sm_name	sm_lincs_id	sm_alternative_name	sm_pubchem_cid	sm_inchi_parent	sm_inchi_key_parent	sm_smiles_parent	sm_center_name	sm_center_canonical_id	sm_center_batch_id	sm_provider_name	sm_provider_catalog_id	sm_provider_batch_id	sm_salt	sm_smiles_batch	sm_inchi_batch	sm_inchi_key_batch	sm_molecular_mass	sm_purity	sm_purity_method	sm_aqueous_solubility	sm_logp	sm_alternative_id	sm_relevant_citations	sm_chebi_id
BRD-K51933590	LSM-17824		54634039	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19-,25+/m0/s1	AMXKABWGEBMLDF-XHNVNVPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CC4CCCC4)C[C@@H]1C	BroadT	BRD-K51933590	BRD-K51933590-001-01-9	Broad Institute of MIT and Harvard	BRD-K51933590			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CC2CCCC2)C[C@@H]1C	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19-,25+/m0/s1	AMXKABWGEBMLDF-XHNVNVPESA-N	471.309706822							106465
BRD-K17686226	LSM-17825		54633859	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-8-15(21-14(3)23)6-7-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13-,18+/m1/s1	PEWYMSZXRIJNLE-VFVRVIDISA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K17686226	BRD-K17686226-001-01-8	Broad Institute of MIT and Harvard	BRD-K17686226			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-8-15(21-14(3)23)6-7-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13-,18+/m1/s1	PEWYMSZXRIJNLE-VFVRVIDISA-N	363.215806438							106466
BRD-K58041870	LSM-17826		54633993	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17+,21+/m0/s1	DYVIHJNOYXUPHK-CSODHUTKSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	BroadT	BRD-K58041870	BRD-K58041870-001-01-5	Broad Institute of MIT and Harvard	BRD-K58041870			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17+,21+/m0/s1	DYVIHJNOYXUPHK-CSODHUTKSA-N	498.251205666							106467
BRD-K72050226	LSM-17827		54634070	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26+/m1/s1	FNWJNXZWDLFJNZ-GOHWNWGWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc4ccccc4)C[C@H]1C	BroadT	BRD-K72050226	BRD-K72050226-001-01-9	Broad Institute of MIT and Harvard	BRD-K72050226			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc2ccccc2)C[C@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26+/m1/s1	FNWJNXZWDLFJNZ-GOHWNWGWSA-N	479.278406694							106468
BRD-K23776284-001-01-8	LSM-17828	BRD-K23776284	54633990	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17-,21+/m0/s1	DYVIHJNOYXUPHK-XGHQBKJUSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	BroadT	BRD-K23776284	BRD-K23776284-001-01-8	Broad Institute of MIT and Harvard	BRD-K23776284			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17-,21+/m0/s1	DYVIHJNOYXUPHK-XGHQBKJUSA-N	498.251205666							106469
BRD-K77032979	LSM-17829		54633826	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18+,24-/m1/s1	UCVRUKRGUKDLJG-NXMSCROESA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K77032979	BRD-K77032979-001-01-1	Broad Institute of MIT and Harvard	BRD-K77032979			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18+,24-/m1/s1	UCVRUKRGUKDLJG-NXMSCROESA-N	515.243164038							106470
BRD-K89476396	LSM-17830		54633883	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19+,25+/m1/s1	JVEUQFVGQSVVLY-WYEJZRMESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K89476396	BRD-K89476396-001-01-1	Broad Institute of MIT and Harvard	BRD-K89476396			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19+,25+/m1/s1	JVEUQFVGQSVVLY-WYEJZRMESA-N	580.212233344							106471
BRD-K73227372	LSM-17831		54634079	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	GKKKBEGITMWCFG-YZZKKUAISA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3cncnc3)[C@H](C)COc2c1	BroadT	BRD-K73227372	BRD-K73227372-001-01-4	Broad Institute of MIT and Harvard	BRD-K73227372			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	GKKKBEGITMWCFG-YZZKKUAISA-N	469.26890465							106472
BRD-K35639494	LSM-17832		54633852	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24-/m1/s1	VNWCVAVKLIIMGX-YDIMBITNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K35639494	BRD-K35639494-001-01-0	Broad Institute of MIT and Harvard	BRD-K35639494			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24-/m1/s1	VNWCVAVKLIIMGX-YDIMBITNSA-N	489.22974194							106473
BRD-K05096562	LSM-17833		54634015	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17+,22-/m1/s1	QEZINBTXCCLULH-HYFFOGBASA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K05096562	BRD-K05096562-001-01-6	Broad Institute of MIT and Harvard	BRD-K05096562			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17+,22-/m1/s1	QEZINBTXCCLULH-HYFFOGBASA-N	499.243083826							106474
BRD-K77601667	LSM-17834		54634128	InChI=1S/C22H37N3O5S/c1-7-11-25-13-16(3)21(29-6)14-24(5)22(26)19-12-18(23-31(27,28)8-2)9-10-20(19)30-15-17(25)4/h9-10,12,16-17,21,23H,7-8,11,13-15H2,1-6H3/t16-,17+,21+/m0/s1	IIWCVUJRFUKBIA-CSODHUTKSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@H]1C)OC	BroadT	BRD-K77601667	BRD-K77601667-001-01-0	Broad Institute of MIT and Harvard	BRD-K77601667			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@H]1C)OC	InChI=1S/C22H37N3O5S/c1-7-11-25-13-16(3)21(29-6)14-24(5)22(26)19-12-18(23-31(27,28)8-2)9-10-20(19)30-15-17(25)4/h9-10,12,16-17,21,23H,7-8,11,13-15H2,1-6H3/t16-,17+,21+/m0/s1	IIWCVUJRFUKBIA-CSODHUTKSA-N	455.245392004							106475
BRD-K96925976	LSM-17835		54633894	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21-/m1/s1	RPMIXOPEMBQBTD-CBGDNZLLSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K96925976	BRD-K96925976-001-01-6	Broad Institute of MIT and Harvard	BRD-K96925976			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H]1C)OC	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21-/m1/s1	RPMIXOPEMBQBTD-CBGDNZLLSA-N	462.284220356							106476
BRD-K16879434	LSM-17836		54633845	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24-/m1/s1	VNWCVAVKLIIMGX-KHCICDEESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K16879434	BRD-K16879434-001-01-8	Broad Institute of MIT and Harvard	BRD-K16879434			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24-/m1/s1	VNWCVAVKLIIMGX-KHCICDEESA-N	489.22974194							106477
BRD-K34382498	LSM-17837		54633926	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-8-7-15(20-30(5,24)25)9-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18+/m0/s1	JGILLHKCGZDGGM-PMUMKWKESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)C	BroadT	BRD-K34382498	BRD-K34382498-001-01-4	Broad Institute of MIT and Harvard	BRD-K34382498			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)S(C)(=O)=O	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-8-7-15(20-30(5,24)25)9-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18+/m0/s1	JGILLHKCGZDGGM-PMUMKWKESA-N	477.160341742							106478
BRD-K44492160	LSM-17838		54633829	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20-,25-/m1/s1	VGEAOMRMXWKHAS-UMEGOILYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K44492160	BRD-K44492160-001-01-6	Broad Institute of MIT and Harvard	BRD-K44492160			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20-,25-/m1/s1	VGEAOMRMXWKHAS-UMEGOILYSA-N	546.251205666							106479
BRD-K50713036	LSM-17839		54634020	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m0/s1	PYPDZGGBRRHRLK-XLNZFTOWSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)Cc3ccccn3	BroadT	BRD-K50713036	BRD-K50713036-001-01-8	Broad Institute of MIT and Harvard	BRD-K50713036			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)Cc2ccccn2)c1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m0/s1	PYPDZGGBRRHRLK-XLNZFTOWSA-N	512.263484912							131243
BRD-K25512917-001-01-0	LSM-17840	BRD-K25512917	54633967	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20-,26-/m1/s1	UBWMIYXJQVYFAA-XMERXJNXSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K25512917	BRD-K25512917-001-01-0	Broad Institute of MIT and Harvard	BRD-K25512917			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20-,26-/m1/s1	UBWMIYXJQVYFAA-XMERXJNXSA-N	499.284634926							106482
BRD-K45185240	LSM-17841		54633885	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19-,25-/m0/s1	JVEUQFVGQSVVLY-MHPIHPPYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K45185240	BRD-K45185240-001-01-9	Broad Institute of MIT and Harvard	BRD-K45185240			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19-,25-/m0/s1	JVEUQFVGQSVVLY-MHPIHPPYSA-N	580.212233344							106483
BRD-K74873856	LSM-17842		54633986	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m0/s1	NSJHBAKZFARZIY-DEYYWGMASA-N	CCC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K74873856	BRD-K74873856-001-01-9	Broad Institute of MIT and Harvard	BRD-K74873856			CCC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m0/s1	NSJHBAKZFARZIY-DEYYWGMASA-N	377.231456502							106484
BRD-K93051667	LSM-17843		54634107	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20-,26+/m0/s1	UCVSNTHCJARTNZ-CUVVAGTFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H](C)N(Cc4cccc(F)c4)C[C@@H]1C	BroadT	BRD-K93051667	BRD-K93051667-001-01-8	Broad Institute of MIT and Harvard	BRD-K93051667			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H](C)N(Cc2cccc(F)c2)C[C@@H]1C	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20-,26+/m0/s1	UCVSNTHCJARTNZ-CUVVAGTFSA-N	573.242118192							106485
BRD-K21635266	LSM-17844		54634078	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	GKKKBEGITMWCFG-STSQHVNTSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3cncnc3)[C@@H](C)COc2c1	BroadT	BRD-K21635266	BRD-K21635266-001-01-0	Broad Institute of MIT and Harvard	BRD-K21635266			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	GKKKBEGITMWCFG-STSQHVNTSA-N	469.26890465							106486
BRD-K52833964	LSM-17845		54634052	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26-/m0/s1	LAJHXMOWUUWHRC-UNVFRBQDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K52833964	BRD-K52833964-001-01-8	Broad Institute of MIT and Harvard	BRD-K52833964			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26-/m0/s1	LAJHXMOWUUWHRC-UNVFRBQDSA-N	500.336255928							106487
BRD-K19710723	LSM-17846		54633850	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24-/m0/s1	VNWCVAVKLIIMGX-JXQFQVJHSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K19710723	BRD-K19710723-001-01-2	Broad Institute of MIT and Harvard	BRD-K19710723			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24-/m0/s1	VNWCVAVKLIIMGX-JXQFQVJHSA-N	489.22974194							106488
BRD-K49847771	LSM-17847		54633991	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17+,21+/m1/s1	DYVIHJNOYXUPHK-WWMYMODYSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	BroadT	BRD-K49847771	BRD-K49847771-001-01-7	Broad Institute of MIT and Harvard	BRD-K49847771			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17+,21+/m1/s1	DYVIHJNOYXUPHK-WWMYMODYSA-N	498.251205666							106489
BRD-K62650632	LSM-17848		54633828	InChI=1S/C30H35ClN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21-,28-/m1/s1	ZGOWVEAQAYRRCO-UMQWNRPGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(Cl)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K62650632	BRD-K62650632-001-01-6	Broad Institute of MIT and Harvard	BRD-K62650632			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(Cl)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C30H35ClN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21-,28-/m1/s1	ZGOWVEAQAYRRCO-UMQWNRPGSA-N	614.19658328							106490
BRD-K18181387	LSM-17849		54634126	InChI=1S/C22H37N3O5S/c1-7-11-25-13-16(3)21(29-6)14-24(5)22(26)19-12-18(23-31(27,28)8-2)9-10-20(19)30-15-17(25)4/h9-10,12,16-17,21,23H,7-8,11,13-15H2,1-6H3/t16-,17+,21+/m1/s1	IIWCVUJRFUKBIA-WWMYMODYSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K18181387	BRD-K18181387-001-01-4	Broad Institute of MIT and Harvard	BRD-K18181387			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	InChI=1S/C22H37N3O5S/c1-7-11-25-13-16(3)21(29-6)14-24(5)22(26)19-12-18(23-31(27,28)8-2)9-10-20(19)30-15-17(25)4/h9-10,12,16-17,21,23H,7-8,11,13-15H2,1-6H3/t16-,17+,21+/m1/s1	IIWCVUJRFUKBIA-WWMYMODYSA-N	455.245392004							106491
BRD-K76812105	LSM-17850		54634051	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20-,26-/m0/s1	LAJHXMOWUUWHRC-DYLHXGEVSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K76812105	BRD-K76812105-001-01-4	Broad Institute of MIT and Harvard	BRD-K76812105			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20-,26-/m0/s1	LAJHXMOWUUWHRC-DYLHXGEVSA-N	500.336255928							106492
BRD-K02987495	LSM-17851		54634105	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20-,26-/m1/s1	UCVSNTHCJARTNZ-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc4cccc(F)c4)C[C@H]1C	BroadT	BRD-K02987495	BRD-K02987495-001-01-1	Broad Institute of MIT and Harvard	BRD-K02987495			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc2cccc(F)c2)C[C@H]1C	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20-,26-/m1/s1	UCVSNTHCJARTNZ-XMERXJNXSA-N	573.242118192							106493
BRD-K60936420	LSM-17852		54634026	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19-,24+/m1/s1	LZTQTXILMDYHIK-IECBHUPTSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K60936420	BRD-K60936420-001-01-7	Broad Institute of MIT and Harvard	BRD-K60936420			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19-,24+/m1/s1	LZTQTXILMDYHIK-IECBHUPTSA-N	498.295453756							106494
BRD-K23442578	LSM-17853		54633830	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20-,25+/m1/s1	VGEAOMRMXWKHAS-FHAGJXEFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K23442578	BRD-K23442578-001-01-2	Broad Institute of MIT and Harvard	BRD-K23442578			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20-,25+/m1/s1	VGEAOMRMXWKHAS-FHAGJXEFSA-N	546.251205666							106495
BRD-K52194153	LSM-17854		54634000	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)27-12-15(2)21(31-6)13-26(5)22(29)19-11-18(25-17(4)28)8-9-20(19)32-14-16(27)3/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H,24,30)(H,25,28)/t15-,16-,21+/m0/s1	ISTJSGUPMUQIIL-CKJXQJPGSA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K52194153	BRD-K52194153-001-01-6	Broad Institute of MIT and Harvard	BRD-K52194153			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)27-12-15(2)21(31-6)13-26(5)22(29)19-11-18(25-17(4)28)8-9-20(19)32-14-16(27)3/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H,24,30)(H,25,28)/t15-,16-,21+/m0/s1	ISTJSGUPMUQIIL-CKJXQJPGSA-N	448.268570292							106496
BRD-K74363294	LSM-17855		54634088	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24-/m0/s1	BDMDWUGESBMSSG-RHGYRFJNSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H]1C)OC	BroadT	BRD-K74363294	BRD-K74363294-001-01-1	Broad Institute of MIT and Harvard	BRD-K74363294			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H]1C)OC	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24-/m0/s1	BDMDWUGESBMSSG-RHGYRFJNSA-N	514.25914846							106497
BRD-K47535493	LSM-17856		54634119	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m1/s1	VAJTWMVZCANAHM-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K47535493	BRD-K47535493-001-01-7	Broad Institute of MIT and Harvard	BRD-K47535493			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m1/s1	VAJTWMVZCANAHM-PNCHPQGNSA-N	445.294056758							106498
BRD-K97867712	LSM-17857		54633896	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21+/m1/s1	RPMIXOPEMBQBTD-WWMYMODYSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K97867712	BRD-K97867712-001-01-8	Broad Institute of MIT and Harvard	BRD-K97867712			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H]1C)OC	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21+/m1/s1	RPMIXOPEMBQBTD-WWMYMODYSA-N	462.284220356							106499
BRD-K76087207	LSM-17858		54634067	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	UUMXXNLKKOYIII-IEGUWTFLSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K76087207	BRD-K76087207-001-01-0	Broad Institute of MIT and Harvard	BRD-K76087207			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	UUMXXNLKKOYIII-IEGUWTFLSA-N	498.247834848							106500
BRD-K03265347	LSM-17859		54633907	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17+,22-/m1/s1	JUIHLWHRNYURSY-HYFFOGBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K03265347	BRD-K03265347-001-01-1	Broad Institute of MIT and Harvard	BRD-K03265347			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17+,22-/m1/s1	JUIHLWHRNYURSY-HYFFOGBASA-N	474.284220356							106501
BRD-K98086832	LSM-17860		54634116	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m0/s1	BTNLJZNTSQHFEG-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K98086832	BRD-K98086832-001-01-9	Broad Institute of MIT and Harvard	BRD-K98086832			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m0/s1	BTNLJZNTSQHFEG-MFEFFIJZSA-N	488.219033286							106502
BRD-K21332842	LSM-17861		54633842	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19-/m0/s1	LLKOVVHLWKWLBT-DOXZYTNZSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K21332842	BRD-K21332842-001-01-7	Broad Institute of MIT and Harvard	BRD-K21332842			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19-/m0/s1	LLKOVVHLWKWLBT-DOXZYTNZSA-N	455.209006496							106503
BRD-K18084996	LSM-17862		54634010	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17-,22+/m0/s1	QEZINBTXCCLULH-PNLZDCPESA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K18084996	BRD-K18084996-001-01-3	Broad Institute of MIT and Harvard	BRD-K18084996			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17-,22+/m0/s1	QEZINBTXCCLULH-PNLZDCPESA-N	499.243083826							106504
BRD-K47841020	LSM-17863		54634123	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m0/s1	VAJTWMVZCANAHM-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K47841020	BRD-K47841020-001-01-1	Broad Institute of MIT and Harvard	BRD-K47841020			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m0/s1	VAJTWMVZCANAHM-IXFSTUDKSA-N	445.294056758							106505
BRD-K60678662	LSM-17864		54634135	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22+,27+/m0/s1	DDLXNYQUNGDADK-OREGWCPLSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K60678662	BRD-K60678662-001-01-2	Broad Institute of MIT and Harvard	BRD-K60678662			CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22+,27+/m0/s1	DDLXNYQUNGDADK-OREGWCPLSA-N	495.309706822							106506
BRD-K57516590	LSM-17865		54633897	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21+/m1/s1	RPMIXOPEMBQBTD-LZJOCLMNSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K57516590	BRD-K57516590-001-01-6	Broad Institute of MIT and Harvard	BRD-K57516590			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H]1C)OC	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21+/m1/s1	RPMIXOPEMBQBTD-LZJOCLMNSA-N	462.284220356							106507
BRD-K45916030	LSM-17866		54634082	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	GKKKBEGITMWCFG-IEGUWTFLSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3cncnc3)[C@@H](C)COc2c1	BroadT	BRD-K45916030	BRD-K45916030-001-01-1	Broad Institute of MIT and Harvard	BRD-K45916030			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	GKKKBEGITMWCFG-IEGUWTFLSA-N	469.26890465							106508
BRD-K34445094	LSM-17867		54633958	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	YNBGRPLIUXSJPN-DFIYOIEZSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K34445094	BRD-K34445094-001-01-7	Broad Institute of MIT and Harvard	BRD-K34445094			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	YNBGRPLIUXSJPN-DFIYOIEZSA-N	467.278406694							106509
BRD-K63086103	LSM-17868		54634061	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	UUMXXNLKKOYIII-PMAPCBKXSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K63086103	BRD-K63086103-001-01-2	Broad Institute of MIT and Harvard	BRD-K63086103			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	UUMXXNLKKOYIII-PMAPCBKXSA-N	498.247834848							106510
BRD-K08433493	LSM-17869		54634113	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m0/s1	BTNLJZNTSQHFEG-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K08433493	BRD-K08433493-001-01-2	Broad Institute of MIT and Harvard	BRD-K08433493			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m0/s1	BTNLJZNTSQHFEG-YGKZAACZSA-N	488.219033286							106511
BRD-K62781263	LSM-17870		54634014	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17+,22-/m0/s1	QEZINBTXCCLULH-JKSBSHDWSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K62781263	BRD-K62781263-001-01-5	Broad Institute of MIT and Harvard	BRD-K62781263			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17+,22-/m0/s1	QEZINBTXCCLULH-JKSBSHDWSA-N	499.243083826							106512
BRD-K69780027	LSM-17871		54633977	InChI=1S/C24H31N5O5/c1-15-12-29(17(3)30)16(2)14-34-21-10-18(27-23(31)20-11-25-8-9-26-20)6-7-19(21)24(32)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,31)/t15-,16+,22+/m0/s1	OXKAOHVNWAVCBO-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K69780027	BRD-K69780027-001-01-7	Broad Institute of MIT and Harvard	BRD-K69780027			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C24H31N5O5/c1-15-12-29(17(3)30)16(2)14-34-21-10-18(27-23(31)20-11-25-8-9-26-20)6-7-19(21)24(32)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,31)/t15-,16+,22+/m0/s1	OXKAOHVNWAVCBO-WJONJSRFSA-N	469.232519142							106513
BRD-K91593159	LSM-17872		54633882	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19-,25+/m0/s1	JVEUQFVGQSVVLY-XHNVNVPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K91593159	BRD-K91593159-001-01-6	Broad Institute of MIT and Harvard	BRD-K91593159			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19-,25+/m0/s1	JVEUQFVGQSVVLY-XHNVNVPESA-N	580.212233344							106514
BRD-K27194553	LSM-17873		54633938	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20+/m1/s1	PIHZSTWBUFPGGZ-GUXCAODWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K27194553	BRD-K27194553-001-01-4	Broad Institute of MIT and Harvard	BRD-K27194553			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20+/m1/s1	PIHZSTWBUFPGGZ-GUXCAODWSA-N	420.273655672							106515
BRD-K74641261	LSM-17874		54633877	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	LTXUUMGQLHONAZ-GLDPYIMESA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K74641261	BRD-K74641261-001-01-9	Broad Institute of MIT and Harvard	BRD-K74641261			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	LTXUUMGQLHONAZ-GLDPYIMESA-N	468.273655672							106516
BRD-K93484038	LSM-17875		54633933	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15-,19-/m1/s1	LHCHELWHGOXDMN-SPYBWZPUSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(C)[C@H](C)COc2c1	BroadT	BRD-K93484038	BRD-K93484038-001-01-3	Broad Institute of MIT and Harvard	BRD-K93484038			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15-,19-/m1/s1	LHCHELWHGOXDMN-SPYBWZPUSA-N	407.242021186							106517
BRD-K80044183	LSM-17876		54633866	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18+/m1/s1	FTRBQWVEVPNQIS-GLJUWKHASA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K80044183	BRD-K80044183-001-01-3	Broad Institute of MIT and Harvard	BRD-K80044183			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18+/m1/s1	FTRBQWVEVPNQIS-GLJUWKHASA-N	413.198441812							106518
BRD-K82827604	LSM-17877		54633939	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20+/m0/s1	PIHZSTWBUFPGGZ-RZQQEMMASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K82827604	BRD-K82827604-001-01-0	Broad Institute of MIT and Harvard	BRD-K82827604			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20+/m0/s1	PIHZSTWBUFPGGZ-RZQQEMMASA-N	420.273655672							106519
BRD-K51577368	LSM-17878		54634096	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	MPHSNZGGXIVNOW-YDIMBITNSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccncc3)[C@@H](C)COc2c1	BroadT	BRD-K51577368	BRD-K51577368-001-01-4	Broad Institute of MIT and Harvard	BRD-K51577368			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccncc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	MPHSNZGGXIVNOW-YDIMBITNSA-N	484.268570292							106520
BRD-K56950366	LSM-17879		54633910	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13-,17+/m0/s1	VYMZHXXUXXOUBO-GDZNZVCISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K56950366	BRD-K56950366-001-01-0	Broad Institute of MIT and Harvard	BRD-K56950366			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13-,17+/m0/s1	VYMZHXXUXXOUBO-GDZNZVCISA-N	399.182791748							106521
BRD-K25905181	LSM-17880		54634132	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22-,27+/m0/s1	DDLXNYQUNGDADK-BCQCSXDESA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K25905181	BRD-K25905181-001-01-5	Broad Institute of MIT and Harvard	BRD-K25905181			CCCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22-,27+/m0/s1	DDLXNYQUNGDADK-BCQCSXDESA-N	495.309706822							106522
BRD-K80630598	LSM-17881		54634114	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m0/s1	BTNLJZNTSQHFEG-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K80630598	BRD-K80630598-001-01-8	Broad Institute of MIT and Harvard	BRD-K80630598			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m0/s1	BTNLJZNTSQHFEG-QQMNAOGKSA-N	488.219033286							106523
BRD-K05414181	LSM-17882		54633864	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18+/m1/s1	FTRBQWVEVPNQIS-LBTNJELSSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K05414181	BRD-K05414181-001-01-2	Broad Institute of MIT and Harvard	BRD-K05414181			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18+/m1/s1	FTRBQWVEVPNQIS-LBTNJELSSA-N	413.198441812							106524
BRD-K60192542	LSM-17883		54634103	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20+,25-/m0/s1	OXVANDDYVOZFBN-DFIYOIEZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K60192542	BRD-K60192542-001-01-0	Broad Institute of MIT and Harvard	BRD-K60192542			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20+,25-/m0/s1	OXVANDDYVOZFBN-DFIYOIEZSA-N	510.284220356							106525
BRD-K52054012	LSM-17884		54634111	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20+,26-/m1/s1	UCVSNTHCJARTNZ-BVFVYWQFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H](C)N(Cc4cccc(F)c4)C[C@H]1C	BroadT	BRD-K52054012	BRD-K52054012-001-01-3	Broad Institute of MIT and Harvard	BRD-K52054012			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H](C)N(Cc2cccc(F)c2)C[C@H]1C	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20+,26-/m1/s1	UCVSNTHCJARTNZ-BVFVYWQFSA-N	573.242118192							106526
BRD-K67856917	LSM-17885		54633836	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20+,25-/m1/s1	VGEAOMRMXWKHAS-OHUGHZGNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K67856917	BRD-K67856917-001-01-0	Broad Institute of MIT and Harvard	BRD-K67856917			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20+,25-/m1/s1	VGEAOMRMXWKHAS-OHUGHZGNSA-N	546.251205666							106527
BRD-K31747470	LSM-17886		54633915	InChI=1S/C28H33FN4O7S/c1-17-14-33(41(36,37)22-8-6-7-20(29)12-22)18(2)16-39-25-13-21(30-27(34)24-11-19(3)40-31-24)9-10-23(25)28(35)32(4)15-26(17)38-5/h6-13,17-18,26H,14-16H2,1-5H3,(H,30,34)/t17-,18-,26-/m1/s1	ZYYGXPKBDOJORP-UYPAYLBCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c4cccc(F)c4	BroadT	BRD-K31747470	BRD-K31747470-001-01-3	Broad Institute of MIT and Harvard	BRD-K31747470			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c1cccc(F)c1	InChI=1S/C28H33FN4O7S/c1-17-14-33(41(36,37)22-8-6-7-20(29)12-22)18(2)16-39-25-13-21(30-27(34)24-11-19(3)40-31-24)9-10-23(25)28(35)32(4)15-26(17)38-5/h6-13,17-18,26H,14-16H2,1-5H3,(H,30,34)/t17-,18-,26-/m1/s1	ZYYGXPKBDOJORP-UYPAYLBCSA-N	588.205398326							106528
BRD-K02530287	LSM-17887		54634142	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18-,24+/m1/s1	UCVRUKRGUKDLJG-GGUMNFRJSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K02530287	BRD-K02530287-001-01-1	Broad Institute of MIT and Harvard	BRD-K02530287			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H]1C)OC	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18-,24+/m1/s1	UCVRUKRGUKDLJG-GGUMNFRJSA-N	515.243164038							106529
BRD-K62979806	LSM-17888		54633837	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19-/m1/s1	LLKOVVHLWKWLBT-SPYBWZPUSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K62979806	BRD-K62979806-001-01-9	Broad Institute of MIT and Harvard	BRD-K62979806			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19-/m1/s1	LLKOVVHLWKWLBT-SPYBWZPUSA-N	455.209006496							106530
BRD-K31081052	LSM-17889		54634023	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m1/s1	PYPDZGGBRRHRLK-YDIMBITNSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)Cc3ccccn3	BroadT	BRD-K31081052	BRD-K31081052-001-01-3	Broad Institute of MIT and Harvard	BRD-K31081052			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)Cc2ccccn2)c1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m1/s1	PYPDZGGBRRHRLK-YDIMBITNSA-N	512.263484912							106531
BRD-K34739404	LSM-17890		54634121	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m1/s1	VAJTWMVZCANAHM-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K34739404	BRD-K34739404-001-01-8	Broad Institute of MIT and Harvard	BRD-K34739404			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m1/s1	VAJTWMVZCANAHM-STSQHVNTSA-N	445.294056758							106532
BRD-K62329160	LSM-17891		54633949	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17+,22-/m0/s1	VIFILZSBWJHORO-JKSBSHDWSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K62329160	BRD-K62329160-001-01-7	Broad Institute of MIT and Harvard	BRD-K62329160			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17+,22-/m0/s1	VIFILZSBWJHORO-JKSBSHDWSA-N	459.273321314							106533
BRD-K47650707	LSM-17892		54633898	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21+/m0/s1	RPMIXOPEMBQBTD-CSODHUTKSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K47650707	BRD-K47650707-001-01-6	Broad Institute of MIT and Harvard	BRD-K47650707			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H]1C)OC	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21+/m0/s1	RPMIXOPEMBQBTD-CSODHUTKSA-N	462.284220356							106534
BRD-K97540907	LSM-17893		54633863	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-8-15(21-14(3)23)6-7-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18-/m1/s1	PEWYMSZXRIJNLE-FHSNZYRGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K97540907	BRD-K97540907-001-01-6	Broad Institute of MIT and Harvard	BRD-K97540907			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-8-15(21-14(3)23)6-7-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18-/m1/s1	PEWYMSZXRIJNLE-FHSNZYRGSA-N	363.215806438							106535
BRD-K84336660	LSM-17894		54633922	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24-/m0/s1	XAICKZHKLVEFIU-JXQFQVJHSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K84336660	BRD-K84336660-001-01-1	Broad Institute of MIT and Harvard	BRD-K84336660			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24-/m0/s1	XAICKZHKLVEFIU-JXQFQVJHSA-N	496.268570292							106536
BRD-K08311368	LSM-17895		54633906	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17+,22-/m0/s1	JUIHLWHRNYURSY-JKSBSHDWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K08311368	BRD-K08311368-001-01-2	Broad Institute of MIT and Harvard	BRD-K08311368			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17+,22-/m0/s1	JUIHLWHRNYURSY-JKSBSHDWSA-N	474.284220356							106537
BRD-K77890526	LSM-17896		54634032	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18-,24-/m1/s1	UMCPMTYKFZLTFT-QZTZHPFYSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K77890526	BRD-K77890526-001-01-0	Broad Institute of MIT and Harvard	BRD-K77890526			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18-,24-/m1/s1	UMCPMTYKFZLTFT-QZTZHPFYSA-N	499.248249418							106538
BRD-K62807053	LSM-17897		54633923	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24-/m0/s1	XAICKZHKLVEFIU-GLDPYIMESA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K62807053	BRD-K62807053-001-01-2	Broad Institute of MIT and Harvard	BRD-K62807053			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24-/m0/s1	XAICKZHKLVEFIU-GLDPYIMESA-N	496.268570292							106539
BRD-K69520171	LSM-17898		54633983	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m1/s1	NSJHBAKZFARZIY-LBTNJELSSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K69520171	BRD-K69520171-001-01-1	Broad Institute of MIT and Harvard	BRD-K69520171			CCC(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m1/s1	NSJHBAKZFARZIY-LBTNJELSSA-N	377.231456502							106540
BRD-K03194507	LSM-17899		54633843	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19-/m0/s1	LLKOVVHLWKWLBT-KHYOSLBOSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K03194507	BRD-K03194507-001-01-9	Broad Institute of MIT and Harvard	BRD-K03194507			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19-/m0/s1	LLKOVVHLWKWLBT-KHYOSLBOSA-N	455.209006496							106541
BRD-K09261379	LSM-17900		54633955	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	YNBGRPLIUXSJPN-WZOHSFFVSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K09261379	BRD-K09261379-001-01-5	Broad Institute of MIT and Harvard	BRD-K09261379			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	YNBGRPLIUXSJPN-WZOHSFFVSA-N	467.278406694							106542
BRD-K24206299	LSM-17901		54633972	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20-,26-/m0/s1	UBWMIYXJQVYFAA-DYLHXGEVSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K24206299	BRD-K24206299-001-01-8	Broad Institute of MIT and Harvard	BRD-K24206299			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20-,26-/m0/s1	UBWMIYXJQVYFAA-DYLHXGEVSA-N	499.284634926							106543
BRD-K59049030	LSM-17902		54633888	InChI=1S/C24H33N3O5S/c1-16-6-9-20(10-7-16)33(29,30)26-19-8-11-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18-,23+/m1/s1	CPSLRTTUHRJLDR-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K59049030	BRD-K59049030-001-01-4	Broad Institute of MIT and Harvard	BRD-K59049030			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H33N3O5S/c1-16-6-9-20(10-7-16)33(29,30)26-19-8-11-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18-,23+/m1/s1	CPSLRTTUHRJLDR-PNCHPQGNSA-N	475.214091876							106544
BRD-K04712840	LSM-17903		54633976	InChI=1S/C24H31N5O5/c1-15-12-29(17(3)30)16(2)14-34-21-10-18(27-23(31)20-11-25-8-9-26-20)6-7-19(21)24(32)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,31)/t15-,16+,22+/m1/s1	OXKAOHVNWAVCBO-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K04712840	BRD-K04712840-001-01-3	Broad Institute of MIT and Harvard	BRD-K04712840			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C24H31N5O5/c1-15-12-29(17(3)30)16(2)14-34-21-10-18(27-23(31)20-11-25-8-9-26-20)6-7-19(21)24(32)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,31)/t15-,16+,22+/m1/s1	OXKAOHVNWAVCBO-VVBPWWLESA-N	469.232519142							106545
BRD-K66590796	LSM-17904		54633862	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-8-15(21-14(3)23)6-7-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18-/m0/s1	PEWYMSZXRIJNLE-JCGVRSQUSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K66590796	BRD-K66590796-001-01-2	Broad Institute of MIT and Harvard	BRD-K66590796			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-8-15(21-14(3)23)6-7-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18-/m0/s1	PEWYMSZXRIJNLE-JCGVRSQUSA-N	363.215806438							106546
BRD-K03851221	LSM-17905		54633835	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20+,25-/m0/s1	VGEAOMRMXWKHAS-DFIYOIEZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K03851221	BRD-K03851221-001-01-9	Broad Institute of MIT and Harvard	BRD-K03851221			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20+,25-/m0/s1	VGEAOMRMXWKHAS-DFIYOIEZSA-N	546.251205666							106547
BRD-K53771043	LSM-17906		54634083	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24-/m1/s1	BDMDWUGESBMSSG-QZTZHPFYSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H]1C)OC	BroadT	BRD-K53771043	BRD-K53771043-001-01-4	Broad Institute of MIT and Harvard	BRD-K53771043			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H]1C)OC	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24-/m1/s1	BDMDWUGESBMSSG-QZTZHPFYSA-N	514.25914846							106548
BRD-K25982056	LSM-17907		54633984	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m1/s1	NSJHBAKZFARZIY-GLJUWKHASA-N	CCC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K25982056	BRD-K25982056-001-01-6	Broad Institute of MIT and Harvard	BRD-K25982056			CCC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m1/s1	NSJHBAKZFARZIY-GLJUWKHASA-N	377.231456502							106549
BRD-K28846321	LSM-17908		54633944	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m1/s1	VIFILZSBWJHORO-YVHKJVDXSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K28846321	BRD-K28846321-001-01-9	Broad Institute of MIT and Harvard	BRD-K28846321			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m1/s1	VIFILZSBWJHORO-YVHKJVDXSA-N	459.273321314							106550
BRD-K89089981	LSM-17909		54633997	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17+,21-/m1/s1	DYVIHJNOYXUPHK-LLGFUMIMSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	BroadT	BRD-K89089981	BRD-K89089981-001-01-3	Broad Institute of MIT and Harvard	BRD-K89089981			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17+,21-/m1/s1	DYVIHJNOYXUPHK-LLGFUMIMSA-N	498.251205666							106551
BRD-K74779337	LSM-17980		54634139	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18-,24-/m1/s1	UCVRUKRGUKDLJG-QZTZHPFYSA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K74779337	BRD-K74779337-001-01-7	Broad Institute of MIT and Harvard	BRD-K74779337			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H]1C)OC	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18-,24-/m1/s1	UCVRUKRGUKDLJG-QZTZHPFYSA-N	515.243164038							106622
BRD-K27600134	LSM-17981		54634053	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26-/m1/s1	LAJHXMOWUUWHRC-BVFVYWQFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K27600134	BRD-K27600134-001-01-8	Broad Institute of MIT and Harvard	BRD-K27600134			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26-/m1/s1	LAJHXMOWUUWHRC-BVFVYWQFSA-N	500.336255928							106623
BRD-K84586608	LSM-17982		54634101	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20+,25+/m0/s1	OXVANDDYVOZFBN-WZOHSFFVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K84586608	BRD-K84586608-001-01-6	Broad Institute of MIT and Harvard	BRD-K84586608			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20+,25+/m0/s1	OXVANDDYVOZFBN-WZOHSFFVSA-N	510.284220356							106624
BRD-K65789952	LSM-17983		54633959	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	YNBGRPLIUXSJPN-OHUGHZGNSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K65789952	BRD-K65789952-001-01-1	Broad Institute of MIT and Harvard	BRD-K65789952			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	YNBGRPLIUXSJPN-OHUGHZGNSA-N	467.278406694							106625
BRD-K28811650	LSM-17984		54634062	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m0/s1	UUMXXNLKKOYIII-IUKKYPGJSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K28811650	BRD-K28811650-001-01-4	Broad Institute of MIT and Harvard	BRD-K28811650			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m0/s1	UUMXXNLKKOYIII-IUKKYPGJSA-N	498.247834848							106626
BRD-K88128293	LSM-17985		54633827	InChI=1S/C30H38N4O6/c1-20-15-34(16-24-14-27(40-32-24)22-9-7-6-8-10-22)21(2)18-39-26-12-11-23(31-29(35)19-37-4)13-25(26)30(36)33(3)17-28(20)38-5/h6-14,20-21,28H,15-19H2,1-5H3,(H,31,35)/t20-,21-,28-/m1/s1	PRNRGPRWJXZYIE-UMQWNRPGSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cc(on3)c4ccccc4)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K88128293	BRD-K88128293-001-01-3	Broad Institute of MIT and Harvard	BRD-K88128293			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cc(on3)-c3ccccc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C30H38N4O6/c1-20-15-34(16-24-14-27(40-32-24)22-9-7-6-8-10-22)21(2)18-39-26-12-11-23(31-29(35)19-37-4)13-25(26)30(36)33(3)17-28(20)38-5/h6-14,20-21,28H,15-19H2,1-5H3,(H,31,35)/t20-,21-,28-/m1/s1	PRNRGPRWJXZYIE-UMQWNRPGSA-N	550.279134976							106627
BRD-K08941280	LSM-17986		54634017	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m1/s1	PYPDZGGBRRHRLK-IECBHUPTSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)Cc3ccccn3	BroadT	BRD-K08941280	BRD-K08941280-001-01-1	Broad Institute of MIT and Harvard	BRD-K08941280			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)Cc2ccccn2)c1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m1/s1	PYPDZGGBRRHRLK-IECBHUPTSA-N	512.263484912							106628
BRD-K01793276	LSM-17987		54633900	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21-/m0/s1	RPMIXOPEMBQBTD-FVJLSDCUSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K01793276	BRD-K01793276-001-01-9	Broad Institute of MIT and Harvard	BRD-K01793276			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H]1C)OC	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21-/m0/s1	RPMIXOPEMBQBTD-FVJLSDCUSA-N	462.284220356							106629
BRD-K77207661	LSM-17988		54634012	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17+,22+/m0/s1	QEZINBTXCCLULH-GSHUGGBRSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K77207661	BRD-K77207661-001-01-2	Broad Institute of MIT and Harvard	BRD-K77207661			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17+,22+/m0/s1	QEZINBTXCCLULH-GSHUGGBRSA-N	499.243083826							106630
BRD-K50604515	LSM-17989		54634001	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)27-12-15(2)21(31-6)13-26(5)22(29)19-11-18(25-17(4)28)8-9-20(19)32-14-16(27)3/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H,24,30)(H,25,28)/t15-,16+,21+/m0/s1	ISTJSGUPMUQIIL-GCKMJXCFSA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K50604515	BRD-K50604515-001-01-9	Broad Institute of MIT and Harvard	BRD-K50604515			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H]1C)OC	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)27-12-15(2)21(31-6)13-26(5)22(29)19-11-18(25-17(4)28)8-9-20(19)32-14-16(27)3/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H,24,30)(H,25,28)/t15-,16+,21+/m0/s1	ISTJSGUPMUQIIL-GCKMJXCFSA-N	448.268570292							106631
BRD-K17293545	LSM-17990		54633912	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13+,17+/m0/s1	VYMZHXXUXXOUBO-OGHNNQOOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K17293545	BRD-K17293545-001-01-7	Broad Institute of MIT and Harvard	BRD-K17293545			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13+,17+/m0/s1	VYMZHXXUXXOUBO-OGHNNQOOSA-N	399.182791748							106632
BRD-K89362730	LSM-17991		54633879	InChI=1S/C27H37FN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19-,25-/m1/s1	RCFLHALOPPLUJD-MPCDZSKCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K89362730	BRD-K89362730-001-01-8	Broad Institute of MIT and Harvard	BRD-K89362730			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C27H37FN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19-,25-/m1/s1	RCFLHALOPPLUJD-MPCDZSKCSA-N	564.241783834							106633
BRD-K42199095	LSM-17992		54633895	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21+/m0/s1	RPMIXOPEMBQBTD-XGHQBKJUSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K42199095	BRD-K42199095-001-01-9	Broad Institute of MIT and Harvard	BRD-K42199095			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H]1C)OC	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21+/m0/s1	RPMIXOPEMBQBTD-XGHQBKJUSA-N	462.284220356							106634
BRD-K80483148	LSM-17993		54634092	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	MPHSNZGGXIVNOW-AXHZCLLHSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccncc3)[C@@H](C)COc2c1	BroadT	BRD-K80483148	BRD-K80483148-001-01-7	Broad Institute of MIT and Harvard	BRD-K80483148			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccncc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	MPHSNZGGXIVNOW-AXHZCLLHSA-N	484.268570292							106635
BRD-K43918582	LSM-17994		54634065	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m0/s1	UUMXXNLKKOYIII-BSRJHKFKSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K43918582	BRD-K43918582-001-01-1	Broad Institute of MIT and Harvard	BRD-K43918582			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m0/s1	UUMXXNLKKOYIII-BSRJHKFKSA-N	498.247834848							106636
BRD-K82909038	LSM-17995		54634071	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26+/m0/s1	FNWJNXZWDLFJNZ-OUDXUNEISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc4ccccc4)C[C@@H]1C	BroadT	BRD-K82909038	BRD-K82909038-001-01-2	Broad Institute of MIT and Harvard	BRD-K82909038			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc2ccccc2)C[C@@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26+/m0/s1	FNWJNXZWDLFJNZ-OUDXUNEISA-N	479.278406694							106637
BRD-K69355244	LSM-17996		54634109	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20+,26+/m0/s1	UCVSNTHCJARTNZ-OUDXUNEISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc4cccc(F)c4)C[C@@H]1C	BroadT	BRD-K69355244	BRD-K69355244-001-01-5	Broad Institute of MIT and Harvard	BRD-K69355244			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc2cccc(F)c2)C[C@@H]1C	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20+,26+/m0/s1	UCVSNTHCJARTNZ-OUDXUNEISA-N	573.242118192							106638
BRD-K98008739	LSM-17997		54633868	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18-/m1/s1	FTRBQWVEVPNQIS-HBUWYVDXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K98008739	BRD-K98008739-001-01-7	Broad Institute of MIT and Harvard	BRD-K98008739			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18-/m1/s1	FTRBQWVEVPNQIS-HBUWYVDXSA-N	413.198441812							106639
BRD-K11095218	LSM-17998		54634137	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22+,27-/m0/s1	DDLXNYQUNGDADK-XXAUWVGASA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K11095218	BRD-K11095218-001-01-8	Broad Institute of MIT and Harvard	BRD-K11095218			CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22+,27-/m0/s1	DDLXNYQUNGDADK-XXAUWVGASA-N	495.309706822							106640
BRD-K41347678	LSM-17999		54634102	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20-,25-/m0/s1	OXVANDDYVOZFBN-RLSLOFABSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K41347678	BRD-K41347678-001-01-0	Broad Institute of MIT and Harvard	BRD-K41347678			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20-,25-/m0/s1	OXVANDDYVOZFBN-RLSLOFABSA-N	510.284220356							106641
BRD-K11696795	LSM-18000		54634120	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m0/s1	VAJTWMVZCANAHM-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K11696795	BRD-K11696795-001-01-4	Broad Institute of MIT and Harvard	BRD-K11696795			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m0/s1	VAJTWMVZCANAHM-IUKKYPGJSA-N	445.294056758							106642
BRD-K20918933	LSM-18001		54633952	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	YNBGRPLIUXSJPN-FHAGJXEFSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K20918933	BRD-K20918933-001-01-4	Broad Institute of MIT and Harvard	BRD-K20918933			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	YNBGRPLIUXSJPN-FHAGJXEFSA-N	467.278406694							106643
BRD-K60862683	LSM-18002		54634008	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17-,22-/m1/s1	QEZINBTXCCLULH-DRSNIGMVSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K60862683	BRD-K60862683-001-01-7	Broad Institute of MIT and Harvard	BRD-K60862683			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17-,22-/m1/s1	QEZINBTXCCLULH-DRSNIGMVSA-N	499.243083826							106644
BRD-K64132098	LSM-18003		54633873	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	LTXUUMGQLHONAZ-IECBHUPTSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K64132098	BRD-K64132098-001-01-0	Broad Institute of MIT and Harvard	BRD-K64132098			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	LTXUUMGQLHONAZ-IECBHUPTSA-N	468.273655672							106645
BRD-K36725646	LSM-18004		54633920	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24+/m1/s1	XAICKZHKLVEFIU-IMWIBFENSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K36725646	BRD-K36725646-001-01-3	Broad Institute of MIT and Harvard	BRD-K36725646			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24+/m1/s1	XAICKZHKLVEFIU-IMWIBFENSA-N	496.268570292							106646
BRD-K09819684	LSM-18005		54634018	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m0/s1	PYPDZGGBRRHRLK-AXHZCLLHSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)Cc3ccccn3	BroadT	BRD-K09819684	BRD-K09819684-001-01-0	Broad Institute of MIT and Harvard	BRD-K09819684			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)Cc2ccccn2)c1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m0/s1	PYPDZGGBRRHRLK-AXHZCLLHSA-N	512.263484912							106647
BRD-K18688395	LSM-18006		54634080	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	GKKKBEGITMWCFG-PMAPCBKXSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3cncnc3)[C@H](C)COc2c1	BroadT	BRD-K18688395	BRD-K18688395-001-01-8	Broad Institute of MIT and Harvard	BRD-K18688395			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cncnc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	GKKKBEGITMWCFG-PMAPCBKXSA-N	469.26890465							106648
CHEMBL3188824	LSM-18007	BRD-K43142490	54633989	InChI=1S/C31H34F2N4O5/c1-19-16-37(29(38)21-5-7-22(32)8-6-21)20(2)18-42-27-15-25(35-31(40)34-24-11-9-23(33)10-12-24)13-14-26(27)30(39)36(3)17-28(19)41-4/h5-15,19-20,28H,16-18H2,1-4H3,(H2,34,35,40)/t19-,20-,28-/m1/s1	PLOYMQLPWGFRKQ-NCXSOUSFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccc(F)cc4	BroadT	BRD-K43142490	BRD-K43142490-001-01-9	Broad Institute of MIT and Harvard	BRD-K43142490			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccc(F)cc1	InChI=1S/C31H34F2N4O5/c1-19-16-37(29(38)21-5-7-22(32)8-6-21)20(2)18-42-27-15-25(35-31(40)34-24-11-9-23(33)10-12-24)13-14-26(27)30(39)36(3)17-28(19)41-4/h5-15,19-20,28H,16-18H2,1-4H3,(H2,34,35,40)/t19-,20-,28-/m1/s1	PLOYMQLPWGFRKQ-NCXSOUSFSA-N	580.249726628							106649
BRD-K38917645	LSM-18008		54634059	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17+,22-/m0/s1	FTTNYZAODGCOSV-JKSBSHDWSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K38917645	BRD-K38917645-001-01-5	Broad Institute of MIT and Harvard	BRD-K38917645			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17+,22-/m0/s1	FTTNYZAODGCOSV-JKSBSHDWSA-N	459.273321314							106650
BRD-K25387295	LSM-18009		54633985	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m0/s1	NSJHBAKZFARZIY-PMUMKWKESA-N	CCC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K25387295	BRD-K25387295-001-01-9	Broad Institute of MIT and Harvard	BRD-K25387295			CCC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m0/s1	NSJHBAKZFARZIY-PMUMKWKESA-N	377.231456502							106651
BRD-K58715359	LSM-18010		54634043	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19-,25-/m0/s1	AMXKABWGEBMLDF-MHPIHPPYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CC4CCCC4)C[C@@H]1C	BroadT	BRD-K58715359	BRD-K58715359-001-01-4	Broad Institute of MIT and Harvard	BRD-K58715359			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CC2CCCC2)C[C@@H]1C	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19-,25-/m0/s1	AMXKABWGEBMLDF-MHPIHPPYSA-N	471.309706822							106652
BRD-K11781871	LSM-18011		54633994	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17-,21-/m0/s1	DYVIHJNOYXUPHK-FIKGOQFSSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	BroadT	BRD-K11781871	BRD-K11781871-001-01-1	Broad Institute of MIT and Harvard	BRD-K11781871			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17-,21-/m0/s1	DYVIHJNOYXUPHK-FIKGOQFSSA-N	498.251205666							106653
BRD-K26647686	LSM-18012		54634136	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22-,27-/m0/s1	DDLXNYQUNGDADK-BERHBOFZSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K26647686	BRD-K26647686-001-01-2	Broad Institute of MIT and Harvard	BRD-K26647686			CCCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22-,27-/m0/s1	DDLXNYQUNGDADK-BERHBOFZSA-N	495.309706822							106654
BRD-K07689069	LSM-18013		54634144	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18-,24-/m0/s1	UCVRUKRGUKDLJG-XFAGBWLFSA-N	COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K07689069	BRD-K07689069-001-01-4	Broad Institute of MIT and Harvard	BRD-K07689069			COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18-,24-/m0/s1	UCVRUKRGUKDLJG-XFAGBWLFSA-N	515.243164038							106655
BRD-K66039243	LSM-18014		54634034	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18-,24+/m0/s1	UMCPMTYKFZLTFT-LLJLJFOGSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K66039243	BRD-K66039243-001-01-9	Broad Institute of MIT and Harvard	BRD-K66039243			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18-,24+/m0/s1	UMCPMTYKFZLTFT-LLJLJFOGSA-N	499.248249418							106656
BRD-K94903598	LSM-18015		54633875	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m0/s1	LTXUUMGQLHONAZ-JXQFQVJHSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K94903598	BRD-K94903598-001-01-3	Broad Institute of MIT and Harvard	BRD-K94903598			CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m0/s1	LTXUUMGQLHONAZ-JXQFQVJHSA-N	468.273655672							106657
BRD-K09166899	LSM-18016		54634055	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17+,22+/m1/s1	FTTNYZAODGCOSV-JLHGSKIFSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K09166899	BRD-K09166899-001-01-7	Broad Institute of MIT and Harvard	BRD-K09166899			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17+,22+/m1/s1	FTTNYZAODGCOSV-JLHGSKIFSA-N	459.273321314							106658
BRD-K16109630	LSM-18017		54633901	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17-,22+/m1/s1	JUIHLWHRNYURSY-YVHKJVDXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K16109630	BRD-K16109630-001-01-2	Broad Institute of MIT and Harvard	BRD-K16109630			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17-,22+/m1/s1	JUIHLWHRNYURSY-YVHKJVDXSA-N	474.284220356							106659
BRD-K69031148	LSM-18018		54633965	InChI=1S/C27H35N3O6/c1-18-14-30(25(31)17-34-4)19(2)16-36-23-13-21(28-26(32)20-9-7-6-8-10-20)11-12-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,32)/t18-,19+,24-/m1/s1	RXTVBUOGJRMDEF-YDIMBITNSA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K69031148	BRD-K69031148-001-01-9	Broad Institute of MIT and Harvard	BRD-K69031148			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35N3O6/c1-18-14-30(25(31)17-34-4)19(2)16-36-23-13-21(28-26(32)20-9-7-6-8-10-20)11-12-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,32)/t18-,19+,24-/m1/s1	RXTVBUOGJRMDEF-YDIMBITNSA-N	497.25258587							106660
BRD-K04408214	LSM-18019		54633957	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m1/s1	YNBGRPLIUXSJPN-UMEGOILYSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K04408214	BRD-K04408214-001-01-6	Broad Institute of MIT and Harvard	BRD-K04408214			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m1/s1	YNBGRPLIUXSJPN-UMEGOILYSA-N	467.278406694							106661
BRD-K56912308	LSM-18020		54633956	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m0/s1	YNBGRPLIUXSJPN-RLSLOFABSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K56912308	BRD-K56912308-001-01-1	Broad Institute of MIT and Harvard	BRD-K56912308			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m0/s1	YNBGRPLIUXSJPN-RLSLOFABSA-N	467.278406694							106662
BRD-K31721388	LSM-18021		54633992	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17-,21+/m1/s1	DYVIHJNOYXUPHK-LZJOCLMNSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	BroadT	BRD-K31721388	BRD-K31721388-001-01-9	Broad Institute of MIT and Harvard	BRD-K31721388			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17-,21+/m1/s1	DYVIHJNOYXUPHK-LZJOCLMNSA-N	498.251205666							106663
BRD-K13922961	LSM-18022		54633943	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20-/m1/s1	PIHZSTWBUFPGGZ-GQIGUUNPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K13922961	BRD-K13922961-001-01-0	Broad Institute of MIT and Harvard	BRD-K13922961			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20-/m1/s1	PIHZSTWBUFPGGZ-GQIGUUNPSA-N	420.273655672							106664
BRD-K35544244	LSM-18023		54633917	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24-/m1/s1	XAICKZHKLVEFIU-KHCICDEESA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K35544244	BRD-K35544244-001-01-5	Broad Institute of MIT and Harvard	BRD-K35544244			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24-/m1/s1	XAICKZHKLVEFIU-KHCICDEESA-N	496.268570292							106665
BRD-K49923205	LSM-18024		54633846	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24+/m1/s1	VNWCVAVKLIIMGX-IECBHUPTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K49923205	BRD-K49923205-001-01-2	Broad Institute of MIT and Harvard	BRD-K49923205			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24+/m1/s1	VNWCVAVKLIIMGX-IECBHUPTSA-N	489.22974194							106666
BRD-K64135153	LSM-18025		54634143	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18+,24+/m0/s1	UCVRUKRGUKDLJG-HOOSLVGPSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K64135153	BRD-K64135153-001-01-5	Broad Institute of MIT and Harvard	BRD-K64135153			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H]1C)OC	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18+,24+/m0/s1	UCVRUKRGUKDLJG-HOOSLVGPSA-N	515.243164038							106667
BRD-K69740275	LSM-18026		54634094	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m0/s1	MPHSNZGGXIVNOW-XLNZFTOWSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccncc3)[C@H](C)COc2c1	BroadT	BRD-K69740275	BRD-K69740275-001-01-0	Broad Institute of MIT and Harvard	BRD-K69740275			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccncc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m0/s1	MPHSNZGGXIVNOW-XLNZFTOWSA-N	484.268570292							106668
BRD-K75869095	LSM-18027		54633936	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20+/m1/s1	PIHZSTWBUFPGGZ-QINHECLXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K75869095	BRD-K75869095-001-01-7	Broad Institute of MIT and Harvard	BRD-K75869095			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20+/m1/s1	PIHZSTWBUFPGGZ-QINHECLXSA-N	420.273655672							106669
BRD-K25039453	LSM-18028		54633911	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13+,17+/m1/s1	VYMZHXXUXXOUBO-IGCXYCKISA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K25039453	BRD-K25039453-001-01-4	Broad Institute of MIT and Harvard	BRD-K25039453			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13+,17+/m1/s1	VYMZHXXUXXOUBO-IGCXYCKISA-N	399.182791748							106670
BRD-K15444424-001-01-4	LSM-18029	BRD-K15444424	54633968	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20-,26+/m0/s1	UBWMIYXJQVYFAA-CUVVAGTFSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K15444424	BRD-K15444424-001-01-4	Broad Institute of MIT and Harvard	BRD-K15444424			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20-,26+/m0/s1	UBWMIYXJQVYFAA-CUVVAGTFSA-N	499.284634926							106671
BRD-K96637144	LSM-18030		54634125	InChI=1S/C22H37N3O5S/c1-7-11-25-13-16(3)21(29-6)14-24(5)22(26)19-12-18(23-31(27,28)8-2)9-10-20(19)30-15-17(25)4/h9-10,12,16-17,21,23H,7-8,11,13-15H2,1-6H3/t16-,17-,21+/m0/s1	IIWCVUJRFUKBIA-XGHQBKJUSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K96637144	BRD-K96637144-001-01-4	Broad Institute of MIT and Harvard	BRD-K96637144			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	InChI=1S/C22H37N3O5S/c1-7-11-25-13-16(3)21(29-6)14-24(5)22(26)19-12-18(23-31(27,28)8-2)9-10-20(19)30-15-17(25)4/h9-10,12,16-17,21,23H,7-8,11,13-15H2,1-6H3/t16-,17-,21+/m0/s1	IIWCVUJRFUKBIA-XGHQBKJUSA-N	455.245392004							106672
BRD-K39247583	LSM-18031		54633913	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13+,17-/m0/s1	VYMZHXXUXXOUBO-AHIWAGSCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K39247583	BRD-K39247583-001-01-0	Broad Institute of MIT and Harvard	BRD-K39247583			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13+,17-/m0/s1	VYMZHXXUXXOUBO-AHIWAGSCSA-N	399.182791748							106673
BRD-K84310612	LSM-18032		54634106	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20-,26+/m1/s1	UCVSNTHCJARTNZ-KYTVRQNUSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc4cccc(F)c4)C[C@H]1C	BroadT	BRD-K84310612	BRD-K84310612-001-01-5	Broad Institute of MIT and Harvard	BRD-K84310612			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc2cccc(F)c2)C[C@H]1C	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20-,26+/m1/s1	UCVSNTHCJARTNZ-KYTVRQNUSA-N	573.242118192							106674
BRD-K43029808	LSM-18033		54634035	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18+,24+/m1/s1	UMCPMTYKFZLTFT-YTZAWJCFSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K43029808	BRD-K43029808-001-01-5	Broad Institute of MIT and Harvard	BRD-K43029808			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18+,24+/m1/s1	UMCPMTYKFZLTFT-YTZAWJCFSA-N	499.248249418							106675
BRD-K03489727	LSM-18034		54634064	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	UUMXXNLKKOYIII-YZZKKUAISA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K03489727	BRD-K03489727-001-01-7	Broad Institute of MIT and Harvard	BRD-K03489727			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	UUMXXNLKKOYIII-YZZKKUAISA-N	498.247834848							106676
BRD-K01668149	LSM-18035		54634131	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22-,27-/m1/s1	DDLXNYQUNGDADK-VHFRWLAGSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K01668149	BRD-K01668149-001-01-8	Broad Institute of MIT and Harvard	BRD-K01668149			CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22-,27-/m1/s1	DDLXNYQUNGDADK-VHFRWLAGSA-N	495.309706822							106677
BRD-K72721410	LSM-18036		54633960	InChI=1S/C27H35N3O6/c1-18-14-30(25(31)17-34-4)19(2)16-36-23-13-21(28-26(32)20-9-7-6-8-10-20)11-12-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,32)/t18-,19-,24-/m1/s1	RXTVBUOGJRMDEF-KHCICDEESA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K72721410	BRD-K72721410-001-01-1	Broad Institute of MIT and Harvard	BRD-K72721410			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H35N3O6/c1-18-14-30(25(31)17-34-4)19(2)16-36-23-13-21(28-26(32)20-9-7-6-8-10-20)11-12-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,32)/t18-,19-,24-/m1/s1	RXTVBUOGJRMDEF-KHCICDEESA-N	497.25258587							106678
BRD-K21584435	LSM-18037		54633855	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	XXTDQFHOFKGJNQ-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K21584435	BRD-K21584435-001-01-6	Broad Institute of MIT and Harvard	BRD-K21584435			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	XXTDQFHOFKGJNQ-VVBPWWLESA-N	474.203383222							106679
BRD-K19142902	LSM-18038		54633918	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m1/s1	XAICKZHKLVEFIU-IECBHUPTSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K19142902	BRD-K19142902-001-01-1	Broad Institute of MIT and Harvard	BRD-K19142902			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m1/s1	XAICKZHKLVEFIU-IECBHUPTSA-N	496.268570292							106680
BRD-K86077185	LSM-18039		54633940	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20-/m0/s1	PIHZSTWBUFPGGZ-FTRWYGJKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K86077185	BRD-K86077185-001-01-5	Broad Institute of MIT and Harvard	BRD-K86077185			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20-/m0/s1	PIHZSTWBUFPGGZ-FTRWYGJKSA-N	420.273655672							106681
BRD-K85912419	LSM-18040		54633988	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m1/s1	NSJHBAKZFARZIY-QWQRMKEZSA-N	CCC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K85912419	BRD-K85912419-001-01-2	Broad Institute of MIT and Harvard	BRD-K85912419			CCC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m1/s1	NSJHBAKZFARZIY-QWQRMKEZSA-N	377.231456502							106682
BRD-K95653016	LSM-18041		54634007	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-7-6-10-27-12-19)18(2)15-36-22-11-20(28-24(31)16-34-4)8-9-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	LTGSPNUZXQNZNT-IEGUWTFLSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3cccnc3	BroadT	BRD-K95653016	BRD-K95653016-001-01-7	Broad Institute of MIT and Harvard	BRD-K95653016			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2cccnc2)c1	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-7-6-10-27-12-19)18(2)15-36-22-11-20(28-24(31)16-34-4)8-9-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	LTGSPNUZXQNZNT-IEGUWTFLSA-N	498.247834848							106683
BRD-K36557327	LSM-18042		54633874	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m0/s1	LTXUUMGQLHONAZ-XLNZFTOWSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K36557327	BRD-K36557327-001-01-6	Broad Institute of MIT and Harvard	BRD-K36557327			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m0/s1	LTXUUMGQLHONAZ-XLNZFTOWSA-N	468.273655672							106684
BRD-K14831193	LSM-18043		54633934	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19-/m0/s1	LHCHELWHGOXDMN-KHYOSLBOSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(C)[C@H](C)COc2c1	BroadT	BRD-K14831193	BRD-K14831193-001-01-2	Broad Institute of MIT and Harvard	BRD-K14831193			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19-/m0/s1	LHCHELWHGOXDMN-KHYOSLBOSA-N	407.242021186							106685
BRD-K27945483	LSM-17910		54633831	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20-,25+/m0/s1	VGEAOMRMXWKHAS-ZYLNGJIFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K27945483	BRD-K27945483-001-01-4	Broad Institute of MIT and Harvard	BRD-K27945483			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20-,25+/m0/s1	VGEAOMRMXWKHAS-ZYLNGJIFSA-N	546.251205666							106552
BRD-K93747042	LSM-17911		54634003	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-7-6-10-27-12-19)18(2)15-36-22-11-20(28-24(31)16-34-4)8-9-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	LTGSPNUZXQNZNT-STSQHVNTSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3cccnc3	BroadT	BRD-K93747042	BRD-K93747042-001-01-7	Broad Institute of MIT and Harvard	BRD-K93747042			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2cccnc2)c1	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-7-6-10-27-12-19)18(2)15-36-22-11-20(28-24(31)16-34-4)8-9-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	LTGSPNUZXQNZNT-STSQHVNTSA-N	498.247834848							106553
BRD-K13672060	LSM-17912		54634097	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20-,25-/m1/s1	OXVANDDYVOZFBN-UMEGOILYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K13672060	BRD-K13672060-001-01-1	Broad Institute of MIT and Harvard	BRD-K13672060			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20-,25-/m1/s1	OXVANDDYVOZFBN-UMEGOILYSA-N	510.284220356							106554
BRD-K83801418	LSM-17913		54634047	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20-,26+/m0/s1	LAJHXMOWUUWHRC-CUVVAGTFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K83801418	BRD-K83801418-001-01-0	Broad Institute of MIT and Harvard	BRD-K83801418			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20-,26+/m0/s1	LAJHXMOWUUWHRC-CUVVAGTFSA-N	500.336255928							106555
BRD-K82852523	LSM-17914		54633889	InChI=1S/C24H33N3O5S/c1-16-6-9-20(10-7-16)33(29,30)26-19-8-11-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18-,23+/m0/s1	CPSLRTTUHRJLDR-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K82852523	BRD-K82852523-001-01-6	Broad Institute of MIT and Harvard	BRD-K82852523			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O5S/c1-16-6-9-20(10-7-16)33(29,30)26-19-8-11-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18-,23+/m0/s1	CPSLRTTUHRJLDR-IUKKYPGJSA-N	475.214091876							106556
BRD-K11269634	LSM-17915		54633954	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	YNBGRPLIUXSJPN-RNHFSVANSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K11269634	BRD-K11269634-001-01-5	Broad Institute of MIT and Harvard	BRD-K11269634			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	YNBGRPLIUXSJPN-RNHFSVANSA-N	467.278406694							106557
BRD-K71427375	LSM-17916		54634138	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22+,27-/m1/s1	DDLXNYQUNGDADK-UMTXDNHDSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K71427375	BRD-K71427375-001-01-9	Broad Institute of MIT and Harvard	BRD-K71427375			CCCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22+,27-/m1/s1	DDLXNYQUNGDADK-UMTXDNHDSA-N	495.309706822							106558
BRD-K26161397	LSM-17917		54633928	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-8-7-15(20-30(5,24)25)9-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m1/s1	JGILLHKCGZDGGM-QWQRMKEZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K26161397	BRD-K26161397-001-01-4	Broad Institute of MIT and Harvard	BRD-K26161397			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-8-7-15(20-30(5,24)25)9-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m1/s1	JGILLHKCGZDGGM-QWQRMKEZSA-N	477.160341742							106559
BRD-K90762344	LSM-17918		54634025	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19+,24+/m1/s1	LZTQTXILMDYHIK-IMWIBFENSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K90762344	BRD-K90762344-001-01-4	Broad Institute of MIT and Harvard	BRD-K90762344			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19+,24+/m1/s1	LZTQTXILMDYHIK-IMWIBFENSA-N	498.295453756							106560
BRD-K61973443	LSM-17919		54633860	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-8-15(21-14(3)23)6-7-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18+/m1/s1	PEWYMSZXRIJNLE-VBHSOAQHSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K61973443	BRD-K61973443-001-01-2	Broad Institute of MIT and Harvard	BRD-K61973443			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-8-15(21-14(3)23)6-7-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18+/m1/s1	PEWYMSZXRIJNLE-VBHSOAQHSA-N	363.215806438							106561
BRD-K83569804	LSM-17920		54633909	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13-,17+/m1/s1	VYMZHXXUXXOUBO-XNJGSVPQSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K83569804	BRD-K83569804-001-01-5	Broad Institute of MIT and Harvard	BRD-K83569804			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13-,17+/m1/s1	VYMZHXXUXXOUBO-XNJGSVPQSA-N	399.182791748							106562
BRD-K31608682	LSM-17921		54633981	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m1/s1	NSJHBAKZFARZIY-HBUWYVDXSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K31608682	BRD-K31608682-001-01-1	Broad Institute of MIT and Harvard	BRD-K31608682			CCC(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m1/s1	NSJHBAKZFARZIY-HBUWYVDXSA-N	377.231456502							106563
BRD-K78599344	LSM-17922		54634045	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19+,25-/m1/s1	AMXKABWGEBMLDF-HHJKRLRDSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CC4CCCC4)C[C@H]1C	BroadT	BRD-K78599344	BRD-K78599344-001-01-6	Broad Institute of MIT and Harvard	BRD-K78599344			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CC2CCCC2)C[C@H]1C	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19+,25-/m1/s1	AMXKABWGEBMLDF-HHJKRLRDSA-N	471.309706822							106564
BRD-K90460185	LSM-17923		54634100	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20-,25+/m1/s1	OXVANDDYVOZFBN-FHAGJXEFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K90460185	BRD-K90460185-001-01-7	Broad Institute of MIT and Harvard	BRD-K90460185			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20-,25+/m1/s1	OXVANDDYVOZFBN-FHAGJXEFSA-N	510.284220356							106565
BRD-K09473191	LSM-17924		54634041	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19+,25+/m1/s1	AMXKABWGEBMLDF-WYEJZRMESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CC4CCCC4)C[C@H]1C	BroadT	BRD-K09473191	BRD-K09473191-001-01-2	Broad Institute of MIT and Harvard	BRD-K09473191			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CC2CCCC2)C[C@H]1C	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19+,25+/m1/s1	AMXKABWGEBMLDF-WYEJZRMESA-N	471.309706822							106566
BRD-K31575995	LSM-17925		54634040	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19-,25+/m1/s1	AMXKABWGEBMLDF-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CC4CCCC4)C[C@H]1C	BroadT	BRD-K31575995	BRD-K31575995-001-01-4	Broad Institute of MIT and Harvard	BRD-K31575995			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CC2CCCC2)C[C@H]1C	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19-,25+/m1/s1	AMXKABWGEBMLDF-RRQZXNHTSA-N	471.309706822							106567
BRD-K75961186	LSM-17926		54634022	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m0/s1	PYPDZGGBRRHRLK-GLDPYIMESA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)Cc3ccccn3	BroadT	BRD-K75961186	BRD-K75961186-001-01-2	Broad Institute of MIT and Harvard	BRD-K75961186			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)Cc2ccccn2)c1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m0/s1	PYPDZGGBRRHRLK-GLDPYIMESA-N	512.263484912							106568
BRD-K32043305	LSM-17927		54634019	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m1/s1	PYPDZGGBRRHRLK-IMWIBFENSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)Cc3ccccn3	BroadT	BRD-K32043305	BRD-K32043305-001-01-7	Broad Institute of MIT and Harvard	BRD-K32043305			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)Cc2ccccn2)c1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m1/s1	PYPDZGGBRRHRLK-IMWIBFENSA-N	512.263484912							106569
BRD-K42475945	LSM-17928		54634016	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m1/s1	PYPDZGGBRRHRLK-KHCICDEESA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)Cc3ccccn3	BroadT	BRD-K42475945	BRD-K42475945-001-01-5	Broad Institute of MIT and Harvard	BRD-K42475945			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)Cc2ccccn2)c1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m1/s1	PYPDZGGBRRHRLK-KHCICDEESA-N	512.263484912							106570
BRD-K32319151	LSM-17929		54633947	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22-/m0/s1	VIFILZSBWJHORO-HOIFWPIMSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K32319151	BRD-K32319151-001-01-6	Broad Institute of MIT and Harvard	BRD-K32319151			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22-/m0/s1	VIFILZSBWJHORO-HOIFWPIMSA-N	459.273321314							106571
BRD-K16988512	LSM-17930		54634057	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17+,22+/m0/s1	FTTNYZAODGCOSV-GSHUGGBRSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K16988512	BRD-K16988512-001-01-2	Broad Institute of MIT and Harvard	BRD-K16988512			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17+,22+/m0/s1	FTTNYZAODGCOSV-GSHUGGBRSA-N	459.273321314							106572
BRD-K58933168	LSM-17931		54634011	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17+,22+/m1/s1	QEZINBTXCCLULH-JLHGSKIFSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K58933168	BRD-K58933168-001-01-4	Broad Institute of MIT and Harvard	BRD-K58933168			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17+,22+/m1/s1	QEZINBTXCCLULH-JLHGSKIFSA-N	499.243083826							106573
BRD-K41202439	LSM-17932		54634108	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20+,26+/m1/s1	UCVSNTHCJARTNZ-GOHWNWGWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H](C)N(Cc4cccc(F)c4)C[C@H]1C	BroadT	BRD-K41202439	BRD-K41202439-001-01-7	Broad Institute of MIT and Harvard	BRD-K41202439			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H](C)N(Cc2cccc(F)c2)C[C@H]1C	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20+,26+/m1/s1	UCVSNTHCJARTNZ-GOHWNWGWSA-N	573.242118192							106574
BRD-K19039785	LSM-17933		54634013	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17-,22-/m0/s1	QEZINBTXCCLULH-HOIFWPIMSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K19039785	BRD-K19039785-001-01-1	Broad Institute of MIT and Harvard	BRD-K19039785			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17-,22-/m0/s1	QEZINBTXCCLULH-HOIFWPIMSA-N	499.243083826							106575
BRD-K67941637	LSM-17934		54633849	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24+/m0/s1	VNWCVAVKLIIMGX-XLNZFTOWSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K67941637	BRD-K67941637-001-01-9	Broad Institute of MIT and Harvard	BRD-K67941637			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24+/m0/s1	VNWCVAVKLIIMGX-XLNZFTOWSA-N	489.22974194							106576
BRD-K33640715	LSM-17935		54633951	InChI=1S/C29H43N3O7/c1-19-16-32(28(34)22-9-13-38-14-10-22)20(2)18-39-25-15-23(30-27(33)21-7-11-37-12-8-21)5-6-24(25)29(35)31(3)17-26(19)36-4/h5-6,15,19-22,26H,7-14,16-18H2,1-4H3,(H,30,33)/t19-,20-,26-/m1/s1	SZANDJBIGGWQLC-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CCOCC4	BroadT	BRD-K33640715	BRD-K33640715-001-01-3	Broad Institute of MIT and Harvard	BRD-K33640715			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCOCC1	InChI=1S/C29H43N3O7/c1-19-16-32(28(34)22-9-13-38-14-10-22)20(2)18-39-25-15-23(30-27(33)21-7-11-37-12-8-21)5-6-24(25)29(35)31(3)17-26(19)36-4/h5-6,15,19-22,26H,7-14,16-18H2,1-4H3,(H,30,33)/t19-,20-,26-/m1/s1	SZANDJBIGGWQLC-XMERXJNXSA-N	545.310100746							106577
BRD-K73500518	LSM-17936		54633878	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	LTXUUMGQLHONAZ-YDIMBITNSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K73500518	BRD-K73500518-001-01-9	Broad Institute of MIT and Harvard	BRD-K73500518			CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	LTXUUMGQLHONAZ-YDIMBITNSA-N	468.273655672							106578
BRD-K69158240	LSM-17937		54633833	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20+,25+/m0/s1	VGEAOMRMXWKHAS-WZOHSFFVSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K69158240	BRD-K69158240-001-01-7	Broad Institute of MIT and Harvard	BRD-K69158240			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20+,25+/m0/s1	VGEAOMRMXWKHAS-WZOHSFFVSA-N	546.251205666							106579
BRD-K52532740	LSM-17938		54634104	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20+,25-/m1/s1	OXVANDDYVOZFBN-OHUGHZGNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K52532740	BRD-K52532740-001-01-7	Broad Institute of MIT and Harvard	BRD-K52532740			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20+,25-/m1/s1	OXVANDDYVOZFBN-OHUGHZGNSA-N	510.284220356							106580
BRD-K20184768	LSM-17939		54634112	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m1/s1	BTNLJZNTSQHFEG-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K20184768	BRD-K20184768-001-01-3	Broad Institute of MIT and Harvard	BRD-K20184768			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m1/s1	BTNLJZNTSQHFEG-DGGJZMOXSA-N	488.219033286							106581
BRD-K18345677	LSM-17940		54634087	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24-/m0/s1	BDMDWUGESBMSSG-XFAGBWLFSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H]1C)OC	BroadT	BRD-K18345677	BRD-K18345677-001-01-4	Broad Institute of MIT and Harvard	BRD-K18345677			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24-/m0/s1	BDMDWUGESBMSSG-XFAGBWLFSA-N	514.25914846							106582
BRD-K93927229	LSM-17941		54634118	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18-,23-/m1/s1	VAJTWMVZCANAHM-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K93927229	BRD-K93927229-001-01-0	Broad Institute of MIT and Harvard	BRD-K93927229			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18-,23-/m1/s1	VAJTWMVZCANAHM-PMAPCBKXSA-N	445.294056758							106583
BRD-K92462786	LSM-17942		54633903	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17+,22+/m1/s1	JUIHLWHRNYURSY-JLHGSKIFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K92462786	BRD-K92462786-001-01-4	Broad Institute of MIT and Harvard	BRD-K92462786			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17+,22+/m1/s1	JUIHLWHRNYURSY-JLHGSKIFSA-N	474.284220356							106584
BRD-K74987024	LSM-17943		54634129	InChI=1S/C22H37N3O5S/c1-7-11-25-13-16(3)21(29-6)14-24(5)22(26)19-12-18(23-31(27,28)8-2)9-10-20(19)30-15-17(25)4/h9-10,12,16-17,21,23H,7-8,11,13-15H2,1-6H3/t16-,17+,21-/m0/s1	IIWCVUJRFUKBIA-FVJLSDCUSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@H]1C)OC	BroadT	BRD-K74987024	BRD-K74987024-001-01-4	Broad Institute of MIT and Harvard	BRD-K74987024			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@H]1C)OC	InChI=1S/C22H37N3O5S/c1-7-11-25-13-16(3)21(29-6)14-24(5)22(26)19-12-18(23-31(27,28)8-2)9-10-20(19)30-15-17(25)4/h9-10,12,16-17,21,23H,7-8,11,13-15H2,1-6H3/t16-,17+,21-/m0/s1	IIWCVUJRFUKBIA-FVJLSDCUSA-N	455.245392004							106585
BRD-K39074860	LSM-17944		54633927	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-8-7-15(20-30(5,24)25)9-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18-/m0/s1	JGILLHKCGZDGGM-DEYYWGMASA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)S(=O)(=O)C	BroadT	BRD-K39074860	BRD-K39074860-001-01-2	Broad Institute of MIT and Harvard	BRD-K39074860			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@@H]1C)S(C)(=O)=O	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-8-7-15(20-30(5,24)25)9-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18-/m0/s1	JGILLHKCGZDGGM-DEYYWGMASA-N	477.160341742							106586
BRD-K87080232	LSM-17945		54634081	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	GKKKBEGITMWCFG-IXFSTUDKSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3cncnc3)[C@H](C)COc2c1	BroadT	BRD-K87080232	BRD-K87080232-001-01-1	Broad Institute of MIT and Harvard	BRD-K87080232			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	GKKKBEGITMWCFG-IXFSTUDKSA-N	469.26890465							106587
BRD-K37276417	LSM-17946		54634029	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19+,24-/m0/s1	LZTQTXILMDYHIK-GLDPYIMESA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K37276417	BRD-K37276417-001-01-3	Broad Institute of MIT and Harvard	BRD-K37276417			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19+,24-/m0/s1	LZTQTXILMDYHIK-GLDPYIMESA-N	498.295453756							106588
BRD-K16238077	LSM-17947		54633853	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	XXTDQFHOFKGJNQ-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K16238077	BRD-K16238077-001-01-9	Broad Institute of MIT and Harvard	BRD-K16238077			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	XXTDQFHOFKGJNQ-PONJGIIJSA-N	474.203383222							106589
BRD-K17765399	LSM-17948		54634048	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20-,26+/m1/s1	LAJHXMOWUUWHRC-KYTVRQNUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K17765399	BRD-K17765399-001-01-1	Broad Institute of MIT and Harvard	BRD-K17765399			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20-,26+/m1/s1	LAJHXMOWUUWHRC-KYTVRQNUSA-N	500.336255928							106590
BRD-K10959171	LSM-17949		54634075	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26-/m1/s1	FNWJNXZWDLFJNZ-BVFVYWQFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc4ccccc4)C[C@H]1C	BroadT	BRD-K10959171	BRD-K10959171-001-01-1	Broad Institute of MIT and Harvard	BRD-K10959171			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc2ccccc2)C[C@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26-/m1/s1	FNWJNXZWDLFJNZ-BVFVYWQFSA-N	479.278406694							106591
BRD-K75779523	LSM-17950		54634063	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	UUMXXNLKKOYIII-PNCHPQGNSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K75779523	BRD-K75779523-001-01-0	Broad Institute of MIT and Harvard	BRD-K75779523			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	UUMXXNLKKOYIII-PNCHPQGNSA-N	498.247834848							106592
BRD-K15532741	LSM-17951		54633941	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20-/m1/s1	PIHZSTWBUFPGGZ-JXXFODFXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K15532741	BRD-K15532741-001-01-2	Broad Institute of MIT and Harvard	BRD-K15532741			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20-/m1/s1	PIHZSTWBUFPGGZ-JXXFODFXSA-N	420.273655672							106593
BRD-K09721398	LSM-17952		54634134	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22+,27+/m1/s1	DDLXNYQUNGDADK-VHSZZVNMSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K09721398	BRD-K09721398-001-01-5	Broad Institute of MIT and Harvard	BRD-K09721398			CCCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22+,27+/m1/s1	DDLXNYQUNGDADK-VHSZZVNMSA-N	495.309706822							106594
BRD-K36997940	LSM-17953		54634093	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	MPHSNZGGXIVNOW-IMWIBFENSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccncc3)[C@@H](C)COc2c1	BroadT	BRD-K36997940	BRD-K36997940-001-01-1	Broad Institute of MIT and Harvard	BRD-K36997940			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccncc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	MPHSNZGGXIVNOW-IMWIBFENSA-N	484.268570292							106595
BRD-K22988729	LSM-17954		54633974	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20+,26-/m1/s1	UBWMIYXJQVYFAA-BVFVYWQFSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K22988729	BRD-K22988729-001-01-3	Broad Institute of MIT and Harvard	BRD-K22988729			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20+,26-/m1/s1	UBWMIYXJQVYFAA-BVFVYWQFSA-N	499.284634926							106596
BRD-K30655307	LSM-17955		54633980	InChI=1S/C24H31N5O5/c1-15-12-29(17(3)30)16(2)14-34-21-10-18(27-23(31)20-11-25-8-9-26-20)6-7-19(21)24(32)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,31)/t15-,16+,22-/m1/s1	OXKAOHVNWAVCBO-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K30655307	BRD-K30655307-001-01-8	Broad Institute of MIT and Harvard	BRD-K30655307			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C24H31N5O5/c1-15-12-29(17(3)30)16(2)14-34-21-10-18(27-23(31)20-11-25-8-9-26-20)6-7-19(21)24(32)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,31)/t15-,16+,22-/m1/s1	OXKAOHVNWAVCBO-ZMPRRUGASA-N	469.232519142							106597
BRD-K61383885	LSM-17956		54633848	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24+/m1/s1	VNWCVAVKLIIMGX-IMWIBFENSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K61383885	BRD-K61383885-001-01-9	Broad Institute of MIT and Harvard	BRD-K61383885			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24+/m1/s1	VNWCVAVKLIIMGX-IMWIBFENSA-N	489.22974194							106598
BRD-K64026092	LSM-17957		54633975	InChI=1S/C24H31N5O5/c1-15-12-29(17(3)30)16(2)14-34-21-10-18(27-23(31)20-11-25-8-9-26-20)6-7-19(21)24(32)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,31)/t15-,16-,22+/m1/s1	OXKAOHVNWAVCBO-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K64026092	BRD-K64026092-001-01-0	Broad Institute of MIT and Harvard	BRD-K64026092			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C24H31N5O5/c1-15-12-29(17(3)30)16(2)14-34-21-10-18(27-23(31)20-11-25-8-9-26-20)6-7-19(21)24(32)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,31)/t15-,16-,22+/m1/s1	OXKAOHVNWAVCBO-MCFFVMPBSA-N	469.232519142							106599
BRD-K40361885	LSM-17958		54633872	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	LTXUUMGQLHONAZ-IMWIBFENSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K40361885	BRD-K40361885-001-01-1	Broad Institute of MIT and Harvard	BRD-K40361885			CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	LTXUUMGQLHONAZ-IMWIBFENSA-N	468.273655672							106600
BRD-K96619480	LSM-17959		54634072	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26-/m0/s1	FNWJNXZWDLFJNZ-DYLHXGEVSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc4ccccc4)C[C@@H]1C	BroadT	BRD-K96619480	BRD-K96619480-001-01-4	Broad Institute of MIT and Harvard	BRD-K96619480			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc2ccccc2)C[C@@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26-/m0/s1	FNWJNXZWDLFJNZ-DYLHXGEVSA-N	479.278406694							106601
BRD-K20160406	LSM-17960		54634140	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18-,24+/m0/s1	UCVRUKRGUKDLJG-LLJLJFOGSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K20160406	BRD-K20160406-001-01-1	Broad Institute of MIT and Harvard	BRD-K20160406			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18-,24+/m0/s1	UCVRUKRGUKDLJG-LLJLJFOGSA-N	515.243164038							106602
BRD-K39705203	LSM-17961		54634058	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17-,22-/m0/s1	FTTNYZAODGCOSV-HOIFWPIMSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K39705203	BRD-K39705203-001-01-7	Broad Institute of MIT and Harvard	BRD-K39705203			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17-,22-/m0/s1	FTTNYZAODGCOSV-HOIFWPIMSA-N	459.273321314							106603
BRD-K20530300	LSM-17962		54634091	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	MPHSNZGGXIVNOW-IECBHUPTSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccncc3)[C@H](C)COc2c1	BroadT	BRD-K20530300	BRD-K20530300-001-01-2	Broad Institute of MIT and Harvard	BRD-K20530300			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccncc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	MPHSNZGGXIVNOW-IECBHUPTSA-N	484.268570292							106604
BRD-K67014046	LSM-17963		54634021	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m0/s1	PYPDZGGBRRHRLK-JXQFQVJHSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)Cc3ccccn3	BroadT	BRD-K67014046	BRD-K67014046-001-01-0	Broad Institute of MIT and Harvard	BRD-K67014046			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)Cc2ccccn2)c1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)13-20-8-6-7-11-28-20)19(2)16-37-23-12-21(29-25(32)17-35-4)9-10-22(23)27(34)30(3)15-24(18)36-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m0/s1	PYPDZGGBRRHRLK-JXQFQVJHSA-N	512.263484912							106605
BRD-K26156776	LSM-17964		54633914	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13+,17-/m1/s1	VYMZHXXUXXOUBO-IIYDPXPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K26156776	BRD-K26156776-001-01-5	Broad Institute of MIT and Harvard	BRD-K26156776			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13+,17-/m1/s1	VYMZHXXUXXOUBO-IIYDPXPESA-N	399.182791748							106606
BRD-K99462197	LSM-17965		54633961	InChI=1S/C27H35N3O6/c1-18-14-30(25(31)17-34-4)19(2)16-36-23-13-21(28-26(32)20-9-7-6-8-10-20)11-12-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,32)/t18-,19-,24+/m1/s1	RXTVBUOGJRMDEF-IECBHUPTSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K99462197	BRD-K99462197-001-01-0	Broad Institute of MIT and Harvard	BRD-K99462197			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H35N3O6/c1-18-14-30(25(31)17-34-4)19(2)16-36-23-13-21(28-26(32)20-9-7-6-8-10-20)11-12-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,32)/t18-,19-,24+/m1/s1	RXTVBUOGJRMDEF-IECBHUPTSA-N	497.25258587							106607
BRD-K10571700	LSM-17966		54633948	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22-/m1/s1	VIFILZSBWJHORO-DRSNIGMVSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K10571700	BRD-K10571700-001-01-4	Broad Institute of MIT and Harvard	BRD-K10571700			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22-/m1/s1	VIFILZSBWJHORO-DRSNIGMVSA-N	459.273321314							106608
BRD-K48358706	LSM-17967		54633867	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18+/m0/s1	FTRBQWVEVPNQIS-PMUMKWKESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K48358706	BRD-K48358706-001-01-6	Broad Institute of MIT and Harvard	BRD-K48358706			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18+/m0/s1	FTRBQWVEVPNQIS-PMUMKWKESA-N	413.198441812							106609
BRD-K30674442	LSM-17968		54633856	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m0/s1	XXTDQFHOFKGJNQ-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K30674442	BRD-K30674442-001-01-5	Broad Institute of MIT and Harvard	BRD-K30674442			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m0/s1	XXTDQFHOFKGJNQ-WJONJSRFSA-N	474.203383222							106610
BRD-K35088248	LSM-17969		54633969	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20-,26+/m1/s1	UBWMIYXJQVYFAA-KYTVRQNUSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K35088248	BRD-K35088248-001-01-9	Broad Institute of MIT and Harvard	BRD-K35088248			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20-,26+/m1/s1	UBWMIYXJQVYFAA-KYTVRQNUSA-N	499.284634926							106611
BRD-K98474331	LSM-17970		54634033	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18-,24+/m1/s1	UMCPMTYKFZLTFT-GGUMNFRJSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K98474331	BRD-K98474331-001-01-3	Broad Institute of MIT and Harvard	BRD-K98474331			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18-,24+/m1/s1	UMCPMTYKFZLTFT-GGUMNFRJSA-N	499.248249418							106612
BRD-K97688756	LSM-17971		54634086	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24+/m0/s1	BDMDWUGESBMSSG-HOOSLVGPSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H]1C)OC	BroadT	BRD-K97688756	BRD-K97688756-001-01-5	Broad Institute of MIT and Harvard	BRD-K97688756			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H]1C)OC	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24+/m0/s1	BDMDWUGESBMSSG-HOOSLVGPSA-N	514.25914846							106613
BRD-K57228212	LSM-17972		54633876	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m1/s1	LTXUUMGQLHONAZ-KHCICDEESA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K57228212	BRD-K57228212-001-01-6	Broad Institute of MIT and Harvard	BRD-K57228212			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m1/s1	LTXUUMGQLHONAZ-KHCICDEESA-N	468.273655672							106614
BRD-K50162138	LSM-17973		54634130	InChI=1S/C22H37N3O5S/c1-7-11-25-13-16(3)21(29-6)14-24(5)22(26)19-12-18(23-31(27,28)8-2)9-10-20(19)30-15-17(25)4/h9-10,12,16-17,21,23H,7-8,11,13-15H2,1-6H3/t16-,17+,21-/m1/s1	IIWCVUJRFUKBIA-LLGFUMIMSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K50162138	BRD-K50162138-001-01-5	Broad Institute of MIT and Harvard	BRD-K50162138			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	InChI=1S/C22H37N3O5S/c1-7-11-25-13-16(3)21(29-6)14-24(5)22(26)19-12-18(23-31(27,28)8-2)9-10-20(19)30-15-17(25)4/h9-10,12,16-17,21,23H,7-8,11,13-15H2,1-6H3/t16-,17+,21-/m1/s1	IIWCVUJRFUKBIA-LLGFUMIMSA-N	455.245392004							106615
BRD-K33863933	LSM-17974		54634054	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m0/s1	FTTNYZAODGCOSV-PNLZDCPESA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K33863933	BRD-K33863933-001-01-7	Broad Institute of MIT and Harvard	BRD-K33863933			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m0/s1	FTTNYZAODGCOSV-PNLZDCPESA-N	459.273321314							106616
BRD-K50477983	LSM-17975		54634027	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19-,24+/m0/s1	LZTQTXILMDYHIK-AXHZCLLHSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K50477983	BRD-K50477983-001-01-3	Broad Institute of MIT and Harvard	BRD-K50477983			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19-,24+/m0/s1	LZTQTXILMDYHIK-AXHZCLLHSA-N	498.295453756							106617
BRD-K94888615	LSM-17976		54634076	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	GKKKBEGITMWCFG-PNCHPQGNSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3cncnc3)[C@H](C)COc2c1	BroadT	BRD-K94888615	BRD-K94888615-001-01-5	Broad Institute of MIT and Harvard	BRD-K94888615			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	GKKKBEGITMWCFG-PNCHPQGNSA-N	469.26890465							106618
BRD-K98969488	LSM-17977		54633869	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m0/s1	FTRBQWVEVPNQIS-IYOUNJFTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K98969488	BRD-K98969488-001-01-3	Broad Institute of MIT and Harvard	BRD-K98969488			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m0/s1	FTRBQWVEVPNQIS-IYOUNJFTSA-N	413.198441812							106619
BRD-K17078647	LSM-17978		54633953	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	YNBGRPLIUXSJPN-ZYLNGJIFSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K17078647	BRD-K17078647-001-01-9	Broad Institute of MIT and Harvard	BRD-K17078647			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h7-14,19-20,25H,6,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	YNBGRPLIUXSJPN-ZYLNGJIFSA-N	467.278406694							106620
BRD-K35156336	LSM-17979		54634005	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-7-6-10-27-12-19)18(2)15-36-22-11-20(28-24(31)16-34-4)8-9-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m0/s1	LTGSPNUZXQNZNT-BSRJHKFKSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)c3cccnc3	BroadT	BRD-K35156336	BRD-K35156336-001-01-7	Broad Institute of MIT and Harvard	BRD-K35156336			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2cccnc2)c1	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-7-6-10-27-12-19)18(2)15-36-22-11-20(28-24(31)16-34-4)8-9-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m0/s1	LTGSPNUZXQNZNT-BSRJHKFKSA-N	498.247834848							106621
BRD-K24271020	LSM-15610		54633148	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19-,24+/m1/s1	DRUGZYWRQAVALM-IECBHUPTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H]1C	BroadT	BRD-K24271020	BRD-K24271020-001-01-8	Broad Institute of MIT and Harvard	BRD-K24271020			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19-,24+/m1/s1	DRUGZYWRQAVALM-IECBHUPTSA-N	498.295453756							104245
BRD-K96149826	LSM-15611		54632919	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m0/s1	POIAECOHAGPJOS-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@@H]1C	BroadT	BRD-K96149826	BRD-K96149826-001-01-5	Broad Institute of MIT and Harvard	BRD-K96149826			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m0/s1	POIAECOHAGPJOS-HOOSLVGPSA-N	454.258005608							104246
BRD-K26435104	LSM-15612		54633042	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	FSOYZNCORKLRQF-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K26435104	BRD-K26435104-001-01-6	Broad Institute of MIT and Harvard	BRD-K26435104			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	FSOYZNCORKLRQF-YGKZAACZSA-N	457.237684734							104247
BRD-K30581008	LSM-15613		54632883	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19-,24-/m0/s1	WMGIIIYIYFXVGX-JXQFQVJHSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCOCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K30581008	BRD-K30581008-001-01-8	Broad Institute of MIT and Harvard	BRD-K30581008			CCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCOCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19-,24-/m0/s1	WMGIIIYIYFXVGX-JXQFQVJHSA-N	475.304621442							104248
BRD-K83783925	LSM-15614		54633009	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16-,20+/m0/s1	SSHPSTSVPAJXGJ-TWOQFEAHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K83783925	BRD-K83783925-001-01-6	Broad Institute of MIT and Harvard	BRD-K83783925			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16-,20+/m0/s1	SSHPSTSVPAJXGJ-TWOQFEAHSA-N	479.220239896							104249
BRD-K33997327	LSM-15615		54633045	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	FSOYZNCORKLRQF-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K33997327	BRD-K33997327-001-01-7	Broad Institute of MIT and Harvard	BRD-K33997327			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	FSOYZNCORKLRQF-SAHWJRBASA-N	457.237684734							104250
BRD-K72379955	LSM-15616		54633080	InChI=1S/C23H32F3N3O5/c1-6-21(31)29-11-14(2)19(33-5)12-28(4)22(32)17-8-7-16(9-18(17)34-13-15(29)3)27-20(30)10-23(24,25)26/h7-9,14-15,19H,6,10-13H2,1-5H3,(H,27,30)/t14-,15-,19+/m0/s1	ZGVLQFKGWSMLFX-YZVOILCLSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CC(F)(F)F)cc2OC[C@@H]1C)OC	BroadT	BRD-K72379955	BRD-K72379955-001-01-9	Broad Institute of MIT and Harvard	BRD-K72379955			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CC(F)(F)F)cc2OC[C@@H]1C)OC	InChI=1S/C23H32F3N3O5/c1-6-21(31)29-11-14(2)19(33-5)12-28(4)22(32)17-8-7-16(9-18(17)34-13-15(29)3)27-20(30)10-23(24,25)26/h7-9,14-15,19H,6,10-13H2,1-5H3,(H,27,30)/t14-,15-,19+/m0/s1	ZGVLQFKGWSMLFX-YZVOILCLSA-N	487.229405754							104251
BRD-K91564773	LSM-15617		54633085	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16+,22+/m0/s1	ILZDYFIBDLQWDD-WJONJSRFSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H]1C)OC	BroadT	BRD-K91564773	BRD-K91564773-001-01-3	Broad Institute of MIT and Harvard	BRD-K91564773			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H]1C)OC	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16+,22+/m0/s1	ILZDYFIBDLQWDD-WJONJSRFSA-N	486.247834848							104252
BRD-K99412981	LSM-15618		54633101	InChI=1S/C26H40N4O5/c1-17-13-30(24(31)15-28(3)4)18(2)16-35-22-12-20(27-25(32)19-8-7-9-19)10-11-21(22)26(33)29(5)14-23(17)34-6/h10-12,17-19,23H,7-9,13-16H2,1-6H3,(H,27,32)/t17-,18+,23-/m1/s1	OGUHNRNBJHRPNW-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K99412981	BRD-K99412981-001-01-5	Broad Institute of MIT and Harvard	BRD-K99412981			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C26H40N4O5/c1-17-13-30(24(31)15-28(3)4)18(2)16-35-22-12-20(27-25(32)19-8-7-9-19)10-11-21(22)26(33)29(5)14-23(17)34-6/h10-12,17-19,23H,7-9,13-16H2,1-6H3,(H,27,32)/t17-,18+,23-/m1/s1	OGUHNRNBJHRPNW-IEGUWTFLSA-N	488.29987042							104253
BRD-K38750802	LSM-15619		54632938	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-11-17(22-30(6,26)27)8-9-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20+/m1/s1	GJWLNKOJEVXCCA-GUXCAODWSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K38750802	BRD-K38750802-001-01-9	Broad Institute of MIT and Harvard	BRD-K38750802			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-11-17(22-30(6,26)27)8-9-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20+/m1/s1	GJWLNKOJEVXCCA-GUXCAODWSA-N	441.22974194							104254
BRD-K60127720	LSM-15620		54632900	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m1/s1	JELNQRUVVFGWSZ-IEGUWTFLSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K60127720	BRD-K60127720-001-01-0	Broad Institute of MIT and Harvard	BRD-K60127720			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m1/s1	JELNQRUVVFGWSZ-IEGUWTFLSA-N	445.294056758							104255
BRD-K78866450	LSM-15621		54632976	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18-,25-/m0/s1	UCDDDGMWGBQWAH-RPPIVITFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K78866450	BRD-K78866450-001-01-9	Broad Institute of MIT and Harvard	BRD-K78866450			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18-,25-/m0/s1	UCDDDGMWGBQWAH-RPPIVITFSA-N	526.25914846							104256
BRD-K30145193	LSM-15622		54632980	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18-,23+/m0/s1	ODEBYALMHVNZLV-IUKKYPGJSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)C3CCCC3	BroadT	BRD-K30145193	BRD-K30145193-001-01-7	Broad Institute of MIT and Harvard	BRD-K30145193			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)C2CCCC2)c1	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18-,23+/m0/s1	ODEBYALMHVNZLV-IUKKYPGJSA-N	489.283885998							104257
BRD-K01606969	LSM-15623		54632873	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17-,21+/m1/s1	LWXKGGIJWSHZGV-LZJOCLMNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K01606969	BRD-K01606969-001-01-5	Broad Institute of MIT and Harvard	BRD-K01606969			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17-,21+/m1/s1	LWXKGGIJWSHZGV-LZJOCLMNSA-N	502.276690304							104258
BRD-K17171256	LSM-15624		54632958	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25+/m1/s1	DCHCVUMEJAAHBI-FHAGJXEFSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K17171256	BRD-K17171256-001-01-4	Broad Institute of MIT and Harvard	BRD-K17171256			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25+/m1/s1	DCHCVUMEJAAHBI-FHAGJXEFSA-N	497.300204778							104259
BRD-K85851814	LSM-15625		54632959	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25+/m1/s1	DCHCVUMEJAAHBI-RNHFSVANSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K85851814	BRD-K85851814-001-01-3	Broad Institute of MIT and Harvard	BRD-K85851814			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25+/m1/s1	DCHCVUMEJAAHBI-RNHFSVANSA-N	497.300204778							104260
BRD-K74324157	LSM-15626		54633007	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m0/s1	TVGROYRLGTWDMS-JKSBSHDWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K74324157	BRD-K74324157-001-01-9	Broad Institute of MIT and Harvard	BRD-K74324157			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m0/s1	TVGROYRLGTWDMS-JKSBSHDWSA-N	447.273321314							104261
BRD-K56987307	LSM-15627		54633041	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	FSOYZNCORKLRQF-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K56987307	BRD-K56987307-001-01-4	Broad Institute of MIT and Harvard	BRD-K56987307			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	FSOYZNCORKLRQF-DGGJZMOXSA-N	457.237684734							104262
BRD-K16079077	LSM-15628		54633061	InChI=1S/C26H33N3O8S/c1-16-12-29(25(30)18-6-9-21-23(10-18)37-15-36-21)17(2)14-35-22-11-19(27-38(5,32)33)7-8-20(22)26(31)28(3)13-24(16)34-4/h6-11,16-17,24,27H,12-15H2,1-5H3/t16-,17+,24+/m0/s1	JZGYUICVYOVPMO-OBWXTZQISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K16079077	BRD-K16079077-001-01-7	Broad Institute of MIT and Harvard	BRD-K16079077			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccc2OCOc2c1	InChI=1S/C26H33N3O8S/c1-16-12-29(25(30)18-6-9-21-23(10-18)37-15-36-21)17(2)14-35-22-11-19(27-38(5,32)33)7-8-20(22)26(31)28(3)13-24(16)34-4/h6-11,16-17,24,27H,12-15H2,1-5H3/t16-,17+,24+/m0/s1	JZGYUICVYOVPMO-OBWXTZQISA-N	547.198835736							104263
BRD-K46322281	LSM-15629		54632950	InChI=1S/C28H38N4O5/c1-6-9-26(33)30-22-11-12-24-23(14-22)28(35)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)27(34)15-21-10-7-8-13-29-21/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20-,25-/m1/s1	MKBXFNPKCUJSKG-UMEGOILYSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)Cc3ccccn3	BroadT	BRD-K46322281	BRD-K46322281-001-01-7	Broad Institute of MIT and Harvard	BRD-K46322281			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)Cc1ccccn1	InChI=1S/C28H38N4O5/c1-6-9-26(33)30-22-11-12-24-23(14-22)28(35)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)27(34)15-21-10-7-8-13-29-21/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20-,25-/m1/s1	MKBXFNPKCUJSKG-UMEGOILYSA-N	510.284220356							104264
BRD-K78748401	LSM-15630		54633001	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16+,20-/m1/s1	VUTYSYZKXJFCMD-GQIGUUNPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K78748401	BRD-K78748401-001-01-9	Broad Institute of MIT and Harvard	BRD-K78748401			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16+,20-/m1/s1	VUTYSYZKXJFCMD-GQIGUUNPSA-N	484.235555602							104265
BRD-K94962942	LSM-15631		54632884	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m0/s1	WMGIIIYIYFXVGX-GLDPYIMESA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCOCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K94962942	BRD-K94962942-001-01-2	Broad Institute of MIT and Harvard	BRD-K94962942			CCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCOCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m0/s1	WMGIIIYIYFXVGX-GLDPYIMESA-N	475.304621442							104266
BRD-K94790210	LSM-15632		54633109	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26-/m1/s1	CNFQIZJMIVHXMW-FIAZIHOUSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K94790210	BRD-K94790210-001-01-2	Broad Institute of MIT and Harvard	BRD-K94790210			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26-/m1/s1	CNFQIZJMIVHXMW-FIAZIHOUSA-N	612.246310674							104267
BRD-K59709341	LSM-15633		54633152	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19+,24-/m0/s1	DRUGZYWRQAVALM-GLDPYIMESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H]1C	BroadT	BRD-K59709341	BRD-K59709341-001-01-7	Broad Institute of MIT and Harvard	BRD-K59709341			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19+,24-/m0/s1	DRUGZYWRQAVALM-GLDPYIMESA-N	498.295453756							104268
BRD-K13267130	LSM-15634		54632956	InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25-/m1/s1	ACQKEKFFNOLIKU-HHJKRLRDSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K13267130	BRD-K13267130-001-01-6	Broad Institute of MIT and Harvard	BRD-K13267130			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25-/m1/s1	ACQKEKFFNOLIKU-HHJKRLRDSA-N	500.279883904							104269
CHEMBL2132067	LSM-15635	BRD-K44624253, SID131429426	54633176	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22-/m0/s1	LHXFIZLNBSIVPU-KIMHZCHSSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K44624253	BRD-K44624253-001-01-2	Broad Institute of MIT and Harvard	BRD-K44624253			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22-/m0/s1	LHXFIZLNBSIVPU-KIMHZCHSSA-N	508.1644109							104270
BRD-K15290974	LSM-15636		54632951	InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25+/m0/s1	ACQKEKFFNOLIKU-XHNVNVPESA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K15290974	BRD-K15290974-001-01-5	Broad Institute of MIT and Harvard	BRD-K15290974			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25+/m0/s1	ACQKEKFFNOLIKU-XHNVNVPESA-N	500.279883904							104271
BRD-K01762107	LSM-15637		54633089	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	YJDVPIUPODSEFW-FHAGJXEFSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CC3CCCCC3)[C@H](C)COc2c1	BroadT	BRD-K01762107	BRD-K01762107-001-01-9	Broad Institute of MIT and Harvard	BRD-K01762107			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CCCCC3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	YJDVPIUPODSEFW-FHAGJXEFSA-N	473.325356886							104272
BRD-K79152256	LSM-15638		54633125	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19+/m1/s1	PXLHMJKVTIIEQJ-VCBZYWHSSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K79152256	BRD-K79152256-001-01-9	Broad Institute of MIT and Harvard	BRD-K79152256			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19+/m1/s1	PXLHMJKVTIIEQJ-VCBZYWHSSA-N	406.258005608							104273
BRD-K15615178	LSM-15639		54633098	InChI=1S/C26H40N4O5/c1-17-13-30(24(31)15-28(3)4)18(2)16-35-22-12-20(27-25(32)19-8-7-9-19)10-11-21(22)26(33)29(5)14-23(17)34-6/h10-12,17-19,23H,7-9,13-16H2,1-6H3,(H,27,32)/t17-,18+,23+/m1/s1	OGUHNRNBJHRPNW-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K15615178	BRD-K15615178-001-01-7	Broad Institute of MIT and Harvard	BRD-K15615178			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C26H40N4O5/c1-17-13-30(24(31)15-28(3)4)18(2)16-35-22-12-20(27-25(32)19-8-7-9-19)10-11-21(22)26(33)29(5)14-23(17)34-6/h10-12,17-19,23H,7-9,13-16H2,1-6H3,(H,27,32)/t17-,18+,23+/m1/s1	OGUHNRNBJHRPNW-STSQHVNTSA-N	488.29987042							104274
BRD-K68939871	LSM-15640		54633058	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-6-5-7-22(29)12-20)19(2)17-36-25-13-23(30-27(33)21-8-9-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-19,21,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26-/m1/s1	FZYPJVOXNKMGKY-UYXZNNOOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc4cccc(F)c4)C[C@H]1C	BroadT	BRD-K68939871	BRD-K68939871-001-01-7	Broad Institute of MIT and Harvard	BRD-K68939871			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc2cccc(F)c2)C[C@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-6-5-7-22(29)12-20)19(2)17-36-25-13-23(30-27(33)21-8-9-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-19,21,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26-/m1/s1	FZYPJVOXNKMGKY-UYXZNNOOSA-N	497.268984862							104275
BRD-K33005275	LSM-15641		54632983	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18-,23-/m0/s1	ODEBYALMHVNZLV-BSRJHKFKSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)C3CCCC3	BroadT	BRD-K33005275	BRD-K33005275-001-01-1	Broad Institute of MIT and Harvard	BRD-K33005275			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)C2CCCC2)c1	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18-,23-/m0/s1	ODEBYALMHVNZLV-BSRJHKFKSA-N	489.283885998							104276
BRD-K46015322	LSM-15642		54632934	InChI=1S/C26H39N3O6/c1-6-24(30)29-14-17(2)23(33-5)15-28(4)26(32)21-8-7-20(13-22(21)35-16-18(29)3)27-25(31)19-9-11-34-12-10-19/h7-8,13,17-19,23H,6,9-12,14-16H2,1-5H3,(H,27,31)/t17-,18+,23-/m0/s1	MDHLDPDUZLKUJE-IXFSTUDKSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K46015322	BRD-K46015322-001-01-8	Broad Institute of MIT and Harvard	BRD-K46015322			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	InChI=1S/C26H39N3O6/c1-6-24(30)29-14-17(2)23(33-5)15-28(4)26(32)21-8-7-20(13-22(21)35-16-18(29)3)27-25(31)19-9-11-34-12-10-19/h7-8,13,17-19,23H,6,9-12,14-16H2,1-5H3,(H,27,31)/t17-,18+,23-/m0/s1	MDHLDPDUZLKUJE-IXFSTUDKSA-N	489.283885998							104277
CHEMBL2142647	LSM-15643	BRD-K95537020, SID131429427	54633177	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22-/m1/s1	LHXFIZLNBSIVPU-ZCCHDVMBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K95537020	BRD-K95537020-001-01-6	Broad Institute of MIT and Harvard	BRD-K95537020			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22-/m1/s1	LHXFIZLNBSIVPU-ZCCHDVMBSA-N	508.1644109							104278
BRD-K56893290	LSM-15644		54632893	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17+,21-/m1/s1	WKMZWDZZZDEYCM-LLGFUMIMSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K56893290	BRD-K56893290-001-01-3	Broad Institute of MIT and Harvard	BRD-K56893290			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17+,21-/m1/s1	WKMZWDZZZDEYCM-LLGFUMIMSA-N	462.284220356							104279
BRD-K62692910	LSM-15645		54633034	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19+,25+/m1/s1	YEIJZPFIQUPCSE-WYEJZRMESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(CC3CCCCC3)C[C@H]1C	BroadT	BRD-K62692910	BRD-K62692910-001-01-1	Broad Institute of MIT and Harvard	BRD-K62692910			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19+,25+/m1/s1	YEIJZPFIQUPCSE-WYEJZRMESA-N	459.309706822							104280
BRD-K54134201	LSM-15646		54633111	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17-,23+/m1/s1	YOWCQSGRJVNXNF-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K54134201	BRD-K54134201-001-01-2	Broad Institute of MIT and Harvard	BRD-K54134201			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17-,23+/m1/s1	YOWCQSGRJVNXNF-QZMQVMSPSA-N	459.273321314							104281
BRD-K84073439	LSM-15647		54633168	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16+,21-/m0/s1	ORSJUXOXPPDIAU-MRUHUIDDSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K84073439	BRD-K84073439-001-01-0	Broad Institute of MIT and Harvard	BRD-K84073439			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16+,21-/m0/s1	ORSJUXOXPPDIAU-MRUHUIDDSA-N	448.268570292							104282
BRD-K73894303-001-01-5	LSM-15648	BRD-K73894303	54632869	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17+,21-/m0/s1	HECXZILGRZYZSJ-FVJLSDCUSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K73894303	BRD-K73894303-001-01-5	Broad Institute of MIT and Harvard	BRD-K73894303			CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17+,21-/m0/s1	HECXZILGRZYZSJ-FVJLSDCUSA-N	487.265791262							104283
BRD-K42084582	LSM-15649		54632894	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m0/s1	JELNQRUVVFGWSZ-IUKKYPGJSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K42084582	BRD-K42084582-001-01-3	Broad Institute of MIT and Harvard	BRD-K42084582			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m0/s1	JELNQRUVVFGWSZ-IUKKYPGJSA-N	445.294056758							104284
BRD-K04918285	LSM-15650		54633146	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19-,24-/m1/s1	DRUGZYWRQAVALM-KHCICDEESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H]1C	BroadT	BRD-K04918285	BRD-K04918285-001-01-8	Broad Institute of MIT and Harvard	BRD-K04918285			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19-,24-/m1/s1	DRUGZYWRQAVALM-KHCICDEESA-N	498.295453756							104285
BRD-K73899967	LSM-15651		54633157	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26+/m1/s1	WREZSNUYDZQHHD-GOHWNWGWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K73899967	BRD-K73899967-001-01-1	Broad Institute of MIT and Harvard	BRD-K73899967			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26+/m1/s1	WREZSNUYDZQHHD-GOHWNWGWSA-N	479.278406694							104286
BRD-K32071534	LSM-15652		54633040	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	FSOYZNCORKLRQF-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K32071534	BRD-K32071534-001-01-1	Broad Institute of MIT and Harvard	BRD-K32071534			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	FSOYZNCORKLRQF-HKARXFIJSA-N	457.237684734							104287
BRD-K53443314	LSM-15653		54633164	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21+/m1/s1	ORSJUXOXPPDIAU-ZOCZFRKYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K53443314	BRD-K53443314-001-01-2	Broad Institute of MIT and Harvard	BRD-K53443314			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21+/m1/s1	ORSJUXOXPPDIAU-ZOCZFRKYSA-N	448.268570292							104288
BRD-K59263278	LSM-15654		54632903	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23+/m1/s1	PJDHXRQRCWLMLV-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K59263278	BRD-K59263278-001-01-2	Broad Institute of MIT and Harvard	BRD-K59263278			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23+/m1/s1	PJDHXRQRCWLMLV-QZMQVMSPSA-N	470.252920228							104289
BRD-K04969760	LSM-15655		54633030	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21-/m0/s1	ZSTCKDKDRWVGTF-FVJLSDCUSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@H]1C)OC	BroadT	BRD-K04969760	BRD-K04969760-001-01-5	Broad Institute of MIT and Harvard	BRD-K04969760			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21-/m0/s1	ZSTCKDKDRWVGTF-FVJLSDCUSA-N	435.273321314							104290
BRD-K95111937	LSM-15656		54632901	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23-/m1/s1	PJDHXRQRCWLMLV-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K95111937	BRD-K95111937-001-01-2	Broad Institute of MIT and Harvard	BRD-K95111937			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23-/m1/s1	PJDHXRQRCWLMLV-SEPYTNNBSA-N	470.252920228							104291
BRD-K60076175	LSM-15657		54632932	InChI=1S/C26H39N3O6/c1-6-24(30)29-14-17(2)23(33-5)15-28(4)26(32)21-8-7-20(13-22(21)35-16-18(29)3)27-25(31)19-9-11-34-12-10-19/h7-8,13,17-19,23H,6,9-12,14-16H2,1-5H3,(H,27,31)/t17-,18+,23+/m0/s1	MDHLDPDUZLKUJE-YZZKKUAISA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K60076175	BRD-K60076175-001-01-9	Broad Institute of MIT and Harvard	BRD-K60076175			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	InChI=1S/C26H39N3O6/c1-6-24(30)29-14-17(2)23(33-5)15-28(4)26(32)21-8-7-20(13-22(21)35-16-18(29)3)27-25(31)19-9-11-34-12-10-19/h7-8,13,17-19,23H,6,9-12,14-16H2,1-5H3,(H,27,31)/t17-,18+,23+/m0/s1	MDHLDPDUZLKUJE-YZZKKUAISA-N	489.283885998							104292
BRD-K91516693	LSM-15658		54633124	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15-,19+/m1/s1	PXLHMJKVTIIEQJ-CLCXKQKWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K91516693	BRD-K91516693-001-01-0	Broad Institute of MIT and Harvard	BRD-K91516693			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15-,19+/m1/s1	PXLHMJKVTIIEQJ-CLCXKQKWSA-N	406.258005608							104293
BRD-K96144282	LSM-15659		54633158	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26+/m0/s1	WREZSNUYDZQHHD-OUDXUNEISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K96144282	BRD-K96144282-001-01-3	Broad Institute of MIT and Harvard	BRD-K96144282			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26+/m0/s1	WREZSNUYDZQHHD-OUDXUNEISA-N	479.278406694							104294
BRD-K51364219	LSM-15660		54632946	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22-/m0/s1	NMVKSNPKIBDAFP-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K51364219	BRD-K51364219-001-01-8	Broad Institute of MIT and Harvard	BRD-K51364219			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22-/m0/s1	NMVKSNPKIBDAFP-WCJKSRRJSA-N	443.22203467							104295
CHEMBL3184222	LSM-15661	BRD-K19139070	54633171	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22+/m0/s1	LHXFIZLNBSIVPU-AYSMAOOMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K19139070	BRD-K19139070-001-01-3	Broad Institute of MIT and Harvard	BRD-K19139070			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22+/m0/s1	LHXFIZLNBSIVPU-AYSMAOOMSA-N	508.1644109							104296
BRD-K36798110	LSM-15662		54632877	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17+,21-/m0/s1	LWXKGGIJWSHZGV-FVJLSDCUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K36798110	BRD-K36798110-001-01-7	Broad Institute of MIT and Harvard	BRD-K36798110			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17+,21-/m0/s1	LWXKGGIJWSHZGV-FVJLSDCUSA-N	502.276690304							104297
BRD-K44203030	LSM-15663		54632922	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m1/s1	POIAECOHAGPJOS-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3cccnc3)C[C@H]1C	BroadT	BRD-K44203030	BRD-K44203030-001-01-5	Broad Institute of MIT and Harvard	BRD-K44203030			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m1/s1	POIAECOHAGPJOS-NXMSCROESA-N	454.258005608							104298
BRD-K42754852	LSM-15664		54633013	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16-,20-/m0/s1	SSHPSTSVPAJXGJ-FTRWYGJKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K42754852	BRD-K42754852-001-01-4	Broad Institute of MIT and Harvard	BRD-K42754852			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16-,20-/m0/s1	SSHPSTSVPAJXGJ-FTRWYGJKSA-N	479.220239896							104299
BRD-K88996011	LSM-15665		54633143	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24-/m0/s1	JPQILOCSRFKHEV-UAVUOLJFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccccc3F	BroadT	BRD-K88996011	BRD-K88996011-001-01-4	Broad Institute of MIT and Harvard	BRD-K88996011			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccc1F	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24-/m0/s1	JPQILOCSRFKHEV-UAVUOLJFSA-N	485.232599354							104300
BRD-K30921693	LSM-15666		54632887	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17-,21+/m1/s1	WKMZWDZZZDEYCM-LZJOCLMNSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K30921693	BRD-K30921693-001-01-6	Broad Institute of MIT and Harvard	BRD-K30921693			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17-,21+/m1/s1	WKMZWDZZZDEYCM-LZJOCLMNSA-N	462.284220356							104301
CHEMBL2143548	LSM-15667	BRD-K26063034, SID131429423	54633173	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22+/m1/s1	LHXFIZLNBSIVPU-GTQRCTGISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K26063034	BRD-K26063034-001-01-1	Broad Institute of MIT and Harvard	BRD-K26063034			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22+/m1/s1	LHXFIZLNBSIVPU-GTQRCTGISA-N	508.1644109							104302
BRD-K34700473	LSM-15668		54632965	InChI=1S/C30H40FN3O4/c1-20-16-34(17-22-9-11-24(31)12-10-22)21(2)19-38-27-14-13-25(32-29(35)23-7-5-6-8-23)15-26(27)30(36)33(3)18-28(20)37-4/h9-15,20-21,23,28H,5-8,16-19H2,1-4H3,(H,32,35)/t20-,21-,28-/m1/s1	IPZNZTZAKSLSOU-UMQWNRPGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@@H](C)N(Cc4ccc(F)cc4)C[C@H]1C	BroadT	BRD-K34700473	BRD-K34700473-001-01-6	Broad Institute of MIT and Harvard	BRD-K34700473			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@@H](C)N(Cc2ccc(F)cc2)C[C@H]1C	InChI=1S/C30H40FN3O4/c1-20-16-34(17-22-9-11-24(31)12-10-22)21(2)19-38-27-14-13-25(32-29(35)23-7-5-6-8-23)15-26(27)30(36)33(3)18-28(20)37-4/h9-15,20-21,23,28H,5-8,16-19H2,1-4H3,(H,32,35)/t20-,21-,28-/m1/s1	IPZNZTZAKSLSOU-UMQWNRPGSA-N	525.30028499							104303
BRD-K48827674	LSM-15669		54633161	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26-/m0/s1	WREZSNUYDZQHHD-UNVFRBQDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K48827674	BRD-K48827674-001-01-8	Broad Institute of MIT and Harvard	BRD-K48827674			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26-/m0/s1	WREZSNUYDZQHHD-UNVFRBQDSA-N	479.278406694							104304
BRD-K41604824	LSM-15670		54632970	InChI=1S/C23H31N5O4/c1-15-12-27(3)16(2)14-32-20-10-17(26-22(29)19-11-24-8-9-25-19)6-7-18(20)23(30)28(4)13-21(15)31-5/h6-11,15-16,21H,12-14H2,1-5H3,(H,26,29)/t15-,16+,21-/m0/s1	WHHUAOMDORXOMQ-MRUHUIDDSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K41604824	BRD-K41604824-001-01-7	Broad Institute of MIT and Harvard	BRD-K41604824			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C23H31N5O4/c1-15-12-27(3)16(2)14-32-20-10-17(26-22(29)19-11-24-8-9-25-19)6-7-18(20)23(30)28(4)13-21(15)31-5/h6-11,15-16,21H,12-14H2,1-5H3,(H,26,29)/t15-,16+,21-/m0/s1	WHHUAOMDORXOMQ-MRUHUIDDSA-N	441.237604522							104305
BRD-K28912195	LSM-15671		54633131	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m0/s1	JPYQBBUSLGAIKR-SUNYJGFJSA-N	COCC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K28912195	BRD-K28912195-001-01-2	Broad Institute of MIT and Harvard	BRD-K28912195			COCC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m0/s1	JPYQBBUSLGAIKR-SUNYJGFJSA-N	393.226371122							104306
BRD-K18930370	LSM-15672		54633076	InChI=1S/C31H38N4O7S/c1-21-18-35(30(36)14-23-8-7-13-32-17-23)22(2)20-42-28-15-24(11-12-27(28)31(37)34(3)19-29(21)41-5)33-43(38,39)26-10-6-9-25(16-26)40-4/h6-13,15-17,21-22,29,33H,14,18-20H2,1-5H3/t21-,22-,29+/m0/s1	CTXMNAKEZUVJQX-IHMCZWCLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K18930370	BRD-K18930370-001-01-3	Broad Institute of MIT and Harvard	BRD-K18930370			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc1cccnc1	InChI=1S/C31H38N4O7S/c1-21-18-35(30(36)14-23-8-7-13-32-17-23)22(2)20-42-28-15-24(11-12-27(28)31(37)34(3)19-29(21)41-5)33-43(38,39)26-10-6-9-25(16-26)40-4/h6-13,15-17,21-22,29,33H,14,18-20H2,1-5H3/t21-,22-,29+/m0/s1	CTXMNAKEZUVJQX-IHMCZWCLSA-N	610.246120286							104307
BRD-K89760040	LSM-15673		54633103	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26+/m1/s1	CNFQIZJMIVHXMW-ZENTWMBTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K89760040	BRD-K89760040-001-01-8	Broad Institute of MIT and Harvard	BRD-K89760040			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26+/m1/s1	CNFQIZJMIVHXMW-ZENTWMBTSA-N	612.246310674							104308
BRD-K66700691	LSM-15674		54633023	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	UPGINRWREGYSMW-IXFSTUDKSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K66700691	BRD-K66700691-001-01-3	Broad Institute of MIT and Harvard	BRD-K66700691			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	UPGINRWREGYSMW-IXFSTUDKSA-N	498.247834848							104309
BRD-K72821236	LSM-15675		54633113	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17+,23+/m0/s1	YOWCQSGRJVNXNF-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K72821236	BRD-K72821236-001-01-1	Broad Institute of MIT and Harvard	BRD-K72821236			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17+,23+/m0/s1	YOWCQSGRJVNXNF-YGKZAACZSA-N	459.273321314							104310
BRD-K52119965	LSM-15676		54632899	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m0/s1	JELNQRUVVFGWSZ-IXFSTUDKSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	BroadT	BRD-K52119965	BRD-K52119965-001-01-1	Broad Institute of MIT and Harvard	BRD-K52119965			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m0/s1	JELNQRUVVFGWSZ-IXFSTUDKSA-N	445.294056758							104311
BRD-K06611347	LSM-15677		54632995	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16-,20+/m0/s1	VUTYSYZKXJFCMD-TWOQFEAHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K06611347	BRD-K06611347-001-01-3	Broad Institute of MIT and Harvard	BRD-K06611347			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16-,20+/m0/s1	VUTYSYZKXJFCMD-TWOQFEAHSA-N	484.235555602							104312
BRD-K05253426	LSM-15678		54633008	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m1/s1	TVGROYRLGTWDMS-HYFFOGBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K05253426	BRD-K05253426-001-01-9	Broad Institute of MIT and Harvard	BRD-K05253426			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m1/s1	TVGROYRLGTWDMS-HYFFOGBASA-N	447.273321314							104313
BRD-K20051655	LSM-15679		54632876	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17-,21-/m0/s1	LWXKGGIJWSHZGV-FIKGOQFSSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K20051655	BRD-K20051655-001-01-0	Broad Institute of MIT and Harvard	BRD-K20051655			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17-,21-/m0/s1	LWXKGGIJWSHZGV-FIKGOQFSSA-N	502.276690304							104314
BRD-K85359206	LSM-15680		54632889	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17+,21+/m0/s1	WKMZWDZZZDEYCM-CSODHUTKSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K85359206	BRD-K85359206-001-01-3	Broad Institute of MIT and Harvard	BRD-K85359206			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17+,21+/m0/s1	WKMZWDZZZDEYCM-CSODHUTKSA-N	462.284220356							104315
BRD-K73497584	LSM-15681		54633082	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16-,22+/m1/s1	ILZDYFIBDLQWDD-MCFFVMPBSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H]1C)OC	BroadT	BRD-K73497584	BRD-K73497584-001-01-7	Broad Institute of MIT and Harvard	BRD-K73497584			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H]1C)OC	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16-,22+/m1/s1	ILZDYFIBDLQWDD-MCFFVMPBSA-N	486.247834848							104316
BRD-K91818277	LSM-15682		54633081	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16-,22-/m1/s1	ILZDYFIBDLQWDD-XCGNWRKASA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H]1C)OC	BroadT	BRD-K91818277	BRD-K91818277-001-01-4	Broad Institute of MIT and Harvard	BRD-K91818277			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H]1C)OC	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16-,22-/m1/s1	ILZDYFIBDLQWDD-XCGNWRKASA-N	486.247834848							104317
CHEMBL3185018	LSM-15683	BRD-K11188962	54633174	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22+/m0/s1	LHXFIZLNBSIVPU-SMASLZHESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K11188962	BRD-K11188962-001-01-9	Broad Institute of MIT and Harvard	BRD-K11188962			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22+/m0/s1	LHXFIZLNBSIVPU-SMASLZHESA-N	508.1644109							104318
CHEMBL3183954	LSM-15684	BRD-K90877053	54633175	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22-/m0/s1	LHXFIZLNBSIVPU-DFFLPILJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K90877053	BRD-K90877053-001-01-1	Broad Institute of MIT and Harvard	BRD-K90877053			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22-/m0/s1	LHXFIZLNBSIVPU-DFFLPILJSA-N	508.1644109							104319
BRD-K26423054	LSM-15685		54632964	InChI=1S/C26H36F3N3O6/c1-16-13-32(24(34)18-7-9-37-10-8-18)17(2)15-38-21-6-5-19(30-23(33)12-26(27,28)29)11-20(21)25(35)31(3)14-22(16)36-4/h5-6,11,16-18,22H,7-10,12-15H2,1-4H3,(H,30,33)/t16-,17-,22-/m1/s1	GPEXLPSANWTTMU-DRSNIGMVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CCOCC3	BroadT	BRD-K26423054	BRD-K26423054-001-01-2	Broad Institute of MIT and Harvard	BRD-K26423054			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCOCC1	InChI=1S/C26H36F3N3O6/c1-16-13-32(24(34)18-7-9-37-10-8-18)17(2)15-38-21-6-5-19(30-23(33)12-26(27,28)29)11-20(21)25(35)31(3)14-22(16)36-4/h5-6,11,16-18,22H,7-10,12-15H2,1-4H3,(H,30,33)/t16-,17-,22-/m1/s1	GPEXLPSANWTTMU-DRSNIGMVSA-N	543.255620502							104320
BRD-K50710722	LSM-15686		54633028	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21+/m0/s1	ZSTCKDKDRWVGTF-CSODHUTKSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@H]1C)OC	BroadT	BRD-K50710722	BRD-K50710722-001-01-3	Broad Institute of MIT and Harvard	BRD-K50710722			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21+/m0/s1	ZSTCKDKDRWVGTF-CSODHUTKSA-N	435.273321314							104321
BRD-K58756877	LSM-15687		54632947	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22-/m0/s1	NMVKSNPKIBDAFP-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K58756877	BRD-K58756877-001-01-1	Broad Institute of MIT and Harvard	BRD-K58756877			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22-/m0/s1	NMVKSNPKIBDAFP-DMPWYTOCSA-N	443.22203467							104322
BRD-K89376690	LSM-15688		54632974	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18+,25+/m1/s1	UCDDDGMWGBQWAH-UZEJHQAJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K89376690	BRD-K89376690-001-01-6	Broad Institute of MIT and Harvard	BRD-K89376690			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18+,25+/m1/s1	UCDDDGMWGBQWAH-UZEJHQAJSA-N	526.25914846							104323
BRD-K49721311	LSM-15689		54633070	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27+/m1/s1	HCXQDEKJJPGAJR-BUEREQSYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)N(Cc5cccnc5)C[C@H]1C	BroadT	BRD-K49721311	BRD-K49721311-001-01-1	Broad Institute of MIT and Harvard	BRD-K49721311			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27+/m1/s1	HCXQDEKJJPGAJR-BUEREQSYSA-N	573.24097534							104324
BRD-K42713448	LSM-15690		54632985	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18+,23-/m0/s1	ODEBYALMHVNZLV-IXFSTUDKSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)C3CCCC3	BroadT	BRD-K42713448	BRD-K42713448-001-01-1	Broad Institute of MIT and Harvard	BRD-K42713448			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)C2CCCC2)c1	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18+,23-/m0/s1	ODEBYALMHVNZLV-IXFSTUDKSA-N	489.283885998							104325
BRD-K95153427	LSM-15691		54633068	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27+/m1/s1	HCXQDEKJJPGAJR-GNMOFYLKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)N(Cc5cccnc5)C[C@H]1C	BroadT	BRD-K95153427	BRD-K95153427-001-01-1	Broad Institute of MIT and Harvard	BRD-K95153427			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27+/m1/s1	HCXQDEKJJPGAJR-GNMOFYLKSA-N	573.24097534							104326
BRD-K24178822	LSM-15692		54632874	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17+,21+/m1/s1	LWXKGGIJWSHZGV-WWMYMODYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K24178822	BRD-K24178822-001-01-5	Broad Institute of MIT and Harvard	BRD-K24178822			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17+,21+/m1/s1	LWXKGGIJWSHZGV-WWMYMODYSA-N	502.276690304							104327
BRD-K26863838	LSM-15693		54633062	InChI=1S/C26H33N3O8S/c1-16-12-29(25(30)18-6-9-21-23(10-18)37-15-36-21)17(2)14-35-22-11-19(27-38(5,32)33)7-8-20(22)26(31)28(3)13-24(16)34-4/h6-11,16-17,24,27H,12-15H2,1-5H3/t16-,17-,24-/m0/s1	JZGYUICVYOVPMO-UAVUOLJFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K26863838	BRD-K26863838-001-01-2	Broad Institute of MIT and Harvard	BRD-K26863838			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccc2OCOc2c1	InChI=1S/C26H33N3O8S/c1-16-12-29(25(30)18-6-9-21-23(10-18)37-15-36-21)17(2)14-35-22-11-19(27-38(5,32)33)7-8-20(22)26(31)28(3)13-24(16)34-4/h6-11,16-17,24,27H,12-15H2,1-5H3/t16-,17-,24-/m0/s1	JZGYUICVYOVPMO-UAVUOLJFSA-N	547.198835736							104328
BRD-K29745629	LSM-15694		54633150	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19+,24+/m0/s1	DRUGZYWRQAVALM-XLNZFTOWSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H]1C	BroadT	BRD-K29745629	BRD-K29745629-001-01-1	Broad Institute of MIT and Harvard	BRD-K29745629			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19+,24+/m0/s1	DRUGZYWRQAVALM-XLNZFTOWSA-N	498.295453756							104329
BRD-K93846199	LSM-15695		54633019	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	UPGINRWREGYSMW-PNCHPQGNSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K93846199	BRD-K93846199-001-01-8	Broad Institute of MIT and Harvard	BRD-K93846199			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	UPGINRWREGYSMW-PNCHPQGNSA-N	498.247834848							104330
BRD-K58614056	LSM-15696		54633054	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-6-5-7-22(29)12-20)19(2)17-36-25-13-23(30-27(33)21-8-9-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-19,21,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19-,26+/m0/s1	FZYPJVOXNKMGKY-LZJCXSABSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc4cccc(F)c4)C[C@@H]1C	BroadT	BRD-K58614056	BRD-K58614056-001-01-5	Broad Institute of MIT and Harvard	BRD-K58614056			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc2cccc(F)c2)C[C@@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-6-5-7-22(29)12-20)19(2)17-36-25-13-23(30-27(33)21-8-9-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-19,21,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19-,26+/m0/s1	FZYPJVOXNKMGKY-LZJCXSABSA-N	497.268984862							104331
BRD-K41719231	LSM-15697		54632885	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m1/s1	WMGIIIYIYFXVGX-YDIMBITNSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCOCC3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K41719231	BRD-K41719231-001-01-0	Broad Institute of MIT and Harvard	BRD-K41719231			CCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCOCC3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m1/s1	WMGIIIYIYFXVGX-YDIMBITNSA-N	475.304621442							104332
BRD-K80098154	LSM-15698		54632960	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25+/m0/s1	DCHCVUMEJAAHBI-WZOHSFFVSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K80098154	BRD-K80098154-001-01-4	Broad Institute of MIT and Harvard	BRD-K80098154			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25+/m0/s1	DCHCVUMEJAAHBI-WZOHSFFVSA-N	497.300204778							104333
BRD-K81447429	LSM-15699		54632982	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18+,23+/m0/s1	ODEBYALMHVNZLV-YZZKKUAISA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)C3CCCC3	BroadT	BRD-K81447429	BRD-K81447429-001-01-1	Broad Institute of MIT and Harvard	BRD-K81447429			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)C2CCCC2)c1	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18+,23+/m0/s1	ODEBYALMHVNZLV-YZZKKUAISA-N	489.283885998							104334
BRD-K36539857	LSM-15700		54633035	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19+,25+/m0/s1	YEIJZPFIQUPCSE-OSWQYVSFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@@H]1C	BroadT	BRD-K36539857	BRD-K36539857-001-01-2	Broad Institute of MIT and Harvard	BRD-K36539857			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19+,25+/m0/s1	YEIJZPFIQUPCSE-OSWQYVSFSA-N	459.309706822							104335
BRD-K86104966	LSM-15701		54632940	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-11-17(22-30(6,26)27)8-9-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20-/m0/s1	GJWLNKOJEVXCCA-YRNRMSPPSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K86104966	BRD-K86104966-001-01-2	Broad Institute of MIT and Harvard	BRD-K86104966			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H]1C)OC	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-11-17(22-30(6,26)27)8-9-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20-/m0/s1	GJWLNKOJEVXCCA-YRNRMSPPSA-N	441.22974194							104336
BRD-K28803288	LSM-15702		54633121	InChI=1S/C24H34N4O5S/c1-17-13-28(14-20-8-6-7-11-25-20)18(2)16-33-22-12-19(26-34(5,30)31)9-10-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18+,23+/m0/s1	VKVFXZDQZTZVBL-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H]1C	BroadT	BRD-K28803288	BRD-K28803288-001-01-1	Broad Institute of MIT and Harvard	BRD-K28803288			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C24H34N4O5S/c1-17-13-28(14-20-8-6-7-11-25-20)18(2)16-33-22-12-19(26-34(5,30)31)9-10-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18+,23+/m0/s1	VKVFXZDQZTZVBL-YZZKKUAISA-N	490.224990918							104337
BRD-K61354976	LSM-15703		54632904	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23+/m1/s1	PJDHXRQRCWLMLV-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K61354976	BRD-K61354976-001-01-0	Broad Institute of MIT and Harvard	BRD-K61354976			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23+/m1/s1	PJDHXRQRCWLMLV-DGGJZMOXSA-N	470.252920228							104338
BRD-K52566202	LSM-15704		54633139	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24+/m1/s1	JPQILOCSRFKHEV-OJLQRUNKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccccc3F	BroadT	BRD-K52566202	BRD-K52566202-001-01-6	Broad Institute of MIT and Harvard	BRD-K52566202			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1F	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24+/m1/s1	JPQILOCSRFKHEV-OJLQRUNKSA-N	485.232599354							104339
BRD-K03090859	LSM-15705		54633074	InChI=1S/C31H38N4O7S/c1-21-18-35(30(36)14-23-8-7-13-32-17-23)22(2)20-42-28-15-24(11-12-27(28)31(37)34(3)19-29(21)41-5)33-43(38,39)26-10-6-9-25(16-26)40-4/h6-13,15-17,21-22,29,33H,14,18-20H2,1-5H3/t21-,22-,29-/m1/s1	CTXMNAKEZUVJQX-IEOSBIPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K03090859	BRD-K03090859-001-01-3	Broad Institute of MIT and Harvard	BRD-K03090859			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C31H38N4O7S/c1-21-18-35(30(36)14-23-8-7-13-32-17-23)22(2)20-42-28-15-24(11-12-27(28)31(37)34(3)19-29(21)41-5)33-43(38,39)26-10-6-9-25(16-26)40-4/h6-13,15-17,21-22,29,33H,14,18-20H2,1-5H3/t21-,22-,29-/m1/s1	CTXMNAKEZUVJQX-IEOSBIPESA-N	610.246120286							104340
BRD-K09711841	LSM-15706		54633011	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16+,20+/m1/s1	SSHPSTSVPAJXGJ-GUXCAODWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K09711841	BRD-K09711841-001-01-9	Broad Institute of MIT and Harvard	BRD-K09711841			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16+,20+/m1/s1	SSHPSTSVPAJXGJ-GUXCAODWSA-N	479.220239896							104341
BRD-K99127896	LSM-15707		54632953	InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25+/m1/s1	ACQKEKFFNOLIKU-WYEJZRMESA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K99127896	BRD-K99127896-001-01-3	Broad Institute of MIT and Harvard	BRD-K99127896			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25+/m1/s1	ACQKEKFFNOLIKU-WYEJZRMESA-N	500.279883904							104342
CHEMBL2136477	LSM-15708	BRD-K50177754, SID131429316	54633066	InChI=1S/C29H35N5O4/c1-20-16-34(17-23-9-5-7-13-30-23)21(2)19-38-26-15-22(32-28(35)25-10-6-8-14-31-25)11-12-24(26)29(36)33(3)18-27(20)37-4/h5-15,20-21,27H,16-19H2,1-4H3,(H,32,35)/t20-,21-,27-/m1/s1	ZBJJNPNHABUELL-LGVUCKNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@@H](C)N(Cc4ccccn4)C[C@H]1C	BroadT	BRD-K50177754	BRD-K50177754-001-01-6	Broad Institute of MIT and Harvard	BRD-K50177754			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C29H35N5O4/c1-20-16-34(17-23-9-5-7-13-30-23)21(2)19-38-26-15-22(32-28(35)25-10-6-8-14-31-25)11-12-24(26)29(36)33(3)18-27(20)37-4/h5-15,20-21,27H,16-19H2,1-4H3,(H,32,35)/t20-,21-,27-/m1/s1	ZBJJNPNHABUELL-LGVUCKNBSA-N	517.26890465							104343
BRD-K48777375	LSM-15709		54633180	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24+/m1/s1	CQIKJOZGEFZHGH-IMWIBFENSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K48777375	BRD-K48777375-001-01-7	Broad Institute of MIT and Harvard	BRD-K48777375			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24+/m1/s1	CQIKJOZGEFZHGH-IMWIBFENSA-N	495.276692132							104344
BRD-K70978931	LSM-15710		54633130	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m1/s1	JPYQBBUSLGAIKR-HBUWYVDXSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K70978931	BRD-K70978931-001-01-9	Broad Institute of MIT and Harvard	BRD-K70978931			COCC(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m1/s1	JPYQBBUSLGAIKR-HBUWYVDXSA-N	393.226371122							104345
BRD-K92736140	LSM-15711		54633044	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	FSOYZNCORKLRQF-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K92736140	BRD-K92736140-001-01-2	Broad Institute of MIT and Harvard	BRD-K92736140			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	FSOYZNCORKLRQF-MFEFFIJZSA-N	457.237684734							104346
BRD-K80467627	LSM-15712		54633166	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16+,21+/m0/s1	ORSJUXOXPPDIAU-GCKMJXCFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K80467627	BRD-K80467627-001-01-0	Broad Institute of MIT and Harvard	BRD-K80467627			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16+,21+/m0/s1	ORSJUXOXPPDIAU-GCKMJXCFSA-N	448.268570292							104347
BRD-K90408478	LSM-15713		54632949	InChI=1S/C26H34N4O6/c1-16-12-29(3)17(2)14-34-22-10-18(6-8-20(22)25(31)30(4)13-24(16)33-5)27-26(32)28-19-7-9-21-23(11-19)36-15-35-21/h6-11,16-17,24H,12-15H2,1-5H3,(H2,27,28,32)/t16-,17-,24-/m1/s1	GEYUWNAIOQFKRH-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K90408478	BRD-K90408478-001-01-2	Broad Institute of MIT and Harvard	BRD-K90408478			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H34N4O6/c1-16-12-29(3)17(2)14-34-22-10-18(6-8-20(22)25(31)30(4)13-24(16)33-5)27-26(32)28-19-7-9-21-23(11-19)36-15-35-21/h6-11,16-17,24H,12-15H2,1-5H3,(H2,27,28,32)/t16-,17-,24-/m1/s1	GEYUWNAIOQFKRH-HOZJOUCCSA-N	498.247834848							104348
BRD-K86019347	LSM-15714		54632997	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16+,20+/m1/s1	VUTYSYZKXJFCMD-GUXCAODWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K86019347	BRD-K86019347-001-01-2	Broad Institute of MIT and Harvard	BRD-K86019347			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16+,20+/m1/s1	VUTYSYZKXJFCMD-GUXCAODWSA-N	484.235555602							104349
BRD-K56716645	LSM-15715		54632966	InChI=1S/C23H31N5O4/c1-15-12-27(3)16(2)14-32-20-10-17(26-22(29)19-11-24-8-9-25-19)6-7-18(20)23(30)28(4)13-21(15)31-5/h6-11,15-16,21H,12-14H2,1-5H3,(H,26,29)/t15-,16-,21+/m1/s1	WHHUAOMDORXOMQ-ZOCZFRKYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K56716645	BRD-K56716645-001-01-8	Broad Institute of MIT and Harvard	BRD-K56716645			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C23H31N5O4/c1-15-12-27(3)16(2)14-32-20-10-17(26-22(29)19-11-24-8-9-25-19)6-7-18(20)23(30)28(4)13-21(15)31-5/h6-11,15-16,21H,12-14H2,1-5H3,(H,26,29)/t15-,16-,21+/m1/s1	WHHUAOMDORXOMQ-ZOCZFRKYSA-N	441.237604522							104350
BRD-K91934571-001-01-2	LSM-15716	BRD-K91934571	54632870	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17+,21-/m1/s1	HECXZILGRZYZSJ-LLGFUMIMSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K91934571	BRD-K91934571-001-01-2	Broad Institute of MIT and Harvard	BRD-K91934571			CCCC(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17+,21-/m1/s1	HECXZILGRZYZSJ-LLGFUMIMSA-N	487.265791262							104351
BRD-K39037393	LSM-15717		54632905	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23+/m0/s1	PJDHXRQRCWLMLV-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K39037393	BRD-K39037393-001-01-5	Broad Institute of MIT and Harvard	BRD-K39037393			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23+/m0/s1	PJDHXRQRCWLMLV-YGKZAACZSA-N	470.252920228							104352
BRD-K09993756	LSM-15718		54632937	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-11-17(22-30(6,26)27)8-9-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16-,20+/m1/s1	GJWLNKOJEVXCCA-QINHECLXSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K09993756	BRD-K09993756-001-01-6	Broad Institute of MIT and Harvard	BRD-K09993756			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H]1C)OC	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-11-17(22-30(6,26)27)8-9-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16-,20+/m1/s1	GJWLNKOJEVXCCA-QINHECLXSA-N	441.22974194							104353
BRD-K03733288	LSM-15719		54632994	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16-,20-/m1/s1	VUTYSYZKXJFCMD-JXXFODFXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K03733288	BRD-K03733288-001-01-9	Broad Institute of MIT and Harvard	BRD-K03733288			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16-,20-/m1/s1	VUTYSYZKXJFCMD-JXXFODFXSA-N	484.235555602							104354
BRD-K53257131	LSM-15720		54632888	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17-,21+/m0/s1	WKMZWDZZZDEYCM-XGHQBKJUSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K53257131	BRD-K53257131-001-01-7	Broad Institute of MIT and Harvard	BRD-K53257131			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17-,21+/m0/s1	WKMZWDZZZDEYCM-XGHQBKJUSA-N	462.284220356							104355
BRD-K11925125	LSM-15721		54633031	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21-/m1/s1	ZSTCKDKDRWVGTF-LLGFUMIMSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K11925125	BRD-K11925125-001-01-8	Broad Institute of MIT and Harvard	BRD-K11925125			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21-/m1/s1	ZSTCKDKDRWVGTF-LLGFUMIMSA-N	435.273321314							104356
BRD-K15028515	LSM-15722		54633053	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-6-5-7-22(29)12-20)19(2)17-36-25-13-23(30-27(33)21-8-9-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-19,21,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19-,26+/m1/s1	FZYPJVOXNKMGKY-UDCNLSRBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc4cccc(F)c4)C[C@H]1C	BroadT	BRD-K15028515	BRD-K15028515-001-01-5	Broad Institute of MIT and Harvard	BRD-K15028515			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc2cccc(F)c2)C[C@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-6-5-7-22(29)12-20)19(2)17-36-25-13-23(30-27(33)21-8-9-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-19,21,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19-,26+/m1/s1	FZYPJVOXNKMGKY-UDCNLSRBSA-N	497.268984862							104357
BRD-K73692505	LSM-15723		54632954	InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25+/m0/s1	ACQKEKFFNOLIKU-OSWQYVSFSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	BroadT	BRD-K73692505	BRD-K73692505-001-01-9	Broad Institute of MIT and Harvard	BRD-K73692505			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25+/m0/s1	ACQKEKFFNOLIKU-OSWQYVSFSA-N	500.279883904							104358
BRD-K81318113-001-01-5	LSM-15724	BRD-K81318113	54633151	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19-,24-/m0/s1	DRUGZYWRQAVALM-JXQFQVJHSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H]1C	BroadT	BRD-K81318113	BRD-K81318113-001-01-5	Broad Institute of MIT and Harvard	BRD-K81318113			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19-,24-/m0/s1	DRUGZYWRQAVALM-JXQFQVJHSA-N	498.295453756							104359
BRD-K61213827	LSM-15725		54632875	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17+,21+/m0/s1	LWXKGGIJWSHZGV-CSODHUTKSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K61213827	BRD-K61213827-001-01-9	Broad Institute of MIT and Harvard	BRD-K61213827			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17+,21+/m0/s1	LWXKGGIJWSHZGV-CSODHUTKSA-N	502.276690304							104360
BRD-K03304013	LSM-15726		54632910	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25+/m1/s1	FHXMSJACTAYBFY-FHAGJXEFSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K03304013	BRD-K03304013-001-01-1	Broad Institute of MIT and Harvard	BRD-K03304013			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25+/m1/s1	FHXMSJACTAYBFY-FHAGJXEFSA-N	497.300204778							131236
BRD-K23956364	LSM-15727		54632968	InChI=1S/C23H31N5O4/c1-15-12-27(3)16(2)14-32-20-10-17(26-22(29)19-11-24-8-9-25-19)6-7-18(20)23(30)28(4)13-21(15)31-5/h6-11,15-16,21H,12-14H2,1-5H3,(H,26,29)/t15-,16+,21+/m1/s1	WHHUAOMDORXOMQ-XFQAVAEZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K23956364	BRD-K23956364-001-01-9	Broad Institute of MIT and Harvard	BRD-K23956364			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C23H31N5O4/c1-15-12-27(3)16(2)14-32-20-10-17(26-22(29)19-11-24-8-9-25-19)6-7-18(20)23(30)28(4)13-21(15)31-5/h6-11,15-16,21H,12-14H2,1-5H3,(H,26,29)/t15-,16+,21+/m1/s1	WHHUAOMDORXOMQ-XFQAVAEZSA-N	441.237604522							104363
BRD-K25176380	LSM-15728		54633087	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16+,22-/m0/s1	ILZDYFIBDLQWDD-DMPWYTOCSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H]1C)OC	BroadT	BRD-K25176380	BRD-K25176380-001-01-2	Broad Institute of MIT and Harvard	BRD-K25176380			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H]1C)OC	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16+,22-/m0/s1	ILZDYFIBDLQWDD-DMPWYTOCSA-N	486.247834848							104364
BRD-K27754030	LSM-15729		54633179	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24+/m0/s1	CQIKJOZGEFZHGH-AXHZCLLHSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K27754030	BRD-K27754030-001-01-8	Broad Institute of MIT and Harvard	BRD-K27754030			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24+/m0/s1	CQIKJOZGEFZHGH-AXHZCLLHSA-N	495.276692132							104365
BRD-K98938484	LSM-15730		54632921	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m0/s1	POIAECOHAGPJOS-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@@H]1C	BroadT	BRD-K98938484	BRD-K98938484-001-01-2	Broad Institute of MIT and Harvard	BRD-K98938484			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m0/s1	POIAECOHAGPJOS-RHGYRFJNSA-N	454.258005608							104366
BRD-K21253219	LSM-15731		54633133	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m1/s1	JPYQBBUSLGAIKR-GLJUWKHASA-N	COCC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K21253219	BRD-K21253219-001-01-0	Broad Institute of MIT and Harvard	BRD-K21253219			COCC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m1/s1	JPYQBBUSLGAIKR-GLJUWKHASA-N	393.226371122							104367
BRD-K79355381	LSM-15732		54633091	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	YJDVPIUPODSEFW-RNHFSVANSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CC3CCCCC3)[C@@H](C)COc2c1	BroadT	BRD-K79355381	BRD-K79355381-001-01-6	Broad Institute of MIT and Harvard	BRD-K79355381			CCC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CCCCC3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	YJDVPIUPODSEFW-RNHFSVANSA-N	473.325356886							104368
BRD-K30264389	LSM-15733		54633043	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m0/s1	FSOYZNCORKLRQF-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K30264389	BRD-K30264389-001-01-0	Broad Institute of MIT and Harvard	BRD-K30264389			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m0/s1	FSOYZNCORKLRQF-QQMNAOGKSA-N	457.237684734							104369
BRD-K92379545	LSM-15734		54632920	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m0/s1	POIAECOHAGPJOS-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3cccnc3)C[C@@H]1C	BroadT	BRD-K92379545	BRD-K92379545-001-01-2	Broad Institute of MIT and Harvard	BRD-K92379545			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m0/s1	POIAECOHAGPJOS-XFAGBWLFSA-N	454.258005608							104370
BRD-K96651591	LSM-15735		54633120	InChI=1S/C24H34N4O5S/c1-17-13-28(14-20-8-6-7-11-25-20)18(2)16-33-22-12-19(26-34(5,30)31)9-10-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18+,23+/m1/s1	VKVFXZDQZTZVBL-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(Cc3ccccn3)C[C@H]1C	BroadT	BRD-K96651591	BRD-K96651591-001-01-3	Broad Institute of MIT and Harvard	BRD-K96651591			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C24H34N4O5S/c1-17-13-28(14-20-8-6-7-11-25-20)18(2)16-33-22-12-19(26-34(5,30)31)9-10-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18+,23+/m1/s1	VKVFXZDQZTZVBL-STSQHVNTSA-N	490.224990918							104371
BRD-K90675978	LSM-15736		54632871	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17-,21-/m1/s1	LWXKGGIJWSHZGV-CBGDNZLLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K90675978	BRD-K90675978-001-01-1	Broad Institute of MIT and Harvard	BRD-K90675978			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17-,21-/m1/s1	LWXKGGIJWSHZGV-CBGDNZLLSA-N	502.276690304							104372
BRD-K24549321	LSM-15737		54632882	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m0/s1	WMGIIIYIYFXVGX-XLNZFTOWSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCOCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K24549321	BRD-K24549321-001-01-3	Broad Institute of MIT and Harvard	BRD-K24549321			CCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCOCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m0/s1	WMGIIIYIYFXVGX-XLNZFTOWSA-N	475.304621442							104373
BRD-K24133768	LSM-15738		54632897	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m0/s1	JELNQRUVVFGWSZ-YZZKKUAISA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	BroadT	BRD-K24133768	BRD-K24133768-001-01-6	Broad Institute of MIT and Harvard	BRD-K24133768			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m0/s1	JELNQRUVVFGWSZ-YZZKKUAISA-N	445.294056758							104374
BRD-K45909830	LSM-15739		54632986	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18+,23-/m1/s1	ODEBYALMHVNZLV-IEGUWTFLSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C3CCCC3	BroadT	BRD-K45909830	BRD-K45909830-001-01-8	Broad Institute of MIT and Harvard	BRD-K45909830			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)C2CCCC2)c1	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18+,23-/m1/s1	ODEBYALMHVNZLV-IEGUWTFLSA-N	489.283885998							104375
BRD-K73669270	LSM-15740		54632961	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25-/m0/s1	DCHCVUMEJAAHBI-RLSLOFABSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K73669270	BRD-K73669270-001-01-0	Broad Institute of MIT and Harvard	BRD-K73669270			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25-/m0/s1	DCHCVUMEJAAHBI-RLSLOFABSA-N	497.300204778							104376
BRD-K89931949	LSM-15741		54633170	InChI=1S/C25H33ClN4O6S/c1-16-13-30(37(5,33)34)17(2)15-36-22-11-10-18(12-19(22)24(31)29(3)14-23(16)35-4)27-25(32)28-21-9-7-6-8-20(21)26/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m1/s1	ZAUBETAXUYVFOB-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3Cl)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K89931949	BRD-K89931949-001-01-7	Broad Institute of MIT and Harvard	BRD-K89931949			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3Cl)ccc2OC[C@@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C25H33ClN4O6S/c1-16-13-30(37(5,33)34)17(2)15-36-22-11-10-18(12-19(22)24(31)29(3)14-23(16)35-4)27-25(32)28-21-9-7-6-8-20(21)26/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m1/s1	ZAUBETAXUYVFOB-SEPYTNNBSA-N	552.180933216							104377
BRD-K60905563	LSM-15742		54632929	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21+,27-/m1/s1	PRTUIZBAVMDHAZ-PBDKAQRYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K60905563	BRD-K60905563-001-01-9	Broad Institute of MIT and Harvard	BRD-K60905563			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21+,27-/m1/s1	PRTUIZBAVMDHAZ-PBDKAQRYSA-N	493.294056758							104378
CHEMBL3187509	LSM-15743	BRD-K01716842	54633067	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27-/m1/s1	HCXQDEKJJPGAJR-LGVUCKNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)N(Cc5cccnc5)C[C@H]1C	BroadT	BRD-K01716842	BRD-K01716842-001-01-5	Broad Institute of MIT and Harvard	BRD-K01716842			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27-/m1/s1	HCXQDEKJJPGAJR-LGVUCKNBSA-N	573.24097534							104379
BRD-K74540252	LSM-15744		54633032	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19-,25+/m0/s1	YEIJZPFIQUPCSE-XHNVNVPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(CC3CCCCC3)C[C@@H]1C	BroadT	BRD-K74540252	BRD-K74540252-001-01-4	Broad Institute of MIT and Harvard	BRD-K74540252			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19-,25+/m0/s1	YEIJZPFIQUPCSE-XHNVNVPESA-N	459.309706822							104380
BRD-K78818514	LSM-15745		54633056	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-6-5-7-22(29)12-20)19(2)17-36-25-13-23(30-27(33)21-8-9-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-19,21,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26+/m0/s1	FZYPJVOXNKMGKY-GNBJCERTSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc4cccc(F)c4)C[C@@H]1C	BroadT	BRD-K78818514	BRD-K78818514-001-01-4	Broad Institute of MIT and Harvard	BRD-K78818514			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc2cccc(F)c2)C[C@@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-6-5-7-22(29)12-20)19(2)17-36-25-13-23(30-27(33)21-8-9-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-19,21,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26+/m0/s1	FZYPJVOXNKMGKY-GNBJCERTSA-N	497.268984862							104381
BRD-K60166659	LSM-15746		54633047	InChI=1S/C28H35N3O5/c1-18-15-31(27(33)21-10-11-21)19(2)17-36-24-14-22(29-26(32)20-8-6-5-7-9-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h5-9,12-14,18-19,21,25H,10-11,15-17H2,1-4H3,(H,29,32)/t18-,19-,25+/m0/s1	OQUNXXZCDPSMLO-XHNVNVPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K60166659	BRD-K60166659-001-01-3	Broad Institute of MIT and Harvard	BRD-K60166659			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C28H35N3O5/c1-18-15-31(27(33)21-10-11-21)19(2)17-36-24-14-22(29-26(32)20-8-6-5-7-9-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h5-9,12-14,18-19,21,25H,10-11,15-17H2,1-4H3,(H,29,32)/t18-,19-,25+/m0/s1	OQUNXXZCDPSMLO-XHNVNVPESA-N	493.25767125							104382
BRD-K93195567	LSM-15747		54633002	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22-/m1/s1	TVGROYRLGTWDMS-DRSNIGMVSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K93195567	BRD-K93195567-001-01-4	Broad Institute of MIT and Harvard	BRD-K93195567			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22-/m1/s1	TVGROYRLGTWDMS-DRSNIGMVSA-N	447.273321314							104383
BRD-K38350115	LSM-15748		54632975	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18+,25+/m0/s1	UCDDDGMWGBQWAH-YYULODDRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K38350115	BRD-K38350115-001-01-0	Broad Institute of MIT and Harvard	BRD-K38350115			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18+,25+/m0/s1	UCDDDGMWGBQWAH-YYULODDRSA-N	526.25914846							104384
BRD-K40732885	LSM-15749		54632957	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25+/m0/s1	DCHCVUMEJAAHBI-ZYLNGJIFSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K40732885	BRD-K40732885-001-01-3	Broad Institute of MIT and Harvard	BRD-K40732885			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25+/m0/s1	DCHCVUMEJAAHBI-ZYLNGJIFSA-N	497.300204778							104385
BRD-K20073772	LSM-15750		54633048	InChI=1S/C28H35N3O5/c1-18-15-31(27(33)21-10-11-21)19(2)17-36-24-14-22(29-26(32)20-8-6-5-7-9-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h5-9,12-14,18-19,21,25H,10-11,15-17H2,1-4H3,(H,29,32)/t18-,19+,25+/m1/s1	OQUNXXZCDPSMLO-WYEJZRMESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K20073772	BRD-K20073772-001-01-2	Broad Institute of MIT and Harvard	BRD-K20073772			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C28H35N3O5/c1-18-15-31(27(33)21-10-11-21)19(2)17-36-24-14-22(29-26(32)20-8-6-5-7-9-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h5-9,12-14,18-19,21,25H,10-11,15-17H2,1-4H3,(H,29,32)/t18-,19+,25+/m1/s1	OQUNXXZCDPSMLO-WYEJZRMESA-N	493.25767125							104386
BRD-K97445906	LSM-15751		54633090	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	YJDVPIUPODSEFW-ZYLNGJIFSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CC3CCCCC3)[C@@H](C)COc2c1	BroadT	BRD-K97445906	BRD-K97445906-001-01-9	Broad Institute of MIT and Harvard	BRD-K97445906			CCC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CCCCC3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	YJDVPIUPODSEFW-ZYLNGJIFSA-N	473.325356886							104387
BRD-K96258717	LSM-15752		54632931	InChI=1S/C26H39N3O6/c1-6-24(30)29-14-17(2)23(33-5)15-28(4)26(32)21-8-7-20(13-22(21)35-16-18(29)3)27-25(31)19-9-11-34-12-10-19/h7-8,13,17-19,23H,6,9-12,14-16H2,1-5H3,(H,27,31)/t17-,18+,23+/m1/s1	MDHLDPDUZLKUJE-STSQHVNTSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H]1C)OC	BroadT	BRD-K96258717	BRD-K96258717-001-01-6	Broad Institute of MIT and Harvard	BRD-K96258717			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H]1C)OC	InChI=1S/C26H39N3O6/c1-6-24(30)29-14-17(2)23(33-5)15-28(4)26(32)21-8-7-20(13-22(21)35-16-18(29)3)27-25(31)19-9-11-34-12-10-19/h7-8,13,17-19,23H,6,9-12,14-16H2,1-5H3,(H,27,31)/t17-,18+,23+/m1/s1	MDHLDPDUZLKUJE-STSQHVNTSA-N	489.283885998							104388
BRD-K35035851	LSM-15753		54633000	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16+,20-/m0/s1	VUTYSYZKXJFCMD-YRNRMSPPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K35035851	BRD-K35035851-001-01-8	Broad Institute of MIT and Harvard	BRD-K35035851			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16+,20-/m0/s1	VUTYSYZKXJFCMD-YRNRMSPPSA-N	484.235555602							104389
BRD-K45612428	LSM-15754		54633055	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-6-5-7-22(29)12-20)19(2)17-36-25-13-23(30-27(33)21-8-9-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-19,21,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26+/m1/s1	FZYPJVOXNKMGKY-MVYHEMRASA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc4cccc(F)c4)C[C@H]1C	BroadT	BRD-K45612428	BRD-K45612428-001-01-6	Broad Institute of MIT and Harvard	BRD-K45612428			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc2cccc(F)c2)C[C@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-6-5-7-22(29)12-20)19(2)17-36-25-13-23(30-27(33)21-8-9-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-19,21,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26+/m1/s1	FZYPJVOXNKMGKY-MVYHEMRASA-N	497.268984862							104390
BRD-K98961458	LSM-15755		54633063	InChI=1S/C26H33N3O8S/c1-16-12-29(25(30)18-6-9-21-23(10-18)37-15-36-21)17(2)14-35-22-11-19(27-38(5,32)33)7-8-20(22)26(31)28(3)13-24(16)34-4/h6-11,16-17,24,27H,12-15H2,1-5H3/t16-,17+,24-/m0/s1	JZGYUICVYOVPMO-SRGWNRLKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K98961458	BRD-K98961458-001-01-6	Broad Institute of MIT and Harvard	BRD-K98961458			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccc2OCOc2c1	InChI=1S/C26H33N3O8S/c1-16-12-29(25(30)18-6-9-21-23(10-18)37-15-36-21)17(2)14-35-22-11-19(27-38(5,32)33)7-8-20(22)26(31)28(3)13-24(16)34-4/h6-11,16-17,24,27H,12-15H2,1-5H3/t16-,17+,24-/m0/s1	JZGYUICVYOVPMO-SRGWNRLKSA-N	547.198835736							104391
BRD-K72060903	LSM-15756		54632895	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m1/s1	JELNQRUVVFGWSZ-PNCHPQGNSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	BroadT	BRD-K72060903	BRD-K72060903-001-01-8	Broad Institute of MIT and Harvard	BRD-K72060903			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m1/s1	JELNQRUVVFGWSZ-PNCHPQGNSA-N	445.294056758							104392
BRD-K15444511	LSM-15757		54633004	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22+/m0/s1	TVGROYRLGTWDMS-PNLZDCPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K15444511	BRD-K15444511-001-01-8	Broad Institute of MIT and Harvard	BRD-K15444511			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22+/m0/s1	TVGROYRLGTWDMS-PNLZDCPESA-N	447.273321314							104393
BRD-K07502463	LSM-15758		54633119	InChI=1S/C24H34N4O5S/c1-17-13-28(14-20-8-6-7-11-25-20)18(2)16-33-22-12-19(26-34(5,30)31)9-10-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23+/m0/s1	VKVFXZDQZTZVBL-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(Cc3ccccn3)C[C@@H]1C	BroadT	BRD-K07502463	BRD-K07502463-001-01-1	Broad Institute of MIT and Harvard	BRD-K07502463			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C24H34N4O5S/c1-17-13-28(14-20-8-6-7-11-25-20)18(2)16-33-22-12-19(26-34(5,30)31)9-10-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23+/m0/s1	VKVFXZDQZTZVBL-IUKKYPGJSA-N	490.224990918							104394
BRD-K41271559	LSM-15759		54632999	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16-,20-/m0/s1	VUTYSYZKXJFCMD-FTRWYGJKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K41271559	BRD-K41271559-001-01-6	Broad Institute of MIT and Harvard	BRD-K41271559			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16-,20-/m0/s1	VUTYSYZKXJFCMD-FTRWYGJKSA-N	484.235555602							104395
BRD-K07588901	LSM-15760		54633163	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21-/m1/s1	ORSJUXOXPPDIAU-WHSLLNHNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K07588901	BRD-K07588901-001-01-0	Broad Institute of MIT and Harvard	BRD-K07588901			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21-/m1/s1	ORSJUXOXPPDIAU-WHSLLNHNSA-N	448.268570292							104396
BRD-K92144896	LSM-15761		54633083	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16-,22+/m0/s1	ILZDYFIBDLQWDD-PONJGIIJSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H]1C)OC	BroadT	BRD-K92144896	BRD-K92144896-001-01-5	Broad Institute of MIT and Harvard	BRD-K92144896			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H]1C)OC	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16-,22+/m0/s1	ILZDYFIBDLQWDD-PONJGIIJSA-N	486.247834848							104397
BRD-K60337657	LSM-15762		54633118	InChI=1S/C24H34N4O5S/c1-17-13-28(14-20-8-6-7-11-25-20)18(2)16-33-22-12-19(26-34(5,30)31)9-10-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23+/m1/s1	VKVFXZDQZTZVBL-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3ccccn3)C[C@H]1C	BroadT	BRD-K60337657	BRD-K60337657-001-01-2	Broad Institute of MIT and Harvard	BRD-K60337657			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C24H34N4O5S/c1-17-13-28(14-20-8-6-7-11-25-20)18(2)16-33-22-12-19(26-34(5,30)31)9-10-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23+/m1/s1	VKVFXZDQZTZVBL-PNCHPQGNSA-N	490.224990918							104398
BRD-K30615964	LSM-15763		54632878	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17+,21-/m1/s1	LWXKGGIJWSHZGV-LLGFUMIMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K30615964	BRD-K30615964-001-01-6	Broad Institute of MIT and Harvard	BRD-K30615964			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17+,21-/m1/s1	LWXKGGIJWSHZGV-LLGFUMIMSA-N	502.276690304							104399
BRD-K39153737	LSM-15764		54632926	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21+,27+/m0/s1	PRTUIZBAVMDHAZ-FYQCMVGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K39153737	BRD-K39153737-001-01-5	Broad Institute of MIT and Harvard	BRD-K39153737			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21+,27+/m0/s1	PRTUIZBAVMDHAZ-FYQCMVGJSA-N	493.294056758							104400
BRD-K31602570	LSM-15765		54632924	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21-,27+/m1/s1	PRTUIZBAVMDHAZ-GNMOFYLKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K31602570	BRD-K31602570-001-01-9	Broad Institute of MIT and Harvard	BRD-K31602570			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21-,27+/m1/s1	PRTUIZBAVMDHAZ-GNMOFYLKSA-N	493.294056758							104401
BRD-K19567079	LSM-15766		54632990	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m0/s1	QPDYUGYUVJBCGY-OSWQYVSFSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K19567079	BRD-K19567079-001-01-6	Broad Institute of MIT and Harvard	BRD-K19567079			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m0/s1	QPDYUGYUVJBCGY-OSWQYVSFSA-N	485.268984862							104402
CHEMBL3183107	LSM-15767	BRD-K33287655	54633138	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24-/m1/s1	JPQILOCSRFKHEV-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccccc3F	BroadT	BRD-K33287655	BRD-K33287655-001-01-5	Broad Institute of MIT and Harvard	BRD-K33287655			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1F	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24-/m1/s1	JPQILOCSRFKHEV-HOZJOUCCSA-N	485.232599354							104403
BRD-K54836449	LSM-15768		54632969	InChI=1S/C23H31N5O4/c1-15-12-27(3)16(2)14-32-20-10-17(26-22(29)19-11-24-8-9-25-19)6-7-18(20)23(30)28(4)13-21(15)31-5/h6-11,15-16,21H,12-14H2,1-5H3,(H,26,29)/t15-,16-,21-/m1/s1	WHHUAOMDORXOMQ-WHSLLNHNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K54836449	BRD-K54836449-001-01-4	Broad Institute of MIT and Harvard	BRD-K54836449			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C23H31N5O4/c1-15-12-27(3)16(2)14-32-20-10-17(26-22(29)19-11-24-8-9-25-19)6-7-18(20)23(30)28(4)13-21(15)31-5/h6-11,15-16,21H,12-14H2,1-5H3,(H,26,29)/t15-,16-,21-/m1/s1	WHHUAOMDORXOMQ-WHSLLNHNSA-N	441.237604522							104404
BRD-K64836560	LSM-15769		54633064	InChI=1S/C26H33N3O8S/c1-16-12-29(25(30)18-6-9-21-23(10-18)37-15-36-21)17(2)14-35-22-11-19(27-38(5,32)33)7-8-20(22)26(31)28(3)13-24(16)34-4/h6-11,16-17,24,27H,12-15H2,1-5H3/t16-,17+,24-/m1/s1	JZGYUICVYOVPMO-XVTZWQNCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K64836560	BRD-K64836560-001-01-5	Broad Institute of MIT and Harvard	BRD-K64836560			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccc2OCOc2c1	InChI=1S/C26H33N3O8S/c1-16-12-29(25(30)18-6-9-21-23(10-18)37-15-36-21)17(2)14-35-22-11-19(27-38(5,32)33)7-8-20(22)26(31)28(3)13-24(16)34-4/h6-11,16-17,24,27H,12-15H2,1-5H3/t16-,17+,24-/m1/s1	JZGYUICVYOVPMO-XVTZWQNCSA-N	547.198835736							104405
BRD-K42633304	LSM-15770		54632981	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18+,23+/m1/s1	ODEBYALMHVNZLV-STSQHVNTSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C3CCCC3	BroadT	BRD-K42633304	BRD-K42633304-001-01-4	Broad Institute of MIT and Harvard	BRD-K42633304			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)C2CCCC2)c1	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18+,23+/m1/s1	ODEBYALMHVNZLV-STSQHVNTSA-N	489.283885998							104406
BRD-K94344573	LSM-15771		54633026	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17-,21+/m0/s1	ZSTCKDKDRWVGTF-XGHQBKJUSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K94344573	BRD-K94344573-001-01-9	Broad Institute of MIT and Harvard	BRD-K94344573			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17-,21+/m0/s1	ZSTCKDKDRWVGTF-XGHQBKJUSA-N	435.273321314							104407
BRD-K10031593	LSM-15772		54632879	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m0/s1	WMGIIIYIYFXVGX-AXHZCLLHSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCOCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K10031593	BRD-K10031593-001-01-9	Broad Institute of MIT and Harvard	BRD-K10031593			CCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCOCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m0/s1	WMGIIIYIYFXVGX-AXHZCLLHSA-N	475.304621442							104408
BRD-K32522654	LSM-15773		54633117	InChI=1S/C24H34N4O5S/c1-17-13-28(14-20-8-6-7-11-25-20)18(2)16-33-22-12-19(26-34(5,30)31)9-10-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23-/m1/s1	VKVFXZDQZTZVBL-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3ccccn3)C[C@H]1C	BroadT	BRD-K32522654	BRD-K32522654-001-01-7	Broad Institute of MIT and Harvard	BRD-K32522654			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C24H34N4O5S/c1-17-13-28(14-20-8-6-7-11-25-20)18(2)16-33-22-12-19(26-34(5,30)31)9-10-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23-/m1/s1	VKVFXZDQZTZVBL-PMAPCBKXSA-N	490.224990918							104409
BRD-K40432489	LSM-15774		54632971	InChI=1S/C23H31N5O4/c1-15-12-27(3)16(2)14-32-20-10-17(26-22(29)19-11-24-8-9-25-19)6-7-18(20)23(30)28(4)13-21(15)31-5/h6-11,15-16,21H,12-14H2,1-5H3,(H,26,29)/t15-,16+,21-/m1/s1	WHHUAOMDORXOMQ-VWKPWSFCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K40432489	BRD-K40432489-001-01-0	Broad Institute of MIT and Harvard	BRD-K40432489			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C23H31N5O4/c1-15-12-27(3)16(2)14-32-20-10-17(26-22(29)19-11-24-8-9-25-19)6-7-18(20)23(30)28(4)13-21(15)31-5/h6-11,15-16,21H,12-14H2,1-5H3,(H,26,29)/t15-,16+,21-/m1/s1	WHHUAOMDORXOMQ-VWKPWSFCSA-N	441.237604522							104410
BRD-K70895130	LSM-15775		54633021	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	UPGINRWREGYSMW-STSQHVNTSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K70895130	BRD-K70895130-001-01-4	Broad Institute of MIT and Harvard	BRD-K70895130			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	UPGINRWREGYSMW-STSQHVNTSA-N	498.247834848							104411
BRD-K25165359	LSM-15776		54632977	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18+,25-/m0/s1	UCDDDGMWGBQWAH-ATLLOTDBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K25165359	BRD-K25165359-001-01-2	Broad Institute of MIT and Harvard	BRD-K25165359			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18+,25-/m0/s1	UCDDDGMWGBQWAH-ATLLOTDBSA-N	526.25914846							104412
BRD-K79318338	LSM-15777		54633072	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27-/m0/s1	HCXQDEKJJPGAJR-ISCCLHIJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)N(Cc5cccnc5)C[C@@H]1C	BroadT	BRD-K79318338	BRD-K79318338-001-01-8	Broad Institute of MIT and Harvard	BRD-K79318338			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27-/m0/s1	HCXQDEKJJPGAJR-ISCCLHIJSA-N	573.24097534							104413
BRD-K54007898	LSM-15778		54633167	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21-/m0/s1	ORSJUXOXPPDIAU-QYWGDWMGSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K54007898	BRD-K54007898-001-01-8	Broad Institute of MIT and Harvard	BRD-K54007898			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21-/m0/s1	ORSJUXOXPPDIAU-QYWGDWMGSA-N	448.268570292							104414
BRD-K22970494	LSM-15779		54632978	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18+,25-/m1/s1	UCDDDGMWGBQWAH-FUMQJTLXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K22970494	BRD-K22970494-001-01-4	Broad Institute of MIT and Harvard	BRD-K22970494			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18+,25-/m1/s1	UCDDDGMWGBQWAH-FUMQJTLXSA-N	526.25914846							104415
BRD-K09373762	LSM-15780		54633126	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19+/m0/s1	PXLHMJKVTIIEQJ-QMTMVMCOSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K09373762	BRD-K09373762-001-01-3	Broad Institute of MIT and Harvard	BRD-K09373762			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19+/m0/s1	PXLHMJKVTIIEQJ-QMTMVMCOSA-N	406.258005608							104416
BRD-K64162340-001-01-3	LSM-15781	BRD-K64162340	54633029	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17-,21-/m0/s1	ZSTCKDKDRWVGTF-FIKGOQFSSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K64162340	BRD-K64162340-001-01-3	Broad Institute of MIT and Harvard	BRD-K64162340			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17-,21-/m0/s1	ZSTCKDKDRWVGTF-FIKGOQFSSA-N	435.273321314							104417
BRD-K85813125	LSM-15782		54632992	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m0/s1	QPDYUGYUVJBCGY-CEYNDMKZSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K85813125	BRD-K85813125-001-01-7	Broad Institute of MIT and Harvard	BRD-K85813125			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m0/s1	QPDYUGYUVJBCGY-CEYNDMKZSA-N	485.268984862							104418
BRD-K31490008	LSM-15783		54633071	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27+/m0/s1	HCXQDEKJJPGAJR-FYQCMVGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)N(Cc5cccnc5)C[C@@H]1C	BroadT	BRD-K31490008	BRD-K31490008-001-01-1	Broad Institute of MIT and Harvard	BRD-K31490008			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27+/m0/s1	HCXQDEKJJPGAJR-FYQCMVGJSA-N	573.24097534							104419
BRD-K72565671	LSM-15784		54632880	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m1/s1	WMGIIIYIYFXVGX-IECBHUPTSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCOCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K72565671	BRD-K72565671-001-01-6	Broad Institute of MIT and Harvard	BRD-K72565671			CCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCOCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m1/s1	WMGIIIYIYFXVGX-IECBHUPTSA-N	475.304621442							104420
BRD-K67211407	LSM-15785		54633162	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26-/m1/s1	WREZSNUYDZQHHD-BVFVYWQFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K67211407	BRD-K67211407-001-01-5	Broad Institute of MIT and Harvard	BRD-K67211407			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26-/m1/s1	WREZSNUYDZQHHD-BVFVYWQFSA-N	479.278406694							104421
BRD-K27236794	LSM-15786		54632979	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18-,23+/m1/s1	ODEBYALMHVNZLV-PNCHPQGNSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)C3CCCC3	BroadT	BRD-K27236794	BRD-K27236794-001-01-2	Broad Institute of MIT and Harvard	BRD-K27236794			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)C2CCCC2)c1	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18-,23+/m1/s1	ODEBYALMHVNZLV-PNCHPQGNSA-N	489.283885998							104422
CHEMBL2132056	LSM-15787	SID131429434, BRD-K12702054	54633184	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24-/m1/s1	CQIKJOZGEFZHGH-KHCICDEESA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K12702054	BRD-K12702054-001-01-5	Broad Institute of MIT and Harvard	BRD-K12702054			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24-/m1/s1	CQIKJOZGEFZHGH-KHCICDEESA-N	495.276692132							104423
BRD-K34343777	LSM-15788		54633084	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16+,22+/m1/s1	ILZDYFIBDLQWDD-VVBPWWLESA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H]1C)OC	BroadT	BRD-K34343777	BRD-K34343777-001-01-8	Broad Institute of MIT and Harvard	BRD-K34343777			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H]1C)OC	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16+,22+/m1/s1	ILZDYFIBDLQWDD-VVBPWWLESA-N	486.247834848							104424
BRD-K53094498	LSM-15789		54633183	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24-/m0/s1	CQIKJOZGEFZHGH-JXQFQVJHSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K53094498	BRD-K53094498-001-01-1	Broad Institute of MIT and Harvard	BRD-K53094498			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24-/m0/s1	CQIKJOZGEFZHGH-JXQFQVJHSA-N	495.276692132							104425
BRD-K69248736	LSM-15790		54633092	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	YJDVPIUPODSEFW-WZOHSFFVSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CC3CCCCC3)[C@H](C)COc2c1	BroadT	BRD-K69248736	BRD-K69248736-001-01-7	Broad Institute of MIT and Harvard	BRD-K69248736			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CCCCC3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	YJDVPIUPODSEFW-WZOHSFFVSA-N	473.325356886							104426
BRD-K40011635	LSM-15791		54633020	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m0/s1	UPGINRWREGYSMW-IUKKYPGJSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K40011635	BRD-K40011635-001-01-5	Broad Institute of MIT and Harvard	BRD-K40011635			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m0/s1	UPGINRWREGYSMW-IUKKYPGJSA-N	498.247834848							104427
BRD-K14081852	LSM-15792		54632927	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21-,27-/m0/s1	PRTUIZBAVMDHAZ-IZVMNLJQSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K14081852	BRD-K14081852-001-01-6	Broad Institute of MIT and Harvard	BRD-K14081852			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21-,27-/m0/s1	PRTUIZBAVMDHAZ-IZVMNLJQSA-N	493.294056758							104428
BRD-K88097873-001-01-8	LSM-15793	BRD-K88097873	54632892	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17+,21-/m0/s1	WKMZWDZZZDEYCM-FVJLSDCUSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K88097873	BRD-K88097873-001-01-8	Broad Institute of MIT and Harvard	BRD-K88097873			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17+,21-/m0/s1	WKMZWDZZZDEYCM-FVJLSDCUSA-N	462.284220356							104429
BRD-K05335635	LSM-15794		54633025	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17-,21+/m1/s1	ZSTCKDKDRWVGTF-LZJOCLMNSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@H]1C)OC	BroadT	BRD-K05335635	BRD-K05335635-001-01-1	Broad Institute of MIT and Harvard	BRD-K05335635			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17-,21+/m1/s1	ZSTCKDKDRWVGTF-LZJOCLMNSA-N	435.273321314							104430
BRD-K32185628	LSM-15795		54632902	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23+/m0/s1	PJDHXRQRCWLMLV-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K32185628	BRD-K32185628-001-01-6	Broad Institute of MIT and Harvard	BRD-K32185628			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23+/m0/s1	PJDHXRQRCWLMLV-HKARXFIJSA-N	470.252920228							104431
BRD-K42511168	LSM-15796		54632896	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m1/s1	JELNQRUVVFGWSZ-STSQHVNTSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K42511168	BRD-K42511168-001-01-7	Broad Institute of MIT and Harvard	BRD-K42511168			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m1/s1	JELNQRUVVFGWSZ-STSQHVNTSA-N	445.294056758							104432
BRD-K05509844	LSM-15797		54633038	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19+,25-/m1/s1	YEIJZPFIQUPCSE-HHJKRLRDSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(CC3CCCCC3)C[C@H]1C	BroadT	BRD-K05509844	BRD-K05509844-001-01-8	Broad Institute of MIT and Harvard	BRD-K05509844			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19+,25-/m1/s1	YEIJZPFIQUPCSE-HHJKRLRDSA-N	459.309706822							104433
BRD-K86988191	LSM-15798		54633169	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16+,21-/m1/s1	ORSJUXOXPPDIAU-VWKPWSFCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K86988191	BRD-K86988191-001-01-5	Broad Institute of MIT and Harvard	BRD-K86988191			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16+,21-/m1/s1	ORSJUXOXPPDIAU-VWKPWSFCSA-N	448.268570292							104434
BRD-K51131084	LSM-15799		54633140	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24+/m0/s1	JPQILOCSRFKHEV-WOGXIUBCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccccc3F	BroadT	BRD-K51131084	BRD-K51131084-001-01-3	Broad Institute of MIT and Harvard	BRD-K51131084			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccc1F	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24+/m0/s1	JPQILOCSRFKHEV-WOGXIUBCSA-N	485.232599354							104435
BRD-K99521908	LSM-15800		54633010	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16-,20+/m1/s1	SSHPSTSVPAJXGJ-QINHECLXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K99521908	BRD-K99521908-001-01-3	Broad Institute of MIT and Harvard	BRD-K99521908			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16-,20+/m1/s1	SSHPSTSVPAJXGJ-QINHECLXSA-N	479.220239896							104436
BRD-K26941844	LSM-15801		54633115	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17+,23-/m0/s1	YOWCQSGRJVNXNF-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K26941844	BRD-K26941844-001-01-8	Broad Institute of MIT and Harvard	BRD-K26941844			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17+,23-/m0/s1	YOWCQSGRJVNXNF-MFEFFIJZSA-N	459.273321314							104437
BRD-K47200630	LSM-15802		54633073	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27-/m1/s1	HCXQDEKJJPGAJR-PBDKAQRYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)N(Cc5cccnc5)C[C@H]1C	BroadT	BRD-K47200630	BRD-K47200630-001-01-2	Broad Institute of MIT and Harvard	BRD-K47200630			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27-/m1/s1	HCXQDEKJJPGAJR-PBDKAQRYSA-N	573.24097534							104438
BRD-K93956318	LSM-15803		54633147	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19-,24+/m0/s1	DRUGZYWRQAVALM-AXHZCLLHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H]1C	BroadT	BRD-K93956318	BRD-K93956318-001-01-1	Broad Institute of MIT and Harvard	BRD-K93956318			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19-,24+/m0/s1	DRUGZYWRQAVALM-AXHZCLLHSA-N	498.295453756							104439
BRD-K59030325	LSM-15804		54632963	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25-/m1/s1	DCHCVUMEJAAHBI-OHUGHZGNSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K59030325	BRD-K59030325-001-01-8	Broad Institute of MIT and Harvard	BRD-K59030325			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25-/m1/s1	DCHCVUMEJAAHBI-OHUGHZGNSA-N	497.300204778							104440
BRD-K42508877	LSM-15805		54632916	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m0/s1	POIAECOHAGPJOS-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3cccnc3)C[C@@H]1C	BroadT	BRD-K42508877	BRD-K42508877-001-01-5	Broad Institute of MIT and Harvard	BRD-K42508877			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m0/s1	POIAECOHAGPJOS-LLJLJFOGSA-N	454.258005608							104441
BRD-K09560946	LSM-15806		54633012	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16+,20+/m0/s1	SSHPSTSVPAJXGJ-RZQQEMMASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K09560946	BRD-K09560946-001-01-4	Broad Institute of MIT and Harvard	BRD-K09560946			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16+,20+/m0/s1	SSHPSTSVPAJXGJ-RZQQEMMASA-N	479.220239896							104442
BRD-K74515526	LSM-15807		54632993	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m1/s1	QPDYUGYUVJBCGY-HHJKRLRDSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K74515526	BRD-K74515526-001-01-6	Broad Institute of MIT and Harvard	BRD-K74515526			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m1/s1	QPDYUGYUVJBCGY-HHJKRLRDSA-N	485.268984862							104443
BRD-K25103635	LSM-15808		54633075	InChI=1S/C31H38N4O7S/c1-21-18-35(30(36)14-23-8-7-13-32-17-23)22(2)20-42-28-15-24(11-12-27(28)31(37)34(3)19-29(21)41-5)33-43(38,39)26-10-6-9-25(16-26)40-4/h6-13,15-17,21-22,29,33H,14,18-20H2,1-5H3/t21-,22-,29+/m1/s1	CTXMNAKEZUVJQX-QLVXXPONSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K25103635	BRD-K25103635-001-01-9	Broad Institute of MIT and Harvard	BRD-K25103635			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C31H38N4O7S/c1-21-18-35(30(36)14-23-8-7-13-32-17-23)22(2)20-42-28-15-24(11-12-27(28)31(37)34(3)19-29(21)41-5)33-43(38,39)26-10-6-9-25(16-26)40-4/h6-13,15-17,21-22,29,33H,14,18-20H2,1-5H3/t21-,22-,29+/m1/s1	CTXMNAKEZUVJQX-QLVXXPONSA-N	610.246120286							104444
BRD-K27302831	LSM-15809		54633114	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17-,23-/m0/s1	YOWCQSGRJVNXNF-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K27302831	BRD-K27302831-001-01-7	Broad Institute of MIT and Harvard	BRD-K27302831			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17-,23-/m0/s1	YOWCQSGRJVNXNF-QQMNAOGKSA-N	459.273321314							104445
BRD-K72713703	LSM-15810		54632872	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17-,21+/m0/s1	LWXKGGIJWSHZGV-XGHQBKJUSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K72713703	BRD-K72713703-001-01-4	Broad Institute of MIT and Harvard	BRD-K72713703			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C24H37F3N4O4/c1-15(2)28-23(33)29-18-7-8-20-19(11-18)22(32)30(5)13-21(34-6)16(3)12-31(17(4)14-35-20)10-9-24(25,26)27/h7-8,11,15-17,21H,9-10,12-14H2,1-6H3,(H2,28,29,33)/t16-,17-,21+/m0/s1	LWXKGGIJWSHZGV-XGHQBKJUSA-N	502.276690304							104446
BRD-K15849455-001-01-6	LSM-15811	BRD-K15849455	54633127	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15-,19-/m0/s1	PXLHMJKVTIIEQJ-DOXZYTNZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K15849455	BRD-K15849455-001-01-6	Broad Institute of MIT and Harvard	BRD-K15849455			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15-,19-/m0/s1	PXLHMJKVTIIEQJ-DOXZYTNZSA-N	406.258005608							104447
BRD-K53308623	LSM-15812		54633135	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m0/s1	JPYQBBUSLGAIKR-DEYYWGMASA-N	COCC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K53308623	BRD-K53308623-001-01-3	Broad Institute of MIT and Harvard	BRD-K53308623			COCC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m0/s1	JPYQBBUSLGAIKR-DEYYWGMASA-N	393.226371122							104448
BRD-K63401195	LSM-15813		54632988	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m0/s1	QPDYUGYUVJBCGY-XHNVNVPESA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K63401195	BRD-K63401195-001-01-2	Broad Institute of MIT and Harvard	BRD-K63401195			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m0/s1	QPDYUGYUVJBCGY-XHNVNVPESA-N	485.268984862							104449
BRD-K25045770	LSM-15814		54632928	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21+,27-/m0/s1	PRTUIZBAVMDHAZ-ISCCLHIJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K25045770	BRD-K25045770-001-01-7	Broad Institute of MIT and Harvard	BRD-K25045770			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21+,27-/m0/s1	PRTUIZBAVMDHAZ-ISCCLHIJSA-N	493.294056758							104450
BRD-K12665145	LSM-15815		54633097	InChI=1S/C26H40N4O5/c1-17-13-30(24(31)15-28(3)4)18(2)16-35-22-12-20(27-25(32)19-8-7-9-19)10-11-21(22)26(33)29(5)14-23(17)34-6/h10-12,17-19,23H,7-9,13-16H2,1-6H3,(H,27,32)/t17-,18-,23+/m0/s1	OGUHNRNBJHRPNW-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K12665145	BRD-K12665145-001-01-5	Broad Institute of MIT and Harvard	BRD-K12665145			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C26H40N4O5/c1-17-13-30(24(31)15-28(3)4)18(2)16-35-22-12-20(27-25(32)19-8-7-9-19)10-11-21(22)26(33)29(5)14-23(17)34-6/h10-12,17-19,23H,7-9,13-16H2,1-6H3,(H,27,32)/t17-,18-,23+/m0/s1	OGUHNRNBJHRPNW-IUKKYPGJSA-N	488.29987042							104451
BRD-K20428189	LSM-15816		54632936	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-11-17(22-30(6,26)27)8-9-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16-,20+/m0/s1	GJWLNKOJEVXCCA-TWOQFEAHSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K20428189	BRD-K20428189-001-01-5	Broad Institute of MIT and Harvard	BRD-K20428189			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-11-17(22-30(6,26)27)8-9-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16-,20+/m0/s1	GJWLNKOJEVXCCA-TWOQFEAHSA-N	441.22974194							104452
BRD-K35066174	LSM-15817		54632913	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25-/m0/s1	FHXMSJACTAYBFY-RLSLOFABSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K35066174	BRD-K35066174-001-01-3	Broad Institute of MIT and Harvard	BRD-K35066174			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25-/m0/s1	FHXMSJACTAYBFY-RLSLOFABSA-N	497.300204778							104453
BRD-K25013674	LSM-15818		54633182	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24+/m0/s1	CQIKJOZGEFZHGH-XLNZFTOWSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K25013674	BRD-K25013674-001-01-2	Broad Institute of MIT and Harvard	BRD-K25013674			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24+/m0/s1	CQIKJOZGEFZHGH-XLNZFTOWSA-N	495.276692132							104454
BRD-K02315086	LSM-15819		54632955	InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25-/m0/s1	ACQKEKFFNOLIKU-CEYNDMKZSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	BroadT	BRD-K02315086	BRD-K02315086-001-01-0	Broad Institute of MIT and Harvard	BRD-K02315086			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25-/m0/s1	ACQKEKFFNOLIKU-CEYNDMKZSA-N	500.279883904							104455
BRD-K59356638	LSM-15820		54632973	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18-,25+/m1/s1	UCDDDGMWGBQWAH-GAKIBJFNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K59356638	BRD-K59356638-001-01-9	Broad Institute of MIT and Harvard	BRD-K59356638			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18-,25+/m1/s1	UCDDDGMWGBQWAH-GAKIBJFNSA-N	526.25914846							104456
BRD-K19573822	LSM-15821		54633123	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15-,19+/m0/s1	PXLHMJKVTIIEQJ-YZVOILCLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K19573822	BRD-K19573822-001-01-4	Broad Institute of MIT and Harvard	BRD-K19573822			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15-,19+/m0/s1	PXLHMJKVTIIEQJ-YZVOILCLSA-N	406.258005608							104457
BRD-K71204648	LSM-15822		54632984	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18-,23-/m1/s1	ODEBYALMHVNZLV-PMAPCBKXSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)C3CCCC3	BroadT	BRD-K71204648	BRD-K71204648-001-01-3	Broad Institute of MIT and Harvard	BRD-K71204648			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)C2CCCC2)c1	InChI=1S/C26H39N3O6/c1-17-13-29(25(31)19-8-6-7-9-19)18(2)15-35-22-12-20(27-24(30)16-33-4)10-11-21(22)26(32)28(3)14-23(17)34-5/h10-12,17-19,23H,6-9,13-16H2,1-5H3,(H,27,30)/t17-,18-,23-/m1/s1	ODEBYALMHVNZLV-PMAPCBKXSA-N	489.283885998							104458
BRD-K54650634	LSM-15823		54633159	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26-/m0/s1	WREZSNUYDZQHHD-DYLHXGEVSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K54650634	BRD-K54650634-001-01-4	Broad Institute of MIT and Harvard	BRD-K54650634			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26-/m0/s1	WREZSNUYDZQHHD-DYLHXGEVSA-N	479.278406694							104459
BRD-K47283018	LSM-15824		54633132	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m1/s1	JPYQBBUSLGAIKR-LBTNJELSSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K47283018	BRD-K47283018-001-01-0	Broad Institute of MIT and Harvard	BRD-K47283018			COCC(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m1/s1	JPYQBBUSLGAIKR-LBTNJELSSA-N	393.226371122							104460
BRD-K44141416	LSM-15825		54633027	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21+/m1/s1	ZSTCKDKDRWVGTF-WWMYMODYSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K44141416	BRD-K44141416-001-01-1	Broad Institute of MIT and Harvard	BRD-K44141416			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)COC)ccc2OC[C@@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-11-18(24-22(27)15-29-5)8-9-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21+/m1/s1	ZSTCKDKDRWVGTF-WWMYMODYSA-N	435.273321314							104461
BRD-K65488906	LSM-15826		54632912	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25+/m0/s1	FHXMSJACTAYBFY-WZOHSFFVSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K65488906	BRD-K65488906-001-01-7	Broad Institute of MIT and Harvard	BRD-K65488906			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25+/m0/s1	FHXMSJACTAYBFY-WZOHSFFVSA-N	497.300204778							104462
BRD-K98537764	LSM-15827		54632923	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21-,27+/m0/s1	PRTUIZBAVMDHAZ-NOMHHCBYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K98537764	BRD-K98537764-001-01-3	Broad Institute of MIT and Harvard	BRD-K98537764			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21-,27+/m0/s1	PRTUIZBAVMDHAZ-NOMHHCBYSA-N	493.294056758							104463
BRD-K50941255	LSM-15828		54633134	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m0/s1	JPYQBBUSLGAIKR-PMUMKWKESA-N	COCC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K50941255	BRD-K50941255-001-01-9	Broad Institute of MIT and Harvard	BRD-K50941255			COCC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m0/s1	JPYQBBUSLGAIKR-PMUMKWKESA-N	393.226371122							104464
BRD-K37271110	LSM-15829		54633039	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	FSOYZNCORKLRQF-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K37271110	BRD-K37271110-001-01-4	Broad Institute of MIT and Harvard	BRD-K37271110			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-18(27-24(30)19-8-6-7-9-21(19)26)10-11-20(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	FSOYZNCORKLRQF-QZMQVMSPSA-N	457.237684734							104465
BRD-K39692099	LSM-15830		54633129	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19-/m1/s1	PXLHMJKVTIIEQJ-ZRGWGRIASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K39692099	BRD-K39692099-001-01-4	Broad Institute of MIT and Harvard	BRD-K39692099			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19-/m1/s1	PXLHMJKVTIIEQJ-ZRGWGRIASA-N	406.258005608							104466
BRD-K74056311	LSM-15831		54633024	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	UPGINRWREGYSMW-IEGUWTFLSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K74056311	BRD-K74056311-001-01-0	Broad Institute of MIT and Harvard	BRD-K74056311			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	UPGINRWREGYSMW-IEGUWTFLSA-N	498.247834848							104467
BRD-K96459367	LSM-15832		54632898	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18-,23-/m0/s1	JELNQRUVVFGWSZ-BSRJHKFKSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K96459367	BRD-K96459367-001-01-3	Broad Institute of MIT and Harvard	BRD-K96459367			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H39N3O4/c1-6-12-28-14-17(2)23(31-5)15-27(4)25(30)21-13-20(26-24(29)19-8-7-9-19)10-11-22(21)32-16-18(28)3/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,26,29)/t17-,18-,23-/m0/s1	JELNQRUVVFGWSZ-BSRJHKFKSA-N	445.294056758							104468
BRD-K16267084	LSM-15833		54632943	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22+/m1/s1	NMVKSNPKIBDAFP-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K16267084	BRD-K16267084-001-01-9	Broad Institute of MIT and Harvard	BRD-K16267084			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22+/m1/s1	NMVKSNPKIBDAFP-MCFFVMPBSA-N	443.22203467							104469
BRD-K62909976	LSM-15834		54633112	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17+,23+/m1/s1	YOWCQSGRJVNXNF-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K62909976	BRD-K62909976-001-01-0	Broad Institute of MIT and Harvard	BRD-K62909976			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17+,23+/m1/s1	YOWCQSGRJVNXNF-DGGJZMOXSA-N	459.273321314							104470
BRD-K27458941	LSM-15835		54633107	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26-/m0/s1	CNFQIZJMIVHXMW-XWXLMPLOSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K27458941	BRD-K27458941-001-01-4	Broad Institute of MIT and Harvard	BRD-K27458941			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26-/m0/s1	CNFQIZJMIVHXMW-XWXLMPLOSA-N	612.246310674							104471
BRD-K50271780	LSM-15836		54633095	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	YJDVPIUPODSEFW-OHUGHZGNSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(CC3CCCCC3)[C@@H](C)COc2c1	BroadT	BRD-K50271780	BRD-K50271780-001-01-5	Broad Institute of MIT and Harvard	BRD-K50271780			CCC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CCCCC3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	YJDVPIUPODSEFW-OHUGHZGNSA-N	473.325356886							104472
BRD-K63787803	LSM-15837		54633108	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26-/m0/s1	CNFQIZJMIVHXMW-DFXHWTJYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K63787803	BRD-K63787803-001-01-8	Broad Institute of MIT and Harvard	BRD-K63787803			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26-/m0/s1	CNFQIZJMIVHXMW-DFXHWTJYSA-N	612.246310674							104473
BRD-K34258763	LSM-15838		54633003	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22+/m1/s1	TVGROYRLGTWDMS-YVHKJVDXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K34258763	BRD-K34258763-001-01-4	Broad Institute of MIT and Harvard	BRD-K34258763			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22+/m1/s1	TVGROYRLGTWDMS-YVHKJVDXSA-N	447.273321314							104474
BRD-K14070721	LSM-15839		54633060	InChI=1S/C26H33N3O8S/c1-16-12-29(25(30)18-6-9-21-23(10-18)37-15-36-21)17(2)14-35-22-11-19(27-38(5,32)33)7-8-20(22)26(31)28(3)13-24(16)34-4/h6-11,16-17,24,27H,12-15H2,1-5H3/t16-,17+,24+/m1/s1	JZGYUICVYOVPMO-KCYKTTMJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K14070721	BRD-K14070721-001-01-8	Broad Institute of MIT and Harvard	BRD-K14070721			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccc2OCOc2c1	InChI=1S/C26H33N3O8S/c1-16-12-29(25(30)18-6-9-21-23(10-18)37-15-36-21)17(2)14-35-22-11-19(27-38(5,32)33)7-8-20(22)26(31)28(3)13-24(16)34-4/h6-11,16-17,24,27H,12-15H2,1-5H3/t16-,17+,24+/m1/s1	JZGYUICVYOVPMO-KCYKTTMJSA-N	547.198835736							104475
BRD-K59205024	LSM-15840		54632908	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m1/s1	PJDHXRQRCWLMLV-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K59205024	BRD-K59205024-001-01-0	Broad Institute of MIT and Harvard	BRD-K59205024			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m1/s1	PJDHXRQRCWLMLV-SAHWJRBASA-N	470.252920228							104476
CHEMBL3181941	LSM-15841	BRD-K66734120	54633153	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19+,24-/m1/s1	DRUGZYWRQAVALM-YDIMBITNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H]1C	BroadT	BRD-K66734120	BRD-K66734120-001-01-3	Broad Institute of MIT and Harvard	BRD-K66734120			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19+,24-/m1/s1	DRUGZYWRQAVALM-YDIMBITNSA-N	498.295453756							104477
BRD-K22189453	LSM-15842		54633181	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24+/m1/s1	CQIKJOZGEFZHGH-IECBHUPTSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K22189453	BRD-K22189453-001-01-0	Broad Institute of MIT and Harvard	BRD-K22189453			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24+/m1/s1	CQIKJOZGEFZHGH-IECBHUPTSA-N	495.276692132							104478
BRD-K39571490	LSM-15843		54633149	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19+,24+/m1/s1	DRUGZYWRQAVALM-IMWIBFENSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H]1C	BroadT	BRD-K39571490	BRD-K39571490-001-01-5	Broad Institute of MIT and Harvard	BRD-K39571490			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19+,24+/m1/s1	DRUGZYWRQAVALM-IMWIBFENSA-N	498.295453756							104479
BRD-K03440991	LSM-15844		54633156	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26+/m0/s1	WREZSNUYDZQHHD-CUVVAGTFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K03440991	BRD-K03440991-001-01-9	Broad Institute of MIT and Harvard	BRD-K03440991			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26+/m0/s1	WREZSNUYDZQHHD-CUVVAGTFSA-N	479.278406694							104480
BRD-K07009788	LSM-15845		54633069	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27+/m0/s1	HCXQDEKJJPGAJR-NOMHHCBYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)N(Cc5cccnc5)C[C@@H]1C	BroadT	BRD-K07009788	BRD-K07009788-001-01-5	Broad Institute of MIT and Harvard	BRD-K07009788			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-8-7-13-32-15-22)21(2)19-40-26-14-23(11-12-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-9-5-6-10-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27+/m0/s1	HCXQDEKJJPGAJR-NOMHHCBYSA-N	573.24097534							104481
BRD-K53768630	LSM-15846		54633105	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26+/m0/s1	CNFQIZJMIVHXMW-QSAFDGGLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K53768630	BRD-K53768630-001-01-9	Broad Institute of MIT and Harvard	BRD-K53768630			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26+/m0/s1	CNFQIZJMIVHXMW-QSAFDGGLSA-N	612.246310674							104482
BRD-K31530457	LSM-15847		54632911	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25+/m1/s1	FHXMSJACTAYBFY-RNHFSVANSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K31530457	BRD-K31530457-001-01-0	Broad Institute of MIT and Harvard	BRD-K31530457			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25+/m1/s1	FHXMSJACTAYBFY-RNHFSVANSA-N	497.300204778							104483
BRD-K30214140	LSM-15848		54632989	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m1/s1	QPDYUGYUVJBCGY-WYEJZRMESA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K30214140	BRD-K30214140-001-01-5	Broad Institute of MIT and Harvard	BRD-K30214140			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m1/s1	QPDYUGYUVJBCGY-WYEJZRMESA-N	485.268984862							104484
BRD-K44341877	LSM-15849		54632945	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22+/m0/s1	NMVKSNPKIBDAFP-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K44341877	BRD-K44341877-001-01-9	Broad Institute of MIT and Harvard	BRD-K44341877			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22+/m0/s1	NMVKSNPKIBDAFP-WJONJSRFSA-N	443.22203467							104485
BRD-K93597476	LSM-15850		54632948	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22-/m1/s1	NMVKSNPKIBDAFP-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K93597476	BRD-K93597476-001-01-1	Broad Institute of MIT and Harvard	BRD-K93597476			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22-/m1/s1	NMVKSNPKIBDAFP-ZMPRRUGASA-N	443.22203467							104486
CHEMBL2357859	LSM-15851	SID131429343, BRD-K63573625	54633093	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m0/s1	YJDVPIUPODSEFW-RLSLOFABSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(CC3CCCCC3)[C@@H](C)COc2c1	BroadT	BRD-K63573625	BRD-K63573625-001-01-8	Broad Institute of MIT and Harvard	BRD-K63573625			CCC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CCCCC3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m0/s1	YJDVPIUPODSEFW-RLSLOFABSA-N	473.325356886							104487
BRD-K28720546	LSM-15852		54633110	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17-,23+/m0/s1	YOWCQSGRJVNXNF-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K28720546	BRD-K28720546-001-01-5	Broad Institute of MIT and Harvard	BRD-K28720546			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17-,23+/m0/s1	YOWCQSGRJVNXNF-HKARXFIJSA-N	459.273321314							104488
BRD-K08409548	LSM-15853		54633022	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	UPGINRWREGYSMW-YZZKKUAISA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K08409548	BRD-K08409548-001-01-7	Broad Institute of MIT and Harvard	BRD-K08409548			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	UPGINRWREGYSMW-YZZKKUAISA-N	498.247834848							104489
BRD-K96440230	LSM-15854		54632941	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-11-17(22-30(6,26)27)8-9-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20-/m1/s1	GJWLNKOJEVXCCA-GQIGUUNPSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K96440230	BRD-K96440230-001-01-8	Broad Institute of MIT and Harvard	BRD-K96440230			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-11-17(22-30(6,26)27)8-9-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20-/m1/s1	GJWLNKOJEVXCCA-GQIGUUNPSA-N	441.22974194							104490
BRD-K46376359	LSM-15855		54632906	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23-/m0/s1	PJDHXRQRCWLMLV-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K46376359	BRD-K46376359-001-01-0	Broad Institute of MIT and Harvard	BRD-K46376359			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23-/m0/s1	PJDHXRQRCWLMLV-QQMNAOGKSA-N	470.252920228							104491
BRD-K11581306	LSM-15856		54632925	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21+,27+/m1/s1	PRTUIZBAVMDHAZ-BUEREQSYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K11581306	BRD-K11581306-001-01-0	Broad Institute of MIT and Harvard	BRD-K11581306			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C29H39N3O4/c1-20-17-32(15-14-22-8-6-5-7-9-22)21(2)19-36-26-13-12-24(30-28(33)23-10-11-23)16-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,16,20-21,23,27H,10-11,14-15,17-19H2,1-4H3,(H,30,33)/t20-,21+,27+/m1/s1	PRTUIZBAVMDHAZ-BUEREQSYSA-N	493.294056758							104492
BRD-K42873980	LSM-15857		54632952	InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25+/m1/s1	ACQKEKFFNOLIKU-RRQZXNHTSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	BroadT	BRD-K42873980	BRD-K42873980-001-01-7	Broad Institute of MIT and Harvard	BRD-K42873980			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-12-32-15-18(2)25(35-5)16-31(4)26(33)23-14-22(10-11-24(23)36-17-19(32)3)30-27(34)29-21-9-7-8-20(28)13-21/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25+/m1/s1	ACQKEKFFNOLIKU-RRQZXNHTSA-N	500.279883904							104493
BRD-K77150932	LSM-15858		54633100	InChI=1S/C26H40N4O5/c1-17-13-30(24(31)15-28(3)4)18(2)16-35-22-12-20(27-25(32)19-8-7-9-19)10-11-21(22)26(33)29(5)14-23(17)34-6/h10-12,17-19,23H,7-9,13-16H2,1-6H3,(H,27,32)/t17-,18+,23-/m0/s1	OGUHNRNBJHRPNW-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K77150932	BRD-K77150932-001-01-7	Broad Institute of MIT and Harvard	BRD-K77150932			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C26H40N4O5/c1-17-13-30(24(31)15-28(3)4)18(2)16-35-22-12-20(27-25(32)19-8-7-9-19)10-11-21(22)26(33)29(5)14-23(17)34-6/h10-12,17-19,23H,7-9,13-16H2,1-6H3,(H,27,32)/t17-,18+,23-/m0/s1	OGUHNRNBJHRPNW-IXFSTUDKSA-N	488.29987042							104494
BRD-K71755056	LSM-15859		54633185	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24-/m0/s1	CQIKJOZGEFZHGH-GLDPYIMESA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K71755056	BRD-K71755056-001-01-9	Broad Institute of MIT and Harvard	BRD-K71755056			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24-/m0/s1	CQIKJOZGEFZHGH-GLDPYIMESA-N	495.276692132							104495
BRD-K72501910	LSM-15860		54633154	InChI=1S/C28H37N3O6/c1-7-26(32)31-15-18(2)25(36-6)16-30(4)28(34)23-14-21(10-13-24(23)37-17-19(31)3)29-27(33)20-8-11-22(35-5)12-9-20/h8-14,18-19,25H,7,15-17H2,1-6H3,(H,29,33)/t18-,19-,25-/m1/s1	QPCTXYQEJVCSQQ-MPCDZSKCSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K72501910	BRD-K72501910-001-01-2	Broad Institute of MIT and Harvard	BRD-K72501910			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@H]1C)OC	InChI=1S/C28H37N3O6/c1-7-26(32)31-15-18(2)25(36-6)16-30(4)28(34)23-14-21(10-13-24(23)37-17-19(31)3)29-27(33)20-8-11-22(35-5)12-9-20/h8-14,18-19,25H,7,15-17H2,1-6H3,(H,29,33)/t18-,19-,25-/m1/s1	QPCTXYQEJVCSQQ-MPCDZSKCSA-N	511.268235934							104496
BRD-K12396271	LSM-15861		54633104	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26+/m1/s1	CNFQIZJMIVHXMW-KABRZNFWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K12396271	BRD-K12396271-001-01-3	Broad Institute of MIT and Harvard	BRD-K12396271			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26+/m1/s1	CNFQIZJMIVHXMW-KABRZNFWSA-N	612.246310674							104497
BRD-K53387776	LSM-15862		54632991	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m0/s1	QPDYUGYUVJBCGY-MHPIHPPYSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K53387776	BRD-K53387776-001-01-2	Broad Institute of MIT and Harvard	BRD-K53387776			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m0/s1	QPDYUGYUVJBCGY-MHPIHPPYSA-N	485.268984862							104498
BRD-K47228832	LSM-15863		54633037	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19+,25-/m0/s1	YEIJZPFIQUPCSE-CEYNDMKZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@@H]1C	BroadT	BRD-K47228832	BRD-K47228832-001-01-9	Broad Institute of MIT and Harvard	BRD-K47228832			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19+,25-/m0/s1	YEIJZPFIQUPCSE-CEYNDMKZSA-N	459.309706822							104499
BRD-K01039605	LSM-15864		54632918	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m1/s1	POIAECOHAGPJOS-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3cccnc3)C[C@H]1C	BroadT	BRD-K01039605	BRD-K01039605-001-01-9	Broad Institute of MIT and Harvard	BRD-K01039605			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m1/s1	POIAECOHAGPJOS-YTZAWJCFSA-N	454.258005608							104500
BRD-K73394628	LSM-15865		54633186	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24-/m1/s1	CQIKJOZGEFZHGH-YDIMBITNSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K73394628	BRD-K73394628-001-01-4	Broad Institute of MIT and Harvard	BRD-K73394628			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H41N3O5S/c1-6-34(30,31)26-21-11-12-23-22(13-21)25(29)27(4)16-24(32-5)18(2)14-28(19(3)17-33-23)15-20-9-7-8-10-20/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24-/m1/s1	CQIKJOZGEFZHGH-YDIMBITNSA-N	495.276692132							104501
BRD-K74855272	LSM-15866		54633077	InChI=1S/C31H38N4O7S/c1-21-18-35(30(36)14-23-8-7-13-32-17-23)22(2)20-42-28-15-24(11-12-27(28)31(37)34(3)19-29(21)41-5)33-43(38,39)26-10-6-9-25(16-26)40-4/h6-13,15-17,21-22,29,33H,14,18-20H2,1-5H3/t21-,22+,29+/m1/s1	CTXMNAKEZUVJQX-BXOOBUKZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K74855272	BRD-K74855272-001-01-2	Broad Institute of MIT and Harvard	BRD-K74855272			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C31H38N4O7S/c1-21-18-35(30(36)14-23-8-7-13-32-17-23)22(2)20-42-28-15-24(11-12-27(28)31(37)34(3)19-29(21)41-5)33-43(38,39)26-10-6-9-25(16-26)40-4/h6-13,15-17,21-22,29,33H,14,18-20H2,1-5H3/t21-,22+,29+/m1/s1	CTXMNAKEZUVJQX-BXOOBUKZSA-N	610.246120286							104502
BRD-K89811208	LSM-15867		54633144	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24-/m0/s1	JPQILOCSRFKHEV-SRGWNRLKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccccc3F	BroadT	BRD-K89811208	BRD-K89811208-001-01-7	Broad Institute of MIT and Harvard	BRD-K89811208			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1F	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24-/m0/s1	JPQILOCSRFKHEV-SRGWNRLKSA-N	485.232599354							104503
BRD-K79329532	LSM-15868		54633128	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19-/m0/s1	PXLHMJKVTIIEQJ-KHYOSLBOSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K79329532	BRD-K79329532-001-01-9	Broad Institute of MIT and Harvard	BRD-K79329532			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-18-17(9-16)20(26)25(5)11-19(28-6)14(3)10-22-15(4)12-29-18/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19-/m0/s1	PXLHMJKVTIIEQJ-KHYOSLBOSA-N	406.258005608							104504
BRD-K62620616	LSM-15869		54633014	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16-,20-/m1/s1	SSHPSTSVPAJXGJ-JXXFODFXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K62620616	BRD-K62620616-001-01-9	Broad Institute of MIT and Harvard	BRD-K62620616			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16-,20-/m1/s1	SSHPSTSVPAJXGJ-JXXFODFXSA-N	479.220239896							104505
BRD-K99000702	LSM-15870		54633096	InChI=1S/C26H40N4O5/c1-17-13-30(24(31)15-28(3)4)18(2)16-35-22-12-20(27-25(32)19-8-7-9-19)10-11-21(22)26(33)29(5)14-23(17)34-6/h10-12,17-19,23H,7-9,13-16H2,1-6H3,(H,27,32)/t17-,18-,23+/m1/s1	OGUHNRNBJHRPNW-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K99000702	BRD-K99000702-001-01-6	Broad Institute of MIT and Harvard	BRD-K99000702			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C26H40N4O5/c1-17-13-30(24(31)15-28(3)4)18(2)16-35-22-12-20(27-25(32)19-8-7-9-19)10-11-21(22)26(33)29(5)14-23(17)34-6/h10-12,17-19,23H,7-9,13-16H2,1-6H3,(H,27,32)/t17-,18-,23+/m1/s1	OGUHNRNBJHRPNW-PNCHPQGNSA-N	488.29987042							104506
BRD-K83586473	LSM-15871		54632939	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-11-17(22-30(6,26)27)8-9-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20+/m0/s1	GJWLNKOJEVXCCA-RZQQEMMASA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K83586473	BRD-K83586473-001-01-9	Broad Institute of MIT and Harvard	BRD-K83586473			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H]1C)OC	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-11-17(22-30(6,26)27)8-9-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20+/m0/s1	GJWLNKOJEVXCCA-RZQQEMMASA-N	441.22974194							104507
BRD-K12841150	LSM-15872		54632890	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17-,21-/m0/s1	WKMZWDZZZDEYCM-FIKGOQFSSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K12841150	BRD-K12841150-001-01-4	Broad Institute of MIT and Harvard	BRD-K12841150			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17-,21-/m0/s1	WKMZWDZZZDEYCM-FIKGOQFSSA-N	462.284220356							104508
BRD-K84716908	LSM-15873		54632914	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25-/m0/s1	FHXMSJACTAYBFY-DFIYOIEZSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K84716908	BRD-K84716908-001-01-6	Broad Institute of MIT and Harvard	BRD-K84716908			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25-/m0/s1	FHXMSJACTAYBFY-DFIYOIEZSA-N	497.300204778							104509
BRD-K93457574	LSM-15874		54633017	InChI=1S/C25H37N5O5/c1-16(2)27-25(32)28-19-7-8-21-22(9-19)35-13-18(4)30(11-20-14-34-15-26-20)10-17(3)23(33-6)12-29(5)24(21)31/h7-9,14-18,23H,10-13H2,1-6H3,(H2,27,28,32)/t17-,18-,23+/m1/s1	BBWOUVGAXSHUEL-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(Cc3cocn3)C[C@H]1C	BroadT	BRD-K93457574	BRD-K93457574-001-01-9	Broad Institute of MIT and Harvard	BRD-K93457574			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(Cc2cocn2)C[C@H]1C	InChI=1S/C25H37N5O5/c1-16(2)27-25(32)28-19-7-8-21-22(9-19)35-13-18(4)30(11-20-14-34-15-26-20)10-17(3)23(33-6)12-29(5)24(21)31/h7-9,14-18,23H,10-13H2,1-6H3,(H2,27,28,32)/t17-,18-,23+/m1/s1	BBWOUVGAXSHUEL-PNCHPQGNSA-N	487.279469334							104510
BRD-K27331198	LSM-15875		54633122	InChI=1S/C24H34N4O5S/c1-17-13-28(14-20-8-6-7-11-25-20)18(2)16-33-22-12-19(26-34(5,30)31)9-10-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18+,23-/m0/s1	VKVFXZDQZTZVBL-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H]1C	BroadT	BRD-K27331198	BRD-K27331198-001-01-3	Broad Institute of MIT and Harvard	BRD-K27331198			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C24H34N4O5S/c1-17-13-28(14-20-8-6-7-11-25-20)18(2)16-33-22-12-19(26-34(5,30)31)9-10-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18+,23-/m0/s1	VKVFXZDQZTZVBL-IXFSTUDKSA-N	490.224990918							104511
BRD-K27991961	LSM-15876		54633033	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19-,25+/m1/s1	YEIJZPFIQUPCSE-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@H]1C	BroadT	BRD-K27991961	BRD-K27991961-001-01-9	Broad Institute of MIT and Harvard	BRD-K27991961			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19-,25+/m1/s1	YEIJZPFIQUPCSE-RRQZXNHTSA-N	459.309706822							104512
BRD-K16207499	LSM-15877		54632944	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22+/m1/s1	NMVKSNPKIBDAFP-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K16207499	BRD-K16207499-001-01-4	Broad Institute of MIT and Harvard	BRD-K16207499			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22+/m1/s1	NMVKSNPKIBDAFP-VVBPWWLESA-N	443.22203467							104513
BRD-K78762661	LSM-15878		54632930	InChI=1S/C26H39N3O6/c1-6-24(30)29-14-17(2)23(33-5)15-28(4)26(32)21-8-7-20(13-22(21)35-16-18(29)3)27-25(31)19-9-11-34-12-10-19/h7-8,13,17-19,23H,6,9-12,14-16H2,1-5H3,(H,27,31)/t17-,18-,23+/m1/s1	MDHLDPDUZLKUJE-PNCHPQGNSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K78762661	BRD-K78762661-001-01-5	Broad Institute of MIT and Harvard	BRD-K78762661			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	InChI=1S/C26H39N3O6/c1-6-24(30)29-14-17(2)23(33-5)15-28(4)26(32)21-8-7-20(13-22(21)35-16-18(29)3)27-25(31)19-9-11-34-12-10-19/h7-8,13,17-19,23H,6,9-12,14-16H2,1-5H3,(H,27,31)/t17-,18-,23+/m1/s1	MDHLDPDUZLKUJE-PNCHPQGNSA-N	489.283885998							104514
BRD-K68985225	LSM-15879		54632962	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25-/m0/s1	DCHCVUMEJAAHBI-DFIYOIEZSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K68985225	BRD-K68985225-001-01-3	Broad Institute of MIT and Harvard	BRD-K68985225			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-7-8-24-23(14-22)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-21-9-12-28-13-10-21/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25-/m0/s1	DCHCVUMEJAAHBI-DFIYOIEZSA-N	497.300204778							104515
BRD-K36531580	LSM-15880		54633137	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m1/s1	JPYQBBUSLGAIKR-QWQRMKEZSA-N	COCC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K36531580	BRD-K36531580-001-01-3	Broad Institute of MIT and Harvard	BRD-K36531580			COCC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m1/s1	JPYQBBUSLGAIKR-QWQRMKEZSA-N	393.226371122							104516
BRD-K58310485	LSM-15881		54633160	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26-/m1/s1	WREZSNUYDZQHHD-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K58310485	BRD-K58310485-001-01-1	Broad Institute of MIT and Harvard	BRD-K58310485			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26-/m1/s1	WREZSNUYDZQHHD-XMERXJNXSA-N	479.278406694							104517
BRD-K77624847	LSM-15882		54633165	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21+/m0/s1	ORSJUXOXPPDIAU-CKJXQJPGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K77624847	BRD-K77624847-001-01-5	Broad Institute of MIT and Harvard	BRD-K77624847			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-10-18(24-17(3)28)8-9-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21+/m0/s1	ORSJUXOXPPDIAU-CKJXQJPGSA-N	448.268570292							104518
BRD-K34980742	LSM-15883		54632998	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16+,20+/m0/s1	VUTYSYZKXJFCMD-RZQQEMMASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K34980742	BRD-K34980742-001-01-9	Broad Institute of MIT and Harvard	BRD-K34980742			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16+,20+/m0/s1	VUTYSYZKXJFCMD-RZQQEMMASA-N	484.235555602							104519
BRD-K27111500	LSM-15884		54632933	InChI=1S/C26H39N3O6/c1-6-24(30)29-14-17(2)23(33-5)15-28(4)26(32)21-8-7-20(13-22(21)35-16-18(29)3)27-25(31)19-9-11-34-12-10-19/h7-8,13,17-19,23H,6,9-12,14-16H2,1-5H3,(H,27,31)/t17-,18-,23-/m1/s1	MDHLDPDUZLKUJE-PMAPCBKXSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K27111500	BRD-K27111500-001-01-2	Broad Institute of MIT and Harvard	BRD-K27111500			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	InChI=1S/C26H39N3O6/c1-6-24(30)29-14-17(2)23(33-5)15-28(4)26(32)21-8-7-20(13-22(21)35-16-18(29)3)27-25(31)19-9-11-34-12-10-19/h7-8,13,17-19,23H,6,9-12,14-16H2,1-5H3,(H,27,31)/t17-,18-,23-/m1/s1	MDHLDPDUZLKUJE-PMAPCBKXSA-N	489.283885998							104520
BRD-K68562280	LSM-15885		54633016	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16+,20-/m1/s1	SSHPSTSVPAJXGJ-GQIGUUNPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K68562280	BRD-K68562280-001-01-2	Broad Institute of MIT and Harvard	BRD-K68562280			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16+,20-/m1/s1	SSHPSTSVPAJXGJ-GQIGUUNPSA-N	479.220239896							104521
BRD-K93044218	LSM-15886		54632996	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16-,20+/m1/s1	VUTYSYZKXJFCMD-QINHECLXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K93044218	BRD-K93044218-001-01-7	Broad Institute of MIT and Harvard	BRD-K93044218			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)26-11-15(3)20(31-6)12-25(5)21(27)18-10-17(24-33(7,29)30)8-9-19(18)32-13-16(26)4/h8-10,14-16,20,24H,11-13H2,1-7H3,(H,23,28)/t15-,16-,20+/m1/s1	VUTYSYZKXJFCMD-QINHECLXSA-N	484.235555602							104522
BRD-K82927098	LSM-15887		54633078	InChI=1S/C31H38N4O7S/c1-21-18-35(30(36)14-23-8-7-13-32-17-23)22(2)20-42-28-15-24(11-12-27(28)31(37)34(3)19-29(21)41-5)33-43(38,39)26-10-6-9-25(16-26)40-4/h6-13,15-17,21-22,29,33H,14,18-20H2,1-5H3/t21-,22+,29+/m0/s1	CTXMNAKEZUVJQX-DKGMKSHISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K82927098	BRD-K82927098-001-01-1	Broad Institute of MIT and Harvard	BRD-K82927098			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc1cccnc1	InChI=1S/C31H38N4O7S/c1-21-18-35(30(36)14-23-8-7-13-32-17-23)22(2)20-42-28-15-24(11-12-27(28)31(37)34(3)19-29(21)41-5)33-43(38,39)26-10-6-9-25(16-26)40-4/h6-13,15-17,21-22,29,33H,14,18-20H2,1-5H3/t21-,22+,29+/m0/s1	CTXMNAKEZUVJQX-DKGMKSHISA-N	610.246120286							104523
BRD-K90872016	LSM-15888		54633116	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17+,23-/m1/s1	YOWCQSGRJVNXNF-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K90872016	BRD-K90872016-001-01-8	Broad Institute of MIT and Harvard	BRD-K90872016			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCC3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C25H37N3O5/c1-16-13-28(18(3)29)17(2)15-33-22-11-10-20(26-24(30)19-8-6-7-9-19)12-21(22)25(31)27(4)14-23(16)32-5/h10-12,16-17,19,23H,6-9,13-15H2,1-5H3,(H,26,30)/t16-,17+,23-/m1/s1	YOWCQSGRJVNXNF-SAHWJRBASA-N	459.273321314							104524
BRD-K57972271	LSM-15889		54633015	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16+,20-/m0/s1	SSHPSTSVPAJXGJ-YRNRMSPPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K57972271	BRD-K57972271-001-01-7	Broad Institute of MIT and Harvard	BRD-K57972271			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C22H33N5O5S/c1-15-10-26(4)16(2)13-32-19-8-7-17(24-33(29,30)21-12-25(3)14-23-21)9-18(19)22(28)27(5)11-20(15)31-6/h7-9,12,14-16,20,24H,10-11,13H2,1-6H3/t15-,16+,20-/m0/s1	SSHPSTSVPAJXGJ-YRNRMSPPSA-N	479.220239896							104525
BRD-K94277689	LSM-15890		54633088	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16+,22-/m1/s1	ILZDYFIBDLQWDD-ZMPRRUGASA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H]1C)OC	BroadT	BRD-K94277689	BRD-K94277689-001-01-2	Broad Institute of MIT and Harvard	BRD-K94277689			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H]1C)OC	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16+,22-/m1/s1	ILZDYFIBDLQWDD-ZMPRRUGASA-N	486.247834848							104526
BRD-K44908880	LSM-15891		54632909	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25+/m0/s1	FHXMSJACTAYBFY-ZYLNGJIFSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K44908880	BRD-K44908880-001-01-0	Broad Institute of MIT and Harvard	BRD-K44908880			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25+/m0/s1	FHXMSJACTAYBFY-ZYLNGJIFSA-N	497.300204778							104527
BRD-K34602185	LSM-15892		54632915	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25-/m1/s1	FHXMSJACTAYBFY-OHUGHZGNSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K34602185	BRD-K34602185-001-01-3	Broad Institute of MIT and Harvard	BRD-K34602185			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H39N5O4/c1-6-12-29-27(34)30-21-10-11-24-23(14-21)26(33)31(4)17-25(35-5)19(2)15-32(20(3)18-36-24)16-22-9-7-8-13-28-22/h7-11,13-14,19-20,25H,6,12,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25-/m1/s1	FHXMSJACTAYBFY-OHUGHZGNSA-N	497.300204778							104528
BRD-K87081444	LSM-15893		54633155	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26+/m1/s1	WREZSNUYDZQHHD-KYTVRQNUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K87081444	BRD-K87081444-001-01-3	Broad Institute of MIT and Harvard	BRD-K87081444			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-10-11-21)20(2)18-35-25-13-12-23(29-27(32)22-8-6-5-7-9-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26+/m1/s1	WREZSNUYDZQHHD-KYTVRQNUSA-N	479.278406694							104529
BRD-K81281620	LSM-15894		54633057	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-6-5-7-22(29)12-20)19(2)17-36-25-13-23(30-27(33)21-8-9-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-19,21,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26-/m0/s1	FZYPJVOXNKMGKY-ANSQWYIGSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc4cccc(F)c4)C[C@@H]1C	BroadT	BRD-K81281620	BRD-K81281620-001-01-1	Broad Institute of MIT and Harvard	BRD-K81281620			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc2cccc(F)c2)C[C@@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-6-5-7-22(29)12-20)19(2)17-36-25-13-23(30-27(33)21-8-9-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-19,21,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26-/m0/s1	FZYPJVOXNKMGKY-ANSQWYIGSA-N	497.268984862							104530
BRD-K40887375	LSM-15895		54633006	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m0/s1	TVGROYRLGTWDMS-GSHUGGBRSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K40887375	BRD-K40887375-001-01-2	Broad Institute of MIT and Harvard	BRD-K40887375			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m0/s1	TVGROYRLGTWDMS-GSHUGGBRSA-N	447.273321314							104531
BRD-K22380421	LSM-15896		54632967	InChI=1S/C23H31N5O4/c1-15-12-27(3)16(2)14-32-20-10-17(26-22(29)19-11-24-8-9-25-19)6-7-18(20)23(30)28(4)13-21(15)31-5/h6-11,15-16,21H,12-14H2,1-5H3,(H,26,29)/t15-,16-,21+/m0/s1	WHHUAOMDORXOMQ-CKJXQJPGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K22380421	BRD-K22380421-001-01-4	Broad Institute of MIT and Harvard	BRD-K22380421			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C23H31N5O4/c1-15-12-27(3)16(2)14-32-20-10-17(26-22(29)19-11-24-8-9-25-19)6-7-18(20)23(30)28(4)13-21(15)31-5/h6-11,15-16,21H,12-14H2,1-5H3,(H,26,29)/t15-,16-,21+/m0/s1	WHHUAOMDORXOMQ-CKJXQJPGSA-N	441.237604522							104532
BRD-K76713298	LSM-15897		54633079	InChI=1S/C31H38N4O7S/c1-21-18-35(30(36)14-23-8-7-13-32-17-23)22(2)20-42-28-15-24(11-12-27(28)31(37)34(3)19-29(21)41-5)33-43(38,39)26-10-6-9-25(16-26)40-4/h6-13,15-17,21-22,29,33H,14,18-20H2,1-5H3/t21-,22+,29-/m0/s1	CTXMNAKEZUVJQX-KERYWQKISA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K76713298	BRD-K76713298-001-01-1	Broad Institute of MIT and Harvard	BRD-K76713298			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc1cccnc1	InChI=1S/C31H38N4O7S/c1-21-18-35(30(36)14-23-8-7-13-32-17-23)22(2)20-42-28-15-24(11-12-27(28)31(37)34(3)19-29(21)41-5)33-43(38,39)26-10-6-9-25(16-26)40-4/h6-13,15-17,21-22,29,33H,14,18-20H2,1-5H3/t21-,22+,29-/m0/s1	CTXMNAKEZUVJQX-KERYWQKISA-N	610.246120286							104533
BRD-K57732605	LSM-15898		54633102	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26-/m1/s1	CNFQIZJMIVHXMW-UYPAYLBCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K57732605	BRD-K57732605-001-01-2	Broad Institute of MIT and Harvard	BRD-K57732605			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26-/m1/s1	CNFQIZJMIVHXMW-UYPAYLBCSA-N	612.246310674							104534
BRD-K55518911	LSM-15899		54632917	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m1/s1	POIAECOHAGPJOS-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@H]1C	BroadT	BRD-K55518911	BRD-K55518911-001-01-6	Broad Institute of MIT and Harvard	BRD-K55518911			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-7-6-10-26-12-20)18(2)16-33-23-9-8-21(27-19(3)30)11-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m1/s1	POIAECOHAGPJOS-GGUMNFRJSA-N	454.258005608							104535
BRD-K37865854	LSM-15900		54632987	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m1/s1	QPDYUGYUVJBCGY-RRQZXNHTSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K37865854	BRD-K37865854-001-01-3	Broad Institute of MIT and Harvard	BRD-K37865854			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)23-12-11-22(14-24(23)35-17-19(31)3)29-26(32)20-7-9-21(28)10-8-20/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m1/s1	QPDYUGYUVJBCGY-RRQZXNHTSA-N	485.268984862							104536
BRD-K87889654	LSM-15901		54633050	InChI=1S/C28H35N3O5/c1-18-15-31(27(33)21-10-11-21)19(2)17-36-24-14-22(29-26(32)20-8-6-5-7-9-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h5-9,12-14,18-19,21,25H,10-11,15-17H2,1-4H3,(H,29,32)/t18-,19+,25-/m0/s1	OQUNXXZCDPSMLO-CEYNDMKZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K87889654	BRD-K87889654-001-01-4	Broad Institute of MIT and Harvard	BRD-K87889654			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C28H35N3O5/c1-18-15-31(27(33)21-10-11-21)19(2)17-36-24-14-22(29-26(32)20-8-6-5-7-9-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h5-9,12-14,18-19,21,25H,10-11,15-17H2,1-4H3,(H,29,32)/t18-,19+,25-/m0/s1	OQUNXXZCDPSMLO-CEYNDMKZSA-N	493.25767125							104537
BRD-K99077411	LSM-15902		54633052	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-16-17(9-15)27-12-14(3)20-10-13(2)18(26-5)11-22(4)19(16)23/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14+,18+/m1/s1	UUGFFVUSGWAEDZ-GLJUWKHASA-N	CCS(=O)(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K99077411	BRD-K99077411-001-01-6	Broad Institute of MIT and Harvard	BRD-K99077411			CCS(=O)(=O)Nc1ccc2c(OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-16-17(9-15)27-12-14(3)20-10-13(2)18(26-5)11-22(4)19(16)23/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14+,18+/m1/s1	UUGFFVUSGWAEDZ-GLJUWKHASA-N	413.198441812							104538
BRD-K66479240	LSM-15903		54633018	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	UPGINRWREGYSMW-PMAPCBKXSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K66479240	BRD-K66479240-001-01-0	Broad Institute of MIT and Harvard	BRD-K66479240			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O6/c1-17-13-30(26(33)21-8-6-7-11-27-21)18(2)15-36-22-12-19(28-24(31)16-34-4)9-10-20(22)25(32)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	UPGINRWREGYSMW-PMAPCBKXSA-N	498.247834848							104539
BRD-K27971671	LSM-15904		54632972	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18-,25-/m1/s1	UCDDDGMWGBQWAH-QJMRKGMQSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K27971671	BRD-K27971671-001-01-2	Broad Institute of MIT and Harvard	BRD-K27971671			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18-,25-/m1/s1	UCDDDGMWGBQWAH-QJMRKGMQSA-N	526.25914846							104540
BRD-K35625946	LSM-15905		54633136	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m0/s1	JPYQBBUSLGAIKR-IYOUNJFTSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K35625946	BRD-K35625946-001-01-3	Broad Institute of MIT and Harvard	BRD-K35625946			COCC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-7-6-15(22-19(24)12-26-4)8-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m0/s1	JPYQBBUSLGAIKR-IYOUNJFTSA-N	393.226371122							104541
BRD-K14645917	LSM-15906		54633141	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24+/m1/s1	JPQILOCSRFKHEV-KCYKTTMJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccccc3F	BroadT	BRD-K14645917	BRD-K14645917-001-01-1	Broad Institute of MIT and Harvard	BRD-K14645917			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1F	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24+/m1/s1	JPQILOCSRFKHEV-KCYKTTMJSA-N	485.232599354							104542
BRD-K24170552	LSM-15907		54633046	InChI=1S/C28H35N3O5/c1-18-15-31(27(33)21-10-11-21)19(2)17-36-24-14-22(29-26(32)20-8-6-5-7-9-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h5-9,12-14,18-19,21,25H,10-11,15-17H2,1-4H3,(H,29,32)/t18-,19-,25+/m1/s1	OQUNXXZCDPSMLO-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K24170552	BRD-K24170552-001-01-8	Broad Institute of MIT and Harvard	BRD-K24170552			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C28H35N3O5/c1-18-15-31(27(33)21-10-11-21)19(2)17-36-24-14-22(29-26(32)20-8-6-5-7-9-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h5-9,12-14,18-19,21,25H,10-11,15-17H2,1-4H3,(H,29,32)/t18-,19-,25+/m1/s1	OQUNXXZCDPSMLO-RRQZXNHTSA-N	493.25767125							104543
BRD-K25559116	LSM-15908		54633051	InChI=1S/C28H35N3O5/c1-18-15-31(27(33)21-10-11-21)19(2)17-36-24-14-22(29-26(32)20-8-6-5-7-9-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h5-9,12-14,18-19,21,25H,10-11,15-17H2,1-4H3,(H,29,32)/t18-,19+,25-/m1/s1	OQUNXXZCDPSMLO-HHJKRLRDSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K25559116	BRD-K25559116-001-01-0	Broad Institute of MIT and Harvard	BRD-K25559116			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C28H35N3O5/c1-18-15-31(27(33)21-10-11-21)19(2)17-36-24-14-22(29-26(32)20-8-6-5-7-9-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h5-9,12-14,18-19,21,25H,10-11,15-17H2,1-4H3,(H,29,32)/t18-,19+,25-/m1/s1	OQUNXXZCDPSMLO-HHJKRLRDSA-N	493.25767125							104544
MLS003650034	LSM-15909	BRD-K88831197	53382694	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18-,25+/m0/s1	UCDDDGMWGBQWAH-DPOKWSEZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K88831197	BRD-K88831197-001-01-9	Broad Institute of MIT and Harvard	BRD-K88831197			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C28H35FN4O5/c1-17-14-33(26(34)19-8-9-19)18(2)16-38-24-11-10-22(13-23(24)27(35)32(3)15-25(17)37-4)31-28(36)30-21-7-5-6-20(29)12-21/h5-7,10-13,17-19,25H,8-9,14-16H2,1-4H3,(H2,30,31,36)/t17-,18-,25+/m0/s1	UCDDDGMWGBQWAH-DPOKWSEZSA-N	526.25914846							104545
BRD-K73460574	LSM-15910		54633099	InChI=1S/C26H40N4O5/c1-17-13-30(24(31)15-28(3)4)18(2)16-35-22-12-20(27-25(32)19-8-7-9-19)10-11-21(22)26(33)29(5)14-23(17)34-6/h10-12,17-19,23H,7-9,13-16H2,1-6H3,(H,27,32)/t17-,18+,23+/m0/s1	OGUHNRNBJHRPNW-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K73460574	BRD-K73460574-001-01-7	Broad Institute of MIT and Harvard	BRD-K73460574			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C26H40N4O5/c1-17-13-30(24(31)15-28(3)4)18(2)16-35-22-12-20(27-25(32)19-8-7-9-19)10-11-21(22)26(33)29(5)14-23(17)34-6/h10-12,17-19,23H,7-9,13-16H2,1-6H3,(H,27,32)/t17-,18+,23+/m0/s1	OGUHNRNBJHRPNW-YZZKKUAISA-N	488.29987042							104546
BRD-K22606370	LSM-15911		54632907	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m0/s1	PJDHXRQRCWLMLV-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K22606370	BRD-K22606370-001-01-3	Broad Institute of MIT and Harvard	BRD-K22606370			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-11-8-19(12-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m0/s1	PJDHXRQRCWLMLV-MFEFFIJZSA-N	470.252920228							104547
BRD-K02353863	LSM-15912		54633036	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19-,25-/m0/s1	YEIJZPFIQUPCSE-MHPIHPPYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(CC3CCCCC3)C[C@@H]1C	BroadT	BRD-K02353863	BRD-K02353863-001-01-0	Broad Institute of MIT and Harvard	BRD-K02353863			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C26H41N3O4/c1-18-14-29(15-21-9-7-6-8-10-21)19(2)17-33-24-12-11-22(27-20(3)30)13-23(24)26(31)28(4)16-25(18)32-5/h11-13,18-19,21,25H,6-10,14-17H2,1-5H3,(H,27,30)/t18-,19-,25-/m0/s1	YEIJZPFIQUPCSE-MHPIHPPYSA-N	459.309706822							104548
BRD-K84094241	LSM-15913		54633145	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24-/m1/s1	JPQILOCSRFKHEV-XVTZWQNCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccccc3F	BroadT	BRD-K84094241	BRD-K84094241-001-01-4	Broad Institute of MIT and Harvard	BRD-K84094241			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1F	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24-/m1/s1	JPQILOCSRFKHEV-XVTZWQNCSA-N	485.232599354							104549
CHEMBL3186919	LSM-15914	BRD-K73110675	54633172	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22+/m1/s1	LHXFIZLNBSIVPU-HLFMIMNKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K73110675	BRD-K73110675-001-01-6	Broad Institute of MIT and Harvard	BRD-K73110675			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-8-6-16(9-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-17-5-7-19(25)20(26)10-17/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22+/m1/s1	LHXFIZLNBSIVPU-HLFMIMNKSA-N	508.1644109							104550
BRD-K70315531	LSM-15915		54633094	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	YJDVPIUPODSEFW-DFIYOIEZSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(CC3CCCCC3)[C@H](C)COc2c1	BroadT	BRD-K70315531	BRD-K70315531-001-01-8	Broad Institute of MIT and Harvard	BRD-K70315531			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CCCCC3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O4/c1-6-26(31)28-22-12-13-23-24(14-22)34-18-20(3)30(16-21-10-8-7-9-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	YJDVPIUPODSEFW-DFIYOIEZSA-N	473.325356886							104551
BRD-K22957824	LSM-15916		54633106	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26+/m0/s1	CNFQIZJMIVHXMW-CUAXAMRHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K22957824	BRD-K22957824-001-01-2	Broad Institute of MIT and Harvard	BRD-K22957824			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-12-11-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-21(31)8-10-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26+/m0/s1	CNFQIZJMIVHXMW-CUAXAMRHSA-N	612.246310674							104552
BRD-K33102216	LSM-15917		54633005	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m1/s1	TVGROYRLGTWDMS-JLHGSKIFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K33102216	BRD-K33102216-001-01-8	Broad Institute of MIT and Harvard	BRD-K33102216			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-12-19(25-23(28)18-8-10-31-11-9-18)6-7-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m1/s1	TVGROYRLGTWDMS-JLHGSKIFSA-N	447.273321314							104553
BRD-K65737790	LSM-15918		54632942	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22+/m0/s1	NMVKSNPKIBDAFP-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K65737790	BRD-K65737790-001-01-6	Broad Institute of MIT and Harvard	BRD-K65737790			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-19(27-23(29)17-5-7-18(25)8-6-17)11-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22+/m0/s1	NMVKSNPKIBDAFP-PONJGIIJSA-N	443.22203467							104554
BRD-K13110695	LSM-15919		54633059	InChI=1S/C26H33N3O8S/c1-16-12-29(25(30)18-6-9-21-23(10-18)37-15-36-21)17(2)14-35-22-11-19(27-38(5,32)33)7-8-20(22)26(31)28(3)13-24(16)34-4/h6-11,16-17,24,27H,12-15H2,1-5H3/t16-,17-,24-/m1/s1	JZGYUICVYOVPMO-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K13110695	BRD-K13110695-001-01-5	Broad Institute of MIT and Harvard	BRD-K13110695			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccc2OCOc2c1	InChI=1S/C26H33N3O8S/c1-16-12-29(25(30)18-6-9-21-23(10-18)37-15-36-21)17(2)14-35-22-11-19(27-38(5,32)33)7-8-20(22)26(31)28(3)13-24(16)34-4/h6-11,16-17,24,27H,12-15H2,1-5H3/t16-,17-,24-/m1/s1	JZGYUICVYOVPMO-HOZJOUCCSA-N	547.198835736							104555
BRD-K05065044-001-01-9	LSM-15920	BRD-K05065044	54632891	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17-,21-/m1/s1	WKMZWDZZZDEYCM-CBGDNZLLSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K05065044	BRD-K05065044-001-01-9	Broad Institute of MIT and Harvard	BRD-K05065044			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17-,21-/m1/s1	WKMZWDZZZDEYCM-CBGDNZLLSA-N	462.284220356							104556
BRD-K94993773	LSM-15921		54633178	InChI=1S/C28H37N3O6/c1-6-11-31-14-18(2)26(34-5)15-30(4)28(33)22-13-21(8-10-23(22)35-16-19(31)3)29-27(32)20-7-9-24-25(12-20)37-17-36-24/h7-10,12-13,18-19,26H,6,11,14-17H2,1-5H3,(H,29,32)/t18-,19-,26-/m1/s1	JXFZGCVLIHCCFN-LJKQEARRSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H]1C)OC	BroadT	BRD-K94993773	BRD-K94993773-001-01-1	Broad Institute of MIT and Harvard	BRD-K94993773			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H]1C)OC	InChI=1S/C28H37N3O6/c1-6-11-31-14-18(2)26(34-5)15-30(4)28(33)22-13-21(8-10-23(22)35-16-19(31)3)29-27(32)20-7-9-24-25(12-20)37-17-36-24/h7-10,12-13,18-19,26H,6,11,14-17H2,1-5H3,(H,29,32)/t18-,19-,26-/m1/s1	JXFZGCVLIHCCFN-LJKQEARRSA-N	511.268235934							104557
BRD-K20735575	LSM-15922		54632935	InChI=1S/C26H39N3O6/c1-6-24(30)29-14-17(2)23(33-5)15-28(4)26(32)21-8-7-20(13-22(21)35-16-18(29)3)27-25(31)19-9-11-34-12-10-19/h7-8,13,17-19,23H,6,9-12,14-16H2,1-5H3,(H,27,31)/t17-,18+,23-/m1/s1	MDHLDPDUZLKUJE-IEGUWTFLSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H]1C)OC	BroadT	BRD-K20735575	BRD-K20735575-001-01-5	Broad Institute of MIT and Harvard	BRD-K20735575			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H]1C)OC	InChI=1S/C26H39N3O6/c1-6-24(30)29-14-17(2)23(33-5)15-28(4)26(32)21-8-7-20(13-22(21)35-16-18(29)3)27-25(31)19-9-11-34-12-10-19/h7-8,13,17-19,23H,6,9-12,14-16H2,1-5H3,(H,27,31)/t17-,18+,23-/m1/s1	MDHLDPDUZLKUJE-IEGUWTFLSA-N	489.283885998							104558
BRD-K83887438	LSM-15923		54633086	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16-,22-/m0/s1	ILZDYFIBDLQWDD-WCJKSRRJSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H]1C)OC	BroadT	BRD-K83887438	BRD-K83887438-001-01-5	Broad Institute of MIT and Harvard	BRD-K83887438			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H]1C)OC	InChI=1S/C25H34N4O6/c1-7-23(30)29-12-15(2)22(33-6)13-28(5)25(32)19-9-8-18(11-21(19)34-14-16(29)3)26-24(31)20-10-17(4)35-27-20/h8-11,15-16,22H,7,12-14H2,1-6H3,(H,26,31)/t15-,16-,22-/m0/s1	ILZDYFIBDLQWDD-WCJKSRRJSA-N	486.247834848							104559
BRD-K66511507	LSM-15924		54633049	InChI=1S/C28H35N3O5/c1-18-15-31(27(33)21-10-11-21)19(2)17-36-24-14-22(29-26(32)20-8-6-5-7-9-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h5-9,12-14,18-19,21,25H,10-11,15-17H2,1-4H3,(H,29,32)/t18-,19+,25+/m0/s1	OQUNXXZCDPSMLO-OSWQYVSFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K66511507	BRD-K66511507-001-01-8	Broad Institute of MIT and Harvard	BRD-K66511507			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C28H35N3O5/c1-18-15-31(27(33)21-10-11-21)19(2)17-36-24-14-22(29-26(32)20-8-6-5-7-9-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h5-9,12-14,18-19,21,25H,10-11,15-17H2,1-4H3,(H,29,32)/t18-,19+,25+/m0/s1	OQUNXXZCDPSMLO-OSWQYVSFSA-N	493.25767125							104560
BRD-K82609503	LSM-15925		54633142	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24+/m0/s1	JPQILOCSRFKHEV-OBWXTZQISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccccc3F	BroadT	BRD-K82609503	BRD-K82609503-001-01-4	Broad Institute of MIT and Harvard	BRD-K82609503			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1F	InChI=1S/C26H32FN3O5/c1-16-13-30(26(33)20-8-6-7-9-22(20)27)17(2)15-35-23-12-19(28-18(3)31)10-11-21(23)25(32)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24+/m0/s1	JPQILOCSRFKHEV-OBWXTZQISA-N	485.232599354							104561
BRD-K23840704	LSM-15926		54632886	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17+,21+/m1/s1	WKMZWDZZZDEYCM-WWMYMODYSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K23840704	BRD-K23840704-001-01-4	Broad Institute of MIT and Harvard	BRD-K23840704			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)26-18-9-10-20-19(12-18)23(30)27(5)14-21(32-6)16(3)13-28(22(29)8-2)17(4)15-33-20/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H2,25,26,31)/t16-,17+,21+/m1/s1	WKMZWDZZZDEYCM-WWMYMODYSA-N	462.284220356							104562
BRD-K51295743	LSM-15927		54633065	InChI=1S/C27H35FN4O6/c1-17-13-32(27(35)30-22-9-7-6-8-21(22)28)18(2)15-38-23-12-19(29-25(33)16-36-4)10-11-20(23)26(34)31(3)14-24(17)37-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)(H,30,35)/t17-,18-,24-/m1/s1	CWZWGWHFCUYAPQ-QZTZHPFYSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)Nc3ccccc3F	BroadT	BRD-K51295743	BRD-K51295743-001-01-9	Broad Institute of MIT and Harvard	BRD-K51295743			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)Nc2ccccc2F)c1	InChI=1S/C27H35FN4O6/c1-17-13-32(27(35)30-22-9-7-6-8-21(22)28)18(2)15-38-23-12-19(29-25(33)16-36-4)10-11-20(23)26(34)31(3)14-24(17)37-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)(H,30,35)/t17-,18-,24-/m1/s1	CWZWGWHFCUYAPQ-QZTZHPFYSA-N	530.25406308							104563
BRD-K14306031	LSM-15928		54632881	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m1/s1	WMGIIIYIYFXVGX-IMWIBFENSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCOCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K14306031	BRD-K14306031-001-01-1	Broad Institute of MIT and Harvard	BRD-K14306031			CCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCOCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H41N3O5/c1-6-25(30)27-21-7-8-23-22(13-21)26(31)28(4)16-24(32-5)18(2)14-29(19(3)17-34-23)15-20-9-11-33-12-10-20/h7-8,13,18-20,24H,6,9-12,14-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m1/s1	WMGIIIYIYFXVGX-IMWIBFENSA-N	475.304621442							104564
BRD-K25642189	LSM-15929		54633187	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21-,26+/m0/s1	PEHKQIRDOAVSKY-ISJBWFOZSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K25642189	BRD-K25642189-001-01-6	Broad Institute of MIT and Harvard	BRD-K25642189			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21-,26+/m0/s1	PEHKQIRDOAVSKY-ISJBWFOZSA-N	481.294056758							104565
BRD-K13714335	LSM-9259		54631902	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23+/m1/s1	FNBLPFIHIJQMKK-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C3CCC3	BroadT	BRD-K13714335	BRD-K13714335-001-01-0	Broad Institute of MIT and Harvard	BRD-K13714335			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CCC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23+/m1/s1	FNBLPFIHIJQMKK-STSQHVNTSA-N	488.29987042							97880
BRD-K28777623	LSM-10174		54631623	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24+,31-/m1/s1	OXAYHDRNXZXDOZ-ULPIOCOXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K28777623	BRD-K28777623-001-01-1	Broad Institute of MIT and Harvard	BRD-K28777623			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24+,31-/m1/s1	OXAYHDRNXZXDOZ-ULPIOCOXSA-N	559.304621442							98795
BRD-K79118917	LSM-13263		54631896	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18+,23+/m0/s1	RIFMDYVXBSMSIP-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K79118917	BRD-K79118917-001-01-1	Broad Institute of MIT and Harvard	BRD-K79118917			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18+,23+/m0/s1	RIFMDYVXBSMSIP-YZZKKUAISA-N	439.247106566							101902
BRD-K38304019	LSM-10747		54631615	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14+,20-/m0/s1	RYHWAKGNXXOPFN-MNVSYLFESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K38304019	BRD-K38304019-001-01-4	Broad Institute of MIT and Harvard	BRD-K38304019			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14+,20-/m0/s1	RYHWAKGNXXOPFN-MNVSYLFESA-N	459.248169206							99368
BRD-K38547930	LSM-10766		54631772	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20+,25+/m0/s1	HWYKCLATECFWDF-WZOHSFFVSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K38547930	BRD-K38547930-001-01-4	Broad Institute of MIT and Harvard	BRD-K38547930			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H]1C)OC	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20+,25+/m0/s1	HWYKCLATECFWDF-WZOHSFFVSA-N	503.245392004							99387
BRD-K38557047	LSM-10767		54631671	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14+,20+/m1/s1	JSRBXIHVEPNVJQ-CKNLXJGOSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K38557047	BRD-K38557047-001-01-3	Broad Institute of MIT and Harvard	BRD-K38557047			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14+,20+/m1/s1	JSRBXIHVEPNVJQ-CKNLXJGOSA-N	430.2216201							99388
BRD-K78954318	LSM-13251		54631874	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19-,24+/m0/s1	IQLGILJFFYEPBE-AXHZCLLHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(CC3CCCCC3)C[C@@H]1C	BroadT	BRD-K78954318	BRD-K78954318-001-01-5	Broad Institute of MIT and Harvard	BRD-K78954318			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19-,24+/m0/s1	IQLGILJFFYEPBE-AXHZCLLHSA-N	563.2640767							101890
BRD-K86888602	LSM-13758		54631677	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17+,24-/m1/s1	VFFXTZRIOLHXNX-XVTZWQNCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K86888602	BRD-K86888602-001-01-0	Broad Institute of MIT and Harvard	BRD-K86888602			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17+,24-/m1/s1	VFFXTZRIOLHXNX-XVTZWQNCSA-N	484.268570292							102407
BRD-K90960272	LSM-14029		54631768	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21-,27-/m0/s1	WKDBULKSLWTRKP-IZVMNLJQSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(Cc4cccnc4)C[C@@H]1C	BroadT	BRD-K90960272	BRD-K90960272-001-01-0	Broad Institute of MIT and Harvard	BRD-K90960272			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21-,27-/m0/s1	WKDBULKSLWTRKP-IZVMNLJQSA-N	524.29987042							102682
BRD-K16752930	LSM-9441		54631754	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18-,22+/m0/s1	REUNTGUOEHKOBZ-NPPFBWRTSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)CN(C)C	BroadT	BRD-K16752930	BRD-K16752930-001-01-6	Broad Institute of MIT and Harvard	BRD-K16752930			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CN(C)C)c1	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18-,22+/m0/s1	REUNTGUOEHKOBZ-NPPFBWRTSA-N	476.29987042							98062
BRD-K75985729	LSM-13075		54631719	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24-/m1/s1	FPIGUEAYUNMTQH-QZTZHPFYSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K75985729	BRD-K75985729-001-01-5	Broad Institute of MIT and Harvard	BRD-K75985729			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H]1C)OC	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24-/m1/s1	FPIGUEAYUNMTQH-QZTZHPFYSA-N	530.22959797							131215
BRD-K73898073	LSM-12956		54631727	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19+,26+/m1/s1	ZMJDYVBEASXUEV-MVYHEMRASA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@H]1C	BroadT	BRD-K73898073	BRD-K73898073-001-01-4	Broad Institute of MIT and Harvard	BRD-K73898073			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2ccccc2OC)C[C@H]1C	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19+,26+/m1/s1	ZMJDYVBEASXUEV-MVYHEMRASA-N	483.273321314							101593
BRD-K75486920	LSM-13049		54631816	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21+,27-/m1/s1	WKDBULKSLWTRKP-PBDKAQRYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K75486920	BRD-K75486920-001-01-1	Broad Institute of MIT and Harvard	BRD-K75486920			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21+,27-/m1/s1	WKDBULKSLWTRKP-PBDKAQRYSA-N	524.29987042							101686
BRD-K95489112	LSM-14282		54631682	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22+,29-/m0/s1	QUELGMPZNWRZSJ-KERYWQKISA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K95489112	BRD-K95489112-001-01-9	Broad Institute of MIT and Harvard	BRD-K95489112			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1F	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22+,29-/m0/s1	QUELGMPZNWRZSJ-KERYWQKISA-N	561.263899482							102936
BRD-K84702181	LSM-13605		54631743	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16+,20+/m1/s1	QTXSGNVPDCTZEW-GUXCAODWSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K84702181	BRD-K84702181-001-01-4	Broad Institute of MIT and Harvard	BRD-K84702181			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16+,20+/m1/s1	QTXSGNVPDCTZEW-GUXCAODWSA-N	509.217126508							102250
BRD-K39906469	LSM-10863		54631746	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	AICRRUIGWBNRBB-IMWIBFENSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K39906469	BRD-K39906469-001-01-0	Broad Institute of MIT and Harvard	BRD-K39906469			CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	AICRRUIGWBNRBB-IMWIBFENSA-N	468.273655672							99484
MLS003650042	LSM-13279	BRD-K79367177	53382701	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19-,24+/m0/s1	UGPRBZOFAYTTOL-AXHZCLLHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN4CCOCC4	BroadT	BRD-K79367177	BRD-K79367177-001-01-9	Broad Institute of MIT and Harvard	BRD-K79367177			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN1CCOCC1	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19-,24+/m0/s1	UGPRBZOFAYTTOL-AXHZCLLHSA-N	516.29478504							101918
BRD-K01547088	LSM-8529		54631676	InChI=1S/C23H33N5O5S/c1-16-11-28(12-18-9-24-15-25-10-18)17(2)14-33-21-7-6-19(26-34(5,30)31)8-20(21)23(29)27(3)13-22(16)32-4/h6-10,15-17,22,26H,11-14H2,1-5H3/t16-,17-,22-/m0/s1	VPVAZUBGKWFEKV-HOIFWPIMSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H]1C	BroadT	BRD-K01547088	BRD-K01547088-001-01-7	Broad Institute of MIT and Harvard	BRD-K01547088			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C23H33N5O5S/c1-16-11-28(12-18-9-24-15-25-10-18)17(2)14-33-21-7-6-19(26-34(5,30)31)8-20(21)23(29)27(3)13-22(16)32-4/h6-10,15-17,22,26H,11-14H2,1-5H3/t16-,17-,22-/m0/s1	VPVAZUBGKWFEKV-HOIFWPIMSA-N	491.220239896							97150
CHEMBL3185492	LSM-11417	BRD-K49166646	54631811	InChI=1S/C30H35N3O4/c1-20-17-31-21(2)19-37-27-16-25(14-15-26(27)30(35)33(3)18-28(20)36-4)32-29(34)24-12-10-23(11-13-24)22-8-6-5-7-9-22/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28-/m0/s1	HAJBOXZNCGYLAF-GTNJKRJXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(cc3)c4ccccc4)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K49166646	BRD-K49166646-001-01-5	Broad Institute of MIT and Harvard	BRD-K49166646			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(cc3)-c3ccccc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C30H35N3O4/c1-20-17-31-21(2)19-37-27-16-25(14-15-26(27)30(35)33(3)18-28(20)36-4)32-29(34)24-12-10-23(11-13-24)22-8-6-5-7-9-22/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28-/m0/s1	HAJBOXZNCGYLAF-GTNJKRJXSA-N	501.26275663							100038
BRD-K74506609	LSM-12989		54631778	InChI=1S/C29H39N3O6/c1-6-9-27(33)30-22-12-13-25-24(14-22)28(34)31(4)17-26(37-5)19(2)15-32(20(3)18-38-25)16-21-10-7-8-11-23(21)29(35)36/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)(H,35,36)/t19-,20-,26-/m1/s1	CYLUOSZFPYOXRH-XMERXJNXSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3C(=O)O)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K74506609	BRD-K74506609-001-01-5	Broad Institute of MIT and Harvard	BRD-K74506609			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3C(O)=O)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C29H39N3O6/c1-6-9-27(33)30-22-12-13-25-24(14-22)28(34)31(4)17-26(37-5)19(2)15-32(20(3)18-38-25)16-21-10-7-8-11-23(21)29(35)36/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)(H,35,36)/t19-,20-,26-/m1/s1	CYLUOSZFPYOXRH-XMERXJNXSA-N	525.283885998							101626
CHEMBL2355299	LSM-11579	SID131428047, BRD-K51538472	54631804	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m0/s1	JFYAEFCKASRCBE-JXQFQVJHSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3	BroadT	BRD-K51538472	BRD-K51538472-001-01-9	Broad Institute of MIT and Harvard	BRD-K51538472			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m0/s1	JFYAEFCKASRCBE-JXQFQVJHSA-N	497.25258587							100202
BRD-K69487032	LSM-12666		54631877	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20+,25+/m1/s1	HWYKCLATECFWDF-RNHFSVANSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K69487032	BRD-K69487032-001-01-2	Broad Institute of MIT and Harvard	BRD-K69487032			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20+,25+/m1/s1	HWYKCLATECFWDF-RNHFSVANSA-N	503.245392004							101300
BRD-K39056847	LSM-10796		54631602	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16-,22-/m0/s1	PQYPJTAQDSWLTB-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3cnccn3	BroadT	BRD-K39056847	BRD-K39056847-001-01-7	Broad Institute of MIT and Harvard	BRD-K39056847			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1cnccn1	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16-,22-/m0/s1	PQYPJTAQDSWLTB-WCJKSRRJSA-N	469.232519142							99417
BRD-K95722922	LSM-14299		54631825	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18+,23-/m0/s1	RIFMDYVXBSMSIP-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K95722922	BRD-K95722922-001-01-3	Broad Institute of MIT and Harvard	BRD-K95722922			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18+,23-/m0/s1	RIFMDYVXBSMSIP-IXFSTUDKSA-N	439.247106566							102953
BRD-K88762178	LSM-13883		54631759	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m1/s1	AICRRUIGWBNRBB-KHCICDEESA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K88762178	BRD-K88762178-001-01-9	Broad Institute of MIT and Harvard	BRD-K88762178			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m1/s1	AICRRUIGWBNRBB-KHCICDEESA-N	468.273655672							102536
BRD-K43717413	LSM-11095		54631773	InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13-,17+/m0/s1	BGDCTPQGAPJUMB-GDZNZVCISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K43717413	BRD-K43717413-001-01-2	Broad Institute of MIT and Harvard	BRD-K43717413			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13-,17+/m0/s1	BGDCTPQGAPJUMB-GDZNZVCISA-N	467.170176316							99716
BRD-K48860322	LSM-11402		54631906	InChI=1S/C28H39N3O4/c1-6-27(32)29-23-12-13-24-25(16-23)35-19-21(3)31(15-14-22-10-8-7-9-11-22)17-20(2)26(34-5)18-30(4)28(24)33/h7-13,16,20-21,26H,6,14-15,17-19H2,1-5H3,(H,29,32)/t20-,21+,26-/m0/s1	IOFIBAZLXDARLU-UZINWLIJSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(CCc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K48860322	BRD-K48860322-001-01-5	Broad Institute of MIT and Harvard	BRD-K48860322			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(CCc3ccccc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C28H39N3O4/c1-6-27(32)29-23-12-13-24-25(16-23)35-19-21(3)31(15-14-22-10-8-7-9-11-22)17-20(2)26(34-5)18-30(4)28(24)33/h7-13,16,20-21,26H,6,14-15,17-19H2,1-5H3,(H,29,32)/t20-,21+,26-/m0/s1	IOFIBAZLXDARLU-UZINWLIJSA-N	481.294056758							100023
BRD-K73504196	LSM-12932		54631734	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	JFYAEFCKASRCBE-AXHZCLLHSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3	BroadT	BRD-K73504196	BRD-K73504196-001-01-0	Broad Institute of MIT and Harvard	BRD-K73504196			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	JFYAEFCKASRCBE-AXHZCLLHSA-N	497.25258587							101569
BRD-K57616212	LSM-11915		54631845	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15-,19+/m0/s1	ALCDIEWMKTXBKO-YZVOILCLSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K57616212	BRD-K57616212-001-01-2	Broad Institute of MIT and Harvard	BRD-K57616212			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H]1C)OC	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15-,19+/m0/s1	ALCDIEWMKTXBKO-YZVOILCLSA-N	471.203921116							100541
BRD-K78226445	LSM-13211		54631884	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22-/m0/s1	FAXXRWNSKSYYIM-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K78226445	BRD-K78226445-001-01-4	Broad Institute of MIT and Harvard	BRD-K78226445			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22-/m0/s1	FAXXRWNSKSYYIM-WCJKSRRJSA-N	479.18901998							101849
BRD-K28489983	LSM-10152		54631847	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m1/s1	HGUJNTNFLCOWHI-RRQZXNHTSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H]1C)OC	BroadT	BRD-K28489983	BRD-K28489983-001-01-7	Broad Institute of MIT and Harvard	BRD-K28489983			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m1/s1	HGUJNTNFLCOWHI-RRQZXNHTSA-N	485.268984862							98773
BRD-K94579454	LSM-14224		54631788	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24+,31+/m1/s1	OXAYHDRNXZXDOZ-OXYPMYLPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K94579454	BRD-K94579454-001-01-4	Broad Institute of MIT and Harvard	BRD-K94579454			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24+,31+/m1/s1	OXAYHDRNXZXDOZ-OXYPMYLPSA-N	559.304621442							102878
BRD-K41641829	LSM-10957		54631729	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25-/m1/s1	NNPXJSNOAUXSRD-QJMRKGMQSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K41641829	BRD-K41641829-001-01-4	Broad Institute of MIT and Harvard	BRD-K41641829			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25-/m1/s1	NNPXJSNOAUXSRD-QJMRKGMQSA-N	497.25258587							99578
BRD-K03891150	LSM-8672		54631641	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m1/s1	HGUJNTNFLCOWHI-WYEJZRMESA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H]1C)OC	BroadT	BRD-K03891150	BRD-K03891150-001-01-0	Broad Institute of MIT and Harvard	BRD-K03891150			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m1/s1	HGUJNTNFLCOWHI-WYEJZRMESA-N	485.268984862							97293
BRD-K97986353	LSM-14451		54631638	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19-,25+/m1/s1	YQOYUVQVCGNRJC-RRQZXNHTSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K97986353	BRD-K97986353-001-01-0	Broad Institute of MIT and Harvard	BRD-K97986353			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H]1C)OC	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19-,25+/m1/s1	YQOYUVQVCGNRJC-RRQZXNHTSA-N	527.263150554							103106
BRD-K30860517	LSM-10291		54631864	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17-,22+/m0/s1	VZMYSNMKMPUTCO-PNLZDCPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K30860517	BRD-K30860517-001-01-0	Broad Institute of MIT and Harvard	BRD-K30860517			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17-,22+/m0/s1	VZMYSNMKMPUTCO-PNLZDCPESA-N	491.209006496							98912
BRD-K09700964	LSM-9020		54631715	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24-/m1/s1	FPIGUEAYUNMTQH-NXMSCROESA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K09700964	BRD-K09700964-001-01-3	Broad Institute of MIT and Harvard	BRD-K09700964			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24-/m1/s1	FPIGUEAYUNMTQH-NXMSCROESA-N	530.22959797							97641
BRD-K50608366	LSM-11506		54631777	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24+/m1/s1	FPIGUEAYUNMTQH-YTZAWJCFSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K50608366	BRD-K50608366-001-01-0	Broad Institute of MIT and Harvard	BRD-K50608366			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24+/m1/s1	FPIGUEAYUNMTQH-YTZAWJCFSA-N	530.22959797							100127
BRD-K01624114	LSM-8539		54631704	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15-,19-/m0/s1	ALCDIEWMKTXBKO-DOXZYTNZSA-N	COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K01624114	BRD-K01624114-001-01-2	Broad Institute of MIT and Harvard	BRD-K01624114			COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H]1C)OC	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15-,19-/m0/s1	ALCDIEWMKTXBKO-DOXZYTNZSA-N	471.203921116							97160
BRD-K72872827	LSM-12890		54631911	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24+/m0/s1	MQWQDAVBIBJDRV-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K72872827	BRD-K72872827-001-01-9	Broad Institute of MIT and Harvard	BRD-K72872827			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24+/m0/s1	MQWQDAVBIBJDRV-HOOSLVGPSA-N	484.268570292							101527
BRD-K93744771	LSM-14181		54631775	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19+,24-/m0/s1	IQLGILJFFYEPBE-GLDPYIMESA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@@H]1C	BroadT	BRD-K93744771	BRD-K93744771-001-01-1	Broad Institute of MIT and Harvard	BRD-K93744771			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19+,24-/m0/s1	IQLGILJFFYEPBE-GLDPYIMESA-N	563.2640767							102835
BRD-K94889220	LSM-14247		54631667	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m1/s1	MDBZRSBKDCCZHT-JLHGSKIFSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CC3CC3)[C@@H](C)COc2c1	BroadT	BRD-K94889220	BRD-K94889220-001-01-0	Broad Institute of MIT and Harvard	BRD-K94889220			COCC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CC3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m1/s1	MDBZRSBKDCCZHT-JLHGSKIFSA-N	447.273321314							102901
BRD-K22944564	LSM-9821		54631872	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14+,20-/m1/s1	RYHWAKGNXXOPFN-LAPQFRIASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K22944564	BRD-K22944564-001-01-4	Broad Institute of MIT and Harvard	BRD-K22944564			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14+,20-/m1/s1	RYHWAKGNXXOPFN-LAPQFRIASA-N	459.248169206							98442
BRD-K86719628	LSM-13740		54631799	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15+,19+/m0/s1	ALCDIEWMKTXBKO-QMTMVMCOSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H]1C)OC	BroadT	BRD-K86719628	BRD-K86719628-001-01-7	Broad Institute of MIT and Harvard	BRD-K86719628			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H]1C)OC	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15+,19+/m0/s1	ALCDIEWMKTXBKO-QMTMVMCOSA-N	471.203921116							102389
BRD-K87300242	LSM-13780		54631846	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18+,23+/m1/s1	RIFMDYVXBSMSIP-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K87300242	BRD-K87300242-001-01-1	Broad Institute of MIT and Harvard	BRD-K87300242			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18+,23+/m1/s1	RIFMDYVXBSMSIP-STSQHVNTSA-N	439.247106566							102429
BRD-K67641117	LSM-12544		54631881	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m1/s1	ZTXXWNNQGVNFQF-KHCICDEESA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccn3	BroadT	BRD-K67641117	BRD-K67641117-001-01-4	Broad Institute of MIT and Harvard	BRD-K67641117			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccn1	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m1/s1	ZTXXWNNQGVNFQF-KHCICDEESA-N	496.268570292							101175
BRD-K28256231	LSM-10139		54631752	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25+/m1/s1	NNPXJSNOAUXSRD-UZEJHQAJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K28256231	BRD-K28256231-001-01-0	Broad Institute of MIT and Harvard	BRD-K28256231			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25+/m1/s1	NNPXJSNOAUXSRD-UZEJHQAJSA-N	497.25258587							98760
BRD-K20091307	LSM-9650		54631854	InChI=1S/C22H30N4O7S/c1-14-11-26(34(5,29)30)15(2)13-32-18-7-6-16(24-21(27)19-8-9-23-33-19)10-17(18)22(28)25(3)12-20(14)31-4/h6-10,14-15,20H,11-13H2,1-5H3,(H,24,27)/t14-,15-,20+/m1/s1	CRZDWKBDRGRNEI-SXGZJXTBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3oncc3)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K20091307	BRD-K20091307-001-01-8	Broad Institute of MIT and Harvard	BRD-K20091307			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccno3)ccc2OC[C@@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C22H30N4O7S/c1-14-11-26(34(5,29)30)15(2)13-32-18-7-6-16(24-21(27)19-8-9-23-33-19)10-17(18)22(28)25(3)12-20(14)31-4/h6-10,14-15,20H,11-13H2,1-5H3,(H,24,27)/t14-,15-,20+/m1/s1	CRZDWKBDRGRNEI-SXGZJXTBSA-N	494.18352003							98271
BRD-K69420053	LSM-12660		54631631	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24-/m0/s1	MQWQDAVBIBJDRV-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K69420053	BRD-K69420053-001-01-7	Broad Institute of MIT and Harvard	BRD-K69420053			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24-/m0/s1	MQWQDAVBIBJDRV-RHGYRFJNSA-N	484.268570292							101294
BRD-K25525438	LSM-9979		54631636	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21-,27+/m1/s1	ZEGIYGLHXRHVDM-GNMOFYLKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccccc4	BroadT	BRD-K25525438	BRD-K25525438-001-01-2	Broad Institute of MIT and Harvard	BRD-K25525438			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21-,27+/m1/s1	ZEGIYGLHXRHVDM-GNMOFYLKSA-N	537.283885998							98600
BRD-K33324635	LSM-10451		54631709	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22-,30-/m1/s1	WUHLCXCEWBJVDE-NPKFRGRUSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(Cc4ccccc4F)C[C@H]1C	BroadT	BRD-K33324635	BRD-K33324635-001-01-1	Broad Institute of MIT and Harvard	BRD-K33324635			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(Cc2ccccc2F)C[C@H]1C	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22-,30-/m1/s1	WUHLCXCEWBJVDE-NPKFRGRUSA-N	599.246534856							99072
BRD-K68236123	LSM-12588		54631688	InChI=1S/C24H38N4O4/c1-16-13-25-17(2)15-32-21-12-19(27-24(30)26-18-8-6-5-7-9-18)10-11-20(21)23(29)28(3)14-22(16)31-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H2,26,27,30)/t16-,17-,22-/m1/s1	IWXLMTPNFQAQHO-DRSNIGMVSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC3CCCCC3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K68236123	BRD-K68236123-001-01-4	Broad Institute of MIT and Harvard	BRD-K68236123			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC3CCCCC3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H38N4O4/c1-16-13-25-17(2)15-32-21-12-19(27-24(30)26-18-8-6-5-7-9-18)10-11-20(21)23(29)28(3)14-22(16)31-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H2,26,27,30)/t16-,17-,22-/m1/s1	IWXLMTPNFQAQHO-DRSNIGMVSA-N	446.289305736							101219
BRD-K97657359	LSM-14429		54631711	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18+,23-/m1/s1	RIFMDYVXBSMSIP-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K97657359	BRD-K97657359-001-01-1	Broad Institute of MIT and Harvard	BRD-K97657359			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18+,23-/m1/s1	RIFMDYVXBSMSIP-IEGUWTFLSA-N	439.247106566							103084
BRD-K35039537	LSM-10535		54631830	InChI=1S/C22H30N4O7S/c1-14-11-26(34(5,29)30)15(2)13-32-18-7-6-16(24-21(27)19-8-9-23-33-19)10-17(18)22(28)25(3)12-20(14)31-4/h6-10,14-15,20H,11-13H2,1-5H3,(H,24,27)/t14-,15-,20-/m0/s1	CRZDWKBDRGRNEI-AVYPCKFXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3oncc3)ccc2OC[C@H](C)N(C[C@@H]1C)S(=O)(=O)C	BroadT	BRD-K35039537	BRD-K35039537-001-01-2	Broad Institute of MIT and Harvard	BRD-K35039537			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccno3)ccc2OC[C@H](C)N(C[C@@H]1C)S(C)(=O)=O	InChI=1S/C22H30N4O7S/c1-14-11-26(34(5,29)30)15(2)13-32-18-7-6-16(24-21(27)19-8-9-23-33-19)10-17(18)22(28)25(3)12-20(14)31-4/h6-10,14-15,20H,11-13H2,1-5H3,(H,24,27)/t14-,15-,20-/m0/s1	CRZDWKBDRGRNEI-AVYPCKFXSA-N	494.18352003							99156
BRD-K50819157	LSM-11529		54631647	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19-,26+/m1/s1	ZMJDYVBEASXUEV-UDCNLSRBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@H]1C	BroadT	BRD-K50819157	BRD-K50819157-001-01-6	Broad Institute of MIT and Harvard	BRD-K50819157			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2ccccc2OC)C[C@H]1C	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19-,26+/m1/s1	ZMJDYVBEASXUEV-UDCNLSRBSA-N	483.273321314							100152
BRD-K77966217	LSM-13200		54631670	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21-,27-/m1/s1	WKDBULKSLWTRKP-LGVUCKNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K77966217	BRD-K77966217-001-01-2	Broad Institute of MIT and Harvard	BRD-K77966217			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21-,27-/m1/s1	WKDBULKSLWTRKP-LGVUCKNBSA-N	524.29987042							101838
BRD-K03142004	LSM-8629		54631669	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19+,24-/m0/s1	UGPRBZOFAYTTOL-GLDPYIMESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN4CCOCC4	BroadT	BRD-K03142004	BRD-K03142004-001-01-6	Broad Institute of MIT and Harvard	BRD-K03142004			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN1CCOCC1	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19+,24-/m0/s1	UGPRBZOFAYTTOL-GLDPYIMESA-N	516.29478504							97250
BRD-K53923842	LSM-11707		54631809	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16-,21-/m1/s1	IMTXHMNNEPVREU-WHSLLNHNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K53923842	BRD-K53923842-001-01-4	Broad Institute of MIT and Harvard	BRD-K53923842			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16-,21-/m1/s1	IMTXHMNNEPVREU-WHSLLNHNSA-N	417.26275663							100332
BRD-K60050469	LSM-12059		54631865	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24+/m1/s1	MQWQDAVBIBJDRV-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K60050469	BRD-K60050469-001-01-9	Broad Institute of MIT and Harvard	BRD-K60050469			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24+/m1/s1	MQWQDAVBIBJDRV-YTZAWJCFSA-N	484.268570292							100685
BRD-K19657374	LSM-9617		54631774	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22-/m1/s1	FAXXRWNSKSYYIM-XCGNWRKASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K19657374	BRD-K19657374-001-01-7	Broad Institute of MIT and Harvard	BRD-K19657374			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22-/m1/s1	FAXXRWNSKSYYIM-XCGNWRKASA-N	479.18901998							98238
BRD-K68921379	LSM-12638		54631694	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17-,22+/m0/s1	MDBZRSBKDCCZHT-PNLZDCPESA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CC3CC3)[C@@H](C)COc2c1	BroadT	BRD-K68921379	BRD-K68921379-001-01-2	Broad Institute of MIT and Harvard	BRD-K68921379			COCC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CC3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17-,22+/m0/s1	MDBZRSBKDCCZHT-PNLZDCPESA-N	447.273321314							101271
BRD-K20757362	LSM-9689		54631806	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25+/m0/s1	CHKBOEGZXMMFCS-ZYLNGJIFSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3cccnc3)[C@@H](C)COc2c1	BroadT	BRD-K20757362	BRD-K20757362-001-01-6	Broad Institute of MIT and Harvard	BRD-K20757362			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3cccnc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25+/m0/s1	CHKBOEGZXMMFCS-ZYLNGJIFSA-N	497.300204778							98310
BRD-K24196267	LSM-9893		54631723	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19-,24+/m1/s1	IQLGILJFFYEPBE-IECBHUPTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@H]1C	BroadT	BRD-K24196267	BRD-K24196267-001-01-9	Broad Institute of MIT and Harvard	BRD-K24196267			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19-,24+/m1/s1	IQLGILJFFYEPBE-IECBHUPTSA-N	563.2640767							98514
BRD-K87687716	LSM-13804		54631652	InChI=1S/C21H31N5O5S/c1-14-9-22-15(2)12-31-18-8-16(24-32(28,29)20-11-25(3)13-23-20)6-7-17(18)21(27)26(4)10-19(14)30-5/h6-8,11,13-15,19,22,24H,9-10,12H2,1-5H3/t14-,15+,19-/m1/s1	QXYUWGLBJNPRKS-ZRGWGRIASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K87687716	BRD-K87687716-001-01-8	Broad Institute of MIT and Harvard	BRD-K87687716			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C21H31N5O5S/c1-14-9-22-15(2)12-31-18-8-16(24-32(28,29)20-11-25(3)13-23-20)6-7-17(18)21(27)26(4)10-19(14)30-5/h6-8,11,13-15,19,22,24H,9-10,12H2,1-5H3/t14-,15+,19-/m1/s1	QXYUWGLBJNPRKS-ZRGWGRIASA-N	465.204589832							102453
BRD-K58300499	LSM-11946		54631717	InChI=1S/C27H42N4O6/c1-6-11-28-27(34)29-21-7-8-22-23(14-21)37-17-19(3)31(25(32)20-9-12-36-13-10-20)15-18(2)24(35-5)16-30(4)26(22)33/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24-/m0/s1	NYJPVGKIWASVOA-JXQFQVJHSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)C3CCOCC3	BroadT	BRD-K58300499	BRD-K58300499-001-01-6	Broad Institute of MIT and Harvard	BRD-K58300499			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)C2CCOCC2)c1	InChI=1S/C27H42N4O6/c1-6-11-28-27(34)29-21-7-8-22-23(14-21)37-17-19(3)31(25(32)20-9-12-36-13-10-20)15-18(2)24(35-5)16-30(4)26(22)33/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24-/m0/s1	NYJPVGKIWASVOA-JXQFQVJHSA-N	518.310435104							100572
BRD-K72993421	LSM-12898		54631698	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20-,25-/m1/s1	HWYKCLATECFWDF-UMEGOILYSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K72993421	BRD-K72993421-001-01-3	Broad Institute of MIT and Harvard	BRD-K72993421			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H]1C)OC	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20-,25-/m1/s1	HWYKCLATECFWDF-UMEGOILYSA-N	503.245392004							101535
BRD-K71520313	LSM-12801		54631835	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m0/s1	AICRRUIGWBNRBB-JXQFQVJHSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K71520313	BRD-K71520313-001-01-6	Broad Institute of MIT and Harvard	BRD-K71520313			CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m0/s1	AICRRUIGWBNRBB-JXQFQVJHSA-N	468.273655672							101438
BRD-K18350116	LSM-9532		54631701	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19+,25+/m0/s1	YQOYUVQVCGNRJC-OSWQYVSFSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K18350116	BRD-K18350116-001-01-3	Broad Institute of MIT and Harvard	BRD-K18350116			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H]1C)OC	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19+,25+/m0/s1	YQOYUVQVCGNRJC-OSWQYVSFSA-N	527.263150554							98153
BRD-K69962604	LSM-12700		54631760	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23+/m0/s1	FNBLPFIHIJQMKK-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C3CCC3	BroadT	BRD-K69962604	BRD-K69962604-001-01-2	Broad Institute of MIT and Harvard	BRD-K69962604			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CCC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23+/m0/s1	FNBLPFIHIJQMKK-IUKKYPGJSA-N	488.29987042							101335
BRD-K39703302	LSM-10846		54631679	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22+,30-/m1/s1	WUHLCXCEWBJVDE-VDZJOXJSSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(Cc4ccccc4F)C[C@H]1C	BroadT	BRD-K39703302	BRD-K39703302-001-01-2	Broad Institute of MIT and Harvard	BRD-K39703302			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(Cc2ccccc2F)C[C@H]1C	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22+,30-/m1/s1	WUHLCXCEWBJVDE-VDZJOXJSSA-N	599.246534856							99467
BRD-K86741607	LSM-13742		54631658	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18+,22+/m1/s1	REUNTGUOEHKOBZ-FGSXEWAUSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)CN(C)C	BroadT	BRD-K86741607	BRD-K86741607-001-01-6	Broad Institute of MIT and Harvard	BRD-K86741607			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)CN(C)C)c1	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18+,22+/m1/s1	REUNTGUOEHKOBZ-FGSXEWAUSA-N	476.29987042							102391
BRD-K69021148	LSM-12642		54631610	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22+,30+/m0/s1	WUHLCXCEWBJVDE-IABYTQIASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(Cc4ccccc4F)C[C@@H]1C	BroadT	BRD-K69021148	BRD-K69021148-001-01-0	Broad Institute of MIT and Harvard	BRD-K69021148			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(Cc2ccccc2F)C[C@@H]1C	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22+,30+/m0/s1	WUHLCXCEWBJVDE-IABYTQIASA-N	599.246534856							101275
BRD-K14378954	LSM-9297		54631713	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19-,25+/m0/s1	YQOYUVQVCGNRJC-XHNVNVPESA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K14378954	BRD-K14378954-001-01-3	Broad Institute of MIT and Harvard	BRD-K14378954			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19-,25+/m0/s1	YQOYUVQVCGNRJC-XHNVNVPESA-N	527.263150554							97918
BRD-K38320477	LSM-10750		54631646	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14-,20+/m1/s1	RYHWAKGNXXOPFN-JZKQVHKSSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K38320477	BRD-K38320477-001-01-5	Broad Institute of MIT and Harvard	BRD-K38320477			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14-,20+/m1/s1	RYHWAKGNXXOPFN-JZKQVHKSSA-N	459.248169206							99371
BRD-K67660075	LSM-12546		54631839	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20-,25+/m1/s1	HWYKCLATECFWDF-FHAGJXEFSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K67660075	BRD-K67660075-001-01-4	Broad Institute of MIT and Harvard	BRD-K67660075			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H]1C)OC	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20-,25+/m1/s1	HWYKCLATECFWDF-FHAGJXEFSA-N	503.245392004							101177
BRD-K43503317	LSM-11077		54631900	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25+/m1/s1	HTKHLCDDEOIAQO-RRQZXNHTSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H]1C)OC	BroadT	BRD-K43503317	BRD-K43503317-001-01-3	Broad Institute of MIT and Harvard	BRD-K43503317			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25+/m1/s1	HTKHLCDDEOIAQO-RRQZXNHTSA-N	500.279883904							99698
BRD-K45174347	LSM-11178		54631637	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m0/s1	HGUJNTNFLCOWHI-XHNVNVPESA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H]1C)OC	BroadT	BRD-K45174347	BRD-K45174347-001-01-5	Broad Institute of MIT and Harvard	BRD-K45174347			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m0/s1	HGUJNTNFLCOWHI-XHNVNVPESA-N	485.268984862							99799
BRD-K18310625	LSM-9527		54631888	InChI=1S/C26H40N4O5/c1-6-12-27-26(33)30-14-17(2)23(34-5)15-29(4)25(32)21-11-10-20(13-22(21)35-16-18(30)3)28-24(31)19-8-7-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,33)(H,28,31)/t17-,18+,23+/m0/s1	JIFPRSYXXRNMQX-YZZKKUAISA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K18310625	BRD-K18310625-001-01-1	Broad Institute of MIT and Harvard	BRD-K18310625			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H]1C)OC	InChI=1S/C26H40N4O5/c1-6-12-27-26(33)30-14-17(2)23(34-5)15-29(4)25(32)21-11-10-20(13-22(21)35-16-18(30)3)28-24(31)19-8-7-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,33)(H,28,31)/t17-,18+,23+/m0/s1	JIFPRSYXXRNMQX-YZZKKUAISA-N	488.29987042							98148
BRD-K67322403	LSM-12526		54631695	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16-,22-/m1/s1	PQYPJTAQDSWLTB-XCGNWRKASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3cnccn3	BroadT	BRD-K67322403	BRD-K67322403-001-01-4	Broad Institute of MIT and Harvard	BRD-K67322403			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16-,22-/m1/s1	PQYPJTAQDSWLTB-XCGNWRKASA-N	469.232519142							101157
BRD-K21968411	LSM-9758		54631721	InChI=1S/C27H36N4O6/c1-16-13-31(26(33)19-7-6-8-19)17(2)15-36-23-12-20(28-25(32)22-11-18(3)37-29-22)9-10-21(23)27(34)30(4)14-24(16)35-5/h9-12,16-17,19,24H,6-8,13-15H2,1-5H3,(H,28,32)/t16-,17-,24-/m1/s1	GMAYLDSADPOMGV-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CCC4	BroadT	BRD-K21968411	BRD-K21968411-001-01-9	Broad Institute of MIT and Harvard	BRD-K21968411			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCC1	InChI=1S/C27H36N4O6/c1-16-13-31(26(33)19-7-6-8-19)17(2)15-36-23-12-20(28-25(32)22-11-18(3)37-29-22)9-10-21(23)27(34)30(4)14-24(16)35-5/h9-12,16-17,19,24H,6-8,13-15H2,1-5H3,(H,28,32)/t16-,17-,24-/m1/s1	GMAYLDSADPOMGV-HOZJOUCCSA-N	512.263484912							98379
BRD-K97766167	LSM-14439		54631779	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17-,24+/m1/s1	VFFXTZRIOLHXNX-OJLQRUNKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K97766167	BRD-K97766167-001-01-2	Broad Institute of MIT and Harvard	BRD-K97766167			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17-,24+/m1/s1	VFFXTZRIOLHXNX-OJLQRUNKSA-N	484.268570292							103094
BRD-K87643614	LSM-13802		54631702	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22-,30+/m0/s1	WUHLCXCEWBJVDE-MWXNICTNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(Cc4ccccc4F)C[C@@H]1C	BroadT	BRD-K87643614	BRD-K87643614-001-01-4	Broad Institute of MIT and Harvard	BRD-K87643614			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(Cc2ccccc2F)C[C@@H]1C	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22-,30+/m0/s1	WUHLCXCEWBJVDE-MWXNICTNSA-N	599.246534856							102451
BRD-K78685075-001-01-8	LSM-15930	BRD-K78685075	54631685	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16+,20-/m1/s1	QTXSGNVPDCTZEW-GQIGUUNPSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K78685075	BRD-K78685075-001-01-8	Broad Institute of MIT and Harvard	BRD-K78685075			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16+,20-/m1/s1	QTXSGNVPDCTZEW-GQIGUUNPSA-N	509.217126508							104566
BRD-K15639930	LSM-9363		54631789	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24+,31+/m0/s1	OXAYHDRNXZXDOZ-BKZGZDJESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K15639930	BRD-K15639930-001-01-6	Broad Institute of MIT and Harvard	BRD-K15639930			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24+,31+/m0/s1	OXAYHDRNXZXDOZ-BKZGZDJESA-N	559.304621442							97984
BRD-K82644788	LSM-13476		54631859	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m0/s1	MDBZRSBKDCCZHT-GSHUGGBRSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CC3CC3)[C@H](C)COc2c1	BroadT	BRD-K82644788	BRD-K82644788-001-01-7	Broad Institute of MIT and Harvard	BRD-K82644788			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CC3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m0/s1	MDBZRSBKDCCZHT-GSHUGGBRSA-N	447.273321314							102116
BRD-K43744546	LSM-11097		54631780	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21+,27+/m1/s1	ZEGIYGLHXRHVDM-BUEREQSYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccccc4	BroadT	BRD-K43744546	BRD-K43744546-001-01-6	Broad Institute of MIT and Harvard	BRD-K43744546			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21+,27+/m1/s1	ZEGIYGLHXRHVDM-BUEREQSYSA-N	537.283885998							99718
BRD-K60149889	LSM-12066		54631736	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22-,30+/m1/s1	WUHLCXCEWBJVDE-WOGZVKCMSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(Cc4ccccc4F)C[C@H]1C	BroadT	BRD-K60149889	BRD-K60149889-001-01-1	Broad Institute of MIT and Harvard	BRD-K60149889			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(Cc2ccccc2F)C[C@H]1C	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22-,30+/m1/s1	WUHLCXCEWBJVDE-WOGZVKCMSA-N	599.246534856							100692
BRD-K10864752	LSM-9093		54631827	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19-,26+/m0/s1	ZMJDYVBEASXUEV-LZJCXSABSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@@H]1C	BroadT	BRD-K10864752	BRD-K10864752-001-01-0	Broad Institute of MIT and Harvard	BRD-K10864752			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2ccccc2OC)C[C@@H]1C	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19-,26+/m0/s1	ZMJDYVBEASXUEV-LZJCXSABSA-N	483.273321314							97714
BRD-K32209551	LSM-10380		54631617	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17-,24-/m0/s1	VFFXTZRIOLHXNX-UAVUOLJFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K32209551	BRD-K32209551-001-01-5	Broad Institute of MIT and Harvard	BRD-K32209551			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17-,24-/m0/s1	VFFXTZRIOLHXNX-UAVUOLJFSA-N	484.268570292							99001
BRD-K88959773	LSM-13898		54631626	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24+/m0/s1	FPIGUEAYUNMTQH-HOOSLVGPSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K88959773	BRD-K88959773-001-01-0	Broad Institute of MIT and Harvard	BRD-K88959773			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H]1C)OC	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24+/m0/s1	FPIGUEAYUNMTQH-HOOSLVGPSA-N	530.22959797							102551
BRD-K41957723	LSM-10978		54631819	InChI=1S/C24H37F3N4O4/c1-6-10-28-23(33)29-18-7-8-19-20(12-18)35-15-17(3)31(11-9-24(25,26)27)13-16(2)21(34-5)14-30(4)22(19)32/h7-8,12,16-17,21H,6,9-11,13-15H2,1-5H3,(H2,28,29,33)/t16-,17+,21+/m1/s1	VNTQRTFIXZLISU-WWMYMODYSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CCC(F)(F)F)[C@@H](C)COc2c1	BroadT	BRD-K41957723	BRD-K41957723-001-01-1	Broad Institute of MIT and Harvard	BRD-K41957723			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37F3N4O4/c1-6-10-28-23(33)29-18-7-8-19-20(12-18)35-15-17(3)31(11-9-24(25,26)27)13-16(2)21(34-5)14-30(4)22(19)32/h7-8,12,16-17,21H,6,9-11,13-15H2,1-5H3,(H2,28,29,33)/t16-,17+,21+/m1/s1	VNTQRTFIXZLISU-WWMYMODYSA-N	502.276690304							99599
BRD-K59345639-001-01-1	LSM-15931	BRD-K59345639	54631707	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19+,24-/m1/s1	UGPRBZOFAYTTOL-YDIMBITNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN4CCOCC4	BroadT	BRD-K59345639	BRD-K59345639-001-01-1	Broad Institute of MIT and Harvard	BRD-K59345639			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN1CCOCC1	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19+,24-/m1/s1	UGPRBZOFAYTTOL-YDIMBITNSA-N	516.29478504							104567
BRD-K00262440	LSM-8442		54631608	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	JFYAEFCKASRCBE-GLDPYIMESA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3	BroadT	BRD-K00262440	BRD-K00262440-001-01-7	Broad Institute of MIT and Harvard	BRD-K00262440			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	JFYAEFCKASRCBE-GLDPYIMESA-N	497.25258587							97063
BRD-K12882397	LSM-9193		54631627	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19+,24+/m1/s1	IQLGILJFFYEPBE-IMWIBFENSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(CC3CCCCC3)C[C@H]1C	BroadT	BRD-K12882397	BRD-K12882397-001-01-1	Broad Institute of MIT and Harvard	BRD-K12882397			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19+,24+/m1/s1	IQLGILJFFYEPBE-IMWIBFENSA-N	563.2640767							97814
BRD-K37779687	LSM-10716		54631820	InChI=1S/C23H33N5O5S/c1-16-11-28(12-18-9-24-15-25-10-18)17(2)14-33-21-7-6-19(26-34(5,30)31)8-20(21)23(29)27(3)13-22(16)32-4/h6-10,15-17,22,26H,11-14H2,1-5H3/t16-,17-,22+/m0/s1	VPVAZUBGKWFEKV-PNLZDCPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H]1C	BroadT	BRD-K37779687	BRD-K37779687-001-01-9	Broad Institute of MIT and Harvard	BRD-K37779687			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C23H33N5O5S/c1-16-11-28(12-18-9-24-15-25-10-18)17(2)14-33-21-7-6-19(26-34(5,30)31)8-20(21)23(29)27(3)13-22(16)32-4/h6-10,15-17,22,26H,11-14H2,1-5H3/t16-,17-,22+/m0/s1	VPVAZUBGKWFEKV-PNLZDCPESA-N	491.220239896							99337
BRD-K20089037	LSM-9649		54631886	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19-,24-/m1/s1	IQLGILJFFYEPBE-KHCICDEESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@H]1C	BroadT	BRD-K20089037	BRD-K20089037-001-01-9	Broad Institute of MIT and Harvard	BRD-K20089037			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19-,24-/m1/s1	IQLGILJFFYEPBE-KHCICDEESA-N	563.2640767							98270
BRD-K20741178	LSM-9687		54631703	InChI=1S/C26H40N4O5/c1-6-12-27-26(33)30-14-17(2)23(34-5)15-29(4)25(32)21-11-10-20(13-22(21)35-16-18(30)3)28-24(31)19-8-7-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,33)(H,28,31)/t17-,18+,23-/m1/s1	JIFPRSYXXRNMQX-IEGUWTFLSA-N	CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H]1C)OC	BroadT	BRD-K20741178	BRD-K20741178-001-01-4	Broad Institute of MIT and Harvard	BRD-K20741178			CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H]1C)OC	InChI=1S/C26H40N4O5/c1-6-12-27-26(33)30-14-17(2)23(34-5)15-29(4)25(32)21-11-10-20(13-22(21)35-16-18(30)3)28-24(31)19-8-7-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,33)(H,28,31)/t17-,18+,23-/m1/s1	JIFPRSYXXRNMQX-IEGUWTFLSA-N	488.29987042							98308
BRD-K76472157	LSM-13107		54631663	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25+/m0/s1	CHKBOEGZXMMFCS-WZOHSFFVSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3cccnc3)[C@H](C)COc2c1	BroadT	BRD-K76472157	BRD-K76472157-001-01-4	Broad Institute of MIT and Harvard	BRD-K76472157			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cccnc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25+/m0/s1	CHKBOEGZXMMFCS-WZOHSFFVSA-N	497.300204778							101745
BRD-K69837023	LSM-12691		54631599	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15-,19+/m1/s1	ALCDIEWMKTXBKO-CLCXKQKWSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H]1C)OC	BroadT	BRD-K69837023	BRD-K69837023-001-01-9	Broad Institute of MIT and Harvard	BRD-K69837023			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H]1C)OC	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15-,19+/m1/s1	ALCDIEWMKTXBKO-CLCXKQKWSA-N	471.203921116							101325
BRD-K29324759	LSM-10205		54631753	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25-/m0/s1	HTKHLCDDEOIAQO-CEYNDMKZSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H]1C)OC	BroadT	BRD-K29324759	BRD-K29324759-001-01-7	Broad Institute of MIT and Harvard	BRD-K29324759			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25-/m0/s1	HTKHLCDDEOIAQO-CEYNDMKZSA-N	500.279883904							98826
BRD-K05156496	LSM-8737		54631790	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14+,20-/m1/s1	JSRBXIHVEPNVJQ-LAPQFRIASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K05156496	BRD-K05156496-001-01-9	Broad Institute of MIT and Harvard	BRD-K05156496			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14+,20-/m1/s1	JSRBXIHVEPNVJQ-LAPQFRIASA-N	430.2216201							97358
BRD-K39036510	LSM-10795		54631645	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20-,26+/m0/s1	ZWMNFEZEGHFZOH-CUVVAGTFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC4CC4	BroadT	BRD-K39036510	BRD-K39036510-001-01-5	Broad Institute of MIT and Harvard	BRD-K39036510			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20-,26+/m0/s1	ZWMNFEZEGHFZOH-CUVVAGTFSA-N	522.284220356							99416
BRD-K30836174	LSM-10287		54631761	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19-,24-/m1/s1	UGPRBZOFAYTTOL-KHCICDEESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN4CCOCC4	BroadT	BRD-K30836174	BRD-K30836174-001-01-4	Broad Institute of MIT and Harvard	BRD-K30836174			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN1CCOCC1	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19-,24-/m1/s1	UGPRBZOFAYTTOL-KHCICDEESA-N	516.29478504							98908
BRD-K49430514	LSM-11432		54631732	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16-,22+/m1/s1	PQYPJTAQDSWLTB-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3cnccn3	BroadT	BRD-K49430514	BRD-K49430514-001-01-4	Broad Institute of MIT and Harvard	BRD-K49430514			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16-,22+/m1/s1	PQYPJTAQDSWLTB-MCFFVMPBSA-N	469.232519142							100053
BRD-K61164776	LSM-12132		54631763	InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13-,17+/m1/s1	BGDCTPQGAPJUMB-XNJGSVPQSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K61164776	BRD-K61164776-001-01-5	Broad Institute of MIT and Harvard	BRD-K61164776			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13-,17+/m1/s1	BGDCTPQGAPJUMB-XNJGSVPQSA-N	467.170176316							100758
BRD-K80630466	LSM-13359		54631883	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25-/m1/s1	HTKHLCDDEOIAQO-MPCDZSKCSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H]1C)OC	BroadT	BRD-K80630466	BRD-K80630466-001-01-7	Broad Institute of MIT and Harvard	BRD-K80630466			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25-/m1/s1	HTKHLCDDEOIAQO-MPCDZSKCSA-N	500.279883904							101998
BRD-K67718916	LSM-12554		54631861	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17-,22+/m1/s1	VZMYSNMKMPUTCO-YVHKJVDXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K67718916	BRD-K67718916-001-01-3	Broad Institute of MIT and Harvard	BRD-K67718916			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17-,22+/m1/s1	VZMYSNMKMPUTCO-YVHKJVDXSA-N	491.209006496							101185
BRD-K62185604	LSM-12202		54631620	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-17-18(10-16)28-13-15(3)22-11-14(2)19(27-5)12-24(4)21(17)26/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19-/m0/s1	AZDABJQXNZGANX-KHYOSLBOSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K62185604	BRD-K62185604-001-01-7	Broad Institute of MIT and Harvard	BRD-K62185604			CCCC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-17-18(10-16)28-13-15(3)22-11-14(2)19(27-5)12-24(4)21(17)26/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19-/m0/s1	AZDABJQXNZGANX-KHYOSLBOSA-N	391.247106566							100828
BRD-K52838656	LSM-11652		54631612	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24-/m0/s1	FPIGUEAYUNMTQH-RHGYRFJNSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K52838656	BRD-K52838656-001-01-0	Broad Institute of MIT and Harvard	BRD-K52838656			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H]1C)OC	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24-/m0/s1	FPIGUEAYUNMTQH-RHGYRFJNSA-N	530.22959797							100277
BRD-K02401733	LSM-8582		54631766	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-17-18(10-16)28-13-15(3)22-11-14(2)19(27-5)12-24(4)21(17)26/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19+/m0/s1	AZDABJQXNZGANX-QMTMVMCOSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K02401733	BRD-K02401733-001-01-5	Broad Institute of MIT and Harvard	BRD-K02401733			CCCC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-17-18(10-16)28-13-15(3)22-11-14(2)19(27-5)12-24(4)21(17)26/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19+/m0/s1	AZDABJQXNZGANX-QMTMVMCOSA-N	391.247106566							97203
BRD-K21179706	LSM-9717		54631662	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16+,21+/m0/s1	IMTXHMNNEPVREU-GCKMJXCFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K21179706	BRD-K21179706-001-01-7	Broad Institute of MIT and Harvard	BRD-K21179706			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16+,21+/m0/s1	IMTXHMNNEPVREU-GCKMJXCFSA-N	417.26275663							98338
BRD-K53980138	LSM-11712		54631614	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19+,26-/m0/s1	ZMJDYVBEASXUEV-ANSQWYIGSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@@H]1C	BroadT	BRD-K53980138	BRD-K53980138-001-01-7	Broad Institute of MIT and Harvard	BRD-K53980138			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2ccccc2OC)C[C@@H]1C	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19+,26-/m0/s1	ZMJDYVBEASXUEV-ANSQWYIGSA-N	483.273321314							100337
BRD-K43013792	LSM-11043		54631892	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m0/s1	JFYAEFCKASRCBE-XLNZFTOWSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3	BroadT	BRD-K43013792	BRD-K43013792-001-01-7	Broad Institute of MIT and Harvard	BRD-K43013792			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m0/s1	JFYAEFCKASRCBE-XLNZFTOWSA-N	497.25258587							99664
BRD-K05398363	LSM-8747		54631796	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18-,22-/m1/s1	LLNFNSHBDLACGS-JBYIUTFZSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K05398363	BRD-K05398363-001-01-7	Broad Institute of MIT and Harvard	BRD-K05398363			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18-,22-/m1/s1	LLNFNSHBDLACGS-JBYIUTFZSA-N	488.245726362							97368
BRD-K69293497	LSM-12652		54631726	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23-/m1/s1	FNBLPFIHIJQMKK-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C3CCC3	BroadT	BRD-K69293497	BRD-K69293497-001-01-2	Broad Institute of MIT and Harvard	BRD-K69293497			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CCC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23-/m1/s1	FNBLPFIHIJQMKK-IEGUWTFLSA-N	488.29987042							101286
BRD-K43615608	LSM-11088		54631771	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18+,22+/m0/s1	REUNTGUOEHKOBZ-NJNPRVFISA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)CN(C)C	BroadT	BRD-K43615608	BRD-K43615608-001-01-3	Broad Institute of MIT and Harvard	BRD-K43615608			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CN(C)C)c1	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18+,22+/m0/s1	REUNTGUOEHKOBZ-NJNPRVFISA-N	476.29987042							99709
BRD-K03046744	LSM-8623		54631744	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21+,27+/m1/s1	WKDBULKSLWTRKP-BUEREQSYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K03046744	BRD-K03046744-001-01-4	Broad Institute of MIT and Harvard	BRD-K03046744			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21+,27+/m1/s1	WKDBULKSLWTRKP-BUEREQSYSA-N	524.29987042							97244
BRD-K95371508	LSM-14276		54631606	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21+,27-/m0/s1	ZEGIYGLHXRHVDM-ISCCLHIJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccccc4	BroadT	BRD-K95371508	BRD-K95371508-001-01-1	Broad Institute of MIT and Harvard	BRD-K95371508			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21+,27-/m0/s1	ZEGIYGLHXRHVDM-ISCCLHIJSA-N	537.283885998							102930
BRD-K48603187	LSM-11389		54631815	InChI=1S/C28H39N3O4/c1-6-27(32)29-23-12-13-24-25(16-23)35-19-21(3)31(15-14-22-10-8-7-9-11-22)17-20(2)26(34-5)18-30(4)28(24)33/h7-13,16,20-21,26H,6,14-15,17-19H2,1-5H3,(H,29,32)/t20-,21-,26+/m0/s1	IOFIBAZLXDARLU-ISJBWFOZSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CCc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K48603187	BRD-K48603187-001-01-3	Broad Institute of MIT and Harvard	BRD-K48603187			CCC(=O)Nc1ccc2c(OC[C@H](C)N(CCc3ccccc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C28H39N3O4/c1-6-27(32)29-23-12-13-24-25(16-23)35-19-21(3)31(15-14-22-10-8-7-9-11-22)17-20(2)26(34-5)18-30(4)28(24)33/h7-13,16,20-21,26H,6,14-15,17-19H2,1-5H3,(H,29,32)/t20-,21-,26+/m0/s1	IOFIBAZLXDARLU-ISJBWFOZSA-N	481.294056758							100010
BRD-K88404561	LSM-13868		54631692	InChI=1S/C28H38FN3O4/c1-6-7-27(33)30-23-12-13-24-25(14-23)36-18-20(3)32(16-21-8-10-22(29)11-9-21)15-19(2)26(35-5)17-31(4)28(24)34/h8-14,19-20,26H,6-7,15-18H2,1-5H3,(H,30,33)/t19-,20+,26-/m1/s1	KMKGAVOVEHQLPH-BVFVYWQFSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccc(F)cc3)[C@@H](C)COc2c1	BroadT	BRD-K88404561	BRD-K88404561-001-01-3	Broad Institute of MIT and Harvard	BRD-K88404561			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccc(F)cc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C28H38FN3O4/c1-6-7-27(33)30-23-12-13-24-25(14-23)36-18-20(3)32(16-21-8-10-22(29)11-9-21)15-19(2)26(35-5)17-31(4)28(24)34/h8-14,19-20,26H,6-7,15-18H2,1-5H3,(H,30,33)/t19-,20+,26-/m1/s1	KMKGAVOVEHQLPH-BVFVYWQFSA-N	499.284634926							102520
BRD-K13418716	LSM-9232		54631798	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17-,22+/m1/s1	MDBZRSBKDCCZHT-YVHKJVDXSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CC3CC3)[C@H](C)COc2c1	BroadT	BRD-K13418716	BRD-K13418716-001-01-7	Broad Institute of MIT and Harvard	BRD-K13418716			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CC3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17-,22+/m1/s1	MDBZRSBKDCCZHT-YVHKJVDXSA-N	447.273321314							97853
BRD-K32380790	LSM-10393		54631648	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	JFYAEFCKASRCBE-IMWIBFENSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3	BroadT	BRD-K32380790	BRD-K32380790-001-01-5	Broad Institute of MIT and Harvard	BRD-K32380790			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	JFYAEFCKASRCBE-IMWIBFENSA-N	497.25258587							99014
BRD-K36018407	LSM-10597		54631659	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m0/s1	HGUJNTNFLCOWHI-OSWQYVSFSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H]1C)OC	BroadT	BRD-K36018407	BRD-K36018407-001-01-2	Broad Institute of MIT and Harvard	BRD-K36018407			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m0/s1	HGUJNTNFLCOWHI-OSWQYVSFSA-N	485.268984862							99218
BRD-K50981189	LSM-11539		54631899	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19-,26-/m0/s1	ZMJDYVBEASXUEV-DGUDUIIESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@@H]1C	BroadT	BRD-K50981189	BRD-K50981189-001-01-6	Broad Institute of MIT and Harvard	BRD-K50981189			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2ccccc2OC)C[C@@H]1C	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19-,26-/m0/s1	ZMJDYVBEASXUEV-DGUDUIIESA-N	483.273321314							100162
BRD-K38561684	LSM-10768		54631656	InChI=1S/C23H33N5O5S/c1-16-11-28(12-18-9-24-15-25-10-18)17(2)14-33-21-7-6-19(26-34(5,30)31)8-20(21)23(29)27(3)13-22(16)32-4/h6-10,15-17,22,26H,11-14H2,1-5H3/t16-,17+,22-/m1/s1	VPVAZUBGKWFEKV-HYFFOGBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H]1C	BroadT	BRD-K38561684	BRD-K38561684-001-01-3	Broad Institute of MIT and Harvard	BRD-K38561684			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C23H33N5O5S/c1-16-11-28(12-18-9-24-15-25-10-18)17(2)14-33-21-7-6-19(26-34(5,30)31)8-20(21)23(29)27(3)13-22(16)32-4/h6-10,15-17,22,26H,11-14H2,1-5H3/t16-,17+,22-/m1/s1	VPVAZUBGKWFEKV-HYFFOGBASA-N	491.220239896							99389
BRD-K02675466	LSM-8604		54631643	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24+/m0/s1	MQWQDAVBIBJDRV-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K02675466	BRD-K02675466-001-01-7	Broad Institute of MIT and Harvard	BRD-K02675466			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24+/m0/s1	MQWQDAVBIBJDRV-LLJLJFOGSA-N	484.268570292							97225
BRD-K61268714	LSM-12139		54631624	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22-,29+/m1/s1	QUELGMPZNWRZSJ-QLVXXPONSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K61268714	BRD-K61268714-001-01-9	Broad Institute of MIT and Harvard	BRD-K61268714			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1F	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22-,29+/m1/s1	QUELGMPZNWRZSJ-QLVXXPONSA-N	561.263899482							100765
BRD-K14496573	LSM-9309		54631598	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14-,20+/m0/s1	JSRBXIHVEPNVJQ-PJSUUKDQSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K14496573	BRD-K14496573-001-01-4	Broad Institute of MIT and Harvard	BRD-K14496573			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14-,20+/m0/s1	JSRBXIHVEPNVJQ-PJSUUKDQSA-N	430.2216201							97930
BRD-K59550348	LSM-12028		54631674	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20-,26+/m1/s1	ZWMNFEZEGHFZOH-KYTVRQNUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC4CC4	BroadT	BRD-K59550348	BRD-K59550348-001-01-8	Broad Institute of MIT and Harvard	BRD-K59550348			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20-,26+/m1/s1	ZWMNFEZEGHFZOH-KYTVRQNUSA-N	522.284220356							100654
BRD-K17122162	LSM-9461		54631600	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15+,19-/m0/s1	ALCDIEWMKTXBKO-KHYOSLBOSA-N	COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H]1C)OC	BroadT	BRD-K17122162	BRD-K17122162-001-01-0	Broad Institute of MIT and Harvard	BRD-K17122162			COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H]1C)OC	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15+,19-/m0/s1	ALCDIEWMKTXBKO-KHYOSLBOSA-N	471.203921116							98082
CHEMBL2357436	LSM-13432	BRD-K81974123, SID131428044	54631801	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19+,25-/m1/s1	YQOYUVQVCGNRJC-HHJKRLRDSA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K81974123	BRD-K81974123-001-01-3	Broad Institute of MIT and Harvard	BRD-K81974123			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19+,25-/m1/s1	YQOYUVQVCGNRJC-HHJKRLRDSA-N	527.263150554							102072
BRD-K87175237	LSM-13775		54631639	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23-/m0/s1	FNBLPFIHIJQMKK-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C3CCC3	BroadT	BRD-K87175237	BRD-K87175237-001-01-4	Broad Institute of MIT and Harvard	BRD-K87175237			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CCC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23-/m0/s1	FNBLPFIHIJQMKK-IXFSTUDKSA-N	488.29987042							102424
BRD-K39158620	LSM-10807		54631675	InChI=1S/C24H37F3N4O4/c1-6-10-28-23(33)29-18-7-8-19-20(12-18)35-15-17(3)31(11-9-24(25,26)27)13-16(2)21(34-5)14-30(4)22(19)32/h7-8,12,16-17,21H,6,9-11,13-15H2,1-5H3,(H2,28,29,33)/t16-,17+,21-/m0/s1	VNTQRTFIXZLISU-FVJLSDCUSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(CCC(F)(F)F)[C@H](C)COc2c1	BroadT	BRD-K39158620	BRD-K39158620-001-01-4	Broad Institute of MIT and Harvard	BRD-K39158620			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(CCC(F)(F)F)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37F3N4O4/c1-6-10-28-23(33)29-18-7-8-19-20(12-18)35-15-17(3)31(11-9-24(25,26)27)13-16(2)21(34-5)14-30(4)22(19)32/h7-8,12,16-17,21H,6,9-11,13-15H2,1-5H3,(H2,28,29,33)/t16-,17+,21-/m0/s1	VNTQRTFIXZLISU-FVJLSDCUSA-N	502.276690304							99428
BRD-K92573321	LSM-14103		54631673	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23+/m0/s1	FNBLPFIHIJQMKK-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C3CCC3	BroadT	BRD-K92573321	BRD-K92573321-001-01-0	Broad Institute of MIT and Harvard	BRD-K92573321			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CCC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23+/m0/s1	FNBLPFIHIJQMKK-YZZKKUAISA-N	488.29987042							102757
BRD-K82803470	LSM-13486		54631750	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17+,24-/m0/s1	VFFXTZRIOLHXNX-SRGWNRLKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K82803470	BRD-K82803470-001-01-2	Broad Institute of MIT and Harvard	BRD-K82803470			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17+,24-/m0/s1	VFFXTZRIOLHXNX-SRGWNRLKSA-N	484.268570292							102126
BRD-K04566325	LSM-8704		54631794	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m1/s1	FAXXRWNSKSYYIM-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K04566325	BRD-K04566325-001-01-7	Broad Institute of MIT and Harvard	BRD-K04566325			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m1/s1	FAXXRWNSKSYYIM-MCFFVMPBSA-N	479.18901998							97325
BRD-K08971733	LSM-8969		54631905	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17+,22-/m0/s1	VZMYSNMKMPUTCO-JKSBSHDWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K08971733	BRD-K08971733-001-01-1	Broad Institute of MIT and Harvard	BRD-K08971733			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17+,22-/m0/s1	VZMYSNMKMPUTCO-JKSBSHDWSA-N	491.209006496							97590
BRD-K64478751	LSM-12363		54631869	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18-,23+/m0/s1	RIFMDYVXBSMSIP-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K64478751	BRD-K64478751-001-01-5	Broad Institute of MIT and Harvard	BRD-K64478751			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18-,23+/m0/s1	RIFMDYVXBSMSIP-IUKKYPGJSA-N	439.247106566							100990
BRD-K17891672	LSM-9504		54631880	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21-,27+/m1/s1	WKDBULKSLWTRKP-GNMOFYLKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K17891672	BRD-K17891672-001-01-3	Broad Institute of MIT and Harvard	BRD-K17891672			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21-,27+/m1/s1	WKDBULKSLWTRKP-GNMOFYLKSA-N	524.29987042							98125
BRD-K87972129	LSM-13829		54631871	InChI=1S/C21H31N5O5S/c1-14-9-22-15(2)12-31-18-8-16(24-32(28,29)20-11-25(3)13-23-20)6-7-17(18)21(27)26(4)10-19(14)30-5/h6-8,11,13-15,19,22,24H,9-10,12H2,1-5H3/t14-,15-,19+/m0/s1	QXYUWGLBJNPRKS-YZVOILCLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K87972129	BRD-K87972129-001-01-5	Broad Institute of MIT and Harvard	BRD-K87972129			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C21H31N5O5S/c1-14-9-22-15(2)12-31-18-8-16(24-32(28,29)20-11-25(3)13-23-20)6-7-17(18)21(27)26(4)10-19(14)30-5/h6-8,11,13-15,19,22,24H,9-10,12H2,1-5H3/t14-,15-,19+/m0/s1	QXYUWGLBJNPRKS-YZVOILCLSA-N	465.204589832							102479
BRD-K65342196	LSM-12410		54631619	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17-,24+/m0/s1	VFFXTZRIOLHXNX-WOGXIUBCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K65342196	BRD-K65342196-001-01-5	Broad Institute of MIT and Harvard	BRD-K65342196			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17-,24+/m0/s1	VFFXTZRIOLHXNX-WOGXIUBCSA-N	484.268570292							101037
BRD-K50805111	LSM-11527		54631800	InChI=1S/C28H39N3O4/c1-6-27(32)29-23-12-13-24-25(16-23)35-19-21(3)31(15-14-22-10-8-7-9-11-22)17-20(2)26(34-5)18-30(4)28(24)33/h7-13,16,20-21,26H,6,14-15,17-19H2,1-5H3,(H,29,32)/t20-,21-,26+/m1/s1	IOFIBAZLXDARLU-YPCDYVTLSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CCc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K50805111	BRD-K50805111-001-01-0	Broad Institute of MIT and Harvard	BRD-K50805111			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(CCc3ccccc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C28H39N3O4/c1-6-27(32)29-23-12-13-24-25(16-23)35-19-21(3)31(15-14-22-10-8-7-9-11-22)17-20(2)26(34-5)18-30(4)28(24)33/h7-13,16,20-21,26H,6,14-15,17-19H2,1-5H3,(H,29,32)/t20-,21-,26+/m1/s1	IOFIBAZLXDARLU-YPCDYVTLSA-N	481.294056758							100150
BRD-K35414268	LSM-10553		54631757	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14-,20-/m1/s1	RYHWAKGNXXOPFN-ARGWCVDVSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K35414268	BRD-K35414268-001-01-2	Broad Institute of MIT and Harvard	BRD-K35414268			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14-,20-/m1/s1	RYHWAKGNXXOPFN-ARGWCVDVSA-N	459.248169206							99174
BRD-K75003013-001-01-2	LSM-15932	BRD-K75003013	54631706	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18-,22-/m1/s1	REUNTGUOEHKOBZ-JBYIUTFZSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)CN(C)C	BroadT	BRD-K75003013	BRD-K75003013-001-01-2	Broad Institute of MIT and Harvard	BRD-K75003013			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CN(C)C)c1	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18-,22-/m1/s1	REUNTGUOEHKOBZ-JBYIUTFZSA-N	476.29987042							104568
BRD-K07237640	LSM-8852		54631716	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15-,19-/m1/s1	ALCDIEWMKTXBKO-SPYBWZPUSA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H]1C)OC	BroadT	BRD-K07237640	BRD-K07237640-001-01-0	Broad Institute of MIT and Harvard	BRD-K07237640			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H]1C)OC	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15-,19-/m1/s1	ALCDIEWMKTXBKO-SPYBWZPUSA-N	471.203921116							97473
BRD-K27858373	LSM-10111		54631893	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19+,25+/m1/s1	YQOYUVQVCGNRJC-WYEJZRMESA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K27858373	BRD-K27858373-001-01-2	Broad Institute of MIT and Harvard	BRD-K27858373			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19+,25+/m1/s1	YQOYUVQVCGNRJC-WYEJZRMESA-N	527.263150554							98732
BRD-K24779930	LSM-9935		54631765	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21+,27+/m0/s1	ZEGIYGLHXRHVDM-FYQCMVGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccccc4	BroadT	BRD-K24779930	BRD-K24779930-001-01-9	Broad Institute of MIT and Harvard	BRD-K24779930			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21+,27+/m0/s1	ZEGIYGLHXRHVDM-FYQCMVGJSA-N	537.283885998							98556
BRD-K33961995	LSM-10484		54631661	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24+/m1/s1	MQWQDAVBIBJDRV-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K33961995	BRD-K33961995-001-01-4	Broad Institute of MIT and Harvard	BRD-K33961995			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24+/m1/s1	MQWQDAVBIBJDRV-GGUMNFRJSA-N	484.268570292							99105
BRD-K73555595	LSM-12935		54631687	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17+,22+/m0/s1	VZMYSNMKMPUTCO-GSHUGGBRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K73555595	BRD-K73555595-001-01-9	Broad Institute of MIT and Harvard	BRD-K73555595			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17+,22+/m0/s1	VZMYSNMKMPUTCO-GSHUGGBRSA-N	491.209006496							101572
BRD-K34982474	LSM-10532		54631853	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23-/m0/s1	FNBLPFIHIJQMKK-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C3CCC3	BroadT	BRD-K34982474	BRD-K34982474-001-01-9	Broad Institute of MIT and Harvard	BRD-K34982474			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CCC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23-/m0/s1	FNBLPFIHIJQMKK-BSRJHKFKSA-N	488.29987042							99153
BRD-K11158154	LSM-9111		54631613	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24-/m1/s1	MQWQDAVBIBJDRV-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K11158154	BRD-K11158154-001-01-0	Broad Institute of MIT and Harvard	BRD-K11158154			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24-/m1/s1	MQWQDAVBIBJDRV-NXMSCROESA-N	484.268570292							97732
BRD-K64939621	LSM-12396		54631882	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16-,21+/m0/s1	IMTXHMNNEPVREU-CKJXQJPGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K64939621	BRD-K64939621-001-01-4	Broad Institute of MIT and Harvard	BRD-K64939621			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16-,21+/m0/s1	IMTXHMNNEPVREU-CKJXQJPGSA-N	417.26275663							101023
BRD-K85058337	LSM-13623		54631837	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19-,24+/m1/s1	UGPRBZOFAYTTOL-IECBHUPTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN4CCOCC4	BroadT	BRD-K85058337	BRD-K85058337-001-01-3	Broad Institute of MIT and Harvard	BRD-K85058337			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN1CCOCC1	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19-,24+/m1/s1	UGPRBZOFAYTTOL-IECBHUPTSA-N	516.29478504							102270
BRD-K02817669	LSM-8611		54631897	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m0/s1	HGUJNTNFLCOWHI-CEYNDMKZSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H]1C)OC	BroadT	BRD-K02817669	BRD-K02817669-001-01-0	Broad Institute of MIT and Harvard	BRD-K02817669			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m0/s1	HGUJNTNFLCOWHI-CEYNDMKZSA-N	485.268984862							97232
BRD-K26555669	LSM-10037		54631875	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m1/s1	FAXXRWNSKSYYIM-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K26555669	BRD-K26555669-001-01-8	Broad Institute of MIT and Harvard	BRD-K26555669			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m1/s1	FAXXRWNSKSYYIM-ZMPRRUGASA-N	479.18901998							98658
BRD-K13498994	LSM-9235		54631903	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19+,24+/m0/s1	UGPRBZOFAYTTOL-XLNZFTOWSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN4CCOCC4	BroadT	BRD-K13498994	BRD-K13498994-001-01-2	Broad Institute of MIT and Harvard	BRD-K13498994			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN1CCOCC1	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19+,24+/m0/s1	UGPRBZOFAYTTOL-XLNZFTOWSA-N	516.29478504							97856
BRD-K41042783	LSM-10928		54631818	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25+/m0/s1	HTKHLCDDEOIAQO-OSWQYVSFSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H]1C)OC	BroadT	BRD-K41042783	BRD-K41042783-001-01-9	Broad Institute of MIT and Harvard	BRD-K41042783			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25+/m0/s1	HTKHLCDDEOIAQO-OSWQYVSFSA-N	500.279883904							99549
BRD-K38467418	LSM-10755		54631751	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14-,20+/m1/s1	JSRBXIHVEPNVJQ-JZKQVHKSSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K38467418	BRD-K38467418-001-01-6	Broad Institute of MIT and Harvard	BRD-K38467418			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14-,20+/m1/s1	JSRBXIHVEPNVJQ-JZKQVHKSSA-N	430.2216201							99376
BRD-K05214965	LSM-8739		54631792	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14+,20+/m0/s1	JSRBXIHVEPNVJQ-LRDNONRASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K05214965	BRD-K05214965-001-01-8	Broad Institute of MIT and Harvard	BRD-K05214965			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14+,20+/m0/s1	JSRBXIHVEPNVJQ-LRDNONRASA-N	430.2216201							97360
BRD-K79027750	LSM-13257		54631823	InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13+,17+/m1/s1	BGDCTPQGAPJUMB-IGCXYCKISA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K79027750	BRD-K79027750-001-01-4	Broad Institute of MIT and Harvard	BRD-K79027750			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13+,17+/m1/s1	BGDCTPQGAPJUMB-IGCXYCKISA-N	467.170176316							101896
BRD-K06651637	LSM-8818		54631714	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18-,22-/m0/s1	REUNTGUOEHKOBZ-SPEDKVCISA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)CN(C)C	BroadT	BRD-K06651637	BRD-K06651637-001-01-8	Broad Institute of MIT and Harvard	BRD-K06651637			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)CN(C)C)c1	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18-,22-/m0/s1	REUNTGUOEHKOBZ-SPEDKVCISA-N	476.29987042							97439
BRD-K44737208	LSM-11147		54631904	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22-,29+/m0/s1	QUELGMPZNWRZSJ-IHMCZWCLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K44737208	BRD-K44737208-001-01-8	Broad Institute of MIT and Harvard	BRD-K44737208			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccc1F	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22-,29+/m0/s1	QUELGMPZNWRZSJ-IHMCZWCLSA-N	561.263899482							99768
BRD-K18153171	LSM-9517		54631791	InChI=1S/C26H40N4O5/c1-6-12-27-26(33)30-14-17(2)23(34-5)15-29(4)25(32)21-11-10-20(13-22(21)35-16-18(30)3)28-24(31)19-8-7-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,33)(H,28,31)/t17-,18-,23+/m1/s1	JIFPRSYXXRNMQX-PNCHPQGNSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K18153171	BRD-K18153171-001-01-3	Broad Institute of MIT and Harvard	BRD-K18153171			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H]1C)OC	InChI=1S/C26H40N4O5/c1-6-12-27-26(33)30-14-17(2)23(34-5)15-29(4)25(32)21-11-10-20(13-22(21)35-16-18(30)3)28-24(31)19-8-7-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,33)(H,28,31)/t17-,18-,23+/m1/s1	JIFPRSYXXRNMQX-PNCHPQGNSA-N	488.29987042							98138
BRD-K91922990	LSM-14077		54631712	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16+,20+/m0/s1	QTXSGNVPDCTZEW-RZQQEMMASA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K91922990	BRD-K91922990-001-01-0	Broad Institute of MIT and Harvard	BRD-K91922990			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16+,20+/m0/s1	QTXSGNVPDCTZEW-RZQQEMMASA-N	509.217126508							102731
BRD-K57204946	LSM-11892		54631876	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m0/s1	ZTXXWNNQGVNFQF-XLNZFTOWSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccn3	BroadT	BRD-K57204946	BRD-K57204946-001-01-0	Broad Institute of MIT and Harvard	BRD-K57204946			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccn1	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m0/s1	ZTXXWNNQGVNFQF-XLNZFTOWSA-N	496.268570292							100518
CHEMBL3184089	LSM-10181	BRD-K28862419	54631644	InChI=1S/C30H35N3O4/c1-20-17-31-21(2)19-37-27-16-25(14-15-26(27)30(35)33(3)18-28(20)36-4)32-29(34)24-12-10-23(11-13-24)22-8-6-5-7-9-22/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28+/m0/s1	HAJBOXZNCGYLAF-YHGPEZAFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(cc3)c4ccccc4)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K28862419	BRD-K28862419-001-01-9	Broad Institute of MIT and Harvard	BRD-K28862419			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(cc3)-c3ccccc3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C30H35N3O4/c1-20-17-31-21(2)19-37-27-16-25(14-15-26(27)30(35)33(3)18-28(20)36-4)32-29(34)24-12-10-23(11-13-24)22-8-6-5-7-9-22/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28+/m0/s1	HAJBOXZNCGYLAF-YHGPEZAFSA-N	501.26275663							98802
BRD-K70318404	LSM-12719		54631749	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-17-18(10-16)28-13-15(3)22-11-14(2)19(27-5)12-24(4)21(17)26/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19+/m1/s1	AZDABJQXNZGANX-VCBZYWHSSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K70318404	BRD-K70318404-001-01-6	Broad Institute of MIT and Harvard	BRD-K70318404			CCCC(=O)Nc1ccc2c(OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-17-18(10-16)28-13-15(3)22-11-14(2)19(27-5)12-24(4)21(17)26/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19+/m1/s1	AZDABJQXNZGANX-VCBZYWHSSA-N	391.247106566							131213
BRD-K80843514	LSM-13375		54631822	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16-,21+/m1/s1	IMTXHMNNEPVREU-ZOCZFRKYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K80843514	BRD-K80843514-001-01-8	Broad Institute of MIT and Harvard	BRD-K80843514			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16-,21+/m1/s1	IMTXHMNNEPVREU-ZOCZFRKYSA-N	417.26275663							102014
BRD-K79106177	LSM-13261		54631912	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m0/s1	FAXXRWNSKSYYIM-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K79106177	BRD-K79106177-001-01-1	Broad Institute of MIT and Harvard	BRD-K79106177			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m0/s1	FAXXRWNSKSYYIM-DMPWYTOCSA-N	479.18901998							101900
BRD-K26857129	LSM-10056		54631784	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20+,26-/m0/s1	ZWMNFEZEGHFZOH-UNVFRBQDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC4CC4	BroadT	BRD-K26857129	BRD-K26857129-001-01-2	Broad Institute of MIT and Harvard	BRD-K26857129			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20+,26-/m0/s1	ZWMNFEZEGHFZOH-UNVFRBQDSA-N	522.284220356							98677
BRD-K54145771	LSM-11721		54631657	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18-,23+/m1/s1	RIFMDYVXBSMSIP-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K54145771	BRD-K54145771-001-01-8	Broad Institute of MIT and Harvard	BRD-K54145771			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18-,23+/m1/s1	RIFMDYVXBSMSIP-PNCHPQGNSA-N	439.247106566							100346
BRD-K49014970	LSM-11409		54631609	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17+,22-/m1/s1	VZMYSNMKMPUTCO-HYFFOGBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K49014970	BRD-K49014970-001-01-3	Broad Institute of MIT and Harvard	BRD-K49014970			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17+,22-/m1/s1	VZMYSNMKMPUTCO-HYFFOGBASA-N	491.209006496							100030
BRD-K68057497	LSM-12575		54631836	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m0/s1	ZTXXWNNQGVNFQF-GLDPYIMESA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccn3	BroadT	BRD-K68057497	BRD-K68057497-001-01-2	Broad Institute of MIT and Harvard	BRD-K68057497			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccn1	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m0/s1	ZTXXWNNQGVNFQF-GLDPYIMESA-N	496.268570292							101206
BRD-K11458523	LSM-9127		54631733	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19+,24+/m1/s1	UGPRBZOFAYTTOL-IMWIBFENSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN4CCOCC4	BroadT	BRD-K11458523	BRD-K11458523-001-01-8	Broad Institute of MIT and Harvard	BRD-K11458523			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN1CCOCC1	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19+,24+/m1/s1	UGPRBZOFAYTTOL-IMWIBFENSA-N	516.29478504							97748
BRD-K55432508	LSM-11788		54631844	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24-,31+/m0/s1	OXAYHDRNXZXDOZ-ISTJGCCRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K55432508	BRD-K55432508-001-01-9	Broad Institute of MIT and Harvard	BRD-K55432508			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24-,31+/m0/s1	OXAYHDRNXZXDOZ-ISTJGCCRSA-N	559.304621442							100413
BRD-K91674938	LSM-14058		54631776	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20-,26-/m1/s1	ZWMNFEZEGHFZOH-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC4CC4	BroadT	BRD-K91674938	BRD-K91674938-001-01-2	Broad Institute of MIT and Harvard	BRD-K91674938			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20-,26-/m1/s1	ZWMNFEZEGHFZOH-XMERXJNXSA-N	522.284220356							102711
BRD-K79157597	LSM-13266		54631722	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20+,26+/m1/s1	ZWMNFEZEGHFZOH-GOHWNWGWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CC4CC4	BroadT	BRD-K79157597	BRD-K79157597-001-01-6	Broad Institute of MIT and Harvard	BRD-K79157597			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20+,26+/m1/s1	ZWMNFEZEGHFZOH-GOHWNWGWSA-N	522.284220356							101905
BRD-K08080638	LSM-8916		54631863	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17+,22+/m1/s1	VZMYSNMKMPUTCO-JLHGSKIFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K08080638	BRD-K08080638-001-01-7	Broad Institute of MIT and Harvard	BRD-K08080638			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17+,22+/m1/s1	VZMYSNMKMPUTCO-JLHGSKIFSA-N	491.209006496							97537
BRD-K84651951	LSM-13603		54631655	InChI=1S/C23H37N3O5S/c1-16-13-24-17(2)15-31-21-11-10-18(25-32(28,29)19-8-6-5-7-9-19)12-20(21)23(27)26(3)14-22(16)30-4/h10-12,16-17,19,22,24-25H,5-9,13-15H2,1-4H3/t16-,17-,22+/m0/s1	FFLSYNXDPOASNS-PNLZDCPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C3CCCCC3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K84651951	BRD-K84651951-001-01-1	Broad Institute of MIT and Harvard	BRD-K84651951			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C3CCCCC3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C23H37N3O5S/c1-16-13-24-17(2)15-31-21-11-10-18(25-32(28,29)19-8-6-5-7-9-19)12-20(21)23(27)26(3)14-22(16)30-4/h10-12,16-17,19,22,24-25H,5-9,13-15H2,1-4H3/t16-,17-,22+/m0/s1	FFLSYNXDPOASNS-PNLZDCPESA-N	467.245392004							131221
BRD-K25249292	LSM-9964		54631720	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22-,29-/m1/s1	QUELGMPZNWRZSJ-IEOSBIPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K25249292	BRD-K25249292-001-01-4	Broad Institute of MIT and Harvard	BRD-K25249292			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1F	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22-,29-/m1/s1	QUELGMPZNWRZSJ-IEOSBIPESA-N	561.263899482							98585
BRD-K87445129	LSM-13792		54631866	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24+,31-/m0/s1	OXAYHDRNXZXDOZ-JLELKNTQSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K87445129	BRD-K87445129-001-01-2	Broad Institute of MIT and Harvard	BRD-K87445129			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24+,31-/m0/s1	OXAYHDRNXZXDOZ-JLELKNTQSA-N	559.304621442							102441
BRD-K20754058	LSM-9688		54631666	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m1/s1	ZTXXWNNQGVNFQF-IMWIBFENSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccn3	BroadT	BRD-K20754058	BRD-K20754058-001-01-2	Broad Institute of MIT and Harvard	BRD-K20754058			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccn1	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m1/s1	ZTXXWNNQGVNFQF-IMWIBFENSA-N	496.268570292							98309
BRD-K95515654	LSM-14997		54631849	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m1/s1	ZTXXWNNQGVNFQF-IECBHUPTSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccn3	BroadT	BRD-K95515654	BRD-K95515654-001-01-5	Broad Institute of MIT and Harvard	BRD-K95515654			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccn1	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m1/s1	ZTXXWNNQGVNFQF-IECBHUPTSA-N	496.268570292							103653
BRD-K02003138	LSM-8554		54631812	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17-,22-/m0/s1	VZMYSNMKMPUTCO-HOIFWPIMSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K02003138	BRD-K02003138-001-01-0	Broad Institute of MIT and Harvard	BRD-K02003138			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3OC)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-20-11-10-18(12-19(20)24(28)27(3)14-22(16)32-5)26-34(29,30)23-9-7-6-8-21(23)31-4/h6-12,16-17,22,25-26H,13-15H2,1-5H3/t16-,17-,22-/m0/s1	VZMYSNMKMPUTCO-HOIFWPIMSA-N	491.209006496							97175
BRD-K25097708	LSM-9956		54631855	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18+,22-/m1/s1	LLNFNSHBDLACGS-KGVIQGDOSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K25097708	BRD-K25097708-001-01-5	Broad Institute of MIT and Harvard	BRD-K25097708			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18+,22-/m1/s1	LLNFNSHBDLACGS-KGVIQGDOSA-N	488.245726362							98577
BRD-K02541615	LSM-8593		54631710	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25-/m1/s1	HTKHLCDDEOIAQO-HHJKRLRDSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H]1C)OC	BroadT	BRD-K02541615	BRD-K02541615-001-01-1	Broad Institute of MIT and Harvard	BRD-K02541615			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25-/m1/s1	HTKHLCDDEOIAQO-HHJKRLRDSA-N	500.279883904							97214
BRD-K60778274	LSM-12104		54631680	InChI=1S/C27H42N4O6/c1-6-11-28-27(34)29-21-7-8-22-23(14-21)37-17-19(3)31(25(32)20-9-12-36-13-10-20)15-18(2)24(35-5)16-30(4)26(22)33/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m1/s1	NYJPVGKIWASVOA-IECBHUPTSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)C3CCOCC3	BroadT	BRD-K60778274	BRD-K60778274-001-01-0	Broad Institute of MIT and Harvard	BRD-K60778274			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)C2CCOCC2)c1	InChI=1S/C27H42N4O6/c1-6-11-28-27(34)29-21-7-8-22-23(14-21)37-17-19(3)31(25(32)20-9-12-36-13-10-20)15-18(2)24(35-5)16-30(4)26(22)33/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m1/s1	NYJPVGKIWASVOA-IECBHUPTSA-N	518.310435104							100730
BRD-K76293253	LSM-13096		54631813	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17-,24-/m1/s1	VFFXTZRIOLHXNX-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K76293253	BRD-K76293253-001-01-7	Broad Institute of MIT and Harvard	BRD-K76293253			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17-,24-/m1/s1	VFFXTZRIOLHXNX-HOZJOUCCSA-N	484.268570292							101734
BRD-K66960754	LSM-12507		54631767	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m1/s1	FPIGUEAYUNMTQH-GGUMNFRJSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K66960754	BRD-K66960754-001-01-7	Broad Institute of MIT and Harvard	BRD-K66960754			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H]1C)OC	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m1/s1	FPIGUEAYUNMTQH-GGUMNFRJSA-N	530.22959797							101138
BRD-K08521815	LSM-8944		54631668	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22+,30+/m1/s1	WUHLCXCEWBJVDE-DGIFUFQNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(Cc4ccccc4F)C[C@H]1C	BroadT	BRD-K08521815	BRD-K08521815-001-01-5	Broad Institute of MIT and Harvard	BRD-K08521815			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(Cc2ccccc2F)C[C@H]1C	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22+,30+/m1/s1	WUHLCXCEWBJVDE-DGIFUFQNSA-N	599.246534856							97565
BRD-K58196326	LSM-11943		54631810	InChI=1S/C23H33N5O5S/c1-16-11-28(12-18-9-24-15-25-10-18)17(2)14-33-21-7-6-19(26-34(5,30)31)8-20(21)23(29)27(3)13-22(16)32-4/h6-10,15-17,22,26H,11-14H2,1-5H3/t16-,17+,22+/m0/s1	VPVAZUBGKWFEKV-GSHUGGBRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H]1C	BroadT	BRD-K58196326	BRD-K58196326-001-01-7	Broad Institute of MIT and Harvard	BRD-K58196326			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C23H33N5O5S/c1-16-11-28(12-18-9-24-15-25-10-18)17(2)14-33-21-7-6-19(26-34(5,30)31)8-20(21)23(29)27(3)13-22(16)32-4/h6-10,15-17,22,26H,11-14H2,1-5H3/t16-,17+,22+/m0/s1	VPVAZUBGKWFEKV-GSHUGGBRSA-N	491.220239896							100569
BRD-K11194815	LSM-9113		54631697	InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13+,17+/m0/s1	BGDCTPQGAPJUMB-OGHNNQOOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K11194815	BRD-K11194815-001-01-6	Broad Institute of MIT and Harvard	BRD-K11194815			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13+,17+/m0/s1	BGDCTPQGAPJUMB-OGHNNQOOSA-N	467.170176316							97734
BRD-K04772033	LSM-8725		54631826	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15+,19-/m1/s1	ALCDIEWMKTXBKO-ZRGWGRIASA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K04772033	BRD-K04772033-001-01-4	Broad Institute of MIT and Harvard	BRD-K04772033			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H]1C)OC	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15+,19-/m1/s1	ALCDIEWMKTXBKO-ZRGWGRIASA-N	471.203921116							97346
BRD-K50008654	LSM-11470		54631683	InChI=1S/C24H37F3N4O4/c1-6-10-28-23(33)29-18-7-8-19-20(12-18)35-15-17(3)31(11-9-24(25,26)27)13-16(2)21(34-5)14-30(4)22(19)32/h7-8,12,16-17,21H,6,9-11,13-15H2,1-5H3,(H2,28,29,33)/t16-,17+,21-/m1/s1	VNTQRTFIXZLISU-LLGFUMIMSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(CCC(F)(F)F)[C@@H](C)COc2c1	BroadT	BRD-K50008654	BRD-K50008654-001-01-4	Broad Institute of MIT and Harvard	BRD-K50008654			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37F3N4O4/c1-6-10-28-23(33)29-18-7-8-19-20(12-18)35-15-17(3)31(11-9-24(25,26)27)13-16(2)21(34-5)14-30(4)22(19)32/h7-8,12,16-17,21H,6,9-11,13-15H2,1-5H3,(H2,28,29,33)/t16-,17+,21-/m1/s1	VNTQRTFIXZLISU-LLGFUMIMSA-N	502.276690304							100091
BRD-K97359152	LSM-14410		54631672	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14-,20-/m1/s1	JSRBXIHVEPNVJQ-ARGWCVDVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K97359152	BRD-K97359152-001-01-3	Broad Institute of MIT and Harvard	BRD-K97359152			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14-,20-/m1/s1	JSRBXIHVEPNVJQ-ARGWCVDVSA-N	430.2216201							103064
BRD-K59377703	LSM-12018		54631901	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21+,27-/m0/s1	WKDBULKSLWTRKP-ISCCLHIJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(Cc4cccnc4)C[C@@H]1C	BroadT	BRD-K59377703	BRD-K59377703-001-01-5	Broad Institute of MIT and Harvard	BRD-K59377703			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21+,27-/m0/s1	WKDBULKSLWTRKP-ISCCLHIJSA-N	524.29987042							100644
BRD-K56990873	LSM-11880		54631857	InChI=1S/C28H38FN3O4/c1-6-7-27(33)30-23-12-13-24-25(14-23)36-18-20(3)32(16-21-8-10-22(29)11-9-21)15-19(2)26(35-5)17-31(4)28(24)34/h8-14,19-20,26H,6-7,15-18H2,1-5H3,(H,30,33)/t19-,20-,26+/m1/s1	KMKGAVOVEHQLPH-KYTVRQNUSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccc(F)cc3)[C@H](C)COc2c1	BroadT	BRD-K56990873	BRD-K56990873-001-01-2	Broad Institute of MIT and Harvard	BRD-K56990873			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccc(F)cc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C28H38FN3O4/c1-6-7-27(33)30-23-12-13-24-25(14-23)36-18-20(3)32(16-21-8-10-22(29)11-9-21)15-19(2)26(35-5)17-31(4)28(24)34/h8-14,19-20,26H,6-7,15-18H2,1-5H3,(H,30,33)/t19-,20-,26+/m1/s1	KMKGAVOVEHQLPH-KYTVRQNUSA-N	499.284634926							100506
BRD-K69414416	LSM-12659		54631649	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16-,20+/m1/s1	QTXSGNVPDCTZEW-QINHECLXSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K69414416	BRD-K69414416-001-01-2	Broad Institute of MIT and Harvard	BRD-K69414416			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16-,20+/m1/s1	QTXSGNVPDCTZEW-QINHECLXSA-N	509.217126508							101293
BRD-K93247546	LSM-14148		54631814	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20-,25+/m0/s1	HWYKCLATECFWDF-ZYLNGJIFSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K93247546	BRD-K93247546-001-01-9	Broad Institute of MIT and Harvard	BRD-K93247546			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20-,25+/m0/s1	HWYKCLATECFWDF-ZYLNGJIFSA-N	503.245392004							102802
BRD-K24269428	LSM-9898		54631848	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17+,24+/m0/s1	VFFXTZRIOLHXNX-OBWXTZQISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K24269428	BRD-K24269428-001-01-0	Broad Institute of MIT and Harvard	BRD-K24269428			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17+,24+/m0/s1	VFFXTZRIOLHXNX-OBWXTZQISA-N	484.268570292							98519
BRD-K99515159	LSM-14539		54631828	InChI=1S/C27H42N4O6/c1-6-11-28-27(34)29-21-7-8-22-23(14-21)37-17-19(3)31(25(32)20-9-12-36-13-10-20)15-18(2)24(35-5)16-30(4)26(22)33/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24-/m1/s1	NYJPVGKIWASVOA-YDIMBITNSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C3CCOCC3	BroadT	BRD-K99515159	BRD-K99515159-001-01-1	Broad Institute of MIT and Harvard	BRD-K99515159			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)C2CCOCC2)c1	InChI=1S/C27H42N4O6/c1-6-11-28-27(34)29-21-7-8-22-23(14-21)37-17-19(3)31(25(32)20-9-12-36-13-10-20)15-18(2)24(35-5)16-30(4)26(22)33/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24-/m1/s1	NYJPVGKIWASVOA-YDIMBITNSA-N	518.310435104							103194
BRD-K06475386	LSM-8807		54631735	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m1/s1	FAXXRWNSKSYYIM-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K06475386	BRD-K06475386-001-01-5	Broad Institute of MIT and Harvard	BRD-K06475386			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m1/s1	FAXXRWNSKSYYIM-VVBPWWLESA-N	479.18901998							97428
BRD-K92942746	LSM-14126		54631739	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16+,21+/m1/s1	IMTXHMNNEPVREU-XFQAVAEZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K92942746	BRD-K92942746-001-01-4	Broad Institute of MIT and Harvard	BRD-K92942746			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16+,21+/m1/s1	IMTXHMNNEPVREU-XFQAVAEZSA-N	417.26275663							102780
BRD-K10081616	LSM-9045		54631616	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22+,29+/m1/s1	QUELGMPZNWRZSJ-BXOOBUKZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K10081616	BRD-K10081616-001-01-7	Broad Institute of MIT and Harvard	BRD-K10081616			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1F	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22+,29+/m1/s1	QUELGMPZNWRZSJ-BXOOBUKZSA-N	561.263899482							97666
BRD-K57060993	LSM-11886		54631887	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21+,27+/m0/s1	WKDBULKSLWTRKP-FYQCMVGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(Cc4cccnc4)C[C@@H]1C	BroadT	BRD-K57060993	BRD-K57060993-001-01-8	Broad Institute of MIT and Harvard	BRD-K57060993			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21+,27+/m0/s1	WKDBULKSLWTRKP-FYQCMVGJSA-N	524.29987042							100512
BRD-K34758135	LSM-10518		54631764	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17+,24+/m1/s1	VFFXTZRIOLHXNX-KCYKTTMJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K34758135	BRD-K34758135-001-01-4	Broad Institute of MIT and Harvard	BRD-K34758135			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C26H36N4O5/c1-16-12-30(13-19-6-7-19)17(2)15-34-23-9-8-20(27-25(31)22-10-18(3)35-28-22)11-21(23)26(32)29(4)14-24(16)33-5/h8-11,16-17,19,24H,6-7,12-15H2,1-5H3,(H,27,31)/t16-,17+,24+/m1/s1	VFFXTZRIOLHXNX-KCYKTTMJSA-N	484.268570292							99139
CHEMBL2359016	LSM-11679	BRD-K53290343, SID131427854	54631611	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24-,31-/m0/s1	OXAYHDRNXZXDOZ-MKGJDZFWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K53290343	BRD-K53290343-001-01-2	Broad Institute of MIT and Harvard	BRD-K53290343			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24-,31-/m0/s1	OXAYHDRNXZXDOZ-MKGJDZFWSA-N	559.304621442							100304
BRD-K98793371	LSM-14491		54631843	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18-,22-/m0/s1	LLNFNSHBDLACGS-SPEDKVCISA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K98793371	BRD-K98793371-001-01-7	Broad Institute of MIT and Harvard	BRD-K98793371			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18-,22-/m0/s1	LLNFNSHBDLACGS-SPEDKVCISA-N	488.245726362							103146
BRD-K41952303	LSM-10977		54631889	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15+,19+/m1/s1	ALCDIEWMKTXBKO-VCBZYWHSSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K41952303	BRD-K41952303-001-01-0	Broad Institute of MIT and Harvard	BRD-K41952303			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H]1C)OC	InChI=1S/C21H33N3O7S/c1-14-10-24(20(25)13-29-4)15(2)12-31-18-9-16(22-32(6,27)28)7-8-17(18)21(26)23(3)11-19(14)30-5/h7-9,14-15,19,22H,10-13H2,1-6H3/t14-,15+,19+/m1/s1	ALCDIEWMKTXBKO-VCBZYWHSSA-N	471.203921116							99598
BRD-K31716313	LSM-10352		54631708	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19+,26-/m1/s1	ZMJDYVBEASXUEV-UYXZNNOOSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@H]1C	BroadT	BRD-K31716313	BRD-K31716313-001-01-9	Broad Institute of MIT and Harvard	BRD-K31716313			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2ccccc2OC)C[C@H]1C	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19+,26-/m1/s1	ZMJDYVBEASXUEV-UYXZNNOOSA-N	483.273321314							98973
BRD-K70260471	LSM-12718		54631691	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25+/m1/s1	CHKBOEGZXMMFCS-RNHFSVANSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3cccnc3)[C@@H](C)COc2c1	BroadT	BRD-K70260471	BRD-K70260471-001-01-8	Broad Institute of MIT and Harvard	BRD-K70260471			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3cccnc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25+/m1/s1	CHKBOEGZXMMFCS-RNHFSVANSA-N	497.300204778							101353
BRD-K08210330	LSM-8924		54631653	InChI=1S/C22H30N4O7S/c1-14-11-26(34(5,29)30)15(2)13-32-18-7-6-16(24-21(27)19-8-9-23-33-19)10-17(18)22(28)25(3)12-20(14)31-4/h6-10,14-15,20H,11-13H2,1-5H3,(H,24,27)/t14-,15+,20+/m1/s1	CRZDWKBDRGRNEI-SIFCLUCFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3oncc3)ccc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K08210330	BRD-K08210330-001-01-1	Broad Institute of MIT and Harvard	BRD-K08210330			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccno3)ccc2OC[C@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C22H30N4O7S/c1-14-11-26(34(5,29)30)15(2)13-32-18-7-6-16(24-21(27)19-8-9-23-33-19)10-17(18)22(28)25(3)12-20(14)31-4/h6-10,14-15,20H,11-13H2,1-5H3,(H,24,27)/t14-,15+,20+/m1/s1	CRZDWKBDRGRNEI-SIFCLUCFSA-N	494.18352003							97545
BRD-K92818291	LSM-14120		54631622	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25-/m0/s1	NNPXJSNOAUXSRD-RPPIVITFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K92818291	BRD-K92818291-001-01-5	Broad Institute of MIT and Harvard	BRD-K92818291			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25-/m0/s1	NNPXJSNOAUXSRD-RPPIVITFSA-N	497.25258587							102774
BRD-K99104612	LSM-14514		54631755	InChI=1S/C28H39N3O4/c1-6-27(32)29-23-12-13-24-25(16-23)35-19-21(3)31(15-14-22-10-8-7-9-11-22)17-20(2)26(34-5)18-30(4)28(24)33/h7-13,16,20-21,26H,6,14-15,17-19H2,1-5H3,(H,29,32)/t20-,21+,26-/m1/s1	IOFIBAZLXDARLU-YZIHRLCOSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(CCc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K99104612	BRD-K99104612-001-01-5	Broad Institute of MIT and Harvard	BRD-K99104612			CCC(=O)Nc1ccc2c(OC[C@H](C)N(CCc3ccccc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C28H39N3O4/c1-6-27(32)29-23-12-13-24-25(16-23)35-19-21(3)31(15-14-22-10-8-7-9-11-22)17-20(2)26(34-5)18-30(4)28(24)33/h7-13,16,20-21,26H,6,14-15,17-19H2,1-5H3,(H,29,32)/t20-,21+,26-/m1/s1	IOFIBAZLXDARLU-YZIHRLCOSA-N	481.294056758							103169
BRD-K11156132	LSM-9110		54631686	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14+,20+/m0/s1	RYHWAKGNXXOPFN-LRDNONRASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K11156132	BRD-K11156132-001-01-1	Broad Institute of MIT and Harvard	BRD-K11156132			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14+,20+/m0/s1	RYHWAKGNXXOPFN-LRDNONRASA-N	459.248169206							97731
BRD-K95246884	LSM-14265		54631603	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16+,22-/m0/s1	PQYPJTAQDSWLTB-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3cnccn3	BroadT	BRD-K95246884	BRD-K95246884-001-01-9	Broad Institute of MIT and Harvard	BRD-K95246884			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1cnccn1	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16+,22-/m0/s1	PQYPJTAQDSWLTB-DMPWYTOCSA-N	469.232519142							102919
BRD-K18406496	LSM-9538		54631725	InChI=1S/C28H38FN3O4/c1-6-7-27(33)30-23-12-13-24-25(14-23)36-18-20(3)32(16-21-8-10-22(29)11-9-21)15-19(2)26(35-5)17-31(4)28(24)34/h8-14,19-20,26H,6-7,15-18H2,1-5H3,(H,30,33)/t19-,20+,26-/m0/s1	KMKGAVOVEHQLPH-UNVFRBQDSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccc(F)cc3)[C@H](C)COc2c1	BroadT	BRD-K18406496	BRD-K18406496-001-01-3	Broad Institute of MIT and Harvard	BRD-K18406496			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccc(F)cc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C28H38FN3O4/c1-6-7-27(33)30-23-12-13-24-25(14-23)36-18-20(3)32(16-21-8-10-22(29)11-9-21)15-19(2)26(35-5)17-31(4)28(24)34/h8-14,19-20,26H,6-7,15-18H2,1-5H3,(H,30,33)/t19-,20+,26-/m0/s1	KMKGAVOVEHQLPH-UNVFRBQDSA-N	499.284634926							98159
BRD-K79719155	LSM-13294		54631769	InChI=1S/C28H38FN3O4/c1-6-7-27(33)30-23-12-13-24-25(14-23)36-18-20(3)32(16-21-8-10-22(29)11-9-21)15-19(2)26(35-5)17-31(4)28(24)34/h8-14,19-20,26H,6-7,15-18H2,1-5H3,(H,30,33)/t19-,20-,26-/m0/s1	KMKGAVOVEHQLPH-DYLHXGEVSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccc(F)cc3)[C@@H](C)COc2c1	BroadT	BRD-K79719155	BRD-K79719155-001-01-7	Broad Institute of MIT and Harvard	BRD-K79719155			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccc(F)cc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C28H38FN3O4/c1-6-7-27(33)30-23-12-13-24-25(14-23)36-18-20(3)32(16-21-8-10-22(29)11-9-21)15-19(2)26(35-5)17-31(4)28(24)34/h8-14,19-20,26H,6-7,15-18H2,1-5H3,(H,30,33)/t19-,20-,26-/m0/s1	KMKGAVOVEHQLPH-DYLHXGEVSA-N	499.284634926							101933
BRD-K56219224	LSM-11829		54631597	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m1/s1	HGUJNTNFLCOWHI-HHJKRLRDSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H]1C)OC	BroadT	BRD-K56219224	BRD-K56219224-001-01-2	Broad Institute of MIT and Harvard	BRD-K56219224			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m1/s1	HGUJNTNFLCOWHI-HHJKRLRDSA-N	485.268984862							100454
BRD-K59536184	LSM-12027		54631601	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m0/s1	ZTXXWNNQGVNFQF-AXHZCLLHSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccn3	BroadT	BRD-K59536184	BRD-K59536184-001-01-4	Broad Institute of MIT and Harvard	BRD-K59536184			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccn1	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m0/s1	ZTXXWNNQGVNFQF-AXHZCLLHSA-N	496.268570292							100653
BRD-K61404768	LSM-12148		54631681	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19+,24-/m1/s1	IQLGILJFFYEPBE-YDIMBITNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(CC3CCCCC3)C[C@H]1C	BroadT	BRD-K61404768	BRD-K61404768-001-01-5	Broad Institute of MIT and Harvard	BRD-K61404768			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19+,24-/m1/s1	IQLGILJFFYEPBE-YDIMBITNSA-N	563.2640767							100774
BRD-K86715531	LSM-13739		54631895	InChI=1S/C27H42N4O6/c1-6-11-28-27(34)29-21-7-8-22-23(14-21)37-17-19(3)31(25(32)20-9-12-36-13-10-20)15-18(2)24(35-5)16-30(4)26(22)33/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24+/m1/s1	NYJPVGKIWASVOA-IMWIBFENSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C3CCOCC3	BroadT	BRD-K86715531	BRD-K86715531-001-01-1	Broad Institute of MIT and Harvard	BRD-K86715531			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)C2CCOCC2)c1	InChI=1S/C27H42N4O6/c1-6-11-28-27(34)29-21-7-8-22-23(14-21)37-17-19(3)31(25(32)20-9-12-36-13-10-20)15-18(2)24(35-5)16-30(4)26(22)33/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24+/m1/s1	NYJPVGKIWASVOA-IMWIBFENSA-N	518.310435104							102388
BRD-K22451143	LSM-9789		54631795	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m0/s1	FPIGUEAYUNMTQH-LLJLJFOGSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K22451143	BRD-K22451143-001-01-0	Broad Institute of MIT and Harvard	BRD-K22451143			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35ClN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-12-11-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-19(28)8-10-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m0/s1	FPIGUEAYUNMTQH-LLJLJFOGSA-N	530.22959797							98410
BRD-K39352275	LSM-10814		54631632	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	JFYAEFCKASRCBE-IECBHUPTSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3	BroadT	BRD-K39352275	BRD-K39352275-001-01-1	Broad Institute of MIT and Harvard	BRD-K39352275			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	JFYAEFCKASRCBE-IECBHUPTSA-N	497.25258587							99435
BRD-K66147676	LSM-12462		54631802	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24-/m1/s1	MQWQDAVBIBJDRV-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K66147676	BRD-K66147676-001-01-6	Broad Institute of MIT and Harvard	BRD-K66147676			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24-/m1/s1	MQWQDAVBIBJDRV-QZTZHPFYSA-N	484.268570292							101092
BRD-K88671928	LSM-13879		54631664	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24-,31+/m1/s1	OXAYHDRNXZXDOZ-GQIGMWPISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K88671928	BRD-K88671928-001-01-5	Broad Institute of MIT and Harvard	BRD-K88671928			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24-,31+/m1/s1	OXAYHDRNXZXDOZ-GQIGMWPISA-N	559.304621442							102532
BRD-K46396728	LSM-11261		54631654	InChI=1S/C27H42N4O6/c1-6-11-28-27(34)29-21-7-8-22-23(14-21)37-17-19(3)31(25(32)20-9-12-36-13-10-20)15-18(2)24(35-5)16-30(4)26(22)33/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24-/m0/s1	NYJPVGKIWASVOA-GLDPYIMESA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)C3CCOCC3	BroadT	BRD-K46396728	BRD-K46396728-001-01-2	Broad Institute of MIT and Harvard	BRD-K46396728			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)C2CCOCC2)c1	InChI=1S/C27H42N4O6/c1-6-11-28-27(34)29-21-7-8-22-23(14-21)37-17-19(3)31(25(32)20-9-12-36-13-10-20)15-18(2)24(35-5)16-30(4)26(22)33/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24-/m0/s1	NYJPVGKIWASVOA-GLDPYIMESA-N	518.310435104							99882
BRD-K18817373	LSM-9557		54631793	InChI=1S/C26H40N4O5/c1-6-12-27-26(33)30-14-17(2)23(34-5)15-29(4)25(32)21-11-10-20(13-22(21)35-16-18(30)3)28-24(31)19-8-7-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,33)(H,28,31)/t17-,18-,23+/m0/s1	JIFPRSYXXRNMQX-IUKKYPGJSA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H]1C)OC	BroadT	BRD-K18817373	BRD-K18817373-001-01-9	Broad Institute of MIT and Harvard	BRD-K18817373			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H]1C)OC	InChI=1S/C26H40N4O5/c1-6-12-27-26(33)30-14-17(2)23(34-5)15-29(4)25(32)21-11-10-20(13-22(21)35-16-18(30)3)28-24(31)19-8-7-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,33)(H,28,31)/t17-,18-,23+/m0/s1	JIFPRSYXXRNMQX-IUKKYPGJSA-N	488.29987042							98178
BRD-K15687395	LSM-9367		54631758	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25+/m1/s1	HTKHLCDDEOIAQO-WYEJZRMESA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H]1C)OC	BroadT	BRD-K15687395	BRD-K15687395-001-01-3	Broad Institute of MIT and Harvard	BRD-K15687395			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19+,25+/m1/s1	HTKHLCDDEOIAQO-WYEJZRMESA-N	500.279883904							97988
BRD-K87854506	LSM-13820		54631728	InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13+,17-/m0/s1	BGDCTPQGAPJUMB-AHIWAGSCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K87854506	BRD-K87854506-001-01-8	Broad Institute of MIT and Harvard	BRD-K87854506			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13+,17-/m0/s1	BGDCTPQGAPJUMB-AHIWAGSCSA-N	467.170176316							102470
BRD-K75381775	LSM-13038		54631742	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16-,21-/m0/s1	IMTXHMNNEPVREU-QYWGDWMGSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K75381775	BRD-K75381775-001-01-0	Broad Institute of MIT and Harvard	BRD-K75381775			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16-,21-/m0/s1	IMTXHMNNEPVREU-QYWGDWMGSA-N	417.26275663							101675
BRD-K07918661	LSM-8905		54631831	InChI=1S/C23H33N5O5S/c1-16-11-28(12-18-9-24-15-25-10-18)17(2)14-33-21-7-6-19(26-34(5,30)31)8-20(21)23(29)27(3)13-22(16)32-4/h6-10,15-17,22,26H,11-14H2,1-5H3/t16-,17-,22+/m1/s1	VPVAZUBGKWFEKV-YVHKJVDXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H]1C	BroadT	BRD-K07918661	BRD-K07918661-001-01-9	Broad Institute of MIT and Harvard	BRD-K07918661			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C23H33N5O5S/c1-16-11-28(12-18-9-24-15-25-10-18)17(2)14-33-21-7-6-19(26-34(5,30)31)8-20(21)23(29)27(3)13-22(16)32-4/h6-10,15-17,22,26H,11-14H2,1-5H3/t16-,17-,22+/m1/s1	VPVAZUBGKWFEKV-YVHKJVDXSA-N	491.220239896							97526
BRD-K94116832	LSM-14195		54631690	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20+,26+/m0/s1	ZWMNFEZEGHFZOH-OUDXUNEISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC4CC4	BroadT	BRD-K94116832	BRD-K94116832-001-01-8	Broad Institute of MIT and Harvard	BRD-K94116832			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20+,26+/m0/s1	ZWMNFEZEGHFZOH-OUDXUNEISA-N	522.284220356							102849
BRD-K42397226	LSM-11000		54631840	InChI=1S/C26H33F3N4O4/c1-17-14-33(12-10-26(27,28)29)18(2)16-37-22-13-19(31-24(34)21-7-5-6-11-30-21)8-9-20(22)25(35)32(3)15-23(17)36-4/h5-9,11,13,17-18,23H,10,12,14-16H2,1-4H3,(H,31,34)/t17-,18-,23-/m1/s1	KDJDZTXOVUUOEN-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K42397226	BRD-K42397226-001-01-1	Broad Institute of MIT and Harvard	BRD-K42397226			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C26H33F3N4O4/c1-17-14-33(12-10-26(27,28)29)18(2)16-37-22-13-19(31-24(34)21-7-5-6-11-30-21)8-9-20(22)25(35)32(3)15-23(17)36-4/h5-9,11,13,17-18,23H,10,12,14-16H2,1-4H3,(H,31,34)/t17-,18-,23-/m1/s1	KDJDZTXOVUUOEN-PMAPCBKXSA-N	522.245390176							99621
BRD-K55819735	LSM-11811		54631873	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14+,20+/m1/s1	RYHWAKGNXXOPFN-CKNLXJGOSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K55819735	BRD-K55819735-001-01-2	Broad Institute of MIT and Harvard	BRD-K55819735			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14+,20+/m1/s1	RYHWAKGNXXOPFN-CKNLXJGOSA-N	459.248169206							100436
BRD-K66850406	LSM-12501		54631852	InChI=1S/C22H30N4O7S/c1-14-11-26(34(5,29)30)15(2)13-32-18-7-6-16(24-21(27)19-8-9-23-33-19)10-17(18)22(28)25(3)12-20(14)31-4/h6-10,14-15,20H,11-13H2,1-5H3,(H,24,27)/t14-,15-,20-/m1/s1	CRZDWKBDRGRNEI-STXHMFSFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3oncc3)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K66850406	BRD-K66850406-001-01-2	Broad Institute of MIT and Harvard	BRD-K66850406			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccno3)ccc2OC[C@@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C22H30N4O7S/c1-14-11-26(34(5,29)30)15(2)13-32-18-7-6-16(24-21(27)19-8-9-23-33-19)10-17(18)22(28)25(3)12-20(14)31-4/h6-10,14-15,20H,11-13H2,1-5H3,(H,24,27)/t14-,15-,20-/m1/s1	CRZDWKBDRGRNEI-STXHMFSFSA-N	494.18352003							101132
BRD-K07197565	LSM-8851		54631625	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25+/m1/s1	CHKBOEGZXMMFCS-FHAGJXEFSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3cccnc3)[C@H](C)COc2c1	BroadT	BRD-K07197565	BRD-K07197565-001-01-7	Broad Institute of MIT and Harvard	BRD-K07197565			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cccnc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25+/m1/s1	CHKBOEGZXMMFCS-FHAGJXEFSA-N	497.300204778							97472
BRD-K01373529	LSM-8521		54631770	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	AICRRUIGWBNRBB-AXHZCLLHSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K01373529	BRD-K01373529-001-01-5	Broad Institute of MIT and Harvard	BRD-K01373529			CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	AICRRUIGWBNRBB-AXHZCLLHSA-N	468.273655672							97142
BRD-K60413918	LSM-12080		54631817	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18-,22+/m1/s1	REUNTGUOEHKOBZ-HMFYCAOWSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)CN(C)C	BroadT	BRD-K60413918	BRD-K60413918-001-01-6	Broad Institute of MIT and Harvard	BRD-K60413918			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)CN(C)C)c1	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18-,22+/m1/s1	REUNTGUOEHKOBZ-HMFYCAOWSA-N	476.29987042							100706
BRD-K11901011	LSM-9149		54631824	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16+,22-/m1/s1	PQYPJTAQDSWLTB-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c3cnccn3	BroadT	BRD-K11901011	BRD-K11901011-001-01-6	Broad Institute of MIT and Harvard	BRD-K11901011			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16+,22-/m1/s1	PQYPJTAQDSWLTB-ZMPRRUGASA-N	469.232519142							97770
BRD-K49956785	LSM-11467		54631745	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18+,22+/m0/s1	LLNFNSHBDLACGS-NJNPRVFISA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K49956785	BRD-K49956785-001-01-0	Broad Institute of MIT and Harvard	BRD-K49956785			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18+,22+/m0/s1	LLNFNSHBDLACGS-NJNPRVFISA-N	488.245726362							100088
BRD-K28377322	LSM-10146		54631786	InChI=1S/C26H40N4O5/c1-6-12-27-26(33)30-14-17(2)23(34-5)15-29(4)25(32)21-11-10-20(13-22(21)35-16-18(30)3)28-24(31)19-8-7-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,33)(H,28,31)/t17-,18+,23+/m1/s1	JIFPRSYXXRNMQX-STSQHVNTSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H]1C)OC	BroadT	BRD-K28377322	BRD-K28377322-001-01-4	Broad Institute of MIT and Harvard	BRD-K28377322			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H]1C)OC	InChI=1S/C26H40N4O5/c1-6-12-27-26(33)30-14-17(2)23(34-5)15-29(4)25(32)21-11-10-20(13-22(21)35-16-18(30)3)28-24(31)19-8-7-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,33)(H,28,31)/t17-,18+,23+/m1/s1	JIFPRSYXXRNMQX-STSQHVNTSA-N	488.29987042							98767
BRD-K76527508	LSM-13109		54631805	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m1/s1	HGUJNTNFLCOWHI-MPCDZSKCSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H]1C)OC	BroadT	BRD-K76527508	BRD-K76527508-001-01-1	Broad Institute of MIT and Harvard	BRD-K76527508			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-13-31-15-18(2)25(34-5)16-30(4)27(33)22-12-11-20(14-24(22)35-17-19(31)3)29-26(32)21-9-7-8-10-23(21)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m1/s1	HGUJNTNFLCOWHI-MPCDZSKCSA-N	485.268984862							101747
BRD-K85667213	LSM-13670		54631596	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m0/s1	AICRRUIGWBNRBB-XLNZFTOWSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K85667213	BRD-K85667213-001-01-0	Broad Institute of MIT and Harvard	BRD-K85667213			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m0/s1	AICRRUIGWBNRBB-XLNZFTOWSA-N	468.273655672							102317
BRD-K94198920	LSM-14201		54631718	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19-,25-/m1/s1	YQOYUVQVCGNRJC-MPCDZSKCSA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K94198920	BRD-K94198920-001-01-9	Broad Institute of MIT and Harvard	BRD-K94198920			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H]1C)OC	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19-,25-/m1/s1	YQOYUVQVCGNRJC-MPCDZSKCSA-N	527.263150554							102855
BRD-K94223259	LSM-14205		54631821	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16+,22+/m1/s1	PQYPJTAQDSWLTB-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c3cnccn3	BroadT	BRD-K94223259	BRD-K94223259-001-01-6	Broad Institute of MIT and Harvard	BRD-K94223259			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16+,22+/m1/s1	PQYPJTAQDSWLTB-VVBPWWLESA-N	469.232519142							102859
BRD-K62748060	LSM-12239		54631678	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19+,26+/m0/s1	ZMJDYVBEASXUEV-GNBJCERTSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@@H]1C	BroadT	BRD-K62748060	BRD-K62748060-001-01-9	Broad Institute of MIT and Harvard	BRD-K62748060			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2ccccc2OC)C[C@@H]1C	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-9-7-8-10-24(21)33-5)19(2)17-35-25-12-11-22(28-20(3)31)13-23(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19+,26+/m0/s1	ZMJDYVBEASXUEV-GNBJCERTSA-N	483.273321314							100865
BRD-K61998593	LSM-12190		54631630	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21+,27-/m1/s1	ZEGIYGLHXRHVDM-PBDKAQRYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccccc4	BroadT	BRD-K61998593	BRD-K61998593-001-01-7	Broad Institute of MIT and Harvard	BRD-K61998593			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21+,27-/m1/s1	ZEGIYGLHXRHVDM-PBDKAQRYSA-N	537.283885998							100816
BRD-K52097822	LSM-11615		54631862	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18-,22+/m0/s1	LLNFNSHBDLACGS-NPPFBWRTSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K52097822	BRD-K52097822-001-01-2	Broad Institute of MIT and Harvard	BRD-K52097822			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18-,22+/m0/s1	LLNFNSHBDLACGS-NPPFBWRTSA-N	488.245726362							100238
BRD-K90601358	LSM-14008		54631891	InChI=1S/C27H38N4O5/c1-18-12-31(13-22-16-35-17-28-22)19(2)15-36-24-11-21(29-26(32)20-7-5-6-8-20)9-10-23(24)27(33)30(3)14-25(18)34-4/h9-11,16-20,25H,5-8,12-15H2,1-4H3,(H,29,32)/t18-,19-,25+/m1/s1	MYQCBFUDPAPJCT-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(Cc4cocn4)C[C@H]1C	BroadT	BRD-K90601358	BRD-K90601358-001-01-7	Broad Institute of MIT and Harvard	BRD-K90601358			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(Cc2cocn2)C[C@H]1C	InChI=1S/C27H38N4O5/c1-18-12-31(13-22-16-35-17-28-22)19(2)15-36-24-11-21(29-26(32)20-7-5-6-8-20)9-10-23(24)27(33)30(3)14-25(18)34-4/h9-11,16-20,25H,5-8,12-15H2,1-4H3,(H,29,32)/t18-,19-,25+/m1/s1	MYQCBFUDPAPJCT-RRQZXNHTSA-N	498.284220356							102661
BRD-K24685884	LSM-9927		54631856	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22+,29+/m0/s1	QUELGMPZNWRZSJ-DKGMKSHISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K24685884	BRD-K24685884-001-01-4	Broad Institute of MIT and Harvard	BRD-K24685884			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1F	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22+,29+/m0/s1	QUELGMPZNWRZSJ-DKGMKSHISA-N	561.263899482							98548
BRD-K82710433	LSM-13478		54631907	InChI=1S/C28H39N3O4/c1-6-27(32)29-23-12-13-24-25(16-23)35-19-21(3)31(15-14-22-10-8-7-9-11-22)17-20(2)26(34-5)18-30(4)28(24)33/h7-13,16,20-21,26H,6,14-15,17-19H2,1-5H3,(H,29,32)/t20-,21+,26+/m1/s1	IOFIBAZLXDARLU-SWYRRKHMSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CCc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K82710433	BRD-K82710433-001-01-5	Broad Institute of MIT and Harvard	BRD-K82710433			CCC(=O)Nc1ccc2c(OC[C@H](C)N(CCc3ccccc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C28H39N3O4/c1-6-27(32)29-23-12-13-24-25(16-23)35-19-21(3)31(15-14-22-10-8-7-9-11-22)17-20(2)26(34-5)18-30(4)28(24)33/h7-13,16,20-21,26H,6,14-15,17-19H2,1-5H3,(H,29,32)/t20-,21+,26+/m1/s1	IOFIBAZLXDARLU-SWYRRKHMSA-N	481.294056758							102118
BRD-K83251511	LSM-13514		54631808	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25-/m1/s1	CHKBOEGZXMMFCS-OHUGHZGNSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3cccnc3)[C@@H](C)COc2c1	BroadT	BRD-K83251511	BRD-K83251511-001-01-4	Broad Institute of MIT and Harvard	BRD-K83251511			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3cccnc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25-/m1/s1	CHKBOEGZXMMFCS-OHUGHZGNSA-N	497.300204778							102155
BRD-K60237462	LSM-12070		54631642	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25-/m0/s1	CHKBOEGZXMMFCS-DFIYOIEZSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3cccnc3)[C@H](C)COc2c1	BroadT	BRD-K60237462	BRD-K60237462-001-01-9	Broad Institute of MIT and Harvard	BRD-K60237462			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cccnc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20+,25-/m0/s1	CHKBOEGZXMMFCS-DFIYOIEZSA-N	497.300204778							100696
BRD-K73141149	LSM-12908		54631696	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20+,25-/m0/s1	HWYKCLATECFWDF-DFIYOIEZSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K73141149	BRD-K73141149-001-01-9	Broad Institute of MIT and Harvard	BRD-K73141149			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H]1C)OC	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20+,25-/m0/s1	HWYKCLATECFWDF-DFIYOIEZSA-N	503.245392004							101545
BRD-K81606899	LSM-13409		54631607	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m0/s1	FAXXRWNSKSYYIM-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K81606899	BRD-K81606899-001-01-3	Broad Institute of MIT and Harvard	BRD-K81606899			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m0/s1	FAXXRWNSKSYYIM-WJONJSRFSA-N	479.18901998							102049
BRD-K33689388	LSM-10471		54631635	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20+,25-/m1/s1	HWYKCLATECFWDF-OHUGHZGNSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K33689388	BRD-K33689388-001-01-6	Broad Institute of MIT and Harvard	BRD-K33689388			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	InChI=1S/C26H37N3O5S/c1-6-14-29-16-19(2)25(33-5)17-28(4)26(30)23-15-21(12-13-24(23)34-18-20(29)3)27-35(31,32)22-10-8-7-9-11-22/h7-13,15,19-20,25,27H,6,14,16-18H2,1-5H3/t19-,20+,25-/m1/s1	HWYKCLATECFWDF-OHUGHZGNSA-N	503.245392004							99092
BRD-K67786373	LSM-12561		54631748	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19-,24-/m0/s1	IQLGILJFFYEPBE-JXQFQVJHSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(CC3CCCCC3)C[C@@H]1C	BroadT	BRD-K67786373	BRD-K67786373-001-01-6	Broad Institute of MIT and Harvard	BRD-K67786373			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19-,24-/m0/s1	IQLGILJFFYEPBE-JXQFQVJHSA-N	563.2640767							101192
BRD-K39659850	LSM-10839		54631618	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-17-18(10-16)28-13-15(3)22-11-14(2)19(27-5)12-24(4)21(17)26/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15-,19+/m1/s1	AZDABJQXNZGANX-CLCXKQKWSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K39659850	BRD-K39659850-001-01-2	Broad Institute of MIT and Harvard	BRD-K39659850			CCCC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-17-18(10-16)28-13-15(3)22-11-14(2)19(27-5)12-24(4)21(17)26/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15-,19+/m1/s1	AZDABJQXNZGANX-CLCXKQKWSA-N	391.247106566							99460
BRD-K81403739	LSM-13398		54631829	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20+,26-/m1/s1	ZWMNFEZEGHFZOH-BVFVYWQFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CC4CC4	BroadT	BRD-K81403739	BRD-K81403739-001-01-9	Broad Institute of MIT and Harvard	BRD-K81403739			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20+,26-/m1/s1	ZWMNFEZEGHFZOH-BVFVYWQFSA-N	522.284220356							102038
BRD-K32636206	LSM-10407		54631879	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25-/m1/s1	CHKBOEGZXMMFCS-UMEGOILYSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3cccnc3)[C@H](C)COc2c1	BroadT	BRD-K32636206	BRD-K32636206-001-01-8	Broad Institute of MIT and Harvard	BRD-K32636206			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cccnc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H39N5O4/c1-6-11-29-27(34)30-22-9-10-23-24(13-22)36-18-20(3)32(16-21-8-7-12-28-14-21)15-19(2)25(35-5)17-31(4)26(23)33/h7-10,12-14,19-20,25H,6,11,15-18H2,1-5H3,(H2,29,30,34)/t19-,20-,25-/m1/s1	CHKBOEGZXMMFCS-UMEGOILYSA-N	497.300204778							99028
CHEMBL2360719	LSM-12663	BRD-K69441986, SID131428121	54631878	InChI=1S/C30H35N3O4/c1-20-17-31-21(2)19-37-27-16-25(14-15-26(27)30(35)33(3)18-28(20)36-4)32-29(34)24-12-10-23(11-13-24)22-8-6-5-7-9-22/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28+/m1/s1	HAJBOXZNCGYLAF-GGJMMHKRSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(cc3)c4ccccc4)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K69441986	BRD-K69441986-001-01-5	Broad Institute of MIT and Harvard	BRD-K69441986			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(cc3)-c3ccccc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C30H35N3O4/c1-20-17-31-21(2)19-37-27-16-25(14-15-26(27)30(35)33(3)18-28(20)36-4)32-29(34)24-12-10-23(11-13-24)22-8-6-5-7-9-22/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28+/m1/s1	HAJBOXZNCGYLAF-GGJMMHKRSA-N	501.26275663							101297
BRD-K59291587	LSM-12010		54631737	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14+,20-/m0/s1	JSRBXIHVEPNVJQ-MNVSYLFESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K59291587	BRD-K59291587-001-01-9	Broad Institute of MIT and Harvard	BRD-K59291587			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14+,20-/m0/s1	JSRBXIHVEPNVJQ-MNVSYLFESA-N	430.2216201							100636
BRD-K24390300	LSM-9906		54631890	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m1/s1	MDBZRSBKDCCZHT-HYFFOGBASA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(CC3CC3)[C@@H](C)COc2c1	BroadT	BRD-K24390300	BRD-K24390300-001-01-7	Broad Institute of MIT and Harvard	BRD-K24390300			COCC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CC3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m1/s1	MDBZRSBKDCCZHT-HYFFOGBASA-N	447.273321314							98527
BRD-K19223413	LSM-9585		54631762	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25-/m0/s1	HTKHLCDDEOIAQO-MHPIHPPYSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H]1C)OC	BroadT	BRD-K19223413	BRD-K19223413-001-01-1	Broad Institute of MIT and Harvard	BRD-K19223413			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25-/m0/s1	HTKHLCDDEOIAQO-MHPIHPPYSA-N	500.279883904							98206
BRD-K32665240	LSM-10411		54631747	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	AICRRUIGWBNRBB-GLDPYIMESA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K32665240	BRD-K32665240-001-01-5	Broad Institute of MIT and Harvard	BRD-K32665240			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	AICRRUIGWBNRBB-GLDPYIMESA-N	468.273655672							99032
BRD-K96611378	LSM-14355		54631797	InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13+,17-/m1/s1	BGDCTPQGAPJUMB-IIYDPXPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K96611378	BRD-K96611378-001-01-6	Broad Institute of MIT and Harvard	BRD-K96611378			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13+,17-/m1/s1	BGDCTPQGAPJUMB-IIYDPXPESA-N	467.170176316							103009
BRD-K68955961	LSM-12639		54631756	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21-,27+/m0/s1	WKDBULKSLWTRKP-NOMHHCBYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(Cc4cccnc4)C[C@@H]1C	BroadT	BRD-K68955961	BRD-K68955961-001-01-4	Broad Institute of MIT and Harvard	BRD-K68955961			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C29H40N4O5/c1-20-16-33(17-22-6-5-11-30-15-22)21(2)19-38-26-8-7-24(31-28(34)23-9-12-37-13-10-23)14-25(26)29(35)32(3)18-27(20)36-4/h5-8,11,14-15,20-21,23,27H,9-10,12-13,16-19H2,1-4H3,(H,31,34)/t20-,21-,27+/m0/s1	WKDBULKSLWTRKP-NOMHHCBYSA-N	524.29987042							101272
BRD-K28431554	LSM-10149		54631908	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18+,22-/m1/s1	REUNTGUOEHKOBZ-KGVIQGDOSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)CN(C)C	BroadT	BRD-K28431554	BRD-K28431554-001-01-8	Broad Institute of MIT and Harvard	BRD-K28431554			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CN(C)C)c1	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18+,22-/m1/s1	REUNTGUOEHKOBZ-KGVIQGDOSA-N	476.29987042							98770
BRD-K73969578	LSM-12957		54631803	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19+,25-/m0/s1	YQOYUVQVCGNRJC-CEYNDMKZSA-N	COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K73969578	BRD-K73969578-001-01-3	Broad Institute of MIT and Harvard	BRD-K73969578			COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H]1C)OC	InChI=1S/C28H37N3O7/c1-18-14-31(26(32)17-35-4)19(2)16-38-24-13-21(29-27(33)20-7-10-22(36-5)11-8-20)9-12-23(24)28(34)30(3)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,29,33)/t18-,19+,25-/m0/s1	YQOYUVQVCGNRJC-CEYNDMKZSA-N	527.263150554							101594
BRD-K63484733	LSM-12293		54631783	InChI=1S/C24H37F3N4O4/c1-6-10-28-23(33)29-18-7-8-19-20(12-18)35-15-17(3)31(11-9-24(25,26)27)13-16(2)21(34-5)14-30(4)22(19)32/h7-8,12,16-17,21H,6,9-11,13-15H2,1-5H3,(H2,28,29,33)/t16-,17-,21+/m1/s1	VNTQRTFIXZLISU-LZJOCLMNSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CCC(F)(F)F)[C@H](C)COc2c1	BroadT	BRD-K63484733	BRD-K63484733-001-01-7	Broad Institute of MIT and Harvard	BRD-K63484733			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37F3N4O4/c1-6-10-28-23(33)29-18-7-8-19-20(12-18)35-15-17(3)31(11-9-24(25,26)27)13-16(2)21(34-5)14-30(4)22(19)32/h7-8,12,16-17,21H,6,9-11,13-15H2,1-5H3,(H2,28,29,33)/t16-,17-,21+/m1/s1	VNTQRTFIXZLISU-LZJOCLMNSA-N	502.276690304							100919
BRD-K51147721	LSM-11556		54631740	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19-,24-/m0/s1	UGPRBZOFAYTTOL-JXQFQVJHSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN4CCOCC4	BroadT	BRD-K51147721	BRD-K51147721-001-01-8	Broad Institute of MIT and Harvard	BRD-K51147721			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN1CCOCC1	InChI=1S/C27H40N4O6/c1-18-14-31(25(32)16-30-9-11-36-12-10-30)19(2)17-37-23-8-7-21(28-26(33)20-5-6-20)13-22(23)27(34)29(3)15-24(18)35-4/h7-8,13,18-20,24H,5-6,9-12,14-17H2,1-4H3,(H,28,33)/t18-,19-,24-/m0/s1	UGPRBZOFAYTTOL-JXQFQVJHSA-N	516.29478504							100179
BRD-K67839548	LSM-12564		54631781	InChI=1S/C24H37F3N4O4/c1-6-10-28-23(33)29-18-7-8-19-20(12-18)35-15-17(3)31(11-9-24(25,26)27)13-16(2)21(34-5)14-30(4)22(19)32/h7-8,12,16-17,21H,6,9-11,13-15H2,1-5H3,(H2,28,29,33)/t16-,17+,21+/m0/s1	VNTQRTFIXZLISU-CSODHUTKSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CCC(F)(F)F)[C@H](C)COc2c1	BroadT	BRD-K67839548	BRD-K67839548-001-01-3	Broad Institute of MIT and Harvard	BRD-K67839548			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37F3N4O4/c1-6-10-28-23(33)29-18-7-8-19-20(12-18)35-15-17(3)31(11-9-24(25,26)27)13-16(2)21(34-5)14-30(4)22(19)32/h7-8,12,16-17,21H,6,9-11,13-15H2,1-5H3,(H2,28,29,33)/t16-,17+,21+/m0/s1	VNTQRTFIXZLISU-CSODHUTKSA-N	502.276690304							101195
CHEMBL3187513	LSM-10718	BRD-K37838939	54631633	InChI=1S/C30H35N3O4/c1-20-17-31-21(2)19-37-27-16-25(14-15-26(27)30(35)33(3)18-28(20)36-4)32-29(34)24-12-10-23(11-13-24)22-8-6-5-7-9-22/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28+/m1/s1	HAJBOXZNCGYLAF-CJYOKPGZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(cc3)c4ccccc4)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K37838939	BRD-K37838939-001-01-9	Broad Institute of MIT and Harvard	BRD-K37838939			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(cc3)-c3ccccc3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C30H35N3O4/c1-20-17-31-21(2)19-37-27-16-25(14-15-26(27)30(35)33(3)18-28(20)36-4)32-29(34)24-12-10-23(11-13-24)22-8-6-5-7-9-22/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28+/m1/s1	HAJBOXZNCGYLAF-CJYOKPGZSA-N	501.26275663							99339
BRD-K84003657	LSM-13561		54631858	InChI=1S/C22H30N4O7S/c1-14-11-26(34(5,29)30)15(2)13-32-18-7-6-16(24-21(27)19-8-9-23-33-19)10-17(18)22(28)25(3)12-20(14)31-4/h6-10,14-15,20H,11-13H2,1-5H3,(H,24,27)/t14-,15+,20+/m0/s1	CRZDWKBDRGRNEI-BXTJHSDWSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3oncc3)ccc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)C	BroadT	BRD-K84003657	BRD-K84003657-001-01-2	Broad Institute of MIT and Harvard	BRD-K84003657			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccno3)ccc2OC[C@@H](C)N(C[C@@H]1C)S(C)(=O)=O	InChI=1S/C22H30N4O7S/c1-14-11-26(34(5,29)30)15(2)13-32-18-7-6-16(24-21(27)19-8-9-23-33-19)10-17(18)22(28)25(3)12-20(14)31-4/h6-10,14-15,20H,11-13H2,1-5H3,(H,24,27)/t14-,15+,20+/m0/s1	CRZDWKBDRGRNEI-BXTJHSDWSA-N	494.18352003							102203
BRD-K29635534	LSM-10225		54631741	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	AICRRUIGWBNRBB-IECBHUPTSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K29635534	BRD-K29635534-001-01-8	Broad Institute of MIT and Harvard	BRD-K29635534			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccncc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	AICRRUIGWBNRBB-IECBHUPTSA-N	468.273655672							98846
BRD-K49215584	LSM-11421		54631689	InChI=1S/C21H31N5O5S/c1-14-9-22-15(2)12-31-18-8-16(24-32(28,29)20-11-25(3)13-23-20)6-7-17(18)21(27)26(4)10-19(14)30-5/h6-8,11,13-15,19,22,24H,9-10,12H2,1-5H3/t14-,15+,19+/m1/s1	QXYUWGLBJNPRKS-VCBZYWHSSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K49215584	BRD-K49215584-001-01-4	Broad Institute of MIT and Harvard	BRD-K49215584			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C21H31N5O5S/c1-14-9-22-15(2)12-31-18-8-16(24-32(28,29)20-11-25(3)13-23-20)6-7-17(18)21(27)26(4)10-19(14)30-5/h6-8,11,13-15,19,22,24H,9-10,12H2,1-5H3/t14-,15+,19+/m1/s1	QXYUWGLBJNPRKS-VCBZYWHSSA-N	465.204589832							100042
BRD-K94390294	LSM-14216		54631868	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16-,20-/m0/s1	QTXSGNVPDCTZEW-FTRWYGJKSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K94390294	BRD-K94390294-001-01-0	Broad Institute of MIT and Harvard	BRD-K94390294			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16-,20-/m0/s1	QTXSGNVPDCTZEW-FTRWYGJKSA-N	509.217126508							102870
CHEMBL2361456	LSM-11548	BRD-K51052187, SID131427948	54631705	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25+/m0/s1	NNPXJSNOAUXSRD-DPOKWSEZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K51052187	BRD-K51052187-001-01-7	Broad Institute of MIT and Harvard	BRD-K51052187			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25+/m0/s1	NNPXJSNOAUXSRD-DPOKWSEZSA-N	497.25258587							100171
BRD-K43571148	LSM-11084		54631730	InChI=1S/C27H42N4O6/c1-6-11-28-27(34)29-21-7-8-22-23(14-21)37-17-19(3)31(25(32)20-9-12-36-13-10-20)15-18(2)24(35-5)16-30(4)26(22)33/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m0/s1	NYJPVGKIWASVOA-AXHZCLLHSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)C3CCOCC3	BroadT	BRD-K43571148	BRD-K43571148-001-01-5	Broad Institute of MIT and Harvard	BRD-K43571148			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)C2CCOCC2)c1	InChI=1S/C27H42N4O6/c1-6-11-28-27(34)29-21-7-8-22-23(14-21)37-17-19(3)31(25(32)20-9-12-36-13-10-20)15-18(2)24(35-5)16-30(4)26(22)33/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m0/s1	NYJPVGKIWASVOA-AXHZCLLHSA-N	518.310435104							99705
BRD-K69310574	LSM-12653		54631621	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	AICRRUIGWBNRBB-YDIMBITNSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K69310574	BRD-K69310574-001-01-0	Broad Institute of MIT and Harvard	BRD-K69310574			CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccncc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-7-8-23-22(13-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-9-11-27-12-10-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	AICRRUIGWBNRBB-YDIMBITNSA-N	468.273655672							101287
BRD-K88809956	LSM-13886		54631860	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14-,20+/m0/s1	RYHWAKGNXXOPFN-PJSUUKDQSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K88809956	BRD-K88809956-001-01-6	Broad Institute of MIT and Harvard	BRD-K88809956			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C23H33N5O5/c1-13-10-24-14(2)12-32-19-9-17(25-23(30)26-21-15(3)27-33-16(21)4)7-8-18(19)22(29)28(5)11-20(13)31-6/h7-9,13-14,20,24H,10-12H2,1-6H3,(H2,25,26,30)/t13-,14-,20+/m0/s1	RYHWAKGNXXOPFN-PJSUUKDQSA-N	459.248169206							102539
BRD-K49354529	LSM-11428		54631787	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21-,27+/m0/s1	ZEGIYGLHXRHVDM-NOMHHCBYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4ccccc4	BroadT	BRD-K49354529	BRD-K49354529-001-01-9	Broad Institute of MIT and Harvard	BRD-K49354529			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccc1	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21-,27+/m0/s1	ZEGIYGLHXRHVDM-NOMHHCBYSA-N	537.283885998							100049
BRD-K41539628	LSM-10950		54631731	InChI=1S/C30H48N4O5/c1-21-17-34(18-23-12-14-38-15-13-23)22(2)20-39-27-16-25(32-30(36)31-24-8-6-5-7-9-24)10-11-26(27)29(35)33(3)19-28(21)37-4/h10-11,16,21-24,28H,5-9,12-15,17-20H2,1-4H3,(H2,31,32,36)/t21-,22-,28-/m1/s1	BBKYXTVRCKEXQS-DQCZWYHMSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC3CCCCC3)cc2OC[C@@H](C)N(CC4CCOCC4)C[C@H]1C	BroadT	BRD-K41539628	BRD-K41539628-001-01-3	Broad Institute of MIT and Harvard	BRD-K41539628			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC3CCCCC3)cc2OC[C@@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C30H48N4O5/c1-21-17-34(18-23-12-14-38-15-13-23)22(2)20-39-27-16-25(32-30(36)31-24-8-6-5-7-9-24)10-11-26(27)29(35)33(3)19-28(21)37-4/h10-11,16,21-24,28H,5-9,12-15,17-20H2,1-4H3,(H2,31,32,36)/t21-,22-,28-/m1/s1	BBKYXTVRCKEXQS-DQCZWYHMSA-N	544.362470676							99571
BRD-K09260588	LSM-8986		54631807	InChI=1S/C28H39N3O4/c1-6-27(32)29-23-12-13-24-25(16-23)35-19-21(3)31(15-14-22-10-8-7-9-11-22)17-20(2)26(34-5)18-30(4)28(24)33/h7-13,16,20-21,26H,6,14-15,17-19H2,1-5H3,(H,29,32)/t20-,21-,26-/m1/s1	IOFIBAZLXDARLU-IPVFLDMMSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(CCc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K09260588	BRD-K09260588-001-01-4	Broad Institute of MIT and Harvard	BRD-K09260588			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(CCc3ccccc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C28H39N3O4/c1-6-27(32)29-23-12-13-24-25(16-23)35-19-21(3)31(15-14-22-10-8-7-9-11-22)17-20(2)26(34-5)18-30(4)28(24)33/h7-13,16,20-21,26H,6,14-15,17-19H2,1-5H3,(H,29,32)/t20-,21-,26-/m1/s1	IOFIBAZLXDARLU-IPVFLDMMSA-N	481.294056758							97607
BRD-K25196723	LSM-14771		54631850	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23-/m1/s1	FNBLPFIHIJQMKK-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CCC3	BroadT	BRD-K25196723	BRD-K25196723-001-01-6	Broad Institute of MIT and Harvard	BRD-K25196723			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23-/m1/s1	FNBLPFIHIJQMKK-PMAPCBKXSA-N	488.29987042							103427
BRD-K06723172	LSM-8824		54631838	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24-/m0/s1	MQWQDAVBIBJDRV-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K06723172	BRD-K06723172-001-01-6	Broad Institute of MIT and Harvard	BRD-K06723172			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-22-12-11-19(13-20(22)25(31)30(4)15-24(17)34-6)27-26(32)28-21-9-7-8-10-23(21)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24-/m0/s1	MQWQDAVBIBJDRV-XFAGBWLFSA-N	484.268570292							97445
BRD-K22246751	LSM-9775		54631914	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25+/m0/s1	HTKHLCDDEOIAQO-XHNVNVPESA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H]1C)OC	BroadT	BRD-K22246751	BRD-K22246751-001-01-7	Broad Institute of MIT and Harvard	BRD-K22246751			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H]1C)OC	InChI=1S/C27H37FN4O4/c1-6-13-32-15-18(2)25(35-5)16-31(4)26(33)21-14-20(11-12-24(21)36-17-19(32)3)29-27(34)30-23-10-8-7-9-22(23)28/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,29,30,34)/t18-,19-,25+/m0/s1	HTKHLCDDEOIAQO-XHNVNVPESA-N	500.279883904							98396
BRD-K53101279	LSM-11667		54631851	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-17-18(10-16)28-13-15(3)22-11-14(2)19(27-5)12-24(4)21(17)26/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15-,19+/m0/s1	AZDABJQXNZGANX-YZVOILCLSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K53101279	BRD-K53101279-001-01-9	Broad Institute of MIT and Harvard	BRD-K53101279			CCCC(=O)Nc1ccc2c(OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-17-18(10-16)28-13-15(3)22-11-14(2)19(27-5)12-24(4)21(17)26/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15-,19+/m0/s1	AZDABJQXNZGANX-YZVOILCLSA-N	391.247106566							100292
BRD-K60286124	LSM-12073		54631700	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16+,22+/m0/s1	PQYPJTAQDSWLTB-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3cnccn3	BroadT	BRD-K60286124	BRD-K60286124-001-01-6	Broad Institute of MIT and Harvard	BRD-K60286124			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1cnccn1	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16+,22+/m0/s1	PQYPJTAQDSWLTB-WJONJSRFSA-N	469.232519142							100699
BRD-K54543575	LSM-11737		54631842	InChI=1S/C27H34N4O7/c1-16-12-31(18(3)32)17(2)14-36-22-8-6-19(10-21(22)26(33)30(4)13-25(16)35-5)28-27(34)29-20-7-9-23-24(11-20)38-15-37-23/h6-11,16-17,25H,12-15H2,1-5H3,(H2,28,29,34)/t16-,17-,25-/m1/s1	GAXPUQOVFGRPKG-RYUVBPIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc4OCOc4c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K54543575	BRD-K54543575-001-01-2	Broad Institute of MIT and Harvard	BRD-K54543575			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc4OCOc4c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H34N4O7/c1-16-12-31(18(3)32)17(2)14-36-22-8-6-19(10-21(22)26(33)30(4)13-25(16)35-5)28-27(34)29-20-7-9-23-24(11-20)38-15-37-23/h6-11,16-17,25H,12-15H2,1-5H3,(H2,28,29,34)/t16-,17-,25-/m1/s1	GAXPUQOVFGRPKG-RYUVBPIJSA-N	526.242749468							100362
BRD-K18383512	LSM-9534		54631785	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17-,22-/m1/s1	MDBZRSBKDCCZHT-DRSNIGMVSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(CC3CC3)[C@H](C)COc2c1	BroadT	BRD-K18383512	BRD-K18383512-001-01-4	Broad Institute of MIT and Harvard	BRD-K18383512			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CC3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17-,22-/m1/s1	MDBZRSBKDCCZHT-DRSNIGMVSA-N	447.273321314							98155
BRD-K41023039	LSM-10926		54631834	InChI=1S/C21H31N5O5S/c1-14-9-22-15(2)12-31-18-8-16(24-32(28,29)20-11-25(3)13-23-20)6-7-17(18)21(27)26(4)10-19(14)30-5/h6-8,11,13-15,19,22,24H,9-10,12H2,1-5H3/t14-,15-,19-/m1/s1	QXYUWGLBJNPRKS-SPYBWZPUSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K41023039	BRD-K41023039-001-01-1	Broad Institute of MIT and Harvard	BRD-K41023039			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C21H31N5O5S/c1-14-9-22-15(2)12-31-18-8-16(24-32(28,29)20-11-25(3)13-23-20)6-7-17(18)21(27)26(4)10-19(14)30-5/h6-8,11,13-15,19,22,24H,9-10,12H2,1-5H3/t14-,15-,19-/m1/s1	QXYUWGLBJNPRKS-SPYBWZPUSA-N	465.204589832							99547
BRD-K64630692	LSM-12377		54631629	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16+,21-/m1/s1	IMTXHMNNEPVREU-VWKPWSFCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K64630692	BRD-K64630692-001-01-3	Broad Institute of MIT and Harvard	BRD-K64630692			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16+,21-/m1/s1	IMTXHMNNEPVREU-VWKPWSFCSA-N	417.26275663							101004
BRD-K27571934	LSM-10089		54631894	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m0/s1	ZTXXWNNQGVNFQF-JXQFQVJHSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccn3	BroadT	BRD-K27571934	BRD-K27571934-001-01-3	Broad Institute of MIT and Harvard	BRD-K27571934			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccn1	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m0/s1	ZTXXWNNQGVNFQF-JXQFQVJHSA-N	496.268570292							98710
BRD-K82772827	LSM-13484		54631841	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m0/s1	FAXXRWNSKSYYIM-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K82772827	BRD-K82772827-001-01-9	Broad Institute of MIT and Harvard	BRD-K82772827			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-9-8-18(11-20(21)23(28)27(3)13-22(15)31-4)26-33(29,30)19-7-5-6-17(24)10-19/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m0/s1	FAXXRWNSKSYYIM-PONJGIIJSA-N	479.18901998							102124
BRD-K36951400	LSM-10663		54631640	InChI=1S/C26H40N4O5/c1-6-12-27-26(33)30-14-17(2)23(34-5)15-29(4)25(32)21-11-10-20(13-22(21)35-16-18(30)3)28-24(31)19-8-7-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,33)(H,28,31)/t17-,18+,23-/m0/s1	JIFPRSYXXRNMQX-IXFSTUDKSA-N	CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K36951400	BRD-K36951400-001-01-1	Broad Institute of MIT and Harvard	BRD-K36951400			CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H]1C)OC	InChI=1S/C26H40N4O5/c1-6-12-27-26(33)30-14-17(2)23(34-5)15-29(4)25(32)21-11-10-20(13-22(21)35-16-18(30)3)28-24(31)19-8-7-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,33)(H,28,31)/t17-,18+,23-/m0/s1	JIFPRSYXXRNMQX-IXFSTUDKSA-N	488.29987042							99284
BRD-K33635485	LSM-10468		54631651	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m0/s1	MDBZRSBKDCCZHT-JKSBSHDWSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(CC3CC3)[C@H](C)COc2c1	BroadT	BRD-K33635485	BRD-K33635485-001-01-1	Broad Institute of MIT and Harvard	BRD-K33635485			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CC3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37N3O5/c1-16-11-27(12-18-6-7-18)17(2)14-32-21-10-19(25-23(28)15-30-4)8-9-20(21)24(29)26(3)13-22(16)31-5/h8-10,16-18,22H,6-7,11-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m0/s1	MDBZRSBKDCCZHT-JKSBSHDWSA-N	447.273321314							99089
BRD-K49579550	LSM-11442		54631867	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18+,22+/m1/s1	LLNFNSHBDLACGS-FGSXEWAUSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K49579550	BRD-K49579550-001-01-3	Broad Institute of MIT and Harvard	BRD-K49579550			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18+,22+/m1/s1	LLNFNSHBDLACGS-FGSXEWAUSA-N	488.245726362							100063
BRD-K87269491	LSM-13779		54631833	InChI=1S/C23H33N5O5S/c1-16-11-28(12-18-9-24-15-25-10-18)17(2)14-33-21-7-6-19(26-34(5,30)31)8-20(21)23(29)27(3)13-22(16)32-4/h6-10,15-17,22,26H,11-14H2,1-5H3/t16-,17+,22+/m1/s1	VPVAZUBGKWFEKV-JLHGSKIFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H]1C	BroadT	BRD-K87269491	BRD-K87269491-001-01-6	Broad Institute of MIT and Harvard	BRD-K87269491			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C23H33N5O5S/c1-16-11-28(12-18-9-24-15-25-10-18)17(2)14-33-21-7-6-19(26-34(5,30)31)8-20(21)23(29)27(3)13-22(16)32-4/h6-10,15-17,22,26H,11-14H2,1-5H3/t16-,17+,22+/m1/s1	VPVAZUBGKWFEKV-JLHGSKIFSA-N	491.220239896							102428
BRD-K07275921	LSM-8857		54631650	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18-,23-/m0/s1	RIFMDYVXBSMSIP-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K07275921	BRD-K07275921-001-01-0	Broad Institute of MIT and Harvard	BRD-K07275921			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O4/c1-17-14-26-18(2)16-32-22-11-10-20(27-24(29)12-19-8-6-5-7-9-19)13-21(22)25(30)28(3)15-23(17)31-4/h5-11,13,17-18,23,26H,12,14-16H2,1-4H3,(H,27,29)/t17-,18-,23-/m0/s1	RIFMDYVXBSMSIP-BSRJHKFKSA-N	439.247106566							97478
BRD-K54972173	LSM-11760		54631885	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18+,22-/m0/s1	LLNFNSHBDLACGS-SVMVAKDDSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K54972173	BRD-K54972173-001-01-9	Broad Institute of MIT and Harvard	BRD-K54972173			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18+,22-/m0/s1	LLNFNSHBDLACGS-SVMVAKDDSA-N	488.245726362							100385
BRD-K51328581	LSM-11568		54631634	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	JFYAEFCKASRCBE-YDIMBITNSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3	BroadT	BRD-K51328581	BRD-K51328581-001-01-3	Broad Institute of MIT and Harvard	BRD-K51328581			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1	InChI=1S/C27H35N3O6/c1-18-14-30(26(32)20-9-7-6-8-10-20)19(2)16-36-23-12-11-21(28-25(31)17-34-4)13-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	JFYAEFCKASRCBE-YDIMBITNSA-N	497.25258587							100191
BRD-K49473389	LSM-11436		54631605	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14-,20-/m0/s1	JSRBXIHVEPNVJQ-YRVVQQKDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K49473389	BRD-K49473389-001-01-6	Broad Institute of MIT and Harvard	BRD-K49473389			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C22H30N4O5/c1-13-10-23-14(2)12-30-19-7-6-16(24-21(27)18-8-15(3)31-25-18)9-17(19)22(28)26(4)11-20(13)29-5/h6-9,13-14,20,23H,10-12H2,1-5H3,(H,24,27)/t13-,14-,20-/m0/s1	JSRBXIHVEPNVJQ-YRVVQQKDSA-N	430.2216201							100057
BRD-K69367836	LSM-12658		54631898	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20-,26-/m0/s1	ZWMNFEZEGHFZOH-DYLHXGEVSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC4CC4	BroadT	BRD-K69367836	BRD-K69367836-001-01-4	Broad Institute of MIT and Harvard	BRD-K69367836			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C29H38N4O5/c1-19-16-33(27(34)14-21-10-11-21)20(2)18-38-25-13-12-23(31-29(36)30-22-8-6-5-7-9-22)15-24(25)28(35)32(3)17-26(19)37-4/h5-9,12-13,15,19-21,26H,10-11,14,16-18H2,1-4H3,(H2,30,31,36)/t19-,20-,26-/m0/s1	ZWMNFEZEGHFZOH-DYLHXGEVSA-N	522.284220356							101292
BRD-K20334038-001-01-8	LSM-15933	BRD-K20334038	54631684	InChI=1S/C24H37F3N4O4/c1-6-10-28-23(33)29-18-7-8-19-20(12-18)35-15-17(3)31(11-9-24(25,26)27)13-16(2)21(34-5)14-30(4)22(19)32/h7-8,12,16-17,21H,6,9-11,13-15H2,1-5H3,(H2,28,29,33)/t16-,17-,21+/m0/s1	VNTQRTFIXZLISU-XGHQBKJUSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CCC(F)(F)F)[C@@H](C)COc2c1	BroadT	BRD-K20334038	BRD-K20334038-001-01-8	Broad Institute of MIT and Harvard	BRD-K20334038			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C24H37F3N4O4/c1-6-10-28-23(33)29-18-7-8-19-20(12-18)35-15-17(3)31(11-9-24(25,26)27)13-16(2)21(34-5)14-30(4)22(19)32/h7-8,12,16-17,21H,6,9-11,13-15H2,1-5H3,(H2,28,29,33)/t16-,17-,21+/m0/s1	VNTQRTFIXZLISU-XGHQBKJUSA-N	502.276690304							104569
BRD-K16506419	LSM-9426		54631738	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16+,21-/m0/s1	IMTXHMNNEPVREU-MRUHUIDDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K16506419	BRD-K16506419-001-01-6	Broad Institute of MIT and Harvard	BRD-K16506419			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C23H35N3O4/c1-15-12-25(3)16(2)14-30-20-10-9-18(24-22(27)17-7-6-8-17)11-19(20)23(28)26(4)13-21(15)29-5/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,24,27)/t15-,16+,21-/m0/s1	IMTXHMNNEPVREU-MRUHUIDDSA-N	417.26275663							98047
BRD-K34327142	LSM-10496		54631870	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23+/m1/s1	FNBLPFIHIJQMKK-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CCC3	BroadT	BRD-K34327142	BRD-K34327142-001-01-9	Broad Institute of MIT and Harvard	BRD-K34327142			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-10-11-22-21(12-20)25(32)29(5)14-23(34-6)17(3)13-30(18(4)15-35-22)24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23+/m1/s1	FNBLPFIHIJQMKK-PNCHPQGNSA-N	488.29987042							99117
BRD-K98950492	LSM-14502		54631693	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21-,27-/m1/s1	ZEGIYGLHXRHVDM-LGVUCKNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccccc4	BroadT	BRD-K98950492	BRD-K98950492-001-01-7	Broad Institute of MIT and Harvard	BRD-K98950492			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C30H39N3O6/c1-20-17-33(29(35)23-8-6-5-7-9-23)21(2)19-39-26-16-24(31-28(34)22-12-14-38-15-13-22)10-11-25(26)30(36)32(3)18-27(20)37-4/h5-11,16,20-22,27H,12-15,17-19H2,1-4H3,(H,31,34)/t20-,21-,27-/m1/s1	ZEGIYGLHXRHVDM-LGVUCKNBSA-N	537.283885998							103157
BRD-K63458711	LSM-12292		54631665	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18+,22-/m0/s1	REUNTGUOEHKOBZ-SVMVAKDDSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)CN(C)C	BroadT	BRD-K63458711	BRD-K63458711-001-01-7	Broad Institute of MIT and Harvard	BRD-K63458711			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)CN(C)C)c1	InChI=1S/C25H40N4O5/c1-8-9-23(30)26-19-10-11-20-21(12-19)34-16-18(3)29(24(31)15-27(4)5)13-17(2)22(33-7)14-28(6)25(20)32/h10-12,17-18,22H,8-9,13-16H2,1-7H3,(H,26,30)/t17-,18+,22-/m0/s1	REUNTGUOEHKOBZ-SVMVAKDDSA-N	476.29987042							100918
BRD-K37760698	LSM-10713		54631604	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25+/m1/s1	NNPXJSNOAUXSRD-GAKIBJFNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K37760698	BRD-K37760698-001-01-6	Broad Institute of MIT and Harvard	BRD-K37760698			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25+/m1/s1	NNPXJSNOAUXSRD-GAKIBJFNSA-N	497.25258587							99334
BRD-K82447793	LSM-13464		54631909	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25-/m0/s1	NNPXJSNOAUXSRD-ATLLOTDBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K82447793	BRD-K82447793-001-01-8	Broad Institute of MIT and Harvard	BRD-K82447793			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25-/m0/s1	NNPXJSNOAUXSRD-ATLLOTDBSA-N	497.25258587							102104
BRD-K59757264	LSM-12041		54631628	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22+,29-/m1/s1	QUELGMPZNWRZSJ-UETOGOEVSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K59757264	BRD-K59757264-001-01-9	Broad Institute of MIT and Harvard	BRD-K59757264			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1F	InChI=1S/C32H36FN3O5/c1-21-18-36(32(39)25-12-8-9-13-27(25)33)22(2)20-41-28-17-24(34-30(37)16-23-10-6-5-7-11-23)14-15-26(28)31(38)35(3)19-29(21)40-4/h5-15,17,21-22,29H,16,18-20H2,1-4H3,(H,34,37)/t21-,22+,29-/m1/s1	QUELGMPZNWRZSJ-UETOGOEVSA-N	561.263899482							100667
BRD-K89697867	LSM-13964		54631910	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18-,22+/m1/s1	LLNFNSHBDLACGS-HMFYCAOWSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K89697867	BRD-K89697867-001-01-2	Broad Institute of MIT and Harvard	BRD-K89697867			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O4S/c1-6-7-23(30)27-19-8-9-21-20(12-19)25(31)28(4)14-22(32-5)17(2)13-29(18(3)16-33-21)15-24-26-10-11-34-24/h8-12,17-18,22H,6-7,13-16H2,1-5H3,(H,27,30)/t17-,18-,22+/m1/s1	LLNFNSHBDLACGS-HMFYCAOWSA-N	488.245726362							102617
BRD-K23674983	LSM-9852		54631782	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19+,24+/m0/s1	IQLGILJFFYEPBE-XLNZFTOWSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@@H]1C	BroadT	BRD-K23674983	BRD-K23674983-001-01-9	Broad Institute of MIT and Harvard	BRD-K23674983			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C26H40F3N3O5S/c1-18-13-32(14-20-8-6-5-7-9-20)19(2)16-37-23-11-10-21(30-38(34,35)17-26(27,28)29)12-22(23)25(33)31(3)15-24(18)36-4/h10-12,18-20,24,30H,5-9,13-17H2,1-4H3/t18-,19+,24+/m0/s1	IQLGILJFFYEPBE-XLNZFTOWSA-N	563.2640767							98473
BRD-K31207674	LSM-10314		54631832	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24-,31-/m1/s1	OXAYHDRNXZXDOZ-OVMXQCPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K31207674	BRD-K31207674-001-01-2	Broad Institute of MIT and Harvard	BRD-K31207674			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C33H41N3O5/c1-23-20-36(17-16-25-10-7-6-8-11-25)24(2)22-41-30-15-14-27(19-29(30)33(38)35(3)21-31(23)40-5)34-32(37)26-12-9-13-28(18-26)39-4/h6-15,18-19,23-24,31H,16-17,20-22H2,1-5H3,(H,34,37)/t23-,24-,31-/m1/s1	OXAYHDRNXZXDOZ-OVMXQCPESA-N	559.304621442							98935
BRD-K33258193	LSM-10447		54631724	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22+,30-/m0/s1	WUHLCXCEWBJVDE-ZQLNOWDWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(Cc4ccccc4F)C[C@@H]1C	BroadT	BRD-K33258193	BRD-K33258193-001-01-5	Broad Institute of MIT and Harvard	BRD-K33258193			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(Cc2ccccc2F)C[C@@H]1C	InChI=1S/C31H38FN3O6S/c1-21-17-35(18-23-9-6-7-12-28(23)32)22(2)20-41-29-15-24(13-14-27(29)31(36)34(3)19-30(21)40-5)33-42(37,38)26-11-8-10-25(16-26)39-4/h6-16,21-22,30,33H,17-20H2,1-5H3/t21-,22+,30-/m0/s1	WUHLCXCEWBJVDE-ZQLNOWDWSA-N	599.246534856							99068
BRD-K74817145	LSM-13013		54631699	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25-/m1/s1	NNPXJSNOAUXSRD-FUMQJTLXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K74817145	BRD-K74817145-001-01-7	Broad Institute of MIT and Harvard	BRD-K74817145			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-20(28-26(32)21-9-7-8-10-23(21)34-5)11-12-22(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25-/m1/s1	NNPXJSNOAUXSRD-FUMQJTLXSA-N	497.25258587							101650
BRD-K69880993	LSM-12694		54631913	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16-,22+/m0/s1	PQYPJTAQDSWLTB-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3cnccn3	BroadT	BRD-K69880993	BRD-K69880993-001-01-5	Broad Institute of MIT and Harvard	BRD-K69880993			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1cnccn1	InChI=1S/C24H31N5O5/c1-15-12-29(24(32)20-11-25-8-9-26-20)16(2)14-34-21-7-6-18(27-17(3)30)10-19(21)23(31)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,30)/t15-,16-,22+/m0/s1	PQYPJTAQDSWLTB-PONJGIIJSA-N	469.232519142							101328
BRD-K03180599	LSM-8630		54631660	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m1/s1	ZTXXWNNQGVNFQF-YDIMBITNSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccn3	BroadT	BRD-K03180599	BRD-K03180599-001-01-7	Broad Institute of MIT and Harvard	BRD-K03180599			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccn1	InChI=1S/C27H36N4O5/c1-6-9-25(32)29-20-11-12-23-21(14-20)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)22-10-7-8-13-28-22/h7-8,10-14,18-19,24H,6,9,15-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m1/s1	ZTXXWNNQGVNFQF-YDIMBITNSA-N	496.268570292							97251
BRD-K76729384	LSM-15934		44484601	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23+,27-/m1/s1	LTGDTYHJVMKPBL-GRSOWLQASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K76729384	BRD-K76729384-001-01-2	Broad Institute of MIT and Harvard	BRD-K76729384			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23+,27-/m1/s1	LTGDTYHJVMKPBL-GRSOWLQASA-N	534.37812074							104570
BRD-K62942008	LSM-15935		44620810	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24-,30+/m0/s1	XIVCQDXGZVVHDO-ZUHGBKBGSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K62942008	BRD-K62942008-001-01-3	Broad Institute of MIT and Harvard	BRD-K62942008			COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(NS(C)(=O)=O)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24-,30+/m0/s1	XIVCQDXGZVVHDO-ZUHGBKBGSA-N	605.313471564							104571
BRD-K64245731	LSM-15936		44483960	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22+,29-/m1/s1	BFYBBBSDVFDXJC-KJRCIBJNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	BroadT	BRD-K64245731	BRD-K64245731-001-01-3	Broad Institute of MIT and Harvard	BRD-K64245731			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22+,29-/m1/s1	BFYBBBSDVFDXJC-KJRCIBJNSA-N	584.320999788							104572
BRD-K60848736	LSM-15937		44616965	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22-,23+,27-/m0/s1	XJLXIOLTLBOFKC-TZKYFUQOSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K60848736	BRD-K60848736-001-01-3	Broad Institute of MIT and Harvard	BRD-K60848736			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22-,23+,27-/m0/s1	XJLXIOLTLBOFKC-TZKYFUQOSA-N	598.34002067							104573
BRD-K62935726	LSM-15938		44494520	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25+,30-/m0/s1	ZGCRSIABJPRXFC-INVAMZEASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K62935726	BRD-K62935726-001-01-8	Broad Institute of MIT and Harvard	BRD-K62935726			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25+,30-/m0/s1	ZGCRSIABJPRXFC-INVAMZEASA-N	553.351571634							104574
BRD-K65959331	LSM-15939		44617501	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21-,22-,28-/m0/s1	QZYXNEJVPTWBHC-STFWXSJUSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K65959331	BRD-K65959331-001-01-2	Broad Institute of MIT and Harvard	BRD-K65959331			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21-,22-,28-/m0/s1	QZYXNEJVPTWBHC-STFWXSJUSA-N	556.326085168							104575
BRD-K69942587	LSM-15940		44490350	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29+/m0/s1	ZJHDPNYYPDHDNF-HNFJUSDZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K69942587	BRD-K69942587-001-01-5	Broad Institute of MIT and Harvard	BRD-K69942587			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29+/m0/s1	ZJHDPNYYPDHDNF-HNFJUSDZSA-N	539.33592157							104576
BRD-K77392050	LSM-15941		44490903	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24+,29+/m0/s1	ZJHDPNYYPDHDNF-PHBCIFJZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K77392050	BRD-K77392050-001-01-1	Broad Institute of MIT and Harvard	BRD-K77392050			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24+,29+/m0/s1	ZJHDPNYYPDHDNF-PHBCIFJZSA-N	539.33592157							104577
BRD-K64763803	LSM-15942		44494624	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24-,29+/m1/s1	KAHNNCGHTWSOBA-XTGAJNFRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K64763803	BRD-K64763803-001-01-8	Broad Institute of MIT and Harvard	BRD-K64763803			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24-,29+/m1/s1	KAHNNCGHTWSOBA-XTGAJNFRSA-N	554.346820612							104578
BRD-K77221872	LSM-15943		44490373	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23+,28+/m1/s1	GAZXHMFIMHCKKU-FZVPRWPTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K77221872	BRD-K77221872-001-01-8	Broad Institute of MIT and Harvard	BRD-K77221872			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23+,28+/m1/s1	GAZXHMFIMHCKKU-FZVPRWPTSA-N	576.298155858							104579
BRD-K69580972	LSM-15944		44494532	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29+/m0/s1	GPFIDTWNGXWRJK-HNFJUSDZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K69580972	BRD-K69580972-001-01-6	Broad Institute of MIT and Harvard	BRD-K69580972			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29+/m0/s1	GPFIDTWNGXWRJK-HNFJUSDZSA-N	575.30290688							104580
BRD-K63500288	LSM-15945		44494997	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28+/m0/s1	GOBHPVUGCFRQAG-KJZXJLKKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	BroadT	BRD-K63500288	BRD-K63500288-001-01-9	Broad Institute of MIT and Harvard	BRD-K63500288			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28+/m0/s1	GOBHPVUGCFRQAG-KJZXJLKKSA-N	595.248284494							104581
BRD-K77483143	LSM-15946		44489903	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,28+/m1/s1	BRKIAEBRDYHMFE-IZXSZHORSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K77483143	BRD-K77483143-001-01-7	Broad Institute of MIT and Harvard	BRD-K77483143			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,28+/m1/s1	BRKIAEBRDYHMFE-IZXSZHORSA-N	540.331170548							104582
BRD-K71631414	LSM-15947		44502472	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28+/m0/s1	VUABGABXFJSUSX-TUEWKVEFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K71631414	BRD-K71631414-001-01-9	Broad Institute of MIT and Harvard	BRD-K71631414			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28+/m0/s1	VUABGABXFJSUSX-TUEWKVEFSA-N	546.37812074							104583
BRD-K62294866	LSM-15948		54614856	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18-,19+,25+/m0/s1	OIOMLIQJBPNRTR-PLGVSFSBSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K62294866	BRD-K62294866-001-01-0	Broad Institute of MIT and Harvard	BRD-K62294866			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18-,19+,25+/m0/s1	OIOMLIQJBPNRTR-PLGVSFSBSA-N	545.321334146							104584
BRD-K73573090	LSM-15949		44490442	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22+,26+/m1/s1	ANVCKVJMNHXGBG-CQAGSAPUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K73573090	BRD-K73573090-001-01-2	Broad Institute of MIT and Harvard	BRD-K73573090			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22+,26+/m1/s1	ANVCKVJMNHXGBG-CQAGSAPUSA-N	581.259327506							131237
BRD-K65005022	LSM-15950		44496466	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26+,27+,32-/m1/s1	ZCLFEQBFHRMJFK-JVPIYLDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K65005022	BRD-K65005022-001-01-8	Broad Institute of MIT and Harvard	BRD-K65005022			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26+,27+,32-/m1/s1	ZCLFEQBFHRMJFK-JVPIYLDOSA-N	611.404669846							104587
BRD-K65438558	LSM-15951		54614869	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21+,22+,26-/m1/s1	KFCLPYACNRFGCM-FYBXHKAZSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K65438558	BRD-K65438558-001-01-3	Broad Institute of MIT and Harvard	BRD-K65438558			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21+,22+,26-/m1/s1	KFCLPYACNRFGCM-FYBXHKAZSA-N	477.356657014							104588
BRD-K76309489	LSM-15952		44494517	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22+,26-/m0/s1	UJYZNBPSVBHVBP-IFOBJOEFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K76309489	BRD-K76309489-001-01-7	Broad Institute of MIT and Harvard	BRD-K76309489			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22+,26-/m0/s1	UJYZNBPSVBHVBP-IFOBJOEFSA-N	579.3090549							104589
BRD-K66802550	LSM-15953		44492619	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20+,24-/m0/s1	PQNWFIFCFFWMJI-KTIHBUSBSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K66802550	BRD-K66802550-001-01-7	Broad Institute of MIT and Harvard	BRD-K66802550			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20+,24-/m0/s1	PQNWFIFCFFWMJI-KTIHBUSBSA-N	449.325356886							104590
BRD-K78149572	LSM-15954		44618044	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22-,23+,28+/m0/s1	BJJOMMAJAORXGV-HIAVRWOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K78149572	BRD-K78149572-001-01-3	Broad Institute of MIT and Harvard	BRD-K78149572			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22-,23+,28+/m0/s1	BJJOMMAJAORXGV-HIAVRWOZSA-N	595.329121628							104591
BRD-K76115264	LSM-15955		44492071	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21+,22-,27-/m1/s1	JLURSCHFCUHCJF-RSOWOKRSSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K76115264	BRD-K76115264-001-01-9	Broad Institute of MIT and Harvard	BRD-K76115264			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21+,22-,27-/m1/s1	JLURSCHFCUHCJF-RSOWOKRSSA-N	547.271606752							104592
BRD-K70717477	LSM-15956		44487477	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22-,27+/m0/s1	FBKKOHUHBUWDTB-JLFWUPFSSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K70717477	BRD-K70717477-001-01-1	Broad Institute of MIT and Harvard	BRD-K70717477			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22-,27+/m0/s1	FBKKOHUHBUWDTB-JLFWUPFSSA-N	526.315520484							104593
BRD-K72717797	LSM-15957		44620344	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22-,23+,30+/m1/s1	KQLDLPDWVHVVHP-LRKPSKMWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K72717797	BRD-K72717797-001-01-2	Broad Institute of MIT and Harvard	BRD-K72717797			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22-,23+,30+/m1/s1	KQLDLPDWVHVVHP-LRKPSKMWSA-N	619.29273612							104594
BRD-K76461283	LSM-15958		44493609	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22+,28-/m1/s1	GOBHPVUGCFRQAG-DCRAHPAHSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	BroadT	BRD-K76461283	BRD-K76461283-001-01-4	Broad Institute of MIT and Harvard	BRD-K76461283			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22+,28-/m1/s1	GOBHPVUGCFRQAG-DCRAHPAHSA-N	595.248284494							104595
BRD-K63209730	LSM-15959		54614862	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27+/m1/s1	HLGABPGRBQKPOU-RYBWSMFQSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K63209730	BRD-K63209730-001-01-1	Broad Institute of MIT and Harvard	BRD-K63209730			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27+/m1/s1	HLGABPGRBQKPOU-RYBWSMFQSA-N	532.362470676							104596
BRD-K74261250	LSM-15960		54614891	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29-/m0/s1	MEJMTXOOFVGIJM-DGGNIJSCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K74261250	BRD-K74261250-001-01-9	Broad Institute of MIT and Harvard	BRD-K74261250			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29-/m0/s1	MEJMTXOOFVGIJM-DGGNIJSCSA-N	593.293485048							104597
BRD-K63017287	LSM-15151		44618293	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21+,22-,26+/m0/s1	ZWQRBFIYGZIGKO-IMIIHFCZSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K63017287	BRD-K63017287-001-01-5	Broad Institute of MIT and Harvard	BRD-K63017287			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21+,22-,26+/m0/s1	ZWQRBFIYGZIGKO-IMIIHFCZSA-N	573.338956202							103807
BRD-K65257143	LSM-15961		44496008	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25+,30-/m1/s1	OMPYFAIFRLVIFJ-ZASNTINBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K65257143	BRD-K65257143-001-01-9	Broad Institute of MIT and Harvard	BRD-K65257143			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25+,30-/m1/s1	OMPYFAIFRLVIFJ-ZASNTINBSA-N	621.338956202							104598
BRD-K74908937	LSM-15962		54614894	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22-,23-,28-/m1/s1	BJJOMMAJAORXGV-TZTMDHJLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K74908937	BRD-K74908937-001-01-6	Broad Institute of MIT and Harvard	BRD-K74908937			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22-,23-,28-/m1/s1	BJJOMMAJAORXGV-TZTMDHJLSA-N	595.329121628							104599
BRD-K67150949	LSM-15963		44489710	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20+,24+/m0/s1	LBVOXJOHMPITGR-UECWXEIQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K67150949	BRD-K67150949-001-01-0	Broad Institute of MIT and Harvard	BRD-K67150949			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20+,24+/m0/s1	LBVOXJOHMPITGR-UECWXEIQSA-N	609.269556004							104600
BRD-K60430317	LSM-15964		44490267	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24+,29-/m0/s1	QUSLWNNTNFDPAB-SEAFADMZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K60430317	BRD-K60430317-001-01-7	Broad Institute of MIT and Harvard	BRD-K60430317			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24+,29-/m0/s1	QUSLWNNTNFDPAB-SEAFADMZSA-N	545.382871762							104601
BRD-K74849766	LSM-15965		44500211	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23+,24+,29+/m0/s1	MOSVBDAIGOGSPE-CMSZEEODSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K74849766	BRD-K74849766-001-01-8	Broad Institute of MIT and Harvard	BRD-K74849766			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23+,24+,29+/m0/s1	MOSVBDAIGOGSPE-CMSZEEODSA-N	581.349857072							104602
BRD-K72135113	LSM-15966		44490387	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21+,22-,26+/m1/s1	ANVCKVJMNHXGBG-SRCYTUNASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K72135113	BRD-K72135113-001-01-4	Broad Institute of MIT and Harvard	BRD-K72135113			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21+,22-,26+/m1/s1	ANVCKVJMNHXGBG-SRCYTUNASA-N	581.259327506							104603
BRD-K63493628	LSM-15967		44498631	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22+,26+/m0/s1	UJYZNBPSVBHVBP-BTKWVRSESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K63493628	BRD-K63493628-001-01-6	Broad Institute of MIT and Harvard	BRD-K63493628			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22+,26+/m0/s1	UJYZNBPSVBHVBP-BTKWVRSESA-N	579.3090549							104604
BRD-K60713554-001-01-8	LSM-15968	BRD-K60713554	44494572	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25-,30+/m1/s1	OMPYFAIFRLVIFJ-ZXPXOXBPSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K60713554	BRD-K60713554-001-01-8	Broad Institute of MIT and Harvard	BRD-K60713554			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25-,30+/m1/s1	OMPYFAIFRLVIFJ-ZXPXOXBPSA-N	621.338956202							104605
BRD-K71345532	LSM-15969		54614883	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28+/m0/s1	XHZKQAVNDGMQPU-HIAVRWOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K71345532	BRD-K71345532-001-01-3	Broad Institute of MIT and Harvard	BRD-K71345532			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28+/m0/s1	XHZKQAVNDGMQPU-HIAVRWOZSA-N	589.282171436							104606
BRD-K73582217	LSM-15970		44618999	InChI=1S/C32H48N4O5/c1-6-17-35(5)21-30-23(2)20-36(24(3)22-37)31(38)28-19-27(34-32(39)33-26-13-8-7-9-14-26)15-16-29(28)41-25(4)12-10-11-18-40-30/h7-9,13-16,19,23-25,30,37H,6,10-12,17-18,20-22H2,1-5H3,(H2,33,34,39)/t23-,24+,25+,30+/m0/s1	MWWGHCHVGSQFNB-RZDWVWPCSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K73582217	BRD-K73582217-001-01-1	Broad Institute of MIT and Harvard	BRD-K73582217			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H48N4O5/c1-6-17-35(5)21-30-23(2)20-36(24(3)22-37)31(38)28-19-27(34-32(39)33-26-13-8-7-9-14-26)15-16-29(28)41-25(4)12-10-11-18-40-30/h7-9,13-16,19,23-25,30,37H,6,10-12,17-18,20-22H2,1-5H3,(H2,33,34,39)/t23-,24+,25+,30+/m0/s1	MWWGHCHVGSQFNB-RZDWVWPCSA-N	568.362470676							104607
BRD-K72386335	LSM-15971		44496911	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24+,29-/m1/s1	ZQLCRBSTGDSWQO-IDCDSMMUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K72386335	BRD-K72386335-001-01-5	Broad Institute of MIT and Harvard	BRD-K72386335			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24+,29-/m1/s1	ZQLCRBSTGDSWQO-IDCDSMMUSA-N	526.351905992							104608
BRD-K69132276	LSM-15972		54614876	InChI=1S/C33H49N3O5/c1-6-17-35(5)22-31-24(2)21-36(25(3)23-37)33(39)29-20-28(34-32(38)19-27-13-8-7-9-14-27)15-16-30(29)41-26(4)12-10-11-18-40-31/h7-9,13-16,20,24-26,31,37H,6,10-12,17-19,21-23H2,1-5H3,(H,34,38)/t24-,25+,26+,31-/m0/s1	HWWNGGYYBIBPCQ-PXFJVXAFSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K69132276	BRD-K69132276-001-01-9	Broad Institute of MIT and Harvard	BRD-K69132276			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H49N3O5/c1-6-17-35(5)22-31-24(2)21-36(25(3)23-37)33(39)29-20-28(34-32(38)19-27-13-8-7-9-14-27)15-16-30(29)41-26(4)12-10-11-18-40-31/h7-9,13-16,20,24-26,31,37H,6,10-12,17-19,21-23H2,1-5H3,(H,34,38)/t24-,25+,26+,31-/m0/s1	HWWNGGYYBIBPCQ-PXFJVXAFSA-N	567.367221698							104609
BRD-K61189585	LSM-15973		44607853	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24+,25-,31+/m1/s1	HLAXWBUNQRUQJP-FXIKWKPTSA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)N(C)C)cc1	BroadT	BRD-K61189585	BRD-K61189585-001-01-3	Broad Institute of MIT and Harvard	BRD-K61189585			COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)N(C)C)cc1	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24+,25-,31+/m1/s1	HLAXWBUNQRUQJP-FXIKWKPTSA-N	555.367221698							104610
BRD-K76147162	LSM-15974		44487569	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28+,33+/m1/s1	YHPMBPSGDQLXHP-RPWGJLQWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K76147162	BRD-K76147162-001-01-5	Broad Institute of MIT and Harvard	BRD-K76147162			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28+,33+/m1/s1	YHPMBPSGDQLXHP-RPWGJLQWSA-N	610.409420868							104611
BRD-K72298899	LSM-15975		44501784	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23+,28+/m0/s1	DKJIIKWCTXJSNY-TUEWKVEFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K72298899	BRD-K72298899-001-01-0	Broad Institute of MIT and Harvard	BRD-K72298899			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23+,28+/m0/s1	DKJIIKWCTXJSNY-TUEWKVEFSA-N	561.287256816							104612
BRD-K63730594	LSM-15976		54614864	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29-/m1/s1	IMDGVULVCKQBDZ-CAFXQFFASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K63730594	BRD-K63730594-001-01-1	Broad Institute of MIT and Harvard	BRD-K63730594			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29-/m1/s1	IMDGVULVCKQBDZ-CAFXQFFASA-N	539.33592157							104613
BRD-K60812542	LSM-15977		54614848	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32+/m0/s1	OQPYQZIBKYAWRE-KYFCECMNSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K60812542	BRD-K60812542-001-01-3	Broad Institute of MIT and Harvard	BRD-K60812542			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32+/m0/s1	OQPYQZIBKYAWRE-KYFCECMNSA-N	622.37303536							104614
BRD-K61491580	LSM-15978		54614849	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23-,24+,30-/m0/s1	OKIGVZMNGZVCJM-WAHOFHFDSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C	BroadT	BRD-K61491580	BRD-K61491580-001-01-8	Broad Institute of MIT and Harvard	BRD-K61491580			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23-,24+,30-/m0/s1	OKIGVZMNGZVCJM-WAHOFHFDSA-N	605.313471564							104615
BRD-K65086352	LSM-15979		44618770	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22+,23-,27-/m1/s1	MTZUJVYQNWSRMQ-QSGNWFJVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K65086352	BRD-K65086352-001-01-8	Broad Institute of MIT and Harvard	BRD-K65086352			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22+,23-,27-/m1/s1	MTZUJVYQNWSRMQ-QSGNWFJVSA-N	598.34002067							104616
BRD-K70254692	LSM-15980		44497289	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21+,22-,26-/m1/s1	ZWQRBFIYGZIGKO-UXGLMHHASA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K70254692	BRD-K70254692-001-01-4	Broad Institute of MIT and Harvard	BRD-K70254692			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21+,22-,26-/m1/s1	ZWQRBFIYGZIGKO-UXGLMHHASA-N	573.338956202							104617
BRD-K60759770	LSM-15981		44617456	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28+/m1/s1	XEPWKRSQLBTXFU-DHMIZTNRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K60759770	BRD-K60759770-001-01-9	Broad Institute of MIT and Harvard	BRD-K60759770			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28+/m1/s1	XEPWKRSQLBTXFU-DHMIZTNRSA-N	595.329121628							104618
BRD-K59335919	LSM-15982		49842946	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28+,33+/m1/s1	XXBVUIDNUVBELT-VQSVPOMMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K59335919	BRD-K59335919-001-01-3	Broad Institute of MIT and Harvard	BRD-K59335919			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28+,33+/m1/s1	XXBVUIDNUVBELT-VQSVPOMMSA-N	616.45637106							104619
BRD-K63864604	LSM-15983		44501849	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21+,27-/m0/s1	QNMRQELCDYNENZ-XTYKIWRDSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K63864604	BRD-K63864604-001-01-6	Broad Institute of MIT and Harvard	BRD-K63864604			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21+,27-/m0/s1	QNMRQELCDYNENZ-XTYKIWRDSA-N	544.306098652							104620
BRD-K61034310	LSM-15984		44484566	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24-,25+,32-/m0/s1	HBVPERRGRWZCML-IIWJAMIWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	BroadT	BRD-K61034310	BRD-K61034310-001-01-3	Broad Institute of MIT and Harvard	BRD-K61034310			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24-,25+,32-/m0/s1	HBVPERRGRWZCML-IIWJAMIWSA-N	590.346820612							104621
BRD-K75100119	LSM-15985		44496472	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,28-/m1/s1	DZFCVSNNMFSZPA-FTSHWFHSSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K75100119	BRD-K75100119-001-01-9	Broad Institute of MIT and Harvard	BRD-K75100119			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,28-/m1/s1	DZFCVSNNMFSZPA-FTSHWFHSSA-N	570.305349724							104622
BRD-K68836091	LSM-15986		44618707	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32+/m1/s1	OQPYQZIBKYAWRE-IXTDCBFRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K68836091	BRD-K68836091-001-01-9	Broad Institute of MIT and Harvard	BRD-K68836091			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32+/m1/s1	OQPYQZIBKYAWRE-IXTDCBFRSA-N	622.37303536							104623
BRD-K73048554-001-01-4	LSM-15987	BRD-K73048554	44496025	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21-,22-,28+/m0/s1	GMYAYTAKTSTYEI-MIUQQGMZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	BroadT	BRD-K73048554	BRD-K73048554-001-01-4	Broad Institute of MIT and Harvard	BRD-K73048554			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21-,22-,28+/m0/s1	GMYAYTAKTSTYEI-MIUQQGMZSA-N	608.318555116							104624
BRD-K61845512	LSM-15988		54614853	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25+,26-,32+/m1/s1	JCVAFPCEYZSYDX-IXTDCBFRSA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K61845512	BRD-K61845512-001-01-8	Broad Institute of MIT and Harvard	BRD-K61845512			COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25+,26-,32+/m1/s1	JCVAFPCEYZSYDX-IXTDCBFRSA-N	612.388685424							104625
BRD-K61621900	LSM-15989		54614850	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26-,27-,32-/m0/s1	ZMTJRORPEDZKCY-UCDUTVGFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K61621900	BRD-K61621900-001-01-3	Broad Institute of MIT and Harvard	BRD-K61621900			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26-,27-,32-/m0/s1	ZMTJRORPEDZKCY-UCDUTVGFSA-N	624.388685424							104626
BRD-K63030320	LSM-15990		44496914	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24-,29-/m1/s1	ZQLCRBSTGDSWQO-RWJVBYDYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K63030320	BRD-K63030320-001-01-7	Broad Institute of MIT and Harvard	BRD-K63030320			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24-,29-/m1/s1	ZQLCRBSTGDSWQO-RWJVBYDYSA-N	526.351905992							104627
BRD-K78530095	LSM-15991		44493125	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23-,24+,28-/m0/s1	FCDOAUZTELHSSL-UKWMHNODSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K78530095	BRD-K78530095-001-01-2	Broad Institute of MIT and Harvard	BRD-K78530095			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23-,24+,28-/m0/s1	FCDOAUZTELHSSL-UKWMHNODSA-N	548.393770804							104628
BRD-K75206417	LSM-15992		44488781	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,28-/m0/s1	BRKIAEBRDYHMFE-KYALDGGBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K75206417	BRD-K75206417-001-01-3	Broad Institute of MIT and Harvard	BRD-K75206417			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,28-/m0/s1	BRKIAEBRDYHMFE-KYALDGGBSA-N	540.331170548							104629
BRD-K69505608	LSM-15993		44486433	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23-,24-,29-/m1/s1	SEDRIVHSDUVLLE-RWJVBYDYSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K69505608	BRD-K69505608-001-01-5	Broad Institute of MIT and Harvard	BRD-K69505608			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23-,24-,29-/m1/s1	SEDRIVHSDUVLLE-RWJVBYDYSA-N	597.352634274							104630
BRD-K74659851	LSM-15053		44486992	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m0/s1	VTJNXDUZLOWMHH-KYALDGGBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K74659851	BRD-K74659851-001-01-7	Broad Institute of MIT and Harvard	BRD-K74659851			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m0/s1	VTJNXDUZLOWMHH-KYALDGGBSA-N	531.367221698							103709
BRD-K64183190	LSM-15994		44503392	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25+,26+,32+/m0/s1	JCVAFPCEYZSYDX-MQBJWECPSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K64183190	BRD-K64183190-001-01-0	Broad Institute of MIT and Harvard	BRD-K64183190			COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25+,26+,32+/m0/s1	JCVAFPCEYZSYDX-MQBJWECPSA-N	612.388685424							104631
BRD-K74803017	LSM-15995		44493653	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22-,27-/m1/s1	JMPHEZKYQLUQMM-XAYSYOTPSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K74803017	BRD-K74803017-001-01-2	Broad Institute of MIT and Harvard	BRD-K74803017			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22-,27-/m1/s1	JMPHEZKYQLUQMM-XAYSYOTPSA-N	517.351571634							104632
MLS003128712	LSM-15996	BRD-K67319345, SID99358953	44489723	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,28-/m0/s1	BRKIAEBRDYHMFE-FPZRTEDSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K67319345	BRD-K67319345-001-01-1	Broad Institute of MIT and Harvard	BRD-K67319345			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,28-/m0/s1	BRKIAEBRDYHMFE-FPZRTEDSSA-N	540.331170548							104633
BRD-K76748254	LSM-15997		44616985	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30-/m1/s1	KOPUKDVKYXJRIR-FJRSXGRASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K76748254	BRD-K76748254-001-01-9	Broad Institute of MIT and Harvard	BRD-K76748254			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30-/m1/s1	KOPUKDVKYXJRIR-FJRSXGRASA-N	602.404335488							104634
BRD-K67715154	LSM-15998		54614873	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21+,22-,28-/m1/s1	QZYXNEJVPTWBHC-BUUPBASBSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K67715154	BRD-K67715154-001-01-0	Broad Institute of MIT and Harvard	BRD-K67715154			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21+,22-,28-/m1/s1	QZYXNEJVPTWBHC-BUUPBASBSA-N	556.326085168							104635
BRD-K62312047	LSM-15999		54614857	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33-/m1/s1	FHYFYPZRCDKSKV-BXWHCVCYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K62312047	BRD-K62312047-001-01-2	Broad Institute of MIT and Harvard	BRD-K62312047			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33-/m1/s1	FHYFYPZRCDKSKV-BXWHCVCYSA-N	608.393770804							104636
BRD-K72424071	LSM-16000		44494593	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25+,30+/m1/s1	OMPYFAIFRLVIFJ-ZRIOWSNCSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K72424071	BRD-K72424071-001-01-2	Broad Institute of MIT and Harvard	BRD-K72424071			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25+,30+/m1/s1	OMPYFAIFRLVIFJ-ZRIOWSNCSA-N	621.338956202							104637
BRD-K65945126	LSM-16001		44487428	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19-,23+/m0/s1	HNAHSZOZZNPVNF-KEXUJGGDSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K65945126	BRD-K65945126-001-01-0	Broad Institute of MIT and Harvard	BRD-K65945126			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19-,23+/m0/s1	HNAHSZOZZNPVNF-KEXUJGGDSA-N	499.271606752							104638
BRD-K68160857	LSM-16002		44619044	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22-,23-,29-/m1/s1	QSYAMXVABCSWEP-PZNASWHRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K68160857	BRD-K68160857-001-01-8	Broad Institute of MIT and Harvard	BRD-K68160857			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22-,23-,29-/m1/s1	QSYAMXVABCSWEP-PZNASWHRSA-N	622.33420518							104639
BRD-K66216147	LSM-16003		44617355	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23-,24-,30-/m0/s1	OKIGVZMNGZVCJM-CQUCHYGKSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C	BroadT	BRD-K66216147	BRD-K66216147-001-01-0	Broad Institute of MIT and Harvard	BRD-K66216147			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23-,24-,30-/m0/s1	OKIGVZMNGZVCJM-CQUCHYGKSA-N	605.313471564							104640
BRD-K71368065	LSM-16004		44489876	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25-,26+,33+/m1/s1	UBYZDEGPUXBRQE-DWAIMSSFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K71368065	BRD-K71368065-001-01-0	Broad Institute of MIT and Harvard	BRD-K71368065			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25-,26+,33+/m1/s1	UBYZDEGPUXBRQE-DWAIMSSFSA-N	604.362470676							104641
BRD-K71005143	LSM-16005		44488743	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28-/m0/s1	OWRRZEUGKXIWTQ-AMZZYFJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K71005143	BRD-K71005143-001-01-4	Broad Institute of MIT and Harvard	BRD-K71005143			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28-/m0/s1	OWRRZEUGKXIWTQ-AMZZYFJHSA-N	540.331170548							104642
BRD-K77223020	LSM-16006		54614904	InChI=1S/C33H48N4O7/c1-6-14-36(5)19-31-22(2)18-37(23(3)20-38)32(39)27-16-25(10-12-28(27)44-24(4)9-7-8-15-41-31)34-33(40)35-26-11-13-29-30(17-26)43-21-42-29/h10-13,16-17,22-24,31,38H,6-9,14-15,18-21H2,1-5H3,(H2,34,35,40)/t22-,23-,24-,31+/m0/s1	XLNHBFSEXGTYPK-ILSPQUDCSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K77223020	BRD-K77223020-001-01-5	Broad Institute of MIT and Harvard	BRD-K77223020			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H48N4O7/c1-6-14-36(5)19-31-22(2)18-37(23(3)20-38)32(39)27-16-25(10-12-28(27)44-24(4)9-7-8-15-41-31)34-33(40)35-26-11-13-29-30(17-26)43-21-42-29/h10-13,16-17,22-24,31,38H,6-9,14-15,18-21H2,1-5H3,(H2,34,35,40)/t22-,23-,24-,31+/m0/s1	XLNHBFSEXGTYPK-ILSPQUDCSA-N	612.352299916							104643
BRD-K77718491	LSM-16007		44619908	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29-/m1/s1	MEJMTXOOFVGIJM-CPVANYHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K77718491	BRD-K77718491-001-01-4	Broad Institute of MIT and Harvard	BRD-K77718491			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29-/m1/s1	MEJMTXOOFVGIJM-CPVANYHMSA-N	593.293485048							104644
BRD-K59232212-001-01-6	LSM-16008	BRD-K59232212	54614845	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24-,25-,30-/m1/s1	HYZLHQOJAWWHRH-SFOWLQBLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K59232212	BRD-K59232212-001-01-6	Broad Institute of MIT and Harvard	BRD-K59232212			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24-,25-,30-/m1/s1	HYZLHQOJAWWHRH-SFOWLQBLSA-N	589.318556944							104645
BRD-K74382273	LSM-16009		54614892	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23-,24-,30-/m0/s1	IYJPIDGCXVWPNR-CQUCHYGKSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C)cc1	BroadT	BRD-K74382273	BRD-K74382273-001-01-6	Broad Institute of MIT and Harvard	BRD-K74382273			COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C)cc1	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23-,24-,30-/m0/s1	IYJPIDGCXVWPNR-CQUCHYGKSA-N	584.357385296							104646
BRD-K69668461	LSM-16010		54614878	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23+,24-,30+/m0/s1	YDCDOYMHDVYTIM-WUBQMYJQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K69668461	BRD-K69668461-001-01-7	Broad Institute of MIT and Harvard	BRD-K69668461			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23+,24-,30+/m0/s1	YDCDOYMHDVYTIM-WUBQMYJQSA-N	566.346820612							104647
BRD-K68395284	LSM-16011		44488758	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28+,33-/m0/s1	YHPMBPSGDQLXHP-ZQOCDUSVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K68395284	BRD-K68395284-001-01-3	Broad Institute of MIT and Harvard	BRD-K68395284			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28+,33-/m0/s1	YHPMBPSGDQLXHP-ZQOCDUSVSA-N	610.409420868							104648
BRD-K61733751	LSM-16012		44504061	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22+,27+/m0/s1	AOLQWFIMADKXQA-HRGDABNKSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K61733751	BRD-K61733751-001-01-6	Broad Institute of MIT and Harvard	BRD-K61733751			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22+,27+/m0/s1	AOLQWFIMADKXQA-HRGDABNKSA-N	511.304621442							104649
BRD-K74522958	LSM-16013		44492105	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28-/m1/s1	LQSMEYMBJWSEPC-TZTMDHJLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K74522958	BRD-K74522958-001-01-9	Broad Institute of MIT and Harvard	BRD-K74522958			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28-/m1/s1	LQSMEYMBJWSEPC-TZTMDHJLSA-N	525.320271506							104650
BRD-K68949590	LSM-16014		44490878	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24-,29-/m1/s1	QUSLWNNTNFDPAB-RWJVBYDYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K68949590	BRD-K68949590-001-01-6	Broad Institute of MIT and Harvard	BRD-K68949590			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24-,29-/m1/s1	QUSLWNNTNFDPAB-RWJVBYDYSA-N	545.382871762							104651
BRD-K72161690	LSM-16015		44616734	InChI=1S/C31H47N3O6S/c1-6-17-33(5)21-30-23(2)20-34(24(3)22-35)31(36)28-19-26(32-41(37,38)27-13-8-7-9-14-27)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,32,35H,6,10-12,17-18,20-22H2,1-5H3/t23-,24+,25-,30-/m1/s1	ZAMGSALMCFAIEX-FJRSXGRASA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K72161690	BRD-K72161690-001-01-1	Broad Institute of MIT and Harvard	BRD-K72161690			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C31H47N3O6S/c1-6-17-33(5)21-30-23(2)20-34(24(3)22-35)31(36)28-19-26(32-41(37,38)27-13-8-7-9-14-27)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,32,35H,6,10-12,17-18,20-22H2,1-5H3/t23-,24+,25-,30-/m1/s1	ZAMGSALMCFAIEX-FJRSXGRASA-N	589.318556944							104652
BRD-K70992537	LSM-16016		44496419	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19+,23-/m0/s1	QBUCHBBMZJBUJI-XWQURZDVSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K70992537	BRD-K70992537-001-01-8	Broad Institute of MIT and Harvard	BRD-K70992537			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19+,23-/m0/s1	QBUCHBBMZJBUJI-XWQURZDVSA-N	531.29200601							104653
BRD-K69480055	LSM-16017		44504536	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21+,22+,26-/m0/s1	ZWQRBFIYGZIGKO-BOCITWAFSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K69480055	BRD-K69480055-001-01-9	Broad Institute of MIT and Harvard	BRD-K69480055			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21+,22+,26-/m0/s1	ZWQRBFIYGZIGKO-BOCITWAFSA-N	573.338956202							104654
BRD-K75648723	LSM-16018		54614898	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24-,25+,30-/m0/s1	RSKGZFLSRBPJST-INVAMZEASA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K75648723	BRD-K75648723-001-01-5	Broad Institute of MIT and Harvard	BRD-K75648723			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24-,25+,30-/m0/s1	RSKGZFLSRBPJST-INVAMZEASA-N	617.41523453							104655
BRD-K68303333	LSM-16019		44489894	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21-,22-,27+/m1/s1	FBKKOHUHBUWDTB-RKGZYEPBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K68303333	BRD-K68303333-001-01-8	Broad Institute of MIT and Harvard	BRD-K68303333			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21-,22-,27+/m1/s1	FBKKOHUHBUWDTB-RKGZYEPBSA-N	526.315520484							104656
BRD-K68084083	LSM-16020		54614875	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28+/m0/s1	VUABGABXFJSUSX-WYNJNVBPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K68084083	BRD-K68084083-001-01-6	Broad Institute of MIT and Harvard	BRD-K68084083			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28+/m0/s1	VUABGABXFJSUSX-WYNJNVBPSA-N	546.37812074							104657
MLS003130363	LSM-14926	BRD-K75669394, SID99359248	44504316	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20+,24-/m0/s1	ORDOAKKGIRZCMJ-SMOZNVCYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K75669394	BRD-K75669394-001-01-9	Broad Institute of MIT and Harvard	BRD-K75669394			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20+,24-/m0/s1	ORDOAKKGIRZCMJ-SMOZNVCYSA-N	513.287256816							103582
BRD-K61698250	LSM-16021		44494951	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26-,27+,32-/m0/s1	ZCLFEQBFHRMJFK-WASVBOSJSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K61698250	BRD-K61698250-001-01-7	Broad Institute of MIT and Harvard	BRD-K61698250			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26-,27+,32-/m0/s1	ZCLFEQBFHRMJFK-WASVBOSJSA-N	611.404669846							104658
BRD-K72687327	LSM-16022		49843433	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29+/m1/s1	MEJMTXOOFVGIJM-NBOGMJGSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K72687327	BRD-K72687327-001-01-6	Broad Institute of MIT and Harvard	BRD-K72687327			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29+/m1/s1	MEJMTXOOFVGIJM-NBOGMJGSSA-N	593.293485048							104659
BRD-K62463442	LSM-16023		44490852	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22+,28+/m0/s1	DYIGNVBEUCFAEB-CLYWQNBRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K62463442	BRD-K62463442-001-01-4	Broad Institute of MIT and Harvard	BRD-K62463442			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22+,28+/m0/s1	DYIGNVBEUCFAEB-CLYWQNBRSA-N	558.321748716							104660
BRD-K75275329	LSM-16024		44494972	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23-,24+,29+/m0/s1	VOOFHSDUWYITSP-PHBCIFJZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K75275329	BRD-K75275329-001-01-5	Broad Institute of MIT and Harvard	BRD-K75275329			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23-,24+,29+/m0/s1	VOOFHSDUWYITSP-PHBCIFJZSA-N	603.2978215							104661
BRD-K59522787	LSM-16025		44483818	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20+,21+,27+/m0/s1	AQPDNHSQVUKPGE-ZAACQVCWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K59522787	BRD-K59522787-001-01-5	Broad Institute of MIT and Harvard	BRD-K59522787			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20+,21+,27+/m0/s1	AQPDNHSQVUKPGE-ZAACQVCWSA-N	573.352634274							104662
BRD-K71040831	LSM-16026		54614882	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22-,27-/m1/s1	HLGABPGRBQKPOU-XAYSYOTPSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K71040831	BRD-K71040831-001-01-8	Broad Institute of MIT and Harvard	BRD-K71040831			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22-,27-/m1/s1	HLGABPGRBQKPOU-XAYSYOTPSA-N	532.362470676							104663
BRD-K60093216	LSM-6133		44486428	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24-,25-,31-/m1/s1	ZZWVGKUDLRNMBI-GTEDWBNGSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K60093216	BRD-K60093216-001-01-5	Broad Institute of MIT and Harvard	BRD-K60093216			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24-,25-,31-/m1/s1	ZZWVGKUDLRNMBI-GTEDWBNGSA-N	619.329121628							94914
BRD-K71493640	LSM-16027		44620173	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26-,27-,32-/m1/s1	ZCLFEQBFHRMJFK-YDCVZUCISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K71493640	BRD-K71493640-001-01-0	Broad Institute of MIT and Harvard	BRD-K71493640			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26-,27-,32-/m1/s1	ZCLFEQBFHRMJFK-YDCVZUCISA-N	611.404669846							104664
BRD-K67491390	LSM-16028		44620047	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22-,23-,28+/m0/s1	NMRMJZSCUHLPQY-KKQCDPINSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)CC3CC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K67491390	BRD-K67491390-001-01-2	Broad Institute of MIT and Harvard	BRD-K67491390			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)CC3CC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22-,23-,28+/m0/s1	NMRMJZSCUHLPQY-KKQCDPINSA-N	546.37812074							104665
BRD-K73039647	LSM-16029		44494127	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22+,28-/m1/s1	GMYAYTAKTSTYEI-DCRAHPAHSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	BroadT	BRD-K73039647	BRD-K73039647-001-01-2	Broad Institute of MIT and Harvard	BRD-K73039647			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22+,28-/m1/s1	GMYAYTAKTSTYEI-DCRAHPAHSA-N	608.318555116							104666
BRD-K60429174	LSM-16030		44488176	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21+,22+,27-/m1/s1	JLURSCHFCUHCJF-VZUSRKGYSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K60429174	BRD-K60429174-001-01-1	Broad Institute of MIT and Harvard	BRD-K60429174			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21+,22+,27-/m1/s1	JLURSCHFCUHCJF-VZUSRKGYSA-N	547.271606752							104667
BRD-K67725403	LSM-16031		54614874	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25-,30+/m1/s1	RSKGZFLSRBPJST-ZXPXOXBPSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K67725403	BRD-K67725403-001-01-8	Broad Institute of MIT and Harvard	BRD-K67725403			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25-,30+/m1/s1	RSKGZFLSRBPJST-ZXPXOXBPSA-N	617.41523453							104668
BRD-K78252315	LSM-16032		44617768	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25+,30-/m1/s1	ZGCRSIABJPRXFC-ZASNTINBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K78252315	BRD-K78252315-001-01-7	Broad Institute of MIT and Harvard	BRD-K78252315			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25+,30-/m1/s1	ZGCRSIABJPRXFC-ZASNTINBSA-N	553.351571634							104669
BRD-K72894736	LSM-16033		44501810	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25+,26+,32-/m0/s1	JCVAFPCEYZSYDX-GSDPCRBASA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K72894736	BRD-K72894736-001-01-3	Broad Institute of MIT and Harvard	BRD-K72894736			COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25+,26+,32-/m0/s1	JCVAFPCEYZSYDX-GSDPCRBASA-N	612.388685424							104670
BRD-K61078510	LSM-16034		44490369	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22+,28+/m1/s1	DYIGNVBEUCFAEB-VYZXROPESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K61078510	BRD-K61078510-001-01-8	Broad Institute of MIT and Harvard	BRD-K61078510			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22+,28+/m1/s1	DYIGNVBEUCFAEB-VYZXROPESA-N	558.321748716							104671
BRD-K69744558	LSM-16035		44617775	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22-,23-,30-/m1/s1	KQLDLPDWVHVVHP-YYFZOHQYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K69744558	BRD-K69744558-001-01-0	Broad Institute of MIT and Harvard	BRD-K69744558			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22-,23-,30-/m1/s1	KQLDLPDWVHVVHP-YYFZOHQYSA-N	619.29273612							104672
BRD-K64353470	LSM-16036		44495467	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32-/m1/s1	LKIIRWUIYHEPDR-WRZBRUQPSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K64353470	BRD-K64353470-001-01-0	Broad Institute of MIT and Harvard	BRD-K64353470			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32-/m1/s1	LKIIRWUIYHEPDR-WRZBRUQPSA-N	622.37303536							104673
BRD-K70695911	LSM-16037		44619787	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26-,27+,32-/m1/s1	ZMTJRORPEDZKCY-BESNRVDSSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K70695911	BRD-K70695911-001-01-3	Broad Institute of MIT and Harvard	BRD-K70695911			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26-,27+,32-/m1/s1	ZMTJRORPEDZKCY-BESNRVDSSA-N	624.388685424							104674
BRD-K60017729	LSM-16038		54614846	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20+,24-/m1/s1	ORDOAKKGIRZCMJ-KCOOYEKVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K60017729	BRD-K60017729-001-01-4	Broad Institute of MIT and Harvard	BRD-K60017729			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20+,24-/m1/s1	ORDOAKKGIRZCMJ-KCOOYEKVSA-N	513.287256816							104675
BRD-K67535324	LSM-16039		44619140	InChI=1S/C33H49N3O5/c1-6-17-35(5)22-31-24(2)21-36(25(3)23-37)33(39)29-20-28(34-32(38)19-27-13-8-7-9-14-27)15-16-30(29)41-26(4)12-10-11-18-40-31/h7-9,13-16,20,24-26,31,37H,6,10-12,17-19,21-23H2,1-5H3,(H,34,38)/t24-,25+,26+,31-/m1/s1	HWWNGGYYBIBPCQ-SQRAXXTESA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K67535324	BRD-K67535324-001-01-7	Broad Institute of MIT and Harvard	BRD-K67535324			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H49N3O5/c1-6-17-35(5)22-31-24(2)21-36(25(3)23-37)33(39)29-20-28(34-32(38)19-27-13-8-7-9-14-27)15-16-30(29)41-26(4)12-10-11-18-40-31/h7-9,13-16,20,24-26,31,37H,6,10-12,17-19,21-23H2,1-5H3,(H,34,38)/t24-,25+,26+,31-/m1/s1	HWWNGGYYBIBPCQ-SQRAXXTESA-N	567.367221698							104676
BRD-K77775127	LSM-16040		44498491	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23+,24+,30-/m0/s1	IYJPIDGCXVWPNR-YTNVWYNJSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	BroadT	BRD-K77775127	BRD-K77775127-001-01-6	Broad Institute of MIT and Harvard	BRD-K77775127			COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23+,24+,30-/m0/s1	IYJPIDGCXVWPNR-YTNVWYNJSA-N	584.357385296							104677
BRD-K60653414	LSM-16041		44620777	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24+,25-,31-/m0/s1	HLAXWBUNQRUQJP-PBANKSGMSA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	BroadT	BRD-K60653414	BRD-K60653414-001-01-6	Broad Institute of MIT and Harvard	BRD-K60653414			COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24+,25-,31-/m0/s1	HLAXWBUNQRUQJP-PBANKSGMSA-N	555.367221698							104678
BRD-K76640951	LSM-16042		54614901	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30+/m1/s1	DXYWKCBATINIRK-ZXPXOXBPSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K76640951	BRD-K76640951-001-01-4	Broad Institute of MIT and Harvard	BRD-K76640951			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30+/m1/s1	DXYWKCBATINIRK-ZXPXOXBPSA-N	596.357385296							104679
BRD-K70183558	LSM-16043		44504740	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22+,23+,27-/m0/s1	MTZUJVYQNWSRMQ-MTPWMDRRSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K70183558	BRD-K70183558-001-01-8	Broad Institute of MIT and Harvard	BRD-K70183558			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22+,23+,27-/m0/s1	MTZUJVYQNWSRMQ-MTPWMDRRSA-N	598.34002067							104680
BRD-K76544773	LSM-16044		49843221	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28+/m1/s1	VUABGABXFJSUSX-FZVPRWPTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K76544773	BRD-K76544773-001-01-4	Broad Institute of MIT and Harvard	BRD-K76544773			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28+/m1/s1	VUABGABXFJSUSX-FZVPRWPTSA-N	546.37812074							104681
BRD-K78238858	LSM-16045		44494106	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28-/m0/s1	SCSZUZCJLHTTSJ-KYALDGGBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K78238858	BRD-K78238858-001-01-9	Broad Institute of MIT and Harvard	BRD-K78238858			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28-/m0/s1	SCSZUZCJLHTTSJ-KYALDGGBSA-N	589.282171436							104682
BRD-K72531838	LSM-16046		54614888	InChI=1S/C29H47N5O6S/c1-7-13-32(5)17-27-21(2)16-34(22(3)19-35)29(36)25-15-24(31-41(37,38)28-18-33(6)20-30-28)11-12-26(25)40-23(4)10-8-9-14-39-27/h11-12,15,18,20-23,27,31,35H,7-10,13-14,16-17,19H2,1-6H3/t21-,22+,23-,27-/m1/s1	IKHNOPCXKIAMPI-QSGNWFJVSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K72531838	BRD-K72531838-001-01-8	Broad Institute of MIT and Harvard	BRD-K72531838			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H47N5O6S/c1-7-13-32(5)17-27-21(2)16-34(22(3)19-35)29(36)25-15-24(31-41(37,38)28-18-33(6)20-30-28)11-12-26(25)40-23(4)10-8-9-14-39-27/h11-12,15,18,20-23,27,31,35H,7-10,13-14,16-17,19H2,1-6H3/t21-,22+,23-,27-/m1/s1	IKHNOPCXKIAMPI-QSGNWFJVSA-N	593.324704964							104683
BRD-K73177528	LSM-16047		54614890	InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24+,25+,30+/m0/s1	DPWBPPWCHVQSHF-RZDWVWPCSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K73177528	BRD-K73177528-001-01-4	Broad Institute of MIT and Harvard	BRD-K73177528			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24+,25+,30+/m0/s1	DPWBPPWCHVQSHF-RZDWVWPCSA-N	553.351571634							104684
BRD-K65496998	LSM-16048		44618628	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29-/m0/s1	IMDGVULVCKQBDZ-MVPDCNEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K65496998	BRD-K65496998-001-01-9	Broad Institute of MIT and Harvard	BRD-K65496998			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29-/m0/s1	IMDGVULVCKQBDZ-MVPDCNEZSA-N	539.33592157							104685
BRD-K62358193	LSM-16049		44617193	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22-,27+/m1/s1	HLGABPGRBQKPOU-RKGZYEPBSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K62358193	BRD-K62358193-001-01-7	Broad Institute of MIT and Harvard	BRD-K62358193			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22-,27+/m1/s1	HLGABPGRBQKPOU-RKGZYEPBSA-N	532.362470676							104686
BRD-K76833108	LSM-16050		54614902	InChI=1S/C31H47N3O6S/c1-6-17-33(5)21-30-23(2)20-34(24(3)22-35)31(36)28-19-26(32-41(37,38)27-13-8-7-9-14-27)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,32,35H,6,10-12,17-18,20-22H2,1-5H3/t23-,24-,25-,30+/m0/s1	ZAMGSALMCFAIEX-DNHJLFCISA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K76833108	BRD-K76833108-001-01-7	Broad Institute of MIT and Harvard	BRD-K76833108			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C31H47N3O6S/c1-6-17-33(5)21-30-23(2)20-34(24(3)22-35)31(36)28-19-26(32-41(37,38)27-13-8-7-9-14-27)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,32,35H,6,10-12,17-18,20-22H2,1-5H3/t23-,24-,25-,30+/m0/s1	ZAMGSALMCFAIEX-DNHJLFCISA-N	589.318556944							104687
BRD-K73296134	LSM-16051		44619819	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23+,24+,30+/m1/s1	OKIGVZMNGZVCJM-QAAVFVPKSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)N(C)C	BroadT	BRD-K73296134	BRD-K73296134-001-01-8	Broad Institute of MIT and Harvard	BRD-K73296134			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23+,24+,30+/m1/s1	OKIGVZMNGZVCJM-QAAVFVPKSA-N	605.313471564							104688
BRD-K66707905	LSM-16052		44618141	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23+,24-,30-/m1/s1	YDCDOYMHDVYTIM-UTSVKBTJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K66707905	BRD-K66707905-001-01-0	Broad Institute of MIT and Harvard	BRD-K66707905			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23+,24-,30-/m1/s1	YDCDOYMHDVYTIM-UTSVKBTJSA-N	566.346820612							104689
BRD-K76067434	LSM-16053		44497330	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24+,29+/m0/s1	YZLWJGCKUGDXHR-PHBCIFJZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K76067434	BRD-K76067434-001-01-7	Broad Institute of MIT and Harvard	BRD-K76067434			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24+,29+/m0/s1	YZLWJGCKUGDXHR-PHBCIFJZSA-N	560.393770804							104690
BRD-K62072978	LSM-16054		44504569	InChI=1S/C30H43N3O5/c1-21-19-33(22(2)20-34)30(36)26-17-25(32-29(35)16-24-11-6-5-7-12-24)13-14-27(26)38-23(3)10-8-9-15-37-28(21)18-31-4/h5-7,11-14,17,21-23,28,31,34H,8-10,15-16,18-20H2,1-4H3,(H,32,35)/t21-,22+,23+,28-/m0/s1	GZRWXBHQPNTACC-FPZRTEDSSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K62072978	BRD-K62072978-001-01-5	Broad Institute of MIT and Harvard	BRD-K62072978			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H43N3O5/c1-21-19-33(22(2)20-34)30(36)26-17-25(32-29(35)16-24-11-6-5-7-12-24)13-14-27(26)38-23(3)10-8-9-15-37-28(21)18-31-4/h5-7,11-14,17,21-23,28,31,34H,8-10,15-16,18-20H2,1-4H3,(H,32,35)/t21-,22+,23+,28-/m0/s1	GZRWXBHQPNTACC-FPZRTEDSSA-N	525.320271506							104691
BRD-K65891102	LSM-16055		44620287	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26-,27-,32-/m1/s1	ZMTJRORPEDZKCY-YDCVZUCISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K65891102	BRD-K65891102-001-01-4	Broad Institute of MIT and Harvard	BRD-K65891102			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26-,27-,32-/m1/s1	ZMTJRORPEDZKCY-YDCVZUCISA-N	624.388685424							104692
MLS003128871	LSM-12917	BRD-K73297432, SID99359312	44494956	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25-,30+/m0/s1	OMPYFAIFRLVIFJ-DNHJLFCISA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K73297432	BRD-K73297432-001-01-5	Broad Institute of MIT and Harvard	BRD-K73297432			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25-,30+/m0/s1	OMPYFAIFRLVIFJ-DNHJLFCISA-N	621.338956202							101554
BRD-K62885083	LSM-16056		44489696	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23+/m0/s1	HNAHSZOZZNPVNF-RTXPOLOASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K62885083	BRD-K62885083-001-01-2	Broad Institute of MIT and Harvard	BRD-K62885083			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23+/m0/s1	HNAHSZOZZNPVNF-RTXPOLOASA-N	499.271606752							104693
BRD-K63864310	LSM-16057		44487587	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20-,21-,27+/m1/s1	PQVSIMSGGSSCRI-CVWKGPCHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K63864310	BRD-K63864310-001-01-1	Broad Institute of MIT and Harvard	BRD-K63864310			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20-,21-,27+/m1/s1	PQVSIMSGGSSCRI-CVWKGPCHSA-N	594.308720542							104694
BRD-K60905390	LSM-16058		44618922	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27+/m0/s1	OPIQAKQROYPQNZ-MSZUUUALSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K60905390	BRD-K60905390-001-01-8	Broad Institute of MIT and Harvard	BRD-K60905390			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27+/m0/s1	OPIQAKQROYPQNZ-MSZUUUALSA-N	565.26218492							104695
BRD-K70050144	LSM-16059		54614880	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23-,28+/m1/s1	SKZBTEBCBLPBIZ-KRHPZPPWSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K70050144	BRD-K70050144-001-01-0	Broad Institute of MIT and Harvard	BRD-K70050144			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23-,28+/m1/s1	SKZBTEBCBLPBIZ-KRHPZPPWSA-N	561.287256816							104696
BRD-K60132279	LSM-16060		44617317	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33+/m1/s1	FHYFYPZRCDKSKV-CDNUTCOBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K60132279	BRD-K60132279-001-01-5	Broad Institute of MIT and Harvard	BRD-K60132279			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33+/m1/s1	FHYFYPZRCDKSKV-CDNUTCOBSA-N	608.393770804							104697
BRD-K65836113	LSM-16061		44498676	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21+,27+/m1/s1	QNMRQELCDYNENZ-MEFYPOPPSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K65836113	BRD-K65836113-001-01-6	Broad Institute of MIT and Harvard	BRD-K65836113			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21+,27+/m1/s1	QNMRQELCDYNENZ-MEFYPOPPSA-N	544.306098652							104698
BRD-K73539077	LSM-16062		44494376	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22+,23+,28+/m0/s1	SCSZUZCJLHTTSJ-TUEWKVEFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K73539077	BRD-K73539077-001-01-0	Broad Institute of MIT and Harvard	BRD-K73539077			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22+,23+,28+/m0/s1	SCSZUZCJLHTTSJ-TUEWKVEFSA-N	589.282171436							104699
BRD-K60296400	LSM-16063		44490289	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20+,21+,26+/m0/s1	UGHRLCJQQBYBPV-GQNXPXPTSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K60296400	BRD-K60296400-001-01-0	Broad Institute of MIT and Harvard	BRD-K60296400			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20+,21+,26+/m0/s1	UGHRLCJQQBYBPV-GQNXPXPTSA-N	512.29987042							104700
BRD-K64665523	LSM-16064		44620492	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22+,26+/m1/s1	UJYZNBPSVBHVBP-CQAGSAPUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K64665523	BRD-K64665523-001-01-4	Broad Institute of MIT and Harvard	BRD-K64665523			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22+,26+/m1/s1	UJYZNBPSVBHVBP-CQAGSAPUSA-N	579.3090549							104701
BRD-K69624346	LSM-16065		44618263	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23+,24-,29-/m1/s1	MOSVBDAIGOGSPE-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K69624346	BRD-K69624346-001-01-1	Broad Institute of MIT and Harvard	BRD-K69624346			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23+,24-,29-/m1/s1	MOSVBDAIGOGSPE-CDLOMYRSSA-N	581.349857072							104702
BRD-K64953645	LSM-16066		44498608	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21-,22-,26-/m1/s1	KFCLPYACNRFGCM-PIXQIBFHSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K64953645	BRD-K64953645-001-01-7	Broad Institute of MIT and Harvard	BRD-K64953645			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21-,22-,26-/m1/s1	KFCLPYACNRFGCM-PIXQIBFHSA-N	477.356657014							104703
BRD-K66016089	LSM-16067		44494088	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23-,24+,29-/m0/s1	VOOFHSDUWYITSP-OODISRMCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K66016089	BRD-K66016089-001-01-4	Broad Institute of MIT and Harvard	BRD-K66016089			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23-,24+,29-/m0/s1	VOOFHSDUWYITSP-OODISRMCSA-N	603.2978215							104704
BRD-K76389813	LSM-16068		44491502	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22+,27+/m0/s1	HNFJEPMYRFFBAZ-HCUOBIAZSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K76389813	BRD-K76389813-001-01-6	Broad Institute of MIT and Harvard	BRD-K76389813			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22+,27+/m0/s1	HNFJEPMYRFFBAZ-HCUOBIAZSA-N	526.315520484							104705
BRD-K77894681	LSM-16069		44619411	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23-,30-/m1/s1	SIEZSLVXLUPDNY-YYFZOHQYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K77894681	BRD-K77894681-001-01-3	Broad Institute of MIT and Harvard	BRD-K77894681			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23-,30-/m1/s1	SIEZSLVXLUPDNY-YYFZOHQYSA-N	598.336649852							104706
BRD-K72754669	LSM-16070		49843309	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22+,27+/m1/s1	AOLQWFIMADKXQA-YHZQYDDPSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K72754669	BRD-K72754669-001-01-0	Broad Institute of MIT and Harvard	BRD-K72754669			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22+,27+/m1/s1	AOLQWFIMADKXQA-YHZQYDDPSA-N	511.304621442							104707
BRD-K61978712	LSM-16071		44494542	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m1/s1	LKIIRWUIYHEPDR-UJFVLINRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K61978712	BRD-K61978712-001-01-5	Broad Institute of MIT and Harvard	BRD-K61978712			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m1/s1	LKIIRWUIYHEPDR-UJFVLINRSA-N	622.37303536							104708
BRD-K71614913	LSM-15157		44620686	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23-,24-,29+/m0/s1	MOSVBDAIGOGSPE-HGPRPZRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K71614913	BRD-K71614913-001-01-1	Broad Institute of MIT and Harvard	BRD-K71614913			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23-,24-,29+/m0/s1	MOSVBDAIGOGSPE-HGPRPZRGSA-N	581.349857072							103813
BRD-K64347765	LSM-16072		44494443	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23+/m0/s1	AHFPIWRBAUHSCU-RTXPOLOASA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K64347765	BRD-K64347765-001-01-6	Broad Institute of MIT and Harvard	BRD-K64347765			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23+/m0/s1	AHFPIWRBAUHSCU-RTXPOLOASA-N	435.309706822							104709
BRD-K60587793	LSM-16073		44498651	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21+,27+/m1/s1	QNMRQELCDYNENZ-GMAGDTKFSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K60587793	BRD-K60587793-001-01-7	Broad Institute of MIT and Harvard	BRD-K60587793			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21+,27+/m1/s1	QNMRQELCDYNENZ-GMAGDTKFSA-N	544.306098652							104710
BRD-K75842461	LSM-16074		44497667	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19+,23+/m0/s1	QBUCHBBMZJBUJI-RTXPOLOASA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K75842461	BRD-K75842461-001-01-0	Broad Institute of MIT and Harvard	BRD-K75842461			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19+,23+/m0/s1	QBUCHBBMZJBUJI-RTXPOLOASA-N	531.29200601							104711
CHEMBL2037011	LSM-16075	BRD-K72173400, SID104170596	49843303	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,29+/m1/s1	MEJMTXOOFVGIJM-NXRFZHLESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K72173400	BRD-K72173400-001-01-7	Broad Institute of MIT and Harvard	BRD-K72173400			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,29+/m1/s1	MEJMTXOOFVGIJM-NXRFZHLESA-N	593.293485048							104712
BRD-K69491845	LSM-16076		44504269	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27+,28+,34+/m0/s1	NYAGJJIVOVZRJD-MRHQGJBWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K69491845	BRD-K69491845-001-01-1	Broad Institute of MIT and Harvard	BRD-K69491845			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27+,28+,34+/m0/s1	NYAGJJIVOVZRJD-MRHQGJBWSA-N	616.362470676							104713
BRD-K74842791	LSM-16077		54614893	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33-/m0/s1	NGSMHOKAGHIENU-KIAQLKRMSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K74842791	BRD-K74842791-001-01-2	Broad Institute of MIT and Harvard	BRD-K74842791			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33-/m0/s1	NGSMHOKAGHIENU-KIAQLKRMSA-N	623.404669846001							104714
BRD-K63436783	LSM-16078		54614863	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23-,24-,29+/m0/s1	IMDGVULVCKQBDZ-HGPRPZRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K63436783	BRD-K63436783-001-01-6	Broad Institute of MIT and Harvard	BRD-K63436783			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23-,24-,29+/m0/s1	IMDGVULVCKQBDZ-HGPRPZRGSA-N	539.33592157							104715
BRD-K60695671-001-01-5	LSM-16079	BRD-K60695671	44493128	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22-,28-/m0/s1	GMYAYTAKTSTYEI-QBMQIYCRSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	BroadT	BRD-K60695671	BRD-K60695671-001-01-5	Broad Institute of MIT and Harvard	BRD-K60695671			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22-,28-/m0/s1	GMYAYTAKTSTYEI-QBMQIYCRSA-N	608.318555116							104716
BRD-K77041516	LSM-16080		54614903	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29-/m1/s1	MEJMTXOOFVGIJM-PZNASWHRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K77041516	BRD-K77041516-001-01-2	Broad Institute of MIT and Harvard	BRD-K77041516			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29-/m1/s1	MEJMTXOOFVGIJM-PZNASWHRSA-N	593.293485048							104717
BRD-K74712962	LSM-16081		44618055	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25+,26+,32+/m1/s1	IJPCFLZWEMVLEC-UJFVLINRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C1=O	BroadT	BRD-K74712962	BRD-K74712962-001-01-0	Broad Institute of MIT and Harvard	BRD-K74712962			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25+,26+,32+/m1/s1	IJPCFLZWEMVLEC-UJFVLINRSA-N	615.334207008							104718
BRD-K72588970	LSM-16082		44620282	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28-/m1/s1	XHZKQAVNDGMQPU-SQVYLTPJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K72588970	BRD-K72588970-001-01-6	Broad Institute of MIT and Harvard	BRD-K72588970			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28-/m1/s1	XHZKQAVNDGMQPU-SQVYLTPJSA-N	589.282171436							104719
MLS003128726	LSM-16083	BRD-K71496240	46903682	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24+,30+/m0/s1	XIVCQDXGZVVHDO-QXFFIUSXSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K71496240	BRD-K71496240-001-01-7	Broad Institute of MIT and Harvard	BRD-K71496240			COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(NS(C)(=O)=O)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24+,30+/m0/s1	XIVCQDXGZVVHDO-QXFFIUSXSA-N	605.313471564							104720
BRD-K61199074	LSM-16084		44485830	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20+,21-,27+/m0/s1	PQVSIMSGGSSCRI-ZZWZOVRCSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K61199074	BRD-K61199074-001-01-0	Broad Institute of MIT and Harvard	BRD-K61199074			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20+,21-,27+/m0/s1	PQVSIMSGGSSCRI-ZZWZOVRCSA-N	594.308720542							104721
BRD-K61726189	LSM-16085		44488741	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25-,26-,31-/m0/s1	SIHQACFNVCTPOW-VIYORZMQSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K61726189	BRD-K61726189-001-01-2	Broad Institute of MIT and Harvard	BRD-K61726189			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25-,26-,31-/m0/s1	SIHQACFNVCTPOW-VIYORZMQSA-N	582.37812074							104722
BRD-K76154866	LSM-16086		44490898	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22-,26+/m0/s1	ANVCKVJMNHXGBG-OYSWMMLKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K76154866	BRD-K76154866-001-01-0	Broad Institute of MIT and Harvard	BRD-K76154866			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22-,26+/m0/s1	ANVCKVJMNHXGBG-OYSWMMLKSA-N	581.259327506							104723
BRD-K61139423	LSM-16087		44617023	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24+,29+/m0/s1	CWMFJYTZROJEEY-PHBCIFJZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K61139423	BRD-K61139423-001-01-4	Broad Institute of MIT and Harvard	BRD-K61139423			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24+,29+/m0/s1	CWMFJYTZROJEEY-PHBCIFJZSA-N	622.33420518							104724
BRD-K63665694	LSM-16088		44504535	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33-/m0/s1	NGSMHOKAGHIENU-QTLXSIBASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K63665694	BRD-K63665694-001-01-8	Broad Institute of MIT and Harvard	BRD-K63665694			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33-/m0/s1	NGSMHOKAGHIENU-QTLXSIBASA-N	623.404669846001							104725
BRD-K72519034	LSM-16089		54614887	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22-,23+,28+/m0/s1	SKZBTEBCBLPBIZ-HIAVRWOZSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K72519034	BRD-K72519034-001-01-5	Broad Institute of MIT and Harvard	BRD-K72519034			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22-,23+,28+/m0/s1	SKZBTEBCBLPBIZ-HIAVRWOZSA-N	561.287256816							104726
BRD-K70426100	LSM-16090		44618395	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24+,25-,30-/m1/s1	HYZLHQOJAWWHRH-FJRSXGRASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K70426100	BRD-K70426100-001-01-4	Broad Institute of MIT and Harvard	BRD-K70426100			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24+,25-,30-/m1/s1	HYZLHQOJAWWHRH-FJRSXGRASA-N	589.318556944							104727
MLS003128867	LSM-12021	BRD-K59446585, SID99359310	44494142	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22-,28-/m1/s1	GMYAYTAKTSTYEI-BUUPBASBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	BroadT	BRD-K59446585	BRD-K59446585-001-01-1	Broad Institute of MIT and Harvard	BRD-K59446585			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22-,28-/m1/s1	GMYAYTAKTSTYEI-BUUPBASBSA-N	608.318555116							100647
BRD-K59957369	LSM-16091		44620279	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23+,28-/m1/s1	DKJIIKWCTXJSNY-SQVYLTPJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K59957369	BRD-K59957369-001-01-9	Broad Institute of MIT and Harvard	BRD-K59957369			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23+,28-/m1/s1	DKJIIKWCTXJSNY-SQVYLTPJSA-N	561.287256816							104728
BRD-K76889263	LSM-16092		44488214	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20-,21-,26-/m1/s1	UGHRLCJQQBYBPV-VLECTGLKSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K76889263	BRD-K76889263-001-01-0	Broad Institute of MIT and Harvard	BRD-K76889263			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20-,21-,26-/m1/s1	UGHRLCJQQBYBPV-VLECTGLKSA-N	512.29987042							104729
BRD-K60744874	LSM-16093		44489725	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20+,24-/m0/s1	LBVOXJOHMPITGR-SMOZNVCYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K60744874	BRD-K60744874-001-01-6	Broad Institute of MIT and Harvard	BRD-K60744874			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20+,24-/m0/s1	LBVOXJOHMPITGR-SMOZNVCYSA-N	609.269556004							104730
BRD-K59491482	LSM-16094		44493132	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23+,24+,29-/m1/s1	VOOFHSDUWYITSP-CAFXQFFASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K59491482	BRD-K59491482-001-01-1	Broad Institute of MIT and Harvard	BRD-K59491482			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23+,24+,29-/m1/s1	VOOFHSDUWYITSP-CAFXQFFASA-N	603.2978215							104731
BRD-K66616402	LSM-16095		44498597	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22+,23-,30-/m1/s1	SIEZSLVXLUPDNY-UAXFNLPOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K66616402	BRD-K66616402-001-01-1	Broad Institute of MIT and Harvard	BRD-K66616402			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22+,23-,30-/m1/s1	SIEZSLVXLUPDNY-UAXFNLPOSA-N	598.336649852							104732
BRD-K68890376	LSM-16096		44495062	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19+,23+/m1/s1	AHFPIWRBAUHSCU-GBPOLFSSSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K68890376	BRD-K68890376-001-01-2	Broad Institute of MIT and Harvard	BRD-K68890376			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19+,23+/m1/s1	AHFPIWRBAUHSCU-GBPOLFSSSA-N	435.309706822							104733
BRD-K74933734	LSM-16097		44617654	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26-,27+,32-/m1/s1	SDZYTDXKXKHZJE-BESNRVDSSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K74933734	BRD-K74933734-001-01-9	Broad Institute of MIT and Harvard	BRD-K74933734			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26-,27+,32-/m1/s1	SDZYTDXKXKHZJE-BESNRVDSSA-N	624.388685424							104734
BRD-K62536891	LSM-16098		44490408	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27+/m1/s1	HNFJEPMYRFFBAZ-RYBWSMFQSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K62536891	BRD-K62536891-001-01-3	Broad Institute of MIT and Harvard	BRD-K62536891			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27+/m1/s1	HNFJEPMYRFFBAZ-RYBWSMFQSA-N	526.315520484							104735
MLS003130365	LSM-6785	BRD8846, SID99359249, SD-6-035-B4	44502953	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24+,31-/m0/s1	WIYHORLWMFSPCL-WLCCTRHUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K66608846	BRD-K66608846-001-01-2	Broad Institute of MIT and Harvard	BRD-K66608846			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24+,31-/m0/s1	WIYHORLWMFSPCL-WLCCTRHUSA-N	569.346486254							95406
BRD-K69705285	LSM-16099		54614879	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21-,22-,26-/m0/s1	ZWQRBFIYGZIGKO-YGWSKSRPSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K69705285	BRD-K69705285-001-01-1	Broad Institute of MIT and Harvard	BRD-K69705285			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21-,22-,26-/m0/s1	ZWQRBFIYGZIGKO-YGWSKSRPSA-N	573.338956202							104736
BRD-K76482408	LSM-16100		44489344	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27-/m1/s1	HNFJEPMYRFFBAZ-RSOWOKRSSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K76482408	BRD-K76482408-001-01-0	Broad Institute of MIT and Harvard	BRD-K76482408			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27-/m1/s1	HNFJEPMYRFFBAZ-RSOWOKRSSA-N	526.315520484							104737
BRD-K75038114	LSM-16101		44490372	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24+,29+/m1/s1	QUSLWNNTNFDPAB-MSCBGTKOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K75038114	BRD-K75038114-001-01-6	Broad Institute of MIT and Harvard	BRD-K75038114			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24+,29+/m1/s1	QUSLWNNTNFDPAB-MSCBGTKOSA-N	545.382871762							104738
BRD-K67278762	LSM-16102		44619695	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22+,23+,29+/m1/s1	PSEUFYCSFOBFBF-NXRFZHLESA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K67278762	BRD-K67278762-001-01-3	Broad Institute of MIT and Harvard	BRD-K67278762			COc1ccc(NC(=O)Nc2ccc3O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22+,23+,29+/m1/s1	PSEUFYCSFOBFBF-NXRFZHLESA-N	570.341735232							104739
BRD-K66538269	LSM-16103		44619256	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24-,29-/m0/s1	CWMFJYTZROJEEY-MVPDCNEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K66538269	BRD-K66538269-001-01-9	Broad Institute of MIT and Harvard	BRD-K66538269			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24-,29-/m0/s1	CWMFJYTZROJEEY-MVPDCNEZSA-N	622.33420518							104740
BRD-K65432894	LSM-16104		54614868	InChI=1S/C33H47FN4O5/c1-22-18-38(23(2)21-39)32(40)29-17-28(36-33(41)35-27-12-10-26(34)11-13-27)14-15-30(29)43-24(3)7-5-6-16-42-31(22)20-37(4)19-25-8-9-25/h10-15,17,22-25,31,39H,5-9,16,18-21H2,1-4H3,(H2,35,36,41)/t22-,23+,24-,31+/m0/s1	STYUMYTXFXXJJW-PHSVBEEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc3C1=O	BroadT	BRD-K65432894	BRD-K65432894-001-01-9	Broad Institute of MIT and Harvard	BRD-K65432894			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C33H47FN4O5/c1-22-18-38(23(2)21-39)32(40)29-17-28(36-33(41)35-27-12-10-26(34)11-13-27)14-15-30(29)43-24(3)7-5-6-16-42-31(22)20-37(4)19-25-8-9-25/h10-15,17,22-25,31,39H,5-9,16,18-21H2,1-4H3,(H2,35,36,41)/t22-,23+,24-,31+/m0/s1	STYUMYTXFXXJJW-PHSVBEEISA-N	598.353048844							104741
BRD-K74289419	LSM-16105		44485122	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25-,30+/m0/s1	OPCOPDBCCFUTHV-DNHJLFCISA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K74289419	BRD-K74289419-001-01-8	Broad Institute of MIT and Harvard	BRD-K74289419			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25-,30+/m0/s1	OPCOPDBCCFUTHV-DNHJLFCISA-N	525.356657014							104742
BRD-K74978191	LSM-16106		44485820	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22-,23-,27+/m0/s1	LTGDTYHJVMKPBL-RNLGNXJRSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K74978191	BRD-K74978191-001-01-0	Broad Institute of MIT and Harvard	BRD-K74978191			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22-,23-,27+/m0/s1	LTGDTYHJVMKPBL-RNLGNXJRSA-N	534.37812074							104743
BRD-K65054381	LSM-16107		44484558	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20-,21-,27-/m0/s1	AQPDNHSQVUKPGE-RFACUBCZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K65054381	BRD-K65054381-001-01-1	Broad Institute of MIT and Harvard	BRD-K65054381			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20-,21-,27-/m0/s1	AQPDNHSQVUKPGE-RFACUBCZSA-N	573.352634274							104744
BRD-K74785745	LSM-16108		44489732	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23-/m0/s1	HNAHSZOZZNPVNF-LVBDUCALSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K74785745	BRD-K74785745-001-01-0	Broad Institute of MIT and Harvard	BRD-K74785745			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23-/m0/s1	HNAHSZOZZNPVNF-LVBDUCALSA-N	499.271606752							104745
BRD-K68485855	LSM-16109		44494568	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24+/m1/s1	PQNWFIFCFFWMJI-ZSTWQFLISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K68485855	BRD-K68485855-001-01-1	Broad Institute of MIT and Harvard	BRD-K68485855			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24+/m1/s1	PQNWFIFCFFWMJI-ZSTWQFLISA-N	449.325356886							104746
BRD-K72800151	LSM-16110		54614889	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23+,24-,30+/m1/s1	IYJPIDGCXVWPNR-IFVFNEAISA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)N(C)C)cc1	BroadT	BRD-K72800151	BRD-K72800151-001-01-6	Broad Institute of MIT and Harvard	BRD-K72800151			COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)N(C)C)cc1	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23+,24-,30+/m1/s1	IYJPIDGCXVWPNR-IFVFNEAISA-N	584.357385296							104747
BRD-K72609226	LSM-16111		44490359	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24+,29+/m1/s1	ZJHDPNYYPDHDNF-MSCBGTKOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K72609226	BRD-K72609226-001-01-2	Broad Institute of MIT and Harvard	BRD-K72609226			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24+,29+/m1/s1	ZJHDPNYYPDHDNF-MSCBGTKOSA-N	539.33592157							104748
BRD-K75551005	LSM-16112		44620773	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22-,23+,30-/m0/s1	KQLDLPDWVHVVHP-HKMOBIFTSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K75551005	BRD-K75551005-001-01-0	Broad Institute of MIT and Harvard	BRD-K75551005			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22-,23+,30-/m0/s1	KQLDLPDWVHVVHP-HKMOBIFTSA-N	619.29273612							104749
BRD-K78106941	LSM-16113		44485088	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19+,23-/m1/s1	HNAHSZOZZNPVNF-CROMWVBPSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K78106941	BRD-K78106941-001-01-7	Broad Institute of MIT and Harvard	BRD-K78106941			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19+,23-/m1/s1	HNAHSZOZZNPVNF-CROMWVBPSA-N	499.271606752							104750
BRD-K68298468	LSM-16114		44617895	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28+/m0/s1	MPJVZFHLUPPQBG-MIUQQGMZSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K68298468	BRD-K68298468-001-01-7	Broad Institute of MIT and Harvard	BRD-K68298468			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28+/m0/s1	MPJVZFHLUPPQBG-MIUQQGMZSA-N	577.282171436							104751
BRD-K66805710	LSM-15049		44486405	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25-,30-/m1/s1	OPCOPDBCCFUTHV-FJRSXGRASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K66805710	BRD-K66805710-001-01-7	Broad Institute of MIT and Harvard	BRD-K66805710			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25-,30-/m1/s1	OPCOPDBCCFUTHV-FJRSXGRASA-N	525.356657014							103705
BRD-K72439355	LSM-16115		54614886	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m0/s1	IDICBOGPMQOFGC-FBIDWWCOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K72439355	BRD-K72439355-001-01-7	Broad Institute of MIT and Harvard	BRD-K72439355			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m0/s1	IDICBOGPMQOFGC-FBIDWWCOSA-N	616.326085168							104752
CHEMBL3187109	LSM-16116	BRD-K64066545	44620653	InChI=1S/C32H47FN4O5/c1-6-16-36(5)20-30-22(2)19-37(23(3)21-38)31(39)28-18-27(35-32(40)34-26-12-10-25(33)11-13-26)14-15-29(28)42-24(4)9-7-8-17-41-30/h10-15,18,22-24,30,38H,6-9,16-17,19-21H2,1-5H3,(H2,34,35,40)/t22-,23+,24-,30-/m0/s1	ZDZLFJDSEKLXNO-PUMORYBASA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K64066545	BRD-K64066545-001-01-9	Broad Institute of MIT and Harvard	BRD-K64066545			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H47FN4O5/c1-6-16-36(5)20-30-22(2)19-37(23(3)21-38)31(39)28-18-27(35-32(40)34-26-12-10-25(33)11-13-26)14-15-29(28)42-24(4)9-7-8-17-41-30/h10-15,18,22-24,30,38H,6-9,16-17,19-21H2,1-5H3,(H2,34,35,40)/t22-,23+,24-,30-/m0/s1	ZDZLFJDSEKLXNO-PUMORYBASA-N	586.353048844							104753
BRD-K59609877	LSM-16117		44487499	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28+,33+/m1/s1	YHPMBPSGDQLXHP-VQSVPOMMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K59609877	BRD-K59609877-001-01-1	Broad Institute of MIT and Harvard	BRD-K59609877			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28+,33+/m1/s1	YHPMBPSGDQLXHP-VQSVPOMMSA-N	610.409420868							104754
BRD-K78310215	LSM-16118		44501143	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22+,28+/m0/s1	MPJVZFHLUPPQBG-CLYWQNBRSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K78310215	BRD-K78310215-001-01-4	Broad Institute of MIT and Harvard	BRD-K78310215			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22+,28+/m0/s1	MPJVZFHLUPPQBG-CLYWQNBRSA-N	577.282171436							104755
BRD-K67591072	LSM-16119		44503663	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23+,29-/m0/s1	QSYAMXVABCSWEP-KUFVDZEESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K67591072	BRD-K67591072-001-01-4	Broad Institute of MIT and Harvard	BRD-K67591072			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23+,29-/m0/s1	QSYAMXVABCSWEP-KUFVDZEESA-N	622.33420518							104756
BRD-K77743611	LSM-16120		44492075	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20+,21-,25-/m1/s1	IUWUHICBQVKRRR-FBROZUCGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K77743611	BRD-K77743611-001-01-7	Broad Institute of MIT and Harvard	BRD-K77743611			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20+,21-,25-/m1/s1	IUWUHICBQVKRRR-FBROZUCGSA-N	559.323306138							104757
BRD-K64091938	LSM-16121		44620690	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22-,23-,27+/m0/s1	MTZUJVYQNWSRMQ-RNLGNXJRSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K64091938	BRD-K64091938-001-01-2	Broad Institute of MIT and Harvard	BRD-K64091938			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22-,23-,27+/m0/s1	MTZUJVYQNWSRMQ-RNLGNXJRSA-N	598.34002067							104758
BRD-K77246148	LSM-16122		44620199	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27+/m1/s1	OPIQAKQROYPQNZ-RBZJZWSTSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K77246148	BRD-K77246148-001-01-3	Broad Institute of MIT and Harvard	BRD-K77246148			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27+/m1/s1	OPIQAKQROYPQNZ-RBZJZWSTSA-N	565.26218492							104759
BRD-K72833997	LSM-16123		44617214	InChI=1S/C33H47FN4O5/c1-22-18-38(23(2)21-39)32(40)29-17-28(36-33(41)35-27-12-10-26(34)11-13-27)14-15-30(29)43-24(3)7-5-6-16-42-31(22)20-37(4)19-25-8-9-25/h10-15,17,22-25,31,39H,5-9,16,18-21H2,1-4H3,(H2,35,36,41)/t22-,23+,24+,31+/m0/s1	STYUMYTXFXXJJW-GPYNCYNASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc3C1=O	BroadT	BRD-K72833997	BRD-K72833997-001-01-5	Broad Institute of MIT and Harvard	BRD-K72833997			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C33H47FN4O5/c1-22-18-38(23(2)21-39)32(40)29-17-28(36-33(41)35-27-12-10-26(34)11-13-27)14-15-30(29)43-24(3)7-5-6-16-42-31(22)20-37(4)19-25-8-9-25/h10-15,17,22-25,31,39H,5-9,16,18-21H2,1-4H3,(H2,35,36,41)/t22-,23+,24+,31+/m0/s1	STYUMYTXFXXJJW-GPYNCYNASA-N	598.353048844							104760
BRD-K78365192	LSM-16124		44485772	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25+,26-,31-/m1/s1	SIHQACFNVCTPOW-FVCFNFBRSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K78365192	BRD-K78365192-001-01-5	Broad Institute of MIT and Harvard	BRD-K78365192			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25+,26-,31-/m1/s1	SIHQACFNVCTPOW-FVCFNFBRSA-N	582.37812074							104761
MLS003128804	LSM-13198	BRD-K77939573, SID99359152	44620313	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23+,24-,30+/m0/s1	OKIGVZMNGZVCJM-WUBQMYJQSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C	BroadT	BRD-K77939573	BRD-K77939573-001-01-7	Broad Institute of MIT and Harvard	BRD-K77939573			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23+,24-,30+/m0/s1	OKIGVZMNGZVCJM-WUBQMYJQSA-N	605.313471564							101836
BRD-K64509231	LSM-16125		44492625	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22-,23+,28-/m0/s1	SCSZUZCJLHTTSJ-QKFCCHLXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K64509231	BRD-K64509231-001-01-7	Broad Institute of MIT and Harvard	BRD-K64509231			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22-,23+,28-/m0/s1	SCSZUZCJLHTTSJ-QKFCCHLXSA-N	589.282171436							104762
BRD-K77074748	LSM-16126		44486999	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25+,30-/m1/s1	OPCOPDBCCFUTHV-UBRKHCEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K77074748	BRD-K77074748-001-01-3	Broad Institute of MIT and Harvard	BRD-K77074748			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25+,30-/m1/s1	OPCOPDBCCFUTHV-UBRKHCEVSA-N	525.356657014							104763
BRD-K70322385	LSM-16127		49843438	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24+,29+/m1/s1	CWMFJYTZROJEEY-MSCBGTKOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K70322385	BRD-K70322385-001-01-1	Broad Institute of MIT and Harvard	BRD-K70322385			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24+,29+/m1/s1	CWMFJYTZROJEEY-MSCBGTKOSA-N	622.33420518							104764
BRD-K62324460	LSM-16128		44503710	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21+,28+/m0/s1	DZFCVSNNMFSZPA-FDHRJDEYSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K62324460	BRD-K62324460-001-01-5	Broad Institute of MIT and Harvard	BRD-K62324460			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21+,28+/m0/s1	DZFCVSNNMFSZPA-FDHRJDEYSA-N	570.305349724							104765
CHEMBL2137526	LSM-16129	BRD-K64663625, SID131409856	54614866	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23+,30-/m0/s1	SIEZSLVXLUPDNY-HKMOBIFTSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K64663625	BRD-K64663625-001-01-6	Broad Institute of MIT and Harvard	BRD-K64663625			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23+,30-/m0/s1	SIEZSLVXLUPDNY-HKMOBIFTSA-N	598.336649852							104766
BRD-K76558091	LSM-16130		44617588	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19+,23+/m1/s1	QBUCHBBMZJBUJI-GBPOLFSSSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K76558091	BRD-K76558091-001-01-9	Broad Institute of MIT and Harvard	BRD-K76558091			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19+,23+/m1/s1	QBUCHBBMZJBUJI-GBPOLFSSSA-N	531.29200601							104767
BRD-K70127757	LSM-16131		44619718	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22-,27+/m1/s1	AOLQWFIMADKXQA-RKGZYEPBSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K70127757	BRD-K70127757-001-01-4	Broad Institute of MIT and Harvard	BRD-K70127757			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22-,27+/m1/s1	AOLQWFIMADKXQA-RKGZYEPBSA-N	511.304621442							104768
BRD-K73952959	LSM-16132		44485823	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23-,24+,29+/m0/s1	SEDRIVHSDUVLLE-PHBCIFJZSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K73952959	BRD-K73952959-001-01-8	Broad Institute of MIT and Harvard	BRD-K73952959			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23-,24+,29+/m0/s1	SEDRIVHSDUVLLE-PHBCIFJZSA-N	597.352634274							104769
BRD-K66973998	LSM-16133		49843083	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25+,30+/m1/s1	KOPUKDVKYXJRIR-DUXAABNJSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K66973998	BRD-K66973998-001-01-6	Broad Institute of MIT and Harvard	BRD-K66973998			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25+,30+/m1/s1	KOPUKDVKYXJRIR-DUXAABNJSA-N	602.404335488							104770
BRD-K64824710	LSM-16134		44618319	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28+/m1/s1	XHZKQAVNDGMQPU-DHMIZTNRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K64824710	BRD-K64824710-001-01-0	Broad Institute of MIT and Harvard	BRD-K64824710			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28+/m1/s1	XHZKQAVNDGMQPU-DHMIZTNRSA-N	589.282171436							104771
BRD-K65831955	LSM-16135		44493632	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24-/m1/s1	PQNWFIFCFFWMJI-ZBNTXBBCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K65831955	BRD-K65831955-001-01-8	Broad Institute of MIT and Harvard	BRD-K65831955			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24-/m1/s1	PQNWFIFCFFWMJI-ZBNTXBBCSA-N	449.325356886							104772
BRD-K75625428	LSM-16136		44616846	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28-/m1/s1	VUABGABXFJSUSX-YFUNBVQMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K75625428	BRD-K75625428-001-01-1	Broad Institute of MIT and Harvard	BRD-K75625428			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28-/m1/s1	VUABGABXFJSUSX-YFUNBVQMSA-N	546.37812074							104773
BRD-K67024719	LSM-16137		44495046	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19-,23+/m1/s1	AHFPIWRBAUHSCU-KCESLBEFSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K67024719	BRD-K67024719-001-01-5	Broad Institute of MIT and Harvard	BRD-K67024719			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19-,23+/m1/s1	AHFPIWRBAUHSCU-KCESLBEFSA-N	435.309706822							104774
BRD-K62982533	LSM-16138		54614861	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23+,30+/m0/s1	SIEZSLVXLUPDNY-CXDLDTBJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K62982533	BRD-K62982533-001-01-3	Broad Institute of MIT and Harvard	BRD-K62982533			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23+,30+/m0/s1	SIEZSLVXLUPDNY-CXDLDTBJSA-N	598.336649852							104775
BRD-K78306305	LSM-16139		44492111	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20-,21-,25-/m1/s1	IUWUHICBQVKRRR-QTDDQOEGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K78306305	BRD-K78306305-001-01-3	Broad Institute of MIT and Harvard	BRD-K78306305			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20-,21-,25-/m1/s1	IUWUHICBQVKRRR-QTDDQOEGSA-N	559.323306138							104776
BRD-K72278003	LSM-16140		44618720	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32+/m1/s1	IDICBOGPMQOFGC-ZYMMPZCLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K72278003	BRD-K72278003-001-01-5	Broad Institute of MIT and Harvard	BRD-K72278003			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32+/m1/s1	IDICBOGPMQOFGC-ZYMMPZCLSA-N	616.326085168							104777
BRD-K62921520	LSM-16141		54614859	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23-,29+/m1/s1	AGSKCAQZMPMVIM-OFKKAEEBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K62921520	BRD-K62921520-001-01-6	Broad Institute of MIT and Harvard	BRD-K62921520			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23-,29+/m1/s1	AGSKCAQZMPMVIM-OFKKAEEBSA-N	572.33739878							104778
BRD-K60946512	LSM-16142		44502741	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33-/m0/s1	FHYFYPZRCDKSKV-QTLXSIBASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K60946512	BRD-K60946512-001-01-5	Broad Institute of MIT and Harvard	BRD-K60946512			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33-/m0/s1	FHYFYPZRCDKSKV-QTLXSIBASA-N	608.393770804							104779
BRD-K60719499	LSM-16143		44616972	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28-,33-/m0/s1	XXBVUIDNUVBELT-YENKVUBUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K60719499	BRD-K60719499-001-01-3	Broad Institute of MIT and Harvard	BRD-K60719499			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28-,33-/m0/s1	XXBVUIDNUVBELT-YENKVUBUSA-N	616.45637106							104780
BRD-K61791241	LSM-16144		54614852	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26+,27+,32+/m0/s1	SDZYTDXKXKHZJE-MYECLKKLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K61791241	BRD-K61791241-001-01-2	Broad Institute of MIT and Harvard	BRD-K61791241			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26+,27+,32+/m0/s1	SDZYTDXKXKHZJE-MYECLKKLSA-N	624.388685424							104781
BRD-K60287661	LSM-16145		44620133	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23-,24+,29-/m0/s1	IMDGVULVCKQBDZ-OODISRMCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K60287661	BRD-K60287661-001-01-3	Broad Institute of MIT and Harvard	BRD-K60287661			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23-,24+,29-/m0/s1	IMDGVULVCKQBDZ-OODISRMCSA-N	539.33592157							104782
BRD-K60713831	LSM-16146		54614847	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23-,24+,29-/m1/s1	MOSVBDAIGOGSPE-IDCDSMMUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K60713831	BRD-K60713831-001-01-3	Broad Institute of MIT and Harvard	BRD-K60713831			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23-,24+,29-/m1/s1	MOSVBDAIGOGSPE-IDCDSMMUSA-N	581.349857072							104783
BRD-K71807663	LSM-16147		54614885	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23+,28-/m1/s1	BJJOMMAJAORXGV-YFUNBVQMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K71807663	BRD-K71807663-001-01-3	Broad Institute of MIT and Harvard	BRD-K71807663			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23+,28-/m1/s1	BJJOMMAJAORXGV-YFUNBVQMSA-N	595.329121628							104784
BRD-K73126584	LSM-16148		44619110	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24+,25+,29+/m0/s1	NSUWFWDPIIGHAU-GYKHTSFTSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K73126584	BRD-K73126584-001-01-2	Broad Institute of MIT and Harvard	BRD-K73126584			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24+,25+,29+/m0/s1	NSUWFWDPIIGHAU-GYKHTSFTSA-N	562.409420868							104785
BRD-K62154563	LSM-16149		54614855	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28+/m0/s1	MPJVZFHLUPPQBG-KJZXJLKKSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K62154563	BRD-K62154563-001-01-2	Broad Institute of MIT and Harvard	BRD-K62154563			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28+/m0/s1	MPJVZFHLUPPQBG-KJZXJLKKSA-N	577.282171436							104786
BRD-K73371640-001-01-6	LSM-6778	SD-6-035-A4, BRD1640	46925839	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24+,31+/m1/s1	WIYHORLWMFSPCL-WIZGYELTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K73371640	BRD-K73371640-001-01-6	Broad Institute of MIT and Harvard	BRD-K73371640			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24+,31+/m1/s1	WIYHORLWMFSPCL-WIZGYELTSA-N	569.346486254							95399
BRD-K66214118	LSM-16150		54614872	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24-,25-,30-/m0/s1	RSKGZFLSRBPJST-XZSZPMDUSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K66214118	BRD-K66214118-001-01-0	Broad Institute of MIT and Harvard	BRD-K66214118			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24-,25-,30-/m0/s1	RSKGZFLSRBPJST-XZSZPMDUSA-N	617.41523453							104787
BRD-K60068268	LSM-16151		49843236	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24+,30+/m1/s1	JGZXBABAHUXSMS-UCTCLUAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K60068268	BRD-K60068268-001-01-4	Broad Institute of MIT and Harvard	BRD-K60068268			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24+,30+/m1/s1	JGZXBABAHUXSMS-UCTCLUAXSA-N	569.346486254							104788
BRD-K76449854	LSM-16152		44501993	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m0/s1	OQPYQZIBKYAWRE-GSDPCRBASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K76449854	BRD-K76449854-001-01-8	Broad Institute of MIT and Harvard	BRD-K76449854			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m0/s1	OQPYQZIBKYAWRE-GSDPCRBASA-N	622.37303536							104789
BRD-K66838288	LSM-16153		44619189	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m1/s1	IDICBOGPMQOFGC-UJFVLINRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K66838288	BRD-K66838288-001-01-0	Broad Institute of MIT and Harvard	BRD-K66838288			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m1/s1	IDICBOGPMQOFGC-UJFVLINRSA-N	616.326085168							104790
BRD-K74598339	LSM-16154		44489325	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20+,21-,26-/m0/s1	UGHRLCJQQBYBPV-LMMUWCHVSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K74598339	BRD-K74598339-001-01-9	Broad Institute of MIT and Harvard	BRD-K74598339			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20+,21-,26-/m0/s1	UGHRLCJQQBYBPV-LMMUWCHVSA-N	512.29987042							104791
BRD-K60738705	LSM-16155		44490414	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24-,29+/m1/s1	QUSLWNNTNFDPAB-HZTMJRFTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K60738705	BRD-K60738705-001-01-3	Broad Institute of MIT and Harvard	BRD-K60738705			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24-,29+/m1/s1	QUSLWNNTNFDPAB-HZTMJRFTSA-N	545.382871762							104792
BRD-K60353472	LSM-16156		44490431	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20-,21+,26+/m1/s1	UGHRLCJQQBYBPV-YRKFHGTDSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K60353472	BRD-K60353472-001-01-2	Broad Institute of MIT and Harvard	BRD-K60353472			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20-,21+,26+/m1/s1	UGHRLCJQQBYBPV-YRKFHGTDSA-N	512.29987042							104793
BRD-K75807882	LSM-16157		44495032	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23+,24+,28+/m1/s1	FCDOAUZTELHSSL-DELVEFKNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K75807882	BRD-K75807882-001-01-4	Broad Institute of MIT and Harvard	BRD-K75807882			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23+,24+,28+/m1/s1	FCDOAUZTELHSSL-DELVEFKNSA-N	548.393770804							104794
BRD-K75900642	LSM-16158		44616559	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27-/m0/s1	OPIQAKQROYPQNZ-RFACUBCZSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K75900642	BRD-K75900642-001-01-8	Broad Institute of MIT and Harvard	BRD-K75900642			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27-/m0/s1	OPIQAKQROYPQNZ-RFACUBCZSA-N	565.26218492							104795
BRD-K62152527	LSM-16159		44493633	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m1/s1	LKIIRWUIYHEPDR-VUKRRIEASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K62152527	BRD-K62152527-001-01-1	Broad Institute of MIT and Harvard	BRD-K62152527			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m1/s1	LKIIRWUIYHEPDR-VUKRRIEASA-N	622.37303536							104796
BRD-K65725294	LSM-16160		44620647	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21+,27-/m0/s1	QNMRQELCDYNENZ-GRWWNZOSSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K65725294	BRD-K65725294-001-01-2	Broad Institute of MIT and Harvard	BRD-K65725294			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21+,27-/m0/s1	QNMRQELCDYNENZ-GRWWNZOSSA-N	544.306098652							104797
BRD-K71919612	LSM-16161		44487488	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20-,24+/m0/s1	LBVOXJOHMPITGR-CMCWBKRRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K71919612	BRD-K71919612-001-01-8	Broad Institute of MIT and Harvard	BRD-K71919612			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20-,24+/m0/s1	LBVOXJOHMPITGR-CMCWBKRRSA-N	609.269556004							104798
BRD-K76173551	LSM-16162		44495495	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19-,23+/m0/s1	AHFPIWRBAUHSCU-QPXQOZNCSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K76173551	BRD-K76173551-001-01-0	Broad Institute of MIT and Harvard	BRD-K76173551			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19-,23+/m0/s1	AHFPIWRBAUHSCU-QPXQOZNCSA-N	435.309706822							104799
BRD-K65266979	LSM-16163		44618570	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25-,26+,32+/m1/s1	JCVAFPCEYZSYDX-XPZOENDESA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K65266979	BRD-K65266979-001-01-9	Broad Institute of MIT and Harvard	BRD-K65266979			COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25-,26+,32+/m1/s1	JCVAFPCEYZSYDX-XPZOENDESA-N	612.388685424							104800
BRD-K59657378	LSM-16164		44617399	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22-,23+,29-/m1/s1	QSYAMXVABCSWEP-LDIMMVFUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K59657378	BRD-K59657378-001-01-4	Broad Institute of MIT and Harvard	BRD-K59657378			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22-,23+,29-/m1/s1	QSYAMXVABCSWEP-LDIMMVFUSA-N	622.33420518							104801
BRD-K76893279	LSM-16165		44495479	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23-,24+,28+/m0/s1	FCDOAUZTELHSSL-FLSMRUOLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K76893279	BRD-K76893279-001-01-4	Broad Institute of MIT and Harvard	BRD-K76893279			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23-,24+,28+/m0/s1	FCDOAUZTELHSSL-FLSMRUOLSA-N	548.393770804							104802
BRD-K62492257	LSM-16166		44504552	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21+,22+,26-/m0/s1	KFCLPYACNRFGCM-BOCITWAFSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K62492257	BRD-K62492257-001-01-7	Broad Institute of MIT and Harvard	BRD-K62492257			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21+,22+,26-/m0/s1	KFCLPYACNRFGCM-BOCITWAFSA-N	477.356657014							104803
BRD-K77279904	LSM-16167		54614905	InChI=1S/C31H46ClN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23+,24+,30-/m1/s1	XCNKIYRWXFRDDY-DLWGQWRRSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K77279904	BRD-K77279904-001-01-8	Broad Institute of MIT and Harvard	BRD-K77279904			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C31H46ClN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23+,24+,30-/m1/s1	XCNKIYRWXFRDDY-DLWGQWRRSA-N	623.279584622							104804
BRD-K67525206	LSM-16168		44493145	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21-,22-,28-/m1/s1	GMYAYTAKTSTYEI-SOLZYKTISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	BroadT	BRD-K67525206	BRD-K67525206-001-01-1	Broad Institute of MIT and Harvard	BRD-K67525206			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21-,22-,28-/m1/s1	GMYAYTAKTSTYEI-SOLZYKTISA-N	608.318555116							104805
BRD-K65868510	LSM-16169		54614871	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21-,22+,28-/m1/s1	QZYXNEJVPTWBHC-SITKICAQSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K65868510	BRD-K65868510-001-01-8	Broad Institute of MIT and Harvard	BRD-K65868510			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21-,22+,28-/m1/s1	QZYXNEJVPTWBHC-SITKICAQSA-N	556.326085168							104806
BRD-K74968522	LSM-16170		54614895	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28-,33+/m1/s1	XXBVUIDNUVBELT-CPWWYQHDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K74968522	BRD-K74968522-001-01-1	Broad Institute of MIT and Harvard	BRD-K74968522			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28-,33+/m1/s1	XXBVUIDNUVBELT-CPWWYQHDSA-N	616.45637106							104807
BRD-K74794014	LSM-16171		44490459	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20-,21-,26+/m1/s1	UGHRLCJQQBYBPV-AXMKBWGCSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K74794014	BRD-K74794014-001-01-6	Broad Institute of MIT and Harvard	BRD-K74794014			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20-,21-,26+/m1/s1	UGHRLCJQQBYBPV-AXMKBWGCSA-N	512.29987042							104808
BRD-K60807536	LSM-16172		44504062	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18+,19+,25-/m0/s1	OIOMLIQJBPNRTR-LRYHZEFKSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K60807536	BRD-K60807536-001-01-1	Broad Institute of MIT and Harvard	BRD-K60807536			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18+,19+,25-/m0/s1	OIOMLIQJBPNRTR-LRYHZEFKSA-N	545.321334146							104809
BRD-K75606012	LSM-16173		54614897	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21+,27-/m1/s1	OPIQAKQROYPQNZ-CQXYJFHHSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K75606012	BRD-K75606012-001-01-3	Broad Institute of MIT and Harvard	BRD-K75606012			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21+,27-/m1/s1	OPIQAKQROYPQNZ-CQXYJFHHSA-N	565.26218492							104810
BRD-K69408624	LSM-16174		44493135	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24-,29-/m1/s1	ZQLCRBSTGDSWQO-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K69408624	BRD-K69408624-001-01-2	Broad Institute of MIT and Harvard	BRD-K69408624			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24-,29-/m1/s1	ZQLCRBSTGDSWQO-CDLOMYRSSA-N	526.351905992							104811
BRD-K68383485	LSM-16175		44619172	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23-,24+,29+/m0/s1	IMDGVULVCKQBDZ-PHBCIFJZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K68383485	BRD-K68383485-001-01-6	Broad Institute of MIT and Harvard	BRD-K68383485			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23-,24+,29+/m0/s1	IMDGVULVCKQBDZ-PHBCIFJZSA-N	539.33592157							104812
BRD-K75545951	LSM-16176		44495073	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23-,24-,31+/m1/s1	DSXVWRRZDLHRDJ-QJWQVSSASA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K75545951	BRD-K75545951-001-01-6	Broad Institute of MIT and Harvard	BRD-K75545951			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23-,24-,31+/m1/s1	DSXVWRRZDLHRDJ-QJWQVSSASA-N	576.331170548							104813
BRD-K75224334	LSM-16177		44616962	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28-/m0/s1	KDWFAOIYLGHTDK-STFWXSJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	BroadT	BRD-K75224334	BRD-K75224334-001-01-6	Broad Institute of MIT and Harvard	BRD-K75224334			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28-/m0/s1	KDWFAOIYLGHTDK-STFWXSJUSA-N	579.277834984							104814
BRD-K71420819	LSM-16178		49843174	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32+/m1/s1	OQPYQZIBKYAWRE-XPZOENDESA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K71420819	BRD-K71420819-001-01-8	Broad Institute of MIT and Harvard	BRD-K71420819			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32+/m1/s1	OQPYQZIBKYAWRE-XPZOENDESA-N	622.37303536							104815
BRD-K77824583	LSM-16179		44502479	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25+,26+,32-/m0/s1	IJPCFLZWEMVLEC-GSDPCRBASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C1=O	BroadT	BRD-K77824583	BRD-K77824583-001-01-9	Broad Institute of MIT and Harvard	BRD-K77824583			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25+,26+,32-/m0/s1	IJPCFLZWEMVLEC-GSDPCRBASA-N	615.334207008							104816
BRD-K70945620	LSM-16180		54614881	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22+,23-,30-/m0/s1	KQLDLPDWVHVVHP-GOXVIRKJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K70945620	BRD-K70945620-001-01-4	Broad Institute of MIT and Harvard	BRD-K70945620			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22+,23-,30-/m0/s1	KQLDLPDWVHVVHP-GOXVIRKJSA-N	619.29273612							104817
BRD-K62682892	LSM-16181		54614858	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24-,29+/m0/s1	CWMFJYTZROJEEY-HGPRPZRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K62682892	BRD-K62682892-001-01-4	Broad Institute of MIT and Harvard	BRD-K62682892			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24-,29+/m0/s1	CWMFJYTZROJEEY-HGPRPZRGSA-N	622.33420518							104818
BRD-K64553072	LSM-16182		44619365	InChI=1S/C32H54N4O5/c1-6-17-35(5)21-30-23(2)20-36(24(3)22-37)31(38)28-19-27(34-32(39)33-26-13-8-7-9-14-26)15-16-29(28)41-25(4)12-10-11-18-40-30/h15-16,19,23-26,30,37H,6-14,17-18,20-22H2,1-5H3,(H2,33,34,39)/t23-,24-,25-,30-/m0/s1	DKJNEIWLBYXYNW-XZSZPMDUSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K64553072	BRD-K64553072-001-01-7	Broad Institute of MIT and Harvard	BRD-K64553072			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C32H54N4O5/c1-6-17-35(5)21-30-23(2)20-36(24(3)22-37)31(38)28-19-27(34-32(39)33-26-13-8-7-9-14-26)15-16-29(28)41-25(4)12-10-11-18-40-30/h15-16,19,23-26,30,37H,6-14,17-18,20-22H2,1-5H3,(H2,33,34,39)/t23-,24-,25-,30-/m0/s1	DKJNEIWLBYXYNW-XZSZPMDUSA-N	574.409420868							104819
BRD-K70530990	LSM-16183		44497745	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22+,28-/m1/s1	MPJVZFHLUPPQBG-DCRAHPAHSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K70530990	BRD-K70530990-001-01-6	Broad Institute of MIT and Harvard	BRD-K70530990			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22+,28-/m1/s1	MPJVZFHLUPPQBG-DCRAHPAHSA-N	577.282171436							104820
BRD-K75853175	LSM-16184		54614899	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33-/m0/s1	LFCBJIZGBQWHQM-KIAQLKRMSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K75853175	BRD-K75853175-001-01-4	Broad Institute of MIT and Harvard	BRD-K75853175			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33-/m0/s1	LFCBJIZGBQWHQM-KIAQLKRMSA-N	602.346820612							104821
BRD-K73841784	LSM-16185		44491512	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22-,29+/m0/s1	BFYBBBSDVFDXJC-CROAMNIPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	BroadT	BRD-K73841784	BRD-K73841784-001-01-4	Broad Institute of MIT and Harvard	BRD-K73841784			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22-,29+/m0/s1	BFYBBBSDVFDXJC-CROAMNIPSA-N	584.320999788							104822
BRD-K77869482	LSM-16186		44495473	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19-,20-,26+/m0/s1	YDWJBUOXSRVMJV-XNCCSTQDSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C1=O	BroadT	BRD-K77869482	BRD-K77869482-001-01-6	Broad Institute of MIT and Harvard	BRD-K77869482			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19-,20-,26+/m0/s1	YDWJBUOXSRVMJV-XNCCSTQDSA-N	559.33698421							104823
BRD-K69834831	LSM-16187		44497306	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23-,29-/m1/s1	AGSKCAQZMPMVIM-PZNASWHRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K69834831	BRD-K69834831-001-01-8	Broad Institute of MIT and Harvard	BRD-K69834831			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23-,29-/m1/s1	AGSKCAQZMPMVIM-PZNASWHRSA-N	572.33739878							104824
BRD-K68618340	LSM-16188		44618813	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m0/s1	XEPWKRSQLBTXFU-WYNJNVBPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K68618340	BRD-K68618340-001-01-0	Broad Institute of MIT and Harvard	BRD-K68618340			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m0/s1	XEPWKRSQLBTXFU-WYNJNVBPSA-N	595.329121628							104825
BRD-K74103290	LSM-16189		44485786	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19-,20+,24-/m1/s1	LBVOXJOHMPITGR-MTXNFPGFSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K74103290	BRD-K74103290-001-01-5	Broad Institute of MIT and Harvard	BRD-K74103290			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19-,20+,24-/m1/s1	LBVOXJOHMPITGR-MTXNFPGFSA-N	609.269556004							104826
BRD-K59220177-001-01-4	LSM-16190	BRD-K59220177	44618923	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22-,23+,30+/m0/s1	KQLDLPDWVHVVHP-CXDLDTBJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K59220177	BRD-K59220177-001-01-4	Broad Institute of MIT and Harvard	BRD-K59220177			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22-,23+,30+/m0/s1	KQLDLPDWVHVVHP-CXDLDTBJSA-N	619.29273612							104827
BRD-K68544484	LSM-16191		44494988	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28+/m0/s1	GOBHPVUGCFRQAG-SXKDZKFMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	BroadT	BRD-K68544484	BRD-K68544484-001-01-4	Broad Institute of MIT and Harvard	BRD-K68544484			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28+/m0/s1	GOBHPVUGCFRQAG-SXKDZKFMSA-N	595.248284494							104828
BRD-K62964360	LSM-16192		54614860	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23+,28-/m1/s1	DKJIIKWCTXJSNY-YFUNBVQMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K62964360	BRD-K62964360-001-01-9	Broad Institute of MIT and Harvard	BRD-K62964360			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23+,28-/m1/s1	DKJIIKWCTXJSNY-YFUNBVQMSA-N	561.287256816							104829
BRD-K65729622	LSM-16193		54614870	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25-,30-/m1/s1	ZGCRSIABJPRXFC-SFOWLQBLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K65729622	BRD-K65729622-001-01-7	Broad Institute of MIT and Harvard	BRD-K65729622			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25-,30-/m1/s1	ZGCRSIABJPRXFC-SFOWLQBLSA-N	553.351571634							104830
CHEMBL2359989	LSM-16194	BRD-K59385073	44616981	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33-/m1/s1	NGSMHOKAGHIENU-GLPSKGHJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K59385073	BRD-K59385073-001-01-0	Broad Institute of MIT and Harvard	BRD-K59385073			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33-/m1/s1	NGSMHOKAGHIENU-GLPSKGHJSA-N	623.404669846001							104831
BRD-K61623863	LSM-16195		54614851	InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24+,25-,30-/m0/s1	DPWBPPWCHVQSHF-SODQHWRNSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K61623863	BRD-K61623863-001-01-4	Broad Institute of MIT and Harvard	BRD-K61623863			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24+,25-,30-/m0/s1	DPWBPPWCHVQSHF-SODQHWRNSA-N	553.351571634							104832
BRD-K69532760	LSM-16196		44489844	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20-,21-,25-/m0/s1	IUWUHICBQVKRRR-UKDJSQQHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K69532760	BRD-K69532760-001-01-3	Broad Institute of MIT and Harvard	BRD-K69532760			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20-,21-,25-/m0/s1	IUWUHICBQVKRRR-UKDJSQQHSA-N	559.323306138							104833
BRD-K65404805-001-01-6	LSM-6784	BRD-K65404805, BRD4805	44607850	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24-,31+/m1/s1	WIYHORLWMFSPCL-WDCHQWTNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K65404805	BRD-K65404805-001-01-6	Broad Institute of MIT and Harvard	BRD-K65404805			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24-,31+/m1/s1	WIYHORLWMFSPCL-WDCHQWTNSA-N	569.346486254							95405
BRD-K63299476	LSM-16197		44495980	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28-/m1/s1	SCSZUZCJLHTTSJ-JTNFPWQOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K63299476	BRD-K63299476-001-01-0	Broad Institute of MIT and Harvard	BRD-K63299476			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28-/m1/s1	SCSZUZCJLHTTSJ-JTNFPWQOSA-N	589.282171436							104834
BRD-K68178119	LSM-16198		44496441	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22+,23-,27-/m0/s1	MTZUJVYQNWSRMQ-GIRPNKPCSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K68178119	BRD-K68178119-001-01-4	Broad Institute of MIT and Harvard	BRD-K68178119			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22+,23-,27-/m0/s1	MTZUJVYQNWSRMQ-GIRPNKPCSA-N	598.34002067							104835
BRD-K71240454	LSM-15050		44485809	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28-/m1/s1	VTJNXDUZLOWMHH-TZTMDHJLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K71240454	BRD-K71240454-001-01-0	Broad Institute of MIT and Harvard	BRD-K71240454			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28-/m1/s1	VTJNXDUZLOWMHH-TZTMDHJLSA-N	531.367221698							103706
BRD-K72681425	LSM-16199		44500872	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24+,25+,30-/m0/s1	HYZLHQOJAWWHRH-RPQPUBLWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K72681425	BRD-K72681425-001-01-0	Broad Institute of MIT and Harvard	BRD-K72681425			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24+,25+,30-/m0/s1	HYZLHQOJAWWHRH-RPQPUBLWSA-N	589.318556944							104836
BRD-K65598127	LSM-16200		44493652	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23-,24-,31-/m1/s1	DSXVWRRZDLHRDJ-FFBJJBDJSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K65598127	BRD-K65598127-001-01-6	Broad Institute of MIT and Harvard	BRD-K65598127			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23-,24-,31-/m1/s1	DSXVWRRZDLHRDJ-FFBJJBDJSA-N	576.331170548							104837
BRD-K76492619	LSM-16201		44494143	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19+,23-/m1/s1	AHFPIWRBAUHSCU-CROMWVBPSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K76492619	BRD-K76492619-001-01-4	Broad Institute of MIT and Harvard	BRD-K76492619			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19+,23-/m1/s1	AHFPIWRBAUHSCU-CROMWVBPSA-N	435.309706822							104838
BRD-K65291993	LSM-16202		54614867	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23+,27-/m0/s1	XJLXIOLTLBOFKC-MTPWMDRRSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K65291993	BRD-K65291993-001-01-9	Broad Institute of MIT and Harvard	BRD-K65291993			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23+,27-/m0/s1	XJLXIOLTLBOFKC-MTPWMDRRSA-N	598.34002067							104839
BRD-K76680796	LSM-16203		44502457	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29+/m0/s1	IMDGVULVCKQBDZ-CMSZEEODSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K76680796	BRD-K76680796-001-01-9	Broad Institute of MIT and Harvard	BRD-K76680796			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29+/m0/s1	IMDGVULVCKQBDZ-CMSZEEODSA-N	539.33592157							104840
BRD-K74879991	LSM-16204		44494963	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32+/m0/s1	LKIIRWUIYHEPDR-PXSDZQOHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K74879991	BRD-K74879991-001-01-2	Broad Institute of MIT and Harvard	BRD-K74879991			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32+/m0/s1	LKIIRWUIYHEPDR-PXSDZQOHSA-N	622.37303536							104841
BRD-K62000282	LSM-16205		44620301	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28+/m0/s1	XEPWKRSQLBTXFU-HIAVRWOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K62000282	BRD-K62000282-001-01-7	Broad Institute of MIT and Harvard	BRD-K62000282			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28+/m0/s1	XEPWKRSQLBTXFU-HIAVRWOZSA-N	595.329121628							104842
BRD-K77181307	LSM-16206		44485141	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24-,29+/m0/s1	SEDRIVHSDUVLLE-HNFJUSDZSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K77181307	BRD-K77181307-001-01-9	Broad Institute of MIT and Harvard	BRD-K77181307			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24-,29+/m0/s1	SEDRIVHSDUVLLE-HNFJUSDZSA-N	597.352634274							104843
BRD-K70856965	LSM-16207		44620295	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23-,28+/m0/s1	DKJIIKWCTXJSNY-KKQCDPINSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K70856965	BRD-K70856965-001-01-6	Broad Institute of MIT and Harvard	BRD-K70856965			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23-,28+/m0/s1	DKJIIKWCTXJSNY-KKQCDPINSA-N	561.287256816							104844
BRD-K74129999	LSM-16208		44619574	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19-,23+/m1/s1	QBUCHBBMZJBUJI-KCESLBEFSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K74129999	BRD-K74129999-001-01-4	Broad Institute of MIT and Harvard	BRD-K74129999			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19-,23+/m1/s1	QBUCHBBMZJBUJI-KCESLBEFSA-N	531.29200601							104845
BRD-K73025859	LSM-16209		44494415	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22+,28-/m0/s1	GMYAYTAKTSTYEI-WBJWTPEXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	BroadT	BRD-K73025859	BRD-K73025859-001-01-4	Broad Institute of MIT and Harvard	BRD-K73025859			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22+,28-/m0/s1	GMYAYTAKTSTYEI-WBJWTPEXSA-N	608.318555116							104846
BRD-K75453159	LSM-16210		44492106	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21-,22-,29-/m1/s1	BFYBBBSDVFDXJC-IBSJXXAUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	BroadT	BRD-K75453159	BRD-K75453159-001-01-3	Broad Institute of MIT and Harvard	BRD-K75453159			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21-,22-,29-/m1/s1	BFYBBBSDVFDXJC-IBSJXXAUSA-N	584.320999788							104847
BRD-K77987907	LSM-16211		54614906	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25-,30+/m0/s1	DXYWKCBATINIRK-DNHJLFCISA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K77987907	BRD-K77987907-001-01-3	Broad Institute of MIT and Harvard	BRD-K77987907			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25-,30+/m0/s1	DXYWKCBATINIRK-DNHJLFCISA-N	596.357385296							104848
BRD-K63998843	LSM-16212		44619623	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33-/m0/s1	LFCBJIZGBQWHQM-IULAASEQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K63998843	BRD-K63998843-001-01-3	Broad Institute of MIT and Harvard	BRD-K63998843			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33-/m0/s1	LFCBJIZGBQWHQM-IULAASEQSA-N	602.346820612							104849
BRD-K71452779	LSM-16213		54614884	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29+/m0/s1	YZLWJGCKUGDXHR-HNFJUSDZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K71452779	BRD-K71452779-001-01-9	Broad Institute of MIT and Harvard	BRD-K71452779			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29+/m0/s1	YZLWJGCKUGDXHR-HNFJUSDZSA-N	560.393770804							104850
BRD-K67229323	LSM-16214		44619017	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20+,21-,27-/m0/s1	JTLOVMZMVDHICP-WFQVPWNOSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K67229323	BRD-K67229323-001-01-8	Broad Institute of MIT and Harvard	BRD-K67229323			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20+,21-,27-/m0/s1	JTLOVMZMVDHICP-WFQVPWNOSA-N	594.302905052							104851
BRD-K70289438	LSM-16215		44488745	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28-/m0/s1	VTJNXDUZLOWMHH-AMZZYFJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K70289438	BRD-K70289438-001-01-9	Broad Institute of MIT and Harvard	BRD-K70289438			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28-/m0/s1	VTJNXDUZLOWMHH-AMZZYFJHSA-N	531.367221698							104852
BRD-K75186244	LSM-16216		54614896	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20+,24+/m0/s1	ORDOAKKGIRZCMJ-PWSZPPJVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K75186244	BRD-K75186244-001-01-6	Broad Institute of MIT and Harvard	BRD-K75186244			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20+,24+/m0/s1	ORDOAKKGIRZCMJ-PWSZPPJVSA-N	513.287256816							104853
BRD-K71177762	LSM-16217		44619761	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29-/m0/s1	XPIAMQJKSFNCJS-MVPDCNEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K71177762	BRD-K71177762-001-01-1	Broad Institute of MIT and Harvard	BRD-K71177762			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29-/m0/s1	XPIAMQJKSFNCJS-MVPDCNEZSA-N	603.2978215							104854
BRD-K64075179	LSM-16218		44620274	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28-/m1/s1	KDWFAOIYLGHTDK-BUUPBASBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	BroadT	BRD-K64075179	BRD-K64075179-001-01-3	Broad Institute of MIT and Harvard	BRD-K64075179			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28-/m1/s1	KDWFAOIYLGHTDK-BUUPBASBSA-N	579.277834984							104855
BRD-K64567083	LSM-16219		54614865	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25-,26-,32+/m1/s1	IJPCFLZWEMVLEC-ZYMMPZCLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C1=O	BroadT	BRD-K64567083	BRD-K64567083-001-01-4	Broad Institute of MIT and Harvard	BRD-K64567083			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25-,26-,32+/m1/s1	IJPCFLZWEMVLEC-ZYMMPZCLSA-N	615.334207008							104856
BRD-K71801719	LSM-16220		44493593	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29-/m1/s1	GPFIDTWNGXWRJK-CAFXQFFASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K71801719	BRD-K71801719-001-01-0	Broad Institute of MIT and Harvard	BRD-K71801719			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29-/m1/s1	GPFIDTWNGXWRJK-CAFXQFFASA-N	575.30290688							104857
BRD-K72098698	LSM-16221		44489848	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20-,24-/m0/s1	JFWSYQFTTWMPPF-XHOYROJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K72098698	BRD-K72098698-001-01-7	Broad Institute of MIT and Harvard	BRD-K72098698			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20-,24-/m0/s1	JFWSYQFTTWMPPF-XHOYROJHSA-N	545.307656074							104858
BRD-K68635551	LSM-16222		44620433	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25-,26+,32-/m1/s1	JCVAFPCEYZSYDX-UOJGMACNSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K68635551	BRD-K68635551-001-01-8	Broad Institute of MIT and Harvard	BRD-K68635551			COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25-,26+,32-/m1/s1	JCVAFPCEYZSYDX-UOJGMACNSA-N	612.388685424							104859
BRD-K75985122	LSM-16223		54614900	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24-,29-/m0/s1	CWMFJYTZROJEEY-UITIVDIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K75985122	BRD-K75985122-001-01-8	Broad Institute of MIT and Harvard	BRD-K75985122			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24-,29-/m0/s1	CWMFJYTZROJEEY-UITIVDIESA-N	622.33420518							104860
BRD-K77203880	LSM-16224		44488206	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m1/s1	LQSMEYMBJWSEPC-JTNFPWQOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K77203880	BRD-K77203880-001-01-6	Broad Institute of MIT and Harvard	BRD-K77203880			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m1/s1	LQSMEYMBJWSEPC-JTNFPWQOSA-N	525.320271506							104861
BRD-K75688032	LSM-16225		44493147	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19-,23+/m0/s1	AHFPIWRBAUHSCU-KEXUJGGDSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K75688032	BRD-K75688032-001-01-7	Broad Institute of MIT and Harvard	BRD-K75688032			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19-,23+/m0/s1	AHFPIWRBAUHSCU-KEXUJGGDSA-N	435.309706822							104862
MLS003128681	LSM-12649	BRD-K69206710, SID99358931	44490276	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20+,21+,25-/m0/s1	IUWUHICBQVKRRR-SMTRIPRVSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K69206710	BRD-K69206710-001-01-5	Broad Institute of MIT and Harvard	BRD-K69206710			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20+,21+,25-/m0/s1	IUWUHICBQVKRRR-SMTRIPRVSA-N	559.323306138							101283
BRD-K64577478	LSM-16226		44501142	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20+,21+,27+/m0/s1	JTLOVMZMVDHICP-ZAACQVCWSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K64577478	BRD-K64577478-001-01-6	Broad Institute of MIT and Harvard	BRD-K64577478			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20+,21+,27+/m0/s1	JTLOVMZMVDHICP-ZAACQVCWSA-N	594.302905052							104863
BRD-K76005220	LSM-15054		44487007	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26+,33-/m1/s1	UBYZDEGPUXBRQE-PHAQOQMTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K76005220	BRD-K76005220-001-01-5	Broad Institute of MIT and Harvard	BRD-K76005220			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26+,33-/m1/s1	UBYZDEGPUXBRQE-PHAQOQMTSA-N	604.362470676							103710
BRD-K69515345	LSM-16227		54614877	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26-,27-,32+/m1/s1	ZMTJRORPEDZKCY-XLXCLFHOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K69515345	BRD-K69515345-001-01-2	Broad Institute of MIT and Harvard	BRD-K69515345			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26-,27-,32+/m1/s1	ZMTJRORPEDZKCY-XLXCLFHOSA-N	624.388685424							104864
BRD-K78015598	LSM-16228		44490945	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22-,23+,28+/m1/s1	GAZXHMFIMHCKKU-DHMIZTNRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K78015598	BRD-K78015598-001-01-6	Broad Institute of MIT and Harvard	BRD-K78015598			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22-,23+,28+/m1/s1	GAZXHMFIMHCKKU-DHMIZTNRSA-N	576.298155858							104865
BRD-K73114074	LSM-16229		44489713	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25+,26+,31+/m0/s1	SIHQACFNVCTPOW-BCVXLEMTSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K73114074	BRD-K73114074-001-01-5	Broad Institute of MIT and Harvard	BRD-K73114074			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25+,26+,31+/m0/s1	SIHQACFNVCTPOW-BCVXLEMTSA-N	582.37812074							104866
BRD-K77407030	LSM-16230		44489858	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22+,26-/m0/s1	ANVCKVJMNHXGBG-IFOBJOEFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K77407030	BRD-K77407030-001-01-2	Broad Institute of MIT and Harvard	BRD-K77407030			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22+,26-/m0/s1	ANVCKVJMNHXGBG-IFOBJOEFSA-N	581.259327506							104867
BRD-K61934967	LSM-16231		54614854	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29-/m0/s1	LZRQCLPDICKWHD-VCTIXIOLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K61934967	BRD-K61934967-001-01-0	Broad Institute of MIT and Harvard	BRD-K61934967			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29-/m0/s1	LZRQCLPDICKWHD-VCTIXIOLSA-N	609.263934558							104868
BRD-K78337983	LSM-16232		44618154	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21-,22+,26-/m1/s1	KFCLPYACNRFGCM-ZUVQJFRASA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K78337983	BRD-K78337983-001-01-7	Broad Institute of MIT and Harvard	BRD-K78337983			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21-,22+,26-/m1/s1	KFCLPYACNRFGCM-ZUVQJFRASA-N	477.356657014							104869
BRD-K65733046	LSM-16233		44617130	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28+/m0/s1	XHZKQAVNDGMQPU-KKQCDPINSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K65733046	BRD-K65733046-001-01-7	Broad Institute of MIT and Harvard	BRD-K65733046			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28+/m0/s1	XHZKQAVNDGMQPU-KKQCDPINSA-N	589.282171436							104870
BRD-K73637411	LSM-16234		44494547	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24+,29+/m1/s1	ZQLCRBSTGDSWQO-MSCBGTKOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K73637411	BRD-K73637411-001-01-7	Broad Institute of MIT and Harvard	BRD-K73637411			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24+,29+/m1/s1	ZQLCRBSTGDSWQO-MSCBGTKOSA-N	526.351905992							104871
BRD-K72255288	LSM-16235		44501111	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23+,24+,30-/m0/s1	YDCDOYMHDVYTIM-YTNVWYNJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K72255288	BRD-K72255288-001-01-9	Broad Institute of MIT and Harvard	BRD-K72255288			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23+,24+,30-/m0/s1	YDCDOYMHDVYTIM-YTNVWYNJSA-N	566.346820612							131238
BRD-K69342591	LSM-16236		44497730	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24+,29-/m0/s1	YZLWJGCKUGDXHR-OODISRMCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K69342591	BRD-K69342591-001-01-2	Broad Institute of MIT and Harvard	BRD-K69342591			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24+,29-/m0/s1	YZLWJGCKUGDXHR-OODISRMCSA-N	560.393770804							104874
BRD-K59324446	LSM-16237		44617450	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23-,29+/m1/s1	QSYAMXVABCSWEP-MBWUYLOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K59324446	BRD-K59324446-001-01-9	Broad Institute of MIT and Harvard	BRD-K59324446			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23-,29+/m1/s1	QSYAMXVABCSWEP-MBWUYLOXSA-N	622.33420518							104875
MLS000053561	LSM-15529	BRD-A12973049	2998828	InChI=1S/C17H34N6O2S/c1-4-15(21(2)3)16-19-20-17(26-14-6-18-5-11-24)23(16)8-7-22-9-12-25-13-10-22/h15,18,24H,4-14H2,1-3H3	UGVAQPSDWKEPHE-UHFFFAOYSA-N	CCC(N(C)C)c1nnc(SCCNCCO)n1CCN2CCOCC2	BroadT	BRD-A12973049	BRD-A12973049-034-03-9	Enamine Ltd.	T5235408		OC(=O)C(=O)O	CCC(N(C)C)c1nnc(SCCNCCO)n1CCN1CCOCC1.OC(=O)C(=O)O	InChI=1S/C17H34N6O2S.C2H2O4/c1-4-15(21(2)3)16-19-20-17(26-14-6-18-5-11-24)23(16)8-7-22-9-12-25-13-10-22;3-1(4)2(5)6/h15,18,24H,4-14H2,1-3H3;(H,3,4)(H,5,6)	ZONGEOMRPHGXGK-UHFFFAOYSA-N	386.246395078							104165, 104165
SMR000092448	LSM-16238	SID26670595, SID7966460, BRD-K29755988	3585809	InChI=1S/C19H18N4O3S/c1-12-15(14-6-2-3-7-16(14)21-12)9-18-22-23-19(26-18)27-11-17(24)20-10-13-5-4-8-25-13/h2-8,21H,9-11H2,1H3,(H,20,24)	DGFNGSMGHPFNGO-UHFFFAOYSA-N	Cc1[nH]c2ccccc2c1Cc3oc(SCC(=O)NCc4occc4)nn3	BroadT	BRD-K29755988	BRD-K29755988-001-04-9	ChemDiv Inc.	6516-0006			Cc1[nH]c2ccccc2c1Cc1nnc(SCC(=O)NCc2ccco2)o1	InChI=1S/C19H18N4O3S/c1-12-15(14-6-2-3-7-16(14)21-12)9-18-22-23-19(26-18)27-11-17(24)20-10-13-5-4-8-25-13/h2-8,21H,9-11H2,1H3,(H,20,24)	DGFNGSMGHPFNGO-UHFFFAOYSA-N	382.109961166							104876
AC1M69G5	LSM-16239	BRD-K40926874	2368895	InChI=1S/C15H18N4O2S2/c1-21-15(20)18-16-10-12-13(11-6-5-9-22-11)17-14(23-12)19-7-3-2-4-8-19/h5-6,9-10H,2-4,7-8H2,1H3,(H,18,20)	AHMXJQJRAOUDND-UHFFFAOYSA-N	COC(=O)NN=Cc1sc(nc1c2cccs2)N3CCCCC3	BroadT	BRD-K40926874	BRD-K40926874-001-06-3	Enamine Ltd.	T0516-8436			COC(=O)NN=Cc1sc(nc1-c1cccs1)N1CCCCC1	InChI=1S/C15H18N4O2S2/c1-21-15(20)18-16-10-12-13(11-6-5-9-22-11)17-14(23-12)19-7-3-2-4-8-19/h5-6,9-10H,2-4,7-8H2,1H3,(H,18,20)	AHMXJQJRAOUDND-UHFFFAOYSA-N	350.087117236							104877
52505-56-3	LSM-16240	SID7975102, BRD-K51169528	334460	InChI=1S/C12H14N2O2S/c1-4-16-12(15)10-9(13)8-6(2)5-7(3)14-11(8)17-10/h5H,4,13H2,1-3H3	NUXMTIQMQARQAV-UHFFFAOYSA-N	CCOC(=O)c1sc2nc(C)cc(C)c2c1N	BroadT	BRD-K51169528	BRD-K51169528-001-05-8	ChemBridge Corporation	5274980			CCOC(=O)c1sc2nc(C)cc(C)c2c1N	InChI=1S/C12H14N2O2S/c1-4-16-12(15)10-9(13)8-6(2)5-7(3)14-11(8)17-10/h5H,4,13H2,1-3H3	NUXMTIQMQARQAV-UHFFFAOYSA-N	250.077598398							104878
STK569255	LSM-16241	SID17504488, SID24276625, BRD-A74918211	3285260	InChI=1S/C20H15F3N4O5S/c1-11-7-9-13(10-8-11)33(31,32)26-19(20(21,22)23)14-15(24-17(19)29)27(18(30)25-16(14)28)12-5-3-2-4-6-12/h2-10,26H,1H3,(H,24,29)(H,25,28,30)	QQFCYVYDRISIAF-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NC2(C(=O)NC3=C2C(=O)NC(=O)N3c4ccccc4)C(F)(F)F	BroadT	BRD-A74918211	BRD-A74918211-001-05-5	InterBioScreen Ltd.	STOCK4S-38125			Cc1ccc(cc1)S(=O)(=O)NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2-c1ccccc1)C(F)(F)F	InChI=1S/C20H15F3N4O5S/c1-11-7-9-13(10-8-11)33(31,32)26-19(20(21,22)23)14-15(24-17(19)29)27(18(30)25-16(14)28)12-5-3-2-4-6-12/h2-10,26H,1H3,(H,24,29)(H,25,28,30)	QQFCYVYDRISIAF-UHFFFAOYSA-N	480.07152491							104879
T0512-1130	LSM-16242	SID17516431, BRD-K94764040	1536916	InChI=1S/C20H14N4S/c1-13-6-8-14(9-7-13)15-10-25-20-18(15)19(21-11-22-20)24-12-23-16-4-2-3-5-17(16)24/h2-12H,1H3	KLSWQJCVHWEYCW-UHFFFAOYSA-N	Cc1ccc(cc1)c2csc3ncnc(c23)n4cnc5ccccc45	BroadT	BRD-K94764040	BRD-K94764040-001-06-2	Enamine Ltd.	T0512-1130			Cc1ccc(cc1)-c1csc2ncnc(-n3cnc4ccccc34)c12	InChI=1S/C20H14N4S/c1-13-6-8-14(9-7-13)15-10-25-20-18(15)19(21-11-22-20)24-12-23-16-4-2-3-5-17(16)24/h2-12H,1H3	KLSWQJCVHWEYCW-UHFFFAOYSA-N	342.093917178							104880
MLS000559030	LSM-16243	SID104219392, SID17401602, BRD-K70677790	1959044	InChI=1S/C18H12FN3O2S/c19-11-4-1-2-5-12(11)21-17(23)16-15(20)10-7-8-13(22-18(10)25-16)14-6-3-9-24-14/h1-9H,20H2,(H,21,23)	JOSKENMQKDTLKM-UHFFFAOYSA-N	Nc1c(sc2nc(ccc12)c3occc3)C(=O)Nc4ccccc4F	BroadT	BRD-K70677790	BRD-K70677790-001-05-8	InterBioScreen Ltd.	STOCK5S-53632			Nc1c(sc2nc(ccc12)-c1ccco1)C(=O)Nc1ccccc1F	InChI=1S/C18H12FN3O2S/c19-11-4-1-2-5-12(11)21-17(23)16-15(20)10-7-8-13(22-18(10)25-16)14-6-3-9-24-14/h1-9H,20H2,(H,21,23)	JOSKENMQKDTLKM-UHFFFAOYSA-N	353.063425544							104881
MLS000879883	LSM-16244	SID24840410, SID3716235, BRD-K79851967	2316653	InChI=1S/C17H7Cl3N6O2S2/c18-8-1-2-9(21-7-8)26(14(27)10-12(19)22-16-24(10)3-5-29-16)15(28)11-13(20)23-17-25(11)4-6-30-17/h1-7H	QIKABAMNVDMLJH-UHFFFAOYSA-N	Clc1ccc(nc1)N(C(=O)c2c(Cl)nc3sccn23)C(=O)c4c(Cl)nc5sccn45	BroadT	BRD-K79851967	BRD-K79851967-001-05-7	Enamine Ltd.	T0503-2566			Clc1nc2sccn2c1C(=O)N(C(=O)c1c(Cl)nc2sccn12)c1ccc(Cl)cn1	InChI=1S/C17H7Cl3N6O2S2/c18-8-1-2-9(21-7-8)26(14(27)10-12(19)22-16-24(10)3-5-29-16)15(28)11-13(20)23-17-25(11)4-6-30-17/h1-7H	QIKABAMNVDMLJH-UHFFFAOYSA-N	495.913748034							104882
SMR000060422	LSM-16245	SID3715909, BRD-K74329576	2311632	InChI=1S/C20H16N4OS/c25-20(22-13-15-6-4-10-21-12-15)17-14-24(16-7-2-1-3-8-16)23-19(17)18-9-5-11-26-18/h1-12,14H,13H2,(H,22,25)	WCGGCAPGLNZRIM-UHFFFAOYSA-N	O=C(NCc1cccnc1)c2cn(nc2c3cccs3)c4ccccc4	BroadT	BRD-K74329576	BRD-K74329576-001-05-2	Enamine Ltd.	T0502-6623			O=C(NCc1cccnc1)c1cn(nc1-c1cccs1)-c1ccccc1	InChI=1S/C20H16N4OS/c25-20(22-13-15-6-4-10-21-12-15)17-14-24(16-7-2-1-3-8-16)23-19(17)18-9-5-11-26-18/h1-12,14H,13H2,(H,22,25)	WCGGCAPGLNZRIM-UHFFFAOYSA-N	360.104481862							104883
ST031758	LSM-43630	SID17507394, BRD-K23414129	5394341	InChI=1S/C18H15NO5/c1-22-18(21)13-3-2-4-14(10-13)19-17(20)8-6-12-5-7-15-16(9-12)24-11-23-15/h2-10H,11H2,1H3,(H,19,20)/b8-6+	ZTYDZGHYQBIQRV-SOFGYWHQSA-N	COC(=O)c1cccc(NC(=O)\C=C\c2ccc3OCOc3c2)c1	BroadT	BRD-K23414129	BRD-K23414129-001-07-2	Asinex Ltd.	BAS 00568932			COC(=O)c1cccc(NC(=O)\C=C\c2ccc3OCOc3c2)c1	InChI=1S/C18H15NO5/c1-22-18(21)13-3-2-4-14(10-13)19-17(20)8-6-12-5-7-15-16(9-12)24-11-23-15/h2-10H,11H2,1H3,(H,19,20)/b8-6+	ZTYDZGHYQBIQRV-SOFGYWHQSA-N	325.09502259							
T0501-4707	LSM-43631	SID17516586, BRD-K14096728	12006243	InChI=1S/C29H37N3O5/c1-31(2)23-11-9-20(10-12-23)17-21-7-6-8-24(27(21)32-13-15-37-16-14-32)29(33)30-22-18-25(34-3)28(36-5)26(19-22)35-4/h9-12,17-19H,6-8,13-16H2,1-5H3,(H,30,33)/b21-17-	ZCQLDWFUUYNVRY-FXBPSFAMSA-N	COc1cc(NC(=O)C2=C(N3CCOCC3)\C(=C/c4ccc(cc4)N(C)C)\CCC2)cc(OC)c1OC	BroadT	BRD-K14096728	BRD-K14096728-001-05-7	Enamine Ltd.	T0501-4707			COc1cc(NC(=O)C2=C(N3CCOCC3)\C(CCC2)=C/c2ccc(cc2)N(C)C)cc(OC)c1OC	InChI=1S/C29H37N3O5/c1-31(2)23-11-9-20(10-12-23)17-21-7-6-8-24(27(21)32-13-15-37-16-14-32)29(33)30-22-18-25(34-3)28(36-5)26(19-22)35-4/h9-12,17-19H,6-8,13-16H2,1-5H3,(H,30,33)/b21-17-	ZCQLDWFUUYNVRY-FXBPSFAMSA-N	507.273321314							
MLS000672321	LSM-16248	SID24789266, BRD-A51278647	2966902	InChI=1S/C17H19N3OS/c1-2-3-8-19-16(21)15-9-12-11-6-4-5-7-13(11)18-14(12)10-20(15)17(19)22/h4-7,15,18H,2-3,8-10H2,1H3	DIMYFVJBNJDTGT-UHFFFAOYSA-N	CCCCN1C(=O)C2Cc3c(CN2C1=S)[nH]c4ccccc34	BroadT	BRD-A51278647	BRD-A51278647-001-06-3	ChemBridge Corporation	7928870			CCCCN1C(=O)C2Cc3c(CN2C1=S)[nH]c1ccccc31	InChI=1S/C17H19N3OS/c1-2-3-8-19-16(21)15-9-12-11-6-4-5-7-13(11)18-14(12)10-20(15)17(19)22/h4-7,15,18H,2-3,8-10H2,1H3	DIMYFVJBNJDTGT-UHFFFAOYSA-N	313.124882948							104886
2-(2,4-Dimethyl-phenylamino)-n-thiophen-2-ylmethyl-nicotinamide	LSM-16249	SID17408903, BRD-K15150038	1441127	InChI=1S/C19H19N3OS/c1-13-7-8-17(14(2)11-13)22-18-16(6-3-9-20-18)19(23)21-12-15-5-4-10-24-15/h3-11H,12H2,1-2H3,(H,20,22)(H,21,23)	MNUHKAJKYNRNSN-UHFFFAOYSA-N	Cc1ccc(Nc2ncccc2C(=O)NCc3cccs3)c(C)c1	BroadT	BRD-K15150038	BRD-K15150038-001-05-6	Asinex Ltd.	ASN 04892413			Cc1ccc(Nc2ncccc2C(=O)NCc2cccs2)c(C)c1	InChI=1S/C19H19N3OS/c1-13-7-8-17(14(2)11-13)22-18-16(6-3-9-20-18)19(23)21-12-15-5-4-10-24-15/h3-11H,12H2,1-2H3,(H,20,22)(H,21,23)	MNUHKAJKYNRNSN-UHFFFAOYSA-N	337.124882948							104887
BAS 01026949	LSM-16250	SID24802726, BRD-K87311322	838327	InChI=1S/C13H15N3O/c14-16-13(17)8-5-6-12-10(7-8)9-3-1-2-4-11(9)15-12/h5-7,15H,1-4,14H2,(H,16,17)	WMOBXLDPECZNAT-UHFFFAOYSA-N	NNC(=O)c1ccc2[nH]c3CCCCc3c2c1	BroadT	BRD-K87311322	BRD-K87311322-001-05-2	Asinex Ltd.	BAS 01026949			NNC(=O)c1ccc2[nH]c3CCCCc3c2c1	InChI=1S/C13H15N3O/c14-16-13(17)8-5-6-12-10(7-8)9-3-1-2-4-11(9)15-12/h5-7,15H,1-4,14H2,(H,16,17)	WMOBXLDPECZNAT-UHFFFAOYSA-N	229.12151213							104888
MLS000417134	LSM-16251	SID22409343, BRD-K21360345	4780145	InChI=1S/C17H18ClN3O3/c1-24-17-5-3-2-4-16(17)20-10-8-19(9-11-20)15-7-6-13(21(22)23)12-14(15)18/h2-7,12H,8-11H2,1H3	APGNCGQMAUPNGB-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)c3ccc(cc3Cl)[N+](=O)[O-]	BroadT	BRD-K21360345	BRD-K21360345-001-05-1	Enamine Ltd.	T5343767			COc1ccccc1N1CCN(CC1)c1ccc(cc1Cl)[N+]([O-])=O	InChI=1S/C17H18ClN3O3/c1-24-17-5-3-2-4-16(17)20-10-8-19(9-11-20)15-7-6-13(21(22)23)12-14(15)18/h2-7,12H,8-11H2,1H3	APGNCGQMAUPNGB-UHFFFAOYSA-N	347.103669176							104889
ZINC00275365	LSM-16252	BRD-K74297649	6742676	InChI=1S/C13H13N3O/c1-10-4-2-5-11(8-10)13(17)16-15-9-12-6-3-7-14-12/h2-9,14H,1H3,(H,16,17)	CTNHJYTWFQEUQJ-UHFFFAOYSA-N	Cc1cccc(c1)C(=O)NN=Cc2ccc[nH]2	BroadT	BRD-K74297649	BRD-K74297649-001-05-4	Specs	AN-329/09958061			Cc1cccc(c1)C(=O)NN=Cc1ccc[nH]1	InChI=1S/C13H13N3O/c1-10-4-2-5-11(8-10)13(17)16-15-9-12-6-3-7-14-12/h2-9,14H,1H3,(H,16,17)	CTNHJYTWFQEUQJ-UHFFFAOYSA-N	227.105862066							
MLS001203017	LSM-16253	SID49641363, BRD-K43122750	2218056	InChI=1S/C20H15N3O7S/c24-19(21-15-6-1-5-14(10-15)20(25)26)13-4-2-9-18(11-13)31(29,30)22-16-7-3-8-17(12-16)23(27)28/h1-12,22H,(H,21,24)(H,25,26)	KVIDPPSHOHBRAO-UHFFFAOYSA-N	OC(=O)c1cccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3cccc(c3)[N+](=O)[O-])c1	BroadT	BRD-K43122750	BRD-K43122750-001-07-3	Asinex Ltd.	BAS 00086769			OC(=O)c1cccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc2cccc(c2)[N+]([O-])=O)c1	InChI=1S/C20H15N3O7S/c24-19(21-15-6-1-5-14(10-15)20(25)26)13-4-2-9-18(11-13)31(29,30)22-16-7-3-8-17(12-16)23(27)28/h1-12,22H,(H,21,24)(H,25,26)	KVIDPPSHOHBRAO-UHFFFAOYSA-N	441.06307054							104891
AN-329/42607803	LSM-16254	SID17386532, BRD-K71404746	1791737	InChI=1S/C19H21N3O2S/c1-13(2)12-17(23)22-19(25)21-16-11-7-6-10-15(16)18(24)20-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,20,24)(H2,21,22,23,25)	AVEPIRUGHKMVQU-UHFFFAOYSA-N	CC(C)CC(=O)NC(=S)Nc1ccccc1C(=O)Nc2ccccc2	BroadT	BRD-K71404746	BRD-K71404746-001-05-1	Specs	AN-329/42607803			CC(C)CC(=O)NC(=S)Nc1ccccc1C(=O)Nc1ccccc1	InChI=1S/C19H21N3O2S/c1-13(2)12-17(23)22-19(25)21-16-11-7-6-10-15(16)18(24)20-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,20,24)(H2,21,22,23,25)	AVEPIRUGHKMVQU-UHFFFAOYSA-N	355.135447632							104892
N-[2-(3,4-Dimethoxyphenyl)ethyl]-8-ethoxy-5H-pyrimido[5,4-b]indol-4-amine	LSM-16255	SID26725945, BRD-K80554872	2015821	InChI=1S/C22H24N4O3/c1-4-29-15-6-7-17-16(12-15)20-21(26-17)22(25-13-24-20)23-10-9-14-5-8-18(27-2)19(11-14)28-3/h5-8,11-13,26H,4,9-10H2,1-3H3,(H,23,24,25)	BEIGZMUAVKDCQI-UHFFFAOYSA-N	CCOc1ccc2[nH]c3c(NCCc4ccc(OC)c(OC)c4)ncnc3c2c1	BroadT	BRD-K80554872	BRD-K80554872-001-05-8	InterBioScreen Ltd.	STOCK4S-52250			CCOc1ccc2[nH]c3c(NCCc4ccc(OC)c(OC)c4)ncnc3c2c1	InChI=1S/C22H24N4O3/c1-4-29-15-6-7-17-16(12-15)20-21(26-17)22(25-13-24-20)23-10-9-14-5-8-18(27-2)19(11-14)28-3/h5-8,11-13,26H,4,9-10H2,1-3H3,(H,23,24,25)	BEIGZMUAVKDCQI-UHFFFAOYSA-N	392.184840668							104893
MLS001211690	LSM-16256	SID49644398, BRD-K42122053	802068	InChI=1S/C14H16N2O2S/c1-10-6-7-14(12(3)11(10)2)19(17,18)16-13-5-4-8-15-9-13/h4-9,16H,1-3H3	SZZAZESVMPZHKE-UHFFFAOYSA-N	Cc1ccc(c(C)c1C)S(=O)(=O)Nc2cccnc2	BroadT	BRD-K42122053	BRD-K42122053-001-06-0	Asinex Ltd.	BAS 03391649			Cc1ccc(c(C)c1C)S(=O)(=O)Nc1cccnc1	InChI=1S/C14H16N2O2S/c1-10-6-7-14(12(3)11(10)2)19(17,18)16-13-5-4-8-15-9-13/h4-9,16H,1-3H3	SZZAZESVMPZHKE-UHFFFAOYSA-N	276.093248462							104894
AK-968/15255773	LSM-16257	SID14727212, BRD-K33115108	892391	InChI=1S/C19H18N2O4/c1-2-23-15-5-7-16(8-6-15)24-13-17-9-10-18(25-17)19(22)21-14-4-3-11-20-12-14/h3-12H,2,13H2,1H3,(H,21,22)	MUJJOVYQYSVVTE-UHFFFAOYSA-N	CCOc1ccc(OCc2oc(cc2)C(=O)Nc3cccnc3)cc1	BroadT	BRD-K33115108	BRD-K33115108-001-05-2	Asinex Ltd.	BAS 08303208			CCOc1ccc(OCc2ccc(o2)C(=O)Nc2cccnc2)cc1	InChI=1S/C19H18N2O4/c1-2-23-15-5-7-16(8-6-15)24-13-17-9-10-18(25-17)19(22)21-14-4-3-11-20-12-14/h3-12H,2,13H2,1H3,(H,21,22)	MUJJOVYQYSVVTE-UHFFFAOYSA-N	338.126657076							104895
SMR000046237	LSM-16258	SID863967, BRD-K35352645	665222	InChI=1S/C23H22FN3O3S/c1-23(2)10-17-18(13-30-23)31-21-19(17)20(25)26(12-16-4-3-9-29-16)22(28)27(21)11-14-5-7-15(24)8-6-14/h3-9,25H,10-13H2,1-2H3	KPPWSVICCUUWOM-UHFFFAOYSA-N	CC1(C)Cc2c(CO1)sc3N(Cc4ccc(F)cc4)C(=O)N(Cc5occc5)C(=N)c23	BroadT	BRD-K35352645	BRD-K35352645-001-04-2	InterBioScreen Ltd.	STOCK4S-94721			CC1(C)Cc2c(CO1)sc1n(Cc3ccc(F)cc3)c(=O)n(Cc3ccco3)c(=N)c21	InChI=1S/C23H22FN3O3S/c1-23(2)10-17-18(13-30-23)31-21-19(17)20(25)26(12-16-4-3-9-29-16)22(28)27(21)11-14-5-7-15(24)8-6-14/h3-9,25H,10-13H2,1-2H3	KPPWSVICCUUWOM-UHFFFAOYSA-N	439.136590484							104896
MLS000882836	LSM-16259	SID26732174, BRD-K65739898	16060474	InChI=1S/C26H24BrNO/c1-26-16-8-7-13-22(26)24(28(25(26)29)17-18-9-3-2-4-10-18)21-15-14-19-11-5-6-12-20(19)23(21)27/h2-7,9-15,22,24H,8,16-17H2,1H3/t22-,24-,26+/m0/s1	MKUQHWSYDVIMFL-LLZJGCNPSA-N	C[C@@]12CCC=C[C@H]1[C@@H](N(Cc3ccccc3)C2=O)c4ccc5ccccc5c4Br	BroadT	BRD-K65739898	BRD-K65739898-001-06-2	University of Kansas CMLD	KUC101244N			C[C@@]12CCC=C[C@H]1[C@@H](N(Cc1ccccc1)C2=O)c1ccc2ccccc2c1Br	InChI=1S/C26H24BrNO/c1-26-16-8-7-13-22(26)24(28(25(26)29)17-18-9-3-2-4-10-18)21-15-14-19-11-5-6-12-20(19)23(21)27/h2-7,9-15,22,24H,8,16-17H2,1H3/t22-,24-,26+/m0/s1	MKUQHWSYDVIMFL-LLZJGCNPSA-N	445.104126998							
4-(2-Methylpiperidin-1-yl)quinazoline	LSM-15246	BRD-A74129188	3131603	InChI=1S/C14H17N3/c1-11-6-4-5-9-17(11)14-12-7-2-3-8-13(12)15-10-16-14/h2-3,7-8,10-11H,4-6,9H2,1H3	BOEIMGXBJBIBFB-UHFFFAOYSA-N	CC1CCCCN1c2ncnc3ccccc23	BroadT	BRD-A74129188	BRD-A74129188-003-06-2	Asinex Ltd.	BAS 01426151		Cl	CC1CCCCN1c1ncnc2ccccc12.Cl	InChI=1S/C14H17N3.ClH/c1-11-6-4-5-9-17(11)14-12-7-2-3-8-13(12)15-10-16-14;/h2-3,7-8,10-11H,4-6,9H2,1H3;1H	LTQCFRPKEDAOIK-UHFFFAOYSA-N	227.142247574							103893, 103893
MLS000555841	LSM-16260	SID14730458, BRD-K39014027	4364019	InChI=1S/C20H15N3O/c1-13-7-2-3-9-15(13)23-20(24)14-8-6-12-18-19(14)22-17-11-5-4-10-16(17)21-18/h2-12H,1H3,(H,23,24)	YTAITZRBXMKGJJ-UHFFFAOYSA-N	Cc1ccccc1NC(=O)c2cccc3nc4ccccc4nc23	BroadT	BRD-K39014027	BRD-K39014027-001-05-9	InterBioScreen Ltd.	STOCK3S-32751			Cc1ccccc1NC(=O)c1cccc2nc3ccccc3nc12	InChI=1S/C20H15N3O/c1-13-7-2-3-9-15(13)23-20(24)14-8-6-12-18-19(14)22-17-11-5-4-10-16(17)21-18/h2-12H,1H3,(H,23,24)	YTAITZRBXMKGJJ-UHFFFAOYSA-N	313.12151213							104897
MLS000677251	LSM-16261	SID24802882, BRD-K27743956	1073796	InChI=1S/C19H18F3NO4/c1-26-17(24)14-9-23(13-7-8-13)10-15(18(25)27-2)16(14)11-3-5-12(6-4-11)19(20,21)22/h3-6,9-10,13,16H,7-8H2,1-2H3	OJFRRKLTWZHENI-UHFFFAOYSA-N	COC(=O)C1=CN(C=C(C1c2ccc(cc2)C(F)(F)F)C(=O)OC)C3CC3	BroadT	BRD-K27743956	BRD-K27743956-001-06-0	Asinex Ltd.	BAS 04379683			COC(=O)C1=CN(C=C(C1c1ccc(cc1)C(F)(F)F)C(=O)OC)C1CC1	InChI=1S/C19H18F3NO4/c1-26-17(24)14-9-23(13-7-8-13)10-15(18(25)27-2)16(14)11-3-5-12(6-4-11)19(20,21)22/h3-6,9-10,13,16H,7-8H2,1-2H3	OJFRRKLTWZHENI-UHFFFAOYSA-N	381.118792666							104898
1H-Indazol-3-amine	LSM-16262	SID24830818, SID546537, SID50108337, SID4252983, BRD-K15352280	13399	InChI=1S/C7H7N3/c8-7-5-3-1-2-4-6(5)9-10-7/h1-4H,(H3,8,9,10)	YDTDKKULPWTHRV-UHFFFAOYSA-N	Nc1[nH]nc2ccccc12	BroadT	BRD-K15352280	BRD-K15352280-001-05-3	Enamine Ltd.	T0507-1316			Nc1[nH]nc2ccccc12	InChI=1S/C7H7N3/c8-7-5-3-1-2-4-6(5)9-10-7/h1-4H,(H3,8,9,10)	YDTDKKULPWTHRV-UHFFFAOYSA-N	133.063997254							104899
SMR000218444	LSM-16263	SID17505740, BRD-K79704810	3138567	InChI=1S/C20H15N3O2/c24-18-12-6-3-9-15(18)20(25)23-22-19-13-7-1-4-10-16(13)21-17-11-5-2-8-14(17)19/h1-12,24H,(H,21,22)(H,23,25)	NQYVRHPJMXWFED-UHFFFAOYSA-N	Oc1ccccc1C(=O)NNc2c3ccccc3nc4ccccc24	BroadT	BRD-K79704810	BRD-K79704810-001-07-3	InterBioScreen Ltd.	STOCK2S-89847			Oc1ccccc1C(=O)NNc1c2ccccc2nc2ccccc12	InChI=1S/C20H15N3O2/c24-18-12-6-3-9-15(18)20(25)23-22-19-13-7-1-4-10-16(13)21-17-11-5-2-8-14(17)19/h1-12,24H,(H,21,22)(H,23,25)	NQYVRHPJMXWFED-UHFFFAOYSA-N	329.11642675							104900
SMR000030450	LSM-16264	SID4240685, SID26724738, BRD-A63907577	3235767	InChI=1S/C25H27N5O4S/c1-34-13-7-12-26-22(32)16-35-25-29-19-11-6-5-10-18(19)23-28-20(24(33)30(23)25)14-21(31)27-15-17-8-3-2-4-9-17/h2-6,8-11,20H,7,12-16H2,1H3,(H,26,32)(H,27,31)	UXBJMSCERFPFDH-UHFFFAOYSA-N	COCCCNC(=O)CSC1=Nc2ccccc2C3=NC(CC(=O)NCc4ccccc4)C(=O)N13	BroadT	BRD-A63907577	BRD-A63907577-001-05-9	ChemDiv Inc.	K279-1267			COCCCNC(=O)CSC1=Nc2ccccc2C2=NC(CC(=O)NCc3ccccc3)C(=O)N12	InChI=1S/C25H27N5O4S/c1-34-13-7-12-26-22(32)16-35-25-29-19-11-6-5-10-18(19)23-28-20(24(33)30(23)25)14-21(31)27-15-17-8-3-2-4-9-17/h2-6,8-11,20H,7,12-16H2,1H3,(H,26,32)(H,27,31)	UXBJMSCERFPFDH-UHFFFAOYSA-N	493.178375084							104901
MLS000547229	LSM-16265	SID14718984, BRD-K79702333	5453596	InChI=1S/C22H15N5OS/c23-21-15(22-24-16-9-4-5-10-17(16)25-22)13-18(20(28)19-11-6-12-29-19)26-27(21)14-7-2-1-3-8-14/h1-13,23H,(H,24,25)	RHDIOIKWAASMRW-UHFFFAOYSA-N	N=C1N(N=C(C=C1c2nc3ccccc3[nH]2)C(=O)c4cccs4)c5ccccc5	BroadT	BRD-K79702333	BRD-K79702333-001-07-5	Specs	AJ-916/41045946			N=c1c(cc(nn1-c1ccccc1)C(=O)c1cccs1)-c1nc2ccccc2[nH]1	InChI=1S/C22H15N5OS/c23-21-15(22-24-16-9-4-5-10-17(16)25-22)13-18(20(28)19-11-6-12-29-19)26-27(21)14-7-2-1-3-8-14/h1-13,23H,(H,24,25)	RHDIOIKWAASMRW-UHFFFAOYSA-N	397.09973084							
2-Benzothiazol-2-yl-5-methyl-2H-pyrazol-3-ylamine	LSM-16266	SID24804232, BRD-K87558909	2311153	InChI=1S/C11H10N4S/c1-7-6-10(12)15(14-7)11-13-8-4-2-3-5-9(8)16-11/h2-6H,12H2,1H3	MAVWAUNAOWRFBW-UHFFFAOYSA-N	Cc1cc(N)n(n1)c2nc3ccccc3s2	BroadT	BRD-K87558909	BRD-K87558909-001-05-9	Asinex Ltd.	BAS 01262682			Cc1cc(N)n(n1)-c1nc2ccccc2s1	InChI=1S/C11H10N4S/c1-7-6-10(12)15(14-7)11-13-8-4-2-3-5-9(8)16-11/h2-6H,12H2,1H3	MAVWAUNAOWRFBW-UHFFFAOYSA-N	230.06261705							104903
SMR000065247	LSM-16267	SID3713306, BRD-K64266321	2998362	InChI=1S/C20H20FN5O4S/c1-2-9-26-17(12-30-16-8-4-3-7-15(16)21)24-25-20(26)31-13-18(27)23-19(28)22-11-14-6-5-10-29-14/h2-8,10H,1,9,11-13H2,(H2,22,23,27,28)	LKDZAKCWEHQYSW-UHFFFAOYSA-N	Fc1ccccc1OCc2nnc(SCC(=O)NC(=O)NCc3occc3)n2CC=C	BroadT	BRD-K64266321	BRD-K64266321-001-05-6	Enamine Ltd.	ZT-9508772			Fc1ccccc1OCc1nnc(SCC(=O)NC(=O)NCc2ccco2)n1CC=C	InChI=1S/C20H20FN5O4S/c1-2-9-26-17(12-30-16-8-4-3-7-15(16)21)24-25-20(26)31-13-18(27)23-19(28)22-11-14-6-5-10-29-14/h2-8,10H,1,9,11-13H2,(H2,22,23,27,28)	LKDZAKCWEHQYSW-UHFFFAOYSA-N	445.12200306							104904
SMR000028097	LSM-16268	SID4250281, BRD-K54005694	3244117	InChI=1S/C14H13NO4/c1-9(16)15-6-5-11-3-4-12(7-13(11)15)14(18)8-19-10(2)17/h3-7H,8H2,1-2H3	PRLTXVOLFJIINC-UHFFFAOYSA-N	CC(=O)OCC(=O)c1ccc2ccn(C(=O)C)c2c1	BroadT	BRD-K54005694	BRD-K54005694-001-06-7	ChemDiv Inc.	C607-0640			CC(=O)OCC(=O)c1ccc2ccn(C(C)=O)c2c1	InChI=1S/C14H13NO4/c1-9(16)15-6-5-11-3-4-12(7-13(11)15)14(18)8-19-10(2)17/h3-7H,8H2,1-2H3	PRLTXVOLFJIINC-UHFFFAOYSA-N	259.084457906							104905
STK358385	LSM-16269	SID14730879, BRD-K73028518	2227768	InChI=1S/C21H22N2O5S3/c1-3-28-18-8-4-16(5-9-18)22-30(24,25)20-12-6-17(7-13-20)23-31(26,27)21-14-10-19(29-2)11-15-21/h4-15,22-23H,3H2,1-2H3	XTTQSXYATLSOHS-UHFFFAOYSA-N	CCOc1ccc(NS(=O)(=O)c2ccc(NS(=O)(=O)c3ccc(SC)cc3)cc2)cc1	BroadT	BRD-K73028518	BRD-K73028518-001-06-0	ChemBridge Corporation	7953147			CCOc1ccc(NS(=O)(=O)c2ccc(NS(=O)(=O)c3ccc(SC)cc3)cc2)cc1	InChI=1S/C21H22N2O5S3/c1-3-28-18-8-4-16(5-9-18)22-30(24,25)20-12-6-17(7-13-20)23-31(26,27)21-14-10-19(29-2)11-15-21/h4-15,22-23H,3H2,1-2H3	XTTQSXYATLSOHS-UHFFFAOYSA-N	478.069083894							104906
MLS000418648	LSM-16270	SID22410882, BRD-K00872257	657154	InChI=1S/C23H18FN3O3S2/c1-15-6-12-18(13-7-15)32(29,30)27-20-5-3-2-4-19(20)22(28)26-23-25-21(14-31-23)16-8-10-17(24)11-9-16/h2-14,27H,1H3,(H,25,26,28)	XWAUCQGRYNYIOT-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)Nc2ccccc2C(=O)Nc3nc(cs3)c4ccc(F)cc4	BroadT	BRD-K00872257	BRD-K00872257-001-06-4	Enamine Ltd.	T0509-4528			Cc1ccc(cc1)S(=O)(=O)Nc1ccccc1C(=O)Nc1nc(cs1)-c1ccc(F)cc1	InChI=1S/C23H18FN3O3S2/c1-15-6-12-18(13-7-15)32(29,30)27-20-5-3-2-4-19(20)22(28)26-23-25-21(14-31-23)16-8-10-17(24)11-9-16/h2-14,27H,1H3,(H,25,26,28)	XWAUCQGRYNYIOT-UHFFFAOYSA-N	467.077361046							104907
AC1NPDYV	LSM-16271	SID26662840, BRD-A64635605	5156767	InChI=1S/C23H23NO6S/c1-2-29-19-9-7-16(8-10-19)14-24(18-11-12-31(27,28)15-18)22(25)20-13-17-5-3-4-6-21(17)30-23(20)26/h3-10,13,18H,2,11-12,14-15H2,1H3	PMBZLDDWVQMWSC-UHFFFAOYSA-N	CCOc1ccc(CN(C2CCS(=O)(=O)C2)C(=O)C3=Cc4ccccc4OC3=O)cc1	BroadT	BRD-A64635605	BRD-A64635605-001-05-1	InterBioScreen Ltd.	STOCK4S-73426			CCOc1ccc(CN(C2CCS(=O)(=O)C2)C(=O)c2cc3ccccc3oc2=O)cc1	InChI=1S/C23H23NO6S/c1-2-29-19-9-7-16(8-10-19)14-24(18-11-12-31(27,28)15-18)22(25)20-13-17-5-3-4-6-21(17)30-23(20)26/h3-10,13,18H,2,11-12,14-15H2,1H3	PMBZLDDWVQMWSC-UHFFFAOYSA-N	441.124608156							104908
SMR000067483	LSM-16272	SID3711946, BRD-A06405194	2997823	InChI=1S/C14H13BrN2O3/c1-8-4-11(8)14(19)20-7-10-5-13(18)17-6-9(15)2-3-12(17)16-10/h2-3,5-6,8,11H,4,7H2,1H3	DZDOSPZIHMCCOR-UHFFFAOYSA-N	CC1CC1C(=O)OCC2=CC(=O)N3C=C(Br)C=CC3=N2	BroadT	BRD-A06405194	BRD-A06405194-001-06-5	Enamine Ltd.	T5268328			CC1CC1C(=O)OCc1cc(=O)n2cc(Br)ccc2n1	InChI=1S/C14H13BrN2O3/c1-8-4-11(8)14(19)20-7-10-5-13(18)17-6-9(15)2-3-12(17)16-10/h2-3,5-6,8,11H,4,7H2,1H3	DZDOSPZIHMCCOR-UHFFFAOYSA-N	336.010954896							104909
MLS001212214	LSM-16273	SID49643817, BRD-K03371476	1073328	InChI=1S/C25H26FNO7/c1-30-20-10-16(11-21(31-2)23(20)32-3)22-18(24(28)33-4)13-27(14-19(22)25(29)34-5)12-15-6-8-17(26)9-7-15/h6-11,13-14,22H,12H2,1-5H3	FWLARKPWDNSLGG-UHFFFAOYSA-N	COC(=O)C1=CN(Cc2ccc(F)cc2)C=C(C1c3cc(OC)c(OC)c(OC)c3)C(=O)OC	BroadT	BRD-K03371476	BRD-K03371476-001-05-1	Asinex Ltd.	BAS 04378028			COC(=O)C1=CN(Cc2ccc(F)cc2)C=C(C1c1cc(OC)c(OC)c(OC)c1)C(=O)OC	InChI=1S/C25H26FNO7/c1-30-20-10-16(11-21(31-2)23(20)32-3)22-18(24(28)33-4)13-27(14-19(22)25(29)34-5)12-15-6-8-17(26)9-7-15/h6-11,13-14,22H,12H2,1-5H3	FWLARKPWDNSLGG-UHFFFAOYSA-N	471.169330382							104910
AC1N8GBV	LSM-16274	BRD-K58980666	4343351	InChI=1S/C8H10N6O/c1-6-11-13-8(14(6)9)12-10-5-7-3-2-4-15-7/h2-5H,9H2,1H3,(H,12,13)	AUOBAUTVMOQJMR-UHFFFAOYSA-N	Cc1nnc(NN=Cc2occc2)n1N	BroadT	BRD-K58980666	BRD-K58980666-001-05-3	ChemDiv Inc.	K060-0096			Cc1nnc(NN=Cc2ccco2)n1N	InChI=1S/C8H10N6O/c1-6-11-13-8(14(6)9)12-10-5-7-3-2-4-15-7/h2-5H,9H2,1H3,(H,12,13)	AUOBAUTVMOQJMR-UHFFFAOYSA-N	206.091609							104911
MLS000674775	LSM-16275	SID24823541, BRD-K70590086	6619701	InChI=1S/C24H23ClN2O5S/c1-31-20-11-21(32-2)19(10-16(20)25)27-24(30)13-7-8-15-18(9-13)26-17-6-4-3-5-14(17)23(15)33-12-22(28)29/h7-11H,3-6,12H2,1-2H3,(H,27,30)(H,28,29)	FPIJGQYIKXQHHG-UHFFFAOYSA-N	COc1cc(OC)c(NC(=O)c2ccc3c(SCC(=O)O)c4CCCCc4nc3c2)cc1Cl	BroadT	BRD-K70590086	BRD-K70590086-001-05-6	ChemDiv Inc.	C598-0027			COc1cc(OC)c(NC(=O)c2ccc3c(SCC(O)=O)c4CCCCc4nc3c2)cc1Cl	InChI=1S/C24H23ClN2O5S/c1-31-20-11-21(32-2)19(10-16(20)25)27-24(30)13-7-8-15-18(9-13)26-17-6-4-3-5-14(17)23(15)33-12-22(28)29/h7-11H,3-6,12H2,1-2H3,(H,27,30)(H,28,29)	FPIJGQYIKXQHHG-UHFFFAOYSA-N	486.101620256							104912
AC1LCNII	LSM-16276	SID850500, BRD-K30534191	653031	InChI=1S/C21H23N3O3/c1-13-21(14(2)25)18-11-17(27-12-20(22)26)9-10-19(18)24(13)16-7-5-15(6-8-16)23(3)4/h5-11H,12H2,1-4H3,(H2,22,26)	BJKSOYNMYFCBBH-UHFFFAOYSA-N	CN(C)c1ccc(cc1)n2c(C)c(C(=O)C)c3cc(OCC(=O)N)ccc23	BroadT	BRD-K30534191	BRD-K30534191-001-05-5	Asinex Ltd.	BAS 06106199			CN(C)c1ccc(cc1)-n1c(C)c(C(C)=O)c2cc(OCC(N)=O)ccc12	InChI=1S/C21H23N3O3/c1-13-21(14(2)25)18-11-17(27-12-20(22)26)9-10-19(18)24(13)16-7-5-15(6-8-16)23(3)4/h5-11H,12H2,1-4H3,(H2,22,26)	BJKSOYNMYFCBBH-UHFFFAOYSA-N	365.173941626							104913
MLS000685727	LSM-43632	SID24823560, BRD-K95191397	6027465	InChI=1S/C17H10BrN3O4S3/c18-9-6-7-12-11(8-9)13(15(22)19-12)14-16(23)21(17(26)27-14)20-28(24,25)10-4-2-1-3-5-10/h1-8,20H,(H,19,22)/b14-13-	MELBHLSUSRXGSC-YPKPFQOOSA-N	Brc1ccc2NC(=O)\C(=C\3/SC(=S)N(NS(=O)(=O)c4ccccc4)C3=O)\c2c1	BroadT	BRD-K95191397	BRD-K95191397-001-06-6	ChemDiv Inc.	3232-1386			Brc1ccc2NC(=O)\C(c2c1)=C1/SC(=S)N(NS(=O)(=O)c2ccccc2)C1=O	InChI=1S/C17H10BrN3O4S3/c18-9-6-7-12-11(8-9)13(15(22)19-12)14-16(23)21(17(26)27-14)20-28(24,25)10-4-2-1-3-5-10/h1-8,20H,(H,19,22)/b14-13-	MELBHLSUSRXGSC-YPKPFQOOSA-N	494.9016805							
MLS000581577	LSM-16278	SID17432125, BRD-K53107402	2959240	InChI=1S/C17H15F4N3O3/c18-13-5-2-11(3-6-13)16(25)23-9-1-8-22-14-7-4-12(17(19,20)21)10-15(14)24(26)27/h2-7,10,22H,1,8-9H2,(H,23,25)	KFIBMBAWEJGQRA-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1NCCCNC(=O)c2ccc(F)cc2)C(F)(F)F	BroadT	BRD-K53107402	BRD-K53107402-001-07-3	ChemBridge Corporation	7854576			[O-][N+](=O)c1cc(ccc1NCCCNC(=O)c1ccc(F)cc1)C(F)(F)F	InChI=1S/C17H15F4N3O3/c18-13-5-2-11(3-6-13)16(25)23-9-1-8-22-14-7-4-12(17(19,20)21)10-15(14)24(26)27/h2-7,10,22H,1,8-9H2,(H,23,25)	KFIBMBAWEJGQRA-UHFFFAOYSA-N	385.10495417							104915
MLS000112059	LSM-16279	SID7966209, SID7972542, BRD-K27740408	1326689	InChI=1S/C23H22ClN3O5/c1-15-21(22(26-32-15)18-4-2-3-5-19(18)24)23(29)25-16-6-8-17(9-7-16)31-14-20(28)27-10-12-30-13-11-27/h2-9H,10-14H2,1H3,(H,25,29)	HITDZAVSZADBHH-UHFFFAOYSA-N	Cc1onc(c2ccccc2Cl)c1C(=O)Nc3ccc(OCC(=O)N4CCOCC4)cc3	BroadT	BRD-K27740408	BRD-K27740408-001-06-0	ChemDiv Inc.	6232-2839			Cc1onc(c1C(=O)Nc1ccc(OCC(=O)N2CCOCC2)cc1)-c1ccccc1Cl	InChI=1S/C23H22ClN3O5/c1-15-21(22(26-32-15)18-4-2-3-5-19(18)24)23(29)25-16-6-8-17(9-7-16)31-14-20(28)27-10-12-30-13-11-27/h2-9H,10-14H2,1H3,(H,25,29)	HITDZAVSZADBHH-UHFFFAOYSA-N	455.124798544							104916
MLS000115577	LSM-16280	SID7969014, BRD-K02980127	3896375	InChI=1S/C21H18N4O2/c26-19(14-16-8-3-1-4-9-16)25-21(22-15-18-12-7-13-27-18)23-20(24-25)17-10-5-2-6-11-17/h1-13H,14-15H2,(H,22,23,24)	AKGKCJUHXQYGFO-UHFFFAOYSA-N	O=C(Cc1ccccc1)n2nc(nc2NCc3occc3)c4ccccc4	BroadT	BRD-K02980127	BRD-K02980127-001-04-6	ChemDiv Inc.	6855-0186			O=C(Cc1ccccc1)n1nc(nc1NCc1ccco1)-c1ccccc1	InChI=1S/C21H18N4O2/c26-19(14-16-8-3-1-4-9-16)25-21(22-15-18-12-7-13-27-18)23-20(24-25)17-10-5-2-6-11-17/h1-13H,14-15H2,(H,22,23,24)	AKGKCJUHXQYGFO-UHFFFAOYSA-N	358.142975856							104917
SMR000067822	LSM-16281	SID24840484, SID3714659, BRD-K70122204	2555135	InChI=1S/C22H25N5OS3/c1-13-14(2)31-21-19(13)20(28)23-17(24-21)12-30-22-26-25-18(11-16-9-6-10-29-16)27(22)15-7-4-3-5-8-15/h6,9-10,15H,3-5,7-8,11-12H2,1-2H3,(H,23,24,28)	JWXFOJJHFNTLGM-UHFFFAOYSA-N	Cc1sc2nc(CSc3nnc(Cc4cccs4)n3C5CCCCC5)nc(O)c2c1C	BroadT	BRD-K70122204	BRD-K70122204-001-05-5	Enamine Ltd.	T5330326			Cc1sc2nc(CSc3nnc(Cc4cccs4)n3C3CCCCC3)nc(O)c2c1C	InChI=1S/C22H25N5OS3/c1-13-14(2)31-21-19(13)20(28)23-17(24-21)12-30-22-26-25-18(11-16-9-6-10-29-16)27(22)15-7-4-3-5-8-15/h6,9-10,15H,3-5,7-8,11-12H2,1-2H3,(H,23,24,28)	JWXFOJJHFNTLGM-UHFFFAOYSA-N	471.12212254							104918
2-Chloro-4-(3,4-dimethoxy-phenyl)-6-phenyl-pyrimidine	LSM-16282	SID49641062, BRD-K70544957	2058821	InChI=1S/C18H15ClN2O2/c1-22-16-9-8-13(10-17(16)23-2)15-11-14(20-18(19)21-15)12-6-4-3-5-7-12/h3-11H,1-2H3	LBINREJTDNMIPH-UHFFFAOYSA-N	COc1ccc(cc1OC)c2cc(nc(Cl)n2)c3ccccc3	BroadT	BRD-K70544957	BRD-K70544957-001-05-9	Asinex Ltd.	BAS 00139571			COc1ccc(cc1OC)-c1cc(nc(Cl)n1)-c1ccccc1	InChI=1S/C18H15ClN2O2/c1-22-16-9-8-13(10-17(16)23-2)15-11-14(20-18(19)21-15)12-6-4-3-5-7-12/h3-11H,1-2H3	LBINREJTDNMIPH-UHFFFAOYSA-N	326.08220545							104919
SMR000193358	LSM-16283	SID17433772, BRD-K09761414	1361354	InChI=1S/C24H25FN4O6S/c1-3-27-14-19(24(32)33)23(31)18-12-20(25)22(13-21(18)27)28-8-10-29(11-9-28)36(34,35)17-6-4-16(5-7-17)26-15(2)30/h4-7,12-14H,3,8-11H2,1-2H3,(H,26,30)(H,32,33)	ONXIXHMYSNAGEX-UHFFFAOYSA-N	CCN1C=C(C(=O)O)C(=O)c2cc(F)c(cc12)N3CCN(CC3)S(=O)(=O)c4ccc(NC(=O)C)cc4	BroadT	BRD-K09761414	BRD-K09761414-001-06-0	ChemBridge Corporation	5839497			CCn1cc(C(O)=O)c(=O)c2cc(F)c(cc12)N1CCN(CC1)S(=O)(=O)c1ccc(NC(C)=O)cc1	InChI=1S/C24H25FN4O6S/c1-3-27-14-19(24(32)33)23(31)18-12-20(25)22(13-21(18)27)28-8-10-29(11-9-28)36(34,35)17-6-4-16(5-7-17)26-15(2)30/h4-7,12-14H,3,8-11H2,1-2H3,(H,26,30)(H,32,33)	ONXIXHMYSNAGEX-UHFFFAOYSA-N	516.14788345							104920
AC1NA02J	LSM-16284	SID24812456, BRD-A89366962	4393950	InChI=1S/C16H17N3OS/c1-11-5-2-3-6-12(11)14-18-9-4-7-13(18)15(20)19(14)16-17-8-10-21-16/h2-3,5-6,8,10,13-14H,4,7,9H2,1H3	QLCVVLDQCWMGQX-UHFFFAOYSA-N	Cc1ccccc1C2N3CCCC3C(=O)N2c4nccs4	BroadT	BRD-A89366962	BRD-A89366962-001-05-1	ChemDiv Inc.	C466-0358			Cc1ccccc1C1N2CCCC2C(=O)N1c1nccs1	InChI=1S/C16H17N3OS/c1-11-5-2-3-6-12(11)14-18-9-4-7-13(18)15(20)19(14)16-17-8-10-21-16/h2-3,5-6,8,10,13-14H,4,7,9H2,1H3	QLCVVLDQCWMGQX-UHFFFAOYSA-N	299.109232884							104921
MLS000703244	LSM-16285	SID24822575, BRD-K69388012	1102900	InChI=1S/C26H14N2O6/c29-15-5-1-3-13(11-15)27-23(31)17-7-9-19-22-20(10-8-18(21(17)22)24(27)32)26(34)28(25(19)33)14-4-2-6-16(30)12-14/h1-12,29-30H	SEMFLPWCOKACHM-UHFFFAOYSA-N	Oc1cccc(c1)N2C(=O)c3ccc4C(=O)N(C(=O)c5ccc(C2=O)c3c45)c6cccc(O)c6	BroadT	BRD-K69388012	BRD-K69388012-001-08-1	Asinex Ltd.	BAS 00447562			Oc1cccc(c1)-n1c(=O)c2ccc3c4c(ccc(c24)c1=O)c(=O)n(-c1cccc(O)c1)c3=O	InChI=1S/C26H14N2O6/c29-15-5-1-3-13(11-15)27-23(31)17-7-9-19-22-20(10-8-18(21(17)22)24(27)32)26(34)28(25(19)33)14-4-2-6-16(30)12-14/h1-12,29-30H	SEMFLPWCOKACHM-UHFFFAOYSA-N	450.085186188							104922
MLS000389606	LSM-16286	SID22409458, BRD-K73428865	4354817	InChI=1S/C17H19N3O4/c1-5-8-19-12(3)9-14(13(19)4)15(21)10-24-16-7-6-11(2)18-17(16)20(22)23/h5-7,9H,1,8,10H2,2-4H3	UIQMPVFCYITWMX-UHFFFAOYSA-N	Cc1ccc(OCC(=O)c2cc(C)n(CC=C)c2C)c(n1)[N+](=O)[O-]	BroadT	BRD-K73428865	BRD-K73428865-001-05-3	Enamine Ltd.	T5219633			Cc1cc(C(=O)COc2ccc(C)nc2[N+]([O-])=O)c(C)n1CC=C	InChI=1S/C17H19N3O4/c1-5-8-19-12(3)9-14(13(19)4)15(21)10-24-16-7-6-11(2)18-17(16)20(22)23/h5-7,9H,1,8,10H2,2-4H3	UIQMPVFCYITWMX-UHFFFAOYSA-N	329.137556118							104923
T5253439	LSM-43633	SID24828086, BRD-K21308266	2125653	InChI=1S/C19H19F2N3O7/c1-23-16(22)15(17(27)24(2)19(23)28)11(25)9-30-14(26)7-5-10-4-6-12(31-18(20)21)13(8-10)29-3/h4-8,18H,9,22H2,1-3H3/b7-5+	YYOCXODFEFIMFX-FNORWQNLSA-N	COc1cc(\C=C\C(=O)OCC(=O)C2=C(N)N(C)C(=O)N(C)C2=O)ccc1OC(F)F	BroadT	BRD-K21308266	BRD-K21308266-001-05-5	Enamine Ltd.	T5253439			COc1cc(ccc1OC(F)F)\C=C\C(=O)OCC(=O)c1c(N)n(C)c(=O)n(C)c1=O	InChI=1S/C19H19F2N3O7/c1-23-16(22)15(17(27)24(2)19(23)28)11(25)9-30-14(26)7-5-10-4-6-12(31-18(20)21)13(8-10)29-3/h4-8,18H,9,22H2,1-3H3/b7-5+	YYOCXODFEFIMFX-FNORWQNLSA-N	439.119106378							
SMR000068427	LSM-16288	SID3713184, BRD-K22375845	2998322	InChI=1S/C23H18N4O2/c1-16-25-21-13-18(9-12-22(21)27(16)19-5-3-2-4-6-19)26-23(28)15-29-20-10-7-17(14-24)8-11-20/h2-13H,15H2,1H3,(H,26,28)	VOZIDHJWRZYZLG-UHFFFAOYSA-N	Cc1nc2cc(NC(=O)COc3ccc(cc3)C#N)ccc2n1c4ccccc4	BroadT	BRD-K22375845	BRD-K22375845-001-05-3	Enamine Ltd.	T5341838			Cc1nc2cc(NC(=O)COc3ccc(cc3)C#N)ccc2n1-c1ccccc1	InChI=1S/C23H18N4O2/c1-16-25-21-13-18(9-12-22(21)27(16)19-5-3-2-4-6-19)26-23(28)15-29-20-10-7-17(14-24)8-11-20/h2-13H,15H2,1H3,(H,26,28)	VOZIDHJWRZYZLG-UHFFFAOYSA-N	382.142975856							104925
5-(Azepan-1-yl)-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile	LSM-16289	SID862899, BRD-K11527755	664138	InChI=1S/C18H21N3O3/c1-22-15-8-7-13(11-16(15)23-2)17-20-14(12-19)18(24-17)21-9-5-3-4-6-10-21/h7-8,11H,3-6,9-10H2,1-2H3	ZKMSQFNCYCQUPB-UHFFFAOYSA-N	COc1ccc(cc1OC)c2oc(N3CCCCCC3)c(n2)C#N	BroadT	BRD-K11527755	BRD-K11527755-001-05-0	InterBioScreen Ltd.	STOCK4S-57630			COc1ccc(cc1OC)-c1nc(C#N)c(o1)N1CCCCCC1	InChI=1S/C18H21N3O3/c1-22-15-8-7-13(11-16(15)23-2)17-20-14(12-19)18(24-17)21-9-5-3-4-6-10-21/h7-8,11H,3-6,9-10H2,1-2H3	ZKMSQFNCYCQUPB-UHFFFAOYSA-N	327.158291562							104926
MLS001099412	LSM-16290	SID49818359, BRD-K45519575	24687564	InChI=1S/C23H27N3O4S/c1-6-29-21(28)18-15-11-22(2,3)26-23(4,5)19(15)31-20(18)25-17(27)13-30-16-10-8-7-9-14(16)12-24/h7-10,26H,6,11,13H2,1-5H3,(H,25,27)	FKOCGWKIXOGBBA-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)COc2ccccc2C#N)sc3c1CC(C)(C)NC3(C)C	BroadT	BRD-K45519575	BRD-K45519575-001-05-5	UkrOrgSynthesis Ltd.	PB26884529			CCOC(=O)c1c(NC(=O)COc2ccccc2C#N)sc2c1CC(C)(C)NC2(C)C	InChI=1S/C23H27N3O4S/c1-6-29-21(28)18-15-11-22(2,3)26-23(4,5)19(15)31-20(18)25-17(27)13-30-16-10-8-7-9-14(16)12-24/h7-10,26H,6,11,13H2,1-5H3,(H,25,27)	FKOCGWKIXOGBBA-UHFFFAOYSA-N	441.172227064							104927
GNF-PF-159	LSM-43337	BRD-K98824517, GNF-PF-159	5756371	InChI=1S/C16H15N5O2/c1-3-21-14-13(15(22)20(2)16(23)18-14)17-12(19-21)10-9-11-7-5-4-6-8-11/h4-10H,3H2,1-2H3/b10-9+	BMHKZVDHCKLDME-MDZDMXLPSA-N	CCN1N=C(\C=C\c2ccccc2)N=C3C(=O)N(C)C(=O)N=C13	BroadT	BRD-K98824517	BRD-K98824517-001-09-8	Asinex Ltd.	BAS 00444320			CCn1nc(\C=C\c2ccccc2)nc2c1nc(=O)n(C)c2=O	InChI=1S/C16H15N5O2/c1-3-21-14-13(15(22)20(2)16(23)18-14)17-12(19-21)10-9-11-7-5-4-6-8-11/h4-10H,3H2,1-2H3/b10-9+	BMHKZVDHCKLDME-MDZDMXLPSA-N	309.12257477							
AC1LH5W5	LSM-16291	BRD-K18486667	882244	InChI=1S/C15H14N6O/c16-15-18-19-20-21(15)17-10-13-8-4-5-9-14(13)22-11-12-6-2-1-3-7-12/h1-10H,11H2,(H2,16,18,20)	IWKYJCSDMQVZEK-UHFFFAOYSA-N	Nc1nnnn1N=Cc2ccccc2OCc3ccccc3	BroadT	BRD-K18486667	BRD-K18486667-001-05-9	ChemBridge Corporation	6430685			Nc1nnnn1N=Cc1ccccc1OCc1ccccc1	InChI=1S/C15H14N6O/c16-15-18-19-20-21(15)17-10-13-8-4-5-9-14(13)22-11-12-6-2-1-3-7-12/h1-10H,11H2,(H2,16,18,20)	IWKYJCSDMQVZEK-UHFFFAOYSA-N	294.122909128							104928
MLS000117897	LSM-16292	SID7966410, BRD-A93754807	5308212	InChI=1S/C16H21N5O5S2/c1-2-26-14(22)6-12-9-27-16(19-12)20-15(23)11-4-3-5-21(8-11)28(24,25)13-7-17-10-18-13/h7,9-11H,2-6,8H2,1H3,(H,17,18)(H,19,20,23)	UQISEIMHWNPEJV-UHFFFAOYSA-N	CCOC(=O)Cc1csc(NC(=O)C2CCCN(C2)S(=O)(=O)c3c[nH]cn3)n1	BroadT	BRD-A93754807	BRD-A93754807-001-04-4	ChemDiv Inc.	C548-2230			CCOC(=O)Cc1csc(NC(=O)C2CCCN(C2)S(=O)(=O)c2c[nH]cn2)n1	InChI=1S/C16H21N5O5S2/c1-2-26-14(22)6-12-9-27-16(19-12)20-15(23)11-4-3-5-21(8-11)28(24,25)13-7-17-10-18-13/h7,9-11H,2-6,8H2,1H3,(H,17,18)(H,19,20,23)	UQISEIMHWNPEJV-UHFFFAOYSA-N	427.098410202							104929
ZINC00537071	LSM-16293	SID17514018, BRD-K76044220	940897	InChI=1S/C20H17NO4/c1-12-10-18-19(16-11-15(24-3)8-9-17(16)25-18)20(21(12)22)13-4-6-14(23-2)7-5-13/h4-11H,1-3H3	DIPRAFIKGBYDDD-UHFFFAOYSA-N	COc1ccc(cc1)c2c3c(oc4ccc(OC)cc34)cc(C)[n+]2[O-]	BroadT	BRD-K76044220	BRD-K76044220-001-05-5	InterBioScreen Ltd.	STOCK4S-43069			COc1ccc(cc1)-c1[n+]([O-])c(C)cc2oc3ccc(OC)cc3c12	InChI=1S/C20H17NO4/c1-12-10-18-19(16-11-15(24-3)8-9-17(16)25-18)20(21(12)22)13-4-6-14(23-2)7-5-13/h4-11H,1-3H3	DIPRAFIKGBYDDD-UHFFFAOYSA-N	335.115758034							104930
T5313047	LSM-16294	SID17516761, BRD-K53222360	2459696	InChI=1S/C18H16ClN3OS/c19-13-5-7-15-16(9-13)22-18(21-15)24-10-17(23)20-14-6-4-11-2-1-3-12(11)8-14/h4-9H,1-3,10H2,(H,20,23)(H,21,22)	ZBLBNGCXJKRNON-UHFFFAOYSA-N	Clc1ccc2[nH]c(SCC(=O)Nc3ccc4CCCc4c3)nc2c1	BroadT	BRD-K53222360	BRD-K53222360-001-05-4	Enamine Ltd.	T5313047			Clc1ccc2[nH]c(SCC(=O)Nc3ccc4CCCc4c3)nc2c1	InChI=1S/C18H16ClN3OS/c19-13-5-7-15-16(9-13)22-18(21-15)24-10-17(23)20-14-6-4-11-2-1-3-12(11)8-14/h4-9H,1-3,10H2,(H,20,23)(H,21,22)	ZBLBNGCXJKRNON-UHFFFAOYSA-N	357.070260562							104931
1-(4-Bromo-2-fluorophenyl)-3-(3-chlorophenyl)urea	LSM-16295	SID22402926, BRD-K81240651	2116164	InChI=1S/C13H9BrClFN2O/c14-8-4-5-12(11(16)6-8)18-13(19)17-10-3-1-2-9(15)7-10/h1-7H,(H2,17,18,19)	SLVVATXCONJWRI-UHFFFAOYSA-N	Fc1cc(Br)ccc1NC(=O)Nc2cccc(Cl)c2	BroadT	BRD-K81240651	BRD-K81240651-001-05-0	Enamine Ltd.	T5244650			Fc1cc(Br)ccc1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C13H9BrClFN2O/c14-8-4-5-12(11(16)6-8)18-13(19)17-10-3-1-2-9(15)7-10/h1-7H,(H2,17,18,19)	SLVVATXCONJWRI-UHFFFAOYSA-N	341.957081438							104932
MLS000389319	LSM-16296	SID22409606, BRD-K26665052	2581550	InChI=1S/C17H17N5O2S3/c1-2-10-3-5-11(6-4-10)19-16-21-22-17(27-16)26-9-13(23)20-15-12(14(18)24)7-8-25-15/h3-8H,2,9H2,1H3,(H2,18,24)(H,19,21)(H,20,23)	DHHGYSLGUFSAQY-UHFFFAOYSA-N	CCc1ccc(Nc2nnc(SCC(=O)Nc3sccc3C(=O)N)s2)cc1	BroadT	BRD-K26665052	BRD-K26665052-001-05-1	Enamine Ltd.	ZT-7767395			CCc1ccc(Nc2nnc(SCC(=O)Nc3sccc3C(N)=O)s2)cc1	InChI=1S/C17H17N5O2S3/c1-2-10-3-5-11(6-4-10)19-16-21-22-17(27-16)26-9-13(23)20-15-12(14(18)24)7-8-25-15/h3-8H,2,9H2,1H3,(H2,18,24)(H,19,21)(H,20,23)	DHHGYSLGUFSAQY-UHFFFAOYSA-N	419.054436904							104933
SMR000041442	LSM-16297	SID24841038, SID859340, BRD-A53667874	660642	InChI=1S/C14H14F3N3O5S2/c1-7(21)19-13(11(22)25-2,14(15,16)17)20-12-18-9-5-4-8(27(3,23)24)6-10(9)26-12/h4-6H,1-3H3,(H,18,20)(H,19,21)	HWCLMJPDYGVVLV-UHFFFAOYSA-N	COC(=O)C(NC(=O)C)(Nc1nc2ccc(cc2s1)S(=O)(=O)C)C(F)(F)F	BroadT	BRD-A53667874	BRD-A53667874-001-06-9	InterBioScreen Ltd.	STOCK3S-07279			COC(=O)C(NC(C)=O)(Nc1nc2ccc(cc2s1)S(C)(=O)=O)C(F)(F)F	InChI=1S/C14H14F3N3O5S2/c1-7(21)19-13(11(22)25-2,14(15,16)17)20-12-18-9-5-4-8(27(3,23)24)6-10(9)26-12/h4-6H,1-3H3,(H,18,20)(H,19,21)	HWCLMJPDYGVVLV-UHFFFAOYSA-N	425.032696558							104934
MLS000335765	LSM-16298	SID22410269, BRD-K26027790	2463285	InChI=1S/C25H24N4O2S/c1-16-13-22(17(2)29(16)14-19-7-5-4-6-8-19)23-15-32-25(27-23)28-24(31)20-9-11-21(12-10-20)26-18(3)30/h4-13,15H,14H2,1-3H3,(H,26,30)(H,27,28,31)	PIITVCCJJWAOHX-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)C(=O)Nc2nc(cs2)c3cc(C)n(Cc4ccccc4)c3C	BroadT	BRD-K26027790	BRD-K26027790-001-05-1	Enamine Ltd.	T5319370			CC(=O)Nc1ccc(cc1)C(=O)Nc1nc(cs1)-c1cc(C)n(Cc2ccccc2)c1C	InChI=1S/C25H24N4O2S/c1-16-13-22(17(2)29(16)14-19-7-5-4-6-8-19)23-15-32-25(27-23)28-24(31)20-9-11-21(12-10-20)26-18(3)30/h4-13,15H,14H2,1-3H3,(H,26,30)(H,27,28,31)	PIITVCCJJWAOHX-UHFFFAOYSA-N	444.161996738							104935
AC1MVK7H	LSM-16299	BRD-K91769618	3709138	InChI=1S/C19H18N6O2S/c1-23-16-15(17(26)24(2)19(23)27)25(12-13-7-4-3-5-8-13)18(21-16)22-20-11-14-9-6-10-28-14/h3-11H,12H2,1-2H3,(H,21,22)	MDLZUHWOYJMSAN-UHFFFAOYSA-N	CN1C(=O)N(C)c2nc(NN=Cc3cccs3)n(Cc4ccccc4)c2C1=O	BroadT	BRD-K91769618	BRD-K91769618-001-06-6	InterBioScreen Ltd.	STOCK2S-31446			Cn1c2nc(NN=Cc3cccs3)n(Cc3ccccc3)c2c(=O)n(C)c1=O	InChI=1S/C19H18N6O2S/c1-23-16-15(17(26)24(2)19(23)27)25(12-13-7-4-3-5-8-13)18(21-16)22-20-11-14-9-6-10-28-14/h3-11H,12H2,1-2H3,(H,21,22)	MDLZUHWOYJMSAN-UHFFFAOYSA-N	394.121194566							104936
STK254656	LSM-16300	SID49723749, BRD-K46820885	1306211	InChI=1S/C20H23N3O2S/c1-25-18-12-6-3-9-15(18)19(24)22-20(26)21-16-10-4-5-11-17(16)23-13-7-2-8-14-23/h3-6,9-12H,2,7-8,13-14H2,1H3,(H2,21,22,24,26)	XBARDXREAOSKED-UHFFFAOYSA-N	COc1ccccc1C(=O)NC(=S)Nc2ccccc2N3CCCCC3	BroadT	BRD-K46820885	BRD-K46820885-001-05-1	ChemBridge Corporation	7406734			COc1ccccc1C(=O)NC(=S)Nc1ccccc1N1CCCCC1	InChI=1S/C20H23N3O2S/c1-25-18-12-6-3-9-15(18)19(24)22-20(26)21-16-10-4-5-11-17(16)23-13-7-2-8-14-23/h3-6,9-12H,2,7-8,13-14H2,1H3,(H2,21,22,24,26)	XBARDXREAOSKED-UHFFFAOYSA-N	369.151097696							104937
MLS000331542	LSM-16301	SID17505546, BRD-K78272952	2013382	InChI=1S/C16H17ClN2OS2/c1-20-15-5-3-2-4-14(15)19-16(21)18-10-11-22-13-8-6-12(17)7-9-13/h2-9H,10-11H2,1H3,(H2,18,19,21)	MTCQSHONQUVLPE-UHFFFAOYSA-N	COc1ccccc1N=C(S)NCCSc2ccc(Cl)cc2	BroadT	BRD-K78272952	BRD-K78272952-001-05-4	InterBioScreen Ltd.	STOCK4S-49106			COc1ccccc1N=C(S)NCCSc1ccc(Cl)cc1	InChI=1S/C16H17ClN2OS2/c1-20-15-5-3-2-4-14(15)19-16(21)18-10-11-22-13-8-6-12(17)7-9-13/h2-9H,10-11H2,1H3,(H2,18,19,21)	MTCQSHONQUVLPE-UHFFFAOYSA-N	352.047082274							104938
MLS000703513	LSM-43634	SID24816521, BRD-K45988237	6011097	InChI=1S/C11H12N2O3S/c14-10(12-7-1-2-8-12)5-3-9-4-6-11(17-9)13(15)16/h3-6H,1-2,7-8H2/b5-3+	UDSVOHWDGMFOHN-HWKANZROSA-N	[O-][N+](=O)c1ccc(\C=C\C(=O)N2CCCC2)s1	BroadT	BRD-K45988237	BRD-K45988237-001-08-6	Life Chemicals Inc.	F0447-0114			[O-][N+](=O)c1ccc(s1)\C=C\C(=O)N1CCCC1	InChI=1S/C11H12N2O3S/c14-10(12-7-1-2-8-12)5-3-9-4-6-11(17-9)13(15)16/h3-6H,1-2,7-8H2/b5-3+	UDSVOHWDGMFOHN-HWKANZROSA-N	252.056862954							
SMR000145351	LSM-16303	SID14741098, BRD-A62208588	4311525	InChI=1S/C15H16N2O2S2/c1-11-5-7-12(8-6-11)13-10-14(15-4-3-9-20-15)17(16-13)21(2,18)19/h3-9,14H,10H2,1-2H3	IOUORVYECQCYHG-UHFFFAOYSA-N	Cc1ccc(cc1)C2=NN(C(C2)c3cccs3)S(=O)(=O)C	BroadT	BRD-A62208588	BRD-A62208588-001-05-0	InterBioScreen Ltd.	STOCK3S-12224			Cc1ccc(cc1)C1=NN(C(C1)c1cccs1)S(C)(=O)=O	InChI=1S/C15H16N2O2S2/c1-11-5-7-12(8-6-11)13-10-14(15-4-3-9-20-15)17(16-13)21(2,18)19/h3-9,14H,10H2,1-2H3	IOUORVYECQCYHG-UHFFFAOYSA-N	320.065319152							104940
AC1LDF9L	LSM-16304	SID864858, SID24841103, BRD-A66955073	666106	InChI=1S/C23H20Cl2N4O4/c1-10-14(25)7-6-13-19(10)27-22(33)23(13)18-17(15(28-23)8-9-16(26)30)20(31)29(21(18)32)12-4-2-11(24)3-5-12/h2-7,15,17-18,28H,8-9H2,1H3,(H2,26,30)(H,27,33)/t15?,17-,18+,23?/m1/s1	CGJBTXKHANZNPI-IBBBCHJRSA-N	Cc1c(Cl)ccc2c1NC(=O)C23NC(CCC(=O)N)[C@@H]4[C@H]3C(=O)N(C4=O)c5ccc(Cl)cc5	BroadT	BRD-A66955073	BRD-A66955073-001-06-2	InterBioScreen Ltd.	STOCK5S-31622			Cc1c2NC(=O)C3(NC(CCC(N)=O)[C@@H]4[C@H]3C(=O)N(C4=O)c3ccc(Cl)cc3)c2ccc1Cl	InChI=1S/C23H20Cl2N4O4/c1-10-14(25)7-6-13-19(10)27-22(33)23(13)18-17(15(28-23)8-9-16(26)30)20(31)29(21(18)32)12-4-2-11(24)3-5-12/h2-7,15,17-18,28H,8-9H2,1H3,(H2,26,30)(H,27,33)/t15?,17-,18+,23?/m1/s1	CGJBTXKHANZNPI-IBBBCHJRSA-N	486.08616058							104941
AC1MEFIP	LSM-15247	BRD-A01392766	2854383	InChI=1S/C17H21NO/c1-13(18(2)3)15-11-7-8-12-16(15)17(19)14-9-5-4-6-10-14/h4-13,17,19H,1-3H3	LISUDWGNQOAYJR-UHFFFAOYSA-N	CC(N(C)C)c1ccccc1C(O)c2ccccc2	BroadT	BRD-A01392766	BRD-A01392766-003-05-6	ChemBridge Corporation	5587546		Cl	CC(N(C)C)c1ccccc1C(O)c1ccccc1.Cl	InChI=1S/C17H21NO.ClH/c1-13(18(2)3)15-11-7-8-12-16(15)17(19)14-9-5-4-6-10-14;/h4-13,17,19H,1-3H3;1H	HDEICIRYLLADJB-UHFFFAOYSA-N	255.162314302							103894, 103894
SMR000068226	LSM-16305	SID24839814, SID3715378, BRD-K57265891	2999180	InChI=1S/C23H27N5O5/c1-13(2)11-27-20(24)19(21(30)26(5)23(27)32)17(29)12-33-22(31)18-14(3)25-28(15(18)4)16-9-7-6-8-10-16/h6-10,13H,11-12,24H2,1-5H3	NACPWEHVMXMKDT-UHFFFAOYSA-N	CC(C)CN1C(=C(C(=O)COC(=O)c2c(C)nn(c2C)c3ccccc3)C(=O)N(C)C1=O)N	BroadT	BRD-K57265891	BRD-K57265891-001-05-7	Enamine Ltd.	T5338934			CC(C)Cn1c(N)c(C(=O)COC(=O)c2c(C)nn(c2C)-c2ccccc2)c(=O)n(C)c1=O	InChI=1S/C23H27N5O5/c1-13(2)11-27-20(24)19(21(30)26(5)23(27)32)17(29)12-33-22(31)18-14(3)25-28(15(18)4)16-9-7-6-8-10-16/h6-10,13H,11-12,24H2,1-5H3	NACPWEHVMXMKDT-UHFFFAOYSA-N	453.201219014							104942
F0550-0092	LSM-16306	SID4246958, BRD-K97865195	3241234	InChI=1S/C14H11N3O4S/c18-12(9-6-15-14-17(13(9)19)3-4-22-14)16-8-1-2-10-11(5-8)21-7-20-10/h1-2,5-6H,3-4,7H2,(H,16,18)	JWYBEWDLIGFPPQ-UHFFFAOYSA-N	O=C(Nc1ccc2OCOc2c1)C3=CN=C4SCCN4C3=O	BroadT	BRD-K97865195	BRD-K97865195-001-05-9	ChemDiv Inc.	C057-0092			O=C(Nc1ccc2OCOc2c1)c1cnc2SCCn2c1=O	InChI=1S/C14H11N3O4S/c18-12(9-6-15-14-17(13(9)19)3-4-22-14)16-8-1-2-10-11(5-8)21-7-20-10/h1-2,5-6H,3-4,7H2,(H,16,18)	JWYBEWDLIGFPPQ-UHFFFAOYSA-N	317.047026552							104943
1-Benzyl-3-(3-chlorophenyl)thiourea	LSM-16307	SID22411915, BRD-K80963099	826714	InChI=1S/C14H13ClN2S/c15-12-7-4-8-13(9-12)17-14(18)16-10-11-5-2-1-3-6-11/h1-9H,10H2,(H2,16,17,18)	KHNANZQXGXUCGP-UHFFFAOYSA-N	Clc1cccc(NC(=S)NCc2ccccc2)c1	BroadT	BRD-K80963099	BRD-K80963099-001-05-8	Specs	AE-641/01074053			Clc1cccc(NC(=S)NCc2ccccc2)c1	InChI=1S/C14H13ClN2S/c15-12-7-4-8-13(9-12)17-14(18)16-10-11-5-2-1-3-6-11/h1-9H,10H2,(H2,16,17,18)	KHNANZQXGXUCGP-UHFFFAOYSA-N	276.048796836							104944
AC1NDVP1	LSM-16308	BRD-A69937311	4582405	InChI=1S/C13H12N4O4/c18-16(19)9-4-5-11(13(7-9)17(20)21)14-15-12-6-8-2-1-3-10(8)12/h1,3-5,7-8,10,14H,2,6H2	GCEQJUADWFNJDR-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NN=C2CC3CC=CC23)c(c1)[N+](=O)[O-]	BroadT	BRD-A69937311	BRD-A69937311-001-05-1	Enamine Ltd.	T0516-9218			[O-][N+](=O)c1ccc(NN=C2CC3CC=CC23)c(c1)[N+]([O-])=O	InChI=1S/C13H12N4O4/c18-16(19)9-4-5-11(13(7-9)17(20)21)14-15-12-6-8-2-1-3-10(8)12/h1,3-5,7-8,10,14H,2,6H2	GCEQJUADWFNJDR-UHFFFAOYSA-N	288.085854904							104945
MLS001122582	LSM-16309	SID24416920, SID49731706, BRD-K34150991	16034617	InChI=1S/C22H24FN3O5S/c23-17-6-4-16(5-7-17)13-24-21(27)14-26-19-12-18(8-9-20(19)31-15-22(26)28)32(29,30)25-10-2-1-3-11-25/h4-9,12H,1-3,10-11,13-15H2,(H,24,27)	GTLAKEZRKNIXKK-UHFFFAOYSA-N	Fc1ccc(CNC(=O)CN2C(=O)COc3ccc(cc23)S(=O)(=O)N4CCCCC4)cc1	BroadT	BRD-K34150991	BRD-K34150991-001-06-6	ChemDiv Inc.	E589-1353			Fc1ccc(CNC(=O)CN2C(=O)COc3ccc(cc23)S(=O)(=O)N2CCCCC2)cc1	InChI=1S/C22H24FN3O5S/c23-17-6-4-16(5-7-17)13-24-21(27)14-26-19-12-18(8-9-20(19)31-15-22(26)28)32(29,30)25-10-2-1-3-11-25/h4-9,12H,1-3,10-11,13-15H2,(H,24,27)	GTLAKEZRKNIXKK-UHFFFAOYSA-N	461.142069788							104946
T5239576	LSM-16310	SID3715805, BRD-A99020234	2999361	InChI=1S/C21H21NO6S/c1-22(14-10-11-29(25,26)13-14)19(23)12-27-21(24)20-15-6-2-4-8-17(15)28-18-9-5-3-7-16(18)20/h2-9,14,20H,10-13H2,1H3	OEVTZSJQEOGMBK-UHFFFAOYSA-N	CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)C2c3ccccc3Oc4ccccc24	BroadT	BRD-A99020234	BRD-A99020234-001-05-4	Enamine Ltd.	T5239576			CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)C1c2ccccc2Oc2ccccc12	InChI=1S/C21H21NO6S/c1-22(14-10-11-29(25,26)13-14)19(23)12-27-21(24)20-15-6-2-4-8-17(15)28-18-9-5-3-7-16(18)20/h2-9,14,20H,10-13H2,1H3	OEVTZSJQEOGMBK-UHFFFAOYSA-N	415.108958092							104947
F5791-2458	LSM-16311	SID843958, BRD-K61396432	646264	InChI=1S/C16H18N4O2/c1-12-10-18-15(11-17-12)16(21)19-13-2-4-14(5-3-13)20-6-8-22-9-7-20/h2-5,10-11H,6-9H2,1H3,(H,19,21)	MRKTVQZUQWLCPD-UHFFFAOYSA-N	Cc1cnc(cn1)C(=O)Nc2ccc(cc2)N3CCOCC3	BroadT	BRD-K61396432	BRD-K61396432-001-05-0	Asinex Ltd.	ASN 06977449			Cc1cnc(cn1)C(=O)Nc1ccc(cc1)N1CCOCC1	InChI=1S/C16H18N4O2/c1-12-10-18-15(11-17-12)16(21)19-13-2-4-14(5-3-13)20-6-8-22-9-7-20/h2-5,10-11H,6-9H2,1H3,(H,19,21)	MRKTVQZUQWLCPD-UHFFFAOYSA-N	298.142975856							104948
MLS000556823	LSM-16312	SID17408356, BRD-K76905369	3221601	InChI=1S/C20H25N5O3S/c1-2-26-8-4-7-24-20(29)23-6-3-5-22-19-15(12-21)9-14-10-17-18(28-13-27-17)11-16(14)25-19/h9-11H,2-8,13H2,1H3,(H,22,25)(H2,23,24,29)	RSOYCKZHDINCSE-UHFFFAOYSA-N	CCOCCCN=C(S)NCCCNc1nc2cc3OCOc3cc2cc1C#N	BroadT	BRD-K76905369	BRD-K76905369-001-06-6	Asinex Ltd.	ASN 06537036			CCOCCCN=C(S)NCCCNc1nc2cc3OCOc3cc2cc1C#N	InChI=1S/C20H25N5O3S/c1-2-26-8-4-7-24-20(29)23-6-3-5-22-19-15(12-21)9-14-10-17-18(28-13-27-17)11-16(14)25-19/h9-11H,2-8,13H2,1H3,(H,22,25)(H2,23,24,29)	RSOYCKZHDINCSE-UHFFFAOYSA-N	415.1678104							104949
AF-399/42810488	LSM-16313	SID24816591, BRD-A66672006	4648501	InChI=1S/C16H13N3O2S/c1-10-4-6-11(7-5-10)19-14(13-3-2-8-21-13)18-15(20)12(9-17)16(19)22/h2-8,14,22H,1H3,(H,18,20)	VFIRJYJMECEAGF-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(NC(=O)C(=C2S)C#N)c3occc3	BroadT	BRD-A66672006	BRD-A66672006-001-06-5	Life Chemicals Inc.	F1762-0056			Cc1ccc(cc1)N1C(NC(=O)C(C#N)=C1S)c1ccco1	InChI=1S/C16H13N3O2S/c1-10-4-6-11(7-5-10)19-14(13-3-2-8-21-13)18-15(20)12(9-17)16(19)22/h2-8,14,22H,1H3,(H,18,20)	VFIRJYJMECEAGF-UHFFFAOYSA-N	311.072847376							104950
SMR000203628	LSM-43635	SID17509688, BRD-K82427190	12004938	InChI=1S/C22H23N3O3/c1-4-28-21(26)15-20-19(14-16-10-12-17(13-11-16)24(2)3)22(27)25(23-20)18-8-6-5-7-9-18/h5-14H,4,15H2,1-3H3/b19-14-	QQKRCQSFGQFOBF-RGEXLXHISA-N	CCOC(=O)CC1=NN(C(=O)/C/1=C\c2ccc(cc2)N(C)C)c3ccccc3	BroadT	BRD-K82427190	BRD-K82427190-001-05-0	ChemDiv Inc.	2339-2145			CCOC(=O)CC1=NN(C(=O)C\1=C/c1ccc(cc1)N(C)C)c1ccccc1	InChI=1S/C22H23N3O3/c1-4-28-21(26)15-20-19(14-16-10-12-17(13-11-16)24(2)3)22(27)25(23-20)18-8-6-5-7-9-18/h5-14H,4,15H2,1-3H3/b19-14-	QQKRCQSFGQFOBF-RGEXLXHISA-N	377.173941626							
AC1MEMG9	LSM-16315	SID17413530, BRD-K62741448	2880644	InChI=1S/C17H17N3O5/c1-11-7-8-13(9-14(11)20(22)23)17(21)25-19-16(18)10-12-5-3-4-6-15(12)24-2/h3-9H,10H2,1-2H3,(H2,18,19)	XKNMHYBWPOWHGN-UHFFFAOYSA-N	COc1ccccc1CC(=N)NOC(=O)c2ccc(C)c(c2)[N+](=O)[O-]	BroadT	BRD-K62741448	BRD-K62741448-001-05-8	ChemBridge Corporation	6014017			COc1ccccc1CC(=N)NOC(=O)c1ccc(C)c(c1)[N+]([O-])=O	InChI=1S/C17H17N3O5/c1-11-7-8-13(9-14(11)20(22)23)17(21)25-19-16(18)10-12-5-3-4-6-15(12)24-2/h3-9H,10H2,1-2H3,(H2,18,19)	XKNMHYBWPOWHGN-UHFFFAOYSA-N	343.116820674							104952
ST50193829	LSM-43636	SID17414585, BRD-K68321212	1568082	InChI=1S/C25H25NO/c1-3-20-16-11-17-21(4-2)24(20)26-25(27)23(22-14-9-6-10-15-22)18-19-12-7-5-8-13-19/h5-18H,3-4H2,1-2H3,(H,26,27)/b23-18+	MGCQYWNPOGORCE-PTGBLXJZSA-N	CCc1cccc(CC)c1NC(=O)\C(=C\c2ccccc2)\c3ccccc3	BroadT	BRD-K68321212	BRD-K68321212-001-05-7	ChemBridge Corporation	7154829			CCc1cccc(CC)c1NC(=O)C(=C\c1ccccc1)\c1ccccc1	InChI=1S/C25H25NO/c1-3-20-16-11-17-21(4-2)24(20)26-25(27)23(22-14-9-6-10-15-22)18-19-12-7-5-8-13-19/h5-18H,3-4H2,1-2H3,(H,26,27)/b23-18+	MGCQYWNPOGORCE-PTGBLXJZSA-N	355.19361443							
N-(1,2-Oxazol-3-yl)-1,3-benzodioxole-5-carboxamide	LSM-16317	SID4259356, BRD-K57021862	1246565	InChI=1S/C11H8N2O4/c14-11(12-10-3-4-17-13-10)7-1-2-8-9(5-7)16-6-15-8/h1-5H,6H2,(H,12,13,14)	JSXLYSPMECKBPV-UHFFFAOYSA-N	O=C(Nc1ccon1)c2ccc3OCOc3c2	BroadT	BRD-K57021862	BRD-K57021862-001-05-9	ChemBridge Corporation	7947325			O=C(Nc1ccon1)c1ccc2OCOc2c1	InChI=1S/C11H8N2O4/c14-11(12-10-3-4-17-13-10)7-1-2-8-9(5-7)16-6-15-8/h1-5H,6H2,(H,12,13,14)	JSXLYSPMECKBPV-UHFFFAOYSA-N	232.048406756							104954
ST50841141	LSM-16318	SID49823713, BRD-K15877150	17368185	InChI=1S/C17H26N2S/c1-2-3-11-18-17(20)19-12-9-16(10-13-19)14-15-7-5-4-6-8-15/h4-8,16H,2-3,9-14H2,1H3,(H,18,20)	RXZANCNFWBVRQU-UHFFFAOYSA-N	CCCCN=C(S)N1CCC(Cc2ccccc2)CC1	BroadT	BRD-K15877150	BRD-K15877150-001-05-6	Chemical Technologies & Investigations	UZI/1254049			CCCCN=C(S)N1CCC(Cc2ccccc2)CC1	InChI=1S/C17H26N2S/c1-2-3-11-18-17(20)19-12-9-16(10-13-19)14-15-7-5-4-6-8-15/h4-8,16H,2-3,9-14H2,1H3,(H,18,20)	RXZANCNFWBVRQU-UHFFFAOYSA-N	290.181669542							104955
AC1OA268	LSM-16319	SID24809148, BRD-K50326094	6744823	InChI=1S/C14H16N4O3S/c19-11-4-2-1-3-10(11)13-15-14(17-16-13)22-9-12(20)18-5-7-21-8-6-18/h1-4,19H,5-9H2,(H,15,16,17)	BDJSVXDKRKVZEJ-UHFFFAOYSA-N	Oc1ccccc1c2n[nH]c(SCC(=O)N3CCOCC3)n2	BroadT	BRD-K50326094	BRD-K50326094-001-05-9	Asinex Ltd.	ASN 01516429			Oc1ccccc1-c1n[nH]c(SCC(=O)N2CCOCC2)n1	InChI=1S/C14H16N4O3S/c19-11-4-2-1-3-10(11)13-15-14(17-16-13)22-9-12(20)18-5-7-21-8-6-18/h1-4,19H,5-9H2,(H,15,16,17)	BDJSVXDKRKVZEJ-UHFFFAOYSA-N	320.094311102							
STK238251	LSM-16320	SID17510949, BRD-K38331236	3537138	InChI=1S/C24H17NO7S2/c1-2-30-15-9-11-16(12-10-15)34(28,29)25(23(26)20-8-5-13-31-20)19-14-21-22(32-24(27)33-21)18-7-4-3-6-17(18)19/h3-14H,2H2,1H3	FVXSWPYGLOZBBR-UHFFFAOYSA-N	CCOc1ccc(cc1)S(=O)(=O)N(C(=O)c2occc2)c3cc4SC(=O)Oc4c5ccccc35	BroadT	BRD-K38331236	BRD-K38331236-001-06-3	ChemDiv Inc.	6807-0686			CCOc1ccc(cc1)S(=O)(=O)N(C(=O)c1ccco1)c1cc2sc(=O)oc2c2ccccc12	InChI=1S/C24H17NO7S2/c1-2-30-15-9-11-16(12-10-15)34(28,29)25(23(26)20-8-5-13-31-20)19-14-21-22(32-24(27)33-21)18-7-4-3-6-17(18)19/h3-14H,2H2,1H3	FVXSWPYGLOZBBR-UHFFFAOYSA-N	495.044643274							104957
STK521471	LSM-16321	SID7977394, BRD-K64069341	5310882	InChI=1S/C13H10N4OS/c1-2-7-19-13-15-12-11(16-17-13)9-5-3-4-6-10(9)14-8-18-12/h2-6,8H,1,7H2	TWOXIZRBEBZPRL-UHFFFAOYSA-N	C=CCSc1nnc2c(OC=Nc3ccccc23)n1	BroadT	BRD-K64069341	BRD-K64069341-001-05-0	ChemBridge Corporation	7011902			C=CCSc1nnc-2c(OC=Nc3ccccc-23)n1	InChI=1S/C13H10N4OS/c1-2-7-19-13-15-12-11(16-17-13)9-5-3-4-6-10(9)14-8-18-12/h2-6,8H,1,7H2	TWOXIZRBEBZPRL-UHFFFAOYSA-N	270.05753167							104958
ZINC02620594	LSM-16322	SID22405713, BRD-K55853808	2082451	InChI=1S/C18H15ClN4OS2/c1-10-9-25-18(20-10)21-16(24)15-7-13-11(2)22-23(17(13)26-15)8-12-5-3-4-6-14(12)19/h3-7,9H,8H2,1-2H3,(H,20,21,24)	URQLTMDNUYNNRB-UHFFFAOYSA-N	Cc1csc(NC(=O)c2cc3c(C)nn(Cc4ccccc4Cl)c3s2)n1	BroadT	BRD-K55853808	BRD-K55853808-001-06-2	Enamine Ltd.	T5260249			Cc1csc(NC(=O)c2cc3c(C)nn(Cc4ccccc4Cl)c3s2)n1	InChI=1S/C18H15ClN4OS2/c1-10-9-25-18(20-10)21-16(24)15-7-13-11(2)22-23(17(13)26-15)8-12-5-3-4-6-14(12)19/h3-7,9H,8H2,1-2H3,(H,20,21,24)	URQLTMDNUYNNRB-UHFFFAOYSA-N	402.03758023							104959
SMR000171000	LSM-16323	SID17508229, BRD-A87550446	3192114	InChI=1S/C27H34N4O3S/c1-5-30-12-6-7-21(30)17-31(27(35)29-23-11-10-22(33-3)15-25(23)34-4)16-20-14-19-9-8-18(2)13-24(19)28-26(20)32/h8-11,13-15,21H,5-7,12,16-17H2,1-4H3,(H,28,32)(H,29,35)	KXNWGWWYNFNKJS-UHFFFAOYSA-N	CCN1CCCC1CN(Cc2cc3ccc(C)cc3nc2O)C(=Nc4ccc(OC)cc4OC)S	BroadT	BRD-A87550446	BRD-A87550446-001-06-6	Asinex Ltd.	ASN 04887552			CCN1CCCC1CN(Cc1cc2ccc(C)cc2nc1O)C(S)=Nc1ccc(OC)cc1OC	InChI=1S/C27H34N4O3S/c1-5-30-12-6-7-21(30)17-31(27(35)29-23-11-10-22(33-3)15-25(23)34-4)16-20-14-19-9-8-18(2)13-24(19)28-26(20)32/h8-11,13-15,21H,5-7,12,16-17H2,1-4H3,(H,28,32)(H,29,35)	KXNWGWWYNFNKJS-UHFFFAOYSA-N	494.235161678							104960
MLS000911950	LSM-16324	SID49648878, BRD-K43909206	11637235	InChI=1S/C14H10N4/c1-2-6-11(7-3-1)13-10-16-18-14(17-13)12-8-4-5-9-15-12/h1-10H	PQIPAPNLNPLMLK-UHFFFAOYSA-N	c1ccc(cc1)c2cnnc(n2)c3ccccn3	BroadT	BRD-K43909206	BRD-K43909206-001-05-7	University of California at Davis	LY-SH3-001			c1ccc(cc1)-c1cnnc(n1)-c1ccccn1	InChI=1S/C14H10N4/c1-2-6-11(7-3-1)13-10-16-18-14(17-13)12-8-4-5-9-15-12/h1-10H	PQIPAPNLNPLMLK-UHFFFAOYSA-N	234.09054636							104961
SMR000242495	LSM-43637	SID17516869, BRD-K16703109	6520828	InChI=1S/C18H13ClN2O4S/c19-13-7-5-11(10-15(13)21(24)25)9-12(6-8-17(22)23)18-20-14-3-1-2-4-16(14)26-18/h1-5,7,9-10H,6,8H2,(H,22,23)/b12-9+	GHVAFTZKRDDKEC-FMIVXFBMSA-N	OC(=O)CC\C(=C/c1ccc(Cl)c(c1)[N+](=O)[O-])\c2nc3ccccc3s2	BroadT	BRD-K16703109	BRD-K16703109-001-05-5	Enamine Ltd.	T0520-4707			OC(=O)CC\C(=C/c1ccc(Cl)c(c1)[N+]([O-])=O)c1nc2ccccc2s1	InChI=1S/C18H13ClN2O4S/c19-13-7-5-11(10-15(13)21(24)25)9-12(6-8-17(22)23)18-20-14-3-1-2-4-16(14)26-18/h1-5,7,9-10H,6,8H2,(H,22,23)/b12-9+	GHVAFTZKRDDKEC-FMIVXFBMSA-N	388.028455316							
T0510-9919	LSM-16326	SID26670031, BRD-K41249664	2338868	InChI=1S/C19H23N3O5S/c1-4-26-18(24)15-12(3)16(19(25)27-5-2)28-17(15)22-14(23)11-20-10-13-8-6-7-9-21-13/h6-9,20H,4-5,10-11H2,1-3H3,(H,22,23)	HKJUYDIDBIUBLJ-UHFFFAOYSA-N	CCOC(=O)c1sc(NC(=O)CNCc2ccccn2)c(C(=O)OCC)c1C	BroadT	BRD-K41249664	BRD-K41249664-001-07-1	Enamine Ltd.	T0510-9919			CCOC(=O)c1sc(NC(=O)CNCc2ccccn2)c(C(=O)OCC)c1C	InChI=1S/C19H23N3O5S/c1-4-26-18(24)15-12(3)16(19(25)27-5-2)28-17(15)22-14(23)11-20-10-13-8-6-7-9-21-13/h6-9,20H,4-5,10-11H2,1-3H3,(H,22,23)	HKJUYDIDBIUBLJ-UHFFFAOYSA-N	405.135841556							104963
MLS000592022	LSM-43638	SID24791523, BRD-K49134164	5418979	InChI=1S/C16H11FN2O3S/c17-11-5-3-10(4-6-11)9-19-15(21)13(14(20)18-16(19)22)8-12-2-1-7-23-12/h1-8H,9H2,(H,18,20,22)/b13-8+	GYIGZACWAPWURC-MDWZMJQESA-N	Fc1ccc(CN2C(=O)NC(=O)\C(=C/c3cccs3)\C2=O)cc1	BroadT	BRD-K49134164	BRD-K49134164-001-05-6	InterBioScreen Ltd.	STOCK1S-83728			Fc1ccc(CN2C(=O)NC(=O)\C(=C/c3cccs3)C2=O)cc1	InChI=1S/C16H11FN2O3S/c17-11-5-3-10(4-6-11)9-19-15(21)13(14(20)18-16(19)22)8-12-2-1-7-23-12/h1-8H,9H2,(H,18,20,22)/b13-8+	GYIGZACWAPWURC-MDWZMJQESA-N	330.047441122							
1-(4-Chlorophenyl)-3-phenethylthiourea	LSM-16328	SID17432768, BRD-K11219328	878760	InChI=1S/C15H15ClN2S/c16-13-6-8-14(9-7-13)18-15(19)17-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H2,17,18,19)	KSLZSPRUTHUAOA-UHFFFAOYSA-N	Clc1ccc(NC(=S)NCCc2ccccc2)cc1	BroadT	BRD-K11219328	BRD-K11219328-001-05-2	ChemBridge Corporation	6048718			Clc1ccc(NC(=S)NCCc2ccccc2)cc1	InChI=1S/C15H15ClN2S/c16-13-6-8-14(9-7-13)18-15(19)17-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H2,17,18,19)	KSLZSPRUTHUAOA-UHFFFAOYSA-N	290.0644469							104965
MLS000032393	LSM-16329	SID845473, SID26667759, BRD-K42671663	647823	InChI=1S/C26H26N6O3/c1-18-9-10-23-20(12-18)13-21(26(33)27-23)15-31(14-19-6-3-4-8-24(19)34-2)17-25-28-29-30-32(25)16-22-7-5-11-35-22/h3-13H,14-17H2,1-2H3,(H,27,33)	BMDSAZDIDMDPRU-UHFFFAOYSA-N	COc1ccccc1CN(Cc2cc3cc(C)ccc3nc2O)Cc4nnnn4Cc5occc5	BroadT	BRD-K42671663	BRD-K42671663-001-05-0	Asinex Ltd.	ASN 05303840			COc1ccccc1CN(Cc1nnnn1Cc1ccco1)Cc1cc2cc(C)ccc2nc1O	InChI=1S/C26H26N6O3/c1-18-9-10-23-20(12-18)13-21(26(33)27-23)15-31(14-19-6-3-4-8-24(19)34-2)17-25-28-29-30-32(25)16-22-7-5-11-35-22/h3-13H,14-17H2,1-2H3,(H,27,33)	BMDSAZDIDMDPRU-UHFFFAOYSA-N	470.206638752							104966
ZINC00534085	LSM-16330	SID862284, BRD-K43526091	663507	InChI=1S/C17H13N3O2/c18-10-14-17(22-16(19-14)15-6-3-9-21-15)20-8-7-12-4-1-2-5-13(12)11-20/h1-6,9H,7-8,11H2	LNROJYWTBBRMMG-UHFFFAOYSA-N	N#Cc1nc(oc1N2CCc3ccccc3C2)c4occc4	BroadT	BRD-K43526091	BRD-K43526091-001-05-7	InterBioScreen Ltd.	STOCK4S-34843			N#Cc1nc(oc1N1CCc2ccccc2C1)-c1ccco1	InChI=1S/C17H13N3O2/c18-10-14-17(22-16(19-14)15-6-3-9-21-15)20-8-7-12-4-1-2-5-13(12)11-20/h1-6,9H,7-8,11H2	LNROJYWTBBRMMG-UHFFFAOYSA-N	291.100776686							104967
ST50599749	LSM-16331	SID22416175, BRD-K34212649	2917949	InChI=1S/C15H14ClFN2S/c16-12-3-1-11(2-4-12)9-10-18-15(20)19-14-7-5-13(17)6-8-14/h1-8H,9-10H2,(H2,18,19,20)	CAZHFDOAPGZBNA-UHFFFAOYSA-N	Fc1ccc(NC(=NCCc2ccc(Cl)cc2)S)cc1	BroadT	BRD-K34212649	BRD-K34212649-001-05-2	ChemBridge Corporation	6888588			Fc1ccc(NC(S)=NCCc2ccc(Cl)cc2)cc1	InChI=1S/C15H14ClFN2S/c16-12-3-1-11(2-4-12)9-10-18-15(20)19-14-7-5-13(17)6-8-14/h1-8H,9-10H2,(H2,18,19,20)	CAZHFDOAPGZBNA-UHFFFAOYSA-N	308.055025068							104968
F1835-0126	LSM-16332	SID7970639, BRD-K26579657	5310265	InChI=1S/C16H16N6O2S/c23-15(21-7-9-24-10-8-21)11-25-14-5-4-13-18-19-16(22(13)20-14)12-3-1-2-6-17-12/h1-6H,7-11H2	CTYRKPLSSZOQQY-UHFFFAOYSA-N	O=C(CSc1ccc2nnc(c3ccccn3)n2n1)N4CCOCC4	BroadT	BRD-K26579657	BRD-K26579657-001-05-3	Life Chemicals Inc.	F1835-0126			O=C(CSc1ccc2nnc(-c3ccccn3)n2n1)N1CCOCC1	InChI=1S/C16H16N6O2S/c23-15(21-7-9-24-10-8-21)11-25-14-5-4-13-18-19-16(22(13)20-14)12-3-1-2-6-17-12/h1-6H,7-11H2	CTYRKPLSSZOQQY-UHFFFAOYSA-N	356.105544502							104969
2-Allyl-6-phenyl-5-piperidino-3(2H)-pyridazinone	LSM-16333	SID24821606, BRD-K89949440	1472488	InChI=1S/C18H21N3O/c1-2-11-21-17(22)14-16(20-12-7-4-8-13-20)18(19-21)15-9-5-3-6-10-15/h2-3,5-6,9-10,14H,1,4,7-8,11-13H2	CUXLJZCGLQCOFH-UHFFFAOYSA-N	C=CCN1N=C(C(=CC1=O)N2CCCCC2)c3ccccc3	BroadT	BRD-K89949440	BRD-K89949440-001-05-4	Key Organics Ltd.	2R-1083			C=CCn1nc(-c2ccccc2)c(cc1=O)N1CCCCC1	InChI=1S/C18H21N3O/c1-2-11-21-17(22)14-16(20-12-7-4-8-13-20)18(19-21)15-9-5-3-6-10-15/h2-3,5-6,9-10,14H,1,4,7-8,11-13H2	CUXLJZCGLQCOFH-UHFFFAOYSA-N	295.168462322							104970
MLS000723430	LSM-16334	SID24782515, BRD-K57676691	7178340	InChI=1S/C20H15NO2/c22-19-16-10-4-8-15-9-5-11-17(18(15)16)20(23)21(19)13-12-14-6-2-1-3-7-14/h1-11H,12-13H2	ZFDSPMWGSWVSQU-UHFFFAOYSA-N	O=C1N(CCc2ccccc2)C(=O)c3cccc4cccc1c34	BroadT	BRD-K57676691	BRD-K57676691-001-05-7	ChemDiv Inc.	2248-4241			O=C1N(CCc2ccccc2)C(=O)c2cccc3cccc1c23	InChI=1S/C20H15NO2/c22-19-16-10-4-8-15-9-5-11-17(18(15)16)20(23)21(19)13-12-14-6-2-1-3-7-14/h1-11H,12-13H2	ZFDSPMWGSWVSQU-UHFFFAOYSA-N	301.11027873							104971
STK135081	LSM-16335	SID849079, BRD-K06896536	651550	InChI=1S/C14H12N2O3S/c17-13(15-8-10-4-3-7-19-10)9-16-11-5-1-2-6-12(11)20-14(16)18/h1-7H,8-9H2,(H,15,17)	ZWORGDNNQOELMA-UHFFFAOYSA-N	O=C(CN1C(=O)Sc2ccccc12)NCc3occc3	BroadT	BRD-K06896536	BRD-K06896536-001-06-0	Asinex Ltd.	BAS 06207872			O=C(Cn1c2ccccc2sc1=O)NCc1ccco1	InChI=1S/C14H12N2O3S/c17-13(15-8-10-4-3-7-19-10)9-16-11-5-1-2-6-12(11)20-14(16)18/h1-7H,8-9H2,(H,15,17)	ZWORGDNNQOELMA-UHFFFAOYSA-N	288.056862954							104972
AC1M04DL	LSM-16336	BRD-K68917053	1966234	InChI=1S/C11H7BrN4O3S/c12-8-3-7(4-13-5-8)11(17)15-14-6-9-1-2-10(20-9)16(18)19/h1-6H,(H,15,17)	YEDSXCJEAFAHKT-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(C=NNC(=O)c2cncc(Br)c2)s1	BroadT	BRD-K68917053	BRD-K68917053-001-08-8	InterBioScreen Ltd.	STOCK3S-01104			[O-][N+](=O)c1ccc(C=NNC(=O)c2cncc(Br)c2)s1	InChI=1S/C11H7BrN4O3S/c12-8-3-7(4-13-5-8)11(17)15-14-6-9-1-2-10(20-9)16(18)19/h1-6H,(H,15,17)	YEDSXCJEAFAHKT-UHFFFAOYSA-N	353.942223414							104973
AC1LCINH	LSM-16337	SID848368, BRD-K95180570	650814	InChI=1S/C21H22ClN3O3/c1-14-5-2-6-15-11-16(20(27)24-19(14)15)13-25(9-4-10-26)21(28)23-18-8-3-7-17(22)12-18/h2-3,5-8,11-12,26H,4,9-10,13H2,1H3,(H,23,28)(H,24,27)	FQTWCLMMQRCMNF-UHFFFAOYSA-N	Cc1cccc2cc(CN(CCCO)C(=O)Nc3cccc(Cl)c3)c(O)nc12	BroadT	BRD-K95180570	BRD-K95180570-001-05-0	Asinex Ltd.	ASN 05110846			Cc1cccc2cc(CN(CCCO)C(=O)Nc3cccc(Cl)c3)c(O)nc12	InChI=1S/C21H22ClN3O3/c1-14-5-2-6-15-11-16(20(27)24-19(14)15)13-25(9-4-10-26)21(28)23-18-8-3-7-17(22)12-18/h2-3,5-8,11-12,26H,4,9-10,13H2,1H3,(H,23,28)(H,24,27)	FQTWCLMMQRCMNF-UHFFFAOYSA-N	399.134969304							104974
F1740-0377	LSM-16338	SID24824328, BRD-A46655065	16195715	InChI=1S/C9H10N6O4S2/c10-7(18)12-5(16)1-3-6(17)13-8(21-3)15-14-4-2-20-9(19)11-4/h3H,1-2H2,(H,11,14,19)(H,13,15,17)(H3,10,12,16,18)	YNCBFINXNOSFCM-UHFFFAOYSA-N	NC(=O)NC(=O)CC1SC(=NC1=O)NN=C2CSC(=O)N2	BroadT	BRD-A46655065	BRD-A46655065-001-05-5	Life Chemicals Inc.	F1740-0377			NC(=O)NC(=O)CC1SC(NN=C2CSC(=O)N2)=NC1=O	InChI=1S/C9H10N6O4S2/c10-7(18)12-5(16)1-3-6(17)13-8(21-3)15-14-4-2-20-9(19)11-4/h3H,1-2H2,(H,11,14,19)(H,13,15,17)(H3,10,12,16,18)	YNCBFINXNOSFCM-UHFFFAOYSA-N	330.02049424							104975
AC1N60YX	LSM-15606	BRD-K26925032	4252610	InChI=1S/C18H16N4O2/c1-13(20-21-16-6-2-15(3-7-16)18(23)24)14-4-8-17(9-5-14)22-11-10-19-12-22/h2-12,21H,1H3,(H,23,24)	WEMUNNMUGUQEJO-UHFFFAOYSA-N	CC(=NNc1ccc(cc1)C(=O)O)c2ccc(cc2)n3ccnc3	BroadT	BRD-K26925032	BRD-K26925032-065-05-9	Enamine Ltd.	T0506-6599		OS(=O)(=O)O	CC(=NNc1ccc(cc1)C(O)=O)c1ccc(cc1)-n1ccnc1.OS(=O)(=O)O	InChI=1S/C18H16N4O2.H2O4S/c1-13(20-21-16-6-2-15(3-7-16)18(23)24)14-4-8-17(9-5-14)22-11-10-19-12-22;1-5(2,3)4/h2-12,21H,1H3,(H,23,24);(H2,1,2,3,4)	NOVNASSXQGVWLZ-UHFFFAOYSA-N	320.127325792							104241
ASN 04428371	LSM-16339	SID24806210, BRD-K08746927	1373890	InChI=1S/C18H21N3O4S/c1-4-6-13(22)21-17-14(18(24)25-3)10(2)15(26-17)16(23)20-12-8-5-7-11(19)9-12/h5,7-9H,4,6,19H2,1-3H3,(H,20,23)(H,21,22)	WFNIXDMUVPMPSZ-UHFFFAOYSA-N	CCCC(=O)Nc1sc(C(=O)Nc2cccc(N)c2)c(C)c1C(=O)OC	BroadT	BRD-K08746927	BRD-K08746927-001-05-4	Asinex Ltd.	ASN 04428371			CCCC(=O)Nc1sc(C(=O)Nc2cccc(N)c2)c(C)c1C(=O)OC	InChI=1S/C18H21N3O4S/c1-4-6-13(22)21-17-14(18(24)25-3)10(2)15(26-17)16(23)20-12-8-5-7-11(19)9-12/h5,7-9H,4,6,19H2,1-3H3,(H,20,23)(H,21,22)	WFNIXDMUVPMPSZ-UHFFFAOYSA-N	375.125276872							104976
ST50924448	LSM-16340	SID22416427, BRD-K18899449	2932793	InChI=1S/C14H13N3O5/c1-21-10-4-5-11(12(7-10)22-2)14(18)16-13-6-3-9(8-15-13)17(19)20/h3-8H,1-2H3,(H,15,16,18)	PMCHHSWNAPKHAU-UHFFFAOYSA-N	COc1ccc(C(=O)Nc2ccc(cn2)[N+](=O)[O-])c(OC)c1	BroadT	BRD-K18899449	BRD-K18899449-001-05-8	ChemBridge Corporation	7273394			COc1ccc(C(=O)Nc2ccc(cn2)[N+]([O-])=O)c(OC)c1	InChI=1S/C14H13N3O5/c1-21-10-4-5-11(12(7-10)22-2)14(18)16-13-6-3-9(8-15-13)17(19)20/h3-8H,1-2H3,(H,15,16,18)	PMCHHSWNAPKHAU-UHFFFAOYSA-N	303.085520546							104977
4-[4-(Tert-butyl)benzoyl]-n-[3-(1H-imidazol-1-yl)propyl]-1H-pyrrole-2-carboxamide	LSM-16341	SID17411160, BRD-K86210740	3851062	InChI=1S/C22H26N4O2/c1-22(2,3)18-7-5-16(6-8-18)20(27)17-13-19(25-14-17)21(28)24-9-4-11-26-12-10-23-15-26/h5-8,10,12-15,25H,4,9,11H2,1-3H3,(H,24,28)	DQOXDNAAMXCTPB-UHFFFAOYSA-N	CC(C)(C)c1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCCCn3ccnc3	BroadT	BRD-K86210740	BRD-K86210740-001-05-1	Key Organics Ltd.	7R-0270			CC(C)(C)c1ccc(cc1)C(=O)c1c[nH]c(c1)C(=O)NCCCn1ccnc1	InChI=1S/C22H26N4O2/c1-22(2,3)18-7-5-16(6-8-18)20(27)17-13-19(25-14-17)21(28)24-9-4-11-26-12-10-23-15-26/h5-8,10,12-15,25H,4,9,11H2,1-3H3,(H,24,28)	DQOXDNAAMXCTPB-UHFFFAOYSA-N	378.205576112							104978
T5275012	LSM-16342	SID3714520, BRD-K14971326	2089613	InChI=1S/C18H18N4O6S/c1-2-22-16(25)12-6-4-3-5-11(12)15(20-22)17(26)28-9-13(23)19-7-8-21-14(24)10-29-18(21)27/h3-6H,2,7-10H2,1H3,(H,19,23)	ZQEMYFLZPKZOIC-UHFFFAOYSA-N	CCN1N=C(C(=O)OCC(=O)NCCN2C(=O)CSC2=O)c3ccccc3C1=O	BroadT	BRD-K14971326	BRD-K14971326-001-05-7	Enamine Ltd.	T5275012			CCn1nc(C(=O)OCC(=O)NCCN2C(=O)CSC2=O)c2ccccc2c1=O	InChI=1S/C18H18N4O6S/c1-2-22-16(25)12-6-4-3-5-11(12)15(20-22)17(26)28-9-13(23)19-7-8-21-14(24)10-29-18(21)27/h3-6H,2,7-10H2,1H3,(H,19,23)	ZQEMYFLZPKZOIC-UHFFFAOYSA-N	418.094705026							104979
AC1MOD2E	LSM-16343	BRD-A08840157	3367199	InChI=1S/C14H23N3S/c1-9(2)16-13(18)17-15-8-10-5-6-11-7-12(10)14(11,3)4/h5,8-9,11-12H,6-7H2,1-4H3,(H2,16,17,18)	CFIYJXLBYHAXKF-UHFFFAOYSA-N	CC(C)N=C(S)NN=CC1=CCC2CC1C2(C)C	BroadT	BRD-A08840157	BRD-A08840157-001-05-8	Enamine Ltd.	T0509-1814			CC(C)N=C(S)NN=CC1=CCC2CC1C2(C)C	InChI=1S/C14H23N3S/c1-9(2)16-13(18)17-15-8-10-5-6-11-7-12(10)14(11,3)4/h5,8-9,11-12H,6-7H2,1-4H3,(H2,16,17,18)	CFIYJXLBYHAXKF-UHFFFAOYSA-N	265.161268456							104980
ST50839140	LSM-16344	SID49823953, BRD-A12288677	17264329	InChI=1S/C20H25FN2S/c1-4-14(2)17-7-9-18(10-8-17)15(3)23-20(24)22-13-16-5-11-19(21)12-6-16/h5-12,14-15H,4,13H2,1-3H3,(H2,22,23,24)	MLLCULQTRUENTM-UHFFFAOYSA-N	CCC(C)c1ccc(cc1)C(C)N=C(S)NCc2ccc(F)cc2	BroadT	BRD-A12288677	BRD-A12288677-001-05-5	Chemical Technologies & Investigations	AMNCS-10470			CCC(C)c1ccc(cc1)C(C)N=C(S)NCc1ccc(F)cc1	InChI=1S/C20H25FN2S/c1-4-14(2)17-7-9-18(10-8-17)15(3)23-20(24)22-13-16-5-11-19(21)12-6-16/h5-12,14-15H,4,13H2,1-3H3,(H2,22,23,24)	MLLCULQTRUENTM-UHFFFAOYSA-N	344.17224771							104981
1-Ethoxy-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one	LSM-16345	SID24790934, BRD-K79199064	672640	InChI=1S/C15H12N2O5/c1-2-21-12-7-9(17(19)20)8-13-14(12)15(18)16-10-5-3-4-6-11(10)22-13/h3-8H,2H2,1H3,(H,16,18)	GIJFMVRFLAXIGY-UHFFFAOYSA-N	CCOc1cc(cc2Oc3ccccc3NC(=O)c12)[N+](=O)[O-]	BroadT	BRD-K79199064	BRD-K79199064-001-05-3	ChemDiv Inc.	8011-6652			CCOc1cc(cc2Oc3ccccc3NC(=O)c12)[N+]([O-])=O	InChI=1S/C15H12N2O5/c1-2-21-12-7-9(17(19)20)8-13-14(12)15(18)16-10-5-3-4-6-11(10)22-13/h3-8H,2H2,1H3,(H,16,18)	GIJFMVRFLAXIGY-UHFFFAOYSA-N	300.074621504							104982
MLS001212408	LSM-16346	SID49643818, BRD-K40605750	54684069	InChI=1S/C18H15FN2O3/c1-2-21-14-10-6-3-7-11(14)16(22)15(18(21)24)17(23)20-13-9-5-4-8-12(13)19/h3-10,22H,2H2,1H3,(H,20,23)	PSDKLPHPFVFIKY-UHFFFAOYSA-N	CCN1C(=O)C(=C(O)c2ccccc12)C(=O)Nc3ccccc3F	BroadT	BRD-K40605750	BRD-K40605750-001-06-2	Asinex Ltd.	BAS 00141247			CCn1c2ccccc2c(O)c(C(=O)Nc2ccccc2F)c1=O	InChI=1S/C18H15FN2O3/c1-2-21-14-10-6-3-7-11(14)16(22)15(18(21)24)17(23)20-13-9-5-4-8-12(13)19/h3-10,22H,2H2,1H3,(H,20,23)	PSDKLPHPFVFIKY-UHFFFAOYSA-N	326.10667056							104983
AC1O13N8	LSM-43639	SID17511607, BRD-K47441643	6110673	InChI=1S/C16H15N3O3/c1-2-11-19-15(21)13(14(20)18-16(19)22)9-6-10-17-12-7-4-3-5-8-12/h2-10,17H,1,11H2,(H,18,20,22)/b10-6+,13-9-	QRTMCECGDOUPPM-ONRCZQTBSA-N	C=CCN1C(=O)NC(=O)\C(=C\C=C\Nc2ccccc2)\C1=O	BroadT	BRD-K47441643	BRD-K47441643-001-06-6	InterBioScreen Ltd.	STOCK2S-46879			C=CCN1C(=O)NC(=O)\C(=C\C=C\Nc2ccccc2)C1=O	InChI=1S/C16H15N3O3/c1-2-11-19-15(21)13(14(20)18-16(19)22)9-6-10-17-12-7-4-3-5-8-12/h2-10,17H,1,11H2,(H,18,20,22)/b10-6+,13-9-	QRTMCECGDOUPPM-ONRCZQTBSA-N	297.11134137							
BRD-A12380490	LSM-16348			InChI=1S/C28H28ClN3O3S/c1-5-15-31-17-32(23-12-7-6-11-22(23)31)26(28(36)30-21-10-8-9-20(29)18(21)2)27(33)19-13-14-24(34-3)25(16-19)35-4/h6-14,16-17,26H,5,15H2,1-4H3/p+1	KDKYHLKGBVCGMU-UHFFFAOYSA-O	CCC[n+]1cn(C(C(=Nc2cccc(Cl)c2C)S)C(=O)c3ccc(OC)c(OC)c3)c4ccccc14	BroadT	BRD-A12380490	BRD-A12380490-001-05-5	Enamine Ltd.	T0517-7322			CCC[n+]1cn(C(C(S)=Nc2cccc(Cl)c2C)C(=O)c2ccc(OC)c(OC)c2)c2ccccc12	InChI=1S/C28H28ClN3O3S/c1-5-15-31-17-32(23-12-7-6-11-22(23)31)26(28(36)30-21-10-8-9-20(29)18(21)2)27(33)19-13-14-24(34-3)25(16-19)35-4/h6-14,16-17,26H,5,15H2,1-4H3/p+1	KDKYHLKGBVCGMU-UHFFFAOYSA-O	522.161815218							104985
SMR000031834	LSM-16349	SID4247642, BRD-K75358000	3241823	InChI=1S/C18H21NO5S/c1-12-15-11-14(7-8-16(15)24-17(12)18(20)21)25(22,23)19-10-9-13-5-3-2-4-6-13/h5,7-8,11,19H,2-4,6,9-10H2,1H3,(H,20,21)	VHYQGOIDOVHQGX-UHFFFAOYSA-N	Cc1c(oc2ccc(cc12)S(=O)(=O)NCCC3=CCCCC3)C(=O)O	BroadT	BRD-K75358000	BRD-K75358000-001-05-6	ChemDiv Inc.	K786-0022			Cc1c(oc2ccc(cc12)S(=O)(=O)NCCC1=CCCCC1)C(O)=O	InChI=1S/C18H21NO5S/c1-12-15-11-14(7-8-16(15)24-17(12)18(20)21)25(22,23)19-10-9-13-5-3-2-4-6-13/h5,7-8,11,19H,2-4,6,9-10H2,1H3,(H,20,21)	VHYQGOIDOVHQGX-UHFFFAOYSA-N	363.114043472							104986
SMR000023649	LSM-16350	SID4244372, BRD-K46948679	3238979	InChI=1S/C21H18N2O2/c24-21(23-13-5-8-15-7-2-4-10-18(15)23)19-17-12-11-14-6-1-3-9-16(14)20(17)25-22-19/h1-4,6-7,9-10H,5,8,11-13H2	LGFUURIRYOCCRM-UHFFFAOYSA-N	O=C(N1CCCc2ccccc12)c3noc4c3CCc5ccccc45	BroadT	BRD-K46948679	BRD-K46948679-001-05-0	ChemDiv Inc.	C226-3898			O=C(N1CCCc2ccccc12)c1noc-2c1CCc1ccccc-21	InChI=1S/C21H18N2O2/c24-21(23-13-5-8-15-7-2-4-10-18(15)23)19-17-12-11-14-6-1-3-9-16(14)20(17)25-22-19/h1-4,6-7,9-10H,5,8,11-13H2	LGFUURIRYOCCRM-UHFFFAOYSA-N	330.136827836							104987
AC1O9E8V	LSM-16351	BRD-K78718737	6756297	InChI=1S/C19H19N5O2S/c1-13-17(18(26)24(23(13)2)15-9-4-3-5-10-15)21-19(27)22-20-12-14-8-6-7-11-16(14)25/h3-12,25H,1-2H3,(H2,21,22,27)	OAGNFKCWXVXZJD-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)N=C(S)NN=Cc2ccccc2O)c3ccccc3	BroadT	BRD-K78718737	BRD-K78718737-001-05-8	Life Chemicals Inc.	F0207-0674			Cc1c(N=C(S)NN=Cc2ccccc2O)c(=O)n(-c2ccccc2)n1C	InChI=1S/C19H19N5O2S/c1-13-17(18(26)24(23(13)2)15-9-4-3-5-10-15)21-19(27)22-20-12-14-8-6-7-11-16(14)25/h3-12,25H,1-2H3,(H2,21,22,27)	OAGNFKCWXVXZJD-UHFFFAOYSA-N	381.125945588							
MLS000554830	LSM-16352	SID14729678, BRD-A94417262	3490047	InChI=1S/C7H11Cl3N2OS2/c1-4(13)11-5(7(8,9)10)15-6(14)12(2)3/h5H,1-3H3,(H,11,13)	DFTATZQBDBNHLQ-UHFFFAOYSA-N	CN(C)C(=S)SC(NC(=O)C)C(Cl)(Cl)Cl	BroadT	BRD-A94417262	BRD-A94417262-001-05-2	InterBioScreen Ltd.	STOCK1S-54549			CN(C)C(=S)SC(NC(C)=O)C(Cl)(Cl)Cl	InChI=1S/C7H11Cl3N2OS2/c1-4(13)11-5(7(8,9)10)15-6(14)12(2)3/h5H,1-3H3,(H,11,13)	DFTATZQBDBNHLQ-UHFFFAOYSA-N	307.937837502							104989
MLS000051718	LSM-16353	SID4262429, BRD-A16458085	2970996	InChI=1S/C18H17NO4/c1-21-17-9-12-11-5-2-3-6-14(11)23-16(12)10-13(17)19-18(20)15-7-4-8-22-15/h2-3,5-6,9-10,15H,4,7-8H2,1H3,(H,19,20)	SLVHSSYJYBEKCJ-UHFFFAOYSA-N	COc1cc2c(oc3ccccc23)cc1NC(=O)C4CCCO4	BroadT	BRD-A16458085	BRD-A16458085-001-06-4	ChemBridge Corporation	7946951			COc1cc2c(cc1NC(=O)C1CCCO1)oc1ccccc21	InChI=1S/C18H17NO4/c1-21-17-9-12-11-5-2-3-6-14(11)23-16(12)10-13(17)19-18(20)15-7-4-8-22-15/h2-3,5-6,9-10,15H,4,7-8H2,1H3,(H,19,20)	SLVHSSYJYBEKCJ-UHFFFAOYSA-N	311.115758034							104990
MLS000070447	LSM-16354	SID848003, SID7964587, BRD-K22565782	650428	InChI=1S/C18H18ClN3O3/c19-14-2-1-3-16(12-14)21-18(24)20-15-6-4-13(5-7-15)17(23)22-8-10-25-11-9-22/h1-7,12H,8-11H2,(H2,20,21,24)	PSZFDQQWUGYIAD-UHFFFAOYSA-N	Clc1cccc(NC(=O)Nc2ccc(cc2)C(=O)N3CCOCC3)c1	BroadT	BRD-K22565782	BRD-K22565782-001-05-4	Asinex Ltd.	BAS 02083628			Clc1cccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCOCC2)c1	InChI=1S/C18H18ClN3O3/c19-14-2-1-3-16(12-14)21-18(24)20-15-6-4-13(5-7-15)17(23)22-8-10-25-11-9-22/h1-7,12H,8-11H2,(H2,20,21,24)	PSZFDQQWUGYIAD-UHFFFAOYSA-N	359.103669176							104991
AC1MJ6KG	LSM-16355	BRD-K96409967	3107353	InChI=1S/C16H15FN4O2/c1-11(20-21-16(23)14-4-2-3-9-18-14)10-15(22)19-13-7-5-12(17)6-8-13/h2-9H,10H2,1H3,(H,19,22)(H,21,23)	YZHSDKOZLVOGDU-UHFFFAOYSA-N	CC(=NNC(=O)c1ccccn1)CC(=O)Nc2ccc(F)cc2	BroadT	BRD-K96409967	BRD-K96409967-001-05-3	Asinex Ltd.	BAS 00440612			CC(CC(=O)Nc1ccc(F)cc1)=NNC(=O)c1ccccn1	InChI=1S/C16H15FN4O2/c1-11(20-21-16(23)14-4-2-3-9-18-14)10-15(22)19-13-7-5-12(17)6-8-13/h2-9H,10H2,1H3,(H,19,22)(H,21,23)	YZHSDKOZLVOGDU-UHFFFAOYSA-N	314.11790396							104992
ASN 04448396	LSM-16356	SID17507034, BRD-K04777149	1174633	InChI=1S/C23H25N5O3S2/c1-26-22(18-8-10-19(11-9-18)33(30,31)27-13-4-5-14-27)24-25-23(26)32-16-21(29)28-15-12-17-6-2-3-7-20(17)28/h2-3,6-11H,4-5,12-16H2,1H3	VMCJBYOKXRANAM-UHFFFAOYSA-N	Cn1c(SCC(=O)N2CCc3ccccc23)nnc1c4ccc(cc4)S(=O)(=O)N5CCCC5	BroadT	BRD-K04777149	BRD-K04777149-001-05-5	Asinex Ltd.	ASN 04448396			Cn1c(SCC(=O)N2CCc3ccccc23)nnc1-c1ccc(cc1)S(=O)(=O)N1CCCC1	InChI=1S/C23H25N5O3S2/c1-26-22(18-8-10-19(11-9-18)33(30,31)27-13-4-5-14-27)24-25-23(26)32-16-21(29)28-15-12-17-6-2-3-7-20(17)28/h2-3,6-11H,4-5,12-16H2,1H3	VMCJBYOKXRANAM-UHFFFAOYSA-N	483.13988109							104993
AMBCB16971663	LSM-16357	SID24800231, BRD-K36646212	16191900	InChI=1S/C26H29FN6/c1-20-3-9-24(10-4-20)33-18-22(26(29-33)21-5-7-23(27)8-6-21)17-31-13-15-32(16-14-31)19-25-28-11-12-30(25)2/h3-12,18H,13-17,19H2,1-2H3	NKVFJSGYMQEBRF-UHFFFAOYSA-N	Cc1ccc(cc1)n2cc(CN3CCN(Cc4nccn4C)CC3)c(n2)c5ccc(F)cc5	BroadT	BRD-K36646212	BRD-K36646212-001-05-6	ChemBridge Corporation	16971663			Cc1ccc(cc1)-n1cc(CN2CCN(Cc3nccn3C)CC2)c(n1)-c1ccc(F)cc1	InChI=1S/C26H29FN6/c1-20-3-9-24(10-4-20)33-18-22(26(29-33)21-5-7-23(27)8-6-21)17-31-13-15-32(16-14-31)19-25-28-11-12-30(25)2/h3-12,18H,13-17,19H2,1-2H3	NKVFJSGYMQEBRF-UHFFFAOYSA-N	444.243773188							104994
AC1O9ZW7	LSM-16358	SID17506299, BRD-K01601739	6742472	InChI=1S/C16H13N3O4/c1-23-10-6-7-16(20)12(8-10)14-9-13(17-18-14)11-4-2-3-5-15(11)19(21)22/h2-9,20H,1H3,(H,17,18)	PCVVSFGHNIMERT-UHFFFAOYSA-N	COc1ccc(O)c(c1)c2cc([nH]n2)c3ccccc3[N+](=O)[O-]	BroadT	BRD-K01601739	BRD-K01601739-001-06-4	ChemBridge Corporation	5468761			COc1ccc(O)c(c1)-c1cc([nH]n1)-c1ccccc1[N+]([O-])=O	InChI=1S/C16H13N3O4/c1-23-10-6-7-16(20)12(8-10)14-9-13(17-18-14)11-4-2-3-5-15(11)19(21)22/h2-9,20H,1H3,(H,17,18)	PCVVSFGHNIMERT-UHFFFAOYSA-N	311.090605926							
SMR000094828	LSM-16359	SID7967478, BRD-A05350058	5308842	InChI=1S/C18H22N4O5S/c1-2-27-18(24)13-5-7-15(8-6-13)21-17(23)14-4-3-9-22(11-14)28(25,26)16-10-19-12-20-16/h5-8,10,12,14H,2-4,9,11H2,1H3,(H,19,20)(H,21,23)	OILMKIYBXZGMQM-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)C2CCCN(C2)S(=O)(=O)c3c[nH]cn3)cc1	BroadT	BRD-A05350058	BRD-A05350058-001-04-4	ChemDiv Inc.	C548-2167			CCOC(=O)c1ccc(NC(=O)C2CCCN(C2)S(=O)(=O)c2c[nH]cn2)cc1	InChI=1S/C18H22N4O5S/c1-2-27-18(24)13-5-7-15(8-6-13)21-17(23)14-4-3-9-22(11-14)28(25,26)16-10-19-12-20-16/h5-8,10,12,14H,2-4,9,11H2,1H3,(H,19,20)(H,21,23)	OILMKIYBXZGMQM-UHFFFAOYSA-N	406.131090534							104996
MLS000053578	LSM-16360	SID3714427, BRD-K23488933	2112393	InChI=1S/C12H9F6N7/c1-5-9-6(11(13,14)15)4-7(12(16,17)18)19-10(9)25(22-5)3-2-8-20-23-24-21-8/h4H,2-3H2,1H3,(H,20,21,23,24)	FGMOQCGINZQATI-UHFFFAOYSA-N	Cc1nn(CCc2nn[nH]n2)c3nc(cc(c13)C(F)(F)F)C(F)(F)F	BroadT	BRD-K23488933	BRD-K23488933-001-05-6	Enamine Ltd.	T5227343			Cc1nn(CCc2nn[nH]n2)c2nc(cc(c12)C(F)(F)F)C(F)(F)F	InChI=1S/C12H9F6N7/c1-5-9-6(11(13,14)15)4-7(12(16,17)18)19-10(9)25(22-5)3-2-8-20-23-24-21-8/h4H,2-3H2,1H3,(H,20,21,23,24)	FGMOQCGINZQATI-UHFFFAOYSA-N	365.082362558							104997
MLS000530951	LSM-16361	SID14731782, BRD-K41389288	1312855	InChI=1S/C21H20O6/c1-11-7-16(25-10-13-9-18(20(22)23)26-12(13)2)19-14-5-3-4-6-15(14)21(24)27-17(19)8-11/h7-9H,3-6,10H2,1-2H3,(H,22,23)	VBNNMGWQAMSGJG-UHFFFAOYSA-N	Cc1cc(OCc2cc(oc2C)C(=O)O)c3C4=C(CCCC4)C(=O)Oc3c1	BroadT	BRD-K41389288	BRD-K41389288-001-13-9	ChemBridge Corporation	6823669			Cc1oc(cc1COc1cc(C)cc2oc(=O)c3CCCCc3c12)C(O)=O	InChI=1S/C21H20O6/c1-11-7-16(25-10-13-9-18(20(22)23)26-12(13)2)19-14-5-3-4-6-15(14)21(24)27-17(19)8-11/h7-9H,3-6,10H2,1-2H3,(H,22,23)	VBNNMGWQAMSGJG-UHFFFAOYSA-N	368.12598836							104998
T5223000	LSM-4646	EMF-SUMO1-7, SID85271518, BRD-K49181186	3550807	InChI=1S/C17H18ClF3N2O3S/c18-13-11(19)4-12(20)15(14(13)21)27(25,26)23-22-16(24)17-5-8-1-9(6-17)3-10(2-8)7-17/h4,8-10,23H,1-3,5-7H2,(H,22,24)	IMAHIZOAEFWBHO-UHFFFAOYSA-N	Fc1cc(F)c(c(F)c1Cl)S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3	BroadT	BRD-K49181186	BRD-K49181186-001-07-7	Enamine Ltd.	T5223000			Fc1cc(F)c(c(F)c1Cl)S(=O)(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	InChI=1S/C17H18ClF3N2O3S/c18-13-11(19)4-12(20)15(14(13)21)27(25,26)23-22-16(24)17-5-8-1-9(6-17)3-10(2-8)7-17/h4,8-10,23H,1-3,5-7H2,(H,22,24)	IMAHIZOAEFWBHO-UHFFFAOYSA-N	422.067875456							94047
4-{[(Dimethoxy-phosphoryl)-phenyl-methyl]-amino}-benzoic acid	LSM-16362	SID17507200, BRD-A44172567	614731	InChI=1S/C16H18NO5P/c1-21-23(20,22-2)15(12-6-4-3-5-7-12)17-14-10-8-13(9-11-14)16(18)19/h3-11,15,17H,1-2H3,(H,18,19)	WHQFKVXQCJGLRI-UHFFFAOYSA-N	COP(=O)(OC)C(Nc1ccc(cc1)C(=O)O)c2ccccc2	BroadT	BRD-A44172567	BRD-A44172567-001-05-6	Asinex Ltd.	BAS 00134008			COP(=O)(OC)C(Nc1ccc(cc1)C(O)=O)c1ccccc1	InChI=1S/C16H18NO5P/c1-21-23(20,22-2)15(12-6-4-3-5-7-12)17-14-10-8-13(9-11-14)16(18)19/h3-11,15,17H,1-2H3,(H,18,19)	WHQFKVXQCJGLRI-UHFFFAOYSA-N	335.092259196							104999
MLS000756123	LSM-16363	SID22404985, BRD-K92063534	848959	InChI=1S/C13H17N5OS2/c1-17-4-6-18(7-5-17)9-11(19)14-13-16-15-12(21-13)10-3-2-8-20-10/h2-3,8H,4-7,9H2,1H3,(H,14,16,19)	SWBSSOSKHOTSJZ-UHFFFAOYSA-N	CN1CCN(CC(=O)Nc2nnc(s2)c3cccs3)CC1	BroadT	BRD-K92063534	BRD-K92063534-001-06-4	Specs	AO-476/42871090			CN1CCN(CC(=O)Nc2nnc(s2)-c2cccs2)CC1	InChI=1S/C13H17N5OS2/c1-17-4-6-18(7-5-17)9-11(19)14-13-16-15-12(21-13)10-3-2-8-20-10/h2-3,8H,4-7,9H2,1H3,(H,14,16,19)	SWBSSOSKHOTSJZ-UHFFFAOYSA-N	323.087451594							105000
AC1OAOOK	LSM-16364	BRD-K58496761	6807935	InChI=1S/C17H20N2O4/c1-10(2)8-18-9-12-16-11-5-3-4-6-14(11)23-15(16)7-13(17(12)20)19(21)22/h7,9-10,20H,3-6,8H2,1-2H3	YOUNXHCNCOLWFQ-UHFFFAOYSA-N	CC(C)CN=Cc1c(O)c(cc2oc3CCCCc3c12)[N+](=O)[O-]	BroadT	BRD-K58496761	BRD-K58496761-001-05-4	InterBioScreen Ltd.	STOCK2S-84600			CC(C)CN=Cc1c(O)c(cc2oc3CCCCc3c12)[N+]([O-])=O	InChI=1S/C17H20N2O4/c1-10(2)8-18-9-12-16-11-5-3-4-6-14(11)23-15(16)7-13(17(12)20)19(21)22/h7,9-10,20H,3-6,8H2,1-2H3	YOUNXHCNCOLWFQ-UHFFFAOYSA-N	316.14230714							
T0520-3404	LSM-16365	SID16953090, BRD-K63291645	3933489	InChI=1S/C20H18FN3S/c21-18-13-7-8-14-19(18)22-20(25)23-24(17-11-5-2-6-12-17)15-16-9-3-1-4-10-16/h1-14H,15H2,(H2,22,23,25)	LLWHFCREIKFHTF-UHFFFAOYSA-N	Fc1ccccc1N=C(S)NN(Cc2ccccc2)c3ccccc3	BroadT	BRD-K63291645	BRD-K63291645-001-05-4	Enamine Ltd.	T0520-3404			Fc1ccccc1N=C(S)NN(Cc1ccccc1)c1ccccc1	InChI=1S/C20H18FN3S/c21-18-13-7-8-14-19(18)22-20(25)23-24(17-11-5-2-6-12-17)15-16-9-3-1-4-10-16/h1-14H,15H2,(H2,22,23,25)	LLWHFCREIKFHTF-UHFFFAOYSA-N	351.120546496							105002
ZINC03318977	LSM-16366	SID22402739, BRD-K71521303	2434720	InChI=1S/C19H23N3O4S2/c1-14(23)20-15-5-7-16(8-6-15)21-18(24)13-17-9-10-19(27-17)28(25,26)22-11-3-2-4-12-22/h5-10H,2-4,11-13H2,1H3,(H,20,23)(H,21,24)	IMFHWPDDDBFPQP-UHFFFAOYSA-N	CC(=O)Nc1ccc(NC(=O)Cc2ccc(s2)S(=O)(=O)N3CCCCC3)cc1	BroadT	BRD-K71521303	BRD-K71521303-001-05-7	Enamine Ltd.	T0517-5789			CC(=O)Nc1ccc(NC(=O)Cc2ccc(s2)S(=O)(=O)N2CCCCC2)cc1	InChI=1S/C19H23N3O4S2/c1-14(23)20-15-5-7-16(8-6-15)21-18(24)13-17-9-10-19(27-17)28(25,26)22-11-3-2-4-12-22/h5-10H,2-4,11-13H2,1H3,(H,20,23)(H,21,24)	IMFHWPDDDBFPQP-UHFFFAOYSA-N	421.112997626							105003
MLS000057408	LSM-16367	SID3712142, BRD-A01004828	2997906	InChI=1S/C15H13ClN6OS/c1-10(14(23)18-13-8-7-11(16)9-17-13)24-15-19-20-21-22(15)12-5-3-2-4-6-12/h2-10H,1H3,(H,17,18,23)	JTTFMZCSMQVOKG-UHFFFAOYSA-N	CC(Sc1nnnn1c2ccccc2)C(=O)Nc3ccc(Cl)cn3	BroadT	BRD-A01004828	BRD-A01004828-001-05-7	Enamine Ltd.	ZT-9672881			CC(Sc1nnnn1-c1ccccc1)C(=O)Nc1ccc(Cl)cn1	InChI=1S/C15H13ClN6OS/c1-10(14(23)18-13-8-7-11(16)9-17-13)24-15-19-20-21-22(15)12-5-3-2-4-6-12/h2-10H,1H3,(H,17,18,23)	JTTFMZCSMQVOKG-UHFFFAOYSA-N	360.056007496							105004
MLS000052086	LSM-16368	SID4255510, SID7969158, BRD-K17866350	1251408	InChI=1S/C19H16N4S/c1-2-7-15(8-3-1)18-20-21-19-23(18)13-16(24-19)12-22-11-10-14-6-4-5-9-17(14)22/h1-9,13H,10-12H2	CZEOVHGKEIYKCI-UHFFFAOYSA-N	C(N1CCc2ccccc12)c3cn4c(nnc4s3)c5ccccc5	BroadT	BRD-K17866350	BRD-K17866350-001-06-3	ChemDiv Inc.	C246-0425			C(N1CCc2ccccc12)c1cn2c(nnc2s1)-c1ccccc1	InChI=1S/C19H16N4S/c1-2-7-15(8-3-1)18-20-21-19-23(18)13-16(24-19)12-22-11-10-14-6-4-5-9-17(14)22/h1-9,13H,10-12H2	CZEOVHGKEIYKCI-UHFFFAOYSA-N	332.109567242							105005
SMR000651590	LSM-16369	SID49821624, BRD-K59527775	1768585	InChI=1S/C27H22N2O6/c1-15-23(11-10-19-18-7-2-3-8-20(18)27(33)35-25(15)19)34-14-24(30)29-22(26(31)32)12-16-13-28-21-9-5-4-6-17(16)21/h2-11,13,22,28H,12,14H2,1H3,(H,29,30)(H,31,32)/t22-/m0/s1	KPSVCBXPHRRKCB-QFIPXVFZSA-N	Cc1c(OCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)ccc4c1OC(=O)c5ccccc45	BroadT	BRD-K59527775	BRD-K59527775-001-04-2	InterBioScreen Ltd.	STOCK1N-50049			Cc1c(OCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(O)=O)ccc2c1oc(=O)c1ccccc21	InChI=1S/C27H22N2O6/c1-15-23(11-10-19-18-7-2-3-8-20(18)27(33)35-25(15)19)34-14-24(30)29-22(26(31)32)12-16-13-28-21-9-5-4-6-17(16)21/h2-11,13,22,28H,12,14H2,1H3,(H,29,30)(H,31,32)/t22-/m0/s1	KPSVCBXPHRRKCB-QFIPXVFZSA-N	470.147786444							105006
STK498374	LSM-15188	BRD-K36067719	6493430	InChI=1S/C13H14N2O2S/c1-15-7-6-14-13(15)18-9-12(16)10-4-3-5-11(8-10)17-2/h3-8H,9H2,1-2H3	SYLWZFNIQJFWKS-UHFFFAOYSA-N	COc1cccc(c1)C(=O)CSc2nccn2C	BroadT	BRD-K36067719	BRD-K36067719-004-06-5	Asinex Ltd.	ASN 12913772		Br	COc1cccc(c1)C(=O)CSc1nccn1C.Br	InChI=1S/C13H14N2O2S.BrH/c1-15-7-6-14-13(15)18-9-12(16)10-4-3-5-11(8-10)17-2;/h3-8H,9H2,1-2H3;1H	HAVVTBUZMUUGML-UHFFFAOYSA-N	262.077598398							103838, 103838
F0593-0115	LSM-16370	SID4249752, BRD-K51339581	2155640	InChI=1S/C16H22N4O4S2/c1-4-5-10-20(2)26(22,23)13-8-6-12(7-9-13)15(21)17-16-19-18-14(24-16)11-25-3/h6-9H,4-5,10-11H2,1-3H3,(H,17,19,21)	RMSGLOWQUXFIRR-UHFFFAOYSA-N	CCCCN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc2oc(CSC)nn2	BroadT	BRD-K51339581	BRD-K51339581-001-05-1	ChemDiv Inc.	C079-0456			CCCCN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(CSC)o1	InChI=1S/C16H22N4O4S2/c1-4-5-10-20(2)26(22,23)13-8-6-12(7-9-13)15(21)17-16-19-18-14(24-16)11-25-3/h6-9H,4-5,10-11H2,1-3H3,(H,17,19,21)	RMSGLOWQUXFIRR-UHFFFAOYSA-N	398.108246604							105007
11B-052	LSM-16371	BRD-K77404247	6819910	InChI=1S/C16H13N3O2/c20-16-12(11-18-19-16)10-17-13-6-8-15(9-7-13)21-14-4-2-1-3-5-14/h1-11H,(H2,18,19,20)	PTRDZIYXELODOO-UHFFFAOYSA-N	Oc1[nH]ncc1C=Nc2ccc(Oc3ccccc3)cc2	BroadT	BRD-K77404247	BRD-K77404247-001-05-9	Key Organics Ltd.	11B-052			Oc1[nH]ncc1C=Nc1ccc(Oc2ccccc2)cc1	InChI=1S/C16H13N3O2/c20-16-12(11-18-19-16)10-17-13-6-8-15(9-7-13)21-14-4-2-1-3-5-14/h1-11H,(H2,18,19,20)	PTRDZIYXELODOO-UHFFFAOYSA-N	279.100776686							
T0510-6049	LSM-16372	SID49673700, BRD-A17940587	4425194	InChI=1S/C24H22N2O4/c1-29-23-14-18(12-13-22(23)30-16-24(27)28)21-15-20(17-8-4-2-5-9-17)25-26(21)19-10-6-3-7-11-19/h2-14,21H,15-16H2,1H3,(H,27,28)	BPERWKHCZSFQRP-UHFFFAOYSA-N	COc1cc(ccc1OCC(=O)O)C2CC(=NN2c3ccccc3)c4ccccc4	BroadT	BRD-A17940587	BRD-A17940587-001-05-5	Enamine Ltd.	T0510-6049			COc1cc(ccc1OCC(O)=O)C1CC(=NN1c1ccccc1)c1ccccc1	InChI=1S/C24H22N2O4/c1-29-23-14-18(12-13-22(23)30-16-24(27)28)21-15-20(17-8-4-2-5-9-17)25-26(21)19-10-6-3-7-11-19/h2-14,21H,15-16H2,1H3,(H,27,28)	BPERWKHCZSFQRP-UHFFFAOYSA-N	402.157957204							105009
AC1LJY7D	LSM-16373	BRD-K05443951	1008607	InChI=1S/C23H21N3O/c1-3-26-21-11-7-6-10-19(21)20-14-17(12-13-22(20)26)15-24-25-23(27)18-9-5-4-8-16(18)2/h4-15H,3H2,1-2H3,(H,25,27)	NYLXNQHCXNOBQX-UHFFFAOYSA-N	CCn1c2ccccc2c3cc(C=NNC(=O)c4ccccc4C)ccc13	BroadT	BRD-K05443951	BRD-K05443951-001-05-0	ChemBridge Corporation	5194550			CCn1c2ccccc2c2cc(C=NNC(=O)c3ccccc3C)ccc12	InChI=1S/C23H21N3O/c1-3-26-21-11-7-6-10-19(21)20-14-17(12-13-22(20)26)15-24-25-23(27)18-9-5-4-8-16(18)2/h4-15H,3H2,1-2H3,(H,25,27)	NYLXNQHCXNOBQX-UHFFFAOYSA-N	355.168462322							105010
T0517-7260	LSM-16374	SID17517100, BRD-K41077786	2437415	InChI=1S/C22H16N4O5S/c27-21(23-15-6-4-9-17(12-15)26(29)30)14-31-22(28)19-13-18(20-10-5-11-32-20)24-25(19)16-7-2-1-3-8-16/h1-13H,14H2,(H,23,27)	VLDPPNRSAGPASZ-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(NC(=O)COC(=O)c2cc(nn2c3ccccc3)c4cccs4)c1	BroadT	BRD-K41077786	BRD-K41077786-001-05-3	Enamine Ltd.	T0517-7260			[O-][N+](=O)c1cccc(NC(=O)COC(=O)c2cc(nn2-c2ccccc2)-c2cccs2)c1	InChI=1S/C22H16N4O5S/c27-21(23-15-6-4-9-17(12-15)26(29)30)14-31-22(28)19-13-18(20-10-5-11-32-20)24-25(19)16-7-2-1-3-8-16/h1-13H,14H2,(H,23,27)	VLDPPNRSAGPASZ-UHFFFAOYSA-N	448.084140342							105011
AC1LWVME	LSM-16375	SID49829082, BRD-K92943958	1786328	InChI=1S/C25H25NO6/c27-23(26-14-16-6-8-18(9-7-16)24(28)29)15-31-20-11-10-19-12-21(17-4-2-1-3-5-17)25(30)32-22(19)13-20/h1-5,10-13,16,18H,6-9,14-15H2,(H,26,27)(H,28,29)	XYKMEDUGXHOUKH-UHFFFAOYSA-N	OC(=O)C1CCC(CNC(=O)COc2ccc3C=C(C(=O)Oc3c2)c4ccccc4)CC1	BroadT	BRD-K92943958	BRD-K92943958-001-04-9	InterBioScreen Ltd.	STOCK1N-56765			OC(=O)C1CCC(CNC(=O)COc2ccc3cc(-c4ccccc4)c(=O)oc3c2)CC1	InChI=1S/C25H25NO6/c27-23(26-14-16-6-8-18(9-7-16)24(28)29)15-31-20-11-10-19-12-21(17-4-2-1-3-5-17)25(30)32-22(19)13-20/h1-5,10-13,16,18H,6-9,14-15H2,(H,26,27)(H,28,29)	XYKMEDUGXHOUKH-UHFFFAOYSA-N	435.16818753							105012
ST50839063	LSM-16376	SID49823402, BRD-A77422452	20179591	InChI=1S/C20H25FN2S/c1-4-19(17-9-7-16(8-10-17)14(2)3)23-20(24)22-13-15-5-11-18(21)12-6-15/h5-12,14,19H,4,13H2,1-3H3,(H2,22,23,24)	IDTQCNLPWMYNNQ-UHFFFAOYSA-N	CCC(N=C(S)NCc1ccc(F)cc1)c2ccc(cc2)C(C)C	BroadT	BRD-A77422452	BRD-A77422452-001-05-3	Chemical Technologies & Investigations	AMNCS-24570			CCC(N=C(S)NCc1ccc(F)cc1)c1ccc(cc1)C(C)C	InChI=1S/C20H25FN2S/c1-4-19(17-9-7-16(8-10-17)14(2)3)23-20(24)22-13-15-5-11-18(21)12-6-15/h5-12,14,19H,4,13H2,1-3H3,(H2,22,23,24)	IDTQCNLPWMYNNQ-UHFFFAOYSA-N	344.17224771							105013
10K-343S	LSM-16377	SID14730219, BRD-K57648422	1472205	InChI=1S/C13H11ClN2O4S/c14-10-4-6-11(7-5-10)21(19,20)16(9-13(17)18)12-3-1-2-8-15-12/h1-8H,9H2,(H,17,18)	KXCQCBUYPBXGDG-UHFFFAOYSA-N	OC(=O)CN(c1ccccn1)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K57648422	BRD-K57648422-001-06-0	Key Organics Ltd.	10K-343S			OC(=O)CN(c1ccccn1)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C13H11ClN2O4S/c14-10-4-6-11(7-5-10)21(19,20)16(9-13(17)18)12-3-1-2-8-15-12/h1-8H,9H2,(H,17,18)	KXCQCBUYPBXGDG-UHFFFAOYSA-N	326.012805252							105014
AC1LGO6J	LSM-16378	BRD-K34803839	774688	InChI=1S/C14H14N4O3S/c1-10-4-2-3-5-12(10)15-9-13(19)17-16-8-11-6-7-14(22-11)18(20)21/h2-8,15H,9H2,1H3,(H,17,19)	JACCJEJIJCZTAM-UHFFFAOYSA-N	Cc1ccccc1NCC(=O)NN=Cc2ccc(s2)[N+](=O)[O-]	BroadT	BRD-K34803839	BRD-K34803839-001-06-6	ChemDiv Inc.	2181-0629			Cc1ccccc1NCC(=O)NN=Cc1ccc(s1)[N+]([O-])=O	InChI=1S/C14H14N4O3S/c1-10-4-2-3-5-12(10)15-9-13(19)17-16-8-11-6-7-14(22-11)18(20)21/h2-8,15H,9H2,1H3,(H,17,19)	JACCJEJIJCZTAM-UHFFFAOYSA-N	318.078661038							105015
AC1MLIXD	LSM-16379	SID49725992, BRD-K45141102	3174233	InChI=1S/C23H31N5O4S/c1-2-3-13-32-17-11-9-16(10-12-17)28(14-18(29)26-15-7-5-4-6-8-15)23(31)21-19(24)20(22(25)30)27-33-21/h9-12,15H,2-8,13-14,24H2,1H3,(H2,25,30)(H,26,29)	WDKNZLMANLNCOG-UHFFFAOYSA-N	CCCCOc1ccc(cc1)N(CC(=O)NC2CCCCC2)C(=O)c3snc(C(=O)N)c3N	BroadT	BRD-K45141102	BRD-K45141102-001-05-0	Asinex Ltd.	ASN 03580845			CCCCOc1ccc(cc1)N(CC(=O)NC1CCCCC1)C(=O)c1snc(C(N)=O)c1N	InChI=1S/C23H31N5O4S/c1-2-3-13-32-17-11-9-16(10-12-17)28(14-18(29)26-15-7-5-4-6-8-15)23(31)21-19(24)20(22(25)30)27-33-21/h9-12,15H,2-8,13-14,24H2,1H3,(H2,25,30)(H,26,29)	WDKNZLMANLNCOG-UHFFFAOYSA-N	473.209675212							105016
3-(4-Methoxy-phenyl)-1-phenyl-3-(toluene-4-sulfonyl)-propan-1-one	LSM-16380	SID17403126, BRD-A02597951	2884084	InChI=1S/C23H22O4S/c1-17-8-14-21(15-9-17)28(25,26)23(19-10-12-20(27-2)13-11-19)16-22(24)18-6-4-3-5-7-18/h3-15,23H,16H2,1-2H3	ANHWSKCBERYBNG-UHFFFAOYSA-N	COc1ccc(cc1)C(CC(=O)c2ccccc2)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-A02597951	BRD-A02597951-001-05-8	Asinex Ltd.	BAS 02914250			COc1ccc(cc1)C(CC(=O)c1ccccc1)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C23H22O4S/c1-17-8-14-21(15-9-17)28(25,26)23(19-10-12-20(27-2)13-11-19)16-22(24)18-6-4-3-5-7-18/h3-15,23H,16H2,1-2H3	ANHWSKCBERYBNG-UHFFFAOYSA-N	394.123879874							105017
BRD-A66396839	LSM-16381			InChI=1S/C26H23N5O3/c1-18-22(26(34)31(30(18)2)21-16-10-5-11-17-21)28-29-23(24(32)19-12-6-3-7-13-19)25(33)27-20-14-8-4-9-15-20/h3-17,23H,1-2H3,(H,27,33)	ZLILEVZYOSFGJO-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)N=NC(C(=O)Nc2ccccc2)C(=O)c3ccccc3)c4ccccc4	BroadT	BRD-A66396839	BRD-A66396839-001-05-6	Enamine Ltd.	T0513-7584			Cc1c(N=NC(C(=O)Nc2ccccc2)C(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C	InChI=1S/C26H23N5O3/c1-18-22(26(34)31(30(18)2)21-16-10-5-11-17-21)28-29-23(24(32)19-12-6-3-7-13-19)25(33)27-20-14-8-4-9-15-20/h3-17,23H,1-2H3,(H,27,33)	ZLILEVZYOSFGJO-UHFFFAOYSA-N	453.180089646							105018
F1365-1367	LSM-16382	BRD-K74400475	3565390	InChI=1S/C19H23N3O2S/c1-3-11-22-16-10-9-15(20-13(2)23)12-17(16)25-19(22)21-18(24)14-7-5-4-6-8-14/h3,9-10,12,14H,1,4-8,11H2,2H3,(H,20,23)	VNDYWOISNOYNQV-UHFFFAOYSA-N	CC(=O)Nc1ccc2N(CC=C)C(=NC(=O)C3CCCCC3)Sc2c1	BroadT	BRD-K74400475	BRD-K74400475-001-04-6	Life Chemicals Inc.	F1365-1367			CC(=O)Nc1ccc2n(CC=C)c(=NC(=O)C3CCCCC3)sc2c1	InChI=1S/C19H23N3O2S/c1-3-11-22-16-10-9-15(20-13(2)23)12-17(16)25-19(22)21-18(24)14-7-5-4-6-8-14/h3,9-10,12,14H,1,4-8,11H2,2H3,(H,20,23)	VNDYWOISNOYNQV-UHFFFAOYSA-N	357.151097696							105019
AC1N8UKQ	LSM-16383	BRD-K09619185	4350328	InChI=1S/C15H18N4O3S2/c1-11-7-8-13(22-11)10-16-18-15(23)17-12-5-4-6-14(9-12)24(20,21)19(2)3/h4-10H,1-3H3,(H2,17,18,23)	CKXMFNMWIIFQLD-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cccc(NC(=NN=Cc2oc(C)cc2)S)c1	BroadT	BRD-K09619185	BRD-K09619185-001-05-9	Enamine Ltd.	T0511-4014			CN(C)S(=O)(=O)c1cccc(NC(S)=NN=Cc2ccc(C)o2)c1	InChI=1S/C15H18N4O3S2/c1-11-7-8-13(22-11)10-16-18-15(23)17-12-5-4-6-14(9-12)24(20,21)19(2)3/h4-10H,1-3H3,(H2,17,18,23)	CKXMFNMWIIFQLD-UHFFFAOYSA-N	366.082031856							105020
MLS000390702	LSM-16384	SID22406864, BRD-K05479247	2360549	InChI=1S/C20H25FN2O/c1-14-8-10-22(11-9-14)13-20(24)17-12-15(2)23(16(17)3)19-7-5-4-6-18(19)21/h4-7,12,14H,8-11,13H2,1-3H3	WVBWCGCTOWVHQS-UHFFFAOYSA-N	CC1CCN(CC(=O)c2cc(C)n(c2C)c3ccccc3F)CC1	BroadT	BRD-K05479247	BRD-K05479247-001-07-4	Enamine Ltd.	T0507-1127			CC1CCN(CC(=O)c2cc(C)n(c2C)-c2ccccc2F)CC1	InChI=1S/C20H25FN2O/c1-14-8-10-22(11-9-14)13-20(24)17-12-15(2)23(16(17)3)19-7-5-4-6-18(19)21/h4-7,12,14H,8-11,13H2,1-3H3	WVBWCGCTOWVHQS-UHFFFAOYSA-N	328.19509164							105021
SMR000114426	LSM-16385	SID14727433, BRD-K77694233	1205600	InChI=1S/C19H14F3N5OS/c20-19(21,22)15-11-13(14-7-4-10-29-14)24-18-25-16(26-27(15)18)17(28)23-9-8-12-5-2-1-3-6-12/h1-7,10-11H,8-9H2,(H,23,28)	ITAXYYNQZUTCNK-UHFFFAOYSA-N	FC(F)(F)c1cc(nc2nc(nn12)C(=O)NCCc3ccccc3)c4cccs4	BroadT	BRD-K77694233	BRD-K77694233-001-05-1	Specs	AG-690/36535054			FC(F)(F)c1cc(nc2nc(nn12)C(=O)NCCc1ccccc1)-c1cccs1	InChI=1S/C19H14F3N5OS/c20-19(21,22)15-11-13(14-7-4-10-29-14)24-18-25-16(26-27(15)18)17(28)23-9-8-12-5-2-1-3-6-12/h1-7,10-11H,8-9H2,(H,23,28)	ITAXYYNQZUTCNK-UHFFFAOYSA-N	417.087115408							105022
AC1N5GPP	LSM-16386	SID24830303, BRD-A00755391	4194805	InChI=1S/C34H34O3P2/c1-32-25-37-34(39(36,30-18-10-4-11-19-30)31-20-12-5-13-21-31)24-27(32)22-23-33(32,34)26-38(35,28-14-6-2-7-15-28)29-16-8-3-9-17-29/h2-21,27H,22-26H2,1H3	UIBHSDQMFKDEOB-UHFFFAOYSA-N	CC12COC3(CC1CCC23CP(=O)(c4ccccc4)c5ccccc5)P(=O)(c6ccccc6)c7ccccc7	BroadT	BRD-A00755391	BRD-A00755391-001-05-2	Enamine Ltd.	T0501-5964			CC12COC3(CC1CCC23CP(=O)(c1ccccc1)c1ccccc1)P(=O)(c1ccccc1)c1ccccc1	InChI=1S/C34H34O3P2/c1-32-25-37-34(39(36,30-18-10-4-11-19-30)31-20-12-5-13-21-31)24-27(32)22-23-33(32,34)26-38(35,28-14-6-2-7-15-28)29-16-8-3-9-17-29/h2-21,27H,22-26H2,1H3	UIBHSDQMFKDEOB-UHFFFAOYSA-N	552.198317968							105023
BAS 09687586	LSM-16387	SID24781620, BRD-A57520205	3158985	InChI=1S/C13H15N3OS2/c1-7-3-4-9-10(6-18-11(9)5-7)12(17)14-13-16-15-8(2)19-13/h6-7H,3-5H2,1-2H3,(H,14,16,17)	QBJHONOUTKNSLO-UHFFFAOYSA-N	CC1CCc2c(C1)scc2C(=O)Nc3nnc(C)s3	BroadT	BRD-A57520205	BRD-A57520205-001-05-8	Asinex Ltd.	BAS 09687586			CC1CCc2c(C1)scc2C(=O)Nc1nnc(C)s1	InChI=1S/C13H15N3OS2/c1-7-3-4-9-10(6-18-11(9)5-7)12(17)14-13-16-15-8(2)19-13/h6-7H,3-5H2,1-2H3,(H,14,16,17)	QBJHONOUTKNSLO-UHFFFAOYSA-N	293.06565351							105024
STK642705	LSM-16388	SID859007, BRD-K83557954	660310	InChI=1S/C11H11ClN4O/c1-7-10(14-11(17)16-15-7)13-6-8-2-4-9(12)5-3-8/h2-5H,6H2,1H3,(H2,13,14,16,17)	LXHRVYBKTPIEMY-UHFFFAOYSA-N	Cc1nnc(O)nc1NCc2ccc(Cl)cc2	BroadT	BRD-K83557954	BRD-K83557954-001-06-7	InterBioScreen Ltd.	STOCK2S-79460			Cc1nnc(O)nc1NCc1ccc(Cl)cc1	InChI=1S/C11H11ClN4O/c1-7-10(14-11(17)16-15-7)13-6-8-2-4-9(12)5-3-8/h2-5H,6H2,1H3,(H2,13,14,16,17)	LXHRVYBKTPIEMY-UHFFFAOYSA-N	250.062138722							105025
N-[4-Chloro-3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide	LSM-16389	SID22405679, BRD-K45130744	2083041	InChI=1S/C18H17ClF3NO4/c1-25-14-6-10(7-15(26-2)17(14)27-3)8-16(24)23-11-4-5-13(19)12(9-11)18(20,21)22/h4-7,9H,8H2,1-3H3,(H,23,24)	ZWBAQFXYMXGBEA-UHFFFAOYSA-N	COc1cc(CC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)cc(OC)c1OC	BroadT	BRD-K45130744	BRD-K45130744-001-06-5	Enamine Ltd.	T5260964			COc1cc(CC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)cc(OC)c1OC	InChI=1S/C18H17ClF3NO4/c1-25-14-6-10(7-15(26-2)17(14)27-3)8-16(24)23-11-4-5-13(19)12(9-11)18(20,21)22/h4-7,9H,8H2,1-3H3,(H,23,24)	ZWBAQFXYMXGBEA-UHFFFAOYSA-N	403.079820344							105026
AC1M3YIO	LSM-16390	SID4263888, BRD-K28071775	2199160	InChI=1S/C17H17N3O/c1-2-5-15(6-3-1)16-7-9-17(10-8-16)21-12-4-11-20-14-18-13-19-20/h1-3,5-10,13-14H,4,11-12H2	HIDHFMMPDIACKQ-UHFFFAOYSA-N	C(COc1ccc(cc1)c2ccccc2)Cn3cncn3	BroadT	BRD-K28071775	BRD-K28071775-001-04-9	ChemBridge Corporation	7706751			C(COc1ccc(cc1)-c1ccccc1)Cn1cncn1	InChI=1S/C17H17N3O/c1-2-5-15(6-3-1)16-7-9-17(10-8-16)21-12-4-11-20-14-18-13-19-20/h1-3,5-10,13-14H,4,11-12H2	HIDHFMMPDIACKQ-UHFFFAOYSA-N	279.137162194							105027
AC1MFAIP	LSM-16391	SID24786003, BRD-K18930460	2891430	InChI=1S/C13H10BrN3O2/c14-11-3-1-10(2-4-11)13(18)19-17-12(15)9-5-7-16-8-6-9/h1-8H,(H2,15,17)	PKILLTJAGYUDIJ-UHFFFAOYSA-N	Brc1ccc(cc1)C(=O)ONC(=N)c2ccncc2	BroadT	BRD-K18930460	BRD-K18930460-001-05-5	ChemBridge Corporation	6234635			Brc1ccc(cc1)C(=O)ONC(=N)c1ccncc1	InChI=1S/C13H10BrN3O2/c14-11-3-1-10(2-4-11)13(18)19-17-12(15)9-5-7-16-8-6-9/h1-8H,(H2,15,17)	PKILLTJAGYUDIJ-UHFFFAOYSA-N	318.99563919							105028
SMR000221105	LSM-16392	SID17513097, BRD-K46270368	1860881	InChI=1S/C23H19N3O2/c1-27-16-9-7-15(8-10-16)14-26-21-12-11-17(28-2)13-18(21)22-23(26)25-20-6-4-3-5-19(20)24-22/h3-13H,14H2,1-2H3	HSNHWHFAPQSSTR-UHFFFAOYSA-N	COc1ccc(Cn2c3ccc(OC)cc3c4nc5ccccc5nc24)cc1	BroadT	BRD-K46270368	BRD-K46270368-001-07-1	InterBioScreen Ltd.	STOCK5S-41673			COc1ccc(Cn2c3ccc(OC)cc3c3nc4ccccc4nc23)cc1	InChI=1S/C23H19N3O2/c1-27-16-9-7-15(8-10-16)14-26-21-12-11-17(28-2)13-18(21)22-23(26)25-20-6-4-3-5-19(20)24-22/h3-13H,14H2,1-2H3	HSNHWHFAPQSSTR-UHFFFAOYSA-N	369.147726878							105029
SMR000376171	LSM-16393	SID24837305, BRD-A13280254	3905965	InChI=1S/C24H26N6O4S/c1-17(31)27-18-6-8-19(9-7-18)35(32,33)22(16-25)23-24(26-10-11-30-12-14-34-15-13-30)29-21-5-3-2-4-20(21)28-23/h2-9,22H,10-15H2,1H3,(H,26,29)(H,27,31)	AGLRVQFITFFTRR-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)S(=O)(=O)C(C#N)c2nc3ccccc3nc2NCCN4CCOCC4	BroadT	BRD-A13280254	BRD-A13280254-001-05-2	Enamine Ltd.	T5238812			CC(=O)Nc1ccc(cc1)S(=O)(=O)C(C#N)c1nc2ccccc2nc1NCCN1CCOCC1	InChI=1S/C24H26N6O4S/c1-17(31)27-18-6-8-19(9-7-18)35(32,33)22(16-25)23-24(26-10-11-30-12-14-34-15-13-30)29-21-5-3-2-4-20(21)28-23/h2-9,22H,10-15H2,1H3,(H,26,29)(H,27,31)	AGLRVQFITFFTRR-UHFFFAOYSA-N	494.173624062							105030
ZINC00372643	LSM-16394	SID24790499, BRD-K73145704	842230	InChI=1S/C14H14N2O2S/c1-18-13-9-11(19-2)3-4-12(13)14(17)16-10-5-7-15-8-6-10/h3-9H,1-2H3,(H,15,16,17)	PPEQZNIWAAFDHQ-UHFFFAOYSA-N	COc1cc(SC)ccc1C(=O)Nc2ccncc2	BroadT	BRD-K73145704	BRD-K73145704-001-05-8	ChemBridge Corporation	6170062			COc1cc(SC)ccc1C(=O)Nc1ccncc1	InChI=1S/C14H14N2O2S/c1-18-13-9-11(19-2)3-4-12(13)14(17)16-10-5-7-15-8-6-10/h3-9H,1-2H3,(H,15,16,17)	PPEQZNIWAAFDHQ-UHFFFAOYSA-N	274.077598398							105031
SMR000152308	LSM-16395	SID14745919, BRD-K46388765	2421493	InChI=1S/C20H19FN4O3/c1-4-28-20(26)15-11-17(14-7-6-13(27-3)10-16(14)21)23-19-18(15)12(2)24-25(19)9-5-8-22/h6-7,10-11H,4-5,9H2,1-3H3	IEUZNNODZKNDPK-UHFFFAOYSA-N	CCOC(=O)c1cc(nc2c1c(C)nn2CCC#N)c3ccc(OC)cc3F	BroadT	BRD-K46388765	BRD-K46388765-001-06-2	Enamine Ltd.	T0515-7248			CCOC(=O)c1cc(nc2n(CCC#N)nc(C)c12)-c1ccc(OC)cc1F	InChI=1S/C20H19FN4O3/c1-4-28-20(26)15-11-17(14-7-6-13(27-3)10-16(14)21)23-19-18(15)12(2)24-25(19)9-5-8-22/h6-7,10-11H,4-5,9H2,1-3H3	IEUZNNODZKNDPK-UHFFFAOYSA-N	382.144118708							105032
2-(4-Bromophenyl)-n-(5-tert-butyl-1,3,4-thiadiazol-2-yl)acetamide	LSM-16396	SID22404324, BRD-K32707307	1321747	InChI=1S/C14H16BrN3OS/c1-14(2,3)12-17-18-13(20-12)16-11(19)8-9-4-6-10(15)7-5-9/h4-7H,8H2,1-3H3,(H,16,18,19)	JFOYUQSYQBSSIB-UHFFFAOYSA-N	CC(C)(C)c1nnc(NC(=O)Cc2ccc(Br)cc2)s1	BroadT	BRD-K32707307	BRD-K32707307-001-05-6	ChemBridge Corporation	6858090			CC(C)(C)c1nnc(NC(=O)Cc2ccc(Br)cc2)s1	InChI=1S/C14H16BrN3OS/c1-14(2,3)12-17-18-13(20-12)16-11(19)8-9-4-6-10(15)7-5-9/h4-7H,8H2,1-3H3,(H,16,18,19)	JFOYUQSYQBSSIB-UHFFFAOYSA-N	353.019745452							105033
AC1MMDIZ	LSM-16397	SID4242170, BRD-A04753289	3237055	InChI=1S/C18H19N3O2/c1-12(13-7-3-2-4-8-13)19-17(22)11-16-18(23)21-15-10-6-5-9-14(15)20-16/h2-10,12,16,20H,11H2,1H3,(H,19,22)(H,21,23)	BBXMKLXKJDMVCH-UHFFFAOYSA-N	CC(NC(=O)CC1Nc2ccccc2NC1=O)c3ccccc3	BroadT	BRD-A04753289	BRD-A04753289-001-05-8	ChemDiv Inc.	K788-6224			CC(NC(=O)CC1Nc2ccccc2NC1=O)c1ccccc1	InChI=1S/C18H19N3O2/c1-12(13-7-3-2-4-8-13)19-17(22)11-16-18(23)21-15-10-6-5-9-14(15)20-16/h2-10,12,16,20H,11H2,1H3,(H,19,22)(H,21,23)	BBXMKLXKJDMVCH-UHFFFAOYSA-N	309.147726878							105034
MLS000698628	LSM-16398	SID22412278, BRD-K38933653	843677	InChI=1S/C16H17N3S2/c1-3-13-11(2)21-10-14(13)15-17-18-16(20)19(15)9-12-7-5-4-6-8-12/h4-8,10H,3,9H2,1-2H3,(H,18,20)	UTHTVLYHARKYPZ-UHFFFAOYSA-N	CCc1c(C)scc1c2nnc(S)n2Cc3ccccc3	BroadT	BRD-K38933653	BRD-K38933653-001-05-2	Specs	AK-968/41923905			CCc1c(C)scc1-c1nnc(S)n1Cc1ccccc1	InChI=1S/C16H17N3S2/c1-3-13-11(2)21-10-14(13)15-17-18-16(20)19(15)9-12-7-5-4-6-8-12/h4-8,10H,3,9H2,1-2H3,(H,18,20)	UTHTVLYHARKYPZ-UHFFFAOYSA-N	315.086388954							105035
MLS000665044	LSM-16399	SID24794366, BRD-K35530300	972574	InChI=1S/C14H12Cl2N2S/c15-11-6-2-1-5-10(11)9-17-14(19)18-13-8-4-3-7-12(13)16/h1-8H,9H2,(H2,17,18,19)	RERGRKSECJIJMI-UHFFFAOYSA-N	Clc1ccccc1CNC(=S)Nc2ccccc2Cl	BroadT	BRD-K35530300	BRD-K35530300-001-05-6	ChemBridge Corporation	7854608			Clc1ccccc1CNC(=S)Nc1ccccc1Cl	InChI=1S/C14H12Cl2N2S/c15-11-6-2-1-5-10(11)9-17-14(19)18-13-8-4-3-7-12(13)16/h1-8H,9H2,(H2,17,18,19)	RERGRKSECJIJMI-UHFFFAOYSA-N	310.009824514							105036
9P-574S	LSM-16400	SID14734170, BRD-K60862460	1489071	InChI=1S/C13H16F3N3O2S/c1-12(2,3)6-21-11(20)17-8-5-7-9(13(14,15)16)18-19(4)10(7)22-8/h5H,6H2,1-4H3,(H,17,20)	IAZHMIFKVQAYNG-UHFFFAOYSA-N	Cn1nc(c2cc(NC(=O)OCC(C)(C)C)sc12)C(F)(F)F	BroadT	BRD-K60862460	BRD-K60862460-001-05-7	Key Organics Ltd.	9P-574S			Cn1nc(c2cc(NC(=O)OCC(C)(C)C)sc12)C(F)(F)F	InChI=1S/C13H16F3N3O2S/c1-12(2,3)6-21-11(20)17-8-5-7-9(13(14,15)16)18-19(4)10(7)22-8/h5H,6H2,1-4H3,(H,17,20)	IAZHMIFKVQAYNG-UHFFFAOYSA-N	335.091532072							105037
MLS000045215	LSM-16401	SID24838613, SID4246176, BRD-A38040034	3240555	InChI=1S/C20H19N5O3S3/c1-12-7-8-14-16(10-12)29-20(21-14)22-19(26)13-4-3-9-25(11-13)31(27,28)17-6-2-5-15-18(17)24-30-23-15/h2,5-8,10,13H,3-4,9,11H2,1H3,(H,21,22,26)	PWONHYLJDVKAEF-UHFFFAOYSA-N	Cc1ccc2nc(NC(=O)C3CCCN(C3)S(=O)(=O)c4cccc5nsnc45)sc2c1	BroadT	BRD-A38040034	BRD-A38040034-001-06-6	ChemDiv Inc.	C444-0175			Cc1ccc2nc(NC(=O)C3CCCN(C3)S(=O)(=O)c3cccc4nsnc34)sc2c1	InChI=1S/C20H19N5O3S3/c1-12-7-8-14-16(10-12)29-20(21-14)22-19(26)13-4-3-9-25(11-13)31(27,28)17-6-2-5-15-18(17)24-30-23-15/h2,5-8,10,13H,3-4,9,11H2,1H3,(H,21,22,26)	PWONHYLJDVKAEF-UHFFFAOYSA-N	473.065001588							105038
5-Methyl-2-phenyl-5-(2-phenylethyl)-1,2,4-triazolidine-3-thione	LSM-16402	SID22403133, BRD-A02377332	2906079	InChI=1S/C17H19N3S/c1-17(13-12-14-8-4-2-5-9-14)18-16(21)20(19-17)15-10-6-3-7-11-15/h2-11,19H,12-13H2,1H3,(H,18,21)	VXNOGTKFWDNXCN-UHFFFAOYSA-N	CC1(CCc2ccccc2)NN(C(=N1)S)c3ccccc3	BroadT	BRD-A02377332	BRD-A02377332-001-05-5	ChemBridge Corporation	6625812			CC1(CCc2ccccc2)NN(C(S)=N1)c1ccccc1	InChI=1S/C17H19N3S/c1-17(13-12-14-8-4-2-5-9-14)18-16(21)20(19-17)15-10-6-3-7-11-15/h2-11,19H,12-13H2,1H3,(H,18,21)	VXNOGTKFWDNXCN-UHFFFAOYSA-N	297.129968328							105039
MLS000731298	LSM-16403	SID24812732, BRD-K89438694	6622379	InChI=1S/C20H23ClN2O/c1-13-8-10-23(11-9-13)20(24)14-6-7-16-18(12-14)22-17-5-3-2-4-15(17)19(16)21/h6-7,12-13H,2-5,8-11H2,1H3	UEXPGQPSJGWVRA-UHFFFAOYSA-N	CC1CCN(CC1)C(=O)c2ccc3c(Cl)c4CCCCc4nc3c2	BroadT	BRD-K89438694	BRD-K89438694-001-06-9	ChemDiv Inc.	C598-0391			CC1CCN(CC1)C(=O)c1ccc2c(Cl)c3CCCCc3nc2c1	InChI=1S/C20H23ClN2O/c1-13-8-10-23(11-9-13)20(24)14-6-7-16-18(12-14)22-17-5-3-2-4-15(17)19(16)21/h6-7,12-13H,2-5,8-11H2,1H3	UEXPGQPSJGWVRA-UHFFFAOYSA-N	342.149891086							105040
N-[(2-Ethoxyphenyl)methylideneamino]-2-(2-prop-2-enylphenoxy)acetamide	LSM-16404	BRD-K23243704	757929	InChI=1S/C20H22N2O3/c1-3-9-16-10-5-7-12-18(16)25-15-20(23)22-21-14-17-11-6-8-13-19(17)24-4-2/h3,5-8,10-14H,1,4,9,15H2,2H3,(H,22,23)	YBICWEYHFIQRRT-UHFFFAOYSA-N	CCOc1ccccc1C=NNC(=O)COc2ccccc2CC=C	BroadT	BRD-K23243704	BRD-K23243704-001-05-2	Specs	AG-205/07770044			CCOc1ccccc1C=NNC(=O)COc1ccccc1CC=C	InChI=1S/C20H22N2O3/c1-3-9-16-10-5-7-12-18(16)25-15-20(23)22-21-14-17-11-6-8-13-19(17)24-4-2/h3,5-8,10-14H,1,4,9,15H2,2H3,(H,22,23)	YBICWEYHFIQRRT-UHFFFAOYSA-N	338.163042584							105041
MLS000556050	LSM-16405	SID17408321, BRD-K57588631	1143072	InChI=1S/C21H18N4O3S/c1-14-17-12-18(29-21(17)25(24-14)15-8-4-2-5-9-15)20(27)23-22-19(26)13-28-16-10-6-3-7-11-16/h2-12H,13H2,1H3,(H,22,26)(H,23,27)	AEPOHJYRCYPODV-UHFFFAOYSA-N	Cc1nn(c2ccccc2)c3sc(cc13)C(=O)NNC(=O)COc4ccccc4	BroadT	BRD-K57588631	BRD-K57588631-001-05-7	Asinex Ltd.	ASN 02070029			Cc1nn(-c2ccccc2)c2sc(cc12)C(=O)NNC(=O)COc1ccccc1	InChI=1S/C21H18N4O3S/c1-14-17-12-18(29-21(17)25(24-14)15-8-4-2-5-9-15)20(27)23-22-19(26)13-28-16-10-6-3-7-11-16/h2-12H,13H2,1H3,(H,22,26)(H,23,27)	AEPOHJYRCYPODV-UHFFFAOYSA-N	406.109961166							105042
3-Morpholino-4-(2-pyridinyl)-n-[3-(trifluoromethyl)phenyl]-1H-pyrazole-1-carboxamide	LSM-16406	SID24816970, BRD-K58094029	1482268	InChI=1S/C20H18F3N5O2/c21-20(22,23)14-4-3-5-15(12-14)25-19(29)28-13-16(17-6-1-2-7-24-17)18(26-28)27-8-10-30-11-9-27/h1-7,12-13H,8-11H2,(H,25,29)	UUSYTIHURXSSDR-UHFFFAOYSA-N	FC(F)(F)c1cccc(NC(=O)n2cc(c3ccccn3)c(n2)N4CCOCC4)c1	BroadT	BRD-K58094029	BRD-K58094029-001-05-5	Key Organics Ltd.	12B-020			FC(F)(F)c1cccc(NC(=O)n2cc(c(n2)N2CCOCC2)-c2ccccn2)c1	InChI=1S/C20H18F3N5O2/c21-20(22,23)14-4-3-5-15(12-14)25-19(29)28-13-16(17-6-1-2-7-24-17)18(26-28)27-8-10-30-11-9-27/h1-7,12-13H,8-11H2,(H,25,29)	UUSYTIHURXSSDR-UHFFFAOYSA-N	417.141259466							105043
ST089114	LSM-16407	SID17433201, BRD-K78234015	790567	InChI=1S/C17H18N2O2/c1-13(20)19-16-9-7-15(8-10-16)17(21)18-12-11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,18,21)(H,19,20)	MNPSTSJIPGRCAX-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)C(=O)NCCc2ccccc2	BroadT	BRD-K78234015	BRD-K78234015-001-05-9	ChemBridge Corporation	5249530			CC(=O)Nc1ccc(cc1)C(=O)NCCc1ccccc1	InChI=1S/C17H18N2O2/c1-13(20)19-16-9-7-15(8-10-16)17(21)18-12-11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,18,21)(H,19,20)	MNPSTSJIPGRCAX-UHFFFAOYSA-N	282.136827836							105044
SMR000199259	LSM-16408	SID17434057, BRD-K29027586	2948824	InChI=1S/C20H23NO/c22-20(15-14-16-8-4-5-9-16)21-19-13-7-6-12-18(19)17-10-2-1-3-11-17/h1-3,6-7,10-13,16H,4-5,8-9,14-15H2,(H,21,22)	XOZIVFWTMYSICP-UHFFFAOYSA-N	O=C(CCC1CCCC1)Nc2ccccc2c3ccccc3	BroadT	BRD-K29027586	BRD-K29027586-001-05-6	ChemBridge Corporation	7705531			O=C(CCC1CCCC1)Nc1ccccc1-c1ccccc1	InChI=1S/C20H23NO/c22-20(15-14-16-8-4-5-9-16)21-19-13-7-6-12-18(19)17-10-2-1-3-11-17/h1-3,6-7,10-13,16H,4-5,8-9,14-15H2,(H,21,22)	XOZIVFWTMYSICP-UHFFFAOYSA-N	293.177964366							105045
AC1LK7QA	LSM-16409	SID22405337, BRD-K65510346	986614	InChI=1S/C17H16BrNO4/c1-21-12-5-2-4-11(8-12)17(20)19-14-10-16-15(9-13(14)18)22-6-3-7-23-16/h2,4-5,8-10H,3,6-7H2,1H3,(H,19,20)	OILVVJOPMWSBKK-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Nc2cc3OCCCOc3cc2Br	BroadT	BRD-K65510346	BRD-K65510346-001-05-7	Specs	AR-378/42397720			COc1cccc(c1)C(=O)Nc1cc2OCCCOc2cc1Br	InChI=1S/C17H16BrNO4/c1-21-12-5-2-4-11(8-12)17(20)19-14-10-16-15(9-13(14)18)22-6-3-7-23-16/h2,4-5,8-10H,3,6-7H2,1H3,(H,19,20)	OILVVJOPMWSBKK-UHFFFAOYSA-N	377.026270602							105046
AC1O2TOJ	LSM-16410	SID26664062, BRD-A33872036	6236645	InChI=1S/C17H18N4O4/c1-10(22)21-13(11-7-5-4-6-8-11)9-12(18-21)14-15(23)19(2)17(25)20(3)16(14)24/h4-8,13,18H,9H2,1-3H3	HPCIYRPJQBJFFL-UHFFFAOYSA-N	CN1C(=O)N(C)C(=O)C(=C2CC(N(N2)C(=O)C)c3ccccc3)C1=O	BroadT	BRD-A33872036	BRD-A33872036-001-05-7	InterBioScreen Ltd.	STOCK5S-57847			CN1C(=O)N(C)C(=O)C(=C2CC(N(N2)C(C)=O)c2ccccc2)C1=O	InChI=1S/C17H18N4O4/c1-10(22)21-13(11-7-5-4-6-8-11)9-12(18-21)14-15(23)19(2)17(25)20(3)16(14)24/h4-8,13,18H,9H2,1-3H3	HPCIYRPJQBJFFL-UHFFFAOYSA-N	342.132805096							105047
AC1MYXPA	LSM-16411	SID7978197, BRD-K65831423	3839220	InChI=1S/C13H15ClN2O/c14-12-5-1-2-6-13(12)17-10-4-3-8-16-9-7-15-11-16/h1-2,5-7,9,11H,3-4,8,10H2	XOMVWWHMMQAEMP-UHFFFAOYSA-N	Clc1ccccc1OCCCCn2ccnc2	BroadT	BRD-K65831423	BRD-K65831423-001-06-1	ChemBridge Corporation	5362207			Clc1ccccc1OCCCCn1ccnc1	InChI=1S/C13H15ClN2O/c14-12-5-1-2-6-13(12)17-10-4-3-8-16-9-7-15-11-16/h1-2,5-7,9,11H,3-4,8,10H2	XOMVWWHMMQAEMP-UHFFFAOYSA-N	250.08729083							105048
6-Amino-4-(2-fluorophenyl)-2,3'-bipyridine-5-carbonitrile	LSM-16412	SID17513811, BRD-K84882667	3815403	InChI=1S/C17H11FN4/c18-15-6-2-1-5-12(15)13-8-16(11-4-3-7-21-10-11)22-17(20)14(13)9-19/h1-8,10H,(H2,20,22)	KYVKPYXKIVOQKO-UHFFFAOYSA-N	Nc1nc(cc(c2ccccc2F)c1C#N)c3cccnc3	BroadT	BRD-K84882667	BRD-K84882667-001-05-8	InterBioScreen Ltd.	STOCK5S-19997			Nc1nc(cc(-c2ccccc2F)c1C#N)-c1cccnc1	InChI=1S/C17H11FN4/c18-15-6-2-1-5-12(15)13-8-16(11-4-3-7-21-10-11)22-17(20)14(13)9-19/h1-8,10H,(H2,20,22)	KYVKPYXKIVOQKO-UHFFFAOYSA-N	290.096774592							105049
AC1MMGFR	LSM-16413	SID4243670, BRD-K15759015	3238361	InChI=1S/C13H10BrN3OS/c14-10-5-3-9(4-6-10)12-15-16-13(19)17(12)8-11-2-1-7-18-11/h1-7H,8H2,(H,16,19)	XTADONHSYKULFZ-UHFFFAOYSA-N	Sc1nnc(c2ccc(Br)cc2)n1Cc3occc3	BroadT	BRD-K15759015	BRD-K15759015-001-05-1	ChemDiv Inc.	6516-0014			Sc1nnc(-c2ccc(Br)cc2)n1Cc1ccco1	InChI=1S/C13H10BrN3OS/c14-10-5-3-9(4-6-10)12-15-16-13(19)17(12)8-11-2-1-7-18-11/h1-7H,8H2,(H,16,19)	XTADONHSYKULFZ-UHFFFAOYSA-N	334.97279526							105050
SMR000039653	LSM-16414	SID857377, BRD-K78046932	658723	InChI=1S/C22H29BrN4O3/c1-30-22(29)21-20(17-13-15(23)7-8-18(17)24-21)25-19(28)14-26-9-11-27(12-10-26)16-5-3-2-4-6-16/h7-8,13,16,24H,2-6,9-12,14H2,1H3,(H,25,28)	QMKBNQSBQGDFHU-UHFFFAOYSA-N	COC(=O)c1[nH]c2ccc(Br)cc2c1NC(=O)CN3CCN(CC3)C4CCCCC4	BroadT	BRD-K78046932	BRD-K78046932-001-06-5	InterBioScreen Ltd.	STOCK1S-63151			COC(=O)c1[nH]c2ccc(Br)cc2c1NC(=O)CN1CCN(CC1)C1CCCCC1	InChI=1S/C22H29BrN4O3/c1-30-22(29)21-20(17-13-15(23)7-8-18(17)24-21)25-19(28)14-26-9-11-27(12-10-26)16-5-3-2-4-6-16/h7-8,13,16,24H,2-6,9-12,14H2,1H3,(H,25,28)	QMKBNQSBQGDFHU-UHFFFAOYSA-N	476.142303428							105051
ASN 06118248	LSM-16415	SID852117, BRD-K47727977	654721	InChI=1S/C24H21N5O3/c1-17-9-10-22-18(12-17)13-19(24-25-26-27-29(22)24)14-28(15-21-8-5-11-31-21)23(30)16-32-20-6-3-2-4-7-20/h2-13H,14-16H2,1H3	DJYCSZBSFTYFEZ-UHFFFAOYSA-N	Cc1ccc2c(c1)cc(CN(Cc3occc3)C(=O)COc4ccccc4)c5nnnn25	BroadT	BRD-K47727977	BRD-K47727977-001-05-6	Asinex Ltd.	ASN 06118248			Cc1ccc2c(c1)cc(CN(Cc1ccco1)C(=O)COc1ccccc1)c1nnnn21	InChI=1S/C24H21N5O3/c1-17-9-10-22-18(12-17)13-19(24-25-26-27-29(22)24)14-28(15-21-8-5-11-31-21)23(30)16-32-20-6-3-2-4-7-20/h2-13H,14-16H2,1H3	DJYCSZBSFTYFEZ-UHFFFAOYSA-N	427.164439582							105052
F0871-0396	LSM-16416	SID24836520, BRD-K32464623	6834129	InChI=1S/C20H22N6O3S/c1-15-19(20(21)26(24-15)17-7-3-2-4-8-17)23-22-16-6-5-9-18(14-16)30(27,28)25-10-12-29-13-11-25/h2-9,14H,10-13,21H2,1H3	QHIQGKMEWIEQJK-UHFFFAOYSA-N	Cc1nn(c(N)c1N=Nc2cccc(c2)S(=O)(=O)N3CCOCC3)c4ccccc4	BroadT	BRD-K32464623	BRD-K32464623-001-06-9	Enamine Ltd.	T0503-0683			Cc1nn(c(N)c1N=Nc1cccc(c1)S(=O)(=O)N1CCOCC1)-c1ccccc1	InChI=1S/C20H22N6O3S/c1-15-19(20(21)26(24-15)17-7-3-2-4-8-17)23-22-16-6-5-9-18(14-16)30(27,28)25-10-12-29-13-11-25/h2-9,14H,10-13,21H2,1H3	QHIQGKMEWIEQJK-UHFFFAOYSA-N	426.147409314							
MLS000061644	LSM-16417	SID4258264, BRD-K36610803	818071	InChI=1S/C13H14N2O2/c1-14-12(16)10-5-4-9(8-11(10)13(14)17)15-6-2-3-7-15/h4-5,8H,2-3,6-7H2,1H3	BUSNFAONONZYCM-UHFFFAOYSA-N	CN1C(=O)c2ccc(cc2C1=O)N3CCCC3	BroadT	BRD-K36610803	BRD-K36610803-001-05-7	ChemBridge Corporation	5647651			CN1C(=O)c2ccc(cc2C1=O)N1CCCC1	InChI=1S/C13H14N2O2/c1-14-12(16)10-5-4-9(8-11(10)13(14)17)15-6-2-3-7-15/h4-5,8H,2-3,6-7H2,1H3	BUSNFAONONZYCM-UHFFFAOYSA-N	230.105527708							105054
MLS001219822	LSM-16418	SID49726508, BRD-K50699162	790478	InChI=1S/C16H11N3O6/c20-15(12-5-2-8-24-12)17-10-3-1-4-11(9-10)18-16(21)13-6-7-14(25-13)19(22)23/h1-9H,(H,17,20)(H,18,21)	ULWDBWHXYUCIPU-UHFFFAOYSA-N	[O-][N+](=O)c1oc(cc1)C(=O)Nc2cccc(NC(=O)c3occc3)c2	BroadT	BRD-K50699162	BRD-K50699162-001-07-2	Asinex Ltd.	BAS 00738308			[O-][N+](=O)c1ccc(o1)C(=O)Nc1cccc(NC(=O)c2ccco2)c1	InChI=1S/C16H11N3O6/c20-15(12-5-2-8-24-12)17-10-3-1-4-11(9-10)18-16(21)13-6-7-14(25-13)19(22)23/h1-9H,(H,17,20)(H,18,21)	ULWDBWHXYUCIPU-UHFFFAOYSA-N	341.064785102							105055
2-(3,4-Dichlorophenyl)imidazo[1,2-a]pyrimidine	LSM-16419	SID14736353, BRD-K01710461	706510	InChI=1S/C12H7Cl2N3/c13-9-3-2-8(6-10(9)14)11-7-17-5-1-4-15-12(17)16-11/h1-7H	WOBQGTFLIRGWOE-UHFFFAOYSA-N	Clc1ccc(cc1Cl)c2cn3cccnc3n2	BroadT	BRD-K01710461	BRD-K01710461-001-05-9	ChemBridge Corporation	7141575			Clc1ccc(cc1Cl)-c1cn2cccnc2n1	InChI=1S/C12H7Cl2N3/c13-9-3-2-8(6-10(9)14)11-7-17-5-1-4-15-12(17)16-11/h1-7H	WOBQGTFLIRGWOE-UHFFFAOYSA-N	263.001702674							105056
ZINC04702167	LSM-16420	SID22404479, BRD-K24073716	2899775	InChI=1S/C25H26N2O2S/c1-29-24-10-6-5-9-23(24)26-15-17-27(18-16-26)25(28)21-13-11-20(12-14-21)19-30-22-7-3-2-4-8-22/h2-14H,15-19H2,1H3	VRXBYMJLBWZPCK-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)C(=O)c3ccc(CSc4ccccc4)cc3	BroadT	BRD-K24073716	BRD-K24073716-001-05-8	ChemBridge Corporation	6481441			COc1ccccc1N1CCN(CC1)C(=O)c1ccc(CSc2ccccc2)cc1	InChI=1S/C25H26N2O2S/c1-29-24-10-6-5-9-23(24)26-15-17-27(18-16-26)25(28)21-13-11-20(12-14-21)19-30-22-7-3-2-4-8-22/h2-14H,15-19H2,1H3	VRXBYMJLBWZPCK-UHFFFAOYSA-N	418.171498782							105057
MLS000561741	LSM-16421	SID17507974, BRD-A67952922	3190977	InChI=1S/C29H32N6O3S/c1-20-10-12-21(13-11-20)28(29(37)31-22-7-4-3-5-8-22)35(27(36)18-24-9-6-16-39-24)23-14-15-25(26(17-23)38-2)34-19-30-32-33-34/h6,9-17,19,22,28H,3-5,7-8,18H2,1-2H3,(H,31,37)	NYVYBYFREXPLSM-UHFFFAOYSA-N	COc1cc(ccc1n2cnnn2)N(C(C(=O)NC3CCCCC3)c4ccc(C)cc4)C(=O)Cc5cccs5	BroadT	BRD-A67952922	BRD-A67952922-001-05-3	Asinex Ltd.	ASN 04883233			COc1cc(ccc1-n1cnnn1)N(C(C(=O)NC1CCCCC1)c1ccc(C)cc1)C(=O)Cc1cccs1	InChI=1S/C29H32N6O3S/c1-20-10-12-21(13-11-20)28(29(37)31-22-7-4-3-5-8-22)35(27(36)18-24-9-6-16-39-24)23-14-15-25(26(17-23)38-2)34-19-30-32-33-34/h6,9-17,19,22,28H,3-5,7-8,18H2,1-2H3,(H,31,37)	NYVYBYFREXPLSM-UHFFFAOYSA-N	544.225659634							105058
6-Phenyl-3-pyridin-2-yl-1,2,4-triazine	LSM-16422	BRD-K75989234, SID46501382	6405118	InChI=1S/C14H10N4/c1-2-6-11(7-3-1)13-10-16-14(18-17-13)12-8-4-5-9-15-12/h1-10H	AUTKUCVVRPJBCM-UHFFFAOYSA-N	c1ccc(cc1)c2cnc(nn2)c3ccccn3	BroadT	BRD-K75989234	BRD-K75989234-001-05-6	University of California at Davis	LY-SH2-002			c1ccc(cc1)-c1cnc(nn1)-c1ccccn1	InChI=1S/C14H10N4/c1-2-6-11(7-3-1)13-10-16-14(18-17-13)12-8-4-5-9-15-12/h1-10H	AUTKUCVVRPJBCM-UHFFFAOYSA-N	234.09054636							105059
STK036892	LSM-16423	SID22413481, BRD-K10476649	1224430	InChI=1S/C16H15FN2O3S/c1-21-11-6-8-12(9-7-11)22-10-15(20)19-16(23)18-14-5-3-2-4-13(14)17/h2-9H,10H2,1H3,(H2,18,19,20,23)	LNZCJNUEANFGNY-UHFFFAOYSA-N	COc1ccc(OCC(=O)NC(=S)Nc2ccccc2F)cc1	BroadT	BRD-K10476649	BRD-K10476649-001-05-1	Specs	AG-670/40802758			COc1ccc(OCC(=O)NC(=S)Nc2ccccc2F)cc1	InChI=1S/C16H15FN2O3S/c1-21-11-6-8-12(9-7-11)22-10-15(20)19-16(23)18-14-5-3-2-4-13(14)17/h2-9H,10H2,1H3,(H2,18,19,20,23)	LNZCJNUEANFGNY-UHFFFAOYSA-N	334.07874125							105060
AC1OANAH	LSM-16424	BRD-K06759762	6832355	InChI=1S/C19H19N5O5/c1-28-16-6-3-11(8-17(16)29-2)7-14-18(27)21-19(24-22-14)23-20-10-12-4-5-13(25)9-15(12)26/h3-6,8-10,25-26H,7H2,1-2H3,(H2,21,23,24,27)	CMPAUHRNQHFETD-UHFFFAOYSA-N	COc1ccc(Cc2nnc(NN=Cc3ccc(O)cc3O)nc2O)cc1OC	BroadT	BRD-K06759762	BRD-K06759762-001-06-5	InterBioScreen Ltd.	STOCK1S-58883			COc1ccc(Cc2nnc(NN=Cc3ccc(O)cc3O)nc2O)cc1OC	InChI=1S/C19H19N5O5/c1-28-16-6-3-11(8-17(16)29-2)7-14-18(27)21-19(24-22-14)23-20-10-12-4-5-13(25)9-15(12)26/h3-6,8-10,25-26H,7H2,1-2H3,(H2,21,23,24,27)	CMPAUHRNQHFETD-UHFFFAOYSA-N	397.138618758							
SMR000075739	LSM-16425	SID4261024, SID7969329, BRD-K11045750	2200936	InChI=1S/C16H15N3O3S2/c1-22-13-10-8-12(9-11-13)15-17-16(23-2)19(18-15)24(20,21)14-6-4-3-5-7-14/h3-11H,1-2H3	YBRGSFBFGNUDDE-UHFFFAOYSA-N	COc1ccc(cc1)c2nc(SC)n(n2)S(=O)(=O)c3ccccc3	BroadT	BRD-K11045750	BRD-K11045750-001-05-8	ChemDiv Inc.	6529-0185			COc1ccc(cc1)-c1nc(SC)n(n1)S(=O)(=O)c1ccccc1	InChI=1S/C16H15N3O3S2/c1-22-13-10-8-12(9-11-13)15-17-16(23-2)19(18-15)24(20,21)14-6-4-3-5-7-14/h3-11H,1-2H3	YBRGSFBFGNUDDE-UHFFFAOYSA-N	361.05548275							105062
MLS000039358	LSM-16426	SID7964700, SID861491, BRD-A70287848	662731	InChI=1S/C17H15N3O2/c1-10-5-7-12(8-6-10)20-16(13-4-3-9-22-13)14-11(2)18-19-15(14)17(20)21/h3-9,16H,1-2H3,(H,18,19)	YSROIMPUTDSXKE-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(c3occc3)c4c(C)n[nH]c4C2=O	BroadT	BRD-A70287848	BRD-A70287848-001-06-8	ChemDiv Inc.	C390-0249			Cc1n[nH]c2C(=O)N(C(c3ccco3)c12)c1ccc(C)cc1	InChI=1S/C17H15N3O2/c1-10-5-7-12(8-6-10)20-16(13-4-3-9-22-13)14-11(2)18-19-15(14)17(20)21/h3-9,16H,1-2H3,(H,18,19)	YSROIMPUTDSXKE-UHFFFAOYSA-N	293.11642675							105063
MLS000028236	LSM-16427	SID26726358, SID850929, BRD-A44716534	653474	InChI=1S/C26H25ClN4O4/c27-18-8-6-17(7-9-18)24(25(32)30-19-4-2-1-3-5-19)31(26(33)21-15-28-12-13-29-21)20-10-11-22-23(14-20)35-16-34-22/h6-15,19,24H,1-5,16H2,(H,30,32)	SYWSGOPRJUTCDO-UHFFFAOYSA-N	Clc1ccc(cc1)C(N(C(=O)c2cnccn2)c3ccc4OCOc4c3)C(=O)NC5CCCCC5	BroadT	BRD-A44716534	BRD-A44716534-001-06-8	Asinex Ltd.	ASN 04361909			Clc1ccc(cc1)C(N(C(=O)c1cnccn1)c1ccc2OCOc2c1)C(=O)NC1CCCCC1	InChI=1S/C26H25ClN4O4/c27-18-8-6-17(7-9-18)24(25(32)30-19-4-2-1-3-5-19)31(26(33)21-15-28-12-13-29-21)20-10-11-22-23(14-20)35-16-34-22/h6-15,19,24H,1-5,16H2,(H,30,32)	SYWSGOPRJUTCDO-UHFFFAOYSA-N	492.15643303							105064
SMR000066435	LSM-16428	SID3714656, BRD-K85442767	2098833	InChI=1S/C16H18ClN5O4S2/c1-11-15(24)18-16(20-19-11)27-10-14(23)21-6-8-22(9-7-21)28(25,26)13-4-2-12(17)3-5-13/h2-5H,6-10H2,1H3,(H,18,20,24)	INXLTEBJWFQKPN-UHFFFAOYSA-N	Cc1nnc(SCC(=O)N2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3)nc1O	BroadT	BRD-K85442767	BRD-K85442767-001-05-9	Enamine Ltd.	T5231581			Cc1nnc(SCC(=O)N2CCN(CC2)S(=O)(=O)c2ccc(Cl)cc2)nc1O	InChI=1S/C16H18ClN5O4S2/c1-11-15(24)18-16(20-19-11)27-10-14(23)21-6-8-22(9-7-21)28(25,26)13-4-2-12(17)3-5-13/h2-5H,6-10H2,1H3,(H,18,20,24)	INXLTEBJWFQKPN-UHFFFAOYSA-N	443.048873196							105065
AC1M7S4P	LSM-16429	BRD-K46576160	2424465	InChI=1S/C16H17N3OS/c1-12-6-5-7-13(10-12)11-17-19-16(21)18-14-8-3-4-9-15(14)20-2/h3-11H,1-2H3,(H2,18,19,21)	SWEOWLIUIMWNKO-UHFFFAOYSA-N	COc1ccccc1N=C(S)NN=Cc2cccc(C)c2	BroadT	BRD-K46576160	BRD-K46576160-001-05-5	Enamine Ltd.	T0515-8915			COc1ccccc1N=C(S)NN=Cc1cccc(C)c1	InChI=1S/C16H17N3OS/c1-12-6-5-7-13(10-12)11-17-19-16(21)18-14-8-3-4-9-15(14)20-2/h3-11H,1-2H3,(H2,18,19,21)	SWEOWLIUIMWNKO-UHFFFAOYSA-N	299.109232884							105066
MLS001030049	LSM-15189	BRD-K28560129	1899727	InChI=1S/C18H14BrN4O/c1-22-18-15(19)9-23(10-16(18)20-21-22)11-17(24)14-7-6-12-4-2-3-5-13(12)8-14/h2-10H,11H2,1H3/q+1	OXTWOFOMWUURDJ-UHFFFAOYSA-N	Cn1nnc2c[n+](CC(=O)c3ccc4ccccc4c3)cc(Br)c12	BroadT	BRD-K28560129	BRD-K28560129-004-06-3	InterBioScreen Ltd.	STOCK1S-59982		Br	Cn1nnc2c[n+](CC(=O)c3ccc4ccccc4c3)cc(Br)c12.Br	InChI=1S/C18H14BrN4O.BrH/c1-22-18-15(19)9-23(10-16(18)20-21-22)11-17(24)14-7-6-12-4-2-3-5-13(12)8-14;/h2-10H,11H2,1H3;1H/q+1;	AHFMJFTXXJPDGV-UHFFFAOYSA-N	381.035098708							103839, 103839
SMR000076391	LSM-16430	SID4260258, SID85301409, BRD-K97218485	1294322	InChI=1S/C24H21N3O3/c1-16-3-7-18(8-4-16)23-26-27-24(30-23)19-9-11-20(12-10-19)25-22(28)15-17-5-13-21(29-2)14-6-17/h3-14H,15H2,1-2H3,(H,25,28)	PACKUEYOUHHCHU-UHFFFAOYSA-N	COc1ccc(CC(=O)Nc2ccc(cc2)c3oc(nn3)c4ccc(C)cc4)cc1	BroadT	BRD-K97218485	BRD-K97218485-001-05-0	ChemBridge Corporation	7782361			COc1ccc(CC(=O)Nc2ccc(cc2)-c2nnc(o2)-c2ccc(C)cc2)cc1	InChI=1S/C24H21N3O3/c1-16-3-7-18(8-4-16)23-26-27-24(30-23)19-9-11-20(12-10-19)25-22(28)15-17-5-13-21(29-2)14-6-17/h3-14H,15H2,1-2H3,(H,25,28)	PACKUEYOUHHCHU-UHFFFAOYSA-N	399.158291562							105067
ST50666772	LSM-16431	SID24783172, BRD-K11019035	2218611	InChI=1S/C13H13N3O4S2/c1-18-4-5-21-13-16-15-12(22-13)14-11(17)8-2-3-9-10(6-8)20-7-19-9/h2-3,6H,4-5,7H2,1H3,(H,14,15,17)	AWQMDMUUXYJKJJ-UHFFFAOYSA-N	COCCSc1nnc(NC(=O)c2ccc3OCOc3c2)s1	BroadT	BRD-K11019035	BRD-K11019035-001-05-0	ChemBridge Corporation	7908699			COCCSc1nnc(NC(=O)c2ccc3OCOc3c2)s1	InChI=1S/C13H13N3O4S2/c1-18-4-5-21-13-16-15-12(22-13)14-11(17)8-2-3-9-10(6-8)20-7-19-9/h2-3,6H,4-5,7H2,1H3,(H,14,15,17)	AWQMDMUUXYJKJJ-UHFFFAOYSA-N	339.034747306							105068
MLS000402296	LSM-16432	BRD-A14556598	3749969	InChI=1S/C22H23NO5/c1-5-16(22(24)25)23-17-12-20(28-18-8-6-13(2)10-15(17)18)14-7-9-19(26-3)21(11-14)27-4/h6-12,16H,5H2,1-4H3,(H,24,25)	MSOJOKQYWZTZTD-UHFFFAOYSA-N	CCC(N=C1C=C(Oc2ccc(C)cc12)c3ccc(OC)c(OC)c3)C(=O)O	BroadT	BRD-A14556598	BRD-A14556598-001-06-7	Enamine Ltd.	T0518-2801			CCC(N=c1cc(oc2ccc(C)cc12)-c1ccc(OC)c(OC)c1)C(O)=O	InChI=1S/C22H23NO5/c1-5-16(22(24)25)23-17-12-20(28-18-8-6-13(2)10-15(17)18)14-7-9-19(26-3)21(11-14)27-4/h6-12,16H,5H2,1-4H3,(H,24,25)	MSOJOKQYWZTZTD-UHFFFAOYSA-N	381.157622846							105069
SMR000081209	LSM-16433	SID4258675, BRD-K70220446	866907	InChI=1S/C14H17N3O5S/c1-15-12-4-3-10(9-11(12)13(18)16(2)14(15)19)23(20,21)17-5-7-22-8-6-17/h3-4,9H,5-8H2,1-2H3	SYHOKENSBZCPDV-UHFFFAOYSA-N	CN1C(=O)N(C)c2ccc(cc2C1=O)S(=O)(=O)N3CCOCC3	BroadT	BRD-K70220446	BRD-K70220446-001-05-5	ChemBridge Corporation	7956048			Cn1c2ccc(cc2c(=O)n(C)c1=O)S(=O)(=O)N1CCOCC1	InChI=1S/C14H17N3O5S/c1-15-12-4-3-10(9-11(12)13(18)16(2)14(15)19)23(20,21)17-5-7-22-8-6-17/h3-4,9H,5-8H2,1-2H3	SYHOKENSBZCPDV-UHFFFAOYSA-N	339.088891364							105070
8P-012	LSM-43640	SID24824593, BRD-K41310524	5525072	InChI=1S/C11H9BrN2O2S/c1-14-10(15)9(17-11(14)16)6-13-8-4-2-7(12)3-5-8/h2-6,13H,1H3/b9-6+	NADZSSOKFQALQP-RMKNXTFCSA-N	CN1C(=O)S\C(=C\Nc2ccc(Br)cc2)\C1=O	BroadT	BRD-K41310524	BRD-K41310524-001-05-5	Key Organics Ltd.	8P-012			CN1C(=O)S\C(=C\Nc2ccc(Br)cc2)C1=O	InChI=1S/C11H9BrN2O2S/c1-14-10(15)9(17-11(14)16)6-13-8-4-2-7(12)3-5-8/h2-6,13H,1H3/b9-6+	NADZSSOKFQALQP-RMKNXTFCSA-N	311.956810838							
AC1MQNHW	LSM-16435	BRD-K71432862	3504580	InChI=1S/C16H14N4O2/c1-22-15(21)12-8-6-11(7-9-12)10-17-20-16-18-13-4-2-3-5-14(13)19-16/h2-10H,1H3,(H2,18,19,20)	DVCFPZMWHDJJJB-UHFFFAOYSA-N	COC(=O)c1ccc(C=NNc2nc3ccccc3[nH]2)cc1	BroadT	BRD-K71432862	BRD-K71432862-001-05-0	Enamine Ltd.	T0507-8115			COC(=O)c1ccc(C=NNc2nc3ccccc3[nH]2)cc1	InChI=1S/C16H14N4O2/c1-22-15(21)12-8-6-11(7-9-12)10-17-20-16-18-13-4-2-3-5-14(13)19-16/h2-10H,1H3,(H2,18,19,20)	DVCFPZMWHDJJJB-UHFFFAOYSA-N	294.111675728							105072
AC1N0RNU	LSM-16436	BRD-K91614426	3921734	InChI=1S/C16H13F3N2O2S/c1-10-4-6-11(7-5-10)15(23)21-20-14(16(17,18)19)9-12(22)13-3-2-8-24-13/h2-8H,9H2,1H3,(H,21,23)	GQOKUNOAZLYGSC-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)NN=C(CC(=O)c2cccs2)C(F)(F)F	BroadT	BRD-K91614426	BRD-K91614426-001-05-8	ChemDiv Inc.	8007-8202			Cc1ccc(cc1)C(=O)NN=C(CC(=O)c1cccs1)C(F)(F)F	InChI=1S/C16H13F3N2O2S/c1-10-4-6-11(7-5-10)15(23)21-20-14(16(17,18)19)9-12(22)13-3-2-8-24-13/h2-8H,9H2,1H3,(H,21,23)	GQOKUNOAZLYGSC-UHFFFAOYSA-N	354.064982966							105073
MLS000732550	LSM-16437	SID24800178, BRD-K65946577	16191847	InChI=1S/C18H22ClN3O3/c19-14-3-1-13(2-4-14)11-18(12-23)7-9-22(10-8-18)17(25)15-5-6-16(24)21-20-15/h1-4,23H,5-12H2,(H,21,24)	ARDAJBPAFNRCTM-UHFFFAOYSA-N	OCC1(Cc2ccc(Cl)cc2)CCN(CC1)C(=O)C3=NNC(=O)CC3	BroadT	BRD-K65946577	BRD-K65946577-001-05-3	ChemBridge Corporation	67930833			OCC1(Cc2ccc(Cl)cc2)CCN(CC1)C(=O)C1=NNC(=O)CC1	InChI=1S/C18H22ClN3O3/c19-14-3-1-13(2-4-14)11-18(12-23)7-9-22(10-8-18)17(25)15-5-6-16(24)21-20-15/h1-4,23H,5-12H2,(H,21,24)	ARDAJBPAFNRCTM-UHFFFAOYSA-N	363.134969304							105074
SMR000065391	LSM-16438	SID3711415, BRD-K91598841	2543587	InChI=1S/C18H16N4S2/c1-12-7-3-5-9-15(12)22-13(2)20-21-18(22)23-11-17-19-14-8-4-6-10-16(14)24-17/h3-10H,11H2,1-2H3	JVHKCESNBIOLIT-UHFFFAOYSA-N	Cc1ccccc1n2c(C)nnc2SCc3nc4ccccc4s3	BroadT	BRD-K91598841	BRD-K91598841-001-06-8	Enamine Ltd.	ZU-4151286			Cc1nnc(SCc2nc3ccccc3s2)n1-c1ccccc1C	InChI=1S/C18H16N4S2/c1-12-7-3-5-9-15(12)22-13(2)20-21-18(22)23-11-17-19-14-8-4-6-10-16(14)24-17/h3-10H,11H2,1-2H3	JVHKCESNBIOLIT-UHFFFAOYSA-N	352.081637932							105075
MLS000687380	LSM-15530	BRD-K46734394	1126136	InChI=1S/C19H21N3O3S/c1-26-18-8-2-15(3-9-18)14-20-10-12-21(13-11-20)19(23)16-4-6-17(7-5-16)22(24)25/h2-9H,10-14H2,1H3	RBIMEIXDDYSEGP-UHFFFAOYSA-N	CSc1ccc(CN2CCN(CC2)C(=O)c3ccc(cc3)[N+](=O)[O-])cc1	BroadT	BRD-K46734394	BRD-K46734394-034-05-9	Asinex Ltd.	BAS 01840138		OC(=O)C(=O)O	CSc1ccc(CN2CCN(CC2)C(=O)c2ccc(cc2)[N+]([O-])=O)cc1.OC(=O)C(=O)O	InChI=1S/C19H21N3O3S.C2H2O4/c1-26-18-8-2-15(3-9-18)14-20-10-12-21(13-11-20)19(23)16-4-6-17(7-5-16)22(24)25;3-1(4)2(5)6/h2-9H,10-14H2,1H3;(H,3,4)(H,5,6)	KLSXZWNPHOXTTI-UHFFFAOYSA-N	371.130362252							104166, 104166
AC1LZ42Z	LSM-16439	BRD-K15994694	1913679	InChI=1S/C21H20N4O5/c1-29-19-10-5-15(12-20(19)30-2)13-21(26)23-22-14-18-4-3-11-24(18)16-6-8-17(9-7-16)25(27)28/h3-12,14H,13H2,1-2H3,(H,23,26)	WHQVUQZVIMLTTA-UHFFFAOYSA-N	COc1ccc(CC(=O)NN=Cc2cccn2c3ccc(cc3)[N+](=O)[O-])cc1OC	BroadT	BRD-K15994694	BRD-K15994694-001-05-2	InterBioScreen Ltd.	STOCK2S-01791			COc1ccc(CC(=O)NN=Cc2cccn2-c2ccc(cc2)[N+]([O-])=O)cc1OC	InChI=1S/C21H20N4O5/c1-29-19-10-5-15(12-20(19)30-2)13-21(26)23-22-14-18-4-3-11-24(18)16-6-8-17(9-7-16)25(27)28/h3-12,14H,13H2,1-2H3,(H,23,26)	WHQVUQZVIMLTTA-UHFFFAOYSA-N	408.14336978							105076
1-Benzotriazol-1-yl-3-o-tolyloxy-propan-2-ol	LSM-16440	SID14726901, BRD-A64408490	3133140	InChI=1S/C16H17N3O2/c1-12-6-2-5-9-16(12)21-11-13(20)10-19-15-8-4-3-7-14(15)17-18-19/h2-9,13,20H,10-11H2,1H3	RGCCDLNIENZMLH-UHFFFAOYSA-N	Cc1ccccc1OCC(O)Cn2nnc3ccccc23	BroadT	BRD-A64408490	BRD-A64408490-001-04-4	Asinex Ltd.	BAS 01813378			Cc1ccccc1OCC(O)Cn1nnc2ccccc12	InChI=1S/C16H17N3O2/c1-12-6-2-5-9-16(12)21-11-13(20)10-19-15-8-4-3-7-14(15)17-18-19/h2-9,13,20H,10-11H2,1H3	RGCCDLNIENZMLH-UHFFFAOYSA-N	283.132076814							105077
EN300-12660	LSM-16441	SID22401229, BRD-K62822784	4962025	InChI=1S/C19H19N3O2S/c1-12-5-7-13(8-6-12)15-11-14(18(23)24)16-17(20-15)21-19(25-16)22-9-3-2-4-10-22/h5-8,11H,2-4,9-10H2,1H3,(H,23,24)	AZLNHYOVLUPYEJ-UHFFFAOYSA-N	Cc1ccc(cc1)c2cc(C(=O)O)c3sc(nc3n2)N4CCCCC4	BroadT	BRD-K62822784	BRD-K62822784-001-05-8	Enamine Ltd.	T5342954			Cc1ccc(cc1)-c1cc(C(O)=O)c2sc(nc2n1)N1CCCCC1	InChI=1S/C19H19N3O2S/c1-12-5-7-13(8-6-12)15-11-14(18(23)24)16-17(20-15)21-19(25-16)22-9-3-2-4-10-22/h5-8,11H,2-4,9-10H2,1H3,(H,23,24)	AZLNHYOVLUPYEJ-UHFFFAOYSA-N	353.119797568							105078
2-(1,4,5,7-Tetramethyl-pyrrolo[3,4-d]pyridazin-6-yl)-phenylamine	LSM-16442	SID24804218, BRD-K08490863	787583	InChI=1S/C16H18N4/c1-9-15-11(3)20(14-8-6-5-7-13(14)17)12(4)16(15)10(2)19-18-9/h5-8H,17H2,1-4H3	AYTUMDQLEWFJFP-UHFFFAOYSA-N	Cc1nnc(C)c2c(C)n(c(C)c12)c3ccccc3N	BroadT	BRD-K08490863	BRD-K08490863-001-05-5	Asinex Ltd.	BAS 03016696			Cc1n(c(C)c2c(C)nnc(C)c12)-c1ccccc1N	InChI=1S/C16H18N4/c1-9-15-11(3)20(14-8-6-5-7-13(14)17)12(4)16(15)10(2)19-18-9/h5-8H,17H2,1-4H3	AYTUMDQLEWFJFP-UHFFFAOYSA-N	266.153146616							105079
HMS2572B22	LSM-16443	BRD-K37765885	12005354	InChI=1S/C24H29N5O3S2/c1-3-32-23-10-6-5-9-21(23)26-24(33)27-25-16-18-17-28(2)22-12-11-19(15-20(18)22)34(30,31)29-13-7-4-8-14-29/h5-6,9-12,15-17H,3-4,7-8,13-14H2,1-2H3,(H2,26,27,33)	OLICJMBCGOUBNZ-UHFFFAOYSA-N	CCOc1ccccc1N=C(S)NN=Cc2cn(C)c3ccc(cc23)S(=O)(=O)N4CCCCC4	BroadT	BRD-K37765885	BRD-K37765885-001-05-9	ChemDiv Inc.	C348-0342			CCOc1ccccc1N=C(S)NN=Cc1cn(C)c2ccc(cc12)S(=O)(=O)N1CCCCC1	InChI=1S/C24H29N5O3S2/c1-3-32-23-10-6-5-9-21(23)26-24(33)27-25-16-18-17-28(2)22-12-11-19(15-20(18)22)34(30,31)29-13-7-4-8-14-29/h5-6,9-12,15-17H,3-4,7-8,13-14H2,1-2H3,(H2,26,27,33)	OLICJMBCGOUBNZ-UHFFFAOYSA-N	499.171181218							105080
ZINC00093430	LSM-16444	SID24809659, BRD-K20214117	706754	InChI=1S/C17H20N4/c1-9-6-7-14(8-15(9)18)21-12(4)16-10(2)19-20-11(3)17(16)13(21)5/h6-8H,18H2,1-5H3	OBKZEVMWVGYNFV-UHFFFAOYSA-N	Cc1ccc(cc1N)n2c(C)c3c(C)nnc(C)c3c2C	BroadT	BRD-K20214117	BRD-K20214117-001-05-7	Asinex Ltd.	BAS 03016692			Cc1n(c(C)c2c(C)nnc(C)c12)-c1ccc(C)c(N)c1	InChI=1S/C17H20N4/c1-9-6-7-14(8-15(9)18)21-12(4)16-10(2)19-20-11(3)17(16)13(21)5/h6-8H,18H2,1-5H3	OBKZEVMWVGYNFV-UHFFFAOYSA-N	280.16879668							105081
ST50776931	LSM-16445	SID22415905, BRD-K09769137	805518	InChI=1S/C17H18N2OS/c1-20-16-8-6-15(7-9-16)18-17(21)19-11-10-13-4-2-3-5-14(13)12-19/h2-9H,10-12H2,1H3,(H,18,21)	FRINAVHAQPHEQI-UHFFFAOYSA-N	COc1ccc(NC(=S)N2CCc3ccccc3C2)cc1	BroadT	BRD-K09769137	BRD-K09769137-001-05-1	ChemBridge Corporation	6680706			COc1ccc(NC(=S)N2CCc3ccccc3C2)cc1	InChI=1S/C17H18N2OS/c1-20-16-8-6-15(7-9-16)18-17(21)19-11-10-13-4-2-3-5-14(13)12-19/h2-9H,10-12H2,1H3,(H,18,21)	FRINAVHAQPHEQI-UHFFFAOYSA-N	298.113983906							105082
MLS000101498	LSM-16446	SID7970979, BRD-A37852093	4454085	InChI=1S/C20H20N4O5S/c1-3-29-15(25)10-13-17(26)21-6-8-23(13)20(28)14-9-12-18(30-14)22-16-11(2)5-4-7-24(16)19(12)27/h4-5,7,9,13H,3,6,8,10H2,1-2H3,(H,21,26)	INXWVCJVINUPKX-UHFFFAOYSA-N	CCOC(=O)CC1N(CCNC1=O)C(=O)c2cc3C(=O)N4C=CC=C(C)C4=Nc3s2	BroadT	BRD-A37852093	BRD-A37852093-001-04-8	Life Chemicals Inc.	F0598-0453			CCOC(=O)CC1N(CCNC1=O)C(=O)c1cc2c(nc3c(C)cccn3c2=O)s1	InChI=1S/C20H20N4O5S/c1-3-29-15(25)10-13-17(26)21-6-8-23(13)20(28)14-9-12-18(30-14)22-16-11(2)5-4-7-24(16)19(12)27/h4-5,7,9,13H,3,6,8,10H2,1-2H3,(H,21,26)	INXWVCJVINUPKX-UHFFFAOYSA-N	428.11544047							105083
MLS000578786	LSM-16447	SID17412191, BRD-A41717767	2856656	InChI=1S/C25H27NO6S/c1-4-16(3)23(26-33(29,30)18-11-8-15(2)9-12-18)25(28)31-17-10-13-20-19-6-5-7-21(19)24(27)32-22(20)14-17/h8-14,16,23,26H,4-7H2,1-3H3	FHTZPDQLIGELRN-UHFFFAOYSA-N	CCC(C)C(NS(=O)(=O)c1ccc(C)cc1)C(=O)Oc2ccc3C4=C(CCC4)C(=O)Oc3c2	BroadT	BRD-A41717767	BRD-A41717767-001-05-9	ChemBridge Corporation	5627481			CCC(C)C(NS(=O)(=O)c1ccc(C)cc1)C(=O)Oc1ccc2c3CCCc3c(=O)oc2c1	InChI=1S/C25H27NO6S/c1-4-16(3)23(26-33(29,30)18-11-8-15(2)9-12-18)25(28)31-17-10-13-20-19-6-5-7-21(19)24(27)32-22(20)14-17/h8-14,16,23,26H,4-7H2,1-3H3	FHTZPDQLIGELRN-UHFFFAOYSA-N	469.155908284							105084
SMR000064710	LSM-16448	SID3713536, BRD-K29289435	2541057	InChI=1S/C23H24N4O4/c1-2-27-22(28)18-6-4-3-5-17(18)21(24-27)23(29)26-11-9-25(10-12-26)14-16-7-8-19-20(13-16)31-15-30-19/h3-8,13H,2,9-12,14-15H2,1H3	VLFYYHLLIZTFSW-UHFFFAOYSA-N	CCN1N=C(C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)c5ccccc5C1=O	BroadT	BRD-K29289435	BRD-K29289435-001-05-5	Enamine Ltd.	T5338106			CCn1nc(C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)c2ccccc2c1=O	InChI=1S/C23H24N4O4/c1-2-27-22(28)18-6-4-3-5-17(18)21(24-27)23(29)26-11-9-25(10-12-26)14-16-7-8-19-20(13-16)31-15-30-19/h3-8,13H,2,9-12,14-15H2,1H3	VLFYYHLLIZTFSW-UHFFFAOYSA-N	420.179755288							105085
SMR000005224	LSM-16449	SID26668325, SID853559, BRD-A18166681	656218	InChI=1S/C24H23N5O5S/c1-32-11-10-25-24(31)23(21-7-4-12-35-21)29(16-8-9-19-20(13-16)34-15-33-19)22(30)14-28-18-6-3-2-5-17(18)26-27-28/h2-9,12-13,23H,10-11,14-15H2,1H3,(H,25,31)	WZXHULVBRKNQGA-UHFFFAOYSA-N	COCCNC(=O)C(N(C(=O)Cn1nnc2ccccc12)c3ccc4OCOc4c3)c5cccs5	BroadT	BRD-A18166681	BRD-A18166681-001-05-1	Asinex Ltd.	ASN 05586416			COCCNC(=O)C(N(C(=O)Cn1nnc2ccccc12)c1ccc2OCOc2c1)c1cccs1	InChI=1S/C24H23N5O5S/c1-32-11-10-25-24(31)23(21-7-4-12-35-21)29(16-8-9-19-20(13-16)34-15-33-19)22(30)14-28-18-6-3-2-5-17(18)26-27-28/h2-9,12-13,23H,10-11,14-15H2,1H3,(H,25,31)	WZXHULVBRKNQGA-UHFFFAOYSA-N	493.141989576							105086
MLS000331630	LSM-43641	SID17514185, BRD-A39920162	5775810	InChI=1S/C26H22N2O3/c1-19(29)31-25-15-9-8-14-22(25)23-18-24(21-12-6-3-7-13-21)28(27-23)26(30)17-16-20-10-4-2-5-11-20/h2-17,24H,18H2,1H3/b17-16+	NBHUZZWIEJRLIX-WUKNDPDISA-N	CC(=O)Oc1ccccc1C2=NN(C(C2)c3ccccc3)C(=O)\C=C\c4ccccc4	BroadT	BRD-A39920162	BRD-A39920162-001-06-2	InterBioScreen Ltd.	STOCK4S-44740			CC(=O)Oc1ccccc1C1=NN(C(C1)c1ccccc1)C(=O)\C=C\c1ccccc1	InChI=1S/C26H22N2O3/c1-19(29)31-25-15-9-8-14-22(25)23-18-24(21-12-6-3-7-13-21)28(27-23)26(30)17-16-20-10-4-2-5-11-20/h2-17,24H,18H2,1H3/b17-16+	NBHUZZWIEJRLIX-WUKNDPDISA-N	410.163042584							
(1-P-tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanyl)-acetic acid ethyl ester	LSM-16451	SID852520, BRD-K46818361	655144	InChI=1S/C16H16N4O2S/c1-3-22-14(21)9-23-16-13-8-19-20(15(13)17-10-18-16)12-6-4-11(2)5-7-12/h4-8,10H,3,9H2,1-2H3	XUVHWWHRMKGYMV-UHFFFAOYSA-N	CCOC(=O)CSc1ncnc2c1cnn2c3ccc(C)cc3	BroadT	BRD-K46818361	BRD-K46818361-001-05-8	Asinex Ltd.	ASN 05099835			CCOC(=O)CSc1ncnc2n(ncc12)-c1ccc(C)cc1	InChI=1S/C16H16N4O2S/c1-3-22-14(21)9-23-16-13-8-19-20(15(13)17-10-18-16)12-6-4-11(2)5-7-12/h4-8,10H,3,9H2,1-2H3	XUVHWWHRMKGYMV-UHFFFAOYSA-N	328.099396482							105088
AN-698/42295242	LSM-16452	BRD-K37962965	838623	InChI=1S/C16H13ClN2O2S/c1-10-14(11-5-7-12(17)8-6-11)19(2)16(22-10)18-15(20)13-4-3-9-21-13/h3-9H,1-2H3	HLDNTBDDSZYDMO-UHFFFAOYSA-N	CN1C(=NC(=O)c2occc2)SC(=C1c3ccc(Cl)cc3)C	BroadT	BRD-K37962965	BRD-K37962965-001-05-5	Specs	AN-698/42295242			Cc1sc(=NC(=O)c2ccco2)n(C)c1-c1ccc(Cl)cc1	InChI=1S/C16H13ClN2O2S/c1-10-14(11-5-7-12(17)8-6-11)19(2)16(22-10)18-15(20)13-4-3-9-21-13/h3-9H,1-2H3	HLDNTBDDSZYDMO-UHFFFAOYSA-N	332.038626076							105089
AC1MPQUF	LSM-15248	BRD-A15641585	3439740	InChI=1S/C18H23N/c1-12-14-7-5-6-8-16(14)19-17-10-9-13(11-15(12)17)18(2,3)4/h5-8,13H,9-11H2,1-4H3	UJQXZVLPQFZFJK-UHFFFAOYSA-N	Cc1c2CC(CCc2nc3ccccc13)C(C)(C)C	BroadT	BRD-A15641585	BRD-A15641585-003-07-5	Enamine Ltd.	T0518-5100		Cl	Cc1c2CC(CCc2nc2ccccc12)C(C)(C)C.Cl	InChI=1S/C18H23N.ClH/c1-12-14-7-5-6-8-16(14)19-17-10-9-13(11-15(12)17)18(2,3)4;/h5-8,13H,9-11H2,1-4H3;1H	IJQCHIBXBHAUER-UHFFFAOYSA-N	253.183049746							103895, 103895
ZINC03275622	LSM-16453	SID47201391, BRD-K17826722	3815079	InChI=1S/C14H14N4O5S/c1-3-23-13(20)11-8(2)24-14(15-11)17-16-12(19)9-4-6-10(7-5-9)18(21)22/h4-7H,3H2,1-2H3,(H,15,17)(H,16,19)	GRFPHNGXYHSIEZ-UHFFFAOYSA-N	CCOC(=O)c1nc(NNC(=O)c2ccc(cc2)[N+](=O)[O-])sc1C	BroadT	BRD-K17826722	BRD-K17826722-001-07-6	Vitas-M Laboratory Ltd.	STK104500			CCOC(=O)c1nc(NNC(=O)c2ccc(cc2)[N+]([O-])=O)sc1C	InChI=1S/C14H14N4O5S/c1-3-23-13(20)11-8(2)24-14(15-11)17-16-12(19)9-4-6-10(7-5-9)18(21)22/h4-7H,3H2,1-2H3,(H,15,17)(H,16,19)	GRFPHNGXYHSIEZ-UHFFFAOYSA-N	350.068490278							105090
MLS000576683	LSM-16454	SID17415196, BRD-K42046626	5429427	InChI=1S/C19H24N4O3S/c1-3-22-17(24)16(18(25)23(4-2)19(22)27)13-20-14-5-7-15(8-6-14)21-9-11-26-12-10-21/h5-8,13,20H,3-4,9-12H2,1-2H3	QWQLNHYQRDGGMK-UHFFFAOYSA-N	CCN1C(=S)N(CC)C(=O)C(=CNc2ccc(cc2)N3CCOCC3)C1=O	BroadT	BRD-K42046626	BRD-K42046626-001-05-1	ChemBridge Corporation	7078134			CCN1C(=O)C(=CNc2ccc(cc2)N2CCOCC2)C(=O)N(CC)C1=S	InChI=1S/C19H24N4O3S/c1-3-22-17(24)16(18(25)23(4-2)19(22)27)13-20-14-5-7-15(8-6-14)21-9-11-26-12-10-21/h5-8,13,20H,3-4,9-12H2,1-2H3	QWQLNHYQRDGGMK-UHFFFAOYSA-N	388.156911358							105091
AC1M6MU4	LSM-16455	SID24834989, BRD-K63817529	2401502	InChI=1S/C15H10F3NO3S/c16-15(17,18)10-4-1-3-9(7-10)12(20)8-23-13-11(14(21)22)5-2-6-19-13/h1-7H,8H2,(H,21,22)	JNITURYINBGBRJ-UHFFFAOYSA-N	OC(=O)c1cccnc1SCC(=O)c2cccc(c2)C(F)(F)F	BroadT	BRD-K63817529	BRD-K63817529-001-05-7	Enamine Ltd.	T0514-9325			OC(=O)c1cccnc1SCC(=O)c1cccc(c1)C(F)(F)F	InChI=1S/C15H10F3NO3S/c16-15(17,18)10-4-1-3-9(7-10)12(20)8-23-13-11(14(21)22)5-2-6-19-13/h1-7H,8H2,(H,21,22)	JNITURYINBGBRJ-UHFFFAOYSA-N	341.03334848							105092
MLS000595301	LSM-16456	SID17401821, BRD-K06697669	1912041	InChI=1S/C20H24N6O2/c1-2-7-22-20(27)16-17-19(24-15-6-4-3-5-14(15)23-17)26(18(16)21)9-8-25-10-12-28-13-11-25/h2-6H,1,7-13,21H2,(H,22,27)	ZSIXUEIWVDVPSR-UHFFFAOYSA-N	Nc1c(C(=O)NCC=C)c2nc3ccccc3nc2n1CCN4CCOCC4	BroadT	BRD-K06697669	BRD-K06697669-001-05-3	InterBioScreen Ltd.	STOCK1S-91893			Nc1c(C(=O)NCC=C)c2nc3ccccc3nc2n1CCN1CCOCC1	InChI=1S/C20H24N6O2/c1-2-7-22-20(27)16-17-19(24-15-6-4-3-5-14(15)23-17)26(18(16)21)9-8-25-10-12-28-13-11-25/h2-6H,1,7-13,21H2,(H,22,27)	ZSIXUEIWVDVPSR-UHFFFAOYSA-N	380.196074068							105093
SMR000040078	LSM-16457	SID24840974, SID857771, BRD-K62295866	659126	InChI=1S/C24H24N6O4/c25-22-20(24(31)26-7-8-29-9-11-32-12-10-29)21-23(28-17-4-2-1-3-16(17)27-21)30(22)15-5-6-18-19(13-15)34-14-33-18/h1-6,13H,7-12,14,25H2,(H,26,31)	JLNJGNIASBGNGD-UHFFFAOYSA-N	Nc1c(C(=O)NCCN2CCOCC2)c3nc4ccccc4nc3n1c5ccc6OCOc6c5	BroadT	BRD-K62295866	BRD-K62295866-001-05-8	InterBioScreen Ltd.	STOCK1S-94576			Nc1c(C(=O)NCCN2CCOCC2)c2nc3ccccc3nc2n1-c1ccc2OCOc2c1	InChI=1S/C24H24N6O4/c25-22-20(24(31)26-7-8-29-9-11-32-12-10-29)21-23(28-17-4-2-1-3-16(17)27-21)30(22)15-5-6-18-19(13-15)34-14-33-18/h1-6,13H,7-12,14,25H2,(H,26,31)	JLNJGNIASBGNGD-UHFFFAOYSA-N	460.185903308							105094
MLS000058143	LSM-16458	SID3713487, BRD-K29738272	2091123	InChI=1S/C15H10BrClN2O2/c16-11-6-2-1-5-10(11)15-19-18-14(21-15)9-20-13-8-4-3-7-12(13)17/h1-8H,9H2	AJVKUWRKUUSINF-UHFFFAOYSA-N	Clc1ccccc1OCc2oc(nn2)c3ccccc3Br	BroadT	BRD-K29738272	BRD-K29738272-001-05-7	Enamine Ltd.	T5270429			Clc1ccccc1OCc1nnc(o1)-c1ccccc1Br	InChI=1S/C15H10BrClN2O2/c16-11-6-2-1-5-10(11)15-19-18-14(21-15)9-20-13-8-4-3-7-12(13)17/h1-8H,9H2	AJVKUWRKUUSINF-UHFFFAOYSA-N	363.96141789							105095
STK595917	LSM-16459	SID17513661, BRD-A04829586	5181592	InChI=1S/C20H20N2O2S/c1-23-16-10-8-13(11-17(16)24-2)18-15-9-7-12-5-3-4-6-14(12)19(15)22-20(25)21-18/h3-6,8,10-11,18H,7,9H2,1-2H3,(H2,21,22,25)	UPWWMFGRFVAGGJ-UHFFFAOYSA-N	COc1ccc(cc1OC)C2NC(=NC3=C2CCc4ccccc34)S	BroadT	BRD-A04829586	BRD-A04829586-001-06-4	InterBioScreen Ltd.	STOCK3S-42244			COc1ccc(cc1OC)C1NC(S)=NC2=C1CCc1ccccc21	InChI=1S/C20H20N2O2S/c1-23-16-10-8-13(11-17(16)24-2)18-15-9-7-12-5-3-4-6-14(12)19(15)22-20(25)21-18/h3-6,8,10-11,18H,7,9H2,1-2H3,(H2,21,22,25)	UPWWMFGRFVAGGJ-UHFFFAOYSA-N	352.12454859							105096
MLS000055897	LSM-16460	SID3717268, BRD-K35381497	2517964	InChI=1S/C23H17N3O3/c1-14-12-18(15(2)26(14)17-9-4-3-5-10-17)21-24-25-22(29-21)19-13-16-8-6-7-11-20(16)28-23(19)27/h3-13H,1-2H3	IRRLKSXIUAJKJM-UHFFFAOYSA-N	Cc1cc(c(C)n1c2ccccc2)c3oc(nn3)C4=Cc5ccccc5OC4=O	BroadT	BRD-K35381497	BRD-K35381497-001-05-7	Enamine Ltd.	T5333622			Cc1cc(-c2nnc(o2)-c2cc3ccccc3oc2=O)c(C)n1-c1ccccc1	InChI=1S/C23H17N3O3/c1-14-12-18(15(2)26(14)17-9-4-3-5-10-17)21-24-25-22(29-21)19-13-16-8-6-7-11-20(16)28-23(19)27/h3-13H,1-2H3	IRRLKSXIUAJKJM-UHFFFAOYSA-N	383.126991434							105097
MLS000034314	LSM-16461	SID848315, BRD-A90807161	650751	InChI=1S/C23H33N7O3/c1-5-33-21(31)15-6-8-16(9-7-15)24-22(32)25-17-12-18-10-11-19(13-17)29(18)14-20-26-27-28-30(20)23(2,3)4/h6-9,17-19H,5,10-14H2,1-4H3,(H2,24,25,32)	FOODIZRFHBFNPF-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)NC2CC3CCC(C2)N3Cc4nnnn4C(C)(C)C)cc1	BroadT	BRD-A90807161	BRD-A90807161-001-05-0	Asinex Ltd.	ASN 06448343			CCOC(=O)c1ccc(NC(=O)NC2CC3CCC(C2)N3Cc2nnnn2C(C)(C)C)cc1	InChI=1S/C23H33N7O3/c1-5-33-21(31)15-6-8-16(9-7-15)24-22(32)25-17-12-18-10-11-19(13-17)29(18)14-20-26-27-28-30(20)23(2,3)4/h6-9,17-19H,5,10-14H2,1-4H3,(H2,24,25,32)	FOODIZRFHBFNPF-UHFFFAOYSA-N	455.264487986							105098
MLS000044115	LSM-16462	SID4242933, BRD-K02012805	3237723	InChI=1S/C19H23BrN2O3S/c1-25-18-5-2-4-16(14-18)15-21-10-3-11-22(13-12-21)26(23,24)19-8-6-17(20)7-9-19/h2,4-9,14H,3,10-13,15H2,1H3	SLFYZNJJJPKHGX-UHFFFAOYSA-N	COc1cccc(CN2CCCN(CC2)S(=O)(=O)c3ccc(Br)cc3)c1	BroadT	BRD-K02012805	BRD-K02012805-001-05-4	ChemDiv Inc.	C036-0013			COc1cccc(CN2CCCN(CC2)S(=O)(=O)c2ccc(Br)cc2)c1	InChI=1S/C19H23BrN2O3S/c1-25-18-5-2-4-16(14-18)15-21-10-3-11-22(13-12-21)26(23,24)19-8-6-17(20)7-9-19/h2,4-9,14H,3,10-13,15H2,1H3	SLFYZNJJJPKHGX-UHFFFAOYSA-N	438.061275906							105099
MLS000048783	LSM-16463	SID3712359, BRD-K14437715	943085	InChI=1S/C12H8N6/c1-2-4-9(5-3-1)18-11-10(6-15-18)12-16-14-8-17(12)7-13-11/h1-8H	QSFYGYPZUVQYMC-UHFFFAOYSA-N	c1ccc(cc1)n2ncc3c2ncn4cnnc34	BroadT	BRD-K14437715	BRD-K14437715-001-05-8	Enamine Ltd.	T0511-7965			c1nn(-c2ccccc2)c2ncn3cnnc3c12	InChI=1S/C12H8N6/c1-2-4-9(5-3-1)18-11-10(6-15-18)12-16-14-8-17(12)7-13-11/h1-8H	QSFYGYPZUVQYMC-UHFFFAOYSA-N	236.081044316							105100
MLS000532803	LSM-16464	SID14736990, BRD-K89502261	2248956	InChI=1S/C14H23NO/c1-2-3-11-15-12-7-8-13-16-14-9-5-4-6-10-14/h4-6,9-10,15H,2-3,7-8,11-13H2,1H3	MYQAURDYZDFDDI-UHFFFAOYSA-N	CCCCNCCCCOc1ccccc1	BroadT	BRD-K89502261	BRD-K89502261-001-05-7	ChemBridge Corporation	5543279			CCCCNCCCCOc1ccccc1	InChI=1S/C14H23NO/c1-2-3-11-15-12-7-8-13-16-14-9-5-4-6-10-14/h4-6,9-10,15H,2-3,7-8,11-13H2,1H3	MYQAURDYZDFDDI-UHFFFAOYSA-N	221.177964366							105101
AC1NATRP	LSM-16465	BRD-K85294251	4457518	InChI=1S/C19H13FN8O4/c20-12-4-1-10(2-5-12)8-22-24-19(29)15-16(11-3-6-13-14(7-11)31-9-30-13)28(27-23-15)18-17(21)25-32-26-18/h1-8H,9H2,(H2,21,25)(H,24,29)	MNXHJBKLZVSKQD-UHFFFAOYSA-N	Nc1nonc1n2nnc(C(=O)NN=Cc3ccc(F)cc3)c2c4ccc5OCOc5c4	BroadT	BRD-K85294251	BRD-K85294251-001-05-7	InterBioScreen Ltd.	STOCK4S-95866			Nc1nonc1-n1nnc(C(=O)NN=Cc2ccc(F)cc2)c1-c1ccc2OCOc2c1	InChI=1S/C19H13FN8O4/c20-12-4-1-10(2-5-12)8-22-24-19(29)15-16(11-3-6-13-14(7-11)31-9-30-13)28(27-23-15)18-17(21)25-32-26-18/h1-8H,9H2,(H2,21,25)(H,24,29)	MNXHJBKLZVSKQD-UHFFFAOYSA-N	436.104379176							105102
AC1MD0KQ	LSM-16466	SID24786548, BRD-K28723930	2803827	InChI=1S/C14H11N3OS/c18-14-10-5-1-2-6-11(10)16-12(17-14)9-19-13-7-3-4-8-15-13/h1-8H,9H2,(H,16,17,18)	HTDOJXWQGHYADR-UHFFFAOYSA-N	Oc1nc(CSc2ccccn2)nc3ccccc13	BroadT	BRD-K28723930	BRD-K28723930-001-05-4	Life Chemicals Inc.	F2551-0023			Oc1nc(CSc2ccccn2)nc2ccccc12	InChI=1S/C14H11N3OS/c18-14-10-5-1-2-6-11(10)16-12(17-14)9-19-13-7-3-4-8-15-13/h1-8H,9H2,(H,16,17,18)	HTDOJXWQGHYADR-UHFFFAOYSA-N	269.062282692							105103
MLS000774576	LSM-16467	SID24834163, BRD-K81539671	6063838	InChI=1S/C13H13N5O3S/c1-7(2)6-14-13(22)17-16-11-9-5-8(18(20)21)3-4-10(9)15-12(11)19/h3-5,15,19H,1,6H2,2H3,(H,14,22)	VZHVRBLJETVDGX-UHFFFAOYSA-N	CC(=C)CN=C(S)N=Nc1c(O)[nH]c2ccc(cc12)[N+](=O)[O-]	BroadT	BRD-K81539671	BRD-K81539671-001-06-9	Enamine Ltd.	T5211755			CC(=C)CN=C(S)N=Nc1c(O)[nH]c2ccc(cc12)[N+]([O-])=O	InChI=1S/C13H13N5O3S/c1-7(2)6-14-13(22)17-16-11-9-5-8(18(20)21)3-4-10(9)15-12(11)19/h3-5,15,19H,1,6H2,2H3,(H,14,22)	VZHVRBLJETVDGX-UHFFFAOYSA-N	319.073910016							
STK147476	LSM-16468	SID17433909, BRD-K54295465	1314679	InChI=1S/C24H20N4OS/c1-28-23(17-6-4-7-19(25)13-17)26-27-24(28)30-14-22(29)16-9-10-21-18(12-16)11-15-5-2-3-8-20(15)21/h2-10,12-13H,11,14,25H2,1H3	YTDFAVNBAISVRJ-UHFFFAOYSA-N	Cn1c(SCC(=O)c2ccc3c(Cc4ccccc34)c2)nnc1c5cccc(N)c5	BroadT	BRD-K54295465	BRD-K54295465-001-06-1	ChemBridge Corporation	7491915			Cn1c(SCC(=O)c2ccc-3c(Cc4ccccc-34)c2)nnc1-c1cccc(N)c1	InChI=1S/C24H20N4OS/c1-28-23(17-6-4-7-19(25)13-17)26-27-24(28)30-14-22(29)16-9-10-21-18(12-16)11-15-5-2-3-8-20(15)21/h2-10,12-13H,11,14,25H2,1H3	YTDFAVNBAISVRJ-UHFFFAOYSA-N	412.13578199							105105
BRD-A70412320	LSM-16469	SID104219383, SID14718795		InChI=1S/C15H20BrN3O/c1-19-7-12(16)14(18-19)15(20)17-13-10-3-8-2-9(5-10)6-11(13)4-8/h7-11,13H,2-6H2,1H3,(H,17,20)/t8-,9+,10-,11+,13?	YEEUPRCHPAKFJO-CEBISCOSSA-N	Cn1cc(Br)c(n1)C(=O)NC2[C@@H]3C[C@H]4C[C@H](C[C@@H]2C4)C3	BroadT	BRD-A70412320	BRD-A70412320-001-05-1	Specs	AK-968/41925606			Cn1cc(Br)c(n1)C(=O)NC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2	InChI=1S/C15H20BrN3O/c1-19-7-12(16)14(18-19)15(20)17-13-10-3-8-2-9(5-10)6-11(13)4-8/h7-11,13H,2-6H2,1H3,(H,17,20)/t8-,9+,10-,11+,13?	YEEUPRCHPAKFJO-CEBISCOSSA-N	337.07897489							
AC1MRRUF	LSM-16470	SID24836943, BRD-K58814312	3522807	InChI=1S/C24H24N4O3S/c29-24(27-16-14-26(15-17-27)23-10-3-4-12-25-23)20-7-5-8-21(18-20)32(30,31)28-13-11-19-6-1-2-9-22(19)28/h1-10,12,18H,11,13-17H2	DNYOWORTIJGFOF-UHFFFAOYSA-N	O=C(N1CCN(CC1)c2ccccn2)c3cccc(c3)S(=O)(=O)N4CCc5ccccc45	BroadT	BRD-K58814312	BRD-K58814312-001-05-2	Enamine Ltd.	T5216504			O=C(N1CCN(CC1)c1ccccn1)c1cccc(c1)S(=O)(=O)N1CCc2ccccc12	InChI=1S/C24H24N4O3S/c29-24(27-16-14-26(15-17-27)23-10-3-4-12-25-23)20-7-5-8-21(18-20)32(30,31)28-13-11-19-6-1-2-9-22(19)28/h1-10,12,18H,11,13-17H2	DNYOWORTIJGFOF-UHFFFAOYSA-N	448.156911358							105107
T5267052	LSM-16471	SID3713455, BRD-K67341671	2121660	InChI=1S/C18H20N2O6/c1-23-14-8-6-5-7-12(14)19-18(22)20-13-10-16(25-3)15(24-2)9-11(13)17(21)26-4/h5-10H,1-4H3,(H2,19,20,22)	FIZBBKVRSXLCOB-UHFFFAOYSA-N	COC(=O)c1cc(OC)c(OC)cc1NC(=O)Nc2ccccc2OC	BroadT	BRD-K67341671	BRD-K67341671-001-05-0	Enamine Ltd.	T5267052			COC(=O)c1cc(OC)c(OC)cc1NC(=O)Nc1ccccc1OC	InChI=1S/C18H20N2O6/c1-23-14-8-6-5-7-12(14)19-18(22)20-13-10-16(25-3)15(24-2)9-11(13)17(21)26-4/h5-10H,1-4H3,(H2,19,20,22)	FIZBBKVRSXLCOB-UHFFFAOYSA-N	360.13213638							105108
6-Amino-4-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile	LSM-16472	SID14718756, BRD-A72832265	4431146	InChI=1S/C19H18N6O/c1-10-16-17(14(9-20)18(21)26-19(16)23-22-10)15-11(2)24-25(12(15)3)13-7-5-4-6-8-13/h4-8,17H,21H2,1-3H3,(H,22,23)	UDAHNFVDPRZCCX-UHFFFAOYSA-N	Cc1n[nH]c2OC(=C(C#N)C(c12)c3c(C)nn(c3C)c4ccccc4)N	BroadT	BRD-A72832265	BRD-A72832265-001-06-3	Specs	AK-968/41017883			Cc1n[nH]c2OC(N)=C(C#N)C(c12)c1c(C)nn(c1C)-c1ccccc1	InChI=1S/C19H18N6O/c1-10-16-17(14(9-20)18(21)26-19(16)23-22-10)15-11(2)24-25(12(15)3)13-7-5-4-6-8-13/h4-8,17H,21H2,1-3H3,(H,22,23)	UDAHNFVDPRZCCX-UHFFFAOYSA-N	346.154209256							105109
ST51024277	LSM-16473	SID14718719, BRD-K05680206	1211462	InChI=1S/C13H11ClN2O2/c14-10-4-6-11(7-5-10)16-13(17)18-9-12-3-1-2-8-15-12/h1-8H,9H2,(H,16,17)	JQUSXPXUPFNCJK-UHFFFAOYSA-N	Clc1ccc(NC(=O)OCc2ccccn2)cc1	BroadT	BRD-K05680206	BRD-K05680206-001-06-8	Specs	AI-204/31710006			Clc1ccc(NC(=O)OCc2ccccn2)cc1	InChI=1S/C13H11ClN2O2/c14-10-4-6-11(7-5-10)16-13(17)18-9-12-3-1-2-8-15-12/h1-8H,9H2,(H,16,17)	JQUSXPXUPFNCJK-UHFFFAOYSA-N	262.050905322							105110
SMR000169853	LSM-16474	SID17412223, BRD-K47546029	1473200	InChI=1S/C11H8Cl2N6/c12-6-1-2-9(8(13)3-6)18-19-5-15-11-7(10(19)14)4-16-17-11/h1-5,18H,14H2	VKIQLRLSSYMLJD-UHFFFAOYSA-N	Nc1c2cnnc2ncn1Nc3ccc(Cl)cc3Cl	BroadT	BRD-K47546029	BRD-K47546029-001-05-8	Key Organics Ltd.	3D-033			Nc1n(Nc2ccc(Cl)cc2Cl)cnc2nncc12	InChI=1S/C11H8Cl2N6/c12-6-1-2-9(8(13)3-6)18-19-5-15-11-7(10(19)14)4-16-17-11/h1-5,18H,14H2	VKIQLRLSSYMLJD-UHFFFAOYSA-N	294.018749736							105111
MLS000120089	LSM-16475	SID7966818, BRD-A88417571	4057143	InChI=1S/C18H24N2O3S/c1-3-16(21)20-15(17(22)19-10-4-5-11-19)12-24-18(20)13-6-8-14(23-2)9-7-13/h6-9,15,18H,3-5,10-12H2,1-2H3	JUACLZGFRHBDOD-UHFFFAOYSA-N	CCC(=O)N1C(CSC1c2ccc(OC)cc2)C(=O)N3CCCC3	BroadT	BRD-A88417571	BRD-A88417571-001-05-6	ChemDiv Inc.	K783-6957			CCC(=O)N1C(CSC1c1ccc(OC)cc1)C(=O)N1CCCC1	InChI=1S/C18H24N2O3S/c1-3-16(21)20-15(17(22)19-10-4-5-11-19)12-24-18(20)13-6-8-14(23-2)9-7-13/h6-9,15,18H,3-5,10-12H2,1-2H3	JUACLZGFRHBDOD-UHFFFAOYSA-N	348.150763338							105112
T5338060	LSM-16476	SID3713450, BRD-A24660135	2998414	InChI=1S/C24H28N4O2S/c1-4-12-27-23(19-9-6-5-7-10-19)25-26-24(27)31-16-22(29)21-14-17(2)28(18(21)3)15-20-11-8-13-30-20/h4-7,9-10,14,20H,1,8,11-13,15-16H2,2-3H3	MNGCLRPBCYSDKT-UHFFFAOYSA-N	Cc1cc(C(=O)CSc2nnc(c3ccccc3)n2CC=C)c(C)n1CC4CCCO4	BroadT	BRD-A24660135	BRD-A24660135-001-05-7	Enamine Ltd.	T5338060			Cc1cc(C(=O)CSc2nnc(-c3ccccc3)n2CC=C)c(C)n1CC1CCCO1	InChI=1S/C24H28N4O2S/c1-4-12-27-23(19-9-6-5-7-10-19)25-26-24(27)31-16-22(29)21-14-17(2)28(18(21)3)15-20-11-8-13-30-20/h4-7,9-10,14,20H,1,8,11-13,15-16H2,2-3H3	MNGCLRPBCYSDKT-UHFFFAOYSA-N	436.193296866							105113
SMR000628985	LSM-16477	SID49731929, BRD-A57095239	24792907	InChI=1S/C30H38N4O5S/c1-21-19-24-20-25(9-10-26(24)34(21)30(36)22-7-8-22)40(37,38)33-13-11-23(12-14-33)29(35)32-17-15-31(16-18-32)27-5-3-4-6-28(27)39-2/h3-6,9-10,20-23H,7-8,11-19H2,1-2H3	IMQVPBIPMJQTCN-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)c4ccc5N(C(C)Cc5c4)C(=O)C6CC6	BroadT	BRD-A57095239	BRD-A57095239-001-05-1	ChemDiv Inc.	E684-0704			COc1ccccc1N1CCN(CC1)C(=O)C1CCN(CC1)S(=O)(=O)c1ccc2N(C(C)Cc2c1)C(=O)C1CC1	InChI=1S/C30H38N4O5S/c1-21-19-24-20-25(9-10-26(24)34(21)30(36)22-7-8-22)40(37,38)33-13-11-23(12-14-33)29(35)32-17-15-31(16-18-32)27-5-3-4-6-28(27)39-2/h3-6,9-10,20-23H,7-8,11-19H2,1-2H3	IMQVPBIPMJQTCN-UHFFFAOYSA-N	566.256291046							105114
N-[2-(4-Fluorophenyl)ethyl]-4-nitrobenzamide	LSM-16478	SID24788983, BRD-K82554441	873392	InChI=1S/C15H13FN2O3/c16-13-5-1-11(2-6-13)9-10-17-15(19)12-3-7-14(8-4-12)18(20)21/h1-8H,9-10H2,(H,17,19)	GQZVPMBSRUIIJV-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)C(=O)NCCc2ccc(F)cc2	BroadT	BRD-K82554441	BRD-K82554441-001-05-8	ChemBridge Corporation	5942981			[O-][N+](=O)c1ccc(cc1)C(=O)NCCc1ccc(F)cc1	InChI=1S/C15H13FN2O3/c16-13-5-1-11(2-6-13)9-10-17-15(19)12-3-7-14(8-4-12)18(20)21/h1-8H,9-10H2,(H,17,19)	GQZVPMBSRUIIJV-UHFFFAOYSA-N	288.091020496							105115
MLS000689439	LSM-16479	SID24814263, BRD-K37541208	3390606	InChI=1S/C18H25N3S2/c1-14-7-8-17(15(2)12-14)19-18(22)21(10-9-20(3)4)13-16-6-5-11-23-16/h5-8,11-12H,9-10,13H2,1-4H3,(H,19,22)	VHTGDWPHWBLKIS-UHFFFAOYSA-N	CN(C)CCN(Cc1cccs1)C(=Nc2ccc(C)cc2C)S	BroadT	BRD-K37541208	BRD-K37541208-001-05-4	ChemDiv Inc.	K784-3988			CN(C)CCN(Cc1cccs1)C(S)=Nc1ccc(C)cc1C	InChI=1S/C18H25N3S2/c1-14-7-8-17(15(2)12-14)19-18(22)21(10-9-20(3)4)13-16-6-5-11-23-16/h5-8,11-12H,9-10,13H2,1-4H3,(H,19,22)	VHTGDWPHWBLKIS-UHFFFAOYSA-N	347.14898921							105116
ZINC13521972	LSM-16480	SID24823182, BRD-K67714775	52098003	InChI=1S/C16H16N4O5S2/c1-3-25-12-8-9(5-6-11(12)21)7-10-13(17)20-15(18-14(10)22)26-16(19-20)27(23,24)4-2/h5-8,17,21H,3-4H2,1-2H3/b10-7+,17-13?	VKWUUXGXNAKUIZ-DNKAYRMDSA-N	CCOc1cc(\C=C/2\C(=O)N=C3SC(=NN3C2=N)S(=O)(=O)CC)ccc1O	BroadT	BRD-K67714775	BRD-K67714775-001-05-3	ChemDiv Inc.	C356-0568			CCOc1cc(ccc1O)\C=C1\C(=O)N=C2SC(=NN2C1=N)S(=O)(=O)CC	InChI=1S/C16H16N4O5S2/c1-3-25-12-8-9(5-6-11(12)21)7-10-13(17)20-15(18-14(10)22)26-16(19-20)27(23,24)4-2/h5-8,17,21H,3-4H2,1-2H3/b10-7+,17-13?	VKWUUXGXNAKUIZ-DNKAYRMDSA-N	408.056211032							
N,N-Dimethyl-1-(2-methylphenanthren-3-yl)methanamine	LSM-15249	BRD-K55160224	1388492	InChI=1S/C18H19N/c1-13-10-15-9-8-14-6-4-5-7-17(14)18(15)11-16(13)12-19(2)3/h4-11H,12H2,1-3H3	SHHGHUVUBNVWJE-UHFFFAOYSA-N	CN(C)Cc1cc2c(ccc3ccccc23)cc1C	BroadT	BRD-K55160224	BRD-K55160224-003-06-4	InterBioScreen Ltd.	STOCK1S-07841		Cl	CN(C)Cc1cc2c(ccc3ccccc23)cc1C.Cl	InChI=1S/C18H19N.ClH/c1-13-10-15-9-8-14-6-4-5-7-17(14)18(15)11-16(13)12-19(2)3;/h4-11H,12H2,1-3H3;1H	XQZPEFXLSQJERS-UHFFFAOYSA-N	249.151749618							103896, 103896
AC1MLMUM	LSM-16481	SID17409068, BRD-A64862239	3197538	InChI=1S/C22H25N3OS2/c1-5-8-18-23-21(20-14(3)15(4)28-22(20)24-18)27-12-19(26)25-13(2)11-16-9-6-7-10-17(16)25/h6-7,9-10,13H,5,8,11-12H2,1-4H3	LSZQUPRZSNNOKU-UHFFFAOYSA-N	CCCc1nc(SCC(=O)N2C(C)Cc3ccccc23)c4c(C)c(C)sc4n1	BroadT	BRD-A64862239	BRD-A64862239-001-05-5	Asinex Ltd.	ASN 05260372			CCCc1nc(SCC(=O)N2C(C)Cc3ccccc23)c2c(C)c(C)sc2n1	InChI=1S/C22H25N3OS2/c1-5-8-18-23-21(20-14(3)15(4)28-22(20)24-18)27-12-19(26)25-13(2)11-16-9-6-7-10-17(16)25/h6-7,9-10,13H,5,8,11-12H2,1-4H3	LSZQUPRZSNNOKU-UHFFFAOYSA-N	411.14390383							105118
AC1MP1EM	LSM-16482	SID22411853, BRD-A59067516	3428054	InChI=1S/C13H13N3O5/c1-14-8-9(15(17)18)7-11(16(19)20)13(14)10-5-3-4-6-12(10)21-2/h3-8,13H,1-2H3	OBQPGIJAIYVZLY-UHFFFAOYSA-N	COc1ccccc1C2N(C)C=C(C=C2[N+](=O)[O-])[N+](=O)[O-]	BroadT	BRD-A59067516	BRD-A59067516-001-05-2	Specs	AK-454/40962514			COc1ccccc1C1N(C)C=C(C=C1[N+]([O-])=O)[N+]([O-])=O	InChI=1S/C13H13N3O5/c1-14-8-9(15(17)18)7-11(16(19)20)13(14)10-5-3-4-6-12(10)21-2/h3-8,13H,1-2H3	OBQPGIJAIYVZLY-UHFFFAOYSA-N	291.085520546							105119
AC1NERB5	LSM-16483	SID49717876, BRD-K45569576	4621901	InChI=1S/C19H23N5O3/c1-13-4-3-6-24-16(13)21-17-14(19(24)26)12-15(22(17)2)18(25)20-5-7-23-8-10-27-11-9-23/h3-4,6,12H,5,7-11H2,1-2H3,(H,20,25)	FOOCZUIMRFDURF-UHFFFAOYSA-N	CC1=CC=CN2C(=O)c3cc(C(=O)NCCN4CCOCC4)n(C)c3N=C12	BroadT	BRD-K45569576	BRD-K45569576-001-05-9	ChemBridge Corporation	9033785			Cc1cccn2c1nc1n(C)c(cc1c2=O)C(=O)NCCN1CCOCC1	InChI=1S/C19H23N5O3/c1-13-4-3-6-24-16(13)21-17-14(19(24)26)12-15(22(17)2)18(25)20-5-7-23-8-10-27-11-9-23/h3-4,6,12H,5,7-11H2,1-2H3,(H,20,25)	FOOCZUIMRFDURF-UHFFFAOYSA-N	369.180089646							105120
MLS000558217	LSM-16484	SID17401531, BRD-A43088983	3743550	InChI=1S/C18H14N4O2S/c1-23-12-4-2-3-10(7-12)16-15-14(11-5-6-25-9-11)13(8-19)17(20)24-18(15)22-21-16/h2-7,9,14H,20H2,1H3,(H,21,22)	NQRGIICELSOXOP-UHFFFAOYSA-N	COc1cccc(c1)c2[nH]nc3OC(=C(C#N)C(c4ccsc4)c23)N	BroadT	BRD-A43088983	BRD-A43088983-001-06-9	InterBioScreen Ltd.	STOCK4S-32833			COc1cccc(c1)-c1[nH]nc2OC(N)=C(C#N)C(c3ccsc3)c12	InChI=1S/C18H14N4O2S/c1-23-12-4-2-3-10(7-12)16-15-14(11-5-6-25-9-11)13(8-19)17(20)24-18(15)22-21-16/h2-7,9,14H,20H2,1H3,(H,21,22)	NQRGIICELSOXOP-UHFFFAOYSA-N	350.083746418							105121
AC1LFC3S	LSM-43642	SID17408253, BRD-K58629399	775618	InChI=1S/C16H16N2O3S/c19-15(14-6-4-10-22-14)17-13(11-12-5-3-9-21-12)16(20)18-7-1-2-8-18/h3-6,9-11H,1-2,7-8H2,(H,17,19)/b13-11+	PWTGIJPJCGHWIT-ACCUITESSA-N	O=C(N\C(=C\c1occc1)\C(=O)N2CCCC2)c3cccs3	BroadT	BRD-K58629399	BRD-K58629399-001-05-0	Asinex Ltd.	BAS 01128323			O=C(N\C(=C\c1ccco1)C(=O)N1CCCC1)c1cccs1	InChI=1S/C16H16N2O3S/c19-15(14-6-4-10-22-14)17-13(11-12-5-3-9-21-12)16(20)18-7-1-2-8-18/h3-6,9-11H,1-2,7-8H2,(H,17,19)/b13-11+	PWTGIJPJCGHWIT-ACCUITESSA-N	316.088163082							
STK089524	LSM-43643	SID24785858, BRD-K83423621	2266771	InChI=1S/C14H12N2O7S/c1-2-23-11(17)7-15-13(19)10(24-14(15)20)6-8-4-3-5-9(12(8)18)16(21)22/h3-6,18H,2,7H2,1H3/b10-6+	NNPVNSCMBITYJA-UXBLZVDNSA-N	CCOC(=O)CN1C(=O)S\C(=C\c2cccc(c2O)[N+](=O)[O-])\C1=O	BroadT	BRD-K83423621	BRD-K83423621-001-05-7	ChemBridge Corporation	6705397			CCOC(=O)CN1C(=O)S\C(=C\c2cccc(c2O)[N+]([O-])=O)C1=O	InChI=1S/C14H12N2O7S/c1-2-23-11(17)7-15-13(19)10(24-14(15)20)6-8-4-3-5-9(12(8)18)16(21)22/h3-6,18H,2,7H2,1H3/b10-6+	NNPVNSCMBITYJA-UXBLZVDNSA-N	352.036521434							
MLS000075331	LSM-16487	SID843091, BRD-A72543288	645371	InChI=1S/C13H14N4O2S/c1-17(12(18)10-4-7-19-8-10)13-16-15-11(20-13)9-2-5-14-6-3-9/h2-3,5-6,10H,4,7-8H2,1H3	IAXCNAUHQIYKGO-UHFFFAOYSA-N	CN(C(=O)C1CCOC1)c2nnc(s2)c3ccncc3	BroadT	BRD-A72543288	BRD-A72543288-001-06-9	Asinex Ltd.	ASN 09114485			CN(C(=O)C1CCOC1)c1nnc(s1)-c1ccncc1	InChI=1S/C13H14N4O2S/c1-17(12(18)10-4-7-19-8-10)13-16-15-11(20-13)9-2-5-14-6-3-9/h2-3,5-6,10H,4,7-8H2,1H3	IAXCNAUHQIYKGO-UHFFFAOYSA-N	290.083746418							105124
AC1LIDYG	LSM-16488	BRD-K58144507	929542	InChI=1S/C15H10ClNOS/c16-15-10-5-1-4-8-13(10)19-14(15)9-17-11-6-2-3-7-12(11)18/h1-9,18H	DKURWBHBLPEHHW-UHFFFAOYSA-N	Oc1ccccc1N=Cc2sc3ccccc3c2Cl	BroadT	BRD-K58144507	BRD-K58144507-001-05-9	InterBioScreen Ltd.	STOCK2S-85667			Oc1ccccc1N=Cc1sc2ccccc2c1Cl	InChI=1S/C15H10ClNOS/c16-15-10-5-1-4-8-13(10)19-14(15)9-17-11-6-2-3-7-12(11)18/h1-9,18H	DKURWBHBLPEHHW-UHFFFAOYSA-N	287.01716235							105125
N-(4-Fluorophenyl)-1H-benzimidazole-6-carboxamide	LSM-16489	SID24823585, BRD-K72141313	1512222	InChI=1S/C14H10FN3O/c15-10-2-4-11(5-3-10)18-14(19)9-1-6-12-13(7-9)17-8-16-12/h1-8H,(H,16,17)(H,18,19)	LSUFUTWCMUAOEF-UHFFFAOYSA-N	Fc1ccc(NC(=O)c2ccc3[nH]cnc3c2)cc1	BroadT	BRD-K72141313	BRD-K72141313-001-05-1	ChemDiv Inc.	8017-1339			Fc1ccc(NC(=O)c2ccc3[nH]cnc3c2)cc1	InChI=1S/C14H10FN3O/c15-10-2-4-11(5-3-10)18-14(19)9-1-6-12-13(7-9)17-8-16-12/h1-8H,(H,16,17)(H,18,19)	LSUFUTWCMUAOEF-UHFFFAOYSA-N	255.08079017							105126
SMR000034596	LSM-16490	SID858946, SID87345623, BRD-K04487767	660251	InChI=1S/C19H16BrNO6/c1-25-16-7-6-12(8-13(16)20)15(22)11-26-18(23)9-21-10-19(24)27-17-5-3-2-4-14(17)21/h2-8H,9-11H2,1H3	OUCMMMUWSKLBRL-UHFFFAOYSA-N	COc1ccc(cc1Br)C(=O)COC(=O)CN2CC(=O)Oc3ccccc23	BroadT	BRD-K04487767	BRD-K04487767-001-04-5	InterBioScreen Ltd.	STOCK2S-85270			COc1ccc(cc1Br)C(=O)COC(=O)CN1CC(=O)Oc2ccccc12	InChI=1S/C19H16BrNO6/c1-25-16-7-6-12(8-13(16)20)15(22)11-26-18(23)9-21-10-19(24)27-17-5-3-2-4-14(17)21/h2-8H,9-11H2,1H3	OUCMMMUWSKLBRL-UHFFFAOYSA-N	433.016099842							105127
AC1OA8B2	LSM-16491	BRD-K18851731	6800721	InChI=1S/C14H12N4O3/c19-11-6-2-1-5-10(11)9-16-18-14(21)13(20)17-12-7-3-4-8-15-12/h1-9,19H,(H,18,21)(H,15,17,20)	KXYFGDQQDXQQBJ-UHFFFAOYSA-N	Oc1ccccc1C=NNC(=O)C(=O)Nc2ccccn2	BroadT	BRD-K18851731	BRD-K18851731-001-05-6	Asinex Ltd.	BAS 00367007			Oc1ccccc1C=NNC(=O)C(=O)Nc1ccccn1	InChI=1S/C14H12N4O3/c19-11-6-2-1-5-10(11)9-16-18-14(21)13(20)17-12-7-3-4-8-15-12/h1-9,19H,(H,18,21)(H,15,17,20)	KXYFGDQQDXQQBJ-UHFFFAOYSA-N	284.090940284							
4-Allyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol	LSM-16492	SID22412633, BRD-A41909111	3422428	InChI=1S/C14H17N3S2/c1-3-6-17-13(15-16-14(17)18)11-8-19-12-7-9(2)4-5-10(11)12/h3,8-9H,1,4-7H2,2H3,(H,16,18)	AMDCSXGQMORJKP-UHFFFAOYSA-N	CC1CCc2c(C1)scc2c3nnc(S)n3CC=C	BroadT	BRD-A41909111	BRD-A41909111-001-05-5	Specs	AK-968/41923654			CC1CCc2c(C1)scc2-c1nnc(S)n1CC=C	InChI=1S/C14H17N3S2/c1-3-6-17-13(15-16-14(17)18)11-8-19-12-7-9(2)4-5-10(11)12/h3,8-9H,1,4-7H2,2H3,(H,16,18)	AMDCSXGQMORJKP-UHFFFAOYSA-N	291.086388954							105129
MLS001101343	LSM-16493	SID49818503, BRD-A17206005	24817438	InChI=1S/C22H29N3O2S/c1-17(16-28-2)25-12-9-20(10-13-25)27-21-8-5-6-18(14-21)22(26)24-15-19-7-3-4-11-23-19/h3-8,11,14,17,20H,9-10,12-13,15-16H2,1-2H3,(H,24,26)	NLUWWWSDVXSKEM-UHFFFAOYSA-N	CSCC(C)N1CCC(CC1)Oc2cccc(c2)C(=O)NCc3ccccn3	BroadT	BRD-A17206005	BRD-A17206005-001-07-1	ChemBridge Corporation	84807459			CSCC(C)N1CCC(CC1)Oc1cccc(c1)C(=O)NCc1ccccn1	InChI=1S/C22H29N3O2S/c1-17(16-28-2)25-12-9-20(10-13-25)27-21-8-5-6-18(14-21)22(26)24-15-19-7-3-4-11-23-19/h3-8,11,14,17,20H,9-10,12-13,15-16H2,1-2H3,(H,24,26)	NLUWWWSDVXSKEM-UHFFFAOYSA-N	399.198047888							105130
10H-542S	LSM-16494	SID17403096, BRD-K94451960	2765294	InChI=1S/C19H12ClFN2O/c1-12-10-15(20)5-9-18(12)24-19-14(11-22)4-8-17(23-19)13-2-6-16(21)7-3-13/h2-10H,1H3	MGZAAXJGZDYWMW-UHFFFAOYSA-N	Cc1cc(Cl)ccc1Oc2nc(ccc2C#N)c3ccc(F)cc3	BroadT	BRD-K94451960	BRD-K94451960-001-05-4	Key Organics Ltd.	10H-542S			Cc1cc(Cl)ccc1Oc1nc(ccc1C#N)-c1ccc(F)cc1	InChI=1S/C19H12ClFN2O/c1-12-10-15(20)5-9-18(12)24-19-14(11-22)4-8-17(23-19)13-2-6-16(21)7-3-13/h2-10H,1H3	MGZAAXJGZDYWMW-UHFFFAOYSA-N	338.062218934							105131
MLS000731282	LSM-16495	SID24813161, BRD-K00127254	16193938	InChI=1S/C22H29N3O2S/c1-4-12-24(13-5-2)14-11-23-21(26)19-15-17-20(28-19)16-9-7-8-10-18(16)25(6-3)22(17)27/h7-10,15H,4-6,11-14H2,1-3H3,(H,23,26)	AOLOGDKWBXCZEM-UHFFFAOYSA-N	CCCN(CCC)CCNC(=O)c1cc2C(=O)N(CC)c3ccccc3c2s1	BroadT	BRD-K00127254	BRD-K00127254-001-05-8	ChemDiv Inc.	C593-0812			CCCN(CCC)CCNC(=O)c1cc2c(s1)c1ccccc1n(CC)c2=O	InChI=1S/C22H29N3O2S/c1-4-12-24(13-5-2)14-11-23-21(26)19-15-17-20(28-19)16-9-7-8-10-18(16)25(6-3)22(17)27/h7-10,15H,4-6,11-14H2,1-3H3,(H,23,26)	AOLOGDKWBXCZEM-UHFFFAOYSA-N	399.198047888							105132
CID 75677470	LSM-16496	BRD-M49209094	75677470	InChI=1S/C17H11ClN2OS/c18-15(11-6-2-1-3-7-11)16(21)12(10-19)17-20-13-8-4-5-9-14(13)22-17/h1-9,12,15H	GUQMMLVVGSTAKM-UHFFFAOYSA-N	ClC(C(=O)C(C#N)c1nc2ccccc2s1)c3ccccc3	BroadT	BRD-M49209094	BRD-M49209094-001-05-9	Enamine Ltd.	T0511-4708		C1COCCO1.ClC(C(=O)C(C#N)c1nc2ccccc2s1)c1ccccc1	C1COCCO1.ClC(C(=O)C(C#N)c1nc2ccccc2s1)c1ccccc1	InChI=1S/C17H11ClN2OS.C4H8O2/c18-15(11-6-2-1-3-7-11)16(21)12(10-19)17-20-13-8-4-5-9-14(13)22-17;1-2-6-4-3-5-1/h1-9,12,15H;1-4H2	DZRPBIPJSVTRMM-UHFFFAOYSA-N	326.028061392							105133
AC1LEXAG	LSM-16497	BRD-K14553310	743384	InChI=1S/C14H15BrN2O/c1-2-17-13-7-6-9(15)8-11(13)10-4-3-5-12(16-18)14(10)17/h6-8,18H,2-5H2,1H3	CVRPKMBHUHDGNF-UHFFFAOYSA-N	CCn1c2C(=NO)CCCc2c3cc(Br)ccc13	BroadT	BRD-K14553310	BRD-K14553310-001-05-1	ChemBridge Corporation	5373795			CCn1c2c(CCCC2=NO)c2cc(Br)ccc12	InChI=1S/C14H15BrN2O/c1-2-17-13-7-6-9(15)8-11(13)10-4-3-5-12(16-18)14(10)17/h6-8,18H,2-5H2,1H3	CVRPKMBHUHDGNF-UHFFFAOYSA-N	306.03677572							105134
AC1MGUEQ	LSM-16498	SID24791304, BRD-K56602052	2941660	InChI=1S/C15H11BrN2O4/c16-11-4-1-9(2-5-11)14(17)18-22-15(19)10-3-6-12-13(7-10)21-8-20-12/h1-7H,8H2,(H2,17,18)	PXDYSWGYXBLZMD-UHFFFAOYSA-N	Brc1ccc(cc1)C(=N)NOC(=O)c2ccc3OCOc3c2	BroadT	BRD-K56602052	BRD-K56602052-001-05-7	ChemBridge Corporation	7522164			Brc1ccc(cc1)C(=N)NOC(=O)c1ccc2OCOc2c1	InChI=1S/C15H11BrN2O4/c16-11-4-1-9(2-5-11)14(17)18-22-15(19)10-3-6-12-13(7-10)21-8-20-12/h1-7H,8H2,(H2,17,18)	PXDYSWGYXBLZMD-UHFFFAOYSA-N	361.990219452							105135
ZINC05062386	LSM-43644	SID22411077, BRD-K66520473	7478561	InChI=1S/C15H13FN2O2/c1-20-15-9-7-13(10-17-15)18-14(19)8-4-11-2-5-12(16)6-3-11/h2-10H,1H3,(H,18,19)/b8-4+	UTOMCTTWLQIFBA-XBXARRHUSA-N	COc1ccc(NC(=O)\C=C\c2ccc(F)cc2)cn1	BroadT	BRD-K66520473	BRD-K66520473-001-05-0	Enamine Ltd.	ZT-2935410			COc1ccc(NC(=O)\C=C\c2ccc(F)cc2)cn1	InChI=1S/C15H13FN2O2/c1-20-15-9-7-13(10-17-15)18-14(19)8-4-11-2-5-12(16)6-3-11/h2-10H,1H3,(H,18,19)/b8-4+	UTOMCTTWLQIFBA-XBXARRHUSA-N	272.096105876							
MLS000699568	LSM-16500	SID22413439, BRD-K27882438	825208	InChI=1S/C12H13NO3/c1-13-10-6-8(15-2)4-5-9(10)11(16-3)7-12(13)14/h4-7H,1-3H3	SXFIYFZKRCNLLT-UHFFFAOYSA-N	COC1=CC(=O)N(C)c2cc(OC)ccc12	BroadT	BRD-K27882438	BRD-K27882438-001-05-6	Specs	AE-406/41057132			COc1ccc2c(OC)cc(=O)n(C)c2c1	InChI=1S/C12H13NO3/c1-13-10-6-8(15-2)4-5-9(10)11(16-3)7-12(13)14/h4-7H,1-3H3	SXFIYFZKRCNLLT-UHFFFAOYSA-N	219.089543286							105137
2-(4-Methylphenyl)-n-[4-(morpholin-4-yl)phenyl]quinazolin-4-amine	LSM-16501	SID26663344, BRD-K39183750	1187531	InChI=1S/C25H24N4O/c1-18-6-8-19(9-7-18)24-27-23-5-3-2-4-22(23)25(28-24)26-20-10-12-21(13-11-20)29-14-16-30-17-15-29/h2-13H,14-17H2,1H3,(H,26,27,28)	YLPKKQNRKMWICA-UHFFFAOYSA-N	Cc1ccc(cc1)c2nc(Nc3ccc(cc3)N4CCOCC4)c5ccccc5n2	BroadT	BRD-K39183750	BRD-K39183750-001-06-3	InterBioScreen Ltd.	STOCK2S-80677			Cc1ccc(cc1)-c1nc(Nc2ccc(cc2)N2CCOCC2)c2ccccc2n1	InChI=1S/C25H24N4O/c1-18-6-8-19(9-7-18)24-27-23-5-3-2-4-22(23)25(28-24)26-20-10-12-21(13-11-20)29-14-16-30-17-15-29/h2-13H,14-17H2,1H3,(H,26,27,28)	YLPKKQNRKMWICA-UHFFFAOYSA-N	396.195011428							105138
ASN 05114318	LSM-16502	SID17505378, BRD-K54579553	3195013	InChI=1S/C23H18FN3O4S/c24-16-3-5-17(6-4-16)25-23(29)27(12-18-2-1-7-32-18)11-15-8-14-9-20-21(31-13-30-20)10-19(14)26-22(15)28/h1-10H,11-13H2,(H,25,29)(H,26,28)	OSDBEEUAEMSEHW-UHFFFAOYSA-N	Oc1nc2cc3OCOc3cc2cc1CN(Cc4cccs4)C(=O)Nc5ccc(F)cc5	BroadT	BRD-K54579553	BRD-K54579553-001-05-3	Asinex Ltd.	ASN 05114318			Oc1nc2cc3OCOc3cc2cc1CN(Cc1cccs1)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H18FN3O4S/c24-16-3-5-17(6-4-16)25-23(29)27(12-18-2-1-7-32-18)11-15-8-14-9-20-21(31-13-30-20)10-19(14)26-22(15)28/h1-10H,11-13H2,(H,25,29)(H,26,28)	OSDBEEUAEMSEHW-UHFFFAOYSA-N	451.100204976							105139
BAS 00693396	LSM-16503	SID24806853, BRD-K56939078	54679505	InChI=1S/C22H20N4O4/c1-3-8-17-23-15-11-6-4-9-13(15)21(29)26(17)24-20(28)18-19(27)14-10-5-7-12-16(14)25(2)22(18)30/h4-7,9-12,27H,3,8H2,1-2H3,(H,24,28)	FVGHBWBYHITQJE-UHFFFAOYSA-N	CCCC1=Nc2ccccc2C(=O)N1NC(=O)C3=C(O)c4ccccc4N(C)C3=O	BroadT	BRD-K56939078	BRD-K56939078-001-05-3	Asinex Ltd.	BAS 00693396			CCCc1nc2ccccc2c(=O)n1NC(=O)c1c(O)c2ccccc2n(C)c1=O	InChI=1S/C22H20N4O4/c1-3-8-17-23-15-11-6-4-9-13(15)21(29)26(17)24-20(28)18-19(27)14-10-5-7-12-16(14)25(2)22(18)30/h4-7,9-12,27H,3,8H2,1-2H3,(H,24,28)	FVGHBWBYHITQJE-UHFFFAOYSA-N	404.14845516							105140
MLS000078605	LSM-16504	SID859947, BRD-K43131011	661249	InChI=1S/C13H15N3O2S/c1-4-5-16-12(14-15-13(16)19)9-6-10(17-2)8-11(7-9)18-3/h4,6-8H,1,5H2,2-3H3,(H,15,19)	GQNBPSAIMKYLNC-UHFFFAOYSA-N	COc1cc(OC)cc(c1)c2nnc(S)n2CC=C	BroadT	BRD-K43131011	BRD-K43131011-001-06-1	InterBioScreen Ltd.	STOCK3S-36968			COc1cc(OC)cc(c1)-c1nnc(S)n1CC=C	InChI=1S/C13H15N3O2S/c1-4-5-16-12(14-15-13(16)19)9-6-10(17-2)8-11(7-9)18-3/h4,6-8H,1,5H2,2-3H3,(H,15,19)	GQNBPSAIMKYLNC-UHFFFAOYSA-N	277.08849744							105141
AC1O9N4J	LSM-16505	BRD-K88868576	6762633	InChI=1S/C16H13ClN2O2/c1-10-2-7-14-13(8-10)15(18-21)16(20)19(14)9-11-3-5-12(17)6-4-11/h2-8,20H,9H2,1H3	OLYHZNMKPVOLAL-UHFFFAOYSA-N	Cc1ccc2n(Cc3ccc(Cl)cc3)c(O)c(N=O)c2c1	BroadT	BRD-K88868576	BRD-K88868576-001-05-3	Key Organics Ltd.	12F-391S			Cc1ccc2n(Cc3ccc(Cl)cc3)c(O)c([N+][O-])c2c1	InChI=1S/C16H13ClN2O2/c1-10-2-7-14-13(8-10)15(18-21)16(20)19(14)9-11-3-5-12(17)6-4-11/h2-8,20H,9H2,1H3	OLYHZNMKPVOLAL-UHFFFAOYSA-N	300.066555386							
[1-(Methylethyl)benzimidazol-2-yl]phenylamine	LSM-16506	SID4261731, BRD-K16431811	920276	InChI=1S/C16H17N3/c1-12(2)19-15-11-7-6-10-14(15)18-16(19)17-13-8-4-3-5-9-13/h3-12H,1-2H3,(H,17,18)	VJFHLVODYOCOPX-UHFFFAOYSA-N	CC(C)n1c(Nc2ccccc2)nc3ccccc13	BroadT	BRD-K16431811	BRD-K16431811-001-05-2	ChemBridge Corporation	7749896			CC(C)n1c(Nc2ccccc2)nc2ccccc12	InChI=1S/C16H17N3/c1-12(2)19-15-11-7-6-10-14(15)18-16(19)17-13-8-4-3-5-9-13/h3-12H,1-2H3,(H,17,18)	VJFHLVODYOCOPX-UHFFFAOYSA-N	251.142247574							105143
MLS000583096	LSM-16507	SID17510026, BRD-K44491796	6618919	InChI=1S/C17H10Cl2N4OS/c18-10-4-3-5-11(8-10)21-13-9-20-23(16(24)15(13)19)17-22-12-6-1-2-7-14(12)25-17/h1-9,21H	ZPAQVLXAJFIGMV-UHFFFAOYSA-N	ClC1=C(Nc2cccc(Cl)c2)C=NN(C1=O)c3nc4ccccc4s3	BroadT	BRD-K44491796	BRD-K44491796-001-05-1	ChemDiv Inc.	C301-2231			Clc1cccc(Nc2cnn(-c3nc4ccccc4s3)c(=O)c2Cl)c1	InChI=1S/C17H10Cl2N4OS/c18-10-4-3-5-11(8-10)21-13-9-20-23(16(24)15(13)19)17-22-12-6-1-2-7-14(12)25-17/h1-9,21H	ZPAQVLXAJFIGMV-UHFFFAOYSA-N	387.99523709							105144
F0665-0070	LSM-16508	SID7966625, BRD-K64289338	5308342	InChI=1S/C20H19N5O2S2/c1-24-17(12-25-15-9-5-6-10-16(15)29-20(25)27)22-23-19(24)28-13-18(26)21-11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H,21,26)	PDMXPMZZDRHWNE-UHFFFAOYSA-N	Cn1c(CN2C(=O)Sc3ccccc23)nnc1SCC(=O)NCc4ccccc4	BroadT	BRD-K64289338	BRD-K64289338-001-03-4	ChemDiv Inc.	C663-0065			Cn1c(Cn2c3ccccc3sc2=O)nnc1SCC(=O)NCc1ccccc1	InChI=1S/C20H19N5O2S2/c1-24-17(12-25-15-9-5-6-10-16(15)29-20(25)27)22-23-19(24)28-13-18(26)21-11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H,21,26)	PDMXPMZZDRHWNE-UHFFFAOYSA-N	425.098016278							105145
AC1O6XQH	LSM-43645	SID17513429, BRD-K64672158	6511602	InChI=1S/C15H18N4O3/c1-4-5-14-13(10-17(2)3)15(20)18(16-14)11-6-8-12(9-7-11)19(21)22/h6-10H,4-5H2,1-3H3/b13-10+	AEEVGUCYDLTPHK-JLHYYAGUSA-N	CCCC1=NN(C(=O)/C/1=C/N(C)C)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K64672158	BRD-K64672158-001-05-3	InterBioScreen Ltd.	STOCK1S-32832			CCCC1=NN(C(=O)C\1=C\N(C)C)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C15H18N4O3/c1-4-5-14-13(10-17(2)3)15(20)18(16-14)11-6-8-12(9-7-11)19(21)22/h6-10H,4-5H2,1-3H3/b13-10+	AEEVGUCYDLTPHK-JLHYYAGUSA-N	302.137890476							
ASN 05082975	LSM-16510	SID26667917, SID843254, BRD-A23953152	645535	InChI=1S/C28H33N7O2/c1-4-28(2,3)35-27(30-31-32-35)26(22-8-9-23-21(17-22)6-5-11-29-23)34-14-12-33(13-15-34)18-20-7-10-24-25(16-20)37-19-36-24/h5-11,16-17,26H,4,12-15,18-19H2,1-3H3	SXGVPWBSDOQTOM-UHFFFAOYSA-N	CCC(C)(C)n1nnnc1C(N2CCN(Cc3ccc4OCOc4c3)CC2)c5ccc6ncccc6c5	BroadT	BRD-A23953152	BRD-A23953152-001-05-5	Asinex Ltd.	ASN 05082975			CCC(C)(C)n1nnnc1C(N1CCN(Cc2ccc3OCOc3c2)CC1)c1ccc2ncccc2c1	InChI=1S/C28H33N7O2/c1-4-28(2,3)35-27(30-31-32-35)26(22-8-9-23-21(17-22)6-5-11-29-23)34-14-12-33(13-15-34)18-20-7-10-24-25(16-20)37-19-36-24/h5-11,16-17,26H,4,12-15,18-19H2,1-3H3	SXGVPWBSDOQTOM-UHFFFAOYSA-N	499.269573366							105147
11H-332S	LSM-16511	SID14730211, BRD-K95868579	2767155	InChI=1S/C20H12Cl2N2O3/c1-26-14-5-2-4-12(10-14)17-9-8-13(11-23)19(24-17)27-20(25)18-15(21)6-3-7-16(18)22/h2-10H,1H3	CJNXEPPAURGNDB-UHFFFAOYSA-N	COc1cccc(c1)c2ccc(C#N)c(OC(=O)c3c(Cl)cccc3Cl)n2	BroadT	BRD-K95868579	BRD-K95868579-001-06-9	Key Organics Ltd.	11H-332S			COc1cccc(c1)-c1ccc(C#N)c(OC(=O)c2c(Cl)cccc2Cl)n1	InChI=1S/C20H12Cl2N2O3/c1-26-14-5-2-4-12(10-14)17-9-8-13(11-23)19(24-17)27-20(25)18-15(21)6-3-7-16(18)22/h2-10H,1H3	CJNXEPPAURGNDB-UHFFFAOYSA-N	398.022497684							105148
AC1N8Q5Q	LSM-16512	BRD-K83185617	4347757	InChI=1S/C18H16F3N7O2/c1-10-6-12(8-24-26-16-15(28(29)30)9-23-17(22)25-16)11(2)27(10)14-5-3-4-13(7-14)18(19,20)21/h3-9H,1-2H3,(H3,22,23,25,26)	LJWUIXMRDMSGFT-UHFFFAOYSA-N	Cc1cc(C=NNc2nc(N)ncc2[N+](=O)[O-])c(C)n1c3cccc(c3)C(F)(F)F	BroadT	BRD-K83185617	BRD-K83185617-001-03-3	Enamine Ltd.	T0502-7153			Cc1cc(C=NNc2nc(N)ncc2[N+]([O-])=O)c(C)n1-c1cccc(c1)C(F)(F)F	InChI=1S/C18H16F3N7O2/c1-10-6-12(8-24-26-16-15(28(29)30)9-23-17(22)25-16)11(2)27(10)14-5-3-4-13(7-14)18(19,20)21/h3-9H,1-2H3,(H3,22,23,25,26)	LJWUIXMRDMSGFT-UHFFFAOYSA-N	419.131757422							105149
SMR000206376	LSM-16513	SID17510320, BRD-A90711788	12005176	InChI=1S/C24H18N4O6/c1-2-33-24(30)14-8-10-16(11-9-14)27-22(15-5-3-6-17(13-15)28(31)32)19-20(18-7-4-12-34-18)25-26-21(19)23(27)29/h3-13,22H,2H2,1H3,(H,25,26)	SNKFEHHUNLAZGK-UHFFFAOYSA-N	CCOC(=O)c1ccc(cc1)N2C(c3cccc(c3)[N+](=O)[O-])c4c(n[nH]c4C2=O)c5occc5	BroadT	BRD-A90711788	BRD-A90711788-001-05-7	ChemDiv Inc.	C390-0478			CCOC(=O)c1ccc(cc1)N1C(c2c(n[nH]c2C1=O)-c1ccco1)c1cccc(c1)[N+]([O-])=O	InChI=1S/C24H18N4O6/c1-2-33-24(30)14-8-10-16(11-9-14)27-22(15-5-3-6-17(13-15)28(31)32)19-20(18-7-4-12-34-18)25-26-21(19)23(27)29/h3-13,22H,2H2,1H3,(H,25,26)	SNKFEHHUNLAZGK-UHFFFAOYSA-N	458.122634336							105150
ZINC02836192	LSM-16514	SID17432833, BRD-K28528450	2192714	InChI=1S/C18H13BrF3N3O3/c1-2-3-16-23-14-6-4-10(19)8-12(14)17(26)24(16)11-5-7-15(25(27)28)13(9-11)18(20,21)22/h4-9H,2-3H2,1H3	HCIWJYRFDLXLJI-UHFFFAOYSA-N	CCCC1=Nc2ccc(Br)cc2C(=O)N1c3ccc(c(c3)C(F)(F)F)[N+](=O)[O-]	BroadT	BRD-K28528450	BRD-K28528450-001-06-5	ChemBridge Corporation	7519758			CCCc1nc2ccc(Br)cc2c(=O)n1-c1ccc(c(c1)C(F)(F)F)[N+]([O-])=O	InChI=1S/C18H13BrF3N3O3/c1-2-3-16-23-14-6-4-10(19)8-12(14)17(26)24(16)11-5-7-15(25(27)28)13(9-11)18(20,21)22/h4-9H,2-3H2,1H3	HCIWJYRFDLXLJI-UHFFFAOYSA-N	455.009238506							105151
MLS000054310	LSM-16515	SID3712804, BRD-K41651675	2998173	InChI=1S/C23H29N3O3/c1-3-24(4-2)21-12-10-19(11-13-21)23(28)29-18-22(27)26-16-14-25(15-17-26)20-8-6-5-7-9-20/h5-13H,3-4,14-18H2,1-2H3	QDUCWVIFLLKBSB-UHFFFAOYSA-N	CCN(CC)c1ccc(cc1)C(=O)OCC(=O)N2CCN(CC2)c3ccccc3	BroadT	BRD-K41651675	BRD-K41651675-001-05-9	Enamine Ltd.	T5235632			CCN(CC)c1ccc(cc1)C(=O)OCC(=O)N1CCN(CC1)c1ccccc1	InChI=1S/C23H29N3O3/c1-3-24(4-2)21-12-10-19(11-13-21)23(28)29-18-22(27)26-16-14-25(15-17-26)20-8-6-5-7-9-20/h5-13H,3-4,14-18H2,1-2H3	QDUCWVIFLLKBSB-UHFFFAOYSA-N	395.220891818							105152
MLS000689720	LSM-16516	SID24822981, BRD-K80281550	628117	InChI=1S/C16H11N3O2S/c20-16-15-14(10-5-1-2-6-11(10)21-15)18-12(19-16)9-22-13-7-3-4-8-17-13/h1-8H,9H2,(H,18,19,20)	OFPPBURSJQTDOK-UHFFFAOYSA-N	Oc1nc(CSc2ccccn2)nc3c1oc4ccccc34	BroadT	BRD-K80281550	BRD-K80281550-001-04-0	ChemDiv Inc.	6526-0833			O=c1[nH]c(CSc2ccccn2)nc2c3ccccc3oc12	InChI=1S/C16H11N3O2S/c20-16-15-14(10-5-1-2-6-11(10)21-15)18-12(19-16)9-22-13-7-3-4-8-17-13/h1-8H,9H2,(H,18,19,20)	OFPPBURSJQTDOK-UHFFFAOYSA-N	309.057197312							105153
2-Chloro-n-(1,2-diphenylethyl)acetamide	LSM-16517	SID24828325, BRD-A23782314	4425285	InChI=1S/C16H16ClNO/c17-12-16(19)18-15(14-9-5-2-6-10-14)11-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,18,19)	JBFGAYHXKQXCTD-UHFFFAOYSA-N	ClCC(=O)NC(Cc1ccccc1)c2ccccc2	BroadT	BRD-A23782314	BRD-A23782314-001-06-1	Enamine Ltd.	T5342939			ClCC(=O)NC(Cc1ccccc1)c1ccccc1	InChI=1S/C16H16ClNO/c17-12-16(19)18-15(14-9-5-2-6-10-14)11-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,18,19)	JBFGAYHXKQXCTD-UHFFFAOYSA-N	273.092041852							105154
MLS000419204	LSM-16518	SID24816744, BRD-K57441868	4321221	InChI=1S/C16H15BrN2O2/c1-11-10-12-4-2-3-5-13(12)19(11)9-8-18-16(20)14-6-7-15(17)21-14/h2-7,10H,8-9H2,1H3,(H,18,20)	WEKYVNZJKJRZGI-UHFFFAOYSA-N	Cc1cc2ccccc2n1CCNC(=O)c3oc(Br)cc3	BroadT	BRD-K57441868	BRD-K57441868-001-06-1	Life Chemicals Inc.	F0613-0137			Cc1cc2ccccc2n1CCNC(=O)c1ccc(Br)o1	InChI=1S/C16H15BrN2O2/c1-11-10-12-4-2-3-5-13(12)19(11)9-8-18-16(20)14-6-7-15(17)21-14/h2-7,10H,8-9H2,1H3,(H,18,20)	WEKYVNZJKJRZGI-UHFFFAOYSA-N	346.03169034							105155
F0559-0097	LSM-16519	SID4244047, BRD-K42080232	2158903	InChI=1S/C22H17FN4O4S/c1-27(18-5-3-2-4-6-18)32(29,30)19-13-9-15(10-14-19)20(28)24-22-26-25-21(31-22)16-7-11-17(23)12-8-16/h2-14H,1H3,(H,24,26,28)	JPVJIVSMURSWGM-UHFFFAOYSA-N	CN(c1ccccc1)S(=O)(=O)c2ccc(cc2)C(=O)Nc3oc(nn3)c4ccc(F)cc4	BroadT	BRD-K42080232	BRD-K42080232-001-04-9	ChemDiv Inc.	C079-0037			CN(c1ccccc1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(o1)-c1ccc(F)cc1	InChI=1S/C22H17FN4O4S/c1-27(18-5-3-2-4-6-18)32(29,30)19-13-9-15(10-14-19)20(28)24-22-26-25-21(31-22)16-7-11-17(23)12-8-16/h2-14H,1H3,(H,24,26,28)	JPVJIVSMURSWGM-UHFFFAOYSA-N	452.095453954							105156
2L-040	LSM-16520	SID17411118, BRD-K87284802	1471207	InChI=1S/C15H14ClF3N2O3S/c1-9(2)21-25(22,23)12-5-3-11(4-6-12)24-14-13(16)7-10(8-20-14)15(17,18)19/h3-9,21H,1-2H3	NIJTUDCAEFZYJX-UHFFFAOYSA-N	CC(C)NS(=O)(=O)c1ccc(Oc2ncc(cc2Cl)C(F)(F)F)cc1	BroadT	BRD-K87284802	BRD-K87284802-001-05-0	Key Organics Ltd.	2L-040			CC(C)NS(=O)(=O)c1ccc(Oc2ncc(cc2Cl)C(F)(F)F)cc1	InChI=1S/C15H14ClF3N2O3S/c1-9(2)21-25(22,23)12-5-3-11(4-6-12)24-14-13(16)7-10(8-20-14)15(17,18)19/h3-9,21H,1-2H3	NIJTUDCAEFZYJX-UHFFFAOYSA-N	394.036575328							105157
SMR000079211	LSM-16521	SID26669403, SID4255254, BRD-K08220354	1261668	InChI=1S/C24H20BrN5O/c25-18-4-5-21-19(15-18)20(16-22(28-21)17-6-9-26-10-7-17)24(31)30-13-11-29(12-14-30)23-3-1-2-8-27-23/h1-10,15-16H,11-14H2	SFFNMNWGTSXGKQ-UHFFFAOYSA-N	Brc1ccc2nc(cc(C(=O)N3CCN(CC3)c4ccccn4)c2c1)c5ccncc5	BroadT	BRD-K08220354	BRD-K08220354-001-05-2	ChemBridge Corporation	7923733			Brc1ccc2nc(cc(C(=O)N3CCN(CC3)c3ccccn3)c2c1)-c1ccncc1	InChI=1S/C24H20BrN5O/c25-18-4-5-21-19(15-18)20(16-22(28-21)17-6-9-26-10-7-17)24(31)30-13-11-29(12-14-30)23-3-1-2-8-27-23/h1-10,15-16H,11-14H2	SFFNMNWGTSXGKQ-UHFFFAOYSA-N	473.08512291							105158
ZINC00501724	LSM-16522	SID26665353, BRD-K95373054	915856	InChI=1S/C13H12ClNO3/c1-7-4-13(17)18-11-3-8(2)10(5-9(7)11)15-12(16)6-14/h3-5H,6H2,1-2H3,(H,15,16)	LCMGGQOQMSENQL-UHFFFAOYSA-N	CC1=CC(=O)Oc2cc(C)c(NC(=O)CCl)cc12	BroadT	BRD-K95373054	BRD-K95373054-001-05-6	InterBioScreen Ltd.	STOCK1S-68850			Cc1cc2oc(=O)cc(C)c2cc1NC(=O)CCl	InChI=1S/C13H12ClNO3/c1-7-4-13(17)18-11-3-8(2)10(5-9(7)11)15-12(16)6-14/h3-5H,6H2,1-2H3,(H,15,16)	LCMGGQOQMSENQL-UHFFFAOYSA-N	265.050570964							105159
T5245108	LSM-16523	SID22411011, BRD-K74452388	2116592	InChI=1S/C20H23ClN4O7S/c1-23-17(22)16(18(27)24(2)20(23)29)14(26)11-32-19(28)12-6-7-13(21)15(10-12)33(30,31)25-8-4-3-5-9-25/h6-7,10H,3-5,8-9,11,22H2,1-2H3	PXSBKUSVQKGTGE-UHFFFAOYSA-N	CN1C(=C(C(=O)COC(=O)c2ccc(Cl)c(c2)S(=O)(=O)N3CCCCC3)C(=O)N(C)C1=O)N	BroadT	BRD-K74452388	BRD-K74452388-001-05-0	Enamine Ltd.	T5245108			Cn1c(N)c(C(=O)COC(=O)c2ccc(Cl)c(c2)S(=O)(=O)N2CCCCC2)c(=O)n(C)c1=O	InChI=1S/C20H23ClN4O7S/c1-23-17(22)16(18(27)24(2)20(23)29)14(26)11-32-19(28)12-6-7-13(21)15(10-12)33(30,31)25-8-4-3-5-9-25/h6-7,10H,3-5,8-9,11,22H2,1-2H3	PXSBKUSVQKGTGE-UHFFFAOYSA-N	498.097597516							105160
ZINC01952601	LSM-16524	BRD-K07031090	6803181	InChI=1S/C15H15N3O5/c1-22-11-5-2-4-10(14(11)20)8-17-18-13(19)9-16-15(21)12-6-3-7-23-12/h2-8,20H,9H2,1H3,(H,16,21)(H,18,19)	DAAAIESCTLINQL-UHFFFAOYSA-N	COc1cccc(C=NNC(=O)CNC(=O)c2occc2)c1O	BroadT	BRD-K07031090	BRD-K07031090-001-06-1	InterBioScreen Ltd.	STOCK1S-86221			COc1cccc(C=NNC(=O)CNC(=O)c2ccco2)c1O	InChI=1S/C15H15N3O5/c1-22-11-5-2-4-10(14(11)20)8-17-18-13(19)9-16-15(21)12-6-3-7-23-12/h2-8,20H,9H2,1H3,(H,16,21)(H,18,19)	DAAAIESCTLINQL-UHFFFAOYSA-N	317.10117061							
SMR000152445	LSM-16525	SID14744410, BRD-K45620924	2493207	InChI=1S/C20H15NO2S/c1-13-10-20(21-16-8-4-3-7-15(13)16)24-12-17(22)19-11-14-6-2-5-9-18(14)23-19/h2-11H,12H2,1H3	LDEZHWFQZKSQEN-UHFFFAOYSA-N	Cc1cc(SCC(=O)c2oc3ccccc3c2)nc4ccccc14	BroadT	BRD-K45620924	BRD-K45620924-001-05-9	Enamine Ltd.	T0519-6658			Cc1cc(SCC(=O)c2cc3ccccc3o2)nc2ccccc12	InChI=1S/C20H15NO2S/c1-13-10-20(21-16-8-4-3-7-15(13)16)24-12-17(22)19-11-14-6-2-5-9-18(14)23-19/h2-11H,12H2,1H3	LDEZHWFQZKSQEN-UHFFFAOYSA-N	333.08234942							105162
MLS000543820	LSM-16526	SID17407330, BRD-K14993597	1239901	InChI=1S/C21H13BrN2O3/c22-14-7-3-13(4-8-14)19(25)23-24-20(26)15-9-5-11-1-2-12-6-10-16(21(24)27)18(15)17(11)12/h3-10H,1-2H2,(H,23,25)	WNNYEHFPCIWBOI-UHFFFAOYSA-N	Brc1ccc(cc1)C(=O)NN2C(=O)c3ccc4CCc5ccc(C2=O)c3c45	BroadT	BRD-K14993597	BRD-K14993597-001-05-3	Specs	AG-205/32361036			Brc1ccc(cc1)C(=O)NN1C(=O)c2ccc3CCc4ccc(C1=O)c2c34	InChI=1S/C21H13BrN2O3/c22-14-7-3-13(4-8-14)19(25)23-24-20(26)15-9-5-11-1-2-12-6-10-16(21(24)27)18(15)17(11)12/h3-10H,1-2H2,(H,23,25)	WNNYEHFPCIWBOI-UHFFFAOYSA-N	420.010954896							105163
MLS000095437	LSM-16527	SID26670706, SID4249420, BRD-K53394777	3243377	InChI=1S/C25H30N4O4S/c1-3-4-10-29-24(31)21-16-19(28-11-13-33-14-12-28)8-9-22(21)27-25(29)34-17-23(30)26-18-6-5-7-20(15-18)32-2/h5-9,15-16H,3-4,10-14,17H2,1-2H3,(H,26,30)	KZEVQLAEFAQOPI-UHFFFAOYSA-N	CCCCN1C(=O)c2cc(ccc2N=C1SCC(=O)Nc3cccc(OC)c3)N4CCOCC4	BroadT	BRD-K53394777	BRD-K53394777-001-06-6	ChemDiv Inc.	K284-7088			CCCCn1c(SCC(=O)Nc2cccc(OC)c2)nc2ccc(cc2c1=O)N1CCOCC1	InChI=1S/C25H30N4O4S/c1-3-4-10-29-24(31)21-16-19(28-11-13-33-14-12-28)8-9-22(21)27-25(29)34-17-23(30)26-18-6-5-7-20(15-18)32-2/h5-9,15-16H,3-4,10-14,17H2,1-2H3,(H,26,30)	KZEVQLAEFAQOPI-UHFFFAOYSA-N	482.19877617							105164
ST50897689	LSM-16528	SID14730124, BRD-K84324635	1247124	InChI=1S/C20H16N2O2S/c21-18(23)16-15-11-10-12-6-4-5-9-14(12)17(15)25-20(16)22-19(24)13-7-2-1-3-8-13/h1-9H,10-11H2,(H2,21,23)(H,22,24)	PRUNCWGAVNDIEF-UHFFFAOYSA-N	NC(=O)c1c(NC(=O)c2ccccc2)sc3c1CCc4ccccc34	BroadT	BRD-K84324635	BRD-K84324635-001-05-0	ChemBridge Corporation	7948456			NC(=O)c1c(NC(=O)c2ccccc2)sc-2c1CCc1ccccc-21	InChI=1S/C20H16N2O2S/c21-18(23)16-15-11-10-12-6-4-5-9-14(12)17(15)25-20(16)22-19(24)13-7-2-1-3-8-13/h1-9H,10-11H2,(H2,21,23)(H,22,24)	PRUNCWGAVNDIEF-UHFFFAOYSA-N	348.093248462							105165
MLS000053914	LSM-16529	SID3717770, BRD-K61842238	2104690	InChI=1S/C23H20N4O2S/c1-26(2)12-21-24-17-9-5-4-8-16(17)23(28)27(21)13-22-25-18(14-30-22)20-11-15-7-3-6-10-19(15)29-20/h3-11,14H,12-13H2,1-2H3	UTVJAJZRXFBKKN-UHFFFAOYSA-N	CN(C)CC1=Nc2ccccc2C(=O)N1Cc3nc(cs3)c4oc5ccccc5c4	BroadT	BRD-K61842238	BRD-K61842238-001-07-5	Enamine Ltd.	T5250814			CN(C)Cc1nc2ccccc2c(=O)n1Cc1nc(cs1)-c1cc2ccccc2o1	InChI=1S/C23H20N4O2S/c1-26(2)12-21-24-17-9-5-4-8-16(17)23(28)27(21)13-22-25-18(14-30-22)20-11-15-7-3-6-10-19(15)29-20/h3-11,14H,12-13H2,1-2H3	UTVJAJZRXFBKKN-UHFFFAOYSA-N	416.13069661							105166
ST066562	LSM-16530	SID4259372, BRD-K42302256	976041	InChI=1S/C11H15NO4S2/c1-16-11(13)9-7-5-3-4-6-8(7)17-10(9)12-18(2,14)15/h12H,3-6H2,1-2H3	FRIOXYPSVNXEJK-UHFFFAOYSA-N	COC(=O)c1c2CCCCc2sc1NS(=O)(=O)C	BroadT	BRD-K42302256	BRD-K42302256-001-05-5	ChemBridge Corporation	7705096			COC(=O)c1c(NS(C)(=O)=O)sc2CCCCc12	InChI=1S/C11H15NO4S2/c1-16-11(13)9-7-5-3-4-6-8(7)17-10(9)12-18(2,14)15/h12H,3-6H2,1-2H3	FRIOXYPSVNXEJK-UHFFFAOYSA-N	289.04424935							105167
2-Chloro-1-(1-isoxazol-3-yl-2,5-dimethyl-1H-pyrrol-3-yl)ethanone	LSM-16531	SID24832777, BRD-K16990538	4868373	InChI=1S/C11H11ClN2O2/c1-7-5-9(10(15)6-12)8(2)14(7)11-3-4-16-13-11/h3-5H,6H2,1-2H3	AMUMCOAHTVMOAC-UHFFFAOYSA-N	Cc1cc(C(=O)CCl)c(C)n1c2ccon2	BroadT	BRD-K16990538	BRD-K16990538-001-04-2	Enamine Ltd.	EN300-11036			Cc1cc(C(=O)CCl)c(C)n1-c1ccon1	InChI=1S/C11H11ClN2O2/c1-7-5-9(10(15)6-12)8(2)14(7)11-3-4-16-13-11/h3-5H,6H2,1-2H3	AMUMCOAHTVMOAC-UHFFFAOYSA-N	238.050905322							105168
T5256957	LSM-16532	SID16953689, BRD-K04068887	4544195	InChI=1S/C18H19NO4/c1-13(2)19-17(20)12-22-18(21)15-10-6-7-11-16(15)23-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,19,20)	LIVNCTKXZFUZPF-UHFFFAOYSA-N	CC(C)NC(=O)COC(=O)c1ccccc1Oc2ccccc2	BroadT	BRD-K04068887	BRD-K04068887-001-05-5	Enamine Ltd.	T5256957			CC(C)NC(=O)COC(=O)c1ccccc1Oc1ccccc1	InChI=1S/C18H19NO4/c1-13(2)19-17(20)12-22-18(21)15-10-6-7-11-16(15)23-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,19,20)	LIVNCTKXZFUZPF-UHFFFAOYSA-N	313.131408098							105169
MLS001224198	LSM-16533	SID103062011, SID125240939, SID49727451, BRD-K58935949	1104203	InChI=1S/C17H10N4O5/c22-16(13-7-8-14(25-13)21(23)24)19-11-5-3-10(4-6-11)17-20-15-12(26-17)2-1-9-18-15/h1-9H,(H,19,22)	KPPHBMOZKRLTCW-UHFFFAOYSA-N	[O-][N+](=O)c1oc(cc1)C(=O)Nc2ccc(cc2)c3oc4cccnc4n3	BroadT	BRD-K58935949	BRD-K58935949-001-09-8	Asinex Ltd.	BAS 00738227			[O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc(cc1)-c1nc2ncccc2o1	InChI=1S/C17H10N4O5/c22-16(13-7-8-14(25-13)21(23)24)19-11-5-3-10(4-6-11)17-20-15-12(26-17)2-1-9-18-15/h1-9H,(H,19,22)	KPPHBMOZKRLTCW-UHFFFAOYSA-N	350.06511946							105170
MLS001105170	LSM-16534	SID49732508, BRD-A17593601	24793194	InChI=1S/C21H25N5O4/c1-28-11-9-16-4-2-3-10-25(16)21(27)20-12-19(30-24-20)13-29-18-7-5-17(6-8-18)26-15-22-14-23-26/h5-8,12,14-16H,2-4,9-11,13H2,1H3	FXRABYUGBARJNR-UHFFFAOYSA-N	COCCC1CCCCN1C(=O)c2cc(COc3ccc(cc3)n4cncn4)on2	BroadT	BRD-A17593601	BRD-A17593601-001-06-2	ChemBridge Corporation	45880690			COCCC1CCCCN1C(=O)c1cc(COc2ccc(cc2)-n2cncn2)on1	InChI=1S/C21H25N5O4/c1-28-11-9-16-4-2-3-10-25(16)21(27)20-12-19(30-24-20)13-29-18-7-5-17(6-8-18)26-15-22-14-23-26/h5-8,12,14-16H,2-4,9-11,13H2,1H3	FXRABYUGBARJNR-UHFFFAOYSA-N	411.19065433							105171
ST50021498	LSM-16535	SID14721165, SID24416607, BRD-K14647153	750667	InChI=1S/C13H15N3O3S/c1-3-19-10-7-5-4-6-9(10)12(17)14-13-16-15-11(20-13)8-18-2/h4-7H,3,8H2,1-2H3,(H,14,16,17)	OXRSQDMLAZJHLR-UHFFFAOYSA-N	CCOc1ccccc1C(=O)Nc2nnc(COC)s2	BroadT	BRD-K14647153	BRD-K14647153-001-05-1	Asinex Ltd.	BAS 05277410			CCOc1ccccc1C(=O)Nc1nnc(COC)s1	InChI=1S/C13H15N3O3S/c1-3-19-10-7-5-4-6-9(10)12(17)14-13-16-15-11(20-13)8-18-2/h4-7H,3,8H2,1-2H3,(H,14,16,17)	OXRSQDMLAZJHLR-UHFFFAOYSA-N	293.08341206							105172
T5822519	LSM-43646	SID14745383, BRD-K71327258	6249835	InChI=1S/C21H15ClFN3O2S/c1-12-16(20(22)26(25-12)15-8-6-14(23)7-9-15)10-13(11-19(27)28)21-24-17-4-2-3-5-18(17)29-21/h2-10H,11H2,1H3,(H,27,28)/b13-10+	RTLMHOJYSNZDDT-JLHYYAGUSA-N	Cc1nn(c(Cl)c1\C=C(/CC(=O)O)\c2nc3ccccc3s2)c4ccc(F)cc4	BroadT	BRD-K71327258	BRD-K71327258-001-05-4	Enamine Ltd.	T0515-8404			Cc1nn(c(Cl)c1\C=C(/CC(O)=O)c1nc2ccccc2s1)-c1ccc(F)cc1	InChI=1S/C21H15ClFN3O2S/c1-12-16(20(22)26(25-12)15-8-6-14(23)7-9-15)10-13(11-19(27)28)21-24-17-4-2-3-5-18(17)29-21/h2-10H,11H2,1H3,(H,27,28)/b13-10+	RTLMHOJYSNZDDT-JLHYYAGUSA-N	427.05575335							
AC1O9NJM	LSM-16537	SID22413865, BRD-K01228012	6762876	InChI=1S/C15H14N6/c16-14-13(19-18-11-7-3-1-4-8-11)15(17)21(20-14)12-9-5-2-6-10-12/h1-10H,17H2,(H2,16,20)	JDBSGKGTKLQVEM-UHFFFAOYSA-N	Nc1nn(c(N)c1N=Nc2ccccc2)c3ccccc3	BroadT	BRD-K01228012	BRD-K01228012-001-05-6	Specs	AE-641/00807020			Nc1nn(c(N)c1N=Nc1ccccc1)-c1ccccc1	InChI=1S/C15H14N6/c16-14-13(19-18-11-7-3-1-4-8-11)15(17)21(20-14)12-9-5-2-6-10-12/h1-10H,17H2,(H2,16,20)	JDBSGKGTKLQVEM-UHFFFAOYSA-N	278.127994508							
AC1LEKKM	LSM-16538	BRD-K36773633	687727	InChI=1S/C14H10BrN3OS/c15-11-5-3-10(4-6-11)13-9-20-14(17-13)18-16-8-12-2-1-7-19-12/h1-9H,(H,17,18)	KECGDNDIPWAYCW-UHFFFAOYSA-N	Brc1ccc(cc1)c2csc(NN=Cc3occc3)n2	BroadT	BRD-K36773633	BRD-K36773633-001-05-9	Enamine Ltd.	T0503-7585			Brc1ccc(cc1)-c1csc(NN=Cc2ccco2)n1	InChI=1S/C14H10BrN3OS/c15-11-5-3-10(4-6-11)13-9-20-14(17-13)18-16-8-12-2-1-7-19-12/h1-9H,(H,17,18)	KECGDNDIPWAYCW-UHFFFAOYSA-N	346.97279526							105175
T5332070	LSM-16539	SID3714848, BRD-K79947793	2494887	InChI=1S/C18H22N2O/c1-12-7-5-9-16(14(12)3)19-11-18(21)20-17-10-6-8-13(2)15(17)4/h5-10,19H,11H2,1-4H3,(H,20,21)	VMBKWMXOXXGBLN-UHFFFAOYSA-N	Cc1cccc(NCC(=O)Nc2cccc(C)c2C)c1C	BroadT	BRD-K79947793	BRD-K79947793-001-05-3	Enamine Ltd.	T5332070			Cc1cccc(NCC(=O)Nc2cccc(C)c2C)c1C	InChI=1S/C18H22N2O/c1-12-7-5-9-16(14(12)3)19-11-18(21)20-17-10-6-8-13(2)15(17)4/h5-10,19H,11H2,1-4H3,(H,20,21)	VMBKWMXOXXGBLN-UHFFFAOYSA-N	282.173213344							105176
ST50631045	LSM-16540	SID24797037, BRD-K09021615	901249	InChI=1S/C18H20N2O3/c1-12(2)17(21)19-14-9-7-13(8-10-14)18(22)20-15-5-4-6-16(11-15)23-3/h4-12H,1-3H3,(H,19,21)(H,20,22)	YXBNHYISADAXPP-UHFFFAOYSA-N	COc1cccc(NC(=O)c2ccc(NC(=O)C(C)C)cc2)c1	BroadT	BRD-K09021615	BRD-K09021615-001-05-8	ChemBridge Corporation	7773589			COc1cccc(NC(=O)c2ccc(NC(=O)C(C)C)cc2)c1	InChI=1S/C18H20N2O3/c1-12(2)17(21)19-14-9-7-13(8-10-14)18(22)20-15-5-4-6-16(11-15)23-3/h4-12H,1-3H3,(H,19,21)(H,20,22)	YXBNHYISADAXPP-UHFFFAOYSA-N	312.14739252							105177
ST50323914	LSM-16541	SID24835522, BRD-K21404203	1186363	InChI=1S/C18H11F3O6/c1-25-11-6-7-12-13(8-11)27-16(18(19,20)21)15(14(12)22)26-10-4-2-9(3-5-10)17(23)24/h2-8H,1H3,(H,23,24)	XEUVVQCUBIMVHD-UHFFFAOYSA-N	COc1ccc2C(=O)C(=C(Oc2c1)C(F)(F)F)Oc3ccc(cc3)C(=O)O	BroadT	BRD-K21404203	BRD-K21404203-001-05-8	Enamine Ltd.	T0505-4631			COc1ccc2c(c1)oc(c(Oc1ccc(cc1)C(O)=O)c2=O)C(F)(F)F	InChI=1S/C18H11F3O6/c1-25-11-6-7-12-13(8-11)27-16(18(19,20)21)15(14(12)22)26-10-4-2-9(3-5-10)17(23)24/h2-8H,1H3,(H,23,24)	XEUVVQCUBIMVHD-UHFFFAOYSA-N	380.050772672							105178
SMR000123694	LSM-16542	SID14722561, SID24415416, BRD-K43089177	1077699	InChI=1S/C20H23ClN2O3S/c1-15-6-8-18(9-7-15)27(25,26)23-12-10-16(11-13-23)20(24)22-14-17-4-2-3-5-19(17)21/h2-9,16H,10-14H2,1H3,(H,22,24)	OBKIWSDWDJIJQC-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)NCc3ccccc3Cl	BroadT	BRD-K43089177	BRD-K43089177-001-06-1	Asinex Ltd.	BAS 05018824			Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccccc1Cl	InChI=1S/C20H23ClN2O3S/c1-15-6-8-18(9-7-15)27(25,26)23-12-10-16(11-13-23)20(24)22-14-17-4-2-3-5-19(17)21/h2-9,16H,10-14H2,1H3,(H,22,24)	OBKIWSDWDJIJQC-UHFFFAOYSA-N	406.111791016							105179
CHEMBL1332325	LSM-2845	BRD-K38012662, SID17433491, SID87219020, SID87457111, BRD2662	877874	InChI=1S/C16H15BrN2O2/c1-2-15(20)18-11-6-5-7-12(10-11)19-16(21)13-8-3-4-9-14(13)17/h3-10H,2H2,1H3,(H,18,20)(H,19,21)	MRHAVVLJBCSEMH-UHFFFAOYSA-N	CCC(=O)Nc1cccc(NC(=O)c2ccccc2Br)c1	BroadT	BRD-K38012662	BRD-K38012662-001-08-8	ChemBridge Corporation	5941154			CCC(=O)Nc1cccc(NC(=O)c2ccccc2Br)c1	InChI=1S/C16H15BrN2O2/c1-2-15(20)18-11-6-5-7-12(10-11)19-16(21)13-8-3-4-9-14(13)17/h3-10H,2H2,1H3,(H,18,20)(H,19,21)	MRHAVVLJBCSEMH-UHFFFAOYSA-N	346.03169034							92674
SMR000196936	LSM-16543	SID17433993, BRD-K49910317	5662854	InChI=1S/C15H11N3O4/c1-7-2-3-11-8(4-7)5-9(12(19)16-11)6-10-13(20)17-15(22)18-14(10)21/h2-6H,1H3,(H,16,19)(H2,17,18,20,21,22)	ILJUOPDTYBNOCY-UHFFFAOYSA-N	Cc1ccc2nc(O)c(C=C3C(=O)NC(=O)NC3=O)cc2c1	BroadT	BRD-K49910317	BRD-K49910317-001-06-3	ChemBridge Corporation	6994210			Cc1ccc2nc(O)c(C=C3C(=O)NC(=O)NC3=O)cc2c1	InChI=1S/C15H11N3O4/c1-7-2-3-11-8(4-7)5-9(12(19)16-11)6-10-13(20)17-15(22)18-14(10)21/h2-6H,1H3,(H,16,19)(H2,17,18,20,21,22)	ILJUOPDTYBNOCY-UHFFFAOYSA-N	297.074955862							105180
MLS000095879	LSM-16544	SID4247665, BRD-K90675977	3241843	InChI=1S/C17H20N2O4S/c1-23-15-7-9-16(10-8-15)24(21,22)19-12-11-17(20)18-13-14-5-3-2-4-6-14/h2-10,19H,11-13H2,1H3,(H,18,20)	QALLGHGEBNUBRQ-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)NCCC(=O)NCc2ccccc2	BroadT	BRD-K90675977	BRD-K90675977-001-05-3	ChemDiv Inc.	K781-4353			COc1ccc(cc1)S(=O)(=O)NCCC(=O)NCc1ccccc1	InChI=1S/C17H20N2O4S/c1-23-15-7-9-16(10-8-15)24(21,22)19-12-11-17(20)18-13-14-5-3-2-4-6-14/h2-10,19H,11-13H2,1H3,(H,18,20)	QALLGHGEBNUBRQ-UHFFFAOYSA-N	348.11437783							105181
CHEMBL473327	LSM-43647	SID24838566, BRD-K16877843	3236108	InChI=1S/C15H16N2O4S4/c1-2-16-13(18)12(24-15(16)22)14-17(8-5-9-25(19,20)21)10-6-3-4-7-11(10)23-14/h3-4,6-7H,2,5,8-9H2,1H3,(H,19,20,21)/b14-12-	ZHNBFYMZDUSWSL-OWBHPGMISA-N	CCN1C(=S)S\C(=C\2/Sc3ccccc3N2CCCS(=O)(=O)O)\C1=O	BroadT	BRD-K16877843	BRD-K16877843-001-05-8	ChemDiv Inc.	2324-0448			CCN1C(=S)S\C(C1=O)=C1/Sc2ccccc2N1CCCS(O)(=O)=O	InChI=1S/C15H16N2O4S4/c1-2-16-13(18)12(24-15(16)22)14-17(8-5-9-25(19,20)21)10-6-3-4-7-11(10)23-14/h3-4,6-7H,2,5,8-9H2,1H3,(H,19,20,21)/b14-12-	ZHNBFYMZDUSWSL-OWBHPGMISA-N	415.999289772							, 
BRD-K91491104	LSM-8008		54618394	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19-,24-/m0/s1	HVXCQDGXUZNQFT-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC(C)(C)O	BroadT	BRD-K91491104	BRD-K91491104-001-01-9	Broad Institute of MIT and Harvard	BRD-K91491104			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC(C)(C)O	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19-,24-/m0/s1	HVXCQDGXUZNQFT-JXQFQVJHSA-N	483.253334798							96629
BRD-K35854261	LSM-7309		54618440	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17+,21+/m1/s1	MNKHAAOLWRLKCW-WWMYMODYSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC3CC3	BroadT	BRD-K35854261	BRD-K35854261-001-01-6	Broad Institute of MIT and Harvard	BRD-K35854261			CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1CC1	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17+,21+/m1/s1	MNKHAAOLWRLKCW-WWMYMODYSA-N	442.258005608							95930
BRD-K49345388	LSM-7487		54618616	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19-,25+/m0/s1	ZMBSZSRZHSICHB-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)c4ccc(F)cc4	BroadT	BRD-K49345388	BRD-K49345388-001-01-7	Broad Institute of MIT and Harvard	BRD-K49345388			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1ccc(F)cc1	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19-,25+/m0/s1	ZMBSZSRZHSICHB-XHNVNVPESA-N	506.232933712							96108
BRD-K97959949	LSM-8087		54618684	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20-,25+/m0/s1	DGMJKRBCRMVRNT-ZYLNGJIFSA-N	CC(C)CC#Cc1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K97959949	BRD-K97959949-001-01-8	Broad Institute of MIT and Harvard	BRD-K97959949			CC(C)CC#Cc1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20-,25+/m0/s1	DGMJKRBCRMVRNT-ZYLNGJIFSA-N	495.253334798							96708
BRD-K56945633	LSM-7596		54618641	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19+,25-/m0/s1	KAJKYFHMOFZFFV-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K56945633	BRD-K56945633-001-01-7	Broad Institute of MIT and Harvard	BRD-K56945633			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19+,25-/m0/s1	KAJKYFHMOFZFFV-CEYNDMKZSA-N	516.209421066							96217
BRD-K52032805	LSM-7519		54618483	InChI=1S/C24H33FN2O4S/c1-5-11-26(4)15-23-17(2)14-27(18(3)16-28)32(29,30)24-10-9-20(13-22(24)31-23)19-7-6-8-21(25)12-19/h6-10,12-13,17-18,23,28H,5,11,14-16H2,1-4H3/t17-,18-,23-/m0/s1	BJNIKYIOOVPCTN-BSRJHKFKSA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3cccc(F)c3	BroadT	BRD-K52032805	BRD-K52032805-001-01-0	Broad Institute of MIT and Harvard	BRD-K52032805			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1cccc(F)c1	InChI=1S/C24H33FN2O4S/c1-5-11-26(4)15-23-17(2)14-27(18(3)16-28)32(29,30)24-10-9-20(13-22(24)31-23)19-7-6-8-21(25)12-19/h6-10,12-13,17-18,23,28H,5,11,14-16H2,1-4H3/t17-,18-,23-/m0/s1	BJNIKYIOOVPCTN-BSRJHKFKSA-N	464.214506446							96140
BRD-K61070477	LSM-7663		54618492	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18-,25-/m0/s1	PGLSEMLPCXRKER-RPPIVITFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(cc4C1=O)C5=CCCC5	BroadT	BRD-K61070477	BRD-K61070477-001-01-6	Broad Institute of MIT and Harvard	BRD-K61070477			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18-,25-/m0/s1	PGLSEMLPCXRKER-RPPIVITFSA-N	507.236935806							96284
BRD-K59551872	LSM-7636		54618644	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22-,29-/m1/s1	CBOPBGRHGQIOTR-IEOSBIPESA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)c4cccc(c4)C(=O)N(C)C)cc1	BroadT	BRD-K59551872	BRD-K59551872-001-01-0	Broad Institute of MIT and Harvard	BRD-K59551872			COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)-c2cccc(c2)C(=O)N(C)C)cc1	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22-,29-/m1/s1	CBOPBGRHGQIOTR-IEOSBIPESA-N	624.26177035							96257
BRD-K80649837	LSM-7900		54618451	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19-,25+/m1/s1	KAJKYFHMOFZFFV-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K80649837	BRD-K80649837-001-01-9	Broad Institute of MIT and Harvard	BRD-K80649837			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19-,25+/m1/s1	KAJKYFHMOFZFFV-RRQZXNHTSA-N	516.209421066							96521
BRD-K92748025	LSM-8028		54618640	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22-/m1/s1	OBRGIGMGBKKHMR-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccccn3	BroadT	BRD-K92748025	BRD-K92748025-001-01-7	Broad Institute of MIT and Harvard	BRD-K92748025			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccn1	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22-/m1/s1	OBRGIGMGBKKHMR-KGVIQGDOSA-N	443.187877128							96649
BRD-K23506413	LSM-7157		54618463	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19-,23-/m0/s1	UDDMVFRUSJXUEW-YDHSSHFGSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc3cccnc3	BroadT	BRD-K23506413	BRD-K23506413-001-01-3	Broad Institute of MIT and Harvard	BRD-K23506413			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc1cccnc1	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19-,23-/m0/s1	UDDMVFRUSJXUEW-YDHSSHFGSA-N	501.193356432							95778
BRD-K90146121	LSM-7997		54618418	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19+,23+/m0/s1	AEYCXANGZGGWKX-PABYOWBDSA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K90146121	BRD-K90146121-001-01-9	Broad Institute of MIT and Harvard	BRD-K90146121			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19+,23+/m0/s1	AEYCXANGZGGWKX-PABYOWBDSA-N	459.273321314							96618
BRD-K60056908	LSM-7643		54618438	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16+,19+/m0/s1	KFBFJFZZVCOITQ-FRQCXROJSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K60056908	BRD-K60056908-001-01-5	Broad Institute of MIT and Harvard	BRD-K60056908			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)(C)O	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16+,19+/m0/s1	KFBFJFZZVCOITQ-FRQCXROJSA-N	447.236935806							96264
CHEMBL2355494	LSM-7404	BRD-K43966462, SID131413752	54618657	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21-,27+/m0/s1	PIKMQEDGBFJLCE-NOMHHCBYSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)C4=CCCCC4	BroadT	BRD-K43966462	BRD-K43966462-001-01-5	Broad Institute of MIT and Harvard	BRD-K43966462			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C1=CCCCC1	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21-,27+/m0/s1	PIKMQEDGBFJLCE-NOMHHCBYSA-N	578.212042956							96025
BRD-K69805180	LSM-7781		54618504	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20-,26+/m0/s1	XRFBPINVKMLPSW-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K69805180	BRD-K69805180-001-01-5	Broad Institute of MIT and Harvard	BRD-K69805180			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20-,26+/m0/s1	XRFBPINVKMLPSW-CUVVAGTFSA-N	545.26381927							96402
CHEMBL2131671	LSM-43357	BRD-K02882069, SID131413598	54618509	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19-,23+/m1/s1	JSQMQZOUAVKGAV-PDDCTVJXSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K02882069	BRD-K02882069-001-01-0	Broad Institute of MIT and Harvard	BRD-K02882069			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19-,23+/m1/s1	JSQMQZOUAVKGAV-PDDCTVJXSA-N	487.214091876							
BRD-K61208213	LSM-7664		54618549	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17-,21+/m0/s1	MNKHAAOLWRLKCW-XGHQBKJUSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC3CC3	BroadT	BRD-K61208213	BRD-K61208213-001-01-1	Broad Institute of MIT and Harvard	BRD-K61208213			CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC1CC1	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17-,21+/m0/s1	MNKHAAOLWRLKCW-XGHQBKJUSA-N	442.258005608							96285
CHEMBL2362082	LSM-8063	BRD-K94882528, SID131413703	54618608	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21-,27-/m1/s1	PIKMQEDGBFJLCE-LGVUCKNBSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C4=CCCCC4	BroadT	BRD-K94882528	BRD-K94882528-001-01-4	Broad Institute of MIT and Harvard	BRD-K94882528			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C1=CCCCC1	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21-,27-/m1/s1	PIKMQEDGBFJLCE-LGVUCKNBSA-N	578.212042956							96684
BRD-K26214776	LSM-7179		54618653	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18-,22-/m0/s1	SVKJOHOIDWZOJW-SPEDKVCISA-N	CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3	BroadT	BRD-K26214776	BRD-K26214776-001-01-2	Broad Institute of MIT and Harvard	BRD-K26214776			CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18-,22-/m0/s1	SVKJOHOIDWZOJW-SPEDKVCISA-N	411.252191946							95800
BRD-K12834930	LSM-7021		54618605	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19-,24-/m1/s1	HVXCQDGXUZNQFT-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC(C)(C)O	BroadT	BRD-K12834930	BRD-K12834930-001-01-6	Broad Institute of MIT and Harvard	BRD-K12834930			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC(C)(C)O	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19-,24-/m1/s1	HVXCQDGXUZNQFT-KHCICDEESA-N	483.253334798							95642
BRD-K86023266	LSM-7948		54618685	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20+,25-/m1/s1	MNWVVWQDNRNIMM-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K86023266	BRD-K86023266-001-01-1	Broad Institute of MIT and Harvard	BRD-K86023266			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20+,25-/m1/s1	MNWVVWQDNRNIMM-OHUGHZGNSA-N	567.187305418							96569
BRD-K30357474	LSM-7240		54618401	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17+,21+/m0/s1	MNKHAAOLWRLKCW-CSODHUTKSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC3CC3	BroadT	BRD-K30357474	BRD-K30357474-001-01-8	Broad Institute of MIT and Harvard	BRD-K30357474			CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC1CC1	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17+,21+/m0/s1	MNKHAAOLWRLKCW-CSODHUTKSA-N	442.258005608							95861
BRD-K59174091	LSM-7631		54618679	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20-,25-/m0/s1	GCPZFZZKEDFKSA-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K59174091	BRD-K59174091-001-01-6	Broad Institute of MIT and Harvard	BRD-K59174091			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20-,25-/m0/s1	GCPZFZZKEDFKSA-RLSLOFABSA-N	500.234492962							96252
CHEMBL2144846	LSM-7225	BRD-K29290722, SID131413704	54618609	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23-,30+/m1/s1	ANXFQERLRQGOSV-JWUQWVJQSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ncc(cc4C1=O)c5cncnc5	BroadT	BRD-K29290722	BRD-K29290722-001-01-4	Broad Institute of MIT and Harvard	BRD-K29290722			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23-,30+/m1/s1	ANXFQERLRQGOSV-JWUQWVJQSA-N	553.26890465							95846
CHEMBL2361997	LSM-43438	BRD-K95688283, SID103910805	49835843	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22+,28+/m1/s1	RWAKEFQIDXFPPV-KIVNEEFJSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K95688283	BRD-K95688283-001-01-9	Broad Institute of MIT and Harvard	BRD-K95688283			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22+,28+/m1/s1	RWAKEFQIDXFPPV-KIVNEEFJSA-N	565.22465656							
BRD-K72623425	LSM-7803		54618533	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16-,19+/m0/s1	KFBFJFZZVCOITQ-TXPKVOOTSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K72623425	BRD-K72623425-001-01-2	Broad Institute of MIT and Harvard	BRD-K72623425			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC(C)(C)O	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16-,19+/m0/s1	KFBFJFZZVCOITQ-TXPKVOOTSA-N	447.236935806							96424
BRD-K10385416	LSM-6986		54618553	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19+,23+/m1/s1	AEYCXANGZGGWKX-XQQXVUDOSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K10385416	BRD-K10385416-001-01-4	Broad Institute of MIT and Harvard	BRD-K10385416			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19+,23+/m1/s1	AEYCXANGZGGWKX-XQQXVUDOSA-N	459.273321314							95607
BRD-K92639644	LSM-8024		54618501	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23+,28+/m0/s1	NJKSHKHIQBEBBM-SXDGJLEOSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@H](CN(C)C(=O)CN4CCOCC4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K92639644	BRD-K92639644-001-01-9	Broad Institute of MIT and Harvard	BRD-K92639644			COc1ccc(cc1)C#Cc1ccc2c(O[C@H](CN(C)C(=O)CN3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23+,28+/m0/s1	NJKSHKHIQBEBBM-SXDGJLEOSA-N	585.250871308							96645
BRD-K26449125	LSM-7184		54618467	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19-,23-/m1/s1	XXZIILLLBOPLBY-FZONSQQESA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K26449125	BRD-K26449125-001-01-2	Broad Institute of MIT and Harvard	BRD-K26449125			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19-,23-/m1/s1	XXZIILLLBOPLBY-FZONSQQESA-N	480.237270164							95805
BRD-K00278564	LSM-6864		54618511	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21+,27-/m1/s1	SOBUUYUTYHYENZ-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccc4F	BroadT	BRD-K00278564	BRD-K00278564-001-01-3	Broad Institute of MIT and Harvard	BRD-K00278564			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccc1F	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21+,27-/m1/s1	SOBUUYUTYHYENZ-PBDKAQRYSA-N	521.268984862							95485
BRD-K20806847	LSM-7121		54618552	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20+,25+/m0/s1	DGMJKRBCRMVRNT-WZOHSFFVSA-N	CC(C)CC#Cc1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K20806847	BRD-K20806847-001-01-6	Broad Institute of MIT and Harvard	BRD-K20806847			CC(C)CC#Cc1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20+,25+/m0/s1	DGMJKRBCRMVRNT-WZOHSFFVSA-N	495.253334798							95742
BRD-K77422873	LSM-7855		54618591	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19-,23-/m0/s1	XXZIILLLBOPLBY-KGYLXKDPSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K77422873	BRD-K77422873-001-01-1	Broad Institute of MIT and Harvard	BRD-K77422873			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19-,23-/m0/s1	XXZIILLLBOPLBY-KGYLXKDPSA-N	480.237270164							96476
BRD-K33518436	LSM-7278		54618397	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19+,25+/m0/s1	ZMBSZSRZHSICHB-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)c4ccc(F)cc4	BroadT	BRD-K33518436	BRD-K33518436-001-01-9	Broad Institute of MIT and Harvard	BRD-K33518436			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1ccc(F)cc1	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19+,25+/m0/s1	ZMBSZSRZHSICHB-OSWQYVSFSA-N	506.232933712							95899
BRD-K58775116	LSM-7627		54618402	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19-,23+/m0/s1	XXZIILLLBOPLBY-KEXUJGGDSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K58775116	BRD-K58775116-001-01-2	Broad Institute of MIT and Harvard	BRD-K58775116			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19-,23+/m0/s1	XXZIILLLBOPLBY-KEXUJGGDSA-N	480.237270164							96248
BRD-K62442112	LSM-7679		54618427	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22-/m1/s1	OBRGIGMGBKKHMR-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccccn3	BroadT	BRD-K62442112	BRD-K62442112-001-01-7	Broad Institute of MIT and Harvard	BRD-K62442112			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccn1	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22-/m1/s1	OBRGIGMGBKKHMR-JBYIUTFZSA-N	443.187877128							96300
BRD-K74962003	LSM-7823		54618471	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21+,27-/m0/s1	RIEPFGYATXCXRE-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K74962003	BRD-K74962003-001-01-2	Broad Institute of MIT and Harvard	BRD-K74962003			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21+,27-/m0/s1	RIEPFGYATXCXRE-ISCCLHIJSA-N	555.220320108							96444
BRD-K67209190	LSM-7744		54618526	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21-,27+/m1/s1	RIEPFGYATXCXRE-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K67209190	BRD-K67209190-001-01-0	Broad Institute of MIT and Harvard	BRD-K67209190			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21-,27+/m1/s1	RIEPFGYATXCXRE-GNMOFYLKSA-N	555.220320108							96365
CHEMBL2145237	LSM-7779	BRD-K69697800, SID131413576	54618487	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21-,27-/m0/s1	RIEPFGYATXCXRE-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K69697800	BRD-K69697800-001-01-6	Broad Institute of MIT and Harvard	BRD-K69697800			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21-,27-/m0/s1	RIEPFGYATXCXRE-IZVMNLJQSA-N	555.220320108							96400
BRD-K91898214	LSM-8013		54618419	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19-,25-/m0/s1	ZMBSZSRZHSICHB-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)c4ccc(F)cc4	BroadT	BRD-K91898214	BRD-K91898214-001-01-2	Broad Institute of MIT and Harvard	BRD-K91898214			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1ccc(F)cc1	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19-,25-/m0/s1	ZMBSZSRZHSICHB-MHPIHPPYSA-N	506.232933712							96634
BRD-K07581216	LSM-6957		54618448	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21+,25+/m1/s1	UDLZIJJYMLYVSF-CZSZKKDXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K07581216	BRD-K07581216-001-01-5	Broad Institute of MIT and Harvard	BRD-K07581216			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21+,25+/m1/s1	UDLZIJJYMLYVSF-CZSZKKDXSA-N	519.276692132							95578
BRD-K25125608	LSM-7169		54618532	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20+,25+/m0/s1	MNWVVWQDNRNIMM-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K25125608	BRD-K25125608-001-01-5	Broad Institute of MIT and Harvard	BRD-K25125608			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20+,25+/m0/s1	MNWVVWQDNRNIMM-WZOHSFFVSA-N	567.187305418							95790
BRD-K79275879	LSM-7889		54618449	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20+,27+/m1/s1	KSASPYMRGHUFQD-JVAFGIKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccc(F)cc4	BroadT	BRD-K79275879	BRD-K79275879-001-01-5	Broad Institute of MIT and Harvard	BRD-K79275879			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20+,27+/m1/s1	KSASPYMRGHUFQD-JVAFGIKQSA-N	556.204335686							96510
BRD-K31439714	LSM-43386		54618544	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19-,23-/m0/s1	JSQMQZOUAVKGAV-LTKLHKGWSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K31439714	BRD-K31439714-001-01-3	Broad Institute of MIT and Harvard	BRD-K31439714			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19-,23-/m0/s1	JSQMQZOUAVKGAV-LTKLHKGWSA-N	487.214091876							
BRD-K03995514	LSM-6913		54618434	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19-,23-/m0/s1	AEYCXANGZGGWKX-KGYLXKDPSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K03995514	BRD-K03995514-001-01-0	Broad Institute of MIT and Harvard	BRD-K03995514			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19-,23-/m0/s1	AEYCXANGZGGWKX-KGYLXKDPSA-N	459.273321314							95534
BRD-K90445273	LSM-7998		54618522	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21+,27+/m0/s1	RIEPFGYATXCXRE-FYQCMVGJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K90445273	BRD-K90445273-001-01-1	Broad Institute of MIT and Harvard	BRD-K90445273			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21+,27+/m0/s1	RIEPFGYATXCXRE-FYQCMVGJSA-N	555.220320108							96619
BRD-K57009782	LSM-7598		54618689	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19+,24-/m0/s1	DUJQZBWFZFXOJW-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K57009782	BRD-K57009782-001-01-0	Broad Institute of MIT and Harvard	BRD-K57009782			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19+,24-/m0/s1	DUJQZBWFZFXOJW-GLDPYIMESA-N	465.26275663							96219
BRD-K78603235-001-01-8	LSM-7875	BRD-K78603235	44488725	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18+,22-/m0/s1	SVKJOHOIDWZOJW-SVMVAKDDSA-N	CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3	BroadT	BRD-K78603235	BRD-K78603235-001-02-6	Broad Institute of MIT and Harvard	BRD-K78603235			CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18+,22-/m0/s1	SVKJOHOIDWZOJW-SVMVAKDDSA-N	411.252191946							96496
BRD-K14678536	LSM-7050		44506101	InChI=1S/C29H30FN3O6S/c1-18-15-33(19(2)17-34)29(35)24-11-21(26-12-20-7-4-5-10-25(20)38-26)14-31-28(24)39-27(18)16-32(3)40(36,37)23-9-6-8-22(30)13-23/h4-14,18-19,27,34H,15-17H2,1-3H3/t18-,19+,27-/m0/s1	CQNONDRQNRMLFE-CUMRGQLISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)c4oc5ccccc5c4	BroadT	BRD-K14678536	BRD-K14678536-001-01-3	Broad Institute of MIT and Harvard	BRD-K14678536			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)-c1cc2ccccc2o1	InChI=1S/C29H30FN3O6S/c1-18-15-33(19(2)17-34)29(35)24-11-21(26-12-20-7-4-5-10-25(20)38-26)14-31-28(24)39-27(18)16-32(3)40(36,37)23-9-6-8-22(30)13-23/h4-14,18-19,27,34H,15-17H2,1-3H3/t18-,19+,27-/m0/s1	CQNONDRQNRMLFE-CUMRGQLISA-N	567.1839346							95671
BRD-K69349639	LSM-7773		54618690	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20+,25+/m0/s1	IXCMNLOSFSWDKI-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K69349639	BRD-K69349639-001-01-1	Broad Institute of MIT and Harvard	BRD-K69349639			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20+,25+/m0/s1	IXCMNLOSFSWDKI-WZOHSFFVSA-N	503.245392004							96394
BRD-K31036503	LSM-7251		54618572	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21-,26-/m0/s1	GVDJVSBPXRZCOM-WOVHNISZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K31036503	BRD-K31036503-001-01-2	Broad Institute of MIT and Harvard	BRD-K31036503			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21-,26-/m0/s1	GVDJVSBPXRZCOM-WOVHNISZSA-N	512.245726362							95872
BRD-K38589316	LSM-7342		54618573	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23+,28+/m1/s1	NJKSHKHIQBEBBM-IWHLBADBSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@@H](CN(C)C(=O)CN4CCOCC4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K38589316	BRD-K38589316-001-01-0	Broad Institute of MIT and Harvard	BRD-K38589316			COc1ccc(cc1)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)CN3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23+,28+/m1/s1	NJKSHKHIQBEBBM-IWHLBADBSA-N	585.250871308							95963
BRD-K80694691	LSM-7901		54618620	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18-,22-/m1/s1	SVKJOHOIDWZOJW-JBYIUTFZSA-N	CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3	BroadT	BRD-K80694691	BRD-K80694691-001-01-0	Broad Institute of MIT and Harvard	BRD-K80694691			CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18-,22-/m1/s1	SVKJOHOIDWZOJW-JBYIUTFZSA-N	411.252191946							96522
BRD-K35152204	LSM-7298		54618424	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19-,24-/m0/s1	DUJQZBWFZFXOJW-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K35152204	BRD-K35152204-001-01-5	Broad Institute of MIT and Harvard	BRD-K35152204			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19-,24-/m0/s1	DUJQZBWFZFXOJW-JXQFQVJHSA-N	465.26275663							95919
BRD-K36333904	LSM-7314		54618656	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19-,25+/m0/s1	KAJKYFHMOFZFFV-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K36333904	BRD-K36333904-001-01-3	Broad Institute of MIT and Harvard	BRD-K36333904			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19-,25+/m0/s1	KAJKYFHMOFZFFV-XHNVNVPESA-N	516.209421066							95935
BRD-K64979177	LSM-7715		54618412	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19+,23-/m1/s1	XXZIILLLBOPLBY-GKAYAJSDSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K64979177	BRD-K64979177-001-01-8	Broad Institute of MIT and Harvard	BRD-K64979177			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19+,23-/m1/s1	XXZIILLLBOPLBY-GKAYAJSDSA-N	480.237270164							96336
BRD-K23304679	LSM-7153		54618503	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22-,29+/m1/s1	CBOPBGRHGQIOTR-QLVXXPONSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)c4cccc(c4)C(=O)N(C)C)cc1	BroadT	BRD-K23304679	BRD-K23304679-001-01-2	Broad Institute of MIT and Harvard	BRD-K23304679			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)-c2cccc(c2)C(=O)N(C)C)cc1	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22-,29+/m1/s1	CBOPBGRHGQIOTR-QLVXXPONSA-N	624.26177035							95774
BRD-K99691991	LSM-8099		54618528	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19+,23+/m0/s1	UDDMVFRUSJXUEW-YCRNBWNJSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc3cccnc3	BroadT	BRD-K99691991	BRD-K99691991-001-01-2	Broad Institute of MIT and Harvard	BRD-K99691991			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc1cccnc1	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19+,23+/m0/s1	UDDMVFRUSJXUEW-YCRNBWNJSA-N	501.193356432							96720
BRD-K82367827	LSM-7913		54618550	InChI=1S/C29H38N4O3/c1-20-16-33(21(2)19-34)29(35)26-13-25(24-11-9-22(14-30)10-12-24)15-31-28(26)36-27(20)18-32(3)17-23-7-5-4-6-8-23/h9-13,15,20-21,23,27,34H,4-8,16-19H2,1-3H3/t20-,21-,27+/m0/s1	GKYOEOUZTXHXGV-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K82367827	BRD-K82367827-001-01-8	Broad Institute of MIT and Harvard	BRD-K82367827			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C29H38N4O3/c1-20-16-33(21(2)19-34)29(35)26-13-25(24-11-9-22(14-30)10-12-24)15-31-28(26)36-27(20)18-32(3)17-23-7-5-4-6-8-23/h9-13,15,20-21,23,27,34H,4-8,16-19H2,1-3H3/t20-,21-,27+/m0/s1	GKYOEOUZTXHXGV-NOMHHCBYSA-N	490.294391116							96534
BRD-K42357106	LSM-7386		54618407	InChI=1S/C29H38N4O3/c1-20-16-33(21(2)19-34)29(35)26-13-25(24-11-9-22(14-30)10-12-24)15-31-28(26)36-27(20)18-32(3)17-23-7-5-4-6-8-23/h9-13,15,20-21,23,27,34H,4-8,16-19H2,1-3H3/t20-,21+,27+/m1/s1	GKYOEOUZTXHXGV-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K42357106	BRD-K42357106-001-01-0	Broad Institute of MIT and Harvard	BRD-K42357106			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C29H38N4O3/c1-20-16-33(21(2)19-34)29(35)26-13-25(24-11-9-22(14-30)10-12-24)15-31-28(26)36-27(20)18-32(3)17-23-7-5-4-6-8-23/h9-13,15,20-21,23,27,34H,4-8,16-19H2,1-3H3/t20-,21+,27+/m1/s1	GKYOEOUZTXHXGV-BUEREQSYSA-N	490.294391116							96007
BRD-K57690336	LSM-7615		54618508	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19-,23-/m0/s1	AEYCXANGZGGWKX-YWNPBTLJSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K57690336	BRD-K57690336-001-01-8	Broad Institute of MIT and Harvard	BRD-K57690336			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19-,23-/m0/s1	AEYCXANGZGGWKX-YWNPBTLJSA-N	459.273321314							96236
BRD-K46663433	LSM-7442		54618536	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20-,26-/m1/s1	XRFBPINVKMLPSW-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K46663433	BRD-K46663433-001-01-1	Broad Institute of MIT and Harvard	BRD-K46663433			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20-,26-/m1/s1	XRFBPINVKMLPSW-XMERXJNXSA-N	545.26381927							96063
CHEMBL2134936	LSM-7862	SID131413584, BRD-K77924862	54618495	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23+,28-/m1/s1	NJKSHKHIQBEBBM-AWVRMFGXSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@H](CN(C)C(=O)CN4CCOCC4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K77924862	BRD-K77924862-001-01-9	Broad Institute of MIT and Harvard	BRD-K77924862			COc1ccc(cc1)C#Cc1ccc2c(O[C@H](CN(C)C(=O)CN3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23+,28-/m1/s1	NJKSHKHIQBEBBM-AWVRMFGXSA-N	585.250871308							96483
BRD-K54789622	LSM-7567		54618543	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20+,25-/m0/s1	RZEXHRSKTOKTQU-DFIYOIEZSA-N	COc1ccccc1C#Cc2cnc3O[C@@H](CN(C)S(=O)(=O)c4cn(C)cn4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K54789622	BRD-K54789622-001-01-4	Broad Institute of MIT and Harvard	BRD-K54789622			COc1ccccc1C#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20+,25-/m0/s1	RZEXHRSKTOKTQU-DFIYOIEZSA-N	567.215154516							96188
BRD-K86762131	LSM-7959		54618396	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19-,23-/m0/s1	XXZIILLLBOPLBY-YWNPBTLJSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K86762131	BRD-K86762131-001-01-7	Broad Institute of MIT and Harvard	BRD-K86762131			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19-,23-/m0/s1	XXZIILLLBOPLBY-YWNPBTLJSA-N	480.237270164							96580
BRD-K26759399	LSM-7187		54618629	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20+,25-/m1/s1	ZRJLNIRQYSTGIF-OHUGHZGNSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3F)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K26759399	BRD-K26759399-001-01-3	Broad Institute of MIT and Harvard	BRD-K26759399			CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3F)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20+,25-/m1/s1	ZRJLNIRQYSTGIF-OHUGHZGNSA-N	531.220320108							95808
BRD-K28394201	LSM-43381		54618457	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17+,22+/m1/s1	DRXNQUOVPOKVMH-XMYDELFSSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K28394201	BRD-K28394201-001-01-5	Broad Institute of MIT and Harvard	BRD-K28394201			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17+,22+/m1/s1	DRXNQUOVPOKVMH-XMYDELFSSA-N	470.232933712							
BRD-K62780697	LSM-7688		54618446	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19+,24+/m0/s1	HVXCQDGXUZNQFT-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC(C)(C)O	BroadT	BRD-K62780697	BRD-K62780697-001-01-3	Broad Institute of MIT and Harvard	BRD-K62780697			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC(C)(C)O	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19+,24+/m0/s1	HVXCQDGXUZNQFT-XLNZFTOWSA-N	483.253334798							96309
BRD-K31096204	LSM-7254		54618652	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21+,25+/m0/s1	UDLZIJJYMLYVSF-BPYKYCOYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K31096204	BRD-K31096204-001-01-8	Broad Institute of MIT and Harvard	BRD-K31096204			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21+,25+/m0/s1	UDLZIJJYMLYVSF-BPYKYCOYSA-N	519.276692132							95875
BRD-K31786211	LSM-7261		54618491	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20-,27+/m1/s1	YBZIDMTZSSULOY-DVHCVUMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5ccccc5	BroadT	BRD-K31786211	BRD-K31786211-001-01-5	Broad Institute of MIT and Harvard	BRD-K31786211			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20-,27+/m1/s1	YBZIDMTZSSULOY-DVHCVUMVSA-N	552.193022074							95882
BRD-K40321450	LSM-7362		54618404	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19-,24+/m0/s1	DUJQZBWFZFXOJW-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K40321450	BRD-K40321450-001-01-0	Broad Institute of MIT and Harvard	BRD-K40321450			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19-,24+/m0/s1	DUJQZBWFZFXOJW-AXHZCLLHSA-N	465.26275663							95983
BRD-K12815005	LSM-7020		54618560	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21-,26+/m0/s1	GVDJVSBPXRZCOM-ISJBWFOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K12815005	BRD-K12815005-001-01-5	Broad Institute of MIT and Harvard	BRD-K12815005			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21-,26+/m0/s1	GVDJVSBPXRZCOM-ISJBWFOZSA-N	512.245726362							95641
BRD-K87087278	LSM-7965		54618514	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22-,29+/m0/s1	CBOPBGRHGQIOTR-IHMCZWCLSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)c4cccc(c4)C(=O)N(C)C)cc1	BroadT	BRD-K87087278	BRD-K87087278-001-01-1	Broad Institute of MIT and Harvard	BRD-K87087278			COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)-c2cccc(c2)C(=O)N(C)C)cc1	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22-,29+/m0/s1	CBOPBGRHGQIOTR-IHMCZWCLSA-N	624.26177035							96586
BRD-K78812164	LSM-43428		49835833	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22-,28+/m1/s1	RWAKEFQIDXFPPV-BRBGUMIPSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K78812164	BRD-K78812164-001-01-0	Broad Institute of MIT and Harvard	BRD-K78812164			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22-,28+/m1/s1	RWAKEFQIDXFPPV-BRBGUMIPSA-N	565.22465656							
BRD-K32796290	LSM-7271		54618458	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21+,25-/m1/s1	UDLZIJJYMLYVSF-TYBLODHISA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K32796290	BRD-K32796290-001-01-7	Broad Institute of MIT and Harvard	BRD-K32796290			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21+,25-/m1/s1	UDLZIJJYMLYVSF-TYBLODHISA-N	519.276692132							95892
BRD-K14131832	LSM-7038		54618672	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22-/m0/s1	OBRGIGMGBKKHMR-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccccn3	BroadT	BRD-K14131832	BRD-K14131832-001-01-4	Broad Institute of MIT and Harvard	BRD-K14131832			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccn1	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22-/m0/s1	OBRGIGMGBKKHMR-SPEDKVCISA-N	443.187877128							95659
BRD-K68311329	LSM-7761		54618461	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18+,25+/m0/s1	PGLSEMLPCXRKER-YYULODDRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(cc4C1=O)C5=CCCC5	BroadT	BRD-K68311329	BRD-K68311329-001-01-7	Broad Institute of MIT and Harvard	BRD-K68311329			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18+,25+/m0/s1	PGLSEMLPCXRKER-YYULODDRSA-N	507.236935806							96382
BRD-K37090607	LSM-7322		54618442	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23+,30-/m0/s1	ANXFQERLRQGOSV-BURCIIJTSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ncc(cc4C1=O)c5cncnc5	BroadT	BRD-K37090607	BRD-K37090607-001-01-8	Broad Institute of MIT and Harvard	BRD-K37090607			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23+,30-/m0/s1	ANXFQERLRQGOSV-BURCIIJTSA-N	553.26890465							95943
BRD-K93549834	LSM-8044		54618435	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20-,25-/m1/s1	ZRJLNIRQYSTGIF-UMEGOILYSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K93549834	BRD-K93549834-001-01-9	Broad Institute of MIT and Harvard	BRD-K93549834			CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20-,25-/m1/s1	ZRJLNIRQYSTGIF-UMEGOILYSA-N	531.220320108							96665
CHEMBL2130662	LSM-7279	SID131413782, BRD-K33575007	54618683	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20+,27-/m1/s1	YBZIDMTZSSULOY-IOKPGSKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5ccccc5	BroadT	BRD-K33575007	BRD-K33575007-001-01-8	Broad Institute of MIT and Harvard	BRD-K33575007			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20+,27-/m1/s1	YBZIDMTZSSULOY-IOKPGSKQSA-N	552.193022074							95900
MLS003129983	LSM-7266	BRD-K32099399, SID99358525	46903353	InChI=1S/C23H27BrF3N3O5S/c1-14-11-30(15(2)13-31)36(33,34)21-9-6-17(24)10-19(21)35-20(14)12-29(3)22(32)28-18-7-4-16(5-8-18)23(25,26)27/h4-10,14-15,20,31H,11-13H2,1-3H3,(H,28,32)/t14-,15+,20+/m1/s1	YXMZKKBYJQSMSA-SIFCLUCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K32099399	BRD-K32099399-001-01-6	Broad Institute of MIT and Harvard	BRD-K32099399			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C23H27BrF3N3O5S/c1-14-11-30(15(2)13-31)36(33,34)21-9-6-17(24)10-19(21)35-20(14)12-29(3)22(32)28-18-7-4-16(5-8-18)23(25,26)27/h4-10,14-15,20,31H,11-13H2,1-3H3,(H,28,32)/t14-,15+,20+/m1/s1	YXMZKKBYJQSMSA-SIFCLUCFSA-N	593.080688884							95887
BRD-K22801678	LSM-43378		54618548	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22-,28-/m1/s1	RWAKEFQIDXFPPV-FJJQBDJBSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K22801678	BRD-K22801678-001-01-9	Broad Institute of MIT and Harvard	BRD-K22801678			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22-,28-/m1/s1	RWAKEFQIDXFPPV-FJJQBDJBSA-N	565.22465656							
BRD-K81859633	LSM-7911		54618664	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19-,25+/m1/s1	ZMBSZSRZHSICHB-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)c4ccc(F)cc4	BroadT	BRD-K81859633	BRD-K81859633-001-01-9	Broad Institute of MIT and Harvard	BRD-K81859633			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1ccc(F)cc1	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19-,25+/m1/s1	ZMBSZSRZHSICHB-RRQZXNHTSA-N	506.232933712							96532
BRD-K99192901	LSM-8096		54618497	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21+,26-/m1/s1	GVDJVSBPXRZCOM-YZIHRLCOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K99192901	BRD-K99192901-001-01-0	Broad Institute of MIT and Harvard	BRD-K99192901			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21+,26-/m1/s1	GVDJVSBPXRZCOM-YZIHRLCOSA-N	512.245726362							96717
BRD-K79367755	LSM-7891		54618627	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20-,25+/m1/s1	MNWVVWQDNRNIMM-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K79367755	BRD-K79367755-001-01-9	Broad Institute of MIT and Harvard	BRD-K79367755			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20-,25+/m1/s1	MNWVVWQDNRNIMM-FHAGJXEFSA-N	567.187305418							96512
BRD-K83435763	LSM-7922		54618678	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20-,26-/m0/s1	XRFBPINVKMLPSW-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K83435763	BRD-K83435763-001-01-8	Broad Institute of MIT and Harvard	BRD-K83435763			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20-,26-/m0/s1	XRFBPINVKMLPSW-DYLHXGEVSA-N	545.26381927							96543
BRD-K38051696	LSM-7339		54618540	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19-,23+/m0/s1	AEYCXANGZGGWKX-QPXQOZNCSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K38051696	BRD-K38051696-001-01-1	Broad Institute of MIT and Harvard	BRD-K38051696			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19-,23+/m0/s1	AEYCXANGZGGWKX-QPXQOZNCSA-N	459.273321314							95960
CHEMBL3185040	LSM-6974	BRD-K09244864	54618567	InChI=1S/C32H36N4O5S/c1-23-18-36(24(2)21-37)42(38,39)32-14-11-26(27-16-33-22-34-17-27)15-30(32)41-31(23)20-35(3)19-25-9-12-29(13-10-25)40-28-7-5-4-6-8-28/h4-17,22-24,31,37H,18-21H2,1-3H3/t23-,24+,31-/m1/s1	JYEISQCWLZSNSR-ULPIOCOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4cc(ccc4S1(=O)=O)c5cncnc5	BroadT	BRD-K09244864	BRD-K09244864-001-01-3	Broad Institute of MIT and Harvard	BRD-K09244864			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C32H36N4O5S/c1-23-18-36(24(2)21-37)42(38,39)32-14-11-26(27-16-33-22-34-17-27)15-30(32)41-31(23)20-35(3)19-25-9-12-29(13-10-25)40-28-7-5-4-6-8-28/h4-17,22-24,31,37H,18-21H2,1-3H3/t23-,24+,31-/m1/s1	JYEISQCWLZSNSR-ULPIOCOXSA-N	588.240640982							95595
BRD-K36702054	LSM-7316		54618621	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21-,25+/m1/s1	UDLZIJJYMLYVSF-OTPAQWSUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K36702054	BRD-K36702054-001-01-7	Broad Institute of MIT and Harvard	BRD-K36702054			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21-,25+/m1/s1	UDLZIJJYMLYVSF-OTPAQWSUSA-N	519.276692132							95937
MLS003129964	LSM-8001	BRD-K90849880, SID99358509	46903337	InChI=1S/C23H27BrF3N3O5S/c1-14-11-30(15(2)13-31)36(33,34)21-9-6-17(24)10-19(21)35-20(14)12-29(3)22(32)28-18-7-4-16(5-8-18)23(25,26)27/h4-10,14-15,20,31H,11-13H2,1-3H3,(H,28,32)/t14-,15-,20-/m1/s1	YXMZKKBYJQSMSA-STXHMFSFSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K90849880	BRD-K90849880-001-01-9	Broad Institute of MIT and Harvard	BRD-K90849880			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C23H27BrF3N3O5S/c1-14-11-30(15(2)13-31)36(33,34)21-9-6-17(24)10-19(21)35-20(14)12-29(3)22(32)28-18-7-4-16(5-8-18)23(25,26)27/h4-10,14-15,20,31H,11-13H2,1-3H3,(H,28,32)/t14-,15-,20-/m1/s1	YXMZKKBYJQSMSA-STXHMFSFSA-N	593.080688884							96622
BRD-K13719685	LSM-7033		54618574	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22-/m0/s1	OBRGIGMGBKKHMR-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccccn3	BroadT	BRD-K13719685	BRD-K13719685-001-01-5	Broad Institute of MIT and Harvard	BRD-K13719685			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccn1	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22-/m0/s1	OBRGIGMGBKKHMR-SVMVAKDDSA-N	443.187877128							95654
BRD-K01847595	LSM-6886		54618650	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17-,22+/m1/s1	YKCDBQLHOOFCLT-YVHKJVDXSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K01847595	BRD-K01847595-001-01-7	Broad Institute of MIT and Harvard	BRD-K01847595			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17-,22+/m1/s1	YKCDBQLHOOFCLT-YVHKJVDXSA-N	494.188685622							95507
BRD-K72980834	LSM-7807		54618539	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23-,30+/m0/s1	ANXFQERLRQGOSV-ZTNZZFSWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ncc(cc4C1=O)c5cncnc5	BroadT	BRD-K72980834	BRD-K72980834-001-01-1	Broad Institute of MIT and Harvard	BRD-K72980834			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23-,30+/m0/s1	ANXFQERLRQGOSV-ZTNZZFSWSA-N	553.26890465							96428
BRD-K49723079	LSM-7490		54618479	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19+,24-/m1/s1	HVXCQDGXUZNQFT-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC(C)(C)O	BroadT	BRD-K49723079	BRD-K49723079-001-01-9	Broad Institute of MIT and Harvard	BRD-K49723079			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC(C)(C)O	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19+,24-/m1/s1	HVXCQDGXUZNQFT-YDIMBITNSA-N	483.253334798							96111
BRD-K33894111	LSM-7286		54618688	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17+,22+/m1/s1	YKCDBQLHOOFCLT-JLHGSKIFSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K33894111	BRD-K33894111-001-01-6	Broad Institute of MIT and Harvard	BRD-K33894111			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17+,22+/m1/s1	YKCDBQLHOOFCLT-JLHGSKIFSA-N	494.188685622							95907
BRD-K53978628	LSM-7551		54618566	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20+,25+/m0/s1	ZRJLNIRQYSTGIF-WZOHSFFVSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3F)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K53978628	BRD-K53978628-001-01-8	Broad Institute of MIT and Harvard	BRD-K53978628			CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3F)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20+,25+/m0/s1	ZRJLNIRQYSTGIF-WZOHSFFVSA-N	531.220320108							96172
BRD-K78976513	LSM-7884		54618623	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20+,25-/m0/s1	MNWVVWQDNRNIMM-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K78976513	BRD-K78976513-001-01-1	Broad Institute of MIT and Harvard	BRD-K78976513			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20+,25-/m0/s1	MNWVVWQDNRNIMM-DFIYOIEZSA-N	567.187305418							96505
BRD-K98846091	LSM-8093		49835862	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20+,25+/m1/s1	RZEXHRSKTOKTQU-RNHFSVANSA-N	COc1ccccc1C#Cc2cnc3O[C@@H](CN(C)S(=O)(=O)c4cn(C)cn4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K98846091	BRD-K98846091-001-01-2	Broad Institute of MIT and Harvard	BRD-K98846091			COc1ccccc1C#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20+,25+/m1/s1	RZEXHRSKTOKTQU-RNHFSVANSA-N	567.215154516							96714
BRD-K68876477	LSM-7768		54618563	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17+,21+/m0/s1	YNLPQPKWJFYZTR-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K68876477	BRD-K68876477-001-01-9	Broad Institute of MIT and Harvard	BRD-K68876477			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17+,21+/m0/s1	YNLPQPKWJFYZTR-CSODHUTKSA-N	461.198441812							96389
BRD-K51803154	LSM-7517		54618466	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21+,29-/m1/s1	MIOBFWIJYZOKSQ-HNMNOHOESA-N	COc1ccccc1C#Cc2cnc3O[C@H](CN(C)C(=O)c4ccc5OCOc5c4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K51803154	BRD-K51803154-001-01-2	Broad Institute of MIT and Harvard	BRD-K51803154			COc1ccccc1C#Cc1cnc2O[C@H](CN(C)C(=O)c3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21+,29-/m1/s1	MIOBFWIJYZOKSQ-HNMNOHOESA-N	571.231850426							96138
BRD-K05111274	LSM-6925		54618416	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19-,24+/m1/s1	HVXCQDGXUZNQFT-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC(C)(C)O	BroadT	BRD-K05111274	BRD-K05111274-001-01-2	Broad Institute of MIT and Harvard	BRD-K05111274			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC(C)(C)O	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19-,24+/m1/s1	HVXCQDGXUZNQFT-IECBHUPTSA-N	483.253334798							95546
BRD-K86420846	LSM-7953		54618437	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22+,29+/m0/s1	CBOPBGRHGQIOTR-DKGMKSHISA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)c4cccc(c4)C(=O)N(C)C)cc1	BroadT	BRD-K86420846	BRD-K86420846-001-01-8	Broad Institute of MIT and Harvard	BRD-K86420846			COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)-c2cccc(c2)C(=O)N(C)C)cc1	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22+,29+/m0/s1	CBOPBGRHGQIOTR-DKGMKSHISA-N	624.26177035							96574
BRD-K14327282	LSM-7044		54618465	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21-,26-/m1/s1	GVDJVSBPXRZCOM-IPVFLDMMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K14327282	BRD-K14327282-001-01-3	Broad Institute of MIT and Harvard	BRD-K14327282			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21-,26-/m1/s1	GVDJVSBPXRZCOM-IPVFLDMMSA-N	512.245726362							95665
BRD-K30723822	LSM-7248		54618559	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19-,23-/m1/s1	AEYCXANGZGGWKX-ISJRUSPKSA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K30723822	BRD-K30723822-001-01-0	Broad Institute of MIT and Harvard	BRD-K30723822			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19-,23-/m1/s1	AEYCXANGZGGWKX-ISJRUSPKSA-N	459.273321314							95869
BRD-K36394966	LSM-7315		54618613	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18+,25+/m1/s1	PGLSEMLPCXRKER-UZEJHQAJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(cc4C1=O)C5=CCCC5	BroadT	BRD-K36394966	BRD-K36394966-001-01-0	Broad Institute of MIT and Harvard	BRD-K36394966			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18+,25+/m1/s1	PGLSEMLPCXRKER-UZEJHQAJSA-N	507.236935806							95936
CHEMBL2361927	LSM-7441	BRD-K46658587, SID131413695	54618600	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21+,26+/m0/s1	GVDJVSBPXRZCOM-LZCXECNNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K46658587	BRD-K46658587-001-01-5	Broad Institute of MIT and Harvard	BRD-K46658587			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21+,26+/m0/s1	GVDJVSBPXRZCOM-LZCXECNNSA-N	512.245726362							96062
CHEMBL3186205	LSM-7672	BRD-K61965677	54618443	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20-,25+/m1/s1	ZRJLNIRQYSTGIF-FHAGJXEFSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K61965677	BRD-K61965677-001-01-5	Broad Institute of MIT and Harvard	BRD-K61965677			CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20-,25+/m1/s1	ZRJLNIRQYSTGIF-FHAGJXEFSA-N	531.220320108							96293
BRD-K98803880	LSM-6858		54618470	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19-,23-/m1/s1	XXZIILLLBOPLBY-ISJRUSPKSA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K98803880	BRD-K98803880-001-01-8	Broad Institute of MIT and Harvard	BRD-K98803880			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19-,23-/m1/s1	XXZIILLLBOPLBY-ISJRUSPKSA-N	480.237270164							95479
BRD-K30857143	LSM-7250		54618493	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19+,25-/m1/s1	KAJKYFHMOFZFFV-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K30857143	BRD-K30857143-001-01-8	Broad Institute of MIT and Harvard	BRD-K30857143			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19+,25-/m1/s1	KAJKYFHMOFZFFV-HHJKRLRDSA-N	516.209421066							95871
BRD-K92372623	LSM-8021		54618584	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19+,23-/m0/s1	UDDMVFRUSJXUEW-YYDVJCTNSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc3cccnc3	BroadT	BRD-K92372623	BRD-K92372623-001-01-2	Broad Institute of MIT and Harvard	BRD-K92372623			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc1cccnc1	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19+,23-/m0/s1	UDDMVFRUSJXUEW-YYDVJCTNSA-N	501.193356432							96642
CHEMBL2355053	LSM-7872	BRD-K78380066, SID131413732	54618637	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20-,27-/m1/s1	KSASPYMRGHUFQD-SEXOINJZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccc(F)cc4	BroadT	BRD-K78380066	BRD-K78380066-001-01-7	Broad Institute of MIT and Harvard	BRD-K78380066			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20-,27-/m1/s1	KSASPYMRGHUFQD-SEXOINJZSA-N	556.204335686							96493
BRD-K53985154	LSM-7552		54618512	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22+,29+/m1/s1	CBOPBGRHGQIOTR-BXOOBUKZSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)c4cccc(c4)C(=O)N(C)C)cc1	BroadT	BRD-K53985154	BRD-K53985154-001-01-5	Broad Institute of MIT and Harvard	BRD-K53985154			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)-c2cccc(c2)C(=O)N(C)C)cc1	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22+,29+/m1/s1	CBOPBGRHGQIOTR-BXOOBUKZSA-N	624.26177035							96173
MLS003130058	LSM-7097	BRD-K19396909, SID131413637, SID99358642	46903421	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19-,23-/m1/s1	UDDMVFRUSJXUEW-DNVFCKCGSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc3cccnc3	BroadT	BRD-K19396909	BRD-K19396909-001-02-4	Broad Institute of MIT and Harvard	BRD-K19396909			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc1cccnc1	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19-,23-/m1/s1	UDDMVFRUSJXUEW-DNVFCKCGSA-N	501.193356432							95718
BRD-K29255825	LSM-7223		54618601	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18-,25+/m0/s1	PGLSEMLPCXRKER-DPOKWSEZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(cc4C1=O)C5=CCCC5	BroadT	BRD-K29255825	BRD-K29255825-001-01-3	Broad Institute of MIT and Harvard	BRD-K29255825			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18-,25+/m0/s1	PGLSEMLPCXRKER-DPOKWSEZSA-N	507.236935806							95844
BRD-K11400546	LSM-6994		54618579	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19+,23-/m1/s1	AEYCXANGZGGWKX-GKAYAJSDSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K11400546	BRD-K11400546-001-01-3	Broad Institute of MIT and Harvard	BRD-K11400546			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19+,23-/m1/s1	AEYCXANGZGGWKX-GKAYAJSDSA-N	459.273321314							95615
BRD-K68233995	LSM-7758		54618618	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18-,25-/m1/s1	PGLSEMLPCXRKER-QJMRKGMQSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(cc4C1=O)C5=CCCC5	BroadT	BRD-K68233995	BRD-K68233995-001-01-6	Broad Institute of MIT and Harvard	BRD-K68233995			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18-,25-/m1/s1	PGLSEMLPCXRKER-QJMRKGMQSA-N	507.236935806							96379
BRD-K33238309	LSM-7274		54618513	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20-,25-/m1/s1	DGMJKRBCRMVRNT-UMEGOILYSA-N	CC(C)CC#Cc1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K33238309	BRD-K33238309-001-01-8	Broad Institute of MIT and Harvard	BRD-K33238309			CC(C)CC#Cc1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20-,25-/m1/s1	DGMJKRBCRMVRNT-UMEGOILYSA-N	495.253334798							95895
BRD-K20019319	LSM-7112		54618484	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17+,22-/m0/s1	YKCDBQLHOOFCLT-JKSBSHDWSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K20019319	BRD-K20019319-001-01-5	Broad Institute of MIT and Harvard	BRD-K20019319			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17+,22-/m0/s1	YKCDBQLHOOFCLT-JKSBSHDWSA-N	494.188685622							95733
BRD-K35234011	LSM-7301		54618582	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21-,25-/m1/s1	UDLZIJJYMLYVSF-DNRQZRRGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K35234011	BRD-K35234011-001-01-4	Broad Institute of MIT and Harvard	BRD-K35234011			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21-,25-/m1/s1	UDLZIJJYMLYVSF-DNRQZRRGSA-N	519.276692132							95922
BRD-K27451531	LSM-7191		54618472	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17+,21-/m0/s1	MNKHAAOLWRLKCW-FVJLSDCUSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC3CC3	BroadT	BRD-K27451531	BRD-K27451531-001-01-5	Broad Institute of MIT and Harvard	BRD-K27451531			CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC1CC1	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17+,21-/m0/s1	MNKHAAOLWRLKCW-FVJLSDCUSA-N	442.258005608							95812
CHEMBL2136492	LSM-7984	BRD-K88606952, SID131413714	54618619	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19+,23-/m1/s1	UDDMVFRUSJXUEW-SELNLUPBSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc3cccnc3	BroadT	BRD-K88606952	BRD-K88606952-001-01-0	Broad Institute of MIT and Harvard	BRD-K88606952			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc1cccnc1	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19+,23-/m1/s1	UDDMVFRUSJXUEW-SELNLUPBSA-N	501.193356432							96605
BRD-K39227212	LSM-7349		54618431	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19-,25-/m0/s1	KAJKYFHMOFZFFV-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K39227212	BRD-K39227212-001-01-1	Broad Institute of MIT and Harvard	BRD-K39227212			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19-,25-/m0/s1	KAJKYFHMOFZFFV-MHPIHPPYSA-N	516.209421066							95970
BRD-K43017765	LSM-7395		54618523	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20-,25-/m0/s1	DGMJKRBCRMVRNT-RLSLOFABSA-N	CC(C)CC#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K43017765	BRD-K43017765-001-01-1	Broad Institute of MIT and Harvard	BRD-K43017765			CC(C)CC#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20-,25-/m0/s1	DGMJKRBCRMVRNT-RLSLOFABSA-N	495.253334798							96016
CHEMBL2132046	LSM-7995	BRD-K89801405, SID131413687	54618592	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21+,29+/m0/s1	MIOBFWIJYZOKSQ-BNJCFXFUSA-N	COc1ccccc1C#Cc2cnc3O[C@H](CN(C)C(=O)c4ccc5OCOc5c4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K89801405	BRD-K89801405-001-01-9	Broad Institute of MIT and Harvard	BRD-K89801405			COc1ccccc1C#Cc1cnc2O[C@H](CN(C)C(=O)c3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21+,29+/m0/s1	MIOBFWIJYZOKSQ-BNJCFXFUSA-N	571.231850426							96616
CHEMBL2358525	LSM-7853	BRD-K77304272, SID131413514	54618425	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21-,27-/m0/s1	PIKMQEDGBFJLCE-IZVMNLJQSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)C4=CCCCC4	BroadT	BRD-K77304272	BRD-K77304272-001-01-8	Broad Institute of MIT and Harvard	BRD-K77304272			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C1=CCCCC1	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21-,27-/m0/s1	PIKMQEDGBFJLCE-IZVMNLJQSA-N	578.212042956							96474
BRD-K32271530	LSM-7268		54618555	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20+,26-/m1/s1	XRFBPINVKMLPSW-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K32271530	BRD-K32271530-001-01-1	Broad Institute of MIT and Harvard	BRD-K32271530			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20+,26-/m1/s1	XRFBPINVKMLPSW-BVFVYWQFSA-N	545.26381927							95889
CHEMBL2135062	LSM-7771	BRD-K69194443, SID131413737	54618642	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23-,28-/m1/s1	NJKSHKHIQBEBBM-MVOZIGHISA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@H](CN(C)C(=O)CN4CCOCC4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K69194443	BRD-K69194443-001-01-7	Broad Institute of MIT and Harvard	BRD-K69194443			COc1ccc(cc1)C#Cc1ccc2c(O[C@H](CN(C)C(=O)CN3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23-,28-/m1/s1	NJKSHKHIQBEBBM-MVOZIGHISA-N	585.250871308							96392
BRD-K62114978	LSM-7675		54618610	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21+,25-/m0/s1	UDLZIJJYMLYVSF-BKSPAHHJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K62114978	BRD-K62114978-001-01-5	Broad Institute of MIT and Harvard	BRD-K62114978			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21+,25-/m0/s1	UDLZIJJYMLYVSF-BKSPAHHJSA-N	519.276692132							96296
BRD-K62462045	LSM-7681		54618598	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21-,27-/m1/s1	RIEPFGYATXCXRE-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K62462045	BRD-K62462045-001-01-7	Broad Institute of MIT and Harvard	BRD-K62462045			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21-,27-/m1/s1	RIEPFGYATXCXRE-LGVUCKNBSA-N	555.220320108							96302
BRD-K41340267	LSM-7373		54618450	InChI=1S/C27H36N2O5S/c1-6-14-28(4)18-26-20(2)17-29(21(3)19-30)35(31,32)27-13-12-23(16-25(27)34-26)11-10-22-8-7-9-24(15-22)33-5/h7-9,12-13,15-16,20-21,26,30H,6,14,17-19H2,1-5H3/t20-,21-,26-/m0/s1	BMTZFXAWOLTARL-WOVHNISZSA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc3cccc(OC)c3	BroadT	BRD-K41340267	BRD-K41340267-001-01-2	Broad Institute of MIT and Harvard	BRD-K41340267			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc1cccc(OC)c1	InChI=1S/C27H36N2O5S/c1-6-14-28(4)18-26-20(2)17-29(21(3)19-30)35(31,32)27-13-12-23(16-25(27)34-26)11-10-22-8-7-9-24(15-22)33-5/h7-9,12-13,15-16,20-21,26,30H,6,14,17-19H2,1-5H3/t20-,21-,26-/m0/s1	BMTZFXAWOLTARL-WOVHNISZSA-N	500.234492962							95994
BRD-K71839385	LSM-7798		54618530	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19+,25+/m0/s1	KAJKYFHMOFZFFV-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K71839385	BRD-K71839385-001-01-3	Broad Institute of MIT and Harvard	BRD-K71839385			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19+,25+/m0/s1	KAJKYFHMOFZFFV-OSWQYVSFSA-N	516.209421066							96419
BRD-K57579659	LSM-7613		54618583	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19+,23-/m0/s1	AEYCXANGZGGWKX-LVBDUCALSA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K57579659	BRD-K57579659-001-01-2	Broad Institute of MIT and Harvard	BRD-K57579659			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19+,23-/m0/s1	AEYCXANGZGGWKX-LVBDUCALSA-N	459.273321314							96234
BRD-K27539003	LSM-7193		54618607	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19+,23+/m1/s1	XXZIILLLBOPLBY-GBPOLFSSSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K27539003	BRD-K27539003-001-01-6	Broad Institute of MIT and Harvard	BRD-K27539003			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19+,23+/m1/s1	XXZIILLLBOPLBY-GBPOLFSSSA-N	480.237270164							95814
BRD-K12942263	LSM-7023		54618654	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22-,29-/m0/s1	CBOPBGRHGQIOTR-SYZUXVNWSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)c4cccc(c4)C(=O)N(C)C)cc1	BroadT	BRD-K12942263	BRD-K12942263-001-01-4	Broad Institute of MIT and Harvard	BRD-K12942263			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)-c2cccc(c2)C(=O)N(C)C)cc1	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22-,29-/m0/s1	CBOPBGRHGQIOTR-SYZUXVNWSA-N	624.26177035							95644
MLS003130204	LSM-7218	BRD-K28882142, SID99358999	46903692	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20+,25+/m0/s1	RZEXHRSKTOKTQU-WZOHSFFVSA-N	COc1ccccc1C#Cc2cnc3O[C@H](CN(C)S(=O)(=O)c4cn(C)cn4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K28882142	BRD-K28882142-001-02-9	Broad Institute of MIT and Harvard	BRD-K28882142			COc1ccccc1C#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20+,25+/m0/s1	RZEXHRSKTOKTQU-WZOHSFFVSA-N	567.215154516							95839
CHEMBL2362449	LSM-8009	BRD-K91573667, SID131413665	54618570	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21+,27+/m1/s1	PIKMQEDGBFJLCE-BUEREQSYSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)C4=CCCCC4	BroadT	BRD-K91573667	BRD-K91573667-001-01-3	Broad Institute of MIT and Harvard	BRD-K91573667			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCCC1	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21+,27+/m1/s1	PIKMQEDGBFJLCE-BUEREQSYSA-N	578.212042956							96630
BRD-K30516885	LSM-7244		54618611	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20+,25+/m1/s1	DGMJKRBCRMVRNT-RNHFSVANSA-N	CC(C)CC#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K30516885	BRD-K30516885-001-01-2	Broad Institute of MIT and Harvard	BRD-K30516885			CC(C)CC#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20+,25+/m1/s1	DGMJKRBCRMVRNT-RNHFSVANSA-N	495.253334798							95865
CHEMBL2134172	LSM-43389	BRD-K38774907, SID131413719	54618624	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22-,28-/m0/s1	RWAKEFQIDXFPPV-ZEEDTAOFSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K38774907	BRD-K38774907-001-01-3	Broad Institute of MIT and Harvard	BRD-K38774907			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22-,28-/m0/s1	RWAKEFQIDXFPPV-ZEEDTAOFSA-N	565.22465656							
BRD-K20119687	LSM-7116		54618445	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20+,27-/m0/s1	YBZIDMTZSSULOY-VKIDHGPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5ccccc5	BroadT	BRD-K20119687	BRD-K20119687-001-01-7	Broad Institute of MIT and Harvard	BRD-K20119687			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20+,27-/m0/s1	YBZIDMTZSSULOY-VKIDHGPPSA-N	552.193022074							95737
BRD-K79064458	LSM-7886		54618565	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17-,21+/m0/s1	YNLPQPKWJFYZTR-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K79064458	BRD-K79064458-001-01-2	Broad Institute of MIT and Harvard	BRD-K79064458			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17-,21+/m0/s1	YNLPQPKWJFYZTR-XGHQBKJUSA-N	461.198441812							96507
BRD-K22576413	LSM-43377		54618490	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17+,22+/m0/s1	DRXNQUOVPOKVMH-IMDOJKNISA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K22576413	BRD-K22576413-001-01-7	Broad Institute of MIT and Harvard	BRD-K22576413			C\C=C\c1cnc2O[C@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17+,22+/m0/s1	DRXNQUOVPOKVMH-IMDOJKNISA-N	470.232933712							
BRD-K05041276	LSM-6924		54618524	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21-,25+/m0/s1	UDLZIJJYMLYVSF-STWLZBDKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K05041276	BRD-K05041276-001-01-9	Broad Institute of MIT and Harvard	BRD-K05041276			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21-,25+/m0/s1	UDLZIJJYMLYVSF-STWLZBDKSA-N	519.276692132							95545
BRD-K04007716	LSM-6914		54618569	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20+,27-/m1/s1	KSASPYMRGHUFQD-IOKPGSKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccc(F)cc4	BroadT	BRD-K04007716	BRD-K04007716-001-01-9	Broad Institute of MIT and Harvard	BRD-K04007716			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20+,27-/m1/s1	KSASPYMRGHUFQD-IOKPGSKQSA-N	556.204335686							95535
BRD-K87062384	LSM-7964		54618426	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19+,25+/m1/s1	ZMBSZSRZHSICHB-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)c4ccc(F)cc4	BroadT	BRD-K87062384	BRD-K87062384-001-01-5	Broad Institute of MIT and Harvard	BRD-K87062384			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1ccc(F)cc1	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19+,25+/m1/s1	ZMBSZSRZHSICHB-WYEJZRMESA-N	506.232933712							96585
BRD-K42279779	LSM-7385		54618577	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19-,25-/m1/s1	KAJKYFHMOFZFFV-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K42279779	BRD-K42279779-001-01-2	Broad Institute of MIT and Harvard	BRD-K42279779			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19-,25-/m1/s1	KAJKYFHMOFZFFV-MPCDZSKCSA-N	516.209421066							96006
MLS003130274	LSM-7809	BRD-K73162352, SID99359060	46903710	InChI=1S/C22H29BrN2O7S2/c1-15-12-25(16(2)14-26)34(29,30)22-10-9-17(23)11-19(22)32-20(15)13-24(3)33(27,28)21-8-6-5-7-18(21)31-4/h5-11,15-16,20,26H,12-14H2,1-4H3/t15-,16+,20-/m1/s1	ZNUDODZEVYBNEW-GQIGUUNPSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2Oc3cc(Br)ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K73162352	BRD-K73162352-001-01-7	Broad Institute of MIT and Harvard	BRD-K73162352			COc1ccccc1S(=O)(=O)N(C)C[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C22H29BrN2O7S2/c1-15-12-25(16(2)14-26)34(29,30)22-10-9-17(23)11-19(22)32-20(15)13-24(3)33(27,28)21-8-6-5-7-18(21)31-4/h5-11,15-16,20,26H,12-14H2,1-4H3/t15-,16+,20-/m1/s1	ZNUDODZEVYBNEW-GQIGUUNPSA-N	576.059955268							96430
BRD-K20009726	LSM-7110		54618626	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16-,19+/m1/s1	KFBFJFZZVCOITQ-MDZRGWNJSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K20009726	BRD-K20009726-001-01-3	Broad Institute of MIT and Harvard	BRD-K20009726			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC(C)(C)O	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16-,19+/m1/s1	KFBFJFZZVCOITQ-MDZRGWNJSA-N	447.236935806							95731
BRD-K39245533	LSM-7350		54618430	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18-,22+/m1/s1	SVKJOHOIDWZOJW-HMFYCAOWSA-N	CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3	BroadT	BRD-K39245533	BRD-K39245533-001-01-5	Broad Institute of MIT and Harvard	BRD-K39245533			CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18-,22+/m1/s1	SVKJOHOIDWZOJW-HMFYCAOWSA-N	411.252191946							95971
BRD-K53792011	LSM-7545		54618682	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21+,29+/m1/s1	MIOBFWIJYZOKSQ-CGQTXMLISA-N	COc1ccccc1C#Cc2cnc3O[C@@H](CN(C)C(=O)c4ccc5OCOc5c4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K53792011	BRD-K53792011-001-01-8	Broad Institute of MIT and Harvard	BRD-K53792011			COc1ccccc1C#Cc1cnc2O[C@@H](CN(C)C(=O)c3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21+,29+/m1/s1	MIOBFWIJYZOKSQ-CGQTXMLISA-N	571.231850426							96166
BRD-K49125116	LSM-7482		54618649	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20-,25+/m0/s1	RZEXHRSKTOKTQU-ZYLNGJIFSA-N	COc1ccccc1C#Cc2cnc3O[C@H](CN(C)S(=O)(=O)c4cn(C)cn4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K49125116	BRD-K49125116-001-01-2	Broad Institute of MIT and Harvard	BRD-K49125116			COc1ccccc1C#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20-,25+/m0/s1	RZEXHRSKTOKTQU-ZYLNGJIFSA-N	567.215154516							96103
BRD-K55343182	LSM-7577		54618586	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19+,23+/m0/s1	XXZIILLLBOPLBY-RTXPOLOASA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K55343182	BRD-K55343182-001-01-1	Broad Institute of MIT and Harvard	BRD-K55343182			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19+,23+/m0/s1	XXZIILLLBOPLBY-RTXPOLOASA-N	480.237270164							96198
BRD-K87791256	LSM-7975		54618671	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22+/m1/s1	OBRGIGMGBKKHMR-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccccn3	BroadT	BRD-K87791256	BRD-K87791256-001-01-4	Broad Institute of MIT and Harvard	BRD-K87791256			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccn1	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22+/m1/s1	OBRGIGMGBKKHMR-HMFYCAOWSA-N	443.187877128							96596
CHEMBL2136504	LSM-8311	BRD-K64558129, SID131413730	54618635	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17+,22-/m1/s1	YKCDBQLHOOFCLT-HYFFOGBASA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K64558129	BRD-K64558129-001-01-9	Broad Institute of MIT and Harvard	BRD-K64558129			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17+,22-/m1/s1	YKCDBQLHOOFCLT-HYFFOGBASA-N	494.188685622							96932
BRD-K57537921	LSM-7612		54618691	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21-,29+/m1/s1	MIOBFWIJYZOKSQ-RLCGNTSFSA-N	COc1ccccc1C#Cc2cnc3O[C@@H](CN(C)C(=O)c4ccc5OCOc5c4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K57537921	BRD-K57537921-001-01-2	Broad Institute of MIT and Harvard	BRD-K57537921			COc1ccccc1C#Cc1cnc2O[C@@H](CN(C)C(=O)c3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21-,29+/m1/s1	MIOBFWIJYZOKSQ-RLCGNTSFSA-N	571.231850426							96233
CHEMBL2136684	LSM-7087	BRD-K18493795, SID131413530	54618441	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21-,27+/m1/s1	PIKMQEDGBFJLCE-GNMOFYLKSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C4=CCCCC4	BroadT	BRD-K18493795	BRD-K18493795-001-01-9	Broad Institute of MIT and Harvard	BRD-K18493795			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C1=CCCCC1	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21-,27+/m1/s1	PIKMQEDGBFJLCE-GNMOFYLKSA-N	578.212042956							95708
BRD-K62602051	LSM-7685		54618498	InChI=1S/C32H35N3O5/c1-22-18-35(23(2)21-36)31(37)28-16-26(11-7-10-24-8-5-4-6-9-24)17-33-30(28)40-29(22)20-34(3)19-25-12-14-27(15-13-25)32(38)39/h4-6,8-9,12-17,22-23,29,36H,10,18-21H2,1-3H3,(H,38,39)/t22-,23-,29+/m0/s1	FGMBKJAJBFHUEJ-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K62602051	BRD-K62602051-001-01-9	Broad Institute of MIT and Harvard	BRD-K62602051			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C32H35N3O5/c1-22-18-35(23(2)21-36)31(37)28-16-26(11-7-10-24-8-5-4-6-9-24)17-33-30(28)40-29(22)20-34(3)19-25-12-14-27(15-13-25)32(38)39/h4-6,8-9,12-17,22-23,29,36H,10,18-21H2,1-3H3,(H,38,39)/t22-,23-,29+/m0/s1	FGMBKJAJBFHUEJ-SBZVUBOMSA-N	541.25767125							96306
BRD-K78657294	LSM-7876		54618676	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18-,22+/m0/s1	SVKJOHOIDWZOJW-NPPFBWRTSA-N	CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3	BroadT	BRD-K78657294	BRD-K78657294-001-01-2	Broad Institute of MIT and Harvard	BRD-K78657294			CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18-,22+/m0/s1	SVKJOHOIDWZOJW-NPPFBWRTSA-N	411.252191946							96497
BRD-K42509645	LSM-43393		54618505	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19+,23-/m1/s1	JSQMQZOUAVKGAV-ICVBJYIRSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K42509645	BRD-K42509645-001-01-4	Broad Institute of MIT and Harvard	BRD-K42509645			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19+,23-/m1/s1	JSQMQZOUAVKGAV-ICVBJYIRSA-N	487.214091876							
CHEMBL2358879	LSM-7372	BRD-K41235383, SID131413500	54618411	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20+,25-/m1/s1	DGMJKRBCRMVRNT-OHUGHZGNSA-N	CC(C)CC#Cc1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K41235383	BRD-K41235383-001-01-3	Broad Institute of MIT and Harvard	BRD-K41235383			CC(C)CC#Cc1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20+,25-/m1/s1	DGMJKRBCRMVRNT-OHUGHZGNSA-N	495.253334798							95993
BRD-K44407752	LSM-7409		54618538	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18+,22+/m1/s1	SVKJOHOIDWZOJW-FGSXEWAUSA-N	CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3	BroadT	BRD-K44407752	BRD-K44407752-001-01-8	Broad Institute of MIT and Harvard	BRD-K44407752			CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18+,22+/m1/s1	SVKJOHOIDWZOJW-FGSXEWAUSA-N	411.252191946							96030
BRD-K37815632	LSM-7336		54618496	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17+,21+/m1/s1	YNLPQPKWJFYZTR-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K37815632	BRD-K37815632-001-01-7	Broad Institute of MIT and Harvard	BRD-K37815632			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17+,21+/m1/s1	YNLPQPKWJFYZTR-WWMYMODYSA-N	461.198441812							95957
BRD-K48733306	LSM-7474		54618474	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19-,23+/m1/s1	UDDMVFRUSJXUEW-PWHSHALESA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc3cccnc3	BroadT	BRD-K48733306	BRD-K48733306-001-01-4	Broad Institute of MIT and Harvard	BRD-K48733306			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc1cccnc1	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19-,23+/m1/s1	UDDMVFRUSJXUEW-PWHSHALESA-N	501.193356432							96095
BRD-K22945779	LSM-7147		54618561	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19+,23+/m0/s1	AEYCXANGZGGWKX-RTXPOLOASA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K22945779	BRD-K22945779-001-01-2	Broad Institute of MIT and Harvard	BRD-K22945779			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19+,23+/m0/s1	AEYCXANGZGGWKX-RTXPOLOASA-N	459.273321314							95768
BRD-K07208716	LSM-6948		54618595	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20+,26+/m0/s1	XRFBPINVKMLPSW-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K07208716	BRD-K07208716-001-01-0	Broad Institute of MIT and Harvard	BRD-K07208716			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20+,26+/m0/s1	XRFBPINVKMLPSW-OUDXUNEISA-N	545.26381927							95569
BRD-K27428408	LSM-7190		54618420	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19+,23-/m1/s1	XXZIILLLBOPLBY-CROMWVBPSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K27428408	BRD-K27428408-001-01-3	Broad Institute of MIT and Harvard	BRD-K27428408			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19+,23-/m1/s1	XXZIILLLBOPLBY-CROMWVBPSA-N	480.237270164							95811
BRD-K18793122-001-01-6	LSM-16546	BRD-K18793122	54618391	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19-,23+/m1/s1	AEYCXANGZGGWKX-ZQAYVECASA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K18793122	BRD-K18793122-001-01-6	Broad Institute of MIT and Harvard	BRD-K18793122			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19-,23+/m1/s1	AEYCXANGZGGWKX-ZQAYVECASA-N	459.273321314							105183
BRD-K58404149	LSM-43415		54618630	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19+,23+/m1/s1	JSQMQZOUAVKGAV-NEGLHNAESA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K58404149	BRD-K58404149-001-01-0	Broad Institute of MIT and Harvard	BRD-K58404149			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19+,23+/m1/s1	JSQMQZOUAVKGAV-NEGLHNAESA-N	487.214091876							
BRD-K46450665	LSM-43399		54618648	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19-,23+/m0/s1	JSQMQZOUAVKGAV-VRWPWIMQSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K46450665	BRD-K46450665-001-01-2	Broad Institute of MIT and Harvard	BRD-K46450665			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19-,23+/m0/s1	JSQMQZOUAVKGAV-VRWPWIMQSA-N	487.214091876							
BRD-K87811893	LSM-7976		54618459	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18+,25-/m1/s1	PGLSEMLPCXRKER-FUMQJTLXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(cc4C1=O)C5=CCCC5	BroadT	BRD-K87811893	BRD-K87811893-001-01-9	Broad Institute of MIT and Harvard	BRD-K87811893			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18+,25-/m1/s1	PGLSEMLPCXRKER-FUMQJTLXSA-N	507.236935806							96597
MLS003129936	LSM-7785	BRD-K69983865	46903309	InChI=1S/C22H29BrN2O7S2/c1-15-12-25(16(2)14-26)34(29,30)22-10-9-17(23)11-19(22)32-20(15)13-24(3)33(27,28)21-8-6-5-7-18(21)31-4/h5-11,15-16,20,26H,12-14H2,1-4H3/t15-,16-,20-/m1/s1	ZNUDODZEVYBNEW-JXXFODFXSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2Oc3cc(Br)ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K69983865	BRD-K69983865-001-01-2	Broad Institute of MIT and Harvard	BRD-K69983865			COc1ccccc1S(=O)(=O)N(C)C[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C22H29BrN2O7S2/c1-15-12-25(16(2)14-26)34(29,30)22-10-9-17(23)11-19(22)32-20(15)13-24(3)33(27,28)21-8-6-5-7-18(21)31-4/h5-11,15-16,20,26H,12-14H2,1-4H3/t15-,16-,20-/m1/s1	ZNUDODZEVYBNEW-JXXFODFXSA-N	576.059955268							96406
BRD-K30234379	LSM-7238		54618462	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20+,26-/m0/s1	XRFBPINVKMLPSW-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K30234379	BRD-K30234379-001-01-5	Broad Institute of MIT and Harvard	BRD-K30234379			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20+,26-/m0/s1	XRFBPINVKMLPSW-UNVFRBQDSA-N	545.26381927							95859
BRD-K53868452	LSM-7549		44484551	InChI=1S/C31H37N5O7/c1-18-15-36(19(2)17-37)30(38)24-12-23(9-8-22-10-11-25(40-6)26(13-22)41-7)14-32-29(24)42-27(18)16-35(5)31(39)33-28-20(3)34-43-21(28)4/h10-14,18-19,27,37H,15-17H2,1-7H3,(H,33,39)/t18-,19+,27-/m0/s1	HGXFGBIPLMFRTM-CUMRGQLISA-N	COc1ccc(cc1OC)C#Cc2cnc3O[C@@H](CN(C)C(=O)Nc4c(C)onc4C)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K53868452	BRD-K53868452-001-01-2	Broad Institute of MIT and Harvard	BRD-K53868452			COc1ccc(cc1OC)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3c(C)noc3C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C31H37N5O7/c1-18-15-36(19(2)17-37)30(38)24-12-23(9-8-22-10-11-25(40-6)26(13-22)41-7)14-32-29(24)42-27(18)16-35(5)31(39)33-28-20(3)34-43-21(28)4/h10-14,18-19,27,37H,15-17H2,1-7H3,(H,33,39)/t18-,19+,27-/m0/s1	HGXFGBIPLMFRTM-CUMRGQLISA-N	591.269298574							96170
BRD-K57133453	LSM-7602		54618547	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19-,23+/m0/s1	AEYCXANGZGGWKX-KEXUJGGDSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K57133453	BRD-K57133453-001-01-6	Broad Institute of MIT and Harvard	BRD-K57133453			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19-,23+/m0/s1	AEYCXANGZGGWKX-KEXUJGGDSA-N	459.273321314							96223
BRD-K41974651	LSM-7380		54618537	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21-,27+/m0/s1	RIEPFGYATXCXRE-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K41974651	BRD-K41974651-001-01-2	Broad Institute of MIT and Harvard	BRD-K41974651			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21-,27+/m0/s1	RIEPFGYATXCXRE-NOMHHCBYSA-N	555.220320108							96001
BRD-K25583560	LSM-7176		54618602	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21-,25-/m0/s1	UDLZIJJYMLYVSF-WATLYSKOSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K25583560	BRD-K25583560-001-01-1	Broad Institute of MIT and Harvard	BRD-K25583560			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C27H41N3O5S/c1-20-17-30(21(2)19-31)36(33,34)26-14-13-22(10-9-15-28(3)4)16-24(26)35-25(20)18-29(5)27(32)23-11-7-6-8-12-23/h13-14,16,20-21,23,25,31H,6-8,11-12,15,17-19H2,1-5H3/t20-,21-,25-/m0/s1	UDLZIJJYMLYVSF-WATLYSKOSA-N	519.276692132							95797
BRD-K51791261	LSM-7516		54618661	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20+,27+/m1/s1	YBZIDMTZSSULOY-JVAFGIKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5ccccc5	BroadT	BRD-K51791261	BRD-K51791261-001-01-9	Broad Institute of MIT and Harvard	BRD-K51791261			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20+,27+/m1/s1	YBZIDMTZSSULOY-JVAFGIKQSA-N	552.193022074							96137
BRD-K06295532	LSM-6939		54618628	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20-,26+/m1/s1	XRFBPINVKMLPSW-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K06295532	BRD-K06295532-001-01-0	Broad Institute of MIT and Harvard	BRD-K06295532			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20-,26+/m1/s1	XRFBPINVKMLPSW-KYTVRQNUSA-N	545.26381927							95560
BRD-K27543325	LSM-7194		54618670	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21-,27-/m1/s1	IVQXIBZAZBUJJC-LGVUCKNBSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)C#Cc4ccncc4)c1	BroadT	BRD-K27543325	BRD-K27543325-001-01-9	Broad Institute of MIT and Harvard	BRD-K27543325			COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)C#Cc2ccncc2)c1	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21-,27-/m1/s1	IVQXIBZAZBUJJC-LGVUCKNBSA-N	543.248169206							95815
BRD-K27918075	LSM-7205		54618643	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17-,21-/m1/s1	YNLPQPKWJFYZTR-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K27918075	BRD-K27918075-001-01-5	Broad Institute of MIT and Harvard	BRD-K27918075			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17-,21-/m1/s1	YNLPQPKWJFYZTR-CBGDNZLLSA-N	461.198441812							95826
BRD-K47788371	LSM-7462		54618481	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20-,27+/m0/s1	KSASPYMRGHUFQD-OWOAZTCBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccc(F)cc4	BroadT	BRD-K47788371	BRD-K47788371-001-01-9	Broad Institute of MIT and Harvard	BRD-K47788371			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20-,27+/m0/s1	KSASPYMRGHUFQD-OWOAZTCBSA-N	556.204335686							96083
BRD-K02756145	LSM-6897		54618399	InChI=1S/C32H35N3O5/c1-22-18-35(23(2)21-36)31(37)28-16-26(11-7-10-24-8-5-4-6-9-24)17-33-30(28)40-29(22)20-34(3)19-25-12-14-27(15-13-25)32(38)39/h4-6,8-9,12-17,22-23,29,36H,10,18-21H2,1-3H3,(H,38,39)/t22-,23-,29+/m1/s1	FGMBKJAJBFHUEJ-SGQNLQFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K02756145	BRD-K02756145-001-01-4	Broad Institute of MIT and Harvard	BRD-K02756145			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C32H35N3O5/c1-22-18-35(23(2)21-36)31(37)28-16-26(11-7-10-24-8-5-4-6-9-24)17-33-30(28)40-29(22)20-34(3)19-25-12-14-27(15-13-25)32(38)39/h4-6,8-9,12-17,22-23,29,36H,10,18-21H2,1-3H3,(H,38,39)/t22-,23-,29+/m1/s1	FGMBKJAJBFHUEJ-SGQNLQFHSA-N	541.25767125							95518
BRD-K83241810	LSM-7919		54618429	InChI=1S/C31H40N2O6S/c1-22-18-33(23(2)21-34)40(37,38)30-15-14-25(11-6-10-24-8-4-5-9-24)17-28(30)39-29(22)20-32(3)19-26-12-7-13-27(16-26)31(35)36/h7,12-17,22-24,29,34H,4-5,8-10,18-21H2,1-3H3,(H,35,36)/t22-,23+,29+/m1/s1	DKZVPIDPIJUHTD-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3cc(ccc3S1(=O)=O)C#CCC4CCCC4	BroadT	BRD-K83241810	BRD-K83241810-001-01-3	Broad Institute of MIT and Harvard	BRD-K83241810			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2cc(ccc2S1(=O)=O)C#CCC1CCCC1	InChI=1S/C31H40N2O6S/c1-22-18-33(23(2)21-34)40(37,38)30-15-14-25(11-6-10-24-8-4-5-9-24)17-28(30)39-29(22)20-32(3)19-26-12-7-13-27(16-26)31(35)36/h7,12-17,22-24,29,34H,4-5,8-10,18-21H2,1-3H3,(H,35,36)/t22-,23+,29+/m1/s1	DKZVPIDPIJUHTD-AFKLWXAFSA-N	568.26070771							96540
BRD-K33903208	LSM-7287		44506100	InChI=1S/C26H36N4O5/c1-16(2)28-26(33)29(5)14-23-17(3)13-30(18(4)15-31)25(32)22-11-20(12-27-24(22)35-23)19-8-7-9-21(10-19)34-6/h7-12,16-18,23,31H,13-15H2,1-6H3,(H,28,33)/t17-,18+,23-/m0/s1	VPRGHURYTRUSAB-IXFSTUDKSA-N	COc1cccc(c1)c2cnc3O[C@@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K33903208	BRD-K33903208-001-01-9	Broad Institute of MIT and Harvard	BRD-K33903208			COc1cccc(c1)-c1cnc2O[C@@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H36N4O5/c1-16(2)28-26(33)29(5)14-23-17(3)13-30(18(4)15-31)25(32)22-11-20(12-27-24(22)35-23)19-8-7-9-21(10-19)34-6/h7-12,16-18,23,31H,13-15H2,1-6H3,(H,28,33)/t17-,18+,23-/m0/s1	VPRGHURYTRUSAB-IXFSTUDKSA-N	484.268570292							95908
BRD-K06884108	LSM-43361		54618476	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19+,23-/m0/s1	JSQMQZOUAVKGAV-LKIAOXKDSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K06884108	BRD-K06884108-001-01-5	Broad Institute of MIT and Harvard	BRD-K06884108			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19+,23-/m0/s1	JSQMQZOUAVKGAV-LKIAOXKDSA-N	487.214091876							
BRD-K72766058	LSM-7804		54618417	InChI=1S/C29H38N4O3/c1-20-16-33(21(2)19-34)29(35)26-13-25(24-11-9-22(14-30)10-12-24)15-31-28(26)36-27(20)18-32(3)17-23-7-5-4-6-8-23/h9-13,15,20-21,23,27,34H,4-8,16-19H2,1-3H3/t20-,21-,27+/m1/s1	GKYOEOUZTXHXGV-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K72766058	BRD-K72766058-001-01-3	Broad Institute of MIT and Harvard	BRD-K72766058			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C29H38N4O3/c1-20-16-33(21(2)19-34)29(35)26-13-25(24-11-9-22(14-30)10-12-24)15-31-28(26)36-27(20)18-32(3)17-23-7-5-4-6-8-23/h9-13,15,20-21,23,27,34H,4-8,16-19H2,1-3H3/t20-,21-,27+/m1/s1	GKYOEOUZTXHXGV-GNMOFYLKSA-N	490.294391116							96425
BRD-K51390937	LSM-7509		54618436	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16+,19+/m1/s1	KFBFJFZZVCOITQ-GJYPPUQNSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K51390937	BRD-K51390937-001-01-4	Broad Institute of MIT and Harvard	BRD-K51390937			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)(C)O	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16+,19+/m1/s1	KFBFJFZZVCOITQ-GJYPPUQNSA-N	447.236935806							96130
MLS003130182	LSM-8081	BRD-K97307478, SID99358831	46903580	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21-,29-/m1/s1	MIOBFWIJYZOKSQ-GVNDJSPXSA-N	COc1ccccc1C#Cc2cnc3O[C@H](CN(C)C(=O)c4ccc5OCOc5c4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K97307478	BRD-K97307478-001-02-7	Broad Institute of MIT and Harvard	BRD-K97307478			COc1ccccc1C#Cc1cnc2O[C@H](CN(C)C(=O)c3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21-,29-/m1/s1	MIOBFWIJYZOKSQ-GVNDJSPXSA-N	571.231850426							96702
BRD-K16210823	LSM-7067		54618612	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20+,27+/m0/s1	KSASPYMRGHUFQD-ASHZAFPQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccc(F)cc4	BroadT	BRD-K16210823	BRD-K16210823-001-01-5	Broad Institute of MIT and Harvard	BRD-K16210823			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20+,27+/m0/s1	KSASPYMRGHUFQD-ASHZAFPQSA-N	556.204335686							95688
BRD-K40630529	LSM-43392		54618494	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17-,22+/m1/s1	DRXNQUOVPOKVMH-VIOADAESSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K40630529	BRD-K40630529-001-01-1	Broad Institute of MIT and Harvard	BRD-K40630529			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17-,22+/m1/s1	DRXNQUOVPOKVMH-VIOADAESSA-N	470.232933712							
BRD-K66204187	LSM-7732		54618500	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21+,27+/m0/s1	SOBUUYUTYHYENZ-FYQCMVGJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccc4F	BroadT	BRD-K66204187	BRD-K66204187-001-01-7	Broad Institute of MIT and Harvard	BRD-K66204187			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccc1F	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21+,27+/m0/s1	SOBUUYUTYHYENZ-FYQCMVGJSA-N	521.268984862							96353
BRD-K11548496	LSM-6996		54618645	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19+,23-/m0/s1	AEYCXANGZGGWKX-XWQURZDVSA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K11548496	BRD-K11548496-001-01-9	Broad Institute of MIT and Harvard	BRD-K11548496			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19+,23-/m0/s1	AEYCXANGZGGWKX-XWQURZDVSA-N	459.273321314							95617
CHEMBL2132868	LSM-43439	BRD-K97615779, SID131413675	54618580	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19-,23-/m1/s1	JSQMQZOUAVKGAV-UZWFEHOCSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K97615779	BRD-K97615779-001-01-1	Broad Institute of MIT and Harvard	BRD-K97615779			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19-,23-/m1/s1	JSQMQZOUAVKGAV-UZWFEHOCSA-N	487.214091876							
BRD-K50639228	LSM-7497		54618585	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19-,23+/m1/s1	AEYCXANGZGGWKX-KCESLBEFSA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K50639228	BRD-K50639228-001-01-3	Broad Institute of MIT and Harvard	BRD-K50639228			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18+,19-,23+/m1/s1	AEYCXANGZGGWKX-KCESLBEFSA-N	459.273321314							96118
BRD-K60963631	LSM-7660		54618469	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19+,24-/m1/s1	DUJQZBWFZFXOJW-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K60963631	BRD-K60963631-001-01-6	Broad Institute of MIT and Harvard	BRD-K60963631			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19+,24-/m1/s1	DUJQZBWFZFXOJW-YDIMBITNSA-N	465.26275663							96281
BRD-K52654243	LSM-7530		54618615	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20-,27+/m0/s1	YBZIDMTZSSULOY-OWOAZTCBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5ccccc5	BroadT	BRD-K52654243	BRD-K52654243-001-01-1	Broad Institute of MIT and Harvard	BRD-K52654243			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20-,27+/m0/s1	YBZIDMTZSSULOY-OWOAZTCBSA-N	552.193022074							96151
BRD-K73360774	LSM-7811		54618423	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21+,27+/m1/s1	RIEPFGYATXCXRE-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K73360774	BRD-K73360774-001-01-7	Broad Institute of MIT and Harvard	BRD-K73360774			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21+,27+/m1/s1	RIEPFGYATXCXRE-BUEREQSYSA-N	555.220320108							96432
BRD-K54560380	LSM-43410		54618675	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17+,22-/m1/s1	DRXNQUOVPOKVMH-KCIITSRNSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K54560380	BRD-K54560380-001-01-1	Broad Institute of MIT and Harvard	BRD-K54560380			C\C=C\c1cnc2O[C@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17+,22-/m1/s1	DRXNQUOVPOKVMH-KCIITSRNSA-N	470.232933712							
BRD-K43436404	LSM-43395		54618638	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17-,22-/m0/s1	DRXNQUOVPOKVMH-AZYGBYLRSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K43436404	BRD-K43436404-001-01-0	Broad Institute of MIT and Harvard	BRD-K43436404			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17-,22-/m0/s1	DRXNQUOVPOKVMH-AZYGBYLRSA-N	470.232933712							
BRD-K67365258	LSM-7749		54618687	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20-,25-/m0/s1	RZEXHRSKTOKTQU-RLSLOFABSA-N	COc1ccccc1C#Cc2cnc3O[C@@H](CN(C)S(=O)(=O)c4cn(C)cn4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K67365258	BRD-K67365258-001-01-9	Broad Institute of MIT and Harvard	BRD-K67365258			COc1ccccc1C#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20-,25-/m0/s1	RZEXHRSKTOKTQU-RLSLOFABSA-N	567.215154516							96370
BRD-K84909597	LSM-7940		54618485	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21+,26-/m0/s1	GVDJVSBPXRZCOM-UZINWLIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K84909597	BRD-K84909597-001-01-3	Broad Institute of MIT and Harvard	BRD-K84909597			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21+,26-/m0/s1	GVDJVSBPXRZCOM-UZINWLIJSA-N	512.245726362							96561
BRD-K15619703	LSM-7058		54618663	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20+,25-/m0/s1	IXCMNLOSFSWDKI-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K15619703	BRD-K15619703-001-01-3	Broad Institute of MIT and Harvard	BRD-K15619703			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20+,25-/m0/s1	IXCMNLOSFSWDKI-DFIYOIEZSA-N	503.245392004							95679
BRD-K01023753	LSM-6871		54618527	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17-,22-/m0/s1	YKCDBQLHOOFCLT-HOIFWPIMSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K01023753	BRD-K01023753-001-01-3	Broad Institute of MIT and Harvard	BRD-K01023753			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17-,22-/m0/s1	YKCDBQLHOOFCLT-HOIFWPIMSA-N	494.188685622							95492
BRD-K84447176	LSM-7934		54618452	InChI=1S/C27H36N2O5S/c1-6-14-28(4)18-26-20(2)17-29(21(3)19-30)35(31,32)27-13-12-23(16-25(27)34-26)11-10-22-8-7-9-24(15-22)33-5/h7-9,12-13,15-16,20-21,26,30H,6,14,17-19H2,1-5H3/t20-,21+,26-/m0/s1	BMTZFXAWOLTARL-UZINWLIJSA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc3cccc(OC)c3	BroadT	BRD-K84447176	BRD-K84447176-001-01-3	Broad Institute of MIT and Harvard	BRD-K84447176			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc1cccc(OC)c1	InChI=1S/C27H36N2O5S/c1-6-14-28(4)18-26-20(2)17-29(21(3)19-30)35(31,32)27-13-12-23(16-25(27)34-26)11-10-22-8-7-9-24(15-22)33-5/h7-9,12-13,15-16,20-21,26,30H,6,14,17-19H2,1-5H3/t20-,21+,26-/m0/s1	BMTZFXAWOLTARL-UZINWLIJSA-N	500.234492962							96555
BRD-K69672299	LSM-7778		54618562	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21+,27-/m0/s1	SOBUUYUTYHYENZ-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccc4F	BroadT	BRD-K69672299	BRD-K69672299-001-01-7	Broad Institute of MIT and Harvard	BRD-K69672299			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccc1F	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21+,27-/m0/s1	SOBUUYUTYHYENZ-ISCCLHIJSA-N	521.268984862							96399
BRD-K64552378	LSM-7710		54618593	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17-,21-/m0/s1	MNKHAAOLWRLKCW-FIKGOQFSSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC3CC3	BroadT	BRD-K64552378	BRD-K64552378-001-01-0	Broad Institute of MIT and Harvard	BRD-K64552378			CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC1CC1	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17-,21-/m0/s1	MNKHAAOLWRLKCW-FIKGOQFSSA-N	442.258005608							96331
BRD-K45258986	LSM-7420		54618606	InChI=1S/C27H36N2O5S/c1-6-14-28(4)18-26-20(2)17-29(21(3)19-30)35(31,32)27-13-12-23(16-25(27)34-26)11-10-22-8-7-9-24(15-22)33-5/h7-9,12-13,15-16,20-21,26,30H,6,14,17-19H2,1-5H3/t20-,21-,26-/m1/s1	BMTZFXAWOLTARL-IPVFLDMMSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc3cccc(OC)c3	BroadT	BRD-K45258986	BRD-K45258986-001-01-2	Broad Institute of MIT and Harvard	BRD-K45258986			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc1cccc(OC)c1	InChI=1S/C27H36N2O5S/c1-6-14-28(4)18-26-20(2)17-29(21(3)19-30)35(31,32)27-13-12-23(16-25(27)34-26)11-10-22-8-7-9-24(15-22)33-5/h7-9,12-13,15-16,20-21,26,30H,6,14,17-19H2,1-5H3/t20-,21-,26-/m1/s1	BMTZFXAWOLTARL-IPVFLDMMSA-N	500.234492962							96041
BRD-K37058154	LSM-7321		54618655	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19-,24-/m1/s1	DUJQZBWFZFXOJW-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K37058154	BRD-K37058154-001-01-2	Broad Institute of MIT and Harvard	BRD-K37058154			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19-,24-/m1/s1	DUJQZBWFZFXOJW-KHCICDEESA-N	465.26275663							95942
BRD-K21987633	LSM-7133		54618546	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19+,23-/m1/s1	AEYCXANGZGGWKX-CROMWVBPSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K21987633	BRD-K21987633-001-01-1	Broad Institute of MIT and Harvard	BRD-K21987633			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19+,23-/m1/s1	AEYCXANGZGGWKX-CROMWVBPSA-N	459.273321314							95754
BRD-K63533538-001-01-8	LSM-16547	BRD-K63533538	54618413	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19+,24+/m0/s1	DUJQZBWFZFXOJW-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K63533538	BRD-K63533538-001-01-8	Broad Institute of MIT and Harvard	BRD-K63533538			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19+,24+/m0/s1	DUJQZBWFZFXOJW-XLNZFTOWSA-N	465.26275663							105184
BRD-K77987559	LSM-7864		54618489	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20+,25+/m1/s1	ZRJLNIRQYSTGIF-RNHFSVANSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3F)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K77987559	BRD-K77987559-001-01-4	Broad Institute of MIT and Harvard	BRD-K77987559			CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3F)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20+,25+/m1/s1	ZRJLNIRQYSTGIF-RNHFSVANSA-N	531.220320108							96485
BRD-K33593585	LSM-43387		54618400	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17-,22+/m0/s1	DRXNQUOVPOKVMH-ZMVFXSKFSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K33593585	BRD-K33593585-001-01-1	Broad Institute of MIT and Harvard	BRD-K33593585			C\C=C\c1cnc2O[C@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17-,22+/m0/s1	DRXNQUOVPOKVMH-ZMVFXSKFSA-N	470.232933712							
BRD-K30079954	LSM-7236		54618576	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20-,25-/m0/s1	IXCMNLOSFSWDKI-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K30079954	BRD-K30079954-001-01-7	Broad Institute of MIT and Harvard	BRD-K30079954			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20-,25-/m0/s1	IXCMNLOSFSWDKI-RLSLOFABSA-N	503.245392004							95857
BRD-K88786138	LSM-7985		54618666	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19-,24+/m1/s1	DUJQZBWFZFXOJW-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K88786138	BRD-K88786138-001-01-7	Broad Institute of MIT and Harvard	BRD-K88786138			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19-,24+/m1/s1	DUJQZBWFZFXOJW-IECBHUPTSA-N	465.26275663							96606
BRD-K29824954	LSM-7231		54618447	InChI=1S/C31H40N2O6S/c1-22-18-33(23(2)21-34)40(37,38)30-15-14-25(11-6-10-24-8-4-5-9-24)17-28(30)39-29(22)20-32(3)19-26-12-7-13-27(16-26)31(35)36/h7,12-17,22-24,29,34H,4-5,8-10,18-21H2,1-3H3,(H,35,36)/t22-,23+,29+/m0/s1	DKZVPIDPIJUHTD-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3cc(ccc3S1(=O)=O)C#CCC4CCCC4	BroadT	BRD-K29824954	BRD-K29824954-001-01-9	Broad Institute of MIT and Harvard	BRD-K29824954			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2cc(ccc2S1(=O)=O)C#CCC1CCCC1	InChI=1S/C31H40N2O6S/c1-22-18-33(23(2)21-34)40(37,38)30-15-14-25(11-6-10-24-8-4-5-9-24)17-28(30)39-29(22)20-32(3)19-26-12-7-13-27(16-26)31(35)36/h7,12-17,22-24,29,34H,4-5,8-10,18-21H2,1-3H3,(H,35,36)/t22-,23+,29+/m0/s1	DKZVPIDPIJUHTD-QFWOEDSFSA-N	568.26070771							95852
BRD-K12108140	LSM-7005		54618636	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19-,23+/m1/s1	XXZIILLLBOPLBY-KCESLBEFSA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K12108140	BRD-K12108140-001-01-1	Broad Institute of MIT and Harvard	BRD-K12108140			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19-,23+/m1/s1	XXZIILLLBOPLBY-KCESLBEFSA-N	480.237270164							95626
BRD-A18477699	LSM-6860		44505711	InChI=1S/C28H37N3O6S/c1-6-7-23(33)11-10-22-14-25-27(29-15-22)37-26(20(3)16-31(28(25)34)21(4)18-32)17-30(5)38(35,36)24-12-8-19(2)9-13-24/h8-9,12-15,20-21,23,26,32-33H,6-7,16-18H2,1-5H3/t20-,21+,23?,26-/m0/s1	CGTVCXLGQUHMAP-GHLWETIGSA-N	CCCC(O)C#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3ccc(C)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-A18477699	BRD-A18477699-001-01-1	Broad Institute of MIT and Harvard	BRD-A18477699			CCCC(O)C#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3ccc(C)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H37N3O6S/c1-6-7-23(33)11-10-22-14-25-27(29-15-22)37-26(20(3)16-31(28(25)34)21(4)18-32)17-30(5)38(35,36)24-12-8-19(2)9-13-24/h8-9,12-15,20-21,23,26,32-33H,6-7,16-18H2,1-5H3/t20-,21+,23?,26-/m0/s1	CGTVCXLGQUHMAP-GHLWETIGSA-N	543.240306624							95481
BRD-K42899395	LSM-8236		54618634	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22+,29-/m0/s1	CBOPBGRHGQIOTR-KERYWQKISA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)c4cccc(c4)C(=O)N(C)C)cc1	BroadT	BRD-K42899395	BRD-K42899395-001-01-1	Broad Institute of MIT and Harvard	BRD-K42899395			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)-c2cccc(c2)C(=O)N(C)C)cc1	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22+,29-/m0/s1	CBOPBGRHGQIOTR-KERYWQKISA-N	624.26177035							96857
BRD-K00083176	LSM-6861		54618647	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19-,23+/m1/s1	XXZIILLLBOPLBY-ZQAYVECASA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K00083176	BRD-K00083176-001-01-7	Broad Institute of MIT and Harvard	BRD-K00083176			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19-,23+/m1/s1	XXZIILLLBOPLBY-ZQAYVECASA-N	480.237270164							95482
BRD-K01162658	LSM-43354		54618406	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22-,28+/m0/s1	RWAKEFQIDXFPPV-XBJSIWBMSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K01162658	BRD-K01162658-001-01-5	Broad Institute of MIT and Harvard	BRD-K01162658			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22-,28+/m0/s1	RWAKEFQIDXFPPV-XBJSIWBMSA-N	565.22465656							
BRD-K02655584	LSM-6895		54618564	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17+,21-/m0/s1	YNLPQPKWJFYZTR-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K02655584	BRD-K02655584-001-01-6	Broad Institute of MIT and Harvard	BRD-K02655584			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17+,21-/m0/s1	YNLPQPKWJFYZTR-FVJLSDCUSA-N	461.198441812							95516
BRD-K48527688	LSM-7471		54618677	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20+,25-/m1/s1	RZEXHRSKTOKTQU-OHUGHZGNSA-N	COc1ccccc1C#Cc2cnc3O[C@H](CN(C)S(=O)(=O)c4cn(C)cn4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K48527688	BRD-K48527688-001-01-8	Broad Institute of MIT and Harvard	BRD-K48527688			COc1ccccc1C#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20+,25-/m1/s1	RZEXHRSKTOKTQU-OHUGHZGNSA-N	567.215154516							96092
BRD-K48228567	LSM-7470		54618662	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20-,25+/m1/s1	DGMJKRBCRMVRNT-FHAGJXEFSA-N	CC(C)CC#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K48228567	BRD-K48228567-001-01-9	Broad Institute of MIT and Harvard	BRD-K48228567			CC(C)CC#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H34FN3O4/c1-18(2)8-6-9-21-12-24-26(30-14-21)36-25(19(3)15-32(28(24)35)20(4)17-33)16-31(5)27(34)22-10-7-11-23(29)13-22/h7,10-14,18-20,25,33H,8,15-17H2,1-5H3/t19-,20-,25+/m1/s1	DGMJKRBCRMVRNT-FHAGJXEFSA-N	495.253334798							96091
BRD-K90912017	LSM-8002		54618405	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18-,25+/m1/s1	PGLSEMLPCXRKER-GAKIBJFNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(cc4C1=O)C5=CCCC5	BroadT	BRD-K90912017	BRD-K90912017-001-01-1	Broad Institute of MIT and Harvard	BRD-K90912017			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18-,25+/m1/s1	PGLSEMLPCXRKER-GAKIBJFNSA-N	507.236935806							96623
MLS003129093	LSM-7993	BRD-K89536088, SID99359698	46904260	InChI=1S/C23H28BrN3O5/c1-14-10-27(15(2)13-28)22(29)19-8-17(24)9-25-21(19)32-20(14)12-26(3)11-16-6-4-5-7-18(16)23(30)31/h4-9,14-15,20,28H,10-13H2,1-3H3,(H,30,31)/t14-,15+,20+/m1/s1	NTJUTHLQVNPFFN-SIFCLUCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(=O)O)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K89536088	BRD-K89536088-001-01-5	Broad Institute of MIT and Harvard	BRD-K89536088			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(O)=O)Oc2ncc(Br)cc2C1=O	InChI=1S/C23H28BrN3O5/c1-14-10-27(15(2)13-28)22(29)19-8-17(24)9-25-21(19)32-20(14)12-26(3)11-16-6-4-5-7-18(16)23(30)31/h4-9,14-15,20,28H,10-13H2,1-3H3,(H,30,31)/t14-,15+,20+/m1/s1	NTJUTHLQVNPFFN-SIFCLUCFSA-N	505.121233626							96614
BRD-K67936348	LSM-7755		54618506	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19+,25-/m1/s1	ZMBSZSRZHSICHB-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)c4ccc(F)cc4	BroadT	BRD-K67936348	BRD-K67936348-001-01-9	Broad Institute of MIT and Harvard	BRD-K67936348			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1ccc(F)cc1	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19+,25-/m1/s1	ZMBSZSRZHSICHB-HHJKRLRDSA-N	506.232933712							96376
BRD-K02072940	LSM-6888		54618410	InChI=1S/C32H35N3O5/c1-22-18-35(23(2)21-36)31(37)28-16-26(11-7-10-24-8-5-4-6-9-24)17-33-30(28)40-29(22)20-34(3)19-25-12-14-27(15-13-25)32(38)39/h4-6,8-9,12-17,22-23,29,36H,10,18-21H2,1-3H3,(H,38,39)/t22-,23-,29-/m0/s1	FGMBKJAJBFHUEJ-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K02072940	BRD-K02072940-001-01-3	Broad Institute of MIT and Harvard	BRD-K02072940			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C32H35N3O5/c1-22-18-35(23(2)21-36)31(37)28-16-26(11-7-10-24-8-5-4-6-9-24)17-33-30(28)40-29(22)20-34(3)19-25-12-14-27(15-13-25)32(38)39/h4-6,8-9,12-17,22-23,29,36H,10,18-21H2,1-3H3,(H,38,39)/t22-,23-,29-/m0/s1	FGMBKJAJBFHUEJ-BOSRLCDASA-N	541.25767125							95509
MLS003128950	LSM-7541	BRD-K53549851, SID99359516	46904078	InChI=1S/C23H28BrN3O5/c1-14-10-27(15(2)13-28)22(29)19-8-17(24)9-25-21(19)32-20(14)12-26(3)11-16-6-4-5-7-18(16)23(30)31/h4-9,14-15,20,28H,10-13H2,1-3H3,(H,30,31)/t14-,15-,20-/m0/s1	NTJUTHLQVNPFFN-AVYPCKFXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(=O)O)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K53549851	BRD-K53549851-001-01-5	Broad Institute of MIT and Harvard	BRD-K53549851			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(O)=O)Oc2ncc(Br)cc2C1=O	InChI=1S/C23H28BrN3O5/c1-14-10-27(15(2)13-28)22(29)19-8-17(24)9-25-21(19)32-20(14)12-26(3)11-16-6-4-5-7-18(16)23(30)31/h4-9,14-15,20,28H,10-13H2,1-3H3,(H,30,31)/t14-,15-,20-/m0/s1	NTJUTHLQVNPFFN-AVYPCKFXSA-N	505.121233626							96162
BRD-K64217932	LSM-7707		54618541	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19+,24+/m1/s1	HVXCQDGXUZNQFT-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC(C)(C)O	BroadT	BRD-K64217932	BRD-K64217932-001-01-9	Broad Institute of MIT and Harvard	BRD-K64217932			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC(C)(C)O	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19+,24+/m1/s1	HVXCQDGXUZNQFT-IMWIBFENSA-N	483.253334798							96328
BRD-K29890753	LSM-7232		54618453	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19-,24+/m0/s1	HVXCQDGXUZNQFT-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC(C)(C)O	BroadT	BRD-K29890753	BRD-K29890753-001-01-3	Broad Institute of MIT and Harvard	BRD-K29890753			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC(C)(C)O	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19-,24+/m0/s1	HVXCQDGXUZNQFT-AXHZCLLHSA-N	483.253334798							95853
BRD-K54381125	LSM-7557		54618421	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22+/m0/s1	OBRGIGMGBKKHMR-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccccn3	BroadT	BRD-K54381125	BRD-K54381125-001-01-2	Broad Institute of MIT and Harvard	BRD-K54381125			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccn1	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22+/m0/s1	OBRGIGMGBKKHMR-NJNPRVFISA-N	443.187877128							96178
BRD-K81121951	LSM-7906		54618632	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20-,25+/m0/s1	MNWVVWQDNRNIMM-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K81121951	BRD-K81121951-001-01-8	Broad Institute of MIT and Harvard	BRD-K81121951			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20-,25+/m0/s1	MNWVVWQDNRNIMM-ZYLNGJIFSA-N	567.187305418							96527
CHEMBL2358139	LSM-16548	SID131413503, BRD-K23906563	54618414	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21-,29+/m0/s1	MIOBFWIJYZOKSQ-LRZFZUCMSA-N	COc1ccccc1C#Cc2cnc3O[C@H](CN(C)C(=O)c4ccc5OCOc5c4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K23906563	BRD-K23906563-001-01-3	Broad Institute of MIT and Harvard	BRD-K23906563			COc1ccccc1C#Cc1cnc2O[C@H](CN(C)C(=O)c3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21-,29+/m0/s1	MIOBFWIJYZOKSQ-LRZFZUCMSA-N	571.231850426							105185
BRD-K37168393	LSM-7324		54618568	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22+/m0/s1	OBRGIGMGBKKHMR-NPPFBWRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccccn3	BroadT	BRD-K37168393	BRD-K37168393-001-01-0	Broad Institute of MIT and Harvard	BRD-K37168393			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccn1	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22+/m0/s1	OBRGIGMGBKKHMR-NPPFBWRTSA-N	443.187877128							95945
CHEMBL2135140	LSM-7402	SID131413549, BRD-K43714340	54618460	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20-,25-/m1/s1	GCPZFZZKEDFKSA-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K43714340	BRD-K43714340-001-01-7	Broad Institute of MIT and Harvard	BRD-K43714340			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20-,25-/m1/s1	GCPZFZZKEDFKSA-UMEGOILYSA-N	500.234492962							96023
BRD-K75418563	LSM-6850		54618673	InChI=1S/C27H36N2O5S/c1-6-14-28(4)18-26-20(2)17-29(21(3)19-30)35(31,32)27-13-12-23(16-25(27)34-26)11-10-22-8-7-9-24(15-22)33-5/h7-9,12-13,15-16,20-21,26,30H,6,14,17-19H2,1-5H3/t20-,21+,26-/m1/s1	BMTZFXAWOLTARL-YZIHRLCOSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc3cccc(OC)c3	BroadT	BRD-K75418563	BRD-K75418563-001-01-6	Broad Institute of MIT and Harvard	BRD-K75418563			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc1cccc(OC)c1	InChI=1S/C27H36N2O5S/c1-6-14-28(4)18-26-20(2)17-29(21(3)19-30)35(31,32)27-13-12-23(16-25(27)34-26)11-10-22-8-7-9-24(15-22)33-5/h7-9,12-13,15-16,20-21,26,30H,6,14,17-19H2,1-5H3/t20-,21+,26-/m1/s1	BMTZFXAWOLTARL-YZIHRLCOSA-N	500.234492962							95471
BRD-K25441114	LSM-7173		54618534	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17+,22+/m0/s1	YKCDBQLHOOFCLT-GSHUGGBRSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K25441114	BRD-K25441114-001-01-3	Broad Institute of MIT and Harvard	BRD-K25441114			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17+,22+/m0/s1	YKCDBQLHOOFCLT-GSHUGGBRSA-N	494.188685622							95794
BRD-K69516264	LSM-7777		54618603	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23+,30-/m1/s1	ANXFQERLRQGOSV-DUELTEGESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ncc(cc4C1=O)c5cncnc5	BroadT	BRD-K69516264	BRD-K69516264-001-01-7	Broad Institute of MIT and Harvard	BRD-K69516264			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23+,30-/m1/s1	ANXFQERLRQGOSV-DUELTEGESA-N	553.26890465							96398
CHEMBL2138884	LSM-7537	BRD-K53255530, SID131413673	54618578	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20-,27-/m1/s1	YBZIDMTZSSULOY-SEXOINJZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5ccccc5	BroadT	BRD-K53255530	BRD-K53255530-001-01-8	Broad Institute of MIT and Harvard	BRD-K53255530			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20-,27-/m1/s1	YBZIDMTZSSULOY-SEXOINJZSA-N	552.193022074							96158
BRD-K65409714	LSM-7719		54618482	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20-,25-/m1/s1	MNWVVWQDNRNIMM-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K65409714	BRD-K65409714-001-01-5	Broad Institute of MIT and Harvard	BRD-K65409714			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20-,25-/m1/s1	MNWVVWQDNRNIMM-UMEGOILYSA-N	567.187305418							96340
BRD-K10182851	LSM-6983		54618529	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19-,23-/m1/s1	AEYCXANGZGGWKX-FZONSQQESA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K10182851	BRD-K10182851-001-01-7	Broad Institute of MIT and Harvard	BRD-K10182851			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19-,23-/m1/s1	AEYCXANGZGGWKX-FZONSQQESA-N	459.273321314							95604
BRD-K62051893	LSM-7674		54618464	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21-,27+/m1/s1	SOBUUYUTYHYENZ-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccc4F	BroadT	BRD-K62051893	BRD-K62051893-001-01-1	Broad Institute of MIT and Harvard	BRD-K62051893			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccc1F	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21-,27+/m1/s1	SOBUUYUTYHYENZ-GNMOFYLKSA-N	521.268984862							96295
BRD-K52797126	LSM-7532		54618398	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19+,23-/m0/s1	XXZIILLLBOPLBY-LVBDUCALSA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K52797126	BRD-K52797126-001-01-0	Broad Institute of MIT and Harvard	BRD-K52797126			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19+,23-/m0/s1	XXZIILLLBOPLBY-LVBDUCALSA-N	480.237270164							96153
BRD-K00241248	LSM-6863		54618408	InChI=1S/C32H35N3O5/c1-22-18-35(23(2)21-36)31(37)28-16-26(11-7-10-24-8-5-4-6-9-24)17-33-30(28)40-29(22)20-34(3)19-25-12-14-27(15-13-25)32(38)39/h4-6,8-9,12-17,22-23,29,36H,10,18-21H2,1-3H3,(H,38,39)/t22-,23+,29-/m1/s1	FGMBKJAJBFHUEJ-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K00241248	BRD-K00241248-001-01-5	Broad Institute of MIT and Harvard	BRD-K00241248			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C32H35N3O5/c1-22-18-35(23(2)21-36)31(37)28-16-26(11-7-10-24-8-5-4-6-9-24)17-33-30(28)40-29(22)20-34(3)19-25-12-14-27(15-13-25)32(38)39/h4-6,8-9,12-17,22-23,29,36H,10,18-21H2,1-3H3,(H,38,39)/t22-,23+,29-/m1/s1	FGMBKJAJBFHUEJ-RLPNJSHFSA-N	541.25767125							95484
BRD-K78764313	LSM-7877		54618428	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17-,21+/m1/s1	MNKHAAOLWRLKCW-LZJOCLMNSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC3CC3	BroadT	BRD-K78764313	BRD-K78764313-001-01-3	Broad Institute of MIT and Harvard	BRD-K78764313			CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC1CC1	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17-,21+/m1/s1	MNKHAAOLWRLKCW-LZJOCLMNSA-N	442.258005608							96498
BRD-K93545352	LSM-8043		54618518	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23-,28+/m1/s1	NJKSHKHIQBEBBM-MRJKTFCFSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@@H](CN(C)C(=O)CN4CCOCC4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K93545352	BRD-K93545352-001-01-9	Broad Institute of MIT and Harvard	BRD-K93545352			COc1ccc(cc1)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)CN3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23-,28+/m1/s1	NJKSHKHIQBEBBM-MRJKTFCFSA-N	585.250871308							96664
BRD-K59730983	LSM-7638		54618681	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20-,27-/m0/s1	YBZIDMTZSSULOY-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5ccccc5	BroadT	BRD-K59730983	BRD-K59730983-001-01-6	Broad Institute of MIT and Harvard	BRD-K59730983			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20-,27-/m0/s1	YBZIDMTZSSULOY-OSOCVKALSA-N	552.193022074							96259
CHEMBL2139042	LSM-7955	BRD-K86524553, SID131413564	54618475	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23+,30+/m0/s1	ANXFQERLRQGOSV-DDFCPOBKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ncc(cc4C1=O)c5cncnc5	BroadT	BRD-K86524553	BRD-K86524553-001-01-0	Broad Institute of MIT and Harvard	BRD-K86524553			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23+,30+/m0/s1	ANXFQERLRQGOSV-DDFCPOBKSA-N	553.26890465							96576
BRD-K01355066	LSM-6877		54618614	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21+,26+/m1/s1	GVDJVSBPXRZCOM-SWYRRKHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K01355066	BRD-K01355066-001-01-1	Broad Institute of MIT and Harvard	BRD-K01355066			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21+,26+/m1/s1	GVDJVSBPXRZCOM-SWYRRKHMSA-N	512.245726362							95498
BRD-K04618303	LSM-6920		54618551	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21-,27+/m1/s1	IVQXIBZAZBUJJC-GNMOFYLKSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)C#Cc4ccncc4)c1	BroadT	BRD-K04618303	BRD-K04618303-001-01-2	Broad Institute of MIT and Harvard	BRD-K04618303			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)C#Cc2ccncc2)c1	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21-,27+/m1/s1	IVQXIBZAZBUJJC-GNMOFYLKSA-N	543.248169206							95541
BRD-K11976754	LSM-7000		54618588	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17-,21-/m0/s1	YNLPQPKWJFYZTR-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K11976754	BRD-K11976754-001-01-9	Broad Institute of MIT and Harvard	BRD-K11976754			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17-,21-/m0/s1	YNLPQPKWJFYZTR-FIKGOQFSSA-N	461.198441812							95621
BRD-K28065812	LSM-7207		54618680	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19+,23-/m0/s1	XXZIILLLBOPLBY-XWQURZDVSA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K28065812	BRD-K28065812-001-01-2	Broad Institute of MIT and Harvard	BRD-K28065812			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19+,23-/m0/s1	XXZIILLLBOPLBY-XWQURZDVSA-N	480.237270164							95828
CHEMBL3187157	LSM-7472	BRD-K48582996	54618665	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23+,30+/m1/s1	ANXFQERLRQGOSV-HFZPWKHCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ncc(cc4C1=O)c5cncnc5	BroadT	BRD-K48582996	BRD-K48582996-001-01-0	Broad Institute of MIT and Harvard	BRD-K48582996			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23+,30+/m1/s1	ANXFQERLRQGOSV-HFZPWKHCSA-N	553.26890465							96093
BRD-K12091863	LSM-7003		54618535	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20-,25-/m0/s1	MNWVVWQDNRNIMM-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K12091863	BRD-K12091863-001-01-4	Broad Institute of MIT and Harvard	BRD-K12091863			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20-,25-/m0/s1	MNWVVWQDNRNIMM-RLSLOFABSA-N	567.187305418							95624
BRD-K60339813	LSM-7648		54618499	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21+,27+/m0/s1	PIKMQEDGBFJLCE-FYQCMVGJSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)C4=CCCCC4	BroadT	BRD-K60339813	BRD-K60339813-001-01-9	Broad Institute of MIT and Harvard	BRD-K60339813			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCCC1	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21+,27+/m0/s1	PIKMQEDGBFJLCE-FYQCMVGJSA-N	578.212042956							96269
BRD-K88597074	LSM-7983		54618422	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23-,30-/m0/s1	ANXFQERLRQGOSV-ZRLASMASSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ncc(cc4C1=O)c5cncnc5	BroadT	BRD-K88597074	BRD-K88597074-001-01-4	Broad Institute of MIT and Harvard	BRD-K88597074			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23-,30-/m0/s1	ANXFQERLRQGOSV-ZRLASMASSA-N	553.26890465							96604
BRD-K20103689	LSM-7115		54618545	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19+,25+/m1/s1	KAJKYFHMOFZFFV-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K20103689	BRD-K20103689-001-01-9	Broad Institute of MIT and Harvard	BRD-K20103689			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H33FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-13-10-22(20-6-4-5-7-20)14-24(26)35-25(18)16-29(3)27(32)21-8-11-23(28)12-9-21/h6,8-14,18-19,25,31H,4-5,7,15-17H2,1-3H3/t18-,19+,25+/m1/s1	KAJKYFHMOFZFFV-WYEJZRMESA-N	516.209421066							95736
BRD-K86752593	LSM-7958		54618617	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17-,22+/m0/s1	YKCDBQLHOOFCLT-PNLZDCPESA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K86752593	BRD-K86752593-001-01-9	Broad Institute of MIT and Harvard	BRD-K86752593			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17-,22+/m0/s1	YKCDBQLHOOFCLT-PNLZDCPESA-N	494.188685622							96579
CHEMBL2141591	LSM-7182	BRD-K26309991, SID131413533	54618444	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21+,27+/m1/s1	IVQXIBZAZBUJJC-BUEREQSYSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)C#Cc4ccncc4)c1	BroadT	BRD-K26309991	BRD-K26309991-001-01-9	Broad Institute of MIT and Harvard	BRD-K26309991			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)C#Cc2ccncc2)c1	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21+,27+/m1/s1	IVQXIBZAZBUJJC-BUEREQSYSA-N	543.248169206							95803
BRD-K22673215	LSM-7143		54618517	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18+,25-/m0/s1	PGLSEMLPCXRKER-ATLLOTDBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(cc4C1=O)C5=CCCC5	BroadT	BRD-K22673215	BRD-K22673215-001-01-2	Broad Institute of MIT and Harvard	BRD-K22673215			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C28H33N3O6/c1-17-13-31(18(2)15-32)28(34)22-10-21(19-6-4-5-7-19)12-29-26(22)37-25(17)14-30(3)27(33)20-8-9-23-24(11-20)36-16-35-23/h6,8-12,17-18,25,32H,4-5,7,13-16H2,1-3H3/t17-,18+,25-/m0/s1	PGLSEMLPCXRKER-ATLLOTDBSA-N	507.236935806							95764
BRD-K49335566-001-01-2	LSM-43405	BRD-K49335566	44484543	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22+,28-/m0/s1	RWAKEFQIDXFPPV-LLOGFUMASA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K49335566	BRD-K49335566-001-02-0	Broad Institute of MIT and Harvard	BRD-K49335566			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22+,28-/m0/s1	RWAKEFQIDXFPPV-LLOGFUMASA-N	565.22465656							
BRD-K11054980	LSM-6992		54618525	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20-,27+/m1/s1	KSASPYMRGHUFQD-DVHCVUMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccc(F)cc4	BroadT	BRD-K11054980	BRD-K11054980-001-01-1	Broad Institute of MIT and Harvard	BRD-K11054980			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20-,27+/m1/s1	KSASPYMRGHUFQD-DVHCVUMVSA-N	556.204335686							95613
BRD-K83631404	LSM-7925		54618692	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20+,25+/m1/s1	MNWVVWQDNRNIMM-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K83631404	BRD-K83631404-001-01-7	Broad Institute of MIT and Harvard	BRD-K83631404			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H34FN3O6S2/c1-19-16-30(20(2)18-31)38(34,35)26-12-11-21(8-7-13-28(3)4)14-24(26)36-25(19)17-29(5)37(32,33)23-10-6-9-22(27)15-23/h6,9-12,14-15,19-20,25,31H,13,16-18H2,1-5H3/t19-,20+,25+/m1/s1	MNWVVWQDNRNIMM-RNHFSVANSA-N	567.187305418							96546
BRD-K34055449	LSM-7289		54618646	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20-,25+/m1/s1	IXCMNLOSFSWDKI-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K34055449	BRD-K34055449-001-01-6	Broad Institute of MIT and Harvard	BRD-K34055449			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20-,25+/m1/s1	IXCMNLOSFSWDKI-FHAGJXEFSA-N	503.245392004							95910
BRD-K20877213	LSM-7123		54618403	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21+,27+/m0/s1	IVQXIBZAZBUJJC-FYQCMVGJSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)C#Cc4ccncc4)c1	BroadT	BRD-K20877213	BRD-K20877213-001-01-3	Broad Institute of MIT and Harvard	BRD-K20877213			COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)C#Cc2ccncc2)c1	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21+,27+/m0/s1	IVQXIBZAZBUJJC-FYQCMVGJSA-N	543.248169206							95744
BRD-K44245916	LSM-7407		54618395	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17+,21-/m1/s1	YNLPQPKWJFYZTR-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K44245916	BRD-K44245916-001-01-5	Broad Institute of MIT and Harvard	BRD-K44245916			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17+,21-/m1/s1	YNLPQPKWJFYZTR-LLGFUMIMSA-N	461.198441812							96028
BRD-K19593188	LSM-7103		54618510	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23+,28-/m0/s1	NJKSHKHIQBEBBM-JWZKTCGFSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@@H](CN(C)C(=O)CN4CCOCC4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K19593188	BRD-K19593188-001-01-0	Broad Institute of MIT and Harvard	BRD-K19593188			COc1ccc(cc1)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)CN3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23+,28-/m0/s1	NJKSHKHIQBEBBM-JWZKTCGFSA-N	585.250871308							95724
BRD-K27824357	LSM-7202		54618409	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19+,23+/m1/s1	AEYCXANGZGGWKX-GBPOLFSSSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K27824357	BRD-K27824357-001-01-4	Broad Institute of MIT and Harvard	BRD-K27824357			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H37N3O5/c1-17-13-28(18(2)16-29)25(31)22-11-21(6-5-19(3)30)12-26-24(22)33-23(17)15-27(4)14-20-7-9-32-10-8-20/h11-12,17-20,23,29-30H,7-10,13-16H2,1-4H3/t17-,18-,19+,23+/m1/s1	AEYCXANGZGGWKX-GBPOLFSSSA-N	459.273321314							95823
BRD-K14203250	LSM-7040		54618594	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19+,23+/m1/s1	XXZIILLLBOPLBY-XQQXVUDOSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K14203250	BRD-K14203250-001-01-4	Broad Institute of MIT and Harvard	BRD-K14203250			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19+,23+/m1/s1	XXZIILLLBOPLBY-XQQXVUDOSA-N	480.237270164							95661
BRD-K62283710	LSM-7678		54618674	InChI=1S/C24H33FN2O4S/c1-5-11-26(4)15-23-17(2)14-27(18(3)16-28)32(29,30)24-10-9-20(13-22(24)31-23)19-7-6-8-21(25)12-19/h6-10,12-13,17-18,23,28H,5,11,14-16H2,1-4H3/t17-,18-,23-/m1/s1	BJNIKYIOOVPCTN-PMAPCBKXSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3cccc(F)c3	BroadT	BRD-K62283710	BRD-K62283710-001-01-1	Broad Institute of MIT and Harvard	BRD-K62283710			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1cccc(F)c1	InChI=1S/C24H33FN2O4S/c1-5-11-26(4)15-23-17(2)14-27(18(3)16-28)32(29,30)24-10-9-20(13-22(24)31-23)19-7-6-8-21(25)12-19/h6-10,12-13,17-18,23,28H,5,11,14-16H2,1-4H3/t17-,18-,23-/m1/s1	BJNIKYIOOVPCTN-PMAPCBKXSA-N	464.214506446							96299
BRD-K08844227	LSM-6968		54618669	InChI=1S/C32H36N4O5S/c1-23-18-36(24(2)21-37)42(38,39)32-14-11-26(27-16-33-22-34-17-27)15-30(32)41-31(23)20-35(3)19-25-9-12-29(13-10-25)40-28-7-5-4-6-8-28/h4-17,22-24,31,37H,18-21H2,1-3H3/t23-,24-,31-/m0/s1	JYEISQCWLZSNSR-MKGJDZFWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4cc(ccc4S1(=O)=O)c5cncnc5	BroadT	BRD-K08844227	BRD-K08844227-001-01-3	Broad Institute of MIT and Harvard	BRD-K08844227			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C32H36N4O5S/c1-23-18-36(24(2)21-37)42(38,39)32-14-11-26(27-16-33-22-34-17-27)15-30(32)41-31(23)20-35(3)19-25-9-12-29(13-10-25)40-28-7-5-4-6-8-28/h4-17,22-24,31,37H,18-21H2,1-3H3/t23-,24-,31-/m0/s1	JYEISQCWLZSNSR-MKGJDZFWSA-N	588.240640982							95589
BRD-K47499097	LSM-7456		54618488	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20+,26+/m1/s1	XRFBPINVKMLPSW-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K47499097	BRD-K47499097-001-01-6	Broad Institute of MIT and Harvard	BRD-K47499097			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C30H35N5O5/c1-19-16-35(20(2)18-36)30(39)25-14-24(21-6-8-22(9-7-21)28(37)33(3)4)15-32-27(25)40-26(19)17-34(5)29(38)23-10-12-31-13-11-23/h6-15,19-20,26,36H,16-18H2,1-5H3/t19-,20+,26+/m1/s1	XRFBPINVKMLPSW-GOHWNWGWSA-N	545.26381927							96077
BRD-K60245465	LSM-7647		54618660	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20-,25-/m0/s1	ZRJLNIRQYSTGIF-RLSLOFABSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3F)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K60245465	BRD-K60245465-001-01-9	Broad Institute of MIT and Harvard	BRD-K60245465			CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3F)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20-,25-/m0/s1	ZRJLNIRQYSTGIF-RLSLOFABSA-N	531.220320108							96268
BRD-K77282409	LSM-7852		54618622	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21+,29-/m0/s1	MIOBFWIJYZOKSQ-FONBTEPMSA-N	COc1ccccc1C#Cc2cnc3O[C@@H](CN(C)C(=O)c4ccc5OCOc5c4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K77282409	BRD-K77282409-001-01-2	Broad Institute of MIT and Harvard	BRD-K77282409			COc1ccccc1C#Cc1cnc2O[C@@H](CN(C)C(=O)c3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21+,29-/m0/s1	MIOBFWIJYZOKSQ-FONBTEPMSA-N	571.231850426							96473
BRD-K93165404	LSM-43436		54618597	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17-,22-/m1/s1	DRXNQUOVPOKVMH-SIGWBNOHSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K93165404	BRD-K93165404-001-01-4	Broad Institute of MIT and Harvard	BRD-K93165404			C\C=C\c1cnc2O[C@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17-,22-/m1/s1	DRXNQUOVPOKVMH-SIGWBNOHSA-N	470.232933712							
BRD-K95438730-001-01-8	LSM-8069	BRD-K95438730	54618667	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23-,30-/m1/s1	ANXFQERLRQGOSV-IQLGONJTSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ncc(cc4C1=O)c5cncnc5	BroadT	BRD-K95438730	BRD-K95438730-001-02-6	Broad Institute of MIT and Harvard	BRD-K95438730			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C32H35N5O4/c1-22-17-37(23(2)20-38)32(39)29-13-25(26-14-33-21-34-15-26)16-35-31(29)41-30(22)19-36(3)18-24-9-11-28(12-10-24)40-27-7-5-4-6-8-27/h4-16,21-23,30,38H,17-20H2,1-3H3/t22-,23-,30-/m1/s1	ANXFQERLRQGOSV-IQLGONJTSA-N	553.26890465							96690
BRD-K97492549	LSM-8082		54618432	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21+,27+/m1/s1	SOBUUYUTYHYENZ-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccc4F	BroadT	BRD-K97492549	BRD-K97492549-001-01-4	Broad Institute of MIT and Harvard	BRD-K97492549			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccc1F	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21+,27+/m1/s1	SOBUUYUTYHYENZ-BUEREQSYSA-N	521.268984862							96703
BRD-K29060081	LSM-43383		54618633	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19+,23+/m0/s1	JSQMQZOUAVKGAV-AZLMFYNDSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K29060081	BRD-K29060081-001-01-6	Broad Institute of MIT and Harvard	BRD-K29060081			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-5-7-20-9-10-24-22(12-20)33-23(18(2)15-28(19(3)17-29)34(24,31)32)16-27(4)25(30)13-21-8-6-11-26-14-21/h5-12,14,18-19,23,29H,13,15-17H2,1-4H3/b7-5+/t18-,19+,23+/m0/s1	JSQMQZOUAVKGAV-AZLMFYNDSA-N	487.214091876							
BRD-K32051704	LSM-7265		54618516	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21+,27-/m1/s1	RIEPFGYATXCXRE-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K32051704	BRD-K32051704-001-01-7	Broad Institute of MIT and Harvard	BRD-K32051704			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C29H34FN3O5S/c1-19-7-5-6-8-25(19)22-9-14-28-26(15-22)38-27(20(2)16-33(21(3)18-34)39(28,36)37)17-32(4)29(35)31-24-12-10-23(30)11-13-24/h5-15,20-21,27,34H,16-18H2,1-4H3,(H,31,35)/t20-,21+,27-/m1/s1	RIEPFGYATXCXRE-PBDKAQRYSA-N	555.220320108							95886
BRD-K22385434	LSM-7139		54618542	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18+,22+/m0/s1	SVKJOHOIDWZOJW-NJNPRVFISA-N	CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3	BroadT	BRD-K22385434	BRD-K22385434-001-01-8	Broad Institute of MIT and Harvard	BRD-K22385434			CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18+,22+/m0/s1	SVKJOHOIDWZOJW-NJNPRVFISA-N	411.252191946							95760
BRD-K54261877	LSM-7554		54618393	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21-,27-/m0/s1	IVQXIBZAZBUJJC-IZVMNLJQSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)C#Cc4ccncc4)c1	BroadT	BRD-K54261877	BRD-K54261877-001-01-6	Broad Institute of MIT and Harvard	BRD-K54261877			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)C#Cc2ccncc2)c1	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21-,27-/m0/s1	IVQXIBZAZBUJJC-IZVMNLJQSA-N	543.248169206							96175
BRD-K01619611	LSM-6882		54618604	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20-,25+/m0/s1	ZRJLNIRQYSTGIF-ZYLNGJIFSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3F)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K01619611	BRD-K01619611-001-01-0	Broad Institute of MIT and Harvard	BRD-K01619611			CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3F)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20-,25+/m0/s1	ZRJLNIRQYSTGIF-ZYLNGJIFSA-N	531.220320108							95503
BRD-K45941745	LSM-7435		54618478	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20-,25+/m1/s1	RZEXHRSKTOKTQU-FHAGJXEFSA-N	COc1ccccc1C#Cc2cnc3O[C@@H](CN(C)S(=O)(=O)c4cn(C)cn4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K45941745	BRD-K45941745-001-01-5	Broad Institute of MIT and Harvard	BRD-K45941745			COc1ccccc1C#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20-,25+/m1/s1	RZEXHRSKTOKTQU-FHAGJXEFSA-N	567.215154516							96056
BRD-K20093888	LSM-7114		54618631	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20-,25-/m1/s1	IXCMNLOSFSWDKI-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K20093888	BRD-K20093888-001-01-1	Broad Institute of MIT and Harvard	BRD-K20093888			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20-,25-/m1/s1	IXCMNLOSFSWDKI-UMEGOILYSA-N	503.245392004							95735
BRD-K54419202	LSM-7559		54618507	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22+,29-/m1/s1	CBOPBGRHGQIOTR-UETOGOEVSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)c4cccc(c4)C(=O)N(C)C)cc1	BroadT	BRD-K54419202	BRD-K54419202-001-01-6	Broad Institute of MIT and Harvard	BRD-K54419202			COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)-c2cccc(c2)C(=O)N(C)C)cc1	InChI=1S/C32H40N4O7S/c1-21-18-36(22(2)20-37)44(40,41)30-15-10-24(23-8-7-9-25(16-23)31(38)34(3)4)17-28(30)43-29(21)19-35(5)32(39)33-26-11-13-27(42-6)14-12-26/h7-17,21-22,29,37H,18-20H2,1-6H3,(H,33,39)/t21-,22+,29-/m1/s1	CBOPBGRHGQIOTR-UETOGOEVSA-N	624.26177035							96180
BRD-K88306141	LSM-7982		54618415	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19+,23+/m0/s1	XXZIILLLBOPLBY-PABYOWBDSA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K88306141	BRD-K88306141-001-01-9	Broad Institute of MIT and Harvard	BRD-K88306141			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18-,19+,23+/m0/s1	XXZIILLLBOPLBY-PABYOWBDSA-N	480.237270164							96603
BRD-K50801330	LSM-7500		54618587	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20-,25-/m1/s1	RZEXHRSKTOKTQU-UMEGOILYSA-N	COc1ccccc1C#Cc2cnc3O[C@H](CN(C)S(=O)(=O)c4cn(C)cn4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K50801330	BRD-K50801330-001-01-4	Broad Institute of MIT and Harvard	BRD-K50801330			COc1ccccc1C#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H33N5O6S/c1-19-14-33(20(2)17-34)28(35)23-12-21(10-11-22-8-6-7-9-24(22)38-5)13-29-27(23)39-25(19)15-32(4)40(36,37)26-16-31(3)18-30-26/h6-9,12-13,16,18-20,25,34H,14-15,17H2,1-5H3/t19-,20-,25-/m1/s1	RZEXHRSKTOKTQU-UMEGOILYSA-N	567.215154516							96121
BRD-K81080300	LSM-7905		54618531	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21-,27-/m1/s1	SOBUUYUTYHYENZ-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccc4F	BroadT	BRD-K81080300	BRD-K81080300-001-01-4	Broad Institute of MIT and Harvard	BRD-K81080300			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccc1F	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21-,27-/m1/s1	SOBUUYUTYHYENZ-LGVUCKNBSA-N	521.268984862							96526
BRD-K78908189	LSM-7881		54618571	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23-,28-/m0/s1	NJKSHKHIQBEBBM-LXWOLXCRSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@@H](CN(C)C(=O)CN4CCOCC4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K78908189	BRD-K78908189-001-01-7	Broad Institute of MIT and Harvard	BRD-K78908189			COc1ccc(cc1)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)CN3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23-,28-/m0/s1	NJKSHKHIQBEBBM-LXWOLXCRSA-N	585.250871308							96502
BRD-K33148516	LSM-7273		54618473	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20+,25-/m0/s1	ZRJLNIRQYSTGIF-DFIYOIEZSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3F)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K33148516	BRD-K33148516-001-01-8	Broad Institute of MIT and Harvard	BRD-K33148516			CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3F)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34FN3O5S/c1-5-6-7-10-21-13-14-26-24(15-21)36-25(19(2)16-31(20(3)18-32)37(26,34)35)17-30(4)27(33)29-23-12-9-8-11-22(23)28/h8-9,11-15,19-20,25,32H,5-6,16-18H2,1-4H3,(H,29,33)/t19-,20+,25-/m0/s1	ZRJLNIRQYSTGIF-DFIYOIEZSA-N	531.220320108							95894
BRD-K53756103	LSM-7544		54618581	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17+,21-/m1/s1	MNKHAAOLWRLKCW-LLGFUMIMSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC3CC3	BroadT	BRD-K53756103	BRD-K53756103-001-01-2	Broad Institute of MIT and Harvard	BRD-K53756103			CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1CC1	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17+,21-/m1/s1	MNKHAAOLWRLKCW-LLGFUMIMSA-N	442.258005608							96165
BRD-K11792293	LSM-6998		54618575	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22+/m1/s1	OBRGIGMGBKKHMR-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccccn3	BroadT	BRD-K11792293	BRD-K11792293-001-01-8	Broad Institute of MIT and Harvard	BRD-K11792293			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccn1	InChI=1S/C23H29N3O4S/c1-17-14-26(18(2)16-27)31(28,29)23-11-9-19(8-10-20-7-5-6-12-24-20)13-21(23)30-22(17)15-25(3)4/h5-7,9,11-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22+/m1/s1	OBRGIGMGBKKHMR-FGSXEWAUSA-N	443.187877128							95619
CHEMBL3184201	LSM-7802	BRD-K72515004	54618556	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21+,27-/m0/s1	PIKMQEDGBFJLCE-ISCCLHIJSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)C4=CCCCC4	BroadT	BRD-K72515004	BRD-K72515004-001-01-9	Broad Institute of MIT and Harvard	BRD-K72515004			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCCC1	InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21+,27-/m0/s1	PIKMQEDGBFJLCE-ISCCLHIJSA-N	578.212042956							96423
CHEMBL2359115	LSM-7575	BRD-K55282910, SID131413591	54618502	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18+,22-/m1/s1	SVKJOHOIDWZOJW-KGVIQGDOSA-N	CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3	BroadT	BRD-K55282910	BRD-K55282910-001-01-0	Broad Institute of MIT and Harvard	BRD-K55282910			CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1	InChI=1S/C24H33N3O3/c1-5-11-26(4)15-22-17(2)14-27(18(3)16-28)24(29)21-12-20(13-25-23(21)30-22)19-9-7-6-8-10-19/h6-10,12-13,17-18,22,28H,5,11,14-16H2,1-4H3/t17-,18+,22-/m1/s1	SVKJOHOIDWZOJW-KGVIQGDOSA-N	411.252191946							96196
BRD-K84113859	LSM-7929		54618590	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19-,23+/m0/s1	XXZIILLLBOPLBY-QPXQOZNCSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K84113859	BRD-K84113859-001-01-5	Broad Institute of MIT and Harvard	BRD-K84113859			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O5/c1-17-14-30(18(2)16-31)26(34)22-11-21(6-5-19(3)32)13-28-25(22)35-23(17)15-29(4)24(33)12-20-7-9-27-10-8-20/h7-11,13,17-19,23,31-32H,12,14-16H2,1-4H3/t17-,18+,19-,23+/m0/s1	XXZIILLLBOPLBY-QPXQOZNCSA-N	480.237270164							96550
BRD-K87217296	LSM-7967		54618468	InChI=1S/C32H35N3O5/c1-22-18-35(23(2)21-36)31(37)28-16-26(11-7-10-24-8-5-4-6-9-24)17-33-30(28)40-29(22)20-34(3)19-25-12-14-27(15-13-25)32(38)39/h4-6,8-9,12-17,22-23,29,36H,10,18-21H2,1-3H3,(H,38,39)/t22-,23-,29-/m1/s1	FGMBKJAJBFHUEJ-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K87217296	BRD-K87217296-001-01-2	Broad Institute of MIT and Harvard	BRD-K87217296			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C32H35N3O5/c1-22-18-35(23(2)21-36)31(37)28-16-26(11-7-10-24-8-5-4-6-9-24)17-33-30(28)40-29(22)20-34(3)19-25-12-14-27(15-13-25)32(38)39/h4-6,8-9,12-17,22-23,29,36H,10,18-21H2,1-3H3,(H,38,39)/t22-,23-,29-/m1/s1	FGMBKJAJBFHUEJ-VDWGHMIBSA-N	541.25767125							96588
CHEMBL2357862	LSM-43398	SID131413691, BRD-K44446302	54618596	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22+,28+/m0/s1	RWAKEFQIDXFPPV-QNVBCPFCSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K44446302	BRD-K44446302-001-01-1	Broad Institute of MIT and Harvard	BRD-K44446302			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22+,28+/m0/s1	RWAKEFQIDXFPPV-QNVBCPFCSA-N	565.22465656							
BRD-K30377659	LSM-7241		54618668	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21-,27+/m0/s1	IVQXIBZAZBUJJC-NOMHHCBYSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)C#Cc4ccncc4)c1	BroadT	BRD-K30377659	BRD-K30377659-001-01-3	Broad Institute of MIT and Harvard	BRD-K30377659			COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)C#Cc2ccncc2)c1	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21-,27+/m0/s1	IVQXIBZAZBUJJC-NOMHHCBYSA-N	543.248169206							95862
BRD-K53601225	LSM-7542		54618454	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19+,23+/m1/s1	UDDMVFRUSJXUEW-MSYCTHLASA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc3cccnc3	BroadT	BRD-K53601225	BRD-K53601225-001-01-3	Broad Institute of MIT and Harvard	BRD-K53601225			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc1cccnc1	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19+,23+/m1/s1	UDDMVFRUSJXUEW-MSYCTHLASA-N	501.193356432							96163
BRD-K59475561	LSM-7633		54618439	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20+,25-/m1/s1	IXCMNLOSFSWDKI-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K59475561	BRD-K59475561-001-01-8	Broad Institute of MIT and Harvard	BRD-K59475561			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20+,25-/m1/s1	IXCMNLOSFSWDKI-OHUGHZGNSA-N	503.245392004							96254
BRD-K40837535	LSM-7367		54618433	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20-,27-/m0/s1	KSASPYMRGHUFQD-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccc(F)cc4	BroadT	BRD-K40837535	BRD-K40837535-001-01-4	Broad Institute of MIT and Harvard	BRD-K40837535			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20-,27-/m0/s1	KSASPYMRGHUFQD-OSOCVKALSA-N	556.204335686							95988
CHEMBL3182073	LSM-7326	BRD-K37231045	54618625	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23-,28+/m0/s1	NJKSHKHIQBEBBM-UXWDXCIHSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@H](CN(C)C(=O)CN4CCOCC4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K37231045	BRD-K37231045-001-01-8	Broad Institute of MIT and Harvard	BRD-K37231045			COc1ccc(cc1)C#Cc1ccc2c(O[C@H](CN(C)C(=O)CN3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H39N3O7S/c1-22-18-33(23(2)21-34)41(36,37)29-12-9-25(6-5-24-7-10-26(38-4)11-8-24)17-27(29)40-28(22)19-31(3)30(35)20-32-13-15-39-16-14-32/h7-12,17,22-23,28,34H,13-16,18-21H2,1-4H3/t22-,23-,28+/m0/s1	NJKSHKHIQBEBBM-UXWDXCIHSA-N	585.250871308							95947
BRD-K46718584	LSM-7443		54618515	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19+,25-/m0/s1	ZMBSZSRZHSICHB-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)c4ccc(F)cc4	BroadT	BRD-K46718584	BRD-K46718584-001-01-0	Broad Institute of MIT and Harvard	BRD-K46718584			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1ccc(F)cc1	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19+,25-/m0/s1	ZMBSZSRZHSICHB-CEYNDMKZSA-N	506.232933712							96064
BRD-K31955163	LSM-7264		54618554	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20+,25+/m1/s1	IXCMNLOSFSWDKI-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K31955163	BRD-K31955163-001-01-4	Broad Institute of MIT and Harvard	BRD-K31955163			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20+,25+/m1/s1	IXCMNLOSFSWDKI-RNHFSVANSA-N	503.245392004							95885
BRD-K67321912	LSM-7748		54618486	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20+,27-/m0/s1	KSASPYMRGHUFQD-VKIDHGPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccc(F)cc4	BroadT	BRD-K67321912	BRD-K67321912-001-01-0	Broad Institute of MIT and Harvard	BRD-K67321912			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C29H33FN2O6S/c1-19-15-32(20(2)18-33)39(36,37)28-13-10-22(21-8-11-24(30)12-9-21)14-26(28)38-27(19)17-31(3)16-23-6-4-5-7-25(23)29(34)35/h4-14,19-20,27,33H,15-18H2,1-3H3,(H,34,35)/t19-,20+,27-/m0/s1	KSASPYMRGHUFQD-VKIDHGPPSA-N	556.204335686							96369
BRD-K59514730-001-01-0	LSM-16549	BRD-K59514730	54618392	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17-,21-/m1/s1	MNKHAAOLWRLKCW-CBGDNZLLSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC3CC3	BroadT	BRD-K59514730	BRD-K59514730-001-01-0	Broad Institute of MIT and Harvard	BRD-K59514730			CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC1CC1	InChI=1S/C24H34N4O4/c1-15(2)26-24(31)27(5)13-21-16(3)12-28(17(4)14-29)23(30)20-10-19(9-8-18-6-7-18)11-25-22(20)32-21/h10-11,15-18,21,29H,6-7,12-14H2,1-5H3,(H,26,31)/t16-,17-,21-/m1/s1	MNKHAAOLWRLKCW-CBGDNZLLSA-N	442.258005608							105186
BRD-K19147816	LSM-7095		54618477	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21-,29-/m0/s1	MIOBFWIJYZOKSQ-WURXVLGASA-N	COc1ccccc1C#Cc2cnc3O[C@@H](CN(C)C(=O)c4ccc5OCOc5c4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K19147816	BRD-K19147816-001-01-5	Broad Institute of MIT and Harvard	BRD-K19147816			COc1ccccc1C#Cc1cnc2O[C@@H](CN(C)C(=O)c3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H33N3O7/c1-20-16-35(21(2)18-36)32(38)25-13-22(9-10-23-7-5-6-8-26(23)39-4)15-33-30(25)42-29(20)17-34(3)31(37)24-11-12-27-28(14-24)41-19-40-27/h5-8,11-15,20-21,29,36H,16-19H2,1-4H3/t20-,21-,29-/m0/s1	MIOBFWIJYZOKSQ-WURXVLGASA-N	571.231850426							95716
CHEMBL2136761	LSM-7319	SID131413734, BRD-K36801622	54618639	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19-,23+/m0/s1	UDDMVFRUSJXUEW-SFYKDHMMSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc3cccnc3	BroadT	BRD-K36801622	BRD-K36801622-001-01-0	Broad Institute of MIT and Harvard	BRD-K36801622			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc1cccnc1	InChI=1S/C25H31N3O6S/c1-18-14-28(19(2)16-29)35(31,32)24-10-9-20(7-8-21-6-5-11-26-13-21)12-22(24)34-23(18)15-27(3)25(30)17-33-4/h5-6,9-13,18-19,23,29H,14-17H2,1-4H3/t18-,19-,23+/m0/s1	UDDMVFRUSJXUEW-SFYKDHMMSA-N	501.193356432							95940
BRD-K33603918	LSM-7281		54618480	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21+,27-/m0/s1	IVQXIBZAZBUJJC-ISCCLHIJSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)C#Cc4ccncc4)c1	BroadT	BRD-K33603918	BRD-K33603918-001-01-6	Broad Institute of MIT and Harvard	BRD-K33603918			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)C#Cc2ccncc2)c1	InChI=1S/C30H33N5O5/c1-20-17-35(21(2)19-36)29(37)26-14-23(9-8-22-10-12-31-13-11-22)16-32-28(26)40-27(20)18-34(3)30(38)33-24-6-5-7-25(15-24)39-4/h5-7,10-16,20-21,27,36H,17-19H2,1-4H3,(H,33,38)/t20-,21+,27-/m0/s1	IVQXIBZAZBUJJC-ISCCLHIJSA-N	543.248169206							95902
BRD-K63539924	LSM-7698		54618651	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19-,25-/m1/s1	ZMBSZSRZHSICHB-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)c4ccc(F)cc4	BroadT	BRD-K63539924	BRD-K63539924-001-01-7	Broad Institute of MIT and Harvard	BRD-K63539924			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1ccc(F)cc1	InChI=1S/C28H31FN4O4/c1-18-15-33(19(2)17-34)28(36)24-12-21(20-7-9-22(29)10-8-20)14-31-27(24)37-25(18)16-32(3)26(35)13-23-6-4-5-11-30-23/h4-12,14,18-19,25,34H,13,15-17H2,1-3H3/t18-,19-,25-/m1/s1	ZMBSZSRZHSICHB-MPCDZSKCSA-N	506.232933712							96319
CHEMBL2139619	LSM-7163	BRD-K24161447, SID131413652	54618557	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21-,27+/m0/s1	SOBUUYUTYHYENZ-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccc4F	BroadT	BRD-K24161447	BRD-K24161447-001-01-6	Broad Institute of MIT and Harvard	BRD-K24161447			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccc1F	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21-,27+/m0/s1	SOBUUYUTYHYENZ-NOMHHCBYSA-N	521.268984862							95784
BRD-K40959498	LSM-7370		54618519	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21-,27-/m0/s1	SOBUUYUTYHYENZ-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccc4F	BroadT	BRD-K40959498	BRD-K40959498-001-01-1	Broad Institute of MIT and Harvard	BRD-K40959498			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccc1F	InChI=1S/C30H36FN3O4/c1-20-17-34(21(2)19-35)30(37)25-15-22(13-14-23-9-7-8-12-26(23)31)16-32-28(25)38-27(20)18-33(3)29(36)24-10-5-4-6-11-24/h7-9,12,15-16,20-21,24,27,35H,4-6,10-11,17-19H2,1-3H3/t20-,21-,27-/m0/s1	SOBUUYUTYHYENZ-IZVMNLJQSA-N	521.268984862							95991
BRD-K53700261	LSM-43408		54618589	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22+,28-/m1/s1	RWAKEFQIDXFPPV-ODTZLBEKSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K53700261	BRD-K53700261-001-01-8	Broad Institute of MIT and Harvard	BRD-K53700261			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H35N3O6S/c1-21-18-33(22(2)20-34)30(35)27-16-24(11-10-23-8-6-5-7-9-23)17-31-29(27)39-28(21)19-32(3)40(36,37)26-14-12-25(38-4)13-15-26/h5-17,21-22,28,34H,18-20H2,1-4H3/b11-10+/t21-,22+,28-/m1/s1	RWAKEFQIDXFPPV-ODTZLBEKSA-N	565.22465656							
BRD-K92191596	LSM-8018		54618455	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19+,24+/m1/s1	DUJQZBWFZFXOJW-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K92191596	BRD-K92191596-001-01-9	Broad Institute of MIT and Harvard	BRD-K92191596			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H35N3O4/c1-17-7-5-6-8-22(17)21-12-23-26(28-13-21)34-24(15-29(4)25(32)11-20-9-10-20)18(2)14-30(27(23)33)19(3)16-31/h5-8,12-13,18-20,24,31H,9-11,14-16H2,1-4H3/t18-,19+,24+/m1/s1	DUJQZBWFZFXOJW-IMWIBFENSA-N	465.26275663							96639
BRD-K88914803	LSM-7988		54618686	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19+,24-/m0/s1	HVXCQDGXUZNQFT-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC(C)(C)O	BroadT	BRD-K88914803	BRD-K88914803-001-01-9	Broad Institute of MIT and Harvard	BRD-K88914803			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC(C)(C)O	InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19+,24-/m0/s1	HVXCQDGXUZNQFT-GLDPYIMESA-N	483.253334798							96609
BRD-K01604266	LSM-6881		54618659	InChI=1S/C24H33FN2O4S/c1-5-11-26(4)15-23-17(2)14-27(18(3)16-28)32(29,30)24-10-9-20(13-22(24)31-23)19-7-6-8-21(25)12-19/h6-10,12-13,17-18,23,28H,5,11,14-16H2,1-4H3/t17-,18+,23-/m1/s1	BJNIKYIOOVPCTN-IEGUWTFLSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3cccc(F)c3	BroadT	BRD-K01604266	BRD-K01604266-001-01-0	Broad Institute of MIT and Harvard	BRD-K01604266			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cccc(F)c1	InChI=1S/C24H33FN2O4S/c1-5-11-26(4)15-23-17(2)14-27(18(3)16-28)32(29,30)24-10-9-20(13-22(24)31-23)19-7-6-8-21(25)12-19/h6-10,12-13,17-18,23,28H,5,11,14-16H2,1-4H3/t17-,18+,23-/m1/s1	BJNIKYIOOVPCTN-IEGUWTFLSA-N	464.214506446							95502
BRD-K77644960	LSM-7859		54618558	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20-,25+/m0/s1	IXCMNLOSFSWDKI-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K77644960	BRD-K77644960-001-01-4	Broad Institute of MIT and Harvard	BRD-K77644960			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H37N3O5S/c1-19-15-29(20(2)18-30)35(31,32)26-7-6-22(23-5-4-10-27-14-23)13-24(26)34-25(19)17-28(3)16-21-8-11-33-12-9-21/h4-7,10,13-14,19-21,25,30H,8-9,11-12,15-18H2,1-3H3/t19-,20-,25+/m0/s1	IXCMNLOSFSWDKI-ZYLNGJIFSA-N	503.245392004							96480
BRD-K57082361	LSM-7601		54618520	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20+,27+/m0/s1	YBZIDMTZSSULOY-ASHZAFPQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5ccccc5	BroadT	BRD-K57082361	BRD-K57082361-001-01-6	Broad Institute of MIT and Harvard	BRD-K57082361			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C29H32N2O7S/c1-19-15-31(20(2)17-32)39(34,35)28-12-10-22(21-7-5-4-6-8-21)13-26(28)38-27(19)16-30(3)29(33)23-9-11-24-25(14-23)37-18-36-24/h4-14,19-20,27,32H,15-18H2,1-3H3/t19-,20+,27+/m0/s1	YBZIDMTZSSULOY-ASHZAFPQSA-N	552.193022074							96222
CHEMBL2142658	LSM-7797	BRD-K71819159, SID131413753	54618658	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17-,22-/m1/s1	YKCDBQLHOOFCLT-DRSNIGMVSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K71819159	BRD-K71819159-001-01-9	Broad Institute of MIT and Harvard	BRD-K71819159			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C24H31FN2O6S/c1-16-12-27(17(2)14-28)34(30,31)23-10-9-18(19-7-5-6-8-20(19)25)11-21(23)33-22(16)13-26(3)24(29)15-32-4/h5-11,16-17,22,28H,12-15H2,1-4H3/t16-,17-,22-/m1/s1	YKCDBQLHOOFCLT-DRSNIGMVSA-N	494.188685622							96418
BRD-K51512723	LSM-7511		54618456	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21-,26+/m1/s1	GVDJVSBPXRZCOM-YPCDYVTLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K51512723	BRD-K51512723-001-01-1	Broad Institute of MIT and Harvard	BRD-K51512723			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C27H36N4O4S/c1-20-15-31(21(2)18-32)36(33,34)27-11-10-23(9-8-22-6-4-5-7-22)12-25(27)35-26(20)17-30(3)16-24-13-28-19-29-14-24/h10-14,19-22,26,32H,4-7,15-18H2,1-3H3/t20-,21-,26+/m1/s1	GVDJVSBPXRZCOM-YPCDYVTLSA-N	512.245726362							96132
BRD-K40567080	LSM-43391		54618599	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17+,22-/m0/s1	DRXNQUOVPOKVMH-FVVLMORVSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K40567080	BRD-K40567080-001-01-6	Broad Institute of MIT and Harvard	BRD-K40567080			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H31FN4O4/c1-5-6-18-11-21-23(27-12-18)34-22(16(2)13-30(24(21)32)17(3)15-31)14-29(4)25(33)28-20-9-7-19(26)8-10-20/h5-12,16-17,22,31H,13-15H2,1-4H3,(H,28,33)/b6-5+/t16-,17+,22-/m0/s1	DRXNQUOVPOKVMH-FVVLMORVSA-N	470.232933712							
BRD-K76547245	LSM-7837		54618521	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17-,21+/m1/s1	YNLPQPKWJFYZTR-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K76547245	BRD-K76547245-001-01-7	Broad Institute of MIT and Harvard	BRD-K76547245			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C23H31N3O5S/c1-15-6-8-18(9-7-15)19-10-20-22(24-11-19)31-21(13-25(4)32(5,29)30)16(2)12-26(23(20)28)17(3)14-27/h6-11,16-17,21,27H,12-14H2,1-5H3/t16-,17-,21+/m1/s1	YNLPQPKWJFYZTR-LZJOCLMNSA-N	461.198441812							96458
877-28-1	LSM-16550	SID24836575, BRD-K96960681	1241620	InChI=1S/C5H5N5OS/c1-2-3(11)6-4-7-8-5(12)10(4)9-2/h1H3,(H,8,12)(H,6,7,11)	LVHGDSJZQCLVQX-UHFFFAOYSA-N	Cc1nn2c(S)nnc2nc1O	BroadT	BRD-K96960681	BRD-K96960681-001-05-0	Enamine Ltd.	T0512-2275			Cc1nn2c(S)nnc2nc1O	InChI=1S/C5H5N5OS/c1-2-3(11)6-4-7-8-5(12)10(4)9-2/h1H3,(H,8,12)(H,6,7,11)	LVHGDSJZQCLVQX-UHFFFAOYSA-N	183.02148052							105187
2-(1,3-Benzodioxol-5-yl)-3-hydroxy-2,3-dihydroquinazolin-4(1H)-one	LSM-16551	SID4246249, BRD-A40922518	3240627	InChI=1S/C15H12N2O4/c18-15-10-3-1-2-4-11(10)16-14(17(15)19)9-5-6-12-13(7-9)21-8-20-12/h1-7,14,16,19H,8H2	LCMASBMIPGOXBS-UHFFFAOYSA-N	ON1C(Nc2ccccc2C1=O)c3ccc4OCOc4c3	BroadT	BRD-A40922518	BRD-A40922518-001-05-8	ChemDiv Inc.	4559-0015			ON1C(Nc2ccccc2C1=O)c1ccc2OCOc2c1	InChI=1S/C15H12N2O4/c18-15-10-3-1-2-4-11(10)16-14(17(15)19)9-5-6-12-13(7-9)21-8-20-12/h1-7,14,16,19H,8H2	LCMASBMIPGOXBS-UHFFFAOYSA-N	284.079706884							105188
MLS000862515	LSM-3487	BRD-K66908362, SID24792418, SID87225761	1261290	InChI=1S/C28H25N5O4S/c1-16-12-17(2)26-23(13-16)24(14-25(31-26)20-6-5-11-29-15-20)27(34)30-21-7-9-22(10-8-21)38(35,36)33-28-18(3)19(4)32-37-28/h5-15,33H,1-4H3,(H,30,34)	DOQFHXQSFNOXOF-UHFFFAOYSA-N	Cc1cc(C)c2nc(cc(C(=O)Nc3ccc(cc3)S(=O)(=O)Nc4onc(C)c4C)c2c1)c5cccnc5	BroadT	BRD-K66908362	BRD-K66908362-001-06-9	ChemBridge Corporation	7923103			Cc1noc(NS(=O)(=O)c2ccc(NC(=O)c3cc(nc4c(C)cc(C)cc34)-c3cccnc3)cc2)c1C	InChI=1S/C28H25N5O4S/c1-16-12-17(2)26-23(13-16)24(14-25(31-26)20-6-5-11-29-15-20)27(34)30-21-7-9-22(10-8-21)38(35,36)33-28-18(3)19(4)32-37-28/h5-15,33H,1-4H3,(H,30,34)	DOQFHXQSFNOXOF-UHFFFAOYSA-N	527.16272502							93170
MLS000050442	LSM-16552	SID4262254, BRD-K09769958	1178171	InChI=1S/C19H15N3O3S/c23-17(20-10-14-7-4-8-25-14)11-22-12-21-18-15(19(22)24)9-16(26-18)13-5-2-1-3-6-13/h1-9,12H,10-11H2,(H,20,23)	AAROASKGPHUWKQ-UHFFFAOYSA-N	O=C(CN1C=Nc2sc(cc2C1=O)c3ccccc3)NCc4occc4	BroadT	BRD-K09769958	BRD-K09769958-001-05-7	ChemBridge Corporation	7934806			O=C(Cn1cnc2sc(cc2c1=O)-c1ccccc1)NCc1ccco1	InChI=1S/C19H15N3O3S/c23-17(20-10-14-7-4-8-25-14)11-22-12-21-18-15(19(22)24)9-16(26-18)13-5-2-1-3-6-13/h1-9,12H,10-11H2,(H,20,23)	AAROASKGPHUWKQ-UHFFFAOYSA-N	365.08341206							105189
Acenaphthen-5-yl(methylsulfonyl)amine	LSM-16553	SID7973889, BRD-K24164610	720585	InChI=1S/C13H13NO2S/c1-17(15,16)14-12-8-7-10-6-5-9-3-2-4-11(12)13(9)10/h2-4,7-8,14H,5-6H2,1H3	NPGRAIIBMVPZHD-UHFFFAOYSA-N	CS(=O)(=O)Nc1ccc2CCc3cccc1c23	BroadT	BRD-K24164610	BRD-K24164610-001-06-0	ChemBridge Corporation	7031658			CS(=O)(=O)Nc1ccc2CCc3cccc1c23	InChI=1S/C13H13NO2S/c1-17(15,16)14-12-8-7-10-6-5-9-3-2-4-11(12)13(9)10/h2-4,7-8,14H,5-6H2,1H3	NPGRAIIBMVPZHD-UHFFFAOYSA-N	247.066699356							105190
ZINC05518169	LSM-16554	SID26663934, BRD-K82211543	3744764	InChI=1S/C16H15N3S/c1-3-9-20-15-10-12(2)18-16-14(11-17-19(15)16)13-7-5-4-6-8-13/h3-8,10-11H,1,9H2,2H3	YNVGNAPNOMDMII-UHFFFAOYSA-N	Cc1cc(SCC=C)n2ncc(c3ccccc3)c2n1	BroadT	BRD-K82211543	BRD-K82211543-001-06-0	InterBioScreen Ltd.	STOCK5S-04180			Cc1cc(SCC=C)n2ncc(-c3ccccc3)c2n1	InChI=1S/C16H15N3S/c1-3-9-20-15-10-12(2)18-16-14(11-17-19(15)16)13-7-5-4-6-8-13/h3-8,10-11H,1,9H2,2H3	YNVGNAPNOMDMII-UHFFFAOYSA-N	281.0986682							105191
ST50839144	LSM-16555	SID24791948, BRD-K43430961	6467346	InChI=1S/C14H10F2N2O3/c15-9-3-6-12(11(16)7-9)18-14(21)17-10-4-1-8(2-5-10)13(19)20/h1-7H,(H,19,20)(H2,17,18,21)	FBJIOGOXHPDBIJ-UHFFFAOYSA-N	OC(=O)c1ccc(NC(=O)Nc2ccc(F)cc2F)cc1	BroadT	BRD-K43430961	BRD-K43430961-001-05-9	ChemBridge Corporation	9048506			OC(=O)c1ccc(NC(=O)Nc2ccc(F)cc2F)cc1	InChI=1S/C14H10F2N2O3/c15-9-3-6-12(11(16)7-9)18-14(21)17-10-4-1-8(2-5-10)13(19)20/h1-7H,(H,19,20)(H2,17,18,21)	FBJIOGOXHPDBIJ-UHFFFAOYSA-N	292.0659486							105192
AC1MFBCD	LSM-16556	SID17414554, BRD-A93007853	2869028	InChI=1S/C20H17Cl2N3O4S/c1-23-20(24-15-9-12(21)5-8-14(15)22)30-16-10-17(26)25(18(16)27)13-6-3-11(4-7-13)19(28)29-2/h3-9,16H,10H2,1-2H3,(H,23,24)	AFXPYHKXSBBVDU-UHFFFAOYSA-N	CNC(=Nc1cc(Cl)ccc1Cl)SC2CC(=O)N(C2=O)c3ccc(cc3)C(=O)OC	BroadT	BRD-A93007853	BRD-A93007853-001-06-5	ChemBridge Corporation	5793613			CNC(SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)OC)=Nc1cc(Cl)ccc1Cl	InChI=1S/C20H17Cl2N3O4S/c1-23-20(24-15-9-12(21)5-8-14(15)22)30-16-10-17(26)25(18(16)27)13-6-3-11(4-7-13)19(28)29-2/h3-9,16H,10H2,1-2H3,(H,23,24)	AFXPYHKXSBBVDU-UHFFFAOYSA-N	465.031682164							105193
STK054488	LSM-16557	SID47203478, BRD-K58480926	745995	InChI=1S/C17H13NO4/c1-10-5-3-4-6-13(10)16-18-15-9-12(21-11(2)19)7-8-14(15)17(20)22-16/h3-9H,1-2H3	QEWGXGMQJNXGMV-UHFFFAOYSA-N	CC(=O)Oc1ccc2C(=O)OC(=Nc2c1)c3ccccc3C	BroadT	BRD-K58480926	BRD-K58480926-001-06-8	Asinex Ltd.	BAS 00721363			CC(=O)Oc1ccc2c(c1)nc(oc2=O)-c1ccccc1C	InChI=1S/C17H13NO4/c1-10-5-3-4-6-13(10)16-18-15-9-12(21-11(2)19)7-8-14(15)17(20)22-16/h3-9H,1-2H3	QEWGXGMQJNXGMV-UHFFFAOYSA-N	295.084457906							105194
SMR000002122	LSM-16558	SID26667541, SID848325, BRD-K70725179	650760	InChI=1S/C23H26N4O4S/c1-4-27-21(14-31-19-11-7-5-9-16(19)2)25-26-23(27)32-15-17(28)13-22(29)24-18-10-6-8-12-20(18)30-3/h5-12H,4,13-15H2,1-3H3,(H,24,29)	LLBBTLGUGWSSDT-UHFFFAOYSA-N	CCn1c(COc2ccccc2C)nnc1SCC(=O)CC(=O)Nc3ccccc3OC	BroadT	BRD-K70725179	BRD-K70725179-001-05-6	Asinex Ltd.	ASN 03204503			CCn1c(COc2ccccc2C)nnc1SCC(=O)CC(=O)Nc1ccccc1OC	InChI=1S/C23H26N4O4S/c1-4-27-21(14-31-19-11-7-5-9-16(19)2)25-26-23(27)32-15-17(28)13-22(29)24-18-10-6-8-12-20(18)30-3/h5-12H,4,13-15H2,1-3H3,(H,24,29)	LLBBTLGUGWSSDT-UHFFFAOYSA-N	454.167476042							105195
AC1LK92D	LSM-16559	BRD-K91097136	1039269	InChI=1S/C24H24N4/c1-18(19-10-12-25-13-11-19)26-28-16-14-27(15-17-28)24-22-8-4-2-6-20(22)21-7-3-5-9-23(21)24/h2-13,24H,14-17H2,1H3	PXCQCBOGRVCHKF-UHFFFAOYSA-N	CC(=NN1CCN(CC1)C2c3ccccc3c4ccccc24)c5ccncc5	BroadT	BRD-K91097136	BRD-K91097136-001-05-7	ChemBridge Corporation	6629345			CC(=NN1CCN(CC1)C1c2ccccc2-c2ccccc12)c1ccncc1	InChI=1S/C24H24N4/c1-18(19-10-12-25-13-11-19)26-28-16-14-27(15-17-28)24-22-8-4-2-6-20(22)21-7-3-5-9-23(21)24/h2-13,24H,14-17H2,1H3	PXCQCBOGRVCHKF-UHFFFAOYSA-N	368.200096808							105196
ASN 06223233	LSM-16560	SID24803847, BRD-A21740165	3218061	InChI=1S/C20H29N3O/c1-4-8-23-18-6-5-7-19(23)13-17(12-18)22-20(24)21-16-10-14(2)9-15(3)11-16/h4,9-11,17-19H,1,5-8,12-13H2,2-3H3,(H2,21,22,24)	WLUAZQOLMDIMEI-UHFFFAOYSA-N	Cc1cc(C)cc(NC(=O)NC2CC3CCCC(C2)N3CC=C)c1	BroadT	BRD-A21740165	BRD-A21740165-001-05-3	Asinex Ltd.	ASN 06223233			Cc1cc(C)cc(NC(=O)NC2CC3CCCC(C2)N3CC=C)c1	InChI=1S/C20H29N3O/c1-4-8-23-18-6-5-7-19(23)13-17(12-18)22-20(24)21-16-10-14(2)9-15(3)11-16/h4,9-11,17-19H,1,5-8,12-13H2,2-3H3,(H2,21,22,24)	WLUAZQOLMDIMEI-UHFFFAOYSA-N	327.231062578							105197
BRD-A36883080	LSM-16561			InChI=1S/C21H24N2O4/c1-11-13(10-22)18(12-6-16(26-4)20(25)17(7-12)27-5)19-14(23-11)8-21(2,3)9-15(19)24/h6-7,18-19,25H,8-9H2,1-5H3	YRBBPAJMHDUQCY-UHFFFAOYSA-N	COc1cc(cc(OC)c1O)C2C3C(=O)CC(C)(C)CC3=NC(=C2C#N)C	BroadT	BRD-A36883080	BRD-A36883080-001-05-6	Enamine Ltd.	T0515-4334			COc1cc(cc(OC)c1O)C1C2C(=O)CC(C)(C)CC2=NC(C)=C1C#N	InChI=1S/C21H24N2O4/c1-11-13(10-22)18(12-6-16(26-4)20(25)17(7-12)27-5)19-14(23-11)8-21(2,3)9-15(19)24/h6-7,18-19,25H,8-9H2,1-5H3	YRBBPAJMHDUQCY-UHFFFAOYSA-N	368.173607268							105198
F0588-0013	LSM-16562	SID17514923, BRD-K45272612	2157261	InChI=1S/C20H21N3O2S/c1-4-25-19(24)18-17(14-9-5-6-10-16(14)21-18)23-20(26)22-15-11-7-8-12(2)13(15)3/h5-11,21H,4H2,1-3H3,(H2,22,23,26)	ZHDCEOMEDYWREW-UHFFFAOYSA-N	CCOC(=O)c1[nH]c2ccccc2c1N=C(S)Nc3cccc(C)c3C	BroadT	BRD-K45272612	BRD-K45272612-001-04-9	Life Chemicals Inc.	F0588-0013			CCOC(=O)c1[nH]c2ccccc2c1N=C(S)Nc1cccc(C)c1C	InChI=1S/C20H21N3O2S/c1-4-25-19(24)18-17(14-9-5-6-10-16(14)21-18)23-20(26)22-15-11-7-8-12(2)13(15)3/h5-11,21H,4H2,1-3H3,(H2,22,23,26)	ZHDCEOMEDYWREW-UHFFFAOYSA-N	367.135447632							105199
4-Methyl-3-phenyl-3H-1,5-benzodiazepin-2-amine	LSM-16563	SID24793456, BRD-A21213622	2943616	InChI=1S/C16H15N3/c1-11-15(12-7-3-2-4-8-12)16(17)19-14-10-6-5-9-13(14)18-11/h2-10,15H,1H3,(H2,17,19)	PQTNTLAURNVWGR-UHFFFAOYSA-N	CC1=Nc2ccccc2N=C(N)C1c3ccccc3	BroadT	BRD-A21213622	BRD-A21213622-001-06-6	ChemBridge Corporation	7619564			CC1=Nc2ccccc2N=C(N)C1c1ccccc1	InChI=1S/C16H15N3/c1-11-15(12-7-3-2-4-8-12)16(17)19-14-10-6-5-9-13(14)18-11/h2-10,15H,1H3,(H2,17,19)	PQTNTLAURNVWGR-UHFFFAOYSA-N	249.12659751							105200
AC1LFV1G	LSM-43648	BRD-K69636039	760436	InChI=1S/C16H15BrN2O2/c1-11-8-15(12(2)21-11)16(20)19-18-10-14(17)9-13-6-4-3-5-7-13/h3-10H,1-2H3,(H,19,20)/b14-9-,18-10?	SQJMGMJPOZKFGT-HKEYHUHBSA-N	Cc1oc(C)c(c1)C(=O)NN=C\C(=C\c2ccccc2)\Br	BroadT	BRD-K69636039	BRD-K69636039-001-05-8	ChemDiv Inc.	3253-0744			Cc1cc(C(=O)NN=C\C(Br)=C\c2ccccc2)c(C)o1	InChI=1S/C16H15BrN2O2/c1-11-8-15(12(2)21-11)16(20)19-18-10-14(17)9-13-6-4-3-5-7-13/h3-10H,1-2H3,(H,19,20)/b14-9-,18-10?	SQJMGMJPOZKFGT-HKEYHUHBSA-N	346.03169034							
AC1MCEXU	LSM-16565	BRD-K14730994	2767984	InChI=1S/C16H19N3O2S/c1-10(2)17-16(20)21-19-12(4)14-11(3)18-15(22-14)13-8-6-5-7-9-13/h5-10H,1-4H3,(H,17,20)	UFNAEUOXECFKRF-UHFFFAOYSA-N	CC(C)NC(=O)ON=C(C)c1sc(nc1C)c2ccccc2	BroadT	BRD-K14730994	BRD-K14730994-001-05-8	Key Organics Ltd.	11P-595S			CC(C)NC(=O)ON=C(C)c1sc(nc1C)-c1ccccc1	InChI=1S/C16H19N3O2S/c1-10(2)17-16(20)21-19-12(4)14-11(3)18-15(22-14)13-8-6-5-7-9-13/h5-10H,1-4H3,(H,17,20)	UFNAEUOXECFKRF-UHFFFAOYSA-N	317.119797568							105202
MLS000777939	LSM-16566	SID26658403, BRD-K27013689	1385360	InChI=1S/C21H18N2O5/c24-19-15-6-1-2-7-16(15)20(25)18(23-8-10-28-11-9-23)17(19)22-14-5-3-4-13(12-14)21(26)27/h1-7,12,22H,8-11H2,(H,26,27)	RKRRTHBMNDJIQQ-UHFFFAOYSA-N	OC(=O)c1cccc(NC2=C(N3CCOCC3)C(=O)c4ccccc4C2=O)c1	BroadT	BRD-K27013689	BRD-K27013689-001-05-4	InterBioScreen Ltd.	STOCK3S-07154			OC(=O)c1cccc(NC2=C(N3CCOCC3)C(=O)c3ccccc3C2=O)c1	InChI=1S/C21H18N2O5/c24-19-15-6-1-2-7-16(15)20(25)18(23-8-10-28-11-9-23)17(19)22-14-5-3-4-13(12-14)21(26)27/h1-7,12,22H,8-11H2,(H,26,27)	RKRRTHBMNDJIQQ-UHFFFAOYSA-N	378.121571696							105203
MLS000533520	LSM-16567	SID14731124, BRD-K66421174	1363889	InChI=1S/C17H10BrN3O3/c18-15-6-5-14(23-15)16(22)20-11-3-4-13-12(8-11)21-17(24-13)10-2-1-7-19-9-10/h1-9H,(H,20,22)	LSFRGFNDMPLMAU-UHFFFAOYSA-N	Brc1oc(cc1)C(=O)Nc2ccc3oc(nc3c2)c4cccnc4	BroadT	BRD-K66421174	BRD-K66421174-001-05-3	ChemBridge Corporation	6021809			Brc1ccc(o1)C(=O)Nc1ccc2oc(nc2c1)-c1cccnc1	InChI=1S/C17H10BrN3O3/c18-15-6-5-14(23-15)16(22)20-11-3-4-13-12(8-11)21-17(24-13)10-2-1-7-19-9-10/h1-9H,(H,20,22)	LSFRGFNDMPLMAU-UHFFFAOYSA-N	382.99055381							105204
8J-349S	LSM-16568	SID24819918, BRD-K14836228	1486626	InChI=1S/C19H21NO5S/c1-13-10-15(11-14(2)18(13)25-19(22)20(3)4)17(21)12-26(23,24)16-8-6-5-7-9-16/h5-11H,12H2,1-4H3	AAHUMVOTCJGEFN-UHFFFAOYSA-N	CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CS(=O)(=O)c2ccccc2	BroadT	BRD-K14836228	BRD-K14836228-001-05-1	Key Organics Ltd.	8J-349S			CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CS(=O)(=O)c1ccccc1	InChI=1S/C19H21NO5S/c1-13-10-15(11-14(2)18(13)25-19(22)20(3)4)17(21)12-26(23,24)16-8-6-5-7-9-16/h5-11H,12H2,1-4H3	AAHUMVOTCJGEFN-UHFFFAOYSA-N	375.114043472							105205
N-{3-[4-(4-Fluorophenyl)piperazin-1-yl]-1,4-dioxo-1,4-dihydronaphthalen-2-yl}benzenesulfonamide	LSM-16569	SID26658425, BRD-K87648058	3481469	InChI=1S/C26H22FN3O4S/c27-18-10-12-19(13-11-18)29-14-16-30(17-15-29)24-23(28-35(33,34)20-6-2-1-3-7-20)25(31)21-8-4-5-9-22(21)26(24)32/h1-13,28H,14-17H2	MTZPSZZQVKEZFF-UHFFFAOYSA-N	Fc1ccc(cc1)N2CCN(CC2)C3=C(NS(=O)(=O)c4ccccc4)C(=O)c5ccccc5C3=O	BroadT	BRD-K87648058	BRD-K87648058-001-05-7	InterBioScreen Ltd.	STOCK2S-33113			Fc1ccc(cc1)N1CCN(CC1)C1=C(NS(=O)(=O)c2ccccc2)C(=O)c2ccccc2C1=O	InChI=1S/C26H22FN3O4S/c27-18-10-12-19(13-11-18)29-14-16-30(17-15-29)24-23(28-35(33,34)20-6-2-1-3-7-20)25(31)21-8-4-5-9-22(21)26(24)32/h1-13,28H,14-17H2	MTZPSZZQVKEZFF-UHFFFAOYSA-N	491.131505104							105206
BIO6G6	LSM-16570	SID14737882, BRD-K30316653	2727886	InChI=1S/C17H14N2O3S/c1-21-11-5-6-12-10(9-11)4-7-14-15(12)18-17(23-14)19-16(20)13-3-2-8-22-13/h2-3,5-6,8-9H,4,7H2,1H3,(H,18,19,20)	GVOMJEIYRXTYCN-UHFFFAOYSA-N	COc1ccc2c(CCc3sc(NC(=O)c4occc4)nc23)c1	BroadT	BRD-K30316653	BRD-K30316653-001-05-8	ChemDiv Inc.	6712-0977			COc1ccc2-c3nc(NC(=O)c4ccco4)sc3CCc2c1	InChI=1S/C17H14N2O3S/c1-21-11-5-6-12-10(9-11)4-7-14-15(12)18-17(23-14)19-16(20)13-3-2-8-22-13/h2-3,5-6,8-9H,4,7H2,1H3,(H,18,19,20)	GVOMJEIYRXTYCN-UHFFFAOYSA-N	326.072513018							105207
BRD-A97346296	LSM-16571			InChI=1S/C18H15BrN2O4/c1-10(22)15-16(11-3-6-13(25-2)7-4-11)21(18(24)17(15)23)14-8-5-12(19)9-20-14/h3-9,15-16H,1-2H3	XOHFTEIFSNIWHX-UHFFFAOYSA-N	COc1ccc(cc1)C2C(C(=O)C)C(=O)C(=O)N2c3ccc(Br)cn3	BroadT	BRD-A97346296	BRD-A97346296-001-05-0	ChemBridge Corporation	6217452			COc1ccc(cc1)C1C(C(C)=O)C(=O)C(=O)N1c1ccc(Br)cn1	InChI=1S/C18H15BrN2O4/c1-10(22)15-16(11-3-6-13(25-2)7-4-11)21(18(24)17(15)23)14-8-5-12(19)9-20-14/h3-9,15-16H,1-2H3	XOHFTEIFSNIWHX-UHFFFAOYSA-N	402.02151958							105208
N2,n2-Diethyl-5-(2-thienyl)thiophene-2-carboxamide	LSM-16572	SID26727131, BRD-K23114786	2740027	InChI=1S/C13H15NOS2/c1-3-14(4-2)13(15)12-8-7-11(17-12)10-6-5-9-16-10/h5-9H,3-4H2,1-2H3	IJEMYRHNCXHVIJ-UHFFFAOYSA-N	CCN(CC)C(=O)c1ccc(s1)c2cccs2	BroadT	BRD-K23114786	BRD-K23114786-001-05-6	Maybridge	SEW 02574			CCN(CC)C(=O)c1ccc(s1)-c1cccs1	InChI=1S/C13H15NOS2/c1-3-14(4-2)13(15)12-8-7-11(17-12)10-6-5-9-16-10/h5-9H,3-4H2,1-2H3	IJEMYRHNCXHVIJ-UHFFFAOYSA-N	265.05950549							105209
MLS000722133	LSM-16573	SID17515555, BRD-K76430030	2150404	InChI=1S/C16H10N2O2S/c19-15-14-13(11-8-4-5-9-12(11)20-14)17-16(21)18(15)10-6-2-1-3-7-10/h1-9H,(H,17,21)	QBIYLKSPXQONML-UHFFFAOYSA-N	O=C1N(C(=S)Nc2c1oc3ccccc23)c4ccccc4	BroadT	BRD-K76430030	BRD-K76430030-001-06-4	Life Chemicals Inc.	F1607-0388			O=c1n(-c2ccccc2)c(=S)[nH]c2c3ccccc3oc12	InChI=1S/C16H10N2O2S/c19-15-14-13(11-8-4-5-9-12(11)20-14)17-16(21)18(15)10-6-2-1-3-7-10/h1-9H,(H,17,21)	QBIYLKSPXQONML-UHFFFAOYSA-N	294.04629827							105210
BDBM37645	LSM-16574	BRD-A78569094	91896300	InChI=1S/C25H21NO7/c1-31-18-11-9-16(10-12-18)22(27)20-21(15-5-7-17(8-6-15)25(30)32-2)26(24(29)23(20)28)14-19-4-3-13-33-19/h3-13,20-21H,14H2,1-2H3	YDXVOOHFHOQPKZ-UHFFFAOYSA-N	COC(=O)c1ccc(cc1)C2C(C(=O)c3ccc(OC)cc3)C(=O)C(=O)N2Cc4occc4	BroadT	BRD-A78569094	BRD-A78569094-001-05-4	InterBioScreen Ltd.	STOCK3S-15201			COC(=O)c1ccc(cc1)C1C(C(=O)c2ccc(OC)cc2)C(=O)C(=O)N1Cc1ccco1	InChI=1S/C25H21NO7/c1-31-18-11-9-16(10-12-18)22(27)20-21(15-5-7-17(8-6-15)25(30)32-2)26(24(29)23(20)28)14-19-4-3-13-33-19/h3-13,20-21H,14H2,1-2H3	YDXVOOHFHOQPKZ-UHFFFAOYSA-N	447.131802022							105211
SMR000082230	LSM-16575	SID4263731, BRD-K19368354	2236768	InChI=1S/C19H31N3O2S/c1-16-14-17(2)19(18(3)15-16)20-10-12-22(13-11-20)25(23,24)21-8-6-4-5-7-9-21/h14-15H,4-13H2,1-3H3	LYMFRBIZGHZFCS-UHFFFAOYSA-N	Cc1cc(C)c(N2CCN(CC2)S(=O)(=O)N3CCCCCC3)c(C)c1	BroadT	BRD-K19368354	BRD-K19368354-001-06-4	ChemBridge Corporation	7977967			Cc1cc(C)c(N2CCN(CC2)S(=O)(=O)N2CCCCCC2)c(C)c1	InChI=1S/C19H31N3O2S/c1-16-14-17(2)19(18(3)15-16)20-10-12-22(13-11-20)25(23,24)21-8-6-4-5-7-9-21/h14-15H,4-13H2,1-3H3	LYMFRBIZGHZFCS-UHFFFAOYSA-N	365.213697952							105212
N-(2,3-Dihydro-1-benzofuran-5-ylcarbonyl)-2-hydroxybenzamide	LSM-16576	SID26731541, BRD-K77692744	2815417	InChI=1S/C16H13NO4/c18-13-4-2-1-3-12(13)16(20)17-15(19)11-5-6-14-10(9-11)7-8-21-14/h1-6,9,18H,7-8H2,(H,17,19,20)	UJHGHNWTOKTBFN-UHFFFAOYSA-N	Oc1ccccc1C(=O)NC(=O)c2ccc3OCCc3c2	BroadT	BRD-K77692744	BRD-K77692744-001-05-7	Maybridge	HTS 10445			Oc1ccccc1C(=O)NC(=O)c1ccc2OCCc2c1	InChI=1S/C16H13NO4/c18-13-4-2-1-3-12(13)16(20)17-15(19)11-5-6-14-10(9-11)7-8-21-14/h1-6,9,18H,7-8H2,(H,17,19,20)	UJHGHNWTOKTBFN-UHFFFAOYSA-N	283.084457906							105213
6-(3-Bromophenyl)-2-methylnicotinic acid	LSM-16577	SID24841190, BRD-K18408650	7131628	InChI=1S/C13H10BrNO2/c1-8-11(13(16)17)5-6-12(15-8)9-3-2-4-10(14)7-9/h2-7H,1H3,(H,16,17)	RYEWOJILRDBBDR-UHFFFAOYSA-N	Cc1nc(ccc1C(=O)O)c2cccc(Br)c2	BroadT	BRD-K18408650	BRD-K18408650-001-05-2	Enamine Ltd.	EN300-15438			Cc1nc(ccc1C(O)=O)-c1cccc(Br)c1	InChI=1S/C13H10BrNO2/c1-8-11(13(16)17)5-6-12(15-8)9-3-2-4-10(14)7-9/h2-7H,1H3,(H,16,17)	RYEWOJILRDBBDR-UHFFFAOYSA-N	290.98949117							105214
MLS000030044	LSM-16578	SID846533, BRD-K70023514	648925	InChI=1S/C25H34N4O4/c30-24-19(14-18-15-22-23(16-21(18)27-24)33-13-12-32-22)17-29(11-10-28-8-4-5-9-28)25(31)26-20-6-2-1-3-7-20/h14-16,20H,1-13,17H2,(H,26,31)(H,27,30)	COJJDCZEIKOSRF-UHFFFAOYSA-N	Oc1nc2cc3OCCOc3cc2cc1CN(CCN4CCCC4)C(=O)NC5CCCCC5	BroadT	BRD-K70023514	BRD-K70023514-001-05-0	Asinex Ltd.	ASN 05114184			Oc1nc2cc3OCCOc3cc2cc1CN(CCN1CCCC1)C(=O)NC1CCCCC1	InChI=1S/C25H34N4O4/c30-24-19(14-18-15-22-23(16-21(18)27-24)33-13-12-32-22)17-29(11-10-28-8-4-5-9-28)25(31)26-20-6-2-1-3-7-20/h14-16,20H,1-13,17H2,(H,26,31)(H,27,30)	COJJDCZEIKOSRF-UHFFFAOYSA-N	454.258005608							105215
9-Phenyl-3,4a,5,6,7,8,8a,9-octahydro-2H-5,8-methanothiochromeno[2,3-d][1,3]thiazol-2-one	LSM-16579	SID4249579, BRD-A03912107	3243512	InChI=1S/C17H17NOS2/c19-17-18-16-15(21-17)12(9-4-2-1-3-5-9)13-10-6-7-11(8-10)14(13)20-16/h1-5,10-14H,6-8H2,(H,18,19)	KPJXVODWPNPRQB-UHFFFAOYSA-N	Oc1nc2SC3C4CCC(C4)C3C(c5ccccc5)c2s1	BroadT	BRD-A03912107	BRD-A03912107-001-06-9	ChemDiv Inc.	6194-0084			Oc1nc2SC3C4CCC(C4)C3C(c2s1)c1ccccc1	InChI=1S/C17H17NOS2/c19-17-18-16-15(21-17)12(9-4-2-1-3-5-9)13-10-6-7-11(8-10)14(13)20-16/h1-5,10-14H,6-8H2,(H,18,19)	KPJXVODWPNPRQB-UHFFFAOYSA-N	315.075155554							105216
SMR000124090	LSM-16580	SID14722816, BRD-K08739237	1451680	InChI=1S/C23H24N4O2S/c1-17-5-8-21(9-6-17)30(28,29)27-11-3-10-26(12-13-27)23-20(16-24)15-19-7-4-18(2)14-22(19)25-23/h4-9,14-15H,3,10-13H2,1-2H3	ADZSGAYQELWUNZ-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N2CCCN(CC2)c3nc4cc(C)ccc4cc3C#N	BroadT	BRD-K08739237	BRD-K08739237-001-06-2	Asinex Ltd.	ASN 06538443			Cc1ccc(cc1)S(=O)(=O)N1CCCN(CC1)c1nc2cc(C)ccc2cc1C#N	InChI=1S/C23H24N4O2S/c1-17-5-8-21(9-6-17)30(28,29)27-11-3-10-26(12-13-27)23-20(16-24)15-19-7-4-18(2)14-22(19)25-23/h4-9,14-15H,3,10-13H2,1-2H3	ADZSGAYQELWUNZ-UHFFFAOYSA-N	420.161996738							105217
ST50833840	LSM-16581	SID24797753, BRD-K35170147	970070	InChI=1S/C17H19N3O3S/c24-17(18-13-3-4-15-16(10-13)23-12-22-15)20-7-5-19(6-8-20)11-14-2-1-9-21-14/h1-4,9-10H,5-8,11-12H2,(H,18,24)	SJXKOSOSNRUTAX-UHFFFAOYSA-N	S=C(Nc1ccc2OCOc2c1)N3CCN(Cc4occc4)CC3	BroadT	BRD-K35170147	BRD-K35170147-001-05-8	ChemBridge Corporation	7792584			S=C(Nc1ccc2OCOc2c1)N1CCN(Cc2ccco2)CC1	InChI=1S/C17H19N3O3S/c24-17(18-13-3-4-15-16(10-13)23-12-22-15)20-7-5-19(6-8-20)11-14-2-1-9-21-14/h1-4,9-10H,5-8,11-12H2,(H,18,24)	SJXKOSOSNRUTAX-UHFFFAOYSA-N	345.114712188							105218
Methyl 4-[2-(1H-pyrrol-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]phenyl ether	LSM-16582	SID17409659, BRD-K89372669	1471640	InChI=1S/C16H13N5O/c1-22-13-6-4-12(5-7-13)14-8-9-17-15-18-16(19-21(14)15)20-10-2-3-11-20/h2-11H,1H3	CIVZTKAQLNKZRZ-UHFFFAOYSA-N	COc1ccc(cc1)c2ccnc3nc(nn23)n4cccc4	BroadT	BRD-K89372669	BRD-K89372669-001-05-3	Key Organics Ltd.	11K-075			COc1ccc(cc1)-c1ccnc2nc(nn12)-n1cccc1	InChI=1S/C16H13N5O/c1-22-13-6-4-12(5-7-13)14-8-9-17-15-18-16(19-21(14)15)20-10-2-3-11-20/h2-11H,1H3	CIVZTKAQLNKZRZ-UHFFFAOYSA-N	291.112010086							105219
MLS000115050	LSM-16583	SID7964642, BRD-A35829420	4228694	InChI=1S/C21H17N3O4S/c1-10(2)19-22-23-21(29-19)24-16(14-9-8-11(3)27-14)15-17(25)12-6-4-5-7-13(12)28-18(15)20(24)26/h4-10,16H,1-3H3	DGZPTRRDZBCQKW-UHFFFAOYSA-N	CC(C)c1nnc(s1)N2C(C3=C(Oc4ccccc4C3=O)C2=O)c5oc(C)cc5	BroadT	BRD-A35829420	BRD-A35829420-001-04-2	ChemDiv Inc.	6391-0456			CC(C)c1nnc(s1)N1C(c2ccc(C)o2)c2c(oc3ccccc3c2=O)C1=O	InChI=1S/C21H17N3O4S/c1-10(2)19-22-23-21(29-19)24-16(14-9-8-11(3)27-14)15-17(25)12-6-4-5-7-13(12)28-18(15)20(24)26/h4-10,16H,1-3H3	DGZPTRRDZBCQKW-UHFFFAOYSA-N	407.093976744							105220
ZINC01201775	LSM-16584	SID14725497, BRD-K47951859	1359710	InChI=1S/C24H25N3O4/c28-21(15-27-23(30)17-11-5-6-12-18(17)24(27)31)26-20-14-8-7-13-19(20)22(29)25-16-9-3-1-2-4-10-16/h5-8,11-14,16H,1-4,9-10,15H2,(H,25,29)(H,26,28)	DGJLQBLHBYYACA-UHFFFAOYSA-N	O=C(CN1C(=O)c2ccccc2C1=O)Nc3ccccc3C(=O)NC4CCCCCC4	BroadT	BRD-K47951859	BRD-K47951859-001-05-5	Asinex Ltd.	BAS 01842135			O=C(CN1C(=O)c2ccccc2C1=O)Nc1ccccc1C(=O)NC1CCCCCC1	InChI=1S/C24H25N3O4/c28-21(15-27-23(30)17-11-5-6-12-18(17)24(27)31)26-20-14-8-7-13-19(20)22(29)25-16-9-3-1-2-4-10-16/h5-8,11-14,16H,1-4,9-10,15H2,(H,25,29)(H,26,28)	DGJLQBLHBYYACA-UHFFFAOYSA-N	419.18450631							105221
ZINC02944477	LSM-16585	SID24786092, BRD-K66722452	2266300	InChI=1S/C17H14N2O4S/c1-18-15(20)13(16(21)19(2)17(18)22)10-11-8-9-14(23-11)24-12-6-4-3-5-7-12/h3-10H,1-2H3	QGBHZVPOCRMPSM-UHFFFAOYSA-N	CN1C(=O)N(C)C(=O)C(=Cc2oc(Sc3ccccc3)cc2)C1=O	BroadT	BRD-K66722452	BRD-K66722452-001-05-7	ChemBridge Corporation	6064049			CN1C(=O)N(C)C(=O)C(=Cc2ccc(Sc3ccccc3)o2)C1=O	InChI=1S/C17H14N2O4S/c1-18-15(20)13(16(21)19(2)17(18)22)10-11-8-9-14(23-11)24-12-6-4-3-5-7-12/h3-10H,1-2H3	QGBHZVPOCRMPSM-UHFFFAOYSA-N	342.067427638							105222
ZINC03294146	LSM-16586	SID22408269, BRD-K16799251	2409755	InChI=1S/C15H12ClF2NOS/c16-11-3-1-10(2-4-11)9-14(20)19-12-5-7-13(8-6-12)21-15(17)18/h1-8,15H,9H2,(H,19,20)	PRTIBHBKPFBRPF-UHFFFAOYSA-N	FC(F)Sc1ccc(NC(=O)Cc2ccc(Cl)cc2)cc1	BroadT	BRD-K16799251	BRD-K16799251-001-05-9	Enamine Ltd.	T0520-6185			FC(F)Sc1ccc(NC(=O)Cc2ccc(Cl)cc2)cc1	InChI=1S/C15H12ClF2NOS/c16-11-3-1-10(2-4-11)9-14(20)19-12-5-7-13(8-6-12)21-15(17)18/h1-8,15H,9H2,(H,19,20)	PRTIBHBKPFBRPF-UHFFFAOYSA-N	327.029618814							105223
ZINC03423542	LSM-16587	SID17516016, BRD-K79776988	2542826	InChI=1S/C16H13ClN2O/c1-11-16(19-15-8-3-2-7-14(15)18-11)20-10-12-5-4-6-13(17)9-12/h2-9H,10H2,1H3	LPUUHMIWHPZXGE-UHFFFAOYSA-N	Cc1nc2ccccc2nc1OCc3cccc(Cl)c3	BroadT	BRD-K79776988	BRD-K79776988-001-05-1	Enamine Ltd.	T5297840			Cc1nc2ccccc2nc1OCc1cccc(Cl)c1	InChI=1S/C16H13ClN2O/c1-11-16(19-15-8-3-2-7-14(15)18-11)20-10-12-5-4-6-13(17)9-12/h2-9H,10H2,1H3	LPUUHMIWHPZXGE-UHFFFAOYSA-N	284.071640766							105224
ST045631	LSM-43649	SID22416974, BRD-A28577961	5292478	InChI=1S/C23H23FN2O2/c1-14(12-15(2)27)26-23(17-4-8-18(24)9-5-17)20-11-7-16-6-10-19(28-3)13-21(16)22(20)25-26/h4-6,8-10,12-13,20,23H,7,11H2,1-3H3/b14-12+	LXNDLNJERAGOBV-WYMLVPIESA-N	COc1ccc2CCC3C(N(N=C3c2c1)\C(=C\C(=O)C)\C)c4ccc(F)cc4	BroadT	BRD-A28577961	BRD-A28577961-001-05-8	ChemBridge Corporation	6203269			COc1ccc2CCC3C(N(N=C3c2c1)C(\C)=C\C(C)=O)c1ccc(F)cc1	InChI=1S/C23H23FN2O2/c1-14(12-15(2)27)26-23(17-4-8-18(24)9-5-17)20-11-7-16-6-10-19(28-3)13-21(16)22(20)25-26/h4-6,8-10,12-13,20,23H,7,11H2,1-3H3/b14-12+	LXNDLNJERAGOBV-WYMLVPIESA-N	378.174356196							
4-Chloro-1-naphthyl 5-methoxy-2-(2-pyridinyl)-4-pyrimidinyl ether	LSM-16589	SID17402227, BRD-K35310650	1474148	InChI=1S/C20H14ClN3O2/c1-25-18-12-23-19(16-8-4-5-11-22-16)24-20(18)26-17-10-9-15(21)13-6-2-3-7-14(13)17/h2-12H,1H3	DFUSOVKMCNZCRI-UHFFFAOYSA-N	COc1cnc(nc1Oc2ccc(Cl)c3ccccc23)c4ccccn4	BroadT	BRD-K35310650	BRD-K35310650-001-07-5	Key Organics Ltd.	3J-321S			COc1cnc(nc1Oc1ccc(Cl)c2ccccc12)-c1ccccn1	InChI=1S/C20H14ClN3O2/c1-25-18-12-23-19(16-8-4-5-11-22-16)24-20(18)26-17-10-9-15(21)13-6-2-3-7-14(13)17/h2-12H,1H3	DFUSOVKMCNZCRI-UHFFFAOYSA-N	363.077454428							105226
STK091516	LSM-16590	SID24803039, BRD-K20622551	3713423	InChI=1S/C15H13ClN2O4S/c16-11-3-1-10(2-4-11)8-23-9-15(20)17-13-7-12(18(21)22)5-6-14(13)19/h1-7,19H,8-9H2,(H,17,20)	XLDYRTAPKQIASS-UHFFFAOYSA-N	Oc1ccc(cc1NC(=O)CSCc2ccc(Cl)cc2)[N+](=O)[O-]	BroadT	BRD-K20622551	BRD-K20622551-001-06-2	ChemBridge Corporation	6539958			Oc1ccc(cc1NC(=O)CSCc1ccc(Cl)cc1)[N+]([O-])=O	InChI=1S/C15H13ClN2O4S/c16-11-3-1-10(2-4-11)8-23-9-15(20)17-13-7-12(18(21)22)5-6-14(13)19/h1-7,19H,8-9H2,(H,17,20)	XLDYRTAPKQIASS-UHFFFAOYSA-N	352.028455316							105227
STK013512	LSM-16591	SID22413334, BRD-K16231719	1224411	InChI=1S/C14H20N2OS/c1-4-11-5-7-12(8-6-11)15-14(18)16-13(17)9-10(2)3/h5-8,10H,4,9H2,1-3H3,(H2,15,16,17,18)	BVQQYNJXBRAYGG-UHFFFAOYSA-N	CCc1ccc(NC(=S)NC(=O)CC(C)C)cc1	BroadT	BRD-K16231719	BRD-K16231719-001-06-7	Specs	AG-670/40735670			CCc1ccc(NC(=S)NC(=O)CC(C)C)cc1	InChI=1S/C14H20N2OS/c1-4-11-5-7-12(8-6-11)15-14(18)16-13(17)9-10(2)3/h5-8,10H,4,9H2,1-3H3,(H2,15,16,17,18)	BVQQYNJXBRAYGG-UHFFFAOYSA-N	264.12963397							105228
AMBCB25956925	LSM-6510	BRD-A88878656, SID24798420, SID87556800	16190091	InChI=1S/C22H29N3O3/c1-15(2)28-20-9-5-7-18(12-20)22(27)19-8-6-10-24(13-19)21(26)14-25-17(4)11-16(3)23-25/h5,7,9,11-12,15,19H,6,8,10,13-14H2,1-4H3	LLULZOSOUFKNIG-UHFFFAOYSA-N	CC(C)Oc1cccc(c1)C(=O)C2CCCN(C2)C(=O)Cn3nc(C)cc3C	BroadT	BRD-A88878656	BRD-A88878656-001-06-5	ChemBridge Corporation	25956925			CC(C)Oc1cccc(c1)C(=O)C1CCCN(C1)C(=O)Cn1nc(C)cc1C	InChI=1S/C22H29N3O3/c1-15(2)28-20-9-5-7-18(12-20)22(27)19-8-6-10-24(13-19)21(26)14-25-17(4)11-16(3)23-25/h5,7,9,11-12,15,19H,6,8,10,13-14H2,1-4H3	LLULZOSOUFKNIG-UHFFFAOYSA-N	383.220891818							95214
ASN 03270243	LSM-15531	BRD-K37316582	3170728	InChI=1S/C22H24BrN3O2S/c1-25(2)13-4-14-26(21(27)17-5-9-18(23)10-6-17)22-24-20(15-29-22)16-7-11-19(28-3)12-8-16/h5-12,15H,4,13-14H2,1-3H3	ITOFQOOZDWVBAP-UHFFFAOYSA-N	COc1ccc(cc1)c2csc(n2)N(CCCN(C)C)C(=O)c3ccc(Br)cc3	BroadT	BRD-K37316582	BRD-K37316582-034-05-8	Asinex Ltd.	ASN 03270243		OC(=O)C(=O)O	COc1ccc(cc1)-c1csc(n1)N(CCCN(C)C)C(=O)c1ccc(Br)cc1.OC(=O)C(=O)O	InChI=1S/C22H24BrN3O2S.C2H2O4/c1-25(2)13-4-14-26(21(27)17-5-9-18(23)10-6-17)22-24-20(15-29-22)16-7-11-19(28-3)12-8-16;3-1(4)2(5)6/h5-12,15H,4,13-14H2,1-3H3;(H,3,4)(H,5,6)	RQBAHTOZTOZSNG-UHFFFAOYSA-N	473.077260328							104167, 104167
T5323373	LSM-16592	SID24835714, BRD-A63912822	4881524	InChI=1S/C14H15F2N3OS/c15-9-3-4-12(16)11(6-9)13-8-21-14(19-18-13)17-7-10-2-1-5-20-10/h3-4,6,10H,1-2,5,7-8H2,(H,17,19)	VNGAZOFVHMCQPP-UHFFFAOYSA-N	Fc1ccc(F)c(c1)C2=NN=C(NCC3CCCO3)SC2	BroadT	BRD-A63912822	BRD-A63912822-001-05-2	Enamine Ltd.	T5323373			Fc1ccc(F)c(c1)C1=NN=C(NCC2CCCO2)SC1	InChI=1S/C14H15F2N3OS/c15-9-3-4-12(16)11(6-9)13-8-21-14(19-18-13)17-7-10-2-1-5-20-10/h3-4,6,10H,1-2,5,7-8H2,(H,17,19)	VNGAZOFVHMCQPP-UHFFFAOYSA-N	311.09038922							105229
MLS-0013275.0001	LSM-16593	SID26514201, SID7977913, BRD-K45632453	796318	InChI=1S/C14H12Cl2N2O3/c15-9-3-1-2-4-10(9)18-13(19)11(16)12(14(18)20)17-5-7-21-8-6-17/h1-4H,5-8H2	IZBZZJWLLSFVOC-UHFFFAOYSA-N	ClC1=C(N2CCOCC2)C(=O)N(C1=O)c3ccccc3Cl	BroadT	BRD-K45632453	BRD-K45632453-001-06-1	ChemBridge Corporation	5343472			ClC1=C(N2CCOCC2)C(=O)N(C1=O)c1ccccc1Cl	InChI=1S/C14H12Cl2N2O3/c15-9-3-1-2-4-10(9)18-13(19)11(16)12(14(18)20)17-5-7-21-8-6-17/h1-4H,5-8H2	IZBZZJWLLSFVOC-UHFFFAOYSA-N	326.022497684							105230
N-(3-Chloro-4-fluorophenyl)-n'-[(4-methyl-1,2,3-thiadiazol-5-yl)carbonyl]urea	LSM-16594	SID26729087, BRD-K66450805	2804629	InChI=1S/C11H8ClFN4O2S/c1-5-9(20-17-16-5)10(18)15-11(19)14-6-2-3-8(13)7(12)4-6/h2-4H,1H3,(H2,14,15,18,19)	JTWOMRHHCDSHHR-UHFFFAOYSA-N	Cc1nnsc1C(=O)NC(=O)Nc2ccc(F)c(Cl)c2	BroadT	BRD-K66450805	BRD-K66450805-001-05-9	Maybridge	CD 06713			Cc1nnsc1C(=O)NC(=O)Nc1ccc(F)c(Cl)c1	InChI=1S/C11H8ClFN4O2S/c1-5-9(20-17-16-5)10(18)15-11(19)14-6-2-3-8(13)7(12)4-6/h2-4H,1H3,(H2,14,15,18,19)	JTWOMRHHCDSHHR-UHFFFAOYSA-N	314.004052136							105231
4,5-Diphenyl-2,5-dihydro-1H-imidazol-2-one	LSM-16595	SID7977294, BRD-A14964391	95311	InChI=1S/C15H12N2O/c18-15-16-13(11-7-3-1-4-8-11)14(17-15)12-9-5-2-6-10-12/h1-10,13H,(H,16,18)	UXKWMBYYIUTXCY-UHFFFAOYSA-N	O=C1NC(C(=N1)c2ccccc2)c3ccccc3	BroadT	BRD-A14964391	BRD-A14964391-001-06-2	ChemBridge Corporation	5162292			O=C1NC(C(=N1)c1ccccc1)c1ccccc1	InChI=1S/C15H12N2O/c18-15-16-13(11-7-3-1-4-8-11)14(17-15)12-9-5-2-6-10-12/h1-10,13H,(H,16,18)	UXKWMBYYIUTXCY-UHFFFAOYSA-N	236.094963024							105232
2-(2,4-Dichloro-phenoxy)-n-furan-2-ylmethyl-acetamide	LSM-16596	SID842243, BRD-K28883641	644503	InChI=1S/C13H11Cl2NO3/c14-9-3-4-12(11(15)6-9)19-8-13(17)16-7-10-2-1-5-18-10/h1-6H,7-8H2,(H,16,17)	RKRCNHHERYWPCG-UHFFFAOYSA-N	Clc1ccc(OCC(=O)NCc2occc2)c(Cl)c1	BroadT	BRD-K28883641	BRD-K28883641-001-05-6	Asinex Ltd.	BAS 00409731			Clc1ccc(OCC(=O)NCc2ccco2)c(Cl)c1	InChI=1S/C13H11Cl2NO3/c14-9-3-4-12(11(15)6-9)19-8-13(17)16-7-10-2-1-5-18-10/h1-6H,7-8H2,(H,16,17)	RKRCNHHERYWPCG-UHFFFAOYSA-N	299.011598642							105233
MLS000071662	LSM-16597	SID850053, BRD-K55530850	652564	InChI=1S/C21H19N5OS2/c1-2-26-19(16-11-7-4-8-12-16)24-25-21(26)29-14-18(27)23-20-22-17(13-28-20)15-9-5-3-6-10-15/h3-13H,2,14H2,1H3,(H,22,23,27)	XRYPMVLEDGPSQH-UHFFFAOYSA-N	CCn1c(SCC(=O)Nc2nc(cs2)c3ccccc3)nnc1c4ccccc4	BroadT	BRD-K55530850	BRD-K55530850-001-06-3	Asinex Ltd.	BAS 02325441			CCn1c(SCC(=O)Nc2nc(cs2)-c2ccccc2)nnc1-c1ccccc1	InChI=1S/C21H19N5OS2/c1-2-26-19(16-11-7-4-8-12-16)24-25-21(26)29-14-18(27)23-20-22-17(13-28-20)15-9-5-3-6-10-15/h3-13H,2,14H2,1H3,(H,22,23,27)	XRYPMVLEDGPSQH-UHFFFAOYSA-N	421.103101658							105234
MLS000042614	LSM-16598	SID865183, BRD-K08995906	666433	InChI=1S/C16H11FN4OS/c1-22-13-8-4-11(5-9-13)15-20-21-14(18-19-16(21)23-15)10-2-6-12(17)7-3-10/h2-9H,1H3	OSESDAJIOWFKNQ-UHFFFAOYSA-N	COc1ccc(cc1)c2nn3c(nnc3s2)c4ccc(F)cc4	BroadT	BRD-K08995906	BRD-K08995906-001-05-2	InterBioScreen Ltd.	STOCK5S-38421			COc1ccc(cc1)-c1nn2c(nnc2s1)-c1ccc(F)cc1	InChI=1S/C16H11FN4OS/c1-22-13-8-4-11(5-9-13)15-20-21-14(18-19-16(21)23-15)10-2-6-12(17)7-3-10/h2-9H,1H3	OSESDAJIOWFKNQ-UHFFFAOYSA-N	326.063759902							105235
SMR000173266	LSM-16599	SID17408774, BRD-A97058894	3216369	InChI=1S/C21H23F3N2O2S/c1-14-9-11-16(12-10-14)26(20(28)21(22,23)24)18(17-8-5-13-29-17)19(27)25-15-6-3-2-4-7-15/h5,8-13,15,18H,2-4,6-7H2,1H3,(H,25,27)	LDJRONFDUNAZBG-UHFFFAOYSA-N	Cc1ccc(cc1)N(C(C(=O)NC2CCCCC2)c3cccs3)C(=O)C(F)(F)F	BroadT	BRD-A97058894	BRD-A97058894-001-05-7	Asinex Ltd.	ASN 05991555			Cc1ccc(cc1)N(C(C(=O)NC1CCCCC1)c1cccs1)C(=O)C(F)(F)F	InChI=1S/C21H23F3N2O2S/c1-14-9-11-16(12-10-14)26(20(28)21(22,23)24)18(17-8-5-13-29-17)19(27)25-15-6-3-2-4-7-15/h5,8-13,15,18H,2-4,6-7H2,1H3,(H,25,27)	LDJRONFDUNAZBG-UHFFFAOYSA-N	424.143233286							105236
MLS000049028	LSM-16600	SID4262783, BRD-K50403659	828529	InChI=1S/C13H14ClN3OS/c1-3-4-11(18)17-13(19-2)15-12(16-17)9-5-7-10(14)8-6-9/h5-8H,3-4H2,1-2H3	BFYHOQGOVSWQLP-UHFFFAOYSA-N	CCCC(=O)n1nc(nc1SC)c2ccc(Cl)cc2	BroadT	BRD-K50403659	BRD-K50403659-001-06-1	ChemBridge Corporation	7655369			CCCC(=O)n1nc(nc1SC)-c1ccc(Cl)cc1	InChI=1S/C13H14ClN3OS/c1-3-4-11(18)17-13(19-2)15-12(16-17)9-5-7-10(14)8-6-9/h5-8H,3-4H2,1-2H3	BFYHOQGOVSWQLP-UHFFFAOYSA-N	295.054610498							105237
2-[(4-Cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-n-(3-ethoxyphenyl)acetamide	LSM-16601	SID14741405, BRD-K93712505	1541054	InChI=1S/C21H23N3O2S/c1-3-26-16-8-6-7-15(11-16)24-20(25)13-27-21-19(12-22)18-10-5-4-9-17(18)14(2)23-21/h6-8,11H,3-5,9-10,13H2,1-2H3,(H,24,25)	LPEJECVDLDVRQG-UHFFFAOYSA-N	CCOc1cccc(NC(=O)CSc2nc(C)c3CCCCc3c2C#N)c1	BroadT	BRD-K93712505	BRD-K93712505-001-05-2	InterBioScreen Ltd.	STOCK3S-87582			CCOc1cccc(NC(=O)CSc2nc(C)c3CCCCc3c2C#N)c1	InChI=1S/C21H23N3O2S/c1-3-26-16-8-6-7-15(11-16)24-20(25)13-27-21-19(12-22)18-10-5-4-9-17(18)14(2)23-21/h6-8,11H,3-5,9-10,13H2,1-2H3,(H,24,25)	LPEJECVDLDVRQG-UHFFFAOYSA-N	381.151097696							105238
MLS000850322	LSM-16602	SID26731320, BRD-K59819423	2813283	InChI=1S/C16H16N4O3/c1-2-3-6-19-9-10-14(16(19)22)17-13-8-11(12-5-4-7-23-12)18-20(13)15(10)21/h4-5,7-8,21H,2-3,6,9H2,1H3	VTZIKJMBHSRBMV-UHFFFAOYSA-N	CCCCN1Cc2c(O)n3nc(cc3nc2C1=O)c4occc4	BroadT	BRD-K59819423	BRD-K59819423-001-05-6	Maybridge	HTS 06826			CCCCN1Cc2c(nc3cc(nn3c2O)-c2ccco2)C1=O	InChI=1S/C16H16N4O3/c1-2-3-6-19-9-10-14(16(19)22)17-13-8-11(12-5-4-7-23-12)18-20(13)15(10)21/h4-5,7-8,21H,2-3,6,9H2,1H3	VTZIKJMBHSRBMV-UHFFFAOYSA-N	312.122240412							
2,3-Diphenylpyrazine	LSM-16603	2,3-Diphenyl-Pyrazine, BRD-K44335043	243907	InChI=1S/C16H12N2/c1-3-7-13(8-4-1)15-16(18-12-11-17-15)14-9-5-2-6-10-14/h1-12H	PTZIVVDMBCVSMR-UHFFFAOYSA-N	c1ccc(cc1)c2nccnc2c3ccccc3	BroadT	BRD-K44335043	BRD-K44335043-001-05-1	Maybridge	S 12966			c1ccc(cc1)-c1nccnc1-c1ccccc1	InChI=1S/C16H12N2/c1-3-7-13(8-4-1)15-16(18-12-11-17-15)14-9-5-2-6-10-14/h1-12H	PTZIVVDMBCVSMR-UHFFFAOYSA-N	232.100048404							105240
CHEMBL1229095	LSM-15250	2-Chlorobenzyl Carbamimidothioate, BRD-K03546652	199162	InChI=1S/C8H9ClN2S/c9-7-4-2-1-3-6(7)5-12-8(10)11/h1-4H,5H2,(H3,10,11)	SFKYKNIIEFCNBX-UHFFFAOYSA-N	NC(=N)SCc1ccccc1Cl	BroadT	BRD-K03546652	BRD-K03546652-003-06-8	Specs	AG-205/40776288		Cl	NC(=N)SCc1ccccc1Cl.Cl	InChI=1S/C8H9ClN2S.ClH/c9-7-4-2-1-3-6(7)5-12-8(10)11;/h1-4H,5H2,(H3,10,11);1H	CEICVYXCGHTEIT-UHFFFAOYSA-N	200.017496708							103897, 103897
AC1MCANQ	LSM-16604	BRD-K68050629	2739596	InChI=1S/C15H13F3N2O3/c1-8-13(22-10(3)19-8)9(2)20-23-14(21)11-4-6-12(7-5-11)15(16,17)18/h4-7H,1-3H3	PABUSPRRAJSSJE-UHFFFAOYSA-N	CC(=NOC(=O)c1ccc(cc1)C(F)(F)F)c2oc(C)nc2C	BroadT	BRD-K68050629	BRD-K68050629-001-05-9	Maybridge	SEW 01647			CC(=NOC(=O)c1ccc(cc1)C(F)(F)F)c1oc(C)nc1C	InChI=1S/C15H13F3N2O3/c1-8-13(22-10(3)19-8)9(2)20-23-14(21)11-4-6-12(7-5-11)15(16,17)18/h4-7H,1-3H3	PABUSPRRAJSSJE-UHFFFAOYSA-N	326.087826896							105241
ST50776429	LSM-16605	SID4258983, BRD-K90496595	888610	InChI=1S/C12H19N3O2S/c1-2-11-18(16,17)15-9-7-14(8-10-15)12-5-3-4-6-13-12/h3-6H,2,7-11H2,1H3	NYMBVWUZYDVROA-UHFFFAOYSA-N	CCCS(=O)(=O)N1CCN(CC1)c2ccccn2	BroadT	BRD-K90496595	BRD-K90496595-001-05-6	ChemBridge Corporation	7357666			CCCS(=O)(=O)N1CCN(CC1)c1ccccn1	InChI=1S/C12H19N3O2S/c1-2-11-18(16,17)15-9-7-14(8-10-15)12-5-3-4-6-13-12/h3-6H,2,7-11H2,1H3	NYMBVWUZYDVROA-UHFFFAOYSA-N	269.119797568							105242
5-Methyl-n-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide	LSM-16606	SID4263597, BRD-K56247046	853491	InChI=1S/C9H9N3O3/c1-5-3-7(11-14-5)9(13)10-8-4-6(2)15-12-8/h3-4H,1-2H3,(H,10,12,13)	MZWWZEXPJCUDHO-UHFFFAOYSA-N	Cc1onc(NC(=O)c2cc(C)on2)c1	BroadT	BRD-K56247046	BRD-K56247046-001-05-0	ChemBridge Corporation	7944718			Cc1cc(NC(=O)c2cc(C)on2)no1	InChI=1S/C9H9N3O3/c1-5-3-7(11-14-5)9(13)10-8-4-6(2)15-12-8/h3-4H,1-2H3,(H,10,12,13)	MZWWZEXPJCUDHO-UHFFFAOYSA-N	207.064391178							105243
AC1LOCDK	LSM-16607	BRD-K37302273	1237231	InChI=1S/C17H14N2O5/c20-17(12-2-4-13-16(8-12)22-6-5-21-13)19-18-9-11-1-3-14-15(7-11)24-10-23-14/h1-4,7-9H,5-6,10H2,(H,19,20)	ITOQTIMWYHMGKJ-UHFFFAOYSA-N	O=C(NN=Cc1ccc2OCOc2c1)c3ccc4OCCOc4c3	BroadT	BRD-K37302273	BRD-K37302273-001-05-1	Specs	AG-205/07662023			O=C(NN=Cc1ccc2OCOc2c1)c1ccc2OCCOc2c1	InChI=1S/C17H14N2O5/c20-17(12-2-4-13-16(8-12)22-6-5-21-13)19-18-9-11-1-3-14-15(7-11)24-10-23-14/h1-4,7-9H,5-6,10H2,(H,19,20)	ITOQTIMWYHMGKJ-UHFFFAOYSA-N	326.090271568							105244
SMR000186246	LSM-43650	SID17432322, BRD-K84916360	5340655	InChI=1S/C19H19N3O5S/c1-3-27-15-9-10-16(17(12-15)22(24)25)20-19(28)21-18(23)11-6-13-4-7-14(26-2)8-5-13/h4-12H,3H2,1-2H3,(H2,20,21,23,28)/b11-6+	NDDQODHEJCVPNW-IZZDOVSWSA-N	CCOc1ccc(NC(=S)NC(=O)\C=C\c2ccc(OC)cc2)c(c1)[N+](=O)[O-]	BroadT	BRD-K84916360	BRD-K84916360-001-05-4	ChemBridge Corporation	5551285			CCOc1ccc(NC(=S)NC(=O)\C=C\c2ccc(OC)cc2)c(c1)[N+]([O-])=O	InChI=1S/C19H19N3O5S/c1-3-27-15-9-10-16(17(12-15)22(24)25)20-19(28)21-18(23)11-6-13-4-7-14(26-2)8-5-13/h4-12H,3H2,1-2H3,(H2,20,21,23,28)/b11-6+	NDDQODHEJCVPNW-IZZDOVSWSA-N	401.104541428							
MLS000720238	LSM-16609	SID17515700, BRD-K37305323	2152201	InChI=1S/C28H28N2O3/c1-20-7-4-8-21(17-20)18-29-16-14-23-24(28(29)32)11-5-13-26(23)33-19-27(31)30-15-6-10-22-9-2-3-12-25(22)30/h2-5,7-9,11-13,17H,6,10,14-16,18-19H2,1H3	RKDMRRYYCOSMEG-UHFFFAOYSA-N	Cc1cccc(CN2CCc3c(OCC(=O)N4CCCc5ccccc45)cccc3C2=O)c1	BroadT	BRD-K37305323	BRD-K37305323-001-06-2	Life Chemicals Inc.	F0556-0598			Cc1cccc(CN2CCc3c(OCC(=O)N4CCCc5ccccc45)cccc3C2=O)c1	InChI=1S/C28H28N2O3/c1-20-7-4-8-21(17-20)18-29-16-14-23-24(28(29)32)11-5-13-26(23)33-19-27(31)30-15-6-10-22-9-2-3-12-25(22)30/h2-5,7-9,11-13,17H,6,10,14-16,18-19H2,1H3	RKDMRRYYCOSMEG-UHFFFAOYSA-N	440.209992776							105246
SMR000125131	LSM-16610	SID14729437, BRD-K73487167	1482338	InChI=1S/C18H14N4S/c1-23-18-20-17-19-12-11-16(22(17)21-18)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-12H,1H3	SGVLHLJTBUQRCS-UHFFFAOYSA-N	CSc1nc2nccc(c3ccc(cc3)c4ccccc4)n2n1	BroadT	BRD-K73487167	BRD-K73487167-001-06-2	Key Organics Ltd.	12C-084			CSc1nc2nccc(-c3ccc(cc3)-c3ccccc3)n2n1	InChI=1S/C18H14N4S/c1-23-18-20-17-19-12-11-16(22(17)21-18)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-12H,1H3	SGVLHLJTBUQRCS-UHFFFAOYSA-N	318.093917178							105247
MLS000566711	LSM-16611	SID14744933, BRD-A62358022	4881170	InChI=1S/C13H14N2O2S2/c1-6-7(2)18-11-10(6)12(15-8(3)14-11)19-9-4-5-17-13(9)16/h9H,4-5H2,1-3H3	DRTFKGMFRMJVSK-UHFFFAOYSA-N	Cc1nc(SC2CCOC2=O)c3c(C)c(C)sc3n1	BroadT	BRD-A62358022	BRD-A62358022-001-05-7	Enamine Ltd.	T5321876			Cc1sc2nc(C)nc(SC3CCOC3=O)c2c1C	InChI=1S/C13H14N2O2S2/c1-6-7(2)18-11-10(6)12(15-8(3)14-11)19-9-4-5-17-13(9)16/h9H,4-5H2,1-3H3	DRTFKGMFRMJVSK-UHFFFAOYSA-N	294.049669088							105248
N-Adamantan-1-yl-5-hydroxy-nicotinamide	LSM-15514	BRD-K43869498	644627	InChI=1S/C16H20N2O2/c19-14-4-13(8-17-9-14)15(20)18-16-5-10-1-11(6-16)3-12(2-10)7-16/h4,8-12,19H,1-3,5-7H2,(H,18,20)	WFNXVOCHFYIBDP-UHFFFAOYSA-N	Oc1cncc(c1)C(=O)NC23CC4CC(CC(C4)C2)C3	BroadT	BRD-K43869498	BRD-K43869498-002-05-8	Asinex Ltd.	BAS 01947699		O	Oc1cncc(c1)C(=O)NC12CC3CC(CC(C3)C1)C2.O	InChI=1S/C16H20N2O2.H2O/c19-14-4-13(8-17-9-14)15(20)18-16-5-10-1-11(6-16)3-12(2-10)7-16;/h4,8-12,19H,1-3,5-7H2,(H,18,20);1H2	XQUFEFYQJNAUTQ-UHFFFAOYSA-N	272.1524779							104155, 104155
BAS 06711071	LSM-15251	BRD-K01963922	931340	InChI=1S/C15H21NO3/c1-12-4-3-5-14(10-12)18-11-15(17)19-13-6-8-16(2)9-7-13/h3-5,10,13H,6-9,11H2,1-2H3	CFQXGQAJHWHLAO-UHFFFAOYSA-N	CN1CCC(CC1)OC(=O)COc2cccc(C)c2	BroadT	BRD-K01963922	BRD-K01963922-003-06-1	Asinex Ltd.	BAS 06711071		Cl	CN1CCC(CC1)OC(=O)COc1cccc(C)c1.Cl	InChI=1S/C15H21NO3.ClH/c1-12-4-3-5-14(10-12)18-11-15(17)19-13-6-8-16(2)9-7-13;/h3-5,10,13H,6-9,11H2,1-2H3;1H	WALQFQPGHIPZFT-UHFFFAOYSA-N	263.152143542							103898, 103898
ST50754697	LSM-16612	SID17506749, BRD-K84665655	1193356	InChI=1S/C23H20ClNO4/c1-15-3-7-18(8-4-15)25-23(27)17-5-9-19(10-6-17)29-22(26)14-28-20-11-12-21(24)16(2)13-20/h3-13H,14H2,1-2H3,(H,25,27)	JYFLBWGIMUCQDM-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2ccc(OC(=O)COc3ccc(Cl)c(C)c3)cc2)cc1	BroadT	BRD-K84665655	BRD-K84665655-001-05-1	ChemBridge Corporation	7573275			Cc1ccc(NC(=O)c2ccc(OC(=O)COc3ccc(Cl)c(C)c3)cc2)cc1	InChI=1S/C23H20ClNO4/c1-15-3-7-18(8-4-15)25-23(27)17-5-9-19(10-6-17)29-22(26)14-28-20-11-12-21(24)16(2)13-20/h3-13H,14H2,1-2H3,(H,25,27)	JYFLBWGIMUCQDM-UHFFFAOYSA-N	409.10808584							105249
SMR000069799	LSM-16613	SID4265289, BRD-A13778051	2851017	InChI=1S/C14H21N5O/c1-2-13-4-9-3-10(5-13)7-14(6-9,8-13)11(20)15-12-16-18-19-17-12/h9-10H,2-8H2,1H3,(H2,15,16,17,18,19,20)	AGQMBQLYIPSXBR-UHFFFAOYSA-N	CCC12CC3CC(C1)CC(C3)(C2)C(=O)Nc4nn[nH]n4	BroadT	BRD-A13778051	BRD-A13778051-001-05-0	ChemBridge Corporation	5539338			CCC12CC3CC(C1)CC(C3)(C2)C(=O)Nc1nn[nH]n1	InChI=1S/C14H21N5O/c1-2-13-4-9-3-10(5-13)7-14(6-9,8-13)11(20)15-12-16-18-19-17-12/h9-10H,2-8H2,1H3,(H2,15,16,17,18,19,20)	AGQMBQLYIPSXBR-UHFFFAOYSA-N	275.174610342							105250
ASN 05099943	LSM-16614	SID24790964, BRD-K95309940	1445311	InChI=1S/C19H16N6O3S/c1-12-4-6-13(7-5-12)25-17-14(9-22-25)19(21-11-20-17)29-10-16(26)23-24-18(27)15-3-2-8-28-15/h2-9,11H,10H2,1H3,(H,23,26)(H,24,27)	TZBHHSXBNOPBFP-UHFFFAOYSA-N	Cc1ccc(cc1)n2ncc3c(SCC(=O)NNC(=O)c4occc4)ncnc23	BroadT	BRD-K95309940	BRD-K95309940-001-05-8	Asinex Ltd.	ASN 05099943			Cc1ccc(cc1)-n1ncc2c(SCC(=O)NNC(=O)c3ccco3)ncnc12	InChI=1S/C19H16N6O3S/c1-12-4-6-13(7-5-12)25-17-14(9-22-25)19(21-11-20-17)29-10-16(26)23-24-18(27)15-3-2-8-28-15/h2-9,11H,10H2,1H3,(H,23,26)(H,24,27)	TZBHHSXBNOPBFP-UHFFFAOYSA-N	408.100459122							105251
MLS000585690	LSM-16615	SID17510189, BRD-A49360378	4103253	InChI=1S/C15H14N4O2/c1-10(20)18-19-14(13-8-4-5-9-16-13)17-12-7-3-2-6-11(12)15(19)21/h2-9,14,17H,1H3,(H,18,20)	RWBSJSBJUPUTQS-UHFFFAOYSA-N	CC(=O)NN1C(Nc2ccccc2C1=O)c3ccccn3	BroadT	BRD-A49360378	BRD-A49360378-001-05-1	ChemDiv Inc.	6267-0128			CC(=O)NN1C(Nc2ccccc2C1=O)c1ccccn1	InChI=1S/C15H14N4O2/c1-10(20)18-19-14(13-8-4-5-9-16-13)17-12-7-3-2-6-11(12)15(19)21/h2-9,14,17H,1H3,(H,18,20)	RWBSJSBJUPUTQS-UHFFFAOYSA-N	282.111675728							105252
SMR000153227	LSM-16616	SID14747051, BRD-A94961026	4563723	InChI=1S/C17H17N3O/c1-12(13-7-3-2-4-8-13)11-16(21)20-17-18-14-9-5-6-10-15(14)19-17/h2-10,12H,11H2,1H3,(H2,18,19,20,21)	ORYMFWXZSDVZSP-UHFFFAOYSA-N	CC(CC(=O)Nc1nc2ccccc2[nH]1)c3ccccc3	BroadT	BRD-A94961026	BRD-A94961026-001-06-4	Enamine Ltd.	T5260239			CC(CC(=O)Nc1nc2ccccc2[nH]1)c1ccccc1	InChI=1S/C17H17N3O/c1-12(13-7-3-2-4-8-13)11-16(21)20-17-18-14-9-5-6-10-15(14)19-17/h2-10,12H,11H2,1H3,(H2,18,19,20,21)	ORYMFWXZSDVZSP-UHFFFAOYSA-N	279.137162194							105253
MLS000588108	LSM-16617	SID17511693, BRD-K41792292	936475	InChI=1S/C19H17NO4/c1-3-24-13-10-8-12(9-11-13)20-16-17(21)14-6-4-5-7-15(14)18(22)19(16)23-2/h4-11,20H,3H2,1-2H3	BJZPKXKVHMJZFK-UHFFFAOYSA-N	CCOc1ccc(NC2=C(OC)C(=O)c3ccccc3C2=O)cc1	BroadT	BRD-K41792292	BRD-K41792292-001-05-4	InterBioScreen Ltd.	STOCK4S-15918			CCOc1ccc(NC2=C(OC)C(=O)c3ccccc3C2=O)cc1	InChI=1S/C19H17NO4/c1-3-24-13-10-8-12(9-11-13)20-16-17(21)14-6-4-5-7-15(14)18(22)19(16)23-2/h4-11,20H,3H2,1-2H3	BJZPKXKVHMJZFK-UHFFFAOYSA-N	323.115758034							105254
AH-487/41656826	LSM-43651	SID17433796, BRD-K31713127	890737	InChI=1S/C16H13FN2O3/c1-10-6-7-12(22-10)8-14-15(20)19(16(21)18-14)9-11-4-2-3-5-13(11)17/h2-8H,9H2,1H3,(H,18,21)/b14-8+	YBPHTKMACUYNBI-RIYZIHGNSA-N	Cc1oc(\C=C/2\NC(=O)N(Cc3ccccc3F)C2=O)cc1	BroadT	BRD-K31713127	BRD-K31713127-001-05-3	ChemBridge Corporation	7442321			Cc1ccc(\C=C2\NC(=O)N(Cc3ccccc3F)C2=O)o1	InChI=1S/C16H13FN2O3/c1-10-6-7-12(22-10)8-14-15(20)19(16(21)18-14)9-11-4-2-3-5-13(11)17/h2-8H,9H2,1H3,(H,18,21)/b14-8+	YBPHTKMACUYNBI-RIYZIHGNSA-N	300.091020496							
2-[4-(4-Fluorobenzoyl)phenyl]-2-(4-fluorophenyl)acetonitrile	LSM-16619	SID14730673, BRD-A13980926	2774422	InChI=1S/C21H13F2NO/c22-18-9-5-15(6-10-18)20(13-24)14-1-3-16(4-2-14)21(25)17-7-11-19(23)12-8-17/h1-12,20H	NSLYLZYECDXPAV-UHFFFAOYSA-N	Fc1ccc(cc1)C(C#N)c2ccc(cc2)C(=O)c3ccc(F)cc3	BroadT	BRD-A13980926	BRD-A13980926-001-05-5	Key Organics Ltd.	9K-015			Fc1ccc(cc1)C(C#N)c1ccc(cc1)C(=O)c1ccc(F)cc1	InChI=1S/C21H13F2NO/c22-18-9-5-15(6-10-18)20(13-24)14-1-3-16(4-2-14)21(25)17-7-11-19(23)12-8-17/h1-12,20H	NSLYLZYECDXPAV-UHFFFAOYSA-N	333.096520446							105256
T0518-4641	LSM-16620	SID24791796, BRD-A18175012	3302998	InChI=1S/C15H15N3O6S/c16-25(21,22)11-5-6-12(13(7-11)18(19)20)17-8-10-9-23-14-3-1-2-4-15(14)24-10/h1-7,10,17H,8-9H2,(H2,16,21,22)	RRTOSGUNHAFDKQ-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(NCC2COc3ccccc3O2)c(c1)[N+](=O)[O-]	BroadT	BRD-A18175012	BRD-A18175012-001-05-2	Enamine Ltd.	T0518-4641			NS(=O)(=O)c1ccc(NCC2COc3ccccc3O2)c(c1)[N+]([O-])=O	InChI=1S/C15H15N3O6S/c16-25(21,22)11-5-6-12(13(7-11)18(19)20)17-8-10-9-23-14-3-1-2-4-15(14)24-10/h1-7,10,17H,8-9H2,(H2,16,21,22)	RRTOSGUNHAFDKQ-UHFFFAOYSA-N	365.06815592							105257
MLS000536845	LSM-4496	EMF-SUMO1-2, BRD-A93893742	2203170	InChI=1S/C15H9ClF3NO5S/c16-10-2-4-11(5-3-10)25-14(21)8-26(24)13-6-1-9(15(17,18)19)7-12(13)20(22)23/h1-7H,8H2	QYOVKDKSKVPVHI-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1S(=O)CC(=O)Oc2ccc(Cl)cc2)C(F)(F)F	BroadT	BRD-A93893742	BRD-A93893742-001-11-3	ChemBridge Corporation	7773201			[O-][N+](=O)c1cc(ccc1S(=O)CC(=O)Oc1ccc(Cl)cc1)C(F)(F)F	InChI=1S/C15H9ClF3NO5S/c16-10-2-4-11(5-3-10)25-14(21)8-26(24)13-6-1-9(15(17,18)19)7-12(13)20(22)23/h1-7H,8H2	QYOVKDKSKVPVHI-UHFFFAOYSA-N	406.984205398							93918
AC1LCSXU	LSM-16621	SID852881, BRD-K02787974	655526	InChI=1S/C19H17N5OS2/c1-12-6-8-14(9-7-12)15-10-26-18-22-23-19(24(15)18)27-11-17(25)21-16-5-3-4-13(2)20-16/h3-10H,11H2,1-2H3,(H,20,21,25)	SZBFVDNXMONBOA-UHFFFAOYSA-N	Cc1ccc(cc1)c2csc3nnc(SCC(=O)Nc4cccc(C)n4)n23	BroadT	BRD-K02787974	BRD-K02787974-001-05-6	Asinex Ltd.	ASN 06591343			Cc1ccc(cc1)-c1csc2nnc(SCC(=O)Nc3cccc(C)n3)n12	InChI=1S/C19H17N5OS2/c1-12-6-8-14(9-7-12)15-10-26-18-22-23-19(24(15)18)27-11-17(25)21-16-5-3-4-13(2)20-16/h3-10H,11H2,1-2H3,(H,20,21,25)	SZBFVDNXMONBOA-UHFFFAOYSA-N	395.087451594							105258
MLS000625127	LSM-16622	SID24796178, BRD-K09475368	953646	InChI=1S/C21H26N2O2/c1-16-11-13-23(14-12-16)19-9-5-4-8-18(19)22-21(24)15-25-20-10-6-3-7-17(20)2/h3-10,16H,11-15H2,1-2H3,(H,22,24)	DXEUTISKCHHBOU-UHFFFAOYSA-N	CC1CCN(CC1)c2ccccc2NC(=O)COc3ccccc3C	BroadT	BRD-K09475368	BRD-K09475368-001-06-3	ChemBridge Corporation	7780304			CC1CCN(CC1)c1ccccc1NC(=O)COc1ccccc1C	InChI=1S/C21H26N2O2/c1-16-11-13-23(14-12-16)19-9-5-4-8-18(19)22-21(24)15-25-20-10-6-3-7-17(20)2/h3-10,16H,11-15H2,1-2H3,(H,22,24)	DXEUTISKCHHBOU-UHFFFAOYSA-N	338.199428092							105259
1-(4-Amino-1,2,5-oxadiazol-3-yl)-n-[(2-ethoxyphenyl)methylideneamino]-5-[(4-methylpiperidin-1-yl)methyl]triazole-4-carboxamide	LSM-16623	BRD-K29702569	5186642	InChI=1S/C21H27N9O3/c1-3-32-17-7-5-4-6-15(17)12-23-25-21(31)18-16(13-29-10-8-14(2)9-11-29)30(28-24-18)20-19(22)26-33-27-20/h4-7,12,14H,3,8-11,13H2,1-2H3,(H2,22,26)(H,25,31)	YHOJEDMEPQJUIJ-UHFFFAOYSA-N	CCOc1ccccc1C=NNC(=O)c2nnn(c2CN3CCC(C)CC3)c4nonc4N	BroadT	BRD-K29702569	BRD-K29702569-001-06-3	ChemDiv Inc.	6011-0830			CCOc1ccccc1C=NNC(=O)c1nnn(c1CN1CCC(C)CC1)-c1nonc1N	InChI=1S/C21H27N9O3/c1-3-32-17-7-5-4-6-15(17)12-23-25-21(31)18-16(13-29-10-8-14(2)9-11-29)30(28-24-18)20-19(22)26-33-27-20/h4-7,12,14H,3,8-11,13H2,1-2H3,(H2,22,26)(H,25,31)	YHOJEDMEPQJUIJ-UHFFFAOYSA-N	453.223685814							105260
SMR000004363	LSM-16624	SID848556, SID85272806, BRD-K57713317	651005	InChI=1S/C22H25N7O3/c1-31-9-8-29-21(25-26-27-29)15-28(13-16-4-3-7-23-12-16)14-18-10-17-11-19(32-2)5-6-20(17)24-22(18)30/h3-7,10-12H,8-9,13-15H2,1-2H3,(H,24,30)	HNWJYCYYJRDPDS-UHFFFAOYSA-N	COCCn1nnnc1CN(Cc2cccnc2)Cc3cc4cc(OC)ccc4nc3O	BroadT	BRD-K57713317	BRD-K57713317-001-04-5	Asinex Ltd.	ASN 05298353			COCCn1nnnc1CN(Cc1cccnc1)Cc1cc2cc(OC)ccc2nc1O	InChI=1S/C22H25N7O3/c1-31-9-8-29-21(25-26-27-29)15-28(13-16-4-3-7-23-12-16)14-18-10-17-11-19(32-2)5-6-20(17)24-22(18)30/h3-7,10-12H,8-9,13-15H2,1-2H3,(H,24,30)	HNWJYCYYJRDPDS-UHFFFAOYSA-N	435.20188773							105261
MLS000534864	LSM-16625	SID14746163, BRD-K95475127	2944687	InChI=1S/C24H21N3/c1-15-22(17-9-3-5-11-19(17)26-15)24(21-13-7-8-14-25-21)23-16(2)27-20-12-6-4-10-18(20)23/h3-14,24,26-27H,1-2H3	ZXPPRPGYRMWKNG-UHFFFAOYSA-N	Cc1[nH]c2ccccc2c1C(c3ccccn3)c4c(C)[nH]c5ccccc45	BroadT	BRD-K95475127	BRD-K95475127-001-06-0	ChemBridge Corporation	7639736			Cc1[nH]c2ccccc2c1C(c1c(C)[nH]c2ccccc12)c1ccccn1	InChI=1S/C24H21N3/c1-15-22(17-9-3-5-11-19(17)26-15)24(21-13-7-8-14-25-21)23-16(2)27-20-12-6-4-10-18(20)23/h3-14,24,26-27H,1-2H3	ZXPPRPGYRMWKNG-UHFFFAOYSA-N	351.173547702							105262
CHEMBL1580288	LSM-16626	SID17514821, BRD-K48409245	12005903	InChI=1S/C20H19ClN2O4S3/c1-2-29(24,25)20-22-18(30(26,27)17-9-7-16(21)8-10-17)19(28-20)23-12-11-14-5-3-4-6-15(14)13-23/h3-10H,2,11-13H2,1H3	XWBNXNPYMCYTKF-UHFFFAOYSA-N	CCS(=O)(=O)c1nc(c(s1)N2CCc3ccccc3C2)S(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K48409245	BRD-K48409245-001-06-4	Life Chemicals Inc.	F0680-0334			CCS(=O)(=O)c1nc(c(s1)N1CCc2ccccc2C1)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C20H19ClN2O4S3/c1-2-29(24,25)20-22-18(30(26,27)17-9-7-16(21)8-10-17)19(28-20)23-12-11-14-5-3-4-6-15(14)13-23/h3-10H,2,11-13H2,1H3	XWBNXNPYMCYTKF-UHFFFAOYSA-N	482.019546888							105263
CHEMBL425065	LSM-16627	SID26731729, BRD-K87364230	2726558	InChI=1S/C10H6ClN3OS/c11-6-1-3-7(4-2-6)13-10-8(5-12)9(15)14-16-10/h1-4,13H,(H,14,15)	FTFJWXKUFGYKLO-UHFFFAOYSA-N	Oc1nsc(Nc2ccc(Cl)cc2)c1C#N	BroadT	BRD-K87364230	BRD-K87364230-001-05-2	Maybridge	RF 02366			Oc1nsc(Nc2ccc(Cl)cc2)c1C#N	InChI=1S/C10H6ClN3OS/c11-6-1-3-7(4-2-6)13-10-8(5-12)9(15)14-16-10/h1-4,13H,(H,14,15)	FTFJWXKUFGYKLO-UHFFFAOYSA-N	250.992010242							105264
MLS000335669	LSM-16628	SID22407484, BRD-K37917585	2098526	InChI=1S/C19H19Cl2NO4/c20-15-8-9-17(16(21)11-15)25-10-4-7-19(24)26-13-18(23)22-12-14-5-2-1-3-6-14/h1-3,5-6,8-9,11H,4,7,10,12-13H2,(H,22,23)	KDDHIANPFLSMEU-UHFFFAOYSA-N	Clc1ccc(OCCCC(=O)OCC(=O)NCc2ccccc2)c(Cl)c1	BroadT	BRD-K37917585	BRD-K37917585-001-05-9	Enamine Ltd.	T5231301			Clc1ccc(OCCCC(=O)OCC(=O)NCc2ccccc2)c(Cl)c1	InChI=1S/C19H19Cl2NO4/c20-15-8-9-17(16(21)11-15)25-10-4-7-19(24)26-13-18(23)22-12-14-5-2-1-3-6-14/h1-3,5-6,8-9,11H,4,7,10,12-13H2,(H,22,23)	KDDHIANPFLSMEU-UHFFFAOYSA-N	395.069113518							105265
AC1LCLXL	LSM-16629	SID849800, BRD-K45315847	652311	InChI=1S/C25H32N4O3/c1-32-22-12-10-21(11-13-22)29(18-24(30)27-20-7-3-4-8-20)25(31)19-9-14-23(26-17-19)28-15-5-2-6-16-28/h9-14,17,20H,2-8,15-16,18H2,1H3,(H,27,30)	QQZGHBPMYRFSPB-UHFFFAOYSA-N	COc1ccc(cc1)N(CC(=O)NC2CCCC2)C(=O)c3ccc(nc3)N4CCCCC4	BroadT	BRD-K45315847	BRD-K45315847-001-05-0	Asinex Ltd.	ASN 05825537			COc1ccc(cc1)N(CC(=O)NC1CCCC1)C(=O)c1ccc(nc1)N1CCCCC1	InChI=1S/C25H32N4O3/c1-32-22-12-10-21(11-13-22)29(18-24(30)27-20-7-3-4-8-20)25(31)19-9-14-23(26-17-19)28-15-5-2-6-16-28/h9-14,17,20H,2-8,15-16,18H2,1H3,(H,27,30)	QQZGHBPMYRFSPB-UHFFFAOYSA-N	436.247440924							105266
N-(3,5-Dichlorophenyl)-2-[(methylsulfonyl)amino]benzamide	LSM-16630	SID14746324, BRD-K89539872	1260692	InChI=1S/C14H12Cl2N2O3S/c1-22(20,21)18-13-5-3-2-4-12(13)14(19)17-11-7-9(15)6-10(16)8-11/h2-8,18H,1H3,(H,17,19)	OCMRFULKMXYDHL-UHFFFAOYSA-N	CS(=O)(=O)Nc1ccccc1C(=O)Nc2cc(Cl)cc(Cl)c2	BroadT	BRD-K89539872	BRD-K89539872-001-05-0	ChemBridge Corporation	7916021			CS(=O)(=O)Nc1ccccc1C(=O)Nc1cc(Cl)cc(Cl)c1	InChI=1S/C14H12Cl2N2O3S/c1-22(20,21)18-13-5-3-2-4-12(13)14(19)17-11-7-9(15)6-10(16)8-11/h2-8,18H,1H3,(H,17,19)	OCMRFULKMXYDHL-UHFFFAOYSA-N	357.994568374							105267
AC1MJH62	LSM-16631	BRD-K53668616	3091860	InChI=1S/C21H29N5O/c1-4-5-6-18-7-9-19(10-8-18)16(2)24-25-20-15-21(23-17(3)22-20)26-11-13-27-14-12-26/h7-10,15H,4-6,11-14H2,1-3H3,(H,22,23,25)	QBFALBLSXWEBNQ-UHFFFAOYSA-N	CCCCc1ccc(cc1)C(=NNc2cc(nc(C)n2)N3CCOCC3)C	BroadT	BRD-K53668616	BRD-K53668616-001-07-6	Asinex Ltd.	BAS 00125683			CCCCc1ccc(cc1)C(C)=NNc1cc(nc(C)n1)N1CCOCC1	InChI=1S/C21H29N5O/c1-4-5-6-18-7-9-19(10-8-18)16(2)24-25-20-15-21(23-17(3)22-20)26-11-13-27-14-12-26/h7-10,15H,4-6,11-14H2,1-3H3,(H,22,23,25)	QBFALBLSXWEBNQ-UHFFFAOYSA-N	367.237210598							105268
N-(4-Chlorophenyl)-2,5-dimethyl-1-(2-thienylmethyl)-1H-pyrrole-3-carboxamide	LSM-16632	SID26727549, BRD-K34112953	2742285	InChI=1S/C18H17ClN2OS/c1-12-10-17(13(2)21(12)11-16-4-3-9-23-16)18(22)20-15-7-5-14(19)6-8-15/h3-10H,11H2,1-2H3,(H,20,22)	ZWXCFCHKKPQMEA-UHFFFAOYSA-N	Cc1cc(C(=O)Nc2ccc(Cl)cc2)c(C)n1Cc3cccs3	BroadT	BRD-K34112953	BRD-K34112953-001-05-4	Maybridge	SP 00298			Cc1cc(C(=O)Nc2ccc(Cl)cc2)c(C)n1Cc1cccs1	InChI=1S/C18H17ClN2OS/c1-12-10-17(13(2)21(12)11-16-4-3-9-23-16)18(22)20-15-7-5-14(19)6-8-15/h3-10H,11H2,1-2H3,(H,20,22)	ZWXCFCHKKPQMEA-UHFFFAOYSA-N	344.075011584							105269
ST062136	LSM-16633	SID4264926, BRD-K56643942	976985	InChI=1S/C18H15N3O3/c22-17(20-12-13-4-2-8-19-11-13)14-5-1-6-15(10-14)21-18(23)16-7-3-9-24-16/h1-11H,12H2,(H,20,22)(H,21,23)	SWTACZUZGJOFPF-UHFFFAOYSA-N	O=C(NCc1cccnc1)c2cccc(NC(=O)c3occc3)c2	BroadT	BRD-K56643942	BRD-K56643942-001-06-3	ChemBridge Corporation	7736792			O=C(Nc1cccc(c1)C(=O)NCc1cccnc1)c1ccco1	InChI=1S/C18H15N3O3/c22-17(20-12-13-4-2-8-19-11-13)14-5-1-6-15(10-14)21-18(23)16-7-3-9-24-16/h1-11H,12H2,(H,20,22)(H,21,23)	SWTACZUZGJOFPF-UHFFFAOYSA-N	321.11134137							105270
ASN 06744332	LSM-16634	SID14721700, BRD-A93694989	3224156	InChI=1S/C25H30N4O3/c1-17-12-13-21-27-22(30)14-25(3,29(21)15-17)24(32)28(20-11-7-4-8-18(20)2)16-23(31)26-19-9-5-6-10-19/h4,7-8,11-13,15,19H,5-6,9-10,14,16H2,1-3H3,(H,26,31)	WNZNCZMJONTKTP-UHFFFAOYSA-N	CC1=CN2C(=NC(=O)CC2(C)C(=O)N(CC(=O)NC3CCCC3)c4ccccc4C)C=C1	BroadT	BRD-A93694989	BRD-A93694989-001-05-9	Asinex Ltd.	ASN 06744332			CC1=CN2C(C=C1)=NC(=O)CC2(C)C(=O)N(CC(=O)NC1CCCC1)c1ccccc1C	InChI=1S/C25H30N4O3/c1-17-12-13-21-27-22(30)14-25(3,29(21)15-17)24(32)28(20-11-7-4-8-18(20)2)16-23(31)26-19-9-5-6-10-19/h4,7-8,11-13,15,19H,5-6,9-10,14,16H2,1-3H3,(H,26,31)	WNZNCZMJONTKTP-UHFFFAOYSA-N	434.23179086							105271
N-(3-Bromobenzyl)pentan-1-amine	LSM-15252	BRD-K57093873	1814795	InChI=1S/C12H18BrN/c1-2-3-4-8-14-10-11-6-5-7-12(13)9-11/h5-7,9,14H,2-4,8,10H2,1H3	JBXQBLGZXVYITJ-UHFFFAOYSA-N	CCCCCNCc1cccc(Br)c1	BroadT	BRD-K57093873	BRD-K57093873-003-05-1	Specs	AN-465/42245611		Cl	CCCCCNCc1cccc(Br)c1.Cl	InChI=1S/C12H18BrN.ClH/c1-2-3-4-8-14-10-11-6-5-7-12(13)9-11;/h5-7,9,14H,2-4,8,10H2,1H3;1H	OUDKZAAEGPCDOM-UHFFFAOYSA-N	255.062262186							103899, 103899
6G-322S	LSM-16635	SID17402480, BRD-K09799295	3785749	InChI=1S/C14H10FN5O/c15-11-3-1-2-4-12(11)19-14(21)10-5-6-13(17-7-10)20-9-16-8-18-20/h1-9H,(H,19,21)	IXRCQJJTSCHAFO-UHFFFAOYSA-N	Fc1ccccc1NC(=O)c2ccc(nc2)n3cncn3	BroadT	BRD-K09799295	BRD-K09799295-001-05-6	Key Organics Ltd.	6G-322S			Fc1ccccc1NC(=O)c1ccc(nc1)-n1cncn1	InChI=1S/C14H10FN5O/c15-11-3-1-2-4-12(11)19-14(21)10-5-6-13(17-7-10)20-9-16-8-18-20/h1-9H,(H,19,21)	IXRCQJJTSCHAFO-UHFFFAOYSA-N	283.08693819							105272
ST50940608	LSM-16636	SID49819230, BRD-K06014585	1261214	InChI=1S/C28H28N4O/c1-2-7-21-11-13-22(14-12-21)26-20-24(23-8-3-4-9-25(23)30-26)28(33)32-18-16-31(17-19-32)27-10-5-6-15-29-27/h3-6,8-15,20H,2,7,16-19H2,1H3	MQSSSHWRFSJANM-UHFFFAOYSA-N	CCCc1ccc(cc1)c2cc(C(=O)N3CCN(CC3)c4ccccn4)c5ccccc5n2	BroadT	BRD-K06014585	BRD-K06014585-001-05-2	ChemBridge Corporation	7922968			CCCc1ccc(cc1)-c1cc(C(=O)N2CCN(CC2)c2ccccn2)c2ccccc2n1	InChI=1S/C28H28N4O/c1-2-7-21-11-13-22(14-12-21)26-20-24(23-8-3-4-9-25(23)30-26)28(33)32-18-16-31(17-19-32)27-10-5-6-15-29-27/h3-6,8-15,20H,2,7,16-19H2,1H3	MQSSSHWRFSJANM-UHFFFAOYSA-N	436.226311556							105273
STK322625	LSM-16637	SID4257790, BRD-K61512221	1300454	InChI=1S/C17H15Cl2N3O3S/c1-11-4-3-5-12(8-11)17-20-16(25-21-17)10-22(2)26(23,24)15-9-13(18)6-7-14(15)19/h3-9H,10H2,1-2H3	DGYDBRLIGIMELQ-UHFFFAOYSA-N	CN(Cc1onc(n1)c2cccc(C)c2)S(=O)(=O)c3cc(Cl)ccc3Cl	BroadT	BRD-K61512221	BRD-K61512221-001-07-3	ChemBridge Corporation	7888241			CN(Cc1nc(no1)-c1cccc(C)c1)S(=O)(=O)c1cc(Cl)ccc1Cl	InChI=1S/C17H15Cl2N3O3S/c1-11-4-3-5-12(8-11)17-20-16(25-21-17)10-22(2)26(23,24)15-9-13(18)6-7-14(15)19/h3-9H,10H2,1-2H3	DGYDBRLIGIMELQ-UHFFFAOYSA-N	411.02111748							105274
2-(2,4-Dioxo-3-phenyl-1,3-thiazolidin-5-yl)-n-phenylacetamide	LSM-16638	SID859287, BRD-A35659695	660584	InChI=1S/C17H14N2O3S/c20-15(18-12-7-3-1-4-8-12)11-14-16(21)19(17(22)23-14)13-9-5-2-6-10-13/h1-10,14H,11H2,(H,18,20)	ZFFWPWYTIOOOAS-UHFFFAOYSA-N	O=C(CC1SC(=O)N(C1=O)c2ccccc2)Nc3ccccc3	BroadT	BRD-A35659695	BRD-A35659695-001-05-8	InterBioScreen Ltd.	STOCK2S-99247			O=C(CC1SC(=O)N(C1=O)c1ccccc1)Nc1ccccc1	InChI=1S/C17H14N2O3S/c20-15(18-12-7-3-1-4-8-12)11-14-16(21)19(17(22)23-14)13-9-5-2-6-10-13/h1-10,14H,11H2,(H,18,20)	ZFFWPWYTIOOOAS-UHFFFAOYSA-N	326.072513018							105275
AC1M2W6U	LSM-15253	BRD-K58918649	2227185	InChI=1S/C21H20N4O3/c1-26-14-9-10-19(27-2)18(12-14)24-21-23-17-8-4-3-7-16(17)20(25-21)22-13-15-6-5-11-28-15/h3-12H,13H2,1-2H3,(H2,22,23,24,25)	QSPBFFYAMKWNTF-UHFFFAOYSA-N	COc1ccc(OC)c(Nc2nc(NCc3occc3)c4ccccc4n2)c1	BroadT	BRD-K58918649	BRD-K58918649-003-07-7	ChemBridge Corporation	7952341		Cl	COc1ccc(OC)c(Nc2nc(NCc3ccco3)c3ccccc3n2)c1.Cl	InChI=1S/C21H20N4O3.ClH/c1-26-14-9-10-19(27-2)18(12-14)24-21-23-17-8-4-3-7-16(17)20(25-21)22-13-15-6-5-11-28-15;/h3-12H,13H2,1-2H3,(H2,22,23,24,25);1H	OAPZXFOBVSRPJI-UHFFFAOYSA-N	376.15354054							103900, 103900
AC1OACBY	LSM-16639	BRD-K07512224	6827527	InChI=1S/C21H23N3O3/c1-3-5-16-6-4-7-17(21(16)27)14-22-24-20(26)13-12-19(25)23-18-10-8-15(2)9-11-18/h3-4,6-11,14,27H,1,5,12-13H2,2H3,(H,23,25)(H,24,26)	CPBXQYSEYRMCIM-UHFFFAOYSA-N	Cc1ccc(NC(=O)CCC(=O)NN=Cc2cccc(CC=C)c2O)cc1	BroadT	BRD-K07512224	BRD-K07512224-001-05-1	ChemDiv Inc.	1761-0671			Cc1ccc(NC(=O)CCC(=O)NN=Cc2cccc(CC=C)c2O)cc1	InChI=1S/C21H23N3O3/c1-3-5-16-6-4-7-17(21(16)27)14-22-24-20(26)13-12-19(25)23-18-10-8-15(2)9-11-18/h3-4,6-11,14,27H,1,5,12-13H2,2H3,(H,23,25)(H,24,26)	CPBXQYSEYRMCIM-UHFFFAOYSA-N	365.173941626							
ZINC00111991	LSM-16640	SID846798, BRD-K24121252	649191	InChI=1S/C19H18O5/c1-10-18-15(21)7-13(9-17(23-4)19(18)11(2)24-10)12-5-6-14(20)16(8-12)22-3/h5-9,20H,1-4H3	UWNPMEZLQWIMBD-UHFFFAOYSA-N	COC1=CC(=CC(=O)c2c(C)oc(C)c12)c3ccc(O)c(OC)c3	BroadT	BRD-K24121252	BRD-K24121252-001-05-5	Asinex Ltd.	BAS 03016775			COc1cc(ccc1O)-c1cc(OC)c2c(C)oc(C)c2c(=O)c1	InChI=1S/C19H18O5/c1-10-18-15(21)7-13(9-17(23-4)19(18)11(2)24-10)12-5-6-14(20)16(8-12)22-3/h5-9,20H,1-4H3	UWNPMEZLQWIMBD-UHFFFAOYSA-N	326.115423676							105277
MLS000076198	LSM-16641	SID842857, BRD-A59789639	645134	InChI=1S/C17H22N2O2/c20-15(12-21-11-14-6-2-1-3-7-14)10-19-13-18-16-8-4-5-9-17(16)19/h1-2,4-5,8-9,13-15,20H,3,6-7,10-12H2	UEBKCGDQDVQRRE-UHFFFAOYSA-N	OC(COCC1CCC=CC1)Cn2cnc3ccccc23	BroadT	BRD-A59789639	BRD-A59789639-001-05-3	Asinex Ltd.	BAS 01340610			OC(COCC1CCC=CC1)Cn1cnc2ccccc12	InChI=1S/C17H22N2O2/c20-15(12-21-11-14-6-2-1-3-7-14)10-19-13-18-16-8-4-5-9-17(16)19/h1-2,4-5,8-9,13-15,20H,3,6-7,10-12H2	UEBKCGDQDVQRRE-UHFFFAOYSA-N	286.168127964							105278
MLS000578655	LSM-16642	SID17412102, BRD-K91120975	748240	InChI=1S/C21H16N2O3/c1-25-15-12-10-14(11-13-15)22-21(24)26-23-20-18-8-4-2-6-16(18)17-7-3-5-9-19(17)20/h2-13H,1H3,(H,22,24)	MCEKMHPPYCOROC-UHFFFAOYSA-N	COc1ccc(NC(=O)ON=C2c3ccccc3c4ccccc24)cc1	BroadT	BRD-K91120975	BRD-K91120975-001-05-1	ChemBridge Corporation	5536809			COc1ccc(NC(=O)ON=C2c3ccccc3-c3ccccc23)cc1	InChI=1S/C21H16N2O3/c1-25-15-12-10-14(11-13-15)22-21(24)26-23-20-18-8-4-2-6-16(18)17-7-3-5-9-19(17)20/h2-13H,1H3,(H,22,24)	MCEKMHPPYCOROC-UHFFFAOYSA-N	344.116092392							105279
AC1O0PF0	LSM-43652	SID22413772, BRD-K16095967	5998338	InChI=1S/C14H14N2O2/c1-2-18-14(17)9-8-12-10-15-16(11-12)13-6-4-3-5-7-13/h3-11H,2H2,1H3/b9-8+	RQBYYNVAWUAYFS-CMDGGOBGSA-N	CCOC(=O)\C=C\c1cnn(c1)c2ccccc2	BroadT	BRD-K16095967	BRD-K16095967-001-05-7	Specs	AG-613/31140003			CCOC(=O)\C=C\c1cnn(c1)-c1ccccc1	InChI=1S/C14H14N2O2/c1-2-18-14(17)9-8-12-10-15-16(11-12)13-6-4-3-5-7-13/h3-11H,2H2,1H3/b9-8+	RQBYYNVAWUAYFS-CMDGGOBGSA-N	242.105527708							
MLS000058000	LSM-16644	SID3712616, BRD-K82268624	2998096	InChI=1S/C21H16N4OS2/c1-14-5-4-6-16(11-14)25-18-8-3-2-7-17(18)23-21(25)28-13-15-12-19(26)24-9-10-27-20(24)22-15/h2-12H,13H2,1H3	VMCWRPDYMGLLED-UHFFFAOYSA-N	Cc1cccc(c1)n2c(SCC3=CC(=O)N4C=CSC4=N3)nc5ccccc25	BroadT	BRD-K82268624	BRD-K82268624-001-08-8	Enamine Ltd.	T5223316			Cc1cccc(c1)-n1c(SCc2cc(=O)n3ccsc3n2)nc2ccccc12	InChI=1S/C21H16N4OS2/c1-14-5-4-6-16(11-14)25-18-8-3-2-7-17(18)23-21(25)28-13-15-12-19(26)24-9-10-27-20(24)22-15/h2-12H,13H2,1H3	VMCWRPDYMGLLED-UHFFFAOYSA-N	404.076552552							105281
AK-968/41925959	LSM-43653	SID22416280, BRD-K75257693	844473	InChI=1S/C16H17N3O2S/c1-11-14(15(21)19(2)3)22-16(17-11)18-13(20)10-9-12-7-5-4-6-8-12/h4-10H,1-3H3,(H,17,18,20)/b10-9+	JBQYUENBTAYOTN-MDZDMXLPSA-N	CN(C)C(=O)c1sc(NC(=O)\C=C\c2ccccc2)nc1C	BroadT	BRD-K75257693	BRD-K75257693-001-06-0	ChemBridge Corporation	7259348			CN(C)C(=O)c1sc(NC(=O)\C=C\c2ccccc2)nc1C	InChI=1S/C16H17N3O2S/c1-11-14(15(21)19(2)3)22-16(17-11)18-13(20)10-9-12-7-5-4-6-8-12/h4-10H,1-3H3,(H,17,18,20)/b10-9+	JBQYUENBTAYOTN-MDZDMXLPSA-N	315.104147504							
STK581416	LSM-43654	SID26665672, BRD-K89568673	6181670	InChI=1S/C19H18N4O3/c1-2-15(22-21-13-9-5-3-6-10-13)16-17(24)20-19(26)23(18(16)25)14-11-7-4-8-12-14/h3-12,21-22H,2H2,1H3,(H,20,24,26)/b16-15+	WEEBEFKOVKCSKD-FOCLMDBBSA-N	CC\C(=C/1\C(=O)NC(=O)N(C1=O)c2ccccc2)\NNc3ccccc3	BroadT	BRD-K89568673	BRD-K89568673-001-06-8	InterBioScreen Ltd.	STOCK4S-11857			CC\C(NNc1ccccc1)=C1\C(=O)NC(=O)N(C1=O)c1ccccc1	InChI=1S/C19H18N4O3/c1-2-15(22-21-13-9-5-3-6-10-13)16-17(24)20-19(26)23(18(16)25)14-11-7-4-8-12-14/h3-12,21-22H,2H2,1H3,(H,20,24,26)/b16-15+	WEEBEFKOVKCSKD-FOCLMDBBSA-N	350.137890476							
T5325728	LSM-16647	SID17385963, BRD-K11366486	4968260	InChI=1S/C15H17ClN4O2/c16-10-1-2-11-12(7-10)18-13(19-15(11)22)8-20-5-3-9(4-6-20)14(17)21/h1-2,7,9H,3-6,8H2,(H2,17,21)(H,18,19,22)	VVRPQDMWQSZIQK-UHFFFAOYSA-N	NC(=O)C1CCN(Cc2nc(O)c3ccc(Cl)cc3n2)CC1	BroadT	BRD-K11366486	BRD-K11366486-001-05-9	Enamine Ltd.	T5325728			NC(=O)C1CCN(Cc2nc(O)c3ccc(Cl)cc3n2)CC1	InChI=1S/C15H17ClN4O2/c16-10-1-2-11-12(7-10)18-13(19-15(11)22)8-20-5-3-9(4-6-20)14(17)21/h1-2,7,9H,3-6,8H2,(H2,17,21)(H,18,19,22)	VVRPQDMWQSZIQK-UHFFFAOYSA-N	320.104003534							105284
STK299856	LSM-16648	SID14739563, BRD-K75777117	1122218	InChI=1S/C17H18N2O3/c1-3-16(20)18-13-9-7-12(8-10-13)17(21)19-14-5-4-6-15(11-14)22-2/h4-11H,3H2,1-2H3,(H,18,20)(H,19,21)	FHDHTGFNDRKSRI-UHFFFAOYSA-N	CCC(=O)Nc1ccc(cc1)C(=O)Nc2cccc(OC)c2	BroadT	BRD-K75777117	BRD-K75777117-001-05-7	ChemBridge Corporation	6796394			CCC(=O)Nc1ccc(cc1)C(=O)Nc1cccc(OC)c1	InChI=1S/C17H18N2O3/c1-3-16(20)18-13-9-7-12(8-10-13)17(21)19-14-5-4-6-15(11-14)22-2/h4-11H,3H2,1-2H3,(H,18,20)(H,19,21)	FHDHTGFNDRKSRI-UHFFFAOYSA-N	298.131742456							105285
CID 74685992	LSM-16649	BRD-A98427048	74685992	InChI=1S/C18H21NO3S/c1-3-9-22-18(21)15-11(2)19-12-6-4-7-13(20)16(12)17(15)14-8-5-10-23-14/h5,8,10,15,17H,3-4,6-7,9H2,1-2H3	SRRQGJHZWQUMGX-UHFFFAOYSA-N	CCCOC(=O)C1C(C2=C(CCCC2=O)N=C1C)c3cccs3	BroadT	BRD-A98427048	BRD-A98427048-001-06-6	Asinex Ltd.	BAS 01251380			CCCOC(=O)C1C(c2cccs2)C2=C(CCCC2=O)N=C1C	InChI=1S/C18H21NO3S/c1-3-9-22-18(21)15-11(2)19-12-6-4-7-13(20)16(12)17(15)14-8-5-10-23-14/h5,8,10,15,17H,3-4,6-7,9H2,1-2H3	SRRQGJHZWQUMGX-UHFFFAOYSA-N	331.124214232							105286
MLS000559770	LSM-16650	SID17507243, BRD-K00892229	3143992	InChI=1S/C28H26F3N5OS/c1-16-8-10-19(11-9-16)14-36-18(3)24(17(2)35-36)32-23(37)15-38-27-33-25-21-7-5-4-6-20(21)12-13-22(25)26(34-27)28(29,30)31/h4-11H,12-15H2,1-3H3,(H,32,37)	WNOMREJUGNFCFB-UHFFFAOYSA-N	Cc1ccc(Cn2nc(C)c(NC(=O)CSc3nc4c(CCc5ccccc45)c(n3)C(F)(F)F)c2C)cc1	BroadT	BRD-K00892229	BRD-K00892229-001-05-9	Asinex Ltd.	BAS 02875980			Cc1nn(Cc2ccc(C)cc2)c(C)c1NC(=O)CSc1nc2-c3ccccc3CCc2c(n1)C(F)(F)F	InChI=1S/C28H26F3N5OS/c1-16-8-10-19(11-9-16)14-36-18(3)24(17(2)35-36)32-23(37)15-38-27-33-25-21-7-5-4-6-20(21)12-13-22(25)26(34-27)28(29,30)31/h4-11H,12-15H2,1-3H3,(H,32,37)	WNOMREJUGNFCFB-UHFFFAOYSA-N	537.181015792							105287
MLS000766154	LSM-16651	SID26664791, BRD-K87852842	288774	InChI=1S/C21H21NO/c1-21(2,3)22-15-18(20(23)17-12-8-5-9-13-17)14-19(22)16-10-6-4-7-11-16/h4-15H,1-3H3	VGRZGTBQRGHSTL-UHFFFAOYSA-N	CC(C)(C)n1cc(cc1c2ccccc2)C(=O)c3ccccc3	BroadT	BRD-K87852842	BRD-K87852842-001-05-6	National Cancer Institute Chemotherapeutic Agents Repository	150114			CC(C)(C)n1cc(cc1-c1ccccc1)C(=O)c1ccccc1	InChI=1S/C21H21NO/c1-21(2,3)22-15-18(20(23)17-12-8-5-9-13-17)14-19(22)16-10-6-4-7-11-16/h4-15H,1-3H3	VGRZGTBQRGHSTL-UHFFFAOYSA-N	303.162314302							105288
MLS000045831	LSM-16652	SID4244281, BRD-K97233050	3238899	InChI=1S/C20H24ClN3O4/c1-20(2,3)28-19(27)23-10-8-13(9-11-23)17-16(18(25)26)12-22-24(17)15-6-4-14(21)5-7-15/h4-7,12-13H,8-11H2,1-3H3,(H,25,26)	LJCLZGWBEQIEML-UHFFFAOYSA-N	CC(C)(C)OC(=O)N1CCC(CC1)c2c(cnn2c3ccc(Cl)cc3)C(=O)O	BroadT	BRD-K97233050	BRD-K97233050-001-06-2	ChemDiv Inc.	C614-5071			CC(C)(C)OC(=O)N1CCC(CC1)c1c(cnn1-c1ccc(Cl)cc1)C(O)=O	InChI=1S/C20H24ClN3O4/c1-20(2,3)28-19(27)23-10-8-13(9-11-23)17-16(18(25)26)12-22-24(17)15-6-4-14(21)5-7-15/h4-7,12-13H,8-11H2,1-3H3,(H,25,26)	LJCLZGWBEQIEML-UHFFFAOYSA-N	405.145533988							105289
T0506-0493	LSM-16653	SID3714866, BRD-A76315007	2998987	InChI=1S/C17H21NO5/c1-13(7-8-14-5-3-2-4-6-14)18-16(19)12-23-17(20)15-11-21-9-10-22-15/h2-6,11,13H,7-10,12H2,1H3,(H,18,19)	BHNVFJOWCQIQHP-UHFFFAOYSA-N	CC(CCc1ccccc1)NC(=O)COC(=O)C2=COCCO2	BroadT	BRD-A76315007	BRD-A76315007-001-05-0	Enamine Ltd.	T0506-0493			CC(CCc1ccccc1)NC(=O)COC(=O)C1=COCCO1	InChI=1S/C17H21NO5/c1-13(7-8-14-5-3-2-4-6-14)18-16(19)12-23-17(20)15-11-21-9-10-22-15/h2-6,11,13H,7-10,12H2,1H3,(H,18,19)	BHNVFJOWCQIQHP-UHFFFAOYSA-N	319.141972782							105290
BAS 03577642	LSM-16654	SID844850, BRD-K04657604	421162	InChI=1S/C17H13N3O/c21-17(16-12-18-10-11-19-16)20-15-9-5-4-8-14(15)13-6-2-1-3-7-13/h1-12H,(H,20,21)	YMUZIYQTUCGSNI-UHFFFAOYSA-N	O=C(Nc1ccccc1c2ccccc2)c3cnccn3	BroadT	BRD-K04657604	BRD-K04657604-001-05-7	Asinex Ltd.	BAS 03577642			O=C(Nc1ccccc1-c1ccccc1)c1cnccn1	InChI=1S/C17H13N3O/c21-17(16-12-18-10-11-19-16)20-15-9-5-4-8-14(15)13-6-2-1-3-7-13/h1-12H,(H,20,21)	YMUZIYQTUCGSNI-UHFFFAOYSA-N	275.105862066							105291
MLS000027528	LSM-16655	SID843887, BRD-K77387045	646196	InChI=1S/C14H15N5O2S2/c1-9-7-22-13(15-9)16-12(20)8-23-14-18-17-10(2)19(14)6-11-4-3-5-21-11/h3-5,7H,6,8H2,1-2H3,(H,15,16,20)	CFSXGZJVUPVKAG-UHFFFAOYSA-N	Cc1csc(NC(=O)CSc2nnc(C)n2Cc3occc3)n1	BroadT	BRD-K77387045	BRD-K77387045-001-05-0	Asinex Ltd.	ASN 05646424			Cc1csc(NC(=O)CSc2nnc(C)n2Cc2ccco2)n1	InChI=1S/C14H15N5O2S2/c1-9-7-22-13(15-9)16-12(20)8-23-14-18-17-10(2)19(14)6-11-4-3-5-21-11/h3-5,7H,6,8H2,1-2H3,(H,15,16,20)	CFSXGZJVUPVKAG-UHFFFAOYSA-N	349.06671615							105292
2-[(3,3-Dimethyl-2-oxobutyl)sulfanyl]-4-(thiophen-2-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile	LSM-16656	BRD-M88682313	1282673	InChI=1S/C19H20N2OS2/c1-19(2,3)16(22)11-24-18-13(10-20)17(15-8-5-9-23-15)12-6-4-7-14(12)21-18/h5,8-9H,4,6-7,11H2,1-3H3	PBOKDZKWQZCKEA-UHFFFAOYSA-N	CC(C)(C)C(=O)CSc1nc2CCCc2c(c1C#N)c3cccs3	BroadT	BRD-M88682313	BRD-M88682313-001-05-4	InterBioScreen Ltd.	STOCK1S-46202		CCO.CC(C)(C)C(=O)CSc1nc2CCCc2c(-c2cccs2)c1C#N	CCO.CC(C)(C)C(=O)CSc1nc2CCCc2c(-c2cccs2)c1C#N	InChI=1S/C19H20N2OS2.C2H6O/c1-19(2,3)16(22)11-24-18-13(10-20)17(15-8-5-9-23-15)12-6-4-7-14(12)21-18;1-2-3/h5,8-9H,4,6-7,11H2,1-3H3;3H,2H2,1H3	UCGJVSWTDAZDCS-UHFFFAOYSA-N	356.10170466							105293, 105293
MLS000678967	LSM-16657	BRD-K40988903	3460648	InChI=1S/C13H13ClN2O3S2/c1-4-19-12(18)10-7(2)16(3)13(21-10)15-11(17)8-5-6-9(14)20-8/h5-6H,4H2,1-3H3	SYMZLNUWBPNEIT-UHFFFAOYSA-N	CCOC(=O)C1=C(C)N(C)C(=NC(=O)c2ccc(Cl)s2)S1	BroadT	BRD-K40988903	BRD-K40988903-001-05-0	Life Chemicals Inc.	F0737-0420			CCOC(=O)c1sc(=NC(=O)c2ccc(Cl)s2)n(C)c1C	InChI=1S/C13H13ClN2O3S2/c1-4-19-12(18)10-7(2)16(3)13(21-10)15-11(17)8-5-6-9(14)20-8/h5-6H,4H2,1-3H3	SYMZLNUWBPNEIT-UHFFFAOYSA-N	344.005611386							105294
MLS000856483	LSM-16658	SID24784792, BRD-K10974113	1077847	InChI=1S/C16H18N2O3S2/c19-16(12-14-4-3-11-22-14)17-13-5-7-15(8-6-13)23(20,21)18-9-1-2-10-18/h3-8,11H,1-2,9-10,12H2,(H,17,19)	ZMYUHWNQSIRLEL-UHFFFAOYSA-N	O=C(Cc1cccs1)Nc2ccc(cc2)S(=O)(=O)N3CCCC3	BroadT	BRD-K10974113	BRD-K10974113-001-05-2	Asinex Ltd.	BAS 05023892			O=C(Cc1cccs1)Nc1ccc(cc1)S(=O)(=O)N1CCCC1	InChI=1S/C16H18N2O3S2/c19-16(12-14-4-3-11-22-14)17-13-5-7-15(8-6-13)23(20,21)18-9-1-2-10-18/h3-8,11H,1-2,9-10,12H2,(H,17,19)	ZMYUHWNQSIRLEL-UHFFFAOYSA-N	350.075883836							105295
AC1OA1MJ	LSM-16659	BRD-K42528272	6744196	InChI=1S/C20H16N4O/c1-14-18(20(25)24(23-14)17-8-3-2-4-9-17)13-21-16-11-15-7-5-6-10-19(15)22-12-16/h2-13,25H,1H3	KMZAQYYKGMKDNY-UHFFFAOYSA-N	Cc1nn(c(O)c1C=Nc2cnc3ccccc3c2)c4ccccc4	BroadT	BRD-K42528272	BRD-K42528272-001-05-5	Specs	AG-205/07695039			Cc1nn(c(O)c1C=Nc1cnc2ccccc2c1)-c1ccccc1	InChI=1S/C20H16N4O/c1-14-18(20(25)24(23-14)17-8-3-2-4-9-17)13-21-16-11-15-7-5-6-10-19(15)22-12-16/h2-13,25H,1H3	KMZAQYYKGMKDNY-UHFFFAOYSA-N	328.132411172							
MLS000701431	LSM-16660	SID22412020, BRD-K57656109	1790578	InChI=1S/C16H15N3O2S/c1-11-7-5-6-10-13(11)15(21)18-19-16(22)17-14(20)12-8-3-2-4-9-12/h2-10H,1H3,(H,18,21)(H2,17,19,20,22)	PRTMXUMLGYLWPX-UHFFFAOYSA-N	Cc1ccccc1C(=O)NNC(=S)NC(=O)c2ccccc2	BroadT	BRD-K57656109	BRD-K57656109-001-05-5	Specs	AN-329/41562986			Cc1ccccc1C(=O)NNC(=S)NC(=O)c1ccccc1	InChI=1S/C16H15N3O2S/c1-11-7-5-6-10-13(11)15(21)18-19-16(22)17-14(20)12-8-3-2-4-9-12/h2-10H,1H3,(H,18,21)(H2,17,19,20,22)	PRTMXUMLGYLWPX-UHFFFAOYSA-N	313.08849744							105297
SMR000105691	LSM-16661	SID7973690, BRD-K37515315	827877	InChI=1S/C18H13N3O2/c1-12-6-4-10-16(19-12)21-17(15-9-5-11-23-15)20-14-8-3-2-7-13(14)18(21)22/h2-11H,1H3	PMPNGDLGOHXQIV-UHFFFAOYSA-N	Cc1cccc(n1)N2C(=O)c3ccccc3N=C2c4occc4	BroadT	BRD-K37515315	BRD-K37515315-001-05-8	ChemBridge Corporation	6062216			Cc1cccc(n1)-n1c(nc2ccccc2c1=O)-c1ccco1	InChI=1S/C18H13N3O2/c1-12-6-4-10-16(19-12)21-17(15-9-5-11-23-15)20-14-8-3-2-7-13(14)18(21)22/h2-11H,1H3	PMPNGDLGOHXQIV-UHFFFAOYSA-N	303.100776686							105298
HMS2800E08	LSM-16662	BRD-K36650662	16745877	InChI=1S/C17H20N4O3/c22-12-16(23)17(24)15(21-20-14-9-5-2-6-10-14)11-18-19-13-7-3-1-4-8-13/h1-11,16-17,19-20,22-24H,12H2/t16-,17-/m1/s1	IKUNLGFTFBMATL-IAGOWNOFSA-N	OC[C@@H](O)[C@H](O)C(=NNc1ccccc1)C=NNc2ccccc2	BroadT	BRD-K36650662	BRD-K36650662-001-05-3	Maybridge	RH 01878			OC[C@@H](O)[C@H](O)C(C=NNc1ccccc1)=NNc1ccccc1	InChI=1S/C17H20N4O3/c22-12-16(23)17(24)15(21-20-14-9-5-2-6-10-14)11-18-19-13-7-3-1-4-8-13/h1-11,16-17,19-20,22-24H,12H2/t16-,17-/m1/s1	IKUNLGFTFBMATL-IAGOWNOFSA-N	328.15354054							105299
11J-510S	LSM-16663	SID24820466, BRD-K04188935	1473390	InChI=1S/C14H10ClN3O2/c1-19-11-4-2-3-9(7-11)13-17-14(20-18-13)10-5-6-12(15)16-8-10/h2-8H,1H3	YYHQEROCIPNHFR-UHFFFAOYSA-N	COc1cccc(c1)c2noc(n2)c3ccc(Cl)nc3	BroadT	BRD-K04188935	BRD-K04188935-001-05-3	Key Organics Ltd.	11J-510S			COc1cccc(c1)-c1noc(n1)-c1ccc(Cl)nc1	InChI=1S/C14H10ClN3O2/c1-19-11-4-2-3-9(7-11)13-17-14(20-18-13)10-5-6-12(15)16-8-10/h2-8H,1H3	YYHQEROCIPNHFR-UHFFFAOYSA-N	287.0461543							105300
AC1OA5J3	LSM-16664	BRD-A93407842	6799270	InChI=1S/C12H15N3O3/c16-12(14-8-11-2-1-5-18-11)9-3-4-10(7-15-17)13-6-9/h3-4,6-7,11,17H,1-2,5,8H2,(H,14,16)	CBNJCZLIBCNXFP-UHFFFAOYSA-N	ON=Cc1ccc(cn1)C(=O)NCC2CCCO2	BroadT	BRD-A93407842	BRD-A93407842-001-05-3	ChemDiv Inc.	7188-0020			ON=Cc1ccc(cn1)C(=O)NCC1CCCO1	InChI=1S/C12H15N3O3/c16-12(14-8-11-2-1-5-18-11)9-3-4-10(7-15-17)13-6-9/h3-4,6-7,11,17H,1-2,5,8H2,(H,14,16)	CBNJCZLIBCNXFP-UHFFFAOYSA-N	249.11134137							
F1741-0099	LSM-16665	SID24784709, BRD-A71931372	5035618	InChI=1S/C21H18N2O3S/c1-26-15-10-8-14(9-11-15)17-13-18(16-5-2-3-6-19(16)24)23(22-17)21(25)20-7-4-12-27-20/h2-12,18,24H,13H2,1H3	AXTQBBDRNAYVKG-UHFFFAOYSA-N	COc1ccc(cc1)C2=NN(C(C2)c3ccccc3O)C(=O)c4cccs4	BroadT	BRD-A71931372	BRD-A71931372-001-06-4	Life Chemicals Inc.	F1741-0099			COc1ccc(cc1)C1=NN(C(C1)c1ccccc1O)C(=O)c1cccs1	InChI=1S/C21H18N2O3S/c1-26-15-10-8-14(9-11-15)17-13-18(16-5-2-3-6-19(16)24)23(22-17)21(25)20-7-4-12-27-20/h2-12,18,24H,13H2,1H3	AXTQBBDRNAYVKG-UHFFFAOYSA-N	378.103813146							105302
AC1NK3TI	LSM-15532	BRD-A35289117	4881958	InChI=1S/C22H30N2O2/c1-6-16(2)20-12-7-8-13-21(20)23-22(25)17(3)24(4)15-18-10-9-11-19(14-18)26-5/h7-14,16-17H,6,15H2,1-5H3,(H,23,25)	CRFFVEROTIZWCB-UHFFFAOYSA-N	CCC(C)c1ccccc1NC(=O)C(C)N(C)Cc2cccc(OC)c2	BroadT	BRD-A35289117	BRD-A35289117-034-05-5	Enamine Ltd.	T5325159		OC(=O)C(=O)O	CCC(C)c1ccccc1NC(=O)C(C)N(C)Cc1cccc(OC)c1.OC(=O)C(=O)O	InChI=1S/C22H30N2O2.C2H2O4/c1-6-16(2)20-12-7-8-13-21(20)23-22(25)17(3)24(4)15-18-10-9-11-19(14-18)26-5;3-1(4)2(5)6/h7-14,16-17H,6,15H2,1-5H3,(H,23,25);(H,3,4)(H,5,6)	MLWSGSBUJXRPDK-UHFFFAOYSA-N	354.23072822							104168, 104168
Racepinephrine	LSM-4958	Vaponefrin, Racepinephrine, Racepinefrine, Epinephrine	838	InChI=1S/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3	UCTWMZQNUQWSLP-UHFFFAOYSA-N	CNCC(O)c1ccc(O)c(O)c1	BroadT	BRD-A07765530	BRD-A07765530-003-05-2	Sigma-Aldrich	E4642		Cl	CNCC(O)c1ccc(O)c(O)c1.Cl	InChI=1S/C9H13NO3.ClH/c1-10-5-9(13)6-2-3-7(11)8(12)4-6;/h2-4,9-13H,5H2,1H3;1H	ATADHKWKHYVBTJ-UHFFFAOYSA-N	183.089543286							33568, 33568, 33568
ST50051250	LSM-16666	SID14723659, BRD-K93336195	730283	InChI=1S/C13H14N2O3/c1-3-18-13(17)12-11(16)8-15(14-12)10-6-4-9(2)5-7-10/h4-8,16H,3H2,1-2H3	RSZMACLXIVZQTD-UHFFFAOYSA-N	CCOC(=O)c1nn(cc1O)c2ccc(C)cc2	BroadT	BRD-K93336195	BRD-K93336195-001-05-5	Asinex Ltd.	BAS 03077973			CCOC(=O)c1nn(cc1O)-c1ccc(C)cc1	InChI=1S/C13H14N2O3/c1-3-18-13(17)12-11(16)8-15(14-12)10-6-4-9(2)5-7-10/h4-8,16H,3H2,1-2H3	RSZMACLXIVZQTD-UHFFFAOYSA-N	246.100442328							105303
AC1LGLS5	LSM-43655	BRD-K88620924	823543	InChI=1S/C15H13ClN2O2/c1-11(8-9-12-5-4-10-20-12)17-18-15(19)13-6-2-3-7-14(13)16/h2-10H,1H3,(H,18,19)/b9-8+,17-11?	TYURSFSDLASZDN-INVVTGPASA-N	CC(=NNC(=O)c1ccccc1Cl)\C=C\c2occc2	BroadT	BRD-K88620924	BRD-K88620924-001-05-7	Specs	AG-670/32483012			CC(\C=C\c1ccco1)=NNC(=O)c1ccccc1Cl	InChI=1S/C15H13ClN2O2/c1-11(8-9-12-5-4-10-20-12)17-18-15(19)13-6-2-3-7-14(13)16/h2-10H,1H3,(H,18,19)/b9-8+,17-11?	TYURSFSDLASZDN-INVVTGPASA-N	288.066555386							
AC1O9Z3E	LSM-16668	BRD-K63568776	6741500	InChI=1S/C14H16N4O/c1-4-6-12-7-5-8-13(14(12)19)9-15-18-10(2)16-17-11(18)3/h4-5,7-9,19H,1,6H2,2-3H3	QHERJVGZDPKCLM-UHFFFAOYSA-N	Cc1nnc(C)n1N=Cc2cccc(CC=C)c2O	BroadT	BRD-K63568776	BRD-K63568776-001-07-2	InterBioScreen Ltd.	STOCK3S-07570			Cc1nnc(C)n1N=Cc1cccc(CC=C)c1O	InChI=1S/C14H16N4O/c1-4-6-12-7-5-8-13(14(12)19)9-15-18-10(2)16-17-11(18)3/h4-5,7-9,19H,1,6H2,2-3H3	QHERJVGZDPKCLM-UHFFFAOYSA-N	256.132411172							
BAS 03847979	LSM-16669	SID852161, BRD-K31436159	54692916	InChI=1S/C22H24N2O5/c1-4-11-24-16-8-6-5-7-15(16)20(25)19(22(24)27)21(26)23-13-14-9-10-17(28-2)18(12-14)29-3/h5-10,12,25H,4,11,13H2,1-3H3,(H,23,26)	UEFBBMRZSJITOF-UHFFFAOYSA-N	CCCN1C(=O)C(=C(O)c2ccccc12)C(=O)NCc3ccc(OC)c(OC)c3	BroadT	BRD-K31436159	BRD-K31436159-001-05-2	Asinex Ltd.	BAS 03847979			CCCn1c2ccccc2c(O)c(C(=O)NCc2ccc(OC)c(OC)c2)c1=O	InChI=1S/C22H24N2O5/c1-4-11-24-16-8-6-5-7-15(16)20(25)19(22(24)27)21(26)23-13-14-9-10-17(28-2)18(12-14)29-3/h5-10,12,25H,4,11,13H2,1-3H3,(H,23,26)	UEFBBMRZSJITOF-UHFFFAOYSA-N	396.168521888							105306
ST50674535	LSM-16670	SID7964839, BRD-K60334068	5307260	InChI=1S/C15H13N3O2S/c16-7-10-9-2-1-3-13(9)21-15(10)17-14(19)11-6-12(20-18-11)8-4-5-8/h6,8H,1-5H2,(H,17,19)	KXXDDIMSHHMFOE-UHFFFAOYSA-N	O=C(Nc1sc2CCCc2c1C#N)c3cc(on3)C4CC4	BroadT	BRD-K60334068	BRD-K60334068-001-05-3	ChemDiv Inc.	C226-2717			O=C(Nc1sc2CCCc2c1C#N)c1cc(on1)C1CC1	InChI=1S/C15H13N3O2S/c16-7-10-9-2-1-3-13(9)21-15(10)17-14(19)11-6-12(20-18-11)8-4-5-8/h6,8H,1-5H2,(H,17,19)	KXXDDIMSHHMFOE-UHFFFAOYSA-N	299.072847376							105307
ZINC02177347	LSM-16671	BRD-K49016171	6817679	InChI=1S/C21H21N3O5S/c1-29-20-10-6-5-9-18(20)24(30(2,27)28)14-21(26)23-22-13-17-16-8-4-3-7-15(16)11-12-19(17)25/h3-13,25H,14H2,1-2H3,(H,23,26)	MSESHGTVOSFQNM-UHFFFAOYSA-N	COc1ccccc1N(CC(=O)NN=Cc2c(O)ccc3ccccc23)S(=O)(=O)C	BroadT	BRD-K49016171	BRD-K49016171-001-08-0	Specs	AO-081/40838421			COc1ccccc1N(CC(=O)NN=Cc1c(O)ccc2ccccc12)S(C)(=O)=O	InChI=1S/C21H21N3O5S/c1-29-20-10-6-5-9-18(20)24(30(2,27)28)14-21(26)23-22-13-17-16-8-4-3-7-15(16)11-12-19(17)25/h3-13,25H,14H2,1-2H3,(H,23,26)	MSESHGTVOSFQNM-UHFFFAOYSA-N	427.120191492							
ST50889983	LSM-16672	SID4257935, BRD-K87501650	1245352	InChI=1S/C9H5F3N4OS/c10-9(11,12)7-15-16-8(18-7)14-6(17)5-2-1-3-13-4-5/h1-4H,(H,14,16,17)	HWBUIQQZXQVJLQ-UHFFFAOYSA-N	FC(F)(F)c1nnc(NC(=O)c2cccnc2)s1	BroadT	BRD-K87501650	BRD-K87501650-001-05-0	ChemBridge Corporation	7944984			FC(F)(F)c1nnc(NC(=O)c2cccnc2)s1	InChI=1S/C9H5F3N4OS/c10-9(11,12)7-15-16-8(18-7)14-6(17)5-2-1-3-13-4-5/h1-4H,(H,14,16,17)	HWBUIQQZXQVJLQ-UHFFFAOYSA-N	274.01361611							105309
SMR000034712	LSM-16673	SID860311, BRD-K67382203	661612	InChI=1S/C20H21N3O5S/c1-4-28-18(24)12-21-29(26,27)17-11-14(10-9-13(17)2)19-15-7-5-6-8-16(15)20(25)23(3)22-19/h5-11,21H,4,12H2,1-3H3	SCNANPLSNGDYJM-UHFFFAOYSA-N	CCOC(=O)CNS(=O)(=O)c1cc(ccc1C)C2=NN(C)C(=O)c3ccccc23	BroadT	BRD-K67382203	BRD-K67382203-001-05-1	InterBioScreen Ltd.	STOCK3S-63552			CCOC(=O)CNS(=O)(=O)c1cc(ccc1C)-c1nn(C)c(=O)c2ccccc12	InChI=1S/C20H21N3O5S/c1-4-28-18(24)12-21-29(26,27)17-11-14(10-9-13(17)2)19-15-7-5-6-8-16(15)20(25)23(3)22-19/h5-11,21H,4,12H2,1-3H3	SCNANPLSNGDYJM-UHFFFAOYSA-N	415.120191492							105310
6P-665S	LSM-16674	SID17409920, BRD-K24836328	1481300	InChI=1S/C22H21N5OS/c1-3-26-21(23-24-22(26)29-15-17-11-9-16(2)10-12-17)20-19(28)13-14-27(25-20)18-7-5-4-6-8-18/h4-14H,3,15H2,1-2H3	WQBBOQYKNAHQOL-UHFFFAOYSA-N	CCn1c(SCc2ccc(C)cc2)nnc1C3=NN(C=CC3=O)c4ccccc4	BroadT	BRD-K24836328	BRD-K24836328-001-05-8	Key Organics Ltd.	6P-665S			CCn1c(SCc2ccc(C)cc2)nnc1-c1nn(ccc1=O)-c1ccccc1	InChI=1S/C22H21N5OS/c1-3-26-21(23-24-22(26)29-15-17-11-9-16(2)10-12-17)20-19(28)13-14-27(25-20)18-7-5-4-6-8-18/h4-14H,3,15H2,1-2H3	WQBBOQYKNAHQOL-UHFFFAOYSA-N	403.146681032							105311
MLS000533056	LSM-43656	SID14736018, BRD-K47201960	699581	InChI=1S/C13H10FNO/c14-12-8-6-11(7-9-12)10-15(16)13-4-2-1-3-5-13/h1-10H/b15-10-	GJTOMWKYUWVHDO-GDNBJRDFSA-N	[O-]\[N+](=C/c1ccc(F)cc1)\c2ccccc2	BroadT	BRD-K47201960	BRD-K47201960-001-05-1	ChemBridge Corporation	5568026			[O-]\[N+](c1ccccc1)=C/c1ccc(F)cc1	InChI=1S/C13H10FNO/c14-12-8-6-11(7-9-12)10-15(16)13-4-2-1-3-5-13/h1-10H/b15-10-	GJTOMWKYUWVHDO-GDNBJRDFSA-N	215.07464215							
MLS000554398	LSM-16676	SID14730544, BRD-K18603805	1896708	InChI=1S/C20H19BrN4OS/c21-14-6-4-13(5-7-14)17(26)12-27-19-16(11-23)20(8-2-1-3-9-20)15(10-22)18(24)25-19/h4-7,25H,1-3,8-9,12,24H2	LNGPKGVQSMWPND-UHFFFAOYSA-N	NC1=C(C#N)C2(CCCCC2)C(=C(N1)SCC(=O)c3ccc(Br)cc3)C#N	BroadT	BRD-K18603805	BRD-K18603805-001-05-2	InterBioScreen Ltd.	STOCK1S-53305			NC1=C(C#N)C2(CCCCC2)C(C#N)=C(N1)SCC(=O)c1ccc(Br)cc1	InChI=1S/C20H19BrN4OS/c21-14-6-4-13(5-7-14)17(26)12-27-19-16(11-23)20(8-2-1-3-9-20)15(10-22)18(24)25-19/h4-7,25H,1-3,8-9,12,24H2	LNGPKGVQSMWPND-UHFFFAOYSA-N	442.046294558							105313
ASN 06361260	LSM-16677	SID24820941, BRD-K43755107	1469472	InChI=1S/C20H18F3N3O/c1-12-24-17-11-13(21)5-6-18(17)26(12)14-7-9-25(10-8-14)20(27)19-15(22)3-2-4-16(19)23/h2-6,11,14H,7-10H2,1H3	JXBVNXITYOIIBI-UHFFFAOYSA-N	Cc1nc2cc(F)ccc2n1C3CCN(CC3)C(=O)c4c(F)cccc4F	BroadT	BRD-K43755107	BRD-K43755107-001-05-4	Asinex Ltd.	ASN 06361260			Cc1nc2cc(F)ccc2n1C1CCN(CC1)C(=O)c1c(F)cccc1F	InChI=1S/C20H18F3N3O/c1-12-24-17-11-13(21)5-6-18(17)26(12)14-7-9-25(10-8-14)20(27)19-15(22)3-2-4-16(19)23/h2-6,11,14H,7-10H2,1H3	JXBVNXITYOIIBI-UHFFFAOYSA-N	373.140196826							105314
AO-476/42871121	LSM-16678	SID17401130, BRD-K73359067	990429	InChI=1S/C20H19N3O2S2/c1-3-25-19(24)15-12-16(14-9-5-4-6-10-14)27-18(15)23-20(26)22-17-11-7-8-13(2)21-17/h4-12H,3H2,1-2H3,(H2,21,22,23,26)	YWWWFWKNQUIDIL-UHFFFAOYSA-N	CCOC(=O)c1cc(sc1N=C(S)Nc2cccc(C)n2)c3ccccc3	BroadT	BRD-K73359067	BRD-K73359067-001-06-4	Specs	AO-476/42871121			CCOC(=O)c1cc(sc1N=C(S)Nc1cccc(C)n1)-c1ccccc1	InChI=1S/C20H19N3O2S2/c1-3-25-19(24)15-12-16(14-9-5-4-6-10-14)27-18(15)23-20(26)22-17-11-7-8-13(2)21-17/h4-12H,3H2,1-2H3,(H2,21,22,23,26)	YWWWFWKNQUIDIL-UHFFFAOYSA-N	397.091868258							105315
MLS000698233	LSM-16679	SID22414381, BRD-K42926668	4417395	InChI=1S/C23H25N5O2/c1-27(2)18-12-8-16(9-13-18)24-22(29)20-6-5-7-21(26-20)23(30)25-17-10-14-19(15-11-17)28(3)4/h5-15H,1-4H3,(H,24,29)(H,25,30)	ZXVOFYQLYHBRQU-UHFFFAOYSA-N	CN(C)c1ccc(NC(=O)c2cccc(n2)C(=O)Nc3ccc(cc3)N(C)C)cc1	BroadT	BRD-K42926668	BRD-K42926668-001-05-3	Specs	AK-968/13025282			CN(C)c1ccc(NC(=O)c2cccc(n2)C(=O)Nc2ccc(cc2)N(C)C)cc1	InChI=1S/C23H25N5O2/c1-27(2)18-12-8-16(9-13-18)24-22(29)20-6-5-7-21(26-20)23(30)25-17-10-14-19(15-11-17)28(3)4/h5-15H,1-4H3,(H,24,29)(H,25,30)	ZXVOFYQLYHBRQU-UHFFFAOYSA-N	403.20082509							105316
N-(3-Chloro-4-methylphenyl)-2-(2-formylphenoxy)acetamide	LSM-16680	SID24798088, BRD-K53040706	975145	InChI=1S/C16H14ClNO3/c1-11-6-7-13(8-14(11)17)18-16(20)10-21-15-5-3-2-4-12(15)9-19/h2-9H,10H2,1H3,(H,18,20)	YJMUUDQNUQGPCK-UHFFFAOYSA-N	Cc1ccc(NC(=O)COc2ccccc2C=O)cc1Cl	BroadT	BRD-K53040706	BRD-K53040706-001-05-3	ChemBridge Corporation	7669922			Cc1ccc(NC(=O)COc2ccccc2C=O)cc1Cl	InChI=1S/C16H14ClNO3/c1-11-6-7-13(8-14(11)17)18-16(20)10-21-15-5-3-2-4-12(15)9-19/h2-9H,10H2,1H3,(H,18,20)	YJMUUDQNUQGPCK-UHFFFAOYSA-N	303.066221028							105317
BAS 00107569	LSM-43622	BRD-K69606559	5749514	InChI=1S/C23H22N2O/c1-3-19(24-20-12-6-5-7-13-20)16-23-25(4-2)21-14-17-10-8-9-11-18(17)15-22(21)26-23/h5-16H,3-4H2,1-2H3/p+1	PXIJCSZNPGOKCC-UHFFFAOYSA-O	CC\C(=C/c1oc2cc3ccccc3cc2[n+]1CC)\Nc4ccccc4	BroadT	BRD-K69606559	BRD-K69606559-005-05-2	Asinex Ltd.	BAS 00107569		I	CC\C(Nc1ccccc1)=C/c1oc2cc3ccccc3cc2[n+]1CC.I	InChI=1S/C23H22N2O.HI/c1-3-19(24-20-12-6-5-7-13-20)16-23-25(4-2)21-14-17-10-8-9-11-18(17)15-22(21)26-23;/h5-16H,3-4H2,1-2H3;1H/p+1	BTWPKNKVJUTEJV-UHFFFAOYSA-O	343.181038376							104139, 104139
Methyl 5-cyano-6-mercapto-2-(methoxymethyl)nicotinate	LSM-16681	SID26730237, BRD-K11000810	2745168	InChI=1S/C10H10N2O3S/c1-14-5-8-7(10(13)15-2)3-6(4-11)9(16)12-8/h3H,5H2,1-2H3,(H,12,16)	SYPFPQUWMZYAMG-UHFFFAOYSA-N	COCc1nc(S)c(cc1C(=O)OC)C#N	BroadT	BRD-K11000810	BRD-K11000810-001-06-9	Maybridge	SPB 04228			COCc1nc(S)c(cc1C(=O)OC)C#N	InChI=1S/C10H10N2O3S/c1-14-5-8-7(10(13)15-2)3-6(4-11)9(16)12-8/h3H,5H2,1-2H3,(H,12,16)	SYPFPQUWMZYAMG-UHFFFAOYSA-N	238.04121289							105318
F0593-0113	LSM-16682	SID4248131, BRD-K24909307	2155639	InChI=1S/C17H24N4O4S2/c1-4-10-21(11-5-2)27(23,24)14-8-6-13(7-9-14)16(22)18-17-20-19-15(25-17)12-26-3/h6-9H,4-5,10-12H2,1-3H3,(H,18,20,22)	HVLKDJSIDWXBSW-UHFFFAOYSA-N	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)Nc2oc(CSC)nn2	BroadT	BRD-K24909307	BRD-K24909307-001-05-8	ChemDiv Inc.	C079-0454			CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(CSC)o1	InChI=1S/C17H24N4O4S2/c1-4-10-21(11-5-2)27(23,24)14-8-6-13(7-9-14)16(22)18-17-20-19-15(25-17)12-26-3/h6-9H,4-5,10-12H2,1-3H3,(H,18,20,22)	HVLKDJSIDWXBSW-UHFFFAOYSA-N	412.123896668							105319
AC1M6HK0	LSM-43657	BRD-K89800944	2349040	InChI=1S/C20H20BrN3O/c1-20(2)15-9-5-7-11-17(15)24(3)18(20)12-13-22-23-19(25)14-8-4-6-10-16(14)21/h4-13H,1-3H3,(H,23,25)/b18-12-,22-13?	AHHYRYPJQFSHMQ-MOZTWKHESA-N	CN1\C(=C/C=NNC(=O)c2ccccc2Br)\C(C)(C)c3ccccc13	BroadT	BRD-K89800944	BRD-K89800944-001-05-0	Enamine Ltd.	T0508-3044			CN1c2ccccc2C(C)(C)\C1=C\C=NNC(=O)c1ccccc1Br	InChI=1S/C20H20BrN3O/c1-20(2)15-9-5-7-11-17(15)24(3)18(20)12-13-22-23-19(25)14-8-4-6-10-16(14)21/h4-13H,1-3H3,(H,23,25)/b18-12-,22-13?	AHHYRYPJQFSHMQ-MOZTWKHESA-N	397.07897489							
7J-349S	LSM-16684	SID14730668, BRD-K44163929	1483859	InChI=1S/C19H20ClNO2S2/c1-12-9-14(10-13(2)18(12)23-19(24)21(3)4)17(22)11-25-16-7-5-15(20)6-8-16/h5-10H,11H2,1-4H3	XWUXYAJOOMSNKT-UHFFFAOYSA-N	CN(C)C(=S)Oc1c(C)cc(cc1C)C(=O)CSc2ccc(Cl)cc2	BroadT	BRD-K44163929	BRD-K44163929-001-05-6	Key Organics Ltd.	7J-349S			CN(C)C(=S)Oc1c(C)cc(cc1C)C(=O)CSc1ccc(Cl)cc1	InChI=1S/C19H20ClNO2S2/c1-12-9-14(10-13(2)18(12)23-19(24)21(3)4)17(22)11-25-16-7-5-15(20)6-8-16/h5-10H,11H2,1-4H3	XWUXYAJOOMSNKT-UHFFFAOYSA-N	393.06239798							105321
4-Chloro-n-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzamide	LSM-16685	SID17411805, BRD-K58562639	884414	InChI=1S/C20H14ClN3O/c21-16-8-4-15(5-9-16)20(25)22-17-10-6-14(7-11-17)18-13-24-12-2-1-3-19(24)23-18/h1-13H,(H,22,25)	LEUUQPOUJRNFNP-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)Nc2ccc(cc2)c3cn4ccccc4n3	BroadT	BRD-K58562639	BRD-K58562639-001-05-3	ChemBridge Corporation	6596750			Clc1ccc(cc1)C(=O)Nc1ccc(cc1)-c1cn2ccccc2n1	InChI=1S/C20H14ClN3O/c21-16-8-4-15(5-9-16)20(25)22-17-10-6-14(7-11-17)18-13-24-12-2-1-3-19(24)23-18/h1-13H,(H,22,25)	LEUUQPOUJRNFNP-UHFFFAOYSA-N	347.082539808							105322
AC1N24WH	LSM-16686	BRD-A29501982	4041117	InChI=1S/C17H14F2N4OS2/c18-16(19)25-13-6-3-4-11(8-13)9-14-15(24)22-17(26-14)23-21-10-12-5-1-2-7-20-12/h1-8,10,14,16H,9H2,(H,22,23,24)	CIZCEUDVSNCUDP-UHFFFAOYSA-N	FC(F)Sc1cccc(CC2SC(=NC2=O)NN=Cc3ccccn3)c1	BroadT	BRD-A29501982	BRD-A29501982-001-06-0	InterBioScreen Ltd.	STOCK4S-69926			FC(F)Sc1cccc(CC2SC(NN=Cc3ccccn3)=NC2=O)c1	InChI=1S/C17H14F2N4OS2/c18-16(19)25-13-6-3-4-11(8-13)9-14-15(24)22-17(26-14)23-21-10-12-5-1-2-7-20-12/h1-8,10,14,16H,9H2,(H,22,23,24)	CIZCEUDVSNCUDP-UHFFFAOYSA-N	392.057708888							105323
MLS000091527	LSM-16687	SID4240600, BRD-K67519598	3235686	InChI=1S/C18H14N4O3/c1-11-3-5-14(25-11)16-17(22-8-2-7-19-18(22)21-16)20-12-4-6-13-15(9-12)24-10-23-13/h2-9,20H,10H2,1H3	ZTWDOLCMYNFAIW-UHFFFAOYSA-N	Cc1oc(cc1)c2nc3ncccn3c2Nc4ccc5OCOc5c4	BroadT	BRD-K67519598	BRD-K67519598-001-05-1	ChemDiv Inc.	C325-0114			Cc1ccc(o1)-c1nc2ncccn2c1Nc1ccc2OCOc2c1	InChI=1S/C18H14N4O3/c1-11-3-5-14(25-11)16-17(22-8-2-7-19-18(22)21-16)20-12-4-6-13-15(9-12)24-10-23-13/h2-9,20H,10H2,1H3	ZTWDOLCMYNFAIW-UHFFFAOYSA-N	334.106590348							105324
CBMICRO_038371	LSM-16688	SID47202121, BRD-K68749384	767560	InChI=1S/C18H22N4O/c1-21-11-8-14-17(20-16(23)12-22-9-4-5-10-22)13-6-2-3-7-15(13)19-18(14)21/h2-3,6-7H,4-5,8-12H2,1H3,(H,19,20,23)	VLEXSUFTPPVMOX-UHFFFAOYSA-N	CN1CCc2c(NC(=O)CN3CCCC3)c4ccccc4nc12	BroadT	BRD-K68749384	BRD-K68749384-001-05-1	ChemBridge Corporation	5936665			CN1CCc2c1nc1ccccc1c2NC(=O)CN1CCCC1	InChI=1S/C18H22N4O/c1-21-11-8-14-17(20-16(23)12-22-9-4-5-10-22)13-6-2-3-7-15(13)19-18(14)21/h2-3,6-7H,4-5,8-12H2,1H3,(H,19,20,23)	VLEXSUFTPPVMOX-UHFFFAOYSA-N	310.179361364							105325
AC1MTAHT	LSM-16689	BRD-K92575008	3597517	InChI=1S/C18H17N3O4/c1-11(13-4-3-5-15(8-13)19-12(2)22)20-21-18(23)14-6-7-16-17(9-14)25-10-24-16/h3-9H,10H2,1-2H3,(H,19,22)(H,21,23)	OPOLKWVBRQDJAC-UHFFFAOYSA-N	CC(=O)Nc1cccc(c1)C(=NNC(=O)c2ccc3OCOc3c2)C	BroadT	BRD-K92575008	BRD-K92575008-001-05-6	Enamine Ltd.	T0510-4299			CC(=O)Nc1cccc(c1)C(C)=NNC(=O)c1ccc2OCOc2c1	InChI=1S/C18H17N3O4/c1-11(13-4-3-5-15(8-13)19-12(2)22)20-21-18(23)14-6-7-16-17(9-14)25-10-24-16/h3-9H,10H2,1-2H3,(H,19,22)(H,21,23)	OPOLKWVBRQDJAC-UHFFFAOYSA-N	339.121906054							105326
Ursinoic acid	LSM-16690	SID7975577	795044	InChI=1S/C15H16O5/c1-15(2)7-6-10-12(19-3)5-4-9(14(10)20-15)11(16)8-13(17)18/h4-7H,8H2,1-3H3,(H,17,18)	XUXBOSSCMLZGTA-UHFFFAOYSA-N	COc1ccc(C(=O)CC(=O)O)c2OC(C)(C)C=Cc12	BroadT	BRD-K92405402	BRD-K92405402-001-08-2	ChemBridge Corporation	5325432			COc1ccc(C(=O)CC(O)=O)c2OC(C)(C)C=Cc12	InChI=1S/C15H16O5/c1-15(2)7-6-10-12(19-3)5-4-9(14(10)20-15)11(16)8-13(17)18/h4-7H,8H2,1-3H3,(H,17,18)	XUXBOSSCMLZGTA-UHFFFAOYSA-N	276.099773612							105327
AK-968/15609273	LSM-16691	SID24804833, BRD-K88476487	1017819	InChI=1S/C19H20N4O5/c1-12-18(23(25)26)13(2)22(21-12)11-16-8-9-17(28-16)19(24)20-10-14-4-6-15(27-3)7-5-14/h4-9H,10-11H2,1-3H3,(H,20,24)	YZMHCMFLUHZCAB-UHFFFAOYSA-N	COc1ccc(CNC(=O)c2oc(Cn3nc(C)c(c3C)[N+](=O)[O-])cc2)cc1	BroadT	BRD-K88476487	BRD-K88476487-001-05-3	Asinex Ltd.	BAS 06330869			COc1ccc(CNC(=O)c2ccc(Cn3nc(C)c(c3C)[N+]([O-])=O)o2)cc1	InChI=1S/C19H20N4O5/c1-12-18(23(25)26)13(2)22(21-12)11-16-8-9-17(28-16)19(24)20-10-14-4-6-15(27-3)7-5-14/h4-9H,10-11H2,1-3H3,(H,20,24)	YZMHCMFLUHZCAB-UHFFFAOYSA-N	384.14336978							105328
ASN 05113908	LSM-16692	SID845408, BRD-K84869175	647750	InChI=1S/C25H29FN4O4/c1-33-22-14-17-13-18(24(31)28-21(17)15-23(22)34-2)16-30(12-11-29-9-3-4-10-29)25(32)27-20-7-5-19(26)6-8-20/h5-8,13-15H,3-4,9-12,16H2,1-2H3,(H,27,32)(H,28,31)	FADKQGLCXGXHGK-UHFFFAOYSA-N	COc1cc2cc(CN(CCN3CCCC3)C(=O)Nc4ccc(F)cc4)c(O)nc2cc1OC	BroadT	BRD-K84869175	BRD-K84869175-001-04-3	Asinex Ltd.	ASN 05113908			COc1cc2cc(CN(CCN3CCCC3)C(=O)Nc3ccc(F)cc3)c(O)nc2cc1OC	InChI=1S/C25H29FN4O4/c1-33-22-14-17-13-18(24(31)28-21(17)15-23(22)34-2)16-30(12-11-29-9-3-4-10-29)25(32)27-20-7-5-19(26)6-8-20/h5-8,13-15H,3-4,9-12,16H2,1-2H3,(H,27,32)(H,28,31)	FADKQGLCXGXHGK-UHFFFAOYSA-N	468.217283648							105329
T0508-6290	LSM-16693	SID24828725, BRD-K99154059	2352607	InChI=1S/C13H10Cl2N2O4/c14-10-4-8(5-17-12(10)15)13(19)21-7-11(18)16-6-9-2-1-3-20-9/h1-5H,6-7H2,(H,16,18)	BCVHWIOZSQTJIV-UHFFFAOYSA-N	Clc1cc(cnc1Cl)C(=O)OCC(=O)NCc2occc2	BroadT	BRD-K99154059	BRD-K99154059-001-05-1	Enamine Ltd.	T0508-6290			Clc1cc(cnc1Cl)C(=O)OCC(=O)NCc1ccco1	InChI=1S/C13H10Cl2N2O4/c14-10-4-8(5-17-12(10)15)13(19)21-7-11(18)16-6-9-2-1-3-20-9/h1-5H,6-7H2,(H,16,18)	BCVHWIOZSQTJIV-UHFFFAOYSA-N	328.00176224							105330
2-(1-Benzyl-1H-tetrazol-5-ylsulfanyl)-n-(2-methoxy-5-methyl-phenyl)-acetamide	LSM-16694	SID842677, BRD-K91134902	644948	InChI=1S/C18H19N5O2S/c1-13-8-9-16(25-2)15(10-13)19-17(24)12-26-18-20-21-22-23(18)11-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3,(H,19,24)	CKQUDGUKOIEHOC-UHFFFAOYSA-N	COc1ccc(C)cc1NC(=O)CSc2nnnn2Cc3ccccc3	BroadT	BRD-K91134902	BRD-K91134902-001-05-0	Asinex Ltd.	ASN 09961921			COc1ccc(C)cc1NC(=O)CSc1nnnn1Cc1ccccc1	InChI=1S/C18H19N5O2S/c1-13-8-9-16(25-2)15(10-13)19-17(24)12-26-18-20-21-22-23(18)11-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3,(H,19,24)	CKQUDGUKOIEHOC-UHFFFAOYSA-N	369.125945588							105331
SMR000026847	LSM-16695	SID4249493, BRD-K42630152	3243437	InChI=1S/C14H20N2O3S/c1-3-8-15-20(18,19)13-6-7-14-12(10-13)5-4-9-16(14)11(2)17/h6-7,10,15H,3-5,8-9H2,1-2H3	KKHMZTFYFSTEGX-UHFFFAOYSA-N	CCCNS(=O)(=O)c1ccc2N(CCCc2c1)C(=O)C	BroadT	BRD-K42630152	BRD-K42630152-001-07-0	ChemDiv Inc.	C444-1852			CCCNS(=O)(=O)c1ccc2N(CCCc2c1)C(C)=O	InChI=1S/C14H20N2O3S/c1-3-8-15-20(18,19)13-6-7-14-12(10-13)5-4-9-16(14)11(2)17/h6-7,10,15H,3-5,8-9H2,1-2H3	KKHMZTFYFSTEGX-UHFFFAOYSA-N	296.11946321							105332
MLS000055045	LSM-16696	SID3715825, BRD-K62834004	854591	InChI=1S/C18H16O6/c1-3-22-18(21)15-7-5-12(23-15)9-14(20)17-10(2)13-6-4-11(19)8-16(13)24-17/h4-8,19H,3,9H2,1-2H3	QLROMLCJNZEAIL-UHFFFAOYSA-N	CCOC(=O)c1oc(CC(=O)c2oc3cc(O)ccc3c2C)cc1	BroadT	BRD-K62834004	BRD-K62834004-001-05-7	Enamine Ltd.	T0503-8250			CCOC(=O)c1ccc(CC(=O)c2oc3cc(O)ccc3c2C)o1	InChI=1S/C18H16O6/c1-3-22-18(21)15-7-5-12(23-15)9-14(20)17-10(2)13-6-4-11(19)8-16(13)24-17/h4-8,19H,3,9H2,1-2H3	QLROMLCJNZEAIL-UHFFFAOYSA-N	328.094688232							105333
SMR000207947	LSM-16697	SID17512515, BRD-K69342045	4229681	InChI=1S/C18H14ClFN2O3S2/c19-13-3-1-4-14(10-13)22-18(23)12-6-7-16(20)17(9-12)27(24,25)21-11-15-5-2-8-26-15/h1-10,21H,11H2,(H,22,23)	YUKWDCNWSHYLAY-UHFFFAOYSA-N	Fc1ccc(cc1S(=O)(=O)NCc2cccs2)C(=O)Nc3cccc(Cl)c3	BroadT	BRD-K69342045	BRD-K69342045-001-05-5	ChemDiv Inc.	K781-6692			Fc1ccc(cc1S(=O)(=O)NCc1cccs1)C(=O)Nc1cccc(Cl)c1	InChI=1S/C18H14ClFN2O3S2/c19-13-3-1-4-14(10-13)22-18(23)12-6-7-16(20)17(9-12)27(24,25)21-11-15-5-2-8-26-15/h1-10,21H,11H2,(H,22,23)	YUKWDCNWSHYLAY-UHFFFAOYSA-N	424.011839618							105334
T6120205	LSM-16698	SID50086489, BRD-K47724584	24856285	InChI=1S/C26H23ClN2O6/c1-17(30)35-21-13-11-19(12-14-21)18-7-9-20(10-8-18)26(33)34-16-25(32)29(2)15-24(31)28-23-6-4-3-5-22(23)27/h3-14H,15-16H2,1-2H3,(H,28,31)	WTBGCJYVPQZDJI-UHFFFAOYSA-N	CN(CC(=O)Nc1ccccc1Cl)C(=O)COC(=O)c2ccc(cc2)c3ccc(OC(=O)C)cc3	BroadT	BRD-K47724584	BRD-K47724584-001-05-8	UkrOrgSynthesis Ltd.	PB-08171401			CN(CC(=O)Nc1ccccc1Cl)C(=O)COC(=O)c1ccc(cc1)-c1ccc(OC(C)=O)cc1	InChI=1S/C26H23ClN2O6/c1-17(30)35-21-13-11-19(12-14-21)18-7-9-20(10-8-18)26(33)34-16-25(32)29(2)15-24(31)28-23-6-4-3-5-22(23)27/h3-14H,15-16H2,1-2H3,(H,28,31)	WTBGCJYVPQZDJI-UHFFFAOYSA-N	494.124464186							105335
MLS000033658	LSM-16699	SID851647, BRD-K54854617	654231	InChI=1S/C21H16N2O4/c22-11-14-5-1-3-7-16(14)26-12-18(24)23-19-15-6-2-4-8-17(15)27-21(19)20(25)13-9-10-13/h1-8,13H,9-10,12H2,(H,23,24)	FJJRKQUVBYDXEB-UHFFFAOYSA-N	O=C(COc1ccccc1C#N)Nc2c(oc3ccccc23)C(=O)C4CC4	BroadT	BRD-K54854617	BRD-K54854617-001-05-4	Asinex Ltd.	BAS 07119755			O=C(COc1ccccc1C#N)Nc1c(oc2ccccc12)C(=O)C1CC1	InChI=1S/C21H16N2O4/c22-11-14-5-1-3-7-16(14)26-12-18(24)23-19-15-6-2-4-8-17(15)27-21(19)20(25)13-9-10-13/h1-8,13H,9-10,12H2,(H,23,24)	FJJRKQUVBYDXEB-UHFFFAOYSA-N	360.111007012							105336
SMR000161526	LSM-16700	SID17386898, BRD-K21708981	9511286	InChI=1S/C31H33N3O2/c35-29-24-28(30(25-12-4-1-5-13-25)26-14-6-2-7-15-26)31(36)34(29)19-11-10-18-32-20-22-33(23-21-32)27-16-8-3-9-17-27/h1-9,12-17H,10-11,18-24H2	QFESFPVBIJPECI-UHFFFAOYSA-N	O=C1CC(=C(c2ccccc2)c3ccccc3)C(=O)N1CCCCN4CCN(CC4)c5ccccc5	BroadT	BRD-K21708981	BRD-K21708981-001-05-0	Specs	AP-685/41280749			O=C1CC(=C(c2ccccc2)c2ccccc2)C(=O)N1CCCCN1CCN(CC1)c1ccccc1	InChI=1S/C31H33N3O2/c35-29-24-28(30(25-12-4-1-5-13-25)26-14-6-2-7-15-26)31(36)34(29)19-11-10-18-32-20-22-33(23-21-32)27-16-8-3-9-17-27/h1-9,12-17H,10-11,18-24H2	QFESFPVBIJPECI-UHFFFAOYSA-N	479.257277326							105337
AC1OB3M2	LSM-16701	BRD-A52347740	6814660	InChI=1S/C14H18Br2N2O/c1-9-4-3-5-10(2)18(9)17-8-11-6-12(15)7-13(16)14(11)19/h6-10,19H,3-5H2,1-2H3	HCKUBOUDEFJALS-UHFFFAOYSA-N	CC1CCCC(C)N1N=Cc2cc(Br)cc(Br)c2O	BroadT	BRD-A52347740	BRD-A52347740-001-06-1	Enamine Ltd.	T0514-2775			CC1CCCC(C)N1N=Cc1cc(Br)cc(Br)c1O	InChI=1S/C14H18Br2N2O/c1-9-4-3-5-10(2)18(9)17-8-11-6-12(15)7-13(16)14(11)19/h6-10,19H,3-5H2,1-2H3	HCKUBOUDEFJALS-UHFFFAOYSA-N	387.978588416							
MLS000565038	LSM-16702	SID14745918, BRD-A87245464	4367643	InChI=1S/C18H19NO/c1-18(15-10-6-3-7-11-15)13-16-12-17(19(18)20-16)14-8-4-2-5-9-14/h2-11,16-17H,12-13H2,1H3	OHDUOGAHBVEMMM-UHFFFAOYSA-N	CC1(CC2CC(N1O2)c3ccccc3)c4ccccc4	BroadT	BRD-A87245464	BRD-A87245464-001-06-0	Enamine Ltd.	T0516-1084			CC1(CC2CC(N1O2)c1ccccc1)c1ccccc1	InChI=1S/C18H19NO/c1-18(15-10-6-3-7-11-15)13-16-12-17(19(18)20-16)14-8-4-2-5-9-14/h2-11,16-17H,12-13H2,1H3	OHDUOGAHBVEMMM-UHFFFAOYSA-N	265.146664238							105339
2,6-Diphenyl-3-propyltetrahydropyridin-4(1H)-one oxime	LSM-16703	BRD-A10244319	2729779	InChI=1S/C20H24N2O/c1-2-9-17-19(22-23)14-18(15-10-5-3-6-11-15)21-20(17)16-12-7-4-8-13-16/h3-8,10-13,17-18,20-21,23H,2,9,14H2,1H3	UWBQKEUMMHOFLM-UHFFFAOYSA-N	CCCC1C(NC(CC1=NO)c2ccccc2)c3ccccc3	BroadT	BRD-A10244319	BRD-A10244319-001-05-4	Asinex Ltd.	BAS 00119093			CCCC1C(NC(CC1=NO)c1ccccc1)c1ccccc1	InChI=1S/C20H24N2O/c1-2-9-17-19(22-23)14-18(15-10-5-3-6-11-15)21-20(17)16-12-7-4-8-13-16/h3-8,10-13,17-18,20-21,23H,2,9,14H2,1H3	UWBQKEUMMHOFLM-UHFFFAOYSA-N	308.188863408							105340
ST50763317	LSM-16704	SID17506777, BRD-K57478964	892410	InChI=1S/C20H25N3S/c1-16-8-9-19(17(2)14-16)21-20(24)23-12-10-22(11-13-23)15-18-6-4-3-5-7-18/h3-9,14H,10-13,15H2,1-2H3,(H,21,24)	BUBMOMNOVFVHTB-UHFFFAOYSA-N	Cc1ccc(N=C(S)N2CCN(Cc3ccccc3)CC2)c(C)c1	BroadT	BRD-K57478964	BRD-K57478964-001-05-8	ChemBridge Corporation	7535031			Cc1ccc(N=C(S)N2CCN(Cc3ccccc3)CC2)c(C)c1	InChI=1S/C20H25N3S/c1-16-8-9-19(17(2)14-16)21-20(24)23-12-10-22(11-13-23)15-18-6-4-3-5-7-18/h3-9,14H,10-13,15H2,1-2H3,(H,21,24)	BUBMOMNOVFVHTB-UHFFFAOYSA-N	339.17691852							105341
ST50920553	LSM-43658	SID22415845, BRD-K06922312	898452	InChI=1S/C14H10ClFN2O/c15-12-2-1-3-13(16)11(12)4-5-14(19)18-10-6-8-17-9-7-10/h1-9H,(H,17,18,19)/b5-4+	NBHFWMITXRYMCK-SNAWJCMRSA-N	Fc1cccc(Cl)c1\C=C\C(=O)Nc2ccncc2	BroadT	BRD-K06922312	BRD-K06922312-001-05-6	ChemBridge Corporation	7277190			Fc1cccc(Cl)c1\C=C\C(=O)Nc1ccncc1	InChI=1S/C14H10ClFN2O/c15-12-2-1-3-13(16)11(12)4-5-14(19)18-10-6-8-17-9-7-10/h1-9H,(H,17,18,19)/b5-4+	NBHFWMITXRYMCK-SNAWJCMRSA-N	276.04656887							
MLS000114955	LSM-16706	SID7966723, BRD-A53967473	5308406	InChI=1S/C18H18FN5O/c1-25-14-4-2-3-12(9-14)16-10-15(11-5-7-13(19)8-6-11)21-18-22-17(20)23-24(16)18/h2-9,15-16H,10H2,1H3,(H3,20,21,22,23)	JITIYKVPTGBVMR-UHFFFAOYSA-N	COc1cccc(c1)C2CC(Nc3nc(N)nn23)c4ccc(F)cc4	BroadT	BRD-A53967473	BRD-A53967473-001-04-3	ChemDiv Inc.	6321-0437			COc1cccc(c1)C1CC(Nc2nc(N)nn12)c1ccc(F)cc1	InChI=1S/C18H18FN5O/c1-25-14-4-2-3-12(9-14)16-10-15(11-5-7-13(19)8-6-11)21-18-22-17(20)23-24(16)18/h2-9,15-16H,10H2,1H3,(H3,20,21,22,23)	JITIYKVPTGBVMR-UHFFFAOYSA-N	339.149538446							105343
AC1LE8ND	LSM-16707	BRD-K49219725	708192	InChI=1S/C16H14FNO2/c1-11-3-5-13(6-4-11)12(2)18-20-16(19)14-7-9-15(17)10-8-14/h3-10H,1-2H3	KFKKOMPVTPPYPO-UHFFFAOYSA-N	CC(=NOC(=O)c1ccc(F)cc1)c2ccc(C)cc2	BroadT	BRD-K49219725	BRD-K49219725-001-05-7	Asinex Ltd.	BAS 00295556			CC(=NOC(=O)c1ccc(F)cc1)c1ccc(C)cc1	InChI=1S/C16H14FNO2/c1-11-3-5-13(6-4-11)12(2)18-20-16(19)14-7-9-15(17)10-8-14/h3-10H,1-2H3	KFKKOMPVTPPYPO-UHFFFAOYSA-N	271.100856898							105344
T5242575	LSM-16708	SID22402959, BRD-A22235376	4654829	InChI=1S/C22H25N3O3/c1-14(2)15(3)23-21(26)13-28-22(27)17-10-11-20-19(12-17)24-16(4)25(20)18-8-6-5-7-9-18/h5-12,14-15H,13H2,1-4H3,(H,23,26)	ZTNNFWYALCMNJH-UHFFFAOYSA-N	CC(C)C(C)NC(=O)COC(=O)c1ccc2c(c1)nc(C)n2c3ccccc3	BroadT	BRD-A22235376	BRD-A22235376-001-05-8	Enamine Ltd.	T5242575			CC(C)C(C)NC(=O)COC(=O)c1ccc2n(c(C)nc2c1)-c1ccccc1	InChI=1S/C22H25N3O3/c1-14(2)15(3)23-21(26)13-28-22(27)17-10-11-20-19(12-17)24-16(4)25(20)18-8-6-5-7-9-18/h5-12,14-15H,13H2,1-4H3,(H,23,26)	ZTNNFWYALCMNJH-UHFFFAOYSA-N	379.18959169							105345
MLS000550819	LSM-16709	SID17408888, BRD-K62074815	1088819	InChI=1S/C24H25N3O4/c1-18-4-2-5-21(16-18)31-17-23(28)25-19-7-9-20(10-8-19)26-11-13-27(14-12-26)24(29)22-6-3-15-30-22/h2-10,15-16H,11-14,17H2,1H3,(H,25,28)	PAKPPURFMNDWCG-UHFFFAOYSA-N	Cc1cccc(OCC(=O)Nc2ccc(cc2)N3CCN(CC3)C(=O)c4occc4)c1	BroadT	BRD-K62074815	BRD-K62074815-001-05-9	Asinex Ltd.	BAS 07245815			Cc1cccc(OCC(=O)Nc2ccc(cc2)N2CCN(CC2)C(=O)c2ccco2)c1	InChI=1S/C24H25N3O4/c1-18-4-2-5-21(16-18)31-17-23(28)25-19-7-9-20(10-8-19)26-11-13-27(14-12-26)24(29)22-6-3-15-30-22/h2-10,15-16H,11-14,17H2,1H3,(H,25,28)	PAKPPURFMNDWCG-UHFFFAOYSA-N	419.18450631							105346
5-Acetylacenaphthene	LSM-16710	SID14742190, BRD-K72626323	97668	InChI=1S/C14H12O/c1-9(15)12-8-7-11-6-5-10-3-2-4-13(12)14(10)11/h2-4,7-8H,5-6H2,1H3	SYGRLGANSVWJGM-UHFFFAOYSA-N	CC(=O)c1ccc2CCc3cccc1c23	BroadT	BRD-K72626323	BRD-K72626323-001-05-9	InterBioScreen Ltd.	STOCK1S-74757			CC(=O)c1ccc2CCc3cccc1c23	InChI=1S/C14H12O/c1-9(15)12-8-7-11-6-5-10-3-2-4-13(12)14(10)11/h2-4,7-8H,5-6H2,1H3	SYGRLGANSVWJGM-UHFFFAOYSA-N	196.088815004							105347
1-Cyclohexyl-3-(3-ethylphenyl)urea	LSM-16711	SID4257756, BRD-K86758689	898087	InChI=1S/C15H22N2O/c1-2-12-7-6-10-14(11-12)17-15(18)16-13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9H2,1H3,(H2,16,17,18)	STXMSUGVXDMHKL-UHFFFAOYSA-N	CCc1cccc(NC(=O)NC2CCCCC2)c1	BroadT	BRD-K86758689	BRD-K86758689-001-05-2	ChemBridge Corporation	7266374			CCc1cccc(NC(=O)NC2CCCCC2)c1	InChI=1S/C15H22N2O/c1-2-12-7-6-10-14(11-12)17-15(18)16-13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9H2,1H3,(H2,16,17,18)	STXMSUGVXDMHKL-UHFFFAOYSA-N	246.173213344							105348
MLS000571277	LSM-16712	SID17415024, BRD-K57242504	877450	InChI=1S/C15H14N2O3/c18-15(9-10-16-13-6-2-1-3-7-13)12-5-4-8-14(11-12)17(19)20/h1-8,11,16H,9-10H2	HZWOIIAHZHTTNX-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C(=O)CCNc2ccccc2	BroadT	BRD-K57242504	BRD-K57242504-001-06-3	ChemBridge Corporation	5928848			[O-][N+](=O)c1cccc(c1)C(=O)CCNc1ccccc1	InChI=1S/C15H14N2O3/c18-15(9-10-16-13-6-2-1-3-7-13)12-5-4-8-14(11-12)17(19)20/h1-8,11,16H,9-10H2	HZWOIIAHZHTTNX-UHFFFAOYSA-N	270.100442328							105349
N-(3-Furan-2-yl-3-phenyl-propyl)-4-methyl-benzenesulfonamide	LSM-16713	SID17505152, BRD-A64608158	2930513	InChI=1S/C20H21NO3S/c1-16-9-11-18(12-10-16)25(22,23)21-14-13-19(20-8-5-15-24-20)17-6-3-2-4-7-17/h2-12,15,19,21H,13-14H2,1H3	JAOSEIAJTQKXPZ-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NCCC(c2occc2)c3ccccc3	BroadT	BRD-A64608158	BRD-A64608158-001-05-9	Asinex Ltd.	BAS 04915134			Cc1ccc(cc1)S(=O)(=O)NCCC(c1ccco1)c1ccccc1	InChI=1S/C20H21NO3S/c1-16-9-11-18(12-10-16)25(22,23)21-14-13-19(20-8-5-15-24-20)17-6-3-2-4-7-17/h2-12,15,19,21H,13-14H2,1H3	JAOSEIAJTQKXPZ-UHFFFAOYSA-N	355.124214232							105350
Ethyl 4-(4-methylphenyl)-2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}thiophene-3-carboxylate	LSM-16714	SID17416155, BRD-K30578791	1676037	InChI=1S/C24H19NO5S/c1-3-29-24(28)20-18(15-10-8-14(2)9-11-15)13-31-22(20)25-21(26)17-12-16-6-4-5-7-19(16)30-23(17)27/h4-13H,3H2,1-2H3,(H,25,26)	UFHWVWRZLRXBCC-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)C2=Cc3ccccc3OC2=O)scc1c4ccc(C)cc4	BroadT	BRD-K30578791	BRD-K30578791-001-05-6	ChemBridge Corporation	6238817			CCOC(=O)c1c(NC(=O)c2cc3ccccc3oc2=O)scc1-c1ccc(C)cc1	InChI=1S/C24H19NO5S/c1-3-29-24(28)20-18(15-10-8-14(2)9-11-15)13-31-22(20)25-21(26)17-12-16-6-4-5-7-19(16)30-23(17)27/h4-13H,3H2,1-2H3,(H,25,26)	UFHWVWRZLRXBCC-UHFFFAOYSA-N	433.098393408							105351
MLS000038177	LSM-16715	SID858392, BRD-K48280640	659720	InChI=1S/C7H6N8O2/c1-2-3(13-16-12-2)6-9-7(11-10-6)4-5(8)15-17-14-4/h1H3,(H2,8,15)(H,9,10,11)	ZQZQNNAHUAEZSY-UHFFFAOYSA-N	Cc1nonc1c2n[nH]c(n2)c3nonc3N	BroadT	BRD-K48280640	BRD-K48280640-001-06-0	InterBioScreen Ltd.	STOCK2S-46888			Cc1nonc1-c1n[nH]c(n1)-c1nonc1N	InChI=1S/C7H6N8O2/c1-2-3(13-16-12-2)6-9-7(11-10-6)4-5(8)15-17-14-4/h1H3,(H2,8,15)(H,9,10,11)	ZQZQNNAHUAEZSY-UHFFFAOYSA-N	234.061371512							105352
3-(4-Chlorophenyl)-6-(thiophen-2-ylmethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole	LSM-16716	SID862954, BRD-K07017004	664192	InChI=1S/C14H9ClN4S2/c15-10-5-3-9(4-6-10)13-16-17-14-19(13)18-12(21-14)8-11-2-1-7-20-11/h1-7H,8H2	JSEHQJJIJOMWNN-UHFFFAOYSA-N	Clc1ccc(cc1)c2nnc3sc(Cc4cccs4)nn23	BroadT	BRD-K07017004	BRD-K07017004-001-05-7	InterBioScreen Ltd.	STOCK4S-59323			Clc1ccc(cc1)-c1nnc2sc(Cc3cccs3)nn12	InChI=1S/C14H9ClN4S2/c15-10-5-3-9(4-6-10)13-16-17-14-19(13)18-12(21-14)8-11-2-1-7-20-11/h1-7H,8H2	JSEHQJJIJOMWNN-UHFFFAOYSA-N	331.995715418							105353
2,2,2-Trifluoro-n-[2-(1H-indol-3-yl)ethyl]acetamide	LSM-16717	SID14742290, BRD-K25303385	384618	InChI=1S/C12H11F3N2O/c13-12(14,15)11(18)16-6-5-8-7-17-10-4-2-1-3-9(8)10/h1-4,7,17H,5-6H2,(H,16,18)	KDFCROJYVJQVQK-UHFFFAOYSA-N	FC(F)(F)C(=O)NCCc1c[nH]c2ccccc12	BroadT	BRD-K25303385	BRD-K25303385-001-05-8	InterBioScreen Ltd.	STOCK1S-17333			FC(F)(F)C(=O)NCCc1c[nH]c2ccccc12	InChI=1S/C12H11F3N2O/c13-12(14,15)11(18)16-6-5-8-7-17-10-4-2-1-3-9(8)10/h1-4,7,17H,5-6H2,(H,16,18)	KDFCROJYVJQVQK-UHFFFAOYSA-N	256.082347592							105354
STK102673	LSM-16718	BRD-K08884153	1542606	InChI=1S/C20H17ClN6S/c1-13-18(14(2)26(25-13)17-6-4-3-5-7-17)12-22-27-19(23-24-20(27)28)15-8-10-16(21)11-9-15/h3-12H,1-2H3,(H,24,28)	LWSYTJWXSMGIKM-UHFFFAOYSA-N	Cc1nn(c(C)c1C=Nn2c(S)nnc2c3ccc(Cl)cc3)c4ccccc4	BroadT	BRD-K08884153	BRD-K08884153-001-05-8	InterBioScreen Ltd.	STOCK3S-13472			Cc1nn(c(C)c1C=Nn1c(S)nnc1-c1ccc(Cl)cc1)-c1ccccc1	InChI=1S/C20H17ClN6S/c1-13-18(14(2)26(25-13)17-6-4-3-5-7-17)12-22-27-19(23-24-20(27)28)15-8-10-16(21)11-9-15/h3-12H,1-2H3,(H,24,28)	LWSYTJWXSMGIKM-UHFFFAOYSA-N	408.092393004							105355
ZINC01512467	LSM-16719	SID26724381, BRD-K13451507	1548308	InChI=1S/C16H13FN2O2S2/c1-11-2-8-14(9-3-11)23(20,21)19-16-18-15(10-22-16)12-4-6-13(17)7-5-12/h2-10H,1H3,(H,18,19)	KAHFGBYYBYIHFU-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)Nc2nc(cs2)c3ccc(F)cc3	BroadT	BRD-K13451507	BRD-K13451507-001-05-2	Enamine Ltd.	T0507-5729			Cc1ccc(cc1)S(=O)(=O)Nc1nc(cs1)-c1ccc(F)cc1	InChI=1S/C16H13FN2O2S2/c1-11-2-8-14(9-3-11)23(20,21)19-16-18-15(10-22-16)12-4-6-13(17)7-5-12/h2-10H,1H3,(H,18,19)	KAHFGBYYBYIHFU-UHFFFAOYSA-N	348.040247256							105356
CID 78444395	LSM-16720	BRD-A82482158	78444395	InChI=1S/C26H36N2O4/c1-7-28(8-2)19-11-9-18(10-12-19)23-22(25(30)32-14-13-31-6)17(3)27-20-15-26(4,5)16-21(29)24(20)23/h9-12,23-24H,7-8,13-16H2,1-6H3	KWJWIXOZKVIUOG-UHFFFAOYSA-N	CCN(CC)c1ccc(cc1)C2C3C(=O)CC(C)(C)CC3=NC(=C2C(=O)OCCOC)C	BroadT	BRD-A82482158	BRD-A82482158-001-05-7	Asinex Ltd.	BAS 00545722			CCN(CC)c1ccc(cc1)C1C2C(=O)CC(C)(C)CC2=NC(C)=C1C(=O)OCCOC	InChI=1S/C26H36N2O4/c1-7-28(8-2)19-11-9-18(10-12-19)23-22(25(30)32-14-13-31-6)17(3)27-20-15-26(4,5)16-21(29)24(20)23/h9-12,23-24H,7-8,13-16H2,1-6H3	KWJWIXOZKVIUOG-UHFFFAOYSA-N	440.267507652							105357
ASN 06532636	LSM-16721	SID17408428, BRD-K29224644	1442560	InChI=1S/C25H20N2O3S/c28-21(18-10-11-22-23(15-18)30-13-12-29-22)16-31-25-19-8-4-5-9-20(19)26-24(27-25)14-17-6-2-1-3-7-17/h1-11,15H,12-14,16H2	JAOGFJKZKNUZCY-UHFFFAOYSA-N	O=C(CSc1nc(Cc2ccccc2)nc3ccccc13)c4ccc5OCCOc5c4	BroadT	BRD-K29224644	BRD-K29224644-001-05-9	Asinex Ltd.	ASN 06532636			O=C(CSc1nc(Cc2ccccc2)nc2ccccc12)c1ccc2OCCOc2c1	InChI=1S/C25H20N2O3S/c28-21(18-10-11-22-23(15-18)30-13-12-29-22)16-31-25-19-8-4-5-9-20(19)26-24(27-25)14-17-6-2-1-3-7-17/h1-11,15H,12-14,16H2	JAOGFJKZKNUZCY-UHFFFAOYSA-N	428.11946321							105358
MLS000552746	LSM-16722	SID14742432, BRD-K90376138	920008	InChI=1S/C18H24N2O/c1-13-8-10-19(11-9-13)12-18(21)20-15(3)14(2)16-6-4-5-7-17(16)20/h4-7,13H,8-12H2,1-3H3	TZDKNVWAMSXZSM-UHFFFAOYSA-N	CC1CCN(CC(=O)n2c(C)c(C)c3ccccc23)CC1	BroadT	BRD-K90376138	BRD-K90376138-001-05-4	InterBioScreen Ltd.	STOCK2S-14643			CC1CCN(CC(=O)n2c(C)c(C)c3ccccc23)CC1	InChI=1S/C18H24N2O/c1-13-8-10-19(11-9-13)12-18(21)20-15(3)14(2)16-6-4-5-7-17(16)20/h4-7,13H,8-12H2,1-3H3	TZDKNVWAMSXZSM-UHFFFAOYSA-N	284.188863408							105359
MLS000776640	LSM-16723	SID24834980, BRD-K58944924	2106919	InChI=1S/C25H24FN3O7S/c26-19-12-17-20(29(15-1-2-15)14-18(24(17)30)25(31)32)13-21(19)27-5-7-28(8-6-27)37(33,34)16-3-4-22-23(11-16)36-10-9-35-22/h3-4,11-15H,1-2,5-10H2,(H,31,32)	OQMLZHABXASMDX-UHFFFAOYSA-N	OC(=O)C1=CN(C2CC2)c3cc(N4CCN(CC4)S(=O)(=O)c5ccc6OCCOc6c5)c(F)cc3C1=O	BroadT	BRD-K58944924	BRD-K58944924-001-05-7	Enamine Ltd.	T5224399			OC(=O)c1cn(C2CC2)c2cc(N3CCN(CC3)S(=O)(=O)c3ccc4OCCOc4c3)c(F)cc2c1=O	InChI=1S/C25H24FN3O7S/c26-19-12-17-20(29(15-1-2-15)14-18(24(17)30)25(31)32)13-21(19)27-5-7-28(8-6-27)37(33,34)16-3-4-22-23(11-16)36-10-9-35-22/h3-4,11-15H,1-2,5-10H2,(H,31,32)	OQMLZHABXASMDX-UHFFFAOYSA-N	529.131899028							105360
MLS000568833	LSM-16724	SID14744582, BRD-K57868800	2107414	InChI=1S/C23H27N5O3/c1-2-27(15-21-25-20-6-4-3-5-19(20)23(30)26-21)16-22(29)24-17-7-9-18(10-8-17)28-11-13-31-14-12-28/h3-10H,2,11-16H2,1H3,(H,24,29)(H,25,26,30)	DZWLZPWRNXQUGF-UHFFFAOYSA-N	CCN(CC(=O)Nc1ccc(cc1)N2CCOCC2)Cc3nc(O)c4ccccc4n3	BroadT	BRD-K57868800	BRD-K57868800-001-05-8	Enamine Ltd.	T5266272			CCN(CC(=O)Nc1ccc(cc1)N1CCOCC1)Cc1nc(O)c2ccccc2n1	InChI=1S/C23H27N5O3/c1-2-27(15-21-25-20-6-4-3-5-19(20)23(30)26-21)16-22(29)24-17-7-9-18(10-8-17)28-11-13-31-14-12-28/h3-10H,2,11-16H2,1H3,(H,24,29)(H,25,26,30)	DZWLZPWRNXQUGF-UHFFFAOYSA-N	421.211389774							105361
SMR000172335	LSM-16725	SID17508001, BRD-K56574407	1085893	InChI=1S/C17H10Cl2N2O3/c18-12-7-10(11(17(23)24)8-13(12)19)16(22)21-14-5-1-3-9-4-2-6-20-15(9)14/h1-8H,(H,21,22)(H,23,24)	RAEGRZPQCSGOGU-UHFFFAOYSA-N	OC(=O)c1cc(Cl)c(Cl)cc1C(=O)Nc2cccc3cccnc23	BroadT	BRD-K56574407	BRD-K56574407-001-05-0	Asinex Ltd.	BAS 06809194			OC(=O)c1cc(Cl)c(Cl)cc1C(=O)Nc1cccc2cccnc12	InChI=1S/C17H10Cl2N2O3/c18-12-7-10(11(17(23)24)8-13(12)19)16(22)21-14-5-1-3-9-4-2-6-20-15(9)14/h1-8H,(H,21,22)(H,23,24)	RAEGRZPQCSGOGU-UHFFFAOYSA-N	360.00684762							105362
AC1MJ16S	LSM-16726	SID26665562, BRD-K16930225	3129744	InChI=1S/C13H14N4O2/c1-7-2-5-10-9(6-7)15-13(19-10)17-12(14)16-11(18)8-3-4-8/h2,5-6,8H,3-4H2,1H3,(H3,14,15,16,17,18)	KTOQJKLRNXMTNW-UHFFFAOYSA-N	Cc1ccc2oc(N=C(N)NC(=O)C3CC3)nc2c1	BroadT	BRD-K16930225	BRD-K16930225-001-05-3	InterBioScreen Ltd.	STOCK1S-51884			Cc1ccc2oc(N=C(N)NC(=O)C3CC3)nc2c1	InChI=1S/C13H14N4O2/c1-7-2-5-10-9(6-7)15-13(19-10)17-12(14)16-11(18)8-3-4-8/h2,5-6,8H,3-4H2,1H3,(H3,14,15,16,17,18)	KTOQJKLRNXMTNW-UHFFFAOYSA-N	258.111675728							105363
MLS001167398	LSM-16727	SID49676797, BRD-K82911459	2370925	InChI=1S/C7H5N3O2S2/c11-5(4-2-1-3-12-4)8-6-9-10-7(13)14-6/h1-3H,(H,10,13)(H,8,9,11)	HGXFKPINWJTKBM-UHFFFAOYSA-N	Sc1nnc(NC(=O)c2occc2)s1	BroadT	BRD-K82911459	BRD-K82911459-001-04-2	Life Chemicals Inc.	F0326-1010			Sc1nnc(NC(=O)c2ccco2)s1	InChI=1S/C7H5N3O2S2/c11-5(4-2-1-3-12-4)8-6-9-10-7(13)14-6/h1-3H,(H,10,13)(H,8,9,11)	HGXFKPINWJTKBM-UHFFFAOYSA-N	226.98231781							105364
4-(3,4-Dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1,3-thiazole	LSM-16728	SID26727797, BRD-K87253210	2742348	InChI=1S/C13H13NO2S/c1-9-14-11(8-17-9)10-3-4-12-13(7-10)16-6-2-5-15-12/h3-4,7-8H,2,5-6H2,1H3	NZODDNKEPZILBV-UHFFFAOYSA-N	Cc1nc(cs1)c2ccc3OCCCOc3c2	BroadT	BRD-K87253210	BRD-K87253210-001-06-9	Maybridge	SP 00399			Cc1nc(cs1)-c1ccc2OCCCOc2c1	InChI=1S/C13H13NO2S/c1-9-14-11(8-17-9)10-3-4-12-13(7-10)16-6-2-5-15-12/h3-4,7-8H,2,5-6H2,1H3	NZODDNKEPZILBV-UHFFFAOYSA-N	247.066699356							105365
SMR000069888	LSM-16729	SID4255406, BRD-K80569662	845559	InChI=1S/C15H13ClN2O/c16-12-5-1-4-8-15(12)19-10-9-18-11-17-13-6-2-3-7-14(13)18/h1-8,11H,9-10H2	ZVOXLAMBONAQPC-UHFFFAOYSA-N	Clc1ccccc1OCCn2cnc3ccccc23	BroadT	BRD-K80569662	BRD-K80569662-001-05-0	ChemBridge Corporation	5567995			Clc1ccccc1OCCn1cnc2ccccc12	InChI=1S/C15H13ClN2O/c16-12-5-1-4-8-15(12)19-10-9-18-11-17-13-6-2-3-7-14(13)18/h1-8,11H,9-10H2	ZVOXLAMBONAQPC-UHFFFAOYSA-N	272.071640766							105366
T0520-6969	LSM-16730	SID22408294, BRD-K03551403	4287451	InChI=1S/C23H28N4O3/c1-26(2)19-13-11-18(12-14-19)24-25-21-10-6-5-9-20(21)23(29)30-17-22(28)27-15-7-3-4-8-16-27/h5-6,9-14H,3-4,7-8,15-17H2,1-2H3	FRGCOOWEOHINOH-UHFFFAOYSA-N	CN(C)c1ccc(cc1)N=Nc2ccccc2C(=O)OCC(=O)N3CCCCCC3	BroadT	BRD-K03551403	BRD-K03551403-001-05-6	Enamine Ltd.	T0520-6969			CN(C)c1ccc(cc1)N=Nc1ccccc1C(=O)OCC(=O)N1CCCCCC1	InChI=1S/C23H28N4O3/c1-26(2)19-13-11-18(12-14-19)24-25-21-10-6-5-9-20(21)23(29)30-17-22(28)27-15-7-3-4-8-16-27/h5-6,9-14H,3-4,7-8,15-17H2,1-2H3	FRGCOOWEOHINOH-UHFFFAOYSA-N	408.216140796							105367
MLS000713936	LSM-16731	SID24804036, BRD-K73632731	2263192	InChI=1S/C27H18N2O4/c30-25(21-12-3-1-10-19(21)20-11-2-4-13-22(20)27(31)32)28-18-9-7-8-17(16-18)26-29-23-14-5-6-15-24(23)33-26/h1-16H,(H,28,30)(H,31,32)	BOWSDTSZGFZFAM-UHFFFAOYSA-N	OC(=O)c1ccccc1c2ccccc2C(=O)Nc3cccc(c3)c4oc5ccccc5n4	BroadT	BRD-K73632731	BRD-K73632731-001-07-8	Asinex Ltd.	BAS 00844400			OC(=O)c1ccccc1-c1ccccc1C(=O)Nc1cccc(c1)-c1nc2ccccc2o1	InChI=1S/C27H18N2O4/c30-25(21-12-3-1-10-19(21)20-11-2-4-13-22(20)27(31)32)28-18-9-7-8-17(16-18)26-29-23-14-5-6-15-24(23)33-26/h1-16H,(H,28,30)(H,31,32)	BOWSDTSZGFZFAM-UHFFFAOYSA-N	434.126657076							105368
SMR000135290	LSM-16732	SID14733551, BRD-K49014109	766778	InChI=1S/C21H22N2O/c24-21-11-10-17-6-4-5-9-19(17)20(21)16-22-12-14-23(15-13-22)18-7-2-1-3-8-18/h1-11,24H,12-16H2	BBVMRYLCSDWAKO-UHFFFAOYSA-N	Oc1ccc2ccccc2c1CN3CCN(CC3)c4ccccc4	BroadT	BRD-K49014109	BRD-K49014109-001-06-6	ChemBridge Corporation	5430697			Oc1ccc2ccccc2c1CN1CCN(CC1)c1ccccc1	InChI=1S/C21H22N2O/c24-21-11-10-17-6-4-5-9-19(17)20(21)16-22-12-14-23(15-13-22)18-7-2-1-3-8-18/h1-11,24H,12-16H2	BBVMRYLCSDWAKO-UHFFFAOYSA-N	318.173213344							105369
SMR000078954	LSM-16733	SID4261830, BRD-K55048290	2219483	InChI=1S/C23H20N2O4/c26-22(16-29-17-7-2-1-3-8-17)20-14-25(21-11-5-4-10-19(20)21)15-23(27)24-13-18-9-6-12-28-18/h1-12,14H,13,15-16H2,(H,24,27)	PSPVKQXDXRMMBG-UHFFFAOYSA-N	O=C(Cn1cc(C(=O)COc2ccccc2)c3ccccc13)NCc4occc4	BroadT	BRD-K55048290	BRD-K55048290-001-05-6	ChemBridge Corporation	7916479			O=C(Cn1cc(C(=O)COc2ccccc2)c2ccccc12)NCc1ccco1	InChI=1S/C23H20N2O4/c26-22(16-29-17-7-2-1-3-8-17)20-14-25(21-11-5-4-10-19(20)21)15-23(27)24-13-18-9-6-12-28-18/h1-12,14H,13,15-16H2,(H,24,27)	PSPVKQXDXRMMBG-UHFFFAOYSA-N	388.14230714							105370
2-(4-Chlorobenzyl)-6-phenyl-5-piperidino-3(2H)-pyridazinone	LSM-16734	SID17410148, BRD-K85497546	1472480	InChI=1S/C22H22ClN3O/c23-19-11-9-17(10-12-19)16-26-21(27)15-20(25-13-5-2-6-14-25)22(24-26)18-7-3-1-4-8-18/h1,3-4,7-12,15H,2,5-6,13-14,16H2	JQIGIYGSOWUONU-UHFFFAOYSA-N	Clc1ccc(CN2N=C(C(=CC2=O)N3CCCCC3)c4ccccc4)cc1	BroadT	BRD-K85497546	BRD-K85497546-001-06-9	Key Organics Ltd.	2R-1070			Clc1ccc(Cn2nc(-c3ccccc3)c(cc2=O)N2CCCCC2)cc1	InChI=1S/C22H22ClN3O/c23-19-11-9-17(10-12-19)16-26-21(27)15-20(25-13-5-2-6-14-25)22(24-26)18-7-3-1-4-8-18/h1,3-4,7-12,15H,2,5-6,13-14,16H2	JQIGIYGSOWUONU-UHFFFAOYSA-N	379.145140064							105371
MLS000737949	LSM-43659	NSC-11437, BRD-K94986477	5354467	InChI=1S/C17H16ClNO2/c1-19(2)14-7-3-12(4-8-14)5-9-16(20)15-11-13(18)6-10-17(15)21/h3-11,21H,1-2H3/b9-5+	ZTYHXBUDOSNOCB-WEVVVXLNSA-N	CN(C)c1ccc(\C=C\C(=O)c2cc(Cl)ccc2O)cc1	BroadT	BRD-K94986477	BRD-K94986477-001-05-5	National Cancer Institute Chemotherapeutic Agents Repository	11437			CN(C)c1ccc(cc1)\C=C\C(=O)c1cc(Cl)ccc1O	InChI=1S/C17H16ClNO2/c1-19(2)14-7-3-12(4-8-14)5-9-16(20)15-11-13(18)6-10-17(15)21/h3-11,21H,1-2H3/b9-5+	ZTYHXBUDOSNOCB-WEVVVXLNSA-N	301.086956472							
AC1LCMBJ	LSM-16736	SID849972, BRD-K14434547	652481	InChI=1S/C19H24ClN5O/c1-4-19(2,3)25-18(21-22-23-25)14-24(13-17-6-5-11-26-17)12-15-7-9-16(20)10-8-15/h5-11H,4,12-14H2,1-3H3	XUXVUUBDVADVNV-UHFFFAOYSA-N	CCC(C)(C)n1nnnc1CN(Cc2occc2)Cc3ccc(Cl)cc3	BroadT	BRD-K14434547	BRD-K14434547-001-05-9	Asinex Ltd.	ASN 05089775			CCC(C)(C)n1nnnc1CN(Cc1ccco1)Cc1ccc(Cl)cc1	InChI=1S/C19H24ClN5O/c1-4-19(2,3)25-18(21-22-23-25)14-24(13-17-6-5-11-26-17)12-15-7-9-16(20)10-8-15/h5-11H,4,12-14H2,1-3H3	XUXVUUBDVADVNV-UHFFFAOYSA-N	373.166938148							105373
F0596-0065	LSM-16737	SID4241671, BRD-K81137011	2158329	InChI=1S/C20H17N3O3S/c1-2-25-16-10-6-4-8-14(16)23-17(24)11-27-20-19-18(21-12-22-20)13-7-3-5-9-15(13)26-19/h3-10,12H,2,11H2,1H3,(H,23,24)	YDIYGUJBMHNODQ-UHFFFAOYSA-N	CCOc1ccccc1NC(=O)CSc2ncnc3c2oc4ccccc34	BroadT	BRD-K81137011	BRD-K81137011-001-06-1	ChemDiv Inc.	C253-0065			CCOc1ccccc1NC(=O)CSc1ncnc2c3ccccc3oc12	InChI=1S/C20H17N3O3S/c1-2-25-16-10-6-4-8-14(16)23-17(24)11-27-20-19-18(21-12-22-20)13-7-3-5-9-15(13)26-19/h3-10,12H,2,11H2,1H3,(H,23,24)	YDIYGUJBMHNODQ-UHFFFAOYSA-N	379.099062124							105374
6-(2-Methyl-1-benzofuran-3-yl)-2,3-dihydroimidazo[2,1-b][1,3]thiazole	LSM-16738	SID4264374, BRD-K32379974	696879	InChI=1S/C14H12N2OS/c1-9-13(10-4-2-3-5-12(10)17-9)11-8-16-6-7-18-14(16)15-11/h2-5,8H,6-7H2,1H3	LGQFSSSTZLKIRM-UHFFFAOYSA-N	Cc1oc2ccccc2c1c3cn4CCSc4n3	BroadT	BRD-K32379974	BRD-K32379974-001-05-6	ChemBridge Corporation	7416162			Cc1oc2ccccc2c1-c1cn2CCSc2n1	InChI=1S/C14H12N2OS/c1-9-13(10-4-2-3-5-12(10)17-9)11-8-16-6-7-18-14(16)15-11/h2-5,8H,6-7H2,1H3	LGQFSSSTZLKIRM-UHFFFAOYSA-N	256.067033714							105375
MLS002415567	LSM-2555	BRD-K25522720, SID57287596, SID85147012	1400698	InChI=1S/C20H19N3O4S/c1-3-10-23-19(13-4-7-15(27-2)8-5-13)21-22-20(23)28-12-18(26)14-6-9-16(24)17(25)11-14/h3-9,11,24-25H,1,10,12H2,2H3	KKUJUVOEUPSRQJ-UHFFFAOYSA-N	COc1ccc(cc1)c2nnc(SCC(=O)c3ccc(O)c(O)c3)n2CC=C	BroadT	BRD-K25522720	BRD-K25522720-001-04-0	Sanford-Burnham Medical Research Institute	MLS-0390850.0001			COc1ccc(cc1)-c1nnc(SCC(=O)c2ccc(O)c(O)c2)n1CC=C	InChI=1S/C20H19N3O4S/c1-3-10-23-19(13-4-7-15(27-2)8-5-13)21-22-20(23)28-12-18(26)14-6-9-16(24)17(25)11-14/h3-9,11,24-25H,1,10,12H2,2H3	KKUJUVOEUPSRQJ-UHFFFAOYSA-N	397.109626808							92448
MLS000092296	LSM-16739	SID4249968, BRD-K86559499	3243843	InChI=1S/C22H25N3O4S/c1-23-19-9-8-18(15-20(19)24(2)22(27)21(23)26)30(28,29)25-12-10-17(11-13-25)14-16-6-4-3-5-7-16/h3-9,15,17H,10-14H2,1-2H3	IBTKJRKFYXEURN-UHFFFAOYSA-N	CN1C(=O)C(=O)N(C)c2cc(ccc12)S(=O)(=O)N3CCC(Cc4ccccc4)CC3	BroadT	BRD-K86559499	BRD-K86559499-001-06-2	ChemDiv Inc.	C515-0143			Cn1c2ccc(cc2n(C)c(=O)c1=O)S(=O)(=O)N1CCC(Cc2ccccc2)CC1	InChI=1S/C22H25N3O4S/c1-23-19-9-8-18(15-20(19)24(2)22(27)21(23)26)30(28,29)25-12-10-17(11-13-25)14-16-6-4-3-5-7-16/h3-9,15,17H,10-14H2,1-2H3	IBTKJRKFYXEURN-UHFFFAOYSA-N	427.156577							105376
AMBCB76843272	LSM-16740	SID24798577, BRD-A75934551	16190248	InChI=1S/C23H29N3O2S/c1-2-28-22-5-6-23-19(13-22)3-4-20(24-23)15-25-9-10-26(21(16-25)7-11-27)14-18-8-12-29-17-18/h3-6,8,12-13,17,21,27H,2,7,9-11,14-16H2,1H3	UEFMQICMWILKST-UHFFFAOYSA-N	CCOc1ccc2nc(CN3CCN(Cc4ccsc4)C(CCO)C3)ccc2c1	BroadT	BRD-A75934551	BRD-A75934551-001-05-9	ChemBridge Corporation	76843272			CCOc1ccc2nc(CN3CCN(Cc4ccsc4)C(CCO)C3)ccc2c1	InChI=1S/C23H29N3O2S/c1-2-28-22-5-6-23-19(13-22)3-4-20(24-23)15-25-9-10-26(21(16-25)7-11-27)14-18-8-12-29-17-18/h3-6,8,12-13,17,21,27H,2,7,9-11,14-16H2,1H3	UEFMQICMWILKST-UHFFFAOYSA-N	411.198047888							105377
ST50763233	LSM-16741	SID24787531, BRD-K09948597	891648	InChI=1S/C18H16N2O2S/c23-18(19-13-17-7-4-12-21-17)20-14-8-10-16(11-9-14)22-15-5-2-1-3-6-15/h1-12H,13H2,(H2,19,20,23)	VDZSXFFCUIEPCS-UHFFFAOYSA-N	S=C(NCc1occc1)Nc2ccc(Oc3ccccc3)cc2	BroadT	BRD-K09948597	BRD-K09948597-001-05-4	ChemBridge Corporation	7491858			S=C(NCc1ccco1)Nc1ccc(Oc2ccccc2)cc1	InChI=1S/C18H16N2O2S/c23-18(19-13-17-7-4-12-21-17)20-14-8-10-16(11-9-14)22-15-5-2-1-3-6-15/h1-12H,13H2,(H2,19,20,23)	VDZSXFFCUIEPCS-UHFFFAOYSA-N	324.093248462							105378
ST50869855	LSM-16742	SID3711555, BRD-K75226770	2997683	InChI=1S/C11H10N4OS2/c1-15-4-3-13-11(15)18-7-9(16)14-10-8(6-12)2-5-17-10/h2-5H,7H2,1H3,(H,14,16)	VLOBVPWHRDRZQF-UHFFFAOYSA-N	Cn1ccnc1SCC(=O)Nc2sccc2C#N	BroadT	BRD-K75226770	BRD-K75226770-001-05-3	Enamine Ltd.	T0514-3096			Cn1ccnc1SCC(=O)Nc1sccc1C#N	InChI=1S/C11H10N4OS2/c1-15-4-3-13-11(15)18-7-9(16)14-10-8(6-12)2-5-17-10/h2-5H,7H2,1H3,(H,14,16)	VLOBVPWHRDRZQF-UHFFFAOYSA-N	278.02960236							105379
CHEMBL1617226	LSM-15254	BRD-K99543796	16411533	InChI=1S/C26H36ClN2O2/c1-18(2)22-13-8-19(3)15-24(22)31-26(30)17-28-16-23(20-9-11-21(27)12-10-20)29-14-6-4-5-7-25(28)29/h9-12,16,18-19,22,24H,4-8,13-15,17H2,1-3H3/q+1/t19-,22+,24-/m1/s1	OWJNNMGFSZEVIL-WNOPAQSVSA-N	CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)C[n+]2cc(c3ccc(Cl)cc3)n4CCCCCc24	BroadT	BRD-K99543796	BRD-K99543796-003-06-7	InterBioScreen Ltd.	STOCK2S-41317		Cl	CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)C[n+]1cc(-c2ccc(Cl)cc2)n2CCCCCc12.Cl	InChI=1S/C26H36ClN2O2.ClH/c1-18(2)22-13-8-19(3)15-24(22)31-26(30)17-28-16-23(20-9-11-21(27)12-10-20)29-14-6-4-5-7-25(28)29;/h9-12,16,18-19,22,24H,4-8,13-15,17H2,1-3H3;1H/q+1;/t19-,22+,24-;/m1./s1	OYMCMTBEXDWEKC-GEOMLKSPSA-N	443.246531122							103901, 103901
MLS000392310	LSM-16743	SID17516789, BRD-K53622286	4668547	InChI=1S/C24H17ClN2O3/c1-27(17-7-3-2-4-8-17)21-20(26-24(30)15-11-13-16(25)14-12-15)22(28)18-9-5-6-10-19(18)23(21)29/h2-14H,1H3,(H,26,30)	MQJYHVVZGORUOI-UHFFFAOYSA-N	CN(C1=C(NC(=O)c2ccc(Cl)cc2)C(=O)c3ccccc3C1=O)c4ccccc4	BroadT	BRD-K53622286	BRD-K53622286-001-07-2	Enamine Ltd.	T0502-8906			CN(c1ccccc1)C1=C(NC(=O)c2ccc(Cl)cc2)C(=O)c2ccccc2C1=O	InChI=1S/C24H17ClN2O3/c1-27(17-7-3-2-4-8-17)21-20(26-24(30)15-11-13-16(25)14-12-15)22(28)18-9-5-6-10-19(18)23(21)29/h2-14H,1H3,(H,26,30)	MQJYHVVZGORUOI-UHFFFAOYSA-N	416.092770134							105380
SMR000207213	LSM-16744	SID17510678, BRD-A61366099	12005309	InChI=1S/C23H26N4O4/c1-16-5-3-6-18(13-16)25-12-11-24(15-17(25)2)20-10-9-19(14-21(20)27(30)31)26-22(28)7-4-8-23(26)29/h3,5-6,9-10,13-14,17H,4,7-8,11-12,15H2,1-2H3	FBLQTTOQGBOQMQ-UHFFFAOYSA-N	CC1CN(CCN1c2cccc(C)c2)c3ccc(cc3[N+](=O)[O-])N4C(=O)CCCC4=O	BroadT	BRD-A61366099	BRD-A61366099-001-06-7	ChemDiv Inc.	K807-6112			CC1CN(CCN1c1cccc(C)c1)c1ccc(cc1[N+]([O-])=O)N1C(=O)CCCC1=O	InChI=1S/C23H26N4O4/c1-16-5-3-6-18(13-16)25-12-11-24(15-17(25)2)20-10-9-19(14-21(20)27(30)31)26-22(28)7-4-8-23(26)29/h3,5-6,9-10,13-14,17H,4,7-8,11-12,15H2,1-2H3	FBLQTTOQGBOQMQ-UHFFFAOYSA-N	422.195405352							105381
AC1M6HFM	LSM-16745	BRD-K99048460	2398263	InChI=1S/C20H24N4O4S/c1-4-21-20(29)24-22-12-14-5-10-17(18(11-14)27-3)28-13-19(25)23-15-6-8-16(26-2)9-7-15/h5-12H,4,13H2,1-3H3,(H,23,25)(H2,21,24,29)	DIUWKSJNFBJIGK-UHFFFAOYSA-N	CCN=C(S)NN=Cc1ccc(OCC(=O)Nc2ccc(OC)cc2)c(OC)c1	BroadT	BRD-K99048460	BRD-K99048460-001-05-8	Enamine Ltd.	T0514-7905			CCN=C(S)NN=Cc1ccc(OCC(=O)Nc2ccc(OC)cc2)c(OC)c1	InChI=1S/C20H24N4O4S/c1-4-21-20(29)24-22-12-14-5-10-17(18(11-14)27-3)28-13-19(25)23-15-6-8-16(26-2)9-7-15/h5-12H,4,13H2,1-3H3,(H,23,25)(H2,21,24,29)	DIUWKSJNFBJIGK-UHFFFAOYSA-N	416.151825978							105382
MLS001006307	LSM-16746	SID24835647, BRD-K15041811	2525858	InChI=1S/C17H13ClFNO3/c1-22-9-12-11-4-2-3-5-15(11)23-16(12)17(21)20-14-7-6-10(18)8-13(14)19/h2-8H,9H2,1H3,(H,20,21)	JGZLBKPRNGKCSE-UHFFFAOYSA-N	COCc1c(oc2ccccc12)C(=O)Nc3ccc(Cl)cc3F	BroadT	BRD-K15041811	BRD-K15041811-001-06-8	Enamine Ltd.	T5334278			COCc1c(oc2ccccc12)C(=O)Nc1ccc(Cl)cc1F	InChI=1S/C17H13ClFNO3/c1-22-9-12-11-4-2-3-5-15(11)23-16(12)17(21)20-14-7-6-10(18)8-13(14)19/h2-8H,9H2,1H3,(H,20,21)	JGZLBKPRNGKCSE-UHFFFAOYSA-N	333.056799196							105383
AC1OA00J	LSM-16747	BRD-K69853259	6742588	InChI=1S/C10H8N4O/c1-6-2-3-7-8(4-6)13-10(12-7)9(5-11)14-15/h2-4,15H,1H3,(H,12,13)	IPEUWXJGNKVUTC-UHFFFAOYSA-N	Cc1ccc2[nH]c(nc2c1)C(=NO)C#N	BroadT	BRD-K69853259	BRD-K69853259-001-05-2	Asinex Ltd.	BAS 01047096			Cc1ccc2[nH]c(nc2c1)C(=NO)C#N	InChI=1S/C10H8N4O/c1-6-2-3-7-8(4-6)13-10(12-7)9(5-11)14-15/h2-4,15H,1H3,(H,12,13)	IPEUWXJGNKVUTC-UHFFFAOYSA-N	200.069810916							
AC1NKFG1	LSM-43660	BRD-K84041582	4887198	InChI=1S/C20H19N5O3/c1-26-15-9-17(28-3)16(27-2)8-12(15)10-23-25-20-19-18(21-11-22-20)13-6-4-5-7-14(13)24-19/h4-11,25H,1-3H3,(H,21,22)	NHSBCUAJUZAWGA-UHFFFAOYSA-N	COc1cc(OC)c(C=NNc2[nH]cnc3c4ccccc4nc23)cc1OC	BroadT	BRD-K84041582	BRD-K84041582-001-05-3	InterBioScreen Ltd.	STOCK5S-34646			COc1cc(OC)c(C=NNc2[nH]cnc3c4ccccc4nc23)cc1OC	InChI=1S/C20H19N5O3/c1-26-15-9-17(28-3)16(27-2)8-12(15)10-23-25-20-19-18(21-11-22-20)13-6-4-5-7-14(13)24-19/h4-11,25H,1-3H3,(H,21,22)	NHSBCUAJUZAWGA-UHFFFAOYSA-N	377.148789518							
MCULE-5415531571	LSM-16749	BRD-K35933397	16189645	InChI=1S/C21H17N3O4/c25-21(19-12-18(19)14-4-2-1-3-5-14)23-22-13-17-10-11-20(28-17)15-6-8-16(9-7-15)24(26)27/h1-11,13,18-19H,12H2,(H,23,25)/t18-,19+/m1/s1	UGOFNVAWWWTSKR-MOPGFXCFSA-N	[O-][N+](=O)c1ccc(cc1)c2oc(C=NNC(=O)[C@H]3C[C@@H]3c4ccccc4)cc2	BroadT	BRD-K35933397	BRD-K35933397-001-05-6	InterBioScreen Ltd.	STOCK5S-12618			[O-][N+](=O)c1ccc(cc1)-c1ccc(C=NNC(=O)[C@H]2C[C@@H]2c2ccccc2)o1	InChI=1S/C21H17N3O4/c25-21(19-12-18(19)14-4-2-1-3-5-14)23-22-13-17-10-11-20(28-17)15-6-8-16(9-7-15)24(26)27/h1-11,13,18-19H,12H2,(H,23,25)/t18-,19+/m1/s1	UGOFNVAWWWTSKR-MOPGFXCFSA-N	375.121906054							105386
SMR000070668	LSM-16750	SID4260388, BRD-A02760000	2886570	InChI=1S/C14H13F2NO3/c15-11-6-5-8(7-12(11)16)17-13(18)9-3-1-2-4-10(9)14(19)20/h1-2,5-7,9-10H,3-4H2,(H,17,18)(H,19,20)	VIOGDFJFJUBWAY-UHFFFAOYSA-N	OC(=O)C1CC=CCC1C(=O)Nc2ccc(F)c(F)c2	BroadT	BRD-A02760000	BRD-A02760000-001-05-3	ChemBridge Corporation	6116599			OC(=O)C1CC=CCC1C(=O)Nc1ccc(F)c(F)c1	InChI=1S/C14H13F2NO3/c15-11-6-5-8(7-12(11)16)17-13(18)9-3-1-2-4-10(9)14(19)20/h1-2,5-7,9-10H,3-4H2,(H,17,18)(H,19,20)	VIOGDFJFJUBWAY-UHFFFAOYSA-N	281.086349686							105387
AC1O9G13	LSM-16751	BRD-K69884084	6757524	InChI=1S/C24H23N3O2/c28-18-10-9-17(23(29)15-18)16-25-27-13-11-26(12-14-27)24-21-7-3-1-5-19(21)20-6-2-4-8-22(20)24/h1-10,15-16,24,28-29H,11-14H2	CDGPPGCEYYZDBQ-UHFFFAOYSA-N	Oc1ccc(C=NN2CCN(CC2)C3c4ccccc4c5ccccc35)c(O)c1	BroadT	BRD-K69884084	BRD-K69884084-001-05-8	ChemBridge Corporation	6624463			Oc1ccc(C=NN2CCN(CC2)C2c3ccccc3-c3ccccc23)c(O)c1	InChI=1S/C24H23N3O2/c28-18-10-9-17(23(29)15-18)16-25-27-13-11-26(12-14-27)24-21-7-3-1-5-19(21)20-6-2-4-8-22(20)24/h1-10,15-16,24,28-29H,11-14H2	CDGPPGCEYYZDBQ-UHFFFAOYSA-N	385.179027006							
AC1LJMFX	LSM-16752	BRD-K02649935	1002961	InChI=1S/C23H21BrN2O4/c1-28-21-9-6-18(24)11-17(21)13-25-26-23(27)22-10-8-20(30-22)14-29-19-7-5-15-3-2-4-16(15)12-19/h5-13H,2-4,14H2,1H3,(H,26,27)	IJWNWERQAQNHCU-UHFFFAOYSA-N	COc1ccc(Br)cc1C=NNC(=O)c2oc(COc3ccc4CCCc4c3)cc2	BroadT	BRD-K02649935	BRD-K02649935-001-05-6	Specs	AK-968/15603258			COc1ccc(Br)cc1C=NNC(=O)c1ccc(COc2ccc3CCCc3c2)o1	InChI=1S/C23H21BrN2O4/c1-28-21-9-6-18(24)11-17(21)13-25-26-23(27)22-10-8-20(30-22)14-29-19-7-5-15-3-2-4-16(15)12-19/h5-13H,2-4,14H2,1H3,(H,26,27)	IJWNWERQAQNHCU-UHFFFAOYSA-N	468.068469772							105389
1-(4-Isobutoxy-phenyl)-3-piperidin-1-yl-propan-1-one	LSM-15255	BRD-K69427350	115932	InChI=1S/C18H27NO2/c1-15(2)14-21-17-8-6-16(7-9-17)18(20)10-13-19-11-4-3-5-12-19/h6-9,15H,3-5,10-14H2,1-2H3	ZOQKGTTZAAQHHZ-UHFFFAOYSA-N	CC(C)COc1ccc(cc1)C(=O)CCN2CCCCC2	BroadT	BRD-K69427350	BRD-K69427350-003-05-9	Asinex Ltd.	BAS 00363801		Cl	CC(C)COc1ccc(cc1)C(=O)CCN1CCCCC1.Cl	InChI=1S/C18H27NO2.ClH/c1-15(2)14-21-17-8-6-16(7-9-17)18(20)10-13-19-11-4-3-5-12-19;/h6-9,15H,3-5,10-14H2,1-2H3;1H	VMAUDRNSDVRVPM-UHFFFAOYSA-N	289.204179114							103902, 103902
MLS001160501	LSM-16753	SID49823150, BRD-K70125053	16406961	InChI=1S/C23H21ClN2O5/c1-12-15-6-17(24)19(27)8-20(15)31-23(30)16(12)7-22(29)25-9-13-5-14(11-25)18-3-2-4-21(28)26(18)10-13/h2-4,6,8,13-14,27H,5,7,9-11H2,1H3/t13-,14+/m1/s1	RAXNGZMLLUDZAC-KGLIPLIRSA-N	CC1=C(CC(=O)N2C[C@H]3C[C@@H](C2)C4=CC=CC(=O)N4C3)C(=O)Oc5cc(O)c(Cl)cc15	BroadT	BRD-K70125053	BRD-K70125053-001-04-3	InterBioScreen Ltd.	STOCK1N-67600			Cc1c(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(=O)oc2cc(O)c(Cl)cc12	InChI=1S/C23H21ClN2O5/c1-12-15-6-17(24)19(27)8-20(15)31-23(30)16(12)7-22(29)25-9-13-5-14(11-25)18-3-2-4-21(28)26(18)10-13/h2-4,6,8,13-14,27H,5,7,9-11H2,1H3/t13-,14+/m1/s1	RAXNGZMLLUDZAC-KGLIPLIRSA-N	440.113899502							105390
T0519-5533	LSM-43661	SID22410036, BRD-K49217806	6159932	InChI=1S/C17H11BrN2O2/c18-14-5-1-3-12(11-14)7-9-15-10-8-13-4-2-6-16(20(21)22)17(13)19-15/h1-11H/b9-7+	RLTWFNLCFOIRSF-VQHVLOKHSA-N	[O-][N+](=O)c1cccc2ccc(\C=C\c3cccc(Br)c3)nc12	BroadT	BRD-K49217806	BRD-K49217806-001-05-3	Enamine Ltd.	T0519-5533			[O-][N+](=O)c1cccc2ccc(\C=C\c3cccc(Br)c3)nc12	InChI=1S/C17H11BrN2O2/c18-14-5-1-3-12(11-14)7-9-15-10-8-13-4-2-6-16(20(21)22)17(13)19-15/h1-11H/b9-7+	RLTWFNLCFOIRSF-VQHVLOKHSA-N	354.000390212							
SMR000064261	LSM-16755	SID24839741, SID3712074, BRD-K66226895	2997877	InChI=1S/C23H22N4O5S2/c1-31-20-7-4-17(14-21(20)34(29,30)27-8-11-32-12-9-27)22(28)24-18-5-2-16(3-6-18)19-15-26-10-13-33-23(26)25-19/h2-7,10,13-15H,8-9,11-12H2,1H3,(H,24,28)	OYEKMUHWDMMEOK-UHFFFAOYSA-N	COc1ccc(cc1S(=O)(=O)N2CCOCC2)C(=O)Nc3ccc(cc3)c4cn5ccsc5n4	BroadT	BRD-K66226895	BRD-K66226895-001-06-2	Enamine Ltd.	T5271643			COc1ccc(cc1S(=O)(=O)N1CCOCC1)C(=O)Nc1ccc(cc1)-c1cn2ccsc2n1	InChI=1S/C23H22N4O5S2/c1-31-20-7-4-17(14-21(20)34(29,30)27-8-11-32-12-9-27)22(28)24-18-5-2-16(3-6-18)19-15-26-10-13-33-23(26)25-19/h2-7,10,13-15H,8-9,11-12H2,1H3,(H,24,28)	OYEKMUHWDMMEOK-UHFFFAOYSA-N	498.103161224							105392
MLS000077440	LSM-16756	SID858395, BRD-A15081700	659723	InChI=1S/C19H23N5O2/c1-26-12-6-9-21-19(25)14(13-20)17-18(24-10-4-5-11-24)23-16-8-3-2-7-15(16)22-17/h2-3,7-8,14H,4-6,9-12H2,1H3,(H,21,25)	PMOODWWXPZUASR-UHFFFAOYSA-N	COCCCNC(=O)C(C#N)c1nc2ccccc2nc1N3CCCC3	BroadT	BRD-A15081700	BRD-A15081700-001-06-0	InterBioScreen Ltd.	STOCK2S-50264			COCCCNC(=O)C(C#N)c1nc2ccccc2nc1N1CCCC1	InChI=1S/C19H23N5O2/c1-26-12-6-9-21-19(25)14(13-20)17-18(24-10-4-5-11-24)23-16-8-3-2-7-15(16)22-17/h2-3,7-8,14H,4-6,9-12H2,1H3,(H,21,25)	PMOODWWXPZUASR-UHFFFAOYSA-N	353.185175026							105393
2,2'-[Pyridine-2,6-Diylbis(methanediylsulfanediyl)]bis[n-(naphthalen-2-yl)acetamide]	LSM-16757	SID14746103, BRD-K31349001	2225884	InChI=1S/C31H27N3O2S2/c35-30(33-26-14-12-22-6-1-3-8-24(22)16-26)20-37-18-28-10-5-11-29(32-28)19-38-21-31(36)34-27-15-13-23-7-2-4-9-25(23)17-27/h1-17H,18-21H2,(H,33,35)(H,34,36)	ZGOOIKKVRQUFFH-UHFFFAOYSA-N	O=C(CSCc1cccc(CSCC(=O)Nc2ccc3ccccc3c2)n1)Nc4ccc5ccccc5c4	BroadT	BRD-K31349001	BRD-K31349001-001-05-7	ChemBridge Corporation	5929457			O=C(CSCc1cccc(CSCC(=O)Nc2ccc3ccccc3c2)n1)Nc1ccc2ccccc2c1	InChI=1S/C31H27N3O2S2/c35-30(33-26-14-12-22-6-1-3-8-24(22)16-26)20-37-18-28-10-5-11-29(32-28)19-38-21-31(36)34-27-15-13-23-7-2-4-9-25(23)17-27/h1-17H,18-21H2,(H,33,35)(H,34,36)	ZGOOIKKVRQUFFH-UHFFFAOYSA-N	537.154468514							105394
BDBM48267	LSM-16758	BRD-A77415021	91896754	InChI=1S/C14H16N2O2/c1-9-3-5-11(6-4-9)13(17)7-12-14(18)16-10(2)8-15-12/h3-6,10H,7-8H2,1-2H3,(H,16,18)	CMVKBJUYNJFIIO-UHFFFAOYSA-N	CC1CN=C(CC(=O)c2ccc(C)cc2)C(=O)N1	BroadT	BRD-A77415021	BRD-A77415021-001-05-9	ChemDiv Inc.	6047-0071			CC1CN=C(CC(=O)c2ccc(C)cc2)C(=O)N1	InChI=1S/C14H16N2O2/c1-9-3-5-11(6-4-9)13(17)7-12-14(18)16-10(2)8-15-12/h3-6,10H,7-8H2,1-2H3,(H,16,18)	CMVKBJUYNJFIIO-UHFFFAOYSA-N	244.121177772							105395
ZINC05261893	LSM-15256	BRD-K53072474	3476719	InChI=1S/C23H24N2O3S/c1-4-28-23(27)21-16(2)17(3)29-22(21)24-20(26)15-25-12-10-19(11-13-25)14-18-8-6-5-7-9-18/h5-13H,4,14-15H2,1-3H3/p+1	YBDWDRXHWHCSJW-UHFFFAOYSA-O	CCOC(=O)c1c(C)c(C)sc1NC(=O)C[n+]2ccc(Cc3ccccc3)cc2	BroadT	BRD-K53072474	BRD-K53072474-003-07-8	Enamine Ltd.	T0519-3384		Cl	CCOC(=O)c1c(NC(=O)C[n+]2ccc(Cc3ccccc3)cc2)sc(C)c1C.Cl	InChI=1S/C23H24N2O3S.ClH/c1-4-28-23(27)21-16(2)17(3)29-22(21)24-20(26)15-25-12-10-19(11-13-25)14-18-8-6-5-7-9-18;/h5-13H,4,14-15H2,1-3H3;1H/p+1	SPJHJXLPZJNVOV-UHFFFAOYSA-O	409.15858837							103903, 103903
SMR000193861	LSM-16759	SID17506383, BRD-K33926809	1213674	InChI=1S/C15H10Cl2N2O2S/c1-8-7-22-15(18-8)19-14(20)13-5-4-12(21-13)10-3-2-9(16)6-11(10)17/h2-7H,1H3,(H,18,19,20)	AWMRTMAWOOHNGZ-UHFFFAOYSA-N	Cc1csc(NC(=O)c2oc(cc2)c3ccc(Cl)cc3Cl)n1	BroadT	BRD-K33926809	BRD-K33926809-001-06-2	ChemBridge Corporation	6028156			Cc1csc(NC(=O)c2ccc(o2)-c2ccc(Cl)cc2Cl)n1	InChI=1S/C15H10Cl2N2O2S/c1-8-7-22-15(18-8)19-14(20)13-5-4-12(21-13)10-3-2-9(16)6-11(10)17/h2-7H,1H3,(H,18,19,20)	AWMRTMAWOOHNGZ-UHFFFAOYSA-N	351.98400369							105396
SMR000069708	LSM-16760	SID4258705, BRD-K98255034	2847306	InChI=1S/C15H13ClN2O/c16-14-5-6-15(13-4-2-1-3-12(13)14)19-10-9-18-8-7-17-11-18/h1-8,11H,9-10H2	KXNPESKMWXONKH-UHFFFAOYSA-N	Clc1ccc(OCCn2ccnc2)c3ccccc13	BroadT	BRD-K98255034	BRD-K98255034-001-07-3	ChemBridge Corporation	5470587			Clc1ccc(OCCn2ccnc2)c2ccccc12	InChI=1S/C15H13ClN2O/c16-14-5-6-15(13-4-2-1-3-12(13)14)19-10-9-18-8-7-17-11-18/h1-8,11H,9-10H2	KXNPESKMWXONKH-UHFFFAOYSA-N	272.071640766							105397
SMR000026000	LSM-16761	SID4251362, BRD-K41811447	3245061	InChI=1S/C13H14N2O4S/c1-8-13(10(3)19-14-8)20(17,18)15-12-6-4-5-11(7-12)9(2)16/h4-7,15H,1-3H3	MZVWVVRFDDLKPE-UHFFFAOYSA-N	CC(=O)c1cccc(NS(=O)(=O)c2c(C)onc2C)c1	BroadT	BRD-K41811447	BRD-K41811447-001-05-6	ChemDiv Inc.	C324-1284			CC(=O)c1cccc(NS(=O)(=O)c2c(C)noc2C)c1	InChI=1S/C13H14N2O4S/c1-8-13(10(3)19-14-8)20(17,18)15-12-6-4-5-11(7-12)9(2)16/h4-7,15H,1-3H3	MZVWVVRFDDLKPE-UHFFFAOYSA-N	294.067427638							105398
MLS000121490	LSM-16762	SID14721383, BRD-K70240073	1075874	InChI=1S/C21H23ClN2O3S/c22-18-4-1-16(2-5-18)13-28-14-21(25)24-9-7-23(8-10-24)12-17-3-6-19-20(11-17)27-15-26-19/h1-6,11H,7-10,12-15H2	MUQOHWHUOIKAAC-UHFFFAOYSA-N	Clc1ccc(CSCC(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)cc1	BroadT	BRD-K70240073	BRD-K70240073-001-05-3	Asinex Ltd.	BAS 04876832			Clc1ccc(CSCC(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)cc1	InChI=1S/C21H23ClN2O3S/c22-18-4-1-16(2-5-18)13-28-14-21(25)24-9-7-23(8-10-24)12-17-3-6-19-20(11-17)27-15-26-19/h1-6,11H,7-10,12-15H2	MUQOHWHUOIKAAC-UHFFFAOYSA-N	418.111791016							105399
5-(4-Methylpiperidin-1-yl)-2-(naphthalen-1-ylmethyl)-1,3-oxazole-4-carbonitrile	LSM-16763	SID863207, BRD-K83729971	664454	InChI=1S/C21H21N3O/c1-15-9-11-24(12-10-15)21-19(14-22)23-20(25-21)13-17-7-4-6-16-5-2-3-8-18(16)17/h2-8,15H,9-13H2,1H3	VCBAMHBXHPKNGD-UHFFFAOYSA-N	CC1CCN(CC1)c2oc(Cc3cccc4ccccc34)nc2C#N	BroadT	BRD-K83729971	BRD-K83729971-001-05-3	InterBioScreen Ltd.	STOCK4S-67505			CC1CCN(CC1)c1oc(Cc2cccc3ccccc23)nc1C#N	InChI=1S/C21H21N3O/c1-15-9-11-24(12-10-15)21-19(14-22)23-20(25-21)13-17-7-4-6-16-5-2-3-8-18(16)17/h2-8,15H,9-13H2,1H3	VCBAMHBXHPKNGD-UHFFFAOYSA-N	331.168462322							105400
AC1MJMBL	LSM-16764	BRD-A57546238	3094245	InChI=1S/C15H15Cl2FN2O/c1-15(2)10(7-12(16)17)13(15)14(21)20-19-8-9-5-3-4-6-11(9)18/h3-8,10,13H,1-2H3,(H,20,21)	FKTAOUGCEILMEG-UHFFFAOYSA-N	CC1(C)C(C=C(Cl)Cl)C1C(=O)NN=Cc2ccccc2F	BroadT	BRD-A57546238	BRD-A57546238-001-05-4	Asinex Ltd.	BAS 00188173			CC1(C)C(C=C(Cl)Cl)C1C(=O)NN=Cc1ccccc1F	InChI=1S/C15H15Cl2FN2O/c1-15(2)10(7-12(16)17)13(15)14(21)20-19-8-9-5-3-4-6-11(9)18/h3-8,10,13H,1-2H3,(H,20,21)	FKTAOUGCEILMEG-UHFFFAOYSA-N	328.05454674							105401
AB-323/13887172	LSM-16765	SID24787267, BRD-K83370850	5409407	InChI=1S/C18H10N4O2/c23-17-15-16(21-18(24)22-17)20-14-12-8-4-2-6-10(12)9-5-1-3-7-11(9)13(14)19-15/h1-8H,(H2,20,21,22,23,24)	BKGOEQARIFRUQI-UHFFFAOYSA-N	O=C1NC(=O)c2nc3c4ccccc4c5ccccc5c3nc2N1	BroadT	BRD-K83370850	BRD-K83370850-001-05-2	Specs	AB-323/13887172			O=c1[nH]c2nc3c4ccccc4c4ccccc4c3nc2c(=O)[nH]1	InChI=1S/C18H10N4O2/c23-17-15-16(21-18(24)22-17)20-14-12-8-4-2-6-10(12)9-5-1-3-7-11(9)13(14)19-15/h1-8H,(H2,20,21,22,23,24)	BKGOEQARIFRUQI-UHFFFAOYSA-N	314.0803756							105402
MLS000581629	LSM-16766	SID17432045, BRD-K80009100	2959740	InChI=1S/C27H28N2O4/c1-32-23-13-5-19(6-14-23)25(30)28-21-9-7-20(8-10-21)27(17-3-4-18-27)26(31)29-22-11-15-24(33-2)16-12-22/h5-16H,3-4,17-18H2,1-2H3,(H,28,30)(H,29,31)	VLSCYHLDGQJLAC-UHFFFAOYSA-N	COc1ccc(NC(=O)C2(CCCC2)c3ccc(NC(=O)c4ccc(OC)cc4)cc3)cc1	BroadT	BRD-K80009100	BRD-K80009100-001-05-7	ChemBridge Corporation	7864498			COc1ccc(NC(=O)C2(CCCC2)c2ccc(NC(=O)c3ccc(OC)cc3)cc2)cc1	InChI=1S/C27H28N2O4/c1-32-23-13-5-19(6-14-23)25(30)28-21-9-7-20(8-10-21)27(17-3-4-18-27)26(31)29-22-11-15-24(33-2)16-12-22/h5-16H,3-4,17-18H2,1-2H3,(H,28,30)(H,29,31)	VLSCYHLDGQJLAC-UHFFFAOYSA-N	444.204907396							105403
4607-16-3	LSM-16767	SID17401504, BRD-A34461624	5209962	InChI=1S/C8H13Cl3N2OS2/c1-3-13(4-2)7(15)16-6(12-5-14)8(9,10)11/h5-6H,3-4H2,1-2H3,(H,12,14)	JJZSINVTAAQEGC-UHFFFAOYSA-N	CCN(CC)C(=S)SC(NC=O)C(Cl)(Cl)Cl	BroadT	BRD-A34461624	BRD-A34461624-001-06-4	InterBioScreen Ltd.	STOCK1S-61498			CCN(CC)C(=S)SC(NC=O)C(Cl)(Cl)Cl	InChI=1S/C8H13Cl3N2OS2/c1-3-13(4-2)7(15)16-6(12-5-14)8(9,10)11/h5-6H,3-4H2,1-2H3,(H,12,14)	JJZSINVTAAQEGC-UHFFFAOYSA-N	321.953487566							105404
SMR000011117	LSM-16768	SID848964, BRD-K38380505	651431	InChI=1S/C20H20N4OS/c1-23-19(16-9-3-2-4-10-16)21-22-20(23)26-14-18(25)24-13-7-11-15-8-5-6-12-17(15)24/h2-6,8-10,12H,7,11,13-14H2,1H3	WGLZAJMYJXKRRG-UHFFFAOYSA-N	Cn1c(SCC(=O)N2CCCc3ccccc23)nnc1c4ccccc4	BroadT	BRD-K38380505	BRD-K38380505-001-06-4	Asinex Ltd.	BAS 02170795			Cn1c(SCC(=O)N2CCCc3ccccc23)nnc1-c1ccccc1	InChI=1S/C20H20N4OS/c1-23-19(16-9-3-2-4-10-16)21-22-20(23)26-14-18(25)24-13-7-11-15-8-5-6-12-17(15)24/h2-6,8-10,12H,7,11,13-14H2,1H3	WGLZAJMYJXKRRG-UHFFFAOYSA-N	364.13578199							105405
2-({2-Nitrophenyl}sulfanyl)cyclooctanone	LSM-16769	SID17385819, BRD-A79815721	4672511	InChI=1S/C14H17NO3S/c16-12-8-3-1-2-4-10-14(12)19-13-9-6-5-7-11(13)15(17)18/h5-7,9,14H,1-4,8,10H2	DURJJDLFRHUNEU-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1SC2CCCCCCC2=O	BroadT	BRD-A79815721	BRD-A79815721-001-05-1	Specs	AB-337/13036294			[O-][N+](=O)c1ccccc1SC1CCCCCCC1=O	InChI=1S/C14H17NO3S/c16-12-8-3-1-2-4-10-14(12)19-13-9-6-5-7-11(13)15(17)18/h5-7,9,14H,1-4,8,10H2	DURJJDLFRHUNEU-UHFFFAOYSA-N	279.092914104							105406
3-Quinolin-6-yl-1-p-tolyl-propenone	LSM-43662	SID47203059, BRD-K88313953	5348246	InChI=1S/C19H15NO/c1-14-4-8-16(9-5-14)19(21)11-7-15-6-10-18-17(13-15)3-2-12-20-18/h2-13H,1H3/b11-7+	XTHGMMSMWJSJSG-YRNVUSSQSA-N	Cc1ccc(cc1)C(=O)\C=C\c2ccc3ncccc3c2	BroadT	BRD-K88313953	BRD-K88313953-001-06-1	Asinex Ltd.	BAS 01577915			Cc1ccc(cc1)C(=O)\C=C\c1ccc2ncccc2c1	InChI=1S/C19H15NO/c1-14-4-8-16(9-5-14)19(21)11-7-15-6-10-18-17(13-15)3-2-12-20-18/h2-13H,1H3/b11-7+	XTHGMMSMWJSJSG-YRNVUSSQSA-N	273.11536411							
ZINC00357453	LSM-16771	BRD-K08974292	6744327	InChI=1S/C20H20N4O2/c1-3-19(25)23-15-10-8-14(9-11-15)20(26)24-21-12-17-13(2)22-18-7-5-4-6-16(17)18/h4-12,22H,3H2,1-2H3,(H,23,25)(H,24,26)	IUBMFEIWTINICY-UHFFFAOYSA-N	CCC(=O)Nc1ccc(cc1)C(=O)NN=Cc2c(C)[nH]c3ccccc23	BroadT	BRD-K08974292	BRD-K08974292-001-05-9	Specs	AN-329/13483004			CCC(=O)Nc1ccc(cc1)C(=O)NN=Cc1c(C)[nH]c2ccccc12	InChI=1S/C20H20N4O2/c1-3-19(25)23-15-10-8-14(9-11-15)20(26)24-21-12-17-13(2)22-18-7-5-4-6-16(17)18/h4-12,22H,3H2,1-2H3,(H,23,25)(H,24,26)	IUBMFEIWTINICY-UHFFFAOYSA-N	348.15862592							
MLS000682713	LSM-16772	SID24814129, BRD-K65363520	3450936	InChI=1S/C19H18N2O/c1-15-4-6-16(7-5-15)14-20-19(22)17-8-10-18(11-9-17)21-12-2-3-13-21/h2-13H,14H2,1H3,(H,20,22)	DMUZAJJOMHMRSO-UHFFFAOYSA-N	Cc1ccc(CNC(=O)c2ccc(cc2)n3cccc3)cc1	BroadT	BRD-K65363520	BRD-K65363520-001-04-2	ChemDiv Inc.	K906-1383			Cc1ccc(CNC(=O)c2ccc(cc2)-n2cccc2)cc1	InChI=1S/C19H18N2O/c1-15-4-6-16(7-5-15)14-20-19(22)17-8-10-18(11-9-17)21-12-2-3-13-21/h2-13H,14H2,1H3,(H,20,22)	DMUZAJJOMHMRSO-UHFFFAOYSA-N	290.141913216							105409
AC1LHRNP	LSM-16773	BRD-K70458939	868098	InChI=1S/C18H21N3O2/c1-13(15-6-5-7-17(12-15)23-4)19-20-18(22)14-8-10-16(11-9-14)21(2)3/h5-12H,1-4H3,(H,20,22)	IXUKFOUQLSPSBE-UHFFFAOYSA-N	COc1cccc(c1)C(=NNC(=O)c2ccc(cc2)N(C)C)C	BroadT	BRD-K70458939	BRD-K70458939-001-05-5	ChemBridge Corporation	5688428			COc1cccc(c1)C(C)=NNC(=O)c1ccc(cc1)N(C)C	InChI=1S/C18H21N3O2/c1-13(15-6-5-7-17(12-15)23-4)19-20-18(22)14-8-10-16(11-9-14)21(2)3/h5-12H,1-4H3,(H,20,22)	IXUKFOUQLSPSBE-UHFFFAOYSA-N	311.163376942							105410
SMR000211111	LSM-16774	BRD-K07170030	1163011	InChI=1S/C27H26N2O5S/c1-2-34-27(33)22-18-5-3-4-6-19(18)35-24(22)28-23(30)14-9-11-17(12-10-14)29-25(31)20-15-7-8-16(13-15)21(20)26(29)32/h7-12,15-16,20-21H,2-6,13H2,1H3,(H,28,30)/t15-,16+,20+,21-	FHWYVIJGQZWILE-IFCLKOLQSA-N	CCOC(=O)c1c2CCCCc2sc1NC(=O)c3ccc(cc3)N4C(=O)[C@H]5[C@H]6C[C@H](C=C6)[C@H]5C4=O	BroadT	BRD-K07170030	BRD-K07170030-001-05-2	InterBioScreen Ltd.	STOCK2S-55039			CCOC(=O)c1c(NC(=O)c2ccc(cc2)N2C(=O)[C@H]3[C@H]4C[C@H](C=C4)[C@H]3C2=O)sc2CCCCc12	InChI=1S/C27H26N2O5S/c1-2-34-27(33)22-18-5-3-4-6-19(18)35-24(22)28-23(30)14-9-11-17(12-10-14)29-25(31)20-15-7-8-16(13-15)21(20)26(29)32/h7-12,15-16,20-21H,2-6,13H2,1H3,(H,28,30)/t15-,16+,20+,21-	FHWYVIJGQZWILE-IFCLKOLQSA-N	490.156242642							105411
Acetic acid 1-[(3-nitro-phenyl)-pentanoylamino-methyl]-naphthalen-2-yl ester	LSM-16775	SID14725427, BRD-A69799920	3129267	InChI=1S/C24H24N2O5/c1-3-4-12-22(28)25-24(18-9-7-10-19(15-18)26(29)30)23-20-11-6-5-8-17(20)13-14-21(23)31-16(2)27/h5-11,13-15,24H,3-4,12H2,1-2H3,(H,25,28)	FPXPKGRYWPJFTD-UHFFFAOYSA-N	CCCCC(=O)NC(c1cccc(c1)[N+](=O)[O-])c2c(OC(=O)C)ccc3ccccc23	BroadT	BRD-A69799920	BRD-A69799920-001-06-6	Asinex Ltd.	BAS 01278016			CCCCC(=O)NC(c1cccc(c1)[N+]([O-])=O)c1c(OC(C)=O)ccc2ccccc12	InChI=1S/C24H24N2O5/c1-3-4-12-22(28)25-24(18-9-7-10-19(15-18)26(29)30)23-20-11-6-5-8-17(20)13-14-21(23)31-16(2)27/h5-11,13-15,24H,3-4,12H2,1-2H3,(H,25,28)	FPXPKGRYWPJFTD-UHFFFAOYSA-N	420.168521888							105412
AC1M3U7H	LSM-43663	BRD-K26720373	2244463	InChI=1S/C16H12BrN3S/c17-13-9-7-12(8-10-13)4-3-11-18-20-16-19-14-5-1-2-6-15(14)21-16/h1-11H,(H,19,20)/b4-3+,18-11?	VZVXFHISDRFKJW-ZRSOARAGSA-N	Brc1ccc(\C=C\C=NNc2nc3ccccc3s2)cc1	BroadT	BRD-K26720373	BRD-K26720373-001-06-4	ChemBridge Corporation	5379985			Brc1ccc(\C=C\C=NNc2nc3ccccc3s2)cc1	InChI=1S/C16H12BrN3S/c17-13-9-7-12(8-10-13)4-3-11-18-20-16-19-14-5-1-2-6-15(14)21-16/h1-11H,(H,19,20)/b4-3+,18-11?	VZVXFHISDRFKJW-ZRSOARAGSA-N	356.993530704							
SMR000006411	LSM-16777	SID844591, BRD-A98379220	646917	InChI=1S/C20H22ClN3O3/c1-13-5-6-15(12-17(13)21)22-19(25)18-4-3-11-24(18)20(26)23-14-7-9-16(27-2)10-8-14/h5-10,12,18H,3-4,11H2,1-2H3,(H,22,25)(H,23,26)	JQBFXJYOXMQKOB-UHFFFAOYSA-N	COc1ccc(NC(=O)N2CCCC2C(=O)Nc3ccc(C)c(Cl)c3)cc1	BroadT	BRD-A98379220	BRD-A98379220-001-05-1	Asinex Ltd.	ASN 06351921			COc1ccc(NC(=O)N2CCCC2C(=O)Nc2ccc(C)c(Cl)c2)cc1	InChI=1S/C20H22ClN3O3/c1-13-5-6-15(12-17(13)21)22-19(25)18-4-3-11-24(18)20(26)23-14-7-9-16(27-2)10-8-14/h5-10,12,18H,3-4,11H2,1-2H3,(H,22,25)(H,23,26)	JQBFXJYOXMQKOB-UHFFFAOYSA-N	387.134969304							105414
SMR000136648	LSM-43664	SID14734627, BRD-K85711978	895212	InChI=1S/C16H10F4O3/c1-2-3-10-11(17)13(19)15(14(20)12(10)18)23-9-6-4-8(5-7-9)16(21)22/h2-7H,1H3,(H,21,22)/b3-2+	JPLMUUCPIHXJTA-NSCUHMNNSA-N	C\C=C\c1c(F)c(F)c(Oc2ccc(cc2)C(=O)O)c(F)c1F	BroadT	BRD-K85711978	BRD-K85711978-001-06-0	ChemBridge Corporation	7638476			C\C=C\c1c(F)c(F)c(Oc2ccc(cc2)C(O)=O)c(F)c1F	InChI=1S/C16H10F4O3/c1-2-3-10-11(17)13(19)15(14(20)12(10)18)23-9-6-4-8(5-7-9)16(21)22/h2-7H,1H3,(H,21,22)/b3-2+	JPLMUUCPIHXJTA-NSCUHMNNSA-N	326.05660698							
AC1LHHNX	LSM-15533	BRD-K01799572	887504	InChI=1S/C14H17NO/c1-15(2)9-10-16-14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,9-10H2,1-2H3	ZGSQBSCXVDPEMV-UHFFFAOYSA-N	CN(C)CCOc1ccc2ccccc2c1	BroadT	BRD-K01799572	BRD-K01799572-034-05-9	ChemBridge Corporation	7326305		OC(=O)C(=O)O	CN(C)CCOc1ccc2ccccc2c1.OC(=O)C(=O)O	InChI=1S/C14H17NO.C2H2O4/c1-15(2)9-10-16-14-8-7-12-5-3-4-6-13(12)11-14;3-1(4)2(5)6/h3-8,11H,9-10H2,1-2H3;(H,3,4)(H,5,6)	PQYVKPYTPJXWRF-UHFFFAOYSA-N	215.131014174							104169, 104169
MLS000688017	LSM-15534	BRD-K34777123	1148166	InChI=1S/C23H27FN2O/c24-21-10-6-20(7-11-21)23(27)26-16-14-25(15-17-26)22-12-8-19(9-13-22)18-4-2-1-3-5-18/h1-7,10-11,19,22H,8-9,12-17H2	MSXNTDQMFQNMMD-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)N2CCN(CC2)C3CCC(CC3)c4ccccc4	BroadT	BRD-K34777123	BRD-K34777123-034-06-8	Asinex Ltd.	BAS 03050239		OC(=O)C(=O)O	Fc1ccc(cc1)C(=O)N1CCN(CC1)C1CCC(CC1)c1ccccc1.OC(=O)C(=O)O	InChI=1S/C23H27FN2O.C2H2O4/c24-21-10-6-20(7-11-21)23(27)26-16-14-25(15-17-26)22-12-8-19(9-13-22)18-4-2-1-3-5-18;3-1(4)2(5)6/h1-7,10-11,19,22H,8-9,12-17H2;(H,3,4)(H,5,6)	KXTLAHFXAAZTLM-UHFFFAOYSA-N	366.210741704							104170, 104170
MLS000590914	LSM-16779	SID17512648, BRD-K58736836	745301	InChI=1S/C18H14N2O/c1-21-14-8-4-7-13(11-14)19-18-15-9-2-5-12-6-3-10-16(20-18)17(12)15/h2-11H,1H3,(H,19,20)	FHSZDGCXOARJMU-UHFFFAOYSA-N	COc1cccc(NC2=Nc3cccc4cccc2c34)c1	BroadT	BRD-K58736836	BRD-K58736836-001-06-2	InterBioScreen Ltd.	STOCK2S-75194			COc1cccc(NC2=Nc3cccc4cccc2c34)c1	InChI=1S/C18H14N2O/c1-21-14-8-4-7-13(11-14)19-18-15-9-2-5-12-6-3-10-16(20-18)17(12)15/h2-11H,1H3,(H,19,20)	FHSZDGCXOARJMU-UHFFFAOYSA-N	274.110613088							105416
ZINC00608642	LSM-43665	SID24793509, BRD-K47843573	2196263	InChI=1S/C19H15NO3/c21-17(19-11-6-14-22-19)12-13-20-16-9-4-5-10-18(16)23-15-7-2-1-3-8-15/h1-14,20H/b13-12+	XQSBWXOTJCKMTA-OUKQBFOZSA-N	O=C(\C=C\Nc1ccccc1Oc2ccccc2)c3occc3	BroadT	BRD-K47843573	BRD-K47843573-001-05-9	ChemBridge Corporation	7650454			O=C(\C=C\Nc1ccccc1Oc1ccccc1)c1ccco1	InChI=1S/C19H15NO3/c21-17(19-11-6-14-22-19)12-13-20-16-9-4-5-10-18(16)23-15-7-2-1-3-8-15/h1-14,20H/b13-12+	XQSBWXOTJCKMTA-OUKQBFOZSA-N	305.10519335							
T0505-4342	LSM-16781	SID22405408, BRD-K13679039	2332199	InChI=1S/C31H24F3N3O3/c32-31(33,34)21-8-4-9-22(18-21)37-29(39)25-11-5-10-23-24(12-13-26(27(23)25)30(37)40)28(38)36-16-14-35(15-17-36)19-20-6-2-1-3-7-20/h1-13,18H,14-17,19H2	WLFBEAMGIJRBPQ-UHFFFAOYSA-N	FC(F)(F)c1cccc(c1)N2C(=O)c3cccc4c(ccc(C2=O)c34)C(=O)N5CCN(Cc6ccccc6)CC5	BroadT	BRD-K13679039	BRD-K13679039-001-07-1	Enamine Ltd.	T0505-4342			FC(F)(F)c1cccc(c1)N1C(=O)c2cccc3c(ccc(C1=O)c23)C(=O)N1CCN(Cc2ccccc2)CC1	InChI=1S/C31H24F3N3O3/c32-31(33,34)21-8-4-9-22(18-21)37-29(39)25-11-5-10-23-24(12-13-26(27(23)25)30(37)40)28(38)36-16-14-35(15-17-36)19-20-6-2-1-3-7-20/h1-13,18H,14-17,19H2	WLFBEAMGIJRBPQ-UHFFFAOYSA-N	543.176976258							105418
3-(2-Methoxyphenyl)-1-phenylprop-2-en-1-one	LSM-43666	SID26665085, BRD-K43475294	5383464	InChI=1S/C16H14O2/c1-18-16-10-6-5-9-14(16)11-12-15(17)13-7-3-2-4-8-13/h2-12H,1H3/b12-11+	ZWTRSTWJBWJEFR-VAWYXSNFSA-N	COc1ccccc1\C=C\C(=O)c2ccccc2	BroadT	BRD-K43475294	BRD-K43475294-001-06-0	National Cancer Institute Chemotherapeutic Agents Repository	636918			COc1ccccc1\C=C\C(=O)c1ccccc1	InChI=1S/C16H14O2/c1-18-16-10-6-5-9-14(16)11-12-15(17)13-7-3-2-4-8-13/h2-12H,1H3/b12-11+	ZWTRSTWJBWJEFR-VAWYXSNFSA-N	238.099379688							
SMR000007562	LSM-16783	SID844114, BRD-K36569688	646423	InChI=1S/C20H25N3O5S2/c1-16-4-8-19(9-5-16)29(25,26)22-12-3-13-23(15-14-22)30(27,28)20-10-6-18(7-11-20)21-17(2)24/h4-11H,3,12-15H2,1-2H3,(H,21,24)	SHTWNHAXTLXGSX-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K36569688	BRD-K36569688-001-05-5	Asinex Ltd.	ASN 06977970			CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCN(CC1)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C20H25N3O5S2/c1-16-4-8-19(9-5-16)29(25,26)22-12-3-13-23(15-14-22)30(27,28)20-10-6-18(7-11-20)21-17(2)24/h4-11H,3,12-15H2,1-2H3,(H,21,24)	SHTWNHAXTLXGSX-UHFFFAOYSA-N	451.12356231							105420
SMR000196738	LSM-16784	SID17412651, SID56322719, BRD-K78133213	1325191	InChI=1S/C27H26O6/c1-17-21-11-10-20(32-16-19-13-24(29-2)26(31-4)25(14-19)30-3)15-23(21)33-27(28)22(17)12-18-8-6-5-7-9-18/h5-11,13-15H,12,16H2,1-4H3	SXZUHOYTEFIBLF-UHFFFAOYSA-N	COc1cc(COc2ccc3C(=C(Cc4ccccc4)C(=O)Oc3c2)C)cc(OC)c1OC	BroadT	BRD-K78133213	BRD-K78133213-001-11-1	ChemBridge Corporation	6942965			COc1cc(COc2ccc3c(C)c(Cc4ccccc4)c(=O)oc3c2)cc(OC)c1OC	InChI=1S/C27H26O6/c1-17-21-11-10-20(32-16-19-13-24(29-2)26(31-4)25(14-19)30-3)15-23(21)33-27(28)22(17)12-18-8-6-5-7-9-18/h5-11,13-15H,12,16H2,1-4H3	SXZUHOYTEFIBLF-UHFFFAOYSA-N	446.172938552							105421
HMS2386C08	LSM-16785	BRD-K04155920	11958377	InChI=1S/C24H18ClN3O2/c25-20-12-9-19(10-13-20)24(29)28-26-15-21-14-11-18-7-4-8-22(23(18)27-21)30-16-17-5-2-1-3-6-17/h1-15H,16H2,(H,28,29)	VPHGVZNVGCNSQR-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)NN=Cc2ccc3cccc(OCc4ccccc4)c3n2	BroadT	BRD-K04155920	BRD-K04155920-001-05-9	Specs	AG-205/07682054			Clc1ccc(cc1)C(=O)NN=Cc1ccc2cccc(OCc3ccccc3)c2n1	InChI=1S/C24H18ClN3O2/c25-20-12-9-19(10-13-20)24(29)28-26-15-21-14-11-18-7-4-8-22(23(18)27-21)30-16-17-5-2-1-3-6-17/h1-15H,16H2,(H,28,29)	VPHGVZNVGCNSQR-UHFFFAOYSA-N	415.108754556							105422
MLS000071568	LSM-16786	SID849248, BRD-K12402465	624350	InChI=1S/C15H9N3OS/c1-2-6-11-10(5-1)13-14(19-11)15(18-9-17-13)20-12-7-3-4-8-16-12/h1-9H	DPEHOXYNMRXRAB-UHFFFAOYSA-N	o1c2ccccc2c3ncnc(Sc4ccccn4)c13	BroadT	BRD-K12402465	BRD-K12402465-001-07-2	Asinex Ltd.	BAS 01507873			S(c1ccccn1)c1ncnc2c3ccccc3oc12	InChI=1S/C15H9N3OS/c1-2-6-11-10(5-1)13-14(19-11)15(18-9-17-13)20-12-7-3-4-8-16-12/h1-9H	DPEHOXYNMRXRAB-UHFFFAOYSA-N	279.046632628							105423
AC1NIE1K	LSM-15190	BRD-K96829009	4829536	InChI=1S/C23H22BrN2O/c1-27-19-11-7-17(8-12-19)22-15-25-14-21(16-5-9-18(24)10-6-16)20-4-2-3-13-26(22)23(20)25/h5-12,15H,2-4,13-14H2,1H3/q+1	JBZPLGMTBVEFIZ-UHFFFAOYSA-N	COc1ccc(cc1)c2c[n+]3CC(=C4CCCCn2c34)c5ccc(Br)cc5	BroadT	BRD-K96829009	BRD-K96829009-004-07-2	Enamine Ltd.	T0503-5951		Br	COc1ccc(cc1)-c1c[n+]2CC(=C3CCCCn1c23)c1ccc(Br)cc1.Br	InChI=1S/C23H22BrN2O.BrH/c1-27-19-11-7-17(8-12-19)22-15-25-14-21(16-5-9-18(24)10-6-16)20-4-2-3-13-26(22)23(20)25;/h5-12,15H,2-4,13-14H2,1H3;1H/q+1;	VAAGLKROVOGAHO-UHFFFAOYSA-N	421.091550944							103840, 103840
MLS001203989	LSM-16787	SID49641503, BRD-K19989439	2792011	InChI=1S/C16H13N3OS/c1-10-3-4-12(7-11(10)2)13-8-21-15-14(13)16(20)19(6-5-17)9-18-15/h3-4,7-9H,6H2,1-2H3	OFUZKQAUTNCHRE-UHFFFAOYSA-N	Cc1ccc(cc1C)c2csc3N=CN(CC#N)C(=O)c23	BroadT	BRD-K19989439	BRD-K19989439-001-05-8	Asinex Ltd.	BAS 03754644			Cc1ccc(cc1C)-c1csc2ncn(CC#N)c(=O)c12	InChI=1S/C16H13N3OS/c1-10-3-4-12(7-11(10)2)13-8-21-15-14(13)16(20)19(6-5-17)9-18-15/h3-4,7-9H,6H2,1-2H3	OFUZKQAUTNCHRE-UHFFFAOYSA-N	295.077932756							105424
85221-16-5	LSM-16788	SID14730919, BRD-K66753526	186315	InChI=1S/C11H15NO3/c1-8(2)15-11(13)12-9-4-6-10(14-3)7-5-9/h4-8H,1-3H3,(H,12,13)	CBGPYPHIFVEQTQ-UHFFFAOYSA-N	COc1ccc(NC(=O)OC(C)C)cc1	BroadT	BRD-K66753526	BRD-K66753526-001-06-2	ChemDiv Inc.	6092-0011			COc1ccc(NC(=O)OC(C)C)cc1	InChI=1S/C11H15NO3/c1-8(2)15-11(13)12-9-4-6-10(14-3)7-5-9/h4-8H,1-3H3,(H,12,13)	CBGPYPHIFVEQTQ-UHFFFAOYSA-N	209.10519335							105425
MLS000862420	LSM-16789	SID24806390, BRD-K24940785	54676439	InChI=1S/C13H12N2O2S/c1-3-8-6(2)4-7-11-12(18-13(7)14-8)9(16)5-10(17)15-11/h4-5H,3H2,1-2H3,(H2,15,16,17)	QWMOYZZAFHNQKO-UHFFFAOYSA-N	CCc1nc2sc3c(O)cc(O)nc3c2cc1C	BroadT	BRD-K24940785	BRD-K24940785-001-05-4	ChemBridge Corporation	9035500			CCc1nc2sc3c(O)cc(O)nc3c2cc1C	InChI=1S/C13H12N2O2S/c1-3-8-6(2)4-7-11-12(18-13(7)14-8)9(16)5-10(17)15-11/h4-5H,3H2,1-2H3,(H2,15,16,17)	QWMOYZZAFHNQKO-UHFFFAOYSA-N	260.061948334							105426
1-[(3,4-Dimethoxyphenyl)sulfonyl]-4-(2-methoxyphenyl)piperazine	LSM-16790	SID4256811, BRD-K57664378	1201987	InChI=1S/C19H24N2O5S/c1-24-17-7-5-4-6-16(17)20-10-12-21(13-11-20)27(22,23)15-8-9-18(25-2)19(14-15)26-3/h4-9,14H,10-13H2,1-3H3	XCDLYQVKMRQWLX-UHFFFAOYSA-N	COc1ccc(cc1OC)S(=O)(=O)N2CCN(CC2)c3ccccc3OC	BroadT	BRD-K57664378	BRD-K57664378-001-05-3	ChemBridge Corporation	6072666			COc1ccc(cc1OC)S(=O)(=O)N1CCN(CC1)c1ccccc1OC	InChI=1S/C19H24N2O5S/c1-24-17-7-5-4-6-16(17)20-10-12-21(13-11-20)27(22,23)15-8-9-18(25-2)19(14-15)26-3/h4-9,14H,10-13H2,1-3H3	XCDLYQVKMRQWLX-UHFFFAOYSA-N	392.140592578							105427
MLS000724844	LSM-16791	SID17514826, BRD-A85224532	2986780	InChI=1S/C28H31N3O4/c1-20-6-2-3-11-25(20)35-19-22(32)18-30-14-12-29(13-15-30)16-17-31-27(33)23-9-4-7-21-8-5-10-24(26(21)23)28(31)34/h2-11,22,32H,12-19H2,1H3	BCSQWBDVLIHPCQ-UHFFFAOYSA-N	Cc1ccccc1OCC(O)CN2CCN(CCN3C(=O)c4cccc5cccc(C3=O)c45)CC2	BroadT	BRD-A85224532	BRD-A85224532-001-07-3	Life Chemicals Inc.	F1771-0042			Cc1ccccc1OCC(O)CN1CCN(CCN2C(=O)c3cccc4cccc(C2=O)c34)CC1	InChI=1S/C28H31N3O4/c1-20-6-2-3-11-25(20)35-19-22(32)18-30-14-12-29(13-15-30)16-17-31-27(33)23-9-4-7-21-8-5-10-24(26(21)23)28(31)34/h2-11,22,32H,12-19H2,1H3	BCSQWBDVLIHPCQ-UHFFFAOYSA-N	473.231456502							105428
AO-359/40796515	LSM-16792	SID17387584, BRD-K53408111	989653	InChI=1S/C20H24ClN3O2/c1-13-10-14(2)12-15(11-13)18(25)24(20(3,4)5)23-19(26)22-17-8-6-16(21)7-9-17/h6-12H,1-5H3,(H2,22,23,26)	SBUXGQJJMZYVEL-UHFFFAOYSA-N	Cc1cc(C)cc(c1)C(=O)N(NC(=O)Nc2ccc(Cl)cc2)C(C)(C)C	BroadT	BRD-K53408111	BRD-K53408111-001-05-1	Specs	AO-359/40796515			Cc1cc(C)cc(c1)C(=O)N(NC(=O)Nc1ccc(Cl)cc1)C(C)(C)C	InChI=1S/C20H24ClN3O2/c1-13-10-14(2)12-15(11-13)18(25)24(20(3,4)5)23-19(26)22-17-8-6-16(21)7-9-17/h6-12H,1-5H3,(H2,22,23,26)	SBUXGQJJMZYVEL-UHFFFAOYSA-N	373.155704748							105429
BAS 02914727	LSM-16793	SID846622, BRD-K32903143	649018	InChI=1S/C13H15ClF3NO2S/c14-11-6-5-10(13(15,16)17)9-12(11)21(19,20)18-7-3-1-2-4-8-18/h5-6,9H,1-4,7-8H2	VLSJGDUOMYWSIU-UHFFFAOYSA-N	FC(F)(F)c1ccc(Cl)c(c1)S(=O)(=O)N2CCCCCC2	BroadT	BRD-K32903143	BRD-K32903143-001-05-9	Asinex Ltd.	BAS 02914727			FC(F)(F)c1ccc(Cl)c(c1)S(=O)(=O)N1CCCCCC1	InChI=1S/C13H15ClF3NO2S/c14-11-6-5-10(13(15,16)17)9-12(11)21(19,20)18-7-3-1-2-4-8-18/h5-6,9H,1-4,7-8H2	VLSJGDUOMYWSIU-UHFFFAOYSA-N	341.04641173							105430
AC1OANHR	LSM-16794	BRD-K56704185	6807411	InChI=1S/C15H17NO3/c1-3-4-9-16-10(2)13-14(17)11-7-5-6-8-12(11)19-15(13)18/h5-8,18H,3-4,9H2,1-2H3	DCRWQJRPXZNJRD-UHFFFAOYSA-N	CCCCN=C(C)C1=C(O)Oc2ccccc2C1=O	BroadT	BRD-K56704185	BRD-K56704185-001-06-9	ChemBridge Corporation	5102862			CCCCN=C(C)c1c(O)oc2ccccc2c1=O	InChI=1S/C15H17NO3/c1-3-4-9-16-10(2)13-14(17)11-7-5-6-8-12(11)19-15(13)18/h5-8,18H,3-4,9H2,1-2H3	DCRWQJRPXZNJRD-UHFFFAOYSA-N	259.120843414							
ST50849769	LSM-16795	SID17433422, BRD-K57624505	2207165	InChI=1S/C13H17N3O4S/c1-3-20-12(18)9-4-6-10(7-5-9)14-13(21)16-15-11(17)8-19-2/h4-7H,3,8H2,1-2H3,(H,15,17)(H2,14,16,21)	SPIWIONSMQIGRJ-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=NNC(=O)COC)S)cc1	BroadT	BRD-K57624505	BRD-K57624505-001-05-3	ChemBridge Corporation	7797372			CCOC(=O)c1ccc(NC(S)=NNC(=O)COC)cc1	InChI=1S/C13H17N3O4S/c1-3-20-12(18)9-4-6-10(7-5-9)14-13(21)16-15-11(17)8-19-2/h4-7H,3,8H2,1-2H3,(H,15,17)(H2,14,16,21)	SPIWIONSMQIGRJ-UHFFFAOYSA-N	311.093976744							105432
MLS000045934	LSM-16796	SID4246819, BRD-K24340678	3241112	InChI=1S/C27H27N7O2/c35-27(22-19-24(20-7-9-28-10-8-20)29-23-4-2-1-3-21(22)23)34-13-11-32(12-14-34)25-5-6-26(31-30-25)33-15-17-36-18-16-33/h1-10,19H,11-18H2	CPHPEVVWPKIKAA-UHFFFAOYSA-N	O=C(N1CCN(CC1)c2ccc(nn2)N3CCOCC3)c4cc(nc5ccccc45)c6ccncc6	BroadT	BRD-K24340678	BRD-K24340678-001-05-7	ChemDiv Inc.	C637-0249			O=C(N1CCN(CC1)c1ccc(nn1)N1CCOCC1)c1cc(nc2ccccc12)-c1ccncc1	InChI=1S/C27H27N7O2/c35-27(22-19-24(20-7-9-28-10-8-20)29-23-4-2-1-3-21(22)23)34-13-11-32(12-14-34)25-5-6-26(31-30-25)33-15-17-36-18-16-33/h1-10,19H,11-18H2	CPHPEVVWPKIKAA-UHFFFAOYSA-N	481.222623174							105433
AC1O9G7S	LSM-16797	BRD-A91823394	6785780	InChI=1S/C14H13N3O3/c18-14(17-16-8-10-4-3-7-15-10)13-9-19-11-5-1-2-6-12(11)20-13/h1-8,13,15H,9H2,(H,17,18)	BWZGDORJNPTUDJ-UHFFFAOYSA-N	O=C(NN=Cc1ccc[nH]1)C2COc3ccccc3O2	BroadT	BRD-A91823394	BRD-A91823394-001-05-5	InterBioScreen Ltd.	STOCK2S-88604			O=C(NN=Cc1ccc[nH]1)C1COc2ccccc2O1	InChI=1S/C14H13N3O3/c18-14(17-16-8-10-4-3-7-15-10)13-9-19-11-5-1-2-6-12(11)20-13/h1-8,13,15H,9H2,(H,17,18)	BWZGDORJNPTUDJ-UHFFFAOYSA-N	271.095691306							
ZINC03359763	LSM-16798	SID14745009, BRD-K04881206	2477287	InChI=1S/C16H16N4OS/c1-16(2,3)13-9-22-15(19-13)20-14(21)10-4-5-11-12(8-10)18-7-6-17-11/h4-9H,1-3H3,(H,19,20,21)	OIUCYBOEOOSATB-UHFFFAOYSA-N	CC(C)(C)c1csc(NC(=O)c2ccc3nccnc3c2)n1	BroadT	BRD-K04881206	BRD-K04881206-001-05-5	Enamine Ltd.	T5314036			CC(C)(C)c1csc(NC(=O)c2ccc3nccnc3c2)n1	InChI=1S/C16H16N4OS/c1-16(2,3)13-9-22-15(19-13)20-14(21)10-4-5-11-12(8-10)18-7-6-17-11/h4-9H,1-3H3,(H,19,20,21)	OIUCYBOEOOSATB-UHFFFAOYSA-N	312.104481862							105435
ST50018916	LSM-16799	SID842171, BRD-K85494642	644427	InChI=1S/C16H18ClNO4/c1-4-5-10-6-16(20)22-13-8-14(12(17)7-11(10)13)21-9-15(19)18(2)3/h6-8H,4-5,9H2,1-3H3	KNWZHZRCAOCXMF-UHFFFAOYSA-N	CCCC1=CC(=O)Oc2cc(OCC(=O)N(C)C)c(Cl)cc12	BroadT	BRD-K85494642	BRD-K85494642-001-06-9	Asinex Ltd.	BAS 04198691			CCCc1cc(=O)oc2cc(OCC(=O)N(C)C)c(Cl)cc12	InChI=1S/C16H18ClNO4/c1-4-5-10-6-16(20)22-13-8-14(12(17)7-11(10)13)21-9-15(19)18(2)3/h6-8H,4-5,9H2,1-3H3	KNWZHZRCAOCXMF-UHFFFAOYSA-N	323.092435776							105436
AC1NYE8I	LSM-16800	SID14738547, BRD-A41910737	5877846	InChI=1S/C17H11Br2FN4/c18-11-3-1-10(2-4-11)15-8-16(24-17(23-15)21-9-22-24)13-7-12(19)5-6-14(13)20/h1-9,16H,(H,21,22,23)	FEAZABUGTHFEJX-UHFFFAOYSA-N	Fc1ccc(Br)cc1C2C=C(Nc3ncnn23)c4ccc(Br)cc4	BroadT	BRD-A41910737	BRD-A41910737-001-05-7	ChemDiv Inc.	K832-2317			Fc1ccc(Br)cc1C1C=C(Nc2ncnn12)c1ccc(Br)cc1	InChI=1S/C17H11Br2FN4/c18-11-3-1-10(2-4-11)15-8-16(24-17(23-15)21-9-22-24)13-7-12(19)5-6-14(13)20/h1-9,16H,(H,21,22,23)	FEAZABUGTHFEJX-UHFFFAOYSA-N	447.933449792							105437
AC1NIPSM	LSM-16801	SID49820211, BRD-A03053572	4834863	InChI=1S/C26H27NO6/c1-16(24(28)27-15-17-7-9-19(10-8-17)25(29)30)32-21-12-11-20-13-22(18-5-3-2-4-6-18)26(31)33-23(20)14-21/h2-6,11-14,16-17,19H,7-10,15H2,1H3,(H,27,28)(H,29,30)	ITGDFJSZWWNVPR-UHFFFAOYSA-N	CC(Oc1ccc2C=C(C(=O)Oc2c1)c3ccccc3)C(=O)NCC4CCC(CC4)C(=O)O	BroadT	BRD-A03053572	BRD-A03053572-001-04-3	InterBioScreen Ltd.	STOCK1N-56125			CC(Oc1ccc2cc(-c3ccccc3)c(=O)oc2c1)C(=O)NCC1CCC(CC1)C(O)=O	InChI=1S/C26H27NO6/c1-16(24(28)27-15-17-7-9-19(10-8-17)25(29)30)32-21-12-11-20-13-22(18-5-3-2-4-6-18)26(31)33-23(20)14-21/h2-6,11-14,16-17,19H,7-10,15H2,1H3,(H,27,28)(H,29,30)	ITGDFJSZWWNVPR-UHFFFAOYSA-N	449.183837594							105438
AK-968/41924963	LSM-16802	SID17387325, BRD-K20193240	1000490	InChI=1S/C16H15F2N3O2S/c1-10-5-4-6-11(9-10)19-16(24)21-20-14(22)12-7-2-3-8-13(12)23-15(17)18/h2-9,15H,1H3,(H,20,22)(H2,19,21,24)	YMDZIEDQBSJLJF-UHFFFAOYSA-N	Cc1cccc(NC(=NNC(=O)c2ccccc2OC(F)F)S)c1	BroadT	BRD-K20193240	BRD-K20193240-001-05-3	Specs	AK-968/41924963			Cc1cccc(NC(S)=NNC(=O)c2ccccc2OC(F)F)c1	InChI=1S/C16H15F2N3O2S/c1-10-5-4-6-11(9-10)19-16(24)21-20-14(22)12-7-2-3-8-13(12)23-15(17)18/h2-9,15H,1H3,(H,20,22)(H2,19,21,24)	YMDZIEDQBSJLJF-UHFFFAOYSA-N	351.08530384							105439
SMR000002990	LSM-16803	SID845783, BRD-K80874557	648147	InChI=1S/C23H21N3O4S/c1-30-20-10-9-18-12-19(23(27)25-22(18)13-20)16-26(15-17-6-5-11-24-14-17)31(28,29)21-7-3-2-4-8-21/h2-14H,15-16H2,1H3,(H,25,27)	OHJVPEIXMPTHAG-UHFFFAOYSA-N	COc1ccc2cc(CN(Cc3cccnc3)S(=O)(=O)c4ccccc4)c(O)nc2c1	BroadT	BRD-K80874557	BRD-K80874557-001-05-2	Asinex Ltd.	ASN 04194720			COc1ccc2cc(CN(Cc3cccnc3)S(=O)(=O)c3ccccc3)c(O)nc2c1	InChI=1S/C23H21N3O4S/c1-30-20-10-9-18-12-19(23(27)25-22(18)13-20)16-26(15-17-6-5-11-24-14-17)31(28,29)21-7-3-2-4-8-21/h2-14H,15-16H2,1H3,(H,25,27)	OHJVPEIXMPTHAG-UHFFFAOYSA-N	435.125276872							105440
AP-970/42167330	LSM-15257	BRD-K30694500	2219230	InChI=1S/C21H28N2O2/c1-2-14-25-21-9-8-18-6-3-4-7-19(18)20(21)17-22-10-5-11-23-12-15-24-16-13-23/h2-4,6-9,22H,1,5,10-17H2	PFYNDXDDRGSFNJ-UHFFFAOYSA-N	C=CCOc1ccc2ccccc2c1CNCCCN3CCOCC3	BroadT	BRD-K30694500	BRD-K30694500-003-05-9	Asinex Ltd.	BAS 09590061		Cl	C=CCOc1ccc2ccccc2c1CNCCCN1CCOCC1.Cl	InChI=1S/C21H28N2O2.ClH/c1-2-14-25-21-9-8-18-6-3-4-7-19(18)20(21)17-22-10-5-11-23-12-15-24-16-13-23;/h2-4,6-9,22H,1,5,10-17H2;1H	DVBWUYOJYVSDBA-UHFFFAOYSA-N	340.215078156							103904, 103904
MLS000879274	LSM-16804	SID26732248, BRD-A53168453	16746411	InChI=1S/C34H40N2O4/c1-23-10-9-18-36(22-23)19-17-27(25-13-15-26(16-14-25)35(2)3)32-29(38-4)21-30(39-5)33-28(20-31(37)40-34(32)33)24-11-7-6-8-12-24/h6-8,11-16,20-21,23,27H,9-10,17-19,22H2,1-5H3	DIIOKAPUKRNPAJ-UHFFFAOYSA-N	COc1cc(OC)c2C(=CC(=O)Oc2c1C(CCN3CCCC(C)C3)c4ccc(cc4)N(C)C)c5ccccc5	BroadT	BRD-A53168453	BRD-A53168453-001-05-9	University of Kansas CMLD	KUC101521N			COc1cc(OC)c2c(cc(=O)oc2c1C(CCN1CCCC(C)C1)c1ccc(cc1)N(C)C)-c1ccccc1	InChI=1S/C34H40N2O4/c1-23-10-9-18-36(22-23)19-17-27(25-13-15-26(16-14-25)35(2)3)32-29(38-4)21-30(39-5)33-28(20-31(37)40-34(32)33)24-11-7-6-8-12-24/h6-8,11-16,20-21,23,27H,9-10,17-19,22H2,1-5H3	DIIOKAPUKRNPAJ-UHFFFAOYSA-N	540.29880778							105441
SMR000142199	LSM-43667	SID14740166, BRD-K91220916	5400728	InChI=1S/C11H12N2OS2/c1-3-13-10(14)9(12-11(13)15)6-8-5-4-7(2)16-8/h4-6H,3H2,1-2H3,(H,12,15)/b9-6-	XTKQPAZINZWJOW-TWGQIWQCSA-N	CCN1C(=S)N\C(=C/c2ccc(C)s2)\C1=O	BroadT	BRD-K91220916	BRD-K91220916-001-05-1	ChemBridge Corporation	7053496			CCN1C(=S)N\C(=C/c2ccc(C)s2)C1=O	InChI=1S/C11H12N2OS2/c1-3-13-10(14)9(12-11(13)15)6-8-5-4-7(2)16-8/h4-6H,3H2,1-2H3,(H,12,15)/b9-6-	XTKQPAZINZWJOW-TWGQIWQCSA-N	252.039104404							
MLS000334378	LSM-16806	SID22401596, BRD-A30409205	4438634	InChI=1S/C21H17NO6S/c1-26-13-6-7-14-12(8-20(24)28-16(14)9-13)11-27-19(23)10-18-21(25)22-15-4-2-3-5-17(15)29-18/h2-9,18H,10-11H2,1H3,(H,22,25)	ANIJAGIIVRSADG-UHFFFAOYSA-N	COc1ccc2C(=CC(=O)Oc2c1)COC(=O)CC3Sc4ccccc4NC3=O	BroadT	BRD-A30409205	BRD-A30409205-001-06-4	Enamine Ltd.	T5284331			COc1ccc2c(COC(=O)CC3Sc4ccccc4NC3=O)cc(=O)oc2c1	InChI=1S/C21H17NO6S/c1-26-13-6-7-14-12(8-20(24)28-16(14)9-13)11-27-19(23)10-18-21(25)22-15-4-2-3-5-17(15)29-18/h2-9,18H,10-11H2,1H3,(H,22,25)	ANIJAGIIVRSADG-UHFFFAOYSA-N	411.077657964							105443
F3385-1191	LSM-16807	SID14742515, BRD-K00815570	5822166	InChI=1S/C22H23NO6/c1-14-21(29-16-5-3-15(26-2)4-6-16)20(25)17-7-8-19(24)18(22(17)28-14)13-23-9-11-27-12-10-23/h3-8,24H,9-13H2,1-2H3	BSNGBVCGIHUQDV-UHFFFAOYSA-N	COc1ccc(OC2=C(C)Oc3c(CN4CCOCC4)c(O)ccc3C2=O)cc1	BroadT	BRD-K00815570	BRD-K00815570-001-05-5	InterBioScreen Ltd.	STOCK4S-50241			COc1ccc(Oc2c(C)oc3c(CN4CCOCC4)c(O)ccc3c2=O)cc1	InChI=1S/C22H23NO6/c1-14-21(29-16-5-3-15(26-2)4-6-16)20(25)17-7-8-19(24)18(22(17)28-14)13-23-9-11-27-12-10-23/h3-8,24H,9-13H2,1-2H3	BSNGBVCGIHUQDV-UHFFFAOYSA-N	397.152537466							105444
AC1NT3QC	LSM-16808	SID17511047, BRD-A59911302	5323450	InChI=1S/C17H17F3N4O4/c1-4-28-15(25)12-13(10-7-9(26-2)5-6-11(10)27-3)24-16(21-8-22-24)23-14(12)17(18,19)20/h5-8,13H,4H2,1-3H3,(H,21,22,23)	NLPHTDCJPAPIFT-UHFFFAOYSA-N	CCOC(=O)C1=C(Nc2ncnn2C1c3cc(OC)ccc3OC)C(F)(F)F	BroadT	BRD-A59911302	BRD-A59911302-001-06-7	ChemDiv Inc.	K832-3616			CCOC(=O)C1=C(Nc2ncnn2C1c1cc(OC)ccc1OC)C(F)(F)F	InChI=1S/C17H17F3N4O4/c1-4-28-15(25)12-13(10-7-9(26-2)5-6-11(10)27-3)24-16(21-8-22-24)23-14(12)17(18,19)20/h5-8,13H,4H2,1-3H3,(H,21,22,23)	NLPHTDCJPAPIFT-UHFFFAOYSA-N	398.120189664							105445
MLS001224636	LSM-16809	SID49826024, BRD-A52775498	17374640	InChI=1S/C17H26N2O2S/c1-12(13-9-10-15(20-2)16(11-13)21-3)18-17(22)19-14-7-5-4-6-8-14/h9-12,14H,4-8H2,1-3H3,(H2,18,19,22)	WQIFQWLLUTYTOX-UHFFFAOYSA-N	COc1ccc(cc1OC)C(C)N=C(S)NC2CCCCC2	BroadT	BRD-A52775498	BRD-A52775498-001-06-7	Chemical Technologies & Investigations	UZI/1258142			COc1ccc(cc1OC)C(C)N=C(S)NC1CCCCC1	InChI=1S/C17H26N2O2S/c1-12(13-9-10-15(20-2)16(11-13)21-3)18-17(22)19-14-7-5-4-6-8-14/h9-12,14H,4-8H2,1-3H3,(H2,18,19,22)	WQIFQWLLUTYTOX-UHFFFAOYSA-N	322.171498782							105446
MLS000724696	LSM-16810	SID17514380, BRD-K39781787	2142305	InChI=1S/C22H17NO5/c1-12-17(22(26)23-11-13-7-9-14(27-2)10-8-13)18-19(24)15-5-3-4-6-16(15)20(25)21(18)28-12/h3-10H,11H2,1-2H3,(H,23,26)	XQTWWQCHTYENDU-UHFFFAOYSA-N	COc1ccc(CNC(=O)c2c(C)oc3C(=O)c4ccccc4C(=O)c23)cc1	BroadT	BRD-K39781787	BRD-K39781787-001-08-7	Life Chemicals Inc.	F1654-0380			COc1ccc(CNC(=O)c2c(C)oc3c2C(=O)c2ccccc2C3=O)cc1	InChI=1S/C22H17NO5/c1-12-17(22(26)23-11-13-7-9-14(27-2)10-8-13)18-19(24)15-5-3-4-6-16(15)20(25)21(18)28-12/h3-10H,11H2,1-2H3,(H,23,26)	XQTWWQCHTYENDU-UHFFFAOYSA-N	375.110672654							105447
STK243785	LSM-16811	SID22416328, BRD-K76677559	1291680	InChI=1S/C18H19N3O5/c1-25-17-7-6-13(12-16(17)21(23)24)18(22)19-14-4-2-3-5-15(14)20-8-10-26-11-9-20/h2-7,12H,8-11H2,1H3,(H,19,22)	SFJJYELEPFGWSA-UHFFFAOYSA-N	COc1ccc(cc1[N+](=O)[O-])C(=O)Nc2ccccc2N3CCOCC3	BroadT	BRD-K76677559	BRD-K76677559-001-06-1	ChemBridge Corporation	7258004			COc1ccc(cc1[N+]([O-])=O)C(=O)Nc1ccccc1N1CCOCC1	InChI=1S/C18H19N3O5/c1-25-17-7-6-13(12-16(17)21(23)24)18(22)19-14-4-2-3-5-15(14)20-8-10-26-11-9-20/h2-7,12H,8-11H2,1H3,(H,19,22)	SFJJYELEPFGWSA-UHFFFAOYSA-N	357.132470738							105448
F1607-0589	LSM-16812	SID17515443, BRD-K70466393	2151453	InChI=1S/C27H23NO6S/c1-3-32-19-8-10-20(11-9-19)35(30,31)27-21-14-24-25(34-13-12-33-24)15-23(21)28-16-22(27)26(29)18-6-4-17(2)5-7-18/h4-11,14-16H,3,12-13H2,1-2H3	VBBFZDWBIVMUNA-UHFFFAOYSA-N	CCOc1ccc(cc1)S(=O)(=O)c2c(cnc3cc4OCCOc4cc23)C(=O)c5ccc(C)cc5	BroadT	BRD-K70466393	BRD-K70466393-001-06-5	Life Chemicals Inc.	F1607-0589			CCOc1ccc(cc1)S(=O)(=O)c1c(cnc2cc3OCCOc3cc12)C(=O)c1ccc(C)cc1	InChI=1S/C27H23NO6S/c1-3-32-19-8-10-20(11-9-19)35(30,31)27-21-14-24-25(34-13-12-33-24)15-23(21)28-16-22(27)26(29)18-6-4-17(2)5-7-18/h4-11,14-16H,3,12-13H2,1-2H3	VBBFZDWBIVMUNA-UHFFFAOYSA-N	489.124608156							105449
2-(3-Nitrophenyl)-2,3-dihydro-1H-perimidine	LSM-16813	SID17432579, BRD-K08195191	727031	InChI=1S/C17H13N3O2/c21-20(22)13-7-1-6-12(10-13)17-18-14-8-2-4-11-5-3-9-15(19-17)16(11)14/h1-10,17-19H	BSUMEMPNPZHKGT-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C2Nc3cccc4cccc(N2)c34	BroadT	BRD-K08195191	BRD-K08195191-001-06-1	ChemBridge Corporation	5706584			[O-][N+](=O)c1cccc(c1)C1Nc2cccc3cccc(N1)c23	InChI=1S/C17H13N3O2/c21-20(22)13-7-1-6-12(10-13)17-18-14-8-2-4-11-5-3-9-15(19-17)16(11)14/h1-10,17-19H	BSUMEMPNPZHKGT-UHFFFAOYSA-N	291.100776686							105450
STK846287	LSM-16814	SID17506118, BRD-A35869011	3727153	InChI=1S/C22H15ClF3N3O6/c23-12-7-5-11(6-8-12)19(30)17-18(27-20(31)28-21(17,32)22(24,25)26)16-10-9-15(35-16)13-3-1-2-4-14(13)29(33)34/h1-10,17-18,32H,(H2,27,28,31)	VPRXUYOVNXDRRE-UHFFFAOYSA-N	OC1(NC(=O)NC(C1C(=O)c2ccc(Cl)cc2)c3oc(cc3)c4ccccc4[N+](=O)[O-])C(F)(F)F	BroadT	BRD-A35869011	BRD-A35869011-001-07-6	InterBioScreen Ltd.	STOCK3S-09773			OC1(NC(=O)NC(C1C(=O)c1ccc(Cl)cc1)c1ccc(o1)-c1ccccc1[N+]([O-])=O)C(F)(F)F	InChI=1S/C22H15ClF3N3O6/c23-12-7-5-11(6-8-12)19(30)17-18(27-20(31)28-21(17,32)22(24,25)26)16-10-9-15(35-16)13-3-1-2-4-14(13)29(33)34/h1-10,17-18,32H,(H2,27,28,31)	VPRXUYOVNXDRRE-UHFFFAOYSA-N	509.06014754							105451
MLS000770552	LSM-16815	SID24836616, BRD-K98150028	2472137	InChI=1S/C12H9N3O3S/c16-9(8-3-1-5-13-8)7-19-12-15-14-11(18-12)10-4-2-6-17-10/h1-6,13H,7H2	CGBBFACQKKWJSA-UHFFFAOYSA-N	O=C(CSc1oc(nn1)c2occc2)c3ccc[nH]3	BroadT	BRD-K98150028	BRD-K98150028-001-05-8	Enamine Ltd.	T5327811			O=C(CSc1nnc(o1)-c1ccco1)c1ccc[nH]1	InChI=1S/C12H9N3O3S/c16-9(8-3-1-5-13-8)7-19-12-15-14-11(18-12)10-4-2-6-17-10/h1-6,13H,7H2	CGBBFACQKKWJSA-UHFFFAOYSA-N	275.036461868							105452
MLS000697328	LSM-16816	SID22401531, BRD-K47314824	2138626	InChI=1S/C24H22N6O2S/c1-16-6-10-18(11-7-16)22-24-27-23(20-4-2-3-5-21(20)30(24)29-28-22)26-15-14-17-8-12-19(13-9-17)33(25,31)32/h2-13H,14-15H2,1H3,(H,26,27)(H2,25,31,32)	GXEHDKDVKTUCMK-UHFFFAOYSA-N	Cc1ccc(cc1)c2nnn3c4ccccc4c(NCCc5ccc(cc5)S(=O)(=O)N)nc23	BroadT	BRD-K47314824	BRD-K47314824-001-05-8	Life Chemicals Inc.	F1605-0992			Cc1ccc(cc1)-c1nnn2c1nc(NCCc1ccc(cc1)S(N)(=O)=O)c1ccccc21	InChI=1S/C24H22N6O2S/c1-16-6-10-18(11-7-16)22-24-27-23(20-4-2-3-5-21(20)30(24)29-28-22)26-15-14-17-8-12-19(13-9-17)33(25,31)32/h2-13H,14-15H2,1H3,(H,26,27)(H2,25,31,32)	GXEHDKDVKTUCMK-UHFFFAOYSA-N	458.152494694							105453
STK864275	LSM-16817	SID17414995, BRD-K42147307	920618	InChI=1S/C16H16N2O2S/c1-20-14-9-7-13(8-10-14)15(19)18-16(21)17-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,17,18,19,21)	SWDLKHIZOBMHOX-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NC(=S)NCc2ccccc2	BroadT	BRD-K42147307	BRD-K42147307-001-05-3	ChemBridge Corporation	7120160			COc1ccc(cc1)C(=O)NC(=S)NCc1ccccc1	InChI=1S/C16H16N2O2S/c1-20-14-9-7-13(8-10-14)15(19)18-16(21)17-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,17,18,19,21)	SWDLKHIZOBMHOX-UHFFFAOYSA-N	300.093248462							105454
MLS000072642	LSM-16818	SID843300, BRD-K69838300	645580	InChI=1S/C20H13F3N4O4/c21-20(22,23)17-7-13(11-3-4-15-16(6-11)31-10-30-15)25-18-8-14(26-27(17)18)19(28)24-9-12-2-1-5-29-12/h1-8H,9-10H2,(H,24,28)	GRVOHZQLIZJKLW-UHFFFAOYSA-N	FC(F)(F)c1cc(nc2cc(nn12)C(=O)NCc3occc3)c4ccc5OCOc5c4	BroadT	BRD-K69838300	BRD-K69838300-001-05-2	Asinex Ltd.	BAS 01515959			FC(F)(F)c1cc(nc2cc(nn12)C(=O)NCc1ccco1)-c1ccc2OCOc2c1	InChI=1S/C20H13F3N4O4/c21-20(22,23)17-7-13(11-3-4-15-16(6-11)31-10-30-15)25-18-8-14(26-27(17)18)19(28)24-9-12-2-1-5-29-12/h1-8H,9-10H2,(H,24,28)	GRVOHZQLIZJKLW-UHFFFAOYSA-N	430.088889536							105455
SMR000003300	LSM-16819	SID852333, BRD-K07080929	654948	InChI=1S/C17H17N3O5S/c1-2-23-16(22)11-8-19-17(20-15(11)18)26-9-12(21)10-3-4-13-14(7-10)25-6-5-24-13/h3-4,7-8H,2,5-6,9H2,1H3,(H2,18,19,20)	QEANRWKAACGVQG-UHFFFAOYSA-N	CCOC(=O)c1cnc(SCC(=O)c2ccc3OCCOc3c2)nc1N	BroadT	BRD-K07080929	BRD-K07080929-001-05-7	Asinex Ltd.	ASN 04374155			CCOC(=O)c1cnc(SCC(=O)c2ccc3OCCOc3c2)nc1N	InChI=1S/C17H17N3O5S/c1-2-23-16(22)11-8-19-17(20-15(11)18)26-9-12(21)10-3-4-13-14(7-10)25-6-5-24-13/h3-4,7-8H,2,5-6,9H2,1H3,(H2,18,19,20)	QEANRWKAACGVQG-UHFFFAOYSA-N	375.088891364							105456
MLS000624931	LSM-16820	SID24785956, BRD-K15466426	1290899	InChI=1S/C25H35N5/c1-3-29(4-2)22-14-12-21(13-15-22)20-26-25-27-23-10-6-7-11-24(23)30(25)19-18-28-16-8-5-9-17-28/h6-7,10-15H,3-5,8-9,16-20H2,1-2H3,(H,26,27)	UBXVEORGGYZAAZ-UHFFFAOYSA-N	CCN(CC)c1ccc(CNc2nc3ccccc3n2CCN4CCCCC4)cc1	BroadT	BRD-K15466426	BRD-K15466426-001-08-0	ChemBridge Corporation	7747256			CCN(CC)c1ccc(CNc2nc3ccccc3n2CCN2CCCCC2)cc1	InChI=1S/C25H35N5/c1-3-29(4-2)22-14-12-21(13-15-22)20-26-25-27-23-10-6-7-11-24(23)30(25)19-18-28-16-8-5-9-17-28/h6-7,10-15H,3-5,8-9,16-20H2,1-2H3,(H,26,27)	UBXVEORGGYZAAZ-UHFFFAOYSA-N	405.28924617							105457
BAS 03086869	LSM-16821	SID7977593, BRD-K94070236	704276	InChI=1S/C17H25N3O4/c1-3-24-17(22)20-12-10-19(11-13-20)9-8-16(21)18-14-4-6-15(23-2)7-5-14/h4-7H,3,8-13H2,1-2H3,(H,18,21)	QOGMSGDSEDXMQN-UHFFFAOYSA-N	CCOC(=O)N1CCN(CCC(=O)Nc2ccc(OC)cc2)CC1	BroadT	BRD-K94070236	BRD-K94070236-001-05-0	ChemBridge Corporation	6511148			CCOC(=O)N1CCN(CCC(=O)Nc2ccc(OC)cc2)CC1	InChI=1S/C17H25N3O4/c1-3-24-17(22)20-12-10-19(11-13-20)9-8-16(21)18-14-4-6-15(23-2)7-5-14/h4-7H,3,8-13H2,1-2H3,(H,18,21)	QOGMSGDSEDXMQN-UHFFFAOYSA-N	335.18450631							105458
MLS000090788	LSM-16822	SID4248806, BRD-K24751529	3242835	InChI=1S/C20H25N3O/c1-2-16-7-9-19(10-8-16)22-20(24)21-12-14-23-13-11-17-5-3-4-6-18(17)15-23/h3-10H,2,11-15H2,1H3,(H2,21,22,24)	CECBTDTUWICXFJ-UHFFFAOYSA-N	CCc1ccc(NC(=O)NCCN2CCc3ccccc3C2)cc1	BroadT	BRD-K24751529	BRD-K24751529-001-05-6	ChemDiv Inc.	C270-0021			CCc1ccc(NC(=O)NCCN2CCc3ccccc3C2)cc1	InChI=1S/C20H25N3O/c1-2-16-7-9-19(10-8-16)22-20(24)21-12-14-23-13-11-17-5-3-4-6-18(17)15-23/h3-10H,2,11-15H2,1H3,(H2,21,22,24)	CECBTDTUWICXFJ-UHFFFAOYSA-N	323.19976245							105459
T5776965	LSM-16823	SID22405705, BRD-K28582696	2491992	InChI=1S/C21H23N3O2S2/c1-4-24-20(26)18-13(2)14(3)28-19(18)22-21(24)27-12-17(25)23-10-9-15-7-5-6-8-16(15)11-23/h5-8H,4,9-12H2,1-3H3	KDGSYBWZDAMPRM-UHFFFAOYSA-N	CCN1C(=O)c2c(C)c(C)sc2N=C1SCC(=O)N3CCc4ccccc4C3	BroadT	BRD-K28582696	BRD-K28582696-001-05-8	Enamine Ltd.	ZU-4179272			CCn1c(SCC(=O)N2CCc3ccccc3C2)nc2sc(C)c(C)c2c1=O	InChI=1S/C21H23N3O2S2/c1-4-24-20(26)18-13(2)14(3)28-19(18)22-21(24)27-12-17(25)23-10-9-15-7-5-6-8-16(15)11-23/h5-8H,4,9-12H2,1-3H3	KDGSYBWZDAMPRM-UHFFFAOYSA-N	413.123168386							105460
MLS000563231	LSM-16824	SID17508144, BRD-A80352900	3174434	InChI=1S/C26H31N3O3S/c1-26(2,3)28-24(30)23(22-12-8-16-33-22)29(17-19-11-7-15-32-19)25(31)21-14-13-20(27-21)18-9-5-4-6-10-18/h4-6,8-10,12-14,16,19,23,27H,7,11,15,17H2,1-3H3,(H,28,30)	GXLXLQYIOKTBOF-UHFFFAOYSA-N	CC(C)(C)NC(=O)C(N(CC1CCCO1)C(=O)c2ccc([nH]2)c3ccccc3)c4cccs4	BroadT	BRD-A80352900	BRD-A80352900-001-06-3	Asinex Ltd.	ASN 03651683			CC(C)(C)NC(=O)C(N(CC1CCCO1)C(=O)c1ccc([nH]1)-c1ccccc1)c1cccs1	InChI=1S/C26H31N3O3S/c1-26(2,3)28-24(30)23(22-12-8-16-33-22)29(17-19-11-7-15-32-19)25(31)21-14-13-20(27-21)18-9-5-4-6-10-18/h4-6,8-10,12-14,16,19,23,27H,7,11,15,17H2,1-3H3,(H,28,30)	GXLXLQYIOKTBOF-UHFFFAOYSA-N	465.208612572							105461
AC1LSHEM	LSM-15535	BRD-K88328355	1439211	InChI=1S/C17H23N3O4/c1-3-19-4-6-20(7-5-19)10-17(22)18-14-9-16-15(23-11-24-16)8-13(14)12(2)21/h8-9H,3-7,10-11H2,1-2H3,(H,18,22)	UBQKKSHJVHJOAL-UHFFFAOYSA-N	CCN1CCN(CC(=O)Nc2cc3OCOc3cc2C(=O)C)CC1	BroadT	BRD-K88328355	BRD-K88328355-034-05-6	Asinex Ltd.	ASN 08240437		OC(=O)C(=O)O	CCN1CCN(CC(=O)Nc2cc3OCOc3cc2C(C)=O)CC1.OC(=O)C(=O)O	InChI=1S/C17H23N3O4.C2H2O4/c1-3-19-4-6-20(7-5-19)10-17(22)18-14-9-16-15(23-11-24-16)8-13(14)12(2)21;3-1(4)2(5)6/h8-9H,3-7,10-11H2,1-2H3,(H,18,22);(H,3,4)(H,5,6)	AXRAAPMDIWRGDQ-UHFFFAOYSA-N	333.168856246							104171, 104171
ZINC04980359	LSM-16825	SID26658683, BRD-K09365132	4593573	InChI=1S/C22H22N2O4S/c1-15-11-13-24(14-12-15)20-19(23-29(27,28)16-7-3-2-4-8-16)21(25)17-9-5-6-10-18(17)22(20)26/h2-10,15,23H,11-14H2,1H3	UFLHDBCVXZGJMP-UHFFFAOYSA-N	CC1CCN(CC1)C2=C(NS(=O)(=O)c3ccccc3)C(=O)c4ccccc4C2=O	BroadT	BRD-K09365132	BRD-K09365132-001-05-3	InterBioScreen Ltd.	STOCK3S-41158			CC1CCN(CC1)C1=C(NS(=O)(=O)c2ccccc2)C(=O)c2ccccc2C1=O	InChI=1S/C22H22N2O4S/c1-15-11-13-24(14-12-15)20-19(23-29(27,28)16-7-3-2-4-8-16)21(25)17-9-5-6-10-18(17)22(20)26/h2-10,15,23H,11-14H2,1H3	UFLHDBCVXZGJMP-UHFFFAOYSA-N	410.130027894							105462
SMR000145385	LSM-16826	SID14741449, SID87345392, BRD-A93532989	4325987	InChI=1S/C31H24N6O2/c1-19-27-28(20-16-17-25(38)26(39)18-20)36-24-15-9-8-14-23(24)33-29(32-21-10-4-2-5-11-21)31(36)34-30(27)37(35-19)22-12-6-3-7-13-22/h2-18,28,38-39H,1H3,(H,32,33)	NWCSVPLYCSMGDA-UHFFFAOYSA-N	Cc1nn(c2ccccc2)c3N=C4N(C(c5ccc(O)c(O)c5)c13)c6ccccc6N=C4Nc7ccccc7	BroadT	BRD-A93532989	BRD-A93532989-001-06-9	InterBioScreen Ltd.	STOCK3S-55640			Cc1nn(c2N=C3N(C(c12)c1ccc(O)c(O)c1)c1ccccc1N=C3Nc1ccccc1)-c1ccccc1	InChI=1S/C31H24N6O2/c1-19-27-28(20-16-17-25(38)26(39)18-20)36-24-15-9-8-14-23(24)33-29(32-21-10-4-2-5-11-21)31(36)34-30(27)37(35-19)22-12-6-3-7-13-22/h2-18,28,38-39H,1H3,(H,32,33)	NWCSVPLYCSMGDA-UHFFFAOYSA-N	512.196074068							105463
AC1M5H7K	LSM-16827	BRD-K01039136	2328705	InChI=1S/C30H27N7O/c1-21-26(30(36-16-7-8-17-36)37(35-21)23-11-3-2-4-12-23)20-32-34-29(38)25-18-28(22-10-9-15-31-19-22)33-27-14-6-5-13-24(25)27/h2-6,9-15,18-20H,7-8,16-17H2,1H3,(H,34,38)	JXLOCLPCKCBDBS-UHFFFAOYSA-N	Cc1nn(c2ccccc2)c(N3CCCC3)c1C=NNC(=O)c4cc(nc5ccccc45)c6cccnc6	BroadT	BRD-K01039136	BRD-K01039136-001-07-4	Enamine Ltd.	T0504-9149			Cc1nn(c(N2CCCC2)c1C=NNC(=O)c1cc(nc2ccccc12)-c1cccnc1)-c1ccccc1	InChI=1S/C30H27N7O/c1-21-26(30(36-16-7-8-17-36)37(35-21)23-11-3-2-4-12-23)20-32-34-29(38)25-18-28(22-10-9-15-31-19-22)33-27-14-6-5-13-24(25)27/h2-6,9-15,18-20H,7-8,16-17H2,1H3,(H,34,38)	JXLOCLPCKCBDBS-UHFFFAOYSA-N	501.227708554							105464
STK849820	LSM-16828	SID14741565, BRD-K13723985	834017	InChI=1S/C12H13N3OS2/c1-17-12-15-14-11(18-12)13-10(16)8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,13,14,16)	QMTRJIWCSSFRSQ-UHFFFAOYSA-N	CSc1nnc(NC(=O)CCc2ccccc2)s1	BroadT	BRD-K13723985	BRD-K13723985-001-05-5	InterBioScreen Ltd.	STOCK3S-57776			CSc1nnc(NC(=O)CCc2ccccc2)s1	InChI=1S/C12H13N3OS2/c1-17-12-15-14-11(18-12)13-10(16)8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,13,14,16)	QMTRJIWCSSFRSQ-UHFFFAOYSA-N	279.050003446							105465
CID_776376	LSM-16829	SID87457214, BRD-A87704518	44607875	InChI=1S/C13H11NO4/c1-7(15)14(2)10-11(16)8-5-3-4-6-9(8)12(17)13(10)18/h3-6,10H,1-2H3	WHSXZOCPNUOMBY-UHFFFAOYSA-N	CN(C1C(=O)C(=O)c2ccccc2C1=O)C(=O)C	BroadT	BRD-A87704518	BRD-A87704518-001-07-0	Asinex Ltd.	BAS 01121593			CN(C1C(=O)C(=O)c2ccccc2C1=O)C(C)=O	InChI=1S/C13H11NO4/c1-7(15)14(2)10-11(16)8-5-3-4-6-9(8)12(17)13(10)18/h3-6,10H,1-2H3	WHSXZOCPNUOMBY-UHFFFAOYSA-N	245.068807842							105466
SMR000067751	LSM-16830	SID3714139, BRD-K96837765	2302351	InChI=1S/C23H25N3O3/c1-28-18-8-6-17(7-9-18)22-16-20(19-4-2-3-5-21(19)25-22)23(27)24-10-11-26-12-14-29-15-13-26/h2-9,16H,10-15H2,1H3,(H,24,27)	SGBBRKAISVWHMV-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(C(=O)NCCN3CCOCC3)c4ccccc4n2	BroadT	BRD-K96837765	BRD-K96837765-001-05-9	Enamine Ltd.	T5282012			COc1ccc(cc1)-c1cc(C(=O)NCCN2CCOCC2)c2ccccc2n1	InChI=1S/C23H25N3O3/c1-28-18-8-6-17(7-9-18)22-16-20(19-4-2-3-5-21(19)25-22)23(27)24-10-11-26-12-14-29-15-13-26/h2-9,16H,10-15H2,1H3,(H,24,27)	SGBBRKAISVWHMV-UHFFFAOYSA-N	391.18959169							105467
MLS000558132	LSM-16831	SID17401773, BRD-A76407812	3914450	InChI=1S/C17H26N4OS2/c1-6-17(2)9-11-12(10-22-17)24-15-13(11)14(18-7-8-21(3)4)19-16(20-15)23-5/h6-10H2,1-5H3,(H,18,19,20)	XWAXCWGQTKUVOV-UHFFFAOYSA-N	CCC1(C)Cc2c(CO1)sc3nc(SC)nc(NCCN(C)C)c23	BroadT	BRD-A76407812	BRD-A76407812-001-05-0	InterBioScreen Ltd.	STOCK4S-69215			CCC1(C)Cc2c(CO1)sc1nc(SC)nc(NCCN(C)C)c21	InChI=1S/C17H26N4OS2/c1-6-17(2)9-11-12(10-22-17)24-15-13(11)14(18-7-8-21(3)4)19-16(20-15)23-5/h6-10H2,1-5H3,(H,18,19,20)	XWAXCWGQTKUVOV-UHFFFAOYSA-N	366.154802872							105468
SMR000035392	LSM-16832	SID7968404, SID863317, BRD-K28081825	664563	InChI=1S/C28H23N5O3/c34-24(18-33-27(35)22-12-6-7-13-23(22)28(33)36)31-14-16-32(17-15-31)26-21-11-5-4-10-20(21)25(29-30-26)19-8-2-1-3-9-19/h1-13H,14-18H2	IXQKLGBUUZVOSE-UHFFFAOYSA-N	O=C(CN1C(=O)c2ccccc2C1=O)N3CCN(CC3)c4nnc(c5ccccc5)c6ccccc46	BroadT	BRD-K28081825	BRD-K28081825-001-05-5	ChemDiv Inc.	6434-3660			O=C(CN1C(=O)c2ccccc2C1=O)N1CCN(CC1)c1nnc(-c2ccccc2)c2ccccc12	InChI=1S/C28H23N5O3/c34-24(18-33-27(35)22-12-6-7-13-23(22)28(33)36)31-14-16-32(17-15-31)26-21-11-5-4-10-20(21)25(29-30-26)19-8-2-1-3-9-19/h1-13H,14-18H2	IXQKLGBUUZVOSE-UHFFFAOYSA-N	477.180089646							105469
ZINC00618711	LSM-16833	SID47196649, BRD-K03267121	976485	InChI=1S/C19H18N2O4/c1-3-8-21-18(24)13-6-5-12(10-14(13)19(21)25)17(23)20-15-9-11(2)4-7-16(15)22/h4-7,9-10,22H,3,8H2,1-2H3,(H,20,23)	XZBLDKMHENSBIN-UHFFFAOYSA-N	CCCN1C(=O)c2ccc(cc2C1=O)C(=O)Nc3cc(C)ccc3O	BroadT	BRD-K03267121	BRD-K03267121-001-07-6	ChemBridge Corporation	7724798			CCCN1C(=O)c2ccc(cc2C1=O)C(=O)Nc1cc(C)ccc1O	InChI=1S/C19H18N2O4/c1-3-8-21-18(24)13-6-5-12(10-14(13)19(21)25)17(23)20-15-9-11(2)4-7-16(15)22/h4-7,9-10,22H,3,8H2,1-2H3,(H,20,23)	XZBLDKMHENSBIN-UHFFFAOYSA-N	338.126657076							105470
SMR000153251	LSM-43668	SID14747068, BRD-K16323978	6091096	InChI=1S/C13H13ClN2O5/c1-2-20-12(18)5-6-13(19)21-8-11(17)16-10-4-3-9(14)7-15-10/h3-7H,2,8H2,1H3,(H,15,16,17)/b6-5+	ZLUVOUVYNMZCLJ-AATRIKPKSA-N	CCOC(=O)\C=C\C(=O)OCC(=O)Nc1ccc(Cl)cn1	BroadT	BRD-K16323978	BRD-K16323978-001-05-0	Enamine Ltd.	T5261973			CCOC(=O)\C=C\C(=O)OCC(=O)Nc1ccc(Cl)cn1	InChI=1S/C13H13ClN2O5/c1-2-20-12(18)5-6-13(19)21-8-11(17)16-10-4-3-9(14)7-15-10/h3-7H,2,8H2,1H3,(H,15,16,17)/b6-5+	ZLUVOUVYNMZCLJ-AATRIKPKSA-N	312.051299246							
SMR000023991	LSM-16835	SID4245114, BRD-K13306274	3239620	InChI=1S/C23H21N3O4/c1-3-26-19-13-12-18(16-6-5-7-17(20(16)19)21(26)27)25-23(29)24-15-10-8-14(9-11-15)22(28)30-4-2/h5-13H,3-4H2,1-2H3,(H2,24,25,29)	XMJIRJQSDSUUTG-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)Nc2ccc3N(CC)C(=O)c4cccc2c34)cc1	BroadT	BRD-K13306274	BRD-K13306274-001-05-9	ChemDiv Inc.	2513-1989			CCOC(=O)c1ccc(NC(=O)Nc2ccc3N(CC)C(=O)c4cccc2c34)cc1	InChI=1S/C23H21N3O4/c1-3-26-19-13-12-18(16-6-5-7-17(20(16)19)21(26)27)25-23(29)24-15-10-8-14(9-11-15)22(28)30-4-2/h5-13H,3-4H2,1-2H3,(H2,24,25,29)	XMJIRJQSDSUUTG-UHFFFAOYSA-N	403.153206182							105472
3-Nitro-n-(pyridin-2-ylmethylideneamino)benzamide	LSM-16836	BRD-K26801211	775111	InChI=1S/C13H10N4O3/c18-13(10-4-3-6-12(8-10)17(19)20)16-15-9-11-5-1-2-7-14-11/h1-9H,(H,16,18)	BDIPDGBKQLKZNG-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C(=O)NN=Cc2ccccn2	BroadT	BRD-K26801211	BRD-K26801211-001-05-0	ChemDiv Inc.	2262-3532			[O-][N+](=O)c1cccc(c1)C(=O)NN=Cc1ccccn1	InChI=1S/C13H10N4O3/c18-13(10-4-3-6-12(8-10)17(19)20)16-15-9-11-5-1-2-7-14-11/h1-9H,(H,16,18)	BDIPDGBKQLKZNG-UHFFFAOYSA-N	270.07529022							105473
MLS000074409	LSM-16837	SID847555, BRD-K48398310	649961	InChI=1S/C18H22N4OS/c1-2-10-19-17-14-8-4-5-9-15(14)18(21-20-17)24-13-16(23)22-11-6-3-7-12-22/h2,4-5,8-9H,1,3,6-7,10-13H2,(H,19,20)	QEAGUQGAHXBMLP-UHFFFAOYSA-N	C=CCNc1nnc(SCC(=O)N2CCCCC2)c3ccccc13	BroadT	BRD-K48398310	BRD-K48398310-001-05-1	Asinex Ltd.	ASN 06976756			C=CCNc1nnc(SCC(=O)N2CCCCC2)c2ccccc12	InChI=1S/C18H22N4OS/c1-2-10-19-17-14-8-4-5-9-15(14)18(21-20-17)24-13-16(23)22-11-6-3-7-12-22/h2,4-5,8-9H,1,3,6-7,10-13H2,(H,19,20)	QEAGUQGAHXBMLP-UHFFFAOYSA-N	342.151432054							105474
MLS000103627	LSM-16838	SID7971447, BRD-A22137475	3438022	InChI=1S/C20H18N4OS/c25-19-18(26-20-21-13-22-24(19)20)17(15-7-2-1-3-8-15)23-11-10-14-6-4-5-9-16(14)12-23/h1-9,13,17,25H,10-12H2	SQGAXWZVRYTQSD-UHFFFAOYSA-N	Oc1c(sc2ncnn12)C(N3CCc4ccccc4C3)c5ccccc5	BroadT	BRD-A22137475	BRD-A22137475-001-06-4	Life Chemicals Inc.	F1805-0025			Oc1c(sc2ncnn12)C(N1CCc2ccccc2C1)c1ccccc1	InChI=1S/C20H18N4OS/c25-19-18(26-20-21-13-22-24(19)20)17(15-7-2-1-3-8-15)23-11-10-14-6-4-5-9-16(14)12-23/h1-9,13,17,25H,10-12H2	SQGAXWZVRYTQSD-UHFFFAOYSA-N	362.120131926							105475
SMR000178388	LSM-16839	SID17407634, BRD-A93863513	3153670	InChI=1S/C24H24F2N4O2/c25-18-9-5-16(6-10-18)15-30(24(32)21-13-14-27-29-21)22(17-7-11-19(26)12-8-17)23(31)28-20-3-1-2-4-20/h5-14,20,22H,1-4,15H2,(H,27,29)(H,28,31)	DCJCSWSWGMNFNW-UHFFFAOYSA-N	Fc1ccc(CN(C(C(=O)NC2CCCC2)c3ccc(F)cc3)C(=O)c4cc[nH]n4)cc1	BroadT	BRD-A93863513	BRD-A93863513-001-05-5	Asinex Ltd.	BAS 06264672			Fc1ccc(CN(C(C(=O)NC2CCCC2)c2ccc(F)cc2)C(=O)c2cc[nH]n2)cc1	InChI=1S/C24H24F2N4O2/c25-18-9-5-16(6-10-18)15-30(24(32)21-13-14-27-29-21)22(17-7-11-19(26)12-8-17)23(31)28-20-3-1-2-4-20/h5-14,20,22H,1-4,15H2,(H,27,29)(H,28,31)	DCJCSWSWGMNFNW-UHFFFAOYSA-N	438.186732448							105476
AP-124/43238112	LSM-16840	SID4264232, BRD-K07479718	2236013	InChI=1S/C18H19NO2/c20-18(19-13-5-2-6-14-19)21-17-11-9-16(10-12-17)15-7-3-1-4-8-15/h1,3-4,7-12H,2,5-6,13-14H2	WSDRGWSHRBCGBE-UHFFFAOYSA-N	O=C(Oc1ccc(cc1)c2ccccc2)N3CCCCC3	BroadT	BRD-K07479718	BRD-K07479718-001-05-6	ChemBridge Corporation	7976495			O=C(Oc1ccc(cc1)-c1ccccc1)N1CCCCC1	InChI=1S/C18H19NO2/c20-18(19-13-5-2-6-14-19)21-17-11-9-16(10-12-17)15-7-3-1-4-8-15/h1,3-4,7-12H,2,5-6,13-14H2	WSDRGWSHRBCGBE-UHFFFAOYSA-N	281.141578858							105477
MLS000527080	LSM-16841	SID17388247, BRD-K18786195	1166507	InChI=1S/C18H18N4O2/c1-11-5-3-4-6-15(11)21-17(23)10-22-12(2)20-16-8-7-13(19)9-14(16)18(22)24/h3-9H,10,19H2,1-2H3,(H,21,23)	FKCVALYNIHGNRH-UHFFFAOYSA-N	CC1=Nc2ccc(N)cc2C(=O)N1CC(=O)Nc3ccccc3C	BroadT	BRD-K18786195	BRD-K18786195-001-05-3	Asinex Ltd.	ASN 04359420			Cc1ccccc1NC(=O)Cn1c(C)nc2ccc(N)cc2c1=O	InChI=1S/C18H18N4O2/c1-11-5-3-4-6-15(11)21-17(23)10-22-12(2)20-16-8-7-13(19)9-14(16)18(22)24/h3-9H,10,19H2,1-2H3,(H,21,23)	FKCVALYNIHGNRH-UHFFFAOYSA-N	322.142975856							105478
AC1LZFNV	LSM-43669	SID14741386, BRD-K87608205	1949546	InChI=1S/C10H14N2O2S2/c1-2-12-9(13)8(16-10(12)15)7-11-3-5-14-6-4-11/h7H,2-6H2,1H3/b8-7+	FAOQYIPMIGOMHW-BQYQJAHWSA-N	CCN1C(=S)S\C(=C\N2CCOCC2)\C1=O	BroadT	BRD-K87608205	BRD-K87608205-001-05-3	InterBioScreen Ltd.	STOCK4S-01346			CCN1C(=S)S\C(C1=O)=C\N1CCOCC1	InChI=1S/C10H14N2O2S2/c1-2-12-9(13)8(16-10(12)15)7-11-3-5-14-6-4-11/h7H,2-6H2,1H3/b8-7+	FAOQYIPMIGOMHW-BQYQJAHWSA-N	258.049669088							
AN-652/41314001	LSM-16843	SID24782020, BRD-K54394702	836507	InChI=1S/C15H16N2O/c18-15(17-14-10-4-5-12-16-14)11-6-9-13-7-2-1-3-8-13/h1-5,7-8,10,12H,6,9,11H2,(H,16,17,18)	BNDUSXZNAHWOMA-UHFFFAOYSA-N	O=C(CCCc1ccccc1)Nc2ccccn2	BroadT	BRD-K54394702	BRD-K54394702-001-06-5	Specs	AN-652/41314001			O=C(CCCc1ccccc1)Nc1ccccn1	InChI=1S/C15H16N2O/c18-15(17-14-10-4-5-12-16-14)11-6-9-13-7-2-1-3-8-13/h1-5,7-8,10,12H,6,9,11H2,(H,16,17,18)	BNDUSXZNAHWOMA-UHFFFAOYSA-N	240.126263152							105480
BRD-K91850687	LSM-14983		44491487	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21-,25-/m1/s1	ULMVXXWMSACXHE-QTDDQOEGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K91850687	BRD-K91850687-001-01-1	Broad Institute of MIT and Harvard	BRD-K91850687			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21-,25-/m1/s1	ULMVXXWMSACXHE-QTDDQOEGSA-N	565.293404836							103639
BRD-K03725349	LSM-14689		44490429	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22+,26+/m1/s1	WCMOVSVGEGOMDB-CQAGSAPUSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K03725349	BRD-K03725349-001-01-2	Broad Institute of MIT and Harvard	BRD-K03725349			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22+,26+/m1/s1	WCMOVSVGEGOMDB-CQAGSAPUSA-N	616.344769864							103345
BRD-K89554882	LSM-14972		44490452	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24-,25-,29+/m1/s1	AIBBTECRVWULHH-IKOOFXLXSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCCN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K89554882	BRD-K89554882-001-01-6	Broad Institute of MIT and Harvard	BRD-K89554882			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCCN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24-,25-,29+/m1/s1	AIBBTECRVWULHH-IKOOFXLXSA-N	605.41523453							103628
BRD-K79112806	LSM-14936		54615000	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23-,27+/m0/s1	HPPNONYMLIWSNI-NBCVKUGOSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K79112806	BRD-K79112806-001-01-8	Broad Institute of MIT and Harvard	BRD-K79112806			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23-,27+/m0/s1	HPPNONYMLIWSNI-NBCVKUGOSA-N	577.383934402							103592
BRD-K22261046	LSM-14758		44618164	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22-,23-,27+/m0/s1	HPPNONYMLIWSNI-RNLGNXJRSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K22261046	BRD-K22261046-001-01-1	Broad Institute of MIT and Harvard	BRD-K22261046			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22-,23-,27+/m0/s1	HPPNONYMLIWSNI-RNLGNXJRSA-N	577.383934402							103414
BRD-K27597389	LSM-14778		44495992	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25-,26+,31-/m1/s1	JEEWDARUSPNTGW-ZGQJUUMOSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K27597389	BRD-K27597389-001-01-8	Broad Institute of MIT and Harvard	BRD-K27597389			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25-,26+,31-/m1/s1	JEEWDARUSPNTGW-ZGQJUUMOSA-N	610.37303536							103434
BRD-K47394228	LSM-14841		44487592	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24-,25-,29+/m1/s1	SUHZFPHQAJGSMY-IKOOFXLXSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K47394228	BRD-K47394228-001-01-1	Broad Institute of MIT and Harvard	BRD-K47394228			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24-,25-,29+/m1/s1	SUHZFPHQAJGSMY-IKOOFXLXSA-N	605.41523453							103497
BRD-K21152218	LSM-14752		44484568	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23-,24+,29-/m0/s1	TYGOPRMPKRHVEQ-OODISRMCSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K21152218	BRD-K21152218-001-01-5	Broad Institute of MIT and Harvard	BRD-K21152218			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23-,24+,29-/m0/s1	TYGOPRMPKRHVEQ-OODISRMCSA-N	597.352634274							103408
BRD-K51413232	LSM-14851		44495482	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25-,26+,31+/m0/s1	JEEWDARUSPNTGW-PZTYDPALSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K51413232	BRD-K51413232-001-01-6	Broad Institute of MIT and Harvard	BRD-K51413232			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25-,26+,31+/m0/s1	JEEWDARUSPNTGW-PZTYDPALSA-N	610.37303536							103507
BRD-K17741643	LSM-14742		44620064	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25-,30+/m0/s1	YBLKRDGTGIUFGT-YDXRHMNESA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K17741643	BRD-K17741643-001-01-6	Broad Institute of MIT and Harvard	BRD-K17741643			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25-,30+/m0/s1	YBLKRDGTGIUFGT-YDXRHMNESA-N	583.373369718							103398
BRD-K48243375	LSM-14845		44498598	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30-/m1/s1	JZEVKSWSVNZKOH-FJRSXGRASA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K48243375	BRD-K48243375-001-01-0	Broad Institute of MIT and Harvard	BRD-K48243375			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30-/m1/s1	JZEVKSWSVNZKOH-FJRSXGRASA-N	596.357385296							103501
BRD-K58284322	LSM-14872		44493119	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32-/m0/s1	ZCWFLIQXFDCFQH-GMKFGHRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K58284322	BRD-K58284322-001-01-5	Broad Institute of MIT and Harvard	BRD-K58284322			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32-/m0/s1	ZCWFLIQXFDCFQH-GMKFGHRTSA-N	603.34206959							103528
BRD-K31042955	LSM-14788		44494121	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20+,24-/m1/s1	DGSOXKKLHVIDDH-KCOOYEKVSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K31042955	BRD-K31042955-001-01-3	Broad Institute of MIT and Harvard	BRD-K31042955			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20+,24-/m1/s1	DGSOXKKLHVIDDH-KCOOYEKVSA-N	492.331170548							103444
BRD-K77983109	LSM-14933		44490239	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26+,31+/m0/s1	IEZOTXDZAGKSTL-BCVXLEMTSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K77983109	BRD-K77983109-001-01-8	Broad Institute of MIT and Harvard	BRD-K77983109			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26+,31+/m0/s1	IEZOTXDZAGKSTL-BCVXLEMTSA-N	610.37303536							103589
BRD-K19534956	LSM-14746		44490364	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21+,25+/m1/s1	YWYDVFGOYOJBGO-VWEIPLKFSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K19534956	BRD-K19534956-001-01-4	Broad Institute of MIT and Harvard	BRD-K19534956			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21+,25+/m1/s1	YWYDVFGOYOJBGO-VWEIPLKFSA-N	506.346820612							103402
BRD-K23370299	LSM-14763		44489316	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22+,26-/m0/s1	KNZOATPLJIEOET-IFOBJOEFSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K23370299	BRD-K23370299-001-01-3	Broad Institute of MIT and Harvard	BRD-K23370299			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22+,26-/m0/s1	KNZOATPLJIEOET-IFOBJOEFSA-N	520.362470676							103419
BRD-K54323133	LSM-14861		44487397	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25+,29+/m0/s1	SUHZFPHQAJGSMY-GYKHTSFTSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K54323133	BRD-K54323133-001-01-4	Broad Institute of MIT and Harvard	BRD-K54323133			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25+,29+/m0/s1	SUHZFPHQAJGSMY-GYKHTSFTSA-N	605.41523453							103517
BRD-K95891443	LSM-15000		44484579	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25+,30-/m0/s1	GBDHSNMZLIRBLK-INVAMZEASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K95891443	BRD-K95891443-001-01-6	Broad Institute of MIT and Harvard	BRD-K95891443			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25+,30-/m0/s1	GBDHSNMZLIRBLK-INVAMZEASA-N	611.368284338							103656
BRD-K05415698	LSM-14693		44492088	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21+,25-/m1/s1	ULMVXXWMSACXHE-NAZDKBRTSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K05415698	BRD-K05415698-001-01-5	Broad Institute of MIT and Harvard	BRD-K05415698			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21+,25-/m1/s1	ULMVXXWMSACXHE-NAZDKBRTSA-N	565.293404836							103349
CHEMBL3187597	LSM-14769	BRD-K24991044	44500869	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25+,26+,31-/m0/s1	YZTWEKNKNNRJIX-PXFJVXAFSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K24991044	BRD-K24991044-001-01-3	Broad Institute of MIT and Harvard	BRD-K24991044			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25+,26+,31-/m0/s1	YZTWEKNKNNRJIX-PXFJVXAFSA-N	603.334207008							103425
BRD-K21827358	LSM-14756		44485773	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30-/m1/s1	GBDHSNMZLIRBLK-FJRSXGRASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K21827358	BRD-K21827358-001-01-2	Broad Institute of MIT and Harvard	BRD-K21827358			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30-/m1/s1	GBDHSNMZLIRBLK-FJRSXGRASA-N	611.368284338							103412
BRD-K10482608	LSM-14719		44616894	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30+/m1/s1	JZEVKSWSVNZKOH-DUXAABNJSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K10482608	BRD-K10482608-001-01-7	Broad Institute of MIT and Harvard	BRD-K10482608			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30+/m1/s1	JZEVKSWSVNZKOH-DUXAABNJSA-N	596.357385296							103375
BRD-K40301427	LSM-14812		44489870	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33+/m1/s1	LMYACBAJSFEPOG-CYNXIGLJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K40301427	BRD-K40301427-001-01-2	Broad Institute of MIT and Harvard	BRD-K40301427			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33+/m1/s1	LMYACBAJSFEPOG-CYNXIGLJSA-N	617.357719654							103468
BRD-K63828515	LSM-14887		44488739	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23-,24-,29-/m0/s1	TYGOPRMPKRHVEQ-UITIVDIESA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K63828515	BRD-K63828515-001-01-9	Broad Institute of MIT and Harvard	BRD-K63828515			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23-,24-,29-/m0/s1	TYGOPRMPKRHVEQ-UITIVDIESA-N	597.352634274							103543
BRD-K27622534	LSM-14779		44490229	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21+,25+/m0/s1	ULMVXXWMSACXHE-UWHHFBIGSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K27622534	BRD-K27622534-001-01-8	Broad Institute of MIT and Harvard	BRD-K27622534			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21+,25+/m0/s1	ULMVXXWMSACXHE-UWHHFBIGSA-N	565.293404836							103435
BRD-K31830662	LSM-14792		44492109	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24-,25-,29-/m1/s1	AIBBTECRVWULHH-DOUCHOMGSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K31830662	BRD-K31830662-001-01-5	Broad Institute of MIT and Harvard	BRD-K31830662			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24-,25-,29-/m1/s1	AIBBTECRVWULHH-DOUCHOMGSA-N	605.41523453							103448
BRD-K89344180	LSM-14969		44496867	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30-/m0/s1	JZEVKSWSVNZKOH-XZSZPMDUSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K89344180	BRD-K89344180-001-01-1	Broad Institute of MIT and Harvard	BRD-K89344180			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30-/m0/s1	JZEVKSWSVNZKOH-XZSZPMDUSA-N	596.357385296							103625
MLS003128748	LSM-10166	BRD-K28649955, SID121282577	44490250	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22+,26+/m0/s1	KNZOATPLJIEOET-AVJFOWIRSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K28649955	BRD-K28649955-001-02-8	Broad Institute of MIT and Harvard	BRD-K28649955			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22+,26+/m0/s1	KNZOATPLJIEOET-AVJFOWIRSA-N	520.362470676							98787
BRD-K42454450	LSM-14826		44617880	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25+,30-/m1/s1	STZYNHZFNFWBAK-ZASNTINBSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K42454450	BRD-K42454450-001-01-7	Broad Institute of MIT and Harvard	BRD-K42454450			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25+,30-/m1/s1	STZYNHZFNFWBAK-ZASNTINBSA-N	617.41523453							103482
BRD-K09824708	LSM-14715		44492090	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25-,26+,31-/m1/s1	IEZOTXDZAGKSTL-ZGQJUUMOSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K09824708	BRD-K09824708-001-01-2	Broad Institute of MIT and Harvard	BRD-K09824708			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25-,26+,31-/m1/s1	IEZOTXDZAGKSTL-ZGQJUUMOSA-N	610.37303536							103371
BRD-K48775333	LSM-14846		44490457	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22-,26+/m1/s1	WCMOVSVGEGOMDB-BILGYAHESA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K48775333	BRD-K48775333-001-01-2	Broad Institute of MIT and Harvard	BRD-K48775333			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22-,26+/m1/s1	WCMOVSVGEGOMDB-BILGYAHESA-N	616.344769864							103502
BRD-K06187854	LSM-14699		44490265	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21+,25-/m0/s1	ULMVXXWMSACXHE-SMTRIPRVSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K06187854	BRD-K06187854-001-01-9	Broad Institute of MIT and Harvard	BRD-K06187854			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21+,25-/m0/s1	ULMVXXWMSACXHE-SMTRIPRVSA-N	565.293404836							103355
BRD-K05886700	LSM-14696		44490891	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22-,26+/m0/s1	WCMOVSVGEGOMDB-OYSWMMLKSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K05886700	BRD-K05886700-001-01-3	Broad Institute of MIT and Harvard	BRD-K05886700			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22-,26+/m0/s1	WCMOVSVGEGOMDB-OYSWMMLKSA-N	616.344769864							103352
BRD-K10008415	LSM-14716		54614983	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25-,26-,31-/m1/s1	YZTWEKNKNNRJIX-YSRRZRNESA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K10008415	BRD-K10008415-001-01-3	Broad Institute of MIT and Harvard	BRD-K10008415			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25-,26-,31-/m1/s1	YZTWEKNKNNRJIX-YSRRZRNESA-N	603.334207008							103372
BRD-K40829514	LSM-14816		44490349	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21-,25+/m0/s1	YWYDVFGOYOJBGO-UGCAPWQASA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K40829514	BRD-K40829514-001-01-6	Broad Institute of MIT and Harvard	BRD-K40829514			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21-,25+/m0/s1	YWYDVFGOYOJBGO-UGCAPWQASA-N	506.346820612							103472
BRD-K66866904	LSM-14899		44494948	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25-,30-/m0/s1	YBLKRDGTGIUFGT-XZSZPMDUSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K66866904	BRD-K66866904-001-01-5	Broad Institute of MIT and Harvard	BRD-K66866904			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25-,30-/m0/s1	YBLKRDGTGIUFGT-XZSZPMDUSA-N	583.373369718							103555
BRD-K38571337	LSM-14806		44490916	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22-,26+/m0/s1	WCMOVSVGEGOMDB-IMIIHFCZSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K38571337	BRD-K38571337-001-01-3	Broad Institute of MIT and Harvard	BRD-K38571337			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22-,26+/m0/s1	WCMOVSVGEGOMDB-IMIIHFCZSA-N	616.344769864							103462
BRD-K60391804	LSM-14878		44495028	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26+,31+/m1/s1	JEEWDARUSPNTGW-OLHJXYGRSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K60391804	BRD-K60391804-001-01-1	Broad Institute of MIT and Harvard	BRD-K60391804			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26+,31+/m1/s1	JEEWDARUSPNTGW-OLHJXYGRSA-N	610.37303536							103534
BRD-K68325161	LSM-14905		54614979	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22-,23+,27-/m1/s1	HPPNONYMLIWSNI-IQXSCUCBSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K68325161	BRD-K68325161-001-01-8	Broad Institute of MIT and Harvard	BRD-K68325161			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22-,23+,27-/m1/s1	HPPNONYMLIWSNI-IQXSCUCBSA-N	577.383934402							103561
BRD-K84109969	LSM-14954		44491494	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24-,25-,29+/m0/s1	AIBBTECRVWULHH-VVEDBRRQSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K84109969	BRD-K84109969-001-01-0	Broad Institute of MIT and Harvard	BRD-K84109969			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24-,25-,29+/m0/s1	AIBBTECRVWULHH-VVEDBRRQSA-N	605.41523453							103610
BRD-K92884627	LSM-14986		44619940	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30+/m0/s1	STZYNHZFNFWBAK-YDXRHMNESA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K92884627	BRD-K92884627-001-01-2	Broad Institute of MIT and Harvard	BRD-K92884627			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30+/m0/s1	STZYNHZFNFWBAK-YDXRHMNESA-N	617.41523453							103642
BRD-K21387011	LSM-14753		44496450	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22-,26-/m0/s1	NPRRWKGRZALGNG-MSZDEVHKSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K21387011	BRD-K21387011-001-01-6	Broad Institute of MIT and Harvard	BRD-K21387011			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22-,26-/m0/s1	NPRRWKGRZALGNG-MSZDEVHKSA-N	616.344769864							103409
BRD-K47611269	LSM-14843		44490912	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21-,25+/m0/s1	ULMVXXWMSACXHE-UGCAPWQASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K47611269	BRD-K47611269-001-01-8	Broad Institute of MIT and Harvard	BRD-K47611269			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21-,25+/m0/s1	ULMVXXWMSACXHE-UGCAPWQASA-N	565.293404836							103499
BRD-K23060602	LSM-14762		44498581	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25+,26-,31-/m0/s1	YZTWEKNKNNRJIX-XZSHTLEFSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K23060602	BRD-K23060602-001-01-2	Broad Institute of MIT and Harvard	BRD-K23060602			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25+,26-,31-/m0/s1	YZTWEKNKNNRJIX-XZSHTLEFSA-N	603.334207008							103418
BRD-K78099132	LSM-14935		44491477	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20-,21+,25-/m1/s1	YWYDVFGOYOJBGO-NAZDKBRTSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K78099132	BRD-K78099132-001-01-3	Broad Institute of MIT and Harvard	BRD-K78099132			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20-,21+,25-/m1/s1	YWYDVFGOYOJBGO-NAZDKBRTSA-N	506.346820612							103591
BRD-K67303249-001-01-2	LSM-16844	BRD-K67303249	54615007	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25-,30-/m1/s1	YBLKRDGTGIUFGT-SFOWLQBLSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K67303249	BRD-K67303249-001-01-2	Broad Institute of MIT and Harvard	BRD-K67303249			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25-,30-/m1/s1	YBLKRDGTGIUFGT-SFOWLQBLSA-N	583.373369718							105481
BRD-K82161520	LSM-14947		44498639	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33+/m0/s1	ZQNJSJYLLBSSCW-SQQWPVGBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K82161520	BRD-K82161520-001-01-5	Broad Institute of MIT and Harvard	BRD-K82161520			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33+/m0/s1	ZQNJSJYLLBSSCW-SQQWPVGBSA-N	615.33083619							103603
BRD-K07060092	LSM-14705		44616639	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29+/m1/s1	IVNRRFOIDKKMKL-MBWUYLOXSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K07060092	BRD-K07060092-001-01-9	Broad Institute of MIT and Harvard	BRD-K07060092			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29+/m1/s1	IVNRRFOIDKKMKL-MBWUYLOXSA-N	591.2978215							103361
BRD-K88616704	LSM-14966		44490406	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22-,26+/m1/s1	WCMOVSVGEGOMDB-SRCYTUNASA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K88616704	BRD-K88616704-001-01-0	Broad Institute of MIT and Harvard	BRD-K88616704			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22-,26+/m1/s1	WCMOVSVGEGOMDB-SRCYTUNASA-N	616.344769864							103622
BRD-K16561280	LSM-14733		44485087	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23-,24+,29-/m1/s1	TYGOPRMPKRHVEQ-IDCDSMMUSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K16561280	BRD-K16561280-001-01-7	Broad Institute of MIT and Harvard	BRD-K16561280			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23-,24+,29-/m1/s1	TYGOPRMPKRHVEQ-IDCDSMMUSA-N	597.352634274							103389
BRD-K80138901	LSM-14943		54615002	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,29-/m1/s1	IVNRRFOIDKKMKL-KOBSQPAKSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K80138901	BRD-K80138901-001-01-4	Broad Institute of MIT and Harvard	BRD-K80138901			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,29-/m1/s1	IVNRRFOIDKKMKL-KOBSQPAKSA-N	591.2978215							103599
BRD-K08922114	LSM-14714		44496894	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25+,30-/m0/s1	YBLKRDGTGIUFGT-INVAMZEASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K08922114	BRD-K08922114-001-01-3	Broad Institute of MIT and Harvard	BRD-K08922114			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25+,30-/m0/s1	YBLKRDGTGIUFGT-INVAMZEASA-N	583.373369718							103370
BRD-K27411973	LSM-14776		44487588	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30+/m1/s1	GBDHSNMZLIRBLK-GBRARVNLSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K27411973	BRD-K27411973-001-01-4	Broad Institute of MIT and Harvard	BRD-K27411973			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30+/m1/s1	GBDHSNMZLIRBLK-GBRARVNLSA-N	611.368284338							103432
BRD-K54635843	LSM-14863		44618073	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25+,30+/m1/s1	YBLKRDGTGIUFGT-ZRIOWSNCSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K54635843	BRD-K54635843-001-01-2	Broad Institute of MIT and Harvard	BRD-K54635843			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25+,30+/m1/s1	YBLKRDGTGIUFGT-ZRIOWSNCSA-N	583.373369718							103519
BRD-K39271757	LSM-14810		44496012	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19-,20-,24-/m1/s1	DGSOXKKLHVIDDH-DBYOASNMSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K39271757	BRD-K39271757-001-01-0	Broad Institute of MIT and Harvard	BRD-K39271757			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19-,20-,24-/m1/s1	DGSOXKKLHVIDDH-DBYOASNMSA-N	492.331170548							103466
CHEMBL3187591	LSM-14815	BRD-K40708503	44620530	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25-,26+,31-/m0/s1	YZTWEKNKNNRJIX-PDTFHCFTSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K40708503	BRD-K40708503-001-01-5	Broad Institute of MIT and Harvard	BRD-K40708503			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25-,26+,31-/m0/s1	YZTWEKNKNNRJIX-PDTFHCFTSA-N	603.334207008							103471
SA-433965	LSM-14707		49843139	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30+/m1/s1	PLFJTCJSGHSPAZ-ZRIOWSNCSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K07110772	BRD-K07110772-001-01-9	Broad Institute of MIT and Harvard	BRD-K07110772			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30+/m1/s1	PLFJTCJSGHSPAZ-ZRIOWSNCSA-N	602.404335488							103363
BRD-K51388814	LSM-14850		54615005	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25+,26-,31-/m1/s1	YZTWEKNKNNRJIX-FVCFNFBRSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K51388814	BRD-K51388814-001-01-6	Broad Institute of MIT and Harvard	BRD-K51388814			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25+,26-,31-/m1/s1	YZTWEKNKNNRJIX-FVCFNFBRSA-N	603.334207008							103506
BRD-K08325197	LSM-14711		44620073	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22-,26+/m0/s1	NPRRWKGRZALGNG-IMIIHFCZSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K08325197	BRD-K08325197-001-01-9	Broad Institute of MIT and Harvard	BRD-K08325197			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22-,26+/m0/s1	NPRRWKGRZALGNG-IMIIHFCZSA-N	616.344769864							103367
BRD-K79355010	LSM-14940		44493589	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m0/s1	ZCWFLIQXFDCFQH-FBIDWWCOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K79355010	BRD-K79355010-001-01-5	Broad Institute of MIT and Harvard	BRD-K79355010			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m0/s1	ZCWFLIQXFDCFQH-FBIDWWCOSA-N	603.34206959							103596
BRD-K93971021	LSM-14994		54615018	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33+/m0/s1	ZQNJSJYLLBSSCW-LIHQSLCGSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K93971021	BRD-K93971021-001-01-8	Broad Institute of MIT and Harvard	BRD-K93971021			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33+/m0/s1	ZQNJSJYLLBSSCW-LIHQSLCGSA-N	615.33083619							103650
BRD-K81440797	LSM-14945		44488205	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22-,26-/m1/s1	KNZOATPLJIEOET-UXGLMHHASA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K81440797	BRD-K81440797-001-01-0	Broad Institute of MIT and Harvard	BRD-K81440797			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22-,26-/m1/s1	KNZOATPLJIEOET-UXGLMHHASA-N	520.362470676							103601
BRD-K25991572	LSM-14772		44486386	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24+,29-/m1/s1	TYGOPRMPKRHVEQ-CAFXQFFASA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K25991572	BRD-K25991572-001-01-2	Broad Institute of MIT and Harvard	BRD-K25991572			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24+,29-/m1/s1	TYGOPRMPKRHVEQ-CAFXQFFASA-N	597.352634274							103428
BRD-K41649460	LSM-14820		44489878	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33+/m1/s1	LMYACBAJSFEPOG-ZLFFOLKFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K41649460	BRD-K41649460-001-01-1	Broad Institute of MIT and Harvard	BRD-K41649460			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33+/m1/s1	LMYACBAJSFEPOG-ZLFFOLKFSA-N	617.357719654							103476
BRD-K68097207	LSM-14903		44495476	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32+/m0/s1	ZCWFLIQXFDCFQH-PXSDZQOHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K68097207	BRD-K68097207-001-01-9	Broad Institute of MIT and Harvard	BRD-K68097207			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32+/m0/s1	ZCWFLIQXFDCFQH-PXSDZQOHSA-N	603.34206959							103559
SA-434027	LSM-14691		54614984	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30+/m1/s1	PLFJTCJSGHSPAZ-GBRARVNLSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K04592856	BRD-K04592856-001-01-0	Broad Institute of MIT and Harvard	BRD-K04592856			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30+/m1/s1	PLFJTCJSGHSPAZ-GBRARVNLSA-N	602.404335488							103347
BRD-K90329522	LSM-14976		44495492	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19-,20+,24+/m0/s1	DGSOXKKLHVIDDH-PWSZPPJVSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K90329522	BRD-K90329522-001-01-6	Broad Institute of MIT and Harvard	BRD-K90329522			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19-,20+,24+/m0/s1	DGSOXKKLHVIDDH-PWSZPPJVSA-N	492.331170548							103632
BRD-K18293432	LSM-14744		44488184	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22+,26-/m1/s1	KNZOATPLJIEOET-FYBXHKAZSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K18293432	BRD-K18293432-001-01-2	Broad Institute of MIT and Harvard	BRD-K18293432			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22+,26-/m1/s1	KNZOATPLJIEOET-FYBXHKAZSA-N	520.362470676							103400
BRD-K30934390	LSM-14787		44618659	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25-,26+,31-/m1/s1	YZTWEKNKNNRJIX-ZGQJUUMOSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K30934390	BRD-K30934390-001-01-5	Broad Institute of MIT and Harvard	BRD-K30934390			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25-,26+,31-/m1/s1	YZTWEKNKNNRJIX-ZGQJUUMOSA-N	603.334207008							103443
SA-426029	LSM-14722		44488194	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26-,31-/m1/s1	IEZOTXDZAGKSTL-FVCFNFBRSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K11989708	BRD-K11989708-001-01-9	Broad Institute of MIT and Harvard	BRD-K11989708			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26-,31-/m1/s1	IEZOTXDZAGKSTL-FVCFNFBRSA-N	610.37303536							103378
BRD-K07008972	LSM-14702		44489847	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22-,26-/m0/s1	WCMOVSVGEGOMDB-YGWSKSRPSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K07008972	BRD-K07008972-001-01-3	Broad Institute of MIT and Harvard	BRD-K07008972			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22-,26-/m0/s1	WCMOVSVGEGOMDB-YGWSKSRPSA-N	616.344769864							103358
BRD-K10839108	LSM-14720		44487576	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23-,24+,29+/m1/s1	TYGOPRMPKRHVEQ-CHCBTGSZSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K10839108	BRD-K10839108-001-01-3	Broad Institute of MIT and Harvard	BRD-K10839108			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23-,24+,29+/m1/s1	TYGOPRMPKRHVEQ-CHCBTGSZSA-N	597.352634274							103376
BRD-K31315646	LSM-14790		44494947	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30-/m0/s1	PLFJTCJSGHSPAZ-XZSZPMDUSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K31315646	BRD-K31315646-001-01-8	Broad Institute of MIT and Harvard	BRD-K31315646			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30-/m0/s1	PLFJTCJSGHSPAZ-XZSZPMDUSA-N	602.404335488							103446
CHEMBL2357096	LSM-14951	BRD-K82777549, SID85798758	44492080	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21-,25-/m1/s1	ULMVXXWMSACXHE-FBROZUCGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K82777549	BRD-K82777549-001-01-5	Broad Institute of MIT and Harvard	BRD-K82777549			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21-,25-/m1/s1	ULMVXXWMSACXHE-FBROZUCGSA-N	565.293404836							103607
BRD-K26258603	LSM-14774		44495000	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26-,31+/m0/s1	JEEWDARUSPNTGW-GURVGDRESA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K26258603	BRD-K26258603-001-01-8	Broad Institute of MIT and Harvard	BRD-K26258603			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26-,31+/m0/s1	JEEWDARUSPNTGW-GURVGDRESA-N	610.37303536							103430
BRD-K03050720	LSM-14685		54615013	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22-,23-,27-/m1/s1	HPPNONYMLIWSNI-DVAKJLRASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K03050720	BRD-K03050720-001-01-4	Broad Institute of MIT and Harvard	BRD-K03050720			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22-,23-,27-/m1/s1	HPPNONYMLIWSNI-DVAKJLRASA-N	577.383934402							103341
BRD-K16993590	LSM-14738		44494580	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32+/m1/s1	ZCWFLIQXFDCFQH-XPZOENDESA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K16993590	BRD-K16993590-001-01-7	Broad Institute of MIT and Harvard	BRD-K16993590			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32+/m1/s1	ZCWFLIQXFDCFQH-XPZOENDESA-N	603.34206959							103394
BRD-K00643888	LSM-14676		44496898	InChI=1S/C29H50N4O5/c1-8-14-32(7)18-27-21(4)17-33(22(5)19-34)28(35)25-16-24(31-29(36)30-20(2)3)12-13-26(25)38-23(6)11-9-10-15-37-27/h12-13,16,20-23,27,34H,8-11,14-15,17-19H2,1-7H3,(H2,30,31,36)/t21-,22-,23+,27-/m0/s1	OXLKGXSDHBDOHC-TZKYFUQOSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K00643888	BRD-K00643888-001-01-7	Broad Institute of MIT and Harvard	BRD-K00643888			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H50N4O5/c1-8-14-32(7)18-27-21(4)17-33(22(5)19-34)28(35)25-16-24(31-29(36)30-20(2)3)12-13-26(25)38-23(6)11-9-10-15-37-27/h12-13,16,20-23,27,34H,8-11,14-15,17-19H2,1-7H3,(H2,30,31,36)/t21-,22-,23+,27-/m0/s1	OXLKGXSDHBDOHC-TZKYFUQOSA-N	534.37812074							103332
BRD-K28667054	LSM-14781		44490899	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22-,26+/m0/s1	KNZOATPLJIEOET-OYSWMMLKSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K28667054	BRD-K28667054-001-01-2	Broad Institute of MIT and Harvard	BRD-K28667054			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22-,26+/m0/s1	KNZOATPLJIEOET-OYSWMMLKSA-N	520.362470676							103437
BRD-K08891029	LSM-14713		44495003	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20-,24+/m0/s1	DGSOXKKLHVIDDH-CMCWBKRRSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K08891029	BRD-K08891029-001-01-4	Broad Institute of MIT and Harvard	BRD-K08891029			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20-,24+/m0/s1	DGSOXKKLHVIDDH-CMCWBKRRSA-N	492.331170548							103369
BRD-K20192397	LSM-14749		44490468	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20-,21-,25+/m1/s1	YWYDVFGOYOJBGO-YCFYUYSTSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K20192397	BRD-K20192397-001-01-5	Broad Institute of MIT and Harvard	BRD-K20192397			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20-,21-,25+/m1/s1	YWYDVFGOYOJBGO-YCFYUYSTSA-N	506.346820612							103405
BRD-K93994036	LSM-14995		44495995	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32-/m1/s1	ZCWFLIQXFDCFQH-UOJGMACNSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K93994036	BRD-K93994036-001-01-3	Broad Institute of MIT and Harvard	BRD-K93994036			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32-/m1/s1	ZCWFLIQXFDCFQH-UOJGMACNSA-N	603.34206959							103651
BRD-K52827598	LSM-14857		44495977	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21+,25-/m1/s1	ULMVXXWMSACXHE-IZZGNVEXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K52827598	BRD-K52827598-001-01-4	Broad Institute of MIT and Harvard	BRD-K52827598			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21+,25-/m1/s1	ULMVXXWMSACXHE-IZZGNVEXSA-N	565.293404836							103513
BRD-K47539505	LSM-14842		44489845	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21-,25-/m0/s1	ULMVXXWMSACXHE-UKDJSQQHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K47539505	BRD-K47539505-001-01-5	Broad Institute of MIT and Harvard	BRD-K47539505			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21-,25-/m0/s1	ULMVXXWMSACXHE-UKDJSQQHSA-N	565.293404836							103498
BRD-K38546320	LSM-14805		44490399	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21-,25+/m1/s1	ULMVXXWMSACXHE-QDMVCWPOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K38546320	BRD-K38546320-001-01-4	Broad Institute of MIT and Harvard	BRD-K38546320			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21-,25+/m1/s1	ULMVXXWMSACXHE-QDMVCWPOSA-N	565.293404836							103461
BRD-K79326278	LSM-14939		44618270	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30-/m1/s1	JZEVKSWSVNZKOH-SFOWLQBLSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K79326278	BRD-K79326278-001-01-3	Broad Institute of MIT and Harvard	BRD-K79326278			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30-/m1/s1	JZEVKSWSVNZKOH-SFOWLQBLSA-N	596.357385296							103595
BRD-K42740486	LSM-14828		44493615	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20-,24-/m1/s1	DGSOXKKLHVIDDH-ZBNTXBBCSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K42740486	BRD-K42740486-001-01-7	Broad Institute of MIT and Harvard	BRD-K42740486			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20-,24-/m1/s1	DGSOXKKLHVIDDH-ZBNTXBBCSA-N	492.331170548							103484
BRD-K37459628	LSM-14802		44619911	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33-/m1/s1	ZQNJSJYLLBSSCW-GLPSKGHJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K37459628	BRD-K37459628-001-01-0	Broad Institute of MIT and Harvard	BRD-K37459628			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33-/m1/s1	ZQNJSJYLLBSSCW-GLPSKGHJSA-N	615.33083619							103458
BRD-K41889859	LSM-14823		54615011	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25+,26+,31-/m1/s1	YZTWEKNKNNRJIX-SQRAXXTESA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K41889859	BRD-K41889859-001-01-2	Broad Institute of MIT and Harvard	BRD-K41889859			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25+,26+,31-/m1/s1	YZTWEKNKNNRJIX-SQRAXXTESA-N	603.334207008							103479
BRD-K14502067	LSM-14728		44490846	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22+,26+/m0/s1	WCMOVSVGEGOMDB-AVJFOWIRSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K14502067	BRD-K14502067-001-01-2	Broad Institute of MIT and Harvard	BRD-K14502067			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22+,26+/m0/s1	WCMOVSVGEGOMDB-AVJFOWIRSA-N	616.344769864							103384
SA-432137	LSM-14980		44491516	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26+,31+/m1/s1	IEZOTXDZAGKSTL-OLHJXYGRSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K90816807	BRD-K90816807-001-01-8	Broad Institute of MIT and Harvard	BRD-K90816807			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26+,31+/m1/s1	IEZOTXDZAGKSTL-OLHJXYGRSA-N	610.37303536							103636
SA-102607	LSM-14734		44490257	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26+,31-/m0/s1	IEZOTXDZAGKSTL-PXFJVXAFSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K16633354	BRD-K16633354-001-01-5	Broad Institute of MIT and Harvard	BRD-K16633354			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26+,31-/m0/s1	IEZOTXDZAGKSTL-PXFJVXAFSA-N	610.37303536							103390
BRD-K40635448	LSM-14814		44494592	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19-,20+,24+/m1/s1	DGSOXKKLHVIDDH-FDGPYGQJSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K40635448	BRD-K40635448-001-01-8	Broad Institute of MIT and Harvard	BRD-K40635448			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19-,20+,24+/m1/s1	DGSOXKKLHVIDDH-FDGPYGQJSA-N	492.331170548							103470
BRD-K27475558	LSM-14777		44489726	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33-/m0/s1	LMYACBAJSFEPOG-QTLXSIBASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K27475558	BRD-K27475558-001-01-2	Broad Institute of MIT and Harvard	BRD-K27475558			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33-/m0/s1	LMYACBAJSFEPOG-QTLXSIBASA-N	617.357719654							103433
BRD-K57901680	LSM-14871		44486389	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33-/m1/s1	LMYACBAJSFEPOG-HYHRRZRMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K57901680	BRD-K57901680-001-01-1	Broad Institute of MIT and Harvard	BRD-K57901680			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33-/m1/s1	LMYACBAJSFEPOG-HYHRRZRMSA-N	617.357719654							103527
BRD-K76047634	LSM-14927		44489897	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33+/m1/s1	LMYACBAJSFEPOG-CDNUTCOBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K76047634	BRD-K76047634-001-01-7	Broad Institute of MIT and Harvard	BRD-K76047634			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33+/m1/s1	LMYACBAJSFEPOG-CDNUTCOBSA-N	617.357719654							103583
BRD-K75090653	LSM-14923		44489329	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21-,25-/m0/s1	ULMVXXWMSACXHE-PDFGSZSQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K75090653	BRD-K75090653-001-01-4	Broad Institute of MIT and Harvard	BRD-K75090653			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21-,25-/m0/s1	ULMVXXWMSACXHE-PDFGSZSQSA-N	565.293404836							103579
BRD-K37977610	LSM-14803		44495037	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32+/m1/s1	ZCWFLIQXFDCFQH-IXTDCBFRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K37977610	BRD-K37977610-001-01-1	Broad Institute of MIT and Harvard	BRD-K37977610			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32+/m1/s1	ZCWFLIQXFDCFQH-IXTDCBFRSA-N	603.34206959							103459
BRD-K79260832	LSM-14938		54614992	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33+/m1/s1	ZQNJSJYLLBSSCW-CDNUTCOBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K79260832	BRD-K79260832-001-01-3	Broad Institute of MIT and Harvard	BRD-K79260832			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33+/m1/s1	ZQNJSJYLLBSSCW-CDNUTCOBSA-N	615.33083619							103594
BRD-K66221011	LSM-14895		44490393	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25-,29+/m1/s1	AIBBTECRVWULHH-ZTVFFDQVSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCCN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K66221011	BRD-K66221011-001-01-3	Broad Institute of MIT and Harvard	BRD-K66221011			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCCN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25-,29+/m1/s1	AIBBTECRVWULHH-ZTVFFDQVSA-N	605.41523453							103551
SA-424827	LSM-14896		54615019	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23-,27-/m0/s1	HPPNONYMLIWSNI-GIRPNKPCSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K66361302	BRD-K66361302-001-01-5	Broad Institute of MIT and Harvard	BRD-K66361302			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23-,27-/m0/s1	HPPNONYMLIWSNI-GIRPNKPCSA-N	577.383934402							103552
BRD-K44638353	LSM-14834		44493625	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25-,30-/m1/s1	YYAGCQUXHYGTOT-FJRSXGRASA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K44638353	BRD-K44638353-001-01-1	Broad Institute of MIT and Harvard	BRD-K44638353			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25-,30-/m1/s1	YYAGCQUXHYGTOT-FJRSXGRASA-N	611.368284338							103490
BRD-K52220918	LSM-14855		54615008	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22-,26+/m0/s1	NPRRWKGRZALGNG-OYSWMMLKSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K52220918	BRD-K52220918-001-01-5	Broad Institute of MIT and Harvard	BRD-K52220918			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22-,26+/m0/s1	NPRRWKGRZALGNG-OYSWMMLKSA-N	616.344769864							103511
CHEMBL2354516	LSM-14832	SID87543989, BRD-K43880650	44620779	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25+,30-/m1/s1	STZYNHZFNFWBAK-UBRKHCEVSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K43880650	BRD-K43880650-001-01-0	Broad Institute of MIT and Harvard	BRD-K43880650			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25+,30-/m1/s1	STZYNHZFNFWBAK-UBRKHCEVSA-N	617.41523453							103488
BRD-K20139170	LSM-14748		54614999	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30+/m0/s1	JZEVKSWSVNZKOH-ZQIPMTRKSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K20139170	BRD-K20139170-001-01-9	Broad Institute of MIT and Harvard	BRD-K20139170			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30+/m0/s1	JZEVKSWSVNZKOH-ZQIPMTRKSA-N	596.357385296							103404
BRD-K68911617	LSM-14906		44619926	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30+/m0/s1	STZYNHZFNFWBAK-DNHJLFCISA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K68911617	BRD-K68911617-001-01-5	Broad Institute of MIT and Harvard	BRD-K68911617			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30+/m0/s1	STZYNHZFNFWBAK-DNHJLFCISA-N	617.41523453							103562
BRD-K14340046	LSM-14726		44490392	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21-,25+/m1/s1	YWYDVFGOYOJBGO-QDMVCWPOSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K14340046	BRD-K14340046-001-01-3	Broad Institute of MIT and Harvard	BRD-K14340046			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21-,25+/m1/s1	YWYDVFGOYOJBGO-QDMVCWPOSA-N	506.346820612							103382
BRD-K98044070	LSM-15008		44618633	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29-/m0/s1	IVNRRFOIDKKMKL-OJNHJINQSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K98044070	BRD-K98044070-001-01-9	Broad Institute of MIT and Harvard	BRD-K98044070			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29-/m0/s1	IVNRRFOIDKKMKL-OJNHJINQSA-N	591.2978215							103664
BRD-K17817744	LSM-14743		44493105	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19-,20-,24-/m0/s1	DGSOXKKLHVIDDH-XHOYROJHSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K17817744	BRD-K17817744-001-01-2	Broad Institute of MIT and Harvard	BRD-K17817744			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19-,20-,24-/m0/s1	DGSOXKKLHVIDDH-XHOYROJHSA-N	492.331170548							103399
BRD-K43609604	LSM-14831		44485777	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24-,29-/m1/s1	TYGOPRMPKRHVEQ-CDLOMYRSSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K43609604	BRD-K43609604-001-01-0	Broad Institute of MIT and Harvard	BRD-K43609604			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24-,29-/m1/s1	TYGOPRMPKRHVEQ-CDLOMYRSSA-N	597.352634274							103487
BRD-K17288883	LSM-14739		54614980	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25-,30+/m1/s1	YBLKRDGTGIUFGT-GBRARVNLSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K17288883	BRD-K17288883-001-01-7	Broad Institute of MIT and Harvard	BRD-K17288883			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25-,30+/m1/s1	YBLKRDGTGIUFGT-GBRARVNLSA-N	583.373369718							103395
BRD-K76266174	LSM-14928		44486986	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24-,29-/m0/s1	TYGOPRMPKRHVEQ-MVPDCNEZSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K76266174	BRD-K76266174-001-01-9	Broad Institute of MIT and Harvard	BRD-K76266174			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24-,29-/m0/s1	TYGOPRMPKRHVEQ-MVPDCNEZSA-N	597.352634274							103584
BRD-K21688686-001-01-1	LSM-16845	BRD-K21688686	44490862	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25+,29-/m0/s1	AIBBTECRVWULHH-RTAAPDIRSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K21688686	BRD-K21688686-001-01-1	Broad Institute of MIT and Harvard	BRD-K21688686			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25+,29-/m0/s1	AIBBTECRVWULHH-RTAAPDIRSA-N	605.41523453							105482
BRD-K17630163	LSM-14741		44617305	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23-,27+/m1/s1	HPPNONYMLIWSNI-IDIXZGLXSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K17630163	BRD-K17630163-001-01-1	Broad Institute of MIT and Harvard	BRD-K17630163			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23-,27+/m1/s1	HPPNONYMLIWSNI-IDIXZGLXSA-N	577.383934402							103397
BRD-K47301880	LSM-14840		44496035	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30+/m1/s1	YYAGCQUXHYGTOT-DUXAABNJSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K47301880	BRD-K47301880-001-01-5	Broad Institute of MIT and Harvard	BRD-K47301880			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30+/m1/s1	YYAGCQUXHYGTOT-DUXAABNJSA-N	611.368284338							103496
BRD-K86621086	LSM-14962		44494594	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25-,26+,31+/m1/s1	JEEWDARUSPNTGW-PCEYSVKOSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K86621086	BRD-K86621086-001-01-0	Broad Institute of MIT and Harvard	BRD-K86621086			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25-,26+,31+/m1/s1	JEEWDARUSPNTGW-PCEYSVKOSA-N	610.37303536							103618
BRD-K01822243	LSM-14680		44493597	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m1/s1	ZCWFLIQXFDCFQH-XDMKPEOCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K01822243	BRD-K01822243-001-01-6	Broad Institute of MIT and Harvard	BRD-K01822243			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m1/s1	ZCWFLIQXFDCFQH-XDMKPEOCSA-N	603.34206959							103336
BRD-K54385541	LSM-14862		44490432	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22+,26+/m1/s1	KNZOATPLJIEOET-CQAGSAPUSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K54385541	BRD-K54385541-001-01-9	Broad Institute of MIT and Harvard	BRD-K54385541			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22+,26+/m1/s1	KNZOATPLJIEOET-CQAGSAPUSA-N	520.362470676							103518
CHEMBL2359873	LSM-14839	BRD-K47295867, SID131409979	54614988	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22-,26-/m1/s1	NPRRWKGRZALGNG-PIXQIBFHSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K47295867	BRD-K47295867-001-01-6	Broad Institute of MIT and Harvard	BRD-K47295867			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22-,26-/m1/s1	NPRRWKGRZALGNG-PIXQIBFHSA-N	616.344769864							103495
BRD-K61606206	LSM-14882		44501786	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25+,30+/m0/s1	STZYNHZFNFWBAK-RZDWVWPCSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K61606206	BRD-K61606206-001-01-5	Broad Institute of MIT and Harvard	BRD-K61606206			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25+,30+/m0/s1	STZYNHZFNFWBAK-RZDWVWPCSA-N	617.41523453							103538
BRD-K59248078	LSM-14873		44485117	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30+/m0/s1	GBDHSNMZLIRBLK-DNHJLFCISA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K59248078	BRD-K59248078-001-01-5	Broad Institute of MIT and Harvard	BRD-K59248078			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30+/m0/s1	GBDHSNMZLIRBLK-DNHJLFCISA-N	611.368284338							103529
BRD-K98624380	LSM-15010		44494414	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m0/s1	ZCWFLIQXFDCFQH-GSDPCRBASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K98624380	BRD-K98624380-001-01-3	Broad Institute of MIT and Harvard	BRD-K98624380			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m0/s1	ZCWFLIQXFDCFQH-GSDPCRBASA-N	603.34206959							103666
BRD-K22854900	LSM-14761		44487478	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30+/m0/s1	GBDHSNMZLIRBLK-YDXRHMNESA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K22854900	BRD-K22854900-001-01-8	Broad Institute of MIT and Harvard	BRD-K22854900			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30+/m0/s1	GBDHSNMZLIRBLK-YDXRHMNESA-N	611.368284338							103417
BRD-K92865756	LSM-14985		44494096	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26-,31-/m0/s1	JEEWDARUSPNTGW-XZSHTLEFSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K92865756	BRD-K92865756-001-01-4	Broad Institute of MIT and Harvard	BRD-K92865756			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26-,31-/m0/s1	JEEWDARUSPNTGW-XZSHTLEFSA-N	610.37303536							103641
BRD-K19764902	LSM-14747		44490887	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21-,25+/m0/s1	ULMVXXWMSACXHE-AIFLQVKLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K19764902	BRD-K19764902-001-01-2	Broad Institute of MIT and Harvard	BRD-K19764902			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21-,25+/m0/s1	ULMVXXWMSACXHE-AIFLQVKLSA-N	565.293404836							103403
BRD-K61855818	LSM-14883		44491506	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26-,31+/m0/s1	IEZOTXDZAGKSTL-GURVGDRESA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K61855818	BRD-K61855818-001-01-8	Broad Institute of MIT and Harvard	BRD-K61855818			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26-,31+/m0/s1	IEZOTXDZAGKSTL-GURVGDRESA-N	610.37303536							103539
BRD-K92455082	LSM-14984		44494446	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20+,24-/m0/s1	DGSOXKKLHVIDDH-SMOZNVCYSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K92455082	BRD-K92455082-001-01-9	Broad Institute of MIT and Harvard	BRD-K92455082			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20+,24-/m0/s1	DGSOXKKLHVIDDH-SMOZNVCYSA-N	492.331170548							103640
BRD-K79131144	LSM-14937		54614991	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33-/m0/s1	ZQNJSJYLLBSSCW-IULAASEQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K79131144	BRD-K79131144-001-01-9	Broad Institute of MIT and Harvard	BRD-K79131144			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33-/m0/s1	ZQNJSJYLLBSSCW-IULAASEQSA-N	615.33083619							103593
BRD-K05967016	LSM-14697		44495451	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32-/m1/s1	ZCWFLIQXFDCFQH-WRZBRUQPSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K05967016	BRD-K05967016-001-01-0	Broad Institute of MIT and Harvard	BRD-K05967016			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32-/m1/s1	ZCWFLIQXFDCFQH-WRZBRUQPSA-N	603.34206959							103353
BRD-K30393343	LSM-14786		44616397	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30+/m1/s1	PLFJTCJSGHSPAZ-ZXPXOXBPSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K30393343	BRD-K30393343-001-01-2	Broad Institute of MIT and Harvard	BRD-K30393343			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30+/m1/s1	PLFJTCJSGHSPAZ-ZXPXOXBPSA-N	602.404335488							103442
BRD-K76859558	LSM-14931		54615010	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29-/m1/s1	IVNRRFOIDKKMKL-CPVANYHMSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K76859558	BRD-K76859558-001-01-7	Broad Institute of MIT and Harvard	BRD-K76859558			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29-/m1/s1	IVNRRFOIDKKMKL-CPVANYHMSA-N	591.2978215							103587
BRD-K67069164	LSM-14900		44494521	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22+,26-/m0/s1	NPRRWKGRZALGNG-IFOBJOEFSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K67069164	BRD-K67069164-001-01-0	Broad Institute of MIT and Harvard	BRD-K67069164			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22+,26-/m0/s1	NPRRWKGRZALGNG-IFOBJOEFSA-N	616.344769864							103556
BRD-K49751344	LSM-14849		49843380	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25+,26+,31+/m1/s1	YZTWEKNKNNRJIX-OLHJXYGRSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K49751344	BRD-K49751344-001-01-9	Broad Institute of MIT and Harvard	BRD-K49751344			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25+,26+,31+/m1/s1	YZTWEKNKNNRJIX-OLHJXYGRSA-N	603.334207008							103505
BRD-K17565092	LSM-14740		44489904	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23-,24-,29+/m1/s1	TYGOPRMPKRHVEQ-XTGAJNFRSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K17565092	BRD-K17565092-001-01-5	Broad Institute of MIT and Harvard	BRD-K17565092			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23-,24-,29+/m1/s1	TYGOPRMPKRHVEQ-XTGAJNFRSA-N	597.352634274							103396
BRD-K89675250	LSM-14973		44489335	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25-,29-/m0/s1	AIBBTECRVWULHH-JLMYGFKKSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K89675250	BRD-K89675250-001-01-3	Broad Institute of MIT and Harvard	BRD-K89675250			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25-,29-/m0/s1	AIBBTECRVWULHH-JLMYGFKKSA-N	605.41523453							103629
BRD-K78009480	LSM-14934		44483933	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20-,21+,25-/m0/s1	YWYDVFGOYOJBGO-HULNYRCFSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K78009480	BRD-K78009480-001-01-0	Broad Institute of MIT and Harvard	BRD-K78009480			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20-,21+,25-/m0/s1	YWYDVFGOYOJBGO-HULNYRCFSA-N	506.346820612							103590
BRD-K41862560	LSM-14822		44494417	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26+,31-/m0/s1	JEEWDARUSPNTGW-PXFJVXAFSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K41862560	BRD-K41862560-001-01-9	Broad Institute of MIT and Harvard	BRD-K41862560			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26+,31-/m0/s1	JEEWDARUSPNTGW-PXFJVXAFSA-N	610.37303536							103478
BRD-K41520544	LSM-14819		44494602	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32+/m1/s1	ZCWFLIQXFDCFQH-ZYMMPZCLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K41520544	BRD-K41520544-001-01-4	Broad Institute of MIT and Harvard	BRD-K41520544			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32+/m1/s1	ZCWFLIQXFDCFQH-ZYMMPZCLSA-N	603.34206959							103475
BRD-K10323659	LSM-14718		44494915	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30-/m0/s1	YYAGCQUXHYGTOT-RPQPUBLWSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K10323659	BRD-K10323659-001-01-1	Broad Institute of MIT and Harvard	BRD-K10323659			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30-/m0/s1	YYAGCQUXHYGTOT-RPQPUBLWSA-N	611.368284338							103374
BRD-K18337230	LSM-14745		44492103	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22-,26-/m1/s1	WCMOVSVGEGOMDB-PIXQIBFHSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K18337230	BRD-K18337230-001-01-1	Broad Institute of MIT and Harvard	BRD-K18337230			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22-,26-/m1/s1	WCMOVSVGEGOMDB-PIXQIBFHSA-N	616.344769864							103401
BRD-K73517272	LSM-14916		54615006	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22+,26-/m1/s1	NPRRWKGRZALGNG-ZUVQJFRASA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K73517272	BRD-K73517272-001-01-9	Broad Institute of MIT and Harvard	BRD-K73517272			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22+,26-/m1/s1	NPRRWKGRZALGNG-ZUVQJFRASA-N	616.344769864							103572
BRD-K16173196	LSM-14731		44617289	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33+/m1/s1	ZQNJSJYLLBSSCW-XJVVAVADSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K16173196	BRD-K16173196-001-01-4	Broad Institute of MIT and Harvard	BRD-K16173196			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33+/m1/s1	ZQNJSJYLLBSSCW-XJVVAVADSA-N	615.33083619							103387
BRD-K60272788	LSM-14877		44490460	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21-,25+/m1/s1	ULMVXXWMSACXHE-YCFYUYSTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K60272788	BRD-K60272788-001-01-3	Broad Institute of MIT and Harvard	BRD-K60272788			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21-,25+/m1/s1	ULMVXXWMSACXHE-YCFYUYSTSA-N	565.293404836							103533
BRD-K64247367	LSM-14888		44490884	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22-,26-/m1/s1	KNZOATPLJIEOET-PIXQIBFHSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K64247367	BRD-K64247367-001-01-0	Broad Institute of MIT and Harvard	BRD-K64247367			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22-,26-/m1/s1	KNZOATPLJIEOET-PIXQIBFHSA-N	520.362470676							103544
BRD-K67787765	LSM-14901		44619149	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30-/m1/s1	PLFJTCJSGHSPAZ-FJRSXGRASA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K67787765	BRD-K67787765-001-01-0	Broad Institute of MIT and Harvard	BRD-K67787765			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30-/m1/s1	PLFJTCJSGHSPAZ-FJRSXGRASA-N	602.404335488							103557
BRD-K21389281	LSM-14754		44494086	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32-/m0/s1	ZCWFLIQXFDCFQH-ZQIYOYMASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K21389281	BRD-K21389281-001-01-5	Broad Institute of MIT and Harvard	BRD-K21389281			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32-/m0/s1	ZCWFLIQXFDCFQH-ZQIYOYMASA-N	603.34206959							103410
BRD-K10087454	LSM-14717		44490957	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22-,26+/m1/s1	KNZOATPLJIEOET-BILGYAHESA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K10087454	BRD-K10087454-001-01-9	Broad Institute of MIT and Harvard	BRD-K10087454			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22-,26+/m1/s1	KNZOATPLJIEOET-BILGYAHESA-N	520.362470676							103373
MLS003129913	LSM-10708	BRD-K37669227, SID99358406	44502466	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30+/m0/s1	PLFJTCJSGHSPAZ-RZDWVWPCSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K37669227	BRD-K37669227-001-02-7	Broad Institute of MIT and Harvard	BRD-K37669227			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30+/m0/s1	PLFJTCJSGHSPAZ-RZDWVWPCSA-N	602.404335488							99329
BRD-K86728684	LSM-14963		44618166	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33+/m0/s1	ZQNJSJYLLBSSCW-CLFOAKAGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K86728684	BRD-K86728684-001-01-9	Broad Institute of MIT and Harvard	BRD-K86728684			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33+/m0/s1	ZQNJSJYLLBSSCW-CLFOAKAGSA-N	615.33083619							103619
BRD-K75426909	LSM-14924		44489749	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25+,30-/m0/s1	GBDHSNMZLIRBLK-RPQPUBLWSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K75426909	BRD-K75426909-001-01-2	Broad Institute of MIT and Harvard	BRD-K75426909			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25+,30-/m0/s1	GBDHSNMZLIRBLK-RPQPUBLWSA-N	611.368284338							103580
BRD-K67829818	LSM-14902		44503657	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30-/m0/s1	PLFJTCJSGHSPAZ-RPQPUBLWSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K67829818	BRD-K67829818-001-01-7	Broad Institute of MIT and Harvard	BRD-K67829818			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30-/m0/s1	PLFJTCJSGHSPAZ-RPQPUBLWSA-N	602.404335488							103558
BRD-K02314198	LSM-14682		44497303	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29-/m1/s1	IVNRRFOIDKKMKL-LDIMMVFUSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K02314198	BRD-K02314198-001-01-8	Broad Institute of MIT and Harvard	BRD-K02314198			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29-/m1/s1	IVNRRFOIDKKMKL-LDIMMVFUSA-N	591.2978215							103338
BRD-K41763112	LSM-14821		44491470	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22+,26-/m1/s1	KNZOATPLJIEOET-ZUVQJFRASA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K41763112	BRD-K41763112-001-01-2	Broad Institute of MIT and Harvard	BRD-K41763112			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22+,26-/m1/s1	KNZOATPLJIEOET-ZUVQJFRASA-N	520.362470676							103477
BRD-K53220080	LSM-14859		54614990	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25-,30+/m1/s1	YBLKRDGTGIUFGT-ZXPXOXBPSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K53220080	BRD-K53220080-001-01-6	Broad Institute of MIT and Harvard	BRD-K53220080			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25-,30+/m1/s1	YBLKRDGTGIUFGT-ZXPXOXBPSA-N	583.373369718							103515
CHEMBL2357432	LSM-14683	SID85803308, BRD-K02490064	44496446	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25-,30-/m0/s1	YBLKRDGTGIUFGT-SODQHWRNSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K02490064	BRD-K02490064-001-01-7	Broad Institute of MIT and Harvard	BRD-K02490064			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25-,30-/m0/s1	YBLKRDGTGIUFGT-SODQHWRNSA-N	583.373369718							103339
BRD-K20761826	LSM-14750		44490918	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25-,29+/m0/s1	AIBBTECRVWULHH-APSVEGKFSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K20761826	BRD-K20761826-001-01-8	Broad Institute of MIT and Harvard	BRD-K20761826			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25-,29+/m0/s1	AIBBTECRVWULHH-APSVEGKFSA-N	605.41523453							103406
BRD-K64668459	LSM-14889		44484570	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33-/m0/s1	LMYACBAJSFEPOG-IULAASEQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K64668459	BRD-K64668459-001-01-6	Broad Institute of MIT and Harvard	BRD-K64668459			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33-/m0/s1	LMYACBAJSFEPOG-IULAASEQSA-N	617.357719654							103545
BRD-K97961692	LSM-15007		44618620	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22-,23+,27-/m0/s1	HPPNONYMLIWSNI-TZKYFUQOSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K97961692	BRD-K97961692-001-01-3	Broad Institute of MIT and Harvard	BRD-K97961692			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22-,23+,27-/m0/s1	HPPNONYMLIWSNI-TZKYFUQOSA-N	577.383934402							103663
BRD-K43327166	LSM-14830		44620448	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25-,30+/m0/s1	YBLKRDGTGIUFGT-DNHJLFCISA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K43327166	BRD-K43327166-001-01-9	Broad Institute of MIT and Harvard	BRD-K43327166			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25-,30+/m0/s1	YBLKRDGTGIUFGT-DNHJLFCISA-N	583.373369718							103486
BRD-K66185150	LSM-14894		44487401	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25+,29-/m0/s1	SUHZFPHQAJGSMY-RTAAPDIRSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K66185150	BRD-K66185150-001-01-1	Broad Institute of MIT and Harvard	BRD-K66185150			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25+,29-/m0/s1	SUHZFPHQAJGSMY-RTAAPDIRSA-N	605.41523453							103550
BRD-K06314140	LSM-14700		44495074	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19-,20-,24+/m1/s1	DGSOXKKLHVIDDH-FIXDAVPBSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K06314140	BRD-K06314140-001-01-3	Broad Institute of MIT and Harvard	BRD-K06314140			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19-,20-,24+/m1/s1	DGSOXKKLHVIDDH-FIXDAVPBSA-N	492.331170548							103356
BRD-K07039703	LSM-14704		54614995	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33-/m0/s1	ZQNJSJYLLBSSCW-KIAQLKRMSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K07039703	BRD-K07039703-001-01-4	Broad Institute of MIT and Harvard	BRD-K07039703			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33-/m0/s1	ZQNJSJYLLBSSCW-KIAQLKRMSA-N	615.33083619							103360
BRD-K91180076	LSM-14981		44490222	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21+,25+/m0/s1	YWYDVFGOYOJBGO-UWHHFBIGSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K91180076	BRD-K91180076-001-01-2	Broad Institute of MIT and Harvard	BRD-K91180076			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21+,25+/m0/s1	YWYDVFGOYOJBGO-UWHHFBIGSA-N	506.346820612							103637
BRD-K94193354	LSM-14996		44492636	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25-,30-/m0/s1	YYAGCQUXHYGTOT-SODQHWRNSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K94193354	BRD-K94193354-001-01-5	Broad Institute of MIT and Harvard	BRD-K94193354			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25-,30-/m0/s1	YYAGCQUXHYGTOT-SODQHWRNSA-N	611.368284338							103652
BRD-K08198655	LSM-14710		44616823	InChI=1S/C29H50N4O5/c1-8-14-32(7)18-27-21(4)17-33(22(5)19-34)28(35)25-16-24(31-29(36)30-20(2)3)12-13-26(25)38-23(6)11-9-10-15-37-27/h12-13,16,20-23,27,34H,8-11,14-15,17-19H2,1-7H3,(H2,30,31,36)/t21-,22+,23+,27-/m0/s1	OXLKGXSDHBDOHC-MTPWMDRRSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K08198655	BRD-K08198655-001-01-5	Broad Institute of MIT and Harvard	BRD-K08198655			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H50N4O5/c1-8-14-32(7)18-27-21(4)17-33(22(5)19-34)28(35)25-16-24(31-29(36)30-20(2)3)12-13-26(25)38-23(6)11-9-10-15-37-27/h12-13,16,20-23,27,34H,8-11,14-15,17-19H2,1-7H3,(H2,30,31,36)/t21-,22+,23+,27-/m0/s1	OXLKGXSDHBDOHC-MTPWMDRRSA-N	534.37812074							103366
BRD-K28001518	LSM-14780		44489337	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22-,26-/m0/s1	KNZOATPLJIEOET-MSZDEVHKSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K28001518	BRD-K28001518-001-01-4	Broad Institute of MIT and Harvard	BRD-K28001518			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22-,26-/m0/s1	KNZOATPLJIEOET-MSZDEVHKSA-N	520.362470676							103436
BRD-K69747917	LSM-14908		44490348	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22-,26+/m0/s1	KNZOATPLJIEOET-IMIIHFCZSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K69747917	BRD-K69747917-001-01-9	Broad Institute of MIT and Harvard	BRD-K69747917			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22-,26+/m0/s1	KNZOATPLJIEOET-IMIIHFCZSA-N	520.362470676							103564
CHEMBL2357246	LSM-14709	BRD-K08041211, SID93577898	45480087	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22-,26-/m1/s1	NPRRWKGRZALGNG-UXGLMHHASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K08041211	BRD-K08041211-001-01-4	Broad Institute of MIT and Harvard	BRD-K08041211			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22-,26-/m1/s1	NPRRWKGRZALGNG-UXGLMHHASA-N	616.344769864							103365
BRD-K22657795	LSM-14759		44494905	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30+/m0/s1	YYAGCQUXHYGTOT-RZDWVWPCSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K22657795	BRD-K22657795-001-01-3	Broad Institute of MIT and Harvard	BRD-K22657795			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30+/m0/s1	YYAGCQUXHYGTOT-RZDWVWPCSA-N	611.368284338							103415
BRD-K66536842	LSM-14897		44617311	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33+/m1/s1	ZQNJSJYLLBSSCW-ZLFFOLKFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K66536842	BRD-K66536842-001-01-9	Broad Institute of MIT and Harvard	BRD-K66536842			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33+/m1/s1	ZQNJSJYLLBSSCW-ZLFFOLKFSA-N	615.33083619							103553
BRD-K24026396	LSM-14766		44496896	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30-/m0/s1	JZEVKSWSVNZKOH-SODQHWRNSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K24026396	BRD-K24026396-001-01-2	Broad Institute of MIT and Harvard	BRD-K24026396			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30-/m0/s1	JZEVKSWSVNZKOH-SODQHWRNSA-N	596.357385296							103422
BRD-K49164596	LSM-14848		44495470	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25-,26-,31+/m0/s1	JEEWDARUSPNTGW-WJQRCLFPSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K49164596	BRD-K49164596-001-01-0	Broad Institute of MIT and Harvard	BRD-K49164596			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25-,26-,31+/m0/s1	JEEWDARUSPNTGW-WJQRCLFPSA-N	610.37303536							103504
CHEMBL2358936	LSM-14808	BRD-K38965110, SID85797044	44490435	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21+,25+/m1/s1	ULMVXXWMSACXHE-HSGJQSDISA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K38965110	BRD-K38965110-001-01-0	Broad Institute of MIT and Harvard	BRD-K38965110			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21+,25+/m1/s1	ULMVXXWMSACXHE-HSGJQSDISA-N	565.293404836							103464
BRD-K91662172	LSM-14982		44489323	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21+,25-/m0/s1	ULMVXXWMSACXHE-HULNYRCFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K91662172	BRD-K91662172-001-01-2	Broad Institute of MIT and Harvard	BRD-K91662172			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20-,21+,25-/m0/s1	ULMVXXWMSACXHE-HULNYRCFSA-N	565.293404836							103638
BRD-K36177038	LSM-14800		44490936	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26-,31+/m1/s1	IEZOTXDZAGKSTL-ANKKVJNISA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K36177038	BRD-K36177038-001-01-3	Broad Institute of MIT and Harvard	BRD-K36177038			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26-,31+/m1/s1	IEZOTXDZAGKSTL-ANKKVJNISA-N	610.37303536							103456
BRD-K89144439	LSM-14968		44497318	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30+/m0/s1	PLFJTCJSGHSPAZ-DNHJLFCISA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K89144439	BRD-K89144439-001-01-4	Broad Institute of MIT and Harvard	BRD-K89144439			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30+/m0/s1	PLFJTCJSGHSPAZ-DNHJLFCISA-N	602.404335488							103624
BRD-K06145650	LSM-14698		44495514	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25-,30+/m1/s1	YYAGCQUXHYGTOT-ZXPXOXBPSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K06145650	BRD-K06145650-001-01-3	Broad Institute of MIT and Harvard	BRD-K06145650			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25-,30+/m1/s1	YYAGCQUXHYGTOT-ZXPXOXBPSA-N	611.368284338							103354
BRD-K39599822	LSM-14811		44485098	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33-/m1/s1	LMYACBAJSFEPOG-BXWHCVCYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K39599822	BRD-K39599822-001-01-5	Broad Institute of MIT and Harvard	BRD-K39599822			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33-/m1/s1	LMYACBAJSFEPOG-BXWHCVCYSA-N	617.357719654							103467
BRD-K61465460	LSM-14881		44485108	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23-,24-,29+/m0/s1	TYGOPRMPKRHVEQ-HGPRPZRGSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K61465460	BRD-K61465460-001-01-7	Broad Institute of MIT and Harvard	BRD-K61465460			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23-,24-,29+/m0/s1	TYGOPRMPKRHVEQ-HGPRPZRGSA-N	597.352634274							103537
BRD-K42035280	LSM-14825		54614978	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30+/m1/s1	JZEVKSWSVNZKOH-ZXPXOXBPSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K42035280	BRD-K42035280-001-01-0	Broad Institute of MIT and Harvard	BRD-K42035280			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30+/m1/s1	JZEVKSWSVNZKOH-ZXPXOXBPSA-N	596.357385296							103481
BRD-K93406156	LSM-14990		44616929	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29+/m1/s1	IVNRRFOIDKKMKL-OFKKAEEBSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K93406156	BRD-K93406156-001-01-2	Broad Institute of MIT and Harvard	BRD-K93406156			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29+/m1/s1	IVNRRFOIDKKMKL-OFKKAEEBSA-N	591.2978215							103646
BRD-K64951577	LSM-14890		54615020	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30-/m1/s1	STZYNHZFNFWBAK-SFOWLQBLSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K64951577	BRD-K64951577-001-01-3	Broad Institute of MIT and Harvard	BRD-K64951577			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30-/m1/s1	STZYNHZFNFWBAK-SFOWLQBLSA-N	617.41523453							103546
BRD-K00586388	LSM-14675		44503699	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23+,27-/m0/s1	HPPNONYMLIWSNI-MTPWMDRRSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K00586388	BRD-K00586388-001-01-3	Broad Institute of MIT and Harvard	BRD-K00586388			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23+,27-/m0/s1	HPPNONYMLIWSNI-MTPWMDRRSA-N	577.383934402							103331
BRD-K60760276	LSM-14880		44618954	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22-,26+/m1/s1	NPRRWKGRZALGNG-SRCYTUNASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K60760276	BRD-K60760276-001-01-6	Broad Institute of MIT and Harvard	BRD-K60760276			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22-,26+/m1/s1	NPRRWKGRZALGNG-SRCYTUNASA-N	616.344769864							103536
BRD-K51922621	LSM-14852		44489719	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25+,30+/m0/s1	GBDHSNMZLIRBLK-RZDWVWPCSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K51922621	BRD-K51922621-001-01-5	Broad Institute of MIT and Harvard	BRD-K51922621			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25+,30+/m0/s1	GBDHSNMZLIRBLK-RZDWVWPCSA-N	611.368284338							103508
BRD-K42006110	LSM-14824		54615017	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30-/m0/s1	STZYNHZFNFWBAK-SODQHWRNSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K42006110	BRD-K42006110-001-01-7	Broad Institute of MIT and Harvard	BRD-K42006110			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30-/m0/s1	STZYNHZFNFWBAK-SODQHWRNSA-N	617.41523453							103480
BRD-K60212338	LSM-14876		44489301	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20-,21-,25-/m0/s1	YWYDVFGOYOJBGO-UKDJSQQHSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K60212338	BRD-K60212338-001-01-4	Broad Institute of MIT and Harvard	BRD-K60212338			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20-,21-,25-/m0/s1	YWYDVFGOYOJBGO-UKDJSQQHSA-N	506.346820612							103532
BRD-K90256762	LSM-14975		44483952	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22-,26-/m0/s1	WCMOVSVGEGOMDB-MSZDEVHKSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K90256762	BRD-K90256762-001-01-0	Broad Institute of MIT and Harvard	BRD-K90256762			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22-,26-/m0/s1	WCMOVSVGEGOMDB-MSZDEVHKSA-N	616.344769864							103631
BRD-K87779450	LSM-14964		44490365	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21+,25+/m1/s1	ULMVXXWMSACXHE-VWEIPLKFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	BroadT	BRD-K87779450	BRD-K87779450-001-01-3	Broad Institute of MIT and Harvard	BRD-K87779450			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C27H43N5O6S/c1-19-14-32(20(2)17-33)27(34)23-13-22(29-39(35,36)26-16-31(6)18-28-26)10-11-24(23)38-21(3)9-7-8-12-37-25(19)15-30(4)5/h10-11,13,16,18-21,25,29,33H,7-9,12,14-15,17H2,1-6H3/t19-,20+,21+,25+/m1/s1	ULMVXXWMSACXHE-VWEIPLKFSA-N	565.293404836							103620
BRD-K72269288	LSM-14911		44490467	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25-,26-,31+/m1/s1	IEZOTXDZAGKSTL-KUXNCQQFSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K72269288	BRD-K72269288-001-01-0	Broad Institute of MIT and Harvard	BRD-K72269288			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25-,26-,31+/m1/s1	IEZOTXDZAGKSTL-KUXNCQQFSA-N	610.37303536							103567
BRD-K73388067	LSM-14915		44490327	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22+,26+/m0/s1	KNZOATPLJIEOET-BTKWVRSESA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K73388067	BRD-K73388067-001-01-4	Broad Institute of MIT and Harvard	BRD-K73388067			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22+,26+/m0/s1	KNZOATPLJIEOET-BTKWVRSESA-N	520.362470676							103571
BRD-K16970289	LSM-14737		49843341	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29+/m1/s1	IVNRRFOIDKKMKL-NBOGMJGSSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K16970289	BRD-K16970289-001-01-1	Broad Institute of MIT and Harvard	BRD-K16970289			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29+/m1/s1	IVNRRFOIDKKMKL-NBOGMJGSSA-N	591.2978215							103393
CHEMBL3185806	LSM-14760	BRD-K22847783	44493635	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26-,31-/m1/s1	JEEWDARUSPNTGW-FVCFNFBRSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K22847783	BRD-K22847783-001-01-4	Broad Institute of MIT and Harvard	BRD-K22847783			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26-,31-/m1/s1	JEEWDARUSPNTGW-FVCFNFBRSA-N	610.37303536							103416
BRD-K76437403	LSM-14929		44492077	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21-,25-/m1/s1	YWYDVFGOYOJBGO-FBROZUCGSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K76437403	BRD-K76437403-001-01-9	Broad Institute of MIT and Harvard	BRD-K76437403			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21-,25-/m1/s1	YWYDVFGOYOJBGO-FBROZUCGSA-N	506.346820612							103585
BRD-K96385755	LSM-15003		54615014	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30-/m1/s1	PLFJTCJSGHSPAZ-UBRKHCEVSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K96385755	BRD-K96385755-001-01-0	Broad Institute of MIT and Harvard	BRD-K96385755			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30-/m1/s1	PLFJTCJSGHSPAZ-UBRKHCEVSA-N	602.404335488							103659
BRD-K16535949	LSM-14732		44488211	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22+,26-/m1/s1	WCMOVSVGEGOMDB-ZUVQJFRASA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K16535949	BRD-K16535949-001-01-4	Broad Institute of MIT and Harvard	BRD-K16535949			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22+,26-/m1/s1	WCMOVSVGEGOMDB-ZUVQJFRASA-N	616.344769864							103388
BRD-K60144416	LSM-14875		44502715	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25+,26+,31+/m0/s1	YZTWEKNKNNRJIX-BCVXLEMTSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K60144416	BRD-K60144416-001-01-4	Broad Institute of MIT and Harvard	BRD-K60144416			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25+,26+,31+/m0/s1	YZTWEKNKNNRJIX-BCVXLEMTSA-N	603.334207008							103531
BRD-K06884091	LSM-14701		44617869	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33-/m1/s1	ZQNJSJYLLBSSCW-HYHRRZRMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K06884091	BRD-K06884091-001-01-4	Broad Institute of MIT and Harvard	BRD-K06884091			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33-/m1/s1	ZQNJSJYLLBSSCW-HYHRRZRMSA-N	615.33083619							103357
BRD-K27173348	LSM-14775		44616695	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29-/m0/s1	IVNRRFOIDKKMKL-VCTIXIOLSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K27173348	BRD-K27173348-001-01-8	Broad Institute of MIT and Harvard	BRD-K27173348			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29-/m0/s1	IVNRRFOIDKKMKL-VCTIXIOLSA-N	591.2978215							103431
BRD-K04411796	LSM-14690		44488177	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22+,26-/m1/s1	WCMOVSVGEGOMDB-FYBXHKAZSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K04411796	BRD-K04411796-001-01-6	Broad Institute of MIT and Harvard	BRD-K04411796			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22+,26-/m1/s1	WCMOVSVGEGOMDB-FYBXHKAZSA-N	616.344769864							103346
BRD-K96157570	LSM-15002		44493596	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30-/m1/s1	YYAGCQUXHYGTOT-UBRKHCEVSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K96157570	BRD-K96157570-001-01-6	Broad Institute of MIT and Harvard	BRD-K96157570			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30-/m1/s1	YYAGCQUXHYGTOT-UBRKHCEVSA-N	611.368284338							103658
BRD-K95913445	LSM-15001		44617494	InChI=1S/C29H50N4O5/c1-8-14-32(7)18-27-21(4)17-33(22(5)19-34)28(35)25-16-24(31-29(36)30-20(2)3)12-13-26(25)38-23(6)11-9-10-15-37-27/h12-13,16,20-23,27,34H,8-11,14-15,17-19H2,1-7H3,(H2,30,31,36)/t21-,22+,23+,27+/m0/s1	OXLKGXSDHBDOHC-IILZIBOQSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K95913445	BRD-K95913445-001-01-6	Broad Institute of MIT and Harvard	BRD-K95913445			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H50N4O5/c1-8-14-32(7)18-27-21(4)17-33(22(5)19-34)28(35)25-16-24(31-29(36)30-20(2)3)12-13-26(25)38-23(6)11-9-10-15-37-27/h12-13,16,20-23,27,34H,8-11,14-15,17-19H2,1-7H3,(H2,30,31,36)/t21-,22+,23+,27+/m0/s1	OXLKGXSDHBDOHC-IILZIBOQSA-N	534.37812074							103657
SA-426799	LSM-14914		54614981	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30-/m1/s1	PLFJTCJSGHSPAZ-ZASNTINBSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K73121863	BRD-K73121863-001-01-5	Broad Institute of MIT and Harvard	BRD-K73121863			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30-/m1/s1	PLFJTCJSGHSPAZ-ZASNTINBSA-N	602.404335488							103570
BRD-K90646778	LSM-14977		44502701	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33+/m0/s1	ZQNJSJYLLBSSCW-ZJXZHUIYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K90646778	BRD-K90646778-001-01-4	Broad Institute of MIT and Harvard	BRD-K90646778			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33+/m0/s1	ZQNJSJYLLBSSCW-ZJXZHUIYSA-N	615.33083619							103633
BRD-K04832618	LSM-14692		44485790	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33-/m1/s1	LMYACBAJSFEPOG-JIXXDEQJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K04832618	BRD-K04832618-001-01-9	Broad Institute of MIT and Harvard	BRD-K04832618			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33-/m1/s1	LMYACBAJSFEPOG-JIXXDEQJSA-N	617.357719654							103348
SA-425929	LSM-14854		44489343	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26+,31-/m1/s1	IEZOTXDZAGKSTL-SQRAXXTESA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K52043480	BRD-K52043480-001-01-9	Broad Institute of MIT and Harvard	BRD-K52043480			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26+,31-/m1/s1	IEZOTXDZAGKSTL-SQRAXXTESA-N	610.37303536							103510
BRD-K21642343	LSM-14755		49849996	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30+/m1/s1	JZEVKSWSVNZKOH-ZRIOWSNCSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K21642343	BRD-K21642343-001-01-3	Broad Institute of MIT and Harvard	BRD-K21642343			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30+/m1/s1	JZEVKSWSVNZKOH-ZRIOWSNCSA-N	596.357385296							103411
BRD-K51981081	LSM-14853		44487471	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33+/m0/s1	LMYACBAJSFEPOG-LIHQSLCGSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K51981081	BRD-K51981081-001-01-4	Broad Institute of MIT and Harvard	BRD-K51981081			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33+/m0/s1	LMYACBAJSFEPOG-LIHQSLCGSA-N	617.357719654							103509
BRD-K14078057	LSM-14725		54615004	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33-/m1/s1	ZQNJSJYLLBSSCW-JIXXDEQJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K14078057	BRD-K14078057-001-01-5	Broad Institute of MIT and Harvard	BRD-K14078057			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33-/m1/s1	ZQNJSJYLLBSSCW-JIXXDEQJSA-N	615.33083619							103381
BRD-K46080444	LSM-14836		44488769	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24-,25+,29-/m0/s1	SUHZFPHQAJGSMY-VYUAFQCHSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K46080444	BRD-K46080444-001-01-5	Broad Institute of MIT and Harvard	BRD-K46080444			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24-,25+,29-/m0/s1	SUHZFPHQAJGSMY-VYUAFQCHSA-N	605.41523453							103492
BRD-K13969067	LSM-14724		44492083	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22-,26-/m1/s1	WCMOVSVGEGOMDB-UXGLMHHASA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K13969067	BRD-K13969067-001-01-4	Broad Institute of MIT and Harvard	BRD-K13969067			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22-,26-/m1/s1	WCMOVSVGEGOMDB-UXGLMHHASA-N	616.344769864							103380
BRD-K23985857	LSM-14765		44618836	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25-,26-,31+/m1/s1	YZTWEKNKNNRJIX-KUXNCQQFSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K23985857	BRD-K23985857-001-01-2	Broad Institute of MIT and Harvard	BRD-K23985857			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25-,26-,31+/m1/s1	YZTWEKNKNNRJIX-KUXNCQQFSA-N	603.334207008							103421
BRD-K28918096	LSM-14782		54614982	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33-/m1/s1	ZQNJSJYLLBSSCW-BXWHCVCYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K28918096	BRD-K28918096-001-01-9	Broad Institute of MIT and Harvard	BRD-K28918096			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33-/m1/s1	ZQNJSJYLLBSSCW-BXWHCVCYSA-N	615.33083619							103438
BRD-K38986089	LSM-14809		44487442	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33+/m0/s1	LMYACBAJSFEPOG-SQQWPVGBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K38986089	BRD-K38986089-001-01-3	Broad Institute of MIT and Harvard	BRD-K38986089			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33+/m0/s1	LMYACBAJSFEPOG-SQQWPVGBSA-N	617.357719654							103465
BRD-K60588371	LSM-14879		44501123	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22+,26-/m0/s1	NPRRWKGRZALGNG-BOCITWAFSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K60588371	BRD-K60588371-001-01-5	Broad Institute of MIT and Harvard	BRD-K60588371			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22+,26-/m0/s1	NPRRWKGRZALGNG-BOCITWAFSA-N	616.344769864							103535
BRD-K79788021	LSM-14942		44620098	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22-,26+/m1/s1	NPRRWKGRZALGNG-BILGYAHESA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K79788021	BRD-K79788021-001-01-4	Broad Institute of MIT and Harvard	BRD-K79788021			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22-,26+/m1/s1	NPRRWKGRZALGNG-BILGYAHESA-N	616.344769864							103598
BRD-K47630323	LSM-14844		44486998	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25+,29-/m1/s1	SUHZFPHQAJGSMY-XHHBKWMTSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K47630323	BRD-K47630323-001-01-2	Broad Institute of MIT and Harvard	BRD-K47630323			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25+,29-/m1/s1	SUHZFPHQAJGSMY-XHHBKWMTSA-N	605.41523453							103500
BRD-K12559526	LSM-14723		44494504	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22-,26-/m0/s1	NPRRWKGRZALGNG-YGWSKSRPSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K12559526	BRD-K12559526-001-01-9	Broad Institute of MIT and Harvard	BRD-K12559526			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22-,26-/m0/s1	NPRRWKGRZALGNG-YGWSKSRPSA-N	616.344769864							103379
BRD-K31302860	LSM-14789		44620440	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25+,30-/m1/s1	YBLKRDGTGIUFGT-ZASNTINBSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K31302860	BRD-K31302860-001-01-5	Broad Institute of MIT and Harvard	BRD-K31302860			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25+,30-/m1/s1	YBLKRDGTGIUFGT-ZASNTINBSA-N	583.373369718							103445
BRD-K66643665	LSM-14898		44494607	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25-,26-,31+/m1/s1	JEEWDARUSPNTGW-KUXNCQQFSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K66643665	BRD-K66643665-001-01-7	Broad Institute of MIT and Harvard	BRD-K66643665			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25-,26-,31+/m1/s1	JEEWDARUSPNTGW-KUXNCQQFSA-N	610.37303536							103554
CHEMBL3183996	LSM-14860	BRD-K53437983	44617904	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22+,26+/m0/s1	NPRRWKGRZALGNG-BTKWVRSESA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K53437983	BRD-K53437983-001-01-4	Broad Institute of MIT and Harvard	BRD-K53437983			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21-,22+,26+/m0/s1	NPRRWKGRZALGNG-BTKWVRSESA-N	616.344769864							103516
BRD-K41418105	LSM-14817		44489855	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22+,26-/m0/s1	WCMOVSVGEGOMDB-IFOBJOEFSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K41418105	BRD-K41418105-001-01-2	Broad Institute of MIT and Harvard	BRD-K41418105			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22+,26-/m0/s1	WCMOVSVGEGOMDB-IFOBJOEFSA-N	616.344769864							103473
SA-424828	LSM-14695		44489338	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26-,31-/m0/s1	IEZOTXDZAGKSTL-XZSHTLEFSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K05756698	BRD-K05756698-001-01-2	Broad Institute of MIT and Harvard	BRD-K05756698			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25+,26-,31-/m0/s1	IEZOTXDZAGKSTL-XZSHTLEFSA-N	610.37303536							103351
SA-424764	LSM-14998		44486995	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33-/m0/s1	LMYACBAJSFEPOG-IZPIQJOWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K95616928	BRD-K95616928-001-01-1	Broad Institute of MIT and Harvard	BRD-K95616928			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33-/m0/s1	LMYACBAJSFEPOG-IZPIQJOWSA-N	617.357719654							103654
BRD-K52657367	LSM-14856		44487460	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25+,30+/m0/s1	GBDHSNMZLIRBLK-ZQIPMTRKSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K52657367	BRD-K52657367-001-01-4	Broad Institute of MIT and Harvard	BRD-K52657367			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25+,30+/m0/s1	GBDHSNMZLIRBLK-ZQIPMTRKSA-N	611.368284338							103512
BRD-K15950605	LSM-14729		54614994	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23+,27-/m1/s1	HPPNONYMLIWSNI-GRSOWLQASA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K15950605	BRD-K15950605-001-01-1	Broad Institute of MIT and Harvard	BRD-K15950605			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23+,27-/m1/s1	HPPNONYMLIWSNI-GRSOWLQASA-N	577.383934402							103385
BRD-K46512834	LSM-14838		44485803	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30-/m1/s1	GBDHSNMZLIRBLK-SFOWLQBLSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K46512834	BRD-K46512834-001-01-5	Broad Institute of MIT and Harvard	BRD-K46512834			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30-/m1/s1	GBDHSNMZLIRBLK-SFOWLQBLSA-N	611.368284338							103494
CHEMBL2360848	LSM-14958	BRD-K84653575, SID85801865	44495045	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20-,24+/m1/s1	DGSOXKKLHVIDDH-ZSTWQFLISA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K84653575	BRD-K84653575-001-01-3	Broad Institute of MIT and Harvard	BRD-K84653575			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20-,24+/m1/s1	DGSOXKKLHVIDDH-ZSTWQFLISA-N	492.331170548							103614
BRD-K99020117	LSM-15012		44487540	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25-,29+/m1/s1	SUHZFPHQAJGSMY-ZTVFFDQVSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K99020117	BRD-K99020117-001-01-3	Broad Institute of MIT and Harvard	BRD-K99020117			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25-,29+/m1/s1	SUHZFPHQAJGSMY-ZTVFFDQVSA-N	605.41523453							103668
BRD-K36466190	LSM-14801		54614985	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33-/m0/s1	ZQNJSJYLLBSSCW-IZPIQJOWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K36466190	BRD-K36466190-001-01-4	Broad Institute of MIT and Harvard	BRD-K36466190			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33-/m0/s1	ZQNJSJYLLBSSCW-IZPIQJOWSA-N	615.33083619							103457
BRD-K01739339	LSM-14679		54614998	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22+,26-/m1/s1	NPRRWKGRZALGNG-FYBXHKAZSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K01739339	BRD-K01739339-001-01-7	Broad Institute of MIT and Harvard	BRD-K01739339			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22+,26-/m1/s1	NPRRWKGRZALGNG-FYBXHKAZSA-N	616.344769864							103335
BRD-K57487331	LSM-14869		44503688	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25+,30-/m0/s1	STZYNHZFNFWBAK-RPQPUBLWSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K57487331	BRD-K57487331-001-01-4	Broad Institute of MIT and Harvard	BRD-K57487331			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25+,30-/m0/s1	STZYNHZFNFWBAK-RPQPUBLWSA-N	617.41523453							103525
BRD-K62431786	LSM-14886		54615009	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25-,30-/m1/s1	YBLKRDGTGIUFGT-FJRSXGRASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K62431786	BRD-K62431786-001-01-5	Broad Institute of MIT and Harvard	BRD-K62431786			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25-,30-/m1/s1	YBLKRDGTGIUFGT-FJRSXGRASA-N	583.373369718							103542
BRD-K52856667	LSM-14858		54615016	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30-/m1/s1	PLFJTCJSGHSPAZ-SFOWLQBLSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K52856667	BRD-K52856667-001-01-9	Broad Institute of MIT and Harvard	BRD-K52856667			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30-/m1/s1	PLFJTCJSGHSPAZ-SFOWLQBLSA-N	602.404335488							103514
BRD-K08856690	LSM-14712		44494545	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m1/s1	ZCWFLIQXFDCFQH-UJFVLINRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K08856690	BRD-K08856690-001-01-5	Broad Institute of MIT and Harvard	BRD-K08856690			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m1/s1	ZCWFLIQXFDCFQH-UJFVLINRSA-N	603.34206959							103368
BRD-K46295497	LSM-14837		44495475	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19-,20-,24+/m0/s1	DGSOXKKLHVIDDH-AZXNSQLWSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K46295497	BRD-K46295497-001-01-5	Broad Institute of MIT and Harvard	BRD-K46295497			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19-,20-,24+/m0/s1	DGSOXKKLHVIDDH-AZXNSQLWSA-N	492.331170548							103493
BRD-K64968742	LSM-14891		44490883	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20-,21-,25-/m1/s1	YWYDVFGOYOJBGO-QTDDQOEGSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K64968742	BRD-K64968742-001-01-7	Broad Institute of MIT and Harvard	BRD-K64968742			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20-,21-,25-/m1/s1	YWYDVFGOYOJBGO-QTDDQOEGSA-N	506.346820612							103547
BRD-K11169037	LSM-14721		44501089	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30-/m0/s1	JZEVKSWSVNZKOH-RPQPUBLWSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K11169037	BRD-K11169037-001-01-0	Broad Institute of MIT and Harvard	BRD-K11169037			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30-/m0/s1	JZEVKSWSVNZKOH-RPQPUBLWSA-N	596.357385296							103377
BRD-K31883841	LSM-14794		44495973	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21-,25-/m0/s1	YWYDVFGOYOJBGO-PDFGSZSQSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K31883841	BRD-K31883841-001-01-8	Broad Institute of MIT and Harvard	BRD-K31883841			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21-,25-/m0/s1	YWYDVFGOYOJBGO-PDFGSZSQSA-N	506.346820612							103450
BRD-K85144746	LSM-14960		44493124	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25-,26+,31-/m0/s1	JEEWDARUSPNTGW-PDTFHCFTSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K85144746	BRD-K85144746-001-01-6	Broad Institute of MIT and Harvard	BRD-K85144746			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25-,26+,31-/m0/s1	JEEWDARUSPNTGW-PDTFHCFTSA-N	610.37303536							103616
BRD-K82633701	LSM-14949		44490385	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25+,29+/m1/s1	AIBBTECRVWULHH-SGDZTBBFSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)CCCN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K82633701	BRD-K82633701-001-01-4	Broad Institute of MIT and Harvard	BRD-K82633701			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)CCCN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25+,29+/m1/s1	AIBBTECRVWULHH-SGDZTBBFSA-N	605.41523453							103605
BRD-K75666689	LSM-14925		44487498	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24+,29+/m1/s1	TYGOPRMPKRHVEQ-MSCBGTKOSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K75666689	BRD-K75666689-001-01-9	Broad Institute of MIT and Harvard	BRD-K75666689			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24+,29+/m1/s1	TYGOPRMPKRHVEQ-MSCBGTKOSA-N	597.352634274							103581
BRD-K90748376	LSM-14979		54615003	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30-/m0/s1	STZYNHZFNFWBAK-XZSZPMDUSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K90748376	BRD-K90748376-001-01-4	Broad Institute of MIT and Harvard	BRD-K90748376			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30-/m0/s1	STZYNHZFNFWBAK-XZSZPMDUSA-N	617.41523453							103635
BRD-K16950565	LSM-14736		44493627	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m1/s1	ZCWFLIQXFDCFQH-VUKRRIEASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K16950565	BRD-K16950565-001-01-8	Broad Institute of MIT and Harvard	BRD-K16950565			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m1/s1	ZCWFLIQXFDCFQH-VUKRRIEASA-N	603.34206959							103392
BRD-K93577185	LSM-14991		44485822	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24-,25+,29+/m0/s1	SUHZFPHQAJGSMY-RGYUWNBKSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K93577185	BRD-K93577185-001-01-5	Broad Institute of MIT and Harvard	BRD-K93577185			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24-,25+,29+/m0/s1	SUHZFPHQAJGSMY-RGYUWNBKSA-N	605.41523453							103647
BRD-K16930636	LSM-14735		44490361	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22+,26+/m1/s1	KNZOATPLJIEOET-QILISPFLSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K16930636	BRD-K16930636-001-01-5	Broad Institute of MIT and Harvard	BRD-K16930636			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22+,26+/m1/s1	KNZOATPLJIEOET-QILISPFLSA-N	520.362470676							103391
BRD-K42694358	LSM-14827		44501797	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25+,30-/m0/s1	YBLKRDGTGIUFGT-RPQPUBLWSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K42694358	BRD-K42694358-001-01-1	Broad Institute of MIT and Harvard	BRD-K42694358			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25+,30-/m0/s1	YBLKRDGTGIUFGT-RPQPUBLWSA-N	583.373369718							103483
BRD-K56208365	LSM-14865		44494129	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26+,31-/m1/s1	JEEWDARUSPNTGW-SQRAXXTESA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K56208365	BRD-K56208365-001-01-4	Broad Institute of MIT and Harvard	BRD-K56208365			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26+,31-/m1/s1	JEEWDARUSPNTGW-SQRAXXTESA-N	610.37303536							103521
BRD-K24391905	LSM-14768		44496454	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30-/m0/s1	PLFJTCJSGHSPAZ-SODQHWRNSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K24391905	BRD-K24391905-001-01-4	Broad Institute of MIT and Harvard	BRD-K24391905			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30-/m0/s1	PLFJTCJSGHSPAZ-SODQHWRNSA-N	602.404335488							103424
BRD-K90734091	LSM-14978		44489743	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24+,29-/m0/s1	TYGOPRMPKRHVEQ-SEAFADMZSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K90734091	BRD-K90734091-001-01-8	Broad Institute of MIT and Harvard	BRD-K90734091			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24+,29-/m0/s1	TYGOPRMPKRHVEQ-SEAFADMZSA-N	597.352634274							103634
BRD-K07026322	LSM-14703		44488201	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25-,29-/m1/s1	AIBBTECRVWULHH-MNGFJMBLSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K07026322	BRD-K07026322-001-01-2	Broad Institute of MIT and Harvard	BRD-K07026322			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25-,29-/m1/s1	AIBBTECRVWULHH-MNGFJMBLSA-N	605.41523453							103359
BRD-K86303874	LSM-14961		44494904	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m0/s1	ZCWFLIQXFDCFQH-MQBJWECPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K86303874	BRD-K86303874-001-01-1	Broad Institute of MIT and Harvard	BRD-K86303874			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m0/s1	ZCWFLIQXFDCFQH-MQBJWECPSA-N	603.34206959							103617
BRD-K55588166	LSM-14864		44487544	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30+/m1/s1	GBDHSNMZLIRBLK-ZXPXOXBPSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K55588166	BRD-K55588166-001-01-1	Broad Institute of MIT and Harvard	BRD-K55588166			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30+/m1/s1	GBDHSNMZLIRBLK-ZXPXOXBPSA-N	611.368284338							103520
BRD-K74127463	LSM-14921		49843150	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22+,26+/m1/s1	NPRRWKGRZALGNG-QILISPFLSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K74127463	BRD-K74127463-001-01-5	Broad Institute of MIT and Harvard	BRD-K74127463			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)CCC(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22+,26+/m1/s1	NPRRWKGRZALGNG-QILISPFLSA-N	616.344769864							103577
BRD-K97860318	LSM-15006		44485828	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25-,29+/m0/s1	SUHZFPHQAJGSMY-APSVEGKFSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K97860318	BRD-K97860318-001-01-1	Broad Institute of MIT and Harvard	BRD-K97860318			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25-,29+/m0/s1	SUHZFPHQAJGSMY-APSVEGKFSA-N	605.41523453							103662
BRD-K20949245	LSM-14751		54614989	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30-/m1/s1	JZEVKSWSVNZKOH-ZASNTINBSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K20949245	BRD-K20949245-001-01-2	Broad Institute of MIT and Harvard	BRD-K20949245			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30-/m1/s1	JZEVKSWSVNZKOH-ZASNTINBSA-N	596.357385296							103407
BRD-K34516743	LSM-14797		44486983	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30-/m0/s1	GBDHSNMZLIRBLK-SODQHWRNSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K34516743	BRD-K34516743-001-01-0	Broad Institute of MIT and Harvard	BRD-K34516743			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30-/m0/s1	GBDHSNMZLIRBLK-SODQHWRNSA-N	611.368284338							103453
BRD-K74446951	LSM-14922		44490286	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22+,26-/m0/s1	KNZOATPLJIEOET-BOCITWAFSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K74446951	BRD-K74446951-001-01-8	Broad Institute of MIT and Harvard	BRD-K74446951			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22+,26-/m0/s1	KNZOATPLJIEOET-BOCITWAFSA-N	520.362470676							103578
BRD-K83448671	LSM-14953		44496032	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25-,30+/m0/s1	YYAGCQUXHYGTOT-YDXRHMNESA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K83448671	BRD-K83448671-001-01-2	Broad Institute of MIT and Harvard	BRD-K83448671			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25-,30+/m0/s1	YYAGCQUXHYGTOT-YDXRHMNESA-N	611.368284338							103609
BRD-K33215066	LSM-14796		44486406	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25-,29-/m1/s1	SUHZFPHQAJGSMY-MNGFJMBLSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K33215066	BRD-K33215066-001-01-9	Broad Institute of MIT and Harvard	BRD-K33215066			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25-,29-/m1/s1	SUHZFPHQAJGSMY-MNGFJMBLSA-N	605.41523453							103452
BRD-K82651890	LSM-14950		44487474	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24-,29+/m0/s1	TYGOPRMPKRHVEQ-HNFJUSDZSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K82651890	BRD-K82651890-001-01-7	Broad Institute of MIT and Harvard	BRD-K82651890			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24-,29+/m0/s1	TYGOPRMPKRHVEQ-HNFJUSDZSA-N	597.352634274							103606
BRD-K88243749	LSM-14965		44504025	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30+/m0/s1	JZEVKSWSVNZKOH-RZDWVWPCSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K88243749	BRD-K88243749-001-01-0	Broad Institute of MIT and Harvard	BRD-K88243749			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30+/m0/s1	JZEVKSWSVNZKOH-RZDWVWPCSA-N	596.357385296							103621
BRD-K82435102	LSM-14948		44487426	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33+/m0/s1	LMYACBAJSFEPOG-CLFOAKAGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K82435102	BRD-K82435102-001-01-9	Broad Institute of MIT and Harvard	BRD-K82435102			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33+/m0/s1	LMYACBAJSFEPOG-CLFOAKAGSA-N	617.357719654							103604
BRD-K57589644	LSM-14870		44484591	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25-,29-/m0/s1	SUHZFPHQAJGSMY-JLMYGFKKSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K57589644	BRD-K57589644-001-01-9	Broad Institute of MIT and Harvard	BRD-K57589644			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25-,29-/m0/s1	SUHZFPHQAJGSMY-JLMYGFKKSA-N	605.41523453							103526
BRD-K56951539	LSM-14867		44490232	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25+,29+/m0/s1	AIBBTECRVWULHH-GYKHTSFTSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K56951539	BRD-K56951539-001-01-0	Broad Institute of MIT and Harvard	BRD-K56951539			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25+,29+/m0/s1	AIBBTECRVWULHH-GYKHTSFTSA-N	605.41523453							103523
BRD-K22211348	LSM-14757		44494556	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26-,31+/m1/s1	JEEWDARUSPNTGW-ANKKVJNISA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K22211348	BRD-K22211348-001-01-1	Broad Institute of MIT and Harvard	BRD-K22211348			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26-,31+/m1/s1	JEEWDARUSPNTGW-ANKKVJNISA-N	610.37303536							103413
BRD-K73059376	LSM-14913		44485145	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25+,29+/m1/s1	SUHZFPHQAJGSMY-SGDZTBBFSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K73059376	BRD-K73059376-001-01-7	Broad Institute of MIT and Harvard	BRD-K73059376			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)36(8)20-29-23(3)19-37(24(4)21-38)31(40)27-18-26(34-30(39)13-11-16-35(6)7)14-15-28(27)43-25(5)12-9-10-17-42-29/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H,33,41)(H,34,39)/t23-,24+,25+,29+/m1/s1	SUHZFPHQAJGSMY-SGDZTBBFSA-N	605.41523453							103569
BRD-K01329157	LSM-14677		54614997	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25+,30-/m1/s1	YBLKRDGTGIUFGT-UBRKHCEVSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K01329157	BRD-K01329157-001-01-6	Broad Institute of MIT and Harvard	BRD-K01329157			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25+,30-/m1/s1	YBLKRDGTGIUFGT-UBRKHCEVSA-N	583.373369718							103333
BRD-K74046820	LSM-14920		44489703	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24+,29+/m0/s1	TYGOPRMPKRHVEQ-CMSZEEODSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K74046820	BRD-K74046820-001-01-5	Broad Institute of MIT and Harvard	BRD-K74046820			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24+,29+/m0/s1	TYGOPRMPKRHVEQ-CMSZEEODSA-N	597.352634274							103576
BRD-K96477379	LSM-15004		44498677	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30+/m1/s1	JZEVKSWSVNZKOH-GBRARVNLSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K96477379	BRD-K96477379-001-01-1	Broad Institute of MIT and Harvard	BRD-K96477379			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30+/m1/s1	JZEVKSWSVNZKOH-GBRARVNLSA-N	596.357385296							103660
BRD-K31877241	LSM-14793		44490402	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22-,26+/m1/s1	KNZOATPLJIEOET-SRCYTUNASA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K31877241	BRD-K31877241-001-01-6	Broad Institute of MIT and Harvard	BRD-K31877241			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21+,22-,26+/m1/s1	KNZOATPLJIEOET-SRCYTUNASA-N	520.362470676							103449
CHEMBL3187641	LSM-14835	BRD-K44647644	44617225	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29-/m0/s1	IVNRRFOIDKKMKL-DGGNIJSCSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K44647644	BRD-K44647644-001-01-1	Broad Institute of MIT and Harvard	BRD-K44647644			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29-/m0/s1	IVNRRFOIDKKMKL-DGGNIJSCSA-N	591.2978215							103491
BRD-K93303857	LSM-14989		44484555	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30-/m0/s1	GBDHSNMZLIRBLK-XZSZPMDUSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K93303857	BRD-K93303857-001-01-3	Broad Institute of MIT and Harvard	BRD-K93303857			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25-,30-/m0/s1	GBDHSNMZLIRBLK-XZSZPMDUSA-N	611.368284338							103645
BRD-K57073585	LSM-14868		44490858	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22+,26-/m0/s1	WCMOVSVGEGOMDB-BOCITWAFSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K57073585	BRD-K57073585-001-01-5	Broad Institute of MIT and Harvard	BRD-K57073585			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22+,26-/m0/s1	WCMOVSVGEGOMDB-BOCITWAFSA-N	616.344769864							103524
BRD-K89505656	LSM-14971		44494377	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26+,31+/m0/s1	JEEWDARUSPNTGW-BCVXLEMTSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K89505656	BRD-K89505656-001-01-2	Broad Institute of MIT and Harvard	BRD-K89505656			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)37(6)21-31-24(3)20-38(25(4)22-39)33(41)29-19-28(36-32(40)18-27-13-8-7-9-14-27)15-16-30(29)44-26(5)12-10-11-17-43-31/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H,35,42)(H,36,40)/t24-,25+,26+,31+/m0/s1	JEEWDARUSPNTGW-BCVXLEMTSA-N	610.37303536							103627
BRD-K80553643	LSM-14944		44490909	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22+,26+/m0/s1	WCMOVSVGEGOMDB-BTKWVRSESA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K80553643	BRD-K80553643-001-01-7	Broad Institute of MIT and Harvard	BRD-K80553643			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21-,22+,26+/m0/s1	WCMOVSVGEGOMDB-BTKWVRSESA-N	616.344769864							103600
BRD-K62102996	LSM-14885		44489298	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24-,25-,29-/m0/s1	AIBBTECRVWULHH-MGQBIDJDSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K62102996	BRD-K62102996-001-01-8	Broad Institute of MIT and Harvard	BRD-K62102996			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24-,25-,29-/m0/s1	AIBBTECRVWULHH-MGQBIDJDSA-N	605.41523453							103541
BRD-K43014865	LSM-14829		44617302	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33+/m1/s1	ZQNJSJYLLBSSCW-CYNXIGLJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K43014865	BRD-K43014865-001-01-7	Broad Institute of MIT and Harvard	BRD-K43014865			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33+/m1/s1	ZQNJSJYLLBSSCW-CYNXIGLJSA-N	615.33083619							103485
BRD-K38373457	LSM-14804		44617843	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23+,27+/m1/s1	HPPNONYMLIWSNI-GGLGADRISA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K38373457	BRD-K38373457-001-01-8	Broad Institute of MIT and Harvard	BRD-K38373457			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23+,27+/m1/s1	HPPNONYMLIWSNI-GGLGADRISA-N	577.383934402							103460
BRD-K01389427	LSM-14678		44494984	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32+/m0/s1	ZCWFLIQXFDCFQH-KYFCECMNSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K01389427	BRD-K01389427-001-01-4	Broad Institute of MIT and Harvard	BRD-K01389427			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C34H45N5O5/c1-24-20-39(25(2)23-40)34(42)30-19-29(37-33(41)28-12-16-36-17-13-28)8-9-31(30)44-26(3)7-5-6-18-43-32(24)22-38(4)21-27-10-14-35-15-11-27/h8-17,19,24-26,32,40H,5-7,18,20-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32+/m0/s1	ZCWFLIQXFDCFQH-KYFCECMNSA-N	603.34206959							103334
BRD-K73737710	LSM-14917		44489717	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33+/m0/s1	LMYACBAJSFEPOG-ZJXZHUIYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K73737710	BRD-K73737710-001-01-3	Broad Institute of MIT and Harvard	BRD-K73737710			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33+/m0/s1	LMYACBAJSFEPOG-ZJXZHUIYSA-N	617.357719654							103573
BRD-K84157702	LSM-14955		44489843	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22-,26-/m0/s1	KNZOATPLJIEOET-YGWSKSRPSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K84157702	BRD-K84157702-001-01-1	Broad Institute of MIT and Harvard	BRD-K84157702			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C28H48N4O5/c1-19(2)29-28(35)31(8)17-26-20(3)16-32(21(4)18-33)27(34)24-15-23(30(6)7)12-13-25(24)37-22(5)11-9-10-14-36-26/h12-13,15,19-22,26,33H,9-11,14,16-18H2,1-8H3,(H,29,35)/t20-,21-,22-,26-/m0/s1	KNZOATPLJIEOET-YGWSKSRPSA-N	520.362470676							103611
BRD-K44421914	LSM-14833		54615021	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30+/m0/s1	PLFJTCJSGHSPAZ-YDXRHMNESA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K44421914	BRD-K44421914-001-01-4	Broad Institute of MIT and Harvard	BRD-K44421914			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30+/m0/s1	PLFJTCJSGHSPAZ-YDXRHMNESA-N	602.404335488							103489
BRD-K86038750-001-01-2	LSM-16846	BRD-K86038750	44483954	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25+,29-/m1/s1	AIBBTECRVWULHH-XHHBKWMTSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K86038750	BRD-K86038750-001-01-2	Broad Institute of MIT and Harvard	BRD-K86038750			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24+,25+,29-/m1/s1	AIBBTECRVWULHH-XHHBKWMTSA-N	605.41523453							105483
CHEMBL2360606	LSM-14770	BRD-K24992843, SID85795282	44488752	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33-/m0/s1	LMYACBAJSFEPOG-KIAQLKRMSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K24992843	BRD-K24992843-001-01-4	Broad Institute of MIT and Harvard	BRD-K24992843			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33-/m0/s1	LMYACBAJSFEPOG-KIAQLKRMSA-N	617.357719654							103426
BRD-K93672499	LSM-14992		44496893	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30-/m0/s1	PLFJTCJSGHSPAZ-INVAMZEASA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K93672499	BRD-K93672499-001-01-5	Broad Institute of MIT and Harvard	BRD-K93672499			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30-/m0/s1	PLFJTCJSGHSPAZ-INVAMZEASA-N	602.404335488							103648
CHEMBL2357364	LSM-14907	BRD-K69598982, SID131410005	54615012	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30+/m0/s1	JZEVKSWSVNZKOH-DNHJLFCISA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K69598982	BRD-K69598982-001-01-6	Broad Institute of MIT and Harvard	BRD-K69598982			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25-,30+/m0/s1	JZEVKSWSVNZKOH-DNHJLFCISA-N	596.357385296							103563
CHEMBL2357067	LSM-14807	BRD-K38700430, SID131409994	54615001	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23-,27-/m1/s1	HPPNONYMLIWSNI-QSGNWFJVSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K38700430	BRD-K38700430-001-01-4	Broad Institute of MIT and Harvard	BRD-K38700430			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23-,27-/m1/s1	HPPNONYMLIWSNI-QSGNWFJVSA-N	577.383934402							103463
BRD-K23897615	LSM-14764		49850031	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,29+/m1/s1	IVNRRFOIDKKMKL-NXRFZHLESA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K23897615	BRD-K23897615-001-01-2	Broad Institute of MIT and Harvard	BRD-K23897615			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,29+/m1/s1	IVNRRFOIDKKMKL-NXRFZHLESA-N	591.2978215							103420
BRD-K02248910	LSM-14681		44490368	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22+,26+/m1/s1	WCMOVSVGEGOMDB-QILISPFLSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K02248910	BRD-K02248910-001-01-5	Broad Institute of MIT and Harvard	BRD-K02248910			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)36(6)17-26-20(3)16-37(21(4)18-38)28(40)24-15-23(35-27(39)12-13-30(31,32)33)10-11-25(24)43-22(5)9-7-8-14-42-26/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H,34,41)(H,35,39)/t20-,21+,22+,26+/m1/s1	WCMOVSVGEGOMDB-QILISPFLSA-N	616.344769864							103337
BRD-K59472400	LSM-14874		44490270	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21+,25-/m0/s1	YWYDVFGOYOJBGO-SMTRIPRVSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K59472400	BRD-K59472400-001-01-0	Broad Institute of MIT and Harvard	BRD-K59472400			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21+,25-/m0/s1	YWYDVFGOYOJBGO-SMTRIPRVSA-N	506.346820612							103530
BRD-K40471847	LSM-14813		44504553	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33-/m0/s1	ZQNJSJYLLBSSCW-QTLXSIBASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K40471847	BRD-K40471847-001-01-5	Broad Institute of MIT and Harvard	BRD-K40471847			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C36H45N3O6/c1-25-22-39(26(2)24-40)36(43)31-21-30(37-34(41)28-14-7-5-8-15-28)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-38(4)35(42)29-16-9-6-10-17-29/h5-10,14-19,21,25-27,33,40H,11-13,20,22-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33-/m0/s1	ZQNJSJYLLBSSCW-QTLXSIBASA-N	615.33083619							103469
BRD-K14363876	LSM-14727		54614987	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25-,26-,31+/m0/s1	YZTWEKNKNNRJIX-WJQRCLFPSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K14363876	BRD-K14363876-001-01-0	Broad Institute of MIT and Harvard	BRD-K14363876			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C32H49N3O6S/c1-7-17-34(6)21-31-24(3)20-35(25(4)22-36)32(37)29-19-27(33-42(38,39)28-14-11-23(2)12-15-28)13-16-30(29)41-26(5)10-8-9-18-40-31/h11-16,19,24-26,31,33,36H,7-10,17-18,20-22H2,1-6H3/t24-,25-,26-,31+/m0/s1	YZTWEKNKNNRJIX-WJQRCLFPSA-N	603.334207008							103383
BRD-K93107794	LSM-14987		44490325	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20-,21-,25+/m0/s1	YWYDVFGOYOJBGO-AIFLQVKLSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K93107794	BRD-K93107794-001-01-4	Broad Institute of MIT and Harvard	BRD-K93107794			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20-,21-,25+/m0/s1	YWYDVFGOYOJBGO-AIFLQVKLSA-N	506.346820612							103643
BRD-K65540587	LSM-14893		44486384	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25+,30-/m1/s1	GBDHSNMZLIRBLK-UBRKHCEVSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K65540587	BRD-K65540587-001-01-1	Broad Institute of MIT and Harvard	BRD-K65540587			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H49N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25+,30-/m1/s1	GBDHSNMZLIRBLK-UBRKHCEVSA-N	611.368284338							103549
BRD-K30371494	LSM-14785		44492633	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20-,24-/m0/s1	DGSOXKKLHVIDDH-VKDGWMQASA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K30371494	BRD-K30371494-001-01-5	Broad Institute of MIT and Harvard	BRD-K30371494			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20-,24-/m0/s1	DGSOXKKLHVIDDH-VKDGWMQASA-N	492.331170548							103441
BRD-K49148689	LSM-14847		44618182	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30+/m1/s1	PLFJTCJSGHSPAZ-DUXAABNJSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K49148689	BRD-K49148689-001-01-1	Broad Institute of MIT and Harvard	BRD-K49148689			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30+/m1/s1	PLFJTCJSGHSPAZ-DUXAABNJSA-N	602.404335488							103503
BRD-K88748878	LSM-14967		44618542	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25+,30+/m0/s1	YBLKRDGTGIUFGT-ZQIPMTRKSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K88748878	BRD-K88748878-001-01-1	Broad Institute of MIT and Harvard	BRD-K88748878			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24-,25+,30+/m0/s1	YBLKRDGTGIUFGT-ZQIPMTRKSA-N	583.373369718							103623
BRD-K25070860	LSM-6790		44487526	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33+/m1/s1	LMYACBAJSFEPOG-XJVVAVADSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K25070860	BRD-K25070860-001-01-6	Broad Institute of MIT and Harvard	BRD-K25070860			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33+/m1/s1	LMYACBAJSFEPOG-XJVVAVADSA-N	617.357719654							95411
BRD-K65165610	LSM-14892		44498654	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25+,30+/m1/s1	YBLKRDGTGIUFGT-DUXAABNJSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K65165610	BRD-K65165610-001-01-8	Broad Institute of MIT and Harvard	BRD-K65165610			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25+,30+/m1/s1	YBLKRDGTGIUFGT-DUXAABNJSA-N	583.373369718							103548
SA-423862	LSM-14866		44483932	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25-,26+,31-/m0/s1	IEZOTXDZAGKSTL-PDTFHCFTSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Cc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K56726453	BRD-K56726453-001-01-8	Broad Institute of MIT and Harvard	BRD-K56726453			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)Cc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C34H50N4O6/c1-23(2)35-34(42)36-28-15-16-30-29(19-28)33(41)38(25(4)22-39)20-24(3)31(43-17-11-10-12-26(5)44-30)21-37(6)32(40)18-27-13-8-7-9-14-27/h7-9,13-16,19,23-26,31,39H,10-12,17-18,20-22H2,1-6H3,(H2,35,36,42)/t24-,25-,26+,31-/m0/s1	IEZOTXDZAGKSTL-PDTFHCFTSA-N	610.37303536							103522
BRD-K98437249	LSM-15009		44490906	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24-,25+,29+/m0/s1	AIBBTECRVWULHH-RGYUWNBKSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K98437249	BRD-K98437249-001-01-1	Broad Institute of MIT and Harvard	BRD-K98437249			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCCN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H55N5O6/c1-22(2)33-32(41)34-26-14-15-28-27(18-26)31(40)37(24(4)21-38)19-23(3)29(42-17-10-9-12-25(5)43-28)20-36(8)30(39)13-11-16-35(6)7/h14-15,18,22-25,29,38H,9-13,16-17,19-21H2,1-8H3,(H2,33,34,41)/t23-,24-,25+,29+/m0/s1	AIBBTECRVWULHH-RGYUWNBKSA-N	605.41523453							103665
BRD-K29360016	LSM-14783		44494441	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20+,24+/m0/s1	DGSOXKKLHVIDDH-UECWXEIQSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K29360016	BRD-K29360016-001-01-0	Broad Institute of MIT and Harvard	BRD-K29360016			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H44N4O5/c1-17(2)28-26(33)29-21-10-11-23-22(13-21)25(32)30(19(4)16-31)15-18(3)24(14-27-6)34-12-8-7-9-20(5)35-23/h10-11,13,17-20,24,27,31H,7-9,12,14-16H2,1-6H3,(H2,28,29,33)/t18-,19+,20+,24+/m0/s1	DGSOXKKLHVIDDH-UECWXEIQSA-N	492.331170548							103439
BRD-K07270511	LSM-14708		44502210	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22+,26+/m0/s1	NPRRWKGRZALGNG-AVJFOWIRSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K07270511	BRD-K07270511-001-01-7	Broad Institute of MIT and Harvard	BRD-K07270511			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)CCC(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H47F3N4O6/c1-19(2)34-29(41)35-23-10-11-25-24(15-23)28(40)37(21(4)18-38)16-20(3)26(42-14-8-7-9-22(5)43-25)17-36(6)27(39)12-13-30(31,32)33/h10-11,15,19-22,26,38H,7-9,12-14,16-18H2,1-6H3,(H2,34,35,41)/t20-,21+,22+,26+/m0/s1	NPRRWKGRZALGNG-AVJFOWIRSA-N	616.344769864							103364
BRD-K77705921	LSM-14932		44487562	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24-,29+/m1/s1	TYGOPRMPKRHVEQ-HZTMJRFTSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K77705921	BRD-K77705921-001-01-1	Broad Institute of MIT and Harvard	BRD-K77705921			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)35-26-10-11-28-27(17-26)31(40)37(23(4)20-38)18-22(3)29(42-16-8-7-9-24(5)43-28)19-36(6)30(39)25-12-14-33-15-13-25/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H2,34,35,41)/t22-,23+,24-,29+/m1/s1	TYGOPRMPKRHVEQ-HZTMJRFTSA-N	597.352634274							103588
BRD-K89493095	LSM-14970		44501062	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23+,27+/m0/s1	HPPNONYMLIWSNI-IILZIBOQSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K89493095	BRD-K89493095-001-01-0	Broad Institute of MIT and Harvard	BRD-K89493095			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H51N5O6/c1-19(2)31-29(38)33-24-12-13-26-25(15-24)28(37)35(22(6)18-36)16-21(5)27(17-34(8)30(39)32-20(3)4)40-14-10-9-11-23(7)41-26/h12-13,15,19-23,27,36H,9-11,14,16-18H2,1-8H3,(H,32,39)(H2,31,33,38)/t21-,22+,23+,27+/m0/s1	HPPNONYMLIWSNI-IILZIBOQSA-N	577.383934402							103626
BRD-K97481123	LSM-15005		44620789	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30-/m1/s1	STZYNHZFNFWBAK-FJRSXGRASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K97481123	BRD-K97481123-001-01-1	Broad Institute of MIT and Harvard	BRD-K97481123			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24+,25-,30-/m1/s1	STZYNHZFNFWBAK-FJRSXGRASA-N	617.41523453							103661
MLS003128874	LSM-9615	BRD-K19642661	51358867	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29+/m0/s1	IVNRRFOIDKKMKL-LQZKXZFMSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K19642661	BRD-K19642661-001-02-9	Broad Institute of MIT and Harvard	BRD-K19642661			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29+/m0/s1	IVNRRFOIDKKMKL-LQZKXZFMSA-N	591.2978215							98236
BRD-K84528570	LSM-14957		44486404	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33-/m1/s1	LMYACBAJSFEPOG-GLPSKGHJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K84528570	BRD-K84528570-001-01-2	Broad Institute of MIT and Harvard	BRD-K84528570			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C35H47N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,41H,8-10,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33-/m1/s1	LMYACBAJSFEPOG-GLPSKGHJSA-N	617.357719654							103613
BRD-K03707297	LSM-14688		44502215	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25+,30+/m0/s1	YBLKRDGTGIUFGT-RZDWVWPCSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K03707297	BRD-K03707297-001-01-2	Broad Institute of MIT and Harvard	BRD-K03707297			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H49N5O5/c1-22(2)34-32(40)35-27-10-11-29-28(17-27)31(39)37(24(4)21-38)18-23(3)30(41-16-8-7-9-25(5)42-29)20-36(6)19-26-12-14-33-15-13-26/h10-15,17,22-25,30,38H,7-9,16,18-21H2,1-6H3,(H2,34,35,40)/t23-,24+,25+,30+/m0/s1	YBLKRDGTGIUFGT-RZDWVWPCSA-N	583.373369718							103344
BRD-K70496443	LSM-14909		54614986	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30-/m1/s1	JZEVKSWSVNZKOH-UBRKHCEVSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K70496443	BRD-K70496443-001-01-3	Broad Institute of MIT and Harvard	BRD-K70496443			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25+,30-/m1/s1	JZEVKSWSVNZKOH-UBRKHCEVSA-N	596.357385296							103565
BRD-K16050964	LSM-14730		54615015	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30+/m0/s1	JZEVKSWSVNZKOH-YDXRHMNESA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K16050964	BRD-K16050964-001-01-4	Broad Institute of MIT and Harvard	BRD-K16050964			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24+,25-,30+/m0/s1	JZEVKSWSVNZKOH-YDXRHMNESA-N	596.357385296							103386
BRD-K31826120	LSM-14791		44496416	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30-/m0/s1	JZEVKSWSVNZKOH-INVAMZEASA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K31826120	BRD-K31826120-001-01-9	Broad Institute of MIT and Harvard	BRD-K31826120			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)36(6)20-30-23(3)19-37(24(4)21-38)32(40)28-18-27(35-31(39)26-13-8-7-9-14-26)15-16-29(28)43-25(5)12-10-11-17-42-30/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H,34,41)(H,35,39)/t23-,24-,25+,30-/m0/s1	JZEVKSWSVNZKOH-INVAMZEASA-N	596.357385296							103447
BRD-K03245321	LSM-14686		54614993	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29+/m0/s1	IVNRRFOIDKKMKL-FSDPBTBWSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K03245321	BRD-K03245321-001-01-3	Broad Institute of MIT and Harvard	BRD-K03245321			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29+/m0/s1	IVNRRFOIDKKMKL-FSDPBTBWSA-N	591.2978215							103342
BRD-K07064094	LSM-14706		44490321	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24-,25+,30-/m0/s1	YYAGCQUXHYGTOT-INVAMZEASA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K07064094	BRD-K07064094-001-01-9	Broad Institute of MIT and Harvard	BRD-K07064094			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H49N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h7-9,13-16,18,22-25,30,39H,10-12,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24-,25+,30-/m0/s1	YYAGCQUXHYGTOT-INVAMZEASA-N	611.368284338							103362
BRD-K79732306	LSM-14941		44496473	InChI=1S/C29H50N4O5/c1-8-14-32(7)18-27-21(4)17-33(22(5)19-34)28(35)25-16-24(31-29(36)30-20(2)3)12-13-26(25)38-23(6)11-9-10-15-37-27/h12-13,16,20-23,27,34H,8-11,14-15,17-19H2,1-7H3,(H2,30,31,36)/t21-,22+,23-,27-/m1/s1	OXLKGXSDHBDOHC-QSGNWFJVSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K79732306	BRD-K79732306-001-01-8	Broad Institute of MIT and Harvard	BRD-K79732306			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H50N4O5/c1-8-14-32(7)18-27-21(4)17-33(22(5)19-34)28(35)25-16-24(31-29(36)30-20(2)3)12-13-26(25)38-23(6)11-9-10-15-37-27/h12-13,16,20-23,27,34H,8-11,14-15,17-19H2,1-7H3,(H2,30,31,36)/t21-,22+,23-,27-/m1/s1	OXLKGXSDHBDOHC-QSGNWFJVSA-N	534.37812074							103597
BRD-K36048022	LSM-14799		44492067	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21+,25-/m1/s1	YWYDVFGOYOJBGO-IZZGNVEXSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K36048022	BRD-K36048022-001-01-4	Broad Institute of MIT and Harvard	BRD-K36048022			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H46N4O5/c1-18(2)28-27(34)29-22-11-12-24-23(14-22)26(33)31(20(4)17-32)15-19(3)25(16-30(6)7)35-13-9-8-10-21(5)36-24/h11-12,14,18-21,25,32H,8-10,13,15-17H2,1-7H3,(H2,28,29,34)/t19-,20+,21+,25-/m1/s1	YWYDVFGOYOJBGO-IZZGNVEXSA-N	506.346820612							103455
BRD-K61991236	LSM-14884		54614996	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25+,30+/m0/s1	STZYNHZFNFWBAK-ZQIPMTRKSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K61991236	BRD-K61991236-001-01-5	Broad Institute of MIT and Harvard	BRD-K61991236			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25+,30+/m0/s1	STZYNHZFNFWBAK-ZQIPMTRKSA-N	617.41523453							103540
BRD-K95776192	LSM-14999		44616967	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25+,30-/m0/s1	STZYNHZFNFWBAK-INVAMZEASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K95776192	BRD-K95776192-001-01-2	Broad Institute of MIT and Harvard	BRD-K95776192			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H55N5O6/c1-22(2)34-32(41)35-27-15-16-29-28(18-27)31(40)38(24(4)21-39)19-23(3)30(43-17-11-10-12-25(5)44-29)20-37(6)33(42)36-26-13-8-7-9-14-26/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,36,42)(H2,34,35,41)/t23-,24-,25+,30-/m0/s1	STZYNHZFNFWBAK-INVAMZEASA-N	617.41523453							103655
BRD-K93599975-001-01-3	LSM-16847	BRD-K93599975	44616491	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29-/m1/s1	IVNRRFOIDKKMKL-PZNASWHRSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K93599975	BRD-K93599975-001-01-3	Broad Institute of MIT and Harvard	BRD-K93599975			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29-/m1/s1	IVNRRFOIDKKMKL-PZNASWHRSA-N	591.2978215							105484
ASN 05073759	LSM-16848	SID24789784, BRD-A36897132	3193446	InChI=1S/C26H31N7O/c1-4-26(2,3)33-25(28-29-30-33)24(20-7-12-23-19(18-20)6-5-13-27-23)32-16-14-31(15-17-32)21-8-10-22(34)11-9-21/h5-13,18,24,34H,4,14-17H2,1-3H3	ICDKBCHZJUMXBU-UHFFFAOYSA-N	CCC(C)(C)n1nnnc1C(N2CCN(CC2)c3ccc(O)cc3)c4ccc5ncccc5c4	BroadT	BRD-A36897132	BRD-A36897132-001-05-4	Asinex Ltd.	ASN 05073759			CCC(C)(C)n1nnnc1C(N1CCN(CC1)c1ccc(O)cc1)c1ccc2ncccc2c1	InChI=1S/C26H31N7O/c1-4-26(2,3)33-25(28-29-30-33)24(20-7-12-23-19(18-20)6-5-13-27-23)32-16-14-31(15-17-32)21-8-10-22(34)11-9-21/h5-13,18,24,34H,4,14-17H2,1-3H3	ICDKBCHZJUMXBU-UHFFFAOYSA-N	457.259008682							105485
SMR000248799	LSM-43670	SID22403064, BRD-K25864844	15944938	InChI=1S/C29H24N2O4S/c1-18(32)19-11-13-21(14-12-19)30-26(33)17-35-29(34)27-23-8-2-3-10-25(23)31-28-20(6-4-9-24(27)28)16-22-7-5-15-36-22/h2-3,5,7-8,10-16H,4,6,9,17H2,1H3,(H,30,33)/b20-16-	VJGDROGPTBOECG-SILNSSARSA-N	CC(=O)c1ccc(NC(=O)COC(=O)c2c3CCC\C(=C\c4cccs4)\c3nc5ccccc25)cc1	BroadT	BRD-K25864844	BRD-K25864844-001-06-2	Enamine Ltd.	T5240399			CC(=O)c1ccc(NC(=O)COC(=O)c2c3CCC\C(=C\c4cccs4)c3nc3ccccc23)cc1	InChI=1S/C29H24N2O4S/c1-18(32)19-11-13-21(14-12-19)30-26(33)17-35-29(34)27-23-8-2-3-10-25(23)31-28-20(6-4-9-24(27)28)16-22-7-5-15-36-22/h2-3,5,7-8,10-16H,4,6,9,17H2,1H3,(H,30,33)/b20-16-	VJGDROGPTBOECG-SILNSSARSA-N	496.145677958							
AC1LD4X0	LSM-15258	BRD-K40677376	661289	InChI=1S/C18H25N3O/c1-5-19(6-2)10-11-20-16-9-7-8-15-13(3)14(4)21(18(15)16)12-17(20)22/h7-9H,5-6,10-12H2,1-4H3	RJZQXZPRWWWLFS-UHFFFAOYSA-N	CCN(CC)CCN1C(=O)Cn2c(C)c(C)c3cccc1c23	BroadT	BRD-K40677376	BRD-K40677376-003-05-3	InterBioScreen Ltd.	STOCK3S-49695		Cl	CCN(CC)CCN1C(=O)Cn2c(C)c(C)c3cccc1c23.Cl	InChI=1S/C18H25N3O.ClH/c1-5-19(6-2)10-11-20-16-9-7-8-15-13(3)14(4)21(18(15)16)12-17(20)22;/h7-9H,5-6,10-12H2,1-4H3;1H	ZVKPDOQNDHRPEK-UHFFFAOYSA-N	299.19976245							103905, 103905, 103905
AC1LLURU	LSM-43671	SID17509063, BRD-K00882705	1073683	InChI=1S/C27H25N3O3/c1-19-9-10-20(2)26(14-19)33-13-11-30-18-22(24-7-3-4-8-25(24)30)15-21(16-28)27(31)29-17-23-6-5-12-32-23/h3-10,12,14-15,18H,11,13,17H2,1-2H3,(H,29,31)/b21-15+	VUFLSYNVLFSVIG-RCCKNPSSSA-N	Cc1ccc(C)c(OCCn2cc(\C=C(/C#N)\C(=O)NCc3occc3)c4ccccc24)c1	BroadT	BRD-K00882705	BRD-K00882705-001-06-1	Asinex Ltd.	BAS 02104915			Cc1ccc(C)c(OCCn2cc(\C=C(/C#N)C(=O)NCc3ccco3)c3ccccc23)c1	InChI=1S/C27H25N3O3/c1-19-9-10-20(2)26(14-19)33-13-11-30-18-22(24-7-3-4-8-25(24)30)15-21(16-28)27(31)29-17-23-6-5-12-32-23/h3-10,12,14-15,18H,11,13,17H2,1-2H3,(H,29,31)/b21-15+	VUFLSYNVLFSVIG-RCCKNPSSSA-N	439.18959169							
AC1N6IMF	LSM-16851	BRD-A08091849	4260586	InChI=1S/C24H29ClN4O4S/c1-15-12-29(13-16(2)33-15)23(30)14-32-21-9-8-18(10-22(21)31-4)11-26-28-24(34)27-20-7-5-6-19(25)17(20)3/h5-11,15-16H,12-14H2,1-4H3,(H2,27,28,34)	LRUMHJWUSZOFLY-UHFFFAOYSA-N	COc1cc(C=NN=C(S)Nc2cccc(Cl)c2C)ccc1OCC(=O)N3CC(C)OC(C)C3	BroadT	BRD-A08091849	BRD-A08091849-001-06-0	Enamine Ltd.	T5211937			COc1cc(C=NN=C(S)Nc2cccc(Cl)c2C)ccc1OCC(=O)N1CC(C)OC(C)C1	InChI=1S/C24H29ClN4O4S/c1-15-12-29(13-16(2)33-15)23(30)14-32-21-9-8-18(10-22(21)31-4)11-26-28-24(34)27-20-7-5-6-19(25)17(20)3/h5-11,15-16H,12-14H2,1-4H3,(H2,27,28,34)	LRUMHJWUSZOFLY-UHFFFAOYSA-N	504.159803848							105488
AC1MW59H	LSM-16852	BRD-K52473712	3694058	InChI=1S/C16H11BrN4O/c17-13-4-2-12(3-5-13)16(22)21-20-10-11-1-6-14-15(9-11)19-8-7-18-14/h1-10H,(H,21,22)	DKSSXGFTZNCTDE-UHFFFAOYSA-N	Brc1ccc(cc1)C(=O)NN=Cc2ccc3nccnc3c2	BroadT	BRD-K52473712	BRD-K52473712-001-04-2	InterBioScreen Ltd.	STOCK5S-24079			Brc1ccc(cc1)C(=O)NN=Cc1ccc2nccnc2c1	InChI=1S/C16H11BrN4O/c17-13-4-2-12(3-5-13)16(22)21-20-10-11-1-6-14-15(9-11)19-8-7-18-14/h1-10H,(H,21,22)	DKSSXGFTZNCTDE-UHFFFAOYSA-N	354.011623612							105489
SMR000023662	LSM-16853	SID4244316, BRD-K86110370	3238932	InChI=1S/C19H20N4O3/c1-25-14-4-6-15-13(11-14)3-5-16-17(22-26-18(15)16)19(24)21-7-2-9-23-10-8-20-12-23/h4,6,8,10-12H,2-3,5,7,9H2,1H3,(H,21,24)	XCFRVASMUIEGJM-UHFFFAOYSA-N	COc1ccc2c(CCc3c2onc3C(=O)NCCCn4ccnc4)c1	BroadT	BRD-K86110370	BRD-K86110370-001-05-0	ChemDiv Inc.	C226-4010			COc1ccc2-c3onc(C(=O)NCCCn4ccnc4)c3CCc2c1	InChI=1S/C19H20N4O3/c1-25-14-4-6-15-13(11-14)3-5-16-17(22-26-18(15)16)19(24)21-7-2-9-23-10-8-20-12-23/h4,6,8,10-12H,2-3,5,7,9H2,1H3,(H,21,24)	XCFRVASMUIEGJM-UHFFFAOYSA-N	352.15354054							105490
ST063170	LSM-16854	SID846945, BRD-K43729072	649337	InChI=1S/C19H23N3O/c1-16(23)21-11-13-22(14-12-21)19-9-7-18(8-10-19)20-15-17-5-3-2-4-6-17/h2-10,20H,11-15H2,1H3	WRBUDWDUKVSBNY-UHFFFAOYSA-N	CC(=O)N1CCN(CC1)c2ccc(NCc3ccccc3)cc2	BroadT	BRD-K43729072	BRD-K43729072-001-06-8	Asinex Ltd.	BAS 07021447			CC(=O)N1CCN(CC1)c1ccc(NCc2ccccc2)cc1	InChI=1S/C19H23N3O/c1-16(23)21-11-13-22(14-12-21)19-9-7-18(8-10-19)20-15-17-5-3-2-4-6-17/h2-10,20H,11-15H2,1H3	WRBUDWDUKVSBNY-UHFFFAOYSA-N	309.184112386							105491
2-[(2-Bromobenzyl)oxy]benzoic acid	LSM-2422	BRD-K18953385, SID24838021	2160985	InChI=1S/C14H11BrO3/c15-12-7-3-1-5-10(12)9-18-13-8-4-2-6-11(13)14(16)17/h1-8H,9H2,(H,16,17)	IYPKPTAZUPMKGH-UHFFFAOYSA-N	OC(=O)c1ccccc1OCc2ccccc2Br	BroadT	BRD-K18953385	BRD-K18953385-001-05-9	Enamine Ltd.	T5225985			OC(=O)c1ccccc1OCc1ccccc1Br	InChI=1S/C14H11BrO3/c15-12-7-3-1-5-10(12)9-18-13-8-4-2-6-11(13)14(16)17/h1-8H,9H2,(H,16,17)	IYPKPTAZUPMKGH-UHFFFAOYSA-N	305.989156812							92345
MLS000074341	LSM-16855	SID842752, BRD-K69771711	645027	InChI=1S/C17H17N3OS2/c18-14-11-7-8-12(13-6-3-9-22-13)20-17(11)23-15(14)16(21)19-10-4-1-2-5-10/h3,6-10H,1-2,4-5,18H2,(H,19,21)	HTUWAYYTRCAGAL-UHFFFAOYSA-N	Nc1c(sc2nc(ccc12)c3cccs3)C(=O)NC4CCCC4	BroadT	BRD-K69771711	BRD-K69771711-001-05-8	Asinex Ltd.	BAS 06900271			Nc1c(sc2nc(ccc12)-c1cccs1)C(=O)NC1CCCC1	InChI=1S/C17H17N3OS2/c18-14-11-7-8-12(13-6-3-9-22-13)20-17(11)23-15(14)16(21)19-10-4-1-2-5-10/h3,6-10H,1-2,4-5,18H2,(H,19,21)	HTUWAYYTRCAGAL-UHFFFAOYSA-N	343.081303574							105492
ST50371429	LSM-16856	SID7965776, BRD-A85854481	3162345	InChI=1S/C20H21NO5/c1-3-24-20-12(5-4-6-16(20)23-2)13-10-19(22)21-15-11-18-17(9-14(13)15)25-7-8-26-18/h4-6,9,11,13H,3,7-8,10H2,1-2H3,(H,21,22)	HFLRNLKKFQRTCE-UHFFFAOYSA-N	CCOc1c(OC)cccc1C2CC(=O)Nc3cc4OCCOc4cc23	BroadT	BRD-A85854481	BRD-A85854481-001-04-5	ChemDiv Inc.	C276-0729			CCOc1c(OC)cccc1C1CC(=O)Nc2cc3OCCOc3cc12	InChI=1S/C20H21NO5/c1-3-24-20-12(5-4-6-16(20)23-2)13-10-19(22)21-15-11-18-17(9-14(13)15)25-7-8-26-18/h4-6,9,11,13H,3,7-8,10H2,1-2H3,(H,21,22)	HFLRNLKKFQRTCE-UHFFFAOYSA-N	355.141972782							105493
T5302029	LSM-16857	SID24834481, BRD-K97357300	2562424	InChI=1S/C12H12ClF3N2O3S/c1-7(19)17-2-4-18(5-3-17)22(20,21)12-9(15)6-8(14)10(13)11(12)16/h6H,2-5H2,1H3	NJTIJFAEEKEFSS-UHFFFAOYSA-N	CC(=O)N1CCN(CC1)S(=O)(=O)c2c(F)cc(F)c(Cl)c2F	BroadT	BRD-K97357300	BRD-K97357300-001-05-9	Enamine Ltd.	T5302029			CC(=O)N1CCN(CC1)S(=O)(=O)c1c(F)cc(F)c(Cl)c1F	InChI=1S/C12H12ClF3N2O3S/c1-7(19)17-2-4-18(5-3-17)22(20,21)12-9(15)6-8(14)10(13)11(12)16/h6H,2-5H2,1H3	NJTIJFAEEKEFSS-UHFFFAOYSA-N	356.020925264							105494
F0526-2250	LSM-16858	SID17514563, BRD-K41585006	12005862	InChI=1S/C25H20N2O4S/c1-14-21(12-15-9-10-19-20(11-15)31-13-30-19)32-25(22(14)23(26)28)27-24(29)18-8-4-6-16-5-2-3-7-17(16)18/h2-11H,12-13H2,1H3,(H2,26,28)(H,27,29)	CJJWJXLYSJKGPX-UHFFFAOYSA-N	Cc1c(Cc2ccc3OCOc3c2)sc(NC(=O)c4cccc5ccccc45)c1C(=O)N	BroadT	BRD-K41585006	BRD-K41585006-001-05-9	Life Chemicals Inc.	F0526-2250			Cc1c(Cc2ccc3OCOc3c2)sc(NC(=O)c2cccc3ccccc23)c1C(N)=O	InChI=1S/C25H20N2O4S/c1-14-21(12-15-9-10-19-20(11-15)31-13-30-19)32-25(22(14)23(26)28)27-24(29)18-8-4-6-16-5-2-3-7-17(16)18/h2-11H,12-13H2,1H3,(H2,26,28)(H,27,29)	CJJWJXLYSJKGPX-UHFFFAOYSA-N	444.11437783							105495
MLS001232221	LSM-16859	SID49828698, BRD-K60217006	2207232	InChI=1S/C15H14N4O6S/c1-10(20)11-2-4-12(5-3-11)16-15(21)17-18-26(24,25)14-8-6-13(7-9-14)19(22)23/h2-9,18H,1H3,(H2,16,17,21)	HGYCGLNGAFWPDB-UHFFFAOYSA-N	CC(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(cc2)[N+](=O)[O-])cc1	BroadT	BRD-K60217006	BRD-K60217006-001-06-3	Chemical Technologies & Investigations	UZI/1635736			CC(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)cc1	InChI=1S/C15H14N4O6S/c1-10(20)11-2-4-12(5-3-11)16-15(21)17-18-26(24,25)14-8-6-13(7-9-14)19(22)23/h2-9,18H,1H3,(H2,16,17,21)	HGYCGLNGAFWPDB-UHFFFAOYSA-N	378.063404898							105496
MLS000710671	LSM-16860	SID24789501, BRD-K86876475	702333	InChI=1S/C15H16N2OS/c1-15(2)8-9-6-4-5-7-10(9)12-11(15)13(18)17(3)14(19)16-12/h4-7H,8H2,1-3H3,(H,16,19)	QESSEGSTHNDARV-UHFFFAOYSA-N	CN1C(=S)NC2=C(C1=O)C(C)(C)Cc3ccccc23	BroadT	BRD-K86876475	BRD-K86876475-001-05-0	Asinex Ltd.	BAS 01217187			Cn1c(=S)[nH]c2-c3ccccc3CC(C)(C)c2c1=O	InChI=1S/C15H16N2OS/c1-15(2)8-9-6-4-5-7-10(9)12-11(15)13(18)17(3)14(19)16-12/h4-7H,8H2,1-3H3,(H,16,19)	QESSEGSTHNDARV-UHFFFAOYSA-N	272.098333842							105497
AC1NLC7D	LSM-16861	SID17505827, BRD-A67558291	4978215	InChI=1S/C15H20N6O3/c1-10-4-2-6-20(9-10)14-12(21(22)23)13(16)18-15(19-14)17-8-11-5-3-7-24-11/h3,5,7,10H,2,4,6,8-9H2,1H3,(H3,16,17,18,19)	BMOMGGXGNNCQLN-UHFFFAOYSA-N	CC1CCCN(C1)c2nc(NCc3occc3)nc(N)c2[N+](=O)[O-]	BroadT	BRD-A67558291	BRD-A67558291-001-05-1	InterBioScreen Ltd.	STOCK4S-73276			CC1CCCN(C1)c1nc(NCc2ccco2)nc(N)c1[N+]([O-])=O	InChI=1S/C15H20N6O3/c1-10-4-2-6-20(9-10)14-12(21(22)23)13(16)18-15(19-14)17-8-11-5-3-7-24-11/h3,5,7,10H,2,4,6,8-9H2,1H3,(H3,16,17,18,19)	BMOMGGXGNNCQLN-UHFFFAOYSA-N	332.15968856							105498
Thiazole, 4-(4-nitrophenyl)-2-(tetrahydro-2,2-dimethyl-2H-pyran-4-yl)-	LSM-16862	SID24802718, BRD-A66152327	3112830	InChI=1S/C16H18N2O3S/c1-16(2)9-12(7-8-21-16)15-17-14(10-22-15)11-3-5-13(6-4-11)18(19)20/h3-6,10,12H,7-9H2,1-2H3	DQSMZCRNWAFLGI-UHFFFAOYSA-N	CC1(C)CC(CCO1)c2nc(cs2)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-A66152327	BRD-A66152327-001-05-2	Asinex Ltd.	BAS 00608678			CC1(C)CC(CCO1)c1nc(cs1)-c1ccc(cc1)[N+]([O-])=O	InChI=1S/C16H18N2O3S/c1-16(2)9-12(7-8-21-16)15-17-14(10-22-15)11-3-5-13(6-4-11)18(19)20/h3-6,10,12H,7-9H2,1-2H3	DQSMZCRNWAFLGI-UHFFFAOYSA-N	318.103813146							105499
BAS 06339517	LSM-16863	SID24807164, BRD-K33766520	1084374	InChI=1S/C15H16N2O3S/c1-3-20-15(19)12-9(2)11(13(16)21-12)14(18)17-10-7-5-4-6-8-10/h4-8H,3,16H2,1-2H3,(H,17,18)	DVFVNLSLZADOIQ-UHFFFAOYSA-N	CCOC(=O)c1sc(N)c(C(=O)Nc2ccccc2)c1C	BroadT	BRD-K33766520	BRD-K33766520-001-05-2	Asinex Ltd.	BAS 06339517			CCOC(=O)c1sc(N)c(C(=O)Nc2ccccc2)c1C	InChI=1S/C15H16N2O3S/c1-3-20-15(19)12-9(2)11(13(16)21-12)14(18)17-10-7-5-4-6-8-10/h4-8H,3,16H2,1-2H3,(H,17,18)	DVFVNLSLZADOIQ-UHFFFAOYSA-N	304.088163082							105500
AC1LFRFX	LSM-16864	BRD-K23164563	758613	InChI=1S/C18H19NO/c1-13-4-7-16(8-5-13)18(20)10-11-19-17-9-6-14(2)15(3)12-17/h4-12,19H,1-3H3	CIAMLHZCZHEMRV-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)C=CNc2ccc(C)c(C)c2	BroadT	BRD-K23164563	BRD-K23164563-001-05-0	Specs	AG-670/07818022			Cc1ccc(cc1)C(=O)C=CNc1ccc(C)c(C)c1	InChI=1S/C18H19NO/c1-13-4-7-16(8-5-13)18(20)10-11-19-17-9-6-14(2)15(3)12-17/h4-12,19H,1-3H3	CIAMLHZCZHEMRV-UHFFFAOYSA-N	265.146664238							105501
T5535119	LSM-16865	SID49673446, BRD-A42388265	16293736	InChI=1S/C24H25N3O4S2/c1-4-14-27(23(29)15-21(25-17(2)28)18-8-6-5-7-9-18)24-26-22(16-32-24)19-10-12-20(13-11-19)33(3,30)31/h4-13,16,21H,1,14-15H2,2-3H3,(H,25,28)	IKJIOKLLFRSHTA-UHFFFAOYSA-N	CC(=O)NC(CC(=O)N(CC=C)c1nc(cs1)c2ccc(cc2)S(=O)(=O)C)c3ccccc3	BroadT	BRD-A42388265	BRD-A42388265-001-05-5	Enamine Ltd.	T5535119			CC(=O)NC(CC(=O)N(CC=C)c1nc(cs1)-c1ccc(cc1)S(C)(=O)=O)c1ccccc1	InChI=1S/C24H25N3O4S2/c1-4-14-27(23(29)15-21(25-17(2)28)18-8-6-5-7-9-18)24-26-22(16-32-24)19-10-12-20(13-11-19)33(3,30)31/h4-13,16,21H,1,14-15H2,2-3H3,(H,25,28)	IKJIOKLLFRSHTA-UHFFFAOYSA-N	483.12864769							105502
1-(5-Tert-butyl-1,3,4-thiadiazol-2-yl)-3-(4-chlorophenyl)urea	LSM-16866	SID26666553, BRD-K42493668	741053	InChI=1S/C13H15ClN4OS/c1-13(2,3)10-17-18-12(20-10)16-11(19)15-9-6-4-8(14)5-7-9/h4-7H,1-3H3,(H2,15,16,18,19)	QMLMRVCBHRTPFT-UHFFFAOYSA-N	CC(C)(C)c1nnc(NC(=O)Nc2ccc(Cl)cc2)s1	BroadT	BRD-K42493668	BRD-K42493668-001-05-4	InterBioScreen Ltd.	STOCK2S-51407			CC(C)(C)c1nnc(NC(=O)Nc2ccc(Cl)cc2)s1	InChI=1S/C13H15ClN4OS/c1-13(2,3)10-17-18-12(20-10)16-11(19)15-9-6-4-8(14)5-7-9/h4-7H,1-3H3,(H2,15,16,18,19)	QMLMRVCBHRTPFT-UHFFFAOYSA-N	310.06550954							105503
AK-968/41024746	LSM-16867	SID17433049, BRD-K42757079	842069	InChI=1S/C15H10Cl2N2OS/c1-8-4-5-18-12(6-8)19-15(20)14-13(17)10-3-2-9(16)7-11(10)21-14/h2-7H,1H3,(H,18,19,20)	IWHUWWSQDDVDFL-UHFFFAOYSA-N	Cc1ccnc(NC(=O)c2sc3cc(Cl)ccc3c2Cl)c1	BroadT	BRD-K42757079	BRD-K42757079-001-05-5	ChemBridge Corporation	6627367			Cc1ccnc(NC(=O)c2sc3cc(Cl)ccc3c2Cl)c1	InChI=1S/C15H10Cl2N2OS/c1-8-4-5-18-12(6-8)19-15(20)14-13(17)10-3-2-9(16)7-11(10)21-14/h2-7H,1H3,(H,18,19,20)	IWHUWWSQDDVDFL-UHFFFAOYSA-N	335.98908907							105504
AK-968/40642710	LSM-16868	SID24786779, BRD-K92362926	1757274	InChI=1S/C15H13N3O6S/c1-7-10(15(21)24-2)14(25-11(7)12(16)19)17-13(20)8-4-3-5-9(6-8)18(22)23/h3-6H,1-2H3,(H2,16,19)(H,17,20)	RLGHZYYWDCELHZ-UHFFFAOYSA-N	COC(=O)c1c(C)c(sc1NC(=O)c2cccc(c2)[N+](=O)[O-])C(=O)N	BroadT	BRD-K92362926	BRD-K92362926-001-06-6	Specs	AK-968/40642710			COC(=O)c1c(NC(=O)c2cccc(c2)[N+]([O-])=O)sc(C(N)=O)c1C	InChI=1S/C15H13N3O6S/c1-7-10(15(21)24-2)14(25-11(7)12(16)19)17-13(20)8-4-3-5-9(6-8)18(22)23/h3-6H,1-2H3,(H2,16,19)(H,17,20)	RLGHZYYWDCELHZ-UHFFFAOYSA-N	363.052505856							105505
SMR000003457	LSM-16869	SID26667533, SID850158, BRD-K33447421	652670	InChI=1S/C25H24N6O/c1-29(2)21-15-13-20(14-16-21)25-26-28-30(27-25)17-24(32)31-22-9-5-3-7-18(22)11-12-19-8-4-6-10-23(19)31/h3-10,13-16H,11-12,17H2,1-2H3	SPRJMBRCAXESKO-UHFFFAOYSA-N	CN(C)c1ccc(cc1)c2nnn(CC(=O)N3c4ccccc4CCc5ccccc35)n2	BroadT	BRD-K33447421	BRD-K33447421-001-05-9	Asinex Ltd.	ASN 04450036			CN(C)c1ccc(cc1)-c1nnn(CC(=O)N2c3ccccc3CCc3ccccc23)n1	InChI=1S/C25H24N6O/c1-29(2)21-15-13-20(14-16-21)25-26-28-30(27-25)17-24(32)31-22-9-5-3-7-18(22)11-12-19-8-4-6-10-23(19)31/h3-10,13-16H,11-12,17H2,1-2H3	SPRJMBRCAXESKO-UHFFFAOYSA-N	424.201159448							105506
MLS000040081	LSM-16870	SID860897, BRD-A01918084	662170	InChI=1S/C16H12Cl2N2O3/c17-10-6-11(18)8-13(7-10)19-15(21)9-14(16(19)22)20(23)12-4-2-1-3-5-12/h1-8,14,23H,9H2	CXUMIBXWRDNFEW-UHFFFAOYSA-N	ON(C1CC(=O)N(C1=O)c2cc(Cl)cc(Cl)c2)c3ccccc3	BroadT	BRD-A01918084	BRD-A01918084-001-05-7	InterBioScreen Ltd.	STOCK3S-93642			ON(C1CC(=O)N(C1=O)c1cc(Cl)cc(Cl)c1)c1ccccc1	InChI=1S/C16H12Cl2N2O3/c17-10-6-11(18)8-13(7-10)19-15(21)9-14(16(19)22)20(23)12-4-2-1-3-5-12/h1-8,14,23H,9H2	CXUMIBXWRDNFEW-UHFFFAOYSA-N	350.022497684							105507
MLS000708943	LSM-43672	SID24789646, BRD-K47642689	753352	InChI=1S/C14H14N2O4/c1-2-20-14(17)10-15-9-11(7-8-16(18)19)12-5-3-4-6-13(12)15/h3-9H,2,10H2,1H3/b8-7+	IEOGPWHCLFLAGG-BQYQJAHWSA-N	CCOC(=O)Cn1cc(\C=C\[N+](=O)[O-])c2ccccc12	BroadT	BRD-K47642689	BRD-K47642689-001-05-6	Asinex Ltd.	BAS 05523138			CCOC(=O)Cn1cc(\C=C\[N+]([O-])=O)c2ccccc12	InChI=1S/C14H14N2O4/c1-2-20-14(17)10-15-9-11(7-8-16(18)19)12-5-3-4-6-13(12)15/h3-9H,2,10H2,1H3/b8-7+	IEOGPWHCLFLAGG-BQYQJAHWSA-N	274.095356948							
MLS000684370	LSM-3444	SID24790793, BRD-K64738596	2225472	InChI=1S/C16H18ClN3O4S/c17-14-12-3-2-11(20(22)23)10-13(12)25-15(14)16(21)18-4-1-5-19-6-8-24-9-7-19/h2-3,10H,1,4-9H2,(H,18,21)	HCFCGILXICFWLF-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2c(Cl)c(sc2c1)C(=O)NCCCN3CCOCC3	BroadT	BRD-K64738596	BRD-K64738596-001-05-2	ChemBridge Corporation	7948711			[O-][N+](=O)c1ccc2c(Cl)c(sc2c1)C(=O)NCCCN1CCOCC1	InChI=1S/C16H18ClN3O4S/c17-14-12-3-2-11(20(22)23)10-13(12)25-15(14)16(21)18-4-1-5-19-6-8-24-9-7-19/h2-3,10H,1,4-9H2,(H,18,21)	HCFCGILXICFWLF-UHFFFAOYSA-N	383.070654486							93133
SMR000022709	LSM-16872	SID4244714, BRD-K90545149	2157330	InChI=1S/C16H14N2O4/c1-2-21-16(20)14-13(10-6-3-4-7-11(10)17-14)18-15(19)12-8-5-9-22-12/h3-9,17H,2H2,1H3,(H,18,19)	LPXKYNWQXZMLJC-UHFFFAOYSA-N	CCOC(=O)c1[nH]c2ccccc2c1NC(=O)c3occc3	BroadT	BRD-K90545149	BRD-K90545149-001-05-1	ChemDiv Inc.	C175-0104			CCOC(=O)c1[nH]c2ccccc2c1NC(=O)c1ccco1	InChI=1S/C16H14N2O4/c1-2-21-16(20)14-13(10-6-3-4-7-11(10)17-14)18-15(19)12-8-5-9-22-12/h3-9,17H,2H2,1H3,(H,18,19)	LPXKYNWQXZMLJC-UHFFFAOYSA-N	298.095356948							105509
MLS000544662	LSM-16873	SID17406894, SID87225776, BRD-K89785473	1214668	InChI=1S/C18H12Br2N4/c1-11-17-16(10-24(23-17)15-7-5-13(19)6-8-15)18(22-21-11)12-3-2-4-14(20)9-12/h2-10H,1H3	SRFXJTJKQWBUMX-UHFFFAOYSA-N	Cc1nnc(c2cccc(Br)c2)c3cn(nc13)c4ccc(Br)cc4	BroadT	BRD-K89785473	BRD-K89785473-001-06-0	Specs	AJ-916/40989362			Cc1nnc(-c2cccc(Br)c2)c2cn(nc12)-c1ccc(Br)cc1	InChI=1S/C18H12Br2N4/c1-11-17-16(10-24(23-17)15-7-5-13(19)6-8-15)18(22-21-11)12-3-2-4-14(20)9-12/h2-10H,1H3	SRFXJTJKQWBUMX-UHFFFAOYSA-N	441.942871624							105510
STK589635	LSM-16874	SID17408328, BRD-A19166163	3157041	InChI=1S/C15H11N3OS2/c16-9-11-14(19)17-13(12-7-4-8-21-12)18(15(11)20)10-5-2-1-3-6-10/h1-8,13,20H,(H,17,19)	DVOZOHPFZNCFDJ-UHFFFAOYSA-N	SC1=C(C#N)C(=O)NC(N1c2ccccc2)c3cccs3	BroadT	BRD-A19166163	BRD-A19166163-001-05-7	Asinex Ltd.	BAS 07778062			SC1=C(C#N)C(=O)NC(N1c1ccccc1)c1cccs1	InChI=1S/C15H11N3OS2/c16-9-11-14(19)17-13(12-7-4-8-21-12)18(15(11)20)10-5-2-1-3-6-10/h1-8,13,20H,(H,17,19)	DVOZOHPFZNCFDJ-UHFFFAOYSA-N	313.034353382							105511
ZINC03099349	LSM-16875	SID858222, BRD-K18439299	659569	InChI=1S/C14H14N2O2S/c1-18-12-6-4-5-11(9-12)16-13(17)10-19-14-7-2-3-8-15-14/h2-9H,10H2,1H3,(H,16,17)	MFTVFXPJYXZUGK-UHFFFAOYSA-N	COc1cccc(NC(=O)CSc2ccccn2)c1	BroadT	BRD-K18439299	BRD-K18439299-001-05-4	InterBioScreen Ltd.	STOCK2S-30869			COc1cccc(NC(=O)CSc2ccccn2)c1	InChI=1S/C14H14N2O2S/c1-18-12-6-4-5-11(9-12)16-13(17)10-19-14-7-2-3-8-15-14/h2-9H,10H2,1H3,(H,16,17)	MFTVFXPJYXZUGK-UHFFFAOYSA-N	274.077598398							105512
5-Bromo-n-(tetrahydro-2-furanylmethyl)-2-thiophenesulfonamide	LSM-16876	SID4255290, BRD-A62548643	2948489	InChI=1S/C9H12BrNO3S2/c10-8-3-4-9(15-8)16(12,13)11-6-7-2-1-5-14-7/h3-4,7,11H,1-2,5-6H2	YMSHOOSWNDOXNW-UHFFFAOYSA-N	Brc1ccc(s1)S(=O)(=O)NCC2CCCO2	BroadT	BRD-A62548643	BRD-A62548643-001-05-2	ChemBridge Corporation	7698486			Brc1ccc(s1)S(=O)(=O)NCC1CCCO1	InChI=1S/C9H12BrNO3S2/c10-8-3-4-9(15-8)16(12,13)11-6-7-2-1-5-14-7/h3-4,7,11H,1-2,5-6H2	YMSHOOSWNDOXNW-UHFFFAOYSA-N	324.944197234							105513
T5330691	LSM-16877	SID3717616, BRD-K99019859	2576479	InChI=1S/C18H22N2O4S2/c1-4-23-18(22)16-14(12-5-6-12)8-26-17(16)19-15(21)9-25-7-13-10(2)20-24-11(13)3/h8,12H,4-7,9H2,1-3H3,(H,19,21)	MHTRURIKBXQYST-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)CSCc2c(C)onc2C)scc1C3CC3	BroadT	BRD-K99019859	BRD-K99019859-001-05-8	Enamine Ltd.	T5330691			CCOC(=O)c1c(NC(=O)CSCc2c(C)noc2C)scc1C1CC1	InChI=1S/C18H22N2O4S2/c1-4-23-18(22)16-14(12-5-6-12)8-26-17(16)19-15(21)9-25-7-13-10(2)20-24-11(13)3/h8,12H,4-7,9H2,1-3H3,(H,19,21)	MHTRURIKBXQYST-UHFFFAOYSA-N	394.102098584							105514
MLS000119002	LSM-16878	SID7968412, BRD-K50701665	5309392	InChI=1S/C21H22N6/c1-2-7-17-14-26(13-10-16(17)6-1)12-5-11-22-20-21-25-23-15-27(21)19-9-4-3-8-18(19)24-20/h1-4,6-9,15H,5,10-14H2,(H,22,24)	DDNCFJVDHUFTSI-UHFFFAOYSA-N	C(CNc1nc2ccccc2n3cnnc13)CN4CCc5ccccc5C4	BroadT	BRD-K50701665	BRD-K50701665-001-02-9	ChemDiv Inc.	C735-0058			C(CNc1nc2ccccc2n2cnnc12)CN1CCc2ccccc2C1	InChI=1S/C21H22N6/c1-2-7-17-14-26(13-10-16(17)6-1)12-5-11-22-20-21-25-23-15-27(21)19-9-4-3-8-18(19)24-20/h1-4,6-9,15H,5,10-14H2,(H,22,24)	DDNCFJVDHUFTSI-UHFFFAOYSA-N	358.190594764							105515
MLS000332913	LSM-43673	SID26661996, BRD-K26541322	5517961	InChI=1S/C23H24N4O6/c1-14(28)25-17-7-5-16(6-8-17)24-13-18-21(29)26-23(31)27(22(18)30)11-10-15-4-9-19(32-2)20(12-15)33-3/h4-9,12-13,24H,10-11H2,1-3H3,(H,25,28)(H,26,29,31)/b18-13+	YIYRLFJOQLGDMQ-QGOAFFKASA-N	COc1ccc(CCN2C(=O)NC(=O)\C(=C/Nc3ccc(NC(=O)C)cc3)\C2=O)cc1OC	BroadT	BRD-K26541322	BRD-K26541322-001-06-6	InterBioScreen Ltd.	STOCK3S-95640			COc1ccc(CCN2C(=O)NC(=O)\C(=C/Nc3ccc(NC(C)=O)cc3)C2=O)cc1OC	InChI=1S/C23H24N4O6/c1-14(28)25-17-7-5-16(6-8-17)24-13-18-21(29)26-23(31)27(22(18)30)11-10-15-4-9-19(32-2)20(12-15)33-3/h4-9,12-13,24H,10-11H2,1-3H3,(H,25,28)(H,26,29,31)/b18-13+	YIYRLFJOQLGDMQ-QGOAFFKASA-N	452.169584528							
6267-40-9	LSM-16880	SID3714756, BRD-K63988672	235997	InChI=1S/C10H17NO6/c1-4-16-8(14)10(6-12,11-7(3)13)9(15)17-5-2/h12H,4-6H2,1-3H3,(H,11,13)	ZJJNFDMJQOSWEJ-UHFFFAOYSA-N	CCOC(=O)C(CO)(NC(=O)C)C(=O)OCC	BroadT	BRD-K63988672	BRD-K63988672-001-05-1	Enamine Ltd.	T0400-1739			CCOC(=O)C(CO)(NC(C)=O)C(=O)OCC	InChI=1S/C10H17NO6/c1-4-16-8(14)10(6-12,11-7(3)13)9(15)17-5-2/h12H,4-6H2,1-3H3,(H,11,13)	ZJJNFDMJQOSWEJ-UHFFFAOYSA-N	247.105587274							105517
CHEMBL1427920	LSM-16881	SID24819158, BRD-A45102875	2739390	InChI=1S/C14H12F3NS/c15-14(16,17)10-3-1-9(2-4-10)13-11-6-8-19-12(11)5-7-18-13/h1-4,6,8,13,18H,5,7H2	KIPRTQNWIXZVKX-UHFFFAOYSA-N	FC(F)(F)c1ccc(cc1)C2NCCc3sccc23	BroadT	BRD-A45102875	BRD-A45102875-001-05-9	Key Organics Ltd.	6X-0842			FC(F)(F)c1ccc(cc1)C1NCCc2sccc12	InChI=1S/C14H12F3NS/c15-14(16,17)10-3-1-9(2-4-10)13-11-6-8-19-12(11)5-7-18-13/h1-4,6,8,13,18H,5,7H2	KIPRTQNWIXZVKX-UHFFFAOYSA-N	283.064254684							105518
AC1LU2M4	LSM-16882	BRD-K40308891	1545213	InChI=1S/C12H8BrN5S2/c13-10-5-4-8(20-10)7-15-18-11(16-17-12(18)19)9-3-1-2-6-14-9/h1-7H,(H,17,19)	HRMQHUGYYPXLRI-UHFFFAOYSA-N	Sc1nnc(c2ccccn2)n1N=Cc3ccc(Br)s3	BroadT	BRD-K40308891	BRD-K40308891-001-06-3	InterBioScreen Ltd.	STOCK3S-73520			Sc1nnc(-c2ccccn2)n1N=Cc1ccc(Br)s1	InChI=1S/C12H8BrN5S2/c13-10-5-4-8(20-10)7-15-18-11(16-17-12(18)19)9-3-1-2-6-14-9/h1-7H,(H,17,19)	HRMQHUGYYPXLRI-UHFFFAOYSA-N	364.940449286							105519
AC1LOJ3T	LSM-16883	BRD-K08606983	1241202	InChI=1S/C20H15N5OS/c26-20(15-8-10-21-11-9-15)23-22-13-16-14-25(17-5-2-1-3-6-17)24-19(16)18-7-4-12-27-18/h1-14H,(H,23,26)	PWDGBFZGNFZPBM-UHFFFAOYSA-N	O=C(NN=Cc1cn(nc1c2cccs2)c3ccccc3)c4ccncc4	BroadT	BRD-K08606983	BRD-K08606983-001-05-1	Enamine Ltd.	T0500-2826			O=C(NN=Cc1cn(nc1-c1cccs1)-c1ccccc1)c1ccncc1	InChI=1S/C20H15N5OS/c26-20(15-8-10-21-11-9-15)23-22-13-16-14-25(17-5-2-1-3-6-17)24-19(16)18-7-4-12-27-18/h1-14H,(H,23,26)	PWDGBFZGNFZPBM-UHFFFAOYSA-N	373.09973084							105520
AC1MQLWD	LSM-16884	BRD-K03796490	3478806	InChI=1S/C11H12F3N3S/c1-7(16-17-10(18)15-2)8-4-3-5-9(6-8)11(12,13)14/h3-6H,1-2H3,(H2,15,17,18)	VYCVYQBPBQHUNX-UHFFFAOYSA-N	CN=C(S)NN=C(C)c1cccc(c1)C(F)(F)F	BroadT	BRD-K03796490	BRD-K03796490-001-05-1	Enamine Ltd.	T0509-9695			CN=C(S)NN=C(C)c1cccc(c1)C(F)(F)F	InChI=1S/C11H12F3N3S/c1-7(16-17-10(18)15-2)8-4-3-5-9(6-8)11(12,13)14/h3-6H,1-2H3,(H2,15,17,18)	VYCVYQBPBQHUNX-UHFFFAOYSA-N	275.070402704							105521
BAS 07414606	LSM-16885	SID14725900, BRD-A04656563	3156178	InChI=1S/C18H18N4O3/c1-3-10-4-6-11(7-5-10)15-12(9-19)17(20)25-18-16(15)13(21-22-18)8-14(23)24-2/h4-7,15H,3,8,20H2,1-2H3,(H,21,22)	MAXRLMQGJHWTLO-UHFFFAOYSA-N	CCc1ccc(cc1)C2C(=C(N)Oc3[nH]nc(CC(=O)OC)c23)C#N	BroadT	BRD-A04656563	BRD-A04656563-001-06-8	Asinex Ltd.	BAS 07414606			CCc1ccc(cc1)C1c2c(CC(=O)OC)n[nH]c2OC(N)=C1C#N	InChI=1S/C18H18N4O3/c1-3-10-4-6-11(7-5-10)15-12(9-19)17(20)25-18-16(15)13(21-22-18)8-14(23)24-2/h4-7,15H,3,8,20H2,1-2H3,(H,21,22)	MAXRLMQGJHWTLO-UHFFFAOYSA-N	338.137890476							105522
BDBM57162	LSM-16886	BRD-A71556055	91897294	InChI=1S/C18H25N5O2S/c1-3-4-5-6-7-8-11-25-17(24)15-13(2)19-18-20-21-22-23(18)16(15)14-10-9-12-26-14/h9-10,12,15-16H,3-8,11H2,1-2H3	VPEVJHHTYYGIGN-UHFFFAOYSA-N	CCCCCCCCOC(=O)C1C(c2cccs2)n3nnnc3N=C1C	BroadT	BRD-A71556055	BRD-A71556055-001-08-9	ChemDiv Inc.	C202-0496			CCCCCCCCOC(=O)C1C(c2cccs2)n2nnnc2N=C1C	InChI=1S/C18H25N5O2S/c1-3-4-5-6-7-8-11-25-17(24)15-13(2)19-18-20-21-22-23(18)16(15)14-10-9-12-26-14/h9-10,12,15-16H,3-8,11H2,1-2H3	VPEVJHHTYYGIGN-UHFFFAOYSA-N	375.17289578							105523
SMR000075593	LSM-16887	SID4265770, BRD-K93517397	2950805	InChI=1S/C24H33N3O6S/c1-5-31-21-16-18(17-22(32-6-2)23(21)33-7-3)24(28)25-19-8-10-20(11-9-19)26-12-14-27(15-13-26)34(4,29)30/h8-11,16-17H,5-7,12-15H2,1-4H3,(H,25,28)	MEXBUQXLBIOYMP-UHFFFAOYSA-N	CCOc1cc(cc(OCC)c1OCC)C(=O)Nc2ccc(cc2)N3CCN(CC3)S(=O)(=O)C	BroadT	BRD-K93517397	BRD-K93517397-001-05-6	ChemBridge Corporation	7735957			CCOc1cc(cc(OCC)c1OCC)C(=O)Nc1ccc(cc1)N1CCN(CC1)S(C)(=O)=O	InChI=1S/C24H33N3O6S/c1-5-31-21-16-18(17-22(32-6-2)23(21)33-7-3)24(28)25-19-8-10-20(11-9-19)26-12-14-27(15-13-26)34(4,29)30/h8-11,16-17H,5-7,12-15H2,1-4H3,(H,25,28)	MEXBUQXLBIOYMP-UHFFFAOYSA-N	491.209006496							105524
SMR000076922	LSM-3142	BRD-K51608872, SID4261036, SID87218804, BRD8872	1517919	InChI=1S/C17H17N9S/c1-25(2)16-20-14(19-15(18)21-16)10-27-17-22-23-24-26(17)13-9-5-7-11-6-3-4-8-12(11)13/h3-9H,10H2,1-2H3,(H2,18,19,20,21)	KEGAOGGMAQQKFO-UHFFFAOYSA-N	CN(C)c1nc(N)nc(CSc2nnnn2c3cccc4ccccc34)n1	BroadT	BRD-K51608872	BRD-K51608872-001-12-3	ChemBridge Corporation	7814700			CN(C)c1nc(N)nc(CSc2nnnn2-c2cccc3ccccc23)n1	InChI=1S/C17H17N9S/c1-25(2)16-20-14(19-15(18)21-16)10-27-17-22-23-24-26(17)13-9-5-7-11-6-3-4-8-12(11)13/h3-9H,10H2,1-2H3,(H2,18,19,20,21)	KEGAOGGMAQQKFO-UHFFFAOYSA-N	379.132762324							92899
STK111867	LSM-1889	STK-111867, SID14726337, SID26513934, SID46493464, BRD2139	2946732	InChI=1S/C16H14N4O2/c21-14-11-8-4-5-9-12(11)15(22)20(14)16-17-13(18-19-16)10-6-2-1-3-7-10/h1-7,11-12H,8-9H2,(H,17,18,19)	MIQGMTKINBACMG-UHFFFAOYSA-N	O=C1C2CC=CCC2C(=O)N1c3n[nH]c(n3)c4ccccc4	BroadT	BRD-A89352139	BRD-A89352139-001-05-9	Asinex Ltd.	BAS 06344251			O=C1C2CC=CCC2C(=O)N1c1nc(n[nH]1)-c1ccccc1	InChI=1S/C16H14N4O2/c21-14-11-8-4-5-9-12(11)15(22)20(14)16-17-13(18-19-16)10-6-2-1-3-7-10/h1-7,11-12H,8-9H2,(H,17,18,19)	MIQGMTKINBACMG-UHFFFAOYSA-N	294.111675728							91946
3-Acetylamino-5-chloro-benzofuran-2-carboxylic acid	LSM-16888	SID844619, BRD-K73953291	646952	InChI=1S/C11H8ClNO4/c1-5(14)13-9-7-4-6(12)2-3-8(7)17-10(9)11(15)16/h2-4H,1H3,(H,13,14)(H,15,16)	WDSQIXUDTWCQJO-UHFFFAOYSA-N	CC(=O)Nc1c(oc2ccc(Cl)cc12)C(=O)O	BroadT	BRD-K73953291	BRD-K73953291-001-06-2	Asinex Ltd.	BAS 01507272			CC(=O)Nc1c(oc2ccc(Cl)cc12)C(O)=O	InChI=1S/C11H8ClNO4/c1-5(14)13-9-7-4-6(12)2-3-8(7)17-10(9)11(15)16/h2-4H,1H3,(H,13,14)(H,15,16)	WDSQIXUDTWCQJO-UHFFFAOYSA-N	253.014185456							105525
ASN 08830677	LSM-16889	SID846095, BRD-K61146276	648467	InChI=1S/C19H27FN4O2/c1-23-10-12-24(13-11-23)17(25)19(8-3-2-4-9-19)22-18(26)21-16-7-5-6-15(20)14-16/h5-7,14H,2-4,8-13H2,1H3,(H2,21,22,26)	ITDYIZHUKNXDFG-UHFFFAOYSA-N	CN1CCN(CC1)C(=O)C2(CCCCC2)NC(=O)Nc3cccc(F)c3	BroadT	BRD-K61146276	BRD-K61146276-001-05-8	Asinex Ltd.	ASN 08830677			CN1CCN(CC1)C(=O)C1(CCCCC1)NC(=O)Nc1cccc(F)c1	InChI=1S/C19H27FN4O2/c1-23-10-12-24(13-11-23)17(25)19(8-3-2-4-9-19)22-18(26)21-16-7-5-6-15(20)14-16/h5-7,14H,2-4,8-13H2,1H3,(H2,21,22,26)	ITDYIZHUKNXDFG-UHFFFAOYSA-N	362.211804344							105526
ZINC00814335	LSM-16890	SID24812635, BRD-A84530592	5294569	InChI=1S/C18H15ClN4O2/c1-10-6-7-11(8-12(10)19)20-17(25)14-9-16(24)23-15-5-3-2-4-13(15)21-18(23)22-14/h2-8,14H,9H2,1H3,(H,20,25)(H,21,22)	NZCVHGWFGORENA-UHFFFAOYSA-N	Cc1ccc(NC(=O)C2CC(=O)n3c(N2)nc4ccccc34)cc1Cl	BroadT	BRD-A84530592	BRD-A84530592-001-07-1	Asinex Ltd.	BAS 08978426			Cc1ccc(NC(=O)C2CC(=O)n3c(N2)nc2ccccc32)cc1Cl	InChI=1S/C18H15ClN4O2/c1-10-6-7-11(8-12(10)19)20-17(25)14-9-16(24)23-15-5-3-2-4-13(15)21-18(23)22-14/h2-8,14H,9H2,1H3,(H,20,25)(H,21,22)	NZCVHGWFGORENA-UHFFFAOYSA-N	354.08835347							105527
AC1NRAKY	LSM-16891	BRD-K59373532	5237340	InChI=1S/C14H13N3O2/c1-10(11-6-8-15-9-7-11)16-17-13-5-3-2-4-12(13)14(18)19/h2-9,17H,1H3,(H,18,19)	MWOKBTMSRNYEMR-UHFFFAOYSA-N	CC(=NNc1ccccc1C(=O)O)c2ccncc2	BroadT	BRD-K59373532	BRD-K59373532-001-05-2	Enamine Ltd.	T0504-1395			CC(=NNc1ccccc1C(O)=O)c1ccncc1	InChI=1S/C14H13N3O2/c1-10(11-6-8-15-9-7-11)16-17-13-5-3-2-4-12(13)14(18)19/h2-9,17H,1H3,(H,18,19)	MWOKBTMSRNYEMR-UHFFFAOYSA-N	255.100776686							105528
AC1MMAAT	LSM-16892	SID4240518, BRD-A53979407	3235616	InChI=1S/C19H21NO5/c1-24-15-7-3-13(4-8-15)11-18(21)20-17(12-19(22)23)14-5-9-16(25-2)10-6-14/h3-10,17H,11-12H2,1-2H3,(H,20,21)(H,22,23)	UDGBSSTULRPTIY-UHFFFAOYSA-N	COc1ccc(CC(=O)NC(CC(=O)O)c2ccc(OC)cc2)cc1	BroadT	BRD-A53979407	BRD-A53979407-001-05-6	ChemDiv Inc.	8014-9414			COc1ccc(CC(=O)NC(CC(O)=O)c2ccc(OC)cc2)cc1	InChI=1S/C19H21NO5/c1-24-15-7-3-13(4-8-15)11-18(21)20-17(12-19(22)23)14-5-9-16(25-2)10-6-14/h3-10,17H,11-12H2,1-2H3,(H,20,21)(H,22,23)	UDGBSSTULRPTIY-UHFFFAOYSA-N	343.141972782							105529
3-(1-Butyl-5-diethylsulfamoyl-1H-benzoimidazol-2-yl)-propionic acid	LSM-16893	SID26670618, BRD-K08578409	5057093	InChI=1S/C18H27N3O4S/c1-4-7-12-21-16-9-8-14(26(24,25)20(5-2)6-3)13-15(16)19-17(21)10-11-18(22)23/h8-9,13H,4-7,10-12H2,1-3H3,(H,22,23)	NYWAELKLKKYXFV-UHFFFAOYSA-N	CCCCn1c(CCC(=O)O)nc2cc(ccc12)S(=O)(=O)N(CC)CC	BroadT	BRD-K08578409	BRD-K08578409-001-05-8	Enamine Ltd.	T0515-0847			CCCCn1c(CCC(O)=O)nc2cc(ccc12)S(=O)(=O)N(CC)CC	InChI=1S/C18H27N3O4S/c1-4-7-12-21-16-9-8-14(26(24,25)20(5-2)6-3)13-15(16)19-17(21)10-11-18(22)23/h8-9,13H,4-7,10-12H2,1-3H3,(H,22,23)	NYWAELKLKKYXFV-UHFFFAOYSA-N	381.172227064							105530
SMR000093056	LSM-16894	SID7965998, BRD-A37491729	3555454	InChI=1S/C22H22N2O3/c1-27-19-9-7-18(8-10-19)24-21(25)15-20(22(24)26)23-13-11-17(12-14-23)16-5-3-2-4-6-16/h2-11,20H,12-15H2,1H3	CRKNXIKNLIOIJW-UHFFFAOYSA-N	COc1ccc(cc1)N2C(=O)CC(N3CCC(=CC3)c4ccccc4)C2=O	BroadT	BRD-A37491729	BRD-A37491729-001-04-7	ChemDiv Inc.	8015-3160			COc1ccc(cc1)N1C(=O)CC(N2CCC(=CC2)c2ccccc2)C1=O	InChI=1S/C22H22N2O3/c1-27-19-9-7-18(8-10-19)24-21(25)15-20(22(24)26)23-13-11-17(12-14-23)16-5-3-2-4-6-16/h2-11,20H,12-15H2,1H3	CRKNXIKNLIOIJW-UHFFFAOYSA-N	362.163042584							105531
STK142432	LSM-16895	SID4240854, BRD-A75281937	3235906	InChI=1S/C19H24N4O4/c1-3-27-12-4-9-22-19(25)17(14-5-7-15(26-2)8-6-14)23-18(24)16-13-20-10-11-21-16/h5-8,10-11,13,17H,3-4,9,12H2,1-2H3,(H,22,25)(H,23,24)	ABRPDYUZUHZPQW-UHFFFAOYSA-N	CCOCCCNC(=O)C(NC(=O)c1cnccn1)c2ccc(OC)cc2	BroadT	BRD-A75281937	BRD-A75281937-001-05-0	ChemDiv Inc.	C094-2066			CCOCCCNC(=O)C(NC(=O)c1cnccn1)c1ccc(OC)cc1	InChI=1S/C19H24N4O4/c1-3-27-12-4-9-22-19(25)17(14-5-7-15(26-2)8-6-14)23-18(24)16-13-20-10-11-21-16/h5-8,10-11,13,17H,3-4,9,12H2,1-2H3,(H,22,25)(H,23,24)	ABRPDYUZUHZPQW-UHFFFAOYSA-N	372.179755288							105532
6-Bromo-2-mercapto-3-phenylquinazolin-4(3H)-one	LSM-16896	SID24813505, SID499772, BRD-K88922243	786570	InChI=1S/C14H9BrN2OS/c15-9-6-7-12-11(8-9)13(18)17(14(19)16-12)10-4-2-1-3-5-10/h1-8H,(H,16,19)	VYQBHLQJGGBSDC-UHFFFAOYSA-N	Brc1ccc2NC(=S)N(C(=O)c2c1)c3ccccc3	BroadT	BRD-K88922243	BRD-K88922243-001-05-1	Asinex Ltd.	BAS 00469708			Brc1ccc2[nH]c(=S)n(-c3ccccc3)c(=O)c2c1	InChI=1S/C14H9BrN2OS/c15-9-6-7-12-11(8-9)13(18)17(14(19)16-12)10-4-2-1-3-5-10/h1-8H,(H,16,19)	VYQBHLQJGGBSDC-UHFFFAOYSA-N	331.961896218							105533
STK859394	LSM-16897	SID7971232, BRD-A79350583	3824334	InChI=1S/C15H16ClN5O/c1-2-11(8-22)20-14-13-7-19-21(15(13)18-9-17-14)12-5-3-10(16)4-6-12/h3-7,9,11,22H,2,8H2,1H3,(H,17,18,20)	WFGJPSRVWGNXNX-UHFFFAOYSA-N	CCC(CO)Nc1ncnc2c1cnn2c3ccc(Cl)cc3	BroadT	BRD-A79350583	BRD-A79350583-001-04-9	Life Chemicals Inc.	F0521-0090			CCC(CO)Nc1ncnc2n(ncc12)-c1ccc(Cl)cc1	InChI=1S/C15H16ClN5O/c1-2-11(8-22)20-14-13-7-19-21(15(13)18-9-17-14)12-5-3-10(16)4-6-12/h3-7,9,11,22H,2,8H2,1H3,(H,17,18,20)	WFGJPSRVWGNXNX-UHFFFAOYSA-N	317.104337892							105534
MLS000394271	LSM-43674	SID22410779, BRD-K45251697	2674720	InChI=1S/C20H24N2O4S/c1-15-4-8-19(14-16(15)2)27(24,25)22-12-10-21(11-13-22)20(23)9-7-18-6-5-17(3)26-18/h4-9,14H,10-13H2,1-3H3/b9-7+	ATNOWKHZXUTJKM-VQHVLOKHSA-N	Cc1oc(\C=C\C(=O)N2CCN(CC2)S(=O)(=O)c3ccc(C)c(C)c3)cc1	BroadT	BRD-K45251697	BRD-K45251697-001-05-8	Enamine Ltd.	ZT-5512970			Cc1ccc(\C=C\C(=O)N2CCN(CC2)S(=O)(=O)c2ccc(C)c(C)c2)o1	InChI=1S/C20H24N2O4S/c1-15-4-8-19(14-16(15)2)27(24,25)22-12-10-21(11-13-22)20(23)9-7-18-6-5-17(3)26-18/h4-9,14H,10-13H2,1-3H3/b9-7+	ATNOWKHZXUTJKM-VQHVLOKHSA-N	388.145677958							
N-(4-Fluorophenyl)-5-nitropyridin-2-amine	LSM-16899	SID17506045, BRD-K93742092	3146297	InChI=1S/C11H8FN3O2/c12-8-1-3-9(4-2-8)14-11-6-5-10(7-13-11)15(16)17/h1-7H,(H,13,14)	OBQWTLGQUGDWCT-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(Nc2ccc(F)cc2)nc1	BroadT	BRD-K93742092	BRD-K93742092-001-05-8	Asinex Ltd.	BAS 03293881			[O-][N+](=O)c1ccc(Nc2ccc(F)cc2)nc1	InChI=1S/C11H8FN3O2/c12-8-1-3-9(4-2-8)14-11-6-5-10(7-13-11)15(16)17/h1-7H,(H,13,14)	OBQWTLGQUGDWCT-UHFFFAOYSA-N	233.060054726							105536
F3394-0700	LSM-16900	SID14734955, BRD-K65727917	1288186	InChI=1S/C21H16N2O4S2/c1-2-7-23-20(24)18-14(15-4-3-8-25-15)11-28-19(18)22-21(23)29-10-13-5-6-16-17(9-13)27-12-26-16/h2-6,8-9,11H,1,7,10,12H2	OCKZFOSIMJBLQD-UHFFFAOYSA-N	C=CCN1C(=O)c2c(csc2N=C1SCc3ccc4OCOc4c3)c5occc5	BroadT	BRD-K65727917	BRD-K65727917-001-05-6	ChemBridge Corporation	7728037			C=CCn1c(SCc2ccc3OCOc3c2)nc2scc(-c3ccco3)c2c1=O	InChI=1S/C21H16N2O4S2/c1-2-7-23-20(24)18-14(15-4-3-8-25-15)11-28-19(18)22-21(23)29-10-13-5-6-16-17(9-13)27-12-26-16/h2-6,8-9,11H,1,7,10,12H2	OCKZFOSIMJBLQD-UHFFFAOYSA-N	424.055148392							105537
SMR000095976	LSM-16901	SID7969198, BRD-K05847686	5309828	InChI=1S/C14H13N3OS/c1-10-5-4-6-11-13(10)16-14(19-11)15-12(18)9-17-7-2-3-8-17/h2-8H,9H2,1H3,(H,15,16,18)	VBSQAXQRPWSQEY-UHFFFAOYSA-N	Cc1cccc2sc(NC(=O)Cn3cccc3)nc12	BroadT	BRD-K05847686	BRD-K05847686-001-04-7	ChemDiv Inc.	C737-0713			Cc1cccc2sc(NC(=O)Cn3cccc3)nc12	InChI=1S/C14H13N3OS/c1-10-5-4-6-11-13(10)16-14(19-11)15-12(18)9-17-7-2-3-8-17/h2-8H,9H2,1H3,(H,15,16,18)	VBSQAXQRPWSQEY-UHFFFAOYSA-N	271.077932756							105538
N-[2-(3-Cyano-6-ethoxy-quinolin-2-ylamino)-ethyl]-propionamide	LSM-16902	SID847706, BRD-K87256167	650115	InChI=1S/C17H20N4O2/c1-3-16(22)19-7-8-20-17-13(11-18)9-12-10-14(23-4-2)5-6-15(12)21-17/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,19,22)(H,20,21)	SBIFELRMHSAINV-UHFFFAOYSA-N	CCOc1ccc2nc(NCCNC(=O)CC)c(cc2c1)C#N	BroadT	BRD-K87256167	BRD-K87256167-001-05-7	Asinex Ltd.	ASN 06146998			CCOc1ccc2nc(NCCNC(=O)CC)c(cc2c1)C#N	InChI=1S/C17H20N4O2/c1-3-16(22)19-7-8-20-17-13(11-18)9-12-10-14(23-4-2)5-6-15(12)21-17/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,19,22)(H,20,21)	SBIFELRMHSAINV-UHFFFAOYSA-N	312.15862592							105539
AC1LWXT7	LSM-43675	SID24805969, BRD-K81034231	1788133	InChI=1S/C18H15N3O5S2/c1-11(22)20-13-5-7-15(8-6-13)28(24,25)26-14-4-2-3-12(9-14)10-16-17(23)21-18(19)27-16/h2-10H,1H3,(H,20,22)(H2,19,21,23)/b16-10-	CBGPOSOHJIBVPX-YBEGLDIGSA-N	CC(=O)Nc1ccc(cc1)S(=O)(=O)Oc2cccc(\C=C\3/SC(=NC3=O)N)c2	BroadT	BRD-K81034231	BRD-K81034231-001-05-6	ChemBridge Corporation	6568832			CC(=O)Nc1ccc(cc1)S(=O)(=O)Oc1cccc(\C=C2/SC(N)=NC2=O)c1	InChI=1S/C18H15N3O5S2/c1-11(22)20-13-5-7-15(8-6-13)28(24,25)26-14-4-2-3-12(9-14)10-16-17(23)21-18(19)27-16/h2-10H,1H3,(H,20,22)(H2,19,21,23)/b16-10-	CBGPOSOHJIBVPX-YBEGLDIGSA-N	417.04531199							
AC1LXWDC	LSM-16904	BRD-K67507779	1859965	InChI=1S/C24H23N3O4S/c1-2-3-9-14-26-15-16-27(17-26)22-21(25-32(30,31)18-10-5-4-6-11-18)23(28)19-12-7-8-13-20(19)24(22)29/h4-8,10-13,15-17H,2-3,9,14H2,1H3/p+1	CVWXODFBKWPROK-UHFFFAOYSA-O	CCCCCn1cc[n+](c1)C2=C(NS(=O)(=O)c3ccccc3)C(=O)c4ccccc4C2=O	BroadT	BRD-K67507779	BRD-K67507779-001-08-1	InterBioScreen Ltd.	STOCK2S-32997			CCCCCn1cc[n+](c1)C1=C(NS(=O)(=O)c2ccccc2)C(=O)c2ccccc2C1=O	InChI=1S/C24H23N3O4S/c1-2-3-9-14-26-15-16-27(17-26)22-21(25-32(30,31)18-10-5-4-6-11-18)23(28)19-12-7-8-13-20(19)24(22)29/h4-8,10-13,15-17H,2-3,9,14H2,1H3/p+1	CVWXODFBKWPROK-UHFFFAOYSA-O	450.148751968							105541
AC1O9AMN	LSM-16905	SID17412287, BRD-K34876632	6753417	InChI=1S/C17H11BrN2S/c18-12-7-5-11(6-8-12)16-10-21-17(20-16)14-9-19-15-4-2-1-3-13(14)15/h1-10,19H	GQVATYVJIBWCMZ-UHFFFAOYSA-N	Brc1ccc(cc1)c2csc(n2)c3c[nH]c4ccccc34	BroadT	BRD-K34876632	BRD-K34876632-001-05-3	ChemBridge Corporation	6616952			Brc1ccc(cc1)-c1csc(n1)-c1c[nH]c2ccccc12	InChI=1S/C17H11BrN2S/c18-12-7-5-11(6-8-12)16-10-21-17(20-16)14-9-19-15-4-2-1-3-13(14)15/h1-10,19H	GQVATYVJIBWCMZ-UHFFFAOYSA-N	353.982631662							
Ethyl 3-{[(dimethylamino)methylene]amino}-4-methoxythieno[2,3-b]pyridine-2-carboxylate	LSM-16906	BRD-K51735966	2765678	InChI=1S/C14H17N3O3S/c1-5-20-14(18)12-11(16-8-17(2)3)10-9(19-4)6-7-15-13(10)21-12/h6-8H,5H2,1-4H3	MFSVYDYRFRBRLC-UHFFFAOYSA-N	CCOC(=O)c1sc2nccc(OC)c2c1N=CN(C)C	BroadT	BRD-K51735966	BRD-K51735966-001-05-5	Key Organics Ltd.	10M-007			CCOC(=O)c1sc2nccc(OC)c2c1N=CN(C)C	InChI=1S/C14H17N3O3S/c1-5-20-14(18)12-11(16-8-17(2)3)10-9(19-4)6-7-15-13(10)21-12/h6-8H,5H2,1-4H3	MFSVYDYRFRBRLC-UHFFFAOYSA-N	307.099062124							105543
AN-465/42245190	LSM-16907	SID17406824, BRD-A56119076	4693206	InChI=1S/C24H21ClN2O5/c1-30-17-10-8-16(9-11-17)27-23(26-20-6-4-3-5-18(20)24(27)29)19-13-15(25)7-12-21(19)32-14-22(28)31-2/h3-13,23,26H,14H2,1-2H3	LVQVEKLXWORDSL-UHFFFAOYSA-N	COC(=O)COc1ccc(Cl)cc1C2Nc3ccccc3C(=O)N2c4ccc(OC)cc4	BroadT	BRD-A56119076	BRD-A56119076-001-05-6	Specs	AN-465/42245190			COC(=O)COc1ccc(Cl)cc1C1Nc2ccccc2C(=O)N1c1ccc(OC)cc1	InChI=1S/C24H21ClN2O5/c1-30-17-10-8-16(9-11-17)27-23(26-20-6-4-3-5-18(20)24(27)29)19-13-15(25)7-12-21(19)32-14-22(28)31-2/h3-13,23,26H,14H2,1-2H3	LVQVEKLXWORDSL-UHFFFAOYSA-N	452.113899502							105544
MLS000101513	LSM-16908	SID110067428, SID7970733, BRD-K07726175	2159329	InChI=1S/C14H11BrN2O3S2/c1-19-7-3-4-8(20-2)12-11(7)16-14(22-12)17-13(18)9-5-6-10(15)21-9/h3-6H,1-2H3,(H,16,17,18)	KJHSZKFNWAMUIB-UHFFFAOYSA-N	COc1ccc(OC)c2sc(NC(=O)c3ccc(Br)s3)nc12	BroadT	BRD-K07726175	BRD-K07726175-001-06-4	Life Chemicals Inc.	F0600-1566			COc1ccc(OC)c2sc(NC(=O)c3ccc(Br)s3)nc12	InChI=1S/C14H11BrN2O3S2/c1-19-7-3-4-8(20-2)12-11(7)16-14(22-12)17-13(18)9-5-6-10(15)21-9/h3-6H,1-2H3,(H,16,17,18)	KJHSZKFNWAMUIB-UHFFFAOYSA-N	397.939446212							105545
AC1O9XQR	LSM-16909	SID4242925, BRD-K23710619	6740097	InChI=1S/C15H9F3N2O2/c16-15(17,18)10-7-5-9(6-8-10)13-19-20-14(22-13)11-3-1-2-4-12(11)21/h1-8,21H	BBHYPHDDSNJGIR-UHFFFAOYSA-N	Oc1ccccc1c2oc(nn2)c3ccc(cc3)C(F)(F)F	BroadT	BRD-K23710619	BRD-K23710619-001-06-2	ChemDiv Inc.	8014-8634			Oc1ccccc1-c1nnc(o1)-c1ccc(cc1)C(F)(F)F	InChI=1S/C15H9F3N2O2/c16-15(17,18)10-7-5-9(6-8-10)13-19-20-14(22-13)11-3-1-2-4-12(11)21/h1-8,21H	BBHYPHDDSNJGIR-UHFFFAOYSA-N	306.061612148							
SMR000023045	LSM-16910	SID4250856, BRD-K27792853	3244613	InChI=1S/C15H17NO4S2/c1-19-14-8-7-13(10-15(14)20-2)22(17,18)16-11-5-4-6-12(9-11)21-3/h4-10,16H,1-3H3	OYDNWIJXSOGFSN-UHFFFAOYSA-N	COc1ccc(cc1OC)S(=O)(=O)Nc2cccc(SC)c2	BroadT	BRD-K27792853	BRD-K27792853-001-05-3	ChemDiv Inc.	C206-0471			COc1ccc(cc1OC)S(=O)(=O)Nc1cccc(SC)c1	InChI=1S/C15H17NO4S2/c1-19-14-8-7-13(10-15(14)20-2)22(17,18)16-11-5-4-6-12(9-11)21-3/h4-10,16H,1-3H3	OYDNWIJXSOGFSN-UHFFFAOYSA-N	339.059899414							105547
ZINC06497065	LSM-16911	SID22409993, BRD-K90449413	3977672	InChI=1S/C12H15NO4S/c1-2-13-11(15)8-17-12(16)6-5-9(14)10-4-3-7-18-10/h3-4,7H,2,5-6,8H2,1H3,(H,13,15)	CDDQAQPBRRMWHR-UHFFFAOYSA-N	CCNC(=O)COC(=O)CCC(=O)c1cccs1	BroadT	BRD-K90449413	BRD-K90449413-001-05-5	Enamine Ltd.	T0519-5676			CCNC(=O)COC(=O)CCC(=O)c1cccs1	InChI=1S/C12H15NO4S/c1-2-13-11(15)8-17-12(16)6-5-9(14)10-4-3-7-18-10/h3-4,7H,2,5-6,8H2,1H3,(H,13,15)	CDDQAQPBRRMWHR-UHFFFAOYSA-N	269.07217866							105548
SMR000179996	LSM-16912	SID17410156, BRD-K15954169	3773687	InChI=1S/C11H9N3OS2/c1-2-4-17-11-13-10-7(3-5-16-10)9-12-8(15)6-14(9)11/h2-3,5H,1,4,6H2	UJHBLSGKRDPGGZ-UHFFFAOYSA-N	C=CCSC1=Nc2sccc2C3=NC(=O)CN13	BroadT	BRD-K15954169	BRD-K15954169-001-06-0	Key Organics Ltd.	3R-0050			C=CCSC1=Nc2sccc2C2=NC(=O)CN12	InChI=1S/C11H9N3OS2/c1-2-4-17-11-13-10-7(3-5-16-10)9-12-8(15)6-14(9)11/h2-3,5H,1,4,6H2	UJHBLSGKRDPGGZ-UHFFFAOYSA-N	263.018703318							105549
HMS2573M13	LSM-43676	BRD-K91501820	12004666	InChI=1S/C12H14N2O2/c1-2-16-12(15)14-13-10-6-9-11-7-4-3-5-8-11/h3-10H,2H2,1H3,(H,14,15)/b9-6+,13-10?	GHFWPCYPKJTPCJ-BJDWQIDWSA-N	CCOC(=O)NN=C\C=C\c1ccccc1	BroadT	BRD-K91501820	BRD-K91501820-001-05-9	ChemBridge Corporation	5272968			CCOC(=O)NN=C\C=C\c1ccccc1	InChI=1S/C12H14N2O2/c1-2-16-12(15)14-13-10-6-9-11-7-4-3-5-8-11/h3-10H,2H2,1H3,(H,14,15)/b9-6+,13-10?	GHFWPCYPKJTPCJ-BJDWQIDWSA-N	218.105527708							
MLS000537887	LSM-16914	SID14735856, BRD-K56694542	2214830	InChI=1S/C16H16N4O4S2/c1-3-23-15(22)13-10(11-5-4-9(2)24-11)6-25-14(13)19-12(21)7-26-16-17-8-18-20-16/h4-6,8H,3,7H2,1-2H3,(H,19,21)(H,17,18,20)	UXRAFCINHRVTJE-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)CSc2nc[nH]n2)scc1c3oc(C)cc3	BroadT	BRD-K56694542	BRD-K56694542-001-05-2	ChemBridge Corporation	7865203			CCOC(=O)c1c(NC(=O)CSc2nc[nH]n2)scc1-c1ccc(C)o1	InChI=1S/C16H16N4O4S2/c1-3-23-15(22)13-10(11-5-4-9(2)24-11)6-25-14(13)19-12(21)7-26-16-17-8-18-20-16/h4-6,8H,3,7H2,1-2H3,(H,19,21)(H,17,18,20)	UXRAFCINHRVTJE-UHFFFAOYSA-N	392.061296412							105551
SMR000132149	LSM-16915	SID14732772, BRD-A86682819	9550295	InChI=1S/C19H24N4O6S/c1-12-16(18(25)22-19(26)21-12)30(27,28)23-8-4-6-14(11-23)17(24)20-10-13-5-3-7-15(9-13)29-2/h3,5,7,9,14H,4,6,8,10-11H2,1-2H3,(H,20,24)(H2,21,22,25,26)	BKTJMVLGAXUUAB-UHFFFAOYSA-N	COc1cccc(CNC(=O)C2CCCN(C2)S(=O)(=O)c3c(C)nc(O)nc3O)c1	BroadT	BRD-A86682819	BRD-A86682819-001-05-9	ChemDiv Inc.	C274-8115			COc1cccc(CNC(=O)C2CCCN(C2)S(=O)(=O)c2c(C)nc(O)nc2O)c1	InChI=1S/C19H24N4O6S/c1-12-16(18(25)22-19(26)21-12)30(27,28)23-8-4-6-14(11-23)17(24)20-10-13-5-3-7-15(9-13)29-2/h3,5,7,9,14H,4,6,8,10-11H2,1-2H3,(H,20,24)(H2,21,22,25,26)	BKTJMVLGAXUUAB-UHFFFAOYSA-N	436.141655218							105552
SMR000627657	LSM-16916	SID49722834, BRD-K62613235	22552136	InChI=1S/C26H33N3O4S/c1-17(2)18-6-8-20(9-7-18)27-24(30)19-12-14-29(15-13-19)34(32,33)21-10-11-23-22(16-21)26(3,4)25(31)28(23)5/h6-11,16-17,19H,12-15H2,1-5H3,(H,27,30)	MSUDPAVPOMLQGP-UHFFFAOYSA-N	CC(C)c1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c3ccc4N(C)C(=O)C(C)(C)c4c3)cc1	BroadT	BRD-K62613235	BRD-K62613235-001-04-9	ChemDiv Inc.	E511-5409			CC(C)c1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2ccc3N(C)C(=O)C(C)(C)c3c2)cc1	InChI=1S/C26H33N3O4S/c1-17(2)18-6-8-20(9-7-18)27-24(30)19-12-14-29(15-13-19)34(32,33)21-10-11-23-22(16-21)26(3,4)25(31)28(23)5/h6-11,16-17,19H,12-15H2,1-5H3,(H,27,30)	MSUDPAVPOMLQGP-UHFFFAOYSA-N	483.219177256							105553
AC1MM6LJ	LSM-16917	SID24826618, BRD-K46804512	3281161	InChI=1S/C15H21N3S/c1-4-5-8-16-15-18-17-14(10-19-15)13-7-6-11(2)12(3)9-13/h6-7,9H,4-5,8,10H2,1-3H3,(H,16,18)	RSCOMAGDKYXTQS-UHFFFAOYSA-N	CCCCNC1=NN=C(CS1)c2ccc(C)c(C)c2	BroadT	BRD-K46804512	BRD-K46804512-001-05-6	Enamine Ltd.	T0518-2733			CCCCNC1=NN=C(CS1)c1ccc(C)c(C)c1	InChI=1S/C15H21N3S/c1-4-5-8-16-15-18-17-14(10-19-15)13-7-6-11(2)12(3)9-13/h6-7,9H,4-5,8,10H2,1-3H3,(H,16,18)	RSCOMAGDKYXTQS-UHFFFAOYSA-N	275.145618392							105554
MLS000335451	LSM-16918	SID22403066, BRD-K07042471	4025697	InChI=1S/C18H19N3O3/c1-2-6-18(23)24-13-17(22)19-14-9-11-16(12-10-14)21-20-15-7-4-3-5-8-15/h3-5,7-12H,2,6,13H2,1H3,(H,19,22)	WOHVRQVPVZRUIK-UHFFFAOYSA-N	CCCC(=O)OCC(=O)Nc1ccc(cc1)N=Nc2ccccc2	BroadT	BRD-K07042471	BRD-K07042471-001-04-2	Enamine Ltd.	T0519-7659			CCCC(=O)OCC(=O)Nc1ccc(cc1)N=Nc1ccccc1	InChI=1S/C18H19N3O3/c1-2-6-18(23)24-13-17(22)19-14-9-11-16(12-10-14)21-20-15-7-4-3-5-8-15/h3-5,7-12H,2,6,13H2,1H3,(H,19,22)	WOHVRQVPVZRUIK-UHFFFAOYSA-N	325.142641498							105555
AC1N9VMC	LSM-16919	BRD-K08564817	4417074	InChI=1S/C18H19F2N3OS/c1-11-5-4-6-12(2)16(11)21-18(25)23-22-13(3)14-7-9-15(10-8-14)24-17(19)20/h4-10,17H,1-3H3,(H2,21,23,25)	GZTVGAPEWMUGNA-UHFFFAOYSA-N	CC(=NN=C(S)Nc1c(C)cccc1C)c2ccc(OC(F)F)cc2	BroadT	BRD-K08564817	BRD-K08564817-001-05-4	Enamine Ltd.	T0510-5883			CC(=NN=C(S)Nc1c(C)cccc1C)c1ccc(OC(F)F)cc1	InChI=1S/C18H19F2N3OS/c1-11-5-4-6-12(2)16(11)21-18(25)23-22-13(3)14-7-9-15(10-8-14)24-17(19)20/h4-10,17H,1-3H3,(H2,21,23,25)	GZTVGAPEWMUGNA-UHFFFAOYSA-N	363.121689348							105556
MLS000702889	LSM-16920	SID22412153, BRD-K77161059	3554999	InChI=1S/C12H19N3OS2/c1-4-5-6-13-12(17)15-14-11(16)10-7-18-9(3)8(10)2/h7H,4-6H2,1-3H3,(H,14,16)(H2,13,15,17)	GFYPBFCLRNYMIL-UHFFFAOYSA-N	CCCCN=C(S)NNC(=O)c1csc(C)c1C	BroadT	BRD-K77161059	BRD-K77161059-001-05-2	Specs	AK-968/41172108			CCCCN=C(S)NNC(=O)c1csc(C)c1C	InChI=1S/C12H19N3OS2/c1-4-5-6-13-12(17)15-14-11(16)10-7-18-9(3)8(10)2/h7H,4-6H2,1-3H3,(H,14,16)(H2,13,15,17)	GFYPBFCLRNYMIL-UHFFFAOYSA-N	285.096953638							105557
AMBCB53144123	LSM-16921	SID49732614, BRD-K53376514	24793276	InChI=1S/C25H29FN4O2/c1-3-30-17-20(18(2)28-30)16-29-14-12-19(13-15-29)25(31)27-21-8-10-22(11-9-21)32-24-7-5-4-6-23(24)26/h4-11,17,19H,3,12-16H2,1-2H3,(H,27,31)	KDXXZHBZHFASCN-UHFFFAOYSA-N	CCn1cc(CN2CCC(CC2)C(=O)Nc3ccc(Oc4ccccc4F)cc3)c(C)n1	BroadT	BRD-K53376514	BRD-K53376514-001-05-3	ChemBridge Corporation	53144123			CCn1cc(CN2CCC(CC2)C(=O)Nc2ccc(Oc3ccccc3F)cc2)c(C)n1	InChI=1S/C25H29FN4O2/c1-3-30-17-20(18(2)28-30)16-29-14-12-19(13-15-29)25(31)27-21-8-10-22(11-9-21)32-24-7-5-4-6-23(24)26/h4-11,17,19H,3,12-16H2,1-2H3,(H,27,31)	KDXXZHBZHFASCN-UHFFFAOYSA-N	436.227454408							105558
MLS000408862	LSM-1277	SID87225726, BRD-A06664848, SID22411139	3409332	InChI=1S/C20H20ClN3O4S3/c1-13(29-20-23-17-11-14(21)5-6-18(17)30-20)19(25)22-15-3-2-4-16(12-15)31(26,27)24-7-9-28-10-8-24/h2-6,11-13H,7-10H2,1H3,(H,22,25)	RFBPLZZVEFTOML-UHFFFAOYSA-N	CC(Sc1nc2cc(Cl)ccc2s1)C(=O)Nc3cccc(c3)S(=O)(=O)N4CCOCC4	BroadT	BRD-A06664848	BRD-A06664848-001-05-9	Enamine Ltd.	T0511-2485			CC(Sc1nc2cc(Cl)ccc2s1)C(=O)Nc1cccc(c1)S(=O)(=O)N1CCOCC1	InChI=1S/C20H20ClN3O4S3/c1-13(29-20-23-17-11-14(21)5-6-18(17)30-20)19(25)22-15-3-2-4-16(12-15)31(26,27)24-7-9-28-10-8-24/h2-6,11-13H,7-10H2,1H3,(H,22,25)	RFBPLZZVEFTOML-UHFFFAOYSA-N	497.03044593							91502
MLS000042070	LSM-43677	SID861823, BRD-K07787963	5389638	InChI=1S/C19H25N3O3/c1-3-5-13-22-18(24)16(17(23)21-19(22)25)15(4-2)20-12-11-14-9-7-6-8-10-14/h6-10,20H,3-5,11-13H2,1-2H3,(H,21,23,25)/b16-15+	OEQPGKUBVCHQQM-FOCLMDBBSA-N	CCCCN1C(=O)NC(=O)\C(=C(\CC)/NCCc2ccccc2)\C1=O	BroadT	BRD-K07787963	BRD-K07787963-001-05-4	InterBioScreen Ltd.	STOCK4S-20726			CCCCN1C(=O)NC(=O)\C(=C(\CC)NCCc2ccccc2)C1=O	InChI=1S/C19H25N3O3/c1-3-5-13-22-18(24)16(17(23)21-19(22)25)15(4-2)20-12-11-14-9-7-6-8-10-14/h6-10,20H,3-5,11-13H2,1-2H3,(H,21,23,25)/b16-15+	OEQPGKUBVCHQQM-FOCLMDBBSA-N	343.18959169							
SMR000030603	LSM-16923	SID4241643, BRD-K29731758	3236592	InChI=1S/C26H30N4O3/c1-19-6-5-9-23(20(19)2)28-14-16-29(17-15-28)25(32)10-12-27-24(31)18-30-13-11-21-7-3-4-8-22(21)26(30)33/h3-9,11,13H,10,12,14-18H2,1-2H3,(H,27,31)	ZWOLUVDFGHDXLY-UHFFFAOYSA-N	Cc1cccc(N2CCN(CC2)C(=O)CCNC(=O)CN3C=Cc4ccccc4C3=O)c1C	BroadT	BRD-K29731758	BRD-K29731758-001-05-5	ChemDiv Inc.	C197-0351			Cc1cccc(N2CCN(CC2)C(=O)CCNC(=O)Cn2ccc3ccccc3c2=O)c1C	InChI=1S/C26H30N4O3/c1-19-6-5-9-23(20(19)2)28-14-16-29(17-15-28)25(32)10-12-27-24(31)18-30-13-11-21-7-3-4-8-22(21)26(30)33/h3-9,11,13H,10,12,14-18H2,1-2H3,(H,27,31)	ZWOLUVDFGHDXLY-UHFFFAOYSA-N	446.23179086							105560
SMR000198594	LSM-16924	SID17432832, BRD-K60022045	2941613	InChI=1S/C23H32N4O5S/c1-2-33(31,32)26-7-5-25(6-8-26)20-4-3-17(14-21(20)27(29)30)23(28)24-22-18-10-15-9-16(12-18)13-19(22)11-15/h3-4,14-16,18-19,22H,2,5-13H2,1H3,(H,24,28)	SODWQJIRWLTZRX-UHFFFAOYSA-N	CCS(=O)(=O)N1CCN(CC1)c2ccc(cc2[N+](=O)[O-])C(=O)NC3C4CC5CC(CC3C5)C4	BroadT	BRD-K60022045	BRD-K60022045-001-06-0	ChemBridge Corporation	7519826			CCS(=O)(=O)N1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(=O)NC1C2CC3CC(C2)CC1C3	InChI=1S/C23H32N4O5S/c1-2-33(31,32)26-7-5-25(6-8-26)20-4-3-17(14-21(20)27(29)30)23(28)24-22-18-10-15-9-16(12-18)13-19(22)11-15/h3-4,14-16,18-19,22H,2,5-13H2,1H3,(H,24,28)	SODWQJIRWLTZRX-UHFFFAOYSA-N	476.209340854							105561
2-Fluoro-n-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]benzamide	LSM-16925	SID849855, BRD-K96609500	652365	InChI=1S/C20H12F2N2O2/c21-13-7-5-12(6-8-13)20-24-17-11-14(9-10-18(17)26-20)23-19(25)15-3-1-2-4-16(15)22/h1-11H,(H,23,25)	YWWNWWVJOHGWQH-UHFFFAOYSA-N	Fc1ccc(cc1)c2oc3ccc(NC(=O)c4ccccc4F)cc3n2	BroadT	BRD-K96609500	BRD-K96609500-001-05-2	Asinex Ltd.	BAS 00413051			Fc1ccc(cc1)-c1nc2cc(NC(=O)c3ccccc3F)ccc2o1	InChI=1S/C20H12F2N2O2/c21-13-7-5-12(6-8-13)20-24-17-11-14(9-10-18(17)26-20)23-19(25)15-3-1-2-4-16(15)22/h1-11H,(H,23,25)	YWWNWWVJOHGWQH-UHFFFAOYSA-N	350.086684044							105562
AO-375/41769786	LSM-16926	SID861977, BRD-K93520959	663197	InChI=1S/C17H16N2O2/c1-21-15-8-6-14(7-9-15)18-11-13-10-12-4-2-3-5-16(12)19-17(13)20/h2-10,18H,11H2,1H3,(H,19,20)	IMNVQHKWVRAIIQ-UHFFFAOYSA-N	COc1ccc(NCc2cc3ccccc3nc2O)cc1	BroadT	BRD-K93520959	BRD-K93520959-001-04-3	InterBioScreen Ltd.	STOCK4S-26049			COc1ccc(NCc2cc3ccccc3[nH]c2=O)cc1	InChI=1S/C17H16N2O2/c1-21-15-8-6-14(7-9-15)18-11-13-10-12-4-2-3-5-16(12)19-17(13)20/h2-10,18H,11H2,1H3,(H,19,20)	IMNVQHKWVRAIIQ-UHFFFAOYSA-N	280.121177772							105563
MLS000584528	LSM-16927	SID17511176, BRD-K88578764	3698173	InChI=1S/C16H21N3S/c1-4-13-8-5-7-12(2)15(13)18-16(20)17-11-14-9-6-10-19(14)3/h5-10H,4,11H2,1-3H3,(H2,17,18,20)	XUAZDDKUQXFIIH-UHFFFAOYSA-N	CCc1cccc(C)c1N=C(S)NCc2cccn2C	BroadT	BRD-K88578764	BRD-K88578764-001-05-0	ChemDiv Inc.	K788-0590			CCc1cccc(C)c1N=C(S)NCc1cccn1C	InChI=1S/C16H21N3S/c1-4-13-8-5-7-12(2)15(13)18-16(20)17-11-14-9-6-10-19(14)3/h5-10H,4,11H2,1-3H3,(H2,17,18,20)	XUAZDDKUQXFIIH-UHFFFAOYSA-N	287.145618392							105564
MLS001151251	LSM-16928	SID49822306, BRD-K49115566	24686397	InChI=1S/C20H18ClN3O3S/c1-14-6-8-15(9-7-14)12-23-20(25)17-4-2-3-5-18(17)24-28(26,27)16-10-11-19(21)22-13-16/h2-11,13,24H,12H2,1H3,(H,23,25)	XXPOVHWBIPWWOX-UHFFFAOYSA-N	Cc1ccc(CNC(=O)c2ccccc2NS(=O)(=O)c3ccc(Cl)nc3)cc1	BroadT	BRD-K49115566	BRD-K49115566-001-05-9	UkrOrgSynthesis Ltd.	PB-15406418			Cc1ccc(CNC(=O)c2ccccc2NS(=O)(=O)c2ccc(Cl)nc2)cc1	InChI=1S/C20H18ClN3O3S/c1-14-6-8-15(9-7-14)12-23-20(25)17-4-2-3-5-18(17)24-28(26,27)16-10-11-19(21)22-13-16/h2-11,13,24H,12H2,1H3,(H,23,25)	XXPOVHWBIPWWOX-UHFFFAOYSA-N	415.075739866							105565
MLS000735743	LSM-16929	SID24800533, BRD-A25919039	16192202	InChI=1S/C23H30N4/c1-2-26-15-13-24-21(26)16-27-14-12-19-18-10-6-7-11-20(18)25-22(19)23(27)17-8-4-3-5-9-17/h6-7,10-11,13,15,17,23,25H,2-5,8-9,12,14,16H2,1H3	PHKDPTVXVFILDF-UHFFFAOYSA-N	CCn1ccnc1CN2CCc3c([nH]c4ccccc34)C2C5CCCCC5	BroadT	BRD-A25919039	BRD-A25919039-001-06-1	ChemBridge Corporation	75487618			CCn1ccnc1CN1CCc2c([nH]c3ccccc23)C1C1CCCCC1	InChI=1S/C23H30N4/c1-2-26-15-13-24-21(26)16-27-14-12-19-18-10-6-7-11-20(18)25-22(19)23(27)17-8-4-3-5-9-17/h6-7,10-11,13,15,17,23,25H,2-5,8-9,12,14,16H2,1H3	PHKDPTVXVFILDF-UHFFFAOYSA-N	362.247047							105566
SMR000029735	LSM-16930	SID4244651, BRD-A05072082	3239221	InChI=1S/C19H28N4O3S2/c1-3-15-6-4-5-10-23(15)11-9-20-19(24)13-21-28(25,26)16-7-8-17-18(12-16)27-14(2)22-17/h7-8,12,15,21H,3-6,9-11,13H2,1-2H3,(H,20,24)	FURGNSVWVPRYDK-UHFFFAOYSA-N	CCC1CCCCN1CCNC(=O)CNS(=O)(=O)c2ccc3nc(C)sc3c2	BroadT	BRD-A05072082	BRD-A05072082-001-06-9	ChemDiv Inc.	C920-1741			CCC1CCCCN1CCNC(=O)CNS(=O)(=O)c1ccc2nc(C)sc2c1	InChI=1S/C19H28N4O3S2/c1-3-15-6-4-5-10-23(15)11-9-20-19(24)13-21-28(25,26)16-7-8-17-18(12-16)27-14(2)22-17/h7-8,12,15,21H,3-6,9-11,13H2,1-2H3,(H,20,24)	FURGNSVWVPRYDK-UHFFFAOYSA-N	424.160282176							105567
SMR000019962	LSM-16931	SID4243793, BRD-K54613724	3238474	InChI=1S/C15H15N3O3S/c19-12-7-13(20)18-15(17-12)22-8-14(21)16-11-5-4-9-2-1-3-10(9)6-11/h4-7H,1-3,8H2,(H,16,21)(H2,17,18,19,20)	UDEGUSADZDFQHJ-UHFFFAOYSA-N	Oc1cc(O)nc(SCC(=O)Nc2ccc3CCCc3c2)n1	BroadT	BRD-K54613724	BRD-K54613724-001-05-4	ChemDiv Inc.	5813-1792			Oc1cc(O)nc(SCC(=O)Nc2ccc3CCCc3c2)n1	InChI=1S/C15H15N3O3S/c19-12-7-13(20)18-15(17-12)22-8-14(21)16-11-5-4-9-2-1-3-10(9)6-11/h4-7H,1-3,8H2,(H,16,21)(H2,17,18,19,20)	UDEGUSADZDFQHJ-UHFFFAOYSA-N	317.08341206							105568
BAS 08315431	LSM-16932	SID844625, BRD-K17779381	646957	InChI=1S/C19H15N3O3/c1-12-5-7-13(8-6-12)15-10-9-14(18(20-15)23-2)17-21-19(25-22-17)16-4-3-11-24-16/h3-11H,1-2H3	PWKQDVVKYZCFLE-UHFFFAOYSA-N	COc1nc(ccc1c2noc(n2)c3occc3)c4ccc(C)cc4	BroadT	BRD-K17779381	BRD-K17779381-001-05-3	Asinex Ltd.	BAS 08315431			COc1nc(ccc1-c1noc(n1)-c1ccco1)-c1ccc(C)cc1	InChI=1S/C19H15N3O3/c1-12-5-7-13(8-6-12)15-10-9-14(18(20-15)23-2)17-21-19(25-22-17)16-4-3-11-24-16/h3-11H,1-2H3	PWKQDVVKYZCFLE-UHFFFAOYSA-N	333.11134137							105569
MLS000095675	LSM-16933	SID4244432, BRD-K80217331	3239030	InChI=1S/C21H21N3O4S/c1-13-7-6-9-18(14(13)2)24-20(16-11-29(26,27)12-17(16)23-24)22-21(25)15-8-4-5-10-19(15)28-3/h4-10H,11-12H2,1-3H3,(H,22,25)	GHWBFHGCWMTBRS-UHFFFAOYSA-N	COc1ccccc1C(=O)Nc2c3CS(=O)(=O)Cc3nn2c4cccc(C)c4C	BroadT	BRD-K80217331	BRD-K80217331-001-05-7	ChemDiv Inc.	K410-0756			COc1ccccc1C(=O)Nc1c2CS(=O)(=O)Cc2nn1-c1cccc(C)c1C	InChI=1S/C21H21N3O4S/c1-13-7-6-9-18(14(13)2)24-20(16-11-29(26,27)12-17(16)23-24)22-21(25)15-8-4-5-10-19(15)28-3/h4-10H,11-12H2,1-3H3,(H,22,25)	GHWBFHGCWMTBRS-UHFFFAOYSA-N	411.125276872							105570
F3226-3058	LSM-16934	SID14746356, BRD-K27233975	1244474	InChI=1S/C20H21N3O3S/c21-16(24)12-23-19-17(14-8-4-5-9-15(14)27-19)18(25)22(20(23)26)11-10-13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-12H2,(H2,21,24)	IQWRCUUKALKJOD-UHFFFAOYSA-N	NC(=O)CN1C(=O)N(CCc2ccccc2)C(=O)c3c4CCCCc4sc13	BroadT	BRD-K27233975	BRD-K27233975-001-05-1	ChemBridge Corporation	7917495			NC(=O)Cn1c2sc3CCCCc3c2c(=O)n(CCc2ccccc2)c1=O	InChI=1S/C20H21N3O3S/c21-16(24)12-23-19-17(14-8-4-5-9-15(14)27-19)18(25)22(20(23)26)11-10-13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-12H2,(H2,21,24)	IQWRCUUKALKJOD-UHFFFAOYSA-N	383.130362252							105571
N-(3-Nitro-5-m-tolyloxy-phenyl)-2-(3-nitro-[1,2,4]triazol-1-yl)-acetamide	LSM-16935	SID17507521, BRD-K23860736	1910052	InChI=1S/C17H14N6O6/c1-11-3-2-4-14(5-11)29-15-7-12(6-13(8-15)22(25)26)19-16(24)9-21-10-18-17(20-21)23(27)28/h2-8,10H,9H2,1H3,(H,19,24)	XHOYPAKCFYMKRW-UHFFFAOYSA-N	Cc1cccc(Oc2cc(NC(=O)Cn3cnc(n3)[N+](=O)[O-])cc(c2)[N+](=O)[O-])c1	BroadT	BRD-K23860736	BRD-K23860736-001-04-8	Asinex Ltd.	BAS 00535158			Cc1cccc(Oc2cc(NC(=O)Cn3cnc(n3)[N+]([O-])=O)cc(c2)[N+]([O-])=O)c1	InChI=1S/C17H14N6O6/c1-11-3-2-4-14(5-11)29-15-7-12(6-13(8-15)22(25)26)19-16(24)9-21-10-18-17(20-21)23(27)28/h2-8,10H,9H2,1H3,(H,19,24)	XHOYPAKCFYMKRW-UHFFFAOYSA-N	398.097482228							105572
MLS000057806	LSM-16936	SID3717639, SID87225512, BRD-K72107498	2083976	InChI=1S/C21H23N3O6/c1-11(2)9-24-18(22)16(19(26)23(4)21(24)28)14(25)10-29-20(27)17-12(3)13-7-5-6-8-15(13)30-17/h5-8,11H,9-10,22H2,1-4H3	ATZFJFSDKLYBSV-UHFFFAOYSA-N	CC(C)CN1C(=C(C(=O)COC(=O)c2oc3ccccc3c2C)C(=O)N(C)C1=O)N	BroadT	BRD-K72107498	BRD-K72107498-001-05-9	Enamine Ltd.	T5226776			CC(C)Cn1c(N)c(C(=O)COC(=O)c2oc3ccccc3c2C)c(=O)n(C)c1=O	InChI=1S/C21H23N3O6/c1-11(2)9-24-18(22)16(19(26)23(4)21(24)28)14(25)10-29-20(27)17-12(3)13-7-5-6-8-15(13)30-17/h5-8,11H,9-10,22H2,1-4H3	ATZFJFSDKLYBSV-UHFFFAOYSA-N	413.158685486							105573
BAS 00226183	LSM-16937	SID49642941, BRD-K64730883	802111	InChI=1S/C14H14N4/c1-9-3-6-14(10(2)7-9)18-16-12-5-4-11(15)8-13(12)17-18/h3-8H,15H2,1-2H3	BEGABUJCGKABMR-UHFFFAOYSA-N	Cc1ccc(c(C)c1)n2nc3ccc(N)cc3n2	BroadT	BRD-K64730883	BRD-K64730883-001-06-9	Asinex Ltd.	BAS 00226183			Cc1ccc(c(C)c1)-n1nc2ccc(N)cc2n1	InChI=1S/C14H14N4/c1-9-3-6-14(10(2)7-9)18-16-12-5-4-11(15)8-13(12)17-18/h3-8H,15H2,1-2H3	BEGABUJCGKABMR-UHFFFAOYSA-N	238.121846488							105574
F0579-0138	LSM-16938	SID4247995, BRD-K36399394	2155202	InChI=1S/C18H16N4O2S3/c1-11-2-4-12(5-3-11)22-16(24)15-13(6-8-25-15)20-18(22)27-10-14(23)21-17-19-7-9-26-17/h2-5,7,9H,6,8,10H2,1H3,(H,19,21,23)	QSHZHMOHJRVJFA-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=NC3=C(SCC3)C2=O)SCC(=O)Nc4nccs4	BroadT	BRD-K36399394	BRD-K36399394-001-06-0	ChemDiv Inc.	C144-0127			Cc1ccc(cc1)-n1c(SCC(=O)Nc2nccs2)nc2CCSc2c1=O	InChI=1S/C18H16N4O2S3/c1-11-2-4-12(5-3-11)22-16(24)15-13(6-8-25-15)20-18(22)27-10-14(23)21-17-19-7-9-26-17/h2-5,7,9H,6,8,10H2,1H3,(H,19,21,23)	QSHZHMOHJRVJFA-UHFFFAOYSA-N	416.043537862							105575
ST50183659	LSM-43678	SID24802798, BRD-K83821605	1556125	InChI=1S/C16H15ClN2O3S/c1-2-22-15(21)9-12-10-23-16(18-12)19-14(20)8-7-11-5-3-4-6-13(11)17/h3-8,10H,2,9H2,1H3,(H,18,19,20)/b8-7-	OBPZXQPDHJXIEU-FPLPWBNLSA-N	CCOC(=O)Cc1csc(NC(=O)\C=C/c2ccccc2Cl)n1	BroadT	BRD-K83821605	BRD-K83821605-001-05-2	Asinex Ltd.	BAS 02140097			CCOC(=O)Cc1csc(NC(=O)\C=C/c2ccccc2Cl)n1	InChI=1S/C16H15ClN2O3S/c1-2-22-15(21)9-12-10-23-16(18-12)19-14(20)8-7-11-5-3-4-6-13(11)17/h3-8,10H,2,9H2,1H3,(H,18,19,20)/b8-7-	OBPZXQPDHJXIEU-FPLPWBNLSA-N	350.04919076							
SMR000206475	LSM-16940	SID17509510, BRD-K53719842	12004860	InChI=1S/C17H21N7O2/c1-10(2)18-14(25)8-9-15(26)21-22-17-20-13-7-5-4-6-12(13)16-19-11(3)23-24(16)17/h4-7,10H,8-9H2,1-3H3,(H,18,25)(H,20,22)(H,21,26)	SJMVOPDTCFVHTR-UHFFFAOYSA-N	CC(C)NC(=O)CCC(=O)NNc1nc2ccccc2c3nc(C)nn13	BroadT	BRD-K53719842	BRD-K53719842-001-06-5	ChemDiv Inc.	C600-0003			CC(C)NC(=O)CCC(=O)NNc1nc2ccccc2c2nc(C)nn12	InChI=1S/C17H21N7O2/c1-10(2)18-14(25)8-9-15(26)21-22-17-20-13-7-5-4-6-12(13)16-19-11(3)23-24(16)17/h4-7,10H,8-9H2,1-3H3,(H,18,25)(H,20,22)(H,21,26)	SJMVOPDTCFVHTR-UHFFFAOYSA-N	355.175672982							105577
MLS000680743	LSM-43679	SID85285625, SID22416204, BRD-K00381373	887992	InChI=1S/C16H18N4O2/c1-13-3-4-14(22-13)5-6-15(21)19-9-11-20(12-10-19)16-17-7-2-8-18-16/h2-8H,9-12H2,1H3/b6-5+	ZQASEDXTLUSBAI-AATRIKPKSA-N	Cc1oc(\C=C\C(=O)N2CCN(CC2)c3ncccn3)cc1	BroadT	BRD-K00381373	BRD-K00381373-001-05-7	ChemBridge Corporation	7306446			Cc1ccc(\C=C\C(=O)N2CCN(CC2)c2ncccn2)o1	InChI=1S/C16H18N4O2/c1-13-3-4-14(22-13)5-6-15(21)19-9-11-20(12-10-19)16-17-7-2-8-18-16/h2-8H,9-12H2,1H3/b6-5+	ZQASEDXTLUSBAI-AATRIKPKSA-N	298.142975856							
AK-968/37044065	LSM-16942	SID24809929, BRD-A12862431	2863233	InChI=1S/C17H19N3O7/c1-4-5-25-16(21)14-9(2)19(3)17(22)18-15(14)10-6-12-13(27-8-26-12)7-11(10)20(23)24/h6-7,15H,4-5,8H2,1-3H3,(H,18,22)	OQWOCRDDBQMUER-UHFFFAOYSA-N	CCCOC(=O)C1=C(C)N(C)C(=O)NC1c2cc3OCOc3cc2[N+](=O)[O-]	BroadT	BRD-A12862431	BRD-A12862431-001-05-4	Asinex Ltd.	BAS 00679711			CCCOC(=O)C1=C(C)N(C)C(=O)NC1c1cc2OCOc2cc1[N+]([O-])=O	InChI=1S/C17H19N3O7/c1-4-5-25-16(21)14-9(2)19(3)17(22)18-15(14)10-6-12-13(27-8-26-12)7-11(10)20(23)24/h6-7,15H,4-5,8H2,1-3H3,(H,18,22)	OQWOCRDDBQMUER-UHFFFAOYSA-N	377.122299978							105579
BAS 00678327	LSM-16943	SID17408734, BRD-K88806900	809168	InChI=1S/C12H9ClN2O2S/c13-9-5-2-1-4-8(9)11(16)14-15-12(17)10-6-3-7-18-10/h1-7H,(H,14,16)(H,15,17)	GVUCBTUKYVLGSX-UHFFFAOYSA-N	Clc1ccccc1C(=O)NNC(=O)c2cccs2	BroadT	BRD-K88806900	BRD-K88806900-001-05-0	Asinex Ltd.	BAS 00678327			Clc1ccccc1C(=O)NNC(=O)c1cccs1	InChI=1S/C12H9ClN2O2S/c13-9-5-2-1-4-8(9)11(16)14-15-12(17)10-6-3-7-18-10/h1-7H,(H,14,16)(H,15,17)	GVUCBTUKYVLGSX-UHFFFAOYSA-N	280.007325948							105580
MLS000029975	LSM-16944	SID843916, BRD-K08831377	646224	InChI=1S/C21H31ClN4O3/c22-17-5-7-18(8-6-17)24-20(28)25-21(9-2-1-3-10-21)19(27)23-11-4-12-26-13-15-29-16-14-26/h5-8H,1-4,9-16H2,(H,23,27)(H2,24,25,28)	YBFYVJOHPDSLSS-UHFFFAOYSA-N	Clc1ccc(NC(=O)NC2(CCCCC2)C(=O)NCCCN3CCOCC3)cc1	BroadT	BRD-K08831377	BRD-K08831377-001-05-9	Asinex Ltd.	ASN 08831861			Clc1ccc(NC(=O)NC2(CCCCC2)C(=O)NCCCN2CCOCC2)cc1	InChI=1S/C21H31ClN4O3/c22-17-5-7-18(8-6-17)24-20(28)25-21(9-2-1-3-10-21)19(27)23-11-4-12-26-13-15-29-16-14-26/h5-8H,1-4,9-16H2,(H,23,27)(H2,24,25,28)	YBFYVJOHPDSLSS-UHFFFAOYSA-N	422.208468602							105581
SMR000017623	LSM-43680	SID7969844, BRD-K30309882	4639586	InChI=1S/C11H13N7/c1(4-18-5-3-12-8-18)2-13-10-9-11(15-6-14-9)17-7-16-10/h3,5-8H,1-2,4H2,(H2,13,14,15,16,17)	YRKNUEQFXHPPDI-UHFFFAOYSA-N	C(CNc1[nH]cnc2ncnc12)Cn3ccnc3	BroadT	BRD-K30309882	BRD-K30309882-001-04-9	Life Chemicals Inc.	F0578-0051			C(CNc1[nH]cnc2ncnc12)Cn1ccnc1	InChI=1S/C11H13N7/c1(4-18-5-3-12-8-18)2-13-10-9-11(15-6-14-9)17-7-16-10/h3,5-8H,1-2,4H2,(H2,13,14,15,16,17)	YRKNUEQFXHPPDI-UHFFFAOYSA-N	243.123243486							
MLS000409274	LSM-16946	SID22403663, BRD-A47393232	4834110	InChI=1S/C21H20Cl2N2O5S/c1-12(2)19(25-31(28,29)20-15(22)7-5-8-16(20)23)21(27)30-11-18(26)14-10-24-17-9-4-3-6-13(14)17/h3-10,12,19,24-25H,11H2,1-2H3	RBYIMXNASLXXRG-UHFFFAOYSA-N	CC(C)C(NS(=O)(=O)c1c(Cl)cccc1Cl)C(=O)OCC(=O)c2c[nH]c3ccccc23	BroadT	BRD-A47393232	BRD-A47393232-001-05-0	Enamine Ltd.	T5304168			CC(C)C(NS(=O)(=O)c1c(Cl)cccc1Cl)C(=O)OCC(=O)c1c[nH]c2ccccc12	InChI=1S/C21H20Cl2N2O5S/c1-12(2)19(25-31(28,29)20-15(22)7-5-8-16(20)23)21(27)30-11-18(26)14-10-24-17-9-4-3-6-13(14)17/h3-10,12,19,24-25H,11H2,1-2H3	RBYIMXNASLXXRG-UHFFFAOYSA-N	482.04699787							105583
STK082599	LSM-16947	SID856727, BRD-K87569241	658086	InChI=1S/C22H25N3O5S/c1-22(2)10-12-13(11-29-22)19(25-6-8-28-9-7-25)24-20-16(12)17(23)18(31-20)14-4-5-15(30-14)21(26)27-3/h4-5H,6-11,23H2,1-3H3	MJPOGLKYICRFMO-UHFFFAOYSA-N	COC(=O)c1oc(cc1)c2sc3nc(N4CCOCC4)c5COC(C)(C)Cc5c3c2N	BroadT	BRD-K87569241	BRD-K87569241-001-06-1	InterBioScreen Ltd.	STOCK1S-30421			COC(=O)c1ccc(o1)-c1sc2nc(N3CCOCC3)c3COC(C)(C)Cc3c2c1N	InChI=1S/C22H25N3O5S/c1-22(2)10-12-13(11-29-22)19(25-6-8-28-9-7-25)24-20-16(12)17(23)18(31-20)14-4-5-15(30-14)21(26)27-3/h4-5H,6-11,23H2,1-3H3	MJPOGLKYICRFMO-UHFFFAOYSA-N	443.15149162							105584
5-Tert-butyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid	LSM-16948	SID4245922, BRD-A61868010	3240332	InChI=1S/C12H18N2O2/c1-12(2,3)7-4-5-9-8(6-7)10(11(15)16)14-13-9/h7H,4-6H2,1-3H3,(H,13,14)(H,15,16)	SUXLFEALYPIVJT-UHFFFAOYSA-N	CC(C)(C)C1CCc2n[nH]c(C(=O)O)c2C1	BroadT	BRD-A61868010	BRD-A61868010-001-04-3	ChemDiv Inc.	R052-2207			CC(C)(C)C1CCc2n[nH]c(C(O)=O)c2C1	InChI=1S/C12H18N2O2/c1-12(2,3)7-4-5-9-8(6-7)10(11(15)16)14-13-9/h7H,4-6H2,1-3H3,(H,13,14)(H,15,16)	SUXLFEALYPIVJT-UHFFFAOYSA-N	222.136827836							105585
ZINC01126803	LSM-16949	SID14736469, BRD-K75910910	1302670	InChI=1S/C17H21N5O4/c1-21(2)15-18-16(22-8-10-25-11-9-22)20-17(19-15)26-13-6-4-12(5-7-13)14(23)24-3/h4-7H,8-11H2,1-3H3	NDYUJMGUQAHBAG-UHFFFAOYSA-N	COC(=O)c1ccc(Oc2nc(nc(n2)N3CCOCC3)N(C)C)cc1	BroadT	BRD-K75910910	BRD-K75910910-001-05-3	ChemBridge Corporation	7375331			COC(=O)c1ccc(Oc2nc(nc(n2)N2CCOCC2)N(C)C)cc1	InChI=1S/C17H21N5O4/c1-21(2)15-18-16(22-8-10-25-11-9-22)20-17(19-15)26-13-6-4-12(5-7-13)14(23)24-3/h4-7H,8-11H2,1-3H3	NDYUJMGUQAHBAG-UHFFFAOYSA-N	359.159354202							105586
AC1O9BP8	LSM-16950	BRD-K19193283	6754300	InChI=1S/C20H19N5O2/c1-11-4-6-15(8-12(11)2)25-19(26)16(13(3)24-25)10-21-14-5-7-17-18(9-14)23-20(27)22-17/h4-10,26H,1-3H3,(H2,22,23,27)	SXILDWVZWVKPBR-UHFFFAOYSA-N	Cc1ccc(cc1C)n2nc(C)c(C=Nc3ccc4[nH]c(O)nc4c3)c2O	BroadT	BRD-K19193283	BRD-K19193283-001-05-4	Specs	AK-968/12117134			Cc1nn(c(O)c1C=Nc1ccc2[nH]c(O)nc2c1)-c1ccc(C)c(C)c1	InChI=1S/C20H19N5O2/c1-11-4-6-15(8-12(11)2)25-19(26)16(13(3)24-25)10-21-14-5-7-17-18(9-14)23-20(27)22-17/h4-10,26H,1-3H3,(H2,22,23,27)	SXILDWVZWVKPBR-UHFFFAOYSA-N	361.153874898							
MLS000530119	LSM-16951	SID14734717, BRD-K65788620	7157941	InChI=1S/C12H12N2O3/c1-2-3-10(15)13-7-4-5-8-9(6-7)12(17)14-11(8)16/h4-6H,2-3H2,1H3,(H,13,15)(H,14,16,17)	HYNFGUHAYZBBCE-UHFFFAOYSA-N	CCCC(=O)Nc1ccc2C(=O)NC(=O)c2c1	BroadT	BRD-K65788620	BRD-K65788620-001-05-6	Life Chemicals Inc.	F1105-0222			CCCC(=O)Nc1ccc2C(=O)NC(=O)c2c1	InChI=1S/C12H12N2O3/c1-2-3-10(15)13-7-4-5-8-9(6-7)12(17)14-11(8)16/h4-6H,2-3H2,1H3,(H,13,15)(H,14,16,17)	HYNFGUHAYZBBCE-UHFFFAOYSA-N	232.084792264							105588
SMR000144819	LSM-3370	SID87457149, SID14729800, BRD-K61627029	1248117	InChI=1S/C13H15N9S/c1-21(2)12-16-10(15-11(14)17-12)8-23-13-18-19-20-22(13)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H2,14,15,16,17)	BCGLGHKBCNEHSY-UHFFFAOYSA-N	CN(C)c1nc(N)nc(CSc2nnnn2c3ccccc3)n1	BroadT	BRD-K61627029	BRD-K61627029-001-08-1	ChemBridge Corporation	7950510			CN(C)c1nc(N)nc(CSc2nnnn2-c2ccccc2)n1	InChI=1S/C13H15N9S/c1-21(2)12-16-10(15-11(14)17-12)8-23-13-18-19-20-22(13)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H2,14,15,16,17)	BCGLGHKBCNEHSY-UHFFFAOYSA-N	329.11711226							93075
AM-879/12634002	LSM-43681	SID22413109, BRD-K49998974	5343920	InChI=1S/C28H28N6O5S2/c1-36-22-17-19(18-23-24(35)34(28(40)41-23)20-5-3-2-4-6-20)7-8-21(22)39-27-30-25(32-9-13-37-14-10-32)29-26(31-27)33-11-15-38-16-12-33/h2-8,17-18H,9-16H2,1H3/b23-18+	YBJNRSZNDOOYKC-PTGBLXJZSA-N	COc1cc(\C=C/2\SC(=S)N(C2=O)c3ccccc3)ccc1Oc4nc(nc(n4)N5CCOCC5)N6CCOCC6	BroadT	BRD-K49998974	BRD-K49998974-001-05-4	Specs	AM-879/12634002			COc1cc(\C=C2\SC(=S)N(C2=O)c2ccccc2)ccc1Oc1nc(nc(n1)N1CCOCC1)N1CCOCC1	InChI=1S/C28H28N6O5S2/c1-36-22-17-19(18-23-24(35)34(28(40)41-23)20-5-3-2-4-6-20)7-8-21(22)39-27-30-25(32-9-13-37-14-10-32)29-26(31-27)33-11-15-38-16-12-33/h2-8,17-18H,9-16H2,1H3/b23-18+	YBJNRSZNDOOYKC-PTGBLXJZSA-N	592.156259436							
AC1N2XSV	LSM-16953	SID24415344, SID24790914, BRD-K89900849	4055959	InChI=1S/C22H24N2O5S/c1-14-4-6-19(15(2)12-14)23-22(25)21-16(3)18-13-17(5-7-20(18)29-21)30(26,27)24-8-10-28-11-9-24/h4-7,12-13H,8-11H2,1-3H3,(H,23,25)	DNGCFMDJZXRIDP-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2oc3ccc(cc3c2C)S(=O)(=O)N4CCOCC4)c(C)c1	BroadT	BRD-K89900849	BRD-K89900849-001-05-4	ChemDiv Inc.	K786-1309			Cc1c(oc2ccc(cc12)S(=O)(=O)N1CCOCC1)C(=O)Nc1ccc(C)cc1C	InChI=1S/C22H24N2O5S/c1-14-4-6-19(15(2)12-14)23-22(25)21-16(3)18-13-17(5-7-20(18)29-21)30(26,27)24-8-10-28-11-9-24/h4-7,12-13H,8-11H2,1-3H3,(H,23,25)	DNGCFMDJZXRIDP-UHFFFAOYSA-N	428.140592578							105590
AC1M1XGQ	LSM-16954	SID24815168, BRD-K21799195	2157974	InChI=1S/C24H22F2N4S/c1-16-21(22-14-19(26)4-7-23(22)28-16)10-13-30(15-17-8-11-27-12-9-17)24(31)29-20-5-2-18(25)3-6-20/h2-9,11-12,14,28H,10,13,15H2,1H3,(H,29,31)	NEMUUGPTBADCGF-UHFFFAOYSA-N	Cc1[nH]c2ccc(F)cc2c1CCN(Cc3ccncc3)C(=Nc4ccc(F)cc4)S	BroadT	BRD-K21799195	BRD-K21799195-001-04-4	Life Chemicals Inc.	F0591-1174			Cc1[nH]c2ccc(F)cc2c1CCN(Cc1ccncc1)C(S)=Nc1ccc(F)cc1	InChI=1S/C24H22F2N4S/c1-16-21(22-14-19(26)4-7-23(22)28-16)10-13-30(15-17-8-11-27-12-9-17)24(31)29-20-5-2-18(25)3-6-20/h2-9,11-12,14,28H,10,13,15H2,1H3,(H,29,31)	NEMUUGPTBADCGF-UHFFFAOYSA-N	436.153323834							105591
T5287677	LSM-16955	SID22404283, BRD-K21575567	2496700	InChI=1S/C18H17F3N2O7S/c1-28-12-5-3-10(7-13(12)29-2)23-15(24)9-30-16(25)8-22-31(26,27)14-6-4-11(19)17(20)18(14)21/h3-7,22H,8-9H2,1-2H3,(H,23,24)	ICBJVIWGIADGFU-UHFFFAOYSA-N	COc1ccc(NC(=O)COC(=O)CNS(=O)(=O)c2ccc(F)c(F)c2F)cc1OC	BroadT	BRD-K21575567	BRD-K21575567-001-05-5	Enamine Ltd.	T5287677			COc1ccc(NC(=O)COC(=O)CNS(=O)(=O)c2ccc(F)c(F)c2F)cc1OC	InChI=1S/C18H17F3N2O7S/c1-28-12-5-3-10(7-13(12)29-2)23-15(24)9-30-16(25)8-22-31(26,27)14-6-4-11(19)17(20)18(14)21/h3-7,22H,8-9H2,1-2H3,(H,23,24)	ICBJVIWGIADGFU-UHFFFAOYSA-N	462.070856194							105592
N-{[3-([1,3]oxazolo[4,5-B]pyridin-2-yl)phenyl]carbamothioyl}furan-2-carboxamide	LSM-16956	SID24809938, BRD-K68661868	1367422	InChI=1S/C18H12N4O3S/c23-16(14-7-3-9-24-14)22-18(26)20-12-5-1-4-11(10-12)17-21-15-13(25-17)6-2-8-19-15/h1-10H,(H2,20,22,23,26)	UKSDIBCTABSJOG-UHFFFAOYSA-N	O=C(NC(=S)Nc1cccc(c1)c2oc3cccnc3n2)c4occc4	BroadT	BRD-K68661868	BRD-K68661868-001-05-3	Asinex Ltd.	BAS 02231388			O=C(NC(=S)Nc1cccc(c1)-c1nc2ncccc2o1)c1ccco1	InChI=1S/C18H12N4O3S/c23-16(14-7-3-9-24-14)22-18(26)20-12-5-1-4-11(10-12)17-21-15-13(25-17)6-2-8-19-15/h1-10H,(H2,20,22,23,26)	UKSDIBCTABSJOG-UHFFFAOYSA-N	364.063010974							105593
AC1O9RES	LSM-16957	BRD-K94042366	6790771	InChI=1S/C16H14ClNO2/c1-2-9-20-15-8-3-12(16(19)10-15)11-18-14-6-4-13(17)5-7-14/h2-8,10-11,19H,1,9H2	MLQATICQPCCUKH-UHFFFAOYSA-N	Oc1cc(OCC=C)ccc1C=Nc2ccc(Cl)cc2	BroadT	BRD-K94042366	BRD-K94042366-001-05-1	ChemDiv Inc.	8005-4719			Oc1cc(OCC=C)ccc1C=Nc1ccc(Cl)cc1	InChI=1S/C16H14ClNO2/c1-2-9-20-15-8-3-12(16(19)10-15)11-18-14-6-4-13(17)5-7-14/h2-8,10-11,19H,1,9H2	MLQATICQPCCUKH-UHFFFAOYSA-N	287.071306408							
ST070995	LSM-16958	SID4257371, BRD-K11191978	893621	InChI=1S/C18H16FNO3/c19-14-5-3-13(4-6-14)17-9-7-15(8-10-18(21)22)20(17)12-16-2-1-11-23-16/h1-7,9,11H,8,10,12H2,(H,21,22)	JPHMJMCBMUYUOS-UHFFFAOYSA-N	OC(=O)CCc1ccc(c2ccc(F)cc2)n1Cc3occc3	BroadT	BRD-K11191978	BRD-K11191978-001-05-6	ChemBridge Corporation	7586374			OC(=O)CCc1ccc(-c2ccc(F)cc2)n1Cc1ccco1	InChI=1S/C18H16FNO3/c19-14-5-3-13(4-6-14)17-9-7-15(8-10-18(21)22)20(17)12-16-2-1-11-23-16/h1-7,9,11H,8,10,12H2,(H,21,22)	JPHMJMCBMUYUOS-UHFFFAOYSA-N	313.111421582							105595
ZINC02277811	LSM-16959	SID857342, SID50103620, BRD-K22606571	658691	InChI=1S/C9H9F6N3OS2/c1-3-20-6-18-17-5(21-6)16-4(19)7(2,8(10,11)12)9(13,14)15/h3H2,1-2H3,(H,16,17,19)	CACIMFREAFKQBY-UHFFFAOYSA-N	CCSc1nnc(NC(=O)C(C)(C(F)(F)F)C(F)(F)F)s1	BroadT	BRD-K22606571	BRD-K22606571-001-05-1	InterBioScreen Ltd.	STOCK1S-68523			CCSc1nnc(NC(=O)C(C)(C(F)(F)F)C(F)(F)F)s1	InChI=1S/C9H9F6N3OS2/c1-3-20-6-18-17-5(21-6)16-4(19)7(2,8(10,11)12)9(13,14)15/h3H2,1-2H3,(H,16,17,19)	CACIMFREAFKQBY-UHFFFAOYSA-N	353.009122518							105596
F0643-0459	LSM-16960	SID4250514, BRD-K90126707	767828	InChI=1S/C14H13N3O2S2/c1-9-8-20-13(15-9)16-12(18)6-7-17-10-4-2-3-5-11(10)21-14(17)19/h2-5,8H,6-7H2,1H3,(H,15,16,18)	LDVRMIBHMMUCJM-UHFFFAOYSA-N	Cc1csc(NC(=O)CCN2C(=O)Sc3ccccc23)n1	BroadT	BRD-K90126707	BRD-K90126707-001-05-4	ChemDiv Inc.	C489-0360			Cc1csc(NC(=O)CCn2c3ccccc3sc2=O)n1	InChI=1S/C14H13N3O2S2/c1-9-8-20-13(15-9)16-12(18)6-7-17-10-4-2-3-5-11(10)21-14(17)19/h2-5,8H,6-7H2,1H3,(H,15,16,18)	LDVRMIBHMMUCJM-UHFFFAOYSA-N	319.044918066							105597
1,8-Dimethoxyphenazine	LSM-16961	SID24826075, BRD-K71919342	4136929	InChI=1S/C14H12N2O2/c1-17-9-6-7-10-12(8-9)16-14-11(15-10)4-3-5-13(14)18-2/h3-8H,1-2H3	CXHKQNZBSNIFHR-UHFFFAOYSA-N	COc1ccc2nc3cccc(OC)c3nc2c1	BroadT	BRD-K71919342	BRD-K71919342-001-06-4	Enamine Ltd.	T0400-2608			COc1ccc2nc3cccc(OC)c3nc2c1	InChI=1S/C14H12N2O2/c1-17-9-6-7-10-12(8-9)16-14-11(15-10)4-3-5-13(14)18-2/h3-8H,1-2H3	CXHKQNZBSNIFHR-UHFFFAOYSA-N	240.089877644							105598
ZINC03226122	LSM-16962	SID22406181, BRD-K02458322	2344311	InChI=1S/C23H20N4O2S/c28-21(26-23-25-19(14-30-23)15-7-3-1-4-8-15)16-10-11-17-18(13-16)24-20-9-5-2-6-12-27(20)22(17)29/h1,3-4,7-8,10-11,13-14H,2,5-6,9,12H2,(H,25,26,28)	CHAKNUAHQDBPFY-UHFFFAOYSA-N	O=C(Nc1nc(cs1)c2ccccc2)c3ccc4C(=O)N5CCCCCC5=Nc4c3	BroadT	BRD-K02458322	BRD-K02458322-001-06-1	Enamine Ltd.	T0507-7906			O=C(Nc1nc(cs1)-c1ccccc1)c1ccc2c(c1)nc1CCCCCn1c2=O	InChI=1S/C23H20N4O2S/c28-21(26-23-25-19(14-30-23)15-7-3-1-4-8-15)16-10-11-17-18(13-16)24-20-9-5-2-6-12-27(20)22(17)29/h1,3-4,7-8,10-11,13-14H,2,5-6,9,12H2,(H,25,26,28)	CHAKNUAHQDBPFY-UHFFFAOYSA-N	416.13069661							105599
264256-44-2	LSM-16963	SID26730684, BRD-K33721685	2745738	InChI=1S/C13H8Cl2N4O/c14-7-1-2-8(9(15)5-7)11-6-12(20-19-11)10-3-4-17-13(16)18-10/h1-6H,(H2,16,17,18)	HVPDAHDCOOJUMW-UHFFFAOYSA-N	Nc1nccc(n1)c2onc(c2)c3ccc(Cl)cc3Cl	BroadT	BRD-K33721685	BRD-K33721685-001-06-6	Maybridge	SPB 05238			Nc1nccc(n1)-c1cc(no1)-c1ccc(Cl)cc1Cl	InChI=1S/C13H8Cl2N4O/c14-7-1-2-8(9(15)5-7)11-6-12(20-19-11)10-3-4-17-13(16)18-10/h1-6H,(H2,16,17,18)	HVPDAHDCOOJUMW-UHFFFAOYSA-N	306.007516336							105600
AC1LUPI5	LSM-16964	BRD-K33666264	1613879	InChI=1S/C18H17N3O4S/c1-23-14-8-7-12(9-15(14)24-2)10-19-25-11-17(22)21-18-20-13-5-3-4-6-16(13)26-18/h3-10H,11H2,1-2H3,(H,20,21,22)	LJVKFLCDKFMANZ-UHFFFAOYSA-N	COc1ccc(C=NOCC(=O)Nc2nc3ccccc3s2)cc1OC	BroadT	BRD-K33666264	BRD-K33666264-001-05-4	InterBioScreen Ltd.	STOCK4S-22624			COc1ccc(C=NOCC(=O)Nc2nc3ccccc3s2)cc1OC	InChI=1S/C18H17N3O4S/c1-23-14-8-7-12(9-15(14)24-2)10-19-25-11-17(22)21-18-20-13-5-3-4-6-16(13)26-18/h3-10H,11H2,1-2H3,(H,20,21,22)	LJVKFLCDKFMANZ-UHFFFAOYSA-N	371.093976744							105601
ST50677751	LSM-16965	SID49715972, BRD-K08252773	17252791	InChI=1S/C20H18FN3O3/c21-15-3-5-16(6-4-15)23-9-11-24(12-10-23)20(26)18-13-19(27-22-18)14-1-7-17(25)8-2-14/h1-8,13,25H,9-12H2	OFFAYDIHAZBGNH-UHFFFAOYSA-N	Oc1ccc(cc1)c2onc(c2)C(=O)N3CCN(CC3)c4ccc(F)cc4	BroadT	BRD-K08252773	BRD-K08252773-001-06-6	ChemDiv Inc.	C226-0583			Oc1ccc(cc1)-c1cc(no1)C(=O)N1CCN(CC1)c1ccc(F)cc1	InChI=1S/C20H18FN3O3/c21-15-3-5-16(6-4-15)23-9-11-24(12-10-23)20(26)18-13-19(27-22-18)14-1-7-17(25)8-2-14/h1-8,13,25H,9-12H2	OFFAYDIHAZBGNH-UHFFFAOYSA-N	367.133219666							
2-[2-(7H-Purin-6-ylamino)ethoxy]ethanol	LSM-43682	SID7971477, BRD-K85314456	2155050	InChI=1S/C9H13N5O2/c15-2-4-16-3-1-10-8-7-9(12-5-11-7)14-6-13-8/h5-6,15H,1-4H2,(H2,10,11,12,13,14)	UYXHZMSJRMCVFC-UHFFFAOYSA-N	OCCOCCNc1[nH]cnc2ncnc12	BroadT	BRD-K85314456	BRD-K85314456-001-04-9	Life Chemicals Inc.	F0578-0072			OCCOCCNc1[nH]cnc2ncnc12	InChI=1S/C9H13N5O2/c15-2-4-16-3-1-10-8-7-9(12-5-11-7)14-6-13-8/h5-6,15H,1-4H2,(H2,10,11,12,13,14)	UYXHZMSJRMCVFC-UHFFFAOYSA-N	223.106924706							
MLS000409344	LSM-16967	SID22402659, BRD-K18367191	4831734	InChI=1S/C27H32N4O4S/c1-3-31(4-2)36(33,34)19-12-13-25(30-14-16-35-17-15-30)24(18-19)29-27(32)26-20-8-5-6-10-22(20)28-23-11-7-9-21(23)26/h5-6,8,10,12-13,18H,3-4,7,9,11,14-17H2,1-2H3,(H,29,32)	NUZOBJNMJBWZRT-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)c3c4CCCc4nc5ccccc35)c1	BroadT	BRD-K18367191	BRD-K18367191-001-05-6	Enamine Ltd.	T5294282			CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)c2c3CCCc3nc3ccccc23)c1	InChI=1S/C27H32N4O4S/c1-3-31(4-2)36(33,34)19-12-13-25(30-14-16-35-17-15-30)24(18-19)29-27(32)26-20-8-5-6-10-22(20)28-23-11-7-9-21(23)26/h5-6,8,10,12-13,18H,3-4,7,9,11,14-17H2,1-2H3,(H,29,32)	NUZOBJNMJBWZRT-UHFFFAOYSA-N	508.214426234							105604
2-(4-Bromo-phenyl)-thiazolidine	LSM-16968	SID24815740, BRD-A41484464	2771064	InChI=1S/C9H10BrNS/c10-8-3-1-7(2-4-8)9-11-5-6-12-9/h1-4,9,11H,5-6H2	YHMUSIBVYIZADU-UHFFFAOYSA-N	Brc1ccc(cc1)C2NCCS2	BroadT	BRD-A41484464	BRD-A41484464-001-06-0	Life Chemicals Inc.	F1912-0001			Brc1ccc(cc1)C1NCCS1	InChI=1S/C9H10BrNS/c10-8-3-1-7(2-4-8)9-11-5-6-12-9/h1-4,9,11H,5-6H2	YHMUSIBVYIZADU-UHFFFAOYSA-N	242.97173262							105605
N-[4-Methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-1,3-benzodioxole-5-carboxamide	LSM-16969	SID4247258, BRD-K43722615	3241487	InChI=1S/C23H24N4O3/c1-15-11-22(27-9-7-26(2)8-10-27)25-19-5-4-17(13-18(15)19)24-23(28)16-3-6-20-21(12-16)30-14-29-20/h3-6,11-13H,7-10,14H2,1-2H3,(H,24,28)	AGIAQXNCZZGFLH-UHFFFAOYSA-N	CN1CCN(CC1)c2cc(C)c3cc(NC(=O)c4ccc5OCOc5c4)ccc3n2	BroadT	BRD-K43722615	BRD-K43722615-001-04-2	ChemDiv Inc.	C138-2003			CN1CCN(CC1)c1cc(C)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2n1	InChI=1S/C23H24N4O3/c1-15-11-22(27-9-7-26(2)8-10-27)25-19-5-4-17(13-18(15)19)24-23(28)16-3-6-20-21(12-16)30-14-29-20/h3-6,11-13H,7-10,14H2,1-2H3,(H,24,28)	AGIAQXNCZZGFLH-UHFFFAOYSA-N	404.184840668							105606
ST057882	LSM-43683	SID24803206, BRD-K98065258	2243980	InChI=1S/C20H16FN3O7S/c1-2-31-15-8-11(7-14(18(15)26)24(29)30)9-16-19(27)23(20(28)32-16)10-17(25)22-13-6-4-3-5-12(13)21/h3-9,26H,2,10H2,1H3,(H,22,25)/b16-9-	KYPHIVXJAXXJJL-SXGWCWSVSA-N	CCOc1cc(\C=C\2/SC(=O)N(CC(=O)Nc3ccccc3F)C2=O)cc(c1O)[N+](=O)[O-]	BroadT	BRD-K98065258	BRD-K98065258-001-05-9	ChemBridge Corporation	6639941			CCOc1cc(\C=C2/SC(=O)N(CC(=O)Nc3ccccc3F)C2=O)cc(c1O)[N+]([O-])=O	InChI=1S/C20H16FN3O7S/c1-2-31-15-8-11(7-14(18(15)26)24(29)30)9-16-19(27)23(20(28)32-16)10-17(25)22-13-6-4-3-5-12(13)21/h3-9,26H,2,10H2,1H3,(H,22,25)/b16-9-	KYPHIVXJAXXJJL-SXGWCWSVSA-N	461.069298772							
MLS000549477	LSM-16971	SID14728277, BRD-K22762517	1744577	InChI=1S/C17H26N2O4S/c1-6-9-10-12(20)18-15-13(17(22)23-5)11(4)14(24-15)16(21)19(7-2)8-3/h6-10H2,1-5H3,(H,18,20)	PSYAGVVETKNVPF-UHFFFAOYSA-N	CCCCC(=O)Nc1sc(C(=O)N(CC)CC)c(C)c1C(=O)OC	BroadT	BRD-K22762517	BRD-K22762517-001-06-7	Specs	AK-968/13026024			CCCCC(=O)Nc1sc(C(=O)N(CC)CC)c(C)c1C(=O)OC	InChI=1S/C17H26N2O4S/c1-6-9-10-12(20)18-15-13(17(22)23-5)11(4)14(24-15)16(21)19(7-2)8-3/h6-10H2,1-5H3,(H,18,20)	PSYAGVVETKNVPF-UHFFFAOYSA-N	354.161328022							105608
4-(1,1,2,3,3,3-Hexafluoropropoxy)benzoic acid	LSM-16972	SID3713995, BRD-A76935636	2998630	InChI=1S/C10H6F6O3/c11-8(9(12,13)14)10(15,16)19-6-3-1-5(2-4-6)7(17)18/h1-4,8H,(H,17,18)	CITRBORWAIVSJU-UHFFFAOYSA-N	OC(=O)c1ccc(OC(F)(F)C(F)C(F)(F)F)cc1	BroadT	BRD-A76935636	BRD-A76935636-001-05-4	Enamine Ltd.	T0517-2252			OC(=O)c1ccc(OC(F)(F)C(F)C(F)(F)F)cc1	InChI=1S/C10H6F6O3/c11-8(9(12,13)14)10(15,16)19-6-3-1-5(2-4-6)7(17)18/h1-4,8H,(H,17,18)	CITRBORWAIVSJU-UHFFFAOYSA-N	288.022113252							105609
EN300-02713	LSM-16973	SID24782355, BRD-K88289303	2353771	InChI=1S/C20H15N5O2S/c21-18-17(20-23-14-7-3-4-8-16(14)28-20)15(26)10-25(18)24-19(27)12-9-22-13-6-2-1-5-11(12)13/h1-9,22H,10,21H2,(H,24,27)	QLPJOBBIJIWDOA-UHFFFAOYSA-N	NC1=C(C(=O)CN1NC(=O)c2c[nH]c3ccccc23)c4nc5ccccc5s4	BroadT	BRD-K88289303	BRD-K88289303-001-06-0	Enamine Ltd.	T0508-7213			NC1=C(C(=O)CN1NC(=O)c1c[nH]c2ccccc12)c1nc2ccccc2s1	InChI=1S/C20H15N5O2S/c21-18-17(20-23-14-7-3-4-8-16(14)28-20)15(26)10-25(18)24-19(27)12-9-22-13-6-2-1-5-11(12)13/h1-9,22H,10,21H2,(H,24,27)	QLPJOBBIJIWDOA-UHFFFAOYSA-N	389.09464546							105610
MLS000676433	LSM-16974	SID24782530, BRD-K78122650	1328724	InChI=1S/C20H15ClN2O5S/c1-27-16-7-4-12(19(25)26)10-14(16)22-20(29)23-18(24)17-9-8-15(28-17)11-2-5-13(21)6-3-11/h2-10H,1H3,(H,25,26)(H2,22,23,24,29)	UHEGZSZRLPTCPP-UHFFFAOYSA-N	COc1ccc(cc1NC(=S)NC(=O)c2oc(cc2)c3ccc(Cl)cc3)C(=O)O	BroadT	BRD-K78122650	BRD-K78122650-001-05-6	ChemBridge Corporation	7011401			COc1ccc(cc1NC(=S)NC(=O)c1ccc(o1)-c1ccc(Cl)cc1)C(O)=O	InChI=1S/C20H15ClN2O5S/c1-27-16-7-4-12(19(25)26)10-14(16)22-20(29)23-18(24)17-9-8-15(28-17)11-2-5-13(21)6-3-11/h2-10H,1H3,(H,25,26)(H2,22,23,24,29)	UHEGZSZRLPTCPP-UHFFFAOYSA-N	430.03902							105611
2-Chloro-n-(3-ethyl-2-oxo-2,3-dihydro-benzooxazol-6-yl)-acetamide	LSM-16975	SID24817194, BRD-K26278645	3159246	InChI=1S/C11H11ClN2O3/c1-2-14-8-4-3-7(13-10(15)6-12)5-9(8)17-11(14)16/h3-5H,2,6H2,1H3,(H,13,15)	MOXIZUOIEDHYCB-UHFFFAOYSA-N	CCN1C(=O)Oc2cc(NC(=O)CCl)ccc12	BroadT	BRD-K26278645	BRD-K26278645-001-05-7	Asinex Ltd.	BAS 09890511			CCn1c2ccc(NC(=O)CCl)cc2oc1=O	InChI=1S/C11H11ClN2O3/c1-2-14-8-4-3-7(13-10(15)6-12)5-9(8)17-11(14)16/h3-5H,2,6H2,1H3,(H,13,15)	MOXIZUOIEDHYCB-UHFFFAOYSA-N	254.045819942							105612
AC1M3GKX	LSM-43684	SID22403320, BRD-K84767166	2189681	InChI=1S/C19H18N4O3S/c1-11(2)13-4-6-14(7-5-13)23-17(25)15(16(24)22-19(23)26)8-12-9-20-18(27-3)21-10-12/h4-11H,1-3H3,(H,22,24,26)/b15-8-	VJKULGQUVOULMY-NVNXTCNLSA-N	CSc1ncc(\C=C/2\C(=O)NC(=O)N(C2=O)c3ccc(cc3)C(C)C)cn1	BroadT	BRD-K84767166	BRD-K84767166-001-05-7	ChemBridge Corporation	6585282			CSc1ncc(\C=C2\C(=O)NC(=O)N(C2=O)c2ccc(cc2)C(C)C)cn1	InChI=1S/C19H18N4O3S/c1-11(2)13-4-6-14(7-5-13)23-17(25)15(16(24)22-19(23)26)8-12-9-20-18(27-3)21-10-12/h4-11H,1-3H3,(H,22,24,26)/b15-8-	VJKULGQUVOULMY-NVNXTCNLSA-N	382.109961166							
AC1OAUN4	LSM-16977	BRD-K20084348	6810593	InChI=1S/C20H16ClN5O2/c1-12-17(20(28)26(24-12)15-7-5-6-14(21)10-15)11-22-25-13(2)23-18-9-4-3-8-16(18)19(25)27/h3-11,28H,1-2H3	LXBKQPKSTVRBKQ-UHFFFAOYSA-N	CC1=Nc2ccccc2C(=O)N1N=Cc3c(C)nn(c3O)c4cccc(Cl)c4	BroadT	BRD-K20084348	BRD-K20084348-001-05-5	Asinex Ltd.	BAS 00516715			Cc1nn(c(O)c1C=Nn1c(C)nc2ccccc2c1=O)-c1cccc(Cl)c1	InChI=1S/C20H16ClN5O2/c1-12-17(20(28)26(24-12)15-7-5-6-14(21)10-15)11-22-25-13(2)23-18-9-4-3-8-16(18)19(25)27/h3-11,28H,1-2H3	LXBKQPKSTVRBKQ-UHFFFAOYSA-N	393.099252512							
MLS000105721	LSM-16978	SID7972825, BRD-A65313838	2832296	InChI=1S/C24H22N2O5/c1-30-17-9-7-16(8-10-17)21(27)25-14-24-12-11-18(31-24)19-20(24)23(29)26(22(19)28)13-15-5-3-2-4-6-15/h2-12,18-20H,13-14H2,1H3,(H,25,27)	FIWVFKGPAZUXEL-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NCC23OC(C=C2)C4C3C(=O)N(Cc5ccccc5)C4=O	BroadT	BRD-A65313838	BRD-A65313838-001-05-3	ChemBridge Corporation	5185007			COc1ccc(cc1)C(=O)NCC12OC(C=C1)C1C2C(=O)N(Cc2ccccc2)C1=O	InChI=1S/C24H22N2O5/c1-30-17-9-7-16(8-10-17)21(27)25-14-24-12-11-18(31-24)19-20(24)23(29)26(22(19)28)13-15-5-3-2-4-6-15/h2-12,18-20H,13-14H2,1H3,(H,25,27)	FIWVFKGPAZUXEL-UHFFFAOYSA-N	418.152871824							105615
AC1LZ3C3	LSM-16979	BRD-K70201878	1940545	InChI=1S/C16H12ClN5O4/c1-9-6-14(20-19-9)16(23)21-18-8-11-3-5-15(26-11)12-4-2-10(22(24)25)7-13(12)17/h2-8H,1H3,(H,19,20)(H,21,23)	SPQXPYXGMNMEAG-UHFFFAOYSA-N	Cc1cc([nH]n1)C(=O)NN=Cc2oc(cc2)c3ccc(cc3Cl)[N+](=O)[O-]	BroadT	BRD-K70201878	BRD-K70201878-001-06-0	InterBioScreen Ltd.	STOCK2S-87752			Cc1cc([nH]n1)C(=O)NN=Cc1ccc(o1)-c1ccc(cc1Cl)[N+]([O-])=O	InChI=1S/C16H12ClN5O4/c1-9-6-14(20-19-9)16(23)21-18-8-11-3-5-15(26-11)12-4-2-10(22(24)25)7-13(12)17/h2-8H,1H3,(H,19,20)(H,21,23)	SPQXPYXGMNMEAG-UHFFFAOYSA-N	373.057781624							105616
MLS000545074	LSM-16980	SID17387433, BRD-K67394135	1716237	InChI=1S/C18H17F3N2O2S/c1-2-9-25-15-8-3-5-12(10-15)16(24)23-17(26)22-14-7-4-6-13(11-14)18(19,20)21/h3-8,10-11H,2,9H2,1H3,(H2,22,23,24,26)	YWMPBINJAQZDGR-UHFFFAOYSA-N	CCCOc1cccc(c1)C(=O)NC(=S)Nc2cccc(c2)C(F)(F)F	BroadT	BRD-K67394135	BRD-K67394135-001-05-9	Specs	AN-648/40682341			CCCOc1cccc(c1)C(=O)NC(=S)Nc1cccc(c1)C(F)(F)F	InChI=1S/C18H17F3N2O2S/c1-2-9-25-15-8-3-5-12(10-15)16(24)23-17(26)22-14-7-4-6-13(11-14)18(19,20)21/h3-8,10-11H,2,9H2,1H3,(H2,22,23,24,26)	YWMPBINJAQZDGR-UHFFFAOYSA-N	382.096283094							105617
3-(4-Methylphenyl)-6-(4-pyridinyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole	LSM-16981	SID4263382, BRD-K30681000	1234098	InChI=1S/C15H11N5S/c1-10-2-4-11(5-3-10)13-17-18-15-20(13)19-14(21-15)12-6-8-16-9-7-12/h2-9H,1H3	KIEHGMVRXGSIJJ-UHFFFAOYSA-N	Cc1ccc(cc1)c2nnc3sc(nn23)c4ccncc4	BroadT	BRD-K30681000	BRD-K30681000-001-05-5	ChemBridge Corporation	7959714			Cc1ccc(cc1)-c1nnc2sc(nn12)-c1ccncc1	InChI=1S/C15H11N5S/c1-10-2-4-11(5-3-10)13-17-18-15-20(13)19-14(21-15)12-6-8-16-9-7-12/h2-9H,1H3	KIEHGMVRXGSIJJ-UHFFFAOYSA-N	293.073516092							105618
5-(4-Bromo-phenyl)-4-(4-methoxy-phenyl)-4H-[1,2,4]triazole-3-thiol	LSM-16982	SID47201154, BRD-K94177950	2054913	InChI=1S/C15H12BrN3OS/c1-20-13-8-6-12(7-9-13)19-14(17-18-15(19)21)10-2-4-11(16)5-3-10/h2-9H,1H3,(H,18,21)	CGTFUJNFADHJME-UHFFFAOYSA-N	COc1ccc(cc1)n2c(S)nnc2c3ccc(Br)cc3	BroadT	BRD-K94177950	BRD-K94177950-001-05-7	Asinex Ltd.	BAS 00668834			COc1ccc(cc1)-n1c(S)nnc1-c1ccc(Br)cc1	InChI=1S/C15H12BrN3OS/c1-20-13-8-6-12(7-9-13)19-14(17-18-15(19)21)10-2-4-11(16)5-3-10/h2-9H,1H3,(H,18,21)	CGTFUJNFADHJME-UHFFFAOYSA-N	360.988445324							105619
SMR000142970	LSM-16983	SID14740672, BRD-K75007194	1312940	InChI=1S/C20H16N2O2S2/c1-26(23,24)20-18(21)17-15(13-8-4-2-5-9-13)12-16(22-19(17)25-20)14-10-6-3-7-11-14/h2-12H,21H2,1H3	PPTOYHNJRVKJGO-UHFFFAOYSA-N	CS(=O)(=O)c1sc2nc(cc(c3ccccc3)c2c1N)c4ccccc4	BroadT	BRD-K75007194	BRD-K75007194-001-05-5	ChemBridge Corporation	7576568			CS(=O)(=O)c1sc2nc(cc(-c3ccccc3)c2c1N)-c1ccccc1	InChI=1S/C20H16N2O2S2/c1-26(23,24)20-18(21)17-15(13-8-4-2-5-9-13)12-16(22-19(17)25-20)14-10-6-3-7-11-14/h2-12H,21H2,1H3	PPTOYHNJRVKJGO-UHFFFAOYSA-N	380.065319152							105620
SMR000211317	LSM-43685	SID87346330, SID17511928, BRD-K93953657	1923659	InChI=1S/C24H18BrN3O2/c25-19-7-5-16(6-8-19)23-10-9-20(30-23)13-18(14-26)24(29)27-12-11-17-15-28-22-4-2-1-3-21(17)22/h1-10,13,15,28H,11-12H2,(H,27,29)/b18-13+	BUZCWELQCJCKPT-QGOAFFKASA-N	Brc1ccc(cc1)c2oc(\C=C(/C#N)\C(=O)NCCc3c[nH]c4ccccc34)cc2	BroadT	BRD-K93953657	BRD-K93953657-001-05-8	InterBioScreen Ltd.	STOCK2S-50788			Brc1ccc(cc1)-c1ccc(\C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)o1	InChI=1S/C24H18BrN3O2/c25-19-7-5-16(6-8-19)23-10-9-20(30-23)13-18(14-26)24(29)27-12-11-17-15-28-22-4-2-1-3-21(17)22/h1-10,13,15,28H,11-12H2,(H,27,29)/b18-13+	BUZCWELQCJCKPT-QGOAFFKASA-N	459.058239446							
SMR000063175	LSM-16985	SID3714702, BRD-K98220872	2079202	InChI=1S/C17H16Cl2N2O5S/c1-11-2-4-13(5-3-11)27(24,25)7-6-16(23)26-10-15(22)21-17-14(19)8-12(18)9-20-17/h2-5,8-9H,6-7,10H2,1H3,(H,20,21,22)	BUZMITYLYOZNNE-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)CCC(=O)OCC(=O)Nc2ncc(Cl)cc2Cl	BroadT	BRD-K98220872	BRD-K98220872-001-05-6	Enamine Ltd.	T5226390			Cc1ccc(cc1)S(=O)(=O)CCC(=O)OCC(=O)Nc1ncc(Cl)cc1Cl	InChI=1S/C17H16Cl2N2O5S/c1-11-2-4-13(5-3-11)27(24,25)7-6-16(23)26-10-15(22)21-17-14(19)8-12(18)9-20-17/h2-5,8-9H,6-7,10H2,1H3,(H,20,21,22)	BUZMITYLYOZNNE-UHFFFAOYSA-N	430.015697742							105622
ZINC02857167	LSM-16986	SID24792912, BRD-K93766911	2210441	InChI=1S/C23H22N2O2/c1-16-12-17(2)14-19(13-16)23(27)25-21-10-8-20(9-11-21)24-22(26)15-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)	QGUBPUFQLQNLFA-UHFFFAOYSA-N	Cc1cc(C)cc(c1)C(=O)Nc2ccc(NC(=O)Cc3ccccc3)cc2	BroadT	BRD-K93766911	BRD-K93766911-001-06-4	ChemBridge Corporation	7819677			Cc1cc(C)cc(c1)C(=O)Nc1ccc(NC(=O)Cc2ccccc2)cc1	InChI=1S/C23H22N2O2/c1-16-12-17(2)14-19(13-16)23(27)25-21-10-8-20(9-11-21)24-22(26)15-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)	QGUBPUFQLQNLFA-UHFFFAOYSA-N	358.168127964							105623
1-(4-Chlorophenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol	LSM-15259	BRD-A16760970	3637378	InChI=1S/C19H22ClNO2/c20-17-8-6-16(7-9-17)19(22)18(15-4-2-1-3-5-15)14-21-10-12-23-13-11-21/h1-9,18-19,22H,10-14H2	FUDJAHCMDYNXAS-UHFFFAOYSA-N	OC(C(CN1CCOCC1)c2ccccc2)c3ccc(Cl)cc3	BroadT	BRD-A16760970	BRD-A16760970-003-05-9	InterBioScreen Ltd.	STOCK1S-18871		Cl	OC(C(CN1CCOCC1)c1ccccc1)c1ccc(Cl)cc1.Cl	InChI=1S/C19H22ClNO2.ClH/c20-17-8-6-16(7-9-17)19(22)18(15-4-2-1-3-5-15)14-21-10-12-23-13-11-21;/h1-9,18-19,22H,10-14H2;1H	RGMJSCROVMWTNW-UHFFFAOYSA-N	331.133906664							103906, 103906
AC1OBK17	LSM-16987	BRD-K16845730	6824552	InChI=1S/C18H22N4O2S/c1-11(2)13-4-6-15(7-5-13)21-18(25)22-20-9-16-14(10-23)8-19-12(3)17(16)24/h4-9,11,23-24H,10H2,1-3H3,(H2,21,22,25)	SXOMZDGDHFLVAA-UHFFFAOYSA-N	CC(C)c1ccc(NC(=NN=Cc2c(CO)cnc(C)c2O)S)cc1	BroadT	BRD-K16845730	BRD-K16845730-001-05-1	Enamine Ltd.	T0509-1848			CC(C)c1ccc(NC(S)=NN=Cc2c(CO)cnc(C)c2O)cc1	InChI=1S/C18H22N4O2S/c1-11(2)13-4-6-15(7-5-13)21-18(25)22-20-9-16-14(10-23)8-19-12(3)17(16)24/h4-9,11,23-24H,10H2,1-3H3,(H2,21,22,25)	SXOMZDGDHFLVAA-UHFFFAOYSA-N	358.146346674							
AC1MJXSH	LSM-16988	SID7970806, BRD-K40256085	3144844	InChI=1S/C17H21N5O2/c1-3-10-18-16-19-14-13(15(23)20-17(24)21(14)2)22(16)11-9-12-7-5-4-6-8-12/h4-8H,3,9-11H2,1-2H3,(H,18,19)(H,20,23,24)	VIWQZLATRNHBGF-UHFFFAOYSA-N	CCCNc1nc2N(C)C(=O)NC(=O)c2n1CCc3ccccc3	BroadT	BRD-K40256085	BRD-K40256085-001-04-5	Life Chemicals Inc.	F0887-0006			CCCNc1nc2n(C)c(=O)[nH]c(=O)c2n1CCc1ccccc1	InChI=1S/C17H21N5O2/c1-3-10-18-16-19-14-13(15(23)20-17(24)21(14)2)22(16)11-9-12-7-5-4-6-8-12/h4-8H,3,9-11H2,1-2H3,(H,18,19)(H,20,23,24)	VIWQZLATRNHBGF-UHFFFAOYSA-N	327.169524962							105625
SMR000000619	LSM-16989	SID842868, BRD-K34029905	645145	InChI=1S/C14H10FN7/c15-11-4-2-1-3-10(11)7-22-14-12(19-20-22)13(17-8-18-14)21-6-5-16-9-21/h1-6,8-9H,7H2	NKJLOSQOHWZOFY-UHFFFAOYSA-N	Fc1ccccc1Cn2nnc3c(ncnc23)n4ccnc4	BroadT	BRD-K34029905	BRD-K34029905-001-05-9	Asinex Ltd.	ASN 09122461			Fc1ccccc1Cn1nnc2c(ncnc12)-n1ccnc1	InChI=1S/C14H10FN7/c15-11-4-2-1-3-10(11)7-22-14-12(19-20-22)13(17-8-18-14)21-6-5-16-9-21/h1-6,8-9H,7H2	NKJLOSQOHWZOFY-UHFFFAOYSA-N	295.09817159							105626
AC1MR17W	LSM-16990	SID26663908, BRD-K13235366	3510793	InChI=1S/C24H24N4O2S/c1-15-5-4-6-16(13-15)28-14-25-20-19-17-7-2-3-8-18(17)22(27-9-11-30-12-10-27)26-23(19)31-21(20)24(28)29/h4-6,13-14H,2-3,7-12H2,1H3	CKZBWBMCWZUAQA-UHFFFAOYSA-N	Cc1cccc(c1)N2C=Nc3c(sc4nc(N5CCOCC5)c6CCCCc6c34)C2=O	BroadT	BRD-K13235366	BRD-K13235366-001-06-7	InterBioScreen Ltd.	STOCK3S-54381			Cc1cccc(c1)-n1cnc2c(sc3nc(N4CCOCC4)c4CCCCc4c23)c1=O	InChI=1S/C24H24N4O2S/c1-15-5-4-6-16(13-15)28-14-25-20-19-17-7-2-3-8-18(17)22(27-9-11-30-12-10-27)26-23(19)31-21(20)24(28)29/h4-6,13-14H,2-3,7-12H2,1H3	CKZBWBMCWZUAQA-UHFFFAOYSA-N	432.161996738							105627
MLS000051275	LSM-16991	SID4254975, BRD-K24403633	2221829	InChI=1S/C21H20N2O4/c1-14-6-3-7-15(2)20(14)27-13-19(24)22-16-8-4-9-17(12-16)23-21(25)18-10-5-11-26-18/h3-12H,13H2,1-2H3,(H,22,24)(H,23,25)	QPAGYKLDKJQHMJ-UHFFFAOYSA-N	Cc1cccc(C)c1OCC(=O)Nc2cccc(NC(=O)c3occc3)c2	BroadT	BRD-K24403633	BRD-K24403633-001-06-5	ChemBridge Corporation	7926449			Cc1cccc(C)c1OCC(=O)Nc1cccc(NC(=O)c2ccco2)c1	InChI=1S/C21H20N2O4/c1-14-6-3-7-15(2)20(14)27-13-19(24)22-16-8-4-9-17(12-16)23-21(25)18-10-5-11-26-18/h3-12H,13H2,1-2H3,(H,22,24)(H,23,25)	QPAGYKLDKJQHMJ-UHFFFAOYSA-N	364.14230714							105628
N-[3-(4-Oxo-4H-3,1-benzoxazin-2-yl)phenyl]benzamide	LSM-16992	SID24807035, BRD-K31380736	695640	InChI=1S/C21H14N2O3/c24-19(14-7-2-1-3-8-14)22-16-10-6-9-15(13-16)20-23-18-12-5-4-11-17(18)21(25)26-20/h1-13H,(H,22,24)	SELRREFXULUALP-UHFFFAOYSA-N	O=C(Nc1cccc(c1)C2=Nc3ccccc3C(=O)O2)c4ccccc4	BroadT	BRD-K31380736	BRD-K31380736-001-05-4	ChemBridge Corporation	6556049			O=C(Nc1cccc(c1)-c1nc2ccccc2c(=O)o1)c1ccccc1	InChI=1S/C21H14N2O3/c24-19(14-7-2-1-3-8-14)22-16-10-6-9-15(13-16)20-23-18-12-5-4-11-17(18)21(25)26-20/h1-13H,(H,22,24)	SELRREFXULUALP-UHFFFAOYSA-N	342.100442328							105629
SMR000054993	LSM-43686	SID7976002, BRD-A76457511	2769925	InChI=1S/C17H14N2O6S2/c1-18-9-5-3-2-4-8(9)12(14(18)22)13-15(23)19(17(26)27-13)10(16(24)25)6-7-11(20)21/h2-5,10H,6-7H2,1H3,(H,20,21)(H,24,25)/b13-12-	DNTNVUFHTFVOQF-SEYXRHQNSA-N	CN1C(=O)\C(=C\2/SC(=S)N(C(CCC(=O)O)C(=O)O)C2=O)\c3ccccc13	BroadT	BRD-A76457511	BRD-A76457511-001-06-7	ChemBridge Corporation	5140276			CN1C(=O)\C(c2ccccc12)=C1/SC(=S)N(C(CCC(O)=O)C(O)=O)C1=O	InChI=1S/C17H14N2O6S2/c1-18-9-5-3-2-4-8(9)12(14(18)22)13-15(23)19(17(26)27-13)10(16(24)25)6-7-11(20)21/h2-5,10H,6-7H2,1H3,(H,20,21)(H,24,25)/b13-12-	DNTNVUFHTFVOQF-SEYXRHQNSA-N	406.029327568							
MLS000715043	LSM-43688	SID24781660, BRD-K19829092	5768667	InChI=1S/C18H16N2O5S/c1-24-13-7-10(8-14(25-2)16(13)22)9-15-17(23)20-18(26-15)19-11-3-5-12(21)6-4-11/h3-9,21-22H,1-2H3,(H,19,20,23)/b15-9+	PCLFSFQEDFZNSB-OQLLNIDSSA-N	COc1cc(\C=C/2\SC(=NC2=O)Nc3ccc(O)cc3)cc(OC)c1O	BroadT	BRD-K19829092	BRD-K19829092-001-05-4	Asinex Ltd.	BAS 04800069			COc1cc(cc(OC)c1O)\C=C1\SC(Nc2ccc(O)cc2)=NC1=O	InChI=1S/C18H16N2O5S/c1-24-13-7-10(8-14(25-2)16(13)22)9-15-17(23)20-18(26-15)19-11-3-5-12(21)6-4-11/h3-9,21-22H,1-2H3,(H,19,20,23)/b15-9+	PCLFSFQEDFZNSB-OQLLNIDSSA-N	372.077992322							
MLS000034756	LSM-16995	SID846796, BRD-K37936726	649189	InChI=1S/C9H9N3O2S2/c1-14-5-7(13)10-9-12-11-8(16-9)6-3-2-4-15-6/h2-4H,5H2,1H3,(H,10,12,13)	BGOHMAJTGWYSNO-UHFFFAOYSA-N	COCC(=O)Nc1nnc(s1)c2cccs2	BroadT	BRD-K37936726	BRD-K37936726-001-05-9	Asinex Ltd.	ASN 05668368			COCC(=O)Nc1nnc(s1)-c1cccs1	InChI=1S/C9H9N3O2S2/c1-14-5-7(13)10-9-12-11-8(16-9)6-3-2-4-15-6/h2-4H,5H2,1H3,(H,10,12,13)	BGOHMAJTGWYSNO-UHFFFAOYSA-N	255.013617938							105632
T0511-3166	LSM-16996	SID24829535, BRD-K81339550	2341607	InChI=1S/C13H12ClN3O3/c1-8-13(17(19)20)9(2)16(15-8)7-12(18)10-5-3-4-6-11(10)14/h3-6H,7H2,1-2H3	UITVJAJUEDURGU-UHFFFAOYSA-N	Cc1nn(CC(=O)c2ccccc2Cl)c(C)c1[N+](=O)[O-]	BroadT	BRD-K81339550	BRD-K81339550-001-06-0	Enamine Ltd.	T0511-3166			Cc1nn(CC(=O)c2ccccc2Cl)c(C)c1[N+]([O-])=O	InChI=1S/C13H12ClN3O3/c1-8-13(17(19)20)9(2)16(15-8)7-12(18)10-5-3-4-6-11(10)14/h3-6H,7H2,1-2H3	UITVJAJUEDURGU-UHFFFAOYSA-N	293.056718984							105633
SMR000063354	LSM-16997	SID3717628, BRD-K37228558	2098159	InChI=1S/C15H13N3O2S2/c1-18-8-4-6-11(18)14(20)17-13(19)9-21-15-16-10-5-2-3-7-12(10)22-15/h2-8H,9H2,1H3,(H,17,19,20)	WBNDJQAEQQGCPK-UHFFFAOYSA-N	Cn1cccc1C(=O)NC(=O)CSc2nc3ccccc3s2	BroadT	BRD-K37228558	BRD-K37228558-001-05-4	Enamine Ltd.	T5230968			Cn1cccc1C(=O)NC(=O)CSc1nc2ccccc2s1	InChI=1S/C15H13N3O2S2/c1-18-8-4-6-11(18)14(20)17-13(19)9-21-15-16-10-5-2-3-7-12(10)22-15/h2-8H,9H2,1H3,(H,17,19,20)	WBNDJQAEQQGCPK-UHFFFAOYSA-N	331.044918066							105634
MLS000100804	LSM-16998	SID7969545, BRD-K96390140	866476	InChI=1S/C18H14FN5/c1-12-3-2-4-15(9-12)24-18-16(10-22-24)17(20-11-21-18)23-14-7-5-13(19)6-8-14/h2-11H,1H3,(H,20,21,23)	CTQVDIVACCDMGM-UHFFFAOYSA-N	Cc1cccc(c1)n2ncc3c(Nc4ccc(F)cc4)ncnc23	BroadT	BRD-K96390140	BRD-K96390140-001-04-8	Life Chemicals Inc.	F0517-0179			Cc1cccc(c1)-n1ncc2c(Nc3ccc(F)cc3)ncnc12	InChI=1S/C18H14FN5/c1-12-3-2-4-15(9-12)24-18-16(10-22-24)17(20-11-21-18)23-14-7-5-13(19)6-8-14/h2-11H,1H3,(H,20,21,23)	CTQVDIVACCDMGM-UHFFFAOYSA-N	319.123323698							105635
SMR000093888	LSM-16999	SID7968348, BRD-A35158877	5309350	InChI=1S/C25H31N3O6/c1-5-34-25(30)27-12-10-17(11-13-27)28-23(18-8-6-7-9-19(18)24(28)29)26-16-14-20(31-2)22(33-4)21(15-16)32-3/h6-9,14-15,17,23,26H,5,10-13H2,1-4H3	JNASXWCREWOTJQ-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)N2C(Nc3cc(OC)c(OC)c(OC)c3)c4ccccc4C2=O	BroadT	BRD-A35158877	BRD-A35158877-001-05-1	ChemDiv Inc.	C429-0352			CCOC(=O)N1CCC(CC1)N1C(Nc2cc(OC)c(OC)c(OC)c2)c2ccccc2C1=O	InChI=1S/C25H31N3O6/c1-5-34-25(30)27-12-10-17(11-13-27)28-23(18-8-6-7-9-19(18)24(28)29)26-16-14-20(31-2)22(33-4)21(15-16)32-3/h6-9,14-15,17,23,26H,5,10-13H2,1-4H3	JNASXWCREWOTJQ-UHFFFAOYSA-N	469.221285742							105636
ST50864543	LSM-17000	SID24794660, BRD-K67856310	4460240	InChI=1S/C14H12ClFN2O2/c1-20-13-7-6-9(8-10(13)15)17-14(19)18-12-5-3-2-4-11(12)16/h2-8H,1H3,(H2,17,18,19)	QLDODAWMXFTDBL-UHFFFAOYSA-N	COc1ccc(NC(=O)Nc2ccccc2F)cc1Cl	BroadT	BRD-K67856310	BRD-K67856310-001-06-2	ChemBridge Corporation	9043170			COc1ccc(NC(=O)Nc2ccccc2F)cc1Cl	InChI=1S/C14H12ClFN2O2/c1-20-13-7-6-9(8-10(13)15)17-14(19)18-12-5-3-2-4-11(12)16/h2-8H,1H3,(H2,17,18,19)	QLDODAWMXFTDBL-UHFFFAOYSA-N	294.057133554							105637
SMR000021483	LSM-17001	SID4250408, BRD-K50920395	3244226	InChI=1S/C17H22N4O3/c1-4-24-17(23)13-5-7-20(8-6-13)16(22)14-10-18-21-12(3)9-11(2)19-15(14)21/h9-10,13H,4-8H2,1-3H3	QBSPUVMXBWTPCN-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC1)C(=O)c2cnn3c(C)cc(C)nc23	BroadT	BRD-K50920395	BRD-K50920395-001-05-5	ChemDiv Inc.	A0013004			CCOC(=O)C1CCN(CC1)C(=O)c1cnn2c(C)cc(C)nc12	InChI=1S/C17H22N4O3/c1-4-24-17(23)13-5-7-20(8-6-13)16(22)14-10-18-21-12(3)9-11(2)19-15(14)21/h9-10,13H,4-8H2,1-3H3	QBSPUVMXBWTPCN-UHFFFAOYSA-N	330.169190604							105638
SMR000200287	LSM-17002	SID17416322, SID87338597, BRD-K62615721	2215226	InChI=1S/C22H27BrN2O4/c1-6-9-29-21-17(23)10-15(11-20(21)28-5)13-24-16-7-8-18(19(12-16)27-4)25-22(26)14(2)3/h6-8,10-12,14,24H,1,9,13H2,2-5H3,(H,25,26)	YIDPKGRSWRIPAA-UHFFFAOYSA-N	COc1cc(NCc2cc(Br)c(OCC=C)c(OC)c2)ccc1NC(=O)C(C)C	BroadT	BRD-K62615721	BRD-K62615721-001-06-0	ChemBridge Corporation	7871007			COc1cc(NCc2cc(Br)c(OCC=C)c(OC)c2)ccc1NC(=O)C(C)C	InChI=1S/C22H27BrN2O4/c1-6-9-29-21-17(23)10-15(11-20(21)28-5)13-24-16-7-8-18(19(12-16)27-4)25-22(26)14(2)3/h6-8,10-12,14,24H,1,9,13H2,2-5H3,(H,25,26)	YIDPKGRSWRIPAA-UHFFFAOYSA-N	462.115419964							105639
T5512642	LSM-17003	SID3717554, BRD-K25016418	2117031	InChI=1S/C17H17N3O4/c1-10-13(11(2)24-20-10)9-23-16(21)8-7-15-18-14-6-4-3-5-12(14)17(22)19-15/h3-6H,7-9H2,1-2H3,(H,18,19,22)	IDGYRSFKQKXVHU-UHFFFAOYSA-N	Cc1onc(C)c1COC(=O)CCc2nc(O)c3ccccc3n2	BroadT	BRD-K25016418	BRD-K25016418-001-05-7	Enamine Ltd.	T5266584			Cc1noc(C)c1COC(=O)CCc1nc(O)c2ccccc2n1	InChI=1S/C17H17N3O4/c1-10-13(11(2)24-20-10)9-23-16(21)8-7-15-18-14-6-4-3-5-12(14)17(22)19-15/h3-6H,7-9H2,1-2H3,(H,18,19,22)	IDGYRSFKQKXVHU-UHFFFAOYSA-N	327.121906054							105640
F0777-1375	LSM-43689	SID24794748, BRD-K43604417	1992025	InChI=1S/C18H17NO5S/c1-3-24-18(23)16-15(12-7-5-4-6-8-12)11(2)25-17(16)19-13(20)9-10-14(21)22/h4-10H,3H2,1-2H3,(H,19,20)(H,21,22)/b10-9-	YZTLNHLIDQNAAU-KTKRTIGZSA-N	CCOC(=O)c1c(NC(=O)\C=C/C(=O)O)sc(C)c1c2ccccc2	BroadT	BRD-K43604417	BRD-K43604417-001-05-9	ChemBridge Corporation	6394046			CCOC(=O)c1c(NC(=O)\C=C/C(O)=O)sc(C)c1-c1ccccc1	InChI=1S/C18H17NO5S/c1-3-24-18(23)16-15(12-7-5-4-6-8-12)11(2)25-17(16)19-13(20)9-10-14(21)22/h4-10H,3H2,1-2H3,(H,19,20)(H,21,22)/b10-9-	YZTLNHLIDQNAAU-KTKRTIGZSA-N	359.082743344							
4-Methyl-2-(2-phenoxy-acetylamino)-thiazole-5-carboxylic acid phenylamide	LSM-17005	SID17407722, BRD-K20679253	1468097	InChI=1S/C19H17N3O3S/c1-13-17(18(24)21-14-8-4-2-5-9-14)26-19(20-13)22-16(23)12-25-15-10-6-3-7-11-15/h2-11H,12H2,1H3,(H,21,24)(H,20,22,23)	WEQYSAYUKCUIJQ-UHFFFAOYSA-N	Cc1nc(NC(=O)COc2ccccc2)sc1C(=O)Nc3ccccc3	BroadT	BRD-K20679253	BRD-K20679253-001-05-5	Asinex Ltd.	ASN 05021012			Cc1nc(NC(=O)COc2ccccc2)sc1C(=O)Nc1ccccc1	InChI=1S/C19H17N3O3S/c1-13-17(18(24)21-14-8-4-2-5-9-14)26-19(20-13)22-16(23)12-25-15-10-6-3-7-11-15/h2-11H,12H2,1H3,(H,21,24)(H,20,22,23)	WEQYSAYUKCUIJQ-UHFFFAOYSA-N	367.099062124							105642
Ethyl 5-methoxy-3-methyl-1H-indole-2-carboxylate	LSM-17006	SID860042, BRD-K91558541	604590	InChI=1S/C13H15NO3/c1-4-17-13(15)12-8(2)10-7-9(16-3)5-6-11(10)14-12/h5-7,14H,4H2,1-3H3	MZBGNUFRAXDPAT-UHFFFAOYSA-N	CCOC(=O)c1[nH]c2ccc(OC)cc2c1C	BroadT	BRD-K91558541	BRD-K91558541-001-05-7	InterBioScreen Ltd.	STOCK3S-45414			CCOC(=O)c1[nH]c2ccc(OC)cc2c1C	InChI=1S/C13H15NO3/c1-4-17-13(15)12-8(2)10-7-9(16-3)5-6-11(10)14-12/h5-7,14H,4H2,1-3H3	MZBGNUFRAXDPAT-UHFFFAOYSA-N	233.10519335							105643
MLS000536739	LSM-17007	BRD-K05950645	828338	InChI=1S/C16H13ClN2OS/c1-11-15(21-14-9-7-12(17)8-10-14)16(20)19(18-11)13-5-3-2-4-6-13/h2-10,20H,1H3	HCUBXMFYIKLIRK-UHFFFAOYSA-N	Cc1nn(c(O)c1Sc2ccc(Cl)cc2)c3ccccc3	BroadT	BRD-K05950645	BRD-K05950645-001-07-2	Enamine Ltd.	T0500-8534			Cc1nn(c(O)c1Sc1ccc(Cl)cc1)-c1ccccc1	InChI=1S/C16H13ClN2OS/c1-11-15(21-14-9-7-12(17)8-10-14)16(20)19(18-11)13-5-3-2-4-6-13/h2-10,20H,1H3	HCUBXMFYIKLIRK-UHFFFAOYSA-N	316.043711456							
N-[5-(Ethoxymethyl)-1,3,4-thiadiazol-2-yl]-2-(phenylsulfanyl)acetamide	LSM-17008	SID4256898, BRD-K50483589	1825732	InChI=1S/C13H15N3O2S2/c1-2-18-8-12-15-16-13(20-12)14-11(17)9-19-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,14,16,17)	CEAQUIJPGSBKQW-UHFFFAOYSA-N	CCOCc1nnc(NC(=O)CSc2ccccc2)s1	BroadT	BRD-K50483589	BRD-K50483589-001-05-0	ChemBridge Corporation	7751742			CCOCc1nnc(NC(=O)CSc2ccccc2)s1	InChI=1S/C13H15N3O2S2/c1-2-18-8-12-15-16-13(20-12)14-11(17)9-19-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,14,16,17)	CEAQUIJPGSBKQW-UHFFFAOYSA-N	309.06056813							105645
MLS000888970	LSM-17009	SID26728031, BRD-K95356204	16745919	InChI=1S/C21H19N3O2S/c1-3-10-22-19(25)15-8-9-16-17(11-15)23-21-24(20(16)26)18(12-27-21)14-6-4-13(2)5-7-14/h4-9,11-12H,3,10H2,1-2H3,(H,22,25)	MJZXHNHXKGHOTR-UHFFFAOYSA-N	CCCNC(=O)c1ccc2C(=O)N3C(=Nc2c1)SC=C3c4ccc(C)cc4	BroadT	BRD-K95356204	BRD-K95356204-001-05-0	University of Notre Dame	5-Oxo-3-p-tolyl-5H-thiazolo[2,3-b]quinazoline-8-carboxylic acid propylamide IB162			CCCNC(=O)c1ccc2c(c1)nc1scc(-c3ccc(C)cc3)n1c2=O	InChI=1S/C21H19N3O2S/c1-3-10-22-19(25)15-8-9-16-17(11-15)23-21-24(20(16)26)18(12-27-21)14-6-4-13(2)5-7-14/h4-9,11-12H,3,10H2,1-2H3,(H,22,25)	MJZXHNHXKGHOTR-UHFFFAOYSA-N	377.119797568							105646
MLS000705675	LSM-43690	SID22414480, BRD-K56224268	11839301	InChI=1S/C25H26N2O6/c1-4-7-19-12-17(13-20-23(28)27(5-2)25(31)26-20)14-21(32-6-3)22(19)33-15-16-8-10-18(11-9-16)24(29)30/h4,8-14H,1,5-7,15H2,2-3H3,(H,26,31)(H,29,30)/b20-13+	VXCVAVSWQGYCGY-DEDYPNTBSA-N	CCOc1cc(\C=C/2\NC(=O)N(CC)C2=O)cc(CC=C)c1OCc3ccc(cc3)C(=O)O	BroadT	BRD-K56224268	BRD-K56224268-001-06-8	Specs	AN-648/42098995			CCOc1cc(\C=C2\NC(=O)N(CC)C2=O)cc(CC=C)c1OCc1ccc(cc1)C(O)=O	InChI=1S/C25H26N2O6/c1-4-7-19-12-17(13-20-23(28)27(5-2)25(31)26-20)14-21(32-6-3)22(19)33-15-16-8-10-18(11-9-16)24(29)30/h4,8-14H,1,5-7,15H2,2-3H3,(H,26,31)(H,29,30)/b20-13+	VXCVAVSWQGYCGY-DEDYPNTBSA-N	450.179086572							
ST042991	LSM-17011	SID7975510, BRD-K82535917	669360	InChI=1S/C19H22N2O/c1-15-8-9-17(14-16(15)2)19(22)21-12-10-20(11-13-21)18-6-4-3-5-7-18/h3-9,14H,10-13H2,1-2H3	FBQUKFJGZCFFHQ-UHFFFAOYSA-N	Cc1ccc(cc1C)C(=O)N2CCN(CC2)c3ccccc3	BroadT	BRD-K82535917	BRD-K82535917-001-05-2	ChemBridge Corporation	5653066			Cc1ccc(cc1C)C(=O)N1CCN(CC1)c1ccccc1	InChI=1S/C19H22N2O/c1-15-8-9-17(14-16(15)2)19(22)21-12-10-20(11-13-21)18-6-4-3-5-7-18/h3-9,14H,10-13H2,1-2H3	FBQUKFJGZCFFHQ-UHFFFAOYSA-N	294.173213344							105648
3335-44-2	LSM-17012	SID17411300, BRD-K96330759	2726227	InChI=1S/C13H7F3N2O/c14-13(15,16)10-6-11(8-4-2-1-3-5-8)18-12(19)9(10)7-17/h1-6H,(H,18,19)	OOVASHBTYQTRFA-UHFFFAOYSA-N	Oc1nc(cc(c1C#N)C(F)(F)F)c2ccccc2	BroadT	BRD-K96330759	BRD-K96330759-001-05-3	Key Organics Ltd.	1K-340S			Oc1nc(cc(c1C#N)C(F)(F)F)-c1ccccc1	InChI=1S/C13H7F3N2O/c14-13(15,16)10-6-11(8-4-2-1-3-5-8)18-12(19)9(10)7-17/h1-6H,(H,18,19)	OOVASHBTYQTRFA-UHFFFAOYSA-N	264.051047464							105649
SMR000093328	LSM-17013	SID7968987, BRD-A57063207	5309708	InChI=1S/C20H23N3O2S/c1-20(2,3)12-6-7-13-14(10-21)19(26-17(13)8-12)22-18(24)15-9-16(25-23-15)11-4-5-11/h9,11-12H,4-8H2,1-3H3,(H,22,24)	QHKHYYOCRLMJAA-UHFFFAOYSA-N	CC(C)(C)C1CCc2c(C1)sc(NC(=O)c3cc(on3)C4CC4)c2C#N	BroadT	BRD-A57063207	BRD-A57063207-001-06-5	ChemDiv Inc.	C226-2721			CC(C)(C)C1CCc2c(C1)sc(NC(=O)c1cc(on1)C1CC1)c2C#N	InChI=1S/C20H23N3O2S/c1-20(2,3)12-6-7-13-14(10-21)19(26-17(13)8-12)22-18(24)15-9-16(25-23-15)11-4-5-11/h9,11-12H,4-8H2,1-3H3,(H,22,24)	QHKHYYOCRLMJAA-UHFFFAOYSA-N	369.151097696							105650
ST50639154	LSM-17014	SID4251604, BRD-A71239871	3245267	InChI=1S/C20H23NO5/c1-5-26-16-7-6-12(10-17(16)24-3)13-8-14-18(15(22)9-13)11(2)19(21-14)20(23)25-4/h6-7,10,13,21H,5,8-9H2,1-4H3	PWUIQMAYTUMYNT-UHFFFAOYSA-N	CCOc1ccc(cc1OC)C2CC(=O)c3c(C)c([nH]c3C2)C(=O)OC	BroadT	BRD-A71239871	BRD-A71239871-001-05-0	ChemDiv Inc.	C276-0126			CCOc1ccc(cc1OC)C1Cc2[nH]c(C(=O)OC)c(C)c2C(=O)C1	InChI=1S/C20H23NO5/c1-5-26-16-7-6-12(10-17(16)24-3)13-8-14-18(15(22)9-13)11(2)19(21-14)20(23)25-4/h6-7,10,13,21H,5,8-9H2,1-4H3	PWUIQMAYTUMYNT-UHFFFAOYSA-N	357.157622846							105651
AC1OA5PX	LSM-17015	SID24801715, BRD-K19768759	6799397	InChI=1S/C15H13F3N2O3/c1-2-23-12-7-9(4-6-11(12)21)3-5-10-8-13(15(16,17)18)20-14(22)19-10/h3-8,21H,2H2,1H3,(H,19,20,22)/b5-3+	KQTMKNGWTNLRBO-HWKANZROSA-N	CCOc1cc(\C=C\c2cc(nc(O)n2)C(F)(F)F)ccc1O	BroadT	BRD-K19768759	BRD-K19768759-001-05-8	Asinex Ltd.	BAS 00830870			CCOc1cc(ccc1O)\C=C\c1cc(nc(O)n1)C(F)(F)F	InChI=1S/C15H13F3N2O3/c1-2-23-12-7-9(4-6-11(12)21)3-5-10-8-13(15(16,17)18)20-14(22)19-10/h3-8,21H,2H2,1H3,(H,19,20,22)/b5-3+	KQTMKNGWTNLRBO-HWKANZROSA-N	326.087826896							
SMR000147487	LSM-17016	SID14741456, BRD-K54419754	1941298	InChI=1S/C21H17N5O2S2/c1-28-16-6-3-2-5-13(16)11-25-18(27)12-30-21-15(10-23)19(17-7-4-8-29-17)14(9-22)20(24)26-21/h2-8H,11-12H2,1H3,(H2,24,26)(H,25,27)	KKLGJQYLQBJYML-UHFFFAOYSA-N	COc1ccccc1CNC(=O)CSc2nc(N)c(C#N)c(c3cccs3)c2C#N	BroadT	BRD-K54419754	BRD-K54419754-001-06-7	InterBioScreen Ltd.	STOCK2S-88433			COc1ccccc1CNC(=O)CSc1nc(N)c(C#N)c(-c2cccs2)c1C#N	InChI=1S/C21H17N5O2S2/c1-28-16-6-3-2-5-13(16)11-25-18(27)12-30-21-15(10-23)19(17-7-4-8-29-17)14(9-22)20(24)26-21/h2-8H,11-12H2,1H3,(H2,24,26)(H,25,27)	KKLGJQYLQBJYML-UHFFFAOYSA-N	435.082366214							105653
BAS 00521470	LSM-17017	SID7976535, BRD-K28462004	804693	InChI=1S/C16H16N2O2S/c1-11-4-5-14-6-7-16(10-15(14)8-11)21(19,20)18-13(3)9-12(2)17-18/h4-10H,1-3H3	ITZUIVKJVHJKKG-UHFFFAOYSA-N	Cc1ccc2ccc(cc2c1)S(=O)(=O)n3nc(C)cc3C	BroadT	BRD-K28462004	BRD-K28462004-001-05-0	ChemBridge Corporation	5613276			Cc1cc(C)n(n1)S(=O)(=O)c1ccc2ccc(C)cc2c1	InChI=1S/C16H16N2O2S/c1-11-4-5-14-6-7-16(10-15(14)8-11)21(19,20)18-13(3)9-12(2)17-18/h4-10H,1-3H3	ITZUIVKJVHJKKG-UHFFFAOYSA-N	300.093248462							105654
MLS001146599	LSM-17018	SID49822001, BRD-A84517860	3794169	InChI=1S/C18H18FN3OS/c19-15-8-6-13(7-9-15)17(23)21-18(24)22-11-2-1-5-16(22)14-4-3-10-20-12-14/h3-4,6-10,12,16H,1-2,5,11H2,(H,21,23,24)	OPBIMMOKSSEPPP-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)NC(=S)N2CCCCC2c3cccnc3	BroadT	BRD-A84517860	BRD-A84517860-001-06-5	InterBioScreen Ltd.	STOCK3S-74333			Fc1ccc(cc1)C(=O)NC(=S)N1CCCCC1c1cccnc1	InChI=1S/C18H18FN3OS/c19-15-8-6-13(7-9-15)17(23)21-18(24)22-11-2-1-5-16(22)14-4-3-10-20-12-14/h3-4,6-10,12,16H,1-2,5,11H2,(H,21,23,24)	OPBIMMOKSSEPPP-UHFFFAOYSA-N	343.115461116							105655
SMR000048767	LSM-17019	SID866151, BRD-K93036943	667410	InChI=1S/C23H28N4O2S/c1-25-12-14-26(15-13-25)23-24-21-20(18-6-4-3-5-7-19(18)30-21)22(28)27(23)16-8-10-17(29-2)11-9-16/h8-11H,3-7,12-15H2,1-2H3	NTPAWLKPCLLDPC-UHFFFAOYSA-N	COc1ccc(cc1)N2C(=O)c3c4CCCCCc4sc3N=C2N5CCN(C)CC5	BroadT	BRD-K93036943	BRD-K93036943-001-05-6	InterBioScreen Ltd.	STOCK5S-60250			COc1ccc(cc1)-n1c(nc2sc3CCCCCc3c2c1=O)N1CCN(C)CC1	InChI=1S/C23H28N4O2S/c1-25-12-14-26(15-13-25)23-24-21-20(18-6-4-3-5-7-19(18)30-21)22(28)27(23)16-8-10-17(29-2)11-9-16/h8-11H,3-7,12-15H2,1-2H3	NTPAWLKPCLLDPC-UHFFFAOYSA-N	424.193296866							105656
F0700-0135	LSM-17020	SID7969526, BRD-K82203327	5226251	InChI=1S/C15H17N3O4S/c1-15(2)5-8-13(9(19)6-15)23-14(16-8)17-10(20)7-18-11(21)3-4-12(18)22/h3-7H2,1-2H3,(H,16,17,20)	MDZYJSPZSKETNW-UHFFFAOYSA-N	CC1(C)CC(=O)c2sc(NC(=O)CN3C(=O)CCC3=O)nc2C1	BroadT	BRD-K82203327	BRD-K82203327-001-04-4	Life Chemicals Inc.	F0700-0135			CC1(C)Cc2nc(NC(=O)CN3C(=O)CCC3=O)sc2C(=O)C1	InChI=1S/C15H17N3O4S/c1-15(2)5-8-13(9(19)6-15)23-14(16-8)17-10(20)7-18-11(21)3-4-12(18)22/h3-7H2,1-2H3,(H,16,17,20)	MDZYJSPZSKETNW-UHFFFAOYSA-N	335.093976744							105657
4-Chloro-n-(8-methyl-[1,3]dioxolo[4,5-g]quinazolin-6-yl)-benzamide	LSM-17021	SID17505467, BRD-K38456289	1942336	InChI=1S/C17H12ClN3O3/c1-9-12-6-14-15(24-8-23-14)7-13(12)20-17(19-9)21-16(22)10-2-4-11(18)5-3-10/h2-7H,8H2,1H3,(H,19,20,21,22)	SSMDPFIXUPMLQC-UHFFFAOYSA-N	Cc1nc(NC(=O)c2ccc(Cl)cc2)nc3cc4OCOc4cc13	BroadT	BRD-K38456289	BRD-K38456289-001-05-6	InterBioScreen Ltd.	STOCK5S-48521			Cc1nc(NC(=O)c2ccc(Cl)cc2)nc2cc3OCOc3cc12	InChI=1S/C17H12ClN3O3/c1-9-12-6-14-15(24-8-23-14)7-13(12)20-17(19-9)21-16(22)10-2-4-11(18)5-3-10/h2-7H,8H2,1H3,(H,19,20,21,22)	SSMDPFIXUPMLQC-UHFFFAOYSA-N	341.056718984							105658
SMR000130365	LSM-17022	SID14732302, BRD-K88861635	9550247	InChI=1S/C25H26N4O2S/c1-15-7-5-9-20(16(15)2)27-11-13-28(14-12-27)24(30)19-8-6-10-29-22(19)26-23-21(25(29)31)17(3)18(4)32-23/h5-10H,11-14H2,1-4H3	IZABGOMGYXOPTG-UHFFFAOYSA-N	Cc1cccc(N2CCN(CC2)C(=O)C3=CC=CN4C(=O)c5c(C)c(C)sc5N=C34)c1C	BroadT	BRD-K88861635	BRD-K88861635-001-05-7	ChemDiv Inc.	C200-1308			Cc1sc2nc3c(cccn3c(=O)c2c1C)C(=O)N1CCN(CC1)c1cccc(C)c1C	InChI=1S/C25H26N4O2S/c1-15-7-5-9-20(16(15)2)27-11-13-28(14-12-27)24(30)19-8-6-10-29-22(19)26-23-21(25(29)31)17(3)18(4)32-23/h5-10H,11-14H2,1-4H3	IZABGOMGYXOPTG-UHFFFAOYSA-N	446.177646802							105659
AC1MMAJC	LSM-17023	SID4240633, BRD-K17927475	3235718	InChI=1S/C15H17NO2S/c17-15(16-9-11-5-4-8-18-11)13-10-19-14-7-3-1-2-6-12(13)14/h4-5,8,10H,1-3,6-7,9H2,(H,16,17)	LDLYKRKLWJUWHW-UHFFFAOYSA-N	O=C(NCc1occc1)c2csc3CCCCCc23	BroadT	BRD-K17927475	BRD-K17927475-001-05-5	ChemDiv Inc.	C760-0927			O=C(NCc1ccco1)c1csc2CCCCCc12	InChI=1S/C15H17NO2S/c17-15(16-9-11-5-4-8-18-11)13-10-19-14-7-3-1-2-6-12(13)14/h4-5,8,10H,1-3,6-7,9H2,(H,16,17)	LDLYKRKLWJUWHW-UHFFFAOYSA-N	275.097999484							105660
MLS000736356	LSM-17024	SID24819798, BRD-A93259806	3723045	InChI=1S/C18H18BrNO3/c19-13-5-3-12(4-6-13)18(20-7-1-2-8-20)14-9-16-17(10-15(14)21)23-11-22-16/h3-6,9-10,18,21H,1-2,7-8,11H2	CNHAVYWPOCSGHE-UHFFFAOYSA-N	Oc1cc2OCOc2cc1C(N3CCCC3)c4ccc(Br)cc4	BroadT	BRD-A93259806	BRD-A93259806-001-03-7	Key Organics Ltd.	4T-0329			Oc1cc2OCOc2cc1C(N1CCCC1)c1ccc(Br)cc1	InChI=1S/C18H18BrNO3/c19-13-5-3-12(4-6-13)18(20-7-1-2-8-20)14-9-16-17(10-15(14)21)23-11-22-16/h3-6,9-10,18,21H,1-2,7-8,11H2	CNHAVYWPOCSGHE-UHFFFAOYSA-N	375.047006046							105661
ZINC03348724	LSM-17025	SID22407592, BRD-K20739802	2465640	InChI=1S/C23H20N2O4/c1-16(26)17-11-13-19(14-12-17)25-22(27)15-29-23(28)20-9-5-6-10-21(20)24-18-7-3-2-4-8-18/h2-14,24H,15H2,1H3,(H,25,27)	AAJIOFUVLXKEJB-UHFFFAOYSA-N	CC(=O)c1ccc(NC(=O)COC(=O)c2ccccc2Nc3ccccc3)cc1	BroadT	BRD-K20739802	BRD-K20739802-001-05-3	Enamine Ltd.	T0518-6895			CC(=O)c1ccc(NC(=O)COC(=O)c2ccccc2Nc2ccccc2)cc1	InChI=1S/C23H20N2O4/c1-16(26)17-11-13-19(14-12-17)25-22(27)15-29-23(28)20-9-5-6-10-21(20)24-18-7-3-2-4-8-18/h2-14,24H,15H2,1H3,(H,25,27)	AAJIOFUVLXKEJB-UHFFFAOYSA-N	388.14230714							105662
AC1N6FDO	LSM-17026	BRD-K48784826	4259095	InChI=1S/C15H15N3O4S2/c1-2-22-14(21)10-7-4-3-5-9(7)24-13(10)16-6-8-11(19)17-15(23)18-12(8)20/h6,8H,2-5H2,1H3,(H2,17,18,19,20,23)	PPSLRDNSYWDYKX-UHFFFAOYSA-N	CCOC(=O)c1c2CCCc2sc1N=CC3C(=O)NC(=S)NC3=O	BroadT	BRD-K48784826	BRD-K48784826-001-06-7	ChemDiv Inc.	4673-0384			CCOC(=O)c1c(N=CC2C(=O)NC(=S)NC2=O)sc2CCCc12	InChI=1S/C15H15N3O4S2/c1-2-22-14(21)10-7-4-3-5-9(7)24-13(10)16-6-8-11(19)17-15(23)18-12(8)20/h6,8H,2-5H2,1H3,(H2,17,18,19,20,23)	PPSLRDNSYWDYKX-UHFFFAOYSA-N	365.05039737							105663
ZINC01113695	LSM-17027	SID4260885, BRD-K15058425	1291706	InChI=1S/C18H18N4O4S2/c1-4-26-11-5-7-13-16(9-11)27-17(19-13)20-28(24,25)12-6-8-14-15(10-12)22(3)18(23)21(14)2/h5-10H,4H2,1-3H3,(H,19,20)	QTUHMOVIXHCTLH-UHFFFAOYSA-N	CCOc1ccc2nc(NS(=O)(=O)c3ccc4N(C)C(=O)N(C)c4c3)sc2c1	BroadT	BRD-K15058425	BRD-K15058425-001-05-2	ChemBridge Corporation	7750713			CCOc1ccc2nc(NS(=O)(=O)c3ccc4n(C)c(=O)n(C)c4c3)sc2c1	InChI=1S/C18H18N4O4S2/c1-4-26-11-5-7-13-16(9-11)27-17(19-13)20-28(24,25)12-6-8-14-15(10-12)22(3)18(23)21(14)2/h5-10H,4H2,1-3H3,(H,19,20)	QTUHMOVIXHCTLH-UHFFFAOYSA-N	418.076946476							105664
4-{[(Cyclohexylamino)carbonyl]amino}-n-(5-methyl-3-isoxazolyl)benzenesulfonamide	LSM-17028	SID4262164, BRD-K48093976	1093288	InChI=1S/C17H22N4O4S/c1-12-11-16(20-25-12)21-26(23,24)15-9-7-14(8-10-15)19-17(22)18-13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3,(H,20,21)(H2,18,19,22)	QAEQJUSQLPWAFM-UHFFFAOYSA-N	Cc1onc(NS(=O)(=O)c2ccc(NC(=O)NC3CCCCC3)cc2)c1	BroadT	BRD-K48093976	BRD-K48093976-001-06-1	ChemBridge Corporation	7867650			Cc1cc(NS(=O)(=O)c2ccc(NC(=O)NC3CCCCC3)cc2)no1	InChI=1S/C17H22N4O4S/c1-12-11-16(20-25-12)21-26(23,24)15-9-7-14(8-10-15)19-17(22)18-13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3,(H,20,21)(H2,18,19,22)	QAEQJUSQLPWAFM-UHFFFAOYSA-N	378.136175914							105665
AC1MDFGX	LSM-17029	BRD-K67899737	2835951	InChI=1S/C21H20N4/c1-3-10-19-16(2)23-20(18-13-8-5-9-14-18)24-21(19)25-22-15-17-11-6-4-7-12-17/h3-9,11-15H,1,10H2,2H3,(H,23,24,25)	MEBSBNKWSNUCMP-UHFFFAOYSA-N	Cc1nc(nc(NN=Cc2ccccc2)c1CC=C)c3ccccc3	BroadT	BRD-K67899737	BRD-K67899737-001-05-9	InterBioScreen Ltd.	STOCK2S-09285			Cc1nc(nc(NN=Cc2ccccc2)c1CC=C)-c1ccccc1	InChI=1S/C21H20N4/c1-3-10-19-16(2)23-20(18-13-8-5-9-14-18)24-21(19)25-22-15-17-11-6-4-7-12-17/h3-9,11-15H,1,10H2,2H3,(H,23,24,25)	MEBSBNKWSNUCMP-UHFFFAOYSA-N	328.16879668							105666
MLS000776527	LSM-17030	SID24837020, BRD-K52124446	2423351	InChI=1S/C24H27N3O3/c1-26(16-22-21-5-3-2-4-18(21)6-11-23(22)28)17-24(29)25-19-7-9-20(10-8-19)27-12-14-30-15-13-27/h2-11,28H,12-17H2,1H3,(H,25,29)	DXKUZRNURNZDIK-UHFFFAOYSA-N	CN(CC(=O)Nc1ccc(cc1)N2CCOCC2)Cc3c(O)ccc4ccccc34	BroadT	BRD-K52124446	BRD-K52124446-001-05-1	Enamine Ltd.	T5219625			CN(CC(=O)Nc1ccc(cc1)N1CCOCC1)Cc1c(O)ccc2ccccc12	InChI=1S/C24H27N3O3/c1-26(16-22-21-5-3-2-4-18(21)6-11-23(22)28)17-24(29)25-19-7-9-20(10-8-19)27-12-14-30-15-13-27/h2-11,28H,12-17H2,1H3,(H,25,29)	DXKUZRNURNZDIK-UHFFFAOYSA-N	405.205241754							105667
MLS000580189	LSM-17031	SID17414242, BRD-K38410475	1194512	InChI=1S/C20H22N2O5S/c1-2-27-20(24)17-16(14-9-6-10-15(11-14)22(25)26)12-28-19(17)21-18(23)13-7-4-3-5-8-13/h6,9-13H,2-5,7-8H2,1H3,(H,21,23)	DRUIZNXKHLVTGP-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)C2CCCCC2)scc1c3cccc(c3)[N+](=O)[O-]	BroadT	BRD-K38410475	BRD-K38410475-001-05-7	ChemBridge Corporation	7784595			CCOC(=O)c1c(NC(=O)C2CCCCC2)scc1-c1cccc(c1)[N+]([O-])=O	InChI=1S/C20H22N2O5S/c1-2-27-20(24)17-16(14-9-6-10-15(11-14)22(25)26)12-28-19(17)21-18(23)13-7-4-3-5-8-13/h6,9-13H,2-5,7-8H2,1H3,(H,21,23)	DRUIZNXKHLVTGP-UHFFFAOYSA-N	402.124942514							105668
MLS001239341	LSM-15260	BRD-K95814235	24892560	InChI=1S/C30H34N4O3S2/c1-4-22-10-15-27-28(20-22)38-30(31-27)34(18-7-17-32(2)3)29(35)24-11-13-26(14-12-24)39(36,37)33-19-16-23-8-5-6-9-25(23)21-33/h5-6,8-15,20H,4,7,16-19,21H2,1-3H3	YLRRAAAQNUKZCI-UHFFFAOYSA-N	CCc1ccc2nc(sc2c1)N(CCCN(C)C)C(=O)c3ccc(cc3)S(=O)(=O)N4CCc5ccccc5C4	BroadT	BRD-K95814235	BRD-K95814235-003-08-1	Life Chemicals Inc.	F2019-0829		Cl	CCc1ccc2nc(sc2c1)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1.Cl	InChI=1S/C30H34N4O3S2.ClH/c1-4-22-10-15-27-28(20-22)38-30(31-27)34(18-7-17-32(2)3)29(35)24-11-13-26(14-12-24)39(36,37)33-19-16-23-8-5-6-9-25(23)21-33;/h5-6,8-15,20H,4,7,16-19,21H2,1-3H3;1H	QFDAUVVIFYUWPQ-UHFFFAOYSA-N	562.207232368							103907, 103907
F0324-0011	LSM-17032	SID17515339, BRD-K26720351	4078248	InChI=1S/C23H18N4O/c1-15-11-12-18-17(13-15)22(16-7-3-2-4-8-16)26-23(25-18)27-14-21(28)24-19-9-5-6-10-20(19)27/h2-13H,14H2,1H3,(H,24,28)	OGPYUNMPCVUPCS-UHFFFAOYSA-N	Cc1ccc2nc(nc(c3ccccc3)c2c1)N4CC(=O)Nc5ccccc45	BroadT	BRD-K26720351	BRD-K26720351-001-04-5	Life Chemicals Inc.	F0324-0011			Cc1ccc2nc(nc(-c3ccccc3)c2c1)N1CC(=O)Nc2ccccc12	InChI=1S/C23H18N4O/c1-15-11-12-18-17(13-15)22(16-7-3-2-4-8-16)26-23(25-18)27-14-21(28)24-19-9-5-6-10-20(19)27/h2-13H,14H2,1H3,(H,24,28)	OGPYUNMPCVUPCS-UHFFFAOYSA-N	366.148061236							105669
SMR000162699	LSM-3117	BRD6152, SID17386663, SID87219012, SID87556782, BRD-K50776152	824820	InChI=1S/C20H14N4O/c1-13-7-9-15(10-8-13)24-19(23)16(11-21)18(17(12-22)20(24)25)14-5-3-2-4-6-14/h2-10H,23H2,1H3	DWDWEGGEKMILES-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=C(C#N)C(=C(C#N)C2=O)c3ccccc3)N	BroadT	BRD-K50776152	BRD-K50776152-001-10-4	Specs	AD-193/42475505			Cc1ccc(cc1)-n1c(N)c(C#N)c(-c2ccccc2)c(C#N)c1=O	InChI=1S/C20H14N4O/c1-13-7-9-15(10-8-13)24-19(23)16(11-21)18(17(12-22)20(24)25)14-5-3-2-4-6-14/h2-10H,23H2,1H3	DWDWEGGEKMILES-UHFFFAOYSA-N	326.116761108							92880
SMR000096636	LSM-17033	SID7966472, BRD-K31537290	5308255	InChI=1S/C22H25N5OS/c28-21(26-14-12-25(13-15-26)20-6-2-3-9-23-20)17-7-8-18-19(16-17)29-22(24-18)27-10-4-1-5-11-27/h2-3,6-9,16H,1,4-5,10-15H2	WWXGUANLVAIXOE-UHFFFAOYSA-N	O=C(N1CCN(CC1)c2ccccn2)c3ccc4nc(sc4c3)N5CCCCC5	BroadT	BRD-K31537290	BRD-K31537290-001-04-0	ChemDiv Inc.	C858-0866			O=C(N1CCN(CC1)c1ccccn1)c1ccc2nc(sc2c1)N1CCCCC1	InChI=1S/C22H25N5OS/c28-21(26-14-12-25(13-15-26)20-6-2-3-9-23-20)17-7-8-18-19(16-17)29-22(24-18)27-10-4-1-5-11-27/h2-3,6-9,16H,1,4-5,10-15H2	WWXGUANLVAIXOE-UHFFFAOYSA-N	407.17798116							105670
T0508-0412	LSM-17034	SID17516108, BRD-K59749740	2347046	InChI=1S/C22H17N3O4S2/c1-28-20-5-3-2-4-18(20)25-31(26,27)17-10-11-21-19(12-17)24-22(29-21)30-14-16-8-6-15(13-23)7-9-16/h2-12,25H,14H2,1H3	WHTITULTEDXNBO-UHFFFAOYSA-N	COc1ccccc1NS(=O)(=O)c2ccc3oc(SCc4ccc(cc4)C#N)nc3c2	BroadT	BRD-K59749740	BRD-K59749740-001-05-1	Enamine Ltd.	T0508-0412			COc1ccccc1NS(=O)(=O)c1ccc2oc(SCc3ccc(cc3)C#N)nc2c1	InChI=1S/C22H17N3O4S2/c1-28-20-5-3-2-4-18(20)25-31(26,27)17-10-11-21-19(12-17)24-22(29-21)30-14-16-8-6-15(13-23)7-9-16/h2-12,25H,14H2,1H3	WHTITULTEDXNBO-UHFFFAOYSA-N	451.066047434							105671
MLS000625121	LSM-17035	SID24796175, BRD-K63707385	974903	InChI=1S/C18H27N3OS/c1-13-9-11-21(12-10-13)15-8-6-5-7-14(15)19-17(23)20-16(22)18(2,3)4/h5-8,13H,9-12H2,1-4H3,(H2,19,20,22,23)	QXDHZSDBHOMNNW-UHFFFAOYSA-N	CC1CCN(CC1)c2ccccc2NC(=S)NC(=O)C(C)(C)C	BroadT	BRD-K63707385	BRD-K63707385-001-06-1	ChemBridge Corporation	7778849			CC1CCN(CC1)c1ccccc1NC(=S)NC(=O)C(C)(C)C	InChI=1S/C18H27N3OS/c1-13-9-11-21(12-10-13)15-8-6-5-7-14(15)19-17(23)20-16(22)18(2,3)4/h5-8,13H,9-12H2,1-4H3,(H2,19,20,22,23)	QXDHZSDBHOMNNW-UHFFFAOYSA-N	333.187483204							105672
T0507-9771	LSM-17036	SID22410345, BRD-K08333736	3416008	InChI=1S/C21H25N3O7S/c1-3-30-20-17(5-4-8-22-20)21(26)31-14-19(25)23-18-13-16(7-6-15(18)2)32(27,28)24-9-11-29-12-10-24/h4-8,13H,3,9-12,14H2,1-2H3,(H,23,25)	FKYCMUGZUKDOOM-UHFFFAOYSA-N	CCOc1ncccc1C(=O)OCC(=O)Nc2cc(ccc2C)S(=O)(=O)N3CCOCC3	BroadT	BRD-K08333736	BRD-K08333736-001-05-2	Enamine Ltd.	T0507-9771			CCOc1ncccc1C(=O)OCC(=O)Nc1cc(ccc1C)S(=O)(=O)N1CCOCC1	InChI=1S/C21H25N3O7S/c1-3-30-20-17(5-4-8-22-20)21(26)31-14-19(25)23-18-13-16(7-6-15(18)2)32(27,28)24-9-11-29-12-10-24/h4-8,13H,3,9-12,14H2,1-2H3,(H,23,25)	FKYCMUGZUKDOOM-UHFFFAOYSA-N	463.14132086							105673
AMBCB16234624	LSM-17037	SID24800240, BRD-K77338217	16191909	InChI=1S/C27H30N4O/c1-19-9-6-7-12-21(19)16-30-17-22-15-24(31-14-8-13-27(22,31)26(30)32)23-18-29(2)28-25(23)20-10-4-3-5-11-20/h3-7,9-12,18,22,24H,8,13-17H2,1-2H3/t22-,24-,27-/m0/s1	DTXAXMOJMCSHIW-DPPGTGKWSA-N	Cc1ccccc1CN2C[C@@H]3C[C@H](N4CCC[C@@]34C2=O)c5cn(C)nc5c6ccccc6	BroadT	BRD-K77338217	BRD-K77338217-001-05-5	ChemBridge Corporation	16234624			Cc1ccccc1CN1C[C@@H]2C[C@H](N3CCC[C@@]23C1=O)c1cn(C)nc1-c1ccccc1	InChI=1S/C27H30N4O/c1-19-9-6-7-12-21(19)16-30-17-22-15-24(31-14-8-13-27(22,31)26(30)32)23-18-29(2)28-25(23)20-10-4-3-5-11-20/h3-7,9-12,18,22,24H,8,13-17H2,1-2H3/t22-,24-,27-/m0/s1	DTXAXMOJMCSHIW-DPPGTGKWSA-N	426.24196162							105674
ST50943613	LSM-17038	SID47199200, BRD-K26193089	8181355	InChI=1S/C21H26N2O2/c1-2-25-20-11-7-6-10-19(20)21(24)22-18-12-14-23(15-13-18)16-17-8-4-3-5-9-17/h3-11,18H,2,12-16H2,1H3,(H,22,24)	SGDXBYFWSPTNIN-UHFFFAOYSA-N	CCOc1ccccc1C(=O)NC2CCN(Cc3ccccc3)CC2	BroadT	BRD-K26193089	BRD-K26193089-001-05-1	Specs	AN-652/40803332			CCOc1ccccc1C(=O)NC1CCN(Cc2ccccc2)CC1	InChI=1S/C21H26N2O2/c1-2-25-20-11-7-6-10-19(20)21(24)22-18-12-14-23(15-13-18)16-17-8-4-3-5-9-17/h3-11,18H,2,12-16H2,1H3,(H,22,24)	SGDXBYFWSPTNIN-UHFFFAOYSA-N	338.199428092							105675
MLS000521139	LSM-17039	SID14731930, BRD-K69411451	5092614	InChI=1S/C19H27N3O/c1-14(2)10-11-20-19(23)15-8-9-18-17(12-15)21-13-22(18)16-6-4-3-5-7-16/h8-9,12-14,16H,3-7,10-11H2,1-2H3,(H,20,23)	SLIIHTSTQKYFDX-UHFFFAOYSA-N	CC(C)CCNC(=O)c1ccc2c(c1)ncn2C3CCCCC3	BroadT	BRD-K69411451	BRD-K69411451-001-05-5	ChemDiv Inc.	K786-8863			CC(C)CCNC(=O)c1ccc2n(cnc2c1)C1CCCCC1	InChI=1S/C19H27N3O/c1-14(2)10-11-20-19(23)15-8-9-18-17(12-15)21-13-22(18)16-6-4-3-5-7-16/h8-9,12-14,16H,3-7,10-11H2,1-2H3,(H,20,23)	SLIIHTSTQKYFDX-UHFFFAOYSA-N	313.215412514							105676
MLS000720429	LSM-17040	SID22401580, BRD-K50537271	7110104	InChI=1S/C16H10FN3O2S2/c17-8-1-2-9-13(5-8)23-15(18-9)20-16-19-10-6-11-12(7-14(10)24-16)22-4-3-21-11/h1-2,5-7H,3-4H2,(H,18,19,20)	QSOMZIBTZRYYGF-UHFFFAOYSA-N	Fc1ccc2nc(Nc3nc4cc5OCCOc5cc4s3)sc2c1	BroadT	BRD-K50537271	BRD-K50537271-001-05-6	Life Chemicals Inc.	F0646-8843			Fc1ccc2nc(Nc3nc4cc5OCCOc5cc4s3)sc2c1	InChI=1S/C16H10FN3O2S2/c17-8-1-2-9-13(5-8)23-15(18-9)20-16-19-10-6-11-12(7-14(10)24-16)22-4-3-21-11/h1-2,5-7H,3-4H2,(H,18,19,20)	QSOMZIBTZRYYGF-UHFFFAOYSA-N	359.01984617							105677
ST51014774	LSM-43691	SID17415237, BRD-K96254830	874793	InChI=1S/C22H17NO3/c1-25-21-13-17-16-9-5-6-10-19(16)26-20(17)14-18(21)23-22(24)12-11-15-7-3-2-4-8-15/h2-14H,1H3,(H,23,24)/b12-11+	MQQMPGRYRICIDF-VAWYXSNFSA-N	COc1cc2c(oc3ccccc23)cc1NC(=O)\C=C\c4ccccc4	BroadT	BRD-K96254830	BRD-K96254830-001-05-8	ChemBridge Corporation	6136159			COc1cc2c(cc1NC(=O)\C=C\c1ccccc1)oc1ccccc21	InChI=1S/C22H17NO3/c1-25-21-13-17-16-9-5-6-10-19(16)26-20(17)14-18(21)23-22(24)12-11-15-7-3-2-4-8-15/h2-14H,1H3,(H,23,24)/b12-11+	MQQMPGRYRICIDF-VAWYXSNFSA-N	343.120843414							
T5325483	LSM-43692	SID24791368, BRD-K77548756	6532801	InChI=1S/C17H14N2O3S/c1-18-14-7-6-11(9-15(14)19(21)22)8-12-10-23-16-5-3-2-4-13(16)17(12)20/h2-9,18H,10H2,1H3/b12-8+	VELUJHIDYSOBEH-XYOKQWHBSA-N	CNc1ccc(\C=C\2/CSc3ccccc3C2=O)cc1[N+](=O)[O-]	BroadT	BRD-K77548756	BRD-K77548756-001-05-6	Enamine Ltd.	T5325483			CNc1ccc(\C=C2/CSc3ccccc3C2=O)cc1[N+]([O-])=O	InChI=1S/C17H14N2O3S/c1-18-14-7-6-11(9-15(14)19(21)22)8-12-10-23-16-5-3-2-4-13(16)17(12)20/h2-9,18H,10H2,1H3/b12-8+	VELUJHIDYSOBEH-XYOKQWHBSA-N	326.072513018							
5-Amino-2-diethylamino-n-(2-methoxy-phenyl)-benzenesulfonamide	LSM-17043	SID24836336, BRD-K03775622	3851493	InChI=1S/C17H23N3O3S/c1-4-20(5-2)15-11-10-13(18)12-17(15)24(21,22)19-14-8-6-7-9-16(14)23-3/h6-12,19H,4-5,18H2,1-3H3	VLPUMVGOTYHZSP-UHFFFAOYSA-N	CCN(CC)c1ccc(N)cc1S(=O)(=O)Nc2ccccc2OC	BroadT	BRD-K03775622	BRD-K03775622-001-05-6	Enamine Ltd.	T0502-8863			CCN(CC)c1ccc(N)cc1S(=O)(=O)Nc1ccccc1OC	InChI=1S/C17H23N3O3S/c1-4-20(5-2)15-11-10-13(18)12-17(15)24(21,22)19-14-8-6-7-9-16(14)23-3/h6-12,19H,4-5,18H2,1-3H3	VLPUMVGOTYHZSP-UHFFFAOYSA-N	349.146012316							105680
T5324502	LSM-17044	SID22409295, BRD-K29367859	4881794	InChI=1S/C17H20ClN3O3S/c1-12-7-8-16(15(18)9-12)19-11-17(22)20-13-5-4-6-14(10-13)25(23,24)21(2)3/h4-10,19H,11H2,1-3H3,(H,20,22)	DAFGFNPQASGAQI-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cccc(NC(=O)CNc2ccc(C)cc2Cl)c1	BroadT	BRD-K29367859	BRD-K29367859-001-05-6	Enamine Ltd.	T5324502			CN(C)S(=O)(=O)c1cccc(NC(=O)CNc2ccc(C)cc2Cl)c1	InChI=1S/C17H20ClN3O3S/c1-12-7-8-16(15(18)9-12)19-11-17(22)20-13-5-4-6-14(10-13)25(23,24)21(2)3/h4-10,19H,11H2,1-3H3,(H,20,22)	DAFGFNPQASGAQI-UHFFFAOYSA-N	381.09138993							105681
AC1MFPIH	LSM-15191	BRD-K80949975	2898151	InChI=1S/C14H13N5OS2/c1-8-12(22-14(16-8)17-9(2)20)10-7-21-13(18-10)19-11-5-3-4-6-15-11/h3-7H,1-2H3,(H,15,18,19)(H,16,17,20)	NSRZLORKVVVKSA-UHFFFAOYSA-N	CC(=O)Nc1nc(C)c(s1)c2csc(Nc3ccccn3)n2	BroadT	BRD-K80949975	BRD-K80949975-004-10-0	Asinex Ltd.	BAS 00600433		Br	CC(=O)Nc1nc(C)c(s1)-c1csc(Nc2ccccn2)n1.Br	InChI=1S/C14H13N5OS2.BrH/c1-8-12(22-14(16-8)17-9(2)20)10-7-21-13(18-10)19-11-5-3-4-6-15-11;/h3-7H,1-2H3,(H,15,18,19)(H,16,17,20);1H	MLHAYSJHCPVGKV-UHFFFAOYSA-N	331.056151466							103841, 103841
MLS000056602	LSM-17045	SID3714683, BRD-K95760264	2998911	InChI=1S/C21H17N3O/c1-14-13-18(15(2)25-14)21-22-19(16-9-5-3-6-10-16)20(23-24-21)17-11-7-4-8-12-17/h3-13H,1-2H3	UJALZUWGULLIEZ-UHFFFAOYSA-N	Cc1oc(C)c(c1)c2nnc(c3ccccc3)c(n2)c4ccccc4	BroadT	BRD-K95760264	BRD-K95760264-001-05-0	Enamine Ltd.	T5337409			Cc1cc(c(C)o1)-c1nnc(-c2ccccc2)c(n1)-c1ccccc1	InChI=1S/C21H17N3O/c1-14-13-18(15(2)25-14)21-22-19(16-9-5-3-6-10-16)20(23-24-21)17-11-7-4-8-12-17/h3-13H,1-2H3	UJALZUWGULLIEZ-UHFFFAOYSA-N	327.137162194							105682
STK300531	LSM-17046	SID14730346, BRD-K13269846	2236064	InChI=1S/C26H25ClN4O3/c1-17-23(24(29-33-17)20-14-8-9-15-21(20)27)26(32)31(19-12-6-3-7-13-19)16-22-28-25(30-34-22)18-10-4-2-5-11-18/h2,4-5,8-11,14-15,19H,3,6-7,12-13,16H2,1H3	NCPIYWXWRWXBOZ-UHFFFAOYSA-N	Cc1onc(c2ccccc2Cl)c1C(=O)N(Cc3onc(n3)c4ccccc4)C5CCCCC5	BroadT	BRD-K13269846	BRD-K13269846-001-06-6	ChemBridge Corporation	7976637			Cc1onc(c1C(=O)N(Cc1nc(no1)-c1ccccc1)C1CCCCC1)-c1ccccc1Cl	InChI=1S/C26H25ClN4O3/c1-17-23(24(29-33-17)20-14-8-9-15-21(20)27)26(32)31(19-12-6-3-7-13-19)16-22-28-25(30-34-22)18-10-4-2-5-11-18/h2,4-5,8-11,14-15,19H,3,6-7,12-13,16H2,1H3	NCPIYWXWRWXBOZ-UHFFFAOYSA-N	476.16151841							105683
MLS000331782	LSM-17047	SID17512675, BRD-K90704198	4885941	InChI=1S/C22H21N3O/c1-3-9-18(10-4-1)23-17-22-24-20-13-7-8-14-21(20)25(22)15-16-26-19-11-5-2-6-12-19/h1-14,23H,15-17H2	RRWNGHNOEYOFFB-UHFFFAOYSA-N	C(Cn1c(CNc2ccccc2)nc3ccccc13)Oc4ccccc4	BroadT	BRD-K90704198	BRD-K90704198-001-05-4	InterBioScreen Ltd.	STOCK5S-30825			C(Cn1c(CNc2ccccc2)nc2ccccc12)Oc1ccccc1	InChI=1S/C22H21N3O/c1-3-9-18(10-4-1)23-17-22-24-20-13-7-8-14-21(20)25(22)15-16-26-19-11-5-2-6-12-19/h1-14,23H,15-17H2	RRWNGHNOEYOFFB-UHFFFAOYSA-N	343.168462322							131239
MLS000530041	LSM-17048	SID14739730, BRD-K27320766	4338730	InChI=1S/C20H21N3O5S/c1-11(24)23-6-5-13-14(9-21)20(29-17(13)10-23)22-19(25)12-7-15(26-2)18(28-4)16(8-12)27-3/h7-8H,5-6,10H2,1-4H3,(H,22,25)	LHSSPQHRQWOFNV-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)Nc2sc3CN(CCc3c2C#N)C(=O)C	BroadT	BRD-K27320766	BRD-K27320766-001-05-9	Life Chemicals Inc.	F1298-0851			COc1cc(cc(OC)c1OC)C(=O)Nc1sc2CN(CCc2c1C#N)C(C)=O	InChI=1S/C20H21N3O5S/c1-11(24)23-6-5-13-14(9-21)20(29-17(13)10-23)22-19(25)12-7-15(26-2)18(28-4)16(8-12)27-3/h7-8H,5-6,10H2,1-4H3,(H,22,25)	LHSSPQHRQWOFNV-UHFFFAOYSA-N	415.120191492							105686
SMR000030995	LSM-17049	SID4245877, BRD-K03708099	3240295	InChI=1S/C19H25N3O4S/c1-3-25-15-11-13-14(12-16(15)26-4-2)20-19(27)22(18(13)24)10-6-9-21-8-5-7-17(21)23/h11-12H,3-10H2,1-2H3,(H,20,27)	DMRBOZKOYDEYEY-UHFFFAOYSA-N	CCOc1cc2NC(=S)N(CCCN3CCCC3=O)C(=O)c2cc1OCC	BroadT	BRD-K03708099	BRD-K03708099-001-05-1	ChemDiv Inc.	K284-7306			CCOc1cc2[nH]c(=S)n(CCCN3CCCC3=O)c(=O)c2cc1OCC	InChI=1S/C19H25N3O4S/c1-3-25-15-11-13-14(12-16(15)26-4-2)20-19(27)22(18(13)24)10-6-9-21-8-5-7-17(21)23/h11-12H,3-10H2,1-2H3,(H,20,27)	DMRBOZKOYDEYEY-UHFFFAOYSA-N	391.156577							105687
MLS000062598	LSM-17050	BRD-K58393684	2174924	InChI=1S/C17H25N5O/c1-2-3-12-23-14-8-6-13(7-9-14)19-16-20-15(18)21-17(22-16)10-4-5-11-17/h6-9H,2-5,10-12H2,1H3,(H4,18,19,20,21,22)	MCYRPUWJNNPZAT-UHFFFAOYSA-N	CCCCOc1ccc(NC2=NC(=NC3(CCCC3)N2)N)cc1	BroadT	BRD-K58393684	BRD-K58393684-001-05-7	ChemBridge Corporation	7126688			CCCCOc1ccc(NC2=NC(N)=NC3(CCCC3)N2)cc1	InChI=1S/C17H25N5O/c1-2-3-12-23-14-8-6-13(7-9-14)19-16-20-15(18)21-17(22-16)10-4-5-11-17/h6-9H,2-5,10-12H2,1H3,(H4,18,19,20,21,22)	MCYRPUWJNNPZAT-UHFFFAOYSA-N	315.20591047							105688
AN-329/41574328	LSM-17051	SID22404993, BRD-K78791054	3525382	InChI=1S/C16H14Br2N2O3S/c17-11-4-5-14(13(18)7-11)23-9-15(22)20-16(24)19-12-3-1-2-10(6-12)8-21/h1-7,21H,8-9H2,(H2,19,20,22,24)	RCAXOGAKRIRKAQ-UHFFFAOYSA-N	OCc1cccc(NC(=S)NC(=O)COc2ccc(Br)cc2Br)c1	BroadT	BRD-K78791054	BRD-K78791054-001-05-0	Specs	AN-329/41574328			OCc1cccc(NC(=S)NC(=O)COc2ccc(Br)cc2Br)c1	InChI=1S/C16H14Br2N2O3S/c17-11-4-5-14(13(18)7-11)23-9-15(22)20-16(24)19-12-3-1-2-10(6-12)8-21/h1-7,21H,8-9H2,(H2,19,20,22,24)	RCAXOGAKRIRKAQ-UHFFFAOYSA-N	471.909188218							105689
SMR000144923	LSM-17052	SID14732669, BRD-K46737922	1942357	InChI=1S/C24H19N3O4S/c1-31-23(30)17-12-13-18-19(14-17)25-24(32)27(22(18)29)26-21(28)20(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-14,20H,1H3,(H,25,32)(H,26,28)	ISNPTKGGYIMYOT-UHFFFAOYSA-N	COC(=O)c1ccc2C(=O)N(NC(=O)C(c3ccccc3)c4ccccc4)C(=S)Nc2c1	BroadT	BRD-K46737922	BRD-K46737922-001-05-2	ChemBridge Corporation	7956966			COC(=O)c1ccc2c(c1)[nH]c(=S)n(NC(=O)C(c1ccccc1)c1ccccc1)c2=O	InChI=1S/C24H19N3O4S/c1-31-23(30)17-12-13-18-19(14-17)25-24(32)27(22(18)29)26-21(28)20(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-14,20H,1H3,(H,25,32)(H,26,28)	ISNPTKGGYIMYOT-UHFFFAOYSA-N	445.109626808							105690
MLS000774474	LSM-43693	SID24835325, BRD-K17675685	876610	InChI=1S/C17H14N2O3/c1-12-7-9-15(22-12)17-13(8-10-16(20)21)11-19(18-17)14-5-3-2-4-6-14/h2-11H,1H3,(H,20,21)/b10-8+	AIFVXBUWNSFCAJ-CSKARUKUSA-N	Cc1oc(cc1)c2nn(cc2\C=C\C(=O)O)c3ccccc3	BroadT	BRD-K17675685	BRD-K17675685-001-05-6	Enamine Ltd.	T0505-5746			Cc1ccc(o1)-c1nn(cc1\C=C\C(O)=O)-c1ccccc1	InChI=1S/C17H14N2O3/c1-12-7-9-15(22-12)17-13(8-10-16(20)21)11-19(18-17)14-5-3-2-4-6-14/h2-11H,1H3,(H,20,21)/b10-8+	AIFVXBUWNSFCAJ-CSKARUKUSA-N	294.100442328							
MLS000548420	LSM-17054	SID17508675, BRD-A10330238	3101220	InChI=1S/C21H17ClN2O5S/c22-13-6-8-14(9-7-13)24-19(25)17-16-10-11-21(29-16,18(17)20(24)26)12-23-30(27,28)15-4-2-1-3-5-15/h1-11,16-18,23H,12H2	YGAKRXYRDKCSCD-UHFFFAOYSA-N	Clc1ccc(cc1)N2C(=O)C3C4OC(CNS(=O)(=O)c5ccccc5)(C=C4)C3C2=O	BroadT	BRD-A10330238	BRD-A10330238-001-06-7	Asinex Ltd.	BAS 00341347			Clc1ccc(cc1)N1C(=O)C2C3OC(CNS(=O)(=O)c4ccccc4)(C=C3)C2C1=O	InChI=1S/C21H17ClN2O5S/c22-13-6-8-14(9-7-13)24-19(25)17-16-10-11-21(29-16,18(17)20(24)26)12-23-30(27,28)15-4-2-1-3-5-15/h1-11,16-18,23H,12H2	YGAKRXYRDKCSCD-UHFFFAOYSA-N	444.054670064							105692
MLS000037705	LSM-17055	SID859570, BRD-K87338678	574171	InChI=1S/C13H10N2OS2/c16-11(12-6-3-7-17-12)8-18-13-14-9-4-1-2-5-10(9)15-13/h1-7H,8H2,(H,14,15)	HWDJEXQWGYZWTD-UHFFFAOYSA-N	O=C(CSc1nc2ccccc2[nH]1)c3cccs3	BroadT	BRD-K87338678	BRD-K87338678-001-05-5	InterBioScreen Ltd.	STOCK3S-22165			O=C(CSc1nc2ccccc2[nH]1)c1cccs1	InChI=1S/C13H10N2OS2/c16-11(12-6-3-7-17-12)8-18-13-14-9-4-1-2-5-10(9)15-13/h1-7H,8H2,(H,14,15)	HWDJEXQWGYZWTD-UHFFFAOYSA-N	274.02345434							105693
ZINC3148643	LSM-17056	BRD-K23968250	40456599	InChI=1S/C15H13BrN4O3/c16-12-1-2-13(21)11(7-12)8-19-20-14(22)9-18-15(23)10-3-5-17-6-4-10/h1-8,21H,9H2,(H,18,23)(H,20,22)	KAIXKRWLJPOZSS-UHFFFAOYSA-N	Oc1ccc(Br)cc1C=NNC(=O)CNC(=O)c2ccncc2	BroadT	BRD-K23968250	BRD-K23968250-001-05-2	ChemDiv Inc.	2009-1461			Oc1ccc(Br)cc1C=NNC(=O)CNC(=O)c1ccncc1	InChI=1S/C15H13BrN4O3/c16-12-1-2-13(21)11(7-12)8-19-20-14(22)9-18-15(23)10-3-5-17-6-4-10/h1-8,21H,9H2,(H,18,23)(H,20,22)	KAIXKRWLJPOZSS-UHFFFAOYSA-N	376.017102916							
MLS000674822	LSM-17057	SID24814804, BRD-K44976794	16194489	InChI=1S/C16H14ClN3O3S/c1-23-13-6-8-14(9-7-13)24(21,22)20-16(18)10-15(19-20)11-2-4-12(17)5-3-11/h2-10H,18H2,1H3	UBXDSOIZJLMFPV-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)n2nc(cc2N)c3ccc(Cl)cc3	BroadT	BRD-K44976794	BRD-K44976794-001-05-3	ChemDiv Inc.	C665-0027			COc1ccc(cc1)S(=O)(=O)n1nc(cc1N)-c1ccc(Cl)cc1	InChI=1S/C16H14ClN3O3S/c1-23-13-6-8-14(9-7-13)24(21,22)20-16(18)10-15(19-20)11-2-4-12(17)5-3-11/h2-10H,18H2,1H3	UBXDSOIZJLMFPV-UHFFFAOYSA-N	363.044439738							105695
MLS000774680	LSM-43694	SID24833342, BRD-K27608080	2400427	InChI=1S/C17H15NO4/c1-22-13-9-6-12(7-10-13)8-11-16(19)18-15-5-3-2-4-14(15)17(20)21/h2-11H,1H3,(H,18,19)(H,20,21)/b11-8+	CKQMTXLABQTGQB-DHZHZOJOSA-N	COc1ccc(\C=C\C(=O)Nc2ccccc2C(=O)O)cc1	BroadT	BRD-K27608080	BRD-K27608080-001-05-6	Enamine Ltd.	T0520-1326			COc1ccc(\C=C\C(=O)Nc2ccccc2C(O)=O)cc1	InChI=1S/C17H15NO4/c1-22-13-9-6-12(7-10-13)8-11-16(19)18-15-5-3-2-4-14(15)17(20)21/h2-11H,1H3,(H,18,19)(H,20,21)/b11-8+	CKQMTXLABQTGQB-DHZHZOJOSA-N	297.10010797							
SMR000237818	LSM-43695	SID17514262, BRD-K88030905	12005790	InChI=1S/C21H16BrClN2O3/c22-17-3-1-2-15(12-17)21-16(13-25(24-21)11-10-20(27)28)6-9-19(26)14-4-7-18(23)8-5-14/h1-9,12-13H,10-11H2,(H,27,28)/b9-6-	PYTRNXVWUCEWPD-TWGQIWQCSA-N	OC(=O)CCn1cc(\C=C/C(=O)c2ccc(Cl)cc2)c(n1)c3cccc(Br)c3	BroadT	BRD-K88030905	BRD-K88030905-001-06-0	Life Chemicals Inc.	F1218-0347			OC(=O)CCn1cc(\C=C/C(=O)c2ccc(Cl)cc2)c(n1)-c1cccc(Br)c1	InChI=1S/C21H16BrClN2O3/c22-17-3-1-2-15(12-17)21-16(13-25(24-21)11-10-20(27)28)6-9-19(26)14-4-7-18(23)8-5-14/h1-9,12-13H,10-11H2,(H,27,28)/b9-6-	PYTRNXVWUCEWPD-TWGQIWQCSA-N	458.003282702							
5-Phenyl-2-((phenylamino)methylene)cyclohexane-1,3-dione	LSM-17060	SID24810931, BRD-K80604668	4465304	InChI=1S/C19H17NO2/c21-18-11-15(14-7-3-1-4-8-14)12-19(22)17(18)13-20-16-9-5-2-6-10-16/h1-10,13,15,20H,11-12H2	JFLLJQLFNVEAIH-UHFFFAOYSA-N	O=C1CC(CC(=O)C1=CNc2ccccc2)c3ccccc3	BroadT	BRD-K80604668	BRD-K80604668-001-06-7	ChemDiv Inc.	4850-0441			O=C1CC(CC(=O)C1=CNc1ccccc1)c1ccccc1	InChI=1S/C19H17NO2/c21-18-11-15(14-7-3-1-4-8-14)12-19(22)17(18)13-20-16-9-5-2-6-10-16/h1-10,13,15,20H,11-12H2	JFLLJQLFNVEAIH-UHFFFAOYSA-N	291.125928794							
SMR000019480	LSM-17061	SID4243645, BRD-K33404682	1765449	InChI=1S/C18H14O6/c19-17(20)15-7-5-11(23-15)9-22-10-4-6-13-12-2-1-3-14(12)18(21)24-16(13)8-10/h4-8H,1-3,9H2,(H,19,20)	YDSZVOWSROECBP-UHFFFAOYSA-N	OC(=O)c1oc(COc2ccc3C4=C(CCC4)C(=O)Oc3c2)cc1	BroadT	BRD-K33404682	BRD-K33404682-001-05-4	ChemDiv Inc.	4986-1266			OC(=O)c1ccc(COc2ccc3c4CCCc4c(=O)oc3c2)o1	InChI=1S/C18H14O6/c19-17(20)15-7-5-11(23-15)9-22-10-4-6-13-12-2-1-3-14(12)18(21)24-16(13)8-10/h4-8H,1-3,9H2,(H,19,20)	YDSZVOWSROECBP-UHFFFAOYSA-N	326.079038168							105699
2-Amino-4-phenylphenol	LSM-17062	SID4242350, SID26664298, BRD-K47707616	14562	InChI=1S/C12H11NO/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9/h1-8,14H,13H2	IGIDZGNPFWGICD-UHFFFAOYSA-N	Nc1cc(ccc1O)c2ccccc2	BroadT	BRD-K47707616	BRD-K47707616-001-06-3	National Cancer Institute Chemotherapeutic Agents Repository	3-amino-1,1'-biphenyl-4-ol 7950			Nc1cc(ccc1O)-c1ccccc1	InChI=1S/C12H11NO/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9/h1-8,14H,13H2	IGIDZGNPFWGICD-UHFFFAOYSA-N	185.084063982							105700
MLS000707247	LSM-17063	SID24809318, BRD-K64336474	892976	InChI=1S/C16H15N3O3S/c1-3-22-16(21)13-10-8-23-14(17)12(10)15(20)19(18-13)11-7-5-4-6-9(11)2/h4-8H,3,17H2,1-2H3	SXGQRQVITZAZLR-UHFFFAOYSA-N	CCOC(=O)C1=NN(C(=O)c2c(N)scc12)c3ccccc3C	BroadT	BRD-K64336474	BRD-K64336474-001-06-0	Asinex Ltd.	BAS 06057607			CCOC(=O)c1nn(-c2ccccc2C)c(=O)c2c(N)scc12	InChI=1S/C16H15N3O3S/c1-3-22-16(21)13-10-8-23-14(17)12(10)15(20)19(18-13)11-7-5-4-6-9(11)2/h4-8H,3,17H2,1-2H3	SXGQRQVITZAZLR-UHFFFAOYSA-N	329.08341206							105701
MLS000696887	LSM-43696	SID17515821, BRD-K73875306	12006164	InChI=1S/C22H19N3O3S/c1-14-2-6-16(7-3-14)25-22(17-11-29-12-18(17)24-25)23-21(26)9-5-15-4-8-19-20(10-15)28-13-27-19/h2-10H,11-13H2,1H3,(H,23,26)/b9-5-	WUYVBSRCBSYWEE-UITAMQMPSA-N	Cc1ccc(cc1)n2nc3CSCc3c2NC(=O)\C=C/c4ccc5OCOc5c4	BroadT	BRD-K73875306	BRD-K73875306-001-04-5	Life Chemicals Inc.	F0529-0082			Cc1ccc(cc1)-n1nc2CSCc2c1NC(=O)\C=C/c1ccc2OCOc2c1	InChI=1S/C22H19N3O3S/c1-14-2-6-16(7-3-14)25-22(17-11-29-12-18(17)24-25)23-21(26)9-5-15-4-8-19-20(10-15)28-13-27-19/h2-10H,11-13H2,1H3,(H,23,26)/b9-5-	WUYVBSRCBSYWEE-UITAMQMPSA-N	405.114712188							
AC1M29UY	LSM-43697	BRD-K49455964	2139385	InChI=1S/C16H15N3O/c1-13(10-14-6-3-2-4-7-14)11-18-19-16(20)15-8-5-9-17-12-15/h2-12H,1H3,(H,19,20)/b13-10+,18-11?	IBQCUYPFRQKZNZ-XFZGLGFCSA-N	C\C(=C/c1ccccc1)\C=NNC(=O)c2cccnc2	BroadT	BRD-K49455964	BRD-K49455964-001-05-7	ChemDiv Inc.	1842-0593			C\C(C=NNC(=O)c1cccnc1)=C/c1ccccc1	InChI=1S/C16H15N3O/c1-13(10-14-6-3-2-4-7-14)11-18-19-16(20)15-8-5-9-17-12-15/h2-12H,1H3,(H,19,20)/b13-10+,18-11?	IBQCUYPFRQKZNZ-XFZGLGFCSA-N	265.12151213							
MLS000058712	LSM-17066	SID3715371, BRD-A38078247	2999178	InChI=1S/C17H13FN2O4S/c1-9-12-8-14(17(22)24-13-6-7-23-16(13)21)25-15(12)20(19-9)11-4-2-10(18)3-5-11/h2-5,8,13H,6-7H2,1H3	NZSWRFJIZIXLGX-UHFFFAOYSA-N	Cc1nn(c2ccc(F)cc2)c3sc(cc13)C(=O)OC4CCOC4=O	BroadT	BRD-A38078247	BRD-A38078247-001-05-1	Enamine Ltd.	T5257781			Cc1nn(-c2ccc(F)cc2)c2sc(cc12)C(=O)OC1CCOC1=O	InChI=1S/C17H13FN2O4S/c1-9-12-8-14(17(22)24-13-6-7-23-16(13)21)25-15(12)20(19-9)11-4-2-10(18)3-5-11/h2-5,8,13H,6-7H2,1H3	NZSWRFJIZIXLGX-UHFFFAOYSA-N	360.058005806							105704
SMR000093352	LSM-17067	SID7966913, BRD-K85999141	5308512	InChI=1S/C13H13BrN2O3/c1-2-3-9-7-11(16-19-9)13(18)15-10-6-8(14)4-5-12(10)17/h4-7,17H,2-3H2,1H3,(H,15,18)	GCFSBSTUVNHVDX-UHFFFAOYSA-N	CCCc1onc(c1)C(=O)Nc2cc(Br)ccc2O	BroadT	BRD-K85999141	BRD-K85999141-001-06-3	ChemDiv Inc.	C226-3021			CCCc1cc(no1)C(=O)Nc1cc(Br)ccc1O	InChI=1S/C13H13BrN2O3/c1-2-3-9-7-11(16-19-9)13(18)15-10-6-8(14)4-5-12(10)17/h4-7,17H,2-3H2,1H3,(H,15,18)	GCFSBSTUVNHVDX-UHFFFAOYSA-N	324.010954896							105705
(8-Methoxy-2-methyl-quinolin-4-yl)-o-tolyl-amine	LSM-15261	BRD-K98170723	807584	InChI=1S/C18H18N2O/c1-12-7-4-5-9-15(12)20-16-11-13(2)19-18-14(16)8-6-10-17(18)21-3/h4-11H,1-3H3,(H,19,20)	LYANQLBZUJALFT-UHFFFAOYSA-N	COc1cccc2c(Nc3ccccc3C)cc(C)nc12	BroadT	BRD-K98170723	BRD-K98170723-003-05-0	Asinex Ltd.	BAS 00482230		Cl	COc1cccc2c(Nc3ccccc3C)cc(C)nc12.Cl	InChI=1S/C18H18N2O.ClH/c1-12-7-4-5-9-15(12)20-16-11-13(2)19-18-14(16)8-6-10-17(18)21-3;/h4-11H,1-3H3,(H,19,20);1H	FGNFLHWWGWFVDQ-UHFFFAOYSA-N	278.141913216							103908, 103908
ZINC18023740	LSM-15192	BRD-K07723125	9550565	InChI=1S/C17H14FN3OS/c1-22-15-8-4-13(5-9-15)16-11-23-17(21-20-16)19-10-12-2-6-14(18)7-3-12/h2-11,20H,1H3	JPYJRIQYPDCENN-UHFFFAOYSA-N	COc1ccc(cc1)C2=CSC(=NN2)N=Cc3ccc(F)cc3	BroadT	BRD-K07723125	BRD-K07723125-004-05-8	ChemDiv Inc.	2332-1138		Br	COc1ccc(cc1)C1=CSC(N=Cc2ccc(F)cc2)=NN1.Br	InChI=1S/C17H14FN3OS.BrH/c1-22-15-8-4-13(5-9-15)16-11-23-17(21-20-16)19-10-12-2-6-14(18)7-3-12;/h2-11,20H,1H3;1H	DFBVSQDCDICOOO-UHFFFAOYSA-N	327.084160988							103842
F1495-5984	LSM-17068	SID17414952, BRD-K51694032	2140163	InChI=1S/C23H18N4O3/c1-30-23(29)17-7-9-18(10-8-17)25-22(28)20-15-27(19-5-3-2-4-6-19)26-21(20)16-11-13-24-14-12-16/h2-15H,1H3,(H,25,28)	GAMGAUOEAAYTOE-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=O)c2cn(nc2c3ccncc3)c4ccccc4)cc1	BroadT	BRD-K51694032	BRD-K51694032-001-07-0	ChemBridge Corporation	7745082			COC(=O)c1ccc(NC(=O)c2cn(nc2-c2ccncc2)-c2ccccc2)cc1	InChI=1S/C23H18N4O3/c1-30-23(29)17-7-9-18(10-8-17)25-22(28)20-15-27(19-5-3-2-4-6-19)26-21(20)16-11-13-24-14-12-16/h2-15H,1H3,(H,25,28)	GAMGAUOEAAYTOE-UHFFFAOYSA-N	398.137890476							105706
MLS000409331	LSM-17069	SID22400968, BRD-K58429162	4875182	InChI=1S/C18H13Cl2N3O3S/c19-15-6-1-2-7-16(15)23-27(25,26)14-5-3-4-13(10-14)22-18(24)12-8-9-17(20)21-11-12/h1-11,23H,(H,22,24)	GNGFOKQODMWBEP-UHFFFAOYSA-N	Clc1ccc(cn1)C(=O)Nc2cccc(c2)S(=O)(=O)Nc3ccccc3Cl	BroadT	BRD-K58429162	BRD-K58429162-001-05-0	Enamine Ltd.	T5292720			Clc1ccc(cn1)C(=O)Nc1cccc(c1)S(=O)(=O)Nc1ccccc1Cl	InChI=1S/C18H13Cl2N3O3S/c19-15-6-1-2-7-16(15)23-27(25,26)14-5-3-4-13(10-14)22-18(24)12-8-9-17(20)21-11-12/h1-11,23H,(H,22,24)	GNGFOKQODMWBEP-UHFFFAOYSA-N	421.005467416							105707
AG-205/37159041	LSM-17070	SID17386846, BRD-A74548703	3123702	InChI=1S/C18H19N3O2/c1-13-5-7-15(8-6-13)10-17(22)21-18(23,11-14(2)20-21)16-4-3-9-19-12-16/h3-9,12,23H,10-11H2,1-2H3	VXINZSUGKXKAJC-UHFFFAOYSA-N	CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(C1)c3cccnc3	BroadT	BRD-A74548703	BRD-A74548703-001-05-5	Specs	AG-205/37159041			CC1=NN(C(=O)Cc2ccc(C)cc2)C(O)(C1)c1cccnc1	InChI=1S/C18H19N3O2/c1-13-5-7-15(8-6-13)10-17(22)21-18(23,11-14(2)20-21)16-4-3-9-19-12-16/h3-9,12,23H,10-11H2,1-2H3	VXINZSUGKXKAJC-UHFFFAOYSA-N	309.147726878							105708
AC1MWF4V	LSM-17071	SID17513974, BRD-A76985501	3723106	InChI=1S/C17H14N2OS/c1-12-5-2-3-6-14(12)15(13(10-18)11-19)9-16(20)17-7-4-8-21-17/h2-8,13,15H,9H2,1H3	NEEVBWZTPVZUSU-UHFFFAOYSA-N	Cc1ccccc1C(CC(=O)c2cccs2)C(C#N)C#N	BroadT	BRD-A76985501	BRD-A76985501-001-06-9	InterBioScreen Ltd.	STOCK2S-06332			Cc1ccccc1C(CC(=O)c1cccs1)C(C#N)C#N	InChI=1S/C17H14N2OS/c1-12-5-2-3-6-14(12)15(13(10-18)11-19)9-16(20)17-7-4-8-21-17/h2-8,13,15H,9H2,1H3	NEEVBWZTPVZUSU-UHFFFAOYSA-N	294.082683778							105709
CHEMDIV1_012409	LSM-17072	SID49715506, BRD-K72778748	6616036	InChI=1S/C25H22N4O6S/c1-33-15-6-8-19(21(12-15)35-3)29-24(32)16-7-4-14(11-17(16)28-25(29)36)23(31)27-18-10-13(22(26)30)5-9-20(18)34-2/h4-12H,1-3H3,(H2,26,30)(H,27,31)(H,28,36)	NGYLWEJNCRNNIG-UHFFFAOYSA-N	COc1ccc(N2C(=S)Nc3cc(ccc3C2=O)C(=O)Nc4cc(ccc4OC)C(=O)N)c(OC)c1	BroadT	BRD-K72778748	BRD-K72778748-001-06-3	ChemDiv Inc.	A0061551			COc1ccc(c(OC)c1)-n1c(=S)[nH]c2cc(ccc2c1=O)C(=O)Nc1cc(ccc1OC)C(N)=O	InChI=1S/C25H22N4O6S/c1-33-15-6-8-19(21(12-15)35-3)29-24(32)16-7-4-14(11-17(16)28-25(29)36)23(31)27-18-10-13(22(26)30)5-9-20(18)34-2/h4-12H,1-3H3,(H2,26,30)(H,27,31)(H,28,36)	NGYLWEJNCRNNIG-UHFFFAOYSA-N	506.126005154							105710
SMR000068036	LSM-17073	SID3711506, BRD-A57640279	2997664	InChI=1S/C19H20N4O3S/c1-4-9-23-18(17-10-24-15-7-5-6-8-16(15)25-17)20-21-19(23)27-11-14-12(2)22-26-13(14)3/h4-8,17H,1,9-11H2,2-3H3	TYQNXYVZANKAGG-UHFFFAOYSA-N	Cc1onc(C)c1CSc2nnc(C3COc4ccccc4O3)n2CC=C	BroadT	BRD-A57640279	BRD-A57640279-001-05-5	Enamine Ltd.	T5333718			Cc1noc(C)c1CSc1nnc(C2COc3ccccc3O2)n1CC=C	InChI=1S/C19H20N4O3S/c1-4-9-23-18(17-10-24-15-7-5-6-8-16(15)25-17)20-21-19(23)27-11-14-12(2)22-26-13(14)3/h4-8,17H,1,9-11H2,2-3H3	TYQNXYVZANKAGG-UHFFFAOYSA-N	384.12561123							105711
SMR000029508	LSM-17074	SID4248296, BRD-K24588660	3242390	InChI=1S/C23H29N5O5/c1-2-33-23(32)27-12-10-26(11-13-27)21(30)15-20(29)24-16-7-8-18-17(14-16)22(31)28-9-5-3-4-6-19(28)25-18/h7-8,14H,2-6,9-13,15H2,1H3,(H,24,29)	RUFQRRFSBBTJGT-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)CC(=O)Nc2ccc3N=C4CCCCCN4C(=O)c3c2	BroadT	BRD-K24588660	BRD-K24588660-001-05-1	ChemDiv Inc.	C865-0053			CCOC(=O)N1CCN(CC1)C(=O)CC(=O)Nc1ccc2nc3CCCCCn3c(=O)c2c1	InChI=1S/C23H29N5O5/c1-2-33-23(32)27-12-10-26(11-13-27)21(30)15-20(29)24-16-7-8-18-17(14-16)22(31)28-9-5-3-4-6-19(28)25-18/h7-8,14H,2-6,9-13,15H2,1H3,(H,24,29)	RUFQRRFSBBTJGT-UHFFFAOYSA-N	455.216869078							105712
SMR000021681	LSM-17075	SID4250426, BRD-K28260634	3244239	InChI=1S/C22H26N2O5/c1-13(2)11-24-12-18(21(25)23-10-15-7-6-14(3)29-15)16-8-19(27-4)20(28-5)9-17(16)22(24)26/h6-9,12-13H,10-11H2,1-5H3,(H,23,25)	FFYWTGVQTAIHMC-UHFFFAOYSA-N	COc1cc2C(=O)N(CC(C)C)C=C(C(=O)NCc3oc(C)cc3)c2cc1OC	BroadT	BRD-K28260634	BRD-K28260634-001-05-6	ChemDiv Inc.	C066-1506			COc1cc2c(cn(CC(C)C)c(=O)c2cc1OC)C(=O)NCc1ccc(C)o1	InChI=1S/C22H26N2O5/c1-13(2)11-24-12-18(21(25)23-10-15-7-6-14(3)29-15)16-8-19(27-4)20(28-5)9-17(16)22(24)26/h6-9,12-13H,10-11H2,1-5H3,(H,23,25)	FFYWTGVQTAIHMC-UHFFFAOYSA-N	398.184171952							105713
T0501-8687	LSM-17076	SID22405647, BRD-A24523504	4417692	InChI=1S/C24H23Cl2FN2O/c1-17-12-13-20(14-21(17)27)22(23(25)26)28-24(30)29(15-18-8-4-2-5-9-18)16-19-10-6-3-7-11-19/h2-14,22-23H,15-16H2,1H3,(H,28,30)	ATDPQEPHNOQBOD-UHFFFAOYSA-N	Cc1ccc(cc1F)C(NC(=O)N(Cc2ccccc2)Cc3ccccc3)C(Cl)Cl	BroadT	BRD-A24523504	BRD-A24523504-001-05-0	Enamine Ltd.	T0501-8687			Cc1ccc(cc1F)C(NC(=O)N(Cc1ccccc1)Cc1ccccc1)C(Cl)Cl	InChI=1S/C24H23Cl2FN2O/c1-17-12-13-20(14-21(17)27)22(23(25)26)28-24(30)29(15-18-8-4-2-5-9-18)16-19-10-6-3-7-11-19/h2-14,22-23H,15-16H2,1H3,(H,28,30)	ATDPQEPHNOQBOD-UHFFFAOYSA-N	444.117146996							105714
MLS000582256	LSM-43698	SID17415777, BRD-K04190958	5740612	InChI=1S/C23H17N3O5/c1-29-21-11-14(6-8-19(21)30-13-16-7-9-20(31-16)23(27)28)10-15(12-24)22-25-17-4-2-3-5-18(17)26-22/h2-11H,13H2,1H3,(H,25,26)(H,27,28)/b15-10-	YMCNIDGRLKHCMB-GDNBJRDFSA-N	COc1cc(\C=C(\C#N)/c2nc3ccccc3[nH]2)ccc1OCc4oc(cc4)C(=O)O	BroadT	BRD-K04190958	BRD-K04190958-001-05-1	ChemBridge Corporation	7927453			COc1cc(\C=C(\C#N)c2nc3ccccc3[nH]2)ccc1OCc1ccc(o1)C(O)=O	InChI=1S/C23H17N3O5/c1-29-21-11-14(6-8-19(21)30-13-16-7-9-20(31-16)23(27)28)10-15(12-24)22-25-17-4-2-3-5-18(17)26-22/h2-11H,13H2,1H3,(H,25,26)(H,27,28)/b15-10-	YMCNIDGRLKHCMB-GDNBJRDFSA-N	415.116820674							
AC1NQDIZ	LSM-17078	BRD-K25548987	5194408	InChI=1S/C14H18N2OS/c1-10-7-11(9-14(2,3)8-10)15-16-13(17)12-5-4-6-18-12/h4-7H,8-9H2,1-3H3,(H,16,17)	JIKXSVJEBSOWSR-UHFFFAOYSA-N	CC1=CC(=NNC(=O)c2cccs2)CC(C)(C)C1	BroadT	BRD-K25548987	BRD-K25548987-001-05-0	ChemDiv Inc.	1269-1774			CC1=CC(CC(C)(C)C1)=NNC(=O)c1cccs1	InChI=1S/C14H18N2OS/c1-10-7-11(9-14(2,3)8-10)15-16-13(17)12-5-4-6-18-12/h4-7H,8-9H2,1-3H3,(H,16,17)	JIKXSVJEBSOWSR-UHFFFAOYSA-N	262.113983906							105716
ZINC00813372	LSM-15242	BRD-K85882511	1092434	InChI=1S/C17H15N3O4S2/c1-11(21)24-14-6-2-12(3-7-14)16-10-25-17(20-16)19-13-4-8-15(9-5-13)26(18,22)23/h2-10H,1H3,(H,19,20)(H2,18,22,23)	UBBZNTOMSLRFTE-UHFFFAOYSA-N	CC(=O)Oc1ccc(cc1)c2csc(Nc3ccc(cc3)S(=O)(=O)N)n2	BroadT	BRD-K85882511	BRD-K85882511-015-05-5	Asinex Ltd.	BAS 08769701		CC(=O)O	CC(=O)Oc1ccc(cc1)-c1csc(Nc2ccc(cc2)S(N)(=O)=O)n1.CC(=O)O	InChI=1S/C17H15N3O4S2.C2H4O2/c1-11(21)24-14-6-2-12(3-7-14)16-10-25-17(20-16)19-13-4-8-15(9-5-13)26(18,22)23;1-2(3)4/h2-10H,1H3,(H,19,20)(H2,18,22,23);1H3,(H,3,4)	RTKJILRPZATJAU-UHFFFAOYSA-N	389.05039737							103889, 103889
MLS000041932	LSM-2538	BRD-K24598397, SID864201, SID87345934	665449	InChI=1S/C16H19Cl2N3O5S/c1-16(2,3)26-14(22)19-7-6-13-20-21-15(25-13)27(23,24)9-10-4-5-11(17)8-12(10)18/h4-5,8H,6-7,9H2,1-3H3,(H,19,22)	KTPSEIKHZBDCBJ-UHFFFAOYSA-N	CC(C)(C)OC(=O)NCCc1oc(nn1)S(=O)(=O)Cc2ccc(Cl)cc2Cl	BroadT	BRD-K24598397	BRD-K24598397-001-08-4	InterBioScreen Ltd.	STOCK5S-11605			CC(C)(C)OC(=O)NCCc1nnc(o1)S(=O)(=O)Cc1ccc(Cl)cc1Cl	InChI=1S/C16H19Cl2N3O5S/c1-16(2,3)26-14(22)19-7-6-13-20-21-15(25-13)27(23,24)9-10-4-5-11(17)8-12(10)18/h4-5,8H,6-7,9H2,1-3H3,(H,19,22)	KTPSEIKHZBDCBJ-UHFFFAOYSA-N	435.042246848							92433
AC1N77TQ	LSM-17079	SID22407466, BRD-K43486179	4273555	InChI=1S/C20H14Cl2N4OS/c21-13-10-15(22)19(23-11-13)25-18(27)12-28-20-24-16-8-4-5-9-17(16)26(20)14-6-2-1-3-7-14/h1-11H,12H2,(H,23,25,27)	YIJPEFNZZMASKU-UHFFFAOYSA-N	Clc1cnc(NC(=O)CSc2nc3ccccc3n2c4ccccc4)c(Cl)c1	BroadT	BRD-K43486179	BRD-K43486179-001-05-9	Enamine Ltd.	T0518-3540			Clc1cnc(NC(=O)CSc2nc3ccccc3n2-c2ccccc2)c(Cl)c1	InChI=1S/C20H14Cl2N4OS/c21-13-10-15(22)19(23-11-13)25-18(27)12-28-20-24-16-8-4-5-9-17(16)26(20)14-6-2-1-3-7-14/h1-11H,12H2,(H,23,25,27)	YIJPEFNZZMASKU-UHFFFAOYSA-N	428.026537218							105717
CHEMDIV3_013106	LSM-17080	SID49736130, BRD-K21094569	4305995	InChI=1S/C23H24N2O/c1-16-10-11-18(14-17(16)2)22-15-20(19-8-4-5-9-21(19)24-22)23(26)25-12-6-3-7-13-25/h4-5,8-11,14-15H,3,6-7,12-13H2,1-2H3	CGPOPEFAVJUOPY-UHFFFAOYSA-N	Cc1ccc(cc1C)c2cc(C(=O)N3CCCCC3)c4ccccc4n2	BroadT	BRD-K21094569	BRD-K21094569-001-06-3	ChemDiv Inc.	K786-0981			Cc1ccc(cc1C)-c1cc(C(=O)N2CCCCC2)c2ccccc2n1	InChI=1S/C23H24N2O/c1-16-10-11-18(14-17(16)2)22-15-20(19-8-4-5-9-21(19)24-22)23(26)25-12-6-3-7-13-25/h4-5,8-11,14-15H,3,6-7,12-13H2,1-2H3	CGPOPEFAVJUOPY-UHFFFAOYSA-N	344.188863408							105718
AP-124/41669689	LSM-17081	SID850402, BRD-A27209003	652924	InChI=1S/C23H27N3O3/c1-13-8-9-20-19(10-13)18-6-5-7-21(29)23(18)25(20)11-17(28)12-26-15(3)22(16(4)27)14(2)24-26/h8-10,17,28H,5-7,11-12H2,1-4H3	XJUQIVFIWRNALO-UHFFFAOYSA-N	CC(=O)c1c(C)nn(CC(O)Cn2c3C(=O)CCCc3c4cc(C)ccc24)c1C	BroadT	BRD-A27209003	BRD-A27209003-001-04-2	Asinex Ltd.	BAS 05604614			CC(=O)c1c(C)nn(CC(O)Cn2c3c(CCCC3=O)c3cc(C)ccc23)c1C	InChI=1S/C23H27N3O3/c1-13-8-9-20-19(10-13)18-6-5-7-21(29)23(18)25(20)11-17(28)12-26-15(3)22(16(4)27)14(2)24-26/h8-10,17,28H,5-7,11-12H2,1-4H3	XJUQIVFIWRNALO-UHFFFAOYSA-N	393.205241754							105719
ST50277656	LSM-17082	SID24803418, BRD-K59420052	808203	InChI=1S/C16H15FN2O/c17-14-5-7-15(8-6-14)18-16(20)19-10-9-12-3-1-2-4-13(12)11-19/h1-8H,9-11H2,(H,18,20)	PTKRIJQZPBQGGV-UHFFFAOYSA-N	Fc1ccc(NC(=O)N2CCc3ccccc3C2)cc1	BroadT	BRD-K59420052	BRD-K59420052-001-05-1	Asinex Ltd.	BAS 05338703			Fc1ccc(NC(=O)N2CCc3ccccc3C2)cc1	InChI=1S/C16H15FN2O/c17-14-5-7-15(8-6-14)18-16(20)19-10-9-12-3-1-2-4-13(12)11-19/h1-8H,9-11H2,(H,18,20)	PTKRIJQZPBQGGV-UHFFFAOYSA-N	270.11684132							105720
6-Nitro-1,3-benzodioxol-5-amine	LSM-17083	SID24791280, BRD-K11392760	602665	InChI=1S/C7H6N2O4/c8-4-1-6-7(13-3-12-6)2-5(4)9(10)11/h1-2H,3,8H2	TXZJXBGDLONQGP-UHFFFAOYSA-N	Nc1cc2OCOc2cc1[N+](=O)[O-]	BroadT	BRD-K11392760	BRD-K11392760-001-05-2	Enamine Ltd.	T0513-9536			Nc1cc2OCOc2cc1[N+]([O-])=O	InChI=1S/C7H6N2O4/c8-4-1-6-7(13-3-12-6)2-5(4)9(10)11/h1-2H,3,8H2	TXZJXBGDLONQGP-UHFFFAOYSA-N	182.032756692							105721
MLS000042180	LSM-17084	SID863575, BRD-K76425737	664825	InChI=1S/C19H15FN2O/c1-12-10-16(15-11-14(20)6-7-17(15)21-12)19(23)22-9-8-13-4-2-3-5-18(13)22/h2-7,10-11H,8-9H2,1H3	BFVWWCZCYHAJBI-UHFFFAOYSA-N	Cc1cc(C(=O)N2CCc3ccccc23)c4cc(F)ccc4n1	BroadT	BRD-K76425737	BRD-K76425737-001-05-2	InterBioScreen Ltd.	STOCK4S-77472			Cc1cc(C(=O)N2CCc3ccccc23)c2cc(F)ccc2n1	InChI=1S/C19H15FN2O/c1-12-10-16(15-11-14(20)6-7-17(15)21-12)19(23)22-9-8-13-4-2-3-5-18(13)22/h2-7,10-11H,8-9H2,1H3	BFVWWCZCYHAJBI-UHFFFAOYSA-N	306.11684132							105722
2-[3-(4-Methylphenyl)acryloyl]-1,2,3,4-tetrahydroisoquinoline	LSM-43699	SID17387118, BRD-K41951173	903355	InChI=1S/C19H19NO/c1-15-6-8-16(9-7-15)10-11-19(21)20-13-12-17-4-2-3-5-18(17)14-20/h2-11H,12-14H2,1H3/b11-10+	OYMYPUTVEZWFAQ-ZHACJKMWSA-N	Cc1ccc(\C=C\C(=O)N2CCc3ccccc3C2)cc1	BroadT	BRD-K41951173	BRD-K41951173-001-05-0	Specs	AK-968/12116019			Cc1ccc(\C=C\C(=O)N2CCc3ccccc3C2)cc1	InChI=1S/C19H19NO/c1-15-6-8-16(9-7-15)10-11-19(21)20-13-12-17-4-2-3-5-18(17)14-20/h2-11H,12-14H2,1H3/b11-10+	OYMYPUTVEZWFAQ-ZHACJKMWSA-N	277.146664238							
SMR000131239	LSM-17086	SID14737563, BRD-K69123433	3261615	InChI=1S/C22H26N2O5S/c1-5-28-19-12-15-16(13-20(19)29-6-2)23-22(30)24(21(15)25)10-9-14-7-8-17(26-3)18(11-14)27-4/h7-8,11-13H,5-6,9-10H2,1-4H3,(H,23,30)	FPVIIGUVSYHBAD-UHFFFAOYSA-N	CCOc1cc2NC(=S)N(CCc3ccc(OC)c(OC)c3)C(=O)c2cc1OCC	BroadT	BRD-K69123433	BRD-K69123433-001-05-9	ChemDiv Inc.	K284-7327			CCOc1cc2[nH]c(=S)n(CCc3ccc(OC)c(OC)c3)c(=O)c2cc1OCC	InChI=1S/C22H26N2O5S/c1-5-28-19-12-15-16(13-20(19)29-6-2)23-22(30)24(21(15)25)10-9-14-7-8-17(26-3)18(11-14)27-4/h7-8,11-13H,5-6,9-10H2,1-4H3,(H,23,30)	FPVIIGUVSYHBAD-UHFFFAOYSA-N	430.156242642							105724
SMR000093862	LSM-17087	SID7965869, BRD-A40862551	5307880	InChI=1S/C22H20N2O4/c1-2-27-22(26)15-7-5-8-16(13-15)23-20-18-10-3-4-11-19(18)21(25)24(20)14-17-9-6-12-28-17/h3-13,20,23H,2,14H2,1H3	SAYPMMRWNWIMRB-UHFFFAOYSA-N	CCOC(=O)c1cccc(NC2N(Cc3occc3)C(=O)c4ccccc24)c1	BroadT	BRD-A40862551	BRD-A40862551-001-05-4	ChemDiv Inc.	C429-0121			CCOC(=O)c1cccc(NC2N(Cc3ccco3)C(=O)c3ccccc23)c1	InChI=1S/C22H20N2O4/c1-2-27-22(26)15-7-5-8-16(13-15)23-20-18-10-3-4-11-19(18)21(25)24(20)14-17-9-6-12-28-17/h3-13,20,23H,2,14H2,1H3	SAYPMMRWNWIMRB-UHFFFAOYSA-N	376.14230714							105725
AC1M2QR1	LSM-17088	SID22402452, BRD-K27567433	2149993	InChI=1S/C13H12ClN3O3/c14-9-3-1-8(2-4-9)7-15-11(18)5-10-6-12(19)17-13(20)16-10/h1-4,6H,5,7H2,(H,15,18)(H2,16,17,19,20)	NVAVJMPQPXAMKX-UHFFFAOYSA-N	Oc1cc(CC(=O)NCc2ccc(Cl)cc2)nc(O)n1	BroadT	BRD-K27567433	BRD-K27567433-001-04-1	Life Chemicals Inc.	F1811-0116			Oc1cc(CC(=O)NCc2ccc(Cl)cc2)nc(O)n1	InChI=1S/C13H12ClN3O3/c14-9-3-1-8(2-4-9)7-15-11(18)5-10-6-12(19)17-13(20)16-10/h1-4,6H,5,7H2,(H,15,18)(H2,16,17,19,20)	NVAVJMPQPXAMKX-UHFFFAOYSA-N	293.056718984							105726
ZINC00798302	LSM-17089	SID24274899, SID24805775, BRD-K44911800	1082741	InChI=1S/C20H15NO4S/c1-23-15-9-8-13(10-16(15)24-2)14-11-26-19-17(14)20(22)25-18(21-19)12-6-4-3-5-7-12/h3-11H,1-2H3	XPBQTPWLVPXDES-UHFFFAOYSA-N	COc1ccc(cc1OC)c2csc3N=C(OC(=O)c23)c4ccccc4	BroadT	BRD-K44911800	BRD-K44911800-001-05-2	Asinex Ltd.	BAS 06105319			COc1ccc(cc1OC)-c1csc2nc(oc(=O)c12)-c1ccccc1	InChI=1S/C20H15NO4S/c1-23-15-9-8-13(10-16(15)24-2)14-11-26-19-17(14)20(22)25-18(21-19)12-6-4-3-5-7-12/h3-11H,1-2H3	XPBQTPWLVPXDES-UHFFFAOYSA-N	365.07217866							105727
MLS000718966	LSM-43700	SID24822483, BRD-K96448807	5962919	InChI=1S/C17H14N4O5/c18-14(22)10-3-5-11(6-4-10)19-8-13-15(23)20-17(25)21(16(13)24)9-12-2-1-7-26-12/h1-8,19H,9H2,(H2,18,22)(H,20,23,25)/b13-8-	SWGSNYQISNHHMF-JYRVWZFOSA-N	NC(=O)c1ccc(N\C=C/2\C(=O)NC(=O)N(Cc3occc3)C2=O)cc1	BroadT	BRD-K96448807	BRD-K96448807-001-05-5	Asinex Ltd.	ASN 11088975			NC(=O)c1ccc(N\C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1	InChI=1S/C17H14N4O5/c18-14(22)10-3-5-11(6-4-10)19-8-13-15(23)20-17(25)21(16(13)24)9-12-2-1-7-26-12/h1-8,19H,9H2,(H2,18,22)(H,20,23,25)/b13-8-	SWGSNYQISNHHMF-JYRVWZFOSA-N	354.096419588							
MLS000095221	LSM-17091	SID4241068, BRD-K02939348	3236088	InChI=1S/C21H27N3O4S/c25-18(23-12-9-21(10-13-23)27-14-15-28-21)8-2-1-5-11-24-19(26)16-6-3-4-7-17(16)22-20(24)29/h3-4,6-7H,1-2,5,8-15H2,(H,22,29)	AQBWUEJVFPHJKP-UHFFFAOYSA-N	O=C(CCCCCN1C(=S)Nc2ccccc2C1=O)N3CCC4(CC3)OCCO4	BroadT	BRD-K02939348	BRD-K02939348-001-05-2	ChemDiv Inc.	K284-1240			O=C(CCCCCn1c(=S)[nH]c2ccccc2c1=O)N1CCC2(CC1)OCCO2	InChI=1S/C21H27N3O4S/c25-18(23-12-9-21(10-13-23)27-14-15-28-21)8-2-1-5-11-24-19(26)16-6-3-4-7-17(16)22-20(24)29/h3-4,6-7H,1-2,5,8-15H2,(H,22,29)	AQBWUEJVFPHJKP-UHFFFAOYSA-N	417.172227064							105729
AC1NJPBS	LSM-17092	SID14746870, BRD-K57634359	4875632	InChI=1S/C13H12N6O2/c1-8-5-6-14-13-17-11(18-19(8)13)12(20)16-9-3-4-10(21-2)15-7-9/h3-7H,1-2H3,(H,16,20)	QYJHYXLNEVHFPZ-UHFFFAOYSA-N	COc1ccc(NC(=O)c2nc3nccc(C)n3n2)cn1	BroadT	BRD-K57634359	BRD-K57634359-001-06-7	Enamine Ltd.	T5295480			COc1ccc(NC(=O)c2nc3nccc(C)n3n2)cn1	InChI=1S/C13H12N6O2/c1-8-5-6-14-13-17-11(18-19(8)13)12(20)16-9-3-4-10(21-2)15-7-9/h3-7H,1-2H3,(H,16,20)	QYJHYXLNEVHFPZ-UHFFFAOYSA-N	284.102173684							105730
AC1LCPRY	LSM-17093	SID851488, BRD-K78222443	654064	InChI=1S/C19H19N3O4/c1-22-19(24)13-8-5-4-7-12(13)14(21-22)11-17(23)20-18-15(25-2)9-6-10-16(18)26-3/h4-10H,11H2,1-3H3,(H,20,23)	FZWRTZXNJDXKLV-UHFFFAOYSA-N	COc1cccc(OC)c1NC(=O)CC2=NN(C)C(=O)c3ccccc23	BroadT	BRD-K78222443	BRD-K78222443-001-05-6	Asinex Ltd.	ASN 05990638			COc1cccc(OC)c1NC(=O)Cc1nn(C)c(=O)c2ccccc12	InChI=1S/C19H19N3O4/c1-22-19(24)13-8-5-4-7-12(13)14(21-22)11-17(23)20-18-15(25-2)9-6-10-16(18)26-3/h4-10H,11H2,1-3H3,(H,20,23)	FZWRTZXNJDXKLV-UHFFFAOYSA-N	353.137556118							105731
MLS000116868	LSM-17094	SID7967790, BRD-A00697544	5309036	InChI=1S/C14H15N3O3/c1-7-11-12(15-14(18)13(11)17-16-7)9-5-4-8(19-2)6-10(9)20-3/h4-6,12H,1-3H3,(H,15,18)(H,16,17)	JAZCXHKZMXDIES-UHFFFAOYSA-N	COc1ccc(C2NC(=O)c3[nH]nc(C)c23)c(OC)c1	BroadT	BRD-A00697544	BRD-A00697544-001-05-2	ChemDiv Inc.	C390-0724			COc1ccc(C2NC(=O)c3[nH]nc(C)c23)c(OC)c1	InChI=1S/C14H15N3O3/c1-7-11-12(15-14(18)13(11)17-16-7)9-5-4-8(19-2)6-10(9)20-3/h4-6,12H,1-3H3,(H,15,18)(H,16,17)	JAZCXHKZMXDIES-UHFFFAOYSA-N	273.11134137							105732
4-Allyl-5-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-2,4-dihydro-3H-1,2,4-triazole-3-thione	LSM-17095	SID26726518, BRD-K40843157	2814542	InChI=1S/C15H16N6S2/c1-3-9-21-12(16-18-14(21)22)10-23-15-19-17-13(20(15)2)11-7-5-4-6-8-11/h3-8H,1,9-10H2,2H3,(H,18,22)	JJMOLQKDUDIOHL-UHFFFAOYSA-N	Cn1c(SCc2nnc(S)n2CC=C)nnc1c3ccccc3	BroadT	BRD-K40843157	BRD-K40843157-001-04-3	Maybridge	HTS 08987			Cn1c(SCc2n[nH]c(=S)n2CC=C)nnc1-c1ccccc1	InChI=1S/C15H16N6S2/c1-3-9-21-12(16-18-14(21)22)10-23-15-19-17-13(20(15)2)11-7-5-4-6-8-11/h3-8H,1,9-10H2,2H3,(H,18,22)	JJMOLQKDUDIOHL-UHFFFAOYSA-N	344.087785952							105733
MLS000681782	LSM-17096	SID24272841, SID24814875, BRD-K23659898	3590106	InChI=1S/C20H22N2O4S/c23-16(11-12-17(24)25)22-20-18(14-9-5-2-6-10-15(14)27-20)19(26)21-13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,9-12H2,(H,21,26)(H,22,23)(H,24,25)	ITRHUIJAZOOGTM-UHFFFAOYSA-N	OC(=O)CCC(=O)Nc1sc2CCCCCc2c1C(=O)Nc3ccccc3	BroadT	BRD-K23659898	BRD-K23659898-001-05-5	ChemDiv Inc.	3759-1287			OC(=O)CCC(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1	InChI=1S/C20H22N2O4S/c23-16(11-12-17(24)25)22-20-18(14-9-5-2-6-10-15(14)27-20)19(26)21-13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,9-12H2,(H,21,26)(H,22,23)(H,24,25)	ITRHUIJAZOOGTM-UHFFFAOYSA-N	386.130027894							105734
AC1O99PE	LSM-17097	BRD-K61554070	6752339	InChI=1S/C17H16BrClN2O2/c18-16-10-13(19)9-12(17(16)22)11-20-14-1-3-15(4-2-14)21-5-7-23-8-6-21/h1-4,9-11,22H,5-8H2	CPGGDWIBCBJPIR-UHFFFAOYSA-N	Oc1c(Br)cc(Cl)cc1C=Nc2ccc(cc2)N3CCOCC3	BroadT	BRD-K61554070	BRD-K61554070-001-05-1	Asinex Ltd.	BAS 00272911			Oc1c(Br)cc(Cl)cc1C=Nc1ccc(cc1)N1CCOCC1	InChI=1S/C17H16BrClN2O2/c18-16-10-13(19)9-12(17(16)22)11-20-14-1-3-15(4-2-14)21-5-7-23-8-6-21/h1-4,9-11,22H,5-8H2	CPGGDWIBCBJPIR-UHFFFAOYSA-N	394.008368082							
MLS000520823	LSM-17098	SID17401898, BRD-K35615607	11957191	InChI=1S/C25H30N4O5S/c1-32-12-9-26-23(30)17-35-25-27-22-8-5-19(28-10-13-34-14-11-28)15-21(22)24(31)29(25)16-18-3-6-20(33-2)7-4-18/h3-8,15H,9-14,16-17H2,1-2H3,(H,26,30)	UWKFXMULYPFETC-UHFFFAOYSA-N	COCCNC(=O)CSC1=Nc2ccc(cc2C(=O)N1Cc3ccc(OC)cc3)N4CCOCC4	BroadT	BRD-K35615607	BRD-K35615607-001-05-5	ChemDiv Inc.	K284-6861			COCCNC(=O)CSc1nc2ccc(cc2c(=O)n1Cc1ccc(OC)cc1)N1CCOCC1	InChI=1S/C25H30N4O5S/c1-32-12-9-26-23(30)17-35-25-27-22-8-5-19(28-10-13-34-14-11-28)15-21(22)24(31)29(25)16-18-3-6-20(33-2)7-4-18/h3-8,15H,9-14,16-17H2,1-2H3,(H,26,30)	UWKFXMULYPFETC-UHFFFAOYSA-N	498.19369079							105736
MLS000858711	LSM-17099	SID26728287, BRD-K04968712	2814981	InChI=1S/C19H10ClF4N3O2/c1-9-14(16(27-29-9)15-12(20)3-2-4-13(15)21)18-26-25-17(28-18)10-5-7-11(8-6-10)19(22,23)24/h2-8H,1H3	OAKGFSAPWOUFRC-UHFFFAOYSA-N	Cc1onc(c1c2oc(nn2)c3ccc(cc3)C(F)(F)F)c4c(F)cccc4Cl	BroadT	BRD-K04968712	BRD-K04968712-001-05-7	Maybridge	HTS 09776			Cc1onc(c1-c1nnc(o1)-c1ccc(cc1)C(F)(F)F)-c1c(F)cccc1Cl	InChI=1S/C19H10ClF4N3O2/c1-9-14(16(27-29-9)15-12(20)3-2-4-13(15)21)18-26-25-17(28-18)10-5-7-11(8-6-10)19(22,23)24/h2-8H,1H3	OAKGFSAPWOUFRC-UHFFFAOYSA-N	423.0397671							105737
MLS000757161	LSM-17100	SID26665061, BRD-K62987569	342632	InChI=1S/C18H12Br2Cl2N2O2/c1-8-6-10(19)16(11(20)7-8)23-18(25)14-9(2)26-24-17(14)15-12(21)4-3-5-13(15)22/h3-7H,1-2H3,(H,23,25)	UEQJYROUYRYTFG-UHFFFAOYSA-N	Cc1cc(Br)c(NC(=O)c2c(C)onc2c3c(Cl)cccc3Cl)c(Br)c1	BroadT	BRD-K62987569	BRD-K62987569-001-05-0	National Cancer Institute Chemotherapeutic Agents Repository	379880			Cc1onc(c1C(=O)Nc1c(Br)cc(C)cc1Br)-c1c(Cl)cccc1Cl	InChI=1S/C18H12Br2Cl2N2O2/c1-8-6-10(19)16(11(20)7-8)23-18(25)14-9(2)26-24-17(14)15-12(21)4-3-5-13(15)22/h3-7H,1-2H3,(H,23,25)	UEQJYROUYRYTFG-UHFFFAOYSA-N	515.864258264							105738
MLS000392966	LSM-17101	SID22411534, BRD-K00659699	3560290	InChI=1S/C19H24ClN3O2S2/c1-4-5-6-14-7-9-15(10-8-14)21-19(26)22-16-11-12-17(20)18(13-16)27(24,25)23(2)3/h7-13H,4-6H2,1-3H3,(H2,21,22,26)	PAQNCIRKVOBURI-UHFFFAOYSA-N	CCCCc1ccc(NC(=Nc2ccc(Cl)c(c2)S(=O)(=O)N(C)C)S)cc1	BroadT	BRD-K00659699	BRD-K00659699-001-05-3	Enamine Ltd.	T5227208			CCCCc1ccc(NC(S)=Nc2ccc(Cl)c(c2)S(=O)(=O)N(C)C)cc1	InChI=1S/C19H24ClN3O2S2/c1-4-5-6-14-7-9-15(10-8-14)21-19(26)22-16-11-12-17(20)18(13-16)27(24,25)23(2)3/h7-13H,4-6H2,1-3H3,(H2,21,22,26)	PAQNCIRKVOBURI-UHFFFAOYSA-N	425.099846128							105739
SMR000077742	LSM-17102	SID4261459, BRD-K53680100	1299194	InChI=1S/C19H20N4O3S2/c1-3-23-17(15-6-5-11-27-15)21-22-19(23)28-12-16(24)20-14-9-7-13(8-10-14)18(25)26-4-2/h5-11H,3-4,12H2,1-2H3,(H,20,24)	SJHXRRPFDDTNPC-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)CSc2nnc(c3cccs3)n2CC)cc1	BroadT	BRD-K53680100	BRD-K53680100-001-06-6	ChemBridge Corporation	7875496			CCOC(=O)c1ccc(NC(=O)CSc2nnc(-c3cccs3)n2CC)cc1	InChI=1S/C19H20N4O3S2/c1-3-23-17(15-6-5-11-27-15)21-22-19(23)28-12-16(24)20-14-9-7-13(8-10-14)18(25)26-4-2/h5-11H,3-4,12H2,1-2H3,(H,20,24)	SJHXRRPFDDTNPC-UHFFFAOYSA-N	416.09768192							105740
MLS000109722	LSM-17103	SID7972094, BRD-A87928000	2883391	InChI=1S/C15H19BrN2O/c1-9(2)7-11-13(15(11,3)4)14(19)18-12-6-5-10(16)8-17-12/h5-8,11,13H,1-4H3,(H,17,18,19)	AXIVSTHBJFCRNV-UHFFFAOYSA-N	CC(=CC1C(C(=O)Nc2ccc(Br)cn2)C1(C)C)C	BroadT	BRD-A87928000	BRD-A87928000-001-05-4	ChemBridge Corporation	6056563			CC(C)=CC1C(C(=O)Nc2ccc(Br)cn2)C1(C)C	InChI=1S/C15H19BrN2O/c1-9(2)7-11-13(15(11,3)4)14(19)18-12-6-5-10(16)8-17-12/h5-8,11,13H,1-4H3,(H,17,18,19)	AXIVSTHBJFCRNV-UHFFFAOYSA-N	322.068075848							105741
MLS000720377	LSM-17104	SID17514918, BRD-K78051552	4064212	InChI=1S/C23H14N2O3S/c26-18-13-20(28-19-10-3-1-8-16(18)19)22(27)24-15-7-5-6-14(12-15)23-25-17-9-2-4-11-21(17)29-23/h1-13H,(H,24,27)	BUJIYFGLGJNWSA-UHFFFAOYSA-N	O=C(Nc1cccc(c1)c2nc3ccccc3s2)C4=CC(=O)c5ccccc5O4	BroadT	BRD-K78051552	BRD-K78051552-001-05-6	Life Chemicals Inc.	F0725-0505			O=C(Nc1cccc(c1)-c1nc2ccccc2s1)c1cc(=O)c2ccccc2o1	InChI=1S/C23H14N2O3S/c26-18-13-20(28-19-10-3-1-8-16(18)19)22(27)24-15-7-5-6-14(12-15)23-25-17-9-2-4-11-21(17)29-23/h1-13H,(H,24,27)	BUJIYFGLGJNWSA-UHFFFAOYSA-N	398.072513018							105742
GNF-PF-5536	LSM-17105	GNF-PF-5536, SJ000066481, BRD-K04198384	5307102	InChI=1S/C14H14BrN5/c1-8-6-11(4-5-12(8)15)18-13-7-9(2)16-14-17-10(3)19-20(13)14/h4-7,18H,1-3H3	DJYOQJGWWQRCHG-UHFFFAOYSA-N	Cc1cc(Nc2ccc(Br)c(C)c2)n3nc(C)nc3n1	BroadT	BRD-K04198384	BRD-K04198384-001-04-1	ChemDiv Inc.	C301-0900			Cc1nc2nc(C)cc(Nc3ccc(Br)c(C)c3)n2n1	InChI=1S/C14H14BrN5/c1-8-6-11(4-5-12(8)15)18-13-7-9(2)16-14-17-10(3)19-20(13)14/h4-7,18H,1-3H3	DJYOQJGWWQRCHG-UHFFFAOYSA-N	331.043258098							105743
SMR000067948	LSM-17106	SID3717266, BRD-A88093547	2999930	InChI=1S/C22H25N3O3S2/c1-3-27-19-9-8-16(15(2)26)12-17(19)14-30-22-24-23-21(20-7-5-11-29-20)25(22)13-18-6-4-10-28-18/h5,7-9,11-12,18H,3-4,6,10,13-14H2,1-2H3	XNHXVLSNARLKHW-UHFFFAOYSA-N	CCOc1ccc(cc1CSc2nnc(c3cccs3)n2CC4CCCO4)C(=O)C	BroadT	BRD-A88093547	BRD-A88093547-001-05-6	Enamine Ltd.	T5331918			CCOc1ccc(cc1CSc1nnc(-c2cccs2)n1CC1CCCO1)C(C)=O	InChI=1S/C22H25N3O3S2/c1-3-27-19-9-8-16(15(2)26)12-17(19)14-30-22-24-23-21(20-7-5-11-29-20)25(22)13-18-6-4-10-28-18/h5,7-9,11-12,18H,3-4,6,10,13-14H2,1-2H3	XNHXVLSNARLKHW-UHFFFAOYSA-N	443.13373307							105744
(2,6-Dimethyl-quinolin-4-yl)-p-tolyl-amine	LSM-17107	SID47204451, BRD-K17680626	698987	InChI=1S/C18H18N2/c1-12-4-7-15(8-5-12)20-18-11-14(3)19-17-9-6-13(2)10-16(17)18/h4-11H,1-3H3,(H,19,20)	BNEVHZDJSBSDRX-UHFFFAOYSA-N	Cc1ccc(Nc2cc(C)nc3ccc(C)cc23)cc1	BroadT	BRD-K17680626	BRD-K17680626-001-05-8	Asinex Ltd.	BAS 01539805			Cc1ccc(Nc2cc(C)nc3ccc(C)cc23)cc1	InChI=1S/C18H18N2/c1-12-4-7-15(8-5-12)20-18-11-14(3)19-17-9-6-13(2)10-16(17)18/h4-11H,1-3H3,(H,19,20)	BNEVHZDJSBSDRX-UHFFFAOYSA-N	262.146998596							105745
MLS000715976	LSM-17108	SID24820398, SID87544553, BRD-K70551979	3152845	InChI=1S/C21H20N4O5/c1-10-16(19(26)24-22-10)18(17-11(2)23-25-20(17)27)15-8-7-14(30-15)12-5-4-6-13(9-12)21(28)29-3/h4-9,18H,1-3H3,(H2,22,24,26)(H2,23,25,27)	XHCYOXYTVCQWBK-UHFFFAOYSA-N	COC(=O)c1cccc(c1)c2oc(cc2)C(c3c(C)n[nH]c3O)c4c(C)n[nH]c4O	BroadT	BRD-K70551979	BRD-K70551979-001-08-2	Asinex Ltd.	BAS 05901102			COC(=O)c1cccc(c1)-c1ccc(o1)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O	InChI=1S/C21H20N4O5/c1-10-16(19(26)24-22-10)18(17-11(2)23-25-20(17)27)15-8-7-14(30-15)12-5-4-6-13(9-12)21(28)29-3/h4-9,18H,1-3H3,(H2,22,24,26)(H2,23,25,27)	XHCYOXYTVCQWBK-UHFFFAOYSA-N	408.14336978							105746
SMR000199530	LSM-17109	SID17414735, BRD-K46564899	1291921	InChI=1S/C23H18N4O5S/c1-32-18-12-8-16(9-13-18)21(28)25-26-22(29)19-4-2-3-5-20(19)24-23(26)33-14-15-6-10-17(11-7-15)27(30)31/h2-13H,14H2,1H3,(H,25,28)	LNHHUUBVHBPJRG-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NN2C(=Nc3ccccc3C2=O)SCc4ccc(cc4)[N+](=O)[O-]	BroadT	BRD-K46564899	BRD-K46564899-001-05-9	ChemBridge Corporation	7751933			COc1ccc(cc1)C(=O)Nn1c(SCc2ccc(cc2)[N+]([O-])=O)nc2ccccc2c1=O	InChI=1S/C23H18N4O5S/c1-32-18-12-8-16(9-13-18)21(28)25-26-22(29)19-4-2-3-5-20(19)24-23(26)33-14-15-6-10-17(11-7-15)27(30)31/h2-13H,14H2,1H3,(H,25,28)	LNHHUUBVHBPJRG-UHFFFAOYSA-N	462.099790406							105747
MLS000591819	LSM-43701	SID17514093, BRD-K06203014	950916	InChI=1S/C20H22N2O2/c23-20(11-8-17-4-2-1-3-5-17)21-19-9-6-18(7-10-19)16-22-12-14-24-15-13-22/h1-11H,12-16H2,(H,21,23)/b11-8+	PJSTUIZLMYTBTM-DHZHZOJOSA-N	O=C(Nc1ccc(CN2CCOCC2)cc1)\C=C\c3ccccc3	BroadT	BRD-K06203014	BRD-K06203014-001-05-2	InterBioScreen Ltd.	STOCK3S-57319			O=C(Nc1ccc(CN2CCOCC2)cc1)\C=C\c1ccccc1	InChI=1S/C20H22N2O2/c23-20(11-8-17-4-2-1-3-5-17)21-19-9-6-18(7-10-19)16-22-12-14-24-15-13-22/h1-11H,12-16H2,(H,21,23)/b11-8+	PJSTUIZLMYTBTM-DHZHZOJOSA-N	322.168127964							
MLS000048987	LSM-3185	BRD-K53566850, SID131465597, SID4263057, SID87544496	1542103	InChI=1S/C23H23ClN6/c1-17-4-2-3-5-21(17)28-10-12-29(13-11-28)22-20-14-27-30(23(20)26-16-25-22)15-18-6-8-19(24)9-7-18/h2-9,14,16H,10-13,15H2,1H3	ODKPRIUYEYROGE-UHFFFAOYSA-N	Cc1ccccc1N2CCN(CC2)c3ncnc4c3cnn4Cc5ccc(Cl)cc5	BroadT	BRD-K53566850	BRD-K53566850-001-05-1	ChemBridge Corporation	7652281			Cc1ccccc1N1CCN(CC1)c1ncnc2n(Cc3ccc(Cl)cc3)ncc12	InChI=1S/C23H23ClN6/c1-17-4-2-3-5-21(17)28-10-12-29(13-11-28)22-20-14-27-30(23(20)26-16-25-22)15-18-6-8-19(24)9-7-18/h2-9,14,16H,10-13,15H2,1H3	ODKPRIUYEYROGE-UHFFFAOYSA-N	418.167272506							92934
SMR000129565	LSM-43702	SID17401902, BRD-K24536086	6522725	InChI=1S/C21H15ClN2O5/c1-3-28-21(27)15-8-12(4-6-17(15)22)18-7-5-13(29-18)9-14-11(2)16(10-23)20(26)24-19(14)25/h4-9H,3H2,1-2H3,(H,24,25,26)/b14-9+	WJDZZRSELRBXOP-NTEUORMPSA-N	CCOC(=O)c1cc(ccc1Cl)c2oc(\C=C/3\C(=O)NC(=O)C(=C3C)C#N)cc2	BroadT	BRD-K24536086	BRD-K24536086-001-06-4	ChemDiv Inc.	4338-0998			CCOC(=O)c1cc(ccc1Cl)-c1ccc(\C=C2C(=O)NC(=O)C(C#N)=C\2C)o1	InChI=1S/C21H15ClN2O5/c1-3-28-21(27)15-8-12(4-6-17(15)22)18-7-5-13(29-18)9-14-11(2)16(10-23)20(26)24-19(14)25/h4-9H,3H2,1-2H3,(H,24,25,26)/b14-9+	WJDZZRSELRBXOP-NTEUORMPSA-N	410.06694931							
AP-970/42168135	LSM-15262	BRD-K71927270	2958651	InChI=1S/C23H32N2O3/c1-5-27-21-15-19(16-24-14-13-18-9-7-6-8-10-18)11-12-20(21)28-17-22(26)25-23(2,3)4/h6-12,15,24H,5,13-14,16-17H2,1-4H3,(H,25,26)	BYZUSZIWBZAANA-UHFFFAOYSA-N	CCOc1cc(CNCCc2ccccc2)ccc1OCC(=O)NC(C)(C)C	BroadT	BRD-K71927270	BRD-K71927270-003-05-1	ChemBridge Corporation	7848053		Cl	CCOc1cc(CNCCc2ccccc2)ccc1OCC(=O)NC(C)(C)C.Cl	InChI=1S/C23H32N2O3.ClH/c1-5-27-21-15-19(16-24-14-13-18-9-7-6-8-10-18)11-12-20(21)28-17-22(26)25-23(2,3)4;/h6-12,15,24H,5,13-14,16-17H2,1-4H3,(H,25,26);1H	NQEMOLIKLIKLEY-UHFFFAOYSA-N	384.241292904							103909, 103909
AK-968/41926677	LSM-17112	SID17505238, BRD-K00266682	1001423	InChI=1S/C15H11Cl2N3O3S2/c1-25(22,23)9-3-5-12-13(7-9)24-15(19-12)20-14(21)18-8-2-4-10(16)11(17)6-8/h2-7H,1H3,(H2,18,19,20,21)	RZIKUIXNAKQGGU-UHFFFAOYSA-N	CS(=O)(=O)c1ccc2nc(NC(=O)Nc3ccc(Cl)c(Cl)c3)sc2c1	BroadT	BRD-K00266682	BRD-K00266682-001-05-6	Asinex Ltd.	BAS 09521012			CS(=O)(=O)c1ccc2nc(NC(=O)Nc3ccc(Cl)c(Cl)c3)sc2c1	InChI=1S/C15H11Cl2N3O3S2/c1-25(22,23)9-3-5-12-13(7-9)24-15(19-12)20-14(21)18-8-2-4-10(16)11(17)6-8/h2-7H,1H3,(H2,18,19,20,21)	RZIKUIXNAKQGGU-UHFFFAOYSA-N	414.961888042							105750
AN-329/42613134	LSM-17113	SID22414177, BRD-K65400733	1226824	InChI=1S/C20H18N2O3S/c1-22(18-10-6-3-7-11-18)26(24,25)19-14-12-17(13-15-19)21-20(23)16-8-4-2-5-9-16/h2-15H,1H3,(H,21,23)	NGNZFFLJJPMBCG-UHFFFAOYSA-N	CN(c1ccccc1)S(=O)(=O)c2ccc(NC(=O)c3ccccc3)cc2	BroadT	BRD-K65400733	BRD-K65400733-001-05-2	Specs	AN-329/42613134			CN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1	InChI=1S/C20H18N2O3S/c1-22(18-10-6-3-7-11-18)26(24,25)19-14-12-17(13-15-19)21-20(23)16-8-4-2-5-9-16/h2-15H,1H3,(H,21,23)	NGNZFFLJJPMBCG-UHFFFAOYSA-N	366.103813146							105751
SMR000092243	LSM-17114	SID7967082, BRD-A99377200	5308612	InChI=1S/C20H23N5O2/c1-3-27-15-9-7-13(8-10-15)18-12-17(14-5-4-6-16(11-14)26-2)22-20-23-19(21)24-25(18)20/h4-11,17-18H,3,12H2,1-2H3,(H3,21,22,23,24)	RZZCFDFNICSWCA-UHFFFAOYSA-N	CCOc1ccc(cc1)C2CC(Nc3nc(N)nn23)c4cccc(OC)c4	BroadT	BRD-A99377200	BRD-A99377200-001-05-8	ChemDiv Inc.	6321-0478			CCOc1ccc(cc1)C1CC(Nc2nc(N)nn12)c1cccc(OC)c1	InChI=1S/C20H23N5O2/c1-3-27-15-9-7-13(8-10-15)18-12-17(14-5-4-6-16(11-14)26-2)22-20-23-19(21)24-25(18)20/h4-11,17-18H,3,12H2,1-2H3,(H3,21,22,23,24)	RZZCFDFNICSWCA-UHFFFAOYSA-N	365.185175026							105752
MLS000120577	LSM-17115	SID7968846, BRD-K96773131	900384	InChI=1S/C10H11BrO5/c1-15-8-3-6(4-12)2-7(11)10(8)16-5-9(13)14/h2-3,12H,4-5H2,1H3,(H,13,14)	VJXXDNCSRIIQSG-UHFFFAOYSA-N	COc1cc(CO)cc(Br)c1OCC(=O)O	BroadT	BRD-K96773131	BRD-K96773131-001-04-6	ChemDiv Inc.	6415-0130			COc1cc(CO)cc(Br)c1OCC(O)=O	InChI=1S/C10H11BrO5/c1-15-8-3-6(4-12)2-7(11)10(8)16-5-9(13)14/h2-3,12H,4-5H2,1H3,(H,13,14)	VJXXDNCSRIIQSG-UHFFFAOYSA-N	289.978986052							105753
SMR000078761	LSM-17116	SID4261221, BRD-A64728896	2963973	InChI=1S/C17H20N2O4S/c1-13(19-24(21,22)15-9-4-3-5-10-15)17(20)18-12-14-8-6-7-11-16(14)23-2/h3-11,13,19H,12H2,1-2H3,(H,18,20)	VXPWJDQRTSEQBX-UHFFFAOYSA-N	COc1ccccc1CNC(=O)C(C)NS(=O)(=O)c2ccccc2	BroadT	BRD-A64728896	BRD-A64728896-001-05-2	ChemBridge Corporation	7913354			COc1ccccc1CNC(=O)C(C)NS(=O)(=O)c1ccccc1	InChI=1S/C17H20N2O4S/c1-13(19-24(21,22)15-9-4-3-5-10-15)17(20)18-12-14-8-6-7-11-16(14)23-2/h3-11,13,19H,12H2,1-2H3,(H,18,20)	VXPWJDQRTSEQBX-UHFFFAOYSA-N	348.11437783							105754
ST4054026	LSM-17117	SID24800956, BRD-K72851839	563543	InChI=1S/C22H21N3O/c1-16-24-20-13-19(23-14-18-9-5-6-10-22(18)26)11-12-21(20)25(16)15-17-7-3-2-4-8-17/h2-13,23,26H,14-15H2,1H3	DNRQRIUQDVKUPF-UHFFFAOYSA-N	Cc1nc2cc(NCc3ccccc3O)ccc2n1Cc4ccccc4	BroadT	BRD-K72851839	BRD-K72851839-001-05-0	Asinex Ltd.	BAS 01403629			Cc1nc2cc(NCc3ccccc3O)ccc2n1Cc1ccccc1	InChI=1S/C22H21N3O/c1-16-24-20-13-19(23-14-18-9-5-6-10-22(18)26)11-12-21(20)25(16)15-17-7-3-2-4-8-17/h2-13,23,26H,14-15H2,1H3	DNRQRIUQDVKUPF-UHFFFAOYSA-N	343.168462322							105755
MLS-0351065.0001	LSM-1627	BRD-A53107311, SID85176632, SID99495588	3266419	InChI=1S/C26H23ClN2O6S/c1-14(2)35-25(33)22-15(3)28-26-29(23(22)17-6-8-18(27)9-7-17)24(32)20(36-26)12-16-4-10-19(11-5-16)34-13-21(30)31/h4-12,14,23H,13H2,1-3H3,(H,30,31)	IOSUGCLQHJKTCK-UHFFFAOYSA-N	CC(C)OC(=O)C1=C(C)N=C2SC(=Cc3ccc(OCC(=O)O)cc3)C(=O)N2C1c4ccc(Cl)cc4	BroadT	BRD-A53107311	BRD-A53107311-001-05-9	Specs	AN-648/15597772			CC(C)OC(=O)C1=C(C)N=c2sc(=Cc3ccc(OCC(O)=O)cc3)c(=O)n2C1c1ccc(Cl)cc1	InChI=1S/C26H23ClN2O6S/c1-14(2)35-25(33)22-15(3)28-26-29(23(22)17-6-8-18(27)9-7-17)24(32)20(36-26)12-16-4-10-19(11-5-16)34-13-21(30)31/h4-12,14,23H,13H2,1-3H3,(H,30,31)	IOSUGCLQHJKTCK-UHFFFAOYSA-N	526.096534876							91750
BDBM37839	LSM-17118	BRD-A55864685	91896354	InChI=1S/C24H26N4O4S/c1-15-5-3-7-27-19(16(2)25-23(15)27)21(29)18-20(17-6-4-14-33-17)28(24(31)22(18)30)9-8-26-10-12-32-13-11-26/h3-7,14,18,20H,8-13H2,1-2H3	JGBRHDKZFQXXSW-UHFFFAOYSA-N	Cc1cccn2c(C(=O)C3C(N(CCN4CCOCC4)C(=O)C3=O)c5cccs5)c(C)nc12	BroadT	BRD-A55864685	BRD-A55864685-001-06-9	InterBioScreen Ltd.	STOCK4S-58245			Cc1nc2c(C)cccn2c1C(=O)C1C(N(CCN2CCOCC2)C(=O)C1=O)c1cccs1	InChI=1S/C24H26N4O4S/c1-15-5-3-7-27-19(16(2)25-23(15)27)21(29)18-20(17-6-4-14-33-17)28(24(31)22(18)30)9-8-26-10-12-32-13-11-26/h3-7,14,18,20H,8-13H2,1-2H3	JGBRHDKZFQXXSW-UHFFFAOYSA-N	466.167476042							105756
MLS000063031	LSM-17119	SID4256827, BRD-K28743880	753142	InChI=1S/C12H9F3N2O/c1-7-5-6-8-3-2-4-9(10(8)16-7)17-11(18)12(13,14)15/h2-6H,1H3,(H,17,18)	OQPXWXNHOKPRTE-UHFFFAOYSA-N	Cc1ccc2cccc(NC(=O)C(F)(F)F)c2n1	BroadT	BRD-K28743880	BRD-K28743880-001-06-0	ChemBridge Corporation	7249418			Cc1ccc2cccc(NC(=O)C(F)(F)F)c2n1	InChI=1S/C12H9F3N2O/c1-7-5-6-8-3-2-4-9(10(8)16-7)17-11(18)12(13,14)15/h2-6H,1H3,(H,17,18)	OQPXWXNHOKPRTE-UHFFFAOYSA-N	254.066697528							105757
AN-648/40963359	LSM-17120	SID17508525, BRD-K68627737	1018666	InChI=1S/C20H23N3O3S/c1-25-17-10-5-14(13-18(17)26-2)19(24)22-20(27)21-15-6-8-16(9-7-15)23-11-3-4-12-23/h5-10,13H,3-4,11-12H2,1-2H3,(H2,21,22,24,27)	CTTNARFRMBYYMU-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)NC(=S)Nc2ccc(cc2)N3CCCC3	BroadT	BRD-K68627737	BRD-K68627737-001-05-3	Asinex Ltd.	BAS 03602441			COc1ccc(cc1OC)C(=O)NC(=S)Nc1ccc(cc1)N1CCCC1	InChI=1S/C20H23N3O3S/c1-25-17-10-5-14(13-18(17)26-2)19(24)22-20(27)21-15-6-8-16(9-7-15)23-11-3-4-12-23/h5-10,13H,3-4,11-12H2,1-2H3,(H2,21,22,24,27)	CTTNARFRMBYYMU-UHFFFAOYSA-N	385.146012316							105758
MLS000516892	LSM-17121	SID24830583, BRD-K01370799	2089384	InChI=1S/C17H25ClN4O2/c1-17(2,3)20-16(24)19-15(23)12-21-7-9-22(10-8-21)14-6-4-5-13(18)11-14/h4-6,11H,7-10,12H2,1-3H3,(H2,19,20,23,24)	DFEKTQJALPKHPK-UHFFFAOYSA-N	CC(C)(C)NC(=O)NC(=O)CN1CCN(CC1)c2cccc(Cl)c2	BroadT	BRD-K01370799	BRD-K01370799-001-05-5	Enamine Ltd.	T5269106			CC(C)(C)NC(=O)NC(=O)CN1CCN(CC1)c1cccc(Cl)c1	InChI=1S/C17H25ClN4O2/c1-17(2,3)20-16(24)19-15(23)12-21-7-9-22(10-8-21)14-6-4-5-13(18)11-14/h4-6,11H,7-10,12H2,1-3H3,(H2,19,20,23,24)	DFEKTQJALPKHPK-UHFFFAOYSA-N	352.16660379							105759
MLS000033109	LSM-17122	SID846500, BRD-K84605058	648892	InChI=1S/C16H17N3/c1-11-7-12(2)14-9-13(10-17)16(18-15(14)8-11)19-5-3-4-6-19/h7-9H,3-6H2,1-2H3	BSMAHAWQWXPQEX-UHFFFAOYSA-N	Cc1cc(C)c2cc(C#N)c(nc2c1)N3CCCC3	BroadT	BRD-K84605058	BRD-K84605058-001-04-3	Asinex Ltd.	ASN 05814881			Cc1cc(C)c2cc(C#N)c(nc2c1)N1CCCC1	InChI=1S/C16H17N3/c1-11-7-12(2)14-9-13(10-17)16(18-15(14)8-11)19-5-3-4-6-19/h7-9H,3-6H2,1-2H3	BSMAHAWQWXPQEX-UHFFFAOYSA-N	251.142247574							105760
T0513-2819	LSM-43703	SID22403037, BRD-K50932361	2380760	InChI=1S/C19H18ClNO5/c1-24-15-9-14(10-16(11-15)25-2)21-18(22)12-26-19(23)8-7-13-5-3-4-6-17(13)20/h3-11H,12H2,1-2H3,(H,21,22)/b8-7+	USMFYGVQQHCJMK-BQYQJAHWSA-N	COc1cc(NC(=O)COC(=O)\C=C\c2ccccc2Cl)cc(OC)c1	BroadT	BRD-K50932361	BRD-K50932361-001-05-0	Enamine Ltd.	T0513-2819			COc1cc(NC(=O)COC(=O)\C=C\c2ccccc2Cl)cc(OC)c1	InChI=1S/C19H18ClNO5/c1-24-15-9-14(10-16(11-15)25-2)21-18(22)12-26-19(23)8-7-13-5-3-4-6-17(13)20/h3-11H,12H2,1-2H3,(H,21,22)/b8-7+	USMFYGVQQHCJMK-BQYQJAHWSA-N	375.087350396							
28045-90-1	LSM-17124	SID7977722, BRD-K61367931	179503	InChI=1S/C11H9ClO3/c1-6-8-4-3-7(14-2)5-9(8)15-11(13)10(6)12/h3-5H,1-2H3	AEMKPSYXSVLTAJ-UHFFFAOYSA-N	COc1ccc2C(=C(Cl)C(=O)Oc2c1)C	BroadT	BRD-K61367931	BRD-K61367931-001-05-7	ChemBridge Corporation	6091855			COc1ccc2c(C)c(Cl)c(=O)oc2c1	InChI=1S/C11H9ClO3/c1-6-8-4-3-7(14-2)5-9(8)15-11(13)10(6)12/h3-5H,1-2H3	AEMKPSYXSVLTAJ-UHFFFAOYSA-N	224.024021858							105762
SMR000130190	LSM-17125	SID14737851, BRD-A76496972	4076815	InChI=1S/C27H25FN2O5/c1-33-13-12-30-25(17-6-8-18(28)9-7-17)24(20-4-2-3-5-21(20)27(30)32)26(31)29-19-10-11-22-23(16-19)35-15-14-34-22/h2-11,16,24-25H,12-15H2,1H3,(H,29,31)	YKILRQIFJMFKJA-UHFFFAOYSA-N	COCCN1C(C(C(=O)Nc2ccc3OCCOc3c2)c4ccccc4C1=O)c5ccc(F)cc5	BroadT	BRD-A76496972	BRD-A76496972-001-05-9	ChemDiv Inc.	C096-0728			COCCN1C(C(C(=O)Nc2ccc3OCCOc3c2)c2ccccc2C1=O)c1ccc(F)cc1	InChI=1S/C27H25FN2O5/c1-33-13-12-30-25(17-6-8-18(28)9-7-17)24(20-4-2-3-5-21(20)27(30)32)26(31)29-19-10-11-22-23(16-19)35-15-14-34-22/h2-11,16,24-25H,12-15H2,1H3,(H,29,31)	YKILRQIFJMFKJA-UHFFFAOYSA-N	476.17475012							105763
MLS001002287	LSM-17126	SID26670295, BRD-K70627229	2409301	InChI=1S/C18H23N3O5S3/c19-28(23,24)16-6-3-14(4-7-16)9-10-20-17(22)13-15-5-8-18(27-15)29(25,26)21-11-1-2-12-21/h3-8H,1-2,9-13H2,(H,20,22)(H2,19,23,24)	YJJPYTKHCZZEEE-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(CCNC(=O)Cc2ccc(s2)S(=O)(=O)N3CCCC3)cc1	BroadT	BRD-K70627229	BRD-K70627229-001-06-2	Enamine Ltd.	T0520-5954			NS(=O)(=O)c1ccc(CCNC(=O)Cc2ccc(s2)S(=O)(=O)N2CCCC2)cc1	InChI=1S/C18H23N3O5S3/c19-28(23,24)16-6-3-14(4-7-16)9-10-20-17(22)13-15-5-8-18(27-15)29(25,26)21-11-1-2-12-21/h3-8H,1-2,9-13H2,(H,20,22)(H2,19,23,24)	YJJPYTKHCZZEEE-UHFFFAOYSA-N	457.079982936							105764
MLS000687379	LSM-17127	SID24807760, BRD-K21230171	1147212	InChI=1S/C17H15N5O3S/c1-25-16(24)12-6-2-3-7-13(12)19-14(23)10-26-17-20-15(21-22-17)11-5-4-8-18-9-11/h2-9H,10H2,1H3,(H,19,23)(H,20,21,22)	RTQAQCXLYUVLAP-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)CSc2n[nH]c(n2)c3cccnc3	BroadT	BRD-K21230171	BRD-K21230171-001-05-5	Asinex Ltd.	ASN 01365721			COC(=O)c1ccccc1NC(=O)CSc1n[nH]c(n1)-c1cccnc1	InChI=1S/C17H15N5O3S/c1-25-16(24)12-6-2-3-7-13(12)19-14(23)10-26-17-20-15(21-22-17)11-5-4-8-18-9-11/h2-9H,10H2,1H3,(H,19,23)(H,20,21,22)	RTQAQCXLYUVLAP-UHFFFAOYSA-N	369.08956008							105765
SMR000177791	LSM-17128	SID17509088, BRD-K68076329	3144257	InChI=1S/C25H23N3O4S/c1-16-12-23(20-13-18(31-2)10-11-21(20)26-16)33-15-25(30)28-27-24(29)14-32-22-9-5-7-17-6-3-4-8-19(17)22/h3-13H,14-15H2,1-2H3,(H,27,29)(H,28,30)	AYRBRHAXEISWPQ-UHFFFAOYSA-N	COc1ccc2nc(C)cc(SCC(=O)NNC(=O)COc3cccc4ccccc34)c2c1	BroadT	BRD-K68076329	BRD-K68076329-001-05-7	Asinex Ltd.	BAS 02915140			COc1ccc2nc(C)cc(SCC(=O)NNC(=O)COc3cccc4ccccc34)c2c1	InChI=1S/C25H23N3O4S/c1-16-12-23(20-13-18(31-2)10-11-21(20)26-16)33-15-25(30)28-27-24(29)14-32-22-9-5-7-17-6-3-4-8-19(17)22/h3-13H,14-15H2,1-2H3,(H,27,29)(H,28,30)	AYRBRHAXEISWPQ-UHFFFAOYSA-N	461.140926936							105766
MLS000119951	LSM-17129	SID7966311, BRD-A63068258	5308150	InChI=1S/C23H25N3O5S/c27-22(24-19-9-5-7-16-6-1-2-8-18(16)19)15-26-20-11-10-17(14-21(20)31-23(26)28)32(29,30)25-12-3-4-13-25/h1-2,6,8,10-11,14,19H,3-5,7,9,12-13,15H2,(H,24,27)	ICTSJMZEXPICDD-UHFFFAOYSA-N	O=C(CN1C(=O)Oc2cc(ccc12)S(=O)(=O)N3CCCC3)NC4CCCc5ccccc45	BroadT	BRD-A63068258	BRD-A63068258-001-05-6	ChemDiv Inc.	C989-0499			O=C(Cn1c2ccc(cc2oc1=O)S(=O)(=O)N1CCCC1)NC1CCCc2ccccc12	InChI=1S/C23H25N3O5S/c27-22(24-19-9-5-7-16-6-1-2-8-18(16)19)15-26-20-11-10-17(14-21(20)31-23(26)28)32(29,30)25-12-3-4-13-25/h1-2,6,8,10-11,14,19H,3-5,7,9,12-13,15H2,(H,24,27)	ICTSJMZEXPICDD-UHFFFAOYSA-N	455.15149162							105767
SMR000196328	LSM-17130	SID17415650, BRD-K87049226	2914673	InChI=1S/C22H20N4OS/c1-22(2,3)20-25-26-21(28-20)24-19(27)16-13-18(14-9-5-4-6-10-14)23-17-12-8-7-11-15(16)17/h4-13H,1-3H3,(H,24,26,27)	KNVXXUYZHQCJPS-UHFFFAOYSA-N	CC(C)(C)c1nnc(NC(=O)c2cc(nc3ccccc23)c4ccccc4)s1	BroadT	BRD-K87049226	BRD-K87049226-001-06-3	ChemBridge Corporation	6806089			CC(C)(C)c1nnc(NC(=O)c2cc(nc3ccccc23)-c2ccccc2)s1	InChI=1S/C22H20N4OS/c1-22(2,3)20-25-26-21(28-20)24-19(27)16-13-18(14-9-5-4-6-10-14)23-17-12-8-7-11-15(16)17/h4-13H,1-3H3,(H,24,26,27)	KNVXXUYZHQCJPS-UHFFFAOYSA-N	388.13578199							105768
AC1P15ON	LSM-43704	SID22413300, BRD-K10760636	8185635	InChI=1S/C21H23N3O2/c1-4-23(5-2)21-22-19(15-16-11-13-18(26-3)14-12-16)20(25)24(21)17-9-7-6-8-10-17/h6-15H,4-5H2,1-3H3/b19-15-	IZAHLKFCTZZZKP-CYVLTUHYSA-N	CCN(CC)C1=N\C(=C/c2ccc(OC)cc2)\C(=O)N1c3ccccc3	BroadT	BRD-K10760636	BRD-K10760636-001-05-3	Specs	AO-294/40960007			CCN(CC)C1=N\C(=C/c2ccc(OC)cc2)C(=O)N1c1ccccc1	InChI=1S/C21H23N3O2/c1-4-23(5-2)21-22-19(15-16-11-13-18(26-3)14-12-16)20(25)24(21)17-9-7-6-8-10-17/h6-15H,4-5H2,1-3H3/b19-15-	IZAHLKFCTZZZKP-CYVLTUHYSA-N	349.179027006							
SMR000201380	LSM-17132	SID17413832, BRD-K18408518	1255242	InChI=1S/C25H26ClN3O4/c1-17-14-21(15-18(2)24(17)26)33-16-23(30)27-19-5-7-20(8-6-19)28-9-11-29(12-10-28)25(31)22-4-3-13-32-22/h3-8,13-15H,9-12,16H2,1-2H3,(H,27,30)	KSVBHJHFVTUERS-UHFFFAOYSA-N	Cc1cc(OCC(=O)Nc2ccc(cc2)N3CCN(CC3)C(=O)c4occc4)cc(C)c1Cl	BroadT	BRD-K18408518	BRD-K18408518-001-05-4	ChemBridge Corporation	7968591			Cc1cc(OCC(=O)Nc2ccc(cc2)N2CCN(CC2)C(=O)c2ccco2)cc(C)c1Cl	InChI=1S/C25H26ClN3O4/c1-17-14-21(15-18(2)24(17)26)33-16-23(30)27-19-5-7-20(8-6-19)28-9-11-29(12-10-28)25(31)22-4-3-13-32-22/h3-8,13-15H,9-12,16H2,1-2H3,(H,27,30)	KSVBHJHFVTUERS-UHFFFAOYSA-N	467.161184052							105770
ZINC01797598	LSM-17133	SID7972781, BRD-K84427671	1583751	InChI=1S/C19H22O5/c1-3-4-8-22-17(20)11-23-15-9-12(2)10-16-18(15)13-6-5-7-14(13)19(21)24-16/h9-10H,3-8,11H2,1-2H3	QCSMTHWMEKZWDK-UHFFFAOYSA-N	CCCCOC(=O)COc1cc(C)cc2OC(=O)C3=C(CCC3)c12	BroadT	BRD-K84427671	BRD-K84427671-001-05-6	ChemBridge Corporation	6165276			CCCCOC(=O)COc1cc(C)cc2oc(=O)c3CCCc3c12	InChI=1S/C19H22O5/c1-3-4-8-22-17(20)11-23-15-9-12(2)10-16-18(15)13-6-5-7-14(13)19(21)24-16/h9-10H,3-8,11H2,1-2H3	QCSMTHWMEKZWDK-UHFFFAOYSA-N	330.146723804							105771
MLS001018029	LSM-17134	SID24828936, SID85753061, BRD-A30776477	2910188	InChI=1S/C13H18N2OS2/c1-2-10-6-3-4-8-15(10)13(17)14-12(16)11-7-5-9-18-11/h5,7,9-10H,2-4,6,8H2,1H3,(H,14,16,17)	OVEHKGROSRNRCP-UHFFFAOYSA-N	CCC1CCCCN1C(=S)NC(=O)c2cccs2	BroadT	BRD-A30776477	BRD-A30776477-001-04-2	Enamine Ltd.	T0507-7513			CCC1CCCCN1C(=S)NC(=O)c1cccs1	InChI=1S/C13H18N2OS2/c1-2-10-6-3-4-8-15(10)13(17)14-12(16)11-7-5-9-18-11/h5,7,9-10H,2-4,6,8H2,1H3,(H,14,16,17)	OVEHKGROSRNRCP-UHFFFAOYSA-N	282.086054596							105772
MLS000755612	LSM-17135	SID24822366, BRD-K71520299	16195261	InChI=1S/C23H24F3N3O/c1-30-20-7-5-17(6-8-20)21-14-22(28-27-21)18-9-11-29(12-10-18)15-16-3-2-4-19(13-16)23(24,25)26/h2-8,13-14,18H,9-12,15H2,1H3,(H,27,28)	LISDNWVPJBZAES-UHFFFAOYSA-N	COc1ccc(cc1)c2cc([nH]n2)C3CCN(Cc4cccc(c4)C(F)(F)F)CC3	BroadT	BRD-K71520299	BRD-K71520299-001-08-9	Key Organics Ltd.	9X-0018			COc1ccc(cc1)-c1cc([nH]n1)C1CCN(Cc2cccc(c2)C(F)(F)F)CC1	InChI=1S/C23H24F3N3O/c1-30-20-7-5-17(6-8-20)21-14-22(28-27-21)18-9-11-29(12-10-18)15-16-3-2-4-19(13-16)23(24,25)26/h2-8,13-14,18H,9-12,15H2,1H3,(H,27,28)	LISDNWVPJBZAES-UHFFFAOYSA-N	415.187147018							105773
(3,4-Dihydro-2H-naphthalen-1-ylideneamino) 4-fluorobenzoate	LSM-17136	BRD-K13442385	1489353	InChI=1S/C17H14FNO2/c18-14-10-8-13(9-11-14)17(20)21-19-16-7-3-5-12-4-1-2-6-15(12)16/h1-2,4,6,8-11H,3,5,7H2	DLGPJPAZWZLENV-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)ON=C2CCCc3ccccc23	BroadT	BRD-K13442385	BRD-K13442385-001-05-8	Key Organics Ltd.	9R-1174			Fc1ccc(cc1)C(=O)ON=C1CCCc2ccccc12	InChI=1S/C17H14FNO2/c18-14-10-8-13(9-11-14)17(20)21-19-16-7-3-5-12-4-1-2-6-15(12)16/h1-2,4,6,8-11H,3,5,7H2	DLGPJPAZWZLENV-UHFFFAOYSA-N	283.100856898							105774
AC1LJ3M9	LSM-17137	SID17512329, BRD-K42136676	916344	InChI=1S/C15H11N5O2S/c21-20(22)11-4-5-12-13(7-11)18-15(17-12)23-9-10-8-19-6-2-1-3-14(19)16-10/h1-8H,9H2,(H,17,18)	QPWFHSJJINRLMW-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2[nH]c(SCc3cn4ccccc4n3)nc2c1	BroadT	BRD-K42136676	BRD-K42136676-001-05-9	InterBioScreen Ltd.	STOCK1S-79607			[O-][N+](=O)c1ccc2[nH]c(SCc3cn4ccccc4n3)nc2c1	InChI=1S/C15H11N5O2S/c21-20(22)11-4-5-12-13(7-11)18-15(17-12)23-9-10-8-19-6-2-1-3-14(19)16-10/h1-8H,9H2,(H,17,18)	QPWFHSJJINRLMW-UHFFFAOYSA-N	325.063345332							105775
AC1M7RVK	LSM-17138	SID24836086, BRD-K72541630	2447555	InChI=1S/C19H22N2O3S/c1-24-18-13-16(25-2)7-8-17(18)19(23)21-11-9-20(10-12-21)14-3-5-15(22)6-4-14/h3-8,13,22H,9-12H2,1-2H3	PNBZQZXPNHSYHK-UHFFFAOYSA-N	COc1cc(SC)ccc1C(=O)N2CCN(CC2)c3ccc(O)cc3	BroadT	BRD-K72541630	BRD-K72541630-001-06-6	Enamine Ltd.	T0518-0768			COc1cc(SC)ccc1C(=O)N1CCN(CC1)c1ccc(O)cc1	InChI=1S/C19H22N2O3S/c1-24-18-13-16(25-2)7-8-17(18)19(23)21-11-9-20(10-12-21)14-3-5-15(22)6-4-14/h3-8,13,22H,9-12H2,1-2H3	PNBZQZXPNHSYHK-UHFFFAOYSA-N	358.135113274							105776
ZINC01128621	LSM-17139	SID24796441, BRD-K94087238	1304083	InChI=1S/C19H21N3O2S/c1-24-15-8-6-7-14(13-15)18(23)21-19(25)20-16-9-2-3-10-17(16)22-11-4-5-12-22/h2-3,6-10,13H,4-5,11-12H2,1H3,(H2,20,21,23,25)	YQJXMBLPZUBEAU-UHFFFAOYSA-N	COc1cccc(c1)C(=O)NC(=S)Nc2ccccc2N3CCCC3	BroadT	BRD-K94087238	BRD-K94087238-001-05-2	ChemBridge Corporation	7384123			COc1cccc(c1)C(=O)NC(=S)Nc1ccccc1N1CCCC1	InChI=1S/C19H21N3O2S/c1-24-15-8-6-7-14(13-15)18(23)21-19(25)20-16-9-2-3-10-17(16)22-11-4-5-12-22/h2-3,6-10,13H,4-5,11-12H2,1H3,(H2,20,21,23,25)	YQJXMBLPZUBEAU-UHFFFAOYSA-N	355.135447632							105777
AC1OEXMC	LSM-17140	SID7968272, BRD-K67301886	7064849	InChI=1S/C19H16N4O2/c1-25-16-11-13(7-8-15(16)24)18-19(21-14-5-3-2-4-6-14)23-10-9-20-12-17(23)22-18/h2-12,21,24H,1H3	KZMVPUIBSUVYJZ-UHFFFAOYSA-N	COc1cc(ccc1O)c2nc3cnccn3c2Nc4ccccc4	BroadT	BRD-K67301886	BRD-K67301886-001-04-8	ChemDiv Inc.	C169-0274			COc1cc(ccc1O)-c1nc2cnccn2c1Nc1ccccc1	InChI=1S/C19H16N4O2/c1-25-16-11-13(7-8-15(16)24)18-19(21-14-5-3-2-4-6-14)23-10-9-20-12-17(23)22-18/h2-12,21,24H,1H3	KZMVPUIBSUVYJZ-UHFFFAOYSA-N	332.127325792							
SMR000032901	LSM-17141	SID24839533, SID4247844, BRD-K70839485	3242000	InChI=1S/C22H23N3O5S/c1-2-25(16-6-4-3-5-7-16)31(28,29)17-8-9-20-18(14-17)21(26)19(15-23-20)22(27)24-10-12-30-13-11-24/h3-9,14-15H,2,10-13H2,1H3,(H,23,26)	FDOYZIRBMRGKPC-UHFFFAOYSA-N	CCN(c1ccccc1)S(=O)(=O)c2ccc3ncc(C(=O)N4CCOCC4)c(O)c3c2	BroadT	BRD-K70839485	BRD-K70839485-001-04-7	ChemDiv Inc.	K828-0107			CCN(c1ccccc1)S(=O)(=O)c1ccc2[nH]cc(C(=O)N3CCOCC3)c(=O)c2c1	InChI=1S/C22H23N3O5S/c1-2-25(16-6-4-3-5-7-16)31(28,29)17-8-9-20-18(14-17)21(26)19(15-23-20)22(27)24-10-12-30-13-11-24/h3-9,14-15H,2,10-13H2,1H3,(H,23,26)	FDOYZIRBMRGKPC-UHFFFAOYSA-N	441.135841556							105779
2B-011	LSM-43705	SID24824574, BRD-K67167793	5831999	InChI=1S/C8H9ClN4O2/c9-6-1-3-7(4-2-6)11-8(12-10)5-13(14)15/h1-5,11-12H,10H2/b8-5-	LTSHFFRMSMRSGJ-YVMONPNESA-N	NN\C(=C/[N+](=O)[O-])\Nc1ccc(Cl)cc1	BroadT	BRD-K67167793	BRD-K67167793-001-05-2	Key Organics Ltd.	2B-011			NN\C(Nc1ccc(Cl)cc1)=C/[N+]([O-])=O	InChI=1S/C8H9ClN4O2/c9-6-1-3-7(4-2-6)11-8(12-10)5-13(14)15/h1-5,11-12H,10H2/b8-5-	LTSHFFRMSMRSGJ-YVMONPNESA-N	228.041403278							
ZINC01130826	LSM-17143	SID47196317, BRD-K14849833	1305912	InChI=1S/C18H23N7O2/c1-13-6-7-14(25(26)27)12-15(13)19-16-20-17(23-8-2-3-9-23)22-18(21-16)24-10-4-5-11-24/h6-7,12H,2-5,8-11H2,1H3,(H,19,20,21,22)	OCWNPSSCQWGLKS-UHFFFAOYSA-N	Cc1ccc(cc1Nc2nc(nc(n2)N3CCCC3)N4CCCC4)[N+](=O)[O-]	BroadT	BRD-K14849833	BRD-K14849833-001-05-1	ChemBridge Corporation	7684175			Cc1ccc(cc1Nc1nc(nc(n1)N1CCCC1)N1CCCC1)[N+]([O-])=O	InChI=1S/C18H23N7O2/c1-13-6-7-14(25(26)27)12-15(13)19-16-20-17(23-8-2-3-9-23)22-18(21-16)24-10-4-5-11-24/h6-7,12H,2-5,8-11H2,1H3,(H,19,20,21,22)	OCWNPSSCQWGLKS-UHFFFAOYSA-N	369.191323046							105781
2-Chloro-n-[2-chloro-5-(methylsulfonyl)phenyl]acetamide	LSM-17144	SID24832489, BRD-K40599320	2566083	InChI=1S/C9H9Cl2NO3S/c1-16(14,15)6-2-3-7(11)8(4-6)12-9(13)5-10/h2-4H,5H2,1H3,(H,12,13)	QDGLPAWGHCOJBG-UHFFFAOYSA-N	CS(=O)(=O)c1ccc(Cl)c(NC(=O)CCl)c1	BroadT	BRD-K40599320	BRD-K40599320-001-05-0	Enamine Ltd.	T5302596			CS(=O)(=O)c1ccc(Cl)c(NC(=O)CCl)c1	InChI=1S/C9H9Cl2NO3S/c1-16(14,15)6-2-3-7(11)8(4-6)12-9(13)5-10/h2-4H,5H2,1H3,(H,12,13)	QDGLPAWGHCOJBG-UHFFFAOYSA-N	280.968019268							105782
4-(1,3-Benzothiazol-2-yl)-n-phenylpiperazine-1-carboxamide	LSM-17145	SID4261724, BRD-K36873153	888783	InChI=1S/C18H18N4OS/c23-17(19-14-6-2-1-3-7-14)21-10-12-22(13-11-21)18-20-15-8-4-5-9-16(15)24-18/h1-9H,10-13H2,(H,19,23)	ZPSAXOLPNUDKFO-UHFFFAOYSA-N	O=C(Nc1ccccc1)N2CCN(CC2)c3nc4ccccc4s3	BroadT	BRD-K36873153	BRD-K36873153-001-05-7	ChemBridge Corporation	7361860			O=C(Nc1ccccc1)N1CCN(CC1)c1nc2ccccc2s1	InChI=1S/C18H18N4OS/c23-17(19-14-6-2-1-3-7-14)21-10-12-22(13-11-21)18-20-15-8-4-5-9-16(15)24-18/h1-9H,10-13H2,(H,19,23)	ZPSAXOLPNUDKFO-UHFFFAOYSA-N	338.120131926							105783
30380-70-2	LSM-17146	SID14747146, BRD-A22596080	207650	InChI=1S/C13H15NO3/c15-12-8-11(13(16)17)9-14(12)7-6-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,16,17)	WXPXDXDHJYRETJ-UHFFFAOYSA-N	OC(=O)C1CN(CCc2ccccc2)C(=O)C1	BroadT	BRD-A22596080	BRD-A22596080-001-06-8	Enamine Ltd.	T5224601			OC(=O)C1CN(CCc2ccccc2)C(=O)C1	InChI=1S/C13H15NO3/c15-12-8-11(13(16)17)9-14(12)7-6-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,16,17)	WXPXDXDHJYRETJ-UHFFFAOYSA-N	233.10519335							105784
AC1MWQD8	LSM-17147	SID26658954, BRD-K83658602	3778296	InChI=1S/C21H29N3O4S/c1-4-5-8-27-20(25)17-16(22)15-13-11-21(2,3)28-12-14(13)18(23-19(15)29-17)24-6-9-26-10-7-24/h4-12,22H2,1-3H3	RZSOLLZIZJVIMQ-UHFFFAOYSA-N	CCCCOC(=O)c1sc2nc(N3CCOCC3)c4COC(C)(C)Cc4c2c1N	BroadT	BRD-K83658602	BRD-K83658602-001-05-1	InterBioScreen Ltd.	STOCK1S-77595			CCCCOC(=O)c1sc2nc(N3CCOCC3)c3COC(C)(C)Cc3c2c1N	InChI=1S/C21H29N3O4S/c1-4-5-8-27-20(25)17-16(22)15-13-11-21(2,3)28-12-14(13)18(23-19(15)29-17)24-6-9-26-10-7-24/h4-12,22H2,1-3H3	RZSOLLZIZJVIMQ-UHFFFAOYSA-N	419.187877128							105785
2-Cyano-3-{4-[(2,4-dimethyl-phenylcarbamoyl)-methoxy]-3-methoxy-phenyl}-acrylic acid ethyl ester	LSM-43706	SID17408614, BRD-K83317599	5443591	InChI=1S/C23H24N2O5/c1-5-29-23(27)18(13-24)11-17-7-9-20(21(12-17)28-4)30-14-22(26)25-19-8-6-15(2)10-16(19)3/h6-12H,5,14H2,1-4H3,(H,25,26)/b18-11-	CUTUECHMSUWIPQ-WQRHYEAKSA-N	CCOC(=O)\C(=C/c1ccc(OCC(=O)Nc2ccc(C)cc2C)c(OC)c1)\C#N	BroadT	BRD-K83317599	BRD-K83317599-001-05-9	Asinex Ltd.	BAS 01403426			CCOC(=O)C(=C/c1ccc(OCC(=O)Nc2ccc(C)cc2C)c(OC)c1)\C#N	InChI=1S/C23H24N2O5/c1-5-29-23(27)18(13-24)11-17-7-9-20(21(12-17)28-4)30-14-22(26)25-19-8-6-15(2)10-16(19)3/h6-12H,5,14H2,1-4H3,(H,25,26)/b18-11-	CUTUECHMSUWIPQ-WQRHYEAKSA-N	408.168521888							
SMR000048476	LSM-17149	SID24840942, SID865914, BRD-K67669791	667172	InChI=1S/C24H32FN7O3/c1-27-22-21(23(33)28(2)24(27)34)32(12-9-29-13-15-35-16-14-29)20(26-22)17-30-7-10-31(11-8-30)19-5-3-18(25)4-6-19/h3-6H,7-17H2,1-2H3	MGFKKCXGOOGLBK-UHFFFAOYSA-N	CN1C(=O)N(C)c2nc(CN3CCN(CC3)c4ccc(F)cc4)n(CCN5CCOCC5)c2C1=O	BroadT	BRD-K67669791	BRD-K67669791-001-05-9	InterBioScreen Ltd.	STOCK5S-54341			Cn1c2nc(CN3CCN(CC3)c3ccc(F)cc3)n(CCN3CCOCC3)c2c(=O)n(C)c1=O	InChI=1S/C24H32FN7O3/c1-27-22-21(23(33)28(2)24(27)34)32(12-9-29-13-15-35-16-14-29)20(26-22)17-30-7-10-31(11-8-30)19-5-3-18(25)4-6-19/h3-6H,7-17H2,1-2H3	MGFKKCXGOOGLBK-UHFFFAOYSA-N	485.255066154							105787
F0679-0491	LSM-17150	SID4244043, BRD-K54607456	3238700	InChI=1S/C21H18ClN5O2/c1-13-6-7-17(8-14(13)2)27-20-18(10-24-27)21(29)26(12-23-20)11-19(28)25-16-5-3-4-15(22)9-16/h3-10,12H,11H2,1-2H3,(H,25,28)	ZCWDKCQSVXFIKL-UHFFFAOYSA-N	Cc1ccc(cc1C)n2ncc3C(=O)N(CC(=O)Nc4cccc(Cl)c4)C=Nc23	BroadT	BRD-K54607456	BRD-K54607456-001-05-0	ChemDiv Inc.	C801-0497			Cc1ccc(cc1C)-n1ncc2c1ncn(CC(=O)Nc1cccc(Cl)c1)c2=O	InChI=1S/C21H18ClN5O2/c1-13-6-7-17(8-14(13)2)27-20-18(10-24-27)21(29)26(12-23-20)11-19(28)25-16-5-3-4-15(22)9-16/h3-10,12H,11H2,1-2H3,(H,25,28)	ZCWDKCQSVXFIKL-UHFFFAOYSA-N	407.114902576							105788
MLS001183661	LSM-17151	SID47202147, BRD-K54664947	3164616	InChI=1S/C16H18N4O2S/c1-8-12(15(21)19-17-8)14(13-9(2)18-20-16(13)22)10-4-6-11(23-3)7-5-10/h4-7,14H,1-3H3,(H2,17,19,21)(H2,18,20,22)	BQFAVSLKHODAPH-UHFFFAOYSA-N	CSc1ccc(cc1)C(c2c(C)n[nH]c2O)c3c(C)n[nH]c3O	BroadT	BRD-K54664947	BRD-K54664947-001-07-4	Vitas-M Laboratory Ltd.	STK119185			CSc1ccc(cc1)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O	InChI=1S/C16H18N4O2S/c1-8-12(15(21)19-17-8)14(13-9(2)18-20-16(13)22)10-4-6-11(23-3)7-5-10/h4-7,14H,1-3H3,(H2,17,19,21)(H2,18,20,22)	BQFAVSLKHODAPH-UHFFFAOYSA-N	330.115046546							105789
F2019-1563	LSM-15263	BRD-K22074945	24892011	InChI=1S/C18H18N4O6S/c1-20(2)6-3-7-21(17(23)12-4-5-16(28-12)22(24)25)18-19-11-8-13-14(27-10-26-13)9-15(11)29-18/h4-5,8-9H,3,6-7,10H2,1-2H3	VDBQQWBAIAAYEY-UHFFFAOYSA-N	CN(C)CCCN(C(=O)c1oc(cc1)[N+](=O)[O-])c2nc3cc4OCOc4cc3s2	BroadT	BRD-K22074945	BRD-K22074945-003-05-7	Life Chemicals Inc.	F2019-1563		Cl	CN(C)CCCN(C(=O)c1ccc(o1)[N+]([O-])=O)c1nc2cc3OCOc3cc2s1.Cl	InChI=1S/C18H18N4O6S.ClH/c1-20(2)6-3-7-21(17(23)12-4-5-16(28-12)22(24)25)18-19-11-8-13-14(27-10-26-13)9-15(11)29-18;/h4-5,8-9H,3,6-7,10H2,1-2H3;1H	RXEUGJAYNMHBLV-UHFFFAOYSA-N	418.094705026							103910, 103910
SMR000170911	LSM-17152	SID17507169, BRD-K53099217	1142088	InChI=1S/C28H25N3O5S/c1-17-7-9-22-19(11-17)13-20(26(32)29-22)15-31(14-18-8-10-24-25(12-18)36-16-35-24)28(37)30-23-6-4-3-5-21(23)27(33)34-2/h3-13H,14-16H2,1-2H3,(H,29,32)(H,30,37)	JEPRCTSVMYRURE-UHFFFAOYSA-N	COC(=O)c1ccccc1N=C(S)N(Cc2ccc3OCOc3c2)Cc4cc5cc(C)ccc5nc4O	BroadT	BRD-K53099217	BRD-K53099217-001-05-1	Asinex Ltd.	ASN 03580420			COC(=O)c1ccccc1N=C(S)N(Cc1ccc2OCOc2c1)Cc1cc2cc(C)ccc2nc1O	InChI=1S/C28H25N3O5S/c1-17-7-9-22-19(11-17)13-20(26(32)29-22)15-31(14-18-8-10-24-25(12-18)36-16-35-24)28(37)30-23-6-4-3-5-21(23)27(33)34-2/h3-13H,14-16H2,1-2H3,(H,29,32)(H,30,37)	JEPRCTSVMYRURE-UHFFFAOYSA-N	515.15149162							105790
MLS000710230	LSM-17153	SID24804632, BRD-K14069831	1090230	InChI=1S/C17H19N7OS/c1-10-8-11(2)20-17(19-10)26-9-14-22-15(18)24-16(23-14)21-12-4-6-13(25-3)7-5-12/h4-8H,9H2,1-3H3,(H3,18,21,22,23,24)	FAZQXFHJCJLUCY-UHFFFAOYSA-N	COc1ccc(Nc2nc(N)nc(CSc3nc(C)cc(C)n3)n2)cc1	BroadT	BRD-K14069831	BRD-K14069831-001-08-2	Asinex Ltd.	BAS 07529034			COc1ccc(cc1)Nc1nc(N)nc(CSc2nc(C)cc(C)n2)n1	InChI=1S/C17H19N7OS/c1-10-8-11(2)20-17(19-10)26-9-14-22-15(18)24-16(23-14)21-12-4-6-13(25-3)7-5-12/h4-8H,9H2,1-3H3,(H3,18,21,22,23,24)	FAZQXFHJCJLUCY-UHFFFAOYSA-N	369.137178988							105791
MLS000730812	LSM-43707	SID24812546, BRD-K13284741	16193700	InChI=1S/C21H22N2O3/c1-3-4-13-22-20(24)16-11-9-15(10-12-16)14-19-21(25)23(2)17-7-5-6-8-18(17)26-19/h5-12,14H,3-4,13H2,1-2H3,(H,22,24)/b19-14-	DGNNHNNFOVKMGM-RGEXLXHISA-N	CCCCNC(=O)c1ccc(\C=C\2/Oc3ccccc3N(C)C2=O)cc1	BroadT	BRD-K13284741	BRD-K13284741-001-05-3	ChemDiv Inc.	C307-0757			CCCCNC(=O)c1ccc(cc1)\C=C1/Oc2ccccc2N(C)C1=O	InChI=1S/C21H22N2O3/c1-3-4-13-22-20(24)16-11-9-15(10-12-16)14-19-21(25)23(2)17-7-5-6-8-18(17)26-19/h5-12,14H,3-4,13H2,1-2H3,(H,22,24)/b19-14-	DGNNHNNFOVKMGM-RGEXLXHISA-N	350.163042584							
ZINC00316745	LSM-17155	SID24807867, BRD-K34381341	806702	InChI=1S/C15H18N2OS/c18-14(10-11-6-2-1-3-7-11)17-15-16-12-8-4-5-9-13(12)19-15/h4-5,8-9,11H,1-3,6-7,10H2,(H,16,17,18)	OAAOZGZZBCUXNT-UHFFFAOYSA-N	O=C(CC1CCCCC1)Nc2nc3ccccc3s2	BroadT	BRD-K34381341	BRD-K34381341-001-06-4	Asinex Ltd.	BAS 04087146			O=C(CC1CCCCC1)Nc1nc2ccccc2s1	InChI=1S/C15H18N2OS/c18-14(10-11-6-2-1-3-7-11)17-15-16-12-8-4-5-9-13(12)19-15/h4-5,8-9,11H,1-3,6-7,10H2,(H,16,17,18)	OAAOZGZZBCUXNT-UHFFFAOYSA-N	274.113983906							105793
T5343137	LSM-17156	SID24791400, BRD-K09558187	4840994	InChI=1S/C23H23N3O9S/c1-3-33-23(30)26-17-6-9-19-15(10-21(28)35-20(19)11-17)13-34-22(29)12-24-36(31,32)18-7-4-16(5-8-18)25-14(2)27/h4-11,24H,3,12-13H2,1-2H3,(H,25,27)(H,26,30)	YJIHSOBMJMONDK-UHFFFAOYSA-N	CCOC(=O)Nc1ccc2C(=CC(=O)Oc2c1)COC(=O)CNS(=O)(=O)c3ccc(NC(=O)C)cc3	BroadT	BRD-K09558187	BRD-K09558187-001-05-7	Enamine Ltd.	T5343137			CCOC(=O)Nc1ccc2c(COC(=O)CNS(=O)(=O)c3ccc(NC(C)=O)cc3)cc(=O)oc2c1	InChI=1S/C23H23N3O9S/c1-3-33-23(30)26-17-6-9-19-15(10-21(28)35-20(19)11-17)13-34-22(29)12-24-36(31,32)18-7-4-16(5-8-18)25-14(2)27/h4-11,24H,3,12-13H2,1-2H3,(H,25,27)(H,26,30)	YJIHSOBMJMONDK-UHFFFAOYSA-N	517.115500036							105794
4F-366S	LSM-17157	SID17410217, BRD-K37252557	1475806	InChI=1S/C16H12Cl2N4O2/c17-11-1-5-13(6-2-11)19-16(23)24-10-14-9-22(21-20-14)15-7-3-12(18)4-8-15/h1-9H,10H2,(H,19,23)	QAAYVSWZIXUNMU-UHFFFAOYSA-N	Clc1ccc(NC(=O)OCc2cn(nn2)c3ccc(Cl)cc3)cc1	BroadT	BRD-K37252557	BRD-K37252557-001-05-5	Key Organics Ltd.	4F-366S			Clc1ccc(NC(=O)OCc2cn(nn2)-c2ccc(Cl)cc2)cc1	InChI=1S/C16H12Cl2N4O2/c17-11-1-5-13(6-2-11)19-16(23)24-10-14-9-22(21-20-14)15-7-3-12(18)4-8-15/h1-9H,10H2,(H,19,23)	QAAYVSWZIXUNMU-UHFFFAOYSA-N	362.033731084							105795
MLS000046690	LSM-17158	SID24839443, SID4243862, BRD-A68701446	3238534	InChI=1S/C19H21F3N2O3S/c1-27-17-7-5-16(6-8-17)24-10-9-14(13-24)12-23-28(25,26)18-4-2-3-15(11-18)19(20,21)22/h2-8,11,14,23H,9-10,12-13H2,1H3	PWBXQAFXEBOSQR-UHFFFAOYSA-N	COc1ccc(cc1)N2CCC(CNS(=O)(=O)c3cccc(c3)C(F)(F)F)C2	BroadT	BRD-A68701446	BRD-A68701446-001-06-8	ChemDiv Inc.	K788-1254			COc1ccc(cc1)N1CCC(CNS(=O)(=O)c2cccc(c2)C(F)(F)F)C1	InChI=1S/C19H21F3N2O3S/c1-27-17-7-5-16(6-8-17)24-10-9-14(13-24)12-23-28(25,26)18-4-2-3-15(11-18)19(20,21)22/h2-8,11,14,23H,9-10,12-13H2,1H3	PWBXQAFXEBOSQR-UHFFFAOYSA-N	414.122497842							105796
STK213922	LSM-17159	SID14739477, BRD-A56274107	2977708	InChI=1S/C19H23NO3/c1-14-4-6-15(7-5-14)18-10-8-16(9-11-19(21)22)20(18)13-17-3-2-12-23-17/h4-8,10,17H,2-3,9,11-13H2,1H3,(H,21,22)	CVOOKNHJAWQSHA-UHFFFAOYSA-N	Cc1ccc(cc1)c2ccc(CCC(=O)O)n2CC3CCCO3	BroadT	BRD-A56274107	BRD-A56274107-001-06-0	ChemBridge Corporation	7969981			Cc1ccc(cc1)-c1ccc(CCC(O)=O)n1CC1CCCO1	InChI=1S/C19H23NO3/c1-14-4-6-15(7-5-14)18-10-8-16(9-11-19(21)22)20(18)13-17-3-2-12-23-17/h4-8,10,17H,2-3,9,11-13H2,1H3,(H,21,22)	CVOOKNHJAWQSHA-UHFFFAOYSA-N	313.167793606							105797
MLS000571034	LSM-17160	SID16952727, BRD-K84947247	2397841	InChI=1S/C16H22N2O2S/c1-16(2,3)12-4-6-13(7-5-12)20-10-8-14(19)18-15-17-9-11-21-15/h4-7H,8-11H2,1-3H3,(H,17,18,19)	XGJKKNLSCCQUEF-UHFFFAOYSA-N	CC(C)(C)c1ccc(OCCC(=O)NC2=NCCS2)cc1	BroadT	BRD-K84947247	BRD-K84947247-001-06-6	Enamine Ltd.	T0514-7730			CC(C)(C)c1ccc(OCCC(=O)NC2=NCCS2)cc1	InChI=1S/C16H22N2O2S/c1-16(2,3)12-4-6-13(7-5-12)20-10-8-14(19)18-15-17-9-11-21-15/h4-7H,8-11H2,1-3H3,(H,17,18,19)	XGJKKNLSCCQUEF-UHFFFAOYSA-N	306.140198654							131240
SMR000003162	LSM-17161	SID842548, BRD-K79957551	644818	InChI=1S/C10H9NOS2/c1-6-5-7(10(11)14-6)9(12)8-3-2-4-13-8/h2-5H,11H2,1H3	VHAZJILCIAUTIA-UHFFFAOYSA-N	Cc1cc(C(=O)c2cccs2)c(N)s1	BroadT	BRD-K79957551	BRD-K79957551-001-06-2	Asinex Ltd.	ASN 04364346			Cc1cc(C(=O)c2cccs2)c(N)s1	InChI=1S/C10H9NOS2/c1-6-5-7(10(11)14-6)9(12)8-3-2-4-13-8/h2-5H,11H2,1H3	VHAZJILCIAUTIA-UHFFFAOYSA-N	223.012555298							105800
436810-97-8	LSM-17162	SID849262, BRD-A57427373	651739	InChI=1S/C12H14N2O2S2/c1-17-7-6-9(11(15)16)14-12-13-8-4-2-3-5-10(8)18-12/h2-5,9H,6-7H2,1H3,(H,13,14)(H,15,16)	WQBVDLYLCFPUNZ-UHFFFAOYSA-N	CSCCC(Nc1nc2ccccc2s1)C(=O)O	BroadT	BRD-A57427373	BRD-A57427373-001-05-2	Asinex Ltd.	BAS 00280985			CSCCC(Nc1nc2ccccc2s1)C(O)=O	InChI=1S/C12H14N2O2S2/c1-17-7-6-9(11(15)16)14-12-13-8-4-2-3-5-10(8)18-12/h2-5,9H,6-7H2,1H3,(H,13,14)(H,15,16)	WQBVDLYLCFPUNZ-UHFFFAOYSA-N	282.049669088							105801
MLS001018296	LSM-17163	SID26657900, BRD-A37754097	3390694	InChI=1S/C8H11N5O4S/c9-7-6(13(14)15)8(11-4-10-7)12-5-1-2-18(16,17)3-5/h4-5H,1-3H2,(H3,9,10,11,12)	UTLVLTDCBRBJEC-UHFFFAOYSA-N	Nc1ncnc(NC2CCS(=O)(=O)C2)c1[N+](=O)[O-]	BroadT	BRD-A37754097	BRD-A37754097-001-06-7	Enamine Ltd.	T0501-4756			Nc1ncnc(NC2CCS(=O)(=O)C2)c1[N+]([O-])=O	InChI=1S/C8H11N5O4S/c9-7-6(13(14)15)8(11-4-10-7)12-5-1-2-18(16,17)3-5/h4-5H,1-3H2,(H3,9,10,11,12)	UTLVLTDCBRBJEC-UHFFFAOYSA-N	273.053174572							105802
T5518965	LSM-17164	SID49673126, BRD-K06767101	9113562	InChI=1S/C19H21NO3/c1-22-17-7-2-3-8-18(17)23-12-11-20-19(21)16-10-9-14-5-4-6-15(14)13-16/h2-3,7-10,13H,4-6,11-12H2,1H3,(H,20,21)	OILPCNOMAZOZLU-UHFFFAOYSA-N	COc1ccccc1OCCNC(=O)c2ccc3CCCc3c2	BroadT	BRD-K06767101	BRD-K06767101-001-05-0	Enamine Ltd.	T5518965			COc1ccccc1OCCNC(=O)c1ccc2CCCc2c1	InChI=1S/C19H21NO3/c1-22-17-7-2-3-8-18(17)23-12-11-20-19(21)16-10-9-14-5-4-6-15(14)13-16/h2-3,7-10,13H,4-6,11-12H2,1H3,(H,20,21)	OILPCNOMAZOZLU-UHFFFAOYSA-N	311.152143542							105803
BAS 00916466	LSM-43708	SID24780820, BRD-K92036736	5442100	InChI=1S/C21H17N3O3/c25-18-8-6-17(7-9-18)23-21(27)19(14-15-10-12-22-13-11-15)24-20(26)16-4-2-1-3-5-16/h1-14,25H,(H,23,27)(H,24,26)/b19-14+	RWNSARVYMMLJFT-XMHGGMMESA-N	Oc1ccc(NC(=O)\C(=C/c2ccncc2)\NC(=O)c3ccccc3)cc1	BroadT	BRD-K92036736	BRD-K92036736-001-05-8	Asinex Ltd.	BAS 00916466			Oc1ccc(NC(=O)C(\NC(=O)c2ccccc2)=C/c2ccncc2)cc1	InChI=1S/C21H17N3O3/c25-18-8-6-17(7-9-18)23-21(27)19(14-15-10-12-22-13-11-15)24-20(26)16-4-2-1-3-5-16/h1-14,25H,(H,23,27)(H,24,26)/b19-14+	RWNSARVYMMLJFT-XMHGGMMESA-N	359.126991434							
MLS000081107	LSM-43709	SID861653, BRD-K37052916	662891	InChI=1S/C22H20N4O2S/c23-12-17(22-24-18-3-1-2-4-21(18)29-22)14-26-9-7-25(8-10-26)13-16-5-6-19-20(11-16)28-15-27-19/h1-6,11,14H,7-10,13,15H2/b17-14+	BQPBTSDVGARJHD-SAPNQHFASA-N	N#C\C(=C/N1CCN(Cc2ccc3OCOc3c2)CC1)\c4nc5ccccc5s4	BroadT	BRD-K37052916	BRD-K37052916-001-07-1	InterBioScreen Ltd.	STOCK4S-15547			N#C\C(=C/N1CCN(Cc2ccc3OCOc3c2)CC1)c1nc2ccccc2s1	InChI=1S/C22H20N4O2S/c23-12-17(22-24-18-3-1-2-4-21(18)29-22)14-26-9-7-25(8-10-26)13-16-5-6-19-20(11-16)28-15-27-19/h1-6,11,14H,7-10,13,15H2/b17-14+	BQPBTSDVGARJHD-SAPNQHFASA-N	404.13069661							
3-Methoxy-9H-carbazole	LSM-17167	SID4245732, BRD-K89056926	519621	InChI=1S/C13H11NO/c1-15-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13/h2-8,14H,1H3	BISIQSCKDZYPLR-UHFFFAOYSA-N	COc1ccc2[nH]c3ccccc3c2c1	BroadT	BRD-K89056926	BRD-K89056926-001-05-1	ChemDiv Inc.	K815-0256			COc1ccc2[nH]c3ccccc3c2c1	InChI=1S/C13H11NO/c1-15-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13/h2-8,14H,1H3	BISIQSCKDZYPLR-UHFFFAOYSA-N	197.084063982							105806
F1300-0032	LSM-17168	SID24803378, BRD-K87918793	1079141	InChI=1S/C16H18N2O3S/c1-21-15(20)11-7-8-12-13(9-11)22-16(17-12)18-14(19)10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H,17,18,19)	QWGJMDUXYXQLKG-UHFFFAOYSA-N	COC(=O)c1ccc2nc(NC(=O)C3CCCCC3)sc2c1	BroadT	BRD-K87918793	BRD-K87918793-001-05-4	Asinex Ltd.	BAS 05289854			COC(=O)c1ccc2nc(NC(=O)C3CCCCC3)sc2c1	InChI=1S/C16H18N2O3S/c1-21-15(20)11-7-8-12-13(9-11)22-16(17-12)18-14(19)10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H,17,18,19)	QWGJMDUXYXQLKG-UHFFFAOYSA-N	318.103813146							105807
Phenazopyridine	LSM-3705	Phenazopyridine, BRD-K76304753	4756	InChI=1S/C11H11N5/c12-10-7-6-9(11(13)14-10)16-15-8-4-2-1-3-5-8/h1-7H,(H4,12,13,14)	QPFYXYFORQJZEC-UHFFFAOYSA-N	Nc1ccc(N=Nc2ccccc2)c(N)n1	BroadT	BRD-K76304753	BRD-K76304753-003-11-2	Prestwick Chemical Inc.	Prestw-752		Cl	Nc1ccc(\N=N\c2ccccc2)c(N)n1.Cl	InChI=1S/C11H11N5.ClH/c12-10-7-6-9(11(13)14-10)16-15-8-4-2-1-3-5-8;/h1-7H,(H4,12,13,14);1H/b16-15+;	QQBPIHBUCMDKFG-GEEYTBSJSA-N	213.101445402							71416, 71416
AC1OBK53	LSM-17169	BRD-K43637478	6824622	InChI=1S/C16H12N2O3/c1-10-5-4-8-14(18-10)17-9-12-15(19)11-6-2-3-7-13(11)21-16(12)20/h2-9,20H,1H3	CSOGDUZILGJWGR-UHFFFAOYSA-N	Cc1cccc(N=CC2=C(O)Oc3ccccc3C2=O)n1	BroadT	BRD-K43637478	BRD-K43637478-001-05-5	Enamine Ltd.	T0509-3987			Cc1cccc(N=Cc2c(O)oc3ccccc3c2=O)n1	InChI=1S/C16H12N2O3/c1-10-5-4-8-14(18-10)17-9-12-15(19)11-6-2-3-7-13(11)21-16(12)20/h2-9,20H,1H3	CSOGDUZILGJWGR-UHFFFAOYSA-N	280.084792264							
ASN 07184379	LSM-17170	SID842942, BRD-K82692617	645213	InChI=1S/C15H13N3O2S/c1-20-13(19)9-21-15-10(5-4-8-16-15)14-17-11-6-2-3-7-12(11)18-14/h2-8H,9H2,1H3,(H,17,18)	DNANXWGYBGVEIX-UHFFFAOYSA-N	COC(=O)CSc1ncccc1c2nc3ccccc3[nH]2	BroadT	BRD-K82692617	BRD-K82692617-001-05-4	Asinex Ltd.	ASN 07184379			COC(=O)CSc1ncccc1-c1nc2ccccc2[nH]1	InChI=1S/C15H13N3O2S/c1-20-13(19)9-21-15-10(5-4-8-16-15)14-17-11-6-2-3-7-12(11)18-14/h2-8H,9H2,1H3,(H,17,18)	DNANXWGYBGVEIX-UHFFFAOYSA-N	299.072847376							105809
MLS000759850	LSM-43710	SID26670689, BRD-K75791788	6903824	InChI=1S/C19H13N3O3S/c23-16-8-4-3-7-15(16)21-11-14-12-5-1-2-6-13(12)17(24)22(18(14)25)19-20-9-10-26-19/h1-11,21,23H/b14-11+	XAPNQRKVHUODFY-SDNWHVSQSA-N	Oc1ccccc1N\C=C/2\C(=O)N(C(=O)c3ccccc23)c4nccs4	BroadT	BRD-K75791788	BRD-K75791788-001-05-6	Enamine Ltd.	T0510-9405			Oc1ccccc1N\C=C1\C(=O)N(c2nccs2)C(=O)c2ccccc12	InChI=1S/C19H13N3O3S/c23-16-8-4-3-7-15(16)21-11-14-12-5-1-2-6-13(12)17(24)22(18(14)25)19-20-9-10-26-19/h1-11,21,23H/b14-11+	XAPNQRKVHUODFY-SDNWHVSQSA-N	363.067761996							
SMR000027340	LSM-17172	SID4250894, BRD-K58994826	3244648	InChI=1S/C18H16ClN3O/c19-13-7-9-14(10-8-13)22-17(23)15-5-1-2-6-16(15)20-18(22)21-11-3-4-12-21/h1-2,5-10H,3-4,11-12H2	WNAUAGDIWFTDRG-UHFFFAOYSA-N	Clc1ccc(cc1)N2C(=O)c3ccccc3N=C2N4CCCC4	BroadT	BRD-K58994826	BRD-K58994826-001-05-1	ChemDiv Inc.	C512-0039			Clc1ccc(cc1)-n1c(nc2ccccc2c1=O)N1CCCC1	InChI=1S/C18H16ClN3O/c19-13-7-9-14(10-8-13)22-17(23)15-5-1-2-6-16(15)20-18(22)21-11-3-4-12-21/h1-2,5-10H,3-4,11-12H2	WNAUAGDIWFTDRG-UHFFFAOYSA-N	325.098189872							105811
1-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-(4,6-dimethylpyrimidin-2-yl)guanidine	LSM-17173	SID24802336, BRD-K80024695	2193848	InChI=1S/C15H17N5O2/c1-9-7-10(2)18-15(17-9)20-14(16)19-11-3-4-12-13(8-11)22-6-5-21-12/h3-4,7-8H,5-6H2,1-2H3,(H3,16,17,18,19,20)	SLSZBZFKIKJGBE-UHFFFAOYSA-N	Cc1cc(C)nc(N=C(N)Nc2ccc3OCCOc3c2)n1	BroadT	BRD-K80024695	BRD-K80024695-001-06-5	Asinex Ltd.	BAS 06107461			Cc1cc(C)nc(N=C(N)Nc2ccc3OCCOc3c2)n1	InChI=1S/C15H17N5O2/c1-9-7-10(2)18-15(17-9)20-14(16)19-11-3-4-12-13(8-11)22-6-5-21-12/h3-4,7-8H,5-6H2,1-2H3,(H3,16,17,18,19,20)	SLSZBZFKIKJGBE-UHFFFAOYSA-N	299.138224834							105812
AC1MDS7U	LSM-17174	BRD-K60888337	2815985	InChI=1S/C22H15N7O2S2/c30-29(31)18-10-8-15(9-11-18)20-16(14-27(26-20)17-5-2-1-3-6-17)13-23-28-21(24-25-22(28)32)19-7-4-12-33-19/h1-14H,(H,25,32)	ARJQCZAEQUEAPX-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)c2nn(cc2C=Nn3c(S)nnc3c4cccs4)c5ccccc5	BroadT	BRD-K60888337	BRD-K60888337-001-05-3	Maybridge	HTS 11987			[O-][N+](=O)c1ccc(cc1)-c1nn(cc1C=Nn1c(S)nnc1-c1cccs1)-c1ccccc1	InChI=1S/C22H15N7O2S2/c30-29(31)18-10-8-15(9-11-18)20-16(14-27(26-20)17-5-2-1-3-6-17)13-23-28-21(24-25-22(28)32)19-7-4-12-33-19/h1-14H,(H,25,32)	ARJQCZAEQUEAPX-UHFFFAOYSA-N	473.07286417							105813
5-Nitro-2-phenyl-1,3-benzoxazole	LSM-17175	SID24810098, BRD-K17364938	759401	InChI=1S/C13H8N2O3/c16-15(17)10-6-7-12-11(8-10)14-13(18-12)9-4-2-1-3-5-9/h1-8H	PBRISAFILDFQFS-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2oc(nc2c1)c3ccccc3	BroadT	BRD-K17364938	BRD-K17364938-001-05-2	Asinex Ltd.	BAS 00015719			[O-][N+](=O)c1ccc2oc(nc2c1)-c1ccccc1	InChI=1S/C13H8N2O3/c16-15(17)10-6-7-12-11(8-10)14-13(18-12)9-4-2-1-3-5-9/h1-8H	PBRISAFILDFQFS-UHFFFAOYSA-N	240.053492136							105814
MLS000733108	LSM-17176	SID24780365, BRD-A95071916	16187374	InChI=1S/C20H27NOS/c1-16-6-3-4-7-18(16)12-20(15-22)10-5-11-21(14-20)13-19-9-8-17(2)23-19/h3-4,6-9,22H,5,10-15H2,1-2H3	FKESSBRNPVWFLH-UHFFFAOYSA-N	Cc1ccc(CN2CCCC(CO)(Cc3ccccc3C)C2)s1	BroadT	BRD-A95071916	BRD-A95071916-001-05-6	ChemBridge Corporation	86541979			Cc1ccc(CN2CCCC(CO)(Cc3ccccc3C)C2)s1	InChI=1S/C20H27NOS/c1-16-6-3-4-7-18(16)12-20(15-22)10-5-11-21(14-20)13-19-9-8-17(2)23-19/h3-4,6-9,22H,5,10-15H2,1-2H3	FKESSBRNPVWFLH-UHFFFAOYSA-N	329.181335184							105815
AC1N30HT	LSM-17177	SID24822921, BRD-K47785560	4079917	InChI=1S/C12H18N4O3S/c1-9-11(16(18)19)12(14-13-9)20-8-10(17)15-6-4-2-3-5-7-15/h2-8H2,1H3,(H,13,14)	SMOCXLQUTOULJW-UHFFFAOYSA-N	Cc1n[nH]c(SCC(=O)N2CCCCCC2)c1[N+](=O)[O-]	BroadT	BRD-K47785560	BRD-K47785560-001-05-7	ChemDiv Inc.	C226-4123			Cc1n[nH]c(SCC(=O)N2CCCCCC2)c1[N+]([O-])=O	InChI=1S/C12H18N4O3S/c1-9-11(16(18)19)12(14-13-9)20-8-10(17)15-6-4-2-3-5-7-15/h2-8H2,1H3,(H,13,14)	SMOCXLQUTOULJW-UHFFFAOYSA-N	298.109961166							105816
ZINC06283819	LSM-17178	SID24793867, BRD-K47020481	4282161	InChI=1S/C17H18N2O3/c1-12-6-8-13(9-7-12)17(21)18-11-16(20)19-14-4-3-5-15(10-14)22-2/h3-10H,11H2,1-2H3,(H,18,21)(H,19,20)	XRJPKMPRLKPPJI-UHFFFAOYSA-N	COc1cccc(NC(=O)CNC(=O)c2ccc(C)cc2)c1	BroadT	BRD-K47020481	BRD-K47020481-001-06-3	ChemBridge Corporation	9028484			COc1cccc(NC(=O)CNC(=O)c2ccc(C)cc2)c1	InChI=1S/C17H18N2O3/c1-12-6-8-13(9-7-12)17(21)18-11-16(20)19-14-4-3-5-15(10-14)22-2/h3-10H,11H2,1-2H3,(H,18,21)(H,19,20)	XRJPKMPRLKPPJI-UHFFFAOYSA-N	298.131742456							105817
AC1LDFJW	LSM-17179	SID864993, BRD-A15382395	666240	InChI=1S/C15H18N2O4S/c1-2-21-15(20)10-3-5-11(6-4-10)17-13(18)9-12-14(19)16-7-8-22-12/h3-6,12H,2,7-9H2,1H3,(H,16,19)(H,17,18)	FZNMSKOVKJFGGH-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)CC2SCCNC2=O)cc1	BroadT	BRD-A15382395	BRD-A15382395-001-06-2	InterBioScreen Ltd.	STOCK5S-33899			CCOC(=O)c1ccc(NC(=O)CC2SCCNC2=O)cc1	InChI=1S/C15H18N2O4S/c1-2-21-15(20)10-3-5-11(6-4-10)17-13(18)9-12-14(19)16-7-8-22-12/h3-6,12H,2,7-9H2,1H3,(H,16,19)(H,17,18)	FZNMSKOVKJFGGH-UHFFFAOYSA-N	322.098727766							105818
SMR000021903	LSM-17180	SID4242612, BRD-K07707853	3237444	InChI=1S/C17H14BrN3O3/c1-10-8-11(18)2-3-14(10)20-15(22)5-7-21-16(23)12-4-6-19-9-13(12)17(21)24/h2-4,6,8-9H,5,7H2,1H3,(H,20,22)	GUDHONOMDKCCHK-UHFFFAOYSA-N	Cc1cc(Br)ccc1NC(=O)CCN2C(=O)c3ccncc3C2=O	BroadT	BRD-K07707853	BRD-K07707853-001-05-5	ChemDiv Inc.	C086-0552			Cc1cc(Br)ccc1NC(=O)CCN1C(=O)c2ccncc2C1=O	InChI=1S/C17H14BrN3O3/c1-10-8-11(18)2-3-14(10)20-15(22)5-7-21-16(23)12-4-6-19-9-13(12)17(21)24/h2-4,6,8-9H,5,7H2,1H3,(H,20,22)	GUDHONOMDKCCHK-UHFFFAOYSA-N	387.021853938							105819
N-[(2,4-Dimethoxyphenyl)methylideneamino]-2-[2-[3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]acetamide	LSM-17181	BRD-K65886815	996619	InChI=1S/C21H19F3N4O3S/c1-30-17-7-6-13(18(10-17)31-2)11-25-28-19(29)9-16-12-32-20(27-16)26-15-5-3-4-14(8-15)21(22,23)24/h3-8,10-12H,9H2,1-2H3,(H,26,27)(H,28,29)	KEWQTTXJFFTKFZ-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)Cc2csc(Nc3cccc(c3)C(F)(F)F)n2)c(OC)c1	BroadT	BRD-K65886815	BRD-K65886815-001-05-3	Specs	AN-988/40680399			COc1ccc(C=NNC(=O)Cc2csc(Nc3cccc(c3)C(F)(F)F)n2)c(OC)c1	InChI=1S/C21H19F3N4O3S/c1-30-17-7-6-13(18(10-17)31-2)11-25-28-19(29)9-16-12-32-20(27-16)26-15-5-3-4-14(8-15)21(22,23)24/h3-8,10-12H,9H2,1-2H3,(H,26,27)(H,28,29)	KEWQTTXJFFTKFZ-UHFFFAOYSA-N	464.112995798							105820
AC1M43RN	LSM-3363	BRD-K61237522, BRD-K91047982	2275371	InChI=1S/C17H19N3O3/c1-12-5-6-15(13(2)10-12)19-16(21)7-8-17(22)20-18-11-14-4-3-9-23-14/h3-6,9-11H,7-8H2,1-2H3,(H,19,21)(H,20,22)	CSEQFIHKUHSYPC-UHFFFAOYSA-N	Cc1ccc(NC(=O)CCC(=O)NN=Cc2occc2)c(C)c1	BroadT	BRD-K61237522	BRD-K61237522-001-05-7	Broad Institute of MIT and Harvard	N-(2,4-dimethylphenyl)-4-[2-(2-furylmethylene)hydrazino]-4-oxobutanamide BRD-K91047982			Cc1ccc(NC(=O)CCC(=O)NN=Cc2ccco2)c(C)c1	InChI=1S/C17H19N3O3/c1-12-5-6-15(13(2)10-12)19-16(21)7-8-17(22)20-18-11-14-4-3-9-23-14/h3-6,9-11H,7-8H2,1-2H3,(H,19,21)(H,20,22)	CSEQFIHKUHSYPC-UHFFFAOYSA-N	313.142641498							93072
ZINC06669811	LSM-17182	SID49822943, BRD-K75439260	8034942	InChI=1S/C18H22N4O5/c1-21-13(10-16(24)22(2)18(21)26)11-20-15(23)7-8-19-17(25)12-5-4-6-14(9-12)27-3/h4-6,9-10H,7-8,11H2,1-3H3,(H,19,25)(H,20,23)	BDOBBVQFBBDHDZ-UHFFFAOYSA-N	COc1cccc(c1)C(=O)NCCC(=O)NCC2=CC(=O)N(C)C(=O)N2C	BroadT	BRD-K75439260	BRD-K75439260-001-05-9	InterBioScreen Ltd.	STOCK6S-08960			COc1cccc(c1)C(=O)NCCC(=O)NCc1cc(=O)n(C)c(=O)n1C	InChI=1S/C18H22N4O5/c1-21-13(10-16(24)22(2)18(21)26)11-20-15(23)7-8-19-17(25)12-5-4-6-14(9-12)27-3/h4-6,9-10H,7-8,11H2,1-3H3,(H,19,25)(H,20,23)	BDOBBVQFBBDHDZ-UHFFFAOYSA-N	374.159019844							105821
ST058801	LSM-17183	SID7965545, BRD-A49950516	3888788	InChI=1S/C18H18N2O4/c1-18(17(22)24-3)19-13-9-5-4-8-12(13)16(21)20(18)14-10-6-7-11-15(14)23-2/h4-11,19H,1-3H3	AUEJKAYMDPANCB-UHFFFAOYSA-N	COC(=O)C1(C)Nc2ccccc2C(=O)N1c3ccccc3OC	BroadT	BRD-A49950516	BRD-A49950516-001-04-5	ChemDiv Inc.	8015-0941			COC(=O)C1(C)Nc2ccccc2C(=O)N1c1ccccc1OC	InChI=1S/C18H18N2O4/c1-18(17(22)24-3)19-13-9-5-4-8-12(13)16(21)20(18)14-10-6-7-11-15(14)23-2/h4-11,19H,1-3H3	AUEJKAYMDPANCB-UHFFFAOYSA-N	326.126657076							105822
AC1NX6FN	LSM-43711	SID47202006, BRD-K48488834	5721692	InChI=1S/C21H23N3O4/c25-24(26)19-6-2-1-4-18(19)5-3-9-22-10-12-23(13-11-22)15-17-7-8-20-21(14-17)28-16-27-20/h1-8,14H,9-13,15-16H2/b5-3+	VQLQAWVTLLYPRG-HWKANZROSA-N	[O-][N+](=O)c1ccccc1\C=C\CN2CCN(Cc3ccc4OCOc4c3)CC2	BroadT	BRD-K48488834	BRD-K48488834-001-05-7	ChemBridge Corporation	5423232			[O-][N+](=O)c1ccccc1\C=C\CN1CCN(Cc2ccc3OCOc3c2)CC1	InChI=1S/C21H23N3O4/c25-24(26)19-6-2-1-4-18(19)5-3-9-22-10-12-23(13-11-22)15-17-7-8-20-21(14-17)28-16-27-20/h1-8,14H,9-13,15-16H2/b5-3+	VQLQAWVTLLYPRG-HWKANZROSA-N	381.168856246							
ST50639415	LSM-17185	SID4250063, BRD-A54209612	3243931	InChI=1S/C18H23NO5/c1-9-8-12-14(16(20)13(9)17(21)23-3)10(2)15(19-12)18(22)24-11-6-4-5-7-11/h9,11,13,19H,4-8H2,1-3H3	DJLGSTKNGBXRSF-UHFFFAOYSA-N	COC(=O)C1C(C)Cc2[nH]c(C(=O)OC3CCCC3)c(C)c2C1=O	BroadT	BRD-A54209612	BRD-A54209612-001-05-8	ChemDiv Inc.	C276-0473			COC(=O)C1C(C)Cc2[nH]c(C(=O)OC3CCCC3)c(C)c2C1=O	InChI=1S/C18H23NO5/c1-9-8-12-14(16(20)13(9)17(21)23-3)10(2)15(19-12)18(22)24-11-6-4-5-7-11/h9,11,13,19H,4-8H2,1-3H3	DJLGSTKNGBXRSF-UHFFFAOYSA-N	333.157622846							105824
AE-641/30155016	LSM-15264	BRD-K36219530	1716307	InChI=1S/C22H25NO2S/c24-20-15-17-7-2-3-8-21(17)26-22-16-18(9-10-19(20)22)25-14-6-13-23-11-4-1-5-12-23/h2-3,7-10,16H,1,4-6,11-15H2	HVBFDMQTIYPSNN-UHFFFAOYSA-N	O=C1Cc2ccccc2Sc3cc(OCCCN4CCCCC4)ccc13	BroadT	BRD-K36219530	BRD-K36219530-003-05-3	Specs	AE-641/30155016		Cl	O=C1Cc2ccccc2Sc2cc(OCCCN3CCCCC3)ccc12.Cl	InChI=1S/C22H25NO2S.ClH/c24-20-15-17-7-2-3-8-21(17)26-22-16-18(9-10-19(20)22)25-14-6-13-23-11-4-1-5-12-23;/h2-3,7-10,16H,1,4-6,11-15H2;1H	HMTWOKCHGBEVLU-UHFFFAOYSA-N	367.16059974							103911, 103911
AC1MWII8	LSM-17186	SID7977329, BRD-K36160053	3749788	InChI=1S/C11H13N5O/c1-17-10-4-2-9(3-5-10)6-11(12)15-16-7-13-14-8-16/h2-5,7-8H,6H2,1H3,(H2,12,15)	WXJXVAKYIPZGJD-UHFFFAOYSA-N	COc1ccc(CC(=N)Nn2cnnc2)cc1	BroadT	BRD-K36160053	BRD-K36160053-001-05-0	ChemBridge Corporation	5705557			COc1ccc(CC(=N)Nn2cnnc2)cc1	InChI=1S/C11H13N5O/c1-17-10-4-2-9(3-5-10)6-11(12)15-16-7-13-14-8-16/h2-5,7-8H,6H2,1H3,(H2,12,15)	WXJXVAKYIPZGJD-UHFFFAOYSA-N	231.112010086							105825
ASN 03778872	LSM-17187	SID17507637, BRD-K10851851	1149974	InChI=1S/C19H21N3O3S2/c1-20-19(26)22(11-14-5-4-6-27-14)10-13-7-12-8-16(24-2)17(25-3)9-15(12)21-18(13)23/h4-9H,10-11H2,1-3H3,(H,20,26)(H,21,23)	SJRLELBWVYHFNK-UHFFFAOYSA-N	CNC(=S)N(Cc1cccs1)Cc2cc3cc(OC)c(OC)cc3nc2O	BroadT	BRD-K10851851	BRD-K10851851-001-06-6	Asinex Ltd.	ASN 03778872			CNC(=S)N(Cc1cccs1)Cc1cc2cc(OC)c(OC)cc2nc1O	InChI=1S/C19H21N3O3S2/c1-20-19(26)22(11-14-5-4-6-27-14)10-13-7-12-8-16(24-2)17(25-3)9-15(12)21-18(13)23/h4-9H,10-11H2,1-3H3,(H,20,26)(H,21,23)	SJRLELBWVYHFNK-UHFFFAOYSA-N	403.102432942							105826
MLS000737049	LSM-17188	SID26664438, BRD-K58815521	237923	InChI=1S/C9H12N2O3S/c1-2-3-4-15-9-10-6(8(13)14)5-7(12)11-9/h5H,2-4H2,1H3,(H,13,14)(H,10,11,12)	NUBJVMLEUWMEQU-UHFFFAOYSA-N	CCCCSc1nc(O)cc(n1)C(=O)O	BroadT	BRD-K58815521	BRD-K58815521-001-05-6	National Cancer Institute Chemotherapeutic Agents Repository	42014			CCCCSc1nc(O)cc(n1)C(O)=O	InChI=1S/C9H12N2O3S/c1-2-3-4-15-9-10-6(8(13)14)5-7(12)11-9/h5H,2-4H2,1H3,(H,13,14)(H,10,11,12)	NUBJVMLEUWMEQU-UHFFFAOYSA-N	228.056862954							105827
AC1LM4HO	LSM-17189	BRD-K88967996	1122669	InChI=1S/C16H15BrN2O3/c1-21-14-7-6-12(15(9-14)22-2)10-18-19-16(20)11-4-3-5-13(17)8-11/h3-10H,1-2H3,(H,19,20)	NXMRWFAUKUOPRV-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)c2cccc(Br)c2)c(OC)c1	BroadT	BRD-K88967996	BRD-K88967996-001-05-5	Asinex Ltd.	BAS 01377955			COc1ccc(C=NNC(=O)c2cccc(Br)c2)c(OC)c1	InChI=1S/C16H15BrN2O3/c1-21-14-7-6-12(15(9-14)22-2)10-18-19-16(20)11-4-3-5-13(17)8-11/h3-10H,1-2H3,(H,19,20)	NXMRWFAUKUOPRV-UHFFFAOYSA-N	362.02660496							105828
AC1MLVIU	LSM-17190	SID14723317, BRD-A14300939	3229223	InChI=1S/C21H27N7O/c1-21(2,3)28-20(23-24-25-28)19(16-8-10-22-11-9-16)27-14-12-26(13-15-27)17-4-6-18(29)7-5-17/h4-11,19,29H,12-15H2,1-3H3	WECIZJXZKLDXGM-UHFFFAOYSA-N	CC(C)(C)n1nnnc1C(N2CCN(CC2)c3ccc(O)cc3)c4ccncc4	BroadT	BRD-A14300939	BRD-A14300939-001-06-8	Asinex Ltd.	ASN 07880820			CC(C)(C)n1nnnc1C(N1CCN(CC1)c1ccc(O)cc1)c1ccncc1	InChI=1S/C21H27N7O/c1-21(2,3)28-20(23-24-25-28)19(16-8-10-22-11-9-16)27-14-12-26(13-15-27)17-4-6-18(29)7-5-17/h4-11,19,29H,12-15H2,1-3H3	WECIZJXZKLDXGM-UHFFFAOYSA-N	393.227708554							105829
AC1OC0BL	LSM-43712	SID24825808, BRD-K45499578	6907086	InChI=1S/C19H15N5O2/c1-12-6-8-13(9-7-12)24-17(25)15-5-3-2-4-14(15)16(18(24)26)10-20-19-21-11-22-23-19/h2-11H,1H3,(H2,20,21,22,23)/b16-10+	MNOSKNGFQFDHBC-MHWRWJLKSA-N	Cc1ccc(cc1)N2C(=O)\C(=C\Nc3nc[nH]n3)\c4ccccc4C2=O	BroadT	BRD-K45499578	BRD-K45499578-001-05-7	Enamine Ltd.	T5296135			Cc1ccc(cc1)N1C(=O)\C(=C\Nc2nc[nH]n2)c2ccccc2C1=O	InChI=1S/C19H15N5O2/c1-12-6-8-13(9-7-12)24-17(25)15-5-3-2-4-14(15)16(18(24)26)10-20-19-21-11-22-23-19/h2-11H,1H3,(H2,20,21,22,23)/b16-10+	MNOSKNGFQFDHBC-MHWRWJLKSA-N	345.12257477							
MLS000551502	LSM-17192	SID14740761, BRD-K01936192	5398488	InChI=1S/C18H16N2O3S/c1-2-23-15-9-5-13(6-10-15)19-17-16(24-18(22)20-17)11-12-3-7-14(21)8-4-12/h3-11,21H,2H2,1H3,(H,19,20,22)/b16-11-	MKAIUMDZTYINGG-WJDWOHSUSA-N	CCOc1ccc(NC2=NC(=O)S/C/2=C\c3ccc(O)cc3)cc1	BroadT	BRD-K01936192	BRD-K01936192-001-05-6	InterBioScreen Ltd.	STOCK3S-46571			CCOc1ccc(NC2=NC(=O)SC\2=C/c2ccc(O)cc2)cc1	InChI=1S/C18H16N2O3S/c1-2-23-15-9-5-13(6-10-15)19-17-16(24-18(22)20-17)11-12-3-7-14(21)8-4-12/h3-11,21H,2H2,1H3,(H,19,20,22)/b16-11-	MKAIUMDZTYINGG-WJDWOHSUSA-N	340.088163082							
AC1MCBOO	LSM-17193	BRD-A94535886	2765698	InChI=1S/C17H17NO3S/c1-11(18-21-17(19)16-4-3-9-22-16)14-10-15(14)12-5-7-13(20-2)8-6-12/h3-9,14-15H,10H2,1-2H3	RBJRCOJXLAWCHM-UHFFFAOYSA-N	COc1ccc(cc1)C2CC2C(=NOC(=O)c3cccs3)C	BroadT	BRD-A94535886	BRD-A94535886-001-05-7	Key Organics Ltd.	10M-030			COc1ccc(cc1)C1CC1C(C)=NOC(=O)c1cccs1	InChI=1S/C17H17NO3S/c1-11(18-21-17(19)16-4-3-9-22-16)14-10-15(14)12-5-7-13(20-2)8-6-12/h3-9,14-15H,10H2,1-2H3	RBJRCOJXLAWCHM-UHFFFAOYSA-N	315.092914104							105832
N,N,2-Trimethyl-1-phenyl-1H-benzimidazole-5-sulfonamide	LSM-17194	SID4263263, BRD-K94189953	744877	InChI=1S/C16H17N3O2S/c1-12-17-15-11-14(22(20,21)18(2)3)9-10-16(15)19(12)13-7-5-4-6-8-13/h4-11H,1-3H3	XMHZTEGRDMKPRB-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc2c(c1)nc(C)n2c3ccccc3	BroadT	BRD-K94189953	BRD-K94189953-001-05-9	ChemBridge Corporation	5119855			CN(C)S(=O)(=O)c1ccc2n(c(C)nc2c1)-c1ccccc1	InChI=1S/C16H17N3O2S/c1-12-17-15-11-14(22(20,21)18(2)3)9-10-16(15)19(12)13-7-5-4-6-8-13/h4-11H,1-3H3	XMHZTEGRDMKPRB-UHFFFAOYSA-N	315.104147504							105833
ZINC00466899	LSM-17195	SID24787841, BRD-K80384269	891391	InChI=1S/C15H13NO6/c1-9-6-13(17)22-10(2)14(9)15(18)21-8-11-4-3-5-12(7-11)16(19)20/h3-7H,8H2,1-2H3	MOAHRJZJGJYJFO-UHFFFAOYSA-N	CC1=C(C(=O)OCc2cccc(c2)[N+](=O)[O-])C(=CC(=O)O1)C	BroadT	BRD-K80384269	BRD-K80384269-001-05-1	ChemBridge Corporation	7478836			Cc1cc(=O)oc(C)c1C(=O)OCc1cccc(c1)[N+]([O-])=O	InChI=1S/C15H13NO6/c1-9-6-13(17)22-10(2)14(9)15(18)21-8-11-4-3-5-12(7-11)16(19)20/h3-7H,8H2,1-2H3	MOAHRJZJGJYJFO-UHFFFAOYSA-N	303.074287146							105834
MLS000044551	LSM-17196	SID4244887, BRD-K87994814	3239428	InChI=1S/C18H20F3N3O2/c1-25-14-7-6-12(10-15(14)26-2)13-11-16(18(19,20)21)23-17(22-13)24-8-4-3-5-9-24/h6-7,10-11H,3-5,8-9H2,1-2H3	QWTBMWLGTUEWKB-UHFFFAOYSA-N	COc1ccc(cc1OC)c2cc(nc(n2)N3CCCCC3)C(F)(F)F	BroadT	BRD-K87994814	BRD-K87994814-001-05-0	ChemDiv Inc.	C130-0353			COc1ccc(cc1OC)-c1cc(nc(n1)N1CCCCC1)C(F)(F)F	InChI=1S/C18H20F3N3O2/c1-25-14-7-6-12(10-15(14)26-2)13-11-16(18(19,20)21)23-17(22-13)24-8-4-3-5-9-24/h6-7,10-11H,3-5,8-9H2,1-2H3	QWTBMWLGTUEWKB-UHFFFAOYSA-N	367.15076151							105835
AG-401/43237635	LSM-17197	SID14728249, BRD-K09817307	7285303	InChI=1S/C20H13N7S/c1-2-5-15(6-3-1)27-20(24-25-26-27)16-13-22-19(14-8-10-21-11-9-14)23-18(16)17-7-4-12-28-17/h1-13H	BCFFQUDODISUEF-UHFFFAOYSA-N	c1ccc(cc1)n2nnnc2c3cnc(nc3c4cccs4)c5ccncc5	BroadT	BRD-K09817307	BRD-K09817307-001-05-2	Specs	AG-401/43237635			c1csc(c1)-c1nc(ncc1-c1nnnn1-c1ccccc1)-c1ccncc1	InChI=1S/C20H13N7S/c1-2-5-15(6-3-1)27-20(24-25-26-27)16-13-22-19(14-8-10-21-11-9-14)23-18(16)17-7-4-12-28-17/h1-13H	BCFFQUDODISUEF-UHFFFAOYSA-N	383.095314176							105836
F1899-0377	LSM-17198	SID852209, BRD-K97661790	654821	InChI=1S/C18H21N3O4S/c1-23-15-5-3-13(11-16(15)24-2)14-4-6-17(20-19-14)26-12-18(22)21-7-9-25-10-8-21/h3-6,11H,7-10,12H2,1-2H3	JTSDYQPIIAAEFO-UHFFFAOYSA-N	COc1ccc(cc1OC)c2ccc(SCC(=O)N3CCOCC3)nn2	BroadT	BRD-K97661790	BRD-K97661790-001-05-1	Asinex Ltd.	ASN 07276639			COc1ccc(cc1OC)-c1ccc(SCC(=O)N2CCOCC2)nn1	InChI=1S/C18H21N3O4S/c1-23-15-5-3-13(11-16(15)24-2)14-4-6-17(20-19-14)26-12-18(22)21-7-9-25-10-8-21/h3-6,11H,7-10,12H2,1-2H3	JTSDYQPIIAAEFO-UHFFFAOYSA-N	375.125276872							105837
MLS000573489	LSM-17199	SID17431821, BRD-K98705347	2282651	InChI=1S/C19H28N2O3S2/c1-6-21(7-2)18(25)26-13-12-16(22)20-17(23)24-15-10-8-14(9-11-15)19(3,4)5/h8-11H,6-7,12-13H2,1-5H3,(H,20,22,23)	FCQGKXQHOMXLGE-UHFFFAOYSA-N	CCN(CC)C(=S)SCCC(=O)NC(=O)Oc1ccc(cc1)C(C)(C)C	BroadT	BRD-K98705347	BRD-K98705347-001-05-3	ChemBridge Corporation	6430101			CCN(CC)C(=S)SCCC(=O)NC(=O)Oc1ccc(cc1)C(C)(C)C	InChI=1S/C19H28N2O3S2/c1-6-21(7-2)18(25)26-13-12-16(22)20-17(23)24-15-10-8-14(9-11-15)19(3,4)5/h8-11H,6-7,12-13H2,1-5H3,(H,20,22,23)	FCQGKXQHOMXLGE-UHFFFAOYSA-N	396.154134156							105838
4-Isopropylbenzenecarbothioamide	LSM-17200	BRD-K62383934	2078831	InChI=1S/C10H13NS/c1-7(2)8-3-5-9(6-4-8)10(11)12/h3-7H,1-2H3,(H2,11,12)	SDNLXXUGUAWDAT-UHFFFAOYSA-N	CC(C)c1ccc(cc1)C(=N)S	BroadT	BRD-K62383934	BRD-K62383934-001-05-0	Enamine Ltd.	T5226037			CC(C)c1ccc(cc1)C(S)=N	InChI=1S/C10H13NS/c1-7(2)8-3-5-9(6-4-8)10(11)12/h3-7H,1-2H3,(H2,11,12)	SDNLXXUGUAWDAT-UHFFFAOYSA-N	179.076870116							105839
2-[(2,4-Dichlorophenoxy)acetyl]-n-(4-fluorophenyl)hydrazinecarbothioamide	LSM-17201	SID17406584, BRD-K72639621	1011511	InChI=1S/C15H12Cl2FN3O2S/c16-9-1-6-13(12(17)7-9)23-8-14(22)20-21-15(24)19-11-4-2-10(18)3-5-11/h1-7H,8H2,(H,20,22)(H2,19,21,24)	LCJAIHVROUAWEW-UHFFFAOYSA-N	Fc1ccc(NC(=NNC(=O)COc2ccc(Cl)cc2Cl)S)cc1	BroadT	BRD-K72639621	BRD-K72639621-001-05-1	Specs	AN-329/40439811			Fc1ccc(NC(S)=NNC(=O)COc2ccc(Cl)cc2Cl)cc1	InChI=1S/C15H12Cl2FN3O2S/c16-9-1-6-13(12(17)7-9)23-8-14(22)20-21-15(24)19-11-4-2-10(18)3-5-11/h1-7H,8H2,(H,20,22)(H2,19,21,24)	LCJAIHVROUAWEW-UHFFFAOYSA-N	387.001130964							105840
6-Chloro-7-hydroxy-4-(morpholin-4-ylmethyl)chromen-2-one	LSM-17202	SID49677515, BRD-K49719159	6215497	InChI=1S/C14H14ClNO4/c15-11-6-10-9(8-16-1-3-19-4-2-16)5-14(18)20-13(10)7-12(11)17/h5-7,17H,1-4,8H2	QXDWZJZGAMNXCI-UHFFFAOYSA-N	Oc1cc2OC(=O)C=C(CN3CCOCC3)c2cc1Cl	BroadT	BRD-K49719159	BRD-K49719159-001-05-1	Life Chemicals Inc.	F1864-0446			Oc1cc2oc(=O)cc(CN3CCOCC3)c2cc1Cl	InChI=1S/C14H14ClNO4/c15-11-6-10-9(8-16-1-3-19-4-2-16)5-14(18)20-13(10)7-12(11)17/h5-7,17H,1-4,8H2	QXDWZJZGAMNXCI-UHFFFAOYSA-N	295.061135648							105841
BRD-A39231252	LSM-17203			InChI=1S/C15H15NO3/c17-14-11-5-1-2-6-12(11)15(18)13(14)9-16-8-10-4-3-7-19-10/h1-2,5-6,9-10,13H,3-4,7-8H2	DBBULPFSAWELFQ-UHFFFAOYSA-N	O=C1C(C=NCC2CCCO2)C(=O)c3ccccc13	BroadT	BRD-A39231252	BRD-A39231252-001-05-7	ChemBridge Corporation	5325731			O=C1C(C=NCC2CCCO2)C(=O)c2ccccc12	InChI=1S/C15H15NO3/c17-14-11-5-1-2-6-12(11)15(18)13(14)9-16-8-10-4-3-7-19-10/h1-2,5-6,9-10,13H,3-4,7-8H2	DBBULPFSAWELFQ-UHFFFAOYSA-N	257.10519335							105842
T5332109	LSM-17204	SID26657857, BRD-K44183355	2495004	InChI=1S/C15H13N3O3S/c1-22(20,21)13-9-5-2-6-10(13)14(19)18-15-16-11-7-3-4-8-12(11)17-15/h2-9H,1H3,(H2,16,17,18,19)	MSBNVBNEXQTGJU-UHFFFAOYSA-N	CS(=O)(=O)c1ccccc1C(=O)Nc2nc3ccccc3[nH]2	BroadT	BRD-K44183355	BRD-K44183355-001-05-7	Enamine Ltd.	T5332109			CS(=O)(=O)c1ccccc1C(=O)Nc1nc2ccccc2[nH]1	InChI=1S/C15H13N3O3S/c1-22(20,21)13-9-5-2-6-10(13)14(19)18-15-16-11-7-3-4-8-12(11)17-15/h2-9H,1H3,(H2,16,17,18,19)	MSBNVBNEXQTGJU-UHFFFAOYSA-N	315.067761996							105843
8-Methoxy-3-[[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one	LSM-43713	BRD-K79815658	1869052	InChI=1S/C25H27N5O3/c1-16-27-23-20-13-19(32-2)7-8-21(20)28-24(23)25(31)30(16)26-14-17-6-9-22(33-3)18(12-17)15-29-10-4-5-11-29/h6-9,12-14,31H,4-5,10-11,15H2,1-3H3	ZXHJBZNJUGTASZ-UHFFFAOYSA-N	COc1ccc2nc3c(O)n(N=Cc4ccc(OC)c(CN5CCCC5)c4)c(C)nc3c2c1	BroadT	BRD-K79815658	BRD-K79815658-001-08-0	InterBioScreen Ltd.	STOCK3S-73269			COc1ccc2nc3c(O)n(N=Cc4ccc(OC)c(CN5CCCC5)c4)c(C)nc3c2c1	InChI=1S/C25H27N5O3/c1-16-27-23-20-13-19(32-2)7-8-21(20)28-24(23)25(31)30(16)26-14-17-6-9-22(33-3)18(12-17)15-29-10-4-5-11-29/h6-9,12-14,31H,4-5,10-11,15H2,1-3H3	ZXHJBZNJUGTASZ-UHFFFAOYSA-N	445.211389774							
BAS 03032673	LSM-17206	SID49641989, BRD-K89067556	3145079	InChI=1S/C15H17N3O5S2/c1-3-23-14(20)8-12-9-24-15(17-12)18-25(21,22)13-6-4-11(5-7-13)16-10(2)19/h4-7,9H,3,8H2,1-2H3,(H,16,19)(H,17,18)	VISGQGQJQWSXHJ-UHFFFAOYSA-N	CCOC(=O)Cc1csc(NS(=O)(=O)c2ccc(NC(=O)C)cc2)n1	BroadT	BRD-K89067556	BRD-K89067556-001-05-5	Asinex Ltd.	BAS 03032673			CCOC(=O)Cc1csc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)n1	InChI=1S/C15H17N3O5S2/c1-3-23-14(20)8-12-9-24-15(17-12)18-25(21,22)13-6-4-11(5-7-13)16-10(2)19/h4-7,9H,3,8H2,1-2H3,(H,16,19)(H,17,18)	VISGQGQJQWSXHJ-UHFFFAOYSA-N	383.060962054							105845
SMR000065666	LSM-43714	SID3711236, BRD-K10247312	2997562	InChI=1S/C12H13ClN2O/c13-10-5-6-12(15-8-10)14-7-9-3-1-2-4-11(9)16/h5-8H,1-4H2,(H,14,15)/b9-7+	SMFYRXPDOJIFSK-VQHVLOKHSA-N	Clc1ccc(N\C=C\2/CCCCC2=O)nc1	BroadT	BRD-K10247312	BRD-K10247312-001-05-2	Enamine Ltd.	T0502-9451			Clc1ccc(N\C=C2/CCCCC2=O)nc1	InChI=1S/C12H13ClN2O/c13-10-5-6-12(15-8-10)14-7-9-3-1-2-4-11(9)16/h5-8H,1-4H2,(H,14,15)/b9-7+	SMFYRXPDOJIFSK-VQHVLOKHSA-N	236.071640766							
N-(3-Phenylpropyl)methanesulfonamide	LSM-17208	SID7975628, BRD-K13398517	1744854	InChI=1S/C10H15NO2S/c1-14(12,13)11-9-5-8-10-6-3-2-4-7-10/h2-4,6-7,11H,5,8-9H2,1H3	OHLXNOLHHQPVJR-UHFFFAOYSA-N	CS(=O)(=O)NCCCc1ccccc1	BroadT	BRD-K13398517	BRD-K13398517-001-05-3	ChemBridge Corporation	7289770			CS(=O)(=O)NCCCc1ccccc1	InChI=1S/C10H15NO2S/c1-14(12,13)11-9-5-8-10-6-3-2-4-7-10/h2-4,6-7,11H,5,8-9H2,1H3	OHLXNOLHHQPVJR-UHFFFAOYSA-N	213.08234942							105847
ST50031540	LSM-17209	SID16953107, BRD-K84927615	798022	InChI=1S/C9H18N4S/c1-2-7-3-5-9(6-4-7)12-10-8(14)11-13-9/h7,12-13H,2-6H2,1H3,(H2,10,11,14)	YGDFYTXKTIMKDV-UHFFFAOYSA-N	CCC1CCC2(CC1)NNC(=NN2)S	BroadT	BRD-K84927615	BRD-K84927615-001-05-4	Asinex Ltd.	BAS 01981888			CCC1CCC2(CC1)NNC(S)=NN2	InChI=1S/C9H18N4S/c1-2-7-3-5-9(6-4-7)12-10-8(14)11-13-9/h7,12-13H,2-6H2,1H3,(H2,10,11,14)	YGDFYTXKTIMKDV-UHFFFAOYSA-N	214.125217306							105848
MLS000086351	LSM-17210	SID4244111, BRD-K35803892	2155612	InChI=1S/C18H24N4O6S/c1-26-11-9-22(10-12-27-2)29(24,25)15-7-5-13(6-8-15)16(23)19-18-21-20-17(28-18)14-3-4-14/h5-8,14H,3-4,9-12H2,1-2H3,(H,19,21,23)	LWYGHCMJFFJCLG-UHFFFAOYSA-N	COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)Nc2oc(nn2)C3CC3	BroadT	BRD-K35803892	BRD-K35803892-001-06-9	ChemDiv Inc.	C079-0418			COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(o1)C1CC1	InChI=1S/C18H24N4O6S/c1-26-11-9-22(10-12-27-2)29(24,25)15-7-5-13(6-8-15)16(23)19-18-21-20-17(28-18)14-3-4-14/h5-8,14H,3-4,9-12H2,1-2H3,(H,19,21,23)	LWYGHCMJFFJCLG-UHFFFAOYSA-N	424.141655218							105849
AC1MDEAW	LSM-15265	BRD-A59181779	2835408	InChI=1S/C21H29NO/c1-20(13-6-7-14-20)21(23,19-11-4-2-5-12-19)15-10-18-22-16-8-3-9-17-22/h2,4-5,11-12,23H,3,6-9,13-14,16-18H2,1H3	TZMWHPKPISYJCM-UHFFFAOYSA-N	CC1(CCCC1)C(O)(C#CCN2CCCCC2)c3ccccc3	BroadT	BRD-A59181779	BRD-A59181779-003-05-9	Asinex Ltd.	BAS 03200182		Cl	CC1(CCCC1)C(O)(C#CCN1CCCCC1)c1ccccc1.Cl	InChI=1S/C21H29NO.ClH/c1-20(13-6-7-14-20)21(23,19-11-4-2-5-12-19)15-10-18-22-16-8-3-9-17-22;/h2,4-5,11-12,23H,3,6-9,13-14,16-18H2,1H3;1H	AKMUYFSLMJHBAZ-UHFFFAOYSA-N	311.224914558							103912, 103912
N-(6-Chloro-4-phenylquinazolin-2-yl)guanidine	LSM-15266	DNDI1417192, BRD-K76356838	3145916	InChI=1S/C15H12ClN5/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)20-15(19-12)21-14(17)18/h1-8H,(H4,17,18,19,20,21)	RGJFEUSQLIFRJG-UHFFFAOYSA-N	NC(=N)Nc1nc(c2ccccc2)c3cc(Cl)ccc3n1	BroadT	BRD-K76356838	BRD-K76356838-003-06-1	Asinex Ltd.	BAS 03181484		Cl	NC(=N)Nc1nc(-c2ccccc2)c2cc(Cl)ccc2n1.Cl	InChI=1S/C15H12ClN5.ClH/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)20-15(19-12)21-14(17)18;/h1-8H,(H4,17,18,19,20,21);1H	HBKZBRMOTWAFMG-UHFFFAOYSA-N	297.078123144							103913, 103913
MLS000779552	LSM-17211	SID26659698, BRD-A53744042	3315584	InChI=1S/C17H24ClNO2/c1-16(2)13-17(9-11-21-16,8-10-19-15(20)12-18)14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3,(H,19,20)	VGXDOXJYAHWVLW-UHFFFAOYSA-N	CC1(C)CC(CCNC(=O)CCl)(CCO1)c2ccccc2	BroadT	BRD-A53744042	BRD-A53744042-001-07-1	InterBioScreen Ltd.	STOCK2S-25340			CC1(C)CC(CCNC(=O)CCl)(CCO1)c1ccccc1	InChI=1S/C17H24ClNO2/c1-16(2)13-17(9-11-21-16,8-10-19-15(20)12-18)14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3,(H,19,20)	VGXDOXJYAHWVLW-UHFFFAOYSA-N	309.149556728							105850
ST50599170	LSM-17212	SID22415671, BRD-K31912442	2171167	InChI=1S/C17H19ClN2S2/c1-12-3-8-16(13(2)11-12)20-17(21)19-9-10-22-15-6-4-14(18)5-7-15/h3-8,11H,9-10H2,1-2H3,(H2,19,20,21)	ODTZZGNKAXMTLT-UHFFFAOYSA-N	Cc1ccc(N=C(S)NCCSc2ccc(Cl)cc2)c(C)c1	BroadT	BRD-K31912442	BRD-K31912442-001-05-9	ChemBridge Corporation	6930692			Cc1ccc(N=C(S)NCCSc2ccc(Cl)cc2)c(C)c1	InChI=1S/C17H19ClN2S2/c1-12-3-8-16(13(2)11-12)20-17(21)19-9-10-22-15-6-4-14(18)5-7-15/h3-8,11H,9-10H2,1-2H3,(H2,19,20,21)	ODTZZGNKAXMTLT-UHFFFAOYSA-N	350.067817718							105851
ZINC03410949	LSM-17213	SID22410030, BRD-K05256982	2529858	InChI=1S/C15H14FNO3/c1-19-14-7-6-10(8-12(14)16)9-20-13-5-3-2-4-11(13)15(17)18/h2-8H,9H2,1H3,(H2,17,18)	SJJSPGJHZMTLNR-UHFFFAOYSA-N	COc1ccc(COc2ccccc2C(=O)N)cc1F	BroadT	BRD-K05256982	BRD-K05256982-001-05-9	Enamine Ltd.	T5294744			COc1ccc(COc2ccccc2C(N)=O)cc1F	InChI=1S/C15H14FNO3/c1-19-14-7-6-10(8-12(14)16)9-20-13-5-3-2-4-11(13)15(17)18/h2-8H,9H2,1H3,(H2,17,18)	SJJSPGJHZMTLNR-UHFFFAOYSA-N	275.095771518							105852
AMBCB73086059	LSM-17214	SID24780292, BRD-K65732579	16187311	InChI=1S/C19H19F2N5O/c1-13-17(24-19(27-13)15-10-14(20)2-3-16(15)21)12-25-6-8-26(9-7-25)18-11-22-4-5-23-18/h2-5,10-11H,6-9,12H2,1H3	JCAIXRKQWLQDJH-UHFFFAOYSA-N	Cc1oc(nc1CN2CCN(CC2)c3cnccn3)c4cc(F)ccc4F	BroadT	BRD-K65732579	BRD-K65732579-001-05-5	ChemBridge Corporation	73086059			Cc1oc(nc1CN1CCN(CC1)c1cnccn1)-c1cc(F)ccc1F	InChI=1S/C19H19F2N5O/c1-13-17(24-19(27-13)15-10-14(20)2-3-16(15)21)12-25-6-8-26(9-7-25)18-11-22-4-5-23-18/h2-5,10-11H,6-9,12H2,1H3	JCAIXRKQWLQDJH-UHFFFAOYSA-N	371.155766678							105853
SMR000255504	LSM-17215	SID22401137, BRD-K73810346	2611589	InChI=1S/C20H19N5O5S2/c1-28-14-5-3-2-4-13(14)22-19-24-25-20(32-19)31-11-17(26)23-18(27)21-12-6-7-15-16(10-12)30-9-8-29-15/h2-7,10H,8-9,11H2,1H3,(H,22,24)(H2,21,23,26,27)	JRQHJDMVYPZDRI-UHFFFAOYSA-N	COc1ccccc1Nc2nnc(SCC(=O)NC(=O)Nc3ccc4OCCOc4c3)s2	BroadT	BRD-K73810346	BRD-K73810346-001-05-1	Enamine Ltd.	ZT-6051551			COc1ccccc1Nc1nnc(SCC(=O)NC(=O)Nc2ccc3OCCOc3c2)s1	InChI=1S/C20H19N5O5S2/c1-28-14-5-3-2-4-13(14)22-19-24-25-20(32-19)31-11-17(26)23-18(27)21-12-6-7-15-16(10-12)30-9-8-29-15/h2-7,10H,8-9,11H2,1H3,(H,22,24)(H2,21,23,26,27)	JRQHJDMVYPZDRI-UHFFFAOYSA-N	473.082760138							105854
MLS000734332	LSM-17216	SID24798764, BRD-A93869114	16190435	InChI=1S/C17H17F2N3S/c1-11(6-12-4-5-23-10-12)20-8-13-9-21-22-17(13)15-3-2-14(18)7-16(15)19/h2-5,7,9-11,20H,6,8H2,1H3,(H,21,22)	HKNRDWJKYQBZDD-UHFFFAOYSA-N	CC(Cc1ccsc1)NCc2c[nH]nc2c3ccc(F)cc3F	BroadT	BRD-A93869114	BRD-A93869114-001-06-3	ChemBridge Corporation	46833188			CC(Cc1ccsc1)NCc1c[nH]nc1-c1ccc(F)cc1F	InChI=1S/C17H17F2N3S/c1-11(6-12-4-5-23-10-12)20-8-13-9-21-22-17(13)15-3-2-14(18)7-16(15)19/h2-5,7,9-11,20H,6,8H2,1H3,(H,21,22)	HKNRDWJKYQBZDD-UHFFFAOYSA-N	333.111124664							105855
ZINC00809309	LSM-17217	SID843036, BRD-K14800843	645311	InChI=1S/C22H23N3O4/c23-13-16-20(24)29-18-8-4-7-17(26)19(18)22(16)9-11-25(12-10-22)21(27)28-14-15-5-2-1-3-6-15/h1-3,5-6H,4,7-12,14,24H2	XKUOZATYGGNDNY-UHFFFAOYSA-N	NC1=C(C#N)C2(CCN(CC2)C(=O)OCc3ccccc3)C4=C(CCCC4=O)O1	BroadT	BRD-K14800843	BRD-K14800843-001-05-2	Asinex Ltd.	BAS 07417445			NC1=C(C#N)C2(CCN(CC2)C(=O)OCc2ccccc2)C2=C(CCCC2=O)O1	InChI=1S/C22H23N3O4/c23-13-16-20(24)29-18-8-4-7-17(26)19(18)22(16)9-11-25(12-10-22)21(27)28-14-15-5-2-1-3-6-15/h1-3,5-6H,4,7-12,14,24H2	XKUOZATYGGNDNY-UHFFFAOYSA-N	393.168856246							105856
3-(3-Oxo-4-phenethyl-3,4-dihydro-quinoxalin-2-yl)-propionic acid	LSM-17218	SID3717153, BRD-K30483794	2374894	InChI=1S/C19H18N2O3/c22-18(23)11-10-16-19(24)21(13-12-14-6-2-1-3-7-14)17-9-5-4-8-15(17)20-16/h1-9H,10-13H2,(H,22,23)	GJKZXPRRHXVZBO-UHFFFAOYSA-N	OC(=O)CCC1=Nc2ccccc2N(CCc3ccccc3)C1=O	BroadT	BRD-K30483794	BRD-K30483794-001-05-6	Enamine Ltd.	T0511-5116			OC(=O)CCc1nc2ccccc2n(CCc2ccccc2)c1=O	InChI=1S/C19H18N2O3/c22-18(23)11-10-16-19(24)21(13-12-14-6-2-1-3-7-14)17-9-5-4-8-15(17)20-16/h1-9H,10-13H2,(H,22,23)	GJKZXPRRHXVZBO-UHFFFAOYSA-N	322.131742456							105857
MLS000518983	LSM-17219	SID14735689, BRD-K63478344	4117727	InChI=1S/C16H17NO3/c18-15(11-6-2-1-3-7-11)17-13-10-12-8-4-5-9-14(12)20-16(13)19/h4-5,8-11H,1-3,6-7H2,(H,17,18)	RJKSUFSHJKUPEX-UHFFFAOYSA-N	O=C(NC1=Cc2ccccc2OC1=O)C3CCCCC3	BroadT	BRD-K63478344	BRD-K63478344-001-05-1	ChemDiv Inc.	2316-2069			O=C(Nc1cc2ccccc2oc1=O)C1CCCCC1	InChI=1S/C16H17NO3/c18-15(11-6-2-1-3-7-11)17-13-10-12-8-4-5-9-14(12)20-16(13)19/h4-5,8-11H,1-3,6-7H2,(H,17,18)	RJKSUFSHJKUPEX-UHFFFAOYSA-N	271.120843414							105858
Methyl (2-phenylimidazo[1,2-a]pyridin-3-yl)carbamate	LSM-17220	SID4264937, BRD-K86968750	740413	InChI=1S/C15H13N3O2/c1-20-15(19)17-14-13(11-7-3-2-4-8-11)16-12-9-5-6-10-18(12)14/h2-10H,1H3,(H,17,19)	CCUUWTAPFGOYGQ-UHFFFAOYSA-N	COC(=O)Nc1c(nc2ccccn12)c3ccccc3	BroadT	BRD-K86968750	BRD-K86968750-001-05-1	ChemBridge Corporation	5561673			COC(=O)Nc1c(nc2ccccn12)-c1ccccc1	InChI=1S/C15H13N3O2/c1-20-15(19)17-14-13(11-7-3-2-4-8-11)16-12-9-5-6-10-18(12)14/h2-10H,1H3,(H,17,19)	CCUUWTAPFGOYGQ-UHFFFAOYSA-N	267.100776686							105859
ZINC03186676	LSM-17221	BRD-K51454518	2318425	InChI=1S/C19H14BrN3O2S/c20-15-10-11-18-21-19(22-26(24,25)16-7-2-1-3-8-16)17-9-5-4-6-14(17)12-23(18)13-15/h1-11,13H,12H2	AUPBGTHXQXUXTF-UHFFFAOYSA-N	BrC1=CN2Cc3ccccc3C(=NS(=O)(=O)c4ccccc4)N=C2C=C1	BroadT	BRD-K51454518	BRD-K51454518-001-05-6	Enamine Ltd.	T0503-4869			BrC1=CN2Cc3ccccc3C(N=C2C=C1)=NS(=O)(=O)c1ccccc1	InChI=1S/C19H14BrN3O2S/c20-15-10-11-18-21-19(22-26(24,25)16-7-2-1-3-8-16)17-9-5-4-6-14(17)12-23(18)13-15/h1-11,13H,12H2	AUPBGTHXQXUXTF-UHFFFAOYSA-N	426.999010008							105860
AC1LEPRU	LSM-2516	BRD-K23673040, BRD-K85660637	690299	InChI=1S/C17H14N4O4/c22-16(20-19-10-13-8-9-17(25-13)21(23)24)11-18-15-7-3-5-12-4-1-2-6-14(12)15/h1-10,18H,11H2,(H,20,22)	ZEUTZRYWGMGMEG-UHFFFAOYSA-N	[O-][N+](=O)c1oc(C=NNC(=O)CNc2cccc3ccccc23)cc1	BroadT	BRD-K23673040	BRD-K23673040-001-10-3	Broad Institute of MIT and Harvard	(Naphthalen-1-ylamino)-acetic acid [1-(5-nitro-furan-2-yl)-meth-(E)-ylidene]-hydrazide BRD-K85660637			[O-][N+](=O)c1ccc(C=NNC(=O)CNc2cccc3ccccc23)o1	InChI=1S/C17H14N4O4/c22-16(20-19-10-13-8-9-17(25-13)21(23)24)11-18-15-7-3-5-12-4-1-2-6-14(12)15/h1-10,18H,11H2,(H,20,22)	ZEUTZRYWGMGMEG-UHFFFAOYSA-N	338.101504968							92415
T0503-7256	LSM-17222	SID22403495, BRD-K54234283	2320177	InChI=1S/C22H19FN4/c23-16-11-9-15(10-12-16)20-14-18(17-6-3-4-7-19(17)24-20)22-26-25-21-8-2-1-5-13-27(21)22/h3-4,6-7,9-12,14H,1-2,5,8,13H2	FAWHFVHQHDNGSK-UHFFFAOYSA-N	Fc1ccc(cc1)c2cc(c3nnc4CCCCCn34)c5ccccc5n2	BroadT	BRD-K54234283	BRD-K54234283-001-06-0	Enamine Ltd.	T0503-7256			Fc1ccc(cc1)-c1cc(-c2nnc3CCCCCn23)c2ccccc2n1	InChI=1S/C22H19FN4/c23-16-11-9-15(10-12-16)20-14-18(17-6-3-4-7-19(17)24-20)22-26-25-21-8-2-1-5-13-27(21)22/h3-4,6-7,9-12,14H,1-2,5,8,13H2	FAWHFVHQHDNGSK-UHFFFAOYSA-N	358.159374848							105861
2-(1H-Benzoimidazol-2-yl)-1-(3-nitro-phenyl)-ethanone	LSM-17223	SID26657533, BRD-K68270321	2388900	InChI=1S/C15H11N3O3/c19-14(10-4-3-5-11(8-10)18(20)21)9-15-16-12-6-1-2-7-13(12)17-15/h1-8H,9H2,(H,16,17)	KSKHWQGLBMCMKE-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C(=O)Cc2nc3ccccc3[nH]2	BroadT	BRD-K68270321	BRD-K68270321-001-05-4	Enamine Ltd.	T0514-2948			[O-][N+](=O)c1cccc(c1)C(=O)Cc1nc2ccccc2[nH]1	InChI=1S/C15H11N3O3/c19-14(10-4-3-5-11(8-10)18(20)21)9-15-16-12-6-1-2-7-13(12)17-15/h1-8H,9H2,(H,16,17)	KSKHWQGLBMCMKE-UHFFFAOYSA-N	281.080041242							105862
F1835-0305	LSM-17224	SID7969703, BRD-A58379633	5310038	InChI=1S/C17H18N6O2S/c24-15(19-10-13-4-2-8-25-13)11-26-16-6-5-14-20-21-17(23(14)22-16)12-3-1-7-18-9-12/h1,3,5-7,9,13H,2,4,8,10-11H2,(H,19,24)	JSQCYWGKEFQZMS-UHFFFAOYSA-N	O=C(CSc1ccc2nnc(c3cccnc3)n2n1)NCC4CCCO4	BroadT	BRD-A58379633	BRD-A58379633-001-04-3	Life Chemicals Inc.	F1835-0305			O=C(CSc1ccc2nnc(-c3cccnc3)n2n1)NCC1CCCO1	InChI=1S/C17H18N6O2S/c24-15(19-10-13-4-2-8-25-13)11-26-16-6-5-14-20-21-17(23(14)22-16)12-3-1-7-18-9-12/h1,3,5-7,9,13H,2,4,8,10-11H2,(H,19,24)	JSQCYWGKEFQZMS-UHFFFAOYSA-N	370.121194566							105863
AC1OA1PH	LSM-17225	BRD-K02591076	6744282	InChI=1S/C15H12N4OS/c20-15(13-7-4-8-21-13)19-17-10-12-9-16-18-14(12)11-5-2-1-3-6-11/h1-10H,(H,16,18)(H,19,20)	GTMDXSHLVKKCDT-UHFFFAOYSA-N	O=C(NN=Cc1c[nH]nc1c2ccccc2)c3cccs3	BroadT	BRD-K02591076	BRD-K02591076-001-06-7	Specs	AK-968/15604495			O=C(NN=Cc1c[nH]nc1-c1ccccc1)c1cccs1	InChI=1S/C15H12N4OS/c20-15(13-7-4-8-21-13)19-17-10-12-9-16-18-14(12)11-5-2-1-3-6-11/h1-10H,(H,16,18)(H,19,20)	GTMDXSHLVKKCDT-UHFFFAOYSA-N	296.073181734							
STK390229	LSM-17226	SID47198442, BRD-K55739765	884329	InChI=1S/C16H15ClN2O2S/c1-10-2-7-14(20)13(8-10)18-16(22)19-15(21)9-11-3-5-12(17)6-4-11/h2-8,20H,9H2,1H3,(H2,18,19,21,22)	BGSXHNNWYPKQIQ-UHFFFAOYSA-N	Cc1ccc(O)c(NC(=S)NC(=O)Cc2ccc(Cl)cc2)c1	BroadT	BRD-K55739765	BRD-K55739765-001-05-6	ChemBridge Corporation	6593884			Cc1ccc(O)c(NC(=S)NC(=O)Cc2ccc(Cl)cc2)c1	InChI=1S/C16H15ClN2O2S/c1-10-2-7-14(20)13(8-10)18-16(22)19-15(21)9-11-3-5-12(17)6-4-11/h2-8,20H,9H2,1H3,(H2,18,19,21,22)	BGSXHNNWYPKQIQ-UHFFFAOYSA-N	334.05427614							105865
HMS2519P04	LSM-43715	BRD-K73359880	12005089	InChI=1S/C18H19N3O2/c1-23-17-11-9-16(10-12-17)19-14-18(22)21-20-13-5-8-15-6-3-2-4-7-15/h2-13,19H,14H2,1H3,(H,21,22)/b8-5-,20-13?	POAXCXKNVAVZQP-ASKRJIILSA-N	COc1ccc(NCC(=O)NN=C\C=C/c2ccccc2)cc1	BroadT	BRD-K73359880	BRD-K73359880-001-05-1	ChemDiv Inc.	8002-9083			COc1ccc(NCC(=O)NN=C\C=C/c2ccccc2)cc1	InChI=1S/C18H19N3O2/c1-23-17-11-9-16(10-12-17)19-14-18(22)21-20-13-5-8-15-6-3-2-4-7-15/h2-13,19H,14H2,1H3,(H,21,22)/b8-5-,20-13?	POAXCXKNVAVZQP-ASKRJIILSA-N	309.147726878							
SMR000149444	LSM-17228	SID14742791, BRD-K64766699	1872309	InChI=1S/C18H19N3O4S/c19-14(22)10-21-17-15(12-6-2-1-3-7-13(12)26-17)16(23)20(18(21)24)9-11-5-4-8-25-11/h4-5,8H,1-3,6-7,9-10H2,(H2,19,22)	CFNHADLXRJXJRK-UHFFFAOYSA-N	NC(=O)CN1C(=O)N(Cc2occc2)C(=O)c3c4CCCCCc4sc13	BroadT	BRD-K64766699	BRD-K64766699-001-06-7	InterBioScreen Ltd.	STOCK5S-45261			NC(=O)Cn1c2sc3CCCCCc3c2c(=O)n(Cc2ccco2)c1=O	InChI=1S/C18H19N3O4S/c19-14(22)10-21-17-15(12-6-2-1-3-7-13(12)26-17)16(23)20(18(21)24)9-11-5-4-8-25-11/h4-5,8H,1-3,6-7,9-10H2,(H2,19,22)	CFNHADLXRJXJRK-UHFFFAOYSA-N	373.109626808							105867
T0502-3208	LSM-17229	SID17516822, BRD-K16945760	2309186	InChI=1S/C19H23N3O/c1-13(2)15-7-6-8-16(12-15)19(4,5)22-18(23)21-17-11-14(3)9-10-20-17/h6-12H,1H2,2-5H3,(H2,20,21,22,23)	IZYAAKSAEJHFIG-UHFFFAOYSA-N	CC(=C)c1cccc(c1)C(C)(C)NC(=O)Nc2cc(C)ccn2	BroadT	BRD-K16945760	BRD-K16945760-001-05-2	Enamine Ltd.	T0502-3208			CC(=C)c1cccc(c1)C(C)(C)NC(=O)Nc1cc(C)ccn1	InChI=1S/C19H23N3O/c1-13(2)15-7-6-8-16(12-15)19(4,5)22-18(23)21-17-11-14(3)9-10-20-17/h6-12H,1H2,2-5H3,(H2,20,21,22,23)	IZYAAKSAEJHFIG-UHFFFAOYSA-N	309.184112386							105868
MLS000947968	LSM-17230	SID24274045, SID49716373, BRD-K06419593	5322407	InChI=1S/C26H24N2O5S/c1-33-19-11-9-18(10-12-19)28-34(31,32)20-13-14-24-23(15-20)21-3-2-4-22(21)25(27-24)16-5-7-17(8-6-16)26(29)30/h2-3,5-15,21-22,25,27-28H,4H2,1H3,(H,29,30)/t21-,22+,25+/m0/s1	UJLSMINJLZJZEX-SGIRGMQISA-N	COc1ccc(NS(=O)(=O)c2ccc3N[C@@H]([C@@H]4CC=C[C@@H]4c3c2)c5ccc(cc5)C(=O)O)cc1	BroadT	BRD-K06419593	BRD-K06419593-001-07-9	ChemDiv Inc.	5408-1513			COc1ccc(NS(=O)(=O)c2ccc3N[C@@H]([C@@H]4CC=C[C@@H]4c3c2)c2ccc(cc2)C(O)=O)cc1	InChI=1S/C26H24N2O5S/c1-33-19-11-9-18(10-12-19)28-34(31,32)20-13-14-24-23(15-20)21-3-2-4-22(21)25(27-24)16-5-7-17(8-6-16)26(29)30/h2-3,5-15,21-22,25,27-28H,4H2,1H3,(H,29,30)/t21-,22+,25+/m0/s1	UJLSMINJLZJZEX-SGIRGMQISA-N	476.140592578							105869
1-Benzyl-5-(4-chlorophenyl)-1H-imidazole-2-thiol	LSM-17231	SID26657831, BRD-K41095479	4868391	InChI=1S/C16H13ClN2S/c17-14-8-6-13(7-9-14)15-10-18-16(20)19(15)11-12-4-2-1-3-5-12/h1-10H,11H2,(H,18,20)	VWPLZCGHNRMBIF-UHFFFAOYSA-N	Sc1ncc(c2ccc(Cl)cc2)n1Cc3ccccc3	BroadT	BRD-K41095479	BRD-K41095479-001-06-5	Enamine Ltd.	T5292103			Sc1ncc(-c2ccc(Cl)cc2)n1Cc1ccccc1	InChI=1S/C16H13ClN2S/c17-14-8-6-13(7-9-14)15-10-18-16(20)19(15)11-12-4-2-1-3-5-12/h1-10H,11H2,(H,18,20)	VWPLZCGHNRMBIF-UHFFFAOYSA-N	300.048796836							105870
SMR000025812	LSM-17232	SID4249434, BRD-K15850481	3243388	InChI=1S/C17H15N7O2/c25-17(14-6-3-11-26-14)23-9-7-22(8-10-23)15-16-19-20-21-24(16)13-5-2-1-4-12(13)18-15/h1-6,11H,7-10H2	ZEMLDKXFPNBFGA-UHFFFAOYSA-N	O=C(N1CCN(CC1)c2nc3ccccc3n4nnnc24)c5occc5	BroadT	BRD-K15850481	BRD-K15850481-001-06-1	ChemDiv Inc.	C301-0705			O=C(N1CCN(CC1)c1nc2ccccc2n2nnnc12)c1ccco1	InChI=1S/C17H15N7O2/c25-17(14-6-3-11-26-14)23-9-7-22(8-10-23)15-16-19-20-21-24(16)13-5-2-1-4-12(13)18-15/h1-6,11H,7-10H2	ZEMLDKXFPNBFGA-UHFFFAOYSA-N	349.12872279							105871
N-(3-Chloro-4-fluorophenyl)-5-(pyridin-4-yl)-1,3,4-thiadiazol-2-amine	LSM-3172	BRD-K53011428, SID87457166, SID99495810	1257201	InChI=1S/C13H8ClFN4S/c14-10-7-9(1-2-11(10)15)17-13-19-18-12(20-13)8-3-5-16-6-4-8/h1-7H,(H,17,19)	AMDJEUDVWWVCPN-UHFFFAOYSA-N	Fc1ccc(Nc2nnc(s2)c3ccncc3)cc1Cl	BroadT	BRD-K53011428	BRD-K53011428-001-03-6	Broad Institute of MIT and Harvard	N-(3-chloro-4-fluorophenyl)-5-(4-pyridinyl)-1,3,4-thiadiazol-2-amine BRD-K53011428			Fc1ccc(Nc2nnc(s2)-c2ccncc2)cc1Cl	InChI=1S/C13H8ClFN4S/c14-10-7-9(1-2-11(10)15)17-13-19-18-12(20-13)8-3-5-16-6-4-8/h1-7H,(H,17,19)	AMDJEUDVWWVCPN-UHFFFAOYSA-N	306.014222896							92924
T0512-5658	LSM-17233	SID24779872, BRD-K81196615	2421054	InChI=1S/C22H18Cl2F2N4S2/c23-17-7-5-15(9-19(17)25)29-21(31)27-11-13-1-2-14(4-3-13)12-28-22(32)30-16-6-8-18(24)20(26)10-16/h1-10H,11-12H2,(H2,27,29,31)(H2,28,30,32)	AGOYBDGDMVYPKN-UHFFFAOYSA-N	Fc1cc(NC(=NCc2ccc(CN=C(S)Nc3ccc(Cl)c(F)c3)cc2)S)ccc1Cl	BroadT	BRD-K81196615	BRD-K81196615-001-05-9	Enamine Ltd.	T0512-5658			Fc1cc(NC(S)=NCc2ccc(CN=C(S)Nc3ccc(Cl)c(F)c3)cc2)ccc1Cl	InChI=1S/C22H18Cl2F2N4S2/c23-17-7-5-15(9-19(17)25)29-21(31)27-11-13-1-2-14(4-3-13)12-28-22(32)30-16-6-8-18(24)20(26)10-16/h1-10H,11-12H2,(H2,27,29,31)(H2,28,30,32)	AGOYBDGDMVYPKN-UHFFFAOYSA-N	510.031799816							105872
Methyl 3-amino-4-(thiophen-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate	LSM-17234	SID14731053, BRD-K95779043	949348	InChI=1S/C17H16N2O2S2/c1-21-17(20)15-14(18)13-12(11-7-4-8-22-11)9-5-2-3-6-10(9)19-16(13)23-15/h4,7-8H,2-3,5-6,18H2,1H3	VJARBRQKIXRNIY-UHFFFAOYSA-N	COC(=O)c1sc2nc3CCCCc3c(c4cccs4)c2c1N	BroadT	BRD-K95779043	BRD-K95779043-001-05-8	InterBioScreen Ltd.	STOCK2S-57417			COC(=O)c1sc2nc3CCCCc3c(-c3cccs3)c2c1N	InChI=1S/C17H16N2O2S2/c1-21-17(20)15-14(18)13-12(11-7-4-8-22-11)9-5-2-3-6-10(9)19-16(13)23-15/h4,7-8H,2-3,5-6,18H2,1H3	VJARBRQKIXRNIY-UHFFFAOYSA-N	344.065319152							105873
N-(4,5-Dihydro-1,3-thiazol-2-yl)-1-ethyl-1H-pyrazole-3-carboxamide	LSM-17235	SID104219478, SID22413641, BRD-K55824706	841677	InChI=1S/C9H12N4OS/c1-2-13-5-3-7(12-13)8(14)11-9-10-4-6-15-9/h3,5H,2,4,6H2,1H3,(H,10,11,14)	SOMLSQRPKZWHIF-UHFFFAOYSA-N	CCn1ccc(n1)C(=O)NC2=NCCS2	BroadT	BRD-K55824706	BRD-K55824706-001-05-8	Specs	AK-968/40941196			CCn1ccc(n1)C(=O)NC1=NCCS1	InChI=1S/C9H12N4OS/c1-2-13-5-3-7(12-13)8(14)11-9-10-4-6-15-9/h3,5H,2,4,6H2,1H3,(H,10,11,14)	SOMLSQRPKZWHIF-UHFFFAOYSA-N	224.073181734							105874
4-{4-[5-(3,4,5-Trimethoxy-phenyl)-[1,3,4]oxadiazol-2-yl]-phenyl}-morpholine	LSM-17236	SID844455, BRD-K85393703	646780	InChI=1S/C21H23N3O5/c1-25-17-12-15(13-18(26-2)19(17)27-3)21-23-22-20(29-21)14-4-6-16(7-5-14)24-8-10-28-11-9-24/h4-7,12-13H,8-11H2,1-3H3	ZQQBASAIFGTMSU-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)c2oc(nn2)c3ccc(cc3)N4CCOCC4	BroadT	BRD-K85393703	BRD-K85393703-001-05-1	Asinex Ltd.	ASN 03157292			COc1cc(cc(OC)c1OC)-c1nnc(o1)-c1ccc(cc1)N1CCOCC1	InChI=1S/C21H23N3O5/c1-25-17-12-15(13-18(26-2)19(17)27-3)21-23-22-20(29-21)14-4-6-16(7-5-14)24-8-10-28-11-9-24/h4-7,12-13H,8-11H2,1-3H3	ZQQBASAIFGTMSU-UHFFFAOYSA-N	397.163770866							105875
AC1LZG2G	LSM-17237	SID26660129, BRD-K95342582	1949842	InChI=1S/C18H22N2O3S2/c1-6-23-16(22)13-14(20(5)17(24)25-13)19-15(21)11-7-9-12(10-8-11)18(2,3)4/h7-10H,6H2,1-5H3,(H,19,21)	OWEYCOKXAHWNFI-UHFFFAOYSA-N	CCOC(=O)C1=C(NC(=O)c2ccc(cc2)C(C)(C)C)N(C)C(=S)S1	BroadT	BRD-K95342582	BRD-K95342582-001-05-2	InterBioScreen Ltd.	STOCK2S-94377			CCOC(=O)c1sc(=S)n(C)c1NC(=O)c1ccc(cc1)C(C)(C)C	InChI=1S/C18H22N2O3S2/c1-6-23-16(22)13-14(20(5)17(24)25-13)19-15(21)11-7-9-12(10-8-11)18(2,3)4/h7-10H,6H2,1-5H3,(H,19,21)	OWEYCOKXAHWNFI-UHFFFAOYSA-N	378.107183964							105876
AC1NELMY	LSM-17238	BRD-K48311677	4594191	InChI=1S/C13H11ClF3N5/c1-22(2)7-21-12-19-4-8(5-20-12)11-10(14)3-9(6-18-11)13(15,16)17/h3-7H,1-2H3	PHEKNLFVOLMIKW-UHFFFAOYSA-N	CN(C)C=Nc1ncc(cn1)c2ncc(cc2Cl)C(F)(F)F	BroadT	BRD-K48311677	BRD-K48311677-001-05-1	Key Organics Ltd.	7G-044			CN(C)C=Nc1ncc(cn1)-c1ncc(cc1Cl)C(F)(F)F	InChI=1S/C13H11ClF3N5/c1-22(2)7-21-12-19-4-8(5-20-12)11-10(14)3-9(6-18-11)13(15,16)17/h3-7H,1-2H3	PHEKNLFVOLMIKW-UHFFFAOYSA-N	329.065507712							105877
F1743-0035	LSM-4518	BRD-K06800040, SID24796559	2981635	InChI=1S/C17H14N4O2S/c22-15-12-6-1-4-11-5-2-7-13(14(11)12)16(23)21(15)8-3-9-24-17-18-10-19-20-17/h1-2,4-7,10H,3,8-9H2,(H,18,19,20)	ACUPQPGUHKDMKN-UHFFFAOYSA-N	O=C1N(CCCSc2nc[nH]n2)C(=O)c3cccc4cccc1c34	BroadT	BRD-K06800040	BRD-K06800040-001-04-6	ChemBridge Corporation	7982096			O=C1N(CCCSc2nnc[nH]2)C(=O)c2cccc3cccc1c23	InChI=1S/C17H14N4O2S/c22-15-12-6-1-4-11-5-2-7-13(14(11)12)16(23)21(15)8-3-9-24-17-18-10-19-20-17/h1-2,4-7,10H,3,8-9H2,(H,18,19,20)	ACUPQPGUHKDMKN-UHFFFAOYSA-N	338.083746418							93939
ST50849938	LSM-17239	SID17432453, BRD-K10671495	970996	InChI=1S/C14H12F3N3O2S/c1-8-9(6-7-22-8)12(21)19-20-13(23)18-11-5-3-2-4-10(11)14(15,16)17/h2-7H,1H3,(H,19,21)(H2,18,20,23)	XGWRGERYNMLWMC-UHFFFAOYSA-N	Cc1occc1C(=O)NN=C(S)Nc2ccccc2C(F)(F)F	BroadT	BRD-K10671495	BRD-K10671495-001-05-2	ChemBridge Corporation	7810846			Cc1occc1C(=O)NN=C(S)Nc1ccccc1C(F)(F)F	InChI=1S/C14H12F3N3O2S/c1-8-9(6-7-22-8)12(21)19-20-13(23)18-11-5-3-2-4-10(11)14(15,16)17/h2-7H,1H3,(H,19,21)(H2,18,20,23)	XGWRGERYNMLWMC-UHFFFAOYSA-N	343.060231944							105878
AC1LH62Y	LSM-17240	BRD-K85627348	832835	InChI=1S/C15H13ClN4O2S/c1-10-2-5-12(6-3-10)18-15(23)19-17-9-11-4-7-13(16)14(8-11)20(21)22/h2-9H,1H3,(H2,18,19,23)	UXEHSJUTAGYFIT-UHFFFAOYSA-N	Cc1ccc(NC(=NN=Cc2ccc(Cl)c(c2)[N+](=O)[O-])S)cc1	BroadT	BRD-K85627348	BRD-K85627348-001-05-3	Specs	AN-329/40239141			Cc1ccc(NC(S)=NN=Cc2ccc(Cl)c(c2)[N+]([O-])=O)cc1	InChI=1S/C15H13ClN4O2S/c1-10-2-5-12(6-3-10)18-15(23)19-17-9-11-4-7-13(16)14(8-11)20(21)22/h2-9H,1H3,(H2,18,19,23)	UXEHSJUTAGYFIT-UHFFFAOYSA-N	348.044774096							105879
STK575679	LSM-17241	SID17433967, BRD-A27891813	2892735	InChI=1S/C19H18N2OS/c1-22-14-7-4-6-13(11-14)17-16-10-9-12-5-2-3-8-15(12)18(16)21-19(23)20-17/h2-8,11,17H,9-10H2,1H3,(H2,20,21,23)	RORQBSIANNPTQQ-UHFFFAOYSA-N	COc1cccc(c1)C2NC(=NC3=C2CCc4ccccc34)S	BroadT	BRD-A27891813	BRD-A27891813-001-05-4	ChemBridge Corporation	6272986			COc1cccc(c1)C1NC(S)=NC2=C1CCc1ccccc21	InChI=1S/C19H18N2OS/c1-22-14-7-4-6-13(11-14)17-16-10-9-12-5-2-3-8-15(12)18(16)21-19(23)20-17/h2-8,11,17H,9-10H2,1H3,(H2,20,21,23)	RORQBSIANNPTQQ-UHFFFAOYSA-N	322.113983906							105880
ST50910558	LSM-17242	SID7975621, BRD-K29159907	2171062	InChI=1S/C15H18N2O2S2/c1-15(2,9-16-13(18)11-5-3-7-20-11)10-17-14(19)12-6-4-8-21-12/h3-8H,9-10H2,1-2H3,(H,16,18)(H,17,19)	RZWYCKPJCCIETA-UHFFFAOYSA-N	CC(C)(CNC(=O)c1cccs1)CNC(=O)c2cccs2	BroadT	BRD-K29159907	BRD-K29159907-001-06-7	ChemBridge Corporation	5540027			CC(C)(CNC(=O)c1cccs1)CNC(=O)c1cccs1	InChI=1S/C15H18N2O2S2/c1-15(2,9-16-13(18)11-5-3-7-20-11)10-17-14(19)12-6-4-8-21-12/h3-8H,9-10H2,1-2H3,(H,16,18)(H,17,19)	RZWYCKPJCCIETA-UHFFFAOYSA-N	322.080969216							105881
1-Benzyl-3-(4-ethylphenyl)thiourea	LSM-17243	SID24839238, BRD-K58169646	2093562	InChI=1S/C16H18N2S/c1-2-13-8-10-15(11-9-13)18-16(19)17-12-14-6-4-3-5-7-14/h3-11H,2,12H2,1H3,(H2,17,18,19)	HBGCOGSUOOXWHS-UHFFFAOYSA-N	CCc1ccc(NC(=NCc2ccccc2)S)cc1	BroadT	BRD-K58169646	BRD-K58169646-001-05-8	Enamine Ltd.	T5276435			CCc1ccc(NC(S)=NCc2ccccc2)cc1	InChI=1S/C16H18N2S/c1-2-13-8-10-15(11-9-13)18-16(19)17-12-14-6-4-3-5-7-14/h3-11H,2,12H2,1H3,(H2,17,18,19)	HBGCOGSUOOXWHS-UHFFFAOYSA-N	270.119069286							105882
T0507-7807	LSM-17244	SID22405595, BRD-A41524805	3618784	InChI=1S/C18H17Cl2NO3/c1-2-16(12-6-4-3-5-7-12)18(23)24-11-17(22)21-15-9-13(19)8-14(20)10-15/h3-10,16H,2,11H2,1H3,(H,21,22)	FQHGDQCBAQOOEQ-UHFFFAOYSA-N	CCC(C(=O)OCC(=O)Nc1cc(Cl)cc(Cl)c1)c2ccccc2	BroadT	BRD-A41524805	BRD-A41524805-001-05-3	Enamine Ltd.	T0507-7807			CCC(C(=O)OCC(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1	InChI=1S/C18H17Cl2NO3/c1-2-16(12-6-4-3-5-7-12)18(23)24-11-17(22)21-15-9-13(19)8-14(20)10-15/h3-10,16H,2,11H2,1H3,(H,21,22)	FQHGDQCBAQOOEQ-UHFFFAOYSA-N	365.058548834							105883
MLS000583211	LSM-17245	SID17510301, BRD-K61587774	12005168	InChI=1S/C22H25NO6/c1-4-29-17-8-6-16(7-9-17)18(24)14-19(25)22(26)23-12-11-15-5-10-20(27-2)21(13-15)28-3/h5-10,13H,4,11-12,14H2,1-3H3,(H,23,26)	LKTXDWAINLJFEV-UHFFFAOYSA-N	CCOc1ccc(cc1)C(=O)CC(=O)C(=O)NCCc2ccc(OC)c(OC)c2	BroadT	BRD-K61587774	BRD-K61587774-001-05-0	ChemDiv Inc.	C439-0801			CCOc1ccc(cc1)C(=O)CC(=O)C(=O)NCCc1ccc(OC)c(OC)c1	InChI=1S/C22H25NO6/c1-4-29-17-8-6-16(7-9-17)18(24)14-19(25)22(26)23-12-11-15-5-10-20(27-2)21(13-15)28-3/h5-10,13H,4,11-12,14H2,1-3H3,(H,23,26)	LKTXDWAINLJFEV-UHFFFAOYSA-N	399.16818753							105884
ST50168677	LSM-17246	SID4259076, BRD-K95153924	747923	InChI=1S/C16H19NO3S/c1-11(2)14-10-15(12(3)9-16(14)18)17-21(19,20)13-7-5-4-6-8-13/h4-11,17-18H,1-3H3	LWRQPXNDCLGMNQ-UHFFFAOYSA-N	CC(C)c1cc(NS(=O)(=O)c2ccccc2)c(C)cc1O	BroadT	BRD-K95153924	BRD-K95153924-001-05-0	ChemBridge Corporation	6625448			CC(C)c1cc(NS(=O)(=O)c2ccccc2)c(C)cc1O	InChI=1S/C16H19NO3S/c1-11(2)14-10-15(12(3)9-16(14)18)17-21(19,20)13-7-5-4-6-8-13/h4-11,17-18H,1-3H3	LWRQPXNDCLGMNQ-UHFFFAOYSA-N	305.108564168							105885
MLS001218123	LSM-17247	SID49733893, BRD-K23194976	24793457	InChI=1S/C14H13ClN6OS/c1-8-6-11-19-20-14(21(11)13(16)17-8)23-7-12(22)18-10-4-2-9(15)3-5-10/h2-6H,7H2,1H3,(H2,16,17)(H,18,22)	GIPWSAVGTCOAIJ-UHFFFAOYSA-N	Cc1cc2nnc(SCC(=O)Nc3ccc(Cl)cc3)n2c(N)n1	BroadT	BRD-K23194976	BRD-K23194976-001-05-8	Asinex Ltd.	AST 07264437			Cc1cc2nnc(SCC(=O)Nc3ccc(Cl)cc3)n2c(N)n1	InChI=1S/C14H13ClN6OS/c1-8-6-11-19-20-14(21(11)13(16)17-8)23-7-12(22)18-10-4-2-9(15)3-5-10/h2-6H,7H2,1H3,(H2,16,17)(H,18,22)	GIPWSAVGTCOAIJ-UHFFFAOYSA-N	348.056007496							105886
NSC670283	LSM-17248	SID26665011, SID513709, BRD-K47510707	382634	InChI=1S/C25H24O2/c26-23-5-1-3-15-7-17-11-25(13-19(17)9-21(15)23)12-18-8-16-4-2-6-24(27)22(16)10-20(18)14-25/h7-10H,1-6,11-14H2	AKPUCJQSLKCIIJ-UHFFFAOYSA-N	O=C1CCCc2cc3CC4(Cc5cc6CCCC(=O)c6cc5C4)Cc3cc12	BroadT	BRD-K47510707	BRD-K47510707-001-06-1	National Cancer Institute Chemotherapeutic Agents Repository	2,2'-Spirobi[2H-benz[f]indene]-5,5'-dione, 1,1',3,3',5,5',6,6',7, 7',8,8'-dodecahydro- 670283			O=C1CCCc2cc3CC4(Cc5cc6CCCC(=O)c6cc5C4)Cc3cc12	InChI=1S/C25H24O2/c26-23-5-1-3-15-7-17-11-25(13-19(17)9-21(15)23)12-18-8-16-4-2-6-24(27)22(16)10-20(18)14-25/h7-10H,1-6,11-14H2	AKPUCJQSLKCIIJ-UHFFFAOYSA-N	356.177630008							105887
T0501-0780	LSM-17249	SID22410141, BRD-K93397704	5788506	InChI=1S/C20H14Br2N4O2/c1-2-11-9-13(12-5-3-4-6-16(12)23-11)19(27)26-25-18-14-7-10(21)8-15(22)17(14)24-20(18)28/h3-9,24,28H,2H2,1H3	IHCRICGUPAKIBD-UHFFFAOYSA-N	CCc1cc(C(=O)N=Nc2c(O)[nH]c3c(Br)cc(Br)cc23)c4ccccc4n1	BroadT	BRD-K93397704	BRD-K93397704-001-05-1	Enamine Ltd.	T0501-0780			CCc1cc(C(=O)N=Nc2c(O)[nH]c3c(Br)cc(Br)cc23)c2ccccc2n1	InChI=1S/C20H14Br2N4O2/c1-2-11-9-13(12-5-3-4-6-16(12)23-11)19(27)26-25-18-14-7-10(21)8-15(22)17(14)24-20(18)28/h3-9,24,28H,2H2,1H3	IHCRICGUPAKIBD-UHFFFAOYSA-N	499.948350928							
MLS000116410	LSM-17250	SID7966605, BRD-K78969898	5308330	InChI=1S/C17H19N3O2S/c1-10(2)7-11-8-14(20-22-11)16(21)19-17-13(9-18)12-5-3-4-6-15(12)23-17/h8,10H,3-7H2,1-2H3,(H,19,21)	ZRTRXRDRAVYFEH-UHFFFAOYSA-N	CC(C)Cc1onc(c1)C(=O)Nc2sc3CCCCc3c2C#N	BroadT	BRD-K78969898	BRD-K78969898-001-04-5	ChemDiv Inc.	C226-3169			CC(C)Cc1cc(no1)C(=O)Nc1sc2CCCCc2c1C#N	InChI=1S/C17H19N3O2S/c1-10(2)7-11-8-14(20-22-11)16(21)19-17-13(9-18)12-5-3-4-6-15(12)23-17/h8,10H,3-7H2,1-2H3,(H,19,21)	ZRTRXRDRAVYFEH-UHFFFAOYSA-N	329.119797568							105889
SMR000028626	LSM-17251	SID4245150, BRD-K42234439	3239653	InChI=1S/C21H16N2O5/c1-26-14-10-8-13(9-11-14)22-21(25)19-18(15-5-2-3-6-16(15)28-19)23-20(24)17-7-4-12-27-17/h2-12H,1H3,(H,22,25)(H,23,24)	QYWZMUCGXGPYQI-UHFFFAOYSA-N	COc1ccc(NC(=O)c2oc3ccccc3c2NC(=O)c4occc4)cc1	BroadT	BRD-K42234439	BRD-K42234439-001-06-8	ChemDiv Inc.	C686-0456			COc1ccc(NC(=O)c2oc3ccccc3c2NC(=O)c2ccco2)cc1	InChI=1S/C21H16N2O5/c1-26-14-10-8-13(9-11-14)22-21(25)19-18(15-5-2-3-6-16(15)28-19)23-20(24)17-7-4-12-27-17/h2-12H,1H3,(H,22,25)(H,23,24)	QYWZMUCGXGPYQI-UHFFFAOYSA-N	376.105921632							105890
AE-641/15338104	LSM-17252	SID7978283, BRD-K92780133	2790144	InChI=1S/C14H19NO4S/c1-3-4-8-19-14(17)15-12-11(13(16)18-2)9-6-5-7-10(9)20-12/h3-8H2,1-2H3,(H,15,17)	CAVOCRZWSBMIPC-UHFFFAOYSA-N	CCCCOC(=O)Nc1sc2CCCc2c1C(=O)OC	BroadT	BRD-K92780133	BRD-K92780133-001-05-0	ChemBridge Corporation	6692623			CCCCOC(=O)Nc1sc2CCCc2c1C(=O)OC	InChI=1S/C14H19NO4S/c1-3-4-8-19-14(17)15-12-11(13(16)18-2)9-6-5-7-10(9)20-12/h3-8H2,1-2H3,(H,15,17)	CAVOCRZWSBMIPC-UHFFFAOYSA-N	297.103478788							105891
SMR000169821	LSM-17253	SID17409341, BRD-K55599425	3638388	InChI=1S/C20H14Cl2N2O/c1-13-5-7-14(8-6-13)16-9-15(10-23)20(25)24(11-16)12-17-18(21)3-2-4-19(17)22/h2-9,11H,12H2,1H3	WCIVZHUWXNSBKG-UHFFFAOYSA-N	Cc1ccc(cc1)C2=CN(Cc3c(Cl)cccc3Cl)C(=O)C(=C2)C#N	BroadT	BRD-K55599425	BRD-K55599425-001-05-6	Key Organics Ltd.	6J-588S			Cc1ccc(cc1)-c1cc(C#N)c(=O)n(Cc2c(Cl)cccc2Cl)c1	InChI=1S/C20H14Cl2N2O/c1-13-5-7-14(8-6-13)16-9-15(10-23)20(25)24(11-16)12-17-18(21)3-2-4-19(17)22/h2-9,11H,12H2,1H3	WCIVZHUWXNSBKG-UHFFFAOYSA-N	368.048318508							105892
SMR000172203	LSM-17254	SID17508888, BRD-A51100427	2908974	InChI=1S/C25H27N3O3S/c1-18-8-11-23(12-9-18)28(17-24(29)16-27-20(3)14-19(2)26-27)32(30,31)25-13-10-21-6-4-5-7-22(21)15-25/h4-15,24,29H,16-17H2,1-3H3	WHVQUFOUFLVPRB-UHFFFAOYSA-N	Cc1ccc(cc1)N(CC(O)Cn2nc(C)cc2C)S(=O)(=O)c3ccc4ccccc4c3	BroadT	BRD-A51100427	BRD-A51100427-001-05-7	Asinex Ltd.	BAS 03111816			Cc1cc(C)n(CC(O)CN(c2ccc(C)cc2)S(=O)(=O)c2ccc3ccccc3c2)n1	InChI=1S/C25H27N3O3S/c1-18-8-11-23(12-9-18)28(17-24(29)16-27-20(3)14-19(2)26-27)32(30,31)25-13-10-21-6-4-5-7-22(21)15-25/h4-15,24,29H,16-17H2,1-3H3	WHVQUFOUFLVPRB-UHFFFAOYSA-N	449.177312444							105893
N-(2,1,3-Benzothiadiazol-5-yl)-4,6-dimethyl-2-oxo-2H-pyran-5-carboxamide	LSM-17255	SID858095, BRD-K73873941	659450	InChI=1S/C14H11N3O3S/c1-7-5-12(18)20-8(2)13(7)14(19)15-9-3-4-10-11(6-9)17-21-16-10/h3-6H,1-2H3,(H,15,19)	CEKUCPDPBKGULU-UHFFFAOYSA-N	CC1=C(C(=O)Nc2ccc3nsnc3c2)C(=CC(=O)O1)C	BroadT	BRD-K73873941	BRD-K73873941-001-05-8	InterBioScreen Ltd.	STOCK2S-16521			Cc1cc(=O)oc(C)c1C(=O)Nc1ccc2nsnc2c1	InChI=1S/C14H11N3O3S/c1-7-5-12(18)20-8(2)13(7)14(19)15-9-3-4-10-11(6-9)17-21-16-10/h3-6H,1-2H3,(H,15,19)	CEKUCPDPBKGULU-UHFFFAOYSA-N	301.052111932							105894
MLS000716405	LSM-17256	SID24784769, BRD-K78684281	1093435	InChI=1S/C15H14ClN3O4S/c1-18-12-5-4-10(8-13(12)19(2)15(18)21)24(22,23)17-11-7-9(16)3-6-14(11)20/h3-8,17,20H,1-2H3	WSYGBZKFYNPOSI-UHFFFAOYSA-N	CN1C(=O)N(C)c2cc(ccc12)S(=O)(=O)Nc3cc(Cl)ccc3O	BroadT	BRD-K78684281	BRD-K78684281-001-05-2	Asinex Ltd.	BAS 09106172			Cn1c2ccc(cc2n(C)c1=O)S(=O)(=O)Nc1cc(Cl)ccc1O	InChI=1S/C15H14ClN3O4S/c1-18-12-5-4-10(8-13(12)19(2)15(18)21)24(22,23)17-11-7-9(16)3-6-14(11)20/h3-8,17,20H,1-2H3	WSYGBZKFYNPOSI-UHFFFAOYSA-N	367.039354358							105895
AC1LIIQO	LSM-43716	SID22402581, BRD-K50749858	932030	InChI=1S/C11H10N4O2/c1-17-6-2-3-7-8(4-6)14-10-9(7)13-5-15(12)11(10)16/h2-5,16H,12H2,1H3	OWUDIYGCDFKCBN-UHFFFAOYSA-N	COc1ccc2c(c1)nc3c(O)n(N)cnc23	BroadT	BRD-K50749858	BRD-K50749858-001-05-8	InterBioScreen Ltd.	STOCK3S-99313			COc1ccc2c(c1)nc1c(O)n(N)cnc21	InChI=1S/C11H10N4O2/c1-17-6-2-3-7-8(4-6)14-10-9(7)13-5-15(12)11(10)16/h2-5,16H,12H2,1H3	OWUDIYGCDFKCBN-UHFFFAOYSA-N	230.0803756							
AC1O98HX	LSM-17258	BRD-K75074283	6750062	InChI=1S/C23H22N6O5S/c1-15-19(22(30)29(27-15)17-7-5-4-6-8-17)14-24-16-9-11-18(12-10-16)35(31,32)28-20-13-21(33-2)26-23(25-20)34-3/h4-14,30H,1-3H3,(H,25,26,28)	KYPPVPPBTLGGCQ-UHFFFAOYSA-N	COc1cc(NS(=O)(=O)c2ccc(cc2)N=Cc3c(C)nn(c3O)c4ccccc4)nc(OC)n1	BroadT	BRD-K75074283	BRD-K75074283-001-05-7	ChemBridge Corporation	5623172			COc1cc(NS(=O)(=O)c2ccc(cc2)N=Cc2c(C)nn(c2O)-c2ccccc2)nc(OC)n1	InChI=1S/C23H22N6O5S/c1-15-19(22(30)29(27-15)17-7-5-4-6-8-17)14-24-16-9-11-18(12-10-16)35(31,32)28-20-13-21(33-2)26-23(25-20)34-3/h4-14,30H,1-3H3,(H,25,26,28)	KYPPVPPBTLGGCQ-UHFFFAOYSA-N	494.137238554							
SMR000077474	LSM-17259	SID4262896, BRD-K93701319	2214016	InChI=1S/C15H18N2O2S/c1-3-9-19-14-12(6-5-7-13(14)18-4-2)11-17-15-16-8-10-20-15/h3,5-8,10H,1,4,9,11H2,2H3,(H,16,17)	HATDOIIFKXUCRN-UHFFFAOYSA-N	CCOc1cccc(CNc2nccs2)c1OCC=C	BroadT	BRD-K93701319	BRD-K93701319-001-05-1	ChemBridge Corporation	7853731			CCOc1cccc(CNc2nccs2)c1OCC=C	InChI=1S/C15H18N2O2S/c1-3-9-19-14-12(6-5-7-13(14)18-4-2)11-17-15-16-8-10-20-15/h3,5-8,10H,1,4,9,11H2,2H3,(H,16,17)	HATDOIIFKXUCRN-UHFFFAOYSA-N	290.108898526							105898
3-[5-(2-Methoxy-ethylsulfanyl)-4-methyl-4H-[1,2,4]triazol-3-yl]-benzonitrile	LSM-17260	SID842679, BRD-K44716488	644950	InChI=1S/C13H14N4OS/c1-17-12(11-5-3-4-10(8-11)9-14)15-16-13(17)19-7-6-18-2/h3-5,8H,6-7H2,1-2H3	JUQOHHAILSTQRK-UHFFFAOYSA-N	COCCSc1nnc(c2cccc(c2)C#N)n1C	BroadT	BRD-K44716488	BRD-K44716488-001-05-4	Asinex Ltd.	ASN 07330984			COCCSc1nnc(-c2cccc(c2)C#N)n1C	InChI=1S/C13H14N4OS/c1-17-12(11-5-3-4-10(8-11)9-14)15-16-13(17)19-7-6-18-2/h3-5,8H,6-7H2,1-2H3	JUQOHHAILSTQRK-UHFFFAOYSA-N	274.088831798							105899
N-(3-Chlorophenyl)-1H-imidazole-4-carboxamide	LSM-17261	SID24276658, SID49649393, BRD-K43296758	5299205	InChI=1S/C10H8ClN3O/c11-7-2-1-3-8(4-7)14-10(15)9-5-12-6-13-9/h1-6H,(H,12,13)(H,14,15)	SLGHCWAHCAQQCA-UHFFFAOYSA-N	Clc1cccc(NC(=O)c2c[nH]cn2)c1	BroadT	BRD-K43296758	BRD-K43296758-001-05-1	ChemDiv Inc.	8017-5121			Clc1cccc(NC(=O)c2c[nH]cn2)c1	InChI=1S/C10H8ClN3O/c11-7-2-1-3-8(4-7)14-10(15)9-5-12-6-13-9/h1-6H,(H,12,13)(H,14,15)	SLGHCWAHCAQQCA-UHFFFAOYSA-N	221.035589616							105900
SMR000040207	LSM-17262	SID857888, BRD-K84989887	659232	InChI=1S/C19H23ClN4O5/c1-3-29-19(27)24-8-6-23(7-9-24)11-15(25)22-16-13-10-12(20)4-5-14(13)21-17(16)18(26)28-2/h4-5,10,21H,3,6-9,11H2,1-2H3,(H,22,25)	JAPDWJJDLBPWSC-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC(=O)Nc2c([nH]c3ccc(Cl)cc23)C(=O)OC)CC1	BroadT	BRD-K84989887	BRD-K84989887-001-05-5	InterBioScreen Ltd.	STOCK2S-04958			CCOC(=O)N1CCN(CC(=O)Nc2c([nH]c3ccc(Cl)cc23)C(=O)OC)CC1	InChI=1S/C19H23ClN4O5/c1-3-29-19(27)24-8-6-23(7-9-24)11-15(25)22-16-13-10-12(20)4-5-14(13)21-17(16)18(26)28-2/h4-5,10,21H,3,6-9,11H2,1-2H3,(H,22,25)	JAPDWJJDLBPWSC-UHFFFAOYSA-N	422.135697586							105901
SMR000194819	LSM-17263	BRD-A89631320	2895248	InChI=1S/C19H19ClN2O3S/c1-4-24-18(23)16-11(3)21-19(26)22-17(16)15-9-8-14(25-15)12-6-5-7-13(20)10(12)2/h5-9,17H,4H2,1-3H3,(H2,21,22,26)	YBOLUDTXMSDTRI-UHFFFAOYSA-N	CCOC(=O)C1=C(C)N=C(S)NC1c2oc(cc2)c3cccc(Cl)c3C	BroadT	BRD-A89631320	BRD-A89631320-001-05-5	ChemBridge Corporation	6373087			CCOC(=O)C1=C(C)N=C(S)NC1c1ccc(o1)-c1cccc(Cl)c1C	InChI=1S/C19H19ClN2O3S/c1-4-24-18(23)16-11(3)21-19(26)22-17(16)15-9-8-14(25-15)12-6-5-7-13(20)10(12)2/h5-9,17H,4H2,1-3H3,(H2,21,22,26)	YBOLUDTXMSDTRI-UHFFFAOYSA-N	390.080490888							105902
(3-Methyl-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)acetonitrile	LSM-17264	SID17406789, BRD-K82339068	830153	InChI=1S/C10H9N3O/c1-12-8-4-2-3-5-9(8)13(7-6-11)10(12)14/h2-5H,7H2,1H3	PUHRXUBGHPMXEK-UHFFFAOYSA-N	CN1C(=O)N(CC#N)c2ccccc12	BroadT	BRD-K82339068	BRD-K82339068-001-06-4	Specs	AF-615/31154060			Cn1c2ccccc2n(CC#N)c1=O	InChI=1S/C10H9N3O/c1-12-8-4-2-3-5-9(8)13(7-6-11)10(12)14/h2-5H,7H2,1H3	PUHRXUBGHPMXEK-UHFFFAOYSA-N	187.074561938							105903
SMR000070637	LSM-17265	SID4255388, BRD-K97754781	710309	InChI=1S/C15H19N3OS/c1-11-8-12(2)17-15(13(11)9-16)20-10-14(19)18-6-4-3-5-7-18/h8H,3-7,10H2,1-2H3	ZOCJVKYOIHAQNJ-UHFFFAOYSA-N	Cc1cc(C)c(C#N)c(SCC(=O)N2CCCCC2)n1	BroadT	BRD-K97754781	BRD-K97754781-001-06-3	ChemBridge Corporation	6087037			Cc1cc(C)c(C#N)c(SCC(=O)N2CCCCC2)n1	InChI=1S/C15H19N3OS/c1-11-8-12(2)17-15(13(11)9-16)20-10-14(19)18-6-4-3-5-7-18/h8H,3-7,10H2,1-2H3	ZOCJVKYOIHAQNJ-UHFFFAOYSA-N	289.124882948							105904
MLS000756471	LSM-17266	SID26664934, BRD-K35225716	306836	InChI=1S/C14H10Cl3NO3/c15-10-5-12(17)13(6-11(10)16)21-7-14(20)18-8-2-1-3-9(19)4-8/h1-6,19H,7H2,(H,18,20)	QFEKNTWDMBSFRL-UHFFFAOYSA-N	Oc1cccc(NC(=O)COc2cc(Cl)c(Cl)cc2Cl)c1	BroadT	BRD-K35225716	BRD-K35225716-001-05-1	National Cancer Institute Chemotherapeutic Agents Repository	204529			Oc1cccc(NC(=O)COc2cc(Cl)c(Cl)cc2Cl)c1	InChI=1S/C14H10Cl3NO3/c15-10-5-12(17)13(6-11(10)16)21-7-14(20)18-8-2-1-3-9(19)4-8/h1-6,19H,7H2,(H,18,20)	QFEKNTWDMBSFRL-UHFFFAOYSA-N	344.97262632							105905
T5331264	LSM-17267	SID3713458, BRD-K05230613	2998416	InChI=1S/C16H12N6O/c1-2-4-14(5-3-1)22-16(18-19-20-22)23-15-8-6-13(7-9-15)21-11-10-17-12-21/h1-12H	CBVWHRCGFLHGCV-UHFFFAOYSA-N	O(c1ccc(cc1)n2ccnc2)c3nnnn3c4ccccc4	BroadT	BRD-K05230613	BRD-K05230613-001-05-1	Enamine Ltd.	T5331264			O(c1nnnn1-c1ccccc1)c1ccc(cc1)-n1ccnc1	InChI=1S/C16H12N6O/c1-2-4-14(5-3-1)22-16(18-19-20-22)23-15-8-6-13(7-9-15)21-11-10-17-12-21/h1-12H	CBVWHRCGFLHGCV-UHFFFAOYSA-N	304.107259064							105906
BAS 11133255	LSM-17268	SID24822482, BRD-A59677526	5769936	InChI=1S/C17H13FN4O2/c18-10-4-3-5-11(8-10)19-16(24)14-9-15(23)21-17-20-12-6-1-2-7-13(12)22(14)17/h1-8,14H,9H2,(H,19,24)(H,20,21,23)	BJUDOKWNSGYHOC-UHFFFAOYSA-N	Fc1cccc(NC(=O)C2CC(=O)Nc3nc4ccccc4n23)c1	BroadT	BRD-A59677526	BRD-A59677526-001-05-6	Asinex Ltd.	BAS 11133255			Fc1cccc(NC(=O)C2CC(=O)Nc3nc4ccccc4n23)c1	InChI=1S/C17H13FN4O2/c18-10-4-3-5-11(8-10)19-16(24)14-9-15(23)21-17-20-12-6-1-2-7-13(12)22(14)17/h1-8,14H,9H2,(H,19,24)(H,20,21,23)	BJUDOKWNSGYHOC-UHFFFAOYSA-N	324.102253896							105907
N-(4-Methylphenyl)tetrazolo[1,5-a]quinoxalin-4-amine	LSM-17269	SID24810760, BRD-K53834778	16193211	InChI=1S/C15H12N6/c1-10-6-8-11(9-7-10)16-14-15-18-19-20-21(15)13-5-3-2-4-12(13)17-14/h2-9H,1H3,(H,16,17)	HMEJHPVPSAQVDV-UHFFFAOYSA-N	Cc1ccc(Nc2nc3ccccc3n4nnnc24)cc1	BroadT	BRD-K53834778	BRD-K53834778-001-05-2	ChemDiv Inc.	C301-0732			Cc1ccc(Nc2nc3ccccc3n3nnnc23)cc1	InChI=1S/C15H12N6/c1-10-6-8-11(9-7-10)16-14-15-18-19-20-21(15)13-5-3-2-4-12(13)17-14/h2-9H,1H3,(H,16,17)	HMEJHPVPSAQVDV-UHFFFAOYSA-N	276.112344444							105908
MLS000540824	LSM-17270	SID17386355, BRD-A60712775	3595113	InChI=1S/C20H25N3O4S2/c1-11-5-7-14-15(8-11)28-20(18(14)19(21)25)23-17(24)10-22-29(26,27)16-9-12(2)4-6-13(16)3/h4,6,9,11,22H,5,7-8,10H2,1-3H3,(H2,21,25)(H,23,24)	NBFOIWUHSGFVNS-UHFFFAOYSA-N	CC1CCc2c(C1)sc(NC(=O)CNS(=O)(=O)c3cc(C)ccc3C)c2C(=O)N	BroadT	BRD-A60712775	BRD-A60712775-001-07-2	Specs	AQ-750/42209132			CC1CCc2c(C1)sc(NC(=O)CNS(=O)(=O)c1cc(C)ccc1C)c2C(N)=O	InChI=1S/C20H25N3O4S2/c1-11-5-7-14-15(8-11)28-20(18(14)19(21)25)23-17(24)10-22-29(26,27)16-9-12(2)4-6-13(16)3/h4,6,9,11,22H,5,7-8,10H2,1-3H3,(H2,21,25)(H,23,24)	NBFOIWUHSGFVNS-UHFFFAOYSA-N	435.12864769							105909
MLS000119816	LSM-17271	SID7964665, BRD-K68824196	5307159	InChI=1S/C18H17ClN4O2/c19-14-6-3-5-12(8-14)16-9-18(25-22-16)20-17(24)11-23-10-13-4-1-2-7-15(13)21-23/h3,5-6,8-10H,1-2,4,7,11H2,(H,20,24)	CWYDCRJQKAYFQB-UHFFFAOYSA-N	Clc1cccc(c1)c2cc(NC(=O)Cn3cc4CCCCc4n3)on2	BroadT	BRD-K68824196	BRD-K68824196-001-04-3	ChemDiv Inc.	C881-0574			Clc1cccc(c1)-c1cc(NC(=O)Cn2cc3CCCCc3n2)on1	InChI=1S/C18H17ClN4O2/c19-14-6-3-5-12(8-14)16-9-18(25-22-16)20-17(24)11-23-10-13-4-1-2-7-15(13)21-23/h3,5-6,8-10H,1-2,4,7,11H2,(H,20,24)	CWYDCRJQKAYFQB-UHFFFAOYSA-N	356.104003534							105910
SMR000206457	LSM-17272	SID17509704, BRD-K54236639	12004946	InChI=1S/C20H15ClN2O3S/c1-25-15-8-7-11(9-16(15)26-2)22-20(24)17-10-13-18(27-17)12-5-3-4-6-14(12)23-19(13)21/h3-10H,1-2H3,(H,22,24)	RQGBASQSCCTIKS-UHFFFAOYSA-N	COc1ccc(NC(=O)c2cc3c(Cl)nc4ccccc4c3s2)cc1OC	BroadT	BRD-K54236639	BRD-K54236639-001-05-8	ChemDiv Inc.	C593-0019			COc1ccc(NC(=O)c2cc3c(Cl)nc4ccccc4c3s2)cc1OC	InChI=1S/C20H15ClN2O3S/c1-25-15-8-7-11(9-16(15)26-2)22-20(24)17-10-13-18(27-17)12-5-3-4-6-14(12)23-19(13)21/h3-10H,1-2H3,(H,22,24)	RQGBASQSCCTIKS-UHFFFAOYSA-N	398.04919076							105911
MLS000554380	LSM-17273	SID14730537, BRD-A67481961	3772905	InChI=1S/C21H18F3O4P/c1-16-9-8-14-19(15-16)27-29(25,26-18-12-6-3-7-13-18)28-20(21(22,23)24)17-10-4-2-5-11-17/h2-15,20H,1H3	NJUYNBCHRXCGCK-UHFFFAOYSA-N	Cc1cccc(OP(=O)(OC(c2ccccc2)C(F)(F)F)Oc3ccccc3)c1	BroadT	BRD-A67481961	BRD-A67481961-001-05-5	InterBioScreen Ltd.	STOCK1S-62309			Cc1cccc(OP(=O)(OC(c2ccccc2)C(F)(F)F)Oc2ccccc2)c1	InChI=1S/C21H18F3O4P/c1-16-9-8-14-19(15-16)27-29(25,26-18-12-6-3-7-13-18)28-20(21(22,23)24)17-10-4-2-5-11-17/h2-15,20H,1H3	NJUYNBCHRXCGCK-UHFFFAOYSA-N	422.089480166							105912
AC1M9EOE	LSM-3145	BRD-K51745483, SID85248337, SID99495681	2557019	InChI=1S/C25H21N3O2S/c29-23(26-19-14-13-17-7-6-8-18(17)15-19)16-31-25-27-22-12-5-4-11-21(22)24(30)28(25)20-9-2-1-3-10-20/h1-5,9-15H,6-8,16H2,(H,26,29)	UKEAGBNVKRIELQ-UHFFFAOYSA-N	O=C(CSC1=Nc2ccccc2C(=O)N1c3ccccc3)Nc4ccc5CCCc5c4	BroadT	BRD-K51745483	BRD-K51745483-001-01-7	Sanford-Burnham Medical Research Institute	MLS-0425600			O=C(CSc1nc2ccccc2c(=O)n1-c1ccccc1)Nc1ccc2CCCc2c1	InChI=1S/C25H21N3O2S/c29-23(26-19-14-13-17-7-6-8-18(17)15-19)16-31-25-27-22-12-5-4-11-21(22)24(30)28(25)20-9-2-1-3-10-20/h1-5,9-15H,6-8,16H2,(H,26,29)	UKEAGBNVKRIELQ-UHFFFAOYSA-N	427.135447632							92900
3-{[(3,5-Dimethylanilino)carbonyl]amino}-n,n,4-trimethylbenzenesulfonamide	LSM-17274	SID26730490, BRD-K80726734	2812298	InChI=1S/C18H23N3O3S/c1-12-8-13(2)10-15(9-12)19-18(22)20-17-11-16(7-6-14(17)3)25(23,24)21(4)5/h6-11H,1-5H3,(H2,19,20,22)	CHGGHWRLXQQEOU-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)Nc2cc(C)cc(C)c2)c1	BroadT	BRD-K80726734	BRD-K80726734-001-04-3	Maybridge	HTS 05240			CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)Nc2cc(C)cc(C)c2)c1	InChI=1S/C18H23N3O3S/c1-12-8-13(2)10-15(9-12)19-18(22)20-17-11-16(7-6-14(17)3)25(23,24)21(4)5/h6-11H,1-5H3,(H2,19,20,22)	CHGGHWRLXQQEOU-UHFFFAOYSA-N	361.146012316							105913
STK248653	LSM-17275	SID49642434, BRD-K30133833	767921	InChI=1S/C11H6BrCl2NO2/c12-10-4-3-9(17-10)11(16)15-8-2-1-6(13)5-7(8)14/h1-5H,(H,15,16)	WLGDEQDNCRILHR-UHFFFAOYSA-N	Clc1ccc(NC(=O)c2oc(Br)cc2)c(Cl)c1	BroadT	BRD-K30133833	BRD-K30133833-001-05-0	Asinex Ltd.	BAS 00391164			Clc1ccc(NC(=O)c2ccc(Br)o2)c(Cl)c1	InChI=1S/C11H6BrCl2NO2/c12-10-4-3-9(17-10)11(16)15-8-2-1-6(13)5-7(8)14/h1-5H,(H,15,16)	WLGDEQDNCRILHR-UHFFFAOYSA-N	332.895896462							105914
5K-020	LSM-17276	SID17411522, BRD-K87590304	1479257	InChI=1S/C17H10BrClF3N3O/c18-11-3-5-12(6-4-11)24-16(26)14-2-1-7-25(14)15-13(19)8-10(9-23-15)17(20,21)22/h1-9H,(H,24,26)	IDORJFJJBZIYQI-UHFFFAOYSA-N	FC(F)(F)c1cnc(c(Cl)c1)n2cccc2C(=O)Nc3ccc(Br)cc3	BroadT	BRD-K87590304	BRD-K87590304-001-05-3	Key Organics Ltd.	5K-020			FC(F)(F)c1cnc(c(Cl)c1)-n1cccc1C(=O)Nc1ccc(Br)cc1	InChI=1S/C17H10BrClF3N3O/c18-11-3-5-12(6-4-11)24-16(26)14-2-1-7-25(14)15-13(19)8-10(9-23-15)17(20,21)22/h1-9H,(H,24,26)	IDORJFJJBZIYQI-UHFFFAOYSA-N	442.96478688							105915
AC1MMCOT	LSM-17277	SID4241745, BRD-K98801667	3236680	InChI=1S/C17H18N2O4/c1-21-12-3-5-13-11(10-12)2-4-14-15(18-23-16(13)14)17(20)19-6-8-22-9-7-19/h3,5,10H,2,4,6-9H2,1H3	XFEFQRWGQSMSCB-UHFFFAOYSA-N	COc1ccc2c(CCc3c2onc3C(=O)N4CCOCC4)c1	BroadT	BRD-K98801667	BRD-K98801667-001-05-2	ChemDiv Inc.	C226-4022			COc1ccc2-c3onc(C(=O)N4CCOCC4)c3CCc2c1	InChI=1S/C17H18N2O4/c1-21-12-3-5-13-11(10-12)2-4-14-15(18-23-16(13)14)17(20)19-6-8-22-9-7-19/h3,5,10H,2,4,6-9H2,1H3	XFEFQRWGQSMSCB-UHFFFAOYSA-N	314.126657076							105916
2,5-Diethoxy-4-tetrazol-1-yl-n-(2-o-tolyl-ethyl)-benzenesulfonamide	LSM-17278	SID847918, BRD-K92207188	650336	InChI=1S/C20H25N5O4S/c1-4-28-18-13-20(19(29-5-2)12-17(18)25-14-21-23-24-25)30(26,27)22-11-10-16-9-7-6-8-15(16)3/h6-9,12-14,22H,4-5,10-11H2,1-3H3	ODYBWCSDOHUZFX-UHFFFAOYSA-N	CCOc1cc(c(OCC)cc1n2cnnn2)S(=O)(=O)NCCc3ccccc3C	BroadT	BRD-K92207188	BRD-K92207188-001-05-8	Asinex Ltd.	ASN 04886956			CCOc1cc(c(OCC)cc1-n1cnnn1)S(=O)(=O)NCCc1ccccc1C	InChI=1S/C20H25N5O4S/c1-4-28-18-13-20(19(29-5-2)12-17(18)25-14-21-23-24-25)30(26,27)22-11-10-16-9-7-6-8-15(16)3/h6-9,12-14,22H,4-5,10-11H2,1-3H3	ODYBWCSDOHUZFX-UHFFFAOYSA-N	431.16272502							105917
SMR000028636	LSM-17279	SID4241940, BRD-K59905302	3236853	InChI=1S/C22H18N2O6/c1-27-13-9-10-15(18(12-13)28-2)23-22(26)20-19(14-6-3-4-7-16(14)30-20)24-21(25)17-8-5-11-29-17/h3-12H,1-2H3,(H,23,26)(H,24,25)	STOSYUMRHHORSV-UHFFFAOYSA-N	COc1ccc(NC(=O)c2oc3ccccc3c2NC(=O)c4occc4)c(OC)c1	BroadT	BRD-K59905302	BRD-K59905302-001-05-9	ChemDiv Inc.	C686-1380			COc1ccc(NC(=O)c2oc3ccccc3c2NC(=O)c2ccco2)c(OC)c1	InChI=1S/C22H18N2O6/c1-27-13-9-10-15(18(12-13)28-2)23-22(26)20-19(14-6-3-4-7-16(14)30-20)24-21(25)17-8-5-11-29-17/h3-12H,1-2H3,(H,23,26)(H,24,25)	STOSYUMRHHORSV-UHFFFAOYSA-N	406.116486316							105918
SMR000137086	LSM-17280	SID14733798, SID56321069, BRD-A51245852	2831426	InChI=1S/C17H13Cl5N4O4S/c1-30-9-3-5-12(13(7-9)26(28)29)23-16(31)25-15(17(20,21)22)24-14(27)10-4-2-8(18)6-11(10)19/h2-7,15H,1H3,(H,24,27)(H2,23,25,31)	DDCSQBQSULUGNJ-UHFFFAOYSA-N	COc1ccc(N=C(S)NC(NC(=O)c2ccc(Cl)cc2Cl)C(Cl)(Cl)Cl)c(c1)[N+](=O)[O-]	BroadT	BRD-A51245852	BRD-A51245852-001-06-2	ChemBridge Corporation	5159076			COc1ccc(N=C(S)NC(NC(=O)c2ccc(Cl)cc2Cl)C(Cl)(Cl)Cl)c(c1)[N+]([O-])=O	InChI=1S/C17H13Cl5N4O4S/c1-30-9-3-5-12(13(7-9)26(28)29)23-16(31)25-15(17(20,21)22)24-14(27)10-4-2-8(18)6-11(10)19/h2-7,15H,1H3,(H,24,27)(H2,23,25,31)	DDCSQBQSULUGNJ-UHFFFAOYSA-N	543.910014176							105919
MLS000327538	LSM-17281	SID17402574, BRD-K40377800	54687582	InChI=1S/C15H13NO4/c1-8(2)16-10-6-4-3-5-9(10)14-13(15(16)19)11(17)7-12(18)20-14/h3-8,18H,1-2H3	PYVZWZCDFVVDRH-UHFFFAOYSA-N	CC(C)N1C(=O)C2=C(OC(=CC2=O)O)c3ccccc13	BroadT	BRD-K40377800	BRD-K40377800-001-06-8	Key Organics Ltd.	8X-0978			CC(C)n1c2ccccc2c2oc(O)cc(=O)c2c1=O	InChI=1S/C15H13NO4/c1-8(2)16-10-6-4-3-5-9(10)14-13(15(16)19)11(17)7-12(18)20-14/h3-8,18H,1-2H3	PYVZWZCDFVVDRH-UHFFFAOYSA-N	271.084457906							
AN-023/13177260	LSM-17282	SID14740617, BRD-K92995730	1007339	InChI=1S/C18H14BrNO3/c1-22-16-5-3-2-4-14(16)20-18(21)17-11-10-15(23-17)12-6-8-13(19)9-7-12/h2-11H,1H3,(H,20,21)	MRBXGCKSWCHGMQ-UHFFFAOYSA-N	COc1ccccc1NC(=O)c2oc(cc2)c3ccc(Br)cc3	BroadT	BRD-K92995730	BRD-K92995730-001-05-1	ChemBridge Corporation	6593768			COc1ccccc1NC(=O)c1ccc(o1)-c1ccc(Br)cc1	InChI=1S/C18H14BrNO3/c1-22-16-5-3-2-4-14(16)20-18(21)17-11-10-15(23-17)12-6-8-13(19)9-7-12/h2-11H,1H3,(H,20,21)	MRBXGCKSWCHGMQ-UHFFFAOYSA-N	371.015705918							105921
MLS000589593	LSM-17283	SID17511798, BRD-K74790716	4594066	InChI=1S/C11H8N4O6/c1-21-11(16)7-4-8(14(17)18)10(9(5-7)15(19)20)13-3-2-12-6-13/h2-6H,1H3	SDDIPIYYPSFJAV-UHFFFAOYSA-N	COC(=O)c1cc(c(c(c1)[N+](=O)[O-])n2ccnc2)[N+](=O)[O-]	BroadT	BRD-K74790716	BRD-K74790716-001-06-4	InterBioScreen Ltd.	STOCK1S-01867			COC(=O)c1cc(c(c(c1)[N+]([O-])=O)-n1ccnc1)[N+]([O-])=O	InChI=1S/C11H8N4O6/c1-21-11(16)7-4-8(14(17)18)10(9(5-7)15(19)20)13-3-2-12-6-13/h2-6H,1H3	SDDIPIYYPSFJAV-UHFFFAOYSA-N	292.044384016							105922
MLS000769523	LSM-17284	SID26663818, BRD-K24425006	1524486	InChI=1S/C20H18N4O3S/c1-2-11-24-18(21)16(28(26,27)14-8-4-3-5-9-14)13-15-19(24)22-17-10-6-7-12-23(17)20(15)25/h3-10,12-13,21H,2,11H2,1H3	RFRKXWSSFQLIFP-UHFFFAOYSA-N	CCCN1C(=N)C(=CC2=C1N=C3C=CC=CN3C2=O)S(=O)(=O)c4ccccc4	BroadT	BRD-K24425006	BRD-K24425006-001-05-9	InterBioScreen Ltd.	STOCK3S-77987			CCCn1c2nc3ccccn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccccc1	InChI=1S/C20H18N4O3S/c1-2-11-24-18(21)16(28(26,27)14-8-4-3-5-9-14)13-15-19(24)22-17-10-6-7-12-23(17)20(15)25/h3-10,12-13,21H,2,11H2,1H3	RFRKXWSSFQLIFP-UHFFFAOYSA-N	394.109961166							105923
ZINC02626667	LSM-17285	SID24830637, BRD-K87329646	2088974	InChI=1S/C17H13N3OS2/c21-16(20-17-18-7-9-23-17)12-10-14(15-6-3-8-22-15)19-13-5-2-1-4-11(12)13/h1-6,8,10H,7,9H2,(H,18,20,21)	ZFRKOHPNQZAMPX-UHFFFAOYSA-N	O=C(NC1=NCCS1)c2cc(nc3ccccc23)c4cccs4	BroadT	BRD-K87329646	BRD-K87329646-001-05-3	Enamine Ltd.	T5268782			O=C(NC1=NCCS1)c1cc(nc2ccccc12)-c1cccs1	InChI=1S/C17H13N3OS2/c21-16(20-17-18-7-9-23-17)12-10-14(15-6-3-8-22-15)19-13-5-2-1-4-11(12)13/h1-6,8,10H,7,9H2,(H,18,20,21)	ZFRKOHPNQZAMPX-UHFFFAOYSA-N	339.050003446							105924
ST51026036	LSM-17286	SID24803814, BRD-K60268575	1325691	InChI=1S/C17H18N4OS2/c23-16-14-13(18-9-19-16)12-10-3-1-2-4-11(10)15(20-17(12)24-14)21-5-7-22-8-6-21/h9H,1-8H2,(H,18,19,23)	KVVASTRPZBEADU-UHFFFAOYSA-N	Sc1ncnc2c1sc3nc(N4CCOCC4)c5CCCCc5c23	BroadT	BRD-K60268575	BRD-K60268575-001-06-7	ChemBridge Corporation	6946637			Sc1ncnc2c1sc1nc(N3CCOCC3)c3CCCCc3c21	InChI=1S/C17H18N4OS2/c23-16-14-13(18-9-19-16)12-10-3-1-2-4-11(10)15(20-17(12)24-14)21-5-7-22-8-6-21/h9H,1-8H2,(H,18,19,23)	KVVASTRPZBEADU-UHFFFAOYSA-N	358.092202616							105925
AC1NVS3P	LSM-43717	SID24791450, BRD-K16460672	5625022	InChI=1S/C21H13N3OS2/c25-20-18(12-19-22-16-7-3-4-8-17(16)23-19)27-21(26)24(20)15-10-9-13-5-1-2-6-14(13)11-15/h1-12H,(H,22,23)/b18-12-	GYGIPHJLPJQMGM-PDGQHHTCSA-N	O=C1N(C(=S)S/C/1=C\c2nc3ccccc3[nH]2)c4ccc5ccccc5c4	BroadT	BRD-K16460672	BRD-K16460672-001-05-9	InterBioScreen Ltd.	STOCK5S-27536			O=C1N(C(=S)S\C1=C/c1nc2ccccc2[nH]1)c1ccc2ccccc2c1	InChI=1S/C21H13N3OS2/c25-20-18(12-19-22-16-7-3-4-8-17(16)23-19)27-21(26)24(20)15-10-9-13-5-1-2-6-14(13)11-15/h1-12H,(H,22,23)/b18-12-	GYGIPHJLPJQMGM-PDGQHHTCSA-N	387.050003446							
SMR000220179	LSM-43718	SID22401759, BRD-K49623464	5917611	InChI=1S/C27H22N6O2S/c1-32(2)36(34,35)23-12-8-9-19(16-23)26-21(18-33(31-26)22-10-4-3-5-11-22)15-20(17-28)27-29-24-13-6-7-14-25(24)30-27/h3-16,18H,1-2H3,(H,29,30)/b20-15+	PSDPERIMKWHVLJ-HMMYKYKNSA-N	CN(C)S(=O)(=O)c1cccc(c1)c2nn(cc2\C=C(/C#N)\c3nc4ccccc4[nH]3)c5ccccc5	BroadT	BRD-K49623464	BRD-K49623464-001-05-5	InterBioScreen Ltd.	STOCK4S-34112			CN(C)S(=O)(=O)c1cccc(c1)-c1nn(cc1\C=C(/C#N)c1nc2ccccc2[nH]1)-c1ccccc1	InChI=1S/C27H22N6O2S/c1-32(2)36(34,35)23-12-8-9-19(16-23)26-21(18-33(31-26)22-10-4-3-5-11-22)15-20(17-28)27-29-24-13-6-7-14-25(24)30-27/h3-16,18H,1-2H3,(H,29,30)/b20-15+	PSDPERIMKWHVLJ-HMMYKYKNSA-N	494.152494694							
ZINC01116135	LSM-17289	SID22416303, BRD-K07864267	1293817	InChI=1S/C18H18N4O4S/c23-17(13-5-7-14(8-6-13)22(24)25)20-18(27)19-15-3-1-2-4-16(15)21-9-11-26-12-10-21/h1-8H,9-12H2,(H2,19,20,23,27)	WQEFBCCCYGECQY-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)C(=O)NC(=S)Nc2ccccc2N3CCOCC3	BroadT	BRD-K07864267	BRD-K07864267-001-05-4	ChemBridge Corporation	7288923			[O-][N+](=O)c1ccc(cc1)C(=O)NC(=S)Nc1ccccc1N1CCOCC1	InChI=1S/C18H18N4O4S/c23-17(13-5-7-14(8-6-13)22(24)25)20-18(27)19-15-3-1-2-4-16(15)21-9-11-26-12-10-21/h1-8H,9-12H2,(H2,19,20,23,27)	WQEFBCCCYGECQY-UHFFFAOYSA-N	386.104875786							105928
AC1LGCKH	LSM-17290	SID7977850, BRD-K05777768	792513	InChI=1S/C11H7ClN4/c12-11-14-13-10-7-6-9(15-16(10)11)8-4-2-1-3-5-8/h1-7H	IWCCSYIXLLUUAF-UHFFFAOYSA-N	Clc1nnc2ccc(nn12)c3ccccc3	BroadT	BRD-K05777768	BRD-K05777768-001-05-4	ChemBridge Corporation	5261929			Clc1nnc2ccc(nn12)-c1ccccc1	InChI=1S/C11H7ClN4/c12-11-14-13-10-7-6-9(15-16(10)11)8-4-2-1-3-5-8/h1-7H	IWCCSYIXLLUUAF-UHFFFAOYSA-N	230.035923974							105929
SMR000067481	LSM-17291	SID3712379, SID89851650, BRD-K40629436	2161878	InChI=1S/C18H12N4O3/c23-17-13-6-2-4-8-15(13)20-21-22(17)11-25-18(24)16-10-9-12-5-1-3-7-14(12)19-16/h1-10H,11H2	ZFSRUYACTOGADA-UHFFFAOYSA-N	O=C(OCN1N=Nc2ccccc2C1=O)c3ccc4ccccc4n3	BroadT	BRD-K40629436	BRD-K40629436-001-04-9	Enamine Ltd.	T5268216			O=C(OCn1nnc2ccccc2c1=O)c1ccc2ccccc2n1	InChI=1S/C18H12N4O3/c23-17-13-6-2-4-8-15(13)20-21-22(17)11-25-18(24)16-10-9-12-5-1-3-7-14(12)19-16/h1-10H,11H2	ZFSRUYACTOGADA-UHFFFAOYSA-N	332.090940284							105930
STK000171	LSM-17292	SID24808582, BRD-K30213116	750225	InChI=1S/C15H19N3O/c1-15(2)8-13-12(10-19-15)7-11(9-16)14(17-13)18-5-3-4-6-18/h7H,3-6,8,10H2,1-2H3	KOIYSPQCHPNVGU-UHFFFAOYSA-N	CC1(C)Cc2nc(N3CCCC3)c(cc2CO1)C#N	BroadT	BRD-K30213116	BRD-K30213116-001-06-6	Asinex Ltd.	BAS 02747761			CC1(C)Cc2nc(N3CCCC3)c(cc2CO1)C#N	InChI=1S/C15H19N3O/c1-15(2)8-13-12(10-19-15)7-11(9-16)14(17-13)18-5-3-4-6-18/h7H,3-6,8,10H2,1-2H3	KOIYSPQCHPNVGU-UHFFFAOYSA-N	257.152812258							105931
AC1MGJUU	LSM-17293	SID4255022, BRD-A96444402	2937026	InChI=1S/C14H15ClN2O4/c1-16(8-13(19)21-2)11-7-12(18)17(14(11)20)10-5-3-9(15)4-6-10/h3-6,11H,7-8H2,1-2H3	PORZWAKMDSHJPG-UHFFFAOYSA-N	COC(=O)CN(C)C1CC(=O)N(C1=O)c2ccc(Cl)cc2	BroadT	BRD-A96444402	BRD-A96444402-001-05-5	ChemBridge Corporation	7361872			COC(=O)CN(C)C1CC(=O)N(C1=O)c1ccc(Cl)cc1	InChI=1S/C14H15ClN2O4/c1-16(8-13(19)21-2)11-7-12(18)17(14(11)20)10-5-3-9(15)4-6-10/h3-6,11H,7-8H2,1-2H3	PORZWAKMDSHJPG-UHFFFAOYSA-N	310.07203469							105932
AG-389/15407002	LSM-17294	SID22414718, BRD-K25423174	822882	InChI=1S/C9H8ClN3S/c1-6-11-12-9(14)13(6)8-4-2-3-7(10)5-8/h2-5H,1H3,(H,12,14)	UBQLDJNFYUHKTK-UHFFFAOYSA-N	Cc1nnc(S)n1c2cccc(Cl)c2	BroadT	BRD-K25423174	BRD-K25423174-001-05-9	Specs	AG-389/15407002			Cc1nnc(S)n1-c1cccc(Cl)c1	InChI=1S/C9H8ClN3S/c1-6-11-12-9(14)13(6)8-4-2-3-7(10)5-8/h2-5H,1H3,(H,12,14)	UBQLDJNFYUHKTK-UHFFFAOYSA-N	225.012745686							105933
SMR000187249	LSM-17295	SID17411884, BRD-A98436252	2870331	InChI=1S/C22H28BrN5O3/c23-17-6-7-19(26-20(29)8-9-28-10-12-31-13-11-28)18(14-17)22(25-15-21(30)27-24)16-4-2-1-3-5-16/h1-7,14,22,25H,8-13,15,24H2,(H,26,29)(H,27,30)	QVMZLLLNHPRRCY-UHFFFAOYSA-N	NNC(=O)CNC(c1ccccc1)c2cc(Br)ccc2NC(=O)CCN3CCOCC3	BroadT	BRD-A98436252	BRD-A98436252-001-05-0	ChemBridge Corporation	5808034			NNC(=O)CNC(c1ccccc1)c1cc(Br)ccc1NC(=O)CCN1CCOCC1	InChI=1S/C22H28BrN5O3/c23-17-6-7-19(26-20(29)8-9-28-10-12-31-13-11-28)18(14-17)22(25-15-21(30)27-24)16-4-2-1-3-5-16/h1-7,14,22,25H,8-13,15,24H2,(H,26,29)(H,27,30)	QVMZLLLNHPRRCY-UHFFFAOYSA-N	489.137552406							105934
F1495-2714	LSM-17296	SID22401676, BRD-K18764540	3290148	InChI=1S/C24H16N4O4/c29-24(25-17-10-12-19(13-11-17)28(30)31)20-15-27(18-7-2-1-3-8-18)26-23(20)22-14-16-6-4-5-9-21(16)32-22/h1-15H,(H,25,29)	ZISNFUWXYMUHOP-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NC(=O)c2cn(nc2c3oc4ccccc4c3)c5ccccc5)cc1	BroadT	BRD-K18764540	BRD-K18764540-001-05-2	Enamine Ltd.	T5211092			[O-][N+](=O)c1ccc(NC(=O)c2cn(nc2-c2cc3ccccc3o2)-c2ccccc2)cc1	InChI=1S/C24H16N4O4/c29-24(25-17-10-12-19(13-11-17)28(30)31)20-15-27(18-7-2-1-3-8-18)26-23(20)22-14-16-6-4-5-9-21(16)32-22/h1-15H,(H,25,29)	ZISNFUWXYMUHOP-UHFFFAOYSA-N	424.117155032							105935
MLS000035292	LSM-17297	SID850071, BRD-K00480854	652580	InChI=1S/C19H21FN4O/c1-12-13(2)21-18-17(15-4-6-16(20)7-5-15)14(3)22-24(18)19(12)23-8-10-25-11-9-23/h4-7H,8-11H2,1-3H3	QRGXILGBPGTIAD-UHFFFAOYSA-N	Cc1nc2c(c(C)nn2c(N3CCOCC3)c1C)c4ccc(F)cc4	BroadT	BRD-K00480854	BRD-K00480854-001-05-5	Asinex Ltd.	ASN 09719441			Cc1nn2c(N3CCOCC3)c(C)c(C)nc2c1-c1ccc(F)cc1	InChI=1S/C19H21FN4O/c1-12-13(2)21-18-17(15-4-6-16(20)7-5-15)14(3)22-24(18)19(12)23-8-10-25-11-9-23/h4-7H,8-11H2,1-3H3	QRGXILGBPGTIAD-UHFFFAOYSA-N	340.169939532							105936
T5310886	LSM-17298	SID22408922, BRD-K89552174	2453706	InChI=1S/C24H23N3O5S/c1-3-27-21-10-5-4-9-19(21)20-14-17(11-12-22(20)27)26-23(28)15-32-24(29)16-7-6-8-18(13-16)33(30,31)25-2/h4-14,25H,3,15H2,1-2H3,(H,26,28)	XIDCKCNBJMDMRK-UHFFFAOYSA-N	CCn1c2ccccc2c3cc(NC(=O)COC(=O)c4cccc(c4)S(=O)(=O)NC)ccc13	BroadT	BRD-K89552174	BRD-K89552174-001-05-8	Enamine Ltd.	T5310886			CCn1c2ccccc2c2cc(NC(=O)COC(=O)c3cccc(c3)S(=O)(=O)NC)ccc12	InChI=1S/C24H23N3O5S/c1-3-27-21-10-5-4-9-19(21)20-14-17(11-12-22(20)27)26-23(28)15-32-24(29)16-7-6-8-18(13-16)33(30,31)25-2/h4-14,25H,3,15H2,1-2H3,(H,26,28)	XIDCKCNBJMDMRK-UHFFFAOYSA-N	465.135841556							105937
STK118484	LSM-17299	SID14727245, BRD-K67896714	1096467	InChI=1S/C16H15BrN4/c1-21-15(13-4-6-14(17)7-5-13)11-20-16(21)19-10-12-3-2-8-18-9-12/h2-9,11H,10H2,1H3,(H,19,20)	XGRDDAXHCITUGZ-UHFFFAOYSA-N	Cn1c(NCc2cccnc2)ncc1c3ccc(Br)cc3	BroadT	BRD-K67896714	BRD-K67896714-001-05-2	Asinex Ltd.	BAS 11100005			Cn1c(NCc2cccnc2)ncc1-c1ccc(Br)cc1	InChI=1S/C16H15BrN4/c1-21-15(13-4-6-14(17)7-5-13)11-20-16(21)19-10-12-3-2-8-18-9-12/h2-9,11H,10H2,1H3,(H,19,20)	XGRDDAXHCITUGZ-UHFFFAOYSA-N	342.04800912							105938
NSC202097	LSM-17300	SID24781975, BRD-A68588186	305330	InChI=1S/C17H15NO3/c19-16-13-7-1-4-11-5-2-8-14(15(11)13)17(20)18(16)10-12-6-3-9-21-12/h1-2,4-5,7-8,12H,3,6,9-10H2	ZOASFBHPCHNXHZ-UHFFFAOYSA-N	O=C1N(CC2CCCO2)C(=O)c3cccc4cccc1c34	BroadT	BRD-A68588186	BRD-A68588186-001-05-5	Asinex Ltd.	BAS 00533668			O=C1N(CC2CCCO2)C(=O)c2cccc3cccc1c23	InChI=1S/C17H15NO3/c19-16-13-7-1-4-11-5-2-8-14(15(11)13)17(20)18(16)10-12-6-3-9-21-12/h1-2,4-5,7-8,12H,3,6,9-10H2	ZOASFBHPCHNXHZ-UHFFFAOYSA-N	281.10519335							105939
4-[5-(3-Chloro-4-methylphenyl)-1,2,4-oxadiazol-3-yl]pyridine	LSM-17301	SID49641347, BRD-K05664043	806991	InChI=1S/C14H10ClN3O/c1-9-2-3-11(8-12(9)15)14-17-13(18-19-14)10-4-6-16-7-5-10/h2-8H,1H3	QTCYFCFPPOXVSX-UHFFFAOYSA-N	Cc1ccc(cc1Cl)c2onc(n2)c3ccncc3	BroadT	BRD-K05664043	BRD-K05664043-001-05-1	Asinex Ltd.	BAS 03289580			Cc1ccc(cc1Cl)-c1nc(no1)-c1ccncc1	InChI=1S/C14H10ClN3O/c1-9-2-3-11(8-12(9)15)14-17-13(18-19-14)10-4-6-16-7-5-10/h2-8H,1H3	QTCYFCFPPOXVSX-UHFFFAOYSA-N	271.05123968							105940
MLS000766496	LSM-17302	SID24824993, BRD-K85802077	16195854	InChI=1S/C35H37N3O5/c1-25(40)38-22-31(30-9-5-6-10-32(30)38)29-19-33(43-34(20-29)42-24-28-13-11-27(23-39)12-14-28)35(41)37-17-15-36(16-18-37)21-26-7-3-2-4-8-26/h2-14,19,22,29,34,39H,15-18,20-21,23-24H2,1H3/t29-,34+/m0/s1	VTQGVLJZPVITEX-ZBWWXOROSA-N	CC(=O)n1cc([C@@H]2C[C@H](OCc3ccc(CO)cc3)OC(=C2)C(=O)N4CCN(Cc5ccccc5)CC4)c6ccccc16	BroadT	BRD-K85802077	BRD-K85802077-001-07-5	Harvard University	1-(3-((2R,4R)-6-(4-benzylpiperazine-1-carbonyl)-2-(4-(hydroxymethyl)benzyloxy)-3,4-dihydro-2H-pyran-4-yl)-1H-indol-1-yl)ethanone DHPC11_001319			CC(=O)n1cc([C@@H]2C[C@H](OCc3ccc(CO)cc3)OC(=C2)C(=O)N2CCN(Cc3ccccc3)CC2)c2ccccc12	InChI=1S/C35H37N3O5/c1-25(40)38-22-31(30-9-5-6-10-32(30)38)29-19-33(43-34(20-29)42-24-28-13-11-27(23-39)12-14-28)35(41)37-17-15-36(16-18-37)21-26-7-3-2-4-8-26/h2-14,19,22,29,34,39H,15-18,20-21,23-24H2,1H3/t29-,34+/m0/s1	VTQGVLJZPVITEX-ZBWWXOROSA-N	579.273321314							105941
2-(4-Methoxyphenyl)quinazolin-4-ol	LSM-17303	SID519282, SID49643183, BRD-K11314985	388017	InChI=1S/C15H12N2O2/c1-19-11-8-6-10(7-9-11)14-16-13-5-3-2-4-12(13)15(18)17-14/h2-9H,1H3,(H,16,17,18)	HETSSARHFAGODR-UHFFFAOYSA-N	COc1ccc(cc1)c2nc(O)c3ccccc3n2	BroadT	BRD-K11314985	BRD-K11314985-001-06-3	Asinex Ltd.	BAS 06107242			COc1ccc(cc1)-c1nc(O)c2ccccc2n1	InChI=1S/C15H12N2O2/c1-19-11-8-6-10(7-9-11)14-16-13-5-3-2-4-12(13)15(18)17-14/h2-9H,1H3,(H,16,17,18)	HETSSARHFAGODR-UHFFFAOYSA-N	252.089877644							105942
SMR000028351	LSM-17304	SID4241655, BRD-A46212887	3236601	InChI=1S/C19H20N2O4/c1-23-15-7-3-13(4-8-15)12-20-19(22)18-11-17(21-25-18)14-5-9-16(24-2)10-6-14/h3-10,18H,11-12H2,1-2H3,(H,20,22)	BDJZDFVNWBMFJO-UHFFFAOYSA-N	COc1ccc(CNC(=O)C2CC(=NO2)c3ccc(OC)cc3)cc1	BroadT	BRD-A46212887	BRD-A46212887-001-05-1	ChemDiv Inc.	C651-0061			COc1ccc(CNC(=O)C2CC(=NO2)c2ccc(OC)cc2)cc1	InChI=1S/C19H20N2O4/c1-23-15-7-3-13(4-8-15)12-20-19(22)18-11-17(21-25-18)14-5-9-16(24-2)10-6-14/h3-10,18H,11-12H2,1-2H3,(H,20,22)	BDJZDFVNWBMFJO-UHFFFAOYSA-N	340.14230714							105943
[3-(Benzoylamino)phenoxy]acetic acid	LSM-17305	SID7974736, BRD-K01206861	570259	InChI=1S/C15H13NO4/c17-14(18)10-20-13-8-4-7-12(9-13)16-15(19)11-5-2-1-3-6-11/h1-9H,10H2,(H,16,19)(H,17,18)	XQOLKPHCFBYWFN-UHFFFAOYSA-N	OC(=O)COc1cccc(NC(=O)c2ccccc2)c1	BroadT	BRD-K01206861	BRD-K01206861-001-05-4	ChemBridge Corporation	6694527			OC(=O)COc1cccc(NC(=O)c2ccccc2)c1	InChI=1S/C15H13NO4/c17-14(18)10-20-13-8-4-7-12(9-13)16-15(19)11-5-2-1-3-6-11/h1-9H,10H2,(H,16,19)(H,17,18)	XQOLKPHCFBYWFN-UHFFFAOYSA-N	271.084457906							105944
MLS000683537	LSM-17306	SID24814931, BRD-A53396890	3687665	InChI=1S/C22H29N3OS/c1-15-11-16(2)21(17(3)12-15)24-22(27)23-13-18-9-10-25(14-18)19-5-7-20(26-4)8-6-19/h5-8,11-12,18H,9-10,13-14H2,1-4H3,(H2,23,24,27)	FXHGJVWNQLIDGU-UHFFFAOYSA-N	COc1ccc(cc1)N2CCC(CN=C(S)Nc3c(C)cc(C)cc3C)C2	BroadT	BRD-A53396890	BRD-A53396890-001-05-7	ChemDiv Inc.	K788-2052			COc1ccc(cc1)N1CCC(CN=C(S)Nc2c(C)cc(C)cc2C)C1	InChI=1S/C22H29N3OS/c1-15-11-16(2)21(17(3)12-15)24-22(27)23-13-18-9-10-25(14-18)19-5-7-20(26-4)8-6-19/h5-8,11-12,18H,9-10,13-14H2,1-4H3,(H2,23,24,27)	FXHGJVWNQLIDGU-UHFFFAOYSA-N	383.203133268							105945
NSC182400	LSM-17307	BRD-K86731314	5383687	InChI=1S/C6H2Cl2N4O2/c7-1-2(8)10-4-3(9-1)11-5(12-4)6(13)14/h(H,13,14)(H,9,10,11,12)	YXRXEPZMAPZYMM-UHFFFAOYSA-N	OC(=O)c1nc2nc(Cl)c(Cl)[nH]c2n1	BroadT	BRD-K86731314	BRD-K86731314-001-05-2	National Cancer Institute Chemotherapeutic Agents Repository	182400			OC(=O)c1nc2nc(Cl)c(Cl)[nH]c2n1	InChI=1S/C6H2Cl2N4O2/c7-1-2(8)10-4-3(9-1)11-5(12-4)6(13)14/h(H,13,14)(H,9,10,11,12)	YXRXEPZMAPZYMM-UHFFFAOYSA-N	231.955480764							105946
F2019-1305	LSM-15267	BRD-K93489018	7208855	InChI=1S/C17H18FN3O2S/c1-20(2)9-5-10-21(16(22)13-7-4-11-23-13)17-19-15-12(18)6-3-8-14(15)24-17/h3-4,6-8,11H,5,9-10H2,1-2H3	CJOWVGDYVAIVBQ-UHFFFAOYSA-N	CN(C)CCCN(C(=O)c1occc1)c2nc3c(F)cccc3s2	BroadT	BRD-K93489018	BRD-K93489018-003-05-3	Life Chemicals Inc.	F2019-1305		Cl	CN(C)CCCN(C(=O)c1ccco1)c1nc2c(F)cccc2s1.Cl	InChI=1S/C17H18FN3O2S.ClH/c1-20(2)9-5-10-21(16(22)13-7-4-11-23-13)17-19-15-12(18)6-3-8-14(15)24-17;/h3-4,6-8,11H,5,9-10H2,1-2H3;1H	ZTDVNGSXPSXSCV-UHFFFAOYSA-N	347.110375736							103914, 103914
MLS000098794	LSM-17308	SID3712932, BRD-A51156511	2998216	InChI=1S/C13H15NO6S/c1-9-2-4-10(5-3-9)21(17,18)14-8-12(15)20-11-6-7-19-13(11)16/h2-5,11,14H,6-8H2,1H3	FXHQSACKEFQWDT-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NCC(=O)OC2CCOC2=O	BroadT	BRD-A51156511	BRD-A51156511-001-06-4	Enamine Ltd.	T0508-4854			Cc1ccc(cc1)S(=O)(=O)NCC(=O)OC1CCOC1=O	InChI=1S/C13H15NO6S/c1-9-2-4-10(5-3-9)21(17,18)14-8-12(15)20-11-6-7-19-13(11)16/h2-5,11,14H,6-8H2,1H3	FXHQSACKEFQWDT-UHFFFAOYSA-N	313.0620079							105947
N-(6-Phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide	LSM-17309	BRD-K44027058, SID7975011	786409	InChI=1S/C18H13N3OS/c22-17(14-9-5-2-6-10-14)20-16-15(13-7-3-1-4-8-13)19-18-21(16)11-12-23-18/h1-12H,(H,20,22)	MCSIZAMXJUWZDC-UHFFFAOYSA-N	O=C(Nc1c(nc2sccn12)c3ccccc3)c4ccccc4	BroadT	BRD-K44027058	BRD-K44027058-001-05-6	ChemBridge Corporation	5143672			O=C(Nc1c(nc2sccn12)-c1ccccc1)c1ccccc1	InChI=1S/C18H13N3OS/c22-17(14-9-5-2-6-10-14)20-16-15(13-7-3-1-4-8-13)19-18-21(16)11-12-23-18/h1-12H,(H,20,22)	MCSIZAMXJUWZDC-UHFFFAOYSA-N	319.077932756							105948
1-(4-Fluorophenyl)-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrrolidine-2,5-dione	LSM-17310	SID7978331, BRD-A41550589	2839888	InChI=1S/C21H19F4N3O2/c22-15-4-6-16(7-5-15)28-19(29)13-18(20(28)30)27-10-8-26(9-11-27)17-3-1-2-14(12-17)21(23,24)25/h1-7,12,18H,8-11,13H2	BDTZMOHFSHVYRE-UHFFFAOYSA-N	Fc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4cccc(c4)C(F)(F)F)C2=O	BroadT	BRD-A41550589	BRD-A41550589-001-05-0	ChemBridge Corporation	5303199			Fc1ccc(cc1)N1C(=O)CC(N2CCN(CC2)c2cccc(c2)C(F)(F)F)C1=O	InChI=1S/C21H19F4N3O2/c22-15-4-6-16(7-5-15)28-19(29)13-18(20(28)30)27-10-8-26(9-11-27)17-3-1-2-14(12-17)21(23,24)25/h1-7,12,18H,8-11,13H2	BDTZMOHFSHVYRE-UHFFFAOYSA-N	421.141339678							105949
3-Bromo-n-(furan-2-ylmethyl)benzamide	LSM-17311	SID47202453, BRD-K23716244	809128	InChI=1S/C12H10BrNO2/c13-10-4-1-3-9(7-10)12(15)14-8-11-5-2-6-16-11/h1-7H,8H2,(H,14,15)	IJKKCHLTWZPXIB-UHFFFAOYSA-N	Brc1cccc(c1)C(=O)NCc2occc2	BroadT	BRD-K23716244	BRD-K23716244-001-05-4	Asinex Ltd.	BAS 00542765			Brc1cccc(c1)C(=O)NCc1ccco1	InChI=1S/C12H10BrNO2/c13-10-4-1-3-9(7-10)12(15)14-8-11-5-2-6-16-11/h1-7H,8H2,(H,14,15)	IJKKCHLTWZPXIB-UHFFFAOYSA-N	278.98949117							105950
AC1O9WZ3	LSM-17312	BRD-K91159527	6739371	InChI=1S/C13H10N4O4/c18-12-2-1-9(7-11(12)17(20)21)8-15-16-13(19)10-3-5-14-6-4-10/h1-8,18H,(H,16,19)	RAOPHYMFJFYFON-UHFFFAOYSA-N	Oc1ccc(C=NNC(=O)c2ccncc2)cc1[N+](=O)[O-]	BroadT	BRD-K91159527	BRD-K91159527-001-05-2	InterBioScreen Ltd.	STOCK3S-09909			Oc1ccc(C=NNC(=O)c2ccncc2)cc1[N+]([O-])=O	InChI=1S/C13H10N4O4/c18-12-2-1-9(7-11(12)17(20)21)8-15-16-13(19)10-3-5-14-6-4-10/h1-8,18H,(H,16,19)	RAOPHYMFJFYFON-UHFFFAOYSA-N	286.07020484							
ASN 05443267	LSM-17313	SID17508494, BRD-K96841301	3206393	InChI=1S/C20H26N4O2S/c1-13(2)19(26)24-23-17(25)12-27-20-15-10-6-7-11-16(15)21-18(22-20)14-8-4-3-5-9-14/h6-7,10-11,13-14H,3-5,8-9,12H2,1-2H3,(H,23,25)(H,24,26)	YTDUGUOAMUKPPO-UHFFFAOYSA-N	CC(C)C(=O)NNC(=O)CSc1nc(nc2ccccc12)C3CCCCC3	BroadT	BRD-K96841301	BRD-K96841301-001-05-2	Asinex Ltd.	ASN 05443267			CC(C)C(=O)NNC(=O)CSc1nc(nc2ccccc12)C1CCCCC1	InChI=1S/C20H26N4O2S/c1-13(2)19(26)24-23-17(25)12-27-20-15-10-6-7-11-16(15)21-18(22-20)14-8-4-3-5-9-14/h6-7,10-11,13-14H,3-5,8-9,12H2,1-2H3,(H,23,25)(H,24,26)	YTDUGUOAMUKPPO-UHFFFAOYSA-N	386.177646802							105952
1-(5-Chloro-2-methoxy-phenyl)-2-(4,6-diamino-pyrimidin-2-ylsulfanyl)-ethanone	LSM-17314	SID853230, BRD-K79442413	655884	InChI=1S/C13H13ClN4O2S/c1-20-10-3-2-7(14)4-8(10)9(19)6-21-13-17-11(15)5-12(16)18-13/h2-5H,6H2,1H3,(H4,15,16,17,18)	RGGRTIAUGLTXOS-UHFFFAOYSA-N	COc1ccc(Cl)cc1C(=O)CSc2nc(N)cc(N)n2	BroadT	BRD-K79442413	BRD-K79442413-001-05-5	Asinex Ltd.	ASN 03270696			COc1ccc(Cl)cc1C(=O)CSc1nc(N)cc(N)n1	InChI=1S/C13H13ClN4O2S/c1-20-10-3-2-7(14)4-8(10)9(19)6-21-13-17-11(15)5-12(16)18-13/h2-5H,6H2,1H3,(H4,15,16,17,18)	RGGRTIAUGLTXOS-UHFFFAOYSA-N	324.044774096							105953
AC1M6GDH	LSM-17315	BRD-K37326155	2348264	InChI=1S/C19H15N3O5S2/c23-19(21-20-11-13-3-8-16-17(10-13)27-12-26-16)14-4-6-15(7-5-14)22-29(24,25)18-2-1-9-28-18/h1-11,22H,12H2,(H,21,23)	OZIRVXNVZPXFHI-UHFFFAOYSA-N	O=C(NN=Cc1ccc2OCOc2c1)c3ccc(NS(=O)(=O)c4cccs4)cc3	BroadT	BRD-K37326155	BRD-K37326155-001-05-3	Enamine Ltd.	T0506-5745			O=C(NN=Cc1ccc2OCOc2c1)c1ccc(NS(=O)(=O)c2cccs2)cc1	InChI=1S/C19H15N3O5S2/c23-19(21-20-11-13-3-8-16-17(10-13)27-12-26-16)14-4-6-15(7-5-14)22-29(24,25)18-2-1-9-28-18/h1-11,22H,12H2,(H,21,23)	OZIRVXNVZPXFHI-UHFFFAOYSA-N	429.04531199							105954
F2890-0049	LSM-17316	SID22406535, BRD-K75983321	2500772	InChI=1S/C15H13Cl2NO2S/c1-21-14-5-3-2-4-12(14)18-15(19)9-20-13-7-6-10(16)8-11(13)17/h2-8H,9H2,1H3,(H,18,19)	DNDPLKCBLWWJCA-UHFFFAOYSA-N	CSc1ccccc1NC(=O)COc2ccc(Cl)cc2Cl	BroadT	BRD-K75983321	BRD-K75983321-001-05-3	Enamine Ltd.	Z26434955			CSc1ccccc1NC(=O)COc1ccc(Cl)cc1Cl	InChI=1S/C15H13Cl2NO2S/c1-21-14-5-3-2-4-12(14)18-15(19)9-20-13-7-6-10(16)8-11(13)17/h2-8H,9H2,1H3,(H,18,19)	DNDPLKCBLWWJCA-UHFFFAOYSA-N	341.004404776							105955
T5242826	LSM-17317	SID3716146, BRD-K37540966	2113664	InChI=1S/C21H19N5OS2/c1-4-13-9-14-19(23-12-24-20(14)29-13)28-11-18(27)15(10-22)21-25(2)16-7-5-6-8-17(16)26(21)3/h5-9,12H,4,11H2,1-3H3	HVSVZPXQJNTHBO-UHFFFAOYSA-N	CCc1cc2c(SCC(=O)C(=C3N(C)c4ccccc4N3C)C#N)ncnc2s1	BroadT	BRD-K37540966	BRD-K37540966-001-05-8	Enamine Ltd.	T5242826			CCc1cc2c(SCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)ncnc2s1	InChI=1S/C21H19N5OS2/c1-4-13-9-14-19(23-12-24-20(14)29-13)28-11-18(27)15(10-22)21-25(2)16-7-5-6-8-17(16)26(21)3/h5-9,12H,4,11H2,1-3H3	HVSVZPXQJNTHBO-UHFFFAOYSA-N	421.103101658							105956
ST50677328	LSM-17318	SID49715768, BRD-K20372127	17253008	InChI=1S/C16H19N3O4/c20-13-3-1-2-12(10-13)15-11-14(18-23-15)16(21)17-4-5-19-6-8-22-9-7-19/h1-3,10-11,20H,4-9H2,(H,17,21)	DLASRZPKKYTHKY-UHFFFAOYSA-N	Oc1cccc(c1)c2onc(c2)C(=O)NCCN3CCOCC3	BroadT	BRD-K20372127	BRD-K20372127-001-05-1	ChemDiv Inc.	C226-1512			Oc1cccc(c1)-c1cc(no1)C(=O)NCCN1CCOCC1	InChI=1S/C16H19N3O4/c20-13-3-1-2-12(10-13)15-11-14(18-23-15)16(21)17-4-5-19-6-8-22-9-7-19/h1-3,10-11,20H,4-9H2,(H,17,21)	DLASRZPKKYTHKY-UHFFFAOYSA-N	317.137556118							105957
ZINC00420754	LSM-17319	SID24805903, BRD-K27980004	864297	InChI=1S/C14H17N5O3S/c1-9-15-18-14(19(9)2)23-8-12(20)16-17-13(21)10-4-6-11(22-3)7-5-10/h4-7H,8H2,1-3H3,(H,16,20)(H,17,21)	YLTHTTDLKLECTK-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NNC(=O)CSc2nnc(C)n2C	BroadT	BRD-K27980004	BRD-K27980004-001-05-2	Asinex Ltd.	ASN 03016896			COc1ccc(cc1)C(=O)NNC(=O)CSc1nnc(C)n1C	InChI=1S/C14H17N5O3S/c1-9-15-18-14(19(9)2)23-8-12(20)16-17-13(21)10-4-6-11(22-3)7-5-10/h4-7H,8H2,1-3H3,(H,16,20)(H,17,21)	YLTHTTDLKLECTK-UHFFFAOYSA-N	335.105210144							105958
SMR000176743	LSM-17320	SID17507573, BRD-K76515392	2876499	InChI=1S/C18H14N6O4S/c1-11-19-16(24(27)28)17(22(11)10-12-5-3-2-4-6-12)29-18-20-14-8-7-13(23(25)26)9-15(14)21-18/h2-9H,10H2,1H3,(H,20,21)	XKEXZAZXSQWNSI-UHFFFAOYSA-N	Cc1nc(c(Sc2nc3cc(ccc3[nH]2)[N+](=O)[O-])n1Cc4ccccc4)[N+](=O)[O-]	BroadT	BRD-K76515392	BRD-K76515392-001-05-6	Asinex Ltd.	BAS 01257014			Cc1nc(c(Sc2nc3cc(ccc3[nH]2)[N+]([O-])=O)n1Cc1ccccc1)[N+]([O-])=O	InChI=1S/C18H14N6O4S/c1-11-19-16(24(27)28)17(22(11)10-12-5-3-2-4-6-12)29-18-20-14-8-7-13(23(25)26)9-15(14)21-18/h2-9H,10H2,1H3,(H,20,21)	XKEXZAZXSQWNSI-UHFFFAOYSA-N	410.079723678							105959
CHEMDIV1_016648	LSM-17321	SID24784616, BRD-K39762892	4523899	InChI=1S/C22H17FN4O/c1-14(28)24-15-7-6-8-16(13-15)25-22-18-10-3-5-12-20(18)26-21(27-22)17-9-2-4-11-19(17)23/h2-13H,1H3,(H,24,28)(H,25,26,27)	RUQRRUCVPJNESH-UHFFFAOYSA-N	CC(=O)Nc1cccc(Nc2nc(nc3ccccc23)c4ccccc4F)c1	BroadT	BRD-K39762892	BRD-K39762892-001-05-5	ChemDiv Inc.	K841-0215			CC(=O)Nc1cccc(Nc2nc(nc3ccccc23)-c2ccccc2F)c1	InChI=1S/C22H17FN4O/c1-14(28)24-15-7-6-8-16(13-15)25-22-18-10-3-5-12-20(18)26-21(27-22)17-9-2-4-11-19(17)23/h2-13H,1H3,(H,24,28)(H,25,26,27)	RUQRRUCVPJNESH-UHFFFAOYSA-N	372.138639404							105960
MLS000722153	LSM-17322	SID17515364, BRD-K81243858	2150444	InChI=1S/C26H21N3O3S/c1-16-12-17(2)14-18(13-16)27-22(30)15-33-26-28-23-20-10-6-7-11-21(20)32-24(23)25(31)29(26)19-8-4-3-5-9-19/h3-14H,15H2,1-2H3,(H,27,30)	QETUPVIBFGZSOV-UHFFFAOYSA-N	Cc1cc(C)cc(NC(=O)CSC2=Nc3c(oc4ccccc34)C(=O)N2c5ccccc5)c1	BroadT	BRD-K81243858	BRD-K81243858-001-06-3	Life Chemicals Inc.	F1607-0425			Cc1cc(C)cc(NC(=O)CSc2nc3c4ccccc4oc3c(=O)n2-c2ccccc2)c1	InChI=1S/C26H21N3O3S/c1-16-12-17(2)14-18(13-16)27-22(30)15-33-26-28-23-20-10-6-7-11-21(20)32-24(23)25(31)29(26)19-8-4-3-5-9-19/h3-14H,15H2,1-2H3,(H,27,30)	QETUPVIBFGZSOV-UHFFFAOYSA-N	455.130362252							105961
AC1NOG3I	LSM-17323	BRD-K23527682	5137647	InChI=1S/C30H32N6O4S/c1-3-40-26-15-17-27(18-16-26)41(38,39)34-24-13-11-23(12-14-24)29(37)32-31-21-28-22(2)33-36(25-9-5-4-6-10-25)30(28)35-19-7-8-20-35/h4-6,9-18,21,34H,3,7-8,19-20H2,1-2H3,(H,32,37)	HYIFELIPJMXJCH-UHFFFAOYSA-N	CCOc1ccc(cc1)S(=O)(=O)Nc2ccc(cc2)C(=O)NN=Cc3c(C)nn(c4ccccc4)c3N5CCCC5	BroadT	BRD-K23527682	BRD-K23527682-001-05-4	Enamine Ltd.	T0504-9152			CCOc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)C(=O)NN=Cc1c(C)nn(c1N1CCCC1)-c1ccccc1	InChI=1S/C30H32N6O4S/c1-3-40-26-15-17-27(18-16-26)41(38,39)34-24-13-11-23(12-14-24)29(37)32-31-21-28-22(2)33-36(25-9-5-4-6-10-25)30(28)35-19-7-8-20-35/h4-6,9-18,21,34H,3,7-8,19-20H2,1-2H3,(H,32,37)	HYIFELIPJMXJCH-UHFFFAOYSA-N	572.220574254							105962
N-[1-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)ethyl]-n'-(5-methyl-1,3,4-thiadiazol-2-yl)urea	LSM-17324	SID4249143, SID87341111, BRD-A21009254	3243134	InChI=1S/C15H17N5O3S/c1-6(16-14(23)17-15-19-18-7(2)24-15)20-12(21)10-8-3-4-9(5-8)11(10)13(20)22/h3-4,6,8-11H,5H2,1-2H3,(H2,16,17,19,23)	OCMMFDANPMLYGR-UHFFFAOYSA-N	CC(NC(=O)Nc1nnc(C)s1)N2C(=O)C3C4CC(C=C4)C3C2=O	BroadT	BRD-A21009254	BRD-A21009254-001-06-3	ChemDiv Inc.	5928-0064			CC(NC(=O)Nc1nnc(C)s1)N1C(=O)C2C3CC(C=C3)C2C1=O	InChI=1S/C15H17N5O3S/c1-6(16-14(23)17-15-19-18-7(2)24-15)20-12(21)10-8-3-4-9(5-8)11(10)13(20)22/h3-4,6,8-11H,5H2,1-2H3,(H2,16,17,19,23)	OCMMFDANPMLYGR-UHFFFAOYSA-N	347.105210144							105963
AJ-292/42034985	LSM-17325	SID22413762, BRD-K15449428	899584	InChI=1S/C15H20N2O3S/c1-2-20-14(19)11-3-5-12(6-4-11)16-15(21)17-9-7-13(18)8-10-17/h3-6,13,18H,2,7-10H2,1H3,(H,16,21)	VEQFHXPMSLZTJD-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1	BroadT	BRD-K15449428	BRD-K15449428-001-05-0	Specs	AJ-292/42034985			CCOC(=O)c1ccc(NC(=S)N2CCC(O)CC2)cc1	InChI=1S/C15H20N2O3S/c1-2-20-14(19)11-3-5-12(6-4-11)16-15(21)17-9-7-13(18)8-10-17/h3-6,13,18H,2,7-10H2,1H3,(H,16,21)	VEQFHXPMSLZTJD-UHFFFAOYSA-N	308.11946321							105964
SMR000144663	LSM-17326	SID14730345, BRD-A42694168	2979898	InChI=1S/C24H29N3O3/c1-5-30-23(28)21-20(14-25-13-18-10-7-15(2)8-11-18)26-24(29)27-22(21)19-12-16(3)6-9-17(19)4/h6-12,22,25H,5,13-14H2,1-4H3,(H2,26,27,29)	IIWDWNYHEGFJHI-UHFFFAOYSA-N	CCOC(=O)C1=C(CNCc2ccc(C)cc2)NC(=O)NC1c3cc(C)ccc3C	BroadT	BRD-A42694168	BRD-A42694168-001-05-4	ChemBridge Corporation	7976865			CCOC(=O)C1=C(CNCc2ccc(C)cc2)NC(=O)NC1c1cc(C)ccc1C	InChI=1S/C24H29N3O3/c1-5-30-23(28)21-20(14-25-13-18-10-7-15(2)8-11-18)26-24(29)27-22(21)19-12-16(3)6-9-17(19)4/h6-12,22,25H,5,13-14H2,1-4H3,(H2,26,27,29)	IIWDWNYHEGFJHI-UHFFFAOYSA-N	407.220891818							105965
AC1MPIRG	LSM-17327	SID24813888, BRD-K09921670	3435922	InChI=1S/C22H28N4O3S/c1-17-4-8-20(9-5-17)26(30(28,29)21-10-6-18(2)7-11-21)16-22(27)24-23-19-12-14-25(3)15-13-19/h4-11H,12-16H2,1-3H3,(H,24,27)	UVZPDYOMYYBJDU-UHFFFAOYSA-N	CN1CCC(=NNC(=O)CN(c2ccc(C)cc2)S(=O)(=O)c3ccc(C)cc3)CC1	BroadT	BRD-K09921670	BRD-K09921670-001-05-1	ChemDiv Inc.	4664-2580			CN1CCC(CC1)=NNC(=O)CN(c1ccc(C)cc1)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C22H28N4O3S/c1-17-4-8-20(9-5-17)26(30(28,29)21-10-6-18(2)7-11-21)16-22(27)24-23-19-12-14-25(3)15-13-19/h4-11H,12-16H2,1-3H3,(H,24,27)	UVZPDYOMYYBJDU-UHFFFAOYSA-N	428.188211486							105966
SMR000032830	LSM-17328	SID4250275, BRD-A25510551	3244111	InChI=1S/C16H16N4O2/c21-15(18-10-11-4-3-7-17-9-11)8-14-16(22)20-13-6-2-1-5-12(13)19-14/h1-7,9,14,19H,8,10H2,(H,18,21)(H,20,22)	UUGIYKPYZVGBEE-UHFFFAOYSA-N	O=C(CC1Nc2ccccc2NC1=O)NCc3cccnc3	BroadT	BRD-A25510551	BRD-A25510551-001-05-8	ChemDiv Inc.	K788-6217			O=C(CC1Nc2ccccc2NC1=O)NCc1cccnc1	InChI=1S/C16H16N4O2/c21-15(18-10-11-4-3-7-17-9-11)8-14-16(22)20-13-6-2-1-5-12(13)19-14/h1-7,9,14,19H,8,10H2,(H,18,21)(H,20,22)	UUGIYKPYZVGBEE-UHFFFAOYSA-N	296.127325792							105967
MLS000705419	LSM-17329	SID22401989, BRD-A15255630	5045172	InChI=1S/C25H21ClN4O2/c1-2-29-15-20(26)24(28-29)25(32)30-22(19-9-5-6-10-23(19)31)14-21(27-30)18-12-11-16-7-3-4-8-17(16)13-18/h3-13,15,22,31H,2,14H2,1H3	VFCFBVVKGKWBBH-UHFFFAOYSA-N	CCn1cc(Cl)c(n1)C(=O)N2N=C(CC2c3ccccc3O)c4ccc5ccccc5c4	BroadT	BRD-A15255630	BRD-A15255630-001-07-3	Specs	AK-968/41924020			CCn1cc(Cl)c(n1)C(=O)N1N=C(CC1c1ccccc1O)c1ccc2ccccc2c1	InChI=1S/C25H21ClN4O2/c1-2-29-15-20(26)24(28-29)25(32)30-22(19-9-5-6-10-23(19)31)14-21(27-30)18-12-11-16-7-3-4-8-17(16)13-18/h3-13,15,22,31H,2,14H2,1H3	VFCFBVVKGKWBBH-UHFFFAOYSA-N	444.135303662							105968
AC1LHZAS	LSM-15536	BRD-K39200607	895330	InChI=1S/C20H23NO2/c1-3-13-21(14-4-2)15-16-22-19-11-8-12-20(17-19)23-18-9-6-5-7-10-18/h3-12,17H,1-2,13-16H2	DKKHIPRRJVYCJS-UHFFFAOYSA-N	C=CCN(CCOc1cccc(Oc2ccccc2)c1)CC=C	BroadT	BRD-K39200607	BRD-K39200607-034-05-3	ChemBridge Corporation	7641192		OC(=O)C(=O)O	C=CCN(CCOc1cccc(Oc2ccccc2)c1)CC=C.OC(=O)C(=O)O	InChI=1S/C20H23NO2.C2H2O4/c1-3-13-21(14-4-2)15-16-22-19-11-8-12-20(17-19)23-18-9-6-5-7-10-18;3-1(4)2(5)6/h3-12,17H,1-2,13-16H2;(H,3,4)(H,5,6)	JOGAZQIMKIEKFC-UHFFFAOYSA-N	309.172878986							104172, 104172
ST50635937	LSM-17330	SID4255361, BRD-K27804269	1247986	InChI=1S/C15H13N5OS/c1-3-10-9(2)22-15(11(10)7-16)19-14(21)12-8-18-20-6-4-5-17-13(12)20/h4-6,8H,3H2,1-2H3,(H,19,21)	ZIELLXUHWBOIQB-UHFFFAOYSA-N	CCc1c(C)sc(NC(=O)c2cnn3cccnc23)c1C#N	BroadT	BRD-K27804269	BRD-K27804269-001-05-4	ChemBridge Corporation	7950212			CCc1c(C)sc(NC(=O)c2cnn3cccnc23)c1C#N	InChI=1S/C15H13N5OS/c1-3-10-9(2)22-15(11(10)7-16)19-14(21)12-8-18-20-6-4-5-17-13(12)20/h4-6,8H,3H2,1-2H3,(H,19,21)	ZIELLXUHWBOIQB-UHFFFAOYSA-N	311.084080776							105969
MLS000693071	LSM-17331	SID24803764, BRD-A00345268	2920215	InChI=1S/C18H19N3O3/c1-12-7-8-19-16(9-12)20-18(23)13-10-17(22)21(11-13)14-3-5-15(24-2)6-4-14/h3-9,13H,10-11H2,1-2H3,(H,19,20,23)	NEKXUHCIYIJSRP-UHFFFAOYSA-N	COc1ccc(cc1)N2CC(CC2=O)C(=O)Nc3cc(C)ccn3	BroadT	BRD-A00345268	BRD-A00345268-001-06-0	Asinex Ltd.	BAS 04243131			COc1ccc(cc1)N1CC(CC1=O)C(=O)Nc1cc(C)ccn1	InChI=1S/C18H19N3O3/c1-12-7-8-19-16(9-12)20-18(23)13-10-17(22)21(11-13)14-3-5-15(24-2)6-4-14/h3-9,13H,10-11H2,1-2H3,(H,19,20,23)	NEKXUHCIYIJSRP-UHFFFAOYSA-N	325.142641498							105970
MLS000074326	LSM-17332	SID844413, BRD-K29771609	646739	InChI=1S/C20H23N3O4S/c1-26-16-6-8-17(9-7-16)28(24,25)23-19-5-3-2-4-18(19)21-20(23)10-11-22-12-14-27-15-13-22/h2-9H,10-15H2,1H3	NIQAWBHCACMOSZ-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)n2c(CCN3CCOCC3)nc4ccccc24	BroadT	BRD-K29771609	BRD-K29771609-001-05-2	Asinex Ltd.	ASN 06218125			COc1ccc(cc1)S(=O)(=O)n1c(CCN2CCOCC2)nc2ccccc12	InChI=1S/C20H23N3O4S/c1-26-16-6-8-17(9-7-16)28(24,25)23-19-5-3-2-4-18(19)21-20(23)10-11-22-12-14-27-15-13-22/h2-9H,10-15H2,1H3	NIQAWBHCACMOSZ-UHFFFAOYSA-N	401.140926936							105971
MLS000855932	LSM-17333	SID24797084, BRD-K39786722	6403907	InChI=1S/C20H16N4O3S/c1-13-5-2-6-14(11-13)21-17(25)12-28-20-22-18(15-7-3-9-26-15)19(23-24-20)16-8-4-10-27-16/h2-11H,12H2,1H3,(H,21,25)	ZCYVNGSVXUKMFW-UHFFFAOYSA-N	Cc1cccc(NC(=O)CSc2nnc(c3occc3)c(n2)c4occc4)c1	BroadT	BRD-K39786722	BRD-K39786722-001-03-5	Asinex Ltd.	BAS 02832747			Cc1cccc(NC(=O)CSc2nnc(-c3ccco3)c(n2)-c2ccco2)c1	InChI=1S/C20H16N4O3S/c1-13-5-2-6-14(11-13)21-17(25)12-28-20-22-18(15-7-3-9-26-15)19(23-24-20)16-8-4-10-27-16/h2-11H,12H2,1H3,(H,21,25)	ZCYVNGSVXUKMFW-UHFFFAOYSA-N	392.094311102							105972
AC1MR67N	LSM-17334	SID24828024, BRD-K11578298	3463143	InChI=1S/C14H18N4O2S/c1-10(19)16-12-5-3-11(4-6-12)13-9-21-14(18-17-13)15-7-8-20-2/h3-6H,7-9H2,1-2H3,(H,15,18)(H,16,19)	ZZRJKLPEGBZEAO-UHFFFAOYSA-N	COCCNC1=NN=C(CS1)c2ccc(NC(=O)C)cc2	BroadT	BRD-K11578298	BRD-K11578298-001-05-7	Enamine Ltd.	T0517-8493			COCCNC1=NN=C(CS1)c1ccc(NC(C)=O)cc1	InChI=1S/C14H18N4O2S/c1-10(19)16-12-5-3-11(4-6-12)13-9-21-14(18-17-13)15-7-8-20-2/h3-6H,7-9H2,1-2H3,(H,15,18)(H,16,19)	ZZRJKLPEGBZEAO-UHFFFAOYSA-N	306.115046546							105973
SMR000010980	LSM-17335	SID847358, BRD-K59076967	649757	InChI=1S/C19H14ClN3O2S/c1-10-16(17(23-25-10)12-5-2-3-7-14(12)20)18(24)22-19-13(9-21)11-6-4-8-15(11)26-19/h2-3,5,7H,4,6,8H2,1H3,(H,22,24)	PPPHOQFSIXVYRL-UHFFFAOYSA-N	Cc1onc(c2ccccc2Cl)c1C(=O)Nc3sc4CCCc4c3C#N	BroadT	BRD-K59076967	BRD-K59076967-001-06-3	Asinex Ltd.	BAS 02052810			Cc1onc(c1C(=O)Nc1sc2CCCc2c1C#N)-c1ccccc1Cl	InChI=1S/C19H14ClN3O2S/c1-10-16(17(23-25-10)12-5-2-3-7-14(12)20)18(24)22-19-13(9-21)11-6-4-8-15(11)26-19/h2-3,5,7H,4,6,8H2,1H3,(H,22,24)	PPPHOQFSIXVYRL-UHFFFAOYSA-N	383.049525118							105974
MLS000324637	LSM-17336	SID17386959, BRD-A01679629	4744889	InChI=1S/C18H16ClN3S/c1-11-2-4-12(5-3-11)15-10-16(15)17-20-21-18(23)22(17)14-8-6-13(19)7-9-14/h2-9,15-16H,10H2,1H3,(H,21,23)	AINSTPYBZSXWHP-UHFFFAOYSA-N	Cc1ccc(cc1)C2CC2c3nnc(S)n3c4ccc(Cl)cc4	BroadT	BRD-A01679629	BRD-A01679629-001-05-7	Specs	AK-968/41922833			Cc1ccc(cc1)C1CC1c1nnc(S)n1-c1ccc(Cl)cc1	InChI=1S/C18H16ClN3S/c1-11-2-4-12(5-3-11)15-10-16(15)17-20-21-18(23)22(17)14-8-6-13(19)7-9-14/h2-9,15-16H,10H2,1H3,(H,21,23)	AINSTPYBZSXWHP-UHFFFAOYSA-N	341.075345942							105975
F1899-0800	LSM-17337	SID24816184, BRD-K67804580	7206008	InChI=1S/C17H16N4O2S/c1-11-3-5-13(6-4-11)14-7-8-17(20-19-14)24-10-16(22)18-15-9-12(2)23-21-15/h3-9H,10H2,1-2H3,(H,18,21,22)	YBGIIPJBBGDYFB-UHFFFAOYSA-N	Cc1onc(NC(=O)CSc2ccc(nn2)c3ccc(C)cc3)c1	BroadT	BRD-K67804580	BRD-K67804580-001-05-7	Life Chemicals Inc.	F1899-0800			Cc1cc(NC(=O)CSc2ccc(nn2)-c2ccc(C)cc2)no1	InChI=1S/C17H16N4O2S/c1-11-3-5-13(6-4-11)14-7-8-17(20-19-14)24-10-16(22)18-15-9-12(2)23-21-15/h3-9H,10H2,1-2H3,(H,18,21,22)	YBGIIPJBBGDYFB-UHFFFAOYSA-N	340.099396482							105976
Dimethyl 2-{4-[(3-chlorobenzoyl)amino]phenyl}malonate	LSM-17338	SID24819020, BRD-K48067822	3807270	InChI=1S/C18H16ClNO5/c1-24-17(22)15(18(23)25-2)11-6-8-14(9-7-11)20-16(21)12-4-3-5-13(19)10-12/h3-10,15H,1-2H3,(H,20,21)	HUINXFWINSOUFT-UHFFFAOYSA-N	COC(=O)C(C(=O)OC)c1ccc(NC(=O)c2cccc(Cl)c2)cc1	BroadT	BRD-K48067822	BRD-K48067822-001-06-1	Key Organics Ltd.	8T-0101			COC(=O)C(C(=O)OC)c1ccc(NC(=O)c2cccc(Cl)c2)cc1	InChI=1S/C18H16ClNO5/c1-24-17(22)15(18(23)25-2)11-6-8-14(9-7-11)20-16(21)12-4-3-5-13(19)10-12/h3-10,15H,1-2H3,(H,20,21)	HUINXFWINSOUFT-UHFFFAOYSA-N	361.071700332							105977
MLS000088906	LSM-17339	SID4264855, BRD-K97902511	751828	InChI=1S/C18H17N3O/c22-18-15-7-3-4-8-16(15)19-17(20-18)12-21-10-9-13-5-1-2-6-14(13)11-21/h1-8H,9-12H2,(H,19,20,22)	OWYSIIKDOFKHFI-UHFFFAOYSA-N	Oc1nc(CN2CCc3ccccc3C2)nc4ccccc14	BroadT	BRD-K97902511	BRD-K97902511-001-06-5	ChemBridge Corporation	7522196			Oc1nc(CN2CCc3ccccc3C2)nc2ccccc12	InChI=1S/C18H17N3O/c22-18-15-7-3-4-8-16(15)19-17(20-18)12-21-10-9-13-5-1-2-6-14(13)11-21/h1-8H,9-12H2,(H,19,20,22)	OWYSIIKDOFKHFI-UHFFFAOYSA-N	291.137162194							105978
BRN 0962299	LSM-17340	SID16952507, BRD-K09771463	198995	InChI=1S/C15H18N4O/c1-20-14-5-3-13(4-6-14)18-9-11-19(12-10-18)15-16-7-2-8-17-15/h2-8H,9-12H2,1H3	MPBJZRJBGUVTBE-UHFFFAOYSA-N	COc1ccc(cc1)N2CCN(CC2)c3ncccn3	BroadT	BRD-K09771463	BRD-K09771463-001-06-9	Enamine Ltd.	T5234321			COc1ccc(cc1)N1CCN(CC1)c1ncccn1	InChI=1S/C15H18N4O/c1-20-14-5-3-13(4-6-14)18-9-11-19(12-10-18)15-16-7-2-8-17-15/h2-8H,9-12H2,1H3	MPBJZRJBGUVTBE-UHFFFAOYSA-N	270.148061236							105979
BRD-A58815527	LSM-17341			InChI=1S/C21H26N2O3/c1-5-9-26-20(25)17-13(2)23-15-10-21(3,4)11-16(24)19(15)18(17)14-7-6-8-22-12-14/h6-8,12,17-18H,5,9-11H2,1-4H3	BUNHOQIATLWVMQ-UHFFFAOYSA-N	CCCOC(=O)C1C(C2=C(CC(C)(C)CC2=O)N=C1C)c3cccnc3	BroadT	BRD-A58815527	BRD-A58815527-001-05-2	Specs	AG-690/13505065			CCCOC(=O)C1C(c2cccnc2)C2=C(CC(C)(C)CC2=O)N=C1C	InChI=1S/C21H26N2O3/c1-5-9-26-20(25)17-13(2)23-15-10-21(3,4)11-16(24)19(15)18(17)14-7-6-8-22-12-14/h6-8,12,17-18H,5,9-11H2,1-4H3	BUNHOQIATLWVMQ-UHFFFAOYSA-N	354.194342712							105980
AC1LGO4Y	LSM-43719	BRD-K04342277	774665	InChI=1S/C17H17N3O/c1-13(10-15-6-4-3-5-7-15)11-19-20-17(21)16-9-8-14(2)18-12-16/h3-12H,1-2H3,(H,20,21)/b13-10+,19-11?	OTQMLBATXFZDDG-MMODIHTESA-N	C\C(=C/c1ccccc1)\C=NNC(=O)c2ccc(C)nc2	BroadT	BRD-K04342277	BRD-K04342277-001-05-2	Specs	AG-205/33112060			C\C(C=NNC(=O)c1ccc(C)nc1)=C/c1ccccc1	InChI=1S/C17H17N3O/c1-13(10-15-6-4-3-5-7-15)11-19-20-17(21)16-9-8-14(2)18-12-16/h3-12H,1-2H3,(H,20,21)/b13-10+,19-11?	OTQMLBATXFZDDG-MMODIHTESA-N	279.137162194							
SMR000021880	LSM-17343	SID4247869, BRD-A93717345	3242020	InChI=1S/C19H18N2O5/c22-15(20-7-10-1-4-13-14(5-10)26-9-25-13)8-21-18(23)16-11-2-3-12(6-11)17(16)19(21)24/h1-5,11-12,16-17H,6-9H2,(H,20,22)	GEBVUAMEWLBPIB-UHFFFAOYSA-N	O=C(CN1C(=O)C2C3CC(C=C3)C2C1=O)NCc4ccc5OCOc5c4	BroadT	BRD-A93717345	BRD-A93717345-001-06-5	ChemDiv Inc.	C082-0014			O=C(CN1C(=O)C2C3CC(C=C3)C2C1=O)NCc1ccc2OCOc2c1	InChI=1S/C19H18N2O5/c22-15(20-7-10-1-4-13-14(5-10)26-9-25-13)8-21-18(23)16-11-2-3-12(6-11)17(16)19(21)24/h1-5,11-12,16-17H,6-9H2,(H,20,22)	GEBVUAMEWLBPIB-UHFFFAOYSA-N	354.121571696							105982
AC1N7AQ1	LSM-17344	BRD-K80978449	4275410	InChI=1S/C18H18ClN3O3/c19-17-6-3-14(11-16(17)18(23)24)21-20-12-13-1-4-15(5-2-13)22-7-9-25-10-8-22/h1-6,11-12,21H,7-10H2,(H,23,24)	JHUDYSXAYLYVDY-UHFFFAOYSA-N	OC(=O)c1cc(NN=Cc2ccc(cc2)N3CCOCC3)ccc1Cl	BroadT	BRD-K80978449	BRD-K80978449-001-05-3	Enamine Ltd.	T0506-7279			OC(=O)c1cc(NN=Cc2ccc(cc2)N2CCOCC2)ccc1Cl	InChI=1S/C18H18ClN3O3/c19-17-6-3-14(11-16(17)18(23)24)21-20-12-13-1-4-15(5-2-13)22-7-9-25-10-8-22/h1-6,11-12,21H,7-10H2,(H,23,24)	JHUDYSXAYLYVDY-UHFFFAOYSA-N	359.103669176							105983
STK397160	LSM-17345	SID24802290, BRD-K24896421	841949	InChI=1S/C10H9Cl2NO3S/c1-7(14)13-10(9(11)12)17(15,16)8-5-3-2-4-6-8/h2-6H,1H3,(H,13,14)	SMVUYUWPKIKFKE-UHFFFAOYSA-N	CC(=O)NC(=C(Cl)Cl)S(=O)(=O)c1ccccc1	BroadT	BRD-K24896421	BRD-K24896421-001-05-8	Asinex Ltd.	BAS 00120115			CC(=O)NC(=C(Cl)Cl)S(=O)(=O)c1ccccc1	InChI=1S/C10H9Cl2NO3S/c1-7(14)13-10(9(11)12)17(15,16)8-5-3-2-4-6-8/h2-6H,1H3,(H,13,14)	SMVUYUWPKIKFKE-UHFFFAOYSA-N	292.968019268							105984
MLS000051394	LSM-17346	SID4255260, BRD-K43977780	2967414	InChI=1S/C22H29ClN4O2/c1-17-4-6-18(7-5-17)25-22(28)24-10-3-11-26-12-14-27(15-13-26)21-16-19(29-2)8-9-20(21)23/h4-9,16H,3,10-15H2,1-2H3,(H2,24,25,28)	FXEQPMSYJAWBQO-UHFFFAOYSA-N	COc1ccc(Cl)c(c1)N2CCN(CCCNC(=O)Nc3ccc(C)cc3)CC2	BroadT	BRD-K43977780	BRD-K43977780-001-05-8	ChemBridge Corporation	7931271			COc1ccc(Cl)c(c1)N1CCN(CCCNC(=O)Nc2ccc(C)cc2)CC1	InChI=1S/C22H29ClN4O2/c1-17-4-6-18(7-5-17)25-22(28)24-10-3-11-26-12-14-27(15-13-26)21-16-19(29-2)8-9-20(21)23/h4-9,16H,3,10-15H2,1-2H3,(H2,24,25,28)	FXEQPMSYJAWBQO-UHFFFAOYSA-N	416.197903918							105985
MLS000768965	LSM-17347	SID26671590, BRD-K00127081	1962617	InChI=1S/C19H13FN4OS/c20-13-5-1-2-6-15(13)23-18(25)17-16(21)12-7-8-14(24-19(12)26-17)11-4-3-9-22-10-11/h1-10H,21H2,(H,23,25)	MNZYLPINBRBBFE-UHFFFAOYSA-N	Nc1c(sc2nc(ccc12)c3cccnc3)C(=O)Nc4ccccc4F	BroadT	BRD-K00127081	BRD-K00127081-001-06-5	InterBioScreen Ltd.	STOCK3S-21917			Nc1c(sc2nc(ccc12)-c1cccnc1)C(=O)Nc1ccccc1F	InChI=1S/C19H13FN4OS/c20-13-5-1-2-6-15(13)23-18(25)17-16(21)12-7-8-14(24-19(12)26-17)11-4-3-9-22-10-11/h1-10H,21H2,(H,23,25)	MNZYLPINBRBBFE-UHFFFAOYSA-N	364.079409966							105986
SMR000259997	LSM-17348	SID22405537, BRD-K28819531	2350978	InChI=1S/C18H11Br2N3O2/c19-13-8-14(20)18(17-12(13)5-3-7-22-17)25-10-16(24)23-15-6-2-1-4-11(15)9-21/h1-8H,10H2,(H,23,24)	BZSRLWRYILGATR-UHFFFAOYSA-N	Brc1cc(Br)c2cccnc2c1OCC(=O)Nc3ccccc3C#N	BroadT	BRD-K28819531	BRD-K28819531-001-05-3	Enamine Ltd.	T0508-4760			Brc1cc(Br)c2cccnc2c1OCC(=O)Nc1ccccc1C#N	InChI=1S/C18H11Br2N3O2/c19-13-8-14(20)18(17-12(13)5-3-7-22-17)25-10-16(24)23-15-6-2-1-4-11(15)9-21/h1-8H,10H2,(H,23,24)	BZSRLWRYILGATR-UHFFFAOYSA-N	458.921801822							105987
MLS000721054	LSM-17349	SID24817864, BRD-A45055032	3700372	InChI=1S/C22H27N3O/c1-17(23-20-15-9-4-10-16-20)22(26)25-24-21(18-11-5-2-6-12-18)19-13-7-3-8-14-19/h2-3,5-8,11-14,17,20,23H,4,9-10,15-16H2,1H3,(H,25,26)	RKMCCWUZWZLIOF-UHFFFAOYSA-N	CC(NC1CCCCC1)C(=O)NN=C(c2ccccc2)c3ccccc3	BroadT	BRD-A45055032	BRD-A45055032-001-06-7	Key Organics Ltd.	9N-372S			CC(NC1CCCCC1)C(=O)NN=C(c1ccccc1)c1ccccc1	InChI=1S/C22H27N3O/c1-17(23-20-15-9-4-10-16-20)22(26)25-24-21(18-11-5-2-6-12-18)19-13-7-3-8-14-19/h2-3,5-8,11-14,17,20,23H,4,9-10,15-16H2,1H3,(H,25,26)	RKMCCWUZWZLIOF-UHFFFAOYSA-N	349.215412514							105988
AC1LIX4Z	LSM-17350	SID26667120, BRD-K15750886	939883	InChI=1S/C13H25N3S/c1-10(2)6-9-16-12(17)14-13(15-16)7-4-11(3)5-8-13/h10-11,15H,4-9H2,1-3H3,(H,14,17)	OFLFECLXRXZURX-UHFFFAOYSA-N	CC(C)CCN1NC2(CCC(C)CC2)N=C1S	BroadT	BRD-K15750886	BRD-K15750886-001-05-6	InterBioScreen Ltd.	STOCK2S-94529			CC(C)CCN1NC2(CCC(C)CC2)N=C1S	InChI=1S/C13H25N3S/c1-10(2)6-9-16-12(17)14-13(15-16)7-4-11(3)5-8-13/h10-11,15H,4-9H2,1-3H3,(H,14,17)	OFLFECLXRXZURX-UHFFFAOYSA-N	255.17691852							105989
SMR000025711	LSM-17351	SID4249001, BRD-A51726689	3243008	InChI=1S/C22H23N3O2/c1-15-9-11-17(12-10-15)22-24-21(27-25-22)14-13-20(26)23-19-8-4-6-16-5-2-3-7-18(16)19/h2-3,5,7,9-12,19H,4,6,8,13-14H2,1H3,(H,23,26)	COPPKCHAWAJUQO-UHFFFAOYSA-N	Cc1ccc(cc1)c2noc(CCC(=O)NC3CCCc4ccccc34)n2	BroadT	BRD-A51726689	BRD-A51726689-001-05-2	ChemDiv Inc.	C289-0672			Cc1ccc(cc1)-c1noc(CCC(=O)NC2CCCc3ccccc23)n1	InChI=1S/C22H23N3O2/c1-15-9-11-17(12-10-15)22-24-21(27-25-22)14-13-20(26)23-19-8-4-6-16-5-2-3-7-18(16)19/h2-3,5,7,9-12,19H,4,6,8,13-14H2,1H3,(H,23,26)	COPPKCHAWAJUQO-UHFFFAOYSA-N	361.179027006							105990
STK221425	LSM-17352	SID14739042, BRD-K15762320	804311	InChI=1S/C13H18N2OS/c1-14-7-9-15(10-8-14)13(17)11-3-5-12(16-2)6-4-11/h3-6H,7-10H2,1-2H3	ZQLVMFDFVBMDIK-UHFFFAOYSA-N	COc1ccc(cc1)C(=S)N2CCN(C)CC2	BroadT	BRD-K15762320	BRD-K15762320-001-05-5	ChemBridge Corporation	7043572			COc1ccc(cc1)C(=S)N1CCN(C)CC1	InChI=1S/C13H18N2OS/c1-14-7-9-15(10-8-14)13(17)11-3-5-12(16-2)6-4-11/h3-6H,7-10H2,1-2H3	ZQLVMFDFVBMDIK-UHFFFAOYSA-N	250.113983906							105991
10H-[1]benzothieno[3,2-B]indole	LSM-17353	SID26664996, SID484276, BRD-K39601134	354261	InChI=1S/C14H9NS/c1-3-7-11-9(5-1)14-13(15-11)10-6-2-4-8-12(10)16-14/h1-8,15H	FPQLXWGSGNEDCF-UHFFFAOYSA-N	c1ccc2c(c1)[nH]c3c4ccccc4sc23	BroadT	BRD-K39601134	BRD-K39601134-001-05-3	National Cancer Institute Chemotherapeutic Agents Repository	605333			c1ccc2c(c1)[nH]c1c3ccccc3sc21	InChI=1S/C14H9NS/c1-3-7-11-9(5-1)14-13(15-11)10-6-2-4-8-12(10)16-14/h1-8,15H	FPQLXWGSGNEDCF-UHFFFAOYSA-N	223.045569988							105992
MLS000879922	LSM-15268	BRD-A17585758	2999333	InChI=1S/C17H18BrFN2O3/c18-16-6-5-15(24-16)17(22)20-11-14(21-7-9-23-10-8-21)12-1-3-13(19)4-2-12/h1-6,14H,7-11H2,(H,20,22)	TUKUCXHWROPNBD-UHFFFAOYSA-N	Fc1ccc(cc1)C(CNC(=O)c2oc(Br)cc2)N3CCOCC3	BroadT	BRD-A17585758	BRD-A17585758-003-05-7	Enamine Ltd.	T0503-0920		Cl	Fc1ccc(cc1)C(CNC(=O)c1ccc(Br)o1)N1CCOCC1.Cl	InChI=1S/C17H18BrFN2O3.ClH/c18-16-6-5-15(24-16)17(22)20-11-14(21-7-9-23-10-8-21)12-1-3-13(19)4-2-12;/h1-6,14H,7-11H2,(H,20,22);1H	YSFCHIAXCGEKEF-UHFFFAOYSA-N	396.048483256							103915, 103915
ST019495	LSM-17354	SID14727615, BRD-K06905748	3974799	InChI=1S/C22H15BrN2O4/c23-15-8-6-14(7-9-15)18-10-11-20(29-18)22(27)25-17-4-1-3-16(13-17)24-21(26)19-5-2-12-28-19/h1-13H,(H,24,26)(H,25,27)	FFHBXQHBMMHCGZ-UHFFFAOYSA-N	Brc1ccc(cc1)c2oc(cc2)C(=O)Nc3cccc(NC(=O)c4occc4)c3	BroadT	BRD-K06905748	BRD-K06905748-001-06-3	Specs	AN-023/13177241			Brc1ccc(cc1)-c1ccc(o1)C(=O)Nc1cccc(NC(=O)c2ccco2)c1	InChI=1S/C22H15BrN2O4/c23-15-8-6-14(7-9-15)18-10-11-20(29-18)22(27)25-17-4-1-3-16(13-17)24-21(26)19-5-2-12-28-19/h1-13H,(H,24,26)(H,25,27)	FFHBXQHBMMHCGZ-UHFFFAOYSA-N	450.02151958							105993
AC1N46HC	LSM-17355	SID24823752, BRD-K80143937	4099138	InChI=1S/C26H30N4O5S/c31-24(27-16-18-5-8-22-23(14-18)35-17-34-22)4-2-1-3-9-30-25(32)20-15-19(29-10-12-33-13-11-29)6-7-21(20)28-26(30)36/h5-8,14-15H,1-4,9-13,16-17H2,(H,27,31)(H,28,36)	TXRNKHZZSWTNJC-UHFFFAOYSA-N	O=C(CCCCCN1C(=S)Nc2ccc(cc2C1=O)N3CCOCC3)NCc4ccc5OCOc5c4	BroadT	BRD-K80143937	BRD-K80143937-001-05-3	ChemDiv Inc.	K284-6367			O=C(CCCCCn1c(=S)[nH]c2ccc(cc2c1=O)N1CCOCC1)NCc1ccc2OCOc2c1	InChI=1S/C26H30N4O5S/c31-24(27-16-18-5-8-22-23(14-18)35-17-34-22)4-2-1-3-9-30-25(32)20-15-19(29-10-12-33-13-11-29)6-7-21(20)28-26(30)36/h5-8,14-15H,1-4,9-13,16-17H2,(H,27,31)(H,28,36)	TXRNKHZZSWTNJC-UHFFFAOYSA-N	510.19369079							105994
MLS000769508	LSM-43720	SID26663862, BRD-K62883304	1599554	InChI=1S/C16H15N3OS2/c1-10(2)19-15(20)13(22-16(19)21)8-12-9-17-18-14(12)11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,18)/b13-8-	DLPVSEABAWKYJX-JYRVWZFOSA-N	CC(C)N1C(=S)S\C(=C/c2c[nH]nc2c3ccccc3)\C1=O	BroadT	BRD-K62883304	BRD-K62883304-001-06-9	InterBioScreen Ltd.	STOCK3S-37696			CC(C)N1C(=S)S\C(=C/c2c[nH]nc2-c2ccccc2)C1=O	InChI=1S/C16H15N3OS2/c1-10(2)19-15(20)13(22-16(19)21)8-12-9-17-18-14(12)11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,18)/b13-8-	DLPVSEABAWKYJX-JYRVWZFOSA-N	329.06565351							
MLS000326267	LSM-17357	SID17411940, BRD-K86375146	3784439	InChI=1S/C15H8ClF3N2O2/c16-10-4-5-11-12(7-10)20-13(21(23)14(11)22)8-2-1-3-9(6-8)15(17,18)19/h1-7,23H	WLMYZFDFXUHTHH-UHFFFAOYSA-N	ON1C(=O)c2ccc(Cl)cc2N=C1c3cccc(c3)C(F)(F)F	BroadT	BRD-K86375146	BRD-K86375146-001-09-4	Key Organics Ltd.	3K-545S			On1c(nc2cc(Cl)ccc2c1=O)-c1cccc(c1)C(F)(F)F	InChI=1S/C15H8ClF3N2O2/c16-10-4-5-11-12(7-10)20-13(21(23)14(11)22)8-2-1-3-9(6-8)15(17,18)19/h1-7,23H	WLMYZFDFXUHTHH-UHFFFAOYSA-N	340.022639826							105996
1-(4-Bromo-2-chlorophenyl)-3-(3-methylpyridin-2-yl)thiourea	LSM-17358	SID24796887, BRD-K10811932	2211326	InChI=1S/C13H11BrClN3S/c1-8-3-2-6-16-12(8)18-13(19)17-11-5-4-9(14)7-10(11)15/h2-7H,1H3,(H2,16,17,18,19)	KEAKWJXFKMKZFP-UHFFFAOYSA-N	Cc1cccnc1N=C(S)Nc2ccc(Br)cc2Cl	BroadT	BRD-K10811932	BRD-K10811932-001-05-5	ChemBridge Corporation	7832313			Cc1cccnc1N=C(S)Nc1ccc(Br)cc1Cl	InChI=1S/C13H11BrClN3S/c1-8-3-2-6-16-12(8)18-13(19)17-11-5-4-9(14)7-10(11)15/h2-7H,1H3,(H2,16,17,18,19)	KEAKWJXFKMKZFP-UHFFFAOYSA-N	354.954558382							105997
MLS000730324	LSM-17359	SID24782486, BRD-K55346885	16187877	InChI=1S/C24H22FN3O5S/c1-32-19-8-3-15(13-20(19)33-2)9-11-26-21(29)14-27-18-10-12-34-22(18)23(30)28(24(27)31)17-6-4-16(25)5-7-17/h3-8,10,12-13H,9,11,14H2,1-2H3,(H,26,29)	OIQDCULIPTUVMZ-UHFFFAOYSA-N	COc1ccc(CCNC(=O)CN2C(=O)N(C(=O)c3sccc23)c4ccc(F)cc4)cc1OC	BroadT	BRD-K55346885	BRD-K55346885-001-04-8	ChemDiv Inc.	C241-0667			COc1ccc(CCNC(=O)Cn2c3ccsc3c(=O)n(-c3ccc(F)cc3)c2=O)cc1OC	InChI=1S/C24H22FN3O5S/c1-32-19-8-3-15(13-20(19)33-2)9-11-26-21(29)14-27-18-10-12-34-22(18)23(30)28(24(27)31)17-6-4-16(25)5-7-17/h3-8,10,12-13H,9,11,14H2,1-2H3,(H,26,29)	OIQDCULIPTUVMZ-UHFFFAOYSA-N	483.126419724							105998
N-(4-Methoxyphenyl)-2-(3-nitrophenyl)quinazolin-4-amine	LSM-17360	SID17503798, BRD-K54033714	1420397	InChI=1S/C21H16N4O3/c1-28-17-11-9-15(10-12-17)22-21-18-7-2-3-8-19(18)23-20(24-21)14-5-4-6-16(13-14)25(26)27/h2-13H,1H3,(H,22,23,24)	XWHWBTQJSCDVMA-UHFFFAOYSA-N	COc1ccc(Nc2nc(nc3ccccc23)c4cccc(c4)[N+](=O)[O-])cc1	BroadT	BRD-K54033714	BRD-K54033714-001-07-3	InterBioScreen Ltd.	STOCK2S-61998			COc1ccc(Nc2nc(nc3ccccc23)-c2cccc(c2)[N+]([O-])=O)cc1	InChI=1S/C21H16N4O3/c1-28-17-11-9-15(10-12-17)22-21-18-7-2-3-8-19(18)23-20(24-21)14-5-4-6-16(13-14)25(26)27/h2-13H,1H3,(H,22,23,24)	XWHWBTQJSCDVMA-UHFFFAOYSA-N	372.122240412							105999
SMR000180196	LSM-17361	SID17402737, BRD-K61651281	1472845	InChI=1S/C16H11F4N3O2S/c1-2-25-14(24)10-7-21-23(13(10)16(18,19)20)15-22-12(8-26-15)9-5-3-4-6-11(9)17/h3-8H,2H2,1H3	TXHRFMAJDMMYJQ-UHFFFAOYSA-N	CCOC(=O)c1cnn(c2nc(cs2)c3ccccc3F)c1C(F)(F)F	BroadT	BRD-K61651281	BRD-K61651281-001-06-8	Key Organics Ltd.	2T-0877			CCOC(=O)c1cnn(-c2nc(cs2)-c2ccccc2F)c1C(F)(F)F	InChI=1S/C16H11F4N3O2S/c1-2-25-14(24)10-7-21-23(13(10)16(18,19)20)15-22-12(8-26-15)9-5-3-4-6-11(9)17/h3-8H,2H2,1H3	TXHRFMAJDMMYJQ-UHFFFAOYSA-N	385.050810112							106000
SMR000207049	LSM-17362	SID17510570, BRD-K24231267	4256438	InChI=1S/C26H28N2O4S/c1-5-32-23-12-8-19(14-24(23)31-4)16-27-26(30)20-9-13-25(22(15-20)28-18(3)29)33-21-10-6-17(2)7-11-21/h6-15H,5,16H2,1-4H3,(H,27,30)(H,28,29)	GEEQZVMWBAUJHL-UHFFFAOYSA-N	CCOc1ccc(CNC(=O)c2ccc(Sc3ccc(C)cc3)c(NC(=O)C)c2)cc1OC	BroadT	BRD-K24231267	BRD-K24231267-001-05-5	ChemDiv Inc.	K786-4141			CCOc1ccc(CNC(=O)c2ccc(Sc3ccc(C)cc3)c(NC(C)=O)c2)cc1OC	InChI=1S/C26H28N2O4S/c1-5-32-23-12-8-19(14-24(23)31-4)16-27-26(30)20-9-13-25(22(15-20)28-18(3)29)33-21-10-6-17(2)7-11-21/h6-15H,5,16H2,1-4H3,(H,27,30)(H,28,29)	GEEQZVMWBAUJHL-UHFFFAOYSA-N	464.176978086							106001
1-(2-Chloro-phenyl)-3-(furan-2-carbonyl)-thiourea	LSM-17363	SID49725686, BRD-K84788355	2833089	InChI=1S/C12H9ClN2O2S/c13-8-4-1-2-5-9(8)14-12(18)15-11(16)10-6-3-7-17-10/h1-7H,(H2,14,15,16,18)	AWEFIAYVGFZNOT-UHFFFAOYSA-N	Clc1ccccc1NC(=S)NC(=O)c2occc2	BroadT	BRD-K84788355	BRD-K84788355-001-05-4	Asinex Ltd.	BAS 00666231			Clc1ccccc1NC(=S)NC(=O)c1ccco1	InChI=1S/C12H9ClN2O2S/c13-8-4-1-2-5-9(8)14-12(18)15-11(16)10-6-3-7-17-10/h1-7H,(H2,14,15,16,18)	AWEFIAYVGFZNOT-UHFFFAOYSA-N	280.007325948							106002
N-[4-(4-Methanesulfonyl-piperazin-1-yl)-phenyl]-2-m-tolyloxy-acetamide	LSM-17364	SID850398, BRD-K42456840	652920	InChI=1S/C20H25N3O4S/c1-16-4-3-5-19(14-16)27-15-20(24)21-17-6-8-18(9-7-17)22-10-12-23(13-11-22)28(2,25)26/h3-9,14H,10-13,15H2,1-2H3,(H,21,24)	GQMSBWCCGBBRIS-UHFFFAOYSA-N	Cc1cccc(OCC(=O)Nc2ccc(cc2)N3CCN(CC3)S(=O)(=O)C)c1	BroadT	BRD-K42456840	BRD-K42456840-001-05-2	Asinex Ltd.	BAS 07535530			Cc1cccc(OCC(=O)Nc2ccc(cc2)N2CCN(CC2)S(C)(=O)=O)c1	InChI=1S/C20H25N3O4S/c1-16-4-3-5-19(14-16)27-15-20(24)21-17-6-8-18(9-7-17)22-10-12-23(13-11-22)28(2,25)26/h3-9,14H,10-13,15H2,1-2H3,(H,21,24)	GQMSBWCCGBBRIS-UHFFFAOYSA-N	403.156577							106003
AG-690/37012141	LSM-17365	SID4259877, BRD-K58800301	2851670	InChI=1S/C20H22N4/c1-15-6-7-17-14-16(2)20(22-18(17)13-15)24-11-9-23(10-12-24)19-5-3-4-8-21-19/h3-8,13-14H,9-12H2,1-2H3	LYTRGAWLJLRTGI-UHFFFAOYSA-N	Cc1ccc2cc(C)c(nc2c1)N3CCN(CC3)c4ccccn4	BroadT	BRD-K58800301	BRD-K58800301-001-05-4	ChemBridge Corporation	5548024			Cc1ccc2cc(C)c(nc2c1)N1CCN(CC1)c1ccccn1	InChI=1S/C20H22N4/c1-15-6-7-17-14-16(2)20(22-18(17)13-15)24-11-9-23(10-12-24)19-5-3-4-8-21-19/h3-8,13-14H,9-12H2,1-2H3	LYTRGAWLJLRTGI-UHFFFAOYSA-N	318.184446744							106004
AK-968/40642023	LSM-17366	SID22414962, BRD-K94060958	841063	InChI=1S/C12H9FN2O3S/c1-7-4-5-19-11(7)12(16)14-8-2-3-9(13)10(6-8)15(17)18/h2-6H,1H3,(H,14,16)	KVINREPTTIADQN-UHFFFAOYSA-N	Cc1ccsc1C(=O)Nc2ccc(F)c(c2)[N+](=O)[O-]	BroadT	BRD-K94060958	BRD-K94060958-001-05-7	Specs	AK-968/40642023			Cc1ccsc1C(=O)Nc1ccc(F)c(c1)[N+]([O-])=O	InChI=1S/C12H9FN2O3S/c1-7-4-5-19-11(7)12(16)14-8-2-3-9(13)10(6-8)15(17)18/h2-6H,1H3,(H,14,16)	KVINREPTTIADQN-UHFFFAOYSA-N	280.031791058							106005
4-Amino-n-(2-methoxyphenyl)benzamide	LSM-17367	SID3715822, BRD-K04143343	2317363	InChI=1S/C14H14N2O2/c1-18-13-5-3-2-4-12(13)16-14(17)10-6-8-11(15)9-7-10/h2-9H,15H2,1H3,(H,16,17)	DCVSWMVFHSQIJJ-UHFFFAOYSA-N	COc1ccccc1NC(=O)c2ccc(N)cc2	BroadT	BRD-K04143343	BRD-K04143343-001-05-4	Enamine Ltd.	T0503-3163			COc1ccccc1NC(=O)c1ccc(N)cc1	InChI=1S/C14H14N2O2/c1-18-13-5-3-2-4-12(13)16-14(17)10-6-8-11(15)9-7-10/h2-9H,15H2,1H3,(H,16,17)	DCVSWMVFHSQIJJ-UHFFFAOYSA-N	242.105527708							106006
AP-853/42160236	LSM-17368	SID24809814, BRD-K11926734	992131	InChI=1S/C17H16N4O3S/c1-23-14-5-3-2-4-13(14)19-15(22)8-11-25-17-21-20-16(24-17)12-6-9-18-10-7-12/h2-7,9-10H,8,11H2,1H3,(H,19,22)	RLBALFNHRPXFHR-UHFFFAOYSA-N	COc1ccccc1NC(=O)CCSc2oc(nn2)c3ccncc3	BroadT	BRD-K11926734	BRD-K11926734-001-06-8	Asinex Ltd.	BAS 06981950			COc1ccccc1NC(=O)CCSc1nnc(o1)-c1ccncc1	InChI=1S/C17H16N4O3S/c1-23-14-5-3-2-4-13(14)19-15(22)8-11-25-17-21-20-16(24-17)12-6-9-18-10-7-12/h2-7,9-10H,8,11H2,1H3,(H,19,22)	RLBALFNHRPXFHR-UHFFFAOYSA-N	356.094311102							106007
MLS-0351016.0001	LSM-1691	BRD-A62647958, SID85176631, SID99495587	2878586	InChI=1S/C25H21ClN2O6S/c1-3-33-24(32)21-14(2)27-25-28(22(21)16-6-8-17(26)9-7-16)23(31)19(35-25)12-15-4-10-18(11-5-15)34-13-20(29)30/h4-12,22H,3,13H2,1-2H3,(H,29,30)	XSQDEOJNULNBPG-UHFFFAOYSA-N	CCOC(=O)C1=C(C)N=C2SC(=Cc3ccc(OCC(=O)O)cc3)C(=O)N2C1c4ccc(Cl)cc4	BroadT	BRD-A62647958	BRD-A62647958-001-05-1	Specs	AN-648/15596223			CCOC(=O)C1=C(C)N=c2sc(=Cc3ccc(OCC(O)=O)cc3)c(=O)n2C1c1ccc(Cl)cc1	InChI=1S/C25H21ClN2O6S/c1-3-33-24(32)21-14(2)27-25-28(22(21)16-6-8-17(26)9-7-16)23(31)19(35-25)12-15-4-10-18(11-5-15)34-13-20(29)30/h4-12,22H,3,13H2,1-2H3,(H,29,30)	XSQDEOJNULNBPG-UHFFFAOYSA-N	512.080884812							91794
MLS000734420	LSM-17369	SID24786300, BRD-A70132191	16189078	InChI=1S/C16H17N3O2S2/c1-22-14-7-3-2-6-12(14)15(20)11-5-4-8-19(9-11)16(21)13-10-23-18-17-13/h2-3,6-7,10-11H,4-5,8-9H2,1H3	AKURUKNQDJYGJR-UHFFFAOYSA-N	CSc1ccccc1C(=O)C2CCCN(C2)C(=O)c3csnn3	BroadT	BRD-A70132191	BRD-A70132191-001-05-1	ChemBridge Corporation	49980790			CSc1ccccc1C(=O)C1CCCN(C1)C(=O)c1csnn1	InChI=1S/C16H17N3O2S2/c1-22-14-7-3-2-6-12(14)15(20)11-5-4-8-19(9-11)16(21)13-10-23-18-17-13/h2-3,6-7,10-11H,4-5,8-9H2,1H3	AKURUKNQDJYGJR-UHFFFAOYSA-N	347.076218194							106008
T6013251	LSM-17370	SID3714138, BRD-K88931022	2125372	InChI=1S/C14H12N2O3S/c1-3-18-14(17)9-7-10(11-5-4-6-20-11)15-13-12(9)8(2)16-19-13/h4-7H,3H2,1-2H3	XSUSZVZRZLIAQA-UHFFFAOYSA-N	CCOC(=O)c1cc(nc2onc(C)c12)c3cccs3	BroadT	BRD-K88931022	BRD-K88931022-001-05-9	Enamine Ltd.	T5253244			CCOC(=O)c1cc(nc2onc(C)c12)-c1cccs1	InChI=1S/C14H12N2O3S/c1-3-18-14(17)9-7-10(11-5-4-6-20-11)15-13-12(9)8(2)16-19-13/h4-7H,3H2,1-2H3	XSUSZVZRZLIAQA-UHFFFAOYSA-N	288.056862954							106009
T5238104	LSM-17371	SID16952976, BRD-K33595011	2106159	InChI=1S/C16H14N2O4S2/c1-10-17-13-4-2-11(8-16(13)23-10)18-24(19,20)12-3-5-14-15(9-12)22-7-6-21-14/h2-5,8-9,18H,6-7H2,1H3	UIHVOBWEDIWVCF-UHFFFAOYSA-N	Cc1nc2ccc(NS(=O)(=O)c3ccc4OCCOc4c3)cc2s1	BroadT	BRD-K33595011	BRD-K33595011-001-05-1	Enamine Ltd.	T5238104			Cc1nc2ccc(NS(=O)(=O)c3ccc4OCCOc4c3)cc2s1	InChI=1S/C16H14N2O4S2/c1-10-17-13-4-2-11(8-16(13)23-10)18-24(19,20)12-3-5-14-15(9-12)22-7-6-21-14/h2-5,8-9,18H,6-7H2,1H3	UIHVOBWEDIWVCF-UHFFFAOYSA-N	362.039498328							106010
SMR000043515	LSM-17372	SID861662, BRD-K61223648	662899	InChI=1S/C17H20N4O/c1-3-7-15(22)19-16-13-11-12-8-5-6-9-14(12)18-17(13)21(20-16)10-4-2/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,19,20,22)	OPMLPKQTOYWIOF-UHFFFAOYSA-N	CCCC(=O)Nc1nn(CCC)c2nc3ccccc3cc12	BroadT	BRD-K61223648	BRD-K61223648-001-07-2	InterBioScreen Ltd.	STOCK4S-14776			CCCC(=O)Nc1nn(CCC)c2nc3ccccc3cc12	InChI=1S/C17H20N4O/c1-3-7-15(22)19-16-13-11-12-8-5-6-9-14(12)18-17(13)21(20-16)10-4-2/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,19,20,22)	OPMLPKQTOYWIOF-UHFFFAOYSA-N	296.1637113							106011
AC1OFFOM	LSM-17373	BRD-K69389213	7099480	InChI=1S/C17H18N2O3/c20-15-7-3-9-19(15)10-4-8-18-11-14-16(21)12-5-1-2-6-13(12)17(14)22/h1-2,5-6,11,14H,3-4,7-10H2	CREITYCEEQRVFS-UHFFFAOYSA-N	O=C1CCCN1CCCN=CC2C(=O)c3ccccc3C2=O	BroadT	BRD-K69389213	BRD-K69389213-001-06-0	Asinex Ltd.	BAS 01257326			O=C1CCCN1CCCN=CC1C(=O)c2ccccc2C1=O	InChI=1S/C17H18N2O3/c20-15-7-3-9-19(15)10-4-8-18-11-14-16(21)12-5-1-2-6-13(12)17(14)22/h1-2,5-6,11,14H,3-4,7-10H2	CREITYCEEQRVFS-UHFFFAOYSA-N	298.131742456							106012
MLS000950234	LSM-17374	SID49735263, BRD-K10509720	22427402	InChI=1S/C14H14N2O3/c17-11-5-3-10(4-6-11)13-9-12(15-19-13)14(18)16-7-1-2-8-16/h3-6,9,17H,1-2,7-8H2	SKZKTUMFJUGQNK-UHFFFAOYSA-N	Oc1ccc(cc1)c2onc(c2)C(=O)N3CCCC3	BroadT	BRD-K10509720	BRD-K10509720-001-05-1	ChemDiv Inc.	C226-0595			Oc1ccc(cc1)-c1cc(no1)C(=O)N1CCCC1	InChI=1S/C14H14N2O3/c17-11-5-3-10(4-6-11)13-9-12(15-19-13)14(18)16-7-1-2-8-16/h3-6,9,17H,1-2,7-8H2	SKZKTUMFJUGQNK-UHFFFAOYSA-N	258.100442328							
MLS000806974	LSM-43721	SID26726272, BRD-K40631496	5593104	InChI=1S/C20H18N4O5/c25-16-9-5-4-8-14(16)18(27)23-21-12-15-17(26)22-20(29)24(19(15)28)11-10-13-6-2-1-3-7-13/h1-9,12,21,25H,10-11H2,(H,23,27)(H,22,26,29)/b15-12+	JQHGGNXOYQQDBA-NTCAYCPXSA-N	Oc1ccccc1C(=O)NN\C=C\2/C(=O)NC(=O)N(CCc3ccccc3)C2=O	BroadT	BRD-K40631496	BRD-K40631496-001-06-7	InterBioScreen Ltd.	STOCK3S-73268			Oc1ccccc1C(=O)NN\C=C1/C(=O)NC(=O)N(CCc2ccccc2)C1=O	InChI=1S/C20H18N4O5/c25-16-9-5-4-8-14(16)18(27)23-21-12-15-17(26)22-20(29)24(19(15)28)11-10-13-6-2-1-3-7-13/h1-9,12,21,25H,10-11H2,(H,23,27)(H,22,26,29)/b15-12+	JQHGGNXOYQQDBA-NTCAYCPXSA-N	394.127719716							
AC1LDBEJ	LSM-17376	SID843128, BRD-K05239308	645407	InChI=1S/C20H21N3O2S2/c24-16(21-10-13-4-3-9-25-13)11-26-19-17-14-5-1-2-6-15(14)27-20(17)23-18(22-19)12-7-8-12/h3-4,9,12H,1-2,5-8,10-11H2,(H,21,24)	NUKIUZWHVLPGCZ-UHFFFAOYSA-N	O=C(CSc1nc(nc2sc3CCCCc3c12)C4CC4)NCc5occc5	BroadT	BRD-K05239308	BRD-K05239308-001-05-2	Asinex Ltd.	ASN 04889010			O=C(CSc1nc(nc2sc3CCCCc3c12)C1CC1)NCc1ccco1	InChI=1S/C20H21N3O2S2/c24-16(21-10-13-4-3-9-25-13)11-26-19-17-14-5-1-2-6-15(14)27-20(17)23-18(22-19)12-7-8-12/h3-4,9,12H,1-2,5-8,10-11H2,(H,21,24)	NUKIUZWHVLPGCZ-UHFFFAOYSA-N	399.107518322							106015
Methyl 2-({[(1-ethyl-1H-pyrazol-4-yl)carbonyl]carbamothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate	LSM-17377	SID17433158, BRD-K93592515	1968518	InChI=1S/C19H24N4O3S2/c1-3-23-11-12(10-20-23)16(24)21-19(27)22-17-15(18(25)26-2)13-8-6-4-5-7-9-14(13)28-17/h10-11H,3-9H2,1-2H3,(H2,21,22,24,27)	DTVRPXOVDRDBKJ-UHFFFAOYSA-N	CCn1cc(cn1)C(=O)NC(=S)Nc2sc3CCCCCCc3c2C(=O)OC	BroadT	BRD-K93592515	BRD-K93592515-001-06-4	ChemBridge Corporation	7659827			CCn1cc(cn1)C(=O)NC(=S)Nc1sc2CCCCCCc2c1C(=O)OC	InChI=1S/C19H24N4O3S2/c1-3-23-11-12(10-20-23)16(24)21-19(27)22-17-15(18(25)26-2)13-8-6-4-5-7-9-14(13)28-17/h10-11H,3-9H2,1-2H3,(H2,21,22,24,27)	DTVRPXOVDRDBKJ-UHFFFAOYSA-N	420.128982048							106016
MLS000074883	LSM-17378	SID849429, BRD-A24853499	651915	InChI=1S/C17H21N3O3S2/c1-25(21,22)20-7-6-13-9-12(4-5-16(13)20)15-11-24-17(19-15)18-10-14-3-2-8-23-14/h4-5,9,11,14H,2-3,6-8,10H2,1H3,(H,18,19)	HCUGIGFUDQJVOG-UHFFFAOYSA-N	CS(=O)(=O)N1CCc2cc(ccc12)c3csc(NCC4CCCO4)n3	BroadT	BRD-A24853499	BRD-A24853499-001-05-8	Asinex Ltd.	ASN 08220445			CS(=O)(=O)N1CCc2cc(ccc12)-c1csc(NCC2CCCO2)n1	InChI=1S/C17H21N3O3S2/c1-25(21,22)20-7-6-13-9-12(4-5-16(13)20)15-11-24-17(19-15)18-10-14-3-2-8-23-14/h4-5,9,11,14H,2-3,6-8,10H2,1H3,(H,18,19)	HCUGIGFUDQJVOG-UHFFFAOYSA-N	379.102432942							106017
F0651-0220	LSM-17379	SID24816900, BRD-K95014315	5223767	InChI=1S/C19H19N3O3/c1-13-9-16-10-15(5-8-18(16)21(13)2)12-20-19(23)11-14-3-6-17(7-4-14)22(24)25/h3-10H,11-12H2,1-2H3,(H,20,23)	YZGBPEZHIPIMSA-UHFFFAOYSA-N	Cc1cc2cc(CNC(=O)Cc3ccc(cc3)[N+](=O)[O-])ccc2n1C	BroadT	BRD-K95014315	BRD-K95014315-001-05-1	Life Chemicals Inc.	F0651-0220			Cc1cc2cc(CNC(=O)Cc3ccc(cc3)[N+]([O-])=O)ccc2n1C	InChI=1S/C19H19N3O3/c1-13-9-16-10-15(5-8-18(16)21(13)2)12-20-19(23)11-14-3-6-17(7-4-14)22(24)25/h3-10H,11-12H2,1-2H3,(H,20,23)	YZGBPEZHIPIMSA-UHFFFAOYSA-N	337.142641498							106018
F1430-0092	LSM-17380	SID14746461, BRD-K64422798	763786	InChI=1S/C16H15N3S/c1-12-7-9-14(10-8-12)19-11-17-15(18-16(19)20)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,17,18,20)	AIMWEBWUEILSCH-UHFFFAOYSA-N	Cc1ccc(cc1)N2CN=C(N=C2S)c3ccccc3	BroadT	BRD-K64422798	BRD-K64422798-001-05-9	ChemBridge Corporation	5629428			Cc1ccc(cc1)N1CN=C(N=C1S)c1ccccc1	InChI=1S/C16H15N3S/c1-12-7-9-14(10-8-12)19-11-17-15(18-16(19)20)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,17,18,20)	AIMWEBWUEILSCH-UHFFFAOYSA-N	281.0986682							106019
SMR000176456	LSM-43722	SID17507371, BRD-K82283938	5761675	InChI=1S/C21H19N3O/c1-3-24-20(23-19-11-7-5-9-17(19)21(24)25)13-12-15-14(2)22-18-10-6-4-8-16(15)18/h4-13,22H,3H2,1-2H3/b13-12+	IOWRYAAXGNIWOH-OUKQBFOZSA-N	CCN1C(=Nc2ccccc2C1=O)\C=C\c3c(C)[nH]c4ccccc34	BroadT	BRD-K82283938	BRD-K82283938-001-06-2	Asinex Ltd.	BAS 01076320			CCn1c(\C=C\c2c(C)[nH]c3ccccc23)nc2ccccc2c1=O	InChI=1S/C21H19N3O/c1-3-24-20(23-19-11-7-5-9-17(19)21(24)25)13-12-15-14(2)22-18-10-6-4-8-16(15)18/h4-13,22H,3H2,1-2H3/b13-12+	IOWRYAAXGNIWOH-OUKQBFOZSA-N	329.152812258							
AMBCB13626335	LSM-17382	SID24780274, BRD-K36922181	16187293	InChI=1S/C24H28N6O/c1-18-20(16-29(4)26-18)15-27(2)17-21-23(25-22-12-8-9-13-30(21)22)24(31)28(3)14-19-10-6-5-7-11-19/h5-13,16H,14-15,17H2,1-4H3	ZHKFHBPIDOGDMG-UHFFFAOYSA-N	CN(Cc1cn(C)nc1C)Cc2c(nc3ccccn23)C(=O)N(C)Cc4ccccc4	BroadT	BRD-K36922181	BRD-K36922181-001-05-8	ChemBridge Corporation	13626335			CN(Cc1cn(C)nc1C)Cc1c(nc2ccccn12)C(=O)N(C)Cc1ccccc1	InChI=1S/C24H28N6O/c1-18-20(16-29(4)26-18)15-27(2)17-21-23(25-22-12-8-9-13-30(21)22)24(31)28(3)14-19-10-6-5-7-11-19/h5-13,16H,14-15,17H2,1-4H3	ZHKFHBPIDOGDMG-UHFFFAOYSA-N	416.232459576							106021
AC1M06TP	LSM-17383	BRD-K19000937	1991622	InChI=1S/C8H11N3OS/c1-2-9-8(13)11-10-6-7-4-3-5-12-7/h3-6H,2H2,1H3,(H2,9,11,13)	SRSVSAGXHKFOOZ-UHFFFAOYSA-N	CCN=C(S)NN=Cc1occc1	BroadT	BRD-K19000937	BRD-K19000937-001-05-1	Enamine Ltd.	T0515-9252			CCN=C(S)NN=Cc1ccco1	InChI=1S/C8H11N3OS/c1-2-9-8(13)11-10-6-7-4-3-5-12-7/h3-6H,2H2,1H3,(H2,9,11,13)	SRSVSAGXHKFOOZ-UHFFFAOYSA-N	197.062282692							106022
N2-Phenylnaphtho[1,2-b]thiophene-2-carboxamide	LSM-17384	SID26728798, BRD-K19209439	2825931	InChI=1S/C19H13NOS/c21-19(20-15-7-2-1-3-8-15)17-12-14-11-10-13-6-4-5-9-16(13)18(14)22-17/h1-12H,(H,20,21)	MRJHKMFTDSLRQA-UHFFFAOYSA-N	O=C(Nc1ccccc1)c2cc3ccc4ccccc4c3s2	BroadT	BRD-K19209439	BRD-K19209439-001-05-1	Maybridge	PD 00015			O=C(Nc1ccccc1)c1cc2ccc3ccccc3c2s1	InChI=1S/C19H13NOS/c21-19(20-15-7-2-1-3-8-15)17-12-14-11-10-13-6-4-5-9-16(13)18(14)22-17/h1-12H,(H,20,21)	MRJHKMFTDSLRQA-UHFFFAOYSA-N	303.071784736							106023
MLS000699850	LSM-17385	SID22414057, BRD-K20716797	676678	InChI=1S/C10H7F3N4/c1-4-14-5-2-7-8(3-6(5)15-4)17-9(16-7)10(11,12)13/h2-3H,1H3,(H,14,15)(H,16,17)	JAEVGTNIGRKNBP-UHFFFAOYSA-N	Cc1nc2cc3[nH]c(nc3cc2[nH]1)C(F)(F)F	BroadT	BRD-K20716797	BRD-K20716797-001-06-6	Specs	AG-205/33653012			Cc1nc2cc3[nH]c(nc3cc2[nH]1)C(F)(F)F	InChI=1S/C10H7F3N4/c1-4-14-5-2-7-8(3-6(5)15-4)17-9(16-7)10(11,12)13/h2-3H,1H3,(H,14,15)(H,16,17)	JAEVGTNIGRKNBP-UHFFFAOYSA-N	240.062280864							106024
1-Methoxy-n-[4-(pyridin-4-ylmethyl)phenyl]naphthalene-2-carboxamide	LSM-17386	SID17431679, BRD-K65711064	1075603	InChI=1S/C24H20N2O2/c1-28-23-21-5-3-2-4-19(21)8-11-22(23)24(27)26-20-9-6-17(7-10-20)16-18-12-14-25-15-13-18/h2-15H,16H2,1H3,(H,26,27)	UEYVGLOXNLBJLK-UHFFFAOYSA-N	COc1c(ccc2ccccc12)C(=O)Nc3ccc(Cc4ccncc4)cc3	BroadT	BRD-K65711064	BRD-K65711064-001-05-1	Asinex Ltd.	BAS 04846636			COc1c(ccc2ccccc12)C(=O)Nc1ccc(Cc2ccncc2)cc1	InChI=1S/C24H20N2O2/c1-28-23-21-5-3-2-4-19(21)8-11-22(23)24(27)26-20-9-6-17(7-10-20)16-18-12-14-25-15-13-18/h2-15H,16H2,1H3,(H,26,27)	UEYVGLOXNLBJLK-UHFFFAOYSA-N	368.1524779							106025
F0020-0217	LSM-17387	SID17508083, BRD-A36246838	3091436	InChI=1S/C16H20N2O2S/c1-10(2)20-15(19)13-11(3)18(4)16(21)17-14(13)12-8-6-5-7-9-12/h5-10,14H,1-4H3,(H,17,21)	RLSOWXJJZQEWFN-UHFFFAOYSA-N	CC(C)OC(=O)C1=C(C)N(C)C(=NC1c2ccccc2)S	BroadT	BRD-A36246838	BRD-A36246838-001-06-9	Asinex Ltd.	BAS 00116998			CC(C)OC(=O)C1=C(C)N(C)C(S)=NC1c1ccccc1	InChI=1S/C16H20N2O2S/c1-10(2)20-15(19)13-11(3)18(4)16(21)17-14(13)12-8-6-5-7-9-12/h5-10,14H,1-4H3,(H,17,21)	RLSOWXJJZQEWFN-UHFFFAOYSA-N	304.12454859							106026
MLS000113138	LSM-17388	SID7972050, BRD-K66604754	2297216	InChI=1S/C17H24O5/c1-4-13-8-7-9-14(12-13)22-11-10-15(16(18)20-5-2)17(19)21-6-3/h7-9,12,15H,4-6,10-11H2,1-3H3	QYQSGVKXTNXPCQ-UHFFFAOYSA-N	CCOC(=O)C(CCOc1cccc(CC)c1)C(=O)OCC	BroadT	BRD-K66604754	BRD-K66604754-001-06-0	ChemBridge Corporation	7005264			CCOC(=O)C(CCOc1cccc(CC)c1)C(=O)OCC	InChI=1S/C17H24O5/c1-4-13-8-7-9-14(12-13)22-11-10-15(16(18)20-5-2)17(19)21-6-3/h7-9,12,15H,4-6,10-11H2,1-3H3	QYQSGVKXTNXPCQ-UHFFFAOYSA-N	308.162373868							106027
AC1LWZG4	LSM-2387	BRD-K17830172, BRD-K64970062	1789299	InChI=1S/C17H18N4O5/c1-11-3-4-13(9-12(11)2)19-15(22)6-7-16(23)20-18-10-14-5-8-17(26-14)21(24)25/h3-5,8-10H,6-7H2,1-2H3,(H,19,22)(H,20,23)	UKQWTRJZFLXIQL-UHFFFAOYSA-N	Cc1ccc(NC(=O)CCC(=O)NN=Cc2oc(cc2)[N+](=O)[O-])cc1C	BroadT	BRD-K17830172	BRD-K17830172-001-09-9	Broad Institute of MIT and Harvard	BRD-K64970062			Cc1ccc(NC(=O)CCC(=O)NN=Cc2ccc(o2)[N+]([O-])=O)cc1C	InChI=1S/C17H18N4O5/c1-11-3-4-13(9-12(11)2)19-15(22)6-7-16(23)20-18-10-14-5-8-17(26-14)21(24)25/h3-5,8-10H,6-7H2,1-2H3,(H,19,22)(H,20,23)	UKQWTRJZFLXIQL-UHFFFAOYSA-N	358.127719716							92319
MLS001049196	LSM-15193	BRD-K40844683	1595686	InChI=1S/C27H31N2O3S/c1-19-16-22(27(3,4)5)17-20(2)26(19)33-15-13-23-8-6-7-14-28(23)18-25(30)21-9-11-24(12-10-21)29(31)32/h6-12,14,16-17H,13,15,18H2,1-5H3/q+1	FCSPLBHOFZPWNK-UHFFFAOYSA-N	Cc1cc(cc(C)c1SCCc2cccc[n+]2CC(=O)c3ccc(cc3)[N+](=O)[O-])C(C)(C)C	BroadT	BRD-K40844683	BRD-K40844683-004-06-3	InterBioScreen Ltd.	STOCK1S-75892		Br	Cc1cc(cc(C)c1SCCc1cccc[n+]1CC(=O)c1ccc(cc1)[N+]([O-])=O)C(C)(C)C.Br	InChI=1S/C27H31N2O3S.BrH/c1-19-16-22(27(3,4)5)17-20(2)26(19)33-15-13-23-8-6-7-14-28(23)18-25(30)21-9-11-24(12-10-21)29(31)32;/h6-12,14,16-17H,13,15,18H2,1-5H3;1H/q+1;	FXJGOUOBZZBBCT-UHFFFAOYSA-N	463.205538562							103843, 103843
HMS2523H22	LSM-17389	BRD-K17536964	12005212	InChI=1S/C22H26N4O4/c1-25(18-8-4-2-5-9-18)21-13-12-19(26(28)29)14-17(21)15-23-24-22(27)16-30-20-10-6-3-7-11-20/h3,6-7,10-15,18H,2,4-5,8-9,16H2,1H3,(H,24,27)	LPAXYLXDCLVQJS-UHFFFAOYSA-N	CN(C1CCCCC1)c2ccc(cc2C=NNC(=O)COc3ccccc3)[N+](=O)[O-]	BroadT	BRD-K17536964	BRD-K17536964-001-05-2	ChemDiv Inc.	8004-1193			CN(C1CCCCC1)c1ccc(cc1C=NNC(=O)COc1ccccc1)[N+]([O-])=O	InChI=1S/C22H26N4O4/c1-25(18-8-4-2-5-9-18)21-13-12-19(26(28)29)14-17(21)15-23-24-22(27)16-30-20-10-6-3-7-11-20/h3,6-7,10-15,18H,2,4-5,8-9,16H2,1H3,(H,24,27)	LPAXYLXDCLVQJS-UHFFFAOYSA-N	410.195405352							106028
2-(4-Bromophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine	LSM-17390	SID47203343, BRD-K40861126	684959	InChI=1S/C14H12BrN3/c1-9-7-10(2)18-14(16-9)8-13(17-18)11-3-5-12(15)6-4-11/h3-8H,1-2H3	XGZDOQBNVMZASH-UHFFFAOYSA-N	Cc1cc(C)n2nc(cc2n1)c3ccc(Br)cc3	BroadT	BRD-K40861126	BRD-K40861126-001-05-0	Asinex Ltd.	BAS 00406623			Cc1cc(C)n2nc(cc2n1)-c1ccc(Br)cc1	InChI=1S/C14H12BrN3/c1-9-7-10(2)18-14(16-9)8-13(17-18)11-3-5-12(15)6-4-11/h3-8H,1-2H3	XGZDOQBNVMZASH-UHFFFAOYSA-N	301.021460014							106029
ZINC00188637	LSM-17391	SID857603, BRD-K27680513	658951	InChI=1S/C18H17N3O2/c1-12-7-9-14(10-8-12)19-17(22)11-21-18(23)16-6-4-3-5-15(16)13(2)20-21/h3-10H,11H2,1-2H3,(H,19,22)	MZUOHTIFZLTPBQ-UHFFFAOYSA-N	CC1=NN(CC(=O)Nc2ccc(C)cc2)C(=O)c3ccccc13	BroadT	BRD-K27680513	BRD-K27680513-001-07-8	InterBioScreen Ltd.	STOCK1S-83991			Cc1ccc(NC(=O)Cn2nc(C)c3ccccc3c2=O)cc1	InChI=1S/C18H17N3O2/c1-12-7-9-14(10-8-12)19-17(22)11-21-18(23)16-6-4-3-5-15(16)13(2)20-21/h3-10H,11H2,1-2H3,(H,19,22)	MZUOHTIFZLTPBQ-UHFFFAOYSA-N	307.132076814							106030
4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)quinoline-3-carbonitrile	LSM-17392	SID859399, BRD-K00136517	660695	InChI=1S/C14H10F5N3O2/c1-23-7-3-4-8(24-2)11-9(7)10(21)6(5-20)12(22-11)13(15,16)14(17,18)19/h3-4H,1-2H3,(H2,21,22)	BGMUZNANPQUDEH-UHFFFAOYSA-N	COc1ccc(OC)c2c(N)c(C#N)c(nc12)C(F)(F)C(F)(F)F	BroadT	BRD-K00136517	BRD-K00136517-001-06-0	InterBioScreen Ltd.	STOCK3S-04542			COc1ccc(OC)c2c(N)c(C#N)c(nc12)C(F)(F)C(F)(F)F	InChI=1S/C14H10F5N3O2/c1-23-7-3-4-8(24-2)11-9(7)10(21)6(5-20)12(22-11)13(15,16)14(17,18)19/h3-4H,1-2H3,(H2,21,22)	BGMUZNANPQUDEH-UHFFFAOYSA-N	347.06931759							106031
AC1O0YUW	LSM-43723	SID26667249, BRD-A44986668	6081455	InChI=1S/C20H17NO5S2/c1-25-14-10-6-9-13(17(14)26-2)11-15-18(22)21(20(27)28-15)16(19(23)24)12-7-4-3-5-8-12/h3-11,16H,1-2H3,(H,23,24)/b15-11-	FWZXAFVNVQVFNB-PTNGSMBKSA-N	COc1cccc(\C=C\2/SC(=S)N(C(C(=O)O)c3ccccc3)C2=O)c1OC	BroadT	BRD-A44986668	BRD-A44986668-001-05-7	InterBioScreen Ltd.	STOCK3S-94914			COc1cccc(\C=C2/SC(=S)N(C(C(O)=O)c3ccccc3)C2=O)c1OC	InChI=1S/C20H17NO5S2/c1-25-14-10-6-9-13(17(14)26-2)11-15-18(22)21(20(27)28-15)16(19(23)24)12-7-4-3-5-8-12/h3-11,16H,1-2H3,(H,23,24)/b15-11-	FWZXAFVNVQVFNB-PTNGSMBKSA-N	415.054814034							
ZINC00187793	LSM-17394	SID7975637, BRD-K25186008	745548	InChI=1S/C19H17NO4/c21-14-6-7-16-15(12-14)17(19(22)20-8-10-23-11-9-20)18(24-16)13-4-2-1-3-5-13/h1-7,12,21H,8-11H2	KYBZDPDOJLSNSO-UHFFFAOYSA-N	Oc1ccc2oc(c3ccccc3)c(C(=O)N4CCOCC4)c2c1	BroadT	BRD-K25186008	BRD-K25186008-001-05-4	ChemBridge Corporation	6237918			Oc1ccc2oc(-c3ccccc3)c(C(=O)N3CCOCC3)c2c1	InChI=1S/C19H17NO4/c21-14-6-7-16-15(12-14)17(19(22)20-8-10-23-11-9-20)18(24-16)13-4-2-1-3-5-13/h1-7,12,21H,8-11H2	KYBZDPDOJLSNSO-UHFFFAOYSA-N	323.115758034							106033
3-Phenylcinnolin-4-ol	LSM-17395	SID863862, BRD-K04930464	665115	InChI=1S/C14H10N2O/c17-14-11-8-4-5-9-12(11)15-16-13(14)10-6-2-1-3-7-10/h1-9H,(H,15,17)	DCVQXYWIIQWVKR-UHFFFAOYSA-N	Oc1c(nnc2ccccc12)c3ccccc3	BroadT	BRD-K04930464	BRD-K04930464-001-05-7	InterBioScreen Ltd.	STOCK4S-91270			Oc1c(nnc2ccccc12)-c1ccccc1	InChI=1S/C14H10N2O/c17-14-11-8-4-5-9-12(11)15-16-13(14)10-6-2-1-3-7-10/h1-9H,(H,15,17)	DCVQXYWIIQWVKR-UHFFFAOYSA-N	222.07931296							106034
MLS000438485	LSM-17396	SID26755890, SID46500279, BRD-K96826341	16759675	InChI=1S/C18H17BrN2O4/c1-11-15(17(22)24-2)16(12-5-7-13(19)8-6-12)20-18(23)21(11)10-14-4-3-9-25-14/h3-9,16H,10H2,1-2H3,(H,20,23)/t16-/m1/s1	WSQYIXJQYZACJD-MRXNPFEDSA-N	COC(=O)C1=C(C)N(Cc2occc2)C(=O)N[C@@H]1c3ccc(Br)cc3	BroadT	BRD-K96826341	BRD-K96826341-001-06-3	Boston University CMLD	CMLD004165 CMLD004165			COC(=O)C1=C(C)N(Cc2ccco2)C(=O)N[C@@H]1c1ccc(Br)cc1	InChI=1S/C18H17BrN2O4/c1-11-15(17(22)24-2)16(12-5-7-13(19)8-6-12)20-18(23)21(11)10-14-4-3-9-25-14/h3-9,16H,10H2,1-2H3,(H,20,23)/t16-/m1/s1	WSQYIXJQYZACJD-MRXNPFEDSA-N	404.037169644							106035
T5312251	LSM-17397	SID17516527, BRD-K53035405	2456622	InChI=1S/C17H15Cl2NO2/c18-14-5-2-6-15(17(14)19)22-10-16(21)20-13-8-7-11-3-1-4-12(11)9-13/h2,5-9H,1,3-4,10H2,(H,20,21)	MQRPMZUQJJIFBP-UHFFFAOYSA-N	Clc1cccc(OCC(=O)Nc2ccc3CCCc3c2)c1Cl	BroadT	BRD-K53035405	BRD-K53035405-001-05-7	Enamine Ltd.	T5312251			Clc1cccc(OCC(=O)Nc2ccc3CCCc3c2)c1Cl	InChI=1S/C17H15Cl2NO2/c18-14-5-2-6-15(17(14)19)22-10-16(21)20-13-8-7-11-3-1-4-12(11)9-13/h2,5-9H,1,3-4,10H2,(H,20,21)	MQRPMZUQJJIFBP-UHFFFAOYSA-N	335.04798415							106036
MLS000699535	LSM-17398	SID22414000, BRD-A86643985	10638284	InChI=1S/C17H15N5O/c1-11-17(21-16(10-19)15(9-18)20-11)12(2)22(13(3)23)14-7-5-4-6-8-14/h4-8,12H,1-3H3	YGUKSUHOJOATSX-UHFFFAOYSA-N	CC(N(C(=O)C)c1ccccc1)c2nc(C#N)c(nc2C)C#N	BroadT	BRD-A86643985	BRD-A86643985-001-06-7	Specs	AQ-917/42754469			CC(N(C(C)=O)c1ccccc1)c1nc(C#N)c(nc1C)C#N	InChI=1S/C17H15N5O/c1-11-17(21-16(10-19)15(9-18)20-11)12(2)22(13(3)23)14-7-5-4-6-8-14/h4-8,12H,1-3H3	YGUKSUHOJOATSX-UHFFFAOYSA-N	305.12766015							106037
ZINC03559496	LSM-17399	SID24830553, BRD-K18665639	2676787	InChI=1S/C11H10F2N2O2S/c12-10(13)17-8-3-1-2-7(6-8)9(16)15-11-14-4-5-18-11/h1-3,6,10H,4-5H2,(H,14,15,16)	SXIIWLMZXIGPJU-UHFFFAOYSA-N	FC(F)Oc1cccc(c1)C(=O)NC2=NCCS2	BroadT	BRD-K18665639	BRD-K18665639-001-05-3	Enamine Ltd.	ZT-5567137			FC(F)Oc1cccc(c1)C(=O)NC1=NCCS1	InChI=1S/C11H10F2N2O2S/c12-10(13)17-8-3-1-2-7(6-8)9(16)15-11-14-4-5-18-11/h1-3,6,10H,4-5H2,(H,14,15,16)	SXIIWLMZXIGPJU-UHFFFAOYSA-N	272.04310467							106038
MLS000081000	LSM-17400	SID865540, BRD-K36622995	5390049	InChI=1S/C17H19NO4/c19-15-5-4-12-11-2-1-3-13(11)17(20)22-16(12)14(15)10-18-6-8-21-9-7-18/h4-5,19H,1-3,6-10H2	UNUWHKZZVYFJEQ-UHFFFAOYSA-N	Oc1ccc2C3=C(CCC3)C(=O)Oc2c1CN4CCOCC4	BroadT	BRD-K36622995	BRD-K36622995-001-04-3	InterBioScreen Ltd.	STOCK5S-48368			Oc1ccc2c3CCCc3c(=O)oc2c1CN1CCOCC1	InChI=1S/C17H19NO4/c19-15-5-4-12-11-2-1-3-13(11)17(20)22-16(12)14(15)10-18-6-8-21-9-7-18/h4-5,19H,1-3,6-10H2	UNUWHKZZVYFJEQ-UHFFFAOYSA-N	301.131408098							106039
F0556-0571	LSM-17401	SID17515664, BRD-K86003941	2152178	InChI=1S/C24H23NO5/c1-16-5-3-6-17(13-16)14-25-12-11-19-20(23(25)26)7-4-8-21(19)29-15-18-9-10-22(30-18)24(27)28-2/h3-10,13H,11-12,14-15H2,1-2H3	APPKDJFEFITDLH-UHFFFAOYSA-N	COC(=O)c1oc(COc2cccc3C(=O)N(Cc4cccc(C)c4)CCc23)cc1	BroadT	BRD-K86003941	BRD-K86003941-001-06-5	Life Chemicals Inc.	F0556-0571			COC(=O)c1ccc(COc2cccc3C(=O)N(Cc4cccc(C)c4)CCc23)o1	InChI=1S/C24H23NO5/c1-16-5-3-6-17(13-16)14-25-12-11-19-20(23(25)26)7-4-8-21(19)29-15-18-9-10-22(30-18)24(27)28-2/h3-10,13H,11-12,14-15H2,1-2H3	APPKDJFEFITDLH-UHFFFAOYSA-N	405.157622846							106040
F0547-0313	LSM-17402	DNDI1417072, BRD-K31406313	3242299	InChI=1S/C11H16N2O2S2/c1-14-6-4-12-8-13(11(16)17-9-12)7-10-3-2-5-15-10/h2-3,5H,4,6-9H2,1H3	NRCILBJQBRWWFJ-UHFFFAOYSA-N	COCCN1CSC(=S)N(Cc2occc2)C1	BroadT	BRD-K31406313	BRD-K31406313-001-05-8	ChemDiv Inc.	K417-0313			COCCN1CSC(=S)N(Cc2ccco2)C1	InChI=1S/C11H16N2O2S2/c1-14-6-4-12-8-13(11(16)17-9-12)7-10-3-2-5-15-10/h2-3,5H,4,6-9H2,1H3	NRCILBJQBRWWFJ-UHFFFAOYSA-N	272.065319152							106041
3-Ethyl-6-(4-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine	LSM-17403	SID26662684, BRD-K32291509	916370	InChI=1S/C12H11N5O2S/c1-2-11-13-14-12-16(11)15-10(7-20-12)8-3-5-9(6-4-8)17(18)19/h3-6H,2,7H2,1H3	ITADYLNLPMLBPQ-UHFFFAOYSA-N	CCc1nnc2SCC(=Nn12)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-K32291509	BRD-K32291509-001-06-5	InterBioScreen Ltd.	STOCK1S-80197			CCc1nnc2SCC(=Nn12)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C12H11N5O2S/c1-2-11-13-14-12-16(11)15-10(7-20-12)8-3-5-9(6-4-8)17(18)19/h3-6H,2,7H2,1H3	ITADYLNLPMLBPQ-UHFFFAOYSA-N	289.063345332							106042
MLS000756511	LSM-17404	SID26664771, BRD-K46788972	309498	InChI=1S/C18H18N2O4/c1-14-12-17(8-9-18(14)20(21)22)24-11-3-2-10-23-16-6-4-15(13-19)5-7-16/h4-9,12H,2-3,10-11H2,1H3	YAARDHUAQHWZFX-UHFFFAOYSA-N	Cc1cc(OCCCCOc2ccc(cc2)C#N)ccc1[N+](=O)[O-]	BroadT	BRD-K46788972	BRD-K46788972-001-05-4	National Cancer Institute Chemotherapeutic Agents Repository	211787			Cc1cc(OCCCCOc2ccc(cc2)C#N)ccc1[N+]([O-])=O	InChI=1S/C18H18N2O4/c1-14-12-17(8-9-18(14)20(21)22)24-11-3-2-10-23-16-6-4-15(13-19)5-7-16/h4-9,12H,2-3,10-11H2,1H3	YAARDHUAQHWZFX-UHFFFAOYSA-N	326.126657076							106043
8-[2-(4-Chloro-3,5-dimethylphenoxy)ethoxy]quinoline	LSM-17405	SID14739718, BRD-K20387983	2282895	InChI=1S/C19H18ClNO2/c1-13-11-16(12-14(2)18(13)20)22-9-10-23-17-7-3-5-15-6-4-8-21-19(15)17/h3-8,11-12H,9-10H2,1-2H3	JXRQZXBZIQEWOC-UHFFFAOYSA-N	Cc1cc(OCCOc2cccc3cccnc23)cc(C)c1Cl	BroadT	BRD-K20387983	BRD-K20387983-001-05-2	ChemBridge Corporation	6436959			Cc1cc(OCCOc2cccc3cccnc23)cc(C)c1Cl	InChI=1S/C19H18ClNO2/c1-13-11-16(12-14(2)18(13)20)22-9-10-23-17-7-3-5-15-6-4-8-21-19(15)17/h3-8,11-12H,9-10H2,1-2H3	JXRQZXBZIQEWOC-UHFFFAOYSA-N	327.102606536							106044
SMR000041865	LSM-17406	SID859955, SID87345665, BRD-A56879261	661257	InChI=1S/C15H16ClN5O/c1-10(8-22-2)20-14-13-7-19-21(15(13)18-9-17-14)12-5-3-11(16)4-6-12/h3-7,9-10H,8H2,1-2H3,(H,17,18,20)	BTFGRCQEMPUWNL-UHFFFAOYSA-N	COCC(C)Nc1ncnc2c1cnn2c3ccc(Cl)cc3	BroadT	BRD-A56879261	BRD-A56879261-001-06-8	InterBioScreen Ltd.	STOCK3S-40672			COCC(C)Nc1ncnc2n(ncc12)-c1ccc(Cl)cc1	InChI=1S/C15H16ClN5O/c1-10(8-22-2)20-14-13-7-19-21(15(13)18-9-17-14)12-5-3-11(16)4-6-12/h3-7,9-10H,8H2,1-2H3,(H,17,18,20)	BTFGRCQEMPUWNL-UHFFFAOYSA-N	317.104337892							106045
T0514-2230	LSM-43724	SID24827700, BRD-K46407589	2387991	InChI=1S/C20H25NO4/c1-24-18-9-5-8-17(14-18)10-11-20(23)25-15-19(22)21-13-12-16-6-3-2-4-7-16/h5-6,8-11,14H,2-4,7,12-13,15H2,1H3,(H,21,22)/b11-10+	LMVZTBIOACDZHD-ZHACJKMWSA-N	COc1cccc(\C=C\C(=O)OCC(=O)NCCC2=CCCCC2)c1	BroadT	BRD-K46407589	BRD-K46407589-001-05-6	Enamine Ltd.	T0514-2230			COc1cccc(\C=C\C(=O)OCC(=O)NCCC2=CCCCC2)c1	InChI=1S/C20H25NO4/c1-24-18-9-5-8-17(14-18)10-11-20(23)25-15-19(22)21-13-12-16-6-3-2-4-7-16/h5-6,8-11,14H,2-4,7,12-13,15H2,1H3,(H,21,22)/b11-10+	LMVZTBIOACDZHD-ZHACJKMWSA-N	343.17835829							
AC1NZY5A	LSM-43725	SID26661902, BRD-K73306486	5920595	InChI=1S/C21H17N3O4/c1-13-8-14(2)10-16(9-13)28-19-17(11-15(12-22)21(26)27-3)20(25)24-7-5-4-6-18(24)23-19/h4-11H,1-3H3/b15-11+	AEFLTQLCLGCAJJ-RVDMUPIBSA-N	COC(=O)\C(=C\C1=C(Oc2cc(C)cc(C)c2)N=C3C=CC=CN3C1=O)\C#N	BroadT	BRD-K73306486	BRD-K73306486-001-04-3	InterBioScreen Ltd.	STOCK4S-38963			COC(=O)C(=C\c1c(Oc2cc(C)cc(C)c2)nc2ccccn2c1=O)\C#N	InChI=1S/C21H17N3O4/c1-13-8-14(2)10-16(9-13)28-19-17(11-15(12-22)21(26)27-3)20(25)24-7-5-4-6-18(24)23-19/h4-11H,1-3H3/b15-11+	AEFLTQLCLGCAJJ-RVDMUPIBSA-N	375.121906054							
4-(4-Chlorophenoxy)-1-morpholin-4-ylbutan-1-one	LSM-17409	SID4257338, BRD-K26824778	1565330	InChI=1S/C14H18ClNO3/c15-12-3-5-13(6-4-12)19-9-1-2-14(17)16-7-10-18-11-8-16/h3-6H,1-2,7-11H2	HSRRXYCDUUXMNY-UHFFFAOYSA-N	Clc1ccc(OCCCC(=O)N2CCOCC2)cc1	BroadT	BRD-K26824778	BRD-K26824778-001-05-7	ChemBridge Corporation	6809679			Clc1ccc(OCCCC(=O)N2CCOCC2)cc1	InChI=1S/C14H18ClNO3/c15-12-3-5-13(6-4-12)19-9-1-2-14(17)16-7-10-18-11-8-16/h3-6H,1-2,7-11H2	HSRRXYCDUUXMNY-UHFFFAOYSA-N	283.097521156							106048
MLS000374660	LSM-17410	SID22401680, BRD-K75978672	3396597	InChI=1S/C20H26FN3O4S2/c1-3-24(4-2)30(27,28)18-11-12-20(23-13-5-6-14-23)19(15-18)22-29(25,26)17-9-7-16(21)8-10-17/h7-12,15,22H,3-6,13-14H2,1-2H3	PGYYQMOLFCFCMF-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(NS(=O)(=O)c3ccc(F)cc3)c1	BroadT	BRD-K75978672	BRD-K75978672-001-05-8	Enamine Ltd.	T0517-6652			CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(NS(=O)(=O)c2ccc(F)cc2)c1	InChI=1S/C20H26FN3O4S2/c1-3-24(4-2)30(27,28)18-11-12-20(23-13-5-6-14-23)19(15-18)22-29(25,26)17-9-7-16(21)8-10-17/h7-12,15,22H,3-6,13-14H2,1-2H3	PGYYQMOLFCFCMF-UHFFFAOYSA-N	455.134875922							106049
STK096973	LSM-15194	BRD-K68145968	2264189	InChI=1S/C12H12ClN2O/c1-14-6-7-15(9-14)8-12(16)10-2-4-11(13)5-3-10/h2-7,9H,8H2,1H3/q+1	VAPRSYGEPKZLNA-UHFFFAOYSA-N	Cn1cc[n+](CC(=O)c2ccc(Cl)cc2)c1	BroadT	BRD-K68145968	BRD-K68145968-004-05-0	ChemBridge Corporation	6036914		Br	Cn1cc[n+](CC(=O)c2ccc(Cl)cc2)c1.Br	InChI=1S/C12H12ClN2O.BrH/c1-14-6-7-15(9-14)8-12(16)10-2-4-11(13)5-3-10;/h2-7,9H,8H2,1H3;1H/q+1;	KXIKUNMXRCNYGK-UHFFFAOYSA-N	235.063815734							103844, 103844
AC1LDCR3	LSM-17411	SID863708, BRD-K53472839	664960	InChI=1S/C20H21N3O2/c1-13(2)23(20(25)15-6-8-21-9-7-15)12-17-11-16-5-4-14(3)10-18(16)22-19(17)24/h4-11,13H,12H2,1-3H3,(H,22,24)	QYJVCMLMINQANH-UHFFFAOYSA-N	CC(C)N(Cc1cc2ccc(C)cc2nc1O)C(=O)c3ccncc3	BroadT	BRD-K53472839	BRD-K53472839-001-05-8	InterBioScreen Ltd.	STOCK4S-82451			CC(C)N(Cc1cc2ccc(C)cc2nc1O)C(=O)c1ccncc1	InChI=1S/C20H21N3O2/c1-13(2)23(20(25)15-6-8-21-9-7-15)12-17-11-16-5-4-14(3)10-18(16)22-19(17)24/h4-11,13H,12H2,1-3H3,(H,22,24)	QYJVCMLMINQANH-UHFFFAOYSA-N	335.163376942							106050
1-(3,4-Dimethyl-phenyl)-3-(pyrimidin-2-ylsulfanyl)-pyrrolidine-2,5-dione	LSM-17412	SID49642820, BRD-A96710964	2932026	InChI=1S/C16H15N3O2S/c1-10-4-5-12(8-11(10)2)19-14(20)9-13(15(19)21)22-16-17-6-3-7-18-16/h3-8,13H,9H2,1-2H3	UIYJICROOQGZQK-UHFFFAOYSA-N	Cc1ccc(cc1C)N2C(=O)CC(Sc3ncccn3)C2=O	BroadT	BRD-A96710964	BRD-A96710964-001-05-9	Asinex Ltd.	BAS 05289225			Cc1ccc(cc1C)N1C(=O)CC(Sc2ncccn2)C1=O	InChI=1S/C16H15N3O2S/c1-10-4-5-12(8-11(10)2)19-14(20)9-13(15(19)21)22-16-17-6-3-7-18-16/h3-8,13H,9H2,1-2H3	UIYJICROOQGZQK-UHFFFAOYSA-N	313.08849744							106051
42062-91-9	LSM-17413	SID47202702, BRD-K18381351	812443	InChI=1S/C13H14N2OS2/c1-2-7-15-12(16)10-8-5-3-4-6-9(8)18-11(10)14-13(15)17/h2H,1,3-7H2,(H,14,17)	ZDHGJHRONIXYAM-UHFFFAOYSA-N	C=CCN1C(=S)Nc2sc3CCCCc3c2C1=O	BroadT	BRD-K18381351	BRD-K18381351-001-06-1	Asinex Ltd.	BAS 00435717			C=CCn1c(=S)[nH]c2sc3CCCCc3c2c1=O	InChI=1S/C13H14N2OS2/c1-2-7-15-12(16)10-8-5-3-4-6-9(8)18-11(10)14-13(15)17/h2H,1,3-7H2,(H,14,17)	ZDHGJHRONIXYAM-UHFFFAOYSA-N	278.054754468							106052
AC1OA503	LSM-17414	BRD-K16256682	6747942	InChI=1S/C13H12N4O4/c1-21-10-4-2-3-8(12(10)19)7-14-17-13(20)9-5-6-11(18)16-15-9/h2-7,19H,1H3,(H,16,18)(H,17,20)	WGOHPPXXDNTAIU-UHFFFAOYSA-N	COc1cccc(C=NNC(=O)c2ccc(O)nn2)c1O	BroadT	BRD-K16256682	BRD-K16256682-001-06-7	InterBioScreen Ltd.	STOCK2S-76046			COc1cccc(C=NNC(=O)c2ccc(O)nn2)c1O	InChI=1S/C13H12N4O4/c1-21-10-4-2-3-8(12(10)19)7-14-17-13(20)9-5-6-11(18)16-15-9/h2-7,19H,1H3,(H,16,18)(H,17,20)	WGOHPPXXDNTAIU-UHFFFAOYSA-N	288.085854904							
MLS000736773	LSM-17415	SID26666262, BRD-K28909472	250770	InChI=1S/C13H12N4O/c14-10-3-1-8-5-9-2-4-11(15)7-13(9)17(18)16-12(8)6-10/h1-4,6-7H,5,14-15H2	FYXDXHIWRLGMCA-UHFFFAOYSA-N	Nc1ccc2Cc3ccc(N)cc3[N+](=Nc2c1)[O-]	BroadT	BRD-K28909472	BRD-K28909472-001-05-3	National Cancer Institute Chemotherapeutic Agents Repository	70534			Nc1ccc2Cc3ccc(N)cc3[N+]([O-])=Nc2c1	InChI=1S/C13H12N4O/c14-10-3-1-8-5-9-2-4-11(15)7-13(9)17(18)16-12(8)6-10/h1-4,6-7H,5,14-15H2	FYXDXHIWRLGMCA-UHFFFAOYSA-N	240.101111044							106054
80809-38-7	LSM-17416	SID858483, BRD-K84851916	659796	InChI=1S/C6H6N4OS/c7-10-5(8-9-6(10)12)4-2-1-3-11-4/h1-3H,7H2,(H,9,12)	XLYBWYJEEHPZMQ-UHFFFAOYSA-N	Nn1c(S)nnc1c2occc2	BroadT	BRD-K84851916	BRD-K84851916-001-05-2	InterBioScreen Ltd.	STOCK2S-43648			Nn1c(S)nnc1-c1ccco1	InChI=1S/C6H6N4OS/c7-10-5(8-9-6(10)12)4-2-1-3-11-4/h1-3H,7H2,(H,9,12)	XLYBWYJEEHPZMQ-UHFFFAOYSA-N	182.026231542							106055
MLS000333177	LSM-43726	SID26663961, BRD-K20960840	941925	InChI=1S/C15H13N3OS/c1-18-9-5-8-12(18)10-13-14(19)17-15(20-13)16-11-6-3-2-4-7-11/h2-10H,1H3,(H,16,17,19)/b13-10-	LCISGORPEYFNGS-RAXLEYEMSA-N	Cn1cccc1\C=C\2/SC(=NC2=O)Nc3ccccc3	BroadT	BRD-K20960840	BRD-K20960840-001-05-9	InterBioScreen Ltd.	STOCK4S-60088			Cn1cccc1\C=C1/SC(Nc2ccccc2)=NC1=O	InChI=1S/C15H13N3OS/c1-18-9-5-8-12(18)10-13-14(19)17-15(20-13)16-11-6-3-2-4-7-11/h2-10H,1H3,(H,16,17,19)/b13-10-	LCISGORPEYFNGS-RAXLEYEMSA-N	283.077932756							
MLS000097999	LSM-17418	SID3717550, BRD-K49132652	2303250	InChI=1S/C14H14N4/c1-10-8-11(2)18-14(15-10)9-13(17-18)16-12-6-4-3-5-7-12/h3-9H,1-2H3,(H,16,17)	YPPYKGDEXRKFMA-UHFFFAOYSA-N	Cc1cc(C)n2nc(Nc3ccccc3)cc2n1	BroadT	BRD-K49132652	BRD-K49132652-001-06-7	Enamine Ltd.	T0504-3415			Cc1cc(C)n2nc(Nc3ccccc3)cc2n1	InChI=1S/C14H14N4/c1-10-8-11(2)18-14(15-10)9-13(17-18)16-12-6-4-3-5-7-12/h3-9H,1-2H3,(H,16,17)	YPPYKGDEXRKFMA-UHFFFAOYSA-N	238.121846488							106057
ZINC03438827	LSM-17419	SID26658152, BRD-K64036139	2558694	InChI=1S/C21H30N4O4/c1-13(2)10-24(17(26)12-29-16-9-7-6-8-15(16)5)18-19(22)25(11-14(3)4)21(28)23-20(18)27/h6-9,13-14H,10-12,22H2,1-5H3,(H,23,27,28)	XWJZQKPIPXFQBN-UHFFFAOYSA-N	CC(C)CN(C(=O)COc1ccccc1C)C2=C(N)N(CC(C)C)C(=O)NC2=O	BroadT	BRD-K64036139	BRD-K64036139-001-05-5	Enamine Ltd.	T5323085			CC(C)CN(C(=O)COc1ccccc1C)c1c(N)n(CC(C)C)c(=O)[nH]c1=O	InChI=1S/C21H30N4O4/c1-13(2)10-24(17(26)12-29-16-9-7-6-8-15(16)5)18-19(22)25(11-14(3)4)21(28)23-20(18)27/h6-9,13-14H,10-12,22H2,1-5H3,(H,23,27,28)	XWJZQKPIPXFQBN-UHFFFAOYSA-N	402.22670548							106058
MLS000564321	LSM-17420	SID14746015, BRD-K88811374	2062923	InChI=1S/C13H13N3S2/c1-8-9(2)18-13-11(8)12(15-7-16-13)14-6-10-4-3-5-17-10/h3-5,7H,6H2,1-2H3,(H,14,15,16)	KLHVRBIPSAKIKO-UHFFFAOYSA-N	Cc1sc2ncnc(NCc3cccs3)c2c1C	BroadT	BRD-K88811374	BRD-K88811374-001-07-3	Enamine Ltd.	T0513-6233			Cc1sc2ncnc(NCc3cccs3)c2c1C	InChI=1S/C13H13N3S2/c1-8-9(2)18-13-11(8)12(15-7-16-13)14-6-10-4-3-5-17-10/h3-5,7H,6H2,1-2H3,(H,14,15,16)	KLHVRBIPSAKIKO-UHFFFAOYSA-N	275.055088826							106059
N-(3-Methoxyphenyl)-2-(1-methyl-1H-indol-3-yl)acetamide	LSM-17421	SID4251696, BRD-K29828100	3245350	InChI=1S/C18H18N2O2/c1-20-12-13(16-8-3-4-9-17(16)20)10-18(21)19-14-6-5-7-15(11-14)22-2/h3-9,11-12H,10H2,1-2H3,(H,19,21)	GKMOBJZGEKVHAB-UHFFFAOYSA-N	COc1cccc(NC(=O)Cc2cn(C)c3ccccc23)c1	BroadT	BRD-K29828100	BRD-K29828100-001-05-4	ChemDiv Inc.	C320-0260			COc1cccc(NC(=O)Cc2cn(C)c3ccccc23)c1	InChI=1S/C18H18N2O2/c1-20-12-13(16-8-3-4-9-17(16)20)10-18(21)19-14-6-5-7-15(11-14)22-2/h3-9,11-12H,10H2,1-2H3,(H,19,21)	GKMOBJZGEKVHAB-UHFFFAOYSA-N	294.136827836							106060
8J-553S	LSM-17422	SID17410768, BRD-K63861371	1486667	InChI=1S/C19H14ClN3O/c20-14-8-9-17-16(11-14)23-19(24-17)15-7-4-10-21-18(15)22-12-13-5-2-1-3-6-13/h1-11H,12H2,(H,21,22)	SPSQGDIGJAIYSM-UHFFFAOYSA-N	Clc1ccc2oc(nc2c1)c3cccnc3NCc4ccccc4	BroadT	BRD-K63861371	BRD-K63861371-001-05-4	Key Organics Ltd.	8J-553S			Clc1ccc2oc(nc2c1)-c1cccnc1NCc1ccccc1	InChI=1S/C19H14ClN3O/c20-14-8-9-17-16(11-14)23-19(24-17)15-7-4-10-21-18(15)22-12-13-5-2-1-3-6-13/h1-11H,12H2,(H,21,22)	SPSQGDIGJAIYSM-UHFFFAOYSA-N	335.082539808							106061
AC1MH6TN	LSM-17423	SID24792462, BRD-A41187236	2972359	InChI=1S/C22H18N2O2/c25-21-14-8-7-13-18(21)20-15-19(16-9-3-1-4-10-16)23-24(20)22(26)17-11-5-2-6-12-17/h1-14,20,25H,15H2	FSRNJBKLLKZKNJ-UHFFFAOYSA-N	Oc1ccccc1C2CC(=NN2C(=O)c3ccccc3)c4ccccc4	BroadT	BRD-A41187236	BRD-A41187236-001-05-8	ChemBridge Corporation	7952351			Oc1ccccc1C1CC(=NN1C(=O)c1ccccc1)c1ccccc1	InChI=1S/C22H18N2O2/c25-21-14-8-7-13-18(21)20-15-19(16-9-3-1-4-10-16)23-24(20)22(26)17-11-5-2-6-12-17/h1-14,20,25H,15H2	FSRNJBKLLKZKNJ-UHFFFAOYSA-N	342.136827836							106062
SMR000044224	LSM-17424	SID862195, BRD-K14310945	663418	InChI=1S/C20H16N6O2/c1-27-15-8-5-9-16(10-15)28-12-18-23-20-17-11-22-26(14-6-3-2-4-7-14)19(17)21-13-25(20)24-18/h2-11,13H,12H2,1H3	JCHUBYMCQWSHHT-UHFFFAOYSA-N	COc1cccc(OCc2nc3c4cnn(c5ccccc5)c4ncn3n2)c1	BroadT	BRD-K14310945	BRD-K14310945-001-05-9	InterBioScreen Ltd.	STOCK4S-34334			COc1cccc(OCc2nc3c4cnn(-c5ccccc5)c4ncn3n2)c1	InChI=1S/C20H16N6O2/c1-27-15-8-5-9-16(10-15)28-12-18-23-20-17-11-22-26(14-6-3-2-4-7-14)19(17)21-13-25(20)24-18/h2-11,13H,12H2,1H3	JCHUBYMCQWSHHT-UHFFFAOYSA-N	372.133473812							106063
AN-979/41714045	LSM-17425	SID24797995, BRD-K19831573	1026303	InChI=1S/C16H13Cl2NO4/c1-2-23-14-12(17)7-10(8-13(14)18)15(20)19-11-5-3-4-9(6-11)16(21)22/h3-8H,2H2,1H3,(H,19,20)(H,21,22)	DZVLONPTRXOCBT-UHFFFAOYSA-N	CCOc1c(Cl)cc(cc1Cl)C(=O)Nc2cccc(c2)C(=O)O	BroadT	BRD-K19831573	BRD-K19831573-001-05-8	ChemBridge Corporation	7325078			CCOc1c(Cl)cc(cc1Cl)C(=O)Nc1cccc(c1)C(O)=O	InChI=1S/C16H13Cl2NO4/c1-2-23-14-12(17)7-10(8-13(14)18)15(20)19-11-5-3-4-9(6-11)16(21)22/h3-8H,2H2,1H3,(H,19,20)(H,21,22)	DZVLONPTRXOCBT-UHFFFAOYSA-N	353.022163326							106064
F2508-0183	LSM-17426	SID24815809, BRD-K36415704	7217821	InChI=1S/C18H19N5O/c24-18(14-4-2-1-3-5-14)20-15-8-6-13(7-9-15)16-10-11-17-21-19-12-23(17)22-16/h6-12,14H,1-5H2,(H,20,24)	PTJNIYFHKKUYIF-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)c2ccc3nncn3n2)C4CCCCC4	BroadT	BRD-K36415704	BRD-K36415704-001-05-1	Life Chemicals Inc.	F2508-0183			O=C(Nc1ccc(cc1)-c1ccc2nncn2n1)C1CCCCC1	InChI=1S/C18H19N5O/c24-18(14-4-2-1-3-5-14)20-15-8-6-13(7-9-15)16-10-11-17-21-19-12-23(17)22-16/h6-12,14H,1-5H2,(H,20,24)	PTJNIYFHKKUYIF-UHFFFAOYSA-N	321.158960278							106065
STK096235	LSM-17427	SID47202260, BRD-K55746737	761932	InChI=1S/C20H17N3O2/c1-14-8-10-16(11-9-14)22-20(25)17-6-2-3-7-18(17)23-19(24)15-5-4-12-21-13-15/h2-13H,1H3,(H,22,25)(H,23,24)	PLIACWIWRWIRLF-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2ccccc2NC(=O)c3cccnc3)cc1	BroadT	BRD-K55746737	BRD-K55746737-001-05-6	Vitas-M Laboratory Ltd.	STK096235			Cc1ccc(NC(=O)c2ccccc2NC(=O)c2cccnc2)cc1	InChI=1S/C20H17N3O2/c1-14-8-10-16(11-9-14)22-20(25)17-6-2-3-7-18(17)23-19(24)15-5-4-12-21-13-15/h2-13H,1H3,(H,22,25)(H,23,24)	PLIACWIWRWIRLF-UHFFFAOYSA-N	331.132076814							106066
ST089525	LSM-17428	SID24780137, BRD-A94947109	577819	InChI=1S/C18H20N2O4/c1-4-24-18(23)15-10-14(12(3)20-17(15)22)16(21)19-11(2)13-8-6-5-7-9-13/h5-11H,4H2,1-3H3,(H,19,21)(H,20,22)	FRPCGQFHTCYOCQ-UHFFFAOYSA-N	CCOC(=O)c1cc(C(=O)NC(C)c2ccccc2)c(C)nc1O	BroadT	BRD-A94947109	BRD-A94947109-001-04-8	Asinex Ltd.	BAS 01884633			CCOC(=O)c1cc(C(=O)NC(C)c2ccccc2)c(C)[nH]c1=O	InChI=1S/C18H20N2O4/c1-4-24-18(23)15-10-14(12(3)20-17(15)22)16(21)19-11(2)13-8-6-5-7-9-13/h5-11H,4H2,1-3H3,(H,19,21)(H,20,22)	FRPCGQFHTCYOCQ-UHFFFAOYSA-N	328.14230714							106067
IFLAB1_002098	LSM-15269	BRD-K87578112	4360761	InChI=1S/C14H13Cl2N3O2S2/c1-19-3-2-6-8(5-19)22-14(10(6)12(17)20)18-13(21)7-4-9(15)23-11(7)16/h4H,2-3,5H2,1H3,(H2,17,20)(H,18,21)	HBBCIGFGKJJWEX-UHFFFAOYSA-N	CN1CCc2c(C1)sc(NC(=O)c3cc(Cl)sc3Cl)c2C(=O)N	BroadT	BRD-K87578112	BRD-K87578112-003-03-1	Life Chemicals Inc.	F0526-1415		Cl	CN1CCc2c(C1)sc(NC(=O)c1cc(Cl)sc1Cl)c2C(N)=O.Cl	InChI=1S/C14H13Cl2N3O2S2.ClH/c1-19-3-2-6-8(5-19)22-14(10(6)12(17)20)18-13(21)7-4-9(15)23-11(7)16;/h4H,2-3,5H2,1H3,(H2,17,20)(H,18,21);1H	FPWALAZGRYBQMJ-UHFFFAOYSA-N	388.982623486							103916, 103916
MLS-0311344.0001	LSM-2815	BRD-K37061750, SID24833242, SID87336799, SID87544647	3538139	InChI=1S/C23H26N4O5S/c1-16-14-17(2)27(25-16)19-6-4-18(5-7-19)23(28)24-21-15-20(8-9-22(21)31-3)33(29,30)26-10-12-32-13-11-26/h4-9,14-15H,10-13H2,1-3H3,(H,24,28)	QKXYXSPMMQZDDM-UHFFFAOYSA-N	COc1ccc(cc1NC(=O)c2ccc(cc2)n3nc(C)cc3C)S(=O)(=O)N4CCOCC4	BroadT	BRD-K37061750	BRD-K37061750-001-05-5	Enamine Ltd.	T5247069			COc1ccc(cc1NC(=O)c1ccc(cc1)-n1nc(C)cc1C)S(=O)(=O)N1CCOCC1	InChI=1S/C23H26N4O5S/c1-16-14-17(2)27(25-16)19-6-4-18(5-7-19)23(28)24-21-15-20(8-9-22(21)31-3)33(29,30)26-10-12-32-13-11-26/h4-9,14-15H,10-13H2,1-3H3,(H,24,28)	QKXYXSPMMQZDDM-UHFFFAOYSA-N	470.162390662							92651
SMR000025605	LSM-17429	SID4243461, BRD-K49468966	3238180	InChI=1S/C16H22N2O3S/c1-4-7-22(20,21)17-6-5-13-10-14-8-11(2)12(3)9-15(14)18-16(13)19/h8-10,17H,4-7H2,1-3H3,(H,18,19)	URNKSNMFPHBSFA-UHFFFAOYSA-N	CCCS(=O)(=O)NCCc1cc2cc(C)c(C)cc2nc1O	BroadT	BRD-K49468966	BRD-K49468966-001-05-8	ChemDiv Inc.	C279-0803			CCCS(=O)(=O)NCCc1cc2cc(C)c(C)cc2nc1O	InChI=1S/C16H22N2O3S/c1-4-7-22(20,21)17-6-5-13-10-14-8-11(2)12(3)9-15(14)18-16(13)19/h8-10,17H,4-7H2,1-3H3,(H,18,19)	URNKSNMFPHBSFA-UHFFFAOYSA-N	322.135113274							106068
5-Benzyl-4-hydroxy-8,9,10,11-tetrahydro-6H-pyrido[3,2,1-jk]carbazol-6-one	LSM-17430	SID26728796, BRD-K92892816	54677759	InChI=1S/C22H19NO2/c24-21-17-11-6-10-16-15-9-4-5-12-19(15)23(20(16)17)22(25)18(21)13-14-7-2-1-3-8-14/h1-3,6-8,10-11,24H,4-5,9,12-13H2	ZYDLDXGCTFGYOD-UHFFFAOYSA-N	OC1=C(Cc2ccccc2)C(=O)n3c4CCCCc4c5cccc1c35	BroadT	BRD-K92892816	BRD-K92892816-001-05-7	Maybridge	NRB 04795			Oc1c(Cc2ccccc2)c(=O)n2c3CCCCc3c3cccc1c23	InChI=1S/C22H19NO2/c24-21-17-11-6-10-16-15-9-4-5-12-19(15)23(20(16)17)22(25)18(21)13-14-7-2-1-3-8-14/h1-3,6-8,10-11,24H,4-5,9,12-13H2	ZYDLDXGCTFGYOD-UHFFFAOYSA-N	329.141578858							106069
MLS000766406	LSM-17431	SID24824862, BRD-K61771811	16195801	InChI=1S/C30H36N2O4S/c1-2-35-30-24(12-8-18-33)25(26-21-37-28-13-7-6-11-23(26)28)19-27(36-30)29(34)32-16-14-31(15-17-32)20-22-9-4-3-5-10-22/h3-7,9-11,13,19,21,24-25,30,33H,2,8,12,14-18,20H2,1H3/t24-,25+,30-/m1/s1	RHQPDZCTKOVIKR-UNHDOIQYSA-N	CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2csc3ccccc23)C(=O)N4CCN(Cc5ccccc5)CC4	BroadT	BRD-K61771811	BRD-K61771811-001-06-3	Harvard University	((2R,3R,4S)-4-(benzo[b]thiophen-3-yl)-2-ethoxy-3-(3-hydroxypropyl)-3,4-dihydro-2H-pyran-6-yl)(4-benzylpiperazin-1-yl)methanone DHPC11_001366			CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c1csc2ccccc12)C(=O)N1CCN(Cc2ccccc2)CC1	InChI=1S/C30H36N2O4S/c1-2-35-30-24(12-8-18-33)25(26-21-37-28-13-7-6-11-23(26)28)19-27(36-30)29(34)32-16-14-31(15-17-32)20-22-9-4-3-5-10-22/h3-7,9-11,13,19,21,24-25,30,33H,2,8,12,14-18,20H2,1H3/t24-,25+,30-/m1/s1	RHQPDZCTKOVIKR-UNHDOIQYSA-N	520.239578342							106070
2-Methoxy-n-(5-phenyl-1,2,4-thiadiazol-3-yl)benzamide	LSM-17432	SID24780946, BRD-K56529745	4182199	InChI=1S/C16H13N3O2S/c1-21-13-10-6-5-9-12(13)14(20)17-16-18-15(22-19-16)11-7-3-2-4-8-11/h2-10H,1H3,(H,17,19,20)	HEZFVZZTHXEKJK-UHFFFAOYSA-N	COc1ccccc1C(=O)Nc2nsc(n2)c3ccccc3	BroadT	BRD-K56529745	BRD-K56529745-001-05-5	ChemDiv Inc.	6574-0241			COc1ccccc1C(=O)Nc1nsc(n1)-c1ccccc1	InChI=1S/C16H13N3O2S/c1-21-13-10-6-5-9-12(13)14(20)17-16-18-15(22-19-16)11-7-3-2-4-8-11/h2-10H,1H3,(H,17,19,20)	HEZFVZZTHXEKJK-UHFFFAOYSA-N	311.072847376							106071
MLS001177449	LSM-17433	SID49675114, BRD-K49305644	5219389	InChI=1S/C24H27N3O6S/c1-3-27(4-2)34(30,31)18-9-10-21(26-11-13-32-14-12-26)20(16-18)25-23(28)19-15-17-7-5-6-8-22(17)33-24(19)29/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,25,28)	KQTVBGCJXVWNLM-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)C3=Cc4ccccc4OC3=O)c1	BroadT	BRD-K49305644	BRD-K49305644-001-06-0	Enamine Ltd.	T5258303			CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)c2cc3ccccc3oc2=O)c1	InChI=1S/C24H27N3O6S/c1-3-27(4-2)34(30,31)18-9-10-21(26-11-13-32-14-12-26)20(16-18)25-23(28)19-15-17-7-5-6-8-22(17)33-24(19)29/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,25,28)	KQTVBGCJXVWNLM-UHFFFAOYSA-N	485.162056304							106072
3-(5-Furan-2-yl-[1,2,4]oxadiazol-3-yl)-pyridine	LSM-17434	SID7977055, BRD-K17905113	577823	InChI=1S/C11H7N3O2/c1-3-8(7-12-5-1)10-13-11(16-14-10)9-4-2-6-15-9/h1-7H	WNMZRKCSRYCUFB-UHFFFAOYSA-N	o1cccc1c2onc(n2)c3cccnc3	BroadT	BRD-K17905113	BRD-K17905113-001-05-9	ChemBridge Corporation	5801205			c1coc(c1)-c1nc(no1)-c1cccnc1	InChI=1S/C11H7N3O2/c1-3-8(7-12-5-1)10-13-11(16-14-10)9-4-2-6-15-9/h1-7H	WNMZRKCSRYCUFB-UHFFFAOYSA-N	213.053826494							106073
T5367828	LSM-17435	SID49675695, BRD-K07959107	4790600	InChI=1S/C24H24N4O2/c1-4-30-21-12-11-17(14-22(21)29-3)16-28(2)24-19-9-5-6-10-20(19)26-23(27-24)18-8-7-13-25-15-18/h5-15H,4,16H2,1-3H3	GWMHXHLOZRRYMY-UHFFFAOYSA-N	CCOc1ccc(CN(C)c2nc(nc3ccccc23)c4cccnc4)cc1OC	BroadT	BRD-K07959107	BRD-K07959107-001-05-6	Enamine Ltd.	T5367828			CCOc1ccc(CN(C)c2nc(nc3ccccc23)-c2cccnc2)cc1OC	InChI=1S/C24H24N4O2/c1-4-30-21-12-11-17(14-22(21)29-3)16-28(2)24-19-9-5-6-10-20(19)26-23(27-24)18-8-7-13-25-15-18/h5-15H,4,16H2,1-3H3	GWMHXHLOZRRYMY-UHFFFAOYSA-N	400.189926048							106074
ZINC02991713	LSM-43727	SID22417040, BRD-K48050041	2289398	InChI=1S/C19H21NO4/c1-22-16-10-7-15(8-11-16)9-12-19(21)20-13-14-24-18-6-4-3-5-17(18)23-2/h3-12H,13-14H2,1-2H3,(H,20,21)/b12-9+	LAKMFTJKVYGEBL-FMIVXFBMSA-N	COc1ccc(\C=C\C(=O)NCCOc2ccccc2OC)cc1	BroadT	BRD-K48050041	BRD-K48050041-001-05-4	ChemBridge Corporation	6844625			COc1ccc(\C=C\C(=O)NCCOc2ccccc2OC)cc1	InChI=1S/C19H21NO4/c1-22-16-10-7-15(8-11-16)9-12-19(21)20-13-14-24-18-6-4-3-5-17(18)23-2/h3-12H,13-14H2,1-2H3,(H,20,21)/b12-9+	LAKMFTJKVYGEBL-FMIVXFBMSA-N	327.147058162							
MLS000331859	LSM-17437	SID17505720, BRD-K07571534	4889437	InChI=1S/C21H22ClN5/c1-5-18-23-10-11-26(18)19-12-17(21(2,3)4)25-20-16(13-24-27(19)20)14-6-8-15(22)9-7-14/h6-13H,5H2,1-4H3	OZCBBWLHTWUDBQ-UHFFFAOYSA-N	CCc1nccn1c2cc(nc3c(cnn23)c4ccc(Cl)cc4)C(C)(C)C	BroadT	BRD-K07571534	BRD-K07571534-001-05-2	InterBioScreen Ltd.	STOCK5S-41263			CCc1nccn1-c1cc(nc2c(cnn12)-c1ccc(Cl)cc1)C(C)(C)C	InChI=1S/C21H22ClN5/c1-5-18-23-10-11-26(18)19-12-17(21(2,3)4)25-20-16(13-24-27(19)20)14-6-8-15(22)9-7-14/h6-13H,5H2,1-4H3	OZCBBWLHTWUDBQ-UHFFFAOYSA-N	379.156373464							106076
MLS000757144	LSM-17438	SID26725223, BRD-K92155238	342499	InChI=1S/C13H11Cl2N3O/c1-8-5-6-9(7-16-8)17-13(19)18-12-10(14)3-2-4-11(12)15/h2-7H,1H3,(H2,17,18,19)	UGOAVFCPVAZKHK-UHFFFAOYSA-N	Cc1ccc(NC(=O)Nc2c(Cl)cccc2Cl)cn1	BroadT	BRD-K92155238	BRD-K92155238-001-05-9	National Cancer Institute Chemotherapeutic Agents Repository	379468			Cc1ccc(NC(=O)Nc2c(Cl)cccc2Cl)cn1	InChI=1S/C13H11Cl2N3O/c1-8-5-6-9(7-16-8)17-13(19)18-12-10(14)3-2-4-11(12)15/h2-7H,1H3,(H2,17,18,19)	UGOAVFCPVAZKHK-UHFFFAOYSA-N	295.027917422							106077
AC1MYFRD	LSM-17439	BRD-K38593888	3831140	InChI=1S/C16H19N3O3/c1-12(20)22-17-11-14-13-5-3-4-6-15(13)18(2)16(14)19-7-9-21-10-8-19/h3-6,11H,7-10H2,1-2H3	JQVVLSIVCWKNTL-UHFFFAOYSA-N	CC(=O)ON=Cc1c(N2CCOCC2)n(C)c3ccccc13	BroadT	BRD-K38593888	BRD-K38593888-001-09-3	Key Organics Ltd.	3P-321S			CC(=O)ON=Cc1c(N2CCOCC2)n(C)c2ccccc12	InChI=1S/C16H19N3O3/c1-12(20)22-17-11-14-13-5-3-4-6-15(13)18(2)16(14)19-7-9-21-10-8-19/h3-6,11H,7-10H2,1-2H3	JQVVLSIVCWKNTL-UHFFFAOYSA-N	301.142641498							106078
MLS000535341	LSM-17440	SID14739442, BRD-K97088696	1283751	InChI=1S/C23H24N2O5S/c1-28-17-10-9-14(12-18(17)29-2)21(26)25-23-20(16-7-3-4-8-19(16)31-23)22(27)24-13-15-6-5-11-30-15/h5-6,9-12H,3-4,7-8,13H2,1-2H3,(H,24,27)(H,25,26)	FZCBMOCOLVJJPS-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)Nc2sc3CCCCc3c2C(=O)NCc4occc4	BroadT	BRD-K97088696	BRD-K97088696-001-05-2	ChemBridge Corporation	7004026			COc1ccc(cc1OC)C(=O)Nc1sc2CCCCc2c1C(=O)NCc1ccco1	InChI=1S/C23H24N2O5S/c1-28-17-10-9-14(12-18(17)29-2)21(26)25-23-20(16-7-3-4-8-19(16)31-23)22(27)24-13-15-6-5-11-30-15/h5-6,9-12H,3-4,7-8,13H2,1-2H3,(H,24,27)(H,25,26)	FZCBMOCOLVJJPS-UHFFFAOYSA-N	440.140592578							106079
AC1MG40Y	LSM-17441	BRD-K44037623	2930083	InChI=1S/C16H16N4OS/c1-11-18-15-13(16(21)20(11)17-10-19(2)3)9-14(22-15)12-7-5-4-6-8-12/h4-10H,1-3H3	ZUZLKSNDVSUMBQ-UHFFFAOYSA-N	CN(C)C=NN1C(=Nc2sc(cc2C1=O)c3ccccc3)C	BroadT	BRD-K44037623	BRD-K44037623-001-05-1	ChemBridge Corporation	7197965			CN(C)C=Nn1c(C)nc2sc(cc2c1=O)-c1ccccc1	InChI=1S/C16H16N4OS/c1-11-18-15-13(16(21)20(11)17-10-19(2)3)9-14(22-15)12-7-5-4-6-8-12/h4-10H,1-3H3	ZUZLKSNDVSUMBQ-UHFFFAOYSA-N	312.104481862							106080
Fendiline	LSM-5133	Fendiline	3336	InChI=1S/C23H25N/c1-19(20-11-5-2-6-12-20)24-18-17-23(21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,19,23-24H,17-18H2,1H3	NMKSAYKQLCHXDK-UHFFFAOYSA-N	CC(NCCC(c1ccccc1)c2ccccc2)c3ccccc3	BroadT	BRD-A71033472	BRD-A71033472-003-17-1	Prestwick Chemical Inc.	Prestw-270		Cl	CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1.Cl	InChI=1S/C23H25N.ClH/c1-19(20-11-5-2-6-12-20)24-18-17-23(21-13-7-3-8-14-21)22-15-9-4-10-16-22;/h2-16,19,23-24H,17-18H2,1H3;1H	NJXWZWXCHBNOOG-UHFFFAOYSA-N	315.19869981							94434, 94434
BRD-K54141134	LSM-43728		54619780	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17-,21-/m0/s1	NLMWZCLTQNAKQL-WMGGKRPOSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K54141134	BRD-K54141134-001-01-9	Broad Institute of MIT and Harvard	BRD-K54141134			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17-,21-/m0/s1	NLMWZCLTQNAKQL-WMGGKRPOSA-N	474.19369079							
BRD-K20451745	LSM-17443		54619741	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21-,25+/m1/s1	GKCJFKOMNRYVJH-OTPAQWSUSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K20451745	BRD-K20451745-001-01-4	Broad Institute of MIT and Harvard	BRD-K20451745			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21-,25+/m1/s1	GKCJFKOMNRYVJH-OTPAQWSUSA-N	513.22974194							106082
CHEMBL2362203	LSM-17444	BRD-K11399565, SID131414963	54619807	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21-,29-/m0/s1	JDSMWWFCTGPOGF-WURXVLGASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccccc5F	BroadT	BRD-K11399565	BRD-K11399565-001-01-3	Broad Institute of MIT and Harvard	BRD-K11399565			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21-,29-/m0/s1	JDSMWWFCTGPOGF-WURXVLGASA-N	594.183600242							106083
BRD-K98535230	LSM-17445		54619721	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15-,19-/m1/s1	WYZAJQOJJPDCBL-SPYBWZPUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K98535230	BRD-K98535230-001-01-3	Broad Institute of MIT and Harvard	BRD-K98535230			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15-,19-/m1/s1	WYZAJQOJJPDCBL-SPYBWZPUSA-N	481.157619134							106084
BRD-K96839404	LSM-17446		54619766	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12+,15+/m0/s1	SBYAEQQHLNEWQQ-YWPYICTPSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K96839404	BRD-K96839404-001-01-1	Broad Institute of MIT and Harvard	BRD-K96839404			COCC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12+,15+/m0/s1	SBYAEQQHLNEWQQ-YWPYICTPSA-N	443.105583562							106085
BRD-K62511698	LSM-17447		54619876	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10+,13+/m0/s1	WOUSVQRWYFHTGE-OPQQBVKSSA-N	CNC[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K62511698	BRD-K62511698-001-01-1	Broad Institute of MIT and Harvard	BRD-K62511698			CNC[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10+,13+/m0/s1	WOUSVQRWYFHTGE-OPQQBVKSSA-N	371.084454194							106086
BRD-K11055147	LSM-17448		54619606	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10-,13-/m1/s1	WOUSVQRWYFHTGE-GIPNMCIBSA-N	CNC[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K11055147	BRD-K11055147-001-01-8	Broad Institute of MIT and Harvard	BRD-K11055147			CNC[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10-,13-/m1/s1	WOUSVQRWYFHTGE-GIPNMCIBSA-N	371.084454194							106087
BRD-K51927648	LSM-17449		54619778	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21+,25+/m0/s1	RCWBPICPBWJXDU-BPYKYCOYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K51927648	BRD-K51927648-001-01-3	Broad Institute of MIT and Harvard	BRD-K51927648			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21+,25+/m0/s1	RCWBPICPBWJXDU-BPYKYCOYSA-N	492.273655672							106088
BRD-K68312794	LSM-17450		54619618	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18+,24+/m1/s1	OVFNTHNHZTZUMD-YTZAWJCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K68312794	BRD-K68312794-001-01-1	Broad Institute of MIT and Harvard	BRD-K68312794			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18+,24+/m1/s1	OVFNTHNHZTZUMD-YTZAWJCFSA-N	499.248249418							106089
BRD-K92520489	LSM-17451		54619783	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14+,19+/m0/s1	WRXISDPBFZAALF-IQUTYRLHSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K92520489	BRD-K92520489-001-01-9	Broad Institute of MIT and Harvard	BRD-K92520489			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14+,19+/m0/s1	WRXISDPBFZAALF-IQUTYRLHSA-N	493.10124711							106090
MLS003128936	LSM-17452	SID99359503, BRD-K71987443	46904066	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11-,14+/m1/s1	JDNCUSTXITVPAM-GYSYKLTISA-N	CNC[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K71987443	BRD-K71987443-001-02-8	Broad Institute of MIT and Harvard	BRD-K71987443			CNC[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11-,14+/m1/s1	JDNCUSTXITVPAM-GYSYKLTISA-N	406.056190526							106091
BRD-K53489056	LSM-17453		54619877	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18-,23+/m0/s1	HJKYHUWIGCJTPR-IUKKYPGJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K53489056	BRD-K53489056-001-01-7	Broad Institute of MIT and Harvard	BRD-K53489056			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18-,23+/m0/s1	HJKYHUWIGCJTPR-IUKKYPGJSA-N	464.242355544							106092
BRD-K83619973	LSM-17454		54619814	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17-,22+/m1/s1	OSFPASGWEYOZJM-YVHKJVDXSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K83619973	BRD-K83619973-001-01-3	Broad Institute of MIT and Harvard	BRD-K83619973			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17-,22+/m1/s1	OSFPASGWEYOZJM-YVHKJVDXSA-N	472.248583776							106093
BRD-K89447678	LSM-43729		54619845	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19-,24-/m0/s1	HCERARMSZYIAOP-LICKQPHZSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K89447678	BRD-K89447678-001-01-1	Broad Institute of MIT and Harvard	BRD-K89447678			C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19-,24-/m0/s1	HCERARMSZYIAOP-LICKQPHZSA-N	502.213757518							
BRD-K02299361	LSM-17456		54619619	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19+,24+/m1/s1	QDRMLRNWHHCLDG-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K02299361	BRD-K02299361-001-01-2	Broad Institute of MIT and Harvard	BRD-K02299361			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19+,24+/m1/s1	QDRMLRNWHHCLDG-IMWIBFENSA-N	489.237604522							106095
BRD-K88670720	LSM-17457		54619687	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20-,24+/m1/s1	NKXMQWDASBSVNS-REHUZNOOSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K88670720	BRD-K88670720-001-01-7	Broad Institute of MIT and Harvard	BRD-K88670720			CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20-,24+/m1/s1	NKXMQWDASBSVNS-REHUZNOOSA-N	463.247106566							106096
BRD-K33221810	LSM-17458		54619638	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18+,23-/m0/s1	HJKYHUWIGCJTPR-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K33221810	BRD-K33221810-001-01-6	Broad Institute of MIT and Harvard	BRD-K33221810			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18+,23-/m0/s1	HJKYHUWIGCJTPR-IXFSTUDKSA-N	464.242355544							106097
MLS003128939	LSM-17459	BRD-K15350548	46904069	InChI=1S/C21H27BrN4O3/c1-14-10-26(15(2)13-27)21(28)18-7-17(22)9-24-20(18)29-19(14)12-25(3)11-16-5-4-6-23-8-16/h4-9,14-15,19,27H,10-13H2,1-3H3/t14-,15-,19+/m1/s1	CNDBXNGNOXPHBO-CLCXKQKWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K15350548	BRD-K15350548-001-01-4	Broad Institute of MIT and Harvard	BRD-K15350548			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C21H27BrN4O3/c1-14-10-26(15(2)13-27)21(28)18-7-17(22)9-24-20(18)29-19(14)12-25(3)11-16-5-4-6-23-8-16/h4-9,14-15,19,27H,10-13H2,1-3H3/t14-,15-,19+/m1/s1	CNDBXNGNOXPHBO-CLCXKQKWSA-N	462.126653364							106098
BRD-K36252987	LSM-17460		54619690	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19-,24+/m0/s1	QDRMLRNWHHCLDG-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K36252987	BRD-K36252987-001-01-5	Broad Institute of MIT and Harvard	BRD-K36252987			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19-,24+/m0/s1	QDRMLRNWHHCLDG-AXHZCLLHSA-N	489.237604522							106099
BRD-K63252672	LSM-17461		54619728	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21+,26+/m1/s1	HHBQEZHNSWTNJC-SWYRRKHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K63252672	BRD-K63252672-001-01-1	Broad Institute of MIT and Harvard	BRD-K63252672			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21+,26+/m1/s1	HHBQEZHNSWTNJC-SWYRRKHMSA-N	510.230076298							106100
BRD-K65705295	LSM-17462		54619692	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20-,25-/m1/s1	XPLVEXAVWRQRFN-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cncnc2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K65705295	BRD-K65705295-001-01-3	Broad Institute of MIT and Harvard	BRD-K65705295			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cncnc2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20-,25-/m1/s1	XPLVEXAVWRQRFN-UMEGOILYSA-N	475.258339966							106101
BRD-K76861469	LSM-17463		54619684	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20-,26-/m1/s1	RYIFWOIJOZENBD-XMERXJNXSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K76861469	BRD-K76861469-001-01-1	Broad Institute of MIT and Harvard	BRD-K76861469			COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20-,26-/m1/s1	RYIFWOIJOZENBD-XMERXJNXSA-N	530.208672138							106102
BRD-K10452371	LSM-17464		54619650	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21-/m0/s1	HYQDYNVKVXEYDN-QYWGDWMGSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2Oc3cc(Br)ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K10452371	BRD-K10452371-001-01-5	Broad Institute of MIT and Harvard	BRD-K10452371			COc1ccccc1NC(=O)N(C)C[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21-/m0/s1	HYQDYNVKVXEYDN-QYWGDWMGSA-N	555.103869							106103
BRD-K74713361	LSM-17465		54619873	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18+,23-/m1/s1	HJKYHUWIGCJTPR-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K74713361	BRD-K74713361-001-01-5	Broad Institute of MIT and Harvard	BRD-K74713361			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18+,23-/m1/s1	HJKYHUWIGCJTPR-IEGUWTFLSA-N	464.242355544							106104
BRD-K92941354	LSM-17466		54619875	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19-,23-/m1/s1	ATGVLJGFQJXEPR-DNVFCKCGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc3cccnc3	BroadT	BRD-K92941354	BRD-K92941354-001-01-9	Broad Institute of MIT and Harvard	BRD-K92941354			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19-,23-/m1/s1	ATGVLJGFQJXEPR-DNVFCKCGSA-N	479.253254586							106105
BRD-K63907145-001-01-9	LSM-17467	BRD-K63907145	54619600	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15-,19+/m0/s1	WYZAJQOJJPDCBL-YZVOILCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K63907145	BRD-K63907145-001-01-9	Broad Institute of MIT and Harvard	BRD-K63907145			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15-,19+/m0/s1	WYZAJQOJJPDCBL-YZVOILCLSA-N	481.157619134							106106
BRD-K59843356	LSM-43730		54619746	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19+,24+/m0/s1	HCERARMSZYIAOP-LFBZRNKISA-N	C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K59843356	BRD-K59843356-001-01-6	Broad Institute of MIT and Harvard	BRD-K59843356			C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19+,24+/m0/s1	HCERARMSZYIAOP-LFBZRNKISA-N	502.213757518							
BRD-K69038251	LSM-17469		54619704	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-13-8-22(21-6-5-7-23(29)14-21)15-26(28)38-27(19)17-30(3)39(33,34)25-11-9-24(37-4)10-12-25/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27+/m0/s1	OLBRUKVYTCLQEJ-ASHZAFPQSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)c4cccc(F)c4	BroadT	BRD-K69038251	BRD-K69038251-001-01-7	Broad Institute of MIT and Harvard	BRD-K69038251			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cccc(F)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-13-8-22(21-6-5-7-23(29)14-21)15-26(28)38-27(19)17-30(3)39(33,34)25-11-9-24(37-4)10-12-25/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27+/m0/s1	OLBRUKVYTCLQEJ-ASHZAFPQSA-N	592.171320996							106108
MLS003129941	LSM-17470	BRD-K52218664, SID99358487	46903315	InChI=1S/C21H29BrN4O6S/c1-12-9-26(13(2)11-27)33(29,30)19-7-6-16(22)8-17(19)31-18(12)10-25(5)21(28)23-20-14(3)24-32-15(20)4/h6-8,12-13,18,27H,9-11H2,1-5H3,(H,23,28)/t12-,13+,18-/m0/s1	YQEAZHSPJCEZGR-JCGVRSQUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K52218664	BRD-K52218664-001-01-5	Broad Institute of MIT and Harvard	BRD-K52218664			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C21H29BrN4O6S/c1-12-9-26(13(2)11-27)33(29,30)19-7-6-16(22)8-17(19)31-18(12)10-25(5)21(28)23-20-14(3)24-32-15(20)4/h6-8,12-13,18,27H,9-11H2,1-5H3,(H,23,28)/t12-,13+,18-/m0/s1	YQEAZHSPJCEZGR-JCGVRSQUSA-N	544.099117978							106109
BRD-K45563993	LSM-17471		54619635	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21+,25+/m1/s1	GKCJFKOMNRYVJH-CZSZKKDXSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K45563993	BRD-K45563993-001-01-6	Broad Institute of MIT and Harvard	BRD-K45563993			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21+,25+/m1/s1	GKCJFKOMNRYVJH-CZSZKKDXSA-N	513.22974194							106110
BRD-K01554997	LSM-17472		54619686	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19-,25-/m1/s1	IPGCYDACBMVSLM-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K01554997	BRD-K01554997-001-01-3	Broad Institute of MIT and Harvard	BRD-K01554997			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19-,25-/m1/s1	IPGCYDACBMVSLM-MPCDZSKCSA-N	485.268984862							106111
BRD-K77627909	LSM-17473		54619616	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17+,22-/m1/s1	OSFPASGWEYOZJM-HYFFOGBASA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K77627909	BRD-K77627909-001-01-3	Broad Institute of MIT and Harvard	BRD-K77627909			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17+,22-/m1/s1	OSFPASGWEYOZJM-HYFFOGBASA-N	472.248583776							106112
MLS003128890	LSM-17474	BRD-K60337438, SID99359327	46903891	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11+,14+/m1/s1	JDNCUSTXITVPAM-SUNKGSAMSA-N	CNC[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K60337438	BRD-K60337438-001-02-6	Broad Institute of MIT and Harvard	BRD-K60337438			CNC[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11+,14+/m1/s1	JDNCUSTXITVPAM-SUNKGSAMSA-N	406.056190526							106113
BRD-K15690866	LSM-17475		54619714	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10-,13+/m0/s1	WOUSVQRWYFHTGE-OUJBWJOFSA-N	CNC[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K15690866	BRD-K15690866-001-01-7	Broad Institute of MIT and Harvard	BRD-K15690866			CNC[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10-,13+/m0/s1	WOUSVQRWYFHTGE-OUJBWJOFSA-N	371.084454194							106114
BRD-K26127722	LSM-17476		54619789	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19+,22-/m1/s1	LOALBDSDXWHRAT-XQBPLPMBSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K26127722	BRD-K26127722-001-01-1	Broad Institute of MIT and Harvard	BRD-K26127722			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19+,22-/m1/s1	LOALBDSDXWHRAT-XQBPLPMBSA-N	486.284220356							106115
BRD-K50510710	LSM-17477		54619846	InChI=1S/C23H26FN3O3/c1-15-13-27(16(2)14-28)23(29)19-10-17(8-9-18-6-4-5-7-20(18)24)11-26-22(19)30-21(15)12-25-3/h4-7,10-11,15-16,21,25,28H,12-14H2,1-3H3/t15-,16-,21-/m0/s1	NUAJGQJLZRKPPD-QYWGDWMGSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc3ccccc3F	BroadT	BRD-K50510710	BRD-K50510710-001-01-1	Broad Institute of MIT and Harvard	BRD-K50510710			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc1ccccc1F	InChI=1S/C23H26FN3O3/c1-15-13-27(16(2)14-28)23(29)19-10-17(8-9-18-6-4-5-7-20(18)24)11-26-22(19)30-21(15)12-25-3/h4-7,10-11,15-16,21,25,28H,12-14H2,1-3H3/t15-,16-,21-/m0/s1	NUAJGQJLZRKPPD-QYWGDWMGSA-N	411.195819922							106116
BRD-K46949676	LSM-17478		54619674	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20-,24-/m1/s1	NKXMQWDASBSVNS-YOSAUDMPSA-N	CCCC#Cc1cnc2O[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K46949676	BRD-K46949676-001-01-0	Broad Institute of MIT and Harvard	BRD-K46949676			CCCC#Cc1cnc2O[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20-,24-/m1/s1	NKXMQWDASBSVNS-YOSAUDMPSA-N	463.247106566							106117
BRD-K03286808	LSM-17479		54619817	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19-,23-/m1/s1	LMEKMJWGWXFVOU-DNVFCKCGSA-N	COCC#Cc1cnc2O[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K03286808	BRD-K03286808-001-01-9	Broad Institute of MIT and Harvard	BRD-K03286808			COCC#Cc1cnc2O[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19-,23-/m1/s1	LMEKMJWGWXFVOU-DNVFCKCGSA-N	471.273321314							106118
BRD-K26641843	LSM-17480		54619737	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20+,26+/m1/s1	RYIFWOIJOZENBD-GOHWNWGWSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K26641843	BRD-K26641843-001-01-5	Broad Institute of MIT and Harvard	BRD-K26641843			COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20+,26+/m1/s1	RYIFWOIJOZENBD-GOHWNWGWSA-N	530.208672138							106119
BRD-K56618252	LSM-17481		54619701	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21+,26+/m0/s1	ULJKHWQRDIVXQP-LZCXECNNSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K56618252	BRD-K56618252-001-01-0	Broad Institute of MIT and Harvard	BRD-K56618252			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21+,26+/m0/s1	ULJKHWQRDIVXQP-LZCXECNNSA-N	566.19205644							106120
BRD-K69437108	LSM-17482		54619658	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17-,21+/m1/s1	FYPIPCFJMPJNQJ-LZJOCLMNSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K69437108	BRD-K69437108-001-01-6	Broad Institute of MIT and Harvard	BRD-K69437108			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17-,21+/m1/s1	FYPIPCFJMPJNQJ-LZJOCLMNSA-N	444.273655672							106121
BRD-K00086692	LSM-43731		54619880	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19-,24+/m0/s1	HCERARMSZYIAOP-QXVANDADSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K00086692	BRD-K00086692-001-01-5	Broad Institute of MIT and Harvard	BRD-K00086692			C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19-,24+/m0/s1	HCERARMSZYIAOP-QXVANDADSA-N	502.213757518							
MLS003128933	LSM-17484	BRD-K03243737, SID99359501	46904064	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11-,14-/m0/s1	JDNCUSTXITVPAM-MJVIPROJSA-N	CNC[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K03243737	BRD-K03243737-001-02-4	Broad Institute of MIT and Harvard	BRD-K03243737			CNC[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11-,14-/m0/s1	JDNCUSTXITVPAM-MJVIPROJSA-N	406.056190526							106123
BRD-K98805845	LSM-17485		54619676	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20+,24-/m1/s1	NKXMQWDASBSVNS-JXALWOEJSA-N	CCCC#Cc1cnc2O[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K98805845	BRD-K98805845-001-01-7	Broad Institute of MIT and Harvard	BRD-K98805845			CCCC#Cc1cnc2O[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20+,24-/m1/s1	NKXMQWDASBSVNS-JXALWOEJSA-N	463.247106566							106124
BRD-K16312305	LSM-17486		54619874	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19+,25+/m1/s1	IPGCYDACBMVSLM-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K16312305	BRD-K16312305-001-01-6	Broad Institute of MIT and Harvard	BRD-K16312305			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19+,25+/m1/s1	IPGCYDACBMVSLM-WYEJZRMESA-N	485.268984862							106125
BRD-K76457661	LSM-43732		54619620	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17+,21+/m0/s1	NLMWZCLTQNAKQL-SIWTXCHWSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K76457661	BRD-K76457661-001-01-4	Broad Institute of MIT and Harvard	BRD-K76457661			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17+,21+/m0/s1	NLMWZCLTQNAKQL-SIWTXCHWSA-N	474.19369079							
BRD-K05357297	LSM-17488		54619609	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17-,22+/m0/s1	OSFPASGWEYOZJM-PNLZDCPESA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K05357297	BRD-K05357297-001-01-4	Broad Institute of MIT and Harvard	BRD-K05357297			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17-,22+/m0/s1	OSFPASGWEYOZJM-PNLZDCPESA-N	472.248583776							106127
BRD-K83180232	LSM-17489		54619821	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20+,26-/m0/s1	RYIFWOIJOZENBD-UNVFRBQDSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K83180232	BRD-K83180232-001-01-3	Broad Institute of MIT and Harvard	BRD-K83180232			COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20+,26-/m0/s1	RYIFWOIJOZENBD-UNVFRBQDSA-N	530.208672138							106128
CHEMBL2357300	LSM-17490	BRD-K07734771, SID131414853	54619706	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21-,26-/m1/s1	ULJKHWQRDIVXQP-IPVFLDMMSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K07734771	BRD-K07734771-001-01-7	Broad Institute of MIT and Harvard	BRD-K07734771			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21-,26-/m1/s1	ULJKHWQRDIVXQP-IPVFLDMMSA-N	566.19205644							106129
BRD-K60729758	LSM-17491		54619812	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21+,26+/m0/s1	ZNXYRHHWSDGXHP-LZCXECNNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K60729758	BRD-K60729758-001-01-8	Broad Institute of MIT and Harvard	BRD-K60729758			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21+,26+/m0/s1	ZNXYRHHWSDGXHP-LZCXECNNSA-N	548.201478272							106130
BRD-K44866331	LSM-17492		54619694	InChI=1S/C23H34N2O4S/c1-17-15-25(18(2)16-26)30(27,28)23-12-11-20(10-9-19-7-5-4-6-8-19)13-21(23)29-22(17)14-24-3/h11-13,17-19,22,24,26H,4-8,14-16H2,1-3H3/t17-,18-,22+/m1/s1	PTEAFCJBUOPAHG-HMFYCAOWSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CC3CCCCC3	BroadT	BRD-K44866331	BRD-K44866331-001-01-5	Broad Institute of MIT and Harvard	BRD-K44866331			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CC1CCCCC1	InChI=1S/C23H34N2O4S/c1-17-15-25(18(2)16-26)30(27,28)23-12-11-20(10-9-19-7-5-4-6-8-19)13-21(23)29-22(17)14-24-3/h11-13,17-19,22,24,26H,4-8,14-16H2,1-3H3/t17-,18-,22+/m1/s1	PTEAFCJBUOPAHG-HMFYCAOWSA-N	434.223928278							106131
BRD-K68574010	LSM-17493		54619718	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12-,15-/m0/s1	SBYAEQQHLNEWQQ-HUBLWGQQSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K68574010	BRD-K68574010-001-01-4	Broad Institute of MIT and Harvard	BRD-K68574010			COCC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12-,15-/m0/s1	SBYAEQQHLNEWQQ-HUBLWGQQSA-N	443.105583562							106132
BRD-K59587063	LSM-17494		44489291	InChI=1S/C23H27N3O4/c1-14-12-26(15(2)13-27)23(28)18-8-17(10-25-22(18)30-21(14)11-24-3)20-9-16-6-4-5-7-19(16)29-20/h4-10,14-15,21,24,27H,11-13H2,1-3H3/t14-,15+,21-/m0/s1	ODAAUIBXBDDTME-ZSDSOXJFSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3oc4ccccc4c3	BroadT	BRD-K59587063	BRD-K59587063-001-01-3	Broad Institute of MIT and Harvard	BRD-K59587063			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cc2ccccc2o1	InChI=1S/C23H27N3O4/c1-14-12-26(15(2)13-27)23(28)18-8-17(10-25-22(18)30-21(14)11-24-3)20-9-16-6-4-5-7-19(16)29-20/h4-10,14-15,21,24,27H,11-13H2,1-3H3/t14-,15+,21-/m0/s1	ODAAUIBXBDDTME-ZSDSOXJFSA-N	409.200156374							106133
MLS003128975	LSM-17495	BRD-K33218695	46904100	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13-,17+/m1/s1	QHGLBWHFCGZTIC-XNJGSVPQSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K33218695	BRD-K33218695-001-02-0	Broad Institute of MIT and Harvard	BRD-K33218695			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13-,17+/m1/s1	QHGLBWHFCGZTIC-XNJGSVPQSA-N	474.082405274							106134
BRD-K69229416	LSM-17496		54619733	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18+,23+/m0/s1	CUOJNPIZUFXRHX-YZZKKUAISA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K69229416	BRD-K69229416-001-01-4	Broad Institute of MIT and Harvard	BRD-K69229416			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18+,23+/m0/s1	CUOJNPIZUFXRHX-YZZKKUAISA-N	501.193356432							106135
BRD-K88977610	LSM-17497		54619878	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20-,24+/m0/s1	RTCSRSPLRRSOHD-MZLICYQSSA-N	CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc3ccccc3	BroadT	BRD-K88977610	BRD-K88977610-001-01-9	Broad Institute of MIT and Harvard	BRD-K88977610			CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc1ccccc1	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20-,24+/m0/s1	RTCSRSPLRRSOHD-MZLICYQSSA-N	484.203192834							106136
BRD-K12705251	LSM-17498		54619680	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20-,26-/m0/s1	RYIFWOIJOZENBD-DYLHXGEVSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K12705251	BRD-K12705251-001-01-9	Broad Institute of MIT and Harvard	BRD-K12705251			COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20-,26-/m0/s1	RYIFWOIJOZENBD-DYLHXGEVSA-N	530.208672138							106137
MLS003128900	LSM-17499	BRD-K04848570, SID99359335	46903899	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12+,15+/m1/s1	SBYAEQQHLNEWQQ-XUJVJEKNSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K04848570	BRD-K04848570-001-02-9	Broad Institute of MIT and Harvard	BRD-K04848570			COCC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12+,15+/m1/s1	SBYAEQQHLNEWQQ-XUJVJEKNSA-N	443.105583562							106138
BRD-K62852603	LSM-43733		54619655	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19+,24-/m1/s1	HCERARMSZYIAOP-ROPHGTDPSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K62852603	BRD-K62852603-001-01-3	Broad Institute of MIT and Harvard	BRD-K62852603			C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19+,24-/m1/s1	HCERARMSZYIAOP-ROPHGTDPSA-N	502.213757518							
BRD-K47443098	LSM-17501		54619669	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18-,21+/m0/s1	YVOLCZAPMPCUFP-BBTUJRGHSA-N	CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K47443098	BRD-K47443098-001-01-3	Broad Institute of MIT and Harvard	BRD-K47443098			CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18-,21+/m0/s1	YVOLCZAPMPCUFP-BBTUJRGHSA-N	503.220239896							106140
BRD-K34620971	LSM-17502		54619800	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13+,17-/m0/s1	QHGLBWHFCGZTIC-AHIWAGSCSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K34620971	BRD-K34620971-001-01-3	Broad Institute of MIT and Harvard	BRD-K34620971			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13+,17-/m0/s1	QHGLBWHFCGZTIC-AHIWAGSCSA-N	474.082405274							106141
BRD-K53402320	LSM-43734		54619864	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22+,28+/m0/s1	YCWRHWKUOUGHRQ-KVNLSWIGSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)c1	BroadT	BRD-K53402320	BRD-K53402320-001-01-0	Broad Institute of MIT and Harvard	BRD-K53402320			COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)c1	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22+,28+/m0/s1	YCWRHWKUOUGHRQ-KVNLSWIGSA-N	544.268570292							
BRD-K32444429	LSM-17504		54619711	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12+,15-/m0/s1	SBYAEQQHLNEWQQ-ZOWXZIJZSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K32444429	BRD-K32444429-001-01-8	Broad Institute of MIT and Harvard	BRD-K32444429			COCC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12+,15-/m0/s1	SBYAEQQHLNEWQQ-ZOWXZIJZSA-N	443.105583562							106143
BRD-K84060528	LSM-17505		54619632	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21+,26-/m1/s1	HHBQEZHNSWTNJC-YZIHRLCOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K84060528	BRD-K84060528-001-01-9	Broad Institute of MIT and Harvard	BRD-K84060528			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21+,26-/m1/s1	HHBQEZHNSWTNJC-YZIHRLCOSA-N	510.230076298							106144
BRD-K30269093	LSM-17506		54619825	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19-,24-/m0/s1	QDRMLRNWHHCLDG-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K30269093	BRD-K30269093-001-01-6	Broad Institute of MIT and Harvard	BRD-K30269093			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19-,24-/m0/s1	QDRMLRNWHHCLDG-JXQFQVJHSA-N	489.237604522							106145
BRD-K02087489	LSM-17507		54619617	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14-,19-/m1/s1	WRXISDPBFZAALF-PJIJBLCYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K02087489	BRD-K02087489-001-01-8	Broad Institute of MIT and Harvard	BRD-K02087489			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14-,19-/m1/s1	WRXISDPBFZAALF-PJIJBLCYSA-N	493.10124711							106146
BRD-K11672894	LSM-43735		54619744	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17-,21+/m1/s1	NLMWZCLTQNAKQL-QNFPXEQRSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K11672894	BRD-K11672894-001-01-5	Broad Institute of MIT and Harvard	BRD-K11672894			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17-,21+/m1/s1	NLMWZCLTQNAKQL-QNFPXEQRSA-N	474.19369079							
BRD-K32231853	LSM-17509		54619649	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21+,25+/m0/s1	GKCJFKOMNRYVJH-BPYKYCOYSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K32231853	BRD-K32231853-001-01-4	Broad Institute of MIT and Harvard	BRD-K32231853			CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21+,25+/m0/s1	GKCJFKOMNRYVJH-BPYKYCOYSA-N	513.22974194							106148
BRD-K01251033	LSM-15016		54619651	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21-,26+/m1/s1	ZNXYRHHWSDGXHP-YPCDYVTLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K01251033	BRD-K01251033-001-01-2	Broad Institute of MIT and Harvard	BRD-K01251033			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21-,26+/m1/s1	ZNXYRHHWSDGXHP-YPCDYVTLSA-N	548.201478272							103672
CHEMBL2356237	LSM-17510	BRD-K78813464, SID131414844	54619697	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21+,29-/m1/s1	JDSMWWFCTGPOGF-HNMNOHOESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccccc5F	BroadT	BRD-K78813464	BRD-K78813464-001-01-5	Broad Institute of MIT and Harvard	BRD-K78813464			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21+,29-/m1/s1	JDSMWWFCTGPOGF-HNMNOHOESA-N	594.183600242							106149
CHEMBL2359417	LSM-17511	SID131414872, BRD-K91467755	54619725	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21-,26-/m0/s1	ULJKHWQRDIVXQP-WOVHNISZSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K91467755	BRD-K91467755-001-01-1	Broad Institute of MIT and Harvard	BRD-K91467755			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21-,26-/m0/s1	ULJKHWQRDIVXQP-WOVHNISZSA-N	566.19205644							106150
CHEMBL2362856	LSM-15057	BRD-K81373254, SID131414797	54619652	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21-,26-/m1/s1	ZNXYRHHWSDGXHP-IPVFLDMMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K81373254	BRD-K81373254-001-01-9	Broad Institute of MIT and Harvard	BRD-K81373254			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21-,26-/m1/s1	ZNXYRHHWSDGXHP-IPVFLDMMSA-N	548.201478272							103713
CHEMBL2357028	LSM-17512	BRD-K50094173, SID131414993	54619836	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21+,29+/m0/s1	JDSMWWFCTGPOGF-BNJCFXFUSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccccc5F	BroadT	BRD-K50094173	BRD-K50094173-001-01-6	Broad Institute of MIT and Harvard	BRD-K50094173			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21+,29+/m0/s1	JDSMWWFCTGPOGF-BNJCFXFUSA-N	594.183600242							106151
BRD-K32882942	LSM-17513		54619709	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20+,24+/m1/s1	NKXMQWDASBSVNS-NMMYMHLASA-N	CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K32882942	BRD-K32882942-001-01-7	Broad Institute of MIT and Harvard	BRD-K32882942			CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20+,24+/m1/s1	NKXMQWDASBSVNS-NMMYMHLASA-N	463.247106566							106152
BRD-K12959846	LSM-43736		54619782	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22-,28-/m1/s1	YCWRHWKUOUGHRQ-AUZARBPPSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)c1	BroadT	BRD-K12959846	BRD-K12959846-001-01-4	Broad Institute of MIT and Harvard	BRD-K12959846			COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)c1	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22-,28-/m1/s1	YCWRHWKUOUGHRQ-AUZARBPPSA-N	544.268570292							
BRD-K71141540	LSM-17515		54619748	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19+,23+/m0/s1	LMEKMJWGWXFVOU-YCRNBWNJSA-N	COCC#Cc1cnc2O[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K71141540	BRD-K71141540-001-01-6	Broad Institute of MIT and Harvard	BRD-K71141540			COCC#Cc1cnc2O[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19+,23+/m0/s1	LMEKMJWGWXFVOU-YCRNBWNJSA-N	471.273321314							106154
BRD-K40765512	LSM-17516		54619882	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20-,25+/m0/s1	XPLVEXAVWRQRFN-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cncnc2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K40765512	BRD-K40765512-001-01-4	Broad Institute of MIT and Harvard	BRD-K40765512			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cncnc2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20-,25+/m0/s1	XPLVEXAVWRQRFN-ZYLNGJIFSA-N	475.258339966							106155
BRD-K78169765	LSM-17517		54619745	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17+,22+/m0/s1	OSFPASGWEYOZJM-GSHUGGBRSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K78169765	BRD-K78169765-001-01-8	Broad Institute of MIT and Harvard	BRD-K78169765			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17+,22+/m0/s1	OSFPASGWEYOZJM-GSHUGGBRSA-N	472.248583776							106156
BRD-K13927197	LSM-17518		54619707	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18-,23+/m1/s1	KDJJTCSMQRMMRL-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K13927197	BRD-K13927197-001-01-5	Broad Institute of MIT and Harvard	BRD-K13927197			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18-,23+/m1/s1	KDJJTCSMQRMMRL-PNCHPQGNSA-N	500.209340854							106157
BRD-K42671261	LSM-17519		54619879	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15+,19+/m0/s1	WYZAJQOJJPDCBL-QMTMVMCOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K42671261	BRD-K42671261-001-01-5	Broad Institute of MIT and Harvard	BRD-K42671261			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15+,19+/m0/s1	WYZAJQOJJPDCBL-QMTMVMCOSA-N	481.157619134							106158
CHEMBL2361140	LSM-15118	BRD-K19601332, SID131414886	54619738	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21+,26+/m1/s1	ZNXYRHHWSDGXHP-SWYRRKHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K19601332	BRD-K19601332-001-01-6	Broad Institute of MIT and Harvard	BRD-K19601332			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21+,26+/m1/s1	ZNXYRHHWSDGXHP-SWYRRKHMSA-N	548.201478272							103774
BRD-K99022424	LSM-17520		54619849	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19+,23+/m0/s1	ATGVLJGFQJXEPR-YCRNBWNJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc3cccnc3	BroadT	BRD-K99022424	BRD-K99022424-001-01-7	Broad Institute of MIT and Harvard	BRD-K99022424			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19+,23+/m0/s1	ATGVLJGFQJXEPR-YCRNBWNJSA-N	479.253254586							106159
BRD-K17231179	LSM-17521		54619716	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20-,25+/m0/s1	OOKFQDXWWBGNFU-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)C#CC4CCCC4	BroadT	BRD-K17231179	BRD-K17231179-001-01-0	Broad Institute of MIT and Harvard	BRD-K17231179			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)C#CC1CCCC1	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20-,25+/m0/s1	OOKFQDXWWBGNFU-ZYLNGJIFSA-N	490.258005608							106160
BRD-K14359942	LSM-17522		54619696	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20-,25+/m1/s1	XPLVEXAVWRQRFN-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cncnc2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K14359942	BRD-K14359942-001-01-8	Broad Institute of MIT and Harvard	BRD-K14359942			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cncnc2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20-,25+/m1/s1	XPLVEXAVWRQRFN-FHAGJXEFSA-N	475.258339966							106161
BRD-K89820077	LSM-17523		54619722	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18-,23-/m1/s1	HJKYHUWIGCJTPR-PMAPCBKXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K89820077	BRD-K89820077-001-01-6	Broad Institute of MIT and Harvard	BRD-K89820077			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18-,23-/m1/s1	HJKYHUWIGCJTPR-PMAPCBKXSA-N	464.242355544							106162
BRD-K30436657	LSM-43737		54619859	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17+,20+/m0/s1	BVEGZLWFKAUDHP-YDIOJFPFSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(\C=C\C)ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K30436657	BRD-K30436657-001-01-9	Broad Institute of MIT and Harvard	BRD-K30436657			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)\C=C\C	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17+,20+/m0/s1	BVEGZLWFKAUDHP-YDIOJFPFSA-N	453.22974194							
BRD-K07404651	LSM-17525		54619699	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15+,19-/m0/s1	WYZAJQOJJPDCBL-KHYOSLBOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K07404651	BRD-K07404651-001-01-2	Broad Institute of MIT and Harvard	BRD-K07404651			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15+,19-/m0/s1	WYZAJQOJJPDCBL-KHYOSLBOSA-N	481.157619134							106164
BRD-K56739005	LSM-17526		54619656	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21-,25-/m0/s1	GKCJFKOMNRYVJH-WATLYSKOSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K56739005	BRD-K56739005-001-01-4	Broad Institute of MIT and Harvard	BRD-K56739005			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21-,25-/m0/s1	GKCJFKOMNRYVJH-WATLYSKOSA-N	513.22974194							106165
BRD-K35253118	LSM-43738		54619863	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19+,24-/m0/s1	HCERARMSZYIAOP-FPBTUTEESA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K35253118	BRD-K35253118-001-01-6	Broad Institute of MIT and Harvard	BRD-K35253118			C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19+,24-/m0/s1	HCERARMSZYIAOP-FPBTUTEESA-N	502.213757518							
BRD-K84110809	LSM-17528		54619720	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21-,26+/m0/s1	HHBQEZHNSWTNJC-ISJBWFOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K84110809	BRD-K84110809-001-01-2	Broad Institute of MIT and Harvard	BRD-K84110809			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21-,26+/m0/s1	HHBQEZHNSWTNJC-ISJBWFOZSA-N	510.230076298							106167
BRD-K44152881	LSM-17529		54619691	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18+,23+/m1/s1	KDJJTCSMQRMMRL-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K44152881	BRD-K44152881-001-01-4	Broad Institute of MIT and Harvard	BRD-K44152881			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18+,23+/m1/s1	KDJJTCSMQRMMRL-STSQHVNTSA-N	500.209340854							106168
BRD-K33346587	LSM-43739		54619662	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22-,28-/m0/s1	YCWRHWKUOUGHRQ-QUKGTYAOSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K33346587	BRD-K33346587-001-01-2	Broad Institute of MIT and Harvard	BRD-K33346587			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)c1	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22-,28-/m0/s1	YCWRHWKUOUGHRQ-QUKGTYAOSA-N	544.268570292							
CHEMBL2361002	LSM-17531	BRD-K64860758, SID131415030	54619868	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21+,29+/m1/s1	JDSMWWFCTGPOGF-CGQTXMLISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccccc5F	BroadT	BRD-K64860758	BRD-K64860758-001-01-7	Broad Institute of MIT and Harvard	BRD-K64860758			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21+,29+/m1/s1	JDSMWWFCTGPOGF-CGQTXMLISA-N	594.183600242							106170
CHEMBL2142260	LSM-43740	BRD-K59667434, SID131414928	54619774	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17+,21-/m1/s1	NLMWZCLTQNAKQL-FXIGTNJYSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K59667434	BRD-K59667434-001-01-5	Broad Institute of MIT and Harvard	BRD-K59667434			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17+,21-/m1/s1	NLMWZCLTQNAKQL-FXIGTNJYSA-N	474.19369079							
BRD-K59134599	LSM-17533		54619816	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16+,21-/m1/s1	HYQDYNVKVXEYDN-VWKPWSFCSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2Oc3cc(Br)ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K59134599	BRD-K59134599-001-01-7	Broad Institute of MIT and Harvard	BRD-K59134599			COc1ccccc1NC(=O)N(C)C[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16+,21-/m1/s1	HYQDYNVKVXEYDN-VWKPWSFCSA-N	555.103869							106172
BRD-K41709602	LSM-17534		54619773	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19-,25+/m0/s1	IPGCYDACBMVSLM-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K41709602	BRD-K41709602-001-01-2	Broad Institute of MIT and Harvard	BRD-K41709602			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19-,25+/m0/s1	IPGCYDACBMVSLM-XHNVNVPESA-N	485.268984862							106173
BRD-K75168124	LSM-17535		54619801	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21+,26-/m1/s1	MIBYCFWLJSOUAV-YZIHRLCOSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K75168124	BRD-K75168124-001-01-9	Broad Institute of MIT and Harvard	BRD-K75168124			CCCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21+,26-/m1/s1	MIBYCFWLJSOUAV-YZIHRLCOSA-N	564.196392892							106174
BRD-A02501536	LSM-17536		44505304	InChI=1S/C28H42N4O5/c1-5-9-23(34)13-12-21-14-24-26(29-15-21)37-25(19(2)16-32(27(24)35)20(3)18-33)17-31(4)28(36)30-22-10-7-6-8-11-22/h14-15,19-20,22-23,25,33-34H,5-11,16-18H2,1-4H3,(H,30,36)/t19-,20+,23?,25-/m0/s1	QMLAMPDCLHLDFQ-FECDZENMSA-N	CCCC(O)C#Cc1cnc2O[C@@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-A02501536	BRD-A02501536-001-01-3	Broad Institute of MIT and Harvard	BRD-A02501536			CCCC(O)C#Cc1cnc2O[C@@H](CN(C)C(=O)NC3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H42N4O5/c1-5-9-23(34)13-12-21-14-24-26(29-15-21)37-25(19(2)16-32(27(24)35)20(3)18-33)17-31(4)28(36)30-22-10-7-6-8-11-22/h14-15,19-20,22-23,25,33-34H,5-11,16-18H2,1-4H3,(H,30,36)/t19-,20+,23?,25-/m0/s1	QMLAMPDCLHLDFQ-FECDZENMSA-N	514.315520484							106175
BRD-K44497547	LSM-17537		54619850	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10+,13-/m1/s1	WOUSVQRWYFHTGE-GBIKHYSHSA-N	CNC[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K44497547	BRD-K44497547-001-01-9	Broad Institute of MIT and Harvard	BRD-K44497547			CNC[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10+,13-/m1/s1	WOUSVQRWYFHTGE-GBIKHYSHSA-N	371.084454194							106176
BRD-K45172622	LSM-43741		54619612	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17+,21-/m0/s1	NLMWZCLTQNAKQL-UENYPMNWSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K45172622	BRD-K45172622-001-01-5	Broad Institute of MIT and Harvard	BRD-K45172622			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17+,21-/m0/s1	NLMWZCLTQNAKQL-UENYPMNWSA-N	474.19369079							
BRD-K94194278	LSM-17539		54619861	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13-,17-/m0/s1	QHGLBWHFCGZTIC-DCGLDWPTSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K94194278	BRD-K94194278-001-01-6	Broad Institute of MIT and Harvard	BRD-K94194278			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13-,17-/m0/s1	QHGLBWHFCGZTIC-DCGLDWPTSA-N	474.082405274							106178
MLS003128904	LSM-17540	BRD-K77290793	46903903	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14+,19-/m1/s1	WRXISDPBFZAALF-BIENJYKASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K77290793	BRD-K77290793-001-02-7	Broad Institute of MIT and Harvard	BRD-K77290793			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14+,19-/m1/s1	WRXISDPBFZAALF-BIENJYKASA-N	493.10124711							106179
BRD-K73027631	LSM-17541		44494493	InChI=1S/C22H28FN3O3/c1-14-11-26(15(2)13-27)22(28)19-9-17(16-5-7-18(23)8-6-16)10-24-21(19)29-20(14)12-25(3)4/h5-10,14-15,20,27H,11-13H2,1-4H3/t14-,15+,20-/m0/s1	MDZBGQPEIJVAEI-MDOVXXIYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ncc(cc2C1=O)c3ccc(F)cc3	BroadT	BRD-K73027631	BRD-K73027631-001-01-5	Broad Institute of MIT and Harvard	BRD-K73027631			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ncc(cc2C1=O)-c1ccc(F)cc1	InChI=1S/C22H28FN3O3/c1-14-11-26(15(2)13-27)22(28)19-9-17(16-5-7-18(23)8-6-16)10-24-21(19)29-20(14)12-25(3)4/h5-10,14-15,20,27H,11-13H2,1-4H3/t14-,15+,20-/m0/s1	MDZBGQPEIJVAEI-MDOVXXIYSA-N	401.211469986							106180
BRD-K64483847	LSM-17542		54619840	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20+,27+/m0/s1	OEWYWQPTOLBINC-ASHZAFPQSA-N	COc1ccccc1c2cnc3O[C@H](CN(C)Cc4ccc(F)cc4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K64483847	BRD-K64483847-001-01-1	Broad Institute of MIT and Harvard	BRD-K64483847			COc1ccccc1-c1cnc2O[C@H](CN(C)Cc3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20+,27+/m0/s1	OEWYWQPTOLBINC-ASHZAFPQSA-N	507.253334798							106181
BRD-K81031146	LSM-17543		54619639	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-13-8-22(21-6-5-7-23(29)14-21)15-26(28)38-27(19)17-30(3)39(33,34)25-11-9-24(37-4)10-12-25/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27+/m1/s1	OLBRUKVYTCLQEJ-DVHCVUMVSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)c4cccc(F)c4	BroadT	BRD-K81031146	BRD-K81031146-001-01-5	Broad Institute of MIT and Harvard	BRD-K81031146			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1cccc(F)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-13-8-22(21-6-5-7-23(29)14-21)15-26(28)38-27(19)17-30(3)39(33,34)25-11-9-24(37-4)10-12-25/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27+/m1/s1	OLBRUKVYTCLQEJ-DVHCVUMVSA-N	592.171320996							106182
BRD-K35441510	LSM-17544		54619607	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19+,23-/m0/s1	LMEKMJWGWXFVOU-YYDVJCTNSA-N	COCC#Cc1cnc2O[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K35441510	BRD-K35441510-001-01-1	Broad Institute of MIT and Harvard	BRD-K35441510			COCC#Cc1cnc2O[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19+,23-/m0/s1	LMEKMJWGWXFVOU-YYDVJCTNSA-N	471.273321314							106183
BRD-K70145120	LSM-17545		54619646	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18+,23+/m1/s1	HJKYHUWIGCJTPR-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K70145120	BRD-K70145120-001-01-6	Broad Institute of MIT and Harvard	BRD-K70145120			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18+,23+/m1/s1	HJKYHUWIGCJTPR-STSQHVNTSA-N	464.242355544							106184
BRD-K15654812	LSM-17546		54619855	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21-,25+/m0/s1	RCWBPICPBWJXDU-STWLZBDKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K15654812	BRD-K15654812-001-01-8	Broad Institute of MIT and Harvard	BRD-K15654812			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21-,25+/m0/s1	RCWBPICPBWJXDU-STWLZBDKSA-N	492.273655672							106185
BRD-K87340219	LSM-17547		54619841	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20-,25-/m1/s1	OOKFQDXWWBGNFU-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)C#CC4CCCC4	BroadT	BRD-K87340219	BRD-K87340219-001-01-6	Broad Institute of MIT and Harvard	BRD-K87340219			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)C#CC1CCCC1	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20-,25-/m1/s1	OOKFQDXWWBGNFU-UMEGOILYSA-N	490.258005608							106186
BRD-K26603007	LSM-17548		54619823	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18-,23-/m0/s1	KDJJTCSMQRMMRL-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K26603007	BRD-K26603007-001-01-7	Broad Institute of MIT and Harvard	BRD-K26603007			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18-,23-/m0/s1	KDJJTCSMQRMMRL-BSRJHKFKSA-N	500.209340854							106187
BRD-K09258973	LSM-17549		54619731	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12-,15+/m0/s1	SBYAEQQHLNEWQQ-SLEUVZQESA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K09258973	BRD-K09258973-001-01-1	Broad Institute of MIT and Harvard	BRD-K09258973			COCC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12-,15+/m0/s1	SBYAEQQHLNEWQQ-SLEUVZQESA-N	443.105583562							106188
BRD-K24004917	LSM-17550		54619613	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19-,23+/m1/s1	ATGVLJGFQJXEPR-PWHSHALESA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc3cccnc3	BroadT	BRD-K24004917	BRD-K24004917-001-01-9	Broad Institute of MIT and Harvard	BRD-K24004917			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19-,23+/m1/s1	ATGVLJGFQJXEPR-PWHSHALESA-N	479.253254586							106189
BRD-K65399214	LSM-43742		54619742	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19-,24-/m1/s1	HCERARMSZYIAOP-CKQPAXMLSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K65399214	BRD-K65399214-001-01-3	Broad Institute of MIT and Harvard	BRD-K65399214			C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19-,24-/m1/s1	HCERARMSZYIAOP-CKQPAXMLSA-N	502.213757518							
BRD-K91799761	LSM-17552		54619677	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20+,25-/m1/s1	OOKFQDXWWBGNFU-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)C#CC4CCCC4	BroadT	BRD-K91799761	BRD-K91799761-001-01-9	Broad Institute of MIT and Harvard	BRD-K91799761			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)C#CC1CCCC1	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20+,25-/m1/s1	OOKFQDXWWBGNFU-OHUGHZGNSA-N	490.258005608							106191
BRD-K77480803	LSM-17553		54619750	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21-,26+/m1/s1	HHBQEZHNSWTNJC-YPCDYVTLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K77480803	BRD-K77480803-001-01-4	Broad Institute of MIT and Harvard	BRD-K77480803			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21-,26+/m1/s1	HHBQEZHNSWTNJC-YPCDYVTLSA-N	510.230076298							106192
BRD-K27692586	LSM-17554		54619647	InChI=1S/C23H26FN3O3/c1-15-13-27(16(2)14-28)23(29)19-10-17(8-9-18-6-4-5-7-20(18)24)11-26-22(19)30-21(15)12-25-3/h4-7,10-11,15-16,21,25,28H,12-14H2,1-3H3/t15-,16+,21-/m0/s1	NUAJGQJLZRKPPD-MRUHUIDDSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc3ccccc3F	BroadT	BRD-K27692586	BRD-K27692586-001-01-8	Broad Institute of MIT and Harvard	BRD-K27692586			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc1ccccc1F	InChI=1S/C23H26FN3O3/c1-15-13-27(16(2)14-28)23(29)19-10-17(8-9-18-6-4-5-7-20(18)24)11-26-22(19)30-21(15)12-25-3/h4-7,10-11,15-16,21,25,28H,12-14H2,1-3H3/t15-,16+,21-/m0/s1	NUAJGQJLZRKPPD-MRUHUIDDSA-N	411.195819922							106193
BRD-K39435284	LSM-17555		54619808	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18-,24+/m1/s1	OVFNTHNHZTZUMD-GGUMNFRJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K39435284	BRD-K39435284-001-01-3	Broad Institute of MIT and Harvard	BRD-K39435284			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18-,24+/m1/s1	OVFNTHNHZTZUMD-GGUMNFRJSA-N	499.248249418							106194
BRD-K04468899	LSM-43743		54619752	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17+,20-/m0/s1	BVEGZLWFKAUDHP-XNAXPPRUSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(\C=C\C)ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K04468899	BRD-K04468899-001-01-2	Broad Institute of MIT and Harvard	BRD-K04468899			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)\C=C\C	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17+,20-/m0/s1	BVEGZLWFKAUDHP-XNAXPPRUSA-N	453.22974194							
MLS003129035	LSM-17557	BRD-K83254798, SID99359643	46904205	InChI=1S/C22H26BrFN2O5S/c1-14-11-26(15(2)13-27)32(29,30)21-9-6-17(23)10-19(21)31-20(14)12-25(3)22(28)16-4-7-18(24)8-5-16/h4-10,14-15,20,27H,11-13H2,1-3H3/t14-,15+,20-/m1/s1	TWAZXZQUDIIERC-QEEYODRMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K83254798	BRD-K83254798-001-01-2	Broad Institute of MIT and Harvard	BRD-K83254798			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H26BrFN2O5S/c1-14-11-26(15(2)13-27)32(29,30)21-9-6-17(23)10-19(21)31-20(14)12-25(3)22(28)16-4-7-18(24)8-5-16/h4-10,14-15,20,27H,11-13H2,1-3H3/t14-,15+,20-/m1/s1	TWAZXZQUDIIERC-QEEYODRMSA-N	528.072983442							106196
MLS003128891	LSM-17558	BRD-K68858233, SID121282617	51358868	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11+,14-/m0/s1	JDNCUSTXITVPAM-WDMOLILDSA-N	CNC[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K68858233	BRD-K68858233-001-01-2	Broad Institute of MIT and Harvard	BRD-K68858233			CNC[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11+,14-/m0/s1	JDNCUSTXITVPAM-WDMOLILDSA-N	406.056190526							106197
BRD-K18686200	LSM-17559		54619777	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20+,24-/m0/s1	NKXMQWDASBSVNS-ROKPMTFOSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K18686200	BRD-K18686200-001-01-7	Broad Institute of MIT and Harvard	BRD-K18686200			CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20+,24-/m0/s1	NKXMQWDASBSVNS-ROKPMTFOSA-N	463.247106566							106198
CHEMBL2142490	LSM-17560	BRD-K32451879, SID131415000	54619842	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-13-8-22(21-6-5-7-23(29)14-21)15-26(28)38-27(19)17-30(3)39(33,34)25-11-9-24(37-4)10-12-25/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27+/m1/s1	OLBRUKVYTCLQEJ-JVAFGIKQSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)c4cccc(F)c4	BroadT	BRD-K32451879	BRD-K32451879-001-01-8	Broad Institute of MIT and Harvard	BRD-K32451879			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cccc(F)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-13-8-22(21-6-5-7-23(29)14-21)15-26(28)38-27(19)17-30(3)39(33,34)25-11-9-24(37-4)10-12-25/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27+/m1/s1	OLBRUKVYTCLQEJ-JVAFGIKQSA-N	592.171320996							106199
BRD-K51322795	LSM-17561		54619626	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17-,21-/m1/s1	FYPIPCFJMPJNQJ-CBGDNZLLSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K51322795	BRD-K51322795-001-01-8	Broad Institute of MIT and Harvard	BRD-K51322795			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17-,21-/m1/s1	FYPIPCFJMPJNQJ-CBGDNZLLSA-N	444.273655672							106200
BRD-K97106314	LSM-17562		54619759	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17-,22-/m1/s1	OSFPASGWEYOZJM-DRSNIGMVSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K97106314	BRD-K97106314-001-01-3	Broad Institute of MIT and Harvard	BRD-K97106314			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17-,22-/m1/s1	OSFPASGWEYOZJM-DRSNIGMVSA-N	472.248583776							106201
BRD-K03331449	LSM-17563		54619602	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21-,25+/m1/s1	RCWBPICPBWJXDU-OTPAQWSUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K03331449	BRD-K03331449-001-01-8	Broad Institute of MIT and Harvard	BRD-K03331449			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21-,25+/m1/s1	RCWBPICPBWJXDU-OTPAQWSUSA-N	492.273655672							106202
BRD-K15343038	LSM-17564		54619624	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19-,23-/m0/s1	ATGVLJGFQJXEPR-YDHSSHFGSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc3cccnc3	BroadT	BRD-K15343038	BRD-K15343038-001-01-6	Broad Institute of MIT and Harvard	BRD-K15343038			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19-,23-/m0/s1	ATGVLJGFQJXEPR-YDHSSHFGSA-N	479.253254586							106203
MLS003128973	LSM-17565	BRD-K25761766, SID99359536	46904098	InChI=1S/C22H26BrFN2O5S/c1-14-11-26(15(2)13-27)32(29,30)21-9-6-17(23)10-19(21)31-20(14)12-25(3)22(28)16-4-7-18(24)8-5-16/h4-10,14-15,20,27H,11-13H2,1-3H3/t14-,15+,20+/m0/s1	TWAZXZQUDIIERC-BXTJHSDWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K25761766	BRD-K25761766-001-01-5	Broad Institute of MIT and Harvard	BRD-K25761766			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H26BrFN2O5S/c1-14-11-26(15(2)13-27)32(29,30)21-9-6-17(23)10-19(21)31-20(14)12-25(3)22(28)16-4-7-18(24)8-5-16/h4-10,14-15,20,27H,11-13H2,1-3H3/t14-,15+,20+/m0/s1	TWAZXZQUDIIERC-BXTJHSDWSA-N	528.072983442							106204
CHEMBL2134790	LSM-17566	SID131414922, BRD-K80725855	54619768	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21-,29-/m1/s1	JDSMWWFCTGPOGF-GVNDJSPXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccccc5F	BroadT	BRD-K80725855	BRD-K80725855-001-01-4	Broad Institute of MIT and Harvard	BRD-K80725855			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21-,29-/m1/s1	JDSMWWFCTGPOGF-GVNDJSPXSA-N	594.183600242							106205
CHEMBL2134061	LSM-17567	BRD-K58248556, SID131414805	54619659	InChI=1S/C23H34N2O4S/c1-17-15-25(18(2)16-26)30(27,28)23-12-11-20(10-9-19-7-5-4-6-8-19)13-21(23)29-22(17)14-24-3/h11-13,17-19,22,24,26H,4-8,14-16H2,1-3H3/t17-,18-,22-/m0/s1	PTEAFCJBUOPAHG-SPEDKVCISA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC3CCCCC3	BroadT	BRD-K58248556	BRD-K58248556-001-01-7	Broad Institute of MIT and Harvard	BRD-K58248556			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC1CCCCC1	InChI=1S/C23H34N2O4S/c1-17-15-25(18(2)16-26)30(27,28)23-12-11-20(10-9-19-7-5-4-6-8-19)13-21(23)29-22(17)14-24-3/h11-13,17-19,22,24,26H,4-8,14-16H2,1-3H3/t17-,18-,22-/m0/s1	PTEAFCJBUOPAHG-SPEDKVCISA-N	434.223928278							106206
BRD-K95016030	LSM-17568		54619611	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20+,26-/m1/s1	RYIFWOIJOZENBD-BVFVYWQFSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K95016030	BRD-K95016030-001-01-9	Broad Institute of MIT and Harvard	BRD-K95016030			COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20+,26-/m1/s1	RYIFWOIJOZENBD-BVFVYWQFSA-N	530.208672138							106207
BRD-K92358687	LSM-17569		54619648	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20+,25-/m1/s1	XPLVEXAVWRQRFN-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cncnc2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K92358687	BRD-K92358687-001-01-4	Broad Institute of MIT and Harvard	BRD-K92358687			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cncnc2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20+,25-/m1/s1	XPLVEXAVWRQRFN-OHUGHZGNSA-N	475.258339966							106208
BRD-K06181307	LSM-17570		54619734	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20-,25-/m0/s1	XPLVEXAVWRQRFN-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cncnc2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K06181307	BRD-K06181307-001-01-5	Broad Institute of MIT and Harvard	BRD-K06181307			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cncnc2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20-,25-/m0/s1	XPLVEXAVWRQRFN-RLSLOFABSA-N	475.258339966							106209
BRD-K42809349	LSM-43744		54619824	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17+,20-/m1/s1	BVEGZLWFKAUDHP-LGBRCTHBSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(\C=C\C)ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K42809349	BRD-K42809349-001-01-7	Broad Institute of MIT and Harvard	BRD-K42809349			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)\C=C\C	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17+,20-/m1/s1	BVEGZLWFKAUDHP-LGBRCTHBSA-N	453.22974194							
BRD-K54922310	LSM-17572		54619713	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19-,22+/m0/s1	LOALBDSDXWHRAT-CNNODRBYSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K54922310	BRD-K54922310-001-01-8	Broad Institute of MIT and Harvard	BRD-K54922310			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19-,22+/m0/s1	LOALBDSDXWHRAT-CNNODRBYSA-N	486.284220356							106211
BRD-K90852412	LSM-17573		54619815	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20-,27+/m1/s1	OEWYWQPTOLBINC-DVHCVUMVSA-N	COc1ccccc1c2cnc3O[C@@H](CN(C)Cc4ccc(F)cc4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K90852412	BRD-K90852412-001-01-0	Broad Institute of MIT and Harvard	BRD-K90852412			COc1ccccc1-c1cnc2O[C@@H](CN(C)Cc3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20-,27+/m1/s1	OEWYWQPTOLBINC-DVHCVUMVSA-N	507.253334798							106212
BRD-K85336956	LSM-17574		54619767	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20-,24+/m0/s1	NKXMQWDASBSVNS-MZLICYQSSA-N	CCCC#Cc1cnc2O[C@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K85336956	BRD-K85336956-001-01-3	Broad Institute of MIT and Harvard	BRD-K85336956			CCCC#Cc1cnc2O[C@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20-,24+/m0/s1	NKXMQWDASBSVNS-MZLICYQSSA-N	463.247106566							106213
BRD-K14673075	LSM-17575		54619671	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	CUOJNPIZUFXRHX-IEGUWTFLSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K14673075	BRD-K14673075-001-01-1	Broad Institute of MIT and Harvard	BRD-K14673075			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	CUOJNPIZUFXRHX-IEGUWTFLSA-N	501.193356432							106214
BRD-K88890050	LSM-17576		54619792	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20+,25-/m0/s1	XPLVEXAVWRQRFN-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cncnc2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K88890050	BRD-K88890050-001-01-1	Broad Institute of MIT and Harvard	BRD-K88890050			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cncnc2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20+,25-/m0/s1	XPLVEXAVWRQRFN-DFIYOIEZSA-N	475.258339966							106215
BRD-K82910696	LSM-17577		54619872	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18-,24-/m1/s1	OVFNTHNHZTZUMD-QZTZHPFYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K82910696	BRD-K82910696-001-01-3	Broad Institute of MIT and Harvard	BRD-K82910696			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18-,24-/m1/s1	OVFNTHNHZTZUMD-QZTZHPFYSA-N	499.248249418							106216
BRD-K80921954	LSM-17578		54619811	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	CUOJNPIZUFXRHX-BSRJHKFKSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K80921954	BRD-K80921954-001-01-9	Broad Institute of MIT and Harvard	BRD-K80921954			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	CUOJNPIZUFXRHX-BSRJHKFKSA-N	501.193356432							106217
BRD-K16525290	LSM-17579		54619623	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21+,26+/m1/s1	MIBYCFWLJSOUAV-SWYRRKHMSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K16525290	BRD-K16525290-001-01-0	Broad Institute of MIT and Harvard	BRD-K16525290			CCCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21+,26+/m1/s1	MIBYCFWLJSOUAV-SWYRRKHMSA-N	564.196392892							106218
BRD-K84235037	LSM-17580		54619695	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18+,23-/m1/s1	KDJJTCSMQRMMRL-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K84235037	BRD-K84235037-001-01-1	Broad Institute of MIT and Harvard	BRD-K84235037			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18+,23-/m1/s1	KDJJTCSMQRMMRL-IEGUWTFLSA-N	500.209340854							106219
BRD-K15052303	LSM-17581		54619726	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19-,24-/m1/s1	QDRMLRNWHHCLDG-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K15052303	BRD-K15052303-001-01-1	Broad Institute of MIT and Harvard	BRD-K15052303			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19-,24-/m1/s1	QDRMLRNWHHCLDG-KHCICDEESA-N	489.237604522							106220
BRD-K38434557	LSM-17582		54619758	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21+,25-/m1/s1	RCWBPICPBWJXDU-TYBLODHISA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K38434557	BRD-K38434557-001-01-7	Broad Institute of MIT and Harvard	BRD-K38434557			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21+,25-/m1/s1	RCWBPICPBWJXDU-TYBLODHISA-N	492.273655672							106221
BRD-K77940693	LSM-17583		54619683	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20-,24-/m0/s1	NKXMQWDASBSVNS-SKPFHBQLSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K77940693	BRD-K77940693-001-01-0	Broad Institute of MIT and Harvard	BRD-K77940693			CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20-,24-/m0/s1	NKXMQWDASBSVNS-SKPFHBQLSA-N	463.247106566							106222
BRD-K33217094	LSM-17584		54619665	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20+,26+/m0/s1	RYIFWOIJOZENBD-OUDXUNEISA-N	COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K33217094	BRD-K33217094-001-01-1	Broad Institute of MIT and Harvard	BRD-K33217094			COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20+,26+/m0/s1	RYIFWOIJOZENBD-OUDXUNEISA-N	530.208672138							106223
BRD-K12801140	LSM-17585		54619796	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13-,17+/m0/s1	QHGLBWHFCGZTIC-GDZNZVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K12801140	BRD-K12801140-001-01-1	Broad Institute of MIT and Harvard	BRD-K12801140			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13-,17+/m0/s1	QHGLBWHFCGZTIC-GDZNZVCISA-N	474.082405274							106224
BRD-K56957303	LSM-17586		54619708	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20-,26+/m1/s1	RYIFWOIJOZENBD-KYTVRQNUSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K56957303	BRD-K56957303-001-01-1	Broad Institute of MIT and Harvard	BRD-K56957303			COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20-,26+/m1/s1	RYIFWOIJOZENBD-KYTVRQNUSA-N	530.208672138							106225
BRD-K50935646-001-01-9	LSM-17587	BRD-K50935646	54619633	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16+,21+/m0/s1	HYQDYNVKVXEYDN-GCKMJXCFSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2Oc3cc(Br)ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K50935646	BRD-K50935646-001-02-7	Broad Institute of MIT and Harvard	BRD-K50935646			COc1ccccc1NC(=O)N(C)C[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16+,21+/m0/s1	HYQDYNVKVXEYDN-GCKMJXCFSA-N	555.103869							106226
MLS003129965	LSM-17588	BRD-K51978501, SID99358510	46903338	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21-/m1/s1	HYQDYNVKVXEYDN-WHSLLNHNSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2Oc3cc(Br)ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K51978501	BRD-K51978501-001-02-0	Broad Institute of MIT and Harvard	BRD-K51978501			COc1ccccc1NC(=O)N(C)C[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21-/m1/s1	HYQDYNVKVXEYDN-WHSLLNHNSA-N	555.103869							106227
BRD-K77237686	LSM-17589		54619755	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19-,22+/m1/s1	LOALBDSDXWHRAT-KNKQGSTJSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K77237686	BRD-K77237686-001-01-0	Broad Institute of MIT and Harvard	BRD-K77237686			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19-,22+/m1/s1	LOALBDSDXWHRAT-KNKQGSTJSA-N	486.284220356							106228
CHEMBL3182391	LSM-17590	BRD-K45112293	54619760	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21-,29+/m0/s1	JDSMWWFCTGPOGF-LRZFZUCMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccccc5F	BroadT	BRD-K45112293	BRD-K45112293-001-01-9	Broad Institute of MIT and Harvard	BRD-K45112293			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21-,29+/m0/s1	JDSMWWFCTGPOGF-LRZFZUCMSA-N	594.183600242							106229
CHEMBL2141199	LSM-17591	SID85812203, BRD-K40376024	44505098	InChI=1S/C29H37F3N4O4/c1-18-15-36(19(2)17-37)27(38)24-13-21(20-8-7-9-22(12-20)29(30,31)32)14-33-26(24)40-25(18)16-35(3)28(39)34-23-10-5-4-6-11-23/h7-9,12-14,18-19,23,25,37H,4-6,10-11,15-17H2,1-3H3,(H,34,39)/t18-,19+,25-/m0/s1	LFZWPCZNHJKZTB-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ncc(cc3C1=O)c4cccc(c4)C(F)(F)F	BroadT	BRD-K40376024	BRD-K40376024-001-01-1	Broad Institute of MIT and Harvard	BRD-K40376024			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ncc(cc2C1=O)-c1cccc(c1)C(F)(F)F	InChI=1S/C29H37F3N4O4/c1-18-15-36(19(2)17-37)27(38)24-13-21(20-8-7-9-22(12-20)29(30,31)32)14-33-26(24)40-25(18)16-35(3)28(39)34-23-10-5-4-6-11-23/h7-9,12-14,18-19,23,25,37H,4-6,10-11,15-17H2,1-3H3,(H,34,39)/t18-,19+,25-/m0/s1	LFZWPCZNHJKZTB-CEYNDMKZSA-N	562.276690304							106230
BRD-K29028138	LSM-17592		54619736	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	CUOJNPIZUFXRHX-STSQHVNTSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K29028138	BRD-K29028138-001-01-6	Broad Institute of MIT and Harvard	BRD-K29028138			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	CUOJNPIZUFXRHX-STSQHVNTSA-N	501.193356432							106231
MLS003128947	LSM-17593	BRD-K25702540	46904075	InChI=1S/C21H27BrN4O3/c1-14-10-26(15(2)13-27)21(28)18-7-17(22)9-24-20(18)29-19(14)12-25(3)11-16-5-4-6-23-8-16/h4-9,14-15,19,27H,10-13H2,1-3H3/t14-,15+,19+/m1/s1	CNDBXNGNOXPHBO-VCBZYWHSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K25702540	BRD-K25702540-001-01-2	Broad Institute of MIT and Harvard	BRD-K25702540			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C21H27BrN4O3/c1-14-10-26(15(2)13-27)21(28)18-7-17(22)9-24-20(18)29-19(14)12-25(3)11-16-5-4-6-23-8-16/h4-9,14-15,19,27H,10-13H2,1-3H3/t14-,15+,19+/m1/s1	CNDBXNGNOXPHBO-VCBZYWHSSA-N	462.126653364							106232
MLS003129051	LSM-17594	BRD-K90519599, SID99359658	46904220	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13+,17-/m1/s1	QHGLBWHFCGZTIC-IIYDPXPESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K90519599	BRD-K90519599-001-02-8	Broad Institute of MIT and Harvard	BRD-K90519599			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13+,17-/m1/s1	QHGLBWHFCGZTIC-IIYDPXPESA-N	474.082405274							106233
BRD-K10481024	LSM-17595		54619666	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17+,21-/m1/s1	FYPIPCFJMPJNQJ-LLGFUMIMSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K10481024	BRD-K10481024-001-01-5	Broad Institute of MIT and Harvard	BRD-K10481024			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17+,21-/m1/s1	FYPIPCFJMPJNQJ-LLGFUMIMSA-N	444.273655672							106234
BRD-K65314728	LSM-17596		54619848	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14+,19+/m1/s1	WRXISDPBFZAALF-TYILLQQXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K65314728	BRD-K65314728-001-01-1	Broad Institute of MIT and Harvard	BRD-K65314728			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14+,19+/m1/s1	WRXISDPBFZAALF-TYILLQQXSA-N	493.10124711							106235
BRD-K78812892	LSM-17597		54619689	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21+,25-/m1/s1	GKCJFKOMNRYVJH-TYBLODHISA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K78812892	BRD-K78812892-001-01-9	Broad Institute of MIT and Harvard	BRD-K78812892			CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21+,25-/m1/s1	GKCJFKOMNRYVJH-TYBLODHISA-N	513.22974194							106236
BRD-K56417082	LSM-17598		44506105	InChI=1S/C31H32N4O7/c1-18-14-35(19(2)16-36)30(37)23-10-21(26-11-20-6-4-5-7-24(20)41-26)13-32-29(23)42-28(18)15-34(3)31(38)33-22-8-9-25-27(12-22)40-17-39-25/h4-13,18-19,28,36H,14-17H2,1-3H3,(H,33,38)/t18-,19+,28-/m0/s1	GEZRNZWITQZHSF-ILLIAVPXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ncc(cc4C1=O)c5oc6ccccc6c5	BroadT	BRD-K56417082	BRD-K56417082-001-01-3	Broad Institute of MIT and Harvard	BRD-K56417082			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ncc(cc2C1=O)-c1cc2ccccc2o1	InChI=1S/C31H32N4O7/c1-18-14-35(19(2)16-36)30(37)23-10-21(26-11-20-6-4-5-7-24(20)41-26)13-32-29(23)42-28(18)15-34(3)31(38)33-22-8-9-25-27(12-22)40-17-39-25/h4-13,18-19,28,36H,14-17H2,1-3H3,(H,33,38)/t18-,19+,28-/m0/s1	GEZRNZWITQZHSF-ILLIAVPXSA-N	572.227099404							106237
BRD-K96377358	LSM-17599		54619673	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18+,24-/m1/s1	OVFNTHNHZTZUMD-NXMSCROESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K96377358	BRD-K96377358-001-01-8	Broad Institute of MIT and Harvard	BRD-K96377358			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18+,24-/m1/s1	OVFNTHNHZTZUMD-NXMSCROESA-N	499.248249418							106238
BRD-K30625175	LSM-17600		54619862	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19+,23-/m1/s1	ATGVLJGFQJXEPR-SELNLUPBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc3cccnc3	BroadT	BRD-K30625175	BRD-K30625175-001-01-0	Broad Institute of MIT and Harvard	BRD-K30625175			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19+,23-/m1/s1	ATGVLJGFQJXEPR-SELNLUPBSA-N	479.253254586							106239
BRD-K76803075	LSM-17601		44505318	InChI=1S/C24H28FN3O5S/c1-16-13-28(17(2)15-29)24(30)21-11-19(9-8-18-6-5-7-20(25)10-18)12-26-23(21)33-22(16)14-27(3)34(4,31)32/h5-7,10-12,16-17,22,29H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	XOGNINPAOVJVSL-JKSBSHDWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)C#Cc3cccc(F)c3	BroadT	BRD-K76803075	BRD-K76803075-001-01-9	Broad Institute of MIT and Harvard	BRD-K76803075			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)C#Cc1cccc(F)c1	InChI=1S/C24H28FN3O5S/c1-16-13-28(17(2)15-29)24(30)21-11-19(9-8-18-6-5-7-20(25)10-18)12-26-23(21)33-22(16)14-27(3)34(4,31)32/h5-7,10-12,16-17,22,29H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	XOGNINPAOVJVSL-JKSBSHDWSA-N	489.173369916							106240
CHEMBL2357284	LSM-17602	BRD-K74677971, SID131414929	54619775	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21-,26+/m0/s1	ULJKHWQRDIVXQP-ISJBWFOZSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K74677971	BRD-K74677971-001-01-4	Broad Institute of MIT and Harvard	BRD-K74677971			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21-,26+/m0/s1	ULJKHWQRDIVXQP-ISJBWFOZSA-N	566.19205644							106241
CHEMBL2362206	LSM-17603	BRD-K91511557, SID131414907	54619757	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21-,25+/m0/s1	GKCJFKOMNRYVJH-STWLZBDKSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K91511557	BRD-K91511557-001-01-6	Broad Institute of MIT and Harvard	BRD-K91511557			CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21-,25+/m0/s1	GKCJFKOMNRYVJH-STWLZBDKSA-N	513.22974194							106242
BRD-K85051145	LSM-17604		54619693	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18+,23+/m0/s1	KDJJTCSMQRMMRL-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K85051145	BRD-K85051145-001-01-0	Broad Institute of MIT and Harvard	BRD-K85051145			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18+,23+/m0/s1	KDJJTCSMQRMMRL-YZZKKUAISA-N	500.209340854							106243
BRD-K11165361	LSM-17605		54619834	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20-,27+/m0/s1	OEWYWQPTOLBINC-OWOAZTCBSA-N	COc1ccccc1c2cnc3O[C@H](CN(C)Cc4ccc(F)cc4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K11165361	BRD-K11165361-001-01-4	Broad Institute of MIT and Harvard	BRD-K11165361			COc1ccccc1-c1cnc2O[C@H](CN(C)Cc3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20-,27+/m0/s1	OEWYWQPTOLBINC-OWOAZTCBSA-N	507.253334798							106244
BRD-K00446585	LSM-17606		54619809	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19-,22-/m0/s1	LOALBDSDXWHRAT-IPJJNNNSSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K00446585	BRD-K00446585-001-01-1	Broad Institute of MIT and Harvard	BRD-K00446585			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19-,22-/m0/s1	LOALBDSDXWHRAT-IPJJNNNSSA-N	486.284220356							106245
BRD-K78658063	LSM-17607		54619865	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	CUOJNPIZUFXRHX-IXFSTUDKSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K78658063	BRD-K78658063-001-01-9	Broad Institute of MIT and Harvard	BRD-K78658063			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	CUOJNPIZUFXRHX-IXFSTUDKSA-N	501.193356432							106246
BRD-K96652989	LSM-17608		54619636	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16+,21+/m1/s1	HYQDYNVKVXEYDN-XFQAVAEZSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2Oc3cc(Br)ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K96652989	BRD-K96652989-001-01-1	Broad Institute of MIT and Harvard	BRD-K96652989			COc1ccccc1NC(=O)N(C)C[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16+,21+/m1/s1	HYQDYNVKVXEYDN-XFQAVAEZSA-N	555.103869							106247
BRD-K94685203	LSM-17609		54619791	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19+,25-/m0/s1	IPGCYDACBMVSLM-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K94685203	BRD-K94685203-001-01-3	Broad Institute of MIT and Harvard	BRD-K94685203			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19+,25-/m0/s1	IPGCYDACBMVSLM-CEYNDMKZSA-N	485.268984862							106248
BRD-K02862004	LSM-17610		54619813	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12-,15+/m1/s1	SBYAEQQHLNEWQQ-JMSVASOKSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K02862004	BRD-K02862004-001-01-0	Broad Institute of MIT and Harvard	BRD-K02862004			COCC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12-,15+/m1/s1	SBYAEQQHLNEWQQ-JMSVASOKSA-N	443.105583562							106249
BRD-K04731905	LSM-17611		54619867	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18+,24+/m0/s1	OVFNTHNHZTZUMD-HOOSLVGPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K04731905	BRD-K04731905-001-01-5	Broad Institute of MIT and Harvard	BRD-K04731905			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18+,24+/m0/s1	OVFNTHNHZTZUMD-HOOSLVGPSA-N	499.248249418							106250
BRD-K39824708	LSM-17612		54619827	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19-,23+/m1/s1	LMEKMJWGWXFVOU-PWHSHALESA-N	COCC#Cc1cnc2O[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K39824708	BRD-K39824708-001-01-6	Broad Institute of MIT and Harvard	BRD-K39824708			COCC#Cc1cnc2O[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19-,23+/m1/s1	LMEKMJWGWXFVOU-PWHSHALESA-N	471.273321314							106251
BRD-K64840743	LSM-17613		54619605	InChI=1S/C22H31N3O4/c1-15-13-25(16(2)14-26)21(27)18-10-17(6-9-22(28)7-4-5-8-22)11-24-20(18)29-19(15)12-23-3/h10-11,15-16,19,23,26,28H,4-5,7-8,12-14H2,1-3H3/t15-,16+,19+/m1/s1	RMBUYXDJUXDIKM-GJYPPUQNSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K64840743	BRD-K64840743-001-01-7	Broad Institute of MIT and Harvard	BRD-K64840743			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H31N3O4/c1-15-13-25(16(2)14-26)21(27)18-10-17(6-9-22(28)7-4-5-8-22)11-24-20(18)29-19(15)12-23-3/h10-11,15-16,19,23,26,28H,4-5,7-8,12-14H2,1-3H3/t15-,16+,19+/m1/s1	RMBUYXDJUXDIKM-GJYPPUQNSA-N	401.231456502							106252
BRD-K96389533	LSM-17614		54619637	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19-,23-/m0/s1	LMEKMJWGWXFVOU-YDHSSHFGSA-N	COCC#Cc1cnc2O[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K96389533	BRD-K96389533-001-01-1	Broad Institute of MIT and Harvard	BRD-K96389533			COCC#Cc1cnc2O[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19-,23-/m0/s1	LMEKMJWGWXFVOU-YDHSSHFGSA-N	471.273321314							106253
BRD-K41306114	LSM-43745		54619627	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17+,20+/m1/s1	BVEGZLWFKAUDHP-WLGSODNXSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(\C=C\C)ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K41306114	BRD-K41306114-001-01-8	Broad Institute of MIT and Harvard	BRD-K41306114			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)\C=C\C	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17+,20+/m1/s1	BVEGZLWFKAUDHP-WLGSODNXSA-N	453.22974194							
BRD-K88642841	LSM-17616		54619843	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20+,25+/m1/s1	OOKFQDXWWBGNFU-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)C#CC4CCCC4	BroadT	BRD-K88642841	BRD-K88642841-001-01-0	Broad Institute of MIT and Harvard	BRD-K88642841			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)C#CC1CCCC1	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20+,25+/m1/s1	OOKFQDXWWBGNFU-RNHFSVANSA-N	490.258005608							106255
CHEMBL2356510	LSM-17617	SID131414741, BRD-K86545229	54619604	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21+,26+/m1/s1	ULJKHWQRDIVXQP-SWYRRKHMSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K86545229	BRD-K86545229-001-01-9	Broad Institute of MIT and Harvard	BRD-K86545229			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21+,26+/m1/s1	ULJKHWQRDIVXQP-SWYRRKHMSA-N	566.19205644							106256
BRD-K90625628	LSM-17618		54619719	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20+,27-/m0/s1	OEWYWQPTOLBINC-VKIDHGPPSA-N	COc1ccccc1c2cnc3O[C@@H](CN(C)Cc4ccc(F)cc4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K90625628	BRD-K90625628-001-01-0	Broad Institute of MIT and Harvard	BRD-K90625628			COc1ccccc1-c1cnc2O[C@@H](CN(C)Cc3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20+,27-/m0/s1	OEWYWQPTOLBINC-VKIDHGPPSA-N	507.253334798							106257
BRD-K30895360	LSM-17619		54619643	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18-,23+/m1/s1	HJKYHUWIGCJTPR-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K30895360	BRD-K30895360-001-01-4	Broad Institute of MIT and Harvard	BRD-K30895360			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18-,23+/m1/s1	HJKYHUWIGCJTPR-PNCHPQGNSA-N	464.242355544							106258
BRD-K44643967	LSM-17620		54619790	InChI=1S/C23H34N2O4S/c1-17-15-25(18(2)16-26)30(27,28)23-12-11-20(10-9-19-7-5-4-6-8-19)13-21(23)29-22(17)14-24-3/h11-13,17-19,22,24,26H,4-8,14-16H2,1-3H3/t17-,18+,22+/m1/s1	PTEAFCJBUOPAHG-FGSXEWAUSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC3CCCCC3	BroadT	BRD-K44643967	BRD-K44643967-001-01-9	Broad Institute of MIT and Harvard	BRD-K44643967			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1CCCCC1	InChI=1S/C23H34N2O4S/c1-17-15-25(18(2)16-26)30(27,28)23-12-11-20(10-9-19-7-5-4-6-8-19)13-21(23)29-22(17)14-24-3/h11-13,17-19,22,24,26H,4-8,14-16H2,1-3H3/t17-,18+,22+/m1/s1	PTEAFCJBUOPAHG-FGSXEWAUSA-N	434.223928278							106259
MLS003128889	LSM-17621	BRD-K79781106, SID131415377, SID99359326	46903890	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11-,14-/m1/s1	JDNCUSTXITVPAM-JTNHKYCSSA-N	CNC[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K79781106	BRD-K79781106-001-02-5	Broad Institute of MIT and Harvard	BRD-K79781106			CNC[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11-,14-/m1/s1	JDNCUSTXITVPAM-JTNHKYCSSA-N	406.056190526							106260
BRD-K96249452	LSM-17622		54619787	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18+,21+/m1/s1	YVOLCZAPMPCUFP-LQWHRVPQSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K96249452	BRD-K96249452-001-01-4	Broad Institute of MIT and Harvard	BRD-K96249452			CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18+,21+/m1/s1	YVOLCZAPMPCUFP-LQWHRVPQSA-N	503.220239896							106261
BRD-K93195215	LSM-17623		54619715	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20+,25+/m0/s1	OOKFQDXWWBGNFU-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)C#CC4CCCC4	BroadT	BRD-K93195215	BRD-K93195215-001-01-0	Broad Institute of MIT and Harvard	BRD-K93195215			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)C#CC1CCCC1	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20+,25+/m0/s1	OOKFQDXWWBGNFU-WZOHSFFVSA-N	490.258005608							106262
BRD-K70533557	LSM-17624		54619730	InChI=1S/C23H26FN3O3/c1-15-13-27(16(2)14-28)23(29)19-10-17(8-9-18-6-4-5-7-20(18)24)11-26-22(19)30-21(15)12-25-3/h4-7,10-11,15-16,21,25,28H,12-14H2,1-3H3/t15-,16-,21-/m1/s1	NUAJGQJLZRKPPD-WHSLLNHNSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc3ccccc3F	BroadT	BRD-K70533557	BRD-K70533557-001-01-5	Broad Institute of MIT and Harvard	BRD-K70533557			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc1ccccc1F	InChI=1S/C23H26FN3O3/c1-15-13-27(16(2)14-28)23(29)19-10-17(8-9-18-6-4-5-7-20(18)24)11-26-22(19)30-21(15)12-25-3/h4-7,10-11,15-16,21,25,28H,12-14H2,1-3H3/t15-,16-,21-/m1/s1	NUAJGQJLZRKPPD-WHSLLNHNSA-N	411.195819922							106263
MLS003128916	LSM-17625	BRD-K32056488	46903915	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15+,19-/m1/s1	WYZAJQOJJPDCBL-ZRGWGRIASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K32056488	BRD-K32056488-001-02-6	Broad Institute of MIT and Harvard	BRD-K32056488			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15+,19-/m1/s1	WYZAJQOJJPDCBL-ZRGWGRIASA-N	481.157619134							106264
BRD-K51787437	LSM-17626		54619847	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12-,15-/m1/s1	SBYAEQQHLNEWQQ-LALPHHSUSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K51787437	BRD-K51787437-001-01-6	Broad Institute of MIT and Harvard	BRD-K51787437			COCC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12-,15-/m1/s1	SBYAEQQHLNEWQQ-LALPHHSUSA-N	443.105583562							106265
BRD-K11566857	LSM-17627		54619784	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18-,21-/m1/s1	YVOLCZAPMPCUFP-DBXWQHBBSA-N	CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K11566857	BRD-K11566857-001-01-4	Broad Institute of MIT and Harvard	BRD-K11566857			CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18-,21-/m1/s1	YVOLCZAPMPCUFP-DBXWQHBBSA-N	503.220239896							106266
BRD-K40292034	LSM-43746		54619818	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17-,21-/m1/s1	NLMWZCLTQNAKQL-BHKDKARYSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K40292034	BRD-K40292034-001-01-8	Broad Institute of MIT and Harvard	BRD-K40292034			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17-,21-/m1/s1	NLMWZCLTQNAKQL-BHKDKARYSA-N	474.19369079							
BRD-K92356505	LSM-17629		54619729	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18+,23-/m0/s1	KDJJTCSMQRMMRL-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K92356505	BRD-K92356505-001-01-8	Broad Institute of MIT and Harvard	BRD-K92356505			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18+,23-/m0/s1	KDJJTCSMQRMMRL-IXFSTUDKSA-N	500.209340854							106268
BRD-K27653895	LSM-17630		54619682	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21-,26-/m1/s1	HHBQEZHNSWTNJC-IPVFLDMMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K27653895	BRD-K27653895-001-01-6	Broad Institute of MIT and Harvard	BRD-K27653895			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21-,26-/m1/s1	HHBQEZHNSWTNJC-IPVFLDMMSA-N	510.230076298							106269
BRD-K60272064	LSM-17631		54619622	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15-,19+/m1/s1	WYZAJQOJJPDCBL-CLCXKQKWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K60272064	BRD-K60272064-001-01-8	Broad Institute of MIT and Harvard	BRD-K60272064			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15-,19+/m1/s1	WYZAJQOJJPDCBL-CLCXKQKWSA-N	481.157619134							106270
BRD-K09779858	LSM-17632		54619654	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18+,24-/m0/s1	OVFNTHNHZTZUMD-RHGYRFJNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K09779858	BRD-K09779858-001-01-6	Broad Institute of MIT and Harvard	BRD-K09779858			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18+,24-/m0/s1	OVFNTHNHZTZUMD-RHGYRFJNSA-N	499.248249418							106271
BRD-K59159023	LSM-43747		54619631	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22+,28-/m0/s1	YCWRHWKUOUGHRQ-IXDAYETLSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)c1	BroadT	BRD-K59159023	BRD-K59159023-001-01-0	Broad Institute of MIT and Harvard	BRD-K59159023			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)c1	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22+,28-/m0/s1	YCWRHWKUOUGHRQ-IXDAYETLSA-N	544.268570292							
BRD-K01754917	LSM-17634		44496849	InChI=1S/C30H31F3N4O3/c1-20-16-37(21(2)19-38)29(39)26-14-24(5-4-22-6-8-25(9-7-22)30(31,32)33)15-35-28(26)40-27(20)18-36(3)17-23-10-12-34-13-11-23/h6-15,20-21,27,38H,16-19H2,1-3H3/t20-,21+,27-/m0/s1	GZQNINDEOIICFU-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ncc(cc3C1=O)C#Cc4ccc(cc4)C(F)(F)F	BroadT	BRD-K01754917	BRD-K01754917-001-01-6	Broad Institute of MIT and Harvard	BRD-K01754917			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ncc(cc2C1=O)C#Cc1ccc(cc1)C(F)(F)F	InChI=1S/C30H31F3N4O3/c1-20-16-37(21(2)19-38)29(39)26-14-24(5-4-22-6-8-25(9-7-22)30(31,32)33)15-35-28(26)40-27(20)18-36(3)17-23-10-12-34-13-11-23/h6-15,20-21,27,38H,16-19H2,1-3H3/t20-,21+,27-/m0/s1	GZQNINDEOIICFU-ISCCLHIJSA-N	552.234825492							106273
BRD-K80733946	LSM-17635		54619740	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20-,25-/m0/s1	OOKFQDXWWBGNFU-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)C#CC4CCCC4	BroadT	BRD-K80733946	BRD-K80733946-001-01-9	Broad Institute of MIT and Harvard	BRD-K80733946			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)C#CC1CCCC1	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20-,25-/m0/s1	OOKFQDXWWBGNFU-RLSLOFABSA-N	490.258005608							106274
BRD-K31275250	LSM-17636		54619670	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19+,24-/m0/s1	QDRMLRNWHHCLDG-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K31275250	BRD-K31275250-001-01-1	Broad Institute of MIT and Harvard	BRD-K31275250			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19+,24-/m0/s1	QDRMLRNWHHCLDG-GLDPYIMESA-N	489.237604522							106275
BRD-K28924192	LSM-17637		54619772	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17-,21-/m0/s1	FYPIPCFJMPJNQJ-FIKGOQFSSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K28924192	BRD-K28924192-001-01-0	Broad Institute of MIT and Harvard	BRD-K28924192			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17-,21-/m0/s1	FYPIPCFJMPJNQJ-FIKGOQFSSA-N	444.273655672							106276
BRD-K68980973	LSM-17638		54619802	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20-,25+/m1/s1	OOKFQDXWWBGNFU-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)C#CC4CCCC4	BroadT	BRD-K68980973	BRD-K68980973-001-01-8	Broad Institute of MIT and Harvard	BRD-K68980973			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)C#CC1CCCC1	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20-,25+/m1/s1	OOKFQDXWWBGNFU-FHAGJXEFSA-N	490.258005608							106277
BRD-K94082609	LSM-43748		54619702	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22-,28+/m1/s1	YCWRHWKUOUGHRQ-YZIRAUJZSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)c1	BroadT	BRD-K94082609	BRD-K94082609-001-01-3	Broad Institute of MIT and Harvard	BRD-K94082609			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)c1	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22-,28+/m1/s1	YCWRHWKUOUGHRQ-YZIRAUJZSA-N	544.268570292							
BRD-K86961579	LSM-17640		54619628	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21-,26+/m0/s1	MIBYCFWLJSOUAV-ISJBWFOZSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K86961579	BRD-K86961579-001-01-4	Broad Institute of MIT and Harvard	BRD-K86961579			CCCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21-,26+/m0/s1	MIBYCFWLJSOUAV-ISJBWFOZSA-N	564.196392892							106279
BRD-K77820593	LSM-17641		54619866	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19+,24-/m1/s1	QDRMLRNWHHCLDG-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K77820593	BRD-K77820593-001-01-5	Broad Institute of MIT and Harvard	BRD-K77820593			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19+,24-/m1/s1	QDRMLRNWHHCLDG-YDIMBITNSA-N	489.237604522							106280
CHEMBL2354713	LSM-17642	BRD-K56188108, SID131415044	54619881	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20+,24+/m1/s1	RTCSRSPLRRSOHD-NMMYMHLASA-N	CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc3ccccc3	BroadT	BRD-K56188108	BRD-K56188108-001-01-0	Broad Institute of MIT and Harvard	BRD-K56188108			CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc1ccccc1	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20+,24+/m1/s1	RTCSRSPLRRSOHD-NMMYMHLASA-N	484.203192834							106281
BRD-K85292767	LSM-17643		54619854	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14-,19-/m0/s1	WRXISDPBFZAALF-NJSLBKSFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K85292767	BRD-K85292767-001-01-7	Broad Institute of MIT and Harvard	BRD-K85292767			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14-,19-/m0/s1	WRXISDPBFZAALF-NJSLBKSFSA-N	493.10124711							106282
BRD-K84062787	LSM-17644		54619765	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21-,25-/m0/s1	RCWBPICPBWJXDU-WATLYSKOSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K84062787	BRD-K84062787-001-01-1	Broad Institute of MIT and Harvard	BRD-K84062787			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21-,25-/m0/s1	RCWBPICPBWJXDU-WATLYSKOSA-N	492.273655672							106283
BRD-K59606563	LSM-43749		54619856	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19-,24+/m1/s1	HCERARMSZYIAOP-NCFXNVHJSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K59606563	BRD-K59606563-001-01-6	Broad Institute of MIT and Harvard	BRD-K59606563			C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19-,24+/m1/s1	HCERARMSZYIAOP-NCFXNVHJSA-N	502.213757518							
BRD-K22485581	LSM-43750		54619806	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17-,20+/m1/s1	BVEGZLWFKAUDHP-IXDLJVBWSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(\C=C\C)ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K22485581	BRD-K22485581-001-01-7	Broad Institute of MIT and Harvard	BRD-K22485581			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)\C=C\C	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17-,20+/m1/s1	BVEGZLWFKAUDHP-IXDLJVBWSA-N	453.22974194							
CHEMBL2360672	LSM-17647	BRD-K20142115, SID131414798	54619653	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21+,26-/m0/s1	ULJKHWQRDIVXQP-UZINWLIJSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K20142115	BRD-K20142115-001-01-1	Broad Institute of MIT and Harvard	BRD-K20142115			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21+,26-/m0/s1	ULJKHWQRDIVXQP-UZINWLIJSA-N	566.19205644							106286
MLS003130385	LSM-17648	BRD-K29519734, SID99359383	46903947	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15+,19+/m1/s1	WYZAJQOJJPDCBL-VCBZYWHSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K29519734	BRD-K29519734-001-02-0	Broad Institute of MIT and Harvard	BRD-K29519734			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15+,19+/m1/s1	WYZAJQOJJPDCBL-VCBZYWHSSA-N	481.157619134							106287
BRD-K11054031	LSM-17649		54619771	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17+,22+/m1/s1	OSFPASGWEYOZJM-JLHGSKIFSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K11054031	BRD-K11054031-001-01-0	Broad Institute of MIT and Harvard	BRD-K11054031			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17+,22+/m1/s1	OSFPASGWEYOZJM-JLHGSKIFSA-N	472.248583776							106288
BRD-K15602285	LSM-17650		54619727	InChI=1S/C22H31N3O4/c1-15-13-25(16(2)14-26)21(27)18-10-17(6-9-22(28)7-4-5-8-22)11-24-20(18)29-19(15)12-23-3/h10-11,15-16,19,23,26,28H,4-5,7-8,12-14H2,1-3H3/t15-,16-,19-/m1/s1	RMBUYXDJUXDIKM-GPMSIDNRSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K15602285	BRD-K15602285-001-01-5	Broad Institute of MIT and Harvard	BRD-K15602285			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H31N3O4/c1-15-13-25(16(2)14-26)21(27)18-10-17(6-9-22(28)7-4-5-8-22)11-24-20(18)29-19(15)12-23-3/h10-11,15-16,19,23,26,28H,4-5,7-8,12-14H2,1-3H3/t15-,16-,19-/m1/s1	RMBUYXDJUXDIKM-GPMSIDNRSA-N	401.231456502							106289
BRD-K98953346	LSM-17651		54619739	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21+/m0/s1	HYQDYNVKVXEYDN-CKJXQJPGSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2Oc3cc(Br)ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K98953346	BRD-K98953346-001-01-9	Broad Institute of MIT and Harvard	BRD-K98953346			COc1ccccc1NC(=O)N(C)C[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21+/m0/s1	HYQDYNVKVXEYDN-CKJXQJPGSA-N	555.103869							106290
BRD-K96807219	LSM-17652		54619642	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21+,26-/m1/s1	ZNXYRHHWSDGXHP-YZIHRLCOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K96807219	BRD-K96807219-001-01-3	Broad Institute of MIT and Harvard	BRD-K96807219			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21+,26-/m1/s1	ZNXYRHHWSDGXHP-YZIHRLCOSA-N	548.201478272							106291
BRD-K22534934	LSM-17653		54619826	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21+,25-/m0/s1	GKCJFKOMNRYVJH-BKSPAHHJSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K22534934	BRD-K22534934-001-01-6	Broad Institute of MIT and Harvard	BRD-K22534934			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21+,25-/m0/s1	GKCJFKOMNRYVJH-BKSPAHHJSA-N	513.22974194							106292
BRD-K66253165	LSM-17654		54619688	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10+,13+/m1/s1	WOUSVQRWYFHTGE-NRUUGDAUSA-N	CNC[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K66253165	BRD-K66253165-001-01-0	Broad Institute of MIT and Harvard	BRD-K66253165			CNC[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10+,13+/m1/s1	WOUSVQRWYFHTGE-NRUUGDAUSA-N	371.084454194							106293
BRD-K98586629	LSM-17655		54619749	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21-,26-/m0/s1	HHBQEZHNSWTNJC-WOVHNISZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K98586629	BRD-K98586629-001-01-5	Broad Institute of MIT and Harvard	BRD-K98586629			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21-,26-/m0/s1	HHBQEZHNSWTNJC-WOVHNISZSA-N	510.230076298							106294
BRD-K69718434	LSM-17656		54619844	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19+,22-/m0/s1	LOALBDSDXWHRAT-JQVVWYNYSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K69718434	BRD-K69718434-001-01-4	Broad Institute of MIT and Harvard	BRD-K69718434			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19+,22-/m0/s1	LOALBDSDXWHRAT-JQVVWYNYSA-N	486.284220356							106295
BRD-K70936779	LSM-17657		54619829	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18-,24+/m0/s1	OVFNTHNHZTZUMD-LLJLJFOGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K70936779	BRD-K70936779-001-01-2	Broad Institute of MIT and Harvard	BRD-K70936779			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18-,24+/m0/s1	OVFNTHNHZTZUMD-LLJLJFOGSA-N	499.248249418							106296
BRD-K03675705	LSM-17658		54619793	InChI=1S/C23H26FN3O3/c1-15-13-27(16(2)14-28)23(29)19-10-17(8-9-18-6-4-5-7-20(18)24)11-26-22(19)30-21(15)12-25-3/h4-7,10-11,15-16,21,25,28H,12-14H2,1-3H3/t15-,16+,21-/m1/s1	NUAJGQJLZRKPPD-VWKPWSFCSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc3ccccc3F	BroadT	BRD-K03675705	BRD-K03675705-001-01-7	Broad Institute of MIT and Harvard	BRD-K03675705			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc1ccccc1F	InChI=1S/C23H26FN3O3/c1-15-13-27(16(2)14-28)23(29)19-10-17(8-9-18-6-4-5-7-20(18)24)11-26-22(19)30-21(15)12-25-3/h4-7,10-11,15-16,21,25,28H,12-14H2,1-3H3/t15-,16+,21-/m1/s1	NUAJGQJLZRKPPD-VWKPWSFCSA-N	411.195819922							106297
BRD-K58865204	LSM-17659		54619860	InChI=1S/C23H34N2O4S/c1-17-15-25(18(2)16-26)30(27,28)23-12-11-20(10-9-19-7-5-4-6-8-19)13-21(23)29-22(17)14-24-3/h11-13,17-19,22,24,26H,4-8,14-16H2,1-3H3/t17-,18+,22-/m1/s1	PTEAFCJBUOPAHG-KGVIQGDOSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC3CCCCC3	BroadT	BRD-K58865204	BRD-K58865204-001-01-4	Broad Institute of MIT and Harvard	BRD-K58865204			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1CCCCC1	InChI=1S/C23H34N2O4S/c1-17-15-25(18(2)16-26)30(27,28)23-12-11-20(10-9-19-7-5-4-6-8-19)13-21(23)29-22(17)14-24-3/h11-13,17-19,22,24,26H,4-8,14-16H2,1-3H3/t17-,18+,22-/m1/s1	PTEAFCJBUOPAHG-KGVIQGDOSA-N	434.223928278							106298
BRD-K08614872	LSM-15108		54619640	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21+,26-/m0/s1	ZNXYRHHWSDGXHP-UZINWLIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K08614872	BRD-K08614872-001-01-8	Broad Institute of MIT and Harvard	BRD-K08614872			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21+,26-/m0/s1	ZNXYRHHWSDGXHP-UZINWLIJSA-N	548.201478272							103764
BRD-K10130686	LSM-17660		44488727	InChI=1S/C26H33N3O6S/c1-18-15-29(19(2)17-30)25(31)22-13-20(11-12-26(3,4)32)14-27-24(22)35-23(18)16-28(5)36(33,34)21-9-7-6-8-10-21/h6-10,13-14,18-19,23,30,32H,15-17H2,1-5H3/t18-,19+,23-/m0/s1	JYGQURHRKDJHQY-YYDVJCTNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ncc(cc3C1=O)C#CC(C)(C)O	BroadT	BRD-K10130686	BRD-K10130686-001-01-7	Broad Institute of MIT and Harvard	BRD-K10130686			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ncc(cc2C1=O)C#CC(C)(C)O	InChI=1S/C26H33N3O6S/c1-18-15-29(19(2)17-30)25(31)22-13-20(11-12-26(3,4)32)14-27-24(22)35-23(18)16-28(5)36(33,34)21-9-7-6-8-10-21/h6-10,13-14,18-19,23,30,32H,15-17H2,1-5H3/t18-,19+,23-/m0/s1	JYGQURHRKDJHQY-YYDVJCTNSA-N	515.209006496							106299
BRD-K68594161	LSM-17661		54619681	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21+,25-/m0/s1	RCWBPICPBWJXDU-BKSPAHHJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K68594161	BRD-K68594161-001-01-9	Broad Institute of MIT and Harvard	BRD-K68594161			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21+,25-/m0/s1	RCWBPICPBWJXDU-BKSPAHHJSA-N	492.273655672							106300
CHEMBL2361610	LSM-17662	BRD-K85392418, SID131414832	54619685	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20-,26+/m0/s1	RYIFWOIJOZENBD-CUVVAGTFSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K85392418	BRD-K85392418-001-01-8	Broad Institute of MIT and Harvard	BRD-K85392418			COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H34N2O7S/c1-19-14-29(20(2)17-30)37(31,32)27-10-8-21(6-5-11-33-4)12-25(27)36-26(19)16-28(3)15-22-7-9-23-24(13-22)35-18-34-23/h7-10,12-13,19-20,26,30H,11,14-18H2,1-4H3/t19-,20-,26+/m0/s1	RYIFWOIJOZENBD-CUVVAGTFSA-N	530.208672138							106301
MLS003130093	LSM-17663	BRD-K18887540, SID99358673	46903452	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18-,24-/m0/s1	OVFNTHNHZTZUMD-XFAGBWLFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K18887540	BRD-K18887540-001-02-8	Broad Institute of MIT and Harvard	BRD-K18887540			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C27H34FN3O5/c1-17-14-31(18(2)16-32)27(34)22-12-20(21-6-4-5-7-23(21)28)13-29-25(22)36-24(17)15-30(3)26(33)19-8-10-35-11-9-19/h4-7,12-13,17-19,24,32H,8-11,14-16H2,1-3H3/t17-,18-,24-/m0/s1	OVFNTHNHZTZUMD-XFAGBWLFSA-N	499.248249418							106302
BRD-K51707293	LSM-17664		54619763	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18+,21-/m0/s1	YVOLCZAPMPCUFP-UEXGIBASSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K51707293	BRD-K51707293-001-01-7	Broad Institute of MIT and Harvard	BRD-K51707293			CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18+,21-/m0/s1	YVOLCZAPMPCUFP-UEXGIBASSA-N	503.220239896							131241
BRD-K43205312	LSM-17665		54619712	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19-,25-/m0/s1	IPGCYDACBMVSLM-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K43205312	BRD-K43205312-001-01-0	Broad Institute of MIT and Harvard	BRD-K43205312			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19-,25-/m0/s1	IPGCYDACBMVSLM-MHPIHPPYSA-N	485.268984862							106305
BRD-K59100858	LSM-17666		54619675	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20+,24+/m0/s1	NKXMQWDASBSVNS-DCLXLUIPSA-N	CCCC#Cc1cnc2O[C@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K59100858	BRD-K59100858-001-01-4	Broad Institute of MIT and Harvard	BRD-K59100858			CCCC#Cc1cnc2O[C@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O4/c1-5-6-8-11-21-14-23-25(28-15-21)34-24(19(2)16-30(27(23)33)20(3)18-31)17-29(4)26(32)22-12-9-7-10-13-22/h7,9-10,12-15,19-20,24,31H,5-6,16-18H2,1-4H3/t19-,20+,24+/m0/s1	NKXMQWDASBSVNS-DCLXLUIPSA-N	463.247106566							106306
BRD-K37480258	LSM-17667		54619663	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21+/m1/s1	HYQDYNVKVXEYDN-ZOCZFRKYSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2Oc3cc(Br)ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K37480258	BRD-K37480258-001-01-3	Broad Institute of MIT and Harvard	BRD-K37480258			COc1ccccc1NC(=O)N(C)C[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21+/m1/s1	HYQDYNVKVXEYDN-ZOCZFRKYSA-N	555.103869							106307
BRD-K78931693	LSM-17668		54619820	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19+,23-/m1/s1	LMEKMJWGWXFVOU-SELNLUPBSA-N	COCC#Cc1cnc2O[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K78931693	BRD-K78931693-001-01-8	Broad Institute of MIT and Harvard	BRD-K78931693			COCC#Cc1cnc2O[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19+,23-/m1/s1	LMEKMJWGWXFVOU-SELNLUPBSA-N	471.273321314							106308
BRD-K43603649	LSM-17669		54619723	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17-,21+/m0/s1	FYPIPCFJMPJNQJ-XGHQBKJUSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K43603649	BRD-K43603649-001-01-0	Broad Institute of MIT and Harvard	BRD-K43603649			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17-,21+/m0/s1	FYPIPCFJMPJNQJ-XGHQBKJUSA-N	444.273655672							106309
BRD-K18208847	LSM-17670		54619710	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18-,21-/m0/s1	YVOLCZAPMPCUFP-WFXMLNOXSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K18208847	BRD-K18208847-001-01-9	Broad Institute of MIT and Harvard	BRD-K18208847			CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18-,21-/m0/s1	YVOLCZAPMPCUFP-WFXMLNOXSA-N	503.220239896							106310
CHEMBL2354638	LSM-17671	SID131414906, BRD-K31093279	54619756	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20-,24+/m1/s1	RTCSRSPLRRSOHD-REHUZNOOSA-N	CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc3ccccc3	BroadT	BRD-K31093279	BRD-K31093279-001-01-5	Broad Institute of MIT and Harvard	BRD-K31093279			CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc1ccccc1	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20-,24+/m1/s1	RTCSRSPLRRSOHD-REHUZNOOSA-N	484.203192834							106311
BRD-K52414345	LSM-17672		54619678	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15-,19-/m0/s1	WYZAJQOJJPDCBL-DOXZYTNZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K52414345	BRD-K52414345-001-01-7	Broad Institute of MIT and Harvard	BRD-K52414345			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15-,19-/m0/s1	WYZAJQOJJPDCBL-DOXZYTNZSA-N	481.157619134							106312
BRD-K93941597	LSM-17673		54619770	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17+,22-/m0/s1	OSFPASGWEYOZJM-JKSBSHDWSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K93941597	BRD-K93941597-001-01-5	Broad Institute of MIT and Harvard	BRD-K93941597			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17+,22-/m0/s1	OSFPASGWEYOZJM-JKSBSHDWSA-N	472.248583776							106313
BRD-K55393423	LSM-17674		54619698	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19+,25-/m1/s1	IPGCYDACBMVSLM-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K55393423	BRD-K55393423-001-01-5	Broad Institute of MIT and Harvard	BRD-K55393423			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19+,25-/m1/s1	IPGCYDACBMVSLM-HHJKRLRDSA-N	485.268984862							106314
BRD-K97332312	LSM-43751		54619634	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17-,20+/m0/s1	BVEGZLWFKAUDHP-TWHBHHPNSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(\C=C\C)ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K97332312	BRD-K97332312-001-01-7	Broad Institute of MIT and Harvard	BRD-K97332312			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)\C=C\C	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17-,20+/m0/s1	BVEGZLWFKAUDHP-TWHBHHPNSA-N	453.22974194							
CHEMBL3185519	LSM-17676	BRD-K95129711	44488723	InChI=1S/C22H29N3O6S/c1-15-12-25(16(2)14-26)22(27)19-6-5-11-23-21(19)31-20(15)13-24(3)32(28,29)18-9-7-17(30-4)8-10-18/h5-11,15-16,20,26H,12-14H2,1-4H3/t15-,16+,20-/m0/s1	CTOMULULXDKVAS-YRNRMSPPSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3ncccc3C(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K95129711	BRD-K95129711-001-01-6	Broad Institute of MIT and Harvard	BRD-K95129711			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2ncccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C22H29N3O6S/c1-15-12-25(16(2)14-26)22(27)19-6-5-11-23-21(19)31-20(15)13-24(3)32(28,29)18-9-7-17(30-4)8-10-18/h5-11,15-16,20,26H,12-14H2,1-4H3/t15-,16+,20-/m0/s1	CTOMULULXDKVAS-YRNRMSPPSA-N	463.177706368							106316
BRD-K88385836	LSM-17677		54619664	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19-,23+/m0/s1	ATGVLJGFQJXEPR-SFYKDHMMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc3cccnc3	BroadT	BRD-K88385836	BRD-K88385836-001-01-3	Broad Institute of MIT and Harvard	BRD-K88385836			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19-,23+/m0/s1	ATGVLJGFQJXEPR-SFYKDHMMSA-N	479.253254586							106317
BRD-K96009269	LSM-17678		54619795	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10-,13+/m1/s1	WOUSVQRWYFHTGE-BREBYQMCSA-N	CNC[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K96009269	BRD-K96009269-001-01-5	Broad Institute of MIT and Harvard	BRD-K96009269			CNC[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10-,13+/m1/s1	WOUSVQRWYFHTGE-BREBYQMCSA-N	371.084454194							106318
BRD-K48188521	LSM-17679		54619641	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-13-8-22(21-6-5-7-23(29)14-21)15-26(28)38-27(19)17-30(3)39(33,34)25-11-9-24(37-4)10-12-25/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27-/m1/s1	OLBRUKVYTCLQEJ-SEXOINJZSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)c4cccc(F)c4	BroadT	BRD-K48188521	BRD-K48188521-001-01-0	Broad Institute of MIT and Harvard	BRD-K48188521			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1cccc(F)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-13-8-22(21-6-5-7-23(29)14-21)15-26(28)38-27(19)17-30(3)39(33,34)25-11-9-24(37-4)10-12-25/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27-/m1/s1	OLBRUKVYTCLQEJ-SEXOINJZSA-N	592.171320996							106319
BRD-K54837058	LSM-43752		54619657	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17-,21+/m0/s1	NLMWZCLTQNAKQL-LWUSATBJSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K54837058	BRD-K54837058-001-01-4	Broad Institute of MIT and Harvard	BRD-K54837058			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17-,21+/m0/s1	NLMWZCLTQNAKQL-LWUSATBJSA-N	474.19369079							
BRD-K79768278	LSM-17681		54619672	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21-,26+/m1/s1	ULJKHWQRDIVXQP-YPCDYVTLSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K79768278	BRD-K79768278-001-01-6	Broad Institute of MIT and Harvard	BRD-K79768278			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21-,26+/m1/s1	ULJKHWQRDIVXQP-YPCDYVTLSA-N	566.19205644							106321
BRD-K74626943	LSM-43753		54619679	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17-,20-/m1/s1	BVEGZLWFKAUDHP-GTQOYAPXSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(\C=C\C)ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K74626943	BRD-K74626943-001-01-6	Broad Institute of MIT and Harvard	BRD-K74626943			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)\C=C\C	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17-,20-/m1/s1	BVEGZLWFKAUDHP-GTQOYAPXSA-N	453.22974194							
CHEMBL3185199	LSM-17683	BRD-K14124956	54619661	InChI=1S/C23H34N2O4S/c1-17-15-25(18(2)16-26)30(27,28)23-12-11-20(10-9-19-7-5-4-6-8-19)13-21(23)29-22(17)14-24-3/h11-13,17-19,22,24,26H,4-8,14-16H2,1-3H3/t17-,18+,22+/m0/s1	PTEAFCJBUOPAHG-NJNPRVFISA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC3CCCCC3	BroadT	BRD-K14124956	BRD-K14124956-001-01-9	Broad Institute of MIT and Harvard	BRD-K14124956			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC1CCCCC1	InChI=1S/C23H34N2O4S/c1-17-15-25(18(2)16-26)30(27,28)23-12-11-20(10-9-19-7-5-4-6-8-19)13-21(23)29-22(17)14-24-3/h11-13,17-19,22,24,26H,4-8,14-16H2,1-3H3/t17-,18+,22+/m0/s1	PTEAFCJBUOPAHG-NJNPRVFISA-N	434.223928278							106323
BRD-K28429328	LSM-17684		54619724	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13+,17+/m1/s1	QHGLBWHFCGZTIC-IGCXYCKISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K28429328	BRD-K28429328-001-01-7	Broad Institute of MIT and Harvard	BRD-K28429328			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13+,17+/m1/s1	QHGLBWHFCGZTIC-IGCXYCKISA-N	474.082405274							106324
BRD-K01973494	LSM-17685		54619705	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18-,21+/m1/s1	YVOLCZAPMPCUFP-OPYAIIAOSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K01973494	BRD-K01973494-001-01-3	Broad Institute of MIT and Harvard	BRD-K01973494			CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18-,21+/m1/s1	YVOLCZAPMPCUFP-OPYAIIAOSA-N	503.220239896							106325
BRD-K84800135	LSM-17686		54619630	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21+,26-/m0/s1	HHBQEZHNSWTNJC-UZINWLIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K84800135	BRD-K84800135-001-01-3	Broad Institute of MIT and Harvard	BRD-K84800135			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21+,26-/m0/s1	HHBQEZHNSWTNJC-UZINWLIJSA-N	510.230076298							106326
BRD-K86036680	LSM-17687		54619830	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19+,23-/m0/s1	ATGVLJGFQJXEPR-YYDVJCTNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc3cccnc3	BroadT	BRD-K86036680	BRD-K86036680-001-01-1	Broad Institute of MIT and Harvard	BRD-K86036680			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19+,23-/m0/s1	ATGVLJGFQJXEPR-YYDVJCTNSA-N	479.253254586							106327
BRD-K28357534	LSM-17688		54619799	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21+,26+/m0/s1	MIBYCFWLJSOUAV-LZCXECNNSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K28357534	BRD-K28357534-001-01-0	Broad Institute of MIT and Harvard	BRD-K28357534			CCCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21+,26+/m0/s1	MIBYCFWLJSOUAV-LZCXECNNSA-N	564.196392892							106328
BRD-K35193502	LSM-17689		54619603	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	CUOJNPIZUFXRHX-PMAPCBKXSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K35193502	BRD-K35193502-001-01-8	Broad Institute of MIT and Harvard	BRD-K35193502			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	CUOJNPIZUFXRHX-PMAPCBKXSA-N	501.193356432							106329
MLS003128935	LSM-17690	BRD-K36944891, SID99359502	46904065	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11-,14+/m0/s1	JDNCUSTXITVPAM-COPLHBTASA-N	CNC[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K36944891	BRD-K36944891-001-02-0	Broad Institute of MIT and Harvard	BRD-K36944891			CNC[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11-,14+/m0/s1	JDNCUSTXITVPAM-COPLHBTASA-N	406.056190526							106330
BRD-K22718400	LSM-17691		54619735	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18+,23+/m0/s1	HJKYHUWIGCJTPR-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K22718400	BRD-K22718400-001-01-0	Broad Institute of MIT and Harvard	BRD-K22718400			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18+,23+/m0/s1	HJKYHUWIGCJTPR-YZZKKUAISA-N	464.242355544							106331
BRD-K96596828	LSM-17692		54619871	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21+,26-/m0/s1	MIBYCFWLJSOUAV-UZINWLIJSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K96596828	BRD-K96596828-001-01-5	Broad Institute of MIT and Harvard	BRD-K96596828			CCCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21+,26-/m0/s1	MIBYCFWLJSOUAV-UZINWLIJSA-N	564.196392892							106332
BRD-K09468701-001-01-5	LSM-17693	BRD-K09468701	44489812	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10+,13-/m0/s1	WOUSVQRWYFHTGE-CWSCBRNRSA-N	CNC[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K09468701	BRD-K09468701-001-02-3	Broad Institute of MIT and Harvard	BRD-K09468701			CNC[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10+,13-/m0/s1	WOUSVQRWYFHTGE-CWSCBRNRSA-N	371.084454194							106333
BRD-K37850190	LSM-17694		54619869	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20+,27-/m1/s1	OEWYWQPTOLBINC-IOKPGSKQSA-N	COc1ccccc1c2cnc3O[C@H](CN(C)Cc4ccc(F)cc4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K37850190	BRD-K37850190-001-01-8	Broad Institute of MIT and Harvard	BRD-K37850190			COc1ccccc1-c1cnc2O[C@H](CN(C)Cc3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20+,27-/m1/s1	OEWYWQPTOLBINC-IOKPGSKQSA-N	507.253334798							106334
BRD-K67142650-001-01-6	LSM-17695	BRD-K67142650	54619621	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20+,24-/m0/s1	RTCSRSPLRRSOHD-ROKPMTFOSA-N	CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc3ccccc3	BroadT	BRD-K67142650	BRD-K67142650-001-01-6	Broad Institute of MIT and Harvard	BRD-K67142650			CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc1ccccc1	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20+,24-/m0/s1	RTCSRSPLRRSOHD-ROKPMTFOSA-N	484.203192834							106335
BRD-K96768352	LSM-17696		54619858	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19-,22-/m1/s1	LOALBDSDXWHRAT-WOIUINJBSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K96768352	BRD-K96768352-001-01-4	Broad Institute of MIT and Harvard	BRD-K96768352			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19-,22-/m1/s1	LOALBDSDXWHRAT-WOIUINJBSA-N	486.284220356							106336
BRD-K18189580	LSM-17697		54619629	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21-,26+/m0/s1	ZNXYRHHWSDGXHP-ISJBWFOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K18189580	BRD-K18189580-001-01-2	Broad Institute of MIT and Harvard	BRD-K18189580			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21-,26+/m0/s1	ZNXYRHHWSDGXHP-ISJBWFOZSA-N	548.201478272							106337
BRD-K30298864	LSM-17698		54619838	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18+,21+/m0/s1	YVOLCZAPMPCUFP-WAOWUJCRSA-N	CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K30298864	BRD-K30298864-001-01-2	Broad Institute of MIT and Harvard	BRD-K30298864			CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18+,21+/m0/s1	YVOLCZAPMPCUFP-WAOWUJCRSA-N	503.220239896							106338
BRD-K46211110	LSM-15037		54619703	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21-,26-/m0/s1	ZNXYRHHWSDGXHP-WOVHNISZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K46211110	BRD-K46211110-001-01-9	Broad Institute of MIT and Harvard	BRD-K46211110			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C27H36N2O6S2/c1-19-9-12-24(13-10-19)36(31,32)28(4)17-26-20(2)16-29(21(3)18-30)37(33,34)27-14-11-23(15-25(27)35-26)22-7-5-6-8-22/h7,9-15,20-21,26,30H,5-6,8,16-18H2,1-4H3/t20-,21-,26-/m0/s1	ZNXYRHHWSDGXHP-WOVHNISZSA-N	548.201478272							103693
MLS003130296	LSM-17699	BRD-K61354849	46903814	InChI=1S/C23H27BrN4O6/c1-13-9-28(14(2)11-29)22(30)17-6-15(24)8-25-21(17)34-20(13)10-27(3)23(31)26-16-4-5-18-19(7-16)33-12-32-18/h4-8,13-14,20,29H,9-12H2,1-3H3,(H,26,31)/t13-,14+,20+/m1/s1	SIKYFMKLFHRFBE-CKNLXJGOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ncc(Br)cc4C1=O	BroadT	BRD-K61354849	BRD-K61354849-001-01-5	Broad Institute of MIT and Harvard	BRD-K61354849			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ncc(Br)cc2C1=O	InChI=1S/C23H27BrN4O6/c1-13-9-28(14(2)11-29)22(30)17-6-15(24)8-25-21(17)34-20(13)10-27(3)23(31)26-16-4-5-18-19(7-16)33-12-32-18/h4-8,13-14,20,29H,9-12H2,1-3H3,(H,26,31)/t13-,14+,20+/m1/s1	SIKYFMKLFHRFBE-CKNLXJGOSA-N	534.111397224							106339
BRD-K17133642	LSM-17700		54619797	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21-,26+/m1/s1	MIBYCFWLJSOUAV-YPCDYVTLSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K17133642	BRD-K17133642-001-01-7	Broad Institute of MIT and Harvard	BRD-K17133642			CCCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21-,26+/m1/s1	MIBYCFWLJSOUAV-YPCDYVTLSA-N	564.196392892							106340
BRD-K28795679	LSM-17701		54619644	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18-,23+/m1/s1	CUOJNPIZUFXRHX-PNCHPQGNSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K28795679	BRD-K28795679-001-01-6	Broad Institute of MIT and Harvard	BRD-K28795679			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18-,23+/m1/s1	CUOJNPIZUFXRHX-PNCHPQGNSA-N	501.193356432							106341
BRD-K73083501	LSM-17702		54619779	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20+,24+/m0/s1	RTCSRSPLRRSOHD-DCLXLUIPSA-N	CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc3ccccc3	BroadT	BRD-K73083501	BRD-K73083501-001-01-5	Broad Institute of MIT and Harvard	BRD-K73083501			CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc1ccccc1	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20+,24+/m0/s1	RTCSRSPLRRSOHD-DCLXLUIPSA-N	484.203192834							106342
BRD-K65969715	LSM-43754		54619819	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22+,28-/m1/s1	YCWRHWKUOUGHRQ-BXAWFUNRSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K65969715	BRD-K65969715-001-01-7	Broad Institute of MIT and Harvard	BRD-K65969715			COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)c1	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22+,28-/m1/s1	YCWRHWKUOUGHRQ-BXAWFUNRSA-N	544.268570292							
BRD-K72580121	LSM-17704		54619743	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16+,21-/m0/s1	HYQDYNVKVXEYDN-MRUHUIDDSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2Oc3cc(Br)ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K72580121	BRD-K72580121-001-01-1	Broad Institute of MIT and Harvard	BRD-K72580121			COc1ccccc1NC(=O)N(C)C[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H30BrN3O6S/c1-15-12-27(16(2)14-28)34(30,31)22-10-9-17(24)11-20(22)33-21(15)13-26(3)23(29)25-18-7-5-6-8-19(18)32-4/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16+,21-/m0/s1	HYQDYNVKVXEYDN-MRUHUIDDSA-N	555.103869							106344
BRD-K51898211	LSM-43755		54619769	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22+,28+/m1/s1	YCWRHWKUOUGHRQ-QYOZJANLSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K51898211	BRD-K51898211-001-01-3	Broad Institute of MIT and Harvard	BRD-K51898211			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)c1	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22+,28+/m1/s1	YCWRHWKUOUGHRQ-QYOZJANLSA-N	544.268570292							
MLS003128907	LSM-17706	BRD-K33177501	46903906	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14-,19+/m1/s1	WRXISDPBFZAALF-LPMFXHHGSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K33177501	BRD-K33177501-001-02-2	Broad Institute of MIT and Harvard	BRD-K33177501			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14-,19+/m1/s1	WRXISDPBFZAALF-LPMFXHHGSA-N	493.10124711							106346
BRD-K25149224	LSM-17707		54619645	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18-,23-/m0/s1	HJKYHUWIGCJTPR-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K25149224	BRD-K25149224-001-01-9	Broad Institute of MIT and Harvard	BRD-K25149224			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H32N4O4/c1-17-14-30(18(2)16-31)25(32)21-12-20(19-8-4-5-9-19)13-28-24(21)34-23(17)15-29(3)26(33)22-10-6-7-11-27-22/h6-8,10-13,17-18,23,31H,4-5,9,14-16H2,1-3H3/t17-,18-,23-/m0/s1	HJKYHUWIGCJTPR-BSRJHKFKSA-N	464.242355544							106347
BRD-K79497053	LSM-17708		54619852	InChI=1S/C22H31N3O4/c1-15-13-25(16(2)14-26)21(27)18-10-17(6-9-22(28)7-4-5-8-22)11-24-20(18)29-19(15)12-23-3/h10-11,15-16,19,23,26,28H,4-5,7-8,12-14H2,1-3H3/t15-,16+,19-/m1/s1	RMBUYXDJUXDIKM-JTDSTZFVSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K79497053	BRD-K79497053-001-01-3	Broad Institute of MIT and Harvard	BRD-K79497053			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H31N3O4/c1-15-13-25(16(2)14-26)21(27)18-10-17(6-9-22(28)7-4-5-8-22)11-24-20(18)29-19(15)12-23-3/h10-11,15-16,19,23,26,28H,4-5,7-8,12-14H2,1-3H3/t15-,16+,19-/m1/s1	RMBUYXDJUXDIKM-JTDSTZFVSA-N	401.231456502							106348
BRD-K49419779	LSM-17709		54619822	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13+,17+/m0/s1	QHGLBWHFCGZTIC-OGHNNQOOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K49419779	BRD-K49419779-001-01-7	Broad Institute of MIT and Harvard	BRD-K49419779			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13+,17+/m0/s1	QHGLBWHFCGZTIC-OGHNNQOOSA-N	474.082405274							106349
BRD-K47409867	LSM-17710		54619804	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20-,24-/m0/s1	RTCSRSPLRRSOHD-SKPFHBQLSA-N	CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc3ccccc3	BroadT	BRD-K47409867	BRD-K47409867-001-01-3	Broad Institute of MIT and Harvard	BRD-K47409867			CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc1ccccc1	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20-,24-/m0/s1	RTCSRSPLRRSOHD-SKPFHBQLSA-N	484.203192834							106350
BRD-K40164971	LSM-17711		54619754	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14-,19+/m0/s1	WRXISDPBFZAALF-CKFHNAJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K40164971	BRD-K40164971-001-01-4	Broad Institute of MIT and Harvard	BRD-K40164971			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14-,19+/m0/s1	WRXISDPBFZAALF-CKFHNAJUSA-N	493.10124711							106351
BRD-K91241684	LSM-17712		54619794	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18-,23+/m0/s1	CUOJNPIZUFXRHX-IUKKYPGJSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K91241684	BRD-K91241684-001-01-6	Broad Institute of MIT and Harvard	BRD-K91241684			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H31N3O6S/c1-17-13-28(18(2)15-29)35(31,32)24-10-9-21(20-7-5-19(12-26)6-8-20)11-22(24)34-23(17)14-27(3)25(30)16-33-4/h5-11,17-18,23,29H,13-16H2,1-4H3/t17-,18-,23+/m0/s1	CUOJNPIZUFXRHX-IUKKYPGJSA-N	501.193356432							106352
BRD-K27323347	LSM-17713		54619833	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20+,25-/m0/s1	OOKFQDXWWBGNFU-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc3ncc(cc3C1=O)C#CC4CCCC4	BroadT	BRD-K27323347	BRD-K27323347-001-01-0	Broad Institute of MIT and Harvard	BRD-K27323347			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc2ncc(cc2C1=O)C#CC1CCCC1	InChI=1S/C28H34N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-22(9-8-21-6-4-5-7-21)15-30-26(24)36-25(19)17-31(3)27(34)23-10-12-29-13-11-23/h10-15,19-21,25,33H,4-7,16-18H2,1-3H3/t19-,20+,25-/m0/s1	OOKFQDXWWBGNFU-DFIYOIEZSA-N	490.258005608							106353
BRD-K52231251	LSM-17714		54619851	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14+,19-/m0/s1	WRXISDPBFZAALF-KSMMKXTCSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K52231251	BRD-K52231251-001-01-7	Broad Institute of MIT and Harvard	BRD-K52231251			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14+,19-/m0/s1	WRXISDPBFZAALF-KSMMKXTCSA-N	493.10124711							106354
BRD-K18828858	LSM-17715		54619761	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19+,24+/m0/s1	QDRMLRNWHHCLDG-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K18828858	BRD-K18828858-001-01-0	Broad Institute of MIT and Harvard	BRD-K18828858			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19+,24+/m0/s1	QDRMLRNWHHCLDG-XLNZFTOWSA-N	489.237604522							106355
MLS003128934	LSM-17716	BRD-K50976856	51358894	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11+,14-/m1/s1	JDNCUSTXITVPAM-UHIISALHSA-N	CNC[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K50976856	BRD-K50976856-001-02-6	Broad Institute of MIT and Harvard	BRD-K50976856			CNC[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11+,14-/m1/s1	JDNCUSTXITVPAM-UHIISALHSA-N	406.056190526							106356
BRD-K77291765	LSM-17717		54619717	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18-,23+/m0/s1	KDJJTCSMQRMMRL-IUKKYPGJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K77291765	BRD-K77291765-001-01-1	Broad Institute of MIT and Harvard	BRD-K77291765			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18-,23+/m0/s1	KDJJTCSMQRMMRL-IUKKYPGJSA-N	500.209340854							106357
MLS003130074	LSM-17718	BRD-K80954687, SID99358657	46903436	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21-,29+/m1/s1	JDSMWWFCTGPOGF-RLCGNTSFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccccc5F	BroadT	BRD-K80954687	BRD-K80954687-001-02-2	Broad Institute of MIT and Harvard	BRD-K80954687			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21-,29+/m1/s1	JDSMWWFCTGPOGF-RLCGNTSFSA-N	594.183600242							106358
CHEMBL2132546	LSM-17719	BRD-K31250130, SID131414944	54619788	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18-,23-/m1/s1	KDJJTCSMQRMMRL-PMAPCBKXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K31250130	BRD-K31250130-001-01-0	Broad Institute of MIT and Harvard	BRD-K31250130			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C25H32N4O5S/c1-17-14-29(18(2)16-30)35(32,33)24-9-8-20(19-6-4-5-7-19)12-22(24)34-23(17)15-28(3)25(31)21-13-26-10-11-27-21/h6,8-13,17-18,23,30H,4-5,7,14-16H2,1-3H3/t17-,18-,23-/m1/s1	KDJJTCSMQRMMRL-PMAPCBKXSA-N	500.209340854							106359
MLS003130055	LSM-17720	BRD-K59821747, SID99358639	46903418	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21-,26-/m1/s1	MIBYCFWLJSOUAV-IPVFLDMMSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K59821747	BRD-K59821747-001-02-8	Broad Institute of MIT and Harvard	BRD-K59821747			CCCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21-,26-/m1/s1	MIBYCFWLJSOUAV-IPVFLDMMSA-N	564.196392892							106360
BRD-K14597872-001-01-7	LSM-43756	BRD-K14597872	54619601	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17-,20-/m0/s1	BVEGZLWFKAUDHP-OMOBONOLSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(\C=C\C)ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K14597872	BRD-K14597872-001-01-7	Broad Institute of MIT and Harvard	BRD-K14597872			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)\C=C\C	InChI=1S/C22H35N3O5S/c1-6-8-18-9-10-21-19(12-18)30-20(14-24(5)22(27)23-11-7-2)16(3)13-25(17(4)15-26)31(21,28)29/h6,8-10,12,16-17,20,26H,7,11,13-15H2,1-5H3,(H,23,27)/b8-6+/t16-,17-,20-/m0/s1	BVEGZLWFKAUDHP-OMOBONOLSA-N	453.22974194							
BRD-K54478142	LSM-17722		54619608	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19-,24+/m1/s1	QDRMLRNWHHCLDG-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K54478142	BRD-K54478142-001-01-5	Broad Institute of MIT and Harvard	BRD-K54478142			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C27H31N5O4/c1-18-14-32(19(2)16-33)27(35)23-10-21(22-11-28-17-29-12-22)13-30-26(23)36-24(18)15-31(3)25(34)9-20-7-5-4-6-8-20/h4-8,10-13,17-19,24,33H,9,14-16H2,1-3H3/t18-,19-,24+/m1/s1	QDRMLRNWHHCLDG-IECBHUPTSA-N	489.237604522							131242
BRD-K13229082	LSM-17723		54619832	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19+,22+/m1/s1	LOALBDSDXWHRAT-DXIQSLLYSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K13229082	BRD-K13229082-001-01-4	Broad Institute of MIT and Harvard	BRD-K13229082			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19+,22+/m1/s1	LOALBDSDXWHRAT-DXIQSLLYSA-N	486.284220356							106364
BRD-K47906308	LSM-17724		54619615	InChI=1S/C22H31N3O4/c1-15-13-25(16(2)14-26)21(27)18-10-17(6-9-22(28)7-4-5-8-22)11-24-20(18)29-19(15)12-23-3/h10-11,15-16,19,23,26,28H,4-5,7-8,12-14H2,1-3H3/t15-,16-,19-/m0/s1	RMBUYXDJUXDIKM-BXWFABGCSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K47906308	BRD-K47906308-001-01-5	Broad Institute of MIT and Harvard	BRD-K47906308			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H31N3O4/c1-15-13-25(16(2)14-26)21(27)18-10-17(6-9-22(28)7-4-5-8-22)11-24-20(18)29-19(15)12-23-3/h10-11,15-16,19,23,26,28H,4-5,7-8,12-14H2,1-3H3/t15-,16-,19-/m0/s1	RMBUYXDJUXDIKM-BXWFABGCSA-N	401.231456502							106365
BRD-K09511124	LSM-17725		54619828	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20+,24-/m1/s1	RTCSRSPLRRSOHD-JXALWOEJSA-N	CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc3ccccc3	BroadT	BRD-K09511124	BRD-K09511124-001-01-1	Broad Institute of MIT and Harvard	BRD-K09511124			CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc1ccccc1	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20+,24-/m1/s1	RTCSRSPLRRSOHD-JXALWOEJSA-N	484.203192834							106366
BRD-K12513721	LSM-17726		54619762	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21-,25-/m1/s1	GKCJFKOMNRYVJH-DNRQZRRGSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K12513721	BRD-K12513721-001-01-9	Broad Institute of MIT and Harvard	BRD-K12513721			CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35N3O5S/c1-19(2)11-12-22-13-14-26-24(15-22)35-25(20(3)16-30(21(4)18-31)36(26,33)34)17-29(5)27(32)28-23-9-7-6-8-10-23/h6-10,13-15,19-21,25,31H,16-18H2,1-5H3,(H,28,32)/t20-,21-,25-/m1/s1	GKCJFKOMNRYVJH-DNRQZRRGSA-N	513.22974194							106367
BRD-K36736230	LSM-17727		54619853	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21+,25+/m1/s1	RCWBPICPBWJXDU-CZSZKKDXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K36736230	BRD-K36736230-001-01-2	Broad Institute of MIT and Harvard	BRD-K36736230			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21+,25+/m1/s1	RCWBPICPBWJXDU-CZSZKKDXSA-N	492.273655672							106368
BRD-K57784254	LSM-43757		54619831	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22-,28+/m0/s1	YCWRHWKUOUGHRQ-UNDUUJOFSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K57784254	BRD-K57784254-001-01-7	Broad Institute of MIT and Harvard	BRD-K57784254			COc1cccc(NC(=O)N(C)C[C@H]2Oc3ncc(\C=C\c4ccccc4)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)c1	InChI=1S/C31H36N4O5/c1-21-18-35(22(2)20-36)30(37)27-15-24(14-13-23-9-6-5-7-10-23)17-32-29(27)40-28(21)19-34(3)31(38)33-25-11-8-12-26(16-25)39-4/h5-17,21-22,28,36H,18-20H2,1-4H3,(H,33,38)/b14-13+/t21-,22-,28+/m0/s1	YCWRHWKUOUGHRQ-UNDUUJOFSA-N	544.268570292							
CHEMBL2140736	LSM-17729	BRD-K80577041, SID131415032	54619870	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20-,24-/m1/s1	RTCSRSPLRRSOHD-YOSAUDMPSA-N	CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc3ccccc3	BroadT	BRD-K80577041	BRD-K80577041-001-01-4	Broad Institute of MIT and Harvard	BRD-K80577041			CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc1ccccc1	InChI=1S/C26H32N2O5S/c1-5-26(30)27(4)17-24-19(2)16-28(20(3)18-29)34(31,32)25-14-13-22(15-23(25)33-24)12-11-21-9-7-6-8-10-21/h6-10,13-15,19-20,24,29H,5,16-18H2,1-4H3/t19-,20-,24-/m1/s1	RTCSRSPLRRSOHD-YOSAUDMPSA-N	484.203192834							106370
BRD-K00973124	LSM-17730		54619837	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19+,22+/m0/s1	LOALBDSDXWHRAT-NNMXDRDESA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K00973124	BRD-K00973124-001-01-2	Broad Institute of MIT and Harvard	BRD-K00973124			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C26H38N4O5/c1-5-12-27-25(33)29(4)16-22-18(2)15-30(19(3)17-31)24(32)21-13-20(14-28-23(21)35-22)8-11-26(34)9-6-7-10-26/h13-14,18-19,22,31,34H,5-7,9-10,12,15-17H2,1-4H3,(H,27,33)/t18-,19+,22+/m0/s1	LOALBDSDXWHRAT-NNMXDRDESA-N	486.284220356							106371
BRD-K63754039	LSM-17731		54619667	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20+,27+/m1/s1	OEWYWQPTOLBINC-JVAFGIKQSA-N	COc1ccccc1c2cnc3O[C@@H](CN(C)Cc4ccc(F)cc4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K63754039	BRD-K63754039-001-01-4	Broad Institute of MIT and Harvard	BRD-K63754039			COc1ccccc1-c1cnc2O[C@@H](CN(C)Cc3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20+,27+/m1/s1	OEWYWQPTOLBINC-JVAFGIKQSA-N	507.253334798							106372
BRD-K76997656	LSM-17732		54619668	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19-,23+/m0/s1	LMEKMJWGWXFVOU-SFYKDHMMSA-N	COCC#Cc1cnc2O[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K76997656	BRD-K76997656-001-01-6	Broad Institute of MIT and Harvard	BRD-K76997656			COCC#Cc1cnc2O[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19-,23+/m0/s1	LMEKMJWGWXFVOU-SFYKDHMMSA-N	471.273321314							106373
BRD-K82115725	LSM-43758		54619732	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19+,24+/m1/s1	HCERARMSZYIAOP-JEJCRDRQSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K82115725	BRD-K82115725-001-01-4	Broad Institute of MIT and Harvard	BRD-K82115725			C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O6S/c1-5-6-20-9-12-25-23(13-20)34-24(18(2)14-28(19(3)17-29)35(25,32)33)16-27(4)15-21-7-10-22(11-8-21)26(30)31/h5-13,18-19,24,29H,14-17H2,1-4H3,(H,30,31)/b6-5+/t18-,19+,24+/m1/s1	HCERARMSZYIAOP-JEJCRDRQSA-N	502.213757518							
BRD-K14122415-001-01-8	LSM-17734	BRD-K14122415	54619764	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11+,14+/m0/s1	JDNCUSTXITVPAM-MISXGVKJSA-N	CNC[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K14122415	BRD-K14122415-001-02-6	Broad Institute of MIT and Harvard	BRD-K14122415			CNC[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C15H23BrN2O4S/c1-10-8-18(11(2)9-19)23(20,21)15-5-4-12(16)6-13(15)22-14(10)7-17-3/h4-6,10-11,14,17,19H,7-9H2,1-3H3/t10-,11+,14+/m0/s1	JDNCUSTXITVPAM-MISXGVKJSA-N	406.056190526							106375
BRD-K36812047	LSM-17735		54619835	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-13-8-22(21-6-5-7-23(29)14-21)15-26(28)38-27(19)17-30(3)39(33,34)25-11-9-24(37-4)10-12-25/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27-/m0/s1	OLBRUKVYTCLQEJ-OSOCVKALSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)c4cccc(F)c4	BroadT	BRD-K36812047	BRD-K36812047-001-01-4	Broad Institute of MIT and Harvard	BRD-K36812047			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1cccc(F)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-13-8-22(21-6-5-7-23(29)14-21)15-26(28)38-27(19)17-30(3)39(33,34)25-11-9-24(37-4)10-12-25/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27-/m0/s1	OLBRUKVYTCLQEJ-OSOCVKALSA-N	592.171320996							106376
BRD-K70380532	LSM-17736		54619700	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19-,25+/m1/s1	IPGCYDACBMVSLM-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K70380532	BRD-K70380532-001-01-1	Broad Institute of MIT and Harvard	BRD-K70380532			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19-,25+/m1/s1	IPGCYDACBMVSLM-RRQZXNHTSA-N	485.268984862							106377
BRD-K34561361	LSM-17737		54619785	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18+,21-/m1/s1	YVOLCZAPMPCUFP-LVCYWYKZSA-N	CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K34561361	BRD-K34561361-001-01-7	Broad Institute of MIT and Harvard	BRD-K34561361			CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H33N5O5S/c1-6-7-8-9-19-10-20-23(25-11-19)34-21(17(2)12-29(24(20)31)18(3)15-30)13-28(5)35(32,33)22-14-27(4)16-26-22/h10-11,14,16-18,21,30H,6-7,12-13,15H2,1-5H3/t17-,18+,21-/m1/s1	YVOLCZAPMPCUFP-LVCYWYKZSA-N	503.220239896							106378
BRD-K15019832	LSM-17738		54619660	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19+,23+/m1/s1	ATGVLJGFQJXEPR-MSYCTHLASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc3cccnc3	BroadT	BRD-K15019832	BRD-K15019832-001-01-0	Broad Institute of MIT and Harvard	BRD-K15019832			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C26H33N5O4/c1-18-14-31(19(2)17-32)26(34)22-11-21(9-8-20-7-6-10-27-12-20)13-28-25(22)35-23(18)15-30(5)24(33)16-29(3)4/h6-7,10-13,18-19,23,32H,14-17H2,1-5H3/t18-,19+,23+/m1/s1	ATGVLJGFQJXEPR-MSYCTHLASA-N	479.253254586							106379
BRD-K95479169	LSM-17739		54619747	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17+,21+/m0/s1	FYPIPCFJMPJNQJ-CSODHUTKSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K95479169	BRD-K95479169-001-01-2	Broad Institute of MIT and Harvard	BRD-K95479169			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17+,21+/m0/s1	FYPIPCFJMPJNQJ-CSODHUTKSA-N	444.273655672							106380
BRD-K69269415	LSM-43759		54619614	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17+,21+/m1/s1	NLMWZCLTQNAKQL-RXTVBCQOSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K69269415	BRD-K69269415-001-01-1	Broad Institute of MIT and Harvard	BRD-K69269415			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C23H30N4O5S/c1-5-6-18-7-8-22-20(11-18)32-21(14-26(4)23(29)19-12-24-9-10-25-19)16(2)13-27(17(3)15-28)33(22,30)31/h5-12,16-17,21,28H,13-15H2,1-4H3/b6-5+/t16-,17+,21+/m1/s1	NLMWZCLTQNAKQL-RXTVBCQOSA-N	474.19369079							
BRD-K52335877	LSM-17741		54619781	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17-,22-/m0/s1	OSFPASGWEYOZJM-HOIFWPIMSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K52335877	BRD-K52335877-001-01-0	Broad Institute of MIT and Harvard	BRD-K52335877			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C25H33FN4O4/c1-5-10-27-25(33)29(4)14-22-16(2)13-30(17(3)15-31)24(32)20-11-18(12-28-23(20)34-22)19-8-6-7-9-21(19)26/h6-9,11-12,16-17,22,31H,5,10,13-15H2,1-4H3,(H,27,33)/t16-,17-,22-/m0/s1	OSFPASGWEYOZJM-HOIFWPIMSA-N	472.248583776							106382
BRD-K18235559	LSM-17742		54619625	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21-,26-/m0/s1	MIBYCFWLJSOUAV-WOVHNISZSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K18235559	BRD-K18235559-001-01-0	Broad Institute of MIT and Harvard	BRD-K18235559			CCCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O7S2/c1-6-7-8-10-22-13-14-27-25(15-22)36-26(20(2)17-29(21(3)19-30)38(27,33)34)18-28(4)37(31,32)24-12-9-11-23(16-24)35-5/h9,11-16,20-21,26,30H,6-7,17-19H2,1-5H3/t20-,21-,26-/m0/s1	MIBYCFWLJSOUAV-WOVHNISZSA-N	564.196392892							106383
BRD-K35122752	LSM-17743		54619810	InChI=1S/C22H31N3O4/c1-15-13-25(16(2)14-26)21(27)18-10-17(6-9-22(28)7-4-5-8-22)11-24-20(18)29-19(15)12-23-3/h10-11,15-16,19,23,26,28H,4-5,7-8,12-14H2,1-3H3/t15-,16+,19+/m0/s1	RMBUYXDJUXDIKM-FRQCXROJSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K35122752	BRD-K35122752-001-01-4	Broad Institute of MIT and Harvard	BRD-K35122752			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H31N3O4/c1-15-13-25(16(2)14-26)21(27)18-10-17(6-9-22(28)7-4-5-8-22)11-24-20(18)29-19(15)12-23-3/h10-11,15-16,19,23,26,28H,4-5,7-8,12-14H2,1-3H3/t15-,16+,19+/m0/s1	RMBUYXDJUXDIKM-FRQCXROJSA-N	401.231456502							106384
BRD-K06698399	LSM-17744		54619798	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19+,25+/m0/s1	IPGCYDACBMVSLM-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K06698399	BRD-K06698399-001-01-7	Broad Institute of MIT and Harvard	BRD-K06698399			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H36FN3O4/c1-18-14-31(19(2)17-32)27(33)24-12-22(21-5-4-6-23(28)11-21)13-29-26(24)35-25(18)16-30(3)15-20-7-9-34-10-8-20/h4-6,11-13,18-20,25,32H,7-10,14-17H2,1-3H3/t18-,19+,25+/m0/s1	IPGCYDACBMVSLM-OSWQYVSFSA-N	485.268984862							106385
BRD-K10541973	LSM-17745		54619857	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17+,21+/m1/s1	FYPIPCFJMPJNQJ-WWMYMODYSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K10541973	BRD-K10541973-001-01-7	Broad Institute of MIT and Harvard	BRD-K10541973			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C24H36N4O4/c1-5-10-25-24(31)27(4)14-21-16(2)13-28(17(3)15-29)23(30)20-11-19(12-26-22(20)32-21)18-8-6-7-9-18/h8,11-12,16-17,21,29H,5-7,9-10,13-15H2,1-4H3,(H,25,31)/t16-,17+,21+/m1/s1	FYPIPCFJMPJNQJ-WWMYMODYSA-N	444.273655672							106386
BRD-K64268886	LSM-17746		54619786	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20+,25+/m1/s1	XPLVEXAVWRQRFN-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cncnc2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K64268886	BRD-K64268886-001-01-8	Broad Institute of MIT and Harvard	BRD-K64268886			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cncnc2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20+,25+/m1/s1	XPLVEXAVWRQRFN-RNHFSVANSA-N	475.258339966							106387
BRD-K08806664	LSM-17747		54619776	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21-,25-/m1/s1	RCWBPICPBWJXDU-DNRQZRRGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K08806664	BRD-K08806664-001-01-2	Broad Institute of MIT and Harvard	BRD-K08806664			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C28H36N4O4/c1-20-17-32(21(2)19-33)28(35)24-14-23(12-9-13-30(3)4)16-29-27(24)36-25(20)18-31(5)26(34)15-22-10-7-6-8-11-22/h6-8,10-11,14,16,20-21,25,33H,13,15,17-19H2,1-5H3/t20-,21-,25-/m1/s1	RCWBPICPBWJXDU-DNRQZRRGSA-N	492.273655672							106388
BRD-K72647169	LSM-17748		54619610	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10-,13-/m0/s1	WOUSVQRWYFHTGE-KWBADKCTSA-N	CNC[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K72647169	BRD-K72647169-001-01-1	Broad Institute of MIT and Harvard	BRD-K72647169			CNC[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C15H22BrN3O3/c1-9-7-19(10(2)8-20)15(21)12-4-11(16)5-18-14(12)22-13(9)6-17-3/h4-5,9-10,13,17,20H,6-8H2,1-3H3/t9-,10-,13-/m0/s1	WOUSVQRWYFHTGE-KWBADKCTSA-N	371.084454194							106389
BRD-K92239253	LSM-17749		54619753	InChI=1S/C22H31N3O4/c1-15-13-25(16(2)14-26)21(27)18-10-17(6-9-22(28)7-4-5-8-22)11-24-20(18)29-19(15)12-23-3/h10-11,15-16,19,23,26,28H,4-5,7-8,12-14H2,1-3H3/t15-,16+,19-/m0/s1	RMBUYXDJUXDIKM-FCEWJHQRSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K92239253	BRD-K92239253-001-01-0	Broad Institute of MIT and Harvard	BRD-K92239253			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H31N3O4/c1-15-13-25(16(2)14-26)21(27)18-10-17(6-9-22(28)7-4-5-8-22)11-24-20(18)29-19(15)12-23-3/h10-11,15-16,19,23,26,28H,4-5,7-8,12-14H2,1-3H3/t15-,16+,19-/m0/s1	RMBUYXDJUXDIKM-FCEWJHQRSA-N	401.231456502							106390
CHEMBL2355169	LSM-17750	BRD-K75595810, SID131414997	54619839	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21+,26-/m1/s1	ULJKHWQRDIVXQP-YZIHRLCOSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K75595810	BRD-K75595810-001-01-2	Broad Institute of MIT and Harvard	BRD-K75595810			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H35FN2O6S2/c1-19(2)7-6-8-22-9-14-27-25(15-22)36-26(20(3)16-30(21(4)18-31)38(27,34)35)17-29(5)37(32,33)24-12-10-23(28)11-13-24/h9-15,19-21,26,31H,7,16-18H2,1-5H3/t20-,21+,26-/m1/s1	ULJKHWQRDIVXQP-YZIHRLCOSA-N	566.19205644							106391
MLS003130143	LSM-17751	BRD-K79119882, SID99358792	46903541	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21+,26+/m0/s1	HHBQEZHNSWTNJC-LZCXECNNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cncnc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K79119882	BRD-K79119882-001-02-8	Broad Institute of MIT and Harvard	BRD-K79119882			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cncnc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H34N4O4S/c1-19-5-7-23(8-6-19)24-9-10-27-25(11-24)35-26(16-30(4)15-22-12-28-18-29-13-22)20(2)14-31(21(3)17-32)36(27,33)34/h5-13,18,20-21,26,32H,14-17H2,1-4H3/t20-,21+,26+/m0/s1	HHBQEZHNSWTNJC-LZCXECNNSA-N	510.230076298							106392
BRD-K19652835	LSM-17752		54619751	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13-,17-/m1/s1	QHGLBWHFCGZTIC-PBFPGSCMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K19652835	BRD-K19652835-001-01-1	Broad Institute of MIT and Harvard	BRD-K19652835			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C19H27BrN2O5S/c1-12-9-22(13(2)11-23)28(25,26)18-7-6-15(20)8-16(18)27-17(12)10-21(3)19(24)14-4-5-14/h6-8,12-14,17,23H,4-5,9-11H2,1-3H3/t12-,13-,17-/m1/s1	QHGLBWHFCGZTIC-PBFPGSCMSA-N	474.082405274							106393
CHEMBL2133972	LSM-17753	BRD-K87602457, SID131414959	54619803	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21+,29-/m0/s1	JDSMWWFCTGPOGF-FONBTEPMSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccccc5F	BroadT	BRD-K87602457	BRD-K87602457-001-01-0	Broad Institute of MIT and Harvard	BRD-K87602457			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C31H31FN2O7S/c1-20-16-34(21(2)18-35)42(37,38)30-13-9-22(8-10-23-6-4-5-7-25(23)32)14-28(30)41-29(20)17-33(3)31(36)24-11-12-26-27(15-24)40-19-39-26/h4-7,9,11-15,20-21,29,35H,16-19H2,1-3H3/t20-,21+,29-/m0/s1	JDSMWWFCTGPOGF-FONBTEPMSA-N	594.183600242							106394
BRD-K63761383	LSM-17754		54619805	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19+,23+/m1/s1	LMEKMJWGWXFVOU-MSYCTHLASA-N	COCC#Cc1cnc2O[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K63761383	BRD-K63761383-001-01-1	Broad Institute of MIT and Harvard	BRD-K63761383			COCC#Cc1cnc2O[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H37N3O5/c1-18-15-29(19(2)17-30)26(32)22-13-20(9-8-12-33-4)14-27-24(22)34-23(18)16-28(3)25(31)21-10-6-5-7-11-21/h13-14,18-19,21,23,30H,5-7,10-12,15-17H2,1-4H3/t18-,19+,23+/m1/s1	LMEKMJWGWXFVOU-MSYCTHLASA-N	471.273321314							106395
BRD-K96057608	LSM-17755		44484541	InChI=1S/C26H30N4O4/c1-17-14-30(18(2)16-31)25(32)21-11-7-13-27-24(21)34-23(17)15-29(3)26(33)28-22-12-6-9-19-8-4-5-10-20(19)22/h4-13,17-18,23,31H,14-16H2,1-3H3,(H,28,33)/t17-,18+,23-/m0/s1	OJHFPOQTTGIILZ-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ncccc4C1=O	BroadT	BRD-K96057608	BRD-K96057608-001-01-4	Broad Institute of MIT and Harvard	BRD-K96057608			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ncccc2C1=O	InChI=1S/C26H30N4O4/c1-17-14-30(18(2)16-31)25(32)21-11-7-13-27-24(21)34-23(17)15-29(3)26(33)28-22-12-6-9-19-8-4-5-10-20(19)22/h4-13,17-18,23,31H,14-16H2,1-3H3,(H,28,33)/t17-,18+,23-/m0/s1	OJHFPOQTTGIILZ-IXFSTUDKSA-N	462.22670548							106396
MLS003128927	LSM-17756	BRD-K28512751, SID99359362	46903926	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12+,15-/m1/s1	SBYAEQQHLNEWQQ-TYNCELHUSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K28512751	BRD-K28512751-001-02-4	Broad Institute of MIT and Harvard	BRD-K28512751			COCC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C18H26BrN3O5/c1-11-7-22(12(2)9-23)18(25)14-5-13(19)6-20-17(14)27-15(11)8-21(3)16(24)10-26-4/h5-6,11-12,15,23H,7-10H2,1-4H3/t11-,12+,15-/m1/s1	SBYAEQQHLNEWQQ-TYNCELHUSA-N	443.105583562							106397
BRD-K05686172	LSM-6936		54618351	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22-,27-/m1/s1	UFPGTWMRZCUHBI-VHFRWLAGSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C#CC4(O)CCCC4)c1	BroadT	BRD-K05686172	BRD-K05686172-001-01-6	Broad Institute of MIT and Harvard	BRD-K05686172			COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C#CC2(O)CCCC2)c1	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22-,27-/m1/s1	UFPGTWMRZCUHBI-VHFRWLAGSA-N	585.250871308							95557
CHEMBL2356334	LSM-7293	BRD-K34666250, SID131413378	54618293	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23+,29-/m1/s1	AWBBMFXXCINDIY-RLPNJSHFSA-N	COc1ccccc1C#Cc2ccc3c(O[C@H](CN(C)Cc4cccnc4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K34666250	BRD-K34666250-001-01-8	Broad Institute of MIT and Harvard	BRD-K34666250			COc1ccccc1C#Cc1ccc2c(O[C@H](CN(C)Cc3cccnc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23+,29-/m1/s1	AWBBMFXXCINDIY-RLPNJSHFSA-N	549.22974194							95914
CHEMBL2359909	LSM-8080	BRD-K97217923, SID131413446	54618357	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20-,27-/m1/s1	ZBKDHRFNQBVZSS-SEXOINJZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C5=CCCCC5	BroadT	BRD-K97217923	BRD-K97217923-001-01-1	Broad Institute of MIT and Harvard	BRD-K97217923			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20-,27-/m1/s1	ZBKDHRFNQBVZSS-SEXOINJZSA-N	571.235221244							96701
BRD-K59539129	LSM-7635		54618219	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21-,27+/m1/s1	FWJMPRMSYCMNDB-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K59539129	BRD-K59539129-001-01-6	Broad Institute of MIT and Harvard	BRD-K59539129			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21-,27+/m1/s1	FWJMPRMSYCMNDB-GNMOFYLKSA-N	557.235970172							96256
BRD-K54278059	LSM-7555		54618269	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21+,27-/m1/s1	FWJMPRMSYCMNDB-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K54278059	BRD-K54278059-001-01-0	Broad Institute of MIT and Harvard	BRD-K54278059			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21+,27-/m1/s1	FWJMPRMSYCMNDB-PBDKAQRYSA-N	557.235970172							96176
BRD-K14396276	LSM-7045		54618105	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17-,23-/m1/s1	SYMAGNSCDPNOSH-SEPYTNNBSA-N	COCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K14396276	BRD-K14396276-001-01-6	Broad Institute of MIT and Harvard	BRD-K14396276			COCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17-,23-/m1/s1	SYMAGNSCDPNOSH-SEPYTNNBSA-N	516.2184265							95666
BRD-K51502980	LSM-7510		54618170	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18-,21+/m0/s1	VEFOSOMUCSIFLK-TWFHAPMSSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#C[C@H](C)O	BroadT	BRD-K51502980	BRD-K51502980-001-01-0	Broad Institute of MIT and Harvard	BRD-K51502980			CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#C[C@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18-,21+/m0/s1	VEFOSOMUCSIFLK-TWFHAPMSSA-N	481.22465656							96131
MLS003130128	LSM-7325	BRD-K37226353, SID99358779	46903528	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20-,26+/m1/s1	HDWGWTYDTDHGLT-KYTVRQNUSA-N	COc1cccc(c1)c2ccc3c(O[C@@H](CN(C)C(=O)C4CCOCC4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K37226353	BRD-K37226353-001-02-2	Broad Institute of MIT and Harvard	BRD-K37226353			COc1cccc(c1)-c1ccc2c(O[C@@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20-,26+/m1/s1	HDWGWTYDTDHGLT-KYTVRQNUSA-N	546.239972266							95946
BRD-K92208021	LSM-8019		54618231	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20-,25+/m0/s1	NHORSMPXTAJMFN-ZYLNGJIFSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K92208021	BRD-K92208021-001-01-6	Broad Institute of MIT and Harvard	BRD-K92208021			COCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20-,25+/m0/s1	NHORSMPXTAJMFN-ZYLNGJIFSA-N	566.175657448							96640
BRD-K79932545	LSM-7893		54618262	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17+,21+/m1/s1	NMUQMAVVZJKKCB-WWMYMODYSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3cncnc3	BroadT	BRD-K79932545	BRD-K79932545-001-01-5	Broad Institute of MIT and Harvard	BRD-K79932545			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cncnc1	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17+,21+/m1/s1	NMUQMAVVZJKKCB-WWMYMODYSA-N	491.220239896							96514
BRD-K12163240	LSM-7006		54618288	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19-,25+/m0/s1	UPQGSBDKNNCSHF-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2F)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K12163240	BRD-K12163240-001-01-5	Broad Institute of MIT and Harvard	BRD-K12163240			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2F)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19-,25+/m0/s1	UPQGSBDKNNCSHF-XHNVNVPESA-N	467.258420178							95627
MLS003130107	LSM-7701	BRD-K63807676, SID99358686	46903465	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20+,26+/m0/s1	ZNOUXTLFAUQIIE-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K63807676	BRD-K63807676-001-02-6	Broad Institute of MIT and Harvard	BRD-K63807676			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20+,26+/m0/s1	ZNOUXTLFAUQIIE-OUDXUNEISA-N	485.242689902							96322
BRD-K60820896	LSM-7658		54618203	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22-,28+/m0/s1	VHCZRFPKNWPULV-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K60820896	BRD-K60820896-001-01-8	Broad Institute of MIT and Harvard	BRD-K60820896			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22-,28+/m0/s1	VHCZRFPKNWPULV-RXYILKCJSA-N	552.229407582							96279
BRD-K70055050	LSM-7788		54618191	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20+,25+/m1/s1	NHORSMPXTAJMFN-RNHFSVANSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K70055050	BRD-K70055050-001-01-1	Broad Institute of MIT and Harvard	BRD-K70055050			COCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20+,25+/m1/s1	NHORSMPXTAJMFN-RNHFSVANSA-N	566.175657448							96409
CHEMBL2356784	LSM-7595	BRD-K56634255, SID131413392	54618307	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23-,29-/m1/s1	AWBBMFXXCINDIY-VDWGHMIBSA-N	COc1ccccc1C#Cc2ccc3c(O[C@H](CN(C)Cc4cccnc4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K56634255	BRD-K56634255-001-01-4	Broad Institute of MIT and Harvard	BRD-K56634255			COc1ccccc1C#Cc1ccc2c(O[C@H](CN(C)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23-,29-/m1/s1	AWBBMFXXCINDIY-VDWGHMIBSA-N	549.22974194							96216
MLS003130278	LSM-8071	BRD-K95500387, SID99359064	46903714	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20+,25-/m1/s1	GCPZFZZKEDFKSA-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K95500387	BRD-K95500387-001-02-9	Broad Institute of MIT and Harvard	BRD-K95500387			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20+,25-/m1/s1	GCPZFZZKEDFKSA-OHUGHZGNSA-N	500.234492962							96692
BRD-K48816779	LSM-43404		54618111	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18+,23-/m0/s1	FNIHZEFWPVWWQI-UHFRQCOTSA-N	C\C=C\c1cnc2O[C@@H](CN(C)Cc3cccc(c3)C(=O)O)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K48816779	BRD-K48816779-001-01-5	Broad Institute of MIT and Harvard	BRD-K48816779			C\C=C\c1cnc2O[C@@H](CN(C)Cc3cccc(c3)C(O)=O)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18+,23-/m0/s1	FNIHZEFWPVWWQI-UHFRQCOTSA-N	467.242021186							
BRD-K96198015	LSM-8076		54618165	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20-,24-/m0/s1	ALBVOUUIQWHTKA-SKPFHBQLSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K96198015	BRD-K96198015-001-01-3	Broad Institute of MIT and Harvard	BRD-K96198015			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20-,24-/m0/s1	ALBVOUUIQWHTKA-SKPFHBQLSA-N	514.224990918							96697
CHEMBL2135490	LSM-8293	SID131413479, BRD-K60865324	54618390	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20-,25+/m1/s1	UEIRNIQKIBOUIF-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K60865324	BRD-K60865324-001-01-5	Broad Institute of MIT and Harvard	BRD-K60865324			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20-,25+/m1/s1	UEIRNIQKIBOUIF-FHAGJXEFSA-N	485.23482732							96914
BRD-K37813153	LSM-7335		54618249	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22-,28+/m1/s1	VHCZRFPKNWPULV-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K37813153	BRD-K37813153-001-01-1	Broad Institute of MIT and Harvard	BRD-K37813153			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22-,28+/m1/s1	VHCZRFPKNWPULV-XJGOYTCSSA-N	552.229407582							95956
BRD-K19554975	LSM-43374		54618381	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16+,19+/m1/s1	KGPKEHLIXQTDQP-XUKWKHDPSA-N	C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K19554975	BRD-K19554975-001-01-9	Broad Institute of MIT and Harvard	BRD-K19554975			C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16+,19+/m1/s1	KGPKEHLIXQTDQP-XUKWKHDPSA-N	477.204589832							
CHEMBL2356547	LSM-8092	BRD-K98833727, SID131413405	54618318	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20+,26+/m0/s1	DYHTZISNAWRTSH-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3cc(ccc3S1(=O)=O)C#CCC4CCCC4	BroadT	BRD-K98833727	BRD-K98833727-001-01-2	Broad Institute of MIT and Harvard	BRD-K98833727			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2cc(ccc2S1(=O)=O)C#CCC1CCCC1	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20+,26+/m0/s1	DYHTZISNAWRTSH-OUDXUNEISA-N	572.26685573							96713
CHEMBL2143863	LSM-6878	SID131413307, BRD-K01463627	54618223	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23-,29+/m0/s1	AWBBMFXXCINDIY-SBZVUBOMSA-N	COc1ccccc1C#Cc2ccc3c(O[C@H](CN(C)Cc4cccnc4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K01463627	BRD-K01463627-001-01-5	Broad Institute of MIT and Harvard	BRD-K01463627			COc1ccccc1C#Cc1ccc2c(O[C@H](CN(C)Cc3cccnc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23-,29+/m0/s1	AWBBMFXXCINDIY-SBZVUBOMSA-N	549.22974194							95499
BRD-K99514625	LSM-8098		54618278	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20-,24-/m1/s1	ALBVOUUIQWHTKA-YOSAUDMPSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K99514625	BRD-K99514625-001-01-0	Broad Institute of MIT and Harvard	BRD-K99514625			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20-,24-/m1/s1	ALBVOUUIQWHTKA-YOSAUDMPSA-N	514.224990918							96719
CHEMBL2359657	LSM-8240	BRD-K43782664, SID131413419	54618330	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23-,29+/m1/s1	AWBBMFXXCINDIY-SGQNLQFHSA-N	COc1ccccc1C#Cc2ccc3c(O[C@@H](CN(C)Cc4cccnc4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K43782664	BRD-K43782664-001-01-2	Broad Institute of MIT and Harvard	BRD-K43782664			COc1ccccc1C#Cc1ccc2c(O[C@@H](CN(C)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23-,29+/m1/s1	AWBBMFXXCINDIY-SGQNLQFHSA-N	549.22974194							96861
BRD-K25344230	LSM-7171		54618176	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22-,27+/m1/s1	UFPGTWMRZCUHBI-LOYIFYEOSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C#CC4(O)CCCC4)c1	BroadT	BRD-K25344230	BRD-K25344230-001-01-8	Broad Institute of MIT and Harvard	BRD-K25344230			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C#CC2(O)CCCC2)c1	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22-,27+/m1/s1	UFPGTWMRZCUHBI-LOYIFYEOSA-N	585.250871308							95792
CHEMBL2137429	LSM-7427	BRD-K45699165, SID131413451	54618362	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20+,26-/m1/s1	HDWGWTYDTDHGLT-BVFVYWQFSA-N	COc1cccc(c1)c2ccc3c(O[C@H](CN(C)C(=O)C4CCOCC4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K45699165	BRD-K45699165-001-01-0	Broad Institute of MIT and Harvard	BRD-K45699165			COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20+,26-/m1/s1	HDWGWTYDTDHGLT-BVFVYWQFSA-N	546.239972266							96048
BRD-K08828851	LSM-43363		54618284	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16-,19-/m0/s1	KGPKEHLIXQTDQP-LSDLTWGLSA-N	C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K08828851	BRD-K08828851-001-01-9	Broad Institute of MIT and Harvard	BRD-K08828851			C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16-,19-/m0/s1	KGPKEHLIXQTDQP-LSDLTWGLSA-N	477.204589832							
BRD-K57169040	LSM-7603		54618316	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19-,27+/m0/s1	KZMWOMHQUKXWRI-RWYJCYHVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K57169040	BRD-K57169040-001-01-0	Broad Institute of MIT and Harvard	BRD-K57169040			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19-,27+/m0/s1	KZMWOMHQUKXWRI-RWYJCYHVSA-N	584.19049719							96224
BRD-K78978845	LSM-7885		54618125	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22-,25-/m1/s1	VKSOWNIUNHUMMN-TZBSWOFLSA-N	CCCC#Cc1cnc2O[C@H](CN(C)C(=O)CCN3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K78978845	BRD-K78978845-001-01-6	Broad Institute of MIT and Harvard	BRD-K78978845			CCCC#Cc1cnc2O[C@H](CN(C)C(=O)CCN3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22-,25-/m1/s1	VKSOWNIUNHUMMN-TZBSWOFLSA-N	498.320605864							96506
BRD-K98611274	LSM-8090		54618168	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20-,26+/m0/s1	DYHTZISNAWRTSH-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3cc(ccc3S1(=O)=O)C#CCC4CCCC4	BroadT	BRD-K98611274	BRD-K98611274-001-01-9	Broad Institute of MIT and Harvard	BRD-K98611274			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2cc(ccc2S1(=O)=O)C#CCC1CCCC1	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20-,26+/m0/s1	DYHTZISNAWRTSH-CUVVAGTFSA-N	572.26685573							96711
BRD-K73282213	LSM-7810		54618215	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17+,23-/m1/s1	SYMAGNSCDPNOSH-SAHWJRBASA-N	COCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K73282213	BRD-K73282213-001-01-2	Broad Institute of MIT and Harvard	BRD-K73282213			COCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17+,23-/m1/s1	SYMAGNSCDPNOSH-SAHWJRBASA-N	516.2184265							96431
BRD-K63870957	LSM-7702		54618275	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20+,27+/m0/s1	ZBKDHRFNQBVZSS-ASHZAFPQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C5=CCCCC5	BroadT	BRD-K63870957	BRD-K63870957-001-01-6	Broad Institute of MIT and Harvard	BRD-K63870957			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20+,27+/m0/s1	ZBKDHRFNQBVZSS-ASHZAFPQSA-N	571.235221244							96323
BRD-K51234905	LSM-7507		54618104	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17+,23+/m1/s1	YCBIAWRDDHRJGU-DGGJZMOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K51234905	BRD-K51234905-001-01-2	Broad Institute of MIT and Harvard	BRD-K51234905			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17+,23+/m1/s1	YCBIAWRDDHRJGU-DGGJZMOXSA-N	493.212532626							96128
CHEMBL2132580	LSM-7122	BRD-K20875709, SID131413199	54618126	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20+,24-/m1/s1	ALBVOUUIQWHTKA-JXALWOEJSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K20875709	BRD-K20875709-001-01-8	Broad Institute of MIT and Harvard	BRD-K20875709			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20+,24-/m1/s1	ALBVOUUIQWHTKA-JXALWOEJSA-N	514.224990918							95743
BRD-K94789179	LSM-8061		54618356	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20+,25+/m0/s1	DFIFSWMEHHNDQD-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C#CC(C)(C)O	BroadT	BRD-K94789179	BRD-K94789179-001-01-3	Broad Institute of MIT and Harvard	BRD-K94789179			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C#CC(C)(C)O	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20+,25+/m0/s1	DFIFSWMEHHNDQD-WZOHSFFVSA-N	518.22507113							96682
BRD-K35174435	LSM-7299		54618295	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19-,22-/m0/s1	MFJAJISBYJYJML-IPJJNNNSSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K35174435	BRD-K35174435-001-01-0	Broad Institute of MIT and Harvard	BRD-K35174435			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19-,22-/m0/s1	MFJAJISBYJYJML-IPJJNNNSSA-N	538.191976228							95920
BRD-K98832554	LSM-8091		44489824	InChI=1S/C23H28F3N3O3/c1-15-11-29(16(2)14-30)22(31)19-8-5-9-27-21(19)32-20(15)13-28(3)12-17-6-4-7-18(10-17)23(24,25)26/h4-10,15-16,20,30H,11-14H2,1-3H3/t15-,16+,20-/m0/s1	XBEPEKYUPLRUNJ-YRNRMSPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)Oc3ncccc3C1=O	BroadT	BRD-K98832554	BRD-K98832554-001-01-2	Broad Institute of MIT and Harvard	BRD-K98832554			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)Oc2ncccc2C1=O	InChI=1S/C23H28F3N3O3/c1-15-11-29(16(2)14-30)22(31)19-8-5-9-27-21(19)32-20(15)13-28(3)12-17-6-4-7-18(10-17)23(24,25)26/h4-10,15-16,20,30H,11-14H2,1-3H3/t15-,16+,20-/m0/s1	XBEPEKYUPLRUNJ-YRNRMSPPSA-N	451.208276386							96712
CHEMBL2356931	LSM-7082	BRD-K17965071, SID131413365	54618281	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18+,22+/m1/s1	KCOGFDLBSVUITM-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K17965071	BRD-K17965071-001-01-2	Broad Institute of MIT and Harvard	BRD-K17965071			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18+,22+/m1/s1	KCOGFDLBSVUITM-FGSXEWAUSA-N	498.259068248							95703
BRD-K89137409	LSM-7990		54618185	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20+,26-/m0/s1	ZNOUXTLFAUQIIE-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K89137409	BRD-K89137409-001-01-4	Broad Institute of MIT and Harvard	BRD-K89137409			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20+,26-/m0/s1	ZNOUXTLFAUQIIE-UNVFRBQDSA-N	485.242689902							96611
CHEMBL2141669	LSM-7311	BRD-K36156445, SID131413214	54618141	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19-,26-/m0/s1	KJZOGGIMPWHLRO-DGUDUIIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K36156445	BRD-K36156445-001-01-4	Broad Institute of MIT and Harvard	BRD-K36156445			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19-,26-/m0/s1	KJZOGGIMPWHLRO-DGUDUIIESA-N	581.22498909							95932
CHEMBL3188602	LSM-7651	BRD-K60527064	54618205	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23+,29+/m1/s1	AWBBMFXXCINDIY-AFKLWXAFSA-N	COc1ccccc1C#Cc2ccc3c(O[C@@H](CN(C)Cc4cccnc4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K60527064	BRD-K60527064-001-01-5	Broad Institute of MIT and Harvard	BRD-K60527064			COc1ccccc1C#Cc1ccc2c(O[C@@H](CN(C)Cc3cccnc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23+,29+/m1/s1	AWBBMFXXCINDIY-AFKLWXAFSA-N	549.22974194							96272
BRD-K56051237	LSM-7588		54618124	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20+,25+/m0/s1	NHORSMPXTAJMFN-WZOHSFFVSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K56051237	BRD-K56051237-001-01-4	Broad Institute of MIT and Harvard	BRD-K56051237			COCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20+,25+/m0/s1	NHORSMPXTAJMFN-WZOHSFFVSA-N	566.175657448							96209
MLS003129023	LSM-7646	BRD-K60143275, SID99359633	46904195	InChI=1S/C23H29BrN2O6S/c1-15-10-26(16(2)13-27)33(28,29)23-7-5-18(24)9-21(23)32-22(15)12-25(3)11-17-4-6-19-20(8-17)31-14-30-19/h4-9,15-16,22,27H,10-14H2,1-3H3/t15-,16+,22+/m0/s1	WSJCKGXDVCNJDF-WJONJSRFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4cc(Br)ccc4S1(=O)=O	BroadT	BRD-K60143275	BRD-K60143275-001-01-6	Broad Institute of MIT and Harvard	BRD-K60143275			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C23H29BrN2O6S/c1-15-10-26(16(2)13-27)33(28,29)23-7-5-18(24)9-21(23)32-22(15)12-25(3)11-17-4-6-19-20(8-17)31-14-30-19/h4-9,15-16,22,27H,10-14H2,1-3H3/t15-,16+,22+/m0/s1	WSJCKGXDVCNJDF-WJONJSRFSA-N	540.092969958							96267
BRD-K39068840	LSM-7348		54618270	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20+,26-/m0/s1	ZKVMCHGVVVSISB-UNVFRBQDSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)C(=O)c4cccnc4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K39068840	BRD-K39068840-001-01-9	Broad Institute of MIT and Harvard	BRD-K39068840			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20+,26-/m0/s1	ZKVMCHGVVVSISB-UNVFRBQDSA-N	539.209006496							95969
BRD-K63484613	LSM-7697		54618312	InChI=1S/C23H30N4O5/c1-15-12-27(16(2)14-28)22(29)19-6-5-11-24-21(19)32-20(15)13-26(3)23(30)25-17-7-9-18(31-4)10-8-17/h5-11,15-16,20,28H,12-14H2,1-4H3,(H,25,30)/t15-,16+,20-/m0/s1	DYLUPURRUAZIFP-YRNRMSPPSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ncccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K63484613	BRD-K63484613-001-01-2	Broad Institute of MIT and Harvard	BRD-K63484613			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ncccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C23H30N4O5/c1-15-12-27(16(2)14-28)22(29)19-6-5-11-24-21(19)32-20(15)13-26(3)23(30)25-17-7-9-18(31-4)10-8-17/h5-11,15-16,20,28H,12-14H2,1-4H3,(H,25,30)/t15-,16+,20-/m0/s1	DYLUPURRUAZIFP-YRNRMSPPSA-N	442.2216201							96318
BRD-K28480589	LSM-7214		44496843	InChI=1S/C29H32FN3O5/c1-18-13-33(19(2)16-34)29(35)24-11-22(21-5-7-23(30)8-6-21)12-31-28(24)38-27(18)15-32(3)14-20-4-9-25-26(10-20)37-17-36-25/h4-12,18-19,27,34H,13-17H2,1-3H3/t18-,19+,27-/m0/s1	PFISLOLGZUKACY-CUMRGQLISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ncc(cc4C1=O)c5ccc(F)cc5	BroadT	BRD-K28480589	BRD-K28480589-001-01-4	Broad Institute of MIT and Harvard	BRD-K28480589			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ncc(cc2C1=O)-c1ccc(F)cc1	InChI=1S/C29H32FN3O5/c1-18-13-33(19(2)16-34)29(35)24-11-22(21-5-7-23(30)8-6-21)12-31-28(24)38-27(18)15-32(3)14-20-4-9-25-26(10-20)37-17-36-25/h4-12,18-19,27,34H,13-17H2,1-3H3/t18-,19+,27-/m0/s1	PFISLOLGZUKACY-CUMRGQLISA-N	521.232599354							95835
MLS003130120	LSM-7963	SID99358771, BRD-K86986466	46903520	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18+,22+/m0/s1	KCOGFDLBSVUITM-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K86986466	BRD-K86986466-001-02-5	Broad Institute of MIT and Harvard	BRD-K86986466			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18+,22+/m0/s1	KCOGFDLBSVUITM-NJNPRVFISA-N	498.259068248							96584
BRD-K65313110	LSM-7718		54618358	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19-,25+/m1/s1	VIOYSSVCFLGZJY-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CC4CC4	BroadT	BRD-K65313110	BRD-K65313110-001-01-9	Broad Institute of MIT and Harvard	BRD-K65313110			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19-,25+/m1/s1	VIOYSSVCFLGZJY-RRQZXNHTSA-N	514.193771002							96339
CHEMBL2134979	LSM-7410	BRD-K44422244, SID131413257	54618181	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21+,27+/m1/s1	FWJMPRMSYCMNDB-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K44422244	BRD-K44422244-001-01-3	Broad Institute of MIT and Harvard	BRD-K44422244			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21+,27+/m1/s1	FWJMPRMSYCMNDB-BUEREQSYSA-N	557.235970172							96031
BRD-K92841908	LSM-8030		54618379	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17+,23+/m1/s1	SYMAGNSCDPNOSH-DGGJZMOXSA-N	COCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K92841908	BRD-K92841908-001-01-2	Broad Institute of MIT and Harvard	BRD-K92841908			COCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17+,23+/m1/s1	SYMAGNSCDPNOSH-DGGJZMOXSA-N	516.2184265							96651
BRD-K47123716	LSM-7448		54618123	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20+,24-/m1/s1	FLFHXFOLABGIIH-JXALWOEJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K47123716	BRD-K47123716-001-01-3	Broad Institute of MIT and Harvard	BRD-K47123716			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20+,24-/m1/s1	FLFHXFOLABGIIH-JXALWOEJSA-N	513.283885998							96069
BRD-K40814141	LSM-7366		54618196	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20+,26+/m1/s1	BHKYXVBLKIOFCQ-GOHWNWGWSA-N	COc1ccc(cc1)c2cnc3O[C@@H](CN(C)C(=O)C4CCCCC4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K40814141	BRD-K40814141-001-01-9	Broad Institute of MIT and Harvard	BRD-K40814141			COc1ccc(cc1)-c1cnc2O[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20+,26+/m1/s1	BHKYXVBLKIOFCQ-GOHWNWGWSA-N	509.288971378							95987
BRD-K80747759	LSM-7903		54618327	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20-,27+/m1/s1	ZBKDHRFNQBVZSS-DVHCVUMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C5=CCCCC5	BroadT	BRD-K80747759	BRD-K80747759-001-01-5	Broad Institute of MIT and Harvard	BRD-K80747759			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20-,27+/m1/s1	ZBKDHRFNQBVZSS-DVHCVUMVSA-N	571.235221244							96524
BRD-K17583574	LSM-7077		54618287	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22-,28+/m1/s1	FRFGYBSWUNYCIP-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K17583574	BRD-K17583574-001-01-5	Broad Institute of MIT and Harvard	BRD-K17583574			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22-,28+/m1/s1	FRFGYBSWUNYCIP-XJGOYTCSSA-N	565.204670044							95698
BRD-K18854347	LSM-7092		54618113	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22-,25+/m1/s1	VKSOWNIUNHUMMN-RQTOMXEWSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)CCN3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K18854347	BRD-K18854347-001-01-5	Broad Institute of MIT and Harvard	BRD-K18854347			CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)CCN3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22-,25+/m1/s1	VKSOWNIUNHUMMN-RQTOMXEWSA-N	498.320605864							95713
BRD-K52062350	LSM-7520		54618261	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20+,26-/m1/s1	ZNOUXTLFAUQIIE-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K52062350	BRD-K52062350-001-01-6	Broad Institute of MIT and Harvard	BRD-K52062350			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20+,26-/m1/s1	ZNOUXTLFAUQIIE-BVFVYWQFSA-N	485.242689902							96141
BRD-K57756744	LSM-7616		54618339	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20-,25+/m1/s1	DFIFSWMEHHNDQD-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C#CC(C)(C)O	BroadT	BRD-K57756744	BRD-K57756744-001-01-3	Broad Institute of MIT and Harvard	BRD-K57756744			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C#CC(C)(C)O	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20-,25+/m1/s1	DFIFSWMEHHNDQD-FHAGJXEFSA-N	518.22507113							96237
BRD-K48918933	LSM-7478		54618234	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20+,24+/m1/s1	ALBVOUUIQWHTKA-NMMYMHLASA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K48918933	BRD-K48918933-001-01-2	Broad Institute of MIT and Harvard	BRD-K48918933			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20+,24+/m1/s1	ALBVOUUIQWHTKA-NMMYMHLASA-N	514.224990918							96099
BRD-K35712980	LSM-7306		54618350	InChI=1S/C24H32N4O4/c1-15-13-28(16(2)14-29)24(31)20-10-19(11-26-22(20)32-21(15)12-25-3)17-7-6-8-18(9-17)23(30)27(4)5/h6-11,15-16,21,25,29H,12-14H2,1-5H3/t15-,16-,21-/m1/s1	JOFZJSROTWODFL-WHSLLNHNSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3cccc(c3)C(=O)N(C)C	BroadT	BRD-K35712980	BRD-K35712980-001-01-6	Broad Institute of MIT and Harvard	BRD-K35712980			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C24H32N4O4/c1-15-13-28(16(2)14-29)24(31)20-10-19(11-26-22(20)32-21(15)12-25-3)17-7-6-8-18(9-17)23(30)27(4)5/h6-11,15-16,21,25,29H,12-14H2,1-5H3/t15-,16-,21-/m1/s1	JOFZJSROTWODFL-WHSLLNHNSA-N	440.242355544							95927
BRD-K68690449	LSM-7767		54618134	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19+,24-/m1/s1	QHDFXKNEEFSYRF-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccncc4	BroadT	BRD-K68690449	BRD-K68690449-001-01-9	Broad Institute of MIT and Harvard	BRD-K68690449			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19+,24-/m1/s1	QHDFXKNEEFSYRF-YDIMBITNSA-N	563.15600529							96388
BRD-K99432717	LSM-8097		54618325	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18-,21+/m1/s1	VEFOSOMUCSIFLK-IKVWTGGYSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#C[C@@H](C)O	BroadT	BRD-K99432717	BRD-K99432717-001-01-4	Broad Institute of MIT and Harvard	BRD-K99432717			CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#C[C@@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18-,21+/m1/s1	VEFOSOMUCSIFLK-IKVWTGGYSA-N	481.22465656							96718
CHEMBL2139107	LSM-7275	BRD-K33348232, SID131413432	54618343	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21+,27-/m0/s1	FWJMPRMSYCMNDB-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K33348232	BRD-K33348232-001-01-7	Broad Institute of MIT and Harvard	BRD-K33348232			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21+,27-/m0/s1	FWJMPRMSYCMNDB-ISCCLHIJSA-N	557.235970172							95896
BRD-K55681368	LSM-7585		54618320	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19+,24+/m1/s1	QHDFXKNEEFSYRF-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccncc4	BroadT	BRD-K55681368	BRD-K55681368-001-01-0	Broad Institute of MIT and Harvard	BRD-K55681368			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19+,24+/m1/s1	QHDFXKNEEFSYRF-IMWIBFENSA-N	563.15600529							96206
BRD-K21000135	LSM-8161		54618369	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20-,26+/m0/s1	ZNOUXTLFAUQIIE-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K21000135	BRD-K21000135-001-01-6	Broad Institute of MIT and Harvard	BRD-K21000135			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20-,26+/m0/s1	ZNOUXTLFAUQIIE-CUVVAGTFSA-N	485.242689902							96782
BRD-K72311435-001-01-2	LSM-17757	BRD-K72311435	54618118	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19+,27+/m0/s1	KZMWOMHQUKXWRI-DSNGTPCMSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K72311435	BRD-K72311435-001-01-2	Broad Institute of MIT and Harvard	BRD-K72311435			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19+,27+/m0/s1	KZMWOMHQUKXWRI-DSNGTPCMSA-N	584.19049719							106398
BRD-K69827766	LSM-7783		54618216	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19+,26+/m0/s1	KJZOGGIMPWHLRO-GNBJCERTSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K69827766	BRD-K69827766-001-01-1	Broad Institute of MIT and Harvard	BRD-K69827766			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19+,26+/m0/s1	KJZOGGIMPWHLRO-GNBJCERTSA-N	581.22498909							96404
BRD-K39332692	LSM-7352		54618103	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17-,23-/m1/s1	YCBIAWRDDHRJGU-SEPYTNNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K39332692	BRD-K39332692-001-01-8	Broad Institute of MIT and Harvard	BRD-K39332692			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17-,23-/m1/s1	YCBIAWRDDHRJGU-SEPYTNNBSA-N	493.212532626							95973
BRD-K27224038	LSM-7189		54618359	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20-,24+/m0/s1	FLFHXFOLABGIIH-MZLICYQSSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K27224038	BRD-K27224038-001-01-4	Broad Institute of MIT and Harvard	BRD-K27224038			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20-,24+/m0/s1	FLFHXFOLABGIIH-MZLICYQSSA-N	513.283885998							95810
BRD-K38665228	LSM-7343		54618336	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20+,26-/m0/s1	DYHTZISNAWRTSH-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3cc(ccc3S1(=O)=O)C#CCC4CCCC4	BroadT	BRD-K38665228	BRD-K38665228-001-01-5	Broad Institute of MIT and Harvard	BRD-K38665228			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2cc(ccc2S1(=O)=O)C#CCC1CCCC1	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20+,26-/m0/s1	DYHTZISNAWRTSH-UNVFRBQDSA-N	572.26685573							95964
CHEMBL2140968	LSM-7892	SID131413388, BRD-K79861274	54618303	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20-,26-/m0/s1	DYHTZISNAWRTSH-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3cc(ccc3S1(=O)=O)C#CCC4CCCC4	BroadT	BRD-K79861274	BRD-K79861274-001-01-3	Broad Institute of MIT and Harvard	BRD-K79861274			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2cc(ccc2S1(=O)=O)C#CCC1CCCC1	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20-,26-/m0/s1	DYHTZISNAWRTSH-DYLHXGEVSA-N	572.26685573							96513
BRD-K53798768	LSM-7546		54618238	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20-,25-/m0/s1	NHORSMPXTAJMFN-RLSLOFABSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K53798768	BRD-K53798768-001-01-0	Broad Institute of MIT and Harvard	BRD-K53798768			COCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20-,25-/m0/s1	NHORSMPXTAJMFN-RLSLOFABSA-N	566.175657448							96167
BRD-K48775846	LSM-7475		54618367	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20+,26+/m1/s1	BVGZNQUUZDWJPB-GOHWNWGWSA-N	COc1ccccc1c2cnc3O[C@@H](CN(C)CC4CCOCC4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K48775846	BRD-K48775846-001-01-2	Broad Institute of MIT and Harvard	BRD-K48775846			COc1ccccc1-c1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20+,26+/m1/s1	BVGZNQUUZDWJPB-GOHWNWGWSA-N	497.288971378							96096
BRD-K88934376	LSM-8400		54618098	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13-,16-/m0/s1	LKDAMHONCJEZRZ-XEZPLFJOSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K88934376	BRD-K88934376-001-01-4	Broad Institute of MIT and Harvard	BRD-K88934376			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13-,16-/m0/s1	LKDAMHONCJEZRZ-XEZPLFJOSA-N	456.137218048							97021
BRD-K22325899	LSM-7138		54618130	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20-,25+/m1/s1	GCPZFZZKEDFKSA-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K22325899	BRD-K22325899-001-01-2	Broad Institute of MIT and Harvard	BRD-K22325899			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20-,25+/m1/s1	GCPZFZZKEDFKSA-FHAGJXEFSA-N	500.234492962							95759
BRD-K41970046	LSM-7379		54618199	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20-,26+/m1/s1	BHKYXVBLKIOFCQ-KYTVRQNUSA-N	COc1ccc(cc1)c2cnc3O[C@@H](CN(C)C(=O)C4CCCCC4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K41970046	BRD-K41970046-001-01-4	Broad Institute of MIT and Harvard	BRD-K41970046			COc1ccc(cc1)-c1cnc2O[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20-,26+/m1/s1	BHKYXVBLKIOFCQ-KYTVRQNUSA-N	509.288971378							96000
BRD-K78118043	LSM-7865		54618363	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19-,25-/m1/s1	UPQGSBDKNNCSHF-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2F)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K78118043	BRD-K78118043-001-01-9	Broad Institute of MIT and Harvard	BRD-K78118043			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2F)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19-,25-/m1/s1	UPQGSBDKNNCSHF-MPCDZSKCSA-N	467.258420178							96486
BRD-K68246656	LSM-7760		54618310	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20+,26-/m1/s1	ZKVMCHGVVVSISB-BVFVYWQFSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)C(=O)c4cccnc4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K68246656	BRD-K68246656-001-01-8	Broad Institute of MIT and Harvard	BRD-K68246656			COc1ccccc1-c1ccc2c(O[C@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20+,26-/m1/s1	ZKVMCHGVVVSISB-BVFVYWQFSA-N	539.209006496							96381
BRD-K94303022	LSM-8051		54618101	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18-,22-/m1/s1	KCOGFDLBSVUITM-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K94303022	BRD-K94303022-001-01-2	Broad Institute of MIT and Harvard	BRD-K94303022			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18-,22-/m1/s1	KCOGFDLBSVUITM-JBYIUTFZSA-N	498.259068248							96672
BRD-K80442083	LSM-7898		54618253	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21-,27-/m0/s1	FWJMPRMSYCMNDB-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K80442083	BRD-K80442083-001-01-0	Broad Institute of MIT and Harvard	BRD-K80442083			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21-,27-/m0/s1	FWJMPRMSYCMNDB-IZVMNLJQSA-N	557.235970172							96519
BRD-K22485649	LSM-7141		54618286	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20+,26-/m0/s1	BHKYXVBLKIOFCQ-UNVFRBQDSA-N	COc1ccc(cc1)c2cnc3O[C@@H](CN(C)C(=O)C4CCCCC4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K22485649	BRD-K22485649-001-01-7	Broad Institute of MIT and Harvard	BRD-K22485649			COc1ccc(cc1)-c1cnc2O[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20+,26-/m0/s1	BHKYXVBLKIOFCQ-UNVFRBQDSA-N	509.288971378							95762
BRD-K47991733	LSM-7464		54618345	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18+,22-/m0/s1	KCOGFDLBSVUITM-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K47991733	BRD-K47991733-001-01-2	Broad Institute of MIT and Harvard	BRD-K47991733			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18+,22-/m0/s1	KCOGFDLBSVUITM-SVMVAKDDSA-N	498.259068248							96085
BRD-A08778300	LSM-6859		44505316	InChI=1S/C29H36N4O7/c1-5-6-22(35)9-7-20-11-23-27(30-13-20)40-26(18(2)14-33(28(23)36)19(3)16-34)15-32(4)29(37)31-21-8-10-24-25(12-21)39-17-38-24/h8,10-13,18-19,22,26,34-35H,5-6,14-17H2,1-4H3,(H,31,37)/t18-,19+,22?,26-/m0/s1	VGYFAVFOCXCKID-WXCMXNBBSA-N	CCCC(O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-A08778300	BRD-A08778300-001-01-5	Broad Institute of MIT and Harvard	BRD-A08778300			CCCC(O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H36N4O7/c1-5-6-22(35)9-7-20-11-23-27(30-13-20)40-26(18(2)14-33(28(23)36)19(3)16-34)15-32(4)29(37)31-21-8-10-24-25(12-21)39-17-38-24/h8,10-13,18-19,22,26,34-35H,5-6,14-17H2,1-4H3,(H,31,37)/t18-,19+,22?,26-/m0/s1	VGYFAVFOCXCKID-WXCMXNBBSA-N	552.258399532							95480
BRD-K17339982	LSM-7075		54618163	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18-,21-/m0/s1	VEFOSOMUCSIFLK-NTLWEQJWSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#C[C@H](C)O	BroadT	BRD-K17339982	BRD-K17339982-001-01-8	Broad Institute of MIT and Harvard	BRD-K17339982			CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#C[C@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18-,21-/m0/s1	VEFOSOMUCSIFLK-NTLWEQJWSA-N	481.22465656							95696
BRD-K28397270	LSM-43382		54618128	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23+,28+/m0/s1	DIBJIDYNEHVBAV-QDLSXJSUSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K28397270	BRD-K28397270-001-01-4	Broad Institute of MIT and Harvard	BRD-K28397270			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23+,28+/m0/s1	DIBJIDYNEHVBAV-QDLSXJSUSA-N	555.276692132							
BRD-K97709323	LSM-8085		54618313	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18+,21+/m0/s1	VEFOSOMUCSIFLK-XKGFGPFHSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#C[C@@H](C)O	BroadT	BRD-K97709323	BRD-K97709323-001-01-3	Broad Institute of MIT and Harvard	BRD-K97709323			CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#C[C@@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18+,21+/m0/s1	VEFOSOMUCSIFLK-XKGFGPFHSA-N	481.22465656							96706
BRD-K49313348	LSM-7485		44505502	InChI=1S/C32H33FN4O4/c1-20-17-37(21(2)19-38)31(39)27-15-24(23-10-6-11-25(33)14-23)16-34-30(27)41-29(20)18-36(3)32(40)35-28-13-7-9-22-8-4-5-12-26(22)28/h4-16,20-21,29,38H,17-19H2,1-3H3,(H,35,40)/t20-,21+,29-/m0/s1	LFKRZQVCQDAKMN-FONBTEPMSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ncc(cc4C1=O)c5cccc(F)c5	BroadT	BRD-K49313348	BRD-K49313348-001-01-4	Broad Institute of MIT and Harvard	BRD-K49313348			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C32H33FN4O4/c1-20-17-37(21(2)19-38)31(39)27-15-24(23-10-6-11-25(33)14-23)16-34-30(27)41-29(20)18-36(3)32(40)35-28-13-7-9-22-8-4-5-12-26(22)28/h4-16,20-21,29,38H,17-19H2,1-3H3,(H,35,40)/t20-,21+,29-/m0/s1	LFKRZQVCQDAKMN-FONBTEPMSA-N	556.248583776							96106
BRD-K80000073	LSM-7894		54618267	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22+,28+/m0/s1	VHCZRFPKNWPULV-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K80000073	BRD-K80000073-001-01-8	Broad Institute of MIT and Harvard	BRD-K80000073			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22+,28+/m0/s1	VHCZRFPKNWPULV-PFPZSTESSA-N	552.229407582							96515
BRD-K60656884	LSM-7653		54618107	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20+,26+/m1/s1	ZNOUXTLFAUQIIE-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K60656884	BRD-K60656884-001-01-0	Broad Institute of MIT and Harvard	BRD-K60656884			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20+,26+/m1/s1	ZNOUXTLFAUQIIE-GOHWNWGWSA-N	485.242689902							96274
BRD-K15684061	LSM-7059		54618195	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20+,25-/m1/s1	DFIFSWMEHHNDQD-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C#CC(C)(C)O	BroadT	BRD-K15684061	BRD-K15684061-001-01-3	Broad Institute of MIT and Harvard	BRD-K15684061			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C#CC(C)(C)O	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20+,25-/m1/s1	DFIFSWMEHHNDQD-OHUGHZGNSA-N	518.22507113							95680
BRD-K05570331	LSM-43359		54618237	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18+,23+/m1/s1	FNIHZEFWPVWWQI-XMFWOJDZSA-N	C\C=C\c1cnc2O[C@@H](CN(C)Cc3cccc(c3)C(=O)O)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K05570331	BRD-K05570331-001-01-0	Broad Institute of MIT and Harvard	BRD-K05570331			C\C=C\c1cnc2O[C@@H](CN(C)Cc3cccc(c3)C(O)=O)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18+,23+/m1/s1	FNIHZEFWPVWWQI-XMFWOJDZSA-N	467.242021186							
CHEMBL2131926	LSM-7242	BRD-K30477337, SID131413226	54618153	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20-,26-/m1/s1	HDWGWTYDTDHGLT-XMERXJNXSA-N	COc1cccc(c1)c2ccc3c(O[C@H](CN(C)C(=O)C4CCOCC4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K30477337	BRD-K30477337-001-01-1	Broad Institute of MIT and Harvard	BRD-K30477337			COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20-,26-/m1/s1	HDWGWTYDTDHGLT-XMERXJNXSA-N	546.239972266							95863
BRD-K35615823	LSM-7304		54618189	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22-,27-/m0/s1	UFPGTWMRZCUHBI-BERHBOFZSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CC4(O)CCCC4)c1	BroadT	BRD-K35615823	BRD-K35615823-001-01-2	Broad Institute of MIT and Harvard	BRD-K35615823			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CC2(O)CCCC2)c1	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22-,27-/m0/s1	UFPGTWMRZCUHBI-BERHBOFZSA-N	585.250871308							95925
BRD-K69503483	LSM-7776		54618106	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20-,26-/m1/s1	DYHTZISNAWRTSH-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3cc(ccc3S1(=O)=O)C#CCC4CCCC4	BroadT	BRD-K69503483	BRD-K69503483-001-01-0	Broad Institute of MIT and Harvard	BRD-K69503483			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2cc(ccc2S1(=O)=O)C#CCC1CCCC1	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20-,26-/m1/s1	DYHTZISNAWRTSH-XMERXJNXSA-N	572.26685573							96397
BRD-K41743657	LSM-7375		54618142	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22+,28+/m0/s1	FRFGYBSWUNYCIP-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K41743657	BRD-K41743657-001-01-5	Broad Institute of MIT and Harvard	BRD-K41743657			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22+,28+/m0/s1	FRFGYBSWUNYCIP-PFPZSTESSA-N	565.204670044							95996
BRD-K77264230	LSM-7851		54618340	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21+,25-/m1/s1	YPWSXDREONXLFW-TYBLODHISA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K77264230	BRD-K77264230-001-01-5	Broad Institute of MIT and Harvard	BRD-K77264230			CCCC#Cc1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21+,25-/m1/s1	YPWSXDREONXLFW-TYBLODHISA-N	492.26579309							96472
BRD-K10301293	LSM-6985		54618132	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19+,24+/m0/s1	QHDFXKNEEFSYRF-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccncc4	BroadT	BRD-K10301293	BRD-K10301293-001-01-9	Broad Institute of MIT and Harvard	BRD-K10301293			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19+,24+/m0/s1	QHDFXKNEEFSYRF-XLNZFTOWSA-N	563.15600529							95606
BRD-K01573538	LSM-6880		54618222	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20+,26+/m0/s1	BVGZNQUUZDWJPB-OUDXUNEISA-N	COc1ccccc1c2cnc3O[C@H](CN(C)CC4CCOCC4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K01573538	BRD-K01573538-001-01-9	Broad Institute of MIT and Harvard	BRD-K01573538			COc1ccccc1-c1cnc2O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20+,26+/m0/s1	BVGZNQUUZDWJPB-OUDXUNEISA-N	497.288971378							95501
BRD-K24975719	LSM-7166		54618271	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20-,24-/m1/s1	FLFHXFOLABGIIH-YOSAUDMPSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K24975719	BRD-K24975719-001-01-0	Broad Institute of MIT and Harvard	BRD-K24975719			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20-,24-/m1/s1	FLFHXFOLABGIIH-YOSAUDMPSA-N	513.283885998							95787
BRD-K78223464	LSM-7869		54618233	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20-,25-/m1/s1	UEIRNIQKIBOUIF-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K78223464	BRD-K78223464-001-01-7	Broad Institute of MIT and Harvard	BRD-K78223464			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20-,25-/m1/s1	UEIRNIQKIBOUIF-UMEGOILYSA-N	485.23482732							96490
BRD-K10287595	LSM-6984		54618220	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17+,23-/m1/s1	YCBIAWRDDHRJGU-SAHWJRBASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K10287595	BRD-K10287595-001-01-5	Broad Institute of MIT and Harvard	BRD-K10287595			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17+,23-/m1/s1	YCBIAWRDDHRJGU-SAHWJRBASA-N	493.212532626							95605
BRD-K67862892	LSM-7753		54618334	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18+,21+/m1/s1	VEFOSOMUCSIFLK-WIRSXHRWSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#C[C@H](C)O	BroadT	BRD-K67862892	BRD-K67862892-001-01-7	Broad Institute of MIT and Harvard	BRD-K67862892			CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#C[C@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18+,21+/m1/s1	VEFOSOMUCSIFLK-WIRSXHRWSA-N	481.22465656							96374
BRD-K04798077	LSM-43358		54618385	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22+,27+/m0/s1	FQANFRRZYSNNGV-WEEIDUKRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K04798077	BRD-K04798077-001-01-6	Broad Institute of MIT and Harvard	BRD-K04798077			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22+,27+/m0/s1	FQANFRRZYSNNGV-WEEIDUKRSA-N	514.258005608							
BRD-K43634429	LSM-43396		54618120	InChI=1S/C24H31FN2O6S2/c1-5-6-19-7-12-24-22(13-19)33-23(17(2)14-27(18(3)16-28)35(24,31)32)15-26(4)34(29,30)21-10-8-20(25)9-11-21/h5-13,17-18,23,28H,14-16H2,1-4H3/b6-5+/t17-,18+,23-/m1/s1	PTEFBLKOTMQJFG-DTMUQXLISA-N	C\C=C\c1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K43634429	BRD-K43634429-001-01-1	Broad Institute of MIT and Harvard	BRD-K43634429			C\C=C\c1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H31FN2O6S2/c1-5-6-19-7-12-24-22(13-19)33-23(17(2)14-27(18(3)16-28)35(24,31)32)15-26(4)34(29,30)21-10-8-20(25)9-11-21/h5-13,17-18,23,28H,14-16H2,1-4H3/b6-5+/t17-,18+,23-/m1/s1	PTEFBLKOTMQJFG-DTMUQXLISA-N	526.160756312							
CHEMBL2132607	LSM-7094	BRD-K19122760, SID131413382	54618297	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22-,28-/m1/s1	FRFGYBSWUNYCIP-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K19122760	BRD-K19122760-001-01-4	Broad Institute of MIT and Harvard	BRD-K19122760			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22-,28-/m1/s1	FRFGYBSWUNYCIP-DQCZWYHMSA-N	565.204670044							95715
BRD-K33960497	LSM-7288		54618382	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20-,25+/m0/s1	DFIFSWMEHHNDQD-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C#CC(C)(C)O	BroadT	BRD-K33960497	BRD-K33960497-001-01-9	Broad Institute of MIT and Harvard	BRD-K33960497			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C#CC(C)(C)O	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20-,25+/m0/s1	DFIFSWMEHHNDQD-ZYLNGJIFSA-N	518.22507113							95909
MLS003130148	LSM-7129	BRD-K21494224, SID99358797	46903546	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22+,28-/m0/s1	VHCZRFPKNWPULV-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K21494224	BRD-K21494224-001-02-1	Broad Institute of MIT and Harvard	BRD-K21494224			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22+,28-/m0/s1	VHCZRFPKNWPULV-TYPXCFOJSA-N	552.229407582							95750
BRD-K66573697	LSM-7736		54618144	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21+,25-/m0/s1	YPWSXDREONXLFW-BKSPAHHJSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K66573697	BRD-K66573697-001-01-8	Broad Institute of MIT and Harvard	BRD-K66573697			CCCC#Cc1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21+,25-/m0/s1	YPWSXDREONXLFW-BKSPAHHJSA-N	492.26579309							96357
BRD-K12589632	LSM-7015		54618352	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20-,25+/m1/s1	NHORSMPXTAJMFN-FHAGJXEFSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K12589632	BRD-K12589632-001-01-7	Broad Institute of MIT and Harvard	BRD-K12589632			COCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20-,25+/m1/s1	NHORSMPXTAJMFN-FHAGJXEFSA-N	566.175657448							95636
BRD-K66803141	LSM-7739		54618186	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20-,26+/m0/s1	ZKVMCHGVVVSISB-CUVVAGTFSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)C(=O)c4cccnc4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K66803141	BRD-K66803141-001-01-1	Broad Institute of MIT and Harvard	BRD-K66803141			COc1ccccc1-c1ccc2c(O[C@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20-,26+/m0/s1	ZKVMCHGVVVSISB-CUVVAGTFSA-N	539.209006496							96360
BRD-K89995901	LSM-8403		54618389	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21-,27-/m1/s1	FWJMPRMSYCMNDB-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K89995901	BRD-K89995901-001-01-8	Broad Institute of MIT and Harvard	BRD-K89995901			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21-,27-/m1/s1	FWJMPRMSYCMNDB-LGVUCKNBSA-N	557.235970172							97024
BRD-K67407970	LSM-7750		54618172	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20+,26-/m1/s1	DYHTZISNAWRTSH-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3cc(ccc3S1(=O)=O)C#CCC4CCCC4	BroadT	BRD-K67407970	BRD-K67407970-001-01-6	Broad Institute of MIT and Harvard	BRD-K67407970			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2cc(ccc2S1(=O)=O)C#CCC1CCCC1	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20+,26-/m1/s1	DYHTZISNAWRTSH-BVFVYWQFSA-N	572.26685573							96371
BRD-K47203692	LSM-43400		54618179	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22-,27-/m0/s1	FQANFRRZYSNNGV-FNHRANMKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K47203692	BRD-K47203692-001-01-1	Broad Institute of MIT and Harvard	BRD-K47203692			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22-,27-/m0/s1	FQANFRRZYSNNGV-FNHRANMKSA-N	514.258005608							
BRD-K54935014	LSM-7571		54618155	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19+,24-/m0/s1	QHDFXKNEEFSYRF-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccncc4	BroadT	BRD-K54935014	BRD-K54935014-001-01-9	Broad Institute of MIT and Harvard	BRD-K54935014			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19+,24-/m0/s1	QHDFXKNEEFSYRF-GLDPYIMESA-N	563.15600529							96192
CHEMBL2141366	LSM-7960	BRD-K86816409, SID131413363	54618279	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22+,28-/m1/s1	FRFGYBSWUNYCIP-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K86816409	BRD-K86816409-001-01-6	Broad Institute of MIT and Harvard	BRD-K86816409			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22+,28-/m1/s1	FRFGYBSWUNYCIP-RZIGYZOXSA-N	565.204670044							96581
BRD-K77069371	LSM-43425		54618171	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18-,23-/m1/s1	FNIHZEFWPVWWQI-YMBATADGSA-N	C\C=C\c1cnc2O[C@H](CN(C)Cc3cccc(c3)C(=O)O)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K77069371	BRD-K77069371-001-01-7	Broad Institute of MIT and Harvard	BRD-K77069371			C\C=C\c1cnc2O[C@H](CN(C)Cc3cccc(c3)C(O)=O)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18-,23-/m1/s1	FNIHZEFWPVWWQI-YMBATADGSA-N	467.242021186							
CHEMBL2359332	LSM-7690	BRD-K62881454, SID131413426	54618337	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20+,27-/m0/s1	ZBKDHRFNQBVZSS-VKIDHGPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C5=CCCCC5	BroadT	BRD-K62881454	BRD-K62881454-001-01-2	Broad Institute of MIT and Harvard	BRD-K62881454			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20+,27-/m0/s1	ZBKDHRFNQBVZSS-VKIDHGPPSA-N	571.235221244							96311
MLS003130144	LSM-43419	BRD-K66925231, SID99358793	46903542	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23-,28-/m0/s1	DIBJIDYNEHVBAV-FCEUQJKUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K66925231	BRD-K66925231-001-02-1	Broad Institute of MIT and Harvard	BRD-K66925231			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23-,28-/m0/s1	DIBJIDYNEHVBAV-FCEUQJKUSA-N	555.276692132							
BRD-K57230817	LSM-7606		54618304	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18+,21-/m1/s1	VEFOSOMUCSIFLK-DCXXXQMHSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#C[C@H](C)O	BroadT	BRD-K57230817	BRD-K57230817-001-01-1	Broad Institute of MIT and Harvard	BRD-K57230817			CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#C[C@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18+,21-/m1/s1	VEFOSOMUCSIFLK-DCXXXQMHSA-N	481.22465656							96227
CHEMBL2140957	LSM-43368	BRD-K13365737, SID131413393	54618308	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23+,28-/m0/s1	DIBJIDYNEHVBAV-MSLUGGNCSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K13365737	BRD-K13365737-001-01-5	Broad Institute of MIT and Harvard	BRD-K13365737			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23+,28-/m0/s1	DIBJIDYNEHVBAV-MSLUGGNCSA-N	555.276692132							
CHEMBL3184881	LSM-7292	BRD-K34576879	54618169	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22-,28-/m0/s1	VHCZRFPKNWPULV-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K34576879	BRD-K34576879-001-01-0	Broad Institute of MIT and Harvard	BRD-K34576879			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22-,28-/m0/s1	VHCZRFPKNWPULV-VPYPWEPUSA-N	552.229407582							95913
BRD-K19724753	LSM-43375		54618259	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16+,19-/m0/s1	KGPKEHLIXQTDQP-MSARHIAJSA-N	C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K19724753	BRD-K19724753-001-01-6	Broad Institute of MIT and Harvard	BRD-K19724753			C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16+,19-/m0/s1	KGPKEHLIXQTDQP-MSARHIAJSA-N	477.204589832							
BRD-K29799191	LSM-43351		54618149	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18-,23+/m0/s1	FNIHZEFWPVWWQI-QSCGOKKNSA-N	C\C=C\c1cnc2O[C@H](CN(C)Cc3cccc(c3)C(=O)O)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K29799191	BRD-K29799191-001-01-6	Broad Institute of MIT and Harvard	BRD-K29799191			C\C=C\c1cnc2O[C@H](CN(C)Cc3cccc(c3)C(O)=O)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18-,23+/m0/s1	FNIHZEFWPVWWQI-QSCGOKKNSA-N	467.242021186							
BRD-K25290948	LSM-43380		54618112	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23-,28-/m1/s1	DIBJIDYNEHVBAV-NHRFSJLWSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K25290948	BRD-K25290948-001-01-6	Broad Institute of MIT and Harvard	BRD-K25290948			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23-,28-/m1/s1	DIBJIDYNEHVBAV-NHRFSJLWSA-N	555.276692132							
BRD-K13999467	LSM-7037		54618164	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22-,28-/m0/s1	FRFGYBSWUNYCIP-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K13999467	BRD-K13999467-001-01-7	Broad Institute of MIT and Harvard	BRD-K13999467			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22-,28-/m0/s1	FRFGYBSWUNYCIP-VPYPWEPUSA-N	565.204670044							95658
BRD-K75636715	LSM-7828		54618248	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20+,25+/m1/s1	GCPZFZZKEDFKSA-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K75636715	BRD-K75636715-001-01-0	Broad Institute of MIT and Harvard	BRD-K75636715			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20+,25+/m1/s1	GCPZFZZKEDFKSA-RNHFSVANSA-N	500.234492962							96449
BRD-K33768761	LSM-7282		54618243	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20+,25-/m1/s1	UEIRNIQKIBOUIF-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K33768761	BRD-K33768761-001-01-5	Broad Institute of MIT and Harvard	BRD-K33768761			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20+,25-/m1/s1	UEIRNIQKIBOUIF-OHUGHZGNSA-N	485.23482732							95903
BRD-K45628229	LSM-7424		54618366	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20-,26-/m1/s1	BVGZNQUUZDWJPB-XMERXJNXSA-N	COc1ccccc1c2cnc3O[C@H](CN(C)CC4CCOCC4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K45628229	BRD-K45628229-001-01-3	Broad Institute of MIT and Harvard	BRD-K45628229			COc1ccccc1-c1cnc2O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20-,26-/m1/s1	BVGZNQUUZDWJPB-XMERXJNXSA-N	497.288971378							96045
BRD-K59524902	LSM-7634		54618173	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19-,25-/m0/s1	UPQGSBDKNNCSHF-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2F)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K59524902	BRD-K59524902-001-01-1	Broad Institute of MIT and Harvard	BRD-K59524902			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2F)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19-,25-/m0/s1	UPQGSBDKNNCSHF-MHPIHPPYSA-N	467.258420178							96255
BRD-K67771738	LSM-7752		54618332	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17+,21+/m0/s1	NMUQMAVVZJKKCB-CSODHUTKSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3cncnc3	BroadT	BRD-K67771738	BRD-K67771738-001-01-8	Broad Institute of MIT and Harvard	BRD-K67771738			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cncnc1	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17+,21+/m0/s1	NMUQMAVVZJKKCB-CSODHUTKSA-N	491.220239896							96373
BRD-K03958946	LSM-6912		54618342	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20-,25+/m0/s1	GCPZFZZKEDFKSA-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K03958946	BRD-K03958946-001-01-6	Broad Institute of MIT and Harvard	BRD-K03958946			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20-,25+/m0/s1	GCPZFZZKEDFKSA-ZYLNGJIFSA-N	500.234492962							95533
BRD-K37722208	LSM-7334		54618229	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21+,25+/m1/s1	YPWSXDREONXLFW-CZSZKKDXSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K37722208	BRD-K37722208-001-01-9	Broad Institute of MIT and Harvard	BRD-K37722208			CCCC#Cc1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21+,25+/m1/s1	YPWSXDREONXLFW-CZSZKKDXSA-N	492.26579309							95955
CHEMBL2362197	LSM-43440	SID131413374, BRD-K98216700	54618289	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23-,28+/m1/s1	DIBJIDYNEHVBAV-IOIDZWFXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K98216700	BRD-K98216700-001-01-1	Broad Institute of MIT and Harvard	BRD-K98216700			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23-,28+/m1/s1	DIBJIDYNEHVBAV-IOIDZWFXSA-N	555.276692132							
BRD-K30573524	LSM-7245		54618290	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18+,22-/m1/s1	KCOGFDLBSVUITM-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K30573524	BRD-K30573524-001-01-0	Broad Institute of MIT and Harvard	BRD-K30573524			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18+,22-/m1/s1	KCOGFDLBSVUITM-KGVIQGDOSA-N	498.259068248							95866
MLS003129072	LSM-7480	BRD-K49031847	46904239	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13+,16-/m0/s1	LKDAMHONCJEZRZ-ZENOOKHLSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K49031847	BRD-K49031847-001-02-6	Broad Institute of MIT and Harvard	BRD-K49031847			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13+,16-/m0/s1	LKDAMHONCJEZRZ-ZENOOKHLSA-N	456.137218048							96101
BRD-K07481069	LSM-6955		54618302	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20-,26+/m1/s1	DYHTZISNAWRTSH-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3cc(ccc3S1(=O)=O)C#CCC4CCCC4	BroadT	BRD-K07481069	BRD-K07481069-001-01-6	Broad Institute of MIT and Harvard	BRD-K07481069			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2cc(ccc2S1(=O)=O)C#CCC1CCCC1	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20-,26+/m1/s1	DYHTZISNAWRTSH-KYTVRQNUSA-N	572.26685573							95576
BRD-K25476619	LSM-7174		54618240	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18+,21+/m0/s1	VEFOSOMUCSIFLK-LXGFNABISA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#C[C@@H](C)O	BroadT	BRD-K25476619	BRD-K25476619-001-01-9	Broad Institute of MIT and Harvard	BRD-K25476619			CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#C[C@@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18+,21+/m0/s1	VEFOSOMUCSIFLK-LXGFNABISA-N	481.22465656							95795
CHEMBL2359191	LSM-7868	BRD-K78218619, SID131413233	54618157	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20-,25-/m1/s1	NHORSMPXTAJMFN-UMEGOILYSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K78218619	BRD-K78218619-001-01-1	Broad Institute of MIT and Harvard	BRD-K78218619			COCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20-,25-/m1/s1	NHORSMPXTAJMFN-UMEGOILYSA-N	566.175657448							96489
BRD-K87990527	LSM-43434		54618135	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18-,23-/m0/s1	FNIHZEFWPVWWQI-IYHQUHIRSA-N	C\C=C\c1cnc2O[C@@H](CN(C)Cc3cccc(c3)C(=O)O)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K87990527	BRD-K87990527-001-01-5	Broad Institute of MIT and Harvard	BRD-K87990527			C\C=C\c1cnc2O[C@@H](CN(C)Cc3cccc(c3)C(O)=O)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18-,23-/m0/s1	FNIHZEFWPVWWQI-IYHQUHIRSA-N	467.242021186							
BRD-K34787855	LSM-7295		54618207	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20+,24+/m1/s1	FLFHXFOLABGIIH-NMMYMHLASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K34787855	BRD-K34787855-001-01-1	Broad Institute of MIT and Harvard	BRD-K34787855			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20+,24+/m1/s1	FLFHXFOLABGIIH-NMMYMHLASA-N	513.283885998							95916
BRD-K72318460	LSM-7800		54618296	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21-,27+/m0/s1	FWJMPRMSYCMNDB-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K72318460	BRD-K72318460-001-01-5	Broad Institute of MIT and Harvard	BRD-K72318460			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21-,27+/m0/s1	FWJMPRMSYCMNDB-NOMHHCBYSA-N	557.235970172							96421
BRD-K41350512	LSM-7374		54618139	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20-,26+/m1/s1	ZKVMCHGVVVSISB-KYTVRQNUSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)C(=O)c4cccnc4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K41350512	BRD-K41350512-001-01-4	Broad Institute of MIT and Harvard	BRD-K41350512			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20-,26+/m1/s1	ZKVMCHGVVVSISB-KYTVRQNUSA-N	539.209006496							95995
MLS003129003	LSM-7151	BRD-K23166787	46904126	InChI=1S/C23H29BrN2O6S/c1-15-10-26(16(2)13-27)33(28,29)23-7-5-18(24)9-21(23)32-22(15)12-25(3)11-17-4-6-19-20(8-17)31-14-30-19/h4-9,15-16,22,27H,10-14H2,1-3H3/t15-,16+,22-/m1/s1	WSJCKGXDVCNJDF-ZMPRRUGASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4cc(Br)ccc4S1(=O)=O	BroadT	BRD-K23166787	BRD-K23166787-001-01-4	Broad Institute of MIT and Harvard	BRD-K23166787			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C23H29BrN2O6S/c1-15-10-26(16(2)13-27)33(28,29)23-7-5-18(24)9-21(23)32-22(15)12-25(3)11-17-4-6-19-20(8-17)31-14-30-19/h4-9,15-16,22,27H,10-14H2,1-3H3/t15-,16+,22-/m1/s1	WSJCKGXDVCNJDF-ZMPRRUGASA-N	540.092969958							95772
BRD-K06900263	LSM-6946		54618242	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18-,22+/m1/s1	KCOGFDLBSVUITM-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K06900263	BRD-K06900263-001-01-0	Broad Institute of MIT and Harvard	BRD-K06900263			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18-,22+/m1/s1	KCOGFDLBSVUITM-HMFYCAOWSA-N	498.259068248							95567
BRD-K64217340	LSM-7706		54618324	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22+,28+/m1/s1	VHCZRFPKNWPULV-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K64217340	BRD-K64217340-001-01-5	Broad Institute of MIT and Harvard	BRD-K64217340			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22+,28+/m1/s1	VHCZRFPKNWPULV-WENCSYSZSA-N	552.229407582							96327
BRD-K05653239	LSM-6934		54618254	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22+,28+/m1/s1	FRFGYBSWUNYCIP-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K05653239	BRD-K05653239-001-01-7	Broad Institute of MIT and Harvard	BRD-K05653239			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22+,28+/m1/s1	FRFGYBSWUNYCIP-WENCSYSZSA-N	565.204670044							95555
BRD-K66110520	LSM-7730		54618208	InChI=1S/C27H37N5O5/c1-16-13-32(17(2)15-33)26(34)22-11-21(20-9-7-6-8-10-20)12-28-25(22)36-23(16)14-31(5)27(35)29-24-18(3)30-37-19(24)4/h9,11-12,16-17,23,33H,6-8,10,13-15H2,1-5H3,(H,29,35)/t16-,17-,23-/m0/s1	GOGVGZCTCHGHTM-QQMNAOGKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K66110520	BRD-K66110520-001-01-2	Broad Institute of MIT and Harvard	BRD-K66110520			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C27H37N5O5/c1-16-13-32(17(2)15-33)26(34)22-11-21(20-9-7-6-8-10-20)12-28-25(22)36-23(16)14-31(5)27(35)29-24-18(3)30-37-19(24)4/h9,11-12,16-17,23,33H,6-8,10,13-15H2,1-5H3,(H,29,35)/t16-,17-,23-/m0/s1	GOGVGZCTCHGHTM-QQMNAOGKSA-N	511.279469334							96351
BRD-K34937870	LSM-7296		54618298	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17-,21-/m0/s1	NMUQMAVVZJKKCB-FIKGOQFSSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3cncnc3	BroadT	BRD-K34937870	BRD-K34937870-001-01-3	Broad Institute of MIT and Harvard	BRD-K34937870			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1cncnc1	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17-,21-/m0/s1	NMUQMAVVZJKKCB-FIKGOQFSSA-N	491.220239896							95917
BRD-K12913157	LSM-43367		54618099	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16-,19+/m0/s1	KGPKEHLIXQTDQP-LAJBOSMKSA-N	C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K12913157	BRD-K12913157-001-01-4	Broad Institute of MIT and Harvard	BRD-K12913157			C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16-,19+/m0/s1	KGPKEHLIXQTDQP-LAJBOSMKSA-N	477.204589832							
BRD-K73643601	LSM-43422		54618198	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18+,23+/m0/s1	FNIHZEFWPVWWQI-DVUHTVQOSA-N	C\C=C\c1cnc2O[C@H](CN(C)Cc3cccc(c3)C(=O)O)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K73643601	BRD-K73643601-001-01-5	Broad Institute of MIT and Harvard	BRD-K73643601			C\C=C\c1cnc2O[C@H](CN(C)Cc3cccc(c3)C(O)=O)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18+,23+/m0/s1	FNIHZEFWPVWWQI-DVUHTVQOSA-N	467.242021186							
BRD-K06806702	LSM-6944		54618299	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20+,25+/m1/s1	DFIFSWMEHHNDQD-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C#CC(C)(C)O	BroadT	BRD-K06806702	BRD-K06806702-001-01-8	Broad Institute of MIT and Harvard	BRD-K06806702			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C#CC(C)(C)O	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20+,25+/m1/s1	DFIFSWMEHHNDQD-RNHFSVANSA-N	518.22507113							95565
BRD-K07464613	LSM-6953		54618122	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17-,21-/m1/s1	NMUQMAVVZJKKCB-CBGDNZLLSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3cncnc3	BroadT	BRD-K07464613	BRD-K07464613-001-01-3	Broad Institute of MIT and Harvard	BRD-K07464613			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1cncnc1	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17-,21-/m1/s1	NMUQMAVVZJKKCB-CBGDNZLLSA-N	491.220239896							95574
MLS003130154	LSM-6905	BRD-K03313681, SID99358803	46903552	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19-,27+/m1/s1	KZMWOMHQUKXWRI-KFDHSVMUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K03313681	BRD-K03313681-001-02-1	Broad Institute of MIT and Harvard	BRD-K03313681			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19-,27+/m1/s1	KZMWOMHQUKXWRI-KFDHSVMUSA-N	584.19049719							95526
BRD-K95488294	LSM-8070		54618151	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19-,25-/m0/s1	VIOYSSVCFLGZJY-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CC4CC4	BroadT	BRD-K95488294	BRD-K95488294-001-01-1	Broad Institute of MIT and Harvard	BRD-K95488294			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19-,25-/m0/s1	VIOYSSVCFLGZJY-MHPIHPPYSA-N	514.193771002							96691
BRD-K53477720	LSM-7540		54618260	InChI=1S/C24H32N4O4/c1-15-13-28(16(2)14-29)24(31)20-10-19(11-26-22(20)32-21(15)12-25-3)17-7-6-8-18(9-17)23(30)27(4)5/h6-11,15-16,21,25,29H,12-14H2,1-5H3/t15-,16+,21-/m0/s1	JOFZJSROTWODFL-MRUHUIDDSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3cccc(c3)C(=O)N(C)C	BroadT	BRD-K53477720	BRD-K53477720-001-01-8	Broad Institute of MIT and Harvard	BRD-K53477720			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C24H32N4O4/c1-15-13-28(16(2)14-29)24(31)20-10-19(11-26-22(20)32-21(15)12-25-3)17-7-6-8-18(9-17)23(30)27(4)5/h6-11,15-16,21,25,29H,12-14H2,1-5H3/t15-,16+,21-/m0/s1	JOFZJSROTWODFL-MRUHUIDDSA-N	440.242355544							96161
BRD-K09779552	LSM-6979		54618116	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20+,26+/m1/s1	ZKVMCHGVVVSISB-GOHWNWGWSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)C(=O)c4cccnc4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K09779552	BRD-K09779552-001-01-5	Broad Institute of MIT and Harvard	BRD-K09779552			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20+,26+/m1/s1	ZKVMCHGVVVSISB-GOHWNWGWSA-N	539.209006496							95600
BRD-K15502712	LSM-43373		54618129	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16+,19+/m0/s1	KGPKEHLIXQTDQP-OMOWZKTISA-N	C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K15502712	BRD-K15502712-001-01-0	Broad Institute of MIT and Harvard	BRD-K15502712			C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16+,19+/m0/s1	KGPKEHLIXQTDQP-OMOWZKTISA-N	477.204589832							
BRD-K62599086	LSM-7684		54618202	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20-,26+/m1/s1	ZNOUXTLFAUQIIE-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K62599086	BRD-K62599086-001-01-6	Broad Institute of MIT and Harvard	BRD-K62599086			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20-,26+/m1/s1	ZNOUXTLFAUQIIE-KYTVRQNUSA-N	485.242689902							96305
CHEMBL3187003	LSM-8035	BRD-K93011670	54618264	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20+,27-/m1/s1	ZBKDHRFNQBVZSS-IOKPGSKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C5=CCCCC5	BroadT	BRD-K93011670	BRD-K93011670-001-01-7	Broad Institute of MIT and Harvard	BRD-K93011670			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20+,27-/m1/s1	ZBKDHRFNQBVZSS-IOKPGSKQSA-N	571.235221244							96656
BRD-K94465870	LSM-8054		54618251	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19-,24+/m0/s1	QHDFXKNEEFSYRF-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccncc4	BroadT	BRD-K94465870	BRD-K94465870-001-01-2	Broad Institute of MIT and Harvard	BRD-K94465870			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19-,24+/m0/s1	QHDFXKNEEFSYRF-AXHZCLLHSA-N	563.15600529							96675
BRD-K76973159	LSM-7845		54618230	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18-,22+/m0/s1	KCOGFDLBSVUITM-NPPFBWRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K76973159	BRD-K76973159-001-01-9	Broad Institute of MIT and Harvard	BRD-K76973159			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18-,22+/m0/s1	KCOGFDLBSVUITM-NPPFBWRTSA-N	498.259068248							96466
BRD-K08288431	LSM-6964		54618115	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20+,26+/m0/s1	BHKYXVBLKIOFCQ-OUDXUNEISA-N	COc1ccc(cc1)c2cnc3O[C@H](CN(C)C(=O)C4CCCCC4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K08288431	BRD-K08288431-001-01-5	Broad Institute of MIT and Harvard	BRD-K08288431			COc1ccc(cc1)-c1cnc2O[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20+,26+/m0/s1	BHKYXVBLKIOFCQ-OUDXUNEISA-N	509.288971378							95585
BRD-K04278887	LSM-6917		54618150	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20-,27-/m0/s1	ZBKDHRFNQBVZSS-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C5=CCCCC5	BroadT	BRD-K04278887	BRD-K04278887-001-01-9	Broad Institute of MIT and Harvard	BRD-K04278887			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20-,27-/m0/s1	ZBKDHRFNQBVZSS-OSOCVKALSA-N	571.235221244							95538
BRD-K42241928	LSM-7383		54618380	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19-,24+/m1/s1	QHDFXKNEEFSYRF-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccncc4	BroadT	BRD-K42241928	BRD-K42241928-001-01-2	Broad Institute of MIT and Harvard	BRD-K42241928			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19-,24+/m1/s1	QHDFXKNEEFSYRF-IECBHUPTSA-N	563.15600529							96004
BRD-K03591925	LSM-6908		54618360	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18-,21-/m0/s1	VEFOSOMUCSIFLK-NYUBLWNDSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#C[C@H](C)O	BroadT	BRD-K03591925	BRD-K03591925-001-01-0	Broad Institute of MIT and Harvard	BRD-K03591925			CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#C[C@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18-,21-/m0/s1	VEFOSOMUCSIFLK-NYUBLWNDSA-N	481.22465656							95529
BRD-K92655621	LSM-8025		54618166	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18+,21-/m0/s1	VEFOSOMUCSIFLK-UGNRZPKXSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#C[C@@H](C)O	BroadT	BRD-K92655621	BRD-K92655621-001-01-2	Broad Institute of MIT and Harvard	BRD-K92655621			CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#C[C@@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18+,21-/m0/s1	VEFOSOMUCSIFLK-UGNRZPKXSA-N	481.22465656							96646
BRD-K87126403	LSM-7966		54618378	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17-,21+/m1/s1	NMUQMAVVZJKKCB-LZJOCLMNSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3cncnc3	BroadT	BRD-K87126403	BRD-K87126403-001-01-5	Broad Institute of MIT and Harvard	BRD-K87126403			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1cncnc1	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17-,21+/m1/s1	NMUQMAVVZJKKCB-LZJOCLMNSA-N	491.220239896							96587
BRD-K09206831	LSM-6973		54618193	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19+,27+/m1/s1	KZMWOMHQUKXWRI-RYTUXRKISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K09206831	BRD-K09206831-001-01-2	Broad Institute of MIT and Harvard	BRD-K09206831			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19+,27+/m1/s1	KZMWOMHQUKXWRI-RYTUXRKISA-N	584.19049719							95594
BRD-K79145797	LSM-43429		54618200	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18+,23-/m1/s1	FNIHZEFWPVWWQI-ZPXOVLSXSA-N	C\C=C\c1cnc2O[C@H](CN(C)Cc3cccc(c3)C(=O)O)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K79145797	BRD-K79145797-001-01-9	Broad Institute of MIT and Harvard	BRD-K79145797			C\C=C\c1cnc2O[C@H](CN(C)Cc3cccc(c3)C(O)=O)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18+,23-/m1/s1	FNIHZEFWPVWWQI-ZPXOVLSXSA-N	467.242021186							
CHEMBL3188942	LSM-7467	BRD-K48195969	44619003	InChI=1S/C30H40N4O3/c1-22-18-34(23(2)21-35)30(36)27-16-26(11-7-10-24-8-5-4-6-9-24)17-32-29(27)37-28(22)20-33(3)19-25-12-14-31-15-13-25/h12-17,22-24,28,35H,4-6,8-10,18-21H2,1-3H3/t22-,23+,28-/m0/s1	MOHYNDWRXWCXBE-JWZKTCGFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ncc(cc3C1=O)C#CCC4CCCCC4	BroadT	BRD-K48195969	BRD-K48195969-001-01-4	Broad Institute of MIT and Harvard	BRD-K48195969			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ncc(cc2C1=O)C#CCC1CCCCC1	InChI=1S/C30H40N4O3/c1-22-18-34(23(2)21-35)30(36)27-16-26(11-7-10-24-8-5-4-6-9-24)17-32-29(27)37-28(22)20-33(3)19-25-12-14-31-15-13-25/h12-17,22-24,28,35H,4-6,8-10,18-21H2,1-3H3/t22-,23+,28-/m0/s1	MOHYNDWRXWCXBE-JWZKTCGFSA-N	504.31004118							96088
BRD-K60997369	LSM-7662		54618309	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20+,24+/m0/s1	ALBVOUUIQWHTKA-DCLXLUIPSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K60997369	BRD-K60997369-001-01-2	Broad Institute of MIT and Harvard	BRD-K60997369			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20+,24+/m0/s1	ALBVOUUIQWHTKA-DCLXLUIPSA-N	514.224990918							96283
BRD-K55434198	LSM-7579		54618102	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19+,26+/m1/s1	KJZOGGIMPWHLRO-MVYHEMRASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K55434198	BRD-K55434198-001-01-0	Broad Institute of MIT and Harvard	BRD-K55434198			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19+,26+/m1/s1	KJZOGGIMPWHLRO-MVYHEMRASA-N	581.22498909							96200
BRD-K56592974	LSM-7594		54618252	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20+,27+/m1/s1	ZBKDHRFNQBVZSS-JVAFGIKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C5=CCCCC5	BroadT	BRD-K56592974	BRD-K56592974-001-01-4	Broad Institute of MIT and Harvard	BRD-K56592974			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20+,27+/m1/s1	ZBKDHRFNQBVZSS-JVAFGIKQSA-N	571.235221244							96215
BRD-K84260700	LSM-7930		54618178	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13+,16-/m1/s1	LKDAMHONCJEZRZ-DVOMOZLQSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K84260700	BRD-K84260700-001-01-5	Broad Institute of MIT and Harvard	BRD-K84260700			CCCNC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13+,16-/m1/s1	LKDAMHONCJEZRZ-DVOMOZLQSA-N	456.137218048							96551
BRD-K47031124	LSM-7447		54618194	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22-,25+/m0/s1	VKSOWNIUNHUMMN-WRALFONMSA-N	CCCC#Cc1cnc2O[C@H](CN(C)C(=O)CCN3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K47031124	BRD-K47031124-001-01-4	Broad Institute of MIT and Harvard	BRD-K47031124			CCCC#Cc1cnc2O[C@H](CN(C)C(=O)CCN3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22-,25+/m0/s1	VKSOWNIUNHUMMN-WRALFONMSA-N	498.320605864							96068
BRD-K38263412	LSM-7340		54618294	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17+,23-/m0/s1	YCBIAWRDDHRJGU-MFEFFIJZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K38263412	BRD-K38263412-001-01-5	Broad Institute of MIT and Harvard	BRD-K38263412			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17+,23-/m0/s1	YCBIAWRDDHRJGU-MFEFFIJZSA-N	493.212532626							95961
CHEMBL2360978	LSM-6971	BRD-K09076022, SID131413364	54618280	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19+,27-/m1/s1	KZMWOMHQUKXWRI-VXLXPWSCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K09076022	BRD-K09076022-001-01-8	Broad Institute of MIT and Harvard	BRD-K09076022			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19+,27-/m1/s1	KZMWOMHQUKXWRI-VXLXPWSCSA-N	584.19049719							95592
BRD-K23713813	LSM-43379		54618162	InChI=1S/C24H31FN2O6S2/c1-5-6-19-7-12-24-22(13-19)33-23(17(2)14-27(18(3)16-28)35(24,31)32)15-26(4)34(29,30)21-10-8-20(25)9-11-21/h5-13,17-18,23,28H,14-16H2,1-4H3/b6-5+/t17-,18+,23-/m0/s1	PTEFBLKOTMQJFG-ZXDYBIPMSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K23713813	BRD-K23713813-001-01-1	Broad Institute of MIT and Harvard	BRD-K23713813			C\C=C\c1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H31FN2O6S2/c1-5-6-19-7-12-24-22(13-19)33-23(17(2)14-27(18(3)16-28)35(24,31)32)15-26(4)34(29,30)21-10-8-20(25)9-11-21/h5-13,17-18,23,28H,14-16H2,1-4H3/b6-5+/t17-,18+,23-/m0/s1	PTEFBLKOTMQJFG-ZXDYBIPMSA-N	526.160756312							
BRD-K73871495	LSM-7815		54618131	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22+,25-/m0/s1	VKSOWNIUNHUMMN-FBLLAGFSSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)CCN3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K73871495	BRD-K73871495-001-01-1	Broad Institute of MIT and Harvard	BRD-K73871495			CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)CCN3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22+,25-/m0/s1	VKSOWNIUNHUMMN-FBLLAGFSSA-N	498.320605864							96436
BRD-K53350977	LSM-43407		54618257	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22+,27-/m0/s1	FQANFRRZYSNNGV-SSLJGLQOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K53350977	BRD-K53350977-001-01-7	Broad Institute of MIT and Harvard	BRD-K53350977			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22+,27-/m0/s1	FQANFRRZYSNNGV-SSLJGLQOSA-N	514.258005608							
BRD-K23801936	LSM-7160		54618361	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20-,26-/m1/s1	ZNOUXTLFAUQIIE-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K23801936	BRD-K23801936-001-01-6	Broad Institute of MIT and Harvard	BRD-K23801936			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20-,26-/m1/s1	ZNOUXTLFAUQIIE-XMERXJNXSA-N	485.242689902							95781
BRD-K12230293	LSM-7008		54618315	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20+,26-/m1/s1	BVGZNQUUZDWJPB-BVFVYWQFSA-N	COc1ccccc1c2cnc3O[C@H](CN(C)CC4CCOCC4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K12230293	BRD-K12230293-001-01-8	Broad Institute of MIT and Harvard	BRD-K12230293			COc1ccccc1-c1cnc2O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20+,26-/m1/s1	BVGZNQUUZDWJPB-BVFVYWQFSA-N	497.288971378							95629
BRD-K26421164	LSM-7183		54618114	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20-,26+/m0/s1	HDWGWTYDTDHGLT-CUVVAGTFSA-N	COc1cccc(c1)c2ccc3c(O[C@H](CN(C)C(=O)C4CCOCC4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K26421164	BRD-K26421164-001-01-3	Broad Institute of MIT and Harvard	BRD-K26421164			COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20-,26+/m0/s1	HDWGWTYDTDHGLT-CUVVAGTFSA-N	546.239972266							95804
BRD-K62047982	LSM-7673		54618266	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20+,25+/m0/s1	GCPZFZZKEDFKSA-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K62047982	BRD-K62047982-001-01-1	Broad Institute of MIT and Harvard	BRD-K62047982			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20+,25+/m0/s1	GCPZFZZKEDFKSA-WZOHSFFVSA-N	500.234492962							96294
BRD-K50108835	LSM-7492		54618376	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17+,21-/m0/s1	NMUQMAVVZJKKCB-FVJLSDCUSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3cncnc3	BroadT	BRD-K50108835	BRD-K50108835-001-01-4	Broad Institute of MIT and Harvard	BRD-K50108835			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cncnc1	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17+,21-/m0/s1	NMUQMAVVZJKKCB-FVJLSDCUSA-N	491.220239896							96113
BRD-K93494062	LSM-8041		54618152	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20-,26-/m0/s1	HDWGWTYDTDHGLT-DYLHXGEVSA-N	COc1cccc(c1)c2ccc3c(O[C@@H](CN(C)C(=O)C4CCOCC4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K93494062	BRD-K93494062-001-01-1	Broad Institute of MIT and Harvard	BRD-K93494062			COc1cccc(c1)-c1ccc2c(O[C@@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20-,26-/m0/s1	HDWGWTYDTDHGLT-DYLHXGEVSA-N	546.239972266							96662
BRD-K71216533	LSM-7795		54618190	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22-,27+/m0/s1	UFPGTWMRZCUHBI-BCQCSXDESA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CC4(O)CCCC4)c1	BroadT	BRD-K71216533	BRD-K71216533-001-01-5	Broad Institute of MIT and Harvard	BRD-K71216533			COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CC2(O)CCCC2)c1	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22-,27+/m0/s1	UFPGTWMRZCUHBI-BCQCSXDESA-N	585.250871308							96416
BRD-K78961368	LSM-7883		54618159	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21-,25-/m0/s1	YPWSXDREONXLFW-WATLYSKOSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K78961368	BRD-K78961368-001-01-9	Broad Institute of MIT and Harvard	BRD-K78961368			CCCC#Cc1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21-,25-/m0/s1	YPWSXDREONXLFW-WATLYSKOSA-N	492.26579309							96504
BRD-K64233461	LSM-7708		54618268	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19-,22+/m0/s1	MFJAJISBYJYJML-CNNODRBYSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K64233461	BRD-K64233461-001-01-5	Broad Institute of MIT and Harvard	BRD-K64233461			CC(C)C#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19-,22+/m0/s1	MFJAJISBYJYJML-CNNODRBYSA-N	538.191976228							96329
BRD-K23992348	LSM-7161		54618273	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19+,25-/m1/s1	UPQGSBDKNNCSHF-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2F)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K23992348	BRD-K23992348-001-01-5	Broad Institute of MIT and Harvard	BRD-K23992348			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2F)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19+,25-/m1/s1	UPQGSBDKNNCSHF-HHJKRLRDSA-N	467.258420178							95782
BRD-K48693155-001-01-2	LSM-17758	BRD-K48693155	54618096	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20-,26-/m0/s1	ZNOUXTLFAUQIIE-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K48693155	BRD-K48693155-001-01-2	Broad Institute of MIT and Harvard	BRD-K48693155			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H31N5O3/c1-19-15-33(20(2)18-34)28(35)25-11-24(23-8-4-6-21(10-23)12-29)14-31-27(25)36-26(19)17-32(3)16-22-7-5-9-30-13-22/h4-11,13-14,19-20,26,34H,15-18H2,1-3H3/t19-,20-,26-/m0/s1	ZNOUXTLFAUQIIE-DYLHXGEVSA-N	485.242689902							106399
BRD-K99171789	LSM-8095		54618236	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20+,25-/m0/s1	NHORSMPXTAJMFN-DFIYOIEZSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K99171789	BRD-K99171789-001-01-1	Broad Institute of MIT and Harvard	BRD-K99171789			COCC#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20+,25-/m0/s1	NHORSMPXTAJMFN-DFIYOIEZSA-N	566.175657448							96716
BRD-K08942755	LSM-43364		54618217	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16-,19-/m1/s1	KGPKEHLIXQTDQP-KUGNCMFCSA-N	C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K08942755	BRD-K08942755-001-01-5	Broad Institute of MIT and Harvard	BRD-K08942755			C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16-,19-/m1/s1	KGPKEHLIXQTDQP-KUGNCMFCSA-N	477.204589832							
BRD-K49309964	LSM-7484		54618333	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22+,28-/m1/s1	VHCZRFPKNWPULV-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K49309964	BRD-K49309964-001-01-5	Broad Institute of MIT and Harvard	BRD-K49309964			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22+,28-/m1/s1	VHCZRFPKNWPULV-RZIGYZOXSA-N	552.229407582							96105
BRD-K24638771	LSM-7164		54618384	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20+,26+/m1/s1	DYHTZISNAWRTSH-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3cc(ccc3S1(=O)=O)C#CCC4CCCC4	BroadT	BRD-K24638771	BRD-K24638771-001-01-9	Broad Institute of MIT and Harvard	BRD-K24638771			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2cc(ccc2S1(=O)=O)C#CCC1CCCC1	InChI=1S/C29H40N4O6S/c1-19-16-33(20(2)18-34)40(36,37)27-14-13-24(12-8-11-23-9-6-7-10-23)15-25(27)38-26(19)17-32(5)29(35)30-28-21(3)31-39-22(28)4/h13-15,19-20,23,26,34H,6-7,9-11,16-18H2,1-5H3,(H,30,35)/t19-,20+,26+/m1/s1	DYHTZISNAWRTSH-GOHWNWGWSA-N	572.26685573							95785
BRD-K60741970	LSM-7657		54618255	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17-,23-/m0/s1	SYMAGNSCDPNOSH-QQMNAOGKSA-N	COCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K60741970	BRD-K60741970-001-01-5	Broad Institute of MIT and Harvard	BRD-K60741970			COCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17-,23-/m0/s1	SYMAGNSCDPNOSH-QQMNAOGKSA-N	516.2184265							96278
BRD-K48941706-001-01-9	LSM-17759	BRD-K48941706	54618119	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22+,25+/m1/s1	VKSOWNIUNHUMMN-SLSDLSHTSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)CCN3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K48941706	BRD-K48941706-001-01-9	Broad Institute of MIT and Harvard	BRD-K48941706			CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)CCN3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22+,25+/m1/s1	VKSOWNIUNHUMMN-SLSDLSHTSA-N	498.320605864							106400
BRD-K41790019	LSM-7377		54618263	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20+,25+/m0/s1	UEIRNIQKIBOUIF-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K41790019	BRD-K41790019-001-01-9	Broad Institute of MIT and Harvard	BRD-K41790019			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20+,25+/m0/s1	UEIRNIQKIBOUIF-WZOHSFFVSA-N	485.23482732							95998
BRD-K09749233	LSM-6977		54618383	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17-,23+/m1/s1	SYMAGNSCDPNOSH-QZMQVMSPSA-N	COCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K09749233	BRD-K09749233-001-01-5	Broad Institute of MIT and Harvard	BRD-K09749233			COCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17-,23+/m1/s1	SYMAGNSCDPNOSH-QZMQVMSPSA-N	516.2184265							95598
BRD-K83082136	LSM-7918		54618156	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20-,26-/m0/s1	ZKVMCHGVVVSISB-DYLHXGEVSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)C(=O)c4cccnc4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K83082136	BRD-K83082136-001-01-8	Broad Institute of MIT and Harvard	BRD-K83082136			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20-,26-/m0/s1	ZKVMCHGVVVSISB-DYLHXGEVSA-N	539.209006496							96539
BRD-K47272214	LSM-7451		54618245	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20+,25-/m1/s1	NHORSMPXTAJMFN-OHUGHZGNSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K47272214	BRD-K47272214-001-01-5	Broad Institute of MIT and Harvard	BRD-K47272214			COCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(OC)cc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N2O8S2/c1-19-16-28(20(2)18-29)38(32,33)26-13-8-21(7-6-14-34-4)15-24(26)36-25(19)17-27(3)37(30,31)23-11-9-22(35-5)10-12-23/h8-13,15,19-20,25,29H,14,16-18H2,1-5H3/t19-,20+,25-/m1/s1	NHORSMPXTAJMFN-OHUGHZGNSA-N	566.175657448							96072
BRD-K61861910	LSM-7669		54618143	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17+,23+/m0/s1	SYMAGNSCDPNOSH-YGKZAACZSA-N	COCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K61861910	BRD-K61861910-001-01-3	Broad Institute of MIT and Harvard	BRD-K61861910			COCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17+,23+/m0/s1	SYMAGNSCDPNOSH-YGKZAACZSA-N	516.2184265							96290
CHEMBL2132048	LSM-7630	BRD-K59155687, SID131413442	54618353	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19-,25-/m1/s1	VIOYSSVCFLGZJY-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CC4CC4	BroadT	BRD-K59155687	BRD-K59155687-001-01-5	Broad Institute of MIT and Harvard	BRD-K59155687			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19-,25-/m1/s1	VIOYSSVCFLGZJY-MPCDZSKCSA-N	514.193771002							96251
BRD-K28077119	LSM-7208		54618108	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19-,24-/m1/s1	QHDFXKNEEFSYRF-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccncc4	BroadT	BRD-K28077119	BRD-K28077119-001-01-7	Broad Institute of MIT and Harvard	BRD-K28077119			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19-,24-/m1/s1	QHDFXKNEEFSYRF-KHCICDEESA-N	563.15600529							95829
BRD-K55522699	LSM-43412		54618387	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16-,19+/m1/s1	KGPKEHLIXQTDQP-GAFRDZLWSA-N	C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K55522699	BRD-K55522699-001-01-6	Broad Institute of MIT and Harvard	BRD-K55522699			C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16-,19+/m1/s1	KGPKEHLIXQTDQP-GAFRDZLWSA-N	477.204589832							
BRD-K21152785	LSM-7127		54618147	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19-,26+/m0/s1	KJZOGGIMPWHLRO-LZJCXSABSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K21152785	BRD-K21152785-001-01-8	Broad Institute of MIT and Harvard	BRD-K21152785			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19-,26+/m0/s1	KJZOGGIMPWHLRO-LZJCXSABSA-N	581.22498909							95748
BRD-K44387261	LSM-43397		54618180	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22-,27+/m0/s1	FQANFRRZYSNNGV-OEAKCCBBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K44387261	BRD-K44387261-001-01-6	Broad Institute of MIT and Harvard	BRD-K44387261			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22-,27+/m0/s1	FQANFRRZYSNNGV-OEAKCCBBSA-N	514.258005608							
BRD-K25533536	LSM-7175		54618365	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20-,26-/m0/s1	BVGZNQUUZDWJPB-DYLHXGEVSA-N	COc1ccccc1c2cnc3O[C@@H](CN(C)CC4CCOCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K25533536	BRD-K25533536-001-01-7	Broad Institute of MIT and Harvard	BRD-K25533536			COc1ccccc1-c1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20-,26-/m0/s1	BVGZNQUUZDWJPB-DYLHXGEVSA-N	497.288971378							95796
BRD-K45613561	LSM-7423		54618276	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18+,21+/m1/s1	VEFOSOMUCSIFLK-WKRCXCSHSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#C[C@H](C)O	BroadT	BRD-K45613561	BRD-K45613561-001-01-1	Broad Institute of MIT and Harvard	BRD-K45613561			CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#C[C@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18+,21+/m1/s1	VEFOSOMUCSIFLK-WKRCXCSHSA-N	481.22465656							96044
BRD-K55415928	LSM-7578		54618349	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18-,22-/m0/s1	KCOGFDLBSVUITM-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(cc3C1=O)c4cncnc4	BroadT	BRD-K55415928	BRD-K55415928-001-01-6	Broad Institute of MIT and Harvard	BRD-K55415928			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(cc2C1=O)-c1cncnc1	InChI=1S/C25H34N6O5/c1-17-12-31(18(2)15-32)25(34)21-8-19(20-9-26-16-27-10-20)11-28-24(21)36-22(17)13-29(3)23(33)14-30-4-6-35-7-5-30/h8-11,16-18,22,32H,4-7,12-15H2,1-3H3/t17-,18-,22-/m0/s1	KCOGFDLBSVUITM-SPEDKVCISA-N	498.259068248							96199
BRD-K82957261	LSM-7917		54618210	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17+,23+/m0/s1	YCBIAWRDDHRJGU-YGKZAACZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K82957261	BRD-K82957261-001-01-9	Broad Institute of MIT and Harvard	BRD-K82957261			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17+,23+/m0/s1	YCBIAWRDDHRJGU-YGKZAACZSA-N	493.212532626							96538
BRD-K78120854	LSM-43426		54618317	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23+,28+/m1/s1	DIBJIDYNEHVBAV-KFRKLSNLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K78120854	BRD-K78120854-001-01-3	Broad Institute of MIT and Harvard	BRD-K78120854			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23+,28+/m1/s1	DIBJIDYNEHVBAV-KFRKLSNLSA-N	555.276692132							
BRD-K29438074	LSM-7228		54618225	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22+,27+/m1/s1	UFPGTWMRZCUHBI-VHSZZVNMSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)C#CC4(O)CCCC4)c1	BroadT	BRD-K29438074	BRD-K29438074-001-01-3	Broad Institute of MIT and Harvard	BRD-K29438074			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)C#CC2(O)CCCC2)c1	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22+,27+/m1/s1	UFPGTWMRZCUHBI-VHSZZVNMSA-N	585.250871308							95849
BRD-K27709404	LSM-7198		54618228	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20-,26+/m1/s1	BVGZNQUUZDWJPB-KYTVRQNUSA-N	COc1ccccc1c2cnc3O[C@@H](CN(C)CC4CCOCC4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K27709404	BRD-K27709404-001-01-0	Broad Institute of MIT and Harvard	BRD-K27709404			COc1ccccc1-c1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20-,26+/m1/s1	BVGZNQUUZDWJPB-KYTVRQNUSA-N	497.288971378							95819
BRD-K14161261	LSM-7039		54618372	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19+,25+/m1/s1	UPQGSBDKNNCSHF-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2F)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K14161261	BRD-K14161261-001-01-1	Broad Institute of MIT and Harvard	BRD-K14161261			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2F)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19+,25+/m1/s1	UPQGSBDKNNCSHF-WYEJZRMESA-N	467.258420178							95660
BRD-K52660225	LSM-7531		54618374	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18-,21+/m1/s1	VEFOSOMUCSIFLK-IIMDRIAPSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#C[C@@H](C)O	BroadT	BRD-K52660225	BRD-K52660225-001-01-0	Broad Institute of MIT and Harvard	BRD-K52660225			CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#C[C@@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18-,21+/m1/s1	VEFOSOMUCSIFLK-IIMDRIAPSA-N	481.22465656							96152
BRD-K77703574	LSM-7860		54618300	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22+,27+/m0/s1	UFPGTWMRZCUHBI-OREGWCPLSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)C#CC4(O)CCCC4)c1	BroadT	BRD-K77703574	BRD-K77703574-001-01-6	Broad Institute of MIT and Harvard	BRD-K77703574			COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)C#CC2(O)CCCC2)c1	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22+,27+/m0/s1	UFPGTWMRZCUHBI-OREGWCPLSA-N	585.250871308							96481
BRD-K12633506	LSM-7016		54618322	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18+,21-/m1/s1	VEFOSOMUCSIFLK-OEMYIYORSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#C[C@H](C)O	BroadT	BRD-K12633506	BRD-K12633506-001-01-6	Broad Institute of MIT and Harvard	BRD-K12633506			CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#C[C@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18+,21-/m1/s1	VEFOSOMUCSIFLK-OEMYIYORSA-N	481.22465656							95637
BRD-K69054398	LSM-7769		54618197	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17-,23+/m1/s1	YCBIAWRDDHRJGU-QZMQVMSPSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K69054398	BRD-K69054398-001-01-8	Broad Institute of MIT and Harvard	BRD-K69054398			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17-,23+/m1/s1	YCBIAWRDDHRJGU-QZMQVMSPSA-N	493.212532626							96390
BRD-K46622484	LSM-7440		54618375	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20-,26+/m0/s1	BVGZNQUUZDWJPB-CUVVAGTFSA-N	COc1ccccc1c2cnc3O[C@H](CN(C)CC4CCOCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K46622484	BRD-K46622484-001-01-5	Broad Institute of MIT and Harvard	BRD-K46622484			COc1ccccc1-c1cnc2O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20-,26+/m0/s1	BVGZNQUUZDWJPB-CUVVAGTFSA-N	497.288971378							96061
BRD-K26652457	LSM-7186		54618323	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22+,27-/m1/s1	UFPGTWMRZCUHBI-UMTXDNHDSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)C#CC4(O)CCCC4)c1	BroadT	BRD-K26652457	BRD-K26652457-001-01-9	Broad Institute of MIT and Harvard	BRD-K26652457			COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)C#CC2(O)CCCC2)c1	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22+,27-/m1/s1	UFPGTWMRZCUHBI-UMTXDNHDSA-N	585.250871308							95807
BRD-K74503687-001-01-7	LSM-17760	BRD-K74503687	54618097	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20-,26-/m0/s1	BHKYXVBLKIOFCQ-DYLHXGEVSA-N	COc1ccc(cc1)c2cnc3O[C@@H](CN(C)C(=O)C4CCCCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K74503687	BRD-K74503687-001-01-7	Broad Institute of MIT and Harvard	BRD-K74503687			COc1ccc(cc1)-c1cnc2O[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20-,26-/m0/s1	BHKYXVBLKIOFCQ-DYLHXGEVSA-N	509.288971378							106401
BRD-K22098045	LSM-7137		54618204	InChI=1S/C22H28BrN3O6S/c1-14-11-26(15(2)13-27)22(28)17-9-16(23)10-24-21(17)32-19(14)12-25(3)33(29,30)20-8-6-5-7-18(20)31-4/h5-10,14-15,19,27H,11-13H2,1-4H3/t14-,15+,19-/m1/s1	LJNOUGNZSXLUFQ-ZRGWGRIASA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2Oc3ncc(Br)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K22098045	BRD-K22098045-001-01-8	Broad Institute of MIT and Harvard	BRD-K22098045			COc1ccccc1S(=O)(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C22H28BrN3O6S/c1-14-11-26(15(2)13-27)22(28)17-9-16(23)10-24-21(17)32-19(14)12-25(3)33(29,30)20-8-6-5-7-18(20)31-4/h5-10,14-15,19,27H,11-13H2,1-4H3/t14-,15+,19-/m1/s1	LJNOUGNZSXLUFQ-ZRGWGRIASA-N	541.088218936							95758
BRD-K47716199	LSM-43402		54618328	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23-,28+/m0/s1	DIBJIDYNEHVBAV-RDIUJVSASA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K47716199	BRD-K47716199-001-01-0	Broad Institute of MIT and Harvard	BRD-K47716199			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23-,28+/m0/s1	DIBJIDYNEHVBAV-RDIUJVSASA-N	555.276692132							
BRD-K38996795	LSM-7347		54618136	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19-,24-/m0/s1	QHDFXKNEEFSYRF-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccncc4	BroadT	BRD-K38996795	BRD-K38996795-001-01-7	Broad Institute of MIT and Harvard	BRD-K38996795			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C26H30FN3O6S2/c1-18-15-30(19(2)17-31)38(34,35)26-9-8-21(20-10-12-28-13-11-20)14-23(26)36-24(18)16-29(3)37(32,33)25-7-5-4-6-22(25)27/h4-14,18-19,24,31H,15-17H2,1-3H3/t18-,19-,24-/m0/s1	QHDFXKNEEFSYRF-JXQFQVJHSA-N	563.15600529							95968
BRD-K96839003	LSM-8077		54618100	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20-,26+/m0/s1	BHKYXVBLKIOFCQ-CUVVAGTFSA-N	COc1ccc(cc1)c2cnc3O[C@H](CN(C)C(=O)C4CCCCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K96839003	BRD-K96839003-001-01-6	Broad Institute of MIT and Harvard	BRD-K96839003			COc1ccc(cc1)-c1cnc2O[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20-,26+/m0/s1	BHKYXVBLKIOFCQ-CUVVAGTFSA-N	509.288971378							96698
BRD-K53121826	LSM-7534		54618338	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19-,22-/m1/s1	MFJAJISBYJYJML-WOIUINJBSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K53121826	BRD-K53121826-001-01-5	Broad Institute of MIT and Harvard	BRD-K53121826			CC(C)C#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19-,22-/m1/s1	MFJAJISBYJYJML-WOIUINJBSA-N	538.191976228							96155
BRD-K35810638	LSM-7307		54618121	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20-,24+/m0/s1	ALBVOUUIQWHTKA-MZLICYQSSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K35810638	BRD-K35810638-001-01-4	Broad Institute of MIT and Harvard	BRD-K35810638			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20-,24+/m0/s1	ALBVOUUIQWHTKA-MZLICYQSSA-N	514.224990918							95928
BRD-K14844214	LSM-7052		54618305	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20-,24+/m1/s1	ALBVOUUIQWHTKA-REHUZNOOSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K14844214	BRD-K14844214-001-01-0	Broad Institute of MIT and Harvard	BRD-K14844214			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20-,24+/m1/s1	ALBVOUUIQWHTKA-REHUZNOOSA-N	514.224990918							95673
BRD-K25056189	LSM-8172		54618329	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21+,25+/m0/s1	YPWSXDREONXLFW-BPYKYCOYSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K25056189	BRD-K25056189-001-01-9	Broad Institute of MIT and Harvard	BRD-K25056189			CCCC#Cc1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21+,25+/m0/s1	YPWSXDREONXLFW-BPYKYCOYSA-N	492.26579309							96793
BRD-K67727634	LSM-43420		54618192	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16+,19-/m1/s1	KGPKEHLIXQTDQP-UHESYJEOSA-N	C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K67727634	BRD-K67727634-001-01-5	Broad Institute of MIT and Harvard	BRD-K67727634			C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C22H31N5O5S/c1-6-7-17-8-18-21(23-9-17)32-19(15(2)10-27(22(18)29)16(3)13-28)11-26(5)33(30,31)20-12-25(4)14-24-20/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3/b7-6+/t15-,16+,19-/m1/s1	KGPKEHLIXQTDQP-UHESYJEOSA-N	477.204589832							
MLS003129031	LSM-8012	BRD-K91775327, SID99359640	46904202	InChI=1S/C22H28BrN3O5S/c1-15-12-26(16(2)14-27)32(29,30)21-8-7-17(23)10-19(21)31-20(15)13-25(3)22(28)11-18-6-4-5-9-24-18/h4-10,15-16,20,27H,11-14H2,1-3H3/t15-,16-,20+/m1/s1	VNTYMDDKAMTNEX-QINHECLXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K91775327	BRD-K91775327-001-01-6	Broad Institute of MIT and Harvard	BRD-K91775327			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H28BrN3O5S/c1-15-12-26(16(2)14-27)32(29,30)21-8-7-17(23)10-19(21)31-20(15)13-25(3)22(28)11-18-6-4-5-9-24-18/h4-10,15-16,20,27H,11-14H2,1-3H3/t15-,16-,20+/m1/s1	VNTYMDDKAMTNEX-QINHECLXSA-N	525.093304316							96633
BRD-K68546494	LSM-7765		54618138	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19+,27-/m0/s1	KZMWOMHQUKXWRI-CUMRGQLISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K68546494	BRD-K68546494-001-01-7	Broad Institute of MIT and Harvard	BRD-K68546494			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19+,27-/m0/s1	KZMWOMHQUKXWRI-CUMRGQLISA-N	584.19049719							96386
BRD-K67240417	LSM-7745		54618188	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20+,26+/m1/s1	HDWGWTYDTDHGLT-GOHWNWGWSA-N	COc1cccc(c1)c2ccc3c(O[C@@H](CN(C)C(=O)C4CCOCC4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K67240417	BRD-K67240417-001-01-2	Broad Institute of MIT and Harvard	BRD-K67240417			COc1cccc(c1)-c1ccc2c(O[C@@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20+,26+/m1/s1	HDWGWTYDTDHGLT-GOHWNWGWSA-N	546.239972266							96366
BRD-K66599765	LSM-7737		54618388	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22+,27-/m0/s1	UFPGTWMRZCUHBI-XXAUWVGASA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)C#CC4(O)CCCC4)c1	BroadT	BRD-K66599765	BRD-K66599765-001-01-0	Broad Institute of MIT and Harvard	BRD-K66599765			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)C#CC2(O)CCCC2)c1	InChI=1S/C30H39N3O7S/c1-21-18-33(22(2)20-34)41(37,38)28-11-10-23(12-15-30(36)13-5-6-14-30)16-26(28)40-27(21)19-32(3)29(35)31-24-8-7-9-25(17-24)39-4/h7-11,16-17,21-22,27,34,36H,5-6,13-14,18-20H2,1-4H3,(H,31,35)/t21-,22+,27-/m0/s1	UFPGTWMRZCUHBI-XXAUWVGASA-N	585.250871308							96358
BRD-K13653700	LSM-7032		54618265	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20-,25-/m1/s1	DFIFSWMEHHNDQD-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C#CC(C)(C)O	BroadT	BRD-K13653700	BRD-K13653700-001-01-7	Broad Institute of MIT and Harvard	BRD-K13653700			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C#CC(C)(C)O	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20-,25-/m1/s1	DFIFSWMEHHNDQD-UMEGOILYSA-N	518.22507113							95653
BRD-K78380744	LSM-7873		54618344	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19-,27-/m0/s1	KZMWOMHQUKXWRI-BATDWUPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K78380744	BRD-K78380744-001-01-7	Broad Institute of MIT and Harvard	BRD-K78380744			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19-,27-/m0/s1	KZMWOMHQUKXWRI-BATDWUPUSA-N	584.19049719							96494
BRD-K75460409	LSM-7826		54618226	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19+,25+/m0/s1	UPQGSBDKNNCSHF-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2F)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K75460409	BRD-K75460409-001-01-6	Broad Institute of MIT and Harvard	BRD-K75460409			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2F)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19+,25+/m0/s1	UPQGSBDKNNCSHF-OSWQYVSFSA-N	467.258420178							96447
BRD-K29974036	LSM-43384		54618341	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22-,27-/m1/s1	FQANFRRZYSNNGV-LSSLYOHLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K29974036	BRD-K29974036-001-01-4	Broad Institute of MIT and Harvard	BRD-K29974036			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22-,27-/m1/s1	FQANFRRZYSNNGV-LSSLYOHLSA-N	514.258005608							
BRD-K83712984	LSM-43432		54618218	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22+,27+/m1/s1	FQANFRRZYSNNGV-DXHIJWHGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K83712984	BRD-K83712984-001-01-3	Broad Institute of MIT and Harvard	BRD-K83712984			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22+,27+/m1/s1	FQANFRRZYSNNGV-DXHIJWHGSA-N	514.258005608							
BRD-K20347745	LSM-7118		54618137	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19-,22+/m1/s1	MFJAJISBYJYJML-KNKQGSTJSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K20347745	BRD-K20347745-001-01-4	Broad Institute of MIT and Harvard	BRD-K20347745			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19-,22+/m1/s1	MFJAJISBYJYJML-KNKQGSTJSA-N	538.191976228							95739
BRD-K27841704	LSM-7204		54618146	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18-,21-/m1/s1	VEFOSOMUCSIFLK-NEYJZJCJSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#C[C@@H](C)O	BroadT	BRD-K27841704	BRD-K27841704-001-01-8	Broad Institute of MIT and Harvard	BRD-K27841704			CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#C[C@@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18-,21-/m1/s1	VEFOSOMUCSIFLK-NEYJZJCJSA-N	481.22465656							95825
BRD-K93368389	LSM-43437		54618167	InChI=1S/C24H31FN2O6S2/c1-5-6-19-7-12-24-22(13-19)33-23(17(2)14-27(18(3)16-28)35(24,31)32)15-26(4)34(29,30)21-10-8-20(25)9-11-21/h5-13,17-18,23,28H,14-16H2,1-4H3/b6-5+/t17-,18-,23-/m0/s1	PTEFBLKOTMQJFG-JGGRACFLSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K93368389	BRD-K93368389-001-01-3	Broad Institute of MIT and Harvard	BRD-K93368389			C\C=C\c1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H31FN2O6S2/c1-5-6-19-7-12-24-22(13-19)33-23(17(2)14-27(18(3)16-28)35(24,31)32)15-26(4)34(29,30)21-10-8-20(25)9-11-21/h5-13,17-18,23,28H,14-16H2,1-4H3/b6-5+/t17-,18-,23-/m0/s1	PTEFBLKOTMQJFG-JGGRACFLSA-N	526.160756312							
BRD-K27656392	LSM-7196		54618319	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13-,16+/m0/s1	LKDAMHONCJEZRZ-HEHGZKQESA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K27656392	BRD-K27656392-001-01-7	Broad Institute of MIT and Harvard	BRD-K27656392			CCCNC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13-,16+/m0/s1	LKDAMHONCJEZRZ-HEHGZKQESA-N	456.137218048							95817
BRD-K92627732	LSM-8022		54618348	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20-,26-/m1/s1	BHKYXVBLKIOFCQ-XMERXJNXSA-N	COc1ccc(cc1)c2cnc3O[C@H](CN(C)C(=O)C4CCCCC4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K92627732	BRD-K92627732-001-01-7	Broad Institute of MIT and Harvard	BRD-K92627732			COc1ccc(cc1)-c1cnc2O[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20-,26-/m1/s1	BHKYXVBLKIOFCQ-XMERXJNXSA-N	509.288971378							96643
BRD-K32648402	LSM-7270		54618371	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20-,24-/m0/s1	FLFHXFOLABGIIH-SKPFHBQLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K32648402	BRD-K32648402-001-01-5	Broad Institute of MIT and Harvard	BRD-K32648402			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20-,24-/m0/s1	FLFHXFOLABGIIH-SKPFHBQLSA-N	513.283885998							95891
BRD-K08110534	LSM-43362		54618283	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22-,27+/m1/s1	FQANFRRZYSNNGV-KPUZLRIGSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K08110534	BRD-K08110534-001-01-7	Broad Institute of MIT and Harvard	BRD-K08110534			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22-,27+/m1/s1	FQANFRRZYSNNGV-KPUZLRIGSA-N	514.258005608							
BRD-K92732825-001-01-3	LSM-8026	BRD-K92732825	44488717	InChI=1S/C19H25N3O5S2/c1-13-10-22(14(2)12-23)19(24)15-6-4-8-20-18(15)27-16(13)11-21(3)29(25,26)17-7-5-9-28-17/h4-9,13-14,16,23H,10-12H2,1-3H3/t13-,14+,16-/m0/s1	FCRAAGKQWSLNPW-LZWOXQAQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)Oc3ncccc3C1=O	BroadT	BRD-K92732825	BRD-K92732825-001-01-3	Broad Institute of MIT and Harvard	BRD-K92732825			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)Oc2ncccc2C1=O	InChI=1S/C19H25N3O5S2/c1-13-10-22(14(2)12-23)19(24)15-6-4-8-20-18(15)27-16(13)11-21(3)29(25,26)17-7-5-9-28-17/h4-9,13-14,16,23H,10-12H2,1-3H3/t13-,14+,16-/m0/s1	FCRAAGKQWSLNPW-LZWOXQAQSA-N	439.12356231							96647
MLS003130064	LSM-7592	BRD-K56375979, SID99358648	46903427	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19+,22-/m0/s1	MFJAJISBYJYJML-JQVVWYNYSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K56375979	BRD-K56375979-001-02-7	Broad Institute of MIT and Harvard	BRD-K56375979			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19+,22-/m0/s1	MFJAJISBYJYJML-JQVVWYNYSA-N	538.191976228							96213
BRD-K18724553	LSM-7089		54618161	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18-,21-/m1/s1	VEFOSOMUCSIFLK-BMQTXXJKSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#C[C@@H](C)O	BroadT	BRD-K18724553	BRD-K18724553-001-01-9	Broad Institute of MIT and Harvard	BRD-K18724553			CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#C[C@@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18-,21-/m1/s1	VEFOSOMUCSIFLK-BMQTXXJKSA-N	481.22465656							95710
BRD-K57758244	LSM-7617		54618256	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20+,26-/m0/s1	HDWGWTYDTDHGLT-UNVFRBQDSA-N	COc1cccc(c1)c2ccc3c(O[C@@H](CN(C)C(=O)C4CCOCC4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K57758244	BRD-K57758244-001-01-4	Broad Institute of MIT and Harvard	BRD-K57758244			COc1cccc(c1)-c1ccc2c(O[C@@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20+,26-/m0/s1	HDWGWTYDTDHGLT-UNVFRBQDSA-N	546.239972266							96238
BRD-K57017252	LSM-7600		54618373	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22+,25-/m1/s1	VKSOWNIUNHUMMN-OTNCWRBYSA-N	CCCC#Cc1cnc2O[C@H](CN(C)C(=O)CCN3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K57017252	BRD-K57017252-001-01-4	Broad Institute of MIT and Harvard	BRD-K57017252			CCCC#Cc1cnc2O[C@H](CN(C)C(=O)CCN3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22+,25-/m1/s1	VKSOWNIUNHUMMN-OTNCWRBYSA-N	498.320605864							96221
BRD-K65461993	LSM-7720		54618206	InChI=1S/C22H27N3O4S/c1-15-13-25(16(2)14-26)30(27,28)22-9-8-19(10-20(22)29-21(15)12-24-3)18-6-4-17(11-23)5-7-18/h4-10,15-16,21,24,26H,12-14H2,1-3H3/t15-,16+,21+/m0/s1	IKCZEPNERFQPIU-GCKMJXCFSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K65461993	BRD-K65461993-001-01-8	Broad Institute of MIT and Harvard	BRD-K65461993			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C22H27N3O4S/c1-15-13-25(16(2)14-26)30(27,28)22-9-8-19(10-20(22)29-21(15)12-24-3)18-6-4-17(11-23)5-7-18/h4-10,15-16,21,24,26H,12-14H2,1-3H3/t15-,16+,21+/m0/s1	IKCZEPNERFQPIU-GCKMJXCFSA-N	429.172227064							96341
BRD-K45787391	LSM-7428		54618239	InChI=1S/C24H32N4O4/c1-15-13-28(16(2)14-29)24(31)20-10-19(11-26-22(20)32-21(15)12-25-3)17-7-6-8-18(9-17)23(30)27(4)5/h6-11,15-16,21,25,29H,12-14H2,1-5H3/t15-,16+,21+/m1/s1	JOFZJSROTWODFL-XFQAVAEZSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3cccc(c3)C(=O)N(C)C	BroadT	BRD-K45787391	BRD-K45787391-001-01-9	Broad Institute of MIT and Harvard	BRD-K45787391			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C24H32N4O4/c1-15-13-28(16(2)14-29)24(31)20-10-19(11-26-22(20)32-21(15)12-25-3)17-7-6-8-18(9-17)23(30)27(4)5/h6-11,15-16,21,25,29H,12-14H2,1-5H3/t15-,16+,21+/m1/s1	JOFZJSROTWODFL-XFQAVAEZSA-N	440.242355544							96049
BRD-K51202492	LSM-7506		54618182	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17+,23-/m0/s1	SYMAGNSCDPNOSH-MFEFFIJZSA-N	COCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K51202492	BRD-K51202492-001-01-8	Broad Institute of MIT and Harvard	BRD-K51202492			COCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17+,23-/m0/s1	SYMAGNSCDPNOSH-MFEFFIJZSA-N	516.2184265							96127
BRD-K66149578	LSM-7731		54618258	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13-,16+/m1/s1	LKDAMHONCJEZRZ-IOASZLSFSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K66149578	BRD-K66149578-001-01-1	Broad Institute of MIT and Harvard	BRD-K66149578			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13-,16+/m1/s1	LKDAMHONCJEZRZ-IOASZLSFSA-N	456.137218048							96352
BRD-K36276950	LSM-7313		54618187	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22-,28-/m1/s1	VHCZRFPKNWPULV-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K36276950	BRD-K36276950-001-01-7	Broad Institute of MIT and Harvard	BRD-K36276950			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C30H36N2O6S/c1-20-7-5-6-8-26(20)25-13-14-29-27(15-25)38-28(21(2)16-32(22(3)19-33)39(29,36)37)18-31(4)17-23-9-11-24(12-10-23)30(34)35/h5-15,21-22,28,33H,16-19H2,1-4H3,(H,34,35)/t21-,22-,28-/m1/s1	VHCZRFPKNWPULV-DQCZWYHMSA-N	552.229407582							95934
BRD-K65196043	LSM-7717		54618158	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19+,25+/m0/s1	VIOYSSVCFLGZJY-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CC4CC4	BroadT	BRD-K65196043	BRD-K65196043-001-01-0	Broad Institute of MIT and Harvard	BRD-K65196043			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19+,25+/m0/s1	VIOYSSVCFLGZJY-OSWQYVSFSA-N	514.193771002							96338
BRD-K90827020	LSM-8000		54618355	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20-,27+/m0/s1	ZBKDHRFNQBVZSS-OWOAZTCBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C5=CCCCC5	BroadT	BRD-K90827020	BRD-K90827020-001-01-6	Broad Institute of MIT and Harvard	BRD-K90827020			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H37N3O7S/c1-19-15-32(20(2)17-33)40(35,36)28-12-9-22(21-7-5-4-6-8-21)13-26(28)39-27(19)16-31(3)29(34)30-23-10-11-24-25(14-23)38-18-37-24/h7,9-14,19-20,27,33H,4-6,8,15-18H2,1-3H3,(H,30,34)/t19-,20-,27+/m0/s1	ZBKDHRFNQBVZSS-OWOAZTCBSA-N	571.235221244							96621
BRD-K57461880	LSM-7611		54618235	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19+,25-/m0/s1	UPQGSBDKNNCSHF-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2F)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K57461880	BRD-K57461880-001-01-4	Broad Institute of MIT and Harvard	BRD-K57461880			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2F)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19+,25-/m0/s1	UPQGSBDKNNCSHF-CEYNDMKZSA-N	467.258420178							96232
MLS003129073	LSM-7792	SID99359678, BRD-K70838368	46904240	InChI=1S/C22H28BrN3O6S/c1-14-11-26(15(2)13-27)22(28)17-9-16(23)10-24-21(17)32-19(14)12-25(3)33(29,30)20-8-6-5-7-18(20)31-4/h5-10,14-15,19,27H,11-13H2,1-4H3/t14-,15-,19-/m1/s1	LJNOUGNZSXLUFQ-SPYBWZPUSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2Oc3ncc(Br)cc3C(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K70838368	BRD-K70838368-001-01-7	Broad Institute of MIT and Harvard	BRD-K70838368			COc1ccccc1S(=O)(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C22H28BrN3O6S/c1-14-11-26(15(2)13-27)22(28)17-9-16(23)10-24-21(17)32-19(14)12-25(3)33(29,30)20-8-6-5-7-18(20)31-4/h5-10,14-15,19,27H,11-13H2,1-4H3/t14-,15-,19-/m1/s1	LJNOUGNZSXLUFQ-SPYBWZPUSA-N	541.088218936							96413
BRD-K22065094	LSM-7136		54618354	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20+,25-/m0/s1	UEIRNIQKIBOUIF-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K22065094	BRD-K22065094-001-01-7	Broad Institute of MIT and Harvard	BRD-K22065094			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20+,25-/m0/s1	UEIRNIQKIBOUIF-DFIYOIEZSA-N	485.23482732							95757
BRD-K20582542	LSM-7119		54618246	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21-,25+/m0/s1	YPWSXDREONXLFW-STWLZBDKSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K20582542	BRD-K20582542-001-01-1	Broad Institute of MIT and Harvard	BRD-K20582542			CCCC#Cc1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21-,25+/m0/s1	YPWSXDREONXLFW-STWLZBDKSA-N	492.26579309							95740
BRD-K92889073	LSM-8031		54618174	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17+,21-/m1/s1	NMUQMAVVZJKKCB-LLGFUMIMSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3cncnc3	BroadT	BRD-K92889073	BRD-K92889073-001-01-0	Broad Institute of MIT and Harvard	BRD-K92889073			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cncnc1	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17+,21-/m1/s1	NMUQMAVVZJKKCB-LLGFUMIMSA-N	491.220239896							96652
BRD-K76892938	LSM-7841		54618148	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20+,24-/m0/s1	ALBVOUUIQWHTKA-ROKPMTFOSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K76892938	BRD-K76892938-001-01-9	Broad Institute of MIT and Harvard	BRD-K76892938			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H34N4O5S/c1-18(2)7-6-8-21-9-10-25-23(13-21)35-24(16-29(5)26(32)22-14-27-11-12-28-22)19(3)15-30(20(4)17-31)36(25,33)34/h9-14,18-20,24,31H,7,15-17H2,1-5H3/t19-,20+,24-/m0/s1	ALBVOUUIQWHTKA-ROKPMTFOSA-N	514.224990918							96462
BRD-K55300135	LSM-7576		54618326	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20+,25+/m1/s1	UEIRNIQKIBOUIF-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K55300135	BRD-K55300135-001-01-9	Broad Institute of MIT and Harvard	BRD-K55300135			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20+,25+/m1/s1	UEIRNIQKIBOUIF-RNHFSVANSA-N	485.23482732							96197
BRD-K01556781	LSM-6879		54618272	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19+,25-/m0/s1	VIOYSSVCFLGZJY-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CC4CC4	BroadT	BRD-K01556781	BRD-K01556781-001-01-8	Broad Institute of MIT and Harvard	BRD-K01556781			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19+,25-/m0/s1	VIOYSSVCFLGZJY-CEYNDMKZSA-N	514.193771002							95500
BRD-K16136812	LSM-7066		54618227	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19+,25+/m1/s1	VIOYSSVCFLGZJY-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CC4CC4	BroadT	BRD-K16136812	BRD-K16136812-001-01-5	Broad Institute of MIT and Harvard	BRD-K16136812			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19+,25+/m1/s1	VIOYSSVCFLGZJY-WYEJZRMESA-N	514.193771002							95687
BRD-K74145465	LSM-7819		54618214	InChI=1S/C24H32N4O4/c1-15-13-28(16(2)14-29)24(31)20-10-19(11-26-22(20)32-21(15)12-25-3)17-7-6-8-18(9-17)23(30)27(4)5/h6-11,15-16,21,25,29H,12-14H2,1-5H3/t15-,16-,21-/m0/s1	JOFZJSROTWODFL-QYWGDWMGSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3cccc(c3)C(=O)N(C)C	BroadT	BRD-K74145465	BRD-K74145465-001-01-5	Broad Institute of MIT and Harvard	BRD-K74145465			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C24H32N4O4/c1-15-13-28(16(2)14-29)24(31)20-10-19(11-26-22(20)32-21(15)12-25-3)17-7-6-8-18(9-17)23(30)27(4)5/h6-11,15-16,21,25,29H,12-14H2,1-5H3/t15-,16-,21-/m0/s1	JOFZJSROTWODFL-QYWGDWMGSA-N	440.242355544							96440
BRD-K69096174	LSM-6848		54618368	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19+,26-/m1/s1	KJZOGGIMPWHLRO-UYXZNNOOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K69096174	BRD-K69096174-001-01-9	Broad Institute of MIT and Harvard	BRD-K69096174			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19+,26-/m1/s1	KJZOGGIMPWHLRO-UYXZNNOOSA-N	581.22498909							95469
BRD-K37403152	LSM-7328		54618250	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19-,27-/m1/s1	KZMWOMHQUKXWRI-DRGJWEBESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K37403152	BRD-K37403152-001-01-2	Broad Institute of MIT and Harvard	BRD-K37403152			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C29H30F2N4O5S/c1-18-15-35(19(2)17-36)41(38,39)28-10-7-22(21-6-4-5-20(11-21)14-32)12-26(28)40-27(18)16-34(3)29(37)33-25-13-23(30)8-9-24(25)31/h4-13,18-19,27,36H,15-17H2,1-3H3,(H,33,37)/t18-,19-,27-/m1/s1	KZMWOMHQUKXWRI-DRGJWEBESA-N	584.19049719							95949
MLS003128993	LSM-7846	BRD-K76989634	46904117	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13-,16-/m1/s1	LKDAMHONCJEZRZ-XJKCOSOUSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K76989634	BRD-K76989634-001-02-8	Broad Institute of MIT and Harvard	BRD-K76989634			CCCNC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13-,16-/m1/s1	LKDAMHONCJEZRZ-XJKCOSOUSA-N	456.137218048							96467
BRD-K11930946	LSM-6999		54618224	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13+,16+/m1/s1	LKDAMHONCJEZRZ-WWGRRREGSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K11930946	BRD-K11930946-001-01-5	Broad Institute of MIT and Harvard	BRD-K11930946			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(Br)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13+,16+/m1/s1	LKDAMHONCJEZRZ-WWGRRREGSA-N	456.137218048							95620
BRD-K85158753	LSM-7942		54618277	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18+,21-/m0/s1	VEFOSOMUCSIFLK-OOSNJVJTSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#C[C@@H](C)O	BroadT	BRD-K85158753	BRD-K85158753-001-01-6	Broad Institute of MIT and Harvard	BRD-K85158753			CC(C)NC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#C[C@@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17+,18+,21-/m0/s1	VEFOSOMUCSIFLK-OOSNJVJTSA-N	481.22465656							96563
CHEMBL3183796	LSM-43414	BRD-K58079191	54618364	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23+,28-/m1/s1	DIBJIDYNEHVBAV-CIPLSMMKSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K58079191	BRD-K58079191-001-01-7	Broad Institute of MIT and Harvard	BRD-K58079191			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H41N3O5S/c1-22-19-33(23(2)21-34)39(36,37)29-17-16-25(15-14-24-10-6-4-7-11-24)18-27(29)38-28(22)20-32(3)30(35)31-26-12-8-5-9-13-26/h4,6-7,10-11,14-18,22-23,26,28,34H,5,8-9,12-13,19-21H2,1-3H3,(H,31,35)/b15-14+/t22-,23+,28-/m1/s1	DIBJIDYNEHVBAV-CIPLSMMKSA-N	555.276692132							
BRD-K06486491	LSM-6942		54618175	InChI=1S/C24H32N4O4/c1-15-13-28(16(2)14-29)24(31)20-10-19(11-26-22(20)32-21(15)12-25-3)17-7-6-8-18(9-17)23(30)27(4)5/h6-11,15-16,21,25,29H,12-14H2,1-5H3/t15-,16+,21-/m1/s1	JOFZJSROTWODFL-VWKPWSFCSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3cccc(c3)C(=O)N(C)C	BroadT	BRD-K06486491	BRD-K06486491-001-01-4	Broad Institute of MIT and Harvard	BRD-K06486491			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C24H32N4O4/c1-15-13-28(16(2)14-29)24(31)20-10-19(11-26-22(20)32-21(15)12-25-3)17-7-6-8-18(9-17)23(30)27(4)5/h6-11,15-16,21,25,29H,12-14H2,1-5H3/t15-,16+,21-/m1/s1	JOFZJSROTWODFL-VWKPWSFCSA-N	440.242355544							95563
BRD-K14602451	LSM-7049		54618241	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20-,26-/m1/s1	ZKVMCHGVVVSISB-XMERXJNXSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)C(=O)c4cccnc4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K14602451	BRD-K14602451-001-01-4	Broad Institute of MIT and Harvard	BRD-K14602451			COc1ccccc1-c1ccc2c(O[C@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20-,26-/m1/s1	ZKVMCHGVVVSISB-XMERXJNXSA-N	539.209006496							95670
BRD-K61412007	LSM-7666		54618184	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21-,25+/m1/s1	YPWSXDREONXLFW-OTPAQWSUSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K61412007	BRD-K61412007-001-01-9	Broad Institute of MIT and Harvard	BRD-K61412007			CCCC#Cc1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21-,25+/m1/s1	YPWSXDREONXLFW-OTPAQWSUSA-N	492.26579309							96287
BRD-K14213456	LSM-7042		44505678	InChI=1S/C29H32F3N3O6S/c1-18-15-35(19(2)17-36)28(37)25-12-21(20-7-5-8-22(11-20)29(30,31)32)14-33-27(25)41-26(18)16-34(3)42(38,39)24-10-6-9-23(13-24)40-4/h5-14,18-19,26,36H,15-17H2,1-4H3/t18-,19+,26-/m0/s1	FBFURHXPUDEEJT-ANSQWYIGSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)c4cccc(c4)C(F)(F)F	BroadT	BRD-K14213456	BRD-K14213456-001-01-5	Broad Institute of MIT and Harvard	BRD-K14213456			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cccc(c1)C(F)(F)F	InChI=1S/C29H32F3N3O6S/c1-18-15-35(19(2)17-36)28(37)25-12-21(20-7-5-8-22(11-20)29(30,31)32)14-33-27(25)41-26(18)16-34(3)42(38,39)24-10-6-9-23(13-24)40-4/h5-14,18-19,26,36H,15-17H2,1-4H3/t18-,19+,26-/m0/s1	FBFURHXPUDEEJT-ANSQWYIGSA-N	607.196391064							95663
MLS003128966	LSM-7661	BRD-K60984759, SID99359529	46904091	InChI=1S/C22H28BrN3O5S/c1-15-12-26(16(2)14-27)32(29,30)21-8-7-17(23)10-19(21)31-20(15)13-25(3)22(28)11-18-6-4-5-9-24-18/h4-10,15-16,20,27H,11-14H2,1-3H3/t15-,16-,20-/m0/s1	VNTYMDDKAMTNEX-FTRWYGJKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K60984759	BRD-K60984759-001-01-8	Broad Institute of MIT and Harvard	BRD-K60984759			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H28BrN3O5S/c1-15-12-26(16(2)14-27)32(29,30)21-8-7-17(23)10-19(21)31-20(15)13-25(3)22(28)11-18-6-4-5-9-24-18/h4-10,15-16,20,27H,11-14H2,1-3H3/t15-,16-,20-/m0/s1	VNTYMDDKAMTNEX-FTRWYGJKSA-N	525.093304316							96282
BRD-K26957826	LSM-7188		54618346	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20+,25-/m0/s1	GCPZFZZKEDFKSA-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K26957826	BRD-K26957826-001-01-6	Broad Institute of MIT and Harvard	BRD-K26957826			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C27H36N2O5S/c1-18-5-9-22(10-6-18)23-11-12-26-24(14-23)34-25(16-28(4)27(31)13-21-7-8-21)19(2)15-29(20(3)17-30)35(26,32)33/h5-6,9-12,14,19-21,25,30H,7-8,13,15-17H2,1-4H3/t19-,20+,25-/m0/s1	GCPZFZZKEDFKSA-DFIYOIEZSA-N	500.234492962							95809
CHEMBL2144321	LSM-8033	BRD-K92967681, SID131413213	54618140	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23+,29-/m0/s1	AWBBMFXXCINDIY-CTWZREHQSA-N	COc1ccccc1C#Cc2ccc3c(O[C@@H](CN(C)Cc4cccnc4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K92967681	BRD-K92967681-001-01-8	Broad Institute of MIT and Harvard	BRD-K92967681			COc1ccccc1C#Cc1ccc2c(O[C@@H](CN(C)Cc3cccnc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23+,29-/m0/s1	AWBBMFXXCINDIY-CTWZREHQSA-N	549.22974194							96654
BRD-K63948704	LSM-43418		54618154	InChI=1S/C24H31FN2O6S2/c1-5-6-19-7-12-24-22(13-19)33-23(17(2)14-27(18(3)16-28)35(24,31)32)15-26(4)34(29,30)21-10-8-20(25)9-11-21/h5-13,17-18,23,28H,14-16H2,1-4H3/b6-5+/t17-,18-,23-/m1/s1	PTEFBLKOTMQJFG-CVNGOIGYSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K63948704	BRD-K63948704-001-01-6	Broad Institute of MIT and Harvard	BRD-K63948704			C\C=C\c1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H31FN2O6S2/c1-5-6-19-7-12-24-22(13-19)33-23(17(2)14-27(18(3)16-28)35(24,31)32)15-26(4)34(29,30)21-10-8-20(25)9-11-21/h5-13,17-18,23,28H,14-16H2,1-4H3/b6-5+/t17-,18-,23-/m1/s1	PTEFBLKOTMQJFG-CVNGOIGYSA-N	526.160756312							
BRD-K63757709	LSM-7700		54618221	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20-,25-/m0/s1	UEIRNIQKIBOUIF-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K63757709	BRD-K63757709-001-01-6	Broad Institute of MIT and Harvard	BRD-K63757709			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20-,25-/m0/s1	UEIRNIQKIBOUIF-RLSLOFABSA-N	485.23482732							96321
BRD-K06042430	LSM-6937		54618127	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17-,23-/m0/s1	YCBIAWRDDHRJGU-QQMNAOGKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K06042430	BRD-K06042430-001-01-9	Broad Institute of MIT and Harvard	BRD-K06042430			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17-,23-/m0/s1	YCBIAWRDDHRJGU-QQMNAOGKSA-N	493.212532626							95558
BRD-K19472114	LSM-7101		54618306	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19+,22-/m1/s1	MFJAJISBYJYJML-XQBPLPMBSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K19472114	BRD-K19472114-001-01-6	Broad Institute of MIT and Harvard	BRD-K19472114			CC(C)C#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19+,22-/m1/s1	MFJAJISBYJYJML-XQBPLPMBSA-N	538.191976228							95722
CHEMBL2138062	LSM-7098	BRD-K19414061, SID131413376	54618291	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19+,25-/m1/s1	VIOYSSVCFLGZJY-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CC4CC4	BroadT	BRD-K19414061	BRD-K19414061-001-01-1	Broad Institute of MIT and Harvard	BRD-K19414061			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19+,25-/m1/s1	VIOYSSVCFLGZJY-HHJKRLRDSA-N	514.193771002							95719
BRD-K87721831	LSM-7974		54618347	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20-,24+/m1/s1	FLFHXFOLABGIIH-REHUZNOOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K87721831	BRD-K87721831-001-01-5	Broad Institute of MIT and Harvard	BRD-K87721831			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20-,24+/m1/s1	FLFHXFOLABGIIH-REHUZNOOSA-N	513.283885998							96595
BRD-K99805333	LSM-8101		54618331	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19+,22+/m0/s1	MFJAJISBYJYJML-NNMXDRDESA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K99805333	BRD-K99805333-001-01-5	Broad Institute of MIT and Harvard	BRD-K99805333			CC(C)C#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19+,22+/m0/s1	MFJAJISBYJYJML-NNMXDRDESA-N	538.191976228							96722
BRD-K50965411	LSM-7501		54618213	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22+,28-/m0/s1	FRFGYBSWUNYCIP-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K50965411	BRD-K50965411-001-01-9	Broad Institute of MIT and Harvard	BRD-K50965411			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22+,28-/m0/s1	FRFGYBSWUNYCIP-TYPXCFOJSA-N	565.204670044							96122
CHEMBL2361943	LSM-7360	BRD-K40109091, SID131413218	54618145	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21+,27+/m0/s1	FWJMPRMSYCMNDB-FYQCMVGJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K40109091	BRD-K40109091-001-01-4	Broad Institute of MIT and Harvard	BRD-K40109091			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H36FN3O5S/c1-20-17-33(21(2)19-34)29(35)26-14-23(13-12-22-8-5-4-6-9-22)16-31-28(26)38-27(20)18-32(3)39(36,37)25-11-7-10-24(30)15-25/h7,10-11,14-16,20-22,27,34H,4-6,8-9,17-19H2,1-3H3/t20-,21+,27+/m0/s1	FWJMPRMSYCMNDB-FYQCMVGJSA-N	557.235970172							95981
BRD-K35689168	LSM-7305		54618133	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19-,25+/m1/s1	UPQGSBDKNNCSHF-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2F)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K35689168	BRD-K35689168-001-01-0	Broad Institute of MIT and Harvard	BRD-K35689168			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2F)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H34FN3O3/c1-18-14-31(19(2)17-32)27(33)23-12-22(20-8-4-5-9-20)13-29-26(23)34-25(18)16-30(3)15-21-10-6-7-11-24(21)28/h6-8,10-13,18-19,25,32H,4-5,9,14-17H2,1-3H3/t18-,19-,25+/m1/s1	UPQGSBDKNNCSHF-RRQZXNHTSA-N	467.258420178							95926
BRD-K39562569	LSM-7353		54618311	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20+,26+/m0/s1	ZKVMCHGVVVSISB-OUDXUNEISA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)C(=O)c4cccnc4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K39562569	BRD-K39562569-001-01-0	Broad Institute of MIT and Harvard	BRD-K39562569			COc1ccccc1-c1ccc2c(O[C@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33N3O6S/c1-19-16-31(20(2)18-32)38(34,35)27-12-11-21(23-9-5-6-10-24(23)36-4)14-25(27)37-26(19)17-30(3)28(33)22-8-7-13-29-15-22/h5-15,19-20,26,32H,16-18H2,1-4H3/t19-,20+,26+/m0/s1	ZKVMCHGVVVSISB-OUDXUNEISA-N	539.209006496							95974
BRD-K29350630	LSM-7227		54618209	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17-,21+/m0/s1	NMUQMAVVZJKKCB-XGHQBKJUSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3cncnc3	BroadT	BRD-K29350630	BRD-K29350630-001-01-7	Broad Institute of MIT and Harvard	BRD-K29350630			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1cncnc1	InChI=1S/C23H33N5O5S/c1-5-8-26-23(30)27(4)13-21-16(2)12-28(17(3)14-29)34(31,32)22-7-6-18(9-20(22)33-21)19-10-24-15-25-11-19/h6-7,9-11,15-17,21,29H,5,8,12-14H2,1-4H3,(H,26,30)/t16-,17-,21+/m0/s1	NMUQMAVVZJKKCB-XGHQBKJUSA-N	491.220239896							95848
BRD-K76960042	LSM-7843		54618160	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22-,28+/m0/s1	FRFGYBSWUNYCIP-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K76960042	BRD-K76960042-001-01-7	Broad Institute of MIT and Harvard	BRD-K76960042			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C30H32FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-11-9-23(8-10-25-6-4-5-7-26(25)31)16-27(29)39-28(21)19-33(3)30(36)17-24-12-14-32-15-13-24/h4-7,9,11-16,21-22,28,35H,17-20H2,1-3H3/t21-,22-,28+/m0/s1	FRFGYBSWUNYCIP-RXYILKCJSA-N	565.204670044							96464
BRD-K20806007	LSM-7120		54618110	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23+,29+/m0/s1	AWBBMFXXCINDIY-QFWOEDSFSA-N	COc1ccccc1C#Cc2ccc3c(O[C@H](CN(C)Cc4cccnc4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K20806007	BRD-K20806007-001-01-2	Broad Institute of MIT and Harvard	BRD-K20806007			COc1ccccc1C#Cc1ccc2c(O[C@H](CN(C)Cc3cccnc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23+,29+/m0/s1	AWBBMFXXCINDIY-QFWOEDSFSA-N	549.22974194							95741
BRD-K78232231	LSM-7870		54618386	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20+,26+/m0/s1	HDWGWTYDTDHGLT-OUDXUNEISA-N	COc1cccc(c1)c2ccc3c(O[C@H](CN(C)C(=O)C4CCOCC4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K78232231	BRD-K78232231-001-01-0	Broad Institute of MIT and Harvard	BRD-K78232231			COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H38N2O7S/c1-19-16-30(20(2)18-31)38(33,34)27-9-8-23(22-6-5-7-24(14-22)35-4)15-25(27)37-26(19)17-29(3)28(32)21-10-12-36-13-11-21/h5-9,14-15,19-21,26,31H,10-13,16-18H2,1-4H3/t19-,20+,26+/m0/s1	HDWGWTYDTDHGLT-OUDXUNEISA-N	546.239972266							96491
BRD-K17618128	LSM-7078		54618274	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21-,25-/m1/s1	YPWSXDREONXLFW-DNRQZRRGSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K17618128	BRD-K17618128-001-01-0	Broad Institute of MIT and Harvard	BRD-K17618128			CCCC#Cc1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H40N2O5S/c1-5-6-7-8-22-9-10-26-24(15-22)33-25(18-27(4)17-23-11-13-32-14-12-23)20(2)16-28(21(3)19-29)34(26,30)31/h9-10,15,20-21,23,25,29H,5-6,11-14,16-19H2,1-4H3/t20-,21-,25-/m1/s1	YPWSXDREONXLFW-DNRQZRRGSA-N	492.26579309							95699
BRD-K14990409	LSM-43372		54618201	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18-,23+/m1/s1	FNIHZEFWPVWWQI-BULGAWEHSA-N	C\C=C\c1cnc2O[C@@H](CN(C)Cc3cccc(c3)C(=O)O)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K14990409	BRD-K14990409-001-01-6	Broad Institute of MIT and Harvard	BRD-K14990409			C\C=C\c1cnc2O[C@@H](CN(C)Cc3cccc(c3)C(O)=O)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-7-19-11-22-24(27-12-19)34-23(17(2)13-29(25(22)31)18(3)16-30)15-28(4)14-20-8-6-9-21(10-20)26(32)33/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,32,33)/b7-5+/t17-,18-,23+/m1/s1	FNIHZEFWPVWWQI-BULGAWEHSA-N	467.242021186							
BRD-K29908513	LSM-7233		54618247	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19+,22+/m1/s1	MFJAJISBYJYJML-DXIQSLLYSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K29908513	BRD-K29908513-001-01-4	Broad Institute of MIT and Harvard	BRD-K29908513			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H34N4O6S2/c1-17(2)7-8-20-9-10-23-21(11-20)34-22(18(3)12-28(19(4)15-29)35(23,30)31)13-27(6)36(32,33)24-14-26(5)16-25-24/h9-11,14,16-19,22,29H,12-13,15H2,1-6H3/t18-,19+,22+/m1/s1	MFJAJISBYJYJML-DXIQSLLYSA-N	538.191976228							95854
BRD-K39685923	LSM-7355		44505076	InChI=1S/C30H38N4O5/c1-19-16-34(20(2)18-35)29(36)24-13-22(26-14-21-9-7-8-12-25(21)38-26)15-31-28(24)39-27(19)17-33(3)30(37)32-23-10-5-4-6-11-23/h7-9,12-15,19-20,23,27,35H,4-6,10-11,16-18H2,1-3H3,(H,32,37)/t19-,20+,27-/m0/s1	KMTGVSKWCLJEFS-VKIDHGPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ncc(cc3C1=O)c4oc5ccccc5c4	BroadT	BRD-K39685923	BRD-K39685923-001-01-0	Broad Institute of MIT and Harvard	BRD-K39685923			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ncc(cc2C1=O)-c1cc2ccccc2o1	InChI=1S/C30H38N4O5/c1-19-16-34(20(2)18-35)29(36)24-13-22(26-14-21-9-7-8-12-25(21)38-26)15-31-28(24)39-27(19)17-33(3)30(37)32-23-10-5-4-6-11-23/h7-9,12-15,19-20,23,27,35H,4-6,10-11,16-18H2,1-3H3,(H,32,37)/t19-,20+,27-/m0/s1	KMTGVSKWCLJEFS-VKIDHGPPSA-N	534.284220356							95976
BRD-K05130619	LSM-6926		54618321	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20+,26-/m1/s1	BHKYXVBLKIOFCQ-BVFVYWQFSA-N	COc1ccc(cc1)c2cnc3O[C@H](CN(C)C(=O)C4CCCCC4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K05130619	BRD-K05130619-001-01-6	Broad Institute of MIT and Harvard	BRD-K05130619			COc1ccc(cc1)-c1cnc2O[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H39N3O5/c1-19-16-32(20(2)18-33)29(35)25-14-23(21-10-12-24(36-4)13-11-21)15-30-27(25)37-26(19)17-31(3)28(34)22-8-6-5-7-9-22/h10-15,19-20,22,26,33H,5-9,16-18H2,1-4H3/t19-,20+,26-/m1/s1	BHKYXVBLKIOFCQ-BVFVYWQFSA-N	509.288971378							95547
BRD-K27728416	LSM-7199		54618282	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17-,23+/m0/s1	YCBIAWRDDHRJGU-HKARXFIJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K27728416	BRD-K27728416-001-01-6	Broad Institute of MIT and Harvard	BRD-K27728416			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C26H28FN5O4/c1-16-13-32(17(2)15-33)25(34)20-10-18(19-6-4-5-7-21(19)27)11-30-24(20)36-23(16)14-31(3)26(35)22-12-28-8-9-29-22/h4-12,16-17,23,33H,13-15H2,1-3H3/t16-,17-,23+/m0/s1	YCBIAWRDDHRJGU-HKARXFIJSA-N	493.212532626							95820
BRD-K87260976	LSM-7968		54618301	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18-,21+/m0/s1	VEFOSOMUCSIFLK-RYLXDESZSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#C[C@H](C)O	BroadT	BRD-K87260976	BRD-K87260976-001-01-9	Broad Institute of MIT and Harvard	BRD-K87260976			CC(C)NC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#C[C@H](C)O	InChI=1S/C23H35N3O6S/c1-15(2)24-23(29)25(6)13-21-16(3)12-26(17(4)14-27)33(30,31)22-10-9-19(8-7-18(5)28)11-20(22)32-21/h9-11,15-18,21,27-28H,12-14H2,1-6H3,(H,24,29)/t16-,17-,18-,21+/m0/s1	VEFOSOMUCSIFLK-RYLXDESZSA-N	481.22465656							96589
BRD-K72913973	LSM-7806		54618183	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20+,24-/m0/s1	FLFHXFOLABGIIH-ROKPMTFOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K72913973	BRD-K72913973-001-01-3	Broad Institute of MIT and Harvard	BRD-K72913973			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20+,24-/m0/s1	FLFHXFOLABGIIH-ROKPMTFOSA-N	513.283885998							96427
BRD-K00463020	LSM-6865		54618377	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20+,24+/m0/s1	FLFHXFOLABGIIH-DCLXLUIPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K00463020	BRD-K00463020-001-01-9	Broad Institute of MIT and Harvard	BRD-K00463020			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H39N3O6/c1-19-16-31(20(2)18-32)27(34)23-14-21(6-11-28(35)9-4-5-10-28)15-29-25(23)37-24(19)17-30(3)26(33)22-7-12-36-13-8-22/h14-15,19-20,22,24,32,35H,4-5,7-10,12-13,16-18H2,1-3H3/t19-,20+,24+/m0/s1	FLFHXFOLABGIIH-DCLXLUIPSA-N	513.283885998							95486
BRD-K54595160	LSM-7562		54618244	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20+,25-/m0/s1	DFIFSWMEHHNDQD-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C#CC(C)(C)O	BroadT	BRD-K54595160	BRD-K54595160-001-01-3	Broad Institute of MIT and Harvard	BRD-K54595160			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C#CC(C)(C)O	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20+,25-/m0/s1	DFIFSWMEHHNDQD-DFIYOIEZSA-N	518.22507113							96183
BRD-K63345683	LSM-7692		54618117	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19-,26+/m1/s1	KJZOGGIMPWHLRO-UDCNLSRBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K63345683	BRD-K63345683-001-01-0	Broad Institute of MIT and Harvard	BRD-K63345683			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19-,26+/m1/s1	KJZOGGIMPWHLRO-UDCNLSRBSA-N	581.22498909							96313
BRD-K77221985	LSM-7849		54618285	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20+,26-/m0/s1	BVGZNQUUZDWJPB-UNVFRBQDSA-N	COc1ccccc1c2cnc3O[C@@H](CN(C)CC4CCOCC4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K77221985	BRD-K77221985-001-01-2	Broad Institute of MIT and Harvard	BRD-K77221985			COc1ccccc1-c1cnc2O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O5/c1-19-15-31(20(2)18-32)28(33)24-13-22(23-7-5-6-8-25(23)34-4)14-29-27(24)36-26(19)17-30(3)16-21-9-11-35-12-10-21/h5-8,13-14,19-21,26,32H,9-12,15-18H2,1-4H3/t19-,20+,26-/m0/s1	BVGZNQUUZDWJPB-UNVFRBQDSA-N	497.288971378							96470
BRD-K12092185	LSM-7004		54618292	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19+,26-/m0/s1	KJZOGGIMPWHLRO-ANSQWYIGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K12092185	BRD-K12092185-001-01-3	Broad Institute of MIT and Harvard	BRD-K12092185			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C30H30F3N5O4/c1-18-15-38(19(2)17-39)28(40)25-12-22(21-6-4-20(13-34)5-7-21)14-35-27(25)42-26(18)16-37(3)29(41)36-24-10-8-23(9-11-24)30(31,32)33/h4-12,14,18-19,26,39H,15-17H2,1-3H3,(H,36,41)/t18-,19+,26-/m0/s1	KJZOGGIMPWHLRO-ANSQWYIGSA-N	581.22498909							95625
BRD-K01651394	LSM-43355		54618370	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22+,27-/m1/s1	FQANFRRZYSNNGV-FANHLJFXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K01651394	BRD-K01651394-001-01-6	Broad Institute of MIT and Harvard	BRD-K01651394			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H34N4O4/c1-21-18-34(22(2)20-35)30(37)26-14-25(12-11-23-8-5-4-6-9-23)17-32-29(26)38-27(21)19-33(3)28(36)15-24-10-7-13-31-16-24/h4-14,16-17,21-22,27,35H,15,18-20H2,1-3H3/b12-11+/t21-,22+,27-/m1/s1	FQANFRRZYSNNGV-FANHLJFXSA-N	514.258005608							
BRD-K40052948	LSM-7358		54618314	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19-,25+/m0/s1	VIOYSSVCFLGZJY-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)C#CC4CC4	BroadT	BRD-K40052948	BRD-K40052948-001-01-1	Broad Institute of MIT and Harvard	BRD-K40052948			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C27H31FN2O5S/c1-18-15-30(19(2)17-31)36(33,34)26-12-11-21(10-9-20-7-8-20)13-24(26)35-25(18)16-29(3)27(32)22-5-4-6-23(28)14-22/h4-6,11-14,18-20,25,31H,7-8,15-17H2,1-3H3/t18-,19-,25+/m0/s1	VIOYSSVCFLGZJY-XHNVNVPESA-N	514.193771002							95979
BRD-K26245595	LSM-7180		54618109	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17-,23+/m0/s1	SYMAGNSCDPNOSH-HKARXFIJSA-N	COCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K26245595	BRD-K26245595-001-01-5	Broad Institute of MIT and Harvard	BRD-K26245595			COCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cc(F)ccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H30F2N4O5/c1-16-13-32(17(2)15-33)25(34)20-10-18(6-5-9-36-4)12-29-24(20)37-23(16)14-31(3)26(35)30-22-11-19(27)7-8-21(22)28/h7-8,10-12,16-17,23,33H,9,13-15H2,1-4H3,(H,30,35)/t16-,17-,23+/m0/s1	SYMAGNSCDPNOSH-HKARXFIJSA-N	516.2184265							95801
BRD-K77423370	LSM-7856		54618212	InChI=1S/C24H32N4O4/c1-15-13-28(16(2)14-29)24(31)20-10-19(11-26-22(20)32-21(15)12-25-3)17-7-6-8-18(9-17)23(30)27(4)5/h6-11,15-16,21,25,29H,12-14H2,1-5H3/t15-,16+,21+/m0/s1	JOFZJSROTWODFL-GCKMJXCFSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3cccc(c3)C(=O)N(C)C	BroadT	BRD-K77423370	BRD-K77423370-001-01-7	Broad Institute of MIT and Harvard	BRD-K77423370			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C24H32N4O4/c1-15-13-28(16(2)14-29)24(31)20-10-19(11-26-22(20)32-21(15)12-25-3)17-7-6-8-18(9-17)23(30)27(4)5/h6-11,15-16,21,25,29H,12-14H2,1-5H3/t15-,16+,21+/m0/s1	JOFZJSROTWODFL-GCKMJXCFSA-N	440.242355544							96477
MLS003130173	LSM-7445	BRD-K46849651, SID99358822	46903571	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22+,25+/m0/s1	VKSOWNIUNHUMMN-SGIRGMQISA-N	CCCC#Cc1cnc2O[C@H](CN(C)C(=O)CCN3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K46849651	BRD-K46849651-001-02-9	Broad Institute of MIT and Harvard	BRD-K46849651			CCCC#Cc1cnc2O[C@H](CN(C)C(=O)CCN3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H42N4O4/c1-5-6-8-11-23-16-24-27(29-17-23)36-25(21(2)18-32(28(24)35)22(3)20-33)19-30(4)26(34)12-15-31-13-9-7-10-14-31/h16-17,21-22,25,33H,5-7,9-10,12-15,18-20H2,1-4H3/t21-,22+,25+/m0/s1	VKSOWNIUNHUMMN-SGIRGMQISA-N	498.320605864							96066
BRD-K86872145	LSM-7961		54618211	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23-,29-/m0/s1	AWBBMFXXCINDIY-BOSRLCDASA-N	COc1ccccc1C#Cc2ccc3c(O[C@@H](CN(C)Cc4cccnc4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K86872145	BRD-K86872145-001-01-8	Broad Institute of MIT and Harvard	BRD-K86872145			COc1ccccc1C#Cc1ccc2c(O[C@@H](CN(C)Cc3cccnc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H35N3O5S/c1-22-18-33(23(2)21-34)39(35,36)30-14-12-24(11-13-26-9-5-6-10-27(26)37-4)16-28(30)38-29(22)20-32(3)19-25-8-7-15-31-17-25/h5-10,12,14-17,22-23,29,34H,18-21H2,1-4H3/t22-,23-,29-/m0/s1	AWBBMFXXCINDIY-BOSRLCDASA-N	549.22974194							96582
BRD-K71004332	LSM-7794		54618335	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20-,25+/m0/s1	UEIRNIQKIBOUIF-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K71004332	BRD-K71004332-001-01-8	Broad Institute of MIT and Harvard	BRD-K71004332			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H35N3O4S/c1-19-15-29(20(2)18-30)34(31,32)26-12-11-22(21-8-4-5-9-21)14-24(26)33-25(19)17-28(3)16-23-10-6-7-13-27-23/h6-8,10-14,19-20,25,30H,4-5,9,15-18H2,1-3H3/t19-,20-,25+/m0/s1	UEIRNIQKIBOUIF-ZYLNGJIFSA-N	485.23482732							96415
BRD-K84271926	LSM-7931		54618177	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13+,16+/m0/s1	LKDAMHONCJEZRZ-WOSRLPQWSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K84271926	BRD-K84271926-001-01-0	Broad Institute of MIT and Harvard	BRD-K84271926			CCCNC(=O)N(C)C[C@H]1Oc2ncc(Br)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C19H29BrN4O4/c1-5-6-21-19(27)23(4)10-16-12(2)9-24(13(3)11-25)18(26)15-7-14(20)8-22-17(15)28-16/h7-8,12-13,16,25H,5-6,9-11H2,1-4H3,(H,21,27)/t12-,13+,16+/m0/s1	LKDAMHONCJEZRZ-WOSRLPQWSA-N	456.137218048							96552
BRD-K86236946	LSM-7950		44505696	InChI=1S/C24H29N3O3/c1-17-14-27(18(2)16-28)24(29)21-12-20(11-10-19-8-6-5-7-9-19)13-25-23(21)30-22(17)15-26(3)4/h5-9,12-13,17-18,22,28H,14-16H2,1-4H3/t17-,18+,22-/m0/s1	QMORQNHXMKKFEQ-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ncc(cc2C1=O)C#Cc3ccccc3	BroadT	BRD-K86236946	BRD-K86236946-001-01-7	Broad Institute of MIT and Harvard	BRD-K86236946			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ncc(cc2C1=O)C#Cc1ccccc1	InChI=1S/C24H29N3O3/c1-17-14-27(18(2)16-28)24(29)21-12-20(11-10-19-8-6-5-7-9-19)13-25-23(21)30-22(17)15-26(3)4/h5-9,12-13,17-18,22,28H,14-16H2,1-4H3/t17-,18+,22-/m0/s1	QMORQNHXMKKFEQ-SVMVAKDDSA-N	407.220891818							96571
BRD-K64930281	LSM-7714		54618232	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20-,25-/m0/s1	DFIFSWMEHHNDQD-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc3cc(ccc3S1(=O)=O)C#CC(C)(C)O	BroadT	BRD-K64930281	BRD-K64930281-001-01-4	Broad Institute of MIT and Harvard	BRD-K64930281			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc2cc(ccc2S1(=O)=O)C#CC(C)(C)O	InChI=1S/C27H35FN2O5S/c1-19-15-30(20(2)18-31)36(33,34)26-11-8-21(12-13-27(3,4)32)14-24(26)35-25(19)17-29(5)16-22-6-9-23(28)10-7-22/h6-11,14,19-20,25,31-32H,15-18H2,1-5H3/t19-,20-,25-/m0/s1	DFIFSWMEHHNDQD-RLSLOFABSA-N	518.22507113							96335
BRD-K78493876	LSM-17761		54634133	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22-,27+/m1/s1	DDLXNYQUNGDADK-LOYIFYEOSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K78493876	BRD-K78493876-001-01-8	Broad Institute of MIT and Harvard	BRD-K78493876			CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C29H41N3O4/c1-6-10-28(33)30-24-13-14-26-25(17-24)29(34)31(4)19-27(35-5)21(2)18-32(22(3)20-36-26)16-15-23-11-8-7-9-12-23/h7-9,11-14,17,21-22,27H,6,10,15-16,18-20H2,1-5H3,(H,30,33)/t21-,22-,27+/m1/s1	DDLXNYQUNGDADK-LOYIFYEOSA-N	495.309706822							106402
BRD-K16526787	LSM-17762		54634077	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18-,23+/m0/s1	GKKKBEGITMWCFG-IUKKYPGJSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3cncnc3)[C@@H](C)COc2c1	BroadT	BRD-K16526787	BRD-K16526787-001-01-8	Broad Institute of MIT and Harvard	BRD-K16526787			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C25H35N5O4/c1-6-24(31)28-20-7-8-21-22(9-20)34-15-18(3)30(13-19-10-26-16-27-11-19)12-17(2)23(33-5)14-29(4)25(21)32/h7-11,16-18,23H,6,12-15H2,1-5H3,(H,28,31)/t17-,18-,23+/m0/s1	GKKKBEGITMWCFG-IUKKYPGJSA-N	469.26890465							106403
BRD-K68056389	LSM-17763		54634117	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m1/s1	BTNLJZNTSQHFEG-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K68056389	BRD-K68056389-001-01-5	Broad Institute of MIT and Harvard	BRD-K68056389			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m1/s1	BTNLJZNTSQHFEG-SAHWJRBASA-N	488.219033286							106404
BRD-K05250921	LSM-17764		54634060	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17+,22-/m1/s1	FTTNYZAODGCOSV-HYFFOGBASA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K05250921	BRD-K05250921-001-01-5	Broad Institute of MIT and Harvard	BRD-K05250921			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17+,22-/m1/s1	FTTNYZAODGCOSV-HYFFOGBASA-N	459.273321314							106405
BRD-K60758969	LSM-17765		54634089	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24-/m1/s1	BDMDWUGESBMSSG-NXMSCROESA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H]1C)OC	BroadT	BRD-K60758969	BRD-K60758969-001-01-2	Broad Institute of MIT and Harvard	BRD-K60758969			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24-/m1/s1	BDMDWUGESBMSSG-NXMSCROESA-N	514.25914846							106406
BRD-K29936219	LSM-17766		54634066	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	UUMXXNLKKOYIII-IXFSTUDKSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K29936219	BRD-K29936219-001-01-2	Broad Institute of MIT and Harvard	BRD-K29936219			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-8-10-27-11-9-19)18(2)15-36-22-7-6-20(28-24(31)16-34-4)12-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	UUMXXNLKKOYIII-IXFSTUDKSA-N	498.247834848							106407
BRD-K86349956	LSM-17767		54633904	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17+,22+/m0/s1	JUIHLWHRNYURSY-GSHUGGBRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K86349956	BRD-K86349956-001-01-5	Broad Institute of MIT and Harvard	BRD-K86349956			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17+,22+/m0/s1	JUIHLWHRNYURSY-GSHUGGBRSA-N	474.284220356							106408
BRD-K21312826	LSM-17768		54633964	InChI=1S/C27H35N3O6/c1-18-14-30(25(31)17-34-4)19(2)16-36-23-13-21(28-26(32)20-9-7-6-8-10-20)11-12-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,32)/t18-,19+,24+/m0/s1	RXTVBUOGJRMDEF-XLNZFTOWSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K21312826	BRD-K21312826-001-01-9	Broad Institute of MIT and Harvard	BRD-K21312826			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H35N3O6/c1-18-14-30(25(31)17-34-4)19(2)16-36-23-13-21(28-26(32)20-9-7-6-8-10-20)11-12-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,32)/t18-,19+,24+/m0/s1	RXTVBUOGJRMDEF-XLNZFTOWSA-N	497.25258587							106409
BRD-K83185986	LSM-17769		54634068	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26+/m1/s1	FNWJNXZWDLFJNZ-KYTVRQNUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc4ccccc4)C[C@H]1C	BroadT	BRD-K83185986	BRD-K83185986-001-01-0	Broad Institute of MIT and Harvard	BRD-K83185986			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc2ccccc2)C[C@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26+/m1/s1	FNWJNXZWDLFJNZ-KYTVRQNUSA-N	479.278406694							106410
BRD-K89742282	LSM-17770		54633841	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19+/m0/s1	LLKOVVHLWKWLBT-QMTMVMCOSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K89742282	BRD-K89742282-001-01-3	Broad Institute of MIT and Harvard	BRD-K89742282			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19+/m0/s1	LLKOVVHLWKWLBT-QMTMVMCOSA-N	455.209006496							106411
BRD-K92367471	LSM-17771		54633854	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	XXTDQFHOFKGJNQ-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K92367471	BRD-K92367471-001-01-5	Broad Institute of MIT and Harvard	BRD-K92367471			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	XXTDQFHOFKGJNQ-MCFFVMPBSA-N	474.203383222							106412
BRD-K70712801	LSM-17772		54633857	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22-/m0/s1	XXTDQFHOFKGJNQ-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K70712801	BRD-K70712801-001-01-9	Broad Institute of MIT and Harvard	BRD-K70712801			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22-/m0/s1	XXTDQFHOFKGJNQ-WCJKSRRJSA-N	474.203383222							106413
BRD-K95875837	LSM-17773		54634049	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26+/m1/s1	LAJHXMOWUUWHRC-GOHWNWGWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K95875837	BRD-K95875837-001-01-3	Broad Institute of MIT and Harvard	BRD-K95875837			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26+/m1/s1	LAJHXMOWUUWHRC-GOHWNWGWSA-N	500.336255928							106414
MLS003650032	LSM-17774	BRD-K65440031, SID125305336	53382692	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	XXTDQFHOFKGJNQ-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K65440031	BRD-K65440031-001-01-6	Broad Institute of MIT and Harvard	BRD-K65440031			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	XXTDQFHOFKGJNQ-ZMPRRUGASA-N	474.203383222							106415
BRD-K82517280	LSM-17775		54633832	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20+,25+/m1/s1	VGEAOMRMXWKHAS-RNHFSVANSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K82517280	BRD-K82517280-001-01-8	Broad Institute of MIT and Harvard	BRD-K82517280			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20+,25+/m1/s1	VGEAOMRMXWKHAS-RNHFSVANSA-N	546.251205666							106416
BRD-K03254663	LSM-17776		54634004	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-7-6-10-27-12-19)18(2)15-36-22-11-20(28-24(31)16-34-4)8-9-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	LTGSPNUZXQNZNT-YZZKKUAISA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3cccnc3	BroadT	BRD-K03254663	BRD-K03254663-001-01-1	Broad Institute of MIT and Harvard	BRD-K03254663			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2cccnc2)c1	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-7-6-10-27-12-19)18(2)15-36-22-11-20(28-24(31)16-34-4)8-9-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	LTGSPNUZXQNZNT-YZZKKUAISA-N	498.247834848							106417
BRD-K25236390	LSM-17777		54633892	InChI=1S/C24H33N3O5S/c1-16-6-9-20(10-7-16)33(29,30)26-19-8-11-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23-/m0/s1	CPSLRTTUHRJLDR-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K25236390	BRD-K25236390-001-01-2	Broad Institute of MIT and Harvard	BRD-K25236390			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O5S/c1-16-6-9-20(10-7-16)33(29,30)26-19-8-11-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23-/m0/s1	CPSLRTTUHRJLDR-IXFSTUDKSA-N	475.214091876							106418
BRD-K60830482	LSM-17778		54633858	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	XXTDQFHOFKGJNQ-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K60830482	BRD-K60830482-001-01-7	Broad Institute of MIT and Harvard	BRD-K60830482			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	XXTDQFHOFKGJNQ-DMPWYTOCSA-N	474.203383222							106419
BRD-K87712055	LSM-17779		54634038	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18+,24-/m1/s1	UMCPMTYKFZLTFT-NXMSCROESA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K87712055	BRD-K87712055-001-01-3	Broad Institute of MIT and Harvard	BRD-K87712055			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18+,24-/m1/s1	UMCPMTYKFZLTFT-NXMSCROESA-N	499.248249418							106420
BRD-K95010912	LSM-17780		54633870	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m1/s1	FTRBQWVEVPNQIS-QWQRMKEZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K95010912	BRD-K95010912-001-01-5	Broad Institute of MIT and Harvard	BRD-K95010912			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m1/s1	FTRBQWVEVPNQIS-QWQRMKEZSA-N	413.198441812							106421
BRD-K81144230	LSM-17781		54633865	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18+/m0/s1	FTRBQWVEVPNQIS-SUNYJGFJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K81144230	BRD-K81144230-001-01-3	Broad Institute of MIT and Harvard	BRD-K81144230			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-9-15(20-28(6,24)25)7-8-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18+/m0/s1	FTRBQWVEVPNQIS-SUNYJGFJSA-N	413.198441812							106422
BRD-K58774452	LSM-17782		54633899	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21-/m0/s1	RPMIXOPEMBQBTD-FIKGOQFSSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K58774452	BRD-K58774452-001-01-7	Broad Institute of MIT and Harvard	BRD-K58774452			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H]1C)OC	InChI=1S/C24H38N4O5/c1-8-22(29)28-12-16(4)21(32-7)13-27(6)23(30)19-11-18(26-24(31)25-15(2)3)9-10-20(19)33-14-17(28)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21-/m0/s1	RPMIXOPEMBQBTD-FIKGOQFSSA-N	462.284220356							106423
BRD-K98264372	LSM-17783		54634110	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20+,26-/m0/s1	UCVSNTHCJARTNZ-UNVFRBQDSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc4cccc(F)c4)C[C@@H]1C	BroadT	BRD-K98264372	BRD-K98264372-001-01-8	Broad Institute of MIT and Harvard	BRD-K98264372			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc2cccc(F)c2)C[C@@H]1C	InChI=1S/C28H36FN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-12-23(31-40(36,37)27-16-32(3)18-30-27)9-10-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20+,26-/m0/s1	UCVSNTHCJARTNZ-UNVFRBQDSA-N	573.242118192							106424
BRD-K46699670	LSM-17784		54633902	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17-,22+/m0/s1	JUIHLWHRNYURSY-PNLZDCPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K46699670	BRD-K46699670-001-01-7	Broad Institute of MIT and Harvard	BRD-K46699670			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17-,22+/m0/s1	JUIHLWHRNYURSY-PNLZDCPESA-N	474.284220356							106425
BRD-K26543702	LSM-17785		54634031	InChI=1S/C22H31F6N3O5S/c1-14-10-31(8-7-21(23,24)25)15(2)12-36-18-9-16(29-37(33,34)13-22(26,27)28)5-6-17(18)20(32)30(3)11-19(14)35-4/h5-6,9,14-15,19,29H,7-8,10-13H2,1-4H3/t14-,15-,19-/m1/s1	BYLLLMVPWHFWDU-SPYBWZPUSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K26543702	BRD-K26543702-001-01-3	Broad Institute of MIT and Harvard	BRD-K26543702			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C22H31F6N3O5S/c1-14-10-31(8-7-21(23,24)25)15(2)12-36-18-9-16(29-37(33,34)13-22(26,27)28)5-6-17(18)20(32)30(3)11-19(14)35-4/h5-6,9,14-15,19,29H,7-8,10-13H2,1-4H3/t14-,15-,19-/m1/s1	BYLLLMVPWHFWDU-SPYBWZPUSA-N	563.188861012							106426
BRD-K90103010	LSM-17786		54633919	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m0/s1	XAICKZHKLVEFIU-AXHZCLLHSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K90103010	BRD-K90103010-001-01-4	Broad Institute of MIT and Harvard	BRD-K90103010			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m0/s1	XAICKZHKLVEFIU-AXHZCLLHSA-N	496.268570292							106427
BRD-K99048639	LSM-17787		54634085	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m0/s1	BDMDWUGESBMSSG-LLJLJFOGSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H]1C)OC	BroadT	BRD-K99048639	BRD-K99048639-001-01-3	Broad Institute of MIT and Harvard	BRD-K99048639			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m0/s1	BDMDWUGESBMSSG-LLJLJFOGSA-N	514.25914846							106428
BRD-K89142472	LSM-17788		54634042	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19+,25+/m0/s1	AMXKABWGEBMLDF-OSWQYVSFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CC4CCCC4)C[C@@H]1C	BroadT	BRD-K89142472	BRD-K89142472-001-01-6	Broad Institute of MIT and Harvard	BRD-K89142472			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CC2CCCC2)C[C@@H]1C	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19+,25+/m0/s1	AMXKABWGEBMLDF-OSWQYVSFSA-N	471.309706822							106429
BRD-K28258038	LSM-17789		54633982	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m0/s1	NSJHBAKZFARZIY-SUNYJGFJSA-N	CCC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K28258038	BRD-K28258038-001-01-1	Broad Institute of MIT and Harvard	BRD-K28258038			CCC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m0/s1	NSJHBAKZFARZIY-SUNYJGFJSA-N	377.231456502							106430
BRD-K11476310	LSM-17790		54633844	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19-/m1/s1	LLKOVVHLWKWLBT-ZRGWGRIASA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K11476310	BRD-K11476310-001-01-7	Broad Institute of MIT and Harvard	BRD-K11476310			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19-/m1/s1	LLKOVVHLWKWLBT-ZRGWGRIASA-N	455.209006496							106431
BRD-K00938872	LSM-17791		54634056	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m1/s1	FTTNYZAODGCOSV-YVHKJVDXSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K00938872	BRD-K00938872-001-01-9	Broad Institute of MIT and Harvard	BRD-K00938872			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-10-11-21-20(12-19)25(31)27(4)14-22(32-5)16(2)13-28(17(3)15-33-21)24(30)18-8-7-9-18/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m1/s1	FTTNYZAODGCOSV-YVHKJVDXSA-N	459.273321314							106432
BRD-K46412655	LSM-17792		54633973	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20+,26-/m0/s1	UBWMIYXJQVYFAA-UNVFRBQDSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K46412655	BRD-K46412655-001-01-4	Broad Institute of MIT and Harvard	BRD-K46412655			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20+,26-/m0/s1	UBWMIYXJQVYFAA-UNVFRBQDSA-N	499.284634926							106433
BRD-K89806367	LSM-17793		54634069	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26+/m0/s1	FNWJNXZWDLFJNZ-CUVVAGTFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc4ccccc4)C[C@@H]1C	BroadT	BRD-K89806367	BRD-K89806367-001-01-4	Broad Institute of MIT and Harvard	BRD-K89806367			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc2ccccc2)C[C@@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26+/m0/s1	FNWJNXZWDLFJNZ-CUVVAGTFSA-N	479.278406694							106434
BRD-K28008176	LSM-17794		54633861	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-8-15(21-14(3)23)6-7-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13-,18-/m0/s1	PEWYMSZXRIJNLE-LXIYXOSZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K28008176	BRD-K28008176-001-01-2	Broad Institute of MIT and Harvard	BRD-K28008176			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-8-15(21-14(3)23)6-7-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13-,18-/m0/s1	PEWYMSZXRIJNLE-LXIYXOSZSA-N	363.215806438							106435
BRD-K19852577	LSM-17795		54633942	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20-/m0/s1	PIHZSTWBUFPGGZ-YRNRMSPPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K19852577	BRD-K19852577-001-01-9	Broad Institute of MIT and Harvard	BRD-K19852577			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20-/m0/s1	PIHZSTWBUFPGGZ-YRNRMSPPSA-N	420.273655672							106436
BRD-K54510565	LSM-17796		54634030	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19+,24-/m1/s1	LZTQTXILMDYHIK-YDIMBITNSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K54510565	BRD-K54510565-001-01-3	Broad Institute of MIT and Harvard	BRD-K54510565			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19+,24-/m1/s1	LZTQTXILMDYHIK-YDIMBITNSA-N	498.295453756							106437
BRD-K02535446	LSM-17797		54633932	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19+/m0/s1	LHCHELWHGOXDMN-QMTMVMCOSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(C)[C@H](C)COc2c1	BroadT	BRD-K02535446	BRD-K02535446-001-01-8	Broad Institute of MIT and Harvard	BRD-K02535446			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19+/m0/s1	LHCHELWHGOXDMN-QMTMVMCOSA-N	407.242021186							106438
BRD-K94275706	LSM-17798		54633890	InChI=1S/C24H33N3O5S/c1-16-6-9-20(10-7-16)33(29,30)26-19-8-11-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23+/m1/s1	CPSLRTTUHRJLDR-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K94275706	BRD-K94275706-001-01-5	Broad Institute of MIT and Harvard	BRD-K94275706			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H33N3O5S/c1-16-6-9-20(10-7-16)33(29,30)26-19-8-11-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23+/m1/s1	CPSLRTTUHRJLDR-STSQHVNTSA-N	475.214091876							106439
BRD-K05748221	LSM-17799		54633966	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27-/m1/s1	VDJCKUULTDNAAX-LGVUCKNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc5ccncc5)C[C@H]1C	BroadT	BRD-K05748221	BRD-K05748221-001-01-5	Broad Institute of MIT and Harvard	BRD-K05748221			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27-/m1/s1	VDJCKUULTDNAAX-LGVUCKNBSA-N	573.24097534							106440
BRD-K27372445	LSM-17800		54633996	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17+,21-/m0/s1	DYVIHJNOYXUPHK-FVJLSDCUSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	BroadT	BRD-K27372445	BRD-K27372445-001-01-8	Broad Institute of MIT and Harvard	BRD-K27372445			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17+,21-/m0/s1	DYVIHJNOYXUPHK-FVJLSDCUSA-N	498.251205666							106441
BRD-K68270916	LSM-17801		54634073	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26-/m1/s1	FNWJNXZWDLFJNZ-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc4ccccc4)C[C@H]1C	BroadT	BRD-K68270916	BRD-K68270916-001-01-4	Broad Institute of MIT and Harvard	BRD-K68270916			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc2ccccc2)C[C@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20-,26-/m1/s1	FNWJNXZWDLFJNZ-XMERXJNXSA-N	479.278406694							106442
BRD-K95121261	LSM-17802		54633838	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19+/m0/s1	LLKOVVHLWKWLBT-YZVOILCLSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K95121261	BRD-K95121261-001-01-7	Broad Institute of MIT and Harvard	BRD-K95121261			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19+/m0/s1	LLKOVVHLWKWLBT-YZVOILCLSA-N	455.209006496							106443
BRD-K87942399	LSM-17803		54633945	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m0/s1	VIFILZSBWJHORO-PNLZDCPESA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K87942399	BRD-K87942399-001-01-1	Broad Institute of MIT and Harvard	BRD-K87942399			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m0/s1	VIFILZSBWJHORO-PNLZDCPESA-N	459.273321314							106444
BRD-K03381861	LSM-17804		54634084	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m1/s1	BDMDWUGESBMSSG-GGUMNFRJSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H]1C)OC	BroadT	BRD-K03381861	BRD-K03381861-001-01-2	Broad Institute of MIT and Harvard	BRD-K03381861			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H]1C)OC	InChI=1S/C27H35FN4O5/c1-6-25(33)32-14-17(2)24(36-5)15-31(4)26(34)22-11-10-21(13-23(22)37-16-18(32)3)30-27(35)29-20-9-7-8-19(28)12-20/h7-13,17-18,24H,6,14-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m1/s1	BDMDWUGESBMSSG-GGUMNFRJSA-N	514.25914846							106445
BRD-K11726285	LSM-17805		54633931	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19+/m1/s1	LHCHELWHGOXDMN-VCBZYWHSSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(C)[C@@H](C)COc2c1	BroadT	BRD-K11726285	BRD-K11726285-001-01-6	Broad Institute of MIT and Harvard	BRD-K11726285			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19+/m1/s1	LHCHELWHGOXDMN-VCBZYWHSSA-N	407.242021186							106446
BRD-K74754874	LSM-17806		54634002	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)27-12-15(2)21(31-6)13-26(5)22(29)19-11-18(25-17(4)28)8-9-20(19)32-14-16(27)3/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H,24,30)(H,25,28)/t15-,16-,21-/m0/s1	ISTJSGUPMUQIIL-QYWGDWMGSA-N	CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K74754874	BRD-K74754874-001-01-9	Broad Institute of MIT and Harvard	BRD-K74754874			CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)27-12-15(2)21(31-6)13-26(5)22(29)19-11-18(25-17(4)28)8-9-20(19)32-14-16(27)3/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H,24,30)(H,25,28)/t15-,16-,21-/m0/s1	ISTJSGUPMUQIIL-QYWGDWMGSA-N	448.268570292							106447
BRD-K02329600	LSM-17807		54634098	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20-,25+/m0/s1	OXVANDDYVOZFBN-ZYLNGJIFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K02329600	BRD-K02329600-001-01-8	Broad Institute of MIT and Harvard	BRD-K02329600			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20-,25+/m0/s1	OXVANDDYVOZFBN-ZYLNGJIFSA-N	510.284220356							106448
BRD-K91576495	LSM-17808		54634046	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20-,26-/m1/s1	LAJHXMOWUUWHRC-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K91576495	BRD-K91576495-001-01-4	Broad Institute of MIT and Harvard	BRD-K91576495			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20-,26-/m1/s1	LAJHXMOWUUWHRC-XMERXJNXSA-N	500.336255928							106449
BRD-K32145037	LSM-17809		54633886	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19+,25-/m0/s1	JVEUQFVGQSVVLY-CEYNDMKZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K32145037	BRD-K32145037-001-01-5	Broad Institute of MIT and Harvard	BRD-K32145037			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19+,25-/m0/s1	JVEUQFVGQSVVLY-CEYNDMKZSA-N	580.212233344							106450
BRD-K29077209	LSM-17810		54634009	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17-,22+/m1/s1	QEZINBTXCCLULH-YVHKJVDXSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K29077209	BRD-K29077209-001-01-7	Broad Institute of MIT and Harvard	BRD-K29077209			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C25H33N5O6/c1-16-12-30(25(33)20-11-26-8-9-27-20)17(2)14-36-21-7-6-18(28-23(31)15-34-4)10-19(21)24(32)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,31)/t16-,17-,22+/m1/s1	QEZINBTXCCLULH-YVHKJVDXSA-N	499.243083826							106451
BRD-K93726930	LSM-17811		54633893	InChI=1S/C24H33N3O5S/c1-16-6-9-20(10-7-16)33(29,30)26-19-8-11-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23-/m1/s1	CPSLRTTUHRJLDR-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K93726930	BRD-K93726930-001-01-6	Broad Institute of MIT and Harvard	BRD-K93726930			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H33N3O5S/c1-16-6-9-20(10-7-16)33(29,30)26-19-8-11-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23-/m1/s1	CPSLRTTUHRJLDR-IEGUWTFLSA-N	475.214091876							106452
BRD-K95913506	LSM-17812		54634141	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18+,24+/m1/s1	UCVRUKRGUKDLJG-YTZAWJCFSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K95913506	BRD-K95913506-001-01-2	Broad Institute of MIT and Harvard	BRD-K95913506			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H34FN3O6/c1-17-13-31(25(32)16-35-4)18(2)15-37-23-11-10-21(29-26(33)19-6-8-20(28)9-7-19)12-22(23)27(34)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,33)/t17-,18+,24+/m1/s1	UCVRUKRGUKDLJG-YTZAWJCFSA-N	515.243164038							106453
BRD-K28108927	LSM-17813		54633929	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15-,19+/m1/s1	LHCHELWHGOXDMN-CLCXKQKWSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(C)[C@H](C)COc2c1	BroadT	BRD-K28108927	BRD-K28108927-001-01-2	Broad Institute of MIT and Harvard	BRD-K28108927			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15-,19+/m1/s1	LHCHELWHGOXDMN-CLCXKQKWSA-N	407.242021186							106454
BRD-K35001076	LSM-17814		54633916	InChI=1S/C31H37N5O6/c1-20-17-36(31(39)34-24-10-6-7-12-26(24)40-4)21(2)19-42-27-16-22(33-29(37)25-11-8-9-15-32-25)13-14-23(27)30(38)35(3)18-28(20)41-5/h6-16,20-21,28H,17-19H2,1-5H3,(H,33,37)(H,34,39)/t20-,21-,28-/m1/s1	MAGDLAGVXKMTFQ-UMQWNRPGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4ccccc4OC	BroadT	BRD-K35001076	BRD-K35001076-001-01-9	Broad Institute of MIT and Harvard	BRD-K35001076			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1ccccc1OC	InChI=1S/C31H37N5O6/c1-20-17-36(31(39)34-24-10-6-7-12-26(24)40-4)21(2)19-42-27-16-22(33-29(37)25-11-8-9-15-32-25)13-14-23(27)30(38)35(3)18-28(20)41-5/h6-16,20-21,28H,17-19H2,1-5H3,(H,33,37)(H,34,39)/t20-,21-,28-/m1/s1	MAGDLAGVXKMTFQ-UMQWNRPGSA-N	575.274383954							106455
BRD-K11741103	LSM-17815		54633908	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13-,17-/m1/s1	VYMZHXXUXXOUBO-PBFPGSCMSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K11741103	BRD-K11741103-001-01-5	Broad Institute of MIT and Harvard	BRD-K11741103			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-8-14(20-27(5,23)24)6-7-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13-,17-/m1/s1	VYMZHXXUXXOUBO-PBFPGSCMSA-N	399.182791748							106456
BRD-K36847650	LSM-17816		54634074	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26-/m0/s1	FNWJNXZWDLFJNZ-UNVFRBQDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc4ccccc4)C[C@@H]1C	BroadT	BRD-K36847650	BRD-K36847650-001-01-8	Broad Institute of MIT and Harvard	BRD-K36847650			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc2ccccc2)C[C@@H]1C	InChI=1S/C28H37N3O4/c1-19-15-31(16-21-8-6-5-7-9-21)20(2)18-35-25-13-12-23(29-27(32)22-10-11-22)14-24(25)28(33)30(3)17-26(19)34-4/h5-9,12-14,19-20,22,26H,10-11,15-18H2,1-4H3,(H,29,32)/t19-,20+,26-/m0/s1	FNWJNXZWDLFJNZ-UNVFRBQDSA-N	479.278406694							106457
BRD-K02778838	LSM-17817		54633946	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17+,22+/m1/s1	VIFILZSBWJHORO-JLHGSKIFSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K02778838	BRD-K02778838-001-01-0	Broad Institute of MIT and Harvard	BRD-K02778838			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17+,22+/m1/s1	VIFILZSBWJHORO-JLHGSKIFSA-N	459.273321314							106458
BRD-K45101864	LSM-17818		54633930	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15-,19+/m0/s1	LHCHELWHGOXDMN-YZVOILCLSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(C)[C@@H](C)COc2c1	BroadT	BRD-K45101864	BRD-K45101864-001-01-1	Broad Institute of MIT and Harvard	BRD-K45101864			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15-,19+/m0/s1	LHCHELWHGOXDMN-YZVOILCLSA-N	407.242021186							106459
BRD-K03730976	LSM-17819		54633871	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	LTXUUMGQLHONAZ-AXHZCLLHSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K03730976	BRD-K03730976-001-01-2	Broad Institute of MIT and Harvard	BRD-K03730976			CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O4/c1-6-25(31)28-21-9-10-23-22(12-21)26(32)29(4)16-24(33-5)18(2)14-30(19(3)17-34-23)15-20-8-7-11-27-13-20/h7-13,18-19,24H,6,14-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	LTXUUMGQLHONAZ-AXHZCLLHSA-N	468.273655672							106460
BRD-K09972656	LSM-17820		54633834	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20-,25-/m0/s1	VGEAOMRMXWKHAS-RLSLOFABSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K09972656	BRD-K09972656-001-01-1	Broad Institute of MIT and Harvard	BRD-K09972656			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C27H38N4O6S/c1-18(2)28-27(33)31-15-19(3)25(36-6)16-30(5)26(32)23-13-12-21(14-24(23)37-17-20(31)4)29-38(34,35)22-10-8-7-9-11-22/h7-14,18-20,25,29H,15-17H2,1-6H3,(H,28,33)/t19-,20-,25-/m0/s1	VGEAOMRMXWKHAS-RLSLOFABSA-N	546.251205666							106461
BRD-K57830670	LSM-17821		54634099	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20+,25+/m1/s1	OXVANDDYVOZFBN-RNHFSVANSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K57830670	BRD-K57830670-001-01-4	Broad Institute of MIT and Harvard	BRD-K57830670			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C28H38N4O5/c1-19-15-32(26(33)17-30(3)4)20(2)18-37-24-13-12-22(29-27(34)21-10-8-7-9-11-21)14-23(24)28(35)31(5)16-25(19)36-6/h7-14,19-20,25H,15-18H2,1-6H3,(H,29,34)/t19-,20+,25+/m1/s1	OXVANDDYVOZFBN-RNHFSVANSA-N	510.284220356							106462
BRD-K29903249	LSM-17822		54634095	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	MPHSNZGGXIVNOW-GLDPYIMESA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccncc3)[C@H](C)COc2c1	BroadT	BRD-K29903249	BRD-K29903249-001-01-6	Broad Institute of MIT and Harvard	BRD-K29903249			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccncc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	MPHSNZGGXIVNOW-GLDPYIMESA-N	484.268570292							106463
CHEMBL2360608	LSM-17823	BRD-K69171646, SID131430240	54633987	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m0/s1	NSJHBAKZFARZIY-IYOUNJFTSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K69171646	BRD-K69171646-001-01-0	Broad Institute of MIT and Harvard	BRD-K69171646			CCC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-17-16(9-15)20(25)23(4)11-18(26-5)13(2)10-21-14(3)12-27-17/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m0/s1	NSJHBAKZFARZIY-IYOUNJFTSA-N	377.231456502							106464
BRD-K76551930	LSM-18044		54633921	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24+/m0/s1	XAICKZHKLVEFIU-XLNZFTOWSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K76551930	BRD-K76551930-001-01-9	Broad Institute of MIT and Harvard	BRD-K76551930			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24+/m0/s1	XAICKZHKLVEFIU-XLNZFTOWSA-N	496.268570292							106686
BRD-K69073616	LSM-18045		54634122	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m0/s1	VAJTWMVZCANAHM-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K69073616	BRD-K69073616-001-01-4	Broad Institute of MIT and Harvard	BRD-K69073616			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m0/s1	VAJTWMVZCANAHM-YZZKKUAISA-N	445.294056758							106687
BRD-K19457629	LSM-18046		54633891	InChI=1S/C24H33N3O5S/c1-16-6-9-20(10-7-16)33(29,30)26-19-8-11-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23+/m0/s1	CPSLRTTUHRJLDR-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K19457629	BRD-K19457629-001-01-5	Broad Institute of MIT and Harvard	BRD-K19457629			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O5S/c1-16-6-9-20(10-7-16)33(29,30)26-19-8-11-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23+/m0/s1	CPSLRTTUHRJLDR-YZZKKUAISA-N	475.214091876							106688
BRD-K86240647	LSM-18047		54633962	InChI=1S/C27H35N3O6/c1-18-14-30(25(31)17-34-4)19(2)16-36-23-13-21(28-26(32)20-9-7-6-8-10-20)11-12-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,32)/t18-,19-,24+/m0/s1	RXTVBUOGJRMDEF-AXHZCLLHSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K86240647	BRD-K86240647-001-01-1	Broad Institute of MIT and Harvard	BRD-K86240647			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35N3O6/c1-18-14-30(25(31)17-34-4)19(2)16-36-23-13-21(28-26(32)20-9-7-6-8-10-20)11-12-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,32)/t18-,19-,24+/m0/s1	RXTVBUOGJRMDEF-AXHZCLLHSA-N	497.25258587							106689
BRD-K44401972	LSM-18048		54633881	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19-,25+/m1/s1	JVEUQFVGQSVVLY-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K44401972	BRD-K44401972-001-01-5	Broad Institute of MIT and Harvard	BRD-K44401972			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19-,25+/m1/s1	JVEUQFVGQSVVLY-RRQZXNHTSA-N	580.212233344							106690
BRD-K44415466	LSM-18049		54633847	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24+/m0/s1	VNWCVAVKLIIMGX-AXHZCLLHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K44415466	BRD-K44415466-001-01-8	Broad Institute of MIT and Harvard	BRD-K44415466			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24+/m0/s1	VNWCVAVKLIIMGX-AXHZCLLHSA-N	489.22974194							106691
BRD-K27137352	LSM-18050		54634044	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19+,25-/m0/s1	AMXKABWGEBMLDF-CEYNDMKZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CC4CCCC4)C[C@@H]1C	BroadT	BRD-K27137352	BRD-K27137352-001-01-6	Broad Institute of MIT and Harvard	BRD-K27137352			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CC2CCCC2)C[C@@H]1C	InChI=1S/C27H41N3O4/c1-18-14-30(15-20-7-5-6-8-20)19(2)17-34-24-12-11-22(28-26(31)21-9-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h11-13,18-21,25H,5-10,14-17H2,1-4H3,(H,28,31)/t18-,19+,25-/m0/s1	AMXKABWGEBMLDF-CEYNDMKZSA-N	471.309706822							106692
BRD-K87995704	LSM-18051		54634050	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26+/m0/s1	LAJHXMOWUUWHRC-OUDXUNEISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K87995704	BRD-K87995704-001-01-9	Broad Institute of MIT and Harvard	BRD-K87995704			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26+/m0/s1	LAJHXMOWUUWHRC-OUDXUNEISA-N	500.336255928							106693
BRD-K83919473	LSM-18052		54633925	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-8-7-15(20-30(5,24)25)9-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18+/m1/s1	JGILLHKCGZDGGM-GLJUWKHASA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K83919473	BRD-K83919473-001-01-2	Broad Institute of MIT and Harvard	BRD-K83919473			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-8-7-15(20-30(5,24)25)9-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18+/m1/s1	JGILLHKCGZDGGM-GLJUWKHASA-N	477.160341742							106694
BRD-K38111331	LSM-18053		54634090	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m1/s1	MPHSNZGGXIVNOW-KHCICDEESA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccncc3)[C@H](C)COc2c1	BroadT	BRD-K38111331	BRD-K38111331-001-01-4	Broad Institute of MIT and Harvard	BRD-K38111331			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccncc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-8-10-27-11-9-20)19(2)16-35-23-12-21(28-25(31)17-33-4)6-7-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m1/s1	MPHSNZGGXIVNOW-KHCICDEESA-N	484.268570292							106695
BRD-K11487484	LSM-18054		54633971	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20+,26+/m0/s1	UBWMIYXJQVYFAA-OUDXUNEISA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K11487484	BRD-K11487484-001-01-4	Broad Institute of MIT and Harvard	BRD-K11487484			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20+,26+/m0/s1	UBWMIYXJQVYFAA-OUDXUNEISA-N	499.284634926							106696
BRD-K65774385	LSM-18055		54634115	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m1/s1	BTNLJZNTSQHFEG-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K65774385	BRD-K65774385-001-01-0	Broad Institute of MIT and Harvard	BRD-K65774385			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m1/s1	BTNLJZNTSQHFEG-SEPYTNNBSA-N	488.219033286							106697
BRD-K18801549	LSM-18056		54634006	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-7-6-10-27-12-19)18(2)15-36-22-11-20(28-24(31)16-34-4)8-9-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	LTGSPNUZXQNZNT-IXFSTUDKSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3cccnc3	BroadT	BRD-K18801549	BRD-K18801549-001-01-2	Broad Institute of MIT and Harvard	BRD-K18801549			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2cccnc2)c1	InChI=1S/C26H34N4O6/c1-17-13-30(25(32)19-7-6-10-27-12-19)18(2)15-36-22-11-20(28-24(31)16-34-4)8-9-21(22)26(33)29(3)14-23(17)35-5/h6-12,17-18,23H,13-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	LTGSPNUZXQNZNT-IXFSTUDKSA-N	498.247834848							106698
BRD-K84636055	LSM-18057		54633978	InChI=1S/C24H31N5O5/c1-15-12-29(17(3)30)16(2)14-34-21-10-18(27-23(31)20-11-25-8-9-26-20)6-7-19(21)24(32)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,31)/t15-,16-,22-/m1/s1	OXKAOHVNWAVCBO-XCGNWRKASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K84636055	BRD-K84636055-001-01-7	Broad Institute of MIT and Harvard	BRD-K84636055			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C24H31N5O5/c1-15-12-29(17(3)30)16(2)14-34-21-10-18(27-23(31)20-11-25-8-9-26-20)6-7-19(21)24(32)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,31)/t15-,16-,22-/m1/s1	OXKAOHVNWAVCBO-XCGNWRKASA-N	469.232519142							106699
BRD-K09995054	LSM-18058		54633937	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20+/m0/s1	PIHZSTWBUFPGGZ-TWOQFEAHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K09995054	BRD-K09995054-001-01-0	Broad Institute of MIT and Harvard	BRD-K09995054			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20+/m0/s1	PIHZSTWBUFPGGZ-TWOQFEAHSA-N	420.273655672							106700
BRD-K68424387	LSM-18059		54633880	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19-,25-/m1/s1	JVEUQFVGQSVVLY-MPCDZSKCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K68424387	BRD-K68424387-001-01-7	Broad Institute of MIT and Harvard	BRD-K68424387			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19-,25-/m1/s1	JVEUQFVGQSVVLY-MPCDZSKCSA-N	580.212233344							106701
BRD-K42582718	LSM-18060		54633840	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19+/m1/s1	LLKOVVHLWKWLBT-VCBZYWHSSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K42582718	BRD-K42582718-001-01-3	Broad Institute of MIT and Harvard	BRD-K42582718			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19+/m1/s1	LLKOVVHLWKWLBT-VCBZYWHSSA-N	455.209006496							106702
BRD-K75539052	LSM-18061		54634037	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18+,24-/m0/s1	UMCPMTYKFZLTFT-RHGYRFJNSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K75539052	BRD-K75539052-001-01-7	Broad Institute of MIT and Harvard	BRD-K75539052			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18+,24-/m0/s1	UMCPMTYKFZLTFT-RHGYRFJNSA-N	499.248249418							106703
BRD-K32535831	LSM-18062		54633979	InChI=1S/C24H31N5O5/c1-15-12-29(17(3)30)16(2)14-34-21-10-18(27-23(31)20-11-25-8-9-26-20)6-7-19(21)24(32)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,31)/t15-,16+,22-/m0/s1	OXKAOHVNWAVCBO-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K32535831	BRD-K32535831-001-01-5	Broad Institute of MIT and Harvard	BRD-K32535831			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C24H31N5O5/c1-15-12-29(17(3)30)16(2)14-34-21-10-18(27-23(31)20-11-25-8-9-26-20)6-7-19(21)24(32)28(4)13-22(15)33-5/h6-11,15-16,22H,12-14H2,1-5H3,(H,27,31)/t15-,16+,22-/m0/s1	OXKAOHVNWAVCBO-DMPWYTOCSA-N	469.232519142							106704
BRD-K63996931	LSM-18063		54633884	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19+,25+/m0/s1	JVEUQFVGQSVVLY-OSWQYVSFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K63996931	BRD-K63996931-001-01-0	Broad Institute of MIT and Harvard	BRD-K63996931			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19+,25+/m0/s1	JVEUQFVGQSVVLY-OSWQYVSFSA-N	580.212233344							106705
BRD-K89260735	LSM-18064		54633935	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19-/m1/s1	LHCHELWHGOXDMN-ZRGWGRIASA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(C)[C@@H](C)COc2c1	BroadT	BRD-K89260735	BRD-K89260735-001-01-9	Broad Institute of MIT and Harvard	BRD-K89260735			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-9-16(22-20(25)13-27-5)7-8-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19-/m1/s1	LHCHELWHGOXDMN-ZRGWGRIASA-N	407.242021186							131244
BRD-K49903196	LSM-18065		54633839	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19+/m1/s1	LLKOVVHLWKWLBT-CLCXKQKWSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K49903196	BRD-K49903196-001-01-5	Broad Institute of MIT and Harvard	BRD-K49903196			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-10-16(22-31(6,27)28)8-9-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19+/m1/s1	LLKOVVHLWKWLBT-CLCXKQKWSA-N	455.209006496							106708
BRD-K52570793	LSM-18066		54633905	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17-,22-/m0/s1	JUIHLWHRNYURSY-HOIFWPIMSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K52570793	BRD-K52570793-001-01-3	Broad Institute of MIT and Harvard	BRD-K52570793			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C25H38N4O5/c1-16-12-29(23(30)14-27(3)4)17(2)15-34-21-10-9-19(26-24(31)18-7-8-18)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,31)/t16-,17-,22-/m0/s1	JUIHLWHRNYURSY-HOIFWPIMSA-N	474.284220356							106709
BRD-K91575768	LSM-18067		54634036	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18+,24+/m0/s1	UMCPMTYKFZLTFT-HOOSLVGPSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	BroadT	BRD-K91575768	BRD-K91575768-001-01-6	Broad Institute of MIT and Harvard	BRD-K91575768			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H]1C)OC	InChI=1S/C27H34FN3O5/c1-6-25(32)31-14-17(2)24(35-5)15-30(4)27(34)22-12-11-21(13-23(22)36-16-18(31)3)29-26(33)19-7-9-20(28)10-8-19/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)/t17-,18+,24+/m0/s1	UMCPMTYKFZLTFT-HOOSLVGPSA-N	499.248249418							106710
BRD-K17482709	LSM-18068		54633851	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24-/m0/s1	VNWCVAVKLIIMGX-GLDPYIMESA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K17482709	BRD-K17482709-001-01-8	Broad Institute of MIT and Harvard	BRD-K17482709			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-23-22(13-20)25(29)28(5)15-24(32-6)18(2)14-27(4)19(3)16-33-23/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24-/m0/s1	VNWCVAVKLIIMGX-GLDPYIMESA-N	489.22974194							106711
BRD-K85917058	LSM-18069		54633995	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17-,21-/m1/s1	DYVIHJNOYXUPHK-CBGDNZLLSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	BroadT	BRD-K85917058	BRD-K85917058-001-01-7	Broad Institute of MIT and Harvard	BRD-K85917058			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CN(C)C	InChI=1S/C23H38N4O6S/c1-8-34(30,31)24-18-9-10-20-19(11-18)23(29)26(6)13-21(32-7)16(2)12-27(17(3)15-33-20)22(28)14-25(4)5/h9-11,16-17,21,24H,8,12-15H2,1-7H3/t16-,17-,21-/m1/s1	DYVIHJNOYXUPHK-CBGDNZLLSA-N	498.251205666							106712
BRD-K11113009	LSM-18070		54633963	InChI=1S/C27H35N3O6/c1-18-14-30(25(31)17-34-4)19(2)16-36-23-13-21(28-26(32)20-9-7-6-8-10-20)11-12-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,32)/t18-,19+,24+/m1/s1	RXTVBUOGJRMDEF-IMWIBFENSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K11113009	BRD-K11113009-001-01-2	Broad Institute of MIT and Harvard	BRD-K11113009			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35N3O6/c1-18-14-30(25(31)17-34-4)19(2)16-36-23-13-21(28-26(32)20-9-7-6-8-10-20)11-12-22(23)27(33)29(3)15-24(18)35-5/h6-13,18-19,24H,14-17H2,1-5H3,(H,28,32)/t18-,19+,24+/m1/s1	RXTVBUOGJRMDEF-IMWIBFENSA-N	497.25258587							106713
BRD-K46107062	LSM-18071		54634127	InChI=1S/C22H37N3O5S/c1-7-11-25-13-16(3)21(29-6)14-24(5)22(26)19-12-18(23-31(27,28)8-2)9-10-20(19)30-15-17(25)4/h9-10,12,16-17,21,23H,7-8,11,13-15H2,1-6H3/t16-,17-,21+/m1/s1	IIWCVUJRFUKBIA-LZJOCLMNSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@H]1C)OC	BroadT	BRD-K46107062	BRD-K46107062-001-01-7	Broad Institute of MIT and Harvard	BRD-K46107062			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@H]1C)OC	InChI=1S/C22H37N3O5S/c1-7-11-25-13-16(3)21(29-6)14-24(5)22(26)19-12-18(23-31(27,28)8-2)9-10-20(19)30-15-17(25)4/h9-10,12,16-17,21,23H,7-8,11,13-15H2,1-6H3/t16-,17-,21+/m1/s1	IIWCVUJRFUKBIA-LZJOCLMNSA-N	455.245392004							106714
BRD-K16789950	LSM-18072		54633924	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24-/m1/s1	XAICKZHKLVEFIU-YDIMBITNSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K16789950	BRD-K16789950-001-01-3	Broad Institute of MIT and Harvard	BRD-K16789950			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H36N4O5/c1-6-25(32)31-15-18(2)24(35-5)16-30(4)26(33)22-13-12-21(14-23(22)36-17-19(31)3)29-27(34)28-20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24-/m1/s1	XAICKZHKLVEFIU-YDIMBITNSA-N	496.268570292							106715
BRD-K44131977	LSM-18073		54634124	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m1/s1	VAJTWMVZCANAHM-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K44131977	BRD-K44131977-001-01-3	Broad Institute of MIT and Harvard	BRD-K44131977			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H39N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m1/s1	VAJTWMVZCANAHM-IEGUWTFLSA-N	445.294056758							106716
BRD-K20329507	LSM-18074		54634024	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19-,24-/m1/s1	LZTQTXILMDYHIK-KHCICDEESA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K20329507	BRD-K20329507-001-01-0	Broad Institute of MIT and Harvard	BRD-K20329507			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19-,24-/m1/s1	LZTQTXILMDYHIK-KHCICDEESA-N	498.295453756							106717
BRD-K15792876	LSM-18075		54633970	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20+,26+/m1/s1	UBWMIYXJQVYFAA-GOHWNWGWSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K15792876	BRD-K15792876-001-01-9	Broad Institute of MIT and Harvard	BRD-K15792876			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-9-27(33)30-22-12-13-25-23(14-22)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-10-7-8-11-24(21)29/h7-8,10-14,19-20,26H,6,9,15-18H2,1-5H3,(H,30,33)/t19-,20+,26+/m1/s1	UBWMIYXJQVYFAA-GOHWNWGWSA-N	499.284634926							106718
BRD-K79734831	LSM-18076		54633950	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17+,22-/m1/s1	VIFILZSBWJHORO-HYFFOGBASA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K79734831	BRD-K79734831-001-01-8	Broad Institute of MIT and Harvard	BRD-K79734831			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O5/c1-6-23(29)26-19-9-10-20-21(12-19)33-15-17(3)28(24(30)11-18-7-8-18)13-16(2)22(32-5)14-27(4)25(20)31/h9-10,12,16-18,22H,6-8,11,13-15H2,1-5H3,(H,26,29)/t16-,17+,22-/m1/s1	VIFILZSBWJHORO-HYFFOGBASA-N	459.273321314							106719
BRD-K08533345	LSM-18077		54633887	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19+,25-/m1/s1	JVEUQFVGQSVVLY-HHJKRLRDSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K08533345	BRD-K08533345-001-01-9	Broad Institute of MIT and Harvard	BRD-K08533345			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C27H37ClN4O6S/c1-17(2)29-27(34)32-14-18(3)25(37-6)15-31(5)26(33)23-12-9-21(13-24(23)38-16-19(32)4)30-39(35,36)22-10-7-20(28)8-11-22/h7-13,17-19,25,30H,14-16H2,1-6H3,(H,29,34)/t18-,19+,25-/m1/s1	JVEUQFVGQSVVLY-HHJKRLRDSA-N	580.212233344							106720
BRD-K14653235	LSM-18078		54634028	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19+,24+/m0/s1	LZTQTXILMDYHIK-XLNZFTOWSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K14653235	BRD-K14653235-001-01-0	Broad Institute of MIT and Harvard	BRD-K14653235			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H38N6O4/c1-6-9-29-26(34)30-21-7-8-23-22(10-21)25(33)31(4)15-24(35-5)18(2)13-32(19(3)16-36-23)14-20-11-27-17-28-12-20/h7-8,10-12,17-19,24H,6,9,13-16H2,1-5H3,(H2,29,30,34)/t18-,19+,24+/m0/s1	LZTQTXILMDYHIK-XLNZFTOWSA-N	498.295453756							106721
BRD-K81471597	LSM-18079		54633998	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)27-12-15(2)21(31-6)13-26(5)22(29)19-11-18(25-17(4)28)8-9-20(19)32-14-16(27)3/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H,24,30)(H,25,28)/t15-,16+,21+/m1/s1	ISTJSGUPMUQIIL-XFQAVAEZSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K81471597	BRD-K81471597-001-01-7	Broad Institute of MIT and Harvard	BRD-K81471597			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)27-12-15(2)21(31-6)13-26(5)22(29)19-11-18(25-17(4)28)8-9-20(19)32-14-16(27)3/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H,24,30)(H,25,28)/t15-,16+,21+/m1/s1	ISTJSGUPMUQIIL-XFQAVAEZSA-N	448.268570292							131245
BRD-K27335290	LSM-18080		54633999	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)27-12-15(2)21(31-6)13-26(5)22(29)19-11-18(25-17(4)28)8-9-20(19)32-14-16(27)3/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H,24,30)(H,25,28)/t15-,16-,21+/m1/s1	ISTJSGUPMUQIIL-ZOCZFRKYSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K27335290	BRD-K27335290-001-01-1	Broad Institute of MIT and Harvard	BRD-K27335290			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H]1C)OC	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)27-12-15(2)21(31-6)13-26(5)22(29)19-11-18(25-17(4)28)8-9-20(19)32-14-16(27)3/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H,24,30)(H,25,28)/t15-,16-,21+/m1/s1	ISTJSGUPMUQIIL-ZOCZFRKYSA-N	448.268570292							106724
BRD-K62676049	LSM-12233		54631436	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-6-5-11-28-13-20)18(2)16-36-23-10-9-21(29-25(32)19-7-8-19)12-22(23)27(34)30(3)15-24(17)35-4/h5-6,9-13,17-19,24H,7-8,14-16H2,1-4H3,(H,29,32)/t17-,18-,24-/m0/s1	DILHJWACXDWAEF-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4cccnc4	BroadT	BRD-K62676049	BRD-K62676049-001-01-8	Broad Institute of MIT and Harvard	BRD-K62676049			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1cccnc1	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-6-5-11-28-13-20)18(2)16-36-23-10-9-21(29-25(32)19-7-8-19)12-22(23)27(34)30(3)15-24(17)35-4/h5-6,9-13,17-19,24H,7-8,14-16H2,1-4H3,(H,29,32)/t17-,18-,24-/m0/s1	DILHJWACXDWAEF-XFAGBWLFSA-N	494.252920228							100859
CHEMBL3182510	LSM-12629	BRD-K68836298	54631434	InChI=1S/C25H31F3N4O4/c1-15-12-29-16(2)14-36-21-10-9-19(11-20(21)23(33)32(3)13-22(15)35-4)31-24(34)30-18-7-5-17(6-8-18)25(26,27)28/h5-11,15-16,22,29H,12-14H2,1-4H3,(H2,30,31,34)/t15-,16+,22+/m1/s1	GXRZKRPKTHFHBM-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(cc3)C(F)(F)F)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K68836298	BRD-K68836298-001-01-0	Broad Institute of MIT and Harvard	BRD-K68836298			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(cc3)C(F)(F)F)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H31F3N4O4/c1-15-12-29-16(2)14-36-21-10-9-19(11-20(21)23(33)32(3)13-22(15)35-4)31-24(34)30-18-7-5-17(6-8-18)25(26,27)28/h5-11,15-16,22,29H,12-14H2,1-4H3,(H2,30,31,34)/t15-,16+,22+/m1/s1	GXRZKRPKTHFHBM-VVBPWWLESA-N	508.229740112							101262
BRD-K85672685	LSM-13671		54631577	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	VSOIFNIWZGPCNV-RNHFSVANSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K85672685	BRD-K85672685-001-01-9	Broad Institute of MIT and Harvard	BRD-K85672685			CCCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	VSOIFNIWZGPCNV-RNHFSVANSA-N	473.325356886							102318
BRD-K06250012	LSM-8794		54631372	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16-,20-/m0/s1	CQZVRHUHRGDROH-FTRWYGJKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(Cc3nccs3)C[C@@H]1C	BroadT	BRD-K06250012	BRD-K06250012-001-01-4	Broad Institute of MIT and Harvard	BRD-K06250012			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16-,20-/m0/s1	CQZVRHUHRGDROH-FTRWYGJKSA-N	564.168796112							97415
BRD-K88074877	LSM-13836		54631510	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16-,20+/m1/s1	CQZVRHUHRGDROH-QINHECLXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(Cc3nccs3)C[C@H]1C	BroadT	BRD-K88074877	BRD-K88074877-001-01-3	Broad Institute of MIT and Harvard	BRD-K88074877			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16-,20+/m1/s1	CQZVRHUHRGDROH-QINHECLXSA-N	564.168796112							102487
BRD-K63938446	LSM-12330		54631280	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	ZGJMWZDWXNCIBA-YZZKKUAISA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	BroadT	BRD-K63938446	BRD-K63938446-001-01-0	Broad Institute of MIT and Harvard	BRD-K63938446			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	ZGJMWZDWXNCIBA-YZZKKUAISA-N	469.26890465							100957
BRD-K38740852	LSM-10777		54631373	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24+/m0/s1	MGTDWSJKTZULMI-WOGXIUBCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K38740852	BRD-K38740852-001-01-9	Broad Institute of MIT and Harvard	BRD-K38740852			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24+/m0/s1	MGTDWSJKTZULMI-WOGXIUBCSA-N	500.243498396							99398
BRD-K46792957	LSM-11285		54631442	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16-,20+/m0/s1	CQZVRHUHRGDROH-TWOQFEAHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(Cc3nccs3)C[C@@H]1C	BroadT	BRD-K46792957	BRD-K46792957-001-01-4	Broad Institute of MIT and Harvard	BRD-K46792957			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16-,20+/m0/s1	CQZVRHUHRGDROH-TWOQFEAHSA-N	564.168796112							99906
BRD-K24758440	LSM-9932		54631370	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24+/m0/s1	DDFXZAACYDZOLE-XLNZFTOWSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(CC3CCCCC3)C[C@@H]1C	BroadT	BRD-K24758440	BRD-K24758440-001-01-6	Broad Institute of MIT and Harvard	BRD-K24758440			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24+/m0/s1	DDFXZAACYDZOLE-XLNZFTOWSA-N	495.276692132							98553
BRD-K43971874	LSM-11112		54631321	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16+,21+/m0/s1	HNVRJEXAKGMODG-GCKMJXCFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K43971874	BRD-K43971874-001-01-7	Broad Institute of MIT and Harvard	BRD-K43971874			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16+,21+/m0/s1	HNVRJEXAKGMODG-GCKMJXCFSA-N	482.19877617							99733
BRD-K17806071	LSM-9499		54631452	InChI=1S/C30H35ClN4O6S/c1-20-17-35(29(36)14-22-6-5-13-32-16-22)21(2)19-41-27-15-24(33-42(38,39)25-10-7-23(31)8-11-25)9-12-26(27)30(37)34(3)18-28(20)40-4/h5-13,15-16,20-21,28,33H,14,17-19H2,1-4H3/t20-,21-,28-/m1/s1	IFOGHGBLBLDYKO-UMQWNRPGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K17806071	BRD-K17806071-001-01-8	Broad Institute of MIT and Harvard	BRD-K17806071			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C30H35ClN4O6S/c1-20-17-35(29(36)14-22-6-5-13-32-16-22)21(2)19-41-27-15-24(33-42(38,39)25-10-7-23(31)8-11-25)9-12-26(27)30(37)34(3)18-28(20)40-4/h5-13,15-16,20-21,28,33H,14,17-19H2,1-4H3/t20-,21-,28-/m1/s1	IFOGHGBLBLDYKO-UMQWNRPGSA-N	614.19658328							98120
BRD-K51592421	LSM-11585		54631547	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23-/m1/s1	OOHQDHOXZWVAAU-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K51592421	BRD-K51592421-001-01-8	Broad Institute of MIT and Harvard	BRD-K51592421			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23-/m1/s1	OOHQDHOXZWVAAU-SEPYTNNBSA-N	455.242021186							100208
BRD-K46359800	LSM-11257		54631334	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16+,21+/m1/s1	HNVRJEXAKGMODG-XFQAVAEZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K46359800	BRD-K46359800-001-01-1	Broad Institute of MIT and Harvard	BRD-K46359800			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16+,21+/m1/s1	HNVRJEXAKGMODG-XFQAVAEZSA-N	482.19877617							99878
BRD-K44980533	LSM-11165		54631564	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18+,25+/m1/s1	UZJARJIYRQCXCT-UZEJHQAJSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K44980533	BRD-K44980533-001-01-0	Broad Institute of MIT and Harvard	BRD-K44980533			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18+,25+/m1/s1	UZJARJIYRQCXCT-UZEJHQAJSA-N	561.2144858							99786
BRD-K79793338	LSM-13299		54631502	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16+,20+/m0/s1	ILJGMXMVVDGLNM-RZQQEMMASA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K79793338	BRD-K79793338-001-01-2	Broad Institute of MIT and Harvard	BRD-K79793338			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16+,20+/m0/s1	ILJGMXMVVDGLNM-RZQQEMMASA-N	433.25767125							101938
BRD-K51849024	LSM-11603		54631307	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24+,31-/m1/s1	DHPIXDXHWYRYQT-ULPIOCOXSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K51849024	BRD-K51849024-001-01-3	Broad Institute of MIT and Harvard	BRD-K51849024			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24+,31-/m1/s1	DHPIXDXHWYRYQT-ULPIOCOXSA-N	573.331504906							100226
BRD-K62753164	LSM-12240		54631414	InChI=1S/C29H36FN3O5/c1-18-15-33(27(34)13-20-5-6-20)19(2)17-38-25-14-23(31-28(35)21-7-9-22(30)10-8-21)11-12-24(25)29(36)32(3)16-26(18)37-4/h7-12,14,18-20,26H,5-6,13,15-17H2,1-4H3,(H,31,35)/t18-,19+,26-/m1/s1	QTFKJTMJQVNOKY-UYXZNNOOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CC4CC4	BroadT	BRD-K62753164	BRD-K62753164-001-01-4	Broad Institute of MIT and Harvard	BRD-K62753164			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C29H36FN3O5/c1-18-15-33(27(34)13-20-5-6-20)19(2)17-38-25-14-23(31-28(35)21-7-9-22(30)10-8-21)11-12-24(25)29(36)32(3)16-26(18)37-4/h7-12,14,18-20,26H,5-6,13,15-17H2,1-4H3,(H,31,35)/t18-,19+,26-/m1/s1	QTFKJTMJQVNOKY-UYXZNNOOSA-N	525.263899482							100866
BRD-K31163805	LSM-10312		54631486	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17+,22-/m1/s1	NPOMWXYRXNIYSA-HYFFOGBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C3CCOCC3	BroadT	BRD-K31163805	BRD-K31163805-001-01-9	Broad Institute of MIT and Harvard	BRD-K31163805			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CCOCC1	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17+,22-/m1/s1	NPOMWXYRXNIYSA-HYFFOGBASA-N	511.235221244							98933
BRD-K16714380	LSM-9437		54631319	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-6-5-11-28-13-20)18(2)16-36-23-10-9-21(29-25(32)19-7-8-19)12-22(23)27(34)30(3)15-24(17)35-4/h5-6,9-13,17-19,24H,7-8,14-16H2,1-4H3,(H,29,32)/t17-,18+,24-/m1/s1	DILHJWACXDWAEF-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c4cccnc4	BroadT	BRD-K16714380	BRD-K16714380-001-01-1	Broad Institute of MIT and Harvard	BRD-K16714380			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1cccnc1	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-6-5-11-28-13-20)18(2)16-36-23-10-9-21(29-25(32)19-7-8-19)12-22(23)27(34)30(3)15-24(17)35-4/h5-6,9-13,17-19,24H,7-8,14-16H2,1-4H3,(H,29,32)/t17-,18+,24-/m1/s1	DILHJWACXDWAEF-NXMSCROESA-N	494.252920228							98058
BRD-K25481209	LSM-9977		54631586	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	VSOIFNIWZGPCNV-OHUGHZGNSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K25481209	BRD-K25481209-001-01-5	Broad Institute of MIT and Harvard	BRD-K25481209			CCCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	VSOIFNIWZGPCNV-OHUGHZGNSA-N	473.325356886							98598
BRD-K98321674	LSM-14470		54631281	InChI=1S/C27H38N4O5S/c1-18-14-31(16-25-28-9-12-37-25)19(2)17-36-23-13-21(29-26(32)20-7-10-35-11-8-20)5-6-22(23)27(33)30(3)15-24(18)34-4/h5-6,9,12-13,18-20,24H,7-8,10-11,14-17H2,1-4H3,(H,29,32)/t18-,19+,24-/m1/s1	FGARXSMYVPQAMN-YDIMBITNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K98321674	BRD-K98321674-001-01-1	Broad Institute of MIT and Harvard	BRD-K98321674			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C27H38N4O5S/c1-18-14-31(16-25-28-9-12-37-25)19(2)17-36-23-13-21(29-26(32)20-7-10-35-11-8-20)5-6-22(23)27(33)30(3)15-24(18)34-4/h5-6,9,12-13,18-20,24H,7-8,10-11,14-17H2,1-4H3,(H,29,32)/t18-,19+,24-/m1/s1	FGARXSMYVPQAMN-YDIMBITNSA-N	530.256291046							103125
BRD-K01977318	LSM-8552		54631297	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	VOCYCOKXIBOWBC-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K01977318	BRD-K01977318-001-01-8	Broad Institute of MIT and Harvard	BRD-K01977318			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	VOCYCOKXIBOWBC-VVBPWWLESA-N	474.203383222							97173
BRD-K32654925	LSM-10409		54631588	InChI=1S/C28H33FN4O5/c1-18-12-33(13-23-16-37-17-30-23)19(2)15-38-25-10-9-22(31-27(34)20-5-7-21(29)8-6-20)11-24(25)28(35)32(3)14-26(18)36-4/h5-11,16-19,26H,12-15H2,1-4H3,(H,31,34)/t18-,19+,26-/m0/s1	UFIUOGZYNPSZLJ-ANSQWYIGSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(Cc4cocn4)C[C@@H]1C	BroadT	BRD-K32654925	BRD-K32654925-001-01-1	Broad Institute of MIT and Harvard	BRD-K32654925			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(Cc2cocn2)C[C@@H]1C	InChI=1S/C28H33FN4O5/c1-18-12-33(13-23-16-37-17-30-23)19(2)15-38-25-10-9-22(31-27(34)20-5-7-21(29)8-6-20)11-24(25)28(35)32(3)14-26(18)36-4/h5-11,16-19,26H,12-15H2,1-4H3,(H,31,34)/t18-,19+,26-/m0/s1	UFIUOGZYNPSZLJ-ANSQWYIGSA-N	524.243498396							99030
BRD-K34786682	LSM-10521		54631386	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16+,20-/m0/s1	LVUSIZZVUUASSP-YRNRMSPPSA-N	CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H]1C)OC	BroadT	BRD-K34786682	BRD-K34786682-001-01-2	Broad Institute of MIT and Harvard	BRD-K34786682			CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H]1C)OC	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16+,20-/m0/s1	LVUSIZZVUUASSP-YRNRMSPPSA-N	552.22294017							99142
BRD-K87410008	LSM-13791		54631492	InChI=1S/C25H31F3N4O4/c1-15-12-29-16(2)14-36-21-10-9-19(11-20(21)23(33)32(3)13-22(15)35-4)31-24(34)30-18-7-5-17(6-8-18)25(26,27)28/h5-11,15-16,22,29H,12-14H2,1-4H3,(H2,30,31,34)/t15-,16-,22+/m0/s1	GXRZKRPKTHFHBM-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(cc3)C(F)(F)F)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K87410008	BRD-K87410008-001-01-2	Broad Institute of MIT and Harvard	BRD-K87410008			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(cc3)C(F)(F)F)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H31F3N4O4/c1-15-12-29-16(2)14-36-21-10-9-19(11-20(21)23(33)32(3)13-22(15)35-4)31-24(34)30-18-7-5-17(6-8-18)25(26,27)28/h5-11,15-16,22,29H,12-14H2,1-4H3,(H2,30,31,34)/t15-,16-,22+/m0/s1	GXRZKRPKTHFHBM-PONJGIIJSA-N	508.229740112							102440
BRD-K00526921	LSM-8464		54631401	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20+,26-/m1/s1	AMMFZKQUXZGGMQ-BVFVYWQFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc5cncnc5)C[C@H]1C	BroadT	BRD-K00526921	BRD-K00526921-001-01-3	Broad Institute of MIT and Harvard	BRD-K00526921			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20+,26-/m1/s1	AMMFZKQUXZGGMQ-BVFVYWQFSA-N	574.236224318							97085
BRD-K81721884	LSM-13420		54631357	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-7-6-8-21(28)11-20)19(2)16-36-24-12-22(29-26(32)17-34-4)9-10-23(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m0/s1	KGYIFIZLZVXLPC-CEYNDMKZSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3cccc(F)c3)[C@H](C)COc2c1	BroadT	BRD-K81721884	BRD-K81721884-001-01-7	Broad Institute of MIT and Harvard	BRD-K81721884			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cccc(F)c3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-7-6-8-21(28)11-20)19(2)16-36-24-12-22(29-26(32)17-34-4)9-10-23(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m0/s1	KGYIFIZLZVXLPC-CEYNDMKZSA-N	501.263899482							102060
BRD-K58743986	LSM-11979		54631522	InChI=1S/C30H37N3O7S2/c1-21-11-9-10-14-29(21)41(35,36)31-24-15-16-27-26(17-24)30(34)32(4)19-28(39-5)22(2)18-33(23(3)20-40-27)42(37,38)25-12-7-6-8-13-25/h6-17,22-23,28,31H,18-20H2,1-5H3/t22-,23-,28-/m1/s1	CUDOUIJJWFXDCR-MVOZIGHISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c4ccccc4	BroadT	BRD-K58743986	BRD-K58743986-001-01-7	Broad Institute of MIT and Harvard	BRD-K58743986			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c1ccccc1	InChI=1S/C30H37N3O7S2/c1-21-11-9-10-14-29(21)41(35,36)31-24-15-16-27-26(17-24)30(34)32(4)19-28(39-5)22(2)18-33(23(3)20-40-27)42(37,38)25-12-7-6-8-13-25/h6-17,22-23,28,31H,18-20H2,1-5H3/t22-,23-,28-/m1/s1	CUDOUIJJWFXDCR-MVOZIGHISA-N	615.207291934							100605
BRD-K77700305	LSM-13177		54631418	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23+/m0/s1	OOHQDHOXZWVAAU-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K77700305	BRD-K77700305-001-01-8	Broad Institute of MIT and Harvard	BRD-K77700305			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23+/m0/s1	OOHQDHOXZWVAAU-HKARXFIJSA-N	455.242021186							101815
BRD-K13759728	LSM-9261		54631583	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16+,20+/m0/s1	LVUSIZZVUUASSP-RZQQEMMASA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H]1C)OC	BroadT	BRD-K13759728	BRD-K13759728-001-01-0	Broad Institute of MIT and Harvard	BRD-K13759728			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H]1C)OC	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16+,20+/m0/s1	LVUSIZZVUUASSP-RZQQEMMASA-N	552.22294017							97882
BRD-K52124071	LSM-11617		54631581	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	VOCYCOKXIBOWBC-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K52124071	BRD-K52124071-001-01-2	Broad Institute of MIT and Harvard	BRD-K52124071			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	VOCYCOKXIBOWBC-MCFFVMPBSA-N	474.203383222							100240
BRD-K79330967	LSM-13276		54631305	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m0/s1	VSOIFNIWZGPCNV-RLSLOFABSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K79330967	BRD-K79330967-001-01-1	Broad Institute of MIT and Harvard	BRD-K79330967			CCCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m0/s1	VSOIFNIWZGPCNV-RLSLOFABSA-N	473.325356886							101915
BRD-K58731341	LSM-11977		54631462	InChI=1S/C28H35FN4O5/c1-17-14-33(28(36)31-23-8-6-5-7-22(23)29)18(2)16-38-24-13-20(30-26(34)19-9-10-19)11-12-21(24)27(35)32(3)15-25(17)37-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,34)(H,31,36)/t17-,18-,25-/m1/s1	RFBSRVOVWGOAAG-QJMRKGMQSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4ccccc4F	BroadT	BRD-K58731341	BRD-K58731341-001-01-2	Broad Institute of MIT and Harvard	BRD-K58731341			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1ccccc1F	InChI=1S/C28H35FN4O5/c1-17-14-33(28(36)31-23-8-6-5-7-22(23)29)18(2)16-38-24-13-20(30-26(34)19-9-10-19)11-12-21(24)27(35)32(3)15-25(17)37-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,34)(H,31,36)/t17-,18-,25-/m1/s1	RFBSRVOVWGOAAG-QJMRKGMQSA-N	526.25914846							100603
BRD-K77793090	LSM-13185		54631447	InChI=1S/C28H40N4O5/c1-7-13-32-16-19(2)26(36-6)17-31(4)27(33)24-12-11-22(15-25(24)37-18-20(32)3)30-28(34)29-21-9-8-10-23(14-21)35-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H2,29,30,34)/t19-,20+,26+/m1/s1	NWXQZACELVQCTR-GOHWNWGWSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(OC)c3)cc2OC[C@@H]1C)OC	BroadT	BRD-K77793090	BRD-K77793090-001-01-2	Broad Institute of MIT and Harvard	BRD-K77793090			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(OC)c3)cc2OC[C@@H]1C)OC	InChI=1S/C28H40N4O5/c1-7-13-32-16-19(2)26(36-6)17-31(4)27(33)24-12-11-22(15-25(24)37-18-20(32)3)30-28(34)29-21-9-8-10-23(14-21)35-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H2,29,30,34)/t19-,20+,26+/m1/s1	NWXQZACELVQCTR-GOHWNWGWSA-N	512.29987042							101823
BRD-K89679058	LSM-13961		54631403	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	ZGJMWZDWXNCIBA-PNCHPQGNSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	BroadT	BRD-K89679058	BRD-K89679058-001-01-9	Broad Institute of MIT and Harvard	BRD-K89679058			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	ZGJMWZDWXNCIBA-PNCHPQGNSA-N	469.26890465							102614
BRD-K22356946	LSM-9784		54631555	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18+,26-/m1/s1	ZXQGUZCJBQNBQR-FIAZIHOUSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c4cnccn4	BroadT	BRD-K22356946	BRD-K22356946-001-01-0	Broad Institute of MIT and Harvard	BRD-K22356946			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18+,26-/m1/s1	ZXQGUZCJBQNBQR-FIAZIHOUSA-N	582.240224584							98405
BRD-K51725102	LSM-11592		54631404	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	ZGJMWZDWXNCIBA-PMAPCBKXSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	BroadT	BRD-K51725102	BRD-K51725102-001-01-0	Broad Institute of MIT and Harvard	BRD-K51725102			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	ZGJMWZDWXNCIBA-PMAPCBKXSA-N	469.26890465							100215
BRD-K33368990	LSM-10455		54631497	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	UHUINQXCHIPGNT-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3cncnc3)C[C@@H]1C	BroadT	BRD-K33368990	BRD-K33368990-001-01-7	Broad Institute of MIT and Harvard	BRD-K33368990			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	UHUINQXCHIPGNT-HKARXFIJSA-N	455.253254586							99076
BRD-K20729616	LSM-9685		54631282	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18-,24+/m1/s1	CZFNYPFIGBHAGJ-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc3ccccn3	BroadT	BRD-K20729616	BRD-K20729616-001-01-9	Broad Institute of MIT and Harvard	BRD-K20729616			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1ccccn1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18-,24+/m1/s1	CZFNYPFIGBHAGJ-GGUMNFRJSA-N	482.252920228							98306
BRD-K90173466	LSM-13992		54631422	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18-,26-/m1/s1	ZXQGUZCJBQNBQR-UYPAYLBCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4cnccn4	BroadT	BRD-K90173466	BRD-K90173466-001-01-6	Broad Institute of MIT and Harvard	BRD-K90173466			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18-,26-/m1/s1	ZXQGUZCJBQNBQR-UYPAYLBCSA-N	582.240224584							102645
BRD-K86335374	LSM-13716		54631387	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16+,20+/m0/s1	CQZVRHUHRGDROH-RZQQEMMASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(Cc3nccs3)C[C@@H]1C	BroadT	BRD-K86335374	BRD-K86335374-001-01-8	Broad Institute of MIT and Harvard	BRD-K86335374			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16+,20+/m0/s1	CQZVRHUHRGDROH-RZQQEMMASA-N	564.168796112							102364
BRD-K52628302	LSM-11641		54631444	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16+,20+/m1/s1	LVUSIZZVUUASSP-GUXCAODWSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H]1C)OC	BroadT	BRD-K52628302	BRD-K52628302-001-01-3	Broad Institute of MIT and Harvard	BRD-K52628302			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H]1C)OC	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16+,20+/m1/s1	LVUSIZZVUUASSP-GUXCAODWSA-N	552.22294017							100266
BRD-K48270072	LSM-11365		54631336	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18+,26-/m0/s1	ZXQGUZCJBQNBQR-DFXHWTJYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4cnccn4	BroadT	BRD-K48270072	BRD-K48270072-001-01-9	Broad Institute of MIT and Harvard	BRD-K48270072			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1cnccn1	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18+,26-/m0/s1	ZXQGUZCJBQNBQR-DFXHWTJYSA-N	582.240224584							99986
BRD-K51217456	LSM-11561		54631379	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-6-5-11-28-13-20)18(2)16-36-23-10-9-21(29-25(32)19-7-8-19)12-22(23)27(34)30(3)15-24(17)35-4/h5-6,9-13,17-19,24H,7-8,14-16H2,1-4H3,(H,29,32)/t17-,18+,24-/m0/s1	DILHJWACXDWAEF-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4cccnc4	BroadT	BRD-K51217456	BRD-K51217456-001-01-0	Broad Institute of MIT and Harvard	BRD-K51217456			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1cccnc1	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-6-5-11-28-13-20)18(2)16-36-23-10-9-21(29-25(32)19-7-8-19)12-22(23)27(34)30(3)15-24(17)35-4/h5-6,9-13,17-19,24H,7-8,14-16H2,1-4H3,(H,29,32)/t17-,18+,24-/m0/s1	DILHJWACXDWAEF-RHGYRFJNSA-N	494.252920228							100184
BRD-K62953960-001-01-6	LSM-18081	BRD-K62953960	54631457	InChI=1S/C27H38N4O5S/c1-18-14-31(16-25-28-9-12-37-25)19(2)17-36-23-13-21(29-26(32)20-7-10-35-11-8-20)5-6-22(23)27(33)30(3)15-24(18)34-4/h5-6,9,12-13,18-20,24H,7-8,10-11,14-17H2,1-4H3,(H,29,32)/t18-,19-,24-/m1/s1	FGARXSMYVPQAMN-KHCICDEESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K62953960	BRD-K62953960-001-01-6	Broad Institute of MIT and Harvard	BRD-K62953960			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C27H38N4O5S/c1-18-14-31(16-25-28-9-12-37-25)19(2)17-36-23-13-21(29-26(32)20-7-10-35-11-8-20)5-6-22(23)27(33)30(3)15-24(18)34-4/h5-6,9,12-13,18-20,24H,7-8,10-11,14-17H2,1-4H3,(H,29,32)/t18-,19-,24-/m1/s1	FGARXSMYVPQAMN-KHCICDEESA-N	530.256291046							106725
BRD-K12610781	LSM-9179		54631294	InChI=1S/C29H35N3O6S/c1-20-17-30-21(2)19-37-27-16-22(10-15-26(27)29(33)32(3)18-28(20)36-4)31-39(34,35)25-13-11-24(12-14-25)38-23-8-6-5-7-9-23/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28-/m0/s1	NZYQBFQVYSNMPI-GTNJKRJXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K12610781	BRD-K12610781-001-01-0	Broad Institute of MIT and Harvard	BRD-K12610781			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C29H35N3O6S/c1-20-17-30-21(2)19-37-27-16-22(10-15-26(27)29(33)32(3)18-28(20)36-4)31-39(34,35)25-13-11-24(12-14-25)38-23-8-6-5-7-9-23/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28-/m0/s1	NZYQBFQVYSNMPI-GTNJKRJXSA-N	553.22465656							97800
BRD-K16925239	LSM-9450		54631427	InChI=1S/C29H36F3N5O5S/c1-19-13-37(14-21-7-6-8-22(11-21)29(30,31)32)20(2)17-42-25-12-23(34-43(39,40)27-16-35(3)18-33-27)9-10-24(25)28(38)36(4)15-26(19)41-5/h6-12,16,18-20,26,34H,13-15,17H2,1-5H3/t19-,20-,26-/m1/s1	KOOKBFWCLZTKPR-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc4cccc(c4)C(F)(F)F)C[C@H]1C	BroadT	BRD-K16925239	BRD-K16925239-001-01-6	Broad Institute of MIT and Harvard	BRD-K16925239			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc2cccc(c2)C(F)(F)F)C[C@H]1C	InChI=1S/C29H36F3N5O5S/c1-19-13-37(14-21-7-6-8-22(11-21)29(30,31)32)20(2)17-42-25-12-23(34-43(39,40)27-16-35(3)18-33-27)9-10-24(25)28(38)36(4)15-26(19)41-5/h6-12,16,18-20,26,34H,13-15,17H2,1-5H3/t19-,20-,26-/m1/s1	KOOKBFWCLZTKPR-XMERXJNXSA-N	623.238924592							98071
BRD-K62237490	LSM-12209		54631299	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17-,22+/m0/s1	NPOMWXYRXNIYSA-PNLZDCPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C3CCOCC3	BroadT	BRD-K62237490	BRD-K62237490-001-01-3	Broad Institute of MIT and Harvard	BRD-K62237490			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CCOCC1	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17-,22+/m0/s1	NPOMWXYRXNIYSA-PNLZDCPESA-N	511.235221244							100835
BRD-K95786246	LSM-14303		54631580	InChI=1S/C27H38N4O5S/c1-18-14-31(16-25-28-9-12-37-25)19(2)17-36-23-13-21(29-26(32)20-7-10-35-11-8-20)5-6-22(23)27(33)30(3)15-24(18)34-4/h5-6,9,12-13,18-20,24H,7-8,10-11,14-17H2,1-4H3,(H,29,32)/t18-,19-,24+/m0/s1	FGARXSMYVPQAMN-AXHZCLLHSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K95786246	BRD-K95786246-001-01-7	Broad Institute of MIT and Harvard	BRD-K95786246			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C27H38N4O5S/c1-18-14-31(16-25-28-9-12-37-25)19(2)17-36-23-13-21(29-26(32)20-7-10-35-11-8-20)5-6-22(23)27(33)30(3)15-24(18)34-4/h5-6,9,12-13,18-20,24H,7-8,10-11,14-17H2,1-4H3,(H,29,32)/t18-,19-,24+/m0/s1	FGARXSMYVPQAMN-AXHZCLLHSA-N	530.256291046							102957
CHEMBL2360376	LSM-8839	SID131427679, BRD-K06897051	54631437	InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18-,26-/m0/s1	MHGGQJRIOQBKBK-XWXLMPLOSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc4cc(F)ccc4F)C[C@@H]1C	BroadT	BRD-K06897051	BRD-K06897051-001-01-4	Broad Institute of MIT and Harvard	BRD-K06897051			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc2cc(F)ccc2F)C[C@@H]1C	InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18-,26-/m0/s1	MHGGQJRIOQBKBK-XWXLMPLOSA-N	515.25956303							97460
BRD-K85891179	LSM-13691		54631464	InChI=1S/C26H40N4O7/c1-18-13-30(25(32)15-29-8-10-36-11-9-29)19(2)16-37-22-12-20(27-24(31)17-34-4)6-7-21(22)26(33)28(3)14-23(18)35-5/h6-7,12,18-19,23H,8-11,13-17H2,1-5H3,(H,27,31)/t18-,19-,23-/m1/s1	SLSZBTPAWGPDLP-DNVFCKCGSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)CN3CCOCC3	BroadT	BRD-K85891179	BRD-K85891179-001-01-8	Broad Institute of MIT and Harvard	BRD-K85891179			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CN2CCOCC2)c1	InChI=1S/C26H40N4O7/c1-18-13-30(25(32)15-29-8-10-36-11-9-29)19(2)16-37-22-12-20(27-24(31)17-34-4)6-7-21(22)26(33)28(3)14-23(18)35-5/h6-7,12,18-19,23H,8-11,13-17H2,1-5H3,(H,27,31)/t18-,19-,23-/m1/s1	SLSZBTPAWGPDLP-DNVFCKCGSA-N	520.28969966							102339
BRD-K26461874	LSM-10030		54631391	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24+,31+/m0/s1	DHPIXDXHWYRYQT-BKZGZDJESA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K26461874	BRD-K26461874-001-01-0	Broad Institute of MIT and Harvard	BRD-K26461874			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24+,31+/m0/s1	DHPIXDXHWYRYQT-BKZGZDJESA-N	573.331504906							98651
BRD-K78699095	LSM-13234		54631329	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16-,20+/m0/s1	ILJGMXMVVDGLNM-TWOQFEAHSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K78699095	BRD-K78699095-001-01-5	Broad Institute of MIT and Harvard	BRD-K78699095			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16-,20+/m0/s1	ILJGMXMVVDGLNM-TWOQFEAHSA-N	433.25767125							101873
BRD-K89133991	LSM-13915		54631322	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18+,25-/m1/s1	RXVPCSLMNQSOJP-FUMQJTLXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K89133991	BRD-K89133991-001-01-7	Broad Institute of MIT and Harvard	BRD-K89133991			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18+,25-/m1/s1	RXVPCSLMNQSOJP-FUMQJTLXSA-N	565.239970438							102568
BRD-K62214646	LSM-12206		54631550	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18+,25+/m1/s1	RXVPCSLMNQSOJP-UZEJHQAJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K62214646	BRD-K62214646-001-01-5	Broad Institute of MIT and Harvard	BRD-K62214646			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18+,25+/m1/s1	RXVPCSLMNQSOJP-UZEJHQAJSA-N	565.239970438							100832
BRD-K90897407	LSM-14023		54631355	InChI=1S/C27H37N5O5/c1-18-14-32(26(34)20-9-11-28-12-10-20)19(2)17-37-23-13-21(29-25(33)16-30(3)4)7-8-22(23)27(35)31(5)15-24(18)36-6/h7-13,18-19,24H,14-17H2,1-6H3,(H,29,33)/t18-,19-,24-/m1/s1	OLPJMCHMQFLJIT-KHCICDEESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)CN(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccncc3	BroadT	BRD-K90897407	BRD-K90897407-001-01-2	Broad Institute of MIT and Harvard	BRD-K90897407			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)CN(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccncc1	InChI=1S/C27H37N5O5/c1-18-14-32(26(34)20-9-11-28-12-10-20)19(2)17-37-23-13-21(29-25(33)16-30(3)4)7-8-22(23)27(35)31(5)15-24(18)36-6/h7-13,18-19,24H,14-17H2,1-6H3,(H,29,33)/t18-,19-,24-/m1/s1	OLPJMCHMQFLJIT-KHCICDEESA-N	511.279469334							102676
BRD-K40676967	LSM-10913		54631513	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-7-8-20)19(2)17-35-24-12-22(29-26(32)21-6-5-11-28-13-21)9-10-23(24)27(33)30(3)16-25(18)34-4/h5-6,9-13,18-20,25H,7-8,14-17H2,1-4H3,(H,29,32)/t18-,19-,25-/m1/s1	SVYAWRHJWQCLRG-MPCDZSKCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccnc3)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K40676967	BRD-K40676967-001-01-3	Broad Institute of MIT and Harvard	BRD-K40676967			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccnc3)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-7-8-20)19(2)17-35-24-12-22(29-26(32)21-6-5-11-28-13-21)9-10-23(24)27(33)30(3)16-25(18)34-4/h5-6,9-13,18-20,25H,7-8,14-17H2,1-4H3,(H,29,32)/t18-,19-,25-/m1/s1	SVYAWRHJWQCLRG-MPCDZSKCSA-N	480.273655672							99534
BRD-K00566471	LSM-8469		54631412	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21-,28+/m1/s1	PDYFFKDIVHOONQ-CJYOKPGZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(CC4CCOCC4)C[C@H]1C	BroadT	BRD-K00566471	BRD-K00566471-001-01-3	Broad Institute of MIT and Harvard	BRD-K00566471			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21-,28+/m1/s1	PDYFFKDIVHOONQ-CJYOKPGZSA-N	541.29519961							97090
BRD-K88352433	LSM-13860		54631585	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18+,26+/m1/s1	ZXQGUZCJBQNBQR-ZENTWMBTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c4cnccn4	BroadT	BRD-K88352433	BRD-K88352433-001-01-0	Broad Institute of MIT and Harvard	BRD-K88352433			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18+,26+/m1/s1	ZXQGUZCJBQNBQR-ZENTWMBTSA-N	582.240224584							102511
BRD-K66533845	LSM-12479		54631562	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23-/m0/s1	OOHQDHOXZWVAAU-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K66533845	BRD-K66533845-001-01-3	Broad Institute of MIT and Harvard	BRD-K66533845			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23-/m0/s1	OOHQDHOXZWVAAU-MFEFFIJZSA-N	455.242021186							101110
BRD-K03276924	LSM-8639		54631490	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-6-11-24(35-4)12-7-21)20(2)18-37-26-13-10-23(30-28(33)22-8-9-22)14-25(26)29(34)31(3)17-27(19)36-5/h6-7,10-14,19-20,22,27H,8-9,15-18H2,1-5H3,(H,30,33)/t19-,20-,27-/m0/s1	SOKZPMDKQQIJSP-OSOCVKALSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc4ccc(OC)cc4)C[C@@H]1C	BroadT	BRD-K03276924	BRD-K03276924-001-01-9	Broad Institute of MIT and Harvard	BRD-K03276924			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc2ccc(OC)cc2)C[C@@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-6-11-24(35-4)12-7-21)20(2)18-37-26-13-10-23(30-28(33)22-8-9-22)14-25(26)29(34)31(3)17-27(19)36-5/h6-7,10-14,19-20,22,27H,8-9,15-18H2,1-5H3,(H,30,33)/t19-,20-,27-/m0/s1	SOKZPMDKQQIJSP-OSOCVKALSA-N	509.288971378							97260
BRD-K20032520	LSM-9645		54631365	InChI=1S/C27H38N4O5S/c1-18-14-31(16-25-28-9-12-37-25)19(2)17-36-23-13-21(29-26(32)20-7-10-35-11-8-20)5-6-22(23)27(33)30(3)15-24(18)34-4/h5-6,9,12-13,18-20,24H,7-8,10-11,14-17H2,1-4H3,(H,29,32)/t18-,19+,24+/m0/s1	FGARXSMYVPQAMN-XLNZFTOWSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K20032520	BRD-K20032520-001-01-3	Broad Institute of MIT and Harvard	BRD-K20032520			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C27H38N4O5S/c1-18-14-31(16-25-28-9-12-37-25)19(2)17-36-23-13-21(29-26(32)20-7-10-35-11-8-20)5-6-22(23)27(33)30(3)15-24(18)34-4/h5-6,9,12-13,18-20,24H,7-8,10-11,14-17H2,1-4H3,(H,29,32)/t18-,19+,24+/m0/s1	FGARXSMYVPQAMN-XLNZFTOWSA-N	530.256291046							98266
BRD-K66975725	LSM-12508		54631296	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16-,21+/m1/s1	HNVRJEXAKGMODG-ZOCZFRKYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K66975725	BRD-K66975725-001-01-1	Broad Institute of MIT and Harvard	BRD-K66975725			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16-,21+/m1/s1	HNVRJEXAKGMODG-ZOCZFRKYSA-N	482.19877617							101139
BRD-K20107219	LSM-9652		54631527	InChI=1S/C22H29N5O4/c1-14-10-25-15(2)13-31-19-9-16(26-21(28)18-11-23-7-8-24-18)5-6-17(19)22(29)27(3)12-20(14)30-4/h5-9,11,14-15,20,25H,10,12-13H2,1-4H3,(H,26,28)/t14-,15-,20-/m1/s1	ORFROPTWDCALKP-STXHMFSFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K20107219	BRD-K20107219-001-01-9	Broad Institute of MIT and Harvard	BRD-K20107219			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C22H29N5O4/c1-14-10-25-15(2)13-31-19-9-16(26-21(28)18-11-23-7-8-24-18)5-6-17(19)22(29)27(3)12-20(14)30-4/h5-9,11,14-15,20,25H,10,12-13H2,1-4H3,(H,26,28)/t14-,15-,20-/m1/s1	ORFROPTWDCALKP-STXHMFSFSA-N	427.221954458							98273
BRD-K89165671	LSM-13918		54631298	InChI=1S/C24H37N3O6S/c1-16-13-27(34(5,30)31)17(2)15-33-21-12-19(25-23(28)18-8-6-7-9-18)10-11-20(21)24(29)26(3)14-22(16)32-4/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m1/s1	LHVPUDAVHZTECS-HYFFOGBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K89165671	BRD-K89165671-001-01-6	Broad Institute of MIT and Harvard	BRD-K89165671			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C24H37N3O6S/c1-16-13-27(34(5,30)31)17(2)15-33-21-12-19(25-23(28)18-8-6-7-9-18)10-11-20(21)24(29)26(3)14-22(16)32-4/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m1/s1	LHVPUDAVHZTECS-HYFFOGBASA-N	495.240306624							102571
BRD-K82062446	LSM-13441		54631443	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20+,26+/m1/s1	AMMFZKQUXZGGMQ-GOHWNWGWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc5cncnc5)C[C@H]1C	BroadT	BRD-K82062446	BRD-K82062446-001-01-6	Broad Institute of MIT and Harvard	BRD-K82062446			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20+,26+/m1/s1	AMMFZKQUXZGGMQ-GOHWNWGWSA-N	574.236224318							102081
BRD-K34692511	LSM-10517		54631293	InChI=1S/C25H31F3N4O4/c1-15-12-29-16(2)14-36-21-10-9-19(11-20(21)23(33)32(3)13-22(15)35-4)31-24(34)30-18-7-5-17(6-8-18)25(26,27)28/h5-11,15-16,22,29H,12-14H2,1-4H3,(H2,30,31,34)/t15-,16+,22+/m0/s1	GXRZKRPKTHFHBM-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(cc3)C(F)(F)F)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K34692511	BRD-K34692511-001-01-9	Broad Institute of MIT and Harvard	BRD-K34692511			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(cc3)C(F)(F)F)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H31F3N4O4/c1-15-12-29-16(2)14-36-21-10-9-19(11-20(21)23(33)32(3)13-22(15)35-4)31-24(34)30-18-7-5-17(6-8-18)25(26,27)28/h5-11,15-16,22,29H,12-14H2,1-4H3,(H2,30,31,34)/t15-,16+,22+/m0/s1	GXRZKRPKTHFHBM-WJONJSRFSA-N	508.229740112							99138
CHEMBL2143628	LSM-6855	BRD-K83694683, SID131427711	54631469	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24-,31-/m0/s1	DHPIXDXHWYRYQT-MKGJDZFWSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K83694683	BRD-K83694683-001-01-7	Broad Institute of MIT and Harvard	BRD-K83694683			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24-,31-/m0/s1	DHPIXDXHWYRYQT-MKGJDZFWSA-N	573.331504906							95476
BRD-K82053812-001-01-1	LSM-13439	BRD-K82053812	54631441	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18-,25-/m0/s1	RXVPCSLMNQSOJP-RPPIVITFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K82053812	BRD-K82053812-001-01-1	Broad Institute of MIT and Harvard	BRD-K82053812			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18-,25-/m0/s1	RXVPCSLMNQSOJP-RPPIVITFSA-N	565.239970438							102079
BRD-K94206926	LSM-14202		54631590	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14+,20+/m0/s1	LINNEEFEDHMFDS-LRDNONRASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)onc3C)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K94206926	BRD-K94206926-001-01-4	Broad Institute of MIT and Harvard	BRD-K94206926			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)noc3C)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14+,20+/m0/s1	LINNEEFEDHMFDS-LRDNONRASA-N	480.204255474							102856
BRD-K03804563	LSM-8665		54631395	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18+,24+/m0/s1	CZFNYPFIGBHAGJ-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc3ccccn3	BroadT	BRD-K03804563	BRD-K03804563-001-01-4	Broad Institute of MIT and Harvard	BRD-K03804563			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc1ccccn1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18+,24+/m0/s1	CZFNYPFIGBHAGJ-HOOSLVGPSA-N	482.252920228							97286
BRD-K32324469	LSM-10388		54631378	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-7-6-8-21(28)11-20)19(2)16-36-24-12-22(29-26(32)17-34-4)9-10-23(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m1/s1	KGYIFIZLZVXLPC-WYEJZRMESA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3cccc(F)c3)[C@@H](C)COc2c1	BroadT	BRD-K32324469	BRD-K32324469-001-01-3	Broad Institute of MIT and Harvard	BRD-K32324469			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3cccc(F)c3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-7-6-8-21(28)11-20)19(2)16-36-24-12-22(29-26(32)17-34-4)9-10-23(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m1/s1	KGYIFIZLZVXLPC-WYEJZRMESA-N	501.263899482							99009
BRD-K64955433	LSM-12397		54631398	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24+,30-/m1/s1	ONZMGLOOFFOJCP-FSGGQHMVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K64955433	BRD-K64955433-001-01-8	Broad Institute of MIT and Harvard	BRD-K64955433			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24+,30-/m1/s1	ONZMGLOOFFOJCP-FSGGQHMVSA-N	550.351905992							101024
BRD-K15178090	LSM-9337		54631328	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24+/m0/s1	DDFXZAACYDZOLE-AXHZCLLHSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(CC3CCCCC3)C[C@@H]1C	BroadT	BRD-K15178090	BRD-K15178090-001-01-1	Broad Institute of MIT and Harvard	BRD-K15178090			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24+/m0/s1	DDFXZAACYDZOLE-AXHZCLLHSA-N	495.276692132							97958
BRD-K36424250	LSM-10628		54631504	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21+,26+/m0/s1	AEHXNEHGWHBDEN-LZCXECNNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K36424250	BRD-K36424250-001-01-0	Broad Institute of MIT and Harvard	BRD-K36424250			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21+,26+/m0/s1	AEHXNEHGWHBDEN-LZCXECNNSA-N	560.26685573							99249
BRD-K27424042	LSM-10082		54631481	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16-,21-/m0/s1	HNVRJEXAKGMODG-QYWGDWMGSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K27424042	BRD-K27424042-001-01-4	Broad Institute of MIT and Harvard	BRD-K27424042			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16-,21-/m0/s1	HNVRJEXAKGMODG-QYWGDWMGSA-N	482.19877617							98703
BRD-K42011191	LSM-10980		54631354	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20-,26-/m1/s1	AMMFZKQUXZGGMQ-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc5cncnc5)C[C@H]1C	BroadT	BRD-K42011191	BRD-K42011191-001-01-9	Broad Institute of MIT and Harvard	BRD-K42011191			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20-,26-/m1/s1	AMMFZKQUXZGGMQ-XMERXJNXSA-N	574.236224318							99601
BRD-K93109423	LSM-14139		54631459	InChI=1S/C32H37N3O6/c1-21-18-35(23(3)36)22(2)20-40-29-16-13-25(17-28(29)32(38)34(4)19-30(21)39-5)33-31(37)24-11-14-27(15-12-24)41-26-9-7-6-8-10-26/h6-17,21-22,30H,18-20H2,1-5H3,(H,33,37)/t21-,22-,30-/m1/s1	JEUTXNUWCDUCFH-NPKFRGRUSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K93109423	BRD-K93109423-001-01-9	Broad Institute of MIT and Harvard	BRD-K93109423			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C32H37N3O6/c1-21-18-35(23(3)36)22(2)20-40-29-16-13-25(17-28(29)32(38)34(4)19-30(21)39-5)33-31(37)24-11-14-27(15-12-24)41-26-9-7-6-8-10-26/h6-17,21-22,30H,18-20H2,1-5H3,(H,33,37)/t21-,22-,30-/m1/s1	JEUTXNUWCDUCFH-NPKFRGRUSA-N	559.268235934							102793
BRD-K98626176	LSM-15011		54631472	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	VOCYCOKXIBOWBC-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K98626176	BRD-K98626176-001-01-6	Broad Institute of MIT and Harvard	BRD-K98626176			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	VOCYCOKXIBOWBC-ZMPRRUGASA-N	474.203383222							103667
BRD-K54029516	LSM-11717		54631425	InChI=1S/C29H36FN3O5/c1-18-15-33(27(34)13-20-5-6-20)19(2)17-38-25-14-23(31-28(35)21-7-9-22(30)10-8-21)11-12-24(25)29(36)32(3)16-26(18)37-4/h7-12,14,18-20,26H,5-6,13,15-17H2,1-4H3,(H,31,35)/t18-,19+,26-/m0/s1	QTFKJTMJQVNOKY-ANSQWYIGSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC4CC4	BroadT	BRD-K54029516	BRD-K54029516-001-01-4	Broad Institute of MIT and Harvard	BRD-K54029516			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C29H36FN3O5/c1-18-15-33(27(34)13-20-5-6-20)19(2)17-38-25-14-23(31-28(35)21-7-9-22(30)10-8-21)11-12-24(25)29(36)32(3)16-26(18)37-4/h7-12,14,18-20,26H,5-6,13,15-17H2,1-4H3,(H,31,35)/t18-,19+,26-/m0/s1	QTFKJTMJQVNOKY-ANSQWYIGSA-N	525.263899482							100342
BRD-K51331750-001-01-2	LSM-18082	BRD-K51331750	54631478	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18+,24+/m1/s1	CZFNYPFIGBHAGJ-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc3ccccn3	BroadT	BRD-K51331750	BRD-K51331750-001-01-2	Broad Institute of MIT and Harvard	BRD-K51331750			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc1ccccn1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18+,24+/m1/s1	CZFNYPFIGBHAGJ-YTZAWJCFSA-N	482.252920228							106726
BRD-K23060864	LSM-9828		54631381	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21+,28+/m0/s1	PDYFFKDIVHOONQ-BALWLHIASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(CC4CCOCC4)C[C@@H]1C	BroadT	BRD-K23060864	BRD-K23060864-001-01-5	Broad Institute of MIT and Harvard	BRD-K23060864			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(CC2CCOCC2)C[C@@H]1C	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21+,28+/m0/s1	PDYFFKDIVHOONQ-BALWLHIASA-N	541.29519961							98449
BRD-K74591286	LSM-12998		54631396	InChI=1S/C25H31F3N4O4/c1-15-12-29-16(2)14-36-21-10-9-19(11-20(21)23(33)32(3)13-22(15)35-4)31-24(34)30-18-7-5-17(6-8-18)25(26,27)28/h5-11,15-16,22,29H,12-14H2,1-4H3,(H2,30,31,34)/t15-,16+,22-/m1/s1	GXRZKRPKTHFHBM-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(cc3)C(F)(F)F)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K74591286	BRD-K74591286-001-01-7	Broad Institute of MIT and Harvard	BRD-K74591286			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(cc3)C(F)(F)F)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H31F3N4O4/c1-15-12-29-16(2)14-36-21-10-9-19(11-20(21)23(33)32(3)13-22(15)35-4)31-24(34)30-18-7-5-17(6-8-18)25(26,27)28/h5-11,15-16,22,29H,12-14H2,1-4H3,(H2,30,31,34)/t15-,16+,22-/m1/s1	GXRZKRPKTHFHBM-ZMPRRUGASA-N	508.229740112							101635
BRD-K37608670	LSM-10701		54631368	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24+/m1/s1	MGTDWSJKTZULMI-OJLQRUNKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K37608670	BRD-K37608670-001-01-9	Broad Institute of MIT and Harvard	BRD-K37608670			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24+/m1/s1	MGTDWSJKTZULMI-OJLQRUNKSA-N	500.243498396							99322
BRD-K17333907	LSM-9471		54631311	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24-,30+/m1/s1	ONZMGLOOFFOJCP-ZLRJYYBNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K17333907	BRD-K17333907-001-01-3	Broad Institute of MIT and Harvard	BRD-K17333907			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24-,30+/m1/s1	ONZMGLOOFFOJCP-ZLRJYYBNSA-N	550.351905992							98092
BRD-K28871766	LSM-10182		54631517	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)30-13-16(4)25(5)11-15(3)20(29-7)12-26(6)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20-/m0/s1	AADVJQLQUVDEBP-YRNRMSPPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K28871766	BRD-K28871766-001-01-9	Broad Institute of MIT and Harvard	BRD-K28871766			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)30-13-16(4)25(5)11-15(3)20(29-7)12-26(6)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20-/m0/s1	AADVJQLQUVDEBP-YRNRMSPPSA-N	420.273655672							98803
BRD-K01284917	LSM-8511		54631324	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24-/m0/s1	OZIBRDAYFOJMNO-UAVUOLJFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccc(F)cc3	BroadT	BRD-K01284917	BRD-K01284917-001-01-4	Broad Institute of MIT and Harvard	BRD-K01284917			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccc(F)cc1	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24-/m0/s1	OZIBRDAYFOJMNO-UAVUOLJFSA-N	485.232599354							97132
BRD-K30953566	LSM-10296		54631337	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19-,25-/m0/s1	IESMZGXEKVWDTA-MHPIHPPYSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K30953566	BRD-K30953566-001-01-3	Broad Institute of MIT and Harvard	BRD-K30953566			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19-,25-/m0/s1	IESMZGXEKVWDTA-MHPIHPPYSA-N	528.274798524							98917
BRD-K66687431	LSM-12489		54631351	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-6-5-11-28-13-20)18(2)16-36-23-10-9-21(29-25(32)19-7-8-19)12-22(23)27(34)30(3)15-24(17)35-4/h5-6,9-13,17-19,24H,7-8,14-16H2,1-4H3,(H,29,32)/t17-,18+,24+/m1/s1	DILHJWACXDWAEF-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c4cccnc4	BroadT	BRD-K66687431	BRD-K66687431-001-01-7	Broad Institute of MIT and Harvard	BRD-K66687431			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1cccnc1	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-6-5-11-28-13-20)18(2)16-36-23-10-9-21(29-25(32)19-7-8-19)12-22(23)27(34)30(3)15-24(17)35-4/h5-6,9-13,17-19,24H,7-8,14-16H2,1-4H3,(H,29,32)/t17-,18+,24+/m1/s1	DILHJWACXDWAEF-YTZAWJCFSA-N	494.252920228							101120
BRD-K80550858	LSM-13353		54631384	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	ZGJMWZDWXNCIBA-IXFSTUDKSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	BroadT	BRD-K80550858	BRD-K80550858-001-01-3	Broad Institute of MIT and Harvard	BRD-K80550858			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	ZGJMWZDWXNCIBA-IXFSTUDKSA-N	469.26890465							101992
BRD-K12019169	LSM-9153		54631521	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m0/s1	ZGJMWZDWXNCIBA-BSRJHKFKSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K12019169	BRD-K12019169-001-01-6	Broad Institute of MIT and Harvard	BRD-K12019169			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m0/s1	ZGJMWZDWXNCIBA-BSRJHKFKSA-N	469.26890465							97774
BRD-K60826706	LSM-12109		54631495	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24+/m0/s1	MGTDWSJKTZULMI-OBWXTZQISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K60826706	BRD-K60826706-001-01-5	Broad Institute of MIT and Harvard	BRD-K60826706			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24+/m0/s1	MGTDWSJKTZULMI-OBWXTZQISA-N	500.243498396							100735
BRD-K09411281	LSM-8997		54631473	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23+/m0/s1	OOHQDHOXZWVAAU-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K09411281	BRD-K09411281-001-01-3	Broad Institute of MIT and Harvard	BRD-K09411281			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23+/m0/s1	OOHQDHOXZWVAAU-YGKZAACZSA-N	455.242021186							97618
BRD-K41700431	LSM-10962		54631455	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24+,30-/m0/s1	ONZMGLOOFFOJCP-BBANNHEPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K41700431	BRD-K41700431-001-01-8	Broad Institute of MIT and Harvard	BRD-K41700431			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24+,30-/m0/s1	ONZMGLOOFFOJCP-BBANNHEPSA-N	550.351905992							99583
BRD-K55232867	LSM-11775		54631435	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16-,22+/m1/s1	PCJFVZCPKBPEAR-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K55232867	BRD-K55232867-001-01-8	Broad Institute of MIT and Harvard	BRD-K55232867			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16-,22+/m1/s1	PCJFVZCPKBPEAR-MCFFVMPBSA-N	555.266853902							100400
BRD-K32629755	LSM-10406		54631362	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	UHUINQXCHIPGNT-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H]1C	BroadT	BRD-K32629755	BRD-K32629755-001-01-8	Broad Institute of MIT and Harvard	BRD-K32629755			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	UHUINQXCHIPGNT-YGKZAACZSA-N	455.253254586							99027
BRD-K88022263	LSM-13832		54631557	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	FQDNKYOBJJPTQR-GLDPYIMESA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K88022263	BRD-K88022263-001-01-4	Broad Institute of MIT and Harvard	BRD-K88022263			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	FQDNKYOBJJPTQR-GLDPYIMESA-N	484.268570292							102482
BRD-K05531636	LSM-8754		54631364	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m0/s1	JHQFRDYLQMIJCM-JXQFQVJHSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)Cc3cccnc3	BroadT	BRD-K05531636	BRD-K05531636-001-01-4	Broad Institute of MIT and Harvard	BRD-K05531636			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)Cc1cccnc1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m0/s1	JHQFRDYLQMIJCM-JXQFQVJHSA-N	512.263484912							97375
MLS003650038	LSM-11584	BRD-K51585944, SID125305341	53382697	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24+,30+/m0/s1	ONZMGLOOFFOJCP-FVBCXUTKSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K51585944	BRD-K51585944-001-01-0	Broad Institute of MIT and Harvard	BRD-K51585944			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24+,30+/m0/s1	ONZMGLOOFFOJCP-FVBCXUTKSA-N	550.351905992							100207
BRD-K30706668	LSM-10276		54631349	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24-,31+/m1/s1	DHPIXDXHWYRYQT-GQIGMWPISA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K30706668	BRD-K30706668-001-01-2	Broad Institute of MIT and Harvard	BRD-K30706668			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24-,31+/m1/s1	DHPIXDXHWYRYQT-GQIGMWPISA-N	573.331504906							98897
BRD-K84516003	LSM-13596		54631507	InChI=1S/C29H35N3O6S/c1-20-17-30-21(2)19-37-27-16-22(10-15-26(27)29(33)32(3)18-28(20)36-4)31-39(34,35)25-13-11-24(12-14-25)38-23-8-6-5-7-9-23/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21-,28+/m1/s1	NZYQBFQVYSNMPI-CJYOKPGZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K84516003	BRD-K84516003-001-01-4	Broad Institute of MIT and Harvard	BRD-K84516003			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C29H35N3O6S/c1-20-17-30-21(2)19-37-27-16-22(10-15-26(27)29(33)32(3)18-28(20)36-4)31-39(34,35)25-13-11-24(12-14-25)38-23-8-6-5-7-9-23/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21-,28+/m1/s1	NZYQBFQVYSNMPI-CJYOKPGZSA-N	553.22465656							102240
BRD-K54003568	LSM-11714		54631496	InChI=1S/C28H33FN4O7S/c1-17-14-33(41(36,37)22-9-6-20(29)7-10-22)18(2)16-39-25-13-21(30-27(34)24-12-19(3)40-31-24)8-11-23(25)28(35)32(4)15-26(17)38-5/h6-13,17-18,26H,14-16H2,1-5H3,(H,30,34)/t17-,18-,26-/m1/s1	YFDKGQSBBJTRGV-UYPAYLBCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K54003568	BRD-K54003568-001-01-6	Broad Institute of MIT and Harvard	BRD-K54003568			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C28H33FN4O7S/c1-17-14-33(41(36,37)22-9-6-20(29)7-10-22)18(2)16-39-25-13-21(30-27(34)24-12-19(3)40-31-24)8-11-23(25)28(35)32(4)15-26(17)38-5/h6-13,17-18,26H,14-16H2,1-5H3,(H,30,34)/t17-,18-,26-/m1/s1	YFDKGQSBBJTRGV-UYPAYLBCSA-N	588.205398326							100339
BRD-K56124197	LSM-11820		54631326	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16+,21-/m0/s1	HNVRJEXAKGMODG-MRUHUIDDSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K56124197	BRD-K56124197-001-01-7	Broad Institute of MIT and Harvard	BRD-K56124197			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16+,21-/m0/s1	HNVRJEXAKGMODG-MRUHUIDDSA-N	482.19877617							100445
BRD-K00061590	LSM-8428		54631285	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-6-11-24(35-4)12-7-21)20(2)18-37-26-13-10-23(30-28(33)22-8-9-22)14-25(26)29(34)31(3)17-27(19)36-5/h6-7,10-14,19-20,22,27H,8-9,15-18H2,1-5H3,(H,30,33)/t19-,20-,27+/m0/s1	SOKZPMDKQQIJSP-OWOAZTCBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc4ccc(OC)cc4)C[C@@H]1C	BroadT	BRD-K00061590	BRD-K00061590-001-01-1	Broad Institute of MIT and Harvard	BRD-K00061590			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc2ccc(OC)cc2)C[C@@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-6-11-24(35-4)12-7-21)20(2)18-37-26-13-10-23(30-28(33)22-8-9-22)14-25(26)29(34)31(3)17-27(19)36-5/h6-7,10-14,19-20,22,27H,8-9,15-18H2,1-5H3,(H,30,33)/t19-,20-,27+/m0/s1	SOKZPMDKQQIJSP-OWOAZTCBSA-N	509.288971378							97049
BRD-K32992890	LSM-10433		54631567	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24-/m0/s1	MGTDWSJKTZULMI-SRGWNRLKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K32992890	BRD-K32992890-001-01-6	Broad Institute of MIT and Harvard	BRD-K32992890			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24-/m0/s1	MGTDWSJKTZULMI-SRGWNRLKSA-N	500.243498396							99054
BRD-K47119747	LSM-11307		54631356	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16+,21+/m0/s1	BIFUFKYMXIZDEA-GCKMJXCFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K47119747	BRD-K47119747-001-01-4	Broad Institute of MIT and Harvard	BRD-K47119747			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16+,21+/m0/s1	BIFUFKYMXIZDEA-GCKMJXCFSA-N	433.25767125							99928
BRD-K73146135	LSM-12909		54631310	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24-,30-/m0/s1	ONZMGLOOFFOJCP-JYUFKMNQSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K73146135	BRD-K73146135-001-01-4	Broad Institute of MIT and Harvard	BRD-K73146135			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24-,30-/m0/s1	ONZMGLOOFFOJCP-JYUFKMNQSA-N	550.351905992							101546
BRD-K03438483	LSM-8647		54631572	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	CFNBOAHXJHVCOD-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K03438483	BRD-K03438483-001-01-8	Broad Institute of MIT and Harvard	BRD-K03438483			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	CFNBOAHXJHVCOD-SEPYTNNBSA-N	457.237684734							97268
BRD-K70633610	LSM-12737		54631316	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)30-13-16(4)25(5)11-15(3)20(29-7)12-26(6)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20-/m1/s1	AADVJQLQUVDEBP-GQIGUUNPSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K70633610	BRD-K70633610-001-01-8	Broad Institute of MIT and Harvard	BRD-K70633610			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)30-13-16(4)25(5)11-15(3)20(29-7)12-26(6)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20-/m1/s1	AADVJQLQUVDEBP-GQIGUUNPSA-N	420.273655672							101373
BRD-K39379309	LSM-10818		54631592	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m0/s1	FQDNKYOBJJPTQR-XLNZFTOWSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K39379309	BRD-K39379309-001-01-4	Broad Institute of MIT and Harvard	BRD-K39379309			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m0/s1	FQDNKYOBJJPTQR-XLNZFTOWSA-N	484.268570292							99439
BRD-K89416483	LSM-13937		54631405	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20+,26+/m0/s1	AMMFZKQUXZGGMQ-OUDXUNEISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc5cncnc5)C[C@@H]1C	BroadT	BRD-K89416483	BRD-K89416483-001-01-1	Broad Institute of MIT and Harvard	BRD-K89416483			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20+,26+/m0/s1	AMMFZKQUXZGGMQ-OUDXUNEISA-N	574.236224318							102590
BRD-K44011183	LSM-11115		54631338	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16+,20-/m0/s1	CQZVRHUHRGDROH-YRNRMSPPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(Cc3nccs3)C[C@@H]1C	BroadT	BRD-K44011183	BRD-K44011183-001-01-7	Broad Institute of MIT and Harvard	BRD-K44011183			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16+,20-/m0/s1	CQZVRHUHRGDROH-YRNRMSPPSA-N	564.168796112							99736
BRD-K40840224	LSM-10917		54631563	InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18+,26-/m1/s1	MHGGQJRIOQBKBK-FIAZIHOUSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc4cc(F)ccc4F)C[C@H]1C	BroadT	BRD-K40840224	BRD-K40840224-001-01-4	Broad Institute of MIT and Harvard	BRD-K40840224			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18+,26-/m1/s1	MHGGQJRIOQBKBK-FIAZIHOUSA-N	515.25956303							99538
BRD-K24821098	LSM-9939		54631491	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16+,20-/m1/s1	CQZVRHUHRGDROH-GQIGUUNPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(Cc3nccs3)C[C@H]1C	BroadT	BRD-K24821098	BRD-K24821098-001-01-7	Broad Institute of MIT and Harvard	BRD-K24821098			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16+,20-/m1/s1	CQZVRHUHRGDROH-GQIGUUNPSA-N	564.168796112							98560
BRD-K91292927	LSM-14041		54631411	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21+,28-/m0/s1	PDYFFKDIVHOONQ-GTNJKRJXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(CC4CCOCC4)C[C@@H]1C	BroadT	BRD-K91292927	BRD-K91292927-001-01-6	Broad Institute of MIT and Harvard	BRD-K91292927			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(CC2CCOCC2)C[C@@H]1C	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21+,28-/m0/s1	PDYFFKDIVHOONQ-GTNJKRJXSA-N	541.29519961							102694
BRD-K67628477	LSM-12543		54631333	InChI=1S/C25H31F3N4O4/c1-15-12-29-16(2)14-36-21-10-9-19(11-20(21)23(33)32(3)13-22(15)35-4)31-24(34)30-18-7-5-17(6-8-18)25(26,27)28/h5-11,15-16,22,29H,12-14H2,1-4H3,(H2,30,31,34)/t15-,16-,22+/m1/s1	GXRZKRPKTHFHBM-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(cc3)C(F)(F)F)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K67628477	BRD-K67628477-001-01-5	Broad Institute of MIT and Harvard	BRD-K67628477			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(cc3)C(F)(F)F)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H31F3N4O4/c1-15-12-29-16(2)14-36-21-10-9-19(11-20(21)23(33)32(3)13-22(15)35-4)31-24(34)30-18-7-5-17(6-8-18)25(26,27)28/h5-11,15-16,22,29H,12-14H2,1-4H3,(H2,30,31,34)/t15-,16-,22+/m1/s1	GXRZKRPKTHFHBM-MCFFVMPBSA-N	508.229740112							101174
BRD-K83756286	LSM-13549		54631553	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19+,25+/m0/s1	IESMZGXEKVWDTA-OSWQYVSFSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K83756286	BRD-K83756286-001-01-5	Broad Institute of MIT and Harvard	BRD-K83756286			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19+,25+/m0/s1	IESMZGXEKVWDTA-OSWQYVSFSA-N	528.274798524							102191
BRD-K21305994	LSM-9723		54631542	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14-,20+/m0/s1	LINNEEFEDHMFDS-PJSUUKDQSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)onc3C)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K21305994	BRD-K21305994-001-01-9	Broad Institute of MIT and Harvard	BRD-K21305994			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)noc3C)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14-,20+/m0/s1	LINNEEFEDHMFDS-PJSUUKDQSA-N	480.204255474							98344
BRD-K22743786	LSM-9810		54631363	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18+,23-/m1/s1	QARSUPNDRVVANH-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K22743786	BRD-K22743786-001-01-2	Broad Institute of MIT and Harvard	BRD-K22743786			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18+,23-/m1/s1	QARSUPNDRVVANH-IEGUWTFLSA-N	519.251540024							98431
BRD-K26319806	LSM-10024		54631561	InChI=1S/C23H33N5O6S/c1-15-10-28(35(31,32)22-12-26(4)14-24-22)16(2)13-34-20-8-7-18(25-17(3)29)9-19(20)23(30)27(5)11-21(15)33-6/h7-9,12,14-16,21H,10-11,13H2,1-6H3,(H,25,29)/t15-,16+,21-/m0/s1	QWCMRWQEQWRTJY-MRUHUIDDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K26319806	BRD-K26319806-001-01-3	Broad Institute of MIT and Harvard	BRD-K26319806			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)c1cn(C)cn1	InChI=1S/C23H33N5O6S/c1-15-10-28(35(31,32)22-12-26(4)14-24-22)16(2)13-34-20-8-7-18(25-17(3)29)9-19(20)23(30)27(5)11-21(15)33-6/h7-9,12,14-16,21H,10-11,13H2,1-6H3,(H,25,29)/t15-,16+,21-/m0/s1	QWCMRWQEQWRTJY-MRUHUIDDSA-N	507.215154516							98645
BRD-K16955082	LSM-9455		54631420	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	CFNBOAHXJHVCOD-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K16955082	BRD-K16955082-001-01-1	Broad Institute of MIT and Harvard	BRD-K16955082			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	CFNBOAHXJHVCOD-YGKZAACZSA-N	457.237684734							98076
BRD-K87258520	LSM-13778		54631314	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16+,22-/m1/s1	PCJFVZCPKBPEAR-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K87258520	BRD-K87258520-001-01-4	Broad Institute of MIT and Harvard	BRD-K87258520			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16+,22-/m1/s1	PCJFVZCPKBPEAR-ZMPRRUGASA-N	555.266853902							102427
BRD-K39475284	LSM-10826		54631291	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16-,22+/m0/s1	PCJFVZCPKBPEAR-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K39475284	BRD-K39475284-001-01-9	Broad Institute of MIT and Harvard	BRD-K39475284			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16-,22+/m0/s1	PCJFVZCPKBPEAR-PONJGIIJSA-N	555.266853902							99447
BRD-K13324372	LSM-9229		54631500	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-7-6-8-21(28)11-20)19(2)16-36-24-12-22(29-26(32)17-34-4)9-10-23(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m0/s1	KGYIFIZLZVXLPC-OSWQYVSFSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3cccc(F)c3)[C@H](C)COc2c1	BroadT	BRD-K13324372	BRD-K13324372-001-01-2	Broad Institute of MIT and Harvard	BRD-K13324372			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cccc(F)c3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-7-6-8-21(28)11-20)19(2)16-36-24-12-22(29-26(32)17-34-4)9-10-23(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m0/s1	KGYIFIZLZVXLPC-OSWQYVSFSA-N	501.263899482							97850
BRD-K42831041	LSM-11030		54631523	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16-,20-/m1/s1	QTXSGNVPDCTZEW-JXXFODFXSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K42831041	BRD-K42831041-001-01-2	Broad Institute of MIT and Harvard	BRD-K42831041			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16-,20-/m1/s1	QTXSGNVPDCTZEW-JXXFODFXSA-N	509.217126508							99651
BRD-K79881395	LSM-13302		54631433	InChI=1S/C29H38ClN3O7S/c1-19-16-33(41(36,37)24-8-5-22(30)6-9-24)20(2)18-40-26-10-7-23(31-28(34)21-11-13-39-14-12-21)15-25(26)29(35)32(3)17-27(19)38-4/h5-10,15,19-21,27H,11-14,16-18H2,1-4H3,(H,31,34)/t19-,20-,27-/m1/s1	IYBICYHBWQURDQ-SEXOINJZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K79881395	BRD-K79881395-001-01-5	Broad Institute of MIT and Harvard	BRD-K79881395			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C29H38ClN3O7S/c1-19-16-33(41(36,37)24-8-5-22(30)6-9-24)20(2)18-40-26-10-7-23(31-28(34)21-11-13-39-14-12-21)15-25(26)29(35)32(3)17-27(19)38-4/h5-10,15,19-21,27H,11-14,16-18H2,1-4H3,(H,31,34)/t19-,20-,27-/m1/s1	IYBICYHBWQURDQ-SEXOINJZSA-N	607.211898986							101941
BRD-K26507936	LSM-10033		54631499	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18-,26+/m1/s1	ZXQGUZCJBQNBQR-KABRZNFWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4cnccn4	BroadT	BRD-K26507936	BRD-K26507936-001-01-6	Broad Institute of MIT and Harvard	BRD-K26507936			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18-,26+/m1/s1	ZXQGUZCJBQNBQR-KABRZNFWSA-N	582.240224584							98654
BRD-K89432015	LSM-13939		54631432	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24-/m1/s1	MGTDWSJKTZULMI-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K89432015	BRD-K89432015-001-01-5	Broad Institute of MIT and Harvard	BRD-K89432015			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24-/m1/s1	MGTDWSJKTZULMI-HOZJOUCCSA-N	500.243498396							102592
BRD-K03779476	LSM-8663		54631569	InChI=1S/C23H33N5O6S/c1-15-10-28(35(31,32)22-12-26(4)14-24-22)16(2)13-34-20-8-7-18(25-17(3)29)9-19(20)23(30)27(5)11-21(15)33-6/h7-9,12,14-16,21H,10-11,13H2,1-6H3,(H,25,29)/t15-,16+,21+/m0/s1	QWCMRWQEQWRTJY-GCKMJXCFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K03779476	BRD-K03779476-001-01-4	Broad Institute of MIT and Harvard	BRD-K03779476			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)c1cn(C)cn1	InChI=1S/C23H33N5O6S/c1-15-10-28(35(31,32)22-12-26(4)14-24-22)16(2)13-34-20-8-7-18(25-17(3)29)9-19(20)23(30)27(5)11-21(15)33-6/h7-9,12,14-16,21H,10-11,13H2,1-6H3,(H,25,29)/t15-,16+,21+/m0/s1	QWCMRWQEQWRTJY-GCKMJXCFSA-N	507.215154516							97284
BRD-K71904020	LSM-12835		54631332	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21+,26-/m1/s1	AEHXNEHGWHBDEN-YZIHRLCOSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K71904020	BRD-K71904020-001-01-6	Broad Institute of MIT and Harvard	BRD-K71904020			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21+,26-/m1/s1	AEHXNEHGWHBDEN-YZIHRLCOSA-N	560.26685573							101472
BRD-K37517867	LSM-10696		54631290	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16+,20-/m0/s1	ILJGMXMVVDGLNM-YRNRMSPPSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K37517867	BRD-K37517867-001-01-5	Broad Institute of MIT and Harvard	BRD-K37517867			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16+,20-/m0/s1	ILJGMXMVVDGLNM-YRNRMSPPSA-N	433.25767125							99317
BRD-K55381473	LSM-11787		54631524	InChI=1S/C26H32ClF3N4O6S/c1-16-12-34(41(37,38)15-26(28,29)30)17(2)14-40-22-10-9-18(11-19(22)24(35)33(3)13-23(16)39-4)31-25(36)32-21-8-6-5-7-20(21)27/h5-11,16-17,23H,12-15H2,1-4H3,(H2,31,32,36)/t16-,17-,23-/m1/s1	LAYZWFLVYRXBBA-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3Cl)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)CC(F)(F)F	BroadT	BRD-K55381473	BRD-K55381473-001-01-9	Broad Institute of MIT and Harvard	BRD-K55381473			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3Cl)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)CC(F)(F)F	InChI=1S/C26H32ClF3N4O6S/c1-16-12-34(41(37,38)15-26(28,29)30)17(2)14-40-22-10-9-18(11-19(22)24(35)33(3)13-23(16)39-4)31-25(36)32-21-8-6-5-7-20(21)27/h5-11,16-17,23H,12-15H2,1-4H3,(H2,31,32,36)/t16-,17-,23-/m1/s1	LAYZWFLVYRXBBA-SEPYTNNBSA-N	620.168317784							100412
BRD-K79512815	LSM-13285		54631409	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	CFNBOAHXJHVCOD-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K79512815	BRD-K79512815-001-01-8	Broad Institute of MIT and Harvard	BRD-K79512815			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	CFNBOAHXJHVCOD-DGGJZMOXSA-N	457.237684734							101924
BRD-K10774870	LSM-9081		54631551	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24-/m0/s1	DDFXZAACYDZOLE-GLDPYIMESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(CC3CCCCC3)C[C@@H]1C	BroadT	BRD-K10774870	BRD-K10774870-001-01-8	Broad Institute of MIT and Harvard	BRD-K10774870			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24-/m0/s1	DDFXZAACYDZOLE-GLDPYIMESA-N	495.276692132							97702
BRD-K99949435	LSM-14572		54631392	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24+/m0/s1	OZIBRDAYFOJMNO-OBWXTZQISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccc(F)cc3	BroadT	BRD-K99949435	BRD-K99949435-001-01-8	Broad Institute of MIT and Harvard	BRD-K99949435			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccc(F)cc1	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24+/m0/s1	OZIBRDAYFOJMNO-OBWXTZQISA-N	485.232599354							103228
BRD-K80603893	LSM-13357		54631448	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24-/m1/s1	DDFXZAACYDZOLE-YDIMBITNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(CC3CCCCC3)C[C@H]1C	BroadT	BRD-K80603893	BRD-K80603893-001-01-7	Broad Institute of MIT and Harvard	BRD-K80603893			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24-/m1/s1	DDFXZAACYDZOLE-YDIMBITNSA-N	495.276692132							101996
BRD-K74378303	LSM-12983		54631485	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18+,23-/m0/s1	QARSUPNDRVVANH-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K74378303	BRD-K74378303-001-01-8	Broad Institute of MIT and Harvard	BRD-K74378303			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18+,23-/m0/s1	QARSUPNDRVVANH-IXFSTUDKSA-N	519.251540024							101620
BRD-K35944454	LSM-10588		54631341	InChI=1S/C24H32FN3O5S/c1-16-13-27(3)17(2)15-33-22-12-19(26-34(30,31)20-9-6-18(25)7-10-20)8-11-21(22)24(29)28(4)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17-,23-/m1/s1	ACNNVQUQXFZAIX-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K35944454	BRD-K35944454-001-01-2	Broad Institute of MIT and Harvard	BRD-K35944454			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C24H32FN3O5S/c1-16-13-27(3)17(2)15-33-22-12-19(26-34(30,31)20-9-6-18(25)7-10-20)8-11-21(22)24(29)28(4)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17-,23-/m1/s1	ACNNVQUQXFZAIX-SEPYTNNBSA-N	493.204670044							99209
BRD-K80890401	LSM-13379		54631526	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16-,20-/m1/s1	LVUSIZZVUUASSP-JXXFODFXSA-N	CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H]1C)OC	BroadT	BRD-K80890401	BRD-K80890401-001-01-5	Broad Institute of MIT and Harvard	BRD-K80890401			CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H]1C)OC	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16-,20-/m1/s1	LVUSIZZVUUASSP-JXXFODFXSA-N	552.22294017							102018
BRD-K09640010	LSM-9017		54631446	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17+,22+/m0/s1	NPOMWXYRXNIYSA-GSHUGGBRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C3CCOCC3	BroadT	BRD-K09640010	BRD-K09640010-001-01-5	Broad Institute of MIT and Harvard	BRD-K09640010			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CCOCC1	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17+,22+/m0/s1	NPOMWXYRXNIYSA-GSHUGGBRSA-N	511.235221244							97638
BRD-K68887696	LSM-12634		54631331	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	VSOIFNIWZGPCNV-ZYLNGJIFSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K68887696	BRD-K68887696-001-01-1	Broad Institute of MIT and Harvard	BRD-K68887696			CCCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	VSOIFNIWZGPCNV-ZYLNGJIFSA-N	473.325356886							101267
BRD-K33909932	LSM-10483		54631390	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	UHUINQXCHIPGNT-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H]1C	BroadT	BRD-K33909932	BRD-K33909932-001-01-9	Broad Institute of MIT and Harvard	BRD-K33909932			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	UHUINQXCHIPGNT-MFEFFIJZSA-N	455.253254586							99104
BRD-K98194519	LSM-14464		54631489	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14+,20-/m0/s1	LINNEEFEDHMFDS-MNVSYLFESA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)onc3C)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K98194519	BRD-K98194519-001-01-1	Broad Institute of MIT and Harvard	BRD-K98194519			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)noc3C)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14+,20-/m0/s1	LINNEEFEDHMFDS-MNVSYLFESA-N	480.204255474							103119
BRD-K09453969	LSM-9002		54631514	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)30-13-16(4)25(5)11-15(3)20(29-7)12-26(6)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20+/m0/s1	AADVJQLQUVDEBP-RZQQEMMASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K09453969	BRD-K09453969-001-01-4	Broad Institute of MIT and Harvard	BRD-K09453969			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)30-13-16(4)25(5)11-15(3)20(29-7)12-26(6)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20+/m0/s1	AADVJQLQUVDEBP-RZQQEMMASA-N	420.273655672							97623
BRD-K09080977	LSM-8980		54631279	InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18+,26+/m1/s1	MHGGQJRIOQBKBK-ZENTWMBTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc4cc(F)ccc4F)C[C@H]1C	BroadT	BRD-K09080977	BRD-K09080977-001-01-5	Broad Institute of MIT and Harvard	BRD-K09080977			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18+,26+/m1/s1	MHGGQJRIOQBKBK-ZENTWMBTSA-N	515.25956303							97601
BRD-K84921800	LSM-13616		54631369	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19-,25+/m0/s1	IESMZGXEKVWDTA-XHNVNVPESA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K84921800	BRD-K84921800-001-01-1	Broad Institute of MIT and Harvard	BRD-K84921800			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19-,25+/m0/s1	IESMZGXEKVWDTA-XHNVNVPESA-N	528.274798524							102262
BRD-K35727710	LSM-10572		54631488	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17+,22+/m1/s1	NPOMWXYRXNIYSA-JLHGSKIFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C3CCOCC3	BroadT	BRD-K35727710	BRD-K35727710-001-01-1	Broad Institute of MIT and Harvard	BRD-K35727710			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CCOCC1	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17+,22+/m1/s1	NPOMWXYRXNIYSA-JLHGSKIFSA-N	511.235221244							99193
BRD-K17554230	LSM-9485		54631306	InChI=1S/C22H29N5O4/c1-14-10-25-15(2)13-31-19-9-16(26-21(28)18-11-23-7-8-24-18)5-6-17(19)22(29)27(3)12-20(14)30-4/h5-9,11,14-15,20,25H,10,12-13H2,1-4H3,(H,26,28)/t14-,15+,20-/m1/s1	ORFROPTWDCALKP-QEEYODRMSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K17554230	BRD-K17554230-001-01-2	Broad Institute of MIT and Harvard	BRD-K17554230			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C22H29N5O4/c1-14-10-25-15(2)13-31-19-9-16(26-21(28)18-11-23-7-8-24-18)5-6-17(19)22(29)27(3)12-20(14)30-4/h5-9,11,14-15,20,25H,10,12-13H2,1-4H3,(H,26,28)/t14-,15+,20-/m1/s1	ORFROPTWDCALKP-QEEYODRMSA-N	427.221954458							98106
BRD-K74162965	LSM-12969		54631415	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m0/s1	FQDNKYOBJJPTQR-JXQFQVJHSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K74162965	BRD-K74162965-001-01-5	Broad Institute of MIT and Harvard	BRD-K74162965			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m0/s1	FQDNKYOBJJPTQR-JXQFQVJHSA-N	484.268570292							101606
BRD-K34766381	LSM-10519		54631591	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21-,26+/m0/s1	AEHXNEHGWHBDEN-ISJBWFOZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K34766381	BRD-K34766381-001-01-8	Broad Institute of MIT and Harvard	BRD-K34766381			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21-,26+/m0/s1	AEHXNEHGWHBDEN-ISJBWFOZSA-N	560.26685573							99140
BRD-K00816633	LSM-8486		54631531	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m1/s1	JHQFRDYLQMIJCM-KHCICDEESA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)Cc3cccnc3	BroadT	BRD-K00816633	BRD-K00816633-001-01-7	Broad Institute of MIT and Harvard	BRD-K00816633			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)Cc1cccnc1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m1/s1	JHQFRDYLQMIJCM-KHCICDEESA-N	512.263484912							97107
BRD-K95814669	LSM-14304		54631358	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-7-6-8-21(28)11-20)19(2)16-36-24-12-22(29-26(32)17-34-4)9-10-23(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m0/s1	KGYIFIZLZVXLPC-XHNVNVPESA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3cccc(F)c3)[C@@H](C)COc2c1	BroadT	BRD-K95814669	BRD-K95814669-001-01-5	Broad Institute of MIT and Harvard	BRD-K95814669			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3cccc(F)c3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-7-6-8-21(28)11-20)19(2)16-36-24-12-22(29-26(32)17-34-4)9-10-23(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m0/s1	KGYIFIZLZVXLPC-XHNVNVPESA-N	501.263899482							102958
BRD-K91665395	LSM-14057		54631544	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24-,31-/m1/s1	DHPIXDXHWYRYQT-OVMXQCPESA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K91665395	BRD-K91665395-001-01-6	Broad Institute of MIT and Harvard	BRD-K91665395			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24-,31-/m1/s1	DHPIXDXHWYRYQT-OVMXQCPESA-N	573.331504906							102710
BRD-K64778483	LSM-12387		54631570	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18-,24+/m0/s1	CZFNYPFIGBHAGJ-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc3ccccn3	BroadT	BRD-K64778483	BRD-K64778483-001-01-3	Broad Institute of MIT and Harvard	BRD-K64778483			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc1ccccn1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18-,24+/m0/s1	CZFNYPFIGBHAGJ-LLJLJFOGSA-N	482.252920228							101014
BRD-K63415335	LSM-12288		54631419	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20-,26+/m1/s1	AMMFZKQUXZGGMQ-KYTVRQNUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc5cncnc5)C[C@H]1C	BroadT	BRD-K63415335	BRD-K63415335-001-01-3	Broad Institute of MIT and Harvard	BRD-K63415335			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20-,26+/m1/s1	AMMFZKQUXZGGMQ-KYTVRQNUSA-N	574.236224318							100914
BRD-K87524836	LSM-13797		54631376	InChI=1S/C22H29N5O4/c1-14-10-25-15(2)13-31-19-9-16(26-21(28)18-11-23-7-8-24-18)5-6-17(19)22(29)27(3)12-20(14)30-4/h5-9,11,14-15,20,25H,10,12-13H2,1-4H3,(H,26,28)/t14-,15-,20+/m0/s1	ORFROPTWDCALKP-AUSJPIAWSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K87524836	BRD-K87524836-001-01-8	Broad Institute of MIT and Harvard	BRD-K87524836			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C22H29N5O4/c1-14-10-25-15(2)13-31-19-9-16(26-21(28)18-11-23-7-8-24-18)5-6-17(19)22(29)27(3)12-20(14)30-4/h5-9,11,14-15,20,25H,10,12-13H2,1-4H3,(H,26,28)/t14-,15-,20+/m0/s1	ORFROPTWDCALKP-AUSJPIAWSA-N	427.221954458							102446
BRD-K37639981	LSM-10705		54631407	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24-/m1/s1	OZIBRDAYFOJMNO-XVTZWQNCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccc(F)cc3	BroadT	BRD-K37639981	BRD-K37639981-001-01-8	Broad Institute of MIT and Harvard	BRD-K37639981			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccc(F)cc1	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24-/m1/s1	OZIBRDAYFOJMNO-XVTZWQNCSA-N	485.232599354							99326
BRD-K20763958	LSM-9692		54631579	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24+/m1/s1	DDFXZAACYDZOLE-IECBHUPTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(CC3CCCCC3)C[C@H]1C	BroadT	BRD-K20763958	BRD-K20763958-001-01-4	Broad Institute of MIT and Harvard	BRD-K20763958			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24+/m1/s1	DDFXZAACYDZOLE-IECBHUPTSA-N	495.276692132							98313
BRD-K57641516	LSM-11918		54631325	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14+,20-/m1/s1	LINNEEFEDHMFDS-LAPQFRIASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)onc3C)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K57641516	BRD-K57641516-001-01-3	Broad Institute of MIT and Harvard	BRD-K57641516			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)noc3C)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14+,20-/m1/s1	LINNEEFEDHMFDS-LAPQFRIASA-N	480.204255474							100544
BRD-K53155533	LSM-11669		54631450	InChI=1S/C24H37N3O6S/c1-16-13-27(34(5,30)31)17(2)15-33-21-12-19(25-23(28)18-8-6-7-9-18)10-11-20(21)24(29)26(3)14-22(16)32-4/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m0/s1	LHVPUDAVHZTECS-JKSBSHDWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)C	BroadT	BRD-K53155533	BRD-K53155533-001-01-7	Broad Institute of MIT and Harvard	BRD-K53155533			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(C[C@@H]1C)S(C)(=O)=O	InChI=1S/C24H37N3O6S/c1-16-13-27(34(5,30)31)17(2)15-33-21-12-19(25-23(28)18-8-6-7-9-18)10-11-20(21)24(29)26(3)14-22(16)32-4/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m0/s1	LHVPUDAVHZTECS-JKSBSHDWSA-N	495.240306624							100294
BRD-K90947365	LSM-14027		54631494	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18+,25-/m0/s1	RXVPCSLMNQSOJP-ATLLOTDBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K90947365	BRD-K90947365-001-01-5	Broad Institute of MIT and Harvard	BRD-K90947365			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18+,25-/m0/s1	RXVPCSLMNQSOJP-ATLLOTDBSA-N	565.239970438							102680
BRD-K14123146	LSM-9280		54631589	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18+,23+/m0/s1	QARSUPNDRVVANH-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K14123146	BRD-K14123146-001-01-2	Broad Institute of MIT and Harvard	BRD-K14123146			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18+,23+/m0/s1	QARSUPNDRVVANH-YZZKKUAISA-N	519.251540024							97901
BRD-K82869179	LSM-13491		54631554	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24-,30+/m0/s1	ONZMGLOOFFOJCP-FOUYOVOOSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K82869179	BRD-K82869179-001-01-7	Broad Institute of MIT and Harvard	BRD-K82869179			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24-,30+/m0/s1	ONZMGLOOFFOJCP-FOUYOVOOSA-N	550.351905992							102132
MLS003649957	LSM-10984	BRD-K42107428	53382623	InChI=1S/C26H40N4O5/c1-17-14-30(26(33)28-20-9-7-6-8-10-20)18(2)16-35-23-13-21(27-19(3)31)11-12-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H,27,31)(H,28,33)/t17-,18-,24-/m1/s1	RKXWIVMHHDVODV-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC3CCCCC3	BroadT	BRD-K42107428	BRD-K42107428-001-01-0	Broad Institute of MIT and Harvard	BRD-K42107428			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC1CCCCC1	InChI=1S/C26H40N4O5/c1-17-14-30(26(33)28-20-9-7-6-8-10-20)18(2)16-35-23-13-21(27-19(3)31)11-12-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H,27,31)(H,28,33)/t17-,18-,24-/m1/s1	RKXWIVMHHDVODV-QZTZHPFYSA-N	488.29987042							99605
BRD-K27788917	LSM-10103		54631512	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16-,20+/m0/s1	QTXSGNVPDCTZEW-TWOQFEAHSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K27788917	BRD-K27788917-001-01-4	Broad Institute of MIT and Harvard	BRD-K27788917			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H34F3N3O5S/c1-6-34(30,31)26-17-7-8-19-18(11-17)21(29)27(4)13-20(32-5)15(2)12-28(16(3)14-33-19)10-9-22(23,24)25/h7-8,11,15-16,20,26H,6,9-10,12-14H2,1-5H3/t15-,16-,20+/m0/s1	QTXSGNVPDCTZEW-TWOQFEAHSA-N	509.217126508							98724
BRD-K47994485	LSM-11346		54631529	InChI=1S/C31H37F2N3O6S/c1-20-16-36(17-22-14-23(32)6-12-28(22)33)21(2)19-42-29-13-7-24(15-27(29)31(37)35(3)18-30(20)41-5)34-43(38,39)26-10-8-25(40-4)9-11-26/h6-15,20-21,30,34H,16-19H2,1-5H3/t20-,21-,30-/m1/s1	CIWYKAFXEOCFDH-URCPOSBSSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(Cc4cc(F)ccc4F)C[C@H]1C	BroadT	BRD-K47994485	BRD-K47994485-001-01-6	Broad Institute of MIT and Harvard	BRD-K47994485			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C31H37F2N3O6S/c1-20-16-36(17-22-14-23(32)6-12-28(22)33)21(2)19-42-29-13-7-24(15-27(29)31(37)35(3)18-30(20)41-5)34-43(38,39)26-10-8-25(40-4)9-11-26/h6-15,20-21,30,34H,16-19H2,1-5H3/t20-,21-,30-/m1/s1	CIWYKAFXEOCFDH-URCPOSBSSA-N	617.237113024							99967
BRD-K66714409	LSM-12491		54631388	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18-,25-/m0/s1	UZJARJIYRQCXCT-RPPIVITFSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K66714409	BRD-K66714409-001-01-7	Broad Institute of MIT and Harvard	BRD-K66714409			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18-,25-/m0/s1	UZJARJIYRQCXCT-RPPIVITFSA-N	561.2144858							101122
BRD-K24486079	LSM-9912		54631286	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18+,25+/m0/s1	UZJARJIYRQCXCT-YYULODDRSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K24486079	BRD-K24486079-001-01-2	Broad Institute of MIT and Harvard	BRD-K24486079			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18+,25+/m0/s1	UZJARJIYRQCXCT-YYULODDRSA-N	561.2144858							98533
BRD-K50755896	LSM-11522		54631539	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24-/m1/s1	MGTDWSJKTZULMI-XVTZWQNCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K50755896	BRD-K50755896-001-01-8	Broad Institute of MIT and Harvard	BRD-K50755896			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24-/m1/s1	MGTDWSJKTZULMI-XVTZWQNCSA-N	500.243498396							100143
BRD-K44562621	LSM-11140		54631449	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20+,26-/m0/s1	AMMFZKQUXZGGMQ-UNVFRBQDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc5cncnc5)C[C@@H]1C	BroadT	BRD-K44562621	BRD-K44562621-001-01-9	Broad Institute of MIT and Harvard	BRD-K44562621			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20+,26-/m0/s1	AMMFZKQUXZGGMQ-UNVFRBQDSA-N	574.236224318							99761
BRD-K12089955	LSM-9154		54631466	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18-,25-/m1/s1	RXVPCSLMNQSOJP-QJMRKGMQSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K12089955	BRD-K12089955-001-01-7	Broad Institute of MIT and Harvard	BRD-K12089955			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18-,25-/m1/s1	RXVPCSLMNQSOJP-QJMRKGMQSA-N	565.239970438							97775
BRD-K24781739	LSM-9937		54631352	InChI=1S/C28H39FN4O4/c1-19-14-33(15-21-9-7-8-10-24(21)29)20(2)18-37-25-12-11-22(30-27(34)17-31(3)4)13-23(25)28(35)32(5)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,30,34)/t19-,20-,26-/m1/s1	FGNLLZJYKQVDAW-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)CN(C)C)ccc2OC[C@@H](C)N(Cc3ccccc3F)C[C@H]1C	BroadT	BRD-K24781739	BRD-K24781739-001-01-8	Broad Institute of MIT and Harvard	BRD-K24781739			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)CN(C)C)ccc2OC[C@@H](C)N(Cc2ccccc2F)C[C@H]1C	InChI=1S/C28H39FN4O4/c1-19-14-33(15-21-9-7-8-10-24(21)29)20(2)18-37-25-12-11-22(30-27(34)17-31(3)4)13-23(25)28(35)32(5)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,30,34)/t19-,20-,26-/m1/s1	FGNLLZJYKQVDAW-XMERXJNXSA-N	514.295533968							98558
BRD-K96871778	LSM-14377		54631453	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16+,22+/m0/s1	PCJFVZCPKBPEAR-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K96871778	BRD-K96871778-001-01-2	Broad Institute of MIT and Harvard	BRD-K96871778			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16+,22+/m0/s1	PCJFVZCPKBPEAR-WJONJSRFSA-N	555.266853902							103031
BRD-K02943940	LSM-8618		54631366	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17+,22-/m0/s1	NPOMWXYRXNIYSA-JKSBSHDWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C3CCOCC3	BroadT	BRD-K02943940	BRD-K02943940-001-01-5	Broad Institute of MIT and Harvard	BRD-K02943940			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CCOCC1	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17+,22-/m0/s1	NPOMWXYRXNIYSA-JKSBSHDWSA-N	511.235221244							97239
BRD-K28370158	LSM-10145		54631342	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16-,21-/m1/s1	HNVRJEXAKGMODG-WHSLLNHNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K28370158	BRD-K28370158-001-01-8	Broad Institute of MIT and Harvard	BRD-K28370158			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16-,21-/m1/s1	HNVRJEXAKGMODG-WHSLLNHNSA-N	482.19877617							98766
BRD-K97727749	LSM-14433		54631549	InChI=1S/C29H36FN3O5/c1-18-15-33(27(34)13-20-5-6-20)19(2)17-38-25-14-23(31-28(35)21-7-9-22(30)10-8-21)11-12-24(25)29(36)32(3)16-26(18)37-4/h7-12,14,18-20,26H,5-6,13,15-17H2,1-4H3,(H,31,35)/t18-,19+,26+/m1/s1	QTFKJTMJQVNOKY-MVYHEMRASA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CC4CC4	BroadT	BRD-K97727749	BRD-K97727749-001-01-1	Broad Institute of MIT and Harvard	BRD-K97727749			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C29H36FN3O5/c1-18-15-33(27(34)13-20-5-6-20)19(2)17-38-25-14-23(31-28(35)21-7-9-22(30)10-8-21)11-12-24(25)29(36)32(3)16-26(18)37-4/h7-12,14,18-20,26H,5-6,13,15-17H2,1-4H3,(H,31,35)/t18-,19+,26+/m1/s1	QTFKJTMJQVNOKY-MVYHEMRASA-N	525.263899482							103088
BRD-K46959535	LSM-11290		54631301	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21-,26-/m0/s1	AEHXNEHGWHBDEN-WOVHNISZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K46959535	BRD-K46959535-001-01-0	Broad Institute of MIT and Harvard	BRD-K46959535			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21-,26-/m0/s1	AEHXNEHGWHBDEN-WOVHNISZSA-N	560.26685573							99911
BRD-K87851508	LSM-13819		54631559	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	ZGJMWZDWXNCIBA-STSQHVNTSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K87851508	BRD-K87851508-001-01-2	Broad Institute of MIT and Harvard	BRD-K87851508			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	ZGJMWZDWXNCIBA-STSQHVNTSA-N	469.26890465							102469
BRD-K80932888	LSM-13382		54631543	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16-,21-/m1/s1	BIFUFKYMXIZDEA-WHSLLNHNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K80932888	BRD-K80932888-001-01-7	Broad Institute of MIT and Harvard	BRD-K80932888			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16-,21-/m1/s1	BIFUFKYMXIZDEA-WHSLLNHNSA-N	433.25767125							102021
BRD-K69573138	LSM-12673		54631519	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16+,20+/m1/s1	CQZVRHUHRGDROH-GUXCAODWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(Cc3nccs3)C[C@H]1C	BroadT	BRD-K69573138	BRD-K69573138-001-01-2	Broad Institute of MIT and Harvard	BRD-K69573138			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16+,20+/m1/s1	CQZVRHUHRGDROH-GUXCAODWSA-N	564.168796112							101307
BRD-K88269272	LSM-13849		54631374	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21-,28-/m0/s1	PDYFFKDIVHOONQ-CZBREUMFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(CC4CCOCC4)C[C@@H]1C	BroadT	BRD-K88269272	BRD-K88269272-001-01-0	Broad Institute of MIT and Harvard	BRD-K88269272			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(CC2CCOCC2)C[C@@H]1C	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21-,28-/m0/s1	PDYFFKDIVHOONQ-CZBREUMFSA-N	541.29519961							102500
BRD-K27998900	LSM-10123		54631382	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16-,20+/m0/s1	LVUSIZZVUUASSP-TWOQFEAHSA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H]1C)OC	BroadT	BRD-K27998900	BRD-K27998900-001-01-8	Broad Institute of MIT and Harvard	BRD-K27998900			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H]1C)OC	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16-,20+/m0/s1	LVUSIZZVUUASSP-TWOQFEAHSA-N	552.22294017							98744
BRD-K00549770	LSM-8467		54631541	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16-,21+/m0/s1	BIFUFKYMXIZDEA-CKJXQJPGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K00549770	BRD-K00549770-001-01-7	Broad Institute of MIT and Harvard	BRD-K00549770			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16-,21+/m0/s1	BIFUFKYMXIZDEA-CKJXQJPGSA-N	433.25767125							97088
BRD-K22583762	LSM-9797		54631471	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23+/m1/s1	OOHQDHOXZWVAAU-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K22583762	BRD-K22583762-001-01-0	Broad Institute of MIT and Harvard	BRD-K22583762			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23+/m1/s1	OOHQDHOXZWVAAU-QZMQVMSPSA-N	455.242021186							98418
BRD-K33504592	LSM-10459		54631595	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24-/m0/s1	OZIBRDAYFOJMNO-SRGWNRLKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccc(F)cc3	BroadT	BRD-K33504592	BRD-K33504592-001-01-9	Broad Institute of MIT and Harvard	BRD-K33504592			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccc(F)cc1	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24-/m0/s1	OZIBRDAYFOJMNO-SRGWNRLKSA-N	485.232599354							99080
BRD-K19949652	LSM-9638		54631406	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17-,22-/m1/s1	NPOMWXYRXNIYSA-DRSNIGMVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CCOCC3	BroadT	BRD-K19949652	BRD-K19949652-001-01-1	Broad Institute of MIT and Harvard	BRD-K19949652			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCOCC1	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17-,22-/m1/s1	NPOMWXYRXNIYSA-DRSNIGMVSA-N	511.235221244							98259
BRD-K59336577	LSM-12015		54631429	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18-,24-/m1/s1	CZFNYPFIGBHAGJ-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc3ccccn3	BroadT	BRD-K59336577	BRD-K59336577-001-01-4	Broad Institute of MIT and Harvard	BRD-K59336577			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1ccccn1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18-,24-/m1/s1	CZFNYPFIGBHAGJ-QZTZHPFYSA-N	482.252920228							100641
BRD-K17506650-001-01-3	LSM-9479	BRD-K17506650	54631340	InChI=1S/C32H41F3N4O5/c1-20-17-39(31(42)37-24-12-10-23(11-13-24)32(33,34)35)21(2)19-44-27-15-14-25(36-29(40)22-8-6-5-7-9-22)16-26(27)30(41)38(3)18-28(20)43-4/h10-16,20-22,28H,5-9,17-19H2,1-4H3,(H,36,40)(H,37,42)/t20-,21-,28-/m1/s1	ZLDULQSRVLRGMO-UMQWNRPGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4ccc(cc4)C(F)(F)F	BroadT	BRD-K17506650	BRD-K17506650-001-01-3	Broad Institute of MIT and Harvard	BRD-K17506650			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C32H41F3N4O5/c1-20-17-39(31(42)37-24-12-10-23(11-13-24)32(33,34)35)21(2)19-44-27-15-14-25(36-29(40)22-8-6-5-7-9-22)16-26(27)30(41)38(3)18-28(20)43-4/h10-16,20-22,28H,5-9,17-19H2,1-4H3,(H,36,40)(H,37,42)/t20-,21-,28-/m1/s1	ZLDULQSRVLRGMO-UMQWNRPGSA-N	618.302905052							98100
BRD-K37225168	LSM-10675		54631460	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-6-5-11-28-13-20)18(2)16-36-23-10-9-21(29-25(32)19-7-8-19)12-22(23)27(34)30(3)15-24(17)35-4/h5-6,9-13,17-19,24H,7-8,14-16H2,1-4H3,(H,29,32)/t17-,18+,24+/m0/s1	DILHJWACXDWAEF-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4cccnc4	BroadT	BRD-K37225168	BRD-K37225168-001-01-1	Broad Institute of MIT and Harvard	BRD-K37225168			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1cccnc1	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-6-5-11-28-13-20)18(2)16-36-23-10-9-21(29-25(32)19-7-8-19)12-22(23)27(34)30(3)15-24(17)35-4/h5-6,9-13,17-19,24H,7-8,14-16H2,1-4H3,(H,29,32)/t17-,18+,24+/m0/s1	DILHJWACXDWAEF-HOOSLVGPSA-N	494.252920228							99296
BRD-K00575615	LSM-8471		54631428	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18-,23-/m1/s1	QARSUPNDRVVANH-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K00575615	BRD-K00575615-001-01-1	Broad Institute of MIT and Harvard	BRD-K00575615			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18-,23-/m1/s1	QARSUPNDRVVANH-PMAPCBKXSA-N	519.251540024							97092
BRD-K07817703	LSM-8901		54631317	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18-,25+/m1/s1	RXVPCSLMNQSOJP-GAKIBJFNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K07817703	BRD-K07817703-001-01-3	Broad Institute of MIT and Harvard	BRD-K07817703			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18-,25+/m1/s1	RXVPCSLMNQSOJP-GAKIBJFNSA-N	565.239970438							97522
BRD-K76224440	LSM-13085		54631320	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18+,25-/m0/s1	UZJARJIYRQCXCT-ATLLOTDBSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K76224440	BRD-K76224440-001-01-6	Broad Institute of MIT and Harvard	BRD-K76224440			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18+,25-/m0/s1	UZJARJIYRQCXCT-ATLLOTDBSA-N	561.2144858							101723
BRD-K67187917	LSM-12516		54631288	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16-,20+/m1/s1	LVUSIZZVUUASSP-QINHECLXSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H]1C)OC	BroadT	BRD-K67187917	BRD-K67187917-001-01-0	Broad Institute of MIT and Harvard	BRD-K67187917			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H]1C)OC	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16-,20+/m1/s1	LVUSIZZVUUASSP-QINHECLXSA-N	552.22294017							101147
BRD-K66944475	LSM-12506		54631346	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	VSOIFNIWZGPCNV-DFIYOIEZSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K66944475	BRD-K66944475-001-01-9	Broad Institute of MIT and Harvard	BRD-K66944475			CCCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	VSOIFNIWZGPCNV-DFIYOIEZSA-N	473.325356886							101137
BRD-K74345748	LSM-12981		54631498	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	UHUINQXCHIPGNT-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3cncnc3)C[C@H]1C	BroadT	BRD-K74345748	BRD-K74345748-001-01-0	Broad Institute of MIT and Harvard	BRD-K74345748			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	UHUINQXCHIPGNT-SEPYTNNBSA-N	455.253254586							101618
BRD-K58733842	LSM-11978		54631511	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	CFNBOAHXJHVCOD-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K58733842	BRD-K58733842-001-01-2	Broad Institute of MIT and Harvard	BRD-K58733842			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	CFNBOAHXJHVCOD-MFEFFIJZSA-N	457.237684734							100604
BRD-K48327915	LSM-11370		54631568	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18+,24-/m1/s1	CZFNYPFIGBHAGJ-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc3ccccn3	BroadT	BRD-K48327915	BRD-K48327915-001-01-8	Broad Institute of MIT and Harvard	BRD-K48327915			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc1ccccn1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18+,24-/m1/s1	CZFNYPFIGBHAGJ-NXMSCROESA-N	482.252920228							99991
BRD-K73474555	LSM-12928		54631537	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24+/m0/s1	OZIBRDAYFOJMNO-WOGXIUBCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccc(F)cc3	BroadT	BRD-K73474555	BRD-K73474555-001-01-1	Broad Institute of MIT and Harvard	BRD-K73474555			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccc(F)cc1	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24+/m0/s1	OZIBRDAYFOJMNO-WOGXIUBCSA-N	485.232599354							101565
BRD-K58499277	LSM-11959		54631474	InChI=1S/C24H37N3O6S/c1-16-13-27(34(5,30)31)17(2)15-33-21-12-19(25-23(28)18-8-6-7-9-18)10-11-20(21)24(29)26(3)14-22(16)32-4/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m1/s1	LHVPUDAVHZTECS-JLHGSKIFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K58499277	BRD-K58499277-001-01-4	Broad Institute of MIT and Harvard	BRD-K58499277			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C24H37N3O6S/c1-16-13-27(34(5,30)31)17(2)15-33-21-12-19(25-23(28)18-8-6-7-9-18)10-11-20(21)24(29)26(3)14-22(16)32-4/h10-12,16-18,22H,6-9,13-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m1/s1	LHVPUDAVHZTECS-JLHGSKIFSA-N	495.240306624							100585
MLS003649961	LSM-12555	BRD-K67733157, SID125305270	53382626	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24-,30-/m1/s1	ONZMGLOOFFOJCP-BOYVUMAVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K67733157	BRD-K67733157-001-01-0	Broad Institute of MIT and Harvard	BRD-K67733157			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24-,30-/m1/s1	ONZMGLOOFFOJCP-BOYVUMAVSA-N	550.351905992							101186
BRD-K82599388	LSM-13473		54631508	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16-,22-/m1/s1	PCJFVZCPKBPEAR-XCGNWRKASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K82599388	BRD-K82599388-001-01-7	Broad Institute of MIT and Harvard	BRD-K82599388			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16-,22-/m1/s1	PCJFVZCPKBPEAR-XCGNWRKASA-N	555.266853902							102113
BRD-K17157530	LSM-9465		54631484	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21+,26+/m1/s1	AEHXNEHGWHBDEN-SWYRRKHMSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K17157530	BRD-K17157530-001-01-1	Broad Institute of MIT and Harvard	BRD-K17157530			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21+,26+/m1/s1	AEHXNEHGWHBDEN-SWYRRKHMSA-N	560.26685573							98086
BRD-K24562909	LSM-9918		54631573	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18-,25+/m0/s1	UZJARJIYRQCXCT-DPOKWSEZSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K24562909	BRD-K24562909-001-01-6	Broad Institute of MIT and Harvard	BRD-K24562909			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18-,25+/m0/s1	UZJARJIYRQCXCT-DPOKWSEZSA-N	561.2144858							98539
BRD-K70751797	LSM-12742		54631546	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m1/s1	FQDNKYOBJJPTQR-KHCICDEESA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K70751797	BRD-K70751797-001-01-3	Broad Institute of MIT and Harvard	BRD-K70751797			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m1/s1	FQDNKYOBJJPTQR-KHCICDEESA-N	484.268570292							101378
BRD-K06240911	LSM-8793		54631292	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	UHUINQXCHIPGNT-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3cncnc3)C[C@H]1C	BroadT	BRD-K06240911	BRD-K06240911-001-01-7	Broad Institute of MIT and Harvard	BRD-K06240911			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	UHUINQXCHIPGNT-QZMQVMSPSA-N	455.253254586							97414
BRD-K96077293	LSM-14324		54631506	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-6-11-24(35-4)12-7-21)20(2)18-37-26-13-10-23(30-28(33)22-8-9-22)14-25(26)29(34)31(3)17-27(19)36-5/h6-7,10-14,19-20,22,27H,8-9,15-18H2,1-5H3,(H,30,33)/t19-,20-,27-/m1/s1	SOKZPMDKQQIJSP-SEXOINJZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc4ccc(OC)cc4)C[C@H]1C	BroadT	BRD-K96077293	BRD-K96077293-001-01-2	Broad Institute of MIT and Harvard	BRD-K96077293			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc2ccc(OC)cc2)C[C@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-6-11-24(35-4)12-7-21)20(2)18-37-26-13-10-23(30-28(33)22-8-9-22)14-25(26)29(34)31(3)17-27(19)36-5/h6-7,10-14,19-20,22,27H,8-9,15-18H2,1-5H3,(H,30,33)/t19-,20-,27-/m1/s1	SOKZPMDKQQIJSP-SEXOINJZSA-N	509.288971378							102978
BRD-K94669078	LSM-14227		54631518	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16-,22-/m0/s1	PCJFVZCPKBPEAR-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K94669078	BRD-K94669078-001-01-9	Broad Institute of MIT and Harvard	BRD-K94669078			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16-,22-/m0/s1	PCJFVZCPKBPEAR-WCJKSRRJSA-N	555.266853902							102881
BRD-K83896715	LSM-13557		54631430	InChI=1S/C30H38N4O5S/c1-21-9-12-26(13-10-21)40(36,37)32-24-11-14-27-28(16-24)39-20-23(3)34(18-25-8-6-7-15-31-25)17-22(2)29(38-5)19-33(4)30(27)35/h6-16,22-23,29,32H,17-20H2,1-5H3/t22-,23-,29-/m1/s1	VIFLTFBPRKOVBZ-VDWGHMIBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)N(Cc4ccccn4)C[C@H]1C	BroadT	BRD-K83896715	BRD-K83896715-001-01-0	Broad Institute of MIT and Harvard	BRD-K83896715			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C30H38N4O5S/c1-21-9-12-26(13-10-21)40(36,37)32-24-11-14-27-28(16-24)39-20-23(3)34(18-25-8-6-7-15-31-25)17-22(2)29(38-5)19-33(4)30(27)35/h6-16,22-23,29,32H,17-20H2,1-5H3/t22-,23-,29-/m1/s1	VIFLTFBPRKOVBZ-VDWGHMIBSA-N	566.256291046							102199
BRD-K46419847	LSM-11263		54631300	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16+,21-/m1/s1	HNVRJEXAKGMODG-VWKPWSFCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K46419847	BRD-K46419847-001-01-8	Broad Institute of MIT and Harvard	BRD-K46419847			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16+,21-/m1/s1	HNVRJEXAKGMODG-VWKPWSFCSA-N	482.19877617							99884
BRD-K20555183	LSM-9680		54631348	InChI=1S/C30H34ClN5O5/c1-19-16-36(30(39)34-24-10-6-5-9-23(24)31)20(2)18-41-26-15-21(33-28(37)25-11-7-8-14-32-25)12-13-22(26)29(38)35(3)17-27(19)40-4/h5-15,19-20,27H,16-18H2,1-4H3,(H,33,37)(H,34,39)/t19-,20-,27-/m1/s1	DHFBNNLIQXQYTF-SEXOINJZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4ccccc4Cl	BroadT	BRD-K20555183	BRD-K20555183-001-01-1	Broad Institute of MIT and Harvard	BRD-K20555183			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1ccccc1Cl	InChI=1S/C30H34ClN5O5/c1-19-16-36(30(39)34-24-10-6-5-9-23(24)31)20(2)18-41-26-15-21(33-28(37)25-11-7-8-14-32-25)12-13-22(26)29(38)35(3)17-27(19)40-4/h5-15,19-20,27H,16-18H2,1-4H3,(H,33,37)(H,34,39)/t19-,20-,27-/m1/s1	DHFBNNLIQXQYTF-SEXOINJZSA-N	579.224846948							98301
BRD-K56004278	LSM-11818		54631565	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m0/s1	ZGJMWZDWXNCIBA-IUKKYPGJSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K56004278	BRD-K56004278-001-01-3	Broad Institute of MIT and Harvard	BRD-K56004278			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m0/s1	ZGJMWZDWXNCIBA-IUKKYPGJSA-N	469.26890465							100443
BRD-K08540981	LSM-8945		54631295	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16+,22+/m1/s1	PCJFVZCPKBPEAR-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K08540981	BRD-K08540981-001-01-3	Broad Institute of MIT and Harvard	BRD-K08540981			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16+,22+/m1/s1	PCJFVZCPKBPEAR-VVBPWWLESA-N	555.266853902							97566
BRD-K68903590	LSM-12635		54631558	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m0/s1	JHQFRDYLQMIJCM-XLNZFTOWSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)Cc3cccnc3	BroadT	BRD-K68903590	BRD-K68903590-001-01-3	Broad Institute of MIT and Harvard	BRD-K68903590			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)Cc1cccnc1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m0/s1	JHQFRDYLQMIJCM-XLNZFTOWSA-N	512.263484912							101268
BRD-K98997045	LSM-14507		54631530	InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18-,26-/m1/s1	MHGGQJRIOQBKBK-UYPAYLBCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc4cc(F)ccc4F)C[C@H]1C	BroadT	BRD-K98997045	BRD-K98997045-001-01-0	Broad Institute of MIT and Harvard	BRD-K98997045			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18-,26-/m1/s1	MHGGQJRIOQBKBK-UYPAYLBCSA-N	515.25956303							103162
BRD-K53394241	LSM-11684		54631548	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m0/s1	JHQFRDYLQMIJCM-GLDPYIMESA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)Cc3cccnc3	BroadT	BRD-K53394241	BRD-K53394241-001-01-5	Broad Institute of MIT and Harvard	BRD-K53394241			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)Cc1cccnc1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m0/s1	JHQFRDYLQMIJCM-GLDPYIMESA-N	512.263484912							100309
BRD-K63903580	LSM-12325		54631339	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21+,26-/m0/s1	AEHXNEHGWHBDEN-UZINWLIJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K63903580	BRD-K63903580-001-01-0	Broad Institute of MIT and Harvard	BRD-K63903580			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21+,26-/m0/s1	AEHXNEHGWHBDEN-UZINWLIJSA-N	560.26685573							100952
BRD-K22210284	LSM-9773		54631313	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24+/m1/s1	DDFXZAACYDZOLE-IMWIBFENSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(CC3CCCCC3)C[C@H]1C	BroadT	BRD-K22210284	BRD-K22210284-001-01-9	Broad Institute of MIT and Harvard	BRD-K22210284			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19+,24+/m1/s1	DDFXZAACYDZOLE-IMWIBFENSA-N	495.276692132							98394
BRD-K00927991	LSM-8490		54631327	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)30-13-16(4)25(5)11-15(3)20(29-7)12-26(6)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20+/m0/s1	AADVJQLQUVDEBP-TWOQFEAHSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K00927991	BRD-K00927991-001-01-8	Broad Institute of MIT and Harvard	BRD-K00927991			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)30-13-16(4)25(5)11-15(3)20(29-7)12-26(6)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20+/m0/s1	AADVJQLQUVDEBP-TWOQFEAHSA-N	420.273655672							97111
BRD-K32602441	LSM-6828		54631468	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)30-13-16(4)25(5)11-15(3)20(29-7)12-26(6)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20+/m1/s1	AADVJQLQUVDEBP-QINHECLXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K32602441	BRD-K32602441-001-01-5	Broad Institute of MIT and Harvard	BRD-K32602441			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)30-13-16(4)25(5)11-15(3)20(29-7)12-26(6)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20+/m1/s1	AADVJQLQUVDEBP-QINHECLXSA-N	420.273655672							95449
BRD-K18097652	LSM-9512		54631505	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17-,22+/m1/s1	NPOMWXYRXNIYSA-YVHKJVDXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CCOCC3	BroadT	BRD-K18097652	BRD-K18097652-001-01-0	Broad Institute of MIT and Harvard	BRD-K18097652			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCOCC1	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17-,22+/m1/s1	NPOMWXYRXNIYSA-YVHKJVDXSA-N	511.235221244							98133
BRD-K80472474	LSM-13349		54631501	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21-,28+/m0/s1	PDYFFKDIVHOONQ-YHGPEZAFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(CC4CCOCC4)C[C@@H]1C	BroadT	BRD-K80472474	BRD-K80472474-001-01-4	Broad Institute of MIT and Harvard	BRD-K80472474			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(CC2CCOCC2)C[C@@H]1C	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21-,28+/m0/s1	PDYFFKDIVHOONQ-YHGPEZAFSA-N	541.29519961							101988
BRD-K89304341	LSM-13926		54631515	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	FQDNKYOBJJPTQR-IMWIBFENSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K89304341	BRD-K89304341-001-01-1	Broad Institute of MIT and Harvard	BRD-K89304341			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	FQDNKYOBJJPTQR-IMWIBFENSA-N	484.268570292							102579
BRD-K07286283-001-01-9	LSM-18083	BRD-K07286283	54631456	InChI=1S/C30H38N4O5S/c1-22-17-34(18-25-11-8-14-31-16-25)23(2)20-39-28-13-12-26(15-27(28)30(35)33(3)19-29(22)38-4)32-40(36,37)21-24-9-6-5-7-10-24/h5-16,22-23,29,32H,17-21H2,1-4H3/t22-,23-,29-/m1/s1	LUADIBMUAAENJU-VDWGHMIBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K07286283	BRD-K07286283-001-01-9	Broad Institute of MIT and Harvard	BRD-K07286283			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C30H38N4O5S/c1-22-17-34(18-25-11-8-14-31-16-25)23(2)20-39-28-13-12-26(15-27(28)30(35)33(3)19-29(22)38-4)32-40(36,37)21-24-9-6-5-7-10-24/h5-16,22-23,29,32H,17-21H2,1-4H3/t22-,23-,29-/m1/s1	LUADIBMUAAENJU-VDWGHMIBSA-N	566.256291046							106727
BRD-K32809121	LSM-10420		54631417	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18-,26-/m0/s1	ZXQGUZCJBQNBQR-XWXLMPLOSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4cnccn4	BroadT	BRD-K32809121	BRD-K32809121-001-01-3	Broad Institute of MIT and Harvard	BRD-K32809121			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1cnccn1	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18-,26-/m0/s1	ZXQGUZCJBQNBQR-XWXLMPLOSA-N	582.240224584							99041
BRD-K38889985	LSM-10784		54631582	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23-/m0/s1	OOHQDHOXZWVAAU-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K38889985	BRD-K38889985-001-01-4	Broad Institute of MIT and Harvard	BRD-K38889985			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23-/m0/s1	OOHQDHOXZWVAAU-QQMNAOGKSA-N	455.242021186							99405
BRD-K61164584	LSM-12131		54631410	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16+,22-/m0/s1	PCJFVZCPKBPEAR-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K61164584	BRD-K61164584-001-01-7	Broad Institute of MIT and Harvard	BRD-K61164584			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C26H36F3N5O5/c1-15-12-34(10-9-26(27,28)29)16(2)14-38-21-8-7-19(11-20(21)24(35)33(5)13-22(15)37-6)30-25(36)31-23-17(3)32-39-18(23)4/h7-8,11,15-16,22H,9-10,12-14H2,1-6H3,(H2,30,31,36)/t15-,16+,22-/m0/s1	PCJFVZCPKBPEAR-DMPWYTOCSA-N	555.266853902							100757
BRD-K98783629	LSM-14490		54631304	InChI=1S/C23H33N5O6S/c1-15-10-28(35(31,32)22-12-26(4)14-24-22)16(2)13-34-20-8-7-18(25-17(3)29)9-19(20)23(30)27(5)11-21(15)33-6/h7-9,12,14-16,21H,10-11,13H2,1-6H3,(H,25,29)/t15-,16-,21-/m0/s1	QWCMRWQEQWRTJY-QYWGDWMGSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K98783629	BRD-K98783629-001-01-8	Broad Institute of MIT and Harvard	BRD-K98783629			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)S(=O)(=O)c1cn(C)cn1	InChI=1S/C23H33N5O6S/c1-15-10-28(35(31,32)22-12-26(4)14-24-22)16(2)13-34-20-8-7-18(25-17(3)29)9-19(20)23(30)27(5)11-21(15)33-6/h7-9,12,14-16,21H,10-11,13H2,1-6H3,(H,25,29)/t15-,16-,21-/m0/s1	QWCMRWQEQWRTJY-QYWGDWMGSA-N	507.215154516							103145
BRD-K20877010	LSM-9702		54631393	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24-,31+/m0/s1	DHPIXDXHWYRYQT-ISTJGCCRSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K20877010	BRD-K20877010-001-01-8	Broad Institute of MIT and Harvard	BRD-K20877010			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24-,31+/m0/s1	DHPIXDXHWYRYQT-ISTJGCCRSA-N	573.331504906							98323
BRD-K48479537	LSM-11378		54631367	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16-,21+/m0/s1	HNVRJEXAKGMODG-CKJXQJPGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K48479537	BRD-K48479537-001-01-5	Broad Institute of MIT and Harvard	BRD-K48479537			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H30N4O4S/c1-15-12-26-16(2)14-33-20-11-17(9-10-18(20)25(31)29(3)13-21(15)32-4)27-23(30)24-28-19-7-5-6-8-22(19)34-24/h5-11,15-16,21,26H,12-14H2,1-4H3,(H,27,30)/t15-,16-,21+/m0/s1	HNVRJEXAKGMODG-CKJXQJPGSA-N	482.19877617							99999
BRD-K00196194	LSM-8435		54631426	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21-,26-/m1/s1	AEHXNEHGWHBDEN-IPVFLDMMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K00196194	BRD-K00196194-001-01-5	Broad Institute of MIT and Harvard	BRD-K00196194			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21-,26-/m1/s1	AEHXNEHGWHBDEN-IPVFLDMMSA-N	560.26685573							97056
BRD-K41421455	LSM-10944		54631361	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	VOCYCOKXIBOWBC-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K41421455	BRD-K41421455-001-01-2	Broad Institute of MIT and Harvard	BRD-K41421455			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	VOCYCOKXIBOWBC-PONJGIIJSA-N	474.203383222							99565
CHEMBL2145122	LSM-14536	SID131427648, BRD-K99469929	54631408	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24+,31-/m0/s1	DHPIXDXHWYRYQT-JLELKNTQSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K99469929	BRD-K99469929-001-01-0	Broad Institute of MIT and Harvard	BRD-K99469929			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24+,31-/m0/s1	DHPIXDXHWYRYQT-JLELKNTQSA-N	573.331504906							103191
BRD-K98622504	LSM-14482		54631303	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-7-6-8-21(28)11-20)19(2)16-36-24-12-22(29-26(32)17-34-4)9-10-23(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m1/s1	KGYIFIZLZVXLPC-RRQZXNHTSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3cccc(F)c3)[C@H](C)COc2c1	BroadT	BRD-K98622504	BRD-K98622504-001-01-8	Broad Institute of MIT and Harvard	BRD-K98622504			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cccc(F)c3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-7-6-8-21(28)11-20)19(2)16-36-24-12-22(29-26(32)17-34-4)9-10-23(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m1/s1	KGYIFIZLZVXLPC-RRQZXNHTSA-N	501.263899482							103137
BRD-K02653676	LSM-8602		54631516	InChI=1S/C22H29N5O4/c1-14-10-25-15(2)13-31-19-9-16(26-21(28)18-11-23-7-8-24-18)5-6-17(19)22(29)27(3)12-20(14)30-4/h5-9,11,14-15,20,25H,10,12-13H2,1-4H3,(H,26,28)/t14-,15+,20+/m1/s1	ORFROPTWDCALKP-SIFCLUCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K02653676	BRD-K02653676-001-01-0	Broad Institute of MIT and Harvard	BRD-K02653676			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C22H29N5O4/c1-14-10-25-15(2)13-31-19-9-16(26-21(28)18-11-23-7-8-24-18)5-6-17(19)22(29)27(3)12-20(14)30-4/h5-9,11,14-15,20,25H,10,12-13H2,1-4H3,(H,26,28)/t14-,15+,20+/m1/s1	ORFROPTWDCALKP-SIFCLUCFSA-N	427.221954458							97223
BRD-K92978187	LSM-14132		54631385	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18+,24-/m0/s1	CZFNYPFIGBHAGJ-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc3ccccn3	BroadT	BRD-K92978187	BRD-K92978187-001-01-4	Broad Institute of MIT and Harvard	BRD-K92978187			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc1ccccn1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)13-20-8-6-7-11-27-20)18(2)16-35-23-12-21(28-19(3)31)9-10-22(23)26(33)29(4)15-24(17)34-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,28,31)/t17-,18+,24-/m0/s1	CZFNYPFIGBHAGJ-RHGYRFJNSA-N	482.252920228							102786
BRD-K14209633	LSM-9284		54631389	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m1/s1	JHQFRDYLQMIJCM-IECBHUPTSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)Cc3cccnc3	BroadT	BRD-K14209633	BRD-K14209633-001-01-9	Broad Institute of MIT and Harvard	BRD-K14209633			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)Cc1cccnc1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m1/s1	JHQFRDYLQMIJCM-IECBHUPTSA-N	512.263484912							97905
BRD-K71857815	LSM-12831		54631560	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18+,23+/m1/s1	QARSUPNDRVVANH-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K71857815	BRD-K71857815-001-01-5	Broad Institute of MIT and Harvard	BRD-K71857815			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18+,23+/m1/s1	QARSUPNDRVVANH-STSQHVNTSA-N	519.251540024							101468
BRD-K48553449	LSM-11383		54631371	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18-,26+/m0/s1	ZXQGUZCJBQNBQR-QSAFDGGLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4cnccn4	BroadT	BRD-K48553449	BRD-K48553449-001-01-4	Broad Institute of MIT and Harvard	BRD-K48553449			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1cnccn1	InChI=1S/C29H32F2N6O5/c1-17-14-37(28(39)24-13-32-9-10-33-24)18(2)16-42-25-12-20(6-7-21(25)27(38)36(3)15-26(17)41-4)34-29(40)35-23-11-19(30)5-8-22(23)31/h5-13,17-18,26H,14-16H2,1-4H3,(H2,34,35,40)/t17-,18-,26+/m0/s1	ZXQGUZCJBQNBQR-QSAFDGGLSA-N	582.240224584							100004
BRD-K02356765	LSM-8581		54631380	InChI=1S/C23H33N5O6S/c1-15-10-28(35(31,32)22-12-26(4)14-24-22)16(2)13-34-20-8-7-18(25-17(3)29)9-19(20)23(30)27(5)11-21(15)33-6/h7-9,12,14-16,21H,10-11,13H2,1-6H3,(H,25,29)/t15-,16-,21-/m1/s1	QWCMRWQEQWRTJY-WHSLLNHNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K02356765	BRD-K02356765-001-01-2	Broad Institute of MIT and Harvard	BRD-K02356765			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c1cn(C)cn1	InChI=1S/C23H33N5O6S/c1-15-10-28(35(31,32)22-12-26(4)14-24-22)16(2)13-34-20-8-7-18(25-17(3)29)9-19(20)23(30)27(5)11-21(15)33-6/h7-9,12,14-16,21H,10-11,13H2,1-6H3,(H,25,29)/t15-,16-,21-/m1/s1	QWCMRWQEQWRTJY-WHSLLNHNSA-N	507.215154516							97202
BRD-K15172981	LSM-9336		54631552	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18-,23+/m0/s1	QARSUPNDRVVANH-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K15172981	BRD-K15172981-001-01-6	Broad Institute of MIT and Harvard	BRD-K15172981			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18-,23+/m0/s1	QARSUPNDRVVANH-IUKKYPGJSA-N	519.251540024							97957
BRD-K76258424	LSM-13090		54631335	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	CFNBOAHXJHVCOD-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K76258424	BRD-K76258424-001-01-4	Broad Institute of MIT and Harvard	BRD-K76258424			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	CFNBOAHXJHVCOD-SAHWJRBASA-N	457.237684734							101728
BRD-K47501069	LSM-11323		54631487	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m1/s1	JHQFRDYLQMIJCM-IMWIBFENSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)Cc3cccnc3	BroadT	BRD-K47501069	BRD-K47501069-001-01-3	Broad Institute of MIT and Harvard	BRD-K47501069			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)Cc1cccnc1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m1/s1	JHQFRDYLQMIJCM-IMWIBFENSA-N	512.263484912							99944
BRD-K58590337	LSM-11964		54631584	InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18-,26+/m1/s1	MHGGQJRIOQBKBK-KABRZNFWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc4cc(F)ccc4F)C[C@H]1C	BroadT	BRD-K58590337	BRD-K58590337-001-01-8	Broad Institute of MIT and Harvard	BRD-K58590337			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18-,26+/m1/s1	MHGGQJRIOQBKBK-KABRZNFWSA-N	515.25956303							100590
BRD-K66046471	LSM-12457		54631344	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	CFNBOAHXJHVCOD-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K66046471	BRD-K66046471-001-01-7	Broad Institute of MIT and Harvard	BRD-K66046471			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	CFNBOAHXJHVCOD-HKARXFIJSA-N	457.237684734							131206
BRD-K79516068	LSM-13286		54631359	InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18+,26-/m0/s1	MHGGQJRIOQBKBK-DFXHWTJYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc4cc(F)ccc4F)C[C@@H]1C	BroadT	BRD-K79516068	BRD-K79516068-001-01-3	Broad Institute of MIT and Harvard	BRD-K79516068			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@@H]1C	InChI=1S/C28H35F2N3O4/c1-17-13-33(14-20-11-21(29)7-10-24(20)30)18(2)16-37-25-12-22(31-27(34)19-5-6-19)8-9-23(25)28(35)32(3)15-26(17)36-4/h7-12,17-19,26H,5-6,13-16H2,1-4H3,(H,31,34)/t17-,18+,26-/m0/s1	MHGGQJRIOQBKBK-DFXHWTJYSA-N	515.25956303							101925
BRD-K75596743	LSM-13051		54631402	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14-,20-/m0/s1	LINNEEFEDHMFDS-YRVVQQKDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)onc3C)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K75596743	BRD-K75596743-001-01-2	Broad Institute of MIT and Harvard	BRD-K75596743			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)noc3C)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14-,20-/m0/s1	LINNEEFEDHMFDS-YRVVQQKDSA-N	480.204255474							101688
BRD-K27161788	LSM-10071		54631587	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	UHUINQXCHIPGNT-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3cncnc3)C[C@H]1C	BroadT	BRD-K27161788	BRD-K27161788-001-01-0	Broad Institute of MIT and Harvard	BRD-K27161788			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	UHUINQXCHIPGNT-DGGJZMOXSA-N	455.253254586							98692
BRD-K70459579	LSM-12727		54631545	InChI=1S/C17H27N3O3/c1-11-8-19-12(2)10-23-15-7-13(18)5-6-14(15)17(21)20(3)9-16(11)22-4/h5-7,11-12,16,19H,8-10,18H2,1-4H3/t11-,12-,16-/m1/s1	QJVJBGSWJYMVMN-XHBSWPGZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(N)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K70459579	BRD-K70459579-001-01-7	Broad Institute of MIT and Harvard	BRD-K70459579			CO[C@@H]1CN(C)C(=O)c2ccc(N)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C17H27N3O3/c1-11-8-19-12(2)10-23-15-7-13(18)5-6-14(15)17(21)20(3)9-16(11)22-4/h5-7,11-12,16,19H,8-10,18H2,1-4H3/t11-,12-,16-/m1/s1	QJVJBGSWJYMVMN-XHBSWPGZSA-N	321.205241754							101363
BRD-K39435863	LSM-10824		54631493	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24+/m1/s1	OZIBRDAYFOJMNO-KCYKTTMJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccc(F)cc3	BroadT	BRD-K39435863	BRD-K39435863-001-01-2	Broad Institute of MIT and Harvard	BRD-K39435863			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccc(F)cc1	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17+,24+/m1/s1	OZIBRDAYFOJMNO-KCYKTTMJSA-N	485.232599354							99445
BRD-K31392657	LSM-10329		54631482	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24+/m1/s1	OZIBRDAYFOJMNO-OJLQRUNKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccc(F)cc3	BroadT	BRD-K31392657	BRD-K31392657-001-01-3	Broad Institute of MIT and Harvard	BRD-K31392657			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccc(F)cc1	InChI=1S/C26H32FN3O5/c1-16-13-30(25(32)19-6-8-20(27)9-7-19)17(2)15-35-23-11-10-21(28-18(3)31)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,31)/t16-,17-,24+/m1/s1	OZIBRDAYFOJMNO-OJLQRUNKSA-N	485.232599354							98950
BRD-K83121797	LSM-13509		54631532	InChI=1S/C20H30F3N3O7S2/c1-13-9-26(35(30,31)12-20(21,22)23)14(2)11-33-17-8-15(24-34(5,28)29)6-7-16(17)19(27)25(3)10-18(13)32-4/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14-,18-/m1/s1	VQJJHIQYBNZNQX-HBUWYVDXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)CC(F)(F)F	BroadT	BRD-K83121797	BRD-K83121797-001-01-4	Broad Institute of MIT and Harvard	BRD-K83121797			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)CC(F)(F)F	InChI=1S/C20H30F3N3O7S2/c1-13-9-26(35(30,31)12-20(21,22)23)14(2)11-33-17-8-15(24-34(5,28)29)6-7-16(17)19(27)25(3)10-18(13)32-4/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14-,18-/m1/s1	VQJJHIQYBNZNQX-HBUWYVDXSA-N	545.14772631							102150
BRD-K91721610	LSM-14062		54631571	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24+/m1/s1	MGTDWSJKTZULMI-KCYKTTMJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K91721610	BRD-K91721610-001-01-6	Broad Institute of MIT and Harvard	BRD-K91721610			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-21(29-26(34)28-20-8-6-7-19(27)11-20)9-10-22(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24+/m1/s1	MGTDWSJKTZULMI-KCYKTTMJSA-N	500.243498396							102715
BRD-K05581223	LSM-8757		54631451	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	FQDNKYOBJJPTQR-AXHZCLLHSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K05581223	BRD-K05581223-001-01-8	Broad Institute of MIT and Harvard	BRD-K05581223			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	FQDNKYOBJJPTQR-AXHZCLLHSA-N	484.268570292							97378
BRD-K84078621	LSM-13566		54631424	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24-/m1/s1	DDFXZAACYDZOLE-KHCICDEESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(CC3CCCCC3)C[C@H]1C	BroadT	BRD-K84078621	BRD-K84078621-001-01-7	Broad Institute of MIT and Harvard	BRD-K84078621			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C25H41N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h11-13,18-20,24,26H,6-10,14-17H2,1-5H3/t18-,19-,24-/m1/s1	DDFXZAACYDZOLE-KHCICDEESA-N	495.276692132							102208
BRD-K31846842	LSM-10362		54631520	InChI=1S/C30H37N5O7/c1-18-15-35(30(38)32-23-9-7-8-10-26(23)39-5)19(2)17-41-25-12-11-21(31-28(36)24-13-20(3)42-33-24)14-22(25)29(37)34(4)16-27(18)40-6/h7-14,18-19,27H,15-17H2,1-6H3,(H,31,36)(H,32,38)/t18-,19-,27-/m1/s1	HEGRZDISCWUYOS-DRGJWEBESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4ccccc4OC	BroadT	BRD-K31846842	BRD-K31846842-001-01-4	Broad Institute of MIT and Harvard	BRD-K31846842			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1ccccc1OC	InChI=1S/C30H37N5O7/c1-18-15-35(30(38)32-23-9-7-8-10-26(23)39-5)19(2)17-41-25-12-11-21(31-28(36)24-13-20(3)42-33-24)14-22(25)29(37)34(4)16-27(18)40-6/h7-14,18-19,27H,15-17H2,1-6H3,(H,31,36)(H,32,38)/t18-,19-,27-/m1/s1	HEGRZDISCWUYOS-DRGJWEBESA-N	579.269298574							98983
BRD-K92028820	LSM-14083		54631330	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18+,25-/m1/s1	UZJARJIYRQCXCT-FUMQJTLXSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K92028820	BRD-K92028820-001-01-1	Broad Institute of MIT and Harvard	BRD-K92028820			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18+,25-/m1/s1	UZJARJIYRQCXCT-FUMQJTLXSA-N	561.2144858							102737
BRD-K46980879	LSM-11292		54631575	InChI=1S/C29H35N3O6S/c1-20-17-30-21(2)19-37-27-16-22(10-15-26(27)29(33)32(3)18-28(20)36-4)31-39(34,35)25-13-11-24(12-14-25)38-23-8-6-5-7-9-23/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21-,28+/m0/s1	NZYQBFQVYSNMPI-YHGPEZAFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K46980879	BRD-K46980879-001-01-0	Broad Institute of MIT and Harvard	BRD-K46980879			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C29H35N3O6S/c1-20-17-30-21(2)19-37-27-16-22(10-15-26(27)29(33)32(3)18-28(20)36-4)31-39(34,35)25-13-11-24(12-14-25)38-23-8-6-5-7-9-23/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21-,28+/m0/s1	NZYQBFQVYSNMPI-YHGPEZAFSA-N	553.22465656							99913
BRD-K15695045	LSM-9369		54631477	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21+,28+/m1/s1	PDYFFKDIVHOONQ-GGJMMHKRSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(CC4CCOCC4)C[C@H]1C	BroadT	BRD-K15695045	BRD-K15695045-001-01-0	Broad Institute of MIT and Harvard	BRD-K15695045			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21+,28+/m1/s1	PDYFFKDIVHOONQ-GGJMMHKRSA-N	541.29519961							97990
BRD-K66755238	LSM-12495		54631578	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m0/s1	CFNBOAHXJHVCOD-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K66755238	BRD-K66755238-001-01-7	Broad Institute of MIT and Harvard	BRD-K66755238			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m0/s1	CFNBOAHXJHVCOD-QQMNAOGKSA-N	457.237684734							101126
BRD-K25198488	LSM-9961		54631576	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23+/m1/s1	OOHQDHOXZWVAAU-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K25198488	BRD-K25198488-001-01-7	Broad Institute of MIT and Harvard	BRD-K25198488			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23+/m1/s1	OOHQDHOXZWVAAU-DGGJZMOXSA-N	455.242021186							98582
BRD-K58472651	LSM-11955		54631353	InChI=1S/C27H38N4O5S/c1-18-14-31(16-25-28-9-12-37-25)19(2)17-36-23-13-21(29-26(32)20-7-10-35-11-8-20)5-6-22(23)27(33)30(3)15-24(18)34-4/h5-6,9,12-13,18-20,24H,7-8,10-11,14-17H2,1-4H3,(H,29,32)/t18-,19-,24+/m1/s1	FGARXSMYVPQAMN-IECBHUPTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K58472651	BRD-K58472651-001-01-7	Broad Institute of MIT and Harvard	BRD-K58472651			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C27H38N4O5S/c1-18-14-31(16-25-28-9-12-37-25)19(2)17-36-23-13-21(29-26(32)20-7-10-35-11-8-20)5-6-22(23)27(33)30(3)15-24(18)34-4/h5-6,9,12-13,18-20,24H,7-8,10-11,14-17H2,1-4H3,(H,29,32)/t18-,19-,24+/m1/s1	FGARXSMYVPQAMN-IECBHUPTSA-N	530.256291046							100581
BRD-K27811024	LSM-10106		54631284	InChI=1S/C29H36FN3O5/c1-18-15-33(27(34)13-20-5-6-20)19(2)17-38-25-14-23(31-28(35)21-7-9-22(30)10-8-21)11-12-24(25)29(36)32(3)16-26(18)37-4/h7-12,14,18-20,26H,5-6,13,15-17H2,1-4H3,(H,31,35)/t18-,19-,26+/m1/s1	QTFKJTMJQVNOKY-UDCNLSRBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC4CC4	BroadT	BRD-K27811024	BRD-K27811024-001-01-4	Broad Institute of MIT and Harvard	BRD-K27811024			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C29H36FN3O5/c1-18-15-33(27(34)13-20-5-6-20)19(2)17-38-25-14-23(31-28(35)21-7-9-22(30)10-8-21)11-12-24(25)29(36)32(3)16-26(18)37-4/h7-12,14,18-20,26H,5-6,13,15-17H2,1-4H3,(H,31,35)/t18-,19-,26+/m1/s1	QTFKJTMJQVNOKY-UDCNLSRBSA-N	525.263899482							98727
BRD-K91694818	LSM-14060		54631289	InChI=1S/C22H29N5O4/c1-14-10-25-15(2)13-31-19-9-16(26-21(28)18-11-23-7-8-24-18)5-6-17(19)22(29)27(3)12-20(14)30-4/h5-9,11,14-15,20,25H,10,12-13H2,1-4H3,(H,26,28)/t14-,15-,20+/m1/s1	ORFROPTWDCALKP-SXGZJXTBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K91694818	BRD-K91694818-001-01-5	Broad Institute of MIT and Harvard	BRD-K91694818			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C22H29N5O4/c1-14-10-25-15(2)13-31-19-9-16(26-21(28)18-11-23-7-8-24-18)5-6-17(19)22(29)27(3)12-20(14)30-4/h5-9,11,14-15,20,25H,10,12-13H2,1-4H3,(H,26,28)/t14-,15-,20+/m1/s1	ORFROPTWDCALKP-SXGZJXTBSA-N	427.221954458							102713
BRD-K16339566	LSM-9413		54631308	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16-,21+/m1/s1	BIFUFKYMXIZDEA-ZOCZFRKYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K16339566	BRD-K16339566-001-01-3	Broad Institute of MIT and Harvard	BRD-K16339566			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16-,21+/m1/s1	BIFUFKYMXIZDEA-ZOCZFRKYSA-N	433.25767125							98034
BRD-K75717096	LSM-13058		54631375	InChI=1S/C23H32N4O5/c1-6-27-12-15(2)21(30-5)13-26(4)23(29)18-8-7-17(11-20(18)31-14-16(27)3)25-22(28)19-9-10-24-32-19/h7-11,15-16,21H,6,12-14H2,1-5H3,(H,25,28)/t15-,16-,21-/m1/s1	WQVSSCVNJCJDQA-WHSLLNHNSA-N	CCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3oncc3)cc2OC[C@H]1C)OC	BroadT	BRD-K75717096	BRD-K75717096-001-01-7	Broad Institute of MIT and Harvard	BRD-K75717096			CCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccno3)cc2OC[C@H]1C)OC	InChI=1S/C23H32N4O5/c1-6-27-12-15(2)21(30-5)13-26(4)23(29)18-8-7-17(11-20(18)31-14-16(27)3)25-22(28)19-9-10-24-32-19/h7-11,15-16,21H,6,12-14H2,1-5H3,(H,25,28)/t15-,16-,21-/m1/s1	WQVSSCVNJCJDQA-WHSLLNHNSA-N	444.237270164							101695
BRD-K96745884	LSM-14372		54631538	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16+,20+/m1/s1	ILJGMXMVVDGLNM-GUXCAODWSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K96745884	BRD-K96745884-001-01-9	Broad Institute of MIT and Harvard	BRD-K96745884			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16+,20+/m1/s1	ILJGMXMVVDGLNM-GUXCAODWSA-N	433.25767125							103026
BRD-K44119437	LSM-11123		54631413	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18-,25+/m0/s1	RXVPCSLMNQSOJP-DPOKWSEZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K44119437	BRD-K44119437-001-01-2	Broad Institute of MIT and Harvard	BRD-K44119437			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18-,25+/m0/s1	RXVPCSLMNQSOJP-DPOKWSEZSA-N	565.239970438							99744
BRD-K81810761	LSM-13424		54631350	InChI=1S/C29H36FN3O5/c1-18-15-33(27(34)13-20-5-6-20)19(2)17-38-25-14-23(31-28(35)21-7-9-22(30)10-8-21)11-12-24(25)29(36)32(3)16-26(18)37-4/h7-12,14,18-20,26H,5-6,13,15-17H2,1-4H3,(H,31,35)/t18-,19-,26-/m1/s1	QTFKJTMJQVNOKY-LJKQEARRSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC4CC4	BroadT	BRD-K81810761	BRD-K81810761-001-01-6	Broad Institute of MIT and Harvard	BRD-K81810761			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C29H36FN3O5/c1-18-15-33(27(34)13-20-5-6-20)19(2)17-38-25-14-23(31-28(35)21-7-9-22(30)10-8-21)11-12-24(25)29(36)32(3)16-26(18)37-4/h7-12,14,18-20,26H,5-6,13,15-17H2,1-4H3,(H,31,35)/t18-,19-,26-/m1/s1	QTFKJTMJQVNOKY-LJKQEARRSA-N	525.263899482							102064
BRD-K01335229	LSM-8517		54631302	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	UHUINQXCHIPGNT-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3cncnc3)C[C@H]1C	BroadT	BRD-K01335229	BRD-K01335229-001-01-7	Broad Institute of MIT and Harvard	BRD-K01335229			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C24H33N5O4/c1-16-11-29(12-19-9-25-15-26-10-19)17(2)14-33-22-8-20(27-18(3)30)6-7-21(22)24(31)28(4)13-23(16)32-5/h6-10,15-17,23H,11-14H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	UHUINQXCHIPGNT-SAHWJRBASA-N	455.253254586							97138
BRD-K65127260	LSM-12404		54631480	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16+,21-/m1/s1	BIFUFKYMXIZDEA-VWKPWSFCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K65127260	BRD-K65127260-001-01-1	Broad Institute of MIT and Harvard	BRD-K65127260			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16+,21-/m1/s1	BIFUFKYMXIZDEA-VWKPWSFCSA-N	433.25767125							101031
BRD-K14958998	LSM-9326		54631574	InChI=1S/C27H38N4O5S/c1-18-14-31(16-25-28-9-12-37-25)19(2)17-36-23-13-21(29-26(32)20-7-10-35-11-8-20)5-6-22(23)27(33)30(3)15-24(18)34-4/h5-6,9,12-13,18-20,24H,7-8,10-11,14-17H2,1-4H3,(H,29,32)/t18-,19+,24+/m1/s1	FGARXSMYVPQAMN-IMWIBFENSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K14958998	BRD-K14958998-001-01-0	Broad Institute of MIT and Harvard	BRD-K14958998			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C27H38N4O5S/c1-18-14-31(16-25-28-9-12-37-25)19(2)17-36-23-13-21(29-26(32)20-7-10-35-11-8-20)5-6-22(23)27(33)30(3)15-24(18)34-4/h5-6,9,12-13,18-20,24H,7-8,10-11,14-17H2,1-4H3,(H,29,32)/t18-,19+,24+/m1/s1	FGARXSMYVPQAMN-IMWIBFENSA-N	530.256291046							97947
BRD-K28021369	LSM-10126		54631503	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19+,25-/m1/s1	IESMZGXEKVWDTA-HHJKRLRDSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K28021369	BRD-K28021369-001-01-2	Broad Institute of MIT and Harvard	BRD-K28021369			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19+,25-/m1/s1	IESMZGXEKVWDTA-HHJKRLRDSA-N	528.274798524							98747
BRD-K21627123	LSM-9742		54631345	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16-,20-/m1/s1	CQZVRHUHRGDROH-JXXFODFXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(Cc3nccs3)C[C@H]1C	BroadT	BRD-K21627123	BRD-K21627123-001-01-0	Broad Institute of MIT and Harvard	BRD-K21627123			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C23H31F3N4O5S2/c1-15-10-30(12-21-27-7-8-36-21)16(2)13-35-19-6-5-17(28-37(32,33)14-23(24,25)26)9-18(19)22(31)29(3)11-20(15)34-4/h5-9,15-16,20,28H,10-14H2,1-4H3/t15-,16-,20-/m1/s1	CQZVRHUHRGDROH-JXXFODFXSA-N	564.168796112							98363
CHEMBL3185534	LSM-10173	BRD-K28752165	54631347	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24+,31+/m1/s1	DHPIXDXHWYRYQT-OXYPMYLPSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K28752165	BRD-K28752165-001-01-8	Broad Institute of MIT and Harvard	BRD-K28752165			CCCNC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C33H43N5O4/c1-6-16-35-33(40)36-27-14-15-30-28(18-27)32(39)37(4)21-31(41-5)23(2)19-38(24(3)22-42-30)20-25-10-12-26(13-11-25)29-9-7-8-17-34-29/h7-15,17-18,23-24,31H,6,16,19-22H2,1-5H3,(H2,35,36,40)/t23-,24+,31+/m1/s1	DHPIXDXHWYRYQT-OXYPMYLPSA-N	573.331504906							98794
BRD-K40410846	LSM-10892		54631461	InChI=1S/C33H40N4O7/c1-21-17-37(18-23-10-6-7-11-25(23)32(39)40)22(2)20-44-29-16-24(14-15-26(29)31(38)36(3)19-30(21)43-5)34-33(41)35-27-12-8-9-13-28(27)42-4/h6-16,21-22,30H,17-20H2,1-5H3,(H,39,40)(H2,34,35,41)/t21-,22-,30-/m1/s1	HNLXCYPKRTVEFJ-NPKFRGRUSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3OC)cc2OC[C@@H](C)N(Cc4ccccc4C(=O)O)C[C@H]1C	BroadT	BRD-K40410846	BRD-K40410846-001-01-4	Broad Institute of MIT and Harvard	BRD-K40410846			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3OC)cc2OC[C@@H](C)N(Cc2ccccc2C(O)=O)C[C@H]1C	InChI=1S/C33H40N4O7/c1-21-17-37(18-23-10-6-7-11-25(23)32(39)40)22(2)20-44-29-16-24(14-15-26(29)31(38)36(3)19-30(21)43-5)34-33(41)35-27-12-8-9-13-28(27)42-4/h6-16,21-22,30H,17-20H2,1-5H3,(H,39,40)(H2,34,35,41)/t21-,22-,30-/m1/s1	HNLXCYPKRTVEFJ-NPKFRGRUSA-N	604.28969966							99513
BRD-K57375725	LSM-11902		54631483	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23-/m1/s1	OOHQDHOXZWVAAU-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K57375725	BRD-K57375725-001-01-5	Broad Institute of MIT and Harvard	BRD-K57375725			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-10-9-19(12-21(22)25(30)28(3)14-23(16)32-5)27-24(29)18-7-6-8-20(11-18)31-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23-/m1/s1	OOHQDHOXZWVAAU-SAHWJRBASA-N	455.242021186							100528
BRD-K28831272	LSM-10177		54631525	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21-,28-/m1/s1	PDYFFKDIVHOONQ-UMQWNRPGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(CC4CCOCC4)C[C@H]1C	BroadT	BRD-K28831272	BRD-K28831272-001-01-0	Broad Institute of MIT and Harvard	BRD-K28831272			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21-,28-/m1/s1	PDYFFKDIVHOONQ-UMQWNRPGSA-N	541.29519961							98798
BRD-K48662018	LSM-11393		54631467	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14+,20+/m1/s1	LINNEEFEDHMFDS-CKNLXJGOSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)onc3C)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K48662018	BRD-K48662018-001-01-4	Broad Institute of MIT and Harvard	BRD-K48662018			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)noc3C)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14+,20+/m1/s1	LINNEEFEDHMFDS-CKNLXJGOSA-N	480.204255474							100014
BRD-K19340473	LSM-9592		54631465	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24+,30+/m1/s1	ONZMGLOOFFOJCP-QEGDFHJFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K19340473	BRD-K19340473-001-01-0	Broad Institute of MIT and Harvard	BRD-K19340473			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24+,30+/m1/s1	ONZMGLOOFFOJCP-QEGDFHJFSA-N	550.351905992							98213
BRD-K57792211	LSM-11926		54631594	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18-,23-/m0/s1	QARSUPNDRVVANH-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K57792211	BRD-K57792211-001-01-2	Broad Institute of MIT and Harvard	BRD-K57792211			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18-,23-/m0/s1	QARSUPNDRVVANH-BSRJHKFKSA-N	519.251540024							100552
BRD-K27467349	LSM-10086		54631283	InChI=1S/C29H35N3O6S/c1-20-17-30-21(2)19-37-27-16-22(10-15-26(27)29(33)32(3)18-28(20)36-4)31-39(34,35)25-13-11-24(12-14-25)38-23-8-6-5-7-9-23/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28+/m1/s1	NZYQBFQVYSNMPI-GGJMMHKRSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K27467349	BRD-K27467349-001-01-3	Broad Institute of MIT and Harvard	BRD-K27467349			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C29H35N3O6S/c1-20-17-30-21(2)19-37-27-16-22(10-15-26(27)29(33)32(3)18-28(20)36-4)31-39(34,35)25-13-11-24(12-14-25)38-23-8-6-5-7-9-23/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28+/m1/s1	NZYQBFQVYSNMPI-GGJMMHKRSA-N	553.22465656							98707
BRD-K52812196	LSM-11650		54631556	InChI=1S/C25H31F3N4O4/c1-15-12-29-16(2)14-36-21-10-9-19(11-20(21)23(33)32(3)13-22(15)35-4)31-24(34)30-18-7-5-17(6-8-18)25(26,27)28/h5-11,15-16,22,29H,12-14H2,1-4H3,(H2,30,31,34)/t15-,16-,22-/m0/s1	GXRZKRPKTHFHBM-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(cc3)C(F)(F)F)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K52812196	BRD-K52812196-001-01-2	Broad Institute of MIT and Harvard	BRD-K52812196			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(cc3)C(F)(F)F)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H31F3N4O4/c1-15-12-29-16(2)14-36-21-10-9-19(11-20(21)23(33)32(3)13-22(15)35-4)31-24(34)30-18-7-5-17(6-8-18)25(26,27)28/h5-11,15-16,22,29H,12-14H2,1-4H3,(H2,30,31,34)/t15-,16-,22-/m0/s1	GXRZKRPKTHFHBM-WCJKSRRJSA-N	508.229740112							100275
BRD-K53987979	LSM-11713		54631312	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	CFNBOAHXJHVCOD-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K53987979	BRD-K53987979-001-01-4	Broad Institute of MIT and Harvard	BRD-K53987979			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-10-9-20(27-24(30)18-7-6-8-19(26)11-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	CFNBOAHXJHVCOD-QZMQVMSPSA-N	457.237684734							100338
BRD-K92975271	LSM-14131		54631445	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20-,26-/m0/s1	AMMFZKQUXZGGMQ-DYLHXGEVSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc5cncnc5)C[C@@H]1C	BroadT	BRD-K92975271	BRD-K92975271-001-01-7	Broad Institute of MIT and Harvard	BRD-K92975271			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20-,26-/m0/s1	AMMFZKQUXZGGMQ-DYLHXGEVSA-N	574.236224318							102785
BRD-K36144252	LSM-10609		54631509	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16+,21+/m1/s1	BIFUFKYMXIZDEA-XFQAVAEZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K36144252	BRD-K36144252-001-01-2	Broad Institute of MIT and Harvard	BRD-K36144252			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16+,21+/m1/s1	BIFUFKYMXIZDEA-XFQAVAEZSA-N	433.25767125							99230
BRD-K30228236	LSM-10255		54631416	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14-,20+/m1/s1	LINNEEFEDHMFDS-JZKQVHKSSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)onc3C)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K30228236	BRD-K30228236-001-01-0	Broad Institute of MIT and Harvard	BRD-K30228236			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3c(C)noc3C)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14-,20+/m1/s1	LINNEEFEDHMFDS-JZKQVHKSSA-N	480.204255474							98876
BRD-K35965314	LSM-10591		54631463	InChI=1S/C31H40N4O5/c1-6-10-30(36)32-24-13-14-26-28(15-24)39-20-22(3)35(17-21(2)29(38-5)19-34(4)31(26)37)18-25-16-27(40-33-25)23-11-8-7-9-12-23/h7-9,11-16,21-22,29H,6,10,17-20H2,1-5H3,(H,32,36)/t21-,22-,29-/m1/s1	PSLHRRXQPKXPKM-IEOSBIPESA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3cc(on3)c4ccccc4)[C@H](C)COc2c1	BroadT	BRD-K35965314	BRD-K35965314-001-01-7	Broad Institute of MIT and Harvard	BRD-K35965314			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cc(on3)-c3ccccc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C31H40N4O5/c1-6-10-30(36)32-24-13-14-26-28(15-24)39-20-22(3)35(17-21(2)29(38-5)19-34(4)31(26)37)18-25-16-27(40-33-25)23-11-8-7-9-12-23/h7-9,11-16,21-22,29H,6,10,17-20H2,1-5H3,(H,32,36)/t21-,22-,29-/m1/s1	PSLHRRXQPKXPKM-IEOSBIPESA-N	548.29987042							99212
BRD-K12012973	LSM-9152		54631343	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	FQDNKYOBJJPTQR-IECBHUPTSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K12012973	BRD-K12012973-001-01-7	Broad Institute of MIT and Harvard	BRD-K12012973			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	FQDNKYOBJJPTQR-IECBHUPTSA-N	484.268570292							97773
BRD-K85721574	LSM-13675		54631360	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	FQDNKYOBJJPTQR-YDIMBITNSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K85721574	BRD-K85721574-001-01-8	Broad Institute of MIT and Harvard	BRD-K85721574			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H36N4O5/c1-18-13-30(14-21-8-6-7-11-27-21)19(2)16-35-23-10-9-20(28-25(31)17-33-4)12-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	FQDNKYOBJJPTQR-YDIMBITNSA-N	484.268570292							102322
BRD-K59909245	LSM-12049		54631423	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20-,26+/m0/s1	AMMFZKQUXZGGMQ-CUVVAGTFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc5cncnc5)C[C@@H]1C	BroadT	BRD-K59909245	BRD-K59909245-001-01-0	Broad Institute of MIT and Harvard	BRD-K59909245			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C30H34N6O4S/c1-19-14-36(15-21-12-31-18-32-13-21)20(2)17-40-25-10-9-22(11-23(25)30(38)35(3)16-26(19)39-4)33-28(37)29-34-24-7-5-6-8-27(24)41-29/h5-13,18-20,26H,14-17H2,1-4H3,(H,33,37)/t19-,20-,26+/m0/s1	AMMFZKQUXZGGMQ-CUVVAGTFSA-N	574.236224318							100675
BRD-K24927839	LSM-9943		54631528	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18-,25-/m1/s1	UZJARJIYRQCXCT-QJMRKGMQSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K24927839	BRD-K24927839-001-01-6	Broad Institute of MIT and Harvard	BRD-K24927839			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H35N3O8S/c1-6-39(33,34)28-20-8-10-22-21(12-20)27(32)29(4)14-25(35-5)17(2)13-30(18(3)15-36-22)26(31)19-7-9-23-24(11-19)38-16-37-23/h7-12,17-18,25,28H,6,13-16H2,1-5H3/t17-,18-,25-/m1/s1	UZJARJIYRQCXCT-QJMRKGMQSA-N	561.2144858							98564
BRD-K95549765	LSM-14287		54631309	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)30-13-16(4)25(5)11-15(3)20(29-7)12-26(6)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20+/m1/s1	AADVJQLQUVDEBP-GUXCAODWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K95549765	BRD-K95549765-001-01-0	Broad Institute of MIT and Harvard	BRD-K95549765			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)30-13-16(4)25(5)11-15(3)20(29-7)12-26(6)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20+/m1/s1	AADVJQLQUVDEBP-GUXCAODWSA-N	420.273655672							102941
BRD-K19357327	LSM-9593		54631394	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16-,20+/m1/s1	ILJGMXMVVDGLNM-QINHECLXSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K19357327	BRD-K19357327-001-01-2	Broad Institute of MIT and Harvard	BRD-K19357327			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16-,20+/m1/s1	ILJGMXMVVDGLNM-QINHECLXSA-N	433.25767125							98214
BRD-K86522396	LSM-13726		54631458	InChI=1S/C32H43N3O6/c1-21-18-35(31(37)23-10-7-6-8-11-23)22(2)20-41-28-17-25(33-30(36)24-12-9-13-26(16-24)39-4)14-15-27(28)32(38)34(3)19-29(21)40-5/h9,12-17,21-23,29H,6-8,10-11,18-20H2,1-5H3,(H,33,36)/t21-,22-,29-/m1/s1	LYKGDNBLKAPSTE-IEOSBIPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CCCCC4	BroadT	BRD-K86522396	BRD-K86522396-001-01-5	Broad Institute of MIT and Harvard	BRD-K86522396			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCCCC1	InChI=1S/C32H43N3O6/c1-21-18-35(31(37)23-10-7-6-8-11-23)22(2)20-41-28-17-25(33-30(36)24-12-9-13-26(16-24)39-4)14-15-27(28)32(38)34(3)19-29(21)40-5/h9,12-17,21-23,29H,6-8,10-11,18-20H2,1-5H3,(H,33,36)/t21-,22-,29-/m1/s1	LYKGDNBLKAPSTE-IEOSBIPESA-N	565.315186126							102375
BRD-K63842915-001-01-6	LSM-18084	BRD-K63842915	54631479	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)33-22-9-7-8-21(31)12-22)18(2)16-42-25-13-23(32-29(39)34-27-19(3)35-43-20(27)4)10-11-24(25)28(38)36(5)15-26(17)41-6/h7-13,17-18,26H,14-16H2,1-6H3,(H,33,40)(H2,32,34,39)/t17-,18-,26-/m1/s1	CUIFKVZJUKDGLK-UYPAYLBCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4cccc(Cl)c4	BroadT	BRD-K63842915	BRD-K63842915-001-01-6	Broad Institute of MIT and Harvard	BRD-K63842915			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1cccc(Cl)c1	InChI=1S/C30H37ClN6O6/c1-17-14-37(30(40)33-22-9-7-8-21(31)12-22)18(2)16-42-25-13-23(32-29(39)34-27-19(3)35-43-20(27)4)10-11-24(25)28(38)36(5)15-26(17)41-6/h7-13,17-18,26H,14-16H2,1-6H3,(H,33,40)(H2,32,34,39)/t17-,18-,26-/m1/s1	CUIFKVZJUKDGLK-UYPAYLBCSA-N	612.246310674							106728
BRD-K86107831	LSM-13702		54631535	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	ZGJMWZDWXNCIBA-IEGUWTFLSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K86107831	BRD-K86107831-001-01-8	Broad Institute of MIT and Harvard	BRD-K86107831			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H35N5O4/c1-6-11-30-14-17(2)23(33-5)15-29(4)25(32)20-12-19(7-8-22(20)34-16-18(30)3)28-24(31)21-13-26-9-10-27-21/h7-10,12-13,17-18,23H,6,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	ZGJMWZDWXNCIBA-IEGUWTFLSA-N	469.26890465							102350
BRD-K17134074	LSM-9462		54631475	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	VSOIFNIWZGPCNV-WZOHSFFVSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K17134074	BRD-K17134074-001-01-2	Broad Institute of MIT and Harvard	BRD-K17134074			CCCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	VSOIFNIWZGPCNV-WZOHSFFVSA-N	473.325356886							98083
BRD-K59323544	LSM-12012		54631397	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19+,25+/m1/s1	IESMZGXEKVWDTA-WYEJZRMESA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K59323544	BRD-K59323544-001-01-2	Broad Institute of MIT and Harvard	BRD-K59323544			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19+,25+/m1/s1	IESMZGXEKVWDTA-WYEJZRMESA-N	528.274798524							100638
BRD-K45591070	LSM-11211		54631438	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m0/s1	JHQFRDYLQMIJCM-AXHZCLLHSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)Cc3cccnc3	BroadT	BRD-K45591070	BRD-K45591070-001-01-3	Broad Institute of MIT and Harvard	BRD-K45591070			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)Cc1cccnc1	InChI=1S/C27H36N4O6/c1-18-14-31(26(33)11-20-7-6-10-28-13-20)19(2)16-37-23-9-8-21(29-25(32)17-35-4)12-22(23)27(34)30(3)15-24(18)36-5/h6-10,12-13,18-19,24H,11,14-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m0/s1	JHQFRDYLQMIJCM-AXHZCLLHSA-N	512.263484912							99832
BRD-K09366813	LSM-8993		54631534	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19+,25-/m0/s1	IESMZGXEKVWDTA-CEYNDMKZSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K09366813	BRD-K09366813-001-01-6	Broad Institute of MIT and Harvard	BRD-K09366813			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19+,25-/m0/s1	IESMZGXEKVWDTA-CEYNDMKZSA-N	528.274798524							97614
BRD-K54456094	LSM-11735		54631431	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19-,25-/m1/s1	IESMZGXEKVWDTA-MPCDZSKCSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K54456094	BRD-K54456094-001-01-9	Broad Institute of MIT and Harvard	BRD-K54456094			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19-,25-/m1/s1	IESMZGXEKVWDTA-MPCDZSKCSA-N	528.274798524							100360
BRD-K19019278	LSM-9568		54631454	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19-,25+/m1/s1	IESMZGXEKVWDTA-RRQZXNHTSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K19019278	BRD-K19019278-001-01-7	Broad Institute of MIT and Harvard	BRD-K19019278			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H37FN4O5/c1-6-13-30-28(36)31-20-11-12-24-22(14-20)26(34)32(4)16-25(37-5)18(2)15-33(19(3)17-38-24)27(35)21-9-7-8-10-23(21)29/h7-12,14,18-19,25H,6,13,15-17H2,1-5H3,(H2,30,31,36)/t18-,19-,25+/m1/s1	IESMZGXEKVWDTA-RRQZXNHTSA-N	528.274798524							98189
BRD-K74711277	LSM-13007		54631593	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16+,20-/m1/s1	LVUSIZZVUUASSP-GQIGUUNPSA-N	CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H]1C)OC	BroadT	BRD-K74711277	BRD-K74711277-001-01-2	Broad Institute of MIT and Harvard	BRD-K74711277			CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H]1C)OC	InChI=1S/C23H35F3N4O6S/c1-6-9-27-22(32)30-11-15(2)20(35-5)12-29(4)21(31)18-8-7-17(10-19(18)36-13-16(30)3)28-37(33,34)14-23(24,25)26/h7-8,10,15-16,20,28H,6,9,11-14H2,1-5H3,(H,27,32)/t15-,16+,20-/m1/s1	LVUSIZZVUUASSP-GQIGUUNPSA-N	552.22294017							101644
BRD-K08570368	LSM-8946		54631540	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	VOCYCOKXIBOWBC-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K08570368	BRD-K08570368-001-01-3	Broad Institute of MIT and Harvard	BRD-K08570368			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	VOCYCOKXIBOWBC-DMPWYTOCSA-N	474.203383222							97567
BRD-K07250107	LSM-8854		54631315	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	VSOIFNIWZGPCNV-FHAGJXEFSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K07250107	BRD-K07250107-001-01-9	Broad Institute of MIT and Harvard	BRD-K07250107			CCCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O4/c1-6-9-26(31)28-22-12-13-24-23(14-22)27(32)29(4)17-25(33-5)19(2)15-30(20(3)18-34-24)16-21-10-7-8-11-21/h12-14,19-21,25H,6-11,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	VSOIFNIWZGPCNV-FHAGJXEFSA-N	473.325356886							97475
CHEMBL2357517	LSM-14079	SID131427718, BRD-K91969329	54631476	InChI=1S/C29H35N3O6S/c1-20-17-30-21(2)19-37-27-16-22(10-15-26(27)29(33)32(3)18-28(20)36-4)31-39(34,35)25-13-11-24(12-14-25)38-23-8-6-5-7-9-23/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28-/m1/s1	NZYQBFQVYSNMPI-PHVLTXCSSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K91969329	BRD-K91969329-001-01-3	Broad Institute of MIT and Harvard	BRD-K91969329			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C29H35N3O6S/c1-20-17-30-21(2)19-37-27-16-22(10-15-26(27)29(33)32(3)18-28(20)36-4)31-39(34,35)25-13-11-24(12-14-25)38-23-8-6-5-7-9-23/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28-/m1/s1	NZYQBFQVYSNMPI-PHVLTXCSSA-N	553.22465656							102733
BRD-K01006500	LSM-8499		54631377	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21-,26+/m1/s1	AEHXNEHGWHBDEN-YPCDYVTLSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K01006500	BRD-K01006500-001-01-4	Broad Institute of MIT and Harvard	BRD-K01006500			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C28H40N4O6S/c1-18(2)29-28(34)32-15-20(4)26(37-7)16-31(6)27(33)24-14-22(10-13-25(24)38-17-21(32)5)30-39(35,36)23-11-8-19(3)9-12-23/h8-14,18,20-21,26,30H,15-17H2,1-7H3,(H,29,34)/t20-,21-,26+/m1/s1	AEHXNEHGWHBDEN-YPCDYVTLSA-N	560.26685573							97120
BRD-K72241566	LSM-12855		54631536	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16+,20-/m1/s1	ILJGMXMVVDGLNM-GQIGUUNPSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K72241566	BRD-K72241566-001-01-2	Broad Institute of MIT and Harvard	BRD-K72241566			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16+,20-/m1/s1	ILJGMXMVVDGLNM-GQIGUUNPSA-N	433.25767125							101492
BRD-K71073890	LSM-12767		54631421	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-7-6-8-21(28)11-20)19(2)16-36-24-12-22(29-26(32)17-34-4)9-10-23(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m1/s1	KGYIFIZLZVXLPC-MPCDZSKCSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3cccc(F)c3)[C@H](C)COc2c1	BroadT	BRD-K71073890	BRD-K71073890-001-01-7	Broad Institute of MIT and Harvard	BRD-K71073890			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cccc(F)c3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-7-6-8-21(28)11-20)19(2)16-36-24-12-22(29-26(32)17-34-4)9-10-23(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m1/s1	KGYIFIZLZVXLPC-MPCDZSKCSA-N	501.263899482							101404
BRD-K69589246	LSM-12675		54631566	InChI=1S/C29H35N3O6S/c1-20-17-30-21(2)19-37-27-16-22(10-15-26(27)29(33)32(3)18-28(20)36-4)31-39(34,35)25-13-11-24(12-14-25)38-23-8-6-5-7-9-23/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28+/m0/s1	NZYQBFQVYSNMPI-BALWLHIASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K69589246	BRD-K69589246-001-01-7	Broad Institute of MIT and Harvard	BRD-K69589246			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C29H35N3O6S/c1-20-17-30-21(2)19-37-27-16-22(10-15-26(27)29(33)32(3)18-28(20)36-4)31-39(34,35)25-13-11-24(12-14-25)38-23-8-6-5-7-9-23/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28+/m0/s1	NZYQBFQVYSNMPI-BALWLHIASA-N	553.22465656							101309
BRD-K40063896	LSM-10872		54631399	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18+,25+/m0/s1	RXVPCSLMNQSOJP-YYULODDRSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K40063896	BRD-K40063896-001-01-0	Broad Institute of MIT and Harvard	BRD-K40063896			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18+,25+/m0/s1	RXVPCSLMNQSOJP-YYULODDRSA-N	565.239970438							99493
BRD-K44207800	LSM-11126		54631383	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21+,28-/m1/s1	PDYFFKDIVHOONQ-PHVLTXCSSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(CC4CCOCC4)C[C@H]1C	BroadT	BRD-K44207800	BRD-K44207800-001-01-4	Broad Institute of MIT and Harvard	BRD-K44207800			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-11-13-38-14-12-22)21(2)19-39-27-10-9-23(32-29(35)24-7-5-6-8-26(24)31)15-25(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-22,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21+,28-/m1/s1	PDYFFKDIVHOONQ-PHVLTXCSSA-N	541.29519961							99747
BRD-K87109962	LSM-13770		54631318	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16-,20-/m0/s1	ILJGMXMVVDGLNM-FTRWYGJKSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	BroadT	BRD-K87109962	BRD-K87109962-001-01-4	Broad Institute of MIT and Harvard	BRD-K87109962			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC	InChI=1S/C23H35N3O5/c1-7-21(27)24-17-9-10-19-18(11-17)23(29)25(5)13-20(30-6)15(3)12-26(22(28)8-2)16(4)14-31-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,24,27)/t15-,16-,20-/m0/s1	ILJGMXMVVDGLNM-FTRWYGJKSA-N	433.25767125							102419
BRD-K29996103	LSM-10245		54631439	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16+,21-/m0/s1	BIFUFKYMXIZDEA-MRUHUIDDSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K29996103	BRD-K29996103-001-01-5	Broad Institute of MIT and Harvard	BRD-K29996103			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H35N3O5/c1-15-12-24-16(2)14-31-20-11-18(25-22(27)17-7-9-30-10-8-17)5-6-19(20)23(28)26(3)13-21(15)29-4/h5-6,11,15-17,21,24H,7-10,12-14H2,1-4H3,(H,25,27)/t15-,16+,21-/m0/s1	BIFUFKYMXIZDEA-MRUHUIDDSA-N	433.25767125							98866
BRD-K39878860	LSM-10858		54631533	InChI=1S/C23H33N5O6S/c1-15-10-28(35(31,32)22-12-26(4)14-24-22)16(2)13-34-20-8-7-18(25-17(3)29)9-19(20)23(30)27(5)11-21(15)33-6/h7-9,12,14-16,21H,10-11,13H2,1-6H3,(H,25,29)/t15-,16+,21+/m1/s1	QWCMRWQEQWRTJY-XFQAVAEZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K39878860	BRD-K39878860-001-01-6	Broad Institute of MIT and Harvard	BRD-K39878860			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)c1cn(C)cn1	InChI=1S/C23H33N5O6S/c1-15-10-28(35(31,32)22-12-26(4)14-24-22)16(2)13-34-20-8-7-18(25-17(3)29)9-19(20)23(30)27(5)11-21(15)33-6/h7-9,12,14-16,21H,10-11,13H2,1-6H3,(H,25,29)/t15-,16+,21+/m1/s1	QWCMRWQEQWRTJY-XFQAVAEZSA-N	507.215154516							99479
BRD-K02576169	LSM-8598		54631440	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-6-11-24(35-4)12-7-21)20(2)18-37-26-13-10-23(30-28(33)22-8-9-22)14-25(26)29(34)31(3)17-27(19)36-5/h6-7,10-14,19-20,22,27H,8-9,15-18H2,1-5H3,(H,30,33)/t19-,20-,27+/m1/s1	SOKZPMDKQQIJSP-DVHCVUMVSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc4ccc(OC)cc4)C[C@H]1C	BroadT	BRD-K02576169	BRD-K02576169-001-01-7	Broad Institute of MIT and Harvard	BRD-K02576169			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc2ccc(OC)cc2)C[C@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-6-11-24(35-4)12-7-21)20(2)18-37-26-13-10-23(30-28(33)22-8-9-22)14-25(26)29(34)31(3)17-27(19)36-5/h6-7,10-14,19-20,22,27H,8-9,15-18H2,1-5H3,(H,30,33)/t19-,20-,27+/m1/s1	SOKZPMDKQQIJSP-DVHCVUMVSA-N	509.288971378							97219
BRD-K80866887	LSM-13377		54631400	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18-,23+/m1/s1	QARSUPNDRVVANH-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K80866887	BRD-K80866887-001-01-8	Broad Institute of MIT and Harvard	BRD-K80866887			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C25H37N5O5S/c1-17-11-30(12-19-6-7-19)18(2)15-35-22-9-8-20(27-36(32,33)24-14-28(3)16-26-24)10-21(22)25(31)29(4)13-23(17)34-5/h8-10,14,16-19,23,27H,6-7,11-13,15H2,1-5H3/t17-,18-,23+/m1/s1	QARSUPNDRVVANH-PNCHPQGNSA-N	519.251540024							102016
BRD-K00498462	LSM-8462		54631323	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17-,22-/m0/s1	NPOMWXYRXNIYSA-HOIFWPIMSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C3CCOCC3	BroadT	BRD-K00498462	BRD-K00498462-001-01-0	Broad Institute of MIT and Harvard	BRD-K00498462			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CCOCC1	InChI=1S/C24H37N3O7S/c1-16-13-27(23(28)18-8-10-33-11-9-18)17(2)15-34-21-7-6-19(25-35(5,30)31)12-20(21)24(29)26(3)14-22(16)32-4/h6-7,12,16-18,22,25H,8-11,13-15H2,1-5H3/t16-,17-,22-/m0/s1	NPOMWXYRXNIYSA-HOIFWPIMSA-N	511.235221244							97083
BRD-K89896024	LSM-13972		54631287	InChI=1S/C22H29N5O4/c1-14-10-25-15(2)13-31-19-9-16(26-21(28)18-11-23-7-8-24-18)5-6-17(19)22(29)27(3)12-20(14)30-4/h5-9,11,14-15,20,25H,10,12-13H2,1-4H3,(H,26,28)/t14-,15+,20-/m0/s1	ORFROPTWDCALKP-MDOVXXIYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K89896024	BRD-K89896024-001-01-0	Broad Institute of MIT and Harvard	BRD-K89896024			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C22H29N5O4/c1-14-10-25-15(2)13-31-19-9-16(26-21(28)18-11-23-7-8-24-18)5-6-17(19)22(29)27(3)12-20(14)30-4/h5-9,11,14-15,20,25H,10,12-13H2,1-4H3,(H,26,28)/t14-,15+,20-/m0/s1	ORFROPTWDCALKP-MDOVXXIYSA-N	427.221954458							102625
BRD-K52564648	LSM-11639		54631470	InChI=1S/C29H36FN3O5/c1-18-15-33(27(34)13-20-5-6-20)19(2)17-38-25-14-23(31-28(35)21-7-9-22(30)10-8-21)11-12-24(25)29(36)32(3)16-26(18)37-4/h7-12,14,18-20,26H,5-6,13,15-17H2,1-4H3,(H,31,35)/t18-,19-,26+/m0/s1	QTFKJTMJQVNOKY-LZJCXSABSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC4CC4	BroadT	BRD-K52564648	BRD-K52564648-001-01-3	Broad Institute of MIT and Harvard	BRD-K52564648			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C29H36FN3O5/c1-18-15-33(27(34)13-20-5-6-20)19(2)17-38-25-14-23(31-28(35)21-7-9-22(30)10-8-21)11-12-24(25)29(36)32(3)16-26(18)37-4/h7-12,14,18-20,26H,5-6,13,15-17H2,1-4H3,(H,31,35)/t18-,19-,26+/m0/s1	QTFKJTMJQVNOKY-LZJCXSABSA-N	525.263899482							100264
BRD-K53992608	LSM-18085		44490228	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20+,24+/m0/s1	JFWSYQFTTWMPPF-UECWXEIQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K53992608	BRD-K53992608-001-01-3	Broad Institute of MIT and Harvard	BRD-K53992608			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20+,24+/m0/s1	JFWSYQFTTWMPPF-UECWXEIQSA-N	545.307656074							106729
BRD-K52978625	LSM-18086		54614831	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22-,26+/m1/s1	UJYZNBPSVBHVBP-SRCYTUNASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K52978625	BRD-K52978625-001-01-2	Broad Institute of MIT and Harvard	BRD-K52978625			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22-,26+/m1/s1	UJYZNBPSVBHVBP-SRCYTUNASA-N	579.3090549							106730
BRD-K41185648	LSM-18087		44620604	InChI=1S/C28H48N4O5/c1-20-18-32(21(2)19-33)28(35)24-16-23(30-27(34)11-9-14-31(5)6)12-13-25(24)37-22(3)10-7-8-15-36-26(20)17-29-4/h12-13,16,20-22,26,29,33H,7-11,14-15,17-19H2,1-6H3,(H,30,34)/t20-,21+,22-,26+/m1/s1	SBFFLWUBRLNFSF-SRCYTUNASA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K41185648	BRD-K41185648-001-01-1	Broad Institute of MIT and Harvard	BRD-K41185648			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H48N4O5/c1-20-18-32(21(2)19-33)28(35)24-16-23(30-27(34)11-9-14-31(5)6)12-13-25(24)37-22(3)10-7-8-15-36-26(20)17-29-4/h12-13,16,20-22,26,29,33H,7-11,14-15,17-19H2,1-6H3,(H,30,34)/t20-,21+,22-,26+/m1/s1	SBFFLWUBRLNFSF-SRCYTUNASA-N	520.362470676							106731
BRD-K56563758	LSM-18088		44490272	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21+,22+,26-/m0/s1	ANVCKVJMNHXGBG-BOCITWAFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K56563758	BRD-K56563758-001-01-7	Broad Institute of MIT and Harvard	BRD-K56563758			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21+,22+,26-/m0/s1	ANVCKVJMNHXGBG-BOCITWAFSA-N	581.259327506							106732
BRD-K40170731	LSM-15034		44496436	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25-,30-/m0/s1	ZGCRSIABJPRXFC-SODQHWRNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K40170731	BRD-K40170731-001-01-2	Broad Institute of MIT and Harvard	BRD-K40170731			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25-,30-/m0/s1	ZGCRSIABJPRXFC-SODQHWRNSA-N	553.351571634							103690
BRD-K58795356	LSM-18089		44490246	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28+/m0/s1	LQSMEYMBJWSEPC-TUEWKVEFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K58795356	BRD-K58795356-001-01-9	Broad Institute of MIT and Harvard	BRD-K58795356			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28+/m0/s1	LQSMEYMBJWSEPC-TUEWKVEFSA-N	525.320271506							106733
BRD-K44403120	LSM-18090		44487543	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25-,30+/m1/s1	OPCOPDBCCFUTHV-ZXPXOXBPSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K44403120	BRD-K44403120-001-01-2	Broad Institute of MIT and Harvard	BRD-K44403120			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25-,30+/m1/s1	OPCOPDBCCFUTHV-ZXPXOXBPSA-N	525.356657014							106734
BRD-K45092891	LSM-18091		54614813	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21-,22-,26-/m1/s1	ZWQRBFIYGZIGKO-PIXQIBFHSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K45092891	BRD-K45092891-001-01-9	Broad Institute of MIT and Harvard	BRD-K45092891			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21-,22-,26-/m1/s1	ZWQRBFIYGZIGKO-PIXQIBFHSA-N	573.338956202							106735
BRD-K39561340	LSM-18092		44616318	InChI=1S/C32H48N4O5/c1-6-17-35(5)21-30-23(2)20-36(24(3)22-37)31(38)28-19-27(34-32(39)33-26-13-8-7-9-14-26)15-16-29(28)41-25(4)12-10-11-18-40-30/h7-9,13-16,19,23-25,30,37H,6,10-12,17-18,20-22H2,1-5H3,(H2,33,34,39)/t23-,24+,25+,30-/m0/s1	MWWGHCHVGSQFNB-RPQPUBLWSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K39561340	BRD-K39561340-001-01-8	Broad Institute of MIT and Harvard	BRD-K39561340			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H48N4O5/c1-6-17-35(5)21-30-23(2)20-36(24(3)22-37)31(38)28-19-27(34-32(39)33-26-13-8-7-9-14-26)15-16-29(28)41-25(4)12-10-11-18-40-30/h7-9,13-16,19,23-25,30,37H,6,10-12,17-18,20-22H2,1-5H3,(H2,33,34,39)/t23-,24+,25+,30-/m0/s1	MWWGHCHVGSQFNB-RPQPUBLWSA-N	568.362470676							106736
BRD-K44861255	LSM-18093		44489892	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28+/m1/s1	OWRRZEUGKXIWTQ-IZXSZHORSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K44861255	BRD-K44861255-001-01-8	Broad Institute of MIT and Harvard	BRD-K44861255			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28+/m1/s1	OWRRZEUGKXIWTQ-IZXSZHORSA-N	540.331170548							106737
BRD-K44759088-001-01-7	LSM-18094	BRD-K44759088	44619532	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21-,27-/m1/s1	QNMRQELCDYNENZ-NUFXCCFXSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K44759088	BRD-K44759088-001-01-7	Broad Institute of MIT and Harvard	BRD-K44759088			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21-,27-/m1/s1	QNMRQELCDYNENZ-NUFXCCFXSA-N	544.306098652							131246
MLS003128690	LSM-11578	BRD-K51530321, SID99358937	44502358	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22+,23+,30-/m0/s1	SIEZSLVXLUPDNY-NWWGNFDPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K51530321	BRD-K51530321-001-01-9	Broad Institute of MIT and Harvard	BRD-K51530321			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22+,23+,30-/m0/s1	SIEZSLVXLUPDNY-NWWGNFDPSA-N	598.336649852							100201
BRD-K43192836	LSM-18095		44494516	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30-/m0/s1	DXYWKCBATINIRK-INVAMZEASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K43192836	BRD-K43192836-001-01-7	Broad Institute of MIT and Harvard	BRD-K43192836			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30-/m0/s1	DXYWKCBATINIRK-INVAMZEASA-N	596.357385296							106740
BRD-K58138729	LSM-18096		54614839	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24+,29-/m1/s1	PRCUBQSECBZBSK-IDCDSMMUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K58138729	BRD-K58138729-001-01-2	Broad Institute of MIT and Harvard	BRD-K58138729			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24+,29-/m1/s1	PRCUBQSECBZBSK-IDCDSMMUSA-N	575.30290688							106741
BRD-K48739735	LSM-18097		44502906	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21+,22+,26+/m0/s1	KFCLPYACNRFGCM-AVJFOWIRSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K48739735	BRD-K48739735-001-01-2	Broad Institute of MIT and Harvard	BRD-K48739735			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21+,22+,26+/m0/s1	KFCLPYACNRFGCM-AVJFOWIRSA-N	477.356657014							106742
BRD-K51003626	LSM-18098		44495508	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27+/m0/s1	JMPHEZKYQLUQMM-JLFWUPFSSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K51003626	BRD-K51003626-001-01-9	Broad Institute of MIT and Harvard	BRD-K51003626			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27+/m0/s1	JMPHEZKYQLUQMM-JLFWUPFSSA-N	517.351571634							106743
BRD-K51228600	LSM-18099		54614829	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33+/m0/s1	FHYFYPZRCDKSKV-CLFOAKAGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K51228600	BRD-K51228600-001-01-2	Broad Institute of MIT and Harvard	BRD-K51228600			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33+/m0/s1	FHYFYPZRCDKSKV-CLFOAKAGSA-N	608.393770804							106744
BRD-K56354139	LSM-18100		44493109	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24-,29-/m0/s1	ZQLCRBSTGDSWQO-UITIVDIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K56354139	BRD-K56354139-001-01-1	Broad Institute of MIT and Harvard	BRD-K56354139			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24-,29-/m0/s1	ZQLCRBSTGDSWQO-UITIVDIESA-N	526.351905992							106745
BRD-K42034238	LSM-18101		44503621	InChI=1S/C31H46N4O5/c1-6-16-34(5)20-29-22(2)19-35(23(3)21-36)31(38)27-18-26(33-30(37)25-12-14-32-15-13-25)10-11-28(27)40-24(4)9-7-8-17-39-29/h10-15,18,22-24,29,36H,6-9,16-17,19-21H2,1-5H3,(H,33,37)/t22-,23+,24+,29+/m0/s1	UGZNIWWZAWAINA-CMSZEEODSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K42034238	BRD-K42034238-001-01-6	Broad Institute of MIT and Harvard	BRD-K42034238			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H46N4O5/c1-6-16-34(5)20-29-22(2)19-35(23(3)21-36)31(38)27-18-26(33-30(37)25-12-14-32-15-13-25)10-11-28(27)40-24(4)9-7-8-17-39-29/h10-15,18,22-24,29,36H,6-9,16-17,19-21H2,1-5H3,(H,33,37)/t22-,23+,24+,29+/m0/s1	UGZNIWWZAWAINA-CMSZEEODSA-N	554.346820612							106746
BRD-K58005972	LSM-18102		44502912	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24+,25+,31+/m0/s1	HLAXWBUNQRUQJP-DTTPJGKXSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	BroadT	BRD-K58005972	BRD-K58005972-001-01-7	Broad Institute of MIT and Harvard	BRD-K58005972			COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24+,25+,31+/m0/s1	HLAXWBUNQRUQJP-DTTPJGKXSA-N	555.367221698							106747
BRD-K55598155	LSM-18103		44487395	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23+,27+/m0/s1	LTGDTYHJVMKPBL-IILZIBOQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K55598155	BRD-K55598155-001-01-3	Broad Institute of MIT and Harvard	BRD-K55598155			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23+,27+/m0/s1	LTGDTYHJVMKPBL-IILZIBOQSA-N	534.37812074							106748
BRD-K51520673	LSM-18104		44620400	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22-,23+,29-/m0/s1	QSYAMXVABCSWEP-DGGNIJSCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K51520673	BRD-K51520673-001-01-4	Broad Institute of MIT and Harvard	BRD-K51520673			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22-,23+,29-/m0/s1	QSYAMXVABCSWEP-DGGNIJSCSA-N	622.33420518							106749
BRD-K40332193	LSM-18105		44619278	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18-,19+,25-/m1/s1	OIOMLIQJBPNRTR-UHYQSWOWSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K40332193	BRD-K40332193-001-01-9	Broad Institute of MIT and Harvard	BRD-K40332193			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18-,19+,25-/m1/s1	OIOMLIQJBPNRTR-UHYQSWOWSA-N	545.321334146							106750
BRD-K40864085-001-01-2	LSM-18106	BRD-K40864085	54614796	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27+/m0/s1	HLGABPGRBQKPOU-JLFWUPFSSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K40864085	BRD-K40864085-001-01-2	Broad Institute of MIT and Harvard	BRD-K40864085			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27+/m0/s1	HLGABPGRBQKPOU-JLFWUPFSSA-N	532.362470676							106751
BRD-K50563598	LSM-18107		44616732	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19-,23-/m1/s1	QBUCHBBMZJBUJI-ISJRUSPKSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K50563598	BRD-K50563598-001-01-7	Broad Institute of MIT and Harvard	BRD-K50563598			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19-,23-/m1/s1	QBUCHBBMZJBUJI-ISJRUSPKSA-N	531.29200601							106752
BRD-K42862653	LSM-18108		44619410	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24-,29-/m1/s1	CWMFJYTZROJEEY-RWJVBYDYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K42862653	BRD-K42862653-001-01-6	Broad Institute of MIT and Harvard	BRD-K42862653			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24-,29-/m1/s1	CWMFJYTZROJEEY-RWJVBYDYSA-N	622.33420518							106753
BRD-K45050268	LSM-18109		44619526	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22+,26-/m1/s1	UJYZNBPSVBHVBP-ZUVQJFRASA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K45050268	BRD-K45050268-001-01-2	Broad Institute of MIT and Harvard	BRD-K45050268			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22+,26-/m1/s1	UJYZNBPSVBHVBP-ZUVQJFRASA-N	579.3090549							106754
CHEMBL2354923	LSM-18110	BRD-K40472535, SID87542880	44619673	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26-,27-,32+/m0/s1	ZCLFEQBFHRMJFK-GZNUUUAQSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K40472535	BRD-K40472535-001-01-0	Broad Institute of MIT and Harvard	BRD-K40472535			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26-,27-,32+/m0/s1	ZCLFEQBFHRMJFK-GZNUUUAQSA-N	611.404669846							106755
BRD-K46065636	LSM-18111		44487527	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26+,33+/m1/s1	UBYZDEGPUXBRQE-FYZNHFMZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K46065636	BRD-K46065636-001-01-4	Broad Institute of MIT and Harvard	BRD-K46065636			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26+,33+/m1/s1	UBYZDEGPUXBRQE-FYZNHFMZSA-N	604.362470676							106756
BRD-K56214240	LSM-18112		44489320	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20+,24-/m0/s1	JFWSYQFTTWMPPF-KTIHBUSBSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K56214240	BRD-K56214240-001-01-3	Broad Institute of MIT and Harvard	BRD-K56214240			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20+,24-/m0/s1	JFWSYQFTTWMPPF-KTIHBUSBSA-N	545.307656074							106757
BRD-K58863944	LSM-18113		44496920	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22-,28+/m0/s1	GMYAYTAKTSTYEI-KJZXJLKKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	BroadT	BRD-K58863944	BRD-K58863944-001-01-4	Broad Institute of MIT and Harvard	BRD-K58863944			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22-,28+/m0/s1	GMYAYTAKTSTYEI-KJZXJLKKSA-N	608.318555116							106758
BRD-K46494135	LSM-18114		44496877	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19-,23-/m0/s1	QBUCHBBMZJBUJI-KGYLXKDPSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K46494135	BRD-K46494135-001-01-2	Broad Institute of MIT and Harvard	BRD-K46494135			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19-,23-/m0/s1	QBUCHBBMZJBUJI-KGYLXKDPSA-N	531.29200601							106759
BRD-K46666779	LSM-15075		44486993	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25+,26-,31-/m0/s1	SIHQACFNVCTPOW-XZSHTLEFSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K46666779	BRD-K46666779-001-01-6	Broad Institute of MIT and Harvard	BRD-K46666779			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25+,26-,31-/m0/s1	SIHQACFNVCTPOW-XZSHTLEFSA-N	582.37812074							103731
CHEMBL3182423	LSM-18115	BRD-K57643011	44496913	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25-,30-/m1/s1	OMPYFAIFRLVIFJ-SFOWLQBLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K57643011	BRD-K57643011-001-01-9	Broad Institute of MIT and Harvard	BRD-K57643011			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25-,30-/m1/s1	OMPYFAIFRLVIFJ-SFOWLQBLSA-N	621.338956202							106760
BRD-K58075863	LSM-18116		44489324	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29-/m0/s1	ZJHDPNYYPDHDNF-MVPDCNEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K58075863	BRD-K58075863-001-01-2	Broad Institute of MIT and Harvard	BRD-K58075863			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29-/m0/s1	ZJHDPNYYPDHDNF-MVPDCNEZSA-N	539.33592157							106761
BRD-K48549243	LSM-18117		44493616	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29-/m1/s1	KAHNNCGHTWSOBA-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K48549243	BRD-K48549243-001-01-0	Broad Institute of MIT and Harvard	BRD-K48549243			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29-/m1/s1	KAHNNCGHTWSOBA-CDLOMYRSSA-N	554.346820612							106762
BRD-K54107674	LSM-18118		44488195	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29-/m1/s1	ZJHDPNYYPDHDNF-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K54107674	BRD-K54107674-001-01-6	Broad Institute of MIT and Harvard	BRD-K54107674			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29-/m1/s1	ZJHDPNYYPDHDNF-CDLOMYRSSA-N	539.33592157							106763
BRD-K44921612	LSM-18119		44493599	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25+,30-/m1/s1	OMPYFAIFRLVIFJ-UBRKHCEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K44921612	BRD-K44921612-001-01-8	Broad Institute of MIT and Harvard	BRD-K44921612			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25+,30-/m1/s1	OMPYFAIFRLVIFJ-UBRKHCEVSA-N	621.338956202							106764
BRD-K47582411	LSM-18120		44483950	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20-,24-/m0/s1	JFWSYQFTTWMPPF-VKDGWMQASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K47582411	BRD-K47582411-001-01-8	Broad Institute of MIT and Harvard	BRD-K47582411			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20-,24-/m0/s1	JFWSYQFTTWMPPF-VKDGWMQASA-N	545.307656074							106765
BRD-K50497551	LSM-18121		44494533	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28+/m0/s1	SCSZUZCJLHTTSJ-WYNJNVBPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K50497551	BRD-K50497551-001-01-3	Broad Institute of MIT and Harvard	BRD-K50497551			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28+/m0/s1	SCSZUZCJLHTTSJ-WYNJNVBPSA-N	589.282171436							106766
BRD-K49872883	LSM-18122		44487513	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24+,29+/m1/s1	SEDRIVHSDUVLLE-MSCBGTKOSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K49872883	BRD-K49872883-001-01-0	Broad Institute of MIT and Harvard	BRD-K49872883			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24+,29+/m1/s1	SEDRIVHSDUVLLE-MSCBGTKOSA-N	597.352634274							106767
BRD-K47254434	LSM-18123		44483943	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21+,22-,26-/m0/s1	ANVCKVJMNHXGBG-MSZDEVHKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K47254434	BRD-K47254434-001-01-7	Broad Institute of MIT and Harvard	BRD-K47254434			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21+,22-,26-/m0/s1	ANVCKVJMNHXGBG-MSZDEVHKSA-N	581.259327506							106768
BRD-K58137366	LSM-18124		44490894	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20-,24+/m0/s1	JFWSYQFTTWMPPF-AZXNSQLWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K58137366	BRD-K58137366-001-01-2	Broad Institute of MIT and Harvard	BRD-K58137366			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20-,24+/m0/s1	JFWSYQFTTWMPPF-AZXNSQLWSA-N	545.307656074							106769
BRD-K54089081	LSM-18125		44617728	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24-,25-,30-/m0/s1	HYZLHQOJAWWHRH-XZSZPMDUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K54089081	BRD-K54089081-001-01-3	Broad Institute of MIT and Harvard	BRD-K54089081			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24-,25-,30-/m0/s1	HYZLHQOJAWWHRH-XZSZPMDUSA-N	589.318556944							106770
BRD-K54506283	LSM-18126		44620557	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18+,22-/m1/s1	GOTBAIXNEHVFNA-QSNWEANLSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K54506283	BRD-K54506283-001-01-2	Broad Institute of MIT and Harvard	BRD-K54506283			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18+,22-/m1/s1	GOTBAIXNEHVFNA-QSNWEANLSA-N	485.255956688							106771
BRD-K56285711	LSM-18127		44620771	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24-,25-,29-/m0/s1	NSUWFWDPIIGHAU-MGQBIDJDSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K56285711	BRD-K56285711-001-01-3	Broad Institute of MIT and Harvard	BRD-K56285711			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24-,25-,29-/m0/s1	NSUWFWDPIIGHAU-MGQBIDJDSA-N	562.409420868							106772
BRD-K55581069	LSM-18128		44494596	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24+/m1/s1	PQNWFIFCFFWMJI-FIXDAVPBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K55581069	BRD-K55581069-001-01-4	Broad Institute of MIT and Harvard	BRD-K55581069			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24+/m1/s1	PQNWFIFCFFWMJI-FIXDAVPBSA-N	449.325356886							106773
BRD-K39306587-001-01-0	LSM-18129	BRD-K39306587	54614792	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27+/m0/s1	AOLQWFIMADKXQA-JLFWUPFSSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K39306587	BRD-K39306587-001-01-0	Broad Institute of MIT and Harvard	BRD-K39306587			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27+/m0/s1	AOLQWFIMADKXQA-JLFWUPFSSA-N	511.304621442							106774
BRD-K56778317	LSM-18130		54614835	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22-,27+/m0/s1	HLGABPGRBQKPOU-GHIUXRNCSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K56778317	BRD-K56778317-001-01-5	Broad Institute of MIT and Harvard	BRD-K56778317			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22-,27+/m0/s1	HLGABPGRBQKPOU-GHIUXRNCSA-N	532.362470676							106775
BRD-K45986774	LSM-18131		44485111	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28+/m0/s1	OWRRZEUGKXIWTQ-KKQCDPINSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K45986774	BRD-K45986774-001-01-4	Broad Institute of MIT and Harvard	BRD-K45986774			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28+/m0/s1	OWRRZEUGKXIWTQ-KKQCDPINSA-N	540.331170548							106776
BRD-K45056520	LSM-18132		44502467	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20+,24+/m0/s1	ORDOAKKGIRZCMJ-UECWXEIQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K45056520	BRD-K45056520-001-01-3	Broad Institute of MIT and Harvard	BRD-K45056520			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20+,24+/m0/s1	ORDOAKKGIRZCMJ-UECWXEIQSA-N	513.287256816							106777
BRD-K47445962	LSM-18133		44489310	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21-,22+,28-/m0/s1	DYIGNVBEUCFAEB-WENLUUPESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K47445962	BRD-K47445962-001-01-1	Broad Institute of MIT and Harvard	BRD-K47445962			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21-,22+,28-/m0/s1	DYIGNVBEUCFAEB-WENLUUPESA-N	558.321748716							106778
BRD-K56520530	LSM-18134		44489887	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19-,23+/m1/s1	HNAHSZOZZNPVNF-ZQAYVECASA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K56520530	BRD-K56520530-001-01-2	Broad Institute of MIT and Harvard	BRD-K56520530			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19-,23+/m1/s1	HNAHSZOZZNPVNF-ZQAYVECASA-N	499.271606752							106779
BRD-K40956802-001-01-8	LSM-6806	BRD6802, SD-6-035-A8	44497649	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24+,31+/m0/s1	WIYHORLWMFSPCL-GPYNCYNASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K40956802	BRD-K40956802-001-01-8	Broad Institute of MIT and Harvard	BRD-K40956802			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24+,31+/m0/s1	WIYHORLWMFSPCL-GPYNCYNASA-N	569.346486254							95427
BRD-K43025624	LSM-18135		54614806	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23-,28-/m0/s1	DKJIIKWCTXJSNY-AMZZYFJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K43025624	BRD-K43025624-001-01-5	Broad Institute of MIT and Harvard	BRD-K43025624			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23-,28-/m0/s1	DKJIIKWCTXJSNY-AMZZYFJHSA-N	561.287256816							106780
BRD-K52630978	LSM-18136		44617634	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21+,22-,26-/m0/s1	ZWQRBFIYGZIGKO-MSZDEVHKSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K52630978	BRD-K52630978-001-01-2	Broad Institute of MIT and Harvard	BRD-K52630978			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21+,22-,26-/m0/s1	ZWQRBFIYGZIGKO-MSZDEVHKSA-N	573.338956202							106781
BRD-K39965317	LSM-18137		44489877	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25+,30+/m1/s1	OPCOPDBCCFUTHV-ZRIOWSNCSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K39965317	BRD-K39965317-001-01-0	Broad Institute of MIT and Harvard	BRD-K39965317			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25+,30+/m1/s1	OPCOPDBCCFUTHV-ZRIOWSNCSA-N	525.356657014							106782
BRD-K47620421	LSM-18138		44620100	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25-,26-,32+/m1/s1	JCVAFPCEYZSYDX-ZYMMPZCLSA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K47620421	BRD-K47620421-001-01-4	Broad Institute of MIT and Harvard	BRD-K47620421			COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25-,26-,32+/m1/s1	JCVAFPCEYZSYDX-ZYMMPZCLSA-N	612.388685424							106783
MLS003128725	LSM-18139	BRD-K45342423	44503686	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33-/m0/s1	LFCBJIZGBQWHQM-QTLXSIBASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K45342423	BRD-K45342423-001-01-5	Broad Institute of MIT and Harvard	BRD-K45342423			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33-/m0/s1	LFCBJIZGBQWHQM-QTLXSIBASA-N	602.346820612							106784
BRD-K50710005	LSM-18140		44503690	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23+,28-/m0/s1	DKJIIKWCTXJSNY-FPZRTEDSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K50710005	BRD-K50710005-001-01-1	Broad Institute of MIT and Harvard	BRD-K50710005			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23+,28-/m0/s1	DKJIIKWCTXJSNY-FPZRTEDSSA-N	561.287256816							106785
BRD-K39438085	LSM-18141		44492624	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25+,30-/m0/s1	OMPYFAIFRLVIFJ-INVAMZEASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K39438085	BRD-K39438085-001-01-8	Broad Institute of MIT and Harvard	BRD-K39438085			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25+,30-/m0/s1	OMPYFAIFRLVIFJ-INVAMZEASA-N	621.338956202							106786
BRD-K43390080	LSM-18142		44486420	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23+,28-/m1/s1	OWRRZEUGKXIWTQ-SQVYLTPJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K43390080	BRD-K43390080-001-01-0	Broad Institute of MIT and Harvard	BRD-K43390080			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23+,28-/m1/s1	OWRRZEUGKXIWTQ-SQVYLTPJSA-N	540.331170548							106787
BRD-K57200229-001-01-6	LSM-6809	BRD0229, SD-6-035-B3	44497312	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24-,31-/m1/s1	WIYHORLWMFSPCL-FFBJJBDJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K57200229	BRD-K57200229-001-01-6	Broad Institute of MIT and Harvard	BRD-K57200229			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24-,31-/m1/s1	WIYHORLWMFSPCL-FFBJJBDJSA-N	569.346486254							95430
BRD-K46703028	LSM-18143		44616455	InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24-,25-,30-/m0/s1	DPWBPPWCHVQSHF-XZSZPMDUSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K46703028	BRD-K46703028-001-01-6	Broad Institute of MIT and Harvard	BRD-K46703028			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24-,25-,30-/m0/s1	DPWBPPWCHVQSHF-XZSZPMDUSA-N	553.351571634							106788
BRD-K42392619	LSM-18144		44618002	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23+,27-/m1/s1	XJLXIOLTLBOFKC-GRSOWLQASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K42392619	BRD-K42392619-001-01-7	Broad Institute of MIT and Harvard	BRD-K42392619			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23+,27-/m1/s1	XJLXIOLTLBOFKC-GRSOWLQASA-N	598.34002067							106789
BRD-K51185182	LSM-18145		44618128	InChI=1S/C33H49N3O5/c1-6-17-35(5)22-31-24(2)21-36(25(3)23-37)33(39)29-20-28(34-32(38)19-27-13-8-7-9-14-27)15-16-30(29)41-26(4)12-10-11-18-40-31/h7-9,13-16,20,24-26,31,37H,6,10-12,17-19,21-23H2,1-5H3,(H,34,38)/t24-,25+,26-,31-/m0/s1	HWWNGGYYBIBPCQ-XZSHTLEFSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K51185182	BRD-K51185182-001-01-0	Broad Institute of MIT and Harvard	BRD-K51185182			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H49N3O5/c1-6-17-35(5)22-31-24(2)21-36(25(3)23-37)33(39)29-20-28(34-32(38)19-27-13-8-7-9-14-27)15-16-30(29)41-26(4)12-10-11-18-40-31/h7-9,13-16,20,24-26,31,37H,6,10-12,17-19,21-23H2,1-5H3,(H,34,38)/t24-,25+,26-,31-/m0/s1	HWWNGGYYBIBPCQ-XZSHTLEFSA-N	567.367221698							106790
BRD-K45799338	LSM-18146		44617774	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24-,30-/m1/s1	XIVCQDXGZVVHDO-NULUGNBJSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K45799338	BRD-K45799338-001-01-0	Broad Institute of MIT and Harvard	BRD-K45799338			COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(NS(C)(=O)=O)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24-,30-/m1/s1	XIVCQDXGZVVHDO-NULUGNBJSA-N	605.313471564							106791
BRD-K45361857	LSM-18147		54614814	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24+,29-/m1/s1	CWMFJYTZROJEEY-CAFXQFFASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K45361857	BRD-K45361857-001-01-0	Broad Institute of MIT and Harvard	BRD-K45361857			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24+,29-/m1/s1	CWMFJYTZROJEEY-CAFXQFFASA-N	622.33420518							106792
BRD-K44743425	LSM-18148		44618422	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27+/m0/s1	WPSSTONNMATWEF-MSZUUUALSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K44743425	BRD-K44743425-001-01-3	Broad Institute of MIT and Harvard	BRD-K44743425			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27+/m0/s1	WPSSTONNMATWEF-MSZUUUALSA-N	581.23263443							106793
BRD-K45013226	LSM-18149		54614812	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28-/m1/s1	KDWFAOIYLGHTDK-SOLZYKTISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	BroadT	BRD-K45013226	BRD-K45013226-001-01-1	Broad Institute of MIT and Harvard	BRD-K45013226			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28-/m1/s1	KDWFAOIYLGHTDK-SOLZYKTISA-N	579.277834984							106794
BRD-K51898276	LSM-18150		44620599	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30+/m1/s1	KOPUKDVKYXJRIR-ZXPXOXBPSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K51898276	BRD-K51898276-001-01-5	Broad Institute of MIT and Harvard	BRD-K51898276			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30+/m1/s1	KOPUKDVKYXJRIR-ZXPXOXBPSA-N	602.404335488							106795
BRD-K46890865	LSM-18151		44492599	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24-/m0/s1	PQNWFIFCFFWMJI-XHOYROJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K46890865	BRD-K46890865-001-01-7	Broad Institute of MIT and Harvard	BRD-K46890865			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24-/m0/s1	PQNWFIFCFFWMJI-XHOYROJHSA-N	449.325356886							106796
BRD-K49530286	LSM-18152		54614823	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22+,23-,29-/m1/s1	PSEUFYCSFOBFBF-CPVANYHMSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K49530286	BRD-K49530286-001-01-7	Broad Institute of MIT and Harvard	BRD-K49530286			COc1ccc(NC(=O)Nc2ccc3O[C@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22+,23-,29-/m1/s1	PSEUFYCSFOBFBF-CPVANYHMSA-N	570.341735232							106797
BRD-K54081441	LSM-18153		44620446	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24-,30-/m1/s1	JGZXBABAHUXSMS-NULUGNBJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K54081441	BRD-K54081441-001-01-5	Broad Institute of MIT and Harvard	BRD-K54081441			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24-,30-/m1/s1	JGZXBABAHUXSMS-NULUGNBJSA-N	569.346486254							106798
BRD-K44648112	LSM-18154		44496895	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30-/m0/s1	KOPUKDVKYXJRIR-INVAMZEASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K44648112	BRD-K44648112-001-01-2	Broad Institute of MIT and Harvard	BRD-K44648112			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30-/m0/s1	KOPUKDVKYXJRIR-INVAMZEASA-N	602.404335488							106799
BRD-K58784778	LSM-6794		44498255	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23-,24-,29+/m1/s1	MOSVBDAIGOGSPE-XTGAJNFRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K58784778	BRD-K58784778-001-01-3	Broad Institute of MIT and Harvard	BRD-K58784778			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23-,24-,29+/m1/s1	MOSVBDAIGOGSPE-XTGAJNFRSA-N	581.349857072							95415
BRD-K40863542-001-01-1	LSM-18155	BRD-K40863542	44617506	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22-,27-/m0/s1	HLGABPGRBQKPOU-LFYAFONDSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K40863542	BRD-K40863542-001-01-1	Broad Institute of MIT and Harvard	BRD-K40863542			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22-,27-/m0/s1	HLGABPGRBQKPOU-LFYAFONDSA-N	532.362470676							106800
BRD-K49384706	LSM-18156		49843045	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29+/m1/s1	IMDGVULVCKQBDZ-MSCBGTKOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K49384706	BRD-K49384706-001-01-1	Broad Institute of MIT and Harvard	BRD-K49384706			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29+/m1/s1	IMDGVULVCKQBDZ-MSCBGTKOSA-N	539.33592157							106801
BRD-K45077605	LSM-18157		44490943	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21+,22-,27+/m1/s1	JLURSCHFCUHCJF-RYBWSMFQSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K45077605	BRD-K45077605-001-01-7	Broad Institute of MIT and Harvard	BRD-K45077605			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21+,22-,27+/m1/s1	JLURSCHFCUHCJF-RYBWSMFQSA-N	547.271606752							106802
MLS003128881	LSM-18158	BRD-K55728478, SID99359320	46903886	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25+,26-,32-/m1/s1	IJPCFLZWEMVLEC-VUKRRIEASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C1=O	BroadT	BRD-K55728478	BRD-K55728478-001-01-6	Broad Institute of MIT and Harvard	BRD-K55728478			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25+,26-,32-/m1/s1	IJPCFLZWEMVLEC-VUKRRIEASA-N	615.334207008							106803
BRD-K53874318	LSM-18159		44485142	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24+,25-,32+/m0/s1	HBVPERRGRWZCML-JUVNKOCGSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	BroadT	BRD-K53874318	BRD-K53874318-001-01-4	Broad Institute of MIT and Harvard	BRD-K53874318			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24+,25-,32+/m0/s1	HBVPERRGRWZCML-JUVNKOCGSA-N	590.346820612							106804
BRD-K51974360	LSM-18160		54614830	InChI=1S/C33H47FN4O5/c1-22-18-38(23(2)21-39)32(40)29-17-28(36-33(41)35-27-12-10-26(34)11-13-27)14-15-30(29)43-24(3)7-5-6-16-42-31(22)20-37(4)19-25-8-9-25/h10-15,17,22-25,31,39H,5-9,16,18-21H2,1-4H3,(H2,35,36,41)/t22-,23-,24-,31+/m1/s1	STYUMYTXFXXJJW-QJWQVSSASA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc3C1=O	BroadT	BRD-K51974360	BRD-K51974360-001-01-1	Broad Institute of MIT and Harvard	BRD-K51974360			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C33H47FN4O5/c1-22-18-38(23(2)21-39)32(40)29-17-28(36-33(41)35-27-12-10-26(34)11-13-27)14-15-30(29)43-24(3)7-5-6-16-42-31(22)20-37(4)19-25-8-9-25/h10-15,17,22-25,31,39H,5-9,16,18-21H2,1-4H3,(H2,35,36,41)/t22-,23-,24-,31+/m1/s1	STYUMYTXFXXJJW-QJWQVSSASA-N	598.353048844							106805
BRD-K44506257	LSM-18161		54614811	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21+,22-,26-/m0/s1	KFCLPYACNRFGCM-MSZDEVHKSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K44506257	BRD-K44506257-001-01-7	Broad Institute of MIT and Harvard	BRD-K44506257			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21+,22-,26-/m0/s1	KFCLPYACNRFGCM-MSZDEVHKSA-N	477.356657014							106806
BRD-K48035513	LSM-18162		44620821	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29+/m0/s1	LZRQCLPDICKWHD-UJUOIFIWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K48035513	BRD-K48035513-001-01-3	Broad Institute of MIT and Harvard	BRD-K48035513			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29+/m0/s1	LZRQCLPDICKWHD-UJUOIFIWSA-N	609.263934558							106807
MLS003128885	LSM-18163	BRD-K46014293, SID99359323	44504325	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,29-/m0/s1	MEJMTXOOFVGIJM-KUFVDZEESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K46014293	BRD-K46014293-001-01-6	Broad Institute of MIT and Harvard	BRD-K46014293			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,29-/m0/s1	MEJMTXOOFVGIJM-KUFVDZEESA-N	593.293485048							106808
BRD-K49552510	LSM-18164		44616625	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22+,23-,30+/m0/s1	KQLDLPDWVHVVHP-XOCMKLHTSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K49552510	BRD-K49552510-001-01-9	Broad Institute of MIT and Harvard	BRD-K49552510			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22+,23-,30+/m0/s1	KQLDLPDWVHVVHP-XOCMKLHTSA-N	619.29273612							106809
BRD-K49630774	LSM-18165		44618723	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28+/m1/s1	XEPWKRSQLBTXFU-IZXSZHORSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K49630774	BRD-K49630774-001-01-4	Broad Institute of MIT and Harvard	BRD-K49630774			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28+/m1/s1	XEPWKRSQLBTXFU-IZXSZHORSA-N	595.329121628							106810
BRD-K56525823	LSM-18166		44485097	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25-,26-,31-/m1/s1	SIHQACFNVCTPOW-YSRRZRNESA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K56525823	BRD-K56525823-001-01-7	Broad Institute of MIT and Harvard	BRD-K56525823			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25-,26-,31-/m1/s1	SIHQACFNVCTPOW-YSRRZRNESA-N	582.37812074							106811
BRD-K51641263	LSM-18167		44491484	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22-,26-/m1/s1	ANVCKVJMNHXGBG-PIXQIBFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K51641263	BRD-K51641263-001-01-4	Broad Institute of MIT and Harvard	BRD-K51641263			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22-,26-/m1/s1	ANVCKVJMNHXGBG-PIXQIBFHSA-N	581.259327506							106812
CHEMBL3186940	LSM-15140	BRD-K47533800	44495043	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22-,28+/m1/s1	GMYAYTAKTSTYEI-LLTQPOKBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	BroadT	BRD-K47533800	BRD-K47533800-001-01-0	Broad Institute of MIT and Harvard	BRD-K47533800			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22-,28+/m1/s1	GMYAYTAKTSTYEI-LLTQPOKBSA-N	608.318555116							103796
BRD-K43086600	LSM-18168		44620713	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22+,23-,28+/m0/s1	NMRMJZSCUHLPQY-WYNJNVBPSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)CC3CC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K43086600	BRD-K43086600-001-01-5	Broad Institute of MIT and Harvard	BRD-K43086600			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)CC3CC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22+,23-,28+/m0/s1	NMRMJZSCUHLPQY-WYNJNVBPSA-N	546.37812074							106813
BRD-K54752947	LSM-18169		44496870	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18-,19-,25-/m0/s1	OIOMLIQJBPNRTR-NUDCOPPTSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K54752947	BRD-K54752947-001-01-0	Broad Institute of MIT and Harvard	BRD-K54752947			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18-,19-,25-/m0/s1	OIOMLIQJBPNRTR-NUDCOPPTSA-N	545.321334146							106814
BRD-K41656340	LSM-18170		44502904	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24+,29+/m0/s1	YZLWJGCKUGDXHR-CMSZEEODSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K41656340	BRD-K41656340-001-01-2	Broad Institute of MIT and Harvard	BRD-K41656340			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24+,29+/m0/s1	YZLWJGCKUGDXHR-CMSZEEODSA-N	560.393770804							106815
BRD-K57242481	LSM-18171		44617640	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27+,28-,34-/m0/s1	NYAGJJIVOVZRJD-JPWDMULGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K57242481	BRD-K57242481-001-01-1	Broad Institute of MIT and Harvard	BRD-K57242481			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27+,28-,34-/m0/s1	NYAGJJIVOVZRJD-JPWDMULGSA-N	616.362470676							106816
BRD-K47748211	LSM-18172		44501141	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27-/m0/s1	OPIQAKQROYPQNZ-XTYKIWRDSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K47748211	BRD-K47748211-001-01-7	Broad Institute of MIT and Harvard	BRD-K47748211			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27-/m0/s1	OPIQAKQROYPQNZ-XTYKIWRDSA-N	565.26218492							106817
BRD-K52500055	LSM-18173		44483979	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23+,28+/m1/s1	OWRRZEUGKXIWTQ-DHMIZTNRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K52500055	BRD-K52500055-001-01-3	Broad Institute of MIT and Harvard	BRD-K52500055			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23+,28+/m1/s1	OWRRZEUGKXIWTQ-DHMIZTNRSA-N	540.331170548							106818
BRD-K46936325	LSM-18174		44495488	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23-,24+,31+/m0/s1	DSXVWRRZDLHRDJ-UBWFJNMSSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K46936325	BRD-K46936325-001-01-2	Broad Institute of MIT and Harvard	BRD-K46936325			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23-,24+,31+/m0/s1	DSXVWRRZDLHRDJ-UBWFJNMSSA-N	576.331170548							106819
BRD-K57575504	LSM-18175		54614837	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24-,29+/m0/s1	PRCUBQSECBZBSK-HGPRPZRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K57575504	BRD-K57575504-001-01-7	Broad Institute of MIT and Harvard	BRD-K57575504			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24-,29+/m0/s1	PRCUBQSECBZBSK-HGPRPZRGSA-N	575.30290688							106820
BRD-K58888361	LSM-18176		54614843	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20+,24-/m0/s1	ZPGALQDMRVAORJ-KTIHBUSBSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K58888361	BRD-K58888361-001-01-5	Broad Institute of MIT and Harvard	BRD-K58888361			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20+,24-/m0/s1	ZPGALQDMRVAORJ-KTIHBUSBSA-N	609.269556004							106821
BRD-K57027644	LSM-18177		44495076	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32+/m1/s1	LKIIRWUIYHEPDR-ZYMMPZCLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K57027644	BRD-K57027644-001-01-0	Broad Institute of MIT and Harvard	BRD-K57027644			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32+/m1/s1	LKIIRWUIYHEPDR-ZYMMPZCLSA-N	622.37303536							106822
BRD-K50149147	LSM-18178		44484573	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19+,23-/m0/s1	HNAHSZOZZNPVNF-XWQURZDVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K50149147	BRD-K50149147-001-01-1	Broad Institute of MIT and Harvard	BRD-K50149147			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19+,23-/m0/s1	HNAHSZOZZNPVNF-XWQURZDVSA-N	499.271606752							106823
BRD-K44696931	LSM-6117		44488783	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24+,25+,31-/m1/s1	ZZWVGKUDLRNMBI-AOHZZOSCSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K44696931	BRD-K44696931-001-01-0	Broad Institute of MIT and Harvard	BRD-K44696931			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24+,25+,31-/m1/s1	ZZWVGKUDLRNMBI-AOHZZOSCSA-N	619.329121628							94898
BRD-K50746465	LSM-18179		44618815	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24+,25+,30+/m1/s1	HYZLHQOJAWWHRH-DUXAABNJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K50746465	BRD-K50746465-001-01-8	Broad Institute of MIT and Harvard	BRD-K50746465			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24+,25+,30+/m1/s1	HYZLHQOJAWWHRH-DUXAABNJSA-N	589.318556944							106824
BRD-K53191200	LSM-18180		44616912	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33+/m1/s1	FHYFYPZRCDKSKV-ZLFFOLKFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K53191200	BRD-K53191200-001-01-4	Broad Institute of MIT and Harvard	BRD-K53191200			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33+/m1/s1	FHYFYPZRCDKSKV-ZLFFOLKFSA-N	608.393770804							106825
BRD-K50532142	LSM-18181		44494994	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24+/m0/s1	PQNWFIFCFFWMJI-CMCWBKRRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K50532142	BRD-K50532142-001-01-3	Broad Institute of MIT and Harvard	BRD-K50532142			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24+/m0/s1	PQNWFIFCFFWMJI-CMCWBKRRSA-N	449.325356886							106826
BRD-K58757743	LSM-18182		44497723	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22-,23-,28-/m0/s1	SKZBTEBCBLPBIZ-AMZZYFJHSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K58757743	BRD-K58757743-001-01-1	Broad Institute of MIT and Harvard	BRD-K58757743			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22-,23-,28-/m0/s1	SKZBTEBCBLPBIZ-AMZZYFJHSA-N	561.287256816							106827
MLS003128887	LSM-18183	BRD-K59002219, SID99359325	46903889	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22+,23+,30+/m1/s1	KQLDLPDWVHVVHP-JLWZNRLGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K59002219	BRD-K59002219-001-01-6	Broad Institute of MIT and Harvard	BRD-K59002219			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22+,23+,30+/m1/s1	KQLDLPDWVHVVHP-JLWZNRLGSA-N	619.29273612							106828
BRD-K42899345	LSM-18184		44620326	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23+,28+/m1/s1	DKJIIKWCTXJSNY-FZVPRWPTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K42899345	BRD-K42899345-001-01-2	Broad Institute of MIT and Harvard	BRD-K42899345			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23+,28+/m1/s1	DKJIIKWCTXJSNY-FZVPRWPTSA-N	561.287256816							106829
MLS003128686	LSM-11237	BRD-K46098747, SID99358935	44500855	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23+,24+,30+/m0/s1	OKIGVZMNGZVCJM-QXFFIUSXSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C	BroadT	BRD-K46098747	BRD-K46098747-001-01-1	Broad Institute of MIT and Harvard	BRD-K46098747			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23+,24+,30+/m0/s1	OKIGVZMNGZVCJM-QXFFIUSXSA-N	605.313471564							99858
BRD-K47874568	LSM-18185		44489883	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19-,20-,24+/m1/s1	LBVOXJOHMPITGR-FIXDAVPBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K47874568	BRD-K47874568-001-01-0	Broad Institute of MIT and Harvard	BRD-K47874568			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19-,20-,24+/m1/s1	LBVOXJOHMPITGR-FIXDAVPBSA-N	609.269556004							106830
BRD-K43479153	LSM-18186		44488179	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24+,29-/m1/s1	QUSLWNNTNFDPAB-CAFXQFFASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K43479153	BRD-K43479153-001-01-3	Broad Institute of MIT and Harvard	BRD-K43479153			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24+,29-/m1/s1	QUSLWNNTNFDPAB-CAFXQFFASA-N	545.382871762							106831
BRD-K50046044	LSM-18187		54614825	InChI=1S/C31H46ClN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23+,24+,30+/m0/s1	XCNKIYRWXFRDDY-QXFFIUSXSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K50046044	BRD-K50046044-001-01-3	Broad Institute of MIT and Harvard	BRD-K50046044			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H46ClN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23+,24+,30+/m0/s1	XCNKIYRWXFRDDY-QXFFIUSXSA-N	623.279584622							106832
CHEMBL3185226	LSM-18188	BRD-K48564062	44620032	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23-,28-/m1/s1	SKZBTEBCBLPBIZ-JTNFPWQOSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K48564062	BRD-K48564062-001-01-7	Broad Institute of MIT and Harvard	BRD-K48564062			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23-,28-/m1/s1	SKZBTEBCBLPBIZ-JTNFPWQOSA-N	561.287256816							106833
BRD-K53797069	LSM-18189		44618765	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22+,23+,30-/m1/s1	KQLDLPDWVHVVHP-VVOVZLFDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K53797069	BRD-K53797069-001-01-8	Broad Institute of MIT and Harvard	BRD-K53797069			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22+,23+,30-/m1/s1	KQLDLPDWVHVVHP-VVOVZLFDSA-N	619.29273612							106834
BRD-K48412518	LSM-18190		44493133	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22+,23+,28-/m1/s1	SCSZUZCJLHTTSJ-YFUNBVQMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K48412518	BRD-K48412518-001-01-9	Broad Institute of MIT and Harvard	BRD-K48412518			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22+,23+,28-/m1/s1	SCSZUZCJLHTTSJ-YFUNBVQMSA-N	589.282171436							106835
BRD-K41133627	LSM-18191		44616340	InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24+,25+,30-/m1/s1	DPWBPPWCHVQSHF-UBRKHCEVSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K41133627	BRD-K41133627-001-01-6	Broad Institute of MIT and Harvard	BRD-K41133627			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24+,25+,30-/m1/s1	DPWBPPWCHVQSHF-UBRKHCEVSA-N	553.351571634							106836
BRD-K41272069	LSM-18192		44495060	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23-,24+,29+/m1/s1	OJAAEAMCTGSNOQ-CHCBTGSZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K41272069	BRD-K41272069-001-01-7	Broad Institute of MIT and Harvard	BRD-K41272069			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23-,24+,29+/m1/s1	OJAAEAMCTGSNOQ-CHCBTGSZSA-N	575.30290688							106837
BRD-K58017833	LSM-18193		44617226	InChI=1S/C31H47N3O6S/c1-6-17-33(5)21-30-23(2)20-34(24(3)22-35)31(36)28-19-26(32-41(37,38)27-13-8-7-9-14-27)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,32,35H,6,10-12,17-18,20-22H2,1-5H3/t23-,24-,25+,30-/m0/s1	ZAMGSALMCFAIEX-INVAMZEASA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K58017833	BRD-K58017833-001-01-1	Broad Institute of MIT and Harvard	BRD-K58017833			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C31H47N3O6S/c1-6-17-33(5)21-30-23(2)20-34(24(3)22-35)31(36)28-19-26(32-41(37,38)27-13-8-7-9-14-27)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,32,35H,6,10-12,17-18,20-22H2,1-5H3/t23-,24-,25+,30-/m0/s1	ZAMGSALMCFAIEX-INVAMZEASA-N	589.318556944							106838
BRD-K54956860	LSM-18194		44619285	InChI=1S/C33H49N3O5/c1-6-17-35(5)22-31-24(2)21-36(25(3)23-37)33(39)29-20-28(34-32(38)19-27-13-8-7-9-14-27)15-16-30(29)41-26(4)12-10-11-18-40-31/h7-9,13-16,20,24-26,31,37H,6,10-12,17-19,21-23H2,1-5H3,(H,34,38)/t24-,25-,26-,31-/m1/s1	HWWNGGYYBIBPCQ-YSRRZRNESA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K54956860	BRD-K54956860-001-01-0	Broad Institute of MIT and Harvard	BRD-K54956860			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C33H49N3O5/c1-6-17-35(5)22-31-24(2)21-36(25(3)23-37)33(39)29-20-28(34-32(38)19-27-13-8-7-9-14-27)15-16-30(29)41-26(4)12-10-11-18-40-31/h7-9,13-16,20,24-26,31,37H,6,10-12,17-19,21-23H2,1-5H3,(H,34,38)/t24-,25-,26-,31-/m1/s1	HWWNGGYYBIBPCQ-YSRRZRNESA-N	567.367221698							106839
BRD-K42394957	LSM-18195		49850011	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26+,27+,32+/m1/s1	ZCLFEQBFHRMJFK-ZPCULFKHSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K42394957	BRD-K42394957-001-01-3	Broad Institute of MIT and Harvard	BRD-K42394957			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26+,27+,32+/m1/s1	ZCLFEQBFHRMJFK-ZPCULFKHSA-N	611.404669846							106840
BRD-K54694941	LSM-18196		44494392	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m0/s1	LKIIRWUIYHEPDR-MQBJWECPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K54694941	BRD-K54694941-001-01-0	Broad Institute of MIT and Harvard	BRD-K54694941			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m0/s1	LKIIRWUIYHEPDR-MQBJWECPSA-N	622.37303536							106841
MLS003128818	LSM-11790	SID99359163, BRD-K55461955	46903782	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25-,30+/m0/s1	RSKGZFLSRBPJST-YDXRHMNESA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K55461955	BRD-K55461955-001-01-6	Broad Institute of MIT and Harvard	BRD-K55461955			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25-,30+/m0/s1	RSKGZFLSRBPJST-YDXRHMNESA-N	617.41523453							100415
BRD-K43237307	LSM-18197		44620397	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22-,23-,29-/m0/s1	QSYAMXVABCSWEP-VCTIXIOLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K43237307	BRD-K43237307-001-01-0	Broad Institute of MIT and Harvard	BRD-K43237307			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22-,23-,29-/m0/s1	QSYAMXVABCSWEP-VCTIXIOLSA-N	622.33420518							106842
BRD-K55562948	LSM-18198		44620286	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32-/m1/s1	IDICBOGPMQOFGC-WRZBRUQPSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K55562948	BRD-K55562948-001-01-1	Broad Institute of MIT and Harvard	BRD-K55562948			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32-/m1/s1	IDICBOGPMQOFGC-WRZBRUQPSA-N	616.326085168							106843
BRD-K55662526	LSM-18199		44494546	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20+,26+/m1/s1	YDWJBUOXSRVMJV-NXHWOCBTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C1=O	BroadT	BRD-K55662526	BRD-K55662526-001-01-9	Broad Institute of MIT and Harvard	BRD-K55662526			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20+,26+/m1/s1	YDWJBUOXSRVMJV-NXHWOCBTSA-N	559.33698421							106844
BRD-K43418395	LSM-18200		44504564	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23+,28+/m0/s1	SKZBTEBCBLPBIZ-TUEWKVEFSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K43418395	BRD-K43418395-001-01-9	Broad Institute of MIT and Harvard	BRD-K43418395			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23+,28+/m0/s1	SKZBTEBCBLPBIZ-TUEWKVEFSA-N	561.287256816							106845
BRD-K43456755	LSM-18201		44494410	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20+,26-/m0/s1	YDWJBUOXSRVMJV-BJZAYRLRSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C1=O	BroadT	BRD-K43456755	BRD-K43456755-001-01-3	Broad Institute of MIT and Harvard	BRD-K43456755			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20+,26-/m0/s1	YDWJBUOXSRVMJV-BJZAYRLRSA-N	559.33698421							106846
BRD-K47314501	LSM-18202		54614820	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m1/s1	OQPYQZIBKYAWRE-XDMKPEOCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K47314501	BRD-K47314501-001-01-7	Broad Institute of MIT and Harvard	BRD-K47314501			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m1/s1	OQPYQZIBKYAWRE-XDMKPEOCSA-N	622.37303536							106847
BRD-K52225720	LSM-18203		44490855	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22+,28-/m0/s1	DYIGNVBEUCFAEB-WBJWTPEXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K52225720	BRD-K52225720-001-01-2	Broad Institute of MIT and Harvard	BRD-K52225720			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22+,28-/m0/s1	DYIGNVBEUCFAEB-WBJWTPEXSA-N	558.321748716							106848
BRD-K48338059	LSM-18204		44488777	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20+,21-,27-/m0/s1	PQVSIMSGGSSCRI-WFQVPWNOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K48338059	BRD-K48338059-001-01-1	Broad Institute of MIT and Harvard	BRD-K48338059			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20+,21-,27-/m0/s1	PQVSIMSGGSSCRI-WFQVPWNOSA-N	594.308720542							106849
MLS003128870	LSM-18205	BRD-K58708811, SID99359311	46903881	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33-/m1/s1	FHYFYPZRCDKSKV-HYHRRZRMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K58708811	BRD-K58708811-001-01-1	Broad Institute of MIT and Harvard	BRD-K58708811			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33-/m1/s1	FHYFYPZRCDKSKV-HYHRRZRMSA-N	608.393770804							106850
MLS003128723	LSM-18206	BRD-K58753007, SID99358963	44502219	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23+,24+,30+/m0/s1	JGZXBABAHUXSMS-QXFFIUSXSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K58753007	BRD-K58753007-001-01-1	Broad Institute of MIT and Harvard	BRD-K58753007			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23+,24+,30+/m0/s1	JGZXBABAHUXSMS-QXFFIUSXSA-N	569.346486254							106851
BRD-K43106305	LSM-18207		44483969	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20+,21-,26-/m1/s1	UGHRLCJQQBYBPV-SBZFUYPRSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K43106305	BRD-K43106305-001-01-9	Broad Institute of MIT and Harvard	BRD-K43106305			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20+,21-,26-/m1/s1	UGHRLCJQQBYBPV-SBZFUYPRSA-N	512.29987042							106852
BRD-K57907671	LSM-18208		44620208	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18-,19-,25+/m1/s1	OIOMLIQJBPNRTR-QAAIKFCJSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K57907671	BRD-K57907671-001-01-9	Broad Institute of MIT and Harvard	BRD-K57907671			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18-,19-,25+/m1/s1	OIOMLIQJBPNRTR-QAAIKFCJSA-N	545.321334146							106853
BRD-K43053725	LSM-18209		54614807	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26-,27-,32+/m0/s1	ZMTJRORPEDZKCY-GZNUUUAQSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K43053725	BRD-K43053725-001-01-5	Broad Institute of MIT and Harvard	BRD-K43053725			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26-,27-,32+/m0/s1	ZMTJRORPEDZKCY-GZNUUUAQSA-N	624.388685424							106854
BRD-K58077750	LSM-18210		44492117	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20-,21-,26+/m0/s1	UGHRLCJQQBYBPV-HJJDGDTKSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K58077750	BRD-K58077750-001-01-4	Broad Institute of MIT and Harvard	BRD-K58077750			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20-,21-,26+/m0/s1	UGHRLCJQQBYBPV-HJJDGDTKSA-N	512.29987042							106855
BRD-K44944875	LSM-18211		44619844	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24-,29+/m1/s1	YZLWJGCKUGDXHR-XTGAJNFRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K44944875	BRD-K44944875-001-01-2	Broad Institute of MIT and Harvard	BRD-K44944875			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24-,29+/m1/s1	YZLWJGCKUGDXHR-XTGAJNFRSA-N	560.393770804							106856
BRD-K50079182	LSM-15145		44497267	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23-,24-,29-/m0/s1	MOSVBDAIGOGSPE-UITIVDIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K50079182	BRD-K50079182-001-01-6	Broad Institute of MIT and Harvard	BRD-K50079182			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23-,24-,29-/m0/s1	MOSVBDAIGOGSPE-UITIVDIESA-N	581.349857072							103801
BRD-K41033343	LSM-18212		54614797	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28-/m0/s1	KDWFAOIYLGHTDK-QBMQIYCRSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	BroadT	BRD-K41033343	BRD-K41033343-001-01-1	Broad Institute of MIT and Harvard	BRD-K41033343			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28-/m0/s1	KDWFAOIYLGHTDK-QBMQIYCRSA-N	579.277834984							106857
BRD-K42032479	LSM-18213		54614802	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22-,23-,28+/m1/s1	SKZBTEBCBLPBIZ-IZXSZHORSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K42032479	BRD-K42032479-001-01-8	Broad Institute of MIT and Harvard	BRD-K42032479			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22-,23-,28+/m1/s1	SKZBTEBCBLPBIZ-IZXSZHORSA-N	561.287256816							106858
BRD-K57051157	LSM-18214		44497760	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25-,26-,32-/m1/s1	JCVAFPCEYZSYDX-WRZBRUQPSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K57051157	BRD-K57051157-001-01-9	Broad Institute of MIT and Harvard	BRD-K57051157			COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25-,26-,32-/m1/s1	JCVAFPCEYZSYDX-WRZBRUQPSA-N	612.388685424							106859
BRD-K53050301	LSM-18215		44487514	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24+,25+,32+/m1/s1	HBVPERRGRWZCML-OWNVZFKLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	BroadT	BRD-K53050301	BRD-K53050301-001-01-0	Broad Institute of MIT and Harvard	BRD-K53050301			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24+,25+,32+/m1/s1	HBVPERRGRWZCML-OWNVZFKLSA-N	590.346820612							106860
CHEMBL3186624	LSM-18216	BRD-K44916315	44502959	InChI=1S/C31H47N3O6S/c1-6-17-33(5)21-30-23(2)20-34(24(3)22-35)31(36)28-19-26(32-41(37,38)27-13-8-7-9-14-27)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,32,35H,6,10-12,17-18,20-22H2,1-5H3/t23-,24+,25+,30-/m0/s1	ZAMGSALMCFAIEX-RPQPUBLWSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K44916315	BRD-K44916315-001-01-8	Broad Institute of MIT and Harvard	BRD-K44916315			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H47N3O6S/c1-6-17-33(5)21-30-23(2)20-34(24(3)22-35)31(36)28-19-26(32-41(37,38)27-13-8-7-9-14-27)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,32,35H,6,10-12,17-18,20-22H2,1-5H3/t23-,24+,25+,30-/m0/s1	ZAMGSALMCFAIEX-RPQPUBLWSA-N	589.318556944							106861
BRD-K40102258	LSM-18217		44490448	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22-,23-,28+/m1/s1	GAZXHMFIMHCKKU-IZXSZHORSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K40102258	BRD-K40102258-001-01-8	Broad Institute of MIT and Harvard	BRD-K40102258			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22-,23-,28+/m1/s1	GAZXHMFIMHCKKU-IZXSZHORSA-N	576.298155858							106862
BRD-K44304623	LSM-18218		44498610	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22-,23-,29-/m1/s1	PSEUFYCSFOBFBF-PZNASWHRSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K44304623	BRD-K44304623-001-01-4	Broad Institute of MIT and Harvard	BRD-K44304623			COc1ccc(NC(=O)Nc2ccc3O[C@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22-,23-,29-/m1/s1	PSEUFYCSFOBFBF-PZNASWHRSA-N	570.341735232							106863
BRD-K57349002	LSM-18219		54614836	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30-/m1/s1	DXYWKCBATINIRK-ZASNTINBSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K57349002	BRD-K57349002-001-01-4	Broad Institute of MIT and Harvard	BRD-K57349002			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30-/m1/s1	DXYWKCBATINIRK-ZASNTINBSA-N	596.357385296							106864
BRD-K44787496	LSM-18220		44618267	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20+,24-/m1/s1	ORDOAKKGIRZCMJ-MTXNFPGFSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K44787496	BRD-K44787496-001-01-4	Broad Institute of MIT and Harvard	BRD-K44787496			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20+,24-/m1/s1	ORDOAKKGIRZCMJ-MTXNFPGFSA-N	513.287256816							106865
BRD-K50201262	LSM-18221		54614826	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32-/m0/s1	OQPYQZIBKYAWRE-ZQIYOYMASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K50201262	BRD-K50201262-001-01-9	Broad Institute of MIT and Harvard	BRD-K50201262			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32-/m0/s1	OQPYQZIBKYAWRE-ZQIYOYMASA-N	622.37303536							106866
BRD-K39710695	LSM-18222		44491468	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24+,29-/m1/s1	QUSLWNNTNFDPAB-IDCDSMMUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K39710695	BRD-K39710695-001-01-2	Broad Institute of MIT and Harvard	BRD-K39710695			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24+,29-/m1/s1	QUSLWNNTNFDPAB-IDCDSMMUSA-N	545.382871762							106867
BRD-K48835953	LSM-18223		44618490	InChI=1S/C29H47N5O6S/c1-7-13-32(5)17-27-21(2)16-34(22(3)19-35)29(36)25-15-24(31-41(37,38)28-18-33(6)20-30-28)11-12-26(25)40-23(4)10-8-9-14-39-27/h11-12,15,18,20-23,27,31,35H,7-10,13-14,16-17,19H2,1-6H3/t21-,22-,23+,27-/m0/s1	IKHNOPCXKIAMPI-TZKYFUQOSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K48835953	BRD-K48835953-001-01-3	Broad Institute of MIT and Harvard	BRD-K48835953			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H47N5O6S/c1-7-13-32(5)17-27-21(2)16-34(22(3)19-35)29(36)25-15-24(31-41(37,38)28-18-33(6)20-30-28)11-12-26(25)40-23(4)10-8-9-14-39-27/h11-12,15,18,20-23,27,31,35H,7-10,13-14,16-17,19H2,1-6H3/t21-,22-,23+,27-/m0/s1	IKHNOPCXKIAMPI-TZKYFUQOSA-N	593.324704964							106868
BRD-K46526566	LSM-18224		44490388	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20-,24+/m1/s1	JFWSYQFTTWMPPF-ZSTWQFLISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K46526566	BRD-K46526566-001-01-9	Broad Institute of MIT and Harvard	BRD-K46526566			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20-,24+/m1/s1	JFWSYQFTTWMPPF-ZSTWQFLISA-N	545.307656074							106869
BRD-K57489406	LSM-18225		44485091	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25-,30-/m1/s1	OPCOPDBCCFUTHV-SFOWLQBLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K57489406	BRD-K57489406-001-01-0	Broad Institute of MIT and Harvard	BRD-K57489406			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25-,30-/m1/s1	OPCOPDBCCFUTHV-SFOWLQBLSA-N	525.356657014							106870
BRD-K45142472	LSM-18226		44493621	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27-/m1/s1	JMPHEZKYQLUQMM-RSOWOKRSSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K45142472	BRD-K45142472-001-01-9	Broad Institute of MIT and Harvard	BRD-K45142472			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27-/m1/s1	JMPHEZKYQLUQMM-RSOWOKRSSA-N	517.351571634							106871
BRD-K57969466	LSM-18227		44489309	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21-,22-,27-/m0/s1	JLURSCHFCUHCJF-LFYAFONDSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K57969466	BRD-K57969466-001-01-8	Broad Institute of MIT and Harvard	BRD-K57969466			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21-,22-,27-/m0/s1	JLURSCHFCUHCJF-LFYAFONDSA-N	547.271606752							106872
BRD-K58113140	LSM-18228		44485118	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24-,25-,32+/m0/s1	HBVPERRGRWZCML-RVMAYGNISA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	BroadT	BRD-K58113140	BRD-K58113140-001-01-6	Broad Institute of MIT and Harvard	BRD-K58113140			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24-,25-,32+/m0/s1	HBVPERRGRWZCML-RVMAYGNISA-N	590.346820612							106873
BRD-K40954438	LSM-18229		44502768	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,29-/m0/s1	IVNRRFOIDKKMKL-KUFVDZEESA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K40954438	BRD-K40954438-001-01-5	Broad Institute of MIT and Harvard	BRD-K40954438			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H45N3O7S/c1-21-18-33(22(2)20-34)30(35)27-17-24(31-41(36,37)26-13-11-25(38-6)12-14-26)10-15-28(27)40-23(3)9-7-8-16-39-29(21)19-32(4)5/h10-15,17,21-23,29,31,34H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,29-/m0/s1	IVNRRFOIDKKMKL-KUFVDZEESA-N	591.2978215							106874
BRD-K52424224	LSM-18230		44495448	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22-,23+,28-/m1/s1	SCSZUZCJLHTTSJ-SQVYLTPJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K52424224	BRD-K52424224-001-01-2	Broad Institute of MIT and Harvard	BRD-K52424224			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22-,23+,28-/m1/s1	SCSZUZCJLHTTSJ-SQVYLTPJSA-N	589.282171436							106875
BRD-K49391713	LSM-18231		44620520	InChI=1S/C29H47N5O6S/c1-7-13-32(5)17-27-21(2)16-34(22(3)19-35)29(36)25-15-24(31-41(37,38)28-18-33(6)20-30-28)11-12-26(25)40-23(4)10-8-9-14-39-27/h11-12,15,18,20-23,27,31,35H,7-10,13-14,16-17,19H2,1-6H3/t21-,22+,23+,27+/m0/s1	IKHNOPCXKIAMPI-IILZIBOQSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K49391713	BRD-K49391713-001-01-7	Broad Institute of MIT and Harvard	BRD-K49391713			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H47N5O6S/c1-7-13-32(5)17-27-21(2)16-34(22(3)19-35)29(36)25-15-24(31-41(37,38)28-18-33(6)20-30-28)11-12-26(25)40-23(4)10-8-9-14-39-27/h11-12,15,18,20-23,27,31,35H,7-10,13-14,16-17,19H2,1-6H3/t21-,22+,23+,27+/m0/s1	IKHNOPCXKIAMPI-IILZIBOQSA-N	593.324704964							106876
BRD-K49878220	LSM-18232		54614824	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23-,28-/m0/s1	SKZBTEBCBLPBIZ-KYALDGGBSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K49878220	BRD-K49878220-001-01-9	Broad Institute of MIT and Harvard	BRD-K49878220			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23-,28-/m0/s1	SKZBTEBCBLPBIZ-KYALDGGBSA-N	561.287256816							106877
BRD-K47197953	LSM-18233		44619588	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21-,22-,28+/m1/s1	QZYXNEJVPTWBHC-KUMFRPPMSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K47197953	BRD-K47197953-001-01-9	Broad Institute of MIT and Harvard	BRD-K47197953			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21-,22-,28+/m1/s1	QZYXNEJVPTWBHC-KUMFRPPMSA-N	556.326085168							106878
BRD-K54839019	LSM-18234		49843112	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23+,28+/m1/s1	BJJOMMAJAORXGV-FZVPRWPTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K54839019	BRD-K54839019-001-01-8	Broad Institute of MIT and Harvard	BRD-K54839019			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23+,28+/m1/s1	BJJOMMAJAORXGV-FZVPRWPTSA-N	595.329121628							106879
BRD-K45378289	LSM-18235		44617810	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24+/m1/s1	ORDOAKKGIRZCMJ-ZSTWQFLISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K45378289	BRD-K45378289-001-01-2	Broad Institute of MIT and Harvard	BRD-K45378289			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24+/m1/s1	ORDOAKKGIRZCMJ-ZSTWQFLISA-N	513.287256816							106880
BRD-K56269643	LSM-15150		44487531	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22-,27+/m1/s1	FBKKOHUHBUWDTB-RYBWSMFQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K56269643	BRD-K56269643-001-01-0	Broad Institute of MIT and Harvard	BRD-K56269643			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22-,27+/m1/s1	FBKKOHUHBUWDTB-RYBWSMFQSA-N	526.315520484							103806
BRD-K40851366	LSM-18236		54614795	InChI=1S/C30H43N3O5/c1-21-19-33(22(2)20-34)30(36)26-17-25(32-29(35)16-24-11-6-5-7-12-24)13-14-27(26)38-23(3)10-8-9-15-37-28(21)18-31-4/h5-7,11-14,17,21-23,28,31,34H,8-10,15-16,18-20H2,1-4H3,(H,32,35)/t21-,22+,23-,28+/m0/s1	GZRWXBHQPNTACC-WYNJNVBPSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K40851366	BRD-K40851366-001-01-9	Broad Institute of MIT and Harvard	BRD-K40851366			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H43N3O5/c1-21-19-33(22(2)20-34)30(36)26-17-25(32-29(35)16-24-11-6-5-7-12-24)13-14-27(26)38-23(3)10-8-9-15-37-28(21)18-31-4/h5-7,11-14,17,21-23,28,31,34H,8-10,15-16,18-20H2,1-4H3,(H,32,35)/t21-,22+,23-,28+/m0/s1	GZRWXBHQPNTACC-WYNJNVBPSA-N	525.320271506							106881
CHEMBL3186976	LSM-18237	BRD-K39681206	44492627	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28-/m0/s1	GOBHPVUGCFRQAG-WENLUUPESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	BroadT	BRD-K39681206	BRD-K39681206-001-01-7	Broad Institute of MIT and Harvard	BRD-K39681206			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28-/m0/s1	GOBHPVUGCFRQAG-WENLUUPESA-N	595.248284494							106882
BRD-K43901257	LSM-18238		44491492	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21-,22-,29+/m0/s1	BFYBBBSDVFDXJC-LLIWRNBMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	BroadT	BRD-K43901257	BRD-K43901257-001-01-1	Broad Institute of MIT and Harvard	BRD-K43901257			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21-,22-,29+/m0/s1	BFYBBBSDVFDXJC-LLIWRNBMSA-N	584.320999788							131247
BRD-K39237968-001-01-6	LSM-18239	BRD-K39237968	44494599	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28+/m1/s1	GOBHPVUGCFRQAG-KUMFRPPMSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	BroadT	BRD-K39237968	BRD-K39237968-001-01-6	Broad Institute of MIT and Harvard	BRD-K39237968			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28+/m1/s1	GOBHPVUGCFRQAG-KUMFRPPMSA-N	595.248284494							106885
BRD-K45964657	LSM-18240		44620468	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24-,29+/m0/s1	PRCUBQSECBZBSK-HNFJUSDZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K45964657	BRD-K45964657-001-01-3	Broad Institute of MIT and Harvard	BRD-K45964657			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24-,29+/m0/s1	PRCUBQSECBZBSK-HNFJUSDZSA-N	575.30290688							106886
BRD-K49029187	LSM-18241		44620288	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18-,22-/m1/s1	GOTBAIXNEHVFNA-OZQHCQBDSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K49029187	BRD-K49029187-001-01-0	Broad Institute of MIT and Harvard	BRD-K49029187			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18-,22-/m1/s1	GOTBAIXNEHVFNA-OZQHCQBDSA-N	485.255956688							106887
BRD-K57014767	LSM-18242		44504266	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22+,23+,28+/m0/s1	NMRMJZSCUHLPQY-TUEWKVEFSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)CC3CC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K57014767	BRD-K57014767-001-01-9	Broad Institute of MIT and Harvard	BRD-K57014767			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)CC3CC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22+,23+,28+/m0/s1	NMRMJZSCUHLPQY-TUEWKVEFSA-N	546.37812074							106888
BRD-K54964687	LSM-18243		44484565	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28-/m0/s1	VTJNXDUZLOWMHH-QKFCCHLXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K54964687	BRD-K54964687-001-01-5	Broad Institute of MIT and Harvard	BRD-K54964687			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28-/m0/s1	VTJNXDUZLOWMHH-QKFCCHLXSA-N	531.367221698							106889
BRD-K56738235	LSM-18244		44494965	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23-,24-,29+/m0/s1	OJAAEAMCTGSNOQ-HGPRPZRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K56738235	BRD-K56738235-001-01-8	Broad Institute of MIT and Harvard	BRD-K56738235			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23-,24-,29+/m0/s1	OJAAEAMCTGSNOQ-HGPRPZRGSA-N	575.30290688							106890
BRD-K41044903	LSM-18245		44497806	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28+/m1/s1	VUABGABXFJSUSX-IZXSZHORSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K41044903	BRD-K41044903-001-01-0	Broad Institute of MIT and Harvard	BRD-K41044903			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28+/m1/s1	VUABGABXFJSUSX-IZXSZHORSA-N	546.37812074							106891
BRD-K39709957	LSM-18246		44487558	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28-,33+/m1/s1	YHPMBPSGDQLXHP-CPWWYQHDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K39709957	BRD-K39709957-001-01-7	Broad Institute of MIT and Harvard	BRD-K39709957			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28-,33+/m1/s1	YHPMBPSGDQLXHP-CPWWYQHDSA-N	610.409420868							106892
BRD-K40061857	LSM-18247		44492081	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23-,28-/m1/s1	GAZXHMFIMHCKKU-JTNFPWQOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K40061857	BRD-K40061857-001-01-1	Broad Institute of MIT and Harvard	BRD-K40061857			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23-,28-/m1/s1	GAZXHMFIMHCKKU-JTNFPWQOSA-N	576.298155858							106893
BRD-K47613410	LSM-18248		44484578	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25+,30-/m0/s1	OPCOPDBCCFUTHV-INVAMZEASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K47613410	BRD-K47613410-001-01-2	Broad Institute of MIT and Harvard	BRD-K47613410			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25+,30-/m0/s1	OPCOPDBCCFUTHV-INVAMZEASA-N	525.356657014							106894
BRD-K44722328	LSM-18249		44618504	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m1/s1	IDICBOGPMQOFGC-XDMKPEOCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K44722328	BRD-K44722328-001-01-5	Broad Institute of MIT and Harvard	BRD-K44722328			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m1/s1	IDICBOGPMQOFGC-XDMKPEOCSA-N	616.326085168							106895
BRD-K41674016	LSM-18250		44495987	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20-,26-/m1/s1	YDWJBUOXSRVMJV-YKFMDHBFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C1=O	BroadT	BRD-K41674016	BRD-K41674016-001-01-8	Broad Institute of MIT and Harvard	BRD-K41674016			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20-,26-/m1/s1	YDWJBUOXSRVMJV-YKFMDHBFSA-N	559.33698421							106896
BRD-K58670847	LSM-18251		44490412	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m1/s1	LQSMEYMBJWSEPC-KRHPZPPWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K58670847	BRD-K58670847-001-01-1	Broad Institute of MIT and Harvard	BRD-K58670847			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m1/s1	LQSMEYMBJWSEPC-KRHPZPPWSA-N	525.320271506							106897
BRD-K39624517	LSM-18252		44494911	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29+/m0/s1	GPFIDTWNGXWRJK-CMSZEEODSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K39624517	BRD-K39624517-001-01-1	Broad Institute of MIT and Harvard	BRD-K39624517			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29+/m0/s1	GPFIDTWNGXWRJK-CMSZEEODSA-N	575.30290688							106898
BRD-K48389518	LSM-18253		54614821	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28+,33-/m1/s1	XXBVUIDNUVBELT-LUYUGSQRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K48389518	BRD-K48389518-001-01-9	Broad Institute of MIT and Harvard	BRD-K48389518			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28+,33-/m1/s1	XXBVUIDNUVBELT-LUYUGSQRSA-N	616.45637106							106899
BRD-K55867695	LSM-18254		44620087	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24+,29+/m1/s1	XPIAMQJKSFNCJS-CHCBTGSZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K55867695	BRD-K55867695-001-01-9	Broad Institute of MIT and Harvard	BRD-K55867695			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24+,29+/m1/s1	XPIAMQJKSFNCJS-CHCBTGSZSA-N	603.2978215							106900
BRD-K53816426	LSM-18255		44495057	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28+/m1/s1	SCSZUZCJLHTTSJ-KRHPZPPWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K53816426	BRD-K53816426-001-01-4	Broad Institute of MIT and Harvard	BRD-K53816426			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28+/m1/s1	SCSZUZCJLHTTSJ-KRHPZPPWSA-N	589.282171436							106901
BRD-K52083268	LSM-18256		44495497	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29+/m0/s1	KAHNNCGHTWSOBA-HNFJUSDZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K52083268	BRD-K52083268-001-01-3	Broad Institute of MIT and Harvard	BRD-K52083268			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29+/m0/s1	KAHNNCGHTWSOBA-HNFJUSDZSA-N	554.346820612							106902
BRD-K48235506	LSM-18257		44485793	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28+,33-/m1/s1	YHPMBPSGDQLXHP-LUYUGSQRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K48235506	BRD-K48235506-001-01-8	Broad Institute of MIT and Harvard	BRD-K48235506			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28+,33-/m1/s1	YHPMBPSGDQLXHP-LUYUGSQRSA-N	610.409420868							106903
BRD-K55237592	LSM-18258		44617425	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22-,26+/m0/s1	UJYZNBPSVBHVBP-IMIIHFCZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K55237592	BRD-K55237592-001-01-9	Broad Institute of MIT and Harvard	BRD-K55237592			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22-,26+/m0/s1	UJYZNBPSVBHVBP-IMIIHFCZSA-N	579.3090549							106904
BRD-K54224946	LSM-18259		44618678	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22-,23+,29+/m0/s1	PSEUFYCSFOBFBF-UJUOIFIWSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K54224946	BRD-K54224946-001-01-1	Broad Institute of MIT and Harvard	BRD-K54224946			COc1ccc(NC(=O)Nc2ccc3O[C@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22-,23+,29+/m0/s1	PSEUFYCSFOBFBF-UJUOIFIWSA-N	570.341735232							106905
BRD-K51573654	LSM-18260		44494379	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25+,30+/m0/s1	OMPYFAIFRLVIFJ-RZDWVWPCSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K51573654	BRD-K51573654-001-01-6	Broad Institute of MIT and Harvard	BRD-K51573654			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25+,30+/m0/s1	OMPYFAIFRLVIFJ-RZDWVWPCSA-N	621.338956202							106906
BRD-K58534531	LSM-18261		44619434	InChI=1S/C30H43N3O5/c1-21-19-33(22(2)20-34)30(36)26-17-25(32-29(35)16-24-11-6-5-7-12-24)13-14-27(26)38-23(3)10-8-9-15-37-28(21)18-31-4/h5-7,11-14,17,21-23,28,31,34H,8-10,15-16,18-20H2,1-4H3,(H,32,35)/t21-,22+,23+,28+/m1/s1	GZRWXBHQPNTACC-FZVPRWPTSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K58534531	BRD-K58534531-001-01-0	Broad Institute of MIT and Harvard	BRD-K58534531			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H43N3O5/c1-21-19-33(22(2)20-34)30(36)26-17-25(32-29(35)16-24-11-6-5-7-12-24)13-14-27(26)38-23(3)10-8-9-15-37-28(21)18-31-4/h5-7,11-14,17,21-23,28,31,34H,8-10,15-16,18-20H2,1-4H3,(H,32,35)/t21-,22+,23+,28+/m1/s1	GZRWXBHQPNTACC-FZVPRWPTSA-N	525.320271506							106907
BRD-K39639513	LSM-18262		44486377	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23-/m1/s1	HNAHSZOZZNPVNF-GKAYAJSDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K39639513	BRD-K39639513-001-01-3	Broad Institute of MIT and Harvard	BRD-K39639513			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23-/m1/s1	HNAHSZOZZNPVNF-GKAYAJSDSA-N	499.271606752							106908
BRD-K58155058	LSM-18263		54614840	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28+/m0/s1	VUABGABXFJSUSX-KKQCDPINSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K58155058	BRD-K58155058-001-01-7	Broad Institute of MIT and Harvard	BRD-K58155058			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28+/m0/s1	VUABGABXFJSUSX-KKQCDPINSA-N	546.37812074							106909
BRD-K52436508	LSM-18264		44619545	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22-,23-,29+/m0/s1	PSEUFYCSFOBFBF-FSDPBTBWSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K52436508	BRD-K52436508-001-01-3	Broad Institute of MIT and Harvard	BRD-K52436508			COc1ccc(NC(=O)Nc2ccc3O[C@@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22-,23-,29+/m0/s1	PSEUFYCSFOBFBF-FSDPBTBWSA-N	570.341735232							106910
BRD-K47030799	LSM-18265		54614819	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23+,24-,30-/m0/s1	IYJPIDGCXVWPNR-PUMORYBASA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	BroadT	BRD-K47030799	BRD-K47030799-001-01-0	Broad Institute of MIT and Harvard	BRD-K47030799			COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23+,24-,30-/m0/s1	IYJPIDGCXVWPNR-PUMORYBASA-N	584.357385296							106911
BRD-K56870337	LSM-18266		44616329	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24-/m0/s1	ORDOAKKGIRZCMJ-VKDGWMQASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K56870337	BRD-K56870337-001-01-6	Broad Institute of MIT and Harvard	BRD-K56870337			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24-/m0/s1	ORDOAKKGIRZCMJ-VKDGWMQASA-N	513.287256816							106912
BRD-K58791506	LSM-18267		54614842	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18+,22-/m0/s1	GOTBAIXNEHVFNA-AYMMHLMVSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K58791506	BRD-K58791506-001-01-7	Broad Institute of MIT and Harvard	BRD-K58791506			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18+,22-/m0/s1	GOTBAIXNEHVFNA-AYMMHLMVSA-N	485.255956688							106913
BRD-K59093791	LSM-18268		44617806	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25-,30+/m1/s1	ZGCRSIABJPRXFC-ZXPXOXBPSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K59093791	BRD-K59093791-001-01-1	Broad Institute of MIT and Harvard	BRD-K59093791			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25-,30+/m1/s1	ZGCRSIABJPRXFC-ZXPXOXBPSA-N	553.351571634							106914
BRD-K56884102	LSM-15040		44486424	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25-,26+,33-/m1/s1	UBYZDEGPUXBRQE-BEXWAKDESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K56884102	BRD-K56884102-001-01-0	Broad Institute of MIT and Harvard	BRD-K56884102			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25-,26+,33-/m1/s1	UBYZDEGPUXBRQE-BEXWAKDESA-N	604.362470676							103696
BRD-K52838863	LSM-18269		44491521	InChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16-,17-,21+/m1/s1	XRGBJGDCXQTJDT-LHUKNYEISA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(N)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K52838863	BRD-K52838863-001-01-9	Broad Institute of MIT and Harvard	BRD-K52838863			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(N)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16-,17-,21+/m1/s1	XRGBJGDCXQTJDT-LHUKNYEISA-N	407.278406694							106915
BRD-K47417426	LSM-18270		44617910	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30+/m0/s1	KOPUKDVKYXJRIR-ZQIPMTRKSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K47417426	BRD-K47417426-001-01-0	Broad Institute of MIT and Harvard	BRD-K47417426			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30+/m0/s1	KOPUKDVKYXJRIR-ZQIPMTRKSA-N	602.404335488							106916
BRD-K47825575	LSM-6793		44486390	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20+,24-/m1/s1	LBVOXJOHMPITGR-KCOOYEKVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K47825575	BRD-K47825575-001-01-3	Broad Institute of MIT and Harvard	BRD-K47825575			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20+,24-/m1/s1	LBVOXJOHMPITGR-KCOOYEKVSA-N	609.269556004							95414
BRD-K43936062	LSM-18271		44485819	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21-,22-,27+/m0/s1	FBKKOHUHBUWDTB-GHIUXRNCSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K43936062	BRD-K43936062-001-01-2	Broad Institute of MIT and Harvard	BRD-K43936062			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21-,22-,27+/m0/s1	FBKKOHUHBUWDTB-GHIUXRNCSA-N	526.315520484							106917
BRD-K54484733	LSM-18272		44487545	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,28+/m1/s1	BRKIAEBRDYHMFE-KRHPZPPWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K54484733	BRD-K54484733-001-01-8	Broad Institute of MIT and Harvard	BRD-K54484733			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,28+/m1/s1	BRKIAEBRDYHMFE-KRHPZPPWSA-N	540.331170548							106918
BRD-K59130783	LSM-18273		54614844	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29-/m0/s1	MEJMTXOOFVGIJM-OJNHJINQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K59130783	BRD-K59130783-001-01-1	Broad Institute of MIT and Harvard	BRD-K59130783			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29-/m0/s1	MEJMTXOOFVGIJM-OJNHJINQSA-N	593.293485048							106919
BRD-K47504528	LSM-18274		44490283	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24+,29-/m0/s1	ZJHDPNYYPDHDNF-SEAFADMZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K47504528	BRD-K47504528-001-01-2	Broad Institute of MIT and Harvard	BRD-K47504528			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24+,29-/m0/s1	ZJHDPNYYPDHDNF-SEAFADMZSA-N	539.33592157							106920
BRD-K57293132	LSM-6131		44485655	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24+,25+,31+/m0/s1	ZZWVGKUDLRNMBI-DTTPJGKXSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K57293132	BRD-K57293132-001-01-7	Broad Institute of MIT and Harvard	BRD-K57293132			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24+,25+,31+/m0/s1	ZZWVGKUDLRNMBI-DTTPJGKXSA-N	619.329121628							94912
BRD-K52101275	LSM-18275		44618776	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21+,27-/m1/s1	QNMRQELCDYNENZ-CQXYJFHHSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K52101275	BRD-K52101275-001-01-4	Broad Institute of MIT and Harvard	BRD-K52101275			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21+,27-/m1/s1	QNMRQELCDYNENZ-CQXYJFHHSA-N	544.306098652							106921
BRD-K55414200	LSM-18276		54614833	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21-,22+,26-/m1/s1	ZWQRBFIYGZIGKO-ZUVQJFRASA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K55414200	BRD-K55414200-001-01-8	Broad Institute of MIT and Harvard	BRD-K55414200			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21-,22+,26-/m1/s1	ZWQRBFIYGZIGKO-ZUVQJFRASA-N	573.338956202							106922
BRD-K57724549	LSM-18277		44616381	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21+,22-,28+/m0/s1	QZYXNEJVPTWBHC-KJZXJLKKSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K57724549	BRD-K57724549-001-01-8	Broad Institute of MIT and Harvard	BRD-K57724549			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21+,22-,28+/m0/s1	QZYXNEJVPTWBHC-KJZXJLKKSA-N	556.326085168							106923
BRD-K55489373	LSM-18278		54614834	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24-,29-/m1/s1	PRCUBQSECBZBSK-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K55489373	BRD-K55489373-001-01-1	Broad Institute of MIT and Harvard	BRD-K55489373			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24-,29-/m1/s1	PRCUBQSECBZBSK-CDLOMYRSSA-N	575.30290688							106924
BRD-K57293986	LSM-18279		44487015	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28-/m1/s1	OWRRZEUGKXIWTQ-YFUNBVQMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K57293986	BRD-K57293986-001-01-4	Broad Institute of MIT and Harvard	BRD-K57293986			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28-/m1/s1	OWRRZEUGKXIWTQ-YFUNBVQMSA-N	540.331170548							106925
BRD-K52202153	LSM-18280		44489704	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25+,30+/m0/s1	OPCOPDBCCFUTHV-RZDWVWPCSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K52202153	BRD-K52202153-001-01-7	Broad Institute of MIT and Harvard	BRD-K52202153			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25+,30+/m0/s1	OPCOPDBCCFUTHV-RZDWVWPCSA-N	525.356657014							106926
BRD-K46877890	LSM-18281		44496865	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27-,28-,34-/m0/s1	NYAGJJIVOVZRJD-NWWIOOOSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K46877890	BRD-K46877890-001-01-3	Broad Institute of MIT and Harvard	BRD-K46877890			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27-,28-,34-/m0/s1	NYAGJJIVOVZRJD-NWWIOOOSSA-N	616.362470676							106927
BRD-K39695412	LSM-18282		54614794	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27-/m1/s1	WPSSTONNMATWEF-FGCFSOHPSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K39695412	BRD-K39695412-001-01-7	Broad Institute of MIT and Harvard	BRD-K39695412			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27-/m1/s1	WPSSTONNMATWEF-FGCFSOHPSA-N	581.23263443							106928
BRD-K40982265	LSM-18283		44495077	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19-,23+/m1/s1	AHFPIWRBAUHSCU-ZQAYVECASA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K40982265	BRD-K40982265-001-01-4	Broad Institute of MIT and Harvard	BRD-K40982265			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19-,23+/m1/s1	AHFPIWRBAUHSCU-ZQAYVECASA-N	435.309706822							106929
BRD-K54123736	LSM-18284		49842957	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33+/m1/s1	LFCBJIZGBQWHQM-ZLFFOLKFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K54123736	BRD-K54123736-001-01-9	Broad Institute of MIT and Harvard	BRD-K54123736			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33+/m1/s1	LFCBJIZGBQWHQM-ZLFFOLKFSA-N	602.346820612							106930
BRD-K44177822	LSM-18285		44501804	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28-/m0/s1	VUABGABXFJSUSX-FPZRTEDSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K44177822	BRD-K44177822-001-01-3	Broad Institute of MIT and Harvard	BRD-K44177822			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28-/m0/s1	VUABGABXFJSUSX-FPZRTEDSSA-N	546.37812074							106931
BRD-K39600742	LSM-18286		44496900	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22-,26-/m0/s1	UJYZNBPSVBHVBP-MSZDEVHKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K39600742	BRD-K39600742-001-01-8	Broad Institute of MIT and Harvard	BRD-K39600742			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22-,26-/m0/s1	UJYZNBPSVBHVBP-MSZDEVHKSA-N	579.3090549							106932
BRD-K45253154-001-01-9	LSM-6807	BRD3154, SD-6-035-A7	44618204	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24-,31+/m1/s1	WIYHORLWMFSPCL-QJWQVSSASA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K45253154	BRD-K45253154-001-01-9	Broad Institute of MIT and Harvard	BRD-K45253154			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24-,31+/m1/s1	WIYHORLWMFSPCL-QJWQVSSASA-N	569.346486254							95428
MLS003129899	LSM-18287	BRD-K43287163, SID99358397	44502968	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24+,25+,31-/m0/s1	HLAXWBUNQRUQJP-UMDYSXRGSA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	BroadT	BRD-K43287163	BRD-K43287163-001-01-8	Broad Institute of MIT and Harvard	BRD-K43287163			COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24+,25+,31-/m0/s1	HLAXWBUNQRUQJP-UMDYSXRGSA-N	555.367221698							106933
BRD-K58268854	LSM-18288		44493111	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23-,24-,29-/m0/s1	GPFIDTWNGXWRJK-UITIVDIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K58268854	BRD-K58268854-001-01-4	Broad Institute of MIT and Harvard	BRD-K58268854			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23-,24-,29-/m0/s1	GPFIDTWNGXWRJK-UITIVDIESA-N	575.30290688							106934
BRD-K52643615	LSM-18289		44504734	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28-/m0/s1	XEPWKRSQLBTXFU-FPZRTEDSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K52643615	BRD-K52643615-001-01-4	Broad Institute of MIT and Harvard	BRD-K52643615			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28-/m0/s1	XEPWKRSQLBTXFU-FPZRTEDSSA-N	595.329121628							106935
BRD-K50942788	LSM-18290		44494117	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23+,24-,29-/m0/s1	VOOFHSDUWYITSP-MVPDCNEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K50942788	BRD-K50942788-001-01-3	Broad Institute of MIT and Harvard	BRD-K50942788			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23+,24-,29-/m0/s1	VOOFHSDUWYITSP-MVPDCNEZSA-N	603.2978215							106936
BRD-K46607226	LSM-18291		54614818	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m1/s1	XEPWKRSQLBTXFU-JTNFPWQOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K46607226	BRD-K46607226-001-01-9	Broad Institute of MIT and Harvard	BRD-K46607226			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m1/s1	XEPWKRSQLBTXFU-JTNFPWQOSA-N	595.329121628							106937
BRD-K57476199	LSM-18292		44488748	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24-,25-,32-/m0/s1	HBVPERRGRWZCML-PGEKDVIVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	BroadT	BRD-K57476199	BRD-K57476199-001-01-8	Broad Institute of MIT and Harvard	BRD-K57476199			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24-,25-,32-/m0/s1	HBVPERRGRWZCML-PGEKDVIVSA-N	590.346820612							106938
BRD-K53681151	LSM-18293		44496458	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22+,23+,27-/m1/s1	MTZUJVYQNWSRMQ-GRSOWLQASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K53681151	BRD-K53681151-001-01-3	Broad Institute of MIT and Harvard	BRD-K53681151			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22+,23+,27-/m1/s1	MTZUJVYQNWSRMQ-GRSOWLQASA-N	598.34002067							106939
BRD-K57616143	LSM-18294		44618654	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24-,25+,31-/m1/s1	HLAXWBUNQRUQJP-RXDUGQIKSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)N(C)C)cc1	BroadT	BRD-K57616143	BRD-K57616143-001-01-6	Broad Institute of MIT and Harvard	BRD-K57616143			COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)N(C)C)cc1	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24-,25+,31-/m1/s1	HLAXWBUNQRUQJP-RXDUGQIKSA-N	555.367221698							106940
BRD-K50712773	LSM-18295		44495979	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20+,21+,25-/m1/s1	IUWUHICBQVKRRR-IZZGNVEXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K50712773	BRD-K50712773-001-01-7	Broad Institute of MIT and Harvard	BRD-K50712773			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20+,21+,25-/m1/s1	IUWUHICBQVKRRR-IZZGNVEXSA-N	559.323306138							106941
BRD-K41774018	LSM-18296		44487532	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25+,30+/m1/s1	OPCOPDBCCFUTHV-DUXAABNJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K41774018	BRD-K41774018-001-01-4	Broad Institute of MIT and Harvard	BRD-K41774018			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25+,30+/m1/s1	OPCOPDBCCFUTHV-DUXAABNJSA-N	525.356657014							106942
BRD-K40264914	LSM-18297		44498180	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24-/m1/s1	ORDOAKKGIRZCMJ-ZBNTXBBCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K40264914	BRD-K40264914-001-01-2	Broad Institute of MIT and Harvard	BRD-K40264914			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24-/m1/s1	ORDOAKKGIRZCMJ-ZBNTXBBCSA-N	513.287256816							106943
BRD-K49461735	LSM-18298		44489909	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28-,33+/m1/s1	YHPMBPSGDQLXHP-NPJKBUODSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K49461735	BRD-K49461735-001-01-2	Broad Institute of MIT and Harvard	BRD-K49461735			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28-,33+/m1/s1	YHPMBPSGDQLXHP-NPJKBUODSA-N	610.409420868							106944
BRD-K46401069	LSM-18299		44502309	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20+,24+/m0/s1	ZPGALQDMRVAORJ-UECWXEIQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K46401069	BRD-K46401069-001-01-7	Broad Institute of MIT and Harvard	BRD-K46401069			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20+,24+/m0/s1	ZPGALQDMRVAORJ-UECWXEIQSA-N	609.269556004							106945
BRD-K47052171	LSM-18300		44620038	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19-,23-/m1/s1	QBUCHBBMZJBUJI-FZONSQQESA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K47052171	BRD-K47052171-001-01-2	Broad Institute of MIT and Harvard	BRD-K47052171			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19-,23-/m1/s1	QBUCHBBMZJBUJI-FZONSQQESA-N	531.29200601							106946
BRD-K50081142	LSM-18301		44502975	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22+,27+/m0/s1	HLGABPGRBQKPOU-HRGDABNKSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K50081142	BRD-K50081142-001-01-1	Broad Institute of MIT and Harvard	BRD-K50081142			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22+,27+/m0/s1	HLGABPGRBQKPOU-HRGDABNKSA-N	532.362470676							106947
BRD-K56241426	LSM-18302		44500873	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22+,23+,28-/m0/s1	NMRMJZSCUHLPQY-FPZRTEDSSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)CC3CC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K56241426	BRD-K56241426-001-01-2	Broad Institute of MIT and Harvard	BRD-K56241426			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)CC3CC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22+,23+,28-/m0/s1	NMRMJZSCUHLPQY-FPZRTEDSSA-N	546.37812074							106948
BRD-K45874102	LSM-18303		44483945	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22-,28-/m0/s1	DYIGNVBEUCFAEB-QBMQIYCRSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K45874102	BRD-K45874102-001-01-5	Broad Institute of MIT and Harvard	BRD-K45874102			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22-,28-/m0/s1	DYIGNVBEUCFAEB-QBMQIYCRSA-N	558.321748716							106949
BRD-K56373119	LSM-18304		44486978	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20+,21-,27-/m0/s1	AQPDNHSQVUKPGE-WFQVPWNOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K56373119	BRD-K56373119-001-01-5	Broad Institute of MIT and Harvard	BRD-K56373119			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20+,21-,27-/m0/s1	AQPDNHSQVUKPGE-WFQVPWNOSA-N	573.352634274							106950
BRD-K58728497	LSM-18305		44490314	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23-,24-,29-/m0/s1	OJAAEAMCTGSNOQ-UITIVDIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K58728497	BRD-K58728497-001-01-0	Broad Institute of MIT and Harvard	BRD-K58728497			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23-,24-,29-/m0/s1	OJAAEAMCTGSNOQ-UITIVDIESA-N	575.30290688							106951
BRD-K48407125	LSM-18306		44498228	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18+,19+,25+/m1/s1	OIOMLIQJBPNRTR-USTRSKKPSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K48407125	BRD-K48407125-001-01-4	Broad Institute of MIT and Harvard	BRD-K48407125			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18+,19+,25+/m1/s1	OIOMLIQJBPNRTR-USTRSKKPSA-N	545.321334146							106952
BRD-K49208610	LSM-18307		44618945	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33+/m1/s1	FHYFYPZRCDKSKV-XJVVAVADSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K49208610	BRD-K49208610-001-01-7	Broad Institute of MIT and Harvard	BRD-K49208610			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33+/m1/s1	FHYFYPZRCDKSKV-XJVVAVADSA-N	608.393770804							106953
BRD-K41562445	LSM-18308		44493586	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20-,26-/m0/s1	YDWJBUOXSRVMJV-AHCFMSJYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C1=O	BroadT	BRD-K41562445	BRD-K41562445-001-01-6	Broad Institute of MIT and Harvard	BRD-K41562445			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20-,26-/m0/s1	YDWJBUOXSRVMJV-AHCFMSJYSA-N	559.33698421							106954
BRD-K52339692	LSM-18309		44494541	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22+,28+/m1/s1	GOBHPVUGCFRQAG-VYZXROPESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	BroadT	BRD-K52339692	BRD-K52339692-001-01-5	Broad Institute of MIT and Harvard	BRD-K52339692			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22+,28+/m1/s1	GOBHPVUGCFRQAG-VYZXROPESA-N	595.248284494							106955
BRD-K51937785	LSM-18310		44489734	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24+,29-/m0/s1	SEDRIVHSDUVLLE-SEAFADMZSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K51937785	BRD-K51937785-001-01-5	Broad Institute of MIT and Harvard	BRD-K51937785			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24+,29-/m0/s1	SEDRIVHSDUVLLE-SEAFADMZSA-N	597.352634274							106956
BRD-K44430448	LSM-18311		54614810	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28+/m0/s1	KDWFAOIYLGHTDK-KJZXJLKKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	BroadT	BRD-K44430448	BRD-K44430448-001-01-0	Broad Institute of MIT and Harvard	BRD-K44430448			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28+/m0/s1	KDWFAOIYLGHTDK-KJZXJLKKSA-N	579.277834984							106957
BRD-K52595962	LSM-18312		44496418	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22-,23+,28-/m0/s1	BJJOMMAJAORXGV-QKFCCHLXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K52595962	BRD-K52595962-001-01-5	Broad Institute of MIT and Harvard	BRD-K52595962			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22-,23+,28-/m0/s1	BJJOMMAJAORXGV-QKFCCHLXSA-N	595.329121628							106958
BRD-K44481920	LSM-18313		44620171	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24-/m1/s1	ORDOAKKGIRZCMJ-DBYOASNMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K44481920	BRD-K44481920-001-01-0	Broad Institute of MIT and Harvard	BRD-K44481920			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24-/m1/s1	ORDOAKKGIRZCMJ-DBYOASNMSA-N	513.287256816							106959
BRD-K48266244	LSM-18314		44494598	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25-,30+/m1/s1	OMPYFAIFRLVIFJ-GBRARVNLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K48266244	BRD-K48266244-001-01-0	Broad Institute of MIT and Harvard	BRD-K48266244			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25-,30+/m1/s1	OMPYFAIFRLVIFJ-GBRARVNLSA-N	621.338956202							106960
BRD-K55238630	LSM-18315		54614832	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23+,28-/m0/s1	DKJIIKWCTXJSNY-QKFCCHLXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K55238630	BRD-K55238630-001-01-1	Broad Institute of MIT and Harvard	BRD-K55238630			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23+,28-/m0/s1	DKJIIKWCTXJSNY-QKFCCHLXSA-N	561.287256816							106961
BRD-K56520129	LSM-18316		44502300	InChI=1S/C32H47FN4O5/c1-6-16-36(5)20-30-22(2)19-37(23(3)21-38)31(39)28-18-27(35-32(40)34-26-12-10-25(33)11-13-26)14-15-29(28)42-24(4)9-7-8-17-41-30/h10-15,18,22-24,30,38H,6-9,16-17,19-21H2,1-5H3,(H2,34,35,40)/t22-,23+,24+,30+/m0/s1	ZDZLFJDSEKLXNO-QXFFIUSXSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K56520129	BRD-K56520129-001-01-9	Broad Institute of MIT and Harvard	BRD-K56520129			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H47FN4O5/c1-6-16-36(5)20-30-22(2)19-37(23(3)21-38)31(39)28-18-27(35-32(40)34-26-12-10-25(33)11-13-26)14-15-29(28)42-24(4)9-7-8-17-41-30/h10-15,18,22-24,30,38H,6-9,16-17,19-21H2,1-5H3,(H2,34,35,40)/t22-,23+,24+,30+/m0/s1	ZDZLFJDSEKLXNO-QXFFIUSXSA-N	586.353048844							106962
BRD-K42439884	LSM-18317		44504712	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33+/m0/s1	NGSMHOKAGHIENU-ZJXZHUIYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K42439884	BRD-K42439884-001-01-4	Broad Institute of MIT and Harvard	BRD-K42439884			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33+/m0/s1	NGSMHOKAGHIENU-ZJXZHUIYSA-N	623.404669846001							106963
BRD-K47762331	LSM-18318		44616336	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29-/m0/s1	LZRQCLPDICKWHD-OJNHJINQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K47762331	BRD-K47762331-001-01-3	Broad Institute of MIT and Harvard	BRD-K47762331			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29-/m0/s1	LZRQCLPDICKWHD-OJNHJINQSA-N	609.263934558							106964
BRD-K46293468	LSM-18319		44487012	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22+,27-/m1/s1	FBKKOHUHBUWDTB-VZUSRKGYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K46293468	BRD-K46293468-001-01-5	Broad Institute of MIT and Harvard	BRD-K46293468			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22+,27-/m1/s1	FBKKOHUHBUWDTB-VZUSRKGYSA-N	526.315520484							106965
BRD-K47802551	LSM-6123		44487032	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24-,25+,31-/m1/s1	ZZWVGKUDLRNMBI-RXDUGQIKSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K47802551	BRD-K47802551-001-01-0	Broad Institute of MIT and Harvard	BRD-K47802551			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24-,25+,31-/m1/s1	ZZWVGKUDLRNMBI-RXDUGQIKSA-N	619.329121628							94904
BRD-K41517267	LSM-18320		54614800	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29-/m1/s1	IMDGVULVCKQBDZ-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K41517267	BRD-K41517267-001-01-5	Broad Institute of MIT and Harvard	BRD-K41517267			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29-/m1/s1	IMDGVULVCKQBDZ-CDLOMYRSSA-N	539.33592157							106966
BRD-K41172555	LSM-18321		44497332	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30+/m0/s1	DXYWKCBATINIRK-YDXRHMNESA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K41172555	BRD-K41172555-001-01-0	Broad Institute of MIT and Harvard	BRD-K41172555			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30+/m0/s1	DXYWKCBATINIRK-YDXRHMNESA-N	596.357385296							106967
BRD-K54236126	LSM-18322		44616417	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27+/m1/s1	OPIQAKQROYPQNZ-CVWKGPCHSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K54236126	BRD-K54236126-001-01-7	Broad Institute of MIT and Harvard	BRD-K54236126			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27+/m1/s1	OPIQAKQROYPQNZ-CVWKGPCHSA-N	565.26218492							106968
BRD-K50445566	LSM-18323		54614827	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23-,24+,30+/m0/s1	IYJPIDGCXVWPNR-GBXOJDCZSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C)cc1	BroadT	BRD-K50445566	BRD-K50445566-001-01-5	Broad Institute of MIT and Harvard	BRD-K50445566			COc1ccc(NC(=O)N(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C)cc1	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23-,24+,30+/m0/s1	IYJPIDGCXVWPNR-GBXOJDCZSA-N	584.357385296							106969
BRD-K56107062	LSM-18324		44493588	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25-,30-/m0/s1	OMPYFAIFRLVIFJ-SODQHWRNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K56107062	BRD-K56107062-001-01-4	Broad Institute of MIT and Harvard	BRD-K56107062			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25-,30-/m0/s1	OMPYFAIFRLVIFJ-SODQHWRNSA-N	621.338956202							106970
BRD-K42654859	LSM-18325		54614803	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29-/m1/s1	YZLWJGCKUGDXHR-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K42654859	BRD-K42654859-001-01-9	Broad Institute of MIT and Harvard	BRD-K42654859			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29-/m1/s1	YZLWJGCKUGDXHR-CDLOMYRSSA-N	560.393770804							106971
BRD-K43324262	LSM-18326		54614808	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27-,28-,34+/m0/s1	NYAGJJIVOVZRJD-RRRPKEFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K43324262	BRD-K43324262-001-01-9	Broad Institute of MIT and Harvard	BRD-K43324262			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27-,28-,34+/m0/s1	NYAGJJIVOVZRJD-RRRPKEFSSA-N	616.362470676							106972
BRD-K43610632	LSM-18327		44619145	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23+,28-/m1/s1	SKZBTEBCBLPBIZ-YFUNBVQMSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K43610632	BRD-K43610632-001-01-4	Broad Institute of MIT and Harvard	BRD-K43610632			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23+,28-/m1/s1	SKZBTEBCBLPBIZ-YFUNBVQMSA-N	561.287256816							106973
BRD-K52254237	LSM-18328		44618067	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24-,25+,30+/m1/s1	HYZLHQOJAWWHRH-ZRIOWSNCSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K52254237	BRD-K52254237-001-01-8	Broad Institute of MIT and Harvard	BRD-K52254237			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24-,25+,30+/m1/s1	HYZLHQOJAWWHRH-ZRIOWSNCSA-N	589.318556944							106974
BRD-K52796804	LSM-18329		44494601	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19-,20-,26+/m1/s1	YDWJBUOXSRVMJV-APWUBMLTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C1=O	BroadT	BRD-K52796804	BRD-K52796804-001-01-1	Broad Institute of MIT and Harvard	BRD-K52796804			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19-,20-,26+/m1/s1	YDWJBUOXSRVMJV-APWUBMLTSA-N	559.33698421							106975
BRD-K46095779	LSM-18330		54614817	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22-,23-,29+/m1/s1	QSYAMXVABCSWEP-OFKKAEEBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K46095779	BRD-K46095779-001-01-8	Broad Institute of MIT and Harvard	BRD-K46095779			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22-,23-,29+/m1/s1	QSYAMXVABCSWEP-OFKKAEEBSA-N	622.33420518							106976
BRD-K47756270	LSM-18331		44617005	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21-,28-/m1/s1	DZFCVSNNMFSZPA-FLUXDKCESA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K47756270	BRD-K47756270-001-01-8	Broad Institute of MIT and Harvard	BRD-K47756270			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21-,28-/m1/s1	DZFCVSNNMFSZPA-FLUXDKCESA-N	570.305349724							106977
BRD-K45282594	LSM-18332		44498593	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24+,25-,29-/m1/s1	NSUWFWDPIIGHAU-MNGFJMBLSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K45282594	BRD-K45282594-001-01-6	Broad Institute of MIT and Harvard	BRD-K45282594			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24+,25-,29-/m1/s1	NSUWFWDPIIGHAU-MNGFJMBLSA-N	562.409420868							106978
BRD-K49673270	LSM-18333		44485812	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,28+/m0/s1	BRKIAEBRDYHMFE-KKQCDPINSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K49673270	BRD-K49673270-001-01-3	Broad Institute of MIT and Harvard	BRD-K49673270			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,28+/m0/s1	BRKIAEBRDYHMFE-KKQCDPINSA-N	540.331170548							106979
BRD-K53291208	LSM-18334		44618882	InChI=1S/C26H45N3O6S/c1-7-13-28(5)17-25-19(2)16-29(20(3)18-30)26(31)23-15-22(27-36(6,32)33)11-12-24(23)35-21(4)10-8-9-14-34-25/h11-12,15,19-21,25,27,30H,7-10,13-14,16-18H2,1-6H3/t19-,20-,21+,25-/m0/s1	ZOEMVRGQCOXOOR-HULNYRCFSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K53291208	BRD-K53291208-001-01-4	Broad Institute of MIT and Harvard	BRD-K53291208			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H45N3O6S/c1-7-13-28(5)17-25-19(2)16-29(20(3)18-30)26(31)23-15-22(27-36(6,32)33)11-12-24(23)35-21(4)10-8-9-14-34-25/h11-12,15,19-21,25,27,30H,7-10,13-14,16-18H2,1-6H3/t19-,20-,21+,25-/m0/s1	ZOEMVRGQCOXOOR-HULNYRCFSA-N	527.30290688							106980
BRD-K39573478	LSM-18335		44490469	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22-,27+/m1/s1	HNFJEPMYRFFBAZ-RKGZYEPBSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K39573478	BRD-K39573478-001-01-7	Broad Institute of MIT and Harvard	BRD-K39573478			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22-,27+/m1/s1	HNFJEPMYRFFBAZ-RKGZYEPBSA-N	526.315520484							106981
BRD-K41412255	LSM-18336		54614799	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30-/m1/s1	DXYWKCBATINIRK-FJRSXGRASA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K41412255	BRD-K41412255-001-01-3	Broad Institute of MIT and Harvard	BRD-K41412255			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30-/m1/s1	DXYWKCBATINIRK-FJRSXGRASA-N	596.357385296							106982
BRD-K56590597	LSM-18337		44494908	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24+,29+/m0/s1	OJAAEAMCTGSNOQ-CMSZEEODSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K56590597	BRD-K56590597-001-01-5	Broad Institute of MIT and Harvard	BRD-K56590597			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24+,29+/m0/s1	OJAAEAMCTGSNOQ-CMSZEEODSA-N	575.30290688							106983
BRD-K42964952	LSM-18338		54614804	InChI=1S/C33H50N4O6/c1-7-17-36(5)21-31-23(2)20-37(24(3)22-38)32(39)29-19-27(13-16-30(29)43-25(4)10-8-9-18-42-31)35-33(40)34-26-11-14-28(41-6)15-12-26/h11-16,19,23-25,31,38H,7-10,17-18,20-22H2,1-6H3,(H2,34,35,40)/t23-,24+,25+,31+/m0/s1	QAGMOHWNXLCFPJ-DTTPJGKXSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K42964952	BRD-K42964952-001-01-8	Broad Institute of MIT and Harvard	BRD-K42964952			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H50N4O6/c1-7-17-36(5)21-31-23(2)20-37(24(3)22-38)32(39)29-19-27(13-16-30(29)43-25(4)10-8-9-18-42-31)35-33(40)34-26-11-14-28(41-6)15-12-26/h11-16,19,23-25,31,38H,7-10,17-18,20-22H2,1-6H3,(H2,34,35,40)/t23-,24+,25+,31+/m0/s1	QAGMOHWNXLCFPJ-DTTPJGKXSA-N	598.37303536							106984
BRD-K39397248	LSM-18339		54614793	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20+,21-,27+/m1/s1	JTLOVMZMVDHICP-RBZJZWSTSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K39397248	BRD-K39397248-001-01-0	Broad Institute of MIT and Harvard	BRD-K39397248			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20+,21-,27+/m1/s1	JTLOVMZMVDHICP-RBZJZWSTSA-N	594.302905052							106985
BRD-K43654313	LSM-18340		54614809	InChI=1S/C32H54N4O5/c1-6-17-35(5)21-30-23(2)20-36(24(3)22-37)31(38)28-19-27(34-32(39)33-26-13-8-7-9-14-26)15-16-29(28)41-25(4)12-10-11-18-40-30/h15-16,19,23-26,30,37H,6-14,17-18,20-22H2,1-5H3,(H2,33,34,39)/t23-,24+,25+,30-/m1/s1	DKJNEIWLBYXYNW-UBRKHCEVSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K43654313	BRD-K43654313-001-01-8	Broad Institute of MIT and Harvard	BRD-K43654313			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H54N4O5/c1-6-17-35(5)21-30-23(2)20-36(24(3)22-37)31(38)28-19-27(34-32(39)33-26-13-8-7-9-14-26)15-16-29(28)41-25(4)12-10-11-18-40-30/h15-16,19,23-26,30,37H,6-14,17-18,20-22H2,1-5H3,(H2,33,34,39)/t23-,24+,25+,30-/m1/s1	DKJNEIWLBYXYNW-UBRKHCEVSA-N	574.409420868							106986
CHEMBL2359525	LSM-18341	BRD-K51454923, SID85797502	44490876	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21-,22-,28-/m0/s1	GMYAYTAKTSTYEI-STFWXSJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	BroadT	BRD-K51454923	BRD-K51454923-001-01-4	Broad Institute of MIT and Harvard	BRD-K51454923			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21-,22-,28-/m0/s1	GMYAYTAKTSTYEI-STFWXSJUSA-N	608.318555116							106987
BRD-K43775480	LSM-18342		44617903	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18+,22+/m0/s1	GOTBAIXNEHVFNA-VDVULAQNSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K43775480	BRD-K43775480-001-01-8	Broad Institute of MIT and Harvard	BRD-K43775480			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18+,22+/m0/s1	GOTBAIXNEHVFNA-VDVULAQNSA-N	485.255956688							106988
BRD-K40241022	LSM-18343		44490376	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22+,29+/m1/s1	BFYBBBSDVFDXJC-VRUYNSFCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	BroadT	BRD-K40241022	BRD-K40241022-001-01-9	Broad Institute of MIT and Harvard	BRD-K40241022			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22+,29+/m1/s1	BFYBBBSDVFDXJC-VRUYNSFCSA-N	584.320999788							106989
BRD-K43729445	LSM-18344		44484576	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19-,20+,24-/m0/s1	LBVOXJOHMPITGR-KTIHBUSBSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K43729445	BRD-K43729445-001-01-9	Broad Institute of MIT and Harvard	BRD-K43729445			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19-,20+,24-/m0/s1	LBVOXJOHMPITGR-KTIHBUSBSA-N	609.269556004							106990
BRD-K53548389	LSM-18345		49843017	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27+/m1/s1	OPIQAKQROYPQNZ-GMAGDTKFSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K53548389	BRD-K53548389-001-01-8	Broad Institute of MIT and Harvard	BRD-K53548389			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27+/m1/s1	OPIQAKQROYPQNZ-GMAGDTKFSA-N	565.26218492							106991
BRD-K44445002	LSM-18346		44619963	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29+/m1/s1	MEJMTXOOFVGIJM-MBWUYLOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K44445002	BRD-K44445002-001-01-6	Broad Institute of MIT and Harvard	BRD-K44445002			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29+/m1/s1	MEJMTXOOFVGIJM-MBWUYLOXSA-N	593.293485048							106992
MLS003128759	LSM-10971	BRD-K41866979, SID99358990	44497202	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22+,26-/m0/s1	UJYZNBPSVBHVBP-BOCITWAFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K41866979	BRD-K41866979-001-01-5	Broad Institute of MIT and Harvard	BRD-K41866979			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22+,26-/m0/s1	UJYZNBPSVBHVBP-BOCITWAFSA-N	579.3090549							99592
BRD-K49662642	LSM-18347		44489705	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22+,27+/m0/s1	FBKKOHUHBUWDTB-HRGDABNKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K49662642	BRD-K49662642-001-01-7	Broad Institute of MIT and Harvard	BRD-K49662642			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22+,27+/m0/s1	FBKKOHUHBUWDTB-HRGDABNKSA-N	526.315520484							106993
BRD-K54079231	LSM-18348		44617252	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23-,29-/m1/s1	QSYAMXVABCSWEP-CPVANYHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K54079231	BRD-K54079231-001-01-3	Broad Institute of MIT and Harvard	BRD-K54079231			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23-,29-/m1/s1	QSYAMXVABCSWEP-CPVANYHMSA-N	622.33420518							106994
BRD-K44834268	LSM-18349		44490441	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22+,27+/m1/s1	HNFJEPMYRFFBAZ-YHZQYDDPSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K44834268	BRD-K44834268-001-01-0	Broad Institute of MIT and Harvard	BRD-K44834268			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21-,22+,27+/m1/s1	HNFJEPMYRFFBAZ-YHZQYDDPSA-N	526.315520484							106995
BRD-K49375456	LSM-18350		44503709	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22+,28-/m0/s1	MPJVZFHLUPPQBG-WBJWTPEXSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K49375456	BRD-K49375456-001-01-1	Broad Institute of MIT and Harvard	BRD-K49375456			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22+,28-/m0/s1	MPJVZFHLUPPQBG-WBJWTPEXSA-N	577.282171436							106996
BRD-K45620289	LSM-18351		44618631	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m0/s1	XHZKQAVNDGMQPU-KYALDGGBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K45620289	BRD-K45620289-001-01-7	Broad Institute of MIT and Harvard	BRD-K45620289			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m0/s1	XHZKQAVNDGMQPU-KYALDGGBSA-N	589.282171436							106997
BRD-K45845217	LSM-18352		54614816	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26+,27+,32-/m1/s1	ZMTJRORPEDZKCY-JVPIYLDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K45845217	BRD-K45845217-001-01-7	Broad Institute of MIT and Harvard	BRD-K45845217			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26+,27+,32-/m1/s1	ZMTJRORPEDZKCY-JVPIYLDOSA-N	624.388685424							106998
BRD-K43051162	LSM-18353		44490900	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20-,21-,25+/m0/s1	IUWUHICBQVKRRR-AIFLQVKLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K43051162	BRD-K43051162-001-01-9	Broad Institute of MIT and Harvard	BRD-K43051162			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20-,21-,25+/m0/s1	IUWUHICBQVKRRR-AIFLQVKLSA-N	559.323306138							106999
BRD-K42971210	LSM-18354		44620261	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23+,24-,29-/m0/s1	MOSVBDAIGOGSPE-MVPDCNEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K42971210	BRD-K42971210-001-01-1	Broad Institute of MIT and Harvard	BRD-K42971210			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23+,24-,29-/m0/s1	MOSVBDAIGOGSPE-MVPDCNEZSA-N	581.349857072							107000
BRD-K55256232	LSM-18355		44490316	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25-,30-/m0/s1	OMPYFAIFRLVIFJ-XZSZPMDUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K55256232	BRD-K55256232-001-01-5	Broad Institute of MIT and Harvard	BRD-K55256232			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24-,25-,30-/m0/s1	OMPYFAIFRLVIFJ-XZSZPMDUSA-N	621.338956202							107001
BRD-K45516283	LSM-18356		44620491	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24+,29+/m1/s1	CWMFJYTZROJEEY-CHCBTGSZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K45516283	BRD-K45516283-001-01-3	Broad Institute of MIT and Harvard	BRD-K45516283			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24+,29+/m1/s1	CWMFJYTZROJEEY-CHCBTGSZSA-N	622.33420518							107002
BRD-K42455150	LSM-18357		44619587	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28+/m1/s1	KDWFAOIYLGHTDK-KUMFRPPMSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	BroadT	BRD-K42455150	BRD-K42455150-001-01-7	Broad Institute of MIT and Harvard	BRD-K42455150			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28+/m1/s1	KDWFAOIYLGHTDK-KUMFRPPMSA-N	579.277834984							107003
MLS003130361	LSM-10947	BRD-K41526317, SID99359247	44501790	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29-/m0/s1	IMDGVULVCKQBDZ-SEAFADMZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K41526317	BRD-K41526317-001-01-6	Broad Institute of MIT and Harvard	BRD-K41526317			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29-/m0/s1	IMDGVULVCKQBDZ-SEAFADMZSA-N	539.33592157							99568
BRD-K41939184	LSM-18358		54614801	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33+/m0/s1	NGSMHOKAGHIENU-SQQWPVGBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K41939184	BRD-K41939184-001-01-1	Broad Institute of MIT and Harvard	BRD-K41939184			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33+/m0/s1	NGSMHOKAGHIENU-SQQWPVGBSA-N	623.404669846001							107004
BRD-K55144248	LSM-18359		44494559	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29+/m1/s1	GPFIDTWNGXWRJK-HZTMJRFTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K55144248	BRD-K55144248-001-01-5	Broad Institute of MIT and Harvard	BRD-K55144248			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29+/m1/s1	GPFIDTWNGXWRJK-HZTMJRFTSA-N	575.30290688							107005
BRD-K49132774	LSM-18360		44617096	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33-/m0/s1	FHYFYPZRCDKSKV-KIAQLKRMSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K49132774	BRD-K49132774-001-01-1	Broad Institute of MIT and Harvard	BRD-K49132774			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33-/m0/s1	FHYFYPZRCDKSKV-KIAQLKRMSA-N	608.393770804							107006
BRD-K48727830	LSM-18361		54614822	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33-/m0/s1	NGSMHOKAGHIENU-IZPIQJOWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K48727830	BRD-K48727830-001-01-1	Broad Institute of MIT and Harvard	BRD-K48727830			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33-/m0/s1	NGSMHOKAGHIENU-IZPIQJOWSA-N	623.404669846001							107007
BRD-K43992442	LSM-18362		49843159	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33+/m1/s1	LFCBJIZGBQWHQM-XJVVAVADSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K43992442	BRD-K43992442-001-01-6	Broad Institute of MIT and Harvard	BRD-K43992442			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33+/m1/s1	LFCBJIZGBQWHQM-XJVVAVADSA-N	602.346820612							107008
MLS003128706	LSM-11950	BRD-K58381953, SID99358948	44489694	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26+,33+/m0/s1	UBYZDEGPUXBRQE-GJFGOQOUSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K58381953	BRD-K58381953-001-01-5	Broad Institute of MIT and Harvard	BRD-K58381953			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26+,33+/m0/s1	UBYZDEGPUXBRQE-GJFGOQOUSA-N	604.362470676							100576
BRD-K57687960	LSM-18363		54614838	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m1/s1	OQPYQZIBKYAWRE-VUKRRIEASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K57687960	BRD-K57687960-001-01-7	Broad Institute of MIT and Harvard	BRD-K57687960			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m1/s1	OQPYQZIBKYAWRE-VUKRRIEASA-N	622.37303536							107009
BRD-K46162352	LSM-18364		44618535	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33-/m1/s1	NGSMHOKAGHIENU-BXWHCVCYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K46162352	BRD-K46162352-001-01-1	Broad Institute of MIT and Harvard	BRD-K46162352			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33-/m1/s1	NGSMHOKAGHIENU-BXWHCVCYSA-N	623.404669846001							107010
BRD-K47577519	LSM-18365		44489865	InChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16+,17-,21-/m1/s1	XRGBJGDCXQTJDT-KYFSNAEOSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(N)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K47577519	BRD-K47577519-001-01-9	Broad Institute of MIT and Harvard	BRD-K47577519			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(N)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16+,17-,21-/m1/s1	XRGBJGDCXQTJDT-KYFSNAEOSA-N	407.278406694							107011
BRD-K47456901	LSM-18366		44619530	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32-/m1/s1	OQPYQZIBKYAWRE-WRZBRUQPSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K47456901	BRD-K47456901-001-01-2	Broad Institute of MIT and Harvard	BRD-K47456901			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32-/m1/s1	OQPYQZIBKYAWRE-WRZBRUQPSA-N	622.37303536							107012
BRD-K41135617-001-01-3	LSM-18367	BRD-K41135617	44495024	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23+,24+,29+/m1/s1	VOOFHSDUWYITSP-MSCBGTKOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K41135617	BRD-K41135617-001-01-3	Broad Institute of MIT and Harvard	BRD-K41135617			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23+,24+,29+/m1/s1	VOOFHSDUWYITSP-MSCBGTKOSA-N	603.2978215							107013
BRD-K52245873	LSM-18368		44492604	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19-,20+,26-/m0/s1	YDWJBUOXSRVMJV-FDTRYVBHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C1=O	BroadT	BRD-K52245873	BRD-K52245873-001-01-5	Broad Institute of MIT and Harvard	BRD-K52245873			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19-,20+,26-/m0/s1	YDWJBUOXSRVMJV-FDTRYVBHSA-N	559.33698421							107014
BRD-K47309161	LSM-18369		44619198	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28+/m1/s1	DKJIIKWCTXJSNY-KRHPZPPWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K47309161	BRD-K47309161-001-01-8	Broad Institute of MIT and Harvard	BRD-K47309161			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28+/m1/s1	DKJIIKWCTXJSNY-KRHPZPPWSA-N	561.287256816							107015
BRD-K56341841	LSM-18370		44620664	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24+,29-/m1/s1	YZLWJGCKUGDXHR-CAFXQFFASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K56341841	BRD-K56341841-001-01-7	Broad Institute of MIT and Harvard	BRD-K56341841			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24+,29-/m1/s1	YZLWJGCKUGDXHR-CAFXQFFASA-N	560.393770804							107016
BRD-K54028343	LSM-18371		44504568	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27+/m0/s1	WPSSTONNMATWEF-ZAACQVCWSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K54028343	BRD-K54028343-001-01-5	Broad Institute of MIT and Harvard	BRD-K54028343			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27+/m0/s1	WPSSTONNMATWEF-ZAACQVCWSA-N	581.23263443							107017
BRD-K49675259	LSM-18372		44490328	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22+,26+/m0/s1	ANVCKVJMNHXGBG-BTKWVRSESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K49675259	BRD-K49675259-001-01-3	Broad Institute of MIT and Harvard	BRD-K49675259			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22+,26+/m0/s1	ANVCKVJMNHXGBG-BTKWVRSESA-N	581.259327506							107018
BRD-K42968343	LSM-18373		54614805	InChI=1S/C31H47N3O6S/c1-6-17-33(5)21-30-23(2)20-34(24(3)22-35)31(36)28-19-26(32-41(37,38)27-13-8-7-9-14-27)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,32,35H,6,10-12,17-18,20-22H2,1-5H3/t23-,24-,25+,30-/m1/s1	ZAMGSALMCFAIEX-ZASNTINBSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K42968343	BRD-K42968343-001-01-7	Broad Institute of MIT and Harvard	BRD-K42968343			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C31H47N3O6S/c1-6-17-33(5)21-30-23(2)20-34(24(3)22-35)31(36)28-19-26(32-41(37,38)27-13-8-7-9-14-27)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,32,35H,6,10-12,17-18,20-22H2,1-5H3/t23-,24-,25+,30-/m1/s1	ZAMGSALMCFAIEX-ZASNTINBSA-N	589.318556944							107019
BRD-K58412301	LSM-18374		54614841	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18-,22+/m1/s1	GOTBAIXNEHVFNA-IDVKNYFZSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K58412301	BRD-K58412301-001-01-7	Broad Institute of MIT and Harvard	BRD-K58412301			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18-,22+/m1/s1	GOTBAIXNEHVFNA-IDVKNYFZSA-N	485.255956688							107020
BRD-K45635721	LSM-18375		54614815	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33-/m1/s1	NGSMHOKAGHIENU-JIXXDEQJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K45635721	BRD-K45635721-001-01-1	Broad Institute of MIT and Harvard	BRD-K45635721			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33-/m1/s1	NGSMHOKAGHIENU-JIXXDEQJSA-N	623.404669846001							107021
BRD-K57195030	LSM-18376		44620567	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23-,24-,30+/m0/s1	IYJPIDGCXVWPNR-ZUHGBKBGSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C)cc1	BroadT	BRD-K57195030	BRD-K57195030-001-01-7	Broad Institute of MIT and Harvard	BRD-K57195030			COc1ccc(NC(=O)N(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C)cc1	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23-,24-,30+/m0/s1	IYJPIDGCXVWPNR-ZUHGBKBGSA-N	584.357385296							107022
BRD-K41116634	LSM-18377		54614798	InChI=1S/C33H49N3O5/c1-6-17-35(5)22-31-24(2)21-36(25(3)23-37)33(39)29-20-28(34-32(38)19-27-13-8-7-9-14-27)15-16-30(29)41-26(4)12-10-11-18-40-31/h7-9,13-16,20,24-26,31,37H,6,10-12,17-19,21-23H2,1-5H3,(H,34,38)/t24-,25-,26-,31-/m0/s1	HWWNGGYYBIBPCQ-VIYORZMQSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K41116634	BRD-K41116634-001-01-2	Broad Institute of MIT and Harvard	BRD-K41116634			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H49N3O5/c1-6-17-35(5)22-31-24(2)21-36(25(3)23-37)33(39)29-20-28(34-32(38)19-27-13-8-7-9-14-27)15-16-30(29)41-26(4)12-10-11-18-40-31/h7-9,13-16,20,24-26,31,37H,6,10-12,17-19,21-23H2,1-5H3,(H,34,38)/t24-,25-,26-,31-/m0/s1	HWWNGGYYBIBPCQ-VIYORZMQSA-N	567.367221698							107023
BRD-K50977435	LSM-18378		44617567	InChI=1S/C33H47FN4O5/c1-22-18-38(23(2)21-39)32(40)29-17-28(36-33(41)35-27-12-10-26(34)11-13-27)14-15-30(29)43-24(3)7-5-6-16-42-31(22)20-37(4)19-25-8-9-25/h10-15,17,22-25,31,39H,5-9,16,18-21H2,1-4H3,(H2,35,36,41)/t22-,23+,24+,31+/m1/s1	STYUMYTXFXXJJW-WIZGYELTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc3C1=O	BroadT	BRD-K50977435	BRD-K50977435-001-01-6	Broad Institute of MIT and Harvard	BRD-K50977435			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C33H47FN4O5/c1-22-18-38(23(2)21-39)32(40)29-17-28(36-33(41)35-27-12-10-26(34)11-13-27)14-15-30(29)43-24(3)7-5-6-16-42-31(22)20-37(4)19-25-8-9-25/h10-15,17,22-25,31,39H,5-9,16,18-21H2,1-4H3,(H2,35,36,41)/t22-,23+,24+,31+/m1/s1	STYUMYTXFXXJJW-WIZGYELTSA-N	598.353048844							107024
CHEMBL2142935	LSM-6808	BRD3351, SID104170370, SD-6-035-B2	49843144	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24+,31-/m1/s1	WIYHORLWMFSPCL-FILQNJKGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K48703351	BRD-K48703351-001-01-1	Broad Institute of MIT and Harvard	BRD-K48703351			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24+,31-/m1/s1	WIYHORLWMFSPCL-FILQNJKGSA-N	569.346486254							95429
BRD-K58977196	LSM-18379		44504485	InChI=1S/C31H49N5O6/c1-8-14-35(7)18-28-20(2)17-36(21(3)19-37)30(38)26-16-25(32-31(39)33-29-23(5)34-42-24(29)6)12-13-27(26)41-22(4)11-9-10-15-40-28/h12-13,16,20-22,28,37H,8-11,14-15,17-19H2,1-7H3,(H2,32,33,39)/t20-,21+,22+,28+/m0/s1	WONHJTSKSOPZKP-CLYWQNBRSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K58977196	BRD-K58977196-001-01-7	Broad Institute of MIT and Harvard	BRD-K58977196			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H49N5O6/c1-8-14-35(7)18-28-20(2)17-36(21(3)19-37)30(38)26-16-25(32-31(39)33-29-23(5)34-42-24(29)6)12-13-27(26)41-22(4)11-9-10-15-40-28/h12-13,16,20-22,28,37H,8-11,14-15,17-19H2,1-7H3,(H2,32,33,39)/t20-,21+,22+,28+/m0/s1	WONHJTSKSOPZKP-CLYWQNBRSA-N	587.368284338							107025
CHEMBL2360817	LSM-18380	BRD-K47461610, SID85793939	44487462	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26-,33+/m0/s1	UBYZDEGPUXBRQE-FMALNZMYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K47461610	BRD-K47461610-001-01-4	Broad Institute of MIT and Harvard	BRD-K47461610			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26-,33+/m0/s1	UBYZDEGPUXBRQE-FMALNZMYSA-N	604.362470676							107026
BRD-K56351525	LSM-18381		44493107	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23-,24-,29-/m0/s1	VOOFHSDUWYITSP-UITIVDIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K56351525	BRD-K56351525-001-01-9	Broad Institute of MIT and Harvard	BRD-K56351525			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23-,24-,29-/m0/s1	VOOFHSDUWYITSP-UITIVDIESA-N	603.2978215							107027
BRD-K51061297	LSM-18382		54614828	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22-,23-,29-/m0/s1	PSEUFYCSFOBFBF-VCTIXIOLSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K51061297	BRD-K51061297-001-01-5	Broad Institute of MIT and Harvard	BRD-K51061297			COc1ccc(NC(=O)Nc2ccc3O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22-,23-,29-/m0/s1	PSEUFYCSFOBFBF-VCTIXIOLSA-N	570.341735232							107028
MLS003128831	LSM-11377	BRD-K48465004, SID99359176	44488192	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21+,22+,26-/m1/s1	ANVCKVJMNHXGBG-FYBXHKAZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K48465004	BRD-K48465004-001-01-8	Broad Institute of MIT and Harvard	BRD-K48465004			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21+,22+,26-/m1/s1	ANVCKVJMNHXGBG-FYBXHKAZSA-N	581.259327506							99998
SMR000073061	LSM-18383	SID4258260, BRD-K93142287	892034	InChI=1S/C18H15N3O3/c1-20-13-8-7-12(10-14(13)21(2)18(20)23)19-17(22)16-9-11-5-3-4-6-15(11)24-16/h3-10H,1-2H3,(H,19,22)	NVIHPLVUGWRHEM-UHFFFAOYSA-N	CN1C(=O)N(C)c2cc(NC(=O)c3oc4ccccc4c3)ccc12	BroadT	BRD-K93142287	BRD-K93142287-001-05-6	ChemBridge Corporation	7512908			Cn1c2ccc(NC(=O)c3cc4ccccc4o3)cc2n(C)c1=O	InChI=1S/C18H15N3O3/c1-20-13-8-7-12(10-14(13)21(2)18(20)23)19-17(22)16-9-11-5-3-4-6-15(11)24-16/h3-10H,1-2H3,(H,19,22)	NVIHPLVUGWRHEM-UHFFFAOYSA-N	321.11134137							107029
AC1LDZ3Z	LSM-18384	SID24837086, BRD-K30673737	703756	InChI=1S/C14H14N2O5/c1-2-19-14(18)13-10(17)8-16(15-13)9-3-4-11-12(7-9)21-6-5-20-11/h3-4,7-8,17H,2,5-6H2,1H3	IBFLUSMRXQCEJN-UHFFFAOYSA-N	CCOC(=O)c1nn(cc1O)c2ccc3OCCOc3c2	BroadT	BRD-K30673737	BRD-K30673737-001-05-2	Enamine Ltd.	T0508-2554			CCOC(=O)c1nn(cc1O)-c1ccc2OCCOc2c1	InChI=1S/C14H14N2O5/c1-2-19-14(18)13-10(17)8-16(15-13)9-3-4-11-12(7-9)21-6-5-20-11/h3-4,7-8,17H,2,5-6H2,1H3	IBFLUSMRXQCEJN-UHFFFAOYSA-N	290.090271568							107030
STK108313	LSM-18385	SID47202131, BRD-K45662799	975411	InChI=1S/C13H17NO2S/c1-15-11-7-5-6-10(12(11)16-2)13(17)14-8-3-4-9-14/h5-7H,3-4,8-9H2,1-2H3	WHKMWQRRXMPGCN-UHFFFAOYSA-N	COc1cccc(C(=S)N2CCCC2)c1OC	BroadT	BRD-K45662799	BRD-K45662799-001-05-3	Vitas-M Laboratory Ltd.	STK108313			COc1cccc(C(=S)N2CCCC2)c1OC	InChI=1S/C13H17NO2S/c1-15-11-7-5-6-10(12(11)16-2)13(17)14-8-3-4-9-14/h5-7H,3-4,8-9H2,1-2H3	WHKMWQRRXMPGCN-UHFFFAOYSA-N	251.097999484							107031
Dibenzo[b,f]oxepin-3-amine	LSM-18386	SID24781206, BRD-K07068495	1382017	InChI=1S/C14H11NO/c15-12-8-7-11-6-5-10-3-1-2-4-13(10)16-14(11)9-12/h1-9H,15H2	WPLLFHWVTWVHAF-UHFFFAOYSA-N	Nc1ccc2C=Cc3ccccc3Oc2c1	BroadT	BRD-K07068495	BRD-K07068495-001-06-4	ChemDiv Inc.	8015-8471			Nc1ccc2C=Cc3ccccc3Oc2c1	InChI=1S/C14H11NO/c15-12-8-7-11-6-5-10-3-1-2-4-13(10)16-14(11)9-12/h1-9H,15H2	WPLLFHWVTWVHAF-UHFFFAOYSA-N	209.084063982							107032
AC1MNZRS	LSM-18387	SID24818082, BRD-K83271507	3361189	InChI=1S/C11H10Cl2N6O/c12-7-1-2-8(9(13)3-7)11(20)18-17-10(14)4-19-6-15-5-16-19/h1-3,5-6H,4H2,(H2,14,17)(H,18,20)	VOKJNQXPLXPALN-UHFFFAOYSA-N	Clc1ccc(C(=O)NNC(=N)Cn2cncn2)c(Cl)c1	BroadT	BRD-K83271507	BRD-K83271507-001-06-7	Key Organics Ltd.	3F-028			Clc1ccc(C(=O)NNC(=N)Cn2cncn2)c(Cl)c1	InChI=1S/C11H10Cl2N6O/c12-7-1-2-8(9(13)3-7)11(20)18-17-10(14)4-19-6-15-5-16-19/h1-3,5-6H,4H2,(H2,14,17)(H,18,20)	VOKJNQXPLXPALN-UHFFFAOYSA-N	312.02931442							107033
MLS000102566	LSM-18388	SID7969520, BRD-A68063230	5309995	InChI=1S/C18H20N6O4/c1-27-13-5-2-4-12(8-13)24-17-16(21-22-24)18(26)23(11-20-17)10-15(25)19-9-14-6-3-7-28-14/h2,4-5,8,11,14H,3,6-7,9-10H2,1H3,(H,19,25)	DXOMIXNKOPBQCX-UHFFFAOYSA-N	COc1cccc(c1)n2nnc3C(=O)N(CC(=O)NCC4CCCO4)C=Nc23	BroadT	BRD-A68063230	BRD-A68063230-001-05-5	Life Chemicals Inc.	F0656-1011			COc1cccc(c1)-n1nnc2c1ncn(CC(=O)NCC1CCCO1)c2=O	InChI=1S/C18H20N6O4/c1-27-13-5-2-4-12(8-13)24-17-16(21-22-24)18(26)23(11-20-17)10-15(25)19-9-14-6-3-7-28-14/h2,4-5,8,11,14H,3,6-7,9-10H2,1H3,(H,19,25)	DXOMIXNKOPBQCX-UHFFFAOYSA-N	384.15460318							107034
SMR000064623	LSM-18389	SID3717803, BRD-K36412733	2532198	InChI=1S/C23H21N3O3/c1-16-12-21(17(2)26(16)13-18-6-4-3-5-7-18)22(27)14-28-20-10-8-19(9-11-20)23-25-24-15-29-23/h3-12,15H,13-14H2,1-2H3	SYXAIJGEZLTDRA-UHFFFAOYSA-N	Cc1cc(C(=O)COc2ccc(cc2)c3ocnn3)c(C)n1Cc4ccccc4	BroadT	BRD-K36412733	BRD-K36412733-001-05-3	Enamine Ltd.	T5336095			Cc1cc(C(=O)COc2ccc(cc2)-c2nnco2)c(C)n1Cc1ccccc1	InChI=1S/C23H21N3O3/c1-16-12-21(17(2)26(16)13-18-6-4-3-5-7-18)22(27)14-28-20-10-8-19(9-11-20)23-25-24-15-29-23/h3-12,15H,13-14H2,1-2H3	SYXAIJGEZLTDRA-UHFFFAOYSA-N	387.158291562							107035
CHEMBL589756	LSM-3992	BRD-K89190195	25067492	InChI=1S/C12H12N2O3/c1-8-13-4-5-14(8)7-12(17)9-2-3-10(15)11(16)6-9/h2-6,15-16H,7H2,1H3	KSGAXVJQIURHFA-UHFFFAOYSA-N	Cc1nccn1CC(=O)c2ccc(O)c(O)c2	BroadT	BRD-K89190195	BRD-K89190195-003-05-8	Sanford-Burnham Medical Research Institute	MLS-0315852.0002		Cl	Cc1nccn1CC(=O)c1ccc(O)c(O)c1.Cl	InChI=1S/C12H12N2O3.ClH/c1-8-13-4-5-14(8)7-12(17)9-2-3-10(15)11(16)6-9;/h2-6,15-16H,7H2,1H3;1H	ZAEAQYJISLWWGK-UHFFFAOYSA-N	232.084792264							93555, 93555
AC1NCAAF	LSM-18390	SID7969606, BRD-A36538931	4530637	InChI=1S/C19H18N4O3S2/c1-11-8-15(22-26-11)21-16(24)10-27-19-20-14-9-12(2)28-17(14)18(25)23(19)13-6-4-3-5-7-13/h3-8,12H,9-10H2,1-2H3,(H,21,22,24)	ZPFSICAETXATDG-UHFFFAOYSA-N	CC1CC2=C(S1)C(=O)N(C(=N2)SCC(=O)Nc3cc(C)on3)c4ccccc4	BroadT	BRD-A36538931	BRD-A36538931-001-05-7	Life Chemicals Inc.	F0612-0497			CC1Cc2nc(SCC(=O)Nc3cc(C)on3)n(-c3ccccc3)c(=O)c2S1	InChI=1S/C19H18N4O3S2/c1-11-8-15(22-26-11)21-16(24)10-27-19-20-14-9-12(2)28-17(14)18(25)23(19)13-6-4-3-5-7-13/h3-8,12H,9-10H2,1-2H3,(H,21,22,24)	ZPFSICAETXATDG-UHFFFAOYSA-N	414.082031856							107036
SMR000076772	LSM-18391	SID4263744, BRD-K52000255	2208140	InChI=1S/C22H20N4O3/c1-28-18-11-9-16(10-12-18)14-20(27)26-22(23-15-19-8-5-13-29-19)24-21(25-26)17-6-3-2-4-7-17/h2-13H,14-15H2,1H3,(H,23,24,25)	CJJOUVXDKSMTCH-UHFFFAOYSA-N	COc1ccc(CC(=O)n2nc(nc2NCc3occc3)c4ccccc4)cc1	BroadT	BRD-K52000255	BRD-K52000255-001-05-3	ChemBridge Corporation	7803574			COc1ccc(CC(=O)n2nc(nc2NCc2ccco2)-c2ccccc2)cc1	InChI=1S/C22H20N4O3/c1-28-18-11-9-16(10-12-18)14-20(27)26-22(23-15-19-8-5-13-29-19)24-21(25-26)17-6-3-2-4-7-17/h2-13H,14-15H2,1H3,(H,23,24,25)	CJJOUVXDKSMTCH-UHFFFAOYSA-N	388.15354054							107037
6-Chloro-n-(2-hydroxyphenyl)pyridine-3-sulfonamide	LSM-18392	SID26663364, BRD-K02582347	931771	InChI=1S/C11H9ClN2O3S/c12-11-6-5-8(7-13-11)18(16,17)14-9-3-1-2-4-10(9)15/h1-7,14-15H	ZXNVTQNRWSYAMZ-UHFFFAOYSA-N	Oc1ccccc1NS(=O)(=O)c2ccc(Cl)nc2	BroadT	BRD-K02582347	BRD-K02582347-001-06-9	InterBioScreen Ltd.	STOCK3S-97797			Oc1ccccc1NS(=O)(=O)c1ccc(Cl)nc1	InChI=1S/C11H9ClN2O3S/c12-11-6-5-8(7-13-11)18(16,17)14-9-3-1-2-4-10(9)15/h1-7,14-15H	ZXNVTQNRWSYAMZ-UHFFFAOYSA-N	284.002240568							107038
MLS-0258268.0001	LSM-1866	BRD-A84909344, SID24834514, SID56373762, SID56373837, SID85147381	4879298	InChI=1S/C14H10BrN3O2/c15-8-5-6-10-9(7-8)14(13(19)16-10)18-17-11-3-1-2-4-12(11)20-14/h1-7,17-18H,(H,16,19)	LPLIRDQZBOMOQI-UHFFFAOYSA-N	Brc1ccc2NC(=O)C3(NNc4ccccc4O3)c2c1	BroadT	BRD-A84909344	BRD-A84909344-001-06-0	Sanford-Burnham Medical Research Institute	MLS-0258268.0001			Brc1ccc2NC(=O)C3(NNc4ccccc4O3)c2c1	InChI=1S/C14H10BrN3O2/c15-8-5-6-10-9(7-8)14(13(19)16-10)18-17-11-3-1-2-4-12(11)20-14/h1-7,17-18H,(H,16,19)	LPLIRDQZBOMOQI-UHFFFAOYSA-N	330.99563919							91926
ZINC04302418	LSM-15270	BRD-K42215100	663523	InChI=1S/C14H15N3O/c1-3-11-16-12-9-7-5-6-8-10(9)18-13(12)14(17-11)15-4-2/h5-8H,3-4H2,1-2H3,(H,15,16,17)	OSQRLYLQRYBSDQ-UHFFFAOYSA-N	CCNc1nc(CC)nc2c1oc3ccccc23	BroadT	BRD-K42215100	BRD-K42215100-003-05-3	InterBioScreen Ltd.	STOCK4S-40420		Cl	CCNc1nc(CC)nc2c3ccccc3oc12.Cl	InChI=1S/C14H15N3O.ClH/c1-3-11-16-12-9-7-5-6-8-10(9)18-13(12)14(17-11)15-4-2;/h5-8H,3-4H2,1-2H3,(H,15,16,17);1H	MJDCOJFWWUMFPS-UHFFFAOYSA-N	241.12151213							103917, 103917
1-(4-Amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-n-[(2-chloro-6-fluorophenyl)methylideneamino]triazole-4-carboxamide	LSM-18393	BRD-K60936953	2047601	InChI=1S/C19H12ClFN8O4/c20-11-2-1-3-12(21)10(11)7-23-25-19(30)15-16(9-4-5-13-14(6-9)32-8-31-13)29(28-24-15)18-17(22)26-33-27-18/h1-7H,8H2,(H2,22,26)(H,25,30)	BRRJCHWLSWDNKN-UHFFFAOYSA-N	Nc1nonc1n2nnc(C(=O)NN=Cc3c(F)cccc3Cl)c2c4ccc5OCOc5c4	BroadT	BRD-K60936953	BRD-K60936953-001-06-1	InterBioScreen Ltd.	STOCK4S-91283			Nc1nonc1-n1nnc(C(=O)NN=Cc2c(F)cccc2Cl)c1-c1ccc2OCOc2c1	InChI=1S/C19H12ClFN8O4/c20-11-2-1-3-12(21)10(11)7-23-25-19(30)15-16(9-4-5-13-14(6-9)32-8-31-13)29(28-24-15)18-17(22)26-33-27-18/h1-7H,8H2,(H2,22,26)(H,25,30)	BRRJCHWLSWDNKN-UHFFFAOYSA-N	470.065406854							107039
AC1MUWA3	LSM-18394	SID24824470, BRD-K35176031	3647693	InChI=1S/C11H14N6O/c1-7-3-4-9(5-8(7)2)14-11-15-10(16-17-11)12-6-13-18/h3-6,18H,1-2H3,(H3,12,13,14,15,16,17)	HGMITDLLYGNSTP-UHFFFAOYSA-N	Cc1ccc(Nc2n[nH]c(N=CNO)n2)cc1C	BroadT	BRD-K35176031	BRD-K35176031-001-05-4	Key Organics Ltd.	JS-1372			Cc1ccc(Nc2n[nH]c(N=CNO)n2)cc1C	InChI=1S/C11H14N6O/c1-7-3-4-9(5-8(7)2)14-11-15-10(16-17-11)12-6-13-18/h3-6,18H,1-2H3,(H3,12,13,14,15,16,17)	HGMITDLLYGNSTP-UHFFFAOYSA-N	246.122909128							107040
MLS000585524	LSM-43760	SID17511259, BRD-K95159965	5942398	InChI=1S/C20H17N3O2/c1-12(2)23-17-10-6-4-7-13(17)15(20(23)25)11-18-21-16-9-5-3-8-14(16)19(24)22-18/h3-12H,1-2H3,(H,21,22,24)/b15-11-	XDTYJOWCVORNRC-PTNGSMBKSA-N	CC(C)N1C(=O)\C(=C/c2nc(O)c3ccccc3n2)\c4ccccc14	BroadT	BRD-K95159965	BRD-K95159965-001-11-5	ChemDiv Inc.	3456-0589			CC(C)N1C(=O)\C(=C/c2nc(O)c3ccccc3n2)c2ccccc12	InChI=1S/C20H17N3O2/c1-12(2)23-17-10-6-4-7-13(17)15(20(23)25)11-18-21-16-9-5-3-8-14(16)19(24)22-18/h3-12H,1-2H3,(H,21,22,24)/b15-11-	XDTYJOWCVORNRC-PTNGSMBKSA-N	331.132076814							
ILP-II-21	LSM-18396	SID24833109, BRD-K70496062	16196407	InChI=1S/C22H37N5O6/c1-14(19(30)32-21(2,3)4)27-18(29)16-15(25-13-26-16)17(28)23-11-9-8-10-12-24-20(31)33-22(5,6)7/h13-14H,8-12H2,1-7H3,(H,23,28)(H,24,31)(H,25,26)(H,27,29)/t14-/m0/s1	ZXJLEJXGLNEYOY-AWEZNQCLSA-N	C[C@H](NC(=O)c1[nH]cnc1C(=O)NCCCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C	BroadT	BRD-K70496062	BRD-K70496062-001-05-4	University of Tulsa	ILP-II-21 AE06_PA07			C[C@H](NC(=O)c1[nH]cnc1C(=O)NCCCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C	InChI=1S/C22H37N5O6/c1-14(19(30)32-21(2,3)4)27-18(29)16-15(25-13-26-16)17(28)23-11-9-8-10-12-24-20(31)33-22(5,6)7/h13-14H,8-12H2,1-7H3,(H,23,28)(H,24,31)(H,25,26)(H,27,29)/t14-/m0/s1	ZXJLEJXGLNEYOY-AWEZNQCLSA-N	467.274383954							107042
T0517-9207	LSM-43761	SID22408261, BRD-K61108991	5839385	InChI=1S/C20H21NO2/c1-16-3-2-4-17(15-16)5-10-20(22)18-6-8-19(9-7-18)21-11-13-23-14-12-21/h2-10,15H,11-14H2,1H3/b10-5+	GXTSCSPSZPDOSU-BJMVGYQFSA-N	Cc1cccc(\C=C\C(=O)c2ccc(cc2)N3CCOCC3)c1	BroadT	BRD-K61108991	BRD-K61108991-001-03-7	Enamine Ltd.	T0517-9207			Cc1cccc(\C=C\C(=O)c2ccc(cc2)N2CCOCC2)c1	InChI=1S/C20H21NO2/c1-16-3-2-4-17(15-16)5-10-20(22)18-6-8-19(9-7-18)21-11-13-23-14-12-21/h2-10,15H,11-14H2,1H3/b10-5+	GXTSCSPSZPDOSU-BJMVGYQFSA-N	307.157228922							
AC1M78NJ	LSM-18398	SID24779946, BRD-K84954258	2413212	InChI=1S/C19H15N3OS/c23-18(12-13-6-5-11-24-13)20-15-8-2-1-7-14(15)19-21-16-9-3-4-10-17(16)22-19/h1-11H,12H2,(H,20,23)(H,21,22)	VGYIGRFYAPUFMC-UHFFFAOYSA-N	O=C(Cc1cccs1)Nc2ccccc2c3nc4ccccc4[nH]3	BroadT	BRD-K84954258	BRD-K84954258-001-03-5	Enamine Ltd.	T0515-4308			O=C(Cc1cccs1)Nc1ccccc1-c1nc2ccccc2[nH]1	InChI=1S/C19H15N3OS/c23-18(12-13-6-5-11-24-13)20-15-8-2-1-7-14(15)19-21-16-9-3-4-10-17(16)22-19/h1-11H,12H2,(H,20,23)(H,21,22)	VGYIGRFYAPUFMC-UHFFFAOYSA-N	333.09358282							107044
AMBCB19288713	LSM-43762	SID24783421, BRD-A21765353	16188141	InChI=1S/C23H28ClNO2/c1-27-22-10-8-19(9-11-22)6-3-13-25-14-4-12-23(17-25,18-26)16-20-5-2-7-21(24)15-20/h2-3,5-11,15,26H,4,12-14,16-18H2,1H3/b6-3+	KETQGNPDHAUPMQ-ZZXKWVIFSA-N	COc1ccc(\C=C\CN2CCCC(CO)(Cc3cccc(Cl)c3)C2)cc1	BroadT	BRD-A21765353	BRD-A21765353-001-06-0	ChemBridge Corporation	19288713			COc1ccc(\C=C\CN2CCCC(CO)(Cc3cccc(Cl)c3)C2)cc1	InChI=1S/C23H28ClNO2/c1-27-22-10-8-19(9-11-22)6-3-13-25-14-4-12-23(17-25,18-26)16-20-5-2-7-21(24)15-20/h2-3,5-11,15,26H,4,12-14,16-18H2,1H3/b6-3+	KETQGNPDHAUPMQ-ZZXKWVIFSA-N	385.180856856							
MLS000101908	LSM-18400	SID7970366, BRD-K23129785	3544833	InChI=1S/C20H27N5O2/c1-14(2)11-25-16(13-22(3)12-15-9-7-6-8-10-15)21-18-17(25)19(26)24(5)20(27)23(18)4/h6-10,14H,11-13H2,1-5H3	VRCUOVJQCGDQBM-UHFFFAOYSA-N	CC(C)Cn1c(CN(C)Cc2ccccc2)nc3N(C)C(=O)N(C)C(=O)c13	BroadT	BRD-K23129785	BRD-K23129785-001-05-5	Life Chemicals Inc.	F0634-0620			CC(C)Cn1c(CN(C)Cc2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C20H27N5O2/c1-14(2)11-25-16(13-22(3)12-15-9-7-6-8-10-15)21-18-17(25)19(26)24(5)20(27)23(18)4/h6-10,14H,11-13H2,1-5H3	VRCUOVJQCGDQBM-UHFFFAOYSA-N	369.216475154							107046
3-(4-Ethoxyphenyl)-1H-pyrazole-5-carbohydrazide	LSM-18401	SID17505387, BRD-K73251805	776488	InChI=1S/C12H14N4O2/c1-2-18-9-5-3-8(4-6-9)10-7-11(16-15-10)12(17)14-13/h3-7H,2,13H2,1H3,(H,14,17)(H,15,16)	USHDDGOYLOOKGQ-UHFFFAOYSA-N	CCOc1ccc(cc1)c2cc([nH]n2)C(=O)NN	BroadT	BRD-K73251805	BRD-K73251805-001-05-2	Asinex Ltd.	BAS 00834345			CCOc1ccc(cc1)-c1cc([nH]n1)C(=O)NN	InChI=1S/C12H14N4O2/c1-2-18-9-5-3-8(4-6-9)10-7-11(16-15-10)12(17)14-13/h3-7H,2,13H2,1H3,(H,14,17)(H,15,16)	USHDDGOYLOOKGQ-UHFFFAOYSA-N	246.111675728							107047
MLS000116357	LSM-18402	SID7967358, BRD-K79157993	5308779	InChI=1S/C15H16N2O3/c1-9(2)14-8-13(17-20-14)15(19)16-12-6-4-5-11(7-12)10(3)18/h4-9H,1-3H3,(H,16,19)	JNKCZCNWALSZPM-UHFFFAOYSA-N	CC(C)c1onc(c1)C(=O)Nc2cccc(c2)C(=O)C	BroadT	BRD-K79157993	BRD-K79157993-001-05-7	ChemDiv Inc.	C226-2932			CC(C)c1cc(no1)C(=O)Nc1cccc(c1)C(C)=O	InChI=1S/C15H16N2O3/c1-9(2)14-8-13(17-20-14)15(19)16-12-6-4-5-11(7-12)10(3)18/h4-9H,1-3H3,(H,16,19)	JNKCZCNWALSZPM-UHFFFAOYSA-N	272.116092392							107048
MLS000034632	LSM-18403	SID846450, BRD-K23021066	648838	InChI=1S/C22H35N3O2/c1-21(2,3)23-19(26)16-25(22(4,5)6)20(27)13-15-24-14-9-11-17-10-7-8-12-18(17)24/h7-8,10,12H,9,11,13-16H2,1-6H3,(H,23,26)	VDWGQYMBLKWTQX-UHFFFAOYSA-N	CC(C)(C)NC(=O)CN(C(=O)CCN1CCCc2ccccc12)C(C)(C)C	BroadT	BRD-K23021066	BRD-K23021066-001-06-2	Asinex Ltd.	ASN 06641807			CC(C)(C)NC(=O)CN(C(=O)CCN1CCCc2ccccc12)C(C)(C)C	InChI=1S/C22H35N3O2/c1-21(2,3)23-19(26)16-25(22(4,5)6)20(27)13-15-24-14-9-11-17-10-7-8-12-18(17)24/h7-8,10,12H,9,11,13-16H2,1-6H3,(H,23,26)	VDWGQYMBLKWTQX-UHFFFAOYSA-N	373.27292739							107049
AK-968/12267260	LSM-18404	SID24808671, BRD-K67336695	903491	InChI=1S/C15H11ClN2O3S/c16-11-3-1-2-4-12(11)20-9-10-5-6-13(21-10)14(19)18-15-17-7-8-22-15/h1-8H,9H2,(H,17,18,19)	MXJRBSHPGJZFBQ-UHFFFAOYSA-N	Clc1ccccc1OCc2oc(cc2)C(=O)Nc3nccs3	BroadT	BRD-K67336695	BRD-K67336695-001-06-0	Asinex Ltd.	BAS 12654182			Clc1ccccc1OCc1ccc(o1)C(=O)Nc1nccs1	InChI=1S/C15H11ClN2O3S/c16-11-3-1-2-4-12(11)20-9-10-5-6-13(21-10)14(19)18-15-17-7-8-22-15/h1-8H,9H2,(H,17,18,19)	MXJRBSHPGJZFBQ-UHFFFAOYSA-N	334.017890632							107050
AMBCB17636043	LSM-18405	SID24799265, BRD-A37531650	16190936	InChI=1S/C22H26ClNO4/c1-26-19-9-17(10-20-21(19)28-15-27-20)12-24-7-3-6-22(13-24,14-25)11-16-4-2-5-18(23)8-16/h2,4-5,8-10,25H,3,6-7,11-15H2,1H3	ZAGAYOJZYQAPMC-UHFFFAOYSA-N	COc1cc(CN2CCCC(CO)(Cc3cccc(Cl)c3)C2)cc4OCOc14	BroadT	BRD-A37531650	BRD-A37531650-001-07-6	ChemBridge Corporation	17636043			COc1cc(CN2CCCC(CO)(Cc3cccc(Cl)c3)C2)cc2OCOc12	InChI=1S/C22H26ClNO4/c1-26-19-9-17(10-20-21(19)28-15-27-20)12-24-7-3-6-22(13-24,14-25)11-16-4-2-5-18(23)8-16/h2,4-5,8-10,25H,3,6-7,11-15H2,1H3	ZAGAYOJZYQAPMC-UHFFFAOYSA-N	403.155036032							107051
MLS001160606	LSM-18406	SID49821536, BRD-A05126040	2991595	InChI=1S/C18H23N3O5S/c1-11(2)26-15(22)10-14-17(24)19-8-9-21(14)18(27)20-16(23)12-4-6-13(25-3)7-5-12/h4-7,11,14H,8-10H2,1-3H3,(H,19,24)(H,20,23,27)	PBWXEARLSDEMHR-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NC(=S)N2CCNC(=O)C2CC(=O)OC(C)C	BroadT	BRD-A05126040	BRD-A05126040-001-06-4	ChemBridge Corporation	9005953			COc1ccc(cc1)C(=O)NC(=S)N1CCNC(=O)C1CC(=O)OC(C)C	InChI=1S/C18H23N3O5S/c1-11(2)26-15(22)10-14-17(24)19-8-9-21(14)18(27)20-16(23)12-4-6-13(25-3)7-5-12/h4-7,11,14H,8-10H2,1-3H3,(H,19,24)(H,20,23,27)	PBWXEARLSDEMHR-UHFFFAOYSA-N	393.135841556							107052
SMR000243612	LSM-18407	SID22403659, BRD-A51303904	4877362	InChI=1S/C21H26N2O5S2/c1-14-3-6-18-15(11-14)12-19(29-18)21(24)22-16-4-5-17(27-2)20(13-16)30(25,26)23-7-9-28-10-8-23/h4-5,12-14H,3,6-11H2,1-2H3,(H,22,24)	WVQUAKWCCMVEFC-UHFFFAOYSA-N	COc1ccc(NC(=O)c2cc3CC(C)CCc3s2)cc1S(=O)(=O)N4CCOCC4	BroadT	BRD-A51303904	BRD-A51303904-001-05-9	Enamine Ltd.	T5303861			COc1ccc(NC(=O)c2cc3CC(C)CCc3s2)cc1S(=O)(=O)N1CCOCC1	InChI=1S/C21H26N2O5S2/c1-14-3-6-18-15(11-14)12-19(29-18)21(24)22-16-4-5-17(27-2)20(13-16)30(25,26)23-7-9-28-10-8-23/h4-5,12-14H,3,6-11H2,1-2H3,(H,22,24)	WVQUAKWCCMVEFC-UHFFFAOYSA-N	450.128313332							107053
F1844-0146	LSM-18408	SID7970805, BRD-K97368094	5310304	InChI=1S/C14H23N3O4S/c1-4-17(11-8-6-5-7-9-11)22(20,21)12-10-15(2)14(19)16(3)13(12)18/h10-11H,4-9H2,1-3H3	AKWQOYCJFYESAA-UHFFFAOYSA-N	CCN(C1CCCCC1)S(=O)(=O)C2=CN(C)C(=O)N(C)C2=O	BroadT	BRD-K97368094	BRD-K97368094-001-05-6	Life Chemicals Inc.	F1844-0146			CCN(C1CCCCC1)S(=O)(=O)c1cn(C)c(=O)n(C)c1=O	InChI=1S/C14H23N3O4S/c1-4-17(11-8-6-5-7-9-11)22(20,21)12-10-15(2)14(19)16(3)13(12)18/h10-11H,4-9H2,1-3H3	AKWQOYCJFYESAA-UHFFFAOYSA-N	329.140926936							107054
SMR000095406	LSM-18409	SID7966559, BRD-K01141296	5308304	InChI=1S/C22H23N5O4/c28-21(17-15-16-3-1-2-4-18(16)31-22(17)29)27-9-7-25(8-10-27)19-5-6-20(24-23-19)26-11-13-30-14-12-26/h1-6,15H,7-14H2	QJMRRVUJLMDPSV-UHFFFAOYSA-N	O=C(N1CCN(CC1)c2ccc(nn2)N3CCOCC3)C4=Cc5ccccc5OC4=O	BroadT	BRD-K01141296	BRD-K01141296-001-04-1	ChemDiv Inc.	C637-0242			O=C(N1CCN(CC1)c1ccc(nn1)N1CCOCC1)c1cc2ccccc2oc1=O	InChI=1S/C22H23N5O4/c28-21(17-15-16-3-1-2-4-18(16)31-22(17)29)27-9-7-25(8-10-27)19-5-6-20(24-23-19)26-11-13-30-14-12-26/h1-6,15H,7-14H2	QJMRRVUJLMDPSV-UHFFFAOYSA-N	421.175004266							107055
1-[1-(3-Fluorophenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxamide	LSM-18410	SID863600, BRD-A54347351	664849	InChI=1S/C16H18FN3O3/c17-11-2-1-3-12(8-11)20-14(21)9-13(16(20)23)19-6-4-10(5-7-19)15(18)22/h1-3,8,10,13H,4-7,9H2,(H2,18,22)	HDXHAEYBVYIETN-UHFFFAOYSA-N	NC(=O)C1CCN(CC1)C2CC(=O)N(C2=O)c3cccc(F)c3	BroadT	BRD-A54347351	BRD-A54347351-001-05-1	InterBioScreen Ltd.	STOCK4S-78743			NC(=O)C1CCN(CC1)C1CC(=O)N(C1=O)c1cccc(F)c1	InChI=1S/C16H18FN3O3/c17-11-2-1-3-12(8-11)20-14(21)9-13(16(20)23)19-6-4-10(5-7-19)15(18)22/h1-3,8,10,13H,4-7,9H2,(H2,18,22)	HDXHAEYBVYIETN-UHFFFAOYSA-N	319.133219666							107056
T5327032	LSM-18411	SID24832189, BRD-K56597705	4882702	InChI=1S/C17H13N3S2/c1-2-7-14-13(6-1)16(18-11-12-5-3-9-21-12)20-17(19-14)15-8-4-10-22-15/h1-10H,11H2,(H,18,19,20)	KPHOJOSUCIJYIZ-UHFFFAOYSA-N	C(Nc1nc(nc2ccccc12)c3cccs3)c4cccs4	BroadT	BRD-K56597705	BRD-K56597705-001-05-0	Enamine Ltd.	T5327032			C(Nc1nc(nc2ccccc12)-c1cccs1)c1cccs1	InChI=1S/C17H13N3S2/c1-2-7-14-13(6-1)16(18-11-12-5-3-9-21-12)20-17(19-14)15-8-4-10-22-15/h1-10H,11H2,(H,18,19,20)	KPHOJOSUCIJYIZ-UHFFFAOYSA-N	323.055088826							107057
CHEMDIV3_012662	LSM-18412	SID24782919, BRD-K01068895	4444521	InChI=1S/C27H34N4O2S/c1-3-21-9-11-22(12-10-21)28-25(32)19-34-27-29-24-8-5-4-7-23(24)26(33)31(27)16-6-15-30-17-13-20(2)14-18-30/h4-5,7-12,20H,3,6,13-19H2,1-2H3,(H,28,32)	QOZGQYGMUOJTHD-UHFFFAOYSA-N	CCc1ccc(NC(=O)CSC2=Nc3ccccc3C(=O)N2CCCN4CCC(C)CC4)cc1	BroadT	BRD-K01068895	BRD-K01068895-001-06-6	ChemDiv Inc.	K284-2859			CCc1ccc(NC(=O)CSc2nc3ccccc3c(=O)n2CCCN2CCC(C)CC2)cc1	InChI=1S/C27H34N4O2S/c1-3-21-9-11-22(12-10-21)28-25(32)19-34-27-29-24-8-5-4-7-23(24)26(33)31(27)16-6-15-30-17-13-20(2)14-18-30/h4-5,7-12,20H,3,6,13-19H2,1-2H3,(H,28,32)	QOZGQYGMUOJTHD-UHFFFAOYSA-N	478.240247058							107058
MLS001210921	LSM-18413	SID49646638, BRD-K90675185	3122942	InChI=1S/C17H13BrN2/c18-13-8-2-1-7-12(13)17-19-14-9-3-5-11-6-4-10-15(20-17)16(11)14/h1-10,17,19-20H	JENNJSGVTKUMQP-UHFFFAOYSA-N	Brc1ccccc1C2Nc3cccc4cccc(N2)c34	BroadT	BRD-K90675185	BRD-K90675185-001-06-9	Asinex Ltd.	BAS 00922270			Brc1ccccc1C1Nc2cccc3cccc(N1)c23	InChI=1S/C17H13BrN2/c18-13-8-2-1-7-12(13)17-19-14-9-3-5-11-6-4-10-15(20-17)16(11)14/h1-10,17,19-20H	JENNJSGVTKUMQP-UHFFFAOYSA-N	324.026211036							107059
AC1MBS35	LSM-18414	BRD-K34751329	2730394	InChI=1S/C15H10Cl2F3N3S/c16-11-4-2-1-3-9(11)8-21-23-14(24)22-13-7-10(15(18,19)20)5-6-12(13)17/h1-8H,(H2,22,23,24)	YHQPEHQBAIXYKM-UHFFFAOYSA-N	FC(F)(F)c1ccc(Cl)c(NC(=NN=Cc2ccccc2Cl)S)c1	BroadT	BRD-K34751329	BRD-K34751329-001-04-9	Maybridge	RJF 00950			FC(F)(F)c1ccc(Cl)c(NC(S)=NN=Cc2ccccc2Cl)c1	InChI=1S/C15H10Cl2F3N3S/c16-11-4-2-1-3-9(11)8-21-23-14(24)22-13-7-10(15(18,19)20)5-6-12(13)17/h1-8H,(H2,22,23,24)	YHQPEHQBAIXYKM-UHFFFAOYSA-N	390.99245806							107060
AC1MWK28	LSM-18415	SID26661805, BRD-A76042151	3775510	InChI=1S/C19H18N4O7/c1-11(2)30-14-6-3-12(4-7-14)15-10-18(24)21(19(15)25)20-16-8-5-13(22(26)27)9-17(16)23(28)29/h3-9,11,15,20H,10H2,1-2H3	MWQHYFBKDKJTSZ-UHFFFAOYSA-N	CC(C)Oc1ccc(cc1)C2CC(=O)N(Nc3ccc(cc3[N+](=O)[O-])[N+](=O)[O-])C2=O	BroadT	BRD-A76042151	BRD-A76042151-001-05-4	InterBioScreen Ltd.	STOCK2S-37597			CC(C)Oc1ccc(cc1)C1CC(=O)N(Nc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)C1=O	InChI=1S/C19H18N4O7/c1-11(2)30-14-6-3-12(4-7-14)15-10-18(24)21(19(15)25)20-16-8-5-13(22(26)27)9-17(16)23(28)29/h3-9,11,15,20H,10H2,1-2H3	MWQHYFBKDKJTSZ-UHFFFAOYSA-N	414.117548956							107061
F0631-0258	LSM-18416	SID7971474, BRD-A90029851	5076107	InChI=1S/C19H22FN5O3S/c1-3-28-19(27)24-10-8-23(9-11-24)15(13-4-6-14(20)7-5-13)16-17(26)25-18(29-16)21-12(2)22-25/h4-7,15,26H,3,8-11H2,1-2H3	JBXLBQUMKOUYSF-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(c2ccc(F)cc2)c3sc4nc(C)nn4c3O	BroadT	BRD-A90029851	BRD-A90029851-001-05-6	Life Chemicals Inc.	F0631-0258			CCOC(=O)N1CCN(CC1)C(c1sc2nc(C)nn2c1O)c1ccc(F)cc1	InChI=1S/C19H22FN5O3S/c1-3-28-19(27)24-10-8-23(9-11-24)15(13-4-6-14(20)7-5-13)16-17(26)25-18(29-16)21-12(2)22-25/h4-7,15,26H,3,8-11H2,1-2H3	JBXLBQUMKOUYSF-UHFFFAOYSA-N	419.142738504							107062
6-Bromo-2-pyrrolidin-1-yl-1,3-benzothiazole	LSM-18417	SID24784658, BRD-K94418733	6622296	InChI=1S/C11H11BrN2S/c12-8-3-4-9-10(7-8)15-11(13-9)14-5-1-2-6-14/h3-4,7H,1-2,5-6H2	AYAVCCOKMKNKNY-UHFFFAOYSA-N	Brc1ccc2nc(sc2c1)N3CCCC3	BroadT	BRD-K94418733	BRD-K94418733-001-06-7	Life Chemicals Inc.	F0647-0174			Brc1ccc2nc(sc2c1)N1CCCC1	InChI=1S/C11H11BrN2S/c12-8-3-4-9-10(7-8)15-11(13-9)14-5-1-2-6-14/h3-4,7H,1-2,5-6H2	AYAVCCOKMKNKNY-UHFFFAOYSA-N	281.982631662							107063
STK298961	LSM-43763	SID7977167, BRD-K72468780	5310868	InChI=1S/C15H17N3O4/c19-8-4-7-16-9-12-13(20)17-15(22)18(14(12)21)10-11-5-2-1-3-6-11/h1-3,5-6,9,16,19H,4,7-8,10H2,(H,17,20,22)/b12-9-	IUYCTACRDXLMDU-XFXZXTDPSA-N	OCCCN\C=C/1\C(=O)NC(=O)N(Cc2ccccc2)C1=O	BroadT	BRD-K72468780	BRD-K72468780-001-06-0	ChemBridge Corporation	5304231			OCCCN\C=C1\C(=O)NC(=O)N(Cc2ccccc2)C1=O	InChI=1S/C15H17N3O4/c19-8-4-7-16-9-12-13(20)17-15(22)18(14(12)21)10-11-5-2-1-3-6-11/h1-3,5-6,9,16,19H,4,7-8,10H2,(H,17,20,22)/b12-9-	IUYCTACRDXLMDU-XFXZXTDPSA-N	303.121906054							
SMR000318028	LSM-1276	BRD-A06641369, SID24780154, SID87219037, SID87556796	16187238	InChI=1S/C22H31N3O2/c1-16(2)25-14-18(12-23-25)13-24-10-6-8-20(15-24)22(26)19-7-5-9-21(11-19)27-17(3)4/h5,7,9,11-12,14,16-17,20H,6,8,10,13,15H2,1-4H3	SBSKQOIYKJFAJN-UHFFFAOYSA-N	CC(C)Oc1cccc(c1)C(=O)C2CCCN(Cc3cnn(c3)C(C)C)C2	BroadT	BRD-A06641369	BRD-A06641369-001-10-6	ChemBridge Corporation	98254896			CC(C)Oc1cccc(c1)C(=O)C1CCCN(Cc2cnn(c2)C(C)C)C1	InChI=1S/C22H31N3O2/c1-16(2)25-14-18(12-23-25)13-24-10-6-8-20(15-24)22(26)19-7-5-9-21(11-19)27-17(3)4/h5,7,9,11-12,14,16-17,20H,6,8,10,13,15H2,1-4H3	SBSKQOIYKJFAJN-UHFFFAOYSA-N	369.241627262							91501
MLS001030458	LSM-18419	SID49716753, BRD-K27142197	20969427	InChI=1S/C16H20N2O5S/c1-2-23-16(20)11-5-7-18(8-6-11)24(21,22)13-3-4-14-12(9-13)10-15(19)17-14/h3-4,9,11H,2,5-8,10H2,1H3,(H,17,19)	FHAZWROZEPRKGL-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC1)S(=O)(=O)c2ccc3NC(=O)Cc3c2	BroadT	BRD-K27142197	BRD-K27142197-001-05-6	ChemDiv Inc.	K906-1766			CCOC(=O)C1CCN(CC1)S(=O)(=O)c1ccc2NC(=O)Cc2c1	InChI=1S/C16H20N2O5S/c1-2-23-16(20)11-5-7-18(8-6-11)24(21,22)13-3-4-14-12(9-13)10-15(19)17-14/h3-4,9,11H,2,5-8,10H2,1H3,(H,17,19)	FHAZWROZEPRKGL-UHFFFAOYSA-N	352.10929245							107065
AC1NW5UU	LSM-43764	SID22403514, BRD-K68029780	5672271	InChI=1S/C20H15N3O2S/c1-13-6-2-5-9-17(13)22-12-16-14-7-3-4-8-15(14)18(24)23(19(16)25)20-21-10-11-26-20/h2-12,22H,1H3/b16-12-	SFPMDHOBMKDURP-VBKFSLOCSA-N	Cc1ccccc1N\C=C\2/C(=O)N(C(=O)c3ccccc23)c4nccs4	BroadT	BRD-K68029780	BRD-K68029780-001-05-8	Enamine Ltd.	T0511-2068			Cc1ccccc1N\C=C1/C(=O)N(c2nccs2)C(=O)c2ccccc12	InChI=1S/C20H15N3O2S/c1-13-6-2-5-9-17(13)22-12-16-14-7-3-4-8-15(14)18(24)23(19(16)25)20-21-10-11-26-20/h2-12,22H,1H3/b16-12-	SFPMDHOBMKDURP-VBKFSLOCSA-N	361.08849744							
ASN 03364925	LSM-18421	SID24789853, BRD-A80887762	3171721	InChI=1S/C23H27N3O3S/c1-15-7-8-16(2)21-20(15)11-17(22(27)25-21)13-26(14-19-6-4-10-29-19)23(30)24-12-18-5-3-9-28-18/h4,6-8,10-11,18H,3,5,9,12-14H2,1-2H3,(H,24,30)(H,25,27)	QLLXMRBGMKJIMC-UHFFFAOYSA-N	Cc1ccc(C)c2nc(O)c(CN(Cc3occc3)C(=NCC4CCCO4)S)cc12	BroadT	BRD-A80887762	BRD-A80887762-001-05-7	Asinex Ltd.	ASN 03364925			Cc1ccc(C)c2nc(O)c(CN(Cc3ccco3)C(S)=NCC3CCCO3)cc12	InChI=1S/C23H27N3O3S/c1-15-7-8-16(2)21-20(15)11-17(22(27)25-21)13-26(14-19-6-4-10-29-19)23(30)24-12-18-5-3-9-28-18/h4,6-8,10-11,18H,3,5,9,12-14H2,1-2H3,(H,24,30)(H,25,27)	QLLXMRBGMKJIMC-UHFFFAOYSA-N	425.177312444							107067
MLS000563797	LSM-18422	SID24708083, BRD-K09609446	3247435	InChI=1S/C19H22ClNOS/c1-2-3-5-14-12-16(14)18(13-7-9-15(20)10-8-13)21-19(22)17-6-4-11-23-17/h4,6-11,14,16,18H,2-3,5,12H2,1H3,(H,21,22)/t14-,16-,18+/m1/s1	QKLOHIAMQQCGHP-KYJSFNMBSA-N	CCCC[C@@H]1C[C@H]1[C@@H](NC(=O)c2cccs2)c3ccc(Cl)cc3	BroadT	BRD-K09609446	BRD-K09609446-001-03-0	University of Pittsburgh CMLD	UPCMLD01ACMC002057			CCCC[C@@H]1C[C@H]1[C@@H](NC(=O)c1cccs1)c1ccc(Cl)cc1	InChI=1S/C19H22ClNOS/c1-2-3-5-14-12-16(14)18(13-7-9-15(20)10-8-13)21-19(22)17-6-4-11-23-17/h4,6-11,14,16,18H,2-3,5,12H2,1H3,(H,21,22)/t14-,16-,18+/m1/s1	QKLOHIAMQQCGHP-KYJSFNMBSA-N	347.111062734							107068
1-[2-(2-Methylphenoxy)ethyl]-3-phenylthiourea	LSM-18423	SID17406602, BRD-K22384930	1811564	InChI=1S/C16H18N2OS/c1-13-7-5-6-10-15(13)19-12-11-17-16(20)18-14-8-3-2-4-9-14/h2-10H,11-12H2,1H3,(H2,17,18,20)	GBPRGJDUEMKMOK-UHFFFAOYSA-N	Cc1ccccc1OCCN=C(S)Nc2ccccc2	BroadT	BRD-K22384930	BRD-K22384930-001-05-1	Specs	AO-080/42479867			Cc1ccccc1OCCN=C(S)Nc1ccccc1	InChI=1S/C16H18N2OS/c1-13-7-5-6-10-15(13)19-12-11-17-16(20)18-14-8-3-2-4-9-14/h2-10H,11-12H2,1H3,(H2,17,18,20)	GBPRGJDUEMKMOK-UHFFFAOYSA-N	286.113983906							107069
AC1LM7D3	LSM-18424	BRD-K79431139	1124738	InChI=1S/C25H20N4O3/c1-32-23-13-12-17(14-22(23)30)16-26-29-25(31)24-27-20(18-8-4-2-5-9-18)15-21(28-24)19-10-6-3-7-11-19/h2-16,30H,1H3,(H,29,31)	IZCIIXYLFYRZPN-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)c2nc(cc(n2)c3ccccc3)c4ccccc4)cc1O	BroadT	BRD-K79431139	BRD-K79431139-001-05-1	Asinex Ltd.	BAS 00232036			COc1ccc(C=NNC(=O)c2nc(cc(n2)-c2ccccc2)-c2ccccc2)cc1O	InChI=1S/C25H20N4O3/c1-32-23-13-12-17(14-22(23)30)16-26-29-25(31)24-27-20(18-8-4-2-5-9-18)15-21(28-24)19-10-6-3-7-11-19/h2-16,30H,1H3,(H,29,31)	IZCIIXYLFYRZPN-UHFFFAOYSA-N	424.15354054							107070
MLS000544429	LSM-18425	SID17387363, BRD-K06856626	842644	InChI=1S/C14H17N5O2S/c1-9-8-11(18-19(9)2)13(20)16-17-14(22)15-10-6-4-5-7-12(10)21-3/h4-8H,1-3H3,(H,16,20)(H2,15,17,22)	AKYGOEVGMSSOLO-UHFFFAOYSA-N	COc1ccccc1N=C(S)NNC(=O)c2cc(C)n(C)n2	BroadT	BRD-K06856626	BRD-K06856626-001-06-5	Specs	AK-968/41169599			COc1ccccc1N=C(S)NNC(=O)c1cc(C)n(C)n1	InChI=1S/C14H17N5O2S/c1-9-8-11(18-19(9)2)13(20)16-17-14(22)15-10-6-4-5-7-12(10)21-3/h4-8H,1-3H3,(H,16,20)(H2,15,17,22)	AKYGOEVGMSSOLO-UHFFFAOYSA-N	319.110295524							107071
2-(5-Oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)-n-[2-(trifluoromethyl)phenyl]acetamide	LSM-18426	SID24785624, BRD-K57070101	1507364	InChI=1S/C21H15F3N4O2S/c22-21(23,24)13-6-2-3-7-14(13)25-16(29)11-28-15-8-4-1-5-12(15)17-18(28)19(30)27-9-10-31-20(27)26-17/h1-8H,9-11H2,(H,25,29)	URMVDBRFNKFWQR-UHFFFAOYSA-N	FC(F)(F)c1ccccc1NC(=O)Cn2c3C(=O)N4CCSC4=Nc3c5ccccc25	BroadT	BRD-K57070101	BRD-K57070101-001-06-5	ChemDiv Inc.	8016-4389			FC(F)(F)c1ccccc1NC(=O)Cn1c2ccccc2c2nc3SCCn3c(=O)c12	InChI=1S/C21H15F3N4O2S/c22-21(23,24)13-6-2-3-7-14(13)25-16(29)11-28-15-8-4-1-5-12(15)17-18(28)19(30)27-9-10-31-20(27)26-17/h1-8H,9-11H2,(H,25,29)	URMVDBRFNKFWQR-UHFFFAOYSA-N	444.08678105							107072
3-Nitro-n-(quinoxalin-6-ylmethylideneamino)benzamide	LSM-18427	BRD-K13812094	5072680	InChI=1S/C16H11N5O3/c22-16(12-2-1-3-13(9-12)21(23)24)20-19-10-11-4-5-14-15(8-11)18-7-6-17-14/h1-10H,(H,20,22)	APZQDLAYYOUJQS-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C(=O)NN=Cc2ccc3nccnc3c2	BroadT	BRD-K13812094	BRD-K13812094-001-05-4	ChemDiv Inc.	K001-0170			[O-][N+](=O)c1cccc(c1)C(=O)NN=Cc1ccc2nccnc2c1	InChI=1S/C16H11N5O3/c22-16(12-2-1-3-13(9-12)21(23)24)20-19-10-11-4-5-14-15(8-11)18-7-6-17-14/h1-10H,(H,20,22)	APZQDLAYYOUJQS-UHFFFAOYSA-N	321.086189262							107073
MLS000519625	LSM-3798	BRD-K79857601, SID85147383	602897	InChI=1S/C10H8Cl2N2O2S2/c1-15-7-4-6(8(16-2)3-5(7)11)13-10-9(12)14-18-17-10/h3-4H,1-2H3	VOQMETKMNGYFQC-UHFFFAOYSA-N	COc1cc(N=C2SSN=C2Cl)c(OC)cc1Cl	BroadT	BRD-K79857601	BRD-K79857601-001-09-8	Sanford-Burnham Medical Research Institute	MLS-0390826			COc1cc(N=c2ssnc2Cl)c(OC)cc1Cl	InChI=1S/C10H8Cl2N2O2S2/c1-15-7-4-6(8(16-2)3-5(7)11)13-10-9(12)14-18-17-10/h3-4H,1-2H3	VOQMETKMNGYFQC-UHFFFAOYSA-N	321.940424316							93408
F1805-0281	LSM-18428	SID7970056, BRD-A41944878	4090143	InChI=1S/C13H14N4O3S/c18-12-11(21-13-14-8-15-17(12)13)10(9-2-1-5-20-9)16-3-6-19-7-4-16/h1-2,5,8,10,18H,3-4,6-7H2	NXQIRLYJSAYIKY-UHFFFAOYSA-N	Oc1c(sc2ncnn12)C(N3CCOCC3)c4occc4	BroadT	BRD-A41944878	BRD-A41944878-001-05-5	Life Chemicals Inc.	F1805-0281			Oc1c(sc2ncnn12)C(N1CCOCC1)c1ccco1	InChI=1S/C13H14N4O3S/c18-12-11(21-13-14-8-15-17(12)13)10(9-2-1-5-20-9)16-3-6-19-7-4-16/h1-2,5,8,10,18H,3-4,6-7H2	NXQIRLYJSAYIKY-UHFFFAOYSA-N	306.078661038							107074
AC1N82MB	LSM-18429	SID24825414, BRD-A41174898	4337242	InChI=1S/C23H21FN2O4/c24-16-9-7-15(8-10-16)21-12-19(18-5-1-2-6-20(18)26-21)23(28)30-14-22(27)25-13-17-4-3-11-29-17/h1-2,5-10,12,17H,3-4,11,13-14H2,(H,25,27)	YFARIZPLDNVMNO-UHFFFAOYSA-N	Fc1ccc(cc1)c2cc(C(=O)OCC(=O)NCC3CCCO3)c4ccccc4n2	BroadT	BRD-A41174898	BRD-A41174898-001-05-5	Enamine Ltd.	T0506-2479			Fc1ccc(cc1)-c1cc(C(=O)OCC(=O)NCC2CCCO2)c2ccccc2n1	InChI=1S/C23H21FN2O4/c24-16-9-7-15(8-10-16)21-12-19(18-5-1-2-6-20(18)26-21)23(28)30-14-22(27)25-13-17-4-3-11-29-17/h1-2,5-10,12,17H,3-4,11,13-14H2,(H,25,27)	YFARIZPLDNVMNO-UHFFFAOYSA-N	408.148535372							107075
F1358-0302	LSM-18430	SID17514543, BRD-A80297901	12005858	InChI=1S/C18H21N3O5S2/c1-11-9-21(10-12(2)26-11)28(24,25)14-5-3-13(4-6-14)17(23)20-18-15(16(19)22)7-8-27-18/h3-8,11-12H,9-10H2,1-2H3,(H2,19,22)(H,20,23)	HNMULCWIQZVHCA-UHFFFAOYSA-N	CC1CN(CC(C)O1)S(=O)(=O)c2ccc(cc2)C(=O)Nc3sccc3C(=O)N	BroadT	BRD-A80297901	BRD-A80297901-001-05-1	Life Chemicals Inc.	F1358-0302			CC1CN(CC(C)O1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1sccc1C(N)=O	InChI=1S/C18H21N3O5S2/c1-11-9-21(10-12(2)26-11)28(24,25)14-5-3-13(4-6-14)17(23)20-18-15(16(19)22)7-8-27-18/h3-8,11-12H,9-10H2,1-2H3,(H2,19,22)(H,20,23)	HNMULCWIQZVHCA-UHFFFAOYSA-N	423.092262182							107076
MLS000621850	LSM-18431	SID24812224, BRD-K43916369	4094373	InChI=1S/C20H21N3O2S/c24-19-17-14-16(22-10-12-25-13-11-22)6-7-18(17)21-20(26)23(19)9-8-15-4-2-1-3-5-15/h1-7,14H,8-13H2,(H,21,26)	SNBXYEMNZPOKIX-UHFFFAOYSA-N	O=C1N(CCc2ccccc2)C(=S)Nc3ccc(cc13)N4CCOCC4	BroadT	BRD-K43916369	BRD-K43916369-001-07-1	ChemDiv Inc.	K284-6222			O=c1n(CCc2ccccc2)c(=S)[nH]c2ccc(cc12)N1CCOCC1	InChI=1S/C20H21N3O2S/c24-19-17-14-16(22-10-12-25-13-11-22)6-7-18(17)21-20(26)23(19)9-8-15-4-2-1-3-5-15/h1-7,14H,8-13H2,(H,21,26)	SNBXYEMNZPOKIX-UHFFFAOYSA-N	367.135447632							107077
SMR000005100	LSM-18432	SID26668087, SID853521, BRD-A20108388	656175	InChI=1S/C27H30N6O/c1-34-25-15-9-8-14-24(25)26(32-20-18-31(19-21-32)23-12-6-3-7-13-23)27-28-29-30-33(27)17-16-22-10-4-2-5-11-22/h2-15,26H,16-21H2,1H3	QITXFIQUENDJAS-UHFFFAOYSA-N	COc1ccccc1C(N2CCN(CC2)c3ccccc3)c4nnnn4CCc5ccccc5	BroadT	BRD-A20108388	BRD-A20108388-001-05-5	Asinex Ltd.	ASN 05561025			COc1ccccc1C(N1CCN(CC1)c1ccccc1)c1nnnn1CCc1ccccc1	InChI=1S/C27H30N6O/c1-34-25-15-9-8-14-24(25)26(32-20-18-31(19-21-32)23-12-6-3-7-13-23)27-28-29-30-33(27)17-16-22-10-4-2-5-11-22/h2-15,26H,16-21H2,1H3	QITXFIQUENDJAS-UHFFFAOYSA-N	454.24810964							107078
AC1M4ZCB	LSM-18433	SID14745324, BRD-K22196502	2318783	InChI=1S/C18H20ClN3OS/c1-2-3-4-9-22-10-15(23)16(17(22)20)18-21-14(11-24-18)12-5-7-13(19)8-6-12/h5-8,11H,2-4,9-10,20H2,1H3	IBIDRLGSBRAGCB-UHFFFAOYSA-N	CCCCCN1CC(=O)C(=C1N)c2nc(cs2)c3ccc(Cl)cc3	BroadT	BRD-K22196502	BRD-K22196502-001-05-7	Enamine Ltd.	T0503-5292			CCCCCN1CC(=O)C(=C1N)c1nc(cs1)-c1ccc(Cl)cc1	InChI=1S/C18H20ClN3OS/c1-2-3-4-9-22-10-15(23)16(17(22)20)18-21-14(11-24-18)12-5-7-13(19)8-6-12/h5-8,11H,2-4,9-10,20H2,1H3	IBIDRLGSBRAGCB-UHFFFAOYSA-N	361.10156069							107079
AC1MRBFK	LSM-18434	SID56431664, SID14740824, BRD-A83180796	3490272	InChI=1S/C27H26N4O2/c28-26-25-23(20-7-2-1-3-8-20)24-21-9-5-4-6-19(21)10-11-22(24)33-27(25)29-18-31(26)13-12-30-14-16-32-17-15-30/h1-11,18,23,28H,12-17H2	JQHNFXIODXZHQN-UHFFFAOYSA-N	N=C1N(CCN2CCOCC2)C=NC3=C1C(c4ccccc4)c5c(O3)ccc6ccccc56	BroadT	BRD-A83180796	BRD-A83180796-001-05-4	InterBioScreen Ltd.	STOCK4S-45065			N=c1c2C(c3ccccc3)c3c(Oc2ncn1CCN1CCOCC1)ccc1ccccc31	InChI=1S/C27H26N4O2/c28-26-25-23(20-7-2-1-3-8-20)24-21-9-5-4-6-19(21)10-11-22(24)33-27(25)29-18-31(26)13-12-30-14-16-32-17-15-30/h1-11,18,23,28H,12-17H2	JQHNFXIODXZHQN-UHFFFAOYSA-N	438.205576112							107080
ST50677263	LSM-18435	SID4250568, BRD-K31701661	3244363	InChI=1S/C16H14N2O4/c1-20-12-5-2-4-11(8-12)15-9-14(18-22-15)16(19)17-10-13-6-3-7-21-13/h2-9H,10H2,1H3,(H,17,19)	VLTZRGPEWQWHCK-UHFFFAOYSA-N	COc1cccc(c1)c2onc(c2)C(=O)NCc3occc3	BroadT	BRD-K31701661	BRD-K31701661-001-05-0	ChemDiv Inc.	C226-0801			COc1cccc(c1)-c1cc(no1)C(=O)NCc1ccco1	InChI=1S/C16H14N2O4/c1-20-12-5-2-4-11(8-12)15-9-14(18-22-15)16(19)17-10-13-6-3-7-21-13/h2-9H,10H2,1H3,(H,17,19)	VLTZRGPEWQWHCK-UHFFFAOYSA-N	298.095356948							107081
F1899-1024	LSM-18436	SID24824209, BRD-A05717240	16195663	InChI=1S/C19H23N3O2S/c1-2-14-5-7-15(8-6-14)17-9-10-19(22-21-17)25-13-18(23)20-12-16-4-3-11-24-16/h5-10,16H,2-4,11-13H2,1H3,(H,20,23)	WMEDXYJJTCMFFP-UHFFFAOYSA-N	CCc1ccc(cc1)c2ccc(SCC(=O)NCC3CCCO3)nn2	BroadT	BRD-A05717240	BRD-A05717240-001-05-0	Life Chemicals Inc.	F1899-1024			CCc1ccc(cc1)-c1ccc(SCC(=O)NCC2CCCO2)nn1	InChI=1S/C19H23N3O2S/c1-2-14-5-7-15(8-6-14)17-9-10-19(22-21-17)25-13-18(23)20-12-16-4-3-11-24-16/h5-10,16H,2-4,11-13H2,1H3,(H,20,23)	WMEDXYJJTCMFFP-UHFFFAOYSA-N	357.151097696							107082
ASN 08248481	LSM-18437	SID24809105, BRD-K30733398	1439460	InChI=1S/C20H23N7O2/c1-29-19-5-3-2-4-18(19)26-12-10-25(11-13-26)14-20(28)22-16-6-8-17(9-7-16)27-15-21-23-24-27/h2-9,15H,10-14H2,1H3,(H,22,28)	WIXNYRNPYLYCJE-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC(=O)Nc3ccc(cc3)n4cnnn4)CC2	BroadT	BRD-K30733398	BRD-K30733398-001-05-4	Asinex Ltd.	ASN 08248481			COc1ccccc1N1CCN(CC(=O)Nc2ccc(cc2)-n2cnnn2)CC1	InChI=1S/C20H23N7O2/c1-29-19-5-3-2-4-18(19)26-12-10-25(11-13-26)14-20(28)22-16-6-8-17(9-7-16)27-15-21-23-24-27/h2-9,15H,10-14H2,1H3,(H,22,28)	WIXNYRNPYLYCJE-UHFFFAOYSA-N	393.191323046							107083
MLS000849716	LSM-18438	SID26670416, BRD-A60330222	16682637	InChI=1S/C20H19N3O3/c24-19(21-11-15-5-3-9-25-15)13-7-8-16-17(10-13)22-23-18-6-2-1-4-14(18)12-26-20(16)23/h1-2,4,6-8,10,15H,3,5,9,11-12H2,(H,21,24)	PNBBJVGLWDXTFS-UHFFFAOYSA-N	O=C(NCC1CCCO1)c2ccc3c4OCc5ccccc5n4nc3c2	BroadT	BRD-A60330222	BRD-A60330222-001-05-6	University of California at Davis	JDB-009			O=C(NCC1CCCO1)c1ccc2c3OCc4ccccc4-n3nc2c1	InChI=1S/C20H19N3O3/c24-19(21-11-15-5-3-9-25-15)13-7-8-16-17(10-13)22-23-18-6-2-1-4-14(18)12-26-20(16)23/h1-2,4,6-8,10,15H,3,5,9,11-12H2,(H,21,24)	PNBBJVGLWDXTFS-UHFFFAOYSA-N	349.142641498							107084
N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2,6-dimethylquinolin-4-amine	LSM-15271	BRD-K15436786	719867	InChI=1S/C19H18N2O2/c1-12-3-5-16-15(9-12)17(10-13(2)20-16)21-14-4-6-18-19(11-14)23-8-7-22-18/h3-6,9-11H,7-8H2,1-2H3,(H,20,21)	NOGWKIKUGIOGRI-UHFFFAOYSA-N	Cc1ccc2nc(C)cc(Nc3ccc4OCCOc4c3)c2c1	BroadT	BRD-K15436786	BRD-K15436786-003-05-9	Specs	AF-399/13927270		Cl	Cc1ccc2nc(C)cc(Nc3ccc4OCCOc4c3)c2c1.Cl	InChI=1S/C19H18N2O2.ClH/c1-12-3-5-16-15(9-12)17(10-13(2)20-16)21-14-4-6-18-19(11-14)23-8-7-22-18;/h3-6,9-11H,7-8H2,1-2H3,(H,20,21);1H	YEKIWLHSSMREMG-UHFFFAOYSA-N	306.136827836							103918, 103918
2-[2-(1,2-Benzisoxazol-3-yl)acetyl]-n-(4-chlorophenyl)-1-hydrazinecarbothioamide	LSM-18439	SID24824384, BRD-K83575166	1482078	InChI=1S/C16H13ClN4O2S/c17-10-5-7-11(8-6-10)18-16(24)20-19-15(22)9-13-12-3-1-2-4-14(12)23-21-13/h1-8H,9H2,(H,19,22)(H2,18,20,24)	XUNYVVQWXXJYEQ-UHFFFAOYSA-N	Clc1ccc(NC(=S)NNC(=O)Cc2noc3ccccc23)cc1	BroadT	BRD-K83575166	BRD-K83575166-001-05-5	Key Organics Ltd.	11W-0357			Clc1ccc(NC(=S)NNC(=O)Cc2noc3ccccc23)cc1	InChI=1S/C16H13ClN4O2S/c17-10-5-7-11(8-6-10)18-16(24)20-19-15(22)9-13-12-3-1-2-4-14(12)23-21-13/h1-8H,9H2,(H,19,22)(H2,18,20,24)	XUNYVVQWXXJYEQ-UHFFFAOYSA-N	360.044774096							107085
2-[(4-Nitrobenzyl)thio]-1,3-benzoxazole	LSM-18440	2-(4-Nitrobenzylsulfanyl)Benzoxazole, BRD-K97850117	497456	InChI=1S/C14H10N2O3S/c17-16(18)11-7-5-10(6-8-11)9-20-14-15-12-3-1-2-4-13(12)19-14/h1-8H,9H2	OWRFFBWURVTRDI-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(CSc2oc3ccccc3n2)cc1	BroadT	BRD-K97850117	BRD-K97850117-001-05-6	ChemBridge Corporation	5209221			[O-][N+](=O)c1ccc(CSc2nc3ccccc3o2)cc1	InChI=1S/C14H10N2O3S/c17-16(18)11-7-5-10(6-8-11)9-20-14-15-12-3-1-2-4-13(12)19-14/h1-8H,9H2	OWRFFBWURVTRDI-UHFFFAOYSA-N	286.04121289							107086
5312-06-1	LSM-18441	SID7975917, BRD-K67171928	2197839	InChI=1S/C14H17NO3S/c1-2-3-4-7-10-17-14(16)19-13-15-11-8-5-6-9-12(11)18-13/h5-6,8-9H,2-4,7,10H2,1H3	IRCNGYPTZXRGFC-UHFFFAOYSA-N	CCCCCCOC(=O)Sc1oc2ccccc2n1	BroadT	BRD-K67171928	BRD-K67171928-001-06-0	ChemBridge Corporation	5312061			CCCCCCOC(=O)Sc1nc2ccccc2o1	InChI=1S/C14H17NO3S/c1-2-3-4-7-10-17-14(16)19-13-15-11-8-5-6-9-12(11)18-13/h5-6,8-9H,2-4,7,10H2,1H3	IRCNGYPTZXRGFC-UHFFFAOYSA-N	279.092914104							107087
2L-014	LSM-18442	SID17409441, BRD-K75102759	1471176	InChI=1S/C18H11ClF3N5OS/c1-28-12-4-2-10(3-5-12)14-6-7-23-16-25-17(26-27(14)16)29-15-13(19)8-11(9-24-15)18(20,21)22/h2-9H,1H3	KIMKGQVCXHWZFA-UHFFFAOYSA-N	COc1ccc(cc1)c2ccnc3nc(Sc4ncc(cc4Cl)C(F)(F)F)nn23	BroadT	BRD-K75102759	BRD-K75102759-001-05-1	Key Organics Ltd.	2L-014			COc1ccc(cc1)-c1ccnc2nc(Sc3ncc(cc3Cl)C(F)(F)F)nn12	InChI=1S/C18H11ClF3N5OS/c1-28-12-4-2-10(3-5-12)14-6-7-23-16-25-17(26-27(14)16)29-15-13(19)8-11(9-24-15)18(20,21)22/h2-9H,1H3	KIMKGQVCXHWZFA-UHFFFAOYSA-N	437.032493022							107088
MLS000768943	LSM-43765	SID26666494, BRD-K06945574	5926607	InChI=1S/C17H12ClNO2/c1-11-4-6-14-13(9-11)10-12(17(18)19-14)5-7-15(20)16-3-2-8-21-16/h2-10H,1H3/b7-5+	NLZAXTYIQKEHKH-FNORWQNLSA-N	Cc1ccc2nc(Cl)c(\C=C\C(=O)c3occc3)cc2c1	BroadT	BRD-K06945574	BRD-K06945574-001-05-0	InterBioScreen Ltd.	STOCK3S-41694			Cc1ccc2nc(Cl)c(\C=C\C(=O)c3ccco3)cc2c1	InChI=1S/C17H12ClNO2/c1-11-4-6-14-13(9-11)10-12(17(18)19-14)5-7-15(20)16-3-2-8-21-16/h2-10H,1H3/b7-5+	NLZAXTYIQKEHKH-FNORWQNLSA-N	297.055656344							
STK116541	LSM-18444	SID24788810, BRD-K59864142	2171218	InChI=1S/C20H20N4O5S2/c1-3-29-18(28)15-11(2)21-20(31-15)22-14(25)10-30-19-23-16(26)13(17(27)24-19)9-12-7-5-4-6-8-12/h4-8H,3,9-10H2,1-2H3,(H,21,22,25)(H2,23,24,26,27)	QUQPWHIAVSOQNF-UHFFFAOYSA-N	CCOC(=O)c1sc(NC(=O)CSc2nc(O)c(Cc3ccccc3)c(O)n2)nc1C	BroadT	BRD-K59864142	BRD-K59864142-001-05-2	ChemBridge Corporation	7091233			CCOC(=O)c1sc(NC(=O)CSc2nc(O)c(Cc3ccccc3)c(O)n2)nc1C	InChI=1S/C20H20N4O5S2/c1-3-29-18(28)15-11(2)21-20(31-15)22-14(25)10-30-19-23-16(26)13(17(27)24-19)9-12-7-5-4-6-8-12/h4-8H,3,9-10H2,1-2H3,(H,21,22,25)(H2,23,24,26,27)	QUQPWHIAVSOQNF-UHFFFAOYSA-N	460.08751116							107090
AC1MXJ3S	LSM-18445	BRD-K85858150	3816389	InChI=1S/C10H13N5O4/c1-18-8-4-3-7(9(5-8)19-2)6-12-13-10(11)14-15(16)17/h3-6H,1-2H3,(H3,11,13,14)	JBGNSGHDTKKNKE-UHFFFAOYSA-N	COc1ccc(C=NN=C(N)N[N+](=O)[O-])c(OC)c1	BroadT	BRD-K85858150	BRD-K85858150-001-06-9	InterBioScreen Ltd.	STOCK3S-13897			COc1ccc(C=NN=C(N)N[N+]([O-])=O)c(OC)c1	InChI=1S/C10H13N5O4/c1-18-8-4-3-7(9(5-8)19-2)6-12-13-10(11)14-15(16)17/h3-6H,1-2H3,(H3,11,13,14)	JBGNSGHDTKKNKE-UHFFFAOYSA-N	267.096753946							107091
MLS000777414	LSM-43766	SID26667225, BRD-K93579229	746614	InChI=1S/C18H17N3O3/c1-19(2)11-10-16-18(21(23)24)15-9-8-14(22)12-17(15)20(16)13-6-4-3-5-7-13/h3-12,22H,1-2H3/b11-10+	FHSALPVEMLZVON-ZHACJKMWSA-N	CN(C)\C=C\c1c(c2ccc(O)cc2n1c3ccccc3)[N+](=O)[O-]	BroadT	BRD-K93579229	BRD-K93579229-001-07-6	InterBioScreen Ltd.	STOCK1S-32230			CN(C)\C=C\c1c([N+]([O-])=O)c2ccc(O)cc2n1-c1ccccc1	InChI=1S/C18H17N3O3/c1-19(2)11-10-16-18(21(23)24)15-9-8-14(22)12-17(15)20(16)13-6-4-3-5-7-13/h3-12,22H,1-2H3/b11-10+	FHSALPVEMLZVON-ZHACJKMWSA-N	323.126991434							
MLS000579119	LSM-18447	SID17412335, BRD-A91387504	2858902	InChI=1S/C18H15ClN2O4/c1-25-17(23)15-11-18(24,13-5-3-2-4-6-13)21(20-15)16(22)12-7-9-14(19)10-8-12/h2-10,24H,11H2,1H3	CNQJGOUWPQEPPO-UHFFFAOYSA-N	COC(=O)C1=NN(C(=O)c2ccc(Cl)cc2)C(O)(C1)c3ccccc3	BroadT	BRD-A91387504	BRD-A91387504-001-06-6	ChemBridge Corporation	5657967			COC(=O)C1=NN(C(=O)c2ccc(Cl)cc2)C(O)(C1)c1ccccc1	InChI=1S/C18H15ClN2O4/c1-25-17(23)15-11-18(24,13-5-3-2-4-6-13)21(20-15)16(22)12-7-9-14(19)10-8-12/h2-10,24H,11H2,1H3	CNQJGOUWPQEPPO-UHFFFAOYSA-N	358.07203469							107093
ASN 06535482	LSM-15272	BRD-K16509257	3221537	InChI=1S/C17H21N3O2S/c1-4-22-14-5-6-15-12(10-14)9-13-11-20(7-8-21-3)17(18-2)23-16(13)19-15/h5-6,9-10H,4,7-8,11H2,1-3H3	QMFOXZXFXUJYET-UHFFFAOYSA-N	CCOc1ccc2nc3SC(=NC)N(CCOC)Cc3cc2c1	BroadT	BRD-K16509257	BRD-K16509257-003-05-2	Asinex Ltd.	ASN 06535482		Cl	CCOc1ccc2nc3SC(=NC)N(CCOC)Cc3cc2c1.Cl	InChI=1S/C17H21N3O2S.ClH/c1-4-22-14-5-6-15-12(10-14)9-13-11-20(7-8-21-3)17(18-2)23-16(13)19-15;/h5-6,9-10H,4,7-8,11H2,1-3H3;1H	UHFWIXBNFFKSRA-UHFFFAOYSA-N	331.135447632							103919
SMR000121242	LSM-18448	SID17388171, BRD-K67716771	2211247	InChI=1S/C20H13N5O2/c26-19(18-21-11-22-25-18)23-13-8-9-17-16(10-13)24-20(27-17)15-7-3-5-12-4-1-2-6-14(12)15/h1-11H,(H,23,26)(H,21,22,25)	WDSLCEDNJCJNNN-UHFFFAOYSA-N	O=C(Nc1ccc2oc(nc2c1)c3cccc4ccccc34)c5nc[nH]n5	BroadT	BRD-K67716771	BRD-K67716771-001-07-8	Asinex Ltd.	BAS 07603025			O=C(Nc1ccc2oc(nc2c1)-c1cccc2ccccc12)c1nc[nH]n1	InChI=1S/C20H13N5O2/c26-19(18-21-11-22-25-18)23-13-8-9-17-16(10-13)24-20(27-17)15-7-3-5-12-4-1-2-6-14(12)15/h1-11H,(H,23,26)(H,21,22,25)	WDSLCEDNJCJNNN-UHFFFAOYSA-N	355.106924706							107094
1-(1,2,3-Benzothiadiazol-5-yl)-3-naphthalen-1-ylurea	LSM-18449	SID14733543, BRD-K89619254	1282288	InChI=1S/C17H12N4OS/c22-17(18-12-8-9-16-15(10-12)20-21-23-16)19-14-7-3-5-11-4-1-2-6-13(11)14/h1-10H,(H2,18,19,22)	YYPFFGGDEUTASO-UHFFFAOYSA-N	O=C(Nc1ccc2snnc2c1)Nc3cccc4ccccc34	BroadT	BRD-K89619254	BRD-K89619254-001-05-8	ChemBridge Corporation	7096432			O=C(Nc1ccc2snnc2c1)Nc1cccc2ccccc12	InChI=1S/C17H12N4OS/c22-17(18-12-8-9-16-15(10-12)20-21-23-16)19-14-7-3-5-11-4-1-2-6-13(11)14/h1-10H,(H2,18,19,22)	YYPFFGGDEUTASO-UHFFFAOYSA-N	320.073181734							107095
SMR000109040	LSM-43767	SID7977314, BRD-K62275715	2297013	InChI=1S/C15H13NO4S2/c1-3-4-21-15-16-10(14(17)22-15)5-9-6-11(18-2)13-12(7-9)19-8-20-13/h3,5-7H,1,4,8H2,2H3/b10-5-	ABLYHHAPJOFYQH-YHYXMXQVSA-N	COc1cc(\C=C\2/N=C(SCC=C)SC2=O)cc3OCOc13	BroadT	BRD-K62275715	BRD-K62275715-001-05-3	ChemBridge Corporation	7004317			COc1cc(\C=C2/N=C(SCC=C)SC2=O)cc2OCOc12	InChI=1S/C15H13NO4S2/c1-3-4-21-15-16-10(14(17)22-15)5-9-6-11(18-2)13-12(7-9)19-8-20-13/h3,5-7H,1,4,8H2,2H3/b10-5-	ABLYHHAPJOFYQH-YHYXMXQVSA-N	335.028599286							
AC1N8OC7	LSM-18451	BRD-K62766089	4321955	InChI=1S/C18H14Cl2N4O2/c1-11-15(17(20)24(23-11)13-5-3-2-4-6-13)10-21-22-12-7-8-16(19)14(9-12)18(25)26/h2-10,22H,1H3,(H,25,26)	KWAMLKJCMIPJPG-UHFFFAOYSA-N	Cc1nn(c(Cl)c1C=NNc2ccc(Cl)c(c2)C(=O)O)c3ccccc3	BroadT	BRD-K62766089	BRD-K62766089-001-06-7	Enamine Ltd.	T0507-6686			Cc1nn(c(Cl)c1C=NNc1ccc(Cl)c(c1)C(O)=O)-c1ccccc1	InChI=1S/C18H14Cl2N4O2/c1-11-15(17(20)24(23-11)13-5-3-2-4-6-13)10-21-22-12-7-8-16(19)14(9-12)18(25)26/h2-10,22H,1H3,(H,25,26)	KWAMLKJCMIPJPG-UHFFFAOYSA-N	388.049381148							107097
ASN 13847384	LSM-18452	SID49728869, BRD-K29197136	6498439	InChI=1S/C21H17FN4O3S/c1-29-16-5-3-2-4-14(16)23-17(27)11-26-15-7-6-12(22)10-13(15)18-19(26)20(28)25-8-9-30-21(25)24-18/h2-7,10H,8-9,11H2,1H3,(H,23,27)	MJIKQZYDJKDBGN-UHFFFAOYSA-N	COc1ccccc1NC(=O)Cn2c3C(=O)N4CCSC4=Nc3c5cc(F)ccc25	BroadT	BRD-K29197136	BRD-K29197136-001-05-2	Asinex Ltd.	ASN 13847384			COc1ccccc1NC(=O)Cn1c2ccc(F)cc2c2nc3SCCn3c(=O)c12	InChI=1S/C21H17FN4O3S/c1-29-16-5-3-2-4-14(16)23-17(27)11-26-15-7-6-12(22)10-13(15)18-19(26)20(28)25-8-9-30-21(25)24-18/h2-7,10H,8-9,11H2,1H3,(H,23,27)	MJIKQZYDJKDBGN-UHFFFAOYSA-N	424.100539334							107098
MLS000674221	LSM-18453	SID24796235, BRD-A44863846	2989049	InChI=1S/C15H19N3O4S2/c1-9(2)22-12(19)8-10-13(20)16-5-6-18(10)15(23)17-14(21)11-4-3-7-24-11/h3-4,7,9-10H,5-6,8H2,1-2H3,(H,16,20)(H,17,21,23)	IWJZMWXXLWXWNA-UHFFFAOYSA-N	CC(C)OC(=O)CC1N(CCNC1=O)C(=S)NC(=O)c2cccs2	BroadT	BRD-A44863846	BRD-A44863846-001-11-1	ChemBridge Corporation	9000617			CC(C)OC(=O)CC1N(CCNC1=O)C(=S)NC(=O)c1cccs1	InChI=1S/C15H19N3O4S2/c1-9(2)22-12(19)8-10-13(20)16-5-6-18(10)15(23)17-14(21)11-4-3-7-24-11/h3-4,7,9-10H,5-6,8H2,1-2H3,(H,16,20)(H,17,21,23)	IWJZMWXXLWXWNA-UHFFFAOYSA-N	369.081697498							107099
AC1NVWMA	LSM-43768	SID26659933, BRD-K13454229	5605722	InChI=1S/C20H22N4O2S/c1-26-17-8-5-16(6-9-17)7-10-19(25)22-20(27)24-14-12-23(13-15-24)18-4-2-3-11-21-18/h2-11H,12-15H2,1H3,(H,22,25,27)/b10-7+	QITZZAKZEOZKFK-JXMROGBWSA-N	COc1ccc(\C=C\C(=O)NC(=S)N2CCN(CC2)c3ccccn3)cc1	BroadT	BRD-K13454229	BRD-K13454229-001-04-6	InterBioScreen Ltd.	STOCK2S-75660			COc1ccc(\C=C\C(=O)NC(=S)N2CCN(CC2)c2ccccn2)cc1	InChI=1S/C20H22N4O2S/c1-26-17-8-5-16(6-9-17)7-10-19(25)22-20(27)24-14-12-23(13-15-24)18-4-2-3-11-21-18/h2-11H,12-15H2,1H3,(H,22,25,27)/b10-7+	QITZZAKZEOZKFK-JXMROGBWSA-N	382.146346674							
Acetic acid 4-[acetyl-(4-chloro-benzenesulfonyl)-amino]-naphthalen-1-yl ester	LSM-18455	SID49641513, BRD-K33997700	2835151	InChI=1S/C20H16ClNO5S/c1-13(23)22(28(25,26)16-9-7-15(21)8-10-16)19-11-12-20(27-14(2)24)18-6-4-3-5-17(18)19/h3-12H,1-2H3	CVUOPNNMCJKVDV-UHFFFAOYSA-N	CC(=O)Oc1ccc(N(C(=O)C)S(=O)(=O)c2ccc(Cl)cc2)c3ccccc13	BroadT	BRD-K33997700	BRD-K33997700-001-05-5	Asinex Ltd.	BAS 00350677			CC(=O)Oc1ccc(N(C(C)=O)S(=O)(=O)c2ccc(Cl)cc2)c2ccccc12	InChI=1S/C20H16ClNO5S/c1-13(23)22(28(25,26)16-9-7-15(21)8-10-16)19-11-12-20(27-14(2)24)18-6-4-3-5-17(18)19/h3-12H,1-2H3	CVUOPNNMCJKVDV-UHFFFAOYSA-N	417.043771022							107101
AC1OBK7N	LSM-18456	SID7970177, BRD-K39183317	6824668	InChI=1S/C15H18N4S/c1-3-4-9-20-15-18-17-14(19(15)2)12-10-16-13-8-6-5-7-11(12)13/h5-8,10,16H,3-4,9H2,1-2H3	ZIWGBDHHSXSEAX-UHFFFAOYSA-N	CCCCSc1nnc(c2c[nH]c3ccccc23)n1C	BroadT	BRD-K39183317	BRD-K39183317-001-05-1	Life Chemicals Inc.	F0653-0005			CCCCSc1nnc(-c2c[nH]c3ccccc23)n1C	InChI=1S/C15H18N4S/c1-3-4-9-20-15-18-17-14(19(15)2)12-10-16-13-8-6-5-7-11(12)13/h5-8,10,16H,3-4,9H2,1-2H3	ZIWGBDHHSXSEAX-UHFFFAOYSA-N	286.125217306							
2-Chloro-4,5-difluoro-n-(5-methylpyridin-2-yl)benzamide	LSM-18457	SID24807233, BRD-K86495486	878799	InChI=1S/C13H9ClF2N2O/c1-7-2-3-12(17-6-7)18-13(19)8-4-10(15)11(16)5-9(8)14/h2-6H,1H3,(H,17,18,19)	LPWXUONYIRUZDS-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2cc(F)c(F)cc2Cl)nc1	BroadT	BRD-K86495486	BRD-K86495486-001-05-6	Asinex Ltd.	BAS 04847923			Cc1ccc(NC(=O)c2cc(F)c(F)cc2Cl)nc1	InChI=1S/C13H9ClF2N2O/c1-7-2-3-12(17-6-7)18-13(19)8-4-10(15)11(16)5-9(8)14/h2-6H,1H3,(H,17,18,19)	LPWXUONYIRUZDS-UHFFFAOYSA-N	282.037147038							107103
AC1NJYSW	LSM-18458	SID14743757, BRD-K22613457	4879767	InChI=1S/C19H14N2O3/c1-23-18-9-14-13-6-2-3-7-16(13)24-17(14)10-15(18)21-19(22)12-5-4-8-20-11-12/h2-11H,1H3,(H,21,22)	IUBZSFCXLOOQCL-UHFFFAOYSA-N	COc1cc2c(oc3ccccc23)cc1NC(=O)c4cccnc4	BroadT	BRD-K22613457	BRD-K22613457-001-06-4	Enamine Ltd.	T5317430			COc1cc2c(cc1NC(=O)c1cccnc1)oc1ccccc21	InChI=1S/C19H14N2O3/c1-23-18-9-14-13-6-2-3-7-16(13)24-17(14)10-15(18)21-19(22)12-5-4-8-20-11-12/h2-11H,1H3,(H,21,22)	IUBZSFCXLOOQCL-UHFFFAOYSA-N	318.100442328							107104
AC1O9ZRB	LSM-18459	BRD-K33978208	6742292	InChI=1S/C11H11N3O4/c15-10-4-3-9(14(17)18)5-8(10)6-12-13-11(16)7-1-2-7/h3-7,15H,1-2H2,(H,13,16)	FYVWTHHBLWDOOL-UHFFFAOYSA-N	Oc1ccc(cc1C=NNC(=O)C2CC2)[N+](=O)[O-]	BroadT	BRD-K33978208	BRD-K33978208-001-05-2	Specs	AN-329/40279807			Oc1ccc(cc1C=NNC(=O)C1CC1)[N+]([O-])=O	InChI=1S/C11H11N3O4/c15-10-4-3-9(14(17)18)5-8(10)6-12-13-11(16)7-1-2-7/h3-7,15H,1-2H2,(H,13,16)	FYVWTHHBLWDOOL-UHFFFAOYSA-N	249.074955862							
N1-[3-(Trifluoromethyl)phenyl]-2-(tert-butyl)hydrazine-1-carbothioamide	LSM-18460	SID26731465, BRD-K55560514	2731986	InChI=1S/C12H16F3N3S/c1-11(2,3)18-17-10(19)16-9-6-4-5-8(7-9)12(13,14)15/h4-7,18H,1-3H3,(H2,16,17,19)	FJCYFMUEKMQFSY-UHFFFAOYSA-N	CC(C)(C)NN=C(S)Nc1cccc(c1)C(F)(F)F	BroadT	BRD-K55560514	BRD-K55560514-001-06-8	Maybridge	S 07296			CC(C)(C)NN=C(S)Nc1cccc(c1)C(F)(F)F	InChI=1S/C12H16F3N3S/c1-11(2,3)18-17-10(19)16-9-6-4-5-8(7-9)12(13,14)15/h4-7,18H,1-3H3,(H2,16,17,19)	FJCYFMUEKMQFSY-UHFFFAOYSA-N	291.101702832							107106
MLS000523521	LSM-18461	SID14723822, BRD-K05038253	1085355	InChI=1S/C15H14ClN5O2/c1-2-8-21-19-15(18-20-21)17-14(22)13-7-6-12(23-13)10-4-3-5-11(16)9-10/h3-7,9H,2,8H2,1H3,(H,17,19,22)	FSXQCTWKDDGIGU-UHFFFAOYSA-N	CCCn1nnc(NC(=O)c2oc(cc2)c3cccc(Cl)c3)n1	BroadT	BRD-K05038253	BRD-K05038253-001-05-3	Asinex Ltd.	BAS 06669173			CCCn1nnc(NC(=O)c2ccc(o2)-c2cccc(Cl)c2)n1	InChI=1S/C15H14ClN5O2/c1-2-8-21-19-15(18-20-21)17-14(22)13-7-6-12(23-13)10-4-3-5-11(16)9-10/h3-7,9H,2,8H2,1H3,(H,17,19,22)	FSXQCTWKDDGIGU-UHFFFAOYSA-N	331.083602448							107107
78979-64-3	LSM-18462	SID24820093, BRD-K27799167	3742475	InChI=1S/C12H10N2O4S/c1-2-18-12(15)10-7-19-11(13-10)8-3-5-9(6-4-8)14(16)17/h3-7H,2H2,1H3	XQBNPFPSRBLFHV-UHFFFAOYSA-N	CCOC(=O)c1csc(n1)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K27799167	BRD-K27799167-001-05-9	Key Organics Ltd.	2G-403S			CCOC(=O)c1csc(n1)-c1ccc(cc1)[N+]([O-])=O	InChI=1S/C12H10N2O4S/c1-2-18-12(15)10-7-19-11(13-10)8-3-5-9(6-4-8)14(16)17/h3-7H,2H2,1H3	XQBNPFPSRBLFHV-UHFFFAOYSA-N	278.03612751							107108
AH-487/41280522	LSM-18463	SID7974936, BRD-K30724865	602131	InChI=1S/C14H18N2O2S3/c1-19-14-15-12-8-7-11(9-13(12)20-14)21(17,18)16-10-5-3-2-4-6-10/h7-10,16H,2-6H2,1H3	OQZHWXPRMUYGEB-UHFFFAOYSA-N	CSc1nc2ccc(cc2s1)S(=O)(=O)NC3CCCCC3	BroadT	BRD-K30724865	BRD-K30724865-001-06-5	ChemBridge Corporation	7111408			CSc1nc2ccc(cc2s1)S(=O)(=O)NC1CCCCC1	InChI=1S/C14H18N2O2S3/c1-19-14-15-12-8-7-11(9-13(12)20-14)21(17,18)16-10-5-3-2-4-6-10/h7-10,16H,2-6H2,1H3	OQZHWXPRMUYGEB-UHFFFAOYSA-N	342.053039906							107109
F1201-0304	LSM-18464	SID4248475, BRD-K72500001	3242544	InChI=1S/C19H22N4O2S/c1-14-16-13-17(18(24)20-7-8-22-9-11-25-12-10-22)26-19(16)23(21-14)15-5-3-2-4-6-15/h2-6,13H,7-12H2,1H3,(H,20,24)	AITKNUAVRFKATC-UHFFFAOYSA-N	Cc1nn(c2ccccc2)c3sc(cc13)C(=O)NCCN4CCOCC4	BroadT	BRD-K72500001	BRD-K72500001-001-05-5	ChemDiv Inc.	5222-3196			Cc1nn(-c2ccccc2)c2sc(cc12)C(=O)NCCN1CCOCC1	InChI=1S/C19H22N4O2S/c1-14-16-13-17(18(24)20-7-8-22-9-11-25-12-10-22)26-19(16)23(21-14)15-5-3-2-4-6-15/h2-6,13H,7-12H2,1H3,(H,20,24)	AITKNUAVRFKATC-UHFFFAOYSA-N	370.146346674							107110
SMR000206319	LSM-18465	SID17510578, BRD-A73166520	12005270	InChI=1S/C23H20ClN3O3S/c1-13-5-7-16(8-6-13)27-20(28)18-17-9-10-23(30-17,19(18)21(27)29)12-25-22(31)26-15-4-2-3-14(24)11-15/h2-11,17-19H,12H2,1H3,(H2,25,26,31)	VRENHHWLKYOLMR-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=O)C3C4OC(CN=C(S)Nc5cccc(Cl)c5)(C=C4)C3C2=O	BroadT	BRD-A73166520	BRD-A73166520-001-06-6	ChemDiv Inc.	C344-0004			Cc1ccc(cc1)N1C(=O)C2C3OC(CN=C(S)Nc4cccc(Cl)c4)(C=C3)C2C1=O	InChI=1S/C23H20ClN3O3S/c1-13-5-7-16(8-6-13)27-20(28)18-17-9-10-23(30-17,19(18)21(27)29)12-25-22(31)26-15-4-2-3-14(24)11-15/h2-11,17-19H,12H2,1H3,(H2,25,26,31)	VRENHHWLKYOLMR-UHFFFAOYSA-N	453.09138993							107111
AC1N7NFR	LSM-18466	BRD-K43842271	4305237	InChI=1S/C15H15N3O4/c19-14(18-17-9-13-7-4-8-21-13)10-16-15(20)11-22-12-5-2-1-3-6-12/h1-9H,10-11H2,(H,16,20)(H,18,19)	DKBWQHKXQFZEAM-UHFFFAOYSA-N	O=C(CNC(=O)COc1ccccc1)NN=Cc2occc2	BroadT	BRD-K43842271	BRD-K43842271-001-05-0	Life Chemicals Inc.	F0474-0628			O=C(COc1ccccc1)NCC(=O)NN=Cc1ccco1	InChI=1S/C15H15N3O4/c19-14(18-17-9-13-7-4-8-21-13)10-16-15(20)11-22-12-5-2-1-3-6-12/h1-9H,10-11H2,(H,16,20)(H,18,19)	DKBWQHKXQFZEAM-UHFFFAOYSA-N	301.10625599							107112
AM-879/40742518	LSM-18467	SID14740619, BRD-K30757915	1207633	InChI=1S/C21H18N2O2S/c24-19(13-25-16-6-2-1-3-7-16)23-21(26)22-18-12-11-15-10-9-14-5-4-8-17(18)20(14)15/h1-8,11-12H,9-10,13H2,(H2,22,23,24,26)	JRCCYPPFRKKNHT-UHFFFAOYSA-N	O=C(COc1ccccc1)NC(=S)Nc2ccc3CCc4cccc2c34	BroadT	BRD-K30757915	BRD-K30757915-001-05-7	ChemBridge Corporation	6594295			O=C(COc1ccccc1)NC(=S)Nc1ccc2CCc3cccc1c23	InChI=1S/C21H18N2O2S/c24-19(13-25-16-6-2-1-3-7-16)23-21(26)22-18-12-11-15-10-9-14-5-4-8-17(18)20(14)15/h1-8,11-12H,9-10,13H2,(H2,22,23,24,26)	JRCCYPPFRKKNHT-UHFFFAOYSA-N	362.108898526							107113
MLS000552808	LSM-18468	SID14742066, BRD-K36842948	765480	InChI=1S/C17H14N4OS/c1-11-8-9-20(18-11)16(22)15-10-14-12(2)19-21(17(14)23-15)13-6-4-3-5-7-13/h3-10H,1-2H3	QGUDJZHCGYSSSX-UHFFFAOYSA-N	Cc1ccn(n1)C(=O)c2cc3c(C)nn(c4ccccc4)c3s2	BroadT	BRD-K36842948	BRD-K36842948-001-05-2	InterBioScreen Ltd.	STOCK2S-18650			Cc1ccn(n1)C(=O)c1cc2c(C)nn(-c3ccccc3)c2s1	InChI=1S/C17H14N4OS/c1-11-8-9-20(18-11)16(22)15-10-14-12(2)19-21(17(14)23-15)13-6-4-3-5-7-13/h3-10H,1-2H3	QGUDJZHCGYSSSX-UHFFFAOYSA-N	322.088831798							107114
F0612-0189	LSM-18469	SID7969932, BRD-A07573940	3455600	InChI=1S/C17H25N3O4S2/c1-11-8-13-15(26-11)16(22)20(5-7-23-2)17(19-13)25-10-14(21)18-9-12-4-3-6-24-12/h11-12H,3-10H2,1-2H3,(H,18,21)	SMUZSXNGFPOHJN-UHFFFAOYSA-N	COCCN1C(=O)C2=C(CC(C)S2)N=C1SCC(=O)NCC3CCCO3	BroadT	BRD-A07573940	BRD-A07573940-001-05-8	Life Chemicals Inc.	F0612-0189			COCCn1c(SCC(=O)NCC2CCCO2)nc2CC(C)Sc2c1=O	InChI=1S/C17H25N3O4S2/c1-11-8-13-15(26-11)16(22)20(5-7-23-2)17(19-13)25-10-14(21)18-9-12-4-3-6-24-12/h11-12H,3-10H2,1-2H3,(H,18,21)	SMUZSXNGFPOHJN-UHFFFAOYSA-N	399.12864769							107115
MLS000779518	LSM-18470	SID26659473, BRD-K72102394	1904499	InChI=1S/C20H25N3O2S/c1-15(2)25-18-11-8-16(9-12-18)10-13-19(24)22-23-20(26)21-14-17-6-4-3-5-7-17/h3-9,11-12,15H,10,13-14H2,1-2H3,(H,22,24)(H2,21,23,26)	BPERMVGYJFBUPW-UHFFFAOYSA-N	CC(C)Oc1ccc(CCC(=O)NN=C(S)NCc2ccccc2)cc1	BroadT	BRD-K72102394	BRD-K72102394-001-05-5	InterBioScreen Ltd.	STOCK3S-11189			CC(C)Oc1ccc(CCC(=O)NN=C(S)NCc2ccccc2)cc1	InChI=1S/C20H25N3O2S/c1-15(2)25-18-11-8-16(9-12-18)10-13-19(24)22-23-20(26)21-14-17-6-4-3-5-7-17/h3-9,11-12,15H,10,13-14H2,1-2H3,(H,22,24)(H2,21,23,26)	BPERMVGYJFBUPW-UHFFFAOYSA-N	371.16674776							107116
AC1LJA23	LSM-18471	BRD-K76285604	919679	InChI=1S/C13H16N2O4/c1-13(2,3)19-12(18)15-14-8-9-4-6-10(7-5-9)11(16)17/h4-8H,1-3H3,(H,15,18)(H,16,17)	GVYOUSIHERXGRQ-UHFFFAOYSA-N	CC(C)(C)OC(=O)NN=Cc1ccc(cc1)C(=O)O	BroadT	BRD-K76285604	BRD-K76285604-001-05-0	InterBioScreen Ltd.	STOCK2S-09860			CC(C)(C)OC(=O)NN=Cc1ccc(cc1)C(O)=O	InChI=1S/C13H16N2O4/c1-13(2,3)19-12(18)15-14-8-9-4-6-10(7-5-9)11(16)17/h4-8H,1-3H3,(H,15,18)(H,16,17)	GVYOUSIHERXGRQ-UHFFFAOYSA-N	264.111007012							107117
Tetramethyl 7,9-dimethyl-9ah-quinolizine-1,2,3,4-tetracarboxylate	LSM-18472	SID22412066, BRD-A18130483	101196	InChI=1S/C19H21NO8/c1-9-7-10(2)14-12(17(22)26-4)11(16(21)25-3)13(18(23)27-5)15(19(24)28-6)20(14)8-9/h7-8,14H,1-6H3	NIAYDOWGZDIMJA-UHFFFAOYSA-N	COC(=O)C1=C(C(=O)OC)C(=C(N2C=C(C)C=C(C)C12)C(=O)OC)C(=O)OC	BroadT	BRD-A18130483	BRD-A18130483-001-05-7	Specs	AO-079/15259048			COC(=O)C1=C(C(=O)OC)C(C(=O)OC)=C(N2C=C(C)C=C(C)C12)C(=O)OC	InChI=1S/C19H21NO8/c1-9-7-10(2)14-12(17(22)26-4)11(16(21)25-3)13(18(23)27-5)15(19(24)28-6)20(14)8-9/h7-8,14H,1-6H3	NIAYDOWGZDIMJA-UHFFFAOYSA-N	391.126716642							107118
AC1LF00E	LSM-18473	BRD-M24734294	695304	InChI=1S/C20H17N5O/c1-12-8-9-16-15(10-12)18(26)24-20(22-16)25-19-21-13(2)11-17(23-19)14-6-4-3-5-7-14/h3-11H,1-2H3,(H2,21,22,23,24,25,26)	WMSAIFRPFRTZNA-UHFFFAOYSA-N	Cc1ccc2nc(Nc3nc(C)cc(n3)c4ccccc4)nc(O)c2c1	BroadT	BRD-M24734294	BRD-M24734294-001-05-3	InterBioScreen Ltd.	STOCK1S-67925		C1COCCO1.Cc1ccc2nc(Nc3nc(C)cc(n3)-c3ccccc3)nc(O)c2c1	C1COCCO1.Cc1ccc2nc(Nc3nc(C)cc(n3)-c3ccccc3)nc(O)c2c1	InChI=1S/C20H17N5O.C4H8O2/c1-12-8-9-16-15(10-12)18(26)24-20(22-16)25-19-21-13(2)11-17(23-19)14-6-4-3-5-7-14;1-2-6-4-3-5-1/h3-11H,1-2H3,(H2,21,22,23,24,25,26);1-4H2	VGKWJLZBOAMQAY-UHFFFAOYSA-N	343.143310214							107119
ZINC02421365	LSM-18474	SID26659816, BRD-K46160960	2018169	InChI=1S/C15H17BrN4O3/c1-15(2,3)13-11(20(22)23)12(19(4)18-13)14(21)17-10-7-5-9(16)6-8-10/h5-8H,1-4H3,(H,17,21)	XLJFYJSUESXBDS-UHFFFAOYSA-N	Cn1nc(c(c1C(=O)Nc2ccc(Br)cc2)[N+](=O)[O-])C(C)(C)C	BroadT	BRD-K46160960	BRD-K46160960-001-05-0	InterBioScreen Ltd.	STOCK4S-70751			Cn1nc(c(c1C(=O)Nc1ccc(Br)cc1)[N+]([O-])=O)C(C)(C)C	InChI=1S/C15H17BrN4O3/c1-15(2,3)13-11(20(22)23)12(19(4)18-13)14(21)17-10-7-5-9(16)6-8-10/h5-8H,1-4H3,(H,17,21)	XLJFYJSUESXBDS-UHFFFAOYSA-N	380.048403044							107120
AC1MKWDB	LSM-18475	SID24807404, BRD-K14898660	3210780	InChI=1S/C23H28N4O6/c1-15-10-20(26-33-15)25-21(28)8-9-23(30)27(13-22(29)24-17-4-2-3-5-17)12-16-6-7-18-19(11-16)32-14-31-18/h6-7,10-11,17H,2-5,8-9,12-14H2,1H3,(H,24,29)(H,25,26,28)	DDJRNJGPHNFEIV-UHFFFAOYSA-N	Cc1onc(NC(=O)CCC(=O)N(CC(=O)NC2CCCC2)Cc3ccc4OCOc4c3)c1	BroadT	BRD-K14898660	BRD-K14898660-001-05-6	Asinex Ltd.	ASN 05570388			Cc1cc(NC(=O)CCC(=O)N(CC(=O)NC2CCCC2)Cc2ccc3OCOc3c2)no1	InChI=1S/C23H28N4O6/c1-15-10-20(26-33-15)25-21(28)8-9-23(30)27(13-22(29)24-17-4-2-3-5-17)12-16-6-7-18-19(11-16)32-14-31-18/h6-7,10-11,17H,2-5,8-9,12-14H2,1H3,(H,24,29)(H,25,26,28)	DDJRNJGPHNFEIV-UHFFFAOYSA-N	456.200884656							107121
MLS000529793	LSM-18476	SID14740272, BRD-K26615633	3659304	InChI=1S/C14H13N3OS2/c1-17-8-12(10-4-2-3-5-11(10)17)20-9-13(18)16-14-15-6-7-19-14/h2-8H,9H2,1H3,(H,15,16,18)	VPRQXDRHRDWCGT-UHFFFAOYSA-N	Cn1cc(SCC(=O)Nc2nccs2)c3ccccc13	BroadT	BRD-K26615633	BRD-K26615633-001-05-4	Life Chemicals Inc.	F0545-0801			Cn1cc(SCC(=O)Nc2nccs2)c2ccccc12	InChI=1S/C14H13N3OS2/c1-17-8-12(10-4-2-3-5-11(10)17)20-9-13(18)16-14-15-6-7-19-14/h2-8H,9H2,1H3,(H,15,16,18)	VPRQXDRHRDWCGT-UHFFFAOYSA-N	303.050003446							107122
N-Benzoyl-n'-(5-quinolinyl)thiourea	LSM-18477	SID24818158, BRD-K09485859	3810050	InChI=1S/C17H13N3OS/c21-16(12-6-2-1-3-7-12)20-17(22)19-15-10-4-9-14-13(15)8-5-11-18-14/h1-11H,(H2,19,20,21,22)	ZMGIOHDRVGQVCU-UHFFFAOYSA-N	O=C(NC(=S)Nc1cccc2ncccc12)c3ccccc3	BroadT	BRD-K09485859	BRD-K09485859-001-05-0	Key Organics Ltd.	2N-010			O=C(NC(=S)Nc1cccc2ncccc12)c1ccccc1	InChI=1S/C17H13N3OS/c21-16(12-6-2-1-3-7-12)20-17(22)19-15-10-4-9-14-13(15)8-5-11-18-14/h1-11H,(H2,19,20,21,22)	ZMGIOHDRVGQVCU-UHFFFAOYSA-N	307.077932756							107123
SMR000037169	LSM-18478	SID858078, BRD-K00168920	659433	InChI=1S/C13H17NO3S2/c15-10(16)7-8-14-12(17)11(19-13(14)18)9-5-3-1-2-4-6-9/h1-8H2,(H,15,16)	OJSYQBBXPIPBGL-UHFFFAOYSA-N	OC(=O)CCN1C(=S)SC(=C2CCCCCC2)C1=O	BroadT	BRD-K00168920	BRD-K00168920-001-06-4	InterBioScreen Ltd.	STOCK2S-19938			OC(=O)CCN1C(=S)SC(C1=O)=C1CCCCCC1	InChI=1S/C13H17NO3S2/c15-10(16)7-8-14-12(17)11(19-13(14)18)9-5-3-1-2-4-6-9/h1-8H2,(H,15,16)	OJSYQBBXPIPBGL-UHFFFAOYSA-N	299.064984794							107124
AC1MJYBT	LSM-18479	BRD-A05731432	3145192	InChI=1S/C14H25N3O3S/c1-9(2)4-5-19-8-12-7-11(13(18)20-12)6-10(3)16-17-14(15)21/h9,11-12H,4-8H2,1-3H3,(H3,15,17,21)	DHJWXOMBAMDTBA-UHFFFAOYSA-N	CC(C)CCOCC1CC(CC(=NN=C(N)S)C)C(=O)O1	BroadT	BRD-A05731432	BRD-A05731432-001-06-7	Asinex Ltd.	BAS 03065923			CC(C)CCOCC1CC(CC(C)=NN=C(N)S)C(=O)O1	InChI=1S/C14H25N3O3S/c1-9(2)4-5-19-8-12-7-11(13(18)20-12)6-10(3)16-17-14(15)21/h9,11-12H,4-8H2,1-3H3,(H3,15,17,21)	DHJWXOMBAMDTBA-UHFFFAOYSA-N	315.16166238							107125
CHEMBL209793	LSM-18480	SID26731526, BRD-K23173968	2726555	InChI=1S/C10H7N3OS/c11-6-8-9(14)13-15-10(8)12-7-4-2-1-3-5-7/h1-5,12H,(H,13,14)	GHXPCAXQBVCFNU-UHFFFAOYSA-N	Oc1nsc(Nc2ccccc2)c1C#N	BroadT	BRD-K23173968	BRD-K23173968-001-06-0	Maybridge	RF 02350			Oc1nsc(Nc2ccccc2)c1C#N	InChI=1S/C10H7N3OS/c11-6-8-9(14)13-15-10(8)12-7-4-2-1-3-5-7/h1-5,12H,(H,13,14)	GHXPCAXQBVCFNU-UHFFFAOYSA-N	217.030982564							107126
MLS000576054	LSM-18481	SID17411703, BRD-A81682135	2845439	InChI=1S/C17H30N2/c1-19-6-2-3-16(19)4-5-18-17-14-8-12-7-13(10-14)11-15(17)9-12/h12-18H,2-11H2,1H3	RSNBIESXEKYLMW-UHFFFAOYSA-N	CN1CCCC1CCNC2C3CC4CC(CC2C4)C3	BroadT	BRD-A81682135	BRD-A81682135-001-05-1	ChemBridge Corporation	5420243			CN1CCCC1CCNC1C2CC3CC(C2)CC1C3	InChI=1S/C17H30N2/c1-19-6-2-3-16(19)4-5-18-17-14-8-12-7-13(10-14)11-15(17)9-12/h12-18H,2-11H2,1H3	RSNBIESXEKYLMW-UHFFFAOYSA-N	262.24089898							107127
3-Acetyl-7-methoxy-2H-chromen-2-one	LSM-18482	SID22416542, BRD-K88500641	2054475	InChI=1S/C12H10O4/c1-7(13)10-5-8-3-4-9(15-2)6-11(8)16-12(10)14/h3-6H,1-2H3	HJRFKKRMCGZIOA-UHFFFAOYSA-N	COc1ccc2C=C(C(=O)C)C(=O)Oc2c1	BroadT	BRD-K88500641	BRD-K88500641-001-06-1	ChemBridge Corporation	6094684			COc1ccc2cc(C(C)=O)c(=O)oc2c1	InChI=1S/C12H10O4/c1-7(13)10-5-8-3-4-9(15-2)6-11(8)16-12(10)14/h3-6H,1-2H3	HJRFKKRMCGZIOA-UHFFFAOYSA-N	218.0579088							107128
2-[3-[(1-Oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-ylidene)methyl]indol-1-yl]acetic acid	LSM-18483	BRD-K60390492	1026892	InChI=1S/C20H13N3O3S/c24-18(25)11-22-10-12(13-5-1-3-7-15(13)22)9-17-19(26)23-16-8-4-2-6-14(16)21-20(23)27-17/h1-10H,11H2,(H,24,25)	WUFOGDSZFSPZPX-UHFFFAOYSA-N	OC(=O)Cn1cc(C=C2Sc3nc4ccccc4n3C2=O)c5ccccc15	BroadT	BRD-K60390492	BRD-K60390492-001-06-9	ChemBridge Corporation	6345532			OC(=O)Cn1cc(C=c2sc3nc4ccccc4n3c2=O)c2ccccc12	InChI=1S/C20H13N3O3S/c24-18(25)11-22-10-12(13-5-1-3-7-15(13)22)9-17-19(26)23-16-8-4-2-6-14(16)21-20(23)27-17/h1-10H,11H2,(H,24,25)	WUFOGDSZFSPZPX-UHFFFAOYSA-N	375.067761996							107129
MLS000589773	LSM-18484	SID17506162, BRD-K48550683	980466	InChI=1S/C20H23N3O2S/c1-2-25-19(24)17-8-10-18(11-9-17)23-15-22(14-21-20(23)26)13-12-16-6-4-3-5-7-16/h3-11H,2,12-15H2,1H3,(H,21,26)	BIHPEXBRJDRAAX-UHFFFAOYSA-N	CCOC(=O)c1ccc(cc1)N2CN(CCc3ccccc3)CN=C2S	BroadT	BRD-K48550683	BRD-K48550683-001-05-6	InterBioScreen Ltd.	STOCK3S-56923			CCOC(=O)c1ccc(cc1)N1CN(CCc2ccccc2)CN=C1S	InChI=1S/C20H23N3O2S/c1-2-25-19(24)17-8-10-18(11-9-17)23-15-22(14-21-20(23)26)13-12-16-6-4-3-5-7-16/h3-11H,2,12-15H2,1H3,(H,21,26)	BIHPEXBRJDRAAX-UHFFFAOYSA-N	369.151097696							107130
F0631-0136	LSM-18485	SID7969965, BRD-A86265053	5063649	InChI=1S/C20H27N5O4S/c1-13-21-20-25(22-13)19(27)18(30-20)17(24-8-6-23(7-9-24)10-11-26)14-4-5-15(28-2)16(12-14)29-3/h4-5,12,17,26-27H,6-11H2,1-3H3	XCJCPPSKBDLPAE-UHFFFAOYSA-N	COc1ccc(cc1OC)C(N2CCN(CCO)CC2)c3sc4nc(C)nn4c3O	BroadT	BRD-A86265053	BRD-A86265053-001-05-8	Life Chemicals Inc.	F0631-0136			COc1ccc(cc1OC)C(N1CCN(CCO)CC1)c1sc2nc(C)nn2c1O	InChI=1S/C20H27N5O4S/c1-13-21-20-25(22-13)19(27)18(30-20)17(24-8-6-23(7-9-24)10-11-26)14-4-5-15(28-2)16(12-14)29-3/h4-5,12,17,26-27H,6-11H2,1-3H3	XCJCPPSKBDLPAE-UHFFFAOYSA-N	433.178375084							107131
4-Chloro-n-(3,4-dimethoxyphenyl)-1-ethyl-1H-pyrazole-3-carboxamide	LSM-18486	SID24812432, BRD-K07197317	1511740	InChI=1S/C14H16ClN3O3/c1-4-18-8-10(15)13(17-18)14(19)16-9-5-6-11(20-2)12(7-9)21-3/h5-8H,4H2,1-3H3,(H,16,19)	CLASNMGCTROMMF-UHFFFAOYSA-N	CCn1cc(Cl)c(n1)C(=O)Nc2ccc(OC)c(OC)c2	BroadT	BRD-K07197317	BRD-K07197317-001-05-9	ChemDiv Inc.	8017-0549			CCn1cc(Cl)c(n1)C(=O)Nc1ccc(OC)c(OC)c1	InChI=1S/C14H16ClN3O3/c1-4-18-8-10(15)13(17-18)14(19)16-9-5-6-11(20-2)12(7-9)21-3/h5-8H,4H2,1-3H3,(H,16,19)	CLASNMGCTROMMF-UHFFFAOYSA-N	309.088019112							107132
T5335702	LSM-18487	SID22410751, BRD-K68950773	4884602	InChI=1S/C18H22ClFN4O3S/c1-4-21-16-8-6-13(28(26,27)24(2)3)10-17(16)22-11-18(25)23-12-5-7-15(20)14(19)9-12/h5-10,21-22H,4,11H2,1-3H3,(H,23,25)	TUZCTPIIVYQBIR-UHFFFAOYSA-N	CCNc1ccc(cc1NCC(=O)Nc2ccc(F)c(Cl)c2)S(=O)(=O)N(C)C	BroadT	BRD-K68950773	BRD-K68950773-001-05-4	Enamine Ltd.	T5335702			CCNc1ccc(cc1NCC(=O)Nc1ccc(F)c(Cl)c1)S(=O)(=O)N(C)C	InChI=1S/C18H22ClFN4O3S/c1-4-21-16-8-6-13(28(26,27)24(2)3)10-17(16)22-11-18(25)23-12-5-7-15(20)14(19)9-12/h5-10,21-22H,4,11H2,1-3H3,(H,23,25)	TUZCTPIIVYQBIR-UHFFFAOYSA-N	428.108517204							107133
SMR000019124	LSM-18488	SID4241469, BRD-K63954116	3236438	InChI=1S/C20H23N3O/c21-9-4-10-22-11-13-23(14-12-22)16-19-15-18(7-8-20(19)24)17-5-2-1-3-6-17/h1-3,5-8,15,24H,4,10-14,16H2	UFHCIZMKGASAMK-UHFFFAOYSA-N	Oc1ccc(cc1CN2CCN(CCC#N)CC2)c3ccccc3	BroadT	BRD-K63954116	BRD-K63954116-001-06-5	ChemDiv Inc.	0921-0009			Oc1ccc(cc1CN1CCN(CCC#N)CC1)-c1ccccc1	InChI=1S/C20H23N3O/c21-9-4-10-22-11-13-23(14-12-22)16-19-15-18(7-8-20(19)24)17-5-2-1-3-6-17/h1-3,5-8,15,24H,4,10-14,16H2	UFHCIZMKGASAMK-UHFFFAOYSA-N	321.184112386							107134
MLS000055286	LSM-18489	SID3714988, BRD-A13316921	2999033	InChI=1S/C20H23NO4/c1-13-7-14(2)11-21(10-13)19(23)12-25-20(24)17-8-15-5-3-4-6-16(15)9-18(17)22/h3-6,8-9,13-14,22H,7,10-12H2,1-2H3	MRZZJIANPBNXMB-UHFFFAOYSA-N	CC1CC(C)CN(C1)C(=O)COC(=O)c2cc3ccccc3cc2O	BroadT	BRD-A13316921	BRD-A13316921-001-05-7	Enamine Ltd.	T0511-9907			CC1CC(C)CN(C1)C(=O)COC(=O)c1cc2ccccc2cc1O	InChI=1S/C20H23NO4/c1-13-7-14(2)11-21(10-13)19(23)12-25-20(24)17-8-15-5-3-4-6-16(15)9-18(17)22/h3-6,8-9,13-14,22H,7,10-12H2,1-2H3	MRZZJIANPBNXMB-UHFFFAOYSA-N	341.162708226							107135
AC1N8LF3	LSM-18490	SID22405746, BRD-A46351047	4320653	InChI=1S/C18H21Cl2N2O4P/c1-3-25-27(24,26-4-2)17(13-8-6-5-7-9-13)22-18(23)21-14-10-11-15(19)16(20)12-14/h5-12,17H,3-4H2,1-2H3,(H2,21,22,23)	ZINBTJIEEGTFGN-UHFFFAOYSA-N	CCOP(=O)(OCC)C(NC(=O)Nc1ccc(Cl)c(Cl)c1)c2ccccc2	BroadT	BRD-A46351047	BRD-A46351047-001-05-4	Enamine Ltd.	T0502-1190			CCOP(=O)(OCC)C(NC(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1	InChI=1S/C18H21Cl2N2O4P/c1-3-25-27(24,26-4-2)17(13-8-6-5-7-9-13)22-18(23)21-14-10-11-15(19)16(20)12-14/h5-12,17H,3-4H2,1-2H3,(H2,21,22,23)	ZINBTJIEEGTFGN-UHFFFAOYSA-N	430.061599102							107136
AC1MCLRG	LSM-18491	SID26731603, BRD-K75940498	2746735	InChI=1S/C12H10ClN5O/c13-9-3-1-8(2-4-9)12(19)18-17-11(14)10-7-15-5-6-16-10/h1-7H,(H2,14,17)(H,18,19)	TZCURNDLICSWOJ-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)NNC(=N)c2cnccn2	BroadT	BRD-K75940498	BRD-K75940498-001-07-6	Maybridge	SPB 07144			Clc1ccc(cc1)C(=O)NNC(=N)c1cnccn1	InChI=1S/C12H10ClN5O/c13-9-3-1-8(2-4-9)12(19)18-17-11(14)10-7-15-5-6-16-10/h1-7H,(H2,14,17)(H,18,19)	TZCURNDLICSWOJ-UHFFFAOYSA-N	275.0573877							107137
SMR000160155	LSM-18492	SID17386453, BRD-A59034900	4178804	InChI=1S/C24H21F4N3O2/c1-13(2)14-7-9-15(10-8-14)19-11-17(16-5-3-4-6-18(16)29-19)22(32)31-24(33,23(27)28)12-20(30-31)21(25)26/h3-11,13,21,23,33H,12H2,1-2H3	HSJCLUDQCDKMOW-UHFFFAOYSA-N	CC(C)c1ccc(cc1)c2cc(C(=O)N3N=C(CC3(O)C(F)F)C(F)F)c4ccccc4n2	BroadT	BRD-A59034900	BRD-A59034900-001-10-6	Specs	AK-968/41923789			CC(C)c1ccc(cc1)-c1cc(C(=O)N2N=C(CC2(O)C(F)F)C(F)F)c2ccccc2n1	InChI=1S/C24H21F4N3O2/c1-13(2)14-7-9-15(10-8-14)19-11-17(16-5-3-4-6-18(16)29-19)22(32)31-24(33,23(27)28)12-20(30-31)21(25)26/h3-11,13,21,23,33H,12H2,1-2H3	HSJCLUDQCDKMOW-UHFFFAOYSA-N	459.156989742							107138
SMR000129577	LSM-18493	SID14733433, BRD-K82632099	9550495	InChI=1S/C21H17N3O3/c1-14-9-10-15(21-24-20-18(27-21)8-5-11-22-20)12-17(14)23-19(25)13-26-16-6-3-2-4-7-16/h2-12H,13H2,1H3,(H,23,25)	OIPHUMQDOVXXLI-UHFFFAOYSA-N	Cc1ccc(cc1NC(=O)COc2ccccc2)c3oc4cccnc4n3	BroadT	BRD-K82632099	BRD-K82632099-001-05-7	ChemDiv Inc.	4410-4290			Cc1ccc(cc1NC(=O)COc1ccccc1)-c1nc2ncccc2o1	InChI=1S/C21H17N3O3/c1-14-9-10-15(21-24-20-18(27-21)8-5-11-22-20)12-17(14)23-19(25)13-26-16-6-3-2-4-7-16/h2-12H,13H2,1H3,(H,23,25)	OIPHUMQDOVXXLI-UHFFFAOYSA-N	359.126991434							107139
MLS001002636	LSM-18494	SID24837682, BRD-K25632735	2445561	InChI=1S/C15H18N4O6S/c1-9-3-5-10(6-4-9)26(23,24)18-14(21)11-12(16)19(7-8-25-2)15(22)17-13(11)20/h3-6H,7-8,16H2,1-2H3,(H,18,21)(H,17,20,22)	WVMWBWDSVZTLPL-UHFFFAOYSA-N	COCCN1C(=O)NC(=O)C(=C1N)C(=O)NS(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K25632735	BRD-K25632735-001-06-5	Enamine Ltd.	T5280490			COCCn1c(N)c(C(=O)NS(=O)(=O)c2ccc(C)cc2)c(=O)[nH]c1=O	InChI=1S/C15H18N4O6S/c1-9-3-5-10(6-4-9)26(23,24)18-14(21)11-12(16)19(7-8-25-2)15(22)17-13(11)20/h3-6H,7-8,16H2,1-2H3,(H,18,21)(H,17,20,22)	WVMWBWDSVZTLPL-UHFFFAOYSA-N	382.094705026							107140
4-[(4-Chlorobenzyl)amino]-3-nitro-2H-chromen-2-one	LSM-18495	BRD-K01916921	4382223	InChI=1S/C16H11ClN2O4/c17-11-7-5-10(6-8-11)9-18-14-12-3-1-2-4-13(12)23-16(20)15(14)19(21)22/h1-8,20H,9H2	BJXKLMRSJJNUKT-UHFFFAOYSA-N	OC1=C(C(=NCc2ccc(Cl)cc2)c3ccccc3O1)[N+](=O)[O-]	BroadT	BRD-K01916921	BRD-K01916921-001-05-6	ChemDiv Inc.	6220-0797			Oc1oc2ccccc2c(=NCc2ccc(Cl)cc2)c1[N+]([O-])=O	InChI=1S/C16H11ClN2O4/c17-11-7-5-10(6-8-11)9-18-14-12-3-1-2-4-13(12)23-16(20)15(14)19(21)22/h1-8,20H,9H2	BJXKLMRSJJNUKT-UHFFFAOYSA-N	330.040734562							
AC1LSU03	LSM-18496	BRD-K47432556	1471438	InChI=1S/C15H11ClN2O2/c16-12-8-6-11(7-9-12)15(20)14(10-19)18-17-13-4-2-1-3-5-13/h1-10,17H	ZOUWBNSRSMCLFY-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)C(=NNc2ccccc2)C=O	BroadT	BRD-K47432556	BRD-K47432556-001-06-0	Key Organics Ltd.	2M-051			Clc1ccc(cc1)C(=O)C(C=O)=NNc1ccccc1	InChI=1S/C15H11ClN2O2/c16-12-8-6-11(7-9-12)15(20)14(10-19)18-17-13-4-2-1-3-5-13/h1-10,17H	ZOUWBNSRSMCLFY-UHFFFAOYSA-N	286.050905322							107142
AC1MEHDQ	LSM-18497	BRD-A04432778	2878396	InChI=1S/C9H9N3OS2/c1-6-8(13)11-9(15-6)12-10-5-7-3-2-4-14-7/h2-6H,1H3,(H,11,12,13)	JLEITFULSIRKPA-UHFFFAOYSA-N	CC1SC(=NC1=O)NN=Cc2cccs2	BroadT	BRD-A04432778	BRD-A04432778-001-05-7	ChemBridge Corporation	5953187			CC1SC(NN=Cc2cccs2)=NC1=O	InChI=1S/C9H9N3OS2/c1-6-8(13)11-9(15-6)12-10-5-7-3-2-4-14-7/h2-6H,1H3,(H,11,12,13)	JLEITFULSIRKPA-UHFFFAOYSA-N	239.018703318							107143
NSC646913	LSM-43769	SID26665899, SID503289, BRD-K46743959	701842	InChI=1S/C18H13NO2/c20-17(12-11-14-6-2-1-3-7-14)21-16-10-4-8-15-9-5-13-19-18(15)16/h1-13H/b12-11+	MGYIGSPQIHQSAA-VAWYXSNFSA-N	O=C(Oc1cccc2cccnc12)\C=C\c3ccccc3	BroadT	BRD-K46743959	BRD-K46743959-001-05-6	InterBioScreen Ltd.	STOCK3S-22481			O=C(Oc1cccc2cccnc12)\C=C\c1ccccc1	InChI=1S/C18H13NO2/c20-17(12-11-14-6-2-1-3-7-14)21-16-10-4-8-15-9-5-13-19-18(15)16/h1-13H/b12-11+	MGYIGSPQIHQSAA-VAWYXSNFSA-N	275.094628666							
MLS000094520	LSM-18499	SID4240781, BRD-K73191918	3235844	InChI=1S/C13H14N2O3S2/c1-3-18-11(16)8-19-13-14-12(15-20-13)9-4-6-10(17-2)7-5-9/h4-7H,3,8H2,1-2H3	IWVHKCRXQOTLCA-UHFFFAOYSA-N	CCOC(=O)CSc1nc(ns1)c2ccc(OC)cc2	BroadT	BRD-K73191918	BRD-K73191918-001-05-4	ChemDiv Inc.	E206-0488			CCOC(=O)CSc1nc(ns1)-c1ccc(OC)cc1	InChI=1S/C13H14N2O3S2/c1-3-18-11(16)8-19-13-14-12(15-20-13)9-4-6-10(17-2)7-5-9/h4-7H,3,8H2,1-2H3	IWVHKCRXQOTLCA-UHFFFAOYSA-N	310.044583708							107145
MLS000560252	LSM-43770	SID17403607, BRD-K39803678	851598	InChI=1S/C15H15N5OS/c1-9-4-3-5-10(2)12(9)20-11(21)6-22-15-13-14(17-7-16-13)18-8-19-15/h3-5,7-8H,6H2,1-2H3,(H,20,21)(H,16,17,18,19)	MYHUWKTZJYGGBT-UHFFFAOYSA-N	Cc1cccc(C)c1NC(=O)CSc2[nH]cnc3ncnc23	BroadT	BRD-K39803678	BRD-K39803678-001-05-7	Asinex Ltd.	BAS 08304461			Cc1cccc(C)c1NC(=O)CSc1[nH]cnc2ncnc12	InChI=1S/C15H15N5OS/c1-9-4-3-5-10(2)12(9)20-11(21)6-22-15-13-14(17-7-16-13)18-8-19-15/h3-5,7-8H,6H2,1-2H3,(H,20,21)(H,16,17,18,19)	MYHUWKTZJYGGBT-UHFFFAOYSA-N	313.09973084							
AC1M646F	LSM-18501	BRD-K78170979	2390928	InChI=1S/C27H21N3O3/c1-33-24-11-3-2-6-21(24)16-28-29-26(31)20-14-12-18(13-15-20)17-30-23-10-5-8-19-7-4-9-22(25(19)23)27(30)32/h2-16H,17H2,1H3,(H,29,31)	XXHKWVKVYRKBJP-UHFFFAOYSA-N	COc1ccccc1C=NNC(=O)c2ccc(CN3C(=O)c4cccc5cccc3c45)cc2	BroadT	BRD-K78170979	BRD-K78170979-001-05-9	Enamine Ltd.	T0506-4788			COc1ccccc1C=NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1	InChI=1S/C27H21N3O3/c1-33-24-11-3-2-6-21(24)16-28-29-26(31)20-14-12-18(13-15-20)17-30-23-10-5-8-19-7-4-9-22(25(19)23)27(30)32/h2-16H,17H2,1H3,(H,29,31)	XXHKWVKVYRKBJP-UHFFFAOYSA-N	435.158291562							107147
AC1NJC1N	LSM-15537	BRD-K58062490	4869973	InChI=1S/C22H27ClN4O4/c1-26(15-22(29)25-18-13-16(23)7-8-20(18)30-2)14-21(28)24-17-5-3-4-6-19(17)27-9-11-31-12-10-27/h3-8,13H,9-12,14-15H2,1-2H3,(H,24,28)(H,25,29)	XZHFWCWADXWVLL-UHFFFAOYSA-N	COc1ccc(Cl)cc1NC(=O)CN(C)CC(=O)Nc2ccccc2N3CCOCC3	BroadT	BRD-K58062490	BRD-K58062490-034-06-1	Enamine Ltd.	T5324190		OC(=O)C(=O)O	COc1ccc(Cl)cc1NC(=O)CN(C)CC(=O)Nc1ccccc1N1CCOCC1.OC(=O)C(=O)O	InChI=1S/C22H27ClN4O4.C2H2O4/c1-26(15-22(29)25-18-13-16(23)7-8-20(18)30-2)14-21(28)24-17-5-3-4-6-19(17)27-9-11-31-12-10-27;3-1(4)2(5)6/h3-8,13H,9-12,14-15H2,1-2H3,(H,24,28)(H,25,29);(H,3,4)(H,5,6)	PJIATSGDDPSAIQ-UHFFFAOYSA-N	446.172083094							104173, 104173
AC1O99UM	LSM-18502	SID17507753, BRD-K99886365	6752646	InChI=1S/C22H19N3O2/c1-2-27-19-11-14(8-10-18(19)26)20-16-9-7-13-5-3-4-6-15(13)21(16)25-22(24)17(20)12-23/h3-6,8,10-11,26H,2,7,9H2,1H3,(H2,24,25)	SHFWXLJFNDXSPU-UHFFFAOYSA-N	CCOc1cc(ccc1O)c2c3CCc4ccccc4c3nc(N)c2C#N	BroadT	BRD-K99886365	BRD-K99886365-001-05-7	Asinex Ltd.	ASN 00851064			CCOc1cc(ccc1O)-c1c2CCc3ccccc3-c2nc(N)c1C#N	InChI=1S/C22H19N3O2/c1-2-27-19-11-14(8-10-18(19)26)20-16-9-7-13-5-3-4-6-15(13)21(16)25-22(24)17(20)12-23/h3-6,8,10-11,26H,2,7,9H2,1H3,(H2,24,25)	SHFWXLJFNDXSPU-UHFFFAOYSA-N	357.147726878							
MLS000549844	LSM-18503	SID14727753, BRD-K62247167	1207838	InChI=1S/C21H25N3O4/c1-5-22(6-2)13-18-19(25)12-11-17-20(24(26)27)14(3)23(21(17)18)15-7-9-16(28-4)10-8-15/h7-12,25H,5-6,13H2,1-4H3	LDACRTGBIXQUOU-UHFFFAOYSA-N	CCN(CC)Cc1c(O)ccc2c(c(C)n(c3ccc(OC)cc3)c12)[N+](=O)[O-]	BroadT	BRD-K62247167	BRD-K62247167-001-06-3	Specs	AH-262/11507003			CCN(CC)Cc1c(O)ccc2c(c(C)n(-c3ccc(OC)cc3)c12)[N+]([O-])=O	InChI=1S/C21H25N3O4/c1-5-22(6-2)13-18-19(25)12-11-17-20(24(26)27)14(3)23(21(17)18)15-7-9-16(28-4)10-8-15/h7-12,25H,5-6,13H2,1-4H3	LDACRTGBIXQUOU-UHFFFAOYSA-N	383.18450631							107149
MLS000058168	LSM-18504	SID17506205, SID3717140, SID50105061, BRD-K66428718	2094474	InChI=1S/C25H24N4O6/c1-14(2)12-29-22(26)21(23(31)28(3)25(29)33)19(30)13-35-24(32)16-11-18(20-9-6-10-34-20)27-17-8-5-4-7-15(16)17/h4-11,14H,12-13,26H2,1-3H3	ABFGKTKVMVRAGW-UHFFFAOYSA-N	CC(C)CN1C(=C(C(=O)COC(=O)c2cc(nc3ccccc23)c4occc4)C(=O)N(C)C1=O)N	BroadT	BRD-K66428718	BRD-K66428718-001-06-9	Enamine Ltd.	T5228418			CC(C)Cn1c(N)c(C(=O)COC(=O)c2cc(nc3ccccc23)-c2ccco2)c(=O)n(C)c1=O	InChI=1S/C25H24N4O6/c1-14(2)12-29-22(26)21(23(31)28(3)25(29)33)19(30)13-35-24(32)16-11-18(20-9-6-10-34-20)27-17-8-5-4-7-15(16)17/h4-11,14H,12-13,26H2,1-3H3	ABFGKTKVMVRAGW-UHFFFAOYSA-N	476.169584528							107150
ST50996245	LSM-18505	SID7977855, BRD-K70374480	877471	InChI=1S/C16H16O8/c1-8-10(6-13(24-8)16(19)20)7-23-14-11(21-2)4-9(15(17)18)5-12(14)22-3/h4-6H,7H2,1-3H3,(H,17,18)(H,19,20)	KSQVYRZSGXKBCD-UHFFFAOYSA-N	COc1cc(cc(OC)c1OCc2cc(oc2C)C(=O)O)C(=O)O	BroadT	BRD-K70374480	BRD-K70374480-001-06-5	ChemBridge Corporation	5929447			COc1cc(cc(OC)c1OCc1cc(oc1C)C(O)=O)C(O)=O	InChI=1S/C16H16O8/c1-8-10(6-13(24-8)16(19)20)7-23-14-11(21-2)4-9(15(17)18)5-12(14)22-3/h4-6H,7H2,1-3H3,(H,17,18)(H,19,20)	KSQVYRZSGXKBCD-UHFFFAOYSA-N	336.084517472							107151
N-Butyl-n-phenylquinoline-8-sulfonamide	LSM-18506	SID24813596, BRD-K17067504	6621395	InChI=1S/C19H20N2O2S/c1-2-3-15-21(17-11-5-4-6-12-17)24(22,23)18-13-7-9-16-10-8-14-20-19(16)18/h4-14H,2-3,15H2,1H3	BFHHVGFGNFAUBS-UHFFFAOYSA-N	CCCCN(c1ccccc1)S(=O)(=O)c2cccc3cccnc23	BroadT	BRD-K17067504	BRD-K17067504-001-06-3	ChemDiv Inc.	C224-1232			CCCCN(c1ccccc1)S(=O)(=O)c1cccc2cccnc12	InChI=1S/C19H20N2O2S/c1-2-3-15-21(17-11-5-4-6-12-17)24(22,23)18-13-7-9-16-10-8-14-20-19(16)18/h4-14H,2-3,15H2,1H3	BFHHVGFGNFAUBS-UHFFFAOYSA-N	340.12454859							107152
AC1MJKY4	LSM-18507	SID24808235, BRD-A56574618	3139045	InChI=1S/C21H24N2O2S/c1-3-15(2)22-20(25)17-9-11-18(12-10-17)21-23(19(24)14-26-21)13-16-7-5-4-6-8-16/h4-12,15,21H,3,13-14H2,1-2H3,(H,22,25)	WHJSBLHNPPKVKH-UHFFFAOYSA-N	CCC(C)NC(=O)c1ccc(cc1)C2SCC(=O)N2Cc3ccccc3	BroadT	BRD-A56574618	BRD-A56574618-001-05-7	Asinex Ltd.	BAS 02189395			CCC(C)NC(=O)c1ccc(cc1)C1SCC(=O)N1Cc1ccccc1	InChI=1S/C21H24N2O2S/c1-3-15(2)22-20(25)17-9-11-18(12-10-17)21-23(19(24)14-26-21)13-16-7-5-4-6-8-16/h4-12,15,21H,3,13-14H2,1-2H3,(H,22,25)	WHJSBLHNPPKVKH-UHFFFAOYSA-N	368.155848718							107153
AC1LF19O	LSM-18508	BRD-K01230938	721345	InChI=1S/C13H12N4O/c1-10-5-6-11(8-15-10)13(18)17-16-9-12-4-2-3-7-14-12/h2-9H,1H3,(H,17,18)	XGDAYPNVUDKBHL-UHFFFAOYSA-N	Cc1ccc(cn1)C(=O)NN=Cc2ccccn2	BroadT	BRD-K01230938	BRD-K01230938-001-05-3	InterBioScreen Ltd.	STOCK3S-22347			Cc1ccc(cn1)C(=O)NN=Cc1ccccn1	InChI=1S/C13H12N4O/c1-10-5-6-11(8-15-10)13(18)17-16-9-12-4-2-3-7-14-12/h2-9H,1H3,(H,17,18)	XGDAYPNVUDKBHL-UHFFFAOYSA-N	240.101111044							107154
MLS000723663	LSM-43771	SID24822666, BRD-K46573336	6379255	InChI=1S/C14H10N4O3S/c19-13-12(15-14(22)16-13)8-11-2-1-7-17(11)9-3-5-10(6-4-9)18(20)21/h1-8H,(H2,15,16,19,22)/b12-8+	FMLUAKSJMUPACD-XYOKQWHBSA-N	[O-][N+](=O)c1ccc(cc1)n2cccc2\C=C/3\NC(=S)NC3=O	BroadT	BRD-K46573336	BRD-K46573336-001-05-1	ChemDiv Inc.	3229-2677			[O-][N+](=O)c1ccc(cc1)-n1cccc1\C=C1\NC(=S)NC1=O	InChI=1S/C14H10N4O3S/c19-13-12(15-14(22)16-13)8-11-2-1-7-17(11)9-3-5-10(6-4-9)18(20)21/h1-8H,(H2,15,16,19,22)/b12-8+	FMLUAKSJMUPACD-XYOKQWHBSA-N	314.04736091							
NSC685008	LSM-18510	SID24781390, BRD-K00784777	1210970	InChI=1S/C14H10N2OS/c15-13-11(14(16)18)7-10-9-4-2-1-3-8(9)5-6-12(10)17-13/h1-7,15H,(H2,16,18)	QLPSUFKUPWGVHY-UHFFFAOYSA-N	NC(=S)C1=Cc2c(OC1=N)ccc3ccccc23	BroadT	BRD-K00784777	BRD-K00784777-001-05-4	Specs	AE-848/32005047			NC(=S)c1cc2c(ccc3ccccc23)oc1=N	InChI=1S/C14H10N2OS/c15-13-11(14(16)18)7-10-9-4-2-1-3-8(9)5-6-12(10)17-13/h1-7,15H,(H2,16,18)	QLPSUFKUPWGVHY-UHFFFAOYSA-N	254.05138365							107156
ZINC05142035	LSM-18511	SID26663676, BRD-K75743408	4353120	InChI=1S/C13H16N6O3/c14-11-10(19(20)21)12(18-5-1-2-6-18)17-13(16-11)15-8-9-4-3-7-22-9/h3-4,7H,1-2,5-6,8H2,(H3,14,15,16,17)	JLQKIPRBSDZAAV-UHFFFAOYSA-N	Nc1nc(NCc2occc2)nc(N3CCCC3)c1[N+](=O)[O-]	BroadT	BRD-K75743408	BRD-K75743408-001-05-7	InterBioScreen Ltd.	STOCK4S-33635			Nc1nc(NCc2ccco2)nc(N2CCCC2)c1[N+]([O-])=O	InChI=1S/C13H16N6O3/c14-11-10(19(20)21)12(18-5-1-2-6-18)17-13(16-11)15-8-9-4-3-7-22-9/h3-4,7H,1-2,5-6,8H2,(H3,14,15,16,17)	JLQKIPRBSDZAAV-UHFFFAOYSA-N	304.128388432							107157
MLS000774242	LSM-18512	SID24834866, BRD-K84279050	2086382	InChI=1S/C17H26N4O3/c1-17(2,3)19-16(24)18-15(23)12-20-8-10-21(11-9-20)13-4-6-14(22)7-5-13/h4-7,22H,8-12H2,1-3H3,(H2,18,19,23,24)	IRAISASWLZJKLO-UHFFFAOYSA-N	CC(C)(C)NC(=O)NC(=O)CN1CCN(CC1)c2ccc(O)cc2	BroadT	BRD-K84279050	BRD-K84279050-001-06-0	Enamine Ltd.	T5263813			CC(C)(C)NC(=O)NC(=O)CN1CCN(CC1)c1ccc(O)cc1	InChI=1S/C17H26N4O3/c1-17(2,3)19-16(24)18-15(23)12-20-8-10-21(11-9-20)13-4-6-14(22)7-5-13/h4-7,22H,8-12H2,1-3H3,(H2,18,19,23,24)	IRAISASWLZJKLO-UHFFFAOYSA-N	334.200490732							107158
T0518-1294	LSM-18513	SID17516932, BRD-K46389999	2448357	InChI=1S/C22H15ClN4O5S/c23-16-9-8-14(11-18(16)27(30)31)24-21(28)13-32-22(29)19-12-17(20-7-4-10-33-20)25-26(19)15-5-2-1-3-6-15/h1-12H,13H2,(H,24,28)	LLXMFGUPTWJCFQ-UHFFFAOYSA-N	[O-][N+](=O)c1cc(NC(=O)COC(=O)c2cc(nn2c3ccccc3)c4cccs4)ccc1Cl	BroadT	BRD-K46389999	BRD-K46389999-001-05-0	Enamine Ltd.	T0518-1294			[O-][N+](=O)c1cc(NC(=O)COC(=O)c2cc(nn2-c2ccccc2)-c2cccs2)ccc1Cl	InChI=1S/C22H15ClN4O5S/c23-16-9-8-14(11-18(16)27(30)31)24-21(28)13-32-22(29)19-12-17(20-7-4-10-33-20)25-26(19)15-5-2-1-3-6-15/h1-12H,13H2,(H,24,28)	LLXMFGUPTWJCFQ-UHFFFAOYSA-N	482.04516802							107159
MLS001006003	LSM-18514	SID24837571, BRD-A14459189	4626420	InChI=1S/C26H24ClN3O7/c1-34-22-10-7-17(12-23(22)35-2)26(33)28-14-25(32)37-15-24(31)30-20(21-4-3-11-36-21)13-19(29-30)16-5-8-18(27)9-6-16/h3-12,20H,13-15H2,1-2H3,(H,28,33)	KEFFGNCGFQKDAH-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)NCC(=O)OCC(=O)N2N=C(CC2c3occc3)c4ccc(Cl)cc4	BroadT	BRD-A14459189	BRD-A14459189-001-06-9	Enamine Ltd.	T0517-7799			COc1ccc(cc1OC)C(=O)NCC(=O)OCC(=O)N1N=C(CC1c1ccco1)c1ccc(Cl)cc1	InChI=1S/C26H24ClN3O7/c1-34-22-10-7-17(12-23(22)35-2)26(33)28-14-25(32)37-15-24(31)30-20(21-4-3-11-36-21)13-19(29-30)16-5-8-18(27)9-6-16/h3-12,20H,13-15H2,1-2H3,(H,28,33)	KEFFGNCGFQKDAH-UHFFFAOYSA-N	525.130277848							107160
T0519-3762	LSM-18515	SID22405645, BRD-K04900726	2480149	InChI=1S/C21H27N3S/c1-2-17-8-10-19(11-9-17)22-21(25)23-20-12-14-24(15-13-20)16-18-6-4-3-5-7-18/h3-11,20H,2,12-16H2,1H3,(H2,22,23,25)	FFRXGZVWUXIOFC-UHFFFAOYSA-N	CCc1ccc(NC(=NC2CCN(Cc3ccccc3)CC2)S)cc1	BroadT	BRD-K04900726	BRD-K04900726-001-05-4	Enamine Ltd.	T0519-3762			CCc1ccc(NC(S)=NC2CCN(Cc3ccccc3)CC2)cc1	InChI=1S/C21H27N3S/c1-2-17-8-10-19(11-9-17)22-21(25)23-20-12-14-24(15-13-20)16-18-6-4-3-5-7-18/h3-11,20H,2,12-16H2,1H3,(H2,22,23,25)	FFRXGZVWUXIOFC-UHFFFAOYSA-N	353.192568584							107161
Triflupromazine	LSM-3421	Vetame, Vesprin, Triflupromazine, Nivoman, Fluopromazine	5568	InChI=1S/C18H19F3N2S/c1-22(2)10-5-11-23-14-6-3-4-7-16(14)24-17-9-8-13(12-15(17)23)18(19,20)21/h3-4,6-9,12H,5,10-11H2,1-2H3	XSCGXQMFQXDFCW-UHFFFAOYSA-N	CN(C)CCCN1c2ccccc2Sc3ccc(cc13)C(F)(F)F	BroadT	BRD-K63675182	BRD-K63675182-003-16-0	Prestwick Chemical Inc.	Prestw-53		Cl	CN(C)CCCN1c2ccccc2Sc2ccc(cc12)C(F)(F)F.Cl	InChI=1S/C18H19F3N2S.ClH/c1-22(2)10-5-11-23-14-6-3-4-7-16(14)24-17-9-8-13(12-15(17)23)18(19,20)21;/h3-4,6-9,12H,5,10-11H2,1-2H3;1H	FTNWXGFYRHWUKG-UHFFFAOYSA-N	352.122103918							9711, 9711
F0526-0238	LSM-15273	BRD-K68050045	3280427	InChI=1S/C20H24N2O3S/c1-3-17(23)21-19-18(20(24)25-4-2)15-10-11-22(13-16(15)26-19)12-14-8-6-5-7-9-14/h5-9H,3-4,10-13H2,1-2H3,(H,21,23)	KCBYZKLDQOWSAV-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)CC)sc2CN(Cc3ccccc3)CCc12	BroadT	BRD-K68050045	BRD-K68050045-003-05-1	Life Chemicals Inc.	F0526-0238		Cl	CCOC(=O)c1c(NC(=O)CC)sc2CN(Cc3ccccc3)CCc12.Cl	InChI=1S/C20H24N2O3S.ClH/c1-3-17(23)21-19-18(20(24)25-4-2)15-10-11-22(13-16(15)26-19)12-14-8-6-5-7-9-14;/h5-9H,3-4,10-13H2,1-2H3,(H,21,23);1H	KDYTVEZMTACMNO-UHFFFAOYSA-N	372.150763338							103920, 103920
MLS000863712	LSM-18516	SID26724752, SID4241880, BRD-K70940371	3236795	InChI=1S/C21H22BrN5O2S/c22-15-6-7-17-16(14-15)20(29)27(21(30)24-17)9-3-5-19(28)26-12-10-25(11-13-26)18-4-1-2-8-23-18/h1-2,4,6-8,14H,3,5,9-13H2,(H,24,30)	JVDAHWMLZLAMIO-UHFFFAOYSA-N	Brc1ccc2NC(=S)N(CCCC(=O)N3CCN(CC3)c4ccccn4)C(=O)c2c1	BroadT	BRD-K70940371	BRD-K70940371-001-05-7	ChemDiv Inc.	K284-4107			Brc1ccc2[nH]c(=S)n(CCCC(=O)N3CCN(CC3)c3ccccn3)c(=O)c2c1	InChI=1S/C21H22BrN5O2S/c22-15-6-7-17-16(14-15)20(29)27(21(30)24-17)9-3-5-19(28)26-12-10-25(11-13-26)18-4-1-2-8-23-18/h1-2,4,6-8,14H,3,5,9-13H2,(H,24,30)	JVDAHWMLZLAMIO-UHFFFAOYSA-N	487.067758284							107162
ST058488	LSM-18517	SID4254708, BRD-A53911481	2980951	InChI=1S/C23H24ClN3O5/c1-2-30-22(28)20-17(12-25-10-9-14-3-6-16(24)7-4-14)26-23(29)27-21(20)15-5-8-18-19(11-15)32-13-31-18/h3-8,11,21,25H,2,9-10,12-13H2,1H3,(H2,26,27,29)	UNBPZNCRXJCBKB-UHFFFAOYSA-N	CCOC(=O)C1=C(CNCCc2ccc(Cl)cc2)NC(=O)NC1c3ccc4OCOc4c3	BroadT	BRD-A53911481	BRD-A53911481-001-06-6	ChemBridge Corporation	7979931			CCOC(=O)C1=C(CNCCc2ccc(Cl)cc2)NC(=O)NC1c1ccc2OCOc2c1	InChI=1S/C23H24ClN3O5/c1-2-30-22(28)20-17(12-25-10-9-14-3-6-16(24)7-4-14)26-23(29)27-21(20)15-5-8-18-19(11-15)32-13-31-18/h3-8,11,21,25H,2,9-10,12-13H2,1H3,(H2,26,27,29)	UNBPZNCRXJCBKB-UHFFFAOYSA-N	457.140448608							107163
3'-(4-Fluorophenyl)-4,4,6,8-tetramethyl-5,6-dihydro-4H,4'h-spiro[pyrrolo[3,2,1-ij]quinoline-1,2'-[1,3]thiazolidine]-2,4'-dione	LSM-18518	SID14730518, BRD-A57255476	2982873	InChI=1S/C23H23FN2O2S/c1-13-9-17-14(2)11-22(3,4)26-20(17)18(10-13)23(21(26)28)25(19(27)12-29-23)16-7-5-15(24)6-8-16/h5-10,14H,11-12H2,1-4H3	YGRBMKXOAUNPHR-UHFFFAOYSA-N	CC1CC(C)(C)N2C(=O)C3(SCC(=O)N3c4ccc(F)cc4)c5cc(C)cc1c25	BroadT	BRD-A57255476	BRD-A57255476-001-06-1	ChemBridge Corporation	7985609			CC1CC(C)(C)N2C(=O)C3(SCC(=O)N3c3ccc(F)cc3)c3cc(C)cc1c23	InChI=1S/C23H23FN2O2S/c1-13-9-17-14(2)11-22(3,4)26-20(17)18(10-13)23(21(26)28)25(19(27)12-29-23)16-7-5-15(24)6-8-16/h5-10,14H,11-12H2,1-4H3	YGRBMKXOAUNPHR-UHFFFAOYSA-N	410.146426886							107164
AC1LRLQS	LSM-18519	BRD-K11474067, SID4243978	1399576	InChI=1S/C14H9F4NO3/c1-22-7-4-2-3-6(5-7)19-13-8(14(20)21)9(15)10(16)11(17)12(13)18/h2-5,19H,1H3,(H,20,21)	PSRYBZDEEXBKMI-UHFFFAOYSA-N	COc1cccc(Nc2c(F)c(F)c(F)c(F)c2C(=O)O)c1	BroadT	BRD-K11474067	BRD-K11474067-001-06-6	ChemDiv Inc.	6704-0015			COc1cccc(Nc2c(F)c(F)c(F)c(F)c2C(O)=O)c1	InChI=1S/C14H9F4NO3/c1-22-7-4-2-3-6(5-7)19-13-8(14(20)21)9(15)10(16)11(17)12(13)18/h2-5,19H,1H3,(H,20,21)	PSRYBZDEEXBKMI-UHFFFAOYSA-N	315.051855958							107165
MLS000760413	LSM-18520	BRD-K55944090	6179481	InChI=1S/C23H19N3O5/c1-29-20-10-14(11-21(30-2)22(20)27)13-24-26-23(28)16-12-18(19-8-5-9-31-19)25-17-7-4-3-6-15(16)17/h3-13,27H,1-2H3,(H,26,28)	OOBPZXCFGNUKJD-UHFFFAOYSA-N	COc1cc(C=NNC(=O)c2cc(nc3ccccc23)c4occc4)cc(OC)c1O	BroadT	BRD-K55944090	BRD-K55944090-001-07-4	Enamine Ltd.	T5231818			COc1cc(C=NNC(=O)c2cc(nc3ccccc23)-c2ccco2)cc(OC)c1O	InChI=1S/C23H19N3O5/c1-29-20-10-14(11-21(30-2)22(20)27)13-24-26-23(28)16-12-18(19-8-5-9-31-19)25-17-7-4-3-6-15(16)17/h3-13,27H,1-2H3,(H,26,28)	OOBPZXCFGNUKJD-UHFFFAOYSA-N	417.132470738							
MLS001230034	LSM-18521	SID49827264, BRD-A15648469	24819580	InChI=1S/C19H22N2O2/c1-13-10-11-18(23-2)17(12-13)21-19(22)20-16-9-5-7-14-6-3-4-8-15(14)16/h3-4,6,8,10-12,16H,5,7,9H2,1-2H3,(H2,20,21,22)	KTKLSHXIWDVDMF-UHFFFAOYSA-N	COc1ccc(C)cc1NC(=O)NC2CCCc3ccccc23	BroadT	BRD-A15648469	BRD-A15648469-001-06-7	Chemical Technologies & Investigations	AMNCO-26832			COc1ccc(C)cc1NC(=O)NC1CCCc2ccccc12	InChI=1S/C19H22N2O2/c1-13-10-11-18(23-2)17(12-13)21-19(22)20-16-9-5-7-14-6-3-4-8-15(14)16/h3-4,6,8,10-12,16H,5,7,9H2,1-2H3,(H2,20,21,22)	KTKLSHXIWDVDMF-UHFFFAOYSA-N	310.168127964							107167
AC1O9UBZ	LSM-18522	BRD-K37051611	6772703	InChI=1S/C19H22N2O3S/c1-4-24-19(23)17-14-7-8-21(3)11-16(14)25-18(17)20-10-13-9-12(2)5-6-15(13)22/h5-6,9-10,22H,4,7-8,11H2,1-3H3	JYALPUJRYLTSNO-UHFFFAOYSA-N	CCOC(=O)c1c2CCN(C)Cc2sc1N=Cc3cc(C)ccc3O	BroadT	BRD-K37051611	BRD-K37051611-001-05-5	InterBioScreen Ltd.	STOCK1S-43872			CCOC(=O)c1c(N=Cc2cc(C)ccc2O)sc2CN(C)CCc12	InChI=1S/C19H22N2O3S/c1-4-24-19(23)17-14-7-8-21(3)11-16(14)25-18(17)20-10-13-9-12(2)5-6-15(13)22/h5-6,9-10,22H,4,7-8,11H2,1-3H3	JYALPUJRYLTSNO-UHFFFAOYSA-N	358.135113274							
ST091678	LSM-18523	SID22412167, BRD-K97231379	736077	InChI=1S/C16H15N3O4S/c1-8-11-12(14(17)24-8)15(20)19(18-13(11)16(21)23-3)9-4-6-10(22-2)7-5-9/h4-7H,17H2,1-3H3	JXAGWNZVOPQTCZ-UHFFFAOYSA-N	COC(=O)C1=NN(C(=O)c2c(N)sc(C)c12)c3ccc(OC)cc3	BroadT	BRD-K97231379	BRD-K97231379-001-05-2	Specs	AG-205/11218312			COC(=O)c1nn(-c2ccc(OC)cc2)c(=O)c2c(N)sc(C)c12	InChI=1S/C16H15N3O4S/c1-8-11-12(14(17)24-8)15(20)19(18-13(11)16(21)23-3)9-4-6-10(22-2)7-5-9/h4-7H,17H2,1-3H3	JXAGWNZVOPQTCZ-UHFFFAOYSA-N	345.07832668							107169
ST50850852	LSM-18524	SID17431968, BRD-K51635240	970622	InChI=1S/C16H17N3O2S/c1-11-3-6-13(7-4-11)10-17-16(22)18-14-8-5-12(2)15(9-14)19(20)21/h3-9H,10H2,1-2H3,(H2,17,18,22)	KCQPVJUGQGNIHG-UHFFFAOYSA-N	Cc1ccc(CN=C(S)Nc2ccc(C)c(c2)[N+](=O)[O-])cc1	BroadT	BRD-K51635240	BRD-K51635240-001-05-5	ChemBridge Corporation	7802679			Cc1ccc(CN=C(S)Nc2ccc(C)c(c2)[N+]([O-])=O)cc1	InChI=1S/C16H17N3O2S/c1-11-3-6-13(7-4-11)10-17-16(22)18-14-8-5-12(2)15(9-14)19(20)21/h3-9H,10H2,1-2H3,(H2,17,18,22)	KCQPVJUGQGNIHG-UHFFFAOYSA-N	315.104147504							107170
AMBCB26285557	LSM-18525	SID24800146, BRD-K41844058	16191815	InChI=1S/C18H22FN3O/c1-23-15-5-6-16(17(19)8-15)18-13(9-20-21-18)11-22-10-12-3-2-4-14(22)7-12/h5-6,8-9,12,14H,2-4,7,10-11H2,1H3,(H,20,21)/t12-,14+/m1/s1	WQLOGZZEUSRGDC-OCCSQVGLSA-N	COc1ccc(c(F)c1)c2[nH]ncc2CN3C[C@@H]4CCC[C@H]3C4	BroadT	BRD-K41844058	BRD-K41844058-001-05-7	ChemBridge Corporation	26285557			COc1ccc(-c2[nH]ncc2CN2C[C@H]3C[C@@H]2CCC3)c(F)c1	InChI=1S/C18H22FN3O/c1-23-15-5-6-16(17(19)8-15)18-13(9-20-21-18)11-22-10-12-3-2-4-14(22)7-12/h5-6,8-9,12,14H,2-4,7,10-11H2,1H3,(H,20,21)/t12-,14+/m1/s1	WQLOGZZEUSRGDC-OCCSQVGLSA-N	315.174690554							107171
ZINC04865964	LSM-18526	SID49724517, BRD-K13856120	2993823	InChI=1S/C17H18ClN3O3/c1-12(22)20-6-8-21(9-7-20)15-5-4-13(11-14(15)18)19-17(23)16-3-2-10-24-16/h2-5,10-11H,6-9H2,1H3,(H,19,23)	MEACCDYDYGCTLV-UHFFFAOYSA-N	CC(=O)N1CCN(CC1)c2ccc(NC(=O)c3occc3)cc2Cl	BroadT	BRD-K13856120	BRD-K13856120-001-05-9	ChemBridge Corporation	9010026			CC(=O)N1CCN(CC1)c1ccc(NC(=O)c2ccco2)cc1Cl	InChI=1S/C17H18ClN3O3/c1-12(22)20-6-8-21(9-7-20)15-5-4-13(11-14(15)18)19-17(23)16-3-2-10-24-16/h2-5,10-11H,6-9H2,1H3,(H,19,23)	MEACCDYDYGCTLV-UHFFFAOYSA-N	347.103669176							107172
ASN 05107445	LSM-18527	SID850040, BRD-K43404287	652551	InChI=1S/C20H19FN2O4/c1-27-15-6-7-18-13(11-15)10-14(19(25)22-18)12-23(8-9-24)20(26)16-4-2-3-5-17(16)21/h2-7,10-11,24H,8-9,12H2,1H3,(H,22,25)	LFIBUXVSJGVTAP-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(CCO)C(=O)c3ccccc3F)cc2c1	BroadT	BRD-K43404287	BRD-K43404287-001-05-1	Asinex Ltd.	ASN 05107445			COc1ccc2nc(O)c(CN(CCO)C(=O)c3ccccc3F)cc2c1	InChI=1S/C20H19FN2O4/c1-27-15-6-7-18-13(11-15)10-14(19(25)22-18)12-23(8-9-24)20(26)16-4-2-3-5-17(16)21/h2-7,10-11,24H,8-9,12H2,1H3,(H,22,25)	LFIBUXVSJGVTAP-UHFFFAOYSA-N	370.132885308							107173
AMBCB82800605	LSM-18528	SID49826399, BRD-K85899538	24819337	InChI=1S/C19H18ClN3O4/c1-12-4-3-5-13(22-12)10-21-19(24)17-9-15(27-23-17)11-26-18-7-6-14(25-2)8-16(18)20/h3-9H,10-11H2,1-2H3,(H,21,24)	UWHKHLBVCXVTLV-UHFFFAOYSA-N	COc1ccc(OCc2onc(c2)C(=O)NCc3cccc(C)n3)c(Cl)c1	BroadT	BRD-K85899538	BRD-K85899538-001-05-8	ChemBridge Corporation	82800605			COc1ccc(OCc2cc(no2)C(=O)NCc2cccc(C)n2)c(Cl)c1	InChI=1S/C19H18ClN3O4/c1-12-4-3-5-13(22-12)10-21-19(24)17-9-15(27-23-17)11-26-18-7-6-14(25-2)8-16(18)20/h3-9H,10-11H2,1-2H3,(H,21,24)	UWHKHLBVCXVTLV-UHFFFAOYSA-N	387.098583796							107174
MLS001176007	LSM-18529	SID49673891, BRD-K34088856	7033665	InChI=1S/C17H17N5/c1-2-5-15-14(4-1)6-7-16(20-15)21-10-12-22(13-11-21)17-18-8-3-9-19-17/h1-9H,10-13H2	YJVPHQFVPIMSIN-UHFFFAOYSA-N	C1CN(CCN1c2ccc3ccccc3n2)c4ncccn4	BroadT	BRD-K34088856	BRD-K34088856-001-07-0	Enamine Ltd.	T5567657			C1CN(CCN1c1ccc2ccccc2n1)c1ncccn1	InChI=1S/C17H17N5/c1-2-5-15-14(4-1)6-7-16(20-15)21-10-12-22(13-11-21)17-18-8-3-9-19-17/h1-9H,10-13H2	YJVPHQFVPIMSIN-UHFFFAOYSA-N	291.148395594							107175
T5335472	LSM-18530	SID3711665, BRD-K50757825	2530022	InChI=1S/C16H20N4O3/c1-12-10-15(18-23-12)17-16(22)11-19-6-8-20(9-7-19)13-4-2-3-5-14(13)21/h2-5,10,21H,6-9,11H2,1H3,(H,17,18,22)	FUSFHSUJSQCXOU-UHFFFAOYSA-N	Cc1onc(NC(=O)CN2CCN(CC2)c3ccccc3O)c1	BroadT	BRD-K50757825	BRD-K50757825-001-05-1	Enamine Ltd.	T5335472			Cc1cc(NC(=O)CN2CCN(CC2)c2ccccc2O)no1	InChI=1S/C16H20N4O3/c1-12-10-15(18-23-12)17-16(22)11-19-6-8-20(9-7-19)13-4-2-3-5-14(13)21/h2-5,10,21H,6-9,11H2,1H3,(H,17,18,22)	FUSFHSUJSQCXOU-UHFFFAOYSA-N	316.15354054							107176
AC1MTR3I	LSM-18531	BRD-K63433685	3606512	InChI=1S/C11H17N3S2/c1-3-4-6-12-11(15)14-13-8-10-9(2)5-7-16-10/h5,7-8H,3-4,6H2,1-2H3,(H2,12,14,15)	SUTWUYBMBWPLMW-UHFFFAOYSA-N	CCCCN=C(S)NN=Cc1sccc1C	BroadT	BRD-K63433685	BRD-K63433685-001-05-3	Enamine Ltd.	T0513-2089			CCCCN=C(S)NN=Cc1sccc1C	InChI=1S/C11H17N3S2/c1-3-4-6-12-11(15)14-13-8-10-9(2)5-7-16-10/h5,7-8H,3-4,6H2,1-2H3,(H2,12,14,15)	SUTWUYBMBWPLMW-UHFFFAOYSA-N	255.086388954							107177
MLS000540613	LSM-18532	SID14729757, BRD-K15609062	1471583	InChI=1S/C22H19BrN4OS/c23-17-8-6-16(7-9-17)20-15-29-22(25-18-4-2-1-3-5-18)19(14-24)21(26-20)27-10-12-28-13-11-27/h1-9,15,25H,10-13H2	GDJWPEGMOXECJV-UHFFFAOYSA-N	Brc1ccc(cc1)C2=CSC(=C(C#N)C(=N2)N3CCOCC3)Nc4ccccc4	BroadT	BRD-K15609062	BRD-K15609062-001-05-0	Key Organics Ltd.	2M-931			Brc1ccc(cc1)C1=CSC(Nc2ccccc2)=C(C#N)C(=N1)N1CCOCC1	InChI=1S/C22H19BrN4OS/c23-17-8-6-16(7-9-17)20-15-29-22(25-18-4-2-1-3-5-18)19(14-24)21(26-20)27-10-12-28-13-11-27/h1-9,15,25H,10-13H2	GDJWPEGMOXECJV-UHFFFAOYSA-N	466.046294558							107178
MLS001116017	LSM-18533	SID24394489, SID49721747, BRD-A59157860	16016639	InChI=1S/C20H21ClN2O3/c1-14-13-23(17-11-16(21)7-8-18(17)26-14)20(25)10-9-19(24)22-12-15-5-3-2-4-6-15/h2-8,11,14H,9-10,12-13H2,1H3,(H,22,24)	SRUHLAUCYSWRSR-UHFFFAOYSA-N	CC1CN(C(=O)CCC(=O)NCc2ccccc2)c3cc(Cl)ccc3O1	BroadT	BRD-A59157860	BRD-A59157860-001-05-3	ChemDiv Inc.	E015-0386			CC1CN(C(=O)CCC(=O)NCc2ccccc2)c2cc(Cl)ccc2O1	InChI=1S/C20H21ClN2O3/c1-14-13-23(17-11-16(21)7-8-18(17)26-14)20(25)10-9-19(24)22-12-15-5-3-2-4-6-15/h2-8,11,14H,9-10,12-13H2,1H3,(H,22,24)	SRUHLAUCYSWRSR-UHFFFAOYSA-N	372.124070262							107179
CHEMBL1210920	LSM-18534	SID49643311, BRD-A44456650	2879720	InChI=1S/C18H18N2O2/c1-13(21)20-18(15-6-4-3-5-7-15)12-17(19-20)14-8-10-16(22-2)11-9-14/h3-11,18H,12H2,1-2H3	NJNSUAFGXKWRID-UHFFFAOYSA-N	COc1ccc(cc1)C2=NN(C(C2)c3ccccc3)C(=O)C	BroadT	BRD-A44456650	BRD-A44456650-001-05-1	Asinex Ltd.	BAS 01289546			COc1ccc(cc1)C1=NN(C(C1)c1ccccc1)C(C)=O	InChI=1S/C18H18N2O2/c1-13(21)20-18(15-6-4-3-5-7-15)12-17(19-20)14-8-10-16(22-2)11-9-14/h3-11,18H,12H2,1-2H3	NJNSUAFGXKWRID-UHFFFAOYSA-N	294.136827836							107180
STK278181	LSM-18535	SID4258144, BRD-K56312355	707444	InChI=1S/C15H15NO4/c17-14(18)9-7-12-6-8-13(16(12)10-15(19)20)11-4-2-1-3-5-11/h1-6,8H,7,9-10H2,(H,17,18)(H,19,20)	LXPFFYQTJXBQJX-UHFFFAOYSA-N	OC(=O)CCc1ccc(c2ccccc2)n1CC(=O)O	BroadT	BRD-K56312355	BRD-K56312355-001-05-7	ChemBridge Corporation	6843097			OC(=O)CCc1ccc(-c2ccccc2)n1CC(O)=O	InChI=1S/C15H15NO4/c17-14(18)9-7-12-6-8-13(16(12)10-15(19)20)11-4-2-1-3-5-11/h1-6,8H,7,9-10H2,(H,17,18)(H,19,20)	LXPFFYQTJXBQJX-UHFFFAOYSA-N	273.10010797							107181
CHEMDIV3_009034	LSM-18536	SID24812248, BRD-A14083717	6621788	InChI=1S/C21H21BrN2O2S/c1-2-17-16-11-14(22)6-8-19(16)27-20-7-5-13(10-18(20)24-17)21(25)23-12-15-4-3-9-26-15/h5-8,10-11,15H,2-4,9,12H2,1H3,(H,23,25)	FWDGNGNJNVPPMH-UHFFFAOYSA-N	CCC1=Nc2cc(ccc2Sc3ccc(Br)cc13)C(=O)NCC4CCCO4	BroadT	BRD-A14083717	BRD-A14083717-001-06-8	ChemDiv Inc.	C304-2167			CCC1=Nc2cc(ccc2Sc2ccc(Br)cc12)C(=O)NCC1CCCO1	InChI=1S/C21H21BrN2O2S/c1-2-17-16-11-14(22)6-8-19(16)27-20-7-5-13(10-18(20)24-17)21(25)23-12-15-4-3-9-26-15/h5-8,10-11,15H,2-4,9,12H2,1H3,(H,23,25)	FWDGNGNJNVPPMH-UHFFFAOYSA-N	444.050711222							107182
ASN 06593992	LSM-18537	SID24784863, BRD-A59045260	3223983	InChI=1S/C22H26N4O2S/c1-14-6-8-17-19(11-14)24-21(23-17)15-5-4-10-26(13-15)22(29)25-18-9-7-16(27-2)12-20(18)28-3/h6-9,11-12,15H,4-5,10,13H2,1-3H3,(H,23,24)(H,25,29)	YOVDCXKFFBPYCO-UHFFFAOYSA-N	COc1ccc(N=C(S)N2CCCC(C2)c3nc4cc(C)ccc4[nH]3)c(OC)c1	BroadT	BRD-A59045260	BRD-A59045260-001-05-6	Asinex Ltd.	ASN 06593992			COc1ccc(N=C(S)N2CCCC(C2)c2nc3cc(C)ccc3[nH]2)c(OC)c1	InChI=1S/C22H26N4O2S/c1-14-6-8-17-19(11-14)24-21(23-17)15-5-4-10-26(13-15)22(29)25-18-9-7-16(27-2)12-20(18)28-3/h6-9,11-12,15H,4-5,10,13H2,1-3H3,(H,23,24)(H,25,29)	YOVDCXKFFBPYCO-UHFFFAOYSA-N	410.177646802							107183
4-Oxo-3-phenyl-4H-chromen-7-yl acetate	LSM-18538	SID24823984, BRD-K23752005	746449	InChI=1S/C17H12O4/c1-11(18)21-13-7-8-14-16(9-13)20-10-15(17(14)19)12-5-3-2-4-6-12/h2-10H,1H3	WFVAMCNYBITPBJ-UHFFFAOYSA-N	CC(=O)Oc1ccc2C(=O)C(=COc2c1)c3ccccc3	BroadT	BRD-K23752005	BRD-K23752005-001-05-8	InterBioScreen Ltd.	STOCK1N-03373			CC(=O)Oc1ccc2c(c1)occ(-c1ccccc1)c2=O	InChI=1S/C17H12O4/c1-11(18)21-13-7-8-14-16(9-13)20-10-15(17(14)19)12-5-3-2-4-6-12/h2-10H,1H3	WFVAMCNYBITPBJ-UHFFFAOYSA-N	280.073558864							107184
AC1N8XAF	LSM-18539	BRD-K06379841	4401549	InChI=1S/C14H18N4/c1-2-6-11(7-3-1)10-15-18-14-16-12-8-4-5-9-13(12)17-14/h4-5,8-11H,1-3,6-7H2,(H2,16,17,18)	SMWMWPMXBMSTCX-UHFFFAOYSA-N	C1CCC(CC1)C=NNc2nc3ccccc3[nH]2	BroadT	BRD-K06379841	BRD-K06379841-001-05-9	Enamine Ltd.	T0511-5520			C1CCC(CC1)C=NNc1nc2ccccc2[nH]1	InChI=1S/C14H18N4/c1-2-6-11(7-3-1)10-15-18-14-16-12-8-4-5-9-13(12)17-14/h4-5,8-11H,1-3,6-7H2,(H2,16,17,18)	SMWMWPMXBMSTCX-UHFFFAOYSA-N	242.153146616							107185
NSC205511	LSM-18540	SID124923, SID4254016, SID49645140, BRD-K80290312	307406	InChI=1S/C19H13NO5/c21-17(14-9-8-12(18(22)23)10-15(14)19(24)25)20-16-7-3-5-11-4-1-2-6-13(11)16/h1-10H,(H,20,21)(H,22,23)(H,24,25)	MXKJSOMQCBHQQL-UHFFFAOYSA-N	OC(=O)c1ccc(C(=O)Nc2cccc3ccccc23)c(c1)C(=O)O	BroadT	BRD-K80290312	BRD-K80290312-001-05-7	Asinex Ltd.	BAS 01516323			OC(=O)c1ccc(C(=O)Nc2cccc3ccccc23)c(c1)C(O)=O	InChI=1S/C19H13NO5/c21-17(14-9-8-12(18(22)23)10-15(14)19(24)25)20-16-7-3-5-11-4-1-2-6-13(11)16/h1-10H,(H,20,21)(H,22,23)(H,24,25)	MXKJSOMQCBHQQL-UHFFFAOYSA-N	335.079372526							107186
4-(2,4-Dimethyl-phenyl)-2H-phthalazin-1-one	LSM-18541	SID49642148, BRD-K14163110	890907	InChI=1S/C16H14N2O/c1-10-7-8-12(11(2)9-10)15-13-5-3-4-6-14(13)16(19)18-17-15/h3-9H,1-2H3,(H,18,19)	VPXCBMLQCAPFLY-UHFFFAOYSA-N	Cc1ccc(c(C)c1)c2nnc(O)c3ccccc23	BroadT	BRD-K14163110	BRD-K14163110-001-05-1	Asinex Ltd.	BAS 05881738			Cc1ccc(c(C)c1)-c1nnc(O)c2ccccc12	InChI=1S/C16H14N2O/c1-10-7-8-12(11(2)9-10)15-13-5-3-4-6-14(13)16(19)18-17-15/h3-9H,1-2H3,(H,18,19)	VPXCBMLQCAPFLY-UHFFFAOYSA-N	250.110613088							107187
ZINC00350247	LSM-18542	SID24794173, BRD-K09117598	828721	InChI=1S/C16H17N3OS/c1-16(2,3)19-10-17-12-9-11(6-7-13(12)19)18-15(20)14-5-4-8-21-14/h4-10H,1-3H3,(H,18,20)	KWASWJQOIWDSGD-UHFFFAOYSA-N	CC(C)(C)n1cnc2cc(NC(=O)c3cccs3)ccc12	BroadT	BRD-K09117598	BRD-K09117598-001-05-5	ChemBridge Corporation	7964051			CC(C)(C)n1cnc2cc(NC(=O)c3cccs3)ccc12	InChI=1S/C16H17N3OS/c1-16(2,3)19-10-17-12-9-11(6-7-13(12)19)18-15(20)14-5-4-8-21-14/h4-10H,1-3H3,(H,18,20)	KWASWJQOIWDSGD-UHFFFAOYSA-N	299.109232884							107188
MLS000065272	LSM-18543	SID4255089, BRD-K69985339	974498	InChI=1S/C12H11NO4/c1-13-11(14)8-6-7-4-3-5-9(16-2)10(7)17-12(8)15/h3-6H,1-2H3,(H,13,14)	LOVTUHYZJSFFMH-UHFFFAOYSA-N	CNC(=O)C1=Cc2cccc(OC)c2OC1=O	BroadT	BRD-K69985339	BRD-K69985339-001-06-4	ChemBridge Corporation	7915480			CNC(=O)c1cc2cccc(OC)c2oc1=O	InChI=1S/C12H11NO4/c1-13-11(14)8-6-7-4-3-5-9(16-2)10(7)17-12(8)15/h3-6H,1-2H3,(H,13,14)	LOVTUHYZJSFFMH-UHFFFAOYSA-N	233.068807842							107189
MLS000090818	LSM-18544	SID4247166, BRD-K27497213	3241402	InChI=1S/C20H16N4O3/c25-15-5-2-13(3-6-15)18-19(24-9-1-8-21-20(24)23-18)22-14-4-7-16-17(12-14)27-11-10-26-16/h1-9,12,22,25H,10-11H2	KHSKNUHXDDCAFX-UHFFFAOYSA-N	Oc1ccc(cc1)c2nc3ncccn3c2Nc4ccc5OCCOc5c4	BroadT	BRD-K27497213	BRD-K27497213-001-06-2	ChemDiv Inc.	C273-0460			Oc1ccc(cc1)-c1nc2ncccn2c1Nc1ccc2OCCOc2c1	InChI=1S/C20H16N4O3/c25-15-5-2-13(3-6-15)18-19(24-9-1-8-21-20(24)23-18)22-14-4-7-16-17(12-14)27-11-10-26-16/h1-9,12,22,25H,10-11H2	KHSKNUHXDDCAFX-UHFFFAOYSA-N	360.122240412							107190
AC1M7HSQ	LSM-43772	SID26670658, BRD-K96653464	2418407	InChI=1S/C21H21NO4/c1-21(2)17-6-4-5-7-18(17)22(3)19(21)12-16(24)13-26-20(25)14-8-10-15(23)11-9-14/h4-12,23H,13H2,1-3H3/b19-12-	QFXPMNWELUNACY-UNOMPAQXSA-N	CN1\C(=C/C(=O)COC(=O)c2ccc(O)cc2)\C(C)(C)c3ccccc13	BroadT	BRD-K96653464	BRD-K96653464-001-05-4	Enamine Ltd.	T0515-5991			CN1c2ccccc2C(C)(C)\C1=C\C(=O)COC(=O)c1ccc(O)cc1	InChI=1S/C21H21NO4/c1-21(2)17-6-4-5-7-18(17)22(3)19(21)12-16(24)13-26-20(25)14-8-10-15(23)11-9-14/h4-12,23H,13H2,1-3H3/b19-12-	QFXPMNWELUNACY-UNOMPAQXSA-N	351.147058162							
AC1LHOZA	LSM-18546	BRD-K55933216	841586	InChI=1S/C16H15FN2OS/c17-14-7-3-1-5-11(14)9-18-19-16(20)13-10-21-15-8-4-2-6-12(13)15/h1,3,5,7,9-10H,2,4,6,8H2,(H,19,20)	MEXLFAAMHFFHKW-UHFFFAOYSA-N	Fc1ccccc1C=NNC(=O)c2csc3CCCCc23	BroadT	BRD-K55933216	BRD-K55933216-001-07-6	Specs	AK-968/40734228			Fc1ccccc1C=NNC(=O)c1csc2CCCCc12	InChI=1S/C16H15FN2OS/c17-14-7-3-1-5-11(14)9-18-19-16(20)13-10-21-15-8-4-2-6-12(13)15/h1,3,5,7,9-10H,2,4,6,8H2,(H,19,20)	MEXLFAAMHFFHKW-UHFFFAOYSA-N	302.08891201							107192
STK015176	LSM-18547	SID7972552, BRD-K96520375	882212	InChI=1S/C15H21NO3/c1-4-11(5-2)14(17)16-13-9-7-12(8-10-13)15(18)19-6-3/h7-11H,4-6H2,1-3H3,(H,16,17)	JHXUNUIAXSKPEP-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)C(CC)CC)cc1	BroadT	BRD-K96520375	BRD-K96520375-001-05-3	ChemBridge Corporation	6430062			CCOC(=O)c1ccc(NC(=O)C(CC)CC)cc1	InChI=1S/C15H21NO3/c1-4-11(5-2)14(17)16-13-9-7-12(8-10-13)15(18)19-6-3/h7-11H,4-6H2,1-3H3,(H,16,17)	JHXUNUIAXSKPEP-UHFFFAOYSA-N	263.152143542							107193
AC1LD9DN	LSM-18548	SID26660101, BRD-A07950339	614407	InChI=1S/C24H26N2O2/c1-24(18-10-14-20(28-3)15-11-18)16-23(17-8-12-19(27-2)13-9-17)25-21-6-4-5-7-22(21)26-24/h4-15,23,25-26H,16H2,1-3H3	IWKLXNHIGJNDLO-UHFFFAOYSA-N	COc1ccc(cc1)C2CC(C)(Nc3ccccc3N2)c4ccc(OC)cc4	BroadT	BRD-A07950339	BRD-A07950339-001-05-7	InterBioScreen Ltd.	STOCK1S-00306			COc1ccc(cc1)C1CC(C)(Nc2ccccc2N1)c1ccc(OC)cc1	InChI=1S/C24H26N2O2/c1-24(18-10-14-20(28-3)15-11-18)16-23(17-8-12-19(27-2)13-9-17)25-21-6-4-5-7-22(21)26-24/h4-15,23,25-26H,16H2,1-3H3	IWKLXNHIGJNDLO-UHFFFAOYSA-N	374.199428092							107194
AC1OA3GG	LSM-18549	BRD-K12460001	6797880	InChI=1S/C19H11ClN4O4S/c20-13-6-4-11(5-7-13)14-9-29-18-16(14)19(26)23(10-21-18)22-8-12-2-1-3-15(17(12)25)24(27)28/h1-10,25H	UVEQNCCOIUYCOC-UHFFFAOYSA-N	Oc1c(C=NN2C=Nc3scc(c4ccc(Cl)cc4)c3C2=O)cccc1[N+](=O)[O-]	BroadT	BRD-K12460001	BRD-K12460001-001-05-5	ChemDiv Inc.	K018-0004			Oc1c(C=Nn2cnc3scc(-c4ccc(Cl)cc4)c3c2=O)cccc1[N+]([O-])=O	InChI=1S/C19H11ClN4O4S/c20-13-6-4-11(5-7-13)14-9-29-18-16(14)19(26)23(10-21-18)22-8-12-2-1-3-15(17(12)25)24(27)28/h1-10,25H	UVEQNCCOIUYCOC-UHFFFAOYSA-N	426.018953272							
1-(4-Amino-1,2,5-oxadiazol-3-yl)-n-[[4-[(3-methylphenyl)methoxy]phenyl]methylideneamino]-5-(piperidin-1-ylmethyl)triazole-4-carboxamide	LSM-18550	BRD-K07826724	1953340	InChI=1S/C26H29N9O3/c1-18-6-5-7-20(14-18)17-37-21-10-8-19(9-11-21)15-28-30-26(36)23-22(16-34-12-3-2-4-13-34)35(33-29-23)25-24(27)31-38-32-25/h5-11,14-15H,2-4,12-13,16-17H2,1H3,(H2,27,31)(H,30,36)	FIWVAISHBIQYOU-UHFFFAOYSA-N	Cc1cccc(COc2ccc(C=NNC(=O)c3nnn(c3CN4CCCCC4)c5nonc5N)cc2)c1	BroadT	BRD-K07826724	BRD-K07826724-001-06-8	InterBioScreen Ltd.	STOCK2S-97691			Cc1cccc(COc2ccc(C=NNC(=O)c3nnn(c3CN3CCCCC3)-c3nonc3N)cc2)c1	InChI=1S/C26H29N9O3/c1-18-6-5-7-20(14-18)17-37-21-10-8-19(9-11-21)15-28-30-26(36)23-22(16-34-12-3-2-4-13-34)35(33-29-23)25-24(27)31-38-32-25/h5-11,14-15H,2-4,12-13,16-17H2,1H3,(H2,27,31)(H,30,36)	FIWVAISHBIQYOU-UHFFFAOYSA-N	515.239335878							107196
T0504-3130	LSM-18551	SID24831735, BRD-K88704851	2323145	InChI=1S/C24H20N6O3S/c1-33-19-9-7-16(8-10-19)21-20(15-30(29-21)18-5-3-2-4-6-18)23(32)26-24(34)28-27-22(31)17-11-13-25-14-12-17/h2-15H,1H3,(H,27,31)(H2,26,28,32,34)	OXZNJZJIVRAPKM-UHFFFAOYSA-N	COc1ccc(cc1)c2nn(cc2C(=O)NC(=S)NNC(=O)c3ccncc3)c4ccccc4	BroadT	BRD-K88704851	BRD-K88704851-001-05-6	Enamine Ltd.	T0504-3130			COc1ccc(cc1)-c1nn(cc1C(=O)NC(=S)NNC(=O)c1ccncc1)-c1ccccc1	InChI=1S/C24H20N6O3S/c1-33-19-9-7-16(8-10-19)21-20(15-30(29-21)18-5-3-2-4-6-18)23(32)26-24(34)28-27-22(31)17-11-13-25-14-12-17/h2-15H,1H3,(H,27,31)(H2,26,28,32,34)	OXZNJZJIVRAPKM-UHFFFAOYSA-N	472.13175925							107197
AC1LD8KV	LSM-18552	SID861781, BRD-A94224584	663008	InChI=1S/C19H25FNO3P/c1-14(2)13-24-25(23,16-11-9-15(10-12-16)21(3)4)19(22)17-7-5-6-8-18(17)20/h5-12,14,19,22H,13H2,1-4H3	QOVNMUHVDCGDOR-UHFFFAOYSA-N	CC(C)COP(=O)(C(O)c1ccccc1F)c2ccc(cc2)N(C)C	BroadT	BRD-A94224584	BRD-A94224584-001-05-3	InterBioScreen Ltd.	STOCK4S-21586			CC(C)COP(=O)(C(O)c1ccccc1F)c1ccc(cc1)N(C)C	InChI=1S/C19H25FNO3P/c1-14(2)13-24-25(23,16-11-9-15(10-12-16)21(3)4)19(22)17-7-5-6-8-18(17)20/h5-12,14,19,22H,13H2,1-4H3	QOVNMUHVDCGDOR-UHFFFAOYSA-N	365.15560838							107198
MLS000533551	LSM-18553	SID14739307, BRD-A14804000	2872337	InChI=1S/C21H17ClN4O/c1-13-18-19(15-8-5-9-16(22)10-15)17(11-23)20(24)27-21(18)26(25-13)12-14-6-3-2-4-7-14/h2-10,19H,12,24H2,1H3	RQDMRECGWKSRHK-UHFFFAOYSA-N	Cc1nn(Cc2ccccc2)c3OC(=C(C#N)C(c4cccc(Cl)c4)c13)N	BroadT	BRD-A14804000	BRD-A14804000-001-06-3	ChemBridge Corporation	5846355			Cc1nn(Cc2ccccc2)c2OC(N)=C(C#N)C(c12)c1cccc(Cl)c1	InChI=1S/C21H17ClN4O/c1-13-18-19(15-8-5-9-16(22)10-15)17(11-23)20(24)27-21(18)26(25-13)12-14-6-3-2-4-7-14/h2-10,19H,12,24H2,1H3	RQDMRECGWKSRHK-UHFFFAOYSA-N	376.109088914							107199
SMR000015984	LSM-43773	SID7971377, BRD-K89151668	3309622	InChI=1S/C15H17N5/c1-3-11-5-7-12(8-6-11)20(4-2)15-13-14(17-9-16-13)18-10-19-15/h5-10H,3-4H2,1-2H3,(H,16,17,18,19)	ORQLFPFMAQXHPJ-UHFFFAOYSA-N	CCN(c1ccc(CC)cc1)c2[nH]cnc3ncnc23	BroadT	BRD-K89151668	BRD-K89151668-001-04-5	Life Chemicals Inc.	F0578-0271			CCN(c1ccc(CC)cc1)c1[nH]cnc2ncnc12	InChI=1S/C15H17N5/c1-3-11-5-7-12(8-6-11)20(4-2)15-13-14(17-9-16-13)18-10-19-15/h5-10H,3-4H2,1-2H3,(H,16,17,18,19)	ORQLFPFMAQXHPJ-UHFFFAOYSA-N	267.148395594							
AC1LUMW8	LSM-43774	SID26726199, BRD-K88382587	1611891	InChI=1S/C22H17N5O3S/c28-21(16-4-3-12-23-14-16)11-13-24-17-7-9-18(10-8-17)31(29,30)27-22-15-25-19-5-1-2-6-20(19)26-22/h1-15,24H,(H,26,27)/b13-11+	WCNNPCOXUROICN-ACCUITESSA-N	O=C(\C=C\Nc1ccc(cc1)S(=O)(=O)Nc2cnc3ccccc3n2)c4cccnc4	BroadT	BRD-K88382587	BRD-K88382587-001-05-2	InterBioScreen Ltd.	STOCK2S-11930			O=C(\C=C\Nc1ccc(cc1)S(=O)(=O)Nc1cnc2ccccc2n1)c1cccnc1	InChI=1S/C22H17N5O3S/c28-21(16-4-3-12-23-14-16)11-13-24-17-7-9-18(10-8-17)31(29,30)27-22-15-25-19-5-1-2-6-20(19)26-22/h1-15,24H,(H,26,27)/b13-11+	WCNNPCOXUROICN-ACCUITESSA-N	431.105210144							
Isovincamine	LSM-18556	SID26664576, SID398192, BRD-A47175490	5668	InChI=1S/C21H26N2O3/c1-3-20-10-6-11-22-12-9-15-14-7-4-5-8-16(14)23(17(15)18(20)22)21(25,13-20)19(24)26-2/h4-5,7-8,18,25H,3,6,9-13H2,1-2H3	RXPRRQLKFXBCSJ-UHFFFAOYSA-N	CCC12CCCN3CCc4c(C13)n(c5ccccc45)C(O)(C2)C(=O)OC	BroadT	BRD-A47175490	BRD-A47175490-001-04-1	National Cancer Institute Chemotherapeutic Agents Repository	Isovincamine 131616			CCC12CCCN3CCc4c(C13)n(c1ccccc41)C(O)(C2)C(=O)OC	InChI=1S/C21H26N2O3/c1-3-20-10-6-11-22-12-9-15-14-7-4-5-8-16(14)23(17(15)18(20)22)21(25,13-20)19(24)26-2/h4-5,7-8,18,25H,3,6,9-13H2,1-2H3	RXPRRQLKFXBCSJ-UHFFFAOYSA-N	354.194342712							107202
MLS000416488	LSM-18557	SID22405310, BRD-A65739997	4881083	InChI=1S/C25H26N2O5S/c1-17(2)27-33(30,31)23-15-11-21(12-16-23)26-25(29)18(3)32-22-13-9-20(10-14-22)24(28)19-7-5-4-6-8-19/h4-18,27H,1-3H3,(H,26,29)	QIPQZGYKZDHDPJ-UHFFFAOYSA-N	CC(C)NS(=O)(=O)c1ccc(NC(=O)C(C)Oc2ccc(cc2)C(=O)c3ccccc3)cc1	BroadT	BRD-A65739997	BRD-A65739997-001-05-6	Enamine Ltd.	T5321499			CC(C)NS(=O)(=O)c1ccc(NC(=O)C(C)Oc2ccc(cc2)C(=O)c2ccccc2)cc1	InChI=1S/C25H26N2O5S/c1-17(2)27-33(30,31)23-15-11-21(12-16-23)26-25(29)18(3)32-22-13-9-20(10-14-22)24(28)19-7-5-4-6-8-19/h4-18,27H,1-3H3,(H,26,29)	QIPQZGYKZDHDPJ-UHFFFAOYSA-N	466.156242642							107203
SMR000136685	LSM-18558	SID14733792, BRD-K12534010	2197281	InChI=1S/C24H25N5O4S2/c1-15-16(2)28-33-23(15)29-35(31,32)20-10-8-19(9-11-20)26-22(30)14-34-24-18(13-25)12-17-6-4-3-5-7-21(17)27-24/h8-12,29H,3-7,14H2,1-2H3,(H,26,30)	HAFBNDMAOWSKGB-UHFFFAOYSA-N	Cc1noc(NS(=O)(=O)c2ccc(NC(=O)CSc3nc4CCCCCc4cc3C#N)cc2)c1C	BroadT	BRD-K12534010	BRD-K12534010-001-05-6	ChemBridge Corporation	7671565			Cc1noc(NS(=O)(=O)c2ccc(NC(=O)CSc3nc4CCCCCc4cc3C#N)cc2)c1C	InChI=1S/C24H25N5O4S2/c1-15-16(2)28-33-23(15)29-35(31,32)20-10-8-19(9-11-20)26-22(30)14-34-24-18(13-25)12-17-6-4-3-5-7-21(17)27-24/h8-12,29H,3-7,14H2,1-2H3,(H,26,30)	HAFBNDMAOWSKGB-UHFFFAOYSA-N	511.13479571							107204
AC1O0VPI	LSM-43775	SID24812752, BRD-K44962714	6103449	InChI=1S/C21H19N3OS/c1-3-23-17-12-8-7-9-15(17)13-14-18(23)19-20(25)22(2)21(26)24(19)16-10-5-4-6-11-16/h4-14H,3H2,1-2H3/b19-18+	AVWSRKJKCVEYCC-VHEBQXMUSA-N	CCN1\C(=C/2\N(C(=S)N(C)C2=O)c3ccccc3)\C=Cc4ccccc14	BroadT	BRD-K44962714	BRD-K44962714-001-06-8	ChemDiv Inc.	1362-0064			CCN1c2ccccc2C=C\C1=C1/N(C(=S)N(C)C1=O)c1ccccc1	InChI=1S/C21H19N3OS/c1-3-23-17-12-8-7-9-15(17)13-14-18(23)19-20(25)22(2)21(26)24(19)16-10-5-4-6-11-16/h4-14H,3H2,1-2H3/b19-18+	AVWSRKJKCVEYCC-VHEBQXMUSA-N	361.124882948							
AC1NDZNH	LSM-18560	SID24840994, BRD-K37767551	4634206	InChI=1S/C19H22N6O6/c1-4-30-12-7-5-6-8-13(12)31-10-15(27)22-21-14(26)9-25-11-20-17-16(25)18(28)24(3)19(29)23(17)2/h5-8,11H,4,9-10H2,1-3H3,(H,21,26)(H,22,27)	HITLLWUXFLNTQH-UHFFFAOYSA-N	CCOc1ccccc1OCC(=O)NNC(=O)Cn2cnc3N(C)C(=O)N(C)C(=O)c23	BroadT	BRD-K37767551	BRD-K37767551-001-05-8	Enamine Ltd.	T0517-5303			CCOc1ccccc1OCC(=O)NNC(=O)Cn1cnc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C19H22N6O6/c1-4-30-12-7-5-6-8-13(12)31-10-15(27)22-21-14(26)9-25-11-20-17-16(25)18(28)24(3)19(29)23(17)2/h5-8,11H,4,9-10H2,1-3H3,(H,21,26)(H,22,27)	HITLLWUXFLNTQH-UHFFFAOYSA-N	430.160082484							107206
MLS000697281	LSM-43776	SID22400661, BRD-K60442535	2141470	InChI=1S/C18H15ClN2O3S3/c19-14-5-1-13(2-6-14)11-16-17(22)21(18(25)26-16)10-9-12-3-7-15(8-4-12)27(20,23)24/h1-8,11H,9-10H2,(H2,20,23,24)/b16-11+	HBKQIISXGIQMKD-LFIBNONCSA-N	NS(=O)(=O)c1ccc(CCN2C(=S)S\C(=C\c3ccc(Cl)cc3)\C2=O)cc1	BroadT	BRD-K60442535	BRD-K60442535-001-05-9	Life Chemicals Inc.	F1622-0044			NS(=O)(=O)c1ccc(CCN2C(=S)S\C(=C\c3ccc(Cl)cc3)C2=O)cc1	InChI=1S/C18H15ClN2O3S3/c19-14-5-1-13(2-6-14)11-16-17(22)21(18(25)26-16)10-9-12-3-7-15(8-4-12)27(20,23)24/h1-8,11H,9-10H2,(H2,20,23,24)/b16-11+	HBKQIISXGIQMKD-LFIBNONCSA-N	437.99333214							
T5988431	LSM-15274	BRD-K79921797	4110637	InChI=1S/C27H26N4O/c32-27(29-21-13-16-31(17-14-21)19-20-8-2-1-3-9-20)23-18-26(25-12-6-7-15-28-25)30-24-11-5-4-10-22(23)24/h1-12,15,18,21H,13-14,16-17,19H2,(H,29,32)	LSOIQFQNLHWNNY-UHFFFAOYSA-N	O=C(NC1CCN(Cc2ccccc2)CC1)c3cc(nc4ccccc34)c5ccccn5	BroadT	BRD-K79921797	BRD-K79921797-003-05-0	Enamine Ltd.	T0505-8157		Cl	O=C(NC1CCN(Cc2ccccc2)CC1)c1cc(nc2ccccc12)-c1ccccn1.Cl	InChI=1S/C27H26N4O.ClH/c32-27(29-21-13-16-31(17-14-21)19-20-8-2-1-3-9-20)23-18-26(25-12-6-7-15-28-25)30-24-11-5-4-10-22(23)24;/h1-12,15,18,21H,13-14,16-17,19H2,(H,29,32);1H	LMJFHFOMUZNQCG-UHFFFAOYSA-N	422.210661492							103921, 103921
ZINC03348102	LSM-18562	SID26670478, BRD-K76466229	4880619	InChI=1S/C23H24N6O3S/c1-3-28-17-12-8-7-11-16(17)25-23(28)33-14-18(30)27(2)19-20(24)29(22(32)26-21(19)31)13-15-9-5-4-6-10-15/h4-12H,3,13-14,24H2,1-2H3,(H,26,31,32)	CRLSRLPQMRZXHJ-UHFFFAOYSA-N	CCn1c(SCC(=O)N(C)C2=C(N)N(Cc3ccccc3)C(=O)NC2=O)nc4ccccc14	BroadT	BRD-K76466229	BRD-K76466229-001-06-9	Enamine Ltd.	T5320030			CCn1c(SCC(=O)N(C)c2c(N)n(Cc3ccccc3)c(=O)[nH]c2=O)nc2ccccc12	InChI=1S/C23H24N6O3S/c1-3-28-17-12-8-7-11-16(17)25-23(28)33-14-18(30)27(2)19-20(24)29(22(32)26-21(19)31)13-15-9-5-4-6-10-15/h4-12H,3,13-14,24H2,1-2H3,(H,26,31,32)	CRLSRLPQMRZXHJ-UHFFFAOYSA-N	464.163059378							107208
STK346387	LSM-18563	SID26669435, SID4259048, BRD-K68481647	1299265	InChI=1S/C20H24BrN3O4S/c1-14-12-15(21)13-18(19(14)28-2)20(25)22-16-4-6-17(7-5-16)23-8-10-24(11-9-23)29(3,26)27/h4-7,12-13H,8-11H2,1-3H3,(H,22,25)	BRIIAJUUYKBFES-UHFFFAOYSA-N	COc1c(C)cc(Br)cc1C(=O)Nc2ccc(cc2)N3CCN(CC3)S(=O)(=O)C	BroadT	BRD-K68481647	BRD-K68481647-001-05-4	ChemBridge Corporation	7876156			COc1c(C)cc(Br)cc1C(=O)Nc1ccc(cc1)N1CCN(CC1)S(C)(=O)=O	InChI=1S/C20H24BrN3O4S/c1-14-12-15(21)13-18(19(14)28-2)20(25)22-16-4-6-17(7-5-16)23-8-10-24(11-9-23)29(3,26)27/h4-7,12-13H,8-11H2,1-3H3,(H,22,25)	BRIIAJUUYKBFES-UHFFFAOYSA-N	481.067089568							107209
AC1M3LL9	LSM-43777	BRD-K15272340	2192482	InChI=1S/C17H21N3O3/c1-13(2)5-4-6-14(3)11-12-18-19-17(21)15-7-9-16(10-8-15)20(22)23/h5,7-12H,4,6H2,1-3H3,(H,19,21)/b14-11+,18-12?	KILWMCDGYWJBGS-LIVPTCIVSA-N	CC(=CCC\C(=C\C=NNC(=O)c1ccc(cc1)[N+](=O)[O-])\C)C	BroadT	BRD-K15272340	BRD-K15272340-001-05-1	ChemBridge Corporation	5105535			CC(C)=CCC\C(C)=C\C=NNC(=O)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C17H21N3O3/c1-13(2)5-4-6-14(3)11-12-18-19-17(21)15-7-9-16(10-8-15)20(22)23/h5,7-12H,4,6H2,1-3H3,(H,19,21)/b14-11+,18-12?	KILWMCDGYWJBGS-LIVPTCIVSA-N	315.158291562							
BRD-A74020693	LSM-18565			InChI=1S/C24H25NO5/c1-24(2)10-16-23(17(26)11-24)22(13-5-6-18-21(7-13)30-12-29-18)14-8-19(27-3)20(28-4)9-15(14)25-16/h5-9,22-23H,10-12H2,1-4H3	AZWZGNXWANEQPZ-UHFFFAOYSA-N	COc1cc2N=C3CC(C)(C)CC(=O)C3C(c4ccc5OCOc5c4)c2cc1OC	BroadT	BRD-A74020693	BRD-A74020693-001-05-7	ChemDiv Inc.	C276-1031			COc1cc2N=C3CC(C)(C)CC(=O)C3C(c3ccc4OCOc4c3)c2cc1OC	InChI=1S/C24H25NO5/c1-24(2)10-16-23(17(26)11-24)22(13-5-6-18-21(7-13)30-12-29-18)14-8-19(27-3)20(28-4)9-15(14)25-16/h5-9,22-23H,10-12H2,1-4H3	AZWZGNXWANEQPZ-UHFFFAOYSA-N	407.17327291							107211
BAS 05604102	LSM-18566	SID853070, BRD-K49620646	655711	InChI=1S/C14H16N2O2S/c1-3-11-13(10-7-5-4-6-8-10)16-14(19-11)15-12(17)9-18-2/h4-8H,3,9H2,1-2H3,(H,15,16,17)	MHPMZNKSCNJFHV-UHFFFAOYSA-N	CCc1sc(NC(=O)COC)nc1c2ccccc2	BroadT	BRD-K49620646	BRD-K49620646-001-05-2	Asinex Ltd.	BAS 05604102			CCc1sc(NC(=O)COC)nc1-c1ccccc1	InChI=1S/C14H16N2O2S/c1-3-11-13(10-7-5-4-6-8-10)16-14(19-11)15-12(17)9-18-2/h4-8H,3,9H2,1-2H3,(H,15,16,17)	MHPMZNKSCNJFHV-UHFFFAOYSA-N	276.093248462							107212
F1835-0175	LSM-18567	SID51085888, BRD-K50937034	7190498	InChI=1S/C20H16N6O2S/c1-13(27)14-5-7-15(8-6-14)22-18(28)12-29-19-10-9-17-23-24-20(26(17)25-19)16-4-2-3-11-21-16/h2-11H,12H2,1H3,(H,22,28)	NQYWPEYUYIJTTM-UHFFFAOYSA-N	CC(=O)c1ccc(NC(=O)CSc2ccc3nnc(c4ccccn4)n3n2)cc1	BroadT	BRD-K50937034	BRD-K50937034-001-05-6	Life Chemicals Inc.	F1835-0175			CC(=O)c1ccc(NC(=O)CSc2ccc3nnc(-c4ccccn4)n3n2)cc1	InChI=1S/C20H16N6O2S/c1-13(27)14-5-7-15(8-6-14)22-18(28)12-29-19-10-9-17-23-24-20(26(17)25-19)16-4-2-3-11-21-16/h2-11H,12H2,1H3,(H,22,28)	NQYWPEYUYIJTTM-UHFFFAOYSA-N	404.105544502							107213
ZINC00311079	LSM-18568	SID24808489, BRD-K13456602	803078	InChI=1S/C16H17NO5S/c1-20-13-8-11(16(19)22-3)12(9-14(13)21-2)17-15(18)7-10-5-4-6-23-10/h4-6,8-9H,7H2,1-3H3,(H,17,18)	GWIRYOOQAMFEDV-UHFFFAOYSA-N	COC(=O)c1cc(OC)c(OC)cc1NC(=O)Cc2cccs2	BroadT	BRD-K13456602	BRD-K13456602-001-05-5	Asinex Ltd.	BAS 08979441			COC(=O)c1cc(OC)c(OC)cc1NC(=O)Cc1cccs1	InChI=1S/C16H17NO5S/c1-20-13-8-11(16(19)22-3)12(9-14(13)21-2)17-15(18)7-10-5-4-6-23-10/h4-6,8-9H,7H2,1-3H3,(H,17,18)	GWIRYOOQAMFEDV-UHFFFAOYSA-N	335.082743344							107214
F0582-0541	LSM-18569	SID17514843, BRD-K75868825	2156560	InChI=1S/C27H22N2O3S/c1-17-10-12-18(13-11-17)24-25(20-7-3-4-8-22(20)29-24)33-15-14-28-26(30)21-16-19-6-2-5-9-23(19)32-27(21)31/h2-13,16,29H,14-15H2,1H3,(H,28,30)	TYHJTFGGRHDHLD-UHFFFAOYSA-N	Cc1ccc(cc1)c2[nH]c3ccccc3c2SCCNC(=O)C4=Cc5ccccc5OC4=O	BroadT	BRD-K75868825	BRD-K75868825-001-04-0	Life Chemicals Inc.	F0582-0541			Cc1ccc(cc1)-c1[nH]c2ccccc2c1SCCNC(=O)c1cc2ccccc2oc1=O	InChI=1S/C27H22N2O3S/c1-17-10-12-18(13-11-17)24-25(20-7-3-4-8-22(20)29-24)33-15-14-28-26(30)21-16-19-6-2-5-9-23(19)32-27(21)31/h2-13,16,29H,14-15H2,1H3,(H,28,30)	TYHJTFGGRHDHLD-UHFFFAOYSA-N	454.135113274							107215
AC1MFTJ6	LSM-18570	SID24803407, BRD-A28107346	2975507	InChI=1S/C20H19N3O3S/c1-3-17(19(26)21-14-10-8-13(9-11-14)12(2)24)27-20-22-16-7-5-4-6-15(16)18(25)23-20/h4-11,17H,3H2,1-2H3,(H,21,26)(H,22,23,25)	IVJJEVDRHUKHKE-UHFFFAOYSA-N	CCC(Sc1nc(O)c2ccccc2n1)C(=O)Nc3ccc(cc3)C(=O)C	BroadT	BRD-A28107346	BRD-A28107346-001-05-0	Asinex Ltd.	BAS 10318670			CCC(Sc1nc(O)c2ccccc2n1)C(=O)Nc1ccc(cc1)C(C)=O	InChI=1S/C20H19N3O3S/c1-3-17(19(26)21-14-10-8-13(9-11-14)12(2)24)27-20-22-16-7-5-4-6-15(16)18(25)23-20/h4-11,17H,3H2,1-2H3,(H,21,26)(H,22,23,25)	IVJJEVDRHUKHKE-UHFFFAOYSA-N	381.114712188							107216
MLS000041833	LSM-18571	SID862818, BRD-K37108405	664051	InChI=1S/C13H9N3O3/c14-7-10-12(15-8-9-3-1-5-17-9)19-13(16-10)11-4-2-6-18-11/h1-6,15H,8H2	XOFNCPWBUITSOU-UHFFFAOYSA-N	N#Cc1nc(oc1NCc2occc2)c3occc3	BroadT	BRD-K37108405	BRD-K37108405-001-05-3	InterBioScreen Ltd.	STOCK4S-55169			N#Cc1nc(oc1NCc1ccco1)-c1ccco1	InChI=1S/C13H9N3O3/c14-7-10-12(15-8-9-3-1-5-17-9)19-13(16-10)11-4-2-6-18-11/h1-6,15H,8H2	XOFNCPWBUITSOU-UHFFFAOYSA-N	255.064391178							107217
ZINC04812419	LSM-43778	SID26661031, BRD-K77526282	6040156	InChI=1S/C18H16O4/c1-12-2-5-14(16(20)10-12)15(19)6-3-13-4-7-17-18(11-13)22-9-8-21-17/h2-7,10-11,20H,8-9H2,1H3/b6-3+	MWPXDVWWQPZEOC-ZZXKWVIFSA-N	Cc1ccc(C(=O)\C=C\c2ccc3OCCOc3c2)c(O)c1	BroadT	BRD-K77526282	BRD-K77526282-001-05-5	InterBioScreen Ltd.	STOCK2S-17166			Cc1ccc(C(=O)\C=C\c2ccc3OCCOc3c2)c(O)c1	InChI=1S/C18H16O4/c1-12-2-5-14(16(20)10-12)15(19)6-3-13-4-7-17-18(11-13)22-9-8-21-17/h2-7,10-11,20H,8-9H2,1H3/b6-3+	MWPXDVWWQPZEOC-ZZXKWVIFSA-N	296.104858992							
AC1NBVYD	LSM-15275	BRD-A15623573	4474816	InChI=1S/C13H17N3O2/c17-13-9-4-7-16(8-5-9)12(13)11(15-18-13)10-3-1-2-6-14-10/h1-3,6,9,11-12,15,17H,4-5,7-8H2	KLTSQZBRJBGNKN-UHFFFAOYSA-N	OC12ONC(C1N3CCC2CC3)c4ccccn4	BroadT	BRD-A15623573	BRD-A15623573-003-05-1	Specs	AH-262/36795007		Cl	OC12ONC(C1N1CCC2CC1)c1ccccn1.Cl	InChI=1S/C13H17N3O2.ClH/c17-13-9-4-7-16(8-5-9)12(13)11(15-18-13)10-3-1-2-6-14-10;/h1-3,6,9,11-12,15,17H,4-5,7-8H2;1H	KWSVNPNYJILKOZ-UHFFFAOYSA-N	247.132076814							103922, 103922
CID_841158	LSM-18573	BRD-K49105611	40784897	InChI=1S/C17H18N2O3/c1-12-4-7-17(19-11-12)18-9-8-14(20)13-5-6-15(21-2)16(10-13)22-3/h4-7,9-11H,8H2,1-3H3	AICZWFIFPDXDHZ-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)CC=Nc2ccc(C)cn2	BroadT	BRD-K49105611	BRD-K49105611-001-05-5	Asinex Ltd.	BAS 02377527			COc1ccc(cc1OC)C(=O)CC=Nc1ccc(C)cn1	InChI=1S/C17H18N2O3/c1-12-4-7-17(19-11-12)18-9-8-14(20)13-5-6-15(21-2)16(10-13)22-3/h4-7,9-11H,8H2,1-3H3	AICZWFIFPDXDHZ-UHFFFAOYSA-N	298.131742456							107219
1-(1,3-Benzodioxol-5-ylmethyl)-3-(3-chloro-2-methylphenyl)thiourea	LSM-18574	SID22415410, BRD-K44412224	800363	InChI=1S/C16H15ClN2O2S/c1-10-12(17)3-2-4-13(10)19-16(22)18-8-11-5-6-14-15(7-11)21-9-20-14/h2-7H,8-9H2,1H3,(H2,18,19,22)	VDACVOARPDKQHL-UHFFFAOYSA-N	Cc1c(Cl)cccc1N=C(S)NCc2ccc3OCOc3c2	BroadT	BRD-K44412224	BRD-K44412224-001-05-9	ChemBridge Corporation	6920984			Cc1c(Cl)cccc1N=C(S)NCc1ccc2OCOc2c1	InChI=1S/C16H15ClN2O2S/c1-10-12(17)3-2-4-13(10)19-16(22)18-8-11-5-6-14-15(7-11)21-9-20-14/h2-7H,8-9H2,1H3,(H2,18,19,22)	VDACVOARPDKQHL-UHFFFAOYSA-N	334.05427614							107220
AG-690/09935060	LSM-18575	SID846163, BRD-K82848510	648545	InChI=1S/C14H14Cl2N2O3S/c1-2-3-6-20-12(19)8-22-14-18-17-13(21-14)10-5-4-9(15)7-11(10)16/h4-5,7H,2-3,6,8H2,1H3	UGCOQLKJLIKWCT-UHFFFAOYSA-N	CCCCOC(=O)CSc1oc(nn1)c2ccc(Cl)cc2Cl	BroadT	BRD-K82848510	BRD-K82848510-001-05-0	Asinex Ltd.	BAS 00386420			CCCCOC(=O)CSc1nnc(o1)-c1ccc(Cl)cc1Cl	InChI=1S/C14H14Cl2N2O3S/c1-2-3-6-20-12(19)8-22-14-18-17-13(21-14)10-5-4-9(15)7-11(10)16/h4-5,7H,2-3,6,8H2,1H3	UGCOQLKJLIKWCT-UHFFFAOYSA-N	360.010218438							107221
Benzothiazol-2-yl-phenethyl-amine	LSM-18576	SID14745552, BRD-K42133523	2404858	InChI=1S/C15H14N2S/c1-2-6-12(7-3-1)10-11-16-15-17-13-8-4-5-9-14(13)18-15/h1-9H,10-11H2,(H,16,17)	ZONFDQCCZSBEFC-UHFFFAOYSA-N	C(Cc1ccccc1)Nc2nc3ccccc3s2	BroadT	BRD-K42133523	BRD-K42133523-001-05-1	Enamine Ltd.	T0515-0201			C(Cc1ccccc1)Nc1nc2ccccc2s1	InChI=1S/C15H14N2S/c1-2-6-12(7-3-1)10-11-16-15-17-13-8-4-5-9-14(13)18-15/h1-9H,10-11H2,(H,16,17)	ZONFDQCCZSBEFC-UHFFFAOYSA-N	254.087769158							107222
SMR000198296	LSM-18577	SID17504831, BRD-K20323744	890028	InChI=1S/C21H17NO4/c1-26-19-10-8-14(9-11-19)15-4-2-5-16(12-15)20(23)22-18-7-3-6-17(13-18)21(24)25/h2-13H,1H3,(H,22,23)(H,24,25)	ROHSXYKNRZDETL-UHFFFAOYSA-N	COc1ccc(cc1)c2cccc(c2)C(=O)Nc3cccc(c3)C(=O)O	BroadT	BRD-K20323744	BRD-K20323744-001-05-7	ChemBridge Corporation	7410279			COc1ccc(cc1)-c1cccc(c1)C(=O)Nc1cccc(c1)C(O)=O	InChI=1S/C21H17NO4/c1-26-19-10-8-14(9-11-19)15-4-2-5-16(12-15)20(23)22-18-7-3-6-17(13-18)21(24)25/h2-13H,1H3,(H,22,23)(H,24,25)	ROHSXYKNRZDETL-UHFFFAOYSA-N	347.115758034							107223
2-(2-Amino-1,3-thiazol-4-yl)cyclohexane-1,3-dione	LSM-15276	BRD-K34681982	663363	InChI=1S/C9H10N2O2S/c10-9-11-5(4-14-9)8-6(12)2-1-3-7(8)13/h4,8H,1-3H2,(H2,10,11)	AOVFNFDBPZZQBX-UHFFFAOYSA-N	Nc1nc(cs1)C2C(=O)CCCC2=O	BroadT	BRD-K34681982	BRD-K34681982-003-05-9	InterBioScreen Ltd.	STOCK4S-33548		Cl	Nc1nc(cs1)C1C(=O)CCCC1=O.Cl	InChI=1S/C9H10N2O2S.ClH/c10-9-11-5(4-14-9)8-6(12)2-1-3-7(8)13;/h4,8H,1-3H2,(H2,10,11);1H	WRSMNDWWCPVLKS-UHFFFAOYSA-N	210.04629827							103923, 103923
AC1OBBOR	LSM-18578	BRD-K71139800	6843880	InChI=1S/C17H14Cl2N2O3/c1-2-13(20-9-10-5-6-11(18)12(19)8-10)15-17(22)24-16(21-15)14-4-3-7-23-14/h3-8,22H,2,9H2,1H3	APLGJQHPGDVEFW-UHFFFAOYSA-N	CCC(=NCc1ccc(Cl)c(Cl)c1)c2nc(oc2O)c3occc3	BroadT	BRD-K71139800	BRD-K71139800-001-06-4	Specs	AJ-030/12105165			CCC(=NCc1ccc(Cl)c(Cl)c1)c1nc(oc1O)-c1ccco1	InChI=1S/C17H14Cl2N2O3/c1-2-13(20-9-10-5-6-11(18)12(19)8-10)15-17(22)24-16(21-15)14-4-3-7-23-14/h3-8,22H,2,9H2,1H3	APLGJQHPGDVEFW-UHFFFAOYSA-N	364.038147748							
MLS000775165	LSM-18579	SID24836188, BRD-K61198461	4216546	InChI=1S/C22H22N2O5S/c1-15-9-10-16(13-21(15)30(27,28)24-11-5-2-6-12-24)23-22(26)20-14-18(25)17-7-3-4-8-19(17)29-20/h3-4,7-10,13-14H,2,5-6,11-12H2,1H3,(H,23,26)	OIMUUHHRZXPRCD-UHFFFAOYSA-N	Cc1ccc(NC(=O)C2=CC(=O)c3ccccc3O2)cc1S(=O)(=O)N4CCCCC4	BroadT	BRD-K61198461	BRD-K61198461-001-05-4	Enamine Ltd.	T0506-7582			Cc1ccc(NC(=O)c2cc(=O)c3ccccc3o2)cc1S(=O)(=O)N1CCCCC1	InChI=1S/C22H22N2O5S/c1-15-9-10-16(13-21(15)30(27,28)24-11-5-2-6-12-24)23-22(26)20-14-18(25)17-7-3-4-8-19(17)29-20/h3-4,7-10,13-14H,2,5-6,11-12H2,1H3,(H,23,26)	OIMUUHHRZXPRCD-UHFFFAOYSA-N	426.124942514							107225
MLS000040669	LSM-42911	BRD-K11667893, SID862638, SID87544811, SID89650216	5389756	InChI=1S/C19H22ClN5O2/c1-13(20)10-12-25-15-16(23(2)19(27)24(3)17(15)26)22-18(25)21-11-9-14-7-5-4-6-8-14/h4-8,10H,9,11-12H2,1-3H3,(H,21,22)/b13-10+	KWMZBBBMSTVLLF-JLHYYAGUSA-N	CN1C(=O)N(C)c2nc(NCCc3ccccc3)n(C\C=C(/C)\Cl)c2C1=O	BroadT	BRD-K11667893	BRD-K11667893-001-05-7	InterBioScreen Ltd.	STOCK4S-51309			C\C(Cl)=C/Cn1c(NCCc2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C19H22ClN5O2/c1-13(20)10-12-25-15-16(23(2)19(27)24(3)17(15)26)22-18(25)21-11-9-14-7-5-4-6-8-14/h4-8,10H,9,11-12H2,1-3H3,(H,21,22)/b13-10+	KWMZBBBMSTVLLF-JLHYYAGUSA-N	387.146202704							
ZINC00109371	LSM-18580	SID3711456, BRD-K06728383	714396	InChI=1S/C18H15N3O4/c22-17(20-12-5-6-15-16(9-12)25-8-7-24-15)10-21-11-19-14-4-2-1-3-13(14)18(21)23/h1-6,9,11H,7-8,10H2,(H,20,22)	SQGFIEJZIAMDTB-UHFFFAOYSA-N	O=C(CN1C=Nc2ccccc2C1=O)Nc3ccc4OCCOc4c3	BroadT	BRD-K06728383	BRD-K06728383-001-06-9	Enamine Ltd.	T5318470			O=C(Cn1cnc2ccccc2c1=O)Nc1ccc2OCCOc2c1	InChI=1S/C18H15N3O4/c22-17(20-12-5-6-15-16(9-12)25-8-7-24-15)10-21-11-19-14-4-2-1-3-13(14)18(21)23/h1-6,9,11H,7-8,10H2,(H,20,22)	SQGFIEJZIAMDTB-UHFFFAOYSA-N	337.10625599							107226
BAS 06334526	LSM-18581	SID844622, BRD-K80943789	646955	InChI=1S/C14H14N2O4S/c1-20-14(17)11-16(13-9-5-6-10-15-13)21(18,19)12-7-3-2-4-8-12/h2-10H,11H2,1H3	IEWOQJFBYRQOFL-UHFFFAOYSA-N	COC(=O)CN(c1ccccn1)S(=O)(=O)c2ccccc2	BroadT	BRD-K80943789	BRD-K80943789-001-05-5	Asinex Ltd.	BAS 06334526			COC(=O)CN(c1ccccn1)S(=O)(=O)c1ccccc1	InChI=1S/C14H14N2O4S/c1-20-14(17)11-16(13-9-5-6-10-15-13)21(18,19)12-7-3-2-4-8-12/h2-10H,11H2,1H3	IEWOQJFBYRQOFL-UHFFFAOYSA-N	306.067427638							107227
SMR000068125	LSM-18582	SID3713486, BRD-K13892375	2535257	InChI=1S/C15H13BrN2O3S2/c1-3-20-14(19)13-11(7-22-15-18-17-8(2)23-15)10-6-9(16)4-5-12(10)21-13/h4-6H,3,7H2,1-2H3	QOFUSEJVOGYLJR-UHFFFAOYSA-N	CCOC(=O)c1oc2ccc(Br)cc2c1CSc3nnc(C)s3	BroadT	BRD-K13892375	BRD-K13892375-001-05-6	Enamine Ltd.	T5336983			CCOC(=O)c1oc2ccc(Br)cc2c1CSc1nnc(C)s1	InChI=1S/C15H13BrN2O3S2/c1-3-20-14(19)13-11(7-22-15-18-17-8(2)23-15)10-6-9(16)4-5-12(10)21-13/h4-6H,3,7H2,1-2H3	QOFUSEJVOGYLJR-UHFFFAOYSA-N	411.955096276							107228
STK134514	LSM-18583	SID24806342, BRD-K91999431	697807	InChI=1S/C14H11N3S/c1-2-5-11(6-3-1)13-10-18-14(17-13)16-12-7-4-8-15-9-12/h1-10H,(H,16,17)	HNBKFOKGRVAMQI-UHFFFAOYSA-N	N(c1cccnc1)c2nc(cs2)c3ccccc3	BroadT	BRD-K91999431	BRD-K91999431-001-05-6	Asinex Ltd.	BAS 08769340			N(c1nc(cs1)-c1ccccc1)c1cccnc1	InChI=1S/C14H11N3S/c1-2-5-11(6-3-1)13-10-18-14(17-13)16-12-7-4-8-15-9-12/h1-10H,(H,16,17)	HNBKFOKGRVAMQI-UHFFFAOYSA-N	253.067368072							107229
BAS 06984457	LSM-18584	SID850918, BRD-K39903135	653464	InChI=1S/C11H17N3OS/c1-8-7-9(2)13-11(12-8)16-6-5-10(15)14(3)4/h7H,5-6H2,1-4H3	QOHMBVSRFLFYJG-UHFFFAOYSA-N	CN(C)C(=O)CCSc1nc(C)cc(C)n1	BroadT	BRD-K39903135	BRD-K39903135-001-05-2	Asinex Ltd.	BAS 06984457			CN(C)C(=O)CCSc1nc(C)cc(C)n1	InChI=1S/C11H17N3OS/c1-8-7-9(2)13-11(12-8)16-6-5-10(15)14(3)4/h7H,5-6H2,1-4H3	QOHMBVSRFLFYJG-UHFFFAOYSA-N	239.109232884							107230
ZINC03350596	LSM-18585	SID22403327, BRD-K56805700	2467593	InChI=1S/C20H24N2O3/c1-14-6-4-8-17(12-14)25-11-10-19(23)21-13-20(24)22-18-9-5-7-15(2)16(18)3/h4-9,12H,10-11,13H2,1-3H3,(H,21,23)(H,22,24)	VCGOOIJTDSWFGV-UHFFFAOYSA-N	Cc1cccc(OCCC(=O)NCC(=O)Nc2cccc(C)c2C)c1	BroadT	BRD-K56805700	BRD-K56805700-001-05-2	Enamine Ltd.	T5324465			Cc1cccc(OCCC(=O)NCC(=O)Nc2cccc(C)c2C)c1	InChI=1S/C20H24N2O3/c1-14-6-4-8-17(12-14)25-11-10-19(23)21-13-20(24)22-18-9-5-7-15(2)16(18)3/h4-9,12H,10-11,13H2,1-3H3,(H,21,23)(H,22,24)	VCGOOIJTDSWFGV-UHFFFAOYSA-N	340.178692648							107231
4-[(Chloroacetyl)amino]-3,5-dimethylphenyl thiocyanate	LSM-18586	SID22409525, BRD-K70427147	2405293	InChI=1S/C11H11ClN2OS/c1-7-3-9(16-6-13)4-8(2)11(7)14-10(15)5-12/h3-4H,5H2,1-2H3,(H,14,15)	OCBBHLKACGBRNA-UHFFFAOYSA-N	Cc1cc(SC#N)cc(C)c1NC(=O)CCl	BroadT	BRD-K70427147	BRD-K70427147-001-06-6	Enamine Ltd.	T0520-2919			Cc1cc(SC#N)cc(C)c1NC(=O)CCl	InChI=1S/C11H11ClN2OS/c1-7-3-9(16-6-13)4-8(2)11(7)14-10(15)5-12/h3-4H,5H2,1-2H3,(H,14,15)	OCBBHLKACGBRNA-UHFFFAOYSA-N	254.028061392							107232
Ethyl 2-{[(4-bromo-1-ethyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5-dimethylthiophene-3-carboxylate	LSM-18587	SID4255182, BRD-K15006508	2056595	InChI=1S/C15H18BrN3O3S/c1-5-19-7-10(16)12(18-19)13(20)17-14-11(15(21)22-6-2)8(3)9(4)23-14/h7H,5-6H2,1-4H3,(H,17,20)	VYDWDSBKBDEKNA-UHFFFAOYSA-N	CCOC(=O)c1c(C)c(C)sc1NC(=O)c2nn(CC)cc2Br	BroadT	BRD-K15006508	BRD-K15006508-001-05-1	ChemBridge Corporation	7541315			CCOC(=O)c1c(NC(=O)c2nn(CC)cc2Br)sc(C)c1C	InChI=1S/C15H18BrN3O3S/c1-5-19-7-10(16)12(18-19)13(20)17-14-11(15(21)22-6-2)8(3)9(4)23-14/h7H,5-6H2,1-4H3,(H,17,20)	VYDWDSBKBDEKNA-UHFFFAOYSA-N	399.025224756							107233
ZINC01008254	LSM-43779	SID17407081, BRD-K05539455	1796714	InChI=1S/C20H21N3O3S/c1-12-5-7-16(8-6-12)21-18(24)11-23-19(25)17(27-20(23)26)10-15-9-13(2)22(4)14(15)3/h5-10H,11H2,1-4H3,(H,21,24)/b17-10-	HEHDBERODSXMTE-YVLHZVERSA-N	Cc1ccc(NC(=O)CN2C(=O)S\C(=C/c3cc(C)n(C)c3C)\C2=O)cc1	BroadT	BRD-K05539455	BRD-K05539455-001-05-6	Specs	AN-698/40781803			Cc1cc(\C=C2/SC(=O)N(CC(=O)Nc3ccc(C)cc3)C2=O)c(C)n1C	InChI=1S/C20H21N3O3S/c1-12-5-7-16(8-6-12)21-18(24)11-23-19(25)17(27-20(23)26)10-15-9-13(2)22(4)14(15)3/h5-10H,11H2,1-4H3,(H,21,24)/b17-10-	HEHDBERODSXMTE-YVLHZVERSA-N	383.130362252							
AC1M8VGR	LSM-18589	SID24826302, BRD-K64319851	2545977	InChI=1S/C20H23N3O2S/c1-2-23(14-19(24)22-13-16-6-5-11-26-16)20(25)10-9-15-12-21-18-8-4-3-7-17(15)18/h3-8,11-12,21H,2,9-10,13-14H2,1H3,(H,22,24)	MOIWLMPQAQDYKT-UHFFFAOYSA-N	CCN(CC(=O)NCc1cccs1)C(=O)CCc2c[nH]c3ccccc23	BroadT	BRD-K64319851	BRD-K64319851-001-05-1	Enamine Ltd.	T5339407			CCN(CC(=O)NCc1cccs1)C(=O)CCc1c[nH]c2ccccc12	InChI=1S/C20H23N3O2S/c1-2-23(14-19(24)22-13-16-6-5-11-26-16)20(25)10-9-15-12-21-18-8-4-3-7-17(15)18/h3-8,11-12,21H,2,9-10,13-14H2,1H3,(H,22,24)	MOIWLMPQAQDYKT-UHFFFAOYSA-N	369.151097696							107235
SMR000094045	LSM-18590	SID7967138, BRD-K08562725	3361119	InChI=1S/C16H15BrN2O2S/c1-11-3-2-4-12(9-11)10-22-16-18-7-8-19(16)15(20)13-5-6-14(17)21-13/h2-6,9H,7-8,10H2,1H3	FWGXAIFIZCHPCH-UHFFFAOYSA-N	Cc1cccc(CSC2=NCCN2C(=O)c3oc(Br)cc3)c1	BroadT	BRD-K08562725	BRD-K08562725-001-04-2	ChemDiv Inc.	C441-0628			Cc1cccc(CSC2=NCCN2C(=O)c2ccc(Br)o2)c1	InChI=1S/C16H15BrN2O2S/c1-11-3-2-4-12(9-11)10-22-16-18-7-8-19(16)15(20)13-5-6-14(17)21-13/h2-6,9H,7-8,10H2,1H3	FWGXAIFIZCHPCH-UHFFFAOYSA-N	378.00376103							107236
SMR000162537	LSM-18591	BRD-A27391717	3575535	InChI=1S/C18H16BrN3O3/c1-12-17(18(23)22(20-12)15-5-3-2-4-6-15)16(11-21(24)25)13-7-9-14(19)10-8-13/h2-10,16,23H,11H2,1H3	GWFLEMYOXYJMJN-UHFFFAOYSA-N	Cc1nn(c(O)c1C(C[N+](=O)[O-])c2ccc(Br)cc2)c3ccccc3	BroadT	BRD-A27391717	BRD-A27391717-001-09-4	Specs	AP-906/41650367			Cc1nn(c(O)c1C(C[N+]([O-])=O)c1ccc(Br)cc1)-c1ccccc1	InChI=1S/C18H16BrN3O3/c1-12-17(18(23)22(20-12)15-5-3-2-4-6-15)16(11-21(24)25)13-7-9-14(19)10-8-13/h2-10,16,23H,11H2,1H3	GWFLEMYOXYJMJN-UHFFFAOYSA-N	401.037504002							
ZINC00482395	LSM-18592	SID24834645, BRD-K32230012	902717	InChI=1S/C17H14ClNO4/c1-11(20)19-13-6-4-5-12(9-13)17(22)23-10-16(21)14-7-2-3-8-15(14)18/h2-9H,10H2,1H3,(H,19,20)	BXBOJSOQMGHPHX-UHFFFAOYSA-N	CC(=O)Nc1cccc(c1)C(=O)OCC(=O)c2ccccc2Cl	BroadT	BRD-K32230012	BRD-K32230012-001-05-5	Enamine Ltd.	T0520-8392			CC(=O)Nc1cccc(c1)C(=O)OCC(=O)c1ccccc1Cl	InChI=1S/C17H14ClNO4/c1-11(20)19-13-6-4-5-12(9-13)17(22)23-10-16(21)14-7-2-3-8-15(14)18/h2-9H,10H2,1H3,(H,19,20)	BXBOJSOQMGHPHX-UHFFFAOYSA-N	331.061135648							107238
ASN 04195250	LSM-18593	SID26667585, SID852687, BRD-K62353197	655322	InChI=1S/C22H18N4O4S3/c1-30-16-7-8-18-14(11-16)10-15(22(27)23-18)12-26(13-17-4-3-9-31-17)33(28,29)20-6-2-5-19-21(20)25-32-24-19/h2-11H,12-13H2,1H3,(H,23,27)	GWKZTMUOMUDUKB-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(Cc3cccs3)S(=O)(=O)c4cccc5nsnc45)cc2c1	BroadT	BRD-K62353197	BRD-K62353197-001-06-3	Asinex Ltd.	ASN 04195250			COc1ccc2nc(O)c(CN(Cc3cccs3)S(=O)(=O)c3cccc4nsnc34)cc2c1	InChI=1S/C22H18N4O4S3/c1-30-16-7-8-18-14(11-16)10-15(22(27)23-18)12-26(13-17-4-3-9-31-17)33(28,29)20-6-2-5-19-21(20)25-32-24-19/h2-11H,12-13H2,1H3,(H,23,27)	GWKZTMUOMUDUKB-UHFFFAOYSA-N	498.049017166							107239
SMR000173622	LSM-18594	SID17408277, BRD-K21882709	1432817	InChI=1S/C22H18N4S/c1-14-9-19-20(10-15(14)2)26-22(25-19)17-7-8-21(24-12-17)27-13-18-6-4-3-5-16(18)11-23/h3-10,12H,13H2,1-2H3,(H,25,26)	GJBUWOBBKMDOGW-UHFFFAOYSA-N	Cc1cc2nc([nH]c2cc1C)c3ccc(SCc4ccccc4C#N)nc3	BroadT	BRD-K21882709	BRD-K21882709-001-05-4	Asinex Ltd.	ASN 07185729			Cc1cc2nc([nH]c2cc1C)-c1ccc(SCc2ccccc2C#N)nc1	InChI=1S/C22H18N4S/c1-14-9-19-20(10-15(14)2)26-22(25-19)17-7-8-21(24-12-17)27-13-18-6-4-3-5-16(18)11-23/h3-10,12H,13H2,1-2H3,(H,25,26)	GJBUWOBBKMDOGW-UHFFFAOYSA-N	370.125217306							107240
STK123395	LSM-18595	SID4258199, BRD-K78222036	891602	InChI=1S/C15H12FNO3/c1-9-2-4-11(16)7-12(9)17-15(18)10-3-5-13-14(6-10)20-8-19-13/h2-7H,8H2,1H3,(H,17,18)	YPHZJQMDKAWHGU-UHFFFAOYSA-N	Cc1ccc(F)cc1NC(=O)c2ccc3OCOc3c2	BroadT	BRD-K78222036	BRD-K78222036-001-06-7	ChemBridge Corporation	7489243			Cc1ccc(F)cc1NC(=O)c1ccc2OCOc2c1	InChI=1S/C15H12FNO3/c1-9-2-4-11(16)7-12(9)17-15(18)10-3-5-13-14(6-10)20-8-19-13/h2-7H,8H2,1H3,(H,17,18)	YPHZJQMDKAWHGU-UHFFFAOYSA-N	273.080121454							107241
ST50269096	LSM-43780	SID24818996, BRD-K60281757	2163933	InChI=1S/C14H15NO5/c1-2-18-14(17)8-15-13(16)6-4-10-3-5-11-12(7-10)20-9-19-11/h3-7H,2,8-9H2,1H3,(H,15,16)/b6-4+	WYFWERIPJKVISX-GQCTYLIASA-N	CCOC(=O)CNC(=O)\C=C\c1ccc2OCOc2c1	BroadT	BRD-K60281757	BRD-K60281757-001-05-2	Asinex Ltd.	BAS 03031498			CCOC(=O)CNC(=O)\C=C\c1ccc2OCOc2c1	InChI=1S/C14H15NO5/c1-2-18-14(17)8-15-13(16)6-4-10-3-5-11-12(7-10)20-9-19-11/h3-7H,2,8-9H2,1H3,(H,15,16)/b6-4+	WYFWERIPJKVISX-GQCTYLIASA-N	277.09502259							
AC1NQ7LQ	LSM-18597	SID26665492, BRD-A57056524	5170995	InChI=1S/C19H22N4O2S/c1-25-18(24)14-7-9-16(10-8-14)21-19(26)22-23-12-3-2-6-17(23)15-5-4-11-20-13-15/h4-5,7-11,13,17H,2-3,6,12H2,1H3,(H2,21,22,26)	JYHJDKYRRNJQCO-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=NN2CCCCC2c3cccnc3)S)cc1	BroadT	BRD-A57056524	BRD-A57056524-001-05-7	InterBioScreen Ltd.	STOCK5S-36240			COC(=O)c1ccc(NC(S)=NN2CCCCC2c2cccnc2)cc1	InChI=1S/C19H22N4O2S/c1-25-18(24)14-7-9-16(10-8-14)21-19(26)22-23-12-3-2-6-17(23)15-5-4-11-20-13-15/h4-5,7-11,13,17H,2-3,6,12H2,1H3,(H2,21,22,26)	JYHJDKYRRNJQCO-UHFFFAOYSA-N	370.146346674							107243
F1420-0361	LSM-18598	DNDI1417701, BRD-K90057874	2954087	InChI=1S/C14H13N3O3S3/c1-17(2)23(19,20)9-5-6-10-12(8-9)22-14(15-10)16-13(18)11-4-3-7-21-11/h3-8H,1-2H3,(H,15,16,18)	GBTHDCJMNYIKOS-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc2nc(NC(=O)c3cccs3)sc2c1	BroadT	BRD-K90057874	BRD-K90057874-001-06-6	ChemBridge Corporation	7783448			CN(C)S(=O)(=O)c1ccc2nc(NC(=O)c3cccs3)sc2c1	InChI=1S/C14H13N3O3S3/c1-17(2)23(19,20)9-5-6-10-12(8-9)22-14(15-10)16-13(18)11-4-3-7-21-11/h3-8H,1-2H3,(H,15,16,18)	GBTHDCJMNYIKOS-UHFFFAOYSA-N	367.011903376							107244
1-Pyrrolidineacetamide, n-(4-nitrophenyl)-	LSM-18599	SID24794211, BRD-K77033609	2959226	InChI=1S/C12H15N3O3/c16-12(9-14-7-1-2-8-14)13-10-3-5-11(6-4-10)15(17)18/h3-6H,1-2,7-9H2,(H,13,16)	GSTWJGHEEBKDPK-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NC(=O)CN2CCCC2)cc1	BroadT	BRD-K77033609	BRD-K77033609-001-05-8	ChemBridge Corporation	7854297			[O-][N+](=O)c1ccc(NC(=O)CN2CCCC2)cc1	InChI=1S/C12H15N3O3/c16-12(9-14-7-1-2-8-14)13-10-3-5-11(6-4-10)15(17)18/h3-6H,1-2,7-9H2,(H,13,16)	GSTWJGHEEBKDPK-UHFFFAOYSA-N	249.11134137							107245
9J-310S	LSM-18600	SID24820025, BRD-K62693371	1488393	InChI=1S/C19H20FNO5S/c1-12-9-14(10-13(2)18(12)26-19(23)21(3)4)17(22)11-27(24,25)16-7-5-15(20)6-8-16/h5-10H,11H2,1-4H3	SQELVLVGSZGXAX-UHFFFAOYSA-N	CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CS(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K62693371	BRD-K62693371-001-05-2	Key Organics Ltd.	9J-310S			CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H20FNO5S/c1-12-9-14(10-13(2)18(12)26-19(23)21(3)4)17(22)11-27(24,25)16-7-5-15(20)6-8-16/h5-10H,11H2,1-4H3	SQELVLVGSZGXAX-UHFFFAOYSA-N	393.10462164							107246
ST010051	LSM-18601	SID17508969, BRD-K47370953	690937	InChI=1S/C14H12N2O2S/c17-13-11-8-4-1-2-6-10(8)19-14(11)16-12(15-13)9-5-3-7-18-9/h3,5,7H,1-2,4,6H2,(H,15,16,17)	JCOZCJBKRYCGGJ-UHFFFAOYSA-N	Oc1nc(nc2sc3CCCCc3c12)c4occc4	BroadT	BRD-K47370953	BRD-K47370953-001-05-3	Asinex Ltd.	BAS 02869244			Oc1nc(nc2sc3CCCCc3c12)-c1ccco1	InChI=1S/C14H12N2O2S/c17-13-11-8-4-1-2-6-10(8)19-14(11)16-12(15-13)9-5-3-7-18-9/h3,5,7H,1-2,4,6H2,(H,15,16,17)	JCOZCJBKRYCGGJ-UHFFFAOYSA-N	272.061948334							107247
AC1LDEHA	LSM-15277	BRD-A57879426	646805	InChI=1S/C25H25FN6O3/c26-21-6-2-1-5-20(21)24(31-11-9-30(10-12-31)16-19-4-3-13-33-19)25-27-28-29-32(25)15-18-7-8-22-23(14-18)35-17-34-22/h1-8,13-14,24H,9-12,15-17H2	RHPYTLPXMYNISV-UHFFFAOYSA-N	Fc1ccccc1C(N2CCN(Cc3occc3)CC2)c4nnnn4Cc5ccc6OCOc6c5	BroadT	BRD-A57879426	BRD-A57879426-003-05-7	Asinex Ltd.	ASN 05558501		Cl	Fc1ccccc1C(N1CCN(Cc2ccco2)CC1)c1nnnn1Cc1ccc2OCOc2c1.Cl	InChI=1S/C25H25FN6O3.ClH/c26-21-6-2-1-5-20(21)24(31-11-9-30(10-12-31)16-19-4-3-13-33-19)25-27-28-29-32(25)15-18-7-8-22-23(14-18)35-17-34-22;/h1-8,13-14,24H,9-12,15-17H2;1H	RZVPPLXNLQGQGS-UHFFFAOYSA-N	476.19721692							103924, 103924
AG-690/11240025	LSM-18602	SID7964932, BRD-K99791875	2258798	InChI=1S/C17H18N4O2S/c1-13-7-9-14(10-8-13)21-17(18-19-20-21)24-12-11-23-16-6-4-3-5-15(16)22-2/h3-10H,11-12H2,1-2H3	RGMWPPZGWQMORH-UHFFFAOYSA-N	COc1ccccc1OCCSc2nnnn2c3ccc(C)cc3	BroadT	BRD-K99791875	BRD-K99791875-001-04-5	ChemDiv Inc.	1537-0006			COc1ccccc1OCCSc1nnnn1-c1ccc(C)cc1	InChI=1S/C17H18N4O2S/c1-13-7-9-14(10-8-13)21-17(18-19-20-21)24-12-11-23-16-6-4-3-5-15(16)22-2/h3-10H,11-12H2,1-2H3	RGMWPPZGWQMORH-UHFFFAOYSA-N	342.115046546							107248
ASN 06217352	LSM-18603	SID852186, BRD-K27410480	654799	InChI=1S/C18H15N3O4/c22-17-12-6-15-16(25-5-4-24-15)7-14(12)20-10-13(17)18(23)21-9-11-2-1-3-19-8-11/h1-3,6-8,10H,4-5,9H2,(H,20,22)(H,21,23)	BMCGIWXTTHMTSP-UHFFFAOYSA-N	Oc1c(cnc2cc3OCCOc3cc12)C(=O)NCc4cccnc4	BroadT	BRD-K27410480	BRD-K27410480-001-05-3	Asinex Ltd.	ASN 06217352			Oc1c(cnc2cc3OCCOc3cc12)C(=O)NCc1cccnc1	InChI=1S/C18H15N3O4/c22-17-12-6-15-16(25-5-4-24-15)7-14(12)20-10-13(17)18(23)21-9-11-2-1-3-19-8-11/h1-3,6-8,10H,4-5,9H2,(H,20,22)(H,21,23)	BMCGIWXTTHMTSP-UHFFFAOYSA-N	337.10625599							107249
STK026930	LSM-18604	SID49816655, BRD-K73337972	2293921	InChI=1S/C16H17N3O5S2/c17-25(21,22)14-7-5-13(6-8-14)19-26(23,24)15-9-3-12(4-10-15)18-16(20)11-1-2-11/h3-11,19H,1-2H2,(H,18,20)(H2,17,21,22)	DXJUOOVEFBLCTM-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C3CC3)cc2)cc1	BroadT	BRD-K73337972	BRD-K73337972-001-05-6	ChemBridge Corporation	6948906			NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C3CC3)cc2)cc1	InChI=1S/C16H17N3O5S2/c17-25(21,22)14-7-5-13(6-8-14)19-26(23,24)15-9-3-12(4-10-15)18-16(20)11-1-2-11/h3-11,19H,1-2H2,(H,18,20)(H2,17,21,22)	DXJUOOVEFBLCTM-UHFFFAOYSA-N	395.060962054							107250
ST50592224	LSM-18605	SID850505, BRD-K22995054	653036	InChI=1S/C19H22N2O5S/c1-2-26-18-6-4-3-5-17(18)19(22)20-15-7-9-16(10-8-15)27(23,24)21-11-13-25-14-12-21/h3-10H,2,11-14H2,1H3,(H,20,22)	NCEJFCLKSROESK-UHFFFAOYSA-N	CCOc1ccccc1C(=O)Nc2ccc(cc2)S(=O)(=O)N3CCOCC3	BroadT	BRD-K22995054	BRD-K22995054-001-05-4	Asinex Ltd.	BAS 03587867			CCOc1ccccc1C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCOCC1	InChI=1S/C19H22N2O5S/c1-2-26-18-6-4-3-5-17(18)19(22)20-15-7-9-16(10-8-15)27(23,24)21-11-13-25-14-12-21/h3-10H,2,11-14H2,1H3,(H,20,22)	NCEJFCLKSROESK-UHFFFAOYSA-N	390.124942514							107251
MLS000077710	LSM-18606	SID860438, SID50102734, BRD-K56493309	661730	InChI=1S/C18H14N4O/c1-23-15-9-7-13(8-10-15)16-11-17(14-5-3-2-4-6-14)22-18(21-16)19-12-20-22/h2-12H,1H3	LORDMKGLLKRCJP-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(c3ccccc3)n4ncnc4n2	BroadT	BRD-K56493309	BRD-K56493309-001-05-2	InterBioScreen Ltd.	STOCK3S-76396			COc1ccc(cc1)-c1cc(-c2ccccc2)n2ncnc2n1	InChI=1S/C18H14N4O/c1-23-15-9-7-13(8-10-15)16-11-17(14-5-3-2-4-6-14)22-18(21-16)19-12-20-22/h2-12H,1H3	LORDMKGLLKRCJP-UHFFFAOYSA-N	302.116761108							107252
384377-41-7	LSM-18607	SID7968082, BRD-K06262795	2901315	InChI=1S/C18H21N3O/c1-2-3-12-21-16-10-6-5-9-15(16)20-18(21)19-13-14-8-4-7-11-17(14)22/h4-11,22H,2-3,12-13H2,1H3,(H,19,20)	SERVSPLCWYKOOP-UHFFFAOYSA-N	CCCCn1c(NCc2ccccc2O)nc3ccccc13	BroadT	BRD-K06262795	BRD-K06262795-001-05-3	ChemDiv Inc.	3988-0435			CCCCn1c(NCc2ccccc2O)nc2ccccc12	InChI=1S/C18H21N3O/c1-2-3-12-21-16-10-6-5-9-15(16)20-18(21)19-13-14-8-4-7-11-17(14)22/h4-11,22H,2-3,12-13H2,1H3,(H,19,20)	SERVSPLCWYKOOP-UHFFFAOYSA-N	295.168462322							107253
MLS000583136	LSM-18608	SID17510575, BRD-A99278039	12005267	InChI=1S/C23H20FN3O3S/c1-13-2-8-16(9-3-13)27-20(28)18-17-10-11-23(30-17,19(18)21(27)29)12-25-22(31)26-15-6-4-14(24)5-7-15/h2-11,17-19H,12H2,1H3,(H2,25,26,31)	ACFCHHALVAZPES-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=O)C3C4OC(CN=C(S)Nc5ccc(F)cc5)(C=C4)C3C2=O	BroadT	BRD-A99278039	BRD-A99278039-001-06-3	ChemDiv Inc.	C344-0017			Cc1ccc(cc1)N1C(=O)C2C3OC(CN=C(S)Nc4ccc(F)cc4)(C=C3)C2C1=O	InChI=1S/C23H20FN3O3S/c1-13-2-8-16(9-3-13)27-20(28)18-17-10-11-23(30-17,19(18)21(27)29)12-25-22(31)26-15-6-4-14(24)5-7-15/h2-11,17-19H,12H2,1H3,(H2,25,26,31)	ACFCHHALVAZPES-UHFFFAOYSA-N	437.12094042							107254
2-[2-Oxo-2-(2,2,4,6-tetramethyl-2H-quinolin-1-yl)-ethyl]-isoindole-1,3-dione	LSM-18609	SID14724820, BRD-K17676574	1118065	InChI=1S/C23H22N2O3/c1-14-9-10-19-18(11-14)15(2)12-23(3,4)25(19)20(26)13-24-21(27)16-7-5-6-8-17(16)22(24)28/h5-12H,13H2,1-4H3	VOVIPIOGQBXGFC-UHFFFAOYSA-N	CC1=CC(C)(C)N(C(=O)CN2C(=O)c3ccccc3C2=O)c4ccc(C)cc14	BroadT	BRD-K17676574	BRD-K17676574-001-05-8	Asinex Ltd.	BAS 00619878			Cc1ccc2N(C(=O)CN3C(=O)c4ccccc4C3=O)C(C)(C)C=C(C)c2c1	InChI=1S/C23H22N2O3/c1-14-9-10-19-18(11-14)15(2)12-23(3,4)25(19)20(26)13-24-21(27)16-7-5-6-8-17(16)22(24)28/h5-12H,13H2,1-4H3	VOVIPIOGQBXGFC-UHFFFAOYSA-N	374.163042584							107255
BAS 01922131	LSM-43781	SID24803281, BRD-K76527769	5765377	InChI=1S/C15H16N4OS2/c16-4-2-5-18-6-8-19(9-7-18)15-17-14(20)13(22-15)11-12-3-1-10-21-12/h1,3,10-11H,2,5-9H2/b13-11+	KOPHRAJFSWLCSC-ACCUITESSA-N	O=C1N=C(S/C/1=C/c2cccs2)N3CCN(CCC#N)CC3	BroadT	BRD-K76527769	BRD-K76527769-001-05-6	Asinex Ltd.	BAS 01922131			O=C1N=C(S\C1=C\c1cccs1)N1CCN(CCC#N)CC1	InChI=1S/C15H16N4OS2/c16-4-2-5-18-6-8-19(9-7-18)15-17-14(20)13(22-15)11-12-3-1-10-21-12/h1,3,10-11H,2,5-9H2/b13-11+	KOPHRAJFSWLCSC-ACCUITESSA-N	332.076552552							
AC1LIESH	LSM-18611	BRD-K64994910	902933	InChI=1S/C14H13N3O/c1-11-6-2-3-8-13(11)14(18)17-16-10-12-7-4-5-9-15-12/h2-10H,1H3,(H,17,18)	ZDZRPVSRIOPDPC-UHFFFAOYSA-N	Cc1ccccc1C(=O)NN=Cc2ccccn2	BroadT	BRD-K64994910	BRD-K64994910-001-05-0	Specs	AK-968/11367536			Cc1ccccc1C(=O)NN=Cc1ccccn1	InChI=1S/C14H13N3O/c1-11-6-2-3-8-13(11)14(18)17-16-10-12-7-4-5-9-15-12/h2-10H,1H3,(H,17,18)	ZDZRPVSRIOPDPC-UHFFFAOYSA-N	239.105862066							107257
T5224047	LSM-18612	SID49680922, BRD-K06383818	4520711	InChI=1S/C17H20ClN3O3S/c1-21(2)25(23,24)16-10-14(8-9-15(16)18)20-17(22)12-19-11-13-6-4-3-5-7-13/h3-10,19H,11-12H2,1-2H3,(H,20,22)	YHNZPHABBWZYQH-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cc(NC(=O)CNCc2ccccc2)ccc1Cl	BroadT	BRD-K06383818	BRD-K06383818-001-05-0	Enamine Ltd.	T5224047			CN(C)S(=O)(=O)c1cc(NC(=O)CNCc2ccccc2)ccc1Cl	InChI=1S/C17H20ClN3O3S/c1-21(2)25(23,24)16-10-14(8-9-15(16)18)20-17(22)12-19-11-13-6-4-3-5-7-13/h3-10,19H,11-12H2,1-2H3,(H,20,22)	YHNZPHABBWZYQH-UHFFFAOYSA-N	381.09138993							107258
MLS000769748	LSM-43782	SID26725933, BRD-K28548873	1991174	InChI=1S/C15H12FN5O2S/c16-11-4-1-10(2-5-11)3-6-13(22)19-15(24)21-20-14(23)12-9-17-7-8-18-12/h1-9H,(H,20,23)(H2,19,21,22,24)/b6-3+	JBZJSTRRKVRICQ-ZZXKWVIFSA-N	Fc1ccc(\C=C\C(=O)NC(=S)NNC(=O)c2cnccn2)cc1	BroadT	BRD-K28548873	BRD-K28548873-001-09-6	InterBioScreen Ltd.	STOCK4S-25775			Fc1ccc(\C=C\C(=O)NC(=S)NNC(=O)c2cnccn2)cc1	InChI=1S/C15H12FN5O2S/c16-11-4-1-10(2-5-11)3-6-13(22)19-15(24)21-20-14(23)12-9-17-7-8-18-12/h1-9H,(H,20,23)(H2,19,21,22,24)/b6-3+	JBZJSTRRKVRICQ-ZZXKWVIFSA-N	345.069573564							
AC1LHQEE	LSM-18614	BRD-K62839070	867493	InChI=1S/C14H12N4O3/c1-9-5-12-13(6-10(9)2)17(8-15-12)16-7-11-3-4-14(21-11)18(19)20/h3-8H,1-2H3	SNJJEQAHOQSQCU-UHFFFAOYSA-N	Cc1cc2ncn(N=Cc3oc(cc3)[N+](=O)[O-])c2cc1C	BroadT	BRD-K62839070	BRD-K62839070-001-07-1	ChemBridge Corporation	5568126			Cc1cc2ncn(N=Cc3ccc(o3)[N+]([O-])=O)c2cc1C	InChI=1S/C14H12N4O3/c1-9-5-12-13(6-10(9)2)17(8-15-12)16-7-11-3-4-14(21-11)18(19)20/h3-8H,1-2H3	SNJJEQAHOQSQCU-UHFFFAOYSA-N	284.090940284							107260
1-Phenacylquinolinium	LSM-15195	BRD-K49725326	201572	InChI=1S/C17H14NO/c19-17(15-8-2-1-3-9-15)13-18-12-6-10-14-7-4-5-11-16(14)18/h1-12H,13H2/q+1	SZWQQHOTONBGOP-UHFFFAOYSA-N	O=C(C[n+]1cccc2ccccc12)c3ccccc3	BroadT	BRD-K49725326	BRD-K49725326-004-05-0	InterBioScreen Ltd.	STOCK1S-57980		Br	O=C(C[n+]1cccc2ccccc12)c1ccccc1.Br	InChI=1S/C17H14NO.BrH/c19-17(15-8-2-1-3-9-15)13-18-12-6-10-14-7-4-5-11-16(14)18;/h1-12H,13H2;1H/q+1;	VJFFWWQMEMACIY-UHFFFAOYSA-N	248.107539078							103845, 103845
ASN 04426501	LSM-18615	SID24808476, BRD-K00440737	1173790	InChI=1S/C17H20N6O3S/c1-5-23-13-14(21(3)17(26)22(4)15(13)25)20-16(23)27-9-12(24)19-11-8-6-7-10(2)18-11/h6-8H,5,9H2,1-4H3,(H,18,19,24)	YMIPTERHPHSLKP-UHFFFAOYSA-N	CCn1c(SCC(=O)Nc2cccc(C)n2)nc3N(C)C(=O)N(C)C(=O)c13	BroadT	BRD-K00440737	BRD-K00440737-001-05-2	Asinex Ltd.	ASN 04426501			CCn1c(SCC(=O)Nc2cccc(C)n2)nc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C17H20N6O3S/c1-5-23-13-14(21(3)17(26)22(4)15(13)25)20-16(23)27-9-12(24)19-11-8-6-7-10(2)18-11/h6-8H,5,9H2,1-4H3,(H,18,19,24)	YMIPTERHPHSLKP-UHFFFAOYSA-N	388.13175925							107261
ASN 06537871	LSM-18616	SID24797136, BRD-K92677297	3221623	InChI=1S/C21H28N6OS/c1-16-3-4-17-14-18(15-22)20(26-19(17)13-16)23-6-7-25-21(29)24-5-2-8-27-9-11-28-12-10-27/h3-4,13-14H,2,5-12H2,1H3,(H,23,26)(H2,24,25,29)	BYPBUCYYZAEHDB-UHFFFAOYSA-N	Cc1ccc2cc(C#N)c(NCCN=C(S)NCCCN3CCOCC3)nc2c1	BroadT	BRD-K92677297	BRD-K92677297-001-05-0	Asinex Ltd.	ASN 06537871			Cc1ccc2cc(C#N)c(NCCN=C(S)NCCCN3CCOCC3)nc2c1	InChI=1S/C21H28N6OS/c1-16-3-4-17-14-18(15-22)20(26-19(17)13-16)23-6-7-25-21(29)24-5-2-8-27-9-11-28-12-10-27/h3-4,13-14H,2,5-12H2,1H3,(H,23,26)(H2,24,25,29)	BYPBUCYYZAEHDB-UHFFFAOYSA-N	412.204530266							107262
AMBCB72856748	LSM-18617	SID49826228, BRD-A60144891	24819257	InChI=1S/C23H25N3O4/c1-25-12-13-26(15-20(25)17-8-4-3-5-9-17)23(27)19-14-18(30-24-19)16-29-22-11-7-6-10-21(22)28-2/h3-11,14,20H,12-13,15-16H2,1-2H3	DAKBXCCNKUPXRY-UHFFFAOYSA-N	COc1ccccc1OCc2onc(c2)C(=O)N3CCN(C)C(C3)c4ccccc4	BroadT	BRD-A60144891	BRD-A60144891-001-06-9	ChemBridge Corporation	72856748			COc1ccccc1OCc1cc(no1)C(=O)N1CCN(C)C(C1)c1ccccc1	InChI=1S/C23H25N3O4/c1-25-12-13-26(15-20(25)17-8-4-3-5-9-17)23(27)19-14-18(30-24-19)16-29-22-11-7-6-10-21(22)28-2/h3-11,14,20H,12-13,15-16H2,1-2H3	DAKBXCCNKUPXRY-UHFFFAOYSA-N	407.18450631							107263
F0656-0066	LSM-18618	SID7969609, BRD-A70270981	5310018	InChI=1S/C18H20N6O3/c25-15(19-9-14-7-4-8-27-14)11-23-12-20-17-16(18(23)26)21-22-24(17)10-13-5-2-1-3-6-13/h1-3,5-6,12,14H,4,7-11H2,(H,19,25)	PJEVFPIJDMZCKQ-UHFFFAOYSA-N	O=C(CN1C=Nc2c(nnn2Cc3ccccc3)C1=O)NCC4CCCO4	BroadT	BRD-A70270981	BRD-A70270981-001-05-3	Life Chemicals Inc.	F0656-0066			O=C(Cn1cnc2n(Cc3ccccc3)nnc2c1=O)NCC1CCCO1	InChI=1S/C18H20N6O3/c25-15(19-9-14-7-4-8-27-14)11-23-12-20-17-16(18(23)26)21-22-24(17)10-13-5-2-1-3-6-13/h1-3,5-6,12,14H,4,7-11H2,(H,19,25)	PJEVFPIJDMZCKQ-UHFFFAOYSA-N	368.15968856							107264
446065-20-9	LSM-18619	SID24789010, BRD-K41283208	777996	InChI=1S/C9H7FN2S/c10-7-3-1-2-6(4-7)8-5-13-9(11)12-8/h1-5H,(H2,11,12)	XBHHILITQUEDDC-UHFFFAOYSA-N	Nc1nc(cs1)c2cccc(F)c2	BroadT	BRD-K41283208	BRD-K41283208-001-05-7	Asinex Ltd.	BAS 05210832			Nc1nc(cs1)-c1cccc(F)c1	InChI=1S/C9H7FN2S/c10-7-3-1-2-6(4-7)8-5-13-9(11)12-8/h1-5H,(H2,11,12)	XBHHILITQUEDDC-UHFFFAOYSA-N	194.031397134							107265
AC1M4W0X	LSM-43783	SID24808066, BRD-K58358077	2268116	InChI=1S/C16H15BrN2O2/c1-21-15-6-5-14(17)9-13(15)4-7-16(20)19-11-12-3-2-8-18-10-12/h2-10H,11H2,1H3,(H,19,20)/b7-4-	HVJPBWMXIPYLKG-DAXSKMNVSA-N	COc1ccc(Br)cc1\C=C/C(=O)NCc2cccnc2	BroadT	BRD-K58358077	BRD-K58358077-001-05-5	Asinex Ltd.	BAS 01515514			COc1ccc(Br)cc1\C=C/C(=O)NCc1cccnc1	InChI=1S/C16H15BrN2O2/c1-21-15-6-5-14(17)9-13(15)4-7-16(20)19-11-12-3-2-8-18-10-12/h2-10H,11H2,1H3,(H,19,20)/b7-4-	HVJPBWMXIPYLKG-DAXSKMNVSA-N	346.03169034							
MLS000583045	LSM-18621	SID17510527, SID24269597, BRD-K73725567	12005244	InChI=1S/C24H29N3O3/c1-4-5-13-25-22(28)12-14-26-23(29)20-8-6-7-9-21(20)27(24(26)30)16-19-15-17(2)10-11-18(19)3/h6-11,15H,4-5,12-14,16H2,1-3H3,(H,25,28)	SBGYTDRGYXNOOP-UHFFFAOYSA-N	CCCCNC(=O)CCN1C(=O)N(Cc2cc(C)ccc2C)c3ccccc3C1=O	BroadT	BRD-K73725567	BRD-K73725567-001-05-3	ChemDiv Inc.	C260-1752			CCCCNC(=O)CCn1c(=O)n(Cc2cc(C)ccc2C)c2ccccc2c1=O	InChI=1S/C24H29N3O3/c1-4-5-13-25-22(28)12-14-26-23(29)20-8-6-7-9-21(20)27(24(26)30)16-19-15-17(2)10-11-18(19)3/h6-11,15H,4-5,12-14,16H2,1-3H3,(H,25,28)	SBGYTDRGYXNOOP-UHFFFAOYSA-N	407.220891818							107267
MLS000850076	LSM-18622	SID26729554, BRD-K16329620	2810291	InChI=1S/C20H23NO5S2/c1-20(2,3)13-7-5-12(6-8-13)15-9-14(18(28-15)19(25)26-4)21-16(22)10-27-11-17(23)24/h5-9H,10-11H2,1-4H3,(H,21,22)(H,23,24)	QZLMIUVUIJWPFI-UHFFFAOYSA-N	COC(=O)c1sc(cc1NC(=O)CSCC(=O)O)c2ccc(cc2)C(C)(C)C	BroadT	BRD-K16329620	BRD-K16329620-001-06-7	Maybridge	HTS 01713			COC(=O)c1sc(cc1NC(=O)CSCC(O)=O)-c1ccc(cc1)C(C)(C)C	InChI=1S/C20H23NO5S2/c1-20(2,3)13-7-5-12(6-8-13)15-9-14(18(28-15)19(25)26-4)21-16(22)10-27-11-17(23)24/h5-9H,10-11H2,1-4H3,(H,21,22)(H,23,24)	QZLMIUVUIJWPFI-UHFFFAOYSA-N	421.101764226							107268
MLS000861524	LSM-18623	SID26727402, BRD-K53273877	2729517	InChI=1S/C19H20ClN3/c20-17-5-2-1-4-15(17)14-22-10-12-23(13-11-22)19-7-3-6-18-16(19)8-9-21-18/h1-9,21H,10-14H2	IKHUKLQDWXAECD-UHFFFAOYSA-N	Clc1ccccc1CN2CCN(CC2)c3cccc4[nH]ccc34	BroadT	BRD-K53273877	BRD-K53273877-001-07-9	Maybridge	RJC 03025			Clc1ccccc1CN1CCN(CC1)c1cccc2[nH]ccc12	InChI=1S/C19H20ClN3/c20-17-5-2-1-4-15(17)14-22-10-12-23(13-11-22)19-7-3-6-18-16(19)8-9-21-18/h1-9,21H,10-14H2	IKHUKLQDWXAECD-UHFFFAOYSA-N	325.13457538							107269
4-Methyl-n-(5,6,7,8-tetrahydro-naphthalen-1-yl)-benzenesulfonamide	LSM-18624	SID17508763, BRD-K46868036	778095	InChI=1S/C17H19NO2S/c1-13-9-11-15(12-10-13)21(19,20)18-17-8-4-6-14-5-2-3-7-16(14)17/h4,6,8-12,18H,2-3,5,7H2,1H3	OQTUWDWJDGOJBC-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)Nc2cccc3CCCCc23	BroadT	BRD-K46868036	BRD-K46868036-001-05-8	Asinex Ltd.	BAS 03374784			Cc1ccc(cc1)S(=O)(=O)Nc1cccc2CCCCc12	InChI=1S/C17H19NO2S/c1-13-9-11-15(12-10-13)21(19,20)18-17-8-4-6-14-5-2-3-7-16(14)17/h4,6,8-12,18H,2-3,5,7H2,1H3	OQTUWDWJDGOJBC-UHFFFAOYSA-N	301.113649548							107270
MLS000553419	LSM-18625	SID17410760, BRD-K47898291	2928921	InChI=1S/C16H15N5O4S2/c1-20-13(24)9(11(22)18-15(20)26)8(7-5-3-4-6-17-7)10-12(23)19-16(27)21(2)14(10)25/h3-6,8,24-25H,1-2H3,(H,18,22,26)(H,19,23,27)	KTLIMRLDAZNZAJ-UHFFFAOYSA-N	CN1C(=S)NC(=O)C(=C1O)C(C2=C(O)N(C)C(=S)NC2=O)c3ccccn3	BroadT	BRD-K47898291	BRD-K47898291-001-05-4	Asinex Ltd.	BAS 04842009			Cn1c(O)c(C(c2ccccn2)c2c(O)n(C)c(=S)[nH]c2=O)c(=O)[nH]c1=S	InChI=1S/C16H15N5O4S2/c1-20-13(24)9(11(22)18-15(20)26)8(7-5-3-4-6-17-7)10-12(23)19-16(27)21(2)14(10)25/h3-6,8,24-25H,1-2H3,(H,18,22,26)(H,19,23,27)	KTLIMRLDAZNZAJ-UHFFFAOYSA-N	405.05654539							107271
MLS000570088	LSM-18626	SID14746489, BRD-K40038819	4193163	InChI=1S/C23H20ClNO5/c24-18-10-16-17(23(29)15-8-4-3-7-14(15)22(16)28)11-19(18)25-20(26)12-30-21(27)9-13-5-1-2-6-13/h3-4,7-8,10-11,13H,1-2,5-6,9,12H2,(H,25,26)	VPJKPQFPNJWADZ-UHFFFAOYSA-N	Clc1cc2C(=O)c3ccccc3C(=O)c2cc1NC(=O)COC(=O)CC4CCCC4	BroadT	BRD-K40038819	BRD-K40038819-001-07-3	Enamine Ltd.	T0511-3818			Clc1cc2C(=O)c3ccccc3C(=O)c2cc1NC(=O)COC(=O)CC1CCCC1	InChI=1S/C23H20ClNO5/c24-18-10-16-17(23(29)15-8-4-3-7-14(15)22(16)28)11-19(18)25-20(26)12-30-21(27)9-13-5-1-2-6-13/h3-4,7-8,10-11,13H,1-2,5-6,9,12H2,(H,25,26)	VPJKPQFPNJWADZ-UHFFFAOYSA-N	425.10300046							107272
N-(2-Fluoro-5-methylphenyl)-3-phenylpropanamide	LSM-18627	SID14739440, BRD-K64400622	803035	InChI=1S/C16H16FNO/c1-12-7-9-14(17)15(11-12)18-16(19)10-8-13-5-3-2-4-6-13/h2-7,9,11H,8,10H2,1H3,(H,18,19)	BOECBBJDMCTSAU-UHFFFAOYSA-N	Cc1ccc(F)c(NC(=O)CCc2ccccc2)c1	BroadT	BRD-K64400622	BRD-K64400622-001-05-7	ChemBridge Corporation	7003158			Cc1ccc(F)c(NC(=O)CCc2ccccc2)c1	InChI=1S/C16H16FNO/c1-12-7-9-14(17)15(11-12)18-16(19)10-8-13-5-3-2-4-6-13/h2-7,9,11H,8,10H2,1H3,(H,18,19)	BOECBBJDMCTSAU-UHFFFAOYSA-N	257.121592342							107273
2-(4-Fluorophenyl)-8-methylindolizine	LSM-18628	SID24807022, BRD-K12490527	751731	InChI=1S/C15H12FN/c1-11-3-2-8-17-10-13(9-15(11)17)12-4-6-14(16)7-5-12/h2-10H,1H3	CNIVDJYOMJXRKT-UHFFFAOYSA-N	Cc1cccn2cc(cc12)c3ccc(F)cc3	BroadT	BRD-K12490527	BRD-K12490527-001-05-7	Asinex Ltd.	BAS 04912272			Cc1cccn2cc(cc12)-c1ccc(F)cc1	InChI=1S/C15H12FN/c1-11-3-2-8-17-10-13(9-15(11)17)12-4-6-14(16)7-5-12/h2-10H,1H3	CNIVDJYOMJXRKT-UHFFFAOYSA-N	225.095377594							107274
MLS000562099	LSM-18629	SID26660078, BRD-A14101427	16682037	InChI=1S/C36H33ClN4O5/c37-27-14-16-29(17-15-27)45-22-33(42)39-28-13-7-12-26(18-28)31-20-36(46-40-31)21-32(35(38)44)41(23-36)34(43)19-30(24-8-3-1-4-9-24)25-10-5-2-6-11-25/h1-18,30,32H,19-23H2,(H2,38,44)(H,39,42)/t32-,36?/m1/s1	BGXZPXNTQICWOW-NQUIPPIDSA-N	NC(=O)[C@H]1CC2(CN1C(=O)CC(c3ccccc3)c4ccccc4)CC(=NO2)c5cccc(NC(=O)COc6ccc(Cl)cc6)c5	BroadT	BRD-A14101427	BRD-A14101427-001-05-1	University of California at Davis	UCD_SMD_1-135			NC(=O)[C@H]1CC2(CN1C(=O)CC(c1ccccc1)c1ccccc1)CC(=NO2)c1cccc(NC(=O)COc2ccc(Cl)cc2)c1	InChI=1S/C36H33ClN4O5/c37-27-14-16-29(17-15-27)45-22-33(42)39-28-13-7-12-26(18-28)31-20-36(46-40-31)21-32(35(38)44)41(23-36)34(43)19-30(24-8-3-1-4-9-24)25-10-5-2-6-11-25/h1-18,30,32H,19-23H2,(H2,38,44)(H,39,42)/t32-,36?/m1/s1	BGXZPXNTQICWOW-NQUIPPIDSA-N	636.213947906							107275
STK561316	LSM-18630	SID49643717, BRD-K28839261	54676672	InChI=1S/C21H21ClN2O3/c1-2-3-8-13-24-17-12-7-4-9-14(17)19(25)18(21(24)27)20(26)23-16-11-6-5-10-15(16)22/h4-7,9-12,25H,2-3,8,13H2,1H3,(H,23,26)	YJWWCLZDOZGSQE-UHFFFAOYSA-N	CCCCCN1C(=O)C(=C(O)c2ccccc12)C(=O)Nc3ccccc3Cl	BroadT	BRD-K28839261	BRD-K28839261-001-05-7	Asinex Ltd.	BAS 00141254			CCCCCn1c2ccccc2c(O)c(C(=O)Nc2ccccc2Cl)c1=O	InChI=1S/C21H21ClN2O3/c1-2-3-8-13-24-17-12-7-4-9-14(17)19(25)18(21(24)27)20(26)23-16-11-6-5-10-15(16)22/h4-7,9-12,25H,2-3,8,13H2,1H3,(H,23,26)	YJWWCLZDOZGSQE-UHFFFAOYSA-N	384.124070262							107276
F0656-0064	LSM-18631	SID24824022, BRD-K30898048	7159111	InChI=1S/C20H17ClN6O2/c21-16-9-5-4-8-15(16)10-22-17(28)12-26-13-23-19-18(20(26)29)24-25-27(19)11-14-6-2-1-3-7-14/h1-9,13H,10-12H2,(H,22,28)	JMEYCKSZNNDZKL-UHFFFAOYSA-N	Clc1ccccc1CNC(=O)CN2C=Nc3c(nnn3Cc4ccccc4)C2=O	BroadT	BRD-K30898048	BRD-K30898048-001-05-9	Life Chemicals Inc.	F0656-0064			Clc1ccccc1CNC(=O)Cn1cnc2n(Cc3ccccc3)nnc2c1=O	InChI=1S/C20H17ClN6O2/c21-16-9-5-4-8-15(16)10-22-17(28)12-26-13-23-19-18(20(26)29)24-25-27(19)11-14-6-2-1-3-7-14/h1-9,13H,10-12H2,(H,22,28)	JMEYCKSZNNDZKL-UHFFFAOYSA-N	408.110151554							107277
MLS000676773	LSM-43784	SID22415149, BRD-K20493347	734190	InChI=1S/C18H17NO4/c1-21-15-5-3-2-4-13(15)6-9-18(20)19-14-7-8-16-17(12-14)23-11-10-22-16/h2-9,12H,10-11H2,1H3,(H,19,20)/b9-6+	MEOGKJOTLWVCRS-RMKNXTFCSA-N	COc1ccccc1\C=C\C(=O)Nc2ccc3OCCOc3c2	BroadT	BRD-K20493347	BRD-K20493347-001-05-9	ChemBridge Corporation	7142063			COc1ccccc1\C=C\C(=O)Nc1ccc2OCCOc2c1	InChI=1S/C18H17NO4/c1-21-15-5-3-2-4-13(15)6-9-18(20)19-14-7-8-16-17(12-14)23-11-10-22-16/h2-9,12H,10-11H2,1H3,(H,19,20)/b9-6+	MEOGKJOTLWVCRS-RMKNXTFCSA-N	311.115758034							
T5334838	LSM-18633	SID24833023, BRD-A56452063	4969701	InChI=1S/C12H13NO5S/c14-10(13-8-4-2-1-3-5-8)7-19-9(12(17)18)6-11(15)16/h1-5,9H,6-7H2,(H,13,14)(H,15,16)(H,17,18)	KFWWYZRSCMOOJW-UHFFFAOYSA-N	OC(=O)CC(SCC(=O)Nc1ccccc1)C(=O)O	BroadT	BRD-A56452063	BRD-A56452063-001-05-6	Enamine Ltd.	T5334838			OC(=O)CC(SCC(=O)Nc1ccccc1)C(O)=O	InChI=1S/C12H13NO5S/c14-10(13-8-4-2-1-3-5-8)7-19-9(12(17)18)6-11(15)16/h1-5,9H,6-7H2,(H,13,14)(H,15,16)(H,17,18)	KFWWYZRSCMOOJW-UHFFFAOYSA-N	283.051443216							107279
N-(3-Chlorophenyl)-2-(4-methylpiperidin-1-yl)acetamide	LSM-18634	SID24793351, BRD-K43873821	2229170	InChI=1S/C14H19ClN2O/c1-11-5-7-17(8-6-11)10-14(18)16-13-4-2-3-12(15)9-13/h2-4,9,11H,5-8,10H2,1H3,(H,16,18)	UTBFNNHTUDUZKF-UHFFFAOYSA-N	CC1CCN(CC(=O)Nc2cccc(Cl)c2)CC1	BroadT	BRD-K43873821	BRD-K43873821-001-05-0	ChemBridge Corporation	7959157			CC1CCN(CC(=O)Nc2cccc(Cl)c2)CC1	InChI=1S/C14H19ClN2O/c1-11-5-7-17(8-6-11)10-14(18)16-13-4-2-3-12(15)9-13/h2-4,9,11H,5-8,10H2,1H3,(H,16,18)	UTBFNNHTUDUZKF-UHFFFAOYSA-N	266.118590958							107280
AC-907/34130057	LSM-18635	SID17386341, BRD-K04296252	824768	InChI=1S/C16H17NO5/c1-4-21-15(19)11-9-12(16(20)22-5-2)14(18)17-10(3)7-6-8-13(11)17/h6-9H,4-5H2,1-3H3	ZVENEJWFSHUFTD-UHFFFAOYSA-N	CCOC(=O)C1=C2C=CC=C(C)N2C(=O)C(=C1)C(=O)OCC	BroadT	BRD-K04296252	BRD-K04296252-001-05-9	Specs	AC-907/34130057			CCOC(=O)c1cc(C(=O)OCC)c(=O)n2c(C)cccc12	InChI=1S/C16H17NO5/c1-4-21-15(19)11-9-12(16(20)22-5-2)14(18)17-10(3)7-6-8-13(11)17/h6-9H,4-5H2,1-3H3	ZVENEJWFSHUFTD-UHFFFAOYSA-N	303.110672654							107281
T5248041	LSM-43785	SID24781854, BRD-K27782106	2120748	InChI=1S/C20H14Cl2N4O2S2/c21-13-5-3-12(4-6-13)15-10-29-17(25-15)8-19-26(18(28)11-30-19)9-16(27)24-14-2-1-7-23-20(14)22/h1-8,10H,9,11H2,(H,24,27)/b19-8-	AGXUUOJHZDZBFN-UWVJOHFNSA-N	Clc1ccc(cc1)c2csc(\C=C\3/SCC(=O)N3CC(=O)Nc4cccnc4Cl)n2	BroadT	BRD-K27782106	BRD-K27782106-001-05-9	Enamine Ltd.	T5248041			Clc1ccc(cc1)-c1csc(\C=C2/SCC(=O)N2CC(=O)Nc2cccnc2Cl)n1	InChI=1S/C20H14Cl2N4O2S2/c21-13-5-3-12(4-6-13)15-10-29-17(25-15)8-19-26(18(28)11-30-19)9-16(27)24-14-2-1-7-23-20(14)22/h1-8,10H,9,11H2,(H,24,27)/b19-8-	AGXUUOJHZDZBFN-UWVJOHFNSA-N	475.993522528							
4-[1,1'-Biphenyl]-4-yl-2-oxo-2,5-dihydro-3-furancarbonitrile	LSM-18637	SID24824511, BRD-K01585627	2764476	InChI=1S/C17H11NO2/c18-10-15-16(11-20-17(15)19)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9H,11H2	TTZMUQGRABVCDG-UHFFFAOYSA-N	O=C1OCC(=C1C#N)c2ccc(cc2)c3ccccc3	BroadT	BRD-K01585627	BRD-K01585627-001-05-6	Key Organics Ltd.	9D-044			O=C1OCC(=C1C#N)c1ccc(cc1)-c1ccccc1	InChI=1S/C17H11NO2/c18-10-15-16(11-20-17(15)19)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9H,11H2	TTZMUQGRABVCDG-UHFFFAOYSA-N	261.078978602							107283
MLS000525938	LSM-18638	SID14724536, BRD-A18392827	2850833	InChI=1S/C15H23NO/c1-11-8-9-13(10-12(11)2)16-14-6-4-5-7-15(14)17-3/h8-10,14-16H,4-7H2,1-3H3	CCKVKDWMBPBQII-UHFFFAOYSA-N	COC1CCCCC1Nc2ccc(C)c(C)c2	BroadT	BRD-A18392827	BRD-A18392827-001-11-6	Asinex Ltd.	BAS 01125302			COC1CCCCC1Nc1ccc(C)c(C)c1	InChI=1S/C15H23NO/c1-11-8-9-13(10-12(11)2)16-14-6-4-5-7-15(14)17-3/h8-10,14-16H,4-7H2,1-3H3	CCKVKDWMBPBQII-UHFFFAOYSA-N	233.177964366							107284
8-Aminoquinaldine	LSM-18639	SID103061984, SID24809056, BRD-K38407067	140457	InChI=1S/C10H10N2/c1-7-5-6-8-3-2-4-9(11)10(8)12-7/h2-6H,11H2,1H3	JHIAOWGCGNMQKA-UHFFFAOYSA-N	Cc1ccc2cccc(N)c2n1	BroadT	BRD-K38407067	BRD-K38407067-001-05-7	Asinex Ltd.	BAS 08909099			Cc1ccc2cccc(N)c2n1	InChI=1S/C10H10N2/c1-7-5-6-8-3-2-4-9(11)10(8)12-7/h2-6H,11H2,1H3	JHIAOWGCGNMQKA-UHFFFAOYSA-N	158.08439834							107285
AC1O9VBG	LSM-18640	BRD-K85418839	6737837	InChI=1S/C16H13NO2S/c1-10(17-12-7-3-4-8-13(12)18)16-15(19)11-6-2-5-9-14(11)20-16/h2-9,18-19H,1H3	MWKBVSUXGQPBEC-UHFFFAOYSA-N	CC(=Nc1ccccc1O)c2sc3ccccc3c2O	BroadT	BRD-K85418839	BRD-K85418839-001-06-1	InterBioScreen Ltd.	STOCK1S-78049			CC(=Nc1ccccc1O)c1sc2ccccc2c1O	InChI=1S/C16H13NO2S/c1-10(17-12-7-3-4-8-13(12)18)16-15(19)11-6-2-5-9-14(11)20-16/h2-9,18-19H,1H3	MWKBVSUXGQPBEC-UHFFFAOYSA-N	283.066699356							
T0512-7641	LSM-18641	SID3715480, BRD-K69589866	2370234	InChI=1S/C14H15N3S2/c1-10-8-11(2)17(16-10)6-5-14-15-12(9-19-14)13-4-3-7-18-13/h3-4,7-9H,5-6H2,1-2H3	RAONHHVSFVIECY-UHFFFAOYSA-N	Cc1cc(C)n(CCc2nc(cs2)c3cccs3)n1	BroadT	BRD-K69589866	BRD-K69589866-001-05-7	Enamine Ltd.	T0512-7641			Cc1cc(C)n(CCc2nc(cs2)-c2cccs2)n1	InChI=1S/C14H15N3S2/c1-10-8-11(2)17(16-10)6-5-14-15-12(9-19-14)13-4-3-7-18-13/h3-4,7-9H,5-6H2,1-2H3	RAONHHVSFVIECY-UHFFFAOYSA-N	289.07073889							107287
ST50841054	LSM-18642	SID49718466, BRD-A06194089	17374586	InChI=1S/C17H21Cl2NO4/c1-2-14(24-15-11-12(18)3-4-13(15)19)16(21)20-7-5-17(6-8-20)22-9-10-23-17/h3-4,11,14H,2,5-10H2,1H3	IJFLJFUZPROQNZ-UHFFFAOYSA-N	CCC(Oc1cc(Cl)ccc1Cl)C(=O)N2CCC3(CC2)OCCO3	BroadT	BRD-A06194089	BRD-A06194089-001-05-5	ChemBridge Corporation	9093229			CCC(Oc1cc(Cl)ccc1Cl)C(=O)N1CCC2(CC1)OCCO2	InChI=1S/C17H21Cl2NO4/c1-2-14(24-15-11-12(18)3-4-13(15)19)16(21)20-7-5-17(6-8-20)22-9-10-23-17/h3-4,11,14H,2,5-10H2,1H3	IJFLJFUZPROQNZ-UHFFFAOYSA-N	373.084763582							107288
T0520-4230	LSM-18643	BRD-K81825262	6245631	InChI=1S/C15H16N4O3S/c1-21-12-6-10(7-13(22-2)14(12)20)8-17-19-15(23)18-11-4-3-5-16-9-11/h3-9,20H,1-2H3,(H2,18,19,23)	VXBCUHXGLOKWBX-UHFFFAOYSA-N	COc1cc(C=NN=C(S)Nc2cccnc2)cc(OC)c1O	BroadT	BRD-K81825262	BRD-K81825262-001-05-9	Enamine Ltd.	T0520-4230			COc1cc(C=NN=C(S)Nc2cccnc2)cc(OC)c1O	InChI=1S/C15H16N4O3S/c1-21-12-6-10(7-13(22-2)14(12)20)8-17-19-15(23)18-11-4-3-5-16-9-11/h3-9,20H,1-2H3,(H2,18,19,23)	VXBCUHXGLOKWBX-UHFFFAOYSA-N	332.094311102							
SMR000029853	LSM-18644	SID87340969, SID4242226, BRD-K89246892	3237110	InChI=1S/C25H26N6O3/c1-16-7-9-18(10-8-16)25(33)30-13-11-17(12-14-30)22-26-23-21(24(32)27-22)28-29-31(23)15-19-5-3-4-6-20(19)34-2/h3-10,17H,11-15H2,1-2H3,(H,26,27,32)	VRTFGHPYBQPDIG-UHFFFAOYSA-N	COc1ccccc1Cn2nnc3c(O)nc(nc23)C4CCN(CC4)C(=O)c5ccc(C)cc5	BroadT	BRD-K89246892	BRD-K89246892-001-05-8	ChemDiv Inc.	D023-0035			COc1ccccc1Cn1nnc2c(O)nc(nc12)C1CCN(CC1)C(=O)c1ccc(C)cc1	InChI=1S/C25H26N6O3/c1-16-7-9-18(10-8-16)25(33)30-13-11-17(12-14-30)22-26-23-21(24(32)27-22)28-29-31(23)15-19-5-3-4-6-20(19)34-2/h3-10,17H,11-15H2,1-2H3,(H,26,27,32)	VRTFGHPYBQPDIG-UHFFFAOYSA-N	458.206638752							
T6029164	LSM-18645	SID49819863, BRD-K93226431	4557860	InChI=1S/C15H11ClN2OS/c1-9-5-4-8-17-14(9)18-15(19)13-12(16)10-6-2-3-7-11(10)20-13/h2-8H,1H3,(H,17,18,19)	PKQDOSZHMAIBHQ-UHFFFAOYSA-N	Cc1cccnc1NC(=O)c2sc3ccccc3c2Cl	BroadT	BRD-K93226431	BRD-K93226431-001-05-2	UkrOrgSynthesis Ltd.	PB71467859			Cc1cccnc1NC(=O)c1sc2ccccc2c1Cl	InChI=1S/C15H11ClN2OS/c1-9-5-4-8-17-14(9)18-15(19)13-12(16)10-6-2-3-7-11(10)20-13/h2-8H,1H3,(H,17,18,19)	PKQDOSZHMAIBHQ-UHFFFAOYSA-N	302.028061392							107291
T6092912	LSM-18646	SID49820571, BRD-K03014438	2595258	InChI=1S/C17H21N3O2S/c1-2-3-10-20-16(22)13-6-4-5-7-14(13)19-17(20)23-11-15(21)18-12-8-9-12/h4-7,12H,2-3,8-11H2,1H3,(H,18,21)	BBLYHWIKINTQTE-UHFFFAOYSA-N	CCCCN1C(=Nc2ccccc2C1=O)SCC(=O)NC3CC3	BroadT	BRD-K03014438	BRD-K03014438-001-05-4	UkrOrgSynthesis Ltd.	PB-00372555			CCCCn1c(SCC(=O)NC2CC2)nc2ccccc2c1=O	InChI=1S/C17H21N3O2S/c1-2-3-10-20-16(22)13-6-4-5-7-14(13)19-17(20)23-11-15(21)18-12-8-9-12/h4-7,12H,2-3,8-11H2,1H3,(H,18,21)	BBLYHWIKINTQTE-UHFFFAOYSA-N	331.135447632							107292
MLS000122453	LSM-18647	SID14722105, BRD-K13095116	1084661	InChI=1S/C19H20N4O/c24-19(13-6-2-1-3-7-13)21-14-9-10-15-17(12-14)23-18(22-15)16-8-4-5-11-20-16/h4-5,8-13H,1-3,6-7H2,(H,21,24)(H,22,23)	LSTQFCLDGQRHFH-UHFFFAOYSA-N	O=C(Nc1ccc2[nH]c(nc2c1)c3ccccn3)C4CCCCC4	BroadT	BRD-K13095116	BRD-K13095116-001-06-8	Asinex Ltd.	BAS 06347310			O=C(Nc1ccc2[nH]c(nc2c1)-c1ccccn1)C1CCCCC1	InChI=1S/C19H20N4O/c24-19(13-6-2-1-3-7-13)21-14-9-10-15-17(12-14)23-18(22-15)16-8-4-5-11-20-16/h4-5,8-13H,1-3,6-7H2,(H,21,24)(H,22,23)	LSTQFCLDGQRHFH-UHFFFAOYSA-N	320.1637113							107293
ST4002966	LSM-18648	SID22414781, BRD-K95066879	753629	InChI=1S/C11H10N4O2S/c1-2-17-9(16)6-18-11-8(5-13)3-7(4-12)10(14)15-11/h3H,2,6H2,1H3,(H2,14,15)	XAWLFKGEPVBUIF-UHFFFAOYSA-N	CCOC(=O)CSc1nc(N)c(cc1C#N)C#N	BroadT	BRD-K95066879	BRD-K95066879-001-05-9	Specs	AG-690/11629201			CCOC(=O)CSc1nc(N)c(cc1C#N)C#N	InChI=1S/C11H10N4O2S/c1-2-17-9(16)6-18-11-8(5-13)3-7(4-12)10(14)15-11/h3H,2,6H2,1H3,(H2,14,15)	XAWLFKGEPVBUIF-UHFFFAOYSA-N	262.05244629							107294
GNF-PF-4746	LSM-15278	BRD-K96341939	16194193	InChI=1S/C23H29FN4O3/c1-16-8-12-27(13-9-16)11-3-10-25-21-7-5-18(14-22(21)28(30)31)23(29)26-19-6-4-17(2)20(24)15-19/h4-7,14-16,25H,3,8-13H2,1-2H3,(H,26,29)	DBJNKIOTKAPNHU-UHFFFAOYSA-N	CC1CCN(CCCNc2ccc(cc2[N+](=O)[O-])C(=O)Nc3ccc(C)c(F)c3)CC1	BroadT	BRD-K96341939	BRD-K96341939-003-05-9	ChemDiv Inc.	K784-1657		Cl	CC1CCN(CCCNc2ccc(cc2[N+]([O-])=O)C(=O)Nc2ccc(C)c(F)c2)CC1.Cl	InChI=1S/C23H29FN4O3.ClH/c1-16-8-12-27(13-9-16)11-3-10-25-21-7-5-18(14-22(21)28(30)31)23(29)26-19-6-4-17(2)20(24)15-19;/h4-7,14-16,25H,3,8-13H2,1-2H3,(H,26,29);1H	BDWMLXMSBLCKKX-UHFFFAOYSA-N	428.222369028							103925, 103925
SMR000095088	LSM-18649	SID26724729, SID7964864, BRD-A99081601	5307277	InChI=1S/C24H32N4O2/c1-16-9-7-10-17(2)28(16)14-8-13-25-23(29)21-15-19-22(26(21)3)18-11-5-6-12-20(18)27(4)24(19)30/h5-6,11-12,15-17H,7-10,13-14H2,1-4H3,(H,25,29)	WPHDYUBGDWPYSY-UHFFFAOYSA-N	CC1CCCC(C)N1CCCNC(=O)c2cc3C(=O)N(C)c4ccccc4c3n2C	BroadT	BRD-A99081601	BRD-A99081601-001-04-4	ChemDiv Inc.	C593-0658			CC1CCCC(C)N1CCCNC(=O)c1cc2c(n1C)c1ccccc1n(C)c2=O	InChI=1S/C24H32N4O2/c1-16-9-7-10-17(2)28(16)14-8-13-25-23(29)21-15-19-22(26(21)3)18-11-5-6-12-20(18)27(4)24(19)30/h5-6,11-12,15-17H,7-10,13-14H2,1-4H3,(H,25,29)	WPHDYUBGDWPYSY-UHFFFAOYSA-N	408.252526304							107295
SMR000241520	LSM-18650	SID22411433, BRD-K82783598	3946151	InChI=1S/C21H23N5O3S3/c27-19(15-30-21-25-24-20(31-21)23-16-8-3-1-4-9-16)22-17-10-7-11-18(14-17)32(28,29)26-12-5-2-6-13-26/h1,3-4,7-11,14H,2,5-6,12-13,15H2,(H,22,27)(H,23,24)	KSCKUBANALFATR-UHFFFAOYSA-N	O=C(CSc1nnc(Nc2ccccc2)s1)Nc3cccc(c3)S(=O)(=O)N4CCCCC4	BroadT	BRD-K82783598	BRD-K82783598-001-05-4	Enamine Ltd.	T5267207			O=C(CSc1nnc(s1)Nc1ccccc1)Nc1cccc(c1)S(=O)(=O)N1CCCCC1	InChI=1S/C21H23N5O3S3/c27-19(15-30-21-25-24-20(31-21)23-16-8-3-1-4-9-16)22-17-10-7-11-18(14-17)32(28,29)26-12-5-2-6-13-26/h1,3-4,7-11,14H,2,5-6,12-13,15H2,(H,22,27)(H,23,24)	KSCKUBANALFATR-UHFFFAOYSA-N	489.096301716							107296
MLS000096906	LSM-18651	SID4258829, BRD-K22484535	2163156	InChI=1S/C14H16N4O4S/c1-2-22-10-13(19)17-11-4-6-12(7-5-11)23(20,21)18-14-15-8-3-9-16-14/h3-9H,2,10H2,1H3,(H,17,19)(H,15,16,18)	LDYNYSLUFIZKOC-UHFFFAOYSA-N	CCOCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2ncccn2	BroadT	BRD-K22484535	BRD-K22484535-001-05-8	ChemBridge Corporation	7679885			CCOCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1	InChI=1S/C14H16N4O4S/c1-2-22-10-13(19)17-11-4-6-12(7-5-11)23(20,21)18-14-15-8-3-9-16-14/h3-9H,2,10H2,1H3,(H,17,19)(H,15,16,18)	LDYNYSLUFIZKOC-UHFFFAOYSA-N	336.089225722							107297
MLS000709567	LSM-18652	SID24804915, BRD-A96219290	3229425	InChI=1S/C22H25N3O2S/c1-24-14-7-8-16(24)13-15-25(21(26)17-9-3-5-11-19(17)27-2)22-23-18-10-4-6-12-20(18)28-22/h3-6,9-12,16H,7-8,13-15H2,1-2H3	VJWZYBFEWVNBCF-UHFFFAOYSA-N	COc1ccccc1C(=O)N(CCC2CCCN2C)c3nc4ccccc4s3	BroadT	BRD-A96219290	BRD-A96219290-001-06-4	Asinex Ltd.	ASN 08230926			COc1ccccc1C(=O)N(CCC1CCCN1C)c1nc2ccccc2s1	InChI=1S/C22H25N3O2S/c1-24-14-7-8-16(24)13-15-25(21(26)17-9-3-5-11-19(17)27-2)22-23-18-10-4-6-12-20(18)28-22/h3-6,9-12,16H,7-8,13-15H2,1-2H3	VJWZYBFEWVNBCF-UHFFFAOYSA-N	395.16674776							107298
AC1NRHKV	LSM-43786	SID14746293, BRD-K23162611	5291617	InChI=1S/C19H16N2O6/c1-26-14-9-11(10-15(27-2)16(14)22)8-13-17(23)20-19(25)21(18(13)24)12-6-4-3-5-7-12/h3-10,22H,1-2H3,(H,20,23,25)/b13-8+	ICEFRACOOZHSPS-MDWZMJQESA-N	COc1cc(\C=C\2/C(=O)NC(=O)N(C2=O)c3ccccc3)cc(OC)c1O	BroadT	BRD-K23162611	BRD-K23162611-001-05-6	ChemBridge Corporation	5809920			COc1cc(cc(OC)c1O)\C=C1/C(=O)NC(=O)N(C1=O)c1ccccc1	InChI=1S/C19H16N2O6/c1-26-14-9-11(10-15(27-2)16(14)22)8-13-17(23)20-19(25)21(18(13)24)12-6-4-3-5-7-12/h3-10,22H,1-2H3,(H,20,23,25)/b13-8+	ICEFRACOOZHSPS-MDWZMJQESA-N	368.100836252							
MLS000051543	LSM-18654	SID4258684, BRD-K28335320	1969317	InChI=1S/C19H16N6O2S/c1-25-19(22-23-24-25)28-12-15(26)20-18-21-16(13-8-4-2-5-9-13)17(27-18)14-10-6-3-7-11-14/h2-11H,12H2,1H3,(H,20,21,26)	DMFWXHHFEQTDEK-UHFFFAOYSA-N	Cn1nnnc1SCC(=O)Nc2oc(c3ccccc3)c(n2)c4ccccc4	BroadT	BRD-K28335320	BRD-K28335320-001-06-3	ChemBridge Corporation	7939235			Cn1nnnc1SCC(=O)Nc1nc(c(o1)-c1ccccc1)-c1ccccc1	InChI=1S/C19H16N6O2S/c1-25-19(22-23-24-25)28-12-15(26)20-18-21-16(13-8-4-2-5-9-13)17(27-18)14-10-6-3-7-11-14/h2-11H,12H2,1H3,(H,20,21,26)	DMFWXHHFEQTDEK-UHFFFAOYSA-N	392.105544502							107300
ZINC00468395	LSM-18655	SID24791153, BRD-K74281619	892433	InChI=1S/C16H13N3O2/c1-11-5-2-3-7-13(11)15-19-14(9-17)16(21-15)18-10-12-6-4-8-20-12/h2-8,18H,10H2,1H3	SMTUPGSVCXEPHW-UHFFFAOYSA-N	Cc1ccccc1c2oc(NCc3occc3)c(n2)C#N	BroadT	BRD-K74281619	BRD-K74281619-001-05-4	ChemBridge Corporation	7536423			Cc1ccccc1-c1nc(C#N)c(NCc2ccco2)o1	InChI=1S/C16H13N3O2/c1-11-5-2-3-7-13(11)15-19-14(9-17)16(21-15)18-10-12-6-4-8-20-12/h2-8,18H,10H2,1H3	SMTUPGSVCXEPHW-UHFFFAOYSA-N	279.100776686							107301
SMR000123409	LSM-18656	SID14720763, BRD-K63694910	3184126	InChI=1S/C23H20N4O4S3/c1-14-5-7-20-21(26-33-25-20)22(14)34(29,30)27(13-18-4-3-9-32-18)12-16-10-15-11-17(31-2)6-8-19(15)24-23(16)28/h3-11H,12-13H2,1-2H3,(H,24,28)	QJSLRPRLHYKHKP-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(Cc3cccs3)S(=O)(=O)c4c(C)ccc5nsnc45)cc2c1	BroadT	BRD-K63694910	BRD-K63694910-001-06-5	Asinex Ltd.	ASN 04195251			COc1ccc2nc(O)c(CN(Cc3cccs3)S(=O)(=O)c3c(C)ccc4nsnc34)cc2c1	InChI=1S/C23H20N4O4S3/c1-14-5-7-20-21(26-33-25-20)22(14)34(29,30)27(13-18-4-3-9-32-18)12-16-10-15-11-17(31-2)6-8-19(15)24-23(16)28/h3-11H,12-13H2,1-2H3,(H,24,28)	QJSLRPRLHYKHKP-UHFFFAOYSA-N	512.06466723							107302
MLS000834574	LSM-18657	SID24841664, BRD-K58499307	16197148	InChI=1S/C29H26F3N3O4/c30-29(31,32)22-11-9-20(10-12-22)21-13-25(28(37)33-15-26-34-23-3-1-2-4-24(23)35-26)39-27(14-21)38-17-19-7-5-18(16-36)6-8-19/h1-13,21,27,36H,14-17H2,(H,33,37)(H,34,35)/t21-,27+/m0/s1	BBIRKSILZBXBGJ-KDYSTLNUSA-N	OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)NCc3nc4ccccc4[nH]3)c5ccc(cc5)C(F)(F)F)cc1	BroadT	BRD-K58499307	BRD-K58499307-001-06-7	Harvard University	DHPC11_000169			OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)NCc2nc3ccccc3[nH]2)c2ccc(cc2)C(F)(F)F)cc1	InChI=1S/C29H26F3N3O4/c30-29(31,32)22-11-9-20(10-12-22)21-13-25(28(37)33-15-26-34-23-3-1-2-4-24(23)35-26)39-27(14-21)38-17-19-7-5-18(16-36)6-8-19/h1-13,21,27,36H,14-17H2,(H,33,37)(H,34,35)/t21-,27+/m0/s1	BBIRKSILZBXBGJ-KDYSTLNUSA-N	537.187540942							107303
MLS000091247	LSM-18658	SID4248552, BRD-K12347712	3242620	InChI=1S/C10H9N3O3/c1-7-6-12(16)13(11-7)9-4-2-8(3-5-9)10(14)15/h2-6H,1H3,(H,14,15)	UHIPOIZUICTQEI-UHFFFAOYSA-N	Cc1c[n+]([O-])n(n1)c2ccc(cc2)C(=O)O	BroadT	BRD-K12347712	BRD-K12347712-001-06-2	ChemDiv Inc.	C301-0648			Cc1c[n+]([O-])n(n1)-c1ccc(cc1)C(O)=O	InChI=1S/C10H9N3O3/c1-7-6-12(16)13(11-7)9-4-2-8(3-5-9)10(14)15/h2-6H,1H3,(H,14,15)	UHIPOIZUICTQEI-UHFFFAOYSA-N	219.064391178							107304
ST51019192	LSM-18659	SID17503939, BRD-K85718703	713338	InChI=1S/C17H16N4O2S/c1-9-3-4-11(7-10(9)2)15(22)21-17(24)18-12-5-6-13-14(8-12)20-16(23)19-13/h3-8H,1-2H3,(H2,19,20,23)(H2,18,21,22,24)	KWOOTWZPLPBULE-UHFFFAOYSA-N	Cc1ccc(cc1C)C(=O)NC(=S)Nc2ccc3[nH]c(O)nc3c2	BroadT	BRD-K85718703	BRD-K85718703-001-05-9	ChemDiv Inc.	3792-0399			Cc1ccc(cc1C)C(=O)NC(=S)Nc1ccc2[nH]c(O)nc2c1	InChI=1S/C17H16N4O2S/c1-9-3-4-11(7-10(9)2)15(22)21-17(24)18-12-5-6-13-14(8-12)20-16(23)19-13/h3-8H,1-2H3,(H2,19,20,23)(H2,18,21,22,24)	KWOOTWZPLPBULE-UHFFFAOYSA-N	340.099396482							107305
MLS000117793	LSM-18660	SID7967068, BRD-K72344935	5308605	InChI=1S/C20H17N3O4/c1-12-8-17(23(22-12)14-6-4-3-5-7-14)20(25)21-16-10-19-18(26-11-27-19)9-15(16)13(2)24/h3-10H,11H2,1-2H3,(H,21,25)	XXYVOHVTBJHXFJ-UHFFFAOYSA-N	CC(=O)c1cc2OCOc2cc1NC(=O)c3cc(C)nn3c4ccccc4	BroadT	BRD-K72344935	BRD-K72344935-001-04-2	ChemDiv Inc.	C532-1649			CC(=O)c1cc2OCOc2cc1NC(=O)c1cc(C)nn1-c1ccccc1	InChI=1S/C20H17N3O4/c1-12-8-17(23(22-12)14-6-4-3-5-7-14)20(25)21-16-10-19-18(26-11-27-19)9-15(16)13(2)24/h3-10H,11H2,1-2H3,(H,21,25)	XXYVOHVTBJHXFJ-UHFFFAOYSA-N	363.121906054							107306
T0507-7551	LSM-18661	SID24828643, BRD-K29385413	2344028	InChI=1S/C14H18N2O2S/c17-13(12-7-4-10-18-12)16-14(19)15-9-8-11-5-2-1-3-6-11/h4-5,7,10H,1-3,6,8-9H2,(H2,15,16,17,19)	NMPTXOFVGXIWRZ-UHFFFAOYSA-N	O=C(NC(=S)NCCC1=CCCCC1)c2occc2	BroadT	BRD-K29385413	BRD-K29385413-001-05-7	Enamine Ltd.	T0507-7551			O=C(NC(=S)NCCC1=CCCCC1)c1ccco1	InChI=1S/C14H18N2O2S/c17-13(12-7-4-10-18-12)16-14(19)15-9-8-11-5-2-1-3-6-11/h4-5,7,10H,1-3,6,8-9H2,(H2,15,16,17,19)	NMPTXOFVGXIWRZ-UHFFFAOYSA-N	278.108898526							107307
SMR000164057	LSM-18662	SID17387485, BRD-K21631125	1214563	InChI=1S/C23H17BrN2O3/c1-2-29-23(28)21-20(14-26(25-21)17-12-10-16(24)11-13-17)22(27)19-9-5-7-15-6-3-4-8-18(15)19/h3-14H,2H2,1H3	ZGEFYVLRNRIVJL-UHFFFAOYSA-N	CCOC(=O)c1nn(cc1C(=O)c2cccc3ccccc23)c4ccc(Br)cc4	BroadT	BRD-K21631125	BRD-K21631125-001-05-1	Specs	AJ-916/13002017			CCOC(=O)c1nn(cc1C(=O)c1cccc2ccccc12)-c1ccc(Br)cc1	InChI=1S/C23H17BrN2O3/c1-2-29-23(28)21-20(14-26(25-21)17-12-10-16(24)11-13-17)22(27)19-9-5-7-15-6-3-4-8-18(15)19/h3-14H,2H2,1H3	ZGEFYVLRNRIVJL-UHFFFAOYSA-N	448.042255024							107308
AC1LJLMN	LSM-15279	BRD-K06700239	976126	InChI=1S/C17H18BrNO/c18-16-6-3-7-17(12-16)20-11-10-19-9-8-14-4-1-2-5-15(14)13-19/h1-7,12H,8-11,13H2	BGVQTTPXHRMOIF-UHFFFAOYSA-N	Brc1cccc(OCCN2CCc3ccccc3C2)c1	BroadT	BRD-K06700239	BRD-K06700239-003-06-0	ChemBridge Corporation	7707646		Cl	Brc1cccc(OCCN2CCc3ccccc3C2)c1.Cl	InChI=1S/C17H18BrNO.ClH/c18-16-6-3-7-17(12-16)20-11-10-19-9-8-14-4-1-2-5-15(14)13-19;/h1-7,12H,8-11,13H2;1H	SALVKUUMGAVQED-UHFFFAOYSA-N	331.057176806							103926, 103926
AC1LFMJ2	LSM-18663	SID7977185, BRD-K40218785	756149	InChI=1S/C14H8ClFN2O/c15-11-5-1-9(2-6-11)13-17-18-14(19-13)10-3-7-12(16)8-4-10/h1-8H	VWMVJTUMOMXODY-UHFFFAOYSA-N	Fc1ccc(cc1)c2oc(nn2)c3ccc(Cl)cc3	BroadT	BRD-K40218785	BRD-K40218785-001-05-5	ChemBridge Corporation	5399273			Fc1ccc(cc1)-c1nnc(o1)-c1ccc(Cl)cc1	InChI=1S/C14H8ClFN2O/c15-11-5-1-9(2-6-11)13-17-18-14(19-13)10-3-7-12(16)8-4-10/h1-8H	VWMVJTUMOMXODY-UHFFFAOYSA-N	274.030918806							107309
MLS001162088	LSM-18664	SID49724692, BRD-K68370757	4935995	InChI=1S/C21H24N2O3/c1-16-9-11-17(12-10-16)26-15-20(24)22-19-8-4-3-7-18(19)21(25)23-13-5-2-6-14-23/h3-4,7-12H,2,5-6,13-15H2,1H3,(H,22,24)	XTYULOUDXLQUCZ-UHFFFAOYSA-N	Cc1ccc(OCC(=O)Nc2ccccc2C(=O)N3CCCCC3)cc1	BroadT	BRD-K68370757	BRD-K68370757-001-06-3	ChemBridge Corporation	9030570			Cc1ccc(OCC(=O)Nc2ccccc2C(=O)N2CCCCC2)cc1	InChI=1S/C21H24N2O3/c1-16-9-11-17(12-10-16)26-15-20(24)22-19-8-4-3-7-18(19)21(25)23-13-5-2-6-14-23/h3-4,7-12H,2,5-6,13-15H2,1H3,(H,22,24)	XTYULOUDXLQUCZ-UHFFFAOYSA-N	352.178692648							107310
MLS000390303	LSM-43787	SID22404338, BRD-K00663376	6027583	InChI=1S/C21H14F3N3O3/c1-12-9-18(26-30-12)25-11-17-15-7-2-3-8-16(15)19(28)27(20(17)29)14-6-4-5-13(10-14)21(22,23)24/h2-11H,1H3,(H,25,26)/b17-11+	FDYWWOBXWBUXPF-GZTJUZNOSA-N	Cc1onc(N\C=C/2\C(=O)N(C(=O)c3ccccc23)c4cccc(c4)C(F)(F)F)c1	BroadT	BRD-K00663376	BRD-K00663376-001-05-5	Enamine Ltd.	T0511-3481			Cc1cc(N\C=C2\C(=O)N(C(=O)c3ccccc23)c2cccc(c2)C(F)(F)F)no1	InChI=1S/C21H14F3N3O3/c1-12-9-18(26-30-12)25-11-17-15-7-2-3-8-16(15)19(28)27(20(17)29)14-6-4-5-13(10-14)21(22,23)24/h2-11H,1H3,(H,25,26)/b17-11+	FDYWWOBXWBUXPF-GZTJUZNOSA-N	413.098725938							
F0634-0453	LSM-18666	SID7971206, BRD-K09727345	4972751	InChI=1S/C20H23N5O4/c1-22-18-17(19(27)23(2)20(22)28)25(12-16(26)29-3)15(21-18)11-24-9-8-13-6-4-5-7-14(13)10-24/h4-7H,8-12H2,1-3H3	POERGFONJBBQSG-UHFFFAOYSA-N	COC(=O)Cn1c(CN2CCc3ccccc3C2)nc4N(C)C(=O)N(C)C(=O)c14	BroadT	BRD-K09727345	BRD-K09727345-001-05-7	Life Chemicals Inc.	F0634-0453			COC(=O)Cn1c(CN2CCc3ccccc3C2)nc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C20H23N5O4/c1-22-18-17(19(27)23(2)20(22)28)25(12-16(26)29-3)15(21-18)11-24-9-8-13-6-4-5-7-14(13)10-24/h4-7H,8-12H2,1-3H3	POERGFONJBBQSG-UHFFFAOYSA-N	397.175004266							107312
BAS 06335589	LSM-18667	SID7967915, SID853181, BRD-K95147379	655831	InChI=1S/C20H20N2O3/c1-13-5-4-10-21-20(13)22-19(23)12-24-14-8-9-18-16(11-14)15-6-2-3-7-17(15)25-18/h4-5,8-11H,2-3,6-7,12H2,1H3,(H,21,22,23)	WIGPXJAJZITWLJ-UHFFFAOYSA-N	Cc1cccnc1NC(=O)COc2ccc3oc4CCCCc4c3c2	BroadT	BRD-K95147379	BRD-K95147379-001-05-2	Asinex Ltd.	BAS 06335589			Cc1cccnc1NC(=O)COc1ccc2oc3CCCCc3c2c1	InChI=1S/C20H20N2O3/c1-13-5-4-10-21-20(13)22-19(23)12-24-14-8-9-18-16(11-14)15-6-2-3-7-17(15)25-18/h4-5,8-11H,2-3,6-7,12H2,1H3,(H,21,22,23)	WIGPXJAJZITWLJ-UHFFFAOYSA-N	336.14739252							107313
MLS000117274	LSM-18668	SID7968902, BRD-A29734053	5309663	InChI=1S/C22H20ClN3O2S/c1-2-28-16-9-7-15(8-10-16)25-13-26-21(27)11-18(17-5-3-4-6-20(17)23)19(12-24)22(26)29-14-25/h3-10,18H,2,11,13-14H2,1H3	NHRWFZXWMCOFCE-UHFFFAOYSA-N	CCOc1ccc(cc1)N2CSC3=C(C#N)C(CC(=O)N3C2)c4ccccc4Cl	BroadT	BRD-A29734053	BRD-A29734053-001-06-1	ChemDiv Inc.	C499-1007			CCOc1ccc(cc1)N1CSC2=C(C#N)C(CC(=O)N2C1)c1ccccc1Cl	InChI=1S/C22H20ClN3O2S/c1-2-28-16-9-7-15(8-10-16)25-13-26-21(27)11-18(17-5-3-4-6-20(17)23)19(12-24)22(26)29-14-25/h3-10,18H,2,11,13-14H2,1H3	NHRWFZXWMCOFCE-UHFFFAOYSA-N	425.09647531							107314
MLS000332708	LSM-18669	SID26663893, BRD-K00460925	3709524	InChI=1S/C13H16N6O3/c1-8-3-2-4-9(7-8)16-13-17-11(14)10(19(21)22)12(18-13)15-5-6-20/h2-4,7,20H,5-6H2,1H3,(H4,14,15,16,17,18)	SULPMJJSBUTHBD-UHFFFAOYSA-N	Cc1cccc(Nc2nc(N)c(c(NCCO)n2)[N+](=O)[O-])c1	BroadT	BRD-K00460925	BRD-K00460925-001-07-8	InterBioScreen Ltd.	STOCK4S-28217			Cc1cccc(Nc2nc(N)c(c(NCCO)n2)[N+]([O-])=O)c1	InChI=1S/C13H16N6O3/c1-8-3-2-4-9(7-8)16-13-17-11(14)10(19(21)22)12(18-13)15-5-6-20/h2-4,7,20H,5-6H2,1H3,(H4,14,15,16,17,18)	SULPMJJSBUTHBD-UHFFFAOYSA-N	304.128388432							107315
MLS000677517	LSM-18670	SID24792147, BRD-K58123928	710987	InChI=1S/C13H10N2S2/c1-2-4-10(5-3-1)8-17-13-11-6-7-16-12(11)14-9-15-13/h1-7,9H,8H2	GEIHZHQRXYKYAE-UHFFFAOYSA-N	C(Sc1ncnc2sccc12)c3ccccc3	BroadT	BRD-K58123928	BRD-K58123928-001-05-4	ChemBridge Corporation	7121769			C(Sc1ncnc2sccc12)c1ccccc1	InChI=1S/C13H10N2S2/c1-2-4-10(5-3-1)8-17-13-11-6-7-16-12(11)14-9-15-13/h1-7,9H,8H2	GEIHZHQRXYKYAE-UHFFFAOYSA-N	258.02853972							107316
AC1MGMH9	LSM-18671	SID47199408, BRD-A28524368	2988368	InChI=1S/C16H17BrN2O3/c1-10-8-11(2)19(18-10)14(16(21)22-3)9-15(20)12-4-6-13(17)7-5-12/h4-8,14H,9H2,1-3H3	YKYDBGXSDLKLOK-UHFFFAOYSA-N	COC(=O)C(CC(=O)c1ccc(Br)cc1)n2nc(C)cc2C	BroadT	BRD-A28524368	BRD-A28524368-001-05-9	ChemBridge Corporation	7999241			COC(=O)C(CC(=O)c1ccc(Br)cc1)n1nc(C)cc1C	InChI=1S/C16H17BrN2O3/c1-10-8-11(2)19(18-10)14(16(21)22-3)9-15(20)12-4-6-13(17)7-5-12/h4-8,14H,9H2,1-3H3	YKYDBGXSDLKLOK-UHFFFAOYSA-N	364.042255024							107317
MLS000050867	LSM-18672	SID4257662, BRD-K21515220	1890961	InChI=1S/C24H23N5O2S/c1-3-28-19-9-6-5-8-17(19)18-14-16(11-12-20(18)28)25-22(30)15-32-24-27-26-23(29(24)4-2)21-10-7-13-31-21/h5-14H,3-4,15H2,1-2H3,(H,25,30)	OKUUCTJPQJBHRR-UHFFFAOYSA-N	CCn1c(SCC(=O)Nc2ccc3c(c2)c4ccccc4n3CC)nnc1c5occc5	BroadT	BRD-K21515220	BRD-K21515220-001-05-0	ChemBridge Corporation	7909787			CCn1c(SCC(=O)Nc2ccc3n(CC)c4ccccc4c3c2)nnc1-c1ccco1	InChI=1S/C24H23N5O2S/c1-3-28-19-9-6-5-8-17(19)18-14-16(11-12-20(18)28)25-22(30)15-32-24-27-26-23(29(24)4-2)21-10-7-13-31-21/h5-14H,3-4,15H2,1-2H3,(H,25,30)	OKUUCTJPQJBHRR-UHFFFAOYSA-N	445.157245716							107318
ZINC00467698	LSM-18673	SID4259632, BRD-K28078576	891917	InChI=1S/C16H13N3O2S/c1-2-20-12-7-5-11(6-8-12)18-15-13(10-17)19-16(21-15)14-4-3-9-22-14/h3-9,18H,2H2,1H3	FMTSGSSQHGVHDZ-UHFFFAOYSA-N	CCOc1ccc(Nc2oc(nc2C#N)c3cccs3)cc1	BroadT	BRD-K28078576	BRD-K28078576-001-05-2	ChemBridge Corporation	7506709			CCOc1ccc(Nc2oc(nc2C#N)-c2cccs2)cc1	InChI=1S/C16H13N3O2S/c1-2-20-12-7-5-11(6-8-12)18-15-13(10-17)19-16(21-15)14-4-3-9-22-14/h3-9,18H,2H2,1H3	FMTSGSSQHGVHDZ-UHFFFAOYSA-N	311.072847376							107319
SMR000022429	LSM-18674	SID4245197, BRD-K29034888	3239695	InChI=1S/C23H24N4O3/c1-30-20-9-5-4-8-19(20)26-22-17-7-3-2-6-16(17)18(14-25-22)23(29)27-12-10-15(11-13-27)21(24)28/h2-9,14-15H,10-13H2,1H3,(H2,24,28)(H,25,26)	PIPLFSRYSOVDPO-UHFFFAOYSA-N	COc1ccccc1Nc2ncc(C(=O)N3CCC(CC3)C(=O)N)c4ccccc24	BroadT	BRD-K29034888	BRD-K29034888-001-04-0	ChemDiv Inc.	C138-0775			COc1ccccc1Nc1ncc(C(=O)N2CCC(CC2)C(N)=O)c2ccccc12	InChI=1S/C23H24N4O3/c1-30-20-9-5-4-8-19(20)26-22-17-7-3-2-6-16(17)18(14-25-22)23(29)27-12-10-15(11-13-27)21(24)28/h2-9,14-15H,10-13H2,1H3,(H2,24,28)(H,25,26)	PIPLFSRYSOVDPO-UHFFFAOYSA-N	404.184840668							107320
MLS000780045	LSM-18675	BRD-K68457497	778465	InChI=1S/C7H13N3S/c1-5-4-7(2,3)10(9-5)6(8)11/h4H2,1-3H3,(H2,8,11)	GQAFTAYUUOBTRK-UHFFFAOYSA-N	CC1=NN(C(=N)S)C(C)(C)C1	BroadT	BRD-K68457497	BRD-K68457497-001-06-3	InterBioScreen Ltd.	STOCK1S-52686			CC1=NN(C(S)=N)C(C)(C)C1	InChI=1S/C7H13N3S/c1-5-4-7(2,3)10(9-5)6(8)11/h4H2,1-3H3,(H2,8,11)	GQAFTAYUUOBTRK-UHFFFAOYSA-N	171.083018136							107321
CHEMBL1290401	LSM-18676	SID17511861, BRD-K50973412	1910342	InChI=1S/C24H15FO4/c1-27-21-8-7-15(9-20(21)25)19-13-28-22-12-23-17(10-18(19)22)16(11-24(26)29-23)14-5-3-2-4-6-14/h2-13H,1H3	XICOFRVOBQTUQL-UHFFFAOYSA-N	COc1ccc(cc1F)c2coc3cc4OC(=O)C=C(c5ccccc5)c4cc23	BroadT	BRD-K50973412	BRD-K50973412-001-05-3	InterBioScreen Ltd.	STOCK1S-88571			COc1ccc(cc1F)-c1coc2cc3oc(=O)cc(-c4ccccc4)c3cc12	InChI=1S/C24H15FO4/c1-27-21-8-7-15(9-20(21)25)19-13-28-22-12-23-17(10-18(19)22)16(11-24(26)29-23)14-5-3-2-4-6-14/h2-13H,1H3	XICOFRVOBQTUQL-UHFFFAOYSA-N	386.09543716							107322
2-Piperidinophenyl 4-(acetylamino)benzenesulfonate	LSM-18677	SID26728681, BRD-K20267824	2812557	InChI=1S/C19H22N2O4S/c1-15(22)20-16-9-11-17(12-10-16)26(23,24)25-19-8-4-3-7-18(19)21-13-5-2-6-14-21/h3-4,7-12H,2,5-6,13-14H2,1H3,(H,20,22)	YKTZHRNETIQRCP-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)S(=O)(=O)Oc2ccccc2N3CCCCC3	BroadT	BRD-K20267824	BRD-K20267824-001-05-9	Maybridge	HTS 05627			CC(=O)Nc1ccc(cc1)S(=O)(=O)Oc1ccccc1N1CCCCC1	InChI=1S/C19H22N2O4S/c1-15(22)20-16-9-11-17(12-10-16)26(23,24)25-19-8-4-3-7-18(19)21-13-5-2-6-14-21/h3-4,7-12H,2,5-6,13-14H2,1H3,(H,20,22)	YKTZHRNETIQRCP-UHFFFAOYSA-N	374.130027894							107323
AC1M4U5H	LSM-18678	BRD-K38924818	2267084	InChI=1S/C15H16N4O3S/c1-11-6-8-13(9-7-11)23(20,21)22-14-5-3-2-4-12(14)10-18-19-15(16)17/h2-10H,1H3,(H4,16,17,19)	KCHFGJOXPLWNIY-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)Oc2ccccc2C=NN=C(N)N	BroadT	BRD-K38924818	BRD-K38924818-001-11-1	ChemBridge Corporation	6070709			Cc1ccc(cc1)S(=O)(=O)Oc1ccccc1C=NN=C(N)N	InChI=1S/C15H16N4O3S/c1-11-6-8-13(9-7-11)23(20,21)22-14-5-3-2-4-12(14)10-18-19-15(16)17/h2-10H,1H3,(H4,16,17,19)	KCHFGJOXPLWNIY-UHFFFAOYSA-N	332.094311102							107324
AC1NWVAQ	LSM-43788	SID26730459, BRD-A10482588	5713290	InChI=1S/C23H18O3/c1-25-18-13-11-16(12-14-18)15-20-22(24)19-9-5-6-10-21(19)26-23(20)17-7-3-2-4-8-17/h2-15,23H,1H3/b20-15+	LBUIGFCPSGJSAD-HMMYKYKNSA-N	COc1ccc(\C=C/2\C(Oc3ccccc3C2=O)c4ccccc4)cc1	BroadT	BRD-A10482588	BRD-A10482588-001-07-0	Maybridge	BTB 13256			COc1ccc(\C=C2\C(Oc3ccccc3C2=O)c2ccccc2)cc1	InChI=1S/C23H18O3/c1-25-18-13-11-16(12-14-18)15-20-22(24)19-9-5-6-10-21(19)26-23(20)17-7-3-2-4-8-17/h2-15,23H,1H3/b20-15+	LBUIGFCPSGJSAD-HMMYKYKNSA-N	342.125594436							
1-Benzyl-3-(ethylcarbamothioylamino)thiourea	LSM-18680	SID22404970, SID56373523, SID56373717, BRD-K67708305	1825238	InChI=1S/C11H16N4S2/c1-2-12-10(16)14-15-11(17)13-8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,12,14,16)(H2,13,15,17)	HNVKQXJBINMTGG-UHFFFAOYSA-N	CCN=C(S)NN=C(S)NCc1ccccc1	BroadT	BRD-K67708305	BRD-K67708305-001-05-4	Specs	AG-205/40776280			CCN=C(S)NN=C(S)NCc1ccccc1	InChI=1S/C11H16N4S2/c1-2-12-10(16)14-15-11(17)13-8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,12,14,16)(H2,13,15,17)	HNVKQXJBINMTGG-UHFFFAOYSA-N	268.081637932							107326
AC1MG2BM	LSM-18681	SID49816594, BRD-A80753229	2954395	InChI=1S/C19H18N4O7S/c1-12-2-8-15(9-3-12)31(28,29)22-16(10-11-17(22)24)19(25)30-21-18(20)13-4-6-14(7-5-13)23(26)27/h2-9,16H,10-11H2,1H3,(H2,20,21)	GUHSSAKFHUPPEL-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N2C(CCC2=O)C(=O)ONC(=N)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-A80753229	BRD-A80753229-001-05-8	ChemBridge Corporation	7785576			Cc1ccc(cc1)S(=O)(=O)N1C(CCC1=O)C(=O)ONC(=N)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C19H18N4O7S/c1-12-2-8-15(9-3-12)31(28,29)22-16(10-11-17(22)24)19(25)30-21-18(20)13-4-6-14(7-5-13)23(26)27/h2-9,16H,10-11H2,1H3,(H2,20,21)	GUHSSAKFHUPPEL-UHFFFAOYSA-N	446.089619646							107327
AC1MRWAF	LSM-18682	BRD-K64297007	3474998	InChI=1S/C24H24N4O5/c1-4-6-11-27-20-16(23(30)28-12-7-9-15(3)19(28)25-20)14-17(24(31)32-5-2)21(27)26-22(29)18-10-8-13-33-18/h7-10,12-14H,4-6,11H2,1-3H3	HVAKRZXYPOCFJG-UHFFFAOYSA-N	CCCCN1C2=C(C=C(C(=O)OCC)C1=NC(=O)c3occc3)C(=O)N4C=CC=C(C)C4=N2	BroadT	BRD-K64297007	BRD-K64297007-001-05-2	InterBioScreen Ltd.	STOCK4S-38023			CCCCn1c2nc3c(C)cccn3c(=O)c2cc(C(=O)OCC)c1=NC(=O)c1ccco1	InChI=1S/C24H24N4O5/c1-4-6-11-27-20-16(23(30)28-12-7-9-15(3)19(28)25-20)14-17(24(31)32-5-2)21(27)26-22(29)18-10-8-13-33-18/h7-10,12-14H,4-6,11H2,1-3H3	HVAKRZXYPOCFJG-UHFFFAOYSA-N	448.174669908							107328
F0630-0211	LSM-18683	SID7965848, BRD-K21443386	4338529	InChI=1S/C18H16N2O3S/c21-17(14-6-7-15-16(10-14)23-12-22-15)20-9-8-19-18(20)24-11-13-4-2-1-3-5-13/h1-7,10H,8-9,11-12H2	IDOWHJAEOZFCIO-UHFFFAOYSA-N	O=C(N1CCN=C1SCc2ccccc2)c3ccc4OCOc4c3	BroadT	BRD-K21443386	BRD-K21443386-001-05-5	ChemDiv Inc.	C441-0105			O=C(N1CCN=C1SCc1ccccc1)c1ccc2OCOc2c1	InChI=1S/C18H16N2O3S/c21-17(14-6-7-15-16(10-14)23-12-22-15)20-9-8-19-18(20)24-11-13-4-2-1-3-5-13/h1-7,10H,8-9,11-12H2	IDOWHJAEOZFCIO-UHFFFAOYSA-N	340.088163082							107329
ST50882342	LSM-18684	SID49827457, BRD-K13769064	6464877	InChI=1S/C17H21ClN4O2/c1-3-24-15-7-5-4-6-14(15)21-8-10-22(11-9-21)17(23)16-13(18)12-19-20(16)2/h4-7,12H,3,8-11H2,1-2H3	LVRVDCYFXLCHOZ-UHFFFAOYSA-N	CCOc1ccccc1N2CCN(CC2)C(=O)c3c(Cl)cnn3C	BroadT	BRD-K13769064	BRD-K13769064-001-05-2	ChemBridge Corporation	9043349			CCOc1ccccc1N1CCN(CC1)C(=O)c1c(Cl)cnn1C	InChI=1S/C17H21ClN4O2/c1-3-24-15-7-5-4-6-14(15)21-8-10-22(11-9-21)17(23)16-13(18)12-19-20(16)2/h4-7,12H,3,8-11H2,1-2H3	LVRVDCYFXLCHOZ-UHFFFAOYSA-N	348.135303662							107330
MLS000766488	LSM-18685	SID24825226, BRD-K08747234	16195883	InChI=1S/C33H34N2O4S/c36-21-25-10-12-26(13-11-25)22-38-32-19-27(29-23-40-31-9-5-4-8-28(29)31)18-30(39-32)33(37)35-16-14-34(15-17-35)20-24-6-2-1-3-7-24/h1-13,18,23,27,32,36H,14-17,19-22H2/t27-,32+/m1/s1	PTTHOVHGPPERMY-ZUKKLESISA-N	OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5csc6ccccc56)cc1	BroadT	BRD-K08747234	BRD-K08747234-001-07-6	Harvard University	((2S,4S)-4-(benzo[b]thiophen-3-yl)-2-(4-(hydroxymethyl)benzyloxy)-3,4-dihydro-2H-pyran-6-yl)(4-benzylpiperazin-1-yl)methanone DHPC11_001342			OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N2CCN(Cc3ccccc3)CC2)c2csc3ccccc23)cc1	InChI=1S/C33H34N2O4S/c36-21-25-10-12-26(13-11-25)22-38-32-19-27(29-23-40-31-9-5-4-8-28(29)31)18-30(39-32)33(37)35-16-14-34(15-17-35)20-24-6-2-1-3-7-24/h1-13,18,23,27,32,36H,14-17,19-22H2/t27-,32+/m1/s1	PTTHOVHGPPERMY-ZUKKLESISA-N	554.223928278							107331
SMR000004787	LSM-18686	SID26667885, SID846824, BRD-A20210464	649217	InChI=1S/C27H28N8S/c1-2-8-21(7-1)35-26(30-31-32-35)25(20-11-12-22-19(18-20)6-5-13-28-22)33-14-16-34(17-15-33)27-29-23-9-3-4-10-24(23)36-27/h3-6,9-13,18,21,25H,1-2,7-8,14-17H2	HHHPYTHYAAQJDO-UHFFFAOYSA-N	C1CCC(C1)n2nnnc2C(N3CCN(CC3)c4nc5ccccc5s4)c6ccc7ncccc7c6	BroadT	BRD-A20210464	BRD-A20210464-001-06-4	Asinex Ltd.	ASN 05542144			C1CCC(C1)n1nnnc1C(N1CCN(CC1)c1nc2ccccc2s1)c1ccc2ncccc2c1	InChI=1S/C27H28N8S/c1-2-8-21(7-1)35-26(30-31-32-35)25(20-11-12-22-19(18-20)6-5-13-28-22)33-14-16-34(17-15-33)27-29-23-9-3-4-10-24(23)36-27/h3-6,9-13,18,21,25H,1-2,7-8,14-17H2	HHHPYTHYAAQJDO-UHFFFAOYSA-N	496.215763666							107332
MLS000325494	LSM-18687	SID17409656, BRD-K11212637	1480206	InChI=1S/C17H8Cl2F3N5S/c18-11-3-1-9(2-4-11)13-5-6-23-15-25-16(26-27(13)15)28-14-12(19)7-10(8-24-14)17(20,21)22/h1-8H	JLLFVMCZYYQSHT-UHFFFAOYSA-N	FC(F)(F)c1cnc(Sc2nc3nccc(c4ccc(Cl)cc4)n3n2)c(Cl)c1	BroadT	BRD-K11212637	BRD-K11212637-001-07-9	Key Organics Ltd.	10G-033			FC(F)(F)c1cnc(Sc2nc3nccc(-c4ccc(Cl)cc4)n3n2)c(Cl)c1	InChI=1S/C17H8Cl2F3N5S/c18-11-3-1-9(2-4-11)13-5-6-23-15-25-16(26-27(13)15)28-14-12(19)7-10(8-24-14)17(20,21)22/h1-8H	JLLFVMCZYYQSHT-UHFFFAOYSA-N	440.982956016							107333
AC1LWL68	LSM-18688	BRD-K26967404	1778397	InChI=1S/C19H23N3O3S/c1-3-5-12-24-18(23)15-8-6-14(7-9-15)17-11-10-16(25-17)13-21-22-19(26)20-4-2/h6-11,13H,3-5,12H2,1-2H3,(H2,20,22,26)	FYDGZWFQEMOMFQ-UHFFFAOYSA-N	CCCCOC(=O)c1ccc(cc1)c2oc(C=NN=C(S)NCC)cc2	BroadT	BRD-K26967404	BRD-K26967404-001-05-6	Specs	AM-879/41890896			CCCCOC(=O)c1ccc(cc1)-c1ccc(C=NN=C(S)NCC)o1	InChI=1S/C19H23N3O3S/c1-3-5-12-24-18(23)15-8-6-14(7-9-15)17-11-10-16(25-17)13-21-22-19(26)20-4-2/h6-11,13H,3-5,12H2,1-2H3,(H2,20,22,26)	FYDGZWFQEMOMFQ-UHFFFAOYSA-N	373.146012316							107334
AC1O9JGF	LSM-18689	SID17401576, SID56373721, BRD-K63601816	6759952	InChI=1S/C17H14N6O2/c1-25-14-8-4-5-11(15(14)24)9-18-20-16-12-6-2-3-7-13(12)17-21-19-10-23(17)22-16/h2-10,24H,1H3,(H,20,22)	WDHBIANOOALAIX-UHFFFAOYSA-N	COc1cccc(C=NNc2nn3cnnc3c4ccccc24)c1O	BroadT	BRD-K63601816	BRD-K63601816-001-05-7	InterBioScreen Ltd.	STOCK2S-79937			COc1cccc(C=NNc2nn3cnnc3c3ccccc23)c1O	InChI=1S/C17H14N6O2/c1-25-14-8-4-5-11(15(14)24)9-18-20-16-12-6-2-3-7-13(12)17-21-19-10-23(17)22-16/h2-10,24H,1H3,(H,20,22)	WDHBIANOOALAIX-UHFFFAOYSA-N	334.117823748							
MLS000575863	LSM-18690	SID17415538, BRD-K60040181	3774739	InChI=1S/C18H22N4O4/c1-5-26-12-7-6-11(8-13(12)25-4)16(14-9(2)19-21-17(14)23)15-10(3)20-22-18(15)24/h6-8,16H,5H2,1-4H3,(H2,19,21,23)(H2,20,22,24)	MFRHFEWSEQENDR-UHFFFAOYSA-N	CCOc1ccc(cc1OC)C(c2c(C)n[nH]c2O)c3c(C)n[nH]c3O	BroadT	BRD-K60040181	BRD-K60040181-001-06-6	ChemBridge Corporation	6983306			CCOc1ccc(cc1OC)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O	InChI=1S/C18H22N4O4/c1-5-26-12-7-6-11(8-13(12)25-4)16(14-9(2)19-21-17(14)23)15-10(3)20-22-18(15)24/h6-8,16H,5H2,1-4H3,(H2,19,21,23)(H2,20,22,24)	MFRHFEWSEQENDR-UHFFFAOYSA-N	358.164105224							107336
ZINC01196540	LSM-18691	SID7978448, BRD-K28589337	1356021	InChI=1S/C19H19N3O4S2/c1-13-20-17-7-4-15(12-18(17)27-13)21-19(23)14-2-5-16(6-3-14)28(24,25)22-8-10-26-11-9-22/h2-7,12H,8-11H2,1H3,(H,21,23)	NKHFFJNTSKMUAN-UHFFFAOYSA-N	Cc1nc2ccc(NC(=O)c3ccc(cc3)S(=O)(=O)N4CCOCC4)cc2s1	BroadT	BRD-K28589337	BRD-K28589337-001-06-6	ChemBridge Corporation	5918577			Cc1nc2ccc(NC(=O)c3ccc(cc3)S(=O)(=O)N3CCOCC3)cc2s1	InChI=1S/C19H19N3O4S2/c1-13-20-17-7-4-15(12-18(17)27-13)21-19(23)14-2-5-16(6-3-14)28(24,25)22-8-10-26-11-9-22/h2-7,12H,8-11H2,1H3,(H,21,23)	NKHFFJNTSKMUAN-UHFFFAOYSA-N	417.081697498							107337
SMR000132085	LSM-18692	SID14737599, BRD-K40110596	9551082	InChI=1S/C20H23FN4O2/c1-12(2)8-9-22-19(26)16-11-23-25-18(16)24-13(3)15(20(25)27)10-14-6-4-5-7-17(14)21/h4-7,11-12,27H,8-10H2,1-3H3,(H,22,26)	ZRXHJPHGYAJOIF-UHFFFAOYSA-N	CC(C)CCNC(=O)c1cnn2c(O)c(Cc3ccccc3F)c(C)nc12	BroadT	BRD-K40110596	BRD-K40110596-001-06-1	ChemDiv Inc.	C218-0295			CC(C)CCNC(=O)c1cnn2c(O)c(Cc3ccccc3F)c(C)nc12	InChI=1S/C20H23FN4O2/c1-12(2)8-9-22-19(26)16-11-23-25-18(16)24-13(3)15(20(25)27)10-14-6-4-5-7-17(14)21/h4-7,11-12,27H,8-10H2,1-3H3,(H,22,26)	ZRXHJPHGYAJOIF-UHFFFAOYSA-N	370.180504216							
MLS001203360	LSM-18693	SID47201473, BRD-K41620508	773463	InChI=1S/C19H22N2OS/c1-13(2)15-12-14(3)8-9-18(15)22-11-10-21-17-7-5-4-6-16(17)20-19(21)23/h4-9,12-13H,10-11H2,1-3H3,(H,20,23)	ZDYAAMWLXNIXQT-UHFFFAOYSA-N	CC(C)c1cc(C)ccc1OCCn2c(S)nc3ccccc23	BroadT	BRD-K41620508	BRD-K41620508-001-06-5	Asinex Ltd.	BAS 00693465			CC(C)c1cc(C)ccc1OCCn1c(S)nc2ccccc12	InChI=1S/C19H22N2OS/c1-13(2)15-12-14(3)8-9-18(15)22-11-10-21-17-7-5-4-6-16(17)20-19(21)23/h4-9,12-13H,10-11H2,1-3H3,(H,20,23)	ZDYAAMWLXNIXQT-UHFFFAOYSA-N	326.145284034							107339
MLS000102135	LSM-18694	SID26669764, BRD-K85771899	4063939	InChI=1S/C16H15BrN2O2/c1-10-7-12-8-11(3-4-13(12)19(10)2)9-18-16(20)14-5-6-15(17)21-14/h3-8H,9H2,1-2H3,(H,18,20)	VLWUKKOYMKMSNY-UHFFFAOYSA-N	Cc1cc2cc(CNC(=O)c3oc(Br)cc3)ccc2n1C	BroadT	BRD-K85771899	BRD-K85771899-001-05-2	Life Chemicals Inc.	F0651-0236			Cc1cc2cc(CNC(=O)c3ccc(Br)o3)ccc2n1C	InChI=1S/C16H15BrN2O2/c1-10-7-12-8-11(3-4-13(12)19(10)2)9-18-16(20)14-5-6-15(17)21-14/h3-8H,9H2,1-2H3,(H,18,20)	VLWUKKOYMKMSNY-UHFFFAOYSA-N	346.03169034							107340
STK346099	LSM-18695	SID17403483, BRD-K75066978	779699	InChI=1S/C19H15NO3S/c21-16(14-6-2-1-3-7-14)12-23-18(22)13-24-17-10-4-8-15-9-5-11-20-19(15)17/h1-11H,12-13H2	WQUDGLWZETZHQW-UHFFFAOYSA-N	O=C(CSc1cccc2cccnc12)OCC(=O)c3ccccc3	BroadT	BRD-K75066978	BRD-K75066978-001-05-3	Asinex Ltd.	BAS 01053251			O=C(CSc1cccc2cccnc12)OCC(=O)c1ccccc1	InChI=1S/C19H15NO3S/c21-16(14-6-2-1-3-7-14)12-23-18(22)13-24-17-10-4-8-15-9-5-11-20-19(15)17/h1-11H,12-13H2	WQUDGLWZETZHQW-UHFFFAOYSA-N	337.07726404							107341
MLS000571789	LSM-18696	SID17413504, BRD-K23905225	878013	InChI=1S/C14H9ClN2O2S2/c15-11-4-2-1-3-9(11)8-20-14-16-12-6-5-10(17(18)19)7-13(12)21-14/h1-7H,8H2	KLODEQXVTMWOOZ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2nc(SCc3ccccc3Cl)sc2c1	BroadT	BRD-K23905225	BRD-K23905225-001-05-6	ChemBridge Corporation	6001464			[O-][N+](=O)c1ccc2nc(SCc3ccccc3Cl)sc2c1	InChI=1S/C14H9ClN2O2S2/c15-11-4-2-1-3-9(11)8-20-14-16-12-6-5-10(17(18)19)7-13(12)21-14/h1-7H,8H2	KLODEQXVTMWOOZ-UHFFFAOYSA-N	335.979396638							107342
N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamide	LSM-18697	BRD-K66831217	1304709	InChI=1S/C18H17N3O4S/c1-23-12-3-4-13-14(9-12)21-18(20-13)26-10-17(22)19-11-2-5-15-16(8-11)25-7-6-24-15/h2-5,8-9H,6-7,10H2,1H3,(H,19,22)(H,20,21)	UDKHFRSECDGNEQ-UHFFFAOYSA-N	COc1ccc2[nH]c(SCC(=O)Nc3ccc4OCCOc4c3)nc2c1	BroadT	BRD-K66831217	BRD-K66831217-001-06-0	ChemDiv Inc.	K781-1090			COc1ccc2[nH]c(SCC(=O)Nc3ccc4OCCOc4c3)nc2c1	InChI=1S/C18H17N3O4S/c1-23-12-3-4-13-14(9-12)21-18(20-13)26-10-17(22)19-11-2-5-15-16(8-11)25-7-6-24-15/h2-5,8-9H,6-7,10H2,1H3,(H,19,22)(H,20,21)	UDKHFRSECDGNEQ-UHFFFAOYSA-N	371.093976744							107343
SMR000206289	LSM-18698	SID17510487, BRD-K71365670	12005219	InChI=1S/C22H20N2O2S/c1-2-6-18-17-8-3-4-9-20(17)27-21-11-10-15(13-19(21)24-18)22(25)23-14-16-7-5-12-26-16/h3-5,7-13H,2,6,14H2,1H3,(H,23,25)	CASKODLSBWDLAY-UHFFFAOYSA-N	CCCC1=Nc2cc(ccc2Sc3ccccc13)C(=O)NCc4occc4	BroadT	BRD-K71365670	BRD-K71365670-001-06-2	ChemDiv Inc.	C304-0372			CCCC1=Nc2cc(ccc2Sc2ccccc12)C(=O)NCc1ccco1	InChI=1S/C22H20N2O2S/c1-2-6-18-17-8-3-4-9-20(17)27-21-11-10-15(13-19(21)24-18)22(25)23-14-16-7-5-12-26-16/h3-5,7-13H,2,6,14H2,1H3,(H,23,25)	CASKODLSBWDLAY-UHFFFAOYSA-N	376.12454859							107344
Methyl 4-[2-(3-methoxyphenyl)-2-oxoethoxy]benzoate	LSM-18699	SID22416941, BRD-K71875073	896959	InChI=1S/C17H16O5/c1-20-15-5-3-4-13(10-15)16(18)11-22-14-8-6-12(7-9-14)17(19)21-2/h3-10H,11H2,1-2H3	JAIZEZAFQYOPNF-UHFFFAOYSA-N	COC(=O)c1ccc(OCC(=O)c2cccc(OC)c2)cc1	BroadT	BRD-K71875073	BRD-K71875073-001-05-5	ChemBridge Corporation	7242244			COC(=O)c1ccc(OCC(=O)c2cccc(OC)c2)cc1	InChI=1S/C17H16O5/c1-20-15-5-3-4-13(10-15)16(18)11-22-14-8-6-12(7-9-14)17(19)21-2/h3-10H,11H2,1-2H3	JAIZEZAFQYOPNF-UHFFFAOYSA-N	300.099773612							107345
SMR000109236	LSM-18700	SID26668906, SID7975925, BRD-K11572636	1072880	InChI=1S/C26H25N7O3/c1-2-36-26(35)33-15-13-32(14-16-33)25(34)29-18-9-10-19-22(17-18)31-24(21-8-4-6-12-28-21)23(30-19)20-7-3-5-11-27-20/h3-12,17H,2,13-16H2,1H3,(H,29,34)	NCMHKURODCFHNF-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)Nc2ccc3nc(c4ccccn4)c(nc3c2)c5ccccn5	BroadT	BRD-K11572636	BRD-K11572636-001-05-1	ChemBridge Corporation	7078040			CCOC(=O)N1CCN(CC1)C(=O)Nc1ccc2nc(-c3ccccn3)c(nc2c1)-c1ccccn1	InChI=1S/C26H25N7O3/c1-2-36-26(35)33-15-13-32(14-16-33)25(34)29-18-9-10-19-22(17-18)31-24(21-8-4-6-12-28-21)23(30-19)20-7-3-5-11-27-20/h3-12,17H,2,13-16H2,1H3,(H,29,34)	NCMHKURODCFHNF-UHFFFAOYSA-N	483.20188773							107346
AK-968/12269460	LSM-18701	SID14727704, BRD-A45105722	5013637	InChI=1S/C21H20ClN3O3S/c1-10-7-8-13-15(9-10)29-21(17(13)19(23)26)24-20(27)16-11(2)28-25-18(16)12-5-3-4-6-14(12)22/h3-6,10H,7-9H2,1-2H3,(H2,23,26)(H,24,27)	PSHNNPOXZYOMBJ-UHFFFAOYSA-N	CC1CCc2c(C1)sc(NC(=O)c3c(C)onc3c4ccccc4Cl)c2C(=O)N	BroadT	BRD-A45105722	BRD-A45105722-001-05-7	Specs	AK-968/12269460			CC1CCc2c(C1)sc(NC(=O)c1c(C)onc1-c1ccccc1Cl)c2C(N)=O	InChI=1S/C21H20ClN3O3S/c1-10-7-8-13-15(9-10)29-21(17(13)19(23)26)24-20(27)16-11(2)28-25-18(16)12-5-3-4-6-14(12)22/h3-6,10H,7-9H2,1-2H3,(H2,23,26)(H,24,27)	PSHNNPOXZYOMBJ-UHFFFAOYSA-N	429.09138993							107347
F0214-0064	LSM-18702	SID4245444, BRD-K17613812	3239915	InChI=1S/C13H8BrNO2S2/c14-11-6-5-10(18-11)13(16)17-7-12-15-8-3-1-2-4-9(8)19-12/h1-6H,7H2	QCJNVVVGENRLKK-UHFFFAOYSA-N	Brc1ccc(s1)C(=O)OCc2nc3ccccc3s2	BroadT	BRD-K17613812	BRD-K17613812-001-05-3	ChemDiv Inc.	2292-0655			Brc1ccc(s1)C(=O)OCc1nc2ccccc2s1	InChI=1S/C13H8BrNO2S2/c14-11-6-5-10(18-11)13(16)17-7-12-15-8-3-1-2-4-9(8)19-12/h1-6H,7H2	QCJNVVVGENRLKK-UHFFFAOYSA-N	352.917982486							107348
MLS000539683	LSM-18703	SID17408800, BRD-K07314686	4240836	InChI=1S/C28H25N5O2/c1-16-24(27(34)31-29-16)26(25-17(2)30-32-28(25)35)22-15-33(23-13-6-5-12-21(22)23)14-19-10-7-9-18-8-3-4-11-20(18)19/h3-13,15,26H,14H2,1-2H3,(H2,29,31,34)(H2,30,32,35)	IEDDUUCBRAGPHC-UHFFFAOYSA-N	Cc1n[nH]c(O)c1C(c2cn(Cc3cccc4ccccc34)c5ccccc25)c6c(C)n[nH]c6O	BroadT	BRD-K07314686	BRD-K07314686-001-05-3	Specs	AN-698/42027015			Cc1n[nH]c(O)c1C(c1cn(Cc2cccc3ccccc23)c2ccccc12)c1c(C)n[nH]c1O	InChI=1S/C28H25N5O2/c1-16-24(27(34)31-29-16)26(25-17(2)30-32-28(25)35)22-15-33(23-13-6-5-12-21(22)23)14-19-10-7-9-18-8-3-4-11-20(18)19/h3-13,15,26H,14H2,1-2H3,(H2,29,31,34)(H2,30,32,35)	IEDDUUCBRAGPHC-UHFFFAOYSA-N	463.20082509							107349
SMR000041479	LSM-18704	SID50102594, SID859403, SID87345860, BRD-K45719148	660699	InChI=1S/C21H17N5OS2/c22-11-15-19(17-7-4-10-28-17)16(12-23)21(26-20(15)24)29-13-18(27)25-9-8-14-5-2-1-3-6-14/h1-7,10H,8-9,13H2,(H2,24,26)(H,25,27)	SJUCPKDGHIEMPP-UHFFFAOYSA-N	Nc1nc(SCC(=O)NCCc2ccccc2)c(C#N)c(c3cccs3)c1C#N	BroadT	BRD-K45719148	BRD-K45719148-001-06-7	InterBioScreen Ltd.	STOCK3S-10753			Nc1nc(SCC(=O)NCCc2ccccc2)c(C#N)c(-c2cccs2)c1C#N	InChI=1S/C21H17N5OS2/c22-11-15-19(17-7-4-10-28-17)16(12-23)21(26-20(15)24)29-13-18(27)25-9-8-14-5-2-1-3-6-14/h1-7,10H,8-9,13H2,(H2,24,26)(H,25,27)	SJUCPKDGHIEMPP-UHFFFAOYSA-N	419.087451594							107350
AC1MUXHA	LSM-18705	BRD-K35101029	3648503	InChI=1S/C17H14N2O5/c1-10(11-2-4-13-15(6-11)23-8-21-13)18-19-17(20)12-3-5-14-16(7-12)24-9-22-14/h2-7H,8-9H2,1H3,(H,19,20)	PYQWSUQYZGASHS-UHFFFAOYSA-N	CC(=NNC(=O)c1ccc2OCOc2c1)c3ccc4OCOc4c3	BroadT	BRD-K35101029	BRD-K35101029-001-05-6	Enamine Ltd.	T5282033			CC(=NNC(=O)c1ccc2OCOc2c1)c1ccc2OCOc2c1	InChI=1S/C17H14N2O5/c1-10(11-2-4-13-15(6-11)23-8-21-13)18-19-17(20)12-3-5-14-16(7-12)24-9-22-14/h2-7H,8-9H2,1H3,(H,19,20)	PYQWSUQYZGASHS-UHFFFAOYSA-N	326.090271568							107351
ZINC01098788	LSM-18706	SID24791284, BRD-K21965571	1280196	InChI=1S/C19H14N4O3S/c1-11-6-7-12(18-22-16-14(26-18)4-2-8-20-16)10-13(11)21-19(27)23-17(24)15-5-3-9-25-15/h2-10H,1H3,(H2,21,23,24,27)	FONMYXFCXOYTLI-UHFFFAOYSA-N	Cc1ccc(cc1NC(=S)NC(=O)c2occc2)c3oc4cccnc4n3	BroadT	BRD-K21965571	BRD-K21965571-001-05-2	ChemBridge Corporation	7535495			Cc1ccc(cc1NC(=S)NC(=O)c1ccco1)-c1nc2ncccc2o1	InChI=1S/C19H14N4O3S/c1-11-6-7-12(18-22-16-14(26-18)4-2-8-20-16)10-13(11)21-19(27)23-17(24)15-5-3-9-25-15/h2-10H,1H3,(H2,21,23,24,27)	FONMYXFCXOYTLI-UHFFFAOYSA-N	378.078661038							107352
MLS000324601	LSM-18707	SID87225777, SID17386520, BRD-K36785552	1214670	InChI=1S/C19H15BrN4/c1-12-6-8-16(9-7-12)24-11-17-18(23-24)13(2)21-22-19(17)14-4-3-5-15(20)10-14/h3-11H,1-2H3	NUKHSIDVEMUYCP-UHFFFAOYSA-N	Cc1ccc(cc1)n2cc3c(nnc(C)c3n2)c4cccc(Br)c4	BroadT	BRD-K36785552	BRD-K36785552-001-06-8	Specs	AJ-916/40989366			Cc1ccc(cc1)-n1cc2c(nnc(C)c2n1)-c1cccc(Br)c1	InChI=1S/C19H15BrN4/c1-12-6-8-16(9-7-12)24-11-17-18(23-24)13(2)21-22-19(17)14-4-3-5-15(20)10-14/h3-11H,1-2H3	NUKHSIDVEMUYCP-UHFFFAOYSA-N	378.04800912							107353
MLS000108060	LSM-18708	SID7977195, BRD-K65567793	5310871	InChI=1S/C14H13N5/c1-10-8-11(2)19(18-10)14-16-13(9-15-17-14)12-6-4-3-5-7-12/h3-9H,1-2H3	CDEZKXULGHHICE-UHFFFAOYSA-N	Cc1cc(C)n(n1)c2nncc(n2)c3ccccc3	BroadT	BRD-K65567793	BRD-K65567793-001-06-3	ChemBridge Corporation	5709031			Cc1cc(C)n(n1)-c1nncc(n1)-c1ccccc1	InChI=1S/C14H13N5/c1-10-8-11(2)19(18-10)14-16-13(9-15-17-14)12-6-4-3-5-7-12/h3-9H,1-2H3	CDEZKXULGHHICE-UHFFFAOYSA-N	251.117095466							107354
F0850-4763	LSM-18709	SID49640986, BRD-K68852952	5348527	InChI=1S/C23H25NO4/c1-15-9-11-24(12-10-15)13-18-20(25)8-7-17-22(26)19(14-28-23(17)18)16-5-3-4-6-21(16)27-2/h3-8,14-15,25H,9-13H2,1-2H3	DIPBHKKCKVWICC-UHFFFAOYSA-N	COc1ccccc1C2=COc3c(CN4CCC(C)CC4)c(O)ccc3C2=O	BroadT	BRD-K68852952	BRD-K68852952-001-05-5	Asinex Ltd.	BAS 02168042			COc1ccccc1-c1coc2c(CN3CCC(C)CC3)c(O)ccc2c1=O	InChI=1S/C23H25NO4/c1-15-9-11-24(12-10-15)13-18-20(25)8-7-17-22(26)19(14-28-23(17)18)16-5-3-4-6-21(16)27-2/h3-8,14-15,25H,9-13H2,1-2H3	DIPBHKKCKVWICC-UHFFFAOYSA-N	379.17835829							107355
MLS000686752	LSM-18710	SID24819851, BRD-K81999650	785602	InChI=1S/C14H11NO4S/c1-10-6-8-11(9-7-10)20(17,18)15-12-4-2-3-5-13(12)19-14(15)16/h2-9H,1H3	GFWJFUAUJKMTEJ-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N2C(=O)Oc3ccccc23	BroadT	BRD-K81999650	BRD-K81999650-001-06-0	ChemDiv Inc.	7426-0533			Cc1ccc(cc1)S(=O)(=O)n1c2ccccc2oc1=O	InChI=1S/C14H11NO4S/c1-10-6-8-11(9-7-10)20(17,18)15-12-4-2-3-5-13(12)19-14(15)16/h2-9H,1H3	GFWJFUAUJKMTEJ-UHFFFAOYSA-N	289.040878532							107356
MLS001033725	LSM-43789	SID24837179, BRD-K08611512	2364621	InChI=1S/C14H15BrN2O4/c1-20-4-3-17-14(19)10(8-16)5-9-6-11(15)13(18)12(7-9)21-2/h5-7,18H,3-4H2,1-2H3,(H,17,19)/b10-5+	XTLSBBIUZFKKRN-BJMVGYQFSA-N	COCCNC(=O)\C(=C\c1cc(Br)c(O)c(OC)c1)\C#N	BroadT	BRD-K08611512	BRD-K08611512-001-05-1	Enamine Ltd.	T0509-7328			COCCNC(=O)C(=C\c1cc(Br)c(O)c(OC)c1)\C#N	InChI=1S/C14H15BrN2O4/c1-20-4-3-17-14(19)10(8-16)5-9-6-11(15)13(18)12(7-9)21-2/h5-7,18H,3-4H2,1-2H3,(H,17,19)/b10-5+	XTLSBBIUZFKKRN-BJMVGYQFSA-N	354.02151958							
SMR000006603	LSM-18712	SID851479, BRD-A48081261	654055	InChI=1S/C19H18N4O2S3/c1-12-9-13-5-2-3-7-15(13)23(12)17(25)11-27-19-22-21-18(28-19)20-16(24)10-14-6-4-8-26-14/h2-8,12H,9-11H2,1H3,(H,20,21,24)	PSLMFSOEBNFDQW-UHFFFAOYSA-N	CC1Cc2ccccc2N1C(=O)CSc3nnc(NC(=O)Cc4cccs4)s3	BroadT	BRD-A48081261	BRD-A48081261-001-03-9	Asinex Ltd.	ASN 06399043			CC1Cc2ccccc2N1C(=O)CSc1nnc(NC(=O)Cc2cccs2)s1	InChI=1S/C19H18N4O2S3/c1-12-9-13-5-2-3-7-15(13)23(12)17(25)11-27-19-22-21-18(28-19)20-16(24)10-14-6-4-8-26-14/h2-8,12H,9-11H2,1H3,(H,20,21,24)	PSLMFSOEBNFDQW-UHFFFAOYSA-N	430.059187926							107358
AC1NVY5X	LSM-18713	SID24809713, BRD-K60030854	5607538	InChI=1S/C18H17N3O4S/c1-24-15-5-3-2-4-14(15)19-16(23)10-11-26-18-21-20-17(25-18)12-6-8-13(22)9-7-12/h2-9,22H,10-11H2,1H3,(H,19,23)	KQEPPFTWQCUNID-UHFFFAOYSA-N	COc1ccccc1NC(=O)CCSc2oc(nn2)c3ccc(O)cc3	BroadT	BRD-K60030854	BRD-K60030854-001-06-3	Asinex Ltd.	BAS 10850907			COc1ccccc1NC(=O)CCSc1nnc(o1)-c1ccc(O)cc1	InChI=1S/C18H17N3O4S/c1-24-15-5-3-2-4-14(15)19-16(23)10-11-26-18-21-20-17(25-18)12-6-8-13(22)9-7-12/h2-9,22H,10-11H2,1H3,(H,19,23)	KQEPPFTWQCUNID-UHFFFAOYSA-N	371.093976744							
MLS000590207	LSM-43790	SID17514084, BRD-K62021436	1421763	InChI=1S/C21H22N4O4S/c26-20(9-6-16-2-1-3-19(14-16)25(27)28)23-21(30)22-18-7-4-17(5-8-18)15-24-10-12-29-13-11-24/h1-9,14H,10-13,15H2,(H2,22,23,26,30)/b9-6+	JDZIERLOPXSINW-RMKNXTFCSA-N	[O-][N+](=O)c1cccc(\C=C\C(=O)NC(=S)Nc2ccc(CN3CCOCC3)cc2)c1	BroadT	BRD-K62021436	BRD-K62021436-001-06-7	InterBioScreen Ltd.	STOCK3S-99410			[O-][N+](=O)c1cccc(\C=C\C(=O)NC(=S)Nc2ccc(CN3CCOCC3)cc2)c1	InChI=1S/C21H22N4O4S/c26-20(9-6-16-2-1-3-19(14-16)25(27)28)23-21(30)22-18-7-4-17(5-8-18)15-24-10-12-29-13-11-24/h1-9,14H,10-13,15H2,(H2,22,23,26,30)/b9-6+	JDZIERLOPXSINW-RMKNXTFCSA-N	426.136175914							
6-Methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole	LSM-15280	BRD-K28399802	593947	InChI=1S/C12H14N2/c1-8-3-2-4-9-10-7-13-6-5-11(10)14-12(8)9/h2-4,13-14H,5-7H2,1H3	SEIGTDMBJJWKGU-UHFFFAOYSA-N	Cc1cccc2c3CNCCc3[nH]c12	BroadT	BRD-K28399802	BRD-K28399802-003-05-4	Asinex Ltd.	BAS 01909697		Cl	Cc1cccc2c3CNCCc3[nH]c12.Cl	InChI=1S/C12H14N2.ClH/c1-8-3-2-4-9-10-7-13-6-5-11(10)14-12(8)9;/h2-4,13-14H,5-7H2,1H3;1H	IWQNFXZCHVCFRX-UHFFFAOYSA-N	186.115698468							103927, 103927
MLS000086352	LSM-18715	SID4244705, BRD-K16111035	2051214	InChI=1S/C20H20N4O4S/c1-24(13-14-5-3-2-4-6-14)29(26,27)17-11-9-15(10-12-17)18(25)21-20-23-22-19(28-20)16-7-8-16/h2-6,9-12,16H,7-8,13H2,1H3,(H,21,23,25)	ZFBGQOLXKQLHAG-UHFFFAOYSA-N	CN(Cc1ccccc1)S(=O)(=O)c2ccc(cc2)C(=O)Nc3oc(nn3)C4CC4	BroadT	BRD-K16111035	BRD-K16111035-001-06-8	ChemDiv Inc.	C079-0422			CN(Cc1ccccc1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(o1)C1CC1	InChI=1S/C20H20N4O4S/c1-24(13-14-5-3-2-4-6-14)29(26,27)17-11-9-15(10-12-17)18(25)21-20-23-22-19(28-20)16-7-8-16/h2-6,9-12,16H,7-8,13H2,1H3,(H,21,23,25)	ZFBGQOLXKQLHAG-UHFFFAOYSA-N	412.12052585							107361
MLS000077322	LSM-18716	SID849123, BRD-K77266308	651594	InChI=1S/C23H20N2O6S/c1-28-19-13-16(14-20(29-2)21(19)30-3)23-25-24-22(31-23)15-9-11-18(12-10-15)32(26,27)17-7-5-4-6-8-17/h4-14H,1-3H3	ZJTHFQYLPMJZBQ-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)c2oc(nn2)c3ccc(cc3)S(=O)(=O)c4ccccc4	BroadT	BRD-K77266308	BRD-K77266308-001-04-1	Asinex Ltd.	BAS 00680310			COc1cc(cc(OC)c1OC)-c1nnc(o1)-c1ccc(cc1)S(=O)(=O)c1ccccc1	InChI=1S/C23H20N2O6S/c1-28-19-13-16(14-20(29-2)21(19)30-3)23-25-24-22(31-23)15-9-11-18(12-10-15)32(26,27)17-7-5-4-6-8-17/h4-14H,1-3H3	ZJTHFQYLPMJZBQ-UHFFFAOYSA-N	452.10420707							107362
MLS000051404	LSM-18717	SID4264876, BRD-A22411525	115423	InChI=1S/C23H27F3N2O3/c1-2-22(30)17-6-8-21(9-7-17)31-16-20(29)15-27-10-12-28(13-11-27)19-5-3-4-18(14-19)23(24,25)26/h3-9,14,20,29H,2,10-13,15-16H2,1H3	RZBKZNYVDFDGCS-UHFFFAOYSA-N	CCC(=O)c1ccc(OCC(O)CN2CCN(CC2)c3cccc(c3)C(F)(F)F)cc1	BroadT	BRD-A22411525	BRD-A22411525-001-05-5	ChemBridge Corporation	7931630			CCC(=O)c1ccc(OCC(O)CN2CCN(CC2)c2cccc(c2)C(F)(F)F)cc1	InChI=1S/C23H27F3N2O3/c1-2-22(30)17-6-8-21(9-7-17)31-16-20(29)15-27-10-12-28(13-11-27)19-5-3-4-18(14-19)23(24,25)26/h3-9,14,20,29H,2,10-13,15-16H2,1H3	RZBKZNYVDFDGCS-UHFFFAOYSA-N	436.197377344							107363
AC1NMYJB	LSM-18718	BRD-K42350741	5033938	InChI=1S/C17H21NO4S/c1-5-22-16(21)11-6-10(2)23-15(11)18-9-12-13(19)7-17(3,4)8-14(12)20/h6,9,12H,5,7-8H2,1-4H3	GHQPDFDSYXHBEW-UHFFFAOYSA-N	CCOC(=O)c1cc(C)sc1N=CC2C(=O)CC(C)(C)CC2=O	BroadT	BRD-K42350741	BRD-K42350741-001-05-7	ChemDiv Inc.	4673-0412			CCOC(=O)c1cc(C)sc1N=CC1C(=O)CC(C)(C)CC1=O	InChI=1S/C17H21NO4S/c1-5-22-16(21)11-6-10(2)23-15(11)18-9-12-13(19)7-17(3,4)8-14(12)20/h6,9,12H,5,7-8H2,1-4H3	GHQPDFDSYXHBEW-UHFFFAOYSA-N	335.119128852							107364
SMR000136033	LSM-18719	SID14746321, BRD-K08598061	2928113	InChI=1S/C24H26N4O6S/c1-5-33-19-12-16(8-11-18(19)34-35(31,32)17-9-6-13(2)7-10-17)22(20-14(3)25-27-23(20)29)21-15(4)26-28-24(21)30/h6-12,22H,5H2,1-4H3,(H2,25,27,29)(H2,26,28,30)	QCDJENTUMCYGBV-UHFFFAOYSA-N	CCOc1cc(ccc1OS(=O)(=O)c2ccc(C)cc2)C(c3c(C)n[nH]c3O)c4c(C)n[nH]c4O	BroadT	BRD-K08598061	BRD-K08598061-001-06-3	ChemBridge Corporation	7136660			CCOc1cc(ccc1OS(=O)(=O)c1ccc(C)cc1)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O	InChI=1S/C24H26N4O6S/c1-5-33-19-12-16(8-11-18(19)34-35(31,32)17-9-6-13(2)7-10-17)22(20-14(3)25-27-23(20)29)21-15(4)26-28-24(21)30/h6-12,22H,5H2,1-4H3,(H2,25,27,29)(H2,26,28,30)	QCDJENTUMCYGBV-UHFFFAOYSA-N	498.157305282							107365
2-(4-Sec-butylanilino)nicotinonitrile	LSM-18720	SID17406873, BRD-A53598982	11842297	InChI=1S/C16H17N3/c1-3-12(2)13-6-8-15(9-7-13)19-16-14(11-17)5-4-10-18-16/h4-10,12H,3H2,1-2H3,(H,18,19)	BVFMRMYKLFNXLT-UHFFFAOYSA-N	CCC(C)c1ccc(Nc2ncccc2C#N)cc1	BroadT	BRD-A53598982	BRD-A53598982-001-05-7	Specs	AR-017/42899979			CCC(C)c1ccc(Nc2ncccc2C#N)cc1	InChI=1S/C16H17N3/c1-3-12(2)13-6-8-15(9-7-13)19-16-14(11-17)5-4-10-18-16/h4-10,12H,3H2,1-2H3,(H,18,19)	BVFMRMYKLFNXLT-UHFFFAOYSA-N	251.142247574							107366
3-Methyl-10H-9-thia-10-aza-phenanthrene 9,9-dioxide	LSM-18721	SID843199, BRD-K64295967	645483	InChI=1S/C13H11NO2S/c1-9-6-7-12-11(8-9)10-4-2-3-5-13(10)17(15,16)14-12/h2-8,14H,1H3	KWNZYAUOWBBMJN-UHFFFAOYSA-N	Cc1ccc2NS(=O)(=O)c3ccccc3c2c1	BroadT	BRD-K64295967	BRD-K64295967-001-06-2	Asinex Ltd.	BAS 01125871			Cc1ccc2NS(=O)(=O)c3ccccc3-c2c1	InChI=1S/C13H11NO2S/c1-9-6-7-12-11(8-9)10-4-2-3-5-13(10)17(15,16)14-12/h2-8,14H,1H3	KWNZYAUOWBBMJN-UHFFFAOYSA-N	245.051049292							107367
ST50891334	LSM-18722	SID17413632, BRD-K90707204	1261311	InChI=1S/C27H27N3O3S/c1-2-5-19-8-12-21(13-9-19)26-18-24(23-6-3-4-7-25(23)30-26)27(31)29-17-16-20-10-14-22(15-11-20)34(28,32)33/h3-4,6-15,18H,2,5,16-17H2,1H3,(H,29,31)(H2,28,32,33)	VJENYQKWQQOXAZ-UHFFFAOYSA-N	CCCc1ccc(cc1)c2cc(C(=O)NCCc3ccc(cc3)S(=O)(=O)N)c4ccccc4n2	BroadT	BRD-K90707204	BRD-K90707204-001-05-9	ChemBridge Corporation	7923159			CCCc1ccc(cc1)-c1cc(C(=O)NCCc2ccc(cc2)S(N)(=O)=O)c2ccccc2n1	InChI=1S/C27H27N3O3S/c1-2-5-19-8-12-21(13-9-19)26-18-24(23-6-3-4-7-25(23)30-26)27(31)29-17-16-20-10-14-22(15-11-20)34(28,32)33/h3-4,6-15,18H,2,5,16-17H2,1H3,(H,29,31)(H2,28,32,33)	VJENYQKWQQOXAZ-UHFFFAOYSA-N	473.177312444							107368
MLS000555450	LSM-18723	SID17401603, BRD-K43719044	1410147	InChI=1S/C16H18N4S3/c21-15-19-18-14(20(15)11-6-2-1-3-7-11)10-22-16-17-12-8-4-5-9-13(12)23-16/h4-5,8-9,11H,1-3,6-7,10H2,(H,19,21)	LLPRUPUFKSSBQN-UHFFFAOYSA-N	Sc1nnc(CSc2nc3ccccc3s2)n1C4CCCCC4	BroadT	BRD-K43719044	BRD-K43719044-001-05-6	InterBioScreen Ltd.	STOCK2S-91550			Sc1nnc(CSc2nc3ccccc3s2)n1C1CCCCC1	InChI=1S/C16H18N4S3/c21-15-19-18-14(20(15)11-6-2-1-3-7-11)10-22-16-17-12-8-4-5-9-13(12)23-16/h4-5,8-9,11H,1-3,6-7,10H2,(H,19,21)	LLPRUPUFKSSBQN-UHFFFAOYSA-N	362.069358686							107369
ZINC00628701	LSM-18724	SID14744934, BRD-K04320586	982889	InChI=1S/C19H21N3O2S2/c1-4-9-22-18(23)16-13-7-5-6-8-15(13)26-17(16)20-19(22)25-10-14-11(2)21-24-12(14)3/h4H,1,5-10H2,2-3H3	XKMDKNYRNXJPLF-UHFFFAOYSA-N	Cc1onc(C)c1CSC2=Nc3sc4CCCCc4c3C(=O)N2CC=C	BroadT	BRD-K04320586	BRD-K04320586-001-05-4	Enamine Ltd.	T0504-4406			Cc1noc(C)c1CSc1nc2sc3CCCCc3c2c(=O)n1CC=C	InChI=1S/C19H21N3O2S2/c1-4-9-22-18(23)16-13-7-5-6-8-15(13)26-17(16)20-19(22)25-10-14-11(2)21-24-12(14)3/h4H,1,5-10H2,2-3H3	XKMDKNYRNXJPLF-UHFFFAOYSA-N	387.107518322							107370
MLS000094787	LSM-18725	SID87341346, SID4244250, BRD-K64439264	3238872	InChI=1S/C21H16N4O2S/c26-19(22-12-14-6-5-11-27-14)13-28-21-24-16-8-2-1-7-15(16)20-23-17-9-3-4-10-18(17)25(20)21/h1-11H,12-13H2,(H,22,26)	HKWBEZOTINZVLA-UHFFFAOYSA-N	O=C(CSc1nc2ccccc2c3nc4ccccc4n13)NCc5occc5	BroadT	BRD-K64439264	BRD-K64439264-001-07-4	ChemDiv Inc.	K250-0368			O=C(CSc1nc2ccccc2c2nc3ccccc3n12)NCc1ccco1	InChI=1S/C21H16N4O2S/c26-19(22-12-14-6-5-11-27-14)13-28-21-24-16-8-2-1-7-15(16)20-23-17-9-3-4-10-18(17)25(20)21/h1-11H,12-13H2,(H,22,26)	HKWBEZOTINZVLA-UHFFFAOYSA-N	388.099396482							107371
ASN 04457678	LSM-15281	BRD-K75786907	3189633	InChI=1S/C21H24ClN3O2S/c1-3-24(4-2)12-6-13-25(20(26)19-7-5-14-27-19)21-23-18(15-28-21)16-8-10-17(22)11-9-16/h5,7-11,14-15H,3-4,6,12-13H2,1-2H3	CTZRVLWWCNVIHZ-UHFFFAOYSA-N	CCN(CC)CCCN(C(=O)c1occc1)c2nc(cs2)c3ccc(Cl)cc3	BroadT	BRD-K75786907	BRD-K75786907-003-06-6	Asinex Ltd.	ASN 04457678		Cl	CCN(CC)CCCN(C(=O)c1ccco1)c1nc(cs1)-c1ccc(Cl)cc1.Cl	InChI=1S/C21H24ClN3O2S.ClH/c1-3-24(4-2)12-6-13-25(20(26)19-7-5-14-27-19)21-23-18(15-28-21)16-8-10-17(22)11-9-16;/h5,7-11,14-15H,3-4,6,12-13H2,1-2H3;1H	GVESMTVVFACQAX-UHFFFAOYSA-N	417.127775438							103928, 103928
N-[4-(1H-Benzimidazol-2-yl)phenyl]-2,3,4,5,6-pentafluorobenzamide	LSM-18726	SID24783703, BRD-K78790809	2200641	InChI=1S/C20H10F5N3O/c21-14-13(15(22)17(24)18(25)16(14)23)20(29)26-10-7-5-9(6-8-10)19-27-11-3-1-2-4-12(11)28-19/h1-8H,(H,26,29)(H,27,28)	ABRMNMWSRYGJAX-UHFFFAOYSA-N	Fc1c(F)c(F)c(C(=O)Nc2ccc(cc2)c3nc4ccccc4[nH]3)c(F)c1F	BroadT	BRD-K78790809	BRD-K78790809-001-06-8	ChemBridge Corporation	7737377			Fc1c(F)c(F)c(C(=O)Nc2ccc(cc2)-c2nc3ccccc3[nH]2)c(F)c1F	InChI=1S/C20H10F5N3O/c21-14-13(15(22)17(24)18(25)16(14)23)20(29)26-10-7-5-9(6-8-10)19-27-11-3-1-2-4-12(11)28-19/h1-8H,(H,26,29)(H,27,28)	ABRMNMWSRYGJAX-UHFFFAOYSA-N	403.07440297							107372
F3394-1188	LSM-18727	SID4260948, BRD-K11752047	2241612	InChI=1S/C24H22FN3O2S/c1-15-12-22(26-20-5-3-2-4-18(15)20)31-14-23(29)28-10-8-16(9-11-28)24-19-13-17(25)6-7-21(19)30-27-24/h2-7,12-13,16H,8-11,14H2,1H3	UDDGKMQBOSBVQC-UHFFFAOYSA-N	Cc1cc(SCC(=O)N2CCC(CC2)c3noc4ccc(F)cc34)nc5ccccc15	BroadT	BRD-K11752047	BRD-K11752047-001-06-0	ChemBridge Corporation	7848811			Cc1cc(SCC(=O)N2CCC(CC2)c2noc3ccc(F)cc23)nc2ccccc12	InChI=1S/C24H22FN3O2S/c1-15-12-22(26-20-5-3-2-4-18(15)20)31-14-23(29)28-10-8-16(9-11-28)24-19-13-17(25)6-7-21(19)30-27-24/h2-7,12-13,16H,8-11,14H2,1H3	UDDGKMQBOSBVQC-UHFFFAOYSA-N	435.141675864							107373
STK296659	LSM-18728	SID842754, BRD-K62574428	645029	InChI=1S/C20H14ClN3O3/c21-14-1-4-16(5-2-14)26-12-19(25)23-15-3-6-18-17(11-15)24-20(27-18)13-7-9-22-10-8-13/h1-11H,12H2,(H,23,25)	ZFVQEFNMMHFWNK-UHFFFAOYSA-N	Clc1ccc(OCC(=O)Nc2ccc3oc(nc3c2)c4ccncc4)cc1	BroadT	BRD-K62574428	BRD-K62574428-001-06-5	Asinex Ltd.	BAS 06862882			Clc1ccc(OCC(=O)Nc2ccc3oc(nc3c2)-c2ccncc2)cc1	InChI=1S/C20H14ClN3O3/c21-14-1-4-16(5-2-14)26-12-19(25)23-15-3-6-18-17(11-15)24-20(27-18)13-7-9-22-10-8-13/h1-11H,12H2,(H,23,25)	ZFVQEFNMMHFWNK-UHFFFAOYSA-N	379.072369048							107374
MLS000115777	LSM-18729	SID7967248, BRD-K61294509	894115	InChI=1S/C15H12N2O3S/c18-13-8-6-12(7-9-13)17-21(19,20)14-5-1-3-11-4-2-10-16-15(11)14/h1-10,17-18H	KVFNSUPFXGYOKN-UHFFFAOYSA-N	Oc1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1	BroadT	BRD-K61294509	BRD-K61294509-001-04-8	ChemDiv Inc.	7202-2472			Oc1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1	InChI=1S/C15H12N2O3S/c18-13-8-6-12(7-9-13)17-21(19,20)14-5-1-3-11-4-2-10-16-15(11)14/h1-10,17-18H	KVFNSUPFXGYOKN-UHFFFAOYSA-N	300.056862954							107375
SMR000041950	LSM-43791	SID24840877, SID860023, BRD-K77545275	1834058	InChI=1S/C23H23N5O3S/c1-17-7-6-10-28-21(17)25-22(27-13-11-26(2)12-14-27)20(23(28)29)15-19(16-24)32(30,31)18-8-4-3-5-9-18/h3-10,15H,11-14H2,1-2H3/b19-15+	VEBZEIIKHSMIHX-XDJHFCHBSA-N	CN1CCN(CC1)C2=C(\C=C(/C#N)\S(=O)(=O)c3ccccc3)C(=O)N4C=CC=C(C)C4=N2	BroadT	BRD-K77545275	BRD-K77545275-001-05-4	InterBioScreen Ltd.	STOCK3S-46278			CN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1\C=C(/C#N)S(=O)(=O)c1ccccc1	InChI=1S/C23H23N5O3S/c1-17-7-6-10-28-21(17)25-22(27-13-11-26(2)12-14-27)20(23(28)29)15-19(16-24)32(30,31)18-8-4-3-5-9-18/h3-10,15H,11-14H2,1-2H3/b19-15+	VEBZEIIKHSMIHX-XDJHFCHBSA-N	449.152160336							
MLS000056194	LSM-18731	SID24840362, SID3712372, BRD-K52714027	2517024	InChI=1S/C21H15BrFN3O2S/c22-19-11-10-18(28-19)20-24-25-21(26(20)12-14-6-2-1-3-7-14)29-13-17(27)15-8-4-5-9-16(15)23/h1-11H,12-13H2	KBUOQAYFGCGAKV-UHFFFAOYSA-N	Fc1ccccc1C(=O)CSc2nnc(c3oc(Br)cc3)n2Cc4ccccc4	BroadT	BRD-K52714027	BRD-K52714027-001-05-6	Enamine Ltd.	T5333361			Fc1ccccc1C(=O)CSc1nnc(-c2ccc(Br)o2)n1Cc1ccccc1	InChI=1S/C21H15BrFN3O2S/c22-19-11-10-18(28-19)20-24-25-21(26(20)12-14-6-2-1-3-7-14)29-13-17(27)15-8-4-5-9-16(15)23/h1-11H,12-13H2	KBUOQAYFGCGAKV-UHFFFAOYSA-N	471.00523824							107377
AC1MP46A	LSM-18732	SID26669319, BRD-A88712548	3379299	InChI=1S/C21H19N3O4/c1-3-27-21(25)18-17(14-5-4-10-24-12-14)16(11-22)20(23)28-19(18)13-6-8-15(26-2)9-7-13/h4-10,12,17H,3,23H2,1-2H3	STLFPMADNKLVFJ-UHFFFAOYSA-N	CCOC(=O)C1=C(OC(=C(C#N)C1c2cccnc2)N)c3ccc(OC)cc3	BroadT	BRD-A88712548	BRD-A88712548-001-04-3	InterBioScreen Ltd.	STOCK3S-10227			CCOC(=O)C1=C(OC(N)=C(C#N)C1c1cccnc1)c1ccc(OC)cc1	InChI=1S/C21H19N3O4/c1-3-27-21(25)18-17(14-5-4-10-24-12-14)16(11-22)20(23)28-19(18)13-6-8-15(26-2)9-7-13/h4-10,12,17H,3,23H2,1-2H3	STLFPMADNKLVFJ-UHFFFAOYSA-N	377.137556118							107378
N-(4-Phenoxyphenyl)-2-(1,2,3,4-tetrahydro-1-isoquinolinyl)acetamide	LSM-18733	SID24817913, BRD-A94827155	5156639	InChI=1S/C23H22N2O2/c26-23(16-22-21-9-5-4-6-17(21)14-15-24-22)25-18-10-12-20(13-11-18)27-19-7-2-1-3-8-19/h1-13,22,24H,14-16H2,(H,25,26)	PGQAPBDURPHHDJ-UHFFFAOYSA-N	O=C(CC1NCCc2ccccc12)Nc3ccc(Oc4ccccc4)cc3	BroadT	BRD-A94827155	BRD-A94827155-001-06-0	Key Organics Ltd.	6H-061			O=C(CC1NCCc2ccccc12)Nc1ccc(Oc2ccccc2)cc1	InChI=1S/C23H22N2O2/c26-23(16-22-21-9-5-4-6-17(21)14-15-24-22)25-18-10-12-20(13-11-18)27-19-7-2-1-3-8-19/h1-13,22,24H,14-16H2,(H,25,26)	PGQAPBDURPHHDJ-UHFFFAOYSA-N	358.168127964							107379
AC1LDDH1	LSM-18734	SID864036, SID87348867, BRD-K20448569	665287	InChI=1S/C19H15ClN2O5/c1-25-10-7-8-14(26-2)13(9-10)22-18(23)15-16(21-27-17(15)19(22)24)11-5-3-4-6-12(11)20/h3-9,15,17H,1-2H3/t15-,17+/m1/s1	AVMJNCJSYBFURN-WBVHZDCISA-N	COc1ccc(OC)c(c1)N2C(=O)[C@H]3ON=C([C@H]3C2=O)c4ccccc4Cl	BroadT	BRD-K20448569	BRD-K20448569-001-05-4	InterBioScreen Ltd.	STOCK4S-93840			COc1ccc(OC)c(c1)N1C(=O)[C@H]2ON=C([C@H]2C1=O)c1ccccc1Cl	InChI=1S/C19H15ClN2O5/c1-25-10-7-8-14(26-2)13(9-10)22-18(23)15-16(21-27-17(15)19(22)24)11-5-3-4-6-12(11)20/h3-9,15,17H,1-2H3/t15-,17+/m1/s1	AVMJNCJSYBFURN-WBVHZDCISA-N	386.06694931							107380
SMR000069339	LSM-18735	SID4258501, BRD-K91634964	1377242	InChI=1S/C20H25ClN2O3/c1-24-18-11-15(12-19(25-2)20(18)26-3)14-22-7-9-23(10-8-22)17-6-4-5-16(21)13-17/h4-6,11-13H,7-10,14H2,1-3H3	OZZZZNWJPKCYDI-UHFFFAOYSA-N	COc1cc(CN2CCN(CC2)c3cccc(Cl)c3)cc(OC)c1OC	BroadT	BRD-K91634964	BRD-K91634964-001-06-2	ChemBridge Corporation	5267721			COc1cc(CN2CCN(CC2)c2cccc(Cl)c2)cc(OC)c1OC	InChI=1S/C20H25ClN2O3/c1-24-18-11-15(12-19(25-2)20(18)26-3)14-22-7-9-23(10-8-22)17-6-4-5-16(21)13-17/h4-6,11-13H,7-10,14H2,1-3H3	OZZZZNWJPKCYDI-UHFFFAOYSA-N	376.15537039							107381
RO-5-3335	LSM-2426	BRD-K19059335, RO-5-3335	64983	InChI=1S/C13H10ClN3O/c14-8-3-4-10-9(6-8)13(11-2-1-5-15-11)16-7-12(18)17-10/h1-6,15H,7H2,(H,17,18)	XWNMORIHKRROGW-UHFFFAOYSA-N	Clc1ccc2NC(=O)CN=C(c3ccc[nH]3)c2c1	BroadT	BRD-K19059335	BRD-K19059335-001-05-5	National Cancer Institute Chemotherapeutic Agents Repository	2H-1,4-Benzodiazepin-2-one, 7-chloro-1,3-dihydro-5-pyrrol-2-yl- 66020			Clc1ccc2NC(=O)CN=C(c3ccc[nH]3)c2c1	InChI=1S/C13H10ClN3O/c14-8-3-4-10-9(6-8)13(11-2-1-5-15-11)16-7-12(18)17-10/h1-6,15H,7H2,(H,17,18)	XWNMORIHKRROGW-UHFFFAOYSA-N	259.05123968							131785, 92349
F0665-0121	LSM-18736	SID7965372, BRD-K68275232	5307584	InChI=1S/C19H18N4OS2/c1-2-12-25-18-21-20-17(23(18)14-8-4-3-5-9-14)13-22-15-10-6-7-11-16(15)26-19(22)24/h3-11H,2,12-13H2,1H3	WTGJIGYDGCMYAE-UHFFFAOYSA-N	CCCSc1nnc(CN2C(=O)Sc3ccccc23)n1c4ccccc4	BroadT	BRD-K68275232	BRD-K68275232-001-05-1	ChemDiv Inc.	C663-0111			CCCSc1nnc(Cn2c3ccccc3sc2=O)n1-c1ccccc1	InChI=1S/C19H18N4OS2/c1-2-12-25-18-21-20-17(23(18)14-8-4-3-5-9-14)13-22-15-10-6-7-11-16(15)26-19(22)24/h3-11H,2,12-13H2,1H3	WTGJIGYDGCMYAE-UHFFFAOYSA-N	382.092202616							107382
MLS000721980	LSM-18737	SID22402149, BRD-K76479041	3689609	InChI=1S/C16H22N8O4/c1-9-7-11(19-17-9)15(27)23-21-13(25)5-3-4-6-14(26)22-24-16(28)12-8-10(2)18-20-12/h7-8H,3-6H2,1-2H3,(H,17,19)(H,18,20)(H,21,25)(H,22,26)(H,23,27)(H,24,28)	PNPKTABRPYDDGB-UHFFFAOYSA-N	Cc1cc([nH]n1)C(=O)NNC(=O)CCCCC(=O)NNC(=O)c2cc(C)[nH]n2	BroadT	BRD-K76479041	BRD-K76479041-001-06-8	Life Chemicals Inc.	F1443-3941			Cc1cc([nH]n1)C(=O)NNC(=O)CCCCC(=O)NNC(=O)c1cc(C)[nH]n1	InChI=1S/C16H22N8O4/c1-9-7-11(19-17-9)15(27)23-21-13(25)5-3-4-6-14(26)22-24-16(28)12-8-10(2)18-20-12/h7-8H,3-6H2,1-2H3,(H,17,19)(H,18,20)(H,21,25)(H,22,26)(H,23,27)(H,24,28)	PNPKTABRPYDDGB-UHFFFAOYSA-N	390.176401264							107383
MLS000683575	LSM-18738	SID24791107, BRD-K96813690	16189621	InChI=1S/C26H36N4O2S/c1-3-29-11-5-6-22-18-21(9-10-25(22)29)20-30(13-12-28-14-16-32-17-15-28)26(33)27-23-7-4-8-24(19-23)31-2/h4,7-10,18-19H,3,5-6,11-17,20H2,1-2H3,(H,27,33)	JWWWLRILINVXAZ-UHFFFAOYSA-N	CCN1CCCc2cc(CN(CCN3CCOCC3)C(=Nc4cccc(OC)c4)S)ccc12	BroadT	BRD-K96813690	BRD-K96813690-001-05-0	ChemDiv Inc.	K788-3568			CCN1CCCc2cc(CN(CCN3CCOCC3)C(S)=Nc3cccc(OC)c3)ccc12	InChI=1S/C26H36N4O2S/c1-3-29-11-5-6-22-18-21(9-10-25(22)29)20-30(13-12-28-14-16-32-17-15-28)26(33)27-23-7-4-8-24(19-23)31-2/h4,7-10,18-19H,3,5-6,11-17,20H2,1-2H3,(H,27,33)	JWWWLRILINVXAZ-UHFFFAOYSA-N	468.255897122							107384
T0516-7455	LSM-18739	SID14745855, BRD-K85635978	2368021	InChI=1S/C18H19N3S/c1-11-6-8-13(9-7-11)10-19-17-16-14-4-3-5-15(14)22-18(16)21-12(2)20-17/h6-9H,3-5,10H2,1-2H3,(H,19,20,21)	JVIJQIPKGUVYES-UHFFFAOYSA-N	Cc1ccc(CNc2nc(C)nc3sc4CCCc4c23)cc1	BroadT	BRD-K85635978	BRD-K85635978-001-05-3	Enamine Ltd.	T0516-7455			Cc1ccc(CNc2nc(C)nc3sc4CCCc4c23)cc1	InChI=1S/C18H19N3S/c1-11-6-8-13(9-7-11)10-19-17-16-14-4-3-5-15(14)22-18(16)21-12(2)20-17/h6-9H,3-5,10H2,1-2H3,(H,19,20,21)	JVIJQIPKGUVYES-UHFFFAOYSA-N	309.129968328							107385
BAS 01129968	LSM-18740	SID846054, BRD-K75033792	648426	InChI=1S/C21H20N6O3/c1-24-19-18(20(29)25(2)21(24)30)26(14-23-19)13-17(28)27(16-10-6-7-11-22-16)12-15-8-4-3-5-9-15/h3-11,14H,12-13H2,1-2H3	FYWLRYXTDCBFCZ-UHFFFAOYSA-N	CN1C(=O)N(C)c2ncn(CC(=O)N(Cc3ccccc3)c4ccccn4)c2C1=O	BroadT	BRD-K75033792	BRD-K75033792-001-05-7	Asinex Ltd.	BAS 01129968			Cn1c2ncn(CC(=O)N(Cc3ccccc3)c3ccccn3)c2c(=O)n(C)c1=O	InChI=1S/C21H20N6O3/c1-24-19-18(20(29)25(2)21(24)30)26(14-23-19)13-17(28)27(16-10-6-7-11-22-16)12-15-8-4-3-5-9-15/h3-11,14H,12-13H2,1-2H3	FYWLRYXTDCBFCZ-UHFFFAOYSA-N	404.15968856							107386
AC1NSIYT	LSM-18741	SID7971390, BRD-K22083193	5310463	InChI=1S/C15H15N3O2S3/c1-2-13-5-6-14(22-13)23(19,20)17-9-12-10-21-15(18-12)11-4-3-7-16-8-11/h3-8,10,17H,2,9H2,1H3	MSZJNNMULKOVET-UHFFFAOYSA-N	CCc1ccc(s1)S(=O)(=O)NCc2csc(n2)c3cccnc3	BroadT	BRD-K22083193	BRD-K22083193-001-04-4	Life Chemicals Inc.	F0684-0148			CCc1ccc(s1)S(=O)(=O)NCc1csc(n1)-c1cccnc1	InChI=1S/C15H15N3O2S3/c1-2-13-5-6-14(22-13)23(19,20)17-9-12-10-21-15(18-12)11-4-3-7-16-8-11/h3-8,10,17H,2,9H2,1H3	MSZJNNMULKOVET-UHFFFAOYSA-N	365.03263882							107387
MLS000045899	LSM-18742	SID4250410, BRD-A87991868	3244228	InChI=1S/C17H20ClN3O3/c1-10-4-5-13(18)6-14(10)21-16(22)7-15(19-17(21)23)20-8-11(2)24-12(3)9-20/h4-7,11-12H,8-9H2,1-3H3,(H,19,23)	DMFFTJYOPSSREU-UHFFFAOYSA-N	CC1CN(CC(C)O1)C2=CC(=O)N(C(=O)N2)c3cc(Cl)ccc3C	BroadT	BRD-A87991868	BRD-A87991868-001-06-1	ChemDiv Inc.	C632-0312			CC1CN(CC(C)O1)c1cc(=O)n(-c2cc(Cl)ccc2C)c(=O)[nH]1	InChI=1S/C17H20ClN3O3/c1-10-4-5-13(18)6-14(10)21-16(22)7-15(19-17(21)23)20-8-11(2)24-12(3)9-20/h4-7,11-12H,8-9H2,1-3H3,(H,19,23)	DMFFTJYOPSSREU-UHFFFAOYSA-N	349.11931924							107388
AC1N8YHJ	LSM-18743	SID49821998, BRD-A61886478	4352108	InChI=1S/C21H20N2O5/c1-27-15-5-2-4-14(11-15)22-19(24)13-7-8-17-18(10-13)21(26)23(20(17)25)12-16-6-3-9-28-16/h2,4-5,7-8,10-11,16H,3,6,9,12H2,1H3,(H,22,24)	FPEKMONGJKUQQK-UHFFFAOYSA-N	COc1cccc(NC(=O)c2ccc3C(=O)N(CC4CCCO4)C(=O)c3c2)c1	BroadT	BRD-A61886478	BRD-A61886478-001-05-7	InterBioScreen Ltd.	STOCK3S-41160			COc1cccc(NC(=O)c2ccc3C(=O)N(CC4CCCO4)C(=O)c3c2)c1	InChI=1S/C21H20N2O5/c1-27-15-5-2-4-14(11-15)22-19(24)13-7-8-17-18(10-13)21(26)23(20(17)25)12-16-6-3-9-28-16/h2,4-5,7-8,10-11,16H,3,6,9,12H2,1H3,(H,22,24)	FPEKMONGJKUQQK-UHFFFAOYSA-N	380.13722176							107389
MLS000119832	LSM-18744	SID7964971, BRD-A79694261	5307336	InChI=1S/C17H26N4O2/c1-13-5-6-15-14(10-13)11-21(19-15)12-16(22)18-7-3-9-20-8-2-4-17(20)23/h11,13H,2-10,12H2,1H3,(H,18,22)	ZPQCAVFJNQLWGI-UHFFFAOYSA-N	CC1CCc2nn(CC(=O)NCCCN3CCCC3=O)cc2C1	BroadT	BRD-A79694261	BRD-A79694261-001-05-6	ChemDiv Inc.	C881-0725			CC1CCc2nn(CC(=O)NCCCN3CCCC3=O)cc2C1	InChI=1S/C17H26N4O2/c1-13-5-6-15-14(10-13)11-21(19-15)12-16(22)18-7-3-9-20-8-2-4-17(20)23/h11,13H,2-10,12H2,1H3,(H,18,22)	ZPQCAVFJNQLWGI-UHFFFAOYSA-N	318.205576112							107390
AC1LFRMX	LSM-18745	SID14725729, BRD-K77462030	54680362	InChI=1S/C18H15N3O3/c1-2-10-21-14-8-4-3-7-13(14)16(22)15(18(21)24)17(23)20-12-6-5-9-19-11-12/h2-9,11,22H,1,10H2,(H,20,23)	STIOQQLLDQRYOQ-UHFFFAOYSA-N	OC1=C(C(=O)Nc2cccnc2)C(=O)N(CC=C)c3ccccc13	BroadT	BRD-K77462030	BRD-K77462030-001-05-8	Asinex Ltd.	BAS 02766308			Oc1c(C(=O)Nc2cccnc2)c(=O)n(CC=C)c2ccccc12	InChI=1S/C18H15N3O3/c1-2-10-21-14-8-4-3-7-13(14)16(22)15(18(21)24)17(23)20-12-6-5-9-19-11-12/h2-9,11,22H,1,10H2,(H,20,23)	STIOQQLLDQRYOQ-UHFFFAOYSA-N	321.11134137							107391
1H-Benzimidazole-5,6-diamine	LSM-18746	SID24822839, BRD-K55412727	2773193	InChI=1S/C7H8N4/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-3H,8-9H2,(H,10,11)	SJVPHAOWYMKBPE-UHFFFAOYSA-N	Nc1cc2nc[nH]c2cc1N	BroadT	BRD-K55412727	BRD-K55412727-001-04-0	ChemDiv Inc.	4205-0081			Nc1cc2nc[nH]c2cc1N	InChI=1S/C7H8N4/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-3H,8-9H2,(H,10,11)	SJVPHAOWYMKBPE-UHFFFAOYSA-N	148.074896296							107392
AC1OA4HI	LSM-18747	BRD-K88035734	6747420	InChI=1S/C17H14N4O4/c1-10-7-13(21(24)25)8-12(16(10)22)9-18-20-11(2)19-15-6-4-3-5-14(15)17(20)23/h3-9,22H,1-2H3	QLTQZWVOUNTISN-UHFFFAOYSA-N	CC1=Nc2ccccc2C(=O)N1N=Cc3cc(cc(C)c3O)[N+](=O)[O-]	BroadT	BRD-K88035734	BRD-K88035734-001-06-6	InterBioScreen Ltd.	STOCK4S-21175			Cc1cc(cc(C=Nn2c(C)nc3ccccc3c2=O)c1O)[N+]([O-])=O	InChI=1S/C17H14N4O4/c1-10-7-13(21(24)25)8-12(16(10)22)9-18-20-11(2)19-15-6-4-3-5-14(15)17(20)23/h3-9,22H,1-2H3	QLTQZWVOUNTISN-UHFFFAOYSA-N	338.101504968							
4-[5-(Carboxymethyl)-4-phenyl-1,3-thiazol-2-yl]benzenecarboxylic acid	LSM-18748	SID24817733, BRD-K34577416	1472848	InChI=1S/C18H13NO4S/c20-15(21)10-14-16(11-4-2-1-3-5-11)19-17(24-14)12-6-8-13(9-7-12)18(22)23/h1-9H,10H2,(H,20,21)(H,22,23)	IAQPAVNNMOSSAZ-UHFFFAOYSA-N	OC(=O)Cc1sc(nc1c2ccccc2)c3ccc(cc3)C(=O)O	BroadT	BRD-K34577416	BRD-K34577416-001-05-9	Key Organics Ltd.	2T-0890			OC(=O)Cc1sc(nc1-c1ccccc1)-c1ccc(cc1)C(O)=O	InChI=1S/C18H13NO4S/c20-15(21)10-14-16(11-4-2-1-3-5-11)19-17(24-14)12-6-8-13(9-7-12)18(22)23/h1-9H,10H2,(H,20,21)(H,22,23)	IAQPAVNNMOSSAZ-UHFFFAOYSA-N	339.056528596							107394
STK858139	LSM-18749	SID26671558, BRD-A32966160	3741377	InChI=1S/C19H19N3O5S/c1-3-26-13-7-6-12-9-14(19(23)20-15(12)10-13)17-11-16(18-5-4-8-27-18)21-22(17)28(2,24)25/h4-10,17H,3,11H2,1-2H3,(H,20,23)	ROUOWVCZUDHCAQ-UHFFFAOYSA-N	CCOc1ccc2cc(C3CC(=NN3S(=O)(=O)C)c4occc4)c(O)nc2c1	BroadT	BRD-A32966160	BRD-A32966160-001-05-6	InterBioScreen Ltd.	STOCK3S-46599			CCOc1ccc2cc(C3CC(=NN3S(C)(=O)=O)c3ccco3)c(O)nc2c1	InChI=1S/C19H19N3O5S/c1-3-26-13-7-6-12-9-14(19(23)20-15(12)10-13)17-11-16(18-5-4-8-27-18)21-22(17)28(2,24)25/h4-10,17H,3,11H2,1-2H3,(H,20,23)	ROUOWVCZUDHCAQ-UHFFFAOYSA-N	401.104541428							107395
MLS000032607	LSM-18750	SID845428, BRD-A03299823	647779	InChI=1S/C22H28N2O3S2/c25-20(14-18-9-4-12-28-18)24(15-17-8-3-11-27-17)21(19-10-5-13-29-19)22(26)23-16-6-1-2-7-16/h4-5,9-10,12-13,16-17,21H,1-3,6-8,11,14-15H2,(H,23,26)	CRZVIMUDNUKTIP-UHFFFAOYSA-N	O=C(Cc1cccs1)N(CC2CCCO2)C(C(=O)NC3CCCC3)c4cccs4	BroadT	BRD-A03299823	BRD-A03299823-001-05-6	Asinex Ltd.	ASN 05376874			O=C(NC1CCCC1)C(N(CC1CCCO1)C(=O)Cc1cccs1)c1cccs1	InChI=1S/C22H28N2O3S2/c25-20(14-18-9-4-12-28-18)24(15-17-8-3-11-27-17)21(19-10-5-13-29-19)22(26)23-16-6-1-2-7-16/h4-5,9-10,12-13,16-17,21H,1-3,6-8,11,14-15H2,(H,23,26)	CRZVIMUDNUKTIP-UHFFFAOYSA-N	432.154134156							107396
ST50916929	LSM-18751	SID14728008, BRD-K69559673	1220811	InChI=1S/C15H17FN4O/c1-18-14(6-7-17-18)15(21)20-10-8-19(9-11-20)13-4-2-12(16)3-5-13/h2-7H,8-11H2,1H3	YZZCPCGURLBDPK-UHFFFAOYSA-N	Cn1nccc1C(=O)N2CCN(CC2)c3ccc(F)cc3	BroadT	BRD-K69559673	BRD-K69559673-001-05-3	Specs	AK-968/12097199			Cn1nccc1C(=O)N1CCN(CC1)c1ccc(F)cc1	InChI=1S/C15H17FN4O/c1-18-14(6-7-17-18)15(21)20-10-8-19(9-11-20)13-4-2-12(16)3-5-13/h2-7H,8-11H2,1H3	YZZCPCGURLBDPK-UHFFFAOYSA-N	288.138639404							107397
N-[4-(Benzyloxy)phenyl]methanesulfonamide	LSM-18752	SID7973505, BRD-K50914780	669037	InChI=1S/C14H15NO3S/c1-19(16,17)15-13-7-9-14(10-8-13)18-11-12-5-3-2-4-6-12/h2-10,15H,11H2,1H3	ARUAGQGCXPFUOS-UHFFFAOYSA-N	CS(=O)(=O)Nc1ccc(OCc2ccccc2)cc1	BroadT	BRD-K50914780	BRD-K50914780-001-05-1	ChemBridge Corporation	5343512			CS(=O)(=O)Nc1ccc(OCc2ccccc2)cc1	InChI=1S/C14H15NO3S/c1-19(16,17)15-13-7-9-14(10-8-13)18-11-12-5-3-2-4-6-12/h2-10,15H,11H2,1H3	ARUAGQGCXPFUOS-UHFFFAOYSA-N	277.07726404							107398
1-(2-Hydroxyphenyl)-2-(2H-tetrazol-5-yl)ethanone	LSM-18753	BRD-K98157219	902451	InChI=1S/C9H8N4O2/c14-7-4-2-1-3-6(7)8(15)5-9-10-12-13-11-9/h1-4,14H,5H2,(H,10,11,12,13)	HISCKGVWGVRJTC-UHFFFAOYSA-N	Oc1ccccc1C(=O)Cc2nn[nH]n2	BroadT	BRD-K98157219	BRD-K98157219-001-05-2	Specs	AK-820/12460008			Oc1ccccc1C(=O)Cc1nn[nH]n1	InChI=1S/C9H8N4O2/c14-7-4-2-1-3-6(7)8(15)5-9-10-12-13-11-9/h1-4,14H,5H2,(H,10,11,12,13)	HISCKGVWGVRJTC-UHFFFAOYSA-N	204.064725536							107399
ST50758531	LSM-15282	BRD-K67768698	2953917	InChI=1S/C22H32N2O2/c1-24(2)7-6-23-21(25)19-11-18(4-5-20(19)26-3)22-12-15-8-16(13-22)10-17(9-15)14-22/h4-5,11,15-17H,6-10,12-14H2,1-3H3,(H,23,25)	ZNVLSXUUHIHQKB-UHFFFAOYSA-N	COc1ccc(cc1C(=O)NCCN(C)C)C23CC4CC(CC(C4)C2)C3	BroadT	BRD-K67768698	BRD-K67768698-003-05-9	ChemBridge Corporation	7782086		Cl	COc1ccc(cc1C(=O)NCCN(C)C)C12CC3CC(CC(C3)C1)C2.Cl	InChI=1S/C22H32N2O2.ClH/c1-24(2)7-6-23-21(25)19-11-18(4-5-20(19)26-3)22-12-15-8-16(13-22)10-17(9-15)14-22;/h4-5,11,15-17H,6-10,12-14H2,1-3H3,(H,23,25);1H	OYWNLVXEUCYUGL-UHFFFAOYSA-N	356.246378284							103929, 103929
SMR000196046	LSM-18754	SID17432878, BRD-K40560710	805875	InChI=1S/C15H15N3O3S2/c1-2-21-12(19)8-11-9-23-15(16-11)18-14(22)17-13(20)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H2,16,17,18,20,22)	NZKFCGVVILYGBE-UHFFFAOYSA-N	CCOC(=O)Cc1csc(NC(=S)NC(=O)c2ccccc2)n1	BroadT	BRD-K40560710	BRD-K40560710-001-05-0	ChemBridge Corporation	6690640			CCOC(=O)Cc1csc(NC(=S)NC(=O)c2ccccc2)n1	InChI=1S/C15H15N3O3S2/c1-2-21-12(19)8-11-9-23-15(16-11)18-14(22)17-13(20)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H2,16,17,18,20,22)	NZKFCGVVILYGBE-UHFFFAOYSA-N	349.05548275							107400
SMR000160310	LSM-43792	SID17387723, BRD-K48039403	1001185	InChI=1S/C23H23BrClN3O3/c1-15-18(13-28(2)27-15)12-26-23(29)9-5-16-4-7-21(30-3)17(10-16)14-31-22-8-6-19(25)11-20(22)24/h4-11,13H,12,14H2,1-3H3,(H,26,29)/b9-5+	GSKFOCKLAVDXHB-WEVVVXLNSA-N	COc1ccc(\C=C\C(=O)NCc2cn(C)nc2C)cc1COc3ccc(Cl)cc3Br	BroadT	BRD-K48039403	BRD-K48039403-001-05-9	Specs	AK-968/41926122			COc1ccc(\C=C\C(=O)NCc2cn(C)nc2C)cc1COc1ccc(Cl)cc1Br	InChI=1S/C23H23BrClN3O3/c1-15-18(13-28(2)27-15)12-26-23(29)9-5-16-4-7-21(30-3)17(10-16)14-31-22-8-6-19(25)11-20(22)24/h4-11,13H,12,14H2,1-3H3,(H,26,29)/b9-5+	GSKFOCKLAVDXHB-WEVVVXLNSA-N	503.061131936							
MLS000698742	LSM-43793	SID24788108, BRD-K24454159	1227642	InChI=1S/C15H10N2O4S/c16-15-17(9-3-4-11-12(6-9)21-8-20-11)14(18)13(22-15)7-10-2-1-5-19-10/h1-7,16H,8H2/b13-7-,16-15?	DWHKQRPRTKFGKY-HPAZJXPTSA-N	N=C1S\C(=C/c2occc2)\C(=O)N1c3ccc4OCOc4c3	BroadT	BRD-K24454159	BRD-K24454159-001-06-2	Specs	AN-648/40740019			N=C1S\C(=C/c2ccco2)C(=O)N1c1ccc2OCOc2c1	InChI=1S/C15H10N2O4S/c16-15-17(9-3-4-11-12(6-9)21-8-20-11)14(18)13(22-15)7-10-2-1-5-19-10/h1-7,16H,8H2/b13-7-,16-15?	DWHKQRPRTKFGKY-HPAZJXPTSA-N	314.03612751							
SMR000002504	LSM-18757	SID852384, BRD-A96597548	655007	InChI=1S/C21H28N6O4S/c1-14(20(29)24-13-15-5-3-2-4-6-15)27(8-7-26-9-11-31-12-10-26)21(30)18-16(22)17(19(23)28)25-32-18/h2-6,14H,7-13,22H2,1H3,(H2,23,28)(H,24,29)	DJFINWFRGRKWLZ-UHFFFAOYSA-N	CC(N(CCN1CCOCC1)C(=O)c2snc(C(=O)N)c2N)C(=O)NCc3ccccc3	BroadT	BRD-A96597548	BRD-A96597548-001-01-4	Asinex Ltd.	ASN 03779204			CC(N(CCN1CCOCC1)C(=O)c1snc(C(N)=O)c1N)C(=O)NCc1ccccc1	InChI=1S/C21H28N6O4S/c1-14(20(29)24-13-15-5-3-2-4-6-15)27(8-7-26-9-11-31-12-10-26)21(30)18-16(22)17(19(23)28)25-32-18/h2-6,14H,7-13,22H2,1H3,(H2,23,28)(H,24,29)	DJFINWFRGRKWLZ-UHFFFAOYSA-N	460.189274126							107403
MLS000040158	LSM-18758	SID861033, BRD-A65644260	662303	InChI=1S/C21H24N4O3/c22-14-16(21(26)28-15-6-2-1-3-7-15)19-20(25-10-12-27-13-11-25)24-18-9-5-4-8-17(18)23-19/h4-5,8-9,15-16H,1-3,6-7,10-13H2	LSTQBCLFJHIIGJ-UHFFFAOYSA-N	O=C(OC1CCCCC1)C(C#N)c2nc3ccccc3nc2N4CCOCC4	BroadT	BRD-A65644260	BRD-A65644260-001-05-8	InterBioScreen Ltd.	STOCK3S-97526			O=C(OC1CCCCC1)C(C#N)c1nc2ccccc2nc1N1CCOCC1	InChI=1S/C21H24N4O3/c22-14-16(21(26)28-15-6-2-1-3-7-15)19-20(25-10-12-27-13-11-25)24-18-9-5-4-8-17(18)23-19/h4-5,8-9,15-16H,1-3,6-7,10-13H2	LSTQBCLFJHIIGJ-UHFFFAOYSA-N	380.184840668							107404
MLS000590203	LSM-18759	SID22402022, BRD-K90785589	1997393	InChI=1S/C15H15N5O4S/c1-23-11-4-3-9(7-12(11)24-2)13(21)18-15(25)20-19-14(22)10-8-16-5-6-17-10/h3-8H,1-2H3,(H,19,22)(H2,18,20,21,25)	UDICXUBEONZJND-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)NC(=S)NNC(=O)c2cnccn2	BroadT	BRD-K90785589	BRD-K90785589-001-06-8	InterBioScreen Ltd.	STOCK4S-31643			COc1ccc(cc1OC)C(=O)NC(=S)NNC(=O)c1cnccn1	InChI=1S/C15H15N5O4S/c1-23-11-4-3-9(7-12(11)24-2)13(21)18-15(25)20-19-14(22)10-8-16-5-6-17-10/h3-8H,1-2H3,(H,19,22)(H2,18,20,21,25)	UDICXUBEONZJND-UHFFFAOYSA-N	361.0844747							107405
MLS000037709	LSM-18760	SID859454, BRD-K71430627	660757	InChI=1S/C17H18N2O/c1-3-17-18-14-9-5-6-10-15(14)19(17)12-13-8-4-7-11-16(13)20-2/h4-11H,3,12H2,1-2H3	NNTTVNGXVPOWDS-UHFFFAOYSA-N	CCc1nc2ccccc2n1Cc3ccccc3OC	BroadT	BRD-K71430627	BRD-K71430627-001-05-0	InterBioScreen Ltd.	STOCK3S-18122			CCc1nc2ccccc2n1Cc1ccccc1OC	InChI=1S/C17H18N2O/c1-3-17-18-14-9-5-6-10-15(14)19(17)12-13-8-4-7-11-16(13)20-2/h4-11H,3,12H2,1-2H3	NNTTVNGXVPOWDS-UHFFFAOYSA-N	266.141913216							107406
MLS000682934	LSM-43794	SID24823014, BRD-K95295111	6525830	InChI=1S/C23H17ClN2O5/c1-13-10-14(22(28)29)6-8-17(13)20-9-7-16(31-20)11-19-21(27)26(23(30)25-19)12-15-4-2-3-5-18(15)24/h2-11H,12H2,1H3,(H,25,30)(H,28,29)/b19-11-	UYEYPATYXUVPQG-ODLFYWEKSA-N	Cc1cc(ccc1c2oc(\C=C\3/NC(=O)N(Cc4ccccc4Cl)C3=O)cc2)C(=O)O	BroadT	BRD-K95295111	BRD-K95295111-001-06-0	ChemDiv Inc.	4759-7758			Cc1cc(ccc1-c1ccc(\C=C2/NC(=O)N(Cc3ccccc3Cl)C2=O)o1)C(O)=O	InChI=1S/C23H17ClN2O5/c1-13-10-14(22(28)29)6-8-17(13)20-9-7-16(31-20)11-19-21(27)26(23(30)25-19)12-15-4-2-3-5-18(15)24/h2-11H,12H2,1H3,(H,25,30)(H,28,29)/b19-11-	UYEYPATYXUVPQG-ODLFYWEKSA-N	436.082599374							
CBMICRO_041086	LSM-18762	BRD-K21391690	2881000	InChI=1S/C11H12N4O2S/c1-14-9(6-10(16)15(2)11(14)17)13-12-7-8-4-3-5-18-8/h3-7,13H,1-2H3	YMXNPWMREYPIKK-UHFFFAOYSA-N	CN1C(=O)C=C(NN=Cc2cccs2)N(C)C1=O	BroadT	BRD-K21391690	BRD-K21391690-001-05-7	ChemBridge Corporation	6031154			Cn1c(NN=Cc2cccs2)cc(=O)n(C)c1=O	InChI=1S/C11H12N4O2S/c1-14-9(6-10(16)15(2)11(14)17)13-12-7-8-4-3-5-18-8/h3-7,13H,1-2H3	YMXNPWMREYPIKK-UHFFFAOYSA-N	264.068096354							107408
T0506-0291	LSM-18763	SID17516514, BRD-K43087091	4074317	InChI=1S/C25H19NO5/c1-14-7-5-12-20(15(14)2)26-21(27)13-31-25(30)19-11-6-10-18-22(19)24(29)17-9-4-3-8-16(17)23(18)28/h3-12H,13H2,1-2H3,(H,26,27)	VRAKKOVOEZOSBS-UHFFFAOYSA-N	Cc1cccc(NC(=O)COC(=O)c2cccc3C(=O)c4ccccc4C(=O)c23)c1C	BroadT	BRD-K43087091	BRD-K43087091-001-05-0	Enamine Ltd.	T0506-0291			Cc1cccc(NC(=O)COC(=O)c2cccc3C(=O)c4ccccc4C(=O)c23)c1C	InChI=1S/C25H19NO5/c1-14-7-5-12-20(15(14)2)26-21(27)13-31-25(30)19-11-6-10-18-22(19)24(29)17-9-4-3-8-16(17)23(18)28/h3-12H,13H2,1-2H3,(H,26,27)	VRAKKOVOEZOSBS-UHFFFAOYSA-N	413.126322718							107409
N-Benzo[1,3]dioxol-5-yl-2-[4-(4-phenyl-thiazol-2-yl)-piperazin-1-yl]-acetamide	LSM-18764	SID849261, BRD-K42956625	651738	InChI=1S/C22H22N4O3S/c27-21(23-17-6-7-19-20(12-17)29-15-28-19)13-25-8-10-26(11-9-25)22-24-18(14-30-22)16-4-2-1-3-5-16/h1-7,12,14H,8-11,13,15H2,(H,23,27)	QRSQIARFCOHQNS-UHFFFAOYSA-N	O=C(CN1CCN(CC1)c2nc(cs2)c3ccccc3)Nc4ccc5OCOc5c4	BroadT	BRD-K42956625	BRD-K42956625-001-05-2	Asinex Ltd.	ASN 06588360			O=C(CN1CCN(CC1)c1nc(cs1)-c1ccccc1)Nc1ccc2OCOc2c1	InChI=1S/C22H22N4O3S/c27-21(23-17-6-7-19-20(12-17)29-15-28-19)13-25-8-10-26(11-9-25)22-24-18(14-30-22)16-4-2-1-3-5-16/h1-7,12,14H,8-11,13,15H2,(H,23,27)	QRSQIARFCOHQNS-UHFFFAOYSA-N	422.141261294							107410
AC1NN6RG	LSM-18765	SID24810511, BRD-A63220563	5063380	InChI=1S/C22H34N4OS/c1-16-7-6-8-19(18(16)3)24-11-13-25(14-12-24)20(27)9-10-26-17(2)15-22(4,5)23-21(26)28/h6-8,17H,9-15H2,1-5H3,(H,23,28)	JDNVZZJNIMPBEL-UHFFFAOYSA-N	CC1CC(C)(C)N=C(S)N1CCC(=O)N2CCN(CC2)c3cccc(C)c3C	BroadT	BRD-A63220563	BRD-A63220563-001-05-3	ChemDiv Inc.	C069-0080			CC1CC(C)(C)N=C(S)N1CCC(=O)N1CCN(CC1)c1cccc(C)c1C	InChI=1S/C22H34N4OS/c1-16-7-6-8-19(18(16)3)24-11-13-25(14-12-24)20(27)9-10-26-17(2)15-22(4,5)23-21(26)28/h6-8,17H,9-15H2,1-5H3,(H,23,28)	JDNVZZJNIMPBEL-UHFFFAOYSA-N	402.245332438							107411
MLS001013316	LSM-18766	SID24831920, BRD-K97674696	2375394	InChI=1S/C19H15NO2S/c21-18(14-23-19-8-4-5-13-20(19)22)17-11-9-16(10-12-17)15-6-2-1-3-7-15/h1-13H,14H2	UDWVETSTKCQUBA-UHFFFAOYSA-N	[O-][n+]1ccccc1SCC(=O)c2ccc(cc2)c3ccccc3	BroadT	BRD-K97674696	BRD-K97674696-001-05-9	Enamine Ltd.	T0511-5346			[O-][n+]1ccccc1SCC(=O)c1ccc(cc1)-c1ccccc1	InChI=1S/C19H15NO2S/c21-18(14-23-19-8-4-5-13-20(19)22)17-11-9-16(10-12-17)15-6-2-1-3-7-15/h1-13H,14H2	UDWVETSTKCQUBA-UHFFFAOYSA-N	321.08234942							107412
SMR000078669	LSM-18767	SID26669400, SID4254949, BRD-K56253992	1248841	InChI=1S/C22H18N6O2S/c1-14-4-8-17(9-5-14)28-21(19-3-2-10-30-19)26-27-22(28)31-13-20(29)24-16-7-6-15-12-23-25-18(15)11-16/h2-12H,13H2,1H3,(H,23,25)(H,24,29)	CKRFYDXCBMBJSF-UHFFFAOYSA-N	Cc1ccc(cc1)n2c(SCC(=O)Nc3ccc4c[nH]nc4c3)nnc2c5occc5	BroadT	BRD-K56253992	BRD-K56253992-001-05-2	ChemBridge Corporation	7911363			Cc1ccc(cc1)-n1c(SCC(=O)Nc2ccc3c[nH]nc3c2)nnc1-c1ccco1	InChI=1S/C22H18N6O2S/c1-14-4-8-17(9-5-14)28-21(19-3-2-10-30-19)26-27-22(28)31-13-20(29)24-16-7-6-15-12-23-25-18(15)11-16/h2-12H,13H2,1H3,(H,23,25)(H,24,29)	CKRFYDXCBMBJSF-UHFFFAOYSA-N	430.121194566							107413
2K-086	LSM-43795	SID17410583, BRD-K22740448	5523557	InChI=1S/C15H13N5/c1-20(2)15(13(10-17)11-18)7-8-19-14-5-3-12(9-16)4-6-14/h3-8,19H,1-2H3/b8-7+	HAASBDMHPOSVOU-BQYQJAHWSA-N	CN(C)C(=C(C#N)C#N)\C=C\Nc1ccc(cc1)C#N	BroadT	BRD-K22740448	BRD-K22740448-001-05-9	Key Organics Ltd.	2K-086			CN(C)C(\C=C\Nc1ccc(cc1)C#N)=C(C#N)C#N	InChI=1S/C15H13N5/c1-20(2)15(13(10-17)11-18)7-8-19-14-5-3-12(9-16)4-6-14/h3-8,19H,1-2H3/b8-7+	HAASBDMHPOSVOU-BQYQJAHWSA-N	263.117095466							
MLS000109613	LSM-18769	SID7973608, BRD-K70331047	1087398	InChI=1S/C20H23NO6/c1-11-15(19(23)26-5)17(16(20(24)27-6)12(2)21(11)3)13-7-9-14(10-8-13)18(22)25-4/h7-10,17H,1-6H3	KRPXKIUVLKBXSJ-UHFFFAOYSA-N	COC(=O)C1=C(C)N(C)C(=C(C1c2ccc(cc2)C(=O)OC)C(=O)OC)C	BroadT	BRD-K70331047	BRD-K70331047-001-05-3	ChemBridge Corporation	6045710			COC(=O)c1ccc(cc1)C1C(C(=O)OC)=C(C)N(C)C(C)=C1C(=O)OC	InChI=1S/C20H23NO6/c1-11-15(19(23)26-5)17(16(20(24)27-6)12(2)21(11)3)13-7-9-14(10-8-13)18(22)25-4/h7-10,17H,1-6H3	KRPXKIUVLKBXSJ-UHFFFAOYSA-N	373.152537466							107415
MLS000092472	LSM-18770	SID4251873, BRD-A20282696	3245505	InChI=1S/C22H24N2O5S/c25-21(10-11-22(26)27)24-13-12-16-14-17(8-9-20(16)24)30(28,29)23-19-7-3-5-15-4-1-2-6-18(15)19/h1-2,4,6,8-9,14,19,23H,3,5,7,10-13H2,(H,26,27)	AOUWQUSRMDJTJV-UHFFFAOYSA-N	OC(=O)CCC(=O)N1CCc2cc(ccc12)S(=O)(=O)NC3CCCc4ccccc34	BroadT	BRD-A20282696	BRD-A20282696-001-05-5	ChemDiv Inc.	C563-0522			OC(=O)CCC(=O)N1CCc2cc(ccc12)S(=O)(=O)NC1CCCc2ccccc12	InChI=1S/C22H24N2O5S/c25-21(10-11-22(26)27)24-13-12-16-14-17(8-9-20(16)24)30(28,29)23-19-7-3-5-15-4-1-2-6-18(15)19/h1-2,4,6,8-9,14,19,23H,3,5,7,10-13H2,(H,26,27)	AOUWQUSRMDJTJV-UHFFFAOYSA-N	428.140592578							107416
MLS000080519	LSM-2479	SID57287672, SID863840, SID56373725, BRD-K21640605	665093	InChI=1S/C20H19N3O4S/c1-3-10-23-19(14-6-4-5-7-18(14)27-2)21-22-20(23)28-12-17(26)13-8-9-15(24)16(25)11-13/h3-9,11,24-25H,1,10,12H2,2H3	HDLQKEKTQTTWGA-UHFFFAOYSA-N	COc1ccccc1c2nnc(SCC(=O)c3ccc(O)c(O)c3)n2CC=C	BroadT	BRD-K21640605	BRD-K21640605-001-05-1	Sanford-Burnham Medical Research Institute	MLS-0014097.0001			COc1ccccc1-c1nnc(SCC(=O)c2ccc(O)c(O)c2)n1CC=C	InChI=1S/C20H19N3O4S/c1-3-10-23-19(14-6-4-5-7-18(14)27-2)21-22-20(23)28-12-17(26)13-8-9-15(24)16(25)11-13/h3-9,11,24-25H,1,10,12H2,2H3	HDLQKEKTQTTWGA-UHFFFAOYSA-N	397.109626808							92388
CHEMBL1162110	LSM-18771	SID49825807, BRD-K03581230	1255990	InChI=1S/C22H16Cl2N2O5/c23-14-7-10-19(17(24)11-14)31-12-20(27)25-15-8-5-13(6-9-15)21(28)26-18-4-2-1-3-16(18)22(29)30/h1-11H,12H2,(H,25,27)(H,26,28)(H,29,30)	YPAJYCVUCIUYLQ-UHFFFAOYSA-N	OC(=O)c1ccccc1NC(=O)c2ccc(NC(=O)COc3ccc(Cl)cc3Cl)cc2	BroadT	BRD-K03581230	BRD-K03581230-001-07-8	ChemBridge Corporation	7971347			OC(=O)c1ccccc1NC(=O)c1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1	InChI=1S/C22H16Cl2N2O5/c23-14-7-10-19(17(24)11-14)31-12-20(27)25-15-8-5-13(6-9-15)21(28)26-18-4-2-1-3-16(18)22(29)30/h1-11H,12H2,(H,25,27)(H,26,28)(H,29,30)	YPAJYCVUCIUYLQ-UHFFFAOYSA-N	458.043627052							107417
SMR000017884	LSM-18772	SID7969830, BRD-A28942447	5060477	InChI=1S/C21H22N4O2S/c26-20-19(28-21-22-14-23-25(20)21)18(17-7-4-12-27-17)24-10-8-16(9-11-24)13-15-5-2-1-3-6-15/h1-7,12,14,16,18,26H,8-11,13H2	YMELEISHTHTXSF-UHFFFAOYSA-N	Oc1c(sc2ncnn12)C(N3CCC(Cc4ccccc4)CC3)c5occc5	BroadT	BRD-A28942447	BRD-A28942447-001-04-1	Life Chemicals Inc.	F1805-0278			Oc1c(sc2ncnn12)C(N1CCC(Cc2ccccc2)CC1)c1ccco1	InChI=1S/C21H22N4O2S/c26-20-19(28-21-22-14-23-25(20)21)18(17-7-4-12-27-17)24-10-8-16(9-11-24)13-15-5-2-1-3-6-15/h1-7,12,14,16,18,26H,8-11,13H2	YMELEISHTHTXSF-UHFFFAOYSA-N	394.146346674							107418
MLS000678825	LSM-18773	SID22403184, BRD-K58779662	747951	InChI=1S/C18H19NO6/c1-10-6-13(7-11(2)16(10)20)19-25-18(21)12-8-14(22-3)17(24-5)15(9-12)23-4/h6-9H,1-5H3	DTVHIFQMJDOHJN-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)ON=C2C=C(C)C(=O)C(=C2)C	BroadT	BRD-K58779662	BRD-K58779662-001-05-3	ChemBridge Corporation	6628359			COc1cc(cc(OC)c1OC)C(=O)ON=C1C=C(C)C(=O)C(C)=C1	InChI=1S/C18H19NO6/c1-10-6-13(7-11(2)16(10)20)19-25-18(21)12-8-14(22-3)17(24-5)15(9-12)23-4/h6-9H,1-5H3	DTVHIFQMJDOHJN-UHFFFAOYSA-N	345.121237338							107419
BAS 03551158	LSM-18774	SID14722731, BRD-K33199624	1917784	InChI=1S/C18H23N3O2/c1-3-18(4-2)11-12-7-5-6-8-13(12)15-14(18)16(23)21-17(20-15)19-9-10-22/h5-8,22H,3-4,9-11H2,1-2H3,(H2,19,20,21,23)	MBCNBIJDGYZRSY-UHFFFAOYSA-N	CCC1(CC)Cc2ccccc2c3nc(NCCO)nc(O)c13	BroadT	BRD-K33199624	BRD-K33199624-001-05-1	Asinex Ltd.	BAS 03551158			CCC1(CC)Cc2ccccc2-c2nc(NCCO)nc(O)c12	InChI=1S/C18H23N3O2/c1-3-18(4-2)11-12-7-5-6-8-13(12)15-14(18)16(23)21-17(20-15)19-9-10-22/h5-8,22H,3-4,9-11H2,1-2H3,(H2,19,20,21,23)	MBCNBIJDGYZRSY-UHFFFAOYSA-N	313.179027006							107420
SMR000109574	LSM-18775	SID7978091, SID85302935, BRD-K06818088	1284704	InChI=1S/C25H21N5O3/c26-22-19(24(31)27-16-18-9-6-14-33-18)15-20-23(28-21-10-4-5-12-29(21)25(20)32)30(22)13-11-17-7-2-1-3-8-17/h1-10,12,14-15,26H,11,13,16H2,(H,27,31)	DAMDQEJEZBNBET-UHFFFAOYSA-N	N=C1N(CCc2ccccc2)C3=C(C=C1C(=O)NCc4occc4)C(=O)N5C=CC=CC5=N3	BroadT	BRD-K06818088	BRD-K06818088-001-05-8	ChemBridge Corporation	7169996			N=c1c(cc2c(nc3ccccn3c2=O)n1CCc1ccccc1)C(=O)NCc1ccco1	InChI=1S/C25H21N5O3/c26-22-19(24(31)27-16-18-9-6-14-33-18)15-20-23(28-21-10-4-5-12-29(21)25(20)32)30(22)13-11-17-7-2-1-3-8-17/h1-10,12,14-15,26H,11,13,16H2,(H,27,31)	DAMDQEJEZBNBET-UHFFFAOYSA-N	439.164439582							107421
ZINC04820252	LSM-43796	SID26665605, BRD-K95807815	5519976	InChI=1S/C20H22N4O4/c1-3-23(4-2)15-9-7-14(8-10-15)21-12-17-18(25)22-20(27)24(19(17)26)13-16-6-5-11-28-16/h5-12,21H,3-4,13H2,1-2H3,(H,22,25,27)/b17-12+	USWZLOJTTQJPQM-SFQUDFHCSA-N	CCN(CC)c1ccc(N\C=C\2/C(=O)NC(=O)N(Cc3occc3)C2=O)cc1	BroadT	BRD-K95807815	BRD-K95807815-001-05-3	InterBioScreen Ltd.	STOCK2S-41324			CCN(CC)c1ccc(N\C=C2/C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1	InChI=1S/C20H22N4O4/c1-3-23(4-2)15-9-7-14(8-10-15)21-12-17-18(25)22-20(27)24(19(17)26)13-16-6-5-11-28-16/h5-12,21H,3-4,13H2,1-2H3,(H,22,25,27)/b17-12+	USWZLOJTTQJPQM-SFQUDFHCSA-N	382.164105224							
MLS000698880	LSM-18777	SID22404499, BRD-K92314307	4415927	InChI=1S/C17H23N7/c1-10-3-11(2)24(23-10)16-21-19-15(20-22-16)18-17-7-12-4-13(8-17)6-14(5-12)9-17/h3,12-14H,4-9H2,1-2H3,(H,18,19,20)	MZJQFYGLAXOAGY-UHFFFAOYSA-N	Cc1cc(C)n(n1)c2nnc(NC34CC5CC(CC(C5)C3)C4)nn2	BroadT	BRD-K92314307	BRD-K92314307-001-05-8	Specs	AG-227/40703622			Cc1cc(C)n(n1)-c1nnc(NC23CC4CC(CC(C4)C2)C3)nn1	InChI=1S/C17H23N7/c1-10-3-11(2)24(23-10)16-21-19-15(20-22-16)18-17-7-12-4-13(8-17)6-14(5-12)9-17/h3,12-14H,4-9H2,1-2H3,(H,18,19,20)	MZJQFYGLAXOAGY-UHFFFAOYSA-N	325.201493806							107423
ZINC01121767	LSM-43797	SID4257261, BRD-K95820117	1298379	InChI=1S/C17H19N7OS/c18-15-14-16(20-11-19-15)22-17(21-14)26-10-13(25)24-8-6-23(7-9-24)12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H3,18,19,20,21,22)	NPECIKNPNFLFCI-UHFFFAOYSA-N	Nc1[nH]cnc2nc(SCC(=O)N3CCN(CC3)c4ccccc4)nc12	BroadT	BRD-K95820117	BRD-K95820117-001-05-1	ChemBridge Corporation	7824158			Nc1ncnc2[nH]c(SCC(=O)N3CCN(CC3)c3ccccc3)nc12	InChI=1S/C17H19N7OS/c18-15-14-16(20-11-19-15)22-17(21-14)26-10-13(25)24-8-6-23(7-9-24)12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H3,18,19,20,21,22)	NPECIKNPNFLFCI-UHFFFAOYSA-N	369.137178988							
SMR000219396	LSM-18779	SID17513166, BRD-K08648073	5595685	InChI=1S/C14H15N3O4S2/c1-3-7-5-8(13(20)21-4-2)12(23-7)15-6-9-10(18)16-14(22)17-11(9)19/h5-6,15H,3-4H2,1-2H3,(H2,16,17,18,19,22)	MRAINDNXXUSXSU-UHFFFAOYSA-N	CCOC(=O)c1cc(CC)sc1NC=C2C(=O)NC(=S)NC2=O	BroadT	BRD-K08648073	BRD-K08648073-001-07-0	InterBioScreen Ltd.	STOCK3S-87290			CCOC(=O)c1cc(CC)sc1NC=C1C(=O)NC(=S)NC1=O	InChI=1S/C14H15N3O4S2/c1-3-7-5-8(13(20)21-4-2)12(23-7)15-6-9-10(18)16-14(22)17-11(9)19/h5-6,15H,3-4H2,1-2H3,(H2,16,17,18,19,22)	MRAINDNXXUSXSU-UHFFFAOYSA-N	353.05039737							107425
MLS001005274	LSM-18780	SID24828127, BRD-K20130171	2404824	InChI=1S/C17H19ClN2O/c1-13(2)20(15-6-4-3-5-7-15)16-10-8-14(9-11-16)19-17(21)12-18/h3-11,13H,12H2,1-2H3,(H,19,21)	JTAXNZDNUBCRFI-UHFFFAOYSA-N	CC(C)N(c1ccccc1)c2ccc(NC(=O)CCl)cc2	BroadT	BRD-K20130171	BRD-K20130171-001-09-0	Enamine Ltd.	T0515-0150			CC(C)N(c1ccccc1)c1ccc(NC(=O)CCl)cc1	InChI=1S/C17H19ClN2O/c1-13(2)20(15-6-4-3-5-7-15)16-10-8-14(9-11-16)19-17(21)12-18/h3-11,13H,12H2,1-2H3,(H,19,21)	JTAXNZDNUBCRFI-UHFFFAOYSA-N	302.118590958							107426
SMR000063727	LSM-18781	SID24840354, SID3711383, BRD-K60512434	2123961	InChI=1S/C21H20N6O4S2/c28-20-17-9-2-3-10-18(17)22-25-27(20)14-32-21-24-23-19(31-21)15-7-6-8-16(13-15)33(29,30)26-11-4-1-5-12-26/h2-3,6-10,13H,1,4-5,11-12,14H2	PYCOMWAHDJNYTO-UHFFFAOYSA-N	O=C1N(CSc2oc(nn2)c3cccc(c3)S(=O)(=O)N4CCCCC4)N=Nc5ccccc15	BroadT	BRD-K60512434	BRD-K60512434-001-05-1	Enamine Ltd.	T5251176			O=c1n(CSc2nnc(o2)-c2cccc(c2)S(=O)(=O)N2CCCCC2)nnc2ccccc12	InChI=1S/C21H20N6O4S2/c28-20-17-9-2-3-10-18(17)22-25-27(20)14-32-21-24-23-19(31-21)15-7-6-8-16(13-15)33(29,30)26-11-4-1-5-12-26/h2-3,6-10,13H,1,4-5,11-12,14H2	PYCOMWAHDJNYTO-UHFFFAOYSA-N	484.09874456							107427
MLS000119674	LSM-18782	SID7968318, BRD-K78366013	6324567	InChI=1S/C15H14FN3O/c1-9-13-7-17-18-15(20)14(13)10(2)19(9)8-11-3-5-12(16)6-4-11/h3-7H,8H2,1-2H3,(H,18,20)	FOJBATYLECKUFU-UHFFFAOYSA-N	Cc1c2cnnc(O)c2c(C)n1Cc3ccc(F)cc3	BroadT	BRD-K78366013	BRD-K78366013-001-05-1	ChemDiv Inc.	C799-0091			Cc1n(Cc2ccc(F)cc2)c(C)c2c(O)nncc12	InChI=1S/C15H14FN3O/c1-9-13-7-17-18-15(20)14(13)10(2)19(9)8-11-3-5-12(16)6-4-11/h3-7H,8H2,1-2H3,(H,18,20)	FOJBATYLECKUFU-UHFFFAOYSA-N	271.112090298							107428
SMR000004585	LSM-18783	SID842648, BRD-K93605990	644919	InChI=1S/C20H22ClFN4O4/c1-30-11-10-24-19(28)13-26(14-5-6-16(22)15(21)12-14)20(29)8-7-18(27)25-17-4-2-3-9-23-17/h2-6,9,12H,7-8,10-11,13H2,1H3,(H,24,28)(H,23,25,27)	BSMZCGPOJHGDLL-UHFFFAOYSA-N	COCCNC(=O)CN(C(=O)CCC(=O)Nc1ccccn1)c2ccc(F)c(Cl)c2	BroadT	BRD-K93605990	BRD-K93605990-001-05-0	Asinex Ltd.	ASN 05392575			COCCNC(=O)CN(C(=O)CCC(=O)Nc1ccccn1)c1ccc(F)c(Cl)c1	InChI=1S/C20H22ClFN4O4/c1-30-11-10-24-19(28)13-26(14-5-6-16(22)15(21)12-14)20(29)8-7-18(27)25-17-4-2-3-9-23-17/h2-6,9,12H,7-8,10-11,13H2,1H3,(H,24,28)(H,23,25,27)	BSMZCGPOJHGDLL-UHFFFAOYSA-N	436.131361134							107429
MLS000539257	LSM-18784	SID14729867, BRD-K65219655	828705	InChI=1S/C19H17N3O2/c1-23-16-7-5-15(6-8-16)22-13-21-18-11-14(4-9-19(18)22)20-12-17-3-2-10-24-17/h2-11,13,20H,12H2,1H3	JLKSRLWXOIXKNK-UHFFFAOYSA-N	COc1ccc(cc1)n2cnc3cc(NCc4occc4)ccc23	BroadT	BRD-K65219655	BRD-K65219655-001-06-8	ChemBridge Corporation	7954240			COc1ccc(cc1)-n1cnc2cc(NCc3ccco3)ccc12	InChI=1S/C19H17N3O2/c1-23-16-7-5-15(6-8-16)22-13-21-18-11-14(4-9-19(18)22)20-12-17-3-2-10-24-17/h2-11,13,20H,12H2,1H3	JLKSRLWXOIXKNK-UHFFFAOYSA-N	319.132076814							107430
MLS000555416	LSM-18785	SID17408735, SID92093135, BRD-K18007988	3134270	InChI=1S/C21H17ClN2O2S/c22-15-9-7-13(8-10-15)19(25)18-16-5-1-2-6-17(16)27-21(18)24-20(26)14-4-3-11-23-12-14/h3-4,7-12H,1-2,5-6H2,(H,24,26)	SXVQPOKDBMQXIS-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)c2c3CCCCc3sc2NC(=O)c4cccnc4	BroadT	BRD-K18007988	BRD-K18007988-001-11-3	Asinex Ltd.	BAS 01842979			Clc1ccc(cc1)C(=O)c1c(NC(=O)c2cccnc2)sc2CCCCc12	InChI=1S/C21H17ClN2O2S/c22-15-9-7-13(8-10-15)19(25)18-16-5-1-2-6-17(16)27-21(18)24-20(26)14-4-3-11-23-12-14/h3-4,7-12H,1-2,5-6H2,(H,24,26)	SXVQPOKDBMQXIS-UHFFFAOYSA-N	396.069926204							107431
MLS000882739	LSM-18786	SID26732352, BRD-K96024990	16746492	InChI=1S/C30H31FN2O/c1-20-8-7-11-26-28(20)30(34)33(19-21-9-5-4-6-10-21)29(26)25-17-14-23(18-27(25)31)22-12-15-24(16-13-22)32(2)3/h4-7,9-18,20,26,28-29H,8,19H2,1-3H3/t20-,26+,28+,29+/m1/s1	OGOYFYBJGOZDCJ-SZOMIKIBSA-N	C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc3ccccc3)[C@H]2c4ccc(cc4F)c5ccc(cc5)N(C)C	BroadT	BRD-K96024990	BRD-K96024990-001-05-1	University of Kansas CMLD	KUC101255N			C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc1ccccc1)[C@H]2c1ccc(cc1F)-c1ccc(cc1)N(C)C	InChI=1S/C30H31FN2O/c1-20-8-7-11-26-28(20)30(34)33(19-21-9-5-4-6-10-21)29(26)25-17-14-23(18-27(25)31)22-12-15-24(16-13-22)32(2)3/h4-7,9-18,20,26,28-29H,8,19H2,1-3H3/t20-,26+,28+,29+/m1/s1	OGOYFYBJGOZDCJ-SZOMIKIBSA-N	454.242041832							107432
Ethoxzolamide	LSM-18787	Cardrase, Ethamide, Ethoxzolamide	3295	InChI=1S/C9H10N2O3S2/c1-2-14-6-3-4-7-8(5-6)15-9(11-7)16(10,12)13/h3-5H,2H2,1H3,(H2,10,12,13)	OUZWUKMCLIBBOG-UHFFFAOYSA-N	CCOc1ccc2nc(sc2c1)S(=O)(=O)N	BroadT	BRD-K18131774	BRD-K18131774-001-12-7	Sigma-Aldrich	333328			CCOc1ccc2nc(sc2c1)S(N)(=O)=O	InChI=1S/C9H10N2O3S2/c1-2-14-6-3-4-7-8(5-6)15-9(11-7)16(10,12)13/h3-5H,2H2,1H3,(H2,10,12,13)	OUZWUKMCLIBBOG-UHFFFAOYSA-N	258.01328358							101096
SMR000041272	LSM-18788	SID859070, BRD-A10216015	660374	InChI=1S/C25H27N5O3/c1-32-15-16-33-25(31)20(17-26)23-24(28-22-10-6-5-9-21(22)27-23)30-13-11-29(12-14-30)18-19-7-3-2-4-8-19/h2-10,20H,11-16,18H2,1H3	FIXHZJOAPUMNOS-UHFFFAOYSA-N	COCCOC(=O)C(C#N)c1nc2ccccc2nc1N3CCN(Cc4ccccc4)CC3	BroadT	BRD-A10216015	BRD-A10216015-001-06-7	InterBioScreen Ltd.	STOCK2S-92652			COCCOC(=O)C(C#N)c1nc2ccccc2nc1N1CCN(Cc2ccccc2)CC1	InChI=1S/C25H27N5O3/c1-32-15-16-33-25(31)20(17-26)23-24(28-22-10-6-5-9-21(22)27-23)30-13-11-29(12-14-30)18-19-7-3-2-4-8-19/h2-10,20H,11-16,18H2,1H3	FIXHZJOAPUMNOS-UHFFFAOYSA-N	445.211389774							107433
AC1MDSDV	LSM-18789	BRD-K58856853	2842125	InChI=1S/C11H9ClN6O2/c12-9-5-10(13)16-11(15-9)17-14-6-7-3-1-2-4-8(7)18(19)20/h1-6H,(H3,13,15,16,17)	LUKAPZZRMFXHBT-UHFFFAOYSA-N	Nc1cc(Cl)nc(NN=Cc2ccccc2[N+](=O)[O-])n1	BroadT	BRD-K58856853	BRD-K58856853-001-05-8	Asinex Ltd.	BAS 00317473			Nc1cc(Cl)nc(NN=Cc2ccccc2[N+]([O-])=O)n1	InChI=1S/C11H9ClN6O2/c12-9-5-10(13)16-11(15-9)17-14-6-7-3-1-2-4-8(7)18(19)20/h1-6H,(H3,13,15,16,17)	LUKAPZZRMFXHBT-UHFFFAOYSA-N	292.047551298							107434
AC1MER20	LSM-18790	BRD-A15389765	2907716	InChI=1S/C15H15N5O4S/c1-19-9-4-3-8(5-10(9)20(2)15(19)24)7-16-18-14-17-13(23)11(25-14)6-12(21)22/h3-5,7,11H,6H2,1-2H3,(H,21,22)(H,17,18,23)	JDKJKELRAGWSJZ-UHFFFAOYSA-N	CN1C(=O)N(C)c2cc(C=NNC3=NC(=O)C(CC(=O)O)S3)ccc12	BroadT	BRD-A15389765	BRD-A15389765-001-06-9	ChemBridge Corporation	6640166			Cn1c2ccc(C=NNC3=NC(=O)C(CC(O)=O)S3)cc2n(C)c1=O	InChI=1S/C15H15N5O4S/c1-19-9-4-3-8(5-10(9)20(2)15(19)24)7-16-18-14-17-13(23)11(25-14)6-12(21)22/h3-5,7,11H,6H2,1-2H3,(H,21,22)(H,17,18,23)	JDKJKELRAGWSJZ-UHFFFAOYSA-N	361.0844747							107435
STK559863	LSM-18791	SID842249, BRD-A02680048	644509	InChI=1S/C15H22N4O4S/c1-8(2)6-7-19-10-11(18(4)14(22)17-12(10)20)16-15(19)24-9(3)13(21)23-5/h8-9H,6-7H2,1-5H3,(H,17,20,22)	HQQCGZDMNBZXKF-UHFFFAOYSA-N	COC(=O)C(C)Sc1nc2N(C)C(=O)NC(=O)c2n1CCC(C)C	BroadT	BRD-A02680048	BRD-A02680048-001-05-7	Life Chemicals Inc.	F1167-0062			COC(=O)C(C)Sc1nc2n(C)c(=O)[nH]c(=O)c2n1CCC(C)C	InChI=1S/C15H22N4O4S/c1-8(2)6-7-19-10-11(18(4)14(22)17-12(10)20)16-15(19)24-9(3)13(21)23-5/h8-9H,6-7H2,1-5H3,(H,17,20,22)	HQQCGZDMNBZXKF-UHFFFAOYSA-N	354.136175914							107436
CHEMBL244693	LSM-18792	SID4263806, BRD-K97467901	872330	InChI=1S/C18H17NO4/c1-2-19-15-5-3-11(9-17(20)21)7-13(15)14-8-12(10-18(22)23)4-6-16(14)19/h3-8H,2,9-10H2,1H3,(H,20,21)(H,22,23)	SPUIFQHIGRNTFJ-UHFFFAOYSA-N	CCn1c2ccc(CC(=O)O)cc2c3cc(CC(=O)O)ccc13	BroadT	BRD-K97467901	BRD-K97467901-001-05-9	ChemBridge Corporation	5579459			CCn1c2ccc(CC(O)=O)cc2c2cc(CC(O)=O)ccc12	InChI=1S/C18H17NO4/c1-2-19-15-5-3-11(9-17(20)21)7-13(15)14-8-12(10-18(22)23)4-6-16(14)19/h3-8H,2,9-10H2,1H3,(H,20,21)(H,22,23)	SPUIFQHIGRNTFJ-UHFFFAOYSA-N	311.115758034							107437
AMBCB26717934	LSM-18793	SID47197208, BRD-A81857688	23723436	InChI=1S/C21H34N2O2/c1-17(2)23-13-12-22(16-19(23)11-14-24)15-18-7-9-21(10-8-18)25-20-5-3-4-6-20/h7-10,17,19-20,24H,3-6,11-16H2,1-2H3	DMBISELTKYZNPI-UHFFFAOYSA-N	CC(C)N1CCN(Cc2ccc(OC3CCCC3)cc2)CC1CCO	BroadT	BRD-A81857688	BRD-A81857688-001-06-8	ChemBridge Corporation	26717934			CC(C)N1CCN(Cc2ccc(OC3CCCC3)cc2)CC1CCO	InChI=1S/C21H34N2O2/c1-17(2)23-13-12-22(16-19(23)11-14-24)15-18-7-9-21(10-8-18)25-20-5-3-4-6-20/h7-10,17,19-20,24H,3-6,11-16H2,1-2H3	DMBISELTKYZNPI-UHFFFAOYSA-N	346.262028348							107438
MLS000040258	LSM-18794	SID863577, BRD-A95270202	664827	InChI=1S/C14H21N3O3S/c1-9(2)7-20-14(19)17-6-4-5-11(17)12(18)16-13-15-10(3)8-21-13/h8-9,11H,4-7H2,1-3H3,(H,15,16,18)	CTBWVPPFKVSGHQ-UHFFFAOYSA-N	CC(C)COC(=O)N1CCCC1C(=O)Nc2nc(C)cs2	BroadT	BRD-A95270202	BRD-A95270202-001-06-5	InterBioScreen Ltd.	STOCK4S-76159			CC(C)COC(=O)N1CCCC1C(=O)Nc1nc(C)cs1	InChI=1S/C14H21N3O3S/c1-9(2)7-20-14(19)17-6-4-5-11(17)12(18)16-13-15-10(3)8-21-13/h8-9,11H,4-7H2,1-3H3,(H,15,16,18)	CTBWVPPFKVSGHQ-UHFFFAOYSA-N	311.130362252							107439
F0676-0066	LSM-18795	SID4244667, BRD-K63841165	3239237	InChI=1S/C18H15N5O2S/c24-16(19-11-14-7-4-10-25-14)12-26-17-9-8-15-20-21-18(23(15)22-17)13-5-2-1-3-6-13/h1-10H,11-12H2,(H,19,24)	SJXMINDUMZWKMI-UHFFFAOYSA-N	O=C(CSc1ccc2nnc(c3ccccc3)n2n1)NCc4occc4	BroadT	BRD-K63841165	BRD-K63841165-001-05-6	ChemDiv Inc.	C742-0066			O=C(CSc1ccc2nnc(-c3ccccc3)n2n1)NCc1ccco1	InChI=1S/C18H15N5O2S/c24-16(19-11-14-7-4-10-25-14)12-26-17-9-8-15-20-21-18(23(15)22-17)13-5-2-1-3-6-13/h1-10H,11-12H2,(H,19,24)	SJXMINDUMZWKMI-UHFFFAOYSA-N	365.09464546							107440
MLS001206572	LSM-18796	SID49641282, BRD-K43610438	759619	InChI=1S/C17H18N4O2/c1-3-4-17(22)18-12-5-10-15-16(11-12)20-21(19-15)13-6-8-14(23-2)9-7-13/h5-11H,3-4H2,1-2H3,(H,18,22)	NSJWOTURAYVXJE-UHFFFAOYSA-N	CCCC(=O)Nc1ccc2nn(nc2c1)c3ccc(OC)cc3	BroadT	BRD-K43610438	BRD-K43610438-001-05-1	Asinex Ltd.	BAS 02874163			CCCC(=O)Nc1ccc2nn(nc2c1)-c1ccc(OC)cc1	InChI=1S/C17H18N4O2/c1-3-4-17(22)18-12-5-10-15-16(11-12)20-21(19-15)13-6-8-14(23-2)9-7-13/h5-11H,3-4H2,1-2H3,(H,18,22)	NSJWOTURAYVXJE-UHFFFAOYSA-N	310.142975856							107441
F1537-0041	LSM-18797	SID4254737, BRD-A40190835	2948741	InChI=1S/C22H25N3O5/c1-28-17-7-8-19(20(13-17)29-2)25-21(26)14-18(22(25)27)23-15-3-5-16(6-4-15)24-9-11-30-12-10-24/h3-8,13,18,23H,9-12,14H2,1-2H3	ZJYAYAHNSRMRDK-UHFFFAOYSA-N	COc1ccc(N2C(=O)CC(Nc3ccc(cc3)N4CCOCC4)C2=O)c(OC)c1	BroadT	BRD-A40190835	BRD-A40190835-001-05-8	ChemBridge Corporation	7704652			COc1ccc(N2C(=O)CC(Nc3ccc(cc3)N3CCOCC3)C2=O)c(OC)c1	InChI=1S/C22H25N3O5/c1-28-17-7-8-19(20(13-17)29-2)25-21(26)14-18(22(25)27)23-15-3-5-16(6-4-15)24-9-11-30-12-10-24/h3-8,13,18,23H,9-12,14H2,1-2H3	ZJYAYAHNSRMRDK-UHFFFAOYSA-N	411.17942093							107442
CID 40786002	LSM-43798	BRD-A63465350	40786002	InChI=1S/C19H17ClN2O6S/c1-11-17(19(24)27-2)18(23)16(22-11)9-13-5-6-14(28-13)10-21-29(25,26)15-7-3-12(20)4-8-15/h3-9,17,21H,10H2,1-2H3/b16-9+	JWQADHOLTGFLAO-CXUHLZMHSA-N	COC(=O)C1C(=N\C(=C\c2oc(CNS(=O)(=O)c3ccc(Cl)cc3)cc2)\C1=O)C	BroadT	BRD-A63465350	BRD-A63465350-001-05-1	Asinex Ltd.	BAS 02949852			COC(=O)C1C(=O)C(=C/c2ccc(CNS(=O)(=O)c3ccc(Cl)cc3)o2)\N=C1C	InChI=1S/C19H17ClN2O6S/c1-11-17(19(24)27-2)18(23)16(22-11)9-13-5-6-14(28-13)10-21-29(25,26)15-7-3-12(20)4-8-15/h3-9,17,21H,10H2,1-2H3/b16-9+	JWQADHOLTGFLAO-CXUHLZMHSA-N	436.049584684							
AMBCB60879342	LSM-18799	SID24785252, BRD-A13318633	16188764	InChI=1S/C24H31F3N2O2/c25-24(26,27)21-8-4-19(5-9-21)12-13-28-16-20-6-10-23(11-7-20)31-18-22(30)17-29-14-2-1-3-15-29/h4-11,22,28,30H,1-3,12-18H2	RHHUEMKHXMZVIG-UHFFFAOYSA-N	OC(COc1ccc(CNCCc2ccc(cc2)C(F)(F)F)cc1)CN3CCCCC3	BroadT	BRD-A13318633	BRD-A13318633-001-06-0	ChemBridge Corporation	60879342			OC(COc1ccc(CNCCc2ccc(cc2)C(F)(F)F)cc1)CN1CCCCC1	InChI=1S/C24H31F3N2O2/c25-24(26,27)21-8-4-19(5-9-21)12-13-28-16-20-6-10-23(11-7-20)31-18-22(30)17-29-14-2-1-3-15-29/h4-11,22,28,30H,1-3,12-18H2	RHHUEMKHXMZVIG-UHFFFAOYSA-N	436.233762852							107444
MLS000042099	LSM-18800	SID864408, BRD-A74776232	5389953	InChI=1S/C17H17N5OS/c1-11-10-13(12-6-3-2-4-7-12)22-17(18-11)20-16(21-22)19-15(23)14-8-5-9-24-14/h2-9,11,13H,10H2,1H3,(H2,18,19,20,21,23)	CCINCLDHAAVHKZ-UHFFFAOYSA-N	CC1CC(c2ccccc2)n3nc(NC(=O)c4cccs4)nc3N1	BroadT	BRD-A74776232	BRD-A74776232-001-06-0	InterBioScreen Ltd.	STOCK5S-12762			CC1CC(c2ccccc2)n2nc(NC(=O)c3cccs3)nc2N1	InChI=1S/C17H17N5OS/c1-11-10-13(12-6-3-2-4-7-12)22-17(18-11)20-16(21-22)19-15(23)14-8-5-9-24-14/h2-9,11,13H,10H2,1H3,(H2,18,19,20,21,23)	CCINCLDHAAVHKZ-UHFFFAOYSA-N	339.115380904							107445
AC1M14PJ	LSM-18801	BRD-K30236306	2041599	InChI=1S/C22H21FN8O3/c1-2-4-18-19(26-30-31(18)21-20(24)28-34-29-21)22(32)27-25-12-15-5-3-6-17(11-15)33-13-14-7-9-16(23)10-8-14/h3,5-12H,2,4,13H2,1H3,(H2,24,28)(H,27,32)	PEUDXRHCFBVMTL-UHFFFAOYSA-N	CCCc1c(nnn1c2nonc2N)C(=O)NN=Cc3cccc(OCc4ccc(F)cc4)c3	BroadT	BRD-K30236306	BRD-K30236306-001-05-9	InterBioScreen Ltd.	STOCK4S-86532			CCCc1c(nnn1-c1nonc1N)C(=O)NN=Cc1cccc(OCc2ccc(F)cc2)c1	InChI=1S/C22H21FN8O3/c1-2-4-18-19(26-30-31(18)21-20(24)28-34-29-21)22(32)27-25-12-15-5-3-6-17(11-15)33-13-14-7-9-16(23)10-8-14/h3,5-12H,2,4,13H2,1H3,(H2,24,28)(H,27,32)	PEUDXRHCFBVMTL-UHFFFAOYSA-N	464.172064812							107446
MLS000830201	LSM-18802	SID125311422, SID26731392, BRD-K28142751	2810154	InChI=1S/C14H9FN2O2S2/c1-7-6-20-11-10(7)16-14(21-13(11)19)17-12(18)8-2-4-9(15)5-3-8/h2-6H,1H3,(H,16,17,18)	BTKQVTWFCFGYHS-UHFFFAOYSA-N	Cc1csc2C(=O)SC(=Nc12)NC(=O)c3ccc(F)cc3	BroadT	BRD-K28142751	BRD-K28142751-001-04-6	Maybridge	HTS 01495			Cc1csc2c1nc(NC(=O)c1ccc(F)cc1)sc2=O	InChI=1S/C14H9FN2O2S2/c1-7-6-20-11-10(7)16-14(21-13(11)19)17-12(18)8-2-4-9(15)5-3-8/h2-6H,1H3,(H,16,17,18)	BTKQVTWFCFGYHS-UHFFFAOYSA-N	320.008947128							107447
BAS 09620421	LSM-18803	SID24801521, BRD-K38317291	3158604	InChI=1S/C15H16N2O4S/c1-17-12-6-7-13(22(19,20)16-8-9-21-2)10-4-3-5-11(14(10)12)15(17)18/h3-7,16H,8-9H2,1-2H3	WGVIVONLYOPDGA-UHFFFAOYSA-N	COCCNS(=O)(=O)c1ccc2N(C)C(=O)c3cccc1c23	BroadT	BRD-K38317291	BRD-K38317291-001-05-6	Asinex Ltd.	BAS 09620421			COCCNS(=O)(=O)c1ccc2N(C)C(=O)c3cccc1c23	InChI=1S/C15H16N2O4S/c1-17-12-6-7-13(22(19,20)16-8-9-21-2)10-4-3-5-11(14(10)12)15(17)18/h3-7,16H,8-9H2,1-2H3	WGVIVONLYOPDGA-UHFFFAOYSA-N	320.083077702							107448
MLS000572851	LSM-43799	SID17415877, BRD-K00496561	875821	InChI=1S/C14H11ClN2O/c15-13-4-2-1-3-11(13)5-6-14(18)17-12-7-9-16-10-8-12/h1-10H,(H,16,17,18)/b6-5+	ASZXVOGHNNBRPS-AATRIKPKSA-N	Clc1ccccc1\C=C\C(=O)Nc2ccncc2	BroadT	BRD-K00496561	BRD-K00496561-001-07-1	ChemBridge Corporation	6204719			Clc1ccccc1\C=C\C(=O)Nc1ccncc1	InChI=1S/C14H11ClN2O/c15-13-4-2-1-3-11(13)5-6-14(18)17-12-7-9-16-10-8-12/h1-10H,(H,16,17,18)/b6-5+	ASZXVOGHNNBRPS-AATRIKPKSA-N	258.055990702							
MLS000393262	LSM-18805	SID22401174, BRD-K00973747	2389343	InChI=1S/C20H21FN2O5S/c21-17-6-2-1-5-16(17)20(11-3-4-12-20)19(25)28-13-18(24)23-14-7-9-15(10-8-14)29(22,26)27/h1-2,5-10H,3-4,11-13H2,(H,23,24)(H2,22,26,27)	PGPJEEIVJCYMFI-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(CCCC2)c3ccccc3F)cc1	BroadT	BRD-K00973747	BRD-K00973747-001-06-8	Enamine Ltd.	T0512-3831			NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(CCCC2)c2ccccc2F)cc1	InChI=1S/C20H21FN2O5S/c21-17-6-2-1-5-16(17)20(11-3-4-12-20)19(25)28-13-18(24)23-14-7-9-15(10-8-14)29(22,26)27/h1-2,5-10H,3-4,11-13H2,(H,23,24)(H2,22,26,27)	PGPJEEIVJCYMFI-UHFFFAOYSA-N	420.115520682							107450
MLS000703412	LSM-43800	SID24787998, BRD-K59509254	1734123	InChI=1S/C11H12N2O3S3/c1-12-4-5-18-8(12)3-2-7-10(16)13(6-9(14)15)11(17)19-7/h2-3H,4-6H2,1H3,(H,14,15)/b7-2-,8-3-	AMSAICQWZZDCEM-ZXCOBTLNSA-N	CN1CCS/C/1=C\C=C\2/SC(=S)N(CC(=O)O)C2=O	BroadT	BRD-K59509254	BRD-K59509254-001-04-0	Asinex Ltd.	BAS 00670021			CN1CCS\C1=C/C=C1\SC(=S)N(CC(O)=O)C1=O	InChI=1S/C11H12N2O3S3/c1-12-4-5-18-8(12)3-2-7-10(16)13(6-9(14)15)11(17)19-7/h2-3H,4-6H2,1H3,(H,14,15)/b7-2-,8-3-	AMSAICQWZZDCEM-ZXCOBTLNSA-N	316.001004334							
MLS000673878	LSM-43801	SID24803989, BRD-K15439372	2208545	InChI=1S/C26H22N2O6/c1-32-22-10-8-21(9-11-22)28-25(29)20(15-27)13-18-5-12-23(24(14-18)33-2)34-16-17-3-6-19(7-4-17)26(30)31/h3-14H,16H2,1-2H3,(H,28,29)(H,30,31)/b20-13-	ORXDHFRLJLDTBE-MOSHPQCFSA-N	COc1ccc(NC(=O)\C(=C/c2ccc(OCc3ccc(cc3)C(=O)O)c(OC)c2)\C#N)cc1	BroadT	BRD-K15439372	BRD-K15439372-001-05-7	ChemBridge Corporation	5906558			COc1ccc(NC(=O)C(=C/c2ccc(OCc3ccc(cc3)C(O)=O)c(OC)c2)\C#N)cc1	InChI=1S/C26H22N2O6/c1-32-22-10-8-21(9-11-22)28-25(29)20(15-27)13-18-5-12-23(24(14-18)33-2)34-16-17-3-6-19(7-4-17)26(30)31/h3-14H,16H2,1-2H3,(H,28,29)(H,30,31)/b20-13-	ORXDHFRLJLDTBE-MOSHPQCFSA-N	458.147786444							
AC1NU0LB	LSM-43802	SID24792052, BRD-K96095079	5415544	InChI=1S/C18H17NO2/c1-13-3-5-16(6-4-13)18(21)11-12-19-17-9-7-15(8-10-17)14(2)20/h3-12,19H,1-2H3/b12-11-	RKUWYNVXLRPAMO-QXMHVHEDSA-N	CC(=O)c1ccc(N\C=C/C(=O)c2ccc(C)cc2)cc1	BroadT	BRD-K96095079	BRD-K96095079-001-05-5	ChemBridge Corporation	6591128			CC(=O)c1ccc(N\C=C/C(=O)c2ccc(C)cc2)cc1	InChI=1S/C18H17NO2/c1-13-3-5-16(6-4-13)18(21)11-12-19-17-9-7-15(8-10-17)14(2)20/h3-12,19H,1-2H3/b12-11-	RKUWYNVXLRPAMO-QXMHVHEDSA-N	279.125928794							
5-Azepan-1-yl-1,3,4-thiadiazol-2-amine	LSM-18809	SID4249408, BRD-K04148329	3243365	InChI=1S/C8H14N4S/c9-7-10-11-8(13-7)12-5-3-1-2-4-6-12/h1-6H2,(H2,9,10)	OQLGBSGAQITNNB-UHFFFAOYSA-N	Nc1nnc(s1)N2CCCCCC2	BroadT	BRD-K04148329	BRD-K04148329-001-05-1	ChemDiv Inc.	K780-0893			Nc1nnc(s1)N1CCCCCC1	InChI=1S/C8H14N4S/c9-7-10-11-8(13-7)12-5-3-1-2-4-6-12/h1-6H2,(H2,9,10)	OQLGBSGAQITNNB-UHFFFAOYSA-N	198.093917178							107454
MLS001121909	LSM-18810	SID49732128, BRD-K96775334	24792989	InChI=1S/C27H34N4O2/c1-21-19-23(11-12-25(21)33-2)20-30-17-14-24(15-18-30)31-26(13-16-28-31)29-27(32)10-6-9-22-7-4-3-5-8-22/h3-5,7-8,11-13,16,19,24H,6,9-10,14-15,17-18,20H2,1-2H3,(H,29,32)	SXWPJZVYZIDLIO-UHFFFAOYSA-N	COc1ccc(CN2CCC(CC2)n3nccc3NC(=O)CCCc4ccccc4)cc1C	BroadT	BRD-K96775334	BRD-K96775334-001-05-3	ChemBridge Corporation	62683504			COc1ccc(CN2CCC(CC2)n2nccc2NC(=O)CCCc2ccccc2)cc1C	InChI=1S/C27H34N4O2/c1-21-19-23(11-12-25(21)33-2)20-30-17-14-24(15-18-30)31-26(13-16-28-31)29-27(32)10-6-9-22-7-4-3-5-8-22/h3-5,7-8,11-13,16,19,24H,6,9-10,14-15,17-18,20H2,1-2H3,(H,29,32)	SXWPJZVYZIDLIO-UHFFFAOYSA-N	446.268176368							107455
N1-[4-Bromo-1-(tert-butyl)-3-methyl-1H-pyrazol-5-yl]-2,4-dichlorobenzamide	LSM-18811	SID26730076, BRD-K88780295	2818811	InChI=1S/C15H16BrCl2N3O/c1-8-12(16)13(21(20-8)15(2,3)4)19-14(22)10-6-5-9(17)7-11(10)18/h5-7H,1-4H3,(H,19,22)	NTUXVUQBYKOQAD-UHFFFAOYSA-N	Cc1nn(c(NC(=O)c2ccc(Cl)cc2Cl)c1Br)C(C)(C)C	BroadT	BRD-K88780295	BRD-K88780295-001-05-0	Maybridge	KM 00092			Cc1nn(c(NC(=O)c2ccc(Cl)cc2Cl)c1Br)C(C)(C)C	InChI=1S/C15H16BrCl2N3O/c1-8-12(16)13(21(20-8)15(2,3)4)19-14(22)10-6-5-9(17)7-11(10)18/h5-7H,1-4H3,(H,19,22)	NTUXVUQBYKOQAD-UHFFFAOYSA-N	402.985380182							107456
AC1MF83K	LSM-18812	SID7977238, BRD-A57644554	2867524	InChI=1S/C15H22O4/c1-4-6-12-7-8-14(15(9-12)17-3)19-11-13(16)10-18-5-2/h4,7-9,13,16H,1,5-6,10-11H2,2-3H3	DMCMPDJEQZVXQN-UHFFFAOYSA-N	CCOCC(O)COc1ccc(CC=C)cc1OC	BroadT	BRD-A57644554	BRD-A57644554-001-05-3	ChemBridge Corporation	5770588			CCOCC(O)COc1ccc(CC=C)cc1OC	InChI=1S/C15H22O4/c1-4-6-12-7-8-14(15(9-12)17-3)19-11-13(16)10-18-5-2/h4,7-9,13,16H,1,5-6,10-11H2,2-3H3	DMCMPDJEQZVXQN-UHFFFAOYSA-N	266.151809184							107457
STK324040	LSM-18813	SID14719124, BRD-K17476836	834312	InChI=1S/C21H28N2O2/c1-16-11-13-23(14-12-16)19-9-7-18(8-10-19)22-15-17-5-4-6-20(24-2)21(17)25-3/h4-10,16,22H,11-15H2,1-3H3	MATSUFORSCSJSR-UHFFFAOYSA-N	COc1cccc(CNc2ccc(cc2)N3CCC(C)CC3)c1OC	BroadT	BRD-K17476836	BRD-K17476836-001-05-7	Specs	AN-465/42519092			COc1cccc(CNc2ccc(cc2)N2CCC(C)CC2)c1OC	InChI=1S/C21H28N2O2/c1-16-11-13-23(14-12-16)19-9-7-18(8-10-19)22-15-17-5-4-6-20(24-2)21(17)25-3/h4-10,16,22H,11-15H2,1-3H3	MATSUFORSCSJSR-UHFFFAOYSA-N	340.215078156							107458
MLS001013386	LSM-43803	SID24831570, BRD-K49734529	5682438	InChI=1S/C20H21N3O3/c24-20(14-11-16-9-12-18(13-10-16)23(25)26)22(17-6-2-1-3-7-17)19-8-4-5-15-21-19/h4-5,8-15,17H,1-3,6-7H2/b14-11+	GMQINCPJVNSAKW-SDNWHVSQSA-N	[O-][N+](=O)c1ccc(\C=C\C(=O)N(C2CCCCC2)c3ccccn3)cc1	BroadT	BRD-K49734529	BRD-K49734529-001-05-3	Enamine Ltd.	T0511-6871			[O-][N+](=O)c1ccc(\C=C\C(=O)N(C2CCCCC2)c2ccccn2)cc1	InChI=1S/C20H21N3O3/c24-20(14-11-16-9-12-18(13-10-16)23(25)26)22(17-6-2-1-3-7-17)19-8-4-5-15-21-19/h4-5,8-15,17H,1-3,6-7H2/b14-11+	GMQINCPJVNSAKW-SDNWHVSQSA-N	351.158291562							
SMR000149917	LSM-18815	BRD-K74697177	987954	InChI=1S/C22H22N4OS/c1-4-25(5-2)17-12-10-16(11-13-17)14-19-21(27)26-20(23-24-22(26)28-19)18-9-7-6-8-15(18)3/h6-14H,4-5H2,1-3H3	OHBSLURBCZIRKJ-UHFFFAOYSA-N	CCN(CC)c1ccc(C=C2Sc3nnc(c4ccccc4C)n3C2=O)cc1	BroadT	BRD-K74697177	BRD-K74697177-001-06-3	InterBioScreen Ltd.	STOCK2S-23077			CCN(CC)c1ccc(C=c2sc3nnc(-c4ccccc4C)n3c2=O)cc1	InChI=1S/C22H22N4OS/c1-4-25(5-2)17-12-10-16(11-13-17)14-19-21(27)26-20(23-24-22(26)28-19)18-9-7-6-8-15(18)3/h6-14H,4-5H2,1-3H3	OHBSLURBCZIRKJ-UHFFFAOYSA-N	390.151432054							107460
SMR000141582	LSM-43804	SID14731890, BRD-K28017539	1007600	InChI=1S/C21H12ClFN2O4S/c22-16-11-13(6-7-17(16)23)25-20(27)15(19(26)24-25)10-12-3-1-4-14(9-12)29-21(28)18-5-2-8-30-18/h1-11H,(H,24,26)/b15-10-	JNUIQGKVFFMDLX-GDNBJRDFSA-N	Fc1ccc(cc1Cl)N2NC(=O)\C(=C\c3cccc(OC(=O)c4cccs4)c3)\C2=O	BroadT	BRD-K28017539	BRD-K28017539-001-05-6	ChemBridge Corporation	6698911			Fc1ccc(cc1Cl)N1NC(=O)\C(=C\c2cccc(OC(=O)c3cccs3)c2)C1=O	InChI=1S/C21H12ClFN2O4S/c22-16-11-13(6-7-17(16)23)25-20(27)15(19(26)24-25)10-12-3-1-4-14(9-12)29-21(28)18-5-2-8-30-18/h1-11H,(H,24,26)/b15-10-	JNUIQGKVFFMDLX-GDNBJRDFSA-N	442.019033484							
MLS000074654	LSM-18817	SID842229, BRD-K83281795	644484	InChI=1S/C16H17ClN6/c1-11-18-15(22-8-4-5-9-22)14-16(19-11)23(21-20-14)10-12-6-2-3-7-13(12)17/h2-3,6-7H,4-5,8-10H2,1H3	QTBKAMVDHAOZBC-UHFFFAOYSA-N	Cc1nc(N2CCCC2)c3nnn(Cc4ccccc4Cl)c3n1	BroadT	BRD-K83281795	BRD-K83281795-001-05-9	Asinex Ltd.	ASN 07369631			Cc1nc(N2CCCC2)c2nnn(Cc3ccccc3Cl)c2n1	InChI=1S/C16H17ClN6/c1-11-18-15(22-8-4-5-9-22)14-16(19-11)23(21-20-14)10-12-6-2-3-7-13(12)17/h2-3,6-7H,4-5,8-10H2,1H3	QTBKAMVDHAOZBC-UHFFFAOYSA-N	328.120322314							107462
SMR000036150	LSM-18818	SID857936, BRD-K67883300	659287	InChI=1S/C15H11ClN4S/c1-2-21-15-11(8-18)13(10(7-17)14(19)20-15)9-5-3-4-6-12(9)16/h3-6H,2H2,1H3,(H2,19,20)	ZDQBGAWRNRRFFD-UHFFFAOYSA-N	CCSc1nc(N)c(C#N)c(c2ccccc2Cl)c1C#N	BroadT	BRD-K67883300	BRD-K67883300-001-05-0	InterBioScreen Ltd.	STOCK2S-08537			CCSc1nc(N)c(C#N)c(-c2ccccc2Cl)c1C#N	InChI=1S/C15H11ClN4S/c1-2-21-15-11(8-18)13(10(7-17)14(19)20-15)9-5-3-4-6-12(9)16/h3-6H,2H2,1H3,(H2,19,20)	ZDQBGAWRNRRFFD-UHFFFAOYSA-N	314.039294792							107463
MLS000564840	LSM-18819	SID14744196, BRD-K22216513	4083896	InChI=1S/C21H24N2O2S/c24-19(21-9-14-6-15(10-21)8-16(7-14)11-21)23-20-22-17(13-26-20)12-25-18-4-2-1-3-5-18/h1-5,13-16H,6-12H2,(H,22,23,24)	QRAASQPZCBBCKR-UHFFFAOYSA-N	O=C(Nc1nc(COc2ccccc2)cs1)C34CC5CC(CC(C5)C3)C4	BroadT	BRD-K22216513	BRD-K22216513-001-06-8	Enamine Ltd.	T0512-0069			O=C(Nc1nc(COc2ccccc2)cs1)C12CC3CC(CC(C3)C1)C2	InChI=1S/C21H24N2O2S/c24-19(21-9-14-6-15(10-21)8-16(7-14)11-21)23-20-22-17(13-26-20)12-25-18-4-2-1-3-5-18/h1-5,13-16H,6-12H2,(H,22,23,24)	QRAASQPZCBBCKR-UHFFFAOYSA-N	368.155848718							107464
AC1MO2ZS	LSM-18820	BRD-K47427447	3362640	InChI=1S/C19H19N5/c1-15-12-18(24-21-14-17-10-6-3-7-11-17)23-19(22-15)20-13-16-8-4-2-5-9-16/h2-12,14H,13H2,1H3,(H2,20,22,23,24)	TWMNSQGYKDIDRO-UHFFFAOYSA-N	Cc1cc(NN=Cc2ccccc2)nc(NCc3ccccc3)n1	BroadT	BRD-K47427447	BRD-K47427447-001-05-5	InterBioScreen Ltd.	STOCK2S-24528			Cc1cc(NN=Cc2ccccc2)nc(NCc2ccccc2)n1	InChI=1S/C19H19N5/c1-15-12-18(24-21-14-17-10-6-3-7-11-17)23-19(22-15)20-13-16-8-4-2-5-9-16/h2-12,14H,13H2,1H3,(H2,20,22,23,24)	TWMNSQGYKDIDRO-UHFFFAOYSA-N	317.164045658							107465
MLS000730125	LSM-18821	SID24813393, BRD-K05701217	2135732	InChI=1S/C18H18N2O3S/c1-21-14-7-5-13(6-8-14)20-11-15(19-18(20)24)12-4-9-16(22-2)17(10-12)23-3/h4-11H,1-3H3,(H,19,24)	IZLCIVYEZOSGHW-UHFFFAOYSA-N	COc1ccc(cc1)n2cc(nc2S)c3ccc(OC)c(OC)c3	BroadT	BRD-K05701217	BRD-K05701217-001-05-1	ChemDiv Inc.	C200-1625			COc1ccc(cc1)-n1cc(nc1S)-c1ccc(OC)c(OC)c1	InChI=1S/C18H18N2O3S/c1-21-14-7-5-13(6-8-14)20-11-15(19-18(20)24)12-4-9-16(22-2)17(10-12)23-3/h4-11H,1-3H3,(H,19,24)	IZLCIVYEZOSGHW-UHFFFAOYSA-N	342.103813146							107466
ZINC4183902	LSM-18822	BRD-K82655613	16193264	InChI=1S/C14H17NO3S/c1-11-4-6-13-7-5-12(2)15(14(13)10-11)8-3-9-19(16,17)18/h4-7,10H,3,8-9H2,1-2H3/p+1	DAXHLBSWKNYEJG-UHFFFAOYSA-O	Cc1ccc2ccc(C)[n+](CCCS(=O)(=O)O)c2c1	BroadT	BRD-K82655613	BRD-K82655613-001-05-5	ChemDiv Inc.	4400-0065			Cc1ccc2ccc(C)[n+](CCCS(O)(=O)=O)c2c1	InChI=1S/C14H17NO3S/c1-11-4-6-13-7-5-12(2)15(14(13)10-11)8-3-9-19(16,17)18/h4-7,10H,3,8-9H2,1-2H3/p+1	DAXHLBSWKNYEJG-UHFFFAOYSA-O	280.100739136							107467
MLS000118627	LSM-18823	SID7969160, BRD-K29414517	5309804	InChI=1S/C23H20N6O3S2/c1-14-7-3-4-8-16(14)29-20(12-28-17-9-5-6-10-18(17)34-23(28)31)25-26-22(29)33-13-21(30)24-19-11-15(2)32-27-19/h3-11H,12-13H2,1-2H3,(H,24,27,30)	AIJXENIASDJLKH-UHFFFAOYSA-N	Cc1onc(NC(=O)CSc2nnc(CN3C(=O)Sc4ccccc34)n2c5ccccc5C)c1	BroadT	BRD-K29414517	BRD-K29414517-001-04-3	ChemDiv Inc.	C663-0234			Cc1cc(NC(=O)CSc2nnc(Cn3c4ccccc4sc3=O)n2-c2ccccc2C)no1	InChI=1S/C23H20N6O3S2/c1-14-7-3-4-8-16(14)29-20(12-28-17-9-5-6-10-18(17)34-23(28)31)25-26-22(29)33-13-21(30)24-19-11-15(2)32-27-19/h3-11H,12-13H2,1-2H3,(H,24,27,30)	AIJXENIASDJLKH-UHFFFAOYSA-N	492.10382994							107468
MLS000392137	LSM-43805	SID22408667, BRD-K10237621	5978544	InChI=1S/C24H24N2O3S/c1-2-3-12-25-21(27)15-29-24(28)22-18-8-4-5-9-20(18)26-23-16(10-11-19(22)23)14-17-7-6-13-30-17/h4-9,13-14H,2-3,10-12,15H2,1H3,(H,25,27)/b16-14+	GGIUCRJUEPQOQC-JQIJEIRASA-N	CCCCNC(=O)COC(=O)c1c2CC\C(=C/c3cccs3)\c2nc4ccccc14	BroadT	BRD-K10237621	BRD-K10237621-001-04-2	Enamine Ltd.	T0515-8949			CCCCNC(=O)COC(=O)c1c2CC\C(=C/c3cccs3)c2nc2ccccc12	InChI=1S/C24H24N2O3S/c1-2-3-12-25-21(27)15-29-24(28)22-18-8-4-5-9-20(18)26-23-16(10-11-19(22)23)14-17-7-6-13-30-17/h4-9,13-14H,2-3,10-12,15H2,1H3,(H,25,27)/b16-14+	GGIUCRJUEPQOQC-JQIJEIRASA-N	420.150763338							
MLS001074413	LSM-18825	SID49817398, BRD-K71569686	24816798	InChI=1S/C14H10ClN3O2/c15-9-3-6-11-12(7-9)18-14(17-11)16-10-4-1-8(2-5-10)13(19)20/h1-7H,(H,19,20)(H2,16,17,18)	GXWRTNAHZRXBRO-UHFFFAOYSA-N	OC(=O)c1ccc(Nc2nc3cc(Cl)ccc3[nH]2)cc1	BroadT	BRD-K71569686	BRD-K71569686-001-06-1	University of California at Davis	UCD1005			OC(=O)c1ccc(Nc2nc3cc(Cl)ccc3[nH]2)cc1	InChI=1S/C14H10ClN3O2/c15-9-3-6-11-12(7-9)18-14(17-11)16-10-4-1-8(2-5-10)13(19)20/h1-7H,(H,19,20)(H2,16,17,18)	GXWRTNAHZRXBRO-UHFFFAOYSA-N	287.0461543							107470
MLS000088730	LSM-18826	SID4256637, BRD-K71276538	891086	InChI=1S/C14H13N3OS/c19-14-16-15-13(9-11-5-2-1-3-6-11)17(14)10-12-7-4-8-18-12/h1-8H,9-10H2,(H,16,19)	KXLVXORPOHNALY-UHFFFAOYSA-N	Sc1nnc(Cc2ccccc2)n1Cc3occc3	BroadT	BRD-K71276538	BRD-K71276538-001-05-5	ChemBridge Corporation	7461687			Sc1nnc(Cc2ccccc2)n1Cc1ccco1	InChI=1S/C14H13N3OS/c19-14-16-15-13(9-11-5-2-1-3-6-11)17(14)10-12-7-4-8-18-12/h1-8H,9-10H2,(H,16,19)	KXLVXORPOHNALY-UHFFFAOYSA-N	271.077932756							107471
AC1LR7GN	LSM-18827	BRD-K39094983	1363733	InChI=1S/C21H14BrFN4O2/c22-19-11-10-18(29-19)21(28)25-24-12-15-13-27(17-4-2-1-3-5-17)26-20(15)14-6-8-16(23)9-7-14/h1-13H,(H,25,28)	JDRYSMXWTTZHLO-UHFFFAOYSA-N	Fc1ccc(cc1)c2nn(cc2C=NNC(=O)c3oc(Br)cc3)c4ccccc4	BroadT	BRD-K39094983	BRD-K39094983-001-05-3	ChemBridge Corporation	5744127			Fc1ccc(cc1)-c1nn(cc1C=NNC(=O)c1ccc(Br)o1)-c1ccccc1	InChI=1S/C21H14BrFN4O2/c22-19-11-10-18(29-19)21(28)25-24-12-15-13-27(17-4-2-1-3-5-17)26-20(15)14-6-8-16(23)9-7-14/h1-13H,(H,25,28)	JDRYSMXWTTZHLO-UHFFFAOYSA-N	452.028416528							107472
3,5-Dimethoxy-n-(1H-1,2,4-triazol-3-yl)benzamide	LSM-1974	BRD-K00203625, SID56373754, SID85147389	702927	InChI=1S/C11H12N4O3/c1-17-8-3-7(4-9(5-8)18-2)10(16)14-11-12-6-13-15-11/h3-6H,1-2H3,(H2,12,13,14,15,16)	RGKSDFUICNFMCO-UHFFFAOYSA-N	COc1cc(OC)cc(c1)C(=O)Nc2nc[nH]n2	BroadT	BRD-K00203625	BRD-K00203625-001-04-2	Sanford-Burnham Medical Research Institute	3,5-Dimethoxy-N-(1H-[1,2,4]triazol-3-yl)-benzamide MLS-0315839.0001			COc1cc(OC)cc(c1)C(=O)Nc1nc[nH]n1	InChI=1S/C11H12N4O3/c1-17-8-3-7(4-9(5-8)18-2)10(16)14-11-12-6-13-15-11/h3-6H,1-2H3,(H2,12,13,14,15,16)	RGKSDFUICNFMCO-UHFFFAOYSA-N	248.090940284							92003
BAS 01549634	LSM-18828	SID24784800, BRD-K05441185	1125103	InChI=1S/C13H13BrN2O3S/c1-9-4-3-7-15-13(9)16-20(17,18)12-8-10(14)5-6-11(12)19-2/h3-8H,1-2H3,(H,15,16)	XUUJFAKVEMCQGR-UHFFFAOYSA-N	COc1ccc(Br)cc1S(=O)(=O)Nc2ncccc2C	BroadT	BRD-K05441185	BRD-K05441185-001-05-2	Asinex Ltd.	BAS 01549634			COc1ccc(Br)cc1S(=O)(=O)Nc1ncccc1C	InChI=1S/C13H13BrN2O3S/c1-9-4-3-7-15-13(9)16-20(17,18)12-8-10(14)5-6-11(12)19-2/h3-8H,1-2H3,(H,15,16)	XUUJFAKVEMCQGR-UHFFFAOYSA-N	355.983025586							107473
SMR000020684	LSM-18829	SID4247618, BRD-K36020099	901734	InChI=1S/C15H16N2O/c1-9-6-10(2)16-14-7-12-4-5-17(11(3)18)15(12)8-13(9)14/h6-8H,4-5H2,1-3H3	PWJUBTOPMCVVII-UHFFFAOYSA-N	CC(=O)N1CCc2cc3nc(C)cc(C)c3cc12	BroadT	BRD-K36020099	BRD-K36020099-001-06-0	ChemDiv Inc.	7093-1586			CC(=O)N1CCc2cc3nc(C)cc(C)c3cc12	InChI=1S/C15H16N2O/c1-9-6-10(2)16-14-7-12-4-5-17(11(3)18)15(12)8-13(9)14/h6-8H,4-5H2,1-3H3	PWJUBTOPMCVVII-UHFFFAOYSA-N	240.126263152							107474
STK521868	LSM-43806	SID17434066, BRD-K85371665	2191172	InChI=1S/C17H16N2O6S2/c1-4-6-26-17-18-12(16(21)27-17)7-11-8-13(19(22)23)15(25-10(3)20)14(9-11)24-5-2/h4,7-9H,1,5-6H2,2-3H3/b12-7-	VGKDCUBFONAPQD-GHXNOFRVSA-N	CCOc1cc(\C=C\2/N=C(SCC=C)SC2=O)cc(c1OC(=O)C)[N+](=O)[O-]	BroadT	BRD-K85371665	BRD-K85371665-001-05-3	ChemBridge Corporation	7478821			CCOc1cc(\C=C2/N=C(SCC=C)SC2=O)cc(c1OC(C)=O)[N+]([O-])=O	InChI=1S/C17H16N2O6S2/c1-4-6-26-17-18-12(16(21)27-17)7-11-8-13(19(22)23)15(25-10(3)20)14(9-11)24-5-2/h4,7-9H,1,5-6H2,2-3H3/b12-7-	VGKDCUBFONAPQD-GHXNOFRVSA-N	408.044977632							
SMR000025604	LSM-18831	SID4243589, BRD-K00952083	3238291	InChI=1S/C15H20N2O3S/c1-4-21(19,20)16-6-5-12-9-13-7-10(2)11(3)8-14(13)17-15(12)18/h7-9,16H,4-6H2,1-3H3,(H,17,18)	TZVRWMPUYDDJGC-UHFFFAOYSA-N	CCS(=O)(=O)NCCc1cc2cc(C)c(C)cc2nc1O	BroadT	BRD-K00952083	BRD-K00952083-001-03-1	ChemDiv Inc.	C279-0802			CCS(=O)(=O)NCCc1cc2cc(C)c(C)cc2nc1O	InChI=1S/C15H20N2O3S/c1-4-21(19,20)16-6-5-12-9-13-7-10(2)11(3)8-14(13)17-15(12)18/h7-9,16H,4-6H2,1-3H3,(H,17,18)	TZVRWMPUYDDJGC-UHFFFAOYSA-N	308.11946321							107476
AC1MG3FU	LSM-18832	BRD-K16979991	2954900	InChI=1S/C19H20N6S/c1-11-5-4-6-14(9-11)22-19(26)25-17(20)24-18-21-13(3)15-8-7-12(2)10-16(15)23-18/h4-10H,1-3H3,(H4,20,21,22,23,24,25,26)	HBMKYTBXLLTTGT-UHFFFAOYSA-N	Cc1cccc(NC(=NC(=N)Nc2nc(C)c3ccc(C)cc3n2)S)c1	BroadT	BRD-K16979991	BRD-K16979991-001-07-8	ChemBridge Corporation	7790346			Cc1cccc(NC(S)=NC(=N)Nc2nc(C)c3ccc(C)cc3n2)c1	InChI=1S/C19H20N6S/c1-11-5-4-6-14(9-11)22-19(26)25-17(20)24-18-21-13(3)15-8-7-12(2)10-16(15)23-18/h4-10H,1-3H3,(H4,20,21,22,23,24,25,26)	HBMKYTBXLLTTGT-UHFFFAOYSA-N	364.14701539							107477
SMR000212607	LSM-18833	SID17511939, BRD-A67859157	5238151	InChI=1S/C29H25N5O3/c1-36-22-14-12-21(13-15-22)34-28(30-24-8-4-3-7-23(24)29(34)35)19-11-16-27(37-2)20(17-19)18-33-26-10-6-5-9-25(26)31-32-33/h3-17,28,30H,18H2,1-2H3	DPVFHMWNLCQOKP-UHFFFAOYSA-N	COc1ccc(cc1)N2C(Nc3ccccc3C2=O)c4ccc(OC)c(Cn5nnc6ccccc56)c4	BroadT	BRD-A67859157	BRD-A67859157-001-06-4	InterBioScreen Ltd.	STOCK1S-72748			COc1ccc(cc1)N1C(Nc2ccccc2C1=O)c1ccc(OC)c(Cn2nnc3ccccc23)c1	InChI=1S/C29H25N5O3/c1-36-22-14-12-21(13-15-22)34-28(30-24-8-4-3-7-23(24)29(34)35)19-11-16-27(37-2)20(17-19)18-33-26-10-6-5-9-25(26)31-32-33/h3-17,28,30H,18H2,1-2H3	DPVFHMWNLCQOKP-UHFFFAOYSA-N	491.19573971							107478
MLS000113626	LSM-18834	SID7978061, BRD-K09081267	2928644	InChI=1S/C16H17ClN2O2/c17-12-5-6-13-14(11-12)18-8-7-15(13)21-16(20)19-9-3-1-2-4-10-19/h5-8,11H,1-4,9-10H2	QBGNBCNFOZTKHI-UHFFFAOYSA-N	Clc1ccc2c(OC(=O)N3CCCCCC3)ccnc2c1	BroadT	BRD-K09081267	BRD-K09081267-001-05-3	ChemBridge Corporation	7156291			Clc1ccc2c(OC(=O)N3CCCCCC3)ccnc2c1	InChI=1S/C16H17ClN2O2/c17-12-5-6-13-14(11-12)18-8-7-15(13)21-16(20)19-9-3-1-2-4-10-19/h5-8,11H,1-4,9-10H2	QBGNBCNFOZTKHI-UHFFFAOYSA-N	304.097855514							107479
AC1MVNDD	LSM-18835	SID26662707, BRD-A35046390	3735630	InChI=1S/C12H16N4O/c1-6(2)4-8-9(5-13)11(14)17-12-10(8)7(3)15-16-12/h6,8H,4,14H2,1-3H3,(H,15,16)	PGBUKEQJTAYWET-UHFFFAOYSA-N	CC(C)CC1C(=C(N)Oc2[nH]nc(C)c12)C#N	BroadT	BRD-A35046390	BRD-A35046390-001-07-2	InterBioScreen Ltd.	STOCK1S-04811			CC(C)CC1c2c(C)n[nH]c2OC(N)=C1C#N	InChI=1S/C12H16N4O/c1-6(2)4-8-9(5-13)11(14)17-12-10(8)7(3)15-16-12/h6,8H,4,14H2,1-3H3,(H,15,16)	PGBUKEQJTAYWET-UHFFFAOYSA-N	232.132411172							107480
ST50884382	LSM-18836	SID49819175, BRD-K95354904	2220850	InChI=1S/C19H14BrN5OS/c1-2-17-24-25-19(27-17)23-18(26)13-10-16(15-5-3-4-8-21-15)22-14-7-6-11(20)9-12(13)14/h3-10H,2H2,1H3,(H,23,25,26)	FXHFMSTZNHHKAH-UHFFFAOYSA-N	CCc1nnc(NC(=O)c2cc(nc3ccc(Br)cc23)c4ccccn4)s1	BroadT	BRD-K95354904	BRD-K95354904-001-05-8	ChemBridge Corporation	7922363			CCc1nnc(NC(=O)c2cc(nc3ccc(Br)cc23)-c2ccccn2)s1	InChI=1S/C19H14BrN5OS/c1-2-17-24-25-19(27-17)23-18(26)13-10-16(15-5-3-4-8-21-15)22-14-7-6-11(20)9-12(13)14/h3-10H,2H2,1H3,(H,23,25,26)	FXHFMSTZNHHKAH-UHFFFAOYSA-N	439.010243408							107481
ZINC02485867	LSM-18837	SID4263959, BRD-K63983876	2056403	InChI=1S/C14H13NO5/c1-9(16)19-7-6-15-13(17)11-8-10-4-2-3-5-12(10)20-14(11)18/h2-5,8H,6-7H2,1H3,(H,15,17)	UMIDGISCWOTJED-UHFFFAOYSA-N	CC(=O)OCCNC(=O)C1=Cc2ccccc2OC1=O	BroadT	BRD-K63983876	BRD-K63983876-001-05-6	ChemBridge Corporation	7930299			CC(=O)OCCNC(=O)c1cc2ccccc2oc1=O	InChI=1S/C14H13NO5/c1-9(16)19-7-6-15-13(17)11-8-10-4-2-3-5-12(10)20-14(11)18/h2-5,8H,6-7H2,1H3,(H,15,17)	UMIDGISCWOTJED-UHFFFAOYSA-N	275.079372526							107482
F1883-1389	LSM-18838	SID49680374, BRD-K39300778	7205133	InChI=1S/C19H16N2O6/c1-24-9-16(22)21-17-12-4-2-3-5-13(12)27-18(17)19(23)20-11-6-7-14-15(8-11)26-10-25-14/h2-8H,9-10H2,1H3,(H,20,23)(H,21,22)	VWJSKICDWRRKPJ-UHFFFAOYSA-N	COCC(=O)Nc1c(oc2ccccc12)C(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K39300778	BRD-K39300778-001-06-1	Life Chemicals Inc.	F1883-1389			COCC(=O)Nc1c(oc2ccccc12)C(=O)Nc1ccc2OCOc2c1	InChI=1S/C19H16N2O6/c1-24-9-16(22)21-17-12-4-2-3-5-13(12)27-18(17)19(23)20-11-6-7-14-15(8-11)26-10-25-14/h2-8H,9-10H2,1H3,(H,20,23)(H,21,22)	VWJSKICDWRRKPJ-UHFFFAOYSA-N	368.100836252							107483
AC1MJQMQ	LSM-18839	BRD-K47356015	3096244	InChI=1S/C16H14N6O5/c1-8-5-9(2)12(22(24)25)6-11(8)13-4-3-10(26-13)7-18-19-16(23)14-15(17)21-27-20-14/h3-7H,1-2H3,(H2,17,21)(H,19,23)	JAVCTDZUTOKGRG-UHFFFAOYSA-N	Cc1cc(C)c(cc1c2oc(C=NNC(=O)c3nonc3N)cc2)[N+](=O)[O-]	BroadT	BRD-K47356015	BRD-K47356015-001-05-8	Asinex Ltd.	BAS 00258112			Cc1cc(C)c(cc1-c1ccc(C=NNC(=O)c2nonc2N)o1)[N+]([O-])=O	InChI=1S/C16H14N6O5/c1-8-5-9(2)12(22(24)25)6-11(8)13-4-3-10(26-13)7-18-19-16(23)14-15(17)21-27-20-14/h3-7H,1-2H3,(H2,17,21)(H,19,23)	JAVCTDZUTOKGRG-UHFFFAOYSA-N	370.102567608							107484
ST50932655	LSM-18840	SID22400499, BRD-K77094664	841204	InChI=1S/C16H14FN3O2/c1-11-2-7-14(22-11)16(21)18-15-8-9-20(19-15)10-12-3-5-13(17)6-4-12/h2-9H,10H2,1H3,(H,18,19,21)	PHXCDVXJNYQOPO-UHFFFAOYSA-N	Cc1oc(cc1)C(=O)Nc2ccn(Cc3ccc(F)cc3)n2	BroadT	BRD-K77094664	BRD-K77094664-001-05-2	Specs	AK-968/40707806			Cc1ccc(o1)C(=O)Nc1ccn(Cc2ccc(F)cc2)n1	InChI=1S/C16H14FN3O2/c1-11-2-7-14(22-11)16(21)18-15-8-9-20(19-15)10-12-3-5-13(17)6-4-12/h2-9H,10H2,1H3,(H,18,19,21)	PHXCDVXJNYQOPO-UHFFFAOYSA-N	299.107004918							107485
AC1NVGCB	LSM-43807	SID26671079, BRD-K12363499	5586851	InChI=1S/C18H14N4O3S3/c1-11-6-8-12(9-7-11)28(24,25)21-22-17(23)15(27-18(22)26)10-16-19-13-4-2-3-5-14(13)20-16/h2-10,21H,1H3,(H,19,20)/b15-10-	GMJPYLQWRLAORZ-GDNBJRDFSA-N	Cc1ccc(cc1)S(=O)(=O)NN2C(=S)S\C(=C/c3nc4ccccc4[nH]3)\C2=O	BroadT	BRD-K12363499	BRD-K12363499-001-05-0	InterBioScreen Ltd.	STOCK5S-32945			Cc1ccc(cc1)S(=O)(=O)NN1C(=S)S\C(=C/c2nc3ccccc3[nH]2)C1=O	InChI=1S/C18H14N4O3S3/c1-11-6-8-12(9-7-11)28(24,25)21-22-17(23)15(27-18(22)26)10-16-19-13-4-2-3-5-14(13)20-16/h2-10,21H,1H3,(H,19,20)/b15-10-	GMJPYLQWRLAORZ-GDNBJRDFSA-N	430.022802418							
MLS000948068	LSM-43808	SID49716190, SID87225736, BRD-K09710240	24789787	InChI=1S/C22H29N9O2/c1-4-11-30(12-5-2)15-18-19(25-29-31(18)21-20(23)27-33-28-21)22(32)26-24-14-16(3)13-17-9-7-6-8-10-17/h6-10,13-14H,4-5,11-12,15H2,1-3H3,(H2,23,27)(H,26,32)/b16-13-,24-14?	NRDCILSNYFGEBU-HEVZOGSJSA-N	CCCN(CCC)Cc1c(nnn1c2nonc2N)C(=O)NN=C\C(=C/c3ccccc3)\C	BroadT	BRD-K09710240	BRD-K09710240-001-06-7	ChemDiv Inc.	6011-0681			CCCN(CCC)Cc1c(nnn1-c1nonc1N)C(=O)NN=C\C(C)=C/c1ccccc1	InChI=1S/C22H29N9O2/c1-4-11-30(12-5-2)15-18-19(25-29-31(18)21-20(23)27-33-28-21)22(32)26-24-14-16(3)13-17-9-7-6-8-10-17/h6-10,13-14H,4-5,11-12,15H2,1-3H3,(H2,23,27)(H,26,32)/b16-13-,24-14?	NRDCILSNYFGEBU-HEVZOGSJSA-N	451.244421258							
ZINC04324666	LSM-43809	SID26728146, BRD-K32818886	5714550	InChI=1S/C17H22N4O5/c22-15(3-4-16(23)24)18-13-1-2-14(20-5-9-25-10-6-20)19-17(13)21-7-11-26-12-8-21/h1-4H,5-12H2,(H,18,22)(H,23,24)/b4-3+	DWSNGRJYFBPVHN-ONEGZZNKSA-N	OC(=O)\C=C\C(=O)Nc1ccc(nc1N2CCOCC2)N3CCOCC3	BroadT	BRD-K32818886	BRD-K32818886-001-06-8	Maybridge	HTS 02194			OC(=O)\C=C\C(=O)Nc1ccc(nc1N1CCOCC1)N1CCOCC1	InChI=1S/C17H22N4O5/c22-15(3-4-16(23)24)18-13-1-2-14(20-5-9-25-10-6-20)19-17(13)21-7-11-26-12-8-21/h1-4H,5-12H2,(H,18,22)(H,23,24)/b4-3+	DWSNGRJYFBPVHN-ONEGZZNKSA-N	362.159019844							
1-(2-Phenoxy-ethyl)-1H-benzoimidazole-2-thiol	LSM-18844	SID49641630, BRD-K93815256	761457	InChI=1S/C15H14N2OS/c19-15-16-13-8-4-5-9-14(13)17(15)10-11-18-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,16,19)	UOSKQLWSSCRNCT-UHFFFAOYSA-N	Sc1nc2ccccc2n1CCOc3ccccc3	BroadT	BRD-K93815256	BRD-K93815256-001-05-4	Asinex Ltd.	BAS 00546998			Sc1nc2ccccc2n1CCOc1ccccc1	InChI=1S/C15H14N2OS/c19-15-16-13-8-4-5-9-14(13)17(15)10-11-18-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,16,19)	UOSKQLWSSCRNCT-UHFFFAOYSA-N	270.082683778							107489
ZINC05034961	LSM-18845	BRD-K95717215	6804809	InChI=1S/C21H15FN4O2/c22-17-7-3-1-5-15(17)20-24-18-8-4-2-6-16(18)21(25-20)26-23-12-13-9-10-14(27)11-19(13)28/h1-12,27-28H,(H,24,25,26)	YYFHVWCXHGVOIK-UHFFFAOYSA-N	Oc1ccc(C=NNc2nc(nc3ccccc23)c4ccccc4F)c(O)c1	BroadT	BRD-K95717215	BRD-K95717215-001-06-8	InterBioScreen Ltd.	STOCK3S-73662			Oc1ccc(C=NNc2nc(nc3ccccc23)-c2ccccc2F)c(O)c1	InChI=1S/C21H15FN4O2/c22-17-7-3-1-5-15(17)20-24-18-8-4-2-6-16(18)21(25-20)26-23-12-13-9-10-14(27)11-19(13)28/h1-12,27-28H,(H,24,25,26)	YYFHVWCXHGVOIK-UHFFFAOYSA-N	374.11790396							
ST50834852	LSM-18846	SID49823489, BRD-K77486412	17421534	InChI=1S/C16H15N3O3/c20-16(17-14-6-3-7-15(10-14)19(21)22)18-9-8-12-4-1-2-5-13(12)11-18/h1-7,10H,8-9,11H2,(H,17,20)	LVZUSTPGZTVFPA-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(NC(=O)N2CCc3ccccc3C2)c1	BroadT	BRD-K77486412	BRD-K77486412-001-05-5	Chemical Technologies & Investigations	AMNCO-30972			[O-][N+](=O)c1cccc(NC(=O)N2CCc3ccccc3C2)c1	InChI=1S/C16H15N3O3/c20-16(17-14-6-3-7-15(10-14)19(21)22)18-9-8-12-4-1-2-5-13(12)11-18/h1-7,10H,8-9,11H2,(H,17,20)	LVZUSTPGZTVFPA-UHFFFAOYSA-N	297.11134137							107491
5-(Methylamino)-1,3,4-thiadiazole-2-thiol	LSM-18847	SID26659426, BRD-K02682944	1811587	InChI=1S/C3H5N3S2/c1-4-2-5-6-3(7)8-2/h1H3,(H,4,5)(H,6,7)	JMRAYTPNXKJWAX-UHFFFAOYSA-N	CNc1nnc(S)s1	BroadT	BRD-K02682944	BRD-K02682944-001-05-6	InterBioScreen Ltd.	STOCK3S-02765			CNc1nnc(S)s1	InChI=1S/C3H5N3S2/c1-4-2-5-6-3(7)8-2/h1H3,(H,4,5)(H,6,7)	JMRAYTPNXKJWAX-UHFFFAOYSA-N	146.99248857							107492
BAS 09529825	LSM-18848	SID4265862, BRD-K58139833	1093772	InChI=1S/C17H15N3O2/c1-12-4-6-14(7-5-12)16-9-15(20-22-16)17(21)19-11-13-3-2-8-18-10-13/h2-10H,11H2,1H3,(H,19,21)	GRGPMWYJLYMDJJ-UHFFFAOYSA-N	Cc1ccc(cc1)c2onc(c2)C(=O)NCc3cccnc3	BroadT	BRD-K58139833	BRD-K58139833-001-06-2	ChemBridge Corporation	7951904			Cc1ccc(cc1)-c1cc(no1)C(=O)NCc1cccnc1	InChI=1S/C17H15N3O2/c1-12-4-6-14(7-5-12)16-9-15(20-22-16)17(21)19-11-13-3-2-8-18-10-13/h2-10H,11H2,1H3,(H,19,21)	GRGPMWYJLYMDJJ-UHFFFAOYSA-N	293.11642675							107493
MLS000735717	LSM-18849	SID24781566, BRD-K89725005	16187589	InChI=1S/C16H17F3N2O2/c1-11-14(10-21-5-7-22-8-6-21)20-15(23-11)12-3-2-4-13(9-12)16(17,18)19/h2-4,9H,5-8,10H2,1H3	FXCQJWRNGGAQKW-UHFFFAOYSA-N	Cc1oc(nc1CN2CCOCC2)c3cccc(c3)C(F)(F)F	BroadT	BRD-K89725005	BRD-K89725005-001-05-5	ChemBridge Corporation	53138386			Cc1oc(nc1CN1CCOCC1)-c1cccc(c1)C(F)(F)F	InChI=1S/C16H17F3N2O2/c1-11-14(10-21-5-7-22-8-6-21)20-15(23-11)12-3-2-4-13(9-12)16(17,18)19/h2-4,9H,5-8,10H2,1H3	FXCQJWRNGGAQKW-UHFFFAOYSA-N	326.124212404							107494
2-(2-Fluorophenyl)-5-(4-methylpiperidin-1-yl)-1,3-oxazole-4-carbonitrile	LSM-18850	SID7967738, BRD-K29697604	935568	InChI=1S/C16H16FN3O/c1-11-6-8-20(9-7-11)16-14(10-18)19-15(21-16)12-4-2-3-5-13(12)17/h2-5,11H,6-9H2,1H3	HKTQMNIBQUGQPC-UHFFFAOYSA-N	CC1CCN(CC1)c2oc(nc2C#N)c3ccccc3F	BroadT	BRD-K29697604	BRD-K29697604-001-04-7	ChemDiv Inc.	4552-3304			CC1CCN(CC1)c1oc(nc1C#N)-c1ccccc1F	InChI=1S/C16H16FN3O/c1-11-6-8-20(9-7-11)16-14(10-18)19-15(21-16)12-4-2-3-5-13(12)17/h2-5,11H,6-9H2,1H3	HKTQMNIBQUGQPC-UHFFFAOYSA-N	285.127740362							107495
BAS 03216859	LSM-18851	SID842457, BRD-K30333141	644722	InChI=1S/C13H13NO3S/c1-16-10-6-9(7-11(8-10)17-2)14-13(15)12-4-3-5-18-12/h3-8H,1-2H3,(H,14,15)	BIDIAQAIXYPRDY-UHFFFAOYSA-N	COc1cc(NC(=O)c2cccs2)cc(OC)c1	BroadT	BRD-K30333141	BRD-K30333141-001-05-3	Asinex Ltd.	BAS 03216859			COc1cc(NC(=O)c2cccs2)cc(OC)c1	InChI=1S/C13H13NO3S/c1-16-10-6-9(7-11(8-10)17-2)14-13(15)12-4-3-5-18-12/h3-8H,1-2H3,(H,14,15)	BIDIAQAIXYPRDY-UHFFFAOYSA-N	263.061613976							107496
SMR000200112	LSM-18852	SID17433424, BRD-K59486308	2212602	InChI=1S/C23H26Cl2N4O2S/c1-4-16-8-5-7-15(2)22(16)26-21(30)14-32-23-28-27-20(29(23)3)9-6-12-31-19-11-10-17(24)13-18(19)25/h5,7-8,10-11,13H,4,6,9,12,14H2,1-3H3,(H,26,30)	HPOGCIRVHHLONM-UHFFFAOYSA-N	CCc1cccc(C)c1NC(=O)CSc2nnc(CCCOc3ccc(Cl)cc3Cl)n2C	BroadT	BRD-K59486308	BRD-K59486308-001-06-2	ChemBridge Corporation	7844349			CCc1cccc(C)c1NC(=O)CSc1nnc(CCCOc2ccc(Cl)cc2Cl)n1C	InChI=1S/C23H26Cl2N4O2S/c1-4-16-8-5-7-15(2)22(16)26-21(30)14-32-23-28-27-20(29(23)3)9-6-12-31-19-11-10-17(24)13-18(19)25/h5,7-8,10-11,13H,4,6,9,12,14H2,1-3H3,(H,26,30)	HPOGCIRVHHLONM-UHFFFAOYSA-N	492.115352222							107497
1-(2,5-Dimethoxyphenyl)-3-phenylthiourea	LSM-18853	SID49642813, BRD-K01199426	730557	InChI=1S/C15H16N2O2S/c1-18-12-8-9-14(19-2)13(10-12)17-15(20)16-11-6-4-3-5-7-11/h3-10H,1-2H3,(H2,16,17,20)	DYIPNXQBWVUFEX-UHFFFAOYSA-N	COc1ccc(OC)c(NC(=Nc2ccccc2)S)c1	BroadT	BRD-K01199426	BRD-K01199426-001-05-9	Asinex Ltd.	BAS 01849755			COc1ccc(OC)c(NC(S)=Nc2ccccc2)c1	InChI=1S/C15H16N2O2S/c1-18-12-8-9-14(19-2)13(10-12)17-15(20)16-11-6-4-3-5-7-11/h3-10H,1-2H3,(H2,16,17,20)	DYIPNXQBWVUFEX-UHFFFAOYSA-N	288.093248462							107498
AK-968/13150448	LSM-15538	BRD-K96420869	829314	InChI=1S/C20H23F3N2/c1-16-6-2-3-7-17(16)14-24-10-12-25(13-11-24)15-18-8-4-5-9-19(18)20(21,22)23/h2-9H,10-15H2,1H3	NTJSXLFPKFFCFG-UHFFFAOYSA-N	Cc1ccccc1CN2CCN(Cc3ccccc3C(F)(F)F)CC2	BroadT	BRD-K96420869	BRD-K96420869-034-05-0	Asinex Ltd.	BAS 01840437		OC(=O)C(=O)O	Cc1ccccc1CN1CCN(Cc2ccccc2C(F)(F)F)CC1.OC(=O)C(=O)O	InChI=1S/C20H23F3N2.C2H2O4/c1-16-6-2-3-7-17(16)14-24-10-12-25(13-11-24)15-18-8-4-5-9-19(18)20(21,22)23;3-1(4)2(5)6/h2-9H,10-15H2,1H3;(H,3,4)(H,5,6)	FJTUYHGOJDFPAB-UHFFFAOYSA-N	348.181333356							104174, 104174
MLS000099470	LSM-18854	SID4263077, BRD-K38842393	895500	InChI=1S/C16H14N4O2/c1-22-13-10-6-5-9-12(13)15(21)20-16(17)18-14(19-20)11-7-3-2-4-8-11/h2-10H,1H3,(H2,17,18,19)	XFOFNRPAKUBICP-UHFFFAOYSA-N	COc1ccccc1C(=O)n2nc(nc2N)c3ccccc3	BroadT	BRD-K38842393	BRD-K38842393-001-05-0	ChemBridge Corporation	7644376			COc1ccccc1C(=O)n1nc(nc1N)-c1ccccc1	InChI=1S/C16H14N4O2/c1-22-13-10-6-5-9-12(13)15(21)20-16(17)18-14(19-20)11-7-3-2-4-8-11/h2-10H,1H3,(H2,17,18,19)	XFOFNRPAKUBICP-UHFFFAOYSA-N	294.111675728							107499
MLS000093207	LSM-18855	SID4249464, BRD-K09110331	3243413	InChI=1S/C12H18N2O3/c1-6-17-12(16)10-7(2)9(8(3)13-10)11(15)14(4)5/h13H,6H2,1-5H3	CTHCFZVMGUABNT-UHFFFAOYSA-N	CCOC(=O)c1[nH]c(C)c(C(=O)N(C)C)c1C	BroadT	BRD-K09110331	BRD-K09110331-001-05-2	ChemDiv Inc.	C722-0001			CCOC(=O)c1[nH]c(C)c(C(=O)N(C)C)c1C	InChI=1S/C12H18N2O3/c1-6-17-12(16)10-7(2)9(8(3)13-10)11(15)14(4)5/h13H,6H2,1-5H3	CTHCFZVMGUABNT-UHFFFAOYSA-N	238.131742456							107500
MLS001033768	LSM-18856	SID87544569, SID26669912, BRD-K84547852	5494737	InChI=1S/C15H9ClN4O4/c16-11-4-2-1-3-9(11)14(21)19-18-13-10-7-8(20(23)24)5-6-12(10)17-15(13)22/h1-7,17,22H	WQWLFQYLWHIPHJ-UHFFFAOYSA-N	Oc1[nH]c2ccc(cc2c1N=NC(=O)c3ccccc3Cl)[N+](=O)[O-]	BroadT	BRD-K84547852	BRD-K84547852-001-06-0	Enamine Ltd.	T0503-4873			Oc1[nH]c2ccc(cc2c1N=NC(=O)c1ccccc1Cl)[N+]([O-])=O	InChI=1S/C15H9ClN4O4/c16-11-4-2-1-3-9(11)14(21)19-18-13-10-7-8(20(23)24)5-6-12(10)17-15(13)22/h1-7,17,22H	WQWLFQYLWHIPHJ-UHFFFAOYSA-N	344.031232518							
T0516-0488	LSM-18857	BRD-A58778597	5160456	InChI=1S/C17H15ClN2O3S/c1-9-14(16(21)22-2)15(20-17(24)19-9)13-7-6-12(23-13)10-4-3-5-11(18)8-10/h3-8,15H,1-2H3,(H2,19,20,24)	CMYAZMXYVDLQHR-UHFFFAOYSA-N	COC(=O)C1=C(C)N=C(S)NC1c2oc(cc2)c3cccc(Cl)c3	BroadT	BRD-A58778597	BRD-A58778597-001-07-3	Enamine Ltd.	T0516-0488			COC(=O)C1=C(C)N=C(S)NC1c1ccc(o1)-c1cccc(Cl)c1	InChI=1S/C17H15ClN2O3S/c1-9-14(16(21)22-2)15(20-17(24)19-9)13-7-6-12(23-13)10-4-3-5-11(18)8-10/h3-8,15H,1-2H3,(H2,19,20,24)	CMYAZMXYVDLQHR-UHFFFAOYSA-N	362.04919076							107502
5-Bromo-n'-cycloheptylidene-2-furohydrazide	LSM-18858	SID22405458, BRD-K76957589	3283870	InChI=1S/C12H15BrN2O2/c13-11-8-7-10(17-11)12(16)15-14-9-5-3-1-2-4-6-9/h7-8H,1-6H2,(H,15,16)	LTGPLPDAYODTGM-UHFFFAOYSA-N	Brc1oc(cc1)C(=O)NN=C2CCCCCC2	BroadT	BRD-K76957589	BRD-K76957589-001-05-3	Specs	AK-968/11367284			Brc1ccc(o1)C(=O)NN=C1CCCCCC1	InChI=1S/C12H15BrN2O2/c13-11-8-7-10(17-11)12(16)15-14-9-5-3-1-2-4-6-9/h7-8H,1-6H2,(H,15,16)	LTGPLPDAYODTGM-UHFFFAOYSA-N	298.03169034							107503
SMR000004409	LSM-18859	SID50086786, SID844673, BRD-A39532542	647004	InChI=1S/C27H32N6O3/c1-2-35-23-10-11-25-21(16-23)15-22(27(34)28-25)17-32(18-24-9-6-14-36-24)19-26-29-30-31-33(26)13-12-20-7-4-3-5-8-20/h3-5,7-8,10-11,15-16,24H,2,6,9,12-14,17-19H2,1H3,(H,28,34)	ISUCMNZRBYNLLZ-UHFFFAOYSA-N	CCOc1ccc2nc(O)c(CN(CC3CCCO3)Cc4nnnn4CCc5ccccc5)cc2c1	BroadT	BRD-A39532542	BRD-A39532542-001-05-8	Asinex Ltd.	ASN 05303781			CCOc1ccc2nc(O)c(CN(CC3CCCO3)Cc3nnnn3CCc3ccccc3)cc2c1	InChI=1S/C27H32N6O3/c1-2-35-23-10-11-25-21(16-23)15-22(27(34)28-25)17-32(18-24-9-6-14-36-24)19-26-29-30-31-33(26)13-12-20-7-4-3-5-8-20/h3-5,7-8,10-11,15-16,24H,2,6,9,12-14,17-19H2,1H3,(H,28,34)	ISUCMNZRBYNLLZ-UHFFFAOYSA-N	488.253588944							107504
58905-18-3	LSM-18860	SID861618, BRD-A41973561	662857	InChI=1S/C10H9Cl2N3O/c11-7-1-2-8(9(12)3-7)10(16)4-15-6-13-5-14-15/h1-3,5-6,10,16H,4H2	XCWJBJOPHSVLGU-UHFFFAOYSA-N	OC(Cn1cncn1)c2ccc(Cl)cc2Cl	BroadT	BRD-A41973561	BRD-A41973561-001-05-6	InterBioScreen Ltd.	STOCK4S-16960			OC(Cn1cncn1)c1ccc(Cl)cc1Cl	InChI=1S/C10H9Cl2N3O/c11-7-1-2-8(9(12)3-7)10(16)4-15-6-13-5-14-15/h1-3,5-6,10,16H,4H2	XCWJBJOPHSVLGU-UHFFFAOYSA-N	257.012267358							107505
MLS000027148	LSM-18861	SID852129, BRD-K07162418	54692915	InChI=1S/C19H16N4O3/c1-2-23-14-10-6-3-7-11(14)16(24)15(18(23)26)17(25)22-19-20-12-8-4-5-9-13(12)21-19/h3-10,24H,2H2,1H3,(H2,20,21,22,25)	MSIIQGRNGMMSTR-UHFFFAOYSA-N	CCN1C(=O)C(=C(O)c2ccccc12)C(=O)Nc3nc4ccccc4[nH]3	BroadT	BRD-K07162418	BRD-K07162418-001-07-7	Asinex Ltd.	BAS 03848013			CCn1c2ccccc2c(O)c(C(=O)Nc2nc3ccccc3[nH]2)c1=O	InChI=1S/C19H16N4O3/c1-2-23-14-10-6-3-7-11(14)16(24)15(18(23)26)17(25)22-19-20-12-8-4-5-9-13(12)21-19/h3-10,24H,2H2,1H3,(H2,20,21,22,25)	MSIIQGRNGMMSTR-UHFFFAOYSA-N	348.122240412							107506
7-Methoxy-n-(pyridin-3-ylmethyl)furo[2,3-b]quinoline-2-carboxamide	LSM-18862	SID24814454, BRD-K36549357	4185310	InChI=1S/C19H15N3O3/c1-24-15-5-4-13-7-14-8-17(25-19(14)22-16(13)9-15)18(23)21-11-12-3-2-6-20-10-12/h2-10H,11H2,1H3,(H,21,23)	OKUOVCIWUHICLI-UHFFFAOYSA-N	COc1ccc2cc3cc(oc3nc2c1)C(=O)NCc4cccnc4	BroadT	BRD-K36549357	BRD-K36549357-001-05-7	ChemDiv Inc.	C369-0304			COc1ccc2cc3cc(oc3nc2c1)C(=O)NCc1cccnc1	InChI=1S/C19H15N3O3/c1-24-15-5-4-13-7-14-8-17(25-19(14)22-16(13)9-15)18(23)21-11-12-3-2-6-20-10-12/h2-10H,11H2,1H3,(H,21,23)	OKUOVCIWUHICLI-UHFFFAOYSA-N	333.11134137							107507
4-(2,6-Diphenyl-pyrimidin-4-yloxy)-benzaldehyde	LSM-18863	SID17508172, BRD-K71060914	1082031	InChI=1S/C23H16N2O2/c26-16-17-11-13-20(14-12-17)27-22-15-21(18-7-3-1-4-8-18)24-23(25-22)19-9-5-2-6-10-19/h1-16H	LIFZPHDRVIMFLU-UHFFFAOYSA-N	O=Cc1ccc(Oc2cc(nc(n2)c3ccccc3)c4ccccc4)cc1	BroadT	BRD-K71060914	BRD-K71060914-001-06-5	Asinex Ltd.	BAS 00317886			O=Cc1ccc(Oc2cc(nc(n2)-c2ccccc2)-c2ccccc2)cc1	InChI=1S/C23H16N2O2/c26-16-17-11-13-20(14-12-17)27-22-15-21(18-7-3-1-4-8-18)24-23(25-22)19-9-5-2-6-10-19/h1-16H	LIFZPHDRVIMFLU-UHFFFAOYSA-N	352.121177772							107508
Phenanthroline	LSM-18864	1,10-Phenanthroline	1318	InChI=1S/C12H8N2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-8H	DGEZNRSVGBDHLK-UHFFFAOYSA-N	c1cnc2c(c1)ccc3cccnc23	BroadT	BRD-K91050611	BRD-K91050611-001-16-7	National Cancer Institute Chemotherapeutic Agents Repository	1,10-PHENANTHROLINE;66-71-7 4265			c1cnc2c(c1)ccc1cccnc21	InChI=1S/C12H8N2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-8H	DGEZNRSVGBDHLK-UHFFFAOYSA-N	180.068748276							44975, 44975, 44975, 44975, 44975
MLS000871790	LSM-18865	SID24783077, BRD-K72925518	16188044	InChI=1S/C14H14N4O5S/c1-6-11(18(21)22)10(17-23-6)13(20)16-14-9(12(15)19)7-4-2-3-5-8(7)24-14/h2-5H2,1H3,(H2,15,19)(H,16,20)	KWSMRTMQIZTIHV-UHFFFAOYSA-N	Cc1onc(C(=O)Nc2sc3CCCCc3c2C(=O)N)c1[N+](=O)[O-]	BroadT	BRD-K72925518	BRD-K72925518-001-05-0	ChemDiv Inc.	C582-0863			Cc1onc(C(=O)Nc2sc3CCCCc3c2C(N)=O)c1[N+]([O-])=O	InChI=1S/C14H14N4O5S/c1-6-11(18(21)22)10(17-23-6)13(20)16-14-9(12(15)19)7-4-2-3-5-8(7)24-14/h2-5H2,1H3,(H2,15,19)(H,16,20)	KWSMRTMQIZTIHV-UHFFFAOYSA-N	350.068490278							107509
MLS000053132	LSM-18866	SID4265604, BRD-K04351169	689500	InChI=1S/C13H12N2O2/c1-17-11-7-3-2-6-10(11)13(16)15-12-8-4-5-9-14-12/h2-9H,1H3,(H,14,15,16)	FHPWTYWEPNEAQY-UHFFFAOYSA-N	COc1ccccc1C(=O)Nc2ccccn2	BroadT	BRD-K04351169	BRD-K04351169-001-07-0	ChemBridge Corporation	5309556			COc1ccccc1C(=O)Nc1ccccn1	InChI=1S/C13H12N2O2/c1-17-11-7-3-2-6-10(11)13(16)15-12-8-4-5-9-14-12/h2-9H,1H3,(H,14,15,16)	FHPWTYWEPNEAQY-UHFFFAOYSA-N	228.089877644							107510
ST50739489	LSM-18867	SID14724253, BRD-K63349542	794339	InChI=1S/C12H15N3O4S/c1-14(2)10-5-3-9(4-6-10)13-11-7-20(18,19)8-12(11)15(16)17/h3-6,13H,7-8H2,1-2H3	OHWVTHZEJBUEKL-UHFFFAOYSA-N	CN(C)c1ccc(NC2=C(CS(=O)(=O)C2)[N+](=O)[O-])cc1	BroadT	BRD-K63349542	BRD-K63349542-001-05-4	Asinex Ltd.	BAS 00667339			CN(C)c1ccc(NC2=C(CS(=O)(=O)C2)[N+]([O-])=O)cc1	InChI=1S/C12H15N3O4S/c1-14(2)10-5-3-9(4-6-10)13-11-7-20(18,19)8-12(11)15(16)17/h3-6,13H,7-8H2,1-2H3	OHWVTHZEJBUEKL-UHFFFAOYSA-N	297.07832668							107511
SMR000073885	LSM-18868	SID4255465, SID87338259, BRD-K17959025	1281119	InChI=1S/C20H22N4O2/c1-25-14-9-10-17(18(13-14)26-2)21-19-15-7-3-4-8-16(15)22-20(23-19)24-11-5-6-12-24/h3-4,7-10,13H,5-6,11-12H2,1-2H3,(H,21,22,23)	ZIDQHHIURCUZOD-UHFFFAOYSA-N	COc1ccc(Nc2nc(nc3ccccc23)N4CCCC4)c(OC)c1	BroadT	BRD-K17959025	BRD-K17959025-001-07-9	ChemBridge Corporation	7622086			COc1ccc(Nc2nc(nc3ccccc23)N2CCCC2)c(OC)c1	InChI=1S/C20H22N4O2/c1-25-14-9-10-17(18(13-14)26-2)21-19-15-7-3-4-8-16(15)22-20(23-19)24-11-5-6-12-24/h3-4,7-10,13H,5-6,11-12H2,1-2H3,(H,21,22,23)	ZIDQHHIURCUZOD-UHFFFAOYSA-N	350.174275984							107512
SMR000034527	LSM-18869	SID863937, BRD-K45034322	665194	InChI=1S/C11H8Cl2N2O/c12-6-1-2-7(13)10-8(6)5-3-4-14-11(16)9(5)15-10/h1-2,15H,3-4H2,(H,14,16)	VJUGVVOGVWAGRV-UHFFFAOYSA-N	Clc1ccc(Cl)c2c3CCNC(=O)c3[nH]c12	BroadT	BRD-K45034322	BRD-K45034322-001-05-1	InterBioScreen Ltd.	STOCK4S-99042			Clc1ccc(Cl)c2c3CCNC(=O)c3[nH]c12	InChI=1S/C11H8Cl2N2O/c12-6-1-2-7(13)10-8(6)5-3-4-14-11(16)9(5)15-10/h1-2,15H,3-4H2,(H,14,16)	VJUGVVOGVWAGRV-UHFFFAOYSA-N	254.001368316							107513
ASN 03431498	LSM-18870	SID24807275, BRD-A10555284	3172890	InChI=1S/C23H30N2O4S/c1-27-17-10-11-21(28-2)19(13-17)20-15-30-23(24-20)25(14-18-9-6-12-29-18)22(26)16-7-4-3-5-8-16/h10-11,13,15-16,18H,3-9,12,14H2,1-2H3	CUKWXDBNFZFYEG-UHFFFAOYSA-N	COc1ccc(OC)c(c1)c2csc(n2)N(CC3CCCO3)C(=O)C4CCCCC4	BroadT	BRD-A10555284	BRD-A10555284-001-06-2	Asinex Ltd.	ASN 03431498			COc1ccc(OC)c(c1)-c1csc(n1)N(CC1CCCO1)C(=O)C1CCCCC1	InChI=1S/C23H30N2O4S/c1-27-17-10-11-21(28-2)19(13-17)20-15-30-23(24-20)25(14-18-9-6-12-29-18)22(26)16-7-4-3-5-8-16/h10-11,13,15-16,18H,3-9,12,14H2,1-2H3	CUKWXDBNFZFYEG-UHFFFAOYSA-N	430.19262815							107514
ZINC00535724	LSM-18871	SID26662370, BRD-K98724916	940003	InChI=1S/C16H21NO5/c1-12(2)16(18)17-13-3-4-14-15(11-13)22-10-8-20-6-5-19-7-9-21-14/h3-4,11H,1,5-10H2,2H3,(H,17,18)	SHOAYIYXGKLRBB-UHFFFAOYSA-N	CC(=C)C(=O)Nc1ccc2OCCOCCOCCOc2c1	BroadT	BRD-K98724916	BRD-K98724916-001-05-5	InterBioScreen Ltd.	STOCK2S-97739			CC(=C)C(=O)Nc1ccc2OCCOCCOCCOc2c1	InChI=1S/C16H21NO5/c1-12(2)16(18)17-13-3-4-14-15(11-13)22-10-8-20-6-5-19-7-9-21-14/h3-4,11H,1,5-10H2,2H3,(H,17,18)	SHOAYIYXGKLRBB-UHFFFAOYSA-N	307.141972782							107515
ST50317697	LSM-18872	SID47204563, BRD-A73571245	6497425	InChI=1S/C17H23FN2O2/c1-3-12(2)19-17(22)14-10-16(21)20(11-14)9-8-13-4-6-15(18)7-5-13/h4-7,12,14H,3,8-11H2,1-2H3,(H,19,22)	IRUDLSXNIASDSR-UHFFFAOYSA-N	CCC(C)NC(=O)C1CN(CCc2ccc(F)cc2)C(=O)C1	BroadT	BRD-A73571245	BRD-A73571245-001-05-3	Asinex Ltd.	BAS 13780821			CCC(C)NC(=O)C1CN(CCc2ccc(F)cc2)C(=O)C1	InChI=1S/C17H23FN2O2/c1-3-12(2)19-17(22)14-10-16(21)20(11-14)9-8-13-4-6-15(18)7-5-13/h4-7,12,14H,3,8-11H2,1-2H3,(H,19,22)	IRUDLSXNIASDSR-UHFFFAOYSA-N	306.174356196							107516
ST50927665	LSM-18873	SID7975635, BRD-K77048122	1293958	InChI=1S/C18H24N2O6S2/c1-5-27(21,22)19-15-9-7-13(11-17(15)25-3)14-8-10-16(18(12-14)26-4)20-28(23,24)6-2/h7-12,19-20H,5-6H2,1-4H3	WCNQIIHWNXOJQB-UHFFFAOYSA-N	CCS(=O)(=O)Nc1ccc(cc1OC)c2ccc(NS(=O)(=O)CC)c(OC)c2	BroadT	BRD-K77048122	BRD-K77048122-001-05-4	ChemBridge Corporation	7292713			CCS(=O)(=O)Nc1ccc(cc1OC)-c1ccc(NS(=O)(=O)CC)c(OC)c1	InChI=1S/C18H24N2O6S2/c1-5-27(21,22)19-15-9-7-13(11-17(15)25-3)14-8-10-16(18(12-14)26-4)20-28(23,24)6-2/h7-12,19-20H,5-6H2,1-4H3	WCNQIIHWNXOJQB-UHFFFAOYSA-N	428.107577888							107517
AC1O9Z9B	LSM-18874	BRD-K94811027	6741734	InChI=1S/C12H12N2O2/c1-7-5-8(2)12(15)11-10(7)4-3-9(14-11)6-13-16/h3-6,15-16H,1-2H3	AYGNPZLVDLAIJB-UHFFFAOYSA-N	Cc1cc(C)c2ccc(C=NO)nc2c1O	BroadT	BRD-K94811027	BRD-K94811027-001-05-0	ChemDiv Inc.	0422-0035			Cc1cc(C)c2ccc(C=NO)nc2c1O	InChI=1S/C12H12N2O2/c1-7-5-8(2)12(15)11-10(7)4-3-9(14-11)6-13-16/h3-6,15-16H,1-2H3	AYGNPZLVDLAIJB-UHFFFAOYSA-N	216.089877644							
MLS000580698	LSM-18875	SID17509318, BRD-K89412036	4326877	InChI=1S/C19H13ClN4O2/c20-12-4-7-17-23-18(14-3-1-2-8-21-14)19(24(17)10-12)22-13-5-6-15-16(9-13)26-11-25-15/h1-10,22H,11H2	RZZMLQUIUHVURI-UHFFFAOYSA-N	Clc1ccc2nc(c(Nc3ccc4OCOc4c3)n2c1)c5ccccn5	BroadT	BRD-K89412036	BRD-K89412036-001-06-1	ChemDiv Inc.	C177-0167			Clc1ccc2nc(c(Nc3ccc4OCOc4c3)n2c1)-c1ccccn1	InChI=1S/C19H13ClN4O2/c20-12-4-7-17-23-18(14-3-1-2-8-21-14)19(24(17)10-12)22-13-5-6-15-16(9-13)26-11-25-15/h1-10,22H,11H2	RZZMLQUIUHVURI-UHFFFAOYSA-N	364.072703406							107519
MLS000756915	LSM-18876	NSC-366807, BRD-K49243142	339578	InChI=1S/C9H9N3S2/c1-2-5-14-9-10-8(11-12-9)7-4-3-6-13-7/h2-4,6H,1,5H2,(H,10,11,12)	RPRQETFEPUYFMP-UHFFFAOYSA-N	C=CCSc1n[nH]c(n1)c2cccs2	BroadT	BRD-K49243142	BRD-K49243142-001-05-2	National Cancer Institute Chemotherapeutic Agents Repository	366807			C=CCSc1n[nH]c(n1)-c1cccs1	InChI=1S/C9H9N3S2/c1-2-5-14-9-10-8(11-12-9)7-4-3-6-13-7/h2-4,6H,1,5H2,(H,10,11,12)	RPRQETFEPUYFMP-UHFFFAOYSA-N	223.023788698							107520
ST50904691	LSM-18877	SID49819170, BRD-K12174771	2220460	InChI=1S/C23H21ClN4O2/c1-13-16(24)9-8-14-15(11-18(26-21(13)14)17-7-5-6-10-25-17)22(29)27-20-12-19(30-28-20)23(2,3)4/h5-12H,1-4H3,(H,27,28,29)	QKCWGPACWPETIE-UHFFFAOYSA-N	Cc1c(Cl)ccc2c(cc(nc12)c3ccccn3)C(=O)Nc4cc(on4)C(C)(C)C	BroadT	BRD-K12174771	BRD-K12174771-001-06-8	ChemBridge Corporation	7921567			Cc1c(Cl)ccc2c(cc(nc12)-c1ccccn1)C(=O)Nc1cc(on1)C(C)(C)C	InChI=1S/C23H21ClN4O2/c1-13-16(24)9-8-14-15(11-18(26-21(13)14)17-7-5-6-10-25-17)22(29)27-20-12-19(30-28-20)23(2,3)4/h5-12H,1-4H3,(H,27,28,29)	QKCWGPACWPETIE-UHFFFAOYSA-N	420.135303662							107521
AC1ME0J4	LSM-18878	SID47198234, BRD-K20735998	2845970	InChI=1S/C23H29NO4/c1-3-27-23(25)20-11-13-24(14-12-20)16-19-9-10-21(26-2)22(15-19)28-17-18-7-5-4-6-8-18/h4-10,15,20H,3,11-14,16-17H2,1-2H3	ZFHBICVGEKIVQB-UHFFFAOYSA-N	CCOC(=O)C1CCN(Cc2ccc(OC)c(OCc3ccccc3)c2)CC1	BroadT	BRD-K20735998	BRD-K20735998-001-05-5	ChemBridge Corporation	5427803			CCOC(=O)C1CCN(Cc2ccc(OC)c(OCc3ccccc3)c2)CC1	InChI=1S/C23H29NO4/c1-3-27-23(25)20-11-13-24(14-12-20)16-19-9-10-21(26-2)22(15-19)28-17-18-7-5-4-6-8-18/h4-10,15,20H,3,11-14,16-17H2,1-2H3	ZFHBICVGEKIVQB-UHFFFAOYSA-N	383.209658418							107522
ST50272833	LSM-18879	SID24822397, BRD-K61547199	1164596	InChI=1S/C20H15ClN2O5/c21-14-11-13(4-5-15(14)23-20(25)17-2-1-7-26-17)22-19(24)12-3-6-16-18(10-12)28-9-8-27-16/h1-7,10-11H,8-9H2,(H,22,24)(H,23,25)	VAGNSHOVECQQTP-UHFFFAOYSA-N	Clc1cc(NC(=O)c2ccc3OCCOc3c2)ccc1NC(=O)c4occc4	BroadT	BRD-K61547199	BRD-K61547199-001-06-9	Asinex Ltd.	BAS 03595754			Clc1cc(NC(=O)c2ccc3OCCOc3c2)ccc1NC(=O)c1ccco1	InChI=1S/C20H15ClN2O5/c21-14-11-13(4-5-15(14)23-20(25)17-2-1-7-26-17)22-19(24)12-3-6-16-18(10-12)28-9-8-27-16/h1-7,10-11H,8-9H2,(H,22,24)(H,23,25)	VAGNSHOVECQQTP-UHFFFAOYSA-N	398.06694931							107523
SMR000206275	LSM-18880	SID17510526, BRD-A74700532	12005243	InChI=1S/C21H26ClN5O/c1-13-3-4-17(6-18(13)22)23-19(28)11-20-7-15-5-16(8-20)10-21(9-15,12-20)27-25-14(2)24-26-27/h3-4,6,15-16H,5,7-12H2,1-2H3,(H,23,28)	BNIKBLBYQYVLRK-UHFFFAOYSA-N	Cc1nnn(n1)C23CC4CC(CC(CC(=O)Nc5ccc(C)c(Cl)c5)(C4)C2)C3	BroadT	BRD-A74700532	BRD-A74700532-001-05-9	ChemDiv Inc.	C301-1581			Cc1nnn(n1)C12CC3CC(CC(CC(=O)Nc4ccc(C)c(Cl)c4)(C3)C1)C2	InChI=1S/C21H26ClN5O/c1-13-3-4-17(6-18(13)22)23-19(28)11-20-7-15-5-16(8-20)10-21(9-15,12-20)27-25-14(2)24-26-27/h3-4,6,15-16H,5,7-12H2,1-2H3,(H,23,28)	BNIKBLBYQYVLRK-UHFFFAOYSA-N	399.182588212							107524
T0503-1147	LSM-18881	SID3716244, BRD-A74516318	2999532	InChI=1S/C16H12F2O4/c17-11-4-3-5-12(18)15(11)16(19)21-9-10-8-20-13-6-1-2-7-14(13)22-10/h1-7,10H,8-9H2	FQPWRGVIEHNQDQ-UHFFFAOYSA-N	Fc1cccc(F)c1C(=O)OCC2COc3ccccc3O2	BroadT	BRD-A74516318	BRD-A74516318-001-05-9	Enamine Ltd.	T0503-1147			Fc1cccc(F)c1C(=O)OCC1COc2ccccc2O1	InChI=1S/C16H12F2O4/c17-11-4-3-5-12(18)15(11)16(19)21-9-10-8-20-13-6-1-2-7-14(13)22-10/h1-7,10H,8-9H2	FQPWRGVIEHNQDQ-UHFFFAOYSA-N	306.070365264							107525
CHEMBL597055	LSM-3333	BRD-K59794046	25067496	InChI=1S/C16H14N2O3/c1-10-17-12-4-2-3-5-13(12)18(10)9-16(21)11-6-7-14(19)15(20)8-11/h2-8,19-20H,9H2,1H3	BSXRJIBWLOPQGM-UHFFFAOYSA-N	Cc1nc2ccccc2n1CC(=O)c3ccc(O)c(O)c3	BroadT	BRD-K59794046	BRD-K59794046-003-04-7	Sanford-Burnham Medical Research Institute	MLS-0315854.0002		Cl	Cc1nc2ccccc2n1CC(=O)c1ccc(O)c(O)c1.Cl	InChI=1S/C16H14N2O3.ClH/c1-10-17-12-4-2-3-5-13(12)18(10)9-16(21)11-6-7-14(19)15(20)8-11;/h2-8,19-20H,9H2,1H3;1H	RGYBYJNRVCAGHG-UHFFFAOYSA-N	282.100442328							93050, 93050
SMR000003957	LSM-18882	SID26668166, SID842986, BRD-A81457325	645264	InChI=1S/C22H30N6S/c1-16-8-6-9-18(17(16)2)26-11-13-27(14-12-26)20(19-10-7-15-29-19)21-23-24-25-28(21)22(3,4)5/h6-10,15,20H,11-14H2,1-5H3	BQPQYRCBUNHGPV-UHFFFAOYSA-N	Cc1cccc(N2CCN(CC2)C(c3cccs3)c4nnnn4C(C)(C)C)c1C	BroadT	BRD-A81457325	BRD-A81457325-001-05-8	Asinex Ltd.	ASN 05073410			Cc1cccc(N2CCN(CC2)C(c2cccs2)c2nnnn2C(C)(C)C)c1C	InChI=1S/C22H30N6S/c1-16-8-6-9-18(17(16)2)26-11-13-27(14-12-26)20(19-10-7-15-29-19)21-23-24-25-28(21)22(3,4)5/h6-10,15,20H,11-14H2,1-5H3	BQPQYRCBUNHGPV-UHFFFAOYSA-N	410.22526571							107526
BAS 03543408	LSM-15283	BRD-K52743528	1566596	InChI=1S/C21H25N3O2/c1-16-8-10-17(11-9-16)20-22-19-7-5-4-6-18(19)21(23-20)24(12-14-25-2)13-15-26-3/h4-11H,12-15H2,1-3H3	VDENOZWXPJFATJ-UHFFFAOYSA-N	COCCN(CCOC)c1nc(nc2ccccc12)c3ccc(C)cc3	BroadT	BRD-K52743528	BRD-K52743528-003-06-3	Asinex Ltd.	BAS 03543408		Cl	COCCN(CCOC)c1nc(nc2ccccc12)-c1ccc(C)cc1.Cl	InChI=1S/C21H25N3O2.ClH/c1-16-8-10-17(11-9-16)20-22-19-7-5-4-6-18(19)21(23-20)24(12-14-25-2)13-15-26-3;/h4-11H,12-15H2,1-3H3;1H	LFDAPJRRNJJOKS-UHFFFAOYSA-N	351.19467707							103930, 103930
AC1M1XBE	LSM-18883	SID24815171, BRD-K07745565	2157872	InChI=1S/C19H23N3S2/c1-13-6-7-18-17(11-13)16(14(2)21-18)8-9-22(19(23)20-3)12-15-5-4-10-24-15/h4-7,10-11,21H,8-9,12H2,1-3H3,(H,20,23)	QKCPZWFKHBBANF-UHFFFAOYSA-N	CN=C(S)N(CCc1c(C)[nH]c2ccc(C)cc12)Cc3cccs3	BroadT	BRD-K07745565	BRD-K07745565-001-05-4	Life Chemicals Inc.	F0591-0793			CN=C(S)N(CCc1c(C)[nH]c2ccc(C)cc12)Cc1cccs1	InChI=1S/C19H23N3S2/c1-13-6-7-18-17(11-13)16(14(2)21-18)8-9-22(19(23)20-3)12-15-5-4-10-24-15/h4-7,10-11,21H,8-9,12H2,1-3H3,(H,20,23)	QKCPZWFKHBBANF-UHFFFAOYSA-N	357.133339146							107527
3-(4-Chlorophenyl)-2-(2,3-dimethoxyphenyl)-1,3-thiazolidin-4-one	LSM-18884	SID17509993, BRD-A10284974	4259693	InChI=1S/C17H16ClNO3S/c1-21-14-5-3-4-13(16(14)22-2)17-19(15(20)10-23-17)12-8-6-11(18)7-9-12/h3-9,17H,10H2,1-2H3	USKBADUQYSXSCK-UHFFFAOYSA-N	COc1cccc(C2SCC(=O)N2c3ccc(Cl)cc3)c1OC	BroadT	BRD-A10284974	BRD-A10284974-001-05-6	ChemDiv Inc.	K205-1865			COc1cccc(C2SCC(=O)N2c2ccc(Cl)cc2)c1OC	InChI=1S/C17H16ClNO3S/c1-21-14-5-3-4-13(16(14)22-2)17-19(15(20)10-23-17)12-8-6-11(18)7-9-12/h3-9,17H,10H2,1-2H3	USKBADUQYSXSCK-UHFFFAOYSA-N	349.053941782							107528
SMR000030752	LSM-18885	SID4241563, BRD-K51632550	3236520	InChI=1S/C27H33N3O3/c1-4-20-9-11-22(12-10-20)27-29-24(19(2)33-27)18-30-15-13-21(14-16-30)26(31)28-17-23-7-5-6-8-25(23)32-3/h5-12,21H,4,13-18H2,1-3H3,(H,28,31)	MBMSEQXNHWPJPP-UHFFFAOYSA-N	CCc1ccc(cc1)c2oc(C)c(CN3CCC(CC3)C(=O)NCc4ccccc4OC)n2	BroadT	BRD-K51632550	BRD-K51632550-001-05-6	ChemDiv Inc.	C522-1394			CCc1ccc(cc1)-c1nc(CN2CCC(CC2)C(=O)NCc2ccccc2OC)c(C)o1	InChI=1S/C27H33N3O3/c1-4-20-9-11-22(12-10-20)27-29-24(19(2)33-27)18-30-15-13-21(14-16-30)26(31)28-17-23-7-5-6-8-25(23)32-3/h5-12,21H,4,13-18H2,1-3H3,(H,28,31)	MBMSEQXNHWPJPP-UHFFFAOYSA-N	447.252191946							107529
F1654-0461	LSM-18886	SID14729742, BRD-A03739427	4172397	InChI=1S/C18H15FN2O4/c19-12-5-3-4-11(8-12)16(21-15-6-1-2-7-20-15)18-17(24)14(23)9-13(10-22)25-18/h1-9,16,22,24H,10H2,(H,20,21)	PIMBWGQKUSYHBN-UHFFFAOYSA-N	OCC1=CC(=O)C(=C(O1)C(Nc2ccccn2)c3cccc(F)c3)O	BroadT	BRD-A03739427	BRD-A03739427-001-04-4	Life Chemicals Inc.	F1654-0461			OCc1cc(=O)c(O)c(o1)C(Nc1ccccn1)c1cccc(F)c1	InChI=1S/C18H15FN2O4/c19-12-5-3-4-11(8-12)16(21-15-6-1-2-7-20-15)18-17(24)14(23)9-13(10-22)25-18/h1-9,16,22,24H,10H2,(H,20,21)	PIMBWGQKUSYHBN-UHFFFAOYSA-N	342.10158518							107530
MLS000522700	LSM-18887	SID14733283, BRD-K41902935	9550441	InChI=1S/C18H19N3O2S/c1-11-6-12(2)8-14(7-11)20-18(23)19-13-4-5-16-15(9-13)21(3)17(22)10-24-16/h4-9H,10H2,1-3H3,(H2,19,20,23)	XUIAATHNEQWORS-UHFFFAOYSA-N	CN1C(=O)CSc2ccc(NC(=O)Nc3cc(C)cc(C)c3)cc12	BroadT	BRD-K41902935	BRD-K41902935-001-04-5	ChemDiv Inc.	C791-0227			CN1C(=O)CSc2ccc(NC(=O)Nc3cc(C)cc(C)c3)cc12	InChI=1S/C18H19N3O2S/c1-11-6-12(2)8-14(7-11)20-18(23)19-13-4-5-16-15(9-13)21(3)17(22)10-24-16/h4-9H,10H2,1-3H3,(H2,19,20,23)	XUIAATHNEQWORS-UHFFFAOYSA-N	341.119797568							107531
14377-21-0	LSM-18888	SID4242159, BRD-K06805435	2840098	InChI=1S/C13H18O2/c1-2-3-4-5-11-6-8-12(9-7-11)10-13(14)15/h6-9H,2-5,10H2,1H3,(H,14,15)	YAAVVJAWWNQMCY-UHFFFAOYSA-N	CCCCCc1ccc(CC(=O)O)cc1	BroadT	BRD-K06805435	BRD-K06805435-001-05-5	ChemDiv Inc.	0088-0016			CCCCCc1ccc(CC(O)=O)cc1	InChI=1S/C13H18O2/c1-2-3-4-5-11-6-8-12(9-7-11)10-13(14)15/h6-9H,2-5,10H2,1H3,(H,14,15)	YAAVVJAWWNQMCY-UHFFFAOYSA-N	206.130679816							107532
ST50833674	LSM-18889	SID49823561, BRD-K79213734	20411474	InChI=1S/C15H13ClN2O2S/c16-10-2-1-3-11(8-10)17-15(21)18-12-4-5-13-14(9-12)20-7-6-19-13/h1-5,8-9H,6-7H2,(H2,17,18,21)	WVEBVYOXGIJPLM-UHFFFAOYSA-N	Clc1cccc(NC(=S)Nc2ccc3OCCOc3c2)c1	BroadT	BRD-K79213734	BRD-K79213734-001-05-2	Chemical Technologies & Investigations	AMNCS-33006			Clc1cccc(NC(=S)Nc2ccc3OCCOc3c2)c1	InChI=1S/C15H13ClN2O2S/c16-10-2-1-3-11(8-10)17-15(21)18-12-4-5-13-14(9-12)20-7-6-19-13/h1-5,8-9H,6-7H2,(H2,17,18,21)	WVEBVYOXGIJPLM-UHFFFAOYSA-N	320.038626076							107533
6-Methyl-indolo[1,2-c]quinazolin-12-ylamine	LSM-18890	SID24828645, BRD-K96911077	2396841	InChI=1S/C16H13N3/c1-10-18-13-8-4-2-6-11(13)16-15(17)12-7-3-5-9-14(12)19(10)16/h2-9H,17H2,1H3	JXDDRDSPPIIJOQ-UHFFFAOYSA-N	Cc1nc2ccccc2c3c(N)c4ccccc4n13	BroadT	BRD-K96911077	BRD-K96911077-001-05-5	Enamine Ltd.	T0519-9896			Cc1nc2ccccc2c2c(N)c3ccccc3n12	InChI=1S/C16H13N3/c1-10-18-13-8-4-2-6-11(13)16-15(17)12-7-3-5-9-14(12)19(10)16/h2-9H,17H2,1H3	JXDDRDSPPIIJOQ-UHFFFAOYSA-N	247.110947446							107534
SMR000046050	LSM-18891	SID863907, BRD-K75125457	665159	InChI=1S/C13H15N3O4S/c1-4-20-13(17)14-12-16-15-11(21-12)8-5-6-9(18-2)10(7-8)19-3/h5-7H,4H2,1-3H3,(H,14,16,17)	QVLHJLUCXFPSDD-UHFFFAOYSA-N	CCOC(=O)Nc1nnc(s1)c2ccc(OC)c(OC)c2	BroadT	BRD-K75125457	BRD-K75125457-001-05-7	InterBioScreen Ltd.	STOCK4S-87253			CCOC(=O)Nc1nnc(s1)-c1ccc(OC)c(OC)c1	InChI=1S/C13H15N3O4S/c1-4-20-13(17)14-12-16-15-11(21-12)8-5-6-9(18-2)10(7-8)19-3/h5-7H,4H2,1-3H3,(H,14,16,17)	QVLHJLUCXFPSDD-UHFFFAOYSA-N	309.07832668							107535
MLS000095126	LSM-18892	SID24838643, SID4244269, BRD-K41919428	3238889	InChI=1S/C24H25N3O7S/c1-2-26-14-19(24(29)25-13-16-3-6-21-22(11-16)34-15-33-21)23(28)18-12-17(4-5-20(18)26)35(30,31)27-7-9-32-10-8-27/h3-6,11-12,14H,2,7-10,13,15H2,1H3,(H,25,29)	CKLNJEVAHISUMB-UHFFFAOYSA-N	CCN1C=C(C(=O)NCc2ccc3OCOc3c2)C(=O)c4cc(ccc14)S(=O)(=O)N5CCOCC5	BroadT	BRD-K41919428	BRD-K41919428-001-05-0	ChemDiv Inc.	C519-1526			CCn1cc(C(=O)NCc2ccc3OCOc3c2)c(=O)c2cc(ccc12)S(=O)(=O)N1CCOCC1	InChI=1S/C24H25N3O7S/c1-2-26-14-19(24(29)25-13-16-3-6-21-22(11-16)34-15-33-21)23(28)18-12-17(4-5-20(18)26)35(30,31)27-7-9-32-10-8-27/h3-6,11-12,14H,2,7-10,13,15H2,1H3,(H,25,29)	CKLNJEVAHISUMB-UHFFFAOYSA-N	499.14132086							107536
ZINC05584743	LSM-18893	SID22414218, BRD-K74891695	4077727	InChI=1S/C15H16ClN5O4S/c1-4-25-9-5-6-10(11(7-9)21(23)24)17-15(26)18-14(22)13-12(16)8(2)19-20(13)3/h5-7H,4H2,1-3H3,(H2,17,18,22,26)	LPRQOGCKVPAJAY-UHFFFAOYSA-N	CCOc1ccc(NC(=S)NC(=O)c2c(Cl)c(C)nn2C)c(c1)[N+](=O)[O-]	BroadT	BRD-K74891695	BRD-K74891695-001-05-7	Specs	AK-968/41026413			CCOc1ccc(NC(=S)NC(=O)c2c(Cl)c(C)nn2C)c(c1)[N+]([O-])=O	InChI=1S/C15H16ClN5O4S/c1-4-25-9-5-6-10(11(7-9)21(23)24)17-15(26)18-14(22)13-12(16)8(2)19-20(13)3/h5-7H,4H2,1-3H3,(H2,17,18,22,26)	LPRQOGCKVPAJAY-UHFFFAOYSA-N	397.061152442							107537
MLS001096126	LSM-18894	SID49736151, BRD-K27724100	24793730	InChI=1S/C19H21N3O6S/c1-2-27-16-6-4-3-5-13(16)12-20-18(23)9-10-21-29(25,26)14-7-8-15-17(11-14)28-19(24)22-15/h3-8,11,21H,2,9-10,12H2,1H3,(H,20,23)(H,22,24)	RNYQKAKPXGJWAW-UHFFFAOYSA-N	CCOc1ccccc1CNC(=O)CCNS(=O)(=O)c2ccc3nc(O)oc3c2	BroadT	BRD-K27724100	BRD-K27724100-001-05-7	ChemDiv Inc.	G305-2277			CCOc1ccccc1CNC(=O)CCNS(=O)(=O)c1ccc2nc(O)oc2c1	InChI=1S/C19H21N3O6S/c1-2-27-16-6-4-3-5-13(16)12-20-18(23)9-10-21-29(25,26)14-7-8-15-17(11-14)28-19(24)22-15/h3-8,11,21H,2,9-10,12H2,1H3,(H,20,23)(H,22,24)	RNYQKAKPXGJWAW-UHFFFAOYSA-N	419.115106112							107538
T5788616	LSM-18895	SID7971764, BRD-A51856603	5310546	InChI=1S/C21H25ClFN5O2/c1-13-6-5-9-27(10-13)12-17-24-19-18(20(29)26(3)21(30)25(19)2)28(17)11-14-15(22)7-4-8-16(14)23/h4,7-8,13H,5-6,9-12H2,1-3H3	YGWLDMTVPHQFIX-UHFFFAOYSA-N	CC1CCCN(Cc2nc3N(C)C(=O)N(C)C(=O)c3n2Cc4c(F)cccc4Cl)C1	BroadT	BRD-A51856603	BRD-A51856603-001-04-3	Life Chemicals Inc.	F0634-0220			CC1CCCN(Cc2nc3n(C)c(=O)n(C)c(=O)c3n2Cc2c(F)cccc2Cl)C1	InChI=1S/C21H25ClFN5O2/c1-13-6-5-9-27(10-13)12-17-24-19-18(20(29)26(3)21(30)25(19)2)28(17)11-14-15(22)7-4-8-16(14)23/h4,7-8,13H,5-6,9-12H2,1-3H3	YGWLDMTVPHQFIX-UHFFFAOYSA-N	433.168081							107539
MLS000543685	LSM-18896	SID17387098, BRD-K98819976	1001529	InChI=1S/C22H20N4O5/c1-3-25-17-7-5-4-6-16(17)23-22(25)24-21(27)20-11-9-15(31-20)13-30-19-10-8-14(2)12-18(19)26(28)29/h4-12H,3,13H2,1-2H3,(H,23,24,27)	USJICSSBSOLIHY-UHFFFAOYSA-N	CCn1c(NC(=O)c2oc(COc3ccc(C)cc3[N+](=O)[O-])cc2)nc4ccccc14	BroadT	BRD-K98819976	BRD-K98819976-001-05-0	Specs	AK-968/41926890			CCn1c(NC(=O)c2ccc(COc3ccc(C)cc3[N+]([O-])=O)o2)nc2ccccc12	InChI=1S/C22H20N4O5/c1-3-25-17-7-5-4-6-16(17)23-22(25)24-21(27)20-11-9-15(31-20)13-30-19-10-8-14(2)12-18(19)26(28)29/h4-12H,3,13H2,1-2H3,(H,23,24,27)	USJICSSBSOLIHY-UHFFFAOYSA-N	420.14336978							107540
4-(Azepan-1-yl)-6-hydrazinyl-n-(4-nitrophenyl)-1,3,5-triazin-2-amine	LSM-18897	SID47201298, BRD-K27822058	3317300	InChI=1S/C15H20N8O2/c16-21-14-18-13(17-11-5-7-12(8-6-11)23(24)25)19-15(20-14)22-9-3-1-2-4-10-22/h5-8H,1-4,9-10,16H2,(H2,17,18,19,20,21)	MNWXQCNWVLHIEE-UHFFFAOYSA-N	NNc1nc(Nc2ccc(cc2)[N+](=O)[O-])nc(n1)N3CCCCCC3	BroadT	BRD-K27822058	BRD-K27822058-001-06-9	Asinex Ltd.	BAS 00194241			NNc1nc(Nc2ccc(cc2)[N+]([O-])=O)nc(n1)N1CCCCCC1	InChI=1S/C15H20N8O2/c16-21-14-18-13(17-11-5-7-12(8-6-11)23(24)25)19-15(20-14)22-9-3-1-2-4-10-22/h5-8H,1-4,9-10,16H2,(H2,17,18,19,20,21)	MNWXQCNWVLHIEE-UHFFFAOYSA-N	344.17092196							107541
MLS000531444	LSM-18898	SID14736294, BRD-K50359549	935391	InChI=1S/C16H18FNO3S/c1-4-21-15-9-10-16(12(3)11(15)2)22(19,20)18-14-7-5-13(17)6-8-14/h5-10,18H,4H2,1-3H3	GJUCAVHSIPEIGQ-UHFFFAOYSA-N	CCOc1ccc(c(C)c1C)S(=O)(=O)Nc2ccc(F)cc2	BroadT	BRD-K50359549	BRD-K50359549-001-05-1	ChemBridge Corporation	7938819			CCOc1ccc(c(C)c1C)S(=O)(=O)Nc1ccc(F)cc1	InChI=1S/C16H18FNO3S/c1-4-21-15-9-10-16(12(3)11(15)2)22(19,20)18-14-7-5-13(17)6-8-14/h5-10,18H,4H2,1-3H3	GJUCAVHSIPEIGQ-UHFFFAOYSA-N	323.099142336							107542
CID 74481274	LSM-18899	BRD-A40995984	74481274	InChI=1S/C19H16N2O4/c1-11(22)20-16-17(21-14-9-5-6-10-15(14)25-2)19(24)13-8-4-3-7-12(13)18(16)23/h3-10,16H,1-2H3,(H,20,22)	QGGIGXQJYSQSHX-UHFFFAOYSA-N	COc1ccccc1N=C2C(NC(=O)C)C(=O)c3ccccc3C2=O	BroadT	BRD-A40995984	BRD-A40995984-001-04-2	Enamine Ltd.	T0502-6427			COc1ccccc1N=C1C(NC(C)=O)C(=O)c2ccccc2C1=O	InChI=1S/C19H16N2O4/c1-11(22)20-16-17(21-14-9-5-6-10-15(14)25-2)19(24)13-8-4-3-7-12(13)18(16)23/h3-10,16H,1-2H3,(H,20,22)	QGGIGXQJYSQSHX-UHFFFAOYSA-N	336.111007012							107543
ST50675202	LSM-18900	SID4248356, BRD-K07440008	3242444	InChI=1S/C20H18N2O3/c1-24-16-10-8-15(9-11-16)19-13-17(21-25-19)20(23)22-12-4-6-14-5-2-3-7-18(14)22/h2-3,5,7-11,13H,4,6,12H2,1H3	NXZPGFQRSJZSQQ-UHFFFAOYSA-N	COc1ccc(cc1)c2onc(c2)C(=O)N3CCCc4ccccc34	BroadT	BRD-K07440008	BRD-K07440008-001-05-7	ChemDiv Inc.	C226-0706			COc1ccc(cc1)-c1cc(no1)C(=O)N1CCCc2ccccc12	InChI=1S/C20H18N2O3/c1-24-16-10-8-15(9-11-16)19-13-17(21-25-19)20(23)22-12-4-6-14-5-2-3-7-18(14)22/h2-3,5,7-11,13H,4,6,12H2,1H3	NXZPGFQRSJZSQQ-UHFFFAOYSA-N	334.131742456							107544
AC1MPDIR	LSM-18901	BRD-K21092746	3433548	InChI=1S/C16H25N3S/c1-11(2)17-15(20)19-18-12(3)13-7-9-14(10-8-13)16(4,5)6/h7-11H,1-6H3,(H2,17,19,20)	PKDRJTVWRAJXJM-UHFFFAOYSA-N	CC(C)N=C(S)NN=C(C)c1ccc(cc1)C(C)(C)C	BroadT	BRD-K21092746	BRD-K21092746-001-06-3	Enamine Ltd.	T0518-9297			CC(C)N=C(S)NN=C(C)c1ccc(cc1)C(C)(C)C	InChI=1S/C16H25N3S/c1-11(2)17-15(20)19-18-12(3)13-7-9-14(10-8-13)16(4,5)6/h7-11H,1-6H3,(H2,17,19,20)	PKDRJTVWRAJXJM-UHFFFAOYSA-N	291.17691852							107545
AC1LCUBX	LSM-18902	SID853503, BRD-K36828521	656159	InChI=1S/C21H25N5O3S/c1-15-4-9-20-19(14-15)22-23-26(20)17-10-12-25(13-11-17)30(28,29)18-7-5-16(6-8-18)21(27)24(2)3/h4-9,14,17H,10-13H2,1-3H3	CJJHMSWSJNGSFN-UHFFFAOYSA-N	CN(C)C(=O)c1ccc(cc1)S(=O)(=O)N2CCC(CC2)n3nnc4cc(C)ccc34	BroadT	BRD-K36828521	BRD-K36828521-001-05-6	Asinex Ltd.	ASN 06365826			CN(C)C(=O)c1ccc(cc1)S(=O)(=O)N1CCC(CC1)n1nnc2cc(C)ccc12	InChI=1S/C21H25N5O3S/c1-15-4-9-20-19(14-15)22-23-26(20)17-10-12-25(13-11-17)30(28,29)18-7-5-16(6-8-18)21(27)24(2)3/h4-9,14,17H,10-13H2,1-3H3	CJJHMSWSJNGSFN-UHFFFAOYSA-N	427.1678104							107546
AC1LWB1O	LSM-18903	BRD-K06262517	1672419	InChI=1S/C15H13Cl2N3OS/c1-2-7-18-15(22)20-19-9-11-4-6-14(21-11)12-8-10(16)3-5-13(12)17/h2-6,8-9H,1,7H2,(H2,18,20,22)	LSMIXSYAXJNILX-UHFFFAOYSA-N	Clc1ccc(Cl)c(c1)c2oc(C=NNC(=S)NCC=C)cc2	BroadT	BRD-K06262517	BRD-K06262517-001-05-0	Asinex Ltd.	BAS 00392448			Clc1ccc(Cl)c(c1)-c1ccc(C=NNC(=S)NCC=C)o1	InChI=1S/C15H13Cl2N3OS/c1-2-7-18-15(22)20-19-9-11-4-6-14(21-11)12-8-10(16)3-5-13(12)17/h2-6,8-9H,1,7H2,(H2,18,20,22)	LSMIXSYAXJNILX-UHFFFAOYSA-N	353.015638176							107547
SMR000004408	LSM-18904	SID842282, SID26668607, BRD-K21345422	644541	InChI=1S/C26H24N6O4/c1-17-4-6-22-19(9-17)11-20(26(33)27-22)13-31(12-18-5-7-23-24(10-18)36-16-35-23)15-25-28-29-30-32(25)14-21-3-2-8-34-21/h2-11H,12-16H2,1H3,(H,27,33)	KYIWUANOGAVPOM-UHFFFAOYSA-N	Cc1ccc2nc(O)c(CN(Cc3ccc4OCOc4c3)Cc5nnnn5Cc6occc6)cc2c1	BroadT	BRD-K21345422	BRD-K21345422-001-05-8	Asinex Ltd.	ASN 05303729			Cc1ccc2nc(O)c(CN(Cc3nnnn3Cc3ccco3)Cc3ccc4OCOc4c3)cc2c1	InChI=1S/C26H24N6O4/c1-17-4-6-22-19(9-17)11-20(26(33)27-22)13-31(12-18-5-7-23-24(10-18)36-16-35-23)15-25-28-29-30-32(25)14-21-3-2-8-34-21/h2-11H,12-16H2,1H3,(H,27,33)	KYIWUANOGAVPOM-UHFFFAOYSA-N	484.185903308							107548
AC1ME39C	LSM-18905	SID50085564, BRD-K95542937	2820885	InChI=1S/C13H9F3N4O2/c14-13(15,16)9-3-1-2-8(6-9)12(21)22-20-11(17)10-7-18-4-5-19-10/h1-7H,(H2,17,20)	ZPJIDLNAMTUWIW-UHFFFAOYSA-N	FC(F)(F)c1cccc(c1)C(=O)ONC(=N)c2cnccn2	BroadT	BRD-K95542937	BRD-K95542937-001-05-9	Maybridge	KM 05047			FC(F)(F)c1cccc(c1)C(=O)ONC(=N)c1cnccn1	InChI=1S/C13H9F3N4O2/c14-13(15,16)9-3-1-2-8(6-9)12(21)22-20-11(17)10-7-18-4-5-19-10/h1-7H,(H2,17,20)	ZPJIDLNAMTUWIW-UHFFFAOYSA-N	310.067760168							107549
MLS000332727	LSM-18906	SID124360059, SID26664003, BRD-K33239740	3732306	InChI=1S/C17H22FN7O3/c18-12-3-1-4-13(11-12)21-16-14(25(26)27)15(19)22-17(23-16)20-5-2-6-24-7-9-28-10-8-24/h1,3-4,11H,2,5-10H2,(H4,19,20,21,22,23)	BOFBGGWXWFWVCE-UHFFFAOYSA-N	Nc1nc(NCCCN2CCOCC2)nc(Nc3cccc(F)c3)c1[N+](=O)[O-]	BroadT	BRD-K33239740	BRD-K33239740-001-06-2	InterBioScreen Ltd.	STOCK4S-19834			Nc1nc(NCCCN2CCOCC2)nc(Nc2cccc(F)c2)c1[N+]([O-])=O	InChI=1S/C17H22FN7O3/c18-12-3-1-4-13(11-12)21-16-14(25(26)27)15(19)22-17(23-16)20-5-2-6-24-7-9-28-10-8-24/h1,3-4,11H,2,5-10H2,(H4,19,20,21,22,23)	BOFBGGWXWFWVCE-UHFFFAOYSA-N	391.176815834							107550
ZINC04206037	LSM-18907	BRD-K54818574	6806481	InChI=1S/C17H14N6O2/c1-25-15-8-11(6-7-14(15)24)9-18-20-16-12-4-2-3-5-13(12)17-21-19-10-23(17)22-16/h2-10,24H,1H3,(H,20,22)	JMVHIGRVULAARF-UHFFFAOYSA-N	COc1cc(C=NNc2nn3cnnc3c4ccccc24)ccc1O	BroadT	BRD-K54818574	BRD-K54818574-001-05-0	ChemDiv Inc.	6404-0014			COc1cc(C=NNc2nn3cnnc3c3ccccc23)ccc1O	InChI=1S/C17H14N6O2/c1-25-15-8-11(6-7-14(15)24)9-18-20-16-12-4-2-3-5-13(12)17-21-19-10-23(17)22-16/h2-10,24H,1H3,(H,20,22)	JMVHIGRVULAARF-UHFFFAOYSA-N	334.117823748							
AC1LYU0T	LSM-43810	BRD-K85488776	1933793	InChI=1S/C18H13ClN4O6/c19-13(9-11-1-7-15(8-2-11)23(28)29)10-20-22-17(25)16(24)21-14-5-3-12(4-6-14)18(26)27/h1-10H,(H,21,24)(H,22,25)(H,26,27)/b13-9-,20-10?	VAZSWYMUYICMRR-CIRFYHHZSA-N	OC(=O)c1ccc(NC(=O)C(=O)NN=C\C(=C\c2ccc(cc2)[N+](=O)[O-])\Cl)cc1	BroadT	BRD-K85488776	BRD-K85488776-001-05-1	InterBioScreen Ltd.	STOCK1S-17855			OC(=O)c1ccc(NC(=O)C(=O)NN=C\C(Cl)=C\c2ccc(cc2)[N+]([O-])=O)cc1	InChI=1S/C18H13ClN4O6/c19-13(9-11-1-7-15(8-2-11)23(28)29)10-20-22-17(25)16(24)21-14-5-3-12(4-6-14)18(26)27/h1-10H,(H,21,24)(H,22,25)(H,26,27)/b13-9-,20-10?	VAZSWYMUYICMRR-CIRFYHHZSA-N	416.052361886							
2-Methyl-3-(thiophene-2-carbonyl)-indolizine-1-carbaldehyde	LSM-18909	SID24836778, BRD-K61921323	2121152	InChI=1S/C15H11NO2S/c1-10-11(9-17)12-5-2-3-7-16(12)14(10)15(18)13-6-4-8-19-13/h2-9H,1H3	NKVXBYYGVBAWID-UHFFFAOYSA-N	Cc1c(C=O)c2ccccn2c1C(=O)c3cccs3	BroadT	BRD-K61921323	BRD-K61921323-001-05-7	Enamine Ltd.	T5248668			Cc1c(C=O)c2ccccn2c1C(=O)c1cccs1	InChI=1S/C15H11NO2S/c1-10-11(9-17)12-5-2-3-7-16(12)14(10)15(18)13-6-4-8-19-13/h2-9H,1H3	NKVXBYYGVBAWID-UHFFFAOYSA-N	269.051049292							107553
MLS000729150	LSM-18910	SID24781750, BRD-K75275735	1506394	InChI=1S/C11H12N4O4S2/c1-3-21(18,19)8-4-5-10(9(6-8)15(16)17)20-11-13-12-7-14(11)2/h4-7H,3H2,1-2H3	HIKQHKVDDXOZHS-UHFFFAOYSA-N	CCS(=O)(=O)c1ccc(Sc2nncn2C)c(c1)[N+](=O)[O-]	BroadT	BRD-K75275735	BRD-K75275735-001-05-4	ChemDiv Inc.	8016-2638			CCS(=O)(=O)c1ccc(Sc2nncn2C)c(c1)[N+]([O-])=O	InChI=1S/C11H12N4O4S2/c1-3-21(18,19)8-4-5-10(9(6-8)15(16)17)20-11-13-12-7-14(11)2/h4-7H,3H2,1-2H3	HIKQHKVDDXOZHS-UHFFFAOYSA-N	328.029996284							107554
AC1MH46G	LSM-18911	SID4256596, BRD-A64878329	2945965	InChI=1S/C15H14N4S/c1-11(12-5-3-2-4-6-12)19-14(17-18-15(19)20)13-7-9-16-10-8-13/h2-11H,1H3,(H,18,20)	PHFZUAFDRUJDIE-UHFFFAOYSA-N	CC(c1ccccc1)n2c(S)nnc2c3ccncc3	BroadT	BRD-A64878329	BRD-A64878329-001-05-2	ChemBridge Corporation	7657520			CC(c1ccccc1)n1c(S)nnc1-c1ccncc1	InChI=1S/C15H14N4S/c1-11(12-5-3-2-4-6-12)19-14(17-18-15(19)20)13-7-9-16-10-8-13/h2-11H,1H3,(H,18,20)	PHFZUAFDRUJDIE-UHFFFAOYSA-N	282.093917178							107555
MLS000532537	LSM-18912	SID14734687, BRD-K08572519	2844976	InChI=1S/C8H9NOS2/c10-7-6(12-8(11)9-7)5-3-1-2-4-5/h1-4H2,(H,9,10,11)	GVQMNRSQVSQAKK-UHFFFAOYSA-N	O=C1NC(=S)SC1=C2CCCC2	BroadT	BRD-K08572519	BRD-K08572519-001-05-8	ChemBridge Corporation	5404712			O=C1NC(=S)SC1=C1CCCC1	InChI=1S/C8H9NOS2/c10-7-6(12-8(11)9-7)5-3-1-2-4-5/h1-4H2,(H,9,10,11)	GVQMNRSQVSQAKK-UHFFFAOYSA-N	199.012555298							107556
STK498565	LSM-18913	SID24269056, SID24784962, BRD-K87023148	3276862	InChI=1S/C18H22N4/c1-4-22-13-20-17-11-15(7-10-18(17)22)19-12-14-5-8-16(9-6-14)21(2)3/h5-11,13,19H,4,12H2,1-3H3	GOXXBXMODVWPKM-UHFFFAOYSA-N	CCn1cnc2cc(NCc3ccc(cc3)N(C)C)ccc12	BroadT	BRD-K87023148	BRD-K87023148-001-06-3	ChemDiv Inc.	C215-0035			CCn1cnc2cc(NCc3ccc(cc3)N(C)C)ccc12	InChI=1S/C18H22N4/c1-4-22-13-20-17-11-15(7-10-18(17)22)19-12-14-5-8-16(9-6-14)21(2)3/h5-11,13,19H,4,12H2,1-3H3	GOXXBXMODVWPKM-UHFFFAOYSA-N	294.184446744							107557
ST50932553	LSM-18914	SID4261844, BRD-K07800366	1246859	InChI=1S/C16H18ClN3O/c17-14-7-5-12(6-8-14)10-20-11-15(9-18-20)19-16(21)13-3-1-2-4-13/h5-9,11,13H,1-4,10H2,(H,19,21)	DYVWKUVAQABNDB-UHFFFAOYSA-N	Clc1ccc(Cn2cc(NC(=O)C3CCCC3)cn2)cc1	BroadT	BRD-K07800366	BRD-K07800366-001-05-8	ChemBridge Corporation	7947924			Clc1ccc(Cn2cc(NC(=O)C3CCCC3)cn2)cc1	InChI=1S/C16H18ClN3O/c17-14-7-5-12(6-8-14)10-20-11-15(9-18-20)19-16(21)13-3-1-2-4-13/h5-9,11,13H,1-4,10H2,(H,19,21)	DYVWKUVAQABNDB-UHFFFAOYSA-N	303.113839936							107558
2K-537S	LSM-18915	SID24824445, BRD-K48308907	1471080	InChI=1S/C12H8ClN3O3S/c13-8-1-3-9(4-2-8)20(18,19)10-5-7(6-14)12(17)16-11(10)15/h1-5H,(H3,15,16,17)	RLBOYZWCNDHMNA-UHFFFAOYSA-N	Nc1nc(O)c(cc1S(=O)(=O)c2ccc(Cl)cc2)C#N	BroadT	BRD-K48308907	BRD-K48308907-001-05-9	Key Organics Ltd.	2K-537S			Nc1nc(O)c(cc1S(=O)(=O)c1ccc(Cl)cc1)C#N	InChI=1S/C12H8ClN3O3S/c13-8-1-3-9(4-2-8)20(18,19)10-5-7(6-14)12(17)16-11(10)15/h1-5H,(H3,15,16,17)	RLBOYZWCNDHMNA-UHFFFAOYSA-N	308.997489546							107559
AO-476/41839681	LSM-18916	SID22402444, BRD-K91939093	848930	InChI=1S/C13H13N3O2S2/c1-18-10-6-4-9(5-7-10)14-13(19)16-15-12(17)11-3-2-8-20-11/h2-8H,1H3,(H,15,17)(H2,14,16,19)	CDMJIFSWLUXAQT-UHFFFAOYSA-N	COc1ccc(NC(=NNC(=O)c2cccs2)S)cc1	BroadT	BRD-K91939093	BRD-K91939093-001-05-1	Specs	AO-476/41839681			COc1ccc(NC(S)=NNC(=O)c2cccs2)cc1	InChI=1S/C13H13N3O2S2/c1-18-10-6-4-9(5-7-10)14-13(19)16-15-12(17)11-3-2-8-20-11/h2-8H,1H3,(H,15,17)(H2,14,16,19)	CDMJIFSWLUXAQT-UHFFFAOYSA-N	307.044918066							107560
SMR000000708	LSM-18917	SID852749, BRD-A48019378	655389	InChI=1S/C20H21N5O4S/c1-2-29-20(28)12-4-3-9-25(10-12)14-7-5-13(6-8-14)23-19(27)17-15-16(24-30-17)18(26)22-11-21-15/h5-8,11-12H,2-4,9-10H2,1H3,(H,23,27)(H,21,22,26)	YCRRQQUNXHMDLQ-UHFFFAOYSA-N	CCOC(=O)C1CCCN(C1)c2ccc(NC(=O)c3snc4c(O)ncnc34)cc2	BroadT	BRD-A48019378	BRD-A48019378-001-05-4	Asinex Ltd.	ASN 09646959			CCOC(=O)C1CCCN(C1)c1ccc(NC(=O)c2snc3c(O)ncnc23)cc1	InChI=1S/C20H21N5O4S/c1-2-29-20(28)12-4-3-9-25(10-12)14-7-5-13(6-8-14)23-19(27)17-15-16(24-30-17)18(26)22-11-21-15/h5-8,11-12H,2-4,9-10H2,1H3,(H,23,27)(H,21,22,26)	YCRRQQUNXHMDLQ-UHFFFAOYSA-N	427.131424892							107561
MLS001030012	LSM-18918	SID26662891, BRD-A61314904	3367286	InChI=1S/C14H9N3O6/c1-6-4-9-12(14(18)21-6)11(7(5-15)13(16)23-9)8-2-3-10(22-8)17(19)20/h2-4,11H,16H2,1H3	FPLQLGSWZHRSPC-UHFFFAOYSA-N	CC1=CC2=C(C(C(=C(N)O2)C#N)c3oc(cc3)[N+](=O)[O-])C(=O)O1	BroadT	BRD-A61314904	BRD-A61314904-001-05-4	InterBioScreen Ltd.	STOCK1S-34007			Cc1cc2OC(N)=C(C#N)C(c3ccc(o3)[N+]([O-])=O)c2c(=O)o1	InChI=1S/C14H9N3O6/c1-6-4-9-12(14(18)21-6)11(7(5-15)13(16)23-9)8-2-3-10(22-8)17(19)20/h2-4,11H,16H2,1H3	FPLQLGSWZHRSPC-UHFFFAOYSA-N	315.049135038							107562
MLS000889011	LSM-18919	SID49714040, BRD-K17543671	24789417	InChI=1S/C21H18Cl3N5O2S/c1-2-7-28-19-10-15(24)14(23)9-16(19)26-20(28)5-6-25-21-27-17(11-32-21)12-3-4-13(22)18(8-12)29(30)31/h3-4,8-11H,2,5-7H2,1H3,(H,25,27)	GWPLJXRAKALFKS-UHFFFAOYSA-N	CCCn1c(CCNc2nc(cs2)c3ccc(Cl)c(c3)[N+](=O)[O-])nc4cc(Cl)c(Cl)cc14	BroadT	BRD-K17543671	BRD-K17543671-001-05-2	University of Notre Dame	[4-(4-Chloro-3-nitro-phenyl)-thiazol-2-yl]-[2-(5,6-dichloro-1-propyl-1H-benzoimidazol-2-yl)-ethyl]-amine MSPBBC			CCCn1c(CCNc2nc(cs2)-c2ccc(Cl)c(c2)[N+]([O-])=O)nc2cc(Cl)c(Cl)cc12	InChI=1S/C21H18Cl3N5O2S/c1-2-7-28-19-10-15(24)14(23)9-16(19)26-20(28)5-6-25-21-27-17(11-32-21)12-3-4-13(22)18(8-12)29(30)31/h3-4,8-11H,2,5-7H2,1H3,(H,25,27)	GWPLJXRAKALFKS-UHFFFAOYSA-N	509.024678686							107563
AK-968/15363550	LSM-18920	SID14718895, BRD-K78498445	1002659	InChI=1S/C18H12Cl2FNO3/c19-11-5-7-16(13(20)9-11)24-10-12-6-8-17(25-12)18(23)22-15-4-2-1-3-14(15)21/h1-9H,10H2,(H,22,23)	MYYIHYITRHWMGQ-UHFFFAOYSA-N	Fc1ccccc1NC(=O)c2oc(COc3ccc(Cl)cc3Cl)cc2	BroadT	BRD-K78498445	BRD-K78498445-001-05-0	Specs	AK-968/15363550			Fc1ccccc1NC(=O)c1ccc(COc2ccc(Cl)cc2Cl)o1	InChI=1S/C18H12Cl2FNO3/c19-11-5-7-16(13(20)9-11)24-10-12-6-8-17(25-12)18(23)22-15-4-2-1-3-14(15)21/h1-9H,10H2,(H,22,23)	MYYIHYITRHWMGQ-UHFFFAOYSA-N	379.017826874							107564
ZINC00450802	LSM-18921	SID17415938, BRD-K56493285	880426	InChI=1S/C15H12N4OS2/c1-9-5-7-10(8-6-9)14(20)17-15(21)16-11-3-2-4-12-13(11)19-22-18-12/h2-8H,1H3,(H2,16,17,20,21)	QFNOALBMEJDQKY-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)NC(=S)Nc2cccc3nsnc23	BroadT	BRD-K56493285	BRD-K56493285-001-05-0	ChemBridge Corporation	6313025			Cc1ccc(cc1)C(=O)NC(=S)Nc1cccc2nsnc12	InChI=1S/C15H12N4OS2/c1-9-5-7-10(8-6-9)14(20)17-15(21)16-11-3-2-4-12-13(11)19-22-18-12/h2-8H,1H3,(H2,16,17,20,21)	QFNOALBMEJDQKY-UHFFFAOYSA-N	328.045252424							107565
6-Amino-4-[4-(tert-butyl)phenyl]-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile	LSM-18922	SID26728787, BRD-K77693043	2809820	InChI=1S/C24H23N5/c1-15-20-21(16-10-12-17(13-11-16)24(2,3)4)19(14-25)22(26)27-23(20)29(28-15)18-8-6-5-7-9-18/h5-13H,1-4H3,(H2,26,27)	REHVFFROLQVHGZ-UHFFFAOYSA-N	Cc1nn(c2ccccc2)c3nc(N)c(C#N)c(c4ccc(cc4)C(C)(C)C)c13	BroadT	BRD-K77693043	BRD-K77693043-001-06-1	Maybridge	HTS 00839			Cc1nn(-c2ccccc2)c2nc(N)c(C#N)c(-c3ccc(cc3)C(C)(C)C)c12	InChI=1S/C24H23N5/c1-15-20-21(16-10-12-17(13-11-16)24(2,3)4)19(14-25)22(26)27-23(20)29(28-15)18-8-6-5-7-9-18/h5-13H,1-4H3,(H2,26,27)	REHVFFROLQVHGZ-UHFFFAOYSA-N	381.195345786							107566
MLS001205774	LSM-18923	SID49643347, BRD-K19505887	24746968	InChI=1S/C18H14ClFN6/c1-11-21-17(23-15-9-5-4-8-14(15)20)16-18(22-11)26(25-24-16)10-12-6-2-3-7-13(12)19/h2-9H,10H2,1H3,(H,21,22,23)	SRSWDMHSNSVIHZ-UHFFFAOYSA-N	Cc1nc(Nc2ccccc2F)c3nnn(Cc4ccccc4Cl)c3n1	BroadT	BRD-K19505887	BRD-K19505887-001-05-9	Asinex Ltd.	AST 7369733			Cc1nc(Nc2ccccc2F)c2nnn(Cc3ccccc3Cl)c2n1	InChI=1S/C18H14ClFN6/c1-11-21-17(23-15-9-5-4-8-14(15)20)16-18(22-11)26(25-24-16)10-12-6-2-3-7-13(12)19/h2-9H,10H2,1H3,(H,21,22,23)	SRSWDMHSNSVIHZ-UHFFFAOYSA-N	368.095250418							107567
MLS000075625	LSM-18924	SID50086776, SID843726, BRD-A59692727	646028	InChI=1S/C25H35N7O2/c33-24(27-25-11-16-6-17(12-25)8-18(7-16)13-25)26-19-9-20-3-4-21(10-19)31(20)15-23-28-29-30-32(23)14-22-2-1-5-34-22/h1-2,5,16-21H,3-4,6-15H2,(H2,26,27,33)	BDXFAAMOJLRGLA-UHFFFAOYSA-N	O=C(NC1CC2CCC(C1)N2Cc3nnnn3Cc4occc4)NC56CC7CC(CC(C7)C5)C6	BroadT	BRD-A59692727	BRD-A59692727-001-05-2	Asinex Ltd.	ASN 06448725			O=C(NC1CC2CCC(C1)N2Cc1nnnn1Cc1ccco1)NC12CC3CC(CC(C3)C1)C2	InChI=1S/C25H35N7O2/c33-24(27-25-11-16-6-17(12-25)8-18(7-16)13-25)26-19-9-20-3-4-21(10-19)31(20)15-23-28-29-30-32(23)14-22-2-1-5-34-22/h1-2,5,16-21H,3-4,6-15H2,(H2,26,27,33)	BDXFAAMOJLRGLA-UHFFFAOYSA-N	465.28522343							107568
N-(4-Fluorophenyl)-2,1,3-benzothiadiazole-5-carboxamide	LSM-18925	SID24809096, BRD-K24327171	684863	InChI=1S/C13H8FN3OS/c14-9-2-4-10(5-3-9)15-13(18)8-1-6-11-12(7-8)17-19-16-11/h1-7H,(H,15,18)	OHLIGSGFQSXILN-UHFFFAOYSA-N	Fc1ccc(NC(=O)c2ccc3nsnc3c2)cc1	BroadT	BRD-K24327171	BRD-K24327171-001-05-6	Asinex Ltd.	BAS 01228880			Fc1ccc(NC(=O)c2ccc3nsnc3c2)cc1	InChI=1S/C13H8FN3OS/c14-9-2-4-10(5-3-9)15-13(18)8-1-6-11-12(7-8)17-19-16-11/h1-7H,(H,15,18)	OHLIGSGFQSXILN-UHFFFAOYSA-N	273.037210796							107569
BAS 00363986	LSM-18926	SID49641382, BRD-K13162652	54679562	InChI=1S/C21H21ClN2O3/c1-2-3-12-24-17-7-5-4-6-16(17)19(25)18(21(24)27)20(26)23-13-14-8-10-15(22)11-9-14/h4-11,25H,2-3,12-13H2,1H3,(H,23,26)	GGRUQJSKMAWYDL-UHFFFAOYSA-N	CCCCN1C(=O)C(=C(O)c2ccccc12)C(=O)NCc3ccc(Cl)cc3	BroadT	BRD-K13162652	BRD-K13162652-001-06-6	Asinex Ltd.	BAS 00363986			CCCCn1c2ccccc2c(O)c(C(=O)NCc2ccc(Cl)cc2)c1=O	InChI=1S/C21H21ClN2O3/c1-2-3-12-24-17-7-5-4-6-16(17)19(25)18(21(24)27)20(26)23-13-14-8-10-15(22)11-9-14/h4-11,25H,2-3,12-13H2,1H3,(H,23,26)	GGRUQJSKMAWYDL-UHFFFAOYSA-N	384.124070262							107570
T0515-1872	LSM-18927	SID22408932, BRD-K52151987	3931213	InChI=1S/C25H17N3O5/c29-21(13-33-22(30)12-28-14-26-18-9-3-4-11-20(18)28)27-19-10-5-8-17-23(19)25(32)16-7-2-1-6-15(16)24(17)31/h1-11,14H,12-13H2,(H,27,29)	FESKMXJZZBQTPN-UHFFFAOYSA-N	O=C(COC(=O)Cn1cnc2ccccc12)Nc3cccc4C(=O)c5ccccc5C(=O)c34	BroadT	BRD-K52151987	BRD-K52151987-001-05-9	Enamine Ltd.	T0515-1872			O=C(COC(=O)Cn1cnc2ccccc12)Nc1cccc2C(=O)c3ccccc3C(=O)c12	InChI=1S/C25H17N3O5/c29-21(13-33-22(30)12-28-14-26-18-9-3-4-11-20(18)28)27-19-10-5-8-17-23(19)25(32)16-7-2-1-6-15(16)24(17)31/h1-11,14H,12-13H2,(H,27,29)	FESKMXJZZBQTPN-UHFFFAOYSA-N	439.116820674							107571
BDBM63329	LSM-18928	BRD-A41593167	91897538	InChI=1S/C25H24N2O4S/c1-2-3-12-31-19-9-4-8-18(14-19)22-21(23(28)20-10-6-13-32-20)24(29)25(30)27(22)16-17-7-5-11-26-15-17/h4-11,13-15,21-22H,2-3,12,16H2,1H3	AIKSWGQKTPMFJP-UHFFFAOYSA-N	CCCCOc1cccc(c1)C2C(C(=O)c3cccs3)C(=O)C(=O)N2Cc4cccnc4	BroadT	BRD-A41593167	BRD-A41593167-001-06-8	Specs	AF-399/42043711			CCCCOc1cccc(c1)C1C(C(=O)c2cccs2)C(=O)C(=O)N1Cc1cccnc1	InChI=1S/C25H24N2O4S/c1-2-3-12-31-19-9-4-8-18(14-19)22-21(23(28)20-10-6-13-32-20)24(29)25(30)27(22)16-17-7-5-11-26-15-17/h4-11,13-15,21-22H,2-3,12,16H2,1H3	AIKSWGQKTPMFJP-UHFFFAOYSA-N	448.145677958							107572
T5390710	LSM-18929	SID22408989, BRD-K16787711	4798519	InChI=1S/C22H25NO3/c1-16-7-11-19(12-8-16)23-21(24)15-26-20-13-9-18(10-14-20)22(25)17-5-3-2-4-6-17/h2-6,9-10,13-14,16,19H,7-8,11-12,15H2,1H3,(H,23,24)	SQUICWHZPHIFGR-UHFFFAOYSA-N	CC1CCC(CC1)NC(=O)COc2ccc(cc2)C(=O)c3ccccc3	BroadT	BRD-K16787711	BRD-K16787711-001-05-8	Enamine Ltd.	ZT-6246904			CC1CCC(CC1)NC(=O)COc1ccc(cc1)C(=O)c1ccccc1	InChI=1S/C22H25NO3/c1-16-7-11-19(12-8-16)23-21(24)15-26-20-13-9-18(10-14-20)22(25)17-5-3-2-4-6-17/h2-6,9-10,13-14,16,19H,7-8,11-12,15H2,1H3,(H,23,24)	SQUICWHZPHIFGR-UHFFFAOYSA-N	351.18344367							107573
MLS000775232	LSM-18930	SID24836622, BRD-K94199167	3551423	InChI=1S/C19H23ClN2O2S/c1-19(2,21-25(23,24)18-9-7-17(20)8-10-18)14-22-12-11-15-5-3-4-6-16(15)13-22/h3-10,21H,11-14H2,1-2H3	LWWPJRYUNFTHPP-UHFFFAOYSA-N	CC(C)(CN1CCc2ccccc2C1)NS(=O)(=O)c3ccc(Cl)cc3	BroadT	BRD-K94199167	BRD-K94199167-001-06-8	Enamine Ltd.	T0502-7672			CC(C)(CN1CCc2ccccc2C1)NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C19H23ClN2O2S/c1-19(2,21-25(23,24)18-9-7-17(20)8-10-18)14-22-12-11-15-5-3-4-6-16(15)13-22/h3-10,21H,11-14H2,1-2H3	LWWPJRYUNFTHPP-UHFFFAOYSA-N	378.116876396							107574
AC1MXNO2	LSM-18931	BRD-K52117308	3818470	InChI=1S/C21H21FN4O4/c22-16-8-2-3-9-17(16)24-20(28)21(29)25-23-13-15-7-1-4-10-18(15)30-14-19(27)26-11-5-6-12-26/h1-4,7-10,13H,5-6,11-12,14H2,(H,24,28)(H,25,29)	XASZQGNYHHWPOW-UHFFFAOYSA-N	Fc1ccccc1NC(=O)C(=O)NN=Cc2ccccc2OCC(=O)N3CCCC3	BroadT	BRD-K52117308	BRD-K52117308-001-05-2	InterBioScreen Ltd.	STOCK4S-25130			Fc1ccccc1NC(=O)C(=O)NN=Cc1ccccc1OCC(=O)N1CCCC1	InChI=1S/C21H21FN4O4/c22-16-8-2-3-9-17(16)24-20(28)21(29)25-23-13-15-7-1-4-10-18(15)30-14-19(27)26-11-5-6-12-26/h1-4,7-10,13H,5-6,11-12,14H2,(H,24,28)(H,25,29)	XASZQGNYHHWPOW-UHFFFAOYSA-N	412.154683392							107575
AMBCB92229708	LSM-18932	SID49816919, BRD-A64943552	24816621	InChI=1S/C24H26N6O/c1-16-13-20(29-28-16)15-30-12-4-5-18(14-30)24(31)25-19-10-8-17(9-11-19)23-26-21-6-2-3-7-22(21)27-23/h2-3,6-11,13,18H,4-5,12,14-15H2,1H3,(H,25,31)(H,26,27)(H,28,29)	IQFVZEAIOKMHBE-UHFFFAOYSA-N	Cc1cc(CN2CCCC(C2)C(=O)Nc3ccc(cc3)c4nc5ccccc5[nH]4)n[nH]1	BroadT	BRD-A64943552	BRD-A64943552-001-05-2	ChemBridge Corporation	92229708			Cc1cc(CN2CCCC(C2)C(=O)Nc2ccc(cc2)-c2nc3ccccc3[nH]2)n[nH]1	InChI=1S/C24H26N6O/c1-16-13-20(29-28-16)15-30-12-4-5-18(14-30)24(31)25-19-10-8-17(9-11-19)23-26-21-6-2-3-7-22(21)27-23/h2-3,6-11,13,18H,4-5,12,14-15H2,1H3,(H,25,31)(H,26,27)(H,28,29)	IQFVZEAIOKMHBE-UHFFFAOYSA-N	414.216809512							107576
SMR000220101	LSM-18933	SID17511887, BRD-K12851831	4207425	InChI=1S/C15H18N6O3/c1-10-3-2-4-11(9-10)17-15-18-13(16)12(21(22)23)14(19-15)20-5-7-24-8-6-20/h2-4,9H,5-8H2,1H3,(H3,16,17,18,19)	JBLXKYQPJCGXAY-UHFFFAOYSA-N	Cc1cccc(Nc2nc(N)c(c(n2)N3CCOCC3)[N+](=O)[O-])c1	BroadT	BRD-K12851831	BRD-K12851831-001-06-9	InterBioScreen Ltd.	STOCK4S-53356			Cc1cccc(Nc2nc(N)c(c(n2)N2CCOCC2)[N+]([O-])=O)c1	InChI=1S/C15H18N6O3/c1-10-3-2-4-11(9-10)17-15-18-13(16)12(21(22)23)14(19-15)20-5-7-24-8-6-20/h2-4,9H,5-8H2,1H3,(H3,16,17,18,19)	JBLXKYQPJCGXAY-UHFFFAOYSA-N	330.144038496							107577
SMR000020374	LSM-18934	SID4245401, BRD-A10073163	3239875	InChI=1S/C15H15NO2S2/c17-15-16-14-13(20-15)11(9-2-1-5-18-9)10-7-3-4-8(6-7)12(10)19-14/h1-2,5,7-8,10-12H,3-4,6H2,(H,16,17)	PGOHYRVPWXTGJJ-UHFFFAOYSA-N	Oc1nc2SC3C4CCC(C4)C3C(c5occc5)c2s1	BroadT	BRD-A10073163	BRD-A10073163-001-05-4	ChemDiv Inc.	6194-0094			O=c1[nH]c2SC3C4CCC(C4)C3C(c3ccco3)c2s1	InChI=1S/C15H15NO2S2/c17-15-16-14-13(20-15)11(9-2-1-5-18-9)10-7-3-4-8(6-7)12(10)19-14/h1-2,5,7-8,10-12H,3-4,6H2,(H,16,17)	PGOHYRVPWXTGJJ-UHFFFAOYSA-N	305.05442011							107578
T5250397	LSM-18935	SID14745312, BRD-K49654601	2123627	InChI=1S/C16H20N4O2/c1-2-21-13-9-7-12(8-10-13)15-19-20-16(22-15)18-14-6-4-3-5-11-17-14/h7-10H,2-6,11H2,1H3,(H,17,18,20)	INPNMBZFXUQZPZ-UHFFFAOYSA-N	CCOc1ccc(cc1)c2oc(NC3=NCCCCC3)nn2	BroadT	BRD-K49654601	BRD-K49654601-001-05-4	Enamine Ltd.	T5250397			CCOc1ccc(cc1)-c1nnc(NC2=NCCCCC2)o1	InChI=1S/C16H20N4O2/c1-2-21-13-9-7-12(8-10-13)15-19-20-16(22-15)18-14-6-4-3-5-11-17-14/h7-10H,2-6,11H2,1H3,(H,17,18,20)	INPNMBZFXUQZPZ-UHFFFAOYSA-N	300.15862592							107579
BRD-K03595914	LSM-18936	SID864380		InChI=1S/C16H11ClN4O/c17-11-2-1-3-12-13(11)14-15(20-12)16(22)21(9-19-14)8-10-4-6-18-7-5-10/h1-7,9,22H,8H2	DLINJOVHLPVHKV-UHFFFAOYSA-N	Oc1c2nc3cccc(Cl)c3c2ncn1Cc4ccncc4	BroadT	BRD-K03595914	BRD-K03595914-001-06-3	InterBioScreen Ltd.	STOCK5S-14926			Oc1n(cnc2c1nc1cccc(Cl)c21)Cc1ccncc1	InChI=1S/C16H11ClN4O/c17-11-2-1-3-12-13(11)14-15(20-12)16(22)21(9-19-14)8-10-4-6-18-7-5-10/h1-7,9,22H,8H2	DLINJOVHLPVHKV-UHFFFAOYSA-N	310.062138722							
MLS001095624	LSM-18937	SID24406562, SID49730641, BRD-K89954442	16028070	InChI=1S/C23H22N2O4S/c1-28-18-12-16(13-19(14-18)29-2)22(26)24-17-7-8-20-15(11-17)5-3-9-25(20)23(27)21-6-4-10-30-21/h4,6-8,10-14H,3,5,9H2,1-2H3,(H,24,26)	WQAZNGLIPOALII-UHFFFAOYSA-N	COc1cc(OC)cc(c1)C(=O)Nc2ccc3N(CCCc3c2)C(=O)c4cccs4	BroadT	BRD-K89954442	BRD-K89954442-001-05-2	ChemDiv Inc.	G502-0187			COc1cc(OC)cc(c1)C(=O)Nc1ccc2N(CCCc2c1)C(=O)c1cccs1	InChI=1S/C23H22N2O4S/c1-28-18-12-16(13-19(14-18)29-2)22(26)24-17-7-8-20-15(11-17)5-3-9-25(20)23(27)21-6-4-10-30-21/h4,6-8,10-14H,3,5,9H2,1-2H3,(H,24,26)	WQAZNGLIPOALII-UHFFFAOYSA-N	422.130027894							107581
MLS000673203	LSM-18938	SID24782959, BRD-A86592402	4299469	InChI=1S/C19H20F2N8O4S2/c1-27-19(23-25-26-27)35-7-9-6-34-17-13(16(31)29(17)14(9)18(32)33)22-12(30)5-28-11(8-2-3-8)4-10(24-28)15(20)21/h4,8,13,15,17H,2-3,5-7H2,1H3,(H,22,30)(H,32,33)	NGEHZQYUQUZTQF-UHFFFAOYSA-N	Cn1nnnc1SCC2=C(N3C(SC2)C(NC(=O)Cn4nc(cc4C5CC5)C(F)F)C3=O)C(=O)O	BroadT	BRD-A86592402	BRD-A86592402-001-05-3	ChemDiv Inc.	D052-0034			Cn1nnnc1SCC1=C(N2C(SC1)C(NC(=O)Cn1nc(cc1C1CC1)C(F)F)C2=O)C(O)=O	InChI=1S/C19H20F2N8O4S2/c1-27-19(23-25-26-27)35-7-9-6-34-17-13(16(31)29(17)14(9)18(32)33)22-12(30)5-28-11(8-2-3-8)4-10(24-28)15(20)21/h4,8,13,15,17H,2-3,5-7H2,1H3,(H,22,30)(H,32,33)	NGEHZQYUQUZTQF-UHFFFAOYSA-N	526.10169898							107582
SMR000109118	LSM-43811	SID7975384, BRD-K63658493	5310776	InChI=1S/C23H24N4O5/c1-2-32-19-9-7-18(8-10-19)27-22(29)20(21(28)25-23(27)30)15-24-16-3-5-17(6-4-16)26-11-13-31-14-12-26/h3-10,15,24H,2,11-14H2,1H3,(H,25,28,30)/b20-15+	XKVBABVOWWJZKX-HMMYKYKNSA-N	CCOc1ccc(cc1)N2C(=O)NC(=O)\C(=C/Nc3ccc(cc3)N4CCOCC4)\C2=O	BroadT	BRD-K63658493	BRD-K63658493-001-06-5	ChemBridge Corporation	7022815			CCOc1ccc(cc1)N1C(=O)NC(=O)\C(=C/Nc2ccc(cc2)N2CCOCC2)C1=O	InChI=1S/C23H24N4O5/c1-2-32-19-9-7-18(8-10-19)27-22(29)20(21(28)25-23(27)30)15-24-16-3-5-17(6-4-16)26-11-13-31-14-12-26/h3-10,15,24H,2,11-14H2,1H3,(H,25,28,30)/b20-15+	XKVBABVOWWJZKX-HMMYKYKNSA-N	436.174669908							
N1-(2-Chlorophenyl)-2-({5-[5-(trifluoromethyl)-2-pyridyl]-1,3,4-oxadiazol-2-yl}thio)acetamide	LSM-18940	SID26730578, BRD-K13972621	2746573	InChI=1S/C16H10ClF3N4O2S/c17-10-3-1-2-4-11(10)22-13(25)8-27-15-24-23-14(26-15)12-6-5-9(7-21-12)16(18,19)20/h1-7H,8H2,(H,22,25)	QJSVCFQZYKDNMU-UHFFFAOYSA-N	FC(F)(F)c1ccc(nc1)c2oc(SCC(=O)Nc3ccccc3Cl)nn2	BroadT	BRD-K13972621	BRD-K13972621-001-05-8	Maybridge	SPB 06826			FC(F)(F)c1ccc(nc1)-c1nnc(SCC(=O)Nc2ccccc2Cl)o1	InChI=1S/C16H10ClF3N4O2S/c17-10-3-1-2-4-11(10)22-13(25)8-27-15-24-23-14(26-15)12-6-5-9(7-21-12)16(18,19)20/h1-7H,8H2,(H,22,25)	QJSVCFQZYKDNMU-UHFFFAOYSA-N	414.0165086							107584
3-(4-Methylphenyl)-2,1-benzisoxazole-5-carbaldehyde	LSM-18941	SID14730022, BRD-K30777156	2764245	InChI=1S/C15H11NO2/c1-10-2-5-12(6-3-10)15-13-8-11(9-17)4-7-14(13)16-18-15/h2-9H,1H3	AKCMMYWXXNCXES-UHFFFAOYSA-N	Cc1ccc(cc1)c2onc3ccc(C=O)cc23	BroadT	BRD-K30777156	BRD-K30777156-001-05-3	Key Organics Ltd.	7H-923			Cc1ccc(cc1)-c1onc2ccc(C=O)cc12	InChI=1S/C15H11NO2/c1-10-2-5-12(6-3-10)15-13-8-11(9-17)4-7-14(13)16-18-15/h2-9H,1H3	AKCMMYWXXNCXES-UHFFFAOYSA-N	237.078978602							107585
MLS000521311	LSM-18942	SID14733412, BRD-K10402274	4226173	InChI=1S/C26H27N3O2/c1-31-20-12-10-19(11-13-20)27-25(30)18-28-14-16-29(17-15-28)26-23-8-4-2-6-21(23)22-7-3-5-9-24(22)26/h2-13,26H,14-18H2,1H3,(H,27,30)	ACUVUDWJWJUPDC-UHFFFAOYSA-N	COc1ccc(NC(=O)CN2CCN(CC2)C3c4ccccc4c5ccccc35)cc1	BroadT	BRD-K10402274	BRD-K10402274-001-05-9	ChemDiv Inc.	K940-1560			COc1ccc(NC(=O)CN2CCN(CC2)C2c3ccccc3-c3ccccc23)cc1	InChI=1S/C26H27N3O2/c1-31-20-12-10-19(11-13-20)27-25(30)18-28-14-16-29(17-15-28)26-23-8-4-2-6-21(23)22-7-3-5-9-24(22)26/h2-13,26H,14-18H2,1H3,(H,27,30)	ACUVUDWJWJUPDC-UHFFFAOYSA-N	413.210327134							107586
AC1MJ5AZ	LSM-18943	SID24801072, BRD-K77162186	3131591	InChI=1S/C21H24N2O4S/c1-13-7-9-14(10-8-13)22-20(27)19-15-5-3-2-4-6-16(15)28-21(19)23-17(24)11-12-18(25)26/h7-10H,2-6,11-12H2,1H3,(H,22,27)(H,23,24)(H,25,26)	PCAAPIJWXOJZEZ-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2c3CCCCCc3sc2NC(=O)CCC(=O)O)cc1	BroadT	BRD-K77162186	BRD-K77162186-001-05-6	Asinex Ltd.	BAS 01426035			Cc1ccc(NC(=O)c2c(NC(=O)CCC(O)=O)sc3CCCCCc23)cc1	InChI=1S/C21H24N2O4S/c1-13-7-9-14(10-8-13)22-20(27)19-15-5-3-2-4-6-16(15)28-21(19)23-17(24)11-12-18(25)26/h7-10H,2-6,11-12H2,1H3,(H,22,27)(H,23,24)(H,25,26)	PCAAPIJWXOJZEZ-UHFFFAOYSA-N	400.145677958							107587
N-[4-(Cyanomethyl)phenyl]-4-cyclohexylbenzenesulfonamide	LSM-18944	SID17506772, BRD-K52469100	2227004	InChI=1S/C20H22N2O2S/c21-15-14-16-6-10-19(11-7-16)22-25(23,24)20-12-8-18(9-13-20)17-4-2-1-3-5-17/h6-13,17,22H,1-5,14H2	IYKDDQDAIJXAKD-UHFFFAOYSA-N	O=S(=O)(Nc1ccc(CC#N)cc1)c2ccc(cc2)C3CCCCC3	BroadT	BRD-K52469100	BRD-K52469100-001-05-7	ChemBridge Corporation	7951903			O=S(=O)(Nc1ccc(CC#N)cc1)c1ccc(cc1)C1CCCCC1	InChI=1S/C20H22N2O2S/c21-15-14-16-6-10-19(11-7-16)22-25(23,24)20-12-8-18(9-13-20)17-4-2-1-3-5-17/h6-13,17,22H,1-5,14H2	IYKDDQDAIJXAKD-UHFFFAOYSA-N	354.140198654							107588
N-(4-Chlorophenyl)-n'-(2-furylmethyl)thiourea	LSM-18945	SID22400367, BRD-K47000843	841941	InChI=1S/C12H11ClN2OS/c13-9-3-5-10(6-4-9)15-12(17)14-8-11-2-1-7-16-11/h1-7H,8H2,(H2,14,15,17)	QTEYPAXEBVFYCM-UHFFFAOYSA-N	Clc1ccc(NC(=S)NCc2occc2)cc1	BroadT	BRD-K47000843	BRD-K47000843-001-05-0	Specs	AK-968/41018774			Clc1ccc(NC(=S)NCc2ccco2)cc1	InChI=1S/C12H11ClN2OS/c13-9-3-5-10(6-4-9)15-12(17)14-8-11-2-1-7-16-11/h1-7H,8H2,(H2,14,15,17)	QTEYPAXEBVFYCM-UHFFFAOYSA-N	266.028061392							107589
MLS000072908	LSM-18946	SID848999, BRD-K84334376	651465	InChI=1S/C25H32N4O2/c1-18-11-12-19(2)23-22(18)15-21(24(30)27-23)17-29(14-8-13-28(3)4)25(31)26-16-20-9-6-5-7-10-20/h5-7,9-12,15H,8,13-14,16-17H2,1-4H3,(H,26,31)(H,27,30)	OOBJNYVCCUSPJH-UHFFFAOYSA-N	CN(C)CCCN(Cc1cc2c(C)ccc(C)c2nc1O)C(=O)NCc3ccccc3	BroadT	BRD-K84334376	BRD-K84334376-001-05-2	Asinex Ltd.	ASN 05112270			CN(C)CCCN(Cc1cc2c(C)ccc(C)c2nc1O)C(=O)NCc1ccccc1	InChI=1S/C25H32N4O2/c1-18-11-12-19(2)23-22(18)15-21(24(30)27-23)17-29(14-8-13-28(3)4)25(31)26-16-20-9-6-5-7-10-20/h5-7,9-12,15H,8,13-14,16-17H2,1-4H3,(H,26,31)(H,27,30)	OOBJNYVCCUSPJH-UHFFFAOYSA-N	420.252526304							107590
BAS 08197510	LSM-18947	SID49640937, BRD-K32891515	955255	InChI=1S/C19H17FN2O2/c1-2-18(23)14-11-22(17-10-6-3-7-13(14)17)12-19(24)21-16-9-5-4-8-15(16)20/h3-11H,2,12H2,1H3,(H,21,24)	VLYSKKBXAFTPKA-UHFFFAOYSA-N	CCC(=O)c1cn(CC(=O)Nc2ccccc2F)c3ccccc13	BroadT	BRD-K32891515	BRD-K32891515-001-05-6	Asinex Ltd.	BAS 08197510			CCC(=O)c1cn(CC(=O)Nc2ccccc2F)c2ccccc12	InChI=1S/C19H17FN2O2/c1-2-18(23)14-11-22(17-10-6-3-7-13(14)17)12-19(24)21-16-9-5-4-8-15(16)20/h3-11H,2,12H2,1H3,(H,21,24)	VLYSKKBXAFTPKA-UHFFFAOYSA-N	324.127406004							107591
SMR000046515	LSM-18948	SID24841279, SID864074, BRD-K01583113	665325	InChI=1S/C24H23ClN4O4S/c1-24(2)10-17-18(13-33-24)34-22-20(17)21(26)28(11-16-4-3-9-32-16)23(31)29(22)12-19(30)27-15-7-5-14(25)6-8-15/h3-9,26H,10-13H2,1-2H3,(H,27,30)	GTMNRQVYUQDJKF-UHFFFAOYSA-N	CC1(C)Cc2c(CO1)sc3N(CC(=O)Nc4ccc(Cl)cc4)C(=O)N(Cc5occc5)C(=N)c23	BroadT	BRD-K01583113	BRD-K01583113-001-05-2	InterBioScreen Ltd.	STOCK5S-05155			CC1(C)Cc2c(CO1)sc1n(CC(=O)Nc3ccc(Cl)cc3)c(=O)n(Cc3ccco3)c(=N)c21	InChI=1S/C24H23ClN4O4S/c1-24(2)10-17-18(13-33-24)34-22-20(17)21(26)28(11-16-4-3-9-32-16)23(31)29(22)12-19(30)27-15-7-5-14(25)6-8-15/h3-9,26H,10-13H2,1-2H3,(H,27,30)	GTMNRQVYUQDJKF-UHFFFAOYSA-N	498.112853656							107592
SMR000135653	LSM-18949	SID14740226, BRD-K39976509	787417	InChI=1S/C19H17N3O/c1-22-17-9-5-4-8-16(17)21-19(22)20-12-15-14-7-3-2-6-13(14)10-11-18(15)23/h2-11,23H,12H2,1H3,(H,20,21)	NBYDRGNPINHLKT-UHFFFAOYSA-N	Cn1c(NCc2c(O)ccc3ccccc23)nc4ccccc14	BroadT	BRD-K39976509	BRD-K39976509-001-06-4	ChemBridge Corporation	6507684			Cn1c(NCc2c(O)ccc3ccccc23)nc2ccccc12	InChI=1S/C19H17N3O/c1-22-17-9-5-4-8-16(17)21-19(22)20-12-15-14-7-3-2-6-13(14)10-11-18(15)23/h2-11,23H,12H2,1H3,(H,20,21)	NBYDRGNPINHLKT-UHFFFAOYSA-N	303.137162194							107593
MLS000554005	LSM-18950	SID17507818, BRD-K03530975	5436958	InChI=1S/C18H16BrN3O2/c1-11-7-9-13-15(16(11)19)17(18(24)20-13)22-21-14(23)10-8-12-5-3-2-4-6-12/h2-7,9,20,24H,8,10H2,1H3	KERBZOJBZLCDMR-UHFFFAOYSA-N	Cc1ccc2[nH]c(O)c(N=NC(=O)CCc3ccccc3)c2c1Br	BroadT	BRD-K03530975	BRD-K03530975-001-05-8	Asinex Ltd.	BAS 00296783			Cc1ccc2[nH]c(O)c(N=NC(=O)CCc3ccccc3)c2c1Br	InChI=1S/C18H16BrN3O2/c1-11-7-9-13-15(16(11)19)17(18(24)20-13)22-21-14(23)10-8-12-5-3-2-4-6-12/h2-7,9,20,24H,8,10H2,1H3	KERBZOJBZLCDMR-UHFFFAOYSA-N	385.042589382							
F0636-0312	LSM-18951	SID7970831, BRD-K68432789	4537203	InChI=1S/C19H17N5O5S2/c1-10-9-30-19-20-8-15(18(26)24(10)19)16(25)21-13-4-6-14(7-5-13)31(27,28)23-17-11(2)12(3)22-29-17/h4-9,23H,1-3H3,(H,21,25)	AFAPWMRCFMPQBV-UHFFFAOYSA-N	CC1=CSC2=NC=C(C(=O)Nc3ccc(cc3)S(=O)(=O)Nc4onc(C)c4C)C(=O)N12	BroadT	BRD-K68432789	BRD-K68432789-001-05-5	Life Chemicals Inc.	F0636-0312			Cc1noc(NS(=O)(=O)c2ccc(NC(=O)c3cnc4scc(C)n4c3=O)cc2)c1C	InChI=1S/C19H17N5O5S2/c1-10-9-30-19-20-8-15(18(26)24(10)19)16(25)21-13-4-6-14(7-5-13)31(27,28)23-17-11(2)12(3)22-29-17/h4-9,23H,1-3H3,(H,21,25)	AFAPWMRCFMPQBV-UHFFFAOYSA-N	459.067110074							107595
MLS000027766	LSM-18952	SID50086167, SID852230, BRD-A80327103	654842	InChI=1S/C19H19N3O3S3/c1-12-8-14-9-13(5-6-17(14)22(12)28(2,24)25)16-11-27-19(20-16)21-18(23)10-15-4-3-7-26-15/h3-7,9,11-12H,8,10H2,1-2H3,(H,20,21,23)	VHTWQMIWARETAV-UHFFFAOYSA-N	CC1Cc2cc(ccc2N1S(=O)(=O)C)c3csc(NC(=O)Cc4cccs4)n3	BroadT	BRD-A80327103	BRD-A80327103-001-06-0	Asinex Ltd.	ASN 06955039			CC1Cc2cc(ccc2N1S(C)(=O)=O)-c1csc(NC(=O)Cc2cccs2)n1	InChI=1S/C19H19N3O3S3/c1-12-8-14-9-13(5-6-17(14)22(12)28(2,24)25)16-11-27-19(20-16)21-18(23)10-15-4-3-7-26-15/h3-7,9,11-12H,8,10H2,1-2H3,(H,20,21,23)	VHTWQMIWARETAV-UHFFFAOYSA-N	433.058853568							107596
MLS000760691	LSM-18953	SID24837044, BRD-K13247244	2360777	InChI=1S/C15H11FN2O2S2/c16-9-3-5-10(6-4-9)17-15-18-14(11-2-1-7-21-11)12(22-15)8-13(19)20/h1-7H,8H2,(H,17,18)(H,19,20)	ZDEZJQADCAKSPF-UHFFFAOYSA-N	OC(=O)Cc1sc(Nc2ccc(F)cc2)nc1c3cccs3	BroadT	BRD-K13247244	BRD-K13247244-001-05-2	Enamine Ltd.	T0507-1608			OC(=O)Cc1sc(Nc2ccc(F)cc2)nc1-c1cccs1	InChI=1S/C15H11FN2O2S2/c16-9-3-5-10(6-4-9)17-15-18-14(11-2-1-7-21-11)12(22-15)8-13(19)20/h1-7H,8H2,(H,17,18)(H,19,20)	ZDEZJQADCAKSPF-UHFFFAOYSA-N	334.024597192							107597
CHEMBL399982	LSM-43812	SID26725863, BRD-K21281823	1005314	InChI=1S/C21H14ClN3O4/c22-14-5-2-7-17(11-14)25-19(26)18(23-21(25)29)12-16-8-3-9-24(16)15-6-1-4-13(10-15)20(27)28/h1-12H,(H,23,29)(H,27,28)/b18-12+	SKNKQCUDNWAXHL-LDADJPATSA-N	OC(=O)c1cccc(c1)n2cccc2\C=C/3\NC(=O)N(C3=O)c4cccc(Cl)c4	BroadT	BRD-K21281823	BRD-K21281823-001-05-0	InterBioScreen Ltd.	STOCK4S-29954			OC(=O)c1cccc(c1)-n1cccc1\C=C1\NC(=O)N(C1=O)c1cccc(Cl)c1	InChI=1S/C21H14ClN3O4/c22-14-5-2-7-17(11-14)25-19(26)18(23-21(25)29)12-16-8-3-9-24(16)15-6-1-4-13(10-15)20(27)28/h1-12H,(H,23,29)(H,27,28)/b18-12+	SKNKQCUDNWAXHL-LDADJPATSA-N	407.067283668							
ILP-IV-66	LSM-18955	SID26732689, BRD-K29512681	16746635	InChI=1S/C24H33N5O6/c1-14(21(32)34-23(2,3)4)28-19(30)17-18(27-13-26-17)20(31)29-16-10-8-15(9-11-16)12-25-22(33)35-24(5,6)7/h8-11,13-14H,12H2,1-7H3,(H,25,33)(H,26,27)(H,28,30)(H,29,31)/t14-/m0/s1	LYCSQYGDKXPKPY-AWEZNQCLSA-N	C[C@H](NC(=O)c1[nH]cnc1C(=O)Nc2ccc(CNC(=O)OC(C)(C)C)cc2)C(=O)OC(C)(C)C	BroadT	BRD-K29512681	BRD-K29512681-001-05-1	University of Tulsa	ILP-IV-66 AE06_AN07			C[C@H](NC(=O)c1[nH]cnc1C(=O)Nc1ccc(CNC(=O)OC(C)(C)C)cc1)C(=O)OC(C)(C)C	InChI=1S/C24H33N5O6/c1-14(21(32)34-23(2,3)4)28-19(30)17-18(27-13-26-17)20(31)29-16-10-8-15(9-11-16)12-25-22(33)35-24(5,6)7/h8-11,13-14H,12H2,1-7H3,(H,25,33)(H,26,27)(H,28,30)(H,29,31)/t14-/m0/s1	LYCSQYGDKXPKPY-AWEZNQCLSA-N	487.243083826							107599
MLS000888945	LSM-18956	SID26728112, BRD-K95170281	16745930	InChI=1S/C18H13N3O2S/c1-10-2-4-11(5-3-10)15-9-24-18-20-14-8-12(16(19)22)6-7-13(14)17(23)21(15)18/h2-9H,1H3,(H2,19,22)	BQHMKUHKKQPGKA-UHFFFAOYSA-N	Cc1ccc(cc1)C2=CSC3=Nc4cc(ccc4C(=O)N23)C(=O)N	BroadT	BRD-K95170281	BRD-K95170281-001-05-1	University of Notre Dame	5-Oxo-3-p-tolyl-5H-thiazolo[2,3-b]quinazoline-8-carboxylic acid amide IB159			Cc1ccc(cc1)-c1csc2nc3cc(C(N)=O)ccc3c(=O)n12	InChI=1S/C18H13N3O2S/c1-10-2-4-11(5-3-10)15-9-24-18-20-14-8-12(16(19)22)6-7-13(14)17(23)21(15)18/h2-9H,1H3,(H2,19,22)	BQHMKUHKKQPGKA-UHFFFAOYSA-N	335.072847376							107600
Savirin	LSM-18957	Savirin	3243271	InChI=1S/C18H16N4O3S/c1-11(2)12-7-9-13(10-8-12)26(24,25)18-16-19-17(23)14-5-3-4-6-15(14)22(16)21-20-18/h3-11H,1-2H3,(H,19,23)	VXRPWYOOYFIHSS-UHFFFAOYSA-N	CC(C)c1ccc(cc1)S(=O)(=O)c2nnn3c4ccccc4c(O)nc23	BroadT	BRD-K82555718	BRD-K82555718-001-05-1	Life Chemicals Inc.	F1604-0012			CC(C)c1ccc(cc1)S(=O)(=O)c1nnn2c1nc(O)c1ccccc21	InChI=1S/C18H16N4O3S/c1-11(2)12-7-9-13(10-8-12)26(24,25)18-16-19-17(23)14-5-3-4-6-15(14)22(16)21-20-18/h3-11H,1-2H3,(H,19,23)	VXRPWYOOYFIHSS-UHFFFAOYSA-N	368.094311102							
AC1LJN6S	LSM-18958	BRD-K65965564	1027380	InChI=1S/C19H22N4O3S/c1-12-4-6-15(8-13(12)2)22-18(24)11-26-16-7-5-14(9-17(16)25-3)10-21-23-19(20)27/h4-10H,11H2,1-3H3,(H,22,24)(H3,20,23,27)	CSTULWDXJNUOOL-UHFFFAOYSA-N	COc1cc(C=NN=C(N)S)ccc1OCC(=O)Nc2ccc(C)c(C)c2	BroadT	BRD-K65965564	BRD-K65965564-001-05-8	Specs	AN-988/40679742			COc1cc(C=NN=C(N)S)ccc1OCC(=O)Nc1ccc(C)c(C)c1	InChI=1S/C19H22N4O3S/c1-12-4-6-15(8-13(12)2)22-18(24)11-26-16-7-5-14(9-17(16)25-3)10-21-23-19(20)27/h4-10H,11H2,1-3H3,(H,22,24)(H3,20,23,27)	CSTULWDXJNUOOL-UHFFFAOYSA-N	386.141261294							107602
STK295194	LSM-18959	SID49724624, BRD-K84447610	2996514	InChI=1S/C19H17N3OS/c1-12-5-3-6-14(11-12)18(23)22-19(24)21-17-8-4-7-16-15(17)10-9-13(2)20-16/h3-11H,1-2H3,(H2,21,22,23,24)	WLXSYJWBJDTIGA-UHFFFAOYSA-N	Cc1cccc(c1)C(=O)NC(=S)Nc2cccc3nc(C)ccc23	BroadT	BRD-K84447610	BRD-K84447610-001-05-8	ChemBridge Corporation	9014212			Cc1cccc(c1)C(=O)NC(=S)Nc1cccc2nc(C)ccc12	InChI=1S/C19H17N3OS/c1-12-5-3-6-14(11-12)18(23)22-19(24)21-17-8-4-7-16-15(17)10-9-13(2)20-16/h3-11H,1-2H3,(H2,21,22,23,24)	WLXSYJWBJDTIGA-UHFFFAOYSA-N	335.109232884							107603
T5293777	LSM-18960	SID14746835, BRD-K03205298	2525399	InChI=1S/C19H17FN2O4S2/c20-13-6-1-4-10-17(13)28(24,25)22-11-5-8-15(22)19(23)26-12-18-21-14-7-2-3-9-16(14)27-18/h1-4,6-7,9-10,15H,5,8,11-12H2/t15-/m0/s1	XAUDRYNVUQQMSZ-HNNXBMFYSA-N	Fc1ccccc1S(=O)(=O)N2CCC[C@H]2C(=O)OCc3nc4ccccc4s3	BroadT	BRD-K03205298	BRD-K03205298-001-05-7	Enamine Ltd.	T5293777			Fc1ccccc1S(=O)(=O)N1CCC[C@H]1C(=O)OCc1nc2ccccc2s1	InChI=1S/C19H17FN2O4S2/c20-13-6-1-4-10-17(13)28(24,25)22-11-5-8-15(22)19(23)26-12-18-21-14-7-2-3-9-16(14)27-18/h1-4,6-7,9-10,15H,5,8,11-12H2/t15-/m0/s1	XAUDRYNVUQQMSZ-HNNXBMFYSA-N	420.061376624							107604
SMR000074826	LSM-18961	SID4254924, SID7968314, BRD-A71200869	2947859	InChI=1S/C18H18N2O3/c21-16(19-10-13-6-3-9-23-13)11-20-15-8-2-5-12-4-1-7-14(17(12)15)18(20)22/h1-2,4-5,7-8,13H,3,6,9-11H2,(H,19,21)	VVKPUAPJGHWAIV-UHFFFAOYSA-N	O=C(CN1C(=O)c2cccc3cccc1c23)NCC4CCCO4	BroadT	BRD-A71200869	BRD-A71200869-001-05-6	ChemDiv Inc.	6423-0025			O=C(CN1C(=O)c2cccc3cccc1c23)NCC1CCCO1	InChI=1S/C18H18N2O3/c21-16(19-10-13-6-3-9-23-13)11-20-15-8-2-5-12-4-1-7-14(17(12)15)18(20)22/h1-2,4-5,7-8,13H,3,6,9-11H2,(H,19,21)	VVKPUAPJGHWAIV-UHFFFAOYSA-N	310.131742456							107605
STK567505	LSM-18962	SID4260384, BRD-A08435997	2952911	InChI=1S/C20H22N4O2/c1-12-4-7-15(8-5-12)22-20-23-17(11-18(25)24-20)19(26)21-16-9-6-13(2)14(3)10-16/h4-10,17H,11H2,1-3H3,(H,21,26)(H2,22,23,24,25)	UZOANRZPVQIWRV-UHFFFAOYSA-N	Cc1ccc(NC2=NC(=O)CC(N2)C(=O)Nc3ccc(C)c(C)c3)cc1	BroadT	BRD-A08435997	BRD-A08435997-001-05-1	ChemBridge Corporation	7768869			Cc1ccc(NC2=NC(=O)CC(N2)C(=O)Nc2ccc(C)c(C)c2)cc1	InChI=1S/C20H22N4O2/c1-12-4-7-15(8-5-12)22-20-23-17(11-18(25)24-20)19(26)21-16-9-6-13(2)14(3)10-16/h4-10,17H,11H2,1-3H3,(H,21,26)(H2,22,23,24,25)	UZOANRZPVQIWRV-UHFFFAOYSA-N	350.174275984							107606
MLS000554438	LSM-18963	SID17508880, BRD-K63641806	1105152	InChI=1S/C23H21NO5S2/c1-16-9-11-19(12-10-16)31(28,29)14-13-30-18-6-4-5-17(15-18)22(25)24-21-8-3-2-7-20(21)23(26)27/h2-12,15H,13-14H2,1H3,(H,24,25)(H,26,27)	MYDKXHMRNKHYRA-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)CCSc2cccc(c2)C(=O)Nc3ccccc3C(=O)O	BroadT	BRD-K63641806	BRD-K63641806-001-05-5	Asinex Ltd.	BAS 00154334			Cc1ccc(cc1)S(=O)(=O)CCSc1cccc(c1)C(=O)Nc1ccccc1C(O)=O	InChI=1S/C23H21NO5S2/c1-16-9-11-19(12-10-16)31(28,29)14-13-30-18-6-4-5-17(15-18)22(25)24-21-8-3-2-7-20(21)23(26)27/h2-12,15H,13-14H2,1H3,(H,24,25)(H,26,27)	MYDKXHMRNKHYRA-UHFFFAOYSA-N	455.086114162							107607
2-Chloro-4-methyl-n-[4-(4-methylpiperazin-1-yl)phenyl]benzamide	LSM-18964	SID49642428, BRD-K97655218	834151	InChI=1S/C19H22ClN3O/c1-14-3-8-17(18(20)13-14)19(24)21-15-4-6-16(7-5-15)23-11-9-22(2)10-12-23/h3-8,13H,9-12H2,1-2H3,(H,21,24)	BGVHQPOMPNPFDV-UHFFFAOYSA-N	CN1CCN(CC1)c2ccc(NC(=O)c3ccc(C)cc3Cl)cc2	BroadT	BRD-K97655218	BRD-K97655218-001-05-7	Asinex Ltd.	BAS 06829489			CN1CCN(CC1)c1ccc(NC(=O)c2ccc(C)cc2Cl)cc1	InChI=1S/C19H22ClN3O/c1-14-3-8-17(18(20)13-14)19(24)21-15-4-6-16(7-5-15)23-11-9-22(2)10-12-23/h3-8,13H,9-12H2,1-2H3,(H,21,24)	BGVHQPOMPNPFDV-UHFFFAOYSA-N	343.145140064							107608
N-(2,4-Dimethoxyphenyl)-n'-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanediamide	LSM-18965	SID14741660, BRD-K36578176	1398618	InChI=1S/C15H15F3N4O4S/c1-25-8-3-4-9(10(7-8)26-2)19-11(23)5-6-12(24)20-14-22-21-13(27-14)15(16,17)18/h3-4,7H,5-6H2,1-2H3,(H,19,23)(H,20,22,24)	YVBKAHRBBICCLR-UHFFFAOYSA-N	COc1ccc(NC(=O)CCC(=O)Nc2nnc(s2)C(F)(F)F)c(OC)c1	BroadT	BRD-K36578176	BRD-K36578176-001-06-3	InterBioScreen Ltd.	STOCK4S-81065			COc1ccc(NC(=O)CCC(=O)Nc2nnc(s2)C(F)(F)F)c(OC)c1	InChI=1S/C15H15F3N4O4S/c1-25-8-3-4-9(10(7-8)26-2)19-11(23)5-6-12(24)20-14-22-21-13(27-14)15(16,17)18/h3-4,7H,5-6H2,1-2H3,(H,19,23)(H,20,22,24)	YVBKAHRBBICCLR-UHFFFAOYSA-N	404.07661029							107609
SMR000074721	LSM-18966	SID4265105, SID26668475, BRD-A16470924	2947587	InChI=1S/C22H21N3O5S2/c26-21(20-13-29-18-5-1-2-6-19(18)30-20)24-22-23-17(14-31-22)15-7-9-16(10-8-15)32(27,28)25-11-3-4-12-25/h1-2,5-10,14,20H,3-4,11-13H2,(H,23,24,26)	UQGXWGVQAVBUGD-UHFFFAOYSA-N	O=C(Nc1nc(cs1)c2ccc(cc2)S(=O)(=O)N3CCCC3)C4COc5ccccc5O4	BroadT	BRD-A16470924	BRD-A16470924-001-05-6	ChemBridge Corporation	7682384			O=C(Nc1nc(cs1)-c1ccc(cc1)S(=O)(=O)N1CCCC1)C1COc2ccccc2O1	InChI=1S/C22H21N3O5S2/c26-21(20-13-29-18-5-1-2-6-19(18)30-20)24-22-23-17(14-31-22)15-7-9-16(10-8-15)32(27,28)25-11-3-4-12-25/h1-2,5-10,14,20H,3-4,11-13H2,(H,23,24,26)	UQGXWGVQAVBUGD-UHFFFAOYSA-N	471.092262182							107610
SMR000036038	LSM-18967	SID24840831, SID859769, BRD-K08091685	661072	InChI=1S/C16H17NO5S2/c1-2-22-16(21)14-10(11-5-4-8-23-11)9-24-15(14)17-12(18)6-3-7-13(19)20/h4-5,8-9H,2-3,6-7H2,1H3,(H,17,18)(H,19,20)	QKNHDCQPVUCGMO-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)CCCC(=O)O)scc1c2cccs2	BroadT	BRD-K08091685	BRD-K08091685-001-05-7	InterBioScreen Ltd.	STOCK3S-29288			CCOC(=O)c1c(NC(=O)CCCC(O)=O)scc1-c1cccs1	InChI=1S/C16H17NO5S2/c1-2-22-16(21)14-10(11-5-4-8-23-11)9-24-15(14)17-12(18)6-3-7-13(19)20/h4-5,8-9H,2-3,6-7H2,1H3,(H,17,18)(H,19,20)	QKNHDCQPVUCGMO-UHFFFAOYSA-N	367.054814034							107611
AC1LKB0Y	LSM-18968	BRD-K94253377	1040311	InChI=1S/C23H19N3O3S/c27-19-8-2-1-5-16(19)10-12-21(28)26-25-15-18-11-13-22(29-18)30-20-9-3-6-17-7-4-14-24-23(17)20/h1-9,11,13-15,27H,10,12H2,(H,26,28)	MEMJQWACUZPANO-UHFFFAOYSA-N	Oc1ccccc1CCC(=O)NN=Cc2oc(Sc3cccc4cccnc34)cc2	BroadT	BRD-K94253377	BRD-K94253377-001-05-1	ChemBridge Corporation	5924351			Oc1ccccc1CCC(=O)NN=Cc1ccc(Sc2cccc3cccnc23)o1	InChI=1S/C23H19N3O3S/c27-19-8-2-1-5-16(19)10-12-21(28)26-25-15-18-11-13-22(29-18)30-20-9-3-6-17-7-4-14-24-23(17)20/h1-9,11,13-15,27H,10,12H2,(H,26,28)	MEMJQWACUZPANO-UHFFFAOYSA-N	417.114712188							107612
N-Cyclooctyl-4-methylbenzenesulfonamide	LSM-6588	EMF-SUMO1-8, SID47198549, BRD-K38324426	260972	InChI=1S/C15H23NO2S/c1-13-9-11-15(12-10-13)19(17,18)16-14-7-5-3-2-4-6-8-14/h9-12,14,16H,2-8H2,1H3	YXSWGHDOGYIRBI-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NC2CCCCCCC2	BroadT	BRD-K38324426	BRD-K38324426-001-08-4	ChemBridge Corporation	6104683			Cc1ccc(cc1)S(=O)(=O)NC1CCCCCCC1	InChI=1S/C15H23NO2S/c1-13-9-11-15(12-10-13)19(17,18)16-14-7-5-3-2-4-6-8-14/h9-12,14,16H,2-8H2,1H3	YXSWGHDOGYIRBI-UHFFFAOYSA-N	281.144949676							95261
BRD-A38284918	LSM-18969			InChI=1S/C21H17BrN2O7/c1-9-4-5-13(30-9)19(26)16-17(11-7-12(22)18(25)14(8-11)29-3)24(21(28)20(16)27)15-6-10(2)31-23-15/h4-8,16-17,25H,1-3H3	JKRCRUWDYASULG-UHFFFAOYSA-N	COc1cc(cc(Br)c1O)C2C(C(=O)c3oc(C)cc3)C(=O)C(=O)N2c4cc(C)on4	BroadT	BRD-A38284918	BRD-A38284918-001-05-3	InterBioScreen Ltd.	STOCK4S-18367			COc1cc(cc(Br)c1O)C1C(C(=O)c2ccc(C)o2)C(=O)C(=O)N1c1cc(C)on1	InChI=1S/C21H17BrN2O7/c1-9-4-5-13(30-9)19(26)16-17(11-7-12(22)18(25)14(8-11)29-3)24(21(28)20(16)27)15-6-10(2)31-23-15/h4-8,16-17,25H,1-3H3	JKRCRUWDYASULG-UHFFFAOYSA-N	488.021913504							107613
MLS000065638	LSM-18970	SID4260149, BRD-K23460304	1245035	InChI=1S/C14H16N2O3S/c1-3-4-9-7-11(12(15)17)14(20-9)16-13(18)10-5-6-19-8(10)2/h5-7H,3-4H2,1-2H3,(H2,15,17)(H,16,18)	CKJLLUXMXMSKGF-UHFFFAOYSA-N	CCCc1cc(C(=O)N)c(NC(=O)c2ccoc2C)s1	BroadT	BRD-K23460304	BRD-K23460304-001-06-4	ChemBridge Corporation	7944341			CCCc1cc(C(N)=O)c(NC(=O)c2ccoc2C)s1	InChI=1S/C14H16N2O3S/c1-3-4-9-7-11(12(15)17)14(20-9)16-13(18)10-5-6-19-8(10)2/h5-7H,3-4H2,1-2H3,(H2,15,17)(H,16,18)	CKJLLUXMXMSKGF-UHFFFAOYSA-N	292.088163082							107614
MLS000766598	LSM-18971	SID24841624, BRD-K05567789	16197109	InChI=1S/C29H27NO4S/c31-17-21-10-12-22(13-11-21)18-33-28-15-23(25-19-35-27-9-5-4-8-24(25)27)14-26(34-28)29(32)30-16-20-6-2-1-3-7-20/h1-14,19,23,28,31H,15-18H2,(H,30,32)/t23-,28+/m1/s1	HCHDWAVTMDCPLB-LXFBAYGMSA-N	OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)NCc3ccccc3)c4csc5ccccc45)cc1	BroadT	BRD-K05567789	BRD-K05567789-001-08-8	Harvard University	DHPC11_000519			OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)NCc2ccccc2)c2csc3ccccc23)cc1	InChI=1S/C29H27NO4S/c31-17-21-10-12-22(13-11-21)18-33-28-15-23(25-19-35-27-9-5-4-8-24(25)27)14-26(34-28)29(32)30-16-20-6-2-1-3-7-20/h1-14,19,23,28,31H,15-18H2,(H,30,32)/t23-,28+/m1/s1	HCHDWAVTMDCPLB-LXFBAYGMSA-N	485.166079044							107615
Ethyl 2-(5,7-dihydroxy-4-methyl-2-oxochromen-3-yl)acetate	LSM-18972	SID3714528, BRD-K83291035	5381321	InChI=1S/C14H14O6/c1-3-19-12(17)6-9-7(2)13-10(16)4-8(15)5-11(13)20-14(9)18/h4-5,15-16H,3,6H2,1-2H3	RDSHEHFDUUPIAW-UHFFFAOYSA-N	CCOC(=O)CC1=C(C)c2c(O)cc(O)cc2OC1=O	BroadT	BRD-K83291035	BRD-K83291035-001-05-8	Enamine Ltd.	T0501-0334			CCOC(=O)Cc1c(C)c2c(O)cc(O)cc2oc1=O	InChI=1S/C14H14O6/c1-3-19-12(17)6-9-7(2)13-10(16)4-8(15)5-11(13)20-14(9)18/h4-5,15-16H,3,6H2,1-2H3	RDSHEHFDUUPIAW-UHFFFAOYSA-N	278.079038168							107616
AC1O9A43	LSM-18973	SID24791454, SID87348975, BRD-K44637850	6775439	InChI=1S/C23H26N4O3S/c1-4-24-22(30)19-15-7-5-6-8-18(15)31-23(19)25-21(29)17-11-16(26-27-17)14-10-9-12(2)13(3)20(14)28/h9-11,28H,4-8H2,1-3H3,(H,24,30)(H,25,29)(H,26,27)	CULGOHHUJHGCDM-UHFFFAOYSA-N	CCNC(=O)c1c2CCCCc2sc1NC(=O)c3cc([nH]n3)c4ccc(C)c(C)c4O	BroadT	BRD-K44637850	BRD-K44637850-001-05-2	InterBioScreen Ltd.	STOCK5S-58326			CCNC(=O)c1c(NC(=O)c2cc([nH]n2)-c2ccc(C)c(C)c2O)sc2CCCCc12	InChI=1S/C23H26N4O3S/c1-4-24-22(30)19-15-7-5-6-8-18(15)31-23(19)25-21(29)17-11-16(26-27-17)14-10-9-12(2)13(3)20(14)28/h9-11,28H,4-8H2,1-3H3,(H,24,30)(H,25,29)(H,26,27)	CULGOHHUJHGCDM-UHFFFAOYSA-N	438.172561422							
N-{2-[2-(2-Bromo-4-chlorophenoxy)ethoxy]ethyl}-2-butanamine oxalate	LSM-15539	BRD-A65562228	2936080	InChI=1S/C14H21BrClNO2/c1-3-11(2)17-6-7-18-8-9-19-14-5-4-12(16)10-13(14)15/h4-5,10-11,17H,3,6-9H2,1-2H3	FHEMKPMORHQQQS-UHFFFAOYSA-N	CCC(C)NCCOCCOc1ccc(Cl)cc1Br	BroadT	BRD-A65562228	BRD-A65562228-034-12-0	ChemBridge Corporation	7349419		OC(=O)C(=O)O	CCC(C)NCCOCCOc1ccc(Cl)cc1Br.OC(=O)C(=O)O	InChI=1S/C14H21BrClNO2.C2H2O4/c1-3-11(2)17-6-7-18-8-9-19-14-5-4-12(16)10-13(14)15;3-1(4)2(5)6/h4-5,10-11,17H,3,6-9H2,1-2H3;(H,3,4)(H,5,6)	HYESBCIXPZTBIH-UHFFFAOYSA-N	349.044419232							104175, 104175
F0594-0265	LSM-18974	SID4246783, BRD-K00783478	866861	InChI=1S/C16H19N3O4S/c1-2-22-13-5-3-12(4-6-13)15-17-18-16(23-15)24-11-14(20)19-7-9-21-10-8-19/h3-6H,2,7-11H2,1H3	NMSXDIUHVHKQGG-UHFFFAOYSA-N	CCOc1ccc(cc1)c2oc(SCC(=O)N3CCOCC3)nn2	BroadT	BRD-K00783478	BRD-K00783478-001-05-8	ChemDiv Inc.	C292-0172			CCOc1ccc(cc1)-c1nnc(SCC(=O)N2CCOCC2)o1	InChI=1S/C16H19N3O4S/c1-2-22-13-5-3-12(4-6-13)15-17-18-16(23-15)24-11-14(20)19-7-9-21-10-8-19/h3-6H,2,7-11H2,1H3	NMSXDIUHVHKQGG-UHFFFAOYSA-N	349.109626808							107618
F3225-6976	LSM-18975	SID26664053, BRD-K66490720	1967623	InChI=1S/C23H16FN3O3/c1-26-18-7-3-2-6-17(18)20(28)19-22(26)25-21(14-8-10-15(24)11-9-14)27(23(19)29)13-16-5-4-12-30-16/h2-12H,13H2,1H3	ATRJAQVYBJKZJK-UHFFFAOYSA-N	CN1C2=C(C(=O)N(Cc3occc3)C(=N2)c4ccc(F)cc4)C(=O)c5ccccc15	BroadT	BRD-K66490720	BRD-K66490720-001-05-7	InterBioScreen Ltd.	STOCK5S-56932			Cn1c2ccccc2c(=O)c2c1nc(-c1ccc(F)cc1)n(Cc1ccco1)c2=O	InChI=1S/C23H16FN3O3/c1-26-18-7-3-2-6-17(18)20(28)19-22(26)25-21(14-8-10-15(24)11-9-14)27(23(19)29)13-16-5-4-12-30-16/h2-12H,13H2,1H3	ATRJAQVYBJKZJK-UHFFFAOYSA-N	401.117569602							107619
STK852726	LSM-18976	SID17505768, BRD-K38526395	1840584	InChI=1S/C17H12ClN5OS/c18-13-7-3-4-8-14(13)23-15(20-21-17(23)25)10-22-16(24)12-6-2-1-5-11(12)9-19-22/h1-9H,10H2,(H,21,25)	XHBITWULKPSTLW-UHFFFAOYSA-N	Sc1nnc(CN2N=Cc3ccccc3C2=O)n1c4ccccc4Cl	BroadT	BRD-K38526395	BRD-K38526395-001-05-7	InterBioScreen Ltd.	STOCK5S-35069			Sc1nnc(Cn2ncc3ccccc3c2=O)n1-c1ccccc1Cl	InChI=1S/C17H12ClN5OS/c18-13-7-3-4-8-14(13)23-15(20-21-17(23)25)10-22-16(24)12-6-2-1-5-11(12)9-19-22/h1-9H,10H2,(H,21,25)	XHBITWULKPSTLW-UHFFFAOYSA-N	369.045108454							107620
AC1LJECZ	LSM-43813	SID17512310, BRD-K10783325	921800	InChI=1S/C17H17N3O2/c1-20(2)16-9-8-15(22-16)10-14(11-18)17(21)19-12-13-6-4-3-5-7-13/h3-10H,12H2,1-2H3,(H,19,21)/b14-10-	KSEMQYWKFQVZIB-UVTDQMKNSA-N	CN(C)c1oc(\C=C(\C#N)/C(=O)NCc2ccccc2)cc1	BroadT	BRD-K10783325	BRD-K10783325-001-06-9	InterBioScreen Ltd.	STOCK2S-46690			CN(C)c1ccc(\C=C(\C#N)C(=O)NCc2ccccc2)o1	InChI=1S/C17H17N3O2/c1-20(2)16-9-8-15(22-16)10-14(11-18)17(21)19-12-13-6-4-3-5-7-13/h3-10H,12H2,1-2H3,(H,19,21)/b14-10-	KSEMQYWKFQVZIB-UVTDQMKNSA-N	295.132076814							
AC1LKHBU	LSM-18978	SID7973720, BRD-K70135809	1018416	InChI=1S/C19H23N7O2S2/c1-29-19-21-14-3-2-13(12-15(14)30-19)20-16-22-17(25-4-8-27-9-5-25)24-18(23-16)26-6-10-28-11-7-26/h2-3,12H,4-11H2,1H3,(H,20,22,23,24)	YRZLMZPVQMJPAK-UHFFFAOYSA-N	CSc1nc2ccc(Nc3nc(nc(n3)N4CCOCC4)N5CCOCC5)cc2s1	BroadT	BRD-K70135809	BRD-K70135809-001-04-9	ChemBridge Corporation	6244021			CSc1nc2ccc(Nc3nc(nc(n3)N3CCOCC3)N3CCOCC3)cc2s1	InChI=1S/C19H23N7O2S2/c1-29-19-21-14-3-2-13(12-15(14)30-19)20-16-22-17(25-4-8-27-9-5-25)24-18(23-16)26-6-10-28-11-7-26/h2-3,12H,4-11H2,1H3,(H,20,22,23,24)	YRZLMZPVQMJPAK-UHFFFAOYSA-N	445.135464426							107622
MLS000696568	LSM-18979	SID22400822, BRD-K50947467	5122884	InChI=1S/C20H16N2O4/c1-26-14-7-6-12-10-13(18(23)21-17(12)11-14)8-9-22-19(24)15-4-2-3-5-16(15)20(22)25/h2-7,10-11H,8-9H2,1H3,(H,21,23)	LWRQZGYFWBEOGR-UHFFFAOYSA-N	COc1ccc2cc(CCN3C(=O)c4ccccc4C3=O)c(O)nc2c1	BroadT	BRD-K50947467	BRD-K50947467-001-05-1	Life Chemicals Inc.	F0611-0654			COc1ccc2cc(CCN3C(=O)c4ccccc4C3=O)c(O)nc2c1	InChI=1S/C20H16N2O4/c1-26-14-7-6-12-10-13(18(23)21-17(12)11-14)8-9-22-19(24)15-4-2-3-5-16(15)20(22)25/h2-7,10-11H,8-9H2,1H3,(H,21,23)	LWRQZGYFWBEOGR-UHFFFAOYSA-N	348.111007012							107623
ST50884588	LSM-18980	SID4255823, BRD-K61594853	1246663	InChI=1S/C17H22N2O3/c1-10-15(11(2)22-19-10)16(20)18-13-9-12(17(3,4)5)7-8-14(13)21-6/h7-9H,1-6H3,(H,18,20)	HOFZBEATRCYGFE-UHFFFAOYSA-N	COc1ccc(cc1NC(=O)c2c(C)onc2C)C(C)(C)C	BroadT	BRD-K61594853	BRD-K61594853-001-05-0	ChemBridge Corporation	7947493			COc1ccc(cc1NC(=O)c1c(C)noc1C)C(C)(C)C	InChI=1S/C17H22N2O3/c1-10-15(11(2)22-19-10)16(20)18-13-9-12(17(3,4)5)7-8-14(13)21-6/h7-9H,1-6H3,(H,18,20)	HOFZBEATRCYGFE-UHFFFAOYSA-N	302.163042584							107624
MLS000078341	LSM-18981	SID857981, BRD-K54164807	659329	InChI=1S/C10H11NO4/c12-9-2-1-8(7-15-9)10(13)11-3-5-14-6-4-11/h1-2,7H,3-6H2	YNKJZULRDBGWPX-UHFFFAOYSA-N	O=C(N1CCOCC1)C2=COC(=O)C=C2	BroadT	BRD-K54164807	BRD-K54164807-001-05-8	InterBioScreen Ltd.	STOCK2S-09336			O=C(N1CCOCC1)c1ccc(=O)oc1	InChI=1S/C10H11NO4/c12-9-2-1-8(7-15-9)10(13)11-3-5-14-6-4-11/h1-2,7H,3-6H2	YNKJZULRDBGWPX-UHFFFAOYSA-N	209.068807842							107625
T5268150	LSM-18982	SID24825115, BRD-K57190272	2161820	InChI=1S/C20H22N4O2/c1-12(2)17(23-18(25)14-8-6-7-13(3)11-14)19(26)24-20-21-15-9-4-5-10-16(15)22-20/h4-12,17H,1-3H3,(H,23,25)(H2,21,22,24,26)/t17-/m0/s1	SIFAUQMIWOPROB-KRWDZBQOSA-N	CC(C)[C@H](NC(=O)c1cccc(C)c1)C(=O)Nc2nc3ccccc3[nH]2	BroadT	BRD-K57190272	BRD-K57190272-001-05-6	Enamine Ltd.	T5268150			CC(C)[C@H](NC(=O)c1cccc(C)c1)C(=O)Nc1nc2ccccc2[nH]1	InChI=1S/C20H22N4O2/c1-12(2)17(23-18(25)14-8-6-7-13(3)11-14)19(26)24-20-21-15-9-4-5-10-16(15)22-20/h4-12,17H,1-3H3,(H,23,25)(H2,21,22,24,26)/t17-/m0/s1	SIFAUQMIWOPROB-KRWDZBQOSA-N	350.174275984							107626
N-(2,6-Dimethoxypyrimidin-4-yl)-3-phenylpropanamide	LSM-18983	SID4264574, BRD-K30812685	749283	InChI=1S/C15H17N3O3/c1-20-14-10-12(17-15(18-14)21-2)16-13(19)9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,16,17,18,19)	XUSSTLRZKBKZLT-UHFFFAOYSA-N	COc1cc(NC(=O)CCc2ccccc2)nc(OC)n1	BroadT	BRD-K30812685	BRD-K30812685-001-05-8	ChemBridge Corporation	5365040			COc1cc(NC(=O)CCc2ccccc2)nc(OC)n1	InChI=1S/C15H17N3O3/c1-20-14-10-12(17-15(18-14)21-2)16-13(19)9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,16,17,18,19)	XUSSTLRZKBKZLT-UHFFFAOYSA-N	287.126991434							107627
AP-685/41280872	LSM-18984	SID47194544, BRD-A42412017	4079627	InChI=1S/C20H28N4O3/c1-27-18-8-3-2-6-16(18)22-13-10-21(11-14-22)12-15-24-19(25)17-7-4-5-9-23(17)20(24)26/h2-3,6,8,17H,4-5,7,9-15H2,1H3	YIBAHIUJRKGNMN-UHFFFAOYSA-N	COc1ccccc1N2CCN(CCN3C(=O)C4CCCCN4C3=O)CC2	BroadT	BRD-A42412017	BRD-A42412017-001-06-2	Specs	AP-685/41280872			COc1ccccc1N1CCN(CCN2C(=O)C3CCCCN3C2=O)CC1	InChI=1S/C20H28N4O3/c1-27-18-8-3-2-6-16(18)22-13-10-21(11-14-22)12-15-24-19(25)17-7-4-5-9-23(17)20(24)26/h2-3,6,8,17H,4-5,7,9-15H2,1H3	YIBAHIUJRKGNMN-UHFFFAOYSA-N	372.216140796							107628
MLS000589841	LSM-43814	SID22400593, BRD-K65064932	1916919	InChI=1S/C17H14N2OS/c20-16-15(11-13-7-3-1-4-8-13)21-17(19-16)18-12-14-9-5-2-6-10-14/h1-11H,12H2,(H,18,19,20)/b15-11-	LVKAALLVKHHHGN-PTNGSMBKSA-N	O=C1N=C(NCc2ccccc2)S/C/1=C\c3ccccc3	BroadT	BRD-K65064932	BRD-K65064932-001-06-3	InterBioScreen Ltd.	STOCK2S-10437			O=C1N=C(NCc2ccccc2)S\C1=C/c1ccccc1	InChI=1S/C17H14N2OS/c20-16-15(11-13-7-3-1-4-8-13)21-17(19-16)18-12-14-9-5-2-6-10-14/h1-11H,12H2,(H,18,19,20)/b15-11-	LVKAALLVKHHHGN-PTNGSMBKSA-N	294.082683778							
MLS000075285	LSM-18986	SID842157, BRD-A12838646	644413	InChI=1S/C19H17N5/c1-24-8-7-14-15(9-20)18(23)19(11-21,12-22)17(16(14)10-24)13-5-3-2-4-6-13/h2-8,16-18H,10,23H2,1H3	PFPORCXOCGBIOO-UHFFFAOYSA-N	CN1CC2C(c3ccccc3)C(C#N)(C#N)C(N)C(=C2C=C1)C#N	BroadT	BRD-A12838646	BRD-A12838646-001-05-5	Asinex Ltd.	BAS 07417724			CN1CC2C(c3ccccc3)C(C#N)(C#N)C(N)C(C#N)=C2C=C1	InChI=1S/C19H17N5/c1-24-8-7-14-15(9-20)18(23)19(11-21,12-22)17(16(14)10-24)13-5-3-2-4-6-13/h2-8,16-18H,10,23H2,1H3	PFPORCXOCGBIOO-UHFFFAOYSA-N	315.148395594							107630
Remoxipride	LSM-3202	Remoxipride, Roxiam, A-33547, FLA-731	54477	InChI=1S/C16H23BrN2O3/c1-4-19-9-5-6-11(19)10-18-16(20)14-13(21-2)8-7-12(17)15(14)22-3/h7-8,11H,4-6,9-10H2,1-3H3,(H,18,20)/t11-/m0/s1	GUJRSXAPGDDABA-NSHDSACASA-N	CCN1CCC[C@H]1CNC(=O)c2c(OC)ccc(Br)c2OC	BroadT	BRD-K54094468	BRD-K54094468-001-01-6	Biomol International Inc.	D-111	2812-3-N1298		CCN1CCC[C@H]1CNC(=O)c1c(OC)ccc(Br)c1OC	InChI=1S/C16H23BrN2O3/c1-4-19-9-5-6-11(19)10-18-16(20)14-13(21-2)8-7-12(17)15(14)22-3/h7-8,11H,4-6,9-10H2,1-3H3,(H,18,20)/t11-/m0/s1	GUJRSXAPGDDABA-NSHDSACASA-N	370.089205216							92948, 92948
Glycocholic acid	LSM-3222	Glycocholate, SID56463222	10140	InChI=1S/C26H43NO6/c1-14(4-7-22(31)27-13-23(32)33)17-5-6-18-24-19(12-21(30)26(17,18)3)25(2)9-8-16(28)10-15(25)11-20(24)29/h14-21,24,28-30H,4-13H2,1-3H3,(H,27,31)(H,32,33)/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1	RFDAIACWWDREDC-FRVQLJSFSA-N	C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C	BroadT	BRD-K54771420	BRD-K54771420-001-03-2	Prestwick Chemical Inc.	Prestw-521	D0701-MP04-ST03-200-		C[C@H](CCC(=O)NCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C	InChI=1S/C26H43NO6/c1-14(4-7-22(31)27-13-23(32)33)17-5-6-18-24-19(12-21(30)26(17,18)3)25(2)9-8-16(28)10-15(25)11-20(24)29/h14-21,24,28-30H,4-13H2,1-3H3,(H,27,31)(H,32,33)/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1	RFDAIACWWDREDC-FRVQLJSFSA-N	465.309038106							17687, 17687, 17687
Icosapent	LSM-42964	Icosapent, Omega-3 Marine Triglycerides, Eicosapentaenoic Acid	446284	InChI=1S/C20H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17-19H2,1H3,(H,21,22)/b4-3-,7-6-,10-9-,13-12-,16-15-	JAZBEHYOTPTENJ-JLNKQSITSA-N	CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)O	BroadT	BRD-K47192521	BRD-K47192521-001-02-1	Biomol International Inc.	FA001	2840(V2)-3-N1305		CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O	InChI=1S/C20H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17-19H2,1H3,(H,21,22)/b4-3-,7-6-,10-9-,13-12-,16-15-	JAZBEHYOTPTENJ-JLNKQSITSA-N	302.2245802							28364
Apiin	LSM-18987	SID17505071	5280746	InChI=1S/C26H28O14/c27-8-18-20(32)21(33)22(40-25-23(34)26(35,9-28)10-36-25)24(39-18)37-13-5-14(30)19-15(31)7-16(38-17(19)6-13)11-1-3-12(29)4-2-11/h1-7,18,20-25,27-30,32-35H,8-10H2/t18-,20-,21+,22-,23+,24-,25+,26-/m1/s1	NTDLXWMIWOECHG-YRCFQSNFSA-N	OC[C@H]1O[C@@H](Oc2cc(O)c3C(=O)C=C(Oc3c2)c4ccc(O)cc4)[C@H](O[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@@H]1O	BroadT	BRD-K52379519	BRD-K52379519-001-02-0	MicroSource Discovery Systems Inc.	350025			OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(cc3=O)-c2ccc(O)cc2)[C@H](O[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@@H]1O	InChI=1S/C26H28O14/c27-8-18-20(32)21(33)22(40-25-23(34)26(35,9-28)10-36-25)24(39-18)37-13-5-14(30)19-15(31)7-16(38-17(19)6-13)11-1-3-12(29)4-2-11/h1-7,18,20-25,27-30,32-35H,8-10H2/t18-,20-,21+,22-,23+,24-,25+,26-/m1/s1	NTDLXWMIWOECHG-YRCFQSNFSA-N	564.147905576							15932
1,3-Dipropyl-8-phenylxanthine	LSM-18988	BRD-K41853443, SID11113528	128784	InChI=1S/C17H20N4O2/c1-3-10-20-15-13(16(22)21(11-4-2)17(20)23)18-14(19-15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,18,19)	CLIGSMOZKDCDRZ-UHFFFAOYSA-N	CCCN1C(=O)N(CCC)c2[nH]c(nc2C1=O)c3ccccc3	BroadT	BRD-K41853443	BRD-K41853443-001-01-1	Tocris Bioscience	486	1		CCCn1c2[nH]c(nc2c(=O)n(CCC)c1=O)-c1ccccc1	InChI=1S/C17H20N4O2/c1-3-10-20-15-13(16(22)21(11-4-2)17(20)23)18-14(19-15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,18,19)	CLIGSMOZKDCDRZ-UHFFFAOYSA-N	312.15862592							107631
Benazepril	LSM-5609	Benazepril, Lotensin, Lotrel	5362124	InChI=1S/C24H28N2O5/c1-2-31-24(30)20(14-12-17-8-4-3-5-9-17)25-19-15-13-18-10-6-7-11-21(18)26(23(19)29)16-22(27)28/h3-11,19-20,25H,2,12-16H2,1H3,(H,27,28)/t19-,20-/m0/s1	XPCFTKFZXHTYIP-PMACEKPBSA-N	CCOC(=O)[C@H](CCc1ccccc1)N[C@H]2CCc3ccccc3N(CC(=O)O)C2=O	BroadT	BRD-K49807096	BRD-K49807096-003-02-3	MicroSource Discovery Systems Inc.	1505200		Cl	CCOC(=O)[C@H](CCc1ccccc1)N[C@H]1CCc2ccccc2N(CC(O)=O)C1=O.Cl	InChI=1S/C24H28N2O5.ClH/c1-2-31-24(30)20(14-12-17-8-4-3-5-9-17)25-19-15-13-18-10-6-7-11-21(18)26(23(19)29)16-22(27)28;/h3-11,19-20,25H,2,12-16H2,1H3,(H,27,28);1H/t19-,20-;/m0./s1	VPSRQEHTHIMDQM-FKLPMGAJSA-N	424.199822016							3011
Niridazole	LSM-3174	Niridazole, BA-32644	6093	InChI=1S/C6H6N4O3S/c11-5-7-1-2-9(5)6-8-3-4(14-6)10(12)13/h3H,1-2H2,(H,7,11)	RDXLYGJSWZYTFJ-UHFFFAOYSA-N	[O-][N+](=O)c1cnc(s1)N2CCNC2=O	BroadT	BRD-K53123955	BRD-K53123955-001-03-0	Prestwick Chemical Inc.	Prestw-469	D0701-MP04-ST03-200-		[O-][N+](=O)c1cnc(s1)N1CCNC1=O	InChI=1S/C6H6N4O3S/c11-5-7-1-2-9(5)6-8-3-4(14-6)10(12)13/h3H,1-2H2,(H,7,11)	RDXLYGJSWZYTFJ-UHFFFAOYSA-N	214.016060782							82349
GR-55562	LSM-3026	GR 55562, GR-55562	128018	InChI=1S/C23H25N3O2/c1-26(2)15-3-4-19-16-20(7-10-22(19)27)23(28)25-21-8-5-17(6-9-21)18-11-13-24-14-12-18/h5-14,16,27H,3-4,15H2,1-2H3,(H,25,28)	ZAGAUUVCYGSPBP-UHFFFAOYSA-N	CN(C)CCCc1cc(ccc1O)C(=O)Nc2ccc(cc2)c3ccncc3	BroadT	BRD-K46441700	BRD-K46441700-001-01-8	Biomol International Inc.	AC-538	2813-N1283		CN(C)CCCc1cc(ccc1O)C(=O)Nc1ccc(cc1)-c1ccncc1	InChI=1S/C23H25N3O2/c1-26(2)15-3-4-19-16-20(7-10-22(19)27)23(28)25-21-8-5-17(6-9-21)18-11-13-24-14-12-18/h5-14,16,27H,3-4,15H2,1-2H3,(H,25,28)	ZAGAUUVCYGSPBP-UHFFFAOYSA-N	375.19467707							92813
Flavoxate	LSM-3050	Flavoxate	3354	InChI=1S/C24H25NO4/c1-17-21(26)19-11-8-12-20(23(19)29-22(17)18-9-4-2-5-10-18)24(27)28-16-15-25-13-6-3-7-14-25/h2,4-5,8-12H,3,6-7,13-16H2,1H3	SPIUTQOUKAMGCX-UHFFFAOYSA-N	CC1=C(Oc2c(cccc2C1=O)C(=O)OCCN3CCCCC3)c4ccccc4	BroadT	BRD-K47639036	BRD-K47639036-003-03-3	Prestwick Chemical Inc.	Prestw-242	D0701-MP04-ST03-200-	Cl	Cc1c(oc2c(cccc2c1=O)C(=O)OCCN1CCCCC1)-c1ccccc1.Cl	InChI=1S/C24H25NO4.ClH/c1-17-21(26)19-11-8-12-20(23(19)29-22(17)18-9-4-2-5-10-18)24(27)28-16-15-25-13-6-3-7-14-25;/h2,4-5,8-12H,3,6-7,13-16H2,1H3;1H	XOEVKNFZUQEERE-UHFFFAOYSA-N	391.17835829							5088, 5088
Proadifen	LSM-3023	Proadifen	4910	InChI=1S/C23H31NO2/c1-4-17-23(20-13-9-7-10-14-20,21-15-11-8-12-16-21)22(25)26-19-18-24(5-2)6-3/h7-16H,4-6,17-19H2,1-3H3	SNTQPLDRUZOSDP-UHFFFAOYSA-N	CCCC(C(=O)OCCN(CC)CC)(c1ccccc1)c2ccccc2	BroadT	BRD-K46317332	BRD-K46317332-003-04-6	MicroSource Discovery Systems Inc.	1502084		Cl	CCCC(C(=O)OCCN(CC)CC)(c1ccccc1)c1ccccc1.Cl	InChI=1S/C23H31NO2.ClH/c1-4-17-23(20-13-9-7-10-14-20,21-15-11-8-12-16-21)22(25)26-19-18-24(5-2)6-3;/h7-16H,4-6,17-19H2,1-3H3;1H	FHIKZROVIDCMJA-UHFFFAOYSA-N	353.235479242							92811, 92811
PSB 1115	LSM-3075	BRD-K49027941, PSB-1115	5311479	InChI=1S/C14H14N4O5S/c1-2-7-18-13(19)10-12(17-14(18)20)16-11(15-10)8-3-5-9(6-4-8)24(21,22)23/h3-6H,2,7H2,1H3,(H,15,16)(H,17,20)(H,21,22,23)	UYDRRQPGDSIMNU-UHFFFAOYSA-N	CCCN1C(=O)Nc2nc([nH]c2C1=O)c3ccc(cc3)S(=O)(=O)O	BroadT	BRD-K49027941	BRD-K49027941-237-01-1	Tocris Bioscience	2009	1	[K]	CCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(O)(=O)=O.[K]	InChI=1S/C14H14N4O5S.K.H/c1-2-7-18-13(19)10-12(17-14(18)20)16-11(15-10)8-3-5-9(6-4-8)24(21,22)23;;/h3-6H,2,7H2,1H3,(H,15,16)(H,17,20)(H,21,22,23);;	NCFRJDSFHNCRRA-UHFFFAOYSA-N	350.068490278							92848, 92848, 92848
E-Doxepin	LSM-42947	Doxepin, SID90341830, SID50111016, SID11113537	667477	InChI=1S/C19H21NO/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3/b17-11+	ODQWQRRAPPTVAG-GZTJUZNOSA-N	CN(C)CC\C=C\1/c2ccccc2COc3ccccc13	BroadT	BRD-K54462405	BRD-K54462405-003-03-3	Prestwick Chemical Inc.	Prestw-263	D0701-MP04-ST03-200-	Cl	CN(C)CC\C=C1/c2ccccc2COc2ccccc12.Cl	InChI=1S/C19H21NO.ClH/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19;/h3-6,8-12H,7,13-14H2,1-2H3;1H/b17-11+;	MHNSPTUQQIYJOT-SJDTYFKWSA-N	279.162314302							, 
TPCA-1	LSM-1136	BRD-K51575138, SID50112910	9903786	InChI=1S/C12H10FN3O2S/c13-7-3-1-6(2-4-7)9-5-8(10(14)17)11(19-9)16-12(15)18/h1-5H,(H2,14,17)(H3,15,16,18)	SAYGKHKXGCPTLX-UHFFFAOYSA-N	NC(=O)Nc1sc(cc1C(=O)N)c2ccc(F)cc2	BroadT	BRD-K51575138	BRD-K51575138-001-01-7	Tocris Bioscience	2559	2		NC(=O)Nc1sc(cc1C(N)=O)-c1ccc(F)cc1	InChI=1S/C12H10FN3O2S/c13-7-3-1-6(2-4-7)9-5-8(10(14)17)11(19-9)16-12(15)18/h1-5H,(H2,14,17)(H3,15,16,18)	SAYGKHKXGCPTLX-UHFFFAOYSA-N	279.04777548							91403
Irigenin, 7-benzyl ether	LSM-18989	Irigenin,7-Benzyl Ether, SID26749499	6063287	InChI=1S/C25H22O8/c1-29-19-10-15(9-17(26)24(19)30-2)16-13-33-18-11-20(32-12-14-7-5-4-6-8-14)25(31-3)23(28)21(18)22(16)27/h4-11,13,26,28H,12H2,1-3H3	WSKWDXWDFFVUKX-UHFFFAOYSA-N	COc1cc(cc(O)c1OC)C2=COc3cc(OCc4ccccc4)c(OC)c(O)c3C2=O	BroadT	BRD-K53634892	BRD-K53634892-001-02-4	MicroSource Discovery Systems Inc.	200763			COc1cc(cc(O)c1OC)-c1coc2cc(OCc3ccccc3)c(OC)c(O)c2c1=O	InChI=1S/C25H22O8/c1-29-19-10-15(9-17(26)24(19)30-2)16-13-33-18-11-20(32-12-14-7-5-4-6-8-14)25(31-3)23(28)21(18)22(16)27/h4-11,13,26,28H,12H2,1-3H3	WSKWDXWDFFVUKX-UHFFFAOYSA-N	450.131467664							107632
Atrazine	LSM-18990	Atrazine	2256	InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14)	MXWJVTOOROXGIU-UHFFFAOYSA-N	CCNc1nc(Cl)nc(NC(C)C)n1	BroadT	BRD-K45535217	BRD-K45535217-001-02-2	MicroSource Discovery Systems Inc.	330029			CCNc1nc(Cl)nc(NC(C)C)n1	InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14)	MXWJVTOOROXGIU-UHFFFAOYSA-N	215.093773208							15930
TMB8	LSM-18991	TMB 8, SID11110668, SID124879013, SID26755645	5494	InChI=1S/C22H37NO5/c1-6-23(7-2)14-12-10-8-9-11-13-15-28-22(24)18-16-19(25-3)21(27-5)20(17-18)26-4/h16-17H,6-15H2,1-5H3	IBQMHBGFMLHHLE-UHFFFAOYSA-N	CCN(CC)CCCCCCCCOC(=O)c1cc(OC)c(OC)c(OC)c1	BroadT	BRD-K58220566	BRD-K58220566-001-02-2	Biomol International Inc.	EI-110	2840(V2)-3-N1305		CCN(CC)CCCCCCCCOC(=O)c1cc(OC)c(OC)c(OC)c1	InChI=1S/C22H37NO5/c1-6-23(7-2)14-12-10-8-9-11-13-15-28-22(24)18-16-19(25-3)21(27-5)20(17-18)26-4/h16-17H,6-15H2,1-5H3	IBQMHBGFMLHHLE-UHFFFAOYSA-N	395.267173294							107633, 107633
NO-711	LSM-2939	NO 711, SID26752247, SID50104957, SID90340568, NNC-711	4515	InChI=1S/C21H22N2O3/c24-21(25)19-12-7-13-23(16-19)14-15-26-22-20(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-6,8-12H,7,13-16H2,(H,24,25)	NGNALWDRPKNJGR-UHFFFAOYSA-N	OC(=O)C1=CCCN(CCON=C(c2ccccc2)c3ccccc3)C1	BroadT	BRD-K42221274	BRD-K42221274-001-01-4	Biomol International Inc.	AC-985	2819-N1292		OC(=O)C1=CCCN(CCON=C(c2ccccc2)c2ccccc2)C1	InChI=1S/C21H22N2O3/c24-21(25)19-12-7-13-23(16-19)14-15-26-22-20(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-6,8-12H,7,13-16H2,(H,24,25)	NGNALWDRPKNJGR-UHFFFAOYSA-N	350.163042584							92744, 92744
PAC-1	LSM-3119	BRD-K50841342, SID50112924, SID90341778	6753378	InChI=1S/C23H28N4O2/c1-2-7-20-10-6-11-21(23(20)29)16-24-25-22(28)18-27-14-12-26(13-15-27)17-19-8-4-3-5-9-19/h2-6,8-11,16,29H,1,7,12-15,17-18H2,(H,25,28)/b24-16+	YQNRVGJCPCNMKT-LFVJCYFKSA-N	Oc1c(CC=C)cccc1\C=N\NC(=O)CN2CCN(Cc3ccccc3)CC2	BroadT	BRD-K50841342	BRD-K50841342-001-01-6	Tocris Bioscience	2581	1		Oc1c(CC=C)cccc1C=NNC(=O)CN1CCN(Cc2ccccc2)CC1	InChI=1S/C23H28N4O2/c1-2-7-20-10-6-11-21(23(20)29)16-24-25-22(28)18-27-14-12-26(13-15-27)17-19-8-4-3-5-9-19/h2-6,8-11,16,29H,1,7,12-15,17-18H2,(H,25,28)	YQNRVGJCPCNMKT-UHFFFAOYSA-N	392.221226176							
Alprostadil	LSM-42979	Edex, Caverject, Alprostadil, Prostin, Prostaglandin E1, PGE1, U-10136, Caverject Impulse, Prostin Vr Pediatric	5280723	InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h12-13,15-17,19,21,23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16+,17+,19+/m0/s1	GMVPRGQOIOIIMI-DWKJAMRDSA-N	CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O	BroadT	BRD-K52459643	BRD-K52459643-001-10-2	Tocris Bioscience	1620	1		CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(O)=O	InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h12-13,15-17,19,21,23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16+,17+,19+/m0/s1	GMVPRGQOIOIIMI-DWKJAMRDSA-N	354.240624188							15544
Diffractaic acid	LSM-18992	NSC-685595	94870	InChI=1S/C20H22O7/c1-9-8-14(11(3)17(21)15(9)19(22)23)27-20(24)16-10(2)7-13(25-5)12(4)18(16)26-6/h7-8,21H,1-6H3,(H,22,23)	MIJKZXWOOXIEEU-UHFFFAOYSA-N	COc1cc(C)c(C(=O)Oc2cc(C)c(C(=O)O)c(O)c2C)c(OC)c1C	BroadT	BRD-K51370144	BRD-K51370144-001-02-3	MicroSource Discovery Systems Inc.	1504118			COc1cc(C)c(C(=O)Oc2cc(C)c(C(O)=O)c(O)c2C)c(OC)c1C	InChI=1S/C20H22O7/c1-9-8-14(11(3)17(21)15(9)19(22)23)27-20(24)16-10(2)7-13(25-5)12(4)18(16)26-6/h7-8,21H,1-6H3,(H,22,23)	MIJKZXWOOXIEEU-UHFFFAOYSA-N	374.136553044							107634
Tyrphostin 51	LSM-43207	Tyrphostin-51, Tyrphostin 51	5328807	InChI=1S/C13H8N4O3/c14-4-8(12(17)9(5-15)6-16)1-7-2-10(18)13(20)11(19)3-7/h1-3,18-20H,17H2/b8-1+	JKNOYWVMHPMBEL-UNXLUWIOSA-N	NC(=C(C#N)C#N)\C(=C\c1cc(O)c(O)c(O)c1)\C#N	BroadT	BRD-K47943470	BRD-K47943470-001-02-8	Calbiochem	658410			NC(=C(C#N)C#N)C(\C#N)=C\c1cc(O)c(O)c(O)c1	InChI=1S/C13H8N4O3/c14-4-8(12(17)9(5-15)6-16)1-7-2-10(18)13(20)11(19)3-7/h1-3,18-20H,17H2/b8-1+	JKNOYWVMHPMBEL-UNXLUWIOSA-N	268.059640156							
Diethylcarbamazine	LSM-3009	Diethylcarbamazine, Hetrazan	3052	InChI=1S/C10H21N3O/c1-4-12(5-2)10(14)13-8-6-11(3)7-9-13/h4-9H2,1-3H3	RCKMWOKWVGPNJF-UHFFFAOYSA-N	CCN(CC)C(=O)N1CCN(C)CC1	BroadT	BRD-K45542189	BRD-K45542189-048-04-9	MicroSource Discovery Systems Inc.	1500242		OC(=O)CC(O)(CC(=O)O)C(=O)O	CCN(CC)C(=O)N1CCN(C)CC1.OC(=O)CC(O)(CC(=O)O)C(=O)O	InChI=1S/C10H21N3O.C6H8O7/c1-4-12(5-2)10(14)13-8-6-11(3)7-9-13;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-9H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)	PGNKBEARDDELNB-UHFFFAOYSA-N	199.168462322							4527, 4527
MDL 29951	LSM-3330		446916	InChI=1S/C12H9Cl2NO4/c13-5-3-7(14)10-6(1-2-9(16)17)11(12(18)19)15-8(10)4-5/h3-4,15H,1-2H2,(H,16,17)(H,18,19)	KNBSYZNKEAWABY-UHFFFAOYSA-N	OC(=O)CCc1c([nH]c2cc(Cl)cc(Cl)c12)C(=O)O	BroadT	BRD-K59753853	BRD-K59753853-001-01-5	Biomol International Inc.	AC-406	2817-N1277		OC(=O)CCc1c([nH]c2cc(Cl)cc(Cl)c12)C(O)=O	InChI=1S/C12H9Cl2NO4/c13-5-3-7(14)10-6(1-2-9(16)17)11(12(18)19)15-8(10)4-5/h3-4,15H,1-2H2,(H,16,17)(H,18,19)	KNBSYZNKEAWABY-UHFFFAOYSA-N	300.990863198							, , 
2-Mercaptobenzothiazole	LSM-18993	2-Mercaptobenzothioazole, 2-Mercaptobenzothiazole, Benzothiazole-2-Thiol, BRD-K55160477	697993	InChI=1S/C7H5NS2/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)	YXIWHUQXZSMYRE-UHFFFAOYSA-N	Sc1nc2ccccc2s1	BroadT	BRD-K55160477	BRD-K55160477-001-02-1	MicroSource Discovery Systems Inc.	1504225			Sc1nc2ccccc2s1	InChI=1S/C7H5NS2/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)	YXIWHUQXZSMYRE-UHFFFAOYSA-N	166.98634055							34292, 34292
Emodin	LSM-18994	Emodin	3220	InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3	RHMXXJGYXNZAPX-UHFFFAOYSA-N	Cc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1	BroadT	BRD-K58685305	BRD-K58685305-001-02-2	AnalytiCon Discovery GmbH	NP-001218			Cc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1	InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3	RHMXXJGYXNZAPX-UHFFFAOYSA-N	270.05282342							42223
Zimelidine (E-Isomer)	LSM-42965	Zimelidine, SID11110655, SID11114207, SID4254130	5458656	InChI=1S/C16H17BrN2/c1-19(2)11-9-16(14-4-3-10-18-12-14)13-5-7-15(17)8-6-13/h3-10,12H,11H2,1-2H3/b16-9+	OYPPVKRFBIWMSX-CXUHLZMHSA-N	CN(C)C\C=C(/c1ccc(Br)cc1)\c2cccnc2	BroadT	BRD-K47207162	BRD-K47207162-312-02-2	Prestwick Chemical Inc.	Prestw-92	D0701-MP04-ST03-200-	O.Cl.Cl	CN(C)C\C=C(/c1ccc(Br)cc1)c1cccnc1.O.Cl.Cl	InChI=1S/C16H17BrN2.2ClH.H2O/c1-19(2)11-9-16(14-4-3-10-18-12-14)13-5-7-15(17)8-6-13;;;/h3-10,12H,11H2,1-2H3;2*1H;1H2/b16-9+;;;	WFUAVXYXJOQWAZ-FCVRRRHYSA-N	316.057511164							, , 
Dipyrocetyl	LSM-18995	Dipyrocetyl, Diacetylsalicylic Acid	68093	InChI=1S/C11H10O6/c1-6(12)16-9-5-3-4-8(11(14)15)10(9)17-7(2)13/h3-5H,1-2H3,(H,14,15)	NYIZXMGNIUSNKL-UHFFFAOYSA-N	CC(=O)Oc1cccc(C(=O)O)c1OC(=O)C	BroadT	BRD-K47608922	BRD-K47608922-001-02-1	MicroSource Discovery Systems Inc.	1503032			CC(=O)Oc1cccc(C(O)=O)c1OC(C)=O	InChI=1S/C11H10O6/c1-6(12)16-9-5-3-4-8(11(14)15)10(9)17-7(2)13/h3-5H,1-2H3,(H,14,15)	NYIZXMGNIUSNKL-UHFFFAOYSA-N	238.04773804							107635
7-Methoxychromone	LSM-18996	7-Methoxy-4H-Chromen-4-one, BRD-K48213854, SID26749820	600605	InChI=1S/C10H8O3/c1-12-7-2-3-8-9(11)4-5-13-10(8)6-7/h2-6H,1H3	ZIPLCYUNFCYCCT-UHFFFAOYSA-N	COc1ccc2C(=O)C=COc2c1	BroadT	BRD-K48213854	BRD-K48213854-001-02-1	MicroSource Discovery Systems Inc.	211097			COc1ccc2c(c1)occc2=O	InChI=1S/C10H8O3/c1-12-7-2-3-8-9(11)4-5-13-10(8)6-7/h2-6H,1H3	ZIPLCYUNFCYCCT-UHFFFAOYSA-N	176.047344116							107636
Sulfisoxazole	LSM-3120	Sulfisoxazole, Sulfalar, Sulfafurazole, Sulphafurazole, Sulsoxin, Soxazole, Sosol, Pediazole, Neazolin, Eryzole, Entusil, Sulfafuraz OLE	5344	InChI=1S/C11H13N3O3S/c1-7-8(2)13-17-11(7)14-18(15,16)10-5-3-9(12)4-6-10/h3-6,14H,12H2,1-2H3	NHUHCSRWZMLRLA-UHFFFAOYSA-N	Cc1noc(NS(=O)(=O)c2ccc(N)cc2)c1C	BroadT	BRD-K50859149	BRD-K50859149-001-04-7	MicroSource Discovery Systems Inc.	1500555			Cc1noc(NS(=O)(=O)c2ccc(N)cc2)c1C	InChI=1S/C11H13N3O3S/c1-7-8(2)13-17-11(7)14-18(15,16)10-5-3-9(12)4-6-10/h3-6,14H,12H2,1-2H3	NHUHCSRWZMLRLA-UHFFFAOYSA-N	267.067761996							102484, 102484
RO 90-7501	LSM-3293	BRD-K58299615, GNF-PF-5510	824226	InChI=1S/C20H16N6/c21-13-4-1-11(2-5-13)19-23-15-7-3-12(9-17(15)25-19)20-24-16-8-6-14(22)10-18(16)26-20/h1-10H,21-22H2,(H,23,25)(H,24,26)	PAGZCEHLFCJSPV-UHFFFAOYSA-N	Nc1ccc(cc1)c2nc3ccc(cc3[nH]2)c4nc5ccc(N)cc5[nH]4	BroadT	BRD-K58299615	BRD-K58299615-001-02-7	Tocris Bioscience	2408	1		Nc1ccc(cc1)-c1nc2ccc(cc2[nH]1)-c1nc2ccc(N)cc2[nH]1	InChI=1S/C20H16N6/c21-13-4-1-11(2-5-13)19-23-15-7-3-12(9-17(15)25-19)20-24-16-8-6-14(22)10-18(16)26-20/h1-10H,21-22H2,(H,23,25)(H,24,26)	PAGZCEHLFCJSPV-UHFFFAOYSA-N	340.143644572							93018
Bezafibrate	LSM-3015	41859-67-0, Bezafibrate, BM 15.075	39042	InChI=1S/C19H20ClNO4/c1-19(2,18(23)24)25-16-9-3-13(4-10-16)11-12-21-17(22)14-5-7-15(20)8-6-14/h3-10H,11-12H2,1-2H3,(H,21,22)(H,23,24)	IIBYAHWJQTYFKB-UHFFFAOYSA-N	CC(C)(Oc1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1)C(=O)O	BroadT	BRD-K46018455	BRD-K46018455-001-06-0	Biomol International Inc.	GR-211	2840(V2)-3-N1305		CC(C)(Oc1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1)C(O)=O	InChI=1S/C19H20ClNO4/c1-19(2,18(23)24)25-16-9-3-13(4-10-16)11-12-21-17(22)14-5-7-15(20)8-6-14/h3-10H,11-12H2,1-2H3,(H,21,22)(H,23,24)	IIBYAHWJQTYFKB-UHFFFAOYSA-N	361.10808584							47612
Naringin	LSM-18997		6710627	InChI=1S/C27H32O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-7,10,16,18,20-30,32-36H,8-9H2,1H3/t10-,16-,18+,20-,21+,22+,23-,24+,25+,26-,27-/m0/s1	DFPMSGMNTNDNHN-KTEXIAFXSA-N	C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]2Oc3cc(O)c4C(=O)C[C@H](Oc4c3)c5ccc(O)cc5)[C@H](O)[C@H](O)[C@H]1O	BroadT	BRD-K56759808	BRD-K56759808-001-02-9	MicroSource Discovery Systems Inc.	1500765			C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]2Oc2cc(O)c3C(=O)C[C@H](Oc3c2)c2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1O	InChI=1S/C27H32O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-7,10,16,18,20-30,32-36H,8-9H2,1H3/t10-,16-,18+,20-,21+,22+,23-,24+,25+,26-,27-/m0/s1	DFPMSGMNTNDNHN-KTEXIAFXSA-N	580.179205704							107637
Alfadolone Acetate	LSM-3146	SID56463549	24733	InChI=1S/C23H34O5/c1-13(24)28-12-20(27)18-7-6-17-16-5-4-14-10-15(25)8-9-22(14,2)21(16)19(26)11-23(17,18)3/h14-18,21,25H,4-12H2,1-3H3/t14-,15+,16-,17-,18+,21+,22-,23-/m0/s1	QRJOQYLXZPQQMX-FWROMSNXSA-N	CC(=O)OCC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3C(=O)C[C@]12C	BroadT	BRD-K51751936	BRD-K51751936-001-03-4	Prestwick Chemical Inc.	Prestw-1001	D0701-MP04-ST03-200-		CC(=O)OCC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3C(=O)C[C@]12C	InChI=1S/C23H34O5/c1-13(24)28-12-20(27)18-7-6-17-16-5-4-14-10-15(25)8-9-22(14,2)21(16)19(26)11-23(17,18)3/h14-18,21,25H,4-12H2,1-3H3/t14-,15+,16-,17-,18+,21+,22-,23-/m0/s1	QRJOQYLXZPQQMX-FWROMSNXSA-N	390.240624188							92901
Ozagrel	LSM-42902	Ozagrel, Ozagrel Sodium	5282440	InChI=1S/C13H12N2O2/c16-13(17)6-5-11-1-3-12(4-2-11)9-15-8-7-14-10-15/h1-8,10H,9H2,(H,16,17)/b6-5+	SHZKQBHERIJWAO-AATRIKPKSA-N	OC(=O)\C=C\c1ccc(Cn2ccnc2)cc1	BroadT	BRD-K53061490	BRD-K53061490-003-03-0	Prestwick Chemical Inc.	Prestw-979	D0701-MP04-ST03-200-	Cl	OC(=O)\C=C\c1ccc(Cn2ccnc2)cc1.Cl	InChI=1S/C13H12N2O2.ClH/c16-13(17)6-5-11-1-3-12(4-2-11)9-15-8-7-14-10-15;/h1-8,10H,9H2,(H,16,17);1H/b6-5+;	CWKFWBJJNNPGAM-IPZCTEOASA-N	228.089877644							, , 
TAS-301	LSM-3234	TAS 301, SID29217672	9885087	InChI=1S/C23H19NO3/c1-26-17-11-7-15(8-12-17)21(16-9-13-18(27-2)14-10-16)22-19-5-3-4-6-20(19)24-23(22)25/h3-14H,1-2H3,(H,24,25)	KUEYYIJXBRWZIB-UHFFFAOYSA-N	COc1ccc(cc1)C(=C2C(=O)Nc3ccccc23)c4ccc(OC)cc4	BroadT	BRD-K55454768	BRD-K55454768-001-01-8	EMD Biosciences	608050			COc1ccc(cc1)C(=C1C(=O)Nc2ccccc12)c1ccc(OC)cc1	InChI=1S/C23H19NO3/c1-26-17-11-7-15(8-12-17)21(16-9-13-18(27-2)14-10-16)22-19-5-3-4-6-20(19)24-23(22)25/h3-14H,1-2H3,(H,24,25)	KUEYYIJXBRWZIB-UHFFFAOYSA-N	357.136493478							92970
CFM-2	LSM-18998	1-(4-Aminophenyl)-3,5-Dihydro-7,8-Dimethoxy-4H-2,3-Benzodiazepin-4-one, SID11113904, SID26752063	4377504	InChI=1S/C17H17N3O3/c1-22-14-7-11-8-16(21)19-20-17(13(11)9-15(14)23-2)10-3-5-12(18)6-4-10/h3-7,9H,8,18H2,1-2H3,(H,19,21)	MJKADKZSYQWGLL-UHFFFAOYSA-N	COc1cc2CC(=O)NN=C(c3ccc(N)cc3)c2cc1OC	BroadT	BRD-K42859542	BRD-K42859542-001-01-7	Biomol International Inc.	EA-145	2817-N1277		COc1cc2CC(=O)NN=C(c3ccc(N)cc3)c2cc1OC	InChI=1S/C17H17N3O3/c1-22-14-7-11-8-16(21)19-20-17(13(11)9-15(14)23-2)10-3-5-12(18)6-4-10/h3-7,9H,8,18H2,1-2H3,(H,19,21)	MJKADKZSYQWGLL-UHFFFAOYSA-N	311.126991434							107638
Oxolamine	LSM-5538	Oxolamine, Oxalamine, SKF-9976, AF-438	13738	InChI=1S/C14H19N3O/c1-3-17(4-2)11-10-13-15-14(16-18-13)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3	IDCHQQSVJAAUQQ-UHFFFAOYSA-N	CCN(CC)CCc1onc(n1)c2ccccc2	BroadT	BRD-K42596464	BRD-K42596464-048-03-6	Prestwick Chemical Inc.	Prestw-826	D0701-MP04-ST03-200-	OC(=O)CC(O)(CC(=O)O)C(=O)O	CCN(CC)CCc1nc(no1)-c1ccccc1.OC(=O)CC(O)(CC(=O)O)C(=O)O	InChI=1S/C14H19N3O.C6H8O7/c1-3-17(4-2)11-10-13-15-14(16-18-13)12-8-6-5-7-9-12;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-9H,3-4,10-11H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)	RBZIGQJSMCOHSS-UHFFFAOYSA-N	245.152812258							94607, 94607
Gangaleoidin	LSM-18999	SID26749476	4565183	InChI=1S/C18H14Cl2O7/c1-6-11-16(13(20)14(21)12(6)19)27-15-7(2)10(17(22)25-4)8(24-3)5-9(15)26-18(11)23/h5,21H,1-4H3	RPHAAJGBADUATP-UHFFFAOYSA-N	COC(=O)c1c(C)c2Oc3c(Cl)c(O)c(Cl)c(C)c3C(=O)Oc2cc1OC	BroadT	BRD-K41603276	BRD-K41603276-001-02-0	MicroSource Discovery Systems Inc.	200035			COC(=O)c1c(OC)cc2OC(=O)c3c(C)c(Cl)c(O)c(Cl)c3Oc2c1C	InChI=1S/C18H14Cl2O7/c1-6-11-16(13(20)14(21)12(6)19)27-15-7(2)10(17(22)25-4)8(24-3)5-9(15)26-18(11)23/h5,21H,1-4H3	RPHAAJGBADUATP-UHFFFAOYSA-N	412.011658208							107639
3,4,5,6-Tetrabromofluorescein	LSM-3327	BRD-K59637651	275510	InChI=1S/C20H8Br4O5/c21-16-14(15(20(27)28)17(22)19(24)18(16)23)13-9-3-1-7(25)5-11(9)29-12-6-8(26)2-4-10(12)13/h1-6,25H,(H,27,28)	MQGBYISSPZLIEZ-UHFFFAOYSA-N	OC(=O)c1c(Br)c(Br)c(Br)c(Br)c1C2=C3C=CC(=O)C=C3Oc4cc(O)ccc24	BroadT	BRD-K59637651	BRD-K59637651-001-01-4	Calbiochem	539690			OC(=O)c1c(Br)c(Br)c(Br)c(Br)c1-c1c2ccc(O)cc2oc2cc(=O)ccc12	InChI=1S/C20H8Br4O5/c21-16-14(15(20(27)28)17(22)19(24)18(16)23)13-9-3-1-7(25)5-11(9)29-12-6-8(26)2-4-10(12)13/h1-6,25H,(H,27,28)	MQGBYISSPZLIEZ-UHFFFAOYSA-N	643.710523756							93045
Formononetin	LSM-19000	NSC-93360	5280378	InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)14-9-20-15-8-11(17)4-7-13(15)16(14)18/h2-9,17H,1H3	HKQYGTCOTHHOMP-UHFFFAOYSA-N	COc1ccc(cc1)C2=COc3cc(O)ccc3C2=O	BroadT	BRD-K55567017	BRD-K55567017-001-02-4	MicroSource Discovery Systems Inc.	102007			COc1ccc(cc1)-c1coc2cc(O)ccc2c1=O	InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)14-9-20-15-8-11(17)4-7-13(15)16(14)18/h2-9,17H,1H3	HKQYGTCOTHHOMP-UHFFFAOYSA-N	268.073558864							18088
Phenytoin	LSM-5663		1775	InChI=1S/C15H12N2O2/c18-13-15(17-14(19)16-13,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,16,17,18,19)	CXOFVDLJLONNDW-UHFFFAOYSA-N	O=C1NC(=O)C(N1)(c2ccccc2)c3ccccc3	BroadT	BRD-K55930204	BRD-K55930204-001-02-7	Biomol International Inc.	AC-125	2840(V2)-3-N1305		O=C1NC(=O)C(N1)(c1ccccc1)c1ccccc1	InChI=1S/C15H12N2O2/c18-13-15(17-14(19)16-13,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,16,17,18,19)	CXOFVDLJLONNDW-UHFFFAOYSA-N	252.089877644							8107, 8107, 8107, 8107
RS-67333	LSM-3018	RS 67333, RS-67333	183782	InChI=1S/C19H29ClN2O2/c1-3-4-9-22-10-7-14(8-11-22)5-6-18(23)15-12-16(20)17(21)13-19(15)24-2/h12-14H,3-11,21H2,1-2H3	JBHLYIVFFLNISJ-UHFFFAOYSA-N	CCCCN1CCC(CCC(=O)c2cc(Cl)c(N)cc2OC)CC1	BroadT	BRD-K46142322	BRD-K46142322-003-01-6	Tocris Bioscience	989	3	Cl	CCCCN1CCC(CCC(=O)c2cc(Cl)c(N)cc2OC)CC1.Cl	InChI=1S/C19H29ClN2O2.ClH/c1-3-4-9-22-10-7-14(8-11-22)5-6-18(23)15-12-16(20)17(21)13-19(15)24-2;/h12-14H,3-11,21H2,1-2H3;1H	XVBGLZNYWUUAFF-UHFFFAOYSA-N	352.191755898							92807
Ketanserin	LSM-3092	Ketanserin, R-41468	3822	InChI=1S/C22H22FN3O3/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29/h1-8,16H,9-14H2,(H,24,29)	FPCCSQOGAWCVBH-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)C2CCN(CCN3C(=O)Nc4ccccc4C3=O)CC2	BroadT	BRD-K49671696	BRD-K49671696-001-02-1	Biomol International Inc.	NS-515	2813-N1283		Fc1ccc(cc1)C(=O)C1CCN(CCn2c(=O)[nH]c3ccccc3c2=O)CC1	InChI=1S/C22H22FN3O3/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29/h1-8,16H,9-14H2,(H,24,29)	FPCCSQOGAWCVBH-UHFFFAOYSA-N	395.164519794							6123, 6123, 6123, 6123, 6123
Ritodrine	LSM-3138	Ritodrine, DU-21220	33572	InChI=1S/C17H21NO3/c1-12(17(21)14-4-8-16(20)9-5-14)18-11-10-13-2-6-15(19)7-3-13/h2-9,12,17-21H,10-11H2,1H3/t12-,17-/m0/s1	IOVGROKTTNBUGK-SJCJKPOMSA-N	C[C@H](NCCc1ccc(O)cc1)[C@H](O)c2ccc(O)cc2	BroadT	BRD-K51465424	BRD-K51465424-003-03-6	Prestwick Chemical Inc.	Prestw-349	D0701-MP04-ST03-200-	Cl	C[C@H](NCCc1ccc(O)cc1)[C@H](O)c1ccc(O)cc1.Cl	InChI=1S/C17H21NO3.ClH/c1-12(17(21)14-4-8-16(20)9-5-14)18-11-10-13-2-6-15(19)7-3-13;/h2-9,12,17-21H,10-11H2,1H3;1H/t12-,17-;/m0./s1	IDLSITKDRVDKRV-XHXSRVRCSA-N	287.152143542							8872, 8872
Flunisolide	LSM-3089	Aerobid, Aerospan, Flunisolide, Nasalide, Nasarel, RS-3999, Aerospan HFA	82153	InChI=1S/C24H31FO6/c1-21(2)30-19-9-14-13-8-16(25)15-7-12(27)5-6-22(15,3)20(13)17(28)10-23(14,4)24(19,31-21)18(29)11-26/h5-7,13-14,16-17,19-20,26,28H,8-11H2,1-4H3/t13-,14-,16-,17-,19+,20+,22-,23-,24+/m0/s1	XSFJVAJPIHIPKU-XWCQMRHXSA-N	CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO	BroadT	BRD-K49577446	BRD-K49577446-001-03-1	Prestwick Chemical Inc.	Prestw-643	D0701-MP04-ST03-200-		CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO	InChI=1S/C24H31FO6/c1-21(2)30-19-9-14-13-8-16(25)15-7-12(27)5-6-22(15,3)20(13)17(28)10-23(14,4)24(19,31-21)18(29)11-26/h5-7,13-14,16-17,19-20,26,28H,8-11H2,1-4H3/t13-,14-,16-,17-,19+,20+,22-,23-,24+/m0/s1	XSFJVAJPIHIPKU-XWCQMRHXSA-N	434.210466912							5106
Lidocaine	LSM-3165	Lidocaine, Lidocaton, Lidoderm, Lidopen, Lignocaine, Lignostab, Iontocaine, Embolex, Dentipatch, Anestacon, Alphacaine, Octocaine, Xylocaine, Lignocaine HCl	3676	InChI=1S/C14H22N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)	NNJVILVZKWQKPM-UHFFFAOYSA-N	CCN(CC)CC(=O)Nc1c(C)cccc1C	BroadT	BRD-K52662033	BRD-K52662033-001-02-6	Biomol International Inc.	AC-128	2840(V2)-3-N1305		CCN(CC)CC(=O)Nc1c(C)cccc1C	InChI=1S/C14H22N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)	NNJVILVZKWQKPM-UHFFFAOYSA-N	234.173213344							6456, 6456, 6456, 6456
CHEMBL279841	LSM-19001	1-(2-Methoxyphenyl)-4-(4-Succinimidobutyl)Piperazine, SID11113800	3994476	InChI=1S/C19H27N3O3/c1-25-17-7-3-2-6-16(17)21-14-12-20(13-15-21)10-4-5-11-22-18(23)8-9-19(22)24/h2-3,6-7H,4-5,8-15H2,1H3	MQHOGPLXAXSQAJ-UHFFFAOYSA-N	COc1ccccc1N2CCN(CCCCN3C(=O)CCC3=O)CC2	BroadT	BRD-K50293352	BRD-K50293352-001-01-7	Biomol International Inc.	AC-540	2813-N1283		COc1ccccc1N1CCN(CCCCN2C(=O)CCC2=O)CC1	InChI=1S/C19H27N3O3/c1-25-17-7-3-2-6-16(17)21-14-12-20(13-15-21)10-4-5-11-22-18(23)8-9-19(22)24/h2-3,6-7H,4-5,8-15H2,1H3	MQHOGPLXAXSQAJ-UHFFFAOYSA-N	345.205241754							107640
Metyrapone	LSM-3035	Metopirone, Metyrapone	4174	InChI=1S/C14H14N2O/c1-14(2,12-6-4-8-16-10-12)13(17)11-5-3-7-15-9-11/h3-10H,1-2H3	FJLBFSROUSIWMA-UHFFFAOYSA-N	CC(C)(C(=O)c1cccnc1)c2cccnc2	BroadT	BRD-K46862739	BRD-K46862739-001-03-6	Prestwick Chemical Inc.	Prestw-904	D0701-MP04-ST03-200-		CC(C)(C(=O)c1cccnc1)c1cccnc1	InChI=1S/C14H14N2O/c1-14(2,12-6-4-8-16-10-12)13(17)11-5-3-7-15-9-11/h3-10H,1-2H3	FJLBFSROUSIWMA-UHFFFAOYSA-N	226.110613088							44241, 44241
Arachidonoyl Glycine	LSM-42976	BRD-K51557114, N-Arachidonylglycine, N-Arachidonoylglycine, N-Arachidonyl Glycine, Arachidonoyl Glycine	5283389	InChI=1S/C22H35NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(24)23-20-22(25)26/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-20H2,1H3,(H,23,24)(H,25,26)/b7-6-,10-9-,13-12-,16-15-	YLEARPUNMCCKMP-DOFZRALJSA-N	CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCC(=O)O	BroadT	BRD-K51557114	BRD-K51557114-001-02-1	Biomol International Inc.	FA-029	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCC(O)=O	InChI=1S/C22H35NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(24)23-20-22(25)26/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-20H2,1H3,(H,23,24)(H,25,26)/b7-6-,10-9-,13-12-,16-15-	YLEARPUNMCCKMP-DOFZRALJSA-N	361.26169399							58961
Amperozide	LSM-3159	Amperozide, BRD-K52397688	73333	InChI=1S/C23H29F2N3O/c1-2-26-23(29)28-16-14-27(15-17-28)13-3-4-22(18-5-9-20(24)10-6-18)19-7-11-21(25)12-8-19/h5-12,22H,2-4,13-17H2,1H3,(H,26,29)	NNAIYOXJNVGUOM-UHFFFAOYSA-N	CCNC(=O)N1CCN(CCCC(c2ccc(F)cc2)c3ccc(F)cc3)CC1	BroadT	BRD-K52397688	BRD-K52397688-001-01-9	Biomol International Inc.	AC-1367	2813-N1283		CCNC(=O)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1	InChI=1S/C23H29F2N3O/c1-2-26-23(29)28-16-14-27(15-17-28)13-3-4-22(18-5-9-20(24)10-6-18)19-7-11-21(25)12-8-19/h5-12,22H,2-4,13-17H2,1H3,(H,26,29)	NNAIYOXJNVGUOM-UHFFFAOYSA-N	401.227868978							92913, 92913, 92913
Fluocinonide	LSM-19002	Fluocinolide, Fluocinonide, Lidex, Vanos, Fluocinonide Emulsified Base, Lidex-E	9642	InChI=1S/C26H32F2O7/c1-13(29)33-12-20(32)26-21(34-22(2,3)35-26)10-15-16-9-18(27)17-8-14(30)6-7-23(17,4)25(16,28)19(31)11-24(15,26)5/h6-8,15-16,18-19,21,31H,9-12H2,1-5H3/t15-,16-,18-,19-,21+,23-,24-,25-,26+/m0/s1	WJOHZNCJWYWUJD-IUGZLZTKSA-N	CC(=O)OCC(=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]23C	BroadT	BRD-K57886322	BRD-K57886322-001-03-4	Prestwick Chemical Inc.	Prestw-774	D0701-MP04-ST03-200-		CC(=O)OCC(=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]1[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]21C	InChI=1S/C26H32F2O7/c1-13(29)33-12-20(32)26-21(34-22(2,3)35-26)10-15-16-9-18(27)17-8-14(30)6-7-23(17,4)25(16,28)19(31)11-24(15,26)5/h6-8,15-16,18-19,21,31H,9-12H2,1-5H3/t15-,16-,18-,19-,21+,23-,24-,25-,26+/m0/s1	WJOHZNCJWYWUJD-IUGZLZTKSA-N	494.211609764							
7-Chloroethyltheophylline	LSM-19003	7-(Chloroethyl)Theophylline, SID24824050	1882	InChI=1S/C9H11ClN4O2/c1-12-7-6(8(15)13(2)9(12)16)14(4-3-10)5-11-7/h5H,3-4H2,1-2H3	QCIARNIKNKKHFH-UHFFFAOYSA-N	CN1C(=O)N(C)c2ncn(CCCl)c2C1=O	BroadT	BRD-K52592505	BRD-K52592505-001-02-4	MicroSource Discovery Systems Inc.	2300318			Cn1c2ncn(CCCl)c2c(=O)n(C)c1=O	InChI=1S/C9H11ClN4O2/c1-12-7-6(8(15)13(2)9(12)16)14(4-3-10)5-11-7/h5H,3-4H2,1-2H3	QCIARNIKNKKHFH-UHFFFAOYSA-N	242.057053342							107641
Tyrphostin 8	LSM-19004	2-(4-Hydroxybenzylidene)Malononitrile, Tyrphostin-8	92970	InChI=1S/C10H6N2O/c11-6-9(7-12)5-8-1-3-10(13)4-2-8/h1-5,13H	FNCOVSWSZZVFBQ-UHFFFAOYSA-N	Oc1ccc(C=C(C#N)C#N)cc1	BroadT	BRD-K50212643	BRD-K50212643-001-03-2	Biomol International Inc.	PR-113	2840(V2)-3-N1305		Oc1ccc(C=C(C#N)C#N)cc1	InChI=1S/C10H6N2O/c11-6-9(7-12)5-8-1-3-10(13)4-2-8/h1-5,13H	FNCOVSWSZZVFBQ-UHFFFAOYSA-N	170.048012832							107642
Calcimycin	LSM-19005	Calcimycin, BRD-K41431477	11957499	InChI=1S/C29H37N3O6/c1-15-10-11-29(17(3)13-16(2)27(38-29)18(4)26(33)20-7-6-12-31-20)37-22(15)14-23-32-25-21(36-23)9-8-19(30-5)24(25)28(34)35/h6-9,12,15-18,22,27,30-31H,10-11,13-14H2,1-5H3,(H,34,35)/t15-,16-,17-,18-,22-,27+,29+/m1/s1	HIYAVKIYRIFSCZ-CYEMHPAKSA-N	CNc1ccc2oc(C[C@H]3O[C@@]4(CC[C@H]3C)O[C@H]([C@H](C)C(=O)c5ccc[nH]5)[C@H](C)C[C@H]4C)nc2c1C(=O)O	BroadT	BRD-K41431477	BRD-K41431477-001-05-6	Tocris Bioscience	1234	2		CNc1ccc2oc(C[C@H]3O[C@@]4(CC[C@H]3C)O[C@H]([C@H](C)C(=O)c3ccc[nH]3)[C@H](C)C[C@H]4C)nc2c1C(O)=O	InChI=1S/C29H37N3O6/c1-15-10-11-29(17(3)13-16(2)27(38-29)18(4)26(33)20-7-6-12-31-20)37-22(15)14-23-32-25-21(36-23)9-8-19(30-5)24(25)28(34)35/h6-9,12,15-18,22,27,30-31H,10-11,13-14H2,1-5H3,(H,34,35)/t15-,16-,17-,18-,22-,27+,29+/m1/s1	HIYAVKIYRIFSCZ-CYEMHPAKSA-N	523.268235934							107643
Z-Pro-Prolinal	LSM-3340	JTP-4819, Z-Prolyl-Prolinal	122623	InChI=1S/C18H22N2O4/c21-12-15-8-4-10-19(15)17(22)16-9-5-11-20(16)18(23)24-13-14-6-2-1-3-7-14/h1-3,6-7,12,15-16H,4-5,8-11,13H2/t15-,16-/m0/s1	ORZXYSPOAVJYRU-HOTGVXAUSA-N	O=C[C@@H]1CCCN1C(=O)[C@@H]2CCCN2C(=O)OCc3ccccc3	BroadT	BRD-K60174629	BRD-K60174629-001-02-2	Biomol International Inc.	PI-112	2840(V2)-3-N1305		O=C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	InChI=1S/C18H22N2O4/c21-12-15-8-4-10-19(15)17(22)16-9-5-11-20(16)18(23)24-13-14-6-2-1-3-7-14/h1-3,6-7,12,15-16H,4-5,8-11,13H2/t15-,16-/m0/s1	ORZXYSPOAVJYRU-HOTGVXAUSA-N	330.157957204							
Y-27632	LSM-44936	Y27632, Y-27632, GNF-5837		InChI=1S/C14H21N3O/c1-10(15)11-2-4-12(5-3-11)14(18)17-13-6-8-16-9-7-13/h6-12H,2-5,15H2,1H3,(H,16,17,18)/t10-,11-,12-/m1/s1	IYOZTVGMEWJPKR-IJLUTSLNSA-N	C[C@@H](N)[C@@H]1CC[C@H](CC1)C(=O)Nc2ccncc2	BroadT	BRD-K44084986	BRD-K44084986-001-03-9	Biomol International Inc.	EI-299	2840(V2)-3-N1305		C[C@@H](N)[C@H]1CC[C@@H](CC1)C(=O)Nc1ccncc1	InChI=1S/C14H21N3O/c1-10(15)11-2-4-12(5-3-11)14(18)17-13-6-8-16-9-7-13/h6-12H,2-5,15H2,1H3,(H,16,17,18)/t10-,11-,12-/m1/s1	IYOZTVGMEWJPKR-IJLUTSLNSA-N	247.168462322							75393, 75393
Phenacemide	LSM-19006	Phenurone, Phenacemide	4753	InChI=1S/C9H10N2O2/c10-9(13)11-8(12)6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,10,11,12,13)	XPFRXWCVYUEORT-UHFFFAOYSA-N	NC(=O)NC(=O)Cc1ccccc1	BroadT	BRD-K40905133	BRD-K40905133-001-02-3	MicroSource Discovery Systems Inc.	1500472			NC(=O)NC(=O)Cc1ccccc1	InChI=1S/C9H10N2O2/c10-9(13)11-8(12)6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,10,11,12,13)	XPFRXWCVYUEORT-UHFFFAOYSA-N	178.07422758							8049
C2-Ceramide	LSM-42957	Ceramide, C2 CERAMIDE, N-Acetylspingosine	5497136	InChI=1S/C20H39NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(24)19(17-22)21-18(2)23/h15-16,19-20,22,24H,3-14,17H2,1-2H3,(H,21,23)/b16-15+/t19-,20+/m0/s1	BLTCBVOJNNKFKC-QUDYQQOWSA-N	CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](CO)NC(=O)C	BroadT	BRD-K41707108	BRD-K41707108-001-02-3	EMD Biosciences	110145			CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](CO)NC(C)=O	InChI=1S/C20H39NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(24)19(17-22)21-18(2)23/h15-16,19-20,22,24H,3-14,17H2,1-2H3,(H,21,23)/b16-15+/t19-,20+/m0/s1	BLTCBVOJNNKFKC-QUDYQQOWSA-N	341.292994118							46979
316173-57-6	LSM-3027	BRD-K46469693, SCH-442416	10668061	InChI=1S/C20H19N7O2/c1-28-14-8-6-13(7-9-14)4-2-10-26-18-15(12-22-26)19-23-17(16-5-3-11-29-16)25-27(19)20(21)24-18/h3,5-9,11-12H,2,4,10H2,1H3,(H2,21,24)	AEULVFLPCJOBCE-UHFFFAOYSA-N	COc1ccc(CCCn2ncc3c2nc(N)n4nc(nc34)c5occc5)cc1	BroadT	BRD-K46469693	BRD-K46469693-001-01-8	Tocris Bioscience	2463	1		COc1ccc(CCCn2ncc3c2nc(N)n2nc(nc32)-c2ccco2)cc1	InChI=1S/C20H19N7O2/c1-28-14-8-6-13(7-9-14)4-2-10-26-18-15(12-22-26)19-23-17(16-5-3-11-29-16)25-27(19)20(21)24-18/h3,5-9,11-12H,2,4,10H2,1H3,(H2,21,24)	AEULVFLPCJOBCE-UHFFFAOYSA-N	389.160022918							92814, 92814
Pravastatin	LSM-3347	Pravastatin, Pravachol, BRD-K60511616	54687	InChI=1S/C23H36O7/c1-4-13(2)23(29)30-20-11-17(25)9-15-6-5-14(3)19(22(15)20)8-7-16(24)10-18(26)12-21(27)28/h5-6,9,13-14,16-20,22,24-26H,4,7-8,10-12H2,1-3H3,(H,27,28)/t13-,14-,16+,17+,18+,19-,20-,22-/m0/s1	TUZYXOIXSAXUGO-PZAWKZKUSA-N	CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(=O)O)[C@@H]12	BroadT	BRD-K60511616	BRD-K60511616-236-01-4	Tocris Bioscience	2318	1	[Na]	CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(O)=O)[C@@H]12.[Na]	InChI=1S/C23H36O7.Na.H/c1-4-13(2)23(29)30-20-11-17(25)9-15-6-5-14(3)19(22(15)20)8-7-16(24)10-18(26)12-21(27)28;;/h5-6,9,13-14,16-20,22,24-26H,4,7-8,10-12H2,1-3H3,(H,27,28);;/t13-,14-,16+,17+,18+,19-,20-,22-;;/m0../s1	AOGODJAJIRDKOP-HLQZVYNXSA-N	424.246103492							63618, 63618
Myricetin	LSM-2957	NSC-407290	5281672	InChI=1S/C15H10O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,16-20,22H	IKMDFBPHZNJCSN-UHFFFAOYSA-N	OC1=C(Oc2cc(O)cc(O)c2C1=O)c3cc(O)c(O)c(O)c3	BroadT	BRD-K43149758	BRD-K43149758-001-04-5	Prestwick Chemical Inc.	Prestw-465	D0701-MP04-ST03-200-		Oc1cc(O)c2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O	InChI=1S/C15H10O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,16-20,22H	IKMDFBPHZNJCSN-UHFFFAOYSA-N	318.03756728							18152
QX314	LSM-3262	QX 314, SID11111386, SID11113855, SID124880583, QX-314	3925	InChI=1S/C16H26N2O/c1-6-18(7-2,8-3)12-15(19)17-16-13(4)10-9-11-14(16)5/h9-11H,6-8,12H2,1-5H3/p+1	PYEBKOFMWAMBFV-UHFFFAOYSA-O	CC[N+](CC)(CC)CC(=O)Nc1c(C)cccc1C	BroadT	BRD-K56596464	BRD-K56596464-004-02-4	Biomol International Inc.	NA-134	2840(V2)-3-N1305	Br	CC[N+](CC)(CC)CC(=O)Nc1c(C)cccc1C.Br	InChI=1S/C16H26N2O.BrH/c1-6-18(7-2,8-3)12-15(19)17-16-13(4)10-9-11-14(16)5;/h9-11H,6-8,12H2,1-5H3;1H/p+1	DLHMKHREUTXMCH-UHFFFAOYSA-O	263.212338504							46937, 46937, 46937
Medrysone	LSM-3259	Medrysone, Hydroxymesterone, U-8471	247839	InChI=1S/C22H32O3/c1-12-9-15-17-6-5-16(13(2)23)22(17,4)11-19(25)20(15)21(3)8-7-14(24)10-18(12)21/h10,12,15-17,19-20,25H,5-9,11H2,1-4H3/t12-,15-,16+,17-,19-,20+,21-,22+/m0/s1	GZENKSODFLBBHQ-ILSZZQPISA-N	C[C@H]1C[C@H]2[C@@H]3CC[C@H](C(=O)C)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]4(C)CCC(=O)C=C14	BroadT	BRD-K56515112	BRD-K56515112-001-03-4	Prestwick Chemical Inc.	Prestw-743	D0701-MP04-ST03-200-		C[C@H]1C[C@H]2[C@@H]3CC[C@H](C(C)=O)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)CCC(=O)C=C12	InChI=1S/C22H32O3/c1-12-9-15-17-6-5-16(13(2)23)22(17,4)11-19(25)20(15)21(3)8-7-14(24)10-18(12)21/h10,12,15-17,19-20,25H,5-9,11H2,1-4H3/t12-,15-,16+,17-,19-,20+,21-,22+/m0/s1	GZENKSODFLBBHQ-ILSZZQPISA-N	344.235144884							34829
SB 218795	LSM-3357	BRD-K61097567, SB-218795	6604858	InChI=1S/C25H20N2O3/c1-30-25(29)23(18-12-6-3-7-13-18)27-24(28)20-16-22(17-10-4-2-5-11-17)26-21-15-9-8-14-19(20)21/h2-16,23H,1H3,(H,27,28)/t23-/m1/s1	IUMQXQJZIHWLIN-HSZRJFAPSA-N	COC(=O)[C@H](NC(=O)c1cc(nc2ccccc12)c3ccccc3)c4ccccc4	BroadT	BRD-K61097567	BRD-K61097567-001-03-6	Tocris Bioscience	1376	1		COC(=O)[C@H](NC(=O)c1cc(nc2ccccc12)-c1ccccc1)c1ccccc1	InChI=1S/C25H20N2O3/c1-30-25(29)23(18-12-6-3-7-13-18)27-24(28)20-16-22(17-10-4-2-5-11-17)26-21-15-9-8-14-19(20)21/h2-16,23H,1H3,(H,27,28)/t23-/m1/s1	IUMQXQJZIHWLIN-HSZRJFAPSA-N	396.14739252							93066
Ritanserin	LSM-2906	Ritanserin, Tiserton, R-55667	5074	InChI=1S/C27H25F2N3OS/c1-18-24(26(33)32-16-17-34-27(32)30-18)12-15-31-13-10-21(11-14-31)25(19-2-6-22(28)7-3-19)20-4-8-23(29)9-5-20/h2-9,16-17H,10-15H2,1H3	JUQLTPCYUFPYKE-UHFFFAOYSA-N	CC1=C(CCN2CCC(=C(c3ccc(F)cc3)c4ccc(F)cc4)CC2)C(=O)N5C=CSC5=N1	BroadT	BRD-K40887525	BRD-K40887525-001-02-9	MicroSource Discovery Systems Inc.	1503421			Cc1nc2sccn2c(=O)c1CCN1CCC(CC1)=C(c1ccc(F)cc1)c1ccc(F)cc1	InChI=1S/C27H25F2N3OS/c1-18-24(26(33)32-16-17-34-27(32)30-18)12-15-31-13-10-21(11-14-31)25(19-2-6-22(28)7-3-19)20-4-8-23(29)9-5-20/h2-9,16-17H,10-15H2,1H3	JUQLTPCYUFPYKE-UHFFFAOYSA-N	477.16863954							64195
Dorsomorphin	LSM-3207	Dorsomorphin, BRD-K54233340	11524144	InChI=1S/C24H25N5O/c1-2-12-28(13-3-1)14-15-30-22-6-4-19(5-7-22)21-16-26-24-23(17-27-29(24)18-21)20-8-10-25-11-9-20/h4-11,16-18H,1-3,12-15H2	XHBVYDAKJHETMP-UHFFFAOYSA-N	C(CN1CCCCC1)Oc2ccc(cc2)c3cnc4c(cnn4c3)c5ccncc5	BroadT	BRD-K54233340	BRD-K54233340-300-01-0	Tocris Bioscience	3093	1	Cl.Cl	C(CN1CCCCC1)Oc1ccc(cc1)-c1cnc2c(cnn2c1)-c1ccncc1.Cl.Cl	InChI=1S/C24H25N5O.2ClH/c1-2-12-28(13-3-1)14-15-30-22-6-4-19(5-7-22)21-16-26-24-23(17-27-29(24)18-21)20-8-10-25-11-9-20;;/h4-11,16-18H,1-3,12-15H2;2*1H	RJDVIJJQKMGPMV-UHFFFAOYSA-N	399.20591047							78510
SB-216763	LSM-1161	SB-216763, BRD-K59184148	176158	InChI=1S/C19H12Cl2N2O2/c1-23-9-13(11-4-2-3-5-15(11)23)17-16(18(24)22-19(17)25)12-7-6-10(20)8-14(12)21/h2-9H,1H3,(H,22,24,25)	JCSGFHVFHSKIJH-UHFFFAOYSA-N	Cn1cc(C2=C(C(=O)NC2=O)c3ccc(Cl)cc3Cl)c4ccccc14	BroadT	BRD-K59184148	BRD-K59184148-001-04-2	Tocris Bioscience	1616	2		Cn1cc(C2=C(C(=O)NC2=O)c2ccc(Cl)cc2Cl)c2ccccc12	InChI=1S/C19H12Cl2N2O2/c1-23-9-13(11-4-2-3-5-15(11)23)17-16(18(24)22-19(17)25)12-7-6-10(20)8-14(12)21/h2-9H,1H3,(H,22,24,25)	JCSGFHVFHSKIJH-UHFFFAOYSA-N	370.027583064							91421, 91421
Oxethazaine	LSM-5672	Oxethazaine, Oxetacaine, WY-806	4621	InChI=1S/C28H41N3O3/c1-27(2,19-23-13-9-7-10-14-23)29(5)25(33)21-31(17-18-32)22-26(34)30(6)28(3,4)20-24-15-11-8-12-16-24/h7-16,32H,17-22H2,1-6H3	FTLDJPRFCGDUFH-UHFFFAOYSA-N	CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc2ccccc2	BroadT	BRD-K56940463	BRD-K56940463-001-04-7	MicroSource Discovery Systems Inc.	1503279			CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1	InChI=1S/C28H41N3O3/c1-27(2,19-23-13-9-7-10-14-23)29(5)25(33)21-31(17-18-32)22-26(34)30(6)28(3,4)20-24-15-11-8-12-16-24/h7-16,32H,17-22H2,1-6H3	FTLDJPRFCGDUFH-UHFFFAOYSA-N	467.314792202							31947
CHEMBL26998	LSM-15196	BRD-K59765110, SID124880270, SID90341489	6603866	InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3/t14-/m1/s1	ASXGJMSKWNBENU-CQSZACIVSA-N	CCCN(CCC)[C@@H]1CCc2cccc(O)c2C1	BroadT	BRD-K59765110	BRD-K59765110-004-03-8	Tocris Bioscience	1080	4	Br	CCCN(CCC)[C@@H]1CCc2cccc(O)c2C1.Br	InChI=1S/C16H25NO.BrH/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14;/h5-7,14,18H,3-4,8-12H2,1-2H3;1H/t14-;/m1./s1	BATPBOZTBNNDLN-PFEQFJNWSA-N	247.19361443							103846, 103846
Mometasone Furoate	LSM-3349	Mometasone, Nasonex, Elocon, Asmanex, SCH-32088, Mometasone Furoate, Mometasone Furoate Monohydrate, Asmanex Twisthaler	441336	InChI=1S/C27H30Cl2O6/c1-15-11-19-18-7-6-16-12-17(30)8-9-24(16,2)26(18,29)21(31)13-25(19,3)27(15,22(32)14-28)35-23(33)20-5-4-10-34-20/h4-5,8-10,12,15,18-19,21,31H,6-7,11,13-14H2,1-3H3/t15-,18+,19+,21+,24+,25+,26+,27+/m1/s1	WOFMFGQZHJDGCX-ZULDAHANSA-N	C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@]2(C)[C@@]1(OC(=O)c5occc5)C(=O)CCl	BroadT	BRD-K60640630	BRD-K60640630-001-03-7	Prestwick Chemical Inc.	Prestw-572	D0701-MP04-ST03-200-		C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@]2(C)[C@@]1(OC(=O)c1ccco1)C(=O)CCl	InChI=1S/C27H30Cl2O6/c1-15-11-19-18-7-6-16-12-17(30)8-9-24(16,2)26(18,29)21(31)13-25(19,3)27(15,22(32)14-28)35-23(33)20-5-4-10-34-20/h4-5,8-10,12,15,18-19,21,31H,6-7,11,13-14H2,1-3H3/t15-,18+,19+,21+,24+,25+,26+,27+/m1/s1	WOFMFGQZHJDGCX-ZULDAHANSA-N	520.1419441							47564
Oxybenzone	LSM-3309	Oxybenzone, Uvinul M40	4632	InChI=1S/C14H12O3/c1-17-11-7-8-12(13(15)9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3	DXGLGDHPHMLXJC-UHFFFAOYSA-N	COc1ccc(C(=O)c2ccccc2)c(O)c1	BroadT	BRD-K59037100	BRD-K59037100-001-04-8	MicroSource Discovery Systems Inc.	1500451			COc1ccc(C(=O)c2ccccc2)c(O)c1	InChI=1S/C14H12O3/c1-17-11-7-8-12(13(15)9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3	DXGLGDHPHMLXJC-UHFFFAOYSA-N	228.078644244							34283
Hbdde	LSM-5666	Hhbpdde, SID26756758, SID26756757, SID124892432, EI-273	3568	InChI=1S/C16H18O8/c1-23-5-7-3-9(17)13(19)15(21)11(7)12-8(6-24-2)4-10(18)14(20)16(12)22/h3-4,17-22H,5-6H2,1-2H3	NEBCAMAQXZIVRE-UHFFFAOYSA-N	COCc1cc(O)c(O)c(O)c1c2c(O)c(O)c(O)cc2COC	BroadT	BRD-K56064827	BRD-K56064827-001-04-7	Biomol International Inc.	EI-273	2840(V2)-3-N1305		COCc1cc(O)c(O)c(O)c1-c1c(COC)cc(O)c(O)c1O	InChI=1S/C16H18O8/c1-23-5-7-3-9(17)13(19)15(21)11(7)12-8(6-24-2)4-10(18)14(20)16(12)22/h3-4,17-22H,5-6H2,1-2H3	NEBCAMAQXZIVRE-UHFFFAOYSA-N	338.100167536							94660, 94660, 94660
Piperonylic acid	LSM-19007	Piperonylic Acid	7196	InChI=1S/C8H6O4/c9-8(10)5-1-2-6-7(3-5)12-4-11-6/h1-3H,4H2,(H,9,10)	VDVJGIYXDVPQLP-UHFFFAOYSA-N	OC(=O)c1ccc2OCOc2c1	BroadT	BRD-K52148119	BRD-K52148119-001-01-5	MicroSource Discovery Systems Inc.	500580			OC(=O)c1ccc2OCOc2c1	InChI=1S/C8H6O4/c9-8(10)5-1-2-6-7(3-5)12-4-11-6/h1-3H,4H2,(H,9,10)	VDVJGIYXDVPQLP-UHFFFAOYSA-N	166.026608672							107644
YC1	LSM-3346	SID90341613, SID85231287, SID56322632, YC-1	5712	InChI=1S/C19H16N2O2/c22-13-15-10-11-18(23-15)19-16-8-4-5-9-17(16)21(20-19)12-14-6-2-1-3-7-14/h1-11,22H,12-13H2	OQQVFCKUDYMWGV-UHFFFAOYSA-N	OCc1oc(cc1)c2nn(Cc3ccccc3)c4ccccc24	BroadT	BRD-K60476892	BRD-K60476892-001-02-1	Biomol International Inc.	CN-223	2840(V2)-3-N1305		OCc1ccc(o1)-c1nn(Cc2ccccc2)c2ccccc12	InChI=1S/C19H16N2O2/c22-13-15-10-11-18(23-15)19-16-8-4-5-9-17(16)21(20-19)12-14-6-2-1-3-7-14/h1-11,22H,12-13H2	OQQVFCKUDYMWGV-UHFFFAOYSA-N	304.121177772							93060
CHEMBL364005	LSM-3051	BRD-K47659338, SID26755027	10131112	InChI=1S/C14H15ClN2/c1-9-14(10-4-6-16-7-5-10)12-8-11(15)2-3-13(12)17-9/h2-4,8,16-17H,5-7H2,1H3	BPPGPYJBCVXILI-UHFFFAOYSA-N	Cc1[nH]c2ccc(Cl)cc2c1C3=CCNCC3	BroadT	BRD-K47659338	BRD-K47659338-003-01-0	Tocris Bioscience	2382	1	Cl	Cc1[nH]c2ccc(Cl)cc2c1C1=CCNCC1.Cl	InChI=1S/C14H15ClN2.ClH/c1-9-14(10-4-6-16-7-5-10)12-8-11(15)2-3-13(12)17-9;/h2-4,8,16-17H,5-7H2,1H3;1H	WWSNDUWIZDYGIQ-UHFFFAOYSA-N	246.09237621							92829
Byssochlamic acid	LSM-2963		164723	InChI=1S/C18H20O6/c1-3-5-10-8-12-11(15(19)23-16(12)20)6-9(4-2)7-13-14(10)18(22)24-17(13)21/h9-10H,3-8H2,1-2H3/t9-,10+/m1/s1	NRDWUPPIGBHWAS-ZJUUUORDSA-N	CCC[C@H]1CC2=C(C[C@@H](CC)CC3=C1C(=O)OC3=O)C(=O)OC2=O	BroadT	BRD-K43468059	BRD-K43468059-001-02-9	MicroSource Discovery Systems Inc.	1800172			CCC[C@H]1CC2=C(C[C@@H](CC)CC3=C1C(=O)OC3=O)C(=O)OC2=O	InChI=1S/C18H20O6/c1-3-5-10-8-12-11(15(19)23-16(12)20)6-9(4-2)7-13-14(10)18(22)24-17(13)21/h9-10H,3-8H2,1-2H3/t9-,10+/m1/s1	NRDWUPPIGBHWAS-ZJUUUORDSA-N	332.12598836							92764
MDL-28170	LSM-2958	SID11111486, SID26753602	72430	InChI=1S/C22H26N2O4/c1-16(2)20(24-22(27)28-15-18-11-7-4-8-12-18)21(26)23-19(14-25)13-17-9-5-3-6-10-17/h3-12,14,16,19-20H,13,15H2,1-2H3,(H,23,26)(H,24,27)/t19-,20-/m0/s1	NGBKFLTYGSREKK-PMACEKPBSA-N	CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc2ccccc2)C=O	BroadT	BRD-K43245338	BRD-K43245338-001-02-4	Biomol International Inc.	PI-130	2840(V2)-3-N1305		CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C=O	InChI=1S/C22H26N2O4/c1-16(2)20(24-22(27)28-15-18-11-7-4-8-12-18)21(26)23-19(14-25)13-17-9-5-3-6-10-17/h3-12,14,16,19-20H,13,15H2,1-2H3,(H,23,26)(H,24,27)/t19-,20-/m0/s1	NGBKFLTYGSREKK-PMACEKPBSA-N	382.189257332							82818
AG1295	LSM-5680	Tyrphostin Ag 1295, AG-1295, Tyrphostin-Ag-1295	2048	InChI=1S/C16H14N2/c1-11-8-14-15(9-12(11)2)18-16(10-17-14)13-6-4-3-5-7-13/h3-10H,1-2H3	FQNCLVJEQCJWSU-UHFFFAOYSA-N	Cc1cc2ncc(nc2cc1C)c3ccccc3	BroadT	BRD-K57926513	BRD-K57926513-001-02-9	Calbiochem	658550			Cc1cc2ncc(nc2cc1C)-c1ccccc1	InChI=1S/C16H14N2/c1-11-8-14-15(9-12(11)2)18-16(10-17-14)13-6-4-3-5-7-13/h3-10H,1-2H3	FQNCLVJEQCJWSU-UHFFFAOYSA-N	234.115698468							94668
Tioxolone	LSM-19008	Thioxolone, Tioxolone	72139	InChI=1S/C7H4O3S/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3,8H	SLYPOVJCSQHITR-UHFFFAOYSA-N	Oc1ccc2SC(=O)Oc2c1	BroadT	BRD-K41876534	BRD-K41876534-001-02-0	MicroSource Discovery Systems Inc.	1503094			Oc1ccc2sc(=O)oc2c1	InChI=1S/C7H4O3S/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3,8H	SLYPOVJCSQHITR-UHFFFAOYSA-N	167.988114678							568021
448906-42-1	LSM-3345	SID29215507, BRD-K60298136	4668801	InChI=1S/C14H10N2O3S/c1-19-14(18)11-7-20-13(16-11)12(17)9-6-15-10-5-3-2-4-8(9)10/h2-7,15H,1H3	KDDXOGDIPZSCTM-UHFFFAOYSA-N	COC(=O)c1csc(n1)C(=O)c2c[nH]c3ccccc23	BroadT	BRD-K60298136	BRD-K60298136-001-01-7	Tocris Bioscience	1803	1		COC(=O)c1csc(n1)C(=O)c1c[nH]c2ccccc12	InChI=1S/C14H10N2O3S/c1-19-14(18)11-7-20-13(16-11)12(17)9-6-15-10-5-3-2-4-8(9)10/h2-7,15H,1H3	KDDXOGDIPZSCTM-UHFFFAOYSA-N	286.04121289							93059
SCH-23390	LSM-3005	SCH-23390	3036864	InChI=1S/C17H18ClNO/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12/h2-6,9-10,15,20H,7-8,11H2,1H3/t15-/m1/s1	GOTMKOSCLKVOGG-OAHLLOKOSA-N	CN1CCc2cc(Cl)c(O)cc2[C@H](C1)c3ccccc3	BroadT	BRD-K45435259	BRD-K45435259-001-01-6	Biomol International Inc.	D-110	2812-3-N1298		CN1CCc2cc(Cl)c(O)cc2[C@H](C1)c1ccccc1	InChI=1S/C17H18ClNO/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12/h2-6,9-10,15,20H,7-8,11H2,1H3/t15-/m1/s1	GOTMKOSCLKVOGG-OAHLLOKOSA-N	287.107691916							92798, 92798, 92798
PRE-084	LSM-3278	2-Morpholinoethyl 1-Phenylcyclohexanecarboxylate, BRD-K57304726	126402	InChI=1S/C19H27NO3/c21-18(23-16-13-20-11-14-22-15-12-20)19(9-5-2-6-10-19)17-7-3-1-4-8-17/h1,3-4,7-8H,2,5-6,9-16H2	RQHKZUBCUZVZEF-UHFFFAOYSA-N	O=C(OCCN1CCOCC1)C2(CCCCC2)c3ccccc3	BroadT	BRD-K57304726	BRD-K57304726-003-03-6	Tocris Bioscience	589	1	Cl	O=C(OCCN1CCOCC1)C1(CCCCC1)c1ccccc1.Cl	InChI=1S/C19H27NO3.ClH/c21-18(23-16-13-20-11-14-22-15-12-20)19(9-5-2-6-10-19)17-7-3-1-4-8-17;/h1,3-4,7-8H,2,5-6,9-16H2;1H	QUJWFJNHTBKCLU-UHFFFAOYSA-N	317.199093734							93007, 93007
Pefloxacin	LSM-5653	1589 RB, Pefloxacin, EU-5306	51081	InChI=1S/C17H20FN3O3/c1-3-20-10-12(17(23)24)16(22)11-8-13(18)15(9-14(11)20)21-6-4-19(2)5-7-21/h8-10H,3-7H2,1-2H3,(H,23,24)	FHFYDNQZQSQIAI-UHFFFAOYSA-N	CCN1C=C(C(=O)O)C(=O)c2cc(F)c(cc12)N3CCN(C)CC3	BroadT	BRD-K55034111	BRD-K55034111-066-02-3	MicroSource Discovery Systems Inc.	1505305		CS(=O)(=O)O	CCn1cc(C(O)=O)c(=O)c2cc(F)c(cc12)N1CCN(C)CC1.CS(=O)(=O)O	InChI=1S/C17H20FN3O3.CH4O3S/c1-3-20-10-12(17(23)24)16(22)11-8-13(18)15(9-14(11)20)21-6-4-19(2)5-7-21;1-5(2,3)4/h8-10H,3-7H2,1-2H3,(H,23,24);1H3,(H,2,3,4)	HQQSBEDKMRHYME-UHFFFAOYSA-N	333.14886973							50199, 50199, 50199
E6 Berbamine	LSM-3111	E6 BERBAMINE, CHEMBL405686	6610268	InChI=1S/C44H43N3O9/c1-45-18-16-29-23-37(51-3)39-25-33(29)34(45)20-26-6-13-32(14-7-26)54-38-22-27(8-15-36(38)56-44(48)28-9-11-31(12-10-28)47(49)50)21-35-41-30(17-19-46(35)2)24-40(52-4)42(53-5)43(41)55-39/h6-15,22-25,34-35H,16-21H2,1-5H3/t34-,35+/m0/s1	PUAVTDKYTXNVBU-OIDHKYIRSA-N	COc1cc2CCN(C)[C@H]3Cc4ccc(Oc5cc(C[C@H]6N(C)CCc7cc(OC)c(OC)c(Oc1cc23)c67)ccc5OC(=O)c8ccc(cc8)[N+](=O)[O-])cc4	BroadT	BRD-K50464341	BRD-K50464341-001-02-6	Biomol International Inc.	CA-302	2840(V2)-3-N1305		COc1cc2CCN(C)[C@H]3Cc4ccc(Oc5cc(C[C@H]6N(C)CCc7cc(OC)c(OC)c(Oc1cc23)c67)ccc5OC(=O)c1ccc(cc1)[N+]([O-])=O)cc4	InChI=1S/C44H43N3O9/c1-45-18-16-29-23-37(51-3)39-25-33(29)34(45)20-26-6-13-32(14-7-26)54-38-22-27(8-15-36(38)56-44(48)28-9-11-31(12-10-28)47(49)50)21-35-41-30(17-19-46(35)2)24-40(52-4)42(53-5)43(41)55-39/h6-15,22-25,34-35H,16-21H2,1-5H3/t34-,35+/m0/s1	PUAVTDKYTXNVBU-OIDHKYIRSA-N	757.299929986							92876
Acetazolamide	LSM-5543	Acetazolamide, Diamox	1986	InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9)	BZKPWHYZMXOIDC-UHFFFAOYSA-N	CC(=O)Nc1nnc(s1)S(=O)(=O)N	BroadT	BRD-K43457670	BRD-K43457670-001-04-7	MicroSource Discovery Systems Inc.	1500102			CC(=O)Nc1nnc(s1)S(N)(=O)=O	InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9)	BZKPWHYZMXOIDC-UHFFFAOYSA-N	221.988131472							27690, 27690, 27690
RO 16-6941	LSM-2985	RO-16-6941, RO-166491	4289	InChI=1S/C9H11ClN2O/c10-8-3-1-7(2-4-8)9(13)12-6-5-11/h1-4H,5-6,11H2,(H,12,13)	AIHKMGLJGLKLSI-UHFFFAOYSA-N	NCCNC(=O)c1ccc(Cl)cc1	BroadT	BRD-K44899736	BRD-K44899736-003-02-1	MicroSource Discovery Systems Inc.	1503638		Cl	NCCNC(=O)c1ccc(Cl)cc1.Cl	InChI=1S/C9H11ClN2O.ClH/c10-8-3-1-7(2-4-8)9(13)12-6-5-11;/h1-4H,5-6,11H2,(H,12,13);1H	ARUMZUNJBHSOQQ-UHFFFAOYSA-N	198.055990702							92783, 92783
Syringic acid	LSM-19009	Syringic Acid	10742	InChI=1S/C9H10O5/c1-13-6-3-5(9(11)12)4-7(14-2)8(6)10/h3-4,10H,1-2H3,(H,11,12)	JMSVCTWVEWCHDZ-UHFFFAOYSA-N	COc1cc(cc(OC)c1O)C(=O)O	BroadT	BRD-K51980294	BRD-K51980294-001-01-9	MicroSource Discovery Systems Inc.	1401301			COc1cc(cc(OC)c1O)C(O)=O	InChI=1S/C9H10O5/c1-13-6-3-5(9(11)12)4-7(14-2)8(6)10/h3-4,10H,1-2H3,(H,11,12)	JMSVCTWVEWCHDZ-UHFFFAOYSA-N	198.05282342							68329
Acetyltryptophan	LSM-19010	Acetyltryptophan, SID26748365, Acetyl Tryptophan	700653	InChI=1S/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/t12-/m0/s1	DZTHIGRZJZPRDV-LBPRGKRZSA-N	CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	BroadT	BRD-K47947160	BRD-K47947160-001-02-4	MicroSource Discovery Systems Inc.	1500702			CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O	InChI=1S/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/t12-/m0/s1	DZTHIGRZJZPRDV-LBPRGKRZSA-N	246.100442328							74640
Alfaxalone	LSM-2922	Alfaxalone, Alphaxalone, GR 2/234	104845	InChI=1S/C21H32O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h13-17,19,23H,4-11H2,1-3H3/t13-,14+,15-,16+,17-,19+,20-,21+/m0/s1	DUHUCHOQIDJXAT-OLVMNOGESA-N	CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3C(=O)C[C@]12C	BroadT	BRD-K41445866	BRD-K41445866-001-03-0	Prestwick Chemical Inc.	Prestw-1002	D0701-MP04-ST03-200-		CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3C(=O)C[C@]12C	InChI=1S/C21H32O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h13-17,19,23H,4-11H2,1-3H3/t13-,14+,15-,16+,17-,19+,20-,21+/m0/s1	DUHUCHOQIDJXAT-OLVMNOGESA-N	332.235144884							34531
PCO-400	LSM-3167	SID26756496	129348	InChI=1S/C17H17NO4/c1-17(2)16(20)15(21-12-5-4-11(19)8-12)13-7-10(9-18)3-6-14(13)22-17/h3,6-8,15-16,20H,4-5H2,1-2H3/t15-,16+/m1/s1	WJBHHTPFTVKZCV-CVEARBPZSA-N	CC1(C)Oc2ccc(cc2[C@@H](OC3=CC(=O)CC3)[C@@H]1O)C#N	BroadT	BRD-K52721684	BRD-K52721684-001-02-2	Biomol International Inc.	KC-131	2840(V2)-3-N1305		CC1(C)Oc2ccc(cc2[C@@H](OC2=CC(=O)CC2)[C@@H]1O)C#N	InChI=1S/C17H17NO4/c1-17(2)16(20)15(21-12-5-4-11(19)8-12)13-7-10(9-18)3-6-14(13)22-17/h3,6-8,15-16,20H,4-5H2,1-2H3/t15-,16+/m1/s1	WJBHHTPFTVKZCV-CVEARBPZSA-N	299.115758034							92920
Ntzdpa	LSM-3219	BRD-K54708045, SID26753206	9954280	InChI=1S/C22H15Cl2NO2S/c23-15-8-6-14(7-9-15)13-25-19-11-10-16(24)12-18(19)21(20(25)22(26)27)28-17-4-2-1-3-5-17/h1-12H,13H2,(H,26,27)	VUPOTURDKDMIGQ-UHFFFAOYSA-N	OC(=O)c1c(Sc2ccccc2)c3cc(Cl)ccc3n1Cc4ccc(Cl)cc4	BroadT	BRD-K54708045	BRD-K54708045-001-01-3	Tocris Bioscience	2150	1		OC(=O)c1n(Cc2ccc(Cl)cc2)c2ccc(Cl)cc2c1Sc1ccccc1	InChI=1S/C22H15Cl2NO2S/c23-15-8-6-14(7-9-15)13-25-19-11-10-16(24)12-18(19)21(20(25)22(26)27)28-17-4-2-1-3-5-17/h1-12H,13H2,(H,26,27)	VUPOTURDKDMIGQ-UHFFFAOYSA-N	427.02005484							
2-TEDC	LSM-19011	BRD-K42663584	4324255	InChI=1S/C16H13NO4S/c17-10-12(8-11-3-4-14(18)15(19)9-11)16(20)21-6-5-13-2-1-7-22-13/h1-4,7-9,18-19H,5-6H2	KCGLTUBCAGZLHP-UHFFFAOYSA-N	Oc1ccc(C=C(C#N)C(=O)OCCc2cccs2)cc1O	BroadT	BRD-K42663584	BRD-K42663584-001-01-2	Tocris Bioscience	645	1		Oc1ccc(C=C(C#N)C(=O)OCCc2cccs2)cc1O	InChI=1S/C16H13NO4S/c17-10-12(8-11-3-4-14(18)15(19)9-11)16(20)21-6-5-13-2-1-7-22-13/h1-4,7-9,18-19H,5-6H2	KCGLTUBCAGZLHP-UHFFFAOYSA-N	315.056528596							107645
Suloctidil	LSM-2946	Suloctidil, CP-556S, MJF-12637	657255	InChI=1S/C20H35NOS/c1-5-6-7-8-9-10-15-21-17(4)20(22)18-11-13-19(14-12-18)23-16(2)3/h11-14,16-17,20-22H,5-10,15H2,1-4H3/t17-,20-/m1/s1	BFCDFTHTSVTWOG-YLJYHZDGSA-N	CCCCCCCCN[C@H](C)[C@@H](O)c1ccc(SC(C)C)cc1	BroadT	BRD-K42635745	BRD-K42635745-001-02-4	Prestwick Chemical Inc.	Prestw-421	D0701-MP04-ST03-200-		CCCCCCCCN[C@H](C)[C@@H](O)c1ccc(SC(C)C)cc1	InChI=1S/C20H35NOS/c1-5-6-7-8-9-10-15-21-17(4)20(22)18-11-13-19(14-12-18)23-16(2)3/h11-14,16-17,20-22H,5-10,15H2,1-4H3/t17-,20-/m1/s1	BFCDFTHTSVTWOG-YLJYHZDGSA-N	337.24393544							92751
Pramoxine	LSM-5573	Pramocaine, Pramoxine	4886	InChI=1S/C17H27NO3/c1-2-3-12-20-16-5-7-17(8-6-16)21-13-4-9-18-10-14-19-15-11-18/h5-8H,2-4,9-15H2,1H3	DQKXQSGTHWVTAD-UHFFFAOYSA-N	CCCCOc1ccc(OCCCN2CCOCC2)cc1	BroadT	BRD-K46523383	BRD-K46523383-003-04-7	Prestwick Chemical Inc.	Prestw-716	D0701-MP04-ST03-200-	Cl	CCCCOc1ccc(OCCCN2CCOCC2)cc1.Cl	InChI=1S/C17H27NO3.ClH/c1-2-3-12-20-16-5-7-17(8-6-16)21-13-4-9-18-10-14-19-15-11-18;/h5-8H,2-4,9-15H2,1H3;1H	SYCBXBCPLUFJID-UHFFFAOYSA-N	293.199093734							8357, 8357
Spiperone	LSM-3235	Spiperone, Spiropitan, R-5147	5265	InChI=1S/C23H26FN3O2/c24-19-10-8-18(9-11-19)21(28)7-4-14-26-15-12-23(13-16-26)22(29)25-17-27(23)20-5-2-1-3-6-20/h1-3,5-6,8-11H,4,7,12-17H2,(H,25,29)	DKGZKTPJOSAWFA-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)CCCN2CCC3(CC2)N(CNC3=O)c4ccccc4	BroadT	BRD-K55468218	BRD-K55468218-001-04-8	MicroSource Discovery Systems Inc.	1501152			Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1	InChI=1S/C23H26FN3O2/c24-19-10-8-18(9-11-19)21(28)7-4-14-26-15-12-23(13-16-26)22(29)25-17-27(23)20-5-2-1-3-6-20/h1-3,5-6,8-11H,4,7,12-17H2,(H,25,29)	DKGZKTPJOSAWFA-UHFFFAOYSA-N	395.200905302							9233, 9233
Azlocillin	LSM-15179	Azlocillin	6479523	InChI=1S/C20H23N5O6S/c1-20(2)13(17(28)29)25-15(27)12(16(25)32-20)22-14(26)11(10-6-4-3-5-7-10)23-19(31)24-9-8-21-18(24)30/h3-7,11-13,16H,8-9H2,1-2H3,(H,21,30)(H,22,26)(H,23,31)(H,28,29)/t11-,12-,13+,16-/m1/s1	JTWOMNBEOCYFNV-NFFDBFGFSA-N	CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)N3CCNC3=O)c4ccccc4)C(=O)N2[C@H]1C(=O)O	BroadT	BRD-K60663764	BRD-K60663764-236-02-1	Prestwick Chemical Inc.	Prestw-821	D0701-MP04-ST03-200-	[Na]	CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)N3CCNC3=O)c3ccccc3)C(=O)N2[C@H]1C(O)=O.[Na]	InChI=1S/C20H23N5O6S.Na.H/c1-20(2)13(17(28)29)25-15(27)12(16(25)32-20)22-14(26)11(10-6-4-3-5-7-10)23-19(31)24-9-8-21-18(24)30;;/h3-7,11-13,16H,8-9H2,1-2H3,(H,21,30)(H,22,26)(H,23,31)(H,28,29);;/t11-,12-,13+,16-;;/m1../s1	AVFLNJTZQMJZPT-JWJWOXTHSA-N	461.136904196							2956, 2956
Diethylstilbestrol	LSM-42960	Stilbetin, Stilbestrol, Stilbestroform, Palestrol, Fonatol, Estromenin, Estrogenine, Estrobene, Diethylstilbestrol, Stilboesterol, Stilboestrol, Synestrin, Synthestrin, NEW-ESTRANOL 1, Cyren A, Diethyl Stilbestrol	448537	InChI=1S/C18H20O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,19-20H,3-4H2,1-2H3/b18-17+	RGLYKWWBQGJZGM-ISLYRVAYSA-N	CC\C(=C(\CC)/c1ccc(O)cc1)\c2ccc(O)cc2	BroadT	BRD-K45330754	BRD-K45330754-001-04-3	MicroSource Discovery Systems Inc.	1500244			CC\C(c1ccc(O)cc1)=C(\CC)c1ccc(O)cc1	InChI=1S/C18H20O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,19-20H,3-4H2,1-2H3/b18-17+	RGLYKWWBQGJZGM-ISLYRVAYSA-N	268.14632988							41922
Palmitine	LSM-6625	Palmatine, SID11112538	19009	InChI=1S/C21H22NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,9-12H,7-8H2,1-4H3/q+1	QUCQEUCGKKTEBI-UHFFFAOYSA-N	COc1ccc2cc3c4cc(OC)c(OC)cc4CC[n+]3cc2c1OC	BroadT	BRD-K58466253	BRD-K58466253-003-04-1	Prestwick Chemical Inc.	Prestw-579	D0701-MP04-ST03-200-	Cl	COc1cc2CC[n+]3cc4c(OC)c(OC)ccc4cc3-c2cc1OC.Cl	InChI=1S/C21H22NO4.ClH/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4;/h5-6,9-12H,7-8H2,1-4H3;1H/q+1;	RLQYRXCUPVKSAW-UHFFFAOYSA-N	352.154883194							16096, 16096, 16096, 16096, 16096
N-Benzylquinazolin-4-amine	LSM-2968	BRD-K43796186, SID50086002	616573	InChI=1S/C15H13N3/c1-2-6-12(7-3-1)10-16-15-13-8-4-5-9-14(13)17-11-18-15/h1-9,11H,10H2,(H,16,17,18)	FVWANTDQRFSCAL-UHFFFAOYSA-N	C(Nc1ncnc2ccccc12)c3ccccc3	BroadT	BRD-K43796186	BRD-K43796186-001-01-1	Broad Institute CMLD	RLM-1-127			C(Nc1ncnc2ccccc12)c1ccccc1	InChI=1S/C15H13N3/c1-2-6-12(7-3-1)10-16-15-13-8-4-5-9-14(13)17-11-18-15/h1-9,11H,10H2,(H,16,17,18)	FVWANTDQRFSCAL-UHFFFAOYSA-N	235.110947446							92768, 92768
RO-316233	LSM-3085	RO-31-6233, Bisindolylmaleimide IV	2399	InChI=1S/C20H13N3O2/c24-19-17(13-9-21-15-7-3-1-5-11(13)15)18(20(25)23-19)14-10-22-16-8-4-2-6-12(14)16/h1-10,21-22H,(H,23,24,25)	DQYBRTASHMYDJG-UHFFFAOYSA-N	O=C1NC(=O)C(=C1c2c[nH]c3ccccc23)c4c[nH]c5ccccc45	BroadT	BRD-K49448285	BRD-K49448285-001-01-3	Calbiochem	203297			O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12	InChI=1S/C20H13N3O2/c24-19-17(13-9-21-15-7-3-1-5-11(13)15)18(20(25)23-19)14-10-22-16-8-4-2-6-12(14)16/h1-10,21-22H,(H,23,24,25)	DQYBRTASHMYDJG-UHFFFAOYSA-N	327.100776686							92857
Propentofylline	LSM-3315	Propentofylline, HWA-285	4938	InChI=1S/C15H22N4O3/c1-4-8-18-10-16-13-12(18)14(21)19(15(22)17(13)3)9-6-5-7-11(2)20/h10H,4-9H2,1-3H3	RBQOQRRFDPXAGN-UHFFFAOYSA-N	CCCn1cnc2N(C)C(=O)N(CCCCC(=O)C)C(=O)c12	BroadT	BRD-K59273480	BRD-K59273480-001-01-5	MicroSource Discovery Systems Inc.	1503079			CCCn1cnc2n(C)c(=O)n(CCCCC(C)=O)c(=O)c12	InChI=1S/C15H22N4O3/c1-4-8-18-10-16-13-12(18)14(21)19(15(22)17(13)3)9-6-5-7-11(2)20/h10H,4-9H2,1-3H3	RBQOQRRFDPXAGN-UHFFFAOYSA-N	306.169190604							93037
Prazosin	LSM-3079	Prazosin, CP-12299	4893	InChI=1S/C19H21N5O4/c1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h3-4,9-11H,5-8H2,1-2H3,(H2,20,21,22)	IENZQIKPVFGBNW-UHFFFAOYSA-N	COc1cc2nc(nc(N)c2cc1OC)N3CCN(CC3)C(=O)c4occc4	BroadT	BRD-K49111258	BRD-K49111258-001-02-8	Biomol International Inc.	AC-146	2840(V2)-3-N1305		COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)c1ccco1	InChI=1S/C19H21N5O4/c1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h3-4,9-11H,5-8H2,1-2H3,(H2,20,21,22)	IENZQIKPVFGBNW-UHFFFAOYSA-N	383.159354202							8364, 8364, 8364
Calcipotriene	LSM-42986	Dovonex, Calcipotriol, Calcipotriene, Sorilux, MC-903, BRD-K56429665, Calcipotriene Hydrate	5288783	InChI=1S/C27H40O3/c1-17(6-13-25(29)20-8-9-20)23-11-12-24-19(5-4-14-27(23,24)3)7-10-21-15-22(28)16-26(30)18(21)2/h6-7,10,13,17,20,22-26,28-30H,2,4-5,8-9,11-12,14-16H2,1,3H3/b13-6+,19-7+,21-10-/t17-,22-,23-,24+,25-,26+,27-/m1/s1	LWQQLNNNIPYSNX-UROSTWAQSA-N	C[C@H](\C=C\[C@@H](O)C1CC1)[C@H]2CC[C@H]3\C(=C\C=C/4\C[C@@H](O)C[C@H](O)C4=C)\CCC[C@]23C	BroadT	BRD-K56429665	BRD-K56429665-001-03-9	Tocris Bioscience	2700	1		C[C@H](\C=C\[C@@H](O)C1CC1)[C@H]1CC[C@@H]2[C@]1(C)CCC\C2=C/C=C1/C[C@@H](O)C[C@H](O)C1=C	InChI=1S/C27H40O3/c1-17(6-13-25(29)20-8-9-20)23-11-12-24-19(5-4-14-27(23,24)3)7-10-21-15-22(28)16-26(30)18(21)2/h6-7,10,13,17,20,22-26,28-30H,2,4-5,8-9,11-12,14-16H2,1,3H3/b13-6+,19-7+,21-10-/t17-,22-,23-,24+,25-,26+,27-/m1/s1	LWQQLNNNIPYSNX-UROSTWAQSA-N	412.29774514							50749
Tolazoline	LSM-3020	Priscoline, Tolazoline	5504	InChI=1S/C10H12N2/c1-2-4-9(5-3-1)8-10-11-6-7-12-10/h1-5H,6-8H2,(H,11,12)	JIVZKJJQOZQXQB-UHFFFAOYSA-N	C(C1=NCCN1)c2ccccc2	BroadT	BRD-K46211610	BRD-K46211610-003-05-1	Prestwick Chemical Inc.	Prestw-60	D0701-MP04-ST03-200-	Cl	C(C1=NCCN1)c1ccccc1.Cl	InChI=1S/C10H12N2.ClH/c1-2-4-9(5-3-1)8-10-11-6-7-12-10;/h1-5H,6-8H2,(H,11,12);1H	RHTNTTODYGNRSP-UHFFFAOYSA-N	160.100048404							28502, 28502
Propylthiouracil	LSM-5592	Propylthiouracil, Propacil, Prothyran, Thyreostat, Propyl Thiouracil	657298	InChI=1S/C7H10N2OS/c1-2-3-5-4-6(10)9-7(11)8-5/h4H,2-3H2,1H3,(H2,8,9,10,11)	KNAHARQHSZJURB-UHFFFAOYSA-N	CCCC1=CC(=O)NC(=S)N1	BroadT	BRD-K48168960	BRD-K48168960-001-05-1	Prestwick Chemical Inc.	Prestw-494	D0701-MP04-ST03-200-		CCCc1cc(=O)[nH]c(=S)[nH]1	InChI=1S/C7H10N2OS/c1-2-3-5-4-6(10)9-7(11)8-5/h4H,2-3H2,1H3,(H2,8,9,10,11)	KNAHARQHSZJURB-UHFFFAOYSA-N	170.05138365							8502
522-11-2	LSM-3052	Evoxine, SID56463091	673465	InChI=1S/C18H21NO6/c1-18(2,21)13(20)9-25-12-6-5-10-14(16(12)23-4)19-17-11(7-8-24-17)15(10)22-3/h5-8,13,20-21H,9H2,1-4H3/t13-/m1/s1	FGANMDNHTVJAHL-CYBMUJFWSA-N	COc1c(OC[C@@H](O)C(C)(C)O)ccc2c(OC)c3ccoc3nc12	BroadT	BRD-K47693913	BRD-K47693913-001-02-4	Prestwick Chemical Inc.	Prestw-665	D0701-MP04-ST03-200-		COc1c(OC[C@@H](O)C(C)(C)O)ccc2c(OC)c3ccoc3nc12	InChI=1S/C18H21NO6/c1-18(2,21)13(20)9-25-12-6-5-10-14(16(12)23-4)19-17-11(7-8-24-17)15(10)22-3/h5-8,13,20-21H,9H2,1-4H3/t13-/m1/s1	FGANMDNHTVJAHL-CYBMUJFWSA-N	347.136887402							92830
Linopirdine	LSM-3317	Linopirdine, BRD-K59332007, DUP-996	3932	InChI=1S/C26H21N3O/c30-25-26(18-20-10-14-27-15-11-20,19-21-12-16-28-17-13-21)23-8-4-5-9-24(23)29(25)22-6-2-1-3-7-22/h1-17H,18-19H2	YEJCDKJIEMIWRQ-UHFFFAOYSA-N	O=C1N(c2ccccc2)c3ccccc3C1(Cc4ccncc4)Cc5ccncc5	BroadT	BRD-K59332007	BRD-K59332007-300-01-9	Tocris Bioscience	1999	1	Cl.Cl	O=C1N(c2ccccc2C1(Cc1ccncc1)Cc1ccncc1)c1ccccc1.Cl.Cl	InChI=1S/C26H21N3O.2ClH/c30-25-26(18-20-10-14-27-15-11-20,19-21-12-16-28-17-13-21)23-8-4-5-9-24(23)29(25)22-6-2-1-3-7-22;;/h1-17H,18-19H2;2*1H	ZEVVHCGTTNRYOY-UHFFFAOYSA-N	391.168462322							34823, 34823
YM-298198	LSM-3328	BRD-K59650319, SID26755039	9819432	InChI=1S/C18H22N4OS/c1-11-16(17(23)21(2)13-6-4-3-5-7-13)24-18-20-14-9-8-12(19)10-15(14)22(11)18/h8-10,13H,3-7,19H2,1-2H3	KCBXOMYXOBVLED-UHFFFAOYSA-N	CN(C1CCCCC1)C(=O)c2sc3nc4ccc(N)cc4n3c2C	BroadT	BRD-K59650319	BRD-K59650319-003-01-7	Tocris Bioscience	2448	1	Cl	CN(C1CCCCC1)C(=O)c1sc2nc3ccc(N)cc3n2c1C.Cl	InChI=1S/C18H22N4OS.ClH/c1-11-16(17(23)21(2)13-6-4-3-5-7-13)24-18-20-14-9-8-12(19)10-15(14)22(11)18;/h8-10,13H,3-7,19H2,1-2H3;1H	WYTJVUVCSUWZTH-UHFFFAOYSA-N	342.151432054							93046
Zolpidem	LSM-5560	Ambien, Zolpidem	5732	InChI=1S/C19H21N3O/c1-13-5-8-15(9-6-13)19-16(11-18(23)21(3)4)22-12-14(2)7-10-17(22)20-19/h5-10,12H,11H2,1-4H3	ZAFYATHCZYHLPB-UHFFFAOYSA-N	CN(C)C(=O)Cc1c(nc2ccc(C)cn12)c3ccc(C)cc3	BroadT	BRD-K44876623	BRD-K44876623-001-01-1	MicroSource Discovery Systems Inc.	1505369			CN(C)C(=O)Cc1c(nc2ccc(C)cn12)-c1ccc(C)cc1	InChI=1S/C19H21N3O/c1-13-5-8-15(9-6-13)19-16(11-18(23)21(3)4)22-12-14(2)7-10-17(22)20-19/h5-10,12H,11H2,1-4H3	ZAFYATHCZYHLPB-UHFFFAOYSA-N	307.168462322							10125, 10125
Meticrane	LSM-5683	Meticrane, SD-17102	4165	InChI=1S/C10H13NO4S2/c1-7-5-8-3-2-4-16(12,13)10(8)6-9(7)17(11,14)15/h5-6H,2-4H2,1H3,(H2,11,14,15)	FNQQBFNIYODEMB-UHFFFAOYSA-N	Cc1cc2CCCS(=O)(=O)c2cc1S(=O)(=O)N	BroadT	BRD-K58265391	BRD-K58265391-001-03-6	Prestwick Chemical Inc.	Prestw-11	D0701-MP04-ST03-200-		Cc1cc2CCCS(=O)(=O)c2cc1S(N)(=O)=O	InChI=1S/C10H13NO4S2/c1-7-5-8-3-2-4-16(12,13)10(8)6-9(7)17(11,14)15/h5-6H,2-4H2,1H3,(H2,11,14,15)	FNQQBFNIYODEMB-UHFFFAOYSA-N	275.028599286							94670
5-Chloroindole-2-carboxylic acid	LSM-19012	BRD-K57244822, SID26749894, SID26753776, SID93576643	82693	InChI=1S/C9H6ClNO2/c10-6-1-2-7-5(3-6)4-8(11-7)9(12)13/h1-4,11H,(H,12,13)	FUQOTYRCMBZFOL-UHFFFAOYSA-N	OC(=O)c1cc2cc(Cl)ccc2[nH]1	BroadT	BRD-K57244822	BRD-K57244822-001-02-3	MicroSource Discovery Systems Inc.	1502057			OC(=O)c1cc2cc(Cl)ccc2[nH]1	InChI=1S/C9H6ClNO2/c10-6-1-2-7-5(3-6)4-8(11-7)9(12)13/h1-4,11H,(H,12,13)	FUQOTYRCMBZFOL-UHFFFAOYSA-N	195.008706152							107646
ZM 306416	LSM-2921	CB-676475, BRD-K41337261, ZM-306416	5329006	InChI=1S/C16H13ClFN3O2/c1-22-14-6-10-13(7-15(14)23-2)19-8-20-16(10)21-12-4-3-9(17)5-11(12)18/h3-8H,1-2H3,(H,19,20,21)	YHUIUSRCUKUUQA-UHFFFAOYSA-N	COc1cc2ncnc(Nc3ccc(Cl)cc3F)c2cc1OC	BroadT	BRD-K41337261	BRD-K41337261-001-01-4	EMD Biosciences	676475			COc1cc2ncnc(Nc3ccc(Cl)cc3F)c2cc1OC	InChI=1S/C16H13ClFN3O2/c1-22-14-6-10-13(7-15(14)23-2)19-8-20-16(10)21-12-4-3-9(17)5-11(12)18/h3-8H,1-2H3,(H,19,20,21)	YHUIUSRCUKUUQA-UHFFFAOYSA-N	333.068032596							92732
RO-25-6981	LSM-3140	BRD-K51541829, RO-25-6981	6604887	InChI=1S/C22H29NO2/c1-17(22(25)20-7-9-21(24)10-8-20)16-23-13-11-19(12-14-23)15-18-5-3-2-4-6-18/h2-10,17,19,22,24-25H,11-16H2,1H3/t17-,22+/m0/s1	WVZSEUPGUDIELE-HTAPYJJXSA-N	C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c3ccc(O)cc3	BroadT	BRD-K51541829	BRD-K51541829-001-01-3	Tocris Bioscience	1594	4		C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1	InChI=1S/C22H29NO2/c1-17(22(25)20-7-9-21(24)10-8-20)16-23-13-11-19(12-14-23)15-18-5-3-2-4-6-18/h2-10,17,19,22,24-25H,11-16H2,1H3/t17-,22+/m0/s1	WVZSEUPGUDIELE-HTAPYJJXSA-N	339.219829178							92897, 92897
Enalapril	LSM-3282	Enalapril, Lexxel, Vaseretic, Vasotec	5388962	InChI=1S/C20H28N2O5/c1-3-27-20(26)16(12-11-15-8-5-4-6-9-15)21-14(2)18(23)22-13-7-10-17(22)19(24)25/h4-6,8-9,14,16-17,21H,3,7,10-13H2,1-2H3,(H,24,25)/t14-,16-,17-/m0/s1	GBXSMTUPTTWBMN-XIRDDKMYSA-N	CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)O	BroadT	BRD-K57545991	BRD-K57545991-050-03-3	MicroSource Discovery Systems Inc.	1501214		OC(=O)/C=C\C(=O)O	CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=O.OC(=O)/C=C\C(=O)O	InChI=1S/C20H28N2O5.C4H4O4/c1-3-27-20(26)16(12-11-15-8-5-4-6-9-15)21-14(2)18(23)22-13-7-10-17(22)19(24)25;5-3(6)1-2-4(7)8/h4-6,8-9,14,16-17,21H,3,7,10-13H2,1-2H3,(H,24,25);1-2H,(H,5,6)(H,7,8)/b;2-1-/t14-,16-,17-;/m0./s1	OYFJQPXVCSSHAI-QFPUQLAESA-N	376.199822016							4784, 4784, 4784, 4784
Eticlopride	LSM-3109	Eticlopride	57267	InChI=1S/C17H25ClN2O3/c1-4-11-9-13(18)16(23-3)14(15(11)21)17(22)19-10-12-7-6-8-20(12)5-2/h9,12,21H,4-8,10H2,1-3H3,(H,19,22)/t12-/m0/s1	AADCDMQTJNYOSS-LBPRGKRZSA-N	CCN1CCC[C@H]1CNC(=O)c2c(O)c(CC)cc(Cl)c2OC	BroadT	BRD-K50417881	BRD-K50417881-003-05-9	Tocris Bioscience	1847	1	Cl	CCN1CCC[C@H]1CNC(=O)c1c(O)c(CC)cc(Cl)c1OC.Cl	InChI=1S/C17H25ClN2O3.ClH/c1-4-11-9-13(18)16(23-3)14(15(11)21)17(22)19-10-12-7-6-8-20(12)5-2;/h9,12,21H,4-8,10H2,1-3H3,(H,19,22);1H/t12-;/m0./s1	HFJFXXDHVWLIKX-YDALLXLXSA-N	340.15537039							92874, 92874
CHEMBL258465	LSM-3233	BRD-K55430733, WAY-629	6604933	InChI=1S/C15H18N2/c1-2-7-14-12(5-1)13-6-3-4-11-10-16-8-9-17(14)15(11)13/h3-4,6,16H,1-2,5,7-10H2	OIGHTPDWPMLMGT-UHFFFAOYSA-N	C1CCc2c(C1)c3cccc4CNCCn2c34	BroadT	BRD-K55430733	BRD-K55430733-003-01-6	Tocris Bioscience	2173	1	Cl	C1CCc2c(C1)n1CCNCc3cccc2c13.Cl	InChI=1S/C15H18N2.ClH/c1-2-7-14-12(5-1)13-6-3-4-11-10-16-8-9-17(14)15(11)13;/h3-4,6,16H,1-2,5,7-10H2;1H	PZXUJERSOFOWES-UHFFFAOYSA-N	226.146998596							92969
GR 113808	LSM-3098	BRD-K49945136, GR-113808	119376	InChI=1S/C19H27N3O4S/c1-21-13-17(16-5-3-4-6-18(16)21)19(23)26-14-15-7-10-22(11-8-15)12-9-20-27(2,24)25/h3-6,13,15,20H,7-12,14H2,1-2H3	MOZPSIXKYJUTKI-UHFFFAOYSA-N	Cn1cc(C(=O)OCC2CCN(CCNS(=O)(=O)C)CC2)c3ccccc13	BroadT	BRD-K49945136	BRD-K49945136-001-03-5	Tocris Bioscience	1322	2		Cn1cc(C(=O)OCC2CCN(CCNS(C)(=O)=O)CC2)c2ccccc12	InChI=1S/C19H27N3O4S/c1-21-13-17(16-5-3-4-6-18(16)21)19(23)26-14-15-7-10-22(11-8-15)12-9-20-27(2,24)25/h3-6,13,15,20H,7-12,14H2,1-2H3	MOZPSIXKYJUTKI-UHFFFAOYSA-N	393.172227064							73380, 73380
(+)-Niguldipine	LSM-15284	Niguldipine, BRD-K59333713, (+)-Niguldipine	60602	InChI=1S/C36H39N3O6/c1-25-31(34(40)44-3)33(27-12-10-17-30(24-27)39(42)43)32(26(2)37-25)35(41)45-23-11-20-38-21-18-36(19-22-38,28-13-6-4-7-14-28)29-15-8-5-9-16-29/h4-10,12-17,24,33,37H,11,18-23H2,1-3H3/t33-/m0/s1	SVJMLYUFVDMUHP-XIFFEERXSA-N	COC(=O)C1=C(C)NC(=C([C@H]1c2cccc(c2)[N+](=O)[O-])C(=O)OCCCN3CCC(CC3)(c4ccccc4)c5ccccc5)C	BroadT	BRD-K59333713	BRD-K59333713-003-01-2	Tocris Bioscience	1123	1	Cl	COC(=O)C1=C(C)NC(C)=C([C@H]1c1cccc(c1)[N+]([O-])=O)C(=O)OCCCN1CCC(CC1)(c1ccccc1)c1ccccc1.Cl	InChI=1S/C36H39N3O6.ClH/c1-25-31(34(40)44-3)33(27-12-10-17-30(24-27)39(42)43)32(26(2)37-25)35(41)45-23-11-20-38-21-18-36(19-22-38,28-13-6-4-7-14-28)29-15-8-5-9-16-29;/h4-10,12-17,24,33,37H,11,18-23H2,1-3H3;1H/t33-;/m0./s1	MHOSUIMBPQVOEU-WAQYZQTGSA-N	609.283885998							103931, 103931
Tolnaftate	LSM-5554	Tritin, Tolnaftate, Tinactin, Aftate, SCH-10144, Dr. Scholl'S Athlete'S Foot Spray	5510	InChI=1S/C19H17NOS/c1-14-6-5-9-17(12-14)20(2)19(22)21-18-11-10-15-7-3-4-8-16(15)13-18/h3-13H,1-2H3	FUSNMLFNXJSCDI-UHFFFAOYSA-N	CN(C(=S)Oc1ccc2ccccc2c1)c3cccc(C)c3	BroadT	BRD-K44273375	BRD-K44273375-001-04-5	Prestwick Chemical Inc.	Prestw-70	D0701-MP04-ST03-200-		CN(C(=S)Oc1ccc2ccccc2c1)c1cccc(C)c1	InChI=1S/C19H17NOS/c1-14-6-5-9-17(12-14)20(2)19(22)21-18-11-10-15-7-3-4-8-16(15)13-18/h3-13H,1-2H3	FUSNMLFNXJSCDI-UHFFFAOYSA-N	307.103084864							9620
Tyrphostin 23	LSM-3091	Tyrphostin-Ag-18, Tyrphostin Ag18, AG-18, Tyrphostin Ag 18	2052	InChI=1S/C10H6N2O2/c11-5-8(6-12)3-7-1-2-9(13)10(14)4-7/h1-4,13-14H	VTJXFTPMFYAJJU-UHFFFAOYSA-N	Oc1ccc(C=C(C#N)C#N)cc1O	BroadT	BRD-K49657628	BRD-K49657628-001-02-3	Calbiochem	658395			Oc1ccc(C=C(C#N)C#N)cc1O	InChI=1S/C10H6N2O2/c11-5-8(6-12)3-7-1-2-9(13)10(14)4-7/h1-4,13-14H	VTJXFTPMFYAJJU-UHFFFAOYSA-N	186.042927452							92862
Epicatechin Gallate	LSM-3115	Epicatechin, Epicatechin Gallate, (-)-Epicatechin Gallate, Epicatechin Monogallate	107905	InChI=1S/C22H18O10/c23-11-6-14(25)12-8-19(32-22(30)10-4-16(27)20(29)17(28)5-10)21(31-18(12)7-11)9-1-2-13(24)15(26)3-9/h1-7,19,21,23-29H,8H2/t19-,21-/m1/s1	LSHVYAFMTMFKBA-TZIWHRDSSA-N	Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c4ccc(O)c(O)c4	BroadT	BRD-K50660797	BRD-K50660797-001-02-8	MicroSource Discovery Systems Inc.	210238			Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c1ccc(O)c(O)c1	InChI=1S/C22H18O10/c23-11-6-14(25)12-8-19(32-22(30)10-4-16(27)20(29)17(28)5-10)21(31-18(12)7-11)9-1-2-13(24)15(26)3-9/h1-7,19,21,23-29H,8H2/t19-,21-/m1/s1	LSHVYAFMTMFKBA-TZIWHRDSSA-N	442.089996776							70255
(-)-U-50488	LSM-19013	U-50488, (-)-U-50488, (-)-U-50488H	6604724	InChI=1S/C19H26Cl2N2O/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23/h8-9,12,17-18H,2-7,10-11,13H2,1H3/t17-,18-/m0/s1	VQLPLYSROCPWFF-ROUUACIJSA-N	CN([C@H]1CCCC[C@@H]1N2CCCC2)C(=O)Cc3ccc(Cl)c(Cl)c3	BroadT	BRD-K53532120	BRD-K53532120-001-02-4	Biomol International Inc.	N-701	2840(V2)-3-N1305		CN([C@H]1CCCC[C@@H]1N1CCCC1)C(=O)Cc1ccc(Cl)c(Cl)c1	InChI=1S/C19H26Cl2N2O/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23/h8-9,12,17-18H,2-7,10-11,13H2,1H3/t17-,18-/m0/s1	VQLPLYSROCPWFF-ROUUACIJSA-N	368.142218892							107647, 107647, 107647
MK2A Inhibitor	LSM-3203	BRD-K54095730, SID26753219	11382492	InChI=1S/C22H20FNO2/c23-21-6-2-1-5-20(21)17-10-8-16(9-11-17)4-3-7-22(26)24-18-12-14-19(25)15-13-18/h1-2,5-6,8-15,25H,3-4,7H2,(H,24,26)	ODYAQBDIXCVKAE-UHFFFAOYSA-N	Oc1ccc(NC(=O)CCCc2ccc(cc2)c3ccccc3F)cc1	BroadT	BRD-K54095730	BRD-K54095730-001-01-5	Tocris Bioscience	2186	2		Oc1ccc(NC(=O)CCCc2ccc(cc2)-c2ccccc2F)cc1	InChI=1S/C22H20FNO2/c23-21-6-2-1-5-20(21)17-10-8-16(9-11-17)4-3-7-22(26)24-18-12-14-19(25)15-13-18/h1-2,5-6,8-15,25H,3-4,7H2,(H,24,26)	ODYAQBDIXCVKAE-UHFFFAOYSA-N	349.14780709							92949
Trioxsalen	LSM-3223	Trioxsalen, Trioxysalen, Trisoralen	5585	InChI=1S/C14H12O3/c1-7-4-12(15)17-14-9(3)13-10(6-11(7)14)5-8(2)16-13/h4-6H,1-3H3	FMHHVULEAZTJMA-UHFFFAOYSA-N	CC1=CC(=O)Oc2c(C)c3oc(C)cc3cc12	BroadT	BRD-K54790157	BRD-K54790157-001-03-1	AnalytiCon Discovery GmbH	NP-010961			Cc1cc2cc3c(C)cc(=O)oc3c(C)c2o1	InChI=1S/C14H12O3/c1-7-4-12(15)17-14-9(3)13-10(6-11(7)14)5-8(2)16-13/h4-6H,1-3H3	FMHHVULEAZTJMA-UHFFFAOYSA-N	228.078644244							28329
GR-103691	LSM-3121	GR 103691, GR-103691	4302960	InChI=1S/C30H35N3O3/c1-23(34)24-9-11-25(12-10-24)26-13-15-27(16-14-26)30(35)31-17-5-6-18-32-19-21-33(22-20-32)28-7-3-4-8-29(28)36-2/h3-4,7-16H,5-6,17-22H2,1-2H3,(H,31,35)	JARNORYOPMINDY-UHFFFAOYSA-N	COc1ccccc1N2CCN(CCCCNC(=O)c3ccc(cc3)c4ccc(cc4)C(=O)C)CC2	BroadT	BRD-K50891186	BRD-K50891186-001-01-0	Biomol International Inc.	AC-256	2812-3-N1298		COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(cc2)-c2ccc(cc2)C(C)=O)CC1	InChI=1S/C30H35N3O3/c1-23(34)24-9-11-25(12-10-24)26-13-15-27(16-14-26)30(35)31-17-5-6-18-32-19-21-33(22-20-32)28-7-3-4-8-29(28)36-2/h3-4,7-16H,5-6,17-22H2,1-2H3,(H,31,35)	JARNORYOPMINDY-UHFFFAOYSA-N	485.26784201							92882
W 5	LSM-2932	W-5, SID11113467	4314	InChI=1S/C16H22N2O2S/c17-12-5-1-2-6-13-18-21(19,20)16-11-7-9-14-8-3-4-10-15(14)16/h3-4,7-11,18H,1-2,5-6,12-13,17H2	FVJRBJIENDRNBE-UHFFFAOYSA-N	NCCCCCCNS(=O)(=O)c1cccc2ccccc12	BroadT	BRD-K41868777	BRD-K41868777-003-02-9	Tocris Bioscience	368	2	Cl	NCCCCCCNS(=O)(=O)c1cccc2ccccc12.Cl	InChI=1S/C16H22N2O2S.ClH/c17-12-5-1-2-6-13-18-21(19,20)16-11-7-9-14-8-3-4-10-15(14)16;/h3-4,7-11,18H,1-2,5-6,12-13,17H2;1H	HOCSVIGHWPLMFC-UHFFFAOYSA-N	306.140198654							92739, 92739
RS 67506	LSM-3100	RS-67506	133076	InChI=1S/C18H28ClN3O4S/c1-26-18-12-16(20)15(19)11-14(18)17(23)4-3-13-5-8-22(9-6-13)10-7-21-27(2,24)25/h11-13,21H,3-10,20H2,1-2H3	UATDVRSFFGFTAI-UHFFFAOYSA-N	COc1cc(N)c(Cl)cc1C(=O)CCC2CCN(CCNS(=O)(=O)C)CC2	BroadT	BRD-K50018155	BRD-K50018155-003-01-3	Tocris Bioscience	990	2	Cl	COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(CCNS(C)(=O)=O)CC1.Cl	InChI=1S/C18H28ClN3O4S.ClH/c1-26-18-12-16(20)15(19)11-14(18)17(23)4-3-13-5-8-22(9-6-13)10-7-21-27(2,24)25;/h11-13,21H,3-10,20H2,1-2H3;1H	GFWKWEHKHLTRRF-UHFFFAOYSA-N	417.148904806							92869
SB-202190	LSM-3209	SB-202190	5353940	InChI=1S/C20H14FN3O/c21-16-5-1-13(2-6-16)18-19(14-9-11-22-12-10-14)24-20(23-18)15-3-7-17(25)8-4-15/h1-12,25H,(H,23,24)	QHKYPYXTTXKZST-UHFFFAOYSA-N	Oc1ccc(cc1)c2nc(c3ccc(F)cc3)c([nH]2)c4ccncc4	BroadT	BRD-K54330070	BRD-K54330070-001-05-5	Biomol International Inc.	EI-294	2840(V2)-3-N1305		Oc1ccc(cc1)-c1nc(c([nH]1)-c1ccncc1)-c1ccc(F)cc1	InChI=1S/C20H14FN3O/c21-16-5-1-13(2-6-16)18-19(14-9-11-22-12-10-14)24-20(23-18)15-3-7-17(25)8-4-15/h1-12,25H,(H,23,24)	QHKYPYXTTXKZST-UHFFFAOYSA-N	331.112090298							79090
Valacyclovir	LSM-5571	Valaciclovir	60773	InChI=1S/C13H20N6O4/c1-7(2)8(14)12(21)23-4-3-22-6-19-5-16-9-10(19)17-13(15)18-11(9)20/h5,7-8H,3-4,6,14H2,1-2H3,(H3,15,17,18,20)/t8-/m0/s1	HDOVUKNUBWVHOX-QMMMGPOBSA-N	CC(C)[C@H](N)C(=O)OCCOCn1cnc2C(=O)NC(=Nc12)N	BroadT	BRD-K46435977	BRD-K46435977-003-01-2	MicroSource Discovery Systems Inc.	1505368		Cl	CC(C)[C@H](N)C(=O)OCCOCn1cnc2c1nc(N)[nH]c2=O.Cl	InChI=1S/C13H20N6O4.ClH/c1-7(2)8(14)12(21)23-4-3-22-6-19-5-16-9-10(19)17-13(15)18-11(9)20;/h5,7-8H,3-4,6,14H2,1-2H3,(H3,15,17,18,20);1H/t8-;/m0./s1	ZCDDBUOENGJMLV-QRPNPIFTSA-N	324.15460318							35854, 35854, 35854
Dexamethasone 21-acetate	LSM-3049	SID56423129, SID855773, Dexamethasone Acetate	236702	InChI=1S/C24H31FO6/c1-13-9-18-17-6-5-15-10-16(27)7-8-21(15,3)23(17,25)19(28)11-22(18,4)24(13,30)20(29)12-31-14(2)26/h7-8,10,13,17-19,28,30H,5-6,9,11-12H2,1-4H3/t13-,17+,18+,19+,21+,22+,23+,24+/m1/s1	AKUJBENLRBOFTD-RPRRAYFGSA-N	C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)C	BroadT	BRD-K47635719	BRD-K47635719-001-03-9	Prestwick Chemical Inc.	Prestw-130	D0701-MP04-ST03-200-		C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(C)=O	InChI=1S/C24H31FO6/c1-13-9-18-17-6-5-15-10-16(27)7-8-21(15,3)23(17,25)19(28)11-22(18,4)24(13,30)20(29)12-31-14(2)26/h7-8,10,13,17-19,28,30H,5-6,9,11-12H2,1-4H3/t13-,17+,18+,19+,21+,22+,23+,24+/m1/s1	AKUJBENLRBOFTD-RPRRAYFGSA-N	434.210466912							4463
Prednicarbate	LSM-3017	Dermatop, Prednicarbate, HOE-777, S-77 0777, S-770777, Dermatop E Emollient	6714002	InChI=1S/C27H36O8/c1-5-22(31)34-15-21(30)27(35-24(32)33-6-2)12-10-19-18-8-7-16-13-17(28)9-11-25(16,3)23(18)20(29)14-26(19,27)4/h9,11,13,18-20,23,29H,5-8,10,12,14-15H2,1-4H3/t18-,19-,20-,23+,25-,26-,27-/m0/s1	FNPXMHRZILFCKX-KAJVQRHHSA-N	CCOC(=O)O[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]12C)C(=O)COC(=O)CC	BroadT	BRD-K46137903	BRD-K46137903-001-03-3	Prestwick Chemical Inc.	Prestw-1044	D0701-MP04-ST03-200-		CCOC(=O)O[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]12C)C(=O)COC(=O)CC	InChI=1S/C27H36O8/c1-5-22(31)34-15-21(30)27(35-24(32)33-6-2)12-10-19-18-8-7-16-13-17(28)9-11-25(16,3)23(18)20(29)14-26(19,27)4/h9,11,13,18-20,23,29H,5-8,10,12,14-15H2,1-4H3/t18-,19-,20-,23+,25-,26-,27-/m0/s1	FNPXMHRZILFCKX-KAJVQRHHSA-N	488.241018112							
Danazol	LSM-3073	Danazol, Danocrine, WIN-17757	28417	InChI=1S/C22H27NO2/c1-4-22(24)10-8-18-16-6-5-15-11-19-14(13-23-25-19)12-20(15,2)17(16)7-9-21(18,22)3/h1,11,13,16-18,24H,5-10,12H2,2-3H3/t16-,17+,18+,20+,21+,22+/m1/s1	POZRVZJJTULAOH-LHZXLZLDSA-N	C[C@]12Cc3cnoc3C=C1CC[C@@H]4[C@@H]2CC[C@@]5(C)[C@H]4CC[C@@]5(O)C#C	BroadT	BRD-K48970916	BRD-K48970916-001-03-0	Prestwick Chemical Inc.	Prestw-105	D0701-MP04-ST03-200-		C[C@]12CC[C@H]3[C@@H](CCC4=Cc5oncc5C[C@]34C)[C@@H]1CC[C@@]2(O)C#C	InChI=1S/C22H27NO2/c1-4-22(24)10-8-18-16-6-5-15-11-19-14(13-23-25-19)12-20(15,2)17(16)7-9-21(18,22)3/h1,11,13,16-18,24H,5-10,12H2,2-3H3/t16-,17+,18+,20+,21+,22+/m1/s1	POZRVZJJTULAOH-LHZXLZLDSA-N	337.204179114							4315
Captopril	LSM-5648	Tensobon, Lopril, Captopril, Capoten, SQ-14225	44093	InChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/t6-,7+/m1/s1	FAKRSMQSSFJEIM-RQJHMYQMSA-N	C[C@H](CS)C(=O)N1CCC[C@H]1C(=O)O	BroadT	BRD-K54529596	BRD-K54529596-001-04-0	Prestwick Chemical Inc.	Prestw-19	D0701-MP04-ST03-200-		C[C@H](CS)C(=O)N1CCC[C@H]1C(O)=O	InChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/t6-,7+/m1/s1	FAKRSMQSSFJEIM-RQJHMYQMSA-N	217.07726404							3380
Levosulpiride	LSM-5624	Levosulpiride, Sulpiride	688272	InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)/t11-/m0/s1	BGRJTUBHPOOWDU-NSHDSACASA-N	CCN1CCC[C@H]1CNC(=O)c2cc(ccc2OC)S(=O)(=O)N	BroadT	BRD-K51671335	BRD-K51671335-001-01-5	Biomol International Inc.	AC-760	2812-3-N1298		CCN1CCC[C@H]1CNC(=O)c1cc(ccc1OC)S(N)(=O)=O	InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)/t11-/m0/s1	BGRJTUBHPOOWDU-NSHDSACASA-N	341.140926936							64119
Indomethacin	LSM-3275	Indometacin, Indomethacin, Indocin, Indometacin Farnesil, Indocin SR, Indo-Lemmon	3715	InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)	CGIGDMFJXJATDK-UHFFFAOYSA-N	COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c3ccc(Cl)cc3	BroadT	BRD-K57222227	BRD-K57222227-001-06-1	Biomol International Inc.	EI-131	2840(V2)-3-N1305		COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1	InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)	CGIGDMFJXJATDK-UHFFFAOYSA-N	357.076785712							49662, 49662, 49662
Cirazoline	LSM-3204	Cirazoline	2765	InChI=1S/C13H16N2O/c1-2-4-12(11(3-1)10-5-6-10)16-9-13-14-7-8-15-13/h1-4,10H,5-9H2,(H,14,15)	YAORIDZYZDUZCM-UHFFFAOYSA-N	C(Oc1ccccc1C2CC2)C3=NCCN3	BroadT	BRD-K54142781	BRD-K54142781-001-02-1	Biomol International Inc.	AC-136	2840(V2)-3-N1305		C(Oc1ccccc1C1CC1)C1=NCCN1	InChI=1S/C13H16N2O/c1-2-4-12(11(3-1)10-5-6-10)16-9-13-14-7-8-15-13/h1-4,10H,5-9H2,(H,14,15)	YAORIDZYZDUZCM-UHFFFAOYSA-N	216.126263152							92950, 92950
UCL 2077	LSM-3106	BRD-K50325075, SID50112958, SID90340723	24868317	InChI=1S/C25H22N2/c1-4-12-22(13-5-1)25(23-14-6-2-7-15-23,24-16-8-3-9-17-24)27-20-21-11-10-18-26-19-21/h1-19,27H,20H2	PQFNWDHABGBCHB-UHFFFAOYSA-N	C(NC(c1ccccc1)(c2ccccc2)c3ccccc3)c4cccnc4	BroadT	BRD-K50325075	BRD-K50325075-001-01-3	Tocris Bioscience	2661	1		C(NC(c1ccccc1)(c1ccccc1)c1ccccc1)c1cccnc1	InChI=1S/C25H22N2/c1-4-12-22(13-5-1)25(23-14-6-2-7-15-23,24-16-8-3-9-17-24)27-20-21-11-10-18-26-19-21/h1-19,27H,20H2	PQFNWDHABGBCHB-UHFFFAOYSA-N	350.178298724							92873
Hycanthone	LSM-5614	Hycanthone, WIN-24933, Hycanthone Methanesulfonate	3634	InChI=1S/C20H24N2O2S/c1-3-22(4-2)12-11-21-16-10-9-14(13-23)20-18(16)19(24)15-7-5-6-8-17(15)25-20/h5-10,21,23H,3-4,11-13H2,1-2H3	MFZWMTSUNYWVBU-UHFFFAOYSA-N	CCN(CC)CCNc1ccc(CO)c2Sc3ccccc3C(=O)c12	BroadT	BRD-K50406511	BRD-K50406511-001-04-7	MicroSource Discovery Systems Inc.	1503239			CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12	InChI=1S/C20H24N2O2S/c1-3-22(4-2)12-11-21-16-10-9-14(13-23)20-18(16)19(24)15-7-5-6-8-17(15)25-20/h5-10,21,23H,3-4,11-13H2,1-2H3	MFZWMTSUNYWVBU-UHFFFAOYSA-N	356.155848718							52768, 52768
Cnqx	LSM-3184	6-Cyano-7-Nitroquinoxaline-2,3-Dione, SID11113401, SID11113878, SID26751641, BRD-K53545112	3721046	InChI=1S/C9H4N4O4/c10-3-4-1-5-6(2-7(4)13(16)17)12-9(15)8(14)11-5/h1-2H,(H,11,14)(H,12,15)	RPXVIAFEQBNEAX-UHFFFAOYSA-N	Oc1nc2cc(C#N)c(cc2nc1O)[N+](=O)[O-]	BroadT	BRD-K53545112	BRD-K53545112-304-01-6	Tocris Bioscience	1045	16	[Na].[Na]	Oc1nc2cc(C#N)c(cc2nc1O)[N+]([O-])=O.[Na].[Na]	InChI=1S/C9H4N4O4.2Na.2H/c10-3-4-1-5-6(2-7(4)13(16)17)12-9(15)8(14)11-5;;;;/h1-2H,(H,11,14)(H,12,15);;;;	ARAMCRUCCJOEAC-UHFFFAOYSA-N	232.023254648							34468, 34468
Cyclobenzaprine	LSM-5537	Cyclobenzaprine, Flexeril	2895	InChI=1S/C20H21N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-14H,7,15H2,1-2H3	JURKNVYFZMSNLP-UHFFFAOYSA-N	CN(C)CCC=C1c2ccccc2C=Cc3ccccc13	BroadT	BRD-K42348709	BRD-K42348709-003-04-0	MicroSource Discovery Systems Inc.	1503207		Cl	CN(C)CCC=C1c2ccccc2C=Cc2ccccc12.Cl	InChI=1S/C20H21N.ClH/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20;/h3-6,8-14H,7,15H2,1-2H3;1H	VXEAYBOGHINOKW-UHFFFAOYSA-N	275.167399682							3996, 3996
Pentoxifylline	LSM-3285	Pentoxifylline, Trental, Pentoxil, Oxpentifylline, BL-191	4740	InChI=1S/C13H18N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8H,4-7H2,1-3H3	BYPFEZZEUUWMEJ-UHFFFAOYSA-N	CN1C(=O)N(CCCCC(=O)C)C(=O)c2c1ncn2C	BroadT	BRD-K57569181	BRD-K57569181-001-04-4	MicroSource Discovery Systems Inc.	1503611			CC(=O)CCCCn1c(=O)n(C)c2ncn(C)c2c1=O	InChI=1S/C13H18N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8H,4-7H2,1-3H3	BYPFEZZEUUWMEJ-UHFFFAOYSA-N	278.137890476							7986
Andreson	LSM-2965	Cortisone, SID144205092, SID26751583, SID50104218	222786	InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1	MFYSYFVPBJMHGN-ZPOLXVRWSA-N	C[C@]12CCC(=O)C=C1CC[C@H]3[C@@H]4CC[C@](O)(C(=O)CO)[C@@]4(C)CC(=O)[C@H]23	BroadT	BRD-K43736954	BRD-K43736954-001-03-3	Prestwick Chemical Inc.	Prestw-273	D0701-MP04-ST03-200-		C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO	InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1	MFYSYFVPBJMHGN-ZPOLXVRWSA-N	360.193673996							16962
CGP 57380	LSM-2944	BRD-K42500029	11644425	InChI=1S/C11H9FN6/c12-6-1-3-7(4-2-6)16-11-8-9(13)14-5-15-10(8)17-18-11/h1-5H,(H4,13,14,15,16,17,18)	UQPMANVRZYYQMD-UHFFFAOYSA-N	Nc1ncnc2[nH]nc(Nc3ccc(F)cc3)c12	BroadT	BRD-K42500029	BRD-K42500029-001-01-9	Tocris Bioscience	2731	1		Nc1ncnc2[nH]nc(Nc3ccc(F)cc3)c12	InChI=1S/C11H9FN6/c12-6-1-3-7(4-2-6)16-11-8-9(13)14-5-15-10(8)17-18-11/h1-5H,(H4,13,14,15,16,17,18)	UQPMANVRZYYQMD-UHFFFAOYSA-N	244.087272548							92749
1H-Indole-2-carboxylicacid, 4,6-dichloro-3-[(1e)-3-oxo-3-(phenylamino)-1-propen-1-yl]-	LSM-3097	BRD-K49890030, SID137275950	3086670	InChI=1S/C18H12Cl2N2O3/c19-10-8-13(20)16-12(17(18(24)25)22-14(16)9-10)6-7-15(23)21-11-4-2-1-3-5-11/h1-9,22H,(H,21,23)(H,24,25)	WZBNEZWCNKUOSM-UHFFFAOYSA-N	OC(=O)c1[nH]c2cc(Cl)cc(Cl)c2c1C=CC(=O)Nc3ccccc3	BroadT	BRD-K49890030	BRD-K49890030-236-01-6	Tocris Bioscience	2348	1	[Na]	OC(=O)c1[nH]c2cc(Cl)cc(Cl)c2c1C=CC(=O)Nc1ccccc1.[Na]	InChI=1S/C18H12Cl2N2O3.Na.H/c19-10-8-13(20)16-12(17(18(24)25)22-14(16)9-10)6-7-15(23)21-11-4-2-1-3-5-11;;/h1-9,22H,(H,21,23)(H,24,25);;	KVELFZNUFZOWKE-UHFFFAOYSA-N	374.022497684							92867
3-Deoxy-3beta-hydroxyangolensic acid methyl ester	LSM-19014	BRD-K54554531	6710724	InChI=1S/C27H36O7/c1-15-17-7-9-25(4)23(16-8-10-32-14-16)33-22(30)13-27(15,25)34-20-12-19(28)24(2,3)18(26(17,20)5)11-21(29)31-6/h8,10,14,17-20,23,28H,1,7,9,11-13H2,2-6H3/t17-,18+,19+,20+,23+,25+,26-,27+/m1/s1	QFRUZVNPYYYLAN-JQFPPNBKSA-N	COC(=O)C[C@H]1C(C)(C)[C@@H](O)C[C@@H]2O[C@]34CC(=O)O[C@@H](c5cocc5)[C@]3(C)CC[C@H](C4=C)[C@]12C	BroadT	BRD-K54554531	BRD-K54554531-001-01-2	MicroSource Discovery Systems Inc.	100096			COC(=O)C[C@H]1C(C)(C)[C@@H](O)C[C@@H]2O[C@]34CC(=O)O[C@@H](c5ccoc5)[C@]3(C)CC[C@H](C4=C)[C@]12C	InChI=1S/C27H36O7/c1-15-17-7-9-25(4)23(16-8-10-32-14-16)33-22(30)13-27(15,25)34-20-12-19(28)24(2,3)18(26(17,20)5)11-21(29)31-6/h8,10,14,17-20,23,28H,1,7,9,11-13H2,2-6H3/t17-,18+,19+,20+,23+,25+,26-,27+/m1/s1	QFRUZVNPYYYLAN-JQFPPNBKSA-N	472.246103492							
27277-00-5	LSM-3155	BRD-K52219182, SID11114227, SID90341538	62824	InChI=1S/C9H13N5O/c1-3-4-13-7(15)6(2)5-14-9(13)11-8(10)12-14/h5H,3-4H2,1-2H3,(H2,10,12)	UQDVRVNMIJAGRK-UHFFFAOYSA-N	CCCN1C(=O)C(=Cn2nc(N)nc12)C	BroadT	BRD-K52219182	BRD-K52219182-001-01-6	Tocris Bioscience	1816	2		CCCn1c2nc(N)nn2cc(C)c1=O	InChI=1S/C9H13N5O/c1-3-4-13-7(15)6(2)5-14-9(13)11-8(10)12-14/h5H,3-4H2,1-2H3,(H2,10,12)	UQDVRVNMIJAGRK-UHFFFAOYSA-N	207.112010086							92909
Metergoline	LSM-3265	Metergoline, FI-6337	28693	InChI=1S/C25H29N3O2/c1-27-14-18(13-26-25(29)30-16-17-7-4-3-5-8-17)11-21-20-9-6-10-22-24(20)19(12-23(21)27)15-28(22)2/h3-10,15,18,21,23H,11-14,16H2,1-2H3,(H,26,29)/t18-,21+,23+/m0/s1	WZHJKEUHNJHDLS-QTGUNEKASA-N	CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@H]3[C@H]1Cc4cn(C)c5cccc3c45	BroadT	BRD-K56699285	BRD-K56699285-001-03-7	Biomol International Inc.	AC-553	2813-N1283		CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@H]2[C@H]1Cc1cn(C)c3cccc2c13	InChI=1S/C25H29N3O2/c1-27-14-18(13-26-25(29)30-16-17-7-4-3-5-8-17)11-21-20-9-6-10-22-24(20)19(12-23(21)27)15-28(22)2/h3-10,15,18,21,23H,11-14,16H2,1-2H3,(H,26,29)/t18-,21+,23+/m0/s1	WZHJKEUHNJHDLS-QTGUNEKASA-N	403.225977198							64216, 64216
8-Methoxymethyl-ibmx	LSM-3194	BRD-K53878242	155806	InChI=1S/C12H18N4O3/c1-7(2)5-16-10-9(11(17)15(3)12(16)18)13-8(14-10)6-19-4/h7H,5-6H2,1-4H3,(H,13,14)	NBLBCGUCPBXKOV-UHFFFAOYSA-N	COCc1nc2C(=O)N(C)C(=O)N(CC(C)C)c2[nH]1	BroadT	BRD-K56077740	BRD-K56077740-001-03-5	Biomol International Inc.	PD-150	2840(V2)-3-N1305		COCc1nc2n(CC(C)C)c(=O)n(C)c(=O)c2[nH]1	InChI=1S/C12H18N4O3/c1-7(2)5-16-10-9(11(17)15(3)12(16)18)13-8(14-10)6-19-4/h7H,5-6H2,1-4H3,(H,13,14)	NBLBCGUCPBXKOV-UHFFFAOYSA-N	266.137890476							92940
Chlorophenothane	LSM-19015	Penticide, Dicophane, Clofenotane, Chlorphenotane, Chlorophenothane	3036	InChI=1S/C14H9Cl5/c15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10/h1-8,13H	YVGGHNCTFXOJCH-UHFFFAOYSA-N	Clc1ccc(cc1)C(c2ccc(Cl)cc2)C(Cl)(Cl)Cl	BroadT	BRD-K51799616	BRD-K51799616-001-02-2	MicroSource Discovery Systems Inc.	330070			Clc1ccc(cc1)C(c1ccc(Cl)cc1)C(Cl)(Cl)Cl	InChI=1S/C14H9Cl5/c15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10/h1-8,13H	YVGGHNCTFXOJCH-UHFFFAOYSA-N	351.914688838							16130
Naproxen	LSM-5689	Naproxen, Naprosyn, Naprelan, Equiproxen, Anaprox, Aleve, RS-3540, EC-Naprosyn	156391	InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)/t9-/m0/s1	CMWTZPSULFXXJA-VIFPVBQESA-N	COc1ccc2cc(ccc2c1)[C@H](C)C(=O)O	BroadT	BRD-K59197931	BRD-K59197931-001-02-9	MicroSource Discovery Systems Inc.	1500425			COc1ccc2cc(ccc2c1)[C@H](C)C(O)=O	InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)/t9-/m0/s1	CMWTZPSULFXXJA-VIFPVBQESA-N	230.094294308							7476, 7476
Tyramine	LSM-19016	Tyramine	5610	InChI=1S/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H2	DZGWFCGJZKJUFP-UHFFFAOYSA-N	NCCc1ccc(O)cc1	BroadT	BRD-K53893978	BRD-K53893978-001-02-3	MicroSource Discovery Systems Inc.	210400			NCCc1ccc(O)cc1	InChI=1S/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H2	DZGWFCGJZKJUFP-UHFFFAOYSA-N	137.084063982							15760, 15760
RHC80267	LSM-3249	RHC-80267, SID26754512, SID29215511	5063	InChI=1S/C20H34N4O4/c25-19(27-23-17-11-5-3-6-12-17)21-15-9-1-2-10-16-22-20(26)28-24-18-13-7-4-8-14-18/h1-16H2,(H,21,25)(H,22,26)	RXSVYGIGWRDVQC-UHFFFAOYSA-N	O=C(NCCCCCCNC(=O)ON=C1CCCCC1)ON=C2CCCCC2	BroadT	BRD-K56047318	BRD-K56047318-001-02-2	Biomol International Inc.	ST-300	2840(V2)-3-N1305		O=C(NCCCCCCNC(=O)ON=C1CCCCC1)ON=C1CCCCC1	InChI=1S/C20H34N4O4/c25-19(27-23-17-11-5-3-6-12-17)21-15-9-1-2-10-16-22-20(26)28-24-18-13-7-4-8-14-18/h1-16H2,(H,21,25)(H,22,26)	RXSVYGIGWRDVQC-UHFFFAOYSA-N	394.258005608							92984
Glimepiride	LSM-2760	BRD-K42693031, SID11112876	3476	InChI=1S/C24H34N4O5S/c1-4-21-17(3)15-28(22(21)29)24(31)25-14-13-18-7-11-20(12-8-18)34(32,33)27-23(30)26-19-9-5-16(2)6-10-19/h7-8,11-12,16,19H,4-6,9-10,13-15H2,1-3H3,(H,25,31)(H2,26,27,30)	WIGIZIANZCJQQY-UHFFFAOYSA-N	CCC1=C(C)CN(C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)NC3CCC(C)CC3)C1=O	BroadT	BRD-K42693031	BRD-K42693031-001-01-8	Tocris Bioscience	2396	1		CCC1=C(C)CN(C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)NC2CCC(C)CC2)C1=O	InChI=1S/C24H34N4O5S/c1-4-21-17(3)15-28(22(21)29)24(31)25-14-13-18-7-11-20(12-8-18)34(32,33)27-23(30)26-19-9-5-16(2)6-10-19/h7-8,11-12,16,19H,4-6,9-10,13-15H2,1-3H3,(H,25,31)(H2,26,27,30)	WIGIZIANZCJQQY-UHFFFAOYSA-N	490.224990918							92609
Robustic acid	LSM-3210	Robustic Acid	54677407	InChI=1S/C22H20O6/c1-22(2)10-9-14-15(28-22)11-16-18(20(14)26-4)19(23)17(21(24)27-16)12-5-7-13(25-3)8-6-12/h5-11,23H,1-4H3	MBZKDBQDALOSRP-UHFFFAOYSA-N	COc1ccc(cc1)C2=C(O)c3c(OC2=O)cc4OC(C)(C)C=Cc4c3OC	BroadT	BRD-K54411430	BRD-K54411430-001-02-5	MicroSource Discovery Systems Inc.	240673			COc1ccc(cc1)-c1c(O)c2c(OC)c3C=CC(C)(C)Oc3cc2oc1=O	InChI=1S/C22H20O6/c1-22(2)10-9-14-15(28-22)11-16-18(20(14)26-4)19(23)17(21(24)27-16)12-5-7-13(25-3)8-6-12/h5-11,23H,1-4H3	MBZKDBQDALOSRP-UHFFFAOYSA-N	380.12598836							92953
Famciclovir	LSM-2990	Famciclovir, Famvir, BRL-42810	3324	InChI=1S/C14H19N5O4/c1-9(20)22-6-11(7-23-10(2)21)3-4-19-8-17-12-5-16-14(15)18-13(12)19/h5,8,11H,3-4,6-7H2,1-2H3,(H2,15,16,18)	GGXKWVWZWMLJEH-UHFFFAOYSA-N	CC(=O)OCC(CCn1cnc2cnc(N)nc12)COC(=O)C	BroadT	BRD-K45033733	BRD-K45033733-001-02-3	MicroSource Discovery Systems Inc.	1505201			CC(=O)OCC(CCn1cnc2cnc(N)nc12)COC(C)=O	InChI=1S/C14H19N5O4/c1-9(20)22-6-11(7-23-10(2)21)3-4-19-8-17-12-5-16-14(15)18-13(12)19/h5,8,11H,3-4,6-7H2,1-2H3,(H2,15,16,18)	GGXKWVWZWMLJEH-UHFFFAOYSA-N	321.143704138							4974
8-Methoxymethyl-ibmx	LSM-3194	BRD-K53878242	155806	InChI=1S/C12H18N4O3/c1-7(2)5-16-10-9(11(17)15(3)12(16)18)13-8(14-10)6-19-4/h7H,5-6H2,1-4H3,(H,13,14)	NBLBCGUCPBXKOV-UHFFFAOYSA-N	COCc1nc2C(=O)N(C)C(=O)N(CC(C)C)c2[nH]1	BroadT	BRD-K53878242	BRD-K53878242-001-02-4	Tocris Bioscience	552	1		COCc1nc2c([nH]1)n(CC(C)C)c(=O)n(C)c2=O	InChI=1S/C12H18N4O3/c1-7(2)5-16-10-9(11(17)15(3)12(16)18)13-8(14-10)6-19-4/h7H,5-6H2,1-4H3,(H,13,14)	NBLBCGUCPBXKOV-UHFFFAOYSA-N	266.137890476							92940
Clomipramine	LSM-3171	Anafranil, Clomipramine	2801	InChI=1S/C19H23ClN2/c1-21(2)12-5-13-22-18-7-4-3-6-15(18)8-9-16-10-11-17(20)14-19(16)22/h3-4,6-7,10-11,14H,5,8-9,12-13H2,1-2H3	GDLIGKIOYRNHDA-UHFFFAOYSA-N	CN(C)CCCN1c2ccccc2CCc3ccc(Cl)cc13	BroadT	BRD-K52989797	BRD-K52989797-001-01-1	Biomol International Inc.	AC-572	2813-N1283		CN(C)CCCN1c2ccccc2CCc2ccc(Cl)cc12	InChI=1S/C19H23ClN2/c1-21(2)12-5-13-22-18-7-4-3-6-15(18)8-9-16-10-11-17(20)14-19(16)22/h3-4,6-7,10-11,14H,5,8-9,12-13H2,1-2H3	GDLIGKIOYRNHDA-UHFFFAOYSA-N	314.154976466							47780, 47780
Crotamiton	LSM-42989	Crotamiton, Crotan, Eurax	688020	InChI=1S/C13H17NO/c1-4-8-13(15)14(5-2)12-10-7-6-9-11(12)3/h4,6-10H,5H2,1-3H3/b8-4+	DNTGGZPQPQTDQF-XBXARRHUSA-N	CCN(C(=O)\C=C\C)c1ccccc1C	BroadT	BRD-K57179821	BRD-K57179821-001-04-8	MicroSource Discovery Systems Inc.	1505271			CCN(C(=O)\C=C\C)c1ccccc1C	InChI=1S/C13H17NO/c1-4-8-13(15)14(5-2)12-10-7-6-9-11(12)3/h4,6-10H,5H2,1-3H3/b8-4+	DNTGGZPQPQTDQF-XBXARRHUSA-N	203.131014174							
Tiapride	LSM-5676	Tiapride, Tiapride HCl	5467	InChI=1S/C15H24N2O4S/c1-5-17(6-2)10-9-16-15(18)13-11-12(22(4,19)20)7-8-14(13)21-3/h7-8,11H,5-6,9-10H2,1-4H3,(H,16,18)	JTVPZMFULRWINT-UHFFFAOYSA-N	CCN(CC)CCNC(=O)c1cc(ccc1OC)S(=O)(=O)C	BroadT	BRD-K57432881	BRD-K57432881-003-04-4	MicroSource Discovery Systems Inc.	1503086		Cl	CCN(CC)CCNC(=O)c1cc(ccc1OC)S(C)(=O)=O.Cl	InChI=1S/C15H24N2O4S.ClH/c1-5-17(6-2)10-9-16-15(18)13-11-12(22(4,19)20)7-8-14(13)21-3;/h7-8,11H,5-6,9-10H2,1-4H3,(H,16,18);1H	OTFDPNXIVHBTKW-UHFFFAOYSA-N	328.145677958							94666, 94666
Zonisamide	LSM-3062	BRD-K48300629	5734	InChI=1S/C8H8N2O3S/c9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2,(H2,9,11,12)	UBQNRHZMVUUOMG-UHFFFAOYSA-N	NS(=O)(=O)Cc1noc2ccccc12	BroadT	BRD-K48300629	BRD-K48300629-001-03-8	Tocris Bioscience	2625	1		NS(=O)(=O)Cc1noc2ccccc12	InChI=1S/C8H8N2O3S/c9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2,(H2,9,11,12)	UBQNRHZMVUUOMG-UHFFFAOYSA-N	212.025562826							10127, 10127, 10127
S-14506	LSM-3034	BRD-K46766488, SID11114210	131906	InChI=1S/C24H26FN3O2/c1-30-21-10-7-18-3-2-4-23(22(18)17-21)28-15-13-27(14-16-28)12-11-26-24(29)19-5-8-20(25)9-6-19/h2-10,17H,11-16H2,1H3,(H,26,29)	IFMQODYDAUKKEN-UHFFFAOYSA-N	COc1ccc2cccc(N3CCN(CCNC(=O)c4ccc(F)cc4)CC3)c2c1	BroadT	BRD-K46766488	BRD-K46766488-003-01-2	Tocris Bioscience	1771	2	Cl	COc1ccc2cccc(N3CCN(CCNC(=O)c4ccc(F)cc4)CC3)c2c1.Cl	InChI=1S/C24H26FN3O2.ClH/c1-30-21-10-7-18-3-2-4-23(22(18)17-21)28-15-13-27(14-16-28)12-11-26-24(29)19-5-8-20(25)9-6-19;/h2-10,17H,11-16H2,1H3,(H,26,29);1H	HWLZKPKZVOLFGK-UHFFFAOYSA-N	407.200905302							64101
Dichlobenil	LSM-19017		3031	InChI=1S/C7H3Cl2N/c8-6-2-1-3-7(9)5(6)4-10/h1-3H	YOYAIZYFCNQIRF-UHFFFAOYSA-N	Clc1cccc(Cl)c1C#N	BroadT	BRD-K43714461	BRD-K43714461-001-02-8	MicroSource Discovery Systems Inc.	330036			Clc1cccc(Cl)c1C#N	InChI=1S/C7H3Cl2N/c8-6-2-1-3-7(9)5(6)4-10/h1-3H	YOYAIZYFCNQIRF-UHFFFAOYSA-N	170.964254526							943
4-Amino-1,8-naphthalimide	LSM-3103	Amino-1,8-Naphthalimide 4-Amino-1,8-Naphthalimide, SID11110714, SID26753511	1720	InChI=1S/C12H8N2O2/c13-9-5-4-8-10-6(9)2-1-3-7(10)11(15)14-12(8)16/h1-5H,13H2,(H,14,15,16)	SSMIFVHARFVINF-UHFFFAOYSA-N	Nc1ccc2C(=O)NC(=O)c3cccc1c23	BroadT	BRD-K50214219	BRD-K50214219-001-02-4	Biomol International Inc.	AP-101	2840(V2)-3-N1305		Nc1ccc2C(=O)NC(=O)c3cccc1c23	InChI=1S/C12H8N2O2/c13-9-5-4-8-10-6(9)2-1-3-7(10)11(15)14-12(8)16/h1-5H,13H2,(H,14,15,16)	SSMIFVHARFVINF-UHFFFAOYSA-N	212.058577516							40071
EO 1428	LSM-1228	BRD-K42452249	9801969	InChI=1S/C20H16BrClN2O/c1-12-4-2-3-5-15(12)20(25)16-8-7-14(11-17(16)22)24-19-9-6-13(21)10-18(19)23/h2-11,24H,23H2,1H3	HDCLCHNAEZNGNV-UHFFFAOYSA-N	Cc1ccccc1C(=O)c2ccc(Nc3ccc(Br)cc3N)cc2Cl	BroadT	BRD-K42452249	BRD-K42452249-001-01-7	Tocris Bioscience	2908	1		Cc1ccccc1C(=O)c1ccc(Nc2ccc(Br)cc2N)cc1Cl	InChI=1S/C20H16BrClN2O/c1-12-4-2-3-5-15(12)20(25)16-8-7-14(11-17(16)22)24-19-9-6-13(21)10-18(19)23/h2-11,24H,23H2,1H3	HDCLCHNAEZNGNV-UHFFFAOYSA-N	414.013453462							91468
Iodophenpropit	LSM-3151	BRD-K51918615	3035746	InChI=1S/C15H19IN4S/c16-13-5-3-12(4-6-13)7-8-19-15(17)21-9-1-2-14-10-18-11-20-14/h3-6,10-11H,1-2,7-9H2,(H2,17,19)(H,18,20)	UBHYDQAARZKHEZ-UHFFFAOYSA-N	Ic1ccc(CCNC(=N)SCCCc2c[nH]cn2)cc1	BroadT	BRD-K51918615	BRD-K51918615-303-01-1	Tocris Bioscience	779	2	Br.Br	Ic1ccc(CCNC(=N)SCCCc2c[nH]cn2)cc1.Br.Br	InChI=1S/C15H19IN4S.2BrH/c16-13-5-3-12(4-6-13)7-8-19-15(17)21-9-1-2-14-10-18-11-20-14;;/h3-6,10-11H,1-2,7-9H2,(H2,17,19)(H,18,20);2*1H	BOSOGNBLIWPCMS-UHFFFAOYSA-N	414.037510338							92905, 92905
ALX-5407	LSM-3197	BRD-K53979406, ALX-5407	6604909	InChI=1S/C24H24FNO3/c1-26(17-24(27)28)16-15-23(20-7-11-21(25)12-8-20)29-22-13-9-19(10-14-22)18-5-3-2-4-6-18/h2-14,23H,15-17H2,1H3,(H,27,28)/t23-/m1/s1	FDORQEIHOKEJNX-HSZRJFAPSA-N	CN(CC[C@@H](Oc1ccc(cc1)c2ccccc2)c3ccc(F)cc3)CC(=O)O	BroadT	BRD-K53979406	BRD-K53979406-003-01-0	Tocris Bioscience	1757	2	Cl	CN(CC[C@@H](Oc1ccc(cc1)-c1ccccc1)c1ccc(F)cc1)CC(O)=O.Cl	InChI=1S/C24H24FNO3.ClH/c1-26(17-24(27)28)16-15-23(20-7-11-21(25)12-8-20)29-22-13-9-19(10-14-22)18-5-3-2-4-6-18;/h2-14,23H,15-17H2,1H3,(H,27,28);1H/t23-;/m1./s1	RPDGSZCYSJWQEE-GNAFDRTKSA-N	393.174021838							92943
L-Phenylalaninol	LSM-19018	SID93576654, L-Phenylalaninol, L-Phenyl Alaninol	447213	InChI=1S/C9H13NO/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9,11H,6-7,10H2/t9-/m0/s1	STVVMTBJNDTZBF-VIFPVBQESA-N	N[C@H](CO)Cc1ccccc1	BroadT	BRD-K44204252	BRD-K44204252-001-02-2	MicroSource Discovery Systems Inc.	1505339			N[C@H](CO)Cc1ccccc1	InChI=1S/C9H13NO/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9,11H,6-7,10H2/t9-/m0/s1	STVVMTBJNDTZBF-VIFPVBQESA-N	151.099714046							
Sulfadoxine	LSM-5657	Sulphormethoxine, Sulforthamidine, Sulfadoxine, Fanzil, Fanasil, RO-44393	17134	InChI=1S/C12H14N4O4S/c1-19-10-11(14-7-15-12(10)20-2)16-21(17,18)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H,14,15,16)	PJSFRIWCGOHTNF-UHFFFAOYSA-N	COc1ncnc(NS(=O)(=O)c2ccc(N)cc2)c1OC	BroadT	BRD-K55250441	BRD-K55250441-001-03-1	Prestwick Chemical Inc.	Prestw-1094	D0701-MP04-ST03-200-		COc1ncnc(NS(=O)(=O)c2ccc(N)cc2)c1OC	InChI=1S/C12H14N4O4S/c1-19-10-11(14-7-15-12(10)20-2)16-21(17,18)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H,14,15,16)	PJSFRIWCGOHTNF-UHFFFAOYSA-N	310.073575658							9329
ICI 215001	LSM-3063	BRD-K48311056, SID11113797	6604779	InChI=1S/C19H23NO6/c21-15(13-25-16-4-2-1-3-5-16)12-20-10-11-24-17-6-8-18(9-7-17)26-14-19(22)23/h1-9,15,20-21H,10-14H2,(H,22,23)/t15-/m1/s1	MXWICZOXPUWAHY-OAHLLOKOSA-N	O[C@H](CNCCOc1ccc(OCC(=O)O)cc1)COc2ccccc2	BroadT	BRD-K48311056	BRD-K48311056-003-01-7	Tocris Bioscience	929	2	Cl	O[C@H](CNCCOc1ccc(OCC(O)=O)cc1)COc1ccccc1.Cl	InChI=1S/C19H23NO6.ClH/c21-15(13-25-16-4-2-1-3-5-16)12-20-10-11-24-17-6-8-18(9-7-17)26-14-19(22)23;/h1-9,15,20-21H,10-14H2,(H,22,23);1H/t15-;/m1./s1	ISFZQNYGEYAUCR-XFULWGLBSA-N	361.152537466							92838
W13	LSM-2991	W-13, SID11113465	4299	InChI=1S/C14H17ClN2O2S/c15-14-5-3-4-11-10-12(6-7-13(11)14)20(18,19)17-9-2-1-8-16/h3-7,10,17H,1-2,8-9,16H2	JJQKICOADUKSNS-UHFFFAOYSA-N	NCCCCNS(=O)(=O)c1ccc2c(Cl)cccc2c1	BroadT	BRD-K45068323	BRD-K45068323-003-01-3	Calbiochem	681636		Cl	NCCCCNS(=O)(=O)c1ccc2c(Cl)cccc2c1.Cl	InChI=1S/C14H17ClN2O2S.ClH/c15-14-5-3-4-11-10-12(6-7-13(11)14)20(18,19)17-9-2-1-8-16;/h3-7,10,17H,1-2,8-9,16H2;1H	QKAALLVQBOLELJ-UHFFFAOYSA-N	312.069926204							75366, 75366
Cinanserin	LSM-42890	Cinanserin	5475158	InChI=1S/C20H24N2OS/c1-22(2)15-8-16-24-19-12-7-6-11-18(19)21-20(23)14-13-17-9-4-3-5-10-17/h3-7,9-14H,8,15-16H2,1-2H3,(H,21,23)/b14-13+	RSUVYMGADVXGOU-BUHFOSPRSA-N	CN(C)CCCSc1ccccc1NC(=O)\C=C\c2ccccc2	BroadT	BRD-K40901640	BRD-K40901640-001-01-0	Biomol International Inc.	NS-102	2813-N1283		CN(C)CCCSc1ccccc1NC(=O)\C=C\c1ccccc1	InChI=1S/C20H24N2OS/c1-22(2)15-8-16-24-19-12-7-6-11-18(19)21-20(23)14-13-17-9-4-3-5-10-17/h3-7,9-14H,8,15-16H2,1-2H3,(H,21,23)/b14-13+	RSUVYMGADVXGOU-BUHFOSPRSA-N	340.160934098							, , 
5-Methylfurmethide	LSM-4635	5-Methylfurmethide, BRD-K45437867	4141	InChI=1S/C9H16NO/c1-8-5-6-9(11-8)7-10(2,3)4/h5-6H,7H2,1-4H3/q+1	KOWVJDFMEZKDDT-UHFFFAOYSA-N	Cc1oc(C[N+](C)(C)C)cc1	BroadT	BRD-K45437867	BRD-K45437867-005-01-7	Tocris Bioscience	588	2	I	Cc1ccc(C[N+](C)(C)C)o1.I	InChI=1S/C9H16NO.HI/c1-8-5-6-9(11-8)7-10(2,3)4;/h5-6H,7H2,1-4H3;1H/q+1;	IHTCZSNKQINGDD-UHFFFAOYSA-N	154.123189142							94038, 94038
AMG-9810	LSM-2953	BRD-K43068349	680501	InChI=1S/C21H23NO3/c1-21(2,3)16-7-4-15(5-8-16)6-11-20(23)22-17-9-10-18-19(14-17)25-13-12-24-18/h4-11,14H,12-13H2,1-3H3,(H,22,23)	GZTFUVZVLYUPRG-UHFFFAOYSA-N	CC(C)(C)c1ccc(C=CC(=O)Nc2ccc3OCCOc3c2)cc1	BroadT	BRD-K43068349	BRD-K43068349-001-01-9	Tocris Bioscience	2316	1		CC(C)(C)c1ccc(C=CC(=O)Nc2ccc3OCCOc3c2)cc1	InChI=1S/C21H23NO3/c1-21(2,3)16-7-4-15(5-8-16)6-11-20(23)22-17-9-10-18-19(14-17)25-13-12-24-18/h4-11,14H,12-13H2,1-3H3,(H,22,23)	GZTFUVZVLYUPRG-UHFFFAOYSA-N	337.167793606							92757
Iobenguane	LSM-2969	Iobenguane	60860	InChI=1S/C8H10IN3/c9-7-3-1-2-6(4-7)5-12-8(10)11/h1-4H,5H2,(H4,10,11,12)	PDWUPXJEEYOOTR-UHFFFAOYSA-N	NC(=N)NCc1cccc(I)c1	BroadT	BRD-K43860855	BRD-K43860855-065-03-6	Prestwick Chemical Inc.	Prestw-490	D0701-MP04-ST03-200-	OS(=O)(=O)O	NC(=N)NCc1cccc(I)c1.OS(=O)(=O)O	InChI=1S/C8H10IN3.H2O4S/c9-7-3-1-2-6(4-7)5-12-8(10)11;1-5(2,3)4/h1-4H,5H2,(H4,10,11,12);(H2,1,2,3,4)	NMHJRGCKGFRFAQ-UHFFFAOYSA-N	274.99194035							92769, 92769, 92769, 92769, 92769, 92769, 92769
Ambroxol	LSM-3260	Ambroxol, Ambroxol HCl		InChI=1S/C13H18Br2N2O/c14-9-5-8(13(16)12(15)6-9)7-17-10-1-3-11(18)4-2-10/h5-6,10-11,17-18H,1-4,7,16H2/t10-,11-	JBDGDEWWOUBZPM-XYPYZODXSA-N	Nc1c(Br)cc(Br)cc1CN[C@@H]2CC[C@@H](O)CC2	BroadT	BRD-K56558538	BRD-K56558538-003-02-8	Prestwick Chemical Inc.	Prestw-366	D0701-MP04-ST03-200-	Cl	Nc1c(Br)cc(Br)cc1CN[C@H]1CC[C@H](O)CC1.Cl	InChI=1S/C13H18Br2N2O.ClH/c14-9-5-8(13(16)12(15)6-9)7-17-10-1-3-11(18)4-2-10;/h5-6,10-11,17-18H,1-4,7,16H2;1H/t10-,11-;	QNVKOSLOVOTXKF-PFWPSKEQSA-N	375.978588416							, 
Acetaminophen	LSM-5533	Acetaminophen, Datril, Injectapap, Neopap, Ofirmev, Acephen, Apap, Paracetamol, Phenaphen, Tylenol, Infants' Feverall	1983	InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)	RZVAJINKPMORJF-UHFFFAOYSA-N	CC(=O)Nc1ccc(O)cc1	BroadT	BRD-K41524689	BRD-K41524689-001-05-2	Prestwick Chemical Inc.	Prestw-868	D0701-MP04-ST03-200-		CC(=O)Nc1ccc(O)cc1	InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)	RZVAJINKPMORJF-UHFFFAOYSA-N	151.063328538							46195
Irigenin, Dibenzyl Ether	LSM-19019	Irigenin,Dibenzyl Ether	6710674	InChI=1S/C32H28O8/c1-35-25-14-22(15-26(31(25)36-2)38-17-20-10-6-4-7-11-20)23-19-40-24-16-27(39-18-21-12-8-5-9-13-21)32(37-3)30(34)28(24)29(23)33/h4-16,19,34H,17-18H2,1-3H3	BDFCYBFDARSRDM-UHFFFAOYSA-N	COc1cc(cc(OCc2ccccc2)c1OC)C3=COc4cc(OCc5ccccc5)c(OC)c(O)c4C3=O	BroadT	BRD-K41762421	BRD-K41762421-001-02-8	MicroSource Discovery Systems Inc.	201181			COc1cc(cc(OCc2ccccc2)c1OC)-c1coc2cc(OCc3ccccc3)c(OC)c(O)c2c1=O	InChI=1S/C32H28O8/c1-35-25-14-22(15-26(31(25)36-2)38-17-20-10-6-4-7-11-20)23-19-40-24-16-27(39-18-21-12-8-5-9-13-21)32(37-3)30(34)28(24)29(23)33/h4-16,19,34H,17-18H2,1-3H3	BDFCYBFDARSRDM-UHFFFAOYSA-N	540.178417856							107648
Diplosalsalate	LSM-5575	2-(2-Methylcarbonyloxyphenylcarbonyloxy)Benzoic Acid, Acetylsalicylsalicylicacid, Acetylsalicylsalicylic-Acid, Acetylsalicylsalicylic Acid	10745	InChI=1S/C16H12O6/c1-10(17)21-14-9-5-3-7-12(14)16(20)22-13-8-4-2-6-11(13)15(18)19/h2-9H,1H3,(H,18,19)	DDSFKIFGAPZBSR-UHFFFAOYSA-N	CC(=O)Oc1ccccc1C(=O)Oc2ccccc2C(=O)O	BroadT	BRD-K46585355	BRD-K46585355-001-05-1	Prestwick Chemical Inc.	Prestw-98	D0701-MP04-ST03-200-		CC(=O)Oc1ccccc1C(=O)Oc1ccccc1C(O)=O	InChI=1S/C16H12O6/c1-10(17)21-14-9-5-3-7-12(14)16(20)22-13-8-4-2-6-11(13)15(18)19/h2-9H,1H3,(H,18,19)	DDSFKIFGAPZBSR-UHFFFAOYSA-N	300.063388104							94629
P32	LSM-2911	Cyanopindolol(+)	16759997	InChI=1S/C16H21N3O2/c1-16(2,3)18-9-12(20)10-21-15-6-4-5-14-13(15)7-11(8-17)19-14/h4-7,12,18-20H,9-10H2,1-3H3/t12-/m0/s1	QXIUMMLTJVHILT-LBPRGKRZSA-N	CC(C)(C)NC[C@H](O)COc1cccc2[nH]c(cc12)C#N	BroadT	BRD-K40965114	BRD-K40965114-001-01-2	Biomol International Inc.	AR-105	2813-N1283		CC(C)(C)NC[C@H](O)COc1cccc2[nH]c(cc12)C#N	InChI=1S/C16H21N3O2/c1-16(2,3)18-9-12(20)10-21-15-6-4-5-14-13(15)7-11(8-17)19-14/h4-7,12,18-20H,9-10H2,1-3H3/t12-/m0/s1	QXIUMMLTJVHILT-LBPRGKRZSA-N	287.163376942							92724
NS1619	LSM-3206	NS-1619	4552	InChI=1S/C15H8F6N2O2/c16-14(17,18)7-1-3-10-9(5-7)22-13(25)23(10)11-6-8(15(19,20)21)2-4-12(11)24/h1-6,24H,(H,22,25)	YLFMCMWKHSDUCT-UHFFFAOYSA-N	Oc1ccc(cc1N2C(=O)Nc3cc(ccc23)C(F)(F)F)C(F)(F)F	BroadT	BRD-K54210043	BRD-K54210043-001-02-0	Biomol International Inc.	KC-127	2840(V2)-3-N1305		Oc1ccc(cc1-n1c2ccc(cc2[nH]c1=O)C(F)(F)F)C(F)(F)F	InChI=1S/C15H8F6N2O2/c16-14(17,18)7-1-3-10-9(5-7)22-13(25)23(10)11-6-8(15(19,20)21)2-4-12(11)24/h1-6,24H,(H,22,25)	YLFMCMWKHSDUCT-UHFFFAOYSA-N	362.048996716							34879
Rel-Cisapride	LSM-3312	Cisapride, CHEMBL74656, Rel-Cisapride	5311047	InChI=1S/C23H29ClFN3O4/c1-30-21-13-19(26)18(24)12-17(21)23(29)27-20-8-10-28(14-22(20)31-2)9-3-11-32-16-6-4-15(25)5-7-16/h4-7,12-13,20,22H,3,8-11,14,26H2,1-2H3,(H,27,29)/t20-,22+/m0/s1	DCSUBABJRXZOMT-RBBKRZOGSA-N	CO[C@@H]1CN(CCCOc2ccc(F)cc2)CC[C@@H]1NC(=O)c3cc(Cl)c(N)cc3OC	BroadT	BRD-K59163477	BRD-K59163477-001-02-1	Prestwick Chemical Inc.	Prestw-430	D0701-MP04-ST03-200-		CO[C@@H]1CN(CCCOc2ccc(F)cc2)CC[C@@H]1NC(=O)c1cc(Cl)c(N)cc1OC	InChI=1S/C23H29ClFN3O4/c1-30-21-13-19(26)18(24)12-17(21)23(29)27-20-8-10-28(14-22(20)31-2)9-3-11-32-16-6-4-15(25)5-7-16/h4-7,12-13,20,22H,3,8-11,14,26H2,1-2H3,(H,27,29)/t20-,22+/m0/s1	DCSUBABJRXZOMT-RBBKRZOGSA-N	465.183062348							93034
SCHEMBL614840	LSM-3080	BRD-K49119234, SID26755037, SID26755038, SID29216380, SID90340855	11207937	InChI=1S/C16H31NO2/c1-6-7-8-9-10-14(18)19-13-11-15(2,3)17-16(4,5)12-13/h13,17H,6-12H2,1-5H3	PWWKJRFUJIFGGD-UHFFFAOYSA-N	CCCCCCC(=O)OC1CC(C)(C)NC(C)(C)C1	BroadT	BRD-K49119234	BRD-K49119234-003-01-8	Tocris Bioscience	2438	1	Cl	CCCCCCC(=O)OC1CC(C)(C)NC(C)(C)C1.Cl	InChI=1S/C16H31NO2.ClH/c1-6-7-8-9-10-14(18)19-13-11-15(2,3)17-16(4,5)12-13;/h13,17H,6-12H2,1-5H3;1H	XIDDVJIJIFWGIX-UHFFFAOYSA-N	269.235479242							92852
BP-554	LSM-3007	SID11113564, SID26751771, BP 554	134117	InChI=1S/C20H24N2O3/c1-2-5-17(6-3-1)22-12-10-21(11-13-22)9-4-14-23-18-7-8-19-20(15-18)25-16-24-19/h1-3,5-8,15H,4,9-14,16H2	VUSNBQDZGKZEDL-UHFFFAOYSA-N	C(COc1ccc2OCOc2c1)CN3CCN(CC3)c4ccccc4	BroadT	BRD-K45479396	BRD-K45479396-001-01-8	Biomol International Inc.	AC-524	2813-N1283		C(COc1ccc2OCOc2c1)CN1CCN(CC1)c1ccccc1	InChI=1S/C20H24N2O3/c1-2-5-17(6-3-1)22-12-10-21(11-13-22)9-4-14-23-18-7-8-19-20(15-18)25-16-24-19/h1-3,5-8,15H,4,9-14,16H2	VUSNBQDZGKZEDL-UHFFFAOYSA-N	340.178692648							92800, 92800
GR 159897	LSM-3158	BRD-K52394958	9953599	InChI=1S/C23H27FN2O2S/c1-28-23(17-29(27)20-5-3-2-4-6-20)10-13-26(14-11-23)12-9-18-16-25-22-8-7-19(24)15-21(18)22/h2-8,15-16,25H,9-14,17H2,1H3/t29-/m1/s1	BANYJBHWTOJQDU-GDLZYMKVSA-N	COC1(C[S@@](=O)c2ccccc2)CCN(CCc3c[nH]c4ccc(F)cc34)CC1	BroadT	BRD-K52394958	BRD-K52394958-001-01-9	Tocris Bioscience	1274	2		COC1(C[S@@](=O)c2ccccc2)CCN(CCc2c[nH]c3ccc(F)cc23)CC1	InChI=1S/C23H27FN2O2S/c1-28-23(17-29(27)20-5-3-2-4-6-20)10-13-26(14-11-23)12-9-18-16-25-22-8-7-19(24)15-21(18)22/h2-8,15-16,25H,9-14,17H2,1H3/t29-/m1/s1	BANYJBHWTOJQDU-GDLZYMKVSA-N	414.177727014							92912
Methapyrilene	LSM-5582	Methapyrilene	4098	InChI=1S/C14H19N3S/c1-16(2)9-10-17(12-13-6-5-11-18-13)14-7-3-4-8-15-14/h3-8,11H,9-10,12H2,1-2H3	HNJJXZKZRAWDPF-UHFFFAOYSA-N	CN(C)CCN(Cc1cccs1)c2ccccn2	BroadT	BRD-K47323024	BRD-K47323024-003-04-6	MicroSource Discovery Systems Inc.	1503229		Cl	CN(C)CCN(Cc1cccs1)c1ccccn1.Cl	InChI=1S/C14H19N3S.ClH/c1-16(2)9-10-17(12-13-6-5-11-18-13)14-7-3-4-8-15-14;/h3-8,11H,9-10,12H2,1-2H3;1H	BONORRGKLJBGRV-UHFFFAOYSA-N	261.129968328							6820, 6820, 6820, 6820
Butylated Hydroxytoluene	LSM-19020	Butylhydroxytoluene, Bht, E321, Butylated Hydroxytoluene, Butylated Hydroxy Toluene	31404	InChI=1S/C15H24O/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7/h8-9,16H,1-7H3	NLZUEZXRPGMBCV-UHFFFAOYSA-N	Cc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C	BroadT	BRD-K53153417	BRD-K53153417-001-01-3	MicroSource Discovery Systems Inc.	1600716			Cc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C	InChI=1S/C15H24O/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7/h8-9,16H,1-7H3	NLZUEZXRPGMBCV-UHFFFAOYSA-N	220.182715388							34247
Arctigenin	LSM-3183	Arctigenin, BRD-K53523901, (-)-Arctigenin	64981	InChI=1S/C21H24O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,10-11,15-16,22H,8-9,12H2,1-3H3/t15-,16+/m0/s1	NQWVSMVXKMHKTF-JKSUJKDBSA-N	COc1ccc(C[C@H]2COC(=O)[C@@H]2Cc3ccc(O)c(OC)c3)cc1OC	BroadT	BRD-K53523901	BRD-K53523901-001-01-0	AnalytiCon Discovery GmbH	NP-010113			COc1cc(C[C@@H]2[C@@H](Cc3ccc(OC)c(OC)c3)COC2=O)ccc1O	InChI=1S/C21H24O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,10-11,15-16,22H,8-9,12H2,1-3H3/t15-,16+/m0/s1	NQWVSMVXKMHKTF-JKSUJKDBSA-N	372.157288488							79
ST638	LSM-42975		5353962	InChI=1S/C19H18N2O3S/c1-2-24-17-10-13(8-14(11-20)19(21)23)9-15(18(17)22)12-25-16-6-4-3-5-7-16/h3-10,22H,2,12H2,1H3,(H2,21,23)/b14-8-	YKLMGKWXBLSKPK-ZSOIEALJSA-N	CCOc1cc(\C=C(\C#N)/C(=O)N)cc(CSc2ccccc2)c1O	BroadT	BRD-K51476772	BRD-K51476772-001-01-9	Calbiochem	567790			CCOc1cc(\C=C(\C#N)C(N)=O)cc(CSc2ccccc2)c1O	InChI=1S/C19H18N2O3S/c1-2-24-17-10-13(8-14(11-20)19(21)23)9-15(18(17)22)12-25-16-6-4-3-5-7-16/h3-10,22H,2,12H2,1H3,(H2,21,23)/b14-8-	YKLMGKWXBLSKPK-ZSOIEALJSA-N	354.103813146							
Dexniguldipine	LSM-15285	Dexniguldipine, Niguldipine, BRD-K44309363	6918097	InChI=1S/C36H39N3O6/c1-25-31(34(40)44-3)33(27-12-10-17-30(24-27)39(42)43)32(26(2)37-25)35(41)45-23-11-20-38-21-18-36(19-22-38,28-13-6-4-7-14-28)29-15-8-5-9-16-29/h4-10,12-17,24,33,37H,11,18-23H2,1-3H3/t33-/m1/s1	SVJMLYUFVDMUHP-MGBGTMOVSA-N	COC(=O)C1=C(C)NC(=C([C@@H]1c2cccc(c2)[N+](=O)[O-])C(=O)OCCCN3CCC(CC3)(c4ccccc4)c5ccccc5)C	BroadT	BRD-K44309363	BRD-K44309363-003-01-3	Tocris Bioscience	1124	1	Cl	COC(=O)C1=C(C)NC(C)=C([C@@H]1c1cccc(c1)[N+]([O-])=O)C(=O)OCCCN1CCC(CC1)(c1ccccc1)c1ccccc1.Cl	InChI=1S/C36H39N3O6.ClH/c1-25-31(34(40)44-3)33(27-12-10-17-30(24-27)39(42)43)32(26(2)37-25)35(41)45-23-11-20-38-21-18-36(19-22-38,28-13-6-4-7-14-28)29-15-8-5-9-16-29;/h4-10,12-17,24,33,37H,11,18-23H2,1-3H3;1H/t33-;/m1./s1	MHOSUIMBPQVOEU-MGDILKBHSA-N	609.283885998							103932
Norharmane	LSM-19021	Norharmane, Norharman, Beta-Carboline	64961	InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H	AIFRHYZBTHREPW-UHFFFAOYSA-N	c1ccc2c(c1)[nH]c3cnccc23	BroadT	BRD-K47467075	BRD-K47467075-001-02-7	MicroSource Discovery Systems Inc.	1500871			c1ccc2c(c1)[nH]c1cnccc21	InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H	AIFRHYZBTHREPW-UHFFFAOYSA-N	168.068748276							109895
QX-222	LSM-2905	SID11111369, SID11113876	5014	InChI=1S/C13H20N2O/c1-10-7-6-8-11(2)13(10)14-12(16)9-15(3,4)5/h6-8H,9H2,1-5H3/p+1	QYUXPWDVDMSTKR-UHFFFAOYSA-O	Cc1cccc(C)c1NC(=O)C[N+](C)(C)C	BroadT	BRD-K40782193	BRD-K40782193-003-01-1	Tocris Bioscience	1043	1	Cl	Cc1cccc(C)c1NC(=O)C[N+](C)(C)C.Cl	InChI=1S/C13H20N2O.ClH/c1-10-7-6-8-11(2)13(10)14-12(16)9-15(3,4)5;/h6-8H,9H2,1-5H3;1H/p+1	WFKXSWWTOZBDME-UHFFFAOYSA-O	221.165388312							92720, 92720
Tyrphostin AG 527	LSM-42874	AG-527	5328772	InChI=1S/C18H16N2O3/c1-12(14-5-3-2-4-6-14)20-18(23)15(11-19)9-13-7-8-16(21)17(22)10-13/h2-10,12,21-22H,1H3,(H,20,23)/b15-9+/t12-/m1/s1	UMGQVUWXNOJOSJ-KMHUVPDISA-N	C[C@@H](NC(=O)\C(=C\c1ccc(O)c(O)c1)\C#N)c2ccccc2	BroadT	BRD-K43405658	BRD-K43405658-001-01-8	Calbiochem	658402			C[C@@H](NC(=O)C(=C\c1ccc(O)c(O)c1)\C#N)c1ccccc1	InChI=1S/C18H16N2O3/c1-12(14-5-3-2-4-6-14)20-18(23)15(11-19)9-13-7-8-16(21)17(22)10-13/h2-10,12,21-22H,1H3,(H,20,23)/b15-9+/t12-/m1/s1	UMGQVUWXNOJOSJ-KMHUVPDISA-N	308.116092392							
Esatenolol	LSM-5562	Esatenolol, Atenolol, (R)-(+)-Atenolol, S-Atenolol	175540	InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)/t12-/m0/s1	METKIMKYRPQLGS-LBPRGKRZSA-N	CC(C)NC[C@H](O)COc1ccc(CC(=O)N)cc1	BroadT	BRD-K44993696	BRD-K44993696-001-05-7	Tocris Bioscience	393	3		CC(C)NC[C@H](O)COc1ccc(CC(N)=O)cc1	InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)/t12-/m0/s1	METKIMKYRPQLGS-LBPRGKRZSA-N	266.163042584							31556
8,2'-Dimethoxyflavone	LSM-19022	BRD-K47895166, SID26749973	6708756	InChI=1S/C17H14O4/c1-19-14-8-4-3-6-12(14)16-10-13(18)11-7-5-9-15(20-2)17(11)21-16/h3-10H,1-2H3	ZLUNDKGGMHFJPK-UHFFFAOYSA-N	COc1cccc2C(=O)C=C(Oc12)c3ccccc3OC	BroadT	BRD-K47895166	BRD-K47895166-001-02-9	MicroSource Discovery Systems Inc.	1500740			COc1ccccc1-c1cc(=O)c2cccc(OC)c2o1	InChI=1S/C17H14O4/c1-19-14-8-4-3-6-12(14)16-10-13(18)11-7-5-9-15(20-2)17(11)21-16/h3-10H,1-2H3	ZLUNDKGGMHFJPK-UHFFFAOYSA-N	282.089208928							107649
Prothiaden Spofa	LSM-42985	Dosulepin, Dothiepin, Prothiaden Spofa	5284550	InChI=1S/C19H21NS/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3/b17-11+	PHTUQLWOUWZIMZ-GZTJUZNOSA-N	CN(C)CC\C=C\1/c2ccccc2CSc3ccccc13	BroadT	BRD-K54759182	BRD-K54759182-003-02-3	Prestwick Chemical Inc.	Prestw-488	D0701-MP04-ST03-200-	Cl	CN(C)CC\C=C1/c2ccccc2CSc2ccccc12.Cl	InChI=1S/C19H21NS.ClH/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19;/h3-6,8-12H,7,13-14H2,1-2H3;1H/b17-11+;	XUPZAARQDNSRJB-SJDTYFKWSA-N	295.139470372							36803, 36803
Cerulenin	LSM-43210	Cerulenin	5282054	InChI=1S/C12H17NO3/c1-2-3-4-5-6-7-8-9(14)10-11(16-10)12(13)15/h2-3,5-6,10-11H,4,7-8H2,1H3,(H2,13,15)/b3-2+,6-5+/t10-,11-/m1/s1	GVEZIHKRYBHEFX-NQQPLRFYSA-N	C\C=C\C\C=C\CCC(=O)[C@H]1O[C@H]1C(=O)N	BroadT	BRD-K52075040	BRD-K52075040-001-02-2	Biomol International Inc.	G237	2840(V2)-3-N1305		C\C=C\C\C=C\CCC(=O)[C@H]1O[C@H]1C(N)=O	InChI=1S/C12H17NO3/c1-2-3-4-5-6-7-8-9(14)10-11(16-10)12(13)15/h2-3,5-6,10-11H,4,7-8H2,1H3,(H2,13,15)/b3-2+,6-5+/t10-,11-/m1/s1	GVEZIHKRYBHEFX-NQQPLRFYSA-N	223.120843414							171741
Lupinine	LSM-19023	Lupinine	91461	InChI=1S/C10H19NO/c12-8-9-4-3-7-11-6-2-1-5-10(9)11/h9-10,12H,1-8H2/t9-,10+/m0/s1	HDVAWXXJVMJBAR-VHSXEESVSA-N	OC[C@@H]1CCCN2CCCC[C@H]12	BroadT	BRD-K45978015	BRD-K45978015-001-02-8	MicroSource Discovery Systems Inc.	1504021			OC[C@@H]1CCCN2CCCC[C@H]12	InChI=1S/C10H19NO/c12-8-9-4-3-7-11-6-2-1-5-10(9)11/h9-10,12H,1-8H2/t9-,10+/m0/s1	HDVAWXXJVMJBAR-VHSXEESVSA-N	169.146664238							28012
Duartin (-)	LSM-19024	Duartin, AC1O8JZA	6710727	InChI=1S/C18H20O6/c1-21-14-7-5-12(17(22-2)15(14)20)11-8-10-4-6-13(19)18(23-3)16(10)24-9-11/h4-7,11,19-20H,8-9H2,1-3H3/t11-/m1/s1	QVVPJFBYFYYVDM-LLVKDONJSA-N	COc1ccc([C@H]2COc3c(C2)ccc(O)c3OC)c(OC)c1O	BroadT	BRD-K47814830	BRD-K47814830-001-02-6	MicroSource Discovery Systems Inc.	201177			COc1ccc([C@H]2COc3c(C2)ccc(O)c3OC)c(OC)c1O	InChI=1S/C18H20O6/c1-21-14-7-5-12(17(22-2)15(14)20)11-8-10-4-6-13(19)18(23-3)16(10)24-9-11/h4-7,11,19-20H,8-9H2,1-3H3/t11-/m1/s1	QVVPJFBYFYYVDM-LLVKDONJSA-N	332.12598836							107650
Coumaphos	LSM-19025	Coumafos, Baymix, Coumaphos, Meldane, Bayer-21199	2871	InChI=1S/C14H16ClO5PS/c1-4-17-21(22,18-5-2)20-10-6-7-11-9(3)13(15)14(16)19-12(11)8-10/h6-8H,4-5H2,1-3H3	BXNANOICGRISHX-UHFFFAOYSA-N	CCOP(=S)(OCC)Oc1ccc2C(=C(Cl)C(=O)Oc2c1)C	BroadT	BRD-K41567533	BRD-K41567533-001-02-6	MicroSource Discovery Systems Inc.	330012			CCOP(=S)(OCC)Oc1ccc2c(C)c(Cl)c(=O)oc2c1	InChI=1S/C14H16ClO5PS/c1-4-17-21(22,18-5-2)20-10-6-7-11-9(3)13(15)14(16)19-12(11)8-10/h6-8H,4-5H2,1-3H3	BXNANOICGRISHX-UHFFFAOYSA-N	362.014458522							3903
Furegrelate	LSM-15180	Furegrelate	3437	InChI=1S/C15H11NO3/c17-15(18)14-8-12-7-10(3-4-13(12)19-14)6-11-2-1-5-16-9-11/h1-5,7-9H,6H2,(H,17,18)	VHWFITPGPFLBGT-UHFFFAOYSA-N	OC(=O)c1oc2ccc(Cc3cccnc3)cc2c1	BroadT	BRD-K55529781	BRD-K55529781-236-02-0	MicroSource Discovery Systems Inc.	1501195		[Na]	OC(=O)c1cc2cc(Cc3cccnc3)ccc2o1.[Na]	InChI=1S/C15H11NO3.Na.H/c17-15(18)14-8-12-7-10(3-4-13(12)19-14)6-11-2-1-5-16-9-11;;/h1-5,7-9H,6H2,(H,17,18);;	ZWQIUEASYGWMLR-UHFFFAOYSA-N	253.073893222							103833, 103833
BAY 36-7620	LSM-3218	BRD-K54704028	9903757	InChI=1S/C19H18O2/c1-13-8-17-12-21-18(20)19(17,10-13)11-14-6-7-15-4-2-3-5-16(15)9-14/h2-7,9,17H,1,8,10-12H2/t17-,19+/m1/s1	CVIRWLJKDBYYOG-MJGOQNOKSA-N	C=C1C[C@@H]2COC(=O)[C@]2(Cc3ccc4ccccc4c3)C1	BroadT	BRD-K54704028	BRD-K54704028-001-01-3	Tocris Bioscience	2501	1		C=C1C[C@@H]2COC(=O)[C@]2(Cc2ccc3ccccc3c2)C1	InChI=1S/C19H18O2/c1-13-8-17-12-21-18(20)19(17,10-13)11-14-6-7-15-4-2-3-5-16(15)9-14/h2-7,9,17H,1,8,10-12H2/t17-,19+/m1/s1	CVIRWLJKDBYYOG-MJGOQNOKSA-N	278.130679816							
147299-15-8	LSM-19026	1-1-(2-Benzobthienyl)Cyclohexylpyrrolidine, SID26756525	192370	InChI=1S/C18H23NS/c1-4-10-18(11-5-1,19-12-6-7-13-19)17-14-15-8-2-3-9-16(15)20-17/h2-3,8-9,14H,1,4-7,10-13H2	NDVZYCXZMVQYBS-UHFFFAOYSA-N	C1CCC(CC1)(N2CCCC2)c3cc4ccccc4s3	BroadT	BRD-K57586808	BRD-K57586808-001-01-7	Biomol International Inc.	AC-267	2812-3-N1298		C1CCN(C1)C1(CCCCC1)c1cc2ccccc2s1	InChI=1S/C18H23NS/c1-4-10-18(11-5-1,19-12-6-7-13-19)17-14-15-8-2-3-9-16(15)20-17/h2-3,8-9,14H,1,4-7,10-13H2	NDVZYCXZMVQYBS-UHFFFAOYSA-N	285.155120436							107651
TOCRIS-0930	LSM-2999	BRD-K45296539, SID11113798	6604780	InChI=1S/C22H30N2O6/c1-27-13-12-24-22(26)17-30-21-9-7-20(8-10-21)28-14-11-23-15-18(25)16-29-19-5-3-2-4-6-19/h2-10,18,23,25H,11-17H2,1H3,(H,24,26)/t18-/m1/s1	RVMBDLSFFNKKLG-GOSISDBHSA-N	COCCNC(=O)COc1ccc(OCCNC[C@@H](O)COc2ccccc2)cc1	BroadT	BRD-K45296539	BRD-K45296539-003-01-0	Tocris Bioscience	930	1	Cl	COCCNC(=O)COc1ccc(OCCNC[C@@H](O)COc2ccccc2)cc1.Cl	InChI=1S/C22H30N2O6.ClH/c1-27-13-12-24-22(26)17-30-21-9-7-20(8-10-21)28-14-11-23-15-18(25)16-29-19-5-3-2-4-6-19;/h2-10,18,23,25H,11-17H2,1H3,(H,24,26);1H/t18-;/m1./s1	KCAMZVQSGDBGGF-GMUIIQOCSA-N	418.2103867							92793
Metronidazole	LSM-5628	Flagyl, Metrocream, Metrogel, Vandazole, Satric, Protostat, Noritate, Metronidazole, Metrolotion, Metrolyl, Metromidol, Flagyl 375, Metric 21, BAY-5360, Bayer-5360, RP-8823, Flagyl ER, Flagyl I.V. Rtu In Plastic Container, Metro IV, Metrogel-Vaginal	4173	InChI=1S/C6H9N3O3/c1-5-7-4-6(9(11)12)8(5)2-3-10/h4,10H,2-3H2,1H3	VAOCPAMSLUNLGC-UHFFFAOYSA-N	Cc1ncc([N+](=O)[O-])n1CCO	BroadT	BRD-K52020312	BRD-K52020312-001-04-5	MicroSource Discovery Systems Inc.	1500412			Cc1ncc(n1CCO)[N+]([O-])=O	InChI=1S/C6H9N3O3/c1-5-7-4-6(9(11)12)8(5)2-3-10/h4,10H,2-3H2,1H3	VAOCPAMSLUNLGC-UHFFFAOYSA-N	171.064391178							6909, 6909, 6909
Chrysophanol	LSM-19027	Chrysophanol	10208	InChI=1S/C15H10O4/c1-7-5-9-13(11(17)6-7)15(19)12-8(14(9)18)3-2-4-10(12)16/h2-6,16-17H,1H3	LQGUBLBATBMXHT-UHFFFAOYSA-N	Cc1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1	BroadT	BRD-K59284035	BRD-K59284035-001-02-0	MicroSource Discovery Systems Inc.	300545			Cc1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1	InChI=1S/C15H10O4/c1-7-5-9-13(11(17)6-7)15(19)12-8(14(9)18)3-2-4-10(12)16/h2-6,16-17H,1H3	LQGUBLBATBMXHT-UHFFFAOYSA-N	254.0579088							3687
4-[(S)-[(2S,5R)-2,5-dimethyl-4-(2-propenyl)-1-piperazinyl]phenylmethyl]-n,n-diethylbenzamide	LSM-19028	BRD-K45042519, SID11114124	6604878	InChI=1S/C27H37N3O/c1-6-18-29-19-22(5)30(20-21(29)4)26(23-12-10-9-11-13-23)24-14-16-25(17-15-24)27(31)28(7-2)8-3/h6,9-17,21-22,26H,1,7-8,18-20H2,2-5H3/t21-,22+,26+/m1/s1	WGIDFDFAOQVAHY-UFPGJGBJSA-N	CCN(CC)C(=O)c1ccc(cc1)[C@@H](N2C[C@@H](C)N(CC=C)C[C@@H]2C)c3ccccc3	BroadT	BRD-K45042519	BRD-K45042519-001-01-6	Tocris Bioscience	1529	1		CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1ccccc1	InChI=1S/C27H37N3O/c1-6-18-29-19-22(5)30(20-21(29)4)26(23-12-10-9-11-13-23)24-14-16-25(17-15-24)27(31)28(7-2)8-3/h6,9-17,21-22,26H,1,7-8,18-20H2,2-5H3/t21-,22+,26+/m1/s1	WGIDFDFAOQVAHY-UFPGJGBJSA-N	419.293662834							107652
BAY-11-7085	LSM-43815	BRD-K48684885, BAY 11-7085, BAY-117085	5353432	InChI=1S/C13H15NO2S/c1-13(2,3)11-5-7-12(8-6-11)17(15,16)10-4-9-14/h4-8,10H,1-3H3/b10-4+	VHKZGNPOHPFPER-ONNFQVAWSA-N	CC(C)(C)c1ccc(cc1)S(=O)(=O)\C=C\C#N	BroadT	BRD-K48684885	BRD-K48684885-001-01-8	Tocris Bioscience	1743	1		CC(C)(C)c1ccc(cc1)S(=O)(=O)\C=C\C#N	InChI=1S/C13H15NO2S/c1-13(2,3)11-5-7-12(8-6-11)17(15,16)10-4-9-14/h4-8,10H,1-3H3/b10-4+	VHKZGNPOHPFPER-ONNFQVAWSA-N	249.08234942							
3-(4,5-Dihydro-1H-imidazol-2-yl)isoquinoline	LSM-3251	BRD-K56115039, SID11113907	3410883	InChI=1S/C12H11N3/c1-2-4-10-8-15-11(7-9(10)3-1)12-13-5-6-14-12/h1-4,7-8H,5-6H2,(H,13,14)	ZXRSVNHYTSSFMN-UHFFFAOYSA-N	C1CN=C(N1)c2cc3ccccc3cn2	BroadT	BRD-K56115039	BRD-K56115039-003-01-3	Tocris Bioscience	1091	2	Cl	C1CN=C(N1)c1cc2ccccc2cn1.Cl	InChI=1S/C12H11N3.ClH/c1-2-4-10-8-15-11(7-9(10)3-1)12-13-5-6-14-12;/h1-4,7-8H,5-6H2,(H,13,14);1H	NIGHNKWLMSRCOZ-UHFFFAOYSA-N	197.095297382							92986
Rescinnamine	LSM-42980	Rescinnamine, Moderil, Cinnasil	5280954	InChI=1S/C35H42N2O9/c1-40-21-8-9-22-23-11-12-37-18-20-15-29(46-30(38)10-7-19-13-27(41-2)33(43-4)28(14-19)42-3)34(44-5)31(35(39)45-6)24(20)17-26(37)32(23)36-25(22)16-21/h7-10,13-14,16,20,24,26,29,31,34,36H,11-12,15,17-18H2,1-6H3/b10-7+/t20-,24+,26-,29-,31+,34+/m1/s1	SZLZWPPUNLXJEA-QEGASFHISA-N	CO[C@H]1[C@@H](C[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(=O)OC)OC(=O)\C=C\c6cc(OC)c(OC)c(OC)c6	BroadT	BRD-K52930707	BRD-K52930707-001-04-8	Prestwick Chemical Inc.	Prestw-568	D0701-MP04-ST03-200-		CO[C@H]1[C@@H](C[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(=O)OC)OC(=O)\C=C\c1cc(OC)c(OC)c(OC)c1	InChI=1S/C35H42N2O9/c1-40-21-8-9-22-23-11-12-37-18-20-15-29(46-30(38)10-7-19-13-27(41-2)33(43-4)28(14-19)42-3)34(44-5)31(35(39)45-6)24(20)17-26(37)32(23)36-25(22)16-21/h7-10,13-14,16,20,24,26,29,31,34,36H,11-12,15,17-18H2,1-6H3/b10-7+/t20-,24+,26-,29-,31+,34+/m1/s1	SZLZWPPUNLXJEA-QEGASFHISA-N	634.289030944							28572
Risperidone	LSM-3193	Risperidone, Risperdal, R-64766, R-64-766, Risperdal M-Tab, Risperdal M, Risperdal Consta Long Acting, Risperdal Consta	5073	InChI=1S/C23H27FN4O2/c1-15-18(23(29)28-10-3-2-4-21(28)25-15)9-13-27-11-7-16(8-12-27)22-19-6-5-17(24)14-20(19)30-26-22/h5-6,14,16H,2-4,7-13H2,1H3	RAPZEAPATHNIPO-UHFFFAOYSA-N	CC1=C(CCN2CCC(CC2)c3noc4cc(F)ccc34)C(=O)N5CCCCC5=N1	BroadT	BRD-K53857191	BRD-K53857191-001-04-5	Biomol International Inc.	AC-758	2812-3-N1298		Cc1nc2CCCCn2c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12	InChI=1S/C23H27FN4O2/c1-15-18(23(29)28-10-3-2-4-21(28)25-15)9-13-27-11-7-16(8-12-27)22-19-6-5-17(24)14-20(19)30-26-22/h5-6,14,16H,2-4,7-13H2,1H3	RAPZEAPATHNIPO-UHFFFAOYSA-N	410.211804344							8871
Estrone Sulfuric acid	LSM-3126	Estropipate, Estrone Sulfuric Acid, Estrone Sulphate	3001028	InChI=1S/C18H22O5S/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-16H,2,4,6-9H2,1H3,(H,20,21,22)/t14-,15-,16+,18+/m1/s1	JKKFKPJIXZFSSB-CBZIJGRNSA-N	C[C@]12CC[C@H]3[C@@H](CCc4cc(OS(=O)(=O)O)ccc34)[C@@H]1CCC2=O	BroadT	BRD-K51095933	BRD-K51095933-231-03-2	Prestwick Chemical Inc.	Prestw-688	D0701-MP04-ST03-200-	C1CNCCN1	C[C@]12CC[C@H]3[C@@H](CCc4cc(OS(O)(=O)=O)ccc34)[C@@H]1CCC2=O.C1CNCCN1	InChI=1S/C18H22O5S.C4H10N2/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19;1-2-6-4-3-5-1/h3,5,10,14-16H,2,4,6-9H2,1H3,(H,20,21,22);5-6H,1-4H2/t14-,15-,16+,18+;/m1./s1	HZEQBCVBILBTEP-ZFINNJDLSA-N	350.118794494							17474, 17474, 17474, 17474
6-Iodonordihydrocapsaicin	LSM-19030	6'-Iodononivamide, BRD-K49236613	5149140	InChI=1S/C17H26INO3/c1-3-4-5-6-7-8-9-17(21)19-12-13-10-16(22-2)15(20)11-14(13)18/h10-11,20H,3-9,12H2,1-2H3,(H,19,21)	AAORACFZMYMFCG-UHFFFAOYSA-N	CCCCCCCCC(=O)NCc1cc(OC)c(O)cc1I	BroadT	BRD-K49236613	BRD-K49236613-001-01-5	Tocris Bioscience	1975	2		CCCCCCCCC(=O)NCc1cc(OC)c(O)cc1I	InChI=1S/C17H26INO3/c1-3-4-5-6-7-8-9-17(21)19-12-13-10-16(22-2)15(20)11-14(13)18/h10-11,20H,3-9,12H2,1-2H3,(H,19,21)	AAORACFZMYMFCG-UHFFFAOYSA-N	419.095736702							107654
Sulfapyridine	LSM-5531	Sulfapyridine, Coccoclase, Eubasin, Piridazol, Sulfanilamidopyridine, Sulphapyridine	5336	InChI=1S/C11H11N3O2S/c12-9-4-6-10(7-5-9)17(15,16)14-11-3-1-2-8-13-11/h1-8H,12H2,(H,13,14)	GECHUMIMRBOMGK-UHFFFAOYSA-N	Nc1ccc(cc1)S(=O)(=O)Nc2ccccn2	BroadT	BRD-K41406082	BRD-K41406082-001-04-8	MicroSource Discovery Systems Inc.	1500551			Nc1ccc(cc1)S(=O)(=O)Nc1ccccn1	InChI=1S/C11H11N3O2S/c12-9-4-6-10(7-5-9)17(15,16)14-11-3-1-2-8-13-11/h1-8H,12H2,(H,13,14)	GECHUMIMRBOMGK-UHFFFAOYSA-N	249.057197312							132842, 132842
Anpirtoline	LSM-3232	98330-05-3, Anpirtoline	65854	InChI=1S/C10H13ClN2S/c11-9-2-1-3-10(13-9)14-8-4-6-12-7-5-8/h1-3,8,12H,4-7H2	GGALEXMXDMUMDM-UHFFFAOYSA-N	Clc1cccc(SC2CCNCC2)n1	BroadT	BRD-K55424922	BRD-K55424922-001-01-4	Biomol International Inc.	NS-100	2813-N1283		Clc1cccc(SC2CCNCC2)n1	InChI=1S/C10H13ClN2S/c11-9-2-1-3-10(13-9)14-8-4-6-12-7-5-8/h1-3,8,12H,4-7H2	GGALEXMXDMUMDM-UHFFFAOYSA-N	228.048796836							92968
Flufenamic acid	LSM-2973	Flufenamicacid, Arlef, CI-440, CN-27554, INF-1837, Flufenamic-Acid, Flufenamic Acid	3371	InChI=1S/C14H10F3NO2/c15-14(16,17)9-4-3-5-10(8-9)18-12-7-2-1-6-11(12)13(19)20/h1-8,18H,(H,19,20)	LPEPZBJOKDYZAD-UHFFFAOYSA-N	OC(=O)c1ccccc1Nc2cccc(c2)C(F)(F)F	BroadT	BRD-K44067360	BRD-K44067360-001-06-3	Biomol International Inc.	AC-123	2840(V2)-3-N1305		OC(=O)c1ccccc1Nc1cccc(c1)C(F)(F)F	InChI=1S/C14H10F3NO2/c15-14(16,17)9-4-3-5-10(8-9)18-12-7-2-1-6-11(12)13(19)20/h1-8,18H,(H,19,20)	LPEPZBJOKDYZAD-UHFFFAOYSA-N	281.06636317							42638
AM 281	LSM-3318	BRD-K59419204, AM-281	4302962	InChI=1S/C21H19Cl2IN4O2/c1-13-19(21(29)26-27-8-10-30-11-9-27)25-28(18-7-4-15(22)12-17(18)23)20(13)14-2-5-16(24)6-3-14/h2-7,12H,8-11H2,1H3,(H,26,29)	AJFFBPZYXRNAIC-UHFFFAOYSA-N	Cc1c(nn(c2ccc(Cl)cc2Cl)c1c3ccc(I)cc3)C(=O)NN4CCOCC4	BroadT	BRD-K59419204	BRD-K59419204-001-01-9	Tocris Bioscience	1115	7		Cc1c(nn(c1-c1ccc(I)cc1)-c1ccc(Cl)cc1Cl)C(=O)NN1CCOCC1	InChI=1S/C21H19Cl2IN4O2/c1-13-19(21(29)26-27-8-10-30-11-9-27)25-28(18-7-4-15(22)12-17(18)23)20(13)14-2-5-16(24)6-3-14/h2-7,12H,8-11H2,1H3,(H,26,29)	AJFFBPZYXRNAIC-UHFFFAOYSA-N	555.992974308							93039, 93039, 93039
Ubenimex	LSM-3323	Ubenimex	72172	InChI=1S/C16H24N2O4/c1-10(2)8-13(16(21)22)18-15(20)14(19)12(17)9-11-6-4-3-5-7-11/h3-7,10,12-14,19H,8-9,17H2,1-2H3,(H,18,20)(H,21,22)/t12-,13+,14+/m1/s1	VGGGPCQERPFHOB-RDBSUJKOSA-N	CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(=O)O	BroadT	BRD-K59574735	BRD-K59574735-001-02-7	Biomol International Inc.	EI-212	2840(V2)-3-N1305		CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(O)=O	InChI=1S/C16H24N2O4/c1-10(2)8-13(16(21)22)18-15(20)14(19)12(17)9-11-6-4-3-5-7-11/h3-7,10,12-14,19H,8-9,17H2,1-2H3,(H,18,20)(H,21,22)/t12-,13+,14+/m1/s1	VGGGPCQERPFHOB-RDBSUJKOSA-N	308.173607268							, 
Galantamine	LSM-5604	Galantamine, Galanthamine, Razadyne, Reminyl	9651	InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1	ASUTZQLVASHGKV-JDFRZJQESA-N	COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24	BroadT	BRD-K49481516	BRD-K49481516-004-03-5	MicroSource Discovery Systems Inc.	1501202		Br	COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24.Br	InChI=1S/C17H21NO3.BrH/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17;/h3-6,12,14,19H,7-10H2,1-2H3;1H/t12-,14-,17-;/m0./s1	QORVDGQLPPAFRS-XPSHAMGMSA-N	287.152143542							42944, 42944, 42944
Diphenhydramine	LSM-5581	Antitussive, Beldin, Belix, Benadryl, Benylin, Dibenil, Diphen, Diphenhydramine, Hydramine, Silphen	3100	InChI=1S/C17H21NO/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3	ZZVUWRFHKOJYTH-UHFFFAOYSA-N	CN(C)CCOC(c1ccccc1)c2ccccc2	BroadT	BRD-K47278471	BRD-K47278471-003-04-0	MicroSource Discovery Systems Inc.	1500256		Cl	CN(C)CCOC(c1ccccc1)c1ccccc1.Cl	InChI=1S/C17H21NO.ClH/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16;/h3-12,17H,13-14H2,1-2H3;1H	PCHPORCSPXIHLZ-UHFFFAOYSA-N	255.162314302							4636, 4636, 4636
E4031	LSM-2928	E-4031	3185	InChI=1S/C21H27N3O3S/c1-16-4-3-5-19(22-16)12-15-24-13-10-18(11-14-24)21(25)17-6-8-20(9-7-17)23-28(2,26)27/h3-9,18,23H,10-15H2,1-2H3	SRUISGSHWFJION-UHFFFAOYSA-N	Cc1cccc(CCN2CCC(CC2)C(=O)c3ccc(NS(=O)(=O)C)cc3)n1	BroadT	BRD-K41713976	BRD-K41713976-001-02-0	Biomol International Inc.	KC-158	2840(V2)-3-N1305		Cc1cccc(CCN2CCC(CC2)C(=O)c2ccc(NS(C)(=O)=O)cc2)n1	InChI=1S/C21H27N3O3S/c1-16-4-3-5-19(22-16)12-15-24-13-10-18(11-14-24)21(25)17-6-8-20(9-7-17)23-28(2,26)27/h3-9,18,23H,10-15H2,1-2H3	SRUISGSHWFJION-UHFFFAOYSA-N	401.177312444							34732, 34732
Bromhexine	LSM-3048	Bromhexine	2442	InChI=1S/C14H20Br2N2/c1-18(12-5-3-2-4-6-12)9-10-7-11(15)8-13(16)14(10)17/h7-8,12H,2-6,9,17H2,1H3	OJGDCBLYJGHCIH-UHFFFAOYSA-N	CN(Cc1cc(Br)cc(Br)c1N)C2CCCCC2	BroadT	BRD-K47631482	BRD-K47631482-003-02-1	MicroSource Discovery Systems Inc.	1503107		Cl	CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1.Cl	InChI=1S/C14H20Br2N2.ClH/c1-18(12-5-3-2-4-6-12)9-10-7-11(15)8-13(16)14(10)17;/h7-8,12H,2-6,9,17H2,1H3;1H	UCDKONUHZNTQPY-UHFFFAOYSA-N	373.99932386							77032, 77032
Gentisic acid	LSM-19031		3469	InChI=1S/C7H6O4/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,8-9H,(H,10,11)	WXTMDXOMEHJXQO-UHFFFAOYSA-N	OC(=O)c1cc(O)ccc1O	BroadT	BRD-K55927371	BRD-K55927371-001-02-0	MicroSource Discovery Systems Inc.	211307			OC(=O)c1cc(O)ccc1O	InChI=1S/C7H6O4/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,8-9H,(H,10,11)	WXTMDXOMEHJXQO-UHFFFAOYSA-N	154.026608672							17189
792173-99-0	LSM-2924	BRD-K41567364, SB-334867	6604926	InChI=1S/C17H13N5O2/c1-10-20-12-5-4-11(9-15(12)24-10)21-17(23)22-14-6-8-18-13-3-2-7-19-16(13)14/h2-9H,1H3,(H2,18,21,22,23)	AKMNUCBQGHFICM-UHFFFAOYSA-N	Cc1oc2cc(NC(=O)Nc3ccnc4cccnc34)ccc2n1	BroadT	BRD-K41567364	BRD-K41567364-001-01-2	Tocris Bioscience	1960	3		Cc1nc2ccc(NC(=O)Nc3ccnc4cccnc34)cc2o1	InChI=1S/C17H13N5O2/c1-10-20-12-5-4-11(9-15(12)24-10)21-17(23)22-14-6-8-18-13-3-2-7-19-16(13)14/h2-9H,1H3,(H2,18,21,22,23)	AKMNUCBQGHFICM-UHFFFAOYSA-N	319.106924706							92733, 92733
Meclofenamic acid	LSM-3108	Meclomen, Meclofenamate, Meclodium, CI-583, INF-4668, Meclofenamic-Acid, Meclofenamic Acid	4037	InChI=1S/C14H11Cl2NO2/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19/h2-7,17H,1H3,(H,18,19)	SBDNJUWAMKYJOX-UHFFFAOYSA-N	Cc1ccc(Cl)c(Nc2ccccc2C(=O)O)c1Cl	BroadT	BRD-K50398167	BRD-K50398167-236-02-9	MicroSource Discovery Systems Inc.	1500377		[Na]	Cc1ccc(Cl)c(Nc2ccccc2C(O)=O)c1Cl.[Na]	InChI=1S/C14H11Cl2NO2.Na.H/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19;;/h2-7,17H,1H3,(H,18,19);;	CHGIZYUDGOIAFY-UHFFFAOYSA-N	295.016684022							6710, 6710, 6710
Anandamide	LSM-43816	Anandamide (20	5281969	InChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h6-7,9-10,12-13,15-16,24H,2-5,8,11,14,17-21H2,1H3,(H,23,25)/b7-6-,10-9-,13-12-,16-15-	LGEQQWMQCRIYKG-DOFZRALJSA-N	CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCCO	BroadT	BRD-K42352790	BRD-K42352790-001-03-8	Biomol International Inc.	FA017	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCCO	InChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h6-7,9-10,12-13,15-16,24H,2-5,8,11,14,17-21H2,1H3,(H,23,25)/b7-6-,10-9-,13-12-,16-15-	LGEQQWMQCRIYKG-DOFZRALJSA-N	347.282429434							2700
171179-06-9	LSM-3069	BRD-K48735772, PD-158780	4707	InChI=1S/C14H12BrN5/c1-16-13-6-11-12(7-17-13)18-8-19-14(11)20-10-4-2-3-9(15)5-10/h2-8H,1H3,(H,16,17)(H,18,19,20)	KFHMLBXBRCITHF-UHFFFAOYSA-N	CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1	BroadT	BRD-K48735772	BRD-K48735772-001-01-4	Tocris Bioscience	2615	1		CNc1cc2c(Nc3cccc(Br)c3)ncnc2cn1	InChI=1S/C14H12BrN5/c1-16-13-6-11-12(7-17-13)18-8-19-14(11)20-10-4-2-3-9(15)5-10/h2-8H,1H3,(H,16,17)(H,18,19,20)	KFHMLBXBRCITHF-UHFFFAOYSA-N	329.027608034							92843
5Alpha-12-methoxy-4,4-bisnor-8,11,13-podocarpatrien-3-one	LSM-19033	BRD-K58336011, KBIO1_001737	6708746	InChI=1S/C16H20O2/c1-16-8-7-13(17)9-12(16)5-3-11-4-6-14(18-2)10-15(11)16/h4,6,10,12H,3,5,7-9H2,1-2H3/t12-,16-/m0/s1	MMDQZMROSQWSDC-LRDDRELGSA-N	COc1ccc2CC[C@H]3CC(=O)CC[C@]3(C)c2c1	BroadT	BRD-K58336011	BRD-K58336011-001-02-7	MicroSource Discovery Systems Inc.	100646			COc1ccc2CC[C@H]3CC(=O)CC[C@]3(C)c2c1	InChI=1S/C16H20O2/c1-16-8-7-13(17)9-12(16)5-3-11-4-6-14(18-2)10-15(11)16/h4,6,10,12H,3,5,7-9H2,1-2H3/t12-,16-/m0/s1	MMDQZMROSQWSDC-LRDDRELGSA-N	244.14632988							
1-(4-Methylphenyl)-1-(2-pyridyl)-3-pyrrolidino prop-1-ene	LSM-2240	BRD-K56231354	5588	InChI=1S/C19H22N2/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21/h2-3,6-12H,4-5,13-15H2,1H3	CBEQULMOCCWAQT-UHFFFAOYSA-N	Cc1ccc(cc1)C(=CCN2CCCC2)c3ccccn3	BroadT	BRD-K56231354	BRD-K56231354-003-01-5	Tocris Bioscience	662	1	Cl	Cc1ccc(cc1)C(=CCN1CCCC1)c1ccccn1.Cl	InChI=1S/C19H22N2.ClH/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21;/h2-3,6-12H,4-5,13-15H2,1H3;1H	WYUYEJNGHIOFOC-UHFFFAOYSA-N	278.178298724							92200
Derrubone	LSM-19034	Derrubone	5810067	InChI=1S/C21H18O6/c1-11(2)3-5-13-15(22)8-18-19(20(13)23)21(24)14(9-25-18)12-4-6-16-17(7-12)27-10-26-16/h3-4,6-9,22-23H,5,10H2,1-2H3	FTBGFGQPUMCUSC-UHFFFAOYSA-N	CC(=CCc1c(O)cc2OC=C(C(=O)c2c1O)c3ccc4OCOc4c3)C	BroadT	BRD-K59272984	BRD-K59272984-001-02-6	MicroSource Discovery Systems Inc.	201650			CC(C)=CCc1c(O)cc2occ(-c3ccc4OCOc4c3)c(=O)c2c1O	InChI=1S/C21H18O6/c1-11(2)3-5-13-15(22)8-18-19(20(13)23)21(24)14(9-25-18)12-4-6-16-17(7-12)27-10-26-16/h3-4,6-9,22-23H,5,10H2,1-2H3	FTBGFGQPUMCUSC-UHFFFAOYSA-N	366.110338296							107656
XE991	LSM-2949	BRD-K42748308, SID11114260	656732	InChI=1S/C26H20N2O/c29-25-21-5-1-3-7-23(21)26(17-19-9-13-27-14-10-19,18-20-11-15-28-16-12-20)24-8-4-2-6-22(24)25/h1-16H,17-18H2	KHJFBUUFMUBONL-UHFFFAOYSA-N	O=C1c2ccccc2C(Cc3ccncc3)(Cc4ccncc4)c5ccccc15	BroadT	BRD-K42748308	BRD-K42748308-300-01-2	Tocris Bioscience	2000	1	Cl.Cl	O=C1c2ccccc2C(Cc2ccncc2)(Cc2ccncc2)c2ccccc12.Cl.Cl	InChI=1S/C26H20N2O.2ClH/c29-25-21-5-1-3-7-23(21)26(17-19-9-13-27-14-10-19,18-20-11-15-28-16-12-20)24-8-4-2-6-22(24)25;;/h1-16H,17-18H2;2*1H	WOGWMARIFDNZON-UHFFFAOYSA-N	376.15756328							35046
4-Hydroxyantipyrine	LSM-5608	Phenazone, BRD-K49759007, SID11112498, SID56463349	98889	InChI=1S/C11H12N2O2/c1-8-10(14)11(15)13(12(8)2)9-6-4-3-5-7-9/h3-7,14H,1-2H3	SKVPTPMWXJSBTF-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)O)c2ccccc2	BroadT	BRD-K49759007	BRD-K49759007-001-03-6	Prestwick Chemical Inc.	Prestw-30	D0701-MP04-ST03-200-		Cc1c(O)c(=O)n(-c2ccccc2)n1C	InChI=1S/C11H12N2O2/c1-8-10(14)11(15)13(12(8)2)9-6-4-3-5-7-9/h3-7,14H,1-2H3	SKVPTPMWXJSBTF-UHFFFAOYSA-N	204.089877644							94641
JAK3 Inhibitor II	LSM-45207		3795	InChI=1S/C16H14BrN3O3/c1-22-14-6-10-12(7-15(14)23-2)18-8-19-16(10)20-9-3-4-13(21)11(17)5-9/h3-8,21H,1-2H3,(H,18,19,20)	CBIAKDAYHRWZCU-UHFFFAOYSA-N	COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC	BroadT	BRD-K07487750	BRD-K52850071-001-01-2	Calbiochem	420104			COc1cc2ncnc(Nc3ccc(O)c(Br)c3)c2cc1OC	InChI=1S/C16H14BrN3O3/c1-22-14-6-10-12(7-15(14)23-2)18-8-19-16(10)20-9-3-4-13(21)11(17)5-9/h3-8,21H,1-2H3,(H,18,19,20)	CBIAKDAYHRWZCU-UHFFFAOYSA-N	375.021853938					BRD-K07487750-001-02-5		
Clomethiazole	LSM-3110	Clomethiazole, Chlormethiazole, Sctz [As Edisylate]	10783	InChI=1S/C6H8ClNS/c1-5-6(2-3-7)9-4-8-5/h4H,2-3H2,1H3	PCLITLDOTJTVDJ-UHFFFAOYSA-N	Cc1ncsc1CCCl	BroadT	BRD-K50422030	BRD-K50422030-001-01-2	Biomol International Inc.	AC-482	2819-N1292		Cc1ncsc1CCCl	InChI=1S/C6H8ClNS/c1-5-6(2-3-7)9-4-8-5/h4H,2-3H2,1H3	PCLITLDOTJTVDJ-UHFFFAOYSA-N	161.006597666							92875
AG490	LSM-42880	AG-490, Tyrphostin B42	5328779	InChI=1S/C17H14N2O3/c18-10-14(8-13-6-7-15(20)16(21)9-13)17(22)19-11-12-4-2-1-3-5-12/h1-9,20-21H,11H2,(H,19,22)/b14-8+	TUCIOBMMDDOEMM-RIYZIHGNSA-N	Oc1ccc(\C=C(/C#N)\C(=O)NCc2ccccc2)cc1O	BroadT	BRD-K47105409	BRD-K47105409-001-05-3	Biomol International Inc.	EI-272	2840(V2)-3-N1305		Oc1ccc(cc1O)\C=C(/C#N)C(=O)NCc1ccccc1	InChI=1S/C17H14N2O3/c18-10-14(8-13-6-7-15(20)16(21)9-13)17(22)19-11-12-4-2-1-3-5-12/h1-9,20-21H,11H2,(H,19,22)/b14-8+	TUCIOBMMDDOEMM-RIYZIHGNSA-N	294.100442328							131968
Fenbendazole	LSM-3134		3334	InChI=1S/C15H13N3O2S/c1-20-15(19)18-14-16-12-8-7-11(9-13(12)17-14)21-10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)	HDDSHPAODJUKPD-UHFFFAOYSA-N	COC(=O)Nc1nc2cc(Sc3ccccc3)ccc2[nH]1	BroadT	BRD-K51318897	BRD-K51318897-001-04-7	Prestwick Chemical Inc.	Prestw-210	D0701-MP04-ST03-200-		COC(=O)Nc1nc2ccc(Sc3ccccc3)cc2[nH]1	InChI=1S/C15H13N3O2S/c1-20-15(19)18-14-16-12-8-7-11(9-13(12)17-14)21-10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)	HDDSHPAODJUKPD-UHFFFAOYSA-N	299.072847376							77092
Tazac, Axid, Axid Ar, Nizatidine	LSM-42963	Nizatidine, SID56463585	5353831	InChI=1S/C12H21N5O2S2/c1-13-11(6-17(18)19)14-4-5-20-8-10-9-21-12(15-10)7-16(2)3/h6,9,13-14H,4-5,7-8H2,1-3H3/b11-6-	SGXXNSQHWDMGGP-WDZFZDKYSA-N	CN\C(=C\[N+](=O)[O-])\NCCSCc1csc(CN(C)C)n1	BroadT	BRD-K46652470	BRD-K46652470-001-02-6	Prestwick Chemical Inc.	Prestw-921	D0701-MP04-ST03-200-		CN\C(NCCSCc1csc(CN(C)C)n1)=C\[N+]([O-])=O	InChI=1S/C12H21N5O2S2/c1-13-11(6-17(18)19)14-4-5-20-8-10-9-21-12(15-10)7-16(2)3/h6,9,13-14H,4-5,7-8H2,1-3H3/b11-6-	SGXXNSQHWDMGGP-WDZFZDKYSA-N	331.113666342							
6,3'-Dimethoxyflavone	LSM-19035	6,3-Dimethoxyflavone	676293	InChI=1S/C17H14O4/c1-19-12-5-3-4-11(8-12)17-10-15(18)14-9-13(20-2)6-7-16(14)21-17/h3-10H,1-2H3	LLLIKVGWTVPYAL-UHFFFAOYSA-N	COc1cccc(c1)C2=CC(=O)c3cc(OC)ccc3O2	BroadT	BRD-K47724892	BRD-K47724892-001-02-2	MicroSource Discovery Systems Inc.	1504132			COc1cccc(c1)-c1cc(=O)c2cc(OC)ccc2o1	InChI=1S/C17H14O4/c1-19-12-5-3-4-11(8-12)17-10-15(18)14-9-13(20-2)6-7-16(14)21-17/h3-10H,1-2H3	LLLIKVGWTVPYAL-UHFFFAOYSA-N	282.089208928							107657
Esculetin	LSM-6624	6,7-Dihydroxycoumarin, Esculetin	5281416	InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H	ILEDWLMCKZNDJK-UHFFFAOYSA-N	Oc1cc2OC(=O)C=Cc2cc1O	BroadT	BRD-K58149231	BRD-K58149231-001-06-9	Prestwick Chemical Inc.	Prestw-940	D0701-MP04-ST03-200-		Oc1cc2ccc(=O)oc2cc1O	InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H	ILEDWLMCKZNDJK-UHFFFAOYSA-N	178.026608672							490095
Tolfenamic acid	LSM-5612	Tolfenamic-Acid, Tolfenamic Acid	610479	InChI=1S/C14H12ClNO2/c1-9-11(15)6-4-8-12(9)16-13-7-3-2-5-10(13)14(17)18/h2-8,16H,1H3,(H,17,18)	YEZNLOUZAIOMLT-UHFFFAOYSA-N	Cc1c(Cl)cccc1Nc2ccccc2C(=O)O	BroadT	BRD-K50133271	BRD-K50133271-001-04-7	MicroSource Discovery Systems Inc.	1501198			Cc1c(Cl)cccc1Nc1ccccc1C(O)=O	InChI=1S/C14H12ClNO2/c1-9-11(15)6-4-8-12(9)16-13-7-3-2-5-10(13)14(17)18/h2-8,16H,1H3,(H,17,18)	YEZNLOUZAIOMLT-UHFFFAOYSA-N	261.055656344							32243
Tacedinaline	LSM-19036	Tacedinaline, CI-994, PD-123654, GOE-5549, RLM-2-68	2746	InChI=1S/C15H15N3O2/c1-10(19)17-12-8-6-11(7-9-12)15(20)18-14-5-3-2-4-13(14)16/h2-9H,16H2,1H3,(H,17,19)(H,18,20)	VAZAPHZUAVEOMC-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)C(=O)Nc2ccccc2N	BroadT	BRD-K52313696	BRD-K52313696-001-01-6	Broad Institute CMLD	RLM-2-68			CC(=O)Nc1ccc(cc1)C(=O)Nc1ccccc1N	InChI=1S/C15H15N3O2/c1-10(19)17-12-8-6-11(7-9-12)15(20)18-14-5-3-2-4-13(14)16/h2-9H,16H2,1H3,(H,17,19)(H,18,20)	VAZAPHZUAVEOMC-UHFFFAOYSA-N	269.11642675							90195
Betulinic acid	LSM-3004	Betulinic-Acid	64971	InChI=1S/C30H48O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-24,31H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,23-,24+,27-,28+,29+,30-/m0/s1	QGJZLNKBHJESQX-FZFNOLFKSA-N	CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)O	BroadT	BRD-K45401373	BRD-K45401373-001-05-0	Biomol International Inc.	AP-301	2840(V2)-3-N1305		CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O	InChI=1S/C30H48O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-24,31H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,23-,24+,27-,28+,29+,30-/m0/s1	QGJZLNKBHJESQX-FZFNOLFKSA-N	456.360345396							3087, 3087, 3087
Capsazepine	LSM-2983	Capsazepine	2733484	InChI=1S/C19H21ClN2O2S/c20-16-5-3-13(4-6-16)7-8-21-19(25)22-9-1-2-14-10-17(23)18(24)11-15(14)12-22/h3-6,10-11,23-24H,1-2,7-9,12H2,(H,21,25)	DRCMAZOSEIMCHM-UHFFFAOYSA-N	Oc1cc2CCCN(Cc2cc1O)C(=S)NCCc3ccc(Cl)cc3	BroadT	BRD-K44849676	BRD-K44849676-001-03-0	Biomol International Inc.	NK101	2840(V2)-3-N1305		Oc1cc2CCCN(Cc2cc1O)C(=S)NCCc1ccc(Cl)cc1	InChI=1S/C19H21ClN2O2S/c20-16-5-3-13(4-6-16)7-8-21-19(25)22-9-1-2-14-10-17(23)18(24)11-15(14)12-22/h3-6,10-11,23-24H,1-2,7-9,12H2,(H,21,25)	DRCMAZOSEIMCHM-UHFFFAOYSA-N	376.101226332							70773
Benzylpenicillin	LSM-3229	Benzylpenicillin, Bicillin, Permapen, Penicillin-2, Benzyl Penicillin, Penicillin G, Pfizerpen-AS	5904	InChI=1S/C16H18N2O4S/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t11-,12+,14-/m1/s1	JGSARLDLIJGVTE-MBNYWOFBSA-N	CC1(C)S[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O	BroadT	BRD-K55191674	BRD-K55191674-236-03-7	Prestwick Chemical Inc.	Prestw-1078	D0701-MP04-ST03-200-	[Na]	CC1(C)S[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(O)=O.[Na]	InChI=1S/C16H18N2O4S.Na.H/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9;;/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22);;/t11-,12+,14-;;/m1../s1	NIHYIUBBATVEBO-UDPGNSCCSA-N	334.098727766							18208, 18208, 18208, 18208, 18208, 18208, 18208
Khrinone E	LSM-19037	Koparin 2-Methyl Ether, Khrinone E	6710647	InChI=1S/C17H14O6/c1-21-13-6-5-10(17(22-2)16(13)20)12-8-23-14-7-9(18)3-4-11(14)15(12)19/h3-8,18,20H,1-2H3	WDHLJEOPUWGKKG-UHFFFAOYSA-N	COc1ccc(C2=COc3cc(O)ccc3C2=O)c(OC)c1O	BroadT	BRD-K43224838	BRD-K43224838-001-02-4	MicroSource Discovery Systems Inc.	200416			COc1ccc(c(OC)c1O)-c1coc2cc(O)ccc2c1=O	InChI=1S/C17H14O6/c1-21-13-6-5-10(17(22-2)16(13)20)12-8-23-14-7-9(18)3-4-11(14)15(12)19/h3-8,18,20H,1-2H3	WDHLJEOPUWGKKG-UHFFFAOYSA-N	314.079038168							107658
Tetracaine	LSM-4633	Tetracaine, Pontocaine, Metraspray, Dicaine, Amethocaine, Medihaler-Tetracaine	5411	InChI=1S/C15H24N2O2/c1-4-5-10-16-14-8-6-13(7-9-14)15(18)19-12-11-17(2)3/h6-9,16H,4-5,10-12H2,1-3H3	GKCBAIGFKIBETG-UHFFFAOYSA-N	CCCCNc1ccc(cc1)C(=O)OCCN(C)C	BroadT	BRD-K45071273	BRD-K45071273-003-04-1	MicroSource Discovery Systems Inc.	1500564		Cl	CCCCNc1ccc(cc1)C(=O)OCCN(C)C.Cl	InChI=1S/C15H24N2O2.ClH/c1-4-5-10-16-14-8-6-13(7-9-14)15(18)19-12-11-17(2)3;/h6-9,16H,4-5,10-12H2,1-3H3;1H	PPWHTZKZQNXVAE-UHFFFAOYSA-N	264.183778028							9468, 9468
6-Methoxy-harmalan	LSM-3224	6-Methoxy-Harmalan, 6-Methoxyharmalan	5474706	InChI=1S/C13H14N2O/c1-8-13-10(5-6-14-8)11-7-9(16-2)3-4-12(11)15-13/h3-4,7,15H,5-6H2,1-2H3	HMBHRMFLDKKSCT-UHFFFAOYSA-N	COc1ccc2[nH]c3C(=NCCc3c2c1)C	BroadT	BRD-K54906270	BRD-K54906270-001-03-5	Prestwick Chemical Inc.	Prestw-621	D0701-MP04-ST03-200-		COc1ccc2[nH]c3c(CCN=C3C)c2c1	InChI=1S/C13H14N2O/c1-8-13-10(5-6-14-8)11-7-9(16-2)3-4-12(11)15-13/h3-4,7,15H,5-6H2,1-2H3	HMBHRMFLDKKSCT-UHFFFAOYSA-N	214.110613088							
Immethridine	LSM-3087	Immethridine, BRD-K49519092	9989505	InChI=1S/C9H9N3/c1-3-10-4-2-8(1)5-9-6-11-7-12-9/h1-4,6-7H,5H2,(H,11,12)	DFVSGZHJSIEEQQ-UHFFFAOYSA-N	C(c1ccncc1)c2cnc[nH]2	BroadT	BRD-K49519092	BRD-K49519092-303-01-4	Tocris Bioscience	2315	1	Br.Br	C(c1cnc[nH]1)c1ccncc1.Br.Br	InChI=1S/C9H9N3.2BrH/c1-3-10-4-2-8(1)5-9-6-11-7-12-9;;/h1-4,6-7H,5H2,(H,11,12);2*1H	CYNKWHIKNDIVDR-UHFFFAOYSA-N	159.079647318							92859, 92859
Lysylphenylalanyltyrosine	LSM-3044	BRD-K47328134	6710772	InChI=1S/C24H32N4O5/c25-13-5-4-8-19(26)22(30)27-20(14-16-6-2-1-3-7-16)23(31)28-21(24(32)33)15-17-9-11-18(29)12-10-17/h1-3,6-7,9-12,19-21,29H,4-5,8,13-15,25-26H2,(H,27,30)(H,28,31)(H,32,33)/t19-,20-,21-/m0/s1	CNKBMTKICGGSCQ-ACRUOGEOSA-N	NCCCC[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)O	BroadT	BRD-K47328134	BRD-K47328134-001-02-0	MicroSource Discovery Systems Inc.	1502214			NCCCC[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O	InChI=1S/C24H32N4O5/c25-13-5-4-8-19(26)22(30)27-20(14-16-6-2-1-3-7-16)23(31)28-21(24(32)33)15-17-9-11-18(29)12-10-17/h1-3,6-7,9-12,19-21,29H,4-5,8,13-15,25-26H2,(H,27,30)(H,28,31)(H,32,33)/t19-,20-,21-/m0/s1	CNKBMTKICGGSCQ-ACRUOGEOSA-N	456.237270164							92826
Pentylenetetrazol	LSM-3287	Pentylenetetrazol, Pentetrazol, Pentamethylenetetrazol, Cardiazol	5917	InChI=1S/C6H10N4/c1-2-4-6-7-8-9-10(6)5-3-1/h1-5H2	CWRVKFFCRWGWCS-UHFFFAOYSA-N	C1CCc2nnnn2CC1	BroadT	BRD-K57718010	BRD-K57718010-001-06-9	Prestwick Chemical Inc.	Prestw-162	D0701-MP04-ST03-200-		C1CCc2nnnn2CC1	InChI=1S/C6H10N4/c1-2-4-6-7-8-9-10(6)5-3-1/h1-5H2	CWRVKFFCRWGWCS-UHFFFAOYSA-N	138.09054636							34910, 34910
Fenofibrate	LSM-3107	49562-28-9, Fenofibrate, Antara, Fenoglide, Lipidil, Lipofen, Tricor, Triglide	3339	InChI=1S/C20H21ClO4/c1-13(2)24-19(23)20(3,4)25-17-11-7-15(8-12-17)18(22)14-5-9-16(21)10-6-14/h5-13H,1-4H3	YMTINGFKWWXKFG-UHFFFAOYSA-N	CC(C)OC(=O)C(C)(C)Oc1ccc(cc1)C(=O)c2ccc(Cl)cc2	BroadT	BRD-K50388907	BRD-K50388907-001-04-9	MicroSource Discovery Systems Inc.	1501010			CC(C)OC(=O)C(C)(C)Oc1ccc(cc1)C(=O)c1ccc(Cl)cc1	InChI=1S/C20H21ClO4/c1-13(2)24-19(23)20(3,4)25-17-11-7-15(8-12-17)18(22)14-5-9-16(21)10-6-14/h5-13H,1-4H3	YMTINGFKWWXKFG-UHFFFAOYSA-N	360.112836862							5001
SCHEMBL2394914	LSM-3083	BRD-K49294207, SID29215540	17756796	InChI=1S/C22H27ClFN7/c1-3-30(4-2)13-15-7-9-31(10-8-15)22-25-12-19-20(29-22)21(27-14-26-19)28-16-5-6-18(24)17(23)11-16/h5-6,11-12,14-15H,3-4,7-10,13H2,1-2H3,(H,26,27,28)	JUGSLZCFNSTKBN-UHFFFAOYSA-N	CCN(CC)CC1CCN(CC1)c2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2	BroadT	BRD-K49294207	BRD-K49294207-300-01-2	Tocris Bioscience	2417	1	Cl.Cl	CCN(CC)CC1CCN(CC1)c1ncc2ncnc(Nc3ccc(F)c(Cl)c3)c2n1.Cl.Cl	InChI=1S/C22H27ClFN7.2ClH/c1-3-30(4-2)13-15-7-9-31(10-8-15)22-25-12-19-20(29-22)21(27-14-26-19)28-16-5-6-18(24)17(23)11-16;;/h5-6,11-12,14-15H,3-4,7-10,13H2,1-2H3,(H,26,27,28);2*1H	ZNNWCQCQUKAMGL-UHFFFAOYSA-N	443.200049844							92855
Canrenoate	LSM-3029	Canrenoate, Canrenoic Acid	656615	InChI=1S/C22H30O4/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21,26)12-8-19(24)25/h3-4,13,16-18,26H,5-12H2,1-2H3,(H,24,25)/t16-,17+,18+,20+,21+,22-/m1/s1	PBKZPPIHUVSDNM-WNHSNXHDSA-N	C[C@]12CCC(=O)C=C1C=C[C@@H]3[C@@H]2CC[C@@]4(C)[C@H]3CC[C@@]4(O)CCC(=O)O	BroadT	BRD-K46556543	BRD-K46556543-237-03-0	Prestwick Chemical Inc.	Prestw-148	D0701-MP04-ST03-200-	[K]	C[C@]12CC[C@H]3[C@@H](C=CC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@]2(O)CCC(O)=O.[K]	InChI=1S/C22H30O4.K.H/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21,26)12-8-19(24)25;;/h3-4,13,16-18,26H,5-12H2,1-2H3,(H,24,25);;/t16-,17+,18+,20+,21+,22-;;/m1../s1	YLXFIHIYNGPPSF-HUHWECDNSA-N	358.21440944							50156, 50156
Dizocilpine	LSM-5688	Dicozilpine, Dizocilpine, MK-801	180081	InChI=1S/C16H15N/c1-16-13-8-4-2-6-11(13)10-15(17-16)12-7-3-5-9-14(12)16/h2-9,15,17H,10H2,1H3/t15-,16+/m1/s1	LBOJYSIDWZQNJS-CVEARBPZSA-N	C[C@]12N[C@H](Cc3ccccc13)c4ccccc24	BroadT	BRD-K58930050	BRD-K58930050-001-01-1	Biomol International Inc.	AC-409	2817-N1277		C[C@]12N[C@H](Cc3ccccc13)c1ccccc21	InChI=1S/C16H15N/c1-16-13-8-4-2-6-11(13)10-15(17-16)12-7-3-5-9-14(12)16/h2-9,15,17H,10H2,1H3/t15-,16+/m1/s1	LBOJYSIDWZQNJS-CVEARBPZSA-N	221.12044949							34725, 34725, 34725
Piribedil	LSM-3057	Piribedil, EU-4200, ET-495	4850	InChI=1S/C16H18N4O2/c1-4-17-16(18-5-1)20-8-6-19(7-9-20)11-13-2-3-14-15(10-13)22-12-21-14/h1-5,10H,6-9,11-12H2	OQDPVLVUJFGPGQ-UHFFFAOYSA-N	C(N1CCN(CC1)c2ncccn2)c3ccc4OCOc4c3	BroadT	BRD-K47936004	BRD-K47936004-001-01-9	Biomol International Inc.	AC-259	2812-3-N1298		C(N1CCN(CC1)c1ncccn1)c1ccc2OCOc2c1	InChI=1S/C16H18N4O2/c1-4-17-16(18-5-1)20-8-6-19(7-9-20)11-13-2-3-14-15(10-13)22-12-21-14/h1-5,10H,6-9,11-12H2	OQDPVLVUJFGPGQ-UHFFFAOYSA-N	298.142975856							92833, 92833, 92833, 92833
CHEMBL137648	LSM-19038	3-Fluorobenzylspiperone, SID26751844, SID11113652	3248000	InChI=1S/C30H31F2N3O2/c31-25-13-11-24(12-14-25)28(36)10-5-17-33-18-15-30(16-19-33)29(37)34(21-23-6-4-7-26(32)20-23)22-35(30)27-8-2-1-3-9-27/h1-4,6-9,11-14,20H,5,10,15-19,21-22H2	DXZKTRNEOISOCA-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)CCCN2CCC3(CC2)N(CN(Cc4cccc(F)c4)C3=O)c5ccccc5	BroadT	BRD-K45662124	BRD-K45662124-001-01-8	Biomol International Inc.	AC-255	2812-3-N1298		Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)N(CN(Cc1cccc(F)c1)C2=O)c1ccccc1	InChI=1S/C30H31F2N3O2/c31-25-13-11-24(12-14-25)28(36)10-5-17-33-18-15-30(16-19-33)29(37)34(21-23-6-4-7-26(32)20-23)22-35(30)27-8-2-1-3-9-27/h1-4,6-9,11-14,20H,5,10,15-19,21-22H2	DXZKTRNEOISOCA-UHFFFAOYSA-N	503.238433662							107659
5,7 Dichlorokynurenic acid	LSM-19039	5,7-Dichlorokynurenic Acid	1779	InChI=1S/C10H5Cl2NO3/c11-4-1-5(12)9-6(2-4)13-7(10(15)16)3-8(9)14/h1-3H,(H,13,14)(H,15,16)	BGKFPRIGXAVYNX-UHFFFAOYSA-N	OC(=O)c1cc(O)c2c(Cl)cc(Cl)cc2n1	BroadT	BRD-K60287130	BRD-K60287130-001-02-4	MicroSource Discovery Systems Inc.	1502062			OC(=O)c1cc(O)c2c(Cl)cc(Cl)cc2n1	InChI=1S/C10H5Cl2NO3/c11-4-1-5(12)9-6(2-4)13-7(10(15)16)3-8(9)14/h1-3H,(H,13,14)(H,15,16)	BGKFPRIGXAVYNX-UHFFFAOYSA-N	256.96464845							107660, 107660
Antipyrine	LSM-3038	Phenazone, Antipyrine, Phenazon	2206	InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3	VEQOALNAAJBPNY-UHFFFAOYSA-N	CN1N(C(=O)C=C1C)c2ccccc2	BroadT	BRD-K46937689	BRD-K46937689-001-05-1	Prestwick Chemical Inc.	Prestw-29	D0701-MP04-ST03-200-		Cc1cc(=O)n(-c2ccccc2)n1C	InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3	VEQOALNAAJBPNY-UHFFFAOYSA-N	188.094963024							31225
Valsartan	LSM-2993	137862-53-4, Valsartan	60846	InChI=1S/C24H29N5O3/c1-4-5-10-21(30)29(22(16(2)3)24(31)32)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23-25-27-28-26-23/h6-9,11-14,16,22H,4-5,10,15H2,1-3H3,(H,31,32)(H,25,26,27,28)/t22-/m0/s1	ACWBQPMHZXGDFX-QFIPXVFZSA-N	CCCCC(=O)N(Cc1ccc(cc1)c2ccccc2c3nn[nH]n3)[C@@H](C(C)C)C(=O)O	BroadT	BRD-K45158365	BRD-K45158365-001-02-3	MicroSource Discovery Systems Inc.	1505209			CCCCC(=O)N(Cc1ccc(cc1)-c1ccccc1-c1nn[nH]n1)[C@@H](C(C)C)C(O)=O	InChI=1S/C24H29N5O3/c1-4-5-10-21(30)29(22(16(2)3)24(31)32)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23-25-27-28-26-23/h6-9,11-14,16,22H,4-5,10,15H2,1-3H3,(H,31,32)(H,25,26,27,28)/t22-/m0/s1	ACWBQPMHZXGDFX-QFIPXVFZSA-N	435.227039838							9927
R-59022	LSM-3215	R 59022, SID11111085, SID11113326, SID124879908	3012	InChI=1S/C27H26FN3OS/c1-19-24(26(32)31-17-18-33-27(31)29-19)13-16-30-14-11-22(12-15-30)25(20-5-3-2-4-6-20)21-7-9-23(28)10-8-21/h2-10,17-18H,11-16H2,1H3	MFVJXLPANKSLLD-UHFFFAOYSA-N	CC1=C(CCN2CCC(=C(c3ccccc3)c4ccc(F)cc4)CC2)C(=O)N5C=CSC5=N1	BroadT	BRD-K54665485	BRD-K54665485-001-01-2	EMD Biosciences	266785			Cc1nc2sccn2c(=O)c1CCN1CCC(CC1)=C(c1ccccc1)c1ccc(F)cc1	InChI=1S/C27H26FN3OS/c1-19-24(26(32)31-17-18-33-27(31)29-19)13-16-30-14-11-22(12-15-30)25(20-5-3-2-4-6-20)21-7-9-23(28)10-8-21/h2-10,17-18H,11-16H2,1H3	MFVJXLPANKSLLD-UHFFFAOYSA-N	459.178061372							92958
Tyrphostin 46	LSM-42972	Tyrphostin-46, AG-99	5328768	InChI=1S/C10H8N2O3/c11-5-7(10(12)15)3-6-1-2-8(13)9(14)4-6/h1-4,13-14H,(H2,12,15)/b7-3+	USOXQZNJFMKTKJ-XVNBXDOJSA-N	NC(=O)\C(=C\c1ccc(O)c(O)c1)\C#N	BroadT	BRD-K60184833	BRD-K60184833-001-02-3	Calbiochem	658430			NC(=O)C(=C\c1ccc(O)c(O)c1)\C#N	InChI=1S/C10H8N2O3/c11-5-7(10(12)15)3-6-1-2-8(13)9(14)4-6/h1-4,13-14H,(H2,12,15)/b7-3+	USOXQZNJFMKTKJ-XVNBXDOJSA-N	204.053492136							
Purvalanol B	LSM-2923	BRD-K41564320	448991	InChI=1S/C20H25ClN6O3/c1-10(2)15(8-28)24-20-25-17(16-18(26-20)27(9-22-16)11(3)4)23-12-5-6-13(19(29)30)14(21)7-12/h5-7,9-11,15,28H,8H2,1-4H3,(H,29,30)(H2,23,24,25,26)/t15-/m0/s1	ZKDXRFMOHZVXSG-HNNXBMFYSA-N	CC(C)[C@H](CO)Nc1nc(Nc2ccc(C(=O)O)c(Cl)c2)c3ncn(C(C)C)c3n1	BroadT	BRD-K41564320	BRD-K41564320-001-01-2	Tocris Bioscience	1581	3		CC(C)[C@H](CO)Nc1nc(Nc2ccc(C(O)=O)c(Cl)c2)c2ncn(C(C)C)c2n1	InChI=1S/C20H25ClN6O3/c1-10(2)15(8-28)24-20-25-17(16-18(26-20)27(9-22-16)11(3)4)23-12-5-6-13(19(29)30)14(21)7-12/h5-7,9-11,15,28H,8H2,1-4H3,(H,29,30)(H2,23,24,25,26)/t15-/m0/s1	ZKDXRFMOHZVXSG-HNNXBMFYSA-N	432.16766643							49840
127408-30-4	LSM-2947	BRD-K42679050, SID26753197	6918184	InChI=1S/C21H22N2O4/c1-14(24)23(26-13-15-7-5-4-6-8-15)19-17-11-16(12-22)9-10-18(17)27-21(2,3)20(19)25/h4-11,19-20,25H,13H2,1-3H3/t19-,20+/m1/s1	RHFUXPCCELGMFC-UXHICEINSA-N	CC(=O)N(OCc1ccccc1)[C@H]2[C@H](O)C(C)(C)Oc3ccc(cc23)C#N	BroadT	BRD-K42679050	BRD-K42679050-001-01-3	Tocris Bioscience	2077	1		CC(=O)N(OCc1ccccc1)[C@H]1[C@H](O)C(C)(C)Oc2ccc(cc12)C#N	InChI=1S/C21H22N2O4/c1-14(24)23(26-13-15-7-5-4-6-8-15)19-17-11-16(12-22)9-10-18(17)27-21(2,3)20(19)25/h4-11,19-20,25H,13H2,1-3H3/t19-,20+/m1/s1	RHFUXPCCELGMFC-UXHICEINSA-N	366.157957204							92752
Citco	LSM-44970	SID124892395, SID26756451, SID26756452	9600409	InChI=1S/C19H12Cl3N3OS/c20-14-4-2-13(3-5-14)18-17(25-7-8-27-19(25)24-18)10-23-26-11-12-1-6-15(21)16(22)9-12/h1-10H,11H2/b23-10+	ZQWBOKJVVYNKTL-AUEPDCJTSA-N	Clc1ccc(cc1)c2nc3sccn3c2\C=N\OCc4ccc(Cl)c(Cl)c4	BroadT	BRD-K53263234	BRD-K53263234-001-02-9	Biomol International Inc.	GR233	2840(V2)-3-N1305		Clc1ccc(cc1)-c1nc2sccn2c1\C=N\OCc1ccc(Cl)c(Cl)c1	InChI=1S/C19H12Cl3N3OS/c20-14-4-2-13(3-5-14)18-17(25-7-8-27-19(25)24-18)10-23-26-11-12-1-6-15(21)16(22)9-12/h1-10H,11H2/b23-10+	ZQWBOKJVVYNKTL-AUEPDCJTSA-N	434.976665854							
Calycanthine	LSM-3336	Calycanthine	5392245	InChI=1S/C22H26N4/c1-25-13-11-22-16-8-4-5-9-17(16)23-19(25)21(22)12-14-26(2)20(22)24-18-10-6-3-7-15(18)21/h3-10,19-20,23-24H,11-14H2,1-2H3/t19-,20-,21-,22-/m1/s1	XSYCDVWYEVUDKQ-GXRSIYKFSA-N	CN1CC[C@@]23[C@@H]4Nc5ccccc5[C@]2(CCN4C)[C@@H]1Nc6ccccc36	BroadT	BRD-K59851896	BRD-K59851896-001-02-4	Prestwick Chemical Inc.	Prestw-595	D0701-MP04-ST03-200-		CN1CC[C@@]23[C@@H]4Nc5ccccc5[C@]2(CCN4C)[C@@H]1Nc1ccccc31	InChI=1S/C22H26N4/c1-25-13-11-22-16-8-4-5-9-17(16)23-19(25)21(22)12-14-26(2)20(22)24-18-10-6-3-7-15(18)21/h3-10,19-20,23-24H,11-14H2,1-2H3/t19-,20-,21-,22-/m1/s1	XSYCDVWYEVUDKQ-GXRSIYKFSA-N	346.215746872							3333
Daunorubicin	LSM-2962	Daunorubicin HCl, Cerubidine, Daunorubicin, Daunoxome	30323	InChI=1S/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3/t10-,14-,16-,17-,22+,27-/m0/s1	STQGQHZAVUOBTE-VGBVRHCVSA-N	COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)C	BroadT	BRD-K43389675	BRD-K43389675-003-02-7	Prestwick Chemical Inc.	Prestw-487	D0701-MP04-ST03-200-	Cl	COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(C)=O.Cl	InChI=1S/C27H29NO10.ClH/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33;/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3;1H/t10-,14-,16-,17-,22+,27-;/m0./s1	GUGHGUXZJWAIAS-QQYBVWGSSA-N	527.179146138							41977, 41977, 41977
GBR12935	LSM-3101	GBR-12935, GBR 12935	3456	InChI=1S/C28H34N2O/c1-4-11-25(12-5-1)13-10-18-29-19-21-30(22-20-29)23-24-31-28(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-9,11-12,14-17,28H,10,13,18-24H2	RAQPOZGWANIDQT-UHFFFAOYSA-N	C(CN1CCN(CCOC(c2ccccc2)c3ccccc3)CC1)Cc4ccccc4	BroadT	BRD-K50135270	BRD-K50135270-001-01-9	Biomol International Inc.	AC-272	2812-3-N1298		C(CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1)Cc1ccccc1	InChI=1S/C28H34N2O/c1-4-11-25(12-5-1)13-10-18-29-19-21-30(22-20-29)23-24-31-28(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-9,11-12,14-17,28H,10,13,18-24H2	RAQPOZGWANIDQT-UHFFFAOYSA-N	414.267113728							64093, 64093, 64093
Chlorogenic acid	LSM-43324	Chlorogenicacid, NSC-407296, Chlorogenic Acid	1794427	InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1	CWVRJTMFETXNAD-JUHZACGLSA-N	O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1O)C(=O)O	BroadT	BRD-K47114202	BRD-K47114202-001-06-2	Prestwick Chemical Inc.	Prestw-427	D0701-MP04-ST03-200-		O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1O)C(O)=O	InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1	CWVRJTMFETXNAD-JUHZACGLSA-N	354.095082156							16112, 16112
Alpha-Santonin	LSM-6627	Santonin, Alpha-Santonin	221071	InChI=1S/C15H18O3/c1-8-10-4-6-15(3)7-5-11(16)9(2)12(15)13(10)18-14(8)17/h5,7-8,10,13H,4,6H2,1-3H3/t8-,10-,13-,15-/m0/s1	XJHDMGJURBVLLE-BOCCBSBMSA-N	C[C@H]1[C@@H]2CC[C@@]3(C)C=CC(=O)C(=C3[C@H]2OC1=O)C	BroadT	BRD-K58787433	BRD-K58787433-001-04-7	MicroSource Discovery Systems Inc.	300542			C[C@H]1[C@@H]2CC[C@@]3(C)C=CC(=O)C(C)=C3[C@H]2OC1=O	InChI=1S/C15H18O3/c1-8-10-4-6-15(3)7-5-11(16)9(2)12(15)13(10)18-14(8)17/h5,7-8,10,13H,4,6H2,1-3H3/t8-,10-,13-,15-/m0/s1	XJHDMGJURBVLLE-BOCCBSBMSA-N	246.125594436							16363
Y-26763	LSM-2992	BRD-K45117373, SID26753196	121878	InChI=1S/C14H16N2O4/c1-8(17)16(19)12-10-6-9(7-15)4-5-11(10)20-14(2,3)13(12)18/h4-6,12-13,18-19H,1-3H3/t12-,13+/m1/s1	IWTCFIIOUXJOOV-OLZOCXBDSA-N	CC(=O)N(O)[C@H]1[C@H](O)C(C)(C)Oc2ccc(cc12)C#N	BroadT	BRD-K45117373	BRD-K45117373-001-01-1	Tocris Bioscience	2076	1		CC(=O)N(O)[C@H]1[C@H](O)C(C)(C)Oc2ccc(cc12)C#N	InChI=1S/C14H16N2O4/c1-8(17)16(19)12-10-6-9(7-15)4-5-11(10)20-14(2,3)13(12)18/h4-6,12-13,18-19H,1-3H3/t12-,13+/m1/s1	IWTCFIIOUXJOOV-OLZOCXBDSA-N	276.111007012							92788
JTE 013	LSM-2961	BRD-K43330982, SID29215534	10223146	InChI=1S/C17H19Cl2N7O/c1-8(2)11-7-14(22-16-15(11)9(3)25-26(16)4)23-24-17(27)20-10-5-12(18)21-13(19)6-10/h5-8H,1-4H3,(H,22,23)(H2,20,21,24,27)	RNSLRQNDXRSASX-UHFFFAOYSA-N	CC(C)c1cc(NNC(=O)Nc2cc(Cl)nc(Cl)c2)nc3c1c(C)nn3C	BroadT	BRD-K43330982	BRD-K43330982-001-01-5	Tocris Bioscience	2392	2		CC(C)c1cc(NNC(=O)Nc2cc(Cl)nc(Cl)c2)nc2n(C)nc(C)c12	InChI=1S/C17H19Cl2N7O/c1-8(2)11-7-14(22-16-15(11)9(3)25-26(16)4)23-24-17(27)20-10-5-12(18)21-13(19)6-10/h5-8H,1-4H3,(H,22,23)(H2,20,21,24,27)	RNSLRQNDXRSASX-UHFFFAOYSA-N	407.102813718							92763
NU1025	LSM-4643	NU 1025, NU-1025	63306	InChI=1S/C9H8N2O2/c1-5-10-8-6(9(13)11-5)3-2-4-7(8)12/h2-4,12H,1H3,(H,10,11,13)	YJDAOHJWLUNFLX-UHFFFAOYSA-N	CC1=Nc2c(O)cccc2C(=O)N1	BroadT	BRD-K48692744	BRD-K48692744-001-01-2	Tocris Bioscience	1401	2		Cc1nc2c(O)cccc2c(=O)[nH]1	InChI=1S/C9H8N2O2/c1-5-10-8-6(9(13)11-5)3-2-4-7(8)12/h2-4,12H,1H3,(H,10,11,13)	YJDAOHJWLUNFLX-UHFFFAOYSA-N	176.058577516							75399
2-Phenylmelatonin	LSM-19040	BRD-K41869275, SID11113641, SID26751836	4018512	InChI=1S/C19H20N2O2/c1-13(22)20-11-10-16-17-12-15(23-2)8-9-18(17)21-19(16)14-6-4-3-5-7-14/h3-9,12,21H,10-11H2,1-2H3,(H,20,22)	OFCLARYYBGKCHN-UHFFFAOYSA-N	COc1ccc2[nH]c(c(CCNC(=O)C)c2c1)c3ccccc3	BroadT	BRD-K41869275	BRD-K41869275-001-01-0	Tocris Bioscience	680	3		COc1ccc2[nH]c(c(CCNC(C)=O)c2c1)-c1ccccc1	InChI=1S/C19H20N2O2/c1-13(22)20-11-10-16-17-12-15(23-2)8-9-18(17)21-19(16)14-6-4-3-5-7-14/h3-9,12,21H,10-11H2,1-2H3,(H,20,22)	OFCLARYYBGKCHN-UHFFFAOYSA-N	308.1524779							107661
Veratridine	LSM-3354	Veratridine, Chebi, SID73370	6280	InChI=1S/C36H51NO11/c1-19-6-11-26-31(3,40)35(43)25(17-37(26)16-19)33(42)18-34-24(32(33,41)15-27(35)38)10-9-23-30(34,2)13-12-28(36(23,44)48-34)47-29(39)20-7-8-21(45-4)22(14-20)46-5/h7-8,14,19,23-28,38,40-44H,6,9-13,15-18H2,1-5H3/t19-,23-,24-,25-,26-,27-,28-,30-,31+,32+,33+,34+,35-,36-/m0/s1	FVECELJHCSPHKY-YFUMOZOISA-N	COc1ccc(cc1OC)C(=O)O[C@H]2CC[C@@]3(C)[C@@H]4CC[C@H]5[C@]6(O)C[C@H](O)[C@@]7(O)[C@@H](CN8C[C@@H](C)CC[C@H]8[C@@]7(C)O)[C@]6(O)C[C@]35O[C@]24O	BroadT	BRD-K60923938	BRD-K60923938-001-02-8	Biomol International Inc.	NA-125	2840(V2)-3-N1305		COc1ccc(cc1OC)C(=O)O[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4[C@]5(O)C[C@H](O)[C@@]6(O)[C@@H](CN7C[C@@H](C)CC[C@H]7[C@@]6(C)O)[C@]5(O)C[C@]24O[C@]13O	InChI=1S/C36H51NO11/c1-19-6-11-26-31(3,40)35(43)25(17-37(26)16-19)33(42)18-34-24(32(33,41)15-27(35)38)10-9-23-30(34,2)13-12-28(36(23,44)48-34)47-29(39)20-7-8-21(45-4)22(14-20)46-5/h7-8,14,19,23-28,38,40-44H,6,9-13,15-18H2,1-5H3/t19-,23-,24-,25-,26-,27-,28-,30-,31+,32+,33+,34+,35-,36-/m0/s1	FVECELJHCSPHKY-YFUMOZOISA-N	673.346211462							28051
Hymecromone Methyl Ether	LSM-19041	SID26749612, SID93576648	390807	InChI=1S/C11H10O3/c1-7-5-11(12)14-10-6-8(13-2)3-4-9(7)10/h3-6H,1-2H3	UDFPKNSWSYBIHO-UHFFFAOYSA-N	COc1ccc2C(=CC(=O)Oc2c1)C	BroadT	BRD-K55766625	BRD-K55766625-001-02-6	MicroSource Discovery Systems Inc.	300540			COc1ccc2c(C)cc(=O)oc2c1	InChI=1S/C11H10O3/c1-7-5-11(12)14-10-6-8(13-2)3-4-9(7)10/h3-6H,1-2H3	UDFPKNSWSYBIHO-UHFFFAOYSA-N	190.06299418							107662
6,4'-Dimethoxyflavone	LSM-19042	SID26749643, SID24824095, BRD-K48629186	688670	InChI=1S/C17H14O4/c1-19-12-5-3-11(4-6-12)17-10-15(18)14-9-13(20-2)7-8-16(14)21-17/h3-10H,1-2H3	ANVFDWBCVDQNEZ-UHFFFAOYSA-N	COc1ccc(cc1)C2=CC(=O)c3cc(OC)ccc3O2	BroadT	BRD-K48629186	BRD-K48629186-001-02-7	MicroSource Discovery Systems Inc.	1500741			COc1ccc(cc1)-c1cc(=O)c2cc(OC)ccc2o1	InChI=1S/C17H14O4/c1-19-12-5-3-11(4-6-12)17-10-15(18)14-9-13(20-2)7-8-16(14)21-17/h3-10H,1-2H3	ANVFDWBCVDQNEZ-UHFFFAOYSA-N	282.089208928							107663
Acetohexamide	LSM-5638	33006, Dymelor, Acetohexamide	1989	InChI=1S/C15H20N2O4S/c1-11(18)12-7-9-14(10-8-12)22(20,21)17-15(19)16-13-5-3-2-4-6-13/h7-10,13H,2-6H2,1H3,(H2,16,17,19)	VGZSUPCWNCWDAN-UHFFFAOYSA-N	CC(=O)c1ccc(cc1)S(=O)(=O)NC(=O)NC2CCCCC2	BroadT	BRD-K52960356	BRD-K52960356-001-03-1	Prestwick Chemical Inc.	Prestw-55	D0701-MP04-ST03-200-		CC(=O)c1ccc(cc1)S(=O)(=O)NC(=O)NC1CCCCC1	InChI=1S/C15H20N2O4S/c1-11(18)12-7-9-14(10-8-12)22(20,21)17-15(19)16-13-5-3-2-4-6-13/h7-10,13H,2-6H2,1H3,(H2,16,17,19)	VGZSUPCWNCWDAN-UHFFFAOYSA-N	324.11437783							28052
2-(4,5-Dihydro-1H-imidazol-2-yl)quinoline	LSM-3231	BRD-K55344148, SID11110820, SID11113664, SID90341068	2457	InChI=1S/C12H11N3/c1-2-4-10-9(3-1)5-6-11(15-10)12-13-7-8-14-12/h1-6H,7-8H2,(H,13,14)	OSUVWJGCKQEMHK-UHFFFAOYSA-N	C1CN=C(N1)c2ccc3ccccc3n2	BroadT	BRD-K55344148	BRD-K55344148-003-01-8	Tocris Bioscience	725	4	Cl	C1CN=C(N1)c1ccc2ccccc2n1.Cl	InChI=1S/C12H11N3.ClH/c1-2-4-10-9(3-1)5-6-11(15-10)12-13-7-8-14-12;/h1-6H,7-8H2,(H,13,14);1H	DDFHQXAQWZWRSQ-UHFFFAOYSA-N	197.095297382							92967, 92967
Tyrphostin AG 879	LSM-3320	Tyrphostin Ag879, Tyrphostin Ag 879, Tyrphostin Ag-879, AG-879	6809654	InChI=1S/C18H24N2OS/c1-17(2,3)13-8-11(7-12(10-19)16(20)22)9-14(15(13)21)18(4,5)6/h7-9,21H,1-6H3,(H2,20,22)/b12-7+	XRZYELWZLNAXGE-KPKJPENVSA-N	CC(C)(C)c1cc(\C=C(/C#N)\C(=S)N)cc(c1O)C(C)(C)C	BroadT	BRD-K59469039	BRD-K59469039-001-04-9	Biomol International Inc.	EI-258	2840(V2)-3-N1305		CC(C)(C)c1cc(cc(c1O)C(C)(C)C)\C=C(/C#N)C(N)=S	InChI=1S/C18H24N2OS/c1-17(2,3)13-8-11(7-12(10-19)16(20)22)9-14(15(13)21)18(4,5)6/h7-9,21H,1-6H3,(H2,20,22)/b12-7+	XRZYELWZLNAXGE-KPKJPENVSA-N	316.160934098							
SPECTRUM_001028	LSM-2966	BRD-K43744935, SID137275803	5376	InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3	NKANXQFJJICGDU-UHFFFAOYSA-N	CCC(=C(c1ccccc1)c2ccc(OCCN(C)C)cc2)c3ccccc3	BroadT	BRD-K43744935	BRD-K43744935-048-01-6	Tocris Bioscience	999	3	OC(=O)CC(O)(CC(=O)O)C(=O)O	CCC(=C(c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1.OC(=O)CC(O)(CC(=O)O)C(=O)O	InChI=1S/C26H29NO.C6H8O7/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-18H,4,19-20H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)	FQZYTYWMLGAPFJ-UHFFFAOYSA-N	371.224914558							92766
BMS-182874	LSM-3258	BRD-K56509348, BMS-182874	122272	InChI=1S/C17H19N3O3S/c1-11-12(2)18-23-17(11)19-24(21,22)16-10-6-7-13-14(16)8-5-9-15(13)20(3)4/h5-10,19H,1-4H3	MJRGSRRZKSJHOE-UHFFFAOYSA-N	CN(C)c1cccc2c(cccc12)S(=O)(=O)Nc3onc(C)c3C	BroadT	BRD-K56509348	BRD-K56509348-003-01-3	Tocris Bioscience	1441	1	Cl	CN(C)c1cccc2c(cccc12)S(=O)(=O)Nc1onc(C)c1C.Cl	InChI=1S/C17H19N3O3S.ClH/c1-11-12(2)18-23-17(11)19-24(21,22)16-10-6-7-13-14(16)8-5-9-15(13)20(3)4;/h5-10,19H,1-4H3;1H	UZZFRNZGYDOBAO-UHFFFAOYSA-N	345.114712188							92993
CGS-15943	LSM-3076	CGS-15943, CGS15943	2690	InChI=1S/C13H8ClN5O/c14-7-3-4-9-8(6-7)12-17-11(10-2-1-5-20-10)18-19(12)13(15)16-9/h1-6H,(H2,15,16)	MSJODEOZODDVGW-UHFFFAOYSA-N	Nc1nc2ccc(Cl)cc2c3nc(nn13)c4occc4	BroadT	BRD-K49049886	BRD-K49049886-001-03-8	Tocris Bioscience	1699	2		Nc1nc2ccc(Cl)cc2c2nc(nn12)-c1ccco1	InChI=1S/C13H8ClN5O/c14-7-3-4-9-8(6-7)12-17-11(10-2-1-5-20-10)18-19(12)13(15)16-9/h1-6H,(H2,15,16)	MSJODEOZODDVGW-UHFFFAOYSA-N	285.041737636							92849, 92849, 131351, 131351
PP 1	LSM-3047	SID17402282, PP1, SID103904783, SID26756734, SID26756735, PP-1	1400	InChI=1S/C16H19N5/c1-10-5-7-11(8-6-10)13-12-14(17)18-9-19-15(12)21(20-13)16(2,3)4/h5-9H,1-4H3,(H2,17,18,19)	ZVPDNRVYHLRXLX-UHFFFAOYSA-N	Cc1ccc(cc1)c2nn(c3ncnc(N)c23)C(C)(C)C	BroadT	BRD-K47598052	BRD-K47598052-001-04-2	Biomol International Inc.	EI-275	2840(V2)-3-N1305		Cc1ccc(cc1)-c1nn(c2ncnc(N)c12)C(C)(C)C	InChI=1S/C16H19N5/c1-10-5-7-11(8-6-10)13-12-14(17)18-9-19-15(12)21(20-13)16(2,3)4/h5-9H,1-4H3,(H2,17,18,19)	ZVPDNRVYHLRXLX-UHFFFAOYSA-N	281.164045658							
Dilazep	LSM-3068	Dilazep, Dilazep Dihydrochloride	3074	InChI=1S/C31H44N2O10/c1-36-24-18-22(19-25(37-2)28(24)40-5)30(34)42-16-8-12-32-10-7-11-33(15-14-32)13-9-17-43-31(35)23-20-26(38-3)29(41-6)27(21-23)39-4/h18-21H,7-17H2,1-6H3	QVZCXCJXTMIDME-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)OCCCN2CCCN(CCCOC(=O)c3cc(OC)c(OC)c(OC)c3)CC2	BroadT	BRD-K48722258	BRD-K48722258-300-04-5	Tocris Bioscience	481	2	Cl.Cl	COc1cc(cc(OC)c1OC)C(=O)OCCCN1CCCN(CCCOC(=O)c2cc(OC)c(OC)c(OC)c2)CC1.Cl.Cl	InChI=1S/C31H44N2O10.2ClH/c1-36-24-18-22(19-25(37-2)28(24)40-5)30(34)42-16-8-12-32-10-7-11-33(15-14-32)13-9-17-43-31(35)23-20-26(38-3)29(41-6)27(21-23)39-4;;/h18-21H,7-17H2,1-6H3;2*1H	VILIWRRWAWKXRW-UHFFFAOYSA-N	604.299595628							92842, 92842, 92842
2-[(2,6-Dimethylphenyl)amino]-n,n-diethyl-n-methyl-2-oxoethanaminium	LSM-3339	BRD-K60060639, SID11113875	168868	InChI=1S/C15H24N2O/c1-6-17(5,7-2)11-14(18)16-15-12(3)9-8-10-13(15)4/h8-10H,6-7,11H2,1-5H3/p+1	HFRFLLYLVAKRMZ-UHFFFAOYSA-O	CC[N+](C)(CC)CC(=O)Nc1c(C)cccc1C	BroadT	BRD-K60060639	BRD-K60060639-005-01-4	Tocris Bioscience	1042	2	I	CC[N+](C)(CC)CC(=O)Nc1c(C)cccc1C.I	InChI=1S/C15H24N2O.HI/c1-6-17(5,7-2)11-14(18)16-15-12(3)9-8-10-13(15)4;/h8-10H,6-7,11H2,1-5H3;1H/p+1	QLXGAILYZFJDSH-UHFFFAOYSA-O	249.19668844							93054
HSCI1_000081	LSM-19043	4a-Phorbol	24058665	InChI=1S/C20H28O6/c1-9-5-13-18(24,15(9)22)7-11(8-21)6-12-14-17(3,4)20(14,26)16(23)10(2)19(12,13)25/h5-6,10,12-14,16,21,23-26H,7-8H2,1-4H3/t10-,12+,13-,14-,16-,18-,19+,20+/m1/s1	QGVLYPPODPLXMB-ICWWCJFESA-N	C[C@@H]1[C@@H](O)[C@@]2(O)[C@H]([C@@H]3C=C(CO)C[C@@]4(O)[C@@H](C=C(C)C4=O)[C@]13O)C2(C)C	BroadT	BRD-K60024823	BRD-K60024823-001-01-5	EMD Biosciences	524382			C[C@@H]1[C@@H](O)[C@@]2(O)[C@H]([C@@H]3C=C(CO)C[C@@]4(O)[C@@H](C=C(C)C4=O)[C@]13O)C2(C)C	InChI=1S/C20H28O6/c1-9-5-13-18(24,15(9)22)7-11(8-21)6-12-14-17(3,4)20(14,26)16(23)10(2)19(12,13)25/h5-6,10,12-14,16,21,23-26H,7-8H2,1-4H3/t10-,12+,13-,14-,16-,18-,19+,20+/m1/s1	QGVLYPPODPLXMB-ICWWCJFESA-N	364.188588616							107664
Piperine	LSM-42991	Piperine	638024	InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	MXXWOMGUGJBKIW-YPCIICBESA-N	O=C(\C=C\C=C\c1ccc2OCOc2c1)N3CCCCC3	BroadT	BRD-K59522102	BRD-K59522102-001-04-7	MicroSource Discovery Systems Inc.	1500873			O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1	InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	MXXWOMGUGJBKIW-YPCIICBESA-N	285.136493478							28821
Purvalanola	LSM-3118	Piceatannol, Purvalanola, Purvalanol A	456214	InChI=1S/C19H25ClN6O/c1-11(2)15(9-27)23-19-24-17(22-14-7-5-6-13(20)8-14)16-18(25-19)26(10-21-16)12(3)4/h5-8,10-12,15,27H,9H2,1-4H3,(H2,22,23,24,25)/t15-/m0/s1	PMXCMJLOPOFPBT-HNNXBMFYSA-N	CC(C)[C@H](CO)Nc1nc(Nc2cccc(Cl)c2)c3ncn(C(C)C)c3n1	BroadT	BRD-K50836978	BRD-K50836978-001-01-7	Tocris Bioscience	1580	3		CC(C)[C@H](CO)Nc1nc(Nc2cccc(Cl)c2)c2ncn(C(C)C)c2n1	InChI=1S/C19H25ClN6O/c1-11(2)15(9-27)23-19-24-17(22-14-7-5-6-13(20)8-14)16-18(25-19)26(10-21-16)12(3)4/h5-8,10-12,15,27H,9H2,1-4H3,(H2,22,23,24,25)/t15-/m0/s1	PMXCMJLOPOFPBT-HNNXBMFYSA-N	388.17783719							47600
Dephostatin	LSM-3344		5353574	InChI=1S/C7H8N2O3/c1-9(8-12)6-4-5(10)2-3-7(6)11/h2-4,10-11H,1H3	HCJOLYFWJWJPTJ-UHFFFAOYSA-N	CN(N=O)c1cc(O)ccc1O	BroadT	BRD-K60274257	BRD-K60274257-001-01-1	Calbiochem	263200			CN([N+][O-])c1cc(O)ccc1O	InChI=1S/C7H8N2O3/c1-9(8-12)6-4-5(10)2-3-7(6)11/h2-4,10-11H,1H3	HCJOLYFWJWJPTJ-UHFFFAOYSA-N	168.053492136							
SCH-28080	LSM-3243	BRD-K55748775, SID11114180, SID124881444	108137	InChI=1S/C17H15N3O/c1-13-15(9-10-18)20-11-5-8-16(17(20)19-13)21-12-14-6-3-2-4-7-14/h2-8,11H,9,12H2,1H3	PYKJFEPAUKAXNN-UHFFFAOYSA-N	Cc1nc2c(OCc3ccccc3)cccn2c1CC#N	BroadT	BRD-K55748775	BRD-K55748775-001-01-4	Tocris Bioscience	1690	2		Cc1nc2c(OCc3ccccc3)cccn2c1CC#N	InChI=1S/C17H15N3O/c1-13-15(9-10-18)20-11-5-8-16(17(20)19-13)21-12-14-6-3-2-4-7-14/h2-8,11H,9,12H2,1H3	PYKJFEPAUKAXNN-UHFFFAOYSA-N	277.12151213							92978, 92978
ZINC03978807	LSM-19044	BRD-K49745710	40469791	InChI=1S/C8H8O3/c1-6-7(2-4-9)8(10)3-5-11-6/h3-5H,2H2,1H3	OJRUCLKIAXLMBK-UHFFFAOYSA-N	CC1=C(CC=O)C(=O)C=CO1	BroadT	BRD-K49745710	BRD-K49745710-001-02-5	MicroSource Discovery Systems Inc.	1504091			Cc1occc(=O)c1CC=O	InChI=1S/C8H8O3/c1-6-7(2-4-9)8(10)3-5-11-6/h3-5H,2H2,1H3	OJRUCLKIAXLMBK-UHFFFAOYSA-N	152.047344116							107665
Amitriptyline	LSM-3190	Amitril, Amitriptyline, Elavil, Endep, Amitid, Limbitrol, Etrafon-A, Etrafon-Forte	2160	InChI=1S/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3	KRMDCWKBEZIMAB-UHFFFAOYSA-N	CN(C)CCC=C1c2ccccc2CCc3ccccc13	BroadT	BRD-K53737926	BRD-K53737926-003-04-7	MicroSource Discovery Systems Inc.	1500117		Cl	CN(C)CCC=C1c2ccccc2CCc2ccccc12.Cl	InChI=1S/C20H23N.ClH/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20;/h3-6,8-12H,7,13-15H2,1-2H3;1H	KFYRPLNVJVHZGT-UHFFFAOYSA-N	277.183049746							2666, 2666
SRC Kinase Inhibitor I	LSM-3112		1474853	InChI=1S/C22H19N3O3/c1-26-20-12-18-19(13-21(20)27-2)23-14-24-22(18)25-15-8-10-17(11-9-15)28-16-6-4-3-5-7-16/h3-14H,1-2H3,(H,23,24,25)	DMWVGXGXHPOEPT-UHFFFAOYSA-N	COc1cc2ncnc(Nc3ccc(Oc4ccccc4)cc3)c2cc1OC	BroadT	BRD-K50495309	BRD-K50495309-001-01-2	Calbiochem	567805			COc1cc2ncnc(Nc3ccc(Oc4ccccc4)cc3)c2cc1OC	InChI=1S/C22H19N3O3/c1-26-20-12-18-19(13-21(20)27-2)23-14-24-22(18)25-15-8-10-17(11-9-15)28-16-6-4-3-5-7-16/h3-14H,1-2H3,(H,23,24,25)	DMWVGXGXHPOEPT-UHFFFAOYSA-N	373.142641498							78332
N-(3,3-Diphenylpropyl)glycinamide	LSM-2916	BRD-K41143549, N-(3,3-Diphenylpropyl)Glycinamide	6603827	InChI=1S/C17H20N2O/c18-17(20)13-19-12-11-16(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16,19H,11-13H2,(H2,18,20)	BYGXICRJQZKUPA-UHFFFAOYSA-N	NC(=O)CNCCC(c1ccccc1)c2ccccc2	BroadT	BRD-K41143549	BRD-K41143549-003-01-6	Tocris Bioscience	2213	1	Cl	NC(=O)CNCCC(c1ccccc1)c1ccccc1.Cl	InChI=1S/C17H20N2O.ClH/c18-17(20)13-19-12-11-16(14-7-3-1-4-8-14)15-9-5-2-6-10-15;/h1-10,16,19H,11-13H2,(H2,18,20);1H	JCJDLPUASJEVRN-UHFFFAOYSA-N	268.15756328							92727, 92727
UNII-Q85IYK36S4	LSM-3240	BRD-K55677650, SID26755040	6918409	InChI=1S/C21H27NO3/c1-17-2-4-18(5-3-17)16-21(24)10-12-22(13-11-21)14-15-25-20-8-6-19(23)7-9-20/h2-9,23-24H,10-16H2,1H3	VKMFDKYCIKEDMR-UHFFFAOYSA-N	Cc1ccc(CC2(O)CCN(CCOc3ccc(O)cc3)CC2)cc1	BroadT	BRD-K55677650	BRD-K55677650-003-01-1	Tocris Bioscience	2456	1	Cl	Cc1ccc(CC2(O)CCN(CCOc3ccc(O)cc3)CC2)cc1.Cl	InChI=1S/C21H27NO3.ClH/c1-17-2-4-18(5-3-17)16-21(24)10-12-22(13-11-21)14-15-25-20-8-6-19(23)7-9-20;/h2-9,23-24H,10-16H2,1H3;1H	WFFZHKKSIDENAJ-UHFFFAOYSA-N	341.199093734							92975
RO 04-6790	LSM-2960	RO 04-6790 DIHYDROCHLORIDE4-AMINO-N-2,6-BIS(METHYLAMINO)-4-PYRIMIDINYL-BENZENESULFONAMIDE DIHYDROCHLORIDE, RO-046790	5312145	InChI=1S/C12H16N6O2S/c1-14-10-7-11(17-12(15-2)16-10)18-21(19,20)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H3,14,15,16,17,18)	JELFWSXQTXRMAJ-UHFFFAOYSA-N	CNc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(NC)n1	BroadT	BRD-K43290182	BRD-K43290182-001-01-9	Biomol International Inc.	AC-842	2813-N1283		CNc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(NC)n1	InChI=1S/C12H16N6O2S/c1-14-10-7-11(17-12(15-2)16-10)18-21(19,20)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H3,14,15,16,17,18)	JELFWSXQTXRMAJ-UHFFFAOYSA-N	308.105544502							92762, 92762, 92762, 92762
Chlorprothixene	LSM-42990	SID144203583, SID11110647, SID4253130, SID50108484	667466	InChI=1S/C18H18ClNS/c1-20(2)11-5-7-14-15-6-3-4-8-17(15)21-18-10-9-13(19)12-16(14)18/h3-4,6-10,12H,5,11H2,1-2H3/b14-7+	WSPOMRSOLSGNFJ-VGOFMYFVSA-N	CN(C)CC\C=C\1/c2ccccc2Sc3ccc(Cl)cc13	BroadT	BRD-K59058766	BRD-K59058766-003-03-7	MicroSource Discovery Systems Inc.	1503203		Cl	CN(C)CC\C=C1/c2ccccc2Sc2ccc(Cl)cc12.Cl	InChI=1S/C18H18ClNS.ClH/c1-20(2)11-5-7-14-15-6-3-4-8-17(15)21-18-10-9-13(19)12-16(14)18;/h3-4,6-10,12H,5,11H2,1-2H3;1H/b14-7+;	YWKRLOSRDGPEJR-FJUODKGNSA-N	315.084847986							50932, 50932
Aloisine	LSM-3131	Aloisine	3641059	InChI=1S/C17H19N3O/c1-3-4-5-14-15(12-6-8-13(21-2)9-7-12)20-17-16(14)18-10-11-19-17/h6-11H,3-5H2,1-2H3,(H,19,20)	WVMANZPBOBRWCB-UHFFFAOYSA-N	CCCCc1c([nH]c2nccnc12)c3ccc(OC)cc3	BroadT	BRD-K51276371	BRD-K51276371-001-01-8	Calbiochem	128135			CCCCc1c([nH]c2nccnc12)-c1ccc(OC)cc1	InChI=1S/C17H19N3O/c1-3-4-5-14-15(12-6-8-13(21-2)9-7-12)20-17-16(14)18-10-11-19-17/h6-11H,3-5H2,1-2H3,(H,19,20)	WVMANZPBOBRWCB-UHFFFAOYSA-N	281.152812258							92890
Cyclopamine	LSM-3304	Cyclopamine, [3H]-Cyclopamine	442972	InChI=1S/C27H41NO2/c1-15-11-24-25(28-14-15)17(3)27(30-24)10-8-20-21-6-5-18-12-19(29)7-9-26(18,4)23(21)13-22(20)16(27)2/h5,15,17,19-21,23-25,28-29H,6-14H2,1-4H3/t15-,17+,19-,20-,21-,23-,24+,25-,26-,27-/m0/s1	QASFUMOKHFSJGL-LAFRSMQTSA-N	C[C@@H]1CN[C@@H]2[C@@H](C1)O[C@]3(CC[C@H]4[C@@H]5CC=C6C[C@@H](O)CC[C@]6(C)[C@H]5CC4=C3C)[C@@H]2C	BroadT	BRD-K58938839	BRD-K58938839-001-03-8	Biomol International Inc.	GR334	2840(V2)-3-N1305		C[C@@H]1[C@@H]2NC[C@@H](C)C[C@H]2O[C@]11CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC2=C1C	InChI=1S/C27H41NO2/c1-15-11-24-25(28-14-15)17(3)27(30-24)10-8-20-21-6-5-18-12-19(29)7-9-26(18,4)23(21)13-22(20)16(27)2/h5,15,17,19-21,23-25,28-29H,6-14H2,1-4H3/t15-,17+,19-,20-,21-,23-,24+,25-,26-,27-/m0/s1	QASFUMOKHFSJGL-LAFRSMQTSA-N	411.313729562							4021
Sulfabenzamide	LSM-5698	Sulfabenzamide, Sulfabenzamide (Triple Sulfa)	5319	InChI=1S/C13H12N2O3S/c14-11-6-8-12(9-7-11)19(17,18)15-13(16)10-4-2-1-3-5-10/h1-9H,14H2,(H,15,16)	PBCZLFBEBARBBI-UHFFFAOYSA-N	Nc1ccc(cc1)S(=O)(=O)NC(=O)c2ccccc2	BroadT	BRD-K59983611	BRD-K59983611-001-05-2	Prestwick Chemical Inc.	Prestw-711	D0701-MP04-ST03-200-		Nc1ccc(cc1)S(=O)(=O)NC(=O)c1ccccc1	InChI=1S/C13H12N2O3S/c14-11-6-8-12(9-7-11)19(17,18)15-13(16)10-4-2-1-3-5-10/h1-9H,14H2,(H,15,16)	PBCZLFBEBARBBI-UHFFFAOYSA-N	276.056862954							94677
Nbqx	LSM-3054	Nbqx, BRD-K47717570, SID11113877, SID90340695	3272524	InChI=1S/C12H8N4O6S/c13-23(21,22)8-3-1-2-5-9(8)7(16(19)20)4-6-10(5)15-12(18)11(17)14-6/h1-4H,(H,14,17)(H,15,18)(H2,13,21,22)	UQNAFPHGVPVTAL-UHFFFAOYSA-N	NS(=O)(=O)c1cccc2c3nc(O)c(O)nc3cc(c12)[N+](=O)[O-]	BroadT	BRD-K47717570	BRD-K47717570-304-01-5	Tocris Bioscience	1044	18	[Na].[Na]	NS(=O)(=O)c1cccc2c1c(cc1nc(O)c(O)nc21)[N+]([O-])=O.[Na].[Na]	InChI=1S/C12H8N4O6S.2Na.2H/c13-23(21,22)8-3-1-2-5-9(8)7(16(19)20)4-6-10(5)15-12(18)11(17)14-6;;;;/h1-4H,(H,14,17)(H,15,18)(H2,13,21,22);;;;	HNRRCCUZMYMTQP-UHFFFAOYSA-N	336.016454706							31073, 31073
Azaperone	LSM-3012	Azaperone, Stresnil, Suicalm, R-1929	15443	InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2	XTKDAFGWCDAMPY-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)CCCN2CCN(CC2)c3ccccn3	BroadT	BRD-K45861246	BRD-K45861246-001-04-3	MicroSource Discovery Systems Inc.	1505332			Fc1ccc(cc1)C(=O)CCCN1CCN(CC1)c1ccccn1	InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2	XTKDAFGWCDAMPY-UHFFFAOYSA-N	327.174690554							88301
Protriptyline	LSM-2936	Protriptyline	4976	InChI=1S/C19H21N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-10,12-13,19-20H,6,11,14H2,1H3	BWPIARFWQZKAIA-UHFFFAOYSA-N	CNCCCC1c2ccccc2C=Cc3ccccc13	BroadT	BRD-K42098891	BRD-K42098891-003-03-1	Prestwick Chemical Inc.	Prestw-930	D0701-MP04-ST03-200-	Cl	CNCCCC1c2ccccc2C=Cc2ccccc12.Cl	InChI=1S/C19H21N.ClH/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19;/h2-5,7-10,12-13,19-20H,6,11,14H2,1H3;1H	OGQDIIKRQRZXJH-UHFFFAOYSA-N	263.167399682							8597, 8597
Nifenazone	LSM-5583	Nifenazone	4487	InChI=1S/C17H16N4O2/c1-12-15(19-16(22)13-7-6-10-18-11-13)17(23)21(20(12)2)14-8-4-3-5-9-14/h3-11H,1-2H3,(H,19,22)	BRZANEXCSZCZCI-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)NC(=O)c2cccnc2)c3ccccc3	BroadT	BRD-K47407372	BRD-K47407372-001-04-9	MicroSource Discovery Systems Inc.	1503230			Cc1c(NC(=O)c2cccnc2)c(=O)n(-c2ccccc2)n1C	InChI=1S/C17H16N4O2/c1-12-15(19-16(22)13-7-6-10-18-11-13)17(23)21(20(12)2)14-8-4-3-5-9-14/h3-11H,1-2H3,(H,19,22)	BRZANEXCSZCZCI-UHFFFAOYSA-N	308.127325792							94632
A-3	LSM-19045	SID29215027, SID26755304, SID26751691, SID26751690, SID11113466	1960	InChI=1S/C12H13ClN2O2S/c13-11-5-1-4-10-9(11)3-2-6-12(10)18(16,17)15-8-7-14/h1-6,15H,7-8,14H2	ACIMRXKJKQGBGL-UHFFFAOYSA-N	NCCNS(=O)(=O)c1cccc2c(Cl)cccc12	BroadT	BRD-K51215422	BRD-K51215422-001-02-3	Biomol International Inc.	EI-145	2840(V2)-3-N1305		NCCNS(=O)(=O)c1cccc2c(Cl)cccc12	InChI=1S/C12H13ClN2O2S/c13-11-5-1-4-10-9(11)3-2-6-12(10)18(16,17)15-8-7-14/h1-6,15H,7-8,14H2	ACIMRXKJKQGBGL-UHFFFAOYSA-N	284.038626076							107666, 107666
CHEMBL254777	LSM-3059	BRD-K48059230, YM-268198	11716890	InChI=1S/C17H20N4OS/c1-10-15(16(22)19-12-5-3-2-4-6-12)23-17-20-13-8-7-11(18)9-14(13)21(10)17/h7-9,12H,2-6,18H2,1H3,(H,19,22)	VWOMTTIMBHBPBI-UHFFFAOYSA-N	Cc1c(sc2nc3ccc(N)cc3n12)C(=O)NC4CCCCC4	BroadT	BRD-K48059230	BRD-K48059230-003-01-1	Tocris Bioscience	2447	1	Cl	Cc1c(sc2nc3ccc(N)cc3n12)C(=O)NC1CCCCC1.Cl	InChI=1S/C17H20N4OS.ClH/c1-10-15(16(22)19-12-5-3-2-4-6-12)23-17-20-13-8-7-11(18)9-14(13)21(10)17;/h7-9,12H,2-6,18H2,1H3,(H,19,22);1H	SWKZWXJQIDXGLX-UHFFFAOYSA-N	328.13578199							92835, 92835
SC 19220	LSM-3162	BRD-K52512893, SC-19220	4336830	InChI=1S/C16H14ClN3O3/c1-10(21)18-19-16(22)20-9-11-4-2-3-5-14(11)23-15-7-6-12(17)8-13(15)20/h2-8H,9H2,1H3,(H,18,21)(H,19,22)	KNURFLJTOUGOOQ-UHFFFAOYSA-N	CC(=O)NNC(=O)N1Cc2ccccc2Oc3ccc(Cl)cc13	BroadT	BRD-K52512893	BRD-K52512893-001-03-0	Tocris Bioscience	1206	3		CC(=O)NNC(=O)N1Cc2ccccc2Oc2ccc(Cl)cc12	InChI=1S/C16H14ClN3O3/c1-10(21)18-19-16(22)20-9-11-4-2-3-5-14(11)23-15-7-6-12(17)8-13(15)20/h2-8H,9H2,1H3,(H,18,21)(H,19,22)	KNURFLJTOUGOOQ-UHFFFAOYSA-N	331.072369048							92916
4-Methyldaphnetin	LSM-19046	SID26749934, SID93576698	5355836	InChI=1S/C10H8O4/c1-5-4-8(12)14-10-6(5)2-3-7(11)9(10)13/h2-4,11,13H,1H3	NWQBYMPNIJXFNQ-UHFFFAOYSA-N	CC1=CC(=O)Oc2c(O)c(O)ccc12	BroadT	BRD-K49207204	BRD-K49207204-001-02-9	MicroSource Discovery Systems Inc.	1500730			Cc1cc(=O)oc2c(O)c(O)ccc12	InChI=1S/C10H8O4/c1-5-4-8(12)14-10-6(5)2-3-7(11)9(10)13/h2-4,11,13H,1H3	NWQBYMPNIJXFNQ-UHFFFAOYSA-N	192.042258736							107667
N,N-Hexamethyleneamiloride	LSM-2912	5-(N,N-Hexamethylene)Amiloride, Hexamethyleneamiloride, Hexamethylene Amiloride	1794	InChI=1S/C12H18ClN7O/c13-8-10(20-5-3-1-2-4-6-20)18-9(14)7(17-8)11(21)19-12(15)16/h1-6H2,(H2,14,18)(H4,15,16,19,21)	RQQJJXVETXFINY-UHFFFAOYSA-N	NC(=N)NC(=O)c1nc(Cl)c(nc1N)N2CCCCCC2	BroadT	BRD-K40990712	BRD-K40990712-001-02-4	MicroSource Discovery Systems Inc.	1504215			NC(=N)NC(=O)c1nc(Cl)c(nc1N)N1CCCCCC1	InChI=1S/C12H18ClN7O/c13-8-10(20-5-3-1-2-4-6-20)18-9(14)7(17-8)11(21)19-12(15)16/h1-6H2,(H2,14,18)(H4,15,16,19,21)	RQQJJXVETXFINY-UHFFFAOYSA-N	311.126135976							76400, 76400
Podofilox	LSM-3055	Condylox, Podofilox, Podophyllotoxin	10607	InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19-,20-/m0/s1	YJGVMLPVUAXIQN-XVVDYKMHSA-N	COc1cc(cc(OC)c1OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@@H](O)c4cc5OCOc5cc24	BroadT	BRD-K47869605	BRD-K47869605-001-04-9	MicroSource Discovery Systems Inc.	2300332			COc1cc(cc(OC)c1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@@H](O)c2cc3OCOc3cc12	InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19-,20-/m0/s1	YJGVMLPVUAXIQN-XVVDYKMHSA-N	414.131467664							50305
Hymecromone	LSM-3025	Cantabiline, Hymecromone, LM-94	5280567	InChI=1S/C10H8O3/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5,11H,1H3	HSHNITRMYYLLCV-UHFFFAOYSA-N	CC1=CC(=O)Oc2cc(O)ccc12	BroadT	BRD-K46424862	BRD-K46424862-001-04-2	Prestwick Chemical Inc.	Prestw-901	D0701-MP04-ST03-200-		Cc1cc(=O)oc2cc(O)ccc12	InChI=1S/C10H8O3/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5,11H,1H3	HSHNITRMYYLLCV-UHFFFAOYSA-N	176.047344116							17224, 17224
Tyrphostin 1	LSM-2933	2-(4-Methoxybenzylidene)Malononitrile, Tyrphostin-1, Tyrphostin 1	2063	InChI=1S/C11H8N2O/c1-14-11-4-2-9(3-5-11)6-10(7-12)8-13/h2-6H,1H3	UOHFCPXBKJPCAD-UHFFFAOYSA-N	COc1ccc(C=C(C#N)C#N)cc1	BroadT	BRD-K41996876	BRD-K41996876-001-05-5	Biomol International Inc.	EI-190	2840(V2)-3-N1305		COc1ccc(C=C(C#N)C#N)cc1	InChI=1S/C11H8N2O/c1-14-11-4-2-9(3-5-11)6-10(7-12)8-13/h2-6H,1H3	UOHFCPXBKJPCAD-UHFFFAOYSA-N	184.063662896							92740
CHEMBL19259	LSM-15540	SID11113546, BRD-K47337578	5234410	InChI=1S/C22H26FNO/c23-21-11-9-19(10-12-21)22(25)20-13-16-24(17-14-20)15-5-4-8-18-6-2-1-3-7-18/h1-3,6-7,9-12,20H,4-5,8,13-17H2	FTJXZACAQRDRNT-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)C2CCN(CCCCc3ccccc3)CC2	BroadT	BRD-K47337578	BRD-K47337578-034-01-7	Tocris Bioscience	523	3	OC(=O)C(=O)O	Fc1ccc(cc1)C(=O)C1CCN(CCCCc2ccccc2)CC1.OC(=O)C(=O)O	InChI=1S/C22H26FNO.C2H2O4/c23-21-11-9-19(10-12-21)22(25)20-13-16-24(17-14-20)15-5-4-8-18-6-2-1-3-7-18;3-1(4)2(5)6/h1-3,6-7,9-12,20H,4-5,8,13-17H2;(H,3,4)(H,5,6)	VUJYJCRJPFMHEM-UHFFFAOYSA-N	339.199842662							104176, 104176
Vinpocetine	LSM-3178	Vinpocetine, AY-27255	443955	InChI=1S/C22H26N2O2/c1-3-22-11-7-12-23-13-10-16-15-8-5-6-9-17(15)24(19(16)20(22)23)18(14-22)21(25)26-4-2/h5-6,8-9,14,20H,3-4,7,10-13H2,1-2H3/t20-,22+/m1/s1	DDNCQMVWWZOMLN-IRLDBZIGSA-N	CCOC(=O)C1=C[C@]2(CC)CCCN3CCc4c([C@H]23)n1c5ccccc45	BroadT	BRD-K53318339	BRD-K53318339-001-04-1	MicroSource Discovery Systems Inc.	1503115			CCOC(=O)C1=C[C@]2(CC)CCCN3CCc4c([C@H]23)n1c1ccccc41	InChI=1S/C22H26N2O2/c1-3-22-11-7-12-23-13-10-16-15-8-5-6-9-17(15)24(19(16)20(22)23)18(14-22)21(25)26-4-2/h5-6,8-9,14,20H,3-4,7,10-13H2,1-2H3/t20-,22+/m1/s1	DDNCQMVWWZOMLN-IRLDBZIGSA-N	350.199428092							92929
313981-55-4	LSM-3024	BRD-K46384212, SID11114240	770820	InChI=1S/C16H16F3NO2S/c1-10-8-11(2)15(12(3)9-10)23(21,22)20-14-7-5-4-6-13(14)16(17,18)19/h4-9,20H,1-3H3	SKJJIFRWCCSXGL-UHFFFAOYSA-N	Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc2ccccc2C(F)(F)F	BroadT	BRD-K46384212	BRD-K46384212-001-01-1	Tocris Bioscience	1942	1		Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc1ccccc1C(F)(F)F	InChI=1S/C16H16F3NO2S/c1-10-8-11(2)15(12(3)9-10)23(21,22)20-14-7-5-4-6-13(14)16(17,18)19/h4-9,20H,1-3H3	SKJJIFRWCCSXGL-UHFFFAOYSA-N	343.085384052							92812
Sulfaethidole	LSM-19047	Sulfaethidole, Sulphaethidole	7181	InChI=1S/C10H12N4O2S2/c1-2-9-12-13-10(17-9)14-18(15,16)8-5-3-7(11)4-6-8/h3-6H,2,11H2,1H3,(H,13,14)	SVYBEBLNQGDRHF-UHFFFAOYSA-N	CCc1nnc(NS(=O)(=O)c2ccc(N)cc2)s1	BroadT	BRD-K56881825	BRD-K56881825-001-01-2	TimTec LLC	ST007534			CCc1nnc(NS(=O)(=O)c2ccc(N)cc2)s1	InChI=1S/C10H12N4O2S2/c1-2-9-12-13-10(17-9)14-18(15,16)8-5-3-7(11)4-6-8/h3-6H,2,11H2,1H3,(H,13,14)	SVYBEBLNQGDRHF-UHFFFAOYSA-N	284.040167044							107668
ZK 756326	LSM-3253	BRD-K56403959, SID50112915	11688990	InChI=1S/C21H28N2O3/c24-14-16-25-15-13-22-9-11-23(12-10-22)18-19-5-4-8-21(17-19)26-20-6-2-1-3-7-20/h1-8,17,24H,9-16,18H2	SHDFUNGIHDOLQM-UHFFFAOYSA-N	OCCOCCN1CCN(Cc2cccc(Oc3ccccc3)c2)CC1	BroadT	BRD-K56403959	BRD-K56403959-300-01-9	Tocris Bioscience	2565	1	Cl.Cl	OCCOCCN1CCN(Cc2cccc(Oc3ccccc3)c2)CC1.Cl.Cl	InChI=1S/C21H28N2O3.2ClH/c24-14-16-25-15-13-22-9-11-23(12-10-22)18-19-5-4-8-21(17-19)26-20-6-2-1-3-7-20;;/h1-8,17,24H,9-16,18H2;2*1H	MPACCEKWFGWZHS-UHFFFAOYSA-N	356.209992776							92988
Tripelennamine	LSM-3271	Tripelannamine, Pbz, Tripelennamine, PBZ-SR	5587	InChI=1S/C16H21N3/c1-18(2)12-13-19(16-10-6-7-11-17-16)14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3	UFLGIAIHIAPJJC-UHFFFAOYSA-N	CN(C)CCN(Cc1ccccc1)c2ccccn2	BroadT	BRD-K57033106	BRD-K57033106-048-02-8	MicroSource Discovery Systems Inc.	1500597		OC(=O)CC(O)(CC(=O)O)C(=O)O	CN(C)CCN(Cc1ccccc1)c1ccccn1.OC(=O)CC(O)(CC(=O)O)C(=O)O	InChI=1S/C16H21N3.C6H8O7/c1-18(2)12-13-19(16-10-6-7-11-17-16)14-15-8-4-3-5-9-15;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-11H,12-14H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)	GGRBYIUPUOYRLQ-UHFFFAOYSA-N	255.173547702							9741, 9741, 9741
KI8751	LSM-3040	BRD-K47150025, SID50112904	11317348	InChI=1S/C24H18F3N3O4/c1-32-22-11-15-20(12-23(22)33-2)28-8-7-21(15)34-14-4-6-19(17(27)10-14)30-24(31)29-18-5-3-13(25)9-16(18)26/h3-12H,1-2H3,(H2,29,30,31)	LFKQSJNCVRGFCC-UHFFFAOYSA-N	COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)cc4F)c(F)c3)c2cc1OC	BroadT	BRD-K47150025	BRD-K47150025-001-01-2	Tocris Bioscience	2542	1		COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)cc4F)c(F)c3)c2cc1OC	InChI=1S/C24H18F3N3O4/c1-32-22-11-15-20(12-23(22)33-2)28-8-7-21(15)34-14-4-6-19(17(27)10-14)30-24(31)29-18-5-3-13(25)9-16(18)26/h3-12H,1-2H3,(H2,29,30,31)	LFKQSJNCVRGFCC-UHFFFAOYSA-N	469.124940686							92822
CHEMBL34095	LSM-3355	R(+)-6-Bromo-APB, SID26755662, SID90340657	10452020	InChI=1S/C19H20BrNO2/c1-2-9-21-10-8-14-15(11-17(22)19(23)18(14)20)16(12-21)13-6-4-3-5-7-13/h2-7,11,16,22-23H,1,8-10,12H2/t16-/m1/s1	KKZGFVAZUKHFAC-MRXNPFEDSA-N	Oc1cc2[C@H](CN(CC=C)CCc2c(Br)c1O)c3ccccc3	BroadT	BRD-K60932973	BRD-K60932973-001-01-7	Biomol International Inc.	AC-821	2812-3-N1298		Oc1cc2[C@H](CN(CC=C)CCc2c(Br)c1O)c1ccccc1	InChI=1S/C19H20BrNO2/c1-2-9-21-10-8-14-15(11-17(22)19(23)18(14)20)16(12-21)13-6-4-3-5-7-13/h2-7,11,16,22-23H,1,8-10,12H2/t16-/m1/s1	KKZGFVAZUKHFAC-MRXNPFEDSA-N	373.06774149							93064, 93064
MLS000438989	LSM-19048	SID26752643, SID14728854, SID104232027, BRD-K54898768	9549917	InChI=1S/C13H13NO2/c1-10-13(16)12(15)7-8-14(10)9-11-5-3-2-4-6-11/h2-8,16H,9H2,1H3	DJXFYXVBMAAEKZ-UHFFFAOYSA-N	CC1=C(O)C(=O)C=CN1Cc2ccccc2	BroadT	BRD-K54898768	BRD-K54898768-001-07-4	Boston University CMLD	CMLD001923			Cc1c(O)c(=O)ccn1Cc1ccccc1	InChI=1S/C13H13NO2/c1-10-13(16)12(15)7-8-14(10)9-11-5-3-2-4-6-11/h2-8,16H,9H2,1H3	DJXFYXVBMAAEKZ-UHFFFAOYSA-N	215.094628666							107669
AC1LFR2F	LSM-19049	BRD-K15143174	758234	InChI=1S/C19H22N2O3/c1-23-17-12-10-15(11-13-17)6-5-9-19(22)21-20-14-16-7-3-4-8-18(16)24-2/h3-4,7-8,10-14H,5-6,9H2,1-2H3,(H,21,22)	LSXYAGUSDHNGEN-UHFFFAOYSA-N	COc1ccc(CCCC(=O)NN=Cc2ccccc2OC)cc1	BroadT	BRD-K15143174	BRD-K15143174-001-05-5	ChemDiv Inc.	8003-3431			COc1ccc(CCCC(=O)NN=Cc2ccccc2OC)cc1	InChI=1S/C19H22N2O3/c1-23-17-12-10-15(11-13-17)6-5-9-19(22)21-20-14-16-7-3-4-8-18(16)24-2/h3-4,7-8,10-14H,5-6,9H2,1-2H3,(H,21,22)	LSXYAGUSDHNGEN-UHFFFAOYSA-N	326.163042584							107670
AC1LH9N7	LSM-15541	BRD-K78751545	883907	InChI=1S/C20H30N2O/c23-20(22-14-5-2-6-15-22)19-11-16-21(17-12-19)13-7-10-18-8-3-1-4-9-18/h1,3-4,8-9,19H,2,5-7,10-17H2	RBCQPZCZAKIOMH-UHFFFAOYSA-N	O=C(C1CCN(CCCc2ccccc2)CC1)N3CCCCC3	BroadT	BRD-K78751545	BRD-K78751545-034-05-2	ChemBridge Corporation	6578507		OC(=O)C(=O)O	O=C(C1CCN(CCCc2ccccc2)CC1)N1CCCCC1.OC(=O)C(=O)O	InChI=1S/C20H30N2O.C2H2O4/c23-20(22-14-5-2-6-15-22)19-11-16-21(17-12-19)13-7-10-18-8-3-1-4-9-18;3-1(4)2(5)6/h1,3-4,8-9,19H,2,5-7,10-17H2;(H,3,4)(H,5,6)	WZZVLZJQYDYOBT-UHFFFAOYSA-N	314.2358136							104177, 104177
MLS000518254	LSM-19050	SID14728544, BRD-K35208305	4493565	InChI=1S/C18H14ClNO3/c1-22-13-8-6-12(7-9-13)20-18(21)17-11-10-16(23-17)14-4-2-3-5-15(14)19/h2-11H,1H3,(H,20,21)	SSWSMOFPKKPGBV-UHFFFAOYSA-N	COc1ccc(NC(=O)c2oc(cc2)c3ccccc3Cl)cc1	BroadT	BRD-K35208305	BRD-K35208305-001-05-4	University of Kansas CMLD	KUC100026			COc1ccc(NC(=O)c2ccc(o2)-c2ccccc2Cl)cc1	InChI=1S/C18H14ClNO3/c1-22-13-8-6-12(7-9-13)20-18(21)17-11-10-16(23-17)14-4-2-3-5-15(14)19/h2-11H,1H3,(H,20,21)	SSWSMOFPKKPGBV-UHFFFAOYSA-N	327.066221028							107671
AC1MMDQK	LSM-19051	SID4242277, BRD-K68443944	3237154	InChI=1S/C19H19N3O4S/c1-2-26-19(25)22-9-7-21(8-10-22)18(24)15-11-13-16(27-15)12-5-3-4-6-14(12)20-17(13)23/h3-6,11H,2,7-10H2,1H3,(H,20,23)	MGPLWXMMDWAEOO-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)c2cc3c(O)nc4ccccc4c3s2	BroadT	BRD-K68443944	BRD-K68443944-001-05-4	ChemDiv Inc.	C448-0305			CCOC(=O)N1CCN(CC1)C(=O)c1cc2c(O)nc3ccccc3c2s1	InChI=1S/C19H19N3O4S/c1-2-26-19(25)22-9-7-21(8-10-22)18(24)15-11-13-16(27-15)12-5-3-4-6-14(12)20-17(13)23/h3-6,11H,2,7-10H2,1H3,(H,20,23)	MGPLWXMMDWAEOO-UHFFFAOYSA-N	385.109626808							107672
ST50488017	LSM-19052	SID846856, BRD-A13403390	649252	InChI=1S/C23H25N3O2/c1-16-12-17(2)26(24-16)15-20(27)14-25-22-7-5-4-6-19(22)13-23(25)18-8-10-21(28-3)11-9-18/h4-13,20,27H,14-15H2,1-3H3	RFTKCCULWRMXMX-UHFFFAOYSA-N	COc1ccc(cc1)c2cc3ccccc3n2CC(O)Cn4nc(C)cc4C	BroadT	BRD-A13403390	BRD-A13403390-001-05-5	Asinex Ltd.	BAS 05022818			COc1ccc(cc1)-c1cc2ccccc2n1CC(O)Cn1nc(C)cc1C	InChI=1S/C23H25N3O2/c1-16-12-17(2)26(24-16)15-20(27)14-25-22-7-5-4-6-19(22)13-23(25)18-8-10-21(28-3)11-9-18/h4-13,20,27H,14-15H2,1-3H3	RFTKCCULWRMXMX-UHFFFAOYSA-N	375.19467707							107673
STK224466	LSM-19053	SID17414165, BRD-K27022091	1288047	InChI=1S/C22H19ClN2O3S/c1-28-17-10-8-16(9-11-17)24-22(27)19-4-2-3-5-20(19)25-21(26)14-29-18-12-6-15(23)7-13-18/h2-13H,14H2,1H3,(H,24,27)(H,25,26)	XYHKGPIVBRCZEV-UHFFFAOYSA-N	COc1ccc(NC(=O)c2ccccc2NC(=O)CSc3ccc(Cl)cc3)cc1	BroadT	BRD-K27022091	BRD-K27022091-001-05-7	ChemBridge Corporation	7726894			COc1ccc(NC(=O)c2ccccc2NC(=O)CSc2ccc(Cl)cc2)cc1	InChI=1S/C22H19ClN2O3S/c1-28-17-10-8-16(9-11-17)24-22(27)19-4-2-3-5-20(19)25-21(26)14-29-18-12-6-15(23)7-13-18/h2-13H,14H2,1H3,(H,24,27)(H,25,26)	XYHKGPIVBRCZEV-UHFFFAOYSA-N	426.080490888							107674
SMR000095690	LSM-19054	SID49677617, SID7967838, BRD-A17815299	5309064	InChI=1S/C21H24FN5O2S/c1-26-10-2-4-17(26)12-19-24-25-21(27(19)16-8-6-15(22)7-9-16)30-14-20(28)23-13-18-5-3-11-29-18/h2,4,6-10,18H,3,5,11-14H2,1H3,(H,23,28)	VSPDCSSRROXDMQ-UHFFFAOYSA-N	Cn1cccc1Cc2nnc(SCC(=O)NCC3CCCO3)n2c4ccc(F)cc4	BroadT	BRD-A17815299	BRD-A17815299-001-04-1	ChemDiv Inc.	C677-0286			Cn1cccc1Cc1nnc(SCC(=O)NCC2CCCO2)n1-c1ccc(F)cc1	InChI=1S/C21H24FN5O2S/c1-26-10-2-4-17(26)12-19-24-25-21(27(19)16-8-6-15(22)7-9-16)30-14-20(28)23-13-18-5-3-11-29-18/h2,4,6-10,18H,3,5,11-14H2,1H3,(H,23,28)	VSPDCSSRROXDMQ-UHFFFAOYSA-N	429.163473948							107675
MLS000582831	LSM-19055	SID17432592, BRD-K92105860	2237510	InChI=1S/C20H22BrN3O3/c1-3-4-5-18(25)22-16-10-8-14(9-11-16)19(26)23-24-20(27)15-7-6-13(2)17(21)12-15/h6-12H,3-5H2,1-2H3,(H,22,25)(H,23,26)(H,24,27)	FHYSENNAGROFEP-UHFFFAOYSA-N	CCCCC(=O)Nc1ccc(cc1)C(=O)NNC(=O)c2ccc(C)c(Br)c2	BroadT	BRD-K92105860	BRD-K92105860-001-05-9	ChemBridge Corporation	7981190			CCCCC(=O)Nc1ccc(cc1)C(=O)NNC(=O)c1ccc(C)c(Br)c1	InChI=1S/C20H22BrN3O3/c1-3-4-5-18(25)22-16-10-8-14(9-11-16)19(26)23-24-20(27)15-7-6-13(2)17(21)12-15/h6-12H,3-5H2,1-2H3,(H,22,25)(H,23,26)(H,24,27)	FHYSENNAGROFEP-UHFFFAOYSA-N	431.084454194							107676
SMR000108273	LSM-19056	SID7976392, BRD-K29702666	1311459	InChI=1S/C23H19N3O3/c1-2-28-20-13-7-10-17(15-20)21(27)24-19-12-6-11-18(14-19)23-26-25-22(29-23)16-8-4-3-5-9-16/h3-15H,2H2,1H3,(H,24,27)	GMJUPOLZOFIQST-UHFFFAOYSA-N	CCOc1cccc(c1)C(=O)Nc2cccc(c2)c3oc(nn3)c4ccccc4	BroadT	BRD-K29702666	BRD-K29702666-001-05-7	ChemBridge Corporation	6807384			CCOc1cccc(c1)C(=O)Nc1cccc(c1)-c1nnc(o1)-c1ccccc1	InChI=1S/C23H19N3O3/c1-2-28-20-13-7-10-17(15-20)21(27)24-19-12-6-11-18(14-19)23-26-25-22(29-23)16-8-4-3-5-9-16/h3-15H,2H2,1H3,(H,24,27)	GMJUPOLZOFIQST-UHFFFAOYSA-N	385.142641498							107677
AC1MMVMK	LSM-19057	SID4251445, BRD-K17684526	3245131	InChI=1S/C10H15N3O2S2/c1-2-13-8(11)7(17-10(13)16)9(14)12-3-5-15-6-4-12/h2-6,11H2,1H3	YPIWHELEPHBQIM-UHFFFAOYSA-N	CCN1C(=C(SC1=S)C(=O)N2CCOCC2)N	BroadT	BRD-K17684526	BRD-K17684526-001-05-1	ChemDiv Inc.	6000-1615			CCn1c(N)c(sc1=S)C(=O)N1CCOCC1	InChI=1S/C10H15N3O2S2/c1-2-13-8(11)7(17-10(13)16)9(14)12-3-5-15-6-4-12/h2-6,11H2,1H3	YPIWHELEPHBQIM-UHFFFAOYSA-N	273.06056813							107678
ST50196057	LSM-19058	SID4262514, BRD-K60791319	724755	InChI=1S/C16H18N2O4S/c1-2-12-5-3-4-6-15(12)22-11-16(19)18-13-7-9-14(10-8-13)23(17,20)21/h3-10H,2,11H2,1H3,(H,18,19)(H2,17,20,21)	HSAPLXUGGAVLKM-UHFFFAOYSA-N	CCc1ccccc1OCC(=O)Nc2ccc(cc2)S(=O)(=O)N	BroadT	BRD-K60791319	BRD-K60791319-001-06-9	ChemBridge Corporation	7393053			CCc1ccccc1OCC(=O)Nc1ccc(cc1)S(N)(=O)=O	InChI=1S/C16H18N2O4S/c1-2-12-5-3-4-6-15(12)22-11-16(19)18-13-7-9-14(10-8-13)23(17,20)21/h3-10H,2,11H2,1H3,(H,18,19)(H2,17,20,21)	HSAPLXUGGAVLKM-UHFFFAOYSA-N	334.098727766							107679
ST50073078	LSM-19059	SID16952501, BRD-K12868284	1523543	InChI=1S/C19H19N3O2S/c1-13-14(2)25-19-16(13)11-21(10-15-5-7-20-8-6-15)12-22(19)18(23)17-4-3-9-24-17/h3-9H,10-12H2,1-2H3	XVIRJCHXURZDMW-UHFFFAOYSA-N	Cc1sc2N(CN(Cc3ccncc3)Cc2c1C)C(=O)c4occc4	BroadT	BRD-K12868284	BRD-K12868284-001-06-5	Enamine Ltd.	T5227268			Cc1sc2N(CN(Cc3ccncc3)Cc2c1C)C(=O)c1ccco1	InChI=1S/C19H19N3O2S/c1-13-14(2)25-19-16(13)11-21(10-15-5-7-20-8-6-15)12-22(19)18(23)17-4-3-9-24-17/h3-9H,10-12H2,1-2H3	XVIRJCHXURZDMW-UHFFFAOYSA-N	353.119797568							107680
SMR000095597	LSM-19060	SID26670679, SID7965254, BRD-K77230430	5307508	InChI=1S/C20H22N2O6/c1-2-26-20(25)12-5-7-22(8-6-12)17-16(18(23)19(17)24)21-13-3-4-14-15(11-13)28-10-9-27-14/h3-4,11-12,21H,2,5-10H2,1H3	BTOLKHRZPAZCLH-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC1)C2=C(Nc3ccc4OCCOc4c3)C(=O)C2=O	BroadT	BRD-K77230430	BRD-K77230430-001-05-5	ChemDiv Inc.	C667-0266			CCOC(=O)C1CCN(CC1)c1c(Nc2ccc3OCCOc3c2)c(=O)c1=O	InChI=1S/C20H22N2O6/c1-2-26-20(25)12-5-7-22(8-6-12)17-16(18(23)19(17)24)21-13-3-4-14-15(11-13)28-10-9-27-14/h3-4,11-12,21H,2,5-10H2,1H3	BTOLKHRZPAZCLH-UHFFFAOYSA-N	386.147786444							107681
MLS000551404	LSM-19061	SID14741145, BRD-A32090136	3365775	InChI=1S/C26H22N4O3S/c31-24(13-14-25(32)33)30-22(16-21(27-30)23-12-7-15-34-23)20-17-29(19-10-5-2-6-11-19)28-26(20)18-8-3-1-4-9-18/h1-12,15,17,22H,13-14,16H2,(H,32,33)	FAMKTXRFSGOAAK-UHFFFAOYSA-N	OC(=O)CCC(=O)N1N=C(CC1c2cn(nc2c3ccccc3)c4ccccc4)c5cccs5	BroadT	BRD-A32090136	BRD-A32090136-001-06-4	InterBioScreen Ltd.	STOCK1S-95931			OC(=O)CCC(=O)N1N=C(CC1c1cn(nc1-c1ccccc1)-c1ccccc1)c1cccs1	InChI=1S/C26H22N4O3S/c31-24(13-14-25(32)33)30-22(16-21(27-30)23-12-7-15-34-23)20-17-29(19-10-5-2-6-11-19)28-26(20)18-8-3-1-4-9-18/h1-12,15,17,22H,13-14,16H2,(H,32,33)	FAMKTXRFSGOAAK-UHFFFAOYSA-N	470.141261294							107682
SMR000196303	LSM-19062	SID17415248, BRD-K78484850	2914355	InChI=1S/C21H26N4O5S/c26-25(27)20-7-6-19(16-21(20)23-12-14-30-15-13-23)22-8-10-24(11-9-22)31(28,29)17-18-4-2-1-3-5-18/h1-7,16H,8-15,17H2	PJOMEJPWHQZLHB-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1N2CCOCC2)N3CCN(CC3)S(=O)(=O)Cc4ccccc4	BroadT	BRD-K78484850	BRD-K78484850-001-05-8	ChemBridge Corporation	6797625			[O-][N+](=O)c1ccc(cc1N1CCOCC1)N1CCN(CC1)S(=O)(=O)Cc1ccccc1	InChI=1S/C21H26N4O5S/c26-25(27)20-7-6-19(16-21(20)23-12-14-30-15-13-23)22-8-10-24(11-9-22)31(28,29)17-18-4-2-1-3-5-18/h1-7,16H,8-15,17H2	PJOMEJPWHQZLHB-UHFFFAOYSA-N	446.162390662							107683
AC1LB3QK	LSM-15197	BRD-K06769748	575800	InChI=1S/C17H16N2O2/c1-21-14-8-6-12(7-9-14)16(20)11-19-10-13-4-2-3-5-15(13)17(19)18/h2-9,18H,10-11H2,1H3	YTADBJFSUZDANR-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)CN2Cc3ccccc3C2=N	BroadT	BRD-K06769748	BRD-K06769748-004-06-7	InterBioScreen Ltd.	STOCK2S-06991		Br	COc1ccc(cc1)C(=O)CN1Cc2ccccc2C1=N.Br	InChI=1S/C17H16N2O2.BrH/c1-21-14-8-6-12(7-9-14)16(20)11-19-10-13-4-2-3-5-15(13)17(19)18;/h2-9,18H,10-11H2,1H3;1H	DCUGFMQQNRTZQG-UHFFFAOYSA-N	280.121177772							103847, 103847
MCULE-5380498854	LSM-19063	SID26664032, BRD-K39387646	6741150	InChI=1S/C16H18N4O2S/c1-8-7-16(2,3)20-13-10(8)5-9(22-4)6-11(13)12(14(20)21)18-19-15(17)23/h5-7,21H,1-4H3,(H2,17,23)	NMPRKKRYIYTRDX-UHFFFAOYSA-N	COc1cc2C(=CC(C)(C)n3c(O)c(N=NC(=N)S)c(c1)c23)C	BroadT	BRD-K39387646	BRD-K39387646-001-05-0	InterBioScreen Ltd.	STOCK3S-65516			COc1cc2C(C)=CC(C)(C)n3c(O)c(N=NC(S)=N)c(c1)c23	InChI=1S/C16H18N4O2S/c1-8-7-16(2,3)20-13-10(8)5-9(22-4)6-11(13)12(14(20)21)18-19-15(17)23/h5-7,21H,1-4H3,(H2,17,23)	NMPRKKRYIYTRDX-UHFFFAOYSA-N	330.115046546							
SMR000155157	LSM-19064	SID17388471, BRD-A15911542	5132241	InChI=1S/C22H26N4O3S2/c1-14-11-19(15(2)26(14)12-18-5-4-10-29-18)20(27)13-30-22-25-24-21(31-22)23-16-6-8-17(28-3)9-7-16/h6-9,11,18H,4-5,10,12-13H2,1-3H3,(H,23,24)	XGRVTGGGERDOOZ-UHFFFAOYSA-N	COc1ccc(Nc2nnc(SCC(=O)c3cc(C)n(CC4CCCO4)c3C)s2)cc1	BroadT	BRD-A15911542	BRD-A15911542-001-04-5	Enamine Ltd.	T0520-8935			COc1ccc(Nc2nnc(SCC(=O)c3cc(C)n(CC4CCCO4)c3C)s2)cc1	InChI=1S/C22H26N4O3S2/c1-14-11-19(15(2)26(14)12-18-5-4-10-29-18)20(27)13-30-22-25-24-21(31-22)23-16-6-8-17(28-3)9-7-16/h6-9,11,18H,4-5,10,12-13H2,1-3H3,(H,23,24)	XGRVTGGGERDOOZ-UHFFFAOYSA-N	458.144632112							107685
MLS000519150	LSM-19065	BRD-A24067393	4136788	InChI=1S/C19H22N2OS2/c1-11-10-12(2)21-17-15(11)16(20)18(23-17)24(22)14-8-6-13(7-9-14)19(3,4)5/h6-10H,20H2,1-5H3	JMTHDMQJJDFLCY-UHFFFAOYSA-N	Cc1cc(C)c2c(N)c(sc2n1)S(=O)c3ccc(cc3)C(C)(C)C	BroadT	BRD-A24067393	BRD-A24067393-001-06-0	ChemDiv Inc.	4378-0014			Cc1cc(C)c2c(N)c(sc2n1)S(=O)c1ccc(cc1)C(C)(C)C	InChI=1S/C19H22N2OS2/c1-11-10-12(2)21-17-15(11)16(20)18(23-17)24(22)14-8-6-13(7-9-14)19(3,4)5/h6-10H,20H2,1-5H3	JMTHDMQJJDFLCY-UHFFFAOYSA-N	358.117354724							107686
T0512-7206	LSM-19066	SID24779925, BRD-K50451780	3352398	InChI=1S/C23H16Cl2N4O3/c24-16-11-19(25)22(26-12-16)27-20(30)14-32-23(31)18-13-29(17-9-5-2-6-10-17)28-21(18)15-7-3-1-4-8-15/h1-13H,14H2,(H,26,27,30)	PUMPJEZXXDPVJK-UHFFFAOYSA-N	Clc1cnc(NC(=O)COC(=O)c2cn(nc2c3ccccc3)c4ccccc4)c(Cl)c1	BroadT	BRD-K50451780	BRD-K50451780-001-05-4	Enamine Ltd.	T0512-7206			Clc1cnc(NC(=O)COC(=O)c2cn(nc2-c2ccccc2)-c2ccccc2)c(Cl)c1	InChI=1S/C23H16Cl2N4O3/c24-16-11-19(25)22(26-12-16)27-20(30)14-32-23(31)18-13-29(17-9-5-2-6-10-17)28-21(18)15-7-3-1-4-8-15/h1-13H,14H2,(H,26,27,30)	PUMPJEZXXDPVJK-UHFFFAOYSA-N	466.059945832							107687
T5769861	LSM-19067	SID49680606, BRD-K67591367	9265057	InChI=1S/C18H17N3O2/c1-23-14-8-6-13(7-9-14)10-11-19-18(22)17-12-20-15-4-2-3-5-16(15)21-17/h2-9,12H,10-11H2,1H3,(H,19,22)	VBVLKKDCNGYPFY-UHFFFAOYSA-N	COc1ccc(CCNC(=O)c2cnc3ccccc3n2)cc1	BroadT	BRD-K67591367	BRD-K67591367-001-05-9	Enamine Ltd.	T5576560			COc1ccc(CCNC(=O)c2cnc3ccccc3n2)cc1	InChI=1S/C18H17N3O2/c1-23-14-8-6-13(7-9-14)10-11-19-18(22)17-12-20-15-4-2-3-5-16(15)21-17/h2-9,12H,10-11H2,1H3,(H,19,22)	VBVLKKDCNGYPFY-UHFFFAOYSA-N	307.132076814							107688
MLS000081723	LSM-19068	SID3716807, BRD-A25615049	2999765	InChI=1S/C22H19NO6/c1-26-18-8-7-13(11-20(18)27-2)17-12-15(14-5-3-4-6-16(14)23-17)21(24)29-19-9-10-28-22(19)25/h3-8,11-12,19H,9-10H2,1-2H3	OKPMCWIIYRPBPE-UHFFFAOYSA-N	COc1ccc(cc1OC)c2cc(C(=O)OC3CCOC3=O)c4ccccc4n2	BroadT	BRD-A25615049	BRD-A25615049-001-05-5	Enamine Ltd.	T0516-8307			COc1ccc(cc1OC)-c1cc(C(=O)OC2CCOC2=O)c2ccccc2n1	InChI=1S/C22H19NO6/c1-26-18-8-7-13(11-20(18)27-2)17-12-15(14-5-3-4-6-16(14)23-17)21(24)29-19-9-10-28-22(19)25/h3-8,11-12,19H,9-10H2,1-2H3	OKPMCWIIYRPBPE-UHFFFAOYSA-N	393.121237338							107689
9P-571S	LSM-19069	SID14730001, BRD-K28295277	1489069	InChI=1S/C15H11F4N3O2S/c1-22-13-10(12(21-22)15(17,18)19)6-11(25-13)20-14(23)24-7-8-2-4-9(16)5-3-8/h2-6H,7H2,1H3,(H,20,23)	GZHBVHDXEFDKJL-UHFFFAOYSA-N	Cn1nc(c2cc(NC(=O)OCc3ccc(F)cc3)sc12)C(F)(F)F	BroadT	BRD-K28295277	BRD-K28295277-001-06-2	Key Organics Ltd.	9P-571S			Cn1nc(c2cc(NC(=O)OCc3ccc(F)cc3)sc12)C(F)(F)F	InChI=1S/C15H11F4N3O2S/c1-22-13-10(12(21-22)15(17,18)19)6-11(25-13)20-14(23)24-7-8-2-4-9(16)5-3-8/h2-6H,7H2,1H3,(H,20,23)	GZHBVHDXEFDKJL-UHFFFAOYSA-N	373.050810112							107690
SMR000021763	LSM-19070	SID4250502, BRD-K68852533	3244302	InChI=1S/C16H18N2O4/c1-3-22-15(20)9-17-14(19)10-18-11(2)8-12-6-4-5-7-13(12)16(18)21/h4-8H,3,9-10H2,1-2H3,(H,17,19)	NXBPOPIEDGTTNV-UHFFFAOYSA-N	CCOC(=O)CNC(=O)CN1C(=Cc2ccccc2C1=O)C	BroadT	BRD-K68852533	BRD-K68852533-001-05-3	ChemDiv Inc.	C067-0084			CCOC(=O)CNC(=O)Cn1c(C)cc2ccccc2c1=O	InChI=1S/C16H18N2O4/c1-3-22-15(20)9-17-14(19)10-18-11(2)8-12-6-4-5-7-13(12)16(18)21/h4-8H,3,9-10H2,1-2H3,(H,17,19)	NXBPOPIEDGTTNV-UHFFFAOYSA-N	302.126657076							107691
ST50171465	LSM-19071	SID7973912, BRD-K62911960	775826	InChI=1S/C15H17NO4S/c1-19-14-4-2-13-11-15(5-3-12(13)10-14)21(17,18)16-6-8-20-9-7-16/h2-5,10-11H,6-9H2,1H3	JHJANECTTGXRKJ-UHFFFAOYSA-N	COc1ccc2cc(ccc2c1)S(=O)(=O)N3CCOCC3	BroadT	BRD-K62911960	BRD-K62911960-001-05-5	ChemBridge Corporation	6417800			COc1ccc2cc(ccc2c1)S(=O)(=O)N1CCOCC1	InChI=1S/C15H17NO4S/c1-19-14-4-2-13-11-15(5-3-12(13)10-14)21(17,18)16-6-8-20-9-7-16/h2-5,10-11H,6-9H2,1H3	JHJANECTTGXRKJ-UHFFFAOYSA-N	307.087828724							107692
SMR000027663	LSM-19072	SID4248241, BRD-K07612530	1266904	InChI=1S/C22H21N7/c1-3-7-18(8-4-1)20-24-21(26-22(25-20)29-12-11-23-17-29)28-15-13-27(14-16-28)19-9-5-2-6-10-19/h1-12,17H,13-16H2	KOGKLWVBRDGPOX-UHFFFAOYSA-N	C1CN(CCN1c2ccccc2)c3nc(nc(n3)n4ccnc4)c5ccccc5	BroadT	BRD-K07612530	BRD-K07612530-001-06-6	ChemDiv Inc.	8014-9576			C1CN(CCN1c1ccccc1)c1nc(nc(n1)-n1ccnc1)-c1ccccc1	InChI=1S/C22H21N7/c1-3-7-18(8-4-1)20-24-21(26-22(25-20)29-12-11-23-17-29)28-15-13-27(14-16-28)19-9-5-2-6-10-19/h1-12,17H,13-16H2	KOGKLWVBRDGPOX-UHFFFAOYSA-N	383.185843742							107693
AC1MJUXX	LSM-19073	BRD-K59470226	3098495	InChI=1S/C22H18N2O4/c1-15-5-4-6-17(13-15)22(27)28-18-11-9-16(10-12-18)14-23-24-21(26)19-7-2-3-8-20(19)25/h2-14,25H,1H3,(H,24,26)	NALOZXITYHHTEU-UHFFFAOYSA-N	Cc1cccc(c1)C(=O)Oc2ccc(C=NNC(=O)c3ccccc3O)cc2	BroadT	BRD-K59470226	BRD-K59470226-001-05-7	Asinex Ltd.	BAS 00298471			Cc1cccc(c1)C(=O)Oc1ccc(C=NNC(=O)c2ccccc2O)cc1	InChI=1S/C22H18N2O4/c1-15-5-4-6-17(13-15)22(27)28-18-11-9-16(10-12-18)14-23-24-21(26)19-7-2-3-8-20(19)25/h2-14,25H,1H3,(H,24,26)	NALOZXITYHHTEU-UHFFFAOYSA-N	374.126657076							107694
SMR000027741	LSM-19074	SID4244213, BRD-K09318739	3238837	InChI=1S/C18H22N2O3S2/c1-13-16(11-25-12-17(21)20-7-9-22-10-8-20)19-18(23-13)14-3-5-15(24-2)6-4-14/h3-6H,7-12H2,1-2H3	CYJJTSNMEGELMP-UHFFFAOYSA-N	CSc1ccc(cc1)c2oc(C)c(CSCC(=O)N3CCOCC3)n2	BroadT	BRD-K09318739	BRD-K09318739-001-06-7	ChemDiv Inc.	C523-1212			CSc1ccc(cc1)-c1nc(CSCC(=O)N2CCOCC2)c(C)o1	InChI=1S/C18H22N2O3S2/c1-13-16(11-25-12-17(21)20-7-9-22-10-8-20)19-18(23-13)14-3-5-15(24-2)6-4-14/h3-6H,7-12H2,1-2H3	CYJJTSNMEGELMP-UHFFFAOYSA-N	378.107183964							107695
5-Benzo[1,3]dioxol-5-yl-4-phenyl-4H-[1,2,4]triazole-3-thiol	LSM-19075	SID22408997, BRD-K65277915	2423962	InChI=1S/C15H11N3O2S/c21-15-17-16-14(18(15)11-4-2-1-3-5-11)10-6-7-12-13(8-10)20-9-19-12/h1-8H,9H2,(H,17,21)	JNBWDMDSUVQYLP-UHFFFAOYSA-N	Sc1nnc(c2ccc3OCOc3c2)n1c4ccccc4	BroadT	BRD-K65277915	BRD-K65277915-001-05-4	Enamine Ltd.	T0515-8610			Sc1nnc(-c2ccc3OCOc3c2)n1-c1ccccc1	InChI=1S/C15H11N3O2S/c21-15-17-16-14(18(15)11-4-2-1-3-5-11)10-6-7-12-13(8-10)20-9-19-12/h1-8H,9H2,(H,17,21)	JNBWDMDSUVQYLP-UHFFFAOYSA-N	297.057197312							107696
1-{1-[4-(Morpholine-4-sulfonyl)-phenyl]-piperidin-4-ylmethyl}-3-m-tolyl-urea	LSM-19076	SID49728932, BRD-K56987179	3232216	InChI=1S/C24H32N4O4S/c1-19-3-2-4-21(17-19)26-24(29)25-18-20-9-11-27(12-10-20)22-5-7-23(8-6-22)33(30,31)28-13-15-32-16-14-28/h2-8,17,20H,9-16,18H2,1H3,(H2,25,26,29)	KNQLWZGSYWSESX-UHFFFAOYSA-N	Cc1cccc(NC(=O)NCC2CCN(CC2)c3ccc(cc3)S(=O)(=O)N4CCOCC4)c1	BroadT	BRD-K56987179	BRD-K56987179-001-05-0	Asinex Ltd.	ASN 10397938			Cc1cccc(NC(=O)NCC2CCN(CC2)c2ccc(cc2)S(=O)(=O)N2CCOCC2)c1	InChI=1S/C24H32N4O4S/c1-19-3-2-4-21(17-19)26-24(29)25-18-20-9-11-27(12-10-20)22-5-7-23(8-6-22)33(30,31)28-13-15-32-16-14-28/h2-8,17,20H,9-16,18H2,1H3,(H2,25,26,29)	KNQLWZGSYWSESX-UHFFFAOYSA-N	472.214426234							107697
SMR000064396	LSM-19077	SID3715626, BRD-K03301795	2481623	InChI=1S/C22H21BrN4O2/c23-19-8-3-1-6-17(19)16-29-20-9-4-2-7-18(20)21(28)26-12-14-27(15-13-26)22-24-10-5-11-25-22/h1-11H,12-16H2	OBSNIISSPCGHGL-UHFFFAOYSA-N	Brc1ccccc1COc2ccccc2C(=O)N3CCN(CC3)c4ncccn4	BroadT	BRD-K03301795	BRD-K03301795-001-05-2	Enamine Ltd.	T5329490			Brc1ccccc1COc1ccccc1C(=O)N1CCN(CC1)c1ncccn1	InChI=1S/C22H21BrN4O2/c23-19-8-3-1-6-17(19)16-29-20-9-4-2-7-18(20)21(28)26-12-14-27(15-13-26)22-24-10-5-11-25-22/h1-11H,12-16H2	OBSNIISSPCGHGL-UHFFFAOYSA-N	452.084788552							107698
MLS000111630	LSM-19078	SID7976775, BRD-K99347713	1095103	InChI=1S/C16H18N2O5S/c1-11(19)17-12-4-7-14(8-5-12)24(20,21)18-13-6-9-15(22-2)16(10-13)23-3/h4-10,18H,1-3H3,(H,17,19)	TYZQXUXJOMQTEB-UHFFFAOYSA-N	COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C)cc2)cc1OC	BroadT	BRD-K99347713	BRD-K99347713-001-05-9	ChemBridge Corporation	6224370			COc1ccc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1OC	InChI=1S/C16H18N2O5S/c1-11(19)17-12-4-7-14(8-5-12)24(20,21)18-13-6-9-15(22-2)16(10-13)23-3/h4-10,18H,1-3H3,(H,17,19)	TYZQXUXJOMQTEB-UHFFFAOYSA-N	350.093642386							107699
SMR000014785	LSM-19079	SID842698, BRD-K47677644	644969	InChI=1S/C22H25N5O/c23-15-18-16-5-3-6-17(16)21(24-9-4-10-26-11-13-28-14-12-26)27-20-8-2-1-7-19(20)25-22(18)27/h1-2,7-8,24H,3-6,9-14H2	OIXXVTLALOIFRP-UHFFFAOYSA-N	N#Cc1c2CCCc2c(NCCCN3CCOCC3)n4c5ccccc5nc14	BroadT	BRD-K47677644	BRD-K47677644-001-05-6	Asinex Ltd.	BAS 08138833			N#Cc1c2CCCc2c(NCCCN2CCOCC2)n2c1nc1ccccc21	InChI=1S/C22H25N5O/c23-15-18-16-5-3-6-17(16)21(24-9-4-10-26-11-13-28-14-12-26)27-20-8-2-1-7-19(20)25-22(18)27/h1-2,7-8,24H,3-6,9-14H2	OIXXVTLALOIFRP-UHFFFAOYSA-N	375.20591047							107700
CID_9550006	LSM-19080	BRD-A71928464	91899714	InChI=1S/C27H27N3O4/c1-3-4-14-34-21-7-8-22(18(2)15-21)25(31)23-24(20-9-12-28-13-10-20)30(27(33)26(23)32)17-19-6-5-11-29-16-19/h5-13,15-16,23-24H,3-4,14,17H2,1-2H3	QRHNZWXQDCLALU-UHFFFAOYSA-N	CCCCOc1ccc(C(=O)C2C(N(Cc3cccnc3)C(=O)C2=O)c4ccncc4)c(C)c1	BroadT	BRD-A71928464	BRD-A71928464-001-05-1	InterBioScreen Ltd.	STOCK2S-68267			CCCCOc1ccc(C(=O)C2C(N(Cc3cccnc3)C(=O)C2=O)c2ccncc2)c(C)c1	InChI=1S/C27H27N3O4/c1-3-4-14-34-21-7-8-22(18(2)15-21)25(31)23-24(20-9-12-28-13-10-20)30(27(33)26(23)32)17-19-6-5-11-29-16-19/h5-13,15-16,23-24H,3-4,14,17H2,1-2H3	QRHNZWXQDCLALU-UHFFFAOYSA-N	457.200156374							107701
MLS000063376	LSM-19081	SID4260902, BRD-K56008980	714409	InChI=1S/C10H10N2O3S/c1-3-12-4-11-8-6(9(12)13)5(2)7(16-8)10(14)15/h4H,3H2,1-2H3,(H,14,15)	SXQISXMEDDDZKV-UHFFFAOYSA-N	CCN1C=Nc2sc(C(=O)O)c(C)c2C1=O	BroadT	BRD-K56008980	BRD-K56008980-001-05-4	ChemBridge Corporation	7704707			CCn1cnc2sc(C(O)=O)c(C)c2c1=O	InChI=1S/C10H10N2O3S/c1-3-12-4-11-8-6(9(12)13)5(2)7(16-8)10(14)15/h4H,3H2,1-2H3,(H,14,15)	SXQISXMEDDDZKV-UHFFFAOYSA-N	238.04121289							107702
SMR000200616	LSM-19082	SID17432200, BRD-K81789730	3783540	InChI=1S/C13H16N4O4S/c1-8(2)7-11(18)14-13(22)16-15-12(19)9-3-5-10(6-4-9)17(20)21/h3-6,8H,7H2,1-2H3,(H,15,19)(H2,14,16,18,22)	GNXQJDDYSMMYSN-UHFFFAOYSA-N	CC(C)CC(=O)NC(=S)NNC(=O)c1ccc(cc1)[N+](=O)[O-]	BroadT	BRD-K81789730	BRD-K81789730-001-05-1	ChemBridge Corporation	7915265			CC(C)CC(=O)NC(=S)NNC(=O)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C13H16N4O4S/c1-8(2)7-11(18)14-13(22)16-15-12(19)9-3-5-10(6-4-9)17(20)21/h3-6,8H,7H2,1-2H3,(H,15,19)(H2,14,16,18,22)	GNXQJDDYSMMYSN-UHFFFAOYSA-N	324.089225722							107703
SMR000071844	LSM-19083	SID4265168, BRD-K73553469	1231838	InChI=1S/C18H22N2O4S2/c21-25(22,17-7-3-1-4-8-17)19-15-16-11-13-20(14-12-16)26(23,24)18-9-5-2-6-10-18/h1-10,16,19H,11-15H2	UTXPEQKGBCDERP-UHFFFAOYSA-N	O=S(=O)(NCC1CCN(CC1)S(=O)(=O)c2ccccc2)c3ccccc3	BroadT	BRD-K73553469	BRD-K73553469-001-05-8	ChemBridge Corporation	7250197			O=S(=O)(NCC1CCN(CC1)S(=O)(=O)c1ccccc1)c1ccccc1	InChI=1S/C18H22N2O4S2/c21-25(22,17-7-3-1-4-8-17)19-15-16-11-13-20(14-12-16)26(23,24)18-9-5-2-6-10-18/h1-10,16,19H,11-15H2	UTXPEQKGBCDERP-UHFFFAOYSA-N	394.102098584							107704
2-(2,4-Dichlorophenoxy)-n-[4-(morpholin-4-ylmethyl)phenyl]acetamide	LSM-19084	SID49829221, BRD-K91150572	979211	InChI=1S/C19H20Cl2N2O3/c20-15-3-6-18(17(21)11-15)26-13-19(24)22-16-4-1-14(2-5-16)12-23-7-9-25-10-8-23/h1-6,11H,7-10,12-13H2,(H,22,24)	JVKMDAQMPNCPNK-UHFFFAOYSA-N	Clc1ccc(OCC(=O)Nc2ccc(CN3CCOCC3)cc2)c(Cl)c1	BroadT	BRD-K91150572	BRD-K91150572-001-05-5	InterBioScreen Ltd.	STOCK3S-63740			Clc1ccc(OCC(=O)Nc2ccc(CN3CCOCC3)cc2)c(Cl)c1	InChI=1S/C19H20Cl2N2O3/c20-15-3-6-18(17(21)11-15)26-13-19(24)22-16-4-1-14(2-5-16)12-23-7-9-25-10-8-23/h1-6,11H,7-10,12-13H2,(H,22,24)	JVKMDAQMPNCPNK-UHFFFAOYSA-N	394.08509794							107705
BAS 06347363	LSM-19085	SID842908, BRD-K83842983	645180	InChI=1S/C12H9N3O2/c16-12(11-2-1-5-17-11)15-8-3-4-9-10(6-8)14-7-13-9/h1-7H,(H,13,14)(H,15,16)	TVBFOFWDKKVDRV-UHFFFAOYSA-N	O=C(Nc1ccc2[nH]cnc2c1)c3occc3	BroadT	BRD-K83842983	BRD-K83842983-001-05-0	Asinex Ltd.	BAS 06347363			O=C(Nc1ccc2[nH]cnc2c1)c1ccco1	InChI=1S/C12H9N3O2/c16-12(11-2-1-5-17-11)15-8-3-4-9-10(6-8)14-7-13-9/h1-7H,(H,13,14)(H,15,16)	TVBFOFWDKKVDRV-UHFFFAOYSA-N	227.069476558							107706
AC1MF2VW	LSM-19086	BRD-A64595514	2865095	InChI=1S/C15H13NO5/c1-15(2)14(18)9(7-16-19)12-10(21-15)5-3-8-4-6-11(17)20-13(8)12/h3-7,9,19H,1-2H3	KLYUTOYMOGYVCW-UHFFFAOYSA-N	CC1(C)Oc2ccc3C=CC(=O)Oc3c2C(C=NO)C1=O	BroadT	BRD-A64595514	BRD-A64595514-001-05-7	Specs	AG-690/15426056			CC1(C)Oc2ccc3ccc(=O)oc3c2C(C=NO)C1=O	InChI=1S/C15H13NO5/c1-15(2)14(18)9(7-16-19)12-10(21-15)5-3-8-4-6-11(17)20-13(8)12/h3-7,9,19H,1-2H3	KLYUTOYMOGYVCW-UHFFFAOYSA-N	287.079372526							107707
SMR000095185	LSM-19087	SID7966822, BRD-K11015166	5308462	InChI=1S/C18H17ClN2O7S/c1-3-27-17(22)10-21-14-6-5-12(9-16(14)28-18(21)23)29(24,25)20-13-8-11(19)4-7-15(13)26-2/h4-9,20H,3,10H2,1-2H3	SSIQGXKDSAJLCZ-UHFFFAOYSA-N	CCOC(=O)CN1C(=O)Oc2cc(ccc12)S(=O)(=O)Nc3cc(Cl)ccc3OC	BroadT	BRD-K11015166	BRD-K11015166-001-04-2	ChemDiv Inc.	C602-0191			CCOC(=O)Cn1c2ccc(cc2oc1=O)S(=O)(=O)Nc1cc(Cl)ccc1OC	InChI=1S/C18H17ClN2O7S/c1-3-27-17(22)10-21-14-6-5-12(9-16(14)28-18(21)23)29(24,25)20-13-8-11(19)4-7-15(13)26-2/h4-9,20H,3,10H2,1-2H3	SSIQGXKDSAJLCZ-UHFFFAOYSA-N	440.044499304							107708
MLS001034563	LSM-43040	BRD-K75074041, SID49826258, SID87544505	1346721	InChI=1S/C22H20N2O4S2/c1-14-7-9-15(10-8-14)12-18-20(26)24(22(29)30-18)11-3-6-19(25)23-17-5-2-4-16(13-17)21(27)28/h2,4-5,7-10,12-13H,3,6,11H2,1H3,(H,23,25)(H,27,28)/b18-12-	VYBKTUCFFKTPCF-PDGQHHTCSA-N	Cc1ccc(\C=C\2/SC(=S)N(CCCC(=O)Nc3cccc(c3)C(=O)O)C2=O)cc1	BroadT	BRD-K75074041	BRD-K75074041-001-05-0	ChemBridge Corporation	6620759			Cc1ccc(cc1)\C=C1/SC(=S)N(CCCC(=O)Nc2cccc(c2)C(O)=O)C1=O	InChI=1S/C22H20N2O4S2/c1-14-7-9-15(10-8-14)12-18-20(26)24(22(29)30-18)11-3-6-19(25)23-17-5-2-4-16(13-17)21(27)28/h2,4-5,7-10,12-13H,3,6,11H2,1H3,(H,23,25)(H,27,28)/b18-12-	VYBKTUCFFKTPCF-PDGQHHTCSA-N	440.08644852							
AC1NF0LM	LSM-19088	BRD-K49948443	4676022	InChI=1S/C17H15Cl2N3O4/c18-13-6-7-16(15(19)10-13)26-8-2-5-17(23)21-20-11-12-3-1-4-14(9-12)22(24)25/h1,3-4,6-7,9-11H,2,5,8H2,(H,21,23)	BQGSDVXXDGEJJH-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(C=NNC(=O)CCCOc2ccc(Cl)cc2Cl)c1	BroadT	BRD-K49948443	BRD-K49948443-001-05-2	ChemDiv Inc.	1643-0220			[O-][N+](=O)c1cccc(C=NNC(=O)CCCOc2ccc(Cl)cc2Cl)c1	InChI=1S/C17H15Cl2N3O4/c18-13-6-7-16(15(19)10-13)26-8-2-5-17(23)21-20-11-12-3-1-4-14(9-12)22(24)25/h1,3-4,6-7,9-11H,2,5,8H2,(H,21,23)	BQGSDVXXDGEJJH-UHFFFAOYSA-N	395.04396141							107709
T5256129	LSM-19089	SID24829015, BRD-A39863906	3968564	InChI=1S/C25H27N5O3S/c1-5-16(2)26-21(31)15-34-25-27-20-14-10-9-13-19(20)23(32)29(25)22-17(3)28(4)30(24(22)33)18-11-7-6-8-12-18/h6-14,16H,5,15H2,1-4H3,(H,26,31)	FCOHQHTYBGXQSU-UHFFFAOYSA-N	CCC(C)NC(=O)CSC1=Nc2ccccc2C(=O)N1C3=C(C)N(C)N(C3=O)c4ccccc4	BroadT	BRD-A39863906	BRD-A39863906-001-05-7	Enamine Ltd.	T5256129			CCC(C)NC(=O)CSc1nc2ccccc2c(=O)n1-c1c(C)n(C)n(-c2ccccc2)c1=O	InChI=1S/C25H27N5O3S/c1-5-16(2)26-21(31)15-34-25-27-20-14-10-9-13-19(20)23(32)29(25)22-17(3)28(4)30(24(22)33)18-11-7-6-8-12-18/h6-14,16H,5,15H2,1-4H3,(H,26,31)	FCOHQHTYBGXQSU-UHFFFAOYSA-N	477.183460464							107710
STK225467	LSM-19090	SID24798039, BRD-K02947165	1319018	InChI=1S/C17H24BrNO2/c1-13(2)14-7-8-16(15(18)11-14)21-12-17(20)19-9-5-3-4-6-10-19/h7-8,11,13H,3-6,9-10,12H2,1-2H3	ZYRIZJVEUJMDFA-UHFFFAOYSA-N	CC(C)c1ccc(OCC(=O)N2CCCCCC2)c(Br)c1	BroadT	BRD-K02947165	BRD-K02947165-001-05-5	ChemBridge Corporation	7614999			CC(C)c1ccc(OCC(=O)N2CCCCCC2)c(Br)c1	InChI=1S/C17H24BrNO2/c1-13(2)14-7-8-16(15(18)11-14)21-12-17(20)19-9-5-3-4-6-10-19/h7-8,11,13H,3-6,9-10,12H2,1-2H3	ZYRIZJVEUJMDFA-UHFFFAOYSA-N	353.099041618							107711
SMR000024671	LSM-19091	SID4249709, BRD-A13920442	3243624	InChI=1S/C19H21NO5/c1-22-17-9-5-6-13(19(17)23-2)10-18(21)20-11-14-12-24-15-7-3-4-8-16(15)25-14/h3-9,14H,10-12H2,1-2H3,(H,20,21)	CBMVZZGLJFGZAA-UHFFFAOYSA-N	COc1cccc(CC(=O)NCC2COc3ccccc3O2)c1OC	BroadT	BRD-A13920442	BRD-A13920442-001-11-4	ChemDiv Inc.	4434-0094			COc1cccc(CC(=O)NCC2COc3ccccc3O2)c1OC	InChI=1S/C19H21NO5/c1-22-17-9-5-6-13(19(17)23-2)10-18(21)20-11-14-12-24-15-7-3-4-8-16(15)25-14/h3-9,14H,10-12H2,1-2H3,(H,20,21)	CBMVZZGLJFGZAA-UHFFFAOYSA-N	343.141972782							107712
3-(2-Phenyltetrazol-5-yl)pyridine	LSM-19092	SID24707915, SID26514123, BRD-K02609504	1215208	InChI=1S/C12H9N5/c1-2-6-11(7-3-1)17-15-12(14-16-17)10-5-4-8-13-9-10/h1-9H	NGSVAPVLMCRHLB-UHFFFAOYSA-N	c1ccc(cc1)n2nnc(n2)c3cccnc3	BroadT	BRD-K02609504	BRD-K02609504-001-05-1	Sanford-Burnham Medical Research Institute	3-(2-phenyl-2H-tetrazol-5-yl)pyridine TZAN03			c1ccc(cc1)-n1nnc(n1)-c1cccnc1	InChI=1S/C12H9N5/c1-2-6-11(7-3-1)17-15-12(14-16-17)10-5-4-8-13-9-10/h1-9H	NGSVAPVLMCRHLB-UHFFFAOYSA-N	223.085795338							107713
SMR000094635	LSM-19093	BRD-A62693435	5309030	InChI=1S/C25H28N2O5S/c1-16-21(27-25(32-16)18-11-12-22(30-2)23(13-18)31-3)14-33(29)15-24(28)26-20-10-6-8-17-7-4-5-9-19(17)20/h4-5,7,9,11-13,20H,6,8,10,14-15H2,1-3H3,(H,26,28)	BUYHNGPKNHGENZ-UHFFFAOYSA-N	COc1ccc(cc1OC)c2oc(C)c(CS(=O)CC(=O)NC3CCCc4ccccc34)n2	BroadT	BRD-A62693435	BRD-A62693435-001-05-8	ChemDiv Inc.	C527-1660			COc1ccc(cc1OC)-c1nc(CS(=O)CC(=O)NC2CCCc3ccccc23)c(C)o1	InChI=1S/C25H28N2O5S/c1-16-21(27-25(32-16)18-11-12-22(30-2)23(13-18)31-3)14-33(29)15-24(28)26-20-10-6-8-17-7-4-5-9-19(17)20/h4-5,7,9,11-13,20H,6,8,10,14-15H2,1-3H3,(H,26,28)	BUYHNGPKNHGENZ-UHFFFAOYSA-N	468.171892706							107714
MLS000057432	LSM-19094	SID3714574, BRD-K35044141	2998856	InChI=1S/C15H18N2OS2/c18-14(9-3-5-11-6-4-10-19-11)17-15-16-12-7-1-2-8-13(12)20-15/h4,6,10H,1-3,5,7-9H2,(H,16,17,18)	XGJKXIQPTYXYCS-UHFFFAOYSA-N	O=C(CCCc1cccs1)Nc2nc3CCCCc3s2	BroadT	BRD-K35044141	BRD-K35044141-001-05-1	Enamine Ltd.	T5341461			O=C(CCCc1cccs1)Nc1nc2CCCCc2s1	InChI=1S/C15H18N2OS2/c18-14(9-3-5-11-6-4-10-19-11)17-15-16-12-7-1-2-8-13(12)20-15/h4,6,10H,1-3,5,7-9H2,(H,16,17,18)	XGJKXIQPTYXYCS-UHFFFAOYSA-N	306.086054596							107715
MLS000086278	LSM-19095	SID4243528, BRD-K64592938	3238238	InChI=1S/C20H18N2O5/c1-22-15-5-3-2-4-13(15)14(19(22)20(24)25)11-18(23)21-12-6-7-16-17(10-12)27-9-8-26-16/h2-7,10H,8-9,11H2,1H3,(H,21,23)(H,24,25)	RZIXCUMFPILECJ-UHFFFAOYSA-N	Cn1c(C(=O)O)c(CC(=O)Nc2ccc3OCCOc3c2)c4ccccc14	BroadT	BRD-K64592938	BRD-K64592938-001-06-8	ChemDiv Inc.	C075-0038			Cn1c(C(O)=O)c(CC(=O)Nc2ccc3OCCOc3c2)c2ccccc12	InChI=1S/C20H18N2O5/c1-22-15-5-3-2-4-13(15)14(19(22)20(24)25)11-18(23)21-12-6-7-16-17(10-12)27-9-8-26-16/h2-7,10H,8-9,11H2,1H3,(H,21,23)(H,24,25)	RZIXCUMFPILECJ-UHFFFAOYSA-N	366.121571696							107716
5-(4-Chlorophenyl)-1-phenyl-1H-imidazole-2-thiol	LSM-19096	SID22409487, BRD-K86942182	4846975	InChI=1S/C15H11ClN2S/c16-12-8-6-11(7-9-12)14-10-17-15(19)18(14)13-4-2-1-3-5-13/h1-10H,(H,17,19)	ZUHUPNVZKHINMK-UHFFFAOYSA-N	Sc1ncc(c2ccc(Cl)cc2)n1c3ccccc3	BroadT	BRD-K86942182	BRD-K86942182-001-05-4	Enamine Ltd.	T5342249			Sc1ncc(-c2ccc(Cl)cc2)n1-c1ccccc1	InChI=1S/C15H11ClN2S/c16-12-8-6-11(7-9-12)14-10-17-15(19)18(14)13-4-2-1-3-5-13/h1-10H,(H,17,19)	ZUHUPNVZKHINMK-UHFFFAOYSA-N	286.033146772							107717
SMR000045517	LSM-19097	SID863316, BRD-K56657621	664562	InChI=1S/C19H18N4O2/c20-13-16-19(25-18(21-16)17-7-4-12-24-17)23-10-8-22(9-11-23)14-15-5-2-1-3-6-15/h1-7,12H,8-11,14H2	HAMNLVCHMBVYCU-UHFFFAOYSA-N	N#Cc1nc(oc1N2CCN(Cc3ccccc3)CC2)c4occc4	BroadT	BRD-K56657621	BRD-K56657621-001-06-1	InterBioScreen Ltd.	STOCK4S-70676			N#Cc1nc(oc1N1CCN(Cc2ccccc2)CC1)-c1ccco1	InChI=1S/C19H18N4O2/c20-13-16-19(25-18(21-16)17-7-4-12-24-17)23-10-8-22(9-11-23)14-15-5-2-1-3-6-15/h1-7,12H,8-11,14H2	HAMNLVCHMBVYCU-UHFFFAOYSA-N	334.142975856							107718
SMR000029114	LSM-19098	SID4249626, BRD-K28738219	3243554	InChI=1S/C17H15ClN2O4S/c1-23-14-4-3-11(18)8-12(14)19-15(21)9-20-13(17(22)24-2)7-10-5-6-25-16(10)20/h3-8H,9H2,1-2H3,(H,19,21)	CKWUGNRHDNXSCY-UHFFFAOYSA-N	COC(=O)c1cc2ccsc2n1CC(=O)Nc3cc(Cl)ccc3OC	BroadT	BRD-K28738219	BRD-K28738219-001-06-2	ChemDiv Inc.	C777-0701			COC(=O)c1cc2ccsc2n1CC(=O)Nc1cc(Cl)ccc1OC	InChI=1S/C17H15ClN2O4S/c1-23-14-4-3-11(18)8-12(14)19-15(21)9-20-13(17(22)24-2)7-10-5-6-25-16(10)20/h3-8H,9H2,1-2H3,(H,19,21)	CKWUGNRHDNXSCY-UHFFFAOYSA-N	378.04410538							107719
BAS 06208028	LSM-19099	SID24802188, BRD-A26798255	2953454	InChI=1S/C12H12N2O3S2/c1-19(15,16)14-10(11-4-2-6-17-11)8-9(13-14)12-5-3-7-18-12/h2-7,10H,8H2,1H3	MUYBWNBRPJJRMK-UHFFFAOYSA-N	CS(=O)(=O)N1N=C(CC1c2occc2)c3cccs3	BroadT	BRD-A26798255	BRD-A26798255-001-05-7	Asinex Ltd.	BAS 06208028			CS(=O)(=O)N1N=C(CC1c1ccco1)c1cccs1	InChI=1S/C12H12N2O3S2/c1-19(15,16)14-10(11-4-2-6-17-11)8-9(13-14)12-5-3-7-18-12/h2-7,10H,8H2,1H3	MUYBWNBRPJJRMK-UHFFFAOYSA-N	296.028933644							107720
AC1MMITB	LSM-19100	SID4244888, BRD-A56110059	3239429	InChI=1S/C13H16N2OS2/c1-7-4-5-8-9(6-7)18-11-10(8)12(16)15(2)13(14-11)17-3/h7H,4-6H2,1-3H3	CRDMGGMPKRBXKH-UHFFFAOYSA-N	CSC1=Nc2sc3CC(C)CCc3c2C(=O)N1C	BroadT	BRD-A56110059	BRD-A56110059-001-06-4	ChemDiv Inc.	4386-4720			CSc1nc2sc3CC(C)CCc3c2c(=O)n1C	InChI=1S/C13H16N2OS2/c1-7-4-5-8-9(6-7)18-11-10(8)12(16)15(2)13(14-11)17-3/h7H,4-6H2,1-3H3	CRDMGGMPKRBXKH-UHFFFAOYSA-N	280.070404532							107721
MLS000108481	LSM-43817	SID7976135, BRD-K14869008	5310817	InChI=1S/C19H15N5O3/c1-27-14-8-6-13(7-9-14)24-18(25)16-5-3-2-4-15(16)17(19(24)26)10-22-23-11-20-21-12-23/h2-12,22H,1H3/b17-10-	ZLPWXVRACXNZGE-YVLHZVERSA-N	COc1ccc(cc1)N2C(=O)\C(=C/Nn3cnnc3)\c4ccccc4C2=O	BroadT	BRD-K14869008	BRD-K14869008-001-05-8	ChemBridge Corporation	5759995			COc1ccc(cc1)N1C(=O)\C(=C/Nn2cnnc2)c2ccccc2C1=O	InChI=1S/C19H15N5O3/c1-27-14-8-6-13(7-9-14)24-18(25)16-5-3-2-4-15(16)17(19(24)26)10-22-23-11-20-21-12-23/h2-12,22H,1H3/b17-10-	ZLPWXVRACXNZGE-YVLHZVERSA-N	361.11748939							
T5820256	LSM-19102	SID24838519, SID4242139, BRD-K99043334	3237033	InChI=1S/C25H27N5O4/c1-3-34-21(31)17-30-20(26-23-22(30)24(32)27-25(33)28(23)2)16-29(14-18-10-6-4-7-11-18)15-19-12-8-5-9-13-19/h4-13H,3,14-17H2,1-2H3,(H,27,32,33)	CJIQQWDNAAATEV-UHFFFAOYSA-N	CCOC(=O)Cn1c(CN(Cc2ccccc2)Cc3ccccc3)nc4N(C)C(=O)NC(=O)c14	BroadT	BRD-K99043334	BRD-K99043334-001-05-3	ChemDiv Inc.	C692-0531			CCOC(=O)Cn1c(CN(Cc2ccccc2)Cc2ccccc2)nc2n(C)c(=O)[nH]c(=O)c12	InChI=1S/C25H27N5O4/c1-3-34-21(31)17-30-20(26-23-22(30)24(32)27-25(33)28(23)2)16-29(14-18-10-6-4-7-11-18)15-19-12-8-5-9-13-19/h4-13H,3,14-17H2,1-2H3,(H,27,32,33)	CJIQQWDNAAATEV-UHFFFAOYSA-N	461.206304394							107723
ZINC03299419	LSM-19103	SID24824732, BRD-K23046527	2415002	InChI=1S/C21H21N3O/c25-21(20-13-8-16-6-2-3-7-19(16)23-20)22-17-9-11-18(12-10-17)24-14-4-1-5-15-24/h2-3,6-13H,1,4-5,14-15H2,(H,22,25)	YJHVUWMPEWYYIX-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)N2CCCCC2)c3ccc4ccccc4n3	BroadT	BRD-K23046527	BRD-K23046527-001-05-4	Enamine Ltd.	T5211872			O=C(Nc1ccc(cc1)N1CCCCC1)c1ccc2ccccc2n1	InChI=1S/C21H21N3O/c25-21(20-13-8-16-6-2-3-7-19(16)23-20)22-17-9-11-18(12-10-17)24-14-4-1-5-15-24/h2-3,6-13H,1,4-5,14-15H2,(H,22,25)	YJHVUWMPEWYYIX-UHFFFAOYSA-N	331.168462322							107724
F1061-0228	LSM-19104	SID3715820, BRD-K93194316	829587	InChI=1S/C21H20N4O/c26-21-17-7-3-5-16-6-4-8-18(20(16)17)25(21)15-23-11-13-24(14-12-23)19-9-1-2-10-22-19/h1-10H,11-15H2	HTRVJZNOJDISMZ-UHFFFAOYSA-N	O=C1N(CN2CCN(CC2)c3ccccn3)c4cccc5cccc1c45	BroadT	BRD-K93194316	BRD-K93194316-001-05-2	Enamine Ltd.	T0508-1944			O=C1N(CN2CCN(CC2)c2ccccn2)c2cccc3cccc1c23	InChI=1S/C21H20N4O/c26-21-17-7-3-5-16-6-4-8-18(20(16)17)25(21)15-23-11-13-24(14-12-23)19-9-1-2-10-22-19/h1-10H,11-15H2	HTRVJZNOJDISMZ-UHFFFAOYSA-N	344.1637113							131248
AC1M7Z0Y	LSM-15542	BRD-K12895349	2527149	InChI=1S/C16H21N3O4S/c17-5-1-6-18-7-9-19(10-8-18)24(20,21)14-3-4-15-16(13-14)23-12-2-11-22-15/h3-4,13H,1-2,6-12H2	DWICNPFMJASQND-UHFFFAOYSA-N	O=S(=O)(N1CCN(CCC#N)CC1)c2ccc3OCCCOc3c2	BroadT	BRD-K12895349	BRD-K12895349-034-05-4	Enamine Ltd.	T5294025		OC(=O)C(=O)O	O=S(=O)(N1CCN(CCC#N)CC1)c1ccc2OCCCOc2c1.OC(=O)C(=O)O	InChI=1S/C16H21N3O4S.C2H2O4/c17-5-1-6-18-7-9-19(10-8-18)24(20,21)14-3-4-15-16(13-14)23-12-2-11-22-15;3-1(4)2(5)6/h3-4,13H,1-2,6-12H2;(H,3,4)(H,5,6)	XSCJDBFSNGAUKC-UHFFFAOYSA-N	351.125276872							104178, 104178
JS-0731	LSM-43818	SID24817735, BRD-K32664408	6085579	InChI=1S/C16H17NOS/c1-12-5-6-14(13(2)10-12)7-8-16(18)17-11-15-4-3-9-19-15/h3-10H,11H2,1-2H3,(H,17,18)/b8-7+	JLJNSMHAAKJHQC-BQYQJAHWSA-N	Cc1ccc(\C=C\C(=O)NCc2cccs2)c(C)c1	BroadT	BRD-K32664408	BRD-K32664408-001-05-7	Key Organics Ltd.	JS-0731			Cc1ccc(\C=C\C(=O)NCc2cccs2)c(C)c1	InChI=1S/C16H17NOS/c1-12-5-6-14(13(2)10-12)7-8-16(18)17-11-15-4-3-9-19-15/h3-10H,11H2,1-2H3,(H,17,18)/b8-7+	JLJNSMHAAKJHQC-BQYQJAHWSA-N	271.103084864							
BRN 3566669	LSM-19106	SID50101292, SID856806, BRD-K80794552	658161	InChI=1S/C13H14N2O5S/c16-13(17)11-8-14-12-2-1-9(7-10(11)12)21(18,19)15-3-5-20-6-4-15/h1-2,7-8,14H,3-6H2,(H,16,17)	GBSJAXQEEOQIFP-UHFFFAOYSA-N	OC(=O)c1c[nH]c2ccc(cc12)S(=O)(=O)N3CCOCC3	BroadT	BRD-K80794552	BRD-K80794552-001-05-7	InterBioScreen Ltd.	STOCK1S-30589			OC(=O)c1c[nH]c2ccc(cc12)S(=O)(=O)N1CCOCC1	InChI=1S/C13H14N2O5S/c16-13(17)11-8-14-12-2-1-9(7-10(11)12)21(18,19)15-3-5-20-6-4-15/h1-2,7-8,14H,3-6H2,(H,16,17)	GBSJAXQEEOQIFP-UHFFFAOYSA-N	310.062342258							107728
SMR000021872	LSM-19107	SID4251228, BRD-K62810034	3244941	InChI=1S/C17H21N3O3/c21-14(19-12-6-3-1-2-4-7-12)9-11-20-16(22)13-8-5-10-18-15(13)17(20)23/h5,8,10,12H,1-4,6-7,9,11H2,(H,19,21)	KKYAGDSKYHZOPC-UHFFFAOYSA-N	O=C(CCN1C(=O)c2cccnc2C1=O)NC3CCCCCC3	BroadT	BRD-K62810034	BRD-K62810034-001-05-1	ChemDiv Inc.	C081-0748			O=C(CCN1C(=O)c2cccnc2C1=O)NC1CCCCCC1	InChI=1S/C17H21N3O3/c21-14(19-12-6-3-1-2-4-7-12)9-11-20-16(22)13-8-5-10-18-15(13)17(20)23/h5,8,10,12H,1-4,6-7,9,11H2,(H,19,21)	KKYAGDSKYHZOPC-UHFFFAOYSA-N	315.158291562							107729
MLS000689248	LSM-19108	SID24814240, SID85176658, BRD-K08882679	4059144	InChI=1S/C23H21ClN4O5S/c24-19-6-2-1-5-18(19)16-34(32,33)21-9-8-17(15-20(21)28(30)31)23(29)27-13-11-26(12-14-27)22-7-3-4-10-25-22/h1-10,15H,11-14,16H2	ASWWIJZCKSFRRK-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1S(=O)(=O)Cc2ccccc2Cl)C(=O)N3CCN(CC3)c4ccccn4	BroadT	BRD-K08882679	BRD-K08882679-001-06-5	ChemDiv Inc.	K673-0054			[O-][N+](=O)c1cc(ccc1S(=O)(=O)Cc1ccccc1Cl)C(=O)N1CCN(CC1)c1ccccn1	InChI=1S/C23H21ClN4O5S/c24-19-6-2-1-5-18(19)16-34(32,33)21-9-8-17(15-20(21)28(30)31)23(29)27-13-11-26(12-14-27)22-7-3-4-10-25-22/h1-10,15H,11-14,16H2	ASWWIJZCKSFRRK-UHFFFAOYSA-N	500.092118212							107730
SMR000176074	LSM-19109	BRD-A33966510	2861451	InChI=1S/C21H23N3O3/c25-19-17-14-5-6-15(21(14)8-9-21)18(17)20(26)24(19)22-12-13-4-7-16(27-13)23-10-2-1-3-11-23/h4-7,12,14-15,17-18H,1-3,8-11H2	WIMVPYBEPMZMEC-UHFFFAOYSA-N	O=C1C2C3C=CC(C2C(=O)N1N=Cc4oc(cc4)N5CCCCC5)C36CC6	BroadT	BRD-A33966510	BRD-A33966510-001-05-2	Asinex Ltd.	BAS 00801520			O=C1C2C3C=CC(C2C(=O)N1N=Cc1ccc(o1)N1CCCCC1)C31CC1	InChI=1S/C21H23N3O3/c25-19-17-14-5-6-15(21(14)8-9-21)18(17)20(26)24(19)22-12-13-4-7-16(27-13)23-10-2-1-3-11-23/h4-7,12,14-15,17-18H,1-3,8-11H2	WIMVPYBEPMZMEC-UHFFFAOYSA-N	365.173941626							107731
SMR000097063	LSM-19110	BRD-A17687311, SID7967824	3690582	InChI=1S/C16H19ClFN3O2/c1-19-4-6-20(7-5-19)16(23)11-8-15(22)21(10-11)12-2-3-14(18)13(17)9-12/h2-3,9,11H,4-8,10H2,1H3	FHGYJOBEMJFCCO-UHFFFAOYSA-N	CN1CCN(CC1)C(=O)C2CN(C(=O)C2)c3ccc(F)c(Cl)c3	BroadT	BRD-A17687311	BRD-A17687311-001-04-8	ChemDiv Inc.	K786-6919			CN1CCN(CC1)C(=O)C1CN(C(=O)C1)c1ccc(F)c(Cl)c1	InChI=1S/C16H19ClFN3O2/c1-19-4-6-20(7-5-19)16(23)11-8-15(22)21(10-11)12-2-3-14(18)13(17)9-12/h2-3,9,11H,4-8,10H2,1H3	FHGYJOBEMJFCCO-UHFFFAOYSA-N	339.114982788							107732
AC1OBEA4	LSM-19111	SID26659339, BRD-K10929790	6845623	InChI=1S/C13H12FN7O2/c1-20-10-9(11(22)21(2)13(20)23)15-12(16-10)18-19-17-8-6-4-3-5-7(8)14/h3-6H,1-2H3,(H2,15,16,17,18)	CQVXYZKCWRVWRZ-UHFFFAOYSA-N	CN1C(=O)N(C)c2[nH]c(N=NNc3ccccc3F)nc2C1=O	BroadT	BRD-K10929790	BRD-K10929790-001-07-2	InterBioScreen Ltd.	STOCK1S-72248			Cn1c2[nH]c(N=NNc3ccccc3F)nc2c(=O)n(C)c1=O	InChI=1S/C13H12FN7O2/c1-20-10-9(11(22)21(2)13(20)23)15-12(16-10)18-19-17-8-6-4-3-5-7(8)14/h3-6H,1-2H3,(H2,15,16,17,18)	CQVXYZKCWRVWRZ-UHFFFAOYSA-N	317.103650894							
AC1ND5GZ	LSM-19112	SID22411278, BRD-K29752393	4544609	InChI=1S/C21H18BrFN2O4S/c1-13-3-9-17(22)18(11-13)25-30(27,28)20-12-16(8-10-19(20)29-2)24-21(26)14-4-6-15(23)7-5-14/h3-12,25H,1-2H3,(H,24,26)	WDFSMCAXGPFCAW-UHFFFAOYSA-N	COc1ccc(NC(=O)c2ccc(F)cc2)cc1S(=O)(=O)Nc3cc(C)ccc3Br	BroadT	BRD-K29752393	BRD-K29752393-001-05-2	Enamine Ltd.	T0520-4477			COc1ccc(NC(=O)c2ccc(F)cc2)cc1S(=O)(=O)Nc1cc(C)ccc1Br	InChI=1S/C21H18BrFN2O4S/c1-13-3-9-17(22)18(11-13)25-30(27,28)20-12-16(8-10-19(20)29-2)24-21(26)14-4-6-15(23)7-5-14/h3-12,25H,1-2H3,(H,24,26)	WDFSMCAXGPFCAW-UHFFFAOYSA-N	492.015468566							107734
BAS 08770079	LSM-19113	SID24786602, BRD-K66372234	972499	InChI=1S/C17H16N4OS/c1-11-7-8-18-16(9-11)21-17-20-15(10-23-17)13-3-5-14(6-4-13)19-12(2)22/h3-10H,1-2H3,(H,19,22)(H,18,20,21)	GNFJTRBLUFVMGS-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)c2csc(Nc3cc(C)ccn3)n2	BroadT	BRD-K66372234	BRD-K66372234-001-05-6	Asinex Ltd.	BAS 08770079			CC(=O)Nc1ccc(cc1)-c1csc(Nc2cc(C)ccn2)n1	InChI=1S/C17H16N4OS/c1-11-7-8-18-16(9-11)21-17-20-15(10-23-17)13-3-5-14(6-4-13)19-12(2)22/h3-10H,1-2H3,(H,19,22)(H,18,20,21)	GNFJTRBLUFVMGS-UHFFFAOYSA-N	324.104481862							107735
ZINC01117172	LSM-19114	SID24787514, BRD-K75094142	1294578	InChI=1S/C19H18N4OS/c1-11-12(2)20-17-8-7-13(9-16(11)17)18-21-22-19(25)23(18)14-5-4-6-15(10-14)24-3/h4-10,20H,1-3H3,(H,22,25)	FZIVRQGIKHRBMR-UHFFFAOYSA-N	COc1cccc(c1)n2c(S)nnc2c3ccc4[nH]c(C)c(C)c4c3	BroadT	BRD-K75094142	BRD-K75094142-001-05-6	ChemBridge Corporation	7908039			COc1cccc(c1)-n1c(S)nnc1-c1ccc2[nH]c(C)c(C)c2c1	InChI=1S/C19H18N4OS/c1-11-12(2)20-17-8-7-13(9-16(11)17)18-21-22-19(25)23(18)14-5-4-6-15(10-14)24-3/h4-10,20H,1-3H3,(H,22,25)	FZIVRQGIKHRBMR-UHFFFAOYSA-N	350.120131926							131249
Ethyl 6-amino-5-cyano-4-(2,4-dimethoxyphenyl)-2-(2-ethoxy-2-oxoethyl)-4H-pyran-3-carboxylate	LSM-19115	SID7975167, BRD-A35537528	2866174	InChI=1S/C21H24N2O7/c1-5-28-17(24)10-16-19(21(25)29-6-2)18(14(11-22)20(23)30-16)13-8-7-12(26-3)9-15(13)27-4/h7-9,18H,5-6,10,23H2,1-4H3	WDTJEMBCCFOELH-UHFFFAOYSA-N	CCOC(=O)CC1=C(C(C(=C(N)O1)C#N)c2ccc(OC)cc2OC)C(=O)OCC	BroadT	BRD-A35537528	BRD-A35537528-001-06-7	ChemBridge Corporation	5743274			CCOC(=O)CC1=C(C(c2ccc(OC)cc2OC)C(C#N)=C(N)O1)C(=O)OCC	InChI=1S/C21H24N2O7/c1-5-28-17(24)10-16-19(21(25)29-6-2)18(14(11-22)20(23)30-16)13-8-7-12(26-3)9-15(13)27-4/h7-9,18H,5-6,10,23H2,1-4H3	WDTJEMBCCFOELH-UHFFFAOYSA-N	416.158351128							107738
SMR000062896	LSM-19116	SID3711295, BRD-K84383600	2364461	InChI=1S/C19H16O6/c1-2-24-13-4-5-14(16(21)10-13)15(20)8-11-3-6-17-12(7-11)9-18(25-17)19(22)23/h3-7,9-10,21H,2,8H2,1H3,(H,22,23)	BJEGHXIETXORPL-UHFFFAOYSA-N	CCOc1ccc(C(=O)Cc2ccc3oc(cc3c2)C(=O)O)c(O)c1	BroadT	BRD-K84383600	BRD-K84383600-001-05-7	Enamine Ltd.	T0516-4886			CCOc1ccc(C(=O)Cc2ccc3oc(cc3c2)C(O)=O)c(O)c1	InChI=1S/C19H16O6/c1-2-24-13-4-5-14(16(21)10-13)15(20)8-11-3-6-17-12(7-11)9-18(25-17)19(22)23/h3-7,9-10,21H,2,8H2,1H3,(H,22,23)	BJEGHXIETXORPL-UHFFFAOYSA-N	340.094688232							107739
T5229349	LSM-43819	SID24791345, BRD-K64069148	5975988	InChI=1S/C18H14N4O4S/c1-21-11-19-20-18(21)27-17-9-3-12(10-15(17)22(25)26)2-8-16(24)13-4-6-14(23)7-5-13/h2-11,23H,1H3/b8-2+	PVHHKNYFQPGGSN-KRXBUXKQSA-N	Cn1cnnc1Sc2ccc(\C=C\C(=O)c3ccc(O)cc3)cc2[N+](=O)[O-]	BroadT	BRD-K64069148	BRD-K64069148-001-05-5	Enamine Ltd.	T5229349			Cn1cnnc1Sc1ccc(\C=C\C(=O)c2ccc(O)cc2)cc1[N+]([O-])=O	InChI=1S/C18H14N4O4S/c1-21-11-19-20-18(21)27-17-9-3-12(10-15(17)22(25)26)2-8-16(24)13-4-6-14(23)7-5-13/h2-11,23H,1H3/b8-2+	PVHHKNYFQPGGSN-KRXBUXKQSA-N	382.073575658							
ZINC00780631	LSM-19118	SID24789012, BRD-K73062809	1072935	InChI=1S/C17H17N5O2S/c23-17(19-13-3-6-15-16(11-13)21-25-20-15)18-12-1-4-14(5-2-12)22-7-9-24-10-8-22/h1-6,11H,7-10H2,(H2,18,19,23)	ZFVDICDYBGIHLQ-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)N2CCOCC2)Nc3ccc4nsnc4c3	BroadT	BRD-K73062809	BRD-K73062809-001-06-7	Asinex Ltd.	BAS 04320322			O=C(Nc1ccc(cc1)N1CCOCC1)Nc1ccc2nsnc2c1	InChI=1S/C17H17N5O2S/c23-17(19-13-3-6-15-16(11-13)21-25-20-15)18-12-1-4-14(5-2-12)22-7-9-24-10-8-22/h1-6,11H,7-10H2,(H2,18,19,23)	ZFVDICDYBGIHLQ-UHFFFAOYSA-N	355.110295524							107741
ST056856	LSM-19119	SID7977908, BRD-A86636368	2890941	InChI=1S/C18H16N4O5S2/c19-29(26,27)13-8-6-12(7-9-13)20-14(23)10-28-18-21-16(24)15(17(25)22-18)11-4-2-1-3-5-11/h1-9,15H,10H2,(H,20,23)(H2,19,26,27)(H,21,22,24,25)	SSOPIFHIQSGYFB-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(NC(=O)CSC2=NC(=O)C(C(=O)N2)c3ccccc3)cc1	BroadT	BRD-A86636368	BRD-A86636368-001-05-0	ChemBridge Corporation	6218703			NS(=O)(=O)c1ccc(NC(=O)CSC2=NC(=O)C(C(=O)N2)c2ccccc2)cc1	InChI=1S/C18H16N4O5S2/c19-29(26,27)13-8-6-12(7-9-13)20-14(23)10-28-18-21-16(24)15(17(25)22-18)11-4-2-1-3-5-11/h1-9,15H,10H2,(H,20,23)(H2,19,26,27)(H,21,22,24,25)	SSOPIFHIQSGYFB-UHFFFAOYSA-N	432.056211032							107742
SMR000173527	LSM-19120	SID17408439, BRD-K02020774	1454780	InChI=1S/C26H29N5S/c1-17-7-8-18(2)22(12-17)30-26(32)31(16-21-6-5-10-27-15-21)11-9-25-28-23-13-19(3)20(4)14-24(23)29-25/h5-8,10,12-15H,9,11,16H2,1-4H3,(H,28,29)(H,30,32)	UXAPDUYGWUVEAS-UHFFFAOYSA-N	Cc1ccc(C)c(NC(=S)N(CCc2nc3cc(C)c(C)cc3[nH]2)Cc4cccnc4)c1	BroadT	BRD-K02020774	BRD-K02020774-001-06-2	Asinex Ltd.	ASN 06610210			Cc1ccc(C)c(NC(=S)N(CCc2nc3cc(C)c(C)cc3[nH]2)Cc2cccnc2)c1	InChI=1S/C26H29N5S/c1-17-7-8-18(2)22(12-17)30-26(32)31(16-21-6-5-10-27-15-21)11-9-25-28-23-13-19(3)20(4)14-24(23)29-25/h5-8,10,12-15H,9,11,16H2,1-4H3,(H,28,29)(H,30,32)	UXAPDUYGWUVEAS-UHFFFAOYSA-N	443.214366668							107743
ZINC03176780	LSM-43616	BRD-K42796363	2313024	InChI=1S/C22H20NO2/c1-25-21-11-9-18(10-12-21)7-8-19-13-15-23(16-14-19)22(24)17-20-5-3-2-4-6-20/h2-16H,17H2,1H3/q+1/b8-7+	QHSXLFJZNQFYPQ-BQYQJAHWSA-N	COc1ccc(\C=C\c2cc[n+](cc2)C(=O)Cc3ccccc3)cc1	BroadT	BRD-K42796363	BRD-K42796363-003-06-2	Enamine Ltd.	T0400-3730		Cl	COc1ccc(\C=C\c2cc[n+](cc2)C(=O)Cc2ccccc2)cc1.Cl	InChI=1S/C22H20NO2.ClH/c1-25-21-11-9-18(10-12-21)7-8-19-13-15-23(16-14-19)22(24)17-20-5-3-2-4-6-20;/h2-16H,17H2,1H3;1H/q+1;/b8-7+;	YSZXQQVBZMDUSH-USRGLUTNSA-N	330.14940389							, 
2,2'-Bipyridine-3,3'-dicarboxylic acid	LSM-19121	SID4251388, BRD-K16569034	681885	InChI=1S/C12H8N2O4/c15-11(16)7-3-1-5-13-9(7)10-8(12(17)18)4-2-6-14-10/h1-6H,(H,15,16)(H,17,18)	KNVZVRWMLMPTTJ-UHFFFAOYSA-N	OC(=O)c1cccnc1c2ncccc2C(=O)O	BroadT	BRD-K16569034	BRD-K16569034-001-06-8	ChemDiv Inc.	8014-2130			OC(=O)c1cccnc1-c1ncccc1C(O)=O	InChI=1S/C12H8N2O4/c15-11(16)7-3-1-5-13-9(7)10-8(12(17)18)4-2-6-14-10/h1-6H,(H,15,16)(H,17,18)	KNVZVRWMLMPTTJ-UHFFFAOYSA-N	244.048406756							107744
SMR000155402	LSM-19122	SID14744634, BRD-K71912544	3415775	InChI=1S/C21H23N3O6S2/c1-3-30-15-5-6-16-18(13-15)31-21(22-16)23-20(25)14-4-7-17(28-2)19(12-14)32(26,27)24-8-10-29-11-9-24/h4-7,12-13H,3,8-11H2,1-2H3,(H,22,23,25)	KXHKBHYRCVZTJK-UHFFFAOYSA-N	CCOc1ccc2nc(NC(=O)c3ccc(OC)c(c3)S(=O)(=O)N4CCOCC4)sc2c1	BroadT	BRD-K71912544	BRD-K71912544-001-06-5	Enamine Ltd.	T0507-6439			CCOc1ccc2nc(NC(=O)c3ccc(OC)c(c3)S(=O)(=O)N3CCOCC3)sc2c1	InChI=1S/C21H23N3O6S2/c1-3-30-15-5-6-16-18(13-15)31-21(22-16)23-20(25)14-4-7-17(28-2)19(12-14)32(26,27)24-8-10-29-11-9-24/h4-7,12-13H,3,8-11H2,1-2H3,(H,22,23,25)	KXHKBHYRCVZTJK-UHFFFAOYSA-N	477.102826866							107745
MLS000583348	LSM-19123	SID17433268, BRD-K39154783	1249317	InChI=1S/C25H20N2O5/c1-2-30-24(28)20-12-6-8-17(14-20)16-31-25(29)21-13-7-11-19(15-21)23-27-26-22(32-23)18-9-4-3-5-10-18/h3-15H,2,16H2,1H3	DPCWUCIWTFNWGI-UHFFFAOYSA-N	CCOC(=O)c1cccc(COC(=O)c2cccc(c2)c3oc(nn3)c4ccccc4)c1	BroadT	BRD-K39154783	BRD-K39154783-001-05-7	ChemBridge Corporation	7953986			CCOC(=O)c1cccc(COC(=O)c2cccc(c2)-c2nnc(o2)-c2ccccc2)c1	InChI=1S/C25H20N2O5/c1-2-30-24(28)20-12-6-8-17(14-20)16-31-25(29)21-13-7-11-19(15-21)23-27-26-22(32-23)18-9-4-3-5-10-18/h3-15H,2,16H2,1H3	DPCWUCIWTFNWGI-UHFFFAOYSA-N	428.13722176							107746
ST50185515	LSM-19124	SID17408267, BRD-K12724558	725697	InChI=1S/C18H16N2O4/c1-12-6-8-14(9-7-12)23-11-17(21)19-20-18(22)16-10-13-4-2-3-5-15(13)24-16/h2-10H,11H2,1H3,(H,19,21)(H,20,22)	YAPZOCIMBBNQDC-UHFFFAOYSA-N	Cc1ccc(OCC(=O)NNC(=O)c2oc3ccccc3c2)cc1	BroadT	BRD-K12724558	BRD-K12724558-001-05-1	Asinex Ltd.	BAS 00713100			Cc1ccc(OCC(=O)NNC(=O)c2cc3ccccc3o2)cc1	InChI=1S/C18H16N2O4/c1-12-6-8-14(9-7-12)23-11-17(21)19-20-18(22)16-10-13-4-2-3-5-15(13)24-16/h2-10H,11H2,1H3,(H,19,21)(H,20,22)	YAPZOCIMBBNQDC-UHFFFAOYSA-N	324.111007012							107747
ST50942724	LSM-19125	SID14726993, BRD-K83882946	897293	InChI=1S/C16H24N2O/c1-12(2)16(19)18-10-8-17(9-11-18)15-7-5-6-13(3)14(15)4/h5-7,12H,8-11H2,1-4H3	KFWOHYYCXICJDX-UHFFFAOYSA-N	CC(C)C(=O)N1CCN(CC1)c2cccc(C)c2C	BroadT	BRD-K83882946	BRD-K83882946-001-05-2	Asinex Ltd.	BAS 05674740			CC(C)C(=O)N1CCN(CC1)c1cccc(C)c1C	InChI=1S/C16H24N2O/c1-12(2)16(19)18-10-8-17(9-11-18)15-7-5-6-13(3)14(15)4/h5-7,12H,8-11H2,1-4H3	KFWOHYYCXICJDX-UHFFFAOYSA-N	260.188863408							107748
SMR000072097	LSM-19126	SID4256399, BRD-K00571275	1033156	InChI=1S/C18H17N3O2S2/c22-25(23,21-10-1-2-11-21)16-7-5-14(6-8-16)17-13-24-18(20-17)15-4-3-9-19-12-15/h3-9,12-13H,1-2,10-11H2	LNGCCBILHXCZLI-UHFFFAOYSA-N	O=S(=O)(N1CCCC1)c2ccc(cc2)c3csc(n3)c4cccnc4	BroadT	BRD-K00571275	BRD-K00571275-001-06-0	ChemBridge Corporation	7324935			O=S(=O)(N1CCCC1)c1ccc(cc1)-c1csc(n1)-c1cccnc1	InChI=1S/C18H17N3O2S2/c22-25(23,21-10-1-2-11-21)16-7-5-14(6-8-16)17-13-24-18(20-17)15-4-3-9-19-12-15/h3-9,12-13H,1-2,10-11H2	LNGCCBILHXCZLI-UHFFFAOYSA-N	371.076218194							107749
ASN 06532879	LSM-19127	SID24808902, BRD-K64326672	1442659	InChI=1S/C19H17FN2OS/c1-2-5-18-21-16-7-4-3-6-15(16)19(22-18)24-12-17(23)13-8-10-14(20)11-9-13/h3-4,6-11H,2,5,12H2,1H3	BXUDTGUACXXLEB-UHFFFAOYSA-N	CCCc1nc(SCC(=O)c2ccc(F)cc2)c3ccccc3n1	BroadT	BRD-K64326672	BRD-K64326672-001-06-1	Asinex Ltd.	ASN 06532879			CCCc1nc(SCC(=O)c2ccc(F)cc2)c2ccccc2n1	InChI=1S/C19H17FN2OS/c1-2-5-18-21-16-7-4-3-6-15(16)19(22-18)24-12-17(23)13-8-10-14(20)11-9-13/h3-4,6-11H,2,5,12H2,1H3	BXUDTGUACXXLEB-UHFFFAOYSA-N	340.104562074							107750
SMR000078684	LSM-19128	SID4262524, BRD-K08675565	2963624	InChI=1S/C20H16N4OS2/c21-12-15-5-7-16(8-6-15)14-27-20-23-22-19(11-18-4-2-10-26-18)24(20)13-17-3-1-9-25-17/h1-10H,11,13-14H2	HYHCSMHOCPTOLR-UHFFFAOYSA-N	N#Cc1ccc(CSc2nnc(Cc3cccs3)n2Cc4occc4)cc1	BroadT	BRD-K08675565	BRD-K08675565-001-05-2	ChemBridge Corporation	7911488			N#Cc1ccc(CSc2nnc(Cc3cccs3)n2Cc2ccco2)cc1	InChI=1S/C20H16N4OS2/c21-12-15-5-7-16(8-6-15)14-27-20-23-22-19(11-18-4-2-10-26-18)24(20)13-17-3-1-9-25-17/h1-10H,11,13-14H2	HYHCSMHOCPTOLR-UHFFFAOYSA-N	392.076552552							107751
SMR000095399	LSM-19129	SID51088298, SID7967239, BRD-K69740426	5308704	InChI=1S/C22H24N2O4/c1-3-27-19-12-10-16(11-13-19)21-15-18(24-28-21)7-5-9-22(25)23-17-6-4-8-20(14-17)26-2/h4,6,8,10-15H,3,5,7,9H2,1-2H3,(H,23,25)	MGSHIAIRIYECSG-UHFFFAOYSA-N	CCOc1ccc(cc1)c2onc(CCCC(=O)Nc3cccc(OC)c3)c2	BroadT	BRD-K69740426	BRD-K69740426-001-06-7	ChemDiv Inc.	C637-0012			CCOc1ccc(cc1)-c1cc(CCCC(=O)Nc2cccc(OC)c2)no1	InChI=1S/C22H24N2O4/c1-3-27-19-12-10-16(11-13-19)21-15-18(24-28-21)7-5-9-22(25)23-17-6-4-8-20(14-17)26-2/h4,6,8,10-15H,3,5,7,9H2,1-2H3,(H,23,25)	MGSHIAIRIYECSG-UHFFFAOYSA-N	380.173607268							107752
AM-807/42004512	LSM-19130	SID14725924, BRD-A88022652	3156534	InChI=1S/C18H14N4O3/c1-23-12-4-2-10(3-5-12)16-15-14(11-6-7-24-9-11)13(8-19)17(20)25-18(15)22-21-16/h2-7,9,14H,20H2,1H3,(H,21,22)	BFSQCCRPEGKUFZ-UHFFFAOYSA-N	COc1ccc(cc1)c2[nH]nc3OC(=C(C#N)C(c4cocc4)c23)N	BroadT	BRD-A88022652	BRD-A88022652-001-07-2	Asinex Ltd.	BAS 07418284			COc1ccc(cc1)-c1[nH]nc2OC(N)=C(C#N)C(c3ccoc3)c12	InChI=1S/C18H14N4O3/c1-23-12-4-2-10(3-5-12)16-15-14(11-6-7-24-9-11)13(8-19)17(20)25-18(15)22-21-16/h2-7,9,14H,20H2,1H3,(H,21,22)	BFSQCCRPEGKUFZ-UHFFFAOYSA-N	334.106590348							107753
Mifepristone	LSM-2822	Mifepristone, Korlym, Mifeprex, RU-38486, RU-486	55245	InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17,24-26,32H,8,11-14,16,18H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1	VKHAHZOOUSRJNA-GCNJZUOMSA-N	CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c5ccc(cc5)N(C)C	BroadT	BRD-K37270826	BRD-K37270826-001-15-1	Sigma-Aldrich	M8046			CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc(cc1)N(C)C	InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17,24-26,32H,8,11-14,16,18H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1	VKHAHZOOUSRJNA-GCNJZUOMSA-N	429.26677937							50692
N-(Pyridin-3-ylmethyl)-1,3-benzodioxol-5-amine	LSM-19131	SID14743702, BRD-K07808993	2543250	InChI=1S/C13H12N2O2/c1-2-10(7-14-5-1)8-15-11-3-4-12-13(6-11)17-9-16-12/h1-7,15H,8-9H2	OMPJSXOWKKYUGP-UHFFFAOYSA-N	C(Nc1ccc2OCOc2c1)c3cccnc3	BroadT	BRD-K07808993	BRD-K07808993-001-06-0	Enamine Ltd.	T5297937			C(Nc1ccc2OCOc2c1)c1cccnc1	InChI=1S/C13H12N2O2/c1-2-10(7-14-5-1)8-15-11-3-4-12-13(6-11)17-9-16-12/h1-7,15H,8-9H2	OMPJSXOWKKYUGP-UHFFFAOYSA-N	228.089877644							107754
MLS000765490	LSM-19132	SID24822476, BRD-K77189681	5390274	InChI=1S/C9H7N7O2/c17-16(18)9-7(5-1-10-11-2-5)14-15-8(9)6-3-12-13-4-6/h1-4H,(H,10,11)(H,12,13)(H,14,15)	OMPHEYNAVULYPH-UHFFFAOYSA-N	[O-][N+](=O)c1c(n[nH]c1c2cn[nH]c2)c3cn[nH]c3	BroadT	BRD-K77189681	BRD-K77189681-001-06-7	Asinex Ltd.	BAS 00615799			[O-][N+](=O)c1c(n[nH]c1-c1cn[nH]c1)-c1cn[nH]c1	InChI=1S/C9H7N7O2/c17-16(18)9-7(5-1-10-11-2-5)14-15-8(9)6-3-12-13-4-6/h1-4H,(H,10,11)(H,12,13)(H,14,15)	OMPHEYNAVULYPH-UHFFFAOYSA-N	245.066122534							
AC1N2A2U	LSM-19133	SID14741923, BRD-K27996141	4018541	InChI=1S/C10H10N4O3/c1-13-6-11-9(14(16)17)10(13)12-7-2-4-8(15)5-3-7/h2-6,12,15H,1H3	MTKYJDFQIRZBSQ-UHFFFAOYSA-N	Cn1cnc(c1Nc2ccc(O)cc2)[N+](=O)[O-]	BroadT	BRD-K27996141	BRD-K27996141-001-05-2	InterBioScreen Ltd.	STOCK1S-44871			Cn1cnc(c1Nc1ccc(O)cc1)[N+]([O-])=O	InChI=1S/C10H10N4O3/c1-13-6-11-9(14(16)17)10(13)12-7-2-4-8(15)5-3-7/h2-6,12,15H,1H3	MTKYJDFQIRZBSQ-UHFFFAOYSA-N	234.07529022							107756
N'-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-2-thiophenecarbohydrazide	LSM-19134	SID26729881, BRD-K71575796	2817112	InChI=1S/C15H13N3O2S2/c1-20-11-5-2-4-10(8-11)12-9-22-15(16-12)18-17-14(19)13-6-3-7-21-13/h2-9H,1H3,(H,16,18)(H,17,19)	HERMZKVIZDMATB-UHFFFAOYSA-N	COc1cccc(c1)c2csc(NNC(=O)c3cccs3)n2	BroadT	BRD-K71575796	BRD-K71575796-001-05-7	Maybridge	HTS 13467			COc1cccc(c1)-c1csc(NNC(=O)c2cccs2)n1	InChI=1S/C15H13N3O2S2/c1-20-11-5-2-4-10(8-11)12-9-22-15(16-12)18-17-14(19)13-6-3-7-21-13/h2-9H,1H3,(H,16,18)(H,17,19)	HERMZKVIZDMATB-UHFFFAOYSA-N	331.044918066							107757
AC1ND7G2	LSM-19135	SID24836612, BRD-K99034148	4523473	InChI=1S/C22H22N2O5S/c25-19-15-21(29-20-11-4-3-10-18(19)20)22(26)23-16-8-7-9-17(14-16)30(27,28)24-12-5-1-2-6-13-24/h3-4,7-11,14-15H,1-2,5-6,12-13H2,(H,23,26)	ZQWQMEGGIJJTCN-UHFFFAOYSA-N	O=C(Nc1cccc(c1)S(=O)(=O)N2CCCCCC2)C3=CC(=O)c4ccccc4O3	BroadT	BRD-K99034148	BRD-K99034148-001-05-8	Enamine Ltd.	T0506-7546			O=C(Nc1cccc(c1)S(=O)(=O)N1CCCCCC1)c1cc(=O)c2ccccc2o1	InChI=1S/C22H22N2O5S/c25-19-15-21(29-20-11-4-3-10-18(19)20)22(26)23-16-8-7-9-17(14-16)30(27,28)24-12-5-1-2-6-13-24/h3-4,7-11,14-15H,1-2,5-6,12-13H2,(H,23,26)	ZQWQMEGGIJJTCN-UHFFFAOYSA-N	426.124942514							107758
AN-329/41563785	LSM-19136	SID17387394, BRD-K87705545	1790651	InChI=1S/C17H16ClN3O2S/c18-14-9-7-13(8-10-14)16(23)19-17(24)21-20-15(22)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2,(H,20,22)(H2,19,21,23,24)	UWVBEALNNHEDTM-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)NC(=S)NNC(=O)CCc2ccccc2	BroadT	BRD-K87705545	BRD-K87705545-001-05-6	Specs	AN-329/41563785			Clc1ccc(cc1)C(=O)NC(=S)NNC(=O)CCc1ccccc1	InChI=1S/C17H16ClN3O2S/c18-14-9-7-13(8-10-14)16(23)19-17(24)21-20-15(22)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2,(H,20,22)(H2,19,21,23,24)	UWVBEALNNHEDTM-UHFFFAOYSA-N	361.065175182							107759
ST50677458	LSM-19137	SID4244368, BRD-K90793377	657174	InChI=1S/C15H12N2O3/c1-10-4-6-11(7-5-10)16-15(18)12-9-14(20-17-12)13-3-2-8-19-13/h2-9H,1H3,(H,16,18)	VCFGDUWXFDGNLF-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2cc(on2)c3occc3)cc1	BroadT	BRD-K90793377	BRD-K90793377-001-05-0	ChemDiv Inc.	C226-1798			Cc1ccc(NC(=O)c2cc(on2)-c2ccco2)cc1	InChI=1S/C15H12N2O3/c1-10-4-6-11(7-5-10)16-15(18)12-9-14(20-17-12)13-3-2-8-19-13/h2-9H,1H3,(H,16,18)	VCFGDUWXFDGNLF-UHFFFAOYSA-N	268.084792264							107760
MLS000769531	LSM-19138	SID26663822, BRD-K65731773	748627	InChI=1S/C20H16N4/c1-14-6-8-16(9-7-14)22-20-17-4-2-3-5-18(17)23-19(24-20)15-10-12-21-13-11-15/h2-13H,1H3,(H,22,23,24)	SMWKEUKJWUQZTR-UHFFFAOYSA-N	Cc1ccc(Nc2nc(nc3ccccc23)c4ccncc4)cc1	BroadT	BRD-K65731773	BRD-K65731773-001-05-1	InterBioScreen Ltd.	STOCK3S-88647			Cc1ccc(Nc2nc(nc3ccccc23)-c2ccncc2)cc1	InChI=1S/C20H16N4/c1-14-6-8-16(9-7-14)22-20-17-4-2-3-5-18(17)23-19(24-20)15-10-12-21-13-11-15/h2-13H,1H3,(H,22,23,24)	SMWKEUKJWUQZTR-UHFFFAOYSA-N	312.137496552							107761
SMR000152089	LSM-19139	SID14743627, BRD-K10191194	4077389	InChI=1S/C19H20N4O2S3/c1-2-3-10-23-16-9-8-13(28(20,24)25)11-15(16)22-19(23)26-12-18-21-14-6-4-5-7-17(14)27-18/h4-9,11H,2-3,10,12H2,1H3,(H2,20,24,25)	JDMUFUINJWKLBE-UHFFFAOYSA-N	CCCCn1c(SCc2nc3ccccc3s2)nc4cc(ccc14)S(=O)(=O)N	BroadT	BRD-K10191194	BRD-K10191194-001-05-5	Enamine Ltd.	T0511-9593			CCCCn1c(SCc2nc3ccccc3s2)nc2cc(ccc12)S(N)(=O)=O	InChI=1S/C19H20N4O2S3/c1-2-3-10-23-16-9-8-13(28(20,24)25)11-15(16)22-19(23)26-12-18-21-14-6-4-5-7-17(14)27-18/h4-9,11H,2-3,10,12H2,1H3,(H2,20,24,25)	JDMUFUINJWKLBE-UHFFFAOYSA-N	432.07483799							107762
MLS000861805	LSM-19140	SID26729566, BRD-K80480866	2732231	InChI=1S/C16H16N4O/c1-10-7-8-12(9-11(10)2)18-16-20-19-15(21-16)13-5-3-4-6-14(13)17/h3-9H,17H2,1-2H3,(H,18,20)	VBWKIBVDKWTPIJ-UHFFFAOYSA-N	Cc1ccc(Nc2oc(nn2)c3ccccc3N)cc1C	BroadT	BRD-K80480866	BRD-K80480866-001-07-0	Maybridge	S 10064			Cc1ccc(Nc2nnc(o2)-c2ccccc2N)cc1C	InChI=1S/C16H16N4O/c1-10-7-8-12(9-11(10)2)18-16-20-19-15(21-16)13-5-3-4-6-14(13)17/h3-9H,17H2,1-2H3,(H,18,20)	VBWKIBVDKWTPIJ-UHFFFAOYSA-N	280.132411172							107763
MLS000047020	LSM-19141	SID4246983, BRD-K21886573	3241256	InChI=1S/C19H17N3O4/c1-22-19(24)14-5-3-2-4-13(14)15(21-22)11-18(23)20-12-6-7-16-17(10-12)26-9-8-25-16/h2-7,10H,8-9,11H2,1H3,(H,20,23)	XYEVXHKHHRCOPM-UHFFFAOYSA-N	CN1N=C(CC(=O)Nc2ccc3OCCOc3c2)c4ccccc4C1=O	BroadT	BRD-K21886573	BRD-K21886573-001-06-6	ChemDiv Inc.	K851-0075			Cn1nc(CC(=O)Nc2ccc3OCCOc3c2)c2ccccc2c1=O	InChI=1S/C19H17N3O4/c1-22-19(24)14-5-3-2-4-13(14)15(21-22)11-18(23)20-12-6-7-16-17(10-12)26-9-8-25-16/h2-7,10H,8-9,11H2,1H3,(H,20,23)	XYEVXHKHHRCOPM-UHFFFAOYSA-N	351.121906054							107764
T0506-2285	LSM-19142	SID3714250, BRD-A73987137	2998724	InChI=1S/C22H35NO4/c1-5-22(3,4)18-7-9-20(10-8-18)27-16-19(24)15-23-13-11-17(12-14-23)21(25)26-6-2/h7-10,17,19,24H,5-6,11-16H2,1-4H3	CLVBZZPHOLPDKS-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC(O)COc2ccc(cc2)C(C)(C)CC)CC1	BroadT	BRD-A73987137	BRD-A73987137-001-05-2	Enamine Ltd.	T0506-2285			CCOC(=O)C1CCN(CC(O)COc2ccc(cc2)C(C)(C)CC)CC1	InChI=1S/C22H35NO4/c1-5-22(3,4)18-7-9-20(10-8-18)27-16-19(24)15-23-13-11-17(12-14-23)21(25)26-6-2/h7-10,17,19,24H,5-6,11-16H2,1-4H3	CLVBZZPHOLPDKS-UHFFFAOYSA-N	377.25660861							107765
CID 78562528	LSM-19143	BRD-A53118167	78562528	InChI=1S/C21H22N2O3S/c1-3-26-18(25)12-27-21-15(11-22)19(14-9-7-13(2)8-10-14)20-16(23-21)5-4-6-17(20)24/h7-10,19-20H,3-6,12H2,1-2H3	YOCIGGXACNXBQR-UHFFFAOYSA-N	CCOC(=O)CSC1=C(C#N)C(C2C(=O)CCCC2=N1)c3ccc(C)cc3	BroadT	BRD-A53118167	BRD-A53118167-001-05-1	Enamine Ltd.	T0516-5508			CCOC(=O)CSC1=C(C#N)C(C2C(=O)CCCC2=N1)c1ccc(C)cc1	InChI=1S/C21H22N2O3S/c1-3-26-18(25)12-27-21-15(11-22)19(14-9-7-13(2)8-10-14)20-16(23-21)5-4-6-17(20)24/h7-10,19-20H,3-6,12H2,1-2H3	YOCIGGXACNXBQR-UHFFFAOYSA-N	382.135113274							107766
Benzyl 4-(dimethylamino)benzoate	LSM-19144	SID14738727, BRD-K05159099	803407	InChI=1S/C16H17NO2/c1-17(2)15-10-8-14(9-11-15)16(18)19-12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3	KAQXEMSHTWYFQB-UHFFFAOYSA-N	CN(C)c1ccc(cc1)C(=O)OCc2ccccc2	BroadT	BRD-K05159099	BRD-K05159099-001-05-5	ChemBridge Corporation	7011039			CN(C)c1ccc(cc1)C(=O)OCc1ccccc1	InChI=1S/C16H17NO2/c1-17(2)15-10-8-14(9-11-15)16(18)19-12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3	KAQXEMSHTWYFQB-UHFFFAOYSA-N	255.125928794							107767
AC1NF8YU	LSM-19145	SID24823717, BRD-K79431521	4654815	InChI=1S/C23H22N4O/c1-3-17-6-9-20(10-7-17)27-16(2)26-21-13-19(8-11-22(21)27)23(28)25-15-18-5-4-12-24-14-18/h4-14H,3,15H2,1-2H3,(H,25,28)	XYXJYESAJITLHX-UHFFFAOYSA-N	CCc1ccc(cc1)n2c(C)nc3cc(ccc23)C(=O)NCc4cccnc4	BroadT	BRD-K79431521	BRD-K79431521-001-05-7	ChemDiv Inc.	K783-0268			CCc1ccc(cc1)-n1c(C)nc2cc(ccc12)C(=O)NCc1cccnc1	InChI=1S/C23H22N4O/c1-3-17-6-9-20(10-7-17)27-16(2)26-21-13-19(8-11-22(21)27)23(28)25-15-18-5-4-12-24-14-18/h4-14H,3,15H2,1-2H3,(H,25,28)	XYXJYESAJITLHX-UHFFFAOYSA-N	370.179361364							107768
MLS-0015758.0001	LSM-19146	SID87218755, SID863781, BRD-K01342856	665037	InChI=1S/C20H21N3O2/c1-3-10-23(20(25)17-6-4-5-9-21-17)13-16-12-15-8-7-14(2)11-18(15)22-19(16)24/h4-9,11-12H,3,10,13H2,1-2H3,(H,22,24)	XLYAGNZIBZOLQP-UHFFFAOYSA-N	CCCN(Cc1cc2ccc(C)cc2nc1O)C(=O)c3ccccn3	BroadT	BRD-K01342856	BRD-K01342856-001-05-4	InterBioScreen Ltd.	STOCK4S-93414			CCCN(Cc1cc2ccc(C)cc2nc1O)C(=O)c1ccccn1	InChI=1S/C20H21N3O2/c1-3-10-23(20(25)17-6-4-5-9-21-17)13-16-12-15-8-7-14(2)11-18(15)22-19(16)24/h4-9,11-12H,3,10,13H2,1-2H3,(H,22,24)	XLYAGNZIBZOLQP-UHFFFAOYSA-N	335.163376942							107769
ST058923	LSM-19147	SID4260078, BRD-K12092669	1251624	InChI=1S/C21H22N2O5S2/c1-29(24,25)23-11-10-14-12-16(7-8-19(14)23)30(26,27)22-15-6-9-21-18(13-15)17-4-2-3-5-20(17)28-21/h6-9,12-13,22H,2-5,10-11H2,1H3	BTKNCOCAXKQCEZ-UHFFFAOYSA-N	CS(=O)(=O)N1CCc2cc(ccc12)S(=O)(=O)Nc3ccc4oc5CCCCc5c4c3	BroadT	BRD-K12092669	BRD-K12092669-001-05-9	ChemBridge Corporation	7959929			CS(=O)(=O)N1CCc2cc(ccc12)S(=O)(=O)Nc1ccc2oc3CCCCc3c2c1	InChI=1S/C21H22N2O5S2/c1-29(24,25)23-11-10-14-12-16(7-8-19(14)23)30(26,27)22-15-6-9-21-18(13-15)17-4-2-3-5-20(17)28-21/h6-9,12-13,22H,2-5,10-11H2,1H3	BTKNCOCAXKQCEZ-UHFFFAOYSA-N	446.097013204							107770
MLS000095975	LSM-19148	SID4242668, BRD-K78412459	3237493	InChI=1S/C16H13ClFN3O3/c1-8-11(5-9-3-4-10(18)6-13(9)17)15(22)21-14(20-8)12(7-19-21)16(23)24-2/h3-4,6-7,22H,5H2,1-2H3	RWAYAYWDGUNNTR-UHFFFAOYSA-N	COC(=O)c1cnn2c(O)c(Cc3ccc(F)cc3Cl)c(C)nc12	BroadT	BRD-K78412459	BRD-K78412459-001-07-0	ChemDiv Inc.	K783-4557			COC(=O)c1cnn2c(O)c(Cc3ccc(F)cc3Cl)c(C)nc12	InChI=1S/C16H13ClFN3O3/c1-8-11(5-9-3-4-10(18)6-13(9)17)15(22)21-14(20-8)12(7-19-21)16(23)24-2/h3-4,6-7,22H,5H2,1-2H3	RWAYAYWDGUNNTR-UHFFFAOYSA-N	349.062947216							
F5570-0324	LSM-19149	SID26731220, BRD-K89873893	2809650	InChI=1S/C16H15F3N2O6S/c17-16(18,19)27-12-3-1-11(2-4-12)20-15(22)13-5-6-14(26-13)28(23,24)21-7-9-25-10-8-21/h1-6H,7-10H2,(H,20,22)	KNPFPXMLKVJIFZ-UHFFFAOYSA-N	FC(F)(F)Oc1ccc(NC(=O)c2oc(cc2)S(=O)(=O)N3CCOCC3)cc1	BroadT	BRD-K89873893	BRD-K89873893-001-05-8	Maybridge	HTS 00424			FC(F)(F)Oc1ccc(NC(=O)c2ccc(o2)S(=O)(=O)N2CCOCC2)cc1	InChI=1S/C16H15F3N2O6S/c17-16(18,19)27-12-3-1-11(2-4-12)20-15(22)13-5-6-14(26-13)28(23,24)21-7-9-25-10-8-21/h1-6H,7-10H2,(H,20,22)	KNPFPXMLKVJIFZ-UHFFFAOYSA-N	420.06029151							107772
4,7-Dimethoxy-2,3-dimethyl-1H-indole	LSM-19150	SID26664684, BRD-K18563051	266598	InChI=1S/C12H15NO2/c1-7-8(2)13-12-10(15-4)6-5-9(14-3)11(7)12/h5-6,13H,1-4H3	TXUCJSRUALPKHM-UHFFFAOYSA-N	COc1ccc(OC)c2c(C)c(C)[nH]c12	BroadT	BRD-K18563051	BRD-K18563051-001-05-9	National Cancer Institute Chemotherapeutic Agents Repository	105319			COc1ccc(OC)c2c(C)c(C)[nH]c12	InChI=1S/C12H15NO2/c1-7-8(2)13-12-10(15-4)6-5-9(14-3)11(7)12/h5-6,13H,1-4H3	TXUCJSRUALPKHM-UHFFFAOYSA-N	205.11027873							107773
T0511-4881	LSM-19151	SID3712243, BRD-K61055471	2403583	InChI=1S/C19H21N3O3S/c1-3-4-10-20-17(23)12-25-19(24)16-11-15-13(2)21-22(18(15)26-16)14-8-6-5-7-9-14/h5-9,11H,3-4,10,12H2,1-2H3,(H,20,23)	BPSBWFCKMLDGLC-UHFFFAOYSA-N	CCCCNC(=O)COC(=O)c1cc2c(C)nn(c3ccccc3)c2s1	BroadT	BRD-K61055471	BRD-K61055471-001-05-4	Enamine Ltd.	T0511-4881			CCCCNC(=O)COC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1	InChI=1S/C19H21N3O3S/c1-3-4-10-20-17(23)12-25-19(24)16-11-15-13(2)21-22(18(15)26-16)14-8-6-5-7-9-14/h5-9,11H,3-4,10,12H2,1-2H3,(H,20,23)	BPSBWFCKMLDGLC-UHFFFAOYSA-N	371.130362252							107774
ST50111575	LSM-19152	SID14723910, BRD-K91804968	2147601	InChI=1S/C19H17NO4/c1-22-15-9-7-14(8-10-15)20-19(21)18-12-11-17(24-18)13-23-16-5-3-2-4-6-16/h2-12H,13H2,1H3,(H,20,21)	VSUUINVWYMYQJO-UHFFFAOYSA-N	COc1ccc(NC(=O)c2oc(COc3ccccc3)cc2)cc1	BroadT	BRD-K91804968	BRD-K91804968-001-05-9	Asinex Ltd.	BAS 09668190			COc1ccc(cc1)NC(=O)c1ccc(COc2ccccc2)o1	InChI=1S/C19H17NO4/c1-22-15-9-7-14(8-10-15)20-19(21)18-12-11-17(24-18)13-23-16-5-3-2-4-6-16/h2-12H,13H2,1H3,(H,20,21)	VSUUINVWYMYQJO-UHFFFAOYSA-N	323.115758034							107775
AC1LGI8T	LSM-19153	BRD-K74406422	771743	InChI=1S/C18H15N3O2/c1-2-9-21-15-6-4-3-5-14(15)20-18(21)19-11-13-7-8-16-17(10-13)23-12-22-16/h2-8,10-11H,1,9,12H2	DOEIFGVWGAWEPM-UHFFFAOYSA-N	C=CCn1c(N=Cc2ccc3OCOc3c2)nc4ccccc14	BroadT	BRD-K74406422	BRD-K74406422-001-05-4	Asinex Ltd.	BAS 00619249			C=CCn1c(N=Cc2ccc3OCOc3c2)nc2ccccc12	InChI=1S/C18H15N3O2/c1-2-9-21-15-6-4-3-5-14(15)20-18(21)19-11-13-7-8-16-17(10-13)23-12-22-16/h2-8,10-11H,1,9,12H2	DOEIFGVWGAWEPM-UHFFFAOYSA-N	305.11642675							107776
N1-(4-Chlorophenyl)-2-({4-methyl-5-[4-methyl-2-(5-methylisoxazol-3-yl)-1,3-thiazol-5-yl]-4H-1,2,4-triazol-3-yl}thio)acetamide	LSM-19154	SID26730419, BRD-K06967750	2745785	InChI=1S/C19H17ClN6O2S2/c1-10-8-14(25-28-10)18-21-11(2)16(30-18)17-23-24-19(26(17)3)29-9-15(27)22-13-6-4-12(20)5-7-13/h4-8H,9H2,1-3H3,(H,22,27)	QFIMJCJTRRRKAY-UHFFFAOYSA-N	Cc1onc(c1)c2nc(C)c(s2)c3nnc(SCC(=O)Nc4ccc(Cl)cc4)n3C	BroadT	BRD-K06967750	BRD-K06967750-001-04-3	Maybridge	SPB 05325			Cc1cc(no1)-c1nc(C)c(s1)-c1nnc(SCC(=O)Nc2ccc(Cl)cc2)n1C	InChI=1S/C19H17ClN6O2S2/c1-10-8-14(25-28-10)18-21-11(2)16(30-18)17-23-24-19(26(17)3)29-9-15(27)22-13-6-4-12(20)5-7-13/h4-8H,9H2,1-3H3,(H,22,27)	QFIMJCJTRRRKAY-UHFFFAOYSA-N	460.054292934							107777
1-(Adamantan-1-yl)-1H-imidazole	LSM-19155	SID857401, BRD-K28756469	323381	InChI=1S/C13H18N2/c1-2-15(9-14-1)13-6-10-3-11(7-13)5-12(4-10)8-13/h1-2,9-12H,3-8H2	PJWXDQVZZXNUQF-UHFFFAOYSA-N	C1C2CC3CC1CC(C3)(C2)n4ccnc4	BroadT	BRD-K28756469	BRD-K28756469-001-05-3	InterBioScreen Ltd.	STOCK1S-63806			C1C2CC3CC1CC(C2)(C3)n1ccnc1	InChI=1S/C13H18N2/c1-2-15(9-14-1)13-6-10-3-11(7-13)5-12(4-10)8-13/h1-2,9-12H,3-8H2	PJWXDQVZZXNUQF-UHFFFAOYSA-N	202.146998596							107778
MLS000093993	LSM-19156	SID4250760, BRD-A05414272	3244526	InChI=1S/C21H24N4O4/c1-4-19-23-25(21(27)17-12-18-16(24(17)19)9-11-29-18)14(3)20(26)22-13(2)7-8-15-6-5-10-28-15/h5-6,9-14H,4,7-8H2,1-3H3,(H,22,26)	QBDMSRDFZMFARG-UHFFFAOYSA-N	CCC1=NN(C(C)C(=O)NC(C)CCc2occc2)C(=O)c3cc4occc4n13	BroadT	BRD-A05414272	BRD-A05414272-001-06-3	ChemDiv Inc.	C887-1152			CCc1nn(C(C)C(=O)NC(C)CCc2ccco2)c(=O)c2cc3occc3n12	InChI=1S/C21H24N4O4/c1-4-19-23-25(21(27)17-12-18-16(24(17)19)9-11-29-18)14(3)20(26)22-13(2)7-8-15-6-5-10-28-15/h5-6,9-14H,4,7-8H2,1-3H3,(H,22,26)	QBDMSRDFZMFARG-UHFFFAOYSA-N	396.179755288							107779
CHEMBL179024	LSM-19157	SID4263093, BRD-K02160136	788751	InChI=1S/C13H11NO5/c1-7-2-5-11(19-7)12(16)14-8-3-4-10(15)9(6-8)13(17)18/h2-6,15H,1H3,(H,14,16)(H,17,18)	OJNUJVDZJSIQQK-UHFFFAOYSA-N	Cc1oc(cc1)C(=O)Nc2ccc(O)c(c2)C(=O)O	BroadT	BRD-K02160136	BRD-K02160136-001-05-1	ChemBridge Corporation	6154382			Cc1ccc(o1)C(=O)Nc1ccc(O)c(c1)C(O)=O	InChI=1S/C13H11NO5/c1-7-2-5-11(19-7)12(16)14-8-3-4-10(15)9(6-8)13(17)18/h2-6,15H,1H3,(H,14,16)(H,17,18)	OJNUJVDZJSIQQK-UHFFFAOYSA-N	261.063722462							107780
MLS001202696	LSM-19158	SID49641196, BRD-K18170780	844046	InChI=1S/C11H7ClN2O4/c12-7-3-1-2-4-8(7)13-11(15)9-5-6-10(18-9)14(16)17/h1-6H,(H,13,15)	DBSXHMSKBNARHR-UHFFFAOYSA-N	[O-][N+](=O)c1oc(cc1)C(=O)Nc2ccccc2Cl	BroadT	BRD-K18170780	BRD-K18170780-001-06-9	Asinex Ltd.	BAS 00018145			[O-][N+](=O)c1ccc(o1)C(=O)Nc1ccccc1Cl	InChI=1S/C11H7ClN2O4/c12-7-3-1-2-4-8(7)13-11(15)9-5-6-10(18-9)14(16)17/h1-6H,(H,13,15)	DBSXHMSKBNARHR-UHFFFAOYSA-N	266.009434434							107781
AC1M39HZ	LSM-43820	SID17413976, BRD-K72363785	2185437	InChI=1S/C22H21N3O5/c26-20(24-10-12-29-13-11-24)15-30-19-9-5-4-6-16(19)14-18-21(27)23-25(22(18)28)17-7-2-1-3-8-17/h1-9,14H,10-13,15H2,(H,23,27)/b18-14-	MRLJBASOVPJJIA-JXAWBTAJSA-N	O=C(COc1ccccc1\C=C/2\C(=O)NN(C2=O)c3ccccc3)N4CCOCC4	BroadT	BRD-K72363785	BRD-K72363785-001-05-0	ChemBridge Corporation	7356454			O=C(COc1ccccc1\C=C1\C(=O)NN(C1=O)c1ccccc1)N1CCOCC1	InChI=1S/C22H21N3O5/c26-20(24-10-12-29-13-11-24)15-30-19-9-5-4-6-16(19)14-18-21(27)23-25(22(18)28)17-7-2-1-3-8-17/h1-9,14H,10-13,15H2,(H,23,27)/b18-14-	MRLJBASOVPJJIA-JXAWBTAJSA-N	407.148120802							
T5257878	LSM-19160	SID3712126, BRD-A96221029	2997899	InChI=1S/C22H25N3O3S2/c1-24(18-12-14-30(27,28)16-18)21(26)15-29-22-23-19-9-5-6-10-20(19)25(22)13-11-17-7-3-2-4-8-17/h2-10,18H,11-16H2,1H3	DJKAYBDAVYLRCG-UHFFFAOYSA-N	CN(C1CCS(=O)(=O)C1)C(=O)CSc2nc3ccccc3n2CCc4ccccc4	BroadT	BRD-A96221029	BRD-A96221029-001-05-0	Enamine Ltd.	T5257878			CN(C1CCS(=O)(=O)C1)C(=O)CSc1nc2ccccc2n1CCc1ccccc1	InChI=1S/C22H25N3O3S2/c1-24(18-12-14-30(27,28)16-18)21(26)15-29-22-23-19-9-5-6-10-20(19)25(22)13-11-17-7-3-2-4-8-17/h2-10,18H,11-16H2,1H3	DJKAYBDAVYLRCG-UHFFFAOYSA-N	443.13373307							107783
AN-698/41761252	LSM-19161	SID4259100, BRD-K59046064	1021267	InChI=1S/C19H26N4O2S/c1-23-17(12-14-8-10-16(25-2)11-9-14)21-22-19(23)26-13-18(24)20-15-6-4-3-5-7-15/h8-11,15H,3-7,12-13H2,1-2H3,(H,20,24)	UKAZHRMYRPVMJF-UHFFFAOYSA-N	COc1ccc(Cc2nnc(SCC(=O)NC3CCCCC3)n2C)cc1	BroadT	BRD-K59046064	BRD-K59046064-001-06-8	ChemBridge Corporation	7513433			COc1ccc(Cc2nnc(SCC(=O)NC3CCCCC3)n2C)cc1	InChI=1S/C19H26N4O2S/c1-23-17(12-14-8-10-16(25-2)11-9-14)21-22-19(23)26-13-18(24)20-15-6-4-3-5-7-15/h8-11,15H,3-7,12-13H2,1-2H3,(H,20,24)	UKAZHRMYRPVMJF-UHFFFAOYSA-N	374.177646802							107784
BAS 09590668	LSM-19162	SID26667547, SID844292, BRD-K29165406	646612	InChI=1S/C19H18N2O6/c1-2-25-19(24)16-9-7-12(27-16)11-26-17(22)10-8-15-18(23)21-14-6-4-3-5-13(14)20-15/h3-7,9H,2,8,10-11H2,1H3,(H,21,23)	SGTQUPZGIHJJBN-UHFFFAOYSA-N	CCOC(=O)c1oc(COC(=O)CCc2nc3ccccc3nc2O)cc1	BroadT	BRD-K29165406	BRD-K29165406-001-05-2	Asinex Ltd.	BAS 09590668			CCOC(=O)c1ccc(COC(=O)CCc2nc3ccccc3nc2O)o1	InChI=1S/C19H18N2O6/c1-2-25-19(24)16-9-7-12(27-16)11-26-17(22)10-8-15-18(23)21-14-6-4-3-5-13(14)20-15/h3-7,9H,2,8,10-11H2,1H3,(H,21,23)	SGTQUPZGIHJJBN-UHFFFAOYSA-N	370.116486316							107785
N-[4-(Diethylamino)phenyl]-2-furamide	LSM-19163	SID4263889, BRD-K06654104	675057	InChI=1S/C15H18N2O2/c1-3-17(4-2)13-9-7-12(8-10-13)16-15(18)14-6-5-11-19-14/h5-11H,3-4H2,1-2H3,(H,16,18)	MTRAVDMFUGBQBM-UHFFFAOYSA-N	CCN(CC)c1ccc(NC(=O)c2occc2)cc1	BroadT	BRD-K06654104	BRD-K06654104-001-05-7	ChemBridge Corporation	5617737			CCN(CC)c1ccc(NC(=O)c2ccco2)cc1	InChI=1S/C15H18N2O2/c1-3-17(4-2)13-9-7-12(8-10-13)16-15(18)14-6-5-11-19-14/h5-11H,3-4H2,1-2H3,(H,16,18)	MTRAVDMFUGBQBM-UHFFFAOYSA-N	258.136827836							107786
T0518-5304	LSM-19164	SID24836823, BRD-K70838267	2460071	InChI=1S/C23H27N5O3/c1-17-22(23(31)28(25(17)2)19-6-4-3-5-7-19)24-21(30)16-26-12-14-27(15-13-26)18-8-10-20(29)11-9-18/h3-11,29H,12-16H2,1-2H3,(H,24,30)	ZFIBYOSRRUDOFA-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)NC(=O)CN2CCN(CC2)c3ccc(O)cc3)c4ccccc4	BroadT	BRD-K70838267	BRD-K70838267-001-06-8	Enamine Ltd.	T0518-5304			Cc1c(NC(=O)CN2CCN(CC2)c2ccc(O)cc2)c(=O)n(-c2ccccc2)n1C	InChI=1S/C23H27N5O3/c1-17-22(23(31)28(25(17)2)19-6-4-3-5-7-19)24-21(30)16-26-12-14-27(15-13-26)18-8-10-20(29)11-9-18/h3-11,29H,12-16H2,1-2H3,(H,24,30)	ZFIBYOSRRUDOFA-UHFFFAOYSA-N	421.211389774							107787
BDBM83294	LSM-19165	BRD-A03716992	91898500	InChI=1S/C22H18N4O3S/c1-30-11-10-18(26-21(28)13-6-2-3-7-14(13)22(26)29)19(27)15(12-23)20-24-16-8-4-5-9-17(16)25-20/h2-9,15,18H,10-11H2,1H3,(H,24,25)	NCIAEHGOBWMUEE-UHFFFAOYSA-N	CSCCC(N1C(=O)c2ccccc2C1=O)C(=O)C(C#N)c3nc4ccccc4[nH]3	BroadT	BRD-A03716992	BRD-A03716992-001-04-7	ChemBridge Corporation	6058687			CSCCC(N1C(=O)c2ccccc2C1=O)C(=O)C(C#N)c1nc2ccccc2[nH]1	InChI=1S/C22H18N4O3S/c1-30-11-10-18(26-21(28)13-6-2-3-7-14(13)22(26)29)19(27)15(12-23)20-24-16-8-4-5-9-17(16)25-20/h2-9,15,18H,10-11H2,1H3,(H,24,25)	NCIAEHGOBWMUEE-UHFFFAOYSA-N	418.109961166							107788
MLS000710095	LSM-19166	SID24808938, BRD-K20762254	1128166	InChI=1S/C23H19NO3/c25-21-13-17(23-11-6-12-27-23)14-22(26)19(21)15-24-20-10-5-4-9-18(20)16-7-2-1-3-8-16/h1-12,15,17,24H,13-14H2	ADYXMVASDKFVMG-UHFFFAOYSA-N	O=C1CC(CC(=O)C1=CNc2ccccc2c3ccccc3)c4occc4	BroadT	BRD-K20762254	BRD-K20762254-001-05-8	Asinex Ltd.	BAS 01849581			O=C1CC(CC(=O)C1=CNc1ccccc1-c1ccccc1)c1ccco1	InChI=1S/C23H19NO3/c25-21-13-17(23-11-6-12-27-23)14-22(26)19(21)15-24-20-10-5-4-9-18(20)16-7-2-1-3-8-16/h1-12,15,17,24H,13-14H2	ADYXMVASDKFVMG-UHFFFAOYSA-N	357.136493478							
SMR000065001	LSM-19167	SID3713284, BRD-K84107377	2998354	InChI=1S/C23H28N4O3S2/c1-18(2)16-27-21-11-7-6-10-20(21)24-23(27)31-17-22(28)25-12-14-26(15-13-25)32(29,30)19-8-4-3-5-9-19/h3-11,18H,12-17H2,1-2H3	VKTXJWZOKWXDQS-UHFFFAOYSA-N	CC(C)Cn1c(SCC(=O)N2CCN(CC2)S(=O)(=O)c3ccccc3)nc4ccccc14	BroadT	BRD-K84107377	BRD-K84107377-001-05-1	Enamine Ltd.	ZT-3458693			CC(C)Cn1c(SCC(=O)N2CCN(CC2)S(=O)(=O)c2ccccc2)nc2ccccc12	InChI=1S/C23H28N4O3S2/c1-18(2)16-27-21-11-7-6-10-20(21)24-23(27)31-17-22(28)25-12-14-26(15-13-25)32(29,30)19-8-4-3-5-9-19/h3-11,18H,12-17H2,1-2H3	VKTXJWZOKWXDQS-UHFFFAOYSA-N	472.160282176							107790
MLS001163594	LSM-43821	SID47196397, BRD-K10528496	1596435	InChI=1S/C25H23N3O4S2/c1-16(2)15-32-20-10-8-17(9-11-20)23-18(13-28(26-23)19-6-4-3-5-7-19)12-21-24(31)27(14-22(29)30)25(33)34-21/h3-13,16H,14-15H2,1-2H3,(H,29,30)/b21-12+	SALDPLRWBABLIU-CIAFOILYSA-N	CC(C)COc1ccc(cc1)c2nn(cc2\C=C/3\SC(=S)N(CC(=O)O)C3=O)c4ccccc4	BroadT	BRD-K10528496	BRD-K10528496-001-07-9	ChemBridge Corporation	7105681			CC(C)COc1ccc(cc1)-c1nn(cc1\C=C1\SC(=S)N(CC(O)=O)C1=O)-c1ccccc1	InChI=1S/C25H23N3O4S2/c1-16(2)15-32-20-10-8-17(9-11-20)23-18(13-28(26-23)19-6-4-3-5-7-19)12-21-24(31)27(14-22(29)30)25(33)34-21/h3-13,16H,14-15H2,1-2H3,(H,29,30)/b21-12+	SALDPLRWBABLIU-CIAFOILYSA-N	493.112997626							
SMR000028655	LSM-19169	SID4249125, BRD-K01294136	3243119	InChI=1S/C20H21N3O5S2/c1-2-27-20(26)16-13-21-23(7-8-28-18(25)12-15-6-4-10-30-15)19(16)22-17(24)11-14-5-3-9-29-14/h3-6,9-10,13H,2,7-8,11-12H2,1H3,(H,22,24)	MAHQKZVKHHRXNA-UHFFFAOYSA-N	CCOC(=O)c1cnn(CCOC(=O)Cc2cccs2)c1NC(=O)Cc3cccs3	BroadT	BRD-K01294136	BRD-K01294136-001-05-9	ChemDiv Inc.	C691-0054			CCOC(=O)c1cnn(CCOC(=O)Cc2cccs2)c1NC(=O)Cc1cccs1	InChI=1S/C20H21N3O5S2/c1-2-27-20(26)16-13-21-23(7-8-28-18(25)12-15-6-4-10-30-15)19(16)22-17(24)11-14-5-3-9-29-14/h3-6,9-10,13H,2,7-8,11-12H2,1H3,(H,22,24)	MAHQKZVKHHRXNA-UHFFFAOYSA-N	447.092262182							107792
SMR000197658	LSM-43822	SID17433418, BRD-K24301999	896591	InChI=1S/C17H13ClN2O2/c18-15-7-5-13(6-8-15)11-19-12-14(9-10-20(21)22)16-3-1-2-4-17(16)19/h1-10,12H,11H2/b10-9+	XTVWWLOLKMTJML-MDZDMXLPSA-N	[O-][N+](=O)\C=C\c1cn(Cc2ccc(Cl)cc2)c3ccccc13	BroadT	BRD-K24301999	BRD-K24301999-001-08-5	ChemBridge Corporation	7233903			[O-][N+](=O)\C=C\c1cn(Cc2ccc(Cl)cc2)c2ccccc12	InChI=1S/C17H13ClN2O2/c18-15-7-5-13(6-8-15)11-19-12-14(9-10-20(21)22)16-3-1-2-4-17(16)19/h1-10,12H,11H2/b10-9+	XTVWWLOLKMTJML-MDZDMXLPSA-N	312.066555386							
SMR000243278	LSM-19171	SID24791240, BRD-K32125060	4326009	InChI=1S/C24H23N3O4S2/c1-14-4-8-19(16(3)10-14)27-33(30,31)22-12-18(7-5-15(22)2)25-24(29)17-6-9-21-20(11-17)26-23(28)13-32-21/h4-12,27H,13H2,1-3H3,(H,25,29)(H,26,28)	DZYNUOWTXHENGY-UHFFFAOYSA-N	Cc1ccc(NS(=O)(=O)c2cc(NC(=O)c3ccc4SCC(=O)Nc4c3)ccc2C)c(C)c1	BroadT	BRD-K32125060	BRD-K32125060-001-05-8	Enamine Ltd.	T5238063			Cc1ccc(NS(=O)(=O)c2cc(NC(=O)c3ccc4SCC(=O)Nc4c3)ccc2C)c(C)c1	InChI=1S/C24H23N3O4S2/c1-14-4-8-19(16(3)10-14)27-33(30,31)22-12-18(7-5-15(22)2)25-24(29)17-6-9-21-20(11-17)26-23(28)13-32-21/h4-12,27H,13H2,1-3H3,(H,25,29)(H,26,28)	DZYNUOWTXHENGY-UHFFFAOYSA-N	481.112997626							107794
MLS000548715	LSM-19172	SID17505118, BRD-K94361931	1432763	InChI=1S/C24H23N5O3S2/c30-22(26-18-8-10-19(11-9-18)34(31,32)29-13-3-4-14-29)16-33-23-12-7-17(15-25-23)24-27-20-5-1-2-6-21(20)28-24/h1-2,5-12,15H,3-4,13-14,16H2,(H,26,30)(H,27,28)	WZRCNNQIJZERPW-UHFFFAOYSA-N	O=C(CSc1ccc(cn1)c2nc3ccccc3[nH]2)Nc4ccc(cc4)S(=O)(=O)N5CCCC5	BroadT	BRD-K94361931	BRD-K94361931-001-05-1	Asinex Ltd.	ASN 07185446			O=C(CSc1ccc(cn1)-c1nc2ccccc2[nH]1)Nc1ccc(cc1)S(=O)(=O)N1CCCC1	InChI=1S/C24H23N5O3S2/c30-22(26-18-8-10-19(11-9-18)34(31,32)29-13-3-4-14-29)16-33-23-12-7-17(15-25-23)24-27-20-5-1-2-6-21(20)28-24/h1-2,5-12,15H,3-4,13-14,16H2,(H,26,30)(H,27,28)	WZRCNNQIJZERPW-UHFFFAOYSA-N	493.124231026							107795
AC1LUHJ9	LSM-15496	BRD-K85239482	1631216	InChI=1S/C18H16ClNO2/c19-14-7-8-17-15(11-14)16(20-9-4-10-21)12-18(22-17)13-5-2-1-3-6-13/h1-3,5-8,11-12,21H,4,9-10H2	SJHQERKLAJQWIZ-UHFFFAOYSA-N	OCCCN=C1C=C(Oc2ccc(Cl)cc12)c3ccccc3	BroadT	BRD-K85239482	BRD-K85239482-245-05-6	ChemDiv Inc.	6197-5099		F[B-](F)(F)F	OCCCN=c1cc(oc2ccc(Cl)cc12)-c1ccccc1.F[B-](F)(F)F	InChI=1S/C18H16ClNO2.BF4/c19-14-7-8-17-15(11-14)16(20-9-4-10-21)12-18(22-17)13-5-2-1-3-6-13;2-1(3,4)5/h1-3,5-8,11-12,21H,4,9-10H2;/q;-1	KZDQTKDFDHWOAJ-UHFFFAOYSA-N	313.086956472							104137, 104137
F0593-0163	LSM-19173	SID51085275, BRD-K12719224	2155679	InChI=1S/C19H20N4O4S/c1-3-23(13-15-7-5-4-6-8-15)28(25,26)17-11-9-16(10-12-17)18(24)20-19-22-21-14(2)27-19/h4-12H,3,13H2,1-2H3,(H,20,22,24)	MDTNSUYILIPXHT-UHFFFAOYSA-N	CCN(Cc1ccccc1)S(=O)(=O)c2ccc(cc2)C(=O)Nc3oc(C)nn3	BroadT	BRD-K12719224	BRD-K12719224-001-05-5	Life Chemicals Inc.	F0593-0163			CCN(Cc1ccccc1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(C)o1	InChI=1S/C19H20N4O4S/c1-3-23(13-15-7-5-4-6-8-15)28(25,26)17-11-9-16(10-12-17)18(24)20-19-22-21-14(2)27-19/h4-12H,3,13H2,1-2H3,(H,20,22,24)	MDTNSUYILIPXHT-UHFFFAOYSA-N	400.12052585							107796
MLS000684170	LSM-19174	SID24794788, BRD-K33408811	1245133	InChI=1S/C17H20N2O4S/c1-9(2)13-8-11(15(18)20)17(24-13)19-16(21)10-6-5-7-12(22-3)14(10)23-4/h5-9H,1-4H3,(H2,18,20)(H,19,21)	RFVPUIBACZPPEE-UHFFFAOYSA-N	COc1cccc(C(=O)Nc2sc(cc2C(=O)N)C(C)C)c1OC	BroadT	BRD-K33408811	BRD-K33408811-001-06-7	ChemBridge Corporation	7944503			COc1cccc(C(=O)Nc2sc(cc2C(N)=O)C(C)C)c1OC	InChI=1S/C17H20N2O4S/c1-9(2)13-8-11(15(18)20)17(24-13)19-16(21)10-6-5-7-12(22-3)14(10)23-4/h5-9H,1-4H3,(H2,18,20)(H,19,21)	RFVPUIBACZPPEE-UHFFFAOYSA-N	348.11437783							107797
MLS000888829	LSM-19175	SID26670058, BRD-K65378652	16682614	InChI=1S/C19H17F6N3/c20-18(21,22)14-8-12(9-15(10-14)19(23,24)25)6-7-28-16(11-27-17(28)26)13-4-2-1-3-5-13/h1-5,8-10,16H,6-7,11H2,(H2,26,27)/t16-/m1/s1	OZEUINYTNRPMMX-MRXNPFEDSA-N	NC1=NC[C@@H](N1CCc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c3ccccc3	BroadT	BRD-K65378652	BRD-K65378652-001-05-7	Torrey Pines Institute for Molecular Studies	1656-83			NC1=NC[C@@H](N1CCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1ccccc1	InChI=1S/C19H17F6N3/c20-18(21,22)14-8-12(9-15(10-14)19(23,24)25)6-7-28-16(11-27-17(28)26)13-4-2-1-3-5-13/h1-5,8-10,16H,6-7,11H2,(H2,26,27)/t16-/m1/s1	OZEUINYTNRPMMX-MRXNPFEDSA-N	401.132666774							107798
Diamthazole	LSM-15287	Diamthazole, Dimazole	8708	InChI=1S/C15H23N3OS/c1-5-18(6-2)9-10-19-12-7-8-13-14(11-12)20-15(16-13)17(3)4/h7-8,11H,5-6,9-10H2,1-4H3	WGMYEOIMVYADRJ-UHFFFAOYSA-N	CCN(CC)CCOc1ccc2nc(sc2c1)N(C)C	BroadT	BRD-K03978601	BRD-K03978601-003-05-7	InterBioScreen Ltd.	STOCK1S-45555		Cl	CCN(CC)CCOc1ccc2nc(sc2c1)N(C)C.Cl	InChI=1S/C15H23N3OS.ClH/c1-5-18(6-2)9-10-19-12-7-8-13-14(11-12)20-15(16-13)17(3)4;/h7-8,11H,5-6,9-10H2,1-4H3;1H	LYMNPRAIEYTRSZ-UHFFFAOYSA-N	293.156183076							103934, 103934, 103934
MLS000099852	LSM-19176	SID4257937, BRD-K57901061	1964281	InChI=1S/C14H9N7S2/c1-2-5-10-9(4-1)15-19-20(10)8-12-16-17-14-21(12)18-13(23-14)11-6-3-7-22-11/h1-7H,8H2	NMKZIRPXNGHTMZ-UHFFFAOYSA-N	C(c1nnc2sc(nn12)c3cccs3)n4nnc5ccccc45	BroadT	BRD-K57901061	BRD-K57901061-001-06-9	ChemBridge Corporation	7950290			C(c1nnc2sc(nn12)-c1cccs1)n1nnc2ccccc12	InChI=1S/C14H9N7S2/c1-2-5-10-9(4-1)15-19-20(10)8-12-16-17-14-21(12)18-13(23-14)11-6-3-7-22-11/h1-7H,8H2	NMKZIRPXNGHTMZ-UHFFFAOYSA-N	339.036084738							107799
MLS000521292	LSM-19177	SID14735619, BRD-K90002972	5070905	InChI=1S/C20H14BrN3O3/c1-12-4-2-3-5-15(12)20-23-18(24-27-20)13-6-8-14(9-7-13)22-19(25)16-10-11-17(21)26-16/h2-11H,1H3,(H,22,25)	OBPNRGGUFSHYKJ-UHFFFAOYSA-N	Cc1ccccc1c2onc(n2)c3ccc(NC(=O)c4oc(Br)cc4)cc3	BroadT	BRD-K90002972	BRD-K90002972-001-05-5	ChemDiv Inc.	K907-0003			Cc1ccccc1-c1nc(no1)-c1ccc(NC(=O)c2ccc(Br)o2)cc1	InChI=1S/C20H14BrN3O3/c1-12-4-2-3-5-15(12)20-23-18(24-27-20)13-6-8-14(9-7-13)22-19(25)16-10-11-17(21)26-16/h2-11H,1H3,(H,22,25)	OBPNRGGUFSHYKJ-UHFFFAOYSA-N	423.021853938							107800
SMR000107481	LSM-19178	SID7975575, BRD-K26618362	2247967	InChI=1S/C17H18O5/c1-5-8-20-15(18)9-21-14-7-6-13-10(2)11(3)17(19)22-16(13)12(14)4/h5-7H,1,8-9H2,2-4H3	XMLQMAOHZGXAPK-UHFFFAOYSA-N	CC1=C(C)c2ccc(OCC(=O)OCC=C)c(C)c2OC1=O	BroadT	BRD-K26618362	BRD-K26618362-001-05-5	ChemBridge Corporation	6656277			Cc1c(OCC(=O)OCC=C)ccc2c(C)c(C)c(=O)oc12	InChI=1S/C17H18O5/c1-5-8-20-15(18)9-21-14-7-6-13-10(2)11(3)17(19)22-16(13)12(14)4/h5-7H,1,8-9H2,2-4H3	XMLQMAOHZGXAPK-UHFFFAOYSA-N	302.115423676							107801
SMR000105568	LSM-19179	SID7975490, BRD-K49297100	798569	InChI=1S/C18H18FN3O3/c1-3-25-17(23)9-8-14-11(2)20-16-10-15(21-22(16)18(14)24)12-4-6-13(19)7-5-12/h4-7,10,24H,3,8-9H2,1-2H3	GMUWJDBLXSXTNZ-UHFFFAOYSA-N	CCOC(=O)CCc1c(C)nc2cc(nn2c1O)c3ccc(F)cc3	BroadT	BRD-K49297100	BRD-K49297100-001-05-8	ChemBridge Corporation	6046786			CCOC(=O)CCc1c(C)nc2cc(nn2c1O)-c1ccc(F)cc1	InChI=1S/C18H18FN3O3/c1-3-25-17(23)9-8-14-11(2)20-16-10-15(21-22(16)18(14)24)12-4-6-13(19)7-5-12/h4-7,10,24H,3,8-9H2,1-2H3	GMUWJDBLXSXTNZ-UHFFFAOYSA-N	343.133219666							
T5289346	LSM-19180	SID24825145, BRD-K48319737	2503365	InChI=1S/C15H17FN2OS2/c1-15(2,3)18-13(19)9-21-14-17-12(8-20-14)10-4-6-11(16)7-5-10/h4-8H,9H2,1-3H3,(H,18,19)	DYGLRIZMSKMDGS-UHFFFAOYSA-N	CC(C)(C)NC(=O)CSc1nc(cs1)c2ccc(F)cc2	BroadT	BRD-K48319737	BRD-K48319737-001-05-2	Enamine Ltd.	T5289346			CC(C)(C)NC(=O)CSc1nc(cs1)-c1ccc(F)cc1	InChI=1S/C15H17FN2OS2/c1-15(2,3)18-13(19)9-21-14-17-12(8-20-14)10-4-6-11(16)7-5-10/h4-8H,9H2,1-3H3,(H,18,19)	DYGLRIZMSKMDGS-UHFFFAOYSA-N	324.076632764							107803
5-(4-Fluorophenyl)-1-(4-methoxyphenyl)-3-[(4-methoxyphenyl)amino]-1,5-dihydro-2H-pyrrol-2-one	LSM-19181	SID22415484, BRD-A49235256	2920816	InChI=1S/C24H21FN2O3/c1-29-20-11-7-18(8-12-20)26-22-15-23(16-3-5-17(25)6-4-16)27(24(22)28)19-9-13-21(30-2)14-10-19/h3-15,23,26H,1-2H3	IXTHZNVFHVOHAR-UHFFFAOYSA-N	COc1ccc(NC2=CC(N(C2=O)c3ccc(OC)cc3)c4ccc(F)cc4)cc1	BroadT	BRD-A49235256	BRD-A49235256-001-05-2	ChemBridge Corporation	6961993			COc1ccc(NC2=CC(N(C2=O)c2ccc(OC)cc2)c2ccc(F)cc2)cc1	InChI=1S/C24H21FN2O3/c1-29-20-11-7-18(8-12-20)26-22-15-23(16-3-5-17(25)6-4-16)27(24(22)28)19-9-13-21(30-2)14-10-19/h3-15,23,26H,1-2H3	IXTHZNVFHVOHAR-UHFFFAOYSA-N	404.153620752							107804
AC1NGIO8	LSM-19182	BRD-A63004667	4750224	InChI=1S/C24H23N3O5/c28-22(19-14-16-4-1-2-6-18(16)32-19)20-21(17-5-3-7-25-15-17)27(24(30)23(20)29)9-8-26-10-12-31-13-11-26/h1-7,14-15,20-21H,8-13H2	QWQKTOVSCAIBMY-UHFFFAOYSA-N	O=C(C1C(N(CCN2CCOCC2)C(=O)C1=O)c3cccnc3)c4oc5ccccc5c4	BroadT	BRD-A63004667	BRD-A63004667-001-04-9	InterBioScreen Ltd.	STOCK3S-93236			O=C(C1C(N(CCN2CCOCC2)C(=O)C1=O)c1cccnc1)c1cc2ccccc2o1	InChI=1S/C24H23N3O5/c28-22(19-14-16-4-1-2-6-18(16)32-19)20-21(17-5-3-7-25-15-17)27(24(30)23(20)29)9-8-26-10-12-31-13-11-26/h1-7,14-15,20-21H,8-13H2	QWQKTOVSCAIBMY-UHFFFAOYSA-N	433.163770866							107805
MLS000526755	LSM-19183	SID14725185, BRD-K59061227	1111037	InChI=1S/C29H24F3N5OS/c30-29(31,32)25-18-23(24-12-7-17-39-24)34-27-22(19-33-37(25)27)28(38)36-15-13-35(14-16-36)26(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-12,17-19,26H,13-16H2	PRONAQWXGYDKCB-UHFFFAOYSA-N	FC(F)(F)c1cc(nc2c(cnn12)C(=O)N3CCN(CC3)C(c4ccccc4)c5ccccc5)c6cccs6	BroadT	BRD-K59061227	BRD-K59061227-001-05-3	Asinex Ltd.	BAS 00923994			FC(F)(F)c1cc(nc2c(cnn12)C(=O)N1CCN(CC1)C(c1ccccc1)c1ccccc1)-c1cccs1	InChI=1S/C29H24F3N5OS/c30-29(31,32)25-18-23(24-12-7-17-39-24)34-27-22(19-33-37(25)27)28(38)36-15-13-35(14-16-36)26(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-12,17-19,26H,13-16H2	PRONAQWXGYDKCB-UHFFFAOYSA-N	547.165365728							107806
MLS000098668	LSM-19184	SID3717220, BRD-K58497506	2572574	InChI=1S/C16H12N4OS/c1-2-6-12(7-3-1)13-10-17-15(21-13)11-22-16-19-18-14-8-4-5-9-20(14)16/h1-10H,11H2	XDFCSTPYQSTIRQ-UHFFFAOYSA-N	C(Sc1nnc2ccccn12)c3oc(cn3)c4ccccc4	BroadT	BRD-K58497506	BRD-K58497506-001-05-2	Enamine Ltd.	T5347221			C(Sc1nnc2ccccn12)c1ncc(o1)-c1ccccc1	InChI=1S/C16H12N4OS/c1-2-6-12(7-3-1)13-10-17-15(21-13)11-22-16-19-18-14-8-4-5-9-20(14)16/h1-10H,11H2	XDFCSTPYQSTIRQ-UHFFFAOYSA-N	308.073181734							107807
SMR000060621	LSM-19185	SID24840100, SID3715351, BRD-K14420893	2999169	InChI=1S/C24H22N5PS/c1-4-27-15-13-25-23(27)30(31,24-26-14-16-28(24)5-2)18-11-12-22-20(17-18)19-9-7-8-10-21(19)29(22)6-3/h4-5,7-17H,1-2,6H2,3H3	VAIWXADYRRVRQU-UHFFFAOYSA-N	CCn1c2ccccc2c3cc(ccc13)P(=S)(c4nccn4C=C)c5nccn5C=C	BroadT	BRD-K14420893	BRD-K14420893-001-06-6	Enamine Ltd.	T0504-2577			CCn1c2ccccc2c2cc(ccc12)P(=S)(c1nccn1C=C)c1nccn1C=C	InChI=1S/C24H22N5PS/c1-4-27-15-13-25-23(27)30(31,24-26-14-16-28(24)5-2)18-11-12-22-20(17-18)19-9-7-8-10-21(19)29(22)6-3/h4-5,7-17H,1-2,6H2,3H3	VAIWXADYRRVRQU-UHFFFAOYSA-N	443.133352954							107808
T5263329	LSM-19186	SID3717830, BRD-K18126494	2085812	InChI=1S/C20H17N3O4/c24-18-13-7-1-2-8-14(13)19(25)23(18)11-5-6-12-27-20(26)17-15-9-3-4-10-16(15)21-22-17/h1-4,7-10H,5-6,11-12H2,(H,21,22)	IUMHRUARKLDHBC-UHFFFAOYSA-N	O=C(OCCCCN1C(=O)c2ccccc2C1=O)c3[nH]nc4ccccc34	BroadT	BRD-K18126494	BRD-K18126494-001-05-0	Enamine Ltd.	T5263329			O=C(OCCCCN1C(=O)c2ccccc2C1=O)c1[nH]nc2ccccc12	InChI=1S/C20H17N3O4/c24-18-13-7-1-2-8-14(13)19(25)23(18)11-5-6-12-27-20(26)17-15-9-3-4-10-16(15)21-22-17/h1-4,7-10H,5-6,11-12H2,(H,21,22)	IUMHRUARKLDHBC-UHFFFAOYSA-N	363.121906054							107809
ST50894513	LSM-19187	SID115950058, SID24784316, BRD-K88161155	6464905	InChI=1S/C15H14N2O4/c1-21-13-7-3-6-12(9-13)17-15(20)16-11-5-2-4-10(8-11)14(18)19/h2-9H,1H3,(H,18,19)(H2,16,17,20)	QXLAKZRLCZHBIP-UHFFFAOYSA-N	COc1cccc(NC(=O)Nc2cccc(c2)C(=O)O)c1	BroadT	BRD-K88161155	BRD-K88161155-001-09-4	ChemBridge Corporation	9043406			COc1cccc(NC(=O)Nc2cccc(c2)C(O)=O)c1	InChI=1S/C15H14N2O4/c1-21-13-7-3-6-12(9-13)17-15(20)16-11-5-2-4-10(8-11)14(18)19/h2-9H,1H3,(H,18,19)(H2,16,17,20)	QXLAKZRLCZHBIP-UHFFFAOYSA-N	286.095356948							107810
SMR000159469	LSM-19188	SID17387855, BRD-K53842605	1746062	InChI=1S/C19H18Cl2N4O6/c1-19(2,9-22-17(26)11-3-5-15(24(28)29)13(20)7-11)10-23-18(27)12-4-6-16(25(30)31)14(21)8-12/h3-8H,9-10H2,1-2H3,(H,22,26)(H,23,27)	QMUXASORLUENRK-UHFFFAOYSA-N	CC(C)(CNC(=O)c1ccc(c(Cl)c1)[N+](=O)[O-])CNC(=O)c2ccc(c(Cl)c2)[N+](=O)[O-]	BroadT	BRD-K53842605	BRD-K53842605-001-05-4	Specs	AK-968/15359410			CC(C)(CNC(=O)c1ccc(c(Cl)c1)[N+]([O-])=O)CNC(=O)c1ccc(c(Cl)c1)[N+]([O-])=O	InChI=1S/C19H18Cl2N4O6/c1-19(2,9-22-17(26)11-3-5-15(24(28)29)13(20)7-11)10-23-18(27)12-4-6-16(25(30)31)14(21)8-12/h3-8H,9-10H2,1-2H3,(H,22,26)(H,23,27)	QMUXASORLUENRK-UHFFFAOYSA-N	468.060339756							107811
T5250051	LSM-43823	SID24827775, BRD-K93124351	6158330	InChI=1S/C17H12Cl2N2O2/c18-13-3-1-2-12(8-13)4-7-17(22)23-11-15-10-21-9-14(19)5-6-16(21)20-15/h1-10H,11H2/b7-4+	BSWFIUKXQUULRG-QPJJXVBHSA-N	Clc1cccc(\C=C\C(=O)OCc2cn3cc(Cl)ccc3n2)c1	BroadT	BRD-K93124351	BRD-K93124351-001-05-5	Enamine Ltd.	T5250051			Clc1cccc(\C=C\C(=O)OCc2cn3cc(Cl)ccc3n2)c1	InChI=1S/C17H12Cl2N2O2/c18-13-3-1-2-12(8-13)4-7-17(22)23-11-15-10-21-9-14(19)5-6-16(21)20-15/h1-10H,11H2/b7-4+	BSWFIUKXQUULRG-QPJJXVBHSA-N	346.027583064							
SMR000390896	LSM-1958	SID87219048, SID24838419, BRD-A98248982	3238551	InChI=1S/C26H36N2O5/c1-27(14-12-19-8-10-22(30-2)24(15-19)32-4)26(29)21-7-6-13-28(18-21)17-20-9-11-23(31-3)25(16-20)33-5/h8-11,15-16,21H,6-7,12-14,17-18H2,1-5H3	XJJDWEDQSMGTCV-UHFFFAOYSA-N	COc1ccc(CCN(C)C(=O)C2CCCN(Cc3ccc(OC)c(OC)c3)C2)cc1OC	BroadT	BRD-A98248982	BRD-A98248982-001-08-0	ChemDiv Inc.	5979-0184			COc1ccc(CCN(C)C(=O)C2CCCN(Cc3ccc(OC)c(OC)c3)C2)cc1OC	InChI=1S/C26H36N2O5/c1-27(14-12-19-8-10-22(30-2)24(15-19)32-4)26(29)21-7-6-13-28(18-21)17-20-9-11-23(31-3)25(16-20)33-5/h8-11,15-16,21H,6-7,12-14,17-18H2,1-5H3	XJJDWEDQSMGTCV-UHFFFAOYSA-N	456.262422272							91989, 91989
SMR000071328	LSM-19190	SID4263448, BRD-K15975837	705661	InChI=1S/C17H14O6/c1-10-12(7-15(22-10)17(19)20-2)9-21-13-5-3-11-4-6-16(18)23-14(11)8-13/h3-8H,9H2,1-2H3	KNHUIZIJONLTBX-UHFFFAOYSA-N	COC(=O)c1oc(C)c(COc2ccc3C=CC(=O)Oc3c2)c1	BroadT	BRD-K15975837	BRD-K15975837-001-11-7	ChemBridge Corporation	6802079			COC(=O)c1cc(COc2ccc3ccc(=O)oc3c2)c(C)o1	InChI=1S/C17H14O6/c1-10-12(7-15(22-10)17(19)20-2)9-21-13-5-3-11-4-6-16(18)23-14(11)8-13/h3-8H,9H2,1-2H3	KNHUIZIJONLTBX-UHFFFAOYSA-N	314.079038168							107813
SMR000067010	LSM-19191	BRD-K10118529	2998415	InChI=1S/C13H10N4OS/c1-17-10-4-2-3-5-11(10)19-13(17)16-12(18)9-8-14-6-7-15-9/h2-8H,1H3	AJJVYQIKDIKLAT-UHFFFAOYSA-N	CN1C(=NC(=O)c2cnccn2)Sc3ccccc13	BroadT	BRD-K10118529	BRD-K10118529-001-05-4	Enamine Ltd.	T5247090			Cn1c2ccccc2sc1=NC(=O)c1cnccn1	InChI=1S/C13H10N4OS/c1-17-10-4-2-3-5-11(10)19-13(17)16-12(18)9-8-14-6-7-15-9/h2-8H,1H3	AJJVYQIKDIKLAT-UHFFFAOYSA-N	270.05753167							107814
ST50996656	LSM-19192	SID7977365, BRD-K68390130	2223113	InChI=1S/C14H14BrNO2/c1-10-5-6-14(18-10)13(17)7-8-16-12-4-2-3-11(15)9-12/h2-6,9,16H,7-8H2,1H3	ZROZAJTYIPAJPS-UHFFFAOYSA-N	Cc1oc(cc1)C(=O)CCNc2cccc(Br)c2	BroadT	BRD-K68390130	BRD-K68390130-001-05-1	ChemBridge Corporation	5928170			Cc1ccc(o1)C(=O)CCNc1cccc(Br)c1	InChI=1S/C14H14BrNO2/c1-10-5-6-14(18-10)13(17)7-8-16-12-4-2-3-11(15)9-12/h2-6,9,16H,7-8H2,1H3	ZROZAJTYIPAJPS-UHFFFAOYSA-N	307.020791298							107815
1-(Phenylacetyl)piperidine-4-carboxylic acid	LSM-19193	SID24802029, BRD-K16064228	280747	InChI=1S/C14H17NO3/c16-13(10-11-4-2-1-3-5-11)15-8-6-12(7-9-15)14(17)18/h1-5,12H,6-10H2,(H,17,18)	OTVPLNPLEZXHGE-UHFFFAOYSA-N	OC(=O)C1CCN(CC1)C(=O)Cc2ccccc2	BroadT	BRD-K16064228	BRD-K16064228-001-05-8	Asinex Ltd.	BAS 05272179			OC(=O)C1CCN(CC1)C(=O)Cc1ccccc1	InChI=1S/C14H17NO3/c16-13(10-11-4-2-1-3-5-11)15-8-6-12(7-9-15)14(17)18/h1-5,12H,6-10H2,(H,17,18)	OTVPLNPLEZXHGE-UHFFFAOYSA-N	247.120843414							107816
AG-670/12033003	LSM-19194	SID24782130, BRD-K50094664	823387	InChI=1S/C18H13ClN2O3/c19-14-11-13(20-17(22)12-5-2-1-3-6-12)8-9-15(14)21-18(23)16-7-4-10-24-16/h1-11H,(H,20,22)(H,21,23)	KQCGDUIWZNCAAH-UHFFFAOYSA-N	Clc1cc(NC(=O)c2ccccc2)ccc1NC(=O)c3occc3	BroadT	BRD-K50094664	BRD-K50094664-001-05-3	Asinex Ltd.	BAS 02767510			Clc1cc(NC(=O)c2ccccc2)ccc1NC(=O)c1ccco1	InChI=1S/C18H13ClN2O3/c19-14-11-13(20-17(22)12-5-2-1-3-6-12)8-9-15(14)21-18(23)16-7-4-10-24-16/h1-11H,(H,20,22)(H,21,23)	KQCGDUIWZNCAAH-UHFFFAOYSA-N	340.061470006							107817
SMR000178888	LSM-19195	BRD-A83749070	1475478	InChI=1S/C20H19Cl2F3N2O4S/c1-11(2)31-17-8-16(14(21)7-15(17)22)27-19(29)10-32(30)9-18(28)26-13-5-3-4-12(6-13)20(23,24)25/h3-8,11H,9-10H2,1-2H3,(H,26,28)(H,27,29)	WMAAYJJDFHPBOY-UHFFFAOYSA-N	CC(C)Oc1cc(NC(=O)CS(=O)CC(=O)Nc2cccc(c2)C(F)(F)F)c(Cl)cc1Cl	BroadT	BRD-A83749070	BRD-A83749070-001-05-3	Key Organics Ltd.	10L-337S			CC(C)Oc1cc(NC(=O)CS(=O)CC(=O)Nc2cccc(c2)C(F)(F)F)c(Cl)cc1Cl	InChI=1S/C20H19Cl2F3N2O4S/c1-11(2)31-17-8-16(14(21)7-15(17)22)27-19(29)10-32(30)9-18(28)26-13-5-3-4-12(6-13)20(23,24)25/h3-8,11H,9-10H2,1-2H3,(H,26,28)(H,27,29)	WMAAYJJDFHPBOY-UHFFFAOYSA-N	510.039467818							107818
AC1LH0DK	LSM-19196	SID22413838, BRD-K90884091	830036	InChI=1S/C9H8Cl2N6/c10-4-1-2-6(5(11)3-4)17-15-7-8(12)13-14-9(7)16-17/h1-3,15H,(H4,12,13,14,16)	LAPOBIMQKNWHKA-UHFFFAOYSA-N	Nc1[nH]nc2NN(Nc12)c3ccc(Cl)cc3Cl	BroadT	BRD-K90884091	BRD-K90884091-001-05-2	Specs	AF-407/13078030			Nc1[nH]nc2NN(Nc12)c1ccc(Cl)cc1Cl	InChI=1S/C9H8Cl2N6/c10-4-1-2-6(5(11)3-4)17-15-7-8(12)13-14-9(7)16-17/h1-3,15H,(H4,12,13,14,16)	LAPOBIMQKNWHKA-UHFFFAOYSA-N	270.018749736							107819
SMR000071320	LSM-19197	SID4258122, BRD-K36189239	1002206	InChI=1S/C25H30N4O2/c1-17(2)22-21-16-31-25(3,4)14-19(21)20(15-26)23(27-22)28-10-12-29(13-11-28)24(30)18-8-6-5-7-9-18/h5-9,17H,10-14,16H2,1-4H3	LMMSCJMQRKXZQB-UHFFFAOYSA-N	CC(C)c1nc(N2CCN(CC2)C(=O)c3ccccc3)c(C#N)c4CC(C)(C)OCc14	BroadT	BRD-K36189239	BRD-K36189239-001-05-6	ChemBridge Corporation	6793266			CC(C)c1nc(N2CCN(CC2)C(=O)c2ccccc2)c(C#N)c2CC(C)(C)OCc12	InChI=1S/C25H30N4O2/c1-17(2)22-21-16-31-25(3,4)14-19(21)20(15-26)23(27-22)28-10-12-29(13-11-28)24(30)18-8-6-5-7-9-18/h5-9,17H,10-14,16H2,1-4H3	LMMSCJMQRKXZQB-UHFFFAOYSA-N	418.23687624							107820
SMR000092778	LSM-19198	SID7965536, BRD-K97846172	1093414	InChI=1S/C21H24N4O2S/c1-14-12-15(13-27-2)17-18(22)19(28-20(17)23-14)21(26)25-10-8-24(9-11-25)16-6-4-3-5-7-16/h3-7,12H,8-11,13,22H2,1-2H3	ZEAZJNKPMRTFQD-UHFFFAOYSA-N	COCc1cc(C)nc2sc(C(=O)N3CCN(CC3)c4ccccc4)c(N)c12	BroadT	BRD-K97846172	BRD-K97846172-001-05-6	ChemDiv Inc.	7039-5467			COCc1cc(C)nc2sc(C(=O)N3CCN(CC3)c3ccccc3)c(N)c12	InChI=1S/C21H24N4O2S/c1-14-12-15(13-27-2)17-18(22)19(28-20(17)23-14)21(26)25-10-8-24(9-11-25)16-6-4-3-5-7-16/h3-7,12H,8-11,13,22H2,1-2H3	ZEAZJNKPMRTFQD-UHFFFAOYSA-N	396.161996738							107821
4-[[4-(4-Methoxyphenyl)-1,3-thiazol-2-yl]amino]benzenesulfonamide	LSM-15198	BRD-K63273567	2226108	InChI=1S/C16H15N3O3S2/c1-22-13-6-2-11(3-7-13)15-10-23-16(19-15)18-12-4-8-14(9-5-12)24(17,20)21/h2-10H,1H3,(H,18,19)(H2,17,20,21)	UVXFVKPLLNBRNZ-UHFFFAOYSA-N	COc1ccc(cc1)c2csc(Nc3ccc(cc3)S(=O)(=O)N)n2	BroadT	BRD-K63273567	BRD-K63273567-004-05-0	ChemBridge Corporation	5932309		Br	COc1ccc(cc1)-c1csc(Nc2ccc(cc2)S(N)(=O)=O)n1.Br	InChI=1S/C16H15N3O3S2.BrH/c1-22-13-6-2-11(3-7-13)15-10-23-16(19-15)18-12-4-8-14(9-5-12)24(17,20)21;/h2-10H,1H3,(H,18,19)(H2,17,20,21);1H	DTACQIWKHSGTQU-UHFFFAOYSA-N	361.05548275							103848, 103848
SMR000207061	LSM-19199	SID17510631, BRD-K80983134	4086401	InChI=1S/C19H27NOS/c1-16-7-9-18(10-8-16)15-22-14-12-19(21)20-13-11-17-5-3-2-4-6-17/h5,7-10H,2-4,6,11-15H2,1H3,(H,20,21)	LVNGAGGSJOKECY-UHFFFAOYSA-N	Cc1ccc(CSCCC(=O)NCCC2=CCCCC2)cc1	BroadT	BRD-K80983134	BRD-K80983134-001-05-3	ChemDiv Inc.	K786-6245			Cc1ccc(CSCCC(=O)NCCC2=CCCCC2)cc1	InChI=1S/C19H27NOS/c1-16-7-9-18(10-8-16)15-22-14-12-19(21)20-13-11-17-5-3-2-4-6-17/h5,7-10H,2-4,6,11-15H2,1H3,(H,20,21)	LVNGAGGSJOKECY-UHFFFAOYSA-N	317.181335184							107822
ZINC00206352	LSM-19200	SID859875, BRD-K45862128	661179	InChI=1S/C18H15N3O2/c1-19-16-11-21(10-14(16)17(22)20(2)18(19)23)15-9-5-7-12-6-3-4-8-13(12)15/h3-11H,1-2H3	NWPITXXIGYMABQ-UHFFFAOYSA-N	CN1C(=O)N(C)c2cn(cc2C1=O)c3cccc4ccccc34	BroadT	BRD-K45862128	BRD-K45862128-001-05-1	InterBioScreen Ltd.	STOCK3S-40628			Cn1c2cn(cc2c(=O)n(C)c1=O)-c1cccc2ccccc12	InChI=1S/C18H15N3O2/c1-19-16-11-21(10-14(16)17(22)20(2)18(19)23)15-9-5-7-12-6-3-4-8-13(12)15/h3-11H,1-2H3	NWPITXXIGYMABQ-UHFFFAOYSA-N	305.11642675							107823
SBB013708	LSM-19201	SID49643285, BRD-K61455847	689218	InChI=1S/C14H13N3O2/c1-19-11-8-9(5-6-10(11)18)13-14(15)17-7-3-2-4-12(17)16-13/h2-8,18H,15H2,1H3	KLGHXLHELHJKEL-UHFFFAOYSA-N	COc1cc(ccc1O)c2nc3ccccn3c2N	BroadT	BRD-K61455847	BRD-K61455847-001-05-3	Asinex Ltd.	BAS 01952007			COc1cc(ccc1O)-c1nc2ccccn2c1N	InChI=1S/C14H13N3O2/c1-19-11-8-9(5-6-10(11)18)13-14(15)17-7-3-2-4-12(17)16-13/h2-8,18H,15H2,1H3	KLGHXLHELHJKEL-UHFFFAOYSA-N	255.100776686							107824
SMR000094251	LSM-19202	SID7965772, BRD-K98704231	5307826	InChI=1S/C19H16ClN3O2S/c1-11-3-8-14(25-11)10-21-18(24)16-9-15-17(22-23(2)19(15)26-16)12-4-6-13(20)7-5-12/h3-9H,10H2,1-2H3,(H,21,24)	WTSCRZNUHVAQIB-UHFFFAOYSA-N	Cc1oc(CNC(=O)c2cc3c(nn(C)c3s2)c4ccc(Cl)cc4)cc1	BroadT	BRD-K98704231	BRD-K98704231-001-04-8	ChemDiv Inc.	C509-0163			Cc1ccc(CNC(=O)c2cc3c(nn(C)c3s2)-c2ccc(Cl)cc2)o1	InChI=1S/C19H16ClN3O2S/c1-11-3-8-14(25-11)10-21-18(24)16-9-15-17(22-23(2)19(15)26-16)12-4-6-13(20)7-5-12/h3-9H,10H2,1-2H3,(H,21,24)	WTSCRZNUHVAQIB-UHFFFAOYSA-N	385.065175182							107825
SMR000104544	LSM-19203	SID7974021, BRD-K18426494	701960	InChI=1S/C19H22O5/c1-11(2)23-17(20)10-22-15-8-12(3)9-16-18(15)13-6-4-5-7-14(13)19(21)24-16/h8-9,11H,4-7,10H2,1-3H3	BEDXARYXRBYZRP-UHFFFAOYSA-N	CC(C)OC(=O)COc1cc(C)cc2OC(=O)C3=C(CCCC3)c12	BroadT	BRD-K18426494	BRD-K18426494-001-05-4	ChemBridge Corporation	6165743			CC(C)OC(=O)COc1cc(C)cc2oc(=O)c3CCCCc3c12	InChI=1S/C19H22O5/c1-11(2)23-17(20)10-22-15-8-12(3)9-16-18(15)13-6-4-5-7-14(13)19(21)24-16/h8-9,11H,4-7,10H2,1-3H3	BEDXARYXRBYZRP-UHFFFAOYSA-N	330.146723804							107826
T6377242	LSM-19204	SID16953466, BRD-A45667109	4984283	InChI=1S/C24H28N4O4/c1-4-27(16(2)3)18-11-9-17(10-12-18)25-21(29)15-28-22(30)24(26-23(28)31)13-14-32-20-8-6-5-7-19(20)24/h5-12,16H,4,13-15H2,1-3H3,(H,25,29)(H,26,31)	GZOIKKYCWRAYHV-UHFFFAOYSA-N	CCN(C(C)C)c1ccc(NC(=O)CN2C(=O)NC3(CCOc4ccccc34)C2=O)cc1	BroadT	BRD-A45667109	BRD-A45667109-001-06-7	Enamine Ltd.	T5264857			CCN(C(C)C)c1ccc(NC(=O)CN2C(=O)NC3(CCOc4ccccc34)C2=O)cc1	InChI=1S/C24H28N4O4/c1-4-27(16(2)3)18-11-9-17(10-12-18)25-21(29)15-28-22(30)24(26-23(28)31)13-14-32-20-8-6-5-7-19(20)24/h5-12,16H,4,13-15H2,1-3H3,(H,25,29)(H,26,31)	GZOIKKYCWRAYHV-UHFFFAOYSA-N	436.211055416							107827
MLS001105415	LSM-19205	SID49721288, BRD-K87742379	24791712	InChI=1S/C22H22ClN3O2/c23-19-5-1-3-17(13-19)18-4-2-6-20(14-18)24-22(27)16-7-10-26(11-8-16)15-21-9-12-28-25-21/h1-6,9,12-14,16H,7-8,10-11,15H2,(H,24,27)	GVXPLMPWFQQXEJ-UHFFFAOYSA-N	Clc1cccc(c1)c2cccc(NC(=O)C3CCN(Cc4ccon4)CC3)c2	BroadT	BRD-K87742379	BRD-K87742379-001-05-0	ChemBridge Corporation	82857041			Clc1cccc(c1)-c1cccc(NC(=O)C2CCN(Cc3ccon3)CC2)c1	InChI=1S/C22H22ClN3O2/c23-19-5-1-3-17(13-19)18-4-2-6-20(14-18)24-22(27)16-7-10-26(11-8-16)15-21-9-12-28-25-21/h1-6,9,12-14,16H,7-8,10-11,15H2,(H,24,27)	GVXPLMPWFQQXEJ-UHFFFAOYSA-N	395.140054684							107828
AC1NETBZ	LSM-19206	BRD-K27949379	4647693	InChI=1S/C17H14ClN3/c1-12-4-2-3-5-13(12)11-20-21-16-8-9-19-17-10-14(18)6-7-15(16)17/h2-11H,1H3,(H,19,21)	NQAPTYPJVMULPE-UHFFFAOYSA-N	Cc1ccccc1C=NNc2ccnc3cc(Cl)ccc23	BroadT	BRD-K27949379	BRD-K27949379-001-10-4	Enamine Ltd.	T0518-9111			Cc1ccccc1C=NNc1ccnc2cc(Cl)ccc12	InChI=1S/C17H14ClN3/c1-12-4-2-3-5-13(12)11-20-21-16-8-9-19-17-10-14(18)6-7-15(16)17/h2-11H,1H3,(H,19,21)	NQAPTYPJVMULPE-UHFFFAOYSA-N	295.087625188							107829
ST50939311	LSM-19207	SID14739855, BRD-A11186456	2970371	InChI=1S/C11H11F2NO2/c12-7-3-4-8(13)9(6-7)14-11(15)10-2-1-5-16-10/h3-4,6,10H,1-2,5H2,(H,14,15)	NOJVPAALEQABFD-UHFFFAOYSA-N	Fc1ccc(F)c(NC(=O)C2CCCO2)c1	BroadT	BRD-A11186456	BRD-A11186456-001-06-7	ChemBridge Corporation	7944065			Fc1ccc(F)c(NC(=O)C2CCCO2)c1	InChI=1S/C11H11F2NO2/c12-7-3-4-8(13)9(6-7)14-11(15)10-2-1-5-16-10/h3-4,6,10H,1-2,5H2,(H,14,15)	NOJVPAALEQABFD-UHFFFAOYSA-N	227.075785002							107830
MLS000571567	LSM-19208	SID16953453, BRD-K00052415	2479051	InChI=1S/C26H26ClN3O3S/c27-25-12-11-23(18-24(25)26(31)28-21-10-9-19-5-4-6-20(19)17-21)34(32,33)30-15-13-29(14-16-30)22-7-2-1-3-8-22/h1-3,7-12,17-18H,4-6,13-16H2,(H,28,31)	MHIZILWBZBKEHC-UHFFFAOYSA-N	Clc1ccc(cc1C(=O)Nc2ccc3CCCc3c2)S(=O)(=O)N4CCN(CC4)c5ccccc5	BroadT	BRD-K00052415	BRD-K00052415-001-06-2	Enamine Ltd.	T5283518			Clc1ccc(cc1C(=O)Nc1ccc2CCCc2c1)S(=O)(=O)N1CCN(CC1)c1ccccc1	InChI=1S/C26H26ClN3O3S/c27-25-12-11-23(18-24(25)26(31)28-21-10-9-19-5-4-6-20(19)17-21)34(32,33)30-15-13-29(14-16-30)22-7-2-1-3-8-22/h1-3,7-12,17-18H,4-6,13-16H2,(H,28,31)	MHIZILWBZBKEHC-UHFFFAOYSA-N	495.138340122							107831
MLS000521059	LSM-19209	SID14734076, BRD-K03223543	3700536	InChI=1S/C20H29NO4/c1-4-5-6-7-8-11-21-19(23)14-24-15-9-10-18-16(12-15)17(22)13-20(2,3)25-18/h9-10,12H,4-8,11,13-14H2,1-3H3,(H,21,23)	OUUJBRWYDJDOHO-UHFFFAOYSA-N	CCCCCCCNC(=O)COc1ccc2OC(C)(C)CC(=O)c2c1	BroadT	BRD-K03223543	BRD-K03223543-001-07-9	ChemDiv Inc.	K786-3827			CCCCCCCNC(=O)COc1ccc2OC(C)(C)CC(=O)c2c1	InChI=1S/C20H29NO4/c1-4-5-6-7-8-11-21-19(23)14-24-15-9-10-18-16(12-15)17(22)13-20(2,3)25-18/h9-10,12H,4-8,11,13-14H2,1-3H3,(H,21,23)	OUUJBRWYDJDOHO-UHFFFAOYSA-N	347.209658418							107832
ASN 09171341	LSM-19210	SID846180, BRD-K42893373	648562	InChI=1S/C17H13FN4O3/c18-12-3-1-11(2-4-12)8-22-9-14(20-21-22)17(23)19-13-5-6-15-16(7-13)25-10-24-15/h1-7,9H,8,10H2,(H,19,23)	FSWLTVCGFNLBSC-UHFFFAOYSA-N	Fc1ccc(Cn2cc(nn2)C(=O)Nc3ccc4OCOc4c3)cc1	BroadT	BRD-K42893373	BRD-K42893373-001-05-1	Asinex Ltd.	ASN 09171341			Fc1ccc(Cn2cc(nn2)C(=O)Nc2ccc3OCOc3c2)cc1	InChI=1S/C17H13FN4O3/c18-12-3-1-11(2-4-12)8-22-9-14(20-21-22)17(23)19-13-5-6-15-16(7-13)25-10-24-15/h1-7,9H,8,10H2,(H,19,23)	FSWLTVCGFNLBSC-UHFFFAOYSA-N	340.097168516							107833
BAS 11781167	LSM-19211	SID24807549, BRD-K55136906	3161479	InChI=1S/C20H22ClN3O3/c1-23-6-8-24(9-7-23)17-4-3-15(13-16(17)21)22-20(25)14-2-5-18-19(12-14)27-11-10-26-18/h2-5,12-13H,6-11H2,1H3,(H,22,25)	XCJXGQALIMHJSD-UHFFFAOYSA-N	CN1CCN(CC1)c2ccc(NC(=O)c3ccc4OCCOc4c3)cc2Cl	BroadT	BRD-K55136906	BRD-K55136906-001-05-5	Asinex Ltd.	BAS 11781167			CN1CCN(CC1)c1ccc(NC(=O)c2ccc3OCCOc3c2)cc1Cl	InChI=1S/C20H22ClN3O3/c1-23-6-8-24(9-7-23)17-4-3-15(13-16(17)21)22-20(25)14-2-5-18-19(12-14)27-11-10-26-18/h2-5,12-13H,6-11H2,1H3,(H,22,25)	XCJXGQALIMHJSD-UHFFFAOYSA-N	387.134969304							107834
NSC326182	LSM-19212	SID26665278, SID4254200, SID458053, SID50109560, BRD-K23481990	331715	InChI=1S/C17H15N3O3/c1-10-3-5-13(11(2)7-10)18-17-20-19-16(23-17)12-4-6-14-15(8-12)22-9-21-14/h3-8H,9H2,1-2H3,(H,18,20)	SWIUQBFXLZSMJW-UHFFFAOYSA-N	Cc1ccc(Nc2oc(nn2)c3ccc4OCOc4c3)c(C)c1	BroadT	BRD-K23481990	BRD-K23481990-001-05-1	National Cancer Institute Chemotherapeutic Agents Repository	326182			Cc1ccc(Nc2nnc(o2)-c2ccc3OCOc3c2)c(C)c1	InChI=1S/C17H15N3O3/c1-10-3-5-13(11(2)7-10)18-17-20-19-16(23-17)12-4-6-14-15(8-12)22-9-21-14/h3-8H,9H2,1-2H3,(H,18,20)	SWIUQBFXLZSMJW-UHFFFAOYSA-N	309.11134137							107835
T5222729	LSM-19213	SID14746818, BRD-K17785382	2430492	InChI=1S/C20H23N3O6/c1-4-20(5-2)17(25)23(18(26)22-20)11-12-9-16(24)29-15-10-13(7-8-14(12)15)21-19(27)28-6-3/h7-10H,4-6,11H2,1-3H3,(H,21,27)(H,22,26)	JYIQHEXSSYDSHU-UHFFFAOYSA-N	CCOC(=O)Nc1ccc2C(=CC(=O)Oc2c1)CN3C(=O)NC(CC)(CC)C3=O	BroadT	BRD-K17785382	BRD-K17785382-001-03-4	Enamine Ltd.	T5222729			CCOC(=O)Nc1ccc2c(CN3C(=O)NC(CC)(CC)C3=O)cc(=O)oc2c1	InChI=1S/C20H23N3O6/c1-4-20(5-2)17(25)23(18(26)22-20)11-12-9-16(24)29-15-10-13(7-8-14(12)15)21-19(27)28-6-3/h7-10H,4-6,11H2,1-3H3,(H,21,27)(H,22,26)	JYIQHEXSSYDSHU-UHFFFAOYSA-N	401.158685486							107836
MLS000093884	LSM-19214	SID4240904, BRD-K83739153	3235947	InChI=1S/C21H28N4O3S/c1-3-28-21(27)25-12-10-23(11-13-25)19(26)16-4-5-17-18(14-16)29-20(22-17)24-8-6-15(2)7-9-24/h4-5,14-15H,3,6-13H2,1-2H3	GAXAQCUOYOCDGP-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)c2ccc3nc(sc3c2)N4CCC(C)CC4	BroadT	BRD-K83739153	BRD-K83739153-001-06-0	ChemDiv Inc.	C858-1128			CCOC(=O)N1CCN(CC1)C(=O)c1ccc2nc(sc2c1)N1CCC(C)CC1	InChI=1S/C21H28N4O3S/c1-3-28-21(27)25-12-10-23(11-13-25)19(26)16-4-5-17-18(14-16)29-20(22-17)24-8-6-15(2)7-9-24/h4-5,14-15H,3,6-13H2,1-2H3	GAXAQCUOYOCDGP-UHFFFAOYSA-N	416.188211486							107837
ST50850277	LSM-15288	BRD-K19810537	971316	InChI=1S/C18H20N2O4/c1-23-16-10-6-3-7-13(16)11-12-19-18(22)20-15-9-5-4-8-14(15)17(21)24-2/h3-10H,11-12H2,1-2H3,(H2,19,20,22)	BWRNPKGXNGYUDS-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)NCCc2ccccc2OC	BroadT	BRD-K19810537	BRD-K19810537-003-06-1	ChemBridge Corporation	7818567		Cl	COC(=O)c1ccccc1NC(=O)NCCc1ccccc1OC.Cl	InChI=1S/C18H20N2O4.ClH/c1-23-16-10-6-3-7-13(16)11-12-19-18(22)20-15-9-5-4-8-14(15)17(21)24-2;/h3-10H,11-12H2,1-2H3,(H2,19,20,22);1H	NSSMETWYNGZZJB-UHFFFAOYSA-N	328.14230714							103935, 103935
MLS000033178	LSM-19215	SID850146, BRD-K82011025	652660	InChI=1S/C24H27N5OS/c1-24(2)16-18-8-6-7-11-20(18)22-25-26-23(29(22)24)31-17-21(30)28-14-12-27(13-15-28)19-9-4-3-5-10-19/h3-11H,12-17H2,1-2H3	HWMDZNYGSYCFAI-UHFFFAOYSA-N	CC1(C)Cc2ccccc2c3nnc(SCC(=O)N4CCN(CC4)c5ccccc5)n13	BroadT	BRD-K82011025	BRD-K82011025-001-05-3	Asinex Ltd.	ASN 06978376			CC1(C)Cc2ccccc2-c2nnc(SCC(=O)N3CCN(CC3)c3ccccc3)n12	InChI=1S/C24H27N5OS/c1-24(2)16-18-8-6-7-11-20(18)22-25-26-23(29(22)24)31-17-21(30)28-14-12-27(13-15-28)19-9-4-3-5-10-19/h3-11H,12-17H2,1-2H3	HWMDZNYGSYCFAI-UHFFFAOYSA-N	433.193631224							107838
AC1LXUWH	LSM-43824	SID17507883, BRD-K49828117	1858963	InChI=1S/C21H19N5O4S2/c1-30-20-19(22-13-14-23-20)26-32(28,29)17-10-8-16(9-11-17)24-21(31)25-18(27)12-7-15-5-3-2-4-6-15/h2-14H,1H3,(H,22,26)(H2,24,25,27,31)/b12-7+	NUMZNWMRXNYYDD-KPKJPENVSA-N	COc1nccnc1NS(=O)(=O)c2ccc(NC(=S)NC(=O)\C=C\c3ccccc3)cc2	BroadT	BRD-K49828117	BRD-K49828117-001-05-1	Asinex Ltd.	BAS 00224417			COc1nccnc1NS(=O)(=O)c1ccc(NC(=S)NC(=O)\C=C\c2ccccc2)cc1	InChI=1S/C21H19N5O4S2/c1-30-20-19(22-13-14-23-20)26-32(28,29)17-10-8-16(9-11-17)24-21(31)25-18(27)12-7-15-5-3-2-4-6-15/h2-14H,1H3,(H,22,26)(H2,24,25,27,31)/b12-7+	NUMZNWMRXNYYDD-KPKJPENVSA-N	469.087845518							
MLS000089134	LSM-19217	SID4264603, BRD-K74121099	1310230	InChI=1S/C13H14Cl2N4O3S2/c1-3-19(4-2)24(21,22)11-5-8(9(14)6-10(11)15)12(20)17-13-18-16-7-23-13/h5-7H,3-4H2,1-2H3,(H,17,18,20)	NMMDWWLKNRDWES-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2nncs2)c(Cl)cc1Cl	BroadT	BRD-K74121099	BRD-K74121099-001-05-1	ChemBridge Corporation	7481403			CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2nncs2)c(Cl)cc1Cl	InChI=1S/C13H14Cl2N4O3S2/c1-3-19(4-2)24(21,22)11-5-8(9(14)6-10(11)15)12(20)17-13-18-16-7-23-13/h5-7H,3-4H2,1-2H3,(H,17,18,20)	NMMDWWLKNRDWES-UHFFFAOYSA-N	407.988437148							107840
MLS000027857	LSM-19218	SID847464, BRD-K79931204	649869	InChI=1S/C16H14N2O3S/c1-18-12-7-8-22-14(12)9-13(18)15(19)17-11-6-4-3-5-10(11)16(20)21-2/h3-9H,1-2H3,(H,17,19)	IGEULZKACHQPCE-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)c2cc3sccc3n2C	BroadT	BRD-K79931204	BRD-K79931204-001-05-0	Asinex Ltd.	ASN 06915079			COC(=O)c1ccccc1NC(=O)c1cc2sccc2n1C	InChI=1S/C16H14N2O3S/c1-18-12-7-8-22-14(12)9-13(18)15(19)17-11-6-4-3-5-10(11)16(20)21-2/h3-9H,1-2H3,(H,17,19)	IGEULZKACHQPCE-UHFFFAOYSA-N	314.072513018							107841
CHEMBL1330331	LSM-19219	SID49642451, BRD-K06725350	715201	InChI=1S/C16H17N3O2/c1-19-13-8-4-3-7-12(13)18-16(19)17-10-11-6-5-9-14(21-2)15(11)20/h3-9,20H,10H2,1-2H3,(H,17,18)	WTTWIHLYQAPEJS-UHFFFAOYSA-N	COc1cccc(CNc2nc3ccccc3n2C)c1O	BroadT	BRD-K06725350	BRD-K06725350-001-06-4	Asinex Ltd.	BAS 03020360			COc1cccc(CNc2nc3ccccc3n2C)c1O	InChI=1S/C16H17N3O2/c1-19-13-8-4-3-7-12(13)18-16(19)17-10-11-6-5-9-14(21-2)15(11)20/h3-9,20H,10H2,1-2H3,(H,17,18)	WTTWIHLYQAPEJS-UHFFFAOYSA-N	283.132076814							107842
MLS000520196	LSM-19220	SID14737887, BRD-K10292562	3497769	InChI=1S/C17H20N4O/c1-12-8-9-14(22-12)15-16(19-13-6-3-2-4-7-13)21-11-5-10-18-17(21)20-15/h5,8-11,13,19H,2-4,6-7H2,1H3	BLCZKTYVLGECAW-UHFFFAOYSA-N	Cc1oc(cc1)c2nc3ncccn3c2NC4CCCCC4	BroadT	BRD-K10292562	BRD-K10292562-001-05-5	ChemDiv Inc.	C325-0016			Cc1ccc(o1)-c1nc2ncccn2c1NC1CCCCC1	InChI=1S/C17H20N4O/c1-12-8-9-14(22-12)15-16(19-13-6-3-2-4-7-13)21-11-5-10-18-17(21)20-15/h5,8-11,13,19H,2-4,6-7H2,1H3	BLCZKTYVLGECAW-UHFFFAOYSA-N	296.1637113							107843
MLS000045112	LSM-19221	SID4244553, BRD-K23004954	3239135	InChI=1S/C22H24N4O5S/c1-14-4-7-18(8-5-14)26(32(28,29)22-15(2)24-25-16(22)3)13-21(27)23-17-6-9-19-20(12-17)31-11-10-30-19/h4-9,12H,10-11,13H2,1-3H3,(H,23,27)(H,24,25)	JOYNROAATMHFIJ-UHFFFAOYSA-N	Cc1ccc(cc1)N(CC(=O)Nc2ccc3OCCOc3c2)S(=O)(=O)c4c(C)n[nH]c4C	BroadT	BRD-K23004954	BRD-K23004954-001-05-5	ChemDiv Inc.	C436-2774			Cc1n[nH]c(C)c1S(=O)(=O)N(CC(=O)Nc1ccc2OCCOc2c1)c1ccc(C)cc1	InChI=1S/C22H24N4O5S/c1-14-4-7-18(8-5-14)26(32(28,29)22-15(2)24-25-16(22)3)13-21(27)23-17-6-9-19-20(12-17)31-11-10-30-19/h4-9,12H,10-11,13H2,1-3H3,(H,23,27)(H,24,25)	JOYNROAATMHFIJ-UHFFFAOYSA-N	456.146740598							107844
MLS000099027	LSM-19222	SID4264545, BRD-K45488606	717224	InChI=1S/C14H20N2O5S/c1-20-12-8-11(9-13(10-12)21-2)14(17)15-4-6-16(7-5-15)22(3,18)19/h8-10H,4-7H2,1-3H3	NUZMHJAYCQKTDQ-UHFFFAOYSA-N	COc1cc(OC)cc(c1)C(=O)N2CCN(CC2)S(=O)(=O)C	BroadT	BRD-K45488606	BRD-K45488606-001-06-4	ChemBridge Corporation	5940993			COc1cc(OC)cc(c1)C(=O)N1CCN(CC1)S(C)(=O)=O	InChI=1S/C14H20N2O5S/c1-20-12-8-11(9-13(10-12)21-2)14(17)15-4-6-16(7-5-15)22(3,18)19/h8-10H,4-7H2,1-3H3	NUZMHJAYCQKTDQ-UHFFFAOYSA-N	328.10929245							107845
ST50769640	LSM-19223	SID24811158, BRD-K67831601	4639682	InChI=1S/C18H19N5O4/c1-4-22(5-2)14-11(9-12-15(24)20-18(27)21-16(12)25)17(26)23-8-6-7-10(3)13(23)19-14/h6-9H,4-5H2,1-3H3,(H2,20,21,24,25,27)	ISKJIZVDEMXIBX-UHFFFAOYSA-N	CCN(CC)C1=C(C=C2C(=O)NC(=O)NC2=O)C(=O)N3C=CC=C(C)C3=N1	BroadT	BRD-K67831601	BRD-K67831601-001-07-1	ChemDiv Inc.	3338-1146			CCN(CC)c1nc2c(C)cccn2c(=O)c1C=C1C(=O)NC(=O)NC1=O	InChI=1S/C18H19N5O4/c1-4-22(5-2)14-11(9-12-15(24)20-18(27)21-16(12)25)17(26)23-8-6-7-10(3)13(23)19-14/h6-9H,4-5H2,1-3H3,(H2,20,21,24,25,27)	ISKJIZVDEMXIBX-UHFFFAOYSA-N	369.143704138							107846
AC1M6MFY	LSM-19224	BRD-K81136091	2401287	InChI=1S/C14H21N3S/c1-4-5-8-15-14(18)17-16-10-13-9-11(2)6-7-12(13)3/h6-7,9-10H,4-5,8H2,1-3H3,(H2,15,17,18)	BKPHTKNXTNUKNK-UHFFFAOYSA-N	CCCCN=C(S)NN=Cc1cc(C)ccc1C	BroadT	BRD-K81136091	BRD-K81136091-001-05-8	Enamine Ltd.	T0520-1832			CCCCN=C(S)NN=Cc1cc(C)ccc1C	InChI=1S/C14H21N3S/c1-4-5-8-15-14(18)17-16-10-13-9-11(2)6-7-12(13)3/h6-7,9-10H,4-5,8H2,1-3H3,(H2,15,17,18)	BKPHTKNXTNUKNK-UHFFFAOYSA-N	263.145618392							107847
MLS000054284	LSM-19225	SID3715956, BRD-K72151094	2347973	InChI=1S/C18H19NO5/c1-22-16-11-14-5-3-2-4-13(14)10-15(16)18(21)24-12-17(20)19-6-8-23-9-7-19/h2-5,10-11H,6-9,12H2,1H3	VCVIEHAEWKJANZ-UHFFFAOYSA-N	COc1cc2ccccc2cc1C(=O)OCC(=O)N3CCOCC3	BroadT	BRD-K72151094	BRD-K72151094-001-05-5	Enamine Ltd.	T0508-1403			COc1cc2ccccc2cc1C(=O)OCC(=O)N1CCOCC1	InChI=1S/C18H19NO5/c1-22-16-11-14-5-3-2-4-13(14)10-15(16)18(21)24-12-17(20)19-6-8-23-9-7-19/h2-5,10-11H,6-9,12H2,1H3	VCVIEHAEWKJANZ-UHFFFAOYSA-N	329.126322718							107848
AC1MJXUS	LSM-19226	SID47201748, BRD-A15494458	3144880	InChI=1S/C22H29N5O5/c1-24-19-18(20(29)25(2)22(24)30)27(21(23-19)26-11-5-4-6-12-26)13-15(28)14-32-17-9-7-16(31-3)8-10-17/h7-10,15,28H,4-6,11-14H2,1-3H3	KYUPNYDXFGYBNB-UHFFFAOYSA-N	COc1ccc(OCC(O)Cn2c(nc3N(C)C(=O)N(C)C(=O)c23)N4CCCCC4)cc1	BroadT	BRD-A15494458	BRD-A15494458-001-05-1	Asinex Ltd.	BAS 02999192			COc1ccc(OCC(O)Cn2c(nc3n(C)c(=O)n(C)c(=O)c23)N2CCCCC2)cc1	InChI=1S/C22H29N5O5/c1-24-19-18(20(29)25(2)22(24)30)27(21(23-19)26-11-5-4-6-12-26)13-15(28)14-32-17-9-7-16(31-3)8-10-17/h7-10,15,28H,4-6,11-14H2,1-3H3	KYUPNYDXFGYBNB-UHFFFAOYSA-N	443.216869078							107849
N-[(1-Acetylindol-3-yl)methylideneamino]-2,4-dimethyl-1,3-thiazole-5-carboxamide	LSM-19227	BRD-K70542395	2337793	InChI=1S/C17H16N4O2S/c1-10-16(24-11(2)19-10)17(23)20-18-8-13-9-21(12(3)22)15-7-5-4-6-14(13)15/h4-9H,1-3H3,(H,20,23)	SENCRTQZPSCASX-UHFFFAOYSA-N	CC(=O)n1cc(C=NNC(=O)c2sc(C)nc2C)c3ccccc13	BroadT	BRD-K70542395	BRD-K70542395-001-05-3	Enamine Ltd.	T0500-7244			CC(=O)n1cc(C=NNC(=O)c2sc(C)nc2C)c2ccccc12	InChI=1S/C17H16N4O2S/c1-10-16(24-11(2)19-10)17(23)20-18-8-13-9-21(12(3)22)15-7-5-4-6-14(13)15/h4-9H,1-3H3,(H,20,23)	SENCRTQZPSCASX-UHFFFAOYSA-N	340.099396482							107850
SMR000031823	LSM-19228	SID4251284, BRD-K60435968	3244990	InChI=1S/C22H22N4O2/c1-14-6-4-7-17(10-14)11-19-15(2)25-21-20(13-24-26(21)16(19)3)22(27)23-12-18-8-5-9-28-18/h4-10,13H,11-12H2,1-3H3,(H,23,27)	OBUVLPAOWIXQOS-UHFFFAOYSA-N	Cc1cccc(Cc2c(C)nc3c(cnn3c2C)C(=O)NCc4occc4)c1	BroadT	BRD-K60435968	BRD-K60435968-001-05-9	ChemDiv Inc.	K785-0181			Cc1cccc(Cc2c(C)nc3c(cnn3c2C)C(=O)NCc2ccco2)c1	InChI=1S/C22H22N4O2/c1-14-6-4-7-17(10-14)11-19-15(2)25-21-20(13-24-26(21)16(19)3)22(27)23-12-18-8-5-9-28-18/h4-10,13H,11-12H2,1-3H3,(H,23,27)	OBUVLPAOWIXQOS-UHFFFAOYSA-N	374.174275984							107851
4-Isopropyl-n-pyridin-3-yl-benzamide	LSM-19229	SID49641400, BRD-K72628262	887858	InChI=1S/C15H16N2O/c1-11(2)12-5-7-13(8-6-12)15(18)17-14-4-3-9-16-10-14/h3-11H,1-2H3,(H,17,18)	UXPRVYXRHDMOPP-UHFFFAOYSA-N	CC(C)c1ccc(cc1)C(=O)Nc2cccnc2	BroadT	BRD-K72628262	BRD-K72628262-001-06-6	Asinex Ltd.	BAS 01065560			CC(C)c1ccc(cc1)C(=O)Nc1cccnc1	InChI=1S/C15H16N2O/c1-11(2)12-5-7-13(8-6-12)15(18)17-14-4-3-9-16-10-14/h3-11H,1-2H3,(H,17,18)	UXPRVYXRHDMOPP-UHFFFAOYSA-N	240.126263152							107852
1H-1,2,4-Triazole, 1-[2-[4-(phenylmethoxy)phenoxy]ethyl]-	LSM-19230	SID4260052, BRD-K13661881	976289	InChI=1S/C17H17N3O2/c1-2-4-15(5-3-1)12-22-17-8-6-16(7-9-17)21-11-10-20-14-18-13-19-20/h1-9,13-14H,10-12H2	PJVFZNGGGHCROQ-UHFFFAOYSA-N	C(Cn1cncn1)Oc2ccc(OCc3ccccc3)cc2	BroadT	BRD-K13661881	BRD-K13661881-001-05-2	ChemBridge Corporation	7718596			C(Cn1cncn1)Oc1ccc(OCc2ccccc2)cc1	InChI=1S/C17H17N3O2/c1-2-4-15(5-3-1)12-22-17-8-6-16(7-9-17)21-11-10-20-14-18-13-19-20/h1-9,13-14H,10-12H2	PJVFZNGGGHCROQ-UHFFFAOYSA-N	295.132076814							107853
AC1M23NQ	LSM-19231	SID24838141, BRD-K57066058	2161504	InChI=1S/C21H19N5O3S/c27-20(11-6-15-14-24-19-5-2-1-4-18(15)19)25-16-7-9-17(10-8-16)30(28,29)26-21-22-12-3-13-23-21/h1-5,7-10,12-14,24H,6,11H2,(H,25,27)(H,22,23,26)	YYKGAEDBHFUANW-UHFFFAOYSA-N	O=C(CCc1c[nH]c2ccccc12)Nc3ccc(cc3)S(=O)(=O)Nc4ncccn4	BroadT	BRD-K57066058	BRD-K57066058-001-05-8	Enamine Ltd.	T5267493			O=C(CCc1c[nH]c2ccccc12)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1	InChI=1S/C21H19N5O3S/c27-20(11-6-15-14-24-19-5-2-1-4-18(15)19)25-16-7-9-17(10-8-16)30(28,29)26-21-22-12-3-13-23-21/h1-5,7-10,12-14,24H,6,11H2,(H,25,27)(H,22,23,26)	YYKGAEDBHFUANW-UHFFFAOYSA-N	421.120860208							107854
AC1NQKIA	LSM-19232	SID17386062, BRD-K76734823	5198758	InChI=1S/C10H12N2O2S2/c1-15-10(16-2)12-11-9(14)7-3-5-8(13)6-4-7/h3-6,13H,1-2H3,(H,11,14)	VUQDXRMWNUQYII-UHFFFAOYSA-N	CSC(=NNC(=O)c1ccc(O)cc1)SC	BroadT	BRD-K76734823	BRD-K76734823-001-05-2	Specs	AE-842/33001050			CSC(SC)=NNC(=O)c1ccc(O)cc1	InChI=1S/C10H12N2O2S2/c1-15-10(16-2)12-11-9(14)7-3-5-8(13)6-4-7/h3-6,13H,1-2H3,(H,11,14)	VUQDXRMWNUQYII-UHFFFAOYSA-N	256.034019024							107855
MLS000834465	LSM-19233	SID24779788, BRD-K53061928	16187184	InChI=1S/C28H33BrN2O6/c29-23-6-4-21(5-7-23)22-16-26(37-27(17-22)34-14-2-1-13-32)28(33)31-11-9-30(10-12-31)18-20-3-8-24-25(15-20)36-19-35-24/h3-8,15-16,22,27,32H,1-2,9-14,17-19H2/t22-,27+/m0/s1	IZLJQDMHULWICH-WXVAWEFUSA-N	OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)c5ccc(Br)cc5	BroadT	BRD-K53061928	BRD-K53061928-001-08-5	Harvard University	(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)((2R,4R)-4-(4-bromophenyl)-2-(4-hydroxybutoxy)-3,4-dihydro-2H-pyran-6-yl)methanone DHPC11_001155			OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N1CCN(Cc2ccc3OCOc3c2)CC1)c1ccc(Br)cc1	InChI=1S/C28H33BrN2O6/c29-23-6-4-21(5-7-23)22-16-26(37-27(17-22)34-14-2-1-13-32)28(33)31-11-9-30(10-12-31)18-20-3-8-24-25(15-20)36-19-35-24/h3-8,15-16,22,27,32H,1-2,9-14,17-19H2/t22-,27+/m0/s1	IZLJQDMHULWICH-WXVAWEFUSA-N	572.152199396							107856
F0745-0384	LSM-19234	SID14744386, BRD-K34654169	1182910	InChI=1S/C17H18ClNO3S/c1-4-22-17(21)15-10(2)16(19-11(15)3)14(20)9-23-13-7-5-12(18)6-8-13/h5-8,19H,4,9H2,1-3H3	OPXJWUMCOASDQH-UHFFFAOYSA-N	CCOC(=O)c1c(C)[nH]c(C(=O)CSc2ccc(Cl)cc2)c1C	BroadT	BRD-K34654169	BRD-K34654169-001-05-5	Enamine Ltd.	T0505-2722			CCOC(=O)c1c(C)[nH]c(C(=O)CSc2ccc(Cl)cc2)c1C	InChI=1S/C17H18ClNO3S/c1-4-22-17(21)15-10(2)16(19-11(15)3)14(20)9-23-13-7-5-12(18)6-8-13/h5-8,19H,4,9H2,1-3H3	OPXJWUMCOASDQH-UHFFFAOYSA-N	351.069591846							107857
F0808-2337	LSM-19235	SID17414859, BRD-K84479162	2866858	InChI=1S/C19H15ClN2O7S/c1-10(23)19-11(2)29-18-7-4-13(8-15(18)19)21(12(3)24)30(27,28)14-5-6-16(20)17(9-14)22(25)26/h4-9H,1-3H3	RHDIXELWUIYPIB-UHFFFAOYSA-N	CC(=O)N(c1ccc2oc(C)c(C(=O)C)c2c1)S(=O)(=O)c3ccc(Cl)c(c3)[N+](=O)[O-]	BroadT	BRD-K84479162	BRD-K84479162-001-06-1	ChemBridge Corporation	5757059			CC(=O)N(c1ccc2oc(C)c(C(C)=O)c2c1)S(=O)(=O)c1ccc(Cl)c(c1)[N+]([O-])=O	InChI=1S/C19H15ClN2O7S/c1-10(23)19-11(2)29-18-7-4-13(8-15(18)19)21(12(3)24)30(27,28)14-5-6-16(20)17(9-14)22(25)26/h4-9H,1-3H3	RHDIXELWUIYPIB-UHFFFAOYSA-N	450.02884924							107858
MLS000056170	LSM-19236	SID3713368, BRD-K57989144	2553426	InChI=1S/C22H21N5O4/c1-13-7-3-5-9-16(13)24-22-26-18(25-21(23)27-22)12-30-20(28)19-15(11-29-2)14-8-4-6-10-17(14)31-19/h3-10H,11-12H2,1-2H3,(H3,23,24,25,26,27)	CEIVFGMMZTXJNB-UHFFFAOYSA-N	COCc1c(oc2ccccc12)C(=O)OCc3nc(N)nc(Nc4ccccc4C)n3	BroadT	BRD-K57989144	BRD-K57989144-001-05-7	Enamine Ltd.	T5341631			COCc1c(oc2ccccc12)C(=O)OCc1nc(N)nc(Nc2ccccc2C)n1	InChI=1S/C22H21N5O4/c1-13-7-3-5-9-16(13)24-22-26-18(25-21(23)27-22)12-30-20(28)19-15(11-29-2)14-8-4-6-10-17(14)31-19/h3-10H,11-12H2,1-2H3,(H3,23,24,25,26,27)	CEIVFGMMZTXJNB-UHFFFAOYSA-N	419.159354202							107859
N-[[5-(1,3-Benzothiazol-2-ylsulfanyl)furan-2-yl]methylideneamino]-2-(2-methylphenoxy)acetamide	LSM-19237	BRD-K41991113	1237675	InChI=1S/C21H17N3O3S2/c1-14-6-2-4-8-17(14)26-13-19(25)24-22-12-15-10-11-20(27-15)29-21-23-16-7-3-5-9-18(16)28-21/h2-12H,13H2,1H3,(H,24,25)	QRIGMIDAYWJCJY-UHFFFAOYSA-N	Cc1ccccc1OCC(=O)NN=Cc2oc(Sc3nc4ccccc4s3)cc2	BroadT	BRD-K41991113	BRD-K41991113-001-05-9	Specs	AG-205/08036058			Cc1ccccc1OCC(=O)NN=Cc1ccc(Sc2nc3ccccc3s2)o1	InChI=1S/C21H17N3O3S2/c1-14-6-2-4-8-17(14)26-13-19(25)24-22-12-15-10-11-20(27-15)29-21-23-16-7-3-5-9-18(16)28-21/h2-12H,13H2,1H3,(H,24,25)	QRIGMIDAYWJCJY-UHFFFAOYSA-N	423.071132814							107860
AC1LFMAX	LSM-19238	SID26658116, BRD-K45182419	756039	InChI=1S/C17H15N3O2/c1-2-11-7-9-12(10-8-11)18-17(22)15-13-5-3-4-6-14(13)16(21)20-19-15/h3-10H,2H2,1H3,(H,18,22)(H,20,21)	ACWMJNRVNKFXFO-UHFFFAOYSA-N	CCc1ccc(NC(=O)c2nnc(O)c3ccccc23)cc1	BroadT	BRD-K45182419	BRD-K45182419-001-05-2	Enamine Ltd.	T5291422			CCc1ccc(NC(=O)c2nnc(O)c3ccccc23)cc1	InChI=1S/C17H15N3O2/c1-2-11-7-9-12(10-8-11)18-17(22)15-13-5-3-4-6-14(13)16(21)20-19-15/h3-10H,2H2,1H3,(H,18,22)(H,20,21)	ACWMJNRVNKFXFO-UHFFFAOYSA-N	293.11642675							107861
S-(4-Methylphenyl) (3,4-Dimethylphenoxy)Ethanethioate	LSM-19239	SID14736427, BRD-K05113896	888984	InChI=1S/C17H18O2S/c1-12-4-8-16(9-5-12)20-17(18)11-19-15-7-6-13(2)14(3)10-15/h4-10H,11H2,1-3H3	XGFYCQDWUFLLJC-UHFFFAOYSA-N	Cc1ccc(SC(=O)COc2ccc(C)c(C)c2)cc1	BroadT	BRD-K05113896	BRD-K05113896-001-05-7	ChemBridge Corporation	7367210			Cc1ccc(SC(=O)COc2ccc(C)c(C)c2)cc1	InChI=1S/C17H18O2S/c1-12-4-8-16(9-5-12)20-17(18)11-19-15-7-6-13(2)14(3)10-15/h4-10H,11H2,1-3H3	XGFYCQDWUFLLJC-UHFFFAOYSA-N	286.102750506							107862
MLS000098510	LSM-19240	SID3715763, BRD-K92551462	2676408	InChI=1S/C19H17NO5/c1-23-15-6-7-16-13(11-25-17(16)10-15)9-18(21)20-14-5-3-4-12(8-14)19(22)24-2/h3-8,10-11H,9H2,1-2H3,(H,20,21)	HVAQIORIMRNQHZ-UHFFFAOYSA-N	COC(=O)c1cccc(NC(=O)Cc2coc3cc(OC)ccc23)c1	BroadT	BRD-K92551462	BRD-K92551462-001-05-6	Enamine Ltd.	ZT-8022901			COC(=O)c1cccc(NC(=O)Cc2coc3cc(OC)ccc23)c1	InChI=1S/C19H17NO5/c1-23-15-6-7-16-13(11-25-17(16)10-15)9-18(21)20-14-5-3-4-12(8-14)19(22)24-2/h3-8,10-11H,9H2,1-2H3,(H,20,21)	HVAQIORIMRNQHZ-UHFFFAOYSA-N	339.110672654							107863
SMR000105117	LSM-19241	SID7974215, BRD-A07764704	2876018	InChI=1S/C21H22N2O3S/c1-2-26-19(25)15-12-23-18(24)16-17(22-20(23)27-15)14-8-4-3-7-13(14)11-21(16)9-5-6-10-21/h3-4,7-8,15H,2,5-6,9-12H2,1H3	FPALGZOTQIOPFX-UHFFFAOYSA-N	CCOC(=O)C1CN2C(=O)C3=C(N=C2S1)c4ccccc4CC35CCCC5	BroadT	BRD-A07764704	BRD-A07764704-001-04-2	ChemBridge Corporation	5913697			CCOC(=O)C1Cn2c(S1)nc1-c3ccccc3CC3(CCCC3)c1c2=O	InChI=1S/C21H22N2O3S/c1-2-26-19(25)15-12-23-18(24)16-17(22-20(23)27-15)14-8-4-3-7-13(14)11-21(16)9-5-6-10-21/h3-4,7-8,15H,2,5-6,9-12H2,1H3	FPALGZOTQIOPFX-UHFFFAOYSA-N	382.135113274							107864
SMR000036469	LSM-19242	SID865090, BRD-K69609532	666341	InChI=1S/C21H13N5O2/c1-27-19-8-4-5-9-20(19)28-21-11-15(13-23)14(12-22)10-18(21)26-17-7-3-2-6-16(17)24-25-26/h2-11H,1H3	ZDUPMKPVDRTDCV-UHFFFAOYSA-N	COc1ccccc1Oc2cc(C#N)c(cc2n3nnc4ccccc34)C#N	BroadT	BRD-K69609532	BRD-K69609532-001-06-5	InterBioScreen Ltd.	STOCK5S-36077			COc1ccccc1Oc1cc(C#N)c(cc1-n1nnc2ccccc12)C#N	InChI=1S/C21H13N5O2/c1-27-19-8-4-5-9-20(19)28-21-11-15(13-23)14(12-22)10-18(21)26-17-7-3-2-6-16(17)24-25-26/h2-11H,1H3	ZDUPMKPVDRTDCV-UHFFFAOYSA-N	367.106924706							107865
SMR000029981	LSM-19243	SID4242047, BRD-A90006116	3236950	InChI=1S/C24H24ClFN4O/c25-20-5-1-3-18(15-20)24(31)28-17-23(19-4-2-10-27-16-19)30-13-11-29(12-14-30)22-8-6-21(26)7-9-22/h1-10,15-16,23H,11-14,17H2,(H,28,31)	YIYQWHXXRBXVRN-UHFFFAOYSA-N	Fc1ccc(cc1)N2CCN(CC2)C(CNC(=O)c3cccc(Cl)c3)c4cccnc4	BroadT	BRD-A90006116	BRD-A90006116-001-05-5	ChemDiv Inc.	E155-0300			Fc1ccc(cc1)N1CCN(CC1)C(CNC(=O)c1cccc(Cl)c1)c1cccnc1	InChI=1S/C24H24ClFN4O/c25-20-5-1-3-18(15-20)24(31)28-17-23(19-4-2-10-27-16-19)30-13-11-29(12-14-30)22-8-6-21(26)7-9-22/h1-10,15-16,23H,11-14,17H2,(H,28,31)	YIYQWHXXRBXVRN-UHFFFAOYSA-N	438.162267338							107866
AR-422/15096008	LSM-19244	SID7972604, BRD-K86307212	719677	InChI=1S/C18H18N4S/c1-3-22-16-11-7-5-9-14(16)19-17(22)12-23-18-20-13-8-4-6-10-15(13)21(18)2/h4-11H,3,12H2,1-2H3	HBEOXHJIXRVGHQ-UHFFFAOYSA-N	CCn1c(CSc2nc3ccccc3n2C)nc4ccccc14	BroadT	BRD-K86307212	BRD-K86307212-001-05-4	ChemBridge Corporation	6513770			CCn1c(CSc2nc3ccccc3n2C)nc2ccccc12	InChI=1S/C18H18N4S/c1-3-22-16-11-7-5-9-14(16)19-17(22)12-23-18-20-13-8-4-6-10-15(13)21(18)2/h4-11H,3,12H2,1-2H3	HBEOXHJIXRVGHQ-UHFFFAOYSA-N	322.125217306							107867
CID 73951014	LSM-19245	BRD-A64196022	73951014	InChI=1S/C13H12ClNO2/c1-7(2)15-11-10(14)12(16)8-5-3-4-6-9(8)13(11)17/h3-7,10H,1-2H3	BMCSANQVRHIBFE-UHFFFAOYSA-N	CC(C)N=C1C(Cl)C(=O)c2ccccc2C1=O	BroadT	BRD-A64196022	BRD-A64196022-001-05-9	ChemBridge Corporation	5472843			CC(C)N=C1C(Cl)C(=O)c2ccccc2C1=O	InChI=1S/C13H12ClNO2/c1-7(2)15-11-10(14)12(16)8-5-3-4-6-9(8)13(11)17/h3-7,10H,1-2H3	BMCSANQVRHIBFE-UHFFFAOYSA-N	249.055656344							107868
SMR000064549	LSM-19246	SID24840275, SID3714859, BRD-K66803903	2525684	InChI=1S/C17H13Cl2N3O3S/c1-24-14-5-3-2-4-11(14)16-21-22-17(25-16)26-9-15(23)20-13-7-6-10(18)8-12(13)19/h2-8H,9H2,1H3,(H,20,23)	BKXVJUWSFPDUDR-UHFFFAOYSA-N	COc1ccccc1c2oc(SCC(=O)Nc3ccc(Cl)cc3Cl)nn2	BroadT	BRD-K66803903	BRD-K66803903-001-05-0	Enamine Ltd.	T5334215			COc1ccccc1-c1nnc(SCC(=O)Nc2ccc(Cl)cc2Cl)o1	InChI=1S/C17H13Cl2N3O3S/c1-24-14-5-3-2-4-11(14)16-21-22-17(25-16)26-9-15(23)20-13-7-6-10(18)8-12(13)19/h2-8H,9H2,1H3,(H,20,23)	BKXVJUWSFPDUDR-UHFFFAOYSA-N	409.005467416							107869
SMR000023760	LSM-19247	SID4250227, BRD-K30947691	3244071	InChI=1S/C23H21N3O6S/c27-19(24-13-17-7-4-11-31-17)8-10-25-22(29)21-18(9-12-33-21)26(23(25)30)14-20(28)32-15-16-5-2-1-3-6-16/h1-7,9,11-12H,8,10,13-15H2,(H,24,27)	PXKPYBQMLXOGSL-UHFFFAOYSA-N	O=C(CCN1C(=O)N(CC(=O)OCc2ccccc2)c3ccsc3C1=O)NCc4occc4	BroadT	BRD-K30947691	BRD-K30947691-001-05-4	ChemDiv Inc.	C241-1515			O=C(CCn1c(=O)n(CC(=O)OCc2ccccc2)c2ccsc2c1=O)NCc1ccco1	InChI=1S/C23H21N3O6S/c27-19(24-13-17-7-4-11-31-17)8-10-25-22(29)21-18(9-12-33-21)26(23(25)30)14-20(28)32-15-16-5-2-1-3-6-16/h1-7,9,11-12H,8,10,13-15H2,(H,24,27)	PXKPYBQMLXOGSL-UHFFFAOYSA-N	467.115106112							107870
MLS000586823	LSM-19248	SID22411880, SID51088295, BRD-A78269968	15945552	InChI=1S/C27H27ClN4O3/c1-16(20-6-10-24-25(14-20)35-13-12-34-24)30-27(33)11-9-22-17(2)29-26-15-23(31-32(26)18(22)3)19-4-7-21(28)8-5-19/h4-8,10,14-16H,9,11-13H2,1-3H3,(H,30,33)	AYRBYASXVNWJMF-UHFFFAOYSA-N	CC(NC(=O)CCc1c(C)nc2cc(nn2c1C)c3ccc(Cl)cc3)c4ccc5OCCOc5c4	BroadT	BRD-A78269968	BRD-A78269968-001-05-4	ChemDiv Inc.	C561-0921			CC(NC(=O)CCc1c(C)nc2cc(nn2c1C)-c1ccc(Cl)cc1)c1ccc2OCCOc2c1	InChI=1S/C27H27ClN4O3/c1-16(20-6-10-24-25(14-20)35-13-12-34-24)30-27(33)11-9-22-17(2)29-26-15-23(31-32(26)18(22)3)19-4-7-21(28)8-5-19/h4-8,10,14-16H,9,11-13H2,1-3H3,(H,30,33)	AYRBYASXVNWJMF-UHFFFAOYSA-N	490.177168474							107871
AK-968/12117141	LSM-19249	SID17386225, BRD-K64184910	1221201	InChI=1S/C24H17N3O2/c1-29-17-12-10-16(11-13-17)22-14-19(18-6-2-3-7-20(18)26-22)24(28)27-15-25-21-8-4-5-9-23(21)27/h2-15H,1H3	SJYBRNSXRKIGBZ-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(C(=O)n3cnc4ccccc34)c5ccccc5n2	BroadT	BRD-K64184910	BRD-K64184910-001-06-6	Specs	AK-968/12117141			COc1ccc(cc1)-c1cc(C(=O)n2cnc3ccccc23)c2ccccc2n1	InChI=1S/C24H17N3O2/c1-29-17-12-10-16(11-13-17)22-14-19(18-6-2-3-7-20(18)26-22)24(28)27-15-25-21-8-4-5-9-23(21)27/h2-15H,1H3	SJYBRNSXRKIGBZ-UHFFFAOYSA-N	379.132076814							107872
T5567058	LSM-43825	SID49674371, BRD-K28807341	6366746	InChI=1S/C16H15NO3/c1-19-13-6-8-16(20-2)14(10-13)15(18)7-5-12-4-3-9-17-11-12/h3-11H,1-2H3/b7-5+	SEBUJWGZGAITSX-FNORWQNLSA-N	COc1ccc(OC)c(c1)C(=O)\C=C\c2cccnc2	BroadT	BRD-K28807341	BRD-K28807341-001-05-8	Enamine Ltd.	T5567058			COc1ccc(OC)c(c1)C(=O)\C=C\c1cccnc1	InChI=1S/C16H15NO3/c1-19-13-6-8-16(20-2)14(10-13)15(18)7-5-12-4-3-9-17-11-12/h3-11H,1-2H3/b7-5+	SEBUJWGZGAITSX-FNORWQNLSA-N	269.10519335							
SMR000032467	LSM-19251	SID4241591, BRD-A83859334	3236546	InChI=1S/C22H33N3O3/c1-28-20-9-7-18(8-10-20)16-25-17-19(15-21(25)26)22(27)23-11-6-14-24-12-4-2-3-5-13-24/h7-10,19H,2-6,11-17H2,1H3,(H,23,27)	SUGUQDCKEXSSGJ-UHFFFAOYSA-N	COc1ccc(CN2CC(CC2=O)C(=O)NCCCN3CCCCCC3)cc1	BroadT	BRD-A83859334	BRD-A83859334-001-05-2	ChemDiv Inc.	K786-8553			COc1ccc(CN2CC(CC2=O)C(=O)NCCCN2CCCCCC2)cc1	InChI=1S/C22H33N3O3/c1-28-20-9-7-18(8-10-20)16-25-17-19(15-21(25)26)22(27)23-11-6-14-24-12-4-2-3-5-13-24/h7-10,19H,2-6,11-17H2,1H3,(H,23,27)	SUGUQDCKEXSSGJ-UHFFFAOYSA-N	387.252191946							107874
AC1MPLME	LSM-19252	BRD-K17549032	3387220	InChI=1S/C20H24N8O3/c1-2-30-15-10-8-14(9-11-15)17-16(23-27-28(17)19-18(21)25-31-26-19)20(29)24-22-12-13-6-4-3-5-7-13/h8-13H,2-7H2,1H3,(H2,21,25)(H,24,29)	RHZSIUFNUCAGPL-UHFFFAOYSA-N	CCOc1ccc(cc1)c2c(nnn2c3nonc3N)C(=O)NN=CC4CCCCC4	BroadT	BRD-K17549032	BRD-K17549032-001-05-3	InterBioScreen Ltd.	STOCK4S-22685			CCOc1ccc(cc1)-c1c(nnn1-c1nonc1N)C(=O)NN=CC1CCCCC1	InChI=1S/C20H24N8O3/c1-2-30-15-10-8-14(9-11-15)17-16(23-27-28(17)19-18(21)25-31-26-19)20(29)24-22-12-13-6-4-3-5-7-13/h8-13H,2-7H2,1H3,(H2,21,25)(H,24,29)	RHZSIUFNUCAGPL-UHFFFAOYSA-N	424.197136708							107875
SMR000067863	LSM-19253	SID24840263, SID3714319, BRD-K66008044	2594875	InChI=1S/C20H20N4O5S/c25-19(14-28-17-8-6-16(7-9-17)20-22-21-15-29-20)23-10-12-24(13-11-23)30(26,27)18-4-2-1-3-5-18/h1-9,15H,10-14H2	RYJDOSORDXMJJC-UHFFFAOYSA-N	O=C(COc1ccc(cc1)c2ocnn2)N3CCN(CC3)S(=O)(=O)c4ccccc4	BroadT	BRD-K66008044	BRD-K66008044-001-05-6	Enamine Ltd.	T5330976			O=C(COc1ccc(cc1)-c1nnco1)N1CCN(CC1)S(=O)(=O)c1ccccc1	InChI=1S/C20H20N4O5S/c25-19(14-28-17-8-6-16(7-9-17)20-22-21-15-29-20)23-10-12-24(13-11-23)30(26,27)18-4-2-1-3-5-18/h1-9,15H,10-14H2	RYJDOSORDXMJJC-UHFFFAOYSA-N	428.11544047							107876
STK117657	LSM-15543	BRD-K72606380	650547	InChI=1S/C17H28N2O2/c1-13(2)6-9-18-17(20)15-7-10-19(11-8-15)12-16-5-4-14(3)21-16/h4-5,13,15H,6-12H2,1-3H3,(H,18,20)	HFPIDFFBVYFKEL-UHFFFAOYSA-N	CC(C)CCNC(=O)C1CCN(Cc2oc(C)cc2)CC1	BroadT	BRD-K72606380	BRD-K72606380-034-05-2	Asinex Ltd.	BAS 04933826		OC(=O)C(=O)O	CC(C)CCNC(=O)C1CCN(Cc2ccc(C)o2)CC1.OC(=O)C(=O)O	InChI=1S/C17H28N2O2.C2H2O4/c1-13(2)6-9-18-17(20)15-7-10-19(11-8-15)12-16-5-4-14(3)21-16;3-1(4)2(5)6/h4-5,13,15H,6-12H2,1-3H3,(H,18,20);(H,3,4)(H,5,6)	DOKFYLFDPPDFGM-UHFFFAOYSA-N	292.215078156							104179, 104179
AC1OJ3KB	LSM-19254	SID24796753, BRD-K28079131	7313784	InChI=1S/C14H11FN8/c1-7-8(6-16)13(18)23-14(19-7)11(12(17)22-23)21-20-10-5-3-2-4-9(10)15/h2-5H,18H2,1H3,(H2,17,22)	HRFZSQDGLKUGKE-UHFFFAOYSA-N	Cc1nc2c(N=Nc3ccccc3F)c(N)nn2c(N)c1C#N	BroadT	BRD-K28079131	BRD-K28079131-001-06-6	Specs	AO-476/43201415			Cc1nc2c(N=Nc3ccccc3F)c(N)nn2c(N)c1C#N	InChI=1S/C14H11FN8/c1-7-8(6-16)13(18)23-14(19-7)11(12(17)22-23)21-20-10-5-3-2-4-9(10)15/h2-5H,18H2,1H3,(H2,17,22)	HRFZSQDGLKUGKE-UHFFFAOYSA-N	310.109070632							
SMR000092605	LSM-19255	SID7965636, BRD-A61790869	5307737	InChI=1S/C25H29NO5/c1-15-7-5-6-12-26(15)14-19-20(27)10-9-18-24(28)23(16(2)31-25(18)19)17-8-11-21(29-3)22(13-17)30-4/h8-11,13,15,27H,5-7,12,14H2,1-4H3	IINMZGISHVSUFF-UHFFFAOYSA-N	COc1ccc(cc1OC)C2=C(C)Oc3c(CN4CCCCC4C)c(O)ccc3C2=O	BroadT	BRD-A61790869	BRD-A61790869-001-04-1	ChemDiv Inc.	6737-0999			COc1ccc(cc1OC)-c1c(C)oc2c(CN3CCCCC3C)c(O)ccc2c1=O	InChI=1S/C25H29NO5/c1-15-7-5-6-12-26(15)14-19-20(27)10-9-18-24(28)23(16(2)31-25(18)19)17-8-11-21(29-3)22(13-17)30-4/h8-11,13,15,27H,5-7,12,14H2,1-4H3	IINMZGISHVSUFF-UHFFFAOYSA-N	423.204573038							107878
SMR000023675	LSM-19256	SID4247397, BRD-K03350751	3241613	InChI=1S/C21H20N2O5/c1-25-14-6-8-15-12(10-14)4-7-16-19(23-28-20(15)16)21(24)22-13-5-9-17(26-2)18(11-13)27-3/h5-6,8-11H,4,7H2,1-3H3,(H,22,24)	PELZYFPYXBGSIZ-UHFFFAOYSA-N	COc1ccc2c(CCc3c2onc3C(=O)Nc4ccc(OC)c(OC)c4)c1	BroadT	BRD-K03350751	BRD-K03350751-001-05-1	ChemDiv Inc.	C226-4066			COc1ccc2-c3onc(C(=O)Nc4ccc(OC)c(OC)c4)c3CCc2c1	InChI=1S/C21H20N2O5/c1-25-14-6-8-15-12(10-14)4-7-16-19(23-28-20(15)16)21(24)22-13-5-9-17(26-2)18(11-13)27-3/h5-6,8-11H,4,7H2,1-3H3,(H,22,24)	PELZYFPYXBGSIZ-UHFFFAOYSA-N	380.13722176							107879
AC1NAD3G	LSM-19257	BRD-A28661260	4425035	InChI=1S/C18H18N2O2/c21-17-10-13-4-2-1-3-12(13)9-15(17)18(22)20-19-16-8-11-5-6-14(16)7-11/h1-4,9-11,14,21H,5-8H2,(H,20,22)	GUXLIZBICPCSSH-UHFFFAOYSA-N	Oc1cc2ccccc2cc1C(=O)NN=C3CC4CCC3C4	BroadT	BRD-A28661260	BRD-A28661260-001-05-8	Specs	AK-968/40225261			Oc1cc2ccccc2cc1C(=O)NN=C1CC2CCC1C2	InChI=1S/C18H18N2O2/c21-17-10-13-4-2-1-3-12(13)9-15(17)18(22)20-19-16-8-11-5-6-14(16)7-11/h1-4,9-11,14,21H,5-8H2,(H,20,22)	GUXLIZBICPCSSH-UHFFFAOYSA-N	294.136827836							107880
SMR000067358	LSM-19258	SID3715824, BRD-K96605449	2087459	InChI=1S/C18H15N3O3S3/c19-10-12-7-9-25-17(12)21-15(22)11-24-16(23)6-3-8-26-18-20-13-4-1-2-5-14(13)27-18/h1-2,4-5,7,9H,3,6,8,11H2,(H,21,22)	CPHFURNGUZCKJW-UHFFFAOYSA-N	O=C(COC(=O)CCCSc1nc2ccccc2s1)Nc3sccc3C#N	BroadT	BRD-K96605449	BRD-K96605449-001-06-2	Enamine Ltd.	T5264339			O=C(COC(=O)CCCSc1nc2ccccc2s1)Nc1sccc1C#N	InChI=1S/C18H15N3O3S3/c19-10-12-7-9-25-17(12)21-15(22)11-24-16(23)6-3-8-26-18-20-13-4-1-2-5-14(13)27-18/h1-2,4-5,7,9H,3,6,8,11H2,(H,21,22)	CPHFURNGUZCKJW-UHFFFAOYSA-N	417.02755344							107881
ST50002594	LSM-19259	SID17509154, BRD-K74196031	1102016	InChI=1S/C21H14BrF3N4OS/c22-17-18(20(30)28-9-3-6-12-5-1-2-7-14(12)28)27-29-16(21(23,24)25)11-13(26-19(17)29)15-8-4-10-31-15/h1-2,4-5,7-8,10-11H,3,6,9H2	NDSCASPUZDGXFQ-UHFFFAOYSA-N	FC(F)(F)c1cc(nc2c(Br)c(nn12)C(=O)N3CCCc4ccccc34)c5cccs5	BroadT	BRD-K74196031	BRD-K74196031-001-05-4	Asinex Ltd.	BAS 00435184			FC(F)(F)c1cc(nc2c(Br)c(nn12)C(=O)N1CCCc2ccccc12)-c1cccs1	InChI=1S/C21H14BrF3N4OS/c22-17-18(20(30)28-9-3-6-12-5-1-2-7-14(12)28)27-29-16(21(23,24)25)11-13(26-19(17)29)15-8-4-10-31-15/h1-2,4-5,7-8,10-11H,3,6,9H2	NDSCASPUZDGXFQ-UHFFFAOYSA-N	506.002378998							107882
SMR000113997	LSM-19260	SID14718677, BRD-K04374239	828528	InChI=1S/C12H12ClN3OS/c1-3-10(17)16-12(18-2)14-11(15-16)8-4-6-9(13)7-5-8/h4-7H,3H2,1-2H3	FOVVBQGJNFWDHB-UHFFFAOYSA-N	CCC(=O)n1nc(nc1SC)c2ccc(Cl)cc2	BroadT	BRD-K04374239	BRD-K04374239-001-05-2	Specs	AE-848/42278369			CCC(=O)n1nc(nc1SC)-c1ccc(Cl)cc1	InChI=1S/C12H12ClN3OS/c1-3-10(17)16-12(18-2)14-11(15-16)8-4-6-9(13)7-5-8/h4-7H,3H2,1-2H3	FOVVBQGJNFWDHB-UHFFFAOYSA-N	281.038960434							107883
4-Methyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid cyclohexyl-methyl-amide	LSM-19261	SID845228, BRD-K93077412	647570	InChI=1S/C15H20N2OS/c1-16(11-6-4-3-5-7-11)15(18)13-10-14-12(17(13)2)8-9-19-14/h8-11H,3-7H2,1-2H3	AKTYXVQVZJLCEL-UHFFFAOYSA-N	CN(C1CCCCC1)C(=O)c2cc3sccc3n2C	BroadT	BRD-K93077412	BRD-K93077412-001-06-0	Asinex Ltd.	ASN 06915136			CN(C1CCCCC1)C(=O)c1cc2sccc2n1C	InChI=1S/C15H20N2OS/c1-16(11-6-4-3-5-7-11)15(18)13-10-14-12(17(13)2)8-9-19-14/h8-11H,3-7H2,1-2H3	AKTYXVQVZJLCEL-UHFFFAOYSA-N	276.12963397							107884
MLS000331001	LSM-43826	SID17514089, BRD-K30199050	1949948	InChI=1S/C28H25N3O3/c1-19-8-5-6-12-24(19)31-27(33)23(26(32)29-28(31)34)17-21-13-14-25-22(16-21)11-7-15-30(25)18-20-9-3-2-4-10-20/h2-6,8-10,12-14,16-17H,7,11,15,18H2,1H3,(H,29,32,34)/b23-17+	QGPFSAWVISDZSY-HAVVHWLPSA-N	Cc1ccccc1N2C(=O)NC(=O)\C(=C/c3ccc4N(Cc5ccccc5)CCCc4c3)\C2=O	BroadT	BRD-K30199050	BRD-K30199050-001-05-7	InterBioScreen Ltd.	STOCK4S-15299			Cc1ccccc1N1C(=O)NC(=O)\C(=C/c2ccc3N(Cc4ccccc4)CCCc3c2)C1=O	InChI=1S/C28H25N3O3/c1-19-8-5-6-12-24(19)31-27(33)23(26(32)29-28(31)34)17-21-13-14-25-22(16-21)11-7-15-30(25)18-20-9-3-2-4-10-20/h2-6,8-10,12-14,16-17H,7,11,15,18H2,1H3,(H,29,32,34)/b23-17+	QGPFSAWVISDZSY-HAVVHWLPSA-N	451.18959169							
T5342706	LSM-19263	SID3716595, BRD-K13556784	2999676	InChI=1S/C21H17N3O4/c1-2-24-20(26)15-9-4-3-8-14(15)19(23-24)21(27)28-12-18(25)16-11-22-17-10-6-5-7-13(16)17/h3-11,22H,2,12H2,1H3	ONJHHTGWCSZDBZ-UHFFFAOYSA-N	CCN1N=C(C(=O)OCC(=O)c2c[nH]c3ccccc23)c4ccccc4C1=O	BroadT	BRD-K13556784	BRD-K13556784-001-05-2	Enamine Ltd.	T5342706			CCn1nc(C(=O)OCC(=O)c2c[nH]c3ccccc23)c2ccccc2c1=O	InChI=1S/C21H17N3O4/c1-2-24-20(26)15-9-4-3-8-14(15)19(23-24)21(27)28-12-18(25)16-11-22-17-10-6-5-7-13(16)17/h3-11,22H,2,12H2,1H3	ONJHHTGWCSZDBZ-UHFFFAOYSA-N	375.121906054							107886
ST50675972	LSM-19264	SID4249737, BRD-K79971029	3243647	InChI=1S/C14H16N2O3/c1-9(2)15-14(17)12-8-13(19-16-12)10-4-6-11(18-3)7-5-10/h4-9H,1-3H3,(H,15,17)	OTTGQCPZINNXJF-UHFFFAOYSA-N	COc1ccc(cc1)c2onc(c2)C(=O)NC(C)C	BroadT	BRD-K79971029	BRD-K79971029-001-05-9	ChemDiv Inc.	C226-0719			COc1ccc(cc1)-c1cc(no1)C(=O)NC(C)C	InChI=1S/C14H16N2O3/c1-9(2)15-14(17)12-8-13(19-16-12)10-4-6-11(18-3)7-5-10/h4-9H,1-3H3,(H,15,17)	OTTGQCPZINNXJF-UHFFFAOYSA-N	260.116092392							107887
ST50279824	LSM-19265	SID14727219, BRD-K21453116	756538	InChI=1S/C17H13F3N4/c18-17(19,20)15-9-14(13-6-2-1-3-7-13)23-16(24-15)22-11-12-5-4-8-21-10-12/h1-10H,11H2,(H,22,23,24)	JUYPHOHITMKBLE-UHFFFAOYSA-N	FC(F)(F)c1cc(nc(NCc2cccnc2)n1)c3ccccc3	BroadT	BRD-K21453116	BRD-K21453116-001-06-9	Asinex Ltd.	BAS 06331899			FC(F)(F)c1cc(nc(NCc2cccnc2)n1)-c1ccccc1	InChI=1S/C17H13F3N4/c18-17(19,20)15-9-14(13-6-2-1-3-7-13)23-16(24-15)22-11-12-5-4-8-21-10-12/h1-10H,11H2,(H,22,23,24)	JUYPHOHITMKBLE-UHFFFAOYSA-N	330.109231056							107888
SMR000067903	LSM-19266	SID3717940, BRD-A22333896	3000202	InChI=1S/C21H18N4O2S2/c1-25-19(18-12-26-16-9-5-6-10-17(16)27-18)23-24-21(25)28-13-15-11-22-20(29-15)14-7-3-2-4-8-14/h2-11,18H,12-13H2,1H3	DPJAHZOGWFLFRF-UHFFFAOYSA-N	Cn1c(SCc2cnc(s2)c3ccccc3)nnc1C4COc5ccccc5O4	BroadT	BRD-A22333896	BRD-A22333896-001-06-0	Enamine Ltd.	T5331360			Cn1c(SCc2cnc(s2)-c2ccccc2)nnc1C1COc2ccccc2O1	InChI=1S/C21H18N4O2S2/c1-25-19(18-12-26-16-9-5-6-10-17(16)27-18)23-24-21(25)28-13-15-11-22-20(29-15)14-7-3-2-4-8-14/h2-11,18H,12-13H2,1H3	DPJAHZOGWFLFRF-UHFFFAOYSA-N	422.087117236							107889
CHEMDIV1_009586	LSM-15289	BRD-K32936009	2349635	InChI=1S/C24H25N5O/c1-2-7-19(8-3-1)18-28-12-14-29(15-13-28)24-26-22-11-5-4-10-21(22)23(27-24)25-17-20-9-6-16-30-20/h1-11,16H,12-15,17-18H2,(H,25,26,27)	JRTQKLGEKVVPGF-UHFFFAOYSA-N	C(Nc1nc(nc2ccccc12)N3CCN(Cc4ccccc4)CC3)c5occc5	BroadT	BRD-K32936009	BRD-K32936009-003-07-4	Enamine Ltd.	T0507-0051		Cl	C(Nc1nc(nc2ccccc12)N1CCN(Cc2ccccc2)CC1)c1ccco1.Cl	InChI=1S/C24H25N5O.ClH/c1-2-7-19(8-3-1)18-28-12-14-29(15-13-28)24-26-22-11-5-4-10-21(22)23(27-24)25-17-20-9-6-16-30-20;/h1-11,16H,12-15,17-18H2,(H,25,26,27);1H	URASQJJESLYAKM-UHFFFAOYSA-N	399.20591047							103936, 103936
AC1M1PPT	LSM-19267	BRD-K23208377	2103020	InChI=1S/C18H19N3O4/c1-23-15-5-3-14(4-6-15)19-12-18(22)21-20-11-13-2-7-16-17(10-13)25-9-8-24-16/h2-7,10-11,19H,8-9,12H2,1H3,(H,21,22)	VMRMKPQSNYOUMW-UHFFFAOYSA-N	COc1ccc(NCC(=O)NN=Cc2ccc3OCCOc3c2)cc1	BroadT	BRD-K23208377	BRD-K23208377-001-05-1	Enamine Ltd.	T5235825			COc1ccc(NCC(=O)NN=Cc2ccc3OCCOc3c2)cc1	InChI=1S/C18H19N3O4/c1-23-15-5-3-14(4-6-15)19-12-18(22)21-20-11-13-2-7-16-17(10-13)25-9-8-24-16/h2-7,10-11,19H,8-9,12H2,1H3,(H,21,22)	VMRMKPQSNYOUMW-UHFFFAOYSA-N	341.137556118							107890
SMR000073090	LSM-19268	SID4255122, BRD-K00399969	1315470	InChI=1S/C19H20Cl2N2O2/c1-22-8-10-23(11-9-22)19(24)15-4-2-14(3-5-15)13-25-18-7-6-16(20)12-17(18)21/h2-7,12H,8-11,13H2,1H3	NRYVKUUAQCDZHH-UHFFFAOYSA-N	CN1CCN(CC1)C(=O)c2ccc(COc3ccc(Cl)cc3Cl)cc2	BroadT	BRD-K00399969	BRD-K00399969-001-05-9	ChemBridge Corporation	7516187			CN1CCN(CC1)C(=O)c1ccc(COc2ccc(Cl)cc2Cl)cc1	InChI=1S/C19H20Cl2N2O2/c1-22-8-10-23(11-9-22)19(24)15-4-2-14(3-5-15)13-25-18-7-6-16(20)12-17(18)21/h2-7,12H,8-11,13H2,1H3	NRYVKUUAQCDZHH-UHFFFAOYSA-N	378.09018332							107891
SMR000196165	LSM-19269	SID17506504, BRD-K00888242	1332281	InChI=1S/C20H13BrN2O5/c21-16-11-10-13(12-17(16)23(26)27)20(25)28-18-9-5-4-8-15(18)19(24)22-14-6-2-1-3-7-14/h1-12H,(H,22,24)	ONLMRIYNWGCRLQ-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1Br)C(=O)Oc2ccccc2C(=O)Nc3ccccc3	BroadT	BRD-K00888242	BRD-K00888242-001-05-0	ChemBridge Corporation	6738206			[O-][N+](=O)c1cc(ccc1Br)C(=O)Oc1ccccc1C(=O)Nc1ccccc1	InChI=1S/C20H13BrN2O5/c21-16-11-10-13(12-17(16)23(26)27)20(25)28-18-9-5-4-8-15(18)19(24)22-14-6-2-1-3-7-14/h1-12H,(H,22,24)	ONLMRIYNWGCRLQ-UHFFFAOYSA-N	440.000784136							107892
MLS000773738	LSM-3464	BRD-K65742362, SID24834029, SID56373499, SID56405543, SID87350308	5040456	InChI=1S/C15H14N2O3S2/c1-16(2)22(19,20)12-7-5-6-11(10-12)17-15(18)13-8-3-4-9-14(13)21-17/h3-10H,1-2H3	SHVMSYDTOYCGDZ-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cccc(c1)N2Sc3ccccc3C2=O	BroadT	BRD-K65742362	BRD-K65742362-001-04-8	University of Kansas	KUC104125N			CN(C)S(=O)(=O)c1cccc(c1)-n1sc2ccccc2c1=O	InChI=1S/C15H14N2O3S2/c1-16(2)22(19,20)12-7-5-6-11(10-12)17-15(18)13-8-3-4-9-14(13)21-17/h3-10H,1-2H3	SHVMSYDTOYCGDZ-UHFFFAOYSA-N	334.044583708							93150
AC1M3RJ5	LSM-19270	SID24794648, BRD-K26669422	2243106	InChI=1S/C17H17N3S2/c21-17-19-18-16(20(17)15-9-5-2-6-10-15)11-12-22-13-14-7-3-1-4-8-14/h1-10H,11-13H2,(H,19,21)	XJTAQHQRWZHOPW-UHFFFAOYSA-N	Sc1nnc(CCSCc2ccccc2)n1c3ccccc3	BroadT	BRD-K26669422	BRD-K26669422-001-05-6	ChemBridge Corporation	7990747			Sc1nnc(CCSCc2ccccc2)n1-c1ccccc1	InChI=1S/C17H17N3S2/c21-17-19-18-16(20(17)15-9-5-2-6-10-15)11-12-22-13-14-7-3-1-4-8-14/h1-10H,11-13H2,(H,19,21)	XJTAQHQRWZHOPW-UHFFFAOYSA-N	327.086388954							107893
MLS000324466	LSM-19271	SID17386960, BRD-K56620303	1790448	InChI=1S/C11H8BrN3O3S2/c12-8-4-3-6(18-8)9(16)13-11(19)15-14-10(17)7-2-1-5-20-7/h1-5H,(H,14,17)(H2,13,15,16,19)	NLKORLKZQPZEEI-UHFFFAOYSA-N	Brc1oc(cc1)C(=O)NC(=S)NNC(=O)c2cccs2	BroadT	BRD-K56620303	BRD-K56620303-001-05-6	Specs	AN-329/41559355			Brc1ccc(o1)C(=O)NC(=S)NNC(=O)c1cccs1	InChI=1S/C11H8BrN3O3S2/c12-8-4-3-6(18-8)9(16)13-11(19)15-14-10(17)7-2-1-5-20-7/h1-5H,(H,14,17)(H2,13,15,16,19)	NLKORLKZQPZEEI-UHFFFAOYSA-N	372.919045126							107894
ZINC00135170	LSM-19272	SID859962, BRD-K06485050	661264	InChI=1S/C15H14ClN3O/c16-12-6-4-11(5-7-12)14-18-13(10-17)15(20-14)19-8-2-1-3-9-19/h4-7H,1-3,8-9H2	WQKOIGIXISYXPV-UHFFFAOYSA-N	Clc1ccc(cc1)c2oc(N3CCCCC3)c(n2)C#N	BroadT	BRD-K06485050	BRD-K06485050-001-05-0	InterBioScreen Ltd.	STOCK3S-36667			Clc1ccc(cc1)-c1nc(C#N)c(o1)N1CCCCC1	InChI=1S/C15H14ClN3O/c16-12-6-4-11(5-7-12)14-18-13(10-17)15(20-14)19-8-2-1-3-9-19/h4-7H,1-3,8-9H2	WQKOIGIXISYXPV-UHFFFAOYSA-N	287.082539808							107895
MLS000064704	LSM-19273	SID4258076, BRD-K06696296	972599	InChI=1S/C15H11N5S/c1-2-4-11(5-3-1)10-13-17-18-15-20(13)19-14(21-15)12-6-8-16-9-7-12/h1-9H,10H2	WTSQTCFACOPZNI-UHFFFAOYSA-N	C(c1ccccc1)c2nnc3sc(nn23)c4ccncc4	BroadT	BRD-K06696296	BRD-K06696296-001-05-6	ChemBridge Corporation	7855639			C(c1nnc2sc(nn12)-c1ccncc1)c1ccccc1	InChI=1S/C15H11N5S/c1-2-4-11(5-3-1)10-13-17-18-15-20(13)19-14(21-15)12-6-8-16-9-7-12/h1-9H,10H2	WTSQTCFACOPZNI-UHFFFAOYSA-N	293.073516092							107896
SMR000241462	LSM-19274	SID24779899, BRD-K36262909	2088486	InChI=1S/C22H17N3O3S2/c26-21(24-22-23-18-9-2-4-11-20(18)29-22)16-7-5-8-17(14-16)30(27,28)25-13-12-15-6-1-3-10-19(15)25/h1-11,14H,12-13H2,(H,23,24,26)	RIJJJSYFNVSOLS-UHFFFAOYSA-N	O=C(Nc1nc2ccccc2s1)c3cccc(c3)S(=O)(=O)N4CCc5ccccc45	BroadT	BRD-K36262909	BRD-K36262909-001-07-6	Enamine Ltd.	T5265289			O=C(Nc1nc2ccccc2s1)c1cccc(c1)S(=O)(=O)N1CCc2ccccc12	InChI=1S/C22H17N3O3S2/c26-21(24-22-23-18-9-2-4-11-20(18)29-22)16-7-5-8-17(14-16)30(27,28)25-13-12-15-6-1-3-10-19(15)25/h1-11,14H,12-13H2,(H,23,24,26)	RIJJJSYFNVSOLS-UHFFFAOYSA-N	435.071132814							107897
2-(Pyridin-4-yl)quinazolin-4-ol	LSM-19275	SID3715290, BRD-K97414323	722911	InChI=1S/C13H9N3O/c17-13-10-3-1-2-4-11(10)15-12(16-13)9-5-7-14-8-6-9/h1-8H,(H,15,16,17)	QYVWMIMELRGQGM-UHFFFAOYSA-N	Oc1nc(nc2ccccc12)c3ccncc3	BroadT	BRD-K97414323	BRD-K97414323-001-05-1	Enamine Ltd.	T0500-0109			Oc1nc(nc2ccccc12)-c1ccncc1	InChI=1S/C13H9N3O/c17-13-10-3-1-2-4-11(10)15-12(16-13)9-5-7-14-8-6-9/h1-8H,(H,15,16,17)	QYVWMIMELRGQGM-UHFFFAOYSA-N	223.074561938							107898
SMR000212405	LSM-19276	BRD-K32613695	4219997	InChI=1S/C27H23N5O4/c1-17-23(26(33)30(28-17)20-11-5-3-6-12-20)25(19-10-9-15-22(16-19)32(35)36)24-18(2)29-31(27(24)34)21-13-7-4-8-14-21/h3-16,25,33-34H,1-2H3	HVQBMIZMVLLYJW-UHFFFAOYSA-N	Cc1nn(c(O)c1C(c2cccc(c2)[N+](=O)[O-])c3c(C)nn(c3O)c4ccccc4)c5ccccc5	BroadT	BRD-K32613695	BRD-K32613695-001-07-2	InterBioScreen Ltd.	STOCK2S-48943			Cc1nn(c(O)c1C(c1c(C)nn(c1O)-c1ccccc1)c1cccc(c1)[N+]([O-])=O)-c1ccccc1	InChI=1S/C27H23N5O4/c1-17-23(26(33)30(28-17)20-11-5-3-6-12-20)25(19-10-9-15-22(16-19)32(35)36)24-18(2)29-31(27(24)34)21-13-7-4-8-14-21/h3-16,25,33-34H,1-2H3	HVQBMIZMVLLYJW-UHFFFAOYSA-N	481.175004266							
ASN 05923411	LSM-19277	SID847531, BRD-K86764418	649938	InChI=1S/C19H22N4O3S/c1-4-25-13-8-9-16(26-5-2)15(11-13)21-17(24)12-27-19-22-14-7-6-10-20-18(14)23(19)3/h6-11H,4-5,12H2,1-3H3,(H,21,24)	DPFRLQUOOVXBLR-UHFFFAOYSA-N	CCOc1ccc(OCC)c(NC(=O)CSc2nc3cccnc3n2C)c1	BroadT	BRD-K86764418	BRD-K86764418-001-05-8	Asinex Ltd.	ASN 05923411			CCOc1ccc(OCC)c(NC(=O)CSc2nc3cccnc3n2C)c1	InChI=1S/C19H22N4O3S/c1-4-25-13-8-9-16(26-5-2)15(11-13)21-17(24)12-27-19-22-14-7-6-10-20-18(14)23(19)3/h6-11H,4-5,12H2,1-3H3,(H,21,24)	DPFRLQUOOVXBLR-UHFFFAOYSA-N	386.141261294							107900
SMR000200556	LSM-19278	SID17416014, BRD-K76524005	1254477	InChI=1S/C21H14N2O7/c1-28-17-7-6-12(14-10-13-4-2-3-5-16(13)30-21(14)25)11-15(17)22-20(24)18-8-9-19(29-18)23(26)27/h2-11H,1H3,(H,22,24)	OMSVVPQVNMIRMW-UHFFFAOYSA-N	COc1ccc(cc1NC(=O)c2oc(cc2)[N+](=O)[O-])C3=Cc4ccccc4OC3=O	BroadT	BRD-K76524005	BRD-K76524005-001-08-1	ChemBridge Corporation	7912531			COc1ccc(cc1NC(=O)c1ccc(o1)[N+]([O-])=O)-c1cc2ccccc2oc1=O	InChI=1S/C21H14N2O7/c1-28-17-7-6-12(14-10-13-4-2-3-5-16(13)30-21(14)25)11-15(17)22-20(24)18-8-9-19(29-18)23(26)27/h2-11H,1H3,(H,22,24)	OMSVVPQVNMIRMW-UHFFFAOYSA-N	406.080100808							107901
SMR000103188	LSM-19279	SID7972610, BRD-K24914740	1069854	InChI=1S/C18H16F3N5O/c19-18(20,21)14-11-13(12-7-3-1-4-8-12)22-17-23-15(24-26(14)17)16(27)25-9-5-2-6-10-25/h1,3-4,7-8,11H,2,5-6,9-10H2	DWJZGTNNROOOQQ-UHFFFAOYSA-N	FC(F)(F)c1cc(nc2nc(nn12)C(=O)N3CCCCC3)c4ccccc4	BroadT	BRD-K24914740	BRD-K24914740-001-04-6	ChemBridge Corporation	5340932			FC(F)(F)c1cc(nc2nc(nn12)C(=O)N1CCCCC1)-c1ccccc1	InChI=1S/C18H16F3N5O/c19-18(20,21)14-11-13(12-7-3-1-4-8-12)22-17-23-15(24-26(14)17)16(27)25-9-5-2-6-10-25/h1,3-4,7-8,11H,2,5-6,9-10H2	DWJZGTNNROOOQQ-UHFFFAOYSA-N	375.130694782							107902
MLS000032581	LSM-19280	SID50086667, SID845955, BRD-K89177913	648323	InChI=1S/C21H22O8/c1-12-14(9-18(28-12)20(22)25-4)11-27-15-5-6-17-16(10-15)19(13(2)29-17)21(23)26-8-7-24-3/h5-6,9-10H,7-8,11H2,1-4H3	RWGBHQGHZATKST-UHFFFAOYSA-N	COCCOC(=O)c1c(C)oc2ccc(OCc3cc(oc3C)C(=O)OC)cc12	BroadT	BRD-K89177913	BRD-K89177913-001-11-8	Asinex Ltd.	BAS 02770991			COCCOC(=O)c1c(C)oc2ccc(OCc3cc(oc3C)C(=O)OC)cc12	InChI=1S/C21H22O8/c1-12-14(9-18(28-12)20(22)25-4)11-27-15-5-6-17-16(10-15)19(13(2)29-17)21(23)26-8-7-24-3/h5-6,9-10H,7-8,11H2,1-4H3	RWGBHQGHZATKST-UHFFFAOYSA-N	402.131467664							107903
AC1MMT1U	LSM-19281	SID4250115, BRD-A16778483	3243973	InChI=1S/C23H21N3OS/c1-28-17-12-10-15(11-13-17)21-18(14-24)23(25)26(16-6-3-2-4-7-16)19-8-5-9-20(27)22(19)21/h2-4,6-7,10-13,21H,5,8-9,25H2,1H3	ABIJROWADOHEER-UHFFFAOYSA-N	CSc1ccc(cc1)C2C(=C(N)N(C3=C2C(=O)CCC3)c4ccccc4)C#N	BroadT	BRD-A16778483	BRD-A16778483-001-06-3	ChemDiv Inc.	8007-1075			CSc1ccc(cc1)C1C(C#N)=C(N)N(c2ccccc2)C2=C1C(=O)CCC2	InChI=1S/C23H21N3OS/c1-28-17-12-10-15(11-13-17)21-18(14-24)23(25)26(16-6-3-2-4-7-16)19-8-5-9-20(27)22(19)21/h2-4,6-7,10-13,21H,5,8-9,25H2,1H3	ABIJROWADOHEER-UHFFFAOYSA-N	387.140533012							107904
SMR000072353	LSM-19282	SID4258695, BRD-K91320102	1314297	InChI=1S/C19H17BrN2O3/c1-3-22-10-16(17(23)15-8-7-12(2)21-18(15)22)19(24)25-11-13-5-4-6-14(20)9-13/h4-10H,3,11H2,1-2H3	HYRUBJVYVQGUEZ-UHFFFAOYSA-N	CCN1C=C(C(=O)OCc2cccc(Br)c2)C(=O)c3ccc(C)nc13	BroadT	BRD-K91320102	BRD-K91320102-001-05-3	ChemBridge Corporation	7380164			CCn1cc(C(=O)OCc2cccc(Br)c2)c(=O)c2ccc(C)nc12	InChI=1S/C19H17BrN2O3/c1-3-22-10-16(17(23)15-8-7-12(2)21-18(15)22)19(24)25-11-13-5-4-6-14(20)9-13/h4-10H,3,11H2,1-2H3	HYRUBJVYVQGUEZ-UHFFFAOYSA-N	400.042255024							107905
Methyl 1-oxo-1H-isothiochromene-3-carboxylate	LSM-19283	SID4246538, BRD-K90062066	345568	InChI=1S/C11H8O3S/c1-14-10(12)9-6-7-4-2-3-5-8(7)11(13)15-9/h2-6H,1H3	LXCBRCMMHXRQIR-UHFFFAOYSA-N	COC(=O)C1=Cc2ccccc2C(=O)S1	BroadT	BRD-K90062066	BRD-K90062066-001-05-6	ChemDiv Inc.	6451-0726			COC(=O)c1cc2ccccc2c(=O)s1	InChI=1S/C11H8O3S/c1-14-10(12)9-6-7-4-2-3-5-8(7)11(13)15-9/h2-6H,1H3	LXCBRCMMHXRQIR-UHFFFAOYSA-N	220.019414806							107906
N-[1-(2-Bromo-benzyl)-2-oxo-1,2-dihydro-pyridin-3-yl]-butyramide	LSM-19284	SID842666, BRD-K53045739	644937	InChI=1S/C16H17BrN2O2/c1-2-6-15(20)18-14-9-5-10-19(16(14)21)11-12-7-3-4-8-13(12)17/h3-5,7-10H,2,6,11H2,1H3,(H,18,20)	BPFUGBZZHVRKKK-UHFFFAOYSA-N	CCCC(=O)NC1=CC=CN(Cc2ccccc2Br)C1=O	BroadT	BRD-K53045739	BRD-K53045739-001-05-3	Asinex Ltd.	ASN 10014574			CCCC(=O)Nc1cccn(Cc2ccccc2Br)c1=O	InChI=1S/C16H17BrN2O2/c1-2-6-15(20)18-14-9-5-10-19(16(14)21)11-12-7-3-4-8-13(12)17/h3-5,7-10H,2,6,11H2,1H3,(H,18,20)	BPFUGBZZHVRKKK-UHFFFAOYSA-N	348.047340404							107907
SMR000141560	LSM-19285	SID14736515, BRD-K29318973	1819215	InChI=1S/C17H25N5OS/c1-5-18-15-20-16(19-12(2)3)22-17(21-15)24-11-10-23-14-8-6-13(4)7-9-14/h6-9,12H,5,10-11H2,1-4H3,(H2,18,19,20,21,22)	NZQDIZLTOXEKBJ-UHFFFAOYSA-N	CCNc1nc(NC(C)C)nc(SCCOc2ccc(C)cc2)n1	BroadT	BRD-K29318973	BRD-K29318973-001-05-0	ChemBridge Corporation	6678205			CCNc1nc(NC(C)C)nc(SCCOc2ccc(C)cc2)n1	InChI=1S/C17H25N5OS/c1-5-18-15-20-16(19-12(2)3)22-17(21-15)24-11-10-23-14-8-6-13(4)7-9-14/h6-9,12H,5,10-11H2,1-4H3,(H2,18,19,20,21,22)	NZQDIZLTOXEKBJ-UHFFFAOYSA-N	347.17798116							107908
ST50113127	LSM-15199	BRD-K70700733	1352838	InChI=1S/C24H27N2O/c1-18-7-11-20(12-8-18)22-16-25(24-6-4-3-5-15-26(22)24)17-23(27)21-13-9-19(2)10-14-21/h7-14,16H,3-6,15,17H2,1-2H3/q+1	IFHMUNAIFQSUDX-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)Cn2cc(c3ccc(C)cc3)[n+]4CCCCCc24	BroadT	BRD-K70700733	BRD-K70700733-004-09-4	ChemBridge Corporation	5882967		Br	Cc1ccc(cc1)C(=O)Cn1cc(-c2ccc(C)cc2)[n+]2CCCCCc12.Br	InChI=1S/C24H27N2O.BrH/c1-18-7-11-20(12-8-18)22-16-25(24-6-4-3-5-15-26(22)24)17-23(27)21-13-9-19(2)10-14-21;/h7-14,16H,3-6,15,17H2,1-2H3;1H/q+1;	ANJFSNNPLUNHIK-UHFFFAOYSA-N	359.212338504							103849, 103849
SMR000027774	LSM-19286	BRD-A67879114	3241626	InChI=1S/C22H31N3O5S/c1-16-18(24-22(30-16)17-7-8-19(28-2)20(13-17)29-3)14-31(27)15-21(26)23-9-6-12-25-10-4-5-11-25/h7-8,13H,4-6,9-12,14-15H2,1-3H3,(H,23,26)	HTZDZRCLILGQEB-UHFFFAOYSA-N	COc1ccc(cc1OC)c2oc(C)c(CS(=O)CC(=O)NCCCN3CCCC3)n2	BroadT	BRD-A67879114	BRD-A67879114-001-05-6	ChemDiv Inc.	C527-1688			COc1ccc(cc1OC)-c1nc(CS(=O)CC(=O)NCCCN2CCCC2)c(C)o1	InChI=1S/C22H31N3O5S/c1-16-18(24-22(30-16)17-7-8-19(28-2)20(13-17)29-3)14-31(27)15-21(26)23-9-6-12-25-10-4-5-11-25/h7-8,13H,4-6,9-12,14-15H2,1-3H3,(H,23,26)	HTZDZRCLILGQEB-UHFFFAOYSA-N	449.198441812							107909
SMR000096542	LSM-19287	SID7968795, BRD-K39379713	5309608	InChI=1S/C18H19N3O3S/c1-3-24-14-7-4-12(5-8-14)19-18(23)20-13-6-9-16-15(10-13)21(2)17(22)11-25-16/h4-10H,3,11H2,1-2H3,(H2,19,20,23)	ZTGKFWXUZVCBAW-UHFFFAOYSA-N	CCOc1ccc(NC(=O)Nc2ccc3SCC(=O)N(C)c3c2)cc1	BroadT	BRD-K39379713	BRD-K39379713-001-04-8	ChemDiv Inc.	C791-0232			CCOc1ccc(NC(=O)Nc2ccc3SCC(=O)N(C)c3c2)cc1	InChI=1S/C18H19N3O3S/c1-3-24-14-7-4-12(5-8-14)19-18(23)20-13-6-9-16-15(10-13)21(2)17(22)11-25-16/h4-10H,3,11H2,1-2H3,(H2,19,20,23)	ZTGKFWXUZVCBAW-UHFFFAOYSA-N	357.114712188							107910
F2094-0611	LSM-19288	SID49677658, BRD-K20711747	18567300	InChI=1S/C18H18ClN3O3/c1-4-25-15-11(2)9-20-16-14(15)17(23)22(18(24)21(16)3)10-12-6-5-7-13(19)8-12/h5-9H,4,10H2,1-3H3	QSMJWYHULICDHE-UHFFFAOYSA-N	CCOc1c(C)cnc2N(C)C(=O)N(Cc3cccc(Cl)c3)C(=O)c12	BroadT	BRD-K20711747	BRD-K20711747-001-05-0	Life Chemicals Inc.	F2094-0611			CCOc1c(C)cnc2n(C)c(=O)n(Cc3cccc(Cl)c3)c(=O)c12	InChI=1S/C18H18ClN3O3/c1-4-25-15-11(2)9-20-16-14(15)17(23)22(18(24)21(16)3)10-12-6-5-7-13(19)8-12/h5-9H,4,10H2,1-3H3	QSMJWYHULICDHE-UHFFFAOYSA-N	359.103669176							107911
T5344323	LSM-19289	SID3716538, BRD-K61596148	2564250	InChI=1S/C19H17N3O4S3/c1-12-21-18-16(28-12)10-15(14-4-9-27-19(14)18)26-17-3-2-13(11-20-17)29(23,24)22-5-7-25-8-6-22/h2-4,9-11H,5-8H2,1H3	MPSXPWMJSXBEON-UHFFFAOYSA-N	Cc1nc2c(cc(Oc3ccc(cn3)S(=O)(=O)N4CCOCC4)c5ccsc25)s1	BroadT	BRD-K61596148	BRD-K61596148-001-06-8	Enamine Ltd.	T5344323			Cc1nc2c(cc(Oc3ccc(cn3)S(=O)(=O)N3CCOCC3)c3ccsc23)s1	InChI=1S/C19H17N3O4S3/c1-12-21-18-16(28-12)10-15(14-4-9-27-19(14)18)26-17-3-2-13(11-20-17)29(23,24)22-5-7-25-8-6-22/h2-4,9-11H,5-8H2,1H3	MPSXPWMJSXBEON-UHFFFAOYSA-N	447.038118124							107912
SMR000163659	LSM-19290	SID17401356, BRD-K79303561	1204410	InChI=1S/C26H22O6/c1-29-23-19(25(27)31-3)13-15-9-5-7-11-17(15)21(23)22-18-12-8-6-10-16(18)14-20(24(22)30-2)26(28)32-4/h5-14H,1-4H3	NWULKMYMWPIZAX-UHFFFAOYSA-N	COC(=O)c1cc2ccccc2c(c1OC)c3c(OC)c(cc4ccccc34)C(=O)OC	BroadT	BRD-K79303561	BRD-K79303561-001-05-9	Specs	AG-690/33061025			COC(=O)c1cc2ccccc2c(c1OC)-c1c(OC)c(cc2ccccc12)C(=O)OC	InChI=1S/C26H22O6/c1-29-23-19(25(27)31-3)13-15-9-5-7-11-17(15)21(23)22-18-12-8-6-10-16(18)14-20(24(22)30-2)26(28)32-4/h5-14H,1-4H3	NWULKMYMWPIZAX-UHFFFAOYSA-N	430.141638424							107913
SMR000031483	LSM-19291	SID4244407, BRD-K70032220	3239010	InChI=1S/C13H12N2O2/c16-13(17)11-3-1-2-4-12(11)15-9-10-5-7-14-8-6-10/h1-8,15H,9H2,(H,16,17)	UPPNJZSFIIFBPQ-UHFFFAOYSA-N	OC(=O)c1ccccc1NCc2ccncc2	BroadT	BRD-K70032220	BRD-K70032220-001-06-4	ChemDiv Inc.	K783-0927			OC(=O)c1ccccc1NCc1ccncc1	InChI=1S/C13H12N2O2/c16-13(17)11-3-1-2-4-12(11)15-9-10-5-7-14-8-6-10/h1-8,15H,9H2,(H,16,17)	UPPNJZSFIIFBPQ-UHFFFAOYSA-N	228.089877644							107914
F0608-1061	LSM-19292	SID24816540, BRD-K17578591	4226990	InChI=1S/C14H9ClN4O2/c15-11-5-1-3-9(7-11)12(20)17-14-19-18-13(21-14)10-4-2-6-16-8-10/h1-8H,(H,17,19,20)	QPPOTWCKNUADRF-UHFFFAOYSA-N	Clc1cccc(c1)C(=O)Nc2oc(nn2)c3cccnc3	BroadT	BRD-K17578591	BRD-K17578591-001-05-5	Life Chemicals Inc.	F0608-1061			Clc1cccc(c1)C(=O)Nc1nnc(o1)-c1cccnc1	InChI=1S/C14H9ClN4O2/c15-11-5-1-3-9(7-11)12(20)17-14-19-18-13(21-14)10-4-2-6-16-8-10/h1-8H,(H,17,19,20)	QPPOTWCKNUADRF-UHFFFAOYSA-N	300.041403278							107915
MLS000118848	LSM-19293	SID7969139, BRD-K24756689	5309796	InChI=1S/C24H32N4OS/c1-26-12-14-27(15-13-26)11-5-10-25-24(29)21-8-9-23-22(18-21)28(16-17-30-23)19-20-6-3-2-4-7-20/h2-4,6-9,18H,5,10-17,19H2,1H3,(H,25,29)	PGZXJQIYYBDFMR-UHFFFAOYSA-N	CN1CCN(CCCNC(=O)c2ccc3SCCN(Cc4ccccc4)c3c2)CC1	BroadT	BRD-K24756689	BRD-K24756689-001-04-4	ChemDiv Inc.	C699-0161			CN1CCN(CCCNC(=O)c2ccc3SCCN(Cc4ccccc4)c3c2)CC1	InChI=1S/C24H32N4OS/c1-26-12-14-27(15-13-26)11-5-10-25-24(29)21-8-9-23-22(18-21)28(16-17-30-23)19-20-6-3-2-4-7-20/h2-4,6-9,18H,5,10-17,19H2,1H3,(H,25,29)	PGZXJQIYYBDFMR-UHFFFAOYSA-N	424.229682374							107916
5-Methoxy-4-[(2-methoxyphenyl)sulfanyl]-2-phenylpyrimidine	LSM-19294	SID24822281, BRD-K56068834	1491532	InChI=1S/C18H16N2O2S/c1-21-14-10-6-7-11-16(14)23-18-15(22-2)12-19-17(20-18)13-8-4-3-5-9-13/h3-12H,1-2H3	VDPSZTZMXHJHPN-UHFFFAOYSA-N	COc1ccccc1Sc2nc(ncc2OC)c3ccccc3	BroadT	BRD-K56068834	BRD-K56068834-001-05-6	Key Organics Ltd.	1R-1187			COc1ccccc1Sc1nc(ncc1OC)-c1ccccc1	InChI=1S/C18H16N2O2S/c1-21-14-10-6-7-11-16(14)23-18-15(22-2)12-19-17(20-18)13-8-4-3-5-9-13/h3-12H,1-2H3	VDPSZTZMXHJHPN-UHFFFAOYSA-N	324.093248462							107917
AC1N68TH	LSM-19295	SID24811703, BRD-K13501717	4256170	InChI=1S/C19H22FN3S2/c1-25-17-8-4-7-16(12-17)21-19(24)23-11-5-10-22(14-23)13-15-6-2-3-9-18(15)20/h2-4,6-9,12H,5,10-11,13-14H2,1H3,(H,21,24)	OPOAZAFXRMLGBM-UHFFFAOYSA-N	CSc1cccc(NC(=S)N2CCCN(Cc3ccccc3F)C2)c1	BroadT	BRD-K13501717	BRD-K13501717-001-06-8	ChemDiv Inc.	K788-4754			CSc1cccc(NC(=S)N2CCCN(Cc3ccccc3F)C2)c1	InChI=1S/C19H22FN3S2/c1-25-17-8-4-7-16(12-17)21-19(24)23-11-5-10-22(14-23)13-15-6-2-3-9-18(15)20/h2-4,6-9,12H,5,10-11,13-14H2,1H3,(H,21,24)	OPOAZAFXRMLGBM-UHFFFAOYSA-N	375.123917314							107918
AC1OA594	LSM-19296	SID24828691, BRD-K06557469	6799086	InChI=1S/C15H12FN3/c1-10-15(11-6-2-4-8-13(11)17-10)19-18-14-9-5-3-7-12(14)16/h2-9,17H,1H3	DJJDXAQPIKUIFC-UHFFFAOYSA-N	Cc1[nH]c2ccccc2c1N=Nc3ccccc3F	BroadT	BRD-K06557469	BRD-K06557469-001-05-1	Enamine Ltd.	T0502-3079			Cc1[nH]c2ccccc2c1N=Nc1ccccc1F	InChI=1S/C15H12FN3/c1-10-15(11-6-2-4-8-13(11)17-10)19-18-14-9-5-3-7-12(14)16/h2-9,17H,1H3	DJJDXAQPIKUIFC-UHFFFAOYSA-N	253.101525614							
AC1MMOVB	LSM-19297	SID4247977, BRD-A26168826	3242116	InChI=1S/C21H20N4OS2/c1-12-9-14(21(27-2)28-12)18-15(10-22)20(23)25(13-5-4-8-24-11-13)16-6-3-7-17(26)19(16)18/h4-5,8-9,11,18H,3,6-7,23H2,1-2H3	PVRHEORPXRBKLG-UHFFFAOYSA-N	CSc1sc(C)cc1C2C(=C(N)N(C3=C2C(=O)CCC3)c4cccnc4)C#N	BroadT	BRD-A26168826	BRD-A26168826-001-06-1	ChemDiv Inc.	4306-0289			CSc1sc(C)cc1C1C(C#N)=C(N)N(c2cccnc2)C2=C1C(=O)CCC2	InChI=1S/C21H20N4OS2/c1-12-9-14(21(27-2)28-12)18-15(10-22)20(23)25(13-5-4-8-24-11-13)16-6-3-7-17(26)19(16)18/h4-5,8-9,11,18H,3,6-7,23H2,1-2H3	PVRHEORPXRBKLG-UHFFFAOYSA-N	408.10785268							107920
AC1NA7AA	LSM-19298	SID24836850, BRD-K90334416	4397191	InChI=1S/C18H19N3O8S/c22-16(12-28-18(23)15-7-8-17(29-15)21(24)25)19-13-5-4-6-14(11-13)30(26,27)20-9-2-1-3-10-20/h4-8,11H,1-3,9-10,12H2,(H,19,22)	ZURZNLCSTBTUSU-UHFFFAOYSA-N	[O-][N+](=O)c1oc(cc1)C(=O)OCC(=O)Nc2cccc(c2)S(=O)(=O)N3CCCCC3	BroadT	BRD-K90334416	BRD-K90334416-001-05-6	Enamine Ltd.	T0508-6143			[O-][N+](=O)c1ccc(o1)C(=O)OCC(=O)Nc1cccc(c1)S(=O)(=O)N1CCCCC1	InChI=1S/C18H19N3O8S/c22-16(12-28-18(23)15-7-8-17(29-15)21(24)25)19-13-5-4-6-14(11-13)30(26,27)20-9-2-1-3-10-20/h4-8,11H,1-3,9-10,12H2,(H,19,22)	ZURZNLCSTBTUSU-UHFFFAOYSA-N	437.089285288							107921
7-Methoxy-3,5-dimethyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione	LSM-19299	SID4252416, BRD-K46864030	718477	InChI=1S/C8H9N3OS2/c1-4-9-6-5(7(10-4)12-3)14-8(13)11(6)2/h1-3H3	XENJZEYRDHAGQT-UHFFFAOYSA-N	COc1nc(C)nc2N(C)C(=S)Sc12	BroadT	BRD-K46864030	BRD-K46864030-001-05-3	ChemDiv Inc.	8015-3067			COc1nc(C)nc2n(C)c(=S)sc12	InChI=1S/C8H9N3OS2/c1-4-9-6-5(7(10-4)12-3)14-8(13)11(6)2/h1-3H3	XENJZEYRDHAGQT-UHFFFAOYSA-N	227.018703318							107922
SMR000092402	LSM-19300	SID7968831, BRD-A89671349	3829191	InChI=1S/C26H30N4O4/c1-5-33-26(32)25-17(2)29(14-20-9-7-6-8-10-20)24-12-11-22(13-23(24)25)34-16-21(31)15-30-19(4)27-18(3)28-30/h6-13,21,31H,5,14-16H2,1-4H3	AGFWYRJIAJSVTE-UHFFFAOYSA-N	CCOC(=O)c1c(C)n(Cc2ccccc2)c3ccc(OCC(O)Cn4nc(C)nc4C)cc13	BroadT	BRD-A89671349	BRD-A89671349-001-04-1	ChemDiv Inc.	6475-0009			CCOC(=O)c1c(C)n(Cc2ccccc2)c2ccc(OCC(O)Cn3nc(C)nc3C)cc12	InChI=1S/C26H30N4O4/c1-5-33-26(32)25-17(2)29(14-20-9-7-6-8-10-20)24-12-11-22(13-23(24)25)34-16-21(31)15-30-19(4)27-18(3)28-30/h6-13,21,31H,5,14-16H2,1-4H3	AGFWYRJIAJSVTE-UHFFFAOYSA-N	462.22670548							107923
SMR000198058	LSM-43827	SID17414353, BRD-K19712348	5504262	InChI=1S/C24H20N2O4S/c1-3-29-21-15-17(11-12-20(21)30-24(28)22-10-7-13-31-22)14-19-16(2)25-26(23(19)27)18-8-5-4-6-9-18/h4-15H,3H2,1-2H3/b19-14+	OTGWKWLVMHNKNV-XMHGGMMESA-N	CCOc1cc(\C=C\2/C(=NN(C2=O)c3ccccc3)C)ccc1OC(=O)c4cccs4	BroadT	BRD-K19712348	BRD-K19712348-001-05-4	ChemBridge Corporation	7350505			CCOc1cc(\C=C2C(=O)N(N=C\2C)c2ccccc2)ccc1OC(=O)c1cccs1	InChI=1S/C24H20N2O4S/c1-3-29-21-15-17(11-12-20(21)30-24(28)22-10-7-13-31-22)14-19-16(2)25-26(23(19)27)18-8-5-4-6-9-18/h4-15H,3H2,1-2H3/b19-14+	OTGWKWLVMHNKNV-XMHGGMMESA-N	432.11437783							
AC1MD4MG	LSM-19302	BRD-A84822352	54682141	InChI=1S/C25H20N4O7/c1-15(26-27-20-12-11-17(28(32)33)14-21(20)29(34)35)13-19(16-7-3-2-4-8-16)23-24(30)18-9-5-6-10-22(18)36-25(23)31/h2-12,14,19,27,31H,13H2,1H3	IALFUBDCXMVSMN-UHFFFAOYSA-N	CC(=NNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])CC(C2=C(O)Oc3ccccc3C2=O)c4ccccc4	BroadT	BRD-A84822352	BRD-A84822352-001-05-6	ChemDiv Inc.	0672-0436			CC(CC(c1ccccc1)c1c(O)oc2ccccc2c1=O)=NNc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O	InChI=1S/C25H20N4O7/c1-15(26-27-20-12-11-17(28(32)33)14-21(20)29(34)35)13-19(16-7-3-2-4-8-16)23-24(30)18-9-5-6-10-22(18)36-25(23)31/h2-12,14,19,27,31H,13H2,1H3	IALFUBDCXMVSMN-UHFFFAOYSA-N	488.13319902							
ZINC01354168	LSM-19303	SID24786565, BRD-K18092493	1450131	InChI=1S/C20H17ClFN3O2/c21-16-8-4-9-17(22)15(16)13-25-11-5-10-18(19(25)26)24-20(27)23-12-14-6-2-1-3-7-14/h1-11H,12-13H2,(H2,23,24,27)	VCHQEEWIDVWHMW-UHFFFAOYSA-N	Fc1cccc(Cl)c1CN2C=CC=C(NC(=O)NCc3ccccc3)C2=O	BroadT	BRD-K18092493	BRD-K18092493-001-05-5	Asinex Ltd.	ASN 10014780			Fc1cccc(Cl)c1Cn1cccc(NC(=O)NCc2ccccc2)c1=O	InChI=1S/C20H17ClFN3O2/c21-16-8-4-9-17(22)15(16)13-25-11-5-10-18(19(25)26)24-20(27)23-12-14-6-2-1-3-7-14/h1-11H,12-13H2,(H2,23,24,27)	VCHQEEWIDVWHMW-UHFFFAOYSA-N	385.099332724							107926
ST50147782	LSM-19304	BRD-K03610477	1241395	InChI=1S/C17H16N2O3S/c1-21-14-7-3-12(4-8-14)18-17-19(16(20)11-23-17)13-5-9-15(22-2)10-6-13/h3-10H,11H2,1-2H3	AIPQWDLMORICDV-UHFFFAOYSA-N	COc1ccc(cc1)N=C2SCC(=O)N2c3ccc(OC)cc3	BroadT	BRD-K03610477	BRD-K03610477-001-05-1	ChemDiv Inc.	3232-0919			COc1ccc(cc1)N=C1SCC(=O)N1c1ccc(OC)cc1	InChI=1S/C17H16N2O3S/c1-21-14-7-3-12(4-8-14)18-17-19(16(20)11-23-17)13-5-9-15(22-2)10-6-13/h3-10H,11H2,1-2H3	AIPQWDLMORICDV-UHFFFAOYSA-N	328.088163082							107927
MLS000520827	LSM-19305	SID17401998, BRD-K41734555	5159290	InChI=1S/C18H24N4O3S/c1-2-3-6-22-17(24)14-11-13(21-7-9-25-10-8-21)4-5-15(14)20-18(22)26-12-16(19)23/h4-5,11H,2-3,6-10,12H2,1H3,(H2,19,23)	PSNSJNXUALLYFL-UHFFFAOYSA-N	CCCCN1C(=O)c2cc(ccc2N=C1SCC(=O)N)N3CCOCC3	BroadT	BRD-K41734555	BRD-K41734555-001-05-8	ChemDiv Inc.	K284-7106			CCCCn1c(SCC(N)=O)nc2ccc(cc2c1=O)N1CCOCC1	InChI=1S/C18H24N4O3S/c1-2-3-6-22-17(24)14-11-13(21-7-9-25-10-8-21)4-5-15(14)20-18(22)26-12-16(19)23/h4-5,11H,2-3,6-10,12H2,1H3,(H2,19,23)	PSNSJNXUALLYFL-UHFFFAOYSA-N	376.156911358							107928
ZINC00417937	LSM-19306	SID24811023, BRD-K54279453	861750	InChI=1S/C13H15N5O4S/c1-14-12(19)8-23-13-16-15-11(17(13)2)7-22-10-5-3-9(4-6-10)18(20)21/h3-6H,7-8H2,1-2H3,(H,14,19)	FIHFVZJDXRIOLX-UHFFFAOYSA-N	CNC(=O)CSc1nnc(COc2ccc(cc2)[N+](=O)[O-])n1C	BroadT	BRD-K54279453	BRD-K54279453-001-05-1	Asinex Ltd.	ASN 03434769			CNC(=O)CSc1nnc(COc2ccc(cc2)[N+]([O-])=O)n1C	InChI=1S/C13H15N5O4S/c1-14-12(19)8-23-13-16-15-11(17(13)2)7-22-10-5-3-9(4-6-10)18(20)21/h3-6H,7-8H2,1-2H3,(H,14,19)	FIHFVZJDXRIOLX-UHFFFAOYSA-N	337.0844747							107929
N-[2-(Cyclohex-1-en-1-yl)ethyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine	LSM-19307	SID7970470, SID859685, BRD-K01990668	660991	InChI=1S/C19H21N5/c1-3-7-15(8-4-1)11-12-20-18-17-13-23-24(19(17)22-14-21-18)16-9-5-2-6-10-16/h2,5-7,9-10,13-14H,1,3-4,8,11-12H2,(H,20,21,22)	JWIWASBOBFIAPX-UHFFFAOYSA-N	C(CC1=CCCCC1)Nc2ncnc3c2cnn3c4ccccc4	BroadT	BRD-K01990668	BRD-K01990668-001-06-6	Life Chemicals Inc.	F0521-0025			C(CC1=CCCCC1)Nc1ncnc2n(ncc12)-c1ccccc1	InChI=1S/C19H21N5/c1-3-7-15(8-4-1)11-12-20-18-17-13-23-24(19(17)22-14-21-18)16-9-5-2-6-10-16/h2,5-7,9-10,13-14H,1,3-4,8,11-12H2,(H,20,21,22)	JWIWASBOBFIAPX-UHFFFAOYSA-N	319.179695722							107930
MLS000704338	LSM-19308	SID22415096, SID87544593, BRD-K49237712	615806	InChI=1S/C13H13NOS/c1-9-3-6-13(15)12(7-9)14-8-11-5-4-10(2)16-11/h3-8,15H,1-2H3	WQCATVVBVTULPD-UHFFFAOYSA-N	Cc1ccc(O)c(c1)N=Cc2ccc(C)s2	BroadT	BRD-K49237712	BRD-K49237712-001-05-4	Specs	AN-329/11482438			Cc1ccc(C=Nc2cc(C)ccc2O)s1	InChI=1S/C13H13NOS/c1-9-3-6-13(15)12(7-9)14-8-11-5-4-10(2)16-11/h3-8,15H,1-2H3	WQCATVVBVTULPD-UHFFFAOYSA-N	231.071784736							107931
SMR000145191	LSM-19309	SID14742503, BRD-A81030323	4441046	InChI=1S/C24H30NO6PS/c1-3-5-18-30-32(27,31-19-6-4-2)24(25-33(28,29)20-12-8-7-9-13-20)17-16-23(26)21-14-10-11-15-22(21)24/h7-17,25H,3-6,18-19H2,1-2H3	YTKZIUFDINVYGN-UHFFFAOYSA-N	CCCCOP(=O)(OCCCC)C1(NS(=O)(=O)c2ccccc2)C=CC(=O)c3ccccc13	BroadT	BRD-A81030323	BRD-A81030323-001-06-3	InterBioScreen Ltd.	STOCK1S-65327			CCCCOP(=O)(OCCCC)C1(NS(=O)(=O)c2ccccc2)C=CC(=O)c2ccccc12	InChI=1S/C24H30NO6PS/c1-3-5-18-30-32(27,31-19-6-4-2)24(25-33(28,29)20-12-8-7-9-13-20)17-16-23(26)21-14-10-11-15-22(21)24/h7-17,25H,3-6,18-19H2,1-2H3	YTKZIUFDINVYGN-UHFFFAOYSA-N	491.15314489							107932
STK332245	LSM-19310	SID17505173, BRD-K06073311	1116825	InChI=1S/C19H14N4O4S/c1-12-10-11-20-19(21-12)22-28(26,27)14-8-6-13(7-9-14)23-17(24)15-4-2-3-5-16(15)18(23)25/h2-11H,1H3,(H,20,21,22)	RJHYQEYXCXPTJR-UHFFFAOYSA-N	Cc1ccnc(NS(=O)(=O)c2ccc(cc2)N3C(=O)c4ccccc4C3=O)n1	BroadT	BRD-K06073311	BRD-K06073311-001-05-9	Asinex Ltd.	BAS 01174225			Cc1ccnc(NS(=O)(=O)c2ccc(cc2)N2C(=O)c3ccccc3C2=O)n1	InChI=1S/C19H14N4O4S/c1-12-10-11-20-19(21-12)22-28(26,27)14-8-6-13(7-9-14)23-17(24)15-4-2-3-5-16(15)18(23)25/h2-11H,1H3,(H,20,21,22)	RJHYQEYXCXPTJR-UHFFFAOYSA-N	394.073575658							107933
SMR000131579	LSM-19311	SID14734142, BRD-A29506681	9550560	InChI=1S/C24H30ClN3O2/c1-3-27(20-10-6-8-18(2)16-20)15-7-14-26-24(30)22-12-13-23(29)28(22)17-19-9-4-5-11-21(19)25/h4-6,8-11,16,22H,3,7,12-15,17H2,1-2H3,(H,26,30)	ICCKEPIIHCJCID-UHFFFAOYSA-N	CCN(CCCNC(=O)C1CCC(=O)N1Cc2ccccc2Cl)c3cccc(C)c3	BroadT	BRD-A29506681	BRD-A29506681-001-05-5	ChemDiv Inc.	K788-0331			CCN(CCCNC(=O)C1CCC(=O)N1Cc1ccccc1Cl)c1cccc(C)c1	InChI=1S/C24H30ClN3O2/c1-3-27(20-10-6-8-18(2)16-20)15-7-14-26-24(30)22-12-13-23(29)28(22)17-19-9-4-5-11-21(19)25/h4-6,8-11,16,22H,3,7,12-15,17H2,1-2H3,(H,26,30)	ICCKEPIIHCJCID-UHFFFAOYSA-N	427.20265494							107934
MLS-0315803.0001	LSM-3201	BRD-K54070802, SID125001269, SID49724792, SID56373872	4089709	InChI=1S/C20H14N2O5S2/c23-19-16-9-2-4-11-18(16)28-22(19)13-6-5-7-14(12-13)29(26,27)21-17-10-3-1-8-15(17)20(24)25/h1-12,21H,(H,24,25)	FEVKOYDOEFRIDM-UHFFFAOYSA-N	OC(=O)c1ccccc1NS(=O)(=O)c2cccc(c2)N3Sc4ccccc4C3=O	BroadT	BRD-K54070802	BRD-K54070802-001-08-6	Enamine Ltd.	T0509-4263			OC(=O)c1ccccc1NS(=O)(=O)c1cccc(c1)-n1sc2ccccc2c1=O	InChI=1S/C20H14N2O5S2/c23-19-16-9-2-4-11-18(16)28-22(19)13-6-5-7-14(12-13)29(26,27)21-17-10-3-1-8-15(17)20(24)25/h1-12,21H,(H,24,25)	FEVKOYDOEFRIDM-UHFFFAOYSA-N	426.034412948							92947
SMR000023713	LSM-19312	SID4247886, BRD-K42672935	3242037	InChI=1S/C22H27N3O3/c1-15-8-10-24(11-9-15)21(26)17-14-25(12-13-28-3)22(27)20-19(17)16-6-4-5-7-18(16)23(20)2/h4-7,14-15H,8-13H2,1-3H3	NVJXEMYYMSDBAO-UHFFFAOYSA-N	COCCN1C=C(C(=O)N2CCC(C)CC2)c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K42672935	BRD-K42672935-001-07-6	ChemDiv Inc.	C237-1098			COCCn1cc(C(=O)N2CCC(C)CC2)c2c3ccccc3n(C)c2c1=O	InChI=1S/C22H27N3O3/c1-15-8-10-24(11-9-15)21(26)17-14-25(12-13-28-3)22(27)20-19(17)16-6-4-5-7-18(16)23(20)2/h4-7,14-15H,8-13H2,1-3H3	NVJXEMYYMSDBAO-UHFFFAOYSA-N	381.205241754							107935
MLS001006696	LSM-43617	BRD-K56824917	2415296	InChI=1S/C21H22N2O6S2/c1-13-4-5-14(2)19(10-13)31(26,27)29-16-7-6-15(11-17(16)28-3)12-18-20(24)23(9-8-22)21(25)30-18/h4-7,10-12H,8-9,22H2,1-3H3/b18-12-	XTFLFSBYKYFWNZ-PDGQHHTCSA-N	COc1cc(\C=C\2/SC(=O)N(CCN)C2=O)ccc1OS(=O)(=O)c3cc(C)ccc3C	BroadT	BRD-K56824917	BRD-K56824917-003-04-1	Enamine Ltd.	T0515-4901		Cl	COc1cc(ccc1OS(=O)(=O)c1cc(C)ccc1C)\C=C1/SC(=O)N(CCN)C1=O.Cl	InChI=1S/C21H22N2O6S2.ClH/c1-13-4-5-14(2)19(10-13)31(26,27)29-16-7-6-15(11-17(16)28-3)12-18-20(24)23(9-8-22)21(25)30-18;/h4-7,10-12H,8-9,22H2,1-3H3;1H/b18-12-;	YFILXRCIHBFSSR-UWRQUICRSA-N	462.091927824							, 
MLS000683536	LSM-19313	SID24823498, BRD-A27931246	3687660	InChI=1S/C19H22ClN3O2/c1-25-18-8-6-17(7-9-18)23-11-10-14(13-23)12-21-19(24)22-16-4-2-15(20)3-5-16/h2-9,14H,10-13H2,1H3,(H2,21,22,24)	PVAFMKDKWQMBLH-UHFFFAOYSA-N	COc1ccc(cc1)N2CCC(CNC(=O)Nc3ccc(Cl)cc3)C2	BroadT	BRD-A27931246	BRD-A27931246-001-05-5	ChemDiv Inc.	K788-2046			COc1ccc(cc1)N1CCC(CNC(=O)Nc2ccc(Cl)cc2)C1	InChI=1S/C19H22ClN3O2/c1-25-18-8-6-17(7-9-18)23-11-10-14(13-23)12-21-19(24)22-16-4-2-15(20)3-5-16/h2-9,14H,10-13H2,1H3,(H2,21,22,24)	PVAFMKDKWQMBLH-UHFFFAOYSA-N	359.140054684							107936
SMR000070442	LSM-19314	SID4256537, BRD-K72797880	2877970	InChI=1S/C19H16N2O2/c1-22-19-10-15-14-7-2-3-8-17(14)23-18(15)11-16(19)21-12-13-6-4-5-9-20-13/h2-11,21H,12H2,1H3	FNVJJASZJKZALN-UHFFFAOYSA-N	COc1cc2c(oc3ccccc23)cc1NCc4ccccn4	BroadT	BRD-K72797880	BRD-K72797880-001-05-3	ChemBridge Corporation	5941001			COc1cc2c(cc1NCc1ccccn1)oc1ccccc21	InChI=1S/C19H16N2O2/c1-22-19-10-15-14-7-2-3-8-17(14)23-18(15)11-16(19)21-12-13-6-4-5-9-20-13/h2-11,21H,12H2,1H3	FNVJJASZJKZALN-UHFFFAOYSA-N	304.121177772							107937
N-[2-(4-Chlorophenyl)ethyl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)acetamide	LSM-19315	SID24829334, BRD-K55274006	2079468	InChI=1S/C16H15ClN4OS/c17-13-6-4-12(5-7-13)8-9-18-15(22)11-23-16-20-19-14-3-1-2-10-21(14)16/h1-7,10H,8-9,11H2,(H,18,22)	COWBGZSGJWWLTO-UHFFFAOYSA-N	Clc1ccc(CCNC(=O)CSc2nnc3ccccn23)cc1	BroadT	BRD-K55274006	BRD-K55274006-001-05-3	Enamine Ltd.	T5256680			Clc1ccc(CCNC(=O)CSc2nnc3ccccn23)cc1	InChI=1S/C16H15ClN4OS/c17-13-6-4-12(5-7-13)8-9-18-15(22)11-23-16-20-19-14-3-1-2-10-21(14)16/h1-7,10H,8-9,11H2,(H,18,22)	COWBGZSGJWWLTO-UHFFFAOYSA-N	346.06550954							107938
N-Methyl-5-phenyl-2-thiophenecarboxamide	LSM-19316	SID14729898, BRD-K74430653	3790018	InChI=1S/C12H11NOS/c1-13-12(14)11-8-7-10(15-11)9-5-3-2-4-6-9/h2-8H,1H3,(H,13,14)	URCCNXYQSTUSNL-UHFFFAOYSA-N	CNC(=O)c1ccc(s1)c2ccccc2	BroadT	BRD-K74430653	BRD-K74430653-001-05-4	Key Organics Ltd.	6H-365S			CNC(=O)c1ccc(s1)-c1ccccc1	InChI=1S/C12H11NOS/c1-13-12(14)11-8-7-10(15-11)9-5-3-2-4-6-9/h2-8H,1H3,(H,13,14)	URCCNXYQSTUSNL-UHFFFAOYSA-N	217.056134672							107939
SMR000063355	LSM-19317	SID3717193, BRD-K64642724	2098186	InChI=1S/C25H20N2O4/c1-17-20-13-12-18-8-5-6-11-21(18)24(20)31-23(17)25(29)30-16-22(28)27(15-7-14-26)19-9-3-2-4-10-19/h2-6,8-13H,7,15-16H2,1H3	CTYJZSIPFIWHBS-UHFFFAOYSA-N	Cc1c(oc2c1ccc3ccccc23)C(=O)OCC(=O)N(CCC#N)c4ccccc4	BroadT	BRD-K64642724	BRD-K64642724-001-05-1	Enamine Ltd.	T5230993			Cc1c(oc2c1ccc1ccccc21)C(=O)OCC(=O)N(CCC#N)c1ccccc1	InChI=1S/C25H20N2O4/c1-17-20-13-12-18-8-5-6-11-21(18)24(20)31-23(17)25(29)30-16-22(28)27(15-7-14-26)19-9-3-2-4-10-19/h2-6,8-13H,7,15-16H2,1H3	CTYJZSIPFIWHBS-UHFFFAOYSA-N	412.14230714							107940
AC1LUBGX	LSM-19318	BRD-K07418049	1626095	InChI=1S/C21H17BrN2O2/c22-19-11-9-18(10-12-19)21(25)24-23-14-17-7-4-8-20(13-17)26-15-16-5-2-1-3-6-16/h1-14H,15H2,(H,24,25)	RVULRFTVEHUYDI-UHFFFAOYSA-N	Brc1ccc(cc1)C(=O)NN=Cc2cccc(OCc3ccccc3)c2	BroadT	BRD-K07418049	BRD-K07418049-001-05-4	Enamine Ltd.	T0514-8597			Brc1ccc(cc1)C(=O)NN=Cc1cccc(OCc2ccccc2)c1	InChI=1S/C21H17BrN2O2/c22-19-11-9-18(10-12-19)21(25)24-23-14-17-7-4-8-20(13-17)26-15-16-5-2-1-3-6-16/h1-14H,15H2,(H,24,25)	RVULRFTVEHUYDI-UHFFFAOYSA-N	408.047340404							107941
4-(2-Methyl-1,3-thiazol-4-yl)benzoic acid	LSM-15200	BRD-K68607418	654980	InChI=1S/C11H9NO2S/c1-7-12-10(6-15-7)8-2-4-9(5-3-8)11(13)14/h2-6H,1H3,(H,13,14)	NYJHTTLXERQUIV-UHFFFAOYSA-N	Cc1nc(cs1)c2ccc(cc2)C(=O)O	BroadT	BRD-K68607418	BRD-K68607418-004-05-5	Asinex Ltd.	BAS 01847974		Br	Cc1nc(cs1)-c1ccc(cc1)C(O)=O.Br	InChI=1S/C11H9NO2S.BrH/c1-7-12-10(6-15-7)8-2-4-9(5-3-8)11(13)14;/h2-6H,1H3,(H,13,14);1H	JXQSRFQWSFCQIF-UHFFFAOYSA-N	219.035399228							103850, 103850
T0516-1901	LSM-19319	SID3716167, BRD-A86960183	2999500	InChI=1S/C20H28N2O5/c1-4-26-17-11-6-5-10-16(17)20(25)21-12-19(24)27-13-18(23)22-14(2)8-7-9-15(22)3/h5-6,10-11,14-15H,4,7-9,12-13H2,1-3H3,(H,21,25)	UXDCAKZKSINYGV-UHFFFAOYSA-N	CCOc1ccccc1C(=O)NCC(=O)OCC(=O)N2C(C)CCCC2C	BroadT	BRD-A86960183	BRD-A86960183-001-05-7	Enamine Ltd.	T0516-1901			CCOc1ccccc1C(=O)NCC(=O)OCC(=O)N1C(C)CCCC1C	InChI=1S/C20H28N2O5/c1-4-26-17-11-6-5-10-16(17)20(25)21-12-19(24)27-13-18(23)22-14(2)8-7-9-15(22)3/h5-6,10-11,14-15H,4,7-9,12-13H2,1-3H3,(H,21,25)	UXDCAKZKSINYGV-UHFFFAOYSA-N	376.199822016							107942
2-Chloro-n-(pyrimidin-2-ylcarbamothioyl)benzamide	LSM-19320	SID22415502, BRD-K01112281	2295436	InChI=1S/C12H9ClN4OS/c13-9-5-2-1-4-8(9)10(18)16-12(19)17-11-14-6-3-7-15-11/h1-7H,(H2,14,15,16,17,18,19)	RSNZPYJRZFRPCZ-UHFFFAOYSA-N	Clc1ccccc1C(=O)NC(=S)Nc2ncccn2	BroadT	BRD-K01112281	BRD-K01112281-001-05-6	ChemBridge Corporation	6974952			Clc1ccccc1C(=O)NC(=S)Nc1ncccn1	InChI=1S/C12H9ClN4OS/c13-9-5-2-1-4-8(9)10(18)16-12(19)17-11-14-6-3-7-15-11/h1-7H,(H2,14,15,16,17,18,19)	RSNZPYJRZFRPCZ-UHFFFAOYSA-N	292.018559348							107943
SMR000108483	LSM-19321	SID7973261, BRD-K85492583	2055736	InChI=1S/C20H25NO7/c1-24-9-8-21-11-14(19(22)27-4)18(15(12-21)20(23)28-5)13-6-7-16(25-2)17(10-13)26-3/h6-7,10-12,18H,8-9H2,1-5H3	BIRIKJCIZIGMEK-UHFFFAOYSA-N	COCCN1C=C(C(C(=C1)C(=O)OC)c2ccc(OC)c(OC)c2)C(=O)OC	BroadT	BRD-K85492583	BRD-K85492583-001-05-6	ChemBridge Corporation	6873561			COCCN1C=C(C(c2ccc(OC)c(OC)c2)C(=C1)C(=O)OC)C(=O)OC	InChI=1S/C20H25NO7/c1-24-9-8-21-11-14(19(22)27-4)18(15(12-21)20(23)28-5)13-6-7-16(25-2)17(10-13)26-3/h6-7,10-12,18H,8-9H2,1-5H3	BIRIKJCIZIGMEK-UHFFFAOYSA-N	391.16310215							107944
MLS000062416	LSM-19322	SID4262538, BRD-K21930191	892164	InChI=1S/C19H24N2O/c1-22-19-8-4-3-7-16(19)15-20-17-9-11-18(12-10-17)21-13-5-2-6-14-21/h3-4,7-12,20H,2,5-6,13-15H2,1H3	RVXBQNAIAHECGJ-UHFFFAOYSA-N	COc1ccccc1CNc2ccc(cc2)N3CCCCC3	BroadT	BRD-K21930191	BRD-K21930191-001-06-4	ChemBridge Corporation	7520263			COc1ccccc1CNc1ccc(cc1)N1CCCCC1	InChI=1S/C19H24N2O/c1-22-19-8-4-3-7-16(19)15-20-17-9-11-18(12-10-17)21-13-5-2-6-14-21/h3-4,7-12,20H,2,5-6,13-15H2,1H3	RVXBQNAIAHECGJ-UHFFFAOYSA-N	296.188863408							107945
SMR000071356	LSM-19323	SID4259926, BRD-K13627294	2165175	InChI=1S/C15H20ClNO3/c1-12-11-13(16)4-5-14(12)20-8-2-3-15(18)17-6-9-19-10-7-17/h4-5,11H,2-3,6-10H2,1H3	SACVJJTXPBVABM-UHFFFAOYSA-N	Cc1cc(Cl)ccc1OCCCC(=O)N2CCOCC2	BroadT	BRD-K13627294	BRD-K13627294-001-07-0	ChemBridge Corporation	6827204			Cc1cc(Cl)ccc1OCCCC(=O)N1CCOCC1	InChI=1S/C15H20ClNO3/c1-12-11-13(16)4-5-14(12)20-8-2-3-15(18)17-6-9-19-10-7-17/h4-5,11H,2-3,6-10H2,1H3	SACVJJTXPBVABM-UHFFFAOYSA-N	297.11317122							107946
10P-378S	LSM-19324	SID17410658, BRD-K46976183	2765899	InChI=1S/C20H12FN3OS2/c21-15-8-6-14(7-9-15)19(25)24-18-16(12-23)27-20(26-11-10-22)17(18)13-4-2-1-3-5-13/h1-9H,11H2,(H,24,25)	UJJUFSTZXKHSRU-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)Nc2c(C#N)sc(SCC#N)c2c3ccccc3	BroadT	BRD-K46976183	BRD-K46976183-001-05-0	Key Organics Ltd.	10P-378S			Fc1ccc(cc1)C(=O)Nc1c(sc(SCC#N)c1-c1ccccc1)C#N	InChI=1S/C20H12FN3OS2/c21-15-8-6-14(7-9-15)19(25)24-18-16(12-23)27-20(26-11-10-22)17(18)13-4-2-1-3-5-13/h1-9H,11H2,(H,24,25)	UJJUFSTZXKHSRU-UHFFFAOYSA-N	393.040581614							107947
SMR000068390	LSM-19325	SID3715114, BRD-K98740057	2552345	InChI=1S/C21H21N3O6S/c1-29-18-6-3-2-5-17(18)24-31(27,28)16-10-8-15(9-11-16)23-20(25)12-13-22-21(26)19-7-4-14-30-19/h2-11,14,24H,12-13H2,1H3,(H,22,26)(H,23,25)	OFWUEHBDMZMOCF-UHFFFAOYSA-N	COc1ccccc1NS(=O)(=O)c2ccc(NC(=O)CCNC(=O)c3occc3)cc2	BroadT	BRD-K98740057	BRD-K98740057-001-05-0	Enamine Ltd.	T5341323			COc1ccccc1NS(=O)(=O)c1ccc(NC(=O)CCNC(=O)c2ccco2)cc1	InChI=1S/C21H21N3O6S/c1-29-18-6-3-2-5-17(18)24-31(27,28)16-10-8-15(9-11-16)23-20(25)12-13-22-21(26)19-7-4-14-30-19/h2-11,14,24H,12-13H2,1H3,(H,22,26)(H,23,25)	OFWUEHBDMZMOCF-UHFFFAOYSA-N	443.115106112							107948
ZINC06055501	LSM-19326	SID49821657, BRD-K92284884	7861876	InChI=1S/C18H15N3O5/c1-24-14-9-7-13(8-10-14)17(23)25-11-15(22)19-18-21-20-16(26-18)12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,19,21,22)	AYKQKPBFFIQBFJ-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)OCC(=O)Nc2oc(nn2)c3ccccc3	BroadT	BRD-K92284884	BRD-K92284884-001-06-2	UkrOrgSynthesis Ltd.	PB-05978195			COc1ccc(cc1)C(=O)OCC(=O)Nc1nnc(o1)-c1ccccc1	InChI=1S/C18H15N3O5/c1-24-14-9-7-13(8-10-14)17(23)25-11-15(22)19-18-21-20-16(26-18)12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,19,21,22)	AYKQKPBFFIQBFJ-UHFFFAOYSA-N	353.10117061							107949
AC1MDLRQ	LSM-19327	SID26730950, BRD-K96329740	2813157	InChI=1S/C16H16N4O3S2/c21-25(22,16-5-4-14(24-16)13-6-12-23-18-13)20-10-8-19(9-11-20)15-3-1-2-7-17-15/h1-7,12H,8-11H2	YYZSRKMWHVINIW-UHFFFAOYSA-N	O=S(=O)(N1CCN(CC1)c2ccccn2)c3ccc(s3)c4ccon4	BroadT	BRD-K96329740	BRD-K96329740-001-05-7	Maybridge	HTS 06599			O=S(=O)(N1CCN(CC1)c1ccccn1)c1ccc(s1)-c1ccon1	InChI=1S/C16H16N4O3S2/c21-25(22,16-5-4-14(24-16)13-6-12-23-18-13)20-10-8-19(9-11-20)15-3-1-2-7-17-15/h1-7,12H,8-11H2	YYZSRKMWHVINIW-UHFFFAOYSA-N	376.066381792							107950
AN-648/15597011	LSM-43828	SID14719262, BRD-K54015635	7311763	InChI=1S/C21H20N2O4/c1-14(2)27-21(25)16-9-11-17(12-10-16)23-20(24)19(15(3)22-23)8-4-6-18-7-5-13-26-18/h4-14H,1-3H3/b6-4+,19-8-	BVASLSKDOFWFFT-AGASNCOBSA-N	CC(C)OC(=O)c1ccc(cc1)N2N=C(C)\C(=C\C=C\c3occc3)\C2=O	BroadT	BRD-K54015635	BRD-K54015635-001-05-0	Specs	AN-648/15597011			CC(C)OC(=O)c1ccc(cc1)N1N=C(C)\C(=C\C=C\c2ccco2)C1=O	InChI=1S/C21H20N2O4/c1-14(2)27-21(25)16-9-11-17(12-10-16)23-20(24)19(15(3)22-23)8-4-6-18-7-5-13-26-18/h4-14H,1-3H3/b6-4+,19-8-	BVASLSKDOFWFFT-AGASNCOBSA-N	364.14230714							
Nifuratrone	LSM-43829	BRD-K61454150	5910161	InChI=1S/C7H8N2O5/c10-4-3-8(11)5-6-1-2-7(14-6)9(12)13/h1-2,5,10H,3-4H2/b8-5-	QSWZUVFMUIEHAG-YVMONPNESA-N	OCC\[N+](=C\c1oc(cc1)[N+](=O)[O-])\[O-]	BroadT	BRD-K61454150	BRD-K61454150-001-06-5	National Cancer Institute Chemotherapeutic Agents Repository	Nifuratrone 303603			OCC\[N+]([O-])=C\c1ccc(o1)[N+]([O-])=O	InChI=1S/C7H8N2O5/c10-4-3-8(11)5-6-1-2-7(14-6)9(12)13/h1-2,5,10H,3-4H2/b8-5-	QSWZUVFMUIEHAG-YVMONPNESA-N	200.043321376							
SMR000067959	LSM-19330	SID3717787, BRD-K76459967	2494767	InChI=1S/C23H26N2O5S/c1-29-21-8-7-20(17-22(21)31(27,28)25-13-15-30-16-14-25)23(26)24-11-9-19(10-12-24)18-5-3-2-4-6-18/h2-9,17H,10-16H2,1H3	ZBQRBJJRAJEUEZ-UHFFFAOYSA-N	COc1ccc(cc1S(=O)(=O)N2CCOCC2)C(=O)N3CCC(=CC3)c4ccccc4	BroadT	BRD-K76459967	BRD-K76459967-001-05-2	Enamine Ltd.	T5332038			COc1ccc(cc1S(=O)(=O)N1CCOCC1)C(=O)N1CCC(=CC1)c1ccccc1	InChI=1S/C23H26N2O5S/c1-29-21-8-7-20(17-22(21)31(27,28)25-13-15-30-16-14-25)23(26)24-11-9-19(10-12-24)18-5-3-2-4-6-18/h2-9,17H,10-16H2,1H3	ZBQRBJJRAJEUEZ-UHFFFAOYSA-N	442.156242642							107953
4-Methyl-2-(8-quinolinyl)-1(2H)-phthalazinone	LSM-19331	SID14729953, BRD-K38555171	1481947	InChI=1S/C18H13N3O/c1-12-14-8-2-3-9-15(14)18(22)21(20-12)16-10-4-6-13-7-5-11-19-17(13)16/h2-11H,1H3	XMYSTRUFPKBWBE-UHFFFAOYSA-N	CC1=NN(C(=O)c2ccccc12)c3cccc4cccnc34	BroadT	BRD-K38555171	BRD-K38555171-001-05-6	Key Organics Ltd.	11T-0658			Cc1nn(-c2cccc3cccnc23)c(=O)c2ccccc12	InChI=1S/C18H13N3O/c1-12-14-8-2-3-9-15(14)18(22)21(20-12)16-10-4-6-13-7-5-11-19-17(13)16/h2-11H,1H3	XMYSTRUFPKBWBE-UHFFFAOYSA-N	287.105862066							107954
F0561-0703	LSM-19332	BRD-A35401994	756307	InChI=1S/C14H17N3O2S2/c1-14(2,3)17-12(9-7-21(19)8-10(9)16-17)15-13(18)11-5-4-6-20-11/h4-6H,7-8H2,1-3H3,(H,15,18)	WYHNDMBHGRSFMC-UHFFFAOYSA-N	CC(C)(C)n1nc2CS(=O)Cc2c1NC(=O)c3cccs3	BroadT	BRD-A35401994	BRD-A35401994-001-05-3	ChemDiv Inc.	C077-0339			CC(C)(C)n1nc2CS(=O)Cc2c1NC(=O)c1cccs1	InChI=1S/C14H17N3O2S2/c1-14(2,3)17-12(9-7-21(19)8-10(9)16-17)15-13(18)11-5-4-6-20-11/h4-6H,7-8H2,1-3H3,(H,15,18)	WYHNDMBHGRSFMC-UHFFFAOYSA-N	323.076218194							107955
ST50903465	LSM-19333	SID4263200, BRD-K26855844	1246952	InChI=1S/C14H9ClN4O2/c15-11-6-2-1-5-10(11)13-18-19-14(21-13)17-12(20)9-4-3-7-16-8-9/h1-8H,(H,17,19,20)	FEKNFJRGXOAZKK-UHFFFAOYSA-N	Clc1ccccc1c2oc(NC(=O)c3cccnc3)nn2	BroadT	BRD-K26855844	BRD-K26855844-001-05-1	ChemBridge Corporation	7948098			Clc1ccccc1-c1nnc(NC(=O)c2cccnc2)o1	InChI=1S/C14H9ClN4O2/c15-11-6-2-1-5-10(11)13-18-19-14(21-13)17-12(20)9-4-3-7-16-8-9/h1-8H,(H,17,19,20)	FEKNFJRGXOAZKK-UHFFFAOYSA-N	300.041403278							107956
N-(3-Morpholin-4-ylsulfonylphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide	LSM-3772	BRD-K78797196, SID57261917, SID87544619	4292126	InChI=1S/C21H23N3O5S/c25-20-5-2-10-24(20)18-8-6-16(7-9-18)21(26)22-17-3-1-4-19(15-17)30(27,28)23-11-13-29-14-12-23/h1,3-4,6-9,15H,2,5,10-14H2,(H,22,26)	HCHQMTSFRNJTLA-UHFFFAOYSA-N	O=C(Nc1cccc(c1)S(=O)(=O)N2CCOCC2)c3ccc(cc3)N4CCCC4=O	BroadT	BRD-K78797196	BRD-K78797196-001-04-9	Enamine Ltd.	T5279252			O=C(Nc1cccc(c1)S(=O)(=O)N1CCOCC1)c1ccc(cc1)N1CCCC1=O	InChI=1S/C21H23N3O5S/c25-20-5-2-10-24(20)18-8-6-16(7-9-18)21(26)22-17-3-1-4-19(15-17)30(27,28)23-11-13-29-14-12-23/h1,3-4,6-9,15H,2,5,10-14H2,(H,22,26)	HCHQMTSFRNJTLA-UHFFFAOYSA-N	429.135841556							93388
ZINC05060038	LSM-19334	SID24826519, BRD-K61432385	4143922	InChI=1S/C15H12F2N2O4/c16-15(17)23-12-7-2-1-5-10(12)19-13(20)9-22-14(21)11-6-3-4-8-18-11/h1-8,15H,9H2,(H,19,20)	QSTDXPKISWJLNS-UHFFFAOYSA-N	FC(F)Oc1ccccc1NC(=O)COC(=O)c2ccccn2	BroadT	BRD-K61432385	BRD-K61432385-001-05-0	Enamine Ltd.	T0512-0420			FC(F)Oc1ccccc1NC(=O)COC(=O)c1ccccn1	InChI=1S/C15H12F2N2O4/c16-15(17)23-12-7-2-1-5-10(12)19-13(20)9-22-14(21)11-6-3-4-8-18-11/h1-8,15H,9H2,(H,19,20)	QSTDXPKISWJLNS-UHFFFAOYSA-N	322.076513284							107957
SMR000028548	LSM-19335	BRD-K74541409	3237895	InChI=1S/C23H31N3O4/c1-3-25(18-9-6-5-7-10-18)14-8-13-24-19-20(22(28)21(19)27)26-15-11-17(12-16-26)23(29)30-4-2/h5-7,9-10,17,24H,3-4,8,11-16H2,1-2H3	HNRIKSOYAMYABL-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC1)c1c(NCCCN(CC)c2ccccc2)c(=O)c1=O	BroadT	BRD-K74541409	BRD-K74541409-001-05-5	ChemDiv Inc.	C667-0373			CCOC(=O)C1CCN(CC1)c1c(NCCCN(CC)c2ccccc2)c(=O)c1=O	InChI=1S/C23H31N3O4/c1-3-25(18-9-6-5-7-10-18)14-8-13-24-19-20(22(28)21(19)27)26-15-11-17(12-16-26)23(29)30-4-2/h5-7,9-10,17,24H,3-4,8,11-16H2,1-2H3	HNRIKSOYAMYABL-UHFFFAOYSA-N	413.231456502							107958
SMR000072609	LSM-19336	SID26513926, SID4261682, BRD-K13883472	1281364	InChI=1S/C18H16N2O4S/c1-23-17-6-2-3-7-18(17)24-15-8-10-16(11-9-15)25(21,22)20-14-5-4-12-19-13-14/h2-13,20H,1H3	YPBLFFVWZZGYBR-UHFFFAOYSA-N	COc1ccccc1Oc2ccc(cc2)S(=O)(=O)Nc3cccnc3	BroadT	BRD-K13883472	BRD-K13883472-001-05-7	ChemBridge Corporation	7428847			COc1ccccc1Oc1ccc(cc1)S(=O)(=O)Nc1cccnc1	InChI=1S/C18H16N2O4S/c1-23-17-6-2-3-7-18(17)24-15-8-10-16(11-9-15)25(21,22)20-14-5-4-12-19-13-14/h2-13,20H,1H3	YPBLFFVWZZGYBR-UHFFFAOYSA-N	356.083077702							107959
AK-968/37156092	LSM-19337	SID14736614, BRD-A09886181	2862751	InChI=1S/C17H20N2O2S2/c1-2-4-10-6-7-11-13(9-10)23-17(14(11)15(18)20)19-16(21)12-5-3-8-22-12/h3,5,8,10H,2,4,6-7,9H2,1H3,(H2,18,20)(H,19,21)	KUYYOXODJIMUIN-UHFFFAOYSA-N	CCCC1CCc2c(C1)sc(NC(=O)c3cccs3)c2C(=O)N	BroadT	BRD-A09886181	BRD-A09886181-001-05-0	ChemBridge Corporation	5700588			CCCC1CCc2c(C1)sc(NC(=O)c1cccs1)c2C(N)=O	InChI=1S/C17H20N2O2S2/c1-2-4-10-6-7-11-13(9-10)23-17(14(11)15(18)20)19-16(21)12-5-3-8-22-12/h3,5,8,10H,2,4,6-7,9H2,1H3,(H2,18,20)(H,19,21)	KUYYOXODJIMUIN-UHFFFAOYSA-N	348.09661928							107960
BAS 08315303	LSM-19338	SID47204919, BRD-K43170076	3157365	InChI=1S/C19H22N4O/c1-13(2)24-10-6-9-21-18-11-14(3)15(12-20)19-22-16-7-4-5-8-17(16)23(18)19/h4-5,7-8,11,13,21H,6,9-10H2,1-3H3	WWKKTYGTDVEQEK-UHFFFAOYSA-N	CC(C)OCCCNc1cc(C)c(C#N)c2nc3ccccc3n12	BroadT	BRD-K43170076	BRD-K43170076-001-05-3	Asinex Ltd.	BAS 08315303			CC(C)OCCCNc1cc(C)c(C#N)c2nc3ccccc3n12	InChI=1S/C19H22N4O/c1-13(2)24-10-6-9-21-18-11-14(3)15(12-20)19-22-16-7-4-5-8-17(16)23(18)19/h4-5,7-8,11,13,21H,6,9-10H2,1-3H3	WWKKTYGTDVEQEK-UHFFFAOYSA-N	322.179361364							107961
4-Benzyl-n-[4-(difluoromethoxy)phenyl]piperazine-1-carbothioamide	LSM-19339	SID24815983, BRD-K14954189	3361572	InChI=1S/C19H21F2N3OS/c20-18(21)25-17-8-6-16(7-9-17)22-19(26)24-12-10-23(11-13-24)14-15-4-2-1-3-5-15/h1-9,18H,10-14H2,(H,22,26)	KVFRNVSKTWFZLZ-UHFFFAOYSA-N	FC(F)Oc1ccc(NC(=S)N2CCN(Cc3ccccc3)CC2)cc1	BroadT	BRD-K14954189	BRD-K14954189-001-05-9	Life Chemicals Inc.	F0828-0052			FC(F)Oc1ccc(NC(=S)N2CCN(Cc3ccccc3)CC2)cc1	InChI=1S/C19H21F2N3OS/c20-18(21)25-17-8-6-16(7-9-17)22-19(26)24-12-10-23(11-13-24)14-15-4-2-1-3-5-15/h1-9,18H,10-14H2,(H,22,26)	KVFRNVSKTWFZLZ-UHFFFAOYSA-N	377.137339412							107962
MLS000095308	LSM-19340	SID26724605, SID4251862, BRD-K34676668	3245495	InChI=1S/C25H28N4O4S/c1-2-33-25(32)28-14-12-19(13-15-28)29-23(31)20-10-6-7-11-21(20)27-24(29)34-17-22(30)26-16-18-8-4-3-5-9-18/h3-11,19H,2,12-17H2,1H3,(H,26,30)	XIUIRBACTBFYRV-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)N2C(=Nc3ccccc3C2=O)SCC(=O)NCc4ccccc4	BroadT	BRD-K34676668	BRD-K34676668-001-05-4	ChemDiv Inc.	K284-3351			CCOC(=O)N1CCC(CC1)n1c(SCC(=O)NCc2ccccc2)nc2ccccc2c1=O	InChI=1S/C25H28N4O4S/c1-2-33-25(32)28-14-12-19(13-15-28)29-23(31)20-10-6-7-11-21(20)27-24(29)34-17-22(30)26-16-18-8-4-3-5-9-18/h3-11,19H,2,12-17H2,1H3,(H,26,30)	XIUIRBACTBFYRV-UHFFFAOYSA-N	480.183126106							107963
MLS000533808	LSM-19341	SID14734874, BRD-A07786895	2888347	InChI=1S/C16H18N2O2S/c1-11-4-6-12(7-5-11)9-13-10-17-16(21-13)18-15(19)14-3-2-8-20-14/h4-7,10,14H,2-3,8-9H2,1H3,(H,17,18,19)	JDUKUMMTDHDZTH-UHFFFAOYSA-N	Cc1ccc(Cc2cnc(NC(=O)C3CCCO3)s2)cc1	BroadT	BRD-A07786895	BRD-A07786895-001-06-9	ChemBridge Corporation	6151809			Cc1ccc(Cc2cnc(NC(=O)C3CCCO3)s2)cc1	InChI=1S/C16H18N2O2S/c1-11-4-6-12(7-5-11)9-13-10-17-16(21-13)18-15(19)14-3-2-8-20-14/h4-7,10,14H,2-3,8-9H2,1H3,(H,17,18,19)	JDUKUMMTDHDZTH-UHFFFAOYSA-N	302.108898526							107964
T5250562	LSM-19342	SID3714821, BRD-K15718920	2123759	InChI=1S/C19H17FN2O5S/c20-17-5-1-2-6-18(17)27-13-19(23)22-14-7-9-16(10-8-14)28(24,25)21-12-15-4-3-11-26-15/h1-11,21H,12-13H2,(H,22,23)	RZFRZVXOTNQLIL-UHFFFAOYSA-N	Fc1ccccc1OCC(=O)Nc2ccc(cc2)S(=O)(=O)NCc3occc3	BroadT	BRD-K15718920	BRD-K15718920-001-06-9	Enamine Ltd.	T5250562			Fc1ccccc1OCC(=O)Nc1ccc(cc1)S(=O)(=O)NCc1ccco1	InChI=1S/C19H17FN2O5S/c20-17-5-1-2-6-18(17)27-13-19(23)22-14-7-9-16(10-8-14)28(24,25)21-12-15-4-3-11-26-15/h1-11,21H,12-13H2,(H,22,23)	RZFRZVXOTNQLIL-UHFFFAOYSA-N	404.084220554							107965
SMR000274289	LSM-19343	SID24801108, BRD-K92576167	3177234	InChI=1S/C29H38N4O4S/c1-21-6-4-7-22(16-21)8-11-33(29(38)30-9-5-10-32-12-14-37-15-13-32)20-24-17-23-18-26(35-2)27(36-3)19-25(23)31-28(24)34/h4,6-7,16-19H,5,8-15,20H2,1-3H3,(H,30,38)(H,31,34)	FTVZHURJKBLCBP-UHFFFAOYSA-N	COc1cc2cc(CN(CCc3cccc(C)c3)C(=NCCCN4CCOCC4)S)c(O)nc2cc1OC	BroadT	BRD-K92576167	BRD-K92576167-001-05-1	Asinex Ltd.	ASN 03778940			COc1cc2cc(CN(CCc3cccc(C)c3)C(S)=NCCCN3CCOCC3)c(O)nc2cc1OC	InChI=1S/C29H38N4O4S/c1-21-6-4-7-22(16-21)8-11-33(29(38)30-9-5-10-32-12-14-37-15-13-32)20-24-17-23-18-26(35-2)27(36-3)19-25(23)31-28(24)34/h4,6-7,16-19H,5,8-15,20H2,1-3H3,(H,30,38)(H,31,34)	FTVZHURJKBLCBP-UHFFFAOYSA-N	538.261376426							107966
Cis-(5,12)-7,7,14,14-Hexamethyl-1,4,8,11-Tetraazacyclotetradecane	LSM-19344	SID48410172, SID7977308, BRD-A45601407	143337	InChI=1S/C16H36N4/c1-13-11-15(3,4)19-10-8-18-14(2)12-16(5,6)20-9-7-17-13/h13-14,17-20H,7-12H2,1-6H3	XHCNINMOALIGKM-UHFFFAOYSA-N	CC1CC(C)(C)NCCNC(C)CC(C)(C)NCCN1	BroadT	BRD-A45601407	BRD-A45601407-001-05-7	ChemBridge Corporation	5156578			CC1CC(C)(C)NCCNC(C)CC(C)(C)NCCN1	InChI=1S/C16H36N4/c1-13-11-15(3,4)19-10-8-18-14(2)12-16(5,6)20-9-7-17-13/h13-14,17-20H,7-12H2,1-6H3	XHCNINMOALIGKM-UHFFFAOYSA-N	284.293997192							107967
SMR000153033	LSM-19345	SID16952841, BRD-K29961735	2109647	InChI=1S/C24H24N4O7/c1-15-9-21(27-35-15)26-22(29)14-34-20-6-5-18(33-3)11-19(20)23(30)17-10-16(12-25)24(31)28(13-17)7-4-8-32-2/h5-6,9-11,13H,4,7-8,14H2,1-3H3,(H,26,27,29)	WKBMJLABMRWBRG-UHFFFAOYSA-N	COCCCN1C=C(C=C(C#N)C1=O)C(=O)c2cc(OC)ccc2OCC(=O)Nc3cc(C)on3	BroadT	BRD-K29961735	BRD-K29961735-001-05-6	Enamine Ltd.	T5239885			COCCCn1cc(cc(C#N)c1=O)C(=O)c1cc(OC)ccc1OCC(=O)Nc1cc(C)on1	InChI=1S/C24H24N4O7/c1-15-9-21(27-35-15)26-22(29)14-34-20-6-5-18(33-3)11-19(20)23(30)17-10-16(12-25)24(31)28(13-17)7-4-8-32-2/h5-6,9-11,13H,4,7-8,14H2,1-3H3,(H,26,27,29)	WKBMJLABMRWBRG-UHFFFAOYSA-N	480.164499148							107968
Methiazole	LSM-4894	SID56463642, SID11112923	6604471	InChI=1S/C12H15N3O2S/c1-7(2)18-8-4-5-9-10(6-8)14-11(13-9)15-12(16)17-3/h4-7H,1-3H3,(H2,13,14,15,16)	SXJIZQPZESTWLD-UHFFFAOYSA-N	COC(=O)Nc1nc2cc(SC(C)C)ccc2[nH]1	BroadT	BRD-K02764365	BRD-K02764365-001-08-6	Prestwick Chemical Inc.	Prestw-1080			COC(=O)Nc1nc2cc(SC(C)C)ccc2[nH]1	InChI=1S/C12H15N3O2S/c1-7(2)18-8-4-5-9-10(6-8)14-11(13-9)15-12(16)17-3/h4-7H,1-3H3,(H2,13,14,15,16)	SXJIZQPZESTWLD-UHFFFAOYSA-N	265.08849744							94268
N-[3-Chloro-4-(morpholin-4-yl)phenyl]-1,2-benzothiazol-3-amine 1,1-dioxide	LSM-19346	SID24792415, BRD-K34903299	2972816	InChI=1S/C17H16ClN3O3S/c18-14-11-12(5-6-15(14)21-7-9-24-10-8-21)19-17-13-3-1-2-4-16(13)25(22,23)20-17/h1-6,11H,7-10H2,(H,19,20)	SSFYSXUBOLEKJB-UHFFFAOYSA-N	Clc1cc(NC2=NS(=O)(=O)c3ccccc23)ccc1N4CCOCC4	BroadT	BRD-K34903299	BRD-K34903299-001-05-9	ChemBridge Corporation	7953939			Clc1cc(NC2=NS(=O)(=O)c3ccccc23)ccc1N1CCOCC1	InChI=1S/C17H16ClN3O3S/c18-14-11-12(5-6-15(14)21-7-9-24-10-8-21)19-17-13-3-1-2-4-16(13)25(22,23)20-17/h1-6,11H,7-10H2,(H,19,20)	SSFYSXUBOLEKJB-UHFFFAOYSA-N	377.060089802							107969
SMR000105843	LSM-19347	BRD-K75260889, SID7972923	873555	InChI=1S/C16H16N2O5/c1-22-13-8-11(15(19)20)12(9-14(13)23-2)18-16(21)17-10-6-4-3-5-7-10/h3-9H,1-2H3,(H,19,20)(H2,17,18,21)	RXKADNGKBUOGSH-UHFFFAOYSA-N	COc1cc(NC(=O)Nc2ccccc2)c(cc1OC)C(=O)O	BroadT	BRD-K75260889	BRD-K75260889-001-07-6	ChemBridge Corporation	6103445			COc1cc(NC(=O)Nc2ccccc2)c(cc1OC)C(O)=O	InChI=1S/C16H16N2O5/c1-22-13-8-11(15(19)20)12(9-14(13)23-2)18-16(21)17-10-6-4-3-5-7-10/h3-9H,1-2H3,(H,19,20)(H2,17,18,21)	RXKADNGKBUOGSH-UHFFFAOYSA-N	316.105921632							107970
SMR000064860	LSM-19348	BRD-A78125048, SID3714119	2998672	InChI=1S/C21H24N2O5S/c1-15-7-8-17(13-16(15)2)29(25,26)23-11-9-22(10-12-23)21(24)20-14-27-18-5-3-4-6-19(18)28-20/h3-8,13,20H,9-12,14H2,1-2H3	WPCWVOQEDYIZGS-UHFFFAOYSA-N	Cc1ccc(cc1C)S(=O)(=O)N2CCN(CC2)C(=O)C3COc4ccccc4O3	BroadT	BRD-A78125048	BRD-A78125048-001-05-2	Enamine Ltd.	Z45501354			Cc1ccc(cc1C)S(=O)(=O)N1CCN(CC1)C(=O)C1COc2ccccc2O1	InChI=1S/C21H24N2O5S/c1-15-7-8-17(13-16(15)2)29(25,26)23-11-9-22(10-12-23)21(24)20-14-27-18-5-3-4-6-19(18)28-20/h3-8,13,20H,9-12,14H2,1-2H3	WPCWVOQEDYIZGS-UHFFFAOYSA-N	416.140592578							107971
MLS000064295	LSM-19349	BRD-K61909412, SID4260153	978001	InChI=1S/C13H7BrClN3O/c14-9-1-2-11(15)10(7-9)13-17-12(18-19-13)8-3-5-16-6-4-8/h1-7H	FUWIMUYDFFIVTF-UHFFFAOYSA-N	Clc1ccc(Br)cc1c2onc(n2)c3ccncc3	BroadT	BRD-K61909412	BRD-K61909412-001-05-4	ChemBridge Corporation	7783279			Clc1ccc(Br)cc1-c1nc(no1)-c1ccncc1	InChI=1S/C13H7BrClN3O/c14-9-1-2-11(15)10(7-9)13-17-12(18-19-13)8-3-5-16-6-4-8/h1-7H	FUWIMUYDFFIVTF-UHFFFAOYSA-N	334.946102184							107972
ENAMINE_000247	LSM-15291	BRD-A88691416	2838454	InChI=1S/C18H29NO3/c1-13(2)16-5-7-18(8-6-16)21-12-17(20)11-19-9-14(3)22-15(4)10-19/h5-8,13-15,17,20H,9-12H2,1-4H3	QNIGLMISXJYUPM-UHFFFAOYSA-N	CC(C)c1ccc(OCC(O)CN2CC(C)OC(C)C2)cc1	BroadT	BRD-A88691416	BRD-A88691416-003-05-1	Enamine Ltd.	T0500-8935		Cl	CC(C)c1ccc(OCC(O)CN2CC(C)OC(C)C2)cc1.Cl	InChI=1S/C18H29NO3.ClH/c1-13(2)16-5-7-18(8-6-16)21-12-17(20)11-19-9-14(3)22-15(4)10-19;/h5-8,13-15,17,20H,9-12H2,1-4H3;1H	ROUXNCCWXIPLBJ-UHFFFAOYSA-N	307.214743798							103938, 103938
SMR000016080	LSM-19350	SID4246488, BRD-K50068274	3240833	InChI=1S/C20H23N3O4/c1-23-15-8-6-5-7-14(15)22-18(23)9-10-21-20(24)13-11-16(25-2)19(27-4)17(12-13)26-3/h5-8,11-12H,9-10H2,1-4H3,(H,21,24)	CKIZQFCGETXRJP-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)NCCc2nc3ccccc3n2C	BroadT	BRD-K50068274	BRD-K50068274-001-06-7	Life Chemicals Inc.	F0585-0816			COc1cc(cc(OC)c1OC)C(=O)NCCc1nc2ccccc2n1C	InChI=1S/C20H23N3O4/c1-23-15-8-6-5-7-14(15)22-18(23)9-10-21-20(24)13-11-16(25-2)19(27-4)17(12-13)26-3/h5-8,11-12H,9-10H2,1-4H3,(H,21,24)	CKIZQFCGETXRJP-UHFFFAOYSA-N	369.168856246							107973
BRD-A61767497	LSM-19351	BRD-A61767497		InChI=1S/C25H29N3O2/c1-14-10-19-20(11-15(14)2)28-24(17-6-8-18(9-7-17)26-16(3)29)23-21(27-19)12-25(4,5)13-22(23)30/h6-11,23-24,28H,12-13H2,1-5H3,(H,26,29)	WVJPABJAYYPHQO-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)C2Nc3cc(C)c(C)cc3N=C4CC(C)(C)CC(=O)C24	BroadT	BRD-A61767497	BRD-A61767497-001-05-6	Asinex Ltd.	BAS 02170350			CC(=O)Nc1ccc(cc1)C1Nc2cc(C)c(C)cc2N=C2CC(C)(C)CC(=O)C12	InChI=1S/C25H29N3O2/c1-14-10-19-20(11-15(14)2)28-24(17-6-8-18(9-7-17)26-16(3)29)23-21(27-19)12-25(4,5)13-22(23)30/h6-11,23-24,28H,12-13H2,1-5H3,(H,26,29)	WVJPABJAYYPHQO-UHFFFAOYSA-N	403.225977198							107974
SMR000143107	LSM-19352	BRD-K23430405, SID14730744	2184557	InChI=1S/C16H14N2OS/c1-2-7-14-13(5-1)6-3-8-15(14)19-11-12-20-16-17-9-4-10-18-16/h1-10H,11-12H2	FZRICGVLOQVALD-UHFFFAOYSA-N	C(CSc1ncccn1)Oc2cccc3ccccc23	BroadT	BRD-K23430405	BRD-K23430405-001-05-7	ChemBridge Corporation	7344326			C(CSc1ncccn1)Oc1cccc2ccccc12	InChI=1S/C16H14N2OS/c1-2-7-14-13(5-1)6-3-8-15(14)19-11-12-20-16-17-9-4-10-18-16/h1-10H,11-12H2	FZRICGVLOQVALD-UHFFFAOYSA-N	282.082683778							107975
47465-97-4	LSM-19353	BRD-K92722247, SID17414871	162076	InChI=1S/C22H19NO3/c1-13-11-15(7-9-19(13)24)22(16-8-10-20(25)14(2)12-16)17-5-3-4-6-18(17)23-21(22)26/h3-12,24-25H,1-2H3,(H,23,26)	ZEKCYPANSOJWDH-UHFFFAOYSA-N	Cc1cc(ccc1O)C2(C(=O)Nc3ccccc23)c4ccc(O)c(C)c4	BroadT	BRD-K92722247	BRD-K92722247-001-06-3	ChemBridge Corporation	5762905			Cc1cc(ccc1O)C1(C(=O)Nc2ccccc12)c1ccc(O)c(C)c1	InChI=1S/C22H19NO3/c1-13-11-15(7-9-19(13)24)22(16-8-10-20(25)14(2)12-16)17-5-3-4-6-18(17)23-21(22)26/h3-12,24-25H,1-2H3,(H,23,26)	ZEKCYPANSOJWDH-UHFFFAOYSA-N	345.136493478							107976
BRD-A81879813	LSM-19354	BRD-A81879813		InChI=1S/C15H17N5O2/c1-9(2)22-14(21)12-10(3)19-15-17-8-18-20(15)13(12)11-5-4-6-16-7-11/h4-9,12-13H,1-3H3	YIJNZQVCJNLROF-UHFFFAOYSA-N	CC(C)OC(=O)C1C(c2cccnc2)n3ncnc3N=C1C	BroadT	BRD-A81879813	BRD-A81879813-001-06-0	ChemDiv Inc.	5976-1075			CC(C)OC(=O)C1C(c2cccnc2)n2ncnc2N=C1C	InChI=1S/C15H17N5O2/c1-9(2)22-14(21)12-10(3)19-15-17-8-18-20(15)13(12)11-5-4-6-16-7-11/h4-9,12-13H,1-3H3	YIJNZQVCJNLROF-UHFFFAOYSA-N	299.138224834							107977
STK276890	LSM-19355	BRD-K55665639, SID24793356	1250934	InChI=1S/C14H13NO4/c1-2-13(16)19-11-7-5-10(6-8-11)15-14(17)12-4-3-9-18-12/h3-9H,2H2,1H3,(H,15,17)	MSPUYHYGERNXGU-UHFFFAOYSA-N	CCC(=O)Oc1ccc(NC(=O)c2occc2)cc1	BroadT	BRD-K55665639	BRD-K55665639-001-05-7	ChemBridge Corporation	7958226			CCC(=O)Oc1ccc(NC(=O)c2ccco2)cc1	InChI=1S/C14H13NO4/c1-2-13(16)19-11-7-5-10(6-8-11)15-14(17)12-4-3-9-18-12/h3-9H,2H2,1H3,(H,15,17)	MSPUYHYGERNXGU-UHFFFAOYSA-N	259.084457906							107978
SMR000111771	LSM-19356	BRD-K88388723, SID7973436	1129966	InChI=1S/C24H23N3O2/c28-24(27-15-13-26(14-16-27)23-11-5-6-12-25-23)17-20-18-7-1-3-9-21(18)29-22-10-4-2-8-19(20)22/h1-12,20H,13-17H2	USMJFZYNIFTLDL-UHFFFAOYSA-N	O=C(CC1c2ccccc2Oc3ccccc13)N4CCN(CC4)c5ccccn5	BroadT	BRD-K88388723	BRD-K88388723-001-05-4	ChemBridge Corporation	5603961			O=C(CC1c2ccccc2Oc2ccccc12)N1CCN(CC1)c1ccccn1	InChI=1S/C24H23N3O2/c28-24(27-15-13-26(14-16-27)23-11-5-6-12-25-23)17-20-18-7-1-3-9-21(18)29-22-10-4-2-8-19(20)22/h1-12,20H,13-17H2	USMJFZYNIFTLDL-UHFFFAOYSA-N	385.179027006							107979
ST063464	LSM-19357	BRD-A32018906, SID4258123	2957027	InChI=1S/C17H14ClNO5/c1-22-17(21)11-8-10(6-7-12(11)18)19-16(20)15-9-23-13-4-2-3-5-14(13)24-15/h2-8,15H,9H2,1H3,(H,19,20)	BWTXGMDTJIHSGE-UHFFFAOYSA-N	COC(=O)c1cc(NC(=O)C2COc3ccccc3O2)ccc1Cl	BroadT	BRD-A32018906	BRD-A32018906-001-05-5	ChemBridge Corporation	7821324			COC(=O)c1cc(NC(=O)C2COc3ccccc3O2)ccc1Cl	InChI=1S/C17H14ClNO5/c1-22-17(21)11-8-10(6-7-12(11)18)19-16(20)15-9-23-13-4-2-3-5-14(13)24-15/h2-8,15H,9H2,1H3,(H,19,20)	BWTXGMDTJIHSGE-UHFFFAOYSA-N	347.056050268							107980
1-(4-Methoxyphenyl)-n-[2-(morpholin-4-yl)ethyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine	LSM-19358	BRD-K59560948, SID14742026	1985423	InChI=1S/C18H22N6O2/c1-25-15-4-2-14(3-5-15)24-18-16(12-22-24)17(20-13-21-18)19-6-7-23-8-10-26-11-9-23/h2-5,12-13H,6-11H2,1H3,(H,19,20,21)	QHEAREBENILWNA-UHFFFAOYSA-N	COc1ccc(cc1)n2ncc3c(NCCN4CCOCC4)ncnc23	BroadT	BRD-K59560948	BRD-K59560948-001-05-2	InterBioScreen Ltd.	STOCK3S-39023			COc1ccc(cc1)-n1ncc2c(NCCN3CCOCC3)ncnc12	InChI=1S/C18H22N6O2/c1-25-15-4-2-14(3-5-15)24-18-16(12-22-24)17(20-13-21-18)19-6-7-23-8-10-26-11-9-23/h2-5,12-13H,6-11H2,1H3,(H,19,20,21)	QHEAREBENILWNA-UHFFFAOYSA-N	354.180424004							107981
1-Cyclopentyl-3-(2-phenoxyphenyl)thiourea	LSM-19359	SID24796667, BRD-K61432982	971568	InChI=1S/C18H20N2OS/c22-18(19-14-8-4-5-9-14)20-16-12-6-7-13-17(16)21-15-10-2-1-3-11-15/h1-3,6-7,10-14H,4-5,8-9H2,(H2,19,20,22)	DKAXCXMOXXOTKQ-UHFFFAOYSA-N	S=C(NC1CCCC1)Nc2ccccc2Oc3ccccc3	BroadT	BRD-K61432982	BRD-K61432982-001-05-7	ChemBridge Corporation	7824862			S=C(NC1CCCC1)Nc1ccccc1Oc1ccccc1	InChI=1S/C18H20N2OS/c22-18(19-14-8-4-5-9-14)20-16-12-6-7-13-17(16)21-15-10-2-1-3-11-15/h1-3,6-7,10-14H,4-5,8-9H2,(H2,19,20,22)	DKAXCXMOXXOTKQ-UHFFFAOYSA-N	312.12963397							107982
SMR000149222	LSM-19360	BRD-K19387722, SID14741735	3802600	InChI=1S/C23H31N5/c1-6-26-12-14-27(15-13-26)20-16-19(23(3,4)5)24-22-21(17(2)25-28(20)22)18-10-8-7-9-11-18/h7-11,16H,6,12-15H2,1-5H3	IBAJVZQIEQKVFA-UHFFFAOYSA-N	CCN1CCN(CC1)c2cc(nc3c(c(C)nn23)c4ccccc4)C(C)(C)C	BroadT	BRD-K19387722	BRD-K19387722-001-07-7	InterBioScreen Ltd.	STOCK5S-14730			CCN1CCN(CC1)c1cc(nc2c(c(C)nn12)-c1ccccc1)C(C)(C)C	InChI=1S/C23H31N5/c1-6-26-12-14-27(15-13-26)20-16-19(23(3,4)5)24-22-21(17(2)25-28(20)22)18-10-8-7-9-11-18/h7-11,16H,6,12-15H2,1-5H3	IBAJVZQIEQKVFA-UHFFFAOYSA-N	377.257946042							107983
AC1LFBDR	LSM-19361	BRD-K94833531, SID22415698	800270	InChI=1S/C15H12N4O2S/c20-19(21)13-8-4-7-12(9-13)14-16-17-15(22)18(14)10-11-5-2-1-3-6-11/h1-9H,10H2,(H,17,22)	AQJIGPKXAIINEO-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)c2nnc(S)n2Cc3ccccc3	BroadT	BRD-K94833531	BRD-K94833531-001-05-3	ChemBridge Corporation	6915665			[O-][N+](=O)c1cccc(c1)-c1nnc(S)n1Cc1ccccc1	InChI=1S/C15H12N4O2S/c20-19(21)13-8-4-7-12(9-13)14-16-17-15(22)18(14)10-11-5-2-1-3-6-11/h1-9H,10H2,(H,17,22)	AQJIGPKXAIINEO-UHFFFAOYSA-N	312.068096354							107984
F3115-0024	LSM-19362	SID24786011, BRD-A75087829	2943513	InChI=1S/C18H14N2O7S/c1-27-10-6-7-12(13(8-10)20(25)26)19-16(21)9-15(17(19)22)28-14-5-3-2-4-11(14)18(23)24/h2-8,15H,9H2,1H3,(H,23,24)	VJYWONMCFNDWOF-UHFFFAOYSA-N	COc1ccc(N2C(=O)CC(Sc3ccccc3C(=O)O)C2=O)c(c1)[N+](=O)[O-]	BroadT	BRD-A75087829	BRD-A75087829-001-05-2	ChemBridge Corporation	7615668			COc1ccc(N2C(=O)CC(Sc3ccccc3C(O)=O)C2=O)c(c1)[N+]([O-])=O	InChI=1S/C18H14N2O7S/c1-27-10-6-7-12(13(8-10)20(25)26)19-16(21)9-15(17(19)22)28-14-5-3-2-4-11(14)18(23)24/h2-8,15H,9H2,1H3,(H,23,24)	VJYWONMCFNDWOF-UHFFFAOYSA-N	402.052171498							107985
SMR000002944	LSM-19363	BRD-A52729710, SID26667935, SID848782	651236	InChI=1S/C26H30N6O2/c1-5-26(2,3)32-24(28-29-30-32)23(31-13-12-17-8-6-7-9-19(17)16-31)21-14-18-10-11-20(34-4)15-22(18)27-25(21)33/h6-11,14-15,23H,5,12-13,16H2,1-4H3,(H,27,33)	WWWIBCLGMNAXSH-UHFFFAOYSA-N	CCC(C)(C)n1nnnc1C(N2CCc3ccccc3C2)c4cc5ccc(OC)cc5nc4O	BroadT	BRD-A52729710	BRD-A52729710-001-07-4	Asinex Ltd.	ASN 04189326			CCC(C)(C)n1nnnc1C(N1CCc2ccccc2C1)c1cc2ccc(OC)cc2nc1O	InChI=1S/C26H30N6O2/c1-5-26(2,3)32-24(28-29-30-32)23(31-13-12-17-8-6-7-9-19(17)16-31)21-14-18-10-11-20(34-4)15-22(18)27-25(21)33/h6-11,14-15,23H,5,12-13,16H2,1-4H3,(H,27,33)	WWWIBCLGMNAXSH-UHFFFAOYSA-N	458.24302426							107986
MLS000117133	LSM-19364	BRD-K05392698, SID24838633, SID7965576, SID87544701	5307705	InChI=1S/C24H27N3O5/c1-3-32-24(30)26-13-11-17(12-14-26)25-22(28)20-6-4-5-16-15-27(23(29)21(16)20)18-7-9-19(31-2)10-8-18/h4-10,17H,3,11-15H2,1-2H3,(H,25,28)	XINSMRKQRPCGCW-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)NC(=O)c2cccc3CN(C(=O)c23)c4ccc(OC)cc4	BroadT	BRD-K05392698	BRD-K05392698-001-05-7	ChemDiv Inc.	C447-1344			CCOC(=O)N1CCC(CC1)NC(=O)c1cccc2CN(C(=O)c12)c1ccc(OC)cc1	InChI=1S/C24H27N3O5/c1-3-32-24(30)26-13-11-17(12-14-26)25-22(28)20-6-4-5-16-15-27(23(29)21(16)20)18-7-9-19(31-2)10-8-18/h4-10,17H,3,11-15H2,1-2H3,(H,25,28)	XINSMRKQRPCGCW-UHFFFAOYSA-N	437.195070994							107987
6-Chloro-[1,2,4]triazolo[3,4-a]phthalazine	LSM-19365	SID24804147, BRD-K48899005	313633	InChI=1S/C9H5ClN4/c10-8-6-3-1-2-4-7(6)9-12-11-5-14(9)13-8/h1-5H	BSXQUTKJCQAPNE-UHFFFAOYSA-N	Clc1nn2cnnc2c3ccccc13	BroadT	BRD-K48899005	BRD-K48899005-001-05-8	Asinex Ltd.	BAS 03374303			Clc1nn2cnnc2c2ccccc12	InChI=1S/C9H5ClN4/c10-8-6-3-1-2-4-7(6)9-12-11-5-14(9)13-8/h1-5H	BSXQUTKJCQAPNE-UHFFFAOYSA-N	204.02027391							107988
SMR000062438	LSM-19366	BRD-K70057550, SID24839795, SID3715059	2999064	InChI=1S/C20H17NO6S2/c22-20(27-13-14-4-3-11-28-14)16-5-1-2-6-17(16)21-29(23,24)15-7-8-18-19(12-15)26-10-9-25-18/h1-8,11-12,21H,9-10,13H2	HFEGLUYENROKRX-UHFFFAOYSA-N	O=C(OCc1cccs1)c2ccccc2NS(=O)(=O)c3ccc4OCCOc4c3	BroadT	BRD-K70057550	BRD-K70057550-001-05-3	Enamine Ltd.	T0514-6849			O=C(OCc1cccs1)c1ccccc1NS(=O)(=O)c1ccc2OCCOc2c1	InChI=1S/C20H17NO6S2/c22-20(27-13-14-4-3-11-28-14)16-5-1-2-6-17(16)21-29(23,24)15-7-8-18-19(12-15)26-10-9-25-18/h1-8,11-12,21H,9-10,13H2	HFEGLUYENROKRX-UHFFFAOYSA-N	431.049728654							107989
5K-600S	LSM-19367	BRD-A24369193, SID17410505	3734300	InChI=1S/C18H17ClN2O/c1-21-18(19)15(16(20-21)13-9-5-3-6-10-13)17(22-2)14-11-7-4-8-12-14/h3-12,17H,1-2H3	GNFHAMHITFBPIH-UHFFFAOYSA-N	COC(c1ccccc1)c2c(Cl)n(C)nc2c3ccccc3	BroadT	BRD-A24369193	BRD-A24369193-001-05-4	Key Organics Ltd.	5K-600S			COC(c1c(nn(C)c1Cl)-c1ccccc1)c1ccccc1	InChI=1S/C18H17ClN2O/c1-21-18(19)15(16(20-21)13-9-5-3-6-10-13)17(22-2)14-11-7-4-8-12-14/h3-12,17H,1-2H3	GNFHAMHITFBPIH-UHFFFAOYSA-N	312.102940894							107990
T5274851	LSM-19368	BRD-K56562541, SID24835494	2089464	InChI=1S/C22H22N2O4/c1-14(2)23-21(25)13-28-22(26)18-12-20(15-8-10-16(27-3)11-9-15)24-19-7-5-4-6-17(18)19/h4-12,14H,13H2,1-3H3,(H,23,25)	DIRRMYFWNDLMPA-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(C(=O)OCC(=O)NC(C)C)c3ccccc3n2	BroadT	BRD-K56562541	BRD-K56562541-001-05-2	Enamine Ltd.	T5274851			COc1ccc(cc1)-c1cc(C(=O)OCC(=O)NC(C)C)c2ccccc2n1	InChI=1S/C22H22N2O4/c1-14(2)23-21(25)13-28-22(26)18-12-20(15-8-10-16(27-3)11-9-15)24-19-7-5-4-6-17(18)19/h4-12,14H,13H2,1-3H3,(H,23,25)	DIRRMYFWNDLMPA-UHFFFAOYSA-N	378.157957204							107991
CID 16187112	LSM-43830	BRD-K52924481	16187112	InChI=1S/C15H13ClN2O3/c1-10(4-6-12-3-2-8-21-12)17-18-15(20)13-9-11(16)5-7-14(13)19/h2-9,19H,1H3,(H,18,20)/b6-4+,17-10?	UILGZOPYAIEXTJ-QQPYHADESA-N	CC(=NNC(=O)c1cc(Cl)ccc1O)\C=C\c2occc2	BroadT	BRD-K52924481	BRD-K52924481-001-05-0	ChemDiv Inc.	4632-6819			CC(\C=C\c1ccco1)=NNC(=O)c1cc(Cl)ccc1O	InChI=1S/C15H13ClN2O3/c1-10(4-6-12-3-2-8-21-12)17-18-15(20)13-9-11(16)5-7-14(13)19/h2-9,19H,1H3,(H,18,20)/b6-4+,17-10?	UILGZOPYAIEXTJ-QQPYHADESA-N	304.061470006							
SMR000624064	LSM-43831	BRD-K44705560, SID49735315	24793660	InChI=1S/C24H25N3O4S/c1-3-31-24(30)27-11-9-26(10-12-27)23(29)18-7-8-20-19(15-18)25-22(28)21(32-20)14-17-6-4-5-16(2)13-17/h4-8,13-15H,3,9-12H2,1-2H3,(H,25,28)/b21-14+	MAWWLDSICPSISK-KGENOOAVSA-N	CCOC(=O)N1CCN(CC1)C(=O)c2ccc3S\C(=C\c4cccc(C)c4)\C(=O)Nc3c2	BroadT	BRD-K44705560	BRD-K44705560-001-05-8	ChemDiv Inc.	C700-0671			CCOC(=O)N1CCN(CC1)C(=O)c1ccc2S\C(=C\c3cccc(C)c3)C(=O)Nc2c1	InChI=1S/C24H25N3O4S/c1-3-31-24(30)27-11-9-26(10-12-27)23(29)18-7-8-20-19(15-18)25-22(28)21(32-20)14-17-6-4-5-16(2)13-17/h4-8,13-15H,3,9-12H2,1-2H3,(H,25,28)/b21-14+	MAWWLDSICPSISK-KGENOOAVSA-N	451.156577							
Heptanoic acid (4-hydroxy-2-oxo-1,2-dihydro-quinolin-3-yl)-amide	LSM-19371	BRD-K92176613, SID851408	54683986	InChI=1S/C16H20N2O3/c1-2-3-4-5-10-13(19)18-14-15(20)11-8-6-7-9-12(11)17-16(14)21/h6-9H,2-5,10H2,1H3,(H,18,19)(H2,17,20,21)	TWSNQWIBRZVNRU-UHFFFAOYSA-N	CCCCCCC(=O)Nc1c(O)nc2ccccc2c1O	BroadT	BRD-K92176613	BRD-K92176613-001-05-0	Asinex Ltd.	BAS 00219325			CCCCCCC(=O)Nc1c(O)nc2ccccc2c1O	InChI=1S/C16H20N2O3/c1-2-3-4-5-10-13(19)18-14-15(20)11-8-6-7-9-12(11)17-16(14)21/h6-9H,2-5,10H2,1H3,(H,18,19)(H2,17,20,21)	TWSNQWIBRZVNRU-UHFFFAOYSA-N	288.14739252							107994
SMR000172902	LSM-19372	BRD-A94885304, SID17509066, SID57299442	3191162	InChI=1S/C29H32N2O4S/c1-35-29(34)23-16-14-22(15-17-23)27(28(33)30-24-11-6-3-7-12-24)31(20-21-9-4-2-5-10-21)26(32)19-25-13-8-18-36-25/h2,4-5,8-10,13-18,24,27H,3,6-7,11-12,19-20H2,1H3,(H,30,33)	XEYHWRWWSDHXFV-UHFFFAOYSA-N	COC(=O)c1ccc(cc1)C(N(Cc2ccccc2)C(=O)Cc3cccs3)C(=O)NC4CCCCC4	BroadT	BRD-A94885304	BRD-A94885304-001-05-0	Asinex Ltd.	ASN 04883758			COC(=O)c1ccc(cc1)C(N(Cc1ccccc1)C(=O)Cc1cccs1)C(=O)NC1CCCCC1	InChI=1S/C29H32N2O4S/c1-35-29(34)23-16-14-22(15-17-23)27(28(33)30-24-11-6-3-7-12-24)31(20-21-9-4-2-5-10-21)26(32)19-25-13-8-18-36-25/h2,4-5,8-10,13-18,24,27H,3,6-7,11-12,19-20H2,1H3,(H,30,33)	XEYHWRWWSDHXFV-UHFFFAOYSA-N	504.208278214							107995
MLS000103599	LSM-19373	BRD-K45894579, SID7971282	2148477	InChI=1S/C15H23N3O3/c1-17-12(10-14(20)18(2)15(17)21)16-13(19)9-8-11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H,16,19)	YXMRLWJUDLJHQZ-UHFFFAOYSA-N	CN1C(=O)C=C(NC(=O)CCC2CCCCC2)N(C)C1=O	BroadT	BRD-K45894579	BRD-K45894579-001-04-1	Life Chemicals Inc.	F1801-0061			Cn1c(NC(=O)CCC2CCCCC2)cc(=O)n(C)c1=O	InChI=1S/C15H23N3O3/c1-17-12(10-14(20)18(2)15(17)21)16-13(19)9-8-11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H,16,19)	YXMRLWJUDLJHQZ-UHFFFAOYSA-N	293.173941626							107996
SMR000003228	LSM-19374	SID848744, SID26667408, BRD-K72591075	651201	InChI=1S/C24H30N6O2S/c1-5-24(3,4)30-22(26-27-28-30)16-29(15-20-8-7-11-33-20)14-18-12-17-13-19(32-6-2)9-10-21(17)25-23(18)31/h7-13H,5-6,14-16H2,1-4H3,(H,25,31)	NXHUITDSVPREHK-UHFFFAOYSA-N	CCOc1ccc2nc(O)c(CN(Cc3cccs3)Cc4nnnn4C(C)(C)CC)cc2c1	BroadT	BRD-K72591075	BRD-K72591075-001-06-3	Asinex Ltd.	ASN 04370318			CCOc1ccc2nc(O)c(CN(Cc3cccs3)Cc3nnnn3C(C)(C)CC)cc2c1	InChI=1S/C24H30N6O2S/c1-5-24(3,4)30-22(26-27-28-30)16-29(15-20-8-7-11-33-20)14-18-12-17-13-19(32-6-2)9-10-21(17)25-23(18)31/h7-13H,5-6,14-16H2,1-4H3,(H,25,31)	NXHUITDSVPREHK-UHFFFAOYSA-N	466.21509495							107997
7K-645S	LSM-19375	BRD-K89574562, SID17412116	1484136	InChI=1S/C15H10Cl2N2OS/c1-21-13-5-3-2-4-11(13)15-19-18-14(20-15)10-7-6-9(16)8-12(10)17/h2-8H,1H3	SHRIWOKJRAZPAH-UHFFFAOYSA-N	CSc1ccccc1c2oc(nn2)c3ccc(Cl)cc3Cl	BroadT	BRD-K89574562	BRD-K89574562-001-05-2	Key Organics Ltd.	7K-645S			CSc1ccccc1-c1nnc(o1)-c1ccc(Cl)cc1Cl	InChI=1S/C15H10Cl2N2OS/c1-21-13-5-3-2-4-11(13)15-19-18-14(20-15)10-7-6-9(16)8-12(10)17/h2-8H,1H3	SHRIWOKJRAZPAH-UHFFFAOYSA-N	335.98908907							107998
N-[1-(4-Bromophenyl)ethyl]cyclobutanecarboxamide	LSM-19376	BRD-A06837695, SID22415457	2918642	InChI=1S/C13H16BrNO/c1-9(10-5-7-12(14)8-6-10)15-13(16)11-3-2-4-11/h5-9,11H,2-4H2,1H3,(H,15,16)	ZKVJJEODNIPOPE-UHFFFAOYSA-N	CC(NC(=O)C1CCC1)c2ccc(Br)cc2	BroadT	BRD-A06837695	BRD-A06837695-001-05-5	ChemBridge Corporation	6909340			CC(NC(=O)C1CCC1)c1ccc(Br)cc1	InChI=1S/C13H16BrNO/c1-9(10-5-7-12(14)8-6-10)15-13(16)11-3-2-4-11/h5-9,11H,2-4H2,1H3,(H,15,16)	ZKVJJEODNIPOPE-UHFFFAOYSA-N	281.041526742							107999
AC1N1NEQ	LSM-19377	BRD-K98374711	3983933	InChI=1S/C11H12N4OS/c1-7-3-4-17-9(7)6-12-15-11-13-8(2)5-10(16)14-11/h3-6H,1-2H3,(H2,13,14,15,16)	VARYQVLCDBKQNL-UHFFFAOYSA-N	Cc1cc(O)nc(NN=Cc2sccc2C)n1	BroadT	BRD-K98374711	BRD-K98374711-001-05-6	ChemDiv Inc.	K072-0224			Cc1ccsc1C=NNc1nc(C)cc(O)n1	InChI=1S/C11H12N4OS/c1-7-3-4-17-9(7)6-12-15-11-13-8(2)5-10(16)14-11/h3-6H,1-2H3,(H2,13,14,15,16)	VARYQVLCDBKQNL-UHFFFAOYSA-N	248.073181734							108000
T5249110	LSM-19378	BRD-A52024592, SID22407628	3499756	InChI=1S/C22H25N3OS2/c1-15-7-8-17-18(13-15)28-22-20(17)21(27-16-5-3-2-4-6-16)23-19(24-22)14-25-9-11-26-12-10-25/h2-6,15H,7-14H2,1H3	URCOLTFOBLDFKR-UHFFFAOYSA-N	CC1CCc2c(C1)sc3nc(CN4CCOCC4)nc(Sc5ccccc5)c23	BroadT	BRD-A52024592	BRD-A52024592-001-05-7	Enamine Ltd.	T5249110			CC1CCc2c(C1)sc1nc(CN3CCOCC3)nc(Sc3ccccc3)c21	InChI=1S/C22H25N3OS2/c1-15-7-8-17-18(13-15)28-22-20(17)21(27-16-5-3-2-4-6-16)23-19(24-22)14-25-9-11-26-12-10-25/h2-6,15H,7-14H2,1H3	URCOLTFOBLDFKR-UHFFFAOYSA-N	411.14390383							108001
AC1LJBTR	LSM-19379	BRD-K26233698, SID24789786	54680873	InChI=1S/C16H12ClNO2/c17-11-6-7-14-12(9-11)15(19)13(16(20)18-14)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H2,18,19,20)	UPOCVBGJUWKZNY-UHFFFAOYSA-N	Oc1nc2ccc(Cl)cc2c(O)c1Cc3ccccc3	BroadT	BRD-K26233698	BRD-K26233698-001-05-8	Asinex Ltd.	BAS 08138410			Oc1nc2ccc(Cl)cc2c(O)c1Cc1ccccc1	InChI=1S/C16H12ClNO2/c17-11-6-7-14-12(9-11)15(19)13(16(20)18-14)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H2,18,19,20)	UPOCVBGJUWKZNY-UHFFFAOYSA-N	285.055656344							108002
AC1LEQL7	LSM-19380	BRD-K17885598	740303	InChI=1S/C13H15ClN2O2/c1-13(2)7-12(17)11(8-18-13)16-15-10-5-3-9(14)4-6-10/h3-6,15H,7-8H2,1-2H3	WSVFEOHQXPNLFW-UHFFFAOYSA-N	CC1(C)CC(=O)C(=NNc2ccc(Cl)cc2)CO1	BroadT	BRD-K17885598	BRD-K17885598-001-07-3	InterBioScreen Ltd.	STOCK1S-13043			CC1(C)CC(=O)C(CO1)=NNc1ccc(Cl)cc1	InChI=1S/C13H15ClN2O2/c1-13(2)7-12(17)11(8-18-13)16-15-10-5-3-9(14)4-6-10/h3-6,15H,7-8H2,1-2H3	WSVFEOHQXPNLFW-UHFFFAOYSA-N	266.08220545							108003
MLS000588411	LSM-43832	SID17511373, BRD-K56431031	1540074	InChI=1S/C23H22N4O2S/c1-14(2)29-19-10-9-16(11-15(19)3)21-17(12-20-22(28)25-23(24)30-20)13-27(26-21)18-7-5-4-6-8-18/h4-14H,1-3H3,(H2,24,25,28)/b20-12-	BITNRXKPTDBRDQ-NDENLUEZSA-N	CC(C)Oc1ccc(cc1C)c2nn(cc2\C=C\3/SC(=NC3=O)N)c4ccccc4	BroadT	BRD-K56431031	BRD-K56431031-001-05-7	InterBioScreen Ltd.	STOCK2S-35628			CC(C)Oc1ccc(cc1C)-c1nn(cc1\C=C1/SC(N)=NC1=O)-c1ccccc1	InChI=1S/C23H22N4O2S/c1-14(2)29-19-10-9-16(11-15(19)3)21-17(12-20-22(28)25-23(24)30-20)13-27(26-21)18-7-5-4-6-8-18/h4-14H,1-3H3,(H2,24,25,28)/b20-12-	BITNRXKPTDBRDQ-NDENLUEZSA-N	418.146346674							
AC1L8EV5	LSM-19382	BRD-K73095160	380199	InChI=1S/C11H13N3OS/c1-14(2)7-12-11-13-9-5-4-8(15-3)6-10(9)16-11/h4-7H,1-3H3	BPQXVNLXHZYSPG-UHFFFAOYSA-N	COc1ccc2nc(N=CN(C)C)sc2c1	BroadT	BRD-K73095160	BRD-K73095160-001-05-2	ChemDiv Inc.	1313-0436			COc1ccc2nc(N=CN(C)C)sc2c1	InChI=1S/C11H13N3OS/c1-14(2)7-12-11-13-9-5-4-8(15-3)6-10(9)16-11/h4-7H,1-3H3	BPQXVNLXHZYSPG-UHFFFAOYSA-N	235.077932756							108005
AC1LXPJ5	LSM-19383	BRD-K85475457, SID4258086	1834145	InChI=1S/C14H17N5O2/c1-9-3-5-10(6-4-9)16-13(15)19-14-17-11(8-21-2)7-12(20)18-14/h3-7H,8H2,1-2H3,(H4,15,16,17,18,19,20)	TVVKLIKJOPJUQU-UHFFFAOYSA-N	COCc1cc(O)nc(N=C(N)Nc2ccc(C)cc2)n1	BroadT	BRD-K85475457	BRD-K85475457-001-05-4	ChemBridge Corporation	7362043			COCc1cc(O)nc(N=C(N)Nc2ccc(C)cc2)n1	InChI=1S/C14H17N5O2/c1-9-3-5-10(6-4-9)16-13(15)19-14-17-11(8-21-2)7-12(20)18-14/h3-7H,8H2,1-2H3,(H4,15,16,17,18,19,20)	TVVKLIKJOPJUQU-UHFFFAOYSA-N	287.138224834							108006
MLS000049235	LSM-19384	SID4264008, SID104219184, BRD-K07794261	1086855	InChI=1S/C14H10ClN3O2S2/c15-9-3-5-10(6-4-9)20-8-12-17-18-14(22-12)16-13(19)11-2-1-7-21-11/h1-7H,8H2,(H,16,18,19)	ORFONQGKKFOOML-UHFFFAOYSA-N	Clc1ccc(OCc2nnc(NC(=O)c3cccs3)s2)cc1	BroadT	BRD-K07794261	BRD-K07794261-001-05-9	ChemBridge Corporation	7697170			Clc1ccc(OCc2nnc(NC(=O)c3cccs3)s2)cc1	InChI=1S/C14H10ClN3O2S2/c15-9-3-5-10(6-4-9)20-8-12-17-18-14(22-12)16-13(19)11-2-1-7-21-11/h1-7H,8H2,(H,16,18,19)	ORFONQGKKFOOML-UHFFFAOYSA-N	350.99029568							108007
AC1MFJEK	LSM-19385	BRD-K05086663	2920156	InChI=1S/C15H13N3O5/c1-22-13-4-2-3-11(9-13)15(19)23-17-14(16)10-5-7-12(8-6-10)18(20)21/h2-9H,1H3,(H2,16,17)	VJBZAAZOQSCECH-UHFFFAOYSA-N	COc1cccc(c1)C(=O)ONC(=N)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K05086663	BRD-K05086663-001-05-6	ChemBridge Corporation	6946197			COc1cccc(c1)C(=O)ONC(=N)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C15H13N3O5/c1-22-13-4-2-3-11(9-13)15(19)23-17-14(16)10-5-7-12(8-6-10)18(20)21/h2-9H,1H3,(H2,16,17)	VJBZAAZOQSCECH-UHFFFAOYSA-N	315.085520546							108008
6-Methoxy-3-methyl-1,3-benzothiazol-2(3H)-imine	LSM-19386	BRD-K38831170, SID24820606	314212	InChI=1S/C9H10N2OS/c1-11-7-4-3-6(12-2)5-8(7)13-9(11)10/h3-5,10H,1-2H3	KNTMUWQCLYTQAY-UHFFFAOYSA-N	COc1ccc2N(C)C(=N)Sc2c1	BroadT	BRD-K38831170	BRD-K38831170-001-06-0	Key Organics Ltd.	5X-0943			COc1ccc2n(C)c(=N)sc2c1	InChI=1S/C9H10N2OS/c1-11-7-4-3-6(12-2)5-8(7)13-9(11)10/h3-5,10H,1-2H3	KNTMUWQCLYTQAY-UHFFFAOYSA-N	194.05138365							108009
5D-147	LSM-43833	BRD-K49666076, SID17411206	5524335	InChI=1S/C13H16N2O3S/c1-10-4-6-11(7-5-10)15-9-19(17,18)12(13(15)16)8-14(2)3/h4-8H,9H2,1-3H3/b12-8+	BSQIADCBLJDKBB-XYOKQWHBSA-N	CN(C)\C=C\1/C(=O)N(CS1(=O)=O)c2ccc(C)cc2	BroadT	BRD-K49666076	BRD-K49666076-001-05-4	Key Organics Ltd.	5D-147			CN(C)\C=C1/C(=O)N(CS1(=O)=O)c1ccc(C)cc1	InChI=1S/C13H16N2O3S/c1-10-4-6-11(7-5-10)15-9-19(17,18)12(13(15)16)8-14(2)3/h4-8H,9H2,1-3H3/b12-8+	BSQIADCBLJDKBB-XYOKQWHBSA-N	280.088163082							
ST50303392	LSM-19388	BRD-K15123815, SID49644629	2162129	InChI=1S/C12H14N4O4S2/c1-8(2)7-11-13-14-12(21-11)15-22(19,20)10-5-3-9(4-6-10)16(17)18/h3-6,8H,7H2,1-2H3,(H,14,15)	INOFJOJNRTYYRB-UHFFFAOYSA-N	CC(C)Cc1nnc(NS(=O)(=O)c2ccc(cc2)[N+](=O)[O-])s1	BroadT	BRD-K15123815	BRD-K15123815-001-05-2	Asinex Ltd.	BAS 05023525			CC(C)Cc1nnc(NS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)s1	InChI=1S/C12H14N4O4S2/c1-8(2)7-11-13-14-12(21-11)15-22(19,20)10-5-3-9(4-6-10)16(17)18/h3-6,8H,7H2,1-2H3,(H,14,15)	INOFJOJNRTYYRB-UHFFFAOYSA-N	342.045646348							108011
MLS000103312	LSM-19389	BRD-K93752373, SID7970570	5111734	InChI=1S/C16H11Cl2N3O3/c1-23-11-5-2-9(3-6-11)15-20-21-16(24-15)19-14(22)12-8-10(17)4-7-13(12)18/h2-8H,1H3,(H,19,21,22)	HZLPGPQBBZSNRD-UHFFFAOYSA-N	COc1ccc(cc1)c2oc(NC(=O)c3cc(Cl)ccc3Cl)nn2	BroadT	BRD-K93752373	BRD-K93752373-001-07-3	Life Chemicals Inc.	F1374-0460			COc1ccc(cc1)-c1nnc(NC(=O)c2cc(Cl)ccc2Cl)o1	InChI=1S/C16H11Cl2N3O3/c1-23-11-5-2-9(3-6-11)15-20-21-16(24-15)19-14(22)12-8-10(17)4-7-13(12)18/h2-8H,1H3,(H,19,21,22)	HZLPGPQBBZSNRD-UHFFFAOYSA-N	363.017746662							108012
SMR000020815	LSM-19390	BRD-K67036882, SID4244528	3239112	InChI=1S/C18H17N3O3S/c1-3-24-17(23)8-14(22)11-25-18-15(9-19)12(2)7-16(21-18)13-5-4-6-20-10-13/h4-7,10H,3,8,11H2,1-2H3	ZGGPHJFSKBYSSY-UHFFFAOYSA-N	CCOC(=O)CC(=O)CSc1nc(cc(C)c1C#N)c2cccnc2	BroadT	BRD-K67036882	BRD-K67036882-001-05-1	ChemDiv Inc.	8007-0208			CCOC(=O)CC(=O)CSc1nc(cc(C)c1C#N)-c1cccnc1	InChI=1S/C18H17N3O3S/c1-3-24-17(23)8-14(22)11-25-18-15(9-19)12(2)7-16(21-18)13-5-4-6-20-10-13/h4-7,10H,3,8,11H2,1-2H3	ZGGPHJFSKBYSSY-UHFFFAOYSA-N	355.099062124							108013
STK359839	LSM-19391	BRD-K69543414, SID4263782	2209393	InChI=1S/C16H20N2O5S/c1-2-9-18-24(20,21)15-7-5-13(6-8-15)23-12-16(19)17-11-14-4-3-10-22-14/h3-8,10,18H,2,9,11-12H2,1H3,(H,17,19)	JJDNATVGNBDGNF-UHFFFAOYSA-N	CCCNS(=O)(=O)c1ccc(OCC(=O)NCc2occc2)cc1	BroadT	BRD-K69543414	BRD-K69543414-001-05-1	ChemBridge Corporation	7812864			CCCNS(=O)(=O)c1ccc(OCC(=O)NCc2ccco2)cc1	InChI=1S/C16H20N2O5S/c1-2-9-18-24(20,21)15-7-5-13(6-8-15)23-12-16(19)17-11-14-4-3-10-22-14/h3-8,10,18H,2,9,11-12H2,1H3,(H,17,19)	JJDNATVGNBDGNF-UHFFFAOYSA-N	352.10929245							108014
23779-96-6	LSM-19392	BRD-K48020855, SID4258173	90261	InChI=1S/C10H6F3NO/c11-10(12,13)7-3-1-2-6-8(15)4-5-14-9(6)7/h1-5H,(H,14,15)	UDRWADJLLWWJOE-UHFFFAOYSA-N	Oc1ccnc2c(cccc12)C(F)(F)F	BroadT	BRD-K48020855	BRD-K48020855-001-05-2	ChemBridge Corporation	6433226			Oc1ccnc2c(cccc12)C(F)(F)F	InChI=1S/C10H6F3NO/c11-10(12,13)7-3-1-2-6-8(15)4-5-14-9(6)7/h1-5H,(H,14,15)	UDRWADJLLWWJOE-UHFFFAOYSA-N	213.040148422							108015
2-(2,3-Dihydro-1,4-benzodioxin-6-ylamino)-4,6-dimethylpyridine-3-carbonitrile	LSM-19393	SID7968603, BRD-K56572622	712051	InChI=1S/C16H15N3O2/c1-10-7-11(2)18-16(13(10)9-17)19-12-3-4-14-15(8-12)21-6-5-20-14/h3-4,7-8H,5-6H2,1-2H3,(H,18,19)	DCMQCOMQASORMW-UHFFFAOYSA-N	Cc1cc(C)c(C#N)c(Nc2ccc3OCCOc3c2)n1	BroadT	BRD-K56572622	BRD-K56572622-001-04-6	ChemDiv Inc.	8013-5897			Cc1cc(C)c(C#N)c(Nc2ccc3OCCOc3c2)n1	InChI=1S/C16H15N3O2/c1-10-7-11(2)18-16(13(10)9-17)19-12-3-4-14-15(8-12)21-6-5-20-14/h3-4,7-8H,5-6H2,1-2H3,(H,18,19)	DCMQCOMQASORMW-UHFFFAOYSA-N	281.11642675							108016
MLS001000923	LSM-19394	BRD-K98201103, SID47198117	6469195	InChI=1S/C14H17N3O2S/c1-17-12(9-8-11-6-4-3-5-7-11)15-16-14(17)20-10-13(18)19-2/h3-7H,8-10H2,1-2H3	HRJBQUREDQBSBB-UHFFFAOYSA-N	COC(=O)CSc1nnc(CCc2ccccc2)n1C	BroadT	BRD-K98201103	BRD-K98201103-001-06-5	ChemBridge Corporation	9052161			COC(=O)CSc1nnc(CCc2ccccc2)n1C	InChI=1S/C14H17N3O2S/c1-17-12(9-8-11-6-4-3-5-7-11)15-16-14(17)20-10-13(18)19-2/h3-7H,8-10H2,1-2H3	HRJBQUREDQBSBB-UHFFFAOYSA-N	291.104147504							108017
T5285603	LSM-19395	BRD-K06408981, SID22410608, SID89852824	4015951	InChI=1S/C23H22ClF3N2O7S/c24-17-3-1-15(23(25,26)27)11-18(17)28-21(30)13-36-22(31)14-5-7-29(8-6-14)37(32,33)16-2-4-19-20(12-16)35-10-9-34-19/h1-4,11-12,14H,5-10,13H2,(H,28,30)	QDQPCHOOCBJMEL-UHFFFAOYSA-N	FC(F)(F)c1ccc(Cl)c(NC(=O)COC(=O)C2CCN(CC2)S(=O)(=O)c3ccc4OCCOc4c3)c1	BroadT	BRD-K06408981	BRD-K06408981-001-05-6	Enamine Ltd.	T5285603			FC(F)(F)c1ccc(Cl)c(NC(=O)COC(=O)C2CCN(CC2)S(=O)(=O)c2ccc3OCCOc3c2)c1	InChI=1S/C23H22ClF3N2O7S/c24-17-3-1-15(23(25,26)27)11-18(17)28-21(30)13-36-22(31)14-5-7-29(8-6-14)37(32,33)16-2-4-19-20(12-16)35-10-9-34-19/h1-4,11-12,14H,5-10,13H2,(H,28,30)	QDQPCHOOCBJMEL-UHFFFAOYSA-N	562.078834064							108018
MLS000041906	LSM-19396	BRD-A62469171, SID863557	664808	InChI=1S/C21H20N4O2S/c1-15-7-6-8-16(13-15)28(26,27)19(14-22)20-21(25-11-4-5-12-25)24-18-10-3-2-9-17(18)23-20/h2-3,6-10,13,19H,4-5,11-12H2,1H3	GDJMDNKIUMOLIR-UHFFFAOYSA-N	Cc1cccc(c1)S(=O)(=O)C(C#N)c2nc3ccccc3nc2N4CCCC4	BroadT	BRD-A62469171	BRD-A62469171-001-06-9	InterBioScreen Ltd.	STOCK4S-78330			Cc1cccc(c1)S(=O)(=O)C(C#N)c1nc2ccccc2nc1N1CCCC1	InChI=1S/C21H20N4O2S/c1-15-7-6-8-16(13-15)28(26,27)19(14-22)20-21(25-11-4-5-12-25)24-18-10-3-2-9-17(18)23-20/h2-3,6-10,13,19H,4-5,11-12H2,1H3	GDJMDNKIUMOLIR-UHFFFAOYSA-N	392.13069661							108019
ZINC04772880	LSM-43834	BRD-K39773004, SID17511932	5912510	InChI=1S/C17H16ClNO3/c1-10-15(17(21)22-3)11(2)19-16(10)14(20)8-7-12-5-4-6-13(18)9-12/h4-9,19H,1-3H3/b8-7+	SSVIORHZXIQVDF-BQYQJAHWSA-N	COC(=O)c1c(C)[nH]c(C(=O)\C=C\c2cccc(Cl)c2)c1C	BroadT	BRD-K39773004	BRD-K39773004-001-05-7	InterBioScreen Ltd.	STOCK1S-18783			COC(=O)c1c(C)[nH]c(C(=O)\C=C\c2cccc(Cl)c2)c1C	InChI=1S/C17H16ClNO3/c1-10-15(17(21)22-3)11(2)19-16(10)14(20)8-7-12-5-4-6-13(18)9-12/h4-9,19H,1-3H3/b8-7+	SSVIORHZXIQVDF-BQYQJAHWSA-N	317.081871092							
MLS000040787	LSM-19398	SID861951, BRD-A06327019	663174	InChI=1S/C21H26N4O3/c1-2-3-4-7-12-28-21(26)16(15-22)19-20(25-10-13-27-14-11-25)24-18-9-6-5-8-17(18)23-19/h5-6,8-9,16H,2-4,7,10-14H2,1H3	VIUDPZBXTYZPHE-UHFFFAOYSA-N	CCCCCCOC(=O)C(C#N)c1nc2ccccc2nc1N3CCOCC3	BroadT	BRD-A06327019	BRD-A06327019-001-06-4	InterBioScreen Ltd.	STOCK4S-23148			CCCCCCOC(=O)C(C#N)c1nc2ccccc2nc1N1CCOCC1	InChI=1S/C21H26N4O3/c1-2-3-4-7-12-28-21(26)16(15-22)19-20(25-10-13-27-14-11-25)24-18-9-6-5-8-17(18)23-19/h5-6,8-9,16H,2-4,7,10-14H2,1H3	VIUDPZBXTYZPHE-UHFFFAOYSA-N	382.200490732							108021
{1-[3-(4-Methylphenoxy)propyl]-1H-benzimidazol-2-yl}methanol	LSM-19399	BRD-K91810283, SID4258225	2945948	InChI=1S/C18H20N2O2/c1-14-7-9-15(10-8-14)22-12-4-11-20-17-6-3-2-5-16(17)19-18(20)13-21/h2-3,5-10,21H,4,11-13H2,1H3	XQEOBBNMUJPWHH-UHFFFAOYSA-N	Cc1ccc(OCCCn2c(CO)nc3ccccc23)cc1	BroadT	BRD-K91810283	BRD-K91810283-001-06-2	ChemBridge Corporation	7657322			Cc1ccc(OCCCn2c(CO)nc3ccccc23)cc1	InChI=1S/C18H20N2O2/c1-14-7-9-15(10-8-14)22-12-4-11-20-17-6-3-2-5-16(17)19-18(20)13-21/h2-3,5-10,21H,4,11-13H2,1H3	XQEOBBNMUJPWHH-UHFFFAOYSA-N	296.1524779							108022
SMR000204560	LSM-19400	BRD-A43575461, SID17510700	4025678	InChI=1S/C28H26N4O/c1-31(2)32-24-15-20(18-9-4-3-5-10-18)16-25(33)27(24)26(23(17-29)28(32)30)22-14-8-12-19-11-6-7-13-21(19)22/h3-14,20,26H,15-16,30H2,1-2H3	BRDWSRHFGGHGAV-UHFFFAOYSA-N	CN(C)N1C(=C(C#N)C(C2=C1CC(CC2=O)c3ccccc3)c4cccc5ccccc45)N	BroadT	BRD-A43575461	BRD-A43575461-001-06-6	ChemDiv Inc.	8015-2063			CN(C)N1C(N)=C(C#N)C(c2cccc3ccccc23)C2=C1CC(CC2=O)c1ccccc1	InChI=1S/C28H26N4O/c1-31(2)32-24-15-20(18-9-4-3-5-10-18)16-25(33)27(24)26(23(17-29)28(32)30)22-14-8-12-19-11-6-7-13-21(19)22/h3-14,20,26H,15-16,30H2,1-2H3	BRDWSRHFGGHGAV-UHFFFAOYSA-N	434.210661492							108023
1-[1-Methyl-2-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-5-yl]-3-phenylurea	LSM-19401	BRD-K77634326, SID4254660	1253604	InChI=1S/C20H23N5O/c1-24-18-10-9-16(22-20(26)21-15-7-3-2-4-8-15)13-17(18)23-19(24)14-25-11-5-6-12-25/h2-4,7-10,13H,5-6,11-12,14H2,1H3,(H2,21,22,26)	ZOXCBTXMYKDVLJ-UHFFFAOYSA-N	Cn1c(CN2CCCC2)nc3cc(NC(=O)Nc4ccccc4)ccc13	BroadT	BRD-K77634326	BRD-K77634326-001-05-5	ChemBridge Corporation	7963975			Cn1c(CN2CCCC2)nc2cc(NC(=O)Nc3ccccc3)ccc12	InChI=1S/C20H23N5O/c1-24-18-10-9-16(22-20(26)21-15-7-3-2-4-8-15)13-17(18)23-19(24)14-25-11-5-6-12-25/h2-4,7-10,13H,5-6,11-12,14H2,1H3,(H2,21,22,26)	ZOXCBTXMYKDVLJ-UHFFFAOYSA-N	349.190260406							108024
MLS001003076	LSM-19402	SID26724419, BRD-K59955428	2423078	InChI=1S/C19H21ClN2O2S/c20-15-1-7-18(8-2-15)25-14-9-19(24)22-12-10-21(11-13-22)16-3-5-17(23)6-4-16/h1-8,23H,9-14H2	NWFKXYYFNGXVMP-UHFFFAOYSA-N	Oc1ccc(cc1)N2CCN(CC2)C(=O)CCSc3ccc(Cl)cc3	BroadT	BRD-K59955428	BRD-K59955428-001-07-9	Enamine Ltd.	T0515-8151			Oc1ccc(cc1)N1CCN(CC1)C(=O)CCSc1ccc(Cl)cc1	InChI=1S/C19H21ClN2O2S/c20-15-1-7-18(8-2-15)25-14-9-19(24)22-12-10-21(11-13-22)16-3-5-17(23)6-4-16/h1-8,23H,9-14H2	NWFKXYYFNGXVMP-UHFFFAOYSA-N	376.101226332							108025
STK253458	LSM-19403	BRD-K06208863, SID4256482	1252473	InChI=1S/C22H20ClN3O4S/c23-19-13-18(31(28,29)26-12-10-16-5-1-2-7-20(16)26)8-9-21(19)30-15-22(27)25-14-17-6-3-4-11-24-17/h1-9,11,13H,10,12,14-15H2,(H,25,27)	VJTIDELFKCJLRG-UHFFFAOYSA-N	Clc1cc(ccc1OCC(=O)NCc2ccccn2)S(=O)(=O)N3CCc4ccccc34	BroadT	BRD-K06208863	BRD-K06208863-001-05-3	ChemBridge Corporation	7962367			Clc1cc(ccc1OCC(=O)NCc1ccccn1)S(=O)(=O)N1CCc2ccccc12	InChI=1S/C22H20ClN3O4S/c23-19-13-18(31(28,29)26-12-10-16-5-1-2-7-20(16)26)8-9-21(19)30-15-22(27)25-14-17-6-3-4-11-24-17/h1-9,11,13H,10,12,14-15H2,(H,25,27)	VJTIDELFKCJLRG-UHFFFAOYSA-N	457.08630455							108026
MLS000118121	LSM-19404	BRD-K94444134, SID7966757	5308423	InChI=1S/C26H28N4O2/c1-17-8-7-11-21(18(17)2)29-12-14-30(15-13-29)26(32)23-16-20-24(27(23)3)19-9-5-6-10-22(19)28(4)25(20)31/h5-11,16H,12-15H2,1-4H3	FAZQZTYABRGLSR-UHFFFAOYSA-N	CN1C(=O)c2cc(C(=O)N3CCN(CC3)c4cccc(C)c4C)n(C)c2c5ccccc15	BroadT	BRD-K94444134	BRD-K94444134-001-04-3	ChemDiv Inc.	C593-0523			Cc1cccc(N2CCN(CC2)C(=O)c2cc3c(n2C)c2ccccc2n(C)c3=O)c1C	InChI=1S/C26H28N4O2/c1-17-8-7-11-21(18(17)2)29-12-14-30(15-13-29)26(32)23-16-20-24(27(23)3)19-9-5-6-10-22(19)28(4)25(20)31/h5-11,16H,12-15H2,1-4H3	FAZQZTYABRGLSR-UHFFFAOYSA-N	428.221226176							108027
SMR000041928	LSM-19405	BRD-K57382977, SID860097	661400	InChI=1S/C15H17N5O2/c21-7-9-22-8-6-16-14-13-10-19-20(15(13)18-11-17-14)12-4-2-1-3-5-12/h1-5,10-11,21H,6-9H2,(H,16,17,18)	XEQIIUKONKYJGJ-UHFFFAOYSA-N	OCCOCCNc1ncnc2c1cnn2c3ccccc3	BroadT	BRD-K57382977	BRD-K57382977-001-05-7	InterBioScreen Ltd.	STOCK3S-44228			OCCOCCNc1ncnc2n(ncc12)-c1ccccc1	InChI=1S/C15H17N5O2/c21-7-9-22-8-6-16-14-13-10-19-20(15(13)18-11-17-14)12-4-2-1-3-5-12/h1-5,10-11,21H,6-9H2,(H,16,17,18)	XEQIIUKONKYJGJ-UHFFFAOYSA-N	299.138224834							108028
AC1LFUYJ	LSM-19406	BRD-K73587666	760399	InChI=1S/C14H13N3O4/c1-9-7-12(10(2)21-9)14(18)16-15-8-11-5-3-4-6-13(11)17(19)20/h3-8H,1-2H3,(H,16,18)	PNASZGKAFKRRQX-UHFFFAOYSA-N	Cc1oc(C)c(c1)C(=O)NN=Cc2ccccc2[N+](=O)[O-]	BroadT	BRD-K73587666	BRD-K73587666-001-05-7	Asinex Ltd.	BAS 00921572			Cc1cc(C(=O)NN=Cc2ccccc2[N+]([O-])=O)c(C)o1	InChI=1S/C14H13N3O4/c1-9-7-12(10(2)21-9)14(18)16-15-8-11-5-3-4-6-13(11)17(19)20/h3-8H,1-2H3,(H,16,18)	PNASZGKAFKRRQX-UHFFFAOYSA-N	287.090605926							108029
AC1O41VH	LSM-43835	BRD-K97761115, SID24833842	6298588	InChI=1S/C19H12ClNO3/c20-14-6-3-4-12(10-14)11-15(18(22)19(23)24)17-9-8-13-5-1-2-7-16(13)21-17/h1-11H,(H,23,24)/b15-11-	DWKGOIIGYLCWPS-PTNGSMBKSA-N	OC(=O)C(=O)\C(=C/c1cccc(Cl)c1)\c2ccc3ccccc3n2	BroadT	BRD-K97761115	BRD-K97761115-001-05-7	Enamine Ltd.	T0513-2359			OC(=O)C(=O)C(=C/c1cccc(Cl)c1)\c1ccc2ccccc2n1	InChI=1S/C19H12ClNO3/c20-14-6-3-4-12(10-14)11-15(18(22)19(23)24)17-9-8-13-5-1-2-7-16(13)21-17/h1-11H,(H,23,24)/b15-11-	DWKGOIIGYLCWPS-PTNGSMBKSA-N	337.050570964							
MLS000082005	LSM-19408	BRD-K38358574, SID3717838	2346231	InChI=1S/C14H13NO4/c16-13(15-9-12-7-4-8-18-12)10-19-14(17)11-5-2-1-3-6-11/h1-8H,9-10H2,(H,15,16)	KYYBWMIQPYMZNV-UHFFFAOYSA-N	O=C(COC(=O)c1ccccc1)NCc2occc2	BroadT	BRD-K38358574	BRD-K38358574-001-05-8	Enamine Ltd.	T0507-9469			O=C(COC(=O)c1ccccc1)NCc1ccco1	InChI=1S/C14H13NO4/c16-13(15-9-12-7-4-8-18-12)10-19-14(17)11-5-2-1-3-6-11/h1-8H,9-10H2,(H,15,16)	KYYBWMIQPYMZNV-UHFFFAOYSA-N	259.084457906							108031
MLS000417393	LSM-19409	BRD-K34069025, SID24782349	4659956	InChI=1S/C25H26ClN3O6S2/c26-19-7-9-20(10-8-19)28-36(32,33)22-13-14-24(30)23(17-22)27-25(31)18-5-11-21(12-6-18)37(34,35)29-15-3-1-2-4-16-29/h5-14,17,28,30H,1-4,15-16H2,(H,27,31)	QHJHZMGPAXDRGP-UHFFFAOYSA-N	Oc1ccc(cc1NC(=O)c2ccc(cc2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K34069025	BRD-K34069025-001-05-0	Enamine Ltd.	T0507-7052			Oc1ccc(cc1NC(=O)c1ccc(cc1)S(=O)(=O)N1CCCCCC1)S(=O)(=O)Nc1ccc(Cl)cc1	InChI=1S/C25H26ClN3O6S2/c26-19-7-9-20(10-8-19)28-36(32,33)22-13-14-24(30)23(17-22)27-25(31)18-5-11-21(12-6-18)37(34,35)29-15-3-1-2-4-16-29/h5-14,17,28,30H,1-4,15-16H2,(H,27,31)	QHJHZMGPAXDRGP-UHFFFAOYSA-N	563.095154672							108032
MLS000576650	LSM-19410	BRD-K11636255, SID17414856	1330292	InChI=1S/C22H23N3O5S/c1-4-30-21(28)17-14-7-5-6-8-16(14)31-20(17)25-11(2)9-13(12(25)3)10-15-18(26)23-22(29)24-19(15)27/h9-10H,4-8H2,1-3H3,(H2,23,24,26,27,29)	GSXNDIVWWUSWRK-UHFFFAOYSA-N	CCOC(=O)c1c2CCCCc2sc1n3c(C)cc(C=C4C(=O)NC(=O)NC4=O)c3C	BroadT	BRD-K11636255	BRD-K11636255-001-06-2	ChemBridge Corporation	7046854			CCOC(=O)c1c2CCCCc2sc1-n1c(C)cc(C=C2C(=O)NC(=O)NC2=O)c1C	InChI=1S/C22H23N3O5S/c1-4-30-21(28)17-14-7-5-6-8-16(14)31-20(17)25-11(2)9-13(12(25)3)10-15-18(26)23-22(29)24-19(15)27/h9-10H,4-8H2,1-3H3,(H2,23,24,26,27,29)	GSXNDIVWWUSWRK-UHFFFAOYSA-N	441.135841556							108033
AC1O9HN9	LSM-19411	SID24272992, SID17434000, BRD-K25805580	6758691	InChI=1S/C25H21N3O3/c1-15-23-18-13-21(30-2)22(31-3)14-19(18)24(17-11-7-8-12-20(17)29)26-25(23)28(27-15)16-9-5-4-6-10-16/h4-14,29H,1-3H3	POEUIJCVSFDDFS-UHFFFAOYSA-N	COc1cc2c(nc3c(c(C)nn3c4ccccc4)c2cc1OC)c5ccccc5O	BroadT	BRD-K25805580	BRD-K25805580-001-05-5	ChemBridge Corporation	5773894			COc1cc2c(nc3n(nc(C)c3c2cc1OC)-c1ccccc1)-c1ccccc1O	InChI=1S/C25H21N3O3/c1-15-23-18-13-21(30-2)22(31-3)14-19(18)24(17-11-7-8-12-20(17)29)26-25(23)28(27-15)16-9-5-4-6-10-16/h4-14,29H,1-3H3	POEUIJCVSFDDFS-UHFFFAOYSA-N	411.158291562							
MLS000040346	LSM-19412	BRD-K92134254, SID863532	664784	InChI=1S/C15H13N3O2S/c1-20-18-14(19)12-6-2-3-7-13(12)17-15(18)21-10-11-5-4-8-16-9-11/h2-9H,10H2,1H3	ZNSQCCUWJYPCOB-UHFFFAOYSA-N	CON1C(=Nc2ccccc2C1=O)SCc3cccnc3	BroadT	BRD-K92134254	BRD-K92134254-001-05-3	InterBioScreen Ltd.	STOCK4S-81203			COn1c(SCc2cccnc2)nc2ccccc2c1=O	InChI=1S/C15H13N3O2S/c1-20-18-14(19)12-6-2-3-7-13(12)17-15(18)21-10-11-5-4-8-16-9-11/h2-9H,10H2,1H3	ZNSQCCUWJYPCOB-UHFFFAOYSA-N	299.072847376							108035
2-(4-Bromophenyl)-1-(2,4-dihydroxyphenyl)ethanone	LSM-19413	BRD-K97337407, SID7974298	2063466	InChI=1S/C14H11BrO3/c15-10-3-1-9(2-4-10)7-13(17)12-6-5-11(16)8-14(12)18/h1-6,8,16,18H,7H2	GVDMPWQNNRNDOG-UHFFFAOYSA-N	Oc1ccc(C(=O)Cc2ccc(Br)cc2)c(O)c1	BroadT	BRD-K97337407	BRD-K97337407-001-11-1	ChemBridge Corporation	7113606			Oc1ccc(C(=O)Cc2ccc(Br)cc2)c(O)c1	InChI=1S/C14H11BrO3/c15-10-3-1-9(2-4-10)7-13(17)12-6-5-11(16)8-14(12)18/h1-6,8,16,18H,7H2	GVDMPWQNNRNDOG-UHFFFAOYSA-N	305.989156812							108036
Ethyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate	LSM-19414	BRD-A96308662, SID858781	660084	InChI=1S/C15H16N2O5/c1-3-20-14(18)12-8(2)16-15(19)17-13(12)9-4-5-10-11(6-9)22-7-21-10/h4-6,13H,3,7H2,1-2H3,(H2,16,17,19)	SFJUFKUJXZOETL-UHFFFAOYSA-N	CCOC(=O)C1=C(C)NC(=O)NC1c2ccc3OCOc3c2	BroadT	BRD-A96308662	BRD-A96308662-001-05-7	InterBioScreen Ltd.	STOCK2S-61572			CCOC(=O)C1=C(C)NC(=O)NC1c1ccc2OCOc2c1	InChI=1S/C15H16N2O5/c1-3-20-14(18)12-8(2)16-15(19)17-13(12)9-4-5-10-11(6-9)22-7-21-10/h4-6,13H,3,7H2,1-2H3,(H2,16,17,19)	SFJUFKUJXZOETL-UHFFFAOYSA-N	304.105921632							108037
MLS000071219	LSM-19415	SID856658, SID50101307, BRD-K79551673	658010	InChI=1S/C23H28N4OS/c1-23(2)13-18-19(14-24)22(29-16-17-7-5-4-6-8-17)25-21(20(18)15-26(23)3)27-9-11-28-12-10-27/h4-8H,9-13,15-16H2,1-3H3	ZKZWUEUAOWRWKC-UHFFFAOYSA-N	CN1Cc2c(CC1(C)C)c(C#N)c(SCc3ccccc3)nc2N4CCOCC4	BroadT	BRD-K79551673	BRD-K79551673-001-07-4	InterBioScreen Ltd.	STOCK1S-27153			CN1Cc2c(CC1(C)C)c(C#N)c(SCc1ccccc1)nc2N1CCOCC1	InChI=1S/C23H28N4OS/c1-23(2)13-18-19(14-24)22(29-16-17-7-5-4-6-8-17)25-21(20(18)15-26(23)3)27-9-11-28-12-10-27/h4-8H,9-13,15-16H2,1-3H3	ZKZWUEUAOWRWKC-UHFFFAOYSA-N	408.198382246							108038
MLS000079951	LSM-19416	BRD-A55411938, SID859010	660313	InChI=1S/C26H27N5O3/c1-2-34-26(33)19-11-8-14-31(17-19)24-23(29-21-12-6-7-13-22(21)30-24)20(15-27)25(32)28-16-18-9-4-3-5-10-18/h3-7,9-10,12-13,19-20H,2,8,11,14,16-17H2,1H3,(H,28,32)	IUMXMQSPIMHHAM-UHFFFAOYSA-N	CCOC(=O)C1CCCN(C1)c2nc3ccccc3nc2C(C#N)C(=O)NCc4ccccc4	BroadT	BRD-A55411938	BRD-A55411938-001-05-6	InterBioScreen Ltd.	STOCK2S-79088			CCOC(=O)C1CCCN(C1)c1nc2ccccc2nc1C(C#N)C(=O)NCc1ccccc1	InChI=1S/C26H27N5O3/c1-2-34-26(33)19-11-8-14-31(17-19)24-23(29-21-12-6-7-13-22(21)30-24)20(15-27)25(32)28-16-18-9-4-3-5-10-18/h3-7,9-10,12-13,19-20H,2,8,11,14,16-17H2,1H3,(H,28,32)	IUMXMQSPIMHHAM-UHFFFAOYSA-N	457.211389774							108039
N-[2-(Dipropylamino)ethyl]-4-methylfuro[3,2-c]quinoline-2-carboxamide	LSM-19417	BRD-K09721123, SID4251430	3245118	InChI=1S/C21H27N3O2/c1-4-11-24(12-5-2)13-10-22-21(25)19-14-17-15(3)23-18-9-7-6-8-16(18)20(17)26-19/h6-9,14H,4-5,10-13H2,1-3H3,(H,22,25)	LBSDNKSTXVABRZ-UHFFFAOYSA-N	CCCN(CCC)CCNC(=O)c1oc2c(c1)c(C)nc3ccccc23	BroadT	BRD-K09721123	BRD-K09721123-001-05-8	ChemDiv Inc.	C629-0116			CCCN(CCC)CCNC(=O)c1cc2c(C)nc3ccccc3c2o1	InChI=1S/C21H27N3O2/c1-4-11-24(12-5-2)13-10-22-21(25)19-14-17-15(3)23-18-9-7-6-8-16(18)20(17)26-19/h6-9,14H,4-5,10-13H2,1-3H3,(H,22,25)	LBSDNKSTXVABRZ-UHFFFAOYSA-N	353.210327134							108040
ST041340	LSM-19418	BRD-K08679933	1273006	InChI=1S/C23H22N4/c1-3-7-21-19(5-1)20-6-2-4-8-22(20)23(21)26-13-15-27(16-14-26)25-17-18-9-11-24-12-10-18/h1-12,17,23H,13-16H2	GPZDYTLXFCWDQP-UHFFFAOYSA-N	C1CN(CCN1N=Cc2ccncc2)C3c4ccccc4c5ccccc35	BroadT	BRD-K08679933	BRD-K08679933-001-06-7	ChemBridge Corporation	6623653			C1CN(CCN1N=Cc1ccncc1)C1c2ccccc2-c2ccccc12	InChI=1S/C23H22N4/c1-3-7-21-19(5-1)20-6-2-4-8-22(20)23(21)26-13-15-27(16-14-26)25-17-18-9-11-24-12-10-18/h1-12,17,23H,13-16H2	GPZDYTLXFCWDQP-UHFFFAOYSA-N	354.184446744							108041
AC1MW1CI	LSM-19419	BRD-M34385771	3716849	InChI=1S/C24H22N4O3S/c1-4-30-24(29)21-19(13-32-23-17(11-25)14(2)10-15(3)28-23)31-22(27)18(12-26)20(21)16-8-6-5-7-9-16/h5-10,20H,4,13,27H2,1-3H3	RTKWILSYKYJSQX-UHFFFAOYSA-N	CCOC(=O)C1=C(CSc2nc(C)cc(C)c2C#N)OC(=C(C#N)C1c3ccccc3)N	BroadT	BRD-M34385771	BRD-M34385771-001-05-4	InterBioScreen Ltd.	STOCK2S-04253		CN(C)C=O.CCOC(=O)C1=C(CSc2nc(C)cc(C)c2C#N)OC(N)=C(C#N)C1c1ccccc1	CN(C)C=O.CCOC(=O)C1=C(CSc2nc(C)cc(C)c2C#N)OC(N)=C(C#N)C1c1ccccc1	InChI=1S/C24H22N4O3S.C3H7NO/c1-4-30-24(29)21-19(13-32-23-17(11-25)14(2)10-15(3)28-23)31-22(27)18(12-26)20(21)16-8-6-5-7-9-16;1-4(2)3-5/h5-10,20H,4,13,27H2,1-3H3;3H,1-2H3	IQRWYQRGEKKQJF-UHFFFAOYSA-N	446.141261294							108042
MLS000685146	LSM-19420	SID24792838, BRD-K32124229	892222	InChI=1S/C17H19NO/c1-17(2,3)18-16(19)14-10-9-12-8-7-11-5-4-6-13(14)15(11)12/h4-6,9-10H,7-8H2,1-3H3,(H,18,19)	CVCQIYCLJVSKOA-UHFFFAOYSA-N	CC(C)(C)NC(=O)c1ccc2CCc3cccc1c23	BroadT	BRD-K32124229	BRD-K32124229-001-06-7	ChemBridge Corporation	7523558			CC(C)(C)NC(=O)c1ccc2CCc3cccc1c23	InChI=1S/C17H19NO/c1-17(2,3)18-16(19)14-10-9-12-8-7-11-5-4-6-13(14)15(11)12/h4-6,9-10H,7-8H2,1-3H3,(H,18,19)	CVCQIYCLJVSKOA-UHFFFAOYSA-N	253.146664238							108043
MLS000585653	LSM-19421	BRD-K07313741, SID17510383, SID24274719	3571741	InChI=1S/C22H19BrN4O/c1-14-3-5-16(6-4-14)21-10-19(18-9-17(23)7-8-20(18)26-21)22(28)24-11-15-12-25-27(2)13-15/h3-10,12-13H,11H2,1-2H3,(H,24,28)	BPQBRZJBEFZFPE-UHFFFAOYSA-N	Cc1ccc(cc1)c2cc(C(=O)NCc3cnn(C)c3)c4cc(Br)ccc4n2	BroadT	BRD-K07313741	BRD-K07313741-001-05-8	ChemDiv Inc.	6049-2828			Cc1ccc(cc1)-c1cc(C(=O)NCc2cnn(C)c2)c2cc(Br)ccc2n1	InChI=1S/C22H19BrN4O/c1-14-3-5-16(6-4-14)21-10-19(18-9-17(23)7-8-20(18)26-21)22(28)24-11-15-12-25-27(2)13-15/h3-10,12-13H,11H2,1-2H3,(H,24,28)	BPQBRZJBEFZFPE-UHFFFAOYSA-N	434.074223868							108044
AC1OAQUI	LSM-19422	BRD-K65824451	6808894	InChI=1S/C14H14BrN3O2S/c15-9-5-11-12(7-3-1-2-4-10(7)20-11)8(13(9)19)6-17-18-14(16)21/h5-6,19H,1-4H2,(H3,16,18,21)	VBDLLTJWFFBEAG-UHFFFAOYSA-N	NC(=NN=Cc1c(O)c(Br)cc2oc3CCCCc3c12)S	BroadT	BRD-K65824451	BRD-K65824451-001-07-9	InterBioScreen Ltd.	STOCK1S-71749			NC(S)=NN=Cc1c(O)c(Br)cc2oc3CCCCc3c12	InChI=1S/C14H14BrN3O2S/c15-9-5-11-12(7-3-1-2-4-10(7)20-11)8(13(9)19)6-17-18-14(16)21/h5-6,19H,1-4H2,(H3,16,18,21)	VBDLLTJWFFBEAG-UHFFFAOYSA-N	366.999010008							
AC1MN1KE	LSM-19423	BRD-K23868551	3270114	InChI=1S/C13H11FN2OS/c14-10-4-2-9(3-5-10)8-11-12(17)16-7-1-6-15-13(16)18-11/h2-5,8H,1,6-7H2	UQWMVPXYNNAGAD-UHFFFAOYSA-N	Fc1ccc(C=C2SC3=NCCCN3C2=O)cc1	BroadT	BRD-K23868551	BRD-K23868551-001-05-0	Key Organics Ltd.	MS-1231			Fc1ccc(C=c2sc3=NCCCn3c2=O)cc1	InChI=1S/C13H11FN2OS/c14-10-4-2-9(3-5-10)8-11-12(17)16-7-1-6-15-13(16)18-11/h2-5,8H,1,6-7H2	UQWMVPXYNNAGAD-UHFFFAOYSA-N	262.057611882							108046
3-(Furan-2-ylmethyl)-5,6-dimethyl-2-[(3-methylbenzyl)sulfanyl]thieno[2,3-d]pyrimidin-4(3H)-one	LSM-19424	BRD-K93316985, SID14742689	1993414	InChI=1S/C21H20N2O2S2/c1-13-6-4-7-16(10-13)12-26-21-22-19-18(14(2)15(3)27-19)20(24)23(21)11-17-8-5-9-25-17/h4-10H,11-12H2,1-3H3	ZYGAMWVVETZRIU-UHFFFAOYSA-N	Cc1cccc(CSC2=Nc3sc(C)c(C)c3C(=O)N2Cc4occc4)c1	BroadT	BRD-K93316985	BRD-K93316985-001-05-1	InterBioScreen Ltd.	STOCK4S-27985			Cc1sc2nc(SCc3cccc(C)c3)n(Cc3ccco3)c(=O)c2c1C	InChI=1S/C21H20N2O2S2/c1-13-6-4-7-16(10-13)12-26-21-22-19-18(14(2)15(3)27-19)20(24)23(21)11-17-8-5-9-25-17/h4-10H,11-12H2,1-3H3	ZYGAMWVVETZRIU-UHFFFAOYSA-N	396.09661928							108047
Dimethyl 2-thioxo-1,3-dithiole-4,5-dicarboxylate	LSM-19425	BRD-K17372597, SID3715749, SID50121791	547914	InChI=1S/C7H6O4S3/c1-10-5(8)3-4(6(9)11-2)14-7(12)13-3/h1-2H3	UZKKFHMMXWDIPD-UHFFFAOYSA-N	COC(=O)C1=C(SC(=S)S1)C(=O)OC	BroadT	BRD-K17372597	BRD-K17372597-001-06-5	Enamine Ltd.	T0504-6316			COC(=O)c1sc(=S)sc1C(=O)OC	InChI=1S/C7H6O4S3/c1-10-5(8)3-4(6(9)11-2)14-7(12)13-3/h1-2H3	UZKKFHMMXWDIPD-UHFFFAOYSA-N	249.942820742							108048
ILP-IV-18	LSM-19426	BRD-K06330738, SID26732656	16746602	InChI=1S/C21H20N4O4/c1-14-6-5-9-16(10-14)25-21(28)19-18(23-13-24-19)20(27)22-11-17(26)29-12-15-7-3-2-4-8-15/h2-10,13H,11-12H2,1H3,(H,22,27)(H,23,24)(H,25,28)	NRFCCJOWINZJFI-UHFFFAOYSA-N	Cc1cccc(NC(=O)c2[nH]cnc2C(=O)NCC(=O)OCc3ccccc3)c1	BroadT	BRD-K06330738	BRD-K06330738-001-05-8	University of Tulsa	ILP-IV-18 AE01_AN08			Cc1cccc(NC(=O)c2[nH]cnc2C(=O)NCC(=O)OCc2ccccc2)c1	InChI=1S/C21H20N4O4/c1-14-6-5-9-16(10-14)25-21(28)19-18(23-13-24-19)20(27)22-11-17(26)29-12-15-7-3-2-4-8-15/h2-10,13H,11-12H2,1H3,(H,22,27)(H,23,24)(H,25,28)	NRFCCJOWINZJFI-UHFFFAOYSA-N	392.14845516							108049
ASN 04369315	LSM-19427	SID851203, SID26668236, BRD-K64424704	653768	InChI=1S/C26H30N6O2/c1-18-7-10-20-14-21(26(33)27-24(20)13-18)16-31(22-5-3-4-6-22)17-25-28-29-30-32(25)15-19-8-11-23(34-2)12-9-19/h7-14,22H,3-6,15-17H2,1-2H3,(H,27,33)	CLESYUIRTDJQBD-UHFFFAOYSA-N	COc1ccc(Cn2nnnc2CN(Cc3cc4ccc(C)cc4nc3O)C5CCCC5)cc1	BroadT	BRD-K64424704	BRD-K64424704-001-05-8	Asinex Ltd.	ASN 04369315			COc1ccc(Cn2nnnc2CN(Cc2cc3ccc(C)cc3nc2O)C2CCCC2)cc1	InChI=1S/C26H30N6O2/c1-18-7-10-20-14-21(26(33)27-24(20)13-18)16-31(22-5-3-4-6-22)17-25-28-29-30-32(25)15-19-8-11-23(34-2)12-9-19/h7-14,22H,3-6,15-17H2,1-2H3,(H,27,33)	CLESYUIRTDJQBD-UHFFFAOYSA-N	458.24302426							108050
Salicylic acid	LSM-4763	2-Hydroxy-Benzoic Acid, Saligel, Ionil, Freezone, Duoplant, Salicylicacid, Stri-Dex, Salicylic Acid Soap, Salicylic Acid, Ionil-Plus, Advanced Pain Relief Callus Removers, Advanced Pain Relief Com Removers, Clear Away Wart Remover, Compound W, Dr. Scholl'S Callus Removers, Dr. Scholl'S Corn Removers, Dr. Scholl'S Wart Remover Kit, Duofilm Wart Remover	338	InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)	YGSDEFSMJLZEOE-UHFFFAOYSA-N	OC(=O)c1ccccc1O	BroadT	BRD-K93632104	BRD-K93632104-001-12-3	Sigma-Aldrich	105910			OC(=O)c1ccccc1O	InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)	YGSDEFSMJLZEOE-UHFFFAOYSA-N	138.031694052							16914
CID 78430667	LSM-19428	BRD-A99990159	78430667	InChI=1S/C25H32N2O3/c1-6-30-24(29)21-15(2)26-18-13-25(3,4)14-20(28)23(18)22(21)17-9-10-19-16(12-17)8-7-11-27(19)5/h9-10,12,21-22H,6-8,11,13-14H2,1-5H3	BGNIKVMFAFSPIL-UHFFFAOYSA-N	CCOC(=O)C1C(C2=C(CC(C)(C)CC2=O)N=C1C)c3ccc4N(C)CCCc4c3	BroadT	BRD-A99990159	BRD-A99990159-001-05-9	ChemBridge Corporation	7652136			CCOC(=O)C1C(c2ccc3N(C)CCCc3c2)C2=C(CC(C)(C)CC2=O)N=C1C	InChI=1S/C25H32N2O3/c1-6-30-24(29)21-15(2)26-18-13-25(3,4)14-20(28)23(18)22(21)17-9-10-19-16(12-17)8-7-11-27(19)5/h9-10,12,21-22H,6-8,11,13-14H2,1-5H3	BGNIKVMFAFSPIL-UHFFFAOYSA-N	408.241292904							108051
SMR000017039	LSM-19429	BRD-A20213616, SID7970838	4563936	InChI=1S/C17H20N4OS/c1-5-12(4)23-17-19-15-14(16(22)20-17)9-18-21(15)13-7-6-10(2)11(3)8-13/h6-9,12H,5H2,1-4H3,(H,19,20,22)	QKUVCRKEQJWNGM-UHFFFAOYSA-N	CCC(C)Sc1nc(O)c2cnn(c3ccc(C)c(C)c3)c2n1	BroadT	BRD-A20213616	BRD-A20213616-001-04-0	Life Chemicals Inc.	F0568-0402			CCC(C)Sc1nc(O)c2cnn(-c3ccc(C)c(C)c3)c2n1	InChI=1S/C17H20N4OS/c1-5-12(4)23-17-19-15-14(16(22)20-17)9-18-21(15)13-7-6-10(2)11(3)8-13/h6-9,12H,5H2,1-4H3,(H,19,20,22)	QKUVCRKEQJWNGM-UHFFFAOYSA-N	328.13578199							
MLS000590831	LSM-43836	BRD-K97276563, SID17512840	1419861	InChI=1S/C25H22N2O5S/c1-4-32-25(29)22-19(17-8-6-5-7-9-17)15-33-24(22)27-23(28)18(14-26)12-16-10-11-20(30-2)21(13-16)31-3/h5-13,15H,4H2,1-3H3,(H,27,28)/b18-12+	RTLYNOPKCSATJI-LDADJPATSA-N	CCOC(=O)c1c(NC(=O)\C(=C\c2ccc(OC)c(OC)c2)\C#N)scc1c3ccccc3	BroadT	BRD-K97276563	BRD-K97276563-001-06-1	InterBioScreen Ltd.	STOCK1S-78460			CCOC(=O)c1c(NC(=O)C(=C\c2ccc(OC)c(OC)c2)\C#N)scc1-c1ccccc1	InChI=1S/C25H22N2O5S/c1-4-32-25(29)22-19(17-8-6-5-7-9-17)15-33-24(22)27-23(28)18(14-26)12-16-10-11-20(30-2)21(13-16)31-3/h5-13,15H,4H2,1-3H3,(H,27,28)/b18-12+	RTLYNOPKCSATJI-LDADJPATSA-N	462.124942514							
MLS000534239	LSM-19431	BRD-K72310865, SID14735890	1340551	InChI=1S/C18H21N3O3S/c22-15-11-17(24)21(14-9-5-2-6-10-14)18(20-15)25-12-16(23)19-13-7-3-1-4-8-13/h2,5-6,9-11,13,22H,1,3-4,7-8,12H2,(H,19,23)	UYSVZHGIVDFCEO-UHFFFAOYSA-N	OC1=CC(=O)N(C(=N1)SCC(=O)NC2CCCCC2)c3ccccc3	BroadT	BRD-K72310865	BRD-K72310865-001-06-2	ChemBridge Corporation	6518972			Oc1cc(=O)n(-c2ccccc2)c(SCC(=O)NC2CCCCC2)n1	InChI=1S/C18H21N3O3S/c22-15-11-17(24)21(14-9-5-2-6-10-14)18(20-15)25-12-16(23)19-13-7-3-1-4-8-13/h2,5-6,9-11,13,22H,1,3-4,7-8,12H2,(H,19,23)	UYSVZHGIVDFCEO-UHFFFAOYSA-N	359.130362252							
MLS000560911	LSM-19432	BRD-K90562751, SID17508446	1036832	InChI=1S/C12H10Br2N4O2/c1-18-6-9(14)10(17-18)12(20)16-15-11(19)7-2-4-8(13)5-3-7/h2-6H,1H3,(H,15,19)(H,16,20)	JZKMEYUHZBAFIO-UHFFFAOYSA-N	Cn1cc(Br)c(n1)C(=O)NNC(=O)c2ccc(Br)cc2	BroadT	BRD-K90562751	BRD-K90562751-001-04-8	Asinex Ltd.	BAS 02052984			Cn1cc(Br)c(n1)C(=O)NNC(=O)c1ccc(Br)cc1	InChI=1S/C12H10Br2N4O2/c1-18-6-9(14)10(17-18)12(20)16-15-11(19)7-2-4-8(13)5-3-7/h2-6H,1H3,(H,15,19)(H,16,20)	JZKMEYUHZBAFIO-UHFFFAOYSA-N	399.9170508							108055
Ethyl 4-[(methoxyacetyl)amino]benzoate	LSM-19433	SID4264027, BRD-K34228325	835353	InChI=1S/C12H15NO4/c1-3-17-12(15)9-4-6-10(7-5-9)13-11(14)8-16-2/h4-7H,3,8H2,1-2H3,(H,13,14)	IIKLPKRWADPDHJ-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)COC)cc1	BroadT	BRD-K34228325	BRD-K34228325-001-05-9	ChemBridge Corporation	6633411			CCOC(=O)c1ccc(NC(=O)COC)cc1	InChI=1S/C12H15NO4/c1-3-17-12(15)9-4-6-10(7-5-9)13-11(14)8-16-2/h4-7H,3,8H2,1-2H3,(H,13,14)	IIKLPKRWADPDHJ-UHFFFAOYSA-N	237.10010797							108056
MLS001005746	LSM-19434	BRD-K61072684	2350672	InChI=1S/C11H9ClN2S2/c12-8-3-1-7(2-4-8)9-6-16-11(14-9)5-10(13)15/h1-4,6H,5H2,(H2,13,15)	XVCRXJQJSLVXCU-UHFFFAOYSA-N	SC(=N)Cc1nc(cs1)c2ccc(Cl)cc2	BroadT	BRD-K61072684	BRD-K61072684-001-06-0	Enamine Ltd.	T0508-4464			SC(=N)Cc1nc(cs1)-c1ccc(Cl)cc1	InChI=1S/C11H9ClN2S2/c12-8-3-1-7(2-4-8)9-6-16-11(14-9)5-10(13)15/h1-4,6H,5H2,(H2,13,15)	XVCRXJQJSLVXCU-UHFFFAOYSA-N	267.989567398							108057
SMR000077818	LSM-19435	BRD-A54769817, SID4263668	2960655	InChI=1S/C25H29N3O5/c1-6-32-24(30)17(5)33-20-10-8-7-9-19(20)22-21(16(4)26-25(31)28-22)23(29)27-18-12-11-14(2)15(3)13-18/h7-13,17,22H,6H2,1-5H3,(H,27,29)(H2,26,28,31)	WSTFXSAIFZIREN-UHFFFAOYSA-N	CCOC(=O)C(C)Oc1ccccc1C2NC(=O)NC(=C2C(=O)Nc3ccc(C)c(C)c3)C	BroadT	BRD-A54769817	BRD-A54769817-001-05-4	ChemBridge Corporation	7882238			CCOC(=O)C(C)Oc1ccccc1C1NC(=O)NC(C)=C1C(=O)Nc1ccc(C)c(C)c1	InChI=1S/C25H29N3O5/c1-6-32-24(30)17(5)33-20-10-8-7-9-19(20)22-21(16(4)26-25(31)28-22)23(29)27-18-12-11-14(2)15(3)13-18/h7-13,17,22H,6H2,1-5H3,(H,27,29)(H2,26,28,31)	WSTFXSAIFZIREN-UHFFFAOYSA-N	451.210721058							108058
SMR000002448	LSM-19436	BRD-A61522392, SID26667788, SID846314	648700	InChI=1S/C23H26N6O4S/c1-15-9-10-18(33-15)21-25-27-29(26-21)14-19(30)28(13-16-7-6-12-34-16)20(17-8-5-11-32-17)22(31)24-23(2,3)4/h5-12,20H,13-14H2,1-4H3,(H,24,31)	KLVIWFOZQCTLQL-UHFFFAOYSA-N	Cc1oc(cc1)c2nnn(CC(=O)N(Cc3cccs3)C(C(=O)NC(C)(C)C)c4occc4)n2	BroadT	BRD-A61522392	BRD-A61522392-001-05-1	Asinex Ltd.	ASN 03652358			Cc1ccc(o1)-c1nnn(CC(=O)N(Cc2cccs2)C(C(=O)NC(C)(C)C)c2ccco2)n1	InChI=1S/C23H26N6O4S/c1-15-9-10-18(33-15)21-25-27-29(26-21)14-19(30)28(13-16-7-6-12-34-16)20(17-8-5-11-32-17)22(31)24-23(2,3)4/h5-12,20H,13-14H2,1-4H3,(H,24,31)	KLVIWFOZQCTLQL-UHFFFAOYSA-N	482.173624062							108059
AC1NL4TK	LSM-19437	SID24790898, BRD-A77181042	4899288	InChI=1S/C21H17FN2O5S2/c22-8-3-1-7(2-4-8)12-13-9-5-10(16(13)30-18-17(12)31-21(29)23-18)15-14(9)19(27)24(20(15)28)6-11(25)26/h1-4,9-10,12-16H,5-6H2,(H,23,29)(H,25,26)	XPYPCAVHRVTFLO-UHFFFAOYSA-N	OC(=O)CN1C(=O)C2C3CC(C4C3Sc5nc(O)sc5C4c6ccc(F)cc6)C2C1=O	BroadT	BRD-A77181042	BRD-A77181042-001-05-2	Life Chemicals Inc.	F1734-0082			OC(=O)CN1C(=O)C2C3CC(C4C3Sc3nc(O)sc3C4c3ccc(F)cc3)C2C1=O	InChI=1S/C21H17FN2O5S2/c22-8-3-1-7(2-4-8)12-13-9-5-10(16(13)30-18-17(12)31-21(29)23-18)15-14(9)19(27)24(20(15)28)6-11(25)26/h1-4,9-10,12-16H,5-6H2,(H,23,29)(H,25,26)	XPYPCAVHRVTFLO-UHFFFAOYSA-N	460.056291244							108060
ZINC03560254	LSM-19438	BRD-K79877849, SID22407919	2677553	InChI=1S/C17H16FNO3/c18-14-4-2-1-3-13(14)17(20)19-8-7-12-5-6-15-16(11-12)22-10-9-21-15/h1-6,11H,7-10H2,(H,19,20)	FWZKIEUKPYQIEJ-UHFFFAOYSA-N	Fc1ccccc1C(=O)NCCc2ccc3OCCOc3c2	BroadT	BRD-K79877849	BRD-K79877849-001-06-4	Enamine Ltd.	Z30403752			Fc1ccccc1C(=O)NCCc1ccc2OCCOc2c1	InChI=1S/C17H16FNO3/c18-14-4-2-1-3-13(14)17(20)19-8-7-12-5-6-15-16(11-12)22-10-9-21-15/h1-6,11H,7-10H2,(H,19,20)	FWZKIEUKPYQIEJ-UHFFFAOYSA-N	301.111421582							108061
SMR000028282	LSM-19439	BRD-K29850806, SID4246252	3240630	InChI=1S/C19H17N3O4/c1-12-4-2-3-5-14(12)22-18(23)9-17(21-19(22)24)20-10-13-6-7-15-16(8-13)26-11-25-15/h2-9,20H,10-11H2,1H3,(H,21,24)	FJQDOKIZVVBMDL-UHFFFAOYSA-N	Cc1ccccc1N2C(=O)NC(=CC2=O)NCc3ccc4OCOc4c3	BroadT	BRD-K29850806	BRD-K29850806-001-05-5	ChemDiv Inc.	C632-0363			Cc1ccccc1-n1c(=O)cc(NCc2ccc3OCOc3c2)[nH]c1=O	InChI=1S/C19H17N3O4/c1-12-4-2-3-5-14(12)22-18(23)9-17(21-19(22)24)20-10-13-6-7-15-16(8-13)26-11-25-15/h2-9,20H,10-11H2,1H3,(H,21,24)	FJQDOKIZVVBMDL-UHFFFAOYSA-N	351.121906054							108062
MLS000036222	LSM-19440	BRD-K26844643, SID859373	54694096	InChI=1S/C23H26N4O4/c1-13(2)12-26-18-11-7-5-9-16(18)20(28)19(23(26)31)21(29)25-27-14(3)24-17-10-6-4-8-15(17)22(27)30/h4,6,8,10,13,28H,5,7,9,11-12H2,1-3H3,(H,25,29)	PLUCTAKCMVOIKC-UHFFFAOYSA-N	CC(C)CN1C2=C(CCCC2)C(=C(C(=O)NN3C(=Nc4ccccc4C3=O)C)C1=O)O	BroadT	BRD-K26844643	BRD-K26844643-001-05-8	InterBioScreen Ltd.	STOCK3S-12105			CC(C)Cn1c2CCCCc2c(O)c(C(=O)Nn2c(C)nc3ccccc3c2=O)c1=O	InChI=1S/C23H26N4O4/c1-13(2)12-26-18-11-7-5-9-16(18)20(28)19(23(26)31)21(29)25-27-14(3)24-17-10-6-4-8-15(17)22(27)30/h4,6,8,10,13,28H,5,7,9,11-12H2,1-3H3,(H,25,29)	PLUCTAKCMVOIKC-UHFFFAOYSA-N	422.195405352							108063
MLS000621233	LSM-19441	SID24811976, BRD-K36324810	16193479	InChI=1S/C17H22N4O3/c1-5-21-12(3)14(11(2)20-21)10-18-17(23)19-15-9-7-6-8-13(15)16(22)24-4/h6-9H,5,10H2,1-4H3,(H2,18,19,23)	GVZUDILESCHRKL-UHFFFAOYSA-N	CCn1nc(C)c(CNC(=O)Nc2ccccc2C(=O)OC)c1C	BroadT	BRD-K36324810	BRD-K36324810-001-05-6	ChemDiv Inc.	G532-0095			CCn1nc(C)c(CNC(=O)Nc2ccccc2C(=O)OC)c1C	InChI=1S/C17H22N4O3/c1-5-21-12(3)14(11(2)20-21)10-18-17(23)19-15-9-7-6-8-13(15)16(22)24-4/h6-9H,5,10H2,1-4H3,(H2,18,19,23)	GVZUDILESCHRKL-UHFFFAOYSA-N	330.169190604							108064
AC1LD25V	LSM-19442	BRD-A95442017, SID858736	660043	InChI=1S/C20H19N5O3/c21-12-15(20(26)22-13-14-4-3-9-28-14)18-19(25-7-10-27-11-8-25)24-17-6-2-1-5-16(17)23-18/h1-6,9,15H,7-8,10-11,13H2,(H,22,26)	QICAHGAQWKVDFT-UHFFFAOYSA-N	O=C(NCc1occc1)C(C#N)c2nc3ccccc3nc2N4CCOCC4	BroadT	BRD-A95442017	BRD-A95442017-001-05-7	InterBioScreen Ltd.	STOCK2S-62415			O=C(NCc1ccco1)C(C#N)c1nc2ccccc2nc1N1CCOCC1	InChI=1S/C20H19N5O3/c21-12-15(20(26)22-13-14-4-3-9-28-14)18-19(25-7-10-27-11-8-25)24-17-6-2-1-5-16(17)23-18/h1-6,9,15H,7-8,10-11,13H2,(H,22,26)	QICAHGAQWKVDFT-UHFFFAOYSA-N	377.148789518							108065
BRD-K05462252	LSM-19443	BRD-K05462252		InChI=1S/C12H12N2O5/c1-12(2)18-10(16)9(11(17)19-12)14-13-7-3-5-8(15)6-4-7/h3-6,9,15H,1-2H3	ZSKKDSSVGMWZDP-UHFFFAOYSA-N	CC1(C)OC(=O)C(N=Nc2ccc(O)cc2)C(=O)O1	BroadT	BRD-K05462252	BRD-K05462252-001-04-9	InterBioScreen Ltd.	STOCK1S-89509			CC1(C)OC(=O)C(N=Nc2ccc(O)cc2)C(=O)O1	InChI=1S/C12H12N2O5/c1-12(2)18-10(16)9(11(17)19-12)14-13-7-3-5-8(15)6-4-7/h3-6,9,15H,1-2H3	ZSKKDSSVGMWZDP-UHFFFAOYSA-N	264.074621504							
ST50131690	LSM-19444	BRD-K48533326, SID844909	647240	InChI=1S/C10H10N2OS2/c11-10-12-8-7(9(13)15-10)5-3-1-2-4-6(5)14-8/h1-4H2,(H2,11,12)	CLDVQGQXZUANQB-UHFFFAOYSA-N	NC1=Nc2sc3CCCCc3c2C(=O)S1	BroadT	BRD-K48533326	BRD-K48533326-001-05-5	Asinex Ltd.	BAS 02072512			Nc1nc2sc3CCCCc3c2c(=O)s1	InChI=1S/C10H10N2OS2/c11-10-12-8-7(9(13)15-10)5-3-1-2-4-6(5)14-8/h1-4H2,(H2,11,12)	CLDVQGQXZUANQB-UHFFFAOYSA-N	238.02345434							108067
5-Nitro-2-piperidinopyridine	LSM-19445	BRD-K10798676, SID17416162	97158	InChI=1S/C10H13N3O2/c14-13(15)9-4-5-10(11-8-9)12-6-2-1-3-7-12/h4-5,8H,1-3,6-7H2	RQPFYHQIEVITPC-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(nc1)N2CCCCC2	BroadT	BRD-K10798676	BRD-K10798676-001-06-2	ChemBridge Corporation	5473131			[O-][N+](=O)c1ccc(nc1)N1CCCCC1	InChI=1S/C10H13N3O2/c14-13(15)9-4-5-10(11-8-9)12-6-2-1-3-7-12/h4-5,8H,1-3,6-7H2	RQPFYHQIEVITPC-UHFFFAOYSA-N	207.100776686							108068
F1605-0148	LSM-19446	SID22402391, BRD-K53547009	2137307	InChI=1S/C22H17N5O2S/c1-15-8-7-9-16(14-15)23-20-18-12-5-6-13-19(18)27-21(24-20)22(25-26-27)30(28,29)17-10-3-2-4-11-17/h2-14H,1H3,(H,23,24)	VKYYUIDNHOUPGY-UHFFFAOYSA-N	Cc1cccc(Nc2nc3c(nnn3c4ccccc24)S(=O)(=O)c5ccccc5)c1	BroadT	BRD-K53547009	BRD-K53547009-001-05-1	Life Chemicals Inc.	F1605-0148			Cc1cccc(Nc2nc3c(nnn3c3ccccc23)S(=O)(=O)c2ccccc2)c1	InChI=1S/C22H17N5O2S/c1-15-8-7-9-16(14-15)23-20-18-12-5-6-13-19(18)27-21(24-20)22(25-26-27)30(28,29)17-10-3-2-4-11-17/h2-14H,1H3,(H,23,24)	VKYYUIDNHOUPGY-UHFFFAOYSA-N	415.110295524							108069
ST053978	LSM-19447	BRD-K58930048, SID17514392	3788398	InChI=1S/C23H16N2O4S/c1-13-9-20(26)29-19-10-16(7-8-17(13)19)28-22-21-18(11-30-23(21)25-12-24-22)14-3-5-15(27-2)6-4-14/h3-12H,1-2H3	IXIXOJZELNGWEJ-UHFFFAOYSA-N	COc1ccc(cc1)c2csc3ncnc(Oc4ccc5C(=CC(=O)Oc5c4)C)c23	BroadT	BRD-K58930048	BRD-K58930048-001-05-7	Life Chemicals Inc.	F1174-1240			COc1ccc(cc1)-c1csc2ncnc(Oc3ccc4c(C)cc(=O)oc4c3)c12	InChI=1S/C23H16N2O4S/c1-13-9-20(26)29-19-10-16(7-8-17(13)19)28-22-21-18(11-30-23(21)25-12-24-22)14-3-5-15(27-2)6-4-14/h3-12H,1-2H3	IXIXOJZELNGWEJ-UHFFFAOYSA-N	416.083077702							108070
(3-Amino-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridin-2-yl)(pyrrolidin-1-yl)methanone	LSM-19448	BRD-K25465939, SID24816063	1541625	InChI=1S/C18H23N3OS/c19-15-13-11-12-7-3-1-2-4-8-14(12)20-17(13)23-16(15)18(22)21-9-5-6-10-21/h11H,1-10,19H2	WNUSFJKCSANUJV-UHFFFAOYSA-N	Nc1c(sc2nc3CCCCCCc3cc12)C(=O)N4CCCC4	BroadT	BRD-K25465939	BRD-K25465939-001-05-6	Life Chemicals Inc.	F1798-0643			Nc1c(sc2nc3CCCCCCc3cc12)C(=O)N1CCCC1	InChI=1S/C18H23N3OS/c19-15-13-11-12-7-3-1-2-4-8-14(12)20-17(13)23-16(15)18(22)21-9-5-6-10-21/h11H,1-10,19H2	WNUSFJKCSANUJV-UHFFFAOYSA-N	329.156183076							108071
ST50829617	LSM-19449	BRD-K02866760, SID14728187	841870	InChI=1S/C14H14BrNOS/c1-3-11-7-10(8-18-11)14(17)16-13-5-4-9(2)6-12(13)15/h4-8H,3H2,1-2H3,(H,16,17)	ZUEIOSCQBDNEHP-UHFFFAOYSA-N	CCc1cc(cs1)C(=O)Nc2ccc(C)cc2Br	BroadT	BRD-K02866760	BRD-K02866760-001-05-6	Specs	AK-968/41018112			CCc1cc(cs1)C(=O)Nc1ccc(C)cc1Br	InChI=1S/C14H14BrNOS/c1-3-11-7-10(8-18-11)14(17)16-13-5-4-9(2)6-12(13)15/h4-8H,3H2,1-2H3,(H,16,17)	ZUEIOSCQBDNEHP-UHFFFAOYSA-N	322.997947368							108072
SMR000074300	LSM-2495	SID4261564, SID87544497, BRD-K22215695	1502520	InChI=1S/C24H26N6/c1-18-7-9-20(10-8-18)16-30-24-21(15-27-30)23(25-17-26-24)29-13-11-28(12-14-29)22-6-4-3-5-19(22)2/h3-10,15,17H,11-14,16H2,1-2H3	QFKWGNHOYQRRKI-UHFFFAOYSA-N	Cc1ccc(Cn2ncc3c(ncnc23)N4CCN(CC4)c5ccccc5C)cc1	BroadT	BRD-K22215695	BRD-K22215695-001-06-0	ChemBridge Corporation	7656221			Cc1ccc(Cn2ncc3c(ncnc23)N2CCN(CC2)c2ccccc2C)cc1	InChI=1S/C24H26N6/c1-18-7-9-20(10-8-18)16-30-24-21(15-27-30)23(25-17-26-24)29-13-11-28(12-14-29)22-6-4-3-5-19(22)2/h3-10,15,17H,11-14,16H2,1-2H3	QFKWGNHOYQRRKI-UHFFFAOYSA-N	398.221894892							92398
MLS000534453	LSM-19450	BRD-K49184477, SID14733829	725110	InChI=1S/C18H13Cl2NO2/c1-11-4-2-3-5-15(11)21-18(22)17-9-8-16(23-17)13-7-6-12(19)10-14(13)20/h2-10H,1H3,(H,21,22)	JDGFSBXMSNOFJV-UHFFFAOYSA-N	Cc1ccccc1NC(=O)c2oc(cc2)c3ccc(Cl)cc3Cl	BroadT	BRD-K49184477	BRD-K49184477-001-05-3	ChemBridge Corporation	6827449			Cc1ccccc1NC(=O)c1ccc(o1)-c1ccc(Cl)cc1Cl	InChI=1S/C18H13Cl2NO2/c1-11-4-2-3-5-15(11)21-18(22)17-9-8-16(23-17)13-7-6-12(19)10-14(13)20/h2-10H,1H3,(H,21,22)	JDGFSBXMSNOFJV-UHFFFAOYSA-N	345.032334086							108073
N-[4-(4-Oxo-3,4-dihydro-2H-1,3-benzoxazin-2-yl)phenyl]acetamide	LSM-19451	BRD-A00522887, SID865152	666402	InChI=1S/C16H14N2O3/c1-10(19)17-12-8-6-11(7-9-12)16-18-15(20)13-4-2-3-5-14(13)21-16/h2-9,16H,1H3,(H,17,19)(H,18,20)	FLHCLUICGGJALC-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)C2NC(=O)c3ccccc3O2	BroadT	BRD-A00522887	BRD-A00522887-001-05-7	InterBioScreen Ltd.	STOCK5S-36189			CC(=O)Nc1ccc(cc1)C1NC(=O)c2ccccc2O1	InChI=1S/C16H14N2O3/c1-10(19)17-12-8-6-11(7-9-12)16-18-15(20)13-4-2-3-5-14(13)21-16/h2-9,16H,1H3,(H,17,19)(H,18,20)	FLHCLUICGGJALC-UHFFFAOYSA-N	282.100442328							108074
N-[3-(Diethylamino)propyl]-6-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide	LSM-19452	BRD-K62325456, SID4241621	3236573	InChI=1S/C20H25FN4OS/c1-4-24(5-2)12-6-11-22-19(26)18-14(3)25-13-17(23-20(25)27-18)15-7-9-16(21)10-8-15/h7-10,13H,4-6,11-12H2,1-3H3,(H,22,26)	WCINHGXSAOQBRE-UHFFFAOYSA-N	CCN(CC)CCCNC(=O)c1sc2nc(cn2c1C)c3ccc(F)cc3	BroadT	BRD-K62325456	BRD-K62325456-001-05-9	ChemDiv Inc.	C540-0156			CCN(CC)CCCNC(=O)c1sc2nc(cn2c1C)-c1ccc(F)cc1	InChI=1S/C20H25FN4OS/c1-4-24(5-2)12-6-11-22-19(26)18-14(3)25-13-17(23-20(25)27-18)15-7-9-16(21)10-8-15/h7-10,13H,4-6,11-12H2,1-3H3,(H,22,26)	WCINHGXSAOQBRE-UHFFFAOYSA-N	388.17331035							108075
STK097143	LSM-43837	BRD-K51608228, SID47200727	2257755	InChI=1S/C19H21NO5/c1-22-15-7-5-14(6-8-15)20-10-9-16(21)13-11-17(23-2)19(25-4)18(12-13)24-3/h5-12,20H,1-4H3/b10-9+	IBIXFMIFCOIBJZ-MDZDMXLPSA-N	COc1ccc(N\C=C\C(=O)c2cc(OC)c(OC)c(OC)c2)cc1	BroadT	BRD-K51608228	BRD-K51608228-001-09-0	Vitas-M Laboratory Ltd.	STK097143			COc1ccc(N\C=C\C(=O)c2cc(OC)c(OC)c(OC)c2)cc1	InChI=1S/C19H21NO5/c1-22-15-7-5-14(6-8-15)20-10-9-16(21)13-11-17(23-2)19(25-4)18(12-13)24-3/h5-12,20H,1-4H3/b10-9+	IBIXFMIFCOIBJZ-MDZDMXLPSA-N	343.141972782							
MLS000054109	LSM-19454	BRD-A08191729	2998675	InChI=1S/C23H23N3O4S/c1-28-20-7-3-2-6-17(20)25-23-26(12-16-5-4-10-29-16)19(14-31-23)15-8-9-21-18(11-15)24-22(27)13-30-21/h2-3,6-9,11,14,16H,4-5,10,12-13H2,1H3,(H,24,27)	XTOAWMVAZOOIGP-UHFFFAOYSA-N	COc1ccccc1N=C2SC=C(N2CC3CCCO3)c4ccc5OCC(=O)Nc5c4	BroadT	BRD-A08191729	BRD-A08191729-001-05-5	Enamine Ltd.	T0508-9920			COc1ccccc1N=c1scc(-c2ccc3OCC(=O)Nc3c2)n1CC1CCCO1	InChI=1S/C23H23N3O4S/c1-28-20-7-3-2-6-17(20)25-23-26(12-16-5-4-10-29-16)19(14-31-23)15-8-9-21-18(11-15)24-22(27)13-30-21/h2-3,6-9,11,14,16H,4-5,10,12-13H2,1H3,(H,24,27)	XTOAWMVAZOOIGP-UHFFFAOYSA-N	437.140926936							108077
SMR000176669	LSM-19455	SID17509150, BRD-K75130046	3127960	InChI=1S/C20H23N3O6S/c1-3-14-12-15(20(25)29-4-2)19(30-14)21-18(24)13-5-6-16(23(26)27)17(11-13)22-7-9-28-10-8-22/h5-6,11-12H,3-4,7-10H2,1-2H3,(H,21,24)	FPQLFBLZLQHHOM-UHFFFAOYSA-N	CCOC(=O)c1cc(CC)sc1NC(=O)c2ccc(c(c2)N3CCOCC3)[N+](=O)[O-]	BroadT	BRD-K75130046	BRD-K75130046-001-05-5	Asinex Ltd.	BAS 01224832			CCOC(=O)c1cc(CC)sc1NC(=O)c1ccc(c(c1)N1CCOCC1)[N+]([O-])=O	InChI=1S/C20H23N3O6S/c1-3-14-12-15(20(25)29-4-2)19(30-14)21-18(24)13-5-6-16(23(26)27)17(11-13)22-7-9-28-10-8-22/h5-6,11-12H,3-4,7-10H2,1-2H3,(H,21,24)	FPQLFBLZLQHHOM-UHFFFAOYSA-N	433.130756176							108078
N-(2-Fluorophenyl)-3-phenylpropanamide	LSM-19456	BRD-K98940411, SID14734884	874860	InChI=1S/C15H14FNO/c16-13-8-4-5-9-14(13)17-15(18)11-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,18)	SDJLPHLHIMFLJY-UHFFFAOYSA-N	Fc1ccccc1NC(=O)CCc2ccccc2	BroadT	BRD-K98940411	BRD-K98940411-001-05-7	ChemBridge Corporation	6141299			Fc1ccccc1NC(=O)CCc1ccccc1	InChI=1S/C15H14FNO/c16-13-8-4-5-9-14(13)17-15(18)11-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,18)	SDJLPHLHIMFLJY-UHFFFAOYSA-N	243.105942278							108079
STK847168	LSM-19457	BRD-K76541957, SID17503746	1162872	InChI=1S/C23H19ClN2O3S/c1-15-7-10-18(11-8-15)30(28,29)25-14-20-22(16-5-3-2-4-6-16)19-13-17(24)9-12-21(19)26-23(20)27/h2-13,25H,14H2,1H3,(H,26,27)	HDYVRWWHPKPOGI-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NCc2c(O)nc3ccc(Cl)cc3c2c4ccccc4	BroadT	BRD-K76541957	BRD-K76541957-001-05-9	Asinex Ltd.	BAS 02073625			Cc1ccc(cc1)S(=O)(=O)NCc1c(O)nc2ccc(Cl)cc2c1-c1ccccc1	InChI=1S/C23H19ClN2O3S/c1-15-7-10-18(11-8-15)30(28,29)25-14-20-22(16-5-3-2-4-6-16)19-13-17(24)9-12-21(19)26-23(20)27/h2-13,25H,14H2,1H3,(H,26,27)	HDYVRWWHPKPOGI-UHFFFAOYSA-N	438.080490888							108080
MLS000083456	LSM-19458	BRD-K78217087, SID864290	665537	InChI=1S/C26H24N2O3/c29-24-16-23-20(18-27-11-13-28(14-12-27)21-9-5-2-6-10-21)15-26(30)31-25(23)17-22(24)19-7-3-1-4-8-19/h1-10,15-17,29H,11-14,18H2	LBLUAJDAIHVMDN-UHFFFAOYSA-N	Oc1cc2C(=CC(=O)Oc2cc1c3ccccc3)CN4CCN(CC4)c5ccccc5	BroadT	BRD-K78217087	BRD-K78217087-001-05-7	InterBioScreen Ltd.	STOCK5S-06584			Oc1cc2c(CN3CCN(CC3)c3ccccc3)cc(=O)oc2cc1-c1ccccc1	InChI=1S/C26H24N2O3/c29-24-16-23-20(18-27-11-13-28(14-12-27)21-9-5-2-6-10-21)15-26(30)31-25(23)17-22(24)19-7-3-1-4-8-19/h1-10,15-17,29H,11-14,18H2	LBLUAJDAIHVMDN-UHFFFAOYSA-N	412.178692648							108081
F0223-0018	LSM-19459	BRD-K26122955, SID24816525	2853140	InChI=1S/C18H17NO4S/c20-15(21)8-11-24-10-3-9-19-17(22)13-6-1-4-12-5-2-7-14(16(12)13)18(19)23/h1-2,4-7H,3,8-11H2,(H,20,21)	GTKXGZUMBCLIJE-UHFFFAOYSA-N	OC(=O)CCSCCCN1C(=O)c2cccc3cccc(C1=O)c23	BroadT	BRD-K26122955	BRD-K26122955-001-05-1	Life Chemicals Inc.	F0223-0018			OC(=O)CCSCCCN1C(=O)c2cccc3cccc(C1=O)c23	InChI=1S/C18H17NO4S/c20-15(21)8-11-24-10-3-9-19-17(22)13-6-1-4-12-5-2-7-14(16(12)13)18(19)23/h1-2,4-7H,3,8-11H2,(H,20,21)	GTKXGZUMBCLIJE-UHFFFAOYSA-N	343.087828724							108082
SMR000194982	LSM-19460	BRD-K21201014, SID17431795	2282503	InChI=1S/C18H26N2O3S2/c1-5-20(6-2)18(24)25-12-11-16(21)19-17(22)23-15-9-7-14(8-10-15)13(3)4/h7-10,13H,5-6,11-12H2,1-4H3,(H,19,21,22)	NUEOQLXPVLVOIQ-UHFFFAOYSA-N	CCN(CC)C(=S)SCCC(=O)NC(=O)Oc1ccc(cc1)C(C)C	BroadT	BRD-K21201014	BRD-K21201014-001-05-7	ChemBridge Corporation	6428869			CCN(CC)C(=S)SCCC(=O)NC(=O)Oc1ccc(cc1)C(C)C	InChI=1S/C18H26N2O3S2/c1-5-20(6-2)18(24)25-12-11-16(21)19-17(22)23-15-9-7-14(8-10-15)13(3)4/h7-10,13H,5-6,11-12H2,1-4H3,(H,19,21,22)	NUEOQLXPVLVOIQ-UHFFFAOYSA-N	382.138484092							108083
MLS000074693	LSM-19461	BRD-K46124507, SID848584	651033	InChI=1S/C19H19FN4O4S/c20-13-1-3-17-16(11-13)21-22-24(17)14-5-7-23(8-6-14)29(25,26)15-2-4-18-19(12-15)28-10-9-27-18/h1-4,11-12,14H,5-10H2	KVZMPQNPWLPBGJ-UHFFFAOYSA-N	Fc1ccc2c(c1)nnn2C3CCN(CC3)S(=O)(=O)c4ccc5OCCOc5c4	BroadT	BRD-K46124507	BRD-K46124507-001-05-6	Asinex Ltd.	ASN 06367044			Fc1ccc2n(nnc2c1)C1CCN(CC1)S(=O)(=O)c1ccc2OCCOc2c1	InChI=1S/C19H19FN4O4S/c20-13-1-3-17-16(11-13)21-22-24(17)14-5-7-23(8-6-14)29(25,26)15-2-4-18-19(12-15)28-10-9-27-18/h1-4,11-12,14H,5-10H2	KVZMPQNPWLPBGJ-UHFFFAOYSA-N	418.111104018							108084
MLS-0267981.0001	LSM-19462	BRD-K66327237, SID87544682	1105534	InChI=1S/C22H19N3O4/c26-20-9-5-4-8-19(20)22(28)25-23-14-16-10-12-18(13-11-16)29-15-21(27)24-17-6-2-1-3-7-17/h1-14,26H,15H2,(H,24,27)(H,25,28)	CCINUCVYCWIIPV-UHFFFAOYSA-N	Oc1ccccc1C(=O)NN=Cc2ccc(OCC(=O)Nc3ccccc3)cc2	BroadT	BRD-K66327237	BRD-K66327237-001-05-7	Asinex Ltd.	BAS 00758942			Oc1ccccc1C(=O)NN=Cc1ccc(OCC(=O)Nc2ccccc2)cc1	InChI=1S/C22H19N3O4/c26-20-9-5-4-8-19(20)22(28)25-23-14-16-10-12-18(13-11-16)29-15-21(27)24-17-6-2-1-3-7-17/h1-14,26H,15H2,(H,24,27)(H,25,28)	CCINUCVYCWIIPV-UHFFFAOYSA-N	389.137556118							108085
Methyl [(3-ethyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate	LSM-19463	SID4265326, BRD-K94385157	890738	InChI=1S/C15H16O5/c1-4-11-9(2)12-6-5-10(19-8-14(16)18-3)7-13(12)20-15(11)17/h5-7H,4,8H2,1-3H3	PGEDVTVDANJKKT-UHFFFAOYSA-N	CCC1=C(C)c2ccc(OCC(=O)OC)cc2OC1=O	BroadT	BRD-K94385157	BRD-K94385157-001-05-7	ChemBridge Corporation	7442328			CCc1c(C)c2ccc(OCC(=O)OC)cc2oc1=O	InChI=1S/C15H16O5/c1-4-11-9(2)12-6-5-10(19-8-14(16)18-3)7-13(12)20-15(11)17/h5-7H,4,8H2,1-3H3	PGEDVTVDANJKKT-UHFFFAOYSA-N	276.099773612							108086
CBMICRO_020733	LSM-19464	BRD-A09115727, SID7976174	3107523	InChI=1S/C15H19NO/c1-2-6-12(7-3-1)14-10-13-11-15(16(14)17-13)8-4-5-9-15/h1-3,6-7,13-14H,4-5,8-11H2	QMXWPGNYNKFWCU-UHFFFAOYSA-N	C1CCC2(C1)CC3CC(N2O3)c4ccccc4	BroadT	BRD-A09115727	BRD-A09115727-001-05-5	ChemBridge Corporation	5467864			C1CCC2(C1)CC1CC(N2O1)c1ccccc1	InChI=1S/C15H19NO/c1-2-6-12(7-3-1)14-10-13-11-15(16(14)17-13)8-4-5-9-15/h1-3,6-7,13-14H,4-5,8-11H2	QMXWPGNYNKFWCU-UHFFFAOYSA-N	229.146664238							108087
MLS000094053	LSM-19465	BRD-A47109850, SID4242040	3236943	InChI=1S/C16H16FN5O2S/c1-3-12(16(23)24-4-2)25-15-13-14(18-9-19-15)22(21-20-13)11-7-5-10(17)6-8-11/h5-9,12H,3-4H2,1-2H3	AACUKVXTFOXDGE-UHFFFAOYSA-N	CCOC(=O)C(CC)Sc1ncnc2c1nnn2c3ccc(F)cc3	BroadT	BRD-A47109850	BRD-A47109850-001-06-9	ChemDiv Inc.	C910-0880			CCOC(=O)C(CC)Sc1ncnc2n(nnc12)-c1ccc(F)cc1	InChI=1S/C16H16FN5O2S/c1-3-12(16(23)24-4-2)25-15-13-14(18-9-19-15)22(21-20-13)11-7-5-10(17)6-8-11/h5-9,12H,3-4H2,1-2H3	AACUKVXTFOXDGE-UHFFFAOYSA-N	361.100873692							108088
MLS000594161	LSM-19466	BRD-K76065617, SID14730237	1305726	InChI=1S/C22H23NO5/c1-26-15-7-9-17-18-10-8-16(12-20(18)28-22(25)19(17)11-15)27-13-21(24)23-14-5-3-2-4-6-14/h7-12,14H,2-6,13H2,1H3,(H,23,24)	OVYJLQGRKUOMMA-UHFFFAOYSA-N	COc1ccc2c(c1)C(=O)Oc3cc(OCC(=O)NC4CCCCC4)ccc23	BroadT	BRD-K76065617	BRD-K76065617-001-05-1	ChemBridge Corporation	7683031			COc1ccc2c3ccc(OCC(=O)NC4CCCCC4)cc3oc(=O)c2c1	InChI=1S/C22H23NO5/c1-26-15-7-9-17-18-10-8-16(12-20(18)28-22(25)19(17)11-15)27-13-21(24)23-14-5-3-2-4-6-14/h7-12,14H,2-6,13H2,1H3,(H,23,24)	OVYJLQGRKUOMMA-UHFFFAOYSA-N	381.157622846							108089
AC1NMVVZ	LSM-19467	BRD-A57762296, SID22414389	5016927	InChI=1S/C27H32N6O2S/c1-17-8-7-9-22(14-17)33-25(34)15-24(26(33)35)32(16-23-18(2)29-31(6)19(23)3)27(36)28-20-10-12-21(13-11-20)30(4)5/h7-14,24H,15-16H2,1-6H3,(H,28,36)	AGNCTQYSKRYEFE-UHFFFAOYSA-N	CN(C)c1ccc(NC(=S)N(Cc2c(C)nn(C)c2C)C3CC(=O)N(C3=O)c4cccc(C)c4)cc1	BroadT	BRD-A57762296	BRD-A57762296-001-05-6	Specs	AK-968/41018336			CN(C)c1ccc(NC(=S)N(Cc2c(C)nn(C)c2C)C2CC(=O)N(C2=O)c2cccc(C)c2)cc1	InChI=1S/C27H32N6O2S/c1-17-8-7-9-22(14-17)33-25(34)15-24(26(33)35)32(16-23-18(2)29-31(6)19(23)3)27(36)28-20-10-12-21(13-11-20)30(4)5/h7-14,24H,15-16H2,1-6H3,(H,28,36)	AGNCTQYSKRYEFE-UHFFFAOYSA-N	504.230745014							108090
MLS000078222	LSM-43838	BRD-K29726765, SID24841058, SID858491	5389191	InChI=1S/C22H27N5O4/c1-4-5-6-10-13-26-20(29)17(19(28)24-22(26)31)14-23-18-15(2)25(3)27(21(18)30)16-11-8-7-9-12-16/h7-9,11-12,14,23H,4-6,10,13H2,1-3H3,(H,24,28,31)/b17-14+	HICDEVOITSXOSY-SAPNQHFASA-N	CCCCCCN1C(=O)NC(=O)\C(=C/NC2=C(C)N(C)N(C2=O)c3ccccc3)\C1=O	BroadT	BRD-K29726765	BRD-K29726765-001-05-6	InterBioScreen Ltd.	STOCK2S-47488			CCCCCCN1C(=O)NC(=O)\C(=C/Nc2c(C)n(C)n(-c3ccccc3)c2=O)C1=O	InChI=1S/C22H27N5O4/c1-4-5-6-10-13-26-20(29)17(19(28)24-22(26)31)14-23-18-15(2)25(3)27(21(18)30)16-11-8-7-9-12-16/h7-9,11-12,14,23H,4-6,10,13H2,1-3H3,(H,24,28,31)/b17-14+	HICDEVOITSXOSY-SAPNQHFASA-N	425.206304394							
2-(4-Fluoro-phenyl)-7-morpholin-4-yl-5-phenyl-pyrazolo[1,5-a]pyrimidine	LSM-19469	BRD-K85656316, SID851656	654240	InChI=1S/C22H19FN4O/c23-18-8-6-17(7-9-18)20-14-21-24-19(16-4-2-1-3-5-16)15-22(27(21)25-20)26-10-12-28-13-11-26/h1-9,14-15H,10-13H2	OIHQWUKPJWZTQS-UHFFFAOYSA-N	Fc1ccc(cc1)c2cc3nc(cc(N4CCOCC4)n3n2)c5ccccc5	BroadT	BRD-K85656316	BRD-K85656316-001-05-0	Asinex Ltd.	ASN 08735907			Fc1ccc(cc1)-c1cc2nc(cc(N3CCOCC3)n2n1)-c1ccccc1	InChI=1S/C22H19FN4O/c23-18-8-6-17(7-9-18)20-14-21-24-19(16-4-2-1-3-5-16)15-22(27(21)25-20)26-10-12-28-13-11-26/h1-9,14-15H,10-13H2	OIHQWUKPJWZTQS-UHFFFAOYSA-N	374.154289468							108092
AMBCB33779756	LSM-19470	BRD-A05883068, SID24799693	16191363	InChI=1S/C25H34FN3O2/c1-31-23-6-4-5-20(17-23)18-28-14-15-29(19-22(28)11-16-30)21-9-12-27(13-10-21)25-8-3-2-7-24(25)26/h2-8,17,21-22,30H,9-16,18-19H2,1H3	CAOHKWDKHJCSRC-UHFFFAOYSA-N	COc1cccc(CN2CCN(CC2CCO)C3CCN(CC3)c4ccccc4F)c1	BroadT	BRD-A05883068	BRD-A05883068-001-05-9	ChemBridge Corporation	33779756			COc1cccc(CN2CCN(CC2CCO)C2CCN(CC2)c2ccccc2F)c1	InChI=1S/C25H34FN3O2/c1-31-23-6-4-5-20(17-23)18-28-14-15-29(19-22(28)11-16-30)21-9-12-27(13-10-21)25-8-3-2-7-24(25)26/h2-8,17,21-22,30H,9-16,18-19H2,1H3	CAOHKWDKHJCSRC-UHFFFAOYSA-N	427.263505558							108093
BAS 09535555	LSM-19471	BRD-K88418404, SID851646	654230	InChI=1S/C12H13N3O2S2/c1-17-6-7-18-10-5-3-2-4-9(10)11(16)14-12-15-13-8-19-12/h2-5,8H,6-7H2,1H3,(H,14,15,16)	HXTTZPRRADQPJR-UHFFFAOYSA-N	COCCSc1ccccc1C(=O)Nc2nncs2	BroadT	BRD-K88418404	BRD-K88418404-001-05-5	Asinex Ltd.	BAS 09535555			COCCSc1ccccc1C(=O)Nc1nncs1	InChI=1S/C12H13N3O2S2/c1-17-6-7-18-10-5-3-2-4-9(10)11(16)14-12-15-13-8-19-12/h2-5,8H,6-7H2,1H3,(H,14,15,16)	HXTTZPRRADQPJR-UHFFFAOYSA-N	295.044918066							108094
N-(6-Ethoxy-1,3-benzothiazol-2-yl)butanamide	LSM-19472	SID7970581, BRD-K09108485	849083	InChI=1S/C13H16N2O2S/c1-3-5-12(16)15-13-14-10-7-6-9(17-4-2)8-11(10)18-13/h6-8H,3-5H2,1-2H3,(H,14,15,16)	AFIXLXSJIGDAOC-UHFFFAOYSA-N	CCCC(=O)Nc1nc2ccc(OCC)cc2s1	BroadT	BRD-K09108485	BRD-K09108485-001-05-0	Life Chemicals Inc.	F0336-0425			CCCC(=O)Nc1nc2ccc(OCC)cc2s1	InChI=1S/C13H16N2O2S/c1-3-5-12(16)15-13-14-10-7-6-9(17-4-2)8-11(10)18-13/h6-8H,3-5H2,1-2H3,(H,14,15,16)	AFIXLXSJIGDAOC-UHFFFAOYSA-N	264.093248462							108095
SMR000000427	LSM-19473	BRD-A54490075, SID852204	654816	InChI=1S/C21H36N4O2/c26-19(25-15-14-24-13-7-10-18(24)16-25)21(11-5-2-6-12-21)23-20(27)22-17-8-3-1-4-9-17/h17-18H,1-16H2,(H2,22,23,27)	NYYWDZXFMPIOHW-UHFFFAOYSA-N	O=C(NC1CCCCC1)NC2(CCCCC2)C(=O)N3CCN4CCCC4C3	BroadT	BRD-A54490075	BRD-A54490075-001-06-2	Asinex Ltd.	ASN 08828667			O=C(NC1CCCCC1)NC1(CCCCC1)C(=O)N1CCN2CCCC2C1	InChI=1S/C21H36N4O2/c26-19(25-15-14-24-13-7-10-18(24)16-25)21(11-5-2-6-12-21)23-20(27)22-17-8-3-1-4-9-17/h17-18H,1-16H2,(H2,22,23,27)	NYYWDZXFMPIOHW-UHFFFAOYSA-N	376.283826432							108096
BDBM68809	LSM-19474	BRD-A52749901	91897781	InChI=1S/C20H22N2O2/c1-11-5-7-13(8-6-11)17-16-12(2)22-24-19(16)21-14-9-20(3,4)10-15(23)18(14)17/h5-8,17-18H,9-10H2,1-4H3	RXFKKSWJCDSNAU-UHFFFAOYSA-N	Cc1ccc(cc1)C2C3C(=O)CC(C)(C)CC3=Nc4onc(C)c24	BroadT	BRD-A52749901	BRD-A52749901-001-06-3	Enamine Ltd.	T0507-8636			Cc1noc2N=C3CC(C)(C)CC(=O)C3C(c12)c1ccc(C)cc1	InChI=1S/C20H22N2O2/c1-11-5-7-13(8-6-11)17-16-12(2)22-24-19(16)21-14-9-20(3,4)10-15(23)18(14)17/h5-8,17-18H,9-10H2,1-4H3	RXFKKSWJCDSNAU-UHFFFAOYSA-N	322.168127964							108097
MLS000584612	LSM-19475	BRD-A19766589, SID17510540	12005250	InChI=1S/C22H20ClN3O4/c23-15-7-5-14(6-8-15)11-12-24-19-10-9-16(13-20(19)26(29)30)25-21(27)17-3-1-2-4-18(17)22(25)28/h1-2,5-10,13,17-18,24H,3-4,11-12H2	ZLAMWOTWAMBKOV-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1NCCc2ccc(Cl)cc2)N3C(=O)C4CC=CCC4C3=O	BroadT	BRD-A19766589	BRD-A19766589-001-05-0	ChemDiv Inc.	K807-0458			[O-][N+](=O)c1cc(ccc1NCCc1ccc(Cl)cc1)N1C(=O)C2CC=CCC2C1=O	InChI=1S/C22H20ClN3O4/c23-15-7-5-14(6-8-15)11-12-24-19-10-9-16(13-20(19)26(29)30)25-21(27)17-3-1-2-4-18(17)22(25)28/h1-2,5-10,13,17-18,24H,3-4,11-12H2	ZLAMWOTWAMBKOV-UHFFFAOYSA-N	425.11423386							108098
T0501-4570	LSM-19476	BRD-K42181022, SID16953988	2337588	InChI=1S/C12H14ClN3O4/c13-8-3-1-2-4-9(8)15-16-10-11(19)20-7-12(5-17,6-18)14-10/h1-4,15,17-18H,5-7H2,(H,14,16)	BYWVFEWYYYHRPI-UHFFFAOYSA-N	OCC1(CO)COC(=O)C(=N1)NNc2ccccc2Cl	BroadT	BRD-K42181022	BRD-K42181022-001-05-6	Enamine Ltd.	T0501-4570			OCC1(CO)COC(=O)C(NNc2ccccc2Cl)=N1	InChI=1S/C12H14ClN3O4/c13-8-3-1-2-4-9(8)15-16-10-11(19)20-7-12(5-17,6-18)14-10/h1-4,15,17-18H,5-7H2,(H,14,16)	BYWVFEWYYYHRPI-UHFFFAOYSA-N	299.067283668							108099
AC1M7EVH	LSM-19477	BRD-K50066702	2416795	InChI=1S/C16H21N3O4/c20-16(18-14-7-3-1-2-4-8-14)12-23-17-11-13-6-5-9-15(10-13)19(21)22/h5-6,9-11,14H,1-4,7-8,12H2,(H,18,20)	NKQSLIHINGREGE-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(C=NOCC(=O)NC2CCCCCC2)c1	BroadT	BRD-K50066702	BRD-K50066702-001-05-5	Enamine Ltd.	T0512-1528			[O-][N+](=O)c1cccc(C=NOCC(=O)NC2CCCCCC2)c1	InChI=1S/C16H21N3O4/c20-16(18-14-7-3-1-2-4-8-14)12-23-17-11-13-6-5-9-15(10-13)19(21)22/h5-6,9-11,14H,1-4,7-8,12H2,(H,18,20)	NKQSLIHINGREGE-UHFFFAOYSA-N	319.153206182							108100
N-(4-Adamantan-1-yl-thiazol-2-yl)-n'-(4-fluoro-benzyl)-oxalamide	LSM-19478	BRD-K52473839, SID17509205	2870872	InChI=1S/C22H24FN3O2S/c23-17-3-1-13(2-4-17)11-24-19(27)20(28)26-21-25-18(12-29-21)22-8-14-5-15(9-22)7-16(6-14)10-22/h1-4,12,14-16H,5-11H2,(H,24,27)(H,25,26,28)	CZUYDJDOHDASDE-UHFFFAOYSA-N	Fc1ccc(CNC(=O)C(=O)Nc2nc(cs2)C34CC5CC(CC(C5)C3)C4)cc1	BroadT	BRD-K52473839	BRD-K52473839-001-07-3	Asinex Ltd.	BAS 00919866			Fc1ccc(CNC(=O)C(=O)Nc2nc(cs2)C23CC4CC(CC(C4)C2)C3)cc1	InChI=1S/C22H24FN3O2S/c23-17-3-1-13(2-4-17)11-24-19(27)20(28)26-21-25-18(12-29-21)22-8-14-5-15(9-22)7-16(6-14)10-22/h1-4,12,14-16H,5-11H2,(H,24,27)(H,25,26,28)	CZUYDJDOHDASDE-UHFFFAOYSA-N	413.157325928							108101
SMR000073369	LSM-19479	BRD-K86232198, SID4259998	2164602	InChI=1S/C21H22ClN3O4/c1-12(2)28-21(27)15-5-7-16(8-6-15)23-20(26)18-10-9-17(29-18)11-25-14(4)19(22)13(3)24-25/h5-10,12H,11H2,1-4H3,(H,23,26)	IYBQADCFOWHEEK-UHFFFAOYSA-N	CC(C)OC(=O)c1ccc(NC(=O)c2oc(Cn3nc(C)c(Cl)c3C)cc2)cc1	BroadT	BRD-K86232198	BRD-K86232198-001-06-0	ChemBridge Corporation	7556933			CC(C)OC(=O)c1ccc(NC(=O)c2ccc(Cn3nc(C)c(Cl)c3C)o2)cc1	InChI=1S/C21H22ClN3O4/c1-12(2)28-21(27)15-5-7-16(8-6-15)23-20(26)18-10-9-17(29-18)11-25-14(4)19(22)13(3)24-25/h5-10,12H,11H2,1-4H3,(H,23,26)	IYBQADCFOWHEEK-UHFFFAOYSA-N	415.129883924							108102
SMR000195531	LSM-43839	BRD-K14166090, SID17411966	5731085	InChI=1S/C23H19FN2O4S/c1-16(27)18-3-2-4-21(15-18)26-31(29,30)22-11-9-20(10-12-22)25-14-13-23(28)17-5-7-19(24)8-6-17/h2-15,25-26H,1H3/b14-13-	FPELRVRVQZJDHZ-YPKPFQOOSA-N	CC(=O)c1cccc(NS(=O)(=O)c2ccc(N\C=C/C(=O)c3ccc(F)cc3)cc2)c1	BroadT	BRD-K14166090	BRD-K14166090-001-06-6	ChemBridge Corporation	6590860			CC(=O)c1cccc(NS(=O)(=O)c2ccc(N\C=C/C(=O)c3ccc(F)cc3)cc2)c1	InChI=1S/C23H19FN2O4S/c1-16(27)18-3-2-4-21(15-18)26-31(29,30)22-11-9-20(10-12-22)25-14-13-23(28)17-5-7-19(24)8-6-17/h2-15,25-26H,1H3/b14-13-	FPELRVRVQZJDHZ-YPKPFQOOSA-N	438.104955998							
Methyl 5-{[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl)oxy]methyl}furan-2-carboxylate	LSM-19481	BRD-K27354087, SID7972695	1321373	InChI=1S/C21H20O6/c1-12-9-17(25-11-13-7-8-16(26-13)21(23)24-2)19-14-5-3-4-6-15(14)20(22)27-18(19)10-12/h7-10H,3-6,11H2,1-2H3	MKKXFJVEZIBZJT-UHFFFAOYSA-N	COC(=O)c1oc(COc2cc(C)cc3OC(=O)C4=C(CCCC4)c23)cc1	BroadT	BRD-K27354087	BRD-K27354087-001-05-0	ChemBridge Corporation	6843753			COC(=O)c1ccc(COc2cc(C)cc3oc(=O)c4CCCCc4c23)o1	InChI=1S/C21H20O6/c1-12-9-17(25-11-13-7-8-16(26-13)21(23)24-2)19-14-5-3-4-6-15(14)20(22)27-18(19)10-12/h7-10H,3-6,11H2,1-2H3	MKKXFJVEZIBZJT-UHFFFAOYSA-N	368.12598836							108104
AC1OADXV	LSM-19482	BRD-K67950754	6803196	InChI=1S/C13H14N4O2/c1-9-12(8-14-15-10(2)18)13(19)17(16-9)11-6-4-3-5-7-11/h3-8,19H,1-2H3,(H,15,18)	VZGPXJZTJFJBOS-UHFFFAOYSA-N	CC(=O)NN=Cc1c(C)nn(c1O)c2ccccc2	BroadT	BRD-K67950754	BRD-K67950754-001-06-6	ChemDiv Inc.	3896-0041			CC(=O)NN=Cc1c(C)nn(c1O)-c1ccccc1	InChI=1S/C13H14N4O2/c1-9-12(8-14-15-10(2)18)13(19)17(16-9)11-6-4-3-5-7-11/h3-8,19H,1-2H3,(H,15,18)	VZGPXJZTJFJBOS-UHFFFAOYSA-N	258.111675728							
6-Amino-3-(2-chloro-benzyl)-2-propyl-3H-quinazolin-4-one	LSM-19483	SID47202625, BRD-K51546355	1173996	InChI=1S/C18H18ClN3O/c1-2-5-17-21-16-9-8-13(20)10-14(16)18(23)22(17)11-12-6-3-4-7-15(12)19/h3-4,6-10H,2,5,11,20H2,1H3	GIUSZZFJMOEGOA-UHFFFAOYSA-N	CCCC1=Nc2ccc(N)cc2C(=O)N1Cc3ccccc3Cl	BroadT	BRD-K51546355	BRD-K51546355-001-05-5	Asinex Ltd.	ASN 04445524			CCCc1nc2ccc(N)cc2c(=O)n1Cc1ccccc1Cl	InChI=1S/C18H18ClN3O/c1-2-5-17-21-16-9-8-13(20)10-14(16)18(23)22(17)11-12-6-3-4-7-15(12)19/h3-4,6-10H,2,5,11,20H2,1H3	GIUSZZFJMOEGOA-UHFFFAOYSA-N	327.113839936							108106
MLS000531418	LSM-19484	BRD-K75038426, SID14731009	850111	InChI=1S/C16H18ClNO3S/c1-3-12-5-7-13(8-6-12)18-22(19,20)14-9-10-15(17)16(11-14)21-4-2/h5-11,18H,3-4H2,1-2H3	NWUSWVQVPQQPCB-UHFFFAOYSA-N	CCOc1cc(ccc1Cl)S(=O)(=O)Nc2ccc(CC)cc2	BroadT	BRD-K75038426	BRD-K75038426-001-06-8	ChemBridge Corporation	7934939			CCOc1cc(ccc1Cl)S(=O)(=O)Nc1ccc(CC)cc1	InChI=1S/C16H18ClNO3S/c1-3-12-5-7-13(8-6-12)18-22(19,20)14-9-10-15(17)16(11-14)21-4-2/h5-11,18H,3-4H2,1-2H3	NWUSWVQVPQQPCB-UHFFFAOYSA-N	339.069591846							108107
ST50884822	LSM-19485	BRD-K66870022, SID4262245	1246991	InChI=1S/C18H15N3O2S/c1-10-15(11(2)23-21-10)17(22)20-18-14(9-19)16(12(3)24-18)13-7-5-4-6-8-13/h4-8H,1-3H3,(H,20,22)	TZPMWECWAREQGV-UHFFFAOYSA-N	Cc1onc(C)c1C(=O)Nc2sc(C)c(c3ccccc3)c2C#N	BroadT	BRD-K66870022	BRD-K66870022-001-05-5	ChemBridge Corporation	7948180			Cc1noc(C)c1C(=O)Nc1sc(C)c(c1C#N)-c1ccccc1	InChI=1S/C18H15N3O2S/c1-10-15(11(2)23-21-10)17(22)20-18-14(9-19)16(12(3)24-18)13-7-5-4-6-8-13/h4-8H,1-3H3,(H,20,22)	TZPMWECWAREQGV-UHFFFAOYSA-N	337.08849744							108108
MLS000558154	LSM-19486	BRD-K03361106, SID14742160	2014844	InChI=1S/C21H19N3O2S/c1-14-23-19-16-9-5-6-10-17(16)26-20(19)21(24-14)27-13-18(25)22-12-11-15-7-3-2-4-8-15/h2-10H,11-13H2,1H3,(H,22,25)	LAQIBEHWRBFZQH-UHFFFAOYSA-N	Cc1nc(SCC(=O)NCCc2ccccc2)c3oc4ccccc4c3n1	BroadT	BRD-K03361106	BRD-K03361106-001-05-0	InterBioScreen Ltd.	STOCK4S-51012			Cc1nc(SCC(=O)NCCc2ccccc2)c2oc3ccccc3c2n1	InChI=1S/C21H19N3O2S/c1-14-23-19-16-9-5-6-10-17(16)26-20(19)21(24-14)27-13-18(25)22-12-11-15-7-3-2-4-8-15/h2-10H,11-13H2,1H3,(H,22,25)	LAQIBEHWRBFZQH-UHFFFAOYSA-N	377.119797568							108109
AC1LGGVA	LSM-19487	BRD-K74665927	770938	InChI=1S/C13H11BrN2O2S/c1-8(12-3-2-6-19-12)15-16-13(18)10-7-9(14)4-5-11(10)17/h2-7,17H,1H3,(H,16,18)	PLAMTYWNVFFYPH-UHFFFAOYSA-N	CC(=NNC(=O)c1cc(Br)ccc1O)c2cccs2	BroadT	BRD-K74665927	BRD-K74665927-001-05-5	ChemDiv Inc.	2245-0293			CC(=NNC(=O)c1cc(Br)ccc1O)c1cccs1	InChI=1S/C13H11BrN2O2S/c1-8(12-3-2-6-19-12)15-16-13(18)10-7-9(14)4-5-11(10)17/h2-7,17H,1H3,(H,16,18)	PLAMTYWNVFFYPH-UHFFFAOYSA-N	337.972460902							108110
AC1NW4Y0	LSM-19488	BRD-K75164441, SID3714841	5669691	InChI=1S/C17H12N2O2/c20-14-10-19-13-9-5-4-8-12(13)17(21)18-16(19)15(14)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,21)	ABPHLWTZNRABDN-UHFFFAOYSA-N	O=C1CN2C(=C1c3ccccc3)NC(=O)c4ccccc24	BroadT	BRD-K75164441	BRD-K75164441-001-05-5	Enamine Ltd.	T0501-7893			O=C1CN2C(NC(=O)c3ccccc23)=C1c1ccccc1	InChI=1S/C17H12N2O2/c20-14-10-19-13-9-5-4-8-12(13)17(21)18-16(19)15(14)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,21)	ABPHLWTZNRABDN-UHFFFAOYSA-N	276.089877644							108111
3-[[3-(Azepan-1-ylsulfonyl)-4-chlorobenzoyl]amino]benzoic acid	LSM-19489	BRD-K81997160, SID24786719	1251694	InChI=1S/C20H21ClN2O5S/c21-17-9-8-14(19(24)22-16-7-5-6-15(12-16)20(25)26)13-18(17)29(27,28)23-10-3-1-2-4-11-23/h5-9,12-13H,1-4,10-11H2,(H,22,24)(H,25,26)	HUVHEVNCIMLRMZ-UHFFFAOYSA-N	OC(=O)c1cccc(NC(=O)c2ccc(Cl)c(c2)S(=O)(=O)N3CCCCCC3)c1	BroadT	BRD-K81997160	BRD-K81997160-001-05-9	ChemDiv Inc.	3019-0401			OC(=O)c1cccc(NC(=O)c2ccc(Cl)c(c2)S(=O)(=O)N2CCCCCC2)c1	InChI=1S/C20H21ClN2O5S/c21-17-9-8-14(19(24)22-16-7-5-6-15(12-16)20(25)26)13-18(17)29(27,28)23-10-3-1-2-4-11-23/h5-9,12-13H,1-4,10-11H2,(H,22,24)(H,25,26)	HUVHEVNCIMLRMZ-UHFFFAOYSA-N	436.085970192							108112
3-Phenylquinoxalin-2(1H)-one	LSM-19490	BRD-K66413698, SID26658444	346902	InChI=1S/C14H10N2O/c17-14-13(10-6-2-1-3-7-10)15-11-8-4-5-9-12(11)16-14/h1-9H,(H,16,17)	ZBBQSGVRBQKLLE-UHFFFAOYSA-N	Oc1nc2ccccc2nc1c3ccccc3	BroadT	BRD-K66413698	BRD-K66413698-001-05-7	InterBioScreen Ltd.	STOCK4S-84504			Oc1nc2ccccc2nc1-c1ccccc1	InChI=1S/C14H10N2O/c17-14-13(10-6-2-1-3-7-10)15-11-8-4-5-9-12(11)16-14/h1-9H,(H,16,17)	ZBBQSGVRBQKLLE-UHFFFAOYSA-N	222.07931296							108113
CHEMBL1388493	LSM-19491	SID846998, BRD-K08702524	649393	InChI=1S/C17H20N2O4/c20-16(18-6-3-7-19-8-10-22-11-9-19)14-12-13-4-1-2-5-15(13)23-17(14)21/h1-2,4-5,12H,3,6-11H2,(H,18,20)	ALAZKHHIMOUNCX-UHFFFAOYSA-N	O=C(NCCCN1CCOCC1)C2=Cc3ccccc3OC2=O	BroadT	BRD-K08702524	BRD-K08702524-001-05-4	Asinex Ltd.	BAS 01236629			O=C(NCCCN1CCOCC1)c1cc2ccccc2oc1=O	InChI=1S/C17H20N2O4/c20-16(18-6-3-7-19-8-10-22-11-9-19)14-12-13-4-1-2-5-15(13)23-17(14)21/h1-2,4-5,12H,3,6-11H2,(H,18,20)	ALAZKHHIMOUNCX-UHFFFAOYSA-N	316.14230714							108114
4-Hexanoylresorcinol	LSM-19492	BRD-K65112040, SID24836923	76596	InChI=1S/C12H16O3/c1-2-3-4-5-11(14)10-7-6-9(13)8-12(10)15/h6-8,13,15H,2-5H2,1H3	SKUFHZAEFGZSQK-UHFFFAOYSA-N	CCCCCC(=O)c1ccc(O)cc1O	BroadT	BRD-K65112040	BRD-K65112040-001-05-1	Enamine Ltd.	T0500-1971			CCCCCC(=O)c1ccc(O)cc1O	InChI=1S/C12H16O3/c1-2-3-4-5-11(14)10-7-6-9(13)8-12(10)15/h6-8,13,15H,2-5H2,1H3	SKUFHZAEFGZSQK-UHFFFAOYSA-N	208.109944372							108115
AC1O3BX6	LSM-43840	BRD-K83715372, SID22407254	6224121	InChI=1S/C23H24ClN3O4/c1-3-31-20-14-15(13-17(24)21(20)29-2)12-16(23(28)27-8-10-30-11-9-27)22-25-18-6-4-5-7-19(18)26-22/h4-7,12-14H,3,8-11H2,1-2H3,(H,25,26)/b16-12+	ZXLQIKBYLSJLEQ-FOWTUZBSSA-N	CCOc1cc(\C=C(\C(=O)N2CCOCC2)/c3nc4ccccc4[nH]3)cc(Cl)c1OC	BroadT	BRD-K83715372	BRD-K83715372-001-06-5	Enamine Ltd.	T5331722			CCOc1cc(\C=C(\C(=O)N2CCOCC2)c2nc3ccccc3[nH]2)cc(Cl)c1OC	InChI=1S/C23H24ClN3O4/c1-3-31-20-14-15(13-17(24)21(20)29-2)12-16(23(28)27-8-10-30-11-9-27)22-25-18-6-4-5-7-19(18)26-22/h4-7,12-14H,3,8-11H2,1-2H3,(H,25,26)/b16-12+	ZXLQIKBYLSJLEQ-FOWTUZBSSA-N	441.145533988							
SMR000010250	LSM-19494	BRD-K83270677, SID848571	54687523	InChI=1S/C15H17NO3/c17-14-11-6-2-3-7-13(11)19-15(18)12(14)10-16-8-4-1-5-9-16/h2-3,6-7,17H,1,4-5,8-10H2	ZZUCJGSOKDNIEZ-UHFFFAOYSA-N	OC1=C(CN2CCCCC2)C(=O)Oc3ccccc13	BroadT	BRD-K83270677	BRD-K83270677-001-05-5	Asinex Ltd.	BAS 01256128			Oc1c(CN2CCCCC2)c(=O)oc2ccccc12	InChI=1S/C15H17NO3/c17-14-11-6-2-3-7-13(11)19-15(18)12(14)10-16-8-4-1-5-9-16/h2-3,6-7,17H,1,4-5,8-10H2	ZZUCJGSOKDNIEZ-UHFFFAOYSA-N	259.120843414							108117
MLS000690386	LSM-19495	BRD-A07861932, SID22416861	2956806	InChI=1S/C21H25NO5S/c1-3-27-19(24)15-13-6-4-5-7-14(13)28-18(15)22-17(23)16-11-8-9-12(10-11)21(16,2)20(25)26/h8-9,11-12,16H,3-7,10H2,1-2H3,(H,22,23)(H,25,26)	MYCPMISCHRNPFC-UHFFFAOYSA-N	CCOC(=O)c1c2CCCCc2sc1NC(=O)C3C4CC(C=C4)C3(C)C(=O)O	BroadT	BRD-A07861932	BRD-A07861932-001-06-5	ChemBridge Corporation	7816769			CCOC(=O)c1c(NC(=O)C2C3CC(C=C3)C2(C)C(O)=O)sc2CCCCc12	InChI=1S/C21H25NO5S/c1-3-27-19(24)15-13-6-4-5-7-14(13)28-18(15)22-17(23)16-11-8-9-12(10-11)21(16,2)20(25)26/h8-9,11-12,16H,3-7,10H2,1-2H3,(H,22,23)(H,25,26)	MYCPMISCHRNPFC-UHFFFAOYSA-N	403.1453436							108118
1-Methyl-2-(4-methyl-piperidin-1-ylmethyl)-1H-indole-3-carbonitrile	LSM-19496	BRD-K30198800, SID844061	646371	InChI=1S/C17H21N3/c1-13-7-9-20(10-8-13)12-17-15(11-18)14-5-3-4-6-16(14)19(17)2/h3-6,13H,7-10,12H2,1-2H3	QPRAWRACYHQMTB-UHFFFAOYSA-N	CC1CCN(Cc2c(C#N)c3ccccc3n2C)CC1	BroadT	BRD-K30198800	BRD-K30198800-001-05-2	Asinex Ltd.	BAS 07119806			CC1CCN(Cc2c(C#N)c3ccccc3n2C)CC1	InChI=1S/C17H21N3/c1-13-7-9-20(10-8-13)12-17-15(11-18)14-5-3-4-6-16(14)19(17)2/h3-6,13H,7-10,12H2,1-2H3	QPRAWRACYHQMTB-UHFFFAOYSA-N	267.173547702							108119
T0508-7363	LSM-19497	BRD-K15742845, SID17516255	3645743	InChI=1S/C11H13N3O2S/c1-7-3-8(2)14-4-9(13-11(14)12-7)5-17-6-10(15)16/h3-4H,5-6H2,1-2H3,(H,15,16)	MOKSCDRNNQRPRU-UHFFFAOYSA-N	Cc1cc(C)n2cc(CSCC(=O)O)nc2n1	BroadT	BRD-K15742845	BRD-K15742845-001-06-1	Enamine Ltd.	T0508-7363			Cc1cc(C)n2cc(CSCC(O)=O)nc2n1	InChI=1S/C11H13N3O2S/c1-7-3-8(2)14-4-9(13-11(14)12-7)5-17-6-10(15)16/h3-4H,5-6H2,1-2H3,(H,15,16)	MOKSCDRNNQRPRU-UHFFFAOYSA-N	251.072847376							108120
MLS001210968	LSM-2059	BRD-K03857568, SID99222852, SID49644738	776319	InChI=1S/C17H14N2O3S/c1-11-7-9-12(10-8-11)23-16-13-5-3-4-6-14(13)18(2)17(20)15(16)19(21)22/h3-10H,1-2H3	YPRWBCIJAZDVIK-UHFFFAOYSA-N	CN1C(=O)C(=C(Sc2ccc(C)cc2)c3ccccc13)[N+](=O)[O-]	BroadT	BRD-K03857568	BRD-K03857568-001-12-4	Asinex Ltd.	BAS 01060307			Cc1ccc(Sc2c([N+]([O-])=O)c(=O)n(C)c3ccccc23)cc1	InChI=1S/C17H14N2O3S/c1-11-7-9-12(10-8-11)23-16-13-5-3-4-6-14(13)18(2)17(20)15(16)19(21)22/h3-10H,1-2H3	YPRWBCIJAZDVIK-UHFFFAOYSA-N	326.072513018							92067
AMBCB73207886	LSM-19498	BRD-K59491389, SID24799621	16191292	InChI=1S/C24H28ClNO3/c25-21-6-7-23-20(15-21)14-19(17-29-23)16-26-11-8-24(18-27,9-12-26)10-13-28-22-4-2-1-3-5-22/h1-7,14-15,27H,8-13,16-18H2	VWDKYMHHRGVWMZ-UHFFFAOYSA-N	OCC1(CCOc2ccccc2)CCN(CC3=Cc4cc(Cl)ccc4OC3)CC1	BroadT	BRD-K59491389	BRD-K59491389-001-05-6	ChemBridge Corporation	73207886			OCC1(CCOc2ccccc2)CCN(CC2=Cc3cc(Cl)ccc3OC2)CC1	InChI=1S/C24H28ClNO3/c25-21-6-7-23-20(15-21)14-19(17-29-23)16-26-11-8-24(18-27,9-12-26)10-13-28-22-4-2-1-3-5-22/h1-7,14-15,27H,8-13,16-18H2	VWDKYMHHRGVWMZ-UHFFFAOYSA-N	413.175771476							108121
MLS001110692	LSM-19499	BRD-A24223049, SID49731297	20889614	InChI=1S/C23H34N4OS/c1-17-13-18(2)16-26(15-17)10-6-9-24-22(28)19-7-8-20-21(14-19)29-23(25-20)27-11-4-3-5-12-27/h7-8,14,17-18H,3-6,9-13,15-16H2,1-2H3,(H,24,28)	KDXQGPFMMPTGGP-UHFFFAOYSA-N	CC1CC(C)CN(CCCNC(=O)c2ccc3nc(sc3c2)N4CCCCC4)C1	BroadT	BRD-A24223049	BRD-A24223049-001-04-2	ChemDiv Inc.	C858-0768			CC1CC(C)CN(CCCNC(=O)c2ccc3nc(sc3c2)N2CCCCC2)C1	InChI=1S/C23H34N4OS/c1-17-13-18(2)16-26(15-17)10-6-9-24-22(28)19-7-8-20-21(14-19)29-23(25-20)27-11-4-3-5-12-27/h7-8,14,17-18H,3-6,9-13,15-16H2,1-2H3,(H,24,28)	KDXQGPFMMPTGGP-UHFFFAOYSA-N	414.245332438							108122
1-Butyl-3-(4-phenoxyphenyl)thiourea	LSM-19500	SID24794129, BRD-K77490065	1971946	InChI=1S/C17H20N2OS/c1-2-3-13-18-17(21)19-14-9-11-16(12-10-14)20-15-7-5-4-6-8-15/h4-12H,2-3,13H2,1H3,(H2,18,19,21)	WMUMMRQASOQEKE-UHFFFAOYSA-N	CCCCN=C(S)Nc1ccc(Oc2ccccc2)cc1	BroadT	BRD-K77490065	BRD-K77490065-001-05-7	ChemBridge Corporation	7863989			CCCCN=C(S)Nc1ccc(Oc2ccccc2)cc1	InChI=1S/C17H20N2OS/c1-2-3-13-18-17(21)19-14-9-11-16(12-10-14)20-15-7-5-4-6-8-15/h4-12H,2-3,13H2,1H3,(H2,18,19,21)	WMUMMRQASOQEKE-UHFFFAOYSA-N	300.12963397							108123
STK214473	LSM-19501	BRD-A94465834, SID4264793	2956238	InChI=1S/C24H23NO4/c1-16-15-29-17(2)22(16)21(26)14-24(28)19-10-6-7-11-20(19)25(23(24)27)13-12-18-8-4-3-5-9-18/h3-11,15,28H,12-14H2,1-2H3	XGRYBDRIDFKQKK-UHFFFAOYSA-N	Cc1occ(C)c1C(=O)CC2(O)C(=O)N(CCc3ccccc3)c4ccccc24	BroadT	BRD-A94465834	BRD-A94465834-001-06-8	ChemBridge Corporation	7807906			Cc1coc(C)c1C(=O)CC1(O)C(=O)N(CCc2ccccc2)c2ccccc12	InChI=1S/C24H23NO4/c1-16-15-29-17(2)22(16)21(26)14-24(28)19-10-6-7-11-20(19)25(23(24)27)13-12-18-8-4-3-5-9-18/h3-11,15,28H,12-14H2,1-2H3	XGRYBDRIDFKQKK-UHFFFAOYSA-N	389.162708226							108124
AC1M2Q5N	LSM-19502	BRD-K30865566	2122466	InChI=1S/C16H12Cl2N4OS/c1-10-13(9-19-20-16(23)14-6-3-7-24-14)15(18)22(21-10)12-5-2-4-11(17)8-12/h2-9H,1H3,(H,20,23)	BQZUSOLVZDVNQF-UHFFFAOYSA-N	Cc1nn(c(Cl)c1C=NNC(=O)c2cccs2)c3cccc(Cl)c3	BroadT	BRD-K30865566	BRD-K30865566-001-05-0	Enamine Ltd.	T5249399			Cc1nn(c(Cl)c1C=NNC(=O)c1cccs1)-c1cccc(Cl)c1	InChI=1S/C16H12Cl2N4OS/c1-10-13(9-19-20-16(23)14-6-3-7-24-14)15(18)22(21-10)12-5-2-4-11(17)8-12/h2-9H,1H3,(H,20,23)	BQZUSOLVZDVNQF-UHFFFAOYSA-N	378.010887154							108125
MLS000576337	LSM-19503	BRD-K56381552, SID17414888	1295868	InChI=1S/C16H13Cl2NO4/c1-2-23-14-11(17)7-9(8-12(14)18)15(20)19-13-6-4-3-5-10(13)16(21)22/h3-8H,2H2,1H3,(H,19,20)(H,21,22)	FHFFZQVWNMAMDH-UHFFFAOYSA-N	CCOc1c(Cl)cc(cc1Cl)C(=O)Nc2ccccc2C(=O)O	BroadT	BRD-K56381552	BRD-K56381552-001-05-3	ChemBridge Corporation	7321782			CCOc1c(Cl)cc(cc1Cl)C(=O)Nc1ccccc1C(O)=O	InChI=1S/C16H13Cl2NO4/c1-2-23-14-11(17)7-9(8-12(14)18)15(20)19-13-6-4-3-5-10(13)16(21)22/h3-8H,2H2,1H3,(H,19,20)(H,21,22)	FHFFZQVWNMAMDH-UHFFFAOYSA-N	353.022163326							108126
SMR000236143	LSM-19504	BRD-K75506133, SID17514767	4460664	InChI=1S/C19H14ClN3O2S/c20-13-6-8-14(9-7-13)25-12-17(24)22-19-18(15-4-3-11-26-15)21-16-5-1-2-10-23(16)19/h1-11H,12H2,(H,22,24)	ORMCSTJORVCAJC-UHFFFAOYSA-N	Clc1ccc(OCC(=O)Nc2c(nc3ccccn23)c4cccs4)cc1	BroadT	BRD-K75506133	BRD-K75506133-001-05-0	Life Chemicals Inc.	F0589-0299			Clc1ccc(OCC(=O)Nc2c(nc3ccccn23)-c2cccs2)cc1	InChI=1S/C19H14ClN3O2S/c20-13-6-8-14(9-7-13)25-12-17(24)22-19-18(15-4-3-11-26-15)21-16-5-1-2-10-23(16)19/h1-11H,12H2,(H,22,24)	ORMCSTJORVCAJC-UHFFFAOYSA-N	383.049525118							108127
T5344332	LSM-19505	SID14744678, BRD-K10191318	2564280	InChI=1S/C15H9FN2O3/c16-10-2-1-3-11(8-10)21-15-5-4-14(18(19)20)13-9-17-7-6-12(13)15/h1-9H	UBIKCGCGHYJMJW-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(Oc2cccc(F)c2)c3ccncc13	BroadT	BRD-K10191318	BRD-K10191318-001-06-4	Enamine Ltd.	T5344332			[O-][N+](=O)c1ccc(Oc2cccc(F)c2)c2ccncc12	InChI=1S/C15H9FN2O3/c16-10-2-1-3-11(8-10)21-15-5-4-14(18(19)20)13-9-17-7-6-12(13)15/h1-9H	UBIKCGCGHYJMJW-UHFFFAOYSA-N	284.059720368							108128
SMR000136669	LSM-19506	BRD-K02241673, SID14734903	2008989	InChI=1S/C23H24N6O4S2/c1-4-29-21(17-8-6-5-7-9-17)25-26-23(29)34-14-20(30)24-18-10-12-19(13-11-18)35(31,32)28-22-15(2)16(3)27-33-22/h5-13,28H,4,14H2,1-3H3,(H,24,30)	JSGBABXJWJRSCY-UHFFFAOYSA-N	CCn1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)Nc3onc(C)c3C)nnc1c4ccccc4	BroadT	BRD-K02241673	BRD-K02241673-001-05-8	ChemBridge Corporation	7659898			CCn1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)Nc2onc(C)c2C)nnc1-c1ccccc1	InChI=1S/C23H24N6O4S2/c1-4-29-21(17-8-6-5-7-9-17)25-26-23(29)34-14-20(30)24-18-10-12-19(13-11-18)35(31,32)28-22-15(2)16(3)27-33-22/h5-13,28H,4,14H2,1-3H3,(H,24,30)	JSGBABXJWJRSCY-UHFFFAOYSA-N	512.130044688							108129
MLS000050654	LSM-19507	BRD-K18334106, SID4262836	973685	InChI=1S/C15H14ClN3S/c1-2-19-13-6-4-3-5-12(13)18-15(19)20-14-8-7-10(17)9-11(14)16/h3-9H,2,17H2,1H3	FDLVLPJOYWAMMU-UHFFFAOYSA-N	CCn1c(Sc2ccc(N)cc2Cl)nc3ccccc13	BroadT	BRD-K18334106	BRD-K18334106-001-05-0	ChemBridge Corporation	7903645			CCn1c(Sc2ccc(N)cc2Cl)nc2ccccc12	InChI=1S/C15H14ClN3S/c1-2-19-13-6-4-3-5-12(13)18-15(19)20-14-8-7-10(17)9-11(14)16/h3-9H,2,17H2,1H3	FDLVLPJOYWAMMU-UHFFFAOYSA-N	303.059695878							108130
CID 40546775	LSM-19508	BRD-A20463452	40546775	InChI=1S/C19H17N3O3/c1-24-17-8-7-12(10-18(17)25-2)9-16(23)13(11-20)19-21-14-5-3-4-6-15(14)22-19/h3-8,10,13H,9H2,1-2H3,(H,21,22)	YABKZGMDARWCEV-UHFFFAOYSA-N	COc1ccc(CC(=O)C(C#N)c2nc3ccccc3[nH]2)cc1OC	BroadT	BRD-A20463452	BRD-A20463452-001-05-5	ChemBridge Corporation	6062722			COc1ccc(CC(=O)C(C#N)c2nc3ccccc3[nH]2)cc1OC	InChI=1S/C19H17N3O3/c1-24-17-8-7-12(10-18(17)25-2)9-16(23)13(11-20)19-21-14-5-3-4-6-15(14)22-19/h3-8,10,13H,9H2,1-2H3,(H,21,22)	YABKZGMDARWCEV-UHFFFAOYSA-N	335.126991434							108131
MLS000772430	LSM-19509	BRD-A48228341, SID24835094	16196714	InChI=1S/C16H21N3O4S/c1-3-23-12-6-4-11(5-7-12)17-14(20)10-19-15(21)13(8-9-24-2)18-16(19)22/h4-7,13H,3,8-10H2,1-2H3,(H,17,20)(H,18,22)	FYWBITYCXWJRFZ-UHFFFAOYSA-N	CCOc1ccc(NC(=O)CN2C(=O)NC(CCSC)C2=O)cc1	BroadT	BRD-A48228341	BRD-A48228341-001-06-3	Enamine Ltd.	T5327850			CCOc1ccc(NC(=O)CN2C(=O)NC(CCSC)C2=O)cc1	InChI=1S/C16H21N3O4S/c1-3-23-12-6-4-11(5-7-12)17-14(20)10-19-15(21)13(8-9-24-2)18-16(19)22/h4-7,13H,3,8-10H2,1-2H3,(H,17,20)(H,18,22)	FYWBITYCXWJRFZ-UHFFFAOYSA-N	351.125276872							108132
SMR000212208	LSM-43841	BRD-K10684867, SID17511895	1922012	InChI=1S/C13H17NO7S/c1-20-10-7-9(3-4-12(16)17)8-11(13(10)21-2)22(18,19)14-5-6-15/h3-4,7-8,14-15H,5-6H2,1-2H3,(H,16,17)/b4-3+	UYHIQEDZRDRQEH-ONEGZZNKSA-N	COc1cc(\C=C\C(=O)O)cc(c1OC)S(=O)(=O)NCCO	BroadT	BRD-K10684867	BRD-K10684867-001-05-5	InterBioScreen Ltd.	STOCK2S-47136			COc1cc(cc(c1OC)S(=O)(=O)NCCO)\C=C\C(O)=O	InChI=1S/C13H17NO7S/c1-20-10-7-9(3-4-12(16)17)8-11(13(10)21-2)22(18,19)14-5-6-15/h3-4,7-8,14-15H,5-6H2,1-2H3,(H,16,17)/b4-3+	UYHIQEDZRDRQEH-ONEGZZNKSA-N	331.072572584							
2-[(Z)-(3-nitrophenyl)methylidene]-3-quinuclidinone	LSM-43842	BRD-K19702946, SID17506070	763526	InChI=1S/C14H14N2O3/c17-14-11-4-6-15(7-5-11)13(14)9-10-2-1-3-12(8-10)16(18)19/h1-3,8-9,11H,4-7H2/b13-9-	OTLZCUTYLMWZKH-LCYFTJDESA-N	[O-][N+](=O)c1cccc(\C=C\2/N3CCC(CC3)C2=O)c1	BroadT	BRD-K19702946	BRD-K19702946-001-06-9	InterBioScreen Ltd.	STOCK2S-34804			[O-][N+](=O)c1cccc(c1)\C=C1/N2CCC(CC2)C1=O	InChI=1S/C14H14N2O3/c17-14-11-4-6-15(7-5-11)13(14)9-10-2-1-3-12(8-10)16(18)19/h1-3,8-9,11H,4-7H2/b13-9-	OTLZCUTYLMWZKH-LCYFTJDESA-N	258.100442328							
ASN 06934834	LSM-19512	SID24787440, BRD-A19962819	3226016	InChI=1S/C18H23N3O3/c1-3-6-16(22)21-10-5-8-14(12-21)18-19-17(20-24-18)13-7-4-9-15(11-13)23-2/h4,7,9,11,14H,3,5-6,8,10,12H2,1-2H3	AZXOIXAUZOELAK-UHFFFAOYSA-N	CCCC(=O)N1CCCC(C1)c2onc(n2)c3cccc(OC)c3	BroadT	BRD-A19962819	BRD-A19962819-001-05-7	Asinex Ltd.	ASN 06934834			CCCC(=O)N1CCCC(C1)c1nc(no1)-c1cccc(OC)c1	InChI=1S/C18H23N3O3/c1-3-6-16(22)21-10-5-8-14(12-21)18-19-17(20-24-18)13-7-4-9-15(11-13)23-2/h4,7,9,11,14H,3,5-6,8,10,12H2,1-2H3	AZXOIXAUZOELAK-UHFFFAOYSA-N	329.173941626							108135
MLS000537273	LSM-19513	BRD-K38118311, SID14735174	1853048	InChI=1S/C25H23N3O4/c1-16-8-11-18(12-9-16)32-15-23(29)26-21-14-17(10-13-22(21)31-3)24-19-6-4-5-7-20(19)25(30)28(2)27-24/h4-14H,15H2,1-3H3,(H,26,29)	NRFRKRXQLASGDG-UHFFFAOYSA-N	COc1ccc(cc1NC(=O)COc2ccc(C)cc2)C3=NN(C)C(=O)c4ccccc34	BroadT	BRD-K38118311	BRD-K38118311-001-06-2	ChemBridge Corporation	7538327			COc1ccc(cc1NC(=O)COc1ccc(C)cc1)-c1nn(C)c(=O)c2ccccc12	InChI=1S/C25H23N3O4/c1-16-8-11-18(12-9-16)32-15-23(29)26-21-14-17(10-13-22(21)31-3)24-19-6-4-5-7-20(19)25(30)28(2)27-24/h4-14H,15H2,1-3H3,(H,26,29)	NRFRKRXQLASGDG-UHFFFAOYSA-N	429.168856246							108136
MLS000120963	LSM-19514	BRD-A80723361, SID14720958	3148600	InChI=1S/C25H28N2O3/c28-23(26-17-15-20(18-26)19-10-4-3-5-11-19)14-6-1-2-9-16-27-24(29)21-12-7-8-13-22(21)25(27)30/h3-5,7-8,10-13,20H,1-2,6,9,14-18H2	OIIQPABANDREIT-UHFFFAOYSA-N	O=C(CCCCCCN1C(=O)c2ccccc2C1=O)N3CCC(C3)c4ccccc4	BroadT	BRD-A80723361	BRD-A80723361-001-06-7	Asinex Ltd.	BAS 03775057			O=C(CCCCCCN1C(=O)c2ccccc2C1=O)N1CCC(C1)c1ccccc1	InChI=1S/C25H28N2O3/c28-23(26-17-15-20(18-26)19-10-4-3-5-11-19)14-6-1-2-9-16-27-24(29)21-12-7-8-13-22(21)25(27)30/h3-5,7-8,10-13,20H,1-2,6,9,14-18H2	OIIQPABANDREIT-UHFFFAOYSA-N	404.209992776							108137
Dibenzalazine	LSM-19515	BRD-K81954791	92130	InChI=1S/C14H12N2/c1-3-7-13(8-4-1)11-15-16-12-14-9-5-2-6-10-14/h1-12H	CWLGEPSKQDNHIO-UHFFFAOYSA-N	C(=NN=Cc1ccccc1)c2ccccc2	BroadT	BRD-K81954791	BRD-K81954791-001-05-7	Enamine Ltd.	T0512-1998			C(=NN=Cc1ccccc1)c1ccccc1	InChI=1S/C14H12N2/c1-3-7-13(8-4-1)11-15-16-12-14-9-5-2-6-10-14/h1-12H	CWLGEPSKQDNHIO-UHFFFAOYSA-N	208.100048404							108138
MLS000556539	LSM-19516	BRD-A41208012, SID14742028	4352236	InChI=1S/C17H19N5O2/c1-23-13-6-4-12(5-7-13)22-17-15(10-21-22)16(19-11-20-17)18-9-14-3-2-8-24-14/h4-7,10-11,14H,2-3,8-9H2,1H3,(H,18,19,20)	TWVZCOKLWZPBHA-UHFFFAOYSA-N	COc1ccc(cc1)n2ncc3c(NCC4CCCO4)ncnc23	BroadT	BRD-A41208012	BRD-A41208012-001-05-2	InterBioScreen Ltd.	STOCK3S-40589			COc1ccc(cc1)-n1ncc2c(NCC3CCCO3)ncnc12	InChI=1S/C17H19N5O2/c1-23-13-6-4-12(5-7-13)22-17-15(10-21-22)16(19-11-20-17)18-9-14-3-2-8-24-14/h4-7,10-11,14H,2-3,8-9H2,1H3,(H,18,19,20)	TWVZCOKLWZPBHA-UHFFFAOYSA-N	325.153874898							108139
SMR000193514	LSM-19517	SID17412762, BRD-A40010674	3695590	InChI=1S/C13H16N4O4/c1-8-6-12(19)15-16-13(8)9-2-3-10(14-4-5-18)11(7-9)17(20)21/h2-3,7-8,14,18H,4-6H2,1H3,(H,15,19)	RCDCUPNJOXNWIQ-UHFFFAOYSA-N	CC1CC(=O)NN=C1c2ccc(NCCO)c(c2)[N+](=O)[O-]	BroadT	BRD-A40010674	BRD-A40010674-001-06-0	ChemBridge Corporation	5884536			CC1CC(=O)NN=C1c1ccc(NCCO)c(c1)[N+]([O-])=O	InChI=1S/C13H16N4O4/c1-8-6-12(19)15-16-13(8)9-2-3-10(14-4-5-18)11(7-9)17(20)21/h2-3,7-8,14,18H,4-6H2,1H3,(H,15,19)	RCDCUPNJOXNWIQ-UHFFFAOYSA-N	292.117155032							108140
MLS000766351	LSM-19518	BRD-K56013842, SID24824920	16195833	InChI=1S/C22H26O5S/c1-3-12-26-21(24)19-13-17(16(9-7-11-23)22(27-19)25-4-2)18-14-28-20-10-6-5-8-15(18)20/h3,5-6,8,10,13-14,16-17,22-23H,1,4,7,9,11-12H2,2H3/t16-,17+,22-/m1/s1	ZTJMBAUUSGXQHO-HYFFOGBASA-N	CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2csc3ccccc23)C(=O)OCC=C	BroadT	BRD-K56013842	BRD-K56013842-001-06-0	Harvard University	(2R,3R,4S)-allyl 4-(benzo[b]thiophen-3-yl)-2-ethoxy-3-(3-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxylate DHPC11_000737			CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c1csc2ccccc12)C(=O)OCC=C	InChI=1S/C22H26O5S/c1-3-12-26-21(24)19-13-17(16(9-7-11-23)22(27-19)25-4-2)18-14-28-20-10-6-5-8-15(18)20/h3,5-6,8,10,13-14,16-17,22-23H,1,4,7,9,11-12H2,2H3/t16-,17+,22-/m1/s1	ZTJMBAUUSGXQHO-HYFFOGBASA-N	402.150094622							108141
ST50708106	LSM-19519	BRD-K17574409, SID24803625	1068704	InChI=1S/C15H12ClF3N4O2/c1-7(2)20-14(24)12-11(16)13-21-8(9-4-3-5-25-9)6-10(15(17,18)19)23(13)22-12/h3-7H,1-2H3,(H,20,24)	QKXKUIAPPYXYNS-UHFFFAOYSA-N	CC(C)NC(=O)c1nn2c(cc(nc2c1Cl)c3occc3)C(F)(F)F	BroadT	BRD-K17574409	BRD-K17574409-001-05-6	Asinex Ltd.	BAS 01058448			CC(C)NC(=O)c1nn2c(cc(nc2c1Cl)-c1ccco1)C(F)(F)F	InChI=1S/C15H12ClF3N4O2/c1-7(2)20-14(24)12-11(16)13-21-8(9-4-3-5-25-9)6-10(15(17,18)19)23(13)22-12/h3-7H,1-2H3,(H,20,24)	QKXKUIAPPYXYNS-UHFFFAOYSA-N	372.060087974							108142
SMR000161134	LSM-19520	BRD-K83603369, SID17387076	1009410	InChI=1S/C20H20Cl2N4OS/c21-17-7-6-15(12-18(17)22)14-28-20-24-23-19(13-25-8-10-27-11-9-25)26(20)16-4-2-1-3-5-16/h1-7,12H,8-11,13-14H2	NCTPFNXFPVJBQH-UHFFFAOYSA-N	Clc1ccc(CSc2nnc(CN3CCOCC3)n2c4ccccc4)cc1Cl	BroadT	BRD-K83603369	BRD-K83603369-001-06-8	Specs	AN-988/42560109			Clc1ccc(CSc2nnc(CN3CCOCC3)n2-c2ccccc2)cc1Cl	InChI=1S/C20H20Cl2N4OS/c21-17-7-6-15(12-18(17)22)14-28-20-24-23-19(13-25-8-10-27-11-9-25)26(20)16-4-2-1-3-5-16/h1-7,12H,8-11,13-14H2	NCTPFNXFPVJBQH-UHFFFAOYSA-N	434.07348741							108143
ST50221112	LSM-43843	BRD-K27949240, SID14727022	2251001	InChI=1S/C15H9Cl2N3O2/c16-10-1-3-13-12(5-10)20-15(22-13)9(8-21)6-18-14-4-2-11(17)7-19-14/h1-8H,(H,18,19)/b9-6+	PSKHPGPCXWEARR-RMKNXTFCSA-N	Clc1ccc(N\C=C(/C=O)\c2oc3ccc(Cl)cc3n2)nc1	BroadT	BRD-K27949240	BRD-K27949240-001-05-1	Asinex Ltd.	BAS 00285301			Clc1ccc(N\C=C(/C=O)c2nc3cc(Cl)ccc3o2)nc1	InChI=1S/C15H9Cl2N3O2/c16-10-1-3-13-12(5-10)20-15(22-13)9(8-21)6-18-14-4-2-11(17)7-19-14/h1-8H,(H,18,19)/b9-6+	PSKHPGPCXWEARR-RMKNXTFCSA-N	333.007181978							
MLS000095499	LSM-19522	SID4246703, BRD-K10211218	3241011	InChI=1S/C14H18ClN3OS/c1-3-17(4-2)7-8-18-13(19)11-9-10(15)5-6-12(11)16-14(18)20/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,20)	RQVWKVOCNDMZNH-UHFFFAOYSA-N	CCN(CC)CCN1C(=S)Nc2ccc(Cl)cc2C1=O	BroadT	BRD-K10211218	BRD-K10211218-001-05-3	ChemDiv Inc.	K287-0549			CCN(CC)CCn1c(=S)[nH]c2ccc(Cl)cc2c1=O	InChI=1S/C14H18ClN3OS/c1-3-17(4-2)7-8-18-13(19)11-9-10(15)5-6-12(11)16-14(18)20/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,20)	RQVWKVOCNDMZNH-UHFFFAOYSA-N	311.085910626							108145
1,4-Bis(thiophen-2-ylsulfonyl)piperazine	LSM-4539	SID24803082, BRD-K12918607	1034118	InChI=1S/C12H14N2O4S4/c15-21(16,11-3-1-9-19-11)13-5-7-14(8-6-13)22(17,18)12-4-2-10-20-12/h1-4,9-10H,5-8H2	NEPNMHLSBDWWTD-UHFFFAOYSA-N	O=S(=O)(N1CCN(CC1)S(=O)(=O)c2cccs2)c3cccs3	BroadT	BRD-K12918607	BRD-K12918607-001-05-0	ChemBridge Corporation	7123394			O=S(=O)(N1CCN(CC1)S(=O)(=O)c1cccs1)c1cccs1	InChI=1S/C12H14N2O4S4/c15-21(16,11-3-1-9-19-11)13-5-7-14(8-6-13)22(17,18)12-4-2-10-20-12/h1-4,9-10H,5-8H2	NEPNMHLSBDWWTD-UHFFFAOYSA-N	377.983639708							93958
BAS 01076342	LSM-19523	BRD-K35848924, SID24786865	778488	InChI=1S/C11H12ClN5O2S/c1-7-6-10(16-13)15-11(14-7)17-20(18,19)9-4-2-8(12)3-5-9/h2-6H,13H2,1H3,(H2,14,15,16,17)	BZLBBDGMWGUXOS-UHFFFAOYSA-N	Cc1cc(NN)nc(NS(=O)(=O)c2ccc(Cl)cc2)n1	BroadT	BRD-K35848924	BRD-K35848924-001-05-8	Asinex Ltd.	BAS 01076342			Cc1cc(NN)nc(NS(=O)(=O)c2ccc(Cl)cc2)n1	InChI=1S/C11H12ClN5O2S/c1-7-6-10(16-13)15-11(14-7)17-20(18,19)9-4-2-8(12)3-5-9/h2-6H,13H2,1H3,(H2,14,15,16,17)	BZLBBDGMWGUXOS-UHFFFAOYSA-N	313.040023074							108146
ST50056730	LSM-19524	BRD-K91148820, SID4243824	3238504	InChI=1S/C18H20N2O2/c1-14-7-9-15(10-8-14)22-13-18-19-16-5-3-4-6-17(16)20(18)11-12-21-2/h3-10H,11-13H2,1-2H3	IJMQQIJXAOPUNQ-UHFFFAOYSA-N	COCCn1c(COc2ccc(C)cc2)nc3ccccc13	BroadT	BRD-K91148820	BRD-K91148820-001-05-9	ChemDiv Inc.	7287-0007			COCCn1c(COc2ccc(C)cc2)nc2ccccc12	InChI=1S/C18H20N2O2/c1-14-7-9-15(10-8-14)22-13-18-19-16-5-3-4-6-17(16)20(18)11-12-21-2/h3-10H,11-13H2,1-2H3	IJMQQIJXAOPUNQ-UHFFFAOYSA-N	296.1524779							108147
SMR000060700	LSM-19525	BRD-A03121430, SID3711189	2997536	InChI=1S/C17H14O2S2/c18-14(15-8-4-10-19-15)12-17(16-9-5-11-20-16)21-13-6-2-1-3-7-13/h1-11,17H,12H2	RHLBDJJJWVVUOQ-UHFFFAOYSA-N	O=C(CC(Sc1ccccc1)c2cccs2)c3occc3	BroadT	BRD-A03121430	BRD-A03121430-001-05-7	Enamine Ltd.	T0504-4919			O=C(CC(Sc1ccccc1)c1cccs1)c1ccco1	InChI=1S/C17H14O2S2/c18-14(15-8-4-10-19-15)12-17(16-9-5-11-20-16)21-13-6-2-1-3-7-13/h1-11,17H,12H2	RHLBDJJJWVVUOQ-UHFFFAOYSA-N	314.043521068							108148
AC1LJ7P2	LSM-19526	BRD-K21313369	918470	InChI=1S/C16H17N5O/c1-13-2-4-15(5-3-13)21-16(14(10-17)11-19-21)18-12-20-6-8-22-9-7-20/h2-5,11-12H,6-9H2,1H3	JTYCUTQDCSENAQ-UHFFFAOYSA-N	Cc1ccc(cc1)n2ncc(C#N)c2N=CN3CCOCC3	BroadT	BRD-K21313369	BRD-K21313369-001-05-1	ChemBridge Corporation	7721999			Cc1ccc(cc1)-n1ncc(C#N)c1N=CN1CCOCC1	InChI=1S/C16H17N5O/c1-13-2-4-15(5-3-13)21-16(14(10-17)11-19-21)18-12-20-6-8-22-9-7-20/h2-5,11-12H,6-9H2,1H3	JTYCUTQDCSENAQ-UHFFFAOYSA-N	295.143310214							108149
SMR000076859	LSM-19527	BRD-K49292348, SID4262669	2117010	InChI=1S/C17H15BrF3N3O2/c18-13-7-11(9-22-10-13)16(25)23-14-8-12(17(19,20)21)1-2-15(14)24-3-5-26-6-4-24/h1-2,7-10H,3-6H2,(H,23,25)	MGBRLXRWGJGUPU-UHFFFAOYSA-N	FC(F)(F)c1ccc(N2CCOCC2)c(NC(=O)c3cncc(Br)c3)c1	BroadT	BRD-K49292348	BRD-K49292348-001-05-1	ChemBridge Corporation	7809326			FC(F)(F)c1ccc(N2CCOCC2)c(NC(=O)c2cncc(Br)c2)c1	InChI=1S/C17H15BrF3N3O2/c18-13-7-11(9-22-10-13)16(25)23-14-8-12(17(19,20)21)1-2-15(14)24-3-5-26-6-4-24/h1-2,7-10H,3-6H2,(H,23,25)	MGBRLXRWGJGUPU-UHFFFAOYSA-N	429.02997395							108150
AC1LFRBG	LSM-19528	BRD-K21678546	807597	InChI=1S/C14H11ClFNO2/c15-12-7-10(8-17-18)5-6-14(12)19-9-11-3-1-2-4-13(11)16/h1-8,18H,9H2	XSTRSHVVFZMLFQ-UHFFFAOYSA-N	ON=Cc1ccc(OCc2ccccc2F)c(Cl)c1	BroadT	BRD-K21678546	BRD-K21678546-001-05-3	ChemBridge Corporation	6809182			ON=Cc1ccc(OCc2ccccc2F)c(Cl)c1	InChI=1S/C14H11ClFNO2/c15-12-7-10(8-17-18)5-6-14(12)19-9-11-3-1-2-4-13(11)16/h1-8,18H,9H2	XSTRSHVVFZMLFQ-UHFFFAOYSA-N	279.046234512							108151
AN-329/41328605	LSM-19529	BRD-K51490301, SID22402625	1013803	InChI=1S/C20H23N3O4/c1-4-18(24)21-16-9-7-15(8-10-16)20(26)23-22-19(25)12-27-17-11-13(2)5-6-14(17)3/h5-11H,4,12H2,1-3H3,(H,21,24)(H,22,25)(H,23,26)	MTIUZLUDUGVTIW-UHFFFAOYSA-N	CCC(=O)Nc1ccc(cc1)C(=O)NNC(=O)COc2cc(C)ccc2C	BroadT	BRD-K51490301	BRD-K51490301-001-05-1	Specs	AN-329/41328605			CCC(=O)Nc1ccc(cc1)C(=O)NNC(=O)COc1cc(C)ccc1C	InChI=1S/C20H23N3O4/c1-4-18(24)21-16-9-7-15(8-10-16)20(26)23-22-19(25)12-27-17-11-13(2)5-6-14(17)3/h5-11H,4,12H2,1-3H3,(H,21,24)(H,22,25)(H,23,26)	MTIUZLUDUGVTIW-UHFFFAOYSA-N	369.168856246							108152
BAS 08940329	LSM-19530	BRD-A99445203, SID844405	646731	InChI=1S/C18H18ClN3O6/c1-8-15(18(24)26-3)16(10(6-20)17(22)28-8)9-4-12(25-2)13(5-11(9)19)27-7-14(21)23/h4-5,16H,7,22H2,1-3H3,(H2,21,23)	AMTUZINQWIIGLW-UHFFFAOYSA-N	COC(=O)C1=C(C)OC(=C(C#N)C1c2cc(OC)c(OCC(=O)N)cc2Cl)N	BroadT	BRD-A99445203	BRD-A99445203-001-06-8	Asinex Ltd.	BAS 08940329			COC(=O)C1=C(C)OC(N)=C(C#N)C1c1cc(OC)c(OCC(N)=O)cc1Cl	InChI=1S/C18H18ClN3O6/c1-8-15(18(24)26-3)16(10(6-20)17(22)28-8)9-4-12(25-2)13(5-11(9)19)27-7-14(21)23/h4-5,16H,7,22H2,1-3H3,(H2,21,23)	AMTUZINQWIIGLW-UHFFFAOYSA-N	407.088413036							108153
ST50631159	LSM-19531	SID17433359, BRD-K49584663	2939992	InChI=1S/C18H19N3O5/c1-11(2)17(22)19-13-6-4-5-12(9-13)18(23)20-15-8-7-14(26-3)10-16(15)21(24)25/h4-11H,1-3H3,(H,19,22)(H,20,23)	LWQGHDIWAWMBHP-UHFFFAOYSA-N	COc1ccc(NC(=O)c2cccc(NC(=O)C(C)C)c2)c(c1)[N+](=O)[O-]	BroadT	BRD-K49584663	BRD-K49584663-001-05-8	ChemBridge Corporation	7449145			COc1ccc(NC(=O)c2cccc(NC(=O)C(C)C)c2)c(c1)[N+]([O-])=O	InChI=1S/C18H19N3O5/c1-11(2)17(22)19-13-6-4-5-12(9-13)18(23)20-15-8-7-14(26-3)10-16(15)21(24)25/h4-11H,1-3H3,(H,19,22)(H,20,23)	LWQGHDIWAWMBHP-UHFFFAOYSA-N	357.132470738							108154
ZINC02620972	LSM-19532	BRD-K22812176, SID24824686	2082857	InChI=1S/C14H9ClFN3O2/c15-11-7-9(16)5-6-13(11)21-8-19-14(20)10-3-1-2-4-12(10)17-18-19/h1-7H,8H2	KSGSVAVYHGQEJB-UHFFFAOYSA-N	Fc1ccc(OCN2N=Nc3ccccc3C2=O)c(Cl)c1	BroadT	BRD-K22812176	BRD-K22812176-001-05-4	Enamine Ltd.	T5274085			Fc1ccc(OCn2nnc3ccccc3c2=O)c(Cl)c1	InChI=1S/C14H9ClFN3O2/c15-11-7-9(16)5-6-13(11)21-8-19-14(20)10-3-1-2-4-12(10)17-18-19/h1-7H,8H2	KSGSVAVYHGQEJB-UHFFFAOYSA-N	305.036732468							108155
CBDIVE_015655	LSM-19533	BRD-K96758498	724426	InChI=1S/C14H11FN2O/c15-13-8-6-11(7-9-13)10-16-17-14(18)12-4-2-1-3-5-12/h1-10H,(H,17,18)	DQYNLPXKASWMSL-UHFFFAOYSA-N	Fc1ccc(C=NNC(=O)c2ccccc2)cc1	BroadT	BRD-K96758498	BRD-K96758498-001-05-1	ChemDiv Inc.	8003-6181			Fc1ccc(cc1)C=NNC(=O)c1ccccc1	InChI=1S/C14H11FN2O/c15-13-8-6-11(7-9-13)10-16-17-14(18)12-4-2-1-3-5-12/h1-10H,(H,17,18)	DQYNLPXKASWMSL-UHFFFAOYSA-N	242.085541192							108156
AH-487/41729719	LSM-19534	BRD-K22701871, SID4264950	1005513	InChI=1S/C14H16ClF3N2O3S/c1-24(22,23)20-6-4-9(5-7-20)13(21)19-12-8-10(14(16,17)18)2-3-11(12)15/h2-3,8-9H,4-7H2,1H3,(H,19,21)	LPUZQJZCNFPGJC-UHFFFAOYSA-N	CS(=O)(=O)N1CCC(CC1)C(=O)Nc2cc(ccc2Cl)C(F)(F)F	BroadT	BRD-K22701871	BRD-K22701871-001-05-7	ChemBridge Corporation	7583204			CS(=O)(=O)N1CCC(CC1)C(=O)Nc1cc(ccc1Cl)C(F)(F)F	InChI=1S/C14H16ClF3N2O3S/c1-24(22,23)20-6-4-9(5-7-20)13(21)19-12-8-10(14(16,17)18)2-3-11(12)15/h2-3,8-9H,4-7H2,1H3,(H,19,21)	LPUZQJZCNFPGJC-UHFFFAOYSA-N	384.052225392							108157
AC1MH0XQ	LSM-15292	BRD-K80332123	2994656	InChI=1S/C16H15ClN2O/c17-16-14-5-2-1-4-13(14)6-7-15(16)20-11-3-9-19-10-8-18-12-19/h1-2,4-8,10,12H,3,9,11H2	GTIQSTLOVFXLMS-UHFFFAOYSA-N	Clc1c(OCCCn2ccnc2)ccc3ccccc13	BroadT	BRD-K80332123	BRD-K80332123-003-06-0	ChemBridge Corporation	9011314		Cl	Clc1c(OCCCn2ccnc2)ccc2ccccc12.Cl	InChI=1S/C16H15ClN2O.ClH/c17-16-14-5-2-1-4-13(14)6-7-15(16)20-11-3-9-19-10-8-18-12-19;/h1-2,4-8,10,12H,3,9,11H2;1H	ILTMASYAXPTCHC-UHFFFAOYSA-N	286.08729083							103939, 103939
MLS000093363	LSM-19535	BRD-K44103530	3241279	InChI=1S/C20H25N3O4/c1-3-13-6-5-7-15(12-13)22-17-16(18(24)19(17)25)21-14-8-10-23(11-9-14)20(26)27-4-2/h5-7,12,14,24-25H,3-4,8-11H2,1-2H3	QRWUIECHDMPYQU-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)N=C2C(=C(O)C2=Nc3cccc(CC)c3)O	BroadT	BRD-K44103530	BRD-K44103530-001-05-3	ChemDiv Inc.	C748-0168			CCOC(=O)N1CCC(CC1)N=c1c(O)c(O)c1=Nc1cccc(CC)c1	InChI=1S/C20H25N3O4/c1-3-13-6-5-7-15(12-13)22-17-16(18(24)19(17)25)21-14-8-10-23(11-9-14)20(26)27-4-2/h5-7,12,14,24-25H,3-4,8-11H2,1-2H3	QRWUIECHDMPYQU-UHFFFAOYSA-N	371.18450631							
SMR000073631	LSM-19536	BRD-K08723967, SID4255847	893707	InChI=1S/C16H18N2O4S/c1-18(23(2,20)21)14-8-6-7-13(11-14)17-16(19)12-22-15-9-4-3-5-10-15/h3-11H,12H2,1-2H3,(H,17,19)	WIIXNBWAIWINKE-UHFFFAOYSA-N	CN(c1cccc(NC(=O)COc2ccccc2)c1)S(=O)(=O)C	BroadT	BRD-K08723967	BRD-K08723967-001-06-2	ChemBridge Corporation	7590592			CN(c1cccc(NC(=O)COc2ccccc2)c1)S(C)(=O)=O	InChI=1S/C16H18N2O4S/c1-18(23(2,20)21)14-8-6-7-13(11-14)17-16(19)12-22-15-9-4-3-5-10-15/h3-11H,12H2,1-2H3,(H,17,19)	WIIXNBWAIWINKE-UHFFFAOYSA-N	334.098727766							108159
SMR000131319	LSM-19537	BRD-K71592817, SID14734218	4614130	InChI=1S/C20H18BrN3O4/c21-13-3-4-16-15(12-13)19(26)24-7-1-2-14(17(24)22-16)18(25)23-8-5-20(6-9-23)27-10-11-28-20/h1-4,7,12H,5-6,8-11H2	OOJANGFXTFGKRR-UHFFFAOYSA-N	Brc1ccc2N=C3N(C=CC=C3C(=O)N4CCC5(CC4)OCCO5)C(=O)c2c1	BroadT	BRD-K71592817	BRD-K71592817-001-06-5	ChemDiv Inc.	K306-0606			Brc1ccc2nc3c(cccn3c(=O)c2c1)C(=O)N1CCC2(CC1)OCCO2	InChI=1S/C20H18BrN3O4/c21-13-3-4-16-15(12-13)19(26)24-7-1-2-14(17(24)22-16)18(25)23-8-5-20(6-9-23)27-10-11-28-20/h1-4,7,12H,5-6,8-11H2	OOJANGFXTFGKRR-UHFFFAOYSA-N	443.048068686							108160
T5277845	LSM-19538	BRD-K17649115, SID22409221	4442236	InChI=1S/C19H23N3O5S/c1-27-16-6-4-15(5-7-16)10-11-20-18-9-8-17(14-19(18)22(23)24)28(25,26)21-12-2-3-13-21/h4-9,14,20H,2-3,10-13H2,1H3	OSZAJYODVQGSCR-UHFFFAOYSA-N	COc1ccc(CCNc2ccc(cc2[N+](=O)[O-])S(=O)(=O)N3CCCC3)cc1	BroadT	BRD-K17649115	BRD-K17649115-001-06-9	Enamine Ltd.	T5277845			COc1ccc(CCNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)N2CCCC2)cc1	InChI=1S/C19H23N3O5S/c1-27-16-6-4-15(5-7-16)10-11-20-18-9-8-17(14-19(18)22(23)24)28(25,26)21-12-2-3-13-21/h4-9,14,20H,2-3,10-13H2,1H3	OSZAJYODVQGSCR-UHFFFAOYSA-N	405.135841556							108161
AC1ME308	LSM-19539	BRD-A26165232	2847071	InChI=1S/C14H16N2O3/c17-11-6-7-12(13(18)8-11)14(19)16-15-9-10-4-2-1-3-5-10/h1-2,6-10,17-18H,3-5H2,(H,16,19)	FQESQADCJXWSJK-UHFFFAOYSA-N	Oc1ccc(C(=O)NN=CC2CCC=CC2)c(O)c1	BroadT	BRD-A26165232	BRD-A26165232-001-06-5	ChemBridge Corporation	5468578			Oc1ccc(C(=O)NN=CC2CCC=CC2)c(O)c1	InChI=1S/C14H16N2O3/c17-11-6-7-12(13(18)8-11)14(19)16-15-9-10-4-2-1-3-5-10/h1-2,6-10,17-18H,3-5H2,(H,16,19)	FQESQADCJXWSJK-UHFFFAOYSA-N	260.116092392							108162
F1673-1462	LSM-19540	SID4265156, BRD-K21969044	2182132	InChI=1S/C19H21NO2/c1-2-14-22-17-11-9-16(10-12-17)19(21)20-13-5-7-15-6-3-4-8-18(15)20/h3-4,6,8-12H,2,5,7,13-14H2,1H3	LJAXEKPJRFAIDW-UHFFFAOYSA-N	CCCOc1ccc(cc1)C(=O)N2CCCc3ccccc23	BroadT	BRD-K21969044	BRD-K21969044-001-05-3	ChemBridge Corporation	7322289			CCCOc1ccc(cc1)C(=O)N1CCCc2ccccc12	InChI=1S/C19H21NO2/c1-2-14-22-17-11-9-16(10-12-17)19(21)20-13-5-7-15-6-3-4-8-18(15)20/h3-4,6,8-12H,2,5,7,13-14H2,1H3	LJAXEKPJRFAIDW-UHFFFAOYSA-N	295.157228922							108163
STK208640	LSM-19541	BRD-K90956468, SID24783269	1266802	InChI=1S/C12H8FN5O2S2/c13-8-3-1-2-7(4-8)10-16-18-12(20-10)21-5-9(19)15-11-17-14-6-22-11/h1-4,6H,5H2,(H,15,17,19)	VEPLLMTXNHFDMM-UHFFFAOYSA-N	Fc1cccc(c1)c2oc(SCC(=O)Nc3nncs3)nn2	BroadT	BRD-K90956468	BRD-K90956468-001-05-3	ChemBridge Corporation	7938400			Fc1cccc(c1)-c1nnc(SCC(=O)Nc2nncs2)o1	InChI=1S/C12H8FN5O2S2/c13-8-3-1-2-7(4-8)10-16-18-12(20-10)21-5-9(19)15-11-17-14-6-22-11/h1-4,6H,5H2,(H,15,17,19)	VEPLLMTXNHFDMM-UHFFFAOYSA-N	337.010344126							108164
MLS000051733	LSM-19542	BRD-K32191695, SID4256297	2225369	InChI=1S/C19H22N2O3S/c22-17(14-7-5-11-24-14)21-19-16(18(23)20-12-9-10-12)13-6-3-1-2-4-8-15(13)25-19/h5,7,11-12H,1-4,6,8-10H2,(H,20,23)(H,21,22)	WAXNSAUEGUCFGA-UHFFFAOYSA-N	O=C(Nc1sc2CCCCCCc2c1C(=O)NC3CC3)c4occc4	BroadT	BRD-K32191695	BRD-K32191695-001-05-3	ChemBridge Corporation	7947465			O=C(Nc1sc2CCCCCCc2c1C(=O)NC1CC1)c1ccco1	InChI=1S/C19H22N2O3S/c22-17(14-7-5-11-24-14)21-19-16(18(23)20-12-9-10-12)13-6-3-1-2-4-8-15(13)25-19/h5,7,11-12H,1-4,6,8-10H2,(H,20,23)(H,21,22)	WAXNSAUEGUCFGA-UHFFFAOYSA-N	358.135113274							108165
MLS000098536	LSM-19543	BRD-A90450579, SID3713618	2998477	InChI=1S/C22H23N3O4S/c1-2-25(17-8-4-3-5-9-17)30(26,27)19-12-13-22(24-15-19)23-14-18-16-28-20-10-6-7-11-21(20)29-18/h3-13,15,18H,2,14,16H2,1H3,(H,23,24)	BAEWUJRANKALKZ-UHFFFAOYSA-N	CCN(c1ccccc1)S(=O)(=O)c2ccc(NCC3COc4ccccc4O3)nc2	BroadT	BRD-A90450579	BRD-A90450579-001-05-5	Enamine Ltd.	T5252474			CCN(c1ccccc1)S(=O)(=O)c1ccc(NCC2COc3ccccc3O2)nc1	InChI=1S/C22H23N3O4S/c1-2-25(17-8-4-3-5-9-17)30(26,27)19-12-13-22(24-15-19)23-14-18-16-28-20-10-6-7-11-21(20)29-18/h3-13,15,18H,2,14,16H2,1H3,(H,23,24)	BAEWUJRANKALKZ-UHFFFAOYSA-N	425.140926936							108166
2-(4-Amino-6-hydroxy-pyrimidin-2-ylsulfanyl)-1-(3,4-dimethyl-phenyl)-ethanone	LSM-19544	BRD-K49473928, SID49646741	3128451	InChI=1S/C14H15N3O2S/c1-8-3-4-10(5-9(8)2)11(18)7-20-14-16-12(15)6-13(19)17-14/h3-6H,7H2,1-2H3,(H3,15,16,17,19)	YJXSXTRKKLGQOJ-UHFFFAOYSA-N	Cc1ccc(cc1C)C(=O)CSc2nc(N)cc(O)n2	BroadT	BRD-K49473928	BRD-K49473928-001-05-5	Asinex Ltd.	BAS 01247513			Cc1ccc(cc1C)C(=O)CSc1nc(N)cc(O)n1	InChI=1S/C14H15N3O2S/c1-8-3-4-10(5-9(8)2)11(18)7-20-14-16-12(15)6-13(19)17-14/h3-6H,7H2,1-2H3,(H3,15,16,17,19)	YJXSXTRKKLGQOJ-UHFFFAOYSA-N	289.08849744							108167
ZINC00481288	LSM-19545	BRD-K39858575, SID22414260	901918	InChI=1S/C13H12ClN3O/c1-8-7-9(14)4-5-11(8)17-13-10(12(15)18)3-2-6-16-13/h2-7H,1H3,(H2,15,18)(H,16,17)	CQLNDXQKFYZEER-UHFFFAOYSA-N	Cc1cc(Cl)ccc1Nc2ncccc2C(=O)N	BroadT	BRD-K39858575	BRD-K39858575-001-05-5	Specs	AJ-333/13050046			Cc1cc(Cl)ccc1Nc1ncccc1C(N)=O	InChI=1S/C13H12ClN3O/c1-8-7-9(14)4-5-11(8)17-13-10(12(15)18)3-2-6-16-13/h2-7H,1H3,(H2,15,18)(H,16,17)	CQLNDXQKFYZEER-UHFFFAOYSA-N	261.066889744							108168
MLS000519325	LSM-15499	BRD-K38935430	4181844	InChI=1S/C19H21N2O6/c1-12-17(27-18(22)13-5-7-15(8-6-13)21(23)24)16-11-26-19(2,3)25-10-14(16)9-20(12)4/h5-9H,10-11H2,1-4H3/q+1	FTBMIQNGUUNURB-UHFFFAOYSA-N	Cc1c(OC(=O)c2ccc(cc2)[N+](=O)[O-])c3COC(C)(C)OCc3c[n+]1C	BroadT	BRD-K38935430	BRD-K38935430-005-05-8	ChemDiv Inc.	5858-0018		I	Cc1c(OC(=O)c2ccc(cc2)[N+]([O-])=O)c2COC(C)(C)OCc2c[n+]1C.I	InChI=1S/C19H21N2O6.HI/c1-12-17(27-18(22)13-5-7-15(8-6-13)21(23)24)16-11-26-19(2,3)25-10-14(16)9-20(12)4;/h5-9H,10-11H2,1-4H3;1H/q+1;	NHDXCNIPGVNLDM-UHFFFAOYSA-N	373.139961412							104140, 104140
SMR000073913	LSM-19546	BRD-K66541877, SID4255950	990849	InChI=1S/C22H19N3O2S/c26-21(23-14-19-12-7-13-27-19)16-28-22-24-15-20(17-8-3-1-4-9-17)25(22)18-10-5-2-6-11-18/h1-13,15H,14,16H2,(H,23,26)	FXKYZLLCTZOZEG-UHFFFAOYSA-N	O=C(CSc1ncc(c2ccccc2)n1c3ccccc3)NCc4occc4	BroadT	BRD-K66541877	BRD-K66541877-001-05-8	ChemBridge Corporation	7626048			O=C(CSc1ncc(-c2ccccc2)n1-c1ccccc1)NCc1ccco1	InChI=1S/C22H19N3O2S/c26-21(23-14-19-12-7-13-27-19)16-28-22-24-15-20(17-8-3-1-4-9-17)25(22)18-10-5-2-6-11-18/h1-13,15H,14,16H2,(H,23,26)	FXKYZLLCTZOZEG-UHFFFAOYSA-N	389.119797568							108169
ZINC02252571	LSM-19547	BRD-K45677957, SID22402606	1880576	InChI=1S/C16H12Cl2N4OS2/c17-11-3-1-10(2-4-11)9-24-16-22-21-15(25-16)20-14(23)19-13-7-5-12(18)6-8-13/h1-8H,9H2,(H2,19,20,21,23)	KWFAQDZOQHTQRN-UHFFFAOYSA-N	Clc1ccc(CSc2nnc(NC(=O)Nc3ccc(Cl)cc3)s2)cc1	BroadT	BRD-K45677957	BRD-K45677957-001-05-9	InterBioScreen Ltd.	STOCK3S-07835			Clc1ccc(CSc2nnc(NC(=O)Nc3ccc(Cl)cc3)s2)cc1	InChI=1S/C16H12Cl2N4OS2/c17-11-3-1-10(2-4-11)9-24-16-22-21-15(25-16)20-14(23)19-13-7-5-12(18)6-8-13/h1-8H,9H2,(H2,19,20,21,23)	KWFAQDZOQHTQRN-UHFFFAOYSA-N	409.982957844							108170
ST093470	LSM-19548	SID14732052, BRD-K92378241	972604	InChI=1S/C17H15NO3/c1-12-6-8-13(9-7-12)21-11-10-18-16(19)14-4-2-3-5-15(14)17(18)20/h2-9H,10-11H2,1H3	NOBUKRHMNLNIFS-UHFFFAOYSA-N	Cc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	BroadT	BRD-K92378241	BRD-K92378241-001-05-2	ChemBridge Corporation	7855865			Cc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	InChI=1S/C17H15NO3/c1-12-6-8-13(9-7-12)21-11-10-18-16(19)14-4-2-3-5-15(14)17(18)20/h2-9H,10-11H2,1H3	NOBUKRHMNLNIFS-UHFFFAOYSA-N	281.10519335							108171
SMR000109721	LSM-19549	BRD-A20305532, SID7977760	2930694	InChI=1S/C12H15N3O3S2/c1-2-19-12-15-14-11(20-12)13-9(16)7-5-3-4-6-8(7)10(17)18/h3-4,7-8H,2,5-6H2,1H3,(H,17,18)(H,13,14,16)	RFVBTVMRNXFBMX-UHFFFAOYSA-N	CCSc1nnc(NC(=O)C2CC=CCC2C(=O)O)s1	BroadT	BRD-A20305532	BRD-A20305532-001-06-0	ChemBridge Corporation	7222389			CCSc1nnc(NC(=O)C2CC=CCC2C(O)=O)s1	InChI=1S/C12H15N3O3S2/c1-2-19-12-15-14-11(20-12)13-9(16)7-5-3-4-6-8(7)10(17)18/h3-4,7-8H,2,5-6H2,1H3,(H,17,18)(H,13,14,16)	RFVBTVMRNXFBMX-UHFFFAOYSA-N	313.05548275							108172
MLS000540543	LSM-19550	BRD-K06117861, SID14729956	519224	InChI=1S/C14H9ClN2O/c15-11-5-7-12(8-6-11)17-14(18)13-4-2-1-3-10(13)9-16-17/h1-9H	QQJQSWFPMBORPH-UHFFFAOYSA-N	Clc1ccc(cc1)N2N=Cc3ccccc3C2=O	BroadT	BRD-K06117861	BRD-K06117861-001-05-8	Key Organics Ltd.	5F-366S			Clc1ccc(cc1)-n1ncc2ccccc2c1=O	InChI=1S/C14H9ClN2O/c15-11-5-7-12(8-6-11)17-14(18)13-4-2-1-3-10(13)9-16-17/h1-9H	QQJQSWFPMBORPH-UHFFFAOYSA-N	256.040340638							108173
AC1NJP0H	LSM-19551	BRD-K12035825, SID24831242	4875495	InChI=1S/C14H10N4O3/c19-13(9-5-1-4-8-12(9)18(20)21)17-14-15-10-6-2-3-7-11(10)16-14/h1-8H,(H2,15,16,17,19)	DNRKFXPSJOWKDL-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1C(=O)Nc2nc3ccccc3[nH]2	BroadT	BRD-K12035825	BRD-K12035825-001-05-9	Enamine Ltd.	T5294799			[O-][N+](=O)c1ccccc1C(=O)Nc1nc2ccccc2[nH]1	InChI=1S/C14H10N4O3/c19-13(9-5-1-4-8-12(9)18(20)21)17-14-15-10-6-2-3-7-11(10)16-14/h1-8H,(H2,15,16,17,19)	DNRKFXPSJOWKDL-UHFFFAOYSA-N	282.07529022							108174
MLS000702485	LSM-19552	BRD-K30326216, SID22413030	4066056	InChI=1S/C24H28Cl2N6O6/c25-21-5-3-17(31(35)36)15-19(21)23(33)27-7-1-9-29-11-13-30(14-12-29)10-2-8-28-24(34)20-16-18(32(37)38)4-6-22(20)26/h3-6,15-16H,1-2,7-14H2,(H,27,33)(H,28,34)	HVUIGOGGTRASFW-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(Cl)c(c1)C(=O)NCCCN2CCN(CCCNC(=O)c3cc(ccc3Cl)[N+](=O)[O-])CC2	BroadT	BRD-K30326216	BRD-K30326216-001-05-7	Specs	AK-968/15359111			[O-][N+](=O)c1ccc(Cl)c(c1)C(=O)NCCCN1CCN(CCCNC(=O)c2cc(ccc2Cl)[N+]([O-])=O)CC1	InChI=1S/C24H28Cl2N6O6/c25-21-5-3-17(31(35)36)15-19(21)23(33)27-7-1-9-29-11-13-30(14-12-29)10-2-8-28-24(34)20-16-18(32(37)38)4-6-22(20)26/h3-6,15-16H,1-2,7-14H2,(H,27,33)(H,28,34)	HVUIGOGGTRASFW-UHFFFAOYSA-N	566.144738096							108175
ZINC04595761	LSM-19553	BRD-K79179851	6815629	InChI=1S/C18H16N4OS/c23-16-9-5-4-8-15(16)12-20-22-17-10-11-19-18(21-17)24-13-14-6-2-1-3-7-14/h1-12,23H,13H2,(H,19,21,22)	ISXOKFUSLJHXNG-UHFFFAOYSA-N	Oc1ccccc1C=NNc2ccnc(SCc3ccccc3)n2	BroadT	BRD-K79179851	BRD-K79179851-001-04-5	Asinex Ltd.	BAS 00317772			Oc1ccccc1C=NNc1ccnc(SCc2ccccc2)n1	InChI=1S/C18H16N4OS/c23-16-9-5-4-8-15(16)12-20-22-17-10-11-19-18(21-17)24-13-14-6-2-1-3-7-14/h1-12,23H,13H2,(H,19,21,22)	ISXOKFUSLJHXNG-UHFFFAOYSA-N	336.104481862							
1-(4-Chlorophenyl)-3-(2-ethoxyphenyl)urea	LSM-19554	BRD-K55104181, SID22405361	295292	InChI=1S/C15H15ClN2O2/c1-2-20-14-6-4-3-5-13(14)18-15(19)17-12-9-7-11(16)8-10-12/h3-10H,2H2,1H3,(H2,17,18,19)	OBLVETBTEXMBBF-UHFFFAOYSA-N	CCOc1ccccc1NC(=O)Nc2ccc(Cl)cc2	BroadT	BRD-K55104181	BRD-K55104181-001-06-7	Specs	AN-329/40184145			CCOc1ccccc1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C15H15ClN2O2/c1-2-20-14-6-4-3-5-13(14)18-15(19)17-12-9-7-11(16)8-10-12/h3-10H,2H2,1H3,(H2,17,18,19)	OBLVETBTEXMBBF-UHFFFAOYSA-N	290.08220545							108177
MLS000115276	LSM-19555	BRD-K61681480, SID26724796, SID7965627	1177322	InChI=1S/C21H20BrN3O4/c1-26-18-8-3-14(11-19(18)27-2)9-10-24-21-17(12-23)25-20(29-21)13-28-16-6-4-15(22)5-7-16/h3-8,11,24H,9-10,13H2,1-2H3	AZMNDTJDENERFS-UHFFFAOYSA-N	COc1ccc(CCNc2oc(COc3ccc(Br)cc3)nc2C#N)cc1OC	BroadT	BRD-K61681480	BRD-K61681480-001-04-9	ChemDiv Inc.	6487-0406			COc1ccc(CCNc2oc(COc3ccc(Br)cc3)nc2C#N)cc1OC	InChI=1S/C21H20BrN3O4/c1-26-18-8-3-14(11-19(18)27-2)9-10-24-21-17(12-23)25-20(29-21)13-28-16-6-4-15(22)5-7-16/h3-8,11,24H,9-10,13H2,1-2H3	AZMNDTJDENERFS-UHFFFAOYSA-N	457.06371875							108178
N-(2-Hydroxy-5-nitrophenyl)-3-nitrobenzamide	LSM-19556	SID49641098, BRD-K50700697	3090473	InChI=1S/C13H9N3O6/c17-12-5-4-10(16(21)22)7-11(12)14-13(18)8-2-1-3-9(6-8)15(19)20/h1-7,17H,(H,14,18)	OQTYOPJBECVUEO-UHFFFAOYSA-N	Oc1ccc(cc1NC(=O)c2cccc(c2)[N+](=O)[O-])[N+](=O)[O-]	BroadT	BRD-K50700697	BRD-K50700697-001-05-6	Asinex Ltd.	BAS 00095282			Oc1ccc(cc1NC(=O)c1cccc(c1)[N+]([O-])=O)[N+]([O-])=O	InChI=1S/C13H9N3O6/c17-12-5-4-10(16(21)22)7-11(12)14-13(18)8-2-1-3-9(6-8)15(19)20/h1-7,17H,(H,14,18)	OQTYOPJBECVUEO-UHFFFAOYSA-N	303.049135038							108179
MLS000332605	LSM-19557	BRD-K65441343, SID26660165	934383	InChI=1S/C16H18N4O3/c1-11(2)12-3-5-13(6-4-12)23-10-15(21)19-20-16(22)14-9-17-7-8-18-14/h3-9,11H,10H2,1-2H3,(H,19,21)(H,20,22)	QEZNYWJORFQKDY-UHFFFAOYSA-N	CC(C)c1ccc(OCC(=O)NNC(=O)c2cnccn2)cc1	BroadT	BRD-K65441343	BRD-K65441343-001-06-6	InterBioScreen Ltd.	STOCK4S-08687			CC(C)c1ccc(OCC(=O)NNC(=O)c2cnccn2)cc1	InChI=1S/C16H18N4O3/c1-11(2)12-3-5-13(6-4-12)23-10-15(21)19-20-16(22)14-9-17-7-8-18-14/h3-9,11H,10H2,1-2H3,(H,19,21)(H,20,22)	QEZNYWJORFQKDY-UHFFFAOYSA-N	314.137890476							108180
ZINC04295210	LSM-19558	BRD-K08259535, SID864610	665852	InChI=1S/C20H19N3O2/c1-14-8-10-15(11-9-14)18-21-19(25-22-18)16-6-2-3-7-17(16)20(24)23-12-4-5-13-23/h2-3,6-11H,4-5,12-13H2,1H3	QFBFEMRXCXNYLC-UHFFFAOYSA-N	Cc1ccc(cc1)c2noc(n2)c3ccccc3C(=O)N4CCCC4	BroadT	BRD-K08259535	BRD-K08259535-001-05-2	InterBioScreen Ltd.	STOCK5S-25031			Cc1ccc(cc1)-c1noc(n1)-c1ccccc1C(=O)N1CCCC1	InChI=1S/C20H19N3O2/c1-14-8-10-15(11-9-14)18-21-19(25-22-18)16-6-2-3-7-17(16)20(24)23-12-4-5-13-23/h2-3,6-11H,4-5,12-13H2,1H3	QFBFEMRXCXNYLC-UHFFFAOYSA-N	333.147726878							108181
SMR000171178	LSM-19559	BRD-K92981306, SID17508571	3232134	InChI=1S/C26H26FN5O2/c1-30-12-14-31(15-13-30)22-9-7-21(8-10-22)28-25(33)19-4-11-24-23(16-19)29-26(34)32(24)17-18-2-5-20(27)6-3-18/h2-11,16H,12-15,17H2,1H3,(H,28,33)(H,29,34)	MKFRXHXTYSRVIZ-UHFFFAOYSA-N	CN1CCN(CC1)c2ccc(NC(=O)c3ccc4c(c3)nc(O)n4Cc5ccc(F)cc5)cc2	BroadT	BRD-K92981306	BRD-K92981306-001-06-3	Asinex Ltd.	ASN 10364155			CN1CCN(CC1)c1ccc(NC(=O)c2ccc3n(Cc4ccc(F)cc4)c(O)nc3c2)cc1	InChI=1S/C26H26FN5O2/c1-30-12-14-31(15-13-30)22-9-7-21(8-10-22)28-25(33)19-4-11-24-23(16-19)29-26(34)32(24)17-18-2-5-20(27)6-3-18/h2-11,16H,12-15,17H2,1H3,(H,28,33)(H,29,34)	MKFRXHXTYSRVIZ-UHFFFAOYSA-N	459.207053322							108182
AC1LOC5Z	LSM-15293	BRD-K31536290	1237107	InChI=1S/C13H16ClN3O2/c1-10(18)13(17-5-7-19-8-6-17)16-15-12-4-2-3-11(14)9-12/h2-4,9,15H,5-8H2,1H3	ROWXADOVDRCHNU-UHFFFAOYSA-N	CC(=O)C(=NNc1cccc(Cl)c1)N2CCOCC2	BroadT	BRD-K31536290	BRD-K31536290-003-05-5	Specs	AF-886/30752037		Cl	CC(=O)C(=NNc1cccc(Cl)c1)N1CCOCC1.Cl	InChI=1S/C13H16ClN3O2.ClH/c1-10(18)13(17-5-7-19-8-6-17)16-15-12-4-2-3-11(14)9-12;/h2-4,9,15H,5-8H2,1H3;1H	LCEKMYCWKGBIKW-UHFFFAOYSA-N	281.093104492							103940
MLS000515528	LSM-19560	BRD-K78074905, SID17410418	11958830	InChI=1S/C20H21N3O3/c1-4-11-26-20-16-10-9-14(12-17(16)22-23(20)2)19(24)21-13-15-7-5-6-8-18(15)25-3/h4-10,12H,1,11,13H2,2-3H3,(H,21,24)	SMLYCPBSJLOVPD-UHFFFAOYSA-N	COc1ccccc1CNC(=O)c2ccc3c(OCC=C)n(C)nc3c2	BroadT	BRD-K78074905	BRD-K78074905-001-05-2	University of California at Davis	UCD_ADM_1-218			COc1ccccc1CNC(=O)c1ccc2c(OCC=C)n(C)nc2c1	InChI=1S/C20H21N3O3/c1-4-11-26-20-16-10-9-14(12-17(16)22-23(20)2)19(24)21-13-15-7-5-6-8-18(15)25-3/h4-10,12H,1,11,13H2,2-3H3,(H,21,24)	SMLYCPBSJLOVPD-UHFFFAOYSA-N	351.158291562							108183
MLS000594053	LSM-19561	BRD-K60907484, SID14731991	2184843	InChI=1S/C12H11ClN2OS/c13-10-2-4-11(5-3-10)16-8-9-17-12-14-6-1-7-15-12/h1-7H,8-9H2	JCTOSNXWCPXGLF-UHFFFAOYSA-N	Clc1ccc(OCCSc2ncccn2)cc1	BroadT	BRD-K60907484	BRD-K60907484-001-05-2	ChemBridge Corporation	7349788			Clc1ccc(OCCSc2ncccn2)cc1	InChI=1S/C12H11ClN2OS/c13-10-2-4-11(5-3-10)16-8-9-17-12-14-6-1-7-15-12/h1-7H,8-9H2	JCTOSNXWCPXGLF-UHFFFAOYSA-N	266.028061392							108184
SMR000095280	LSM-19562	BRD-A89354030, SID7967469	5308840	InChI=1S/C19H21N3O3/c1-12-6-7-16-14(9-12)18-15(19(24)25-16)10-20-22(18)11-17(23)21-8-4-3-5-13(21)2/h6-7,9-10,13H,3-5,8,11H2,1-2H3	ZCZOAZQPIZRACP-UHFFFAOYSA-N	CC1CCCCN1C(=O)Cn2ncc3C(=O)Oc4ccc(C)cc4c23	BroadT	BRD-A89354030	BRD-A89354030-001-06-3	ChemDiv Inc.	C618-0636			CC1CCCCN1C(=O)Cn1ncc2c1c1cc(C)ccc1oc2=O	InChI=1S/C19H21N3O3/c1-12-6-7-16-14(9-12)18-15(19(24)25-16)10-20-22(18)11-17(23)21-8-4-3-5-13(21)2/h6-7,9-10,13H,3-5,8,11H2,1-2H3	ZCZOAZQPIZRACP-UHFFFAOYSA-N	339.158291562							108185
STK141027	LSM-19563	BRD-K89650689, SID4265549	1090596	InChI=1S/C19H19N3O6S2/c23-18(13-22-19(24)16-5-1-2-6-17(16)30(22,27)28)20-14-7-9-15(10-8-14)29(25,26)21-11-3-4-12-21/h1-2,5-10H,3-4,11-13H2,(H,20,23)	NVTIIEDNXCIXRE-UHFFFAOYSA-N	O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc(cc3)S(=O)(=O)N4CCCC4	BroadT	BRD-K89650689	BRD-K89650689-001-06-6	ChemBridge Corporation	7823287			O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc1ccc(cc1)S(=O)(=O)N1CCCC1	InChI=1S/C19H19N3O6S2/c23-18(13-22-19(24)16-5-1-2-6-17(16)30(22,27)28)20-14-7-9-15(10-8-14)29(25,26)21-11-3-4-12-21/h1-2,5-10H,3-4,11-13H2,(H,20,23)	NVTIIEDNXCIXRE-UHFFFAOYSA-N	449.071526738							108186
2-Bromo-n-(3-methoxyphenyl)benzamide	LSM-19564	SID47201433, BRD-K49328983	795409	InChI=1S/C14H12BrNO2/c1-18-11-6-4-5-10(9-11)16-14(17)12-7-2-3-8-13(12)15/h2-9H,1H3,(H,16,17)	KJBDNSBCXSIQMA-UHFFFAOYSA-N	COc1cccc(NC(=O)c2ccccc2Br)c1	BroadT	BRD-K49328983	BRD-K49328983-001-06-1	Asinex Ltd.	BAS 00092170			COc1cccc(NC(=O)c2ccccc2Br)c1	InChI=1S/C14H12BrNO2/c1-18-11-6-4-5-10(9-11)16-14(17)12-7-2-3-8-13(12)15/h2-9H,1H3,(H,16,17)	KJBDNSBCXSIQMA-UHFFFAOYSA-N	305.005141234							108187
T0506-5899	LSM-19565	BRD-K71514806, SID16953051	5177955	InChI=1S/C17H20FN5O5S/c1-3-22(4-2)29(27,28)16-11-14(23(25)26)9-10-15(16)20-21-17(24)19-13-7-5-12(18)6-8-13/h5-11,20H,3-4H2,1-2H3,(H2,19,21,24)	YWFRZQVGZLTZHX-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1cc(ccc1NNC(=O)Nc2ccc(F)cc2)[N+](=O)[O-]	BroadT	BRD-K71514806	BRD-K71514806-001-05-4	Enamine Ltd.	T0506-5899			CCN(CC)S(=O)(=O)c1cc(ccc1NNC(=O)Nc1ccc(F)cc1)[N+]([O-])=O	InChI=1S/C17H20FN5O5S/c1-3-22(4-2)29(27,28)16-11-14(23(25)26)9-10-15(16)20-21-17(24)19-13-7-5-12(18)6-8-13/h5-11,20H,3-4H2,1-2H3,(H2,19,21,24)	YWFRZQVGZLTZHX-UHFFFAOYSA-N	425.11691768							108188
MLS000079852	LSM-43844	BRD-K19770687, SID858204	659554	InChI=1S/C18H16BrN3O3S/c1-2-5-22-13-4-3-11(19)10-12(13)14(17(22)24)15-16(23)20-18(26-15)21-6-8-25-9-7-21/h2-4,10H,1,5-9H2/b15-14-	GMKOWJIRUQIASB-PFONDFGASA-N	Brc1ccc2N(CC=C)C(=O)\C(=C\3/SC(=NC3=O)N4CCOCC4)\c2c1	BroadT	BRD-K19770687	BRD-K19770687-001-06-9	InterBioScreen Ltd.	STOCK2S-24996			Brc1ccc2N(CC=C)C(=O)\C(c2c1)=C1/SC(=NC1=O)N1CCOCC1	InChI=1S/C18H16BrN3O3S/c1-2-5-22-13-4-3-11(19)10-12(13)14(17(22)24)15-16(23)20-18(26-15)21-6-8-25-9-7-21/h2-4,10H,1,5-9H2/b15-14-	GMKOWJIRUQIASB-PFONDFGASA-N	433.009574692							
AC1MIS5C	LSM-15201	BRD-A47798787	3100727	InChI=1S/C19H23N3O3S/c1-12(2)9-14-10-19(3,25-17(14)24)15-11-26-18(20-15)22-21-16(23)13-7-5-4-6-8-13/h4-8,11-12,14H,9-10H2,1-3H3,(H,20,22)(H,21,23)	SUGQVMVKDZYGDL-UHFFFAOYSA-N	CC(C)CC1CC(C)(OC1=O)c2csc(NNC(=O)c3ccccc3)n2	BroadT	BRD-A47798787	BRD-A47798787-004-05-3	Asinex Ltd.	BAS 00333810		Br	CC(C)CC1CC(C)(OC1=O)c1csc(NNC(=O)c2ccccc2)n1.Br	InChI=1S/C19H23N3O3S.BrH/c1-12(2)9-14-10-19(3,25-17(14)24)15-11-26-18(20-15)22-21-16(23)13-7-5-4-6-8-13;/h4-8,11-12,14H,9-10H2,1-3H3,(H,20,22)(H,21,23);1H	OZMILBMISUKVHR-UHFFFAOYSA-N	373.146012316							103851, 103851
MLS000698465	LSM-19567	BRD-K67007076, SID22412370	990456	InChI=1S/C21H27N5OS/c1-4-27-18-9-7-17(8-10-18)26-16(3)19-15(2)22-23-21(20(19)24-26)28-14-13-25-11-5-6-12-25/h7-10H,4-6,11-14H2,1-3H3	YVEXVFVRGDSMHQ-UHFFFAOYSA-N	CCOc1ccc(cc1)n2nc3c(SCCN4CCCC4)nnc(C)c3c2C	BroadT	BRD-K67007076	BRD-K67007076-001-05-8	Specs	AO-476/43201366			CCOc1ccc(cc1)-n1nc2c(SCCN3CCCC3)nnc(C)c2c1C	InChI=1S/C21H27N5OS/c1-4-27-18-9-7-17(8-10-18)26-16(3)19-15(2)22-23-21(20(19)24-26)28-14-13-25-11-5-6-12-25/h7-10H,4-6,11-14H2,1-3H3	YVEXVFVRGDSMHQ-UHFFFAOYSA-N	397.193631224							108190
MLS000063271	LSM-19568	BRD-K35724671, SID4256551	975698	InChI=1S/C18H21NO4/c1-12-5-7-19(8-6-12)17(20)11-22-14-3-4-16-15(10-14)13(2)9-18(21)23-16/h3-4,9-10,12H,5-8,11H2,1-2H3	INCKOMOUIOGUJF-UHFFFAOYSA-N	CC1CCN(CC1)C(=O)COc2ccc3OC(=O)C=C(C)c3c2	BroadT	BRD-K35724671	BRD-K35724671-001-05-6	ChemBridge Corporation	7690037			CC1CCN(CC1)C(=O)COc1ccc2oc(=O)cc(C)c2c1	InChI=1S/C18H21NO4/c1-12-5-7-19(8-6-12)17(20)11-22-14-3-4-16-15(10-14)13(2)9-18(21)23-16/h3-4,9-10,12H,5-8,11H2,1-2H3	INCKOMOUIOGUJF-UHFFFAOYSA-N	315.147058162							108191
SMR000074646	LSM-19569	BRD-K33775409, SID4264931	1303882	InChI=1S/C21H22N4O4S/c1-3-25-18(12-29-17-9-4-6-14(2)10-17)23-24-21(25)30-13-19(26)22-16-8-5-7-15(11-16)20(27)28/h4-11H,3,12-13H2,1-2H3,(H,22,26)(H,27,28)	FFNMJQUQMUHELR-UHFFFAOYSA-N	CCn1c(COc2cccc(C)c2)nnc1SCC(=O)Nc3cccc(c3)C(=O)O	BroadT	BRD-K33775409	BRD-K33775409-001-05-9	ChemBridge Corporation	7679095			CCn1c(COc2cccc(C)c2)nnc1SCC(=O)Nc1cccc(c1)C(O)=O	InChI=1S/C21H22N4O4S/c1-3-25-18(12-29-17-9-4-6-14(2)10-17)23-24-21(25)30-13-19(26)22-16-8-5-7-15(11-16)20(27)28/h4-11H,3,12-13H2,1-2H3,(H,22,26)(H,27,28)	FFNMJQUQMUHELR-UHFFFAOYSA-N	426.136175914							108192
2,6-Bis[(1,5-dimethyl-1H-pyrazol-4-yl)methylene]cyclohexanone	LSM-43845	BRD-K83127279, SID17386296	1765992	InChI=1S/C18H22N4O/c1-12-16(10-19-21(12)3)8-14-6-5-7-15(18(14)23)9-17-11-20-22(4)13(17)2/h8-11H,5-7H2,1-4H3/b14-8+,15-9+	POYKOUXGSGTAEI-VOMDNODZSA-N	Cc1c(\C=C\2/CCC\C(=C/c3cnn(C)c3C)\C2=O)cnn1C	BroadT	BRD-K83127279	BRD-K83127279-001-05-9	Specs	AK-968/41169753			Cc1c(cnn1C)\C=C1/CCC\C(C1=O)=C/c1cnn(C)c1C	InChI=1S/C18H22N4O/c1-12-16(10-19-21(12)3)8-14-6-5-7-15(18(14)23)9-17-11-20-22(4)13(17)2/h8-11H,5-7H2,1-4H3/b14-8+,15-9+	POYKOUXGSGTAEI-VOMDNODZSA-N	310.179361364							
SMR000026276	LSM-19571	BRD-A45349889, SID4252024	3245631	InChI=1S/C20H28N2O3S/c1-2-17-8-3-4-12-22(17)26(24,25)18-9-10-19-16(14-18)11-13-21(19)20(23)15-6-5-7-15/h9-10,14-15,17H,2-8,11-13H2,1H3	OFSUPMNXHDGMAU-UHFFFAOYSA-N	CCC1CCCCN1S(=O)(=O)c2ccc3N(CCc3c2)C(=O)C4CCC4	BroadT	BRD-A45349889	BRD-A45349889-001-05-0	ChemDiv Inc.	C361-0934			CCC1CCCCN1S(=O)(=O)c1ccc2N(CCc2c1)C(=O)C1CCC1	InChI=1S/C20H28N2O3S/c1-2-17-8-3-4-12-22(17)26(24,25)18-9-10-19-16(14-18)11-13-21(19)20(23)15-6-5-7-15/h9-10,14-15,17H,2-8,11-13H2,1H3	OFSUPMNXHDGMAU-UHFFFAOYSA-N	376.182063466							108194
2-[(2-Nitrophenyl)methylsulfanyl]-1,3-benzoxazole	LSM-19572	2-(2-Nitrobenzylsulfanyl)Benzoxazole, BRD-K81322049	497458	InChI=1S/C14H10N2O3S/c17-16(18)12-7-3-1-5-10(12)9-20-14-15-11-6-2-4-8-13(11)19-14/h1-8H,9H2	WRHRPRGUICELEZ-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1CSc2oc3ccccc3n2	BroadT	BRD-K81322049	BRD-K81322049-001-05-7	Enamine Ltd.	T0504-6712			[O-][N+](=O)c1ccccc1CSc1nc2ccccc2o1	InChI=1S/C14H10N2O3S/c17-16(18)12-7-3-1-5-10(12)9-20-14-15-11-6-2-4-8-13(11)19-14/h1-8H,9H2	WRHRPRGUICELEZ-UHFFFAOYSA-N	286.04121289							108195
SMR000093574	LSM-19573	BRD-K93391478, SID7967968	5309141	InChI=1S/C12H12N6O/c1-2-4-10-9(3-1)13-11(12-14-15-16-18(10)12)17-5-7-19-8-6-17/h1-4H,5-8H2	ZWCDNRRJJHQTGV-UHFFFAOYSA-N	C1CN(CCO1)c2nc3ccccc3n4nnnc24	BroadT	BRD-K93391478	BRD-K93391478-001-05-8	ChemDiv Inc.	C301-0716			C1CN(CCO1)c1nc2ccccc2n2nnnc12	InChI=1S/C12H12N6O/c1-2-4-10-9(3-1)13-11(12-14-15-16-18(10)12)17-5-7-19-8-6-17/h1-4H,5-8H2	ZWCDNRRJJHQTGV-UHFFFAOYSA-N	256.107259064							108196
SMR000043477	LSM-43846	BRD-K90238417, SID861585	5389598	InChI=1S/C20H26N4O3/c1-5-13-24-19(26)17(18(25)22-20(24)27)16(6-2)21-14-9-11-15(12-10-14)23(7-3)8-4/h5,9-12,21H,1,6-8,13H2,2-4H3,(H,22,25,27)/b17-16+	GJGHQVXAHIPWOE-WUKNDPDISA-N	CCN(CC)c1ccc(N\C(=C\2/C(=O)NC(=O)N(CC=C)C2=O)\CC)cc1	BroadT	BRD-K90238417	BRD-K90238417-001-07-4	InterBioScreen Ltd.	STOCK4S-13795			CCN(CC)c1ccc(N\C(CC)=C2/C(=O)NC(=O)N(CC=C)C2=O)cc1	InChI=1S/C20H26N4O3/c1-5-13-24-19(26)17(18(25)22-20(24)27)16(6-2)21-14-9-11-15(12-10-14)23(7-3)8-4/h5,9-12,21H,1,6-8,13H2,2-4H3,(H,22,25,27)/b17-16+	GJGHQVXAHIPWOE-WUKNDPDISA-N	370.200490732							
CHEMDIV3_009592	LSM-19575	SID24824187, BRD-K07350528	4451305	InChI=1S/C15H19N3S/c1-16-15(19)17-9-10-6-7-14-12(8-10)11-4-2-3-5-13(11)18-14/h6-8,18H,2-5,9H2,1H3,(H2,16,17,19)	FYUNJVBLCDMPAV-UHFFFAOYSA-N	CN=C(S)NCc1ccc2[nH]c3CCCCc3c2c1	BroadT	BRD-K07350528	BRD-K07350528-001-05-9	Life Chemicals Inc.	F0651-0493			CN=C(S)NCc1ccc2[nH]c3CCCCc3c2c1	InChI=1S/C15H19N3S/c1-16-15(19)17-9-10-6-7-14-12(8-10)11-4-2-3-5-13(11)18-14/h6-8,18H,2-5,9H2,1H3,(H2,16,17,19)	FYUNJVBLCDMPAV-UHFFFAOYSA-N	273.129968328							108198
MLS000053420	LSM-19576	BRD-K24382357, SID3712521	2099328	InChI=1S/C15H14N2O5/c1-17-8-4-6-11(17)14(20)16-13(19)9-22-15(21)10-5-2-3-7-12(10)18/h2-8,18H,9H2,1H3,(H,16,19,20)	FYKKUFZSXSJFQW-UHFFFAOYSA-N	Cn1cccc1C(=O)NC(=O)COC(=O)c2ccccc2O	BroadT	BRD-K24382357	BRD-K24382357-001-05-7	Enamine Ltd.	T5231998			Cn1cccc1C(=O)NC(=O)COC(=O)c1ccccc1O	InChI=1S/C15H14N2O5/c1-17-8-4-6-11(17)14(20)16-13(19)9-22-15(21)10-5-2-3-7-12(10)18/h2-8,18H,9H2,1H3,(H,16,19,20)	FYKKUFZSXSJFQW-UHFFFAOYSA-N	302.090271568							108199
MLS000037417	LSM-19577	BRD-A00881124, SID857997	659344	InChI=1S/C18H24N2O/c1-3-14-8-6-7-11-20(14)12-17(21)18-13(2)19-16-10-5-4-9-15(16)18/h4-5,9-10,14,19H,3,6-8,11-12H2,1-2H3	MQENFRBYUSXJEN-UHFFFAOYSA-N	CCC1CCCCN1CC(=O)c2c(C)[nH]c3ccccc23	BroadT	BRD-A00881124	BRD-A00881124-001-05-0	InterBioScreen Ltd.	STOCK2S-07197			CCC1CCCCN1CC(=O)c1c(C)[nH]c2ccccc12	InChI=1S/C18H24N2O/c1-3-14-8-6-7-11-20(14)12-17(21)18-13(2)19-16-10-5-4-9-15(16)18/h4-5,9-10,14,19H,3,6-8,11-12H2,1-2H3	MQENFRBYUSXJEN-UHFFFAOYSA-N	284.188863408							108200
HMS2557M10	LSM-19578	BRD-K41798816	12004551	InChI=1S/C21H19N3O4S/c1-28-19-8-5-14(10-15(19)13-29-20-4-2-3-9-22-20)12-23-24-21(27)17-7-6-16(25)11-18(17)26/h2-12,25-26H,13H2,1H3,(H,24,27)	YBDHFPHIXYMEFA-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)c2ccc(O)cc2O)cc1CSc3ccccn3	BroadT	BRD-K41798816	BRD-K41798816-001-05-8	ChemDiv Inc.	1981-1435			COc1ccc(C=NNC(=O)c2ccc(O)cc2O)cc1CSc1ccccn1	InChI=1S/C21H19N3O4S/c1-28-19-8-5-14(10-15(19)13-29-20-4-2-3-9-22-20)12-23-24-21(27)17-7-6-16(25)11-18(17)26/h2-12,25-26H,13H2,1H3,(H,24,27)	YBDHFPHIXYMEFA-UHFFFAOYSA-N	409.109626808							108201
{4-[(2-Bromophenoxy)methyl]phenyl}(piperidin-1-yl)methanone	LSM-19579	BRD-K18000429, SID17386203	1222996	InChI=1S/C19H20BrNO2/c20-17-6-2-3-7-18(17)23-14-15-8-10-16(11-9-15)19(22)21-12-4-1-5-13-21/h2-3,6-11H,1,4-5,12-14H2	ZZLYSPCQPXRIKW-UHFFFAOYSA-N	Brc1ccccc1OCc2ccc(cc2)C(=O)N3CCCCC3	BroadT	BRD-K18000429	BRD-K18000429-001-05-7	Specs	AK-968/14003134			Brc1ccccc1OCc1ccc(cc1)C(=O)N1CCCCC1	InChI=1S/C19H20BrNO2/c20-17-6-2-3-7-18(17)23-14-15-8-10-16(11-9-15)19(22)21-12-4-1-5-13-21/h2-3,6-11H,1,4-5,12-14H2	ZZLYSPCQPXRIKW-UHFFFAOYSA-N	373.06774149							108202
AC1OAOUF	LSM-19580	BRD-K76985713	6833060	InChI=1S/C15H10BrN3O2/c16-11-6-2-1-5-10(11)14-19-12(15(20)21-14)9-18-13-7-3-4-8-17-13/h1-9,20H	OLDXKSBNFBZVJW-UHFFFAOYSA-N	Oc1oc(nc1C=Nc2ccccn2)c3ccccc3Br	BroadT	BRD-K76985713	BRD-K76985713-001-06-1	ChemDiv Inc.	1989-9504			Oc1oc(nc1C=Nc1ccccn1)-c1ccccc1Br	InChI=1S/C15H10BrN3O2/c16-11-6-2-1-5-10(11)14-19-12(15(20)21-14)9-18-13-7-3-4-8-17-13/h1-9,20H	OLDXKSBNFBZVJW-UHFFFAOYSA-N	342.99563919							
MLS000624487	LSM-15294	BRD-K18087940	729778	InChI=1S/C12H12F3N3OS/c13-12(14,15)8-2-1-3-9(6-8)18-10(19)7-20-11-16-4-5-17-11/h1-3,6H,4-5,7H2,(H,16,17)(H,18,19)	GSRUSEGVJQGBQN-UHFFFAOYSA-N	FC(F)(F)c1cccc(NC(=O)CSC2=NCCN2)c1	BroadT	BRD-K18087940	BRD-K18087940-003-06-8	Life Chemicals Inc.	F0820-0249		Cl	FC(F)(F)c1cccc(NC(=O)CSC2=NCCN2)c1.Cl	InChI=1S/C12H12F3N3OS.ClH/c13-12(14,15)8-2-1-3-9(6-8)18-10(19)7-20-11-16-4-5-17-11;/h1-3,6H,4-5,7H2,(H,16,17)(H,18,19);1H	UZLHUCWIPQUUIT-UHFFFAOYSA-N	303.065317324							103941, 103941
AC1N4PAY	LSM-19581	BRD-K44799944, SID24782077	4182451	InChI=1S/C21H30N8S/c30-21(23-17-12-6-2-7-13-17)28-27-19-24-18(22-16-10-4-1-5-11-16)25-20(26-19)29-14-8-3-9-15-29/h1,4-5,10-11,17H,2-3,6-9,12-15H2,(H2,23,28,30)(H2,22,24,25,26,27)	UDGIYLMEUCNXAN-UHFFFAOYSA-N	S=C(NNc1nc(Nc2ccccc2)nc(n1)N3CCCCC3)NC4CCCCC4	BroadT	BRD-K44799944	BRD-K44799944-001-05-8	ChemDiv Inc.	3229-1807			S=C(NNc1nc(Nc2ccccc2)nc(n1)N1CCCCC1)NC1CCCCC1	InChI=1S/C21H30N8S/c30-21(23-17-12-6-2-7-13-17)28-27-19-24-18(22-16-10-4-1-5-11-16)25-20(26-19)29-14-8-3-9-15-29/h1,4-5,10-11,17H,2-3,6-9,12-15H2,(H2,23,28,30)(H2,22,24,25,26,27)	UDGIYLMEUCNXAN-UHFFFAOYSA-N	426.23141373							108204
SMR000074591	LSM-19582	BRD-A03940741, SID4257322	2946961	InChI=1S/C19H19NO5/c1-2-23-19(22)13-7-9-14(10-8-13)20-18(21)11-15-12-24-16-5-3-4-6-17(16)25-15/h3-10,15H,2,11-12H2,1H3,(H,20,21)	SKOUVYWQSUAILS-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)CC2COc3ccccc3O2)cc1	BroadT	BRD-A03940741	BRD-A03940741-001-06-2	ChemBridge Corporation	7676041			CCOC(=O)c1ccc(NC(=O)CC2COc3ccccc3O2)cc1	InChI=1S/C19H19NO5/c1-2-23-19(22)13-7-9-14(10-8-13)20-18(21)11-15-12-24-16-5-3-4-6-17(16)25-15/h3-10,15H,2,11-12H2,1H3,(H,20,21)	SKOUVYWQSUAILS-UHFFFAOYSA-N	341.126322718							108205
F0599-0319	LSM-19583	BRD-K40649636, SID17515235	4610344	InChI=1S/C22H23N3O2S/c1-2-27-19-11-9-18(10-12-19)24-15-13-23-22(24)28-16-21(26)25-14-5-7-17-6-3-4-8-20(17)25/h3-4,6,8-13,15H,2,5,7,14,16H2,1H3	GLSCOAMPEHRJGF-UHFFFAOYSA-N	CCOc1ccc(cc1)n2ccnc2SCC(=O)N3CCCc4ccccc34	BroadT	BRD-K40649636	BRD-K40649636-001-05-2	Life Chemicals Inc.	F0599-0319			CCOc1ccc(cc1)-n1ccnc1SCC(=O)N1CCCc2ccccc12	InChI=1S/C22H23N3O2S/c1-2-27-19-11-9-18(10-12-19)24-15-13-23-22(24)28-16-21(26)25-14-5-7-17-6-3-4-8-20(17)25/h3-4,6,8-13,15H,2,5,7,14,16H2,1H3	GLSCOAMPEHRJGF-UHFFFAOYSA-N	393.151097696							108206
ZINC00435674	LSM-19584	SID7977996, BRD-K05261060	870163	InChI=1S/C13H13ClN2S/c14-11-5-2-1-4-10(11)9-17-13-8-16-7-3-6-12(16)15-13/h1-2,4-5,8H,3,6-7,9H2	KKUQCSKFYZAODQ-UHFFFAOYSA-N	Clc1ccccc1CSc2cn3CCCc3n2	BroadT	BRD-K05261060	BRD-K05261060-001-07-0	ChemBridge Corporation	5791247			Clc1ccccc1CSc1cn2CCCc2n1	InChI=1S/C13H13ClN2S/c14-11-5-2-1-4-10(11)9-17-13-8-16-7-3-6-12(16)15-13/h1-2,4-5,8H,3,6-7,9H2	KKUQCSKFYZAODQ-UHFFFAOYSA-N	264.048796836							108207
MLS000101480	LSM-19585	BRD-K23957028, SID7971125	3452486	InChI=1S/C19H15N3O2S/c1-12-5-4-6-13(9-12)22-16(23)10-25-19-18-17(20-11-21-19)14-7-2-3-8-15(14)24-18/h2-9,11H,10H2,1H3,(H,22,23)	BVYKEWNTVXGSHF-UHFFFAOYSA-N	Cc1cccc(NC(=O)CSc2ncnc3c2oc4ccccc34)c1	BroadT	BRD-K23957028	BRD-K23957028-001-04-9	Life Chemicals Inc.	F0596-0024			Cc1cccc(NC(=O)CSc2ncnc3c4ccccc4oc23)c1	InChI=1S/C19H15N3O2S/c1-12-5-4-6-13(9-12)22-16(23)10-25-19-18-17(20-11-21-19)14-7-2-3-8-15(14)24-18/h2-9,11H,10H2,1H3,(H,22,23)	BVYKEWNTVXGSHF-UHFFFAOYSA-N	349.08849744							108208
SMR000244109	LSM-19586	BRD-A30758703, SID22411468	4331390	InChI=1S/C22H24N2O8S/c1-15-6-7-16(33(27,28)24-8-10-29-11-9-24)12-17(15)23-21(25)14-31-22(26)20-13-30-18-4-2-3-5-19(18)32-20/h2-7,12,20H,8-11,13-14H2,1H3,(H,23,25)	OAYHGDZTJCMKGN-UHFFFAOYSA-N	Cc1ccc(cc1NC(=O)COC(=O)C2COc3ccccc3O2)S(=O)(=O)N4CCOCC4	BroadT	BRD-A30758703	BRD-A30758703-001-05-3	Enamine Ltd.	T0518-1616			Cc1ccc(cc1NC(=O)COC(=O)C1COc2ccccc2O1)S(=O)(=O)N1CCOCC1	InChI=1S/C22H24N2O8S/c1-15-6-7-16(33(27,28)24-8-10-29-11-9-24)12-17(15)23-21(25)14-31-22(26)20-13-30-18-4-2-3-5-19(18)32-20/h2-7,12,20H,8-11,13-14H2,1H3,(H,23,25)	OAYHGDZTJCMKGN-UHFFFAOYSA-N	476.125336438							108209
ST50326416	LSM-19587	BRD-K07160586, SID14731533	735034	InChI=1S/C17H12O5/c18-14(19)10-21-17-15(20)12-8-4-5-9-13(12)22-16(17)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,19)	XRNYYUDRVWPOKG-UHFFFAOYSA-N	OC(=O)COC1=C(Oc2ccccc2C1=O)c3ccccc3	BroadT	BRD-K07160586	BRD-K07160586-001-07-7	ChemBridge Corporation	7957883			OC(=O)COc1c(oc2ccccc2c1=O)-c1ccccc1	InChI=1S/C17H12O5/c18-14(19)10-21-17-15(20)12-8-4-5-9-13(12)22-16(17)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,19)	XRNYYUDRVWPOKG-UHFFFAOYSA-N	296.068473484							108210
N-(2,4-Dichlorophenyl)biphenyl-4-carboxamide	LSM-19588	SID17507111, BRD-K42797038	1590813	InChI=1S/C19H13Cl2NO/c20-16-10-11-18(17(21)12-16)22-19(23)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12H,(H,22,23)	LIVMUDVIMKFBTF-UHFFFAOYSA-N	Clc1ccc(NC(=O)c2ccc(cc2)c3ccccc3)c(Cl)c1	BroadT	BRD-K42797038	BRD-K42797038-001-05-1	Asinex Ltd.	BAS 00168326			Clc1ccc(NC(=O)c2ccc(cc2)-c2ccccc2)c(Cl)c1	InChI=1S/C19H13Cl2NO/c20-16-10-11-18(17(21)12-16)22-19(23)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12H,(H,22,23)	LIVMUDVIMKFBTF-UHFFFAOYSA-N	341.037419466							108211
MLS000529438	LSM-19589	BRD-K35909757, SID14727205	3212965	InChI=1S/C14H16N4O3S/c1-9(2)18-14(15-16-17-18)22-8-11(19)10-3-4-12-13(7-10)21-6-5-20-12/h3-4,7,9H,5-6,8H2,1-2H3	RYINBEFZQUPVNQ-UHFFFAOYSA-N	CC(C)n1nnnc1SCC(=O)c2ccc3OCCOc3c2	BroadT	BRD-K35909757	BRD-K35909757-001-06-8	Asinex Ltd.	ASN 05683273			CC(C)n1nnnc1SCC(=O)c1ccc2OCCOc2c1	InChI=1S/C14H16N4O3S/c1-9(2)18-14(15-16-17-18)22-8-11(19)10-3-4-12-13(7-10)21-6-5-20-12/h3-4,7,9H,5-6,8H2,1-2H3	RYINBEFZQUPVNQ-UHFFFAOYSA-N	320.094311102							108212
SMR000026506	LSM-19590	BRD-K92712671, SID26670678, SID4245613	3240063	InChI=1S/C26H33N5O3/c1-30-13-15-31(16-14-30)12-6-11-27-26(32)21-18-25(28-22-8-5-4-7-20(21)22)29-23-10-9-19(33-2)17-24(23)34-3/h4-5,7-10,17-18H,6,11-16H2,1-3H3,(H,27,32)(H,28,29)	IWLISUQPPURDQF-UHFFFAOYSA-N	COc1ccc(Nc2cc(C(=O)NCCCN3CCN(C)CC3)c4ccccc4n2)c(OC)c1	BroadT	BRD-K92712671	BRD-K92712671-001-05-1	ChemDiv Inc.	C387-0288			COc1ccc(Nc2cc(C(=O)NCCCN3CCN(C)CC3)c3ccccc3n2)c(OC)c1	InChI=1S/C26H33N5O3/c1-30-13-15-31(16-14-30)12-6-11-27-26(32)21-18-25(28-22-8-5-4-7-20(21)22)29-23-10-9-19(33-2)17-24(23)34-3/h4-5,7-10,17-18H,6,11-16H2,1-3H3,(H,27,32)(H,28,29)	IWLISUQPPURDQF-UHFFFAOYSA-N	463.258339966							108213
AK-968/41923674	LSM-19591	BRD-A07214340, SID17386441	4105359	InChI=1S/C17H19N3S2/c1-3-7-15-10-14(11-22-15)16-18-19-17(21)20(16)12(2)13-8-5-4-6-9-13/h4-6,8-12H,3,7H2,1-2H3,(H,19,21)	CAWOEGSOGDTGOS-UHFFFAOYSA-N	CCCc1cc(cs1)c2nnc(S)n2C(C)c3ccccc3	BroadT	BRD-A07214340	BRD-A07214340-001-05-5	Specs	AK-968/41923674			CCCc1cc(cs1)-c1nnc(S)n1C(C)c1ccccc1	InChI=1S/C17H19N3S2/c1-3-7-15-10-14(11-22-15)16-18-19-17(21)20(16)12(2)13-8-5-4-6-9-13/h4-6,8-12H,3,7H2,1-2H3,(H,19,21)	CAWOEGSOGDTGOS-UHFFFAOYSA-N	329.102039018							108214
Ethyl 2-{[(4-bromo-1-ethyl-1H-pyrazol-3-yl)carbonyl]amino}-4-phenylthiophene-3-carboxylate	LSM-19592	SID4264734, BRD-K63614330	1316617	InChI=1S/C19H18BrN3O3S/c1-3-23-10-14(20)16(22-23)17(24)21-18-15(19(25)26-4-2)13(11-27-18)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3,(H,21,24)	UWBXGVMJRWXCIM-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)c2nn(CC)cc2Br)scc1c3ccccc3	BroadT	BRD-K63614330	BRD-K63614330-001-07-3	ChemBridge Corporation	7564165			CCOC(=O)c1c(NC(=O)c2nn(CC)cc2Br)scc1-c1ccccc1	InChI=1S/C19H18BrN3O3S/c1-3-23-10-14(20)16(22-23)17(24)21-18-15(19(25)26-4-2)13(11-27-18)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3,(H,21,24)	UWBXGVMJRWXCIM-UHFFFAOYSA-N	447.025224756							108215
T6662660	LSM-15295	BRD-K75772626	654616	InChI=1S/C15H19N3O/c1-12-7-9-18(10-8-12)11-14-16-15(17-19-14)13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3	YUAKFILGFPHOCL-UHFFFAOYSA-N	CC1CCN(Cc2onc(n2)c3ccccc3)CC1	BroadT	BRD-K75772626	BRD-K75772626-003-06-6	Asinex Ltd.	BAS 08979843		Cl	CC1CCN(Cc2nc(no2)-c2ccccc2)CC1.Cl	InChI=1S/C15H19N3O.ClH/c1-12-7-9-18(10-8-12)11-14-16-15(17-19-14)13-5-3-2-4-6-13;/h2-6,12H,7-11H2,1H3;1H	FTRJXSKFJIBENA-UHFFFAOYSA-N	257.152812258							103942, 103942
AC1MWNOE	LSM-19593	BRD-K61247793	3777098	InChI=1S/C21H22N4O3S/c1-13-5-8-16(9-6-13)19-20(23-14(2)26)29-21(24-19)25-22-12-15-7-10-17(27-3)18(11-15)28-4/h5-12H,1-4H3,(H,23,26)(H,24,25)	HDGPPVFZLOSWLZ-UHFFFAOYSA-N	COc1ccc(C=NNc2nc(c(NC(=O)C)s2)c3ccc(C)cc3)cc1OC	BroadT	BRD-K61247793	BRD-K61247793-001-05-8	InterBioScreen Ltd.	STOCK3S-35452			COc1ccc(C=NNc2nc(c(NC(C)=O)s2)-c2ccc(C)cc2)cc1OC	InChI=1S/C21H22N4O3S/c1-13-5-8-16(9-6-13)19-20(23-14(2)26)29-21(24-19)25-22-12-15-7-10-17(27-3)18(11-15)28-4/h5-12H,1-4H3,(H,23,26)(H,24,25)	HDGPPVFZLOSWLZ-UHFFFAOYSA-N	410.141261294							108216
MLS000027467	LSM-19594	BRD-K13807637, SID848267	650705	InChI=1S/C22H29N5O2S/c1-18-7-9-21(10-8-18)30(28,29)25-22-23-16-27(17-24-22)20-11-13-26(14-12-20)15-19-5-3-2-4-6-19/h2-10,20H,11-17H2,1H3,(H2,23,24,25)	VIDKBODSYYBQMG-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NC2=NCN(CN2)C3CCN(Cc4ccccc4)CC3	BroadT	BRD-K13807637	BRD-K13807637-001-04-1	Asinex Ltd.	BAS 04213402			Cc1ccc(cc1)S(=O)(=O)N=C1NCN(CN1)C1CCN(Cc2ccccc2)CC1	InChI=1S/C22H29N5O2S/c1-18-7-9-21(10-8-18)30(28,29)25-22-23-16-27(17-24-22)20-11-13-26(14-12-20)15-19-5-3-2-4-6-19/h2-10,20H,11-17H2,1H3,(H2,23,24,25)	VIDKBODSYYBQMG-UHFFFAOYSA-N	427.204195908							108217
MLS000562337	LSM-19595	BRD-K40206099, SID17504409	814542	InChI=1S/C11H9N3S/c1-6-2-3-8-7(4-6)9-10(14-8)11(15)13-5-12-9/h2-5,14H,1H3,(H,12,13,15)	OPSQLIZRTSSPAW-UHFFFAOYSA-N	Cc1ccc2[nH]c3c(S)ncnc3c2c1	BroadT	BRD-K40206099	BRD-K40206099-001-05-1	Asinex Ltd.	BAS 00411460			Cc1ccc2[nH]c3c(S)ncnc3c2c1	InChI=1S/C11H9N3S/c1-6-2-3-8-7(4-6)9-10(14-8)11(15)13-5-12-9/h2-5,14H,1H3,(H,12,13,15)	OPSQLIZRTSSPAW-UHFFFAOYSA-N	215.051718008							108218
MLS000695219	LSM-19596	BRD-K74948793, SID24816936	3811783	InChI=1S/C17H19FN8/c1-12-11-13(2)26(23-12)17-21-19-16(20-22-17)25-9-7-24(8-10-25)15-5-3-14(18)4-6-15/h3-6,11H,7-10H2,1-2H3	ZLGIVSGBGDQGOY-UHFFFAOYSA-N	Cc1cc(C)n(n1)c2nnc(nn2)N3CCN(CC3)c4ccc(F)cc4	BroadT	BRD-K74948793	BRD-K74948793-001-05-6	Key Organics Ltd.	6G-071			Cc1cc(C)n(n1)-c1nnc(nn1)N1CCN(CC1)c1ccc(F)cc1	InChI=1S/C17H19FN8/c1-12-11-13(2)26(23-12)17-21-19-16(20-22-17)25-9-7-24(8-10-25)15-5-3-14(18)4-6-15/h3-6,11H,7-10H2,1-2H3	ZLGIVSGBGDQGOY-UHFFFAOYSA-N	354.171670888							108219
AC1L7JS9	LSM-19597	BRD-K81463178	311711	InChI=1S/C17H19N3O2/c1-20(2)15-10-8-14(9-11-15)12-18-19-17(21)13-22-16-6-4-3-5-7-16/h3-12H,13H2,1-2H3,(H,19,21)	BLNHXABCCLZUFM-UHFFFAOYSA-N	CN(C)c1ccc(C=NNC(=O)COc2ccccc2)cc1	BroadT	BRD-K81463178	BRD-K81463178-001-05-2	Enamine Ltd.	T0400-2986			CN(C)c1ccc(C=NNC(=O)COc2ccccc2)cc1	InChI=1S/C17H19N3O2/c1-20(2)15-10-8-14(9-11-15)12-18-19-17(21)13-22-16-6-4-3-5-7-16/h3-12H,13H2,1-2H3,(H,19,21)	BLNHXABCCLZUFM-UHFFFAOYSA-N	297.147726878							108220
N-(2,4-Difluorophenyl)-3-methoxybenzamide	LSM-19598	BRD-K40001470, SID14719010	803653	InChI=1S/C14H11F2NO2/c1-19-11-4-2-3-9(7-11)14(18)17-13-6-5-10(15)8-12(13)16/h2-8H,1H3,(H,17,18)	WZBHDZAZWSMBDF-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Nc2ccc(F)cc2F	BroadT	BRD-K40001470	BRD-K40001470-001-05-5	Specs	AK-968/11368765			COc1cccc(c1)C(=O)Nc1ccc(F)cc1F	InChI=1S/C14H11F2NO2/c1-19-11-4-2-3-9(7-11)14(18)17-13-6-5-10(15)8-12(13)16/h2-8H,1H3,(H,17,18)	WZBHDZAZWSMBDF-UHFFFAOYSA-N	263.075785002							108221
ZINC00572054	LSM-19599	BRD-K15620114, SID17415178	962079	InChI=1S/C18H18N2O3S/c1-11-3-5-14(12(2)9-11)17(21)20-18(24)19-13-4-6-15-16(10-13)23-8-7-22-15/h3-6,9-10H,7-8H2,1-2H3,(H2,19,20,21,24)	YMGUVTJMZDLHAP-UHFFFAOYSA-N	Cc1ccc(C(=O)NC(=S)Nc2ccc3OCCOc3c2)c(C)c1	BroadT	BRD-K15620114	BRD-K15620114-001-05-5	ChemBridge Corporation	7736343			Cc1ccc(C(=O)NC(=S)Nc2ccc3OCCOc3c2)c(C)c1	InChI=1S/C18H18N2O3S/c1-11-3-5-14(12(2)9-11)17(21)20-18(24)19-13-4-6-15-16(10-13)23-8-7-22-15/h3-6,9-10H,7-8H2,1-2H3,(H2,19,20,21,24)	YMGUVTJMZDLHAP-UHFFFAOYSA-N	342.103813146							108222
6-(4-Heptyloxy-phenyl)-nicotinonitrile	LSM-19600	BRD-K21819164, SID17507187	3126290	InChI=1S/C19H22N2O/c1-2-3-4-5-6-13-22-18-10-8-17(9-11-18)19-12-7-16(14-20)15-21-19/h7-12,15H,2-6,13H2,1H3	PDEYNIQMZJWFNN-UHFFFAOYSA-N	CCCCCCCOc1ccc(cc1)c2ccc(cn2)C#N	BroadT	BRD-K21819164	BRD-K21819164-001-05-4	Asinex Ltd.	BAS 01123777			CCCCCCCOc1ccc(cc1)-c1ccc(cn1)C#N	InChI=1S/C19H22N2O/c1-2-3-4-5-6-13-22-18-10-8-17(9-11-18)19-12-7-16(14-20)15-21-19/h7-12,15H,2-6,13H2,1H3	PDEYNIQMZJWFNN-UHFFFAOYSA-N	294.173213344							108223
CBDIVE_008036	LSM-19601	BRD-K23029982	678528	InChI=1S/C12H11N3OS/c1-9(11-3-2-8-17-11)14-15-12(16)10-4-6-13-7-5-10/h2-8H,1H3,(H,15,16)	ZVBINISUCJCXIC-UHFFFAOYSA-N	CC(=NNC(=O)c1ccncc1)c2cccs2	BroadT	BRD-K23029982	BRD-K23029982-001-05-8	Asinex Ltd.	BAS 00314776			CC(=NNC(=O)c1ccncc1)c1cccs1	InChI=1S/C12H11N3OS/c1-9(11-3-2-8-17-11)14-15-12(16)10-4-6-13-7-5-10/h2-8H,1H3,(H,15,16)	ZVBINISUCJCXIC-UHFFFAOYSA-N	245.062282692							108224
441314-01-8	LSM-15544	BRD-A98795688	2896493	InChI=1S/C18H23N3O/c1-12-9-13(2)21(19-12)11-16(22)10-20-15(4)14(3)17-7-5-6-8-18(17)20/h5-9,16,22H,10-11H2,1-4H3	ZHZAKMREZSLKFF-UHFFFAOYSA-N	Cc1cc(C)n(CC(O)Cn2c(C)c(C)c3ccccc23)n1	BroadT	BRD-A98795688	BRD-A98795688-034-05-4	ChemBridge Corporation	6388023		OC(=O)C(=O)O	Cc1cc(C)n(CC(O)Cn2c(C)c(C)c3ccccc23)n1.OC(=O)C(=O)O	InChI=1S/C18H23N3O.C2H2O4/c1-12-9-13(2)21(19-12)11-16(22)10-20-15(4)14(3)17-7-5-6-8-18(17)20;3-1(4)2(5)6/h5-9,16,22H,10-11H2,1-4H3;(H,3,4)(H,5,6)	ZMLXIPKZSLFETD-UHFFFAOYSA-N	297.184112386							104180, 104180
AN-329/41572454	LSM-19602	BRD-K26200833, SID22403375	1014365	InChI=1S/C21H18N2O2S/c24-14-15-5-4-8-19(13-15)22-21(26)23-20(25)18-11-9-17(10-12-18)16-6-2-1-3-7-16/h1-13,24H,14H2,(H2,22,23,25,26)	JBJANFNKRULZHU-UHFFFAOYSA-N	OCc1cccc(NC(=S)NC(=O)c2ccc(cc2)c3ccccc3)c1	BroadT	BRD-K26200833	BRD-K26200833-001-05-3	Specs	AN-329/41572454			OCc1cccc(NC(=S)NC(=O)c2ccc(cc2)-c2ccccc2)c1	InChI=1S/C21H18N2O2S/c24-14-15-5-4-8-19(13-15)22-21(26)23-20(25)18-11-9-17(10-12-18)16-6-2-1-3-7-16/h1-13,24H,14H2,(H2,22,23,25,26)	JBJANFNKRULZHU-UHFFFAOYSA-N	362.108898526							108225
1,3-Dimethyl-8-(4-phenylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione	LSM-19603	BRD-K08489825, SID24794280	949903	InChI=1S/C17H20N6O2/c1-20-14-13(15(24)21(2)17(20)25)18-16(19-14)23-10-8-22(9-11-23)12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H,18,19)	CYQZBNXFVGWVOS-UHFFFAOYSA-N	CN1C(=O)N(C)c2[nH]c(nc2C1=O)N3CCN(CC3)c4ccccc4	BroadT	BRD-K08489825	BRD-K08489825-001-05-4	ChemBridge Corporation	7886424			Cn1c2[nH]c(nc2c(=O)n(C)c1=O)N1CCN(CC1)c1ccccc1	InChI=1S/C17H20N6O2/c1-20-14-13(15(24)21(2)17(20)25)18-16(19-14)23-10-8-22(9-11-23)12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H,18,19)	CYQZBNXFVGWVOS-UHFFFAOYSA-N	340.16477394							108226
SMR000011762	LSM-19604	BRD-K80232129, SID844329	646649	InChI=1S/C16H14O3S/c1-9-15-12(17)7-11(14-5-4-6-20-14)8-13(18-3)16(15)10(2)19-9/h4-8H,1-3H3	QDMVZWDWJDRLQK-UHFFFAOYSA-N	COC1=CC(=CC(=O)c2c(C)oc(C)c12)c3cccs3	BroadT	BRD-K80232129	BRD-K80232129-001-11-0	Asinex Ltd.	BAS 03016782			COc1cc(cc(=O)c2c(C)oc(C)c12)-c1cccs1	InChI=1S/C16H14O3S/c1-9-15-12(17)7-11(14-5-4-6-20-14)8-13(18-3)16(15)10(2)19-9/h4-8H,1-3H3	QDMVZWDWJDRLQK-UHFFFAOYSA-N	286.066364998							108227
AG-670/40802986	LSM-19605	SID17386538, BRD-K63299069	1048156	InChI=1S/C20H22ClN3O4S/c1-26-15-3-5-16(6-4-15)28-13-19(25)23-20(29)22-14-2-7-18(17(21)12-14)24-8-10-27-11-9-24/h2-7,12H,8-11,13H2,1H3,(H2,22,23,25,29)	UCMOLHKBDUPFHL-UHFFFAOYSA-N	COc1ccc(OCC(=O)NC(=S)Nc2ccc(N3CCOCC3)c(Cl)c2)cc1	BroadT	BRD-K63299069	BRD-K63299069-001-05-4	Specs	AG-670/40802986			COc1ccc(OCC(=O)NC(=S)Nc2ccc(N3CCOCC3)c(Cl)c2)cc1	InChI=1S/C20H22ClN3O4S/c1-26-15-3-5-16(6-4-15)28-13-19(25)23-20(29)22-14-2-7-18(17(21)12-14)24-8-10-27-11-9-24/h2-7,12H,8-11,13H2,1H3,(H2,22,23,25,29)	UCMOLHKBDUPFHL-UHFFFAOYSA-N	435.101954614							108228
F0556-0272	LSM-19606	BRD-A89575866, SID17515542	3656804	InChI=1S/C31H26FN3O3S/c32-23-13-11-22(12-14-23)27-18-26(29-10-5-17-39-29)33-35(27)30(36)20-38-28-9-4-8-25-24(28)15-16-34(31(25)37)19-21-6-2-1-3-7-21/h1-14,17,27H,15-16,18-20H2	XRTUFOSKWSYDIT-UHFFFAOYSA-N	Fc1ccc(cc1)C2CC(=NN2C(=O)COc3cccc4C(=O)N(Cc5ccccc5)CCc34)c6cccs6	BroadT	BRD-A89575866	BRD-A89575866-001-05-4	Life Chemicals Inc.	F0556-0272			Fc1ccc(cc1)C1CC(=NN1C(=O)COc1cccc2C(=O)N(Cc3ccccc3)CCc12)c1cccs1	InChI=1S/C31H26FN3O3S/c32-23-13-11-22(12-14-23)27-18-26(29-10-5-17-39-29)33-35(27)30(36)20-38-28-9-4-8-25-24(28)15-16-34(31(25)37)19-21-6-2-1-3-7-21/h1-14,17,27H,15-16,18-20H2	XRTUFOSKWSYDIT-UHFFFAOYSA-N	539.167890612							108229
MLS000073300	LSM-19607	BRD-K08036779, SID851382	653951	InChI=1S/C17H18N4O4S/c22-15(20-5-9-23-10-6-20)12-26-17-19-18-16(14-4-2-8-25-14)21(17)11-13-3-1-7-24-13/h1-4,7-8H,5-6,9-12H2	OYGMRCOIBKIZKE-UHFFFAOYSA-N	O=C(CSc1nnc(c2occc2)n1Cc3occc3)N4CCOCC4	BroadT	BRD-K08036779	BRD-K08036779-001-06-7	Asinex Ltd.	ASN 04037537			O=C(CSc1nnc(-c2ccco2)n1Cc1ccco1)N1CCOCC1	InChI=1S/C17H18N4O4S/c22-15(20-5-9-23-10-6-20)12-26-17-19-18-16(14-4-2-8-25-14)21(17)11-13-3-1-7-24-13/h1-4,7-8H,5-6,9-12H2	OYGMRCOIBKIZKE-UHFFFAOYSA-N	374.104875786							108230
MLS001096216	LSM-19608	BRD-K05471809, SID24405398, SID49731408	16026922	InChI=1S/C23H27FN6O/c1-16-20(9-12-23(31)25-19-8-6-7-18(24)15-19)17(2)30(28-16)22-11-10-21(26-27-22)29-13-4-3-5-14-29/h6-8,10-11,15H,3-5,9,12-14H2,1-2H3,(H,25,31)	HAIPZRHDHJTYCR-UHFFFAOYSA-N	Cc1nn(c(C)c1CCC(=O)Nc2cccc(F)c2)c3ccc(nn3)N4CCCCC4	BroadT	BRD-K05471809	BRD-K05471809-001-06-3	ChemDiv Inc.	G267-0855			Cc1nn(c(C)c1CCC(=O)Nc1cccc(F)c1)-c1ccc(nn1)N1CCCCC1	InChI=1S/C23H27FN6O/c1-16-20(9-12-23(31)25-19-8-6-7-18(24)15-19)17(2)30(28-16)22-11-10-21(26-27-22)29-13-4-3-5-14-29/h6-8,10-11,15H,3-5,9,12-14H2,1-2H3,(H,25,31)	HAIPZRHDHJTYCR-UHFFFAOYSA-N	422.223037744							108231
SMR000141770	LSM-19609	SID14740629, BRD-K12460566	1345918	InChI=1S/C19H24N4OS/c1-4-23-14(2)17(15(3)24)18(20-19(23)25)22-12-10-21(11-13-22)16-8-6-5-7-9-16/h5-9H,4,10-13H2,1-3H3	RTDIDWVVPJYUCA-UHFFFAOYSA-N	CCN1C(=C(C(=O)C)C(=NC1=S)N2CCN(CC2)c3ccccc3)C	BroadT	BRD-K12460566	BRD-K12460566-001-06-0	ChemBridge Corporation	6607080			CCn1c(C)c(C(C)=O)c(nc1=S)N1CCN(CC1)c1ccccc1	InChI=1S/C19H24N4OS/c1-4-23-14(2)17(15(3)24)18(20-19(23)25)22-12-10-21(11-13-22)16-8-6-5-7-9-16/h5-9H,4,10-13H2,1-3H3	RTDIDWVVPJYUCA-UHFFFAOYSA-N	356.167082118							108232
AC1LHV8F	LSM-19610	BRD-K93811242	869791	InChI=1S/C17H15N5O/c18-17(23)20-19-11-14-12-22(15-9-5-2-6-10-15)21-16(14)13-7-3-1-4-8-13/h1-12H,(H3,18,20,23)	GANUFCGHYJZVLE-UHFFFAOYSA-N	NC(=O)NN=Cc1cn(nc1c2ccccc2)c3ccccc3	BroadT	BRD-K93811242	BRD-K93811242-001-05-0	Enamine Ltd.	T0503-4343			NC(=O)NN=Cc1cn(nc1-c1ccccc1)-c1ccccc1	InChI=1S/C17H15N5O/c18-17(23)20-19-11-14-12-22(15-9-5-2-6-10-15)21-16(14)13-7-3-1-4-8-13/h1-12H,(H3,18,20,23)	GANUFCGHYJZVLE-UHFFFAOYSA-N	305.12766015							108233
BAS 02943838	LSM-43847	BRD-K73523821, SID17504621	5767237	InChI=1S/C18H19N3O4S3/c1-24-12-4-3-11(9-13(12)25-2)10-14-16(23)21(18(26)28-14)7-5-15(22)20-17-19-6-8-27-17/h3-4,9-10H,5-8H2,1-2H3,(H,19,20,22)/b14-10-	XTEVMDVJWSDMHG-UVTDQMKNSA-N	COc1ccc(\C=C\2/SC(=S)N(CCC(=O)NC3=NCCS3)C2=O)cc1OC	BroadT	BRD-K73523821	BRD-K73523821-001-05-4	Asinex Ltd.	BAS 02943838			COc1ccc(\C=C2/SC(=S)N(CCC(=O)NC3=NCCS3)C2=O)cc1OC	InChI=1S/C18H19N3O4S3/c1-24-12-4-3-11(9-13(12)25-2)10-14-16(23)21(18(26)28-14)7-5-15(22)20-17-19-6-8-27-17/h3-4,9-10H,5-8H2,1-2H3,(H,19,20,22)/b14-10-	XTEVMDVJWSDMHG-UVTDQMKNSA-N	437.053768188							
3-[(Acetyloxy)methyl]-7-{[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-methylpropanoyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid	LSM-19612	BRD-A98714080, SID24814630	4222854	InChI=1S/C19H23ClN4O6S/c1-8(5-23-10(3)13(20)9(2)22-23)16(26)21-14-17(27)24-15(19(28)29)12(6-30-11(4)25)7-31-18(14)24/h8,14,18H,5-7H2,1-4H3,(H,21,26)(H,28,29)	GLWRNZFZGQSOCS-UHFFFAOYSA-N	CC(Cn1nc(C)c(Cl)c1C)C(=O)NC2C3SCC(=C(N3C2=O)C(=O)O)COC(=O)C	BroadT	BRD-A98714080	BRD-A98714080-001-06-6	ChemDiv Inc.	D052-0113			CC(Cn1nc(C)c(Cl)c1C)C(=O)NC1C2SCC(COC(C)=O)=C(N2C1=O)C(O)=O	InChI=1S/C19H23ClN4O6S/c1-8(5-23-10(3)13(20)9(2)22-23)16(26)21-14-17(27)24-15(19(28)29)12(6-30-11(4)25)7-31-18(14)24/h8,14,18H,5-7H2,1-4H3,(H,21,26)(H,28,29)	GLWRNZFZGQSOCS-UHFFFAOYSA-N	470.102682896							108235
MLS000538604	LSM-19613	BRD-K99944747, SID14732063	2235340	InChI=1S/C17H17NO5/c1-22-16(20)11-6-8-18(9-7-11)15(19)13-10-12-4-2-3-5-14(12)23-17(13)21/h2-5,10-11H,6-9H2,1H3	SVGHNFFSCWKXDJ-UHFFFAOYSA-N	COC(=O)C1CCN(CC1)C(=O)C2=Cc3ccccc3OC2=O	BroadT	BRD-K99944747	BRD-K99944747-001-05-3	ChemBridge Corporation	7975018			COC(=O)C1CCN(CC1)C(=O)c1cc2ccccc2oc1=O	InChI=1S/C17H17NO5/c1-22-16(20)11-6-8-18(9-7-11)15(19)13-10-12-4-2-3-5-14(12)23-17(13)21/h2-5,10-11H,6-9H2,1H3	SVGHNFFSCWKXDJ-UHFFFAOYSA-N	315.110672654							108236
ST50850674	LSM-19614	BRD-K02065805, SID24793279	970707	InChI=1S/C17H15N3O2S/c1-11-8-16(21)22-15-9-12(5-6-14(11)15)20-17(23)19-10-13-4-2-3-7-18-13/h2-9H,10H2,1H3,(H2,19,20,23)	IGKRBWTWRQNUEN-UHFFFAOYSA-N	CC1=CC(=O)Oc2cc(NC(=NCc3ccccn3)S)ccc12	BroadT	BRD-K02065805	BRD-K02065805-001-05-2	ChemBridge Corporation	7804039			Cc1cc(=O)oc2cc(NC(S)=NCc3ccccn3)ccc12	InChI=1S/C17H15N3O2S/c1-11-8-16(21)22-15-9-12(5-6-14(11)15)20-17(23)19-10-13-4-2-3-7-18-13/h2-9H,10H2,1H3,(H2,19,20,23)	IGKRBWTWRQNUEN-UHFFFAOYSA-N	325.08849744							108237
MLS000671944	LSM-19615	BRD-K32084247, SID24797090	1298562	InChI=1S/C15H12F4N2O2/c1-8-2-4-12(13(6-8)23-14(18)19)21-15(22)20-11-5-3-9(16)7-10(11)17/h2-7,14H,1H3,(H2,20,21,22)	ZNQDIRRWCMWISP-UHFFFAOYSA-N	Cc1ccc(NC(=O)Nc2ccc(F)cc2F)c(OC(F)F)c1	BroadT	BRD-K32084247	BRD-K32084247-001-06-1	ChemBridge Corporation	7825640			Cc1ccc(NC(=O)Nc2ccc(F)cc2F)c(OC(F)F)c1	InChI=1S/C15H12F4N2O2/c1-8-2-4-12(13(6-8)23-14(18)19)21-15(22)20-11-5-3-9(16)7-10(11)17/h2-7,14H,1H3,(H2,20,21,22)	ZNQDIRRWCMWISP-UHFFFAOYSA-N	328.083490444							108238
ZINC02870420	LSM-19616	BRD-K00883748, SID24786044	2223181	InChI=1S/C14H11ClFNO4S/c1-20-14(19)13-10(4-5-22-13)17-12(18)7-21-11-3-2-8(16)6-9(11)15/h2-6H,7H2,1H3,(H,17,18)	HYOFEFOGCYEUEZ-UHFFFAOYSA-N	COC(=O)c1sccc1NC(=O)COc2ccc(F)cc2Cl	BroadT	BRD-K00883748	BRD-K00883748-001-05-0	ChemBridge Corporation	7930339			COC(=O)c1sccc1NC(=O)COc1ccc(F)cc1Cl	InChI=1S/C14H11ClFNO4S/c1-20-14(19)13-10(4-5-22-13)17-12(18)7-21-11-3-2-8(16)6-9(11)15/h2-6H,7H2,1H3,(H,17,18)	HYOFEFOGCYEUEZ-UHFFFAOYSA-N	343.008134442							108239
MLS000094096	LSM-19617	BRD-A64774838, SID4248629	3242690	InChI=1S/C17H17N3O2S/c1-22-14-6-4-13(5-7-14)15(20-9-2-3-10-20)12-16(21)19-17-18-8-11-23-17/h2-11,15H,12H2,1H3,(H,18,19,21)	RNYXEDXOIPJGGW-UHFFFAOYSA-N	COc1ccc(cc1)C(CC(=O)Nc2nccs2)n3cccc3	BroadT	BRD-A64774838	BRD-A64774838-001-05-7	ChemDiv Inc.	C920-0278			COc1ccc(cc1)C(CC(=O)Nc1nccs1)n1cccc1	InChI=1S/C17H17N3O2S/c1-22-14-6-4-13(5-7-14)15(20-9-2-3-10-20)12-16(21)19-17-18-8-11-23-17/h2-11,15H,12H2,1H3,(H,18,19,21)	RNYXEDXOIPJGGW-UHFFFAOYSA-N	327.104147504							108240
5E-311S	LSM-19618	SID17402962, BRD-K07615667	1478446	InChI=1S/C16H9ClF3N3O/c17-10-5-1-2-7-12(10)24-14-9-13(16(18,19)20)22-15(23-14)11-6-3-4-8-21-11/h1-9H	KCIGSSKTLZLPQL-UHFFFAOYSA-N	FC(F)(F)c1cc(Oc2ccccc2Cl)nc(n1)c3ccccn3	BroadT	BRD-K07615667	BRD-K07615667-001-06-4	Key Organics Ltd.	5E-311S			FC(F)(F)c1cc(Oc2ccccc2Cl)nc(n1)-c1ccccn1	InChI=1S/C16H9ClF3N3O/c17-10-5-1-2-7-12(10)24-14-9-13(16(18,19)20)22-15(23-14)11-6-3-4-8-21-11/h1-9H	KCIGSSKTLZLPQL-UHFFFAOYSA-N	351.038624248							108241
1-(2,3-Dihydro-1H-indol-1-yl)-2-(phenylsulfanyl)-1-ethanone	LSM-19619	SID14732657	736577	InChI=1S/C16H15NOS/c18-16(12-19-14-7-2-1-3-8-14)17-11-10-13-6-4-5-9-15(13)17/h1-9H,10-12H2	ZJXSCVDERLYXLA-UHFFFAOYSA-N	O=C(CSc1ccccc1)N2CCc3ccccc23	BroadT	BRD-K09366011	BRD-K09366011-001-05-7	ChemBridge Corporation	6807530			O=C(CSc1ccccc1)N1CCc2ccccc12	InChI=1S/C16H15NOS/c18-16(12-19-14-7-2-1-3-8-14)17-11-10-13-6-4-5-9-15(13)17/h1-9H,10-12H2	ZJXSCVDERLYXLA-UHFFFAOYSA-N	269.0874348							108242
SMR000013405	LSM-19620	BRD-K66717300, SID849008	651474	InChI=1S/C17H16FN5O2/c18-13-2-4-14(5-3-13)24-11-16-22-15(10-19)17(25-16)21-6-1-8-23-9-7-20-12-23/h2-5,7,9,12,21H,1,6,8,11H2	LZHVIPISAHVSNV-UHFFFAOYSA-N	Fc1ccc(OCc2oc(NCCCn3ccnc3)c(n2)C#N)cc1	BroadT	BRD-K66717300	BRD-K66717300-001-05-1	Asinex Ltd.	BAS 05509769			Fc1ccc(OCc2nc(C#N)c(NCCCn3ccnc3)o2)cc1	InChI=1S/C17H16FN5O2/c18-13-2-4-14(5-3-13)24-11-16-22-15(10-19)17(25-16)21-6-1-8-23-9-7-20-12-23/h2-5,7,9,12,21H,1,6,8,11H2	LZHVIPISAHVSNV-UHFFFAOYSA-N	341.128803002							108243
N'-(1,3-benzothiazol-2-yl)-4-fluorobenzohydrazide	LSM-19621	BRD-K38536183, SID17512018	919597	InChI=1S/C14H10FN3OS/c15-10-7-5-9(6-8-10)13(19)17-18-14-16-11-3-1-2-4-12(11)20-14/h1-8H,(H,16,18)(H,17,19)	JAJVQVHCAJWYPQ-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)NNc2nc3ccccc3s2	BroadT	BRD-K38536183	BRD-K38536183-001-05-2	InterBioScreen Ltd.	STOCK2S-08651			Fc1ccc(cc1)C(=O)NNc1nc2ccccc2s1	InChI=1S/C14H10FN3OS/c15-10-7-5-9(6-8-10)13(19)17-18-14-16-11-3-1-2-4-12(11)20-14/h1-8H,(H,16,18)(H,17,19)	JAJVQVHCAJWYPQ-UHFFFAOYSA-N	287.05286086							108244
CID 53646141	LSM-19622	BRD-A17635048	53646141	InChI=1S/C18H22N2O4/c1-5-23-17(21)14-11(3)20-12(4)15(18(22)24-6-2)16(14)13-9-7-8-10-19-13/h7-10,14,16H,5-6H2,1-4H3	AJLVNTLWHVMFEJ-UHFFFAOYSA-N	CCOC(=O)C1C(C(=C(C)N=C1C)C(=O)OCC)c2ccccn2	BroadT	BRD-A17635048	BRD-A17635048-001-06-2	National Cancer Institute Chemotherapeutic Agents Repository	Diethyl 2,6-dimethyl-4(2-pyridyl)-1,4-dihydro-3,5-pyridine-dicarboxylate;23125-28-2 291934			CCOC(=O)C1C(c2ccccn2)C(C(=O)OCC)=C(C)N=C1C	InChI=1S/C18H22N2O4/c1-5-23-17(21)14-11(3)20-12(4)15(18(22)24-6-2)16(14)13-9-7-8-10-19-13/h7-10,14,16H,5-6H2,1-4H3	AJLVNTLWHVMFEJ-UHFFFAOYSA-N	330.157957204							108245
SMR000078203	LSM-19623	SID4254622, BRD-K22185032	849905	InChI=1S/C18H25FN4O2/c19-15-4-6-16(7-5-15)20-17(24)14-21-10-12-23(13-11-21)18(25)22-8-2-1-3-9-22/h4-7H,1-3,8-14H2,(H,20,24)	AKKHSCHUDQWGTF-UHFFFAOYSA-N	Fc1ccc(NC(=O)CN2CCN(CC2)C(=O)N3CCCCC3)cc1	BroadT	BRD-K22185032	BRD-K22185032-001-05-9	ChemBridge Corporation	7904527			Fc1ccc(NC(=O)CN2CCN(CC2)C(=O)N2CCCCC2)cc1	InChI=1S/C18H25FN4O2/c19-15-4-6-16(7-5-15)20-17(24)14-21-10-12-23(13-11-21)18(25)22-8-2-1-3-9-22/h4-7H,1-3,8-14H2,(H,20,24)	AKKHSCHUDQWGTF-UHFFFAOYSA-N	348.19615428							108246
MLS000703965	LSM-19624	BRD-K30217326, SID22403472	842651	InChI=1S/C14H15N5OS/c1-9-10(8-18(2)17-9)13-15-16-14(21)19(13)11-6-4-5-7-12(11)20-3/h4-8H,1-3H3,(H,16,21)	GFKNQTAYZDYWHT-UHFFFAOYSA-N	COc1ccccc1n2c(S)nnc2c3cn(C)nc3C	BroadT	BRD-K30217326	BRD-K30217326-001-05-5	Specs	AK-968/41169632			COc1ccccc1-n1c(S)nnc1-c1cn(C)nc1C	InChI=1S/C14H15N5OS/c1-9-10(8-18(2)17-9)13-15-16-14(21)19(13)11-6-4-5-7-12(11)20-3/h4-8H,1-3H3,(H,16,21)	GFKNQTAYZDYWHT-UHFFFAOYSA-N	301.09973084							108247
SMR000021777	LSM-19625	BRD-K54850621, SID24838839, SID4244703	3239269	InChI=1S/C20H19F3N4O5S/c1-12-10-17(27-32-12)26-18(28)8-5-9-33(29,30)19-24-14(11-16(25-19)20(21,22)23)13-6-3-4-7-15(13)31-2/h3-4,6-7,10-11H,5,8-9H2,1-2H3,(H,26,27,28)	FVEJIAQBCVTZMO-UHFFFAOYSA-N	COc1ccccc1c2cc(nc(n2)S(=O)(=O)CCCC(=O)Nc3cc(C)on3)C(F)(F)F	BroadT	BRD-K54850621	BRD-K54850621-001-05-6	ChemDiv Inc.	C071-0415			COc1ccccc1-c1cc(nc(n1)S(=O)(=O)CCCC(=O)Nc1cc(C)on1)C(F)(F)F	InChI=1S/C20H19F3N4O5S/c1-12-10-17(27-32-12)26-18(28)8-5-9-33(29,30)19-24-14(11-16(25-19)20(21,22)23)13-6-3-4-7-15(13)31-2/h3-4,6-7,10-11H,5,8-9H2,1-2H3,(H,26,27,28)	FVEJIAQBCVTZMO-UHFFFAOYSA-N	484.102825038							108248
9M-924	LSM-43848	BRD-K24532125, SID17402708	5810026	InChI=1S/C14H12O3/c1-16-13-5-2-11(3-6-13)4-7-14(15)12-8-9-17-10-12/h2-10H,1H3/b7-4+	ATIQXFYTSDVDTE-QPJJXVBHSA-N	COc1ccc(\C=C\C(=O)c2cocc2)cc1	BroadT	BRD-K24532125	BRD-K24532125-001-06-6	Key Organics Ltd.	9M-924			COc1ccc(\C=C\C(=O)c2ccoc2)cc1	InChI=1S/C14H12O3/c1-16-13-5-2-11(3-6-13)4-7-14(15)12-8-9-17-10-12/h2-10H,1H3/b7-4+	ATIQXFYTSDVDTE-QPJJXVBHSA-N	228.078644244							
ZINC03350090	LSM-19627	BRD-K98772859, SID14743684	2467159	InChI=1S/C21H17N3O3S/c1-13-18(23-20(27-13)15-6-4-3-5-7-15)19(25)24-21-22-17(12-28-21)14-8-10-16(26-2)11-9-14/h3-12H,1-2H3,(H,22,24,25)	ISZFUGIWEYWMBK-UHFFFAOYSA-N	COc1ccc(cc1)c2csc(NC(=O)c3nc(oc3C)c4ccccc4)n2	BroadT	BRD-K98772859	BRD-K98772859-001-05-3	Enamine Ltd.	T5321224			COc1ccc(cc1)-c1csc(NC(=O)c2nc(oc2C)-c2ccccc2)n1	InChI=1S/C21H17N3O3S/c1-13-18(23-20(27-13)15-6-4-3-5-7-15)19(25)24-21-22-17(12-28-21)14-8-10-16(26-2)11-9-14/h3-12H,1-2H3,(H,22,24,25)	ISZFUGIWEYWMBK-UHFFFAOYSA-N	391.099062124							108250
MLS000764647	LSM-19628	SID24807610, BRD-A75607876	2929189	InChI=1S/C15H25NO4/c1-13(2,3)16-12(18)10-8-11(17)20-15(10)6-7-19-14(4,5)9-15/h10H,6-9H2,1-5H3,(H,16,18)	PLNPBKIDHMPJCC-UHFFFAOYSA-N	CC(C)(C)NC(=O)C1CC(=O)OC12CCOC(C)(C)C2	BroadT	BRD-A75607876	BRD-A75607876-001-06-7	Asinex Ltd.	BAS 05372120			CC(C)(C)NC(=O)C1CC(=O)OC11CCOC(C)(C)C1	InChI=1S/C15H25NO4/c1-13(2,3)16-12(18)10-8-11(17)20-15(10)6-7-19-14(4,5)9-15/h10H,6-9H2,1-5H3,(H,16,18)	PLNPBKIDHMPJCC-UHFFFAOYSA-N	283.17835829							108251
MLS000665185	LSM-19629	BRD-K11342801, SID22404445	1121652	InChI=1S/C21H20N2O/c24-21(18-8-7-16-5-1-2-6-17(16)15-18)22-19-9-11-20(12-10-19)23-13-3-4-14-23/h1-2,5-12,15H,3-4,13-14H2,(H,22,24)	GYSRXOOQGROMHA-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)N2CCCC2)c3ccc4ccccc4c3	BroadT	BRD-K11342801	BRD-K11342801-001-06-6	ChemBridge Corporation	6771907			O=C(Nc1ccc(cc1)N1CCCC1)c1ccc2ccccc2c1	InChI=1S/C21H20N2O/c24-21(18-8-7-16-5-1-2-6-17(16)15-18)22-19-9-11-20(12-10-19)23-13-3-4-14-23/h1-2,5-12,15H,3-4,13-14H2,(H,22,24)	GYSRXOOQGROMHA-UHFFFAOYSA-N	316.15756328							108252
MLS000849701	LSM-19630	BRD-K01377768, SID26670427	16682648	InChI=1S/C19H19N3O3/c1-12-3-6-17-14(9-12)11-25-19-15-5-4-13(10-16(15)21-22(17)19)18(23)20-7-8-24-2/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,23)	XCUSFBCLMOHZJW-UHFFFAOYSA-N	COCCNC(=O)c1ccc2c3OCc4cc(C)ccc4n3nc2c1	BroadT	BRD-K01377768	BRD-K01377768-001-05-7	University of California at Davis	JDB-013			COCCNC(=O)c1ccc2c3OCc4cc(C)ccc4-n3nc2c1	InChI=1S/C19H19N3O3/c1-12-3-6-17-14(9-12)11-25-19-15-5-4-13(10-16(15)21-22(17)19)18(23)20-7-8-24-2/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,23)	XCUSFBCLMOHZJW-UHFFFAOYSA-N	337.142641498							108253
N-(2-Cyclohex-1-enyl-ethyl)-4-morpholin-4-ylmethyl-benzamide	LSM-19631	BRD-K09878843, SID842298	644557	InChI=1S/C20H28N2O2/c23-20(21-11-10-17-4-2-1-3-5-17)19-8-6-18(7-9-19)16-22-12-14-24-15-13-22/h4,6-9H,1-3,5,10-16H2,(H,21,23)	ZNJHVYUEUYXHNI-UHFFFAOYSA-N	O=C(NCCC1=CCCCC1)c2ccc(CN3CCOCC3)cc2	BroadT	BRD-K09878843	BRD-K09878843-001-05-5	Asinex Ltd.	BAS 04923456			O=C(NCCC1=CCCCC1)c1ccc(CN2CCOCC2)cc1	InChI=1S/C20H28N2O2/c23-20(21-11-10-17-4-2-1-3-5-17)19-8-6-18(7-9-19)16-22-12-14-24-15-13-22/h4,6-9H,1-3,5,10-16H2,(H,21,23)	ZNJHVYUEUYXHNI-UHFFFAOYSA-N	328.215078156							108254
286409-64-1	LSM-19632	BRD-A36938160, SID17512870	2729826	InChI=1S/C8H12N2O4/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h5-6,13-14H,1-4H2	QBIMPGNQKASPJE-UHFFFAOYSA-N	ON1C2CCCCC2N(O)C(=O)C1=O	BroadT	BRD-A36938160	BRD-A36938160-001-05-1	InterBioScreen Ltd.	STOCK1S-09481			ON1C2CCCCC2N(O)C(=O)C1=O	InChI=1S/C8H12N2O4/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h5-6,13-14H,1-4H2	QBIMPGNQKASPJE-UHFFFAOYSA-N	200.079706884							108255
ZINC00645299	LSM-19633	BRD-K89278382, SID4260776	992277	InChI=1S/C14H14ClN3O4S/c1-9-6-10(15)12(7-11(9)22-8-13(16)19)23(20,21)18-14-4-2-3-5-17-14/h2-7H,8H2,1H3,(H2,16,19)(H,17,18)	KCMVDXWJEYEPFA-UHFFFAOYSA-N	Cc1cc(Cl)c(cc1OCC(=O)N)S(=O)(=O)Nc2ccccn2	BroadT	BRD-K89278382	BRD-K89278382-001-05-8	ChemBridge Corporation	7726535			Cc1cc(Cl)c(cc1OCC(N)=O)S(=O)(=O)Nc1ccccn1	InChI=1S/C14H14ClN3O4S/c1-9-6-10(15)12(7-11(9)22-8-13(16)19)23(20,21)18-14-4-2-3-5-17-14/h2-7H,8H2,1H3,(H2,16,19)(H,17,18)	KCMVDXWJEYEPFA-UHFFFAOYSA-N	355.039354358							108256
AC1ML6EP	LSM-15545	BRD-A01848933	3168743	InChI=1S/C20H27N3O2S/c1-2-5-17(6-3-1)19-15-21-20(23(19)16-18-7-4-11-25-18)26-14-10-22-8-12-24-13-9-22/h1-3,5-6,15,18H,4,7-14,16H2	KVTXZXQSXDFEFG-UHFFFAOYSA-N	C(CN1CCOCC1)Sc2ncc(c3ccccc3)n2CC4CCCO4	BroadT	BRD-A01848933	BRD-A01848933-034-05-0	Asinex Ltd.	ASN 03017611		OC(=O)C(=O)O	C(CN1CCOCC1)Sc1ncc(-c2ccccc2)n1CC1CCCO1.OC(=O)C(=O)O	InChI=1S/C20H27N3O2S.C2H2O4/c1-2-5-17(6-3-1)19-15-21-20(23(19)16-18-7-4-11-25-18)26-14-10-22-8-12-24-13-9-22;3-1(4)2(5)6/h1-3,5-6,15,18H,4,7-14,16H2;(H,3,4)(H,5,6)	XYAAFAOPDOEUJL-UHFFFAOYSA-N	373.182397824							104181, 104181
AC1LCSKI	LSM-15500	BRD-K36397874	655357	InChI=1S/C21H26N4O3/c1-6-28-12-15-10-22-14(3)24-21(15)23-11-19(26)20-13(2)25(4)18-8-7-16(27-5)9-17(18)20/h7-10H,6,11-12H2,1-5H3,(H,22,23,24)	HUYQSJDFPUAWJV-UHFFFAOYSA-N	CCOCc1cnc(C)nc1NCC(=O)c2c(C)n(C)c3ccc(OC)cc23	BroadT	BRD-K36397874	BRD-K36397874-005-04-9	Asinex Ltd.	BAS 00519298		I	CCOCc1cnc(C)nc1NCC(=O)c1c(C)n(C)c2ccc(OC)cc12.I	InChI=1S/C21H26N4O3.HI/c1-6-28-12-15-10-22-14(3)24-21(15)23-11-19(26)20-13(2)25(4)18-8-7-16(27-5)9-17(18)20;/h7-10H,6,11-12H2,1-5H3,(H,22,23,24);1H	PXZMJISQDZWWOA-UHFFFAOYSA-N	382.200490732							104141, 104141
AC1O99MX	LSM-19634	BRD-K23196166	6752208	InChI=1S/C18H22N4O4/c1-11(2)26-14-7-4-13(5-8-14)6-9-16(23)22-19-10-15-12(3)20-18(25)21-17(15)24/h4-5,7-8,10-11H,6,9H2,1-3H3,(H,22,23)(H2,20,21,24,25)	OYGCQRDQFFCEBA-UHFFFAOYSA-N	CC(C)Oc1ccc(CCC(=O)NN=Cc2c(C)nc(O)nc2O)cc1	BroadT	BRD-K23196166	BRD-K23196166-001-03-8	Asinex Ltd.	BAS 01506381			CC(C)Oc1ccc(CCC(=O)NN=Cc2c(C)nc(O)nc2O)cc1	InChI=1S/C18H22N4O4/c1-11(2)26-14-7-4-13(5-8-14)6-9-16(23)22-19-10-15-12(3)20-18(25)21-17(15)24/h4-5,7-8,10-11H,6,9H2,1-3H3,(H,22,23)(H2,20,21,24,25)	OYGCQRDQFFCEBA-UHFFFAOYSA-N	358.164105224							
ZINC00682812	LSM-19635	BRD-K01314849	1019724	InChI=1S/C19H14ClN3O4/c1-11-17(18(23-27-11)12-5-3-2-4-6-12)19(24)22-21-9-13-7-15-16(8-14(13)20)26-10-25-15/h2-9H,10H2,1H3,(H,22,24)	KBVHDJIFLWXTDG-UHFFFAOYSA-N	Cc1onc(c2ccccc2)c1C(=O)NN=Cc3cc4OCOc4cc3Cl	BroadT	BRD-K01314849	BRD-K01314849-001-05-3	Specs	AK-968/36929109			Cc1onc(c1C(=O)NN=Cc1cc2OCOc2cc1Cl)-c1ccccc1	InChI=1S/C19H14ClN3O4/c1-11-17(18(23-27-11)12-5-3-2-4-6-12)19(24)22-21-9-13-7-15-16(8-14(13)20)26-10-25-15/h2-9H,10H2,1H3,(H,22,24)	KBVHDJIFLWXTDG-UHFFFAOYSA-N	383.067283668							108258
SMR000039304	LSM-19636	BRD-K45969405	5389063	InChI=1S/C24H27N5O5/c1-15(19-20(30)16-6-4-5-7-17(16)21(19)31)29-12-10-28(11-13-29)9-8-25-14-18-22(32)26(2)24(34)27(3)23(18)33/h4-7,14,25H,8-13H2,1-3H3	HMLZZVRTHJMYLK-UHFFFAOYSA-N	CN1C(=O)N(C)C(=O)C(=CNCCN2CCN(CC2)C(C)=C2C(=O)c3ccccc3C2=O)C1=O	BroadT	BRD-K45969405	BRD-K45969405-001-05-8	InterBioScreen Ltd.	STOCK1S-49908			CN1C(=O)N(C)C(=O)C(=CNCCN2CCN(CC2)C(C)=C2C(=O)c3ccccc3C2=O)C1=O	InChI=1S/C24H27N5O5/c1-15(19-20(30)16-6-4-5-7-17(16)21(19)31)29-12-10-28(11-13-29)9-8-25-14-18-22(32)26(2)24(34)27(3)23(18)33/h4-7,14,25H,8-13H2,1-3H3	HMLZZVRTHJMYLK-UHFFFAOYSA-N	465.201219014							108259
SMR000148193	LSM-19637	SID14743427, BRD-K41620124	3424501	InChI=1S/C24H34N6OS2/c1-5-29(6-2)8-7-25-21-20-19(26-15-27-21)18-16-13-24(3,4)32-14-17(16)22(28-23(18)33-20)30-9-11-31-12-10-30/h15H,5-14H2,1-4H3,(H,25,26,27)	IXJCEFRSLCTOIL-UHFFFAOYSA-N	CCN(CC)CCNc1ncnc2c1sc3nc(N4CCOCC4)c5CSC(C)(C)Cc5c23	BroadT	BRD-K41620124	BRD-K41620124-001-08-5	InterBioScreen Ltd.	STOCK4S-14179			CCN(CC)CCNc1ncnc2c1sc1nc(N3CCOCC3)c3CSC(C)(C)Cc3c21	InChI=1S/C24H34N6OS2/c1-5-29(6-2)8-7-25-21-20-19(26-15-27-21)18-16-13-24(3,4)32-14-17(16)22(28-23(18)33-20)30-9-11-31-12-10-30/h15H,5-14H2,1-4H3,(H,25,26,27)	IXJCEFRSLCTOIL-UHFFFAOYSA-N	486.223551148							108260
SMR000035373	LSM-19638	BRD-A28219573, SID865776	667037	InChI=1S/C22H26N6O2S2/c1-14-7-6-10-27(13-14)20-24-18-17(19(29)26(3)22(30)25(18)2)28(20)11-12-31-21-23-15-8-4-5-9-16(15)32-21/h4-5,8-9,14H,6-7,10-13H2,1-3H3	MFEWOASOCGWVJY-UHFFFAOYSA-N	CC1CCCN(C1)c2nc3N(C)C(=O)N(C)C(=O)c3n2CCSc4nc5ccccc5s4	BroadT	BRD-A28219573	BRD-A28219573-001-05-7	InterBioScreen Ltd.	STOCK5S-52567			CC1CCCN(C1)c1nc2n(C)c(=O)n(C)c(=O)c2n1CCSc1nc2ccccc2s1	InChI=1S/C22H26N6O2S2/c1-14-7-6-10-27(13-14)20-24-18-17(19(29)26(3)22(30)25(18)2)28(20)11-12-31-21-23-15-8-4-5-9-16(15)32-21/h4-5,8-9,14H,6-7,10-13H2,1-3H3	MFEWOASOCGWVJY-UHFFFAOYSA-N	470.155865512							108261
T0508-9833	LSM-19639	BRD-A11350423, SID17516450	3439283	InChI=1S/C22H18O4/c23-20(16-25-19-14-8-3-9-15-19)26-22(18-12-6-2-7-13-18)21(24)17-10-4-1-5-11-17/h1-15,22H,16H2	NYLMZJJRTNVOAI-UHFFFAOYSA-N	O=C(COc1ccccc1)OC(C(=O)c2ccccc2)c3ccccc3	BroadT	BRD-A11350423	BRD-A11350423-001-05-1	Enamine Ltd.	T0508-9833			O=C(COc1ccccc1)OC(C(=O)c1ccccc1)c1ccccc1	InChI=1S/C22H18O4/c23-20(16-25-19-14-8-3-9-15-19)26-22(18-12-6-2-7-13-18)21(24)17-10-4-1-5-11-17/h1-15,22H,16H2	NYLMZJJRTNVOAI-UHFFFAOYSA-N	346.120509056							108262
ST50165841	LSM-19640	BRD-A74615450, SID14738800	2957167	InChI=1S/C16H24N2OS/c1-14-5-11-6-15(2,8-14)10-16(7-11,9-14)12(19)18-13-17-3-4-20-13/h11H,3-10H2,1-2H3,(H,17,18,19)	XLVMPERBAHLQIC-UHFFFAOYSA-N	CC12CC3CC(C)(C1)CC(C3)(C2)C(=O)NC4=NCCS4	BroadT	BRD-A74615450	BRD-A74615450-001-05-7	ChemBridge Corporation	7824572			CC12CC3CC(C)(C1)CC(C3)(C2)C(=O)NC1=NCCS1	InChI=1S/C16H24N2OS/c1-14-5-11-6-15(2,8-14)10-16(7-11,9-14)12(19)18-13-17-3-4-20-13/h11H,3-10H2,1-2H3,(H,17,18,19)	XLVMPERBAHLQIC-UHFFFAOYSA-N	292.160934098							108263
SMR000047564	LSM-19641	BRD-K50092006, SID865040	666286	InChI=1S/C25H28N6/c1-3-9-21-18-23(30-16-14-29(15-17-30)22-12-7-8-13-26-22)31-25(27-21)24(19(2)28-31)20-10-5-4-6-11-20/h4-8,10-13,18H,3,9,14-17H2,1-2H3	SKCHVQGQMSDADA-UHFFFAOYSA-N	CCCc1cc(N2CCN(CC2)c3ccccn3)n4nc(C)c(c5ccccc5)c4n1	BroadT	BRD-K50092006	BRD-K50092006-001-05-4	InterBioScreen Ltd.	STOCK5S-35005			CCCc1cc(N2CCN(CC2)c2ccccn2)n2nc(C)c(-c3ccccc3)c2n1	InChI=1S/C25H28N6/c1-3-9-21-18-23(30-16-14-29(15-17-30)22-12-7-8-13-26-22)31-25(27-21)24(19(2)28-31)20-10-5-4-6-11-20/h4-8,10-13,18H,3,9,14-17H2,1-2H3	SKCHVQGQMSDADA-UHFFFAOYSA-N	412.237544956							108264
MLS000693808	LSM-19642	BRD-K32881384, SID24791993	739852	InChI=1S/C18H17N3O2/c1-12-7-8-15-14(11-12)17(13-5-3-2-4-6-13)21-18(20-15)19-10-9-16(22)23/h2-8,11H,9-10H2,1H3,(H,22,23)(H,19,20,21)	DTPLBMZQZYRCFA-UHFFFAOYSA-N	Cc1ccc2nc(NCCC(=O)O)nc(c3ccccc3)c2c1	BroadT	BRD-K32881384	BRD-K32881384-001-06-3	ChemBridge Corporation	7733664			Cc1ccc2nc(NCCC(O)=O)nc(-c3ccccc3)c2c1	InChI=1S/C18H17N3O2/c1-12-7-8-15-14(11-12)17(13-5-3-2-4-6-13)21-18(20-15)19-10-9-16(22)23/h2-8,11H,9-10H2,1H3,(H,22,23)(H,19,20,21)	DTPLBMZQZYRCFA-UHFFFAOYSA-N	307.132076814							108265
1-(4-Methoxy-benzyl)-4-(4-trifluoromethyl-benzyl)-piperazine	LSM-15546	BRD-K21936026	1222759	InChI=1S/C20H23F3N2O/c1-26-19-8-4-17(5-9-19)15-25-12-10-24(11-13-25)14-16-2-6-18(7-3-16)20(21,22)23/h2-9H,10-15H2,1H3	QCNHHYSOAAGAKW-UHFFFAOYSA-N	COc1ccc(CN2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cc1	BroadT	BRD-K21936026	BRD-K21936026-034-05-5	Asinex Ltd.	BAS 01234585		OC(=O)C(=O)O	COc1ccc(CN2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cc1.OC(=O)C(=O)O	InChI=1S/C20H23F3N2O.C2H2O4/c1-26-19-8-4-17(5-9-19)15-25-12-10-24(11-13-25)14-16-2-6-18(7-3-16)20(21,22)23;3-1(4)2(5)6/h2-9H,10-15H2,1H3;(H,3,4)(H,5,6)	IOAGCRDCXKVNOK-UHFFFAOYSA-N	364.176247976							104182, 104182
BAS 09687536	LSM-19643	BRD-A54389315, SID24781628	3158983	InChI=1S/C17H19NO2S/c1-11-7-8-12-13(10-21-16(12)9-11)17(19)18-14-5-3-4-6-15(14)20-2/h3-6,10-11H,7-9H2,1-2H3,(H,18,19)	QYNZXQXMPQZCLK-UHFFFAOYSA-N	COc1ccccc1NC(=O)c2csc3CC(C)CCc23	BroadT	BRD-A54389315	BRD-A54389315-001-05-8	Asinex Ltd.	BAS 09687536			COc1ccccc1NC(=O)c1csc2CC(C)CCc12	InChI=1S/C17H19NO2S/c1-11-7-8-12-13(10-21-16(12)9-11)17(19)18-14-5-3-4-6-15(14)20-2/h3-6,10-11H,7-9H2,1-2H3,(H,18,19)	QYNZXQXMPQZCLK-UHFFFAOYSA-N	301.113649548							108266
AC1LW7UF	LSM-19644	BRD-K90797575	1720018	InChI=1S/C25H25N3O5S/c1-19-7-9-20(10-8-19)16-26-27-25(29)18-28(17-21-5-3-2-4-6-21)34(30,31)22-11-12-23-24(15-22)33-14-13-32-23/h2-12,15-16H,13-14,17-18H2,1H3,(H,27,29)	LRZVHYFVDSQGJP-UHFFFAOYSA-N	Cc1ccc(C=NNC(=O)CN(Cc2ccccc2)S(=O)(=O)c3ccc4OCCOc4c3)cc1	BroadT	BRD-K90797575	BRD-K90797575-001-05-1	Asinex Ltd.	BAS 00402180			Cc1ccc(C=NNC(=O)CN(Cc2ccccc2)S(=O)(=O)c2ccc3OCCOc3c2)cc1	InChI=1S/C25H25N3O5S/c1-19-7-9-20(10-8-19)16-26-27-25(29)18-28(17-21-5-3-2-4-6-21)34(30,31)22-11-12-23-24(15-22)33-14-13-32-23/h2-12,15-16H,13-14,17-18H2,1H3,(H,27,29)	LRZVHYFVDSQGJP-UHFFFAOYSA-N	479.15149162							108267
1P-321S	LSM-19645	SID17402348, BRD-A57474391	4594520	InChI=1S/C25H21N3O2S2/c1-16-10-12-17(13-11-16)23(29)26-21-8-4-5-9-22(21)31-14-18-15-32-25-27-20-7-3-2-6-19(20)24(30)28(18)25/h2-13,18H,14-15H2,1H3,(H,26,29)	XFTXNXNDSSZOSJ-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)Nc2ccccc2SCC3CSC4=Nc5ccccc5C(=O)N34	BroadT	BRD-A57474391	BRD-A57474391-001-05-2	Key Organics Ltd.	1P-321S			Cc1ccc(cc1)C(=O)Nc1ccccc1SCC1CSc2nc3ccccc3c(=O)n12	InChI=1S/C25H21N3O2S2/c1-16-10-12-17(13-11-16)23(29)26-21-8-4-5-9-22(21)31-14-18-15-32-25-27-20-7-3-2-6-19(20)24(30)28(18)25/h2-13,18H,14-15H2,1H3,(H,26,29)	XFTXNXNDSSZOSJ-UHFFFAOYSA-N	459.107518322							108268
F0631-0401	LSM-19646	BRD-A01717111, SID4242058	3236960	InChI=1S/C14H16N4O3S/c1-9-15-14-18(16-9)13(19)12(22-14)11(10-3-2-6-21-10)17-4-7-20-8-5-17/h2-3,6,11,19H,4-5,7-8H2,1H3	AVSQPCDYTBQJQM-UHFFFAOYSA-N	Cc1nc2sc(C(N3CCOCC3)c4occc4)c(O)n2n1	BroadT	BRD-A01717111	BRD-A01717111-001-06-8	Life Chemicals Inc.	F0631-0401			Cc1nc2sc(C(N3CCOCC3)c3ccco3)c(O)n2n1	InChI=1S/C14H16N4O3S/c1-9-15-14-18(16-9)13(19)12(22-14)11(10-3-2-6-21-10)17-4-7-20-8-5-17/h2-3,6,11,19H,4-5,7-8H2,1H3	AVSQPCDYTBQJQM-UHFFFAOYSA-N	320.094311102							108269
OPREA1_723974	LSM-19647	BRD-K74688087, SID24813828	16194156	InChI=1S/C17H18N2O6/c1-24-15-6-3-11(9-16(15)25-2)7-8-18-13-5-4-12(17(20)21)10-14(13)19(22)23/h3-6,9-10,18H,7-8H2,1-2H3,(H,20,21)	KOCALSLUENBTBQ-UHFFFAOYSA-N	COc1ccc(CCNc2ccc(cc2[N+](=O)[O-])C(=O)O)cc1OC	BroadT	BRD-K74688087	BRD-K74688087-001-06-1	ChemDiv Inc.	K781-0469			COc1ccc(CCNc2ccc(cc2[N+]([O-])=O)C(O)=O)cc1OC	InChI=1S/C17H18N2O6/c1-24-15-6-3-11(9-16(15)25-2)7-8-18-13-5-4-12(17(20)21)10-14(13)19(22)23/h3-6,9-10,18H,7-8H2,1-2H3,(H,20,21)	KOCALSLUENBTBQ-UHFFFAOYSA-N	346.116486316							108270
2-Methoxy-4-[(4-methyl-1,4-diazepan-1-yl)methyl]-6-nitrophenol	LSM-19648	BRD-K06489778, SID47201862	796756	InChI=1S/C14H21N3O4/c1-15-4-3-5-16(7-6-15)10-11-8-12(17(19)20)14(18)13(9-11)21-2/h8-9,18H,3-7,10H2,1-2H3	ULYUWBYPEDDMBQ-UHFFFAOYSA-N	COc1cc(CN2CCCN(C)CC2)cc(c1O)[N+](=O)[O-]	BroadT	BRD-K06489778	BRD-K06489778-001-05-3	ChemBridge Corporation	5265886			COc1cc(CN2CCCN(C)CC2)cc(c1O)[N+]([O-])=O	InChI=1S/C14H21N3O4/c1-15-4-3-5-16(7-6-15)10-11-8-12(17(19)20)14(18)13(9-11)21-2/h8-9,18H,3-7,10H2,1-2H3	ULYUWBYPEDDMBQ-UHFFFAOYSA-N	295.153206182							108271
MLS000070728	LSM-19649	BRD-K22063616, SID847663	650073	InChI=1S/C17H16N2O3/c20-17(19-7-9-21-10-8-19)18-12-5-6-14-13-3-1-2-4-15(13)22-16(14)11-12/h1-6,11H,7-10H2,(H,18,20)	MVWIJRRHQKNOJU-UHFFFAOYSA-N	O=C(Nc1ccc2c(oc3ccccc23)c1)N4CCOCC4	BroadT	BRD-K22063616	BRD-K22063616-001-06-0	Asinex Ltd.	BAS 03711030			O=C(Nc1ccc2c(c1)oc1ccccc21)N1CCOCC1	InChI=1S/C17H16N2O3/c20-17(19-7-9-21-10-8-19)18-12-5-6-14-13-3-1-2-4-15(13)22-16(14)11-12/h1-6,11H,7-10H2,(H,18,20)	MVWIJRRHQKNOJU-UHFFFAOYSA-N	296.116092392							108272
MLS000584836	LSM-19650	BRD-A16313205, SID17510560	5323445	InChI=1S/C17H17F3N4O4/c1-4-28-15(25)11-12(9-6-5-7-10(26-2)13(9)27-3)24-16(21-8-22-24)23-14(11)17(18,19)20/h5-8,12H,4H2,1-3H3,(H,21,22,23)	QEWPEMXZDHNPNK-UHFFFAOYSA-N	CCOC(=O)C1=C(Nc2ncnn2C1c3cccc(OC)c3OC)C(F)(F)F	BroadT	BRD-A16313205	BRD-A16313205-001-05-8	ChemDiv Inc.	K832-3611			CCOC(=O)C1=C(Nc2ncnn2C1c1cccc(OC)c1OC)C(F)(F)F	InChI=1S/C17H17F3N4O4/c1-4-28-15(25)11-12(9-6-5-7-10(26-2)13(9)27-3)24-16(21-8-22-24)23-14(11)17(18,19)20/h5-8,12H,4H2,1-3H3,(H,21,22,23)	QEWPEMXZDHNPNK-UHFFFAOYSA-N	398.120189664							108273
AC1M7T1J	LSM-19651	BRD-K30963311, SID24833815	2473781	InChI=1S/C16H20N4O4S2/c1-19(8-2-7-17)16(25)18-15(21)13-3-5-14(6-4-13)26(22,23)20-9-11-24-12-10-20/h3-6H,2,8-12H2,1H3,(H,18,21,25)	SWUCYXHWVXHDMP-UHFFFAOYSA-N	CN(CCC#N)C(=S)NC(=O)c1ccc(cc1)S(=O)(=O)N2CCOCC2	BroadT	BRD-K30963311	BRD-K30963311-001-05-1	Enamine Ltd.	T0519-0211			CN(CCC#N)C(=S)NC(=O)c1ccc(cc1)S(=O)(=O)N1CCOCC1	InChI=1S/C16H20N4O4S2/c1-19(8-2-7-17)16(25)18-15(21)13-3-5-14(6-4-13)26(22,23)20-9-11-24-12-10-20/h3-6H,2,8-12H2,1H3,(H,18,21,25)	SWUCYXHWVXHDMP-UHFFFAOYSA-N	396.09259654							108274
BAS 03635759	LSM-19652	SID24789055, BRD-A41183160	3148328	InChI=1S/C14H15F3N2O3/c15-14(16,17)13(21)9-5-2-1-3-6-10(9)18-19(13)12(20)11-7-4-8-22-11/h4,7-9,21H,1-3,5-6H2	MLZOQSJEXLROFX-UHFFFAOYSA-N	OC1(C2CCCCCC2=NN1C(=O)c3occc3)C(F)(F)F	BroadT	BRD-A41183160	BRD-A41183160-001-05-7	Asinex Ltd.	BAS 03635759			OC1(C2CCCCCC2=NN1C(=O)c1ccco1)C(F)(F)F	InChI=1S/C14H15F3N2O3/c15-14(16,17)13(21)9-5-2-1-3-6-10(9)18-19(13)12(20)11-7-4-8-22-11/h4,7-9,21H,1-3,5-6H2	MLZOQSJEXLROFX-UHFFFAOYSA-N	316.10347696							108275
CHEMDIV3_003307	LSM-15296	BRD-A05055724	2882028	InChI=1S/C16H19ClN2/c1-2-18-8-9-19-14-7-6-11(17)10-13(14)12-4-3-5-15(18)16(12)19/h6-7,10,15H,2-5,8-9H2,1H3	NHESABHACNFJOA-UHFFFAOYSA-N	CCN1CCn2c3C1CCCc3c4cc(Cl)ccc24	BroadT	BRD-A05055724	BRD-A05055724-003-12-2	ChemDiv Inc.	4401-0076		Cl	CCN1CCn2c3C1CCCc3c1cc(Cl)ccc21.Cl	InChI=1S/C16H19ClN2.ClH/c1-2-18-8-9-19-14-7-6-11(17)10-13(14)12-4-3-5-15(18)16(12)19;/h6-7,10,15H,2-5,8-9H2,1H3;1H	RTBVUBNWLGQGSK-UHFFFAOYSA-N	274.123676338							103943, 103943
SMR000035727	LSM-19653	SID858370, BRD-K86074537	535812	InChI=1S/C12H12ClN5/c13-10-5-3-9(4-6-10)11-14-16-12(17-15-11)18-7-1-2-8-18/h3-6H,1-2,7-8H2	DHASBLMRLCYQMW-UHFFFAOYSA-N	Clc1ccc(cc1)c2nnc(nn2)N3CCCC3	BroadT	BRD-K86074537	BRD-K86074537-001-05-8	InterBioScreen Ltd.	STOCK2S-40271			Clc1ccc(cc1)-c1nnc(nn1)N1CCCC1	InChI=1S/C12H12ClN5/c13-10-5-3-9(4-6-10)11-14-16-12(17-15-11)18-7-1-2-8-18/h3-6H,1-2,7-8H2	DHASBLMRLCYQMW-UHFFFAOYSA-N	261.078123144							108276
4-[(5-Methyl-2,4-diphenyl-2H-pyrazol-3-ylimino)-methyl]-phenol	LSM-19654	BRD-K84314542	5443199	InChI=1S/C23H19N3O/c1-17-22(19-8-4-2-5-9-19)23(24-16-18-12-14-21(27)15-13-18)26(25-17)20-10-6-3-7-11-20/h2-16,27H,1H3	RXVFWGSBVGEYKM-UHFFFAOYSA-N	Cc1nn(c2ccccc2)c(N=Cc3ccc(O)cc3)c1c4ccccc4	BroadT	BRD-K84314542	BRD-K84314542-001-05-3	Asinex Ltd.	BAS 01318374			Cc1nn(c(N=Cc2ccc(O)cc2)c1-c1ccccc1)-c1ccccc1	InChI=1S/C23H19N3O/c1-17-22(19-8-4-2-5-9-19)23(24-16-18-12-14-21(27)15-13-18)26(25-17)20-10-6-3-7-11-20/h2-16,27H,1H3	RXVFWGSBVGEYKM-UHFFFAOYSA-N	353.152812258							
STK572884	LSM-19655	SID17512082, BRD-A43525162	4887037	InChI=1S/C25H19BrN4O5/c1-28-20-12-11-19(30(34)35)13-16(20)14-25(21(28)15-5-3-2-4-6-15)22(31)27-24(33)29(23(25)32)18-9-7-17(26)8-10-18/h2-13,21H,14H2,1H3,(H,27,31,33)	OWZAHLFMWUAULW-UHFFFAOYSA-N	CN1C(c2ccccc2)C3(Cc4cc(ccc14)[N+](=O)[O-])C(=O)NC(=O)N(C3=O)c5ccc(Br)cc5	BroadT	BRD-A43525162	BRD-A43525162-001-05-5	InterBioScreen Ltd.	STOCK5S-34144			CN1C(c2ccccc2)C2(Cc3cc(ccc13)[N+]([O-])=O)C(=O)NC(=O)N(c1ccc(Br)cc1)C2=O	InChI=1S/C25H19BrN4O5/c1-28-20-12-11-19(30(34)35)13-16(20)14-25(21(28)15-5-3-2-4-6-15)22(31)27-24(33)29(23(25)32)18-9-7-17(26)8-10-18/h2-13,21H,14H2,1H3,(H,27,31,33)	OWZAHLFMWUAULW-UHFFFAOYSA-N	534.053882348							108278
SMR000059774	LSM-43849	SID862148, BRD-K02193775	5389696	InChI=1S/C19H23N3O5/c1-5-7-22-18(24)16(17(23)21-19(22)25)15(6-2)20-11-12-8-13(26-3)10-14(9-12)27-4/h5,8-10,20H,1,6-7,11H2,2-4H3,(H,21,23,25)/b16-15+	FJYDIHGTMMOLMQ-FOCLMDBBSA-N	CC\C(=C/1\C(=O)NC(=O)N(CC=C)C1=O)\NCc2cc(OC)cc(OC)c2	BroadT	BRD-K02193775	BRD-K02193775-001-05-8	InterBioScreen Ltd.	STOCK4S-31199			CC\C(NCc1cc(OC)cc(OC)c1)=C1\C(=O)NC(=O)N(CC=C)C1=O	InChI=1S/C19H23N3O5/c1-5-7-22-18(24)16(17(23)21-19(22)25)15(6-2)20-11-12-8-13(26-3)10-14(9-12)27-4/h5,8-10,20H,1,6-7,11H2,2-4H3,(H,21,23,25)/b16-15+	FJYDIHGTMMOLMQ-FOCLMDBBSA-N	373.163770866							
AC1NSEIF	LSM-19657	SID7966630, BRD-K61048870	5308344	InChI=1S/C15H19N3O2S/c19-21(20,17-9-12-18-10-1-2-11-18)14-7-3-5-13-6-4-8-16-15(13)14/h3-8,17H,1-2,9-12H2	UFIOGZZRIUTCJD-UHFFFAOYSA-N	O=S(=O)(NCCN1CCCC1)c2cccc3cccnc23	BroadT	BRD-K61048870	BRD-K61048870-001-05-6	ChemDiv Inc.	C224-1341			O=S(=O)(NCCN1CCCC1)c1cccc2cccnc12	InChI=1S/C15H19N3O2S/c19-21(20,17-9-12-18-10-1-2-11-18)14-7-3-5-13-6-4-8-16-15(13)14/h3-8,17H,1-2,9-12H2	UFIOGZZRIUTCJD-UHFFFAOYSA-N	305.119797568							108280
2H-Indol-2-one, 1,3-dihydro-3-[(phenylamino)methylene]-, (z)-	LSM-19658	BRD-K97503114	6614295	InChI=1S/C15H12N2O/c18-15-13(10-16-11-6-2-1-3-7-11)12-8-4-5-9-14(12)17-15/h1-10,17-18H	KOBUXAQDZSROAT-UHFFFAOYSA-N	Oc1[nH]c2ccccc2c1C=Nc3ccccc3	BroadT	BRD-K97503114	BRD-K97503114-001-05-4	InterBioScreen Ltd.	STOCK1S-35962			Oc1[nH]c2ccccc2c1C=Nc1ccccc1	InChI=1S/C15H12N2O/c18-15-13(10-16-11-6-2-1-3-7-11)12-8-4-5-9-14(12)17-15/h1-10,17-18H	KOBUXAQDZSROAT-UHFFFAOYSA-N	236.094963024							
STK286532	LSM-19659	SID17510247, BRD-A65744491	4693003	InChI=1S/C25H22N2O4/c1-15-7-12-19-20(14-15)24(29)27(23(19)28)18-10-8-17(9-11-18)25(30)31-21-6-2-4-16-5-3-13-26-22(16)21/h2-6,8-11,13,15,19-20H,7,12,14H2,1H3	FRIOBXUBAMOZEG-UHFFFAOYSA-N	CC1CCC2C(C1)C(=O)N(C2=O)c3ccc(cc3)C(=O)Oc4cccc5cccnc45	BroadT	BRD-A65744491	BRD-A65744491-001-05-7	ChemDiv Inc.	5782-5873			CC1CCC2C(C1)C(=O)N(C2=O)c1ccc(cc1)C(=O)Oc1cccc2cccnc12	InChI=1S/C25H22N2O4/c1-15-7-12-19-20(14-15)24(29)27(23(19)28)18-10-8-17(9-11-18)25(30)31-21-6-2-4-16-5-3-13-26-22(16)21/h2-6,8-11,13,15,19-20H,7,12,14H2,1H3	FRIOBXUBAMOZEG-UHFFFAOYSA-N	414.157957204							108282
BAS 01313001	LSM-19660	SID24807425, BRD-K14750527	1119846	InChI=1S/C12H24N6/c1-7-13-9-15-10(14-8(2)3)17-11(16-9)18-12(4,5)6/h8H,7H2,1-6H3,(H3,13,14,15,16,17,18)	APYGAJCXDCLDTA-UHFFFAOYSA-N	CCNc1nc(NC(C)C)nc(NC(C)(C)C)n1	BroadT	BRD-K14750527	BRD-K14750527-001-07-8	Asinex Ltd.	BAS 01313001			CCNc1nc(NC(C)C)nc(NC(C)(C)C)n1	InChI=1S/C12H24N6/c1-7-13-9-15-10(14-8(2)3)17-11(16-9)18-12(4,5)6/h8H,7H2,1-6H3,(H3,13,14,15,16,17,18)	APYGAJCXDCLDTA-UHFFFAOYSA-N	252.206244828							108283
F0417-1620	LSM-19661	SID22401554, BRD-K88387273	4188121	InChI=1S/C24H20N4O2S2/c29-21(28-14-6-10-17-8-2-4-13-20(17)28)15-31-24-27-26-23(32-24)25-22(30)19-12-5-9-16-7-1-3-11-18(16)19/h1-5,7-9,11-13H,6,10,14-15H2,(H,25,26,30)	VEPAUZAKNCMPMY-UHFFFAOYSA-N	O=C(CSc1nnc(NC(=O)c2cccc3ccccc23)s1)N4CCCc5ccccc45	BroadT	BRD-K88387273	BRD-K88387273-001-05-0	Life Chemicals Inc.	F0417-1620			O=C(CSc1nnc(NC(=O)c2cccc3ccccc23)s1)N1CCCc2ccccc12	InChI=1S/C24H20N4O2S2/c29-21(28-14-6-10-17-8-2-4-13-20(17)28)15-31-24-27-26-23(32-24)25-22(30)19-12-5-9-16-7-1-3-11-18(16)19/h1-5,7-9,11-13H,6,10,14-15H2,(H,25,26,30)	VEPAUZAKNCMPMY-UHFFFAOYSA-N	460.1027673							108284
ZINC05156922	LSM-19662	SID17516670, BRD-K50368950	6824369	InChI=1S/C18H20N4O2S/c1-4-24-17(23)15-11(2)16(19-12(15)3)14-10-25-18(22-21-14)20-13-8-6-5-7-9-13/h5-9,19H,4,10H2,1-3H3,(H,20,22)	HKZRQNAKIFHTMK-UHFFFAOYSA-N	CCOC(=O)c1c(C)[nH]c(C2=NN=C(Nc3ccccc3)SC2)c1C	BroadT	BRD-K50368950	BRD-K50368950-001-04-7	Enamine Ltd.	T5273529			CCOC(=O)c1c(C)[nH]c(c1C)C1=NN=C(Nc2ccccc2)SC1	InChI=1S/C18H20N4O2S/c1-4-24-17(23)15-11(2)16(19-12(15)3)14-10-25-18(22-21-14)20-13-8-6-5-7-9-13/h5-9,19H,4,10H2,1-3H3,(H,20,22)	HKZRQNAKIFHTMK-UHFFFAOYSA-N	356.13069661							
SMR000105885	LSM-19663	SID7975551, BRD-A55849588	2886166	InChI=1S/C20H22N2O3S/c1-4-20(3)10-12-8-6-7-9-13(12)16-15(20)17(23)22-11-14(18(24)25-5-2)26-19(22)21-16/h6-9,14H,4-5,10-11H2,1-3H3	WCHYMZBLYFSEHW-UHFFFAOYSA-N	CCOC(=O)C1CN2C(=NC3=C(C2=O)C(C)(CC)Cc4ccccc34)S1	BroadT	BRD-A55849588	BRD-A55849588-001-05-0	ChemBridge Corporation	6106300			CCOC(=O)C1Cn2c(S1)nc1-c3ccccc3CC(C)(CC)c1c2=O	InChI=1S/C20H22N2O3S/c1-4-20(3)10-12-8-6-7-9-13(12)16-15(20)17(23)22-11-14(18(24)25-5-2)26-19(22)21-16/h6-9,14H,4-5,10-11H2,1-3H3	WCHYMZBLYFSEHW-UHFFFAOYSA-N	370.135113274							108286
N-Cyclohexyl-9-pentofuranosyl-9H-purin-6-amine	LSM-19664	SID24824001, BRD-A74145933	2692	InChI=1S/C16H23N5O4/c22-6-10-12(23)13(24)16(25-10)21-8-19-11-14(17-7-18-15(11)21)20-9-4-2-1-3-5-9/h7-10,12-13,16,22-24H,1-6H2,(H,17,18,20)	SZBULDQSDUXAPJ-UHFFFAOYSA-N	OCC1OC(C(O)C1O)n2cnc3c(NC4CCCCC4)ncnc23	BroadT	BRD-A74145933	BRD-A74145933-001-04-5	InterBioScreen Ltd.	STOCK1N-00777			OCC1OC(C(O)C1O)n1cnc2c(NC3CCCCC3)ncnc12	InChI=1S/C16H23N5O4/c22-6-10-12(23)13(24)16(25-10)21-8-19-11-14(17-7-18-15(11)21)20-9-4-2-1-3-5-9/h7-10,12-13,16,22-24H,1-6H2,(H,17,18,20)	SZBULDQSDUXAPJ-UHFFFAOYSA-N	349.175004266							108287
AC1O9A8R	LSM-19665	SID861947, BRD-K16268342	6775937	InChI=1S/C21H24N4O3/c1-27-18-8-4-6-16(19(18)26)21-23-17-7-3-2-5-15(17)20(24-21)22-9-10-25-11-13-28-14-12-25/h2-8,26H,9-14H2,1H3,(H,22,23,24)	XCGXKGFYNQCIBP-UHFFFAOYSA-N	COc1cccc(c1O)c2nc(NCCN3CCOCC3)c4ccccc4n2	BroadT	BRD-K16268342	BRD-K16268342-001-05-6	InterBioScreen Ltd.	STOCK4S-24208			COc1cccc(c1O)-c1nc(NCCN2CCOCC2)c2ccccc2n1	InChI=1S/C21H24N4O3/c1-27-18-8-4-6-16(19(18)26)21-23-17-7-3-2-5-15(17)20(24-21)22-9-10-25-11-13-28-14-12-25/h2-8,26H,9-14H2,1H3,(H,22,23,24)	XCGXKGFYNQCIBP-UHFFFAOYSA-N	380.184840668							
N-[(2-Methoxyphenyl)carbamoyl]benzamide	LSM-19666	SID47199545, BRD-K42187320	2079312	InChI=1S/C15H14N2O3/c1-20-13-10-6-5-9-12(13)16-15(19)17-14(18)11-7-3-2-4-8-11/h2-10H,1H3,(H2,16,17,18,19)	LBONNRVEROSTMN-UHFFFAOYSA-N	COc1ccccc1NC(=O)NC(=O)c2ccccc2	BroadT	BRD-K42187320	BRD-K42187320-001-05-2	ChemBridge Corporation	9004124			COc1ccccc1NC(=O)NC(=O)c1ccccc1	InChI=1S/C15H14N2O3/c1-20-13-10-6-5-9-12(13)16-15(19)17-14(18)11-7-3-2-4-8-11/h2-10H,1H3,(H2,16,17,18,19)	LBONNRVEROSTMN-UHFFFAOYSA-N	270.100442328							108289
NSC628179	LSM-19667	SID14721589, SID493870, BRD-A53329279	363322	InChI=1S/C18H14N2O2/c21-17-10-14(15-11-19-16-9-5-4-8-13(15)16)18(22)20(17)12-6-2-1-3-7-12/h1-9,11,14,19H,10H2	YSZCDIFFVAZIBE-UHFFFAOYSA-N	O=C1CC(C(=O)N1c2ccccc2)c3c[nH]c4ccccc34	BroadT	BRD-A53329279	BRD-A53329279-001-08-3	Asinex Ltd.	BAS 03025121			O=C1CC(C(=O)N1c1ccccc1)c1c[nH]c2ccccc12	InChI=1S/C18H14N2O2/c21-17-10-14(15-11-19-16-9-5-4-8-13(15)16)18(22)20(17)12-6-2-1-3-7-12/h1-9,11,14,19H,10H2	YSZCDIFFVAZIBE-UHFFFAOYSA-N	290.105527708							108290
MLS000702831	LSM-19668	SID22413130, BRD-K08766593	1767613	InChI=1S/C13H19N3S2/c1-4-5-6-16-12(14-15-13(16)17)10-7-11(9(2)3)18-8-10/h7-9H,4-6H2,1-3H3,(H,15,17)	IDSUMIJKLQKIDV-UHFFFAOYSA-N	CCCCn1c(S)nnc1c2csc(c2)C(C)C	BroadT	BRD-K08766593	BRD-K08766593-001-05-5	Specs	AK-968/41924259			CCCCn1c(S)nnc1-c1csc(c1)C(C)C	InChI=1S/C13H19N3S2/c1-4-5-6-16-12(14-15-13(16)17)10-7-11(9(2)3)18-8-10/h7-9H,4-6H2,1-3H3,(H,15,17)	IDSUMIJKLQKIDV-UHFFFAOYSA-N	281.102039018							108291
MLS000763076	LSM-19669	SID26663967, BRD-K81231356	2029483	InChI=1S/C21H22N2O3/c1-13(2)21(25)22-20-18(15-10-6-8-12-17(15)26-4)19(24)14-9-5-7-11-16(14)23(20)3/h5-13H,1-4H3,(H,22,25)	WITCPHUEQLJCKH-UHFFFAOYSA-N	COc1ccccc1C2=C(NC(=O)C(C)C)N(C)c3ccccc3C2=O	BroadT	BRD-K81231356	BRD-K81231356-001-05-7	InterBioScreen Ltd.	STOCK5S-46425			COc1ccccc1-c1c(NC(=O)C(C)C)n(C)c2ccccc2c1=O	InChI=1S/C21H22N2O3/c1-13(2)21(25)22-20-18(15-10-6-8-12-17(15)26-4)19(24)14-9-5-7-11-16(14)23(20)3/h5-13H,1-4H3,(H,22,25)	WITCPHUEQLJCKH-UHFFFAOYSA-N	350.163042584							108292
MLS000566908	LSM-19670	SID17507049, BRD-K95689834	1162986	InChI=1S/C21H22N2O2S/c1-13-6-5-7-14(2)21(13)23-20(24)12-26-19-10-15(3)22-18-9-8-16(25-4)11-17(18)19/h5-11H,12H2,1-4H3,(H,23,24)	PZVMFLARDASJIX-UHFFFAOYSA-N	COc1ccc2nc(C)cc(SCC(=O)Nc3c(C)cccc3C)c2c1	BroadT	BRD-K95689834	BRD-K95689834-001-06-0	Asinex Ltd.	ASN 02915096			COc1ccc2nc(C)cc(SCC(=O)Nc3c(C)cccc3C)c2c1	InChI=1S/C21H22N2O2S/c1-13-6-5-7-14(2)21(13)23-20(24)12-26-19-10-15(3)22-18-9-8-16(25-4)11-17(18)19/h5-11H,12H2,1-4H3,(H,23,24)	PZVMFLARDASJIX-UHFFFAOYSA-N	366.140198654							108293
MLS000041806	LSM-43850	SID864509, BRD-K17354218	5389963	InChI=1S/C16H17N3O4/c1-4-7-19-15(21)12(14(20)18-16(19)22)9-17-13-6-5-11(23-3)8-10(13)2/h4-6,8-9,17H,1,7H2,2-3H3,(H,18,20,22)/b12-9+	UBURUZUUNQZPJQ-FMIVXFBMSA-N	COc1ccc(N\C=C\2/C(=O)NC(=O)N(CC=C)C2=O)c(C)c1	BroadT	BRD-K17354218	BRD-K17354218-001-06-2	InterBioScreen Ltd.	STOCK5S-24244			COc1ccc(N\C=C2/C(=O)NC(=O)N(CC=C)C2=O)c(C)c1	InChI=1S/C16H17N3O4/c1-4-7-19-15(21)12(14(20)18-16(19)22)9-17-13-6-5-11(23-3)8-10(13)2/h4-6,8-9,17H,1,7H2,2-3H3,(H,18,20,22)/b12-9+	UBURUZUUNQZPJQ-FMIVXFBMSA-N	315.121906054							
ST036730	LSM-19672	SID17433933, BRD-K29812820	1272230	InChI=1S/C18H15Cl2N3O/c1-12-2-7-15(19)8-17(12)22-18(24)14-5-3-13(4-6-14)10-23-11-16(20)9-21-23/h2-9,11H,10H2,1H3,(H,22,24)	XQNKEFPXJRALFI-UHFFFAOYSA-N	Cc1ccc(Cl)cc1NC(=O)c2ccc(Cn3cc(Cl)cn3)cc2	BroadT	BRD-K29812820	BRD-K29812820-001-07-3	ChemBridge Corporation	7496237			Cc1ccc(Cl)cc1NC(=O)c1ccc(cc1)Cn1ncc(Cl)c1	InChI=1S/C18H15Cl2N3O/c1-12-2-7-15(19)8-17(12)22-18(24)14-5-3-13(4-6-14)10-23-11-16(20)9-21-23/h2-9,11H,10H2,1H3,(H,22,24)	XQNKEFPXJRALFI-UHFFFAOYSA-N	359.05921755							108295
SMR000033256	LSM-19673	SID4243573, BRD-K35939488	3238276	InChI=1S/C21H17N3O4/c1-14-5-2-3-6-17(14)27-13-19-23-20(24-28-19)15-8-10-16(11-9-15)22-21(25)18-7-4-12-26-18/h2-12H,13H2,1H3,(H,22,25)	CIGGFRPDPSLZAT-UHFFFAOYSA-N	Cc1ccccc1OCc2onc(n2)c3ccc(NC(=O)c4occc4)cc3	BroadT	BRD-K35939488	BRD-K35939488-001-06-1	ChemDiv Inc.	K907-0076			Cc1ccccc1OCc1nc(no1)-c1ccc(NC(=O)c2ccco2)cc1	InChI=1S/C21H17N3O4/c1-14-5-2-3-6-17(14)27-13-19-23-20(24-28-19)15-8-10-16(11-9-15)22-21(25)18-7-4-12-26-18/h2-12H,13H2,1H3,(H,22,25)	CIGGFRPDPSLZAT-UHFFFAOYSA-N	375.121906054							108296
T5253478	LSM-19674	SID3714928, SID24839711, BRD-K82472823	2125696	InChI=1S/C23H18N4O3S2/c28-18(16-8-9-19-17(11-16)24-21(29)13-30-19)14-32-23-26-25-22(20-7-4-10-31-20)27(23)12-15-5-2-1-3-6-15/h1-11H,12-14H2,(H,24,29)	SNHSUXGPQBKGQA-UHFFFAOYSA-N	O=C(CSc1nnc(c2cccs2)n1Cc3ccccc3)c4ccc5OCC(=O)Nc5c4	BroadT	BRD-K82472823	BRD-K82472823-001-05-1	Enamine Ltd.	T5253478			O=C(CSc1nnc(-c2cccs2)n1Cc1ccccc1)c1ccc2OCC(=O)Nc2c1	InChI=1S/C23H18N4O3S2/c28-18(16-8-9-19-17(11-16)24-21(29)13-30-19)14-32-23-26-25-22(20-7-4-10-31-20)27(23)12-15-5-2-1-3-6-15/h1-11H,12-14H2,(H,24,29)	SNHSUXGPQBKGQA-UHFFFAOYSA-N	462.082031856							108297
SMR000038773	LSM-19675	SID856489, BRD-K34878279	657850	InChI=1S/C18H22BrN5O2/c1-11(2)9-20-17-21-15-14(16(25)23(4)18(26)22(15)3)24(17)10-12-6-5-7-13(19)8-12/h5-8,11H,9-10H2,1-4H3,(H,20,21)	BAJAGPSKIPXFJA-UHFFFAOYSA-N	CC(C)CNc1nc2N(C)C(=O)N(C)C(=O)c2n1Cc3cccc(Br)c3	BroadT	BRD-K34878279	BRD-K34878279-001-05-7	InterBioScreen Ltd.	STOCK1S-16477			CC(C)CNc1nc2n(C)c(=O)n(C)c(=O)c2n1Cc1cccc(Br)c1	InChI=1S/C18H22BrN5O2/c1-11(2)9-20-17-21-15-14(16(25)23(4)18(26)22(15)3)24(17)10-12-6-5-7-13(19)8-12/h5-8,11H,9-10H2,1-4H3,(H,20,21)	BAJAGPSKIPXFJA-UHFFFAOYSA-N	419.095687594							108298
SMR000173233	LSM-19676	SID17408732, BRD-A32683230	3215244	InChI=1S/C26H26F2N2O2S/c27-20-8-6-19(7-9-20)25(26(32)29-22-4-2-1-3-5-22)30(23-12-10-21(28)11-13-23)24(31)16-18-14-15-33-17-18/h6-15,17,22,25H,1-5,16H2,(H,29,32)	LCDTZVWYGFPOLV-UHFFFAOYSA-N	Fc1ccc(cc1)C(N(C(=O)Cc2ccsc2)c3ccc(F)cc3)C(=O)NC4CCCCC4	BroadT	BRD-A32683230	BRD-A32683230-001-06-1	Asinex Ltd.	ASN 05989451			Fc1ccc(cc1)C(N(C(=O)Cc1ccsc1)c1ccc(F)cc1)C(=O)NC1CCCCC1	InChI=1S/C26H26F2N2O2S/c27-20-8-6-19(7-9-20)25(26(32)29-22-4-2-1-3-5-22)30(23-12-10-21(28)11-13-23)24(31)16-18-14-15-33-17-18/h6-15,17,22,25H,1-5,16H2,(H,29,32)	LCDTZVWYGFPOLV-UHFFFAOYSA-N	468.168305182							108299
SMR000064848	LSM-19677	SID3714530, BRD-A12099246	2998842	InChI=1S/C19H17NO7/c1-24-18(22)11-7-12(19(23)25-2)9-13(8-11)20-17(21)16-10-26-14-5-3-4-6-15(14)27-16/h3-9,16H,10H2,1-2H3,(H,20,21)	UAFXNQFVBUJRNR-UHFFFAOYSA-N	COC(=O)c1cc(NC(=O)C2COc3ccccc3O2)cc(c1)C(=O)OC	BroadT	BRD-A12099246	BRD-A12099246-001-06-6	Enamine Ltd.	Z32375558			COC(=O)c1cc(NC(=O)C2COc3ccccc3O2)cc(c1)C(=O)OC	InChI=1S/C19H17NO7/c1-24-18(22)11-7-12(19(23)25-2)9-13(8-11)20-17(21)16-10-26-14-5-3-4-6-15(14)27-16/h3-9,16H,10H2,1-2H3,(H,20,21)	UAFXNQFVBUJRNR-UHFFFAOYSA-N	371.100501894							108300
BAS 01843295	LSM-19678	SID24802264, BRD-K22786878	829296	InChI=1S/C14H14N2OS/c17-14(16-13-7-3-4-8-15-13)11-9-18-12-6-2-1-5-10(11)12/h3-4,7-9H,1-2,5-6H2,(H,15,16,17)	UCQAMKMTOLXIEF-UHFFFAOYSA-N	O=C(Nc1ccccn1)c2csc3CCCCc23	BroadT	BRD-K22786878	BRD-K22786878-001-05-1	Asinex Ltd.	BAS 01843295			O=C(Nc1ccccn1)c1csc2CCCCc12	InChI=1S/C14H14N2OS/c17-14(16-13-7-3-4-8-15-13)11-9-18-12-6-2-1-5-10(11)12/h3-4,7-9H,1-2,5-6H2,(H,15,16,17)	UCQAMKMTOLXIEF-UHFFFAOYSA-N	258.082683778							108301
AK-968/41924749	LSM-19679	SID17386410, BRD-K23386514	843954	InChI=1S/C16H17N3S2/c1-2-6-14-9-13(11-21-14)15-17-18-16(20)19(15)10-12-7-4-3-5-8-12/h3-5,7-9,11H,2,6,10H2,1H3,(H,18,20)	MEAZJYZPOWUZGB-UHFFFAOYSA-N	CCCc1cc(cs1)c2nnc(S)n2Cc3ccccc3	BroadT	BRD-K23386514	BRD-K23386514-001-05-9	Specs	AK-968/41924749			CCCc1cc(cs1)-c1nnc(S)n1Cc1ccccc1	InChI=1S/C16H17N3S2/c1-2-6-14-9-13(11-21-14)15-17-18-16(20)19(15)10-12-7-4-3-5-8-12/h3-5,7-9,11H,2,6,10H2,1H3,(H,18,20)	MEAZJYZPOWUZGB-UHFFFAOYSA-N	315.086388954							108302
3-Amino-5-(4-bromophenyl)-4-pyridazinecarbonitrile	LSM-19680	SID24824458, BRD-K83812424	6404650	InChI=1S/C11H7BrN4/c12-8-3-1-7(2-4-8)10-6-15-16-11(14)9(10)5-13/h1-4,6H,(H2,14,16)	BDBXBPBTMYPAIP-UHFFFAOYSA-N	Nc1nncc(c2ccc(Br)cc2)c1C#N	BroadT	BRD-K83812424	BRD-K83812424-001-06-8	Key Organics Ltd.	7X-0945			Nc1nncc(-c2ccc(Br)cc2)c1C#N	InChI=1S/C11H7BrN4/c12-8-3-1-7(2-4-8)10-6-15-16-11(14)9(10)5-13/h1-4,6H,(H2,14,16)	BDBXBPBTMYPAIP-UHFFFAOYSA-N	273.985408864							108303
MLS000911506	LSM-19681	SID26725588, BRD-K42951535	16745808	InChI=1S/C19H15F3N4O3S/c1-29-14-6-10(5-13(8-14)25-17(28)15-9-30-18(23)26-15)16(27)24-12-4-2-3-11(7-12)19(20,21)22/h2-9H,1H3,(H2,23,26)(H,24,27)(H,25,28)	UJAVEIIDOSHHHM-UHFFFAOYSA-N	COc1cc(NC(=O)c2csc(N)n2)cc(c1)C(=O)Nc3cccc(c3)C(F)(F)F	BroadT	BRD-K42951535	BRD-K42951535-001-07-8	Dana Farber Cancer Institute	AMY001-060			COc1cc(NC(=O)c2csc(N)n2)cc(c1)C(=O)Nc1cccc(c1)C(F)(F)F	InChI=1S/C19H15F3N4O3S/c1-29-14-6-10(5-13(8-14)25-17(28)15-9-30-18(23)26-15)16(27)24-12-4-2-3-11(7-12)19(20,21)22/h2-9H,1H3,(H2,23,26)(H,24,27)(H,25,28)	UJAVEIIDOSHHHM-UHFFFAOYSA-N	436.08169567							108304, 108304
T5332928	LSM-19682	SID24835260, BRD-K65120544	4883952	InChI=1S/C12H14F2N2O/c13-9-3-4-10(14)11(7-9)15-12(17)8-16-5-1-2-6-16/h3-4,7H,1-2,5-6,8H2,(H,15,17)	WHCIMVKQIJJSOD-UHFFFAOYSA-N	Fc1ccc(F)c(NC(=O)CN2CCCC2)c1	BroadT	BRD-K65120544	BRD-K65120544-001-05-5	Enamine Ltd.	T5332928			Fc1ccc(F)c(NC(=O)CN2CCCC2)c1	InChI=1S/C12H14F2N2O/c13-9-3-4-10(14)11(7-9)15-12(17)8-16-5-1-2-6-16/h3-4,7H,1-2,5-6,8H2,(H,15,17)	WHCIMVKQIJJSOD-UHFFFAOYSA-N	240.107419488							108305
T0508-7003	LSM-19683	SID24825859, BRD-K95611884	2353143	InChI=1S/C14H12Cl2N2O2S/c1-20-12-6-9(21-2)3-4-10(12)14(19)18-13-11(16)5-8(15)7-17-13/h3-7H,1-2H3,(H,17,18,19)	WSHNWWOIVODKOD-UHFFFAOYSA-N	COc1cc(SC)ccc1C(=O)Nc2ncc(Cl)cc2Cl	BroadT	BRD-K95611884	BRD-K95611884-001-05-5	Enamine Ltd.	T0508-7003			COc1cc(SC)ccc1C(=O)Nc1ncc(Cl)cc1Cl	InChI=1S/C14H12Cl2N2O2S/c1-20-12-6-9(21-2)3-4-10(12)14(19)18-13-11(16)5-8(15)7-17-13/h3-7H,1-2H3,(H,17,18,19)	WSHNWWOIVODKOD-UHFFFAOYSA-N	341.999653754							108306
SMR000073325	LSM-19684	SID4262658, BRD-A88152287	2942101	InChI=1S/C20H31N3O3/c24-18(17-2-1-7-26-17)22-3-5-23(6-4-22)19(25)21-20-11-14-8-15(12-20)10-16(9-14)13-20/h14-17H,1-13H2,(H,21,25)	IXUSARWTDBJCMJ-UHFFFAOYSA-N	O=C(NC12CC3CC(CC(C3)C1)C2)N4CCN(CC4)C(=O)C5CCCO5	BroadT	BRD-A88152287	BRD-A88152287-001-05-4	ChemBridge Corporation	7550047			O=C(NC12CC3CC(CC(C3)C1)C2)N1CCN(CC1)C(=O)C1CCCO1	InChI=1S/C20H31N3O3/c24-18(17-2-1-7-26-17)22-3-5-23(6-4-22)19(25)21-20-11-14-8-15(12-20)10-16(9-14)13-20/h14-17H,1-13H2,(H,21,25)	IXUSARWTDBJCMJ-UHFFFAOYSA-N	361.236541882							108307
N-(3,4-Dimethylphenyl)-n'-(2-pyridyl)thiourea	LSM-19685	SID26727262, BRD-K14398941	2731041	InChI=1S/C14H15N3S/c1-10-6-7-12(9-11(10)2)16-14(18)17-13-5-3-4-8-15-13/h3-9H,1-2H3,(H2,15,16,17,18)	SMDWBSIOSQLAMA-UHFFFAOYSA-N	Cc1ccc(NC(=Nc2ccccn2)S)cc1C	BroadT	BRD-K14398941	BRD-K14398941-001-05-8	Maybridge	S 01809			Cc1ccc(NC(S)=Nc2ccccn2)cc1C	InChI=1S/C14H15N3S/c1-10-6-7-12(9-11(10)2)16-14(18)17-13-5-3-4-8-15-13/h3-9H,1-2H3,(H2,15,16,17,18)	SMDWBSIOSQLAMA-UHFFFAOYSA-N	257.0986682							108308
MLS000116905	LSM-19686	SID7966763, BRD-K48835585	5308428	InChI=1S/C21H23FN4O3/c1-3-29-21(28)25-10-8-14(9-11-25)17-12-18(27)26-20(23-17)19(13(2)24-26)15-4-6-16(22)7-5-15/h4-7,12,14,27H,3,8-11H2,1-2H3	BFZOZLAMQAIRGP-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)c2cc(O)n3nc(C)c(c4ccc(F)cc4)c3n2	BroadT	BRD-K48835585	BRD-K48835585-001-04-3	ChemDiv Inc.	C429-0112			CCOC(=O)N1CCC(CC1)c1cc(O)n2nc(C)c(-c3ccc(F)cc3)c2n1	InChI=1S/C21H23FN4O3/c1-3-29-21(28)25-10-8-14(9-11-25)17-12-18(27)26-20(23-17)19(13(2)24-26)15-4-6-16(22)7-5-15/h4-7,12,14,27H,3,8-11H2,1-2H3	BFZOZLAMQAIRGP-UHFFFAOYSA-N	398.175418836							
MLS001048975	LSM-19687	SID24823937, BRD-A86178620	4837167	InChI=1S/C20H23NO7/c1-11(22)28-15(20(2,3)23)10-27-14-7-6-12-16(18(14)25-5)21-19-13(8-9-26-19)17(12)24-4/h6-9,15,23H,10H2,1-5H3	OIBYSERMZSUBGK-UHFFFAOYSA-N	COc1c(OCC(OC(=O)C)C(C)(C)O)ccc2c(OC)c3ccoc3nc12	BroadT	BRD-A86178620	BRD-A86178620-001-04-0	InterBioScreen Ltd.	STOCK1N-58817			COc1c(OCC(OC(C)=O)C(C)(C)O)ccc2c(OC)c3ccoc3nc12	InChI=1S/C20H23NO7/c1-11(22)28-15(20(2,3)23)10-27-14-7-6-12-16(18(14)25-5)21-19-13(8-9-26-19)17(12)24-4/h6-9,15,23H,10H2,1-5H3	OIBYSERMZSUBGK-UHFFFAOYSA-N	389.147452086							108310
AC1O9KPQ	LSM-19688	BRD-K00702340	6787788	InChI=1S/C14H9Br2NO3/c15-9-3-8(14(18)11(16)4-9)6-17-10-1-2-12-13(5-10)20-7-19-12/h1-6,18H,7H2	ZXNDKJXTMSKJKM-UHFFFAOYSA-N	Oc1c(Br)cc(Br)cc1C=Nc2ccc3OCOc3c2	BroadT	BRD-K00702340	BRD-K00702340-001-05-4	InterBioScreen Ltd.	STOCK1S-85786			Oc1c(Br)cc(Br)cc1C=Nc1ccc2OCOc2c1	InChI=1S/C14H9Br2NO3/c15-9-3-8(14(18)11(16)4-9)6-17-10-1-2-12-13(5-10)20-7-19-12/h1-6,18H,7H2	ZXNDKJXTMSKJKM-UHFFFAOYSA-N	396.894918358							
3,4-Dichloro-benzoic acid n'-(2,6-di-morpholin-4-yl-pyrimidin-4-yl)-hydrazide	LSM-19689	SID17509128, BRD-K62395412	1109406	InChI=1S/C19H22Cl2N6O3/c20-14-2-1-13(11-15(14)21)18(28)25-24-16-12-17(26-3-7-29-8-4-26)23-19(22-16)27-5-9-30-10-6-27/h1-2,11-12H,3-10H2,(H,25,28)(H,22,23,24)	PKWGFGRQRBAQMM-UHFFFAOYSA-N	Clc1ccc(cc1Cl)C(=O)NNc2cc(nc(n2)N3CCOCC3)N4CCOCC4	BroadT	BRD-K62395412	BRD-K62395412-001-06-3	Asinex Ltd.	BAS 00880429			Clc1ccc(cc1Cl)C(=O)NNc1cc(nc(n1)N1CCOCC1)N1CCOCC1	InChI=1S/C19H22Cl2N6O3/c20-14-2-1-13(11-15(14)21)18(28)25-24-16-12-17(26-3-7-29-8-4-26)23-19(22-16)27-5-9-30-10-6-27/h1-2,11-12H,3-10H2,(H,25,28)(H,22,23,24)	PKWGFGRQRBAQMM-UHFFFAOYSA-N	452.113044044							108313
ST50887184	LSM-19690	SID24797053, BRD-K10891398	6468582	InChI=1S/C16H17FN2O3/c1-10-4-6-12(17)13(8-10)19-16(20)18-11-5-7-14(21-2)15(9-11)22-3/h4-9H,1-3H3,(H2,18,19,20)	NIJOWPVNHCINGX-UHFFFAOYSA-N	COc1ccc(NC(=O)Nc2cc(C)ccc2F)cc1OC	BroadT	BRD-K10891398	BRD-K10891398-001-05-4	ChemBridge Corporation	9050947			COc1ccc(NC(=O)Nc2cc(C)ccc2F)cc1OC	InChI=1S/C16H17FN2O3/c1-10-4-6-12(17)13(8-10)19-16(20)18-11-5-7-14(21-2)15(9-11)22-3/h4-9H,1-3H3,(H2,18,19,20)	NIJOWPVNHCINGX-UHFFFAOYSA-N	304.122320624							108314
MLS000567698	LSM-19691	SID14745434, BRD-K47390060	4837288	InChI=1S/C26H26N4/c1-3-9-20(10-4-1)19-30-17-15-22(16-18-30)27-26-23-13-7-8-14-24(23)28-25(29-26)21-11-5-2-6-12-21/h1-14,22H,15-19H2,(H,27,28,29)	YPLQRLFGAHJJMA-UHFFFAOYSA-N	C(N1CCC(CC1)Nc2nc(nc3ccccc23)c4ccccc4)c5ccccc5	BroadT	BRD-K47390060	BRD-K47390060-001-06-9	Enamine Ltd.	T5310470			C(N1CCC(CC1)Nc1nc(nc2ccccc12)-c1ccccc1)c1ccccc1	InChI=1S/C26H26N4/c1-3-9-20(10-4-1)19-30-17-15-22(16-18-30)27-26-23-13-7-8-14-24(23)28-25(29-26)21-11-5-2-6-12-21/h1-14,22H,15-19H2,(H,27,28,29)	YPLQRLFGAHJJMA-UHFFFAOYSA-N	394.215746872							108315
MLS001250377	LSM-19692	SID50086871, BRD-K81983958	24856323	InChI=1S/C17H21ClN2O5/c1-5-24-15(22)19-14(21)17(11(3)4,20(19)16(23)25-6-2)12-7-9-13(18)10-8-12/h7-11H,5-6H2,1-4H3/t17-/m1/s1	DCJJAVZZIGQNSD-QGZVFWFLSA-N	CCOC(=O)N1N(C(=O)OCC)[C@@](C(C)C)(C1=O)c2ccc(Cl)cc2	BroadT	BRD-K81983958	BRD-K81983958-001-06-3	Massachusetts Institute of Technology	FU_JMBII145A			CCOC(=O)N1N(C(=O)OCC)[C@@](C(C)C)(C1=O)c1ccc(Cl)cc1	InChI=1S/C17H21ClN2O5/c1-5-24-15(22)19-14(21)17(11(3)4,20(19)16(23)25-6-2)12-7-9-13(18)10-8-12/h7-11H,5-6H2,1-4H3/t17-/m1/s1	DCJJAVZZIGQNSD-QGZVFWFLSA-N	368.113899502							108316
MLS000036256	LSM-19693	SID859030, BRD-K19521873	660331	InChI=1S/C19H17BrN2O3/c1-12-9-17(23)14-10-13(20)7-8-16(14)22(12)11-19(24)21-15-5-3-4-6-18(15)25-2/h3-10H,11H2,1-2H3,(H,21,24)	MZAZTRVJSZNYRD-UHFFFAOYSA-N	COc1ccccc1NC(=O)CN2C(=CC(=O)c3cc(Br)ccc23)C	BroadT	BRD-K19521873	BRD-K19521873-001-06-0	InterBioScreen Ltd.	STOCK2S-78344			COc1ccccc1NC(=O)Cn1c(C)cc(=O)c2cc(Br)ccc12	InChI=1S/C19H17BrN2O3/c1-12-9-17(23)14-10-13(20)7-8-16(14)22(12)11-19(24)21-15-5-3-4-6-18(15)25-2/h3-10H,11H2,1-2H3,(H,21,24)	MZAZTRVJSZNYRD-UHFFFAOYSA-N	400.042255024							108317
AC1MGWY8	LSM-19694	SID24794984, BRD-A93424839	2967948	InChI=1S/C12H11N5O2S/c1-16-12(13-14-15-16)20-9-7-10(18)17(11(9)19)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3	CYINJCKAAXWNHN-UHFFFAOYSA-N	Cn1nnnc1SC2CC(=O)N(C2=O)c3ccccc3	BroadT	BRD-A93424839	BRD-A93424839-001-06-1	ChemBridge Corporation	7933639			Cn1nnnc1SC1CC(=O)N(C1=O)c1ccccc1	InChI=1S/C12H11N5O2S/c1-16-12(13-14-15-16)20-9-7-10(18)17(11(9)19)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3	CYINJCKAAXWNHN-UHFFFAOYSA-N	289.063345332							108318
T5340184	LSM-19695	SID24791349, BRD-K83609118	2548470	InChI=1S/C21H17ClF2N2O4S/c1-12-9-19(20(30-2)11-16(12)22)25-21(27)13-3-5-14(6-4-13)26-31(28,29)15-7-8-17(23)18(24)10-15/h3-11,26H,1-2H3,(H,25,27)	QGHNQHYFUFNRBB-UHFFFAOYSA-N	COc1cc(Cl)c(C)cc1NC(=O)c2ccc(NS(=O)(=O)c3ccc(F)c(F)c3)cc2	BroadT	BRD-K83609118	BRD-K83609118-001-05-1	Enamine Ltd.	T5340184			COc1cc(Cl)c(C)cc1NC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1	InChI=1S/C21H17ClF2N2O4S/c1-12-9-19(20(30-2)11-16(12)22)25-21(27)13-3-5-14(6-4-13)26-31(28,29)15-7-8-17(23)18(24)10-15/h3-11,26H,1-2H3,(H,25,27)	QGHNQHYFUFNRBB-UHFFFAOYSA-N	466.056561844							108319
STK847331	LSM-19696	SID17504037, BRD-K12134293	54686069	InChI=1S/C19H13F3N2O4S/c1-27-8-3-4-13(28-2)9(5-8)11-6-10(19(20,21)22)15-16-17(29-18(15)23-11)12(25)7-14(26)24-16/h3-7H,1-2H3,(H2,24,25,26)	YRQAAFSLEDBOMM-UHFFFAOYSA-N	COc1ccc(OC)c(c1)c2cc(c3c(n2)sc4c(O)cc(O)nc34)C(F)(F)F	BroadT	BRD-K12134293	BRD-K12134293-001-05-3	Asinex Ltd.	BAS 06901376			COc1ccc(OC)c(c1)-c1cc(c2c(n1)sc1c(O)cc(O)nc21)C(F)(F)F	InChI=1S/C19H13F3N2O4S/c1-27-8-3-4-13(28-2)9(5-8)11-6-10(19(20,21)22)15-16-17(29-18(15)23-11)12(25)7-14(26)24-16/h3-7H,1-2H3,(H2,24,25,26)	YRQAAFSLEDBOMM-UHFFFAOYSA-N	422.054812206							108320
Ethyl 7-methoxy-2-oxo-2H-chromene-3-carboxylate	LSM-19697	SID14740802, BRD-K49696611	914298	InChI=1S/C13H12O5/c1-3-17-12(14)10-6-8-4-5-9(16-2)7-11(8)18-13(10)15/h4-7H,3H2,1-2H3	FWFVXBZXJKTVGL-UHFFFAOYSA-N	CCOC(=O)C1=Cc2ccc(OC)cc2OC1=O	BroadT	BRD-K49696611	BRD-K49696611-001-05-3	InterBioScreen Ltd.	STOCK1S-41943			CCOC(=O)c1cc2ccc(OC)cc2oc1=O	InChI=1S/C13H12O5/c1-3-17-12(14)10-6-8-4-5-9(16-2)7-11(8)18-13(10)15/h4-7H,3H2,1-2H3	FWFVXBZXJKTVGL-UHFFFAOYSA-N	248.068473484							108321
OPREA1_265520	LSM-19698	BRD-A11876386	2832429	InChI=1S/C17H21NO2/c1-20-13-10-8-12(9-11-13)18-17(19)16-14-6-4-2-3-5-7-15(14)16/h2-3,8-11,14-16H,4-7H2,1H3,(H,18,19)	IMMWUAGAFWRTBP-UHFFFAOYSA-N	COc1ccc(NC(=O)C2C3CCC=CCCC23)cc1	BroadT	BRD-A11876386	BRD-A11876386-001-05-0	InterBioScreen Ltd.	STOCK3S-51340			COc1ccc(NC(=O)C2C3CC\C=C/CCC23)cc1	InChI=1S/C17H21NO2/c1-20-13-10-8-12(9-11-13)18-17(19)16-14-6-4-2-3-5-7-15(14)16/h2-3,8-11,14-16H,4-7H2,1H3,(H,18,19)/b3-2-	IMMWUAGAFWRTBP-IHWYPQMZSA-N	271.157228922							108322
BAS 04023724	LSM-19699	SID14725810, BRD-K38356122	3149078	InChI=1S/C12H14N4O2S/c1-3-16-11(9-4-6-13-7-5-9)14-15-12(16)19-8-10(17)18-2/h4-7H,3,8H2,1-2H3	YBPFZJMRZBVTBK-UHFFFAOYSA-N	CCn1c(SCC(=O)OC)nnc1c2ccncc2	BroadT	BRD-K38356122	BRD-K38356122-001-06-7	Asinex Ltd.	BAS 04023724			CCn1c(SCC(=O)OC)nnc1-c1ccncc1	InChI=1S/C12H14N4O2S/c1-3-16-11(9-4-6-13-7-5-9)14-15-12(16)19-8-10(17)18-2/h4-7H,3,8H2,1-2H3	YBPFZJMRZBVTBK-UHFFFAOYSA-N	278.083746418							108323
N-[(2,5-Dimethoxyphenyl)methylideneamino]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide	LSM-19700	BRD-K03052940	1014538	InChI=1S/C18H17N5O6/c1-27-14-3-5-16(28-2)12(7-14)8-19-21-18(24)17-6-4-15(29-17)11-22-10-13(9-20-22)23(25)26/h3-10H,11H2,1-2H3,(H,21,24)	DCFXOUUTEMVCFV-UHFFFAOYSA-N	COc1ccc(OC)c(C=NNC(=O)c2oc(Cn3cc(cn3)[N+](=O)[O-])cc2)c1	BroadT	BRD-K03052940	BRD-K03052940-001-05-5	Specs	AK-968/40708021			COc1ccc(OC)c(C=NNC(=O)c2ccc(Cn3cc(cn3)[N+]([O-])=O)o2)c1	InChI=1S/C18H17N5O6/c1-27-14-3-5-16(28-2)12(7-14)8-19-21-18(24)17-6-4-15(29-17)11-22-10-13(9-20-22)23(25)26/h3-10H,11H2,1-2H3,(H,21,24)	DCFXOUUTEMVCFV-UHFFFAOYSA-N	399.117883314							108324
SMR000155016	LSM-19701	SID16953026, BRD-K24789882	2335617	InChI=1S/C23H21ClN2O4/c1-29-20-11-10-14(12-17(20)24)25-21(27)13-30-23(28)22-15-6-2-4-8-18(15)26-19-9-5-3-7-16(19)22/h2,4,6,8,10-12H,3,5,7,9,13H2,1H3,(H,25,27)	HCHZUMBCIPCFFF-UHFFFAOYSA-N	COc1ccc(NC(=O)COC(=O)c2c3CCCCc3nc4ccccc24)cc1Cl	BroadT	BRD-K24789882	BRD-K24789882-001-05-7	Enamine Ltd.	T0505-7656			COc1ccc(NC(=O)COC(=O)c2c3CCCCc3nc3ccccc23)cc1Cl	InChI=1S/C23H21ClN2O4/c1-29-20-11-10-14(12-17(20)24)25-21(27)13-30-23(28)22-15-6-2-4-8-18(15)26-19-9-5-3-7-16(19)22/h2,4,6,8,10-12H,3,5,7,9,13H2,1H3,(H,25,27)	HCHZUMBCIPCFFF-UHFFFAOYSA-N	424.118984882							108325
SMR000027459	LSM-19702	SID4251634, BRD-A99292874	3245294	InChI=1S/C22H29N3O4S/c1-15-7-3-4-8-19(15)23-22(27)18-14-24(2)20-10-9-16(13-17(20)21(18)26)30(28,29)25-11-5-6-12-25/h9-10,13-15,19H,3-8,11-12H2,1-2H3,(H,23,27)	QACLMRDCNPWGNR-UHFFFAOYSA-N	CC1CCCCC1NC(=O)C2=CN(C)c3ccc(cc3C2=O)S(=O)(=O)N4CCCC4	BroadT	BRD-A99292874	BRD-A99292874-001-05-4	ChemDiv Inc.	C519-0275			CC1CCCCC1NC(=O)c1cn(C)c2ccc(cc2c1=O)S(=O)(=O)N1CCCC1	InChI=1S/C22H29N3O4S/c1-15-7-3-4-8-19(15)23-22(27)18-14-24(2)20-10-9-16(13-17(20)21(18)26)30(28,29)25-11-5-6-12-25/h9-10,13-15,19H,3-8,11-12H2,1-2H3,(H,23,27)	QACLMRDCNPWGNR-UHFFFAOYSA-N	431.187877128							108326
1-Benzyl-3-(3,4-dimethylphenyl)-1H-pyrazole-4-carbaldehyde	LSM-19703	SID22410312, BRD-K82067189	2535163	InChI=1S/C19H18N2O/c1-14-8-9-17(10-15(14)2)19-18(13-22)12-21(20-19)11-16-6-4-3-5-7-16/h3-10,12-13H,11H2,1-2H3	AJCJKOJVNWOCFK-UHFFFAOYSA-N	Cc1ccc(cc1C)c2nn(Cc3ccccc3)cc2C=O	BroadT	BRD-K82067189	BRD-K82067189-001-05-7	Enamine Ltd.	T5315890			Cc1ccc(cc1C)-c1nn(Cc2ccccc2)cc1C=O	InChI=1S/C19H18N2O/c1-14-8-9-17(10-15(14)2)19-18(13-22)12-21(20-19)11-16-6-4-3-5-7-16/h3-10,12-13H,11H2,1-2H3	AJCJKOJVNWOCFK-UHFFFAOYSA-N	290.141913216							108327
3-Nitroquinolin-4-ol	LSM-19704	SID17505299, BRD-K30927891	316988	InChI=1S/C9H6N2O3/c12-9-6-3-1-2-4-7(6)10-5-8(9)11(13)14/h1-5H,(H,10,12)	ZWISCKSGNCMAQO-UHFFFAOYSA-N	Oc1c(cnc2ccccc12)[N+](=O)[O-]	BroadT	BRD-K30927891	BRD-K30927891-001-06-2	ChemDiv Inc.	8009-7893			Oc1c(cnc2ccccc12)[N+]([O-])=O	InChI=1S/C9H6N2O3/c12-9-6-3-1-2-4-7(6)10-5-8(9)11(13)14/h1-5H,(H,10,12)	ZWISCKSGNCMAQO-UHFFFAOYSA-N	190.037842072							108328
AC1LU1YJ	LSM-19705	BRD-K96260120	1544741	InChI=1S/C19H19BrClN5O5S/c20-15-2-4-16(5-3-15)32(30,31)25-9-7-24(8-10-25)13-19(27)23-22-12-14-1-6-17(21)18(11-14)26(28)29/h1-6,11-12H,7-10,13H2,(H,23,27)	QLQGIDGIEDSHMF-UHFFFAOYSA-N	[O-][N+](=O)c1cc(C=NNC(=O)CN2CCN(CC2)S(=O)(=O)c3ccc(Br)cc3)ccc1Cl	BroadT	BRD-K96260120	BRD-K96260120-001-05-4	InterBioScreen Ltd.	STOCK2S-90468			[O-][N+](=O)c1cc(C=NNC(=O)CN2CCN(CC2)S(=O)(=O)c2ccc(Br)cc2)ccc1Cl	InChI=1S/C19H19BrClN5O5S/c20-15-2-4-16(5-3-15)32(30,31)25-9-7-24(8-10-25)13-19(27)23-22-12-14-1-6-17(21)18(11-14)26(28)29/h1-6,11-12H,7-10,13H2,(H,23,27)	QLQGIDGIEDSHMF-UHFFFAOYSA-N	542.997879758							108329
AC1LS9UB	LSM-19706	BRD-K61510221	1484601	InChI=1S/C18H15ClN4O3S/c1-25-16-8-12(9-22-23-17(24)13-4-6-20-7-5-13)2-3-15(16)26-11-14-10-21-18(19)27-14/h2-10H,11H2,1H3,(H,23,24)	RYXRSILKRUOMNX-UHFFFAOYSA-N	COc1cc(C=NNC(=O)c2ccncc2)ccc1OCc3cnc(Cl)s3	BroadT	BRD-K61510221	BRD-K61510221-001-05-1	Key Organics Ltd.	7N-052			COc1cc(C=NNC(=O)c2ccncc2)ccc1OCc1cnc(Cl)s1	InChI=1S/C18H15ClN4O3S/c1-25-16-8-12(9-22-23-17(24)13-4-6-20-7-5-13)2-3-15(16)26-11-14-10-21-18(19)27-14/h2-10H,11H2,1H3,(H,23,24)	RYXRSILKRUOMNX-UHFFFAOYSA-N	402.05533878							108330
SMR000004129	LSM-19707	SID842370, BRD-K17547515	644638	InChI=1S/C23H27FN4O3/c1-27(2)11-4-12-28(23(30)25-19-7-5-18(24)6-8-19)15-17-13-16-14-20(31-3)9-10-21(16)26-22(17)29/h5-10,13-14H,4,11-12,15H2,1-3H3,(H,25,30)(H,26,29)	BRCYHVMNAQBSJX-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(CCCN(C)C)C(=O)Nc3ccc(F)cc3)cc2c1	BroadT	BRD-K17547515	BRD-K17547515-001-06-1	Asinex Ltd.	ASN 05112828			COc1ccc2nc(O)c(CN(CCCN(C)C)C(=O)Nc3ccc(F)cc3)cc2c1	InChI=1S/C23H27FN4O3/c1-27(2)11-4-12-28(23(30)25-19-7-5-18(24)6-8-19)15-17-13-16-14-20(31-3)9-10-21(16)26-22(17)29/h5-10,13-14H,4,11-12,15H2,1-3H3,(H,25,30)(H,26,29)	BRCYHVMNAQBSJX-UHFFFAOYSA-N	426.206718964							108331
MLS000041307	LSM-19708	SID863857, BRD-K56918039	665110	InChI=1S/C17H14N4O/c1-11-8-15-16(19-12(2)20-17(15)22-11)13-9-18-21(10-13)14-6-4-3-5-7-14/h3-10H,1-2H3	OQRFEKDTJZAPAO-UHFFFAOYSA-N	Cc1oc2nc(C)nc(c3cnn(c3)c4ccccc4)c2c1	BroadT	BRD-K56918039	BRD-K56918039-001-05-5	InterBioScreen Ltd.	STOCK4S-92069			Cc1cc2c(nc(C)nc2o1)-c1cnn(c1)-c1ccccc1	InChI=1S/C17H14N4O/c1-11-8-15-16(19-12(2)20-17(15)22-11)13-9-18-21(10-13)14-6-4-3-5-7-14/h3-10H,1-2H3	OQRFEKDTJZAPAO-UHFFFAOYSA-N	290.116761108							108332
2-(Allylamino)-3-chloronaphthoquinone	LSM-19709	SID22416871, JMW-MITF1	1716436	InChI=1S/C13H10ClNO2/c1-2-7-15-11-10(14)12(16)8-5-3-4-6-9(8)13(11)17/h2-6,15H,1,7H2	PYIGZVBXHAUBPU-UHFFFAOYSA-N	ClC1=C(NCC=C)C(=O)c2ccccc2C1=O	BroadT	BRD-K45681478	BRD-K45681478-001-09-3	ChemBridge Corporation	6292122			ClC1=C(NCC=C)C(=O)c2ccccc2C1=O	InChI=1S/C13H10ClNO2/c1-2-7-15-11-10(14)12(16)8-5-3-4-6-9(8)13(11)17/h2-6,15H,1,7H2	PYIGZVBXHAUBPU-UHFFFAOYSA-N	247.04000628							108333
1-Cyclohexyl-3-phenethylurea	LSM-19710	SID4265015, BRD-K80538994	742677	InChI=1S/C15H22N2O/c18-15(17-14-9-5-2-6-10-14)16-12-11-13-7-3-1-4-8-13/h1,3-4,7-8,14H,2,5-6,9-12H2,(H2,16,17,18)	YJAMPQZPTKVFIU-UHFFFAOYSA-N	O=C(NCCc1ccccc1)NC2CCCCC2	BroadT	BRD-K80538994	BRD-K80538994-001-05-4	ChemBridge Corporation	5402894			O=C(NCCc1ccccc1)NC1CCCCC1	InChI=1S/C15H22N2O/c18-15(17-14-9-5-2-6-10-14)16-12-11-13-7-3-1-4-8-13/h1,3-4,7-8,14H,2,5-6,9-12H2,(H2,16,17,18)	YJAMPQZPTKVFIU-UHFFFAOYSA-N	246.173213344							108334
N1-(4-Methylphenyl)-2-(tert-butyl)hydrazine-1-carbothioamide	LSM-19711	SID26730707, BRD-K47266385	2731984	InChI=1S/C12H19N3S/c1-9-5-7-10(8-6-9)13-11(16)14-15-12(2,3)4/h5-8,15H,1-4H3,(H2,13,14,16)	NZYMPIGYJXJCMV-UHFFFAOYSA-N	Cc1ccc(NC(=NNC(C)(C)C)S)cc1	BroadT	BRD-K47266385	BRD-K47266385-001-05-1	Maybridge	S 07294			Cc1ccc(NC(S)=NNC(C)(C)C)cc1	InChI=1S/C12H19N3S/c1-9-5-7-10(8-6-9)13-11(16)14-15-12(2,3)4/h5-8,15H,1-4H3,(H2,13,14,16)	NZYMPIGYJXJCMV-UHFFFAOYSA-N	237.129968328							108335
BAS 02716602	LSM-19712	SID24805536, BRD-A01621189	3142634	InChI=1S/C17H19NO2/c1-13-8-10-14(11-9-13)12-18-17(19)16(20-2)15-6-4-3-5-7-15/h3-11,16H,12H2,1-2H3,(H,18,19)	NQPGYBJMHYTASA-UHFFFAOYSA-N	COC(C(=O)NCc1ccc(C)cc1)c2ccccc2	BroadT	BRD-A01621189	BRD-A01621189-001-06-9	Asinex Ltd.	BAS 02716602			COC(C(=O)NCc1ccc(C)cc1)c1ccccc1	InChI=1S/C17H19NO2/c1-13-8-10-14(11-9-13)12-18-17(19)16(20-2)15-6-4-3-5-7-15/h3-11,16H,12H2,1-2H3,(H,18,19)	NQPGYBJMHYTASA-UHFFFAOYSA-N	269.141578858							108336
[[Phenyl(Pyridin-2-yl)methylidene]amino] naphthalene-1-carboxylate	LSM-19713	BRD-K00371968	1341620	InChI=1S/C23H16N2O2/c26-23(20-14-8-12-17-9-4-5-13-19(17)20)27-25-22(18-10-2-1-3-11-18)21-15-6-7-16-24-21/h1-16H	SEZNZZNGJOKCKO-UHFFFAOYSA-N	O=C(ON=C(c1ccccc1)c2ccccn2)c3cccc4ccccc34	BroadT	BRD-K00371968	BRD-K00371968-001-05-9	ChemBridge Corporation	6534320			O=C(ON=C(c1ccccc1)c1ccccn1)c1cccc2ccccc12	InChI=1S/C23H16N2O2/c26-23(20-14-8-12-17-9-4-5-13-19(17)20)27-25-22(18-10-2-1-3-11-18)21-15-6-7-16-24-21/h1-16H	SEZNZZNGJOKCKO-UHFFFAOYSA-N	352.121177772							108337
5-(4-Ethoxyphenyl)-1,3-diphenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione	LSM-19714	BRD-A49904853	3657134	InChI=1S/C25H21N3O3/c1-2-31-20-15-13-18(14-16-20)27-24(29)21-22(17-9-5-3-6-10-17)26-28(23(21)25(27)30)19-11-7-4-8-12-19/h3-16,25,30H,2H2,1H3	DGKFPOOZPBOMIR-UHFFFAOYSA-N	CCOc1ccc(cc1)N1C(O)c2c(C1=O)c(nn2-c1ccccc1)-c1ccccc1	BroadT	BRD-A49904853	BRD-A49904853-001-05-0	Specs	AP-970/41681329			CCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(=NN2c1ccccc1)c1ccccc1	InChI=1S/C25H21N3O3/c1-2-31-20-15-13-18(14-16-20)27-24(29)21-22(17-9-5-3-6-10-17)26-28(23(21)25(27)30)19-11-7-4-8-12-19/h3-16,21,23H,2H2,1H3	WCMHVJXKHSMQGI-UHFFFAOYSA-N	411.158291562							
MLS000553823	LSM-19715	SID17508396, BRD-A70582390	3136153	InChI=1S/C25H27NO2/c1-17-11-13-19(14-12-17)24(26-25(28)20-8-3-2-4-9-20)23-21-10-6-5-7-18(21)15-16-22(23)27/h5-7,10-16,20,24,27H,2-4,8-9H2,1H3,(H,26,28)	AOJYUCODXLAKOU-UHFFFAOYSA-N	Cc1ccc(cc1)C(NC(=O)C2CCCCC2)c3c(O)ccc4ccccc34	BroadT	BRD-A70582390	BRD-A70582390-001-05-6	Asinex Ltd.	BAS 01923240			Cc1ccc(cc1)C(NC(=O)C1CCCCC1)c1c(O)ccc2ccccc12	InChI=1S/C25H27NO2/c1-17-11-13-19(14-12-17)24(26-25(28)20-8-3-2-4-9-20)23-21-10-6-5-7-18(21)15-16-22(23)27/h5-7,10-16,20,24,27H,2-4,8-9H2,1H3,(H,26,28)	AOJYUCODXLAKOU-UHFFFAOYSA-N	373.204179114							108339
AK-968/12713096	LSM-19716	SID7977766, BRD-A85862535	3845886	InChI=1S/C20H23ClN2O/c1-2-19(16-7-4-3-5-8-16)20(24)23-13-11-22(12-14-23)18-10-6-9-17(21)15-18/h3-10,15,19H,2,11-14H2,1H3	GPVLHZKWWXNMLG-UHFFFAOYSA-N	CCC(C(=O)N1CCN(CC1)c2cccc(Cl)c2)c3ccccc3	BroadT	BRD-A85862535	BRD-A85862535-001-05-1	ChemBridge Corporation	6122728			CCC(C(=O)N1CCN(CC1)c1cccc(Cl)c1)c1ccccc1	InChI=1S/C20H23ClN2O/c1-2-19(16-7-4-3-5-8-16)20(24)23-13-11-22(12-14-23)18-10-6-9-17(21)15-18/h3-10,15,19H,2,11-14H2,1H3	GPVLHZKWWXNMLG-UHFFFAOYSA-N	342.149891086							108340
SMR000035128	LSM-19717	SID859968, BRD-K92270144	661269	InChI=1S/C17H21N5O3S2/c1-12-2-4-13(5-3-12)18-15(24)11-26-17-21-20-16(27-17)19-14(23)10-22-6-8-25-9-7-22/h2-5H,6-11H2,1H3,(H,18,24)(H,19,20,23)	GLUHNSIYAMZXSN-UHFFFAOYSA-N	Cc1ccc(NC(=O)CSc2nnc(NC(=O)CN3CCOCC3)s2)cc1	BroadT	BRD-K92270144	BRD-K92270144-001-05-9	InterBioScreen Ltd.	STOCK3S-42183			Cc1ccc(cc1)NC(=O)CSc1nnc(NC(=O)CN2CCOCC2)s1	InChI=1S/C17H21N5O3S2/c1-12-2-4-13(5-3-12)18-15(24)11-26-17-21-20-16(27-17)19-14(23)10-22-6-8-25-9-7-22/h2-5H,6-11H2,1H3,(H,18,24)(H,19,20,23)	GLUHNSIYAMZXSN-UHFFFAOYSA-N	407.108580962							108341
ST061938	LSM-19718	SID47204273, BRD-K36707664	893207	InChI=1S/C15H16N2O2/c1-11-4-3-5-14(12(11)2)19-10-15(18)17-13-6-8-16-9-7-13/h3-9H,10H2,1-2H3,(H,16,17,18)	RLESCOYRLMWUTC-UHFFFAOYSA-N	Cc1cccc(OCC(=O)Nc2ccncc2)c1C	BroadT	BRD-K36707664	BRD-K36707664-001-05-9	Asinex Ltd.	BAS 06290077			Cc1cccc(OCC(=O)Nc2ccncc2)c1C	InChI=1S/C15H16N2O2/c1-11-4-3-5-14(12(11)2)19-10-15(18)17-13-6-8-16-9-7-13/h3-9H,10H2,1-2H3,(H,16,17,18)	RLESCOYRLMWUTC-UHFFFAOYSA-N	256.121177772							108342
SMR000045426	LSM-19719	SID863292, BRD-K06875540	664538	InChI=1S/C13H10N6/c1-9-16-13-11-7-15-19(10-5-3-2-4-6-10)12(11)14-8-18(13)17-9/h2-8H,1H3	MRFOPFAYEISVMV-UHFFFAOYSA-N	Cc1nc2c3cnn(c4ccccc4)c3ncn2n1	BroadT	BRD-K06875540	BRD-K06875540-001-05-0	InterBioScreen Ltd.	STOCK4S-68447			Cc1nc2c3cnn(-c4ccccc4)c3ncn2n1	InChI=1S/C13H10N6/c1-9-16-13-11-7-15-19(10-5-3-2-4-6-10)12(11)14-8-18(13)17-9/h2-8H,1H3	MRFOPFAYEISVMV-UHFFFAOYSA-N	250.09669438							108343
STK167781	LSM-19720	SID17432180, BRD-K83864336	888322	InChI=1S/C16H14N2O5/c19-16(9-11-3-1-2-4-13(11)18(20)21)17-12-5-6-14-15(10-12)23-8-7-22-14/h1-6,10H,7-9H2,(H,17,19)	XGHKZYBUOLPQDC-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1CC(=O)Nc2ccc3OCCOc3c2	BroadT	BRD-K83864336	BRD-K83864336-001-06-6	ChemBridge Corporation	7346752			[O-][N+](=O)c1ccccc1CC(=O)Nc1ccc2OCCOc2c1	InChI=1S/C16H14N2O5/c19-16(9-11-3-1-2-4-13(11)18(20)21)17-12-5-6-14-15(10-12)23-8-7-22-14/h1-6,10H,7-9H2,(H,17,19)	XGHKZYBUOLPQDC-UHFFFAOYSA-N	314.090271568							108344
T5361235	LSM-19721	SID49674484, BRD-K62028970	4846019	InChI=1S/C18H19N3O5S2/c1-26-16-7-3-5-9-18(16)28(24,25)21-12-10-20(11-13-21)27(22,23)17-8-4-2-6-15(17)14-19/h2-9H,10-13H2,1H3	GMGAXSWVJGOHPV-UHFFFAOYSA-N	COc1ccccc1S(=O)(=O)N2CCN(CC2)S(=O)(=O)c3ccccc3C#N	BroadT	BRD-K62028970	BRD-K62028970-001-05-6	Enamine Ltd.	T5361235			COc1ccccc1S(=O)(=O)N1CCN(CC1)S(=O)(=O)c1ccccc1C#N	InChI=1S/C18H19N3O5S2/c1-26-16-7-3-5-9-18(16)28(24,25)21-12-10-20(11-13-21)27(22,23)17-8-4-2-6-15(17)14-19/h2-9H,10-13H2,1H3	GMGAXSWVJGOHPV-UHFFFAOYSA-N	421.076612118							108345
SMR000031709	LSM-19722	SID4247764, BRD-A82454997	3241930	InChI=1S/C23H31N3O2/c27-21-17-26(20-9-5-2-6-10-20)23(28)22(19-11-14-24-15-12-19)25(21)16-13-18-7-3-1-4-8-18/h7,11-12,14-15,20,22H,1-6,8-10,13,16-17H2	FIWLCMQMHSJMAX-UHFFFAOYSA-N	O=C1CN(C2CCCCC2)C(=O)C(N1CCC3=CCCCC3)c4ccncc4	BroadT	BRD-A82454997	BRD-A82454997-001-05-1	ChemDiv Inc.	K784-5158			O=C1CN(C2CCCCC2)C(=O)C(N1CCC1=CCCCC1)c1ccncc1	InChI=1S/C23H31N3O2/c27-21-17-26(20-9-5-2-6-10-20)23(28)22(19-11-14-24-15-12-19)25(21)16-13-18-7-3-1-4-8-18/h7,11-12,14-15,20,22H,1-6,8-10,13,16-17H2	FIWLCMQMHSJMAX-UHFFFAOYSA-N	381.241627262							108346
T5210536	LSM-19723	SID26657664, BRD-K43807109	5139167	InChI=1S/C15H15N7O/c1-10(23)21-4-6-22(7-5-21)15-13(9-18)11(2-3-16)12(8-17)14(19)20-15/h2,4-7H2,1H3,(H2,19,20)	DQMGDLZJJITKOR-UHFFFAOYSA-N	CC(=O)N1CCN(CC1)c2nc(N)c(C#N)c(CC#N)c2C#N	BroadT	BRD-K43807109	BRD-K43807109-001-05-1	Enamine Ltd.	T5210536			CC(=O)N1CCN(CC1)c1nc(N)c(C#N)c(CC#N)c1C#N	InChI=1S/C15H15N7O/c1-10(23)21-4-6-22(7-5-21)15-13(9-18)11(2-3-16)12(8-17)14(19)20-15/h2,4-7H2,1H3,(H2,19,20)	DQMGDLZJJITKOR-UHFFFAOYSA-N	309.13380817							108347
T0507-0053	LSM-19724	SID3714721, BRD-K44812364	2349636	InChI=1S/C19H13N3O3S/c23-26(24)17-6-2-4-14-3-1-5-16(18(14)17)22(26)11-13-7-9-15(10-8-13)19-21-20-12-25-19/h1-10,12H,11H2	ILHXOVKTOROISJ-UHFFFAOYSA-N	O=S1(=O)N(Cc2ccc(cc2)c3ocnn3)c4cccc5cccc1c45	BroadT	BRD-K44812364	BRD-K44812364-001-05-0	Enamine Ltd.	T0507-0053			O=S1(=O)N(Cc2ccc(cc2)-c2nnco2)c2cccc3cccc1c23	InChI=1S/C19H13N3O3S/c23-26(24)17-6-2-4-14-3-1-5-16(18(14)17)22(26)11-13-7-9-15(10-8-13)19-21-20-12-25-19/h1-10,12H,11H2	ILHXOVKTOROISJ-UHFFFAOYSA-N	363.067761996							108348
BAS 09625433	LSM-19725	SID842277, BRD-A70929655	5295096	InChI=1S/C15H13N3S/c1-10-8-14-12-4-2-3-5-13(12)16-15(18(14)17-10)11-6-7-19-9-11/h2-9,15-16H,1H3	MXLMWGVMQZOPLG-UHFFFAOYSA-N	Cc1cc2c3ccccc3NC(c4ccsc4)n2n1	BroadT	BRD-A70929655	BRD-A70929655-001-05-9	Asinex Ltd.	BAS 09625433			Cc1cc2-c3ccccc3NC(c3ccsc3)n2n1	InChI=1S/C15H13N3S/c1-10-8-14-12-4-2-3-5-13(12)16-15(18(14)17-10)11-6-7-19-9-11/h2-9,15-16H,1H3	MXLMWGVMQZOPLG-UHFFFAOYSA-N	267.083018136							
N-(6-Acetyl-1,3-benzodioxol-5-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide	LSM-19726	SID4260059, BRD-K78888983	1152787	InChI=1S/C14H13N3O4S2/c1-7(18)9-3-11-12(21-6-20-11)4-10(9)15-13(19)5-22-14-17-16-8(2)23-14/h3-4H,5-6H2,1-2H3,(H,15,19)	KHTCIJIPWGMLEV-UHFFFAOYSA-N	CC(=O)c1cc2OCOc2cc1NC(=O)CSc3nnc(C)s3	BroadT	BRD-K78888983	BRD-K78888983-001-05-0	ChemBridge Corporation	7643778			CC(=O)c1cc2OCOc2cc1NC(=O)CSc1nnc(C)s1	InChI=1S/C14H13N3O4S2/c1-7(18)9-3-11-12(21-6-20-11)4-10(9)15-13(19)5-22-14-17-16-8(2)23-14/h3-4H,5-6H2,1-2H3,(H,15,19)	KHTCIJIPWGMLEV-UHFFFAOYSA-N	351.034747306							108350
SMR000065073	LSM-19727	SID3713289, BRD-K39170655	2528563	InChI=1S/C17H14N4S2/c1-12-19-20-17(21(12)13-7-3-2-4-8-13)22-11-16-18-14-9-5-6-10-15(14)23-16/h2-10H,11H2,1H3	COSOCBHZJUMMSL-UHFFFAOYSA-N	Cc1nnc(SCc2nc3ccccc3s2)n1c4ccccc4	BroadT	BRD-K39170655	BRD-K39170655-001-05-8	Enamine Ltd.	ZT-5824241			Cc1nnc(SCc2nc3ccccc3s2)n1-c1ccccc1	InChI=1S/C17H14N4S2/c1-12-19-20-17(21(12)13-7-3-2-4-8-13)22-11-16-18-14-9-5-6-10-15(14)23-16/h2-10H,11H2,1H3	COSOCBHZJUMMSL-UHFFFAOYSA-N	338.065987868							108351
ZINC03302568	LSM-19728	SID22410913, BRD-K60313259	2418189	InChI=1S/C20H21FN2O5S/c21-15-5-3-14(4-6-15)20(11-1-2-12-20)19(25)28-13-18(24)23-16-7-9-17(10-8-16)29(22,26)27/h3-10H,1-2,11-13H2,(H,23,24)(H2,22,26,27)	NTUAGCMZWBXPNS-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(CCCC2)c3ccc(F)cc3)cc1	BroadT	BRD-K60313259	BRD-K60313259-001-05-6	Enamine Ltd.	T5217888			NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(CCCC2)c2ccc(F)cc2)cc1	InChI=1S/C20H21FN2O5S/c21-15-5-3-14(4-6-15)20(11-1-2-12-20)19(25)28-13-18(24)23-16-7-9-17(10-8-16)29(22,26)27/h3-10H,1-2,11-13H2,(H,23,24)(H2,22,26,27)	NTUAGCMZWBXPNS-UHFFFAOYSA-N	420.115520682							108352
AC1OA08C	LSM-19729	BRD-K44620838	6742783	InChI=1S/C19H17N5O2/c1-11-3-6-14(7-4-11)24-18(25)15(12(2)23-24)10-20-13-5-8-16-17(9-13)22-19(26)21-16/h3-10,25H,1-2H3,(H2,21,22,26)	DCVPBLBUZQFRBH-UHFFFAOYSA-N	Cc1ccc(cc1)n2nc(C)c(C=Nc3ccc4[nH]c(O)nc4c3)c2O	BroadT	BRD-K44620838	BRD-K44620838-001-05-5	Asinex Ltd.	BAS 00833839			Cc1nn(c(O)c1C=Nc1ccc2[nH]c(O)nc2c1)-c1ccc(C)cc1	InChI=1S/C19H17N5O2/c1-11-3-6-14(7-4-11)24-18(25)15(12(2)23-24)10-20-13-5-8-16-17(9-13)22-19(26)21-16/h3-10,25H,1-2H3,(H2,21,22,26)	DCVPBLBUZQFRBH-UHFFFAOYSA-N	347.138224834							
AC1MJ33N	LSM-19730	BRD-K51084610	3105752	InChI=1S/C18H20N4O2/c1-12-5-4-6-15(9-12)18(24)22-21-14(3)11-17(23)20-16-10-13(2)7-8-19-16/h4-10H,11H2,1-3H3,(H,22,24)(H,19,20,23)	ABKVUTDWVSGKNK-UHFFFAOYSA-N	CC(=NNC(=O)c1cccc(C)c1)CC(=O)Nc2cc(C)ccn2	BroadT	BRD-K51084610	BRD-K51084610-001-06-6	Asinex Ltd.	BAS 00410167			CC(CC(=O)Nc1cc(C)ccn1)=NNC(=O)c1cccc(C)c1	InChI=1S/C18H20N4O2/c1-12-5-4-6-15(9-12)18(24)22-21-14(3)11-17(23)20-16-10-13(2)7-8-19-16/h4-10H,11H2,1-3H3,(H,22,24)(H,19,20,23)	ABKVUTDWVSGKNK-UHFFFAOYSA-N	324.15862592							108354
MLS000098867	LSM-19731	SID3715100, SID89851280, BRD-A23557927	2999086	InChI=1S/C23H21N3O3/c1-29-21-12-11-19(14-24-21)25-22(27)20-13-17-9-5-6-10-18(17)15-26(20)23(28)16-7-3-2-4-8-16/h2-12,14,20H,13,15H2,1H3,(H,25,27)	ISPYAMDRPOSHQY-UHFFFAOYSA-N	COc1ccc(NC(=O)C2Cc3ccccc3CN2C(=O)c4ccccc4)cn1	BroadT	BRD-A23557927	BRD-A23557927-001-06-6	Enamine Ltd.	T5329584			COc1ccc(NC(=O)C2Cc3ccccc3CN2C(=O)c2ccccc2)cn1	InChI=1S/C23H21N3O3/c1-29-21-12-11-19(14-24-21)25-22(27)20-13-17-9-5-6-10-18(17)15-26(20)23(28)16-7-3-2-4-8-16/h2-12,14,20H,13,15H2,1H3,(H,25,27)	ISPYAMDRPOSHQY-UHFFFAOYSA-N	387.158291562							108355
SMR000147980	LSM-19732	SID14742548, BRD-K99377280	9551802	InChI=1S/C22H16Cl2N4O3/c23-12-3-7-14(8-4-12)26-20(29)19-18-17(16-2-1-11-25-28(16)19)21(30)27(22(18)31)15-9-5-13(24)6-10-15/h1-11,16-19H,(H,26,29)/t16-,17-,18-,19+/m1/s1	KZEUTKQNAREPMT-MKXGPGLRSA-N	Clc1ccc(NC(=O)[C@@H]2[C@H]3[C@@H]([C@H]4C=CC=NN24)C(=O)N(C3=O)c5ccc(Cl)cc5)cc1	BroadT	BRD-K99377280	BRD-K99377280-001-05-9	InterBioScreen Ltd.	STOCK3S-92633			Clc1ccc(NC(=O)[C@@H]2[C@H]3[C@@H]([C@H]4C=CC=NN24)C(=O)N(C3=O)c2ccc(Cl)cc2)cc1	InChI=1S/C22H16Cl2N4O3/c23-12-3-7-14(8-4-12)26-20(29)19-18-17(16-2-1-11-25-28(16)19)21(30)27(22(18)31)15-9-5-13(24)6-10-15/h1-11,16-19H,(H,26,29)/t16-,17-,18-,19+/m1/s1	KZEUTKQNAREPMT-MKXGPGLRSA-N	454.059945832							108356
2-[(7-Chloro-4-quinazolinyl)oxy]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethanone	LSM-19733	SID26728918, BRD-K16161057	2813569	InChI=1S/C18H13ClN2O4/c19-12-2-3-13-14(8-12)20-10-21-18(13)25-9-15(22)11-1-4-16-17(7-11)24-6-5-23-16/h1-4,7-8,10H,5-6,9H2	URPFVTONTHATKL-UHFFFAOYSA-N	Clc1ccc2c(OCC(=O)c3ccc4OCCOc4c3)ncnc2c1	BroadT	BRD-K16161057	BRD-K16161057-001-05-8	Maybridge	HTS 07333			Clc1ccc2c(OCC(=O)c3ccc4OCCOc4c3)ncnc2c1	InChI=1S/C18H13ClN2O4/c19-12-2-3-13-14(8-12)20-10-21-18(13)25-9-15(22)11-1-4-16-17(7-11)24-6-5-23-16/h1-4,7-8,10H,5-6,9H2	URPFVTONTHATKL-UHFFFAOYSA-N	356.056384626							108357
ZINC01199453	LSM-15202	BRD-K45555856	1358047	InChI=1S/C16H15BrN2O2S2/c1-3-21-10-4-5-12-11(8-10)18-16(19(12)2)22-9-13(20)14-6-7-15(17)23-14/h4-8H,3,9H2,1-2H3	UMTUPPUVIHTRPI-UHFFFAOYSA-N	CCOc1ccc2c(c1)nc(SCC(=O)c3ccc(Br)s3)n2C	BroadT	BRD-K45555856	BRD-K45555856-004-05-3	ChemBridge Corporation	5958491		Br	CCOc1ccc2n(C)c(SCC(=O)c3ccc(Br)s3)nc2c1.Br	InChI=1S/C16H15BrN2O2S2.BrH/c1-3-21-10-4-5-12-11(8-10)18-16(19(12)2)22-9-13(20)14-6-7-15(17)23-14;/h4-8H,3,9H2,1-2H3;1H	RTPMKHAYJICPHZ-UHFFFAOYSA-N	409.97583172							103852, 103852
ASN 07876679	LSM-19734	SID853254, BRD-K12515507	655907	InChI=1S/C22H24FN7O/c23-15-5-6-20-19(13-15)27-28-30(20)16-8-11-29(12-9-16)14-22(31)24-10-7-21-25-17-3-1-2-4-18(17)26-21/h1-6,13,16H,7-12,14H2,(H,24,31)(H,25,26)	RHRRFEFAZRRSAC-UHFFFAOYSA-N	Fc1ccc2c(c1)nnn2C3CCN(CC(=O)NCCc4nc5ccccc5[nH]4)CC3	BroadT	BRD-K12515507	BRD-K12515507-001-05-5	Asinex Ltd.	ASN 07876679			Fc1ccc2n(nnc2c1)C1CCN(CC(=O)NCCc2nc3ccccc3[nH]2)CC1	InChI=1S/C22H24FN7O/c23-15-5-6-20-19(13-15)27-28-30(20)16-8-11-29(12-9-16)14-22(31)24-10-7-21-25-17-3-1-2-4-18(17)26-21/h1-6,13,16H,7-12,14H2,(H,24,31)(H,25,26)	RHRRFEFAZRRSAC-UHFFFAOYSA-N	421.202636658							108358
SMR000207918	LSM-19735	SID17512502, SID87342224, BRD-K68658754	3535142	InChI=1S/C21H20N4O4S2/c26-17-12-14(22-16-6-3-5-9-24(16)17)13-31-21-23-15-8-11-30-19(15)20(29)25(21)10-4-1-2-7-18(27)28/h3,5-6,8-9,11-12H,1-2,4,7,10,13H2,(H,27,28)	DKGBFEOLOMYBAT-UHFFFAOYSA-N	OC(=O)CCCCCN1C(=O)c2sccc2N=C1SCC3=CC(=O)N4C=CC=CC4=N3	BroadT	BRD-K68658754	BRD-K68658754-001-05-6	ChemDiv Inc.	K292-1618			OC(=O)CCCCCn1c(SCc2cc(=O)n3ccccc3n2)nc2ccsc2c1=O	InChI=1S/C21H20N4O4S2/c26-17-12-14(22-16-6-3-5-9-24(16)17)13-31-21-23-15-8-11-30-19(15)20(29)25(21)10-4-1-2-7-18(27)28/h3,5-6,8-9,11-12H,1-2,4,7,10,13H2,(H,27,28)	DKGBFEOLOMYBAT-UHFFFAOYSA-N	456.09259654							108359
AC1MKLVI	LSM-19736	SID49728216, BRD-K98538070	3159388	InChI=1S/C23H22N4O3/c1-15-5-7-16(8-6-15)22(28)25-17-9-10-19-18(14-17)26-21(27(19)2)11-12-24-23(29)20-4-3-13-30-20/h3-10,13-14H,11-12H2,1-2H3,(H,24,29)(H,25,28)	AMOOOGWPTQZZHI-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)Nc2ccc3c(c2)nc(CCNC(=O)c4occc4)n3C	BroadT	BRD-K98538070	BRD-K98538070-001-06-9	Asinex Ltd.	BAS 10122470			Cc1ccc(cc1)C(=O)Nc1ccc2n(C)c(CCNC(=O)c3ccco3)nc2c1	InChI=1S/C23H22N4O3/c1-15-5-7-16(8-6-15)22(28)25-17-9-10-19-18(14-17)26-21(27(19)2)11-12-24-23(29)20-4-3-13-30-20/h3-10,13-14H,11-12H2,1-2H3,(H,24,29)(H,25,28)	AMOOOGWPTQZZHI-UHFFFAOYSA-N	402.169190604							108360
MLS000050489	LSM-19737	SID4259171, BRD-K26838048	2954106	InChI=1S/C19H22N2O4/c1-19(2,3)12-5-7-15(23-4)14(9-12)21-18(22)20-13-6-8-16-17(10-13)25-11-24-16/h5-10H,11H2,1-4H3,(H2,20,21,22)	GEAMHMBWFNQRTB-UHFFFAOYSA-N	COc1ccc(cc1NC(=O)Nc2ccc3OCOc3c2)C(C)(C)C	BroadT	BRD-K26838048	BRD-K26838048-001-07-7	ChemBridge Corporation	7783528			COc1ccc(cc1NC(=O)Nc1ccc2OCOc2c1)C(C)(C)C	InChI=1S/C19H22N2O4/c1-19(2,3)12-5-7-15(23-4)14(9-12)21-18(22)20-13-6-8-16-17(10-13)25-11-24-16/h5-10H,11H2,1-4H3,(H2,20,21,22)	GEAMHMBWFNQRTB-UHFFFAOYSA-N	342.157957204							108361
AC1LKG2C	LSM-19738	BRD-K06265313	1017729	InChI=1S/C20H16N4OS/c1-24-10-4-6-14(24)13-21-23-20(25)16-12-18(19-9-5-11-26-19)22-17-8-3-2-7-15(16)17/h2-13H,1H3,(H,23,25)	JZKBELWWAKACNN-UHFFFAOYSA-N	Cn1cccc1C=NNC(=O)c2cc(nc3ccccc23)c4cccs4	BroadT	BRD-K06265313	BRD-K06265313-001-05-9	Specs	AK-968/15607208			Cn1cccc1C=NNC(=O)c1cc(nc2ccccc12)-c1cccs1	InChI=1S/C20H16N4OS/c1-24-10-4-6-14(24)13-21-23-20(25)16-12-18(19-9-5-11-26-19)22-17-8-3-2-7-15(16)17/h2-13H,1H3,(H,23,25)	JZKBELWWAKACNN-UHFFFAOYSA-N	360.104481862							108362
ZINC00446315	LSM-19739	SID24792126, BRD-K78692447	877371	InChI=1S/C15H13BrN2O3/c16-12-4-6-13(7-5-12)17-9-8-15(19)11-2-1-3-14(10-11)18(20)21/h1-7,10,17H,8-9H2	KFCPVCCIYPGHHK-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C(=O)CCNc2ccc(Br)cc2	BroadT	BRD-K78692447	BRD-K78692447-001-05-6	ChemBridge Corporation	5925819			[O-][N+](=O)c1cccc(c1)C(=O)CCNc1ccc(Br)cc1	InChI=1S/C15H13BrN2O3/c16-12-4-6-13(7-5-12)17-9-8-15(19)11-2-1-3-14(10-11)18(20)21/h1-7,10,17H,8-9H2	KFCPVCCIYPGHHK-UHFFFAOYSA-N	348.010954896							108363
AC1OA96O	LSM-19740	SID4250276, BRD-K10417890	6826122	InChI=1S/C16H14N2O2/c1-2-20-16-11-7-3-5-9-13(11)17-15(18-16)12-8-4-6-10-14(12)19/h3-10,19H,2H2,1H3	WNYLASPSCTVEKI-UHFFFAOYSA-N	CCOc1nc(nc2ccccc12)c3ccccc3O	BroadT	BRD-K10417890	BRD-K10417890-001-05-1	ChemDiv Inc.	4501-0030			CCOc1nc(nc2ccccc12)-c1ccccc1O	InChI=1S/C16H14N2O2/c1-2-20-16-11-7-3-5-9-13(11)17-15(18-16)12-8-4-6-10-14(12)19/h3-10,19H,2H2,1H3	WNYLASPSCTVEKI-UHFFFAOYSA-N	266.105527708							
ST50111090	LSM-19741	SID17514926, BRD-A43352149	4104913	InChI=1S/C28H35N3O3S/c1-4-34-24-12-10-22(11-13-24)26(31-16-14-30(15-17-31)18-19-32)25-20(2)21(3)35-28(25)29-27(33)23-8-6-5-7-9-23/h5-13,26,32H,4,14-19H2,1-3H3,(H,29,33)	SXWKTUITQAVEGZ-UHFFFAOYSA-N	CCOc1ccc(cc1)C(N2CCN(CCO)CC2)c3c(C)c(C)sc3NC(=O)c4ccccc4	BroadT	BRD-A43352149	BRD-A43352149-001-05-2	Life Chemicals Inc.	F1573-0135			CCOc1ccc(cc1)C(N1CCN(CCO)CC1)c1c(C)c(C)sc1NC(=O)c1ccccc1	InChI=1S/C28H35N3O3S/c1-4-34-24-12-10-22(11-13-24)26(31-16-14-30(15-17-31)18-19-32)25-20(2)21(3)35-28(25)29-27(33)23-8-6-5-7-9-23/h5-13,26,32H,4,14-19H2,1-3H3,(H,29,33)	SXWKTUITQAVEGZ-UHFFFAOYSA-N	493.2399127							108365
MLS001142816	LSM-19742	SID49820156, BRD-K88952328	16400186	InChI=1S/C26H33N3O6S/c1-17(2)22(28-36(34,35)21-11-9-18(3)10-12-21)25(31)29-15-13-20(14-16-29)24(30)27-23(26(32)33)19-7-5-4-6-8-19/h4-12,17,20,22-23,28H,13-16H2,1-3H3,(H,27,30)(H,32,33)/t22-,23-/m0/s1	BUKIYBRHWQNVOV-GOTSBHOMSA-N	CC(C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)N2CCC(CC2)C(=O)N[C@H](C(=O)O)c3ccccc3	BroadT	BRD-K88952328	BRD-K88952328-001-04-9	InterBioScreen Ltd.	STOCK1N-47706			CC(C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)N1CCC(CC1)C(=O)N[C@H](C(O)=O)c1ccccc1	InChI=1S/C26H33N3O6S/c1-17(2)22(28-36(34,35)21-11-9-18(3)10-12-21)25(31)29-15-13-20(14-16-29)24(30)27-23(26(32)33)19-7-5-4-6-8-19/h4-12,17,20,22-23,28H,13-16H2,1-3H3,(H,27,30)(H,32,33)/t22-,23-/m0/s1	BUKIYBRHWQNVOV-GOTSBHOMSA-N	515.209006496							108366
SMR000066217	LSM-19743	SID3712873, BRD-K80811151	2347564	InChI=1S/C19H17N5O3S/c1-10-12-9-13(28-18(12)24(21-10)11-7-5-4-6-8-11)15(25)14-16(20)22(2)19(27)23(3)17(14)26/h4-9H,20H2,1-3H3	ZFWWKLJAMKVFFR-UHFFFAOYSA-N	CN1C(=C(C(=O)c2cc3c(C)nn(c4ccccc4)c3s2)C(=O)N(C)C1=O)N	BroadT	BRD-K80811151	BRD-K80811151-001-05-4	Enamine Ltd.	T0508-1067			Cc1nn(-c2ccccc2)c2sc(cc12)C(=O)c1c(N)n(C)c(=O)n(C)c1=O	InChI=1S/C19H17N5O3S/c1-10-12-9-13(28-18(12)24(21-10)11-7-5-4-6-8-11)15(25)14-16(20)22(2)19(27)23(3)17(14)26/h4-9H,20H2,1-3H3	ZFWWKLJAMKVFFR-UHFFFAOYSA-N	395.105210144							108367
6-Benzyl-2-(methylsulfanyl)-4-pyrimidinol	LSM-19744	SID24818026, BRD-K42764993	467329	InChI=1S/C12H12N2OS/c1-16-12-13-10(8-11(15)14-12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,13,14,15)	FQRCZXHZAKAIFX-UHFFFAOYSA-N	CSc1nc(O)cc(Cc2ccccc2)n1	BroadT	BRD-K42764993	BRD-K42764993-001-06-2	Key Organics Ltd.	MS-0442			CSc1nc(O)cc(Cc2ccccc2)n1	InChI=1S/C12H12N2OS/c1-16-12-13-10(8-11(15)14-12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,13,14,15)	FQRCZXHZAKAIFX-UHFFFAOYSA-N	232.067033714							108368
AC1LNRTD	LSM-19745	BRD-K07149243	1207472	InChI=1S/C17H16F3N3O3/c18-17(19,20)13-3-1-2-12(10-13)16(24)22-21-11-14-4-5-15(26-14)23-6-8-25-9-7-23/h1-5,10-11H,6-9H2,(H,22,24)	MXDHUQOHVGOBBW-UHFFFAOYSA-N	FC(F)(F)c1cccc(c1)C(=O)NN=Cc2oc(cc2)N3CCOCC3	BroadT	BRD-K07149243	BRD-K07149243-001-05-9	Specs	AM-879/15551138			FC(F)(F)c1cccc(c1)C(=O)NN=Cc1ccc(o1)N1CCOCC1	InChI=1S/C17H16F3N3O3/c18-17(19,20)13-3-1-2-12(10-13)16(24)22-21-11-14-4-5-15(26-14)23-6-8-25-9-7-23/h1-5,10-11H,6-9H2,(H,22,24)	MXDHUQOHVGOBBW-UHFFFAOYSA-N	367.114376002							108369
AC1LUXB4	LSM-19746	SID17433503, BRD-K29783983	1620083	InChI=1S/C20H22N6S/c1-4-14-7-5-6-8-16(14)24-20(27)26-18(21)25-19-22-13(3)15-11-12(2)9-10-17(15)23-19/h5-11H,4H2,1-3H3,(H4,21,22,23,24,25,26,27)	NIRXLGOFVKTBMV-UHFFFAOYSA-N	CCc1ccccc1N=C(S)N=C(N)Nc2nc(C)c3cc(C)ccc3n2	BroadT	BRD-K29783983	BRD-K29783983-001-06-1	ChemBridge Corporation	7723957			CCc1ccccc1N=C(S)N=C(N)Nc1nc(C)c2cc(C)ccc2n1	InChI=1S/C20H22N6S/c1-4-14-7-5-6-8-16(14)24-20(27)26-18(21)25-19-22-13(3)15-11-12(2)9-10-17(15)23-19/h5-11H,4H2,1-3H3,(H4,21,22,23,24,25,26,27)	NIRXLGOFVKTBMV-UHFFFAOYSA-N	378.162665454							108370
SMR000146892	LSM-19747	SID14740889, BRD-A70067232	3727447	InChI=1S/C23H18ClN3O2/c24-17-9-6-10-18(15-17)25-22(29)27-14-13-26-21(28)19-11-4-5-12-20(19)23(26,27)16-7-2-1-3-8-16/h1-12,15H,13-14H2,(H,25,29)	FQQIMKOHFSKRNY-UHFFFAOYSA-N	Clc1cccc(NC(=O)N2CCN3C(=O)c4ccccc4C23c5ccccc5)c1	BroadT	BRD-A70067232	BRD-A70067232-001-11-8	InterBioScreen Ltd.	STOCK2S-49028			Clc1cccc(NC(=O)N2CCN3C(=O)c4ccccc4C23c2ccccc2)c1	InChI=1S/C23H18ClN3O2/c24-17-9-6-10-18(15-17)25-22(29)27-14-13-26-21(28)19-11-4-5-12-20(19)23(26,27)16-7-2-1-3-8-16/h1-12,15H,13-14H2,(H,25,29)	FQQIMKOHFSKRNY-UHFFFAOYSA-N	403.108754556							108371
SMR000029055	LSM-19748	SID4245215, BRD-A22481213	3239710	InChI=1S/C17H17NO3S2/c1-2-13-6-3-4-7-15(13)18(14-9-11-23(20,21)12-14)17(19)16-8-5-10-22-16/h3-11,14H,2,12H2,1H3	YQLDWBIGLBQWAP-UHFFFAOYSA-N	CCc1ccccc1N(C2CS(=O)(=O)C=C2)C(=O)c3cccs3	BroadT	BRD-A22481213	BRD-A22481213-001-05-5	ChemDiv Inc.	C761-1251			CCc1ccccc1N(C1CS(=O)(=O)C=C1)C(=O)c1cccs1	InChI=1S/C17H17NO3S2/c1-2-13-6-3-4-7-15(13)18(14-9-11-23(20,21)12-14)17(19)16-8-5-10-22-16/h3-11,14H,2,12H2,1H3	YQLDWBIGLBQWAP-UHFFFAOYSA-N	347.064984794							108372
2-Oxo-2H-benzo[h]chromene-3-carboxylic acid ethyl ester	LSM-19749	SID49645457, BRD-K53993052	804889	InChI=1S/C16H12O4/c1-2-19-15(17)13-9-11-8-7-10-5-3-4-6-12(10)14(11)20-16(13)18/h3-9H,2H2,1H3	XIKGCKFVQRKFBP-UHFFFAOYSA-N	CCOC(=O)C1=Cc2ccc3ccccc3c2OC1=O	BroadT	BRD-K53993052	BRD-K53993052-001-05-3	Asinex Ltd.	BAS 00518513			CCOC(=O)c1cc2ccc3ccccc3c2oc1=O	InChI=1S/C16H12O4/c1-2-19-15(17)13-9-11-8-7-10-5-3-4-6-12(10)14(11)20-16(13)18/h3-9H,2H2,1H3	XIKGCKFVQRKFBP-UHFFFAOYSA-N	268.073558864							108373
Methyl 2-[(cyclopentylcarbonyl)amino]benzoate	LSM-19750	SID4256716, BRD-K73284856	895998	InChI=1S/C14H17NO3/c1-18-14(17)11-8-4-5-9-12(11)15-13(16)10-6-2-3-7-10/h4-5,8-10H,2-3,6-7H2,1H3,(H,15,16)	JGXRIRPMSWHGKN-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)C2CCCC2	BroadT	BRD-K73284856	BRD-K73284856-001-05-1	ChemBridge Corporation	7220964			COC(=O)c1ccccc1NC(=O)C1CCCC1	InChI=1S/C14H17NO3/c1-18-14(17)11-8-4-5-9-12(11)15-13(16)10-6-2-3-7-10/h4-5,8-10H,2-3,6-7H2,1H3,(H,15,16)	JGXRIRPMSWHGKN-UHFFFAOYSA-N	247.120843414							108374
AC1LGVID	LSM-19751	BRD-K00370245	827695	InChI=1S/C15H14N2O4S/c1-10(13-7-4-8-22-13)17-21-9-14(18)16-12-6-3-2-5-11(12)15(19)20/h2-8H,9H2,1H3,(H,16,18)(H,19,20)	JALSLBYAWNKONG-UHFFFAOYSA-N	CC(=NOCC(=O)Nc1ccccc1C(=O)O)c2cccs2	BroadT	BRD-K00370245	BRD-K00370245-001-05-6	Enamine Ltd.	T0505-7853			CC(=NOCC(=O)Nc1ccccc1C(O)=O)c1cccs1	InChI=1S/C15H14N2O4S/c1-10(13-7-4-8-22-13)17-21-9-14(18)16-12-6-3-2-5-11(12)15(19)20/h2-8H,9H2,1H3,(H,16,18)(H,19,20)	JALSLBYAWNKONG-UHFFFAOYSA-N	318.067427638							108375
SMR000092195	LSM-19752	SID7967281, BRD-A49317233	5308730	InChI=1S/C19H20ClN5/c1-2-12-3-5-13(6-4-12)16-11-17(14-7-9-15(20)10-8-14)25-19(22-16)23-18(21)24-25/h3-10,16-17H,2,11H2,1H3,(H3,21,22,23,24)	WDUSFYWTQRYAEV-UHFFFAOYSA-N	CCc1ccc(cc1)C2CC(c3ccc(Cl)cc3)n4nc(N)nc4N2	BroadT	BRD-A49317233	BRD-A49317233-001-05-6	ChemDiv Inc.	6321-0338			CCc1ccc(cc1)C1CC(c2ccc(Cl)cc2)n2nc(N)nc2N1	InChI=1S/C19H20ClN5/c1-2-12-3-5-13(6-4-12)16-11-17(14-7-9-15(20)10-8-14)25-19(22-16)23-18(21)24-25/h3-10,16-17H,2,11H2,1H3,(H3,21,22,23,24)	WDUSFYWTQRYAEV-UHFFFAOYSA-N	353.1407234							108376
T0519-5986	LSM-19753	SID16952537, BRD-K35074036	4403572	InChI=1S/C21H21N5O4/c1-26(10-18-22-14-7-5-4-6-12(14)20(27)24-18)11-19-23-15-9-17(30-3)16(29-2)8-13(15)21(28)25-19/h4-9H,10-11H2,1-3H3,(H,22,24,27)(H,23,25,28)	JRIRTZJAJBAKTN-UHFFFAOYSA-N	COc1cc2nc(CN(C)Cc3nc(O)c4ccccc4n3)nc(O)c2cc1OC	BroadT	BRD-K35074036	BRD-K35074036-001-05-6	Enamine Ltd.	T0519-5986			COc1cc2nc(CN(C)Cc3nc(O)c4ccccc4n3)nc(O)c2cc1OC	InChI=1S/C21H21N5O4/c1-26(10-18-22-14-7-5-4-6-12(14)20(27)24-18)11-19-23-15-9-17(30-3)16(29-2)8-13(15)21(28)25-19/h4-9H,10-11H2,1-3H3,(H,22,24,27)(H,23,25,28)	JRIRTZJAJBAKTN-UHFFFAOYSA-N	407.159354202							108377
7G-912	LSM-19754	SID17410446, BRD-A97361070	5096896	InChI=1S/C15H12Cl2N2O7/c1-24-13(22)15(14(23)25-2)9-10(26-18-15)12(21)19(11(9)20)8-4-3-6(16)5-7(8)17/h3-5,9-10,18H,1-2H3	FKSFAHWMBVHZTP-UHFFFAOYSA-N	COC(=O)C1(NOC2C1C(=O)N(C2=O)c3ccc(Cl)cc3Cl)C(=O)OC	BroadT	BRD-A97361070	BRD-A97361070-001-05-1	Key Organics Ltd.	7G-912			COC(=O)C1(NOC2C1C(=O)N(C2=O)c1ccc(Cl)cc1Cl)C(=O)OC	InChI=1S/C15H12Cl2N2O7/c1-24-13(22)15(14(23)25-2)9-10(26-18-15)12(21)19(11(9)20)8-4-3-6(16)5-7(8)17/h3-5,9-10,18H,1-2H3	FKSFAHWMBVHZTP-UHFFFAOYSA-N	402.002156164							108378
T5511955	LSM-19755	SID24839439, BRD-A48883036	4009125	InChI=1S/C24H27N5O3/c1-3-27(20(30)15-28-16(2)13-18-11-7-8-12-19(18)28)21-22(25)29(24(32)26-23(21)31)14-17-9-5-4-6-10-17/h4-12,16H,3,13-15,25H2,1-2H3,(H,26,31,32)	SCTGLDJHFROAGX-UHFFFAOYSA-N	CCN(C(=O)CN1C(C)Cc2ccccc12)C3=C(N)N(Cc4ccccc4)C(=O)NC3=O	BroadT	BRD-A48883036	BRD-A48883036-001-05-7	Enamine Ltd.	T5253787			CCN(C(=O)CN1C(C)Cc2ccccc12)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O	InChI=1S/C24H27N5O3/c1-3-27(20(30)15-28-16(2)13-18-11-7-8-12-19(18)28)21-22(25)29(24(32)26-23(21)31)14-17-9-5-4-6-10-17/h4-12,16H,3,13-15,25H2,1-2H3,(H,26,31,32)	SCTGLDJHFROAGX-UHFFFAOYSA-N	433.211389774							108379
MLS000117212	LSM-19756	SID7966479, BRD-A31306003	5308261	InChI=1S/C18H16BrFN2O/c19-13-4-1-3-12(11-13)17-21-10-2-5-16(21)18(23)22(17)15-8-6-14(20)7-9-15/h1,3-4,6-9,11,16-17H,2,5,10H2	BIHNZOCMIFXZIK-UHFFFAOYSA-N	Fc1ccc(cc1)N2C(N3CCCC3C2=O)c4cccc(Br)c4	BroadT	BRD-A31306003	BRD-A31306003-001-05-7	ChemDiv Inc.	C466-0392			Fc1ccc(cc1)N1C(N2CCCC2C1=O)c1cccc(Br)c1	InChI=1S/C18H16BrFN2O/c19-13-4-1-3-12(11-13)17-21-10-2-5-16(21)18(23)22(17)15-8-6-14(20)7-9-15/h1,3-4,6-9,11,16-17H,2,5,10H2	BIHNZOCMIFXZIK-UHFFFAOYSA-N	374.043003952							108380
AG-690/10414026	LSM-19757	SID24809166, BRD-K42090902	293807	InChI=1S/C13H10Cl2N2O2/c14-9-3-4-12(11(15)6-9)19-8-13(18)17-10-2-1-5-16-7-10/h1-7H,8H2,(H,17,18)	KJMGGUUPWORXTF-UHFFFAOYSA-N	Clc1ccc(OCC(=O)Nc2cccnc2)c(Cl)c1	BroadT	BRD-K42090902	BRD-K42090902-001-05-4	Asinex Ltd.	BAS 05601907			Clc1ccc(OCC(=O)Nc2cccnc2)c(Cl)c1	InChI=1S/C13H10Cl2N2O2/c14-9-3-4-12(11(15)6-9)19-8-13(18)17-10-2-1-5-16-7-10/h1-7H,8H2,(H,17,18)	KJMGGUUPWORXTF-UHFFFAOYSA-N	296.011933							108381
MLS001031788	LSM-19758	SID49828633, BRD-K50842549	24820023	InChI=1S/C21H26N2O2/c1-16-9-8-10-17(2)21(16)25-15-20(24)22-18-11-4-5-12-19(18)23-13-6-3-7-14-23/h4-5,8-12H,3,6-7,13-15H2,1-2H3,(H,22,24)	HFMAHKZHWMDPFO-UHFFFAOYSA-N	Cc1cccc(C)c1OCC(=O)Nc2ccccc2N3CCCCC3	BroadT	BRD-K50842549	BRD-K50842549-001-06-4	UkrOrgSynthesis Ltd.	PB26532165			Cc1cccc(C)c1OCC(=O)Nc1ccccc1N1CCCCC1	InChI=1S/C21H26N2O2/c1-16-9-8-10-17(2)21(16)25-15-20(24)22-18-11-4-5-12-19(18)23-13-6-3-7-14-23/h4-5,8-12H,3,6-7,13-15H2,1-2H3,(H,22,24)	HFMAHKZHWMDPFO-UHFFFAOYSA-N	338.199428092							108382
SMR000027013	LSM-19759	SID4241279, BRD-K54043015	3236276	InChI=1S/C21H22N4O2S/c1-23-17-7-3-2-6-16(17)18(14-20(23)26)28-15-21(27)25-12-10-24(11-13-25)19-8-4-5-9-22-19/h2-9,14H,10-13,15H2,1H3	CBNWPEQPUJLGRN-UHFFFAOYSA-N	CN1C(=O)C=C(SCC(=O)N2CCN(CC2)c3ccccn3)c4ccccc14	BroadT	BRD-K54043015	BRD-K54043015-001-05-2	ChemDiv Inc.	C463-0078			Cn1c2ccccc2c(SCC(=O)N2CCN(CC2)c2ccccn2)cc1=O	InChI=1S/C21H22N4O2S/c1-23-17-7-3-2-6-16(17)18(14-20(23)26)28-15-21(27)25-12-10-24(11-13-25)19-8-4-5-9-22-19/h2-9,14H,10-13,15H2,1H3	CBNWPEQPUJLGRN-UHFFFAOYSA-N	394.146346674							108383
MLS000062031	LSM-19760	SID4263276, BRD-K96385839	566595	InChI=1S/C13H18ClNO3S/c1-18-13-10-11(6-7-12(13)14)19(16,17)15-8-4-2-3-5-9-15/h6-7,10H,2-5,8-9H2,1H3	VFGFTDOTXGPWKW-UHFFFAOYSA-N	COc1cc(ccc1Cl)S(=O)(=O)N2CCCCCC2	BroadT	BRD-K96385839	BRD-K96385839-001-05-1	ChemBridge Corporation	6441133			COc1cc(ccc1Cl)S(=O)(=O)N1CCCCCC1	InChI=1S/C13H18ClNO3S/c1-18-13-10-11(6-7-12(13)14)19(16,17)15-8-4-2-3-5-9-15/h6-7,10H,2-5,8-9H2,1H3	VFGFTDOTXGPWKW-UHFFFAOYSA-N	303.069591846							108384
STK276057	LSM-19761	SID4258805, BRD-K94683388	2224382	InChI=1S/C15H19NO3S/c1-19-10-3-9-16-12(6-8-15(17)18)5-7-13(16)14-4-2-11-20-14/h2,4-5,7,11H,3,6,8-10H2,1H3,(H,17,18)	UHWDVVGLOOPKRS-UHFFFAOYSA-N	COCCCn1c(CCC(=O)O)ccc1c2cccs2	BroadT	BRD-K94683388	BRD-K94683388-001-05-6	ChemBridge Corporation	7933665			COCCCn1c(CCC(O)=O)ccc1-c1cccs1	InChI=1S/C15H19NO3S/c1-19-10-3-9-16-12(6-8-15(17)18)5-7-13(16)14-4-2-11-20-14/h2,4-5,7,11H,3,6,8-10H2,1H3,(H,17,18)	UHWDVVGLOOPKRS-UHFFFAOYSA-N	293.108564168							108385
AC1NSENI	LSM-19762	SID7966732, BRD-K54733859	5308410	InChI=1S/C21H24N4O3S/c1-24(2)18-11-9-16(10-12-18)14-23-20(26)15-25(3)29(27,28)19-8-4-6-17-7-5-13-22-21(17)19/h4-13H,14-15H2,1-3H3,(H,23,26)	HSQQAHYDHSIDCH-UHFFFAOYSA-N	CN(C)c1ccc(CNC(=O)CN(C)S(=O)(=O)c2cccc3cccnc23)cc1	BroadT	BRD-K54733859	BRD-K54733859-001-04-0	ChemDiv Inc.	C737-3418			CN(C)c1ccc(CNC(=O)CN(C)S(=O)(=O)c2cccc3cccnc23)cc1	InChI=1S/C21H24N4O3S/c1-24(2)18-11-9-16(10-12-18)14-23-20(26)15-25(3)29(27,28)19-8-4-6-17-7-5-13-22-21(17)19/h4-13H,14-15H2,1-3H3,(H,23,26)	HSQQAHYDHSIDCH-UHFFFAOYSA-N	412.156911358							108386
MLS000545503	LSM-19763	SID17407078, BRD-K67445143	1767737	InChI=1S/C17H22N4OS/c1-4-18-17(23)21-20-16(22)14-10-12(9-11(2)3)19-15-8-6-5-7-13(14)15/h5-8,10-11H,4,9H2,1-3H3,(H,20,22)(H2,18,21,23)	MYTRQYCYPXKAQI-UHFFFAOYSA-N	CCN=C(S)NNC(=O)c1cc(CC(C)C)nc2ccccc12	BroadT	BRD-K67445143	BRD-K67445143-001-05-9	Specs	AK-968/41924376			CCN=C(S)NNC(=O)c1cc(CC(C)C)nc2ccccc12	InChI=1S/C17H22N4OS/c1-4-18-17(23)21-20-16(22)14-10-12(9-11(2)3)19-15-8-6-5-7-13(14)15/h5-8,10-11H,4,9H2,1-3H3,(H,20,22)(H2,18,21,23)	MYTRQYCYPXKAQI-UHFFFAOYSA-N	330.151432054							108387
ST50763038	LSM-19764	SID24784050, BRD-K74718509	716377	InChI=1S/C13H13N5O3S/c1-20-9-3-7-8(4-10(9)21-2)16-11(17-12(7)19)5-22-13-14-6-15-18-13/h3-4,6H,5H2,1-2H3,(H,14,15,18)(H,16,17,19)	LZHQIMCBWDPRNV-UHFFFAOYSA-N	COc1cc2nc(CSc3nc[nH]n3)nc(O)c2cc1OC	BroadT	BRD-K74718509	BRD-K74718509-001-06-6	Asinex Ltd.	BAS 03058199			COc1cc2nc(CSc3nc[nH]n3)nc(O)c2cc1OC	InChI=1S/C13H13N5O3S/c1-20-9-3-7-8(4-10(9)21-2)16-11(17-12(7)19)5-22-13-14-6-15-18-13/h3-4,6H,5H2,1-2H3,(H,14,15,18)(H,16,17,19)	LZHQIMCBWDPRNV-UHFFFAOYSA-N	319.073910016							108388
MLS000395060	LSM-19765	SID22406287, BRD-K64642958	4206406	InChI=1S/C22H22N4O5S2/c1-4-25(5-2)33(29,30)14-9-10-17(31-3)16(12-14)23-20(27)18-13-15-21(32-18)24-19-8-6-7-11-26(19)22(15)28/h6-13H,4-5H2,1-3H3,(H,23,27)	MRMDGUYNXDPZFH-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)c2cc3C(=O)N4C=CC=CC4=Nc3s2)c1	BroadT	BRD-K64642958	BRD-K64642958-001-06-6	Enamine Ltd.	T0508-7923			CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)c2cc3c(nc4ccccn4c3=O)s2)c1	InChI=1S/C22H22N4O5S2/c1-4-25(5-2)33(29,30)14-9-10-17(31-3)16(12-14)23-20(27)18-13-15-21(32-18)24-19-8-6-7-11-26(19)22(15)28/h6-13H,4-5H2,1-3H3,(H,23,27)	MRMDGUYNXDPZFH-UHFFFAOYSA-N	486.103161224							108389
SMR000082427	LSM-19766	SID4265298, BRD-K63767506	2981828	InChI=1S/C20H16N2O5S/c23-19-14-6-3-5-13-17(28(25,26)21-10-1-2-11-21)9-8-15(18(13)14)22(19)20(24)16-7-4-12-27-16/h3-9,12H,1-2,10-11H2	HVQXAMAIYKOLMM-UHFFFAOYSA-N	O=C(N1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)N4CCCC4)c5occc5	BroadT	BRD-K63767506	BRD-K63767506-001-05-1	ChemBridge Corporation	7982642			O=C(N1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)N1CCCC1)c1ccco1	InChI=1S/C20H16N2O5S/c23-19-14-6-3-5-13-17(28(25,26)21-10-1-2-11-21)9-8-15(18(13)14)22(19)20(24)16-7-4-12-27-16/h3-9,12H,1-2,10-11H2	HVQXAMAIYKOLMM-UHFFFAOYSA-N	396.077992322							108390
MLS000057237	LSM-19767	SID3712654, BRD-K30647015	2568758	InChI=1S/C21H20N2O4/c1-13-7-6-8-16(11-13)20(24)22-19-10-5-4-9-17(19)21(25)26-12-18-14(2)23-27-15(18)3/h4-11H,12H2,1-3H3,(H,22,24)	KSINNJSNPXGHAP-UHFFFAOYSA-N	Cc1cccc(c1)C(=O)Nc2ccccc2C(=O)OCc3c(C)onc3C	BroadT	BRD-K30647015	BRD-K30647015-001-05-9	Enamine Ltd.	T5346071			Cc1noc(C)c1COC(=O)c1ccccc1NC(=O)c1cccc(C)c1	InChI=1S/C21H20N2O4/c1-13-7-6-8-16(11-13)20(24)22-19-10-5-4-9-17(19)21(25)26-12-18-14(2)23-27-15(18)3/h4-11H,12H2,1-3H3,(H,22,24)	KSINNJSNPXGHAP-UHFFFAOYSA-N	364.14230714							108391
SMR000047078	LSM-19768	SID864533, BRD-K50977765	665776	InChI=1S/C16H14N4S/c1-11-10-14(21-9-8-17)20-16(18-11)15(12(2)19-20)13-6-4-3-5-7-13/h3-7,10H,9H2,1-2H3	IKRWSIONZWYJSC-UHFFFAOYSA-N	Cc1cc(SCC#N)n2nc(C)c(c3ccccc3)c2n1	BroadT	BRD-K50977765	BRD-K50977765-001-05-7	InterBioScreen Ltd.	STOCK5S-23818			Cc1nn2c(SCC#N)cc(C)nc2c1-c1ccccc1	InChI=1S/C16H14N4S/c1-11-10-14(21-9-8-17)20-16(18-11)15(12(2)19-20)13-6-4-3-5-7-13/h3-7,10H,9H2,1-2H3	IKRWSIONZWYJSC-UHFFFAOYSA-N	294.093917178							108392
ZINC00644204	LSM-19769	SID14718816, BRD-K15595730	991456	InChI=1S/C20H17ClN2O4/c1-26-15-7-4-13(5-8-15)19(24)23-18-9-6-14(21)11-17(18)20(25)22-12-16-3-2-10-27-16/h2-11H,12H2,1H3,(H,22,25)(H,23,24)	PVBKHLONPNEUIX-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)Nc2ccc(Cl)cc2C(=O)NCc3occc3	BroadT	BRD-K15595730	BRD-K15595730-001-05-3	Specs	AP-064/41684916			COc1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)NCc1ccco1	InChI=1S/C20H17ClN2O4/c1-26-15-7-4-13(5-8-15)19(24)23-18-9-6-14(21)11-17(18)20(25)22-12-16-3-2-10-27-16/h2-11H,12H2,1H3,(H,22,25)(H,23,24)	PVBKHLONPNEUIX-UHFFFAOYSA-N	384.087684754							108393
MLS000711065	LSM-43851	BRD-K09971865	2168379	InChI=1S/C12H14N2S2/c1-2-3-4-10-5-6-11(16-10)7-9(8-13)12(14)15/h5-7H,2-4H2,1H3,(H2,14,15)/b9-7+	SBUVOAYIBFERCL-VQHVLOKHSA-N	CCCCc1ccc(\C=C(/C#N)\C(=N)S)s1	BroadT	BRD-K09971865	BRD-K09971865-001-03-6	Asinex Ltd.	BAS 00512945			CCCCc1ccc(\C=C(/C#N)C(S)=N)s1	InChI=1S/C12H14N2S2/c1-2-3-4-10-5-6-11(16-10)7-9(8-13)12(14)15/h5-7H,2-4H2,1H3,(H2,14,15)/b9-7+	SBUVOAYIBFERCL-VQHVLOKHSA-N	250.059839848							
SS-0694	LSM-19771	SID852431, BRD-A15053993	655054	InChI=1S/C23H29N5O4/c1-3-17-21-20(16(14-24)22(25)32-23(21)27-26-17)15-5-6-18(19(13-15)30-4-2)31-12-9-28-7-10-29-11-8-28/h5-6,13,20H,3-4,7-12,25H2,1-2H3,(H,26,27)	CRORSJFKSIBGJC-UHFFFAOYSA-N	CCOc1cc(ccc1OCCN2CCOCC2)C3C(=C(N)Oc4[nH]nc(CC)c34)C#N	BroadT	BRD-A15053993	BRD-A15053993-001-06-5	Asinex Ltd.	BAS 06899976			CCOc1cc(ccc1OCCN1CCOCC1)C1c2c(CC)n[nH]c2OC(N)=C1C#N	InChI=1S/C23H29N5O4/c1-3-17-21-20(16(14-24)22(25)32-23(21)27-26-17)15-5-6-18(19(13-15)30-4-2)31-12-9-28-7-10-29-11-8-28/h5-6,13,20H,3-4,7-12,25H2,1-2H3,(H,26,27)	CRORSJFKSIBGJC-UHFFFAOYSA-N	439.221954458							108395
AC1MMQJ6	LSM-19772	SID4248830, BRD-K76263047	3242854	InChI=1S/C16H15FN6O2/c17-11-3-5-12(6-4-11)23-15-14(19-20-23)16(25)22(10-18-15)9-13(24)21-7-1-2-8-21/h3-6,10H,1-2,7-9H2	VHIKNYNWTQLQAU-UHFFFAOYSA-N	Fc1ccc(cc1)n2nnc3C(=O)N(CC(=O)N4CCCC4)C=Nc23	BroadT	BRD-K76263047	BRD-K76263047-001-05-2	ChemDiv Inc.	C656-0382			Fc1ccc(cc1)-n1nnc2c1ncn(CC(=O)N1CCCC1)c2=O	InChI=1S/C16H15FN6O2/c17-11-3-5-12(6-4-11)23-15-14(19-20-23)16(25)22(10-18-15)9-13(24)21-7-1-2-8-21/h3-6,10H,1-2,7-9H2	VHIKNYNWTQLQAU-UHFFFAOYSA-N	342.12405198							108396
MLS000105400	LSM-19773	SID7974420, BRD-K31788464	765057	InChI=1S/C16H20N2OS/c1-19-16-5-3-2-4-15(16)18-9-7-17(8-10-18)12-14-6-11-20-13-14/h2-6,11,13H,7-10,12H2,1H3	WYWZGBZCYGPUTL-UHFFFAOYSA-N	COc1ccccc1N2CCN(Cc3ccsc3)CC2	BroadT	BRD-K31788464	BRD-K31788464-001-05-6	ChemBridge Corporation	5269793			COc1ccccc1N1CCN(Cc2ccsc2)CC1	InChI=1S/C16H20N2OS/c1-19-16-5-3-2-4-15(16)18-9-7-17(8-10-18)12-14-6-11-20-13-14/h2-6,11,13H,7-10,12H2,1H3	WYWZGBZCYGPUTL-UHFFFAOYSA-N	288.12963397							108397
SMR000171007	LSM-19774	SID17507266, BRD-K91211435	3192879	InChI=1S/C24H29ClN4O6S2/c25-20-6-10-22(11-7-20)37(34,35)29-16-12-19(13-17-29)24(31)27-26-23(30)18-4-8-21(9-5-18)36(32,33)28-14-2-1-3-15-28/h4-11,19H,1-3,12-17H2,(H,26,30)(H,27,31)	LXINDZIEMNVCHR-UHFFFAOYSA-N	Clc1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)NNC(=O)c3ccc(cc3)S(=O)(=O)N4CCCCC4	BroadT	BRD-K91211435	BRD-K91211435-001-05-2	Asinex Ltd.	ASN 05018457			Clc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NNC(=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1	InChI=1S/C24H29ClN4O6S2/c25-20-6-10-22(11-7-20)37(34,35)29-16-12-19(13-17-29)24(31)27-26-23(30)18-4-8-21(9-5-18)36(32,33)28-14-2-1-3-15-28/h4-11,19H,1-3,12-17H2,(H,26,30)(H,27,31)	LXINDZIEMNVCHR-UHFFFAOYSA-N	568.121703778							108398
STK151112	LSM-2478	SID24273879, SID48410176, BRD-K21614065	704205	InChI=1S/C11H11ClN4O2/c1-7-4-8(2-3-9(7)12)18-5-10(17)15-11-13-6-14-16-11/h2-4,6H,5H2,1H3,(H2,13,14,15,16,17)	DDSVUTNMKCJKGE-UHFFFAOYSA-N	Cc1cc(OCC(=O)Nc2nc[nH]n2)ccc1Cl	BroadT	BRD-K21614065	BRD-K21614065-001-04-2	Sanford-Burnham Medical Research Institute	MLS-0146327.0001			Cc1cc(OCC(=O)Nc2nnc[nH]2)ccc1Cl	InChI=1S/C11H11ClN4O2/c1-7-4-8(2-3-9(7)12)18-5-10(17)15-11-13-6-14-16-11/h2-4,6H,5H2,1H3,(H2,13,14,15,16,17)	DDSVUTNMKCJKGE-UHFFFAOYSA-N	266.057053342							92387
4-Tert-butyl-n-(4-morpholin-4-yl-phenyl)-benzamide	LSM-19775	SID14724638, BRD-K59572954	671014	InChI=1S/C21H26N2O2/c1-21(2,3)17-6-4-16(5-7-17)20(24)22-18-8-10-19(11-9-18)23-12-14-25-15-13-23/h4-11H,12-15H2,1-3H3,(H,22,24)	ARULSDQRCKOYIO-UHFFFAOYSA-N	CC(C)(C)c1ccc(cc1)C(=O)Nc2ccc(cc2)N3CCOCC3	BroadT	BRD-K59572954	BRD-K59572954-001-06-6	Asinex Ltd.	BAS 00290970			CC(C)(C)c1ccc(cc1)C(=O)Nc1ccc(cc1)N1CCOCC1	InChI=1S/C21H26N2O2/c1-21(2,3)17-6-4-16(5-7-17)20(24)22-18-8-10-19(11-9-18)23-12-14-25-15-13-23/h4-11H,12-15H2,1-3H3,(H,22,24)	ARULSDQRCKOYIO-UHFFFAOYSA-N	338.199428092							108399
SMR000039926	LSM-19776	SID857647, BRD-A10320401	658994	InChI=1S/C21H24N4O3S/c1-21-7-6-14(26)25(21)16-15-12-4-2-3-5-13(12)18(24-8-10-28-11-9-24)22-20(15)29-17(16)19(27)23-21/h2-11H2,1H3,(H,23,27)	ZVEXIEYAKCXGHF-UHFFFAOYSA-N	CC12CCC(=O)N1c3c(sc4nc(N5CCOCC5)c6CCCCc6c34)C(=O)N2	BroadT	BRD-A10320401	BRD-A10320401-001-05-1	InterBioScreen Ltd.	STOCK1S-81964			CC12CCC(=O)N1c1c(sc3nc(N4CCOCC4)c4CCCCc4c13)C(=O)N2	InChI=1S/C21H24N4O3S/c1-21-7-6-14(26)25(21)16-15-12-4-2-3-5-13(12)18(24-8-10-28-11-9-24)22-20(15)29-17(16)19(27)23-21/h2-11H2,1H3,(H,23,27)	ZVEXIEYAKCXGHF-UHFFFAOYSA-N	412.156911358							108400
MLS000590696	LSM-43852	SID17513560, BRD-A58214621	12005719	InChI=1S/C22H29N5O2S/c1-15(25-26-13-6-5-11-18(26)16-8-7-12-23-14-16)19-20(28)24-22(30)27(21(19)29)17-9-3-2-4-10-17/h7-8,12,14,17-18,25H,2-6,9-11,13H2,1H3,(H,24,28,30)/b19-15+	JSLFMQXCOCNGKU-XDJHFCHBSA-N	C\C(=C/1\C(=O)NC(=S)N(C2CCCCC2)C1=O)\NN3CCCCC3c4cccnc4	BroadT	BRD-A58214621	BRD-A58214621-001-05-3	InterBioScreen Ltd.	STOCK3S-77301			C\C(NN1CCCCC1c1cccnc1)=C1\C(=O)NC(=S)N(C2CCCCC2)C1=O	InChI=1S/C22H29N5O2S/c1-15(25-26-13-6-5-11-18(26)16-8-7-12-23-14-16)19-20(28)24-22(30)27(21(19)29)17-9-3-2-4-10-17/h7-8,12,14,17-18,25H,2-6,9-11,13H2,1H3,(H,24,28,30)/b19-15+	JSLFMQXCOCNGKU-XDJHFCHBSA-N	427.204195908							
SMR000095125	LSM-19778	SID7965265, BRD-A24316989	5307515	InChI=1S/C19H26N2O3/c1-2-11-21-18(23)15-10-9-13(12-16(15)19(21)24)17(22)20-14-7-5-3-4-6-8-14/h9-10,12,14,18,23H,2-8,11H2,1H3,(H,20,22)	LTLRHXMASFZIIK-UHFFFAOYSA-N	CCCN1C(O)c2ccc(cc2C1=O)C(=O)NC3CCCCCC3	BroadT	BRD-A24316989	BRD-A24316989-001-05-3	ChemDiv Inc.	C596-0816			CCCN1C(O)c2ccc(cc2C1=O)C(=O)NC1CCCCCC1	InChI=1S/C19H26N2O3/c1-2-11-21-18(23)15-10-9-13(12-16(15)19(21)24)17(22)20-14-7-5-3-4-6-8-14/h9-10,12,14,18,23H,2-8,11H2,1H3,(H,20,22)	LTLRHXMASFZIIK-UHFFFAOYSA-N	330.194342712							108402
AC1O9CJS	LSM-19779	SID4260307, BRD-K33027065	6780305	InChI=1S/C13H17NOS/c15-12-8-4-3-7-11(12)13(16)14-9-5-1-2-6-10-14/h3-4,7-8,15H,1-2,5-6,9-10H2	GMMHAHQRANMSCS-UHFFFAOYSA-N	Oc1ccccc1C(=S)N2CCCCCC2	BroadT	BRD-K33027065	BRD-K33027065-001-05-0	ChemBridge Corporation	7939563			Oc1ccccc1C(=S)N1CCCCCC1	InChI=1S/C13H17NOS/c15-12-8-4-3-7-11(12)13(16)14-9-5-1-2-6-10-14/h3-4,7-8,15H,1-2,5-6,9-10H2	GMMHAHQRANMSCS-UHFFFAOYSA-N	235.103084864							
MLS000051884	LSM-19780	SID4265767, BRD-K02569961	2227364	InChI=1S/C20H15NO5S/c22-27(23,21-13-5-7-19-20(11-13)25-10-9-24-19)14-6-8-18-16(12-14)15-3-1-2-4-17(15)26-18/h1-8,11-12,21H,9-10H2	KJXBABZUGIPKNH-UHFFFAOYSA-N	O=S(=O)(Nc1ccc2OCCOc2c1)c3ccc4oc5ccccc5c4c3	BroadT	BRD-K02569961	BRD-K02569961-001-05-3	ChemBridge Corporation	7952720			O=S(=O)(Nc1ccc2OCCOc2c1)c1ccc2oc3ccccc3c2c1	InChI=1S/C20H15NO5S/c22-27(23,21-13-5-7-19-20(11-13)25-10-9-24-19)14-6-8-18-16(12-14)15-3-1-2-4-17(15)26-18/h1-8,11-12,21H,9-10H2	KJXBABZUGIPKNH-UHFFFAOYSA-N	381.06709328							108404
SMR000221311	LSM-43853	SID17505427, BRD-K49039795	1953490	InChI=1S/C25H28N2O5/c1-31-22-7-3-2-5-18(22)6-4-8-23-24(30)19-9-10-21(29)20(25(19)32-23)17-27-13-11-26(12-14-27)15-16-28/h2-10,28-29H,11-17H2,1H3/b6-4+,23-8-	DGBDTVNISBOCDB-YUMLRZHGSA-N	COc1ccccc1\C=C\C=C\2/Oc3c(CN4CCN(CCO)CC4)c(O)ccc3C2=O	BroadT	BRD-K49039795	BRD-K49039795-001-06-2	InterBioScreen Ltd.	STOCK5S-51797			COc1ccccc1\C=C\C=C1/Oc2c(ccc(O)c2CN2CCN(CCO)CC2)C1=O	InChI=1S/C25H28N2O5/c1-31-22-7-3-2-5-18(22)6-4-8-23-24(30)19-9-10-21(29)20(25(19)32-23)17-27-13-11-26(12-14-27)15-16-28/h2-10,28-29H,11-17H2,1H3/b6-4+,23-8-	DGBDTVNISBOCDB-YUMLRZHGSA-N	436.199822016							
MLS001233859	LSM-19782	SID49677542, BRD-K41845062	2517857	InChI=1S/C16H15BrClN3O3S2/c17-11-3-4-14(13(18)10-11)26(23,24)21-8-6-20(7-9-21)16(22)12-2-1-5-19-15(12)25/h1-5,10H,6-9H2,(H,19,25)	FUEWFIVAKBVWAB-UHFFFAOYSA-N	Sc1ncccc1C(=O)N2CCN(CC2)S(=O)(=O)c3ccc(Br)cc3Cl	BroadT	BRD-K41845062	BRD-K41845062-001-06-6	Enamine Ltd.	T5333604			Sc1ncccc1C(=O)N1CCN(CC1)S(=O)(=O)c1ccc(Br)cc1Cl	InChI=1S/C16H15BrClN3O3S2/c17-11-3-4-14(13(18)10-11)26(23,24)21-8-6-20(7-9-21)16(22)12-2-1-5-19-15(12)25/h1-5,10H,6-9H2,(H,19,25)	FUEWFIVAKBVWAB-UHFFFAOYSA-N	474.94267306							108406
AC1NO26L	LSM-19783	BRD-K38777862	5131068	InChI=1S/C12H14Cl3N3OS/c1-7(17-18-12(20)16-5-6-19-2)8-3-4-9(13)11(15)10(8)14/h3-4H,5-6H2,1-2H3,(H2,16,18,20)	IUHHPRPBHKHHQJ-UHFFFAOYSA-N	COCCN=C(S)NN=C(C)c1ccc(Cl)c(Cl)c1Cl	BroadT	BRD-K38777862	BRD-K38777862-001-05-0	Enamine Ltd.	T0514-7538			COCCN=C(S)NN=C(C)c1ccc(Cl)c(Cl)c1Cl	InChI=1S/C12H14Cl3N3OS/c1-7(17-18-12(20)16-5-6-19-2)8-3-4-9(13)11(15)10(8)14/h3-4H,5-6H2,1-2H3,(H2,16,18,20)	IUHHPRPBHKHHQJ-UHFFFAOYSA-N	352.992315918							108407
AC1N6OBK	LSM-19784	BRD-K57654708	4263208	InChI=1S/C21H18N8O4/c1-11-3-5-13(6-4-11)12(2)23-25-21(30)17-18(14-7-8-15-16(9-14)32-10-31-15)29(28-24-17)20-19(22)26-33-27-20/h3-9H,10H2,1-2H3,(H2,22,26)(H,25,30)	HFKWHFDKOWJDRR-UHFFFAOYSA-N	CC(=NNC(=O)c1nnn(c1c2ccc3OCOc3c2)c4nonc4N)c5ccc(C)cc5	BroadT	BRD-K57654708	BRD-K57654708-001-06-3	InterBioScreen Ltd.	STOCK4S-95756			CC(=NNC(=O)c1nnn(-c2nonc2N)c1-c1ccc2OCOc2c1)c1ccc(C)cc1	InChI=1S/C21H18N8O4/c1-11-3-5-13(6-4-11)12(2)23-25-21(30)17-18(14-7-8-15-16(9-14)32-10-31-15)29(28-24-17)20-19(22)26-33-27-20/h3-9H,10H2,1-2H3,(H2,22,26)(H,25,30)	HFKWHFDKOWJDRR-UHFFFAOYSA-N	446.145101136							108408
MLS001105153	LSM-19785	SID49732432, BRD-A13299435	24793139	InChI=1S/C21H25N5OS/c1-13-19(28-25-24-13)20(27)23-17-6-5-7-18-16(17)12-22-26(18)15-10-8-14(9-11-15)21(2,3)4/h8-12,17H,5-7H2,1-4H3,(H,23,27)	SPWXNXCGWJWGSB-UHFFFAOYSA-N	Cc1nnsc1C(=O)NC2CCCc3c2cnn3c4ccc(cc4)C(C)(C)C	BroadT	BRD-A13299435	BRD-A13299435-001-06-2	ChemBridge Corporation	40747496			Cc1nnsc1C(=O)NC1CCCc2c1cnn2-c1ccc(cc1)C(C)(C)C	InChI=1S/C21H25N5OS/c1-13-19(28-25-24-13)20(27)23-17-6-5-7-18-16(17)12-22-26(18)15-10-8-14(9-11-15)21(2,3)4/h8-12,17H,5-7H2,1-4H3,(H,23,27)	SPWXNXCGWJWGSB-UHFFFAOYSA-N	395.17798116							108409
SMR000044924	LSM-19786	SID862833, BRD-K71419333	664066	InChI=1S/C19H16ClN3O3/c1-24-16-8-7-12(9-17(16)25-2)18-23-15(10-21)19(26-18)22-11-13-5-3-4-6-14(13)20/h3-9,22H,11H2,1-2H3	YSMQLDBKVHIHFD-UHFFFAOYSA-N	COc1ccc(cc1OC)c2oc(NCc3ccccc3Cl)c(n2)C#N	BroadT	BRD-K71419333	BRD-K71419333-001-05-8	InterBioScreen Ltd.	STOCK4S-55645			COc1ccc(cc1OC)-c1nc(C#N)c(NCc2ccccc2Cl)o1	InChI=1S/C19H16ClN3O3/c1-24-16-8-7-12(9-17(16)25-2)18-23-15(10-21)19(26-18)22-11-13-5-3-4-6-14(13)20/h3-9,22H,11H2,1-2H3	YSMQLDBKVHIHFD-UHFFFAOYSA-N	369.088019112							108410
2K-029	LSM-19787	SID17402562, BRD-K58538309	1470918	InChI=1S/C18H15F3N4O/c1-11-7-3-4-8-12(11)17(26)24-25(2)16-15(18(19,20)21)22-13-9-5-6-10-14(13)23-16/h3-10H,1-2H3,(H,24,26)	POCREAFIBPVMBR-UHFFFAOYSA-N	CN(NC(=O)c1ccccc1C)c2nc3ccccc3nc2C(F)(F)F	BroadT	BRD-K58538309	BRD-K58538309-001-06-0	Key Organics Ltd.	2K-029			CN(NC(=O)c1ccccc1C)c1nc2ccccc2nc1C(F)(F)F	InChI=1S/C18H15F3N4O/c1-11-7-3-4-8-12(11)17(26)24-25(2)16-15(18(19,20)21)22-13-9-5-6-10-14(13)23-16/h3-10H,1-2H3,(H,24,26)	POCREAFIBPVMBR-UHFFFAOYSA-N	360.11979574							108411
SMR000212022	LSM-19788	BRD-A62995832	3806335	InChI=1S/C19H21N3O3/c1-19(2,3)13-7-8-15-16(10-13)25-17(12-24-15)18(23)22-21-11-14-6-4-5-9-20-14/h4-11,17H,12H2,1-3H3,(H,22,23)	JDJGSIZJBSTISP-UHFFFAOYSA-N	CC(C)(C)c1ccc2OCC(Oc2c1)C(=O)NN=Cc3ccccn3	BroadT	BRD-A62995832	BRD-A62995832-001-05-6	InterBioScreen Ltd.	STOCK2S-61459			CC(C)(C)c1ccc2OCC(Oc2c1)C(=O)NN=Cc1ccccn1	InChI=1S/C19H21N3O3/c1-19(2,3)13-7-8-15-16(10-13)25-17(12-24-15)18(23)22-21-11-14-6-4-5-9-20-14/h4-11,17H,12H2,1-3H3,(H,22,23)	JDJGSIZJBSTISP-UHFFFAOYSA-N	339.158291562							108412
ST058880	LSM-19789	SID24811646, BRD-K53900378	3936614	InChI=1S/C18H15ClN2O3/c19-14-6-2-4-8-16(14)24-10-9-20-18(23)17(22)13-11-21-15-7-3-1-5-12(13)15/h1-8,11,21H,9-10H2,(H,20,23)	ZBQWXDVLRFDJLZ-UHFFFAOYSA-N	Clc1ccccc1OCCNC(=O)C(=O)c2c[nH]c3ccccc23	BroadT	BRD-K53900378	BRD-K53900378-001-05-5	ChemDiv Inc.	8014-1911			Clc1ccccc1OCCNC(=O)C(=O)c1c[nH]c2ccccc12	InChI=1S/C18H15ClN2O3/c19-14-6-2-4-8-16(14)24-10-9-20-18(23)17(22)13-11-21-15-7-3-1-5-12(13)15/h1-8,11,21H,9-10H2,(H,20,23)	ZBQWXDVLRFDJLZ-UHFFFAOYSA-N	342.07712007							108413
SMR000130821	LSM-19790	SID14734281, BRD-K95206601	6622826	InChI=1S/C26H32N4O5/c1-6-34-24(31)20-16-30-22(15-21(28-30)17-7-9-19(33-5)10-8-17)27-23(20)18-11-13-29(14-12-18)25(32)35-26(2,3)4/h7-10,15-16,18H,6,11-14H2,1-5H3	GGBFBHKVPYQVAS-UHFFFAOYSA-N	CCOC(=O)c1cn2nc(cc2nc1C3CCN(CC3)C(=O)OC(C)(C)C)c4ccc(OC)cc4	BroadT	BRD-K95206601	BRD-K95206601-001-07-2	ChemDiv Inc.	C614-5068			CCOC(=O)c1cn2nc(cc2nc1C1CCN(CC1)C(=O)OC(C)(C)C)-c1ccc(OC)cc1	InChI=1S/C26H32N4O5/c1-6-34-24(31)20-16-30-22(15-21(28-30)17-7-9-19(33-5)10-8-17)27-23(20)18-11-13-29(14-12-18)25(32)35-26(2,3)4/h7-10,15-16,18H,6,11-14H2,1-5H3	GGBFBHKVPYQVAS-UHFFFAOYSA-N	480.237270164							108414
3-(2-Piperidin-1-yl-acetylamino)-1H-indole-2-carboxylic acid ethyl ester	LSM-19791	SID849041, BRD-K14254115	651507	InChI=1S/C18H23N3O3/c1-2-24-18(23)17-16(13-8-4-5-9-14(13)19-17)20-15(22)12-21-10-6-3-7-11-21/h4-5,8-9,19H,2-3,6-7,10-12H2,1H3,(H,20,22)	CUMOULPJLKYRTG-UHFFFAOYSA-N	CCOC(=O)c1[nH]c2ccccc2c1NC(=O)CN3CCCCC3	BroadT	BRD-K14254115	BRD-K14254115-001-05-3	Asinex Ltd.	BAS 00703263			CCOC(=O)c1[nH]c2ccccc2c1NC(=O)CN1CCCCC1	InChI=1S/C18H23N3O3/c1-2-24-18(23)17-16(13-8-4-5-9-14(13)19-17)20-15(22)12-21-10-6-3-7-11-21/h4-5,8-9,19H,2-3,6-7,10-12H2,1H3,(H,20,22)	CUMOULPJLKYRTG-UHFFFAOYSA-N	329.173941626							108415
4-Chloro-n-(2-methoxyphenazin-1-yl)benzamide	LSM-19792	SID17512045, BRD-K76847450	3707794	InChI=1S/C20H14ClN3O2/c1-26-17-11-10-16-18(23-15-5-3-2-4-14(15)22-16)19(17)24-20(25)12-6-8-13(21)9-7-12/h2-11H,1H3,(H,24,25)	CHSJEFIEQFTFKV-UHFFFAOYSA-N	COc1ccc2nc3ccccc3nc2c1NC(=O)c4ccc(Cl)cc4	BroadT	BRD-K76847450	BRD-K76847450-001-06-0	InterBioScreen Ltd.	STOCK1S-73692			COc1ccc2nc3ccccc3nc2c1NC(=O)c1ccc(Cl)cc1	InChI=1S/C20H14ClN3O2/c1-26-17-11-10-16-18(23-15-5-3-2-4-14(15)22-16)19(17)24-20(25)12-6-8-13(21)9-7-12/h2-11H,1H3,(H,24,25)	CHSJEFIEQFTFKV-UHFFFAOYSA-N	363.077454428							108416
AG-690/10801009	LSM-19793	SID17505213, BRD-K84883878	1720697	InChI=1S/C16H14N2O7S/c19-15(12-6-8-13(9-7-12)18(21)22)11-25-16(20)10-17-26(23,24)14-4-2-1-3-5-14/h1-9,17H,10-11H2	XPMOOAHIOSGJRD-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)C(=O)COC(=O)CNS(=O)(=O)c2ccccc2	BroadT	BRD-K84883878	BRD-K84883878-001-05-1	Asinex Ltd.	BAS 00442302			[O-][N+](=O)c1ccc(cc1)C(=O)COC(=O)CNS(=O)(=O)c1ccccc1	InChI=1S/C16H14N2O7S/c19-15(12-6-8-13(9-7-12)18(21)22)11-25-16(20)10-17-26(23,24)14-4-2-1-3-5-14/h1-9,17H,10-11H2	XPMOOAHIOSGJRD-UHFFFAOYSA-N	378.052171498							108417
SMR000200050	LSM-19794	SID17434025, SID85176609, BRD-K63077971	2211281	InChI=1S/C27H29N3O3S/c31-27(28-25-11-13-26(14-12-25)34(32,33)30-16-3-4-17-30)23-9-7-21(8-10-23)19-29-18-15-22-5-1-2-6-24(22)20-29/h1-2,5-14H,3-4,15-20H2,(H,28,31)	IDQGIAKHENYTHX-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)S(=O)(=O)N2CCCC2)c3ccc(CN4CCc5ccccc5C4)cc3	BroadT	BRD-K63077971	BRD-K63077971-001-05-1	ChemBridge Corporation	7831806			O=C(Nc1ccc(cc1)S(=O)(=O)N1CCCC1)c1ccc(CN2CCc3ccccc3C2)cc1	InChI=1S/C27H29N3O3S/c31-27(28-25-11-13-26(14-12-25)34(32,33)30-16-3-4-17-30)23-9-7-21(8-10-23)19-29-18-15-22-5-1-2-6-24(22)20-29/h1-2,5-14H,3-4,15-20H2,(H,28,31)	IDQGIAKHENYTHX-UHFFFAOYSA-N	475.192962508							108418
3-(4-Fluoroanilino)-1-(3-nitrophenyl)-1-propanone	LSM-19795	SID17412574, BRD-K85358503	580285	InChI=1S/C15H13FN2O3/c16-12-4-6-13(7-5-12)17-9-8-15(19)11-2-1-3-14(10-11)18(20)21/h1-7,10,17H,8-9H2	AEXQSORQCYRTJF-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C(=O)CCNc2ccc(F)cc2	BroadT	BRD-K85358503	BRD-K85358503-001-05-6	ChemBridge Corporation	5929357			[O-][N+](=O)c1cccc(c1)C(=O)CCNc1ccc(F)cc1	InChI=1S/C15H13FN2O3/c16-12-4-6-13(7-5-12)17-9-8-15(19)11-2-1-3-14(10-11)18(20)21/h1-7,10,17H,8-9H2	AEXQSORQCYRTJF-UHFFFAOYSA-N	288.091020496							108419
3-Bromo-7-hydroxy-4,8-dimethylcoumarin	LSM-19796	SID22411655, BRD-K58826199	5411577	InChI=1S/C11H9BrO3/c1-5-7-3-4-8(13)6(2)10(7)15-11(14)9(5)12/h3-4,13H,1-2H3	CUZVPTYKIQMJDT-UHFFFAOYSA-N	CC1=C(Br)C(=O)Oc2c(C)c(O)ccc12	BroadT	BRD-K58826199	BRD-K58826199-001-05-4	Specs	AN-829/14685019			Cc1c(O)ccc2c(C)c(Br)c(=O)oc12	InChI=1S/C11H9BrO3/c1-5-7-3-4-8(13)6(2)10(7)15-11(14)9(5)12/h3-4,13H,1-2H3	CUZVPTYKIQMJDT-UHFFFAOYSA-N	267.973506748							108420
AC1MEQN3	LSM-15297	BRD-A46044001	2882519	InChI=1S/C22H31N3O2/c1-22(2,3)19-8-4-5-9-20(19)27-17-18(26)16-24-12-14-25(15-13-24)21-10-6-7-11-23-21/h4-11,18,26H,12-17H2,1-3H3	YENLLNJHGZJVBY-UHFFFAOYSA-N	CC(C)(C)c1ccccc1OCC(O)CN2CCN(CC2)c3ccccn3	BroadT	BRD-A46044001	BRD-A46044001-003-05-5	ChemBridge Corporation	6047131		Cl	CC(C)(C)c1ccccc1OCC(O)CN1CCN(CC1)c1ccccn1.Cl	InChI=1S/C22H31N3O2.ClH/c1-22(2,3)19-8-4-5-9-20(19)27-17-18(26)16-24-12-14-25(15-13-24)21-10-6-7-11-23-21;/h4-11,18,26H,12-17H2,1-3H3;1H	NOLYZGVKPOEVLM-UHFFFAOYSA-N	369.241627262							103944, 103944
5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid	LSM-19797	SID7976087, BRD-K61827190	1325582	InChI=1S/C15H13NO7S/c1-21-12-5-3-10(7-11(12)15(17)18)24(19,20)16-9-2-4-13-14(6-9)23-8-22-13/h2-7,16H,8H2,1H3,(H,17,18)	CBTNVZLUXBMTAM-UHFFFAOYSA-N	COc1ccc(cc1C(=O)O)S(=O)(=O)Nc2ccc3OCOc3c2	BroadT	BRD-K61827190	BRD-K61827190-001-05-6	ChemBridge Corporation	6945699			COc1ccc(cc1C(O)=O)S(=O)(=O)Nc1ccc2OCOc2c1	InChI=1S/C15H13NO7S/c1-21-12-5-3-10(7-11(12)15(17)18)24(19,20)16-9-2-4-13-14(6-9)23-8-22-13/h2-7,16H,8H2,1H3,(H,17,18)	CBTNVZLUXBMTAM-UHFFFAOYSA-N	351.041272456							108421
SMR000072677	LSM-19798	SID4260403, SID26668781, BRD-K74285537	1308906	InChI=1S/C25H23N3O5S/c29-20(11-4-12-28-24(31)16-7-1-2-8-17(16)25(28)32)27-23-21(18-9-3-10-19(18)34-23)22(30)26-14-15-6-5-13-33-15/h1-2,5-8,13H,3-4,9-12,14H2,(H,26,30)(H,27,29)	BTNOGGLWFRDYAX-UHFFFAOYSA-N	O=C(CCCN1C(=O)c2ccccc2C1=O)Nc3sc4CCCc4c3C(=O)NCc5occc5	BroadT	BRD-K74285537	BRD-K74285537-001-05-4	ChemBridge Corporation	7443881			O=C(CCCN1C(=O)c2ccccc2C1=O)Nc1sc2CCCc2c1C(=O)NCc1ccco1	InChI=1S/C25H23N3O5S/c29-20(11-4-12-28-24(31)16-7-1-2-8-17(16)25(28)32)27-23-21(18-9-3-10-19(18)34-23)22(30)26-14-15-6-5-13-33-15/h1-2,5-8,13H,3-4,9-12,14H2,(H,26,30)(H,27,29)	BTNOGGLWFRDYAX-UHFFFAOYSA-N	477.135841556							108422
SMR000035507	LSM-19799	SID856234, BRD-K16227926	657605	InChI=1S/C21H21N5O2/c1-24-17-18(23-20(24)22-13-15-9-5-3-6-10-15)25(2)21(28)26(19(17)27)14-16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3,(H,22,23)	ZEUFAGMUQAKCPC-UHFFFAOYSA-N	CN1C(=O)N(Cc2ccccc2)C(=O)c3c1nc(NCc4ccccc4)n3C	BroadT	BRD-K16227926	BRD-K16227926-001-05-6	InterBioScreen Ltd.	STOCK1S-03655			Cn1c(NCc2ccccc2)nc2n(C)c(=O)n(Cc3ccccc3)c(=O)c12	InChI=1S/C21H21N5O2/c1-24-17-18(23-20(24)22-13-15-9-5-3-6-10-15)25(2)21(28)26(19(17)27)14-16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3,(H,22,23)	ZEUFAGMUQAKCPC-UHFFFAOYSA-N	375.169524962							108423
SMR000108226	LSM-19800	SID26668849, SID7976688, BRD-A30481655	2914074	InChI=1S/C23H24N2O4S/c1-13-4-6-14(7-5-13)25-18-11-23(2,3)12-19(26)15(18)10-16(21(25)28)20(27)24-17-8-9-30-22(17)29/h4-7,10,17H,8-9,11-12H2,1-3H3,(H,24,27)	XFUCGEALYDLJRD-UHFFFAOYSA-N	Cc1ccc(cc1)N2C3=C(C=C(C(=O)NC4CCSC4=O)C2=O)C(=O)CC(C)(C)C3	BroadT	BRD-A30481655	BRD-A30481655-001-05-0	ChemBridge Corporation	6790533			Cc1ccc(cc1)-n1c2CC(C)(C)CC(=O)c2cc(C(=O)NC2CCSC2=O)c1=O	InChI=1S/C23H24N2O4S/c1-13-4-6-14(7-5-13)25-18-11-23(2,3)12-19(26)15(18)10-16(21(25)28)20(27)24-17-8-9-30-22(17)29/h4-7,10,17H,8-9,11-12H2,1-3H3,(H,24,27)	XFUCGEALYDLJRD-UHFFFAOYSA-N	424.145677958							108424
T5214241	LSM-19801	SID14745023, BRD-K83572617	2420674	InChI=1S/C17H15Cl3N2O5S/c1-10-12(19)8-13(20)17(21-10)22-15(23)9-27-16(24)6-7-28(25,26)14-5-3-2-4-11(14)18/h2-5,8H,6-7,9H2,1H3,(H,21,22,23)	IBLMEHPVYDRQPE-UHFFFAOYSA-N	Cc1nc(NC(=O)COC(=O)CCS(=O)(=O)c2ccccc2Cl)c(Cl)cc1Cl	BroadT	BRD-K83572617	BRD-K83572617-001-05-7	Enamine Ltd.	T5214241			Cc1nc(NC(=O)COC(=O)CCS(=O)(=O)c2ccccc2Cl)c(Cl)cc1Cl	InChI=1S/C17H15Cl3N2O5S/c1-10-12(19)8-13(20)17(21-10)22-15(23)9-27-16(24)6-7-28(25,26)14-5-3-2-4-11(14)18/h2-5,8H,6-7,9H2,1H3,(H,21,22,23)	IBLMEHPVYDRQPE-UHFFFAOYSA-N	463.97672542							108425
N1-(3-Chlorophenyl)-2-({5-[5-(trifluoromethyl)-2-pyridyl]-1,3,4-oxadiazol-2-yl}thio)acetamide	LSM-19802	SID26729318, SID50120300, BRD-K02286723	2746574	InChI=1S/C16H10ClF3N4O2S/c17-10-2-1-3-11(6-10)22-13(25)8-27-15-24-23-14(26-15)12-5-4-9(7-21-12)16(18,19)20/h1-7H,8H2,(H,22,25)	ARZITOZUTNWSOG-UHFFFAOYSA-N	FC(F)(F)c1ccc(nc1)c2oc(SCC(=O)Nc3cccc(Cl)c3)nn2	BroadT	BRD-K02286723	BRD-K02286723-001-06-1	Maybridge	SPB 06827			FC(F)(F)c1ccc(nc1)-c1nnc(SCC(=O)Nc2cccc(Cl)c2)o1	InChI=1S/C16H10ClF3N4O2S/c17-10-2-1-3-11(6-10)22-13(25)8-27-15-24-23-14(26-15)12-5-4-9(7-21-12)16(18,19)20/h1-7H,8H2,(H,22,25)	ARZITOZUTNWSOG-UHFFFAOYSA-N	414.0165086							108426
MLS000101242	LSM-43854	SID7970138, BRD-K52944702	756704	InChI=1S/C15H15ClN6/c16-11-3-1-2-4-12(11)21-5-7-22(8-6-21)15-13-14(18-9-17-13)19-10-20-15/h1-4,9-10H,5-8H2,(H,17,18,19,20)	KDYPEARPZJFJBV-UHFFFAOYSA-N	Clc1ccccc1N2CCN(CC2)c3[nH]cnc4ncnc34	BroadT	BRD-K52944702	BRD-K52944702-001-04-4	Life Chemicals Inc.	F0578-0120			Clc1ccccc1N1CCN(CC1)c1[nH]cnc2ncnc12	InChI=1S/C15H15ClN6/c16-11-3-1-2-4-12(11)21-5-7-22(8-6-21)15-13-14(18-9-17-13)19-10-20-15/h1-4,9-10H,5-8H2,(H,17,18,19,20)	KDYPEARPZJFJBV-UHFFFAOYSA-N	314.10467225							
MLS000417484	LSM-19804	SID24782141, BRD-K56768746	3268787	InChI=1S/C21H17ClFN3O3S2/c1-13-5-10-17(24-21(30)25-20(27)14-6-8-16(23)9-7-14)12-19(13)31(28,29)26-18-4-2-3-15(22)11-18/h2-12,26H,1H3,(H2,24,25,27,30)	NCOKQDHZCJTXLX-UHFFFAOYSA-N	Cc1ccc(NC(=S)NC(=O)c2ccc(F)cc2)cc1S(=O)(=O)Nc3cccc(Cl)c3	BroadT	BRD-K56768746	BRD-K56768746-001-06-6	Enamine Ltd.	T0507-8120			Cc1ccc(NC(=S)NC(=O)c2ccc(F)cc2)cc1S(=O)(=O)Nc1cccc(Cl)c1	InChI=1S/C21H17ClFN3O3S2/c1-13-5-10-17(24-21(30)25-20(27)14-6-8-16(23)9-7-14)12-19(13)31(28,29)26-18-4-2-3-15(22)11-18/h2-12,26H,1H3,(H2,24,25,27,30)	NCOKQDHZCJTXLX-UHFFFAOYSA-N	477.038388724							108428
SMR000039269	LSM-19805	BRD-A04287036	658378	InChI=1S/C13H11BrN4OS/c1-2-7-11-10(8-3-4-9(14)20-8)6(5-15)12(16)19-13(11)18-17-7/h3-4,6,10,16H,2H2,1H3,(H,17,18)	XPYVCQFSRPJGBK-UHFFFAOYSA-N	CCc1[nH]nc2OC(=N)C(C#N)C(c3ccc(Br)s3)c12	BroadT	BRD-A04287036	BRD-A04287036-001-04-6	InterBioScreen Ltd.	STOCK1S-45966			CCc1n[nH]c2OC(N)=C(C#N)C(c3ccc(Br)s3)c12	InChI=1S/C13H11BrN4OS/c1-2-7-11-10(8-3-4-9(14)20-8)6(5-15)12(16)19-13(11)18-17-7/h3-4,10H,2,16H2,1H3,(H,17,18)	HLGJPLKOLRFWEZ-UHFFFAOYSA-N	349.983694302							
MLS000674597	LSM-19806	SID24814595, SID87225748, BRD-K05016999	6622007	InChI=1S/C23H25ClFN5O4/c1-23(2,3)34-22(33)29-8-6-13(7-9-29)18-11-19(31)30-20(28-18)15(12-26-30)21(32)27-14-4-5-17(25)16(24)10-14/h4-5,10-13,31H,6-9H2,1-3H3,(H,27,32)	BCQKLGVGCVHQQH-UHFFFAOYSA-N	CC(C)(C)OC(=O)N1CCC(CC1)c2cc(O)n3ncc(C(=O)Nc4ccc(F)c(Cl)c4)c3n2	BroadT	BRD-K05016999	BRD-K05016999-001-08-2	ChemDiv Inc.	C429-0376			CC(C)(C)OC(=O)N1CCC(CC1)c1cc(O)n2ncc(C(=O)Nc3ccc(F)c(Cl)c3)c2n1	InChI=1S/C23H25ClFN5O4/c1-23(2,3)34-22(33)29-8-6-13(7-9-29)18-11-19(31)30-20(28-18)15(12-26-30)21(32)27-14-4-5-17(25)16(24)10-14/h4-5,10-13,31H,6-9H2,1-3H3,(H,27,32)	BCQKLGVGCVHQQH-UHFFFAOYSA-N	489.15791024							
MLS000727865	LSM-19807	SID24785328, BRD-A93421946	4108280	InChI=1S/C19H18N2O5/c1-25-13-6-4-5-12(9-13)17(21-16-7-2-3-8-20-16)19-18(24)15(23)10-14(11-22)26-19/h2-10,17,22,24H,11H2,1H3,(H,20,21)	MAHWFBIBHDZFCZ-UHFFFAOYSA-N	COc1cccc(c1)C(Nc2ccccn2)C3=C(O)C(=O)C=C(CO)O3	BroadT	BRD-A93421946	BRD-A93421946-001-05-9	ChemDiv Inc.	7287-0774			COc1cccc(c1)C(Nc1ccccn1)c1oc(CO)cc(=O)c1O	InChI=1S/C19H18N2O5/c1-25-13-6-4-5-12(9-13)17(21-16-7-2-3-8-20-16)19-18(24)15(23)10-14(11-22)26-19/h2-10,17,22,24H,11H2,1H3,(H,20,21)	MAHWFBIBHDZFCZ-UHFFFAOYSA-N	354.121571696							108431
SMR000003248	LSM-19808	SID850188, BRD-K89584657	652699	InChI=1S/C24H19F2N3O3S/c1-31-19-12-6-16(7-13-19)14-29(18-10-8-17(25)9-11-18)22(30)15-33-24-28-27-23(32-24)20-4-2-3-5-21(20)26/h2-13H,14-15H2,1H3	LJVNNQWPOZMUFH-UHFFFAOYSA-N	COc1ccc(CN(C(=O)CSc2oc(nn2)c3ccccc3F)c4ccc(F)cc4)cc1	BroadT	BRD-K89584657	BRD-K89584657-001-05-7	Asinex Ltd.	ASN 04370910			COc1ccc(CN(C(=O)CSc2nnc(o2)-c2ccccc2F)c2ccc(F)cc2)cc1	InChI=1S/C24H19F2N3O3S/c1-31-19-12-6-16(7-13-19)14-29(18-10-8-17(25)9-11-18)22(30)15-33-24-28-27-23(32-24)20-4-2-3-5-21(20)26/h2-13H,14-15H2,1H3	LJVNNQWPOZMUFH-UHFFFAOYSA-N	467.111518588							108432
AC1NSGKU	LSM-19809	SID7968214, BRD-K43108438	5309286	InChI=1S/C11H13NO2S/c1-12-5-6-15-10-4-3-8(7-9(10)12)11(13)14-2/h3-4,7H,5-6H2,1-2H3	IQNAPJUAVHYVQC-UHFFFAOYSA-N	COC(=O)c1ccc2SCCN(C)c2c1	BroadT	BRD-K43108438	BRD-K43108438-001-04-9	ChemDiv Inc.	K780-0842			COC(=O)c1ccc2SCCN(C)c2c1	InChI=1S/C11H13NO2S/c1-12-5-6-15-10-4-3-8(7-9(10)12)11(13)14-2/h3-4,7H,5-6H2,1-2H3	IQNAPJUAVHYVQC-UHFFFAOYSA-N	223.066699356							108433
MLS-0067101.0001	LSM-19810	SID24708158, SID26514128, BRD-K11727348	16066630	InChI=1S/C12H6Cl3N5/c13-9-4-3-7(6-10(9)14)20-18-12(17-19-20)8-2-1-5-16-11(8)15/h1-6H	NEIJVSMAWWDACY-UHFFFAOYSA-N	Clc1ccc(cc1Cl)n2nnc(n2)c3cccnc3Cl	BroadT	BRD-K11727348	BRD-K11727348-001-05-0	Sanford-Burnham Medical Research Institute	2-chloro-3-(2-(3,4-dichlorophenyl)-2H-tetrazol-5-yl)pyridine TZDC02			Clc1ccc(cc1Cl)-n1nnc(n1)-c1cccnc1Cl	InChI=1S/C12H6Cl3N5/c13-9-4-3-7(6-10(9)14)20-18-12(17-19-20)8-2-1-5-16-11(8)15/h1-6H	NEIJVSMAWWDACY-UHFFFAOYSA-N	324.968878372							108434
F0651-0539	LSM-19811	SID14732795, BRD-K97956920	4294342	InChI=1S/C18H25N3O/c1-13-10-15-11-14(8-9-17(15)21(13)2)12-19-18(22)20-16-6-4-3-5-7-16/h8-11,16H,3-7,12H2,1-2H3,(H2,19,20,22)	RQZFXSYQOFLOJA-UHFFFAOYSA-N	Cc1cc2cc(CNC(=O)NC3CCCCC3)ccc2n1C	BroadT	BRD-K97956920	BRD-K97956920-001-04-1	Life Chemicals Inc.	F0651-0539			Cc1cc2cc(CNC(=O)NC3CCCCC3)ccc2n1C	InChI=1S/C18H25N3O/c1-13-10-15-11-14(8-9-17(15)21(13)2)12-19-18(22)20-16-6-4-3-5-7-16/h8-11,16H,3-7,12H2,1-2H3,(H2,19,20,22)	RQZFXSYQOFLOJA-UHFFFAOYSA-N	299.19976245							108435
1-(2,4-Dimethylphenyl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone	LSM-19812	SID24829232, BRD-K06961060	2081257	InChI=1S/C16H15N3OS/c1-11-6-7-13(12(2)9-11)14(20)10-21-16-18-17-15-5-3-4-8-19(15)16/h3-9H,10H2,1-2H3	XJYUZJBGRSNVKZ-UHFFFAOYSA-N	Cc1ccc(C(=O)CSc2nnc3ccccn23)c(C)c1	BroadT	BRD-K06961060	BRD-K06961060-001-05-8	Enamine Ltd.	T5258833			Cc1ccc(C(=O)CSc2nnc3ccccn23)c(C)c1	InChI=1S/C16H15N3OS/c1-11-6-7-13(12(2)9-11)14(20)10-21-16-18-17-15-5-3-4-8-19(15)16/h3-9H,10H2,1-2H3	XJYUZJBGRSNVKZ-UHFFFAOYSA-N	297.09358282							108436
T5267589	LSM-43855	SID3712857, BRD-K97803332	2088635	InChI=1S/C22H20N4O4S2/c23-11-10-21-26(22(28)18-8-4-5-9-19(18)31-21)16-20(27)24-12-14-25(15-13-24)32(29,30)17-6-2-1-3-7-17/h1-10H,12-16H2/b21-10-	GVNBQXUVOARBAP-FBHDLOMBSA-N	O=C(CN1\C(=C\C#N)\Sc2ccccc2C1=O)N3CCN(CC3)S(=O)(=O)c4ccccc4	BroadT	BRD-K97803332	BRD-K97803332-001-06-2	Enamine Ltd.	T5267589			O=C(CN1C(=O)c2ccccc2S\C1=C/C#N)N1CCN(CC1)S(=O)(=O)c1ccccc1	InChI=1S/C22H20N4O4S2/c23-11-10-21-26(22(28)18-8-4-5-9-19(18)31-21)16-20(27)24-12-14-25(15-13-24)32(29,30)17-6-2-1-3-7-17/h1-10H,12-16H2/b21-10-	GVNBQXUVOARBAP-FBHDLOMBSA-N	468.09259654							
ZINC03307654	LSM-19814	BRD-K73857962	6849784	InChI=1S/C12H16N2O3/c1-16-11-4-2-3-10(12(11)15)9-13-14-5-7-17-8-6-14/h2-4,9,15H,5-8H2,1H3	QYEXKEWMMNEUAN-UHFFFAOYSA-N	COc1cccc(C=NN2CCOCC2)c1O	BroadT	BRD-K73857962	BRD-K73857962-001-05-5	Enamine Ltd.	T0515-8312			COc1cccc(C=NN2CCOCC2)c1O	InChI=1S/C12H16N2O3/c1-16-11-4-2-3-10(12(11)15)9-13-14-5-7-17-8-6-14/h2-4,9,15H,5-8H2,1H3	QYEXKEWMMNEUAN-UHFFFAOYSA-N	236.116092392							
AC1LV9C9	LSM-19815	BRD-K38868564	1679083	InChI=1S/C12H11N3O2/c1-9-11(4-6-17-9)12(16)15-14-8-10-3-2-5-13-7-10/h2-8H,1H3,(H,15,16)	IEPYVUGXSJPOHQ-UHFFFAOYSA-N	Cc1occc1C(=O)NN=Cc2cccnc2	BroadT	BRD-K38868564	BRD-K38868564-001-05-8	ChemBridge Corporation	5573924			Cc1occc1C(=O)NN=Cc1cccnc1	InChI=1S/C12H11N3O2/c1-9-11(4-6-17-9)12(16)15-14-8-10-3-2-5-13-7-10/h2-8H,1H3,(H,15,16)	IEPYVUGXSJPOHQ-UHFFFAOYSA-N	229.085126622							108439
AC1MNE9Z	LSM-19816	SID24837615, BRD-A92841773	3326378	InChI=1S/C19H17NO5/c1-12(18(20)21)24-19(22)17-15(11-23-13-7-3-2-4-8-13)14-9-5-6-10-16(14)25-17/h2-10,12H,11H2,1H3,(H2,20,21)	QRVOSMWLOQEFEI-UHFFFAOYSA-N	CC(OC(=O)c1oc2ccccc2c1COc3ccccc3)C(=O)N	BroadT	BRD-A92841773	BRD-A92841773-001-07-3	Enamine Ltd.	T5247114			CC(OC(=O)c1oc2ccccc2c1COc1ccccc1)C(N)=O	InChI=1S/C19H17NO5/c1-12(18(20)21)24-19(22)17-15(11-23-13-7-3-2-4-8-13)14-9-5-6-10-16(14)25-17/h2-10,12H,11H2,1H3,(H2,20,21)	QRVOSMWLOQEFEI-UHFFFAOYSA-N	339.110672654							108440
6-Ethyl-thieno[2,3-b]quinoline-2-carboxylic acid	LSM-19817	SID24790268, BRD-K29671198	1133184	InChI=1S/C14H11NO2S/c1-2-8-3-4-11-9(5-8)6-10-7-12(14(16)17)18-13(10)15-11/h3-7H,2H2,1H3,(H,16,17)	ZCIFZNUDMJXZDI-UHFFFAOYSA-N	CCc1ccc2nc3sc(cc3cc2c1)C(=O)O	BroadT	BRD-K29671198	BRD-K29671198-001-05-1	Asinex Ltd.	ASN 02137205			CCc1ccc2nc3sc(cc3cc2c1)C(O)=O	InChI=1S/C14H11NO2S/c1-2-8-3-4-11-9(5-8)6-10-7-12(14(16)17)18-13(10)15-11/h3-7H,2H2,1H3,(H,16,17)	ZCIFZNUDMJXZDI-UHFFFAOYSA-N	257.051049292							108441
ZINC00470008	LSM-19818	SID17506639, BRD-K01356889	893528	InChI=1S/C17H19NO2S/c1-13-6-8-16(9-7-13)21-11-10-17(19)18-14-4-3-5-15(12-14)20-2/h3-9,12H,10-11H2,1-2H3,(H,18,19)	AWZDQXXQISBJBK-UHFFFAOYSA-N	COc1cccc(NC(=O)CCSc2ccc(C)cc2)c1	BroadT	BRD-K01356889	BRD-K01356889-001-05-5	ChemBridge Corporation	7582352			COc1cccc(NC(=O)CCSc2ccc(C)cc2)c1	InChI=1S/C17H19NO2S/c1-13-6-8-16(9-7-13)21-11-10-17(19)18-14-4-3-5-15(12-14)20-2/h3-9,12H,10-11H2,1-2H3,(H,18,19)	AWZDQXXQISBJBK-UHFFFAOYSA-N	301.113649548							108442
STK155261	LSM-43856	SID17433734, BRD-K98186731	1309706	InChI=1S/C12H14N2OS2/c1-4-14-7(2)5-9(8(14)3)6-10-11(15)13-12(16)17-10/h5-6H,4H2,1-3H3,(H,13,15,16)/b10-6+	GGVNEIPBUXHWIQ-UXBLZVDNSA-N	CCn1c(C)cc(\C=C/2\SC(=S)NC2=O)c1C	BroadT	BRD-K98186731	BRD-K98186731-001-05-0	ChemBridge Corporation	7466843			CCn1c(C)cc(\C=C2\SC(=S)NC2=O)c1C	InChI=1S/C12H14N2OS2/c1-4-14-7(2)5-9(8(14)3)6-10-11(15)13-12(16)17-10/h5-6H,4H2,1-3H3,(H,13,15,16)/b10-6+	GGVNEIPBUXHWIQ-UXBLZVDNSA-N	266.054754468							
MLS000575987	LSM-43857	SID17505521, BRD-K36728438	1328700	InChI=1S/C18H16N2O4S/c1-24-15-9-2-12(3-10-15)4-11-16(21)20-18(25)19-14-7-5-13(6-8-14)17(22)23/h2-11H,1H3,(H,22,23)(H2,19,20,21,25)/b11-4+	OXPUWPKKVUOOJN-NYYWCZLTSA-N	COc1ccc(\C=C\C(=O)NC(=S)Nc2ccc(cc2)C(=O)O)cc1	BroadT	BRD-K36728438	BRD-K36728438-001-05-0	ChemBridge Corporation	7010791			COc1ccc(cc1)\C=C\C(=O)NC(=S)Nc1ccc(cc1)C(O)=O	InChI=1S/C18H16N2O4S/c1-24-15-9-2-12(3-10-15)4-11-16(21)20-18(25)19-14-7-5-13(6-8-14)17(22)23/h2-11H,1H3,(H,22,23)(H2,19,20,21,25)/b11-4+	OXPUWPKKVUOOJN-NYYWCZLTSA-N	356.083077702							
Methyl 5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]furan-2-carboxylate	LSM-19821	SID3714865, BRD-K75838157	673661	InChI=1S/C14H11NO3S2/c1-17-13(16)11-7-6-9(18-11)8-19-14-15-10-4-2-3-5-12(10)20-14/h2-7H,8H2,1H3	XHARXDVWMOJJMT-UHFFFAOYSA-N	COC(=O)c1oc(CSc2nc3ccccc3s2)cc1	BroadT	BRD-K75838157	BRD-K75838157-001-06-6	Enamine Ltd.	T5418054			COC(=O)c1ccc(CSc2nc3ccccc3s2)o1	InChI=1S/C14H11NO3S2/c1-17-13(16)11-7-6-9(18-11)8-19-14-15-10-4-2-3-5-12(10)20-14/h2-7H,8H2,1H3	XHARXDVWMOJJMT-UHFFFAOYSA-N	305.018034602							108445
MLS000117300	LSM-19822	BRD-K74963702, SID7966684	5308376	InChI=1S/C20H23ClN4OS/c1-24-20-16(18(23-24)14-5-7-15(21)8-6-14)13-17(27-20)19(26)22-9-4-12-25-10-2-3-11-25/h5-8,13H,2-4,9-12H2,1H3,(H,22,26)	GIUZJWUZXLOLKB-UHFFFAOYSA-N	Cn1nc(c2ccc(Cl)cc2)c3cc(sc13)C(=O)NCCCN4CCCC4	BroadT	BRD-K74963702	BRD-K74963702-001-06-3	ChemDiv Inc.	C509-0118			Cn1nc(-c2ccc(Cl)cc2)c2cc(sc12)C(=O)NCCCN1CCCC1	InChI=1S/C20H23ClN4OS/c1-24-20-16(18(23-24)14-5-7-15(21)8-6-14)13-17(27-20)19(26)22-9-4-12-25-10-2-3-11-25/h5-8,13H,2-4,9-12H2,1H3,(H,22,26)	GIUZJWUZXLOLKB-UHFFFAOYSA-N	402.128109796							108446
MLS001003058	LSM-19823	SID26724197, BRD-K20372010	4423353	InChI=1S/C22H25N5O3S2/c1-15-9-10-18-19(12-15)26-22(25-18)31-14-21(28)24-16-6-5-7-17(13-16)32(29,30)27-20-8-3-2-4-11-23-20/h5-7,9-10,12-13H,2-4,8,11,14H2,1H3,(H,23,27)(H,24,28)(H,25,26)	QNOSSNASSAHMEG-UHFFFAOYSA-N	Cc1ccc2[nH]c(SCC(=O)Nc3cccc(c3)S(=O)(=O)NC4=NCCCCC4)nc2c1	BroadT	BRD-K20372010	BRD-K20372010-001-06-9	Enamine Ltd.	T0515-2884			Cc1ccc2[nH]c(SCC(=O)Nc3cccc(c3)S(=O)(=O)NC3=NCCCCC3)nc2c1	InChI=1S/C22H25N5O3S2/c1-15-9-10-18-19(12-15)26-22(25-18)31-14-21(28)24-16-6-5-7-17(13-16)32(29,30)27-20-8-3-2-4-11-23-20/h5-7,9-10,12-13H,2-4,8,11,14H2,1H3,(H,23,27)(H,24,28)(H,25,26)	QNOSSNASSAHMEG-UHFFFAOYSA-N	471.13988109							108447
MLS000590448	LSM-19824	SID17513601, BRD-K28584157	1185774	InChI=1S/C22H14BrNO5/c1-13-3-2-4-16(7-13)28-20-12-27-19-9-17(5-6-18(19)21(20)25)29-22(26)14-8-15(23)11-24-10-14/h2-12H,1H3	LLSXYFJOCGQBQY-UHFFFAOYSA-N	Cc1cccc(OC2=COc3cc(OC(=O)c4cncc(Br)c4)ccc3C2=O)c1	BroadT	BRD-K28584157	BRD-K28584157-001-11-4	InterBioScreen Ltd.	STOCK2S-65159			Cc1cccc(Oc2coc3cc(OC(=O)c4cncc(Br)c4)ccc3c2=O)c1	InChI=1S/C22H14BrNO5/c1-13-3-2-4-16(7-13)28-20-12-27-19-9-17(5-6-18(19)21(20)25)29-22(26)14-8-15(23)11-24-10-14/h2-12H,1H3	LLSXYFJOCGQBQY-UHFFFAOYSA-N	451.005535158							108448
AC1OAYFU	LSM-19825	BRD-K10182157	6812307	InChI=1S/C13H12BrN5S/c1-2-12-17-18-13(20)19(12)16-7-8-6-15-11-4-3-9(14)5-10(8)11/h3-7,15H,2H2,1H3,(H,18,20)	FMAIVCCPKLXPMI-UHFFFAOYSA-N	CCc1nnc(S)n1N=Cc2c[nH]c3ccc(Br)cc23	BroadT	BRD-K10182157	BRD-K10182157-001-06-7	Enamine Ltd.	T0520-5848			CCc1nnc(S)n1N=Cc1c[nH]c2ccc(Br)cc12	InChI=1S/C13H12BrN5S/c1-2-12-17-18-13(20)19(12)16-7-8-6-15-11-4-3-9(14)5-10(8)11/h3-7,15H,2H2,1H3,(H,18,20)	FMAIVCCPKLXPMI-UHFFFAOYSA-N	348.999678724							
SMR000034349	LSM-19826	SID856763, BRD-K38082795	658121	InChI=1S/C18H23N3O3S/c1-2-24-18(22)15-14(19)13-11-5-3-4-6-12(11)16(20-17(13)25-15)21-7-9-23-10-8-21/h2-10,19H2,1H3	CPLHVPAYUQAHAW-UHFFFAOYSA-N	CCOC(=O)c1sc2nc(N3CCOCC3)c4CCCCc4c2c1N	BroadT	BRD-K38082795	BRD-K38082795-001-05-7	InterBioScreen Ltd.	STOCK1S-28674			CCOC(=O)c1sc2nc(N3CCOCC3)c3CCCCc3c2c1N	InChI=1S/C18H23N3O3S/c1-2-24-18(22)15-14(19)13-11-5-3-4-6-12(11)16(20-17(13)25-15)21-7-9-23-10-8-21/h2-10,19H2,1H3	CPLHVPAYUQAHAW-UHFFFAOYSA-N	361.146012316							108450
SMR000045251	LSM-19827	SID863143, BRD-K03810962	664380	InChI=1S/C28H26N4O2/c1-33-25-15-9-8-14-23(25)27-30-24(20-29)28(34-27)32-18-16-31(17-19-32)26(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-15,26H,16-19H2,1H3	SWVMNYNUQYEVGK-UHFFFAOYSA-N	COc1ccccc1c2oc(N3CCN(CC3)C(c4ccccc4)c5ccccc5)c(n2)C#N	BroadT	BRD-K03810962	BRD-K03810962-001-05-9	InterBioScreen Ltd.	STOCK4S-63773			COc1ccccc1-c1nc(C#N)c(o1)N1CCN(CC1)C(c1ccccc1)c1ccccc1	InChI=1S/C28H26N4O2/c1-33-25-15-9-8-14-23(25)27-30-24(20-29)28(34-27)32-18-16-31(17-19-32)26(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-15,26H,16-19H2,1H3	SWVMNYNUQYEVGK-UHFFFAOYSA-N	450.205576112							108451
AC1N1JLC	LSM-19828	BRD-K53829711	4031396	InChI=1S/C12H8N4O6/c17-12(14-13-7-11-2-1-3-22-11)8-4-9(15(18)19)6-10(5-8)16(20)21/h1-7H,(H,14,17)	HQKKTKGCUXHHCK-UHFFFAOYSA-N	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NN=Cc2occc2	BroadT	BRD-K53829711	BRD-K53829711-001-05-2	Life Chemicals Inc.	F0890-0379			[O-][N+](=O)c1cc(cc(c1)[N+]([O-])=O)C(=O)NN=Cc1ccco1	InChI=1S/C12H8N4O6/c17-12(14-13-7-11-2-1-3-22-11)8-4-9(15(18)19)6-10(5-8)16(20)21/h1-7H,(H,14,17)	HQKKTKGCUXHHCK-UHFFFAOYSA-N	304.044384016							108452
ST50933967	LSM-19829	SID22405204, BRD-K66869427	1225435	InChI=1S/C15H15N3O4/c1-10-3-5-11(6-4-10)16-15(19)17-12-7-13(18(20)21)9-14(8-12)22-2/h3-9H,1-2H3,(H2,16,17,19)	RMAVCEAOKKMEAX-UHFFFAOYSA-N	COc1cc(NC(=O)Nc2ccc(C)cc2)cc(c1)[N+](=O)[O-]	BroadT	BRD-K66869427	BRD-K66869427-001-05-8	Specs	AK-968/40708682			COc1cc(NC(=O)Nc2ccc(C)cc2)cc(c1)[N+]([O-])=O	InChI=1S/C15H15N3O4/c1-10-3-5-11(6-4-10)16-15(19)17-12-7-13(18(20)21)9-14(8-12)22-2/h3-9H,1-2H3,(H2,16,17,19)	RMAVCEAOKKMEAX-UHFFFAOYSA-N	301.10625599							108453
MLS000117292	LSM-19830	BRD-K57357304, SID7968423	5309397	InChI=1S/C19H23ClN4OS/c1-4-24(5-2)11-10-21-18(25)16-12-15-17(22-23(3)19(15)26-16)13-6-8-14(20)9-7-13/h6-9,12H,4-5,10-11H2,1-3H3,(H,21,25)	WHWPOSROHWRQBH-UHFFFAOYSA-N	CCN(CC)CCNC(=O)c1cc2c(nn(C)c2s1)c3ccc(Cl)cc3	BroadT	BRD-K57357304	BRD-K57357304-001-04-6	ChemDiv Inc.	C509-0065			CCN(CC)CCNC(=O)c1cc2c(nn(C)c2s1)-c1ccc(Cl)cc1	InChI=1S/C19H23ClN4OS/c1-4-24(5-2)11-10-21-18(25)16-12-15-17(22-23(3)19(15)26-16)13-6-8-14(20)9-7-13/h6-9,12H,4-5,10-11H2,1-3H3,(H,21,25)	WHWPOSROHWRQBH-UHFFFAOYSA-N	390.128109796							108454
STK242030	LSM-19831	SID17414633, BRD-K75435004	2960946	InChI=1S/C16H16ClN3O6S/c1-19(27(24,25)13-6-3-11(17)4-7-13)10-16(21)18-14-8-5-12(26-2)9-15(14)20(22)23/h3-9H,10H2,1-2H3,(H,18,21)	FUCNWXFQNWTPEU-UHFFFAOYSA-N	COc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)c(c1)[N+](=O)[O-]	BroadT	BRD-K75435004	BRD-K75435004-001-06-6	ChemBridge Corporation	7887414			COc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)c(c1)[N+]([O-])=O	InChI=1S/C16H16ClN3O6S/c1-19(27(24,25)13-6-3-11(17)4-7-13)10-16(21)18-14-8-5-12(26-2)9-15(14)20(22)23/h3-9H,10H2,1-2H3,(H,18,21)	FUCNWXFQNWTPEU-UHFFFAOYSA-N	413.044833662							108455
ZINC00112778	LSM-19832	BRD-K27809274	6740164	InChI=1S/C12H10ClN3O/c13-10-5-3-9(4-6-10)12(17)16-15-8-11-2-1-7-14-11/h1-8,14H,(H,16,17)	FKKSWBBZJQVWNP-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)NN=Cc2ccc[nH]2	BroadT	BRD-K27809274	BRD-K27809274-001-05-6	Specs	AN-329/40381231			Clc1ccc(cc1)C(=O)NN=Cc1ccc[nH]1	InChI=1S/C12H10ClN3O/c13-10-5-3-9(4-6-10)12(17)16-15-8-11-2-1-7-14-11/h1-8,14H,(H,16,17)	FKKSWBBZJQVWNP-UHFFFAOYSA-N	247.05123968							
T5437228	LSM-19833	SID3717034, BRD-K46216175	2547678	InChI=1S/C21H26N4O2S2/c1-4-24(5-2)29(26,27)19-14-10-13-18(15-19)20-22-23-21(28-6-3)25(20)16-17-11-8-7-9-12-17/h7-15H,4-6,16H2,1-3H3	FXTCNLXWYWXFPA-UHFFFAOYSA-N	CCSc1nnc(c2cccc(c2)S(=O)(=O)N(CC)CC)n1Cc3ccccc3	BroadT	BRD-K46216175	BRD-K46216175-001-06-9	Enamine Ltd.	ZT-3262983			CCSc1nnc(-c2cccc(c2)S(=O)(=O)N(CC)CC)n1Cc1ccccc1	InChI=1S/C21H26N4O2S2/c1-4-24(5-2)29(26,27)19-14-10-13-18(15-19)20-22-23-21(28-6-3)25(20)16-17-11-8-7-9-12-17/h7-15H,4-6,16H2,1-3H3	FXTCNLXWYWXFPA-UHFFFAOYSA-N	430.149717492							108457
SMR000022739	LSM-19834	SID26724856, SID4252072, BRD-A16737060	3245672	InChI=1S/C20H20N2O5/c23-19(22-15-7-8-16-18(12-15)27-11-10-26-16)13-3-5-14(6-4-13)21-20(24)17-2-1-9-25-17/h3-8,12,17H,1-2,9-11H2,(H,21,24)(H,22,23)	FAVDGTRESIFVDK-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)C(=O)Nc2ccc3OCCOc3c2)C4CCCO4	BroadT	BRD-A16737060	BRD-A16737060-001-05-2	ChemDiv Inc.	C181-0861			O=C(Nc1ccc(cc1)C(=O)Nc1ccc2OCCOc2c1)C1CCCO1	InChI=1S/C20H20N2O5/c23-19(22-15-7-8-16-18(12-15)27-11-10-26-16)13-3-5-14(6-4-13)21-20(24)17-2-1-9-25-17/h3-8,12,17H,1-2,9-11H2,(H,21,24)(H,22,23)	FAVDGTRESIFVDK-UHFFFAOYSA-N	368.13722176							108458
ZINC00443394	LSM-19835	SID24806223, BRD-K34531703	875146	InChI=1S/C14H11N3O3S2/c1-19-8-4-5-9-11(7-8)22-14(15-9)17-13(21)16-12(18)10-3-2-6-20-10/h2-7H,1H3,(H2,15,16,17,18,21)	WGGVSKKNPVAZHO-UHFFFAOYSA-N	COc1ccc2nc(NC(=S)NC(=O)c3occc3)sc2c1	BroadT	BRD-K34531703	BRD-K34531703-001-05-8	ChemBridge Corporation	6161345			COc1ccc2nc(NC(=S)NC(=O)c3ccco3)sc2c1	InChI=1S/C14H11N3O3S2/c1-19-8-4-5-9-11(7-8)22-14(15-9)17-13(21)16-12(18)10-3-2-6-20-10/h2-7H,1H3,(H2,15,16,17,18,21)	WGGVSKKNPVAZHO-UHFFFAOYSA-N	333.024182622							108459
SMR000046434	LSM-19836	SID864096, BRD-K71089100	665346	InChI=1S/C22H18N4O2S/c1-27-19-5-2-4-18(12-19)21-24-25-22(26(21)14-20-6-3-11-28-20)29-15-17-9-7-16(13-23)8-10-17/h2-12H,14-15H2,1H3	QWKVQVYOJYHALP-UHFFFAOYSA-N	COc1cccc(c1)c2nnc(SCc3ccc(cc3)C#N)n2Cc4occc4	BroadT	BRD-K71089100	BRD-K71089100-001-05-0	InterBioScreen Ltd.	STOCK5S-02704			COc1cccc(c1)-c1nnc(SCc2ccc(cc2)C#N)n1Cc1ccco1	InChI=1S/C22H18N4O2S/c1-27-19-5-2-4-18(12-19)21-24-25-22(26(21)14-20-6-3-11-28-20)29-15-17-9-7-16(13-23)8-10-17/h2-12H,14-15H2,1H3	QWKVQVYOJYHALP-UHFFFAOYSA-N	402.115046546							108460
SMR000062914	LSM-19837	SID3716830, BRD-K73164622	2366561	InChI=1S/C21H21N3O5S/c22-17-7-5-6-16-18(17)21(27)24(20(16)26)19(25)14-8-10-15(11-9-14)30(28,29)23-12-3-1-2-4-13-23/h5-11H,1-4,12-13,22H2	PDCYSDOOWIRTJB-UHFFFAOYSA-N	Nc1cccc2C(=O)N(C(=O)c3ccc(cc3)S(=O)(=O)N4CCCCCC4)C(=O)c12	BroadT	BRD-K73164622	BRD-K73164622-001-05-8	Enamine Ltd.	T0516-5898			Nc1cccc2C(=O)N(C(=O)c3ccc(cc3)S(=O)(=O)N3CCCCCC3)C(=O)c12	InChI=1S/C21H21N3O5S/c22-17-7-5-6-16-18(17)21(27)24(20(16)26)19(25)14-8-10-15(11-9-14)30(28,29)23-12-3-1-2-4-13-23/h5-11H,1-4,12-13,22H2	PDCYSDOOWIRTJB-UHFFFAOYSA-N	427.120191492							108461
ZINC00380164	LSM-19838	SID24801070, BRD-K41385233	846944	InChI=1S/C16H17FN2O3S/c1-12-4-3-5-14(10-12)18-16(20)11-19(23(2,21)22)15-8-6-13(17)7-9-15/h3-10H,11H2,1-2H3,(H,18,20)	DEHTUHBUVQYNFL-UHFFFAOYSA-N	Cc1cccc(NC(=O)CN(c2ccc(F)cc2)S(=O)(=O)C)c1	BroadT	BRD-K41385233	BRD-K41385233-001-06-7	Asinex Ltd.	BAS 02177246			Cc1cccc(NC(=O)CN(c2ccc(F)cc2)S(C)(=O)=O)c1	InChI=1S/C16H17FN2O3S/c1-12-4-3-5-14(10-12)18-16(20)11-19(23(2,21)22)15-8-6-13(17)7-9-15/h3-10H,11H2,1-2H3,(H,18,20)	DEHTUHBUVQYNFL-UHFFFAOYSA-N	336.094391314							108462
4-Bromo-2-(1H-pyrazol-3-yl)phenol	LSM-19839	SID22400443, BRD-K78349294	6744501	InChI=1S/C9H7BrN2O/c10-6-1-2-9(13)7(5-6)8-3-4-11-12-8/h1-5,13H,(H,11,12)	PNIKRSVKWZRJOK-UHFFFAOYSA-N	Oc1ccc(Br)cc1c2cc[nH]n2	BroadT	BRD-K78349294	BRD-K78349294-001-05-7	Specs	AN-829/36412020			Oc1ccc(Br)cc1-c1cc[nH]n1	InChI=1S/C9H7BrN2O/c10-6-1-2-9(13)7(5-6)8-3-4-11-12-8/h1-5,13H,(H,11,12)	PNIKRSVKWZRJOK-UHFFFAOYSA-N	237.974175464							
BRD-K99555378	LSM-19840	SID14733250		InChI=1S/C13H10ClN3S/c14-10-3-1-2-9(6-10)8-18-13-16-11-4-5-15-7-12(11)17-13/h1-7,15H,8H2	IWJBMFHXYXVQDS-UHFFFAOYSA-N	Clc1cccc(CSc2nc3cc[nH]cc3n2)c1	BroadT	BRD-K99555378	BRD-K99555378-001-07-9	ChemDiv Inc.	K783-7012			Clc1cccc(CSc2nc3cc[nH]cc3n2)c1	InChI=1S/C13H10ClN3S/c14-10-3-1-2-9(6-10)8-18-13-16-11-4-5-15-7-12(11)17-13/h1-7,15H,8H2	IWJBMFHXYXVQDS-UHFFFAOYSA-N	275.02839575							
BAS 08770081	LSM-19841	SID24808123, BRD-K10761095	1092449	InChI=1S/C17H16N4OS/c1-11-4-3-5-16(18-11)21-17-20-15(10-23-17)13-6-8-14(9-7-13)19-12(2)22/h3-10H,1-2H3,(H,19,22)(H,18,20,21)	SNCINWPVLVFPAL-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)c2csc(Nc3cccc(C)n3)n2	BroadT	BRD-K10761095	BRD-K10761095-001-05-5	Asinex Ltd.	BAS 08770081			CC(=O)Nc1ccc(cc1)-c1csc(Nc2cccc(C)n2)n1	InChI=1S/C17H16N4OS/c1-11-4-3-5-16(18-11)21-17-20-15(10-23-17)13-6-8-14(9-7-13)19-12(2)22/h3-10H,1-2H3,(H,19,22)(H,18,20,21)	SNCINWPVLVFPAL-UHFFFAOYSA-N	324.104481862							108465
MLS000936836	LSM-19842	SID49715578, BRD-K47210188	22426975	InChI=1S/C28H32FN5O3/c1-20-18-26(33-14-16-37-17-15-33)31-25-7-4-22(19-24(20)25)30-27(35)8-9-28(36)34-12-10-32(11-13-34)23-5-2-21(29)3-6-23/h2-7,18-19H,8-17H2,1H3,(H,30,35)	LMHXQQKGADTQJD-UHFFFAOYSA-N	Cc1cc(nc2ccc(NC(=O)CCC(=O)N3CCN(CC3)c4ccc(F)cc4)cc12)N5CCOCC5	BroadT	BRD-K47210188	BRD-K47210188-001-05-8	ChemDiv Inc.	C204-0085			Cc1cc(nc2ccc(NC(=O)CCC(=O)N3CCN(CC3)c3ccc(F)cc3)cc12)N1CCOCC1	InChI=1S/C28H32FN5O3/c1-20-18-26(33-14-16-37-17-15-33)31-25-7-4-22(19-24(20)25)30-27(35)8-9-28(36)34-12-10-32(11-13-34)23-5-2-21(29)3-6-23/h2-7,18-19H,8-17H2,1H3,(H,30,35)	LMHXQQKGADTQJD-UHFFFAOYSA-N	505.248918134							108466
2-[(2-Fluorophenoxy)methyl]-5-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-oxazole-4-carbonitrile	LSM-19843	SID860005, BRD-K08213846	661315	InChI=1S/C17H16FN5O2/c18-13-4-1-2-5-15(13)24-11-16-22-14(10-19)17(25-16)21-6-3-8-23-9-7-20-12-23/h1-2,4-5,7,9,12,21H,3,6,8,11H2	WXBRYJKQRSDOIQ-UHFFFAOYSA-N	Fc1ccccc1OCc2oc(NCCCn3ccnc3)c(n2)C#N	BroadT	BRD-K08213846	BRD-K08213846-001-06-1	InterBioScreen Ltd.	STOCK3S-47814			Fc1ccccc1OCc1nc(C#N)c(NCCCn2ccnc2)o1	InChI=1S/C17H16FN5O2/c18-13-4-1-2-5-15(13)24-11-16-22-14(10-19)17(25-16)21-6-3-8-23-9-7-20-12-23/h1-2,4-5,7,9,12,21H,3,6,8,11H2	WXBRYJKQRSDOIQ-UHFFFAOYSA-N	341.128803002							108467
AC1NEADY	LSM-19844	SID26725896, BRD-K58665933	4589068	InChI=1S/C15H13FN6O3/c16-9-3-1-4-10(7-9)19-15-20-13(17)12(22(23)24)14(21-15)18-8-11-5-2-6-25-11/h1-7H,8H2,(H4,17,18,19,20,21)	ASPPPXMWIWFZPH-UHFFFAOYSA-N	Nc1nc(Nc2cccc(F)c2)nc(NCc3occc3)c1[N+](=O)[O-]	BroadT	BRD-K58665933	BRD-K58665933-001-06-5	InterBioScreen Ltd.	STOCK4S-49275			Nc1nc(Nc2cccc(F)c2)nc(NCc2ccco2)c1[N+]([O-])=O	InChI=1S/C15H13FN6O3/c16-9-3-1-4-10(7-9)19-15-20-13(17)12(22(23)24)14(21-15)18-8-11-5-2-6-25-11/h1-7H,8H2,(H4,17,18,19,20,21)	ASPPPXMWIWFZPH-UHFFFAOYSA-N	344.103316536							108468
SMR000047167	LSM-19845	SID864653, BRD-A36141702	665894	InChI=1S/C19H19N3O4S/c1-21(2)14-9-7-13(8-10-14)17-11-15(26-20-17)12-22-19(23)16-5-3-4-6-18(16)27(22,24)25/h3-10,15H,11-12H2,1-2H3	MKWLRSLXLQYTGJ-UHFFFAOYSA-N	CN(C)c1ccc(cc1)C2=NOC(CN3C(=O)c4ccccc4S3(=O)=O)C2	BroadT	BRD-A36141702	BRD-A36141702-001-06-5	InterBioScreen Ltd.	STOCK5S-26530			CN(C)c1ccc(cc1)C1=NOC(CN2C(=O)c3ccccc3S2(=O)=O)C1	InChI=1S/C19H19N3O4S/c1-21(2)14-9-7-13(8-10-14)17-11-15(26-20-17)12-22-19(23)16-5-3-4-6-18(16)27(22,24)25/h3-10,15H,11-12H2,1-2H3	MKWLRSLXLQYTGJ-UHFFFAOYSA-N	385.109626808							108469
N-(4-Bromo-2-fluorophenyl)-2-methyl-3-furamide	LSM-19846	SID14735028, BRD-K57424282	831630	InChI=1S/C12H9BrFNO2/c1-7-9(4-5-17-7)12(16)15-11-3-2-8(13)6-10(11)14/h2-6H,1H3,(H,15,16)	PDARUEJJHMSXHN-UHFFFAOYSA-N	Cc1occc1C(=O)Nc2ccc(Br)cc2F	BroadT	BRD-K57424282	BRD-K57424282-001-05-7	ChemBridge Corporation	7231160			Cc1occc1C(=O)Nc1ccc(Br)cc1F	InChI=1S/C12H9BrFNO2/c1-7-9(4-5-17-7)12(16)15-11-3-2-8(13)6-10(11)14/h2-6H,1H3,(H,15,16)	PDARUEJJHMSXHN-UHFFFAOYSA-N	296.980069338							108470
AC1OB9PH	LSM-19847	BRD-K22295982	6842551	InChI=1S/C17H13BrN4O/c18-15-6-7-16(23)13(8-15)11-21-22-17-19-9-14(10-20-17)12-4-2-1-3-5-12/h1-11,23H,(H,19,20,22)	NJQDSAXXNJUAOZ-UHFFFAOYSA-N	Oc1ccc(Br)cc1C=NNc2ncc(cn2)c3ccccc3	BroadT	BRD-K22295982	BRD-K22295982-001-06-4	Asinex Ltd.	BAS 00434511			Oc1ccc(Br)cc1C=NNc1ncc(cn1)-c1ccccc1	InChI=1S/C17H13BrN4O/c18-15-6-7-16(23)13(8-15)11-21-22-17-19-9-14(10-20-17)12-4-2-1-3-5-12/h1-11,23H,(H,19,20,22)	NJQDSAXXNJUAOZ-UHFFFAOYSA-N	368.027273676							
AC1O99F6	LSM-19848	SID49643451, BRD-K75585694	6751794	InChI=1S/C22H20N4O3/c1-3-29-21-10-15(6-9-20(21)28)17-11-19(26-22(24)18(17)12-23)14-4-7-16(8-5-14)25-13(2)27/h4-11,28H,3H2,1-2H3,(H2,24,26)(H,25,27)	BGYCDCILPRXBLK-UHFFFAOYSA-N	CCOc1cc(ccc1O)c2cc(nc(N)c2C#N)c3ccc(NC(=O)C)cc3	BroadT	BRD-K75585694	BRD-K75585694-001-06-3	Asinex Ltd.	BAS 00851065			CCOc1cc(ccc1O)-c1cc(nc(N)c1C#N)-c1ccc(NC(C)=O)cc1	InChI=1S/C22H20N4O3/c1-3-29-21-10-15(6-9-20(21)28)17-11-19(26-22(24)18(17)12-23)14-4-7-16(8-5-14)25-13(2)27/h4-11,28H,3H2,1-2H3,(H2,24,26)(H,25,27)	BGYCDCILPRXBLK-UHFFFAOYSA-N	388.15354054							
4-Hydroxy-2-oxo-n-[3-(trifluoromethyl)phenyl]-1,2-dihydroquinoline-3-carboxamide	LSM-19849	SID47201653, BRD-K60421635	54679066	InChI=1S/C17H11F3N2O3/c18-17(19,20)9-4-3-5-10(8-9)21-15(24)13-14(23)11-6-1-2-7-12(11)22-16(13)25/h1-8H,(H,21,24)(H2,22,23,25)	YKKFQSZQLFCFDP-UHFFFAOYSA-N	Oc1nc2ccccc2c(O)c1C(=O)Nc3cccc(c3)C(F)(F)F	BroadT	BRD-K60421635	BRD-K60421635-001-05-2	Asinex Ltd.	BAS 00505167			Oc1nc2ccccc2c(O)c1C(=O)Nc1cccc(c1)C(F)(F)F	InChI=1S/C17H11F3N2O3/c18-17(19,20)9-4-3-5-10(8-9)21-15(24)13-14(23)11-6-1-2-7-12(11)22-16(13)25/h1-8H,(H,21,24)(H2,22,23,25)	YKKFQSZQLFCFDP-UHFFFAOYSA-N	348.072176832							108473
MLS000767580	LSM-43858	SID26663337, BRD-K21261751	5551172	InChI=1S/C20H19N5O4/c1-11-8-12(2)16(13(3)9-11)25-19(28)15(18(27)23-20(25)29)10-22-24-17(26)14-4-6-21-7-5-14/h4-10,22H,1-3H3,(H,24,26)(H,23,27,29)/b15-10+	VRMVSHOHANAVAR-XNTDXEJSSA-N	Cc1cc(C)c(N2C(=O)NC(=O)\C(=C/NNC(=O)c3ccncc3)\C2=O)c(C)c1	BroadT	BRD-K21261751	BRD-K21261751-001-06-6	InterBioScreen Ltd.	STOCK2S-47831			Cc1cc(C)c(N2C(=O)NC(=O)\C(=C/NNC(=O)c3ccncc3)C2=O)c(C)c1	InChI=1S/C20H19N5O4/c1-11-8-12(2)16(13(3)9-11)25-19(28)15(18(27)23-20(25)29)10-22-24-17(26)14-4-6-21-7-5-14/h4-10,22H,1-3H3,(H,24,26)(H,23,27,29)/b15-10+	VRMVSHOHANAVAR-XNTDXEJSSA-N	393.143704138							
MLS000733123	LSM-19851	SID24798446, BRD-A81465433	16190117	InChI=1S/C14H28N2OS2/c1-12(2)16-5-4-15(9-13(16)3-6-17)14-10-18-7-8-19-11-14/h12-14,17H,3-11H2,1-2H3	GUDLXTFNNCOYNM-UHFFFAOYSA-N	CC(C)N1CCN(CC1CCO)C2CSCCSC2	BroadT	BRD-A81465433	BRD-A81465433-001-05-0	ChemBridge Corporation	83720533			CC(C)N1CCN(CC1CCO)C1CSCCSC1	InChI=1S/C14H28N2OS2/c1-12(2)16-5-4-15(9-13(16)3-6-17)14-10-18-7-8-19-11-14/h12-14,17H,3-11H2,1-2H3	GUDLXTFNNCOYNM-UHFFFAOYSA-N	304.164304916							108475
F0558-0259	LSM-19852	SID4245437, BRD-K08634056	3239909	InChI=1S/C21H24N4O6S2/c1-2-29-21(28)25-7-5-24(6-8-25)19(27)12-32-11-18(26)23-20-22-15(10-33-20)14-3-4-16-17(9-14)31-13-30-16/h3-4,9-10H,2,5-8,11-13H2,1H3,(H,22,23,26)	UWTSACVETMMCEI-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)CSCC(=O)Nc2nc(cs2)c3ccc4OCOc4c3	BroadT	BRD-K08634056	BRD-K08634056-001-04-8	ChemDiv Inc.	4556-1087			CCOC(=O)N1CCN(CC1)C(=O)CSCC(=O)Nc1nc(cs1)-c1ccc2OCOc2c1	InChI=1S/C21H24N4O6S2/c1-2-29-21(28)25-7-5-24(6-8-25)19(27)12-32-11-18(26)23-20-22-15(10-33-20)14-3-4-16-17(9-14)31-13-30-16/h3-4,9-10H,2,5-8,11-13H2,1H3,(H,22,23,26)	UWTSACVETMMCEI-UHFFFAOYSA-N	492.113725908							108476
MLS000533080	LSM-19853	SID14746118, BRD-K50305779	743778	InChI=1S/C13H10ClN3/c1-8-6-11(12(7-15)13(16)17-8)9-2-4-10(14)5-3-9/h2-6H,1H3,(H2,16,17)	OIADGIDTZVRINS-UHFFFAOYSA-N	Cc1cc(c2ccc(Cl)cc2)c(C#N)c(N)n1	BroadT	BRD-K50305779	BRD-K50305779-001-05-5	ChemBridge Corporation	5585745			Cc1cc(-c2ccc(Cl)cc2)c(C#N)c(N)n1	InChI=1S/C13H10ClN3/c1-8-6-11(12(7-15)13(16)17-8)9-2-4-10(14)5-3-9/h2-6H,1H3,(H2,16,17)	OIADGIDTZVRINS-UHFFFAOYSA-N	243.05632506							108477
SMR000129579	LSM-19854	SID14738209, BRD-K30586672	2911476	InChI=1S/C24H20N4O2/c1-15-14-18(16-10-6-4-7-11-16)21-22-19(23(29)27(3)24(30)26(22)2)20(28(21)25-15)17-12-8-5-9-13-17/h4-14H,1-3H3	RKYFUURODUYWKJ-UHFFFAOYSA-N	CN1C(=O)N(C)c2c(C1=O)c(c3ccccc3)n4nc(C)cc(c5ccccc5)c24	BroadT	BRD-K30586672	BRD-K30586672-001-06-1	ChemDiv Inc.	4414-0010			Cc1cc(-c2ccccc2)c2c3n(C)c(=O)n(C)c(=O)c3c(-c3ccccc3)n2n1	InChI=1S/C24H20N4O2/c1-15-14-18(16-10-6-4-7-11-16)21-22-19(23(29)27(3)24(30)26(22)2)20(28(21)25-15)17-12-8-5-9-13-17/h4-14H,1-3H3	RKYFUURODUYWKJ-UHFFFAOYSA-N	396.15862592							108478
MLS000722301	LSM-43859	SID17515082, BRD-K56566959	6379206	InChI=1S/C15H14N2O3S/c1-10-7-11(2)9-12(8-10)16-14(18)5-3-13-4-6-15(21-13)17(19)20/h3-9H,1-2H3,(H,16,18)/b5-3+	IAIBLICIGSHEOL-HWKANZROSA-N	Cc1cc(C)cc(NC(=O)\C=C\c2ccc(s2)[N+](=O)[O-])c1	BroadT	BRD-K56566959	BRD-K56566959-001-05-8	Life Chemicals Inc.	F0447-0115			Cc1cc(C)cc(NC(=O)\C=C\c2ccc(s2)[N+]([O-])=O)c1	InChI=1S/C15H14N2O3S/c1-10-7-11(2)9-12(8-10)16-14(18)5-3-13-4-6-15(21-13)17(19)20/h3-9H,1-2H3,(H,16,18)/b5-3+	IAIBLICIGSHEOL-HWKANZROSA-N	302.072513018							
AC1M6IBT	LSM-19856	BRD-K59564804	2373767	InChI=1S/C19H15N3O4/c23-19(21-17-9-8-15-5-1-2-6-16(15)11-17)13-26-20-12-14-4-3-7-18(10-14)22(24)25/h1-12H,13H2,(H,21,23)	KQPRMKGVPLRLSE-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(C=NOCC(=O)Nc2ccc3ccccc3c2)c1	BroadT	BRD-K59564804	BRD-K59564804-001-05-7	Enamine Ltd.	T0512-9324			[O-][N+](=O)c1cccc(C=NOCC(=O)Nc2ccc3ccccc3c2)c1	InChI=1S/C19H15N3O4/c23-19(21-17-9-8-15-5-1-2-6-16(15)11-17)13-26-20-12-14-4-3-7-18(10-14)22(24)25/h1-12H,13H2,(H,21,23)	KQPRMKGVPLRLSE-UHFFFAOYSA-N	349.10625599							108480
2-(2-{5-[3,5-Bis(trifluoromethyl)phenyl]-2H-1,2,3,4-tetraazol-2-yl}acetyl)-n-(4-chlorophenyl)-1-hydrazinecarbothioamide	LSM-19857	SID26727776, BRD-K66736913	2730386	InChI=1S/C18H12ClF6N7OS/c19-12-1-3-13(4-2-12)26-16(34)29-27-14(33)8-32-30-15(28-31-32)9-5-10(17(20,21)22)7-11(6-9)18(23,24)25/h1-7H,8H2,(H,27,33)(H2,26,29,34)	ZAONFWDEKAOADX-UHFFFAOYSA-N	FC(F)(F)c1cc(cc(c1)C(F)(F)F)c2nnn(CC(=O)NN=C(S)Nc3ccc(Cl)cc3)n2	BroadT	BRD-K66736913	BRD-K66736913-001-05-0	Maybridge	RJF 00941			FC(F)(F)c1cc(cc(c1)C(F)(F)F)-c1nnn(CC(=O)NN=C(S)Nc2ccc(Cl)cc2)n1	InChI=1S/C18H12ClF6N7OS/c19-12-1-3-13(4-2-12)26-16(34)29-27-14(33)8-32-30-15(28-31-32)9-5-10(17(20,21)22)7-11(6-9)18(23,24)25/h1-7H,8H2,(H,27,33)(H2,26,29,34)	ZAONFWDEKAOADX-UHFFFAOYSA-N	523.041675674							108481
SMR000068358	LSM-19858	SID24839815, SID3711708, BRD-K92634926	2997736	InChI=1S/C21H27N5O3S2/c1-4-26-17-10-9-14(31(28,29)25(2)3)13-16(17)22-19(26)11-12-20(27)24-21-23-15-7-5-6-8-18(15)30-21/h9-10,13H,4-8,11-12H2,1-3H3,(H,23,24,27)	VSSQKWYAEYPUJF-UHFFFAOYSA-N	CCn1c(CCC(=O)Nc2nc3CCCCc3s2)nc4cc(ccc14)S(=O)(=O)N(C)C	BroadT	BRD-K92634926	BRD-K92634926-001-05-0	Enamine Ltd.	T5340715			CCn1c(CCC(=O)Nc2nc3CCCCc3s2)nc2cc(ccc12)S(=O)(=O)N(C)C	InChI=1S/C21H27N5O3S2/c1-4-26-17-10-9-14(31(28,29)25(2)3)13-16(17)22-19(26)11-12-20(27)24-21-23-15-7-5-6-8-18(15)30-21/h9-10,13H,4-8,11-12H2,1-3H3,(H,23,24,27)	VSSQKWYAEYPUJF-UHFFFAOYSA-N	461.155531154							108482
MLS000556224	LSM-43629	BRD-K55766360	793075	InChI=1S/C18H18ClN2S/c1-3-21-16-13-14(19)9-10-17(16)22-18(21)11-12-20(2)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3/q+1	HKYKXCKMZXXLBR-UHFFFAOYSA-N	CC[n+]1c(\C=C\N(C)c2ccccc2)sc3ccc(Cl)cc13	BroadT	BRD-K55766360	BRD-K55766360-009-11-9	Asinex Ltd.	BAS 00009458		OCl(=O)(=O)=O	CC[n+]1c(\C=C\N(C)c2ccccc2)sc2ccc(Cl)cc12.OCl(=O)(=O)=O	InChI=1S/C18H18ClN2S.ClHO4/c1-3-21-16-13-14(19)9-10-17(16)22-18(21)11-12-20(2)15-7-5-4-6-8-15;2-1(3,4)5/h4-13H,3H2,1-2H3;(H,2,3,4,5)/q+1;	WTMMPFWZPRLMLK-UHFFFAOYSA-N	329.087921996							104238, 104238
Methyl 4-(cyclohexylcarbamoylamino)benzoate	LSM-19859	SID22416235, BRD-K73857162	898346	InChI=1S/C15H20N2O3/c1-20-14(18)11-7-9-13(10-8-11)17-15(19)16-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H2,16,17,19)	KVNBYQOKHHJETJ-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=O)NC2CCCCC2)cc1	BroadT	BRD-K73857162	BRD-K73857162-001-06-1	ChemBridge Corporation	7273444			COC(=O)c1ccc(NC(=O)NC2CCCCC2)cc1	InChI=1S/C15H20N2O3/c1-20-14(18)11-7-9-13(10-8-11)17-15(19)16-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H2,16,17,19)	KVNBYQOKHHJETJ-UHFFFAOYSA-N	276.14739252							108483
AC1MHCOK	LSM-19860	SID3717064, BRD-A38105772	2999859	InChI=1S/C19H19N5O2S2/c1-10-11(2)27-18-15(10)17(25)21-16(22-18)12(3)28-19-23-20-9-24(19)13-5-7-14(26-4)8-6-13/h5-9,12H,1-4H3,(H,21,22,25)	HUKKCFAPUOUOIK-UHFFFAOYSA-N	COc1ccc(cc1)n2cnnc2SC(C)c3nc(O)c4c(C)c(C)sc4n3	BroadT	BRD-A38105772	BRD-A38105772-001-02-2	Enamine Ltd.	T5336068			COc1ccc(cc1)-n1cnnc1SC(C)c1nc(O)c2c(C)c(C)sc2n1	InChI=1S/C19H19N5O2S2/c1-10-11(2)27-18-15(10)17(25)21-16(22-18)12(3)28-19-23-20-9-24(19)13-5-7-14(26-4)8-6-13/h5-9,12H,1-4H3,(H,21,22,25)	HUKKCFAPUOUOIK-UHFFFAOYSA-N	413.098016278							108484
MLS000564456	LSM-19861	SID17508106, BRD-K27791603	1079280	InChI=1S/C18H16ClN3O3S/c1-11-16(17(24)20-14-7-5-13(19)6-8-14)21-18(26-11)22(12(2)23)10-15-4-3-9-25-15/h3-9H,10H2,1-2H3,(H,20,24)	FNJAPGWTSONLMK-UHFFFAOYSA-N	CC(=O)N(Cc1occc1)c2nc(C(=O)Nc3ccc(Cl)cc3)c(C)s2	BroadT	BRD-K27791603	BRD-K27791603-001-05-8	Asinex Ltd.	BAS 05307722			CC(=O)N(Cc1ccco1)c1nc(C(=O)Nc2ccc(Cl)cc2)c(C)s1	InChI=1S/C18H16ClN3O3S/c1-11-16(17(24)20-14-7-5-13(19)6-8-14)21-18(26-11)22(12(2)23)10-15-4-3-9-25-15/h3-9H,10H2,1-2H3,(H,20,24)	FNJAPGWTSONLMK-UHFFFAOYSA-N	389.060089802							108485
BRD-A83035589	LSM-19862			InChI=1S/C20H20N2O3S/c1-12-6-8-13(9-7-12)18-14(10-21)20(26-11-17(24)25-2)22-15-4-3-5-16(23)19(15)18/h6-9,18-19H,3-5,11H2,1-2H3	XSQAYLCOQFOXAK-UHFFFAOYSA-N	COC(=O)CSC1=C(C#N)C(C2C(=O)CCCC2=N1)c3ccc(C)cc3	BroadT	BRD-A83035589	BRD-A83035589-001-05-1	Enamine Ltd.	T0516-7941			COC(=O)CSC1=C(C#N)C(C2C(=O)CCCC2=N1)c1ccc(C)cc1	InChI=1S/C20H20N2O3S/c1-12-6-8-13(9-7-12)18-14(10-21)20(26-11-17(24)25-2)22-15-4-3-5-16(23)19(15)18/h6-9,18-19H,3-5,11H2,1-2H3	XSQAYLCOQFOXAK-UHFFFAOYSA-N	368.11946321							108486
AC1LZGFJ	LSM-19863	BRD-K88591984	1921318	InChI=1S/C17H17ClN2O3S/c1-22-17(21)20-19-12-13-3-2-4-15(11-13)23-9-10-24-16-7-5-14(18)6-8-16/h2-8,11-12H,9-10H2,1H3,(H,20,21)	NTYFSSHHVSXJGP-UHFFFAOYSA-N	COC(=O)NN=Cc1cccc(OCCSc2ccc(Cl)cc2)c1	BroadT	BRD-K88591984	BRD-K88591984-001-05-7	InterBioScreen Ltd.	STOCK2S-46305			COC(=O)NN=Cc1cccc(OCCSc2ccc(Cl)cc2)c1	InChI=1S/C17H17ClN2O3S/c1-22-17(21)20-19-12-13-3-2-4-15(11-13)23-9-10-24-16-7-5-14(18)6-8-16/h2-8,11-12H,9-10H2,1H3,(H,20,21)	NTYFSSHHVSXJGP-UHFFFAOYSA-N	364.064840824							108487
ZINC00662072	LSM-19864	SID26666491, BRD-K83793715	1004339	InChI=1S/C21H19N3O4S/c1-26-18-8-6-14(10-19(18)27-2)17-7-5-15(11-22)21(24-17)29-13-20(25)23-12-16-4-3-9-28-16/h3-10H,12-13H2,1-2H3,(H,23,25)	RJPBPYIQAXBWNN-UHFFFAOYSA-N	COc1ccc(cc1OC)c2ccc(C#N)c(SCC(=O)NCc3occc3)n2	BroadT	BRD-K83793715	BRD-K83793715-001-05-0	InterBioScreen Ltd.	STOCK3S-24402			COc1ccc(cc1OC)-c1ccc(C#N)c(SCC(=O)NCc2ccco2)n1	InChI=1S/C21H19N3O4S/c1-26-18-8-6-14(10-19(18)27-2)17-7-5-15(11-22)21(24-17)29-13-20(25)23-12-16-4-3-9-28-16/h3-10H,12-13H2,1-2H3,(H,23,25)	RJPBPYIQAXBWNN-UHFFFAOYSA-N	409.109626808							108488
MLS000078329	LSM-19865	SID857594, BRD-K54625745	658944	InChI=1S/C24H25N3O5S/c1-31-20-10-6-5-9-19(20)27-23(30)18(15-17-7-3-2-4-8-17)22(29)25-24(27)33-16-21(28)26-11-13-32-14-12-26/h2-10,30H,11-16H2,1H3	ROSAONLFQKNECH-UHFFFAOYSA-N	COc1ccccc1N2C(=C(Cc3ccccc3)C(=O)N=C2SCC(=O)N4CCOCC4)O	BroadT	BRD-K54625745	BRD-K54625745-001-05-3	InterBioScreen Ltd.	STOCK1S-83522			COc1ccccc1-n1c(SCC(=O)N2CCOCC2)nc(=O)c(Cc2ccccc2)c1O	InChI=1S/C24H25N3O5S/c1-31-20-10-6-5-9-19(20)27-23(30)18(15-17-7-3-2-4-8-17)22(29)25-24(27)33-16-21(28)26-11-13-32-14-12-26/h2-10,30H,11-16H2,1H3	ROSAONLFQKNECH-UHFFFAOYSA-N	467.15149162							108489
MLS000519424	LSM-19866	SID14732901, BRD-K36086149	4103640	InChI=1S/C22H23BrN2O3/c1-14-6-4-5-7-18(14)24-8-10-25(11-9-24)22(26)21-15(2)28-19-13-17(23)20(27-3)12-16(19)21/h4-7,12-13H,8-11H2,1-3H3	CZIDGNROYZDNMF-UHFFFAOYSA-N	COc1cc2c(C(=O)N3CCN(CC3)c4ccccc4C)c(C)oc2cc1Br	BroadT	BRD-K36086149	BRD-K36086149-001-07-9	ChemDiv Inc.	6526-0486			COc1cc2c(C(=O)N3CCN(CC3)c3ccccc3C)c(C)oc2cc1Br	InChI=1S/C22H23BrN2O3/c1-14-6-4-5-7-18(14)24-8-10-25(11-9-24)22(26)21-15(2)28-19-13-17(23)20(27-3)12-16(19)21/h4-7,12-13H,8-11H2,1-3H3	CZIDGNROYZDNMF-UHFFFAOYSA-N	442.089205216							108490
1-Benzo[1,3]dioxol-5-yl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid	LSM-19867	SID849983, BRD-A21023809	652490	InChI=1S/C19H16N2O4/c22-19(23)14-8-12-11-3-1-2-4-13(11)20-18(12)17(21-14)10-5-6-15-16(7-10)25-9-24-15/h1-7,14,17,20-21H,8-9H2,(H,22,23)	MDXJJOKTGDJRNN-UHFFFAOYSA-N	OC(=O)C1Cc2c([nH]c3ccccc23)C(N1)c4ccc5OCOc5c4	BroadT	BRD-A21023809	BRD-A21023809-001-05-6	Asinex Ltd.	BAS 02801154			OC(=O)C1Cc2c([nH]c3ccccc23)C(N1)c1ccc2OCOc2c1	InChI=1S/C19H16N2O4/c22-19(23)14-8-12-11-3-1-2-4-13(11)20-18(12)17(21-14)10-5-6-15-16(7-10)25-9-24-15/h1-7,14,17,20-21H,8-9H2,(H,22,23)	MDXJJOKTGDJRNN-UHFFFAOYSA-N	336.111007012							108491
BRD-A43077378	LSM-19868			InChI=1S/C21H21NO4/c1-21(2)11-17(23)15(19(24)18(21)20(25)26-3)12-22-16-10-6-8-13-7-4-5-9-14(13)16/h4-10,12,15,18H,11H2,1-3H3	XOJSYFQECFHGBL-UHFFFAOYSA-N	COC(=O)C1C(=O)C(C=Nc2cccc3ccccc23)C(=O)CC1(C)C	BroadT	BRD-A43077378	BRD-A43077378-001-05-7	InterBioScreen Ltd.	STOCK2S-05861			COC(=O)C1C(=O)C(C=Nc2cccc3ccccc23)C(=O)CC1(C)C	InChI=1S/C21H21NO4/c1-21(2)11-17(23)15(19(24)18(21)20(25)26-3)12-22-16-10-6-8-13-7-4-5-9-14(13)16/h4-10,12,15,18H,11H2,1-3H3	XOJSYFQECFHGBL-UHFFFAOYSA-N	351.147058162							108492
BAS 00171249	LSM-19869	SID24780908, BRD-A92605422	3094138	InChI=1S/C11H14ClN3O4S/c1-8(12)11(17)15-14-10(16)7-13-20(18,19)9-5-3-2-4-6-9/h2-6,8,13H,7H2,1H3,(H,14,16)(H,15,17)	MEYVZYSCAJMFHA-UHFFFAOYSA-N	CC(Cl)C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1	BroadT	BRD-A92605422	BRD-A92605422-001-05-1	Asinex Ltd.	BAS 00171249			CC(Cl)C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1	InChI=1S/C11H14ClN3O4S/c1-8(12)11(17)15-14-10(16)7-13-20(18,19)9-5-3-2-4-6-9/h2-6,8,13H,7H2,1H3,(H,14,16)(H,15,17)	MEYVZYSCAJMFHA-UHFFFAOYSA-N	319.039354358							108493
AC1LHFHV	LSM-19870	SID4257034, BRD-K11023698	886522	InChI=1S/C15H15ClO3/c1-8(2)18-14-7-13-11(6-12(14)16)9-4-3-5-10(9)15(17)19-13/h6-8H,3-5H2,1-2H3	AXKFCVCCISFWBQ-UHFFFAOYSA-N	CC(C)Oc1cc2OC(=O)C3=C(CCC3)c2cc1Cl	BroadT	BRD-K11023698	BRD-K11023698-001-05-0	ChemBridge Corporation	6239759			CC(C)Oc1cc2oc(=O)c3CCCc3c2cc1Cl	InChI=1S/C15H15ClO3/c1-8(2)18-14-7-13-11(6-12(14)16)9-4-3-5-10(9)15(17)19-13/h6-8H,3-5H2,1-2H3	AXKFCVCCISFWBQ-UHFFFAOYSA-N	278.07097205							108494
1,4-Dimethyl-6-nitro-9H-carbazole	LSM-19871	SID14733321, BRD-K10135134	154436	InChI=1S/C14H12N2O2/c1-8-3-4-9(2)14-13(8)11-7-10(16(17)18)5-6-12(11)15-14/h3-7,15H,1-2H3	OEENCKLKSYVWPU-UHFFFAOYSA-N	Cc1ccc(C)c2c3cc(ccc3[nH]c12)[N+](=O)[O-]	BroadT	BRD-K10135134	BRD-K10135134-001-06-3	Key Organics Ltd.	12W-0853			Cc1ccc(C)c2c1[nH]c1ccc(cc21)[N+]([O-])=O	InChI=1S/C14H12N2O2/c1-8-3-4-9(2)14-13(8)11-7-10(16(17)18)5-6-12(11)15-14/h3-7,15H,1-2H3	OEENCKLKSYVWPU-UHFFFAOYSA-N	240.089877644							108495
T0502-4933	LSM-19872	SID3712774, BRD-K07391518	2310667	InChI=1S/C14H16N4O/c1-8(2)18-7-11(19)12(13(18)15)14-16-9-5-3-4-6-10(9)17-14/h3-6,8H,7,15H2,1-2H3,(H,16,17)	WFWRAWUSRDKHDU-UHFFFAOYSA-N	CC(C)N1CC(=O)C(=C1N)c2nc3ccccc3[nH]2	BroadT	BRD-K07391518	BRD-K07391518-001-05-5	Enamine Ltd.	T0502-4933			CC(C)N1CC(=O)C(c2nc3ccccc3[nH]2)=C1N	InChI=1S/C14H16N4O/c1-8(2)18-7-11(19)12(13(18)15)14-16-9-5-3-4-6-10(9)17-14/h3-6,8H,7,15H2,1-2H3,(H,16,17)	WFWRAWUSRDKHDU-UHFFFAOYSA-N	256.132411172							108496
STK358162	LSM-19873	SID4257986, BRD-K92758664	973953	InChI=1S/C14H15NO3S2/c1-18-12-5-3-11(4-6-12)15-20(16,17)14-9-7-13(19-2)8-10-14/h3-10,15H,1-2H3	MJPGGWHWILPONZ-UHFFFAOYSA-N	COc1ccc(NS(=O)(=O)c2ccc(SC)cc2)cc1	BroadT	BRD-K92758664	BRD-K92758664-001-05-3	ChemBridge Corporation	7907251			COc1ccc(NS(=O)(=O)c2ccc(SC)cc2)cc1	InChI=1S/C14H15NO3S2/c1-18-12-5-3-11(4-6-12)15-20(16,17)14-9-7-13(19-2)8-10-14/h3-10,15H,1-2H3	MJPGGWHWILPONZ-UHFFFAOYSA-N	309.04933473							108497
NSC721065	LSM-19874	SID535868, SID7975512, BRD-A35141474	5310783	InChI=1S/C17H15N5O/c1-23-14-9-7-13(8-10-14)16-11-15(12-5-3-2-4-6-12)18-17-19-20-21-22(16)17/h2-11,16H,1H3,(H,18,19,21)	WYRNEYAZTKWHPI-UHFFFAOYSA-N	COc1ccc(cc1)C2C=C(Nc3nnnn23)c4ccccc4	BroadT	BRD-A35141474	BRD-A35141474-001-05-4	ChemBridge Corporation	6991668			COc1ccc(cc1)C1C=C(Nc2nnnn12)c1ccccc1	InChI=1S/C17H15N5O/c1-23-14-9-7-13(8-10-14)16-11-15(12-5-3-2-4-6-12)18-17-19-20-21-22(16)17/h2-11,16H,1H3,(H,18,19,21)	WYRNEYAZTKWHPI-UHFFFAOYSA-N	305.12766015							108498
MLS000115836	LSM-19875	SID4258253, SID7969154, BRD-K49121935	712173	InChI=1S/C15H15N3OS2/c1-10-13(21-9-16-10)7-8-20-15-17-12-6-4-3-5-11(12)14(19)18(15)2/h3-6,9H,7-8H2,1-2H3	XDAQJALAKNZBQC-UHFFFAOYSA-N	CN1C(=Nc2ccccc2C1=O)SCCc3scnc3C	BroadT	BRD-K49121935	BRD-K49121935-001-07-7	ChemBridge Corporation	7954103			Cc1ncsc1CCSc1nc2ccccc2c(=O)n1C	InChI=1S/C15H15N3OS2/c1-10-13(21-9-16-10)7-8-20-15-17-12-6-4-3-5-11(12)14(19)18(15)2/h3-6,9H,7-8H2,1-2H3	XDAQJALAKNZBQC-UHFFFAOYSA-N	317.06565351							108499
T5250763	LSM-19876	SID3712733, BRD-A54970395	2998140	InChI=1S/C21H32N2O2/c1-15-20-5-4-8-22(20)9-10-23(15)12-18(24)14-25-13-16-6-7-17-11-19(16)21(17,2)3/h4-6,8,15,17-19,24H,7,9-14H2,1-3H3	MPMBMMNKHZRACQ-UHFFFAOYSA-N	CC1N(CC(O)COCC2=CCC3CC2C3(C)C)CCn4cccc14	BroadT	BRD-A54970395	BRD-A54970395-001-05-8	Enamine Ltd.	T5250763			CC1N(CC(O)COCC2=CCC3CC2C3(C)C)CCn2cccc12	InChI=1S/C21H32N2O2/c1-15-20-5-4-8-22(20)9-10-23(15)12-18(24)14-25-13-16-6-7-17-11-19(16)21(17,2)3/h4-6,8,15,17-19,24H,7,9-14H2,1-3H3	MPMBMMNKHZRACQ-UHFFFAOYSA-N	344.246378284							108500
SMR000046967	LSM-19877	SID864584, BRD-A04544673	665827	InChI=1S/C24H23ClN4O/c25-19-6-4-5-17(13-19)18-14-22-21(23(30)15-18)16-26-24(27-22)29-11-9-28(10-12-29)20-7-2-1-3-8-20/h1-8,13,16,18H,9-12,14-15H2	LIRXFBXUQRJWMZ-UHFFFAOYSA-N	Clc1cccc(c1)C2CC(=O)c3cnc(nc3C2)N4CCN(CC4)c5ccccc5	BroadT	BRD-A04544673	BRD-A04544673-001-05-5	InterBioScreen Ltd.	STOCK5S-19358			Clc1cccc(c1)C1CC(=O)c2cnc(nc2C1)N1CCN(CC1)c1ccccc1	InChI=1S/C24H23ClN4O/c25-19-6-4-5-17(13-19)18-14-22-21(23(30)15-18)16-26-24(27-22)29-11-9-28(10-12-29)20-7-2-1-3-8-20/h1-8,13,16,18H,9-12,14-15H2	LIRXFBXUQRJWMZ-UHFFFAOYSA-N	418.156039106							108501
AC1MOZSO	LSM-19878	SID17513890, BRD-A50170005	3403355	InChI=1S/C17H26N2O2S/c20-15(18-16(22)19-3-5-21-6-4-19)17-2-1-12-7-13(10-17)9-14(8-12)11-17/h12-14H,1-11H2,(H,18,20,22)	UMSXWPSYLFTPBQ-UHFFFAOYSA-N	O=C(NC(=S)N1CCOCC1)C23CCC4CC(CC(C4)C2)C3	BroadT	BRD-A50170005	BRD-A50170005-001-05-1	InterBioScreen Ltd.	STOCK1S-93279			O=C(NC(=S)N1CCOCC1)C12CC3CC(CC(C3)CC1)C2	InChI=1S/C17H26N2O2S/c20-15(18-16(22)19-3-5-21-6-4-19)17-2-1-12-7-13(10-17)9-14(8-12)11-17/h12-14H,1-11H2,(H,18,20,22)	UMSXWPSYLFTPBQ-UHFFFAOYSA-N	322.171498782							108502
F3238-0145	LSM-19879	SID4263814, BRD-K78971503	1094980	InChI=1S/C18H19N3O3S/c22-25(23,20-10-12-24-13-11-20)21-17-9-5-4-8-16(17)19-18(21)14-15-6-2-1-3-7-15/h1-9H,10-14H2	ULFFECNMOAPKDI-UHFFFAOYSA-N	O=S(=O)(N1CCOCC1)n2c(Cc3ccccc3)nc4ccccc24	BroadT	BRD-K78971503	BRD-K78971503-001-06-3	ChemBridge Corporation	7904581			O=S(=O)(N1CCOCC1)n1c(Cc2ccccc2)nc2ccccc12	InChI=1S/C18H19N3O3S/c22-25(23,20-10-12-24-13-11-20)21-17-9-5-4-8-16(17)19-18(21)14-15-6-2-1-3-7-15/h1-9H,10-14H2	ULFFECNMOAPKDI-UHFFFAOYSA-N	357.114712188							108503
SMR000065781	LSM-19880	SID3715692, BRD-K14581814	1548053	InChI=1S/C15H14N2O4/c1-3-8-6-9-12(7-11(8)19-2)21-15(16)13(14(9)18)10-4-5-20-17-10/h4-7,16,18H,3H2,1-2H3	XCHXPEYJZPYNRE-UHFFFAOYSA-N	CCc1cc2C(=C(C(=N)Oc2cc1OC)c3ccon3)O	BroadT	BRD-K14581814	BRD-K14581814-001-07-9	Enamine Ltd.	T0503-4807			CCc1cc2c(O)c(-c3ccon3)c(=N)oc2cc1OC	InChI=1S/C15H14N2O4/c1-3-8-6-9-12(7-11(8)19-2)21-15(16)13(14(9)18)10-4-5-20-17-10/h4-7,16,18H,3H2,1-2H3	XCHXPEYJZPYNRE-UHFFFAOYSA-N	286.095356948							
T0516-6691	LSM-19881	BRD-A41503323	4424829	InChI=1S/C23H19ClN4O2S/c24-16-7-6-11-18(13-16)26-21(29)14-20-22(30)28(15-19-10-4-5-12-25-19)23(31-20)27-17-8-2-1-3-9-17/h1-13,20H,14-15H2,(H,26,29)	CZVQZVXLUOAFKN-UHFFFAOYSA-N	Clc1cccc(NC(=O)CC2SC(=Nc3ccccc3)N(Cc4ccccn4)C2=O)c1	BroadT	BRD-A41503323	BRD-A41503323-001-05-0	Enamine Ltd.	T0516-6691			Clc1cccc(NC(=O)CC2SC(=Nc3ccccc3)N(Cc3ccccn3)C2=O)c1	InChI=1S/C23H19ClN4O2S/c24-16-7-6-11-18(13-16)26-21(29)14-20-22(30)28(15-19-10-4-5-12-25-19)23(31-20)27-17-8-2-1-3-9-17/h1-13,20H,14-15H2,(H,26,29)	CZVQZVXLUOAFKN-UHFFFAOYSA-N	450.091724288							108505
MLS000583046	LSM-19882	SID17510364, BRD-A36378415	12005190	InChI=1S/C28H26FN3O4/c29-24-9-3-1-6-20(24)18-31-25-10-4-2-8-23(25)27(34)32(28(31)35)21-13-11-19(12-14-21)16-26(33)30-17-22-7-5-15-36-22/h1-4,6,8-14,22H,5,7,15-18H2,(H,30,33)	IRZFSMRPTZEUFT-UHFFFAOYSA-N	Fc1ccccc1CN2C(=O)N(C(=O)c3ccccc23)c4ccc(CC(=O)NCC5CCCO5)cc4	BroadT	BRD-A36378415	BRD-A36378415-001-05-3	ChemDiv Inc.	C260-2011			Fc1ccccc1Cn1c2ccccc2c(=O)n(-c2ccc(CC(=O)NCC3CCCO3)cc2)c1=O	InChI=1S/C28H26FN3O4/c29-24-9-3-1-6-20(24)18-31-25-10-4-2-8-23(25)27(34)32(28(31)35)21-13-11-19(12-14-21)16-26(33)30-17-22-7-5-15-36-22/h1-4,6,8-14,22H,5,7,15-18H2,(H,30,33)	IRZFSMRPTZEUFT-UHFFFAOYSA-N	487.190734542							108506
AC1LHQP5	LSM-19883	BRD-K66741437	842367	InChI=1S/C12H9Cl2N3O2/c1-7-5-10(17-19-7)12(18)16-15-6-8-3-2-4-9(13)11(8)14/h2-6H,1H3,(H,16,18)	BKMNQBJIZQQZOH-UHFFFAOYSA-N	Cc1onc(c1)C(=O)NN=Cc2cccc(Cl)c2Cl	BroadT	BRD-K66741437	BRD-K66741437-001-05-7	Specs	AK-968/41026282			Cc1cc(no1)C(=O)NN=Cc1cccc(Cl)c1Cl	InChI=1S/C12H9Cl2N3O2/c1-7-5-10(17-19-7)12(18)16-15-6-8-3-2-4-9(13)11(8)14/h2-6H,1H3,(H,16,18)	BKMNQBJIZQQZOH-UHFFFAOYSA-N	297.007181978							108507
AC1LI2MM	LSM-19884	BRD-K20876925	873436	InChI=1S/C13H16N4O2S/c1-4-20-13-16-14-9-17(13)15-8-10-5-6-11(18-2)12(7-10)19-3/h5-9H,4H2,1-3H3	ABBXTWLLBXIBEJ-UHFFFAOYSA-N	CCSc1nncn1N=Cc2ccc(OC)c(OC)c2	BroadT	BRD-K20876925	BRD-K20876925-001-05-5	ChemBridge Corporation	5946503			CCSc1nncn1N=Cc1ccc(OC)c(OC)c1	InChI=1S/C13H16N4O2S/c1-4-20-13-16-14-9-17(13)15-8-10-5-6-11(18-2)12(7-10)19-3/h5-9H,4H2,1-3H3	ABBXTWLLBXIBEJ-UHFFFAOYSA-N	292.099396482							108508
AC1M78ZR	LSM-19885	BRD-K98154140	2437746	InChI=1S/C23H21N3O2S/c1-16-6-10-18(11-7-16)26-20-5-3-4-14-25(20)21(23(26)29)22(27)24-15-17-8-12-19(28-2)13-9-17/h3-14H,15H2,1-2H3,(H-,24,27,29)/p+1	FXFGYHRBMBDPGL-UHFFFAOYSA-O	COc1ccc(CNC(=O)c2c(S)n(c3ccc(C)cc3)c4cccc[n+]24)cc1	BroadT	BRD-K98154140	BRD-K98154140-001-05-3	Enamine Ltd.	T0517-7425			COc1ccc(CNC(=O)c2c(S)n(-c3ccc(C)cc3)c3cccc[n+]23)cc1	InChI=1S/C23H21N3O2S/c1-16-6-10-18(11-7-16)26-20-5-3-4-14-25(20)21(23(26)29)22(27)24-15-17-8-12-19(28-2)13-9-17/h3-14H,15H2,1-2H3,(H-,24,27,29)/p+1	FXFGYHRBMBDPGL-UHFFFAOYSA-O	404.143272664							108509
4,5-Dihydro[1,2,5]oxadiazolo[3,4-f]cinnoline 3-oxide	LSM-19886	SID4259137, BRD-K46769311	548516	InChI=1S/C8H6N4O2/c13-12-7-2-1-6-5(3-4-9-10-6)8(7)11-14-12/h3-4H,1-2H2	XWPXFMYATLQBKY-UHFFFAOYSA-N	[O-][n+]1onc2c1CCc3nnccc23	BroadT	BRD-K46769311	BRD-K46769311-001-06-2	ChemBridge Corporation	5256383			[O-][n+]1onc-2c1CCc1nnccc-21	InChI=1S/C8H6N4O2/c13-12-7-2-1-6-5(3-4-9-10-6)8(7)11-14-12/h3-4H,1-2H2	XWPXFMYATLQBKY-UHFFFAOYSA-N	190.049075472							108510
T0509-8469	LSM-19887	SID3711296, BRD-K69610429	2366421	InChI=1S/C7H5F3N4O/c1-3-2-4-11-5(7(8,9)10)12-6(15)14(4)13-3/h2H,1H3,(H,11,12,15)	REUSOIJOEHFAIA-UHFFFAOYSA-N	Cc1cc2nc(nc(O)n2n1)C(F)(F)F	BroadT	BRD-K69610429	BRD-K69610429-001-05-1	Enamine Ltd.	T0509-8469			Cc1cc2nc(nc(O)n2n1)C(F)(F)F	InChI=1S/C7H5F3N4O/c1-3-2-4-11-5(7(8,9)10)12-6(15)14(4)13-3/h2H,1H3,(H,11,12,15)	REUSOIJOEHFAIA-UHFFFAOYSA-N	218.04154542							
MLS000389022	LSM-19888	SID22408057, BRD-K35363254	3418657	InChI=1S/C24H22ClN3O/c1-16(2)17-9-4-6-12-20(17)26-23(29)15-28-22-14-8-7-13-21(22)27-24(28)18-10-3-5-11-19(18)25/h3-14,16H,15H2,1-2H3,(H,26,29)	YSZNGVHVTOABOS-UHFFFAOYSA-N	CC(C)c1ccccc1NC(=O)Cn2c(nc3ccccc23)c4ccccc4Cl	BroadT	BRD-K35363254	BRD-K35363254-001-05-8	Enamine Ltd.	T0519-7493			CC(C)c1ccccc1NC(=O)Cn1c(nc2ccccc12)-c1ccccc1Cl	InChI=1S/C24H22ClN3O/c1-16(2)17-9-4-6-12-20(17)26-23(29)15-28-22-14-8-7-13-21(22)27-24(28)18-10-3-5-11-19(18)25/h3-14,16H,15H2,1-2H3,(H,26,29)	YSZNGVHVTOABOS-UHFFFAOYSA-N	403.145140064							108512
4-Nitrophenyl 2-(4-ethylphenoxy)acetate	LSM-19889	SID47201722, BRD-K18980064	830993	InChI=1S/C16H15NO5/c1-2-12-3-7-14(8-4-12)21-11-16(18)22-15-9-5-13(6-10-15)17(19)20/h3-10H,2,11H2,1H3	RWFUKWUGXDQCGQ-UHFFFAOYSA-N	CCc1ccc(OCC(=O)Oc2ccc(cc2)[N+](=O)[O-])cc1	BroadT	BRD-K18980064	BRD-K18980064-001-05-0	Asinex Ltd.	BAS 00355360			CCc1ccc(OCC(=O)Oc2ccc(cc2)[N+]([O-])=O)cc1	InChI=1S/C16H15NO5/c1-2-12-3-7-14(8-4-12)21-11-16(18)22-15-9-5-13(6-10-15)17(19)20/h3-10H,2,11H2,1H3	RWFUKWUGXDQCGQ-UHFFFAOYSA-N	301.09502259							108513
N-(4-Fluorophenyl)-4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepane-1-carboxamide	LSM-19890	SID26729235, BRD-K33065755	2815603	InChI=1S/C18H18F4N4O/c19-14-3-5-15(6-4-14)24-17(27)26-9-1-8-25(10-11-26)16-7-2-13(12-23-16)18(20,21)22/h2-7,12H,1,8-11H2,(H,24,27)	IYHHZWFUZWWTQC-UHFFFAOYSA-N	Fc1ccc(NC(=O)N2CCCN(CC2)c3ccc(cn3)C(F)(F)F)cc1	BroadT	BRD-K33065755	BRD-K33065755-001-05-5	Maybridge	HTS 10835			Fc1ccc(NC(=O)N2CCCN(CC2)c2ccc(cn2)C(F)(F)F)cc1	InChI=1S/C18H18F4N4O/c19-14-3-5-15(6-4-14)24-17(27)26-9-1-8-25(10-11-26)16-7-2-13(12-23-16)18(20,21)22/h2-7,12H,1,8-11H2,(H,24,27)	IYHHZWFUZWWTQC-UHFFFAOYSA-N	382.141674036							108514
2-({2-[(2-Fluorobenzyl)oxy]-3-methoxybenzyl}amino)phenol	LSM-19891	SID24792331, BRD-K25408256	1847937	InChI=1S/C21H20FNO3/c1-25-20-12-6-8-15(13-23-18-10-4-5-11-19(18)24)21(20)26-14-16-7-2-3-9-17(16)22/h2-12,23-24H,13-14H2,1H3	VYYYHPJUDXYOCY-UHFFFAOYSA-N	COc1cccc(CNc2ccccc2O)c1OCc3ccccc3F	BroadT	BRD-K25408256	BRD-K25408256-001-05-1	ChemBridge Corporation	9007637			COc1cccc(CNc2ccccc2O)c1OCc1ccccc1F	InChI=1S/C21H20FNO3/c1-25-20-12-6-8-15(13-23-18-10-4-5-11-19(18)24)21(20)26-14-16-7-2-3-9-17(16)22/h2-12,23-24H,13-14H2,1H3	VYYYHPJUDXYOCY-UHFFFAOYSA-N	353.14272171							108515
5-Chloro-2-methoxy-n,n,4-trimethylbenzenesulfonamide	LSM-19892	SID4260894, BRD-K15225658	934502	InChI=1S/C10H14ClNO3S/c1-7-5-9(15-4)10(6-8(7)11)16(13,14)12(2)3/h5-6H,1-4H3	CYAIIRMCYQHMNT-UHFFFAOYSA-N	COc1cc(C)c(Cl)cc1S(=O)(=O)N(C)C	BroadT	BRD-K15225658	BRD-K15225658-001-05-5	ChemBridge Corporation	7926757			COc1cc(C)c(Cl)cc1S(=O)(=O)N(C)C	InChI=1S/C10H14ClNO3S/c1-7-5-9(15-4)10(6-8(7)11)16(13,14)12(2)3/h5-6H,1-4H3	CYAIIRMCYQHMNT-UHFFFAOYSA-N	263.038291718							131251
MLS000879399	LSM-19893	SID26732072, SID50112269, BRD-A78935426	16746264	InChI=1S/C28H35NO8/c1-17-13-24(30)37-28-25(17)20(31-2)16-21(32-3)26(28)19(7-8-29-9-11-36-12-10-29)18-14-22(33-4)27(35-6)23(15-18)34-5/h13-16,19H,7-12H2,1-6H3	GNDCZIUVHLDNSH-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(CCN2CCOCC2)c3c(OC)cc(OC)c4C(=CC(=O)Oc34)C	BroadT	BRD-A78935426	BRD-A78935426-001-05-6	University of Kansas CMLD	KUC101490N			COc1cc(cc(OC)c1OC)C(CCN1CCOCC1)c1c(OC)cc(OC)c2c(C)cc(=O)oc12	InChI=1S/C28H35NO8/c1-17-13-24(30)37-28-25(17)20(31-2)16-21(32-3)26(28)19(7-8-29-9-11-36-12-10-29)18-14-22(33-4)27(35-6)23(15-18)34-5/h13-16,19H,7-12H2,1-6H3	GNDCZIUVHLDNSH-UHFFFAOYSA-N	513.23626709							108518
MLS000096800	LSM-19894	SID4261306, BRD-A02763478	2945349	InChI=1S/C22H21N5O/c1-3-22(2)13-16-11-7-8-12-17(16)19-18(22)20(28)26(21-23-24-25-27(19)21)14-15-9-5-4-6-10-15/h4-12H,3,13-14H2,1-2H3	IYSGUMXLGINQIO-UHFFFAOYSA-N	CCC1(C)Cc2ccccc2C3=C1C(=O)N(Cc4ccccc4)c5nnnn35	BroadT	BRD-A02763478	BRD-A02763478-001-06-8	ChemBridge Corporation	7648162			CCC1(C)Cc2ccccc2-c2c1c(=O)n(Cc1ccccc1)c1nnnn21	InChI=1S/C22H21N5O/c1-3-22(2)13-16-11-7-8-12-17(16)19-18(22)20(28)26(21-23-24-25-27(19)21)14-15-9-5-4-6-10-15/h4-12H,3,13-14H2,1-2H3	IYSGUMXLGINQIO-UHFFFAOYSA-N	371.174610342							108519
N-(3-Methoxyphenyl)-9H-purin-6-amine	LSM-43860	BRD-K06476085	670977	InChI=1S/C12H11N5O/c1-18-9-4-2-3-8(5-9)17-12-10-11(14-6-13-10)15-7-16-12/h2-7H,1H3,(H2,13,14,15,16,17)	AXPCHVXFDHPTBW-UHFFFAOYSA-N	COc1cccc(Nc2[nH]cnc3ncnc23)c1	BroadT	BRD-K06476085	BRD-K06476085-001-06-6	Life Chemicals Inc.	F0578-0013			COc1cccc(Nc2[nH]cnc3ncnc23)c1	InChI=1S/C12H11N5O/c1-18-9-4-2-3-8(5-9)17-12-10-11(14-6-13-10)15-7-16-12/h2-7H,1H3,(H2,13,14,15,16,17)	AXPCHVXFDHPTBW-UHFFFAOYSA-N	241.096360022							
6-Ethyl-2,7-dimethyl-pyrazolo[1,5-a]pyrimidin-5-ol	LSM-19896	SID846578, BRD-K39466210	648970	InChI=1S/C10H13N3O/c1-4-8-7(3)13-9(11-10(8)14)5-6(2)12-13/h5H,4H2,1-3H3,(H,11,14)	SSBOTAFCKSQJTL-UHFFFAOYSA-N	CCc1c(C)n2nc(C)cc2nc1O	BroadT	BRD-K39466210	BRD-K39466210-001-05-8	Asinex Ltd.	BAS 02058884			CCc1c(O)nc2cc(C)nn2c1C	InChI=1S/C10H13N3O/c1-4-8-7(3)13-9(11-10(8)14)5-6(2)12-13/h5H,4H2,1-3H3,(H,11,14)	SSBOTAFCKSQJTL-UHFFFAOYSA-N	191.105862066							
BAS 00411398	LSM-43861	SID22400540, BRD-K48965155	814510	InChI=1S/C12H12N4O2/c1-6-14-10-8-5-7(18-2)3-4-9(8)15-11(10)12(17)16(6)13/h3-5,17H,13H2,1-2H3	GMJZRHJZFOVUTH-UHFFFAOYSA-N	COc1ccc2nc3c(O)n(N)c(C)nc3c2c1	BroadT	BRD-K48965155	BRD-K48965155-001-06-3	InterBioScreen Ltd.	STOCK1S-05824			COc1ccc2nc3c(O)n(N)c(C)nc3c2c1	InChI=1S/C12H12N4O2/c1-6-14-10-8-5-7(18-2)3-4-9(8)15-11(10)12(17)16(6)13/h3-5,17H,13H2,1-2H3	GMJZRHJZFOVUTH-UHFFFAOYSA-N	244.096025664							
STK131458	LSM-19898	SID17432292, BRD-K51942399	1301900	InChI=1S/C18H19N3O3S/c1-3-16(22)21-18(25)20-14-8-6-13(7-9-14)19-17(23)12-4-10-15(24-2)11-5-12/h4-11H,3H2,1-2H3,(H,19,23)(H2,20,21,22,25)	PDVUQZUQFIWMBC-UHFFFAOYSA-N	CCC(=O)NC(=S)Nc1ccc(NC(=O)c2ccc(OC)cc2)cc1	BroadT	BRD-K51942399	BRD-K51942399-001-05-4	ChemBridge Corporation	7371824			CCC(=O)NC(=S)Nc1ccc(NC(=O)c2ccc(OC)cc2)cc1	InChI=1S/C18H19N3O3S/c1-3-16(22)21-18(25)20-14-8-6-13(7-9-14)19-17(23)12-4-10-15(24-2)11-5-12/h4-11H,3H2,1-2H3,(H,19,23)(H2,20,21,22,25)	PDVUQZUQFIWMBC-UHFFFAOYSA-N	357.114712188							108523
AC1MEZNN	LSM-15547	BRD-K43786846	2911519	InChI=1S/C29H36N2O2/c1-32-28-14-13-26(29(21-28)33-2)23-30-18-16-27(17-19-30)31(22-25-11-7-4-8-12-25)20-15-24-9-5-3-6-10-24/h3-14,21,27H,15-20,22-23H2,1-2H3	IOMRUVGLZCUFRT-UHFFFAOYSA-N	COc1ccc(CN2CCC(CC2)N(CCc3ccccc3)Cc4ccccc4)c(OC)c1	BroadT	BRD-K43786846	BRD-K43786846-034-07-2	ChemBridge Corporation	6713637		OC(=O)C(=O)O	COc1ccc(CN2CCC(CC2)N(CCc2ccccc2)Cc2ccccc2)c(OC)c1.OC(=O)C(=O)O	InChI=1S/C29H36N2O2.C2H2O4/c1-32-28-14-13-26(29(21-28)33-2)23-30-18-16-27(17-19-30)31(22-25-11-7-4-8-12-25)20-15-24-9-5-3-6-10-24;3-1(4)2(5)6/h3-14,21,27H,15-20,22-23H2,1-2H3;(H,3,4)(H,5,6)	NWYIXAKRNPCAMG-UHFFFAOYSA-N	444.277678412							104183, 104183
MLS000571112	LSM-19899	SID16952426, BRD-K80073320	2434904	InChI=1S/C17H23ClN2O5S/c1-2-3-8-19-16(21)12-25-17(22)13-6-7-14(18)15(11-13)26(23,24)20-9-4-5-10-20/h6-7,11H,2-5,8-10,12H2,1H3,(H,19,21)	BWBDYRRYPYVMET-UHFFFAOYSA-N	CCCCNC(=O)COC(=O)c1ccc(Cl)c(c1)S(=O)(=O)N2CCCC2	BroadT	BRD-K80073320	BRD-K80073320-001-05-7	Enamine Ltd.	T0516-3159			CCCCNC(=O)COC(=O)c1ccc(Cl)c(c1)S(=O)(=O)N1CCCC1	InChI=1S/C17H23ClN2O5S/c1-2-3-8-19-16(21)12-25-17(22)13-6-7-14(18)15(11-13)26(23,24)20-9-4-5-10-20/h6-7,11H,2-5,8-10,12H2,1H3,(H,19,21)	BWBDYRRYPYVMET-UHFFFAOYSA-N	402.101620256							108524
MLS000767675	LSM-43862	SID26666328, BRD-K12883524	1969925	InChI=1S/C22H25N3O3S/c1-27-18-10-7-17(8-11-18)9-12-21(26)23-22(29)25-15-13-24(14-16-25)19-5-3-4-6-20(19)28-2/h3-12H,13-16H2,1-2H3,(H,23,26,29)/b12-9+	ZGHUHJMSZAYUMP-FMIVXFBMSA-N	COc1ccc(\C=C\C(=O)NC(=S)N2CCN(CC2)c3ccccc3OC)cc1	BroadT	BRD-K12883524	BRD-K12883524-001-08-0	InterBioScreen Ltd.	STOCK3S-26900			COc1ccc(\C=C\C(=O)NC(=S)N2CCN(CC2)c2ccccc2OC)cc1	InChI=1S/C22H25N3O3S/c1-27-18-10-7-17(8-11-18)9-12-21(26)23-22(29)25-15-13-24(14-16-25)19-5-3-4-6-20(19)28-2/h3-12H,13-16H2,1-2H3,(H,23,26,29)/b12-9+	ZGHUHJMSZAYUMP-FMIVXFBMSA-N	411.16166238							
T0500-5081	LSM-19901	SID24829789, BRD-K60283369	4564792	InChI=1S/C15H13ClN2S/c16-13-6-7-15-17-14(9-18(15)8-13)11-19-10-12-4-2-1-3-5-12/h1-9H,10-11H2	LURIBFAGFFWGCY-UHFFFAOYSA-N	Clc1ccc2nc(CSCc3ccccc3)cn2c1	BroadT	BRD-K60283369	BRD-K60283369-001-06-6	Enamine Ltd.	T0500-5081			Clc1ccc2nc(CSCc3ccccc3)cn2c1	InChI=1S/C15H13ClN2S/c16-13-6-7-15-17-14(9-18(15)8-13)11-19-10-12-4-2-1-3-5-12/h1-9H,10-11H2	LURIBFAGFFWGCY-UHFFFAOYSA-N	288.048796836							108526
CID 78431534	LSM-19902	BRD-A75900990	78431534	InChI=1S/C22H19NO4/c1-3-27-22(26)17-12(2)23-20-15-6-4-5-7-16(15)21(25)19(20)18(17)13-8-10-14(24)11-9-13/h4-11,17-18,24H,3H2,1-2H3	MEPAHLUCTQLMPF-UHFFFAOYSA-N	CCOC(=O)C1C(C2=C(N=C1C)c3ccccc3C2=O)c4ccc(O)cc4	BroadT	BRD-A75900990	BRD-A75900990-001-05-9	Specs	AI-559/34388010			CCOC(=O)C1C(C2=C(N=C1C)c1ccccc1C2=O)c1ccc(O)cc1	InChI=1S/C22H19NO4/c1-3-27-22(26)17-12(2)23-20-15-6-4-5-7-16(15)21(25)19(20)18(17)13-8-10-14(24)11-9-13/h4-11,17-18,24H,3H2,1-2H3	MEPAHLUCTQLMPF-UHFFFAOYSA-N	361.131408098							108527
ST50636273	LSM-19903	SID4247525, BRD-K84884867	2987674	InChI=1S/C13H17F3N4O2/c1-3-22-12(21)20-6-4-19(5-7-20)11-17-9(2)8-10(18-11)13(14,15)16/h8H,3-7H2,1-2H3	YDQVMQZWOQRADZ-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)c2nc(C)cc(n2)C(F)(F)F	BroadT	BRD-K84884867	BRD-K84884867-001-05-2	ChemBridge Corporation	7997820			CCOC(=O)N1CCN(CC1)c1nc(C)cc(n1)C(F)(F)F	InChI=1S/C13H17F3N4O2/c1-3-22-12(21)20-6-4-19(5-7-20)11-17-9(2)8-10(18-11)13(14,15)16/h8H,3-7H2,1-2H3	YDQVMQZWOQRADZ-UHFFFAOYSA-N	318.130360424							108528
CID 78432896	LSM-19904	BRD-A39435053	78432896	InChI=1S/C16H17NO5/c1-8(2)22-14(19)12-9(3)17-16(21)11-7-5-4-6-10(11)13(18)15(12,16)20/h4-8,12,20-21H,1-3H3	BXMMJKHIFASTSL-UHFFFAOYSA-N	CC(C)OC(=O)C1C(=NC2(O)c3ccccc3C(=O)C12O)C	BroadT	BRD-A39435053	BRD-A39435053-001-06-3	Specs	AE-848/32310019			CC(C)OC(=O)C1C(C)=NC2(O)c3ccccc3C(=O)C12O	InChI=1S/C16H17NO5/c1-8(2)22-14(19)12-9(3)17-16(21)11-7-5-4-6-10(11)13(18)15(12,16)20/h4-8,12,20-21H,1-3H3	BXMMJKHIFASTSL-UHFFFAOYSA-N	303.110672654							108529
HMS2530E24	LSM-19905	BRD-K38697614	4403790	InChI=1S/C22H17FN4/c1-15-11-12-20-18(13-15)21(16-7-3-2-4-8-16)26-22(25-20)27-24-14-17-9-5-6-10-19(17)23/h2-14H,1H3,(H,25,26,27)	MCRHAWAHRVOUOI-UHFFFAOYSA-N	Cc1ccc2nc(NN=Cc3ccccc3F)nc(c4ccccc4)c2c1	BroadT	BRD-K38697614	BRD-K38697614-001-06-9	Enamine Ltd.	T0512-4333			Cc1ccc2nc(NN=Cc3ccccc3F)nc(-c3ccccc3)c2c1	InChI=1S/C22H17FN4/c1-15-11-12-20-18(13-15)21(16-7-3-2-4-8-16)26-22(25-20)27-24-14-17-9-5-6-10-19(17)23/h2-14H,1H3,(H,25,26,27)	MCRHAWAHRVOUOI-UHFFFAOYSA-N	356.143724784							108530
MLS000059218	LSM-19906	SID4259319, BRD-A20951169	2846250	InChI=1S/C16H20N2/c1-14(7-8-15-5-3-2-4-6-15)18-13-16-9-11-17-12-10-16/h2-6,9-12,14,18H,7-8,13H2,1H3	YISYWSYTOXIDOU-UHFFFAOYSA-N	CC(CCc1ccccc1)NCc2ccncc2	BroadT	BRD-A20951169	BRD-A20951169-001-05-3	ChemBridge Corporation	5452521			CC(CCc1ccccc1)NCc1ccncc1	InChI=1S/C16H20N2/c1-14(7-8-15-5-3-2-4-6-15)18-13-16-9-11-17-12-10-16/h2-6,9-12,14,18H,7-8,13H2,1H3	YISYWSYTOXIDOU-UHFFFAOYSA-N	240.16264866							131252
SMR000127892	LSM-19907	SID14737181, BRD-K73622825	9550949	InChI=1S/C24H29N3O3S/c1-2-30-24(29)26-12-10-20(11-13-26)25-23(28)19-8-9-22-21(16-19)27(14-15-31-22)17-18-6-4-3-5-7-18/h3-9,16,20H,2,10-15,17H2,1H3,(H,25,28)	OSANRKNXFPXRGW-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)NC(=O)c2ccc3SCCN(Cc4ccccc4)c3c2	BroadT	BRD-K73622825	BRD-K73622825-001-04-3	ChemDiv Inc.	C699-0006			CCOC(=O)N1CCC(CC1)NC(=O)c1ccc2SCCN(Cc3ccccc3)c2c1	InChI=1S/C24H29N3O3S/c1-2-30-24(29)26-12-10-20(11-13-26)25-23(28)19-8-9-22-21(16-19)27(14-15-31-22)17-18-6-4-3-5-7-18/h3-9,16,20H,2,10-15,17H2,1H3,(H,25,28)	OSANRKNXFPXRGW-UHFFFAOYSA-N	439.192962508							108533
AC1O9963	LSM-19908	SID17505092, SID87544547, BRD-K41233271	6751310	InChI=1S/C26H19N3O3/c30-23-15-19-11-5-4-10-18(19)14-21(23)25(31)28-27-24-20-12-6-7-13-22(20)29(26(24)32)16-17-8-2-1-3-9-17/h1-15,30,32H,16H2	ZWSBBYODLRMEQN-UHFFFAOYSA-N	Oc1cc2ccccc2cc1C(=O)N=Nc3c(O)n(Cc4ccccc4)c5ccccc35	BroadT	BRD-K41233271	BRD-K41233271-001-07-0	Asinex Ltd.	BAS 00347901			Oc1c(N=NC(=O)c2cc3ccccc3cc2O)c2ccccc2n1Cc1ccccc1	InChI=1S/C26H19N3O3/c30-23-15-19-11-5-4-10-18(19)14-21(23)25(31)28-27-24-20-12-6-7-13-22(20)29(26(24)32)16-17-8-2-1-3-9-17/h1-15,30,32H,16H2	ZWSBBYODLRMEQN-UHFFFAOYSA-N	421.142641498							
STK230083	LSM-19909	SID24809178, BRD-K06223907	5794660	InChI=1S/C11H8N2O2S/c1-2-7-16-11-13-12-10(15-11)8-3-5-9(14)6-4-8/h1,3-6,14H,7H2	IKMRSFJGBAQXLP-UHFFFAOYSA-N	Oc1ccc(cc1)c2oc(SCC#C)nn2	BroadT	BRD-K06223907	BRD-K06223907-001-06-8	Asinex Ltd.	BAS 10850547			Oc1ccc(cc1)-c1nnc(SCC#C)o1	InChI=1S/C11H8N2O2S/c1-2-7-16-11-13-12-10(15-11)8-3-5-9(14)6-4-8/h1,3-6,14H,7H2	IKMRSFJGBAQXLP-UHFFFAOYSA-N	232.030648206							
STK172000	LSM-19910	SID24792339, BRD-K64418292	1300084	InChI=1S/C21H22ClN3O2S/c1-15-3-5-18(13-16(15)2)28(26,27)25-11-9-24(10-12-25)21-7-8-23-20-14-17(22)4-6-19(20)21/h3-8,13-14H,9-12H2,1-2H3	FLHDNJGEUVKNGX-UHFFFAOYSA-N	Cc1ccc(cc1C)S(=O)(=O)N2CCN(CC2)c3ccnc4cc(Cl)ccc34	BroadT	BRD-K64418292	BRD-K64418292-001-05-8	ChemBridge Corporation	7885554			Cc1ccc(cc1C)S(=O)(=O)N1CCN(CC1)c1ccnc2cc(Cl)ccc12	InChI=1S/C21H22ClN3O2S/c1-15-3-5-18(13-16(15)2)28(26,27)25-11-9-24(10-12-25)21-7-8-23-20-14-17(22)4-6-19(20)21/h3-8,13-14H,9-12H2,1-2H3	FLHDNJGEUVKNGX-UHFFFAOYSA-N	415.112125374							108536
4-[(2,4-Dichlorophenoxy)methyl]-n-[2-(dimethylamino)ethyl]benzamide	LSM-19911	DNDI1417697, BRD-K62545744	2193355	InChI=1S/C18H20Cl2N2O2/c1-22(2)10-9-21-18(23)14-5-3-13(4-6-14)12-24-17-8-7-15(19)11-16(17)20/h3-8,11H,9-10,12H2,1-2H3,(H,21,23)	YLBHFMUBTMFLKO-UHFFFAOYSA-N	CN(C)CCNC(=O)c1ccc(COc2ccc(Cl)cc2Cl)cc1	BroadT	BRD-K62545744	BRD-K62545744-001-05-4	ChemBridge Corporation	7551581			CN(C)CCNC(=O)c1ccc(COc2ccc(Cl)cc2Cl)cc1	InChI=1S/C18H20Cl2N2O2/c1-22(2)10-9-21-18(23)14-5-3-13(4-6-14)12-24-17-8-7-15(19)11-16(17)20/h3-8,11H,9-10,12H2,1-2H3,(H,21,23)	YLBHFMUBTMFLKO-UHFFFAOYSA-N	366.09018332							108537
MLS000091077	LSM-19912	SID4247785, BRD-K25936235	3241951	InChI=1S/C18H18N2O/c1-14-13-16-9-5-6-10-17(16)20(14)12-11-19-18(21)15-7-3-2-4-8-15/h2-10,13H,11-12H2,1H3,(H,19,21)	SSYAUVNBEGNTHT-UHFFFAOYSA-N	Cc1cc2ccccc2n1CCNC(=O)c3ccccc3	BroadT	BRD-K25936235	BRD-K25936235-001-05-7	ChemDiv Inc.	C281-0146			Cc1cc2ccccc2n1CCNC(=O)c1ccccc1	InChI=1S/C18H18N2O/c1-14-13-16-9-5-6-10-17(16)20(14)12-11-19-18(21)15-7-3-2-4-8-15/h2-10,13H,11-12H2,1H3,(H,19,21)	SSYAUVNBEGNTHT-UHFFFAOYSA-N	278.141913216							108538
MLS000033384	LSM-19913	SID842461, BRD-K82965961	644726	InChI=1S/C20H21N5OS/c1-2-12-25-19(16-7-10-21-11-8-16)22-23-20(25)27-14-18(26)24-13-9-15-5-3-4-6-17(15)24/h3-8,10-11H,2,9,12-14H2,1H3	KIRHYNHMEYPUGZ-UHFFFAOYSA-N	CCCn1c(SCC(=O)N2CCc3ccccc23)nnc1c4ccncc4	BroadT	BRD-K82965961	BRD-K82965961-001-02-3	Asinex Ltd.	ASN 05939284			CCCn1c(SCC(=O)N2CCc3ccccc23)nnc1-c1ccncc1	InChI=1S/C20H21N5OS/c1-2-12-25-19(16-7-10-21-11-8-16)22-23-20(25)27-14-18(26)24-13-9-15-5-3-4-6-17(15)24/h3-8,10-11H,2,9,12-14H2,1H3	KIRHYNHMEYPUGZ-UHFFFAOYSA-N	379.146681032							108539
MLS000116835	LSM-19914	SID7967531, BRD-K25751806	5308867	InChI=1S/C23H25N3O4S/c1-30-20-9-3-2-6-19(20)16-25-23(27)18-11-14-26(15-12-18)31(28,29)21-10-4-7-17-8-5-13-24-22(17)21/h2-10,13,18H,11-12,14-16H2,1H3,(H,25,27)	PPOUFWVZSOTONG-UHFFFAOYSA-N	COc1ccccc1CNC(=O)C2CCN(CC2)S(=O)(=O)c3cccc4cccnc34	BroadT	BRD-K25751806	BRD-K25751806-001-04-2	ChemDiv Inc.	C375-0138			COc1ccccc1CNC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2cccnc12	InChI=1S/C23H25N3O4S/c1-30-20-9-3-2-6-19(20)16-25-23(27)18-11-14-26(15-12-18)31(28,29)21-10-4-7-17-8-5-13-24-22(17)21/h2-10,13,18H,11-12,14-16H2,1H3,(H,25,27)	PPOUFWVZSOTONG-UHFFFAOYSA-N	439.156577							108540
STK205311	LSM-19915	SID7975671, BRD-K88480566	2226678	InChI=1S/C15H18BrClN2O4/c1-2-22-15(21)19-7-5-18(6-8-19)14(20)10-23-13-4-3-11(16)9-12(13)17/h3-4,9H,2,5-8,10H2,1H3	FHXLTHHWLKREEX-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)COc2ccc(Br)cc2Cl	BroadT	BRD-K88480566	BRD-K88480566-001-05-9	ChemBridge Corporation	6634306			CCOC(=O)N1CCN(CC1)C(=O)COc1ccc(Br)cc1Cl	InChI=1S/C15H18BrClN2O4/c1-2-22-15(21)19-7-5-18(6-8-19)14(20)10-23-13-4-3-11(16)9-12(13)17/h3-4,9H,2,5-8,10H2,1H3	FHXLTHHWLKREEX-UHFFFAOYSA-N	404.013847386							108541
ZINC03347562	LSM-19916	SID24832118, BRD-K30251703	2464350	InChI=1S/C20H19N3O3/c1-3-14-15(4-2)23-17-9-12(5-7-16(17)22-14)20(24)21-13-6-8-18-19(10-13)26-11-25-18/h5-10H,3-4,11H2,1-2H3,(H,21,24)	AHNRKXJEHDLKTF-UHFFFAOYSA-N	CCc1nc2ccc(cc2nc1CC)C(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K30251703	BRD-K30251703-001-06-5	Enamine Ltd.	T5319826			CCc1nc2ccc(cc2nc1CC)C(=O)Nc1ccc2OCOc2c1	InChI=1S/C20H19N3O3/c1-3-14-15(4-2)23-17-9-12(5-7-16(17)22-14)20(24)21-13-6-8-18-19(10-13)26-11-25-18/h5-10H,3-4,11H2,1-2H3,(H,21,24)	AHNRKXJEHDLKTF-UHFFFAOYSA-N	349.142641498							108542
SMR000093449	LSM-19917	SID7967474, BRD-K29098242	790705	InChI=1S/C14H15N3O2/c1-10-4-3-5-13(15-10)17-14(18)16-11-6-8-12(19-2)9-7-11/h3-9H,1-2H3,(H2,15,16,17,18)	KRKHHVFLJIIDQL-UHFFFAOYSA-N	COc1ccc(NC(=O)Nc2cccc(C)n2)cc1	BroadT	BRD-K29098242	BRD-K29098242-001-04-6	ChemDiv Inc.	C270-0282			COc1ccc(NC(=O)Nc2cccc(C)n2)cc1	InChI=1S/C14H15N3O2/c1-10-4-3-5-13(15-10)17-14(18)16-11-6-8-12(19-2)9-7-11/h3-9H,1-2H3,(H2,15,16,17,18)	KRKHHVFLJIIDQL-UHFFFAOYSA-N	257.11642675							108543
4M-529S	LSM-19918	BRD-A07531474	1476806	InChI=1S/C13H13ClN2O2S/c1-9-15-11(8-18-2)7-13(16-9)19(17)12-5-3-10(14)4-6-12/h3-7H,8H2,1-2H3	ADJIMOHBRADXIH-UHFFFAOYSA-N	COCc1cc(nc(C)n1)S(=O)c2ccc(Cl)cc2	BroadT	BRD-A07531474	BRD-A07531474-001-05-0	Key Organics Ltd.	4M-529S			COCc1cc(nc(C)n1)S(=O)c1ccc(Cl)cc1	InChI=1S/C13H13ClN2O2S/c1-9-15-11(8-18-2)7-13(16-9)19(17)12-5-3-10(14)4-6-12/h3-7H,8H2,1-2H3	ADJIMOHBRADXIH-UHFFFAOYSA-N	296.038626076							108544
Thiocetamol	LSM-19919	SID7976114, BRD-K59554004	128894	InChI=1S/C13H11NO3S/c1-9(15)14-10-4-6-11(7-5-10)17-13(16)12-3-2-8-18-12/h2-8H,1H3,(H,14,15)	FGNYPSLGEUCLPH-UHFFFAOYSA-N	CC(=O)Nc1ccc(OC(=O)c2cccs2)cc1	BroadT	BRD-K59554004	BRD-K59554004-001-05-6	ChemBridge Corporation	5336145			CC(=O)Nc1ccc(OC(=O)c2cccs2)cc1	InChI=1S/C13H11NO3S/c1-9(15)14-10-4-6-11(7-5-10)17-13(16)12-3-2-8-18-12/h2-8H,1H3,(H,14,15)	FGNYPSLGEUCLPH-UHFFFAOYSA-N	261.045963912							108545
AC1LWIUI	LSM-19920	SID47201253, BRD-K07524913	54680123	InChI=1S/C20H21N3O3/c1-2-3-12-23-16-11-7-4-8-13(16)18(24)17(20(23)26)19(25)22-15-10-6-5-9-14(15)21/h4-11,24H,2-3,12,21H2,1H3,(H,22,25)	ZWENHLHARKXUOW-UHFFFAOYSA-N	CCCCN1C(=O)C(=C(O)c2ccccc12)C(=O)Nc3ccccc3N	BroadT	BRD-K07524913	BRD-K07524913-001-05-2	Asinex Ltd.	BAS 00141357			CCCCn1c2ccccc2c(O)c(C(=O)Nc2ccccc2N)c1=O	InChI=1S/C20H21N3O3/c1-2-3-12-23-16-11-7-4-8-13(16)18(24)17(20(23)26)19(25)22-15-10-6-5-9-14(15)21/h4-11,24H,2-3,12,21H2,1H3,(H,22,25)	ZWENHLHARKXUOW-UHFFFAOYSA-N	351.158291562							108546
MLS000561186	LSM-19921	SID26659895, BRD-A69756736	16681990	InChI=1S/C19H14F6N2O2/c20-18(21,22)13-7-5-11(6-8-13)15-9-16(29-27-15)17(28)26-10-12-3-1-2-4-14(12)19(23,24)25/h1-8,16H,9-10H2,(H,26,28)	JPZOTGNIUZTQCM-UHFFFAOYSA-N	FC(F)(F)c1ccc(cc1)C2=NOC(C2)C(=O)NCc3ccccc3C(F)(F)F	BroadT	BRD-A69756736	BRD-A69756736-001-07-8	University of California at Davis	UCD-MRJ-1-191			FC(F)(F)c1ccc(cc1)C1=NOC(C1)C(=O)NCc1ccccc1C(F)(F)F	InChI=1S/C19H14F6N2O2/c20-18(21,22)13-7-5-11(6-8-13)15-9-16(29-27-15)17(28)26-10-12-3-1-2-4-14(12)19(23,24)25/h1-8,16H,9-10H2,(H,26,28)	JPZOTGNIUZTQCM-UHFFFAOYSA-N	416.095946908							108547
MLS000537224	LSM-19922	SID17386900, BRD-K18860759	1006298	InChI=1S/C22H15F4N3OS/c23-15-8-4-5-9-16(15)29-20(30)19-18(27)17-14(22(24,25)26)11-13(28-21(17)31-19)10-12-6-2-1-3-7-12/h1-9,11H,10,27H2,(H,29,30)	BLZICZKXDZKEKR-UHFFFAOYSA-N	Nc1c(sc2nc(Cc3ccccc3)cc(c12)C(F)(F)F)C(=O)Nc4ccccc4F	BroadT	BRD-K18860759	BRD-K18860759-001-08-8	Specs	AM-807/42860070			Nc1c(sc2nc(Cc3ccccc3)cc(c12)C(F)(F)F)C(=O)Nc1ccccc1F	InChI=1S/C22H15F4N3OS/c23-15-8-4-5-9-16(15)29-20(30)19-18(27)17-14(22(24,25)26)11-13(28-21(17)31-19)10-12-6-2-1-3-7-12/h1-9,11H,10,27H2,(H,29,30)	BLZICZKXDZKEKR-UHFFFAOYSA-N	445.08719562							108548
2-Chloro-n-phenethyl-benzamide	LSM-19923	SID49643542, BRD-K74221467	692233	InChI=1S/C15H14ClNO/c16-14-9-5-4-8-13(14)15(18)17-11-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,18)	PLSUZSSOFMKWLH-UHFFFAOYSA-N	Clc1ccccc1C(=O)NCCc2ccccc2	BroadT	BRD-K74221467	BRD-K74221467-001-05-3	Asinex Ltd.	BAS 01058108			Clc1ccccc1C(=O)NCCc1ccccc1	InChI=1S/C15H14ClNO/c16-14-9-5-4-8-13(14)15(18)17-11-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,18)	PLSUZSSOFMKWLH-UHFFFAOYSA-N	259.076391788							108549
2-(3-Fluoro-phenyl)-5-methyl-7-morpholin-4-yl-pyrazolo[1,5-a]pyrimidine	LSM-19924	SID847068, BRD-K53002688	649462	InChI=1S/C17H17FN4O/c1-12-9-17(21-5-7-23-8-6-21)22-16(19-12)11-15(20-22)13-3-2-4-14(18)10-13/h2-4,9-11H,5-8H2,1H3	ANDWDBBSDJPBJE-UHFFFAOYSA-N	Cc1cc(N2CCOCC2)n3nc(cc3n1)c4cccc(F)c4	BroadT	BRD-K53002688	BRD-K53002688-001-05-5	Asinex Ltd.	ASN 07273842			Cc1cc(N2CCOCC2)n2nc(cc2n1)-c1cccc(F)c1	InChI=1S/C17H17FN4O/c1-12-9-17(21-5-7-23-8-6-21)22-16(19-12)11-15(20-22)13-3-2-4-14(18)10-13/h2-4,9-11H,5-8H2,1H3	ANDWDBBSDJPBJE-UHFFFAOYSA-N	312.138639404							108550
MLS000388774	LSM-19925	SID22408739, BRD-K61250257	2564901	InChI=1S/C22H17F2NO3/c23-18-7-1-15(2-8-18)13-25-21(26)14-28-20-11-5-17(6-12-20)22(27)16-3-9-19(24)10-4-16/h1-12H,13-14H2,(H,25,26)	RXJOOSRKNDQMBU-UHFFFAOYSA-N	Fc1ccc(CNC(=O)COc2ccc(cc2)C(=O)c3ccc(F)cc3)cc1	BroadT	BRD-K61250257	BRD-K61250257-001-05-1	Enamine Ltd.	ZT-1895667			Fc1ccc(CNC(=O)COc2ccc(cc2)C(=O)c2ccc(F)cc2)cc1	InChI=1S/C22H17F2NO3/c23-18-7-1-15(2-8-18)13-25-21(26)14-28-20-11-5-17(6-12-20)22(27)16-3-9-19(24)10-4-16/h1-12H,13-14H2,(H,25,26)	RXJOOSRKNDQMBU-UHFFFAOYSA-N	381.117649814							108551
STK847102	LSM-19926	SID7975861, BRD-K56060238	1606660	InChI=1S/C16H21N3O3S2/c20-8-3-7-17-12(21)6-2-9-23-16-18-14(22)13-10-4-1-5-11(10)24-15(13)19-16/h20H,1-9H2,(H,17,21)(H,18,19,22)	KJHZCXRCOSUQKQ-UHFFFAOYSA-N	OCCCNC(=O)CCCSc1nc(O)c2c3CCCc3sc2n1	BroadT	BRD-K56060238	BRD-K56060238-001-05-5	ChemBridge Corporation	6944460			OCCCNC(=O)CCCSc1nc(O)c2c3CCCc3sc2n1	InChI=1S/C16H21N3O3S2/c20-8-3-7-17-12(21)6-2-9-23-16-18-14(22)13-10-4-1-5-11(10)24-15(13)19-16/h20H,1-9H2,(H,17,21)(H,18,19,22)	KJHZCXRCOSUQKQ-UHFFFAOYSA-N	367.102432942							108552
AC1O9ZGL	LSM-19927	SID22401803, BRD-K23337016	6741936	InChI=1S/C16H13FN4OS/c17-11-7-5-10(6-8-11)9-21-13-4-2-1-3-12(13)14(15(21)22)19-20-16(18)23/h1-8,22H,9H2,(H2,18,23)	JLJNYCOTJDVCSB-UHFFFAOYSA-N	NC(=S)N=Nc1c(O)n(Cc2ccc(F)cc2)c3ccccc13	BroadT	BRD-K23337016	BRD-K23337016-001-05-5	InterBioScreen Ltd.	STOCK1S-30945			NC(=S)N=Nc1c(O)n(Cc2ccc(F)cc2)c2ccccc12	InChI=1S/C16H13FN4OS/c17-11-7-5-10(6-8-11)9-21-13-4-2-1-3-12(13)14(15(21)22)19-20-16(18)23/h1-8,22H,9H2,(H2,18,23)	JLJNYCOTJDVCSB-UHFFFAOYSA-N	328.079409966							
MLS000565888	LSM-19928	SID17388455, SID57309171, SID89852363, BRD-K67566330	2102207	InChI=1S/C20H18N4O3S3/c1-2-24-18(11-29-20-21-13-5-3-4-6-17(13)30-20)22-23-19(24)28-10-16(27)12-7-8-14(25)15(26)9-12/h3-9,25-26H,2,10-11H2,1H3	APBXJKZUYAAVJS-UHFFFAOYSA-N	CCn1c(CSc2nc3ccccc3s2)nnc1SCC(=O)c4ccc(O)c(O)c4	BroadT	BRD-K67566330	BRD-K67566330-001-06-3	Enamine Ltd.	T5235502			CCn1c(CSc2nc3ccccc3s2)nnc1SCC(=O)c1ccc(O)c(O)c1	InChI=1S/C20H18N4O3S3/c1-2-24-18(11-29-20-21-13-5-3-4-6-17(13)30-20)22-23-19(24)28-10-16(27)12-7-8-14(25)15(26)9-12/h3-9,25-26H,2,10-11H2,1H3	APBXJKZUYAAVJS-UHFFFAOYSA-N	458.054102546							108554
N-(3,4-Dihydro-1H-[1,4]thiazino[4,3-a]benzimidazol-8-yl)butanamide	LSM-19929	SID865263, BRD-K69690115	666517	InChI=1S/C14H17N3OS/c1-2-3-14(18)15-10-4-5-12-11(8-10)16-13-9-19-7-6-17(12)13/h4-5,8H,2-3,6-7,9H2,1H3,(H,15,18)	VDRCQFSWVHTUKQ-UHFFFAOYSA-N	CCCC(=O)Nc1ccc2c(c1)nc3CSCCn23	BroadT	BRD-K69690115	BRD-K69690115-001-05-2	InterBioScreen Ltd.	STOCK5S-41686			CCCC(=O)Nc1ccc2n3CCSCc3nc2c1	InChI=1S/C14H17N3OS/c1-2-3-14(18)15-10-4-5-12-11(8-10)16-13-9-19-7-6-17(12)13/h4-5,8H,2-3,6-7,9H2,1H3,(H,15,18)	VDRCQFSWVHTUKQ-UHFFFAOYSA-N	275.109232884							108555
SMR000039720	LSM-19930	SID857391, BRD-K07593260	658736	InChI=1S/C19H22N2O5S/c1-13-4-6-16(7-5-13)27(23,24)20-19(22)21-9-8-14-10-17(25-2)18(26-3)11-15(14)12-21/h4-7,10-11H,8-9,12H2,1-3H3,(H,20,22)	PWSGCDSECYVGNV-UHFFFAOYSA-N	COc1cc2CCN(Cc2cc1OC)C(=O)NS(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K07593260	BRD-K07593260-001-05-6	InterBioScreen Ltd.	STOCK1S-66567			COc1cc2CCN(Cc2cc1OC)C(=O)NS(=O)(=O)c1ccc(C)cc1	InChI=1S/C19H22N2O5S/c1-13-4-6-16(7-5-13)27(23,24)20-19(22)21-9-8-14-10-17(25-2)18(26-3)11-15(14)12-21/h4-7,10-11H,8-9,12H2,1-3H3,(H,20,22)	PWSGCDSECYVGNV-UHFFFAOYSA-N	390.124942514							108556
T0508-4933	LSM-19931	SID3717780, BRD-K27987544	2351114	InChI=1S/C20H28N2O3/c23-19(15-25-20(24)16-7-3-1-4-8-16)21-17-9-11-18(12-10-17)22-13-5-2-6-14-22/h9-12,16H,1-8,13-15H2,(H,21,23)	VIGALXYLSBVOPL-UHFFFAOYSA-N	O=C(COC(=O)C1CCCCC1)Nc2ccc(cc2)N3CCCCC3	BroadT	BRD-K27987544	BRD-K27987544-001-05-4	Enamine Ltd.	T0508-4933			O=C(COC(=O)C1CCCCC1)Nc1ccc(cc1)N1CCCCC1	InChI=1S/C20H28N2O3/c23-19(15-25-20(24)16-7-3-1-4-8-16)21-17-9-11-18(12-10-17)22-13-5-2-6-14-22/h9-12,16H,1-8,13-15H2,(H,21,23)	VIGALXYLSBVOPL-UHFFFAOYSA-N	344.209992776							108557
MLS000686133	LSM-15298	BRD-K97508419	16194867	InChI=1S/C19H22BrN3OS2/c1-12-6-7-14-17(13(12)2)21-19(26-14)23(11-5-10-22(3)4)18(24)15-8-9-16(20)25-15/h6-9H,5,10-11H2,1-4H3	OQRUBFMHLUDBBU-UHFFFAOYSA-N	CN(C)CCCN(C(=O)c1ccc(Br)s1)c2nc3c(C)c(C)ccc3s2	BroadT	BRD-K97508419	BRD-K97508419-003-05-1	Life Chemicals Inc.	F2019-2072		Cl	CN(C)CCCN(C(=O)c1ccc(Br)s1)c1nc2c(C)c(C)ccc2s1.Cl	InChI=1S/C19H22BrN3OS2.ClH/c1-12-6-7-14-17(13(12)2)21-19(26-14)23(11-5-10-22(3)4)18(24)15-8-9-16(20)25-15;/h6-9H,5,10-11H2,1-4H3;1H	NZPHDGJKYCKSCY-UHFFFAOYSA-N	451.038766334							103945, 103945
N-(4-(((5-((4-(Acetylamino)phenyl)sulfonyl)(2,5-thiazolidinylidene))azamethyl)sulfonyl)phenyl)ethanamide	LSM-19932	BRD-K97039393	3241855	InChI=1S/C19H20N4O6S3/c1-13(24)20-15-3-7-17(8-4-15)31(26,27)22-19-23(11-12-30-19)32(28,29)18-9-5-16(6-10-18)21-14(2)25/h3-10H,11-12H2,1-2H3,(H,20,24)(H,21,25)	PMKMZCUWOMVQBX-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)S(=O)(=O)N=C2SCCN2S(=O)(=O)c3ccc(NC(=O)C)cc3	BroadT	BRD-K97039393	BRD-K97039393-001-05-1	ChemDiv Inc.	5211-0003			CC(=O)Nc1ccc(cc1)S(=O)(=O)N=C1SCCN1S(=O)(=O)c1ccc(NC(C)=O)cc1	InChI=1S/C19H20N4O6S3/c1-13(24)20-15-3-7-17(8-4-15)31(26,27)22-19-23(11-12-30-19)32(28,29)18-9-5-16(6-10-18)21-14(2)25/h3-10H,11-12H2,1-2H3,(H,20,24)(H,21,25)	PMKMZCUWOMVQBX-UHFFFAOYSA-N	496.05449647							108558
T0512-6347	LSM-43863	SID22406604, BRD-K98531780	2361818	InChI=1S/C18H16N2OS/c1-13-4-3-5-16(10-13)20-18(21)15(12-19)11-14-6-8-17(22-2)9-7-14/h3-11H,1-2H3,(H,20,21)/b15-11+	YYQVQZHCKQIBBF-RVDMUPIBSA-N	CSc1ccc(\C=C(/C#N)\C(=O)Nc2cccc(C)c2)cc1	BroadT	BRD-K98531780	BRD-K98531780-001-05-7	Enamine Ltd.	T0512-6347			CSc1ccc(cc1)\C=C(/C#N)C(=O)Nc1cccc(C)c1	InChI=1S/C18H16N2OS/c1-13-4-3-5-16(10-13)20-18(21)15(12-19)11-14-6-8-17(22-2)9-7-14/h3-11H,1-2H3,(H,20,21)/b15-11+	YYQVQZHCKQIBBF-RVDMUPIBSA-N	308.098333842							
MLS000573486	LSM-19934	SID17431819, BRD-K99661296	2282573	InChI=1S/C16H22N2O3S2/c1-4-18(5-2)16(22)23-11-10-14(19)17-15(20)21-13-8-6-12(3)7-9-13/h6-9H,4-5,10-11H2,1-3H3,(H,17,19,20)	OBDCJJZZJUNMCZ-UHFFFAOYSA-N	CCN(CC)C(=S)SCCC(=O)NC(=O)Oc1ccc(C)cc1	BroadT	BRD-K99661296	BRD-K99661296-001-05-8	ChemBridge Corporation	6429429			CCN(CC)C(=S)SCCC(=O)NC(=O)Oc1ccc(C)cc1	InChI=1S/C16H22N2O3S2/c1-4-18(5-2)16(22)23-11-10-14(19)17-15(20)21-13-8-6-12(3)7-9-13/h6-9H,4-5,10-11H2,1-3H3,(H,17,19,20)	OBDCJJZZJUNMCZ-UHFFFAOYSA-N	354.107183964							108560
MLS000045631	LSM-19935	SID4249019, BRD-A67824061	3243025	InChI=1S/C11H8F3NO4/c1-6(16)18-10(11(12,13)14)9(17)15-7-4-2-3-5-8(7)19-10/h2-5H,1H3,(H,15,17)	HMXHWXUBXOQENS-UHFFFAOYSA-N	CC(=O)OC1(Oc2ccccc2NC1=O)C(F)(F)F	BroadT	BRD-A67824061	BRD-A67824061-001-05-5	ChemDiv Inc.	8013-3046			CC(=O)OC1(Oc2ccccc2NC1=O)C(F)(F)F	InChI=1S/C11H8F3NO4/c1-6(16)18-10(11(12,13)14)9(17)15-7-4-2-3-5-8(7)19-10/h2-5H,1H3,(H,15,17)	HMXHWXUBXOQENS-UHFFFAOYSA-N	275.040542346							108561
T5285919	LSM-19936	SID22403662, BRD-A82925153	3304642	InChI=1S/C18H17N5O4S2/c19-16(24)11-5-6-14(13(9-11)23(25)26)29-18-21-20-17(15-4-2-8-28-15)22(18)10-12-3-1-7-27-12/h2,4-6,8-9,12H,1,3,7,10H2,(H2,19,24)	PDZHTLVMZXEBHV-UHFFFAOYSA-N	NC(=O)c1ccc(Sc2nnc(c3cccs3)n2CC4CCCO4)c(c1)[N+](=O)[O-]	BroadT	BRD-A82925153	BRD-A82925153-001-05-0	Enamine Ltd.	T5285919			NC(=O)c1ccc(Sc2nnc(-c3cccs3)n2CC2CCCO2)c(c1)[N+]([O-])=O	InChI=1S/C18H17N5O4S2/c19-16(24)11-5-6-14(13(9-11)23(25)26)29-18-21-20-17(15-4-2-8-28-15)22(18)10-12-3-1-7-27-12/h2,4-6,8-9,12H,1,3,7,10H2,(H2,19,24)	PDZHTLVMZXEBHV-UHFFFAOYSA-N	431.072195454							108562
SMR000019052	LSM-19937	SID4248410, BRD-K92404381	3242485	InChI=1S/C15H15NO2/c1-10-4-6-13(8-11(10)2)15(17)18-14-7-5-12(3)16-9-14/h4-9H,1-3H3	HDRSXOPTXZMKCM-UHFFFAOYSA-N	Cc1ccc(OC(=O)c2ccc(C)c(C)c2)cn1	BroadT	BRD-K92404381	BRD-K92404381-001-06-4	ChemDiv Inc.	0435-5674			Cc1ccc(OC(=O)c2ccc(C)c(C)c2)cn1	InChI=1S/C15H15NO2/c1-10-4-6-13(8-11(10)2)15(17)18-14-7-5-12(3)16-9-14/h4-9H,1-3H3	HDRSXOPTXZMKCM-UHFFFAOYSA-N	241.11027873							108563
AG-670/40727766	LSM-19938	SID17406798, BRD-K16503458	1718168	InChI=1S/C18H26ClN3OS/c1-2-3-5-8-17(23)21-18(24)20-14-9-10-16(15(19)13-14)22-11-6-4-7-12-22/h9-10,13H,2-8,11-12H2,1H3,(H2,20,21,23,24)	PCTYBBRBVZHYJH-UHFFFAOYSA-N	CCCCCC(=O)NC(=S)Nc1ccc(N2CCCCC2)c(Cl)c1	BroadT	BRD-K16503458	BRD-K16503458-001-05-6	Specs	AG-670/40727766			CCCCCC(=O)NC(=S)Nc1ccc(N2CCCCC2)c(Cl)c1	InChI=1S/C18H26ClN3OS/c1-2-3-5-8-17(23)21-18(24)20-14-9-10-16(15(19)13-14)22-11-6-4-7-12-22/h9-10,13H,2-8,11-12H2,1H3,(H2,20,21,23,24)	PCTYBBRBVZHYJH-UHFFFAOYSA-N	367.148510882							108564
2-(2,5-Dimethylphenyl)-1-hydrazinecarbothioamide	LSM-19939	SID24824466, BRD-K01655314	3818657	InChI=1S/C9H13N3S/c1-6-3-4-7(2)8(5-6)11-12-9(10)13/h3-5,11H,1-2H3,(H3,10,12,13)	IXOJKRFUDRHUCH-UHFFFAOYSA-N	Cc1ccc(C)c(NN=C(N)S)c1	BroadT	BRD-K01655314	BRD-K01655314-001-05-5	Key Organics Ltd.	2P-058			Cc1ccc(C)c(NN=C(N)S)c1	InChI=1S/C9H13N3S/c1-6-3-4-7(2)8(5-6)11-12-9(10)13/h3-5,11H,1-2H3,(H3,10,12,13)	IXOJKRFUDRHUCH-UHFFFAOYSA-N	195.083018136							108565
SMR000019084	LSM-19940	SID4245714, BRD-K93343630	3240153	InChI=1S/C18H14N2O5/c21-16(14-10-12-4-1-2-6-15(12)25-18(14)23)20-8-9-24-17(22)13-5-3-7-19-11-13/h1-7,10-11H,8-9H2,(H,20,21)	SGOGZSWIKKLGQT-UHFFFAOYSA-N	O=C(NCCOC(=O)c1cccnc1)C2=Cc3ccccc3OC2=O	BroadT	BRD-K93343630	BRD-K93343630-001-06-2	ChemDiv Inc.	0672-0369			O=C(NCCOC(=O)c1cccnc1)c1cc2ccccc2oc1=O	InChI=1S/C18H14N2O5/c21-16(14-10-12-4-1-2-6-15(12)25-18(14)23)20-8-9-24-17(22)13-5-3-7-19-11-13/h1-7,10-11H,8-9H2,(H,20,21)	SGOGZSWIKKLGQT-UHFFFAOYSA-N	338.090271568							108566
MLS000109451	LSM-19941	SID7978164, BRD-K79320680	878057	InChI=1S/C19H16N2O4/c1-2-24-19(23)14-7-5-13(6-8-14)16-9-10-17(25-16)18(22)21-15-4-3-11-20-12-15/h3-12H,2H2,1H3,(H,21,22)	XDOSFNFEPZZWKS-UHFFFAOYSA-N	CCOC(=O)c1ccc(cc1)c2oc(cc2)C(=O)Nc3cccnc3	BroadT	BRD-K79320680	BRD-K79320680-001-05-9	ChemBridge Corporation	6005612			CCOC(=O)c1ccc(cc1)-c1ccc(o1)C(=O)Nc1cccnc1	InChI=1S/C19H16N2O4/c1-2-24-19(23)14-7-5-13(6-8-14)16-9-10-17(25-16)18(22)21-15-4-3-11-20-12-15/h3-12H,2H2,1H3,(H,21,22)	XDOSFNFEPZZWKS-UHFFFAOYSA-N	336.111007012							108567
N-(4-Bromo-2,6-dimethylphenyl)-2-methoxybenzamide	LSM-19942	SID24787863, BRD-K84866940	1494474	InChI=1S/C16H16BrNO2/c1-10-8-12(17)9-11(2)15(10)18-16(19)13-6-4-5-7-14(13)20-3/h4-9H,1-3H3,(H,18,19)	MBAWOCYLSWCWEY-UHFFFAOYSA-N	COc1ccccc1C(=O)Nc2c(C)cc(Br)cc2C	BroadT	BRD-K84866940	BRD-K84866940-001-05-0	ChemBridge Corporation	6386425			COc1ccccc1C(=O)Nc1c(C)cc(Br)cc1C	InChI=1S/C16H16BrNO2/c1-10-8-12(17)9-11(2)15(10)18-16(19)13-6-4-5-7-14(13)20-3/h4-9H,1-3H3,(H,18,19)	MBAWOCYLSWCWEY-UHFFFAOYSA-N	333.036441362							108568
3-(4-Bromophenyl)-5-(3,5-dimethoxyphenyl)-1,2,4-oxadiazole	LSM-19943	SID7976631, BRD-K76072018	1324642	InChI=1S/C16H13BrN2O3/c1-20-13-7-11(8-14(9-13)21-2)16-18-15(19-22-16)10-3-5-12(17)6-4-10/h3-9H,1-2H3	KFRRTXRVGFPNFT-UHFFFAOYSA-N	COc1cc(OC)cc(c1)c2onc(n2)c3ccc(Br)cc3	BroadT	BRD-K76072018	BRD-K76072018-001-05-2	ChemBridge Corporation	6722657			COc1cc(OC)cc(c1)-c1nc(no1)-c1ccc(Br)cc1	InChI=1S/C16H13BrN2O3/c1-20-13-7-11(8-14(9-13)21-2)16-18-15(19-22-16)10-3-5-12(17)6-4-10/h3-9H,1-2H3	KFRRTXRVGFPNFT-UHFFFAOYSA-N	360.010954896							108569
MLS000566632	LSM-19944	SID14744253, BRD-K26424592	2504736	InChI=1S/C13H10ClN3OS2/c1-8-6-19-13(15-8)20-7-11-16-17-12(18-11)9-2-4-10(14)5-3-9/h2-6H,7H2,1H3	BJHXSUFEIRNGIZ-UHFFFAOYSA-N	Cc1csc(SCc2oc(nn2)c3ccc(Cl)cc3)n1	BroadT	BRD-K26424592	BRD-K26424592-001-05-0	Enamine Ltd.	T5321932			Cc1csc(SCc2nnc(o2)-c2ccc(Cl)cc2)n1	InChI=1S/C13H10ClN3OS2/c1-8-6-19-13(15-8)20-7-11-16-17-12(18-11)9-2-4-10(14)5-3-9/h2-6H,7H2,1H3	BJHXSUFEIRNGIZ-UHFFFAOYSA-N	322.99538106							108570
Ethyl 6-bromo-5-hydroxy-2-methyl-1H-indole-3-carboxylate	LSM-19945	SID4255552, BRD-K99250163	700285	InChI=1S/C12H12BrNO3/c1-3-17-12(16)11-6(2)14-9-5-8(13)10(15)4-7(9)11/h4-5,14-15H,3H2,1-2H3	IHGRXBMSSFFTJL-UHFFFAOYSA-N	CCOC(=O)c1c(C)[nH]c2cc(Br)c(O)cc12	BroadT	BRD-K99250163	BRD-K99250163-001-05-0	ChemBridge Corporation	5100374			CCOC(=O)c1c(C)[nH]c2cc(Br)c(O)cc12	InChI=1S/C12H12BrNO3/c1-3-17-12(16)11-6(2)14-9-5-8(13)10(15)4-7(9)11/h4-5,14-15H,3H2,1-2H3	IHGRXBMSSFFTJL-UHFFFAOYSA-N	297.000055854							108571
AG-690/37123083	LSM-19946	SID49642981, BRD-K56862573	725666	InChI=1S/C17H15NO2/c1-11-7-8-12(2)14(9-11)18-17(19)16-10-13-5-3-4-6-15(13)20-16/h3-10H,1-2H3,(H,18,19)	JEVRZUCUEYZTOY-UHFFFAOYSA-N	Cc1ccc(C)c(NC(=O)c2oc3ccccc3c2)c1	BroadT	BRD-K56862573	BRD-K56862573-001-05-7	Asinex Ltd.	BAS 00713068			Cc1ccc(C)c(NC(=O)c2cc3ccccc3o2)c1	InChI=1S/C17H15NO2/c1-11-7-8-12(2)14(9-11)18-17(19)16-10-13-5-3-4-6-15(13)20-16/h3-10H,1-2H3,(H,18,19)	JEVRZUCUEYZTOY-UHFFFAOYSA-N	265.11027873							108572
MLS000696684	LSM-15299	BRD-K97064206	12006030	InChI=1S/C23H26ClN3OS/c1-26(2)12-5-13-27(23-25-20-11-10-19(24)15-21(20)29-23)22(28)18-9-8-16-6-3-4-7-17(16)14-18/h8-11,14-15H,3-7,12-13H2,1-2H3	QRLKDFRBQFZOLB-UHFFFAOYSA-N	CN(C)CCCN(C(=O)c1ccc2CCCCc2c1)c3nc4ccc(Cl)cc4s3	BroadT	BRD-K97064206	BRD-K97064206-003-05-2	Life Chemicals Inc.	F2019-0590		Cl	CN(C)CCCN(C(=O)c1ccc2CCCCc2c1)c1nc2ccc(Cl)cc2s1.Cl	InChI=1S/C23H26ClN3OS.ClH/c1-26(2)12-5-13-27(23-25-20-11-10-19(24)15-21(20)29-23)22(28)18-9-8-16-6-3-4-7-17(16)14-18;/h8-11,14-15H,3-7,12-13H2,1-2H3;1H	SAFJORWRJKAQBU-UHFFFAOYSA-N	427.148510882							103946, 103946
MLS000936883	LSM-19947	SID24268285, SID49715628, BRD-A99639428	15988137	InChI=1S/C23H23N5O3S/c1-14-6-5-11-27(13-14)20(29)15-9-10-16-18(12-15)25-23-28(21(16)30)26-22(32-23)24-17-7-3-4-8-19(17)31-2/h3-4,7-10,12,14H,5-6,11,13H2,1-2H3,(H,24,26)	KAODUXUKZKDUMM-UHFFFAOYSA-N	COc1ccccc1NC2=NN3C(=Nc4cc(ccc4C3=O)C(=O)N5CCCC(C)C5)S2	BroadT	BRD-A99639428	BRD-A99639428-001-05-7	ChemDiv Inc.	C200-3237			COc1ccccc1Nc1nn2c(nc3cc(ccc3c2=O)C(=O)N2CCCC(C)C2)s1	InChI=1S/C23H23N5O3S/c1-14-6-5-11-27(13-14)20(29)15-9-10-16-18(12-15)25-23-28(21(16)30)26-22(32-23)24-17-7-3-4-8-19(17)31-2/h3-4,7-10,12,14H,5-6,11,13H2,1-2H3,(H,24,26)	KAODUXUKZKDUMM-UHFFFAOYSA-N	449.152160336							108573
T0511-4897	LSM-19948	SID49673677, BRD-K78701426	2403605	InChI=1S/C17H16N2O5S2/c1-11(20)10-25-17-18-14-9-12(7-8-16(14)24-17)26(21,22)19-13-5-3-4-6-15(13)23-2/h3-9,19H,10H2,1-2H3	ZBZDPUAUXOKZSC-UHFFFAOYSA-N	COc1ccccc1NS(=O)(=O)c2ccc3oc(SCC(=O)C)nc3c2	BroadT	BRD-K78701426	BRD-K78701426-001-06-8	Enamine Ltd.	T0511-4897			COc1ccccc1NS(=O)(=O)c1ccc2oc(SCC(C)=O)nc2c1	InChI=1S/C17H16N2O5S2/c1-11(20)10-25-17-18-14-9-12(7-8-16(14)24-17)26(21,22)19-13-5-3-4-6-15(13)23-2/h3-9,19H,10H2,1-2H3	ZBZDPUAUXOKZSC-UHFFFAOYSA-N	392.050063012							108574
3-[3-(2-Methoxy-phenoxy)-propyl]-3H-benzothiazol-2-one	LSM-19949	SID843178, BRD-K17735587	645456	InChI=1S/C17H17NO3S/c1-20-14-8-3-4-9-15(14)21-12-6-11-18-13-7-2-5-10-16(13)22-17(18)19/h2-5,7-10H,6,11-12H2,1H3	SMUQXFJVORQVPQ-UHFFFAOYSA-N	COc1ccccc1OCCCN2C(=O)Sc3ccccc23	BroadT	BRD-K17735587	BRD-K17735587-001-05-7	Asinex Ltd.	BAS 08977234			COc1ccccc1OCCCn1c2ccccc2sc1=O	InChI=1S/C17H17NO3S/c1-20-14-8-3-4-9-15(14)21-12-6-11-18-13-7-2-5-10-16(13)22-17(18)19/h2-5,7-10H,6,11-12H2,1H3	SMUQXFJVORQVPQ-UHFFFAOYSA-N	315.092914104							108575
MLS000733460	LSM-19950	SID24799899, BRD-K45900731	16191569	InChI=1S/C25H27N5O3/c1-17-22(28-25(33-17)20-9-8-18(31-2)14-23(20)32-3)15-29-10-12-30(13-11-29)24-19-6-4-5-7-21(19)26-16-27-24/h4-9,14,16H,10-13,15H2,1-3H3	ZFZWTCOXZVMVOQ-UHFFFAOYSA-N	COc1ccc(c(OC)c1)c2oc(C)c(CN3CCN(CC3)c4ncnc5ccccc45)n2	BroadT	BRD-K45900731	BRD-K45900731-001-06-6	ChemBridge Corporation	63133100			COc1ccc(-c2nc(CN3CCN(CC3)c3ncnc4ccccc34)c(C)o2)c(OC)c1	InChI=1S/C25H27N5O3/c1-17-22(28-25(33-17)20-9-8-18(31-2)14-23(20)32-3)15-29-10-12-30(13-11-29)24-19-6-4-5-7-21(19)26-16-27-24/h4-9,14,16H,10-13,15H2,1-3H3	ZFZWTCOXZVMVOQ-UHFFFAOYSA-N	445.211389774							108576
ST090474	LSM-19951	SID24813227, BRD-K63859705	1503202	InChI=1S/C14H16N2O2S/c1-9-5-3-4-6-12(9)18-8-7-11-10(2)15-14(19)16-13(11)17/h3-6H,7-8H2,1-2H3,(H2,15,16,17,19)	UNHSRUZIDVVZJL-UHFFFAOYSA-N	Cc1ccccc1OCCc2c(C)nc(S)nc2O	BroadT	BRD-K63859705	BRD-K63859705-001-05-5	ChemDiv Inc.	8015-6352			Cc1ccccc1OCCc1c(C)nc(S)nc1O	InChI=1S/C14H16N2O2S/c1-9-5-3-4-6-12(9)18-8-7-11-10(2)15-14(19)16-13(11)17/h3-6H,7-8H2,1-2H3,(H2,15,16,17,19)	UNHSRUZIDVVZJL-UHFFFAOYSA-N	276.093248462							108577
HMS2994M05	LSM-19952	BRD-K18319068	24819763	InChI=1S/C22H17F3N2O3/c1-29-20-8-6-14(12-26-27-22(28)17-4-2-3-5-18(17)24)10-15(20)13-30-21-9-7-16(23)11-19(21)25/h2-12H,13H2,1H3,(H,27,28)	QEDMPKZKIAYWOT-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)c2ccccc2F)cc1COc3ccc(F)cc3F	BroadT	BRD-K18319068	BRD-K18319068-001-05-7	Chemical Technologies & Investigations	DBZA-005851			COc1ccc(C=NNC(=O)c2ccccc2F)cc1COc1ccc(F)cc1F	InChI=1S/C22H17F3N2O3/c1-29-20-8-6-14(12-26-27-22(28)17-4-2-3-5-18(17)24)10-15(20)13-30-21-9-7-16(23)11-19(21)25/h2-12H,13H2,1H3,(H,27,28)	QEDMPKZKIAYWOT-UHFFFAOYSA-N	414.119127024							108578
Syrosingopine	LSM-2297	Syrosingopine	6769	InChI=1S/C35H42N2O11/c1-7-46-35(40)48-31-26(42-3)12-18(13-27(31)43-4)33(38)47-28-14-19-17-37-11-10-22-21-9-8-20(41-2)15-24(21)36-30(22)25(37)16-23(19)29(32(28)44-5)34(39)45-6/h8-9,12-13,15,19,23,25,28-29,32,36H,7,10-11,14,16-17H2,1-6H3/t19-,23+,25-,28-,29+,32+/m1/s1	ZCDNRPPFBQDQHR-SSYATKPKSA-N	CCOC(=O)Oc1c(OC)cc(cc1OC)C(=O)O[C@@H]2C[C@@H]3CN4CCc5c([nH]c6cc(OC)ccc56)[C@H]4C[C@@H]3[C@@H]([C@H]2OC)C(=O)OC	BroadT	BRD-K14200658	BRD-K14200658-001-02-6	Prestwick Chemical Inc.	Prestw-564	D0701-MP04-ST03-200-		CCOC(=O)Oc1c(OC)cc(cc1OC)C(=O)O[C@@H]1C[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]([C@H]1OC)C(=O)OC	InChI=1S/C35H42N2O11/c1-7-46-35(40)48-31-26(42-3)12-18(13-27(31)43-4)33(38)47-28-14-19-17-37-11-10-22-21-9-8-20(41-2)15-24(21)36-30(22)25(37)16-23(19)29(32(28)44-5)34(39)45-6/h8-9,12-13,15,19,23,25,28-29,32,36H,7,10-11,14,16-17H2,1-6H3/t19-,23+,25-,28-,29+,32+/m1/s1	ZCDNRPPFBQDQHR-SSYATKPKSA-N	666.278860184							92245
SMR000304369	LSM-1950	Nadolol, SID56463045	4411	InChI=1S/C17H27NO4/c1-17(2,3)18-9-12(19)10-22-16-6-4-5-11-7-14(20)15(21)8-13(11)16/h4-6,12,14-15,18-21H,7-10H2,1-3H3	VWPOSFSPZNDTMJ-UHFFFAOYSA-N	CC(C)(C)NCC(O)COc1cccc2CC(O)C(O)Cc12	BroadT	BRD-A97454584	BRD-A97454584-001-02-0	Prestwick Chemical Inc.	Prestw-818	D0701-MP04-ST03-200-		CC(C)(C)NCC(O)COc1cccc2CC(O)C(O)Cc12	InChI=1S/C17H27NO4/c1-17(2,3)18-9-12(19)10-22-16-6-4-5-11-7-14(20)15(21)8-13(11)16/h4-6,12,14-15,18-21H,7-10H2,1-3H3	VWPOSFSPZNDTMJ-UHFFFAOYSA-N	309.194008354							91985
Parbendazole	LSM-4893	Parbendazole, SK&F-29044, TCMDC-131798	26596	InChI=1S/C13H17N3O2/c1-3-4-5-9-6-7-10-11(8-9)15-12(14-10)16-13(17)18-2/h6-8H,3-5H2,1-2H3,(H2,14,15,16,17)	YRWLZFXJFBZBEY-UHFFFAOYSA-N	CCCCc1ccc2[nH]c(NC(=O)OC)nc2c1	BroadT	BRD-K02407574	BRD-K02407574-001-03-0	Prestwick Chemical Inc.	Prestw-1110	D0701-MP04-ST03-200-		CCCCc1ccc2[nH]c(NC(=O)OC)nc2c1	InChI=1S/C13H17N3O2/c1-3-4-5-9-6-7-10-11(8-9)15-12(14-10)16-13(17)18-2/h6-8H,3-5H2,1-2H3,(H2,14,15,16,17)	YRWLZFXJFBZBEY-UHFFFAOYSA-N	247.132076814							94267
Apigetrin	LSM-2286	Cosmosiin, NSC-407303	5280704	InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1	KMOUJOKENFFTPU-QNDFHXLGSA-N	OC[C@H]1O[C@@H](Oc2cc(O)c3C(=O)C=C(Oc3c2)c4ccc(O)cc4)[C@H](O)[C@@H](O)[C@@H]1O	BroadT	BRD-K13642330	BRD-K13642330-001-02-6	MicroSource Discovery Systems Inc.	211950			OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(cc3=O)-c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O	InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1	KMOUJOKENFFTPU-QNDFHXLGSA-N	432.10564684							16778
CI-218872	LSM-1991	CL-218872, CI-218872, CL 218872, BRD-K00662280	107950	InChI=1S/C13H9F3N4/c1-8-17-18-12-6-5-11(19-20(8)12)9-3-2-4-10(7-9)13(14,15)16/h2-7H,1H3	GUOQUXNJZHGPQF-UHFFFAOYSA-N	Cc1nnc2ccc(nn12)c3cccc(c3)C(F)(F)F	BroadT	BRD-K00662280	BRD-K00662280-001-01-1	Biomol International Inc.	AC-1369	2819-N1292		Cc1nnc2ccc(nn12)-c1cccc(c1)C(F)(F)F	InChI=1S/C13H9F3N4/c1-8-17-18-12-6-5-11(19-20(8)12)9-3-2-4-10(7-9)13(14,15)16/h2-7H,1H3	GUOQUXNJZHGPQF-UHFFFAOYSA-N	278.077930928							92018
PSB-11	LSM-2213	BRD-K10177585	9882625	InChI=1S/C16H17N5O/c1-3-11-9-21-15(17-11)12-14(20(2)16(21)22)19-13(18-12)10-7-5-4-6-8-10/h4-8,11H,3,9H2,1-2H3,(H,18,19)/t11-/m1/s1	RGDHRCXUMURWBJ-LLVKDONJSA-N	CC[C@@H]1CN2C(=O)N(C)c3nc([nH]c3C2=N1)c4ccccc4	BroadT	BRD-K10177585	BRD-K10177585-003-01-6	Tocris Bioscience	2012	1	Cl	CC[C@@H]1CN2C(=N1)c1[nH]c(nc1N(C)C2=O)-c1ccccc1.Cl	InChI=1S/C16H17N5O.ClH/c1-3-11-9-21-15(17-11)12-14(20(2)16(21)22)19-13(18-12)10-7-5-4-6-8-10;/h4-8,11H,3,9H2,1-2H3,(H,18,19);1H/t11-;/m1./s1	JAUSHKIWPLHBCN-RFVHGSKJSA-N	295.143310214							92180, 92180, 92180
SEW2871	LSM-2340	SEW-2871, BRD-K15601958	4077460	InChI=1S/C20H10F6N2OS/c21-19(22,23)13-8-4-7-12(9-13)17-27-18(29-28-17)15-10-14(11-5-2-1-3-6-11)16(30-15)20(24,25)26/h1-10H	OYMNPJXKQVTQTR-UHFFFAOYSA-N	FC(F)(F)c1cccc(c1)c2noc(n2)c3cc(c4ccccc4)c(s3)C(F)(F)F	BroadT	BRD-K15601958	BRD-K15601958-001-01-3	Tocris Bioscience	2284	1		FC(F)(F)c1sc(cc1-c1ccccc1)-c1nc(no1)-c1cccc(c1)C(F)(F)F	InChI=1S/C20H10F6N2OS/c21-19(22,23)13-8-4-7-12(9-13)17-27-18(29-28-17)15-10-14(11-5-2-1-3-6-11)16(30-15)20(24,25)26/h1-10H	OYMNPJXKQVTQTR-UHFFFAOYSA-N	440.04180285							92283
Psoromic acid	LSM-2068	Psoromicacid, NSC-92186, Psoromic Acid	23725	InChI=1S/C18H14O8/c1-7-4-11(20)10(6-19)15-13(7)18(23)26-14-8(2)12(24-3)5-9(17(21)22)16(14)25-15/h4-6,20H,1-3H3,(H,21,22)	FUCWJKJZOHOLEO-UHFFFAOYSA-N	COc1cc(C(=O)O)c2Oc3c(C=O)c(O)cc(C)c3C(=O)Oc2c1C	BroadT	BRD-K04170657	BRD-K04170657-001-02-4	MicroSource Discovery Systems Inc.	200040			COc1cc(C(O)=O)c2Oc3c(C=O)c(O)cc(C)c3C(=O)Oc2c1C	InChI=1S/C18H14O8/c1-7-4-11(20)10(6-19)15-13(7)18(23)26-14-8(2)12(24-3)5-9(17(21)22)16(14)25-15/h4-6,20H,1-3H3,(H,21,22)	FUCWJKJZOHOLEO-UHFFFAOYSA-N	358.068867408							92074
HA 1004	LSM-2096	H-1004, HA-1004	3546	InChI=1S/C12H15N5O2S/c13-12(14)16-6-7-17-20(18,19)11-3-1-2-9-8-15-5-4-10(9)11/h1-5,8,17H,6-7H2,(H4,13,14,16)	MZNDNBFMSVMUCX-UHFFFAOYSA-N	NC(=N)NCCNS(=O)(=O)c1cccc2cnccc12	BroadT	BRD-K05434375	BRD-K05434375-001-04-0	Biomol International Inc.	EI-184	2840(V2)-3-N1305		NC(=N)NCCNS(=O)(=O)c1cccc2cnccc12	InChI=1S/C12H15N5O2S/c13-12(14)16-6-7-17-20(18,19)11-3-1-2-9-8-15-5-4-10(9)11/h1-5,8,17H,6-7H2,(H4,13,14,16)	MZNDNBFMSVMUCX-UHFFFAOYSA-N	293.09464546							92097, 92097
Carbonyl Cyanide M-Chlorophenylhydrazone	LSM-2341	Cccp, BRD-K15616905, Carbonyl Cyanide M-Chlorophenylhydrazone	2603	InChI=1S/C9H5ClN4/c10-7-2-1-3-8(4-7)13-14-9(5-11)6-12/h1-4,13H	UGTJLJZQQFGTJD-UHFFFAOYSA-N	Clc1cccc(NN=C(C#N)C#N)c1	BroadT	BRD-K15616905	BRD-K15616905-001-01-5	Tocris Bioscience	452	2		Clc1cccc(NN=C(C#N)C#N)c1	InChI=1S/C9H5ClN4/c10-7-2-1-3-8(4-7)13-14-9(5-11)6-12/h1-4,13H	UGTJLJZQQFGTJD-UHFFFAOYSA-N	204.02027391							3259
Ropinirole	LSM-2351	Ropinirole, Requip, BRD-K15933101, SK&F-101468	5095	InChI=1S/C16H24N2O/c1-3-9-18(10-4-2)11-8-13-6-5-7-15-14(13)12-16(19)17-15/h5-7H,3-4,8-12H2,1-2H3,(H,17,19)	UHSKFQJFRQCDBE-UHFFFAOYSA-N	CCCN(CCC)CCc1cccc2NC(=O)Cc12	BroadT	BRD-K15933101	BRD-K15933101-003-01-2	Biomol International Inc.	D-113	2812-3-N1298	Cl	CCCN(CCC)CCc1cccc2NC(=O)Cc12.Cl	InChI=1S/C16H24N2O.ClH/c1-3-9-18(10-4-2)11-8-13-6-5-7-15-14(13)12-16(19)17-15;/h5-7H,3-4,8-12H2,1-2H3,(H,17,19);1H	XDXHAEQXIBQUEZ-UHFFFAOYSA-N	260.188863408							8888, 8888
Papaverine	LSM-2338	Papaverine, Papaverine Hydrochloride	4680	InChI=1S/C20H21NO4/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16/h5-8,10-12H,9H2,1-4H3	XQYZDYMELSJDRZ-UHFFFAOYSA-N	COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC	BroadT	BRD-K15567136	BRD-K15567136-001-01-1	AnalytiCon Discovery GmbH	NP-014100			COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC	InChI=1S/C20H21NO4/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16/h5-8,10-12H,9H2,1-4H3	XQYZDYMELSJDRZ-UHFFFAOYSA-N	339.147058162							28241, 28241
306935-41-1	LSM-2331	SID29215554, BRD-K15196155	2736690	InChI=1S/C10H11N3O2/c1-6(2)13-9-4-3-7(10(14)15)5-8(9)11-12-13/h3-6H,1-2H3,(H,14,15)	RUTVRAJKELSHCC-UHFFFAOYSA-N	CC(C)n1nnc2cc(ccc12)C(=O)O	BroadT	BRD-K15196155	BRD-K15196155-001-01-5	Tocris Bioscience	2469	1		CC(C)n1nnc2cc(ccc12)C(O)=O	InChI=1S/C10H11N3O2/c1-6(2)13-9-4-3-7(10(14)15)5-8(9)11-12-13/h3-6H,1-2H3,(H,14,15)	RUTVRAJKELSHCC-UHFFFAOYSA-N	205.085126622							92275
Succinylsulfathiazole	LSM-5210	Succinylsulfathiazole, Succinyl Sulfathiazole	5315	InChI=1S/C13H13N3O5S2/c17-11(5-6-12(18)19)15-9-1-3-10(4-2-9)23(20,21)16-13-14-7-8-22-13/h1-4,7-8H,5-6H2,(H,14,16)(H,15,17)(H,18,19)	SKVLYVHULOWXTD-UHFFFAOYSA-N	OC(=O)CCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nccs2	BroadT	BRD-K01950558	BRD-K01950558-001-04-8	MicroSource Discovery Systems Inc.	1502025			OC(=O)CCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1	InChI=1S/C13H13N3O5S2/c17-11(5-6-12(18)19)15-9-1-3-10(4-2-9)23(20,21)16-13-14-7-8-22-13/h1-4,7-8H,5-6H2,(H,14,16)(H,15,17)(H,18,19)	SKVLYVHULOWXTD-UHFFFAOYSA-N	355.029661926							9309
SB-222200	LSM-2075	BRD-K04414442, SB 222200, SB-222200	6604009	InChI=1S/C26H24N2O/c1-3-22(19-12-6-4-7-13-19)28-26(29)24-18(2)25(20-14-8-5-9-15-20)27-23-17-11-10-16-21(23)24/h4-17,22H,3H2,1-2H3,(H,28,29)/t22-/m0/s1	MQNYRKWJSMQECI-QFIPXVFZSA-N	CC[C@H](NC(=O)c1c(C)c(nc2ccccc12)c3ccccc3)c4ccccc4	BroadT	BRD-K04414442	BRD-K04414442-001-03-4	Tocris Bioscience	1393	2		CC[C@H](NC(=O)c1c(C)c(nc2ccccc12)-c1ccccc1)c1ccccc1	InChI=1S/C26H24N2O/c1-3-22(19-12-6-4-7-13-19)28-26(29)24-18(2)25(20-14-8-5-9-15-20)27-23-17-11-10-16-21(23)24/h4-17,22H,3H2,1-2H3,(H,28,29)/t22-/m0/s1	MQNYRKWJSMQECI-QFIPXVFZSA-N	380.188863408							92079
3,4,5-Trimethoxybenzoic acid	LSM-2347	3,4,5-Trimethoxybenzoic Acid, Eudesmic Acid	8357	InChI=1S/C10H12O5/c1-13-7-4-6(10(11)12)5-8(14-2)9(7)15-3/h4-5H,1-3H3,(H,11,12)	SJSOFNCYXJUNBT-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)O	BroadT	BRD-K15842202	BRD-K15842202-001-02-5	MicroSource Discovery Systems Inc.	210752			COc1cc(cc(OC)c1OC)C(O)=O	InChI=1S/C10H12O5/c1-13-7-4-6(10(11)12)5-8(14-2)9(7)15-3/h4-5H,1-3H3,(H,11,12)	SJSOFNCYXJUNBT-UHFFFAOYSA-N	212.068473484							454991
GW 405833	LSM-2217	GW-405833, GW405833, L-768242	9911463	InChI=1S/C23H24Cl2N2O3/c1-15-17(8-9-26-10-12-30-13-11-26)19-14-16(29-2)6-7-21(19)27(15)23(28)18-4-3-5-20(24)22(18)25/h3-7,14H,8-13H2,1-2H3	FSFZRNZSZYDVLI-UHFFFAOYSA-N	COc1ccc2c(c1)c(CCN3CCOCC3)c(C)n2C(=O)c4cccc(Cl)c4Cl	BroadT	BRD-K10705233	BRD-K10705233-001-01-4	Tocris Bioscience	2374	2		COc1ccc2n(C(=O)c3cccc(Cl)c3Cl)c(C)c(CCN3CCOCC3)c2c1	InChI=1S/C23H24Cl2N2O3/c1-15-17(8-9-26-10-12-30-13-11-26)19-14-16(29-2)6-7-21(19)27(15)23(28)18-4-3-5-20(24)22(18)25/h3-7,14H,8-13H2,1-2H3	FSFZRNZSZYDVLI-UHFFFAOYSA-N	446.116398068							92184, 92184
Vesamicol	LSM-2313	Vesamicol, (-)-Vesamicol, (+/-)-Vesamicol	659840	InChI=1S/C17H25NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-17,19H,4-5,8-13H2/t16-,17-/m1/s1	YSSBJODGIYRAMI-IAGOWNOFSA-N	O[C@@H]1CCCC[C@H]1N2CCC(CC2)c3ccccc3	BroadT	BRD-K14765469	BRD-K14765469-003-02-3	Prestwick Chemical Inc.	Prestw-920	D0701-MP04-ST03-200-	Cl	O[C@@H]1CCCC[C@H]1N1CCC(CC1)c1ccccc1.Cl	InChI=1S/C17H25NO.ClH/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14;/h1-3,6-7,15-17,19H,4-5,8-13H2;1H/t16-,17-;/m1./s1	XJNUHVMJVWOYCW-GBNZRNLASA-N	259.19361443							92261, 92261, 92261
2-Hydroxyxanthone	LSM-19953	BRD-K12336887	74708	InChI=1S/C13H8O3/c14-8-5-6-12-10(7-8)13(15)9-3-1-2-4-11(9)16-12/h1-7,14H	WSACHQJPCNOREV-UHFFFAOYSA-N	Oc1ccc2Oc3ccccc3C(=O)c2c1	BroadT	BRD-K12336887	BRD-K12336887-001-02-3	MicroSource Discovery Systems Inc.	240651			Oc1ccc2oc3ccccc3c(=O)c2c1	InChI=1S/C13H8O3/c14-8-5-6-12-10(7-8)13(15)9-3-1-2-4-11(9)16-12/h1-7,14H	WSACHQJPCNOREV-UHFFFAOYSA-N	212.047344116							108579
SPBIO_002561	LSM-2031	Tubocurarine Chloride	6713947	InChI=1S/C37H40N2O6/c1-38-13-11-24-19-32(42-4)33-21-27(24)28(38)16-22-7-6-8-26(15-22)44-37-35-25(20-34(43-5)36(37)41)12-14-39(2,3)29(35)17-23-9-10-30(40)31(18-23)45-33/h6-10,15,18-21,28-29H,11-14,16-17H2,1-5H3,(H-,40,41)/p+1/t28-,29+/m0/s1	MZTXBESCVZFFQE-URLMMPGGSA-O	COc1cc2CC[N+](C)(C)[C@@H]3Cc4ccc(O)c(Oc5cc6[C@H](Cc7cccc(Oc(c1O)c23)c7)N(C)CCc6cc5OC)c4	BroadT	BRD-K02607075	BRD-K02607075-333-03-6	Prestwick Chemical Inc.	Prestw-561	D0701-MP04-ST03-200-	O.O.O.O.O.Cl.Cl	COc1cc2CCN(C)[C@H]3Cc4cccc(Oc5c(O)c(OC)cc6CC[N+](C)(C)[C@H](Cc7ccc(O)c(Oc1cc23)c7)c56)c4.O.O.O.O.O.Cl.Cl	InChI=1S/C37H40N2O6.2ClH.5H2O/c1-38-13-11-24-19-32(42-4)33-21-27(24)28(38)16-22-7-6-8-26(15-22)44-37-35-25(20-34(43-5)36(37)41)12-14-39(2,3)29(35)17-23-9-10-30(40)31(18-23)45-33;;;;;;;/h6-10,15,18-21,28-29H,11-14,16-17H2,1-5H3,(H-,40,41);2*1H;5*1H2/p+1/t28-,29+;;;;;;;/m0......./s1	HZSGMDZCAQBCGW-GGDSLZADSA-O	609.296462052							92048, 92048, 92048
N-Desmethylclozapine	LSM-2206	Desmethylclozapine, Norclozapine, N-Demethylclozapine	2820	InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19-20H,7-10H2	JNNOSTQEZICQQP-UHFFFAOYSA-N	Clc1ccc2Nc3ccccc3C(=Nc2c1)N4CCNCC4	BroadT	BRD-K10042277	BRD-K10042277-001-02-7	Biomol International Inc.	NS-106	2813-N1283		Clc1ccc2Nc3ccccc3C(=Nc2c1)N1CCNCC1	InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19-20H,7-10H2	JNNOSTQEZICQQP-UHFFFAOYSA-N	312.114174294							64050
Indole-3-carbinol	LSM-2011	Indole, Indole-3-Carbinol	3712	InChI=1S/C9H9NO/c11-6-7-5-10-9-4-2-1-3-8(7)9/h1-5,10-11H,6H2	IVYPNXXAYMYVSP-UHFFFAOYSA-N	OCc1c[nH]c2ccccc12	BroadT	BRD-K01815685	BRD-K01815685-001-02-3	MicroSource Discovery Systems Inc.	1505320			OCc1c[nH]c2ccccc12	InChI=1S/C9H9NO/c11-6-7-5-10-9-4-2-1-3-8(7)9/h1-5,10-11H,6H2	IVYPNXXAYMYVSP-UHFFFAOYSA-N	147.068413918							24814
NNC 26-9100	LSM-2163	BRD-K08438429, SID29215544, SID89449177, SID99495629	9893924	InChI=1S/C22H25BrCl2N6S/c23-17-5-7-21(29-12-17)31(14-16-4-6-19(24)20(25)11-16)10-2-9-28-22(32)27-8-1-3-18-13-26-15-30-18/h4-7,11-13,15H,1-3,8-10,14H2,(H,26,30)(H2,27,28,32)	UREJDUPKGMFJRU-UHFFFAOYSA-N	Clc1ccc(CN(CCCNC(=S)NCCCc2c[nH]cn2)c3ccc(Br)cn3)cc1Cl	BroadT	BRD-K08438429	BRD-K08438429-001-01-0	Tocris Bioscience	2440	1		Clc1ccc(CN(CCCNC(=S)NCCCc2c[nH]cn2)c2ccc(Br)cn2)cc1Cl	InChI=1S/C22H25BrCl2N6S/c23-17-5-7-21(29-12-17)31(14-16-4-6-19(24)20(25)11-16)10-2-9-28-22(32)27-8-1-3-18-13-26-15-30-18/h4-7,11-13,15H,1-3,8-10,14H2,(H,26,30)(H2,27,28,32)	UREJDUPKGMFJRU-UHFFFAOYSA-N	554.04218357							92144
Benoxinate	LSM-2069	Oxybuprocaine, Benoxinate	4633	InChI=1S/C17H28N2O3/c1-4-7-11-21-16-13-14(8-9-15(16)18)17(20)22-12-10-19(5-2)6-3/h8-9,13H,4-7,10-12,18H2,1-3H3	CMHHMUWAYWTMGS-UHFFFAOYSA-N	CCCCOc1cc(ccc1N)C(=O)OCCN(CC)CC	BroadT	BRD-K04185004	BRD-K04185004-003-03-6	Prestwick Chemical Inc.	Prestw-57	D0701-MP04-ST03-200-	Cl	CCCCOc1cc(ccc1N)C(=O)OCCN(CC)CC.Cl	InChI=1S/C17H28N2O3.ClH/c1-4-7-11-21-16-13-14(8-9-15(16)18)17(20)22-12-10-19(5-2)6-3;/h8-9,13H,4-7,10-12,18H2,1-3H3;1H	PRGUDWLMFLCODA-UHFFFAOYSA-N	308.209992776							309594, 309594
Jatamansin	LSM-42857	Selinidin, Jatamansin	668081	InChI=1S/C19H20O5/c1-5-11(2)18(21)22-15-10-13-14(24-19(15,3)4)8-6-12-7-9-16(20)23-17(12)13/h5-9,15H,10H2,1-4H3/b11-5-/t15-/m1/s1	RRHCDWLSHIIIIT-NVWZYQMFSA-N	C\C=C(\C)/C(=O)O[C@@H]1Cc2c(OC1(C)C)ccc3C=CC(=O)Oc23	BroadT	BRD-K07212038	BRD-K07212038-001-02-1	MicroSource Discovery Systems Inc.	1504159			C\C=C(\C)C(=O)O[C@@H]1Cc2c(OC1(C)C)ccc1ccc(=O)oc21	InChI=1S/C19H20O5/c1-5-11(2)18(21)22-15-10-13-14(24-19(15,3)4)8-6-12-7-9-16(20)23-17(12)13/h5-9,15H,10H2,1-4H3/b11-5-/t15-/m1/s1	RRHCDWLSHIIIIT-NVWZYQMFSA-N	328.13107374							
Arachidonic acid	LSM-43316	Arachidonicacid, Cis-5,8,11,14-Eicosatetraenoic Acid, Arachidonic Acid	444899	InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15-	YZXBAPSDXZZRGB-DOFZRALJSA-N	CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)O	BroadT	BRD-K03070961	BRD-K03070961-001-02-8	Biomol International Inc.	FA003	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O	InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15-	YZXBAPSDXZZRGB-DOFZRALJSA-N	304.240230264							15843, 15843
Celecoxib	LSM-2032	Celebra, Celebrex, Celecoxib, Onsenal, SC-58635	2662	InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)	RZEKVGVHFLEQIL-UHFFFAOYSA-N	Cc1ccc(cc1)c2cc(nn2c3ccc(cc3)S(=O)(=O)N)C(F)(F)F	BroadT	BRD-K02637541	BRD-K02637541-001-02-4	MicroSource Discovery Systems Inc.	1503678			Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F	InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)	RZEKVGVHFLEQIL-UHFFFAOYSA-N	381.075882008							41423, 41423, 41423
Pachyrrizine	LSM-19954	Pachyrrhizin, Pachyrrizine	101277	InChI=1S/C19H12O6/c1-21-16-8-18-17(23-9-24-18)6-12(16)13-5-11-4-10-2-3-22-14(10)7-15(11)25-19(13)20/h2-8H,9H2,1H3	PENSQRMNZZWMGV-UHFFFAOYSA-N	COc1cc2OCOc2cc1C3=Cc4cc5ccoc5cc4OC3=O	BroadT	BRD-K02070226	BRD-K02070226-001-02-0	MicroSource Discovery Systems Inc.	201602			COc1cc2OCOc2cc1-c1cc2cc3ccoc3cc2oc1=O	InChI=1S/C19H12O6/c1-21-16-8-18-17(23-9-24-18)6-12(16)13-5-11-4-10-2-3-22-14(10)7-15(11)25-19(13)20/h2-8H,9H2,1H3	PENSQRMNZZWMGV-UHFFFAOYSA-N	336.063388104							108580
Fenbufen	LSM-2258	Fenbufen, CL-82204	3335	InChI=1S/C16H14O3/c17-15(10-11-16(18)19)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9H,10-11H2,(H,18,19)	ZPAKPRAICRBAOD-UHFFFAOYSA-N	OC(=O)CCC(=O)c1ccc(cc1)c2ccccc2	BroadT	BRD-K12513978	BRD-K12513978-001-04-3	MicroSource Discovery Systems Inc.	1501008			OC(=O)CCC(=O)c1ccc(cc1)-c1ccccc1	InChI=1S/C16H14O3/c17-15(10-11-16(18)19)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9H,10-11H2,(H,18,19)	ZPAKPRAICRBAOD-UHFFFAOYSA-N	254.094294308							31599
1-Methyllysergic acid butanolamide	LSM-1964	BRD-A98725278	4163	InChI=1S/C21H27N3O2/c1-4-15(12-25)22-21(26)14-8-17-16-6-5-7-18-20(16)13(10-23(18)2)9-19(17)24(3)11-14/h5-8,10,14-15,19,25H,4,9,11-12H2,1-3H3,(H,22,26)	KPJZHOPZRAFDTN-UHFFFAOYSA-N	CCC(CO)NC(=O)C1CN(C)C2Cc3cn(C)c4cccc(C2=C1)c34	BroadT	BRD-A98725278	BRD-A98725278-103-01-9	Tocris Bioscience	1064	2	OC(=O)C=CC(=O)O	CCC(CO)NC(=O)C1CN(C)C2Cc3cn(C)c4cccc(C2=C1)c34.OC(=O)C=CC(=O)O	InChI=1S/C21H27N3O2.C4H4O4/c1-4-15(12-25)22-21(26)14-8-17-16-6-5-7-18-20(16)13(10-23(18)2)9-19(17)24(3)11-14;5-3(6)1-2-4(7)8/h5-8,10,14-15,19,25H,4,9,11-12H2,1-3H3,(H,22,26);1-2H,(H,5,6)(H,7,8)	LWYXFDXUMVEZKS-UHFFFAOYSA-N	353.210327134							91995
CHEMBL318111	LSM-2138	SID26755672, SID50111033, SID90340982, R(-)-N-Allylnorapomorphine	838674	InChI=1S/C19H19NO2/c1-2-9-20-10-8-12-4-3-5-14-17(12)15(20)11-13-6-7-16(21)19(22)18(13)14/h2-7,15,21-22H,1,8-11H2/t15-/m1/s1	XEXUKNQDDPKEIF-OAHLLOKOSA-N	Oc1ccc2C[C@H]3N(CC=C)CCc4cccc(c34)c2c1O	BroadT	BRD-K07079548	BRD-K07079548-001-01-9	Biomol International Inc.	AC-820	2812-3-N1298		Oc1ccc2C[C@H]3N(CC=C)CCc4cccc(c34)-c2c1O	InChI=1S/C19H19NO2/c1-2-9-20-10-8-12-4-3-5-14-17(12)15(20)11-13-6-7-16(21)19(22)18(13)14/h2-7,15,21-22H,1,8-11H2/t15-/m1/s1	XEXUKNQDDPKEIF-OAHLLOKOSA-N	293.141578858							92130, 92130
Telenzepine	LSM-2111	Telenzepine	5387	InChI=1S/C19H22N4O2S/c1-13-18-14(12-26-13)19(25)20-15-5-3-4-6-16(15)23(18)17(24)11-22-9-7-21(2)8-10-22/h3-6,12H,7-11H2,1-2H3,(H,20,25)	VSWPGAIWKHPTKX-UHFFFAOYSA-N	CN1CCN(CC(=O)N2c3ccccc3NC(=O)c4csc(C)c24)CC1	BroadT	BRD-K06147391	BRD-K06147391-003-01-9	MicroSource Discovery Systems Inc.	1504187		Cl	CN1CCN(CC(=O)N2c3c(C)scc3C(=O)Nc3ccccc23)CC1.Cl	InChI=1S/C19H22N4O2S.ClH/c1-13-18-14(12-26-13)19(25)20-15-5-3-4-6-16(15)23(18)17(24)11-22-9-7-21(2)8-10-22;/h3-6,12H,7-11H2,1-2H3,(H,20,25);1H	XZVKOMOTDZLLDN-UHFFFAOYSA-N	370.146346674							92110, 92110, 92110
BP-897	LSM-2376	DO 897/99, BP-897	3038495	InChI=1S/C26H31N3O2/c1-31-25-11-5-4-10-24(25)29-18-16-28(17-19-29)15-7-6-14-27-26(30)23-13-12-21-8-2-3-9-22(21)20-23/h2-5,8-13,20H,6-7,14-19H2,1H3,(H,27,30)	MNHDKMDLOJSCGN-UHFFFAOYSA-N	COc1ccccc1N2CCN(CCCCNC(=O)c3ccc4ccccc4c3)CC2	BroadT	BRD-K17378184	BRD-K17378184-300-03-4	Prestwick Chemical Inc.	Prestw-559	D0701-MP04-ST03-200-	Cl.Cl	COc1ccccc1N1CCN(CCCCNC(=O)c2ccc3ccccc3c2)CC1.Cl.Cl	InChI=1S/C26H31N3O2.2ClH/c1-31-25-11-5-4-10-24(25)29-18-16-28(17-19-29)15-7-6-14-27-26(30)23-13-12-21-8-2-3-9-22(21)20-23;;/h2-5,8-13,20H,6-7,14-19H2,1H3,(H,27,30);2*1H	LUGFRGZVWVEDNU-UHFFFAOYSA-N	417.241627262							92310, 92310
GR-127935	LSM-2243	148672-13-3, BRD-K11911061, GR-127935	107780	InChI=1S/C29H31N5O3/c1-19-17-23(28-30-20(2)37-32-28)9-11-25(19)21-5-7-22(8-6-21)29(35)31-24-10-12-27(36-4)26(18-24)34-15-13-33(3)14-16-34/h5-12,17-18H,13-16H2,1-4H3,(H,31,35)	YDBCEBYHYKAFRX-UHFFFAOYSA-N	COc1ccc(NC(=O)c2ccc(cc2)c3ccc(cc3C)c4noc(C)n4)cc1N5CCN(C)CC5	BroadT	BRD-K11911061	BRD-K11911061-003-02-8	Tocris Bioscience	1477	4	Cl	COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc1N1CCN(C)CC1.Cl	InChI=1S/C29H31N5O3.ClH/c1-19-17-23(28-30-20(2)37-32-28)9-11-25(19)21-5-7-22(8-6-21)29(35)31-24-10-12-27(36-4)26(18-24)34-15-13-33(3)14-16-34;/h5-12,17-18H,13-16H2,1-4H3,(H,31,35);1H	SRVVUYIJVBLEJI-UHFFFAOYSA-N	497.242689902							64114, 64114
CDK4 Inhibitor III	LSM-2121	BRD-K06426971, SID50112933	481747	InChI=1S/C15H12N2O2S/c1-8-3-5-10(6-4-8)17-11-7-12(18)15-13(14(11)19)16-9(2)20-15/h3-7,17H,1-2H3	HFPLHASLIOXVGS-UHFFFAOYSA-N	Cc1ccc(NC2=CC(=O)c3sc(C)nc3C2=O)cc1	BroadT	BRD-K06426971	BRD-K06426971-001-01-9	Tocris Bioscience	2609	1		Cc1nc2c(s1)C(=O)C=C(Nc1ccc(C)cc1)C2=O	InChI=1S/C15H12N2O2S/c1-8-3-5-10(6-4-8)17-11-7-12(18)15-13(14(11)19)16-9(2)20-15/h3-7,17H,1-2H3	HFPLHASLIOXVGS-UHFFFAOYSA-N	284.061948334							92119
TyrphostinAG835	LSM-42895	Tyrphostin Ag-835, Tyrphostin Ag 835	5328769	InChI=1S/C18H16N2O3/c1-12(14-5-3-2-4-6-14)20-18(23)15(11-19)9-13-7-8-16(21)17(22)10-13/h2-10,12,21-22H,1H3,(H,20,23)/b15-9+/t12-/m0/s1	UMGQVUWXNOJOSJ-DGGAMASNSA-N	C[C@H](NC(=O)\C(=C\c1ccc(O)c(O)c1)\C#N)c2ccccc2	BroadT	BRD-K17415526	BRD-K17415526-001-02-7	Tocris Bioscience	579	1		C[C@H](NC(=O)C(=C\c1ccc(O)c(O)c1)\C#N)c1ccccc1	InChI=1S/C18H16N2O3/c1-12(14-5-3-2-4-6-14)20-18(23)15(11-19)9-13-7-8-16(21)17(22)10-13/h2-10,12,21-22H,1H3,(H,20,23)/b15-9+/t12-/m0/s1	UMGQVUWXNOJOSJ-DGGAMASNSA-N	308.116092392							
2-(4,5-Dihydro-1H-imidazol-2-yl)quinoxaline	LSM-2238	BRD-K11696279, SID11113665	4520732	InChI=1S/C11H10N4/c1-2-4-9-8(3-1)14-7-10(15-9)11-12-5-6-13-11/h1-4,7H,5-6H2,(H,12,13)	MQSSFHXQKUSFIW-UHFFFAOYSA-N	C1CN=C(N1)c2cnc3ccccc3n2	BroadT	BRD-K11696279	BRD-K11696279-003-01-5	Tocris Bioscience	726	5	Cl	C1CN=C(N1)c1cnc2ccccc2n1.Cl	InChI=1S/C11H10N4.ClH/c1-2-4-9-8(3-1)14-7-10(15-9)11-12-5-6-13-11;/h1-4,7H,5-6H2,(H,12,13);1H	NQMMIEICYUXMKP-UHFFFAOYSA-N	198.09054636							92199
Pirinixic acid	LSM-2015	Pirinixic Acid	5694	InChI=1S/C14H14ClN3O2S/c1-8-4-3-5-10(9(8)2)16-12-6-11(15)17-14(18-12)21-7-13(19)20/h3-6H,7H2,1-2H3,(H,19,20)(H,16,17,18)	SZRPDCCEHVWOJX-UHFFFAOYSA-N	Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C	BroadT	BRD-K01902415	BRD-K01902415-001-03-4	Tocris Bioscience	1312	2		Cc1cccc(Nc2cc(Cl)nc(SCC(O)=O)n2)c1C	InChI=1S/C14H14ClN3O2S/c1-8-4-3-5-10(9(8)2)16-12-6-11(15)17-14(18-12)21-7-13(19)20/h3-6H,7H2,1-2H3,(H,19,20)(H,16,17,18)	SZRPDCCEHVWOJX-UHFFFAOYSA-N	323.049525118							32509
Clofoctol	LSM-19955	Clofoctol	2799	InChI=1S/C21H26Cl2O/c1-20(2,3)13-21(4,5)16-7-9-19(24)15(11-16)10-14-6-8-17(22)12-18(14)23/h6-9,11-12,24H,10,13H2,1-5H3	HQVZOORKDNCGCK-UHFFFAOYSA-N	CC(C)(C)CC(C)(C)c1ccc(O)c(Cc2ccc(Cl)cc2Cl)c1	BroadT	BRD-K02900412	BRD-K02900412-001-02-2	MicroSource Discovery Systems Inc.	1503206			CC(C)(C)CC(C)(C)c1ccc(O)c(Cc2ccc(Cl)cc2Cl)c1	InChI=1S/C21H26Cl2O/c1-20(2,3)13-21(4,5)16-7-9-19(24)15(11-16)10-14-6-8-17(22)12-18(14)23/h6-9,11-12,24H,10,13H2,1-5H3	HQVZOORKDNCGCK-UHFFFAOYSA-N	364.136070872							108581
Nobiletin	LSM-2130	NSC-76751	72344	InChI=1S/C21H22O8/c1-23-13-8-7-11(9-15(13)24-2)14-10-12(22)16-17(25-3)19(26-4)21(28-6)20(27-5)18(16)29-14/h7-10H,1-6H3	MRIAQLRQZPPODS-UHFFFAOYSA-N	COc1ccc(cc1OC)C2=CC(=O)c3c(OC)c(OC)c(OC)c(OC)c3O2	BroadT	BRD-K06753942	BRD-K06753942-001-02-0	AnalytiCon Discovery GmbH	NP-002695			COc1ccc(cc1OC)-c1cc(=O)c2c(OC)c(OC)c(OC)c(OC)c2o1	InChI=1S/C21H22O8/c1-23-13-8-7-11(9-15(13)24-2)14-10-12(22)16-17(25-3)19(26-4)21(28-6)20(27-5)18(16)29-14/h7-10H,1-6H3	MRIAQLRQZPPODS-UHFFFAOYSA-N	402.131467664							7602
Deferoxamine	LSM-6541	Desferrioxamine, Desferal, Deferoxamine	2973	InChI=1S/C25H48N6O8/c1-21(32)29(37)18-9-3-6-16-27-22(33)12-14-25(36)31(39)20-10-4-7-17-28-23(34)11-13-24(35)30(38)19-8-2-5-15-26/h37-39H,2-20,26H2,1H3,(H,27,33)(H,28,34)	UBQYURCVBFRUQT-UHFFFAOYSA-N	CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCN	BroadT	BRD-K09821361	BRD-K09821361-066-05-0	Prestwick Chemical Inc.	Prestw-725	D0701-MP04-ST03-200-	CS(=O)(=O)O	CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCN.CS(=O)(=O)O	InChI=1S/C25H48N6O8.CH4O3S/c1-21(32)29(37)18-9-3-6-16-27-22(33)12-14-25(36)31(39)20-10-4-7-17-28-23(34)11-13-24(35)30(38)19-8-2-5-15-26;1-5(2,3)4/h37-39H,2-20,26H2,1H3,(H,27,33)(H,28,34);1H3,(H,2,3,4)	IDDIJAWJANBQLJ-UHFFFAOYSA-N	560.353362556							4356, 4356, 4356
Lovastatin	LSM-2189	Lovastatin, Altoprev, Mevacor, Mevinolin, MK-803	53232	InChI=1S/C24H36O5/c1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19/h6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3/t14-,15-,16-,18+,19+,20-,21-,23-/m0/s1	PCZOHLXUXFIOCF-BXMDZJJMSA-N	CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12	BroadT	BRD-K09416995	BRD-K09416995-001-16-7	Tocris Bioscience	1530	1		CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12	InChI=1S/C24H36O5/c1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19/h6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3/t14-,15-,16-,18+,19+,20-,21-,23-/m0/s1	PCZOHLXUXFIOCF-BXMDZJJMSA-N	404.256274252							40303
Phenanthridone	LSM-2229	6(5H)-Phenanthridinone, Phenanthridin-6(5H)-one	1853	InChI=1S/C13H9NO/c15-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)14-13/h1-8H,(H,14,15)	RZFVLEJOHSLEFR-UHFFFAOYSA-N	O=C1Nc2ccccc2c3ccccc13	BroadT	BRD-K11163873	BRD-K11163873-001-02-8	Biomol International Inc.	AP-100	2840(V2)-3-N1305		O=c1[nH]c2ccccc2c2ccccc12	InChI=1S/C13H9NO/c15-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)14-13/h1-8H,(H,14,15)	RZFVLEJOHSLEFR-UHFFFAOYSA-N	195.068413918							75292
Pipemidic acid	LSM-5267	Pipemidic-Acid, Pipemidic Acid, Pipemidic Acid Trihydrate	4831	InChI=1S/C14H17N5O3/c1-2-18-8-10(13(21)22)11(20)9-7-16-14(17-12(9)18)19-5-3-15-4-6-19/h7-8,15H,2-6H2,1H3,(H,21,22)	JOHZPMXAZQZXHR-UHFFFAOYSA-N	CCN1C=C(C(=O)O)C(=O)c2cnc(nc12)N3CCNCC3	BroadT	BRD-K08999871	BRD-K08999871-001-04-8	MicroSource Discovery Systems Inc.	1502024			CCn1cc(C(O)=O)c(=O)c2cnc(nc12)N1CCNCC1	InChI=1S/C14H17N5O3/c1-2-18-8-10(13(21)22)11(20)9-7-16-14(17-12(9)18)19-5-3-15-4-6-19/h7-8,15H,2-6H2,1H3,(H,21,22)	JOHZPMXAZQZXHR-UHFFFAOYSA-N	303.133139454							75250
Adrenic acid	LSM-43864	Adrenic Acid (22, SID26754941, SID26754942	5497181	InChI=1S/C22H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-21H2,1H3,(H,23,24)/b7-6-,10-9-,13-12-,16-15-	TWSWSIQAPQLDBP-DOFZRALJSA-N	CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCCCC(=O)O	BroadT	BRD-K17040651	BRD-K17040651-001-02-0	Biomol International Inc.	FA011	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCCCC(O)=O	InChI=1S/C22H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-21H2,1H3,(H,23,24)/b7-6-,10-9-,13-12-,16-15-	TWSWSIQAPQLDBP-DOFZRALJSA-N	332.271530392							53487
8-O-methylretusin	LSM-19957	8-Methylretusin, BRD-K09100418	5319771	InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)13-9-22-16-12(15(13)19)7-8-14(18)17(16)21-2/h3-9,18H,1-2H3	SELGEUSJRWRBQR-UHFFFAOYSA-N	COc1ccc(cc1)C2=COc3c(OC)c(O)ccc3C2=O	BroadT	BRD-K09100418	BRD-K09100418-001-02-6	MicroSource Discovery Systems Inc.	201185			COc1ccc(cc1)-c1coc2c(OC)c(O)ccc2c1=O	InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)13-9-22-16-12(15(13)19)7-8-14(18)17(16)21-2/h3-9,18H,1-2H3	SELGEUSJRWRBQR-UHFFFAOYSA-N	298.084123548							108582
Deltaline	LSM-1966	Deltaline	441728	InChI=1S/C27H41NO8/c1-7-28-12-23(3)9-8-17(32-5)26-20(23)21(36-14(2)29)27(22(26)28)25(34-13-35-27)11-16(31-4)15-10-24(26,30)19(25)18(15)33-6/h15-22,30H,7-13H2,1-6H3/t15-,16+,17+,18+,19+,20-,21+,22?,23+,24+,25-,26-,27-/m1/s1	DTTPWCNKTMQMTE-DZZCPBQSSA-N	CCN1C[C@]2(C)CC[C@H](OC)[C@]34[C@@H]2[C@H](OC(=O)C)[C@@]5(OCO[C@@]56C[C@H](OC)[C@H]7C[C@]3(O)[C@@H]6[C@H]7OC)C14	BroadT	BRD-A99177642	BRD-A99177642-001-02-5	Prestwick Chemical Inc.	Prestw-673	D0701-MP04-ST03-200-		CCN1C[C@]2(C)CC[C@H](OC)[C@]34[C@@H]2[C@H](OC(C)=O)[C@@]2(OCO[C@@]22C[C@H](OC)[C@H]5C[C@]3(O)[C@@H]2[C@H]5OC)C14	InChI=1S/C27H41NO8/c1-7-28-12-23(3)9-8-17(32-5)26-20(23)21(36-14(2)29)27(22(26)28)25(34-13-35-27)11-16(31-4)15-10-24(26,30)19(25)18(15)33-6/h15-22,30H,7-13H2,1-6H3/t15-,16+,17+,18+,19+,20-,21+,22?,23+,24+,25-,26-,27-/m1/s1	DTTPWCNKTMQMTE-DZZCPBQSSA-N	507.283217282							4387
Bromocriptine	LSM-6550	Bromocriptine, CB-154	31101	InChI=1S/C32H40BrN5O5/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39)/t18-,23-,24+,25+,31-,32+/m1/s1	OZVBMTJYIDMWIL-AYFBDAFISA-N	CC(C)C[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)[C@@H]4Cc5c(Br)[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]7CCCN7C1=O)C(C)C	BroadT	BRD-K14496212	BRD-K14496212-001-01-1	Biomol International Inc.	D-102	2812-3-N1298		CC(C)C[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)[C@@H]4Cc5c(Br)[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]2CCCN2C1=O)C(C)C	InChI=1S/C32H40BrN5O5/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39)/t18-,23-,24+,25+,31-,32+/m1/s1	OZVBMTJYIDMWIL-AYFBDAFISA-N	653.22128203							3181, 3181, 3181
Meclofenoxate	LSM-5273	Meclofenoxate, Clophenoxate, Centrophenoxine, Meclofenoxate HCl	4039	InChI=1S/C12H16ClNO3/c1-14(2)7-8-16-12(15)9-17-11-5-3-10(13)4-6-11/h3-6H,7-9H2,1-2H3	XZTYGFHCIAKPGJ-UHFFFAOYSA-N	CN(C)CCOC(=O)COc1ccc(Cl)cc1	BroadT	BRD-K10314788	BRD-K10314788-003-04-4	Prestwick Chemical Inc.	Prestw-763	D0701-MP04-ST03-200-	Cl	CN(C)CCOC(=O)COc1ccc(Cl)cc1.Cl	InChI=1S/C12H16ClNO3.ClH/c1-14(2)7-8-16-12(15)9-17-11-5-3-10(13)4-6-11;/h3-6H,7-9H2,1-2H3;1H	FIVHOHCAXWQPGC-UHFFFAOYSA-N	257.081871092							6712, 6712
Naringin	LSM-2038	Naringin	442428	InChI=1S/C27H32O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-7,10,16,18,20-30,32-36H,8-9H2,1H3/t10-,16-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1	DFPMSGMNTNDNHN-ZPHOTFPESA-N	C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2Oc3cc(O)c4C(=O)C[C@H](Oc4c3)c5ccc(O)cc5)[C@H](O)[C@H](O)[C@H]1O	BroadT	BRD-K02953697	BRD-K02953697-001-01-9	AnalytiCon Discovery GmbH	NP-010660			C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2Oc2cc(O)c3C(=O)C[C@H](Oc3c2)c2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1O	InChI=1S/C27H32O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-7,10,16,18,20-30,32-36H,8-9H2,1H3/t10-,16-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1	DFPMSGMNTNDNHN-ZPHOTFPESA-N	580.179205704							28819
Penitrem A	LSM-2058		6610243	InChI=1S/C37H44ClNO6/c1-15(2)28-27(40)31-37(45-31)23(43-28)9-10-33(6)34(7)18(8-11-35(33,37)41)29-25-24-21(39-30(25)34)14-20(38)17-12-16(3)19-13-22(32(4,5)44-29)36(19,42)26(17)24/h14,18-19,22-23,27-29,31,39-42H,1,3,8-13H2,2,4-7H3/t18-,19+,22+,23-,27-,28+,29-,31+,33+,34+,35-,36+,37-/m0/s1	JDUWHZOLEDOQSR-JKPSMKLGSA-N	CC(=C)[C@H]1O[C@H]2CC[C@]3(C)[C@]4(C)[C@@H](CC[C@@]3(O)[C@]25O[C@@H]5[C@H]1O)[C@@H]6OC(C)(C)[C@H]7C[C@@H]8C(=C)Cc9c(Cl)cc%10[nH]c4c6c%10c9[C@]78O	BroadT	BRD-K03842655	BRD-K03842655-001-02-1	Biomol International Inc.	KC-157	2840(V2)-3-N1305		CC(=C)[C@H]1O[C@H]2CC[C@]3(C)[C@]4(C)[C@@H](CC[C@@]3(O)[C@]22O[C@@H]2[C@H]1O)[C@@H]1OC(C)(C)[C@H]2C[C@@H]3C(=C)Cc5c(Cl)cc6[nH]c4c1c6c5[C@]23O	InChI=1S/C37H44ClNO6/c1-15(2)28-27(40)31-37(45-31)23(43-28)9-10-33(6)34(7)18(8-11-35(33,37)41)29-25-24-21(39-30(25)34)14-20(38)17-12-16(3)19-13-22(32(4,5)44-29)36(19,42)26(17)24/h14,18-19,22-23,27-29,31,39-42H,1,3,8-13H2,2,4-7H3/t18-,19+,22+,23-,27-,28+,29-,31+,33+,34+,35-,36+,37-/m0/s1	JDUWHZOLEDOQSR-JKPSMKLGSA-N	633.285715848							
Tiotidine	LSM-2226	BRD-K11107424	50287	InChI=1S/C10H16N8S2/c1-14-9(16-6-11)15-2-3-19-4-7-5-20-10(17-7)18-8(12)13/h5H,2-4H2,1H3,(H2,14,15,16)(H4,12,13,17,18)	YDDXVAXDYKBWDX-UHFFFAOYSA-N	CNC(=NC#N)NCCSCc1csc(N=C(N)N)n1	BroadT	BRD-K11107424	BRD-K11107424-001-01-1	Tocris Bioscience	826	2		CNC(NCCSCc1csc(N=C(N)N)n1)=NC#N	InChI=1S/C10H16N8S2/c1-14-9(16-6-11)15-2-3-19-4-7-5-20-10(17-7)18-8(12)13/h5H,2-4H2,1H3,(H2,14,15,16)(H4,12,13,17,18)	YDDXVAXDYKBWDX-UHFFFAOYSA-N	312.093933972							92190
Minoxidil	LSM-2134	Minodyl, Minoxidil, Loniten, Rogaine, Theroxidil, U-10858, Men'S Rogaine, Minoxidil Extra Strength, Rogaine Extra Strength	4201	InChI=1S/C9H15N5O/c10-7-6-8(12-9(11)14(7)15)13-4-2-1-3-5-13/h6H,1-5,10H2,(H2,11,12)	ZFMITUMMTDLWHR-UHFFFAOYSA-N	Nc1cc(nc(N)[n+]1[O-])N2CCCCC2	BroadT	BRD-K14888893	BRD-K14888893-001-02-3	Prestwick Chemical Inc.	Prestw-20	D0701-MP04-ST03-200-		Nc1cc(nc(=N)n1O)N1CCCCC1	InChI=1S/C9H15N5O/c10-7-6-8(12-9(11)14(7)15)13-4-2-1-3-5-13/h6,11,15H,1-5,10H2	ZIMGGGWCDYVHOY-UHFFFAOYSA-N	209.12766015							6942
IN1434	LSM-2306	BRD-K14441456	2059	InChI=1S/C20H20N2O3/c21-14-17(12-16-9-10-18(23)19(24)13-16)20(25)22-11-5-4-8-15-6-2-1-3-7-15/h1-3,6-7,9-10,12-13,23-24H,4-5,8,11H2,(H,22,25)	GWCNJMUSWLTSCW-UHFFFAOYSA-N	Oc1ccc(C=C(C#N)C(=O)NCCCCc2ccccc2)cc1O	BroadT	BRD-K14441456	BRD-K14441456-001-01-2	Tocris Bioscience	616	1		Oc1ccc(C=C(C#N)C(=O)NCCCCc2ccccc2)cc1O	InChI=1S/C20H20N2O3/c21-14-17(12-16-9-10-18(23)19(24)13-16)20(25)22-11-5-4-8-15-6-2-1-3-7-15/h1-3,6-7,9-10,12-13,23-24H,4-5,8,11H2,(H,22,25)	GWCNJMUSWLTSCW-UHFFFAOYSA-N	336.14739252							92254
Caffeine	LSM-2026	Theine, Methyltheobromine, Coffeine, Caffeine, Cafcit, Nodoz Caplets And Chewable Tablets	2519	InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3	RYYVLZVUVIJVGH-UHFFFAOYSA-N	CN1C(=O)N(C)c2ncn(C)c2C1=O	BroadT	BRD-K02404261	BRD-K02404261-001-02-7	AnalytiCon Discovery GmbH	NP-004763			Cn1cnc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3	RYYVLZVUVIJVGH-UHFFFAOYSA-N	194.0803756							27732, 27732
IKK Inhibitor VII	LSM-2309	SID50112903, BRD-K14618467	9549298	InChI=1S/C28H29N5OS/c34-27(33-17-12-23(13-18-33)32-15-3-4-16-32)20-7-9-22(10-8-20)30-28-29-14-11-24(31-28)26-19-21-5-1-2-6-25(21)35-26/h1-2,5-11,14,19,23H,3-4,12-13,15-18H2,(H,29,30,31)	BWZJBXAPRCVCKQ-UHFFFAOYSA-N	O=C(N1CCC(CC1)N2CCCC2)c3ccc(Nc4nccc(n4)c5cc6ccccc6s5)cc3	BroadT	BRD-K14618467	BRD-K14618467-003-01-8	Tocris Bioscience	2539	1	Cl	O=C(N1CCC(CC1)N1CCCC1)c1ccc(Nc2nccc(n2)-c2cc3ccccc3s2)cc1.Cl	InChI=1S/C28H29N5OS.ClH/c34-27(33-17-12-23(13-18-33)32-15-3-4-16-32)20-7-9-22(10-8-20)30-28-29-14-11-24(31-28)26-19-21-5-1-2-6-25(21)35-26;/h1-2,5-11,14,19,23H,3-4,12-13,15-18H2,(H,29,30,31);1H	XFVDIVQCZWDBCW-UHFFFAOYSA-N	483.209281288							92257
Cefuroxime	LSM-44947	640/359, Zinacef, Kefurox, Cefuroximine, Cefuroxime	5361202	InChI=1S/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9-/t10-,14-/m1/s1	JFPVXVDWJQMJEE-IZRZKJBUSA-N	CO\N=C(/C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)COC(=O)N)\c3occc3	BroadT	BRD-K02733959	BRD-K02733959-236-02-8	Prestwick Chemical Inc.	Prestw-720	D0701-MP04-ST03-200-	[Na]	CO\N=C(/C(=O)N[C@H]1[C@H]2SCC(COC(N)=O)=C(N2C1=O)C(O)=O)c1ccco1.[Na]	InChI=1S/C16H16N4O8S.Na.H/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20;;/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24);;/b19-9-;;/t10-,14-;;/m1../s1	FEWRHZJCOHFQHI-VMIPEXTJSA-N	424.068884202							3515, 3515
Lasalocid	LSM-2214	Lasalocid, RO-22985	5360807	InChI=1S/C34H54O8/c1-9-25(31-21(6)18-34(11-3,42-31)26-16-17-33(40,10-2)23(8)41-26)30(37)22(7)28(35)19(4)12-14-24-15-13-20(5)29(36)27(24)32(38)39/h13,15,19,21-23,25-26,28,31,35-36,40H,9-12,14,16-18H2,1-8H3,(H,38,39)/t19-,21+,22+,23+,25+,26-,28+,31+,33-,34+/m1/s1	BBMULGJBVDDDNI-OWKLGTHSSA-N	CC[C@H]([C@H]1O[C@@](CC)(C[C@@H]1C)[C@H]2CC[C@](O)(CC)[C@H](C)O2)C(=O)[C@@H](C)[C@@H](O)[C@H](C)CCc3ccc(C)c(O)c3C(=O)O	BroadT	BRD-K10207760	BRD-K10207760-236-03-0	Prestwick Chemical Inc.	Prestw-828	D0701-MP04-ST03-200-	[Na]	CC[C@H]([C@H]1O[C@@](CC)(C[C@@H]1C)[C@H]1CC[C@](O)(CC)[C@H](C)O1)C(=O)[C@@H](C)[C@@H](O)[C@H](C)CCc1ccc(C)c(O)c1C(O)=O.[Na]	InChI=1S/C34H54O8.Na.H/c1-9-25(31-21(6)18-34(11-3,42-31)26-16-17-33(40,10-2)23(8)41-26)30(37)22(7)28(35)19(4)12-14-24-15-13-20(5)29(36)27(24)32(38)39;;/h13,15,19,21-23,25-26,28,31,35-36,40H,9-12,14,16-18H2,1-8H3,(H,38,39);;/t19-,21+,22+,23+,25+,26-,28+,31+,33-,34+;;/m1../s1	ZBUDTVCYXSUIQF-IGVBGIKWSA-N	590.381868688							92181, 92181
Diazepam	LSM-2359	Paxel, Relanium, Scriptopam, Serenack, Stesolid, Tranimul, Valium, Valrelease, Vivol, Apozepam, Diastat, Diazepam, Dizac, RO-52807, WY-3467, LA-III, Q-Pam, Diastat Acudial, Diazepam Intensol, E-Pam	3016	InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3	AAOVKJBEBIDNHE-UHFFFAOYSA-N	CN1C(=O)CN=C(c2ccccc2)c3cc(Cl)ccc13	BroadT	BRD-K16508793	BRD-K16508793-001-01-8	MicroSource Discovery Systems Inc.	1900003			CN1c2ccc(Cl)cc2C(=NCC1=O)c1ccccc1	InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3	AAOVKJBEBIDNHE-UHFFFAOYSA-N	284.071640766							49575, 49575
Harmol	LSM-6720		68094	InChI=1S/C12H10N2O/c1-7-12-10(4-5-13-7)9-3-2-8(15)6-11(9)14-12/h2-6,14-15H,1H3	SATMZMMKDDTOSQ-UHFFFAOYSA-N	Cc1nccc2c3ccc(O)cc3[nH]c12	BroadT	BRD-K01225247	BRD-K01225247-311-03-7	Prestwick Chemical Inc.	Prestw-612	D0701-MP04-ST03-200-	O.Cl	Cc1nccc2c3ccc(O)cc3[nH]c12.O.Cl	InChI=1S/C12H10N2O.ClH.H2O/c1-7-12-10(4-5-13-7)9-3-2-8(15)6-11(9)14-12;;/h2-6,14-15H,1H3;1H;1H2	INUGWPNCFPOEQX-UHFFFAOYSA-N	198.07931296							, , , 
DUP-697	LSM-2119	BRD-K06221026, DUP-697	3177	InChI=1S/C17H12BrFO2S2/c1-23(20,21)14-8-4-11(5-9-14)15-10-16(18)22-17(15)12-2-6-13(19)7-3-12/h2-10H,1H3	AJFTZWGGHJXZOB-UHFFFAOYSA-N	CS(=O)(=O)c1ccc(cc1)c2cc(Br)sc2c3ccc(F)cc3	BroadT	BRD-K06221026	BRD-K06221026-001-03-5	Tocris Bioscience	1430	1		CS(=O)(=O)c1ccc(cc1)-c1cc(Br)sc1-c1ccc(F)cc1	InChI=1S/C17H12BrFO2S2/c1-23(20,21)14-8-4-11(5-9-14)15-10-16(18)22-17(15)12-2-6-13(19)7-3-12/h2-10H,1H3	AJFTZWGGHJXZOB-UHFFFAOYSA-N	409.944611804							4720
ZD-7155	LSM-2232	BRD-K11373525, ZD-7155	4673492	InChI=1S/C26H26N6O/c1-3-19-15-24-22(23(4-2)27-19)13-14-25(33)32(24)16-17-9-11-18(12-10-17)20-7-5-6-8-21(20)26-28-30-31-29-26/h5-12,15H,3-4,13-14,16H2,1-2H3,(H,28,29,30,31)	BFVNEYDCFJNLGN-UHFFFAOYSA-N	CCc1cc2N(Cc3ccc(cc3)c4ccccc4c5nnn[nH]5)C(=O)CCc2c(CC)n1	BroadT	BRD-K11373525	BRD-K11373525-003-01-3	Tocris Bioscience	1211	3	Cl	CCc1cc2N(Cc3ccc(cc3)-c3ccccc3-c3nnn[nH]3)C(=O)CCc2c(CC)n1.Cl	InChI=1S/C26H26N6O.ClH/c1-3-19-15-24-22(23(4-2)27-19)13-14-25(33)32(24)16-17-9-11-18(12-10-17)20-7-5-6-8-21(20)26-28-30-31-29-26;/h5-12,15H,3-4,13-14,16H2,1-2H3,(H,28,29,30,31);1H	NAGGAAHTUXEGFG-UHFFFAOYSA-N	438.216809512							92194, 92194
Fluconazole	LSM-2106	Diflucan, Fluconazole, Triflucan, UK-49858, Diflucan In Sodium Chloride, Fluconazole In Sodium Chloride	3365	InChI=1S/C13H12F2N6O/c14-10-1-2-11(12(15)3-10)13(22,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9,22H,4-5H2	RFHAOTPXVQNOHP-UHFFFAOYSA-N	OC(Cn1cncn1)(Cn2cncn2)c3ccc(F)cc3F	BroadT	BRD-K05977355	BRD-K05977355-001-02-6	MicroSource Discovery Systems Inc.	1503975			OC(Cn1cncn1)(Cn1cncn1)c1ccc(F)cc1F	InChI=1S/C13H12F2N6O/c14-10-1-2-11(12(15)3-10)13(22,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9,22H,4-5H2	RFHAOTPXVQNOHP-UHFFFAOYSA-N	306.104065464							46081, 46081
Trimethoprim	LSM-5246	Trimpex, Trimethoprim, Proloprin, Proloprim, Primsol, Polytrim, Monotrim, Trimpex 200, TCMDC-125538, BW-5672, BW-56-72	5578	InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18)	IEDVJHCEMCRBQM-UHFFFAOYSA-N	COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC	BroadT	BRD-K07208025	BRD-K07208025-001-04-0	MicroSource Discovery Systems Inc.	1500595			COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC	InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18)	IEDVJHCEMCRBQM-UHFFFAOYSA-N	290.137890476							45924, 45924, 45924, 45924, 45924, 45924
(R)-(+)-Bay k 8644	LSM-19958	BRD-K16695519	6604881	InChI=1S/C16H15F3N2O4/c1-8-12(15(22)25-3)13(14(21(23)24)9(2)20-8)10-6-4-5-7-11(10)16(17,18)19/h4-7,13,20H,1-3H3/t13-/m1/s1	ZFLWDHHVRRZMEI-CYBMUJFWSA-N	COC(=O)C1=C(C)NC(=C([C@@H]1c2ccccc2C(F)(F)F)[N+](=O)[O-])C	BroadT	BRD-K16695519	BRD-K16695519-001-01-6	Tocris Bioscience	1545	1		COC(=O)C1=C(C)NC(C)=C([C@@H]1c1ccccc1C(F)(F)F)[N+]([O-])=O	InChI=1S/C16H15F3N2O4/c1-8-12(15(22)25-3)13(14(21(23)24)9(2)20-8)10-6-4-5-7-11(10)16(17,18)19/h4-7,13,20H,1-3H3/t13-/m1/s1	ZFLWDHHVRRZMEI-CYBMUJFWSA-N	356.09839158							131349, 108583
BSPBIO_003237	LSM-42875	Tyrphostin B44, SID50122803	23919058	InChI=1S/C18H16N2O3/c1-12(14-5-3-2-4-6-14)20-18(23)15(11-19)9-13-7-8-16(21)17(22)10-13/h2-10,12,21-22H,1H3,(H,20,23)/b15-9-/t12-/m1/s1	UMGQVUWXNOJOSJ-CDCQXCROSA-N	C[C@@H](NC(=O)\C(=C/c1ccc(O)c(O)c1)\C#N)c2ccccc2	BroadT	BRD-K11158509	BRD-K11158509-001-02-0	MicroSource Discovery Systems Inc.	2300074			C[C@@H](NC(=O)C(=C/c1ccc(O)c(O)c1)\C#N)c1ccccc1	InChI=1S/C18H16N2O3/c1-12(14-5-3-2-4-6-14)20-18(23)15(11-19)9-13-7-8-16(21)17(22)10-13/h2-10,12,21-22H,1H3,(H,20,23)/b15-9-/t12-/m1/s1	UMGQVUWXNOJOSJ-CDCQXCROSA-N	308.116092392							
SCHEMBL12187882	LSM-2029	Protein Tyrosine Phosphatase Inhibitor IV	25035942	InChI=1S/C26H26F6N2O4S2/c1-23(2,19-12-14-21(15-13-19)33-39(35,36)25(27,28)29)17-8-10-18(11-9-17)24(3,4)20-6-5-7-22(16-20)34-40(37,38)26(30,31)32/h5-16,33-34H,1-4H3	PIZLBWAGTLRMSK-UHFFFAOYSA-N	CC(C)(c1ccc(NS(=O)(=O)C(F)(F)F)cc1)c2ccc(cc2)C(C)(C)c3cccc(NS(=O)(=O)C(F)(F)F)c3	BroadT	BRD-K02581333	BRD-K02581333-001-01-8	Calbiochem	540211			CC(C)(c1ccc(NS(=O)(=O)C(F)(F)F)cc1)c1ccc(cc1)C(C)(C)c1cccc(NS(=O)(=O)C(F)(F)F)c1	InChI=1S/C26H26F6N2O4S2/c1-23(2,19-12-14-21(15-13-19)33-39(35,36)25(27,28)29)17-8-10-18(11-9-17)24(3,4)20-6-5-7-22(16-20)34-40(37,38)26(30,31)32/h5-16,33-34H,1-4H3	PIZLBWAGTLRMSK-UHFFFAOYSA-N	608.123817912							92046
Ethyl Everninate	LSM-19959	SID26749540	80201	InChI=1S/C11H14O4/c1-4-15-11(13)10-7(2)5-8(14-3)6-9(10)12/h5-6,12H,4H2,1-3H3	PJOOIAZRUIIQMU-UHFFFAOYSA-N	CCOC(=O)c1c(C)cc(OC)cc1O	BroadT	BRD-K12175788	BRD-K12175788-001-02-5	MicroSource Discovery Systems Inc.	211009			CCOC(=O)c1c(C)cc(OC)cc1O	InChI=1S/C11H14O4/c1-4-15-11(13)10-7(2)5-8(14-3)6-9(10)12/h5-6,12H,4H2,1-3H3	PJOOIAZRUIIQMU-UHFFFAOYSA-N	210.089208928							108584
ZK 164015	LSM-2085	BRD-K05151076, ZK-164015	9806489	InChI=1S/C30H43NO4S/c1-3-4-12-21-36(34,35)22-13-10-8-6-5-7-9-11-20-31-29-19-18-27(33)23-28(29)24(2)30(31)25-14-16-26(32)17-15-25/h14-19,23,32-33H,3-13,20-22H2,1-2H3	LYJSJVYJLZOMCD-UHFFFAOYSA-N	CCCCCS(=O)(=O)CCCCCCCCCCn1c(c(C)c2cc(O)ccc12)c3ccc(O)cc3	BroadT	BRD-K05151076	BRD-K05151076-001-01-8	Tocris Bioscience	2183	1		CCCCCS(=O)(=O)CCCCCCCCCCn1c(c(C)c2cc(O)ccc12)-c1ccc(O)cc1	InChI=1S/C30H43NO4S/c1-3-4-12-21-36(34,35)22-13-10-8-6-5-7-9-11-20-31-29-19-18-27(33)23-28(29)24(2)30(31)25-14-16-26(32)17-15-25/h14-19,23,32-33H,3-13,20-22H2,1-2H3	LYJSJVYJLZOMCD-UHFFFAOYSA-N	513.291279556							92087
Rotenone	LSM-5260		6758	InChI=1S/C23H22O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,16,20-21H,1,8,10H2,2-4H3/t16-,20-,21+/m1/s1	JUVIOZPCNVVQFO-HBGVWJBISA-N	COc1cc2OC[C@H]3Oc4c5C[C@@H](Oc5ccc4C(=O)[C@H]3c2cc1OC)C(=C)C	BroadT	BRD-K08316444	BRD-K08316444-001-02-7	MicroSource Discovery Systems Inc.	200013			COc1cc2OC[C@H]3Oc4c5C[C@@H](Oc5ccc4C(=O)[C@H]3c2cc1OC)C(C)=C	InChI=1S/C23H22O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,16,20-21H,1,8,10H2,2-4H3/t16-,20-,21+/m1/s1	JUVIOZPCNVVQFO-HBGVWJBISA-N	394.141638424							28201
Limonin	LSM-2105	Limonin	179651	InChI=1S/C26H30O8/c1-22(2)15-9-16(27)24(4)14(25(15)12-31-18(28)10-17(25)33-22)5-7-23(3)19(13-6-8-30-11-13)32-21(29)20-26(23,24)34-20/h6,8,11,14-15,17,19-20H,5,7,9-10,12H2,1-4H3/t14-,15-,17-,19-,20+,23-,24-,25+,26+/m0/s1	KBDSLGBFQAGHBE-MSGMIQHVSA-N	CC1(C)O[C@H]2CC(=O)OC[C@]23[C@H]4CC[C@@]5(C)[C@@H](OC(=O)[C@H]6O[C@@]56[C@]4(C)C(=O)C[C@@H]13)c7cocc7	BroadT	BRD-K05906022	BRD-K05906022-001-02-8	AnalytiCon Discovery GmbH	NP-009924			CC1(C)O[C@H]2CC(=O)OC[C@@]22[C@H]1CC(=O)[C@]1(C)[C@@H]2CC[C@@]2(C)[C@@H](OC(=O)[C@H]3O[C@@]123)c1ccoc1	InChI=1S/C26H30O8/c1-22(2)15-9-16(27)24(4)14(25(15)12-31-18(28)10-17(25)33-22)5-7-23(3)19(13-6-8-30-11-13)32-21(29)20-26(23,24)34-20/h6,8,11,14-15,17,19-20H,5,7,9-10,12H2,1-4H3/t14-,15-,17-,19-,20+,23-,24-,25+,26+/m0/s1	KBDSLGBFQAGHBE-MSGMIQHVSA-N	470.19406792							16226
Gemfibrozil	LSM-2227	Gemfibrozil, Lopid, CI-719	3463	InChI=1S/C15H22O3/c1-11-6-7-12(2)13(10-11)18-9-5-8-15(3,4)14(16)17/h6-7,10H,5,8-9H2,1-4H3,(H,16,17)	HEMJJKBWTPKOJG-UHFFFAOYSA-N	Cc1ccc(C)c(OCCCC(C)(C)C(=O)O)c1	BroadT	BRD-K11129031	BRD-K11129031-001-04-4	MicroSource Discovery Systems Inc.	1500313			Cc1ccc(C)c(OCCCC(C)(C)C(O)=O)c1	InChI=1S/C15H22O3/c1-11-6-7-12(2)13(10-11)18-9-5-8-15(3,4)14(16)17/h6-7,10H,5,8-9H2,1-4H3,(H,16,17)	HEMJJKBWTPKOJG-UHFFFAOYSA-N	250.156894564							5296
Saquinavir	LSM-2205	Saquinavir, Invirase, Fortovase, RO-318959000, RO-31-8959	441243	InChI=1S/C38H50N6O5/c1-38(2,3)43-37(49)32-20-26-14-7-8-15-27(26)22-44(32)23-33(45)30(19-24-11-5-4-6-12-24)41-36(48)31(21-34(39)46)42-35(47)29-18-17-25-13-9-10-16-28(25)40-29/h4-6,9-13,16-18,26-27,30-33,45H,7-8,14-15,19-23H2,1-3H3,(H2,39,46)(H,41,48)(H,42,47)(H,43,49)/t26-,27+,30-,31-,32-,33+/m0/s1	QWAXKHKRTORLEM-UGJKXSETSA-N	CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1C[C@@H](O)[C@H](Cc3ccccc3)NC(=O)[C@H](CC(=O)N)NC(=O)c4ccc5ccccc5n4	BroadT	BRD-K09963420	BRD-K09963420-066-03-4	Prestwick Chemical Inc.	Prestw-1114	D0701-MP04-ST03-200-	CS(=O)(=O)O	CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccc2ccccc2n1.CS(=O)(=O)O	InChI=1S/C38H50N6O5.CH4O3S/c1-38(2,3)43-37(49)32-20-26-14-7-8-15-27(26)22-44(32)23-33(45)30(19-24-11-5-4-6-12-24)41-36(48)31(21-34(39)46)42-35(47)29-18-17-25-13-9-10-16-28(25)40-29;1-5(2,3)4/h4-6,9-13,16-18,26-27,30-33,45H,7-8,14-15,19-23H2,1-3H3,(H2,39,46)(H,41,48)(H,42,47)(H,43,49);1H3,(H,2,3,4)/t26-,27+,30-,31-,32-,33+;/m0./s1	IRHXGOXEBNJUSN-YOXDLBRISA-N	670.38426876							63621, 63621
Hydrocortisone Acetate	LSM-19960	50-03-3, Hydrocortone, Dricort, Cortril, Cortifoam, BRD-K11612998, Orabase HCA, Micort-HC, Hydrocortisone Acetate, Hemsol-HC, Cortef Acetate	5744	InChI=1S/C23H32O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h10,16-18,20,26,28H,4-9,11-12H2,1-3H3/t16-,17-,18-,20+,21-,22-,23-/m0/s1	ALEXXDVDDISNDU-JZYPGELDSA-N	CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C	BroadT	BRD-K11612998	BRD-K11612998-001-01-6	AnalytiCon Discovery GmbH	NP-010999			CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C	InChI=1S/C23H32O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h10,16-18,20,26,28H,4-9,11-12H2,1-3H3/t16-,17-,18-,20+,21-,22-,23-/m0/s1	ALEXXDVDDISNDU-JZYPGELDSA-N	404.219888744							17609
8-Iodocatechin tetramethyl ether	LSM-19961	BRD-K07396820	6708556	InChI=1S/C19H21IO6/c1-22-13-6-5-10(7-15(13)24-3)18-12(21)8-11-14(23-2)9-16(25-4)17(20)19(11)26-18/h5-7,9,12,18,21H,8H2,1-4H3/t12-,18+/m0/s1	VTUMIISWLFIURS-KPZWWZAWSA-N	COc1ccc(cc1OC)[C@H]2Oc3c(I)c(OC)cc(OC)c3C[C@@H]2O	BroadT	BRD-K07396820	BRD-K07396820-001-02-4	MicroSource Discovery Systems Inc.	240567			COc1ccc(cc1OC)[C@H]1Oc2c(I)c(OC)cc(OC)c2C[C@@H]1O	InChI=1S/C19H21IO6/c1-22-13-6-5-10(7-15(13)24-3)18-12(21)8-11-14(23-2)9-16(25-4)17(20)19(11)26-18/h5-7,9,12,18,21H,8H2,1-4H3/t12-,18+/m0/s1	VTUMIISWLFIURS-KPZWWZAWSA-N	472.038281392							108585
SC-560	LSM-2314	SC-560, BRD-K14767410	4306515	InChI=1S/C17H12ClF3N2O/c1-24-14-8-6-13(7-9-14)23-15(10-16(22-23)17(19,20)21)11-2-4-12(18)5-3-11/h2-10H,1H3	PQUGCKBLVKJMNT-UHFFFAOYSA-N	COc1ccc(cc1)n2nc(cc2c3ccc(Cl)cc3)C(F)(F)F	BroadT	BRD-K14767410	BRD-K14767410-001-01-5	Tocris Bioscience	1550	1		COc1ccc(cc1)-n1nc(cc1-c1ccc(Cl)cc1)C(F)(F)F	InChI=1S/C17H12ClF3N2O/c1-24-14-8-6-13(7-9-14)23-15(10-16(22-23)17(19,20)21)11-2-4-12(18)5-3-11/h2-10H,1H3	PQUGCKBLVKJMNT-UHFFFAOYSA-N	352.059025334							76274
Chloroxylenol	LSM-19962	Chloroxylenol, Chloro-Xylenol	2723	InChI=1S/C8H9ClO/c1-5-3-7(10)4-6(2)8(5)9/h3-4,10H,1-2H3	OSDLLIBGSJNGJE-UHFFFAOYSA-N	Cc1cc(O)cc(C)c1Cl	BroadT	BRD-K17223896	BRD-K17223896-001-02-7	MicroSource Discovery Systems Inc.	1500182			Cc1cc(O)cc(C)c1Cl	InChI=1S/C8H9ClO/c1-5-3-7(10)4-6(2)8(5)9/h3-4,10H,1-2H3	OSDLLIBGSJNGJE-UHFFFAOYSA-N	156.034192618							34393
151057-13-5	LSM-2212	L-701,252, L-701252	54687453	InChI=1S/C13H10ClNO3/c14-7-3-4-8-9(5-7)15-13(18)10(12(8)17)11(16)6-1-2-6/h3-6H,1-2H2,(H2,15,17,18)	MXEFWCFPCLDOOG-UHFFFAOYSA-N	OC1=C(C(=O)C2CC2)C(=O)Nc3cc(Cl)ccc13	BroadT	BRD-K10176267	BRD-K10176267-001-01-7	Biomol International Inc.	EA-143	2817-N1277		Oc1c(C(=O)C2CC2)c(=O)[nH]c2cc(Cl)ccc12	InChI=1S/C13H10ClNO3/c14-7-3-4-8-9(5-7)15-13(18)10(12(8)17)11(16)6-1-2-6/h3-6H,1-2H2,(H2,15,17,18)	MXEFWCFPCLDOOG-UHFFFAOYSA-N	263.0349209							92179
Diclofenac	LSM-2160	Cataflam, Diclofenac, Solaraze, Voltaren, Cambia, Arthrotec, Voltaren Ophthalmic, Voltaren XR, Voltaren-XR	3033	InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)	DCOPUUMXTXDBNB-UHFFFAOYSA-N	OC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl	BroadT	BRD-K08252256	BRD-K08252256-236-04-9	MicroSource Discovery Systems Inc.	1500237		[Na]	OC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl.[Na]	InChI=1S/C14H11Cl2NO2.Na.H/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19;;/h1-7,17H,8H2,(H,18,19);;	ZKAWZNIEBVXRDW-UHFFFAOYSA-N	295.016684022							47381, 47381, 47381, 47381, 47381
Beta-Peltatin A	LSM-19963	Beta-Peltatin	92122	InChI=1S/C22H22O8/c1-25-14-5-10(6-15(26-2)20(14)27-3)17-12-7-16-21(30-9-29-16)19(23)13(12)4-11-8-28-22(24)18(11)17/h5-7,11,17-18,23H,4,8-9H2,1-3H3/t11-,17+,18-/m0/s1	HLBPOYVRLSXWJJ-PDSMFRHLSA-N	COc1cc(cc(OC)c1OC)[C@H]2[C@@H]3[C@H](COC3=O)Cc4c(O)c5OCOc5cc24	BroadT	BRD-K13265046	BRD-K13265046-001-01-3	MicroSource Discovery Systems Inc.	1504739			COc1cc(cc(OC)c1OC)[C@H]1[C@@H]2[C@H](COC2=O)Cc2c(O)c3OCOc3cc12	InChI=1S/C22H22O8/c1-25-14-5-10(6-15(26-2)20(14)27-3)17-12-7-16-21(30-9-29-16)19(23)13(12)4-11-8-28-22(24)18(11)17/h5-7,11,17-18,23H,4,8-9H2,1-3H3/t11-,17+,18-/m0/s1	HLBPOYVRLSXWJJ-PDSMFRHLSA-N	414.131467664							74867
Fccp	LSM-2317	Carbonyl Cyanide P-Trifluoromethoxyphenyl Hydrazone	3330	InChI=1S/C10H5F3N4O/c11-10(12,13)18-9-3-1-7(2-4-9)16-17-8(5-14)6-15/h1-4,16H	BMZRVOVNUMQTIN-UHFFFAOYSA-N	FC(F)(F)Oc1ccc(NN=C(C#N)C#N)cc1	BroadT	BRD-K14821540	BRD-K14821540-001-02-1	Biomol International Inc.	CM120	2840(V2)-3-N1305		FC(F)(F)Oc1ccc(NN=C(C#N)C#N)cc1	InChI=1S/C10H5F3N4O/c11-10(12,13)18-9-3-1-7(2-4-9)16-17-8(5-14)6-15/h1-4,16H	BMZRVOVNUMQTIN-UHFFFAOYSA-N	254.04154542							75458
Thioproperazine	LSM-2170	Thioproperazine	9429	InChI=1S/C22H30N4O2S2/c1-23(2)30(27,28)18-9-10-22-20(17-18)26(19-7-4-5-8-21(19)29-22)12-6-11-25-15-13-24(3)14-16-25/h4-5,7-10,17H,6,11-16H2,1-3H3	VZYCZNZBPPHOFY-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc2Sc3ccccc3N(CCCN4CCN(C)CC4)c2c1	BroadT	BRD-K08619574	BRD-K08619574-334-03-9	Prestwick Chemical Inc.	Prestw-149	D0701-MP04-ST03-200-	CS(=O)(=O)O.CS(=O)(=O)O	CN(C)S(=O)(=O)c1ccc2Sc3ccccc3N(CCCN3CCN(C)CC3)c2c1.CS(=O)(=O)O.CS(=O)(=O)O	InChI=1S/C22H30N4O2S2.2CH4O3S/c1-23(2)30(27,28)18-9-10-22-20(17-18)26(19-7-4-5-8-21(19)29-22)12-6-11-25-15-13-24(3)14-16-25;2*1-5(2,3)4/h4-5,7-10,17H,6,11-16H2,1-3H3;2*1H3,(H,2,3,4)	QPMDKXBBAVQDCB-UHFFFAOYSA-N	446.18101762							59120, 59120, 59120
Nbqx	LSM-3054	Nbqx, BRD-K47717570, SID11113877, SID90340695	3272524	InChI=1S/C12H8N4O6S/c13-23(21,22)8-3-1-2-5-9(8)7(16(19)20)4-6-10(5)15-12(18)11(17)14-6/h1-4H,(H,14,17)(H,15,18)(H2,13,21,22)	UQNAFPHGVPVTAL-UHFFFAOYSA-N	NS(=O)(=O)c1cccc2c3nc(O)c(O)nc3cc(c12)[N+](=O)[O-]	BroadT	BRD-K11796549	BRD-K11796549-001-01-1	Biomol International Inc.	AC-437	2817-N1277		NS(=O)(=O)c1cccc2c1c(cc1[nH]c(=O)c(=O)[nH]c21)[N+]([O-])=O	InChI=1S/C12H8N4O6S/c13-23(21,22)8-3-1-2-5-9(8)7(16(19)20)4-6-10(5)15-12(18)11(17)14-6/h1-4H,(H,14,17)(H,15,18)(H2,13,21,22)	UQNAFPHGVPVTAL-UHFFFAOYSA-N	336.016454706							31073, 31073
Velnacrine	LSM-1959	Velnacrine	3655	InChI=1S/C13H14N2O/c14-13-8-4-1-2-5-9(8)15-10-6-3-7-11(16)12(10)13/h1-2,4-5,11,16H,3,6-7H2,(H2,14,15)	HLVVITIHAZBPKB-UHFFFAOYSA-N	Nc1c2C(O)CCCc2nc3ccccc13	BroadT	BRD-A98299281	BRD-A98299281-050-03-9	MicroSource Discovery Systems Inc.	2300100		OC(=O)/C=C\C(=O)O	Nc1c2C(O)CCCc2nc2ccccc12.OC(=O)/C=C\C(=O)O	InChI=1S/C13H14N2O.C4H4O4/c14-13-8-4-1-2-5-9(8)15-10-6-3-7-11(16)12(10)13;5-3(6)1-2-4(7)8/h1-2,4-5,11,16H,3,6-7H2,(H2,14,15);1-2H,(H,5,6)(H,7,8)/b;2-1-	NEEKVKZFYBQFGT-BTJKTKAUSA-N	214.110613088							91990, 91990
Sericetin	LSM-2095	SID26749850	4020240	InChI=1S/C25H24O5/c1-14(2)10-11-17-23-16(12-13-25(3,4)30-23)19(26)18-20(27)21(28)22(29-24(17)18)15-8-6-5-7-9-15/h5-10,12-13,26,28H,11H2,1-4H3	BPGVKIFGOXGHPB-UHFFFAOYSA-N	CC(=CCc1c2OC(=C(O)C(=O)c2c(O)c3C=CC(C)(C)Oc13)c4ccccc4)C	BroadT	BRD-K05433219	BRD-K05433219-001-02-6	MicroSource Discovery Systems Inc.	201581			CC(C)=CCc1c2OC(C)(C)C=Cc2c(O)c2c1oc(-c1ccccc1)c(O)c2=O	InChI=1S/C25H24O5/c1-14(2)10-11-17-23-16(12-13-25(3,4)30-23)19(26)18-20(27)21(28)22(29-24(17)18)15-8-6-5-7-9-15/h5-10,12-13,26,28H,11H2,1-4H3	BPGVKIFGOXGHPB-UHFFFAOYSA-N	404.162373868							92096
KBIO3_002763	LSM-2174	Sericetin Dimethyl Ether	6710761	InChI=1S/C27H28O5/c1-16(2)12-13-18-23-19(14-15-27(3,4)32-23)24(29-5)20-21(28)26(30-6)22(31-25(18)20)17-10-8-7-9-11-17/h7-12,14-15H,13H2,1-6H3	LSQXCBMBEAHLQO-UHFFFAOYSA-N	COC1=C(Oc2c(CC=C(C)C)c3OC(C)(C)C=Cc3c(OC)c2C1=O)c4ccccc4	BroadT	BRD-K08714182	BRD-K08714182-001-01-1	MicroSource Discovery Systems Inc.	201585			COc1c2C=CC(C)(C)Oc2c(CC=C(C)C)c2oc(-c3ccccc3)c(OC)c(=O)c12	InChI=1S/C27H28O5/c1-16(2)12-13-18-23-19(14-15-27(3,4)32-23)24(29-5)20-21(28)26(30-6)22(31-25(18)20)17-10-8-7-9-11-17/h7-12,14-15H,13H2,1-6H3	LSQXCBMBEAHLQO-UHFFFAOYSA-N	432.193673996							92151
TCMDC-125843	LSM-2337	BRD-K15522385	5913	InChI=1S/C20H24N2OS/c1-22(2)15-8-16-24-19-12-7-6-11-18(19)21-20(23)14-13-17-9-4-3-5-10-17/h3-7,9-14H,8,15-16H2,1-2H3,(H,21,23)	RSUVYMGADVXGOU-UHFFFAOYSA-N	CN(C)CCCSc1ccccc1NC(=O)C=Cc2ccccc2	BroadT	BRD-K15522385	BRD-K15522385-003-01-0	Tocris Bioscience	460	2	Cl	CN(C)CCCSc1ccccc1NC(=O)C=Cc1ccccc1.Cl	InChI=1S/C20H24N2OS.ClH/c1-22(2)15-8-16-24-19-12-7-6-11-18(19)21-20(23)14-13-17-9-4-3-5-10-17;/h3-7,9-14H,8,15-16H2,1-2H3,(H,21,23);1H	LXGJPDKYMJJWRB-UHFFFAOYSA-N	340.160934098							92281
NCGC00025073-01	LSM-2384	KB-R7943, SID11113991	4534086	InChI=1S/C16H17N3O3S/c17-16(18)23-10-9-12-3-7-15(8-4-12)22-11-13-1-5-14(6-2-13)19(20)21/h1-8H,9-11H2,(H3,17,18)	UMJUNUMSJDTYTM-UHFFFAOYSA-N	NC(=N)SCCc1ccc(OCc2ccc(cc2)[N+](=O)[O-])cc1	BroadT	BRD-K17743697	BRD-K17743697-066-01-0	EMD Biosciences	420336		CS(=O)(=O)O	NC(=N)SCCc1ccc(OCc2ccc(cc2)[N+]([O-])=O)cc1.CS(=O)(=O)O	InChI=1S/C16H17N3O3S.CH4O3S/c17-16(18)23-10-9-12-3-7-15(8-4-12)22-11-13-1-5-14(6-2-13)19(20)21;1-5(2,3)4/h1-8H,9-11H2,(H3,17,18);1H3,(H,2,3,4)	WGIKEBHIKKWJLG-UHFFFAOYSA-N	331.099062124							92316
Ketoprofen	LSM-1955	Nexcede, Orudis, Ketoprofen, Oruvail, Actron, R.P. 19583, RP-19583, Orudis KT	3825	InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)	DKYWVDODHFEZIM-UHFFFAOYSA-N	CC(C(=O)O)c1cccc(c1)C(=O)c2ccccc2	BroadT	BRD-A97739905	BRD-A97739905-001-04-2	MicroSource Discovery Systems Inc.	1501215			CC(C(O)=O)c1cccc(c1)C(=O)c1ccccc1	InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)	DKYWVDODHFEZIM-UHFFFAOYSA-N	254.094294308							6128, 6128
Fenoterol	LSM-1948	Fenoterol, TH-1165A [AS HYDROBROMIDE SALT], Fenoterol Hydrobromide, Berotec [As Hydrobromide]	3343	InChI=1S/C17H21NO4/c1-11(6-12-2-4-14(19)5-3-12)18-10-17(22)13-7-15(20)9-16(21)8-13/h2-5,7-9,11,17-22H,6,10H2,1H3	LSLYOANBFKQKPT-UHFFFAOYSA-N	CC(Cc1ccc(O)cc1)NCC(O)c2cc(O)cc(O)c2	BroadT	BRD-A97104540	BRD-A97104540-004-04-4	Prestwick Chemical Inc.	Prestw-282	D0701-MP04-ST03-200-	Br	CC(Cc1ccc(O)cc1)NCC(O)c1cc(O)cc(O)c1.Br	InChI=1S/C17H21NO4.BrH/c1-11(6-12-2-4-14(19)5-3-12)18-10-17(22)13-7-15(20)9-16(21)8-13;/h2-5,7-9,11,17-22H,6,10H2,1H3;1H	SGZRQMALQBXAIQ-UHFFFAOYSA-N	303.147058162							149226, 149226
Isokobusone	LSM-19964	SID26749599	3860435	InChI=1S/C14H22O2/c1-9-4-5-11-10(8-14(11,2)3)13(16)7-6-12(9)15/h10-12,15H,1,4-8H2,2-3H3	BSFUDCIRZBAPDS-UHFFFAOYSA-N	CC1(C)CC2C1CCC(=C)C(O)CCC2=O	BroadT	BRD-A97152619	BRD-A97152619-001-02-9	MicroSource Discovery Systems Inc.	300117			CC1(C)CC2C1CCC(=C)C(O)CCC2=O	InChI=1S/C14H22O2/c1-9-4-5-11-10(8-14(11,2)3)13(16)7-6-12(9)15/h10-12,15H,1,4-8H2,2-3H3	BSFUDCIRZBAPDS-UHFFFAOYSA-N	222.161979944							108586
ZINC03978806	LSM-19965	BRD-K03470412	40469790	InChI=1S/C10H12O3/c1-2-3-10-8(4-6-11)9(12)5-7-13-10/h5-7H,2-4H2,1H3	AOJCEJLTPMUITR-UHFFFAOYSA-N	CCCC1=C(CC=O)C(=O)C=CO1	BroadT	BRD-K03470412	BRD-K03470412-001-02-5	MicroSource Discovery Systems Inc.	1504090			CCCc1occc(=O)c1CC=O	InChI=1S/C10H12O3/c1-2-3-10-8(4-6-11)9(12)5-7-13-10/h5-7H,2-4H2,1H3	AOJCEJLTPMUITR-UHFFFAOYSA-N	180.078644244							108587
Ticlopidine	LSM-1986	Ticlopidine, Ticlopidine Hydrochloride	5472	InChI=1S/C14H14ClNS/c15-13-4-2-1-3-11(13)9-16-7-5-14-12(10-16)6-8-17-14/h1-4,6,8H,5,7,9-10H2	PHWBOXQYWZNQIN-UHFFFAOYSA-N	Clc1ccccc1CN2CCc3sccc3C2	BroadT	BRD-K00603606	BRD-K00603606-003-03-4	Prestwick Chemical Inc.	Prestw-47	D0701-MP04-ST03-200-	Cl	Clc1ccccc1CN1CCc2sccc2C1.Cl	InChI=1S/C14H14ClNS.ClH/c15-13-4-2-1-3-11(13)9-16-7-5-14-12(10-16)6-8-17-14;/h1-4,6,8H,5,7,9-10H2;1H	MTKNGOHFNXIVOS-UHFFFAOYSA-N	263.053547858							9588
Dicloxacillin	LSM-5234	Pathocil, Dynapen, Dycill, Dicloxacillin, R-13423, BRL-1702	18381	InChI=1S/C19H17Cl2N3O5S/c1-7-10(12(23-29-7)11-8(20)5-4-6-9(11)21)15(25)22-13-16(26)24-14(18(27)28)19(2,3)30-17(13)24/h4-6,13-14,17H,1-3H3,(H,22,25)(H,27,28)/t13-,14+,17-/m1/s1	YFAGHNZHGGCZAX-JKIFEVAISA-N	Cc1onc(c1C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O)c4c(Cl)cccc4Cl	BroadT	BRD-K05673000	BRD-K05673000-323-02-8	Prestwick Chemical Inc.	Prestw-450	D0701-MP04-ST03-200-	O.[Na]	Cc1onc(c1C(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C(O)=O)-c1c(Cl)cccc1Cl.O.[Na]	InChI=1S/C19H17Cl2N3O5S.Na.H2O.H/c1-7-10(12(23-29-7)11-8(20)5-4-6-9(11)21)15(25)22-13-16(26)24-14(18(27)28)19(2,3)30-17(13)24;;;/h4-6,13-14,17H,1-3H3,(H,22,25)(H,27,28);;1H2;/t13-,14+,17-;;;/m1.../s1	OENROYLPCNZEEG-MBGFYOAHSA-N	469.026596784							4511, 4511, 4511
Quinelorane	LSM-2277	Quinelorane, Quinerolane	57242	InChI=1S/C14H22N4/c1-2-5-18-6-3-4-10-7-12-11(8-13(10)18)9-16-14(15)17-12/h9-10,13H,2-8H2,1H3,(H2,15,16,17)/t10-,13-/m1/s1	TUFADSGTJUOBEH-ZWNOBZJWSA-N	CCCN1CCC[C@@H]2Cc3nc(N)ncc3C[C@@H]12	BroadT	BRD-K13261168	BRD-K13261168-001-01-4	Biomol International Inc.	AC-756	2812-3-N1298		CCCN1CCC[C@@H]2Cc3nc(N)ncc3C[C@@H]12	InChI=1S/C14H22N4/c1-2-5-18-6-3-4-10-7-12-11(8-13(10)18)9-16-14(15)17-12/h9-10,13H,2-8H2,1H3,(H2,15,16,17)/t10-,13-/m1/s1	TUFADSGTJUOBEH-ZWNOBZJWSA-N	246.184446744							92230, 92230, 92230
Acetyltryptophanamide	LSM-19966	AC-TRP-NH2	94230	InChI=1S/C13H15N3O2/c1-8(17)16-12(13(14)18)6-9-7-15-11-5-3-2-4-10(9)11/h2-5,7,12,15H,6H2,1H3,(H2,14,18)(H,16,17)/t12-/m0/s1	HNGIZKAMDMBRKJ-LBPRGKRZSA-N	CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N	BroadT	BRD-K10171338	BRD-K10171338-001-02-1	MicroSource Discovery Systems Inc.	1500699			CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O	InChI=1S/C13H15N3O2/c1-8(17)16-12(13(14)18)6-9-7-15-11-5-3-2-4-10(9)11/h2-5,7,12,15H,6H2,1H3,(H2,14,18)(H,16,17)/t12-/m0/s1	HNGIZKAMDMBRKJ-LBPRGKRZSA-N	245.11642675							108588
Ethisterone	LSM-2061	Ethisterone, Pranone, Pregneninolone, Syngestrotabs, Trosinone, Anhydrohydroxyprogesterone, Ora-Lutin	5284557	InChI=1S/C21H28O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h1,13,16-18,23H,5-12H2,2-3H3/t16-,17+,18+,19+,20+,21+/m1/s1	CHNXZKVNWQUJIB-CEGNMAFCSA-N	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@@]4(C)[C@H]3CC[C@@]4(O)C#C	BroadT	BRD-K03981224	BRD-K03981224-001-02-9	Prestwick Chemical Inc.	Prestw-261	D0701-MP04-ST03-200-		C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@]2(O)C#C	InChI=1S/C21H28O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h1,13,16-18,23H,5-12H2,2-3H3/t16-,17+,18+,19+,20+,21+/m1/s1	CHNXZKVNWQUJIB-CEGNMAFCSA-N	312.208930136							34749
Apoptosis Activator II	LSM-2329	SID125317306, SID11114274, Apoptosis-Activator-II	1901244	InChI=1S/C15H9Cl2NO2/c16-11-6-5-9(7-12(11)17)8-18-13-4-2-1-3-10(13)14(19)15(18)20/h1-7H,8H2	KGRJPLRFGLMQMV-UHFFFAOYSA-N	Clc1ccc(CN2C(=O)C(=O)c3ccccc23)cc1Cl	BroadT	BRD-K15164005	BRD-K15164005-001-01-5	EMD Biosciences	178492			Clc1ccc(CN2C(=O)C(=O)c3ccccc23)cc1Cl	InChI=1S/C15H9Cl2NO2/c16-11-6-5-9(7-12(11)17)8-18-13-4-2-1-3-10(13)14(19)15(18)20/h1-7H,8H2	KGRJPLRFGLMQMV-UHFFFAOYSA-N	305.001033958							92273
S-Isopropyl-Isothiourea	LSM-15203	2-Isopropyl-Isothiourea, BRD-K10673031	445319	InChI=1S/C4H10N2S/c1-3(2)7-4(5)6/h3H,1-2H3,(H3,5,6)	XSSNABKEYXKKMK-UHFFFAOYSA-N	CC(C)SC(=N)N	BroadT	BRD-K10673031	BRD-K10673031-004-01-2	Tocris Bioscience	897	1	Br	CC(C)SC(N)=N.Br	InChI=1S/C4H10N2S.BrH/c1-3(2)7-4(5)6;/h3H,1-2H3,(H3,5,6);1H	SLGVZEOMLCTKRK-UHFFFAOYSA-N	118.05646903							
181144-66-1	LSM-2180	BRD-K08890269	44483319	InChI=1S/C14H12FN3O2/c15-11-3-7-13(8-4-11)20-12-5-1-10(2-6-12)9-17-18-14(16)19/h1-9H,(H3,16,18,19)	MHUUDVZSPFRUSK-UHFFFAOYSA-N	NC(=O)NN=Cc1ccc(Oc2ccc(F)cc2)cc1	BroadT	BRD-K08890269	BRD-K08890269-001-01-5	Tocris Bioscience	2642	1		NC(=O)NN=Cc1ccc(Oc2ccc(F)cc2)cc1	InChI=1S/C14H12FN3O2/c15-11-3-7-13(8-4-11)20-12-5-1-10(2-6-12)9-17-18-14(16)19/h1-9H,(H3,16,18,19)	MHUUDVZSPFRUSK-UHFFFAOYSA-N	273.091354854							92156
Dihydrospatheliachromene	LSM-19967		609688	InChI=1S/C15H16O4/c1-8-6-10(16)13-12(18-8)7-11-9(14(13)17)4-5-15(2,3)19-11/h6-7,17H,4-5H2,1-3H3	IQJZOBSXWBOFSO-UHFFFAOYSA-N	CC1=CC(=O)c2c(O)c3CCC(C)(C)Oc3cc2O1	BroadT	BRD-K07565511	BRD-K07565511-001-02-8	MicroSource Discovery Systems Inc.	100531			Cc1cc(=O)c2c(O)c3CCC(C)(C)Oc3cc2o1	InChI=1S/C15H16O4/c1-8-6-10(16)13-12(18-8)7-11-9(14(13)17)4-5-15(2,3)19-11/h6-7,17H,4-5H2,1-3H3	IQJZOBSXWBOFSO-UHFFFAOYSA-N	260.104858992							108589
Rutilantinone	LSM-19968		159908	InChI=1S/C22H20O9/c1-3-22(30)7-12(25)13-8(17(22)21(29)31-2)6-9-14(19(13)27)20(28)16-11(24)5-4-10(23)15(16)18(9)26/h4-6,12,17,23-25,27,30H,3,7H2,1-2H3/t12-,17-,22+/m0/s1	RWCVSDKDFSVZNF-KRYGIPSASA-N	CC[C@@]1(O)C[C@H](O)c2c(O)c3C(=O)c4c(O)ccc(O)c4C(=O)c3cc2[C@H]1C(=O)OC	BroadT	BRD-K11258719	BRD-K11258719-001-02-4	MicroSource Discovery Systems Inc.	201606			CC[C@@]1(O)C[C@H](O)c2c(cc3C(=O)c4c(O)ccc(O)c4C(=O)c3c2O)[C@H]1C(=O)OC	InChI=1S/C22H20O9/c1-3-22(30)7-12(25)13-8(17(22)21(29)31-2)6-9-14(19(13)27)20(28)16-11(24)5-4-10(23)15(16)18(9)26/h4-6,12,17,23-25,27,30H,3,7H2,1-2H3/t12-,17-,22+/m0/s1	RWCVSDKDFSVZNF-KRYGIPSASA-N	428.11073222							108590
7-Nitroindazole	LSM-5222	7-Nitroindazole, 7- Nitroindazole, SID11113712	1893	InChI=1S/C7H5N3O2/c11-10(12)6-3-1-2-5-4-8-9-7(5)6/h1-4H,(H,8,9)	PQCAUHUKTBHUSA-UHFFFAOYSA-N	[O-][N+](=O)c1cccc2cn[nH]c12	BroadT	BRD-K04430056	BRD-K04430056-001-02-9	MicroSource Discovery Systems Inc.	1505342			[O-][N+](=O)c1cccc2cn[nH]c12	InChI=1S/C7H5N3O2/c11-10(12)6-3-1-2-5-4-8-9-7(5)6/h1-4H,(H,8,9)	PQCAUHUKTBHUSA-UHFFFAOYSA-N	163.03817643							
Clemizole	LSM-5225	Clemizole, AL-20, Clemizole HCl	2782	InChI=1S/C19H20ClN3/c20-16-9-7-15(8-10-16)13-23-18-6-2-1-5-17(18)21-19(23)14-22-11-3-4-12-22/h1-2,5-10H,3-4,11-14H2	CJXAEXPPLWQRFR-UHFFFAOYSA-N	Clc1ccc(Cn2c(CN3CCCC3)nc4ccccc24)cc1	BroadT	BRD-K04704168	BRD-K04704168-003-03-6	Prestwick Chemical Inc.	Prestw-227	D0701-MP04-ST03-200-	Cl	Clc1ccc(Cn2c(CN3CCCC3)nc3ccccc23)cc1.Cl	InChI=1S/C19H20ClN3.ClH/c20-16-9-7-15(8-10-16)13-23-18-6-2-1-5-17(18)21-19(23)14-22-11-3-4-12-22;/h1-2,5-10H,3-4,11-14H2;1H	DNFMJYXRIMLMBZ-UHFFFAOYSA-N	325.13457538							52140, 52140
Furazolidone	LSM-44949	Chebi, Furazolidone, Nifurazolidone, Furoxone, Furall	5353636	InChI=1S/C8H7N3O5/c12-8-10(3-4-15-8)9-5-6-1-2-7(16-6)11(13)14/h1-2,5H,3-4H2/b9-5+	PLHJDBGFXBMTGZ-WEVVVXLNSA-N	[O-][N+](=O)c1oc(\C=N\N2CCOC2=O)cc1	BroadT	BRD-K11756522	BRD-K11756522-001-03-2	MicroSource Discovery Systems Inc.	1500309			[O-][N+](=O)c1ccc(\C=N\N2CCOC2=O)o1	InChI=1S/C8H7N3O5/c12-8-10(3-4-15-8)9-5-6-1-2-7(16-6)11(13)14/h1-2,5H,3-4H2/b9-5+	PLHJDBGFXBMTGZ-WEVVVXLNSA-N	225.038570354							
Anthraquinone	LSM-19969	9,10-Anthraquinone, Anthraquinone, Anthracene-9,10-Dione	6780	InChI=1S/C14H8O2/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-8H	RZVHIXYEVGDQDX-UHFFFAOYSA-N	O=C1c2ccccc2C(=O)c3ccccc13	BroadT	BRD-K15957397	BRD-K15957397-001-02-6	MicroSource Discovery Systems Inc.	1502103			O=C1c2ccccc2C(=O)c2ccccc12	InChI=1S/C14H8O2/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-8H	RZVHIXYEVGDQDX-UHFFFAOYSA-N	208.052429496							40448
Clothiapine	LSM-19970	Clotiapine, Clothiapine, HF-2159	16351	InChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3	KAAZGXDPUNNEFN-UHFFFAOYSA-N	CN1CCN(CC1)C2=Nc3ccccc3Sc4ccc(Cl)cc24	BroadT	BRD-K10990317	BRD-K10990317-001-01-1	Biomol International Inc.	D-108	2812-3-N1298		CN1CCN(CC1)C1=Nc2ccccc2Sc2ccc(Cl)cc12	InChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3	KAAZGXDPUNNEFN-UHFFFAOYSA-N	343.090996006							108591
Fanchinin	LSM-6539	Tetrandrine, NSC-77037	73078	InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30-/m0/s1	WVTKBKWTSCPRNU-KYJUHHDHSA-N	COc1ccc2C[C@@H]3N(C)CCc4cc(OC)c(OC)c(Oc5cc6[C@H](Cc7ccc(Oc1c2)cc7)N(C)CCc6cc5OC)c34	BroadT	BRD-K08078237	BRD-K08078237-001-04-0	MicroSource Discovery Systems Inc.	1504185			COc1ccc2C[C@@H]3N(C)CCc4cc(OC)c(OC)c(Oc5cc6[C@H](Cc7ccc(Oc1c2)cc7)N(C)CCc6cc5OC)c34	InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30-/m0/s1	WVTKBKWTSCPRNU-KYJUHHDHSA-N	622.304287084							49
DH 97	LSM-2108	BRD-K06014311, SID11113967, SID26752112	3467177	InChI=1S/C22H26N2O/c1-2-3-13-22(25)23-15-14-19-18-11-7-8-12-20(18)24-21(19)16-17-9-5-4-6-10-17/h4-12,24H,2-3,13-16H2,1H3,(H,23,25)	HDOIPCLEKCEANF-UHFFFAOYSA-N	CCCCC(=O)NCCc1c(Cc2ccccc2)[nH]c3ccccc13	BroadT	BRD-K06014311	BRD-K06014311-001-01-2	Tocris Bioscience	1218	1		CCCCC(=O)NCCc1c(Cc2ccccc2)[nH]c2ccccc12	InChI=1S/C22H26N2O/c1-2-3-13-22(25)23-15-14-19-18-11-7-8-12-20(18)24-21(19)16-17-9-5-4-6-10-17/h4-12,24H,2-3,13-16H2,1H3,(H,23,25)	HDOIPCLEKCEANF-UHFFFAOYSA-N	334.204513472							92107
SCHEMBL6668531	LSM-2236	BRD-K11634954	132475	InChI=1S/C28H30F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-15,28H,16-22H2	DASHZBBQOARCMQ-UHFFFAOYSA-N	Fc1ccc(cc1)C(OCCN2CCN(CC=Cc3ccccc3)CC2)c4ccc(F)cc4	BroadT	BRD-K11634954	BRD-K11634954-300-01-8	Tocris Bioscience	420	3	Cl.Cl	Fc1ccc(cc1)C(OCCN1CCN(CC=Cc2ccccc2)CC1)c1ccc(F)cc1.Cl.Cl	InChI=1S/C28H30F2N2O.2ClH/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23;;/h1-15,28H,16-22H2;2*1H	ZBSZWEYIIGLGSX-UHFFFAOYSA-N	448.23262							92197
JX401	LSM-2097	BRD-K05464208, SID50112956, SID90341212	1126109	InChI=1S/C21H25NO2S/c1-24-20-15-18(25-2)8-9-19(20)21(23)22-12-10-17(11-13-22)14-16-6-4-3-5-7-16/h3-9,15,17H,10-14H2,1-2H3	OMGLGPKQUFSRNN-UHFFFAOYSA-N	COc1cc(SC)ccc1C(=O)N2CCC(Cc3ccccc3)CC2	BroadT	BRD-K05464208	BRD-K05464208-001-01-6	Tocris Bioscience	2657	1		COc1cc(SC)ccc1C(=O)N1CCC(Cc2ccccc2)CC1	InChI=1S/C21H25NO2S/c1-24-20-15-18(25-2)8-9-19(20)21(23)22-12-10-17(11-13-22)14-16-6-4-3-5-7-16/h3-9,15,17H,10-14H2,1-2H3	OMGLGPKQUFSRNN-UHFFFAOYSA-N	355.16059974							92098
UNII-BXU45ZH6LI	LSM-2382	BRD-K17705806, JTC-801	5311340	InChI=1S/C26H25N3O2/c1-3-18-8-11-21(12-9-18)31-16-19-6-4-5-7-22(19)26(30)29-20-10-13-25-23(15-20)24(27)14-17(2)28-25/h4-15H,3,16H2,1-2H3,(H2,27,28)(H,29,30)	VTGBZWHPJFMTKS-UHFFFAOYSA-N	CCc1ccc(OCc2ccccc2C(=O)Nc3ccc4nc(C)cc(N)c4c3)cc1	BroadT	BRD-K17705806	BRD-K17705806-003-01-0	Tocris Bioscience	2481	2	Cl	CCc1ccc(OCc2ccccc2C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1.Cl	InChI=1S/C26H25N3O2.ClH/c1-3-18-8-11-21(12-9-18)31-16-19-6-4-5-7-22(19)26(30)29-20-10-13-25-23(15-20)24(27)14-17(2)28-25;/h4-15H,3,16H2,1-2H3,(H2,27,28)(H,29,30);1H	NQLIYKXNAXKMBL-UHFFFAOYSA-N	411.19467707							92314, 92314
1,3-Dipropyl-8-cyclopentylxanthine	LSM-19971		1329	InChI=1S/C16H24N4O2/c1-3-9-19-14-12(15(21)20(10-4-2)16(19)22)17-13(18-14)11-7-5-6-8-11/h11H,3-10H2,1-2H3,(H,17,18)	FFBDFADSZUINTG-UHFFFAOYSA-N	CCCN1C(=O)N(CCC)c2[nH]c(nc2C1=O)C3CCCC3	BroadT	BRD-K01824921	BRD-K01824921-001-02-9	MicroSource Discovery Systems Inc.	2300063			CCCn1c2[nH]c(nc2c(=O)n(CCC)c1=O)C1CCCC1	InChI=1S/C16H24N4O2/c1-3-9-19-14-12(15(21)20(10-4-2)16(19)22)17-13(18-14)11-7-5-6-8-11/h11H,3-10H2,1-2H3,(H,17,18)	FFBDFADSZUINTG-UHFFFAOYSA-N	304.189926048							73282
IN1436	LSM-2255	BRD-K12357156, SID103905108	2390	InChI=1S/C17H14N2O3/c18-10-14(8-13-6-7-15(20)16(21)9-13)17(22)19-11-12-4-2-1-3-5-12/h1-9,20-21H,11H2,(H,19,22)	TUCIOBMMDDOEMM-UHFFFAOYSA-N	Oc1ccc(C=C(C#N)C(=O)NCc2ccccc2)cc1O	BroadT	BRD-K12357156	BRD-K12357156-001-01-5	Tocris Bioscience	414	2		Oc1ccc(C=C(C#N)C(=O)NCc2ccccc2)cc1O	InChI=1S/C17H14N2O3/c18-10-14(8-13-6-7-15(20)16(21)9-13)17(22)19-11-12-4-2-1-3-5-12/h1-9,20-21H,11H2,(H,19,22)	TUCIOBMMDDOEMM-UHFFFAOYSA-N	294.100442328							92212
Flurandrenolide	LSM-1993	33379, Flurandrenolide, Fludroxycortide, Flurandrenolone, Fludroxicortide, Cordran, Cordran SP	15209	InChI=1S/C24H33FO6/c1-21(2)30-19-9-14-13-8-16(25)15-7-12(27)5-6-22(15,3)20(13)17(28)10-23(14,4)24(19,31-21)18(29)11-26/h7,13-14,16-17,19-20,26,28H,5-6,8-11H2,1-4H3/t13-,14-,16-,17-,19+,20+,22-,23-,24+/m0/s1	POPFMWWJOGLOIF-XWCQMRHXSA-N	CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)CC[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO	BroadT	BRD-K00824317	BRD-K00824317-001-03-0	Prestwick Chemical Inc.	Prestw-645	D0701-MP04-ST03-200-		CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)CC[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO	InChI=1S/C24H33FO6/c1-21(2)30-19-9-14-13-8-16(25)15-7-12(27)5-6-22(15,3)20(13)17(28)10-23(14,4)24(19,31-21)18(29)11-26/h7,13-14,16-17,19-20,26,28H,5-6,8-11H2,1-4H3/t13-,14-,16-,17-,19+,20+,22-,23-,24+/m0/s1	POPFMWWJOGLOIF-XWCQMRHXSA-N	436.226116976							92020
YS-035	LSM-2117	SID11113489, SID26751711, SID90340787, SID11111976	5714	InChI=1S/C21H29NO4/c1-22(12-10-16-6-8-18(23-2)20(14-16)25-4)13-11-17-7-9-19(24-3)21(15-17)26-5/h6-9,14-15H,10-13H2,1-5H3	OXZMQFKVNVQMLI-UHFFFAOYSA-N	COc1ccc(CCN(C)CCc2ccc(OC)c(OC)c2)cc1OC	BroadT	BRD-K06208435	BRD-K06208435-001-02-9	Biomol International Inc.	AC-106	2840(V2)-3-N1305		COc1ccc(CCN(C)CCc2ccc(OC)c(OC)c2)cc1OC	InChI=1S/C21H29NO4/c1-22(12-10-16-6-8-18(23-2)20(14-16)25-4)13-11-17-7-9-19(24-3)21(15-17)26-5/h6-9,14-15H,10-13H2,1-5H3	OXZMQFKVNVQMLI-UHFFFAOYSA-N	359.209658418							92116, 92116
7Beta-forskolin	LSM-2040	BRD-K03015355	9871875	InChI=1S/C29H48N2O7/c1-8-26(4)18-20(33)29(36)27(5)19(32)11-12-25(2,3)23(27)22(35)24(28(29,6)38-26)37-21(34)10-9-13-31-16-14-30(7)15-17-31/h8,19,22-24,32,35-36H,1,9-18H2,2-7H3/t19-,22-,23-,24-,26-,27-,28+,29-/m0/s1	PAYHDZDDAHVPDU-ZQVYKFDISA-N	CN1CCN(CCCC(=O)O[C@H]2[C@@H](O)[C@H]3C(C)(C)CC[C@H](O)[C@]3(C)[C@@]4(O)C(=O)C[C@@](C)(O[C@]24C)C=C)CC1	BroadT	BRD-K03015355	BRD-K03015355-003-01-5	EMD Biosciences	344273		Cl	CN1CCN(CCCC(=O)O[C@H]2[C@@H](O)[C@H]3C(C)(C)CC[C@H](O)[C@]3(C)[C@@]3(O)C(=O)C[C@@](C)(O[C@]23C)C=C)CC1.Cl	InChI=1S/C29H48N2O7.ClH/c1-8-26(4)18-20(33)29(36)27(5)19(32)11-12-25(2,3)23(27)22(35)24(28(29,6)38-26)37-21(34)10-9-13-31-16-14-30(7)15-17-31;/h8,19,22-24,32,35-36H,1,9-18H2,2-7H3;1H/t19-,22-,23-,24-,26-,27-,28+,29-;/m0./s1	OULUEJFJHAWZKK-CGKIGYTNSA-N	536.346151896							
Butylparaben	LSM-2161	Butylparaben, Butyl Paraben, Butyl P-Hydroxybenzoate, Butyl Parahydroxybenzoate	7184	InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7,12H,2-3,8H2,1H3	QFOHBWFCKVYLES-UHFFFAOYSA-N	CCCCOC(=O)c1ccc(O)cc1	BroadT	BRD-K08287586	BRD-K08287586-001-03-6	Prestwick Chemical Inc.	Prestw-894	D0701-MP04-ST03-200-		CCCCOC(=O)c1ccc(O)cc1	InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7,12H,2-3,8H2,1H3	QFOHBWFCKVYLES-UHFFFAOYSA-N	194.094294308							88542
Fentanyl Isothiocyanate	LSM-2391	BRD-K17896185, SID11114101	84008	InChI=1S/C23H27N3OS/c1-2-23(27)26(21-6-4-3-5-7-21)22-13-16-25(17-14-22)15-12-19-8-10-20(11-9-19)24-18-28/h3-11,22H,2,12-17H2,1H3	VDKBIFPJULZUPU-UHFFFAOYSA-N	CCC(=O)N(C1CCN(CCc2ccc(cc2)N=C=S)CC1)c3ccccc3	BroadT	BRD-K17896185	BRD-K17896185-001-01-2	Tocris Bioscience	1480	1		CCC(=O)N(C1CCN(CCc2ccc(cc2)N=C=S)CC1)c1ccccc1	InChI=1S/C23H27N3OS/c1-2-23(27)26(21-6-4-3-5-7-21)22-13-16-25(17-14-22)15-12-19-8-10-20(11-9-19)24-18-28/h3-11,22H,2,12-17H2,1H3	VDKBIFPJULZUPU-UHFFFAOYSA-N	393.187483204							92323
N-Arachidonoyl-gaba (na-gaba)	LSM-2110	BRD-K06024458	44483333	InChI=1S/C24H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)25-22-19-21-24(27)28/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-22H2,1H3,(H,25,26)(H,27,28)	JKUDIEXTAYKJNX-UHFFFAOYSA-N	CCCCCC=CCC=CCC=CCC=CCCCC(=O)NCCCC(=O)O	BroadT	BRD-K06024458	BRD-K06024458-001-01-4	Tocris Bioscience	1814	1		CCCCCC=CCC=CCC=CCC=CCCCC(=O)NCCCC(O)=O	InChI=1S/C24H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)25-22-19-21-24(27)28/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-22H2,1H3,(H,25,26)(H,27,28)	JKUDIEXTAYKJNX-UHFFFAOYSA-N	389.292994118							92109
Fluvastatin	LSM-43201	SID26758026	1548972	InChI=1S/C24H26FNO4/c1-15(2)26-21-6-4-3-5-20(21)24(16-7-9-17(25)10-8-16)22(26)12-11-18(27)13-19(28)14-23(29)30/h3-12,15,18-19,27-28H,13-14H2,1-2H3,(H,29,30)/b12-11+/t18-,19-/m0/s1	FJLGEFLZQAZZCD-JUFISIKESA-N	CC(C)n1c(\C=C\[C@H](O)C[C@H](O)CC(=O)O)c(c2ccc(F)cc2)c3ccccc13	BroadT	BRD-K03602135	BRD-K03602135-236-02-1	Prestwick Chemical Inc.	Prestw-859	D0701-MP04-ST03-200-	[Na]	CC(C)n1c(\C=C\[C@H](O)C[C@H](O)CC(O)=O)c(-c2ccc(F)cc2)c2ccccc12.[Na]	InChI=1S/C24H26FNO4.Na.H/c1-15(2)26-21-6-4-3-5-20(21)24(16-7-9-17(25)10-8-16)22(26)12-11-18(27)13-19(28)14-23(29)30;;/h3-12,15,18-19,27-28H,13-14H2,1-2H3,(H,29,30);;/b12-11+;;/t18-,19-;;/m0../s1	MNZLRTVDDLVGCU-FFAWTJJMSA-N	411.184586522							5136, 5136
Alachlor	LSM-19972	Alochlor, SID17389552, SID26752788, SID89854497	2078	InChI=1S/C14H20ClNO2/c1-4-11-7-6-8-12(5-2)14(11)16(10-18-3)13(17)9-15/h6-8H,4-5,9-10H2,1-3H3	XCSGPAVHZFQHGE-UHFFFAOYSA-N	CCc1cccc(CC)c1N(COC)C(=O)CCl	BroadT	BRD-K02548315	BRD-K02548315-001-02-7	MicroSource Discovery Systems Inc.	330043			CCc1cccc(CC)c1N(COC)C(=O)CCl	InChI=1S/C14H20ClNO2/c1-4-11-7-6-8-12(5-2)14(11)16(10-18-3)13(17)9-15/h6-8H,4-5,9-10H2,1-3H3	XCSGPAVHZFQHGE-UHFFFAOYSA-N	269.1182566							2533
Benzo[Def]Chrysene	LSM-2198	Benzo[Def]Chrysene, Benzo(A)Pyrene, Benzo[A]-Pyrene, Benzo[A]Pyrene	2336	InChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H	FMMWHPNWAFZXNH-UHFFFAOYSA-N	c1ccc2c(c1)cc3ccc4cccc5ccc2c3c45	BroadT	BRD-K09668667	BRD-K09668667-001-02-0	MicroSource Discovery Systems Inc.	330005			c1ccc2c(c1)cc1ccc3cccc4ccc2c1c34	InChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H	FMMWHPNWAFZXNH-UHFFFAOYSA-N	252.093900384							29865
NCGC00018102-06	LSM-2250	BRD-K12184470	3378	InChI=1S/C26H26F2N2/c27-24-12-8-22(9-13-24)26(23-10-14-25(28)15-11-23)30-19-17-29(18-20-30)16-4-7-21-5-2-1-3-6-21/h1-15,26H,16-20H2	SMANXXCATUTDDT-UHFFFAOYSA-N	Fc1ccc(cc1)C(N2CCN(CC=Cc3ccccc3)CC2)c4ccc(F)cc4	BroadT	BRD-K12184470	BRD-K12184470-300-01-8	Tocris Bioscience	522	4	Cl.Cl	Fc1ccc(cc1)C(N1CCN(CC=Cc2ccccc2)CC1)c1ccc(F)cc1.Cl.Cl	InChI=1S/C26H26F2N2.2ClH/c27-24-12-8-22(9-13-24)26(23-10-14-25(28)15-11-23)30-19-17-29(18-20-30)16-4-7-21-5-2-1-3-6-21;;/h1-15,26H,16-20H2;2*1H	RXKMOPXNWTYEHI-UHFFFAOYSA-N	404.206405252							92209
Talniflumate	LSM-1960	Talniflumate, Somalgen, BA-7602-06, BRD-A98378129	48229	InChI=1S/C21H13F3N2O4/c22-21(23,24)12-5-3-6-13(11-12)26-17-16(9-4-10-25-17)19(28)30-20-15-8-2-1-7-14(15)18(27)29-20/h1-11,20H,(H,25,26)	ANMLJLFWUCQGKZ-UHFFFAOYSA-N	FC(F)(F)c1cccc(Nc2ncccc2C(=O)OC3OC(=O)c4ccccc34)c1	BroadT	BRD-A98378129	BRD-A98378129-001-01-4	Tocris Bioscience	2510	1		FC(F)(F)c1cccc(Nc2ncccc2C(=O)OC2OC(=O)c3ccccc23)c1	InChI=1S/C21H13F3N2O4/c22-21(23,24)12-5-3-6-13(11-12)26-17-16(9-4-10-25-17)19(28)30-20-15-8-2-1-7-14(15)18(27)29-20/h1-11,20H,(H,25,26)	ANMLJLFWUCQGKZ-UHFFFAOYSA-N	414.082741516							91991
Ptaeroxylin	LSM-19973	SID26749432	3646533	InChI=1S/C15H14O4/c1-8-3-4-10-12(18-7-8)6-13-14(15(10)17)11(16)5-9(2)19-13/h3,5-6,17H,4,7H2,1-2H3	IUIHYYSAVUBPQO-UHFFFAOYSA-N	CC1=CCc2c(O)c3C(=O)C=C(C)Oc3cc2OC1	BroadT	BRD-K05475322	BRD-K05475322-001-02-1	MicroSource Discovery Systems Inc.	100513			Cc1cc(=O)c2c(O)c3CC=C(C)COc3cc2o1	InChI=1S/C15H14O4/c1-8-3-4-10-12(18-7-8)6-13-14(15(10)17)11(16)5-9(2)19-13/h3,5-6,17H,4,7H2,1-2H3	IUIHYYSAVUBPQO-UHFFFAOYSA-N	258.089208928							108592
9-Aminoacridine	LSM-15516	BRD-K00535541	7019	InChI=1S/C13H10N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H,(H2,14,15)	XJGFWWJLMVZSIG-UHFFFAOYSA-N	Nc1c2ccccc2nc3ccccc13	BroadT	BRD-K00535541	BRD-K00535541-311-04-1	Life Chemicals Inc.	F2179-0009		O.Cl	Nc1c2ccccc2nc2ccccc12.O.Cl	InChI=1S/C13H10N2.ClH.H2O/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13;;/h1-8H,(H2,14,15);1H;1H2	OREJEGKBQBIJSJ-UHFFFAOYSA-N	194.08439834							74789, 74789, 74789
Gamolenic acid	LSM-42900	Gamolenic Acid	5280933	InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)/b7-6-,10-9-,13-12-	VZCCETWTMQHEPK-QNEBEIHSSA-N	CCCCC\C=C/C\C=C/C\C=C/CCCCC(=O)O	BroadT	BRD-K18059238	BRD-K18059238-001-02-1	Biomol International Inc.	FA006	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/C\C=C/CCCCC(O)=O	InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)/b7-6-,10-9-,13-12-	VZCCETWTMQHEPK-QNEBEIHSSA-N	278.2245802							28661
SPECTRUM_001319	LSM-1963	Carbenoxolone	6602447	InChI=1S/C34H50O7/c1-29(2)23-10-13-34(7)27(32(23,5)12-11-24(29)41-26(38)9-8-25(36)37)22(35)18-20-21-19-31(4,28(39)40)15-14-30(21,3)16-17-33(20,34)6/h18,21,23-24,27H,8-17,19H2,1-7H3,(H,36,37)(H,39,40)/t21-,23?,24-,27?,30+,31-,32-,33+,34+/m0/s1	OBZHEBDUNPOCJG-YQNKGXRGSA-N	CC1(C)[C@H](CC[C@@]2(C)C1CC[C@]3(C)C2C(=O)C=C4[C@@H]5C[C@](C)(CC[C@]5(C)CC[C@@]34C)C(=O)O)OC(=O)CCC(=O)O	BroadT	BRD-A98702003	BRD-A98702003-304-02-2	MicroSource Discovery Systems Inc.	1502005		[Na].[Na]	CC1(C)[C@H](CC[C@@]2(C)C1CC[C@]1(C)C2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O)OC(=O)CCC(O)=O.[Na].[Na]	InChI=1S/C34H50O7.2Na.2H/c1-29(2)23-10-13-34(7)27(32(23,5)12-11-24(29)41-26(38)9-8-25(36)37)22(35)18-20-21-19-31(4,28(39)40)15-14-30(21,3)16-17-33(20,34)6;;;;/h18,21,23-24,27H,8-17,19H2,1-7H3,(H,36,37)(H,39,40);;;;/t21-,23?,24-,27?,30+,31-,32-,33+,34+;;;;/m0..../s1	FOGJBHKTAPLOEW-PTKVDZODSA-N	570.35565394							91994
Cefotiam	LSM-2022	Ceradon, Cefotiam	43708	InChI=1S/C18H23N9O4S3/c1-25(2)3-4-26-18(22-23-24-26)34-7-9-6-32-15-12(14(29)27(15)13(9)16(30)31)21-11(28)5-10-8-33-17(19)20-10/h8,12,15H,3-7H2,1-2H3,(H2,19,20)(H,21,28)(H,30,31)/t12-,15-/m1/s1	QYQDKDWGWDOFFU-IUODEOHRSA-N	CN(C)CCn1nnnc1SCC2=C(N3[C@H](SC2)[C@H](NC(=O)Cc4csc(N)n4)C3=O)C(=O)O	BroadT	BRD-K02275692	BRD-K02275692-003-03-4	Prestwick Chemical Inc.	Prestw-482	D0701-MP04-ST03-200-	Cl	CN(C)CCn1nnnc1SCC1=C(N2[C@H](SC1)[C@H](NC(=O)Cc1csc(N)n1)C2=O)C(O)=O.Cl	InChI=1S/C18H23N9O4S3.ClH/c1-25(2)3-4-26-18(22-23-24-26)34-7-9-6-32-15-12(14(29)27(15)13(9)16(30)31)21-11(28)5-10-8-33-17(19)20-10;/h8,12,15H,3-7H2,1-2H3,(H2,19,20)(H,21,28)(H,30,31);1H/t12-,15-;/m1./s1	SVSFIELZISOJDT-XRZFDKQNSA-N	525.103512376							355510, 355510
Tyrphostin AG 538	LSM-42862	AG-538	5328760	InChI=1S/C16H11NO5/c17-8-11(5-9-1-3-12(18)14(20)6-9)16(22)10-2-4-13(19)15(21)7-10/h1-7,18-21H/b11-5+	CANOJKGQDCJDOX-VZUCSPMQSA-N	Oc1ccc(\C=C(/C#N)\C(=O)c2ccc(O)c(O)c2)cc1O	BroadT	BRD-K07888196	BRD-K07888196-001-01-8	Calbiochem	658403			Oc1ccc(\C=C(/C#N)C(=O)c2ccc(O)c(O)c2)cc1O	InChI=1S/C16H11NO5/c17-8-11(5-9-1-3-12(18)14(20)6-9)16(22)10-2-4-13(19)15(21)7-10/h1-7,18-21H/b11-5+	CANOJKGQDCJDOX-VZUCSPMQSA-N	297.063722462							
SPBIO_000454	LSM-15181	Nafcillin	6602443	InChI=1S/C21H22N2O5S/c1-4-28-13-10-9-11-7-5-6-8-12(11)15(13)22-17(24)14-18(25)23-16(20(26)27)21(2,3)29-19(14)23/h5-10,14,16,19H,4H2,1-3H3,(H,22,24)(H,26,27)/t14-,16?,19-/m1/s1	PLIGJUHHTJAZTH-WDOBJEIGSA-N	CCOc1ccc2ccccc2c1NC(=O)[C@H]3[C@H]4SC(C)(C)C(N4C3=O)C(=O)O	BroadT	BRD-A99402294	BRD-A99402294-236-02-0	MicroSource Discovery Systems Inc.	1500420		[Na]	CCOc1ccc2ccccc2c1NC(=O)[C@H]1[C@H]2SC(C)(C)C(N2C1=O)C(O)=O.[Na]	InChI=1S/C21H22N2O5S.Na.H/c1-4-28-13-10-9-11-7-5-6-8-12(11)15(13)22-17(24)14-18(25)23-16(20(26)27)21(2,3)29-19(14)23;;/h5-10,14,16,19H,4H2,1-3H3,(H,22,24)(H,26,27);;/t14-,16?,19-;;/m1../s1	WZXVTWFHHZXBEZ-LZWGIRFSSA-N	414.124942514							103834
6-Formylindolo[3,2-b]carbazole	LSM-5198	6-Formylindolo 3,2-B Carbazole, 6-Formylindolo[3,2-B]Carbazole, GR-206	1863	InChI=1S/C19H12N2O/c22-10-14-18-12-6-2-4-8-16(12)20-17(18)9-13-11-5-1-3-7-15(11)21-19(13)14/h1-10,20-21H	ZUDXFBWDXVNRKF-UHFFFAOYSA-N	O=Cc1c2[nH]c3ccccc3c2cc4[nH]c5ccccc5c14	BroadT	BRD-K00184207	BRD-K00184207-001-02-4	Biomol International Inc.	GR206	2840(V2)-3-N1305		O=Cc1c2[nH]c3ccccc3c2cc2[nH]c3ccccc3c12	InChI=1S/C19H12N2O/c22-10-14-18-12-6-2-4-8-16(12)20-17(18)9-13-11-5-1-3-7-15(11)21-19(13)14/h1-10,20-21H	ZUDXFBWDXVNRKF-UHFFFAOYSA-N	284.094963024							94466
CL-82198	LSM-1992	BRD-K00675675, CL-82198	2777	InChI=1S/C17H22N2O3/c20-17(16-13-14-5-1-2-6-15(14)22-16)18-7-3-4-8-19-9-11-21-12-10-19/h1-2,5-6,13H,3-4,7-12H2,(H,18,20)	KUJQEQAVMNFFAO-UHFFFAOYSA-N	O=C(NCCCCN1CCOCC1)c2oc3ccccc3c2	BroadT	BRD-K00675675	BRD-K00675675-003-01-2	Tocris Bioscience	2632	1	Cl	O=C(NCCCCN1CCOCC1)c1cc2ccccc2o1.Cl	InChI=1S/C17H22N2O3.ClH/c20-17(16-13-14-5-1-2-6-15(14)22-16)18-7-3-4-8-19-9-11-21-12-10-19;/h1-2,5-6,13H,3-4,7-12H2,(H,18,20);1H	PIOACXKZWXHBRB-UHFFFAOYSA-N	302.163042584							92019
Minaprine	LSM-2037	Brantur, Cantor, Minaprine, AGR-1240, CB-30038	4199	InChI=1S/C17H22N4O/c1-14-13-16(15-5-3-2-4-6-15)19-20-17(14)18-7-8-21-9-11-22-12-10-21/h2-6,13H,7-12H2,1H3,(H,18,20)	LDMWSLGGVTVJPG-UHFFFAOYSA-N	Cc1cc(nnc1NCCN2CCOCC2)c3ccccc3	BroadT	BRD-K02867583	BRD-K02867583-300-04-8	MicroSource Discovery Systems Inc.	1501120		Cl.Cl	Cc1cc(nnc1NCCN1CCOCC1)-c1ccccc1.Cl.Cl	InChI=1S/C17H22N4O.2ClH/c1-14-13-16(15-5-3-2-4-6-15)19-20-17(14)18-7-8-21-9-11-22-12-10-21;;/h2-6,13H,7-12H2,1H3,(H,18,20);2*1H	GNUCGROXDZMCJI-UHFFFAOYSA-N	298.179361364							51038, 51038, 51038
Nocodazole	LSM-2260		4122	InChI=1S/C14H11N3O3S/c1-20-14(19)17-13-15-9-5-4-8(7-10(9)16-13)12(18)11-3-2-6-21-11/h2-7H,1H3,(H2,15,16,17,19)	KYRVNWMVYQXFEU-UHFFFAOYSA-N	COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c3cccs3	BroadT	BRD-K12539581	BRD-K12539581-001-06-2	Biomol International Inc.	T101	2840(V2)-3-N1305		COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c1cccs1	InChI=1S/C14H11N3O3S/c1-20-14(19)17-13-15-9-5-4-8(7-10(9)16-13)12(18)11-3-2-6-21-11/h2-7H,1H3,(H2,15,16,17,19)	KYRVNWMVYQXFEU-UHFFFAOYSA-N	301.052111932							34892
Levofloxacin	LSM-5270	Levofloxacin, Quixin, Levaquin, Iquix, Floxacin, RWJ-25213, DR-3355, Levo Floxacin	149096	InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)/t10-/m0/s1	GSDSWSVVBLHKDQ-JTQLQIEISA-N	C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc4C(=O)C(=CN1c24)C(=O)O	BroadT	BRD-K09471561	BRD-K09471561-001-02-6	MicroSource Discovery Systems Inc.	1504260			C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c2n1cc(C(O)=O)c3=O	InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)/t10-/m0/s1	GSDSWSVVBLHKDQ-JTQLQIEISA-N	361.14378435							63598, 63598
Carbenoxolone	LSM-2267	Carbenoxolone	636403	InChI=1S/C34H50O7/c1-29(2)23-10-13-34(7)27(32(23,5)12-11-24(29)41-26(38)9-8-25(36)37)22(35)18-20-21-19-31(4,28(39)40)15-14-30(21,3)16-17-33(20,34)6/h18,21,23-24,27H,8-17,19H2,1-7H3,(H,36,37)(H,39,40)/t21-,23-,24-,27+,30+,31-,32-,33+,34+/m0/s1	OBZHEBDUNPOCJG-WBXJDKIVSA-N	CC1(C)[C@H](CC[C@@]2(C)[C@H]1CC[C@]3(C)[C@@H]2C(=O)C=C4[C@@H]5C[C@](C)(CC[C@]5(C)CC[C@@]34C)C(=O)O)OC(=O)CCC(=O)O	BroadT	BRD-K12765235	BRD-K12765235-304-03-8	Prestwick Chemical Inc.	Prestw-837	D0701-MP04-ST03-200-	[Na].[Na]	CC1(C)[C@H](CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O)OC(=O)CCC(O)=O.[Na].[Na]	InChI=1S/C34H50O7.2Na.2H/c1-29(2)23-10-13-34(7)27(32(23,5)12-11-24(29)41-26(38)9-8-25(36)37)22(35)18-20-21-19-31(4,28(39)40)15-14-30(21,3)16-17-33(20,34)6;;;;/h18,21,23-24,27H,8-17,19H2,1-7H3,(H,36,37)(H,39,40);;;;/t21-,23-,24-,27+,30+,31-,32-,33+,34+;;;;/m0..../s1	FOGJBHKTAPLOEW-WDYKOPHZSA-N	570.35565394							, 
Fast Scarlet	LSM-2299	Benzopurpurine 4b	13817	InChI=1S/C34H28N6O6S2/c1-19-15-21(11-13-27(19)37-39-29-17-31(47(41,42)43)23-7-3-5-9-25(23)33(29)35)22-12-14-28(20(2)16-22)38-40-30-18-32(48(44,45)46)24-8-4-6-10-26(24)34(30)36/h3-18H,35-36H2,1-2H3,(H,41,42,43)(H,44,45,46)	PYPYDHUIORYEHW-UHFFFAOYSA-N	Cc1cc(ccc1N=Nc2cc(c3ccccc3c2N)S(=O)(=O)O)c4ccc(N=Nc5cc(c6ccccc6c5N)S(=O)(=O)O)c(C)c4	BroadT	BRD-K14221570	BRD-K14221570-236-01-1	Calbiochem	199500		[Na]	Cc1cc(ccc1N=Nc1cc(c2ccccc2c1N)S(O)(=O)=O)-c1ccc(N=Nc2cc(c3ccccc3c2N)S(O)(=O)=O)c(C)c1.[Na]	InChI=1S/C34H28N6O6S2.Na.H/c1-19-15-21(11-13-27(19)37-39-29-17-31(47(41,42)43)23-7-3-5-9-25(23)33(29)35)22-12-14-28(20(2)16-22)38-40-30-18-32(48(44,45)46)24-8-4-6-10-26(24)34(30)36;;/h3-18H,35-36H2,1-2H3,(H,41,42,43)(H,44,45,46);;	VRGQPCWEGKAZKK-UHFFFAOYSA-N	680.151174056							92247
(-)-Propanolol	LSM-5318	Propanolol, Propranolol, Propranolol, L-	91536	InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3/t14-/m0/s1	AQHHHDLHHXJYJD-AWEZNQCLSA-N	CC(C)NC[C@H](O)COc1cccc2ccccc12	BroadT	BRD-K13994703	BRD-K13994703-001-02-0	Biomol International Inc.	AR107	2840(V2)-3-N1305		CC(C)NC[C@H](O)COc1cccc2ccccc12	InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3/t14-/m0/s1	AQHHHDLHHXJYJD-AWEZNQCLSA-N	259.157228922							, 
Altanserin	LSM-1987	Altanserin, BRD-K00610438	3033677	InChI=1S/C22H22FN3O2S/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29/h1-8,16H,9-14H2,(H,24,29)	SMYALUSCZJXWHG-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)C2CCN(CCN3C(=S)Nc4ccccc4C3=O)CC2	BroadT	BRD-K00610438	BRD-K00610438-003-01-7	Tocris Bioscience	1809	1	Cl	Fc1ccc(cc1)C(=O)C1CCN(CCn2c(=S)[nH]c3ccccc3c2=O)CC1.Cl	InChI=1S/C22H22FN3O2S.ClH/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29;/h1-8,16H,9-14H2,(H,24,29);1H	JFPPLMAMMZZOEA-UHFFFAOYSA-N	411.141675864							2613, 2613, 2613, 2613
NSC 663284	LSM-2042	BRD-K03109492, NSC-663284	379077	InChI=1S/C15H16ClN3O3/c16-11-13(18-4-5-19-6-8-22-9-7-19)15(21)12-10(14(11)20)2-1-3-17-12/h1-3,18H,4-9H2	BMKPVDQDJQWBPD-UHFFFAOYSA-N	ClC1=C(NCCN2CCOCC2)C(=O)c3ncccc3C1=O	BroadT	BRD-K03109492	BRD-K03109492-001-01-4	Tocris Bioscience	1867	1		ClC1=C(NCCN2CCOCC2)C(=O)c2ncccc2C1=O	InChI=1S/C15H16ClN3O3/c16-11-13(18-4-5-19-6-8-22-9-7-19)15(21)12-10(14(11)20)2-1-3-17-12/h1-3,18H,4-9H2	BMKPVDQDJQWBPD-UHFFFAOYSA-N	321.088019112							92053
LE-135	LSM-2127	SID26753190	10410894	InChI=1S/C29H30N2O2/c1-28(2)14-15-29(3,4)22-17-25-23(16-21(22)28)30-26(18-10-12-19(13-11-18)27(32)33)20-8-6-7-9-24(20)31(25)5/h6-13,16-17H,14-15H2,1-5H3,(H,32,33)	YZZAIQOVMHVWBS-UHFFFAOYSA-N	CN1c2ccccc2C(=Nc3cc4c(cc13)C(C)(C)CCC4(C)C)c5ccc(cc5)C(=O)O	BroadT	BRD-K06593056	BRD-K06593056-001-01-4	Tocris Bioscience	2021	1		CN1c2cc3c(cc2N=C(c2ccc(cc2)C(O)=O)c2ccccc12)C(C)(C)CCC3(C)C	InChI=1S/C29H30N2O2/c1-28(2)14-15-29(3,4)22-17-25-23(16-21(22)28)30-26(18-10-12-19(13-11-18)27(32)33)20-8-6-7-9-24(20)31(25)5/h6-13,16-17H,14-15H2,1-5H3,(H,32,33)	YZZAIQOVMHVWBS-UHFFFAOYSA-N	438.23072822							92124
Sulfamonomethoxine	LSM-5320	Sulfamonomethoxine	5332	InChI=1S/C11H12N4O3S/c1-18-11-6-10(13-7-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h2-7H,12H2,1H3,(H,13,14,15)	WMPXPUYPYQKQCX-UHFFFAOYSA-N	COc1cc(NS(=O)(=O)c2ccc(N)cc2)ncn1	BroadT	BRD-K14116214	BRD-K14116214-001-04-7	Prestwick Chemical Inc.	Prestw-823	D0701-MP04-ST03-200-		COc1cc(NS(=O)(=O)c2ccc(N)cc2)ncn1	InChI=1S/C11H12N4O3S/c1-18-11-6-10(13-7-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h2-7H,12H2,1H3,(H,13,14,15)	WMPXPUYPYQKQCX-UHFFFAOYSA-N	280.063010974							32164
Mephentermine	LSM-2396	Mephentermine	3677	InChI=1S/C11H17N/c1-11(2,12-3)9-10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3	RXQCGGRTAILOIN-UHFFFAOYSA-N	CNC(C)(C)Cc1ccccc1	BroadT	BRD-K18194590	BRD-K18194590-065-02-3	MicroSource Discovery Systems Inc.	1503250		OS(=O)(=O)O	CNC(C)(C)Cc1ccccc1.OS(=O)(=O)O	InChI=1S/C11H17N.H2O4S/c1-11(2,12-3)9-10-7-5-4-6-8-10;1-5(2,3)4/h4-8,12H,9H2,1-3H3;(H2,1,2,3,4)	NZKLHVGUPFNBFD-UHFFFAOYSA-N	163.136099554							6755, 6755, 6755
Cloprostenol	LSM-43613	SID29217531	5311053	InChI=1S/C22H29ClO6/c23-15-6-5-7-17(12-15)29-14-16(24)10-11-19-18(20(25)13-21(19)26)8-3-1-2-4-9-22(27)28/h1,3,5-7,10-12,16,18-21,24-26H,2,4,8-9,13-14H2,(H,27,28)/b3-1-,11-10+/t16-,18-,19-,20+,21-/m1/s1	VJGGHXVGBSZVMZ-QIZQQNKQSA-N	O[C@@H](COc1cccc(Cl)c1)\C=C\[C@H]2[C@H](O)C[C@H](O)[C@@H]2C\C=C/CCCC(=O)O	BroadT	BRD-K17850764	BRD-K17850764-236-03-6	Tocris Bioscience	2295	1	[Na]	O[C@@H](COc1cccc(Cl)c1)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O.[Na]	InChI=1S/C22H29ClO6.Na.H/c23-15-6-5-7-17(12-15)29-14-16(24)10-11-19-18(20(25)13-21(19)26)8-3-1-2-4-9-22(27)28;;/h1,3,5-7,10-12,16,18-21,24-26H,2,4,8-9,13-14H2,(H,27,28);;/b3-1-,11-10+;;/t16-,18-,19-,20+,21-;;/m1../s1	HFYCDSPXZNYCBL-LPFHDDPUSA-N	424.165266358							, 
Timolol	LSM-2176	Betimol, Blocadren, Istalol, Timolol, Timoptic, Timoptic-XE	33624	InChI=1S/C13H24N4O3S/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17/h10,14,18H,4-9H2,1-3H3/t10-/m0/s1	BLJRIMJGRPQVNF-JTQLQIEISA-N	CC(C)(C)NC[C@H](O)COc1nsnc1N2CCOCC2	BroadT	BRD-K08806317	BRD-K08806317-050-03-6	Prestwick Chemical Inc.	Prestw-948	D0701-MP04-ST03-200-	OC(=O)/C=C\C(=O)O	CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1.OC(=O)/C=C\C(=O)O	InChI=1S/C13H24N4O3S.C4H4O4/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17;5-3(6)1-2-4(7)8/h10,14,18H,4-9H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t10-;/m0./s1	WLRMANUAADYWEA-NWASOUNVSA-N	316.156911358							9599, 9599
Fluperlapine	LSM-2343	Fluperlapine	49381	InChI=1S/C19H20FN3/c1-22-8-10-23(11-9-22)19-17-5-3-2-4-14(17)12-15-6-7-16(20)13-18(15)21-19/h2-7,13H,8-12H2,1H3	OBWGMKKHCLHVIE-UHFFFAOYSA-N	CN1CCN(CC1)C2=Nc3cc(F)ccc3Cc4ccccc24	BroadT	BRD-K15715913	BRD-K15715913-001-01-5	Biomol International Inc.	NS-109	2813-N1283		CN1CCN(CC1)C1=Nc2cc(F)ccc2Cc2ccccc12	InChI=1S/C19H20FN3/c1-22-8-10-23(11-9-22)19-17-5-3-2-4-14(17)12-15-6-7-16(20)13-18(15)21-19/h2-7,13H,8-12H2,1H3	OBWGMKKHCLHVIE-UHFFFAOYSA-N	309.16412587							5122
Desoxypeganine	LSM-2290		442894	InChI=1S/C11H12N2/c1-2-5-10-9(4-1)8-13-7-3-6-11(13)12-10/h1-2,4-5H,3,6-8H2	WUFQLZTXIWKION-UHFFFAOYSA-N	C1CN2Cc3ccccc3N=C2C1	BroadT	BRD-K13819402	BRD-K13819402-003-02-9	MicroSource Discovery Systems Inc.	1505243		Cl	C1CN2Cc3ccccc3N=C2C1.Cl	InChI=1S/C11H12N2.ClH/c1-2-5-10-9(4-1)8-13-7-3-6-11(13)12-10;/h1-2,4-5H,3,6-8H2;1H	KTCXMTWSISEJFZ-UHFFFAOYSA-N	172.100048404							4428, 4428, 4428
2-(2-Aminoethyl)pyridine	LSM-15486	2-(2-Aminoethyl)Pyridine, BRD-K17874705	75919	InChI=1S/C7H10N2/c8-5-4-7-3-1-2-6-9-7/h1-3,6H,4-5,8H2	XPQIPUZPSLAZDV-UHFFFAOYSA-N	NCCc1ccccn1	BroadT	BRD-K17874705	BRD-K17874705-300-01-6	Tocris Bioscience	2478	1	Cl.Cl	NCCc1ccccn1.Cl.Cl	InChI=1S/C7H10N2.2ClH/c8-5-4-7-3-1-2-6-9-7;;/h1-3,6H,4-5,8H2;2*1H	GPIFKSYYILNJNR-UHFFFAOYSA-N	122.08439834							74024
L-733060	LSM-2345	BRD-K15791587, L-733060	132846	InChI=1S/C20H19F6NO/c21-19(22,23)15-9-13(10-16(11-15)20(24,25)26)12-28-17-7-4-8-27-18(17)14-5-2-1-3-6-14/h1-3,5-6,9-11,17-18,27H,4,7-8,12H2/t17-,18-/m0/s1	FCDRFVCGMLUYPG-ROUUACIJSA-N	FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c3ccccc3)cc(c1)C(F)(F)F	BroadT	BRD-K15791587	BRD-K15791587-003-01-7	Tocris Bioscience	1145	2	Cl	FC(F)(F)c1cc(CO[C@H]2CCCN[C@H]2c2ccccc2)cc(c1)C(F)(F)F.Cl	InChI=1S/C20H19F6NO.ClH/c21-19(22,23)15-9-13(10-16(11-15)20(24,25)26)12-28-17-7-4-8-27-18(17)14-5-2-1-3-6-14;/h1-3,5-6,9-11,17-18,27H,4,7-8,12H2;1H/t17-,18-;/m0./s1	DYEUTIUITGHIEO-APTPAJQOSA-N	403.137083438							92286, 92286
Cloxacillin	LSM-15183	Cloxacillin, Cloxapen, Tegopen	6098	InChI=1S/C19H18ClN3O5S/c1-8-11(12(22-28-8)9-6-4-5-7-10(9)20)15(24)21-13-16(25)23-14(18(26)27)19(2,3)29-17(13)23/h4-7,13-14,17H,1-3H3,(H,21,24)(H,26,27)/t13-,14+,17-/m1/s1	LQOLIRLGBULYKD-JKIFEVAISA-N	Cc1onc(c2ccccc2Cl)c1C(=O)N[C@H]3[C@H]4SC(C)(C)[C@@H](N4C3=O)C(=O)O	BroadT	BRD-K01244426	BRD-K01244426-236-04-8	MicroSource Discovery Systems Inc.	1500201		[Na]	Cc1onc(c1C(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C(O)=O)-c1ccccc1Cl.[Na]	InChI=1S/C19H18ClN3O5S.Na.H/c1-8-11(12(22-28-8)9-6-4-5-7-10(9)20)15(24)21-13-16(25)23-14(18(26)27)19(2,3)29-17(13)23;;/h4-7,13-14,17H,1-3H3,(H,21,24)(H,26,27);;/t13-,14+,17-;;/m1../s1	JHYHSOKDRYSTLT-VICXVTCVSA-N	435.065569106							49566, 49566, 49566, 49566
Diloxanide Furoate	LSM-2223	Diloxanidefuroate, Diloxanide, Diloxanide Furoate	19529	InChI=1S/C14H11Cl2NO4/c1-17(13(18)12(15)16)9-4-6-10(7-5-9)21-14(19)11-3-2-8-20-11/h2-8,12H,1H3	BDYYDXJSHYEDGB-UHFFFAOYSA-N	CN(C(=O)C(Cl)Cl)c1ccc(OC(=O)c2occc2)cc1	BroadT	BRD-K10974103	BRD-K10974103-001-03-9	Prestwick Chemical Inc.	Prestw-903	D0701-MP04-ST03-200-		CN(C(=O)C(Cl)Cl)c1ccc(OC(=O)c2ccco2)cc1	InChI=1S/C14H11Cl2NO4/c1-17(13(18)12(15)16)9-4-6-10(7-5-9)21-14(19)11-3-2-8-20-11/h2-8,12H,1H3	BDYYDXJSHYEDGB-UHFFFAOYSA-N	327.006513262							4601
SR57227A	LSM-2188	SR-57227A, SID11111781, SID11113955, SID26752102, SID90340574, SR 57227A4-AMINO-1-(6-CHLORO-2-PYRIDYL)-PIPERIDINE HYDROCHLORIDE	131747	InChI=1S/C10H14ClN3/c11-9-2-1-3-10(13-9)14-6-4-8(12)5-7-14/h1-3,8H,4-7,12H2	WPVVMKYQOMJPIN-UHFFFAOYSA-N	NC1CCN(CC1)c2cccc(Cl)n2	BroadT	BRD-K09397065	BRD-K09397065-001-01-6	Biomol International Inc.	AC-561	2813-N1283		NC1CCN(CC1)c1cccc(Cl)n1	InChI=1S/C10H14ClN3/c11-9-2-1-3-10(13-9)14-6-4-8(12)5-7-14/h1-3,8H,4-7,12H2	WPVVMKYQOMJPIN-UHFFFAOYSA-N	211.087625188							92163, 92163
301836-43-1	LSM-1203	BRD-K09132007, SID124950699, D-4476	6419753	InChI=1S/C23H18N4O3/c24-22(28)14-4-6-15(7-5-14)23-26-20(21(27-23)17-3-1-2-10-25-17)16-8-9-18-19(13-16)30-12-11-29-18/h1-10,13H,11-12H2,(H2,24,28)(H,26,27)	DPDZHVCKYBCJHW-UHFFFAOYSA-N	NC(=O)c1ccc(cc1)c2nc(c3ccc4OCCOc4c3)c([nH]2)c5ccccn5	BroadT	BRD-K09132007	BRD-K09132007-001-01-8	Tocris Bioscience	2902	1		NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccccn1)-c1ccc2OCCOc2c1	InChI=1S/C23H18N4O3/c24-22(28)14-4-6-15(7-5-14)23-26-20(21(27-23)17-3-1-2-10-25-17)16-8-9-18-19(13-16)30-12-11-29-18/h1-10,13H,11-12H2,(H2,24,28)(H,26,27)	DPDZHVCKYBCJHW-UHFFFAOYSA-N	398.137890476							91448
Resveratrol 4'-methyl ether	LSM-43865	Resveratrol 4-Methyl Ether, (E)-5-(4-Methoxystyryl)Benzene-1,3-Diol, SID26747940	6255462	InChI=1S/C15H14O3/c1-18-15-6-4-11(5-7-15)2-3-12-8-13(16)10-14(17)9-12/h2-10,16-17H,1H3/b3-2+	IHVRWFJGOIWMGC-NSCUHMNNSA-N	COc1ccc(\C=C\c2cc(O)cc(O)c2)cc1	BroadT	BRD-K02671211	BRD-K02671211-001-02-2	MicroSource Discovery Systems Inc.	1504044			COc1ccc(cc1)\C=C\c1cc(O)cc(O)c1	InChI=1S/C15H14O3/c1-18-15-6-4-11(5-7-15)2-3-12-8-13(16)10-14(17)9-12/h2-10,16-17H,1H3/b3-2+	IHVRWFJGOIWMGC-NSCUHMNNSA-N	242.094294308							
Cinnarizine	LSM-42858	516 MD, Stutgin, Stunarone, Stugeron, Cinnarizine, R-516, R-1575	1547484	InChI=1S/C26H28N2/c1-4-11-23(12-5-1)13-10-18-27-19-21-28(22-20-27)26(24-14-6-2-7-15-24)25-16-8-3-9-17-25/h1-17,26H,18-22H2/b13-10+	DERZBLKQOCDDDZ-JLHYYAGUSA-N	C(\C=C\c1ccccc1)N2CCN(CC2)C(c3ccccc3)c4ccccc4	BroadT	BRD-K07220430	BRD-K07220430-001-03-6	Prestwick Chemical Inc.	Prestw-278	D0701-MP04-ST03-200-		C(\C=C\c1ccccc1)N1CCN(CC1)C(c1ccccc1)c1ccccc1	InChI=1S/C26H28N2/c1-4-11-23(12-5-1)13-10-18-27-19-21-28(22-20-27)26(24-14-6-2-7-15-24)25-16-8-3-9-17-25/h1-17,26H,18-22H2/b13-10+	DERZBLKQOCDDDZ-JLHYYAGUSA-N	368.225248916							31403
Sulfasalazine	LSM-5278	BRD-K10670311, SID11112423	5384001	InChI=1S/C18H14N4O5S/c23-16-9-6-13(11-15(16)18(24)25)21-20-12-4-7-14(8-5-12)28(26,27)22-17-3-1-2-10-19-17/h1-11,23H,(H,19,22)(H,24,25)	NCEXYHBECQHGNR-UHFFFAOYSA-N	OC(=O)c1cc(ccc1O)N=Nc2ccc(cc2)S(=O)(=O)Nc3ccccn3	BroadT	BRD-K10670311	BRD-K10670311-001-04-9	MicroSource Discovery Systems Inc.	1500552			OC(=O)c1cc(ccc1O)\N=N\c1ccc(cc1)S(=O)(=O)Nc1ccccn1	InChI=1S/C18H14N4O5S/c23-16-9-6-13(11-15(16)18(24)25)21-20-12-4-7-14(8-5-12)28(26,27)22-17-3-1-2-10-19-17/h1-11,23H,(H,19,22)(H,24,25)/b21-20+	NCEXYHBECQHGNR-QZQOTICOSA-N	398.068490278							
Emetine	LSM-2041	Emetine, GNF-PF-196, TCMDC-125531	10219	InChI=1S/C29H40N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3/t18-,21-,24+,25-/m0/s1	AUVVAXYIELKVAI-CKBKHPSWSA-N	CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@H]4NCCc5cc(OC)c(OC)cc45	BroadT	BRD-K03067624	BRD-K03067624-300-02-9	Prestwick Chemical Inc.	Prestw-570	D0701-MP04-ST03-200-	Cl.Cl	CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@H]1NCCc2cc(OC)c(OC)cc12.Cl.Cl	InChI=1S/C29H40N2O4.2ClH/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24;;/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3;2*1H/t18-,21-,24+,25-;;/m0../s1	JROGBPMEKVAPEH-GXGBFOEMSA-N	480.29880778							4781, 4781, 4781, 4781
MT-21	LSM-1969		4262	InChI=1S/C16H27NO3/c1-5-6-7-8-9-10-11-17-15(19)14(13(3)18)12(2)16(17,4)20/h20H,5-11H2,1-4H3	IWFCPVZRZLDTPI-UHFFFAOYSA-N	CCCCCCCCN1C(=O)C(=C(C)C1(C)O)C(=O)C	BroadT	BRD-A99449986	BRD-A99449986-001-01-4	EMD Biosciences	475952			CCCCCCCCN1C(=O)C(C(C)=O)=C(C)C1(C)O	InChI=1S/C16H27NO3/c1-5-6-7-8-9-10-11-17-15(19)14(13(3)18)12(2)16(17,4)20/h20H,5-11H2,1-4H3	IWFCPVZRZLDTPI-UHFFFAOYSA-N	281.199093734							91999
Carbetapentane	LSM-5240	Pentoxyverine, Carbetapentane	2562	InChI=1S/C20H31NO3/c1-3-21(4-2)14-15-23-16-17-24-19(22)20(12-8-9-13-20)18-10-6-5-7-11-18/h5-7,10-11H,3-4,8-9,12-17H2,1-2H3	CFJMRBQWBDQYMK-UHFFFAOYSA-N	CCN(CC)CCOCCOC(=O)C1(CCCC1)c2ccccc2	BroadT	BRD-K06181161	BRD-K06181161-048-07-8	Tocris Bioscience	454	1	OC(=O)CC(O)(CC(=O)O)C(=O)O	CCN(CC)CCOCCOC(=O)C1(CCCC1)c1ccccc1.OC(=O)CC(O)(CC(=O)O)C(=O)O	InChI=1S/C20H31NO3.C6H8O7/c1-3-21(4-2)14-15-23-16-17-24-19(22)20(12-8-9-13-20)18-10-6-5-7-11-18;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-7,10-11H,3-4,8-9,12-17H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)	AKJDEXBCRLOVTH-UHFFFAOYSA-N	333.230393862							94484, 94484
Pentosalen	LSM-2140	Imperatorin, Ammidin, Pentosalen	10212	InChI=1S/C16H14O4/c1-10(2)5-7-19-16-14-12(6-8-18-14)9-11-3-4-13(17)20-15(11)16/h3-6,8-9H,7H2,1-2H3	OLOOJGVNMBJLLR-UHFFFAOYSA-N	CC(=CCOc1c2OC(=O)C=Cc2cc3ccoc13)C	BroadT	BRD-K07117950	BRD-K07117950-001-02-6	AnalytiCon Discovery GmbH	NP-000253			CC(C)=CCOc1c2occc2cc2ccc(=O)oc12	InChI=1S/C16H14O4/c1-10(2)5-7-19-16-14-12(6-8-18-14)9-11-3-4-13(17)20-15(11)16/h3-6,8-9H,7H2,1-2H3	OLOOJGVNMBJLLR-UHFFFAOYSA-N	270.089208928							5885
Pridinol	LSM-6559		4904	InChI=1S/C20H25NO/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21/h1-2,4-7,10-13,22H,3,8-9,14-17H2	RQXCLMGKHJWMOA-UHFFFAOYSA-N	OC(CCN1CCCCC1)(c2ccccc2)c3ccccc3	BroadT	BRD-K17565903	BRD-K17565903-066-04-1	MicroSource Discovery Systems Inc.	1503077		CS(=O)(=O)O	OC(CCN1CCCCC1)(c1ccccc1)c1ccccc1.CS(=O)(=O)O	InChI=1S/C20H25NO.CH4O3S/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21;1-5(2,3)4/h1-2,4-7,10-13,22H,3,8-9,14-17H2;1H3,(H,2,3,4)	VNJHUUNVDMYCRH-UHFFFAOYSA-N	295.19361443							75247, 75247
Isotectorigenin Trimethyl Ether	LSM-19975	SID26749515, BRD-K10505056	3279840	InChI=1S/C19H18O6/c1-21-12-7-5-11(6-8-12)13-10-25-19-16(17(13)20)14(22-2)9-15(23-3)18(19)24-4/h5-10H,1-4H3	KCISFICQVCMQEX-UHFFFAOYSA-N	COc1ccc(cc1)C2=COc3c(OC)c(OC)cc(OC)c3C2=O	BroadT	BRD-K10505056	BRD-K10505056-001-02-0	MicroSource Discovery Systems Inc.	201341			COc1ccc(cc1)-c1coc2c(OC)c(OC)cc(OC)c2c1=O	InChI=1S/C19H18O6/c1-21-12-7-5-11(6-8-12)13-10-25-19-16(17(13)20)14(22-2)9-15(23-3)18(19)24-4/h5-10H,1-4H3	KCISFICQVCMQEX-UHFFFAOYSA-N	342.110338296							108594
Zolantidine	LSM-2182	BRD-K08996725, SK&F-95282	91769	InChI=1S/C22H27N3OS/c1-4-13-25(14-5-1)17-18-8-6-9-19(16-18)26-15-7-12-23-22-24-20-10-2-3-11-21(20)27-22/h2-3,6,8-11,16H,1,4-5,7,12-15,17H2,(H,23,24)	KUBONGDXTUOOLM-UHFFFAOYSA-N	C(CNc1nc2ccccc2s1)COc3cccc(CN4CCCCC4)c3	BroadT	BRD-K08996725	BRD-K08996725-313-01-7	Tocris Bioscience	1070	2	OC(=O)C=CC(=O)O.OC(=O)C=CC(=O)O	C(CNc1nc2ccccc2s1)COc1cccc(CN2CCCCC2)c1.OC(=O)C=CC(=O)O.OC(=O)C=CC(=O)O	InChI=1S/C22H27N3OS.2C4H4O4/c1-4-13-25(14-5-1)17-18-8-6-9-19(16-18)26-15-7-12-23-22-24-20-10-2-3-11-21(20)27-22;2*5-3(6)1-2-4(7)8/h2-3,6,8-11,16H,1,4-5,7,12-15,17H2,(H,23,24);2*1-2H,(H,5,6)(H,7,8)	IECBEVAUEBZJCF-UHFFFAOYSA-N	381.187483204							92158, 92158, 92158, 92158
CHEMBL300780	LSM-2087	BRD-K05181084, SID50112943	9891901	InChI=1S/C28H29Cl2N3O/c29-25-8-5-9-26(27(25)30)33-16-14-32(15-17-33)13-4-3-12-31-28(34)21-10-11-24-22(19-21)18-20-6-1-2-7-23(20)24/h1-2,5-11,19H,3-4,12-18H2,(H,31,34)	YJPWVCIGSHWNON-UHFFFAOYSA-N	Clc1cccc(N2CCN(CCCCNC(=O)c3ccc4c(Cc5ccccc45)c3)CC2)c1Cl	BroadT	BRD-K05181084	BRD-K05181084-003-02-9	Tocris Bioscience	2635	1	Cl	Clc1cccc(N2CCN(CCCCNC(=O)c3ccc-4c(Cc5ccccc-45)c3)CC2)c1Cl.Cl	InChI=1S/C28H29Cl2N3O.ClH/c29-25-8-5-9-26(27(25)30)33-16-14-32(15-17-33)13-4-3-12-31-28(34)21-10-11-24-22(19-21)18-20-6-1-2-7-23(20)24;/h1-2,5-11,19H,3-4,12-18H2,(H,31,34);1H	PFIWYJNBKGCVFM-UHFFFAOYSA-N	493.168767998							92089, 92089
AM-580	LSM-2132	AM580	2126	InChI=1S/C22H25NO3/c1-21(2)11-12-22(3,4)18-13-15(7-10-17(18)21)19(24)23-16-8-5-14(6-9-16)20(25)26/h5-10,13H,11-12H2,1-4H3,(H,23,24)(H,25,26)	SZWKGOZKRMMLAJ-UHFFFAOYSA-N	CC1(C)CCC(C)(C)c2cc(ccc12)C(=O)Nc3ccc(cc3)C(=O)O	BroadT	BRD-K06854232	BRD-K06854232-001-03-3	Tocris Bioscience	760	2		CC1(C)CCC(C)(C)c2cc(ccc12)C(=O)Nc1ccc(cc1)C(O)=O	InChI=1S/C22H25NO3/c1-21(2)11-12-22(3,4)18-13-15(7-10-17(18)21)19(24)23-16-8-5-14(6-9-16)20(25)26/h5-10,13H,11-12H2,1-4H3,(H,23,24)(H,25,26)	SZWKGOZKRMMLAJ-UHFFFAOYSA-N	351.18344367							64210
PP 3	LSM-2366	PP3, SID3717423, SID50105050	4879	InChI=1S/C11H9N5/c12-10-9-6-15-16(11(9)14-7-13-10)8-4-2-1-3-5-8/h1-7H,(H2,12,13,14)	KKDPIZPUTYIBFX-UHFFFAOYSA-N	Nc1ncnc2c1cnn2c3ccccc3	BroadT	BRD-K16977723	BRD-K16977723-001-01-0	Calbiochem	529574			Nc1ncnc2n(ncc12)-c1ccccc1	InChI=1S/C11H9N5/c12-10-9-6-15-16(11(9)14-7-13-10)8-4-2-1-3-5-8/h1-7H,(H2,12,13,14)	KKDPIZPUTYIBFX-UHFFFAOYSA-N	211.085795338							92303
Btcp	LSM-4551	Btcp, CS-110266, Btcp Hydrochloride	123692	InChI=1S/C19H25NS/c1-5-11-19(12-6-1,20-13-7-2-8-14-20)18-15-16-9-3-4-10-17(16)21-18/h3-4,9-10,15H,1-2,5-8,11-14H2	RGSVXQJPSWZXOP-UHFFFAOYSA-N	C1CCN(CC1)C2(CCCCC2)c3cc4ccccc4s3	BroadT	BRD-K15519488	BRD-K15519488-001-01-6	Biomol International Inc.	D-103	2812-3-N1298		C1CCN(CC1)C1(CCCCC1)c1cc2ccccc2s1	InChI=1S/C19H25NS/c1-5-11-19(12-6-1,20-13-7-2-8-14-20)18-15-16-9-3-4-10-17(16)21-18/h3-4,9-10,15H,1-2,5-8,11-14H2	RGSVXQJPSWZXOP-UHFFFAOYSA-N	299.1707705							64145, 64145
SB 221284	LSM-2316	SID11114053, SID29215039, BRD-K14807180	443389	InChI=1S/C16H14F3N3OS/c1-24-14-7-10-4-6-22(13(10)8-12(14)16(17,18)19)15(23)21-11-3-2-5-20-9-11/h2-3,5,7-9H,4,6H2,1H3,(H,21,23)	OQZOXHCRSXYSPM-UHFFFAOYSA-N	CSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F	BroadT	BRD-K14807180	BRD-K14807180-001-01-7	Tocris Bioscience	1379	1		CSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F	InChI=1S/C16H14F3N3OS/c1-24-14-7-10-4-6-22(13(10)8-12(14)16(17,18)19)15(23)21-11-3-2-5-20-9-11/h2-3,5,7-9H,4,6H2,1H3,(H,21,23)	OQZOXHCRSXYSPM-UHFFFAOYSA-N	353.080967388							8978
(+)-Artemisinin	LSM-6546	Artemisinin, Qinghaosu, (+)-Artemisinin	68827	InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9-,10+,11+,13-,14-,15-/m1/s1	BLUAFEHZUWYNDE-NNWCWBAJSA-N	C[C@@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4	BroadT	BRD-K13112821	BRD-K13112821-001-08-3	Tocris Bioscience	2668	1		C[C@@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4	InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9-,10+,11+,13-,14-,15-/m1/s1	BLUAFEHZUWYNDE-NNWCWBAJSA-N	282.146723804							223316
Tpen	LSM-19976	SID26756871	5519	InChI=1S/C26H28N6/c1-5-13-27-23(9-1)19-31(20-24-10-2-6-14-28-24)17-18-32(21-25-11-3-7-15-29-25)22-26-12-4-8-16-30-26/h1-16H,17-22H2	CVRXLMUYFMERMJ-UHFFFAOYSA-N	C(CN(Cc1ccccn1)Cc2ccccn2)N(Cc3ccccn3)Cc4ccccn4	BroadT	BRD-K10385824	BRD-K10385824-001-02-8	Biomol International Inc.	AP-300	2840(V2)-3-N1305		C(CN(Cc1ccccn1)Cc1ccccn1)N(Cc1ccccn1)Cc1ccccn1	InChI=1S/C26H28N6/c1-5-13-27-23(9-1)19-31(20-24-10-2-6-14-28-24)17-18-32(21-25-11-3-7-15-29-25)22-26-12-4-8-16-30-26/h1-16H,17-22H2	CVRXLMUYFMERMJ-UHFFFAOYSA-N	424.237544956							88217
Tyrphostin 25	LSM-2054	2-(3,4,5-Trihydroxybenzylidene)Malononitrile, Tyrphostin Ag 82, Tyrphostin 25	2061	InChI=1S/C10H6N2O3/c11-4-7(5-12)1-6-2-8(13)10(15)9(14)3-6/h1-3,13-15H	YZOFLYUAQDJWKV-UHFFFAOYSA-N	Oc1cc(C=C(C#N)C#N)cc(O)c1O	BroadT	BRD-K03670461	BRD-K03670461-001-02-0	Calbiochem	658400			Oc1cc(C=C(C#N)C#N)cc(O)c1O	InChI=1S/C10H6N2O3/c11-4-7(5-12)1-6-2-8(13)10(15)9(14)3-6/h1-3,13-15H	YZOFLYUAQDJWKV-UHFFFAOYSA-N	202.037842072							92063
Perphenazine	LSM-2224	Perphenazine, Trilafon, Fentazin, Etaperazine, Decentan, Chlorpiprazine, Perphenazine Fendizoate, Perphenazine Maleate, Trilafon-LA	4748	InChI=1S/C21H26ClN3OS/c22-17-6-7-21-19(16-17)25(18-4-1-2-5-20(18)27-21)9-3-8-23-10-12-24(13-11-23)14-15-26/h1-2,4-7,16,26H,3,8-15H2	RGCVKNLCSQQDEP-UHFFFAOYSA-N	OCCN1CCN(CCCN2c3ccccc3Sc4ccc(Cl)cc24)CC1	BroadT	BRD-K10995081	BRD-K10995081-001-05-5	Prestwick Chemical Inc.	Prestw-125	D0701-MP04-ST03-200-		OCCN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc23)CC1	InChI=1S/C21H26ClN3OS/c22-17-6-7-21-19(16-17)25(18-4-1-2-5-20(18)27-21)9-3-8-23-10-12-24(13-11-23)14-15-26/h1-2,4-7,16,26H,3,8-15H2	RGCVKNLCSQQDEP-UHFFFAOYSA-N	403.148510882							8028
Cinoxacin	LSM-6552	64716, Cinoxacin, Cinobac	2762	InChI=1S/C12H10N2O5/c1-2-14-7-4-9-8(18-5-19-9)3-6(7)11(15)10(13-14)12(16)17/h3-4H,2,5H2,1H3,(H,16,17)	VDUWPHTZYNWKRN-UHFFFAOYSA-N	CCN1N=C(C(=O)O)C(=O)c2cc3OCOc3cc12	BroadT	BRD-K14704277	BRD-K14704277-001-04-4	MicroSource Discovery Systems Inc.	1500190			CCn1nc(C(O)=O)c(=O)c2cc3OCOc3cc12	InChI=1S/C12H10N2O5/c1-2-14-7-4-9-8(18-5-19-9)3-6(7)11(15)10(13-14)12(16)17/h3-4H,2,5H2,1H3,(H,16,17)	VDUWPHTZYNWKRN-UHFFFAOYSA-N	262.05897144							3716
Norfloxacin	LSM-5286	Quinabic, Noroxin, Norfloxacin, Chibroxin, Baccidal, MK-366	4539	InChI=1S/C16H18FN3O3/c1-2-19-9-11(16(22)23)15(21)10-7-12(17)14(8-13(10)19)20-5-3-18-4-6-20/h7-9,18H,2-6H2,1H3,(H,22,23)	OGJPXUAPXNRGGI-UHFFFAOYSA-N	CCN1C=C(C(=O)O)C(=O)c2cc(F)c(cc12)N3CCNCC3	BroadT	BRD-K11196887	BRD-K11196887-001-04-8	MicroSource Discovery Systems Inc.	1500440			CCn1cc(C(O)=O)c(=O)c2cc(F)c(cc12)N1CCNCC1	InChI=1S/C16H18FN3O3/c1-2-19-9-11(16(22)23)15(21)10-7-12(17)14(8-13(10)19)20-5-3-18-4-6-20/h7-9,18H,2-6H2,1H3,(H,22,23)	OGJPXUAPXNRGGI-UHFFFAOYSA-N	319.133219666							100246
3-Prenyl-4-hydroxyacetophenone	LSM-19977	BRD-K14262397, SID26657858	442916	InChI=1S/C13H16O2/c1-9(2)4-5-12-8-11(10(3)14)6-7-13(12)15/h4,6-8,15H,5H2,1-3H3	QJAPFSSVKIZTMR-UHFFFAOYSA-N	CC(=CCc1cc(ccc1O)C(=O)C)C	BroadT	BRD-K14262397	BRD-K14262397-001-02-2	AnalytiCon Discovery GmbH	NP-005012			CC(C)=CCc1cc(ccc1O)C(C)=O	InChI=1S/C13H16O2/c1-9(2)4-5-12-8-11(10(3)14)6-7-13(12)15/h4,6-8,15H,5H2,1-3H3	QJAPFSSVKIZTMR-UHFFFAOYSA-N	204.115029752							
Zaprinast	LSM-2259		5722	InChI=1S/C13H13N5O2/c1-2-7-20-9-6-4-3-5-8(9)11-14-12-10(13(19)15-11)16-18-17-12/h3-6H,2,7H2,1H3,(H2,14,15,16,17,18,19)	REZGGXNDEMKIQB-UHFFFAOYSA-N	CCCOc1ccccc1C2=Nc3[nH]nnc3C(=O)N2	BroadT	BRD-K16542329	BRD-K16542329-001-05-1	Biomol International Inc.	PD-190	2840(V2)-3-N1305		CCCOc1ccccc1-c1nc2[nH]nnc2c(=O)[nH]1	InChI=1S/C13H13N5O2/c1-2-7-20-9-6-4-3-5-8(9)11-14-12-10(13(19)15-11)16-18-17-12/h3-6H,2,7H2,1H3,(H2,14,15,16,17,18,19)	REZGGXNDEMKIQB-UHFFFAOYSA-N	271.106924706							92215
Tanshinone IIA	LSM-19978	Tanshinone IIA, Tanshinone Ii A	164676	InChI=1S/C19H18O3/c1-10-9-22-18-12-6-7-13-11(5-4-8-19(13,2)3)15(12)17(21)16(20)14(10)18/h6-7,9H,4-5,8H2,1-3H3	HYXITZLLTYIPOF-UHFFFAOYSA-N	Cc1coc2c3ccc4c(CCCC4(C)C)c3C(=O)C(=O)c12	BroadT	BRD-K00141480	BRD-K00141480-001-03-0	Biomol International Inc.	GR-336	2840(V2)-3-N1305		Cc1coc-2c1C(=O)C(=O)c1c-2ccc2c1CCCC2(C)C	InChI=1S/C19H18O3/c1-10-9-22-18-12-6-7-13-11(5-4-8-19(13,2)3)15(12)17(21)16(20)14(10)18/h6-7,9H,4-5,8H2,1-3H3	HYXITZLLTYIPOF-UHFFFAOYSA-N	294.125594436							108595
Alpha-cyano-3-hydroxycinnamic acid	LSM-43866	Alpha-Cyano-3-Hydroxycinnamic Acid, Alpha-Cyano-3-Hydroxycinnamicacid, SID26749899	5353398	InChI=1S/C10H7NO3/c11-6-8(10(13)14)4-7-2-1-3-9(12)5-7/h1-5,12H,(H,13,14)/b8-4+	HPLNTJVXWMJLNJ-XBXARRHUSA-N	OC(=O)\C(=C\c1cccc(O)c1)\C#N	BroadT	BRD-K08199068	BRD-K08199068-001-02-2	MicroSource Discovery Systems Inc.	1502095			OC(=O)C(=C\c1cccc(O)c1)\C#N	InChI=1S/C10H7NO3/c11-6-8(10(13)14)4-7-2-1-3-9(12)5-7/h1-5,12H,(H,13,14)/b8-4+	HPLNTJVXWMJLNJ-XBXARRHUSA-N	189.042593094							
SB 228357	LSM-19980	SB-228357, BRD-K15424032	443390	InChI=1S/C22H17F4N3O2/c1-31-20-9-13-4-6-29(19(13)11-18(20)22(24,25)26)21(30)28-17-8-15(7-16(23)10-17)14-3-2-5-27-12-14/h2-3,5,7-12H,4,6H2,1H3,(H,28,30)	RRJLJKRFFRZRAF-UHFFFAOYSA-N	COc1cc2CCN(C(=O)Nc3cc(F)cc(c3)c4cccnc4)c2cc1C(F)(F)F	BroadT	BRD-K15424032	BRD-K15424032-001-01-0	Tocris Bioscience	1375	1		COc1cc2CCN(C(=O)Nc3cc(F)cc(c3)-c3cccnc3)c2cc1C(F)(F)F	InChI=1S/C22H17F4N3O2/c1-31-20-9-13-4-6-29(19(13)11-18(20)22(24,25)26)21(30)28-17-8-15(7-16(23)10-17)14-3-2-5-27-12-14/h2-3,5,7-12H,4,6H2,1H3,(H,28,30)	RRJLJKRFFRZRAF-UHFFFAOYSA-N	431.125689614							8979
Cefoperazone	LSM-15520	Cefoperazone	44187	InChI=1S/C25H27N9O8S2/c1-3-32-8-9-33(21(39)20(32)38)24(42)27-15(12-4-6-14(35)7-5-12)18(36)26-16-19(37)34-17(23(40)41)13(10-43-22(16)34)11-44-25-28-29-30-31(25)2/h4-7,15-16,22,35H,3,8-11H2,1-2H3,(H,26,36)(H,27,42)(H,40,41)/t15-,16-,22-/m1/s1	GCFBRXLSHGKWDP-XCGNWRKASA-N	CCN1CCN(C(=O)N[C@@H](C(=O)N[C@H]2[C@H]3SCC(=C(N3C2=O)C(=O)O)CSc4nnnn4C)c5ccc(O)cc5)C(=O)C1=O	BroadT	BRD-K02292852	BRD-K02292852-335-03-1	Prestwick Chemical Inc.	Prestw-327	D0701-MP04-ST03-200-	O.O	CCN1CCN(C(=O)N[C@@H](C(=O)N[C@H]2[C@H]3SCC(CSc4nnnn4C)=C(N3C2=O)C(O)=O)c2ccc(O)cc2)C(=O)C1=O.O.O	InChI=1S/C25H27N9O8S2.2H2O/c1-3-32-8-9-33(21(39)20(32)38)24(42)27-15(12-4-6-14(35)7-5-12)18(36)26-16-19(37)34-17(23(40)41)13(10-43-22(16)34)11-44-25-28-29-30-31(25)2;;/h4-7,15-16,22,35H,3,8-11H2,1-2H3,(H,26,36)(H,27,42)(H,40,41);2*1H2/t15-,16-,22-;;/m1../s1	OMYIZCZQILAOGB-BYLXUVCXSA-N	645.142400294							3493, 3493, 3493, 3493
L701324	LSM-2157	L-701,324, L-701324	54682505	InChI=1S/C21H14ClNO3/c22-14-9-10-17-18(12-14)23-21(25)19(20(17)24)13-5-4-8-16(11-13)26-15-6-2-1-3-7-15/h1-12H,(H2,23,24,25)	FLVRDMUHUXVRET-UHFFFAOYSA-N	OC1=C(C(=O)Nc2cc(Cl)ccc12)c3cccc(Oc4ccccc4)c3	BroadT	BRD-K08109516	BRD-K08109516-001-01-1	Biomol International Inc.	AC-405	2817-N1277		Oc1c(-c2cccc(Oc3ccccc3)c2)c(=O)[nH]c2cc(Cl)ccc12	InChI=1S/C21H14ClNO3/c22-14-9-10-17-18(12-14)23-21(25)19(20(17)24)13-5-4-8-16(11-13)26-15-6-2-1-3-7-15/h1-12H,(H2,23,24,25)	FLVRDMUHUXVRET-UHFFFAOYSA-N	363.066221028							92140
Mibefradil	LSM-2192	Mibefradil, Posicor, BRD-K09549677	60663	InChI=1S/C29H38FN3O3/c1-20(2)28-23-12-11-22(30)18-21(23)13-14-29(28,36-27(34)19-35-4)15-17-33(3)16-7-10-26-31-24-8-5-6-9-25(24)32-26/h5-6,8-9,11-12,18,20,28H,7,10,13-17,19H2,1-4H3,(H,31,32)/t28-,29-/m0/s1	HBNPJJILLOYFJU-VMPREFPWSA-N	COCC(=O)O[C@]1(CCN(C)CCCc2nc3ccccc3[nH]2)CCc4cc(F)ccc4[C@@H]1C(C)C	BroadT	BRD-K09549677	BRD-K09549677-300-01-8	Tocris Bioscience	2198	2	Cl.Cl	COCC(=O)O[C@]1(CCN(C)CCCc2nc3ccccc3[nH]2)CCc2cc(F)ccc2[C@@H]1C(C)C.Cl.Cl	InChI=1S/C29H38FN3O3.2ClH/c1-20(2)28-23-12-11-22(30)18-21(23)13-14-29(28,36-27(34)19-35-4)15-17-33(3)16-7-10-26-31-24-8-5-6-9-25(24)32-26;;/h5-6,8-9,11-12,18,20,28H,7,10,13-17,19H2,1-4H3,(H,31,32);2*1H/t28-,29-;;/m0../s1	MTJLQTFHJIHXIX-GDUXWEAWSA-N	495.289720306							6920, 6920, 6920
GTP 14564	LSM-2363	GTP-14564	3385203	InChI=1S/C15H10N2O/c1-2-6-10(7-3-1)13-15-14(17-16-13)11-8-4-5-9-12(11)18-15/h1-9H,(H,16,17)	DZQLVVLATXPWBK-UHFFFAOYSA-N	o1c2ccccc2c3[nH]nc(c4ccccc4)c13	BroadT	BRD-K16664969	BRD-K16664969-001-01-7	Calbiochem	371806			c1ccc(cc1)-c1n[nH]c2c1oc1ccccc21	InChI=1S/C15H10N2O/c1-2-6-10(7-3-1)13-15-14(17-16-13)11-8-4-5-9-12(11)18-15/h1-9H,(H,16,17)	DZQLVVLATXPWBK-UHFFFAOYSA-N	234.07931296							92300
Promazine	LSM-2137	Promazine	4926	InChI=1S/C17H20N2S/c1-18(2)12-7-13-19-14-8-3-5-10-16(14)20-17-11-6-4-9-15(17)19/h3-6,8-11H,7,12-13H2,1-2H3	ZGUGWUXLJSTTMA-UHFFFAOYSA-N	CN(C)CCCN1c2ccccc2Sc3ccccc13	BroadT	BRD-K06980535	BRD-K06980535-003-04-4	MicroSource Discovery Systems Inc.	1500509		Cl	CN(C)CCCN1c2ccccc2Sc2ccccc12.Cl	InChI=1S/C17H20N2S.ClH/c1-18(2)12-7-13-19-14-8-3-5-10-16(14)20-17-11-6-4-9-15(17)19;/h3-6,8-11H,7,12-13H2,1-2H3;1H	JIVSXRLRGOICGA-UHFFFAOYSA-N	284.13471935							8459, 8459
Xylometazoline	LSM-5262	Xylometazoline	5709	InChI=1S/C16H24N2/c1-11-8-13(16(3,4)5)9-12(2)14(11)10-15-17-6-7-18-15/h8-9H,6-7,10H2,1-5H3,(H,17,18)	HUCJFAOMUPXHDK-UHFFFAOYSA-N	Cc1cc(cc(C)c1CC2=NCCN2)C(C)(C)C	BroadT	BRD-K08356259	BRD-K08356259-003-05-6	Prestwick Chemical Inc.	Prestw-223	D0701-MP04-ST03-200-	Cl	Cc1cc(cc(C)c1CC1=NCCN1)C(C)(C)C.Cl	InChI=1S/C16H24N2.ClH/c1-11-8-13(16(3,4)5)9-12(2)14(11)10-15-17-6-7-18-15;/h8-9H,6-7,10H2,1-5H3,(H,17,18);1H	YGWFCQYETHJKNX-UHFFFAOYSA-N	244.193948788							10082, 10082
Aminogenistein	LSM-2083		125519	InChI=1S/C15H11NO3/c16-10-3-1-9(2-4-10)15-8-13(18)12-7-11(17)5-6-14(12)19-15/h1-8,17H,16H2	YBQRUOMICVULNM-UHFFFAOYSA-N	Nc1ccc(cc1)C2=CC(=O)c3cc(O)ccc3O2	BroadT	BRD-K04976539	BRD-K04976539-001-01-0	EMD Biosciences	155100			Nc1ccc(cc1)-c1cc(=O)c2cc(O)ccc2o1	InChI=1S/C15H11NO3/c16-10-3-1-9(2-4-10)15-8-13(18)12-7-11(17)5-6-14(12)19-15/h1-8,17H,16H2	YBQRUOMICVULNM-UHFFFAOYSA-N	253.073893222							92085
Mead Ethanolamide	LSM-42871		16061185	InChI=1S/C22H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h9-10,12-13,15-16,24H,2-8,11,14,17-21H2,1H3,(H,23,25)/b10-9-,13-12-,16-15-	YKGQBEGMUSSPFY-YOILPLPUSA-N	CCCCCCCC\C=C/C\C=C/C\C=C/CCCC(=O)NCCO	BroadT	BRD-K09764130	BRD-K09764130-001-02-6	Biomol International Inc.	FA027	2840(V2)-3-N1305		CCCCCCCC\C=C/C\C=C/C\C=C/CCCC(=O)NCCO	InChI=1S/C22H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h9-10,12-13,15-16,24H,2-8,11,14,17-21H2,1H3,(H,23,25)/b10-9-,13-12-,16-15-	YKGQBEGMUSSPFY-YOILPLPUSA-N	349.298079498							
Corynantheine	LSM-2124	Corynanthine, Corynantheine	92766	InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19-/m0/s1	BLGXFZZNTVWLAY-DKJBZYCGSA-N	COC(=O)[C@@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12	BroadT	BRD-K06467078	BRD-K06467078-001-01-5	AnalytiCon Discovery GmbH	NP-010649			COC(=O)[C@@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12	InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19-/m0/s1	BLGXFZZNTVWLAY-DKJBZYCGSA-N	354.194342712							92122, 92122
JWH-015	LSM-2386	BRD-K17796732, JWH-015	4273754	InChI=1S/C23H21NO/c1-3-15-24-16(2)22(20-12-6-7-14-21(20)24)23(25)19-13-8-10-17-9-4-5-11-18(17)19/h4-14H,3,15H2,1-2H3	LJSBBBWQTLXQEN-UHFFFAOYSA-N	CCCn1c(C)c(C(=O)c2cccc3ccccc23)c4ccccc14	BroadT	BRD-K17796732	BRD-K17796732-001-02-0	Tocris Bioscience	1341	2		CCCn1c(C)c(C(=O)c2cccc3ccccc23)c2ccccc12	InChI=1S/C23H21NO/c1-3-15-24-16(2)22(20-12-6-7-14-21(20)24)23(25)19-13-8-10-17-9-4-5-11-18(17)19/h4-14H,3,15H2,1-2H3	LJSBBBWQTLXQEN-UHFFFAOYSA-N	327.162314302							92318
Methyl-6,7-dimethoxy-4-ethyl-beta-carboline-3-carboxylate	LSM-2318		104999	InChI=1S/C17H18N2O4/c1-5-9-15-10-6-13(21-2)14(22-3)7-11(10)19-12(15)8-18-16(9)17(20)23-4/h6-8,19H,5H2,1-4H3	GADIKQPUNWAMEB-UHFFFAOYSA-N	CCc1c(ncc2[nH]c3cc(OC)c(OC)cc3c12)C(=O)OC	BroadT	BRD-K14844937	BRD-K14844937-001-01-6	Biomol International Inc.	AC-769	2819-N1292		CCc1c(ncc2[nH]c3cc(OC)c(OC)cc3c12)C(=O)OC	InChI=1S/C17H18N2O4/c1-5-9-15-10-6-13(21-2)14(22-3)7-11(10)19-12(15)8-18-16(9)17(20)23-4/h6-8,19H,5H2,1-4H3	GADIKQPUNWAMEB-UHFFFAOYSA-N	314.126657076							92263
Propanil	LSM-19981	Propanil	4933	InChI=1S/C9H9Cl2NO/c1-2-9(13)12-6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3,(H,12,13)	LFULEKSKNZEWOE-UHFFFAOYSA-N	CCC(=O)Nc1ccc(Cl)c(Cl)c1	BroadT	BRD-K08618283	BRD-K08618283-001-02-0	MicroSource Discovery Systems Inc.	330027			CCC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C9H9Cl2NO/c1-2-9(13)12-6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3,(H,12,13)	LFULEKSKNZEWOE-UHFFFAOYSA-N	217.006119338							34936
RS-100329	LSM-2172	BRD-K08640512, RS-100329	3567002	InChI=1S/C20H25F3N4O3/c1-15-13-24-19(29)27(18(15)28)8-4-7-25-9-11-26(12-10-25)16-5-2-3-6-17(16)30-14-20(21,22)23/h2-3,5-6,13H,4,7-12,14H2,1H3,(H,24,29)	RCOBWVAGWYRNHZ-UHFFFAOYSA-N	CC1=CNC(=O)N(CCCN2CCN(CC2)c3ccccc3OCC(F)(F)F)C1=O	BroadT	BRD-K08640512	BRD-K08640512-003-01-5	Tocris Bioscience	1325	2	Cl	Cc1c[nH]c(=O)n(CCCN2CCN(CC2)c2ccccc2OCC(F)(F)F)c1=O.Cl	InChI=1S/C20H25F3N4O3.ClH/c1-15-13-24-19(29)27(18(15)28)8-4-7-25-9-11-26(12-10-25)16-5-2-3-6-17(16)30-14-20(21,22)23;/h2-3,5-6,13H,4,7-12,14H2,1H3,(H,24,29);1H	CWVABCXVOAVUJL-UHFFFAOYSA-N	426.1878753							92149
Pindolol	LSM-1953	Pindolol, Prinodolol, Visken, LB-46	4828	InChI=1S/C14H20N2O2/c1-10(2)16-8-11(17)9-18-14-5-3-4-13-12(14)6-7-15-13/h3-7,10-11,15-17H,8-9H2,1-2H3	JZQKKSLKJUAGIC-UHFFFAOYSA-N	CC(C)NCC(O)COc1cccc2[nH]ccc12	BroadT	BRD-A97701745	BRD-A97701745-001-04-6	MicroSource Discovery Systems Inc.	1500488			CC(C)NCC(O)COc1cccc2[nH]ccc12	InChI=1S/C14H20N2O2/c1-10(2)16-8-11(17)9-18-14-5-3-4-13-12(14)6-7-15-13/h3-7,10-11,15-17H,8-9H2,1-2H3	JZQKKSLKJUAGIC-UHFFFAOYSA-N	248.1524779							8214
3,4-Dimethoxy-6-nitrobenzaldehyde	LSM-19982	SID26753198	88505	InChI=1S/C9H9NO5/c1-14-8-3-6(5-11)7(10(12)13)4-9(8)15-2/h3-5H,1-2H3	YWSPWKXREVSQCA-UHFFFAOYSA-N	COc1cc(C=O)c(cc1OC)[N+](=O)[O-]	BroadT	BRD-K03564313	BRD-K03564313-001-02-5	Tocris Bioscience	2088	1		COc1cc(C=O)c(cc1OC)[N+]([O-])=O	InChI=1S/C9H9NO5/c1-14-8-3-6(5-11)7(10(12)13)4-9(8)15-2/h3-5H,1-2H3	YWSPWKXREVSQCA-UHFFFAOYSA-N	211.048072398							108597
Raclopride	LSM-2064	Raclopride	3033769	InChI=1S/C15H20Cl2N2O3/c1-3-19-6-4-5-9(19)8-18-15(21)12-13(20)10(16)7-11(17)14(12)22-2/h7,9,20H,3-6,8H2,1-2H3,(H,18,21)/t9-/m0/s1	WAOQONBSWFLFPE-VIFPVBQESA-N	CCN1CCC[C@H]1CNC(=O)c2c(O)c(Cl)cc(Cl)c2OC	BroadT	BRD-K04111260	BRD-K04111260-001-01-9	Biomol International Inc.	AC-757	2812-3-N1298		CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(Cl)c1OC	InChI=1S/C15H20Cl2N2O3/c1-3-19-6-4-5-9(19)8-18-15(21)12-13(20)10(16)7-11(17)14(12)22-2/h7,9,20H,3-6,8H2,1-2H3,(H,18,21)/t9-/m0/s1	WAOQONBSWFLFPE-VIFPVBQESA-N	346.08509794							92070, 92070, 92070
Sulfaphenazole	LSM-5279	Sulfaphenazole, Sulphaphenazole, Sulfafenazol, Sulfabid	5335	InChI=1S/C15H14N4O2S/c16-12-6-8-14(9-7-12)22(20,21)18-15-10-11-17-19(15)13-4-2-1-3-5-13/h1-11,18H,16H2	QWCJHSGMANYXCW-UHFFFAOYSA-N	Nc1ccc(cc1)S(=O)(=O)Nc2ccnn2c3ccccc3	BroadT	BRD-K10671814	BRD-K10671814-001-04-9	MicroSource Discovery Systems Inc.	1501143			Nc1ccc(cc1)S(=O)(=O)Nc1ccnn1-c1ccccc1	InChI=1S/C15H14N4O2S/c16-12-6-8-14(9-7-12)22(20,21)18-15-10-11-17-19(15)13-4-2-1-3-5-13/h1-11,18H,16H2	QWCJHSGMANYXCW-UHFFFAOYSA-N	314.083746418							77780
GSK-3BETA Inhibitor VI	LSM-19983		6539171	InChI=1S/C6H3Br2ClOS/c7-3-1-5(4(10)2-9)11-6(3)8/h1H,2H2	KYVDGDMQERQKOY-UHFFFAOYSA-N	ClCC(=O)c1cc(Br)c(Br)s1	BroadT	BRD-K08939002	BRD-K08939002-001-01-2	Calbiochem	361547			ClCC(=O)c1cc(Br)c(Br)s1	InChI=1S/C6H3Br2ClOS/c7-3-1-5(4(10)2-9)11-6(3)8/h1H,2H2	KYVDGDMQERQKOY-UHFFFAOYSA-N	315.795988316							108598
Ciprofloxacin	LSM-5226	Velmonit, Ciprofloxacin, Ciprobay, Cipro, Ciloxan, BAY-Q-3939	2764	InChI=1S/C17H18FN3O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24/h7-10,19H,1-6H2,(H,23,24)	MYSWGUAQZAJSOK-UHFFFAOYSA-N	OC(=O)C1=CN(C2CC2)c3cc(N4CCNCC4)c(F)cc3C1=O	BroadT	BRD-K04804440	BRD-K04804440-311-02-3	Prestwick Chemical Inc.	Prestw-113	D0701-MP04-ST03-200-	O.Cl	OC(=O)c1cn(C2CC2)c2cc(N3CCNCC3)c(F)cc2c1=O.O.Cl	InChI=1S/C17H18FN3O3.ClH.H2O/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24;;/h7-10,19H,1-6H2,(H,23,24);1H;1H2	ARPUHYJMCVWYCZ-UHFFFAOYSA-N	331.133219666							100241, 100241, 100241
1-(1-Naphthyl)piperazine	LSM-19984	BRD-K05977380, SID11111754, SID124881353	1342	InChI=1S/C14H16N2/c1-2-6-13-12(4-1)5-3-7-14(13)16-10-8-15-9-11-16/h1-7,15H,8-11H2	VNICFCQJUVFULD-UHFFFAOYSA-N	C1CN(CCN1)c2cccc3ccccc23	BroadT	BRD-K05977380	BRD-K05977380-001-01-7	Biomol International Inc.	NS-660	2813-N1283		C1CN(CCN1)c1cccc2ccccc12	InChI=1S/C14H16N2/c1-2-6-13-12(4-1)5-3-7-14(13)16-10-8-15-9-11-16/h1-7,15H,8-11H2	VNICFCQJUVFULD-UHFFFAOYSA-N	212.131348532							108599, 108599
Sulfamethazine	LSM-5295	Sulfamethazine, Sulfadimidine, SMZ-MED 454, Sulfamethazine (Trisulfapyrimidines)	5327	InChI=1S/C12H14N4O2S/c1-8-7-9(2)15-12(14-8)16-19(17,18)11-5-3-10(13)4-6-11/h3-7H,13H2,1-2H3,(H,14,15,16)	ASWVTGNCAZCNNR-UHFFFAOYSA-N	Cc1cc(C)nc(NS(=O)(=O)c2ccc(N)cc2)n1	BroadT	BRD-K11640013	BRD-K11640013-001-02-6	MicroSource Discovery Systems Inc.	1500548			Cc1cc(C)nc(NS(=O)(=O)c2ccc(N)cc2)n1	InChI=1S/C12H14N4O2S/c1-8-7-9(2)15-12(14-8)16-19(17,18)11-5-3-10(13)4-6-11/h3-7H,13H2,1-2H3,(H,14,15,16)	ASWVTGNCAZCNNR-UHFFFAOYSA-N	278.083746418							102265, 102265
Belinostat	LSM-43181	Belinostat, RLM-2-89, PXD-101, PXD101	6918638	InChI=1S/C15H14N2O4S/c18-15(16-19)10-9-12-5-4-8-14(11-12)22(20,21)17-13-6-2-1-3-7-13/h1-11,17,19H,(H,16,18)/b10-9+	NCNRHFGMJRPRSK-MDZDMXLPSA-N	ONC(=O)\C=C\c1cccc(c1)S(=O)(=O)Nc2ccccc2	BroadT	BRD-K17743125	BRD-K17743125-001-01-9	Broad Institute CMLD	RLM-2-89			ONC(=O)\C=C\c1cccc(c1)S(=O)(=O)Nc1ccccc1	InChI=1S/C15H14N2O4S/c18-15(16-19)10-9-12-5-4-8-14(11-12)22(20,21)17-13-6-2-1-3-7-13/h1-11,17,19H,(H,16,18)/b10-9+	NCNRHFGMJRPRSK-MDZDMXLPSA-N	318.067427638							61076
L 741,742	LSM-2276	L-741,742, L-741742	133008	InChI=1S/C23H25ClN2O/c1-17-22(25-27-23(17)20-7-9-21(24)10-8-20)19-12-15-26(16-13-19)14-11-18-5-3-2-4-6-18/h2-10,19H,11-16H2,1H3	QDMAKDIDFJTXEL-UHFFFAOYSA-N	Cc1c(onc1C2CCN(CCc3ccccc3)CC2)c4ccc(Cl)cc4	BroadT	BRD-K13211965	BRD-K13211965-001-01-4	Biomol International Inc.	AC-263	2812-3-N1298		Cc1c(noc1-c1ccc(Cl)cc1)C1CCN(CCc2ccccc2)CC1	InChI=1S/C23H25ClN2O/c1-17-22(25-27-23(17)20-7-9-21(24)10-8-20)19-12-15-26(16-13-19)14-11-18-5-3-2-4-6-18/h2-10,19H,11-16H2,1H3	QDMAKDIDFJTXEL-UHFFFAOYSA-N	380.16554115							92229
Juarezic acid	LSM-43867	(E,E)-Cinnamylideneacetic Acid	1549512	InChI=1S/C11H10O2/c12-11(13)9-5-4-8-10-6-2-1-3-7-10/h1-9H,(H,12,13)/b8-4+,9-5+	FEIQOMCWGDNMHM-KBXRYBNXSA-N	OC(=O)\C=C\C=C\c1ccccc1	BroadT	BRD-K12345912	BRD-K12345912-001-02-3	MicroSource Discovery Systems Inc.	203008			OC(=O)\C=C\C=C\c1ccccc1	InChI=1S/C11H10O2/c12-11(13)9-5-4-8-10-6-2-1-3-7-10/h1-9H,(H,12,13)/b8-4+,9-5+	FEIQOMCWGDNMHM-KBXRYBNXSA-N	174.06807956							
Brinaldix	LSM-5337	Clopamide	12492	InChI=1S/C14H20ClN3O3S/c1-9-4-3-5-10(2)18(9)17-14(19)11-6-7-12(15)13(8-11)22(16,20)21/h6-10H,3-5H2,1-2H3,(H,17,19)(H2,16,20,21)/t9-,10+	LBXHRAWDUMTPSE-AOOOYVTPSA-N	C[C@H]1CCC[C@@H](C)N1NC(=O)c2ccc(Cl)c(c2)S(=O)(=O)N	BroadT	BRD-K15567837	BRD-K15567837-001-02-1	Prestwick Chemical Inc.	Prestw-354	D0701-MP04-ST03-200-		C[C@H]1CCC[C@@H](C)N1NC(=O)c1ccc(Cl)c(c1)S(N)(=O)=O	InChI=1S/C14H20ClN3O3S/c1-9-4-3-5-10(2)18(9)17-14(19)11-6-7-12(15)13(8-11)22(16,20)21/h6-10H,3-5H2,1-2H3,(H,17,19)(H2,16,20,21)/t9-,10+	LBXHRAWDUMTPSE-AOOOYVTPSA-N	345.09138993							94521
Trans-1,4-bis(2-chlorobenzaminomethyl)cyclohexane dihydrochloride	LSM-2053	BRD-K03642198, AY-9944	9705	InChI=1S/C22H28Cl2N2/c23-21-7-3-1-5-19(21)15-25-13-17-9-11-18(12-10-17)14-26-16-20-6-2-4-8-22(20)24/h1-8,17-18,25-26H,9-16H2	RZRPZWGIOOZIBE-UHFFFAOYSA-N	Clc1ccccc1CNCC2CCC(CNCc3ccccc3Cl)CC2	BroadT	BRD-K03642198	BRD-K03642198-300-01-7	Tocris Bioscience	1639	1	Cl.Cl	Clc1ccccc1CNCC1CCC(CNCc2ccccc2Cl)CC1.Cl.Cl	InChI=1S/C22H28Cl2N2.2ClH/c23-21-7-3-1-5-19(21)15-25-13-17-9-11-18(12-10-17)14-26-16-20-6-2-4-8-22(20)24;;/h1-8,17-18,25-26H,9-16H2;2*1H	NRVIEWRSGDDWHP-UHFFFAOYSA-N	390.162954336							92062
Prostoglandin A1	LSM-42846	Prostaglandin A1	5281912	InChI=1S/C20H32O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h12-18,21H,2-11H2,1H3,(H,23,24)/b14-12+/t16-,17-,18+/m0/s1	BGKHCLZFGPIKKU-LDDQNKHRSA-N	CCCCC[C@H](O)\C=C\[C@H]1C=CC(=O)[C@@H]1CCCCCCC(=O)O	BroadT	BRD-K04010869	BRD-K04010869-001-02-6	Biomol International Inc.	PG001	2840(V2)-3-N1305		CCCCC[C@H](O)\C=C\[C@H]1C=CC(=O)[C@@H]1CCCCCCC(O)=O	InChI=1S/C20H32O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h12-18,21H,2-11H2,1H3,(H,23,24)/b14-12+/t16-,17-,18+/m0/s1	BGKHCLZFGPIKKU-LDDQNKHRSA-N	336.230059504							15545
PNU-22394	LSM-2360	PNU-22394, BRD-K16551401	27559	InChI=1S/C13H16N2/c1-15-12-5-3-2-4-10(12)11-6-8-14-9-7-13(11)15/h2-5,14H,6-9H2,1H3	ZBXDOQWPGBISAR-UHFFFAOYSA-N	Cn1c2CCNCCc2c3ccccc13	BroadT	BRD-K16551401	BRD-K16551401-003-01-8	Biomol International Inc.	AC-1365	2813-N1283	Cl	Cn1c2CCNCCc2c2ccccc12.Cl	InChI=1S/C13H16N2.ClH/c1-15-12-5-3-2-4-10(12)11-6-8-14-9-7-13(11)15;/h2-5,14H,6-9H2,1H3;1H	SAIGGEUWSYESTR-UHFFFAOYSA-N	200.131348532							92297, 92297
Oxymetazoline	LSM-2353	Oxymetazoline, Ocuclear, Oxymeta Zoline	4636	InChI=1S/C16H24N2O/c1-10-8-13(16(3,4)5)15(19)11(2)12(10)9-14-17-6-7-18-14/h8,19H,6-7,9H2,1-5H3,(H,17,18)	WYWIFABBXFUGLM-UHFFFAOYSA-N	Cc1cc(c(O)c(C)c1CC2=NCCN2)C(C)(C)C	BroadT	BRD-K16195444	BRD-K16195444-001-01-7	Biomol International Inc.	AC-847	2813-N1283		Cc1cc(c(O)c(C)c1CC1=NCCN1)C(C)(C)C	InChI=1S/C16H24N2O/c1-10-8-13(16(3,4)5)15(19)11(2)12(10)9-14-17-6-7-18-14/h8,19H,6-7,9H2,1-5H3,(H,17,18)	WYWIFABBXFUGLM-UHFFFAOYSA-N	260.188863408							7862, 7862
M3M3FBS	LSM-2196	M-3M3-FBS, SID11114239	761523	InChI=1S/C16H16F3NO2S/c1-10-7-11(2)15(12(3)8-10)23(21,22)20-14-6-4-5-13(9-14)16(17,18)19/h4-9,20H,1-3H3	ZIIUUSVHCHPIQD-UHFFFAOYSA-N	Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc2cccc(c2)C(F)(F)F	BroadT	BRD-K09635314	BRD-K09635314-001-01-8	Tocris Bioscience	1941	1		Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc1cccc(c1)C(F)(F)F	InChI=1S/C16H16F3NO2S/c1-10-7-11(2)15(12(3)8-10)23(21,22)20-14-6-4-5-13(9-14)16(17,18)19/h4-9,20H,1-3H3	ZIIUUSVHCHPIQD-UHFFFAOYSA-N	343.085384052							92167
Glipizide	LSM-2251	Glipizide, Glucotrol, K-4024, CP-28720, Glucotrol XL	3478	InChI=1S/C21H27N5O4S/c1-15-13-24-19(14-23-15)20(27)22-12-11-16-7-9-18(10-8-16)31(29,30)26-21(28)25-17-5-3-2-4-6-17/h7-10,13-14,17H,2-6,11-12H2,1H3,(H,22,27)(H2,25,26,28)	ZJJXGWJIGJFDTL-UHFFFAOYSA-N	Cc1cnc(cn1)C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)NC3CCCCC3	BroadT	BRD-K12219985	BRD-K12219985-001-04-8	Biomol International Inc.	AC-120	2840(V2)-3-N1305		Cc1cnc(cn1)C(=O)NCCc1ccc(cc1)S(=O)(=O)NC(=O)NC1CCCCC1	InChI=1S/C21H27N5O4S/c1-15-13-24-19(14-23-15)20(27)22-12-11-16-7-9-18(10-8-16)31(29,30)26-21(28)25-17-5-3-2-4-6-17/h7-10,13-14,17H,2-6,11-12H2,1H3,(H,22,27)(H2,25,26,28)	ZJJXGWJIGJFDTL-UHFFFAOYSA-N	445.178375084							5384
5-Nitroso-8-cinnolinol	LSM-2275	SID26658252, SID26755523, SID50110900, SID70278	19103	InChI=1S/C9H6N2O2/c12-8-4-3-7(11-13)6-2-1-5-10-9(6)8/h1-5,12H	RZWRYPGAUIOOMK-UHFFFAOYSA-N	Oc1ccc(N=O)c2cccnc12	BroadT	BRD-K13169950	BRD-K13169950-001-04-5	Tocris Bioscience	2521	1		Oc1ccc([N+][O-])c2cccnc12	InChI=1S/C9H6N2O2/c12-8-4-3-7(11-13)6-2-1-5-10-9(6)8/h1-5,12H	RZWRYPGAUIOOMK-UHFFFAOYSA-N	174.042927452							
CHEMBL416418	LSM-6211	Pdmp, SID26754972, SID26754973, DL-Pdmp	6610216	InChI=1S/C23H38N2O3/c1-2-3-4-5-6-7-11-14-22(26)24-21(19-25-15-17-28-18-16-25)23(27)20-12-9-8-10-13-20/h8-10,12-13,21,23,27H,2-7,11,14-19H2,1H3,(H,24,26)/t21-,23-/m1/s1	UYNCFCUHRNOSCN-FYYLOGMGSA-N	CCCCCCCCCC(=O)N[C@H](CN1CCOCC1)[C@H](O)c2ccccc2	BroadT	BRD-K05653692	BRD-K05653692-001-02-5	Biomol International Inc.	SL-210	2840(V2)-3-N1305		CCCCCCCCCC(=O)N[C@H](CN1CCOCC1)[C@H](O)c1ccccc1	InChI=1S/C23H38N2O3/c1-2-3-4-5-6-7-11-14-22(26)24-21(19-25-15-17-28-18-16-25)23(27)20-12-9-8-10-13-20/h8-10,12-13,21,23,27H,2-7,11,14-19H2,1H3,(H,24,26)/t21-,23-/m1/s1	UYNCFCUHRNOSCN-FYYLOGMGSA-N	390.288243096							94987, 94987
3,4-Didesmethyl-5-deshydroxy-3'-ethoxyscleroin	LSM-19986	SID26749554	4000243	InChI=1S/C15H14O5/c1-2-20-10-5-3-4-9(8-10)13(17)11-6-7-12(16)15(19)14(11)18/h3-8,16,18-19H,2H2,1H3	GIPLQLQEWXCSIX-UHFFFAOYSA-N	CCOc1cccc(c1)C(=O)c2ccc(O)c(O)c2O	BroadT	BRD-K00313803	BRD-K00313803-001-02-7	MicroSource Discovery Systems Inc.	240429			CCOc1cccc(c1)C(=O)c1ccc(O)c(O)c1O	InChI=1S/C15H14O5/c1-2-20-10-5-3-4-9(8-10)13(17)11-6-7-12(16)15(19)14(11)18/h3-8,16,18-19H,2H2,1H3	GIPLQLQEWXCSIX-UHFFFAOYSA-N	274.084123548							108601
Tyrphostin AG 1288	LSM-5257	Tyrphostin-Ag-1288, AG-1288, Tyrphostin Ag-1288	3856780	InChI=1S/C10H5N3O4/c11-4-7(5-12)1-6-2-8(13(16)17)10(15)9(14)3-6/h1-3,14-15H	KUXOYSZHUFZKHN-UHFFFAOYSA-N	Oc1cc(C=C(C#N)C#N)cc(c1O)[N+](=O)[O-]	BroadT	BRD-K08115555	BRD-K08115555-001-02-8	EMD Biosciences	658510			Oc1cc(C=C(C#N)C#N)cc(c1O)[N+]([O-])=O	InChI=1S/C10H5N3O4/c11-4-7(5-12)1-6-2-8(13(16)17)10(15)9(14)3-6/h1-3,14-15H	KUXOYSZHUFZKHN-UHFFFAOYSA-N	231.02800567							94492
PRESTWICK3_000892	LSM-1968	Esculin	15558439	InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2/t10-,12-,13+,14-,15?/m1/s1	XHCADAYNFIFUHF-GSZWNOCJSA-N	OC[C@H]1OC(Oc2cc3C=CC(=O)Oc3cc2O)[C@H](O)[C@@H](O)[C@@H]1O	BroadT	BRD-A99411506	BRD-A99411506-002-01-3	Prestwick Chemical Inc.	Prestw-892	D0701-MP04-ST03-200-	O	OC[C@H]1OC(Oc2cc3ccc(=O)oc3cc2O)[C@H](O)[C@@H](O)[C@@H]1O.O	InChI=1S/C15H16O9.H2O/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17;/h1-4,10,12-17,19-21H,5H2;1H2/t10-,12-,13+,14-,15?;/m1./s1	CQYPGSKIFJFVDQ-NTDFXFJYSA-N	340.079432092							91998, 91998
Finasteride	LSM-1999	Finasteride, Propecia, Proscar, MK-906	57363	InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1	DBEPLOCGEIEOCV-WSBQPABSSA-N	CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C	BroadT	BRD-K01095011	BRD-K01095011-001-03-5	Prestwick Chemical Inc.	Prestw-717	D0701-MP04-ST03-200-		CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C	InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1	DBEPLOCGEIEOCV-WSBQPABSSA-N	372.277678412							5062
Clioquinol	LSM-2186	Clioquinol, Iodochlorhydroxyquin, Vioform, Domeform-HC, Quin-O-Creme	2788	InChI=1S/C9H5ClINO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H	QCDFBFJGMNKBDO-UHFFFAOYSA-N	Oc1c(I)cc(Cl)c2cccnc12	BroadT	BRD-K09255212	BRD-K09255212-001-03-4	MicroSource Discovery Systems Inc.	1505114			Oc1c(I)cc(Cl)c2cccnc12	InChI=1S/C9H5ClINO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H	QCDFBFJGMNKBDO-UHFFFAOYSA-N	304.9104345							74460
60559-98-0	LSM-1975	BRD-K56478238, BRD-K00206590	43345	InChI=1S/C12H17N5/c1-4-12(2,3)17-11(15-9-13)16-10-6-5-7-14-8-10/h5-8H,4H2,1-3H3,(H2,15,16,17)	HKZNADVVGXKQDL-UHFFFAOYSA-N	CCC(C)(C)N=C(NC#N)Nc1cccnc1	BroadT	BRD-K00206590	BRD-K00206590-001-01-2	Tocris Bioscience	1355	1		CCC(C)(C)N=C(NC#N)Nc1cccnc1	InChI=1S/C12H17N5/c1-4-12(2,3)17-11(15-9-13)16-10-6-5-7-14-8-10/h5-8H,4H2,1-3H3,(H2,15,16,17)	HKZNADVVGXKQDL-UHFFFAOYSA-N	231.148395594							92004
RS-23597-190	LSM-6204	RS-23597-190	182593	InChI=1S/C16H23ClN2O3/c1-21-15-11-14(18)13(17)10-12(15)16(20)22-9-5-8-19-6-3-2-4-7-19/h10-11H,2-9,18H2,1H3	RLSGBCUXLRMTPF-UHFFFAOYSA-N	COc1cc(N)c(Cl)cc1C(=O)OCCCN2CCCCC2	BroadT	BRD-K01868942	BRD-K01868942-001-01-3	Biomol International Inc.	AC-569	2813-N1283		COc1cc(N)c(Cl)cc1C(=O)OCCCN1CCCCC1	InChI=1S/C16H23ClN2O3/c1-21-15-11-14(18)13(17)10-12(15)16(20)22-9-5-8-19-6-3-2-4-7-19/h10-11H,2-9,18H2,1H3	RLSGBCUXLRMTPF-UHFFFAOYSA-N	326.139720326							94981, 94981
Boldine	LSM-2047	Boldine, (+)-Boldine, (S)-(+)-Boldine	10154	InChI=1S/C19H21NO4/c1-20-5-4-10-7-15(22)19(24-3)18-12-9-16(23-2)14(21)8-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3/t13-/m0/s1	LZJRNLRASBVRRX-ZDUSSCGKSA-N	COc1cc2c(C[C@@H]3N(C)CCc4cc(O)c(OC)c2c34)cc1O	BroadT	BRD-K03440695	BRD-K03440695-001-02-6	Prestwick Chemical Inc.	Prestw-600	D0701-MP04-ST03-200-		COc1cc-2c(C[C@@H]3N(C)CCc4cc(O)c(OC)c-2c34)cc1O	InChI=1S/C19H21NO4/c1-20-5-4-10-7-15(22)19(24-3)18-12-9-16(23-2)14(21)8-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3/t13-/m0/s1	LZJRNLRASBVRRX-ZDUSSCGKSA-N	327.147058162							3148, 3148
396129-53-6	LSM-2120	4-(3-(Pyridin-2-yl)-(1H)-Pyrazol-4-ylquinoline, HTS-466284, LY-364947	447966	InChI=1S/C17H12N4/c1-2-6-15-13(5-1)12(8-10-19-15)14-11-20-21-17(14)16-7-3-4-9-18-16/h1-11H,(H,20,21)	IBCXZJCWDGCXQT-UHFFFAOYSA-N	c1ccc(nc1)c2n[nH]cc2c3ccnc4ccccc34	BroadT	BRD-K06234293	BRD-K06234293-001-01-8	Tocris Bioscience	2718	1		c1[nH]nc(c1-c1ccnc2ccccc12)-c1ccccn1	InChI=1S/C17H12N4/c1-2-6-15-13(5-1)12(8-10-19-15)14-11-20-21-17(14)16-7-3-4-9-18-16/h1-11H,(H,20,21)	IBCXZJCWDGCXQT-UHFFFAOYSA-N	272.106196424							92118, 91198
4-Nonylphenol	LSM-19987	4-Nonylphenol, 4-Nonyl-Phenol, Nonylphenol	1752	InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-9-14-10-12-15(16)13-11-14/h10-13,16H,2-9H2,1H3	IGFHQQFPSIBGKE-UHFFFAOYSA-N	CCCCCCCCCc1ccc(O)cc1	BroadT	BRD-K13959223	BRD-K13959223-001-02-4	MicroSource Discovery Systems Inc.	330085			CCCCCCCCCc1ccc(O)cc1	InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-9-14-10-12-15(16)13-11-14/h10-13,16H,2-9H2,1H3	IGFHQQFPSIBGKE-UHFFFAOYSA-N	220.182715388							34440
Roquinimex	LSM-2046	Linomide, Roquinimex, BRD-K03384561, FCF-89, LS-2616	54676478	InChI=1S/C18H16N2O3/c1-19(12-8-4-3-5-9-12)17(22)15-16(21)13-10-6-7-11-14(13)20(2)18(15)23/h3-11,21H,1-2H3	SGOOQMRIPALTEL-UHFFFAOYSA-N	CN(C(=O)C1=C(O)c2ccccc2N(C)C1=O)c3ccccc3	BroadT	BRD-K03384561	BRD-K03384561-001-01-9	Tocris Bioscience	1461	1		CN(C(=O)c1c(O)c2ccccc2n(C)c1=O)c1ccccc1	InChI=1S/C18H16N2O3/c1-19(12-8-4-3-5-9-12)17(22)15-16(21)13-10-6-7-11-14(13)20(2)18(15)23/h3-11,21H,1-2H3	SGOOQMRIPALTEL-UHFFFAOYSA-N	308.116092392							92056
R-N-Propylnorapomorphine	LSM-2281	R(-)-Propylnorapomorphine	167715	InChI=1S/C19H21NO2/c1-2-9-20-10-8-12-4-3-5-14-17(12)15(20)11-13-6-7-16(21)19(22)18(13)14/h3-7,15,21-22H,2,8-11H2,1H3/t15-/m1/s1	BTGAJCKRXPNBFI-OAHLLOKOSA-N	CCCN1CCc2cccc3c2[C@H]1Cc4ccc(O)c(O)c34	BroadT	BRD-K13544237	BRD-K13544237-001-01-0	Biomol International Inc.	AC-838	2812-3-N1298		CCCN1CCc2cccc-3c2[C@H]1Cc1ccc(O)c(O)c-31	InChI=1S/C19H21NO2/c1-2-9-20-10-8-12-4-3-5-14-17(12)15(20)11-13-6-7-16(21)19(22)18(13)14/h3-7,15,21-22H,2,8-11H2,1H3/t15-/m1/s1	BTGAJCKRXPNBFI-OAHLLOKOSA-N	295.157228922							92234, 92234
Papp	LSM-2302	SID124881356, SID26753653, SID11111756	121930	InChI=1S/C19H22F3N3/c20-19(21,22)16-2-1-3-18(14-16)25-12-10-24(11-13-25)9-8-15-4-6-17(23)7-5-15/h1-7,14H,8-13,23H2	GAAKALASJNGQKD-UHFFFAOYSA-N	Nc1ccc(CCN2CCN(CC2)c3cccc(c3)C(F)(F)F)cc1	BroadT	BRD-K14282469	BRD-K14282469-001-01-5	Biomol International Inc.	AC-846	2813-N1283		Nc1ccc(CCN2CCN(CC2)c2cccc(c2)C(F)(F)F)cc1	InChI=1S/C19H22F3N3/c20-19(21,22)16-2-1-3-18(14-16)25-12-10-24(11-13-25)9-8-15-4-6-17(23)7-5-15/h1-7,14H,8-13,23H2	GAAKALASJNGQKD-UHFFFAOYSA-N	349.176582334							92250, 92250
2,4-Dichlorophenoxyacetic acid	LSM-19988	2,4-Dichlorophenoxyacetic Acid, 2,4-Dichlorophenoxy-Acetic Acid, 2,4-Dichlorophenyloxyacetic Acid, 2-(2,4-Dichlorophenoxy)Acetic Acid, (2,4-Dichlorophenoxy)Acetic Acid	1486	InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)	OVSKIKFHRZPJSS-UHFFFAOYSA-N	OC(=O)COc1ccc(Cl)cc1Cl	BroadT	BRD-K01473791	BRD-K01473791-001-02-2	MicroSource Discovery Systems Inc.	330040			OC(=O)COc1ccc(Cl)cc1Cl	InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)	OVSKIKFHRZPJSS-UHFFFAOYSA-N	219.969399472							28854, 28854, 28854
Cefdinir	LSM-5216	SID49679095	6398970	InChI=1S/C14H13N5O5S2/c1-2-5-3-25-12-8(11(21)19(12)9(5)13(22)23)17-10(20)7(18-24)6-4-26-14(15)16-6/h2,4,8,12,24H,1,3H2,(H2,15,16)(H,17,20)(H,22,23)/t8-,12-/m1/s1	RTXOFQZKPXMALH-PRHODGIISA-N	Nc1nc(cs1)C(=NO)C(=O)N[C@H]2[C@H]3SCC(=C(N3C2=O)C(=O)O)C=C	BroadT	BRD-K15766189	BRD-K15766189-001-02-3	MicroSource Discovery Systems Inc.	1505208			Nc1nc(cs1)C(=N\O)\C(=O)N[C@H]1[C@H]2SCC(C=C)=C(N2C1=O)C(O)=O	InChI=1S/C14H13N5O5S2/c1-2-5-3-25-12-8(11(21)19(12)9(5)13(22)23)17-10(20)7(18-24)6-4-26-14(15)16-6/h2,4,8,12,24H,1,3H2,(H2,15,16)(H,17,20)(H,22,23)/b18-7-/t8-,12-/m1/s1	RTXOFQZKPXMALH-GHXIOONMSA-N	395.035809946							94470
Pimozide	LSM-2001	Pimozide, Orap, R-6238, MCN-JR-6238	16362	InChI=1S/C28H29F2N3O/c29-22-11-7-20(8-12-22)25(21-9-13-23(30)14-10-21)4-3-17-32-18-15-24(16-19-32)33-27-6-2-1-5-26(27)31-28(33)34/h1-2,5-14,24-25H,3-4,15-19H2,(H,31,34)	YVUQSNJEYSNKRX-UHFFFAOYSA-N	Fc1ccc(cc1)C(CCCN2CCC(CC2)N3C(=O)Nc4ccccc34)c5ccc(F)cc5	BroadT	BRD-K01292756	BRD-K01292756-001-06-0	Biomol International Inc.	AC-109	2840(V2)-3-N1305		Fc1ccc(cc1)C(CCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1ccc(F)cc1	InChI=1S/C28H29F2N3O/c29-22-11-7-20(8-12-22)25(21-9-13-23(30)14-10-21)4-3-17-32-18-15-24(16-19-32)33-27-6-2-1-5-26(27)31-28(33)34/h1-2,5-14,24-25H,3-4,15-19H2,(H,31,34)	YVUQSNJEYSNKRX-UHFFFAOYSA-N	461.227868978							8212
Cdc	LSM-42873	SID26756877	9905190	InChI=1S/C19H15NO4/c20-13-16(11-15-8-9-17(21)18(22)12-15)19(23)24-10-4-7-14-5-2-1-3-6-14/h1-9,11-12,21-22H,10H2/b7-4+,16-11-	XGHYFEJMJXGPGN-CHLGNXTCSA-N	Oc1ccc(\C=C(\C#N)/C(=O)OC\C=C\c2ccccc2)cc1O	BroadT	BRD-K10870738	BRD-K10870738-001-02-4	Biomol International Inc.	EI211	2840(V2)-3-N1305		Oc1ccc(\C=C(\C#N)C(=O)OC\C=C\c2ccccc2)cc1O	InChI=1S/C19H15NO4/c20-13-16(11-15-8-9-17(21)18(22)12-15)19(23)24-10-4-7-14-5-2-1-3-6-14/h1-9,11-12,21-22H,10H2/b7-4+,16-11-	XGHYFEJMJXGPGN-CHLGNXTCSA-N	321.10010797							
Dubinidine	LSM-1971	Dubinidine	442897	InChI=1S/C15H17NO4/c1-15(18,8-17)12-7-10-13(19-2)9-5-3-4-6-11(9)16-14(10)20-12/h3-6,12,17-18H,7-8H2,1-2H3	NETGEQWGGLFVRL-UHFFFAOYSA-N	COc1c2CC(Oc2nc3ccccc13)C(C)(O)CO	BroadT	BRD-A99571536	BRD-A99571536-001-01-0	TimTec LLC	ST005175			COc1c2CC(Oc2nc2ccccc12)C(C)(O)CO	InChI=1S/C15H17NO4/c1-15(18,8-17)12-7-10-13(19-2)9-5-3-4-6-11(9)16-14(10)20-12/h3-6,12,17-18H,7-8H2,1-2H3	NETGEQWGGLFVRL-UHFFFAOYSA-N	275.115758034							4722
Phenylbutazone	LSM-2219	Elmedal, Diphenylbutazone, Butazolidin, Butaject, Equiphar, Phenylbutazone, Azolid, Antadol, Phenyl Butazone, Pro-Bute	4781	InChI=1S/C19H20N2O2/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)21(19(17)23)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3	VYMDGNCVAMGZFE-UHFFFAOYSA-N	CCCCC1C(=O)N(N(C1=O)c2ccccc2)c3ccccc3	BroadT	BRD-K10843433	BRD-K10843433-001-02-9	MicroSource Discovery Systems Inc.	1500482			CCCCC1C(=O)N(N(C1=O)c1ccccc1)c1ccccc1	InChI=1S/C19H20N2O2/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)21(19(17)23)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3	VYMDGNCVAMGZFE-UHFFFAOYSA-N	308.1524779							48574, 48574
Pyrazolanthrone	LSM-1163	SP600125	8515	InChI=1S/C14H8N2O/c17-14-9-5-2-1-4-8(9)13-12-10(14)6-3-7-11(12)15-16-13/h1-7H,(H,15,16)	ACPOUJIDANTYHO-UHFFFAOYSA-N	O=C1c2ccccc2c3n[nH]c4cccc1c34	BroadT	BRD-K01567962	BRD-K01567962-001-06-5	Biomol International Inc.	EI305	2840(V2)-3-N1305		O=C1c2ccccc2-c2n[nH]c3cccc1c23	InChI=1S/C14H8N2O/c17-14-9-5-2-1-4-8(9)13-12-10(14)6-3-7-11(12)15-16-13/h1-7H,(H,15,16)	ACPOUJIDANTYHO-UHFFFAOYSA-N	220.063662896							90695
Harman	LSM-19989	Harmane, Harman	5281404	InChI=1S/C12H10N2/c1-8-12-10(6-7-13-8)9-4-2-3-5-11(9)14-12/h2-7,14H,1H3	PSFDQSOCUJVVGF-UHFFFAOYSA-N	Cc1nccc2c3ccccc3[nH]c12	BroadT	BRD-K12630395	BRD-K12630395-001-03-2	Tocris Bioscience	1132	3		Cc1nccc2c3ccccc3[nH]c12	InChI=1S/C12H10N2/c1-8-12-10(6-7-13-8)9-4-2-3-5-11(9)14-12/h2-7,14H,1H3	PSFDQSOCUJVVGF-UHFFFAOYSA-N	182.08439834							5623, 5623, 5623
Piperidolate	LSM-1951	Piperidolate	4839	InChI=1S/C21H25NO2/c1-2-22-15-9-14-19(16-22)24-21(23)20(17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19-20H,2,9,14-16H2,1H3	KTHVBAZBLKXIHZ-UHFFFAOYSA-N	CCN1CCCC(C1)OC(=O)C(c2ccccc2)c3ccccc3	BroadT	BRD-A97479839	BRD-A97479839-003-04-2	MicroSource Discovery Systems Inc.	1502197		Cl	CCN1CCCC(C1)OC(=O)C(c1ccccc1)c1ccccc1.Cl	InChI=1S/C21H25NO2.ClH/c1-2-22-15-9-14-19(16-22)24-21(23)20(17-10-5-3-6-11-17)18-12-7-4-8-13-18;/h3-8,10-13,19-20H,2,9,14-16H2,1H3;1H	RBGWCEWDAHDPEH-UHFFFAOYSA-N	323.18852905							91986, 91986
Adrenosterone	LSM-6557	Adrenoterone, Adrenosterone	223997	InChI=1S/C19H24O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h9,13-14,17H,3-8,10H2,1-2H3/t13-,14-,17+,18-,19-/m0/s1	RZRPTBIGEANTGU-IRIMSJTPSA-N	C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CCC2=O	BroadT	BRD-K17368287	BRD-K17368287-001-03-5	Prestwick Chemical Inc.	Prestw-899	D0701-MP04-ST03-200-		C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CCC2=O	InChI=1S/C19H24O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h9,13-14,17H,3-8,10H2,1-2H3/t13-,14-,17+,18-,19-/m0/s1	RZRPTBIGEANTGU-IRIMSJTPSA-N	300.172544628							2495
Hexylcaine	LSM-1954	Hexylcaine, Cyclaine	10770	InChI=1S/C16H23NO2/c1-13(12-17-15-10-6-3-7-11-15)19-16(18)14-8-4-2-5-9-14/h2,4-5,8-9,13,15,17H,3,6-7,10-12H2,1H3	DKLKMKYDWHYZTD-UHFFFAOYSA-N	CC(CNC1CCCCC1)OC(=O)c2ccccc2	BroadT	BRD-A97730597	BRD-A97730597-003-03-2	Prestwick Chemical Inc.	Prestw-788	D0701-MP04-ST03-200-	Cl	CC(CNC1CCCCC1)OC(=O)c1ccccc1.Cl	InChI=1S/C16H23NO2.ClH/c1-13(12-17-15-10-6-3-7-11-15)19-16(18)14-8-4-2-5-9-14;/h2,4-5,8-9,13,15,17H,3,6-7,10-12H2,1H3;1H	MTFCPNHRBINLRQ-UHFFFAOYSA-N	261.172878986							34791, 34791
L741,626	LSM-2088	L-741626	133633	InChI=1S/C20H21ClN2O/c21-17-7-5-16(6-8-17)20(24)9-11-23(12-10-20)14-15-13-22-19-4-2-1-3-18(15)19/h1-8,13,22,24H,9-12,14H2	LLBLNMUONVVVPG-UHFFFAOYSA-N	OC1(CCN(Cc2c[nH]c3ccccc23)CC1)c4ccc(Cl)cc4	BroadT	BRD-K05181463	BRD-K05181463-001-01-6	Biomol International Inc.	AC-251	2812-3-N1298		OC1(CCN(Cc2c[nH]c3ccccc23)CC1)c1ccc(Cl)cc1	InChI=1S/C20H21ClN2O/c21-17-7-5-16(6-8-17)20(24)9-11-23(12-10-20)14-15-13-22-19-4-2-1-3-18(15)19/h1-8,13,22,24H,9-12,14H2	LLBLNMUONVVVPG-UHFFFAOYSA-N	340.134241022							92090
Bisindolylmaleimide IX	LSM-2125	RO-318220, RO 31-8220, Bisindolylmaleimide-IX	5083	InChI=1S/C25H23N5O2S/c1-29-13-17(15-7-2-4-9-19(15)29)21-22(24(32)28-23(21)31)18-14-30(11-6-12-33-25(26)27)20-10-5-3-8-16(18)20/h2-5,7-10,13-14H,6,11-12H2,1H3,(H3,26,27)(H,28,31,32)	DSXXEELGXBCYNQ-UHFFFAOYSA-N	Cn1cc(C2=C(C(=O)NC2=O)c3cn(CCCSC(=N)N)c4ccccc34)c5ccccc15	BroadT	BRD-K06543683	BRD-K06543683-001-03-6	Biomol International Inc.	EI-283	2832A(V2.2)-3-N1290		Cn1cc(C2=C(C(=O)NC2=O)c2cn(CCCSC(N)=N)c3ccccc23)c2ccccc12	InChI=1S/C25H23N5O2S/c1-29-13-17(15-7-2-4-9-19(15)29)21-22(24(32)28-23(21)31)18-14-30(11-6-12-33-25(26)27)20-10-5-3-8-16(18)20/h2-5,7-10,13-14H,6,11-12H2,1H3,(H3,26,27)(H,28,31,32)	DSXXEELGXBCYNQ-UHFFFAOYSA-N	457.157245716							38912, 38912
Thiotepa	LSM-2194	Thioplex, Thiotepa, Thio-Tepa	5453	InChI=1S/C6H12N3PS/c11-10(7-1-2-7,8-3-4-8)9-5-6-9/h1-6H2	FOCVUCIESVLUNU-UHFFFAOYSA-N	S=P(N1CC1)(N2CC2)N3CC3	BroadT	BRD-K09631521	BRD-K09631521-001-02-4	MicroSource Discovery Systems Inc.	1503324			S=P(N1CC1)(N1CC1)N1CC1	InChI=1S/C6H12N3PS/c11-10(7-1-2-7,8-3-4-8)9-5-6-9/h1-6H2	FOCVUCIESVLUNU-UHFFFAOYSA-N	189.048954614							9570
Estriol	LSM-2368	Theelol, Oestriol, Estriol, Estriol Succinate, Estriol Propionate, Estriol Acetate Benzoate	5756	InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,17+,18+/m1/s1	PROQIPRRNZUXQM-ZXXIGWHRSA-N	C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1C[C@@H](O)[C@@H]2O	BroadT	BRD-K17016787	BRD-K17016787-001-03-5	Prestwick Chemical Inc.	Prestw-1096	D0701-MP04-ST03-200-		C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1C[C@@H](O)[C@@H]2O	InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,17+,18+/m1/s1	PROQIPRRNZUXQM-ZXXIGWHRSA-N	288.172544628							27974
Veratric acid	LSM-19990	3,4-Dimethoxybenzoic Acid, 3,4-Dimethoxy-Benzoic Acid, Veratric Acid	7121	InChI=1S/C9H10O4/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H,10,11)	DAUAQNGYDSHRET-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)O	BroadT	BRD-K14520048	BRD-K14520048-001-02-6	MicroSource Discovery Systems Inc.	212140			COc1ccc(cc1OC)C(O)=O	InChI=1S/C9H10O4/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H,10,11)	DAUAQNGYDSHRET-UHFFFAOYSA-N	182.0579088							296881
Cyclosporine	LSM-42883	27-400, Ciclosporin, Cyclosporine, Gengraf, Neoral, Restasis, Sandimmune, Cyclosporin A	5284373	InChI=1S/C62H111N11O12/c1-25-27-28-40(15)52(75)51-56(79)65-43(26-2)58(81)67(18)33-48(74)68(19)44(29-34(3)4)55(78)66-49(38(11)12)61(84)69(20)45(30-35(5)6)54(77)63-41(16)53(76)64-42(17)57(80)70(21)46(31-36(7)8)59(82)71(22)47(32-37(9)10)60(83)72(23)50(39(13)14)62(85)73(51)24/h25,27,34-47,49-52,75H,26,28-33H2,1-24H3,(H,63,77)(H,64,76)(H,65,79)(H,66,78)/b27-25+/t40-,41+,42-,43+,44+,45+,46+,47+,49+,50+,51+,52-/m1/s1	PMATZTZNYRCHOR-CGLBZJNRSA-N	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C	BroadT	BRD-K13533483	BRD-K13533483-001-03-0	Prestwick Chemical Inc.	Prestw-435	D0701-MP04-ST03-200-		CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C	InChI=1S/C62H111N11O12/c1-25-27-28-40(15)52(75)51-56(79)65-43(26-2)58(81)67(18)33-48(74)68(19)44(29-34(3)4)55(78)66-49(38(11)12)61(84)69(20)45(30-35(5)6)54(77)63-41(16)53(76)64-42(17)57(80)70(21)46(31-36(7)8)59(82)71(22)47(32-37(9)10)60(83)72(23)50(39(13)14)62(85)73(51)24/h25,27,34-47,49-52,75H,26,28-33H2,1-24H3,(H,63,77)(H,64,76)(H,65,79)(H,66,78)/b27-25+/t40-,41+,42-,43+,44+,45+,46+,47+,49+,50+,51+,52-/m1/s1	PMATZTZNYRCHOR-CGLBZJNRSA-N	1201.841368102							4031
Neocuproine	LSM-19991	DNDI1343110, GNF-PF-5611	65237	InChI=1S/C14H12N2/c1-9-3-5-11-7-8-12-6-4-10(2)16-14(12)13(11)15-9/h3-8H,1-2H3	IYRGXJIJGHOCFS-UHFFFAOYSA-N	Cc1ccc2ccc3ccc(C)nc3c2n1	BroadT	BRD-K16598630	BRD-K16598630-001-05-7	Life Chemicals Inc.	F0278-0005			Cc1ccc2ccc3ccc(C)nc3c2n1	InChI=1S/C14H12N2/c1-9-3-5-11-7-8-12-6-4-10(2)16-14(12)13(11)15-9/h3-8H,1-2H3	IYRGXJIJGHOCFS-UHFFFAOYSA-N	208.100048404							91222
Sulfathiazole	LSM-5327	Sulphathiazole, Sulfathiazole, Sulfathiazole (Triple Sulfa)	5340	InChI=1S/C9H9N3O2S2/c10-7-1-3-8(4-2-7)16(13,14)12-9-11-5-6-15-9/h1-6H,10H2,(H,11,12)	JNMRHUJNCSQMMB-UHFFFAOYSA-N	Nc1ccc(cc1)S(=O)(=O)Nc2nccs2	BroadT	BRD-K14705039	BRD-K14705039-001-04-0	MicroSource Discovery Systems Inc.	1500553			Nc1ccc(cc1)S(=O)(=O)Nc1nccs1	InChI=1S/C9H9N3O2S2/c10-7-1-3-8(4-2-7)16(13,14)12-9-11-5-6-15-9/h1-6H,10H2,(H,11,12)	JNMRHUJNCSQMMB-UHFFFAOYSA-N	255.013617938							9337, 9337
UNII-5308DT8060	LSM-2244	BRD-K11927976, SID26755042, SID29216381	9799509	InChI=1S/C18H20N2O/c1-12-8-9-15-17(13(12)2)20(11-5-10-19)16-7-4-3-6-14(16)18(15)21/h3-4,6-9H,5,10-11,19H2,1-2H3	CFPDEQBPNROZDC-UHFFFAOYSA-N	Cc1ccc2C(=O)c3ccccc3N(CCCN)c2c1C	BroadT	BRD-K11927976	BRD-K11927976-050-01-1	Tocris Bioscience	2471	1	OC(=O)/C=C\C(=O)O	Cc1ccc2c(c1C)n(CCCN)c1ccccc1c2=O.OC(=O)/C=C\C(=O)O	InChI=1S/C18H20N2O.C4H4O4/c1-12-8-9-15-17(13(12)2)20(11-5-10-19)16-7-4-3-6-14(16)18(15)21;5-3(6)1-2-4(7)8/h3-4,6-9H,5,10-11,19H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-	WVUQPGFRFBVJKH-BTJKTKAUSA-N	280.15756328							92203, 92203
Sulfamethoxypyridazine	LSM-5204	Sulphamethoxypyridazine, Sulfamethoxypyridazine, Midicel	5330	InChI=1S/C11H12N4O3S/c1-18-11-7-6-10(13-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h2-7H,12H2,1H3,(H,13,15)	VLYWMPOKSSWJAL-UHFFFAOYSA-N	COc1ccc(NS(=O)(=O)c2ccc(N)cc2)nn1	BroadT	BRD-K00938507	BRD-K00938507-001-04-6	MicroSource Discovery Systems Inc.	1501156			COc1ccc(NS(=O)(=O)c2ccc(N)cc2)nn1	InChI=1S/C11H12N4O3S/c1-18-11-7-6-10(13-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h2-7H,12H2,1H3,(H,13,15)	VLYWMPOKSSWJAL-UHFFFAOYSA-N	280.063010974							102516
7-Hydroxy-3-(2-methoxyphenyl)-4H-chromen-4-one	LSM-19992	BRD-K09203354, SID26749839	5397276	InChI=1S/C16H12O4/c1-19-14-5-3-2-4-11(14)13-9-20-15-8-10(17)6-7-12(15)16(13)18/h2-9,17H,1H3	AHLHZSCENKUUSF-UHFFFAOYSA-N	COc1ccccc1C2=COc3cc(O)ccc3C2=O	BroadT	BRD-K09203354	BRD-K09203354-001-02-4	MicroSource Discovery Systems Inc.	201309			COc1ccccc1-c1coc2cc(O)ccc2c1=O	InChI=1S/C16H12O4/c1-19-14-5-3-2-4-11(14)13-9-20-15-8-10(17)6-7-12(15)16(13)18/h2-9,17H,1H3	AHLHZSCENKUUSF-UHFFFAOYSA-N	268.073558864							108602
FGIN1-27	LSM-2201	FGIN-1-27, SID11111106, SID11113625, SID123060012	132496	InChI=1S/C28H37FN2O/c1-3-5-7-11-19-31(20-12-8-6-4-2)27(32)21-25-24-13-9-10-14-26(24)30-28(25)22-15-17-23(29)18-16-22/h9-10,13-18,30H,3-8,11-12,19-21H2,1-2H3	VUWXAQFLTSBUDB-UHFFFAOYSA-N	CCCCCCN(CCCCCC)C(=O)Cc1c([nH]c2ccccc12)c3ccc(F)cc3	BroadT	BRD-K09778810	BRD-K09778810-001-01-5	Biomol International Inc.	CM-121	2819-N1292		CCCCCCN(CCCCCC)C(=O)Cc1c([nH]c2ccccc12)-c1ccc(F)cc1	InChI=1S/C28H37FN2O/c1-3-5-7-11-19-31(20-12-8-6-4-2)27(32)21-25-24-13-9-10-14-26(24)30-28(25)22-15-17-23(29)18-16-22/h9-10,13-18,30H,3-8,11-12,19-21H2,1-2H3	VUWXAQFLTSBUDB-UHFFFAOYSA-N	436.288992024							92171
Secalciferol	LSM-43868	24,25-Dihydroxyvitamin D3, 24,25-Dihydroxycholecalciferol, Secalciferol, Osteo D	5283748	InChI=1S/C27H44O3/c1-18-8-12-22(28)17-21(18)11-10-20-7-6-16-27(5)23(13-14-24(20)27)19(2)9-15-25(29)26(3,4)30/h10-11,19,22-25,28-30H,1,6-9,12-17H2,2-5H3/b20-10+,21-11-/t19-,22+,23-,24+,25-,27-/m1/s1	FCKJYANJHNLEEP-XRWYNYHCSA-N	C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@@H](O)CCC3=C)\CCC[C@]12C	BroadT	BRD-K02965577	BRD-K02965577-001-02-6	Biomol International Inc.	DM300	2840(V2)-3-N1305		C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@@H]2[C@]1(C)CCC\C2=C/C=C1/C[C@@H](O)CCC1=C	InChI=1S/C27H44O3/c1-18-8-12-22(28)17-21(18)11-10-20-7-6-16-27(5)23(13-14-24(20)27)19(2)9-15-25(29)26(3,4)30/h10-11,19,22-25,28-30H,1,6-9,12-17H2,2-5H3/b20-10+,21-11-/t19-,22+,23-,24+,25-,27-/m1/s1	FCKJYANJHNLEEP-XRWYNYHCSA-N	416.329045268							28818
Hydrochlorothiazide	LSM-5308	Hctz, Esidrix, Hydrochlorothiazide, Zide, Hydrodiuril, Microzide, Oretic, Hydro-D, Hydrochloro Thiazide, Hydrochlorothiazide Intensol	3639	InChI=1S/C7H8ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-2,10-11H,3H2,(H2,9,12,13)	JZUFKLXOESDKRF-UHFFFAOYSA-N	NS(=O)(=O)c1cc2c(NCNS2(=O)=O)cc1Cl	BroadT	BRD-K13078532	BRD-K13078532-001-04-5	MicroSource Discovery Systems Inc.	1500335			NS(=O)(=O)c1cc2c(NCNS2(=O)=O)cc1Cl	InChI=1S/C7H8ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-2,10-11H,3H2,(H2,9,12,13)	JZUFKLXOESDKRF-UHFFFAOYSA-N	296.964474856							5778
Triprolidine	LSM-42877	Triprolidine, Triphed, Trilitron, Myidyl, Myfed, Histafed, Corphed, Allerfed, Actifed, Actidil, Actahist	5282443	InChI=1S/C19H22N2/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21/h2-3,6-12H,4-5,13-15H2,1H3/b18-11+	CBEQULMOCCWAQT-WOJGMQOQSA-N	Cc1ccc(cc1)\C(=C/CN2CCCC2)\c3ccccn3	BroadT	BRD-K11742128	BRD-K11742128-003-04-4	MicroSource Discovery Systems Inc.	1500598		Cl	Cc1ccc(cc1)C(=C/CN1CCCC1)\c1ccccn1.Cl	InChI=1S/C19H22N2.ClH/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21;/h2-3,6-12H,4-5,13-15H2,1H3;1H/b18-11+;	WYUYEJNGHIOFOC-NWBUNABESA-N	278.178298724							84116, 84116, 84116
Indigo Red	LSM-42899	Indirubin	5318433	InChI=1S/C16H10N2O2/c19-15-10-6-2-4-8-12(10)17-14(15)13-9-5-1-3-7-11(9)18-16(13)20/h1-8,17H,(H,18,20)/b14-13-	CRDNMYFJWFXOCH-YPKPFQOOSA-N	O=C1Nc2ccccc2/C/1=C\3/Nc4ccccc4C3=O	BroadT	BRD-K17894950	BRD-K17894950-001-04-4	Biomol International Inc.	CC-206	2840(V2)-3-N1305		O=C1Nc2ccccc2\C1=C1\Nc2ccccc2C1=O	InChI=1S/C16H10N2O2/c19-15-10-6-2-4-8-12(10)17-14(15)13-9-5-1-3-7-11(9)18-16(13)20/h1-8,17H,(H,18,20)/b14-13-	CRDNMYFJWFXOCH-YPKPFQOOSA-N	262.07422758							
Tremorine	LSM-2171	SID11112314	5534	InChI=1S/C12H20N2/c1-2-8-13(7-1)11-5-6-12-14-9-3-4-10-14/h1-4,7-12H2	JSUAJTLKVREZHV-UHFFFAOYSA-N	C(C#CCN1CCCC1)N2CCCC2	BroadT	BRD-K08619838	BRD-K08619838-300-03-2	Prestwick Chemical Inc.	Prestw-331	D0701-MP04-ST03-200-	Cl.Cl	C(C#CCN1CCCC1)N1CCCC1.Cl.Cl	InChI=1S/C12H20N2.2ClH/c1-2-8-13(7-1)11-5-6-12-14-9-3-4-10-14;;/h1-4,7-12H2;2*1H	ASHYBFCDTYPECZ-UHFFFAOYSA-N	192.16264866							92148, 92148
Valdecoxib	LSM-5305	Bextra, Valdecoxib, SC-65872	119607	InChI=1S/C16H14N2O3S/c1-11-15(12-7-9-14(10-8-12)22(17,19)20)16(18-21-11)13-5-3-2-4-6-13/h2-10H,1H3,(H2,17,19,20)	LNPDTQAFDNKSHK-UHFFFAOYSA-N	Cc1onc(c2ccccc2)c1c3ccc(cc3)S(=O)(=O)N	BroadT	BRD-K12994359	BRD-K12994359-001-02-8	MicroSource Discovery Systems Inc.	1504302			Cc1onc(c1-c1ccc(cc1)S(N)(=O)=O)-c1ccccc1	InChI=1S/C16H14N2O3S/c1-11-15(12-7-9-14(10-8-12)22(17,19)20)16(18-21-11)13-5-3-2-4-6-13/h2-10H,1H3,(H2,17,19,20)	LNPDTQAFDNKSHK-UHFFFAOYSA-N	314.072513018							63634
Bemegride	LSM-2325	Bemegride, Megimide, Methetharimide	2310	InChI=1S/C8H13NO2/c1-3-8(2)4-6(10)9-7(11)5-8/h3-5H2,1-2H3,(H,9,10,11)	ORRZGUBHBVWWOP-UHFFFAOYSA-N	CCC1(C)CC(=O)NC(=O)C1	BroadT	BRD-K14993104	BRD-K14993104-001-03-4	Prestwick Chemical Inc.	Prestw-882	D0701-MP04-ST03-200-		CCC1(C)CC(=O)NC(=O)C1	InChI=1S/C8H13NO2/c1-3-8(2)4-6(10)9-7(11)5-8/h3-5H2,1-2H3,(H,9,10,11)	ORRZGUBHBVWWOP-UHFFFAOYSA-N	155.094628666							92269
Apoptosis Inhibitor	LSM-19994	BRD-K00676343	2748618	InChI=1S/C13H16O4/c14-10-3-1-4-11(15)8(10)7-9-12(16)5-2-6-13(9)17/h8-9H,1-7H2	ILUMEPMGPCKGHH-UHFFFAOYSA-N	O=C1CCCC(=O)C1CC2C(=O)CCCC2=O	BroadT	BRD-K00676343	BRD-K00676343-001-01-6	Calbiochem	178488			O=C1CCCC(=O)C1CC1C(=O)CCCC1=O	InChI=1S/C13H16O4/c14-10-3-1-4-11(15)8(10)7-9-12(16)5-2-6-13(9)17/h8-9H,1-7H2	ILUMEPMGPCKGHH-UHFFFAOYSA-N	236.104858992							108604
Equilin	LSM-2063	Equilin	223368	InChI=1S/C18H20O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3-5,10,14,16,19H,2,6-9H2,1H3/t14-,16+,18+/m1/s1	WKRLQDKEXYKHJB-HFTRVMKXSA-N	C[C@]12CC[C@H]3C(=CCc4cc(O)ccc34)[C@@H]1CCC2=O	BroadT	BRD-K04046242	BRD-K04046242-001-03-6	Prestwick Chemical Inc.	Prestw-850	D0701-MP04-ST03-200-		C[C@]12CC[C@H]3C(=CCc4cc(O)ccc34)[C@@H]1CCC2=O	InChI=1S/C18H20O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3-5,10,14,16,19H,2,6-9H2,1H3/t14-,16+,18+/m1/s1	WKRLQDKEXYKHJB-HFTRVMKXSA-N	268.14632988							42309
Famotidine	LSM-5201		3325	InChI=1S/C8H15N7O2S3/c9-6(15-20(12,16)17)1-2-18-3-5-4-19-8(13-5)14-7(10)11/h4H,1-3H2,(H2,9,15)(H2,12,16,17)(H4,10,11,13,14)	XUFQPHANEAPEMJ-UHFFFAOYSA-N	NC(=Nc1nc(CSCC\C(=N/S(=O)(=O)N)\N)cs1)N	BroadT	BRD-K00673382	BRD-K00673382-001-04-9	MicroSource Discovery Systems Inc.	1501003			NC(N)=Nc1nc(CSCC\C(N)=N/S(N)(=O)=O)cs1	InChI=1S/C8H15N7O2S3/c9-6(15-20(12,16)17)1-2-18-3-5-4-19-8(13-5)14-7(10)11/h4H,1-3H2,(H2,9,15)(H2,12,16,17)(H4,10,11,13,14)	XUFQPHANEAPEMJ-UHFFFAOYSA-N	337.04493486							4975
Metacetamol	LSM-19995	Metacetamol, BS-749	12124	InChI=1S/C8H9NO2/c1-6(10)9-7-3-2-4-8(11)5-7/h2-5,11H,1H3,(H,9,10)	QLNWXBAGRTUKKI-UHFFFAOYSA-N	CC(=O)Nc1cccc(O)c1	BroadT	BRD-K16474819	BRD-K16474819-001-02-1	MicroSource Discovery Systems Inc.	211175			CC(=O)Nc1cccc(O)c1	InChI=1S/C8H9NO2/c1-6(10)9-7-3-2-4-8(11)5-7/h2-5,11H,1H3,(H,9,10)	QLNWXBAGRTUKKI-UHFFFAOYSA-N	151.063328538							76987
Seliciclib	LSM-1001	Roscovitine, Seliciclib, AL-39256, CYC-202, Roscovitine(Cyc202)	160355	InChI=1S/C19H26N6O/c1-4-15(11-26)22-19-23-17(20-10-14-8-6-5-7-9-14)16-18(24-19)25(12-21-16)13(2)3/h5-9,12-13,15,26H,4,10-11H2,1-3H3,(H2,20,22,23,24)/t15-/m1/s1	BTIHMVBBUGXLCJ-OAHLLOKOSA-N	CC[C@H](CO)Nc1nc(NCc2ccccc2)c3ncn(C(C)C)c3n1	BroadT	BRD-K07691486	BRD-K07691486-001-05-6	Biomol International Inc.	CC205	2840(V2)-3-N1305		CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1	InChI=1S/C19H26N6O/c1-4-15(11-26)22-19-23-17(20-10-14-8-6-5-7-9-14)16-18(24-19)25(12-21-16)13(2)3/h5-9,12-13,15,26H,4,10-11H2,1-3H3,(H2,20,22,23,24)/t15-/m1/s1	BTIHMVBBUGXLCJ-OAHLLOKOSA-N	354.216809512							45307
Diphenidol	LSM-2008	Diphenidol, Difenidol, Vontrol, SK&F-478, SK-478, Difenidol HCl	3055	InChI=1S/C21H27NO/c23-21(19-11-4-1-5-12-19,20-13-6-2-7-14-20)15-10-18-22-16-8-3-9-17-22/h1-2,4-7,11-14,23H,3,8-10,15-18H2	OGAKLTJNUQRZJU-UHFFFAOYSA-N	OC(CCCN1CCCCC1)(c2ccccc2)c3ccccc3	BroadT	BRD-K01663662	BRD-K01663662-003-03-8	Prestwick Chemical Inc.	Prestw-252	D0701-MP04-ST03-200-	Cl	OC(CCCN1CCCCC1)(c1ccccc1)c1ccccc1.Cl	InChI=1S/C21H27NO.ClH/c23-21(19-11-4-1-5-12-19,20-13-6-2-7-14-20)15-10-18-22-16-8-3-9-17-22;/h1-2,4-7,11-14,23H,3,8-10,15-18H2;1H	AVZIYZHXZAYGJS-UHFFFAOYSA-N	309.209264494							4638, 4638, 4638
Amoxapine	LSM-2021	Amoxapine, Asendin, CL-67772	2170	InChI=1S/C17H16ClN3O/c18-12-5-6-15-13(11-12)17(21-9-7-19-8-10-21)20-14-3-1-2-4-16(14)22-15/h1-6,11,19H,7-10H2	QWGDMFLQWFTERH-UHFFFAOYSA-N	Clc1ccc2Oc3ccccc3N=C(N4CCNCC4)c2c1	BroadT	BRD-K02265150	BRD-K02265150-001-04-2	MicroSource Discovery Systems Inc.	2300161			Clc1ccc2Oc3ccccc3N=C(N3CCNCC3)c2c1	InChI=1S/C17H16ClN3O/c18-12-5-6-15-13(11-12)17(21-9-7-19-8-10-21)20-14-3-1-2-4-16(14)22-15/h1-6,11,19H,7-10H2	QWGDMFLQWFTERH-UHFFFAOYSA-N	313.098189872							2675
GR-144053	LSM-2248	BRD-K12120659, GR-144053, GR-144053F	173614	InChI=1S/C18H27N5O2/c19-18(20)14-1-3-15(4-2-14)22-9-11-23(12-10-22)16-5-7-21(8-6-16)13-17(24)25/h1-4,16H,5-13H2,(H3,19,20)(H,24,25)	QGEGSJUSWLLZLH-UHFFFAOYSA-N	NC(=N)c1ccc(cc1)N2CCN(CC2)C3CCN(CC(=O)O)CC3	BroadT	BRD-K12120659	BRD-K12120659-305-01-4	Tocris Bioscience	1263	1	Cl.Cl.Cl	NC(=N)c1ccc(cc1)N1CCN(CC1)C1CCN(CC(O)=O)CC1.Cl.Cl.Cl	InChI=1S/C18H27N5O2.3ClH/c19-18(20)14-1-3-15(4-2-14)22-9-11-23(12-10-22)16-5-7-21(8-6-16)13-17(24)25;;;/h1-4,16H,5-13H2,(H3,19,20)(H,24,25);3*1H	YKRNPHOBDOUQTG-UHFFFAOYSA-N	345.216475154							92207, 92207
Fananserin	LSM-2183	Fananserin, BRD-K08998509, RP-62203	60785	InChI=1S/C23H24FN3O2S/c24-19-8-10-20(11-9-19)26-16-14-25(15-17-26)12-3-13-27-21-6-1-4-18-5-2-7-22(23(18)21)30(27,28)29/h1-2,4-11H,3,12-17H2	VGIGHGMPMUCLIQ-UHFFFAOYSA-N	Fc1ccc(cc1)N2CCN(CCCN3c4cccc5cccc(c45)S3(=O)=O)CC2	BroadT	BRD-K08998509	BRD-K08998509-001-01-6	Tocris Bioscience	2645	1		Fc1ccc(cc1)N1CCN(CCCN2c3cccc4cccc(c34)S2(=O)=O)CC1	InChI=1S/C23H24FN3O2S/c24-19-8-10-20(11-9-19)26-16-14-25(15-17-26)12-3-13-27-21-6-1-4-18-5-2-7-22(23(18)21)30(27,28)29/h1-2,4-11H,3,12-17H2	VGIGHGMPMUCLIQ-UHFFFAOYSA-N	425.157325928							92159
Clotrimazole	LSM-5341	Mycelex, Gynix, Canesten, Clotrimazole, Trivagizole 3, Mycelex-7 Combination Pack, Mycelex-7, Gyne-Lotrimin 3 Combination Pack, Gyne-Lotrimin 3, BAY-5097, GNF-PF-3499, Mycelex-G, Gyne-Lotrimin Combination Pack, Gyne-Lotrimin	2812	InChI=1S/C22H17ClN2/c23-21-14-8-7-13-20(21)22(25-16-15-24-17-25,18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-17H	VNFPBHJOKIVQEB-UHFFFAOYSA-N	Clc1ccccc1C(c2ccccc2)(c3ccccc3)n4ccnc4	BroadT	BRD-K15916496	BRD-K15916496-001-04-8	MicroSource Discovery Systems Inc.	1500200			Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1	InChI=1S/C22H17ClN2/c23-21-14-8-7-13-20(21)22(25-16-15-24-17-25,18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-17H	VNFPBHJOKIVQEB-UHFFFAOYSA-N	344.108026274							3764
Dehydro (11,12)ursolic acid lactone	LSM-19996	BRD-A98888138	6708656	InChI=1S/C30H46O3/c1-18-8-14-29-17-16-28(7)27(6)13-9-20-25(3,4)22(31)11-12-26(20,5)21(27)10-15-30(28,33-24(29)32)23(29)19(18)2/h10,15,18-23,31H,8-9,11-14,16-17H2,1-7H3/t18-,19+,20?,21?,22+,23?,26+,27-,28?,29+,30+/m1/s1	UVBLDLGZDSGCSN-QACHQXIWSA-N	C[C@@H]1CC[C@@]23CCC4(C)[C@]5(C)CCC6C(C)(C)[C@@H](O)CC[C@]6(C)C5C=C[C@]4(OC2=O)C3[C@H]1C	BroadT	BRD-A98888138	BRD-A98888138-001-02-9	MicroSource Discovery Systems Inc.	307043			C[C@@H]1CC[C@@]23CCC4(C)[C@](OC2=O)(C=CC2[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]42C)C3[C@H]1C	InChI=1S/C30H46O3/c1-18-8-14-29-17-16-28(7)27(6)13-9-20-25(3,4)22(31)11-12-26(20,5)21(27)10-15-30(28,33-24(29)32)23(29)19(18)2/h10,15,18-23,31H,8-9,11-14,16-17H2,1-7H3/t18-,19+,20?,21?,22+,23?,26+,27-,28?,29+,30+/m1/s1	UVBLDLGZDSGCSN-QACHQXIWSA-N	454.344695332							
Curcumin	LSM-43083	SID91276, SID56422380, SID855880	969516	InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3/b7-3+,8-4+	VFLDPWHFBUODDF-FCXRPNKRSA-N	COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O	BroadT	BRD-K07572174	BRD-K07572174-001-02-2	MicroSource Discovery Systems Inc.	1505345			COc1cc(ccc1O)\C=C\C(=O)CC(=O)\C=C\c1ccc(O)c(OC)c1	InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3/b7-3+,8-4+	VFLDPWHFBUODDF-FCXRPNKRSA-N	368.12598836							3962, 3962
Colchicine	LSM-5199	Colchicine, Colcrys	6167	InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)/t16-/m0/s1	IAKHMKGGTNLKSZ-INIZCTEOSA-N	COC1=CC=C2C(=CC1=O)[C@H](CCc3cc(OC)c(OC)c(OC)c23)NC(=O)C	BroadT	BRD-K00259736	BRD-K00259736-001-03-2	AnalytiCon Discovery GmbH	NP-010664			COc1cc2CC[C@H](NC(C)=O)c3cc(=O)c(OC)ccc3-c2c(OC)c1OC	InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)/t16-/m0/s1	IAKHMKGGTNLKSZ-INIZCTEOSA-N	399.16818753							27882
Danthron	LSM-2208	Danthron, Dantron, Dorbane, Chrysazin, Istizin	2950	InChI=1S/C14H8O4/c15-9-5-1-3-7-11(9)14(18)12-8(13(7)17)4-2-6-10(12)16/h1-6,15-16H	QBPFLULOKWLNNW-UHFFFAOYSA-N	Oc1cccc2C(=O)c3cccc(O)c3C(=O)c12	BroadT	BRD-K10065684	BRD-K10065684-001-02-5	AnalytiCon Discovery GmbH	NP-009848			Oc1cccc2C(=O)c3cccc(O)c3C(=O)c12	InChI=1S/C14H8O4/c15-9-5-1-3-7-11(9)14(18)12-8(13(7)17)4-2-6-10(12)16/h1-6,15-16H	QBPFLULOKWLNNW-UHFFFAOYSA-N	240.042258736							3682
O-2050	LSM-2030	BRD-K02590140, SID26753175	16102146	InChI=1S/C23H31NO4S/c1-16-10-11-19-18(13-16)22-20(25)14-17(15-21(22)28-23(19,2)3)9-7-5-6-8-12-24-29(4,26)27/h10,14-15,18-19,24-25H,6,8-9,11-13H2,1-4H3/t18-,19-/m1/s1	DJTGGIYZQHHLGJ-RTBURBONSA-N	CC1=CC[C@@H]2[C@@H](C1)c3c(O)cc(CC#CCCCNS(=O)(=O)C)cc3OC2(C)C	BroadT	BRD-K02590140	BRD-K02590140-001-01-2	Tocris Bioscience	1655	2		CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(CC#CCCCNS(C)(=O)=O)cc1OC2(C)C	InChI=1S/C23H31NO4S/c1-16-10-11-19-18(13-16)22-20(25)14-17(15-21(22)28-23(19,2)3)9-7-5-6-8-12-24-29(4,26)27/h10,14-15,18-19,24-25H,6,8-9,11-13H2,1-4H3/t18-,19-/m1/s1	DJTGGIYZQHHLGJ-RTBURBONSA-N	417.197379172							92047
Simazine	LSM-19997	SID26747719	5216	InChI=1S/C7H12ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H2,1-2H3,(H2,9,10,11,12,13)	ODCWYMIRDDJXKW-UHFFFAOYSA-N	CCNc1nc(Cl)nc(NCC)n1	BroadT	BRD-K01416914	BRD-K01416914-001-02-3	MicroSource Discovery Systems Inc.	330028			CCNc1nc(Cl)nc(NCC)n1	InChI=1S/C7H12ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H2,1-2H3,(H2,9,10,11,12,13)	ODCWYMIRDDJXKW-UHFFFAOYSA-N	201.078123144							27496
Allopregnanolone	LSM-19998	5alpha Pregnan 3alpha Ol 20 One, 5-Alpha-Pregnan-3-Alpha-Ol-20-one, Allopregnanolone	92786	InChI=1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19,23H,4-12H2,1-3H3/t14-,15+,16-,17+,18-,19-,20-,21+/m0/s1	AURFZBICLPNKBZ-SYBPFIFISA-N	CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C	BroadT	BRD-K18172896	BRD-K18172896-001-01-7	Biomol International Inc.	AC-971	2819-N1292		CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C	InChI=1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19,23H,4-12H2,1-3H3/t14-,15+,16-,17+,18-,19-,20-,21+/m0/s1	AURFZBICLPNKBZ-SYBPFIFISA-N	318.255880328							50169
Kuhlmannin	LSM-19999	SID26749942	4412068	InChI=1S/C17H14O5/c1-20-16-13(18)8-12-11(10-6-4-3-5-7-10)9-14(19)22-15(12)17(16)21-2/h3-9,18H,1-2H3	ABUBCBFUQXIEAU-UHFFFAOYSA-N	COc1c(O)cc2C(=CC(=O)Oc2c1OC)c3ccccc3	BroadT	BRD-K18149487	BRD-K18149487-001-02-8	MicroSource Discovery Systems Inc.	240862			COc1c(O)cc2c(cc(=O)oc2c1OC)-c1ccccc1	InChI=1S/C17H14O5/c1-20-16-13(18)8-12-11(10-6-4-3-5-7-10)9-14(19)22-15(12)17(16)21-2/h3-9,18H,1-2H3	ABUBCBFUQXIEAU-UHFFFAOYSA-N	298.084123548							108605
Harmalol	LSM-15521	Harmolol, Harmalol	5353656	InChI=1S/C12H12N2O/c1-7-12-10(4-5-13-7)9-3-2-8(15)6-11(9)14-12/h2-3,6,14-15H,4-5H2,1H3	RHVPEFQDYMMNSY-UHFFFAOYSA-N	CC1=NCCc2c1[nH]c3cc(O)ccc23	BroadT	BRD-K14756138	BRD-K14756138-310-03-0	Prestwick Chemical Inc.	Prestw-611	D0701-MP04-ST03-200-	O.O.Cl	CC1=NCCc2c1[nH]c1cc(O)ccc21.O.O.Cl	InChI=1S/C12H12N2O.ClH.2H2O/c1-7-12-10(4-5-13-7)9-3-2-8(15)6-11(9)14-12;;;/h2-3,6,14-15H,4-5H2,1H3;1H;2*1H2	OYKGNQNESCZSHQ-UHFFFAOYSA-N	200.094963024							27943, 27943, 27943, 27943, 27943
Pepstatin	LSM-2282	Pepstatin, Pepstatin A	5478883	InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1	FAXGPCHRFPCXOO-LXTPJMTPSA-N	CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(=O)O	BroadT	BRD-K13571841	BRD-K13571841-001-03-7	Biomol International Inc.	PI-120	2840(V2)-3-N1305		CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O	InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1	FAXGPCHRFPCXOO-LXTPJMTPSA-N	685.462578646							
Kaempferol	LSM-5304	Kaempferol, Kempferol, Pelargidenolon, Populnetin, Rhamnolutein, Rhamnolutin, Robigenin, Kaempherol, Swartziol, Trifolitin	5280863	InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H	IYRMWMYZSQPJKC-UHFFFAOYSA-N	OC1=C(Oc2cc(O)cc(O)c2C1=O)c3ccc(O)cc3	BroadT	BRD-K12807006	BRD-K12807006-001-02-9	AnalytiCon Discovery GmbH	NP-004313			Oc1ccc(cc1)-c1oc2cc(O)cc(O)c2c(=O)c1O	InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H	IYRMWMYZSQPJKC-UHFFFAOYSA-N	286.04773804							28499
Ccmq	LSM-2112	BRD-K06159959, SID11113986	3337816	InChI=1S/C12H9NO4/c14-10(15)6-8-5-7-3-1-2-4-9(7)13-11(8)12(16)17/h1-5H,6H2,(H,14,15)(H,16,17)	IFXJDEHFADWURH-UHFFFAOYSA-N	OC(=O)Cc1cc2ccccc2nc1C(=O)O	BroadT	BRD-K06159959	BRD-K06159959-001-01-2	Tocris Bioscience	1238	2		OC(=O)Cc1cc2ccccc2nc1C(O)=O	InChI=1S/C12H9NO4/c14-10(15)6-8-5-7-3-1-2-4-9(7)13-11(8)12(16)17/h1-5H,6H2,(H,14,15)(H,16,17)	IFXJDEHFADWURH-UHFFFAOYSA-N	231.053157778							92111
R(+)-Terguride	LSM-2104	Terguride, R(+)-Terguride	11957722	InChI=1S/C20H28N4O/c1-4-24(5-2)20(25)22-14-10-16-15-7-6-8-17-19(15)13(11-21-17)9-18(16)23(3)12-14/h6-8,11,14,16,18,21H,4-5,9-10,12H2,1-3H3,(H,22,25)/t14-,16-,18-/m1/s1	JOAHPSVPXZTVEP-QGPMSJSTSA-N	CCN(CC)C(=O)N[C@@H]1C[C@H]2[C@@H](Cc3c[nH]c4cccc2c34)N(C)C1	BroadT	BRD-K05901394	BRD-K05901394-001-01-1	Biomol International Inc.	AC-839	2812-3-N1298		CCN(CC)C(=O)N[C@@H]1C[C@H]2[C@@H](Cc3c[nH]c4cccc2c34)N(C)C1	InChI=1S/C20H28N4O/c1-4-24(5-2)20(25)22-14-10-16-15-7-6-8-17-19(15)13(11-21-17)9-18(16)23(3)12-14/h6-8,11,14,16,18,21H,4-5,9-10,12H2,1-3H3,(H,22,25)/t14-,16-,18-/m1/s1	JOAHPSVPXZTVEP-QGPMSJSTSA-N	340.226311556							92105
Benzbromarone	LSM-2239	Benzbromaron, Benzbromarone, L-2214, MJ-10061	2333	InChI=1S/C17H12Br2O3/c1-2-13-15(10-5-3-4-6-14(10)22-13)16(20)9-7-11(18)17(21)12(19)8-9/h3-8,21H,2H2,1H3	WHQCHUCQKNIQEC-UHFFFAOYSA-N	CCc1oc2ccccc2c1C(=O)c3cc(Br)c(O)c(Br)c3	BroadT	BRD-K11717138	BRD-K11717138-001-03-0	Prestwick Chemical Inc.	Prestw-370	D0701-MP04-ST03-200-		CCc1oc2ccccc2c1C(=O)c1cc(Br)c(O)c(Br)c1	InChI=1S/C17H12Br2O3/c1-2-13-15(10-5-3-4-6-14(10)22-13)16(20)9-7-11(18)17(21)12(19)8-9/h3-8,21H,2H2,1H3	WHQCHUCQKNIQEC-UHFFFAOYSA-N	421.915319444							3023
D-Erythro-MAPP	LSM-2195	L-Erythro-Mapp	6610217	InChI=1S/C23H39NO2/c1-3-4-5-6-7-8-9-10-11-12-16-19-22(25)24-20(2)23(26)21-17-14-13-15-18-21/h13-15,17-18,20,23,26H,3-12,16,19H2,1-2H3,(H,24,25)/t20-,23-/m0/s1	YLAZEWZHIRBZDA-REWPJTCUSA-N	CCCCCCCCCCCCCC(=O)N[C@@H](C)[C@H](O)c1ccccc1	BroadT	BRD-K09635134	BRD-K09635134-001-02-4	Biomol International Inc.	SL222	2840(V2)-3-N1305		CCCCCCCCCCCCCC(=O)N[C@@H](C)[C@H](O)c1ccccc1	InChI=1S/C23H39NO2/c1-3-4-5-6-7-8-9-10-11-12-16-19-22(25)24-20(2)23(26)21-17-14-13-15-18-21/h13-15,17-18,20,23,26H,3-12,16,19H2,1-2H3,(H,24,25)/t20-,23-/m0/s1	YLAZEWZHIRBZDA-REWPJTCUSA-N	361.298079498							92166
Phenformin	LSM-2233		8249	InChI=1S/C10H15N5/c11-9(12)15-10(13)14-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H6,11,12,13,14,15)	ICFJFFQQTFMIBG-UHFFFAOYSA-N	NC(=NC(=NCCc1ccccc1)N)N	BroadT	BRD-K11399644	BRD-K11399644-003-03-0	Prestwick Chemical Inc.	Prestw-179	D0701-MP04-ST03-200-	Cl	NC(=N)NC(=N)NCCc1ccccc1.Cl	InChI=1S/C10H15N5.ClH/c11-9(12)15-10(13)14-7-6-8-4-2-1-3-5-8;/h1-5H,6-7H2,(H6,11,12,13,14,15);1H	YSUCWSWKRIOILX-UHFFFAOYSA-N	205.13274553							8064, 8064, 8064
Florfenicol	LSM-5287	Florfenicol, SCH-25298	114811	InChI=1S/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10-/m1/s1	AYIRNRDRBQJXIF-NXEZZACHSA-N	CS(=O)(=O)c1ccc(cc1)[C@@H](O)[C@@H](CF)NC(=O)C(Cl)Cl	BroadT	BRD-K11298197	BRD-K11298197-001-03-9	Prestwick Chemical Inc.	Prestw-955	D0701-MP04-ST03-200-		CS(=O)(=O)c1ccc(cc1)[C@@H](O)[C@@H](CF)NC(=O)C(Cl)Cl	InChI=1S/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)/t9-,10-/m1/s1	AYIRNRDRBQJXIF-NXEZZACHSA-N	357.000462248							87185
Clebopride	LSM-2375	Cleboril, Clebopride, LAS-9273, Clebopride Malate	2780	InChI=1S/C20H24ClN3O2/c1-26-19-12-18(22)17(21)11-16(19)20(25)23-15-7-9-24(10-8-15)13-14-5-3-2-4-6-14/h2-6,11-12,15H,7-10,13,22H2,1H3,(H,23,25)	BVPWJMCABCPUQY-UHFFFAOYSA-N	COc1cc(N)c(Cl)cc1C(=O)NC2CCN(Cc3ccccc3)CC2	BroadT	BRD-K17294426	BRD-K17294426-050-04-0	MicroSource Discovery Systems Inc.	1503991		OC(=O)/C=C\C(=O)O	COc1cc(N)c(Cl)cc1C(=O)NC1CCN(Cc2ccccc2)CC1.OC(=O)/C=C\C(=O)O	InChI=1S/C20H24ClN3O2.C4H4O4/c1-26-19-12-18(22)17(21)11-16(19)20(25)23-15-7-9-24(10-8-15)13-14-5-3-2-4-6-14;5-3(6)1-2-4(7)8/h2-6,11-12,15H,7-10,13,22H2,1H3,(H,23,25);1-2H,(H,5,6)(H,7,8)/b;2-1-	BCVIWCRZYPHHMQ-BTJKTKAUSA-N	373.155704748							92309, 92309
Ibudilast	LSM-2357	Ibudilast, MN-166, AV-411, BRD-K16444452	3671	InChI=1S/C14H18N2O/c1-9(2)13-12(14(17)10(3)4)11-7-5-6-8-16(11)15-13/h5-10H,1-4H3	ZJVFLBOZORBYFE-UHFFFAOYSA-N	CC(C)C(=O)c1c(nn2ccccc12)C(C)C	BroadT	BRD-K16444452	BRD-K16444452-001-03-4	Tocris Bioscience	1694	1		CC(C)C(=O)c1c(nn2ccccc12)C(C)C	InChI=1S/C14H18N2O/c1-9(2)13-12(14(17)10(3)4)11-7-5-6-8-16(11)15-13/h5-10H,1-4H3	ZJVFLBOZORBYFE-UHFFFAOYSA-N	230.141913216							92295
Propylpyrazoletriol	LSM-1978	1,3,5-Tris(4-Hydroxyphenyl)-4-Propyl-1H-Pyrazole, Propylpyrazoletriol, BRD-K00312224	6095481	InChI=1S/C24H22N2O3/c1-2-3-22-23(16-4-10-19(27)11-5-16)25-26(18-8-14-21(29)15-9-18)24(22)17-6-12-20(28)13-7-17/h4-15,27-29H,2-3H2,1H3	IOTXSIGGFRQYKW-UHFFFAOYSA-N	CCCc1c(nn(c2ccc(O)cc2)c1c3ccc(O)cc3)c4ccc(O)cc4	BroadT	BRD-K00312224	BRD-K00312224-001-03-8	Tocris Bioscience	1426	5		CCCc1c(nn(c1-c1ccc(O)cc1)-c1ccc(O)cc1)-c1ccc(O)cc1	InChI=1S/C24H22N2O3/c1-2-3-22-23(16-4-10-19(27)11-5-16)25-26(18-8-14-21(29)15-9-18)24(22)17-6-12-20(28)13-7-17/h4-15,27-29H,2-3H2,1H3	IOTXSIGGFRQYKW-UHFFFAOYSA-N	386.163042584							64110
CHEMBL288096	LSM-2361	SID90340698, SID50111051, R(-)-2,10,11-Trihydroxy-N-Propyl-Noraporphine	6603798	InChI=1S/C19H21NO3/c1-2-6-20-7-5-12-8-13(21)10-14-17(12)15(20)9-11-3-4-16(22)19(23)18(11)14/h3-4,8,10,15,21-23H,2,5-7,9H2,1H3/t15-/m1/s1	HLRBSTGXOFUEHW-OAHLLOKOSA-N	CCCN1CCc2cc(O)cc3c2[C@H]1Cc4ccc(O)c(O)c34	BroadT	BRD-K16604360	BRD-K16604360-001-01-8	Biomol International Inc.	AC-831	2812-3-N1298		CCCN1CCc2cc(O)cc-3c2[C@H]1Cc1ccc(O)c(O)c-31	InChI=1S/C19H21NO3/c1-2-6-20-7-5-12-8-13(21)10-14-17(12)15(20)9-11-3-4-16(22)19(23)18(11)14/h3-4,8,10,15,21-23H,2,5-7,9H2,1H3/t15-/m1/s1	HLRBSTGXOFUEHW-OAHLLOKOSA-N	311.152143542							92298, 92298, 92298
SC-10	LSM-2092	SID11113496	5175	InChI=1S/C17H22ClNO2S/c1-2-3-4-5-6-13-19-22(20,21)17-12-8-9-14-15(17)10-7-11-16(14)18/h7-12,19H,2-6,13H2,1H3	MJMJERJFCHYXEM-UHFFFAOYSA-N	CCCCCCCNS(=O)(=O)c1cccc2c(Cl)cccc12	BroadT	BRD-K05361803	BRD-K05361803-001-01-3	Tocris Bioscience	430			CCCCCCCNS(=O)(=O)c1cccc2c(Cl)cccc12	InChI=1S/C17H22ClNO2S/c1-2-3-4-5-6-13-19-22(20,21)17-12-8-9-14-15(17)10-7-11-16(14)18/h7-12,19H,2-6,13H2,1H3	MJMJERJFCHYXEM-UHFFFAOYSA-N	339.105977354							92094
SG-209	LSM-2381	BRD-K17693482, SID11113476, SID14735997	134230	InChI=1S/C10H12N2O3/c1-8(13)15-6-5-12-10(14)9-3-2-4-11-7-9/h2-4,7H,5-6H2,1H3,(H,12,14)	JQICNNKLTFYSLS-UHFFFAOYSA-N	CC(=O)OCCNC(=O)c1cccnc1	BroadT	BRD-K17693482	BRD-K17693482-001-03-9	Tocris Bioscience	385	1		CC(=O)OCCNC(=O)c1cccnc1	InChI=1S/C10H12N2O3/c1-8(13)15-6-5-12-10(14)9-3-2-4-11-7-9/h2-4,7H,5-6H2,1H3,(H,12,14)	JQICNNKLTFYSLS-UHFFFAOYSA-N	208.084792264							92313
Aminopyrine	LSM-20000	Aminopyrine, Aminophenazone, Amidopyrine	6009	InChI=1S/C13H17N3O/c1-10-12(14(2)3)13(17)16(15(10)4)11-8-6-5-7-9-11/h5-9H,1-4H3	RMMXTBMQSGEXHJ-UHFFFAOYSA-N	CN(C)C1=C(C)N(C)N(C1=O)c2ccccc2	BroadT	BRD-K12568846	BRD-K12568846-001-01-3	TimTec LLC	ST011911			CN(C)c1c(C)n(C)n(-c2ccccc2)c1=O	InChI=1S/C13H17N3O/c1-10-12(14(2)3)13(17)16(15(10)4)11-8-6-5-7-9-11/h5-9H,1-4H3	RMMXTBMQSGEXHJ-UHFFFAOYSA-N	231.137162194							160246, 160246
Bergapten	LSM-20001	Bergaptene, Bergapten	2355	InChI=1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3	BGEBZHIAGXMEMV-UHFFFAOYSA-N	COc1c2C=CC(=O)Oc2cc3occc13	BroadT	BRD-K12968785	BRD-K12968785-001-02-6	AnalytiCon Discovery GmbH	NP-002894			COc1c2ccoc2cc2oc(=O)ccc12	InChI=1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3	BGEBZHIAGXMEMV-UHFFFAOYSA-N	216.042258736							18293
LE 300	LSM-2007	SID90341417, BRD-K01648091, SID56463488, SID85231116	4350931	InChI=1S/C20H22N2/c1-22-12-10-15-6-2-3-7-16(15)14-20-18(11-13-22)17-8-4-5-9-19(17)21-20/h2-9,21H,10-14H2,1H3	YEWGIGCYIAMFMA-UHFFFAOYSA-N	CN1CCc2ccccc2Cc3[nH]c4ccccc4c3CC1	BroadT	BRD-K01648091	BRD-K01648091-001-04-2	Tocris Bioscience	1674	1		CN1CCc2c(Cc3ccccc3CC1)[nH]c1ccccc21	InChI=1S/C20H22N2/c1-22-12-10-15-6-2-3-7-16(15)14-20-18(11-13-22)17-8-4-5-9-19(17)21-20/h2-9,21H,10-14H2,1H3	YEWGIGCYIAMFMA-UHFFFAOYSA-N	290.178298724							92030
3-{3-[(1,3-Benzothiazol-2-ylsulfanyl)methyl]-4-hydroxy-5-methoxyphenyl}-2-cyanoprop-2-enamide	LSM-2158	BRD-K08132273	2062	InChI=1S/C19H15N3O3S2/c1-25-15-8-11(6-12(9-20)18(21)24)7-13(17(15)23)10-26-19-22-14-4-2-3-5-16(14)27-19/h2-8,23H,10H2,1H3,(H2,21,24)	KXDONFLNGBQLTN-UHFFFAOYSA-N	COc1cc(C=C(C#N)C(=O)N)cc(CSc2nc3ccccc3s2)c1O	BroadT	BRD-K08132273	BRD-K08132273-001-01-6	Tocris Bioscience	1555	1		COc1cc(C=C(C#N)C(N)=O)cc(CSc2nc3ccccc3s2)c1O	InChI=1S/C19H15N3O3S2/c1-25-15-8-11(6-12(9-20)18(21)24)7-13(17(15)23)10-26-19-22-14-4-2-3-5-16(14)27-19/h2-8,23H,10H2,1H3,(H2,21,24)	KXDONFLNGBQLTN-UHFFFAOYSA-N	397.05548275							92141
HSCI1_000323	LSM-20002	9,21-Dehydroryanodine	24086267	InChI=1S/C26H37NO8/c1-13(2)20(5)17(16(34-33)15-8-7-11-27-15)24(31)19(4)12-23(30)21(20,6)26(24,32)25(35-23)18(28)14(3)9-10-22(19,25)29/h7-8,11,13,16-18,27-33H,3,9-10,12H2,1-2,4-6H3/t16-,17-,18-,19+,20+,21-,22+,23-,24-,25-,26-/m1/s1	DHJGMGNHBFAAKU-YFFVFBJPSA-N	CC(C)[C@@]1(C)[C@@H]([C@H](OO)c2ccc[nH]2)[C@@]3(O)[C@@]4(C)C[C@@]5(O)O[C@@]6([C@H](O)C(=C)CC[C@]46O)[C@@]3(O)[C@]15C	BroadT	BRD-K14359826	BRD-K14359826-001-01-9	EMD Biosciences	559277			CC(C)[C@@]1(C)[C@@H]([C@H](OO)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@@]4(O)O[C@@]5([C@H](O)C(=C)CC[C@]35O)[C@@]2(O)[C@]14C	InChI=1S/C26H37NO8/c1-13(2)20(5)17(16(34-33)15-8-7-11-27-15)24(31)19(4)12-23(30)21(20,6)26(24,32)25(35-23)18(28)14(3)9-10-22(19,25)29/h7-8,11,13,16-18,27-33H,3,9-10,12H2,1-2,4-6H3/t16-,17-,18-,19+,20+,21-,22+,23-,24-,25-,26-/m1/s1	DHJGMGNHBFAAKU-YFFVFBJPSA-N	491.251917154							
Vapiprost	LSM-42842	Vapiprost, BRD-K02283807, GR-32191	6918030	InChI=1S/C30H39NO4/c32-27-21-28(35-22-23-15-17-25(18-16-23)24-11-5-3-6-12-24)26(13-7-1-2-8-14-29(33)34)30(27)31-19-9-4-10-20-31/h1-3,5-6,11-12,15-18,26-28,30,32H,4,7-10,13-14,19-22H2,(H,33,34)/b2-1-/t26-,27-,28-,30+/m0/s1	GQGRDYWMOPRROR-XUSMOFMBSA-N	O[C@H]1C[C@H](OCc2ccc(cc2)c3ccccc3)[C@H](CC\C=C/CCC(=O)O)[C@H]1N4CCCCC4	BroadT	BRD-K02283807	BRD-K02283807-003-01-4	Tocris Bioscience	1958	1	Cl	O[C@H]1C[C@H](OCc2ccc(cc2)-c2ccccc2)[C@H](CC\C=C/CCC(O)=O)[C@H]1N1CCCCC1.Cl	InChI=1S/C30H39NO4.ClH/c32-27-21-28(35-22-23-15-17-25(18-16-23)24-11-5-3-6-12-24)26(13-7-1-2-8-14-29(33)34)30(27)31-19-9-4-10-20-31;/h1-3,5-6,11-12,15-18,26-28,30,32H,4,7-10,13-14,19-22H2,(H,33,34);1H/b2-1-;/t26-,27-,28-,30+;/m0./s1	ZYOBZRTZRQKKNC-UGNABIHOSA-N	477.287908738							, 
MEK1/2 Inhibitor	LSM-42879	SL-327	9549284	InChI=1S/C16H12F3N3S/c17-16(18,19)14-4-2-1-3-12(14)13(9-20)15(22)23-11-7-5-10(21)6-8-11/h1-8H,21-22H2/b15-13+	JLOXTZFYJNCPIS-FYWRMAATSA-N	N\C(=C(\C#N)/c1ccccc1C(F)(F)F)\Sc2ccc(N)cc2	BroadT	BRD-K12244279	BRD-K12244279-001-01-7	Calbiochem	444939			N\C(Sc1ccc(N)cc1)=C(\C#N)c1ccccc1C(F)(F)F	InChI=1S/C16H12F3N3S/c17-16(18,19)14-4-2-1-3-12(14)13(9-20)15(22)23-11-7-5-10(21)6-8-11/h1-8H,21-22H2/b15-13+	JLOXTZFYJNCPIS-FYWRMAATSA-N	335.070402704							
NU-7026	LSM-2191	LY-293646, NU7026	9860529	InChI=1S/C17H15NO3/c19-15-11-16(18-7-9-20-10-8-18)21-17-13-4-2-1-3-12(13)5-6-14(15)17/h1-6,11H,7-10H2	KKTZALUTXUZPSN-UHFFFAOYSA-N	O=C1C=C(Oc2c1ccc3ccccc23)N4CCOCC4	BroadT	BRD-K09537769	BRD-K09537769-001-01-6	Calbiochem	260961			O=c1cc(oc2c3ccccc3ccc12)N1CCOCC1	InChI=1S/C17H15NO3/c19-15-11-16(18-7-9-20-10-8-18)21-17-13-4-2-1-3-12(13)5-6-14(15)17/h1-6,11H,7-10H2	KKTZALUTXUZPSN-UHFFFAOYSA-N	281.10519335							92165
SDZ-205-557	LSM-2348	SDZ-205557	5191	InChI=1S/C14H21ClN2O3/c1-4-17(5-2)6-7-20-14(18)10-8-11(15)12(16)9-13(10)19-3/h8-9H,4-7,16H2,1-3H3	FFNWMBDISAYHDC-UHFFFAOYSA-N	CCN(CC)CCOC(=O)c1cc(Cl)c(N)cc1OC	BroadT	BRD-K15868788	BRD-K15868788-001-01-4	Biomol International Inc.	AC-843	2813-N1283		CCN(CC)CCOC(=O)c1cc(Cl)c(N)cc1OC	InChI=1S/C14H21ClN2O3/c1-4-17(5-2)6-7-20-14(18)10-8-11(15)12(16)9-13(10)19-3/h8-9H,4-7,16H2,1-3H3	FFNWMBDISAYHDC-UHFFFAOYSA-N	300.124070262							92288, 92288
Nialamide	LSM-5300	Nialamide	4472	InChI=1S/C16H18N4O2/c21-15(18-12-13-4-2-1-3-5-13)8-11-19-20-16(22)14-6-9-17-10-7-14/h1-7,9-10,19H,8,11-12H2,(H,18,21)(H,20,22)	NOIIUHRQUVNIDD-UHFFFAOYSA-N	O=C(CCNNC(=O)c1ccncc1)NCc2ccccc2	BroadT	BRD-K12102668	BRD-K12102668-001-04-0	Prestwick Chemical Inc.	Prestw-1099	D0701-MP04-ST03-200-		O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1	InChI=1S/C16H18N4O2/c21-15(18-12-13-4-2-1-3-5-13)8-11-19-20-16(22)14-6-9-17-10-7-14/h1-7,9-10,19H,8,11-12H2,(H,18,21)(H,20,22)	NOIIUHRQUVNIDD-UHFFFAOYSA-N	298.142975856							94510
Mocetinostat	LSM-5344	Mocetinostat, MGCD0103, MGCD-0103, MCG-D0103	9865515	InChI=1S/C23H20N6O/c24-19-5-1-2-6-21(19)28-22(30)17-9-7-16(8-10-17)14-27-23-26-13-11-20(29-23)18-4-3-12-25-15-18/h1-13,15H,14,24H2,(H,28,30)(H,26,27,29)	HRNLUBSXIHFDHP-UHFFFAOYSA-N	Nc1ccccc1NC(=O)c2ccc(CNc3nccc(n3)c4cccnc4)cc2	BroadT	BRD-K16485616	BRD-K16485616-001-01-4	Broad Institute CMLD	RLM-2-67			Nc1ccccc1NC(=O)c1ccc(CNc2nccc(n2)-c2cccnc2)cc1	InChI=1S/C23H20N6O/c24-19-5-1-2-6-21(19)28-22(30)17-9-7-16(8-10-17)14-27-23-26-13-11-20(29-23)18-4-3-12-25-15-18/h1-13,15H,14,24H2,(H,28,30)(H,26,27,29)	HRNLUBSXIHFDHP-UHFFFAOYSA-N	396.16985932							94525, 94525
SCHEMBL5945809	LSM-2339	BRD-K15588452	10668211	InChI=1S/C22H29NO3/c1-23-16-20(24)15-19(23)12-13-26-22-9-4-3-7-18(22)11-10-17-6-5-8-21(14-17)25-2/h3-9,14,19-20,24H,10-13,15-16H2,1-2H3/t19-,20-/m1/s1	AFZLABYDOCWQBQ-WOJBJXKFSA-N	COc1cccc(CCc2ccccc2OCC[C@@H]3C[C@@H](O)CN3C)c1	BroadT	BRD-K15588452	BRD-K15588452-003-01-9	Tocris Bioscience	1742	3	Cl	COc1cccc(CCc2ccccc2OCC[C@@H]2C[C@@H](O)CN2C)c1.Cl	InChI=1S/C22H29NO3.ClH/c1-23-16-20(24)15-19(23)12-13-26-22-9-4-3-7-18(22)11-10-17-6-5-8-21(14-17)25-2;/h3-9,14,19-20,24H,10-13,15-16H2,1-2H3;1H/t19-,20-;/m1./s1	OUKRSTJUAQEATQ-GZJHNZOKSA-N	355.214743798							92282, 92282
Linoleic acid	LSM-42867	Linoleicacid, Octadeca-9,12-Dienoic Acid, Linoleic-Acid	5280450	InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-	OYHQOLUKZRVURQ-HZJYTTRNSA-N	CCCCC\C=C/C\C=C/CCCCCCCC(=O)O	BroadT	BRD-K08973992	BRD-K08973992-001-01-3	AnalytiCon Discovery GmbH	NP-000153			CCCCC\C=C/C\C=C/CCCCCCCC(O)=O	InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-	OYHQOLUKZRVURQ-HZJYTTRNSA-N	280.240230264							17351, 17351, 17351
Methiazole	LSM-4894	SID56463642, SID11112923	6604471	InChI=1S/C12H15N3O2S/c1-7(2)18-8-4-5-9-10(6-8)14-11(13-9)15-12(16)17-3/h4-7H,1-3H3,(H2,13,14,15,16)	SXJIZQPZESTWLD-UHFFFAOYSA-N	COC(=O)Nc1nc2cc(SC(C)C)ccc2[nH]1	BroadT	BRD-K02764365	BRD-K02764365-001-03-7	Prestwick Chemical Inc.	Prestw-1080	D0701-MP04-ST03-200-		COC(=O)Nc1nc2cc(SC(C)C)ccc2[nH]1	InChI=1S/C12H15N3O2S/c1-7(2)18-8-4-5-9-10(6-8)14-11(13-9)15-12(16)17-3/h4-7H,1-3H3,(H2,13,14,15,16)	SXJIZQPZESTWLD-UHFFFAOYSA-N	265.08849744							94268
BRL-37344	LSM-2146	BRD-K07507905, BRL-37344	9841972	InChI=1S/C19H22ClNO4/c1-13(21-11-18(22)15-3-2-4-16(20)10-15)9-14-5-7-17(8-6-14)25-12-19(23)24/h2-8,10,13,18,21-22H,9,11-12H2,1H3,(H,23,24)/t13-,18+/m1/s1	ZGGNJJJYUVRADP-ACJLOTCBSA-N	C[C@H](Cc1ccc(OCC(=O)O)cc1)NC[C@H](O)c2cccc(Cl)c2	BroadT	BRD-K07507905	BRD-K07507905-236-01-8	Tocris Bioscience	948	4	[Na]	C[C@H](Cc1ccc(OCC(O)=O)cc1)NC[C@H](O)c1cccc(Cl)c1.[Na]	InChI=1S/C19H22ClNO4.Na.H/c1-13(21-11-18(22)15-3-2-4-16(20)10-15)9-14-5-7-17(8-6-14)25-12-19(23)24;;/h2-8,10,13,18,21-22H,9,11-12H2,1H3,(H,23,24);;/t13-,18+;;/m1../s1	MGXUVTFNVMXUTA-BNTHFPBMSA-N	363.123735904							131180, 131180
N-Methylanthranilic acid	LSM-20003	BRD-K06439119, SID26749777	67069	InChI=1S/C8H9NO2/c1-9-7-5-3-2-4-6(7)8(10)11/h2-5,9H,1H3,(H,10,11)	WVMBPWMAQDVZCM-UHFFFAOYSA-N	CNc1ccccc1C(=O)O	BroadT	BRD-K06439119	BRD-K06439119-001-02-3	MicroSource Discovery Systems Inc.	1600964			CNc1ccccc1C(O)=O	InChI=1S/C8H9NO2/c1-9-7-5-3-2-4-6(7)8(10)11/h2-5,9H,1H3,(H,10,11)	WVMBPWMAQDVZCM-UHFFFAOYSA-N	151.063328538							16394
YM 976	LSM-2271	BRD-K12932420, SID11114229, SID90341065	6604918	InChI=1S/C17H16ClN3O/c1-3-13-8-9-14-15(11-6-5-7-12(18)10-11)20-17(22)21(4-2)16(14)19-13/h5-10H,3-4H2,1-2H3	MNHXYNNKDDXKNP-UHFFFAOYSA-N	CCN1C(=O)N=C(c2cccc(Cl)c2)c3ccc(CC)nc13	BroadT	BRD-K12932420	BRD-K12932420-001-01-5	Tocris Bioscience	1821	2		CCc1ccc2c(nc(=O)n(CC)c2n1)-c1cccc(Cl)c1	InChI=1S/C17H16ClN3O/c1-3-13-8-9-14-15(11-6-5-7-12(18)10-11)20-17(22)21(4-2)16(14)19-13/h5-10H,3-4H2,1-2H3	MNHXYNNKDDXKNP-UHFFFAOYSA-N	313.098189872							92225
Diflorasone Diacetate	LSM-2380	Psorcon, Florone, Diflorasone, U-34865, Psorcon E, Florone E, Diflorasone Diacetate	71414	InChI=1S/C26H32F2O7/c1-13-8-17-18-10-20(27)19-9-16(31)6-7-23(19,4)25(18,28)21(32)11-24(17,5)26(13,35-15(3)30)22(33)12-34-14(2)29/h6-7,9,13,17-18,20-21,32H,8,10-12H2,1-5H3/t13-,17-,18-,20-,21-,23-,24-,25-,26-/m0/s1	BOBLHFUVNSFZPJ-JOYXJVLSSA-N	C[C@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(OC(=O)C)C(=O)COC(=O)C	BroadT	BRD-K17674993	BRD-K17674993-001-03-1	Prestwick Chemical Inc.	Prestw-619	D0701-MP04-ST03-200-		C[C@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(OC(C)=O)C(=O)COC(C)=O	InChI=1S/C26H32F2O7/c1-13-8-17-18-10-20(27)19-9-16(31)6-7-23(19,4)25(18,28)21(32)11-24(17,5)26(13,35-15(3)30)22(33)12-34-14(2)29/h6-7,9,13,17-18,20-21,32H,8,10-12H2,1-5H3/t13-,17-,18-,20-,21-,23-,24-,25-,26-/m0/s1	BOBLHFUVNSFZPJ-JOYXJVLSSA-N	494.211609764							31483
Catechin Pentabenzoate	LSM-2051		6708716	InChI=1S/C50H34O11/c51-46(32-16-6-1-7-17-32)56-38-29-41-39(42(30-38)59-48(53)34-20-10-3-11-21-34)31-44(61-50(55)36-24-14-5-15-25-36)45(57-41)37-26-27-40(58-47(52)33-18-8-2-9-19-33)43(28-37)60-49(54)35-22-12-4-13-23-35/h1-30,44-45H,31H2/t44-,45+/m0/s1	RFKGHGMSJVVYTB-YWPUXERESA-N	O=C(O[C@H]1Cc2c(OC(=O)c3ccccc3)cc(OC(=O)c4ccccc4)cc2O[C@@H]1c5ccc(OC(=O)c6ccccc6)c(OC(=O)c7ccccc7)c5)c8ccccc8	BroadT	BRD-K03600606	BRD-K03600606-001-02-3	MicroSource Discovery Systems Inc.	210235			O=C(O[C@H]1Cc2c(OC(=O)c3ccccc3)cc(OC(=O)c3ccccc3)cc2O[C@@H]1c1ccc(OC(=O)c2ccccc2)c(OC(=O)c2ccccc2)c1)c1ccccc1	InChI=1S/C50H34O11/c51-46(32-16-6-1-7-17-32)56-38-29-41-39(42(30-38)59-48(53)34-20-10-3-11-21-34)31-44(61-50(55)36-24-14-5-15-25-36)45(57-41)37-26-27-40(58-47(52)33-18-8-2-9-19-33)43(28-37)60-49(54)35-22-12-4-13-23-35/h1-30,44-45H,31H2/t44-,45+/m0/s1	RFKGHGMSJVVYTB-YWPUXERESA-N	810.210111908001							92060
Dexibuprofen	LSM-2323	Dexibuprofen, Neoprofen, Rufen, IBU-Tab, S (+) Ibuprofen, S-(+)-Ibuprofen	39912	InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/t10-/m0/s1	HEFNNWSXXWATRW-JTQLQIEISA-N	CC(C)Cc1ccc(cc1)[C@H](C)C(=O)O	BroadT	BRD-K14965640	BRD-K14965640-001-03-3	Prestwick Chemical Inc.	Prestw-907	D0701-MP04-ST03-200-		CC(C)Cc1ccc(cc1)[C@H](C)C(O)=O	InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/t10-/m0/s1	HEFNNWSXXWATRW-JTQLQIEISA-N	206.130679816							43415, 43415
Salicyl Alcohol	LSM-20004	Saligenol, Saligenin, Salicain, Salicyl Alcohol	5146	InChI=1S/C7H8O2/c8-5-6-3-1-2-4-7(6)9/h1-4,8-9H,5H2	CQRYARSYNCAZFO-UHFFFAOYSA-N	OCc1ccccc1O	BroadT	BRD-K08493205	BRD-K08493205-001-02-3	MicroSource Discovery Systems Inc.	1500531			OCc1ccccc1O	InChI=1S/C7H8O2/c8-5-6-3-1-2-4-7(6)9/h1-4,8-9H,5H2	CQRYARSYNCAZFO-UHFFFAOYSA-N	124.052429496							16464
SCH-79797	LSM-6224	SID11114146	4259181	InChI=1S/C23H25N5/c1-14(2)16-5-3-15(4-6-16)13-28-12-11-18-20(28)10-9-19-21(18)22(24)27-23(26-19)25-17-7-8-17/h3-6,9-12,14,17H,7-8,13H2,1-2H3,(H3,24,25,26,27)	AVXQPEKZIGPIJW-UHFFFAOYSA-N	CC(C)c1ccc(Cn2ccc3c2ccc4nc(NC5CC5)nc(N)c34)cc1	BroadT	BRD-K17140735	BRD-K17140735-300-01-6	Tocris Bioscience	1592	2	Cl.Cl	CC(C)c1ccc(Cn2ccc3c2ccc2nc(NC4CC4)nc(N)c32)cc1.Cl.Cl	InChI=1S/C23H25N5.2ClH/c1-14(2)16-5-3-15(4-6-16)13-28-12-11-18-20(28)10-9-19-21(18)22(24)27-23(26-19)25-17-7-8-17;;/h3-6,9-12,14,17H,7-8,13H2,1-2H3,(H3,24,25,26,27);2*1H	NNJTXSQXGHYXAJ-UHFFFAOYSA-N	371.21099585							94998
Docosatrienoic acid (22:3 n-3)	LSM-42841	SID26754939, SID26754940	5312557	InChI=1S/C22H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10H,2,5,8,11-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-	WBBQTNCISCKUMU-PDBXOOCHSA-N	CC\C=C/C\C=C/C\C=C/CCCCCCCCCCCC(=O)O	BroadT	BRD-K01624546	BRD-K01624546-001-02-8	Biomol International Inc.	FA-010	2840(V2)-3-N1305		CC\C=C/C\C=C/C\C=C/CCCCCCCCCCCC(O)=O	InChI=1S/C22H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10H,2,5,8,11-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-	WBBQTNCISCKUMU-PDBXOOCHSA-N	334.287180456							77807
Hispidin	LSM-42859	Hispidin	54685921	InChI=1S/C13H10O5/c14-9-6-10(18-13(17)7-9)3-1-8-2-4-11(15)12(16)5-8/h1-7,14-16H/b3-1+	SGJNQVTUYXCBKH-HNQUOIGGSA-N	OC1=CC(=O)OC(=C1)\C=C\c2ccc(O)c(O)c2	BroadT	BRD-K07325606	BRD-K07325606-001-02-3	Calbiochem	377980			Oc1cc(\C=C\c2ccc(O)c(O)c2)oc(=O)c1	InChI=1S/C13H10O5/c14-9-6-10(18-13(17)7-9)3-1-8-2-4-11(15)12(16)5-8/h1-7,14-16H/b3-1+	SGJNQVTUYXCBKH-HNQUOIGGSA-N	246.05282342							36332
5-Nonyloxytryptamine	LSM-20005	SID11113772, SID26751955	1797	InChI=1S/C19H30N2O/c1-2-3-4-5-6-7-8-13-22-17-9-10-19-18(14-17)16(11-12-20)15-21-19/h9-10,14-15,21H,2-8,11-13,20H2,1H3	YHSMSRREJYOGQJ-UHFFFAOYSA-N	CCCCCCCCCOc1ccc2[nH]cc(CCN)c2c1	BroadT	BRD-K08219523	BRD-K08219523-001-01-9	Biomol International Inc.	AC-533	2813-N1283		CCCCCCCCCOc1ccc2[nH]cc(CCN)c2c1	InChI=1S/C19H30N2O/c1-2-3-4-5-6-7-8-13-22-17-9-10-19-18(14-17)16(11-12-20)15-21-19/h9-10,14-15,21H,2-8,11-13,20H2,1H3	YHSMSRREJYOGQJ-UHFFFAOYSA-N	302.2358136							64149, 64149
Butein	LSM-42896	3,4,2',4'-Tetrahydroxychalone, Butein	5281222	InChI=1S/C15H12O5/c16-10-3-4-11(14(19)8-10)12(17)5-1-9-2-6-13(18)15(20)7-9/h1-8,16,18-20H/b5-1+	AYMYWHCQALZEGT-ORCRQEGFSA-N	Oc1ccc(C(=O)\C=C\c2ccc(O)c(O)c2)c(O)c1	BroadT	BRD-K17497770	BRD-K17497770-001-01-0	Calbiochem	203987			Oc1ccc(C(=O)\C=C\c2ccc(O)c(O)c2)c(O)c1	InChI=1S/C15H12O5/c16-10-3-4-11(14(19)8-10)12(17)5-1-9-2-6-13(18)15(20)7-9/h1-8,16,18-20H/b5-1+	AYMYWHCQALZEGT-ORCRQEGFSA-N	272.068473484							3237
HSCI1_000270	LSM-15607	Vincristine	24058669	InChI=1S/C46H56N4O10/c1-7-42(55)22-28-23-45(40(53)58-5,36-30(14-18-48(24-28)25-42)29-12-9-10-13-33(29)47-36)32-20-31-34(21-35(32)57-4)50(26-51)38-44(31)16-19-49-17-11-15-43(8-2,37(44)49)39(60-27(3)52)46(38,56)41(54)59-6/h9-13,15,20-21,26,28,37-39,47,55-56H,7-8,14,16-19,22-25H2,1-6H3/t28-,37+,38-,39-,42+,43+,44-,45+,46+/m1/s1	OGWKCGZFUXNPDA-YPKBQUEXSA-N	CC[C@]1(O)C[C@H]2CN(CCc3c([nH]c4ccccc34)[C@@](C2)(C(=O)OC)c5cc6c(cc5OC)N(C=O)[C@H]7[C@](O)([C@H](OC(=O)C)[C@@]8(CC)C=CCN9CC[C@]67[C@H]89)C(=O)OC)C1	BroadT	BRD-K09598619	BRD-K09598619-065-01-5	EMD Biosciences	677181		OS(=O)(=O)O	CC[C@]1(O)C[C@H]2CN(C1)CCc1c([nH]c3ccccc13)[C@@](C2)(C(=O)OC)c1cc2c(cc1OC)N(C=O)[C@@H]1[C@]22CCN3CC=C[C@@](CC)([C@@H]23)[C@@H](OC(C)=O)[C@]1(O)C(=O)OC.OS(=O)(=O)O	InChI=1S/C46H56N4O10.H2O4S/c1-7-42(55)22-28-23-45(40(53)58-5,36-30(14-18-48(24-28)25-42)29-12-9-10-13-33(29)47-36)32-20-31-34(21-35(32)57-4)50(26-51)38-44(31)16-19-49-17-11-15-43(8-2,37(44)49)39(60-27(3)52)46(38,56)41(54)59-6;1-5(2,3)4/h9-13,15,20-21,26,28,37-39,47,55-56H,7-8,14,16-19,22-25H2,1-6H3;(H2,1,2,3,4)/t28-,37+,38-,39-,42+,43+,44-,45+,46+;/m1./s1	AQTQHPDCURKLKT-WDUYJSEGSA-N	824.399644032001							104242
CHEMBL210901	LSM-42891	SID26756873, ZL3VS	5497183	InChI=1S/C28H45N3O6S/c1-19(2)15-23(13-14-38(7,35)36)29-26(32)24(16-20(3)4)30-27(33)25(17-21(5)6)31-28(34)37-18-22-11-9-8-10-12-22/h8-14,19-21,23-25H,15-18H2,1-7H3,(H,29,32)(H,30,33)(H,31,34)/b14-13+/t23-,24+,25+/m1/s1	DHLFJZAIZCMWEO-JDGFICQVSA-N	CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)\C=C\S(=O)(=O)C	BroadT	BRD-K15935639	BRD-K15935639-001-02-0	Biomol International Inc.	ZW-9170	2840(V2)-3-N1305		CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)\C=C\S(C)(=O)=O	InChI=1S/C28H45N3O6S/c1-19(2)15-23(13-14-38(7,35)36)29-26(32)24(16-20(3)4)30-27(33)25(17-21(5)6)31-28(34)37-18-22-11-9-8-10-12-22/h8-14,19-21,23-25H,15-18H2,1-7H3,(H,29,32)(H,30,33)(H,31,34)/b14-13+/t23-,24+,25+/m1/s1	DHLFJZAIZCMWEO-JDGFICQVSA-N	551.30290688							
BRD-K98301999	LSM-20006		44497177	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18+,24-/m1/s1	JIVQHRCMRGEILI-NXMSCROESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3c(NC(=O)C4CC4)cccc3C1=O	BroadT	BRD-K98301999	BRD-K98301999-001-01-1	Broad Institute of MIT and Harvard	BRD-K98301999			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2c(NC(=O)C3CC3)cccc2C1=O	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18+,24-/m1/s1	JIVQHRCMRGEILI-NXMSCROESA-N	509.25258587							108606
BRD-K94247332	LSM-20007		44503292	InChI=1S/C24H33N3O6S/c1-16-14-27(17(2)15-28)24(29)12-18-11-19(5-10-22(18)33-23(16)13-25-3)26-34(30,31)21-8-6-20(32-4)7-9-21/h5-11,16-17,23,25-26,28H,12-15H2,1-4H3/t16-,17-,23+/m1/s1	WHSSCNZRIKSNFR-QZMQVMSPSA-N	CNC[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K94247332	BRD-K94247332-001-01-6	Broad Institute of MIT and Harvard	BRD-K94247332			CNC[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H33N3O6S/c1-16-14-27(17(2)15-28)24(29)12-18-11-19(5-10-22(18)33-23(16)13-25-3)26-34(30,31)21-8-6-20(32-4)7-9-21/h5-11,16-17,23,25-26,28H,12-15H2,1-4H3/t16-,17-,23+/m1/s1	WHSSCNZRIKSNFR-QZMQVMSPSA-N	491.209006496							108607
BRD-K43282617	LSM-20008		44504851	InChI=1S/C34H37N5O5/c1-22-19-39(23(2)21-40)32(41)18-26-17-27(36-33(42)25-13-15-35-16-14-25)11-12-30(26)44-31(22)20-38(3)34(43)37-29-10-6-8-24-7-4-5-9-28(24)29/h4-17,22-23,31,40H,18-21H2,1-3H3,(H,36,42)(H,37,43)/t22-,23-,31-/m0/s1	LDEMJBAJJXLTPL-BVXAZASISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)c5ccncc5)cc4CC1=O	BroadT	BRD-K43282617	BRD-K43282617-001-01-1	Broad Institute of MIT and Harvard	BRD-K43282617			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C34H37N5O5/c1-22-19-39(23(2)21-40)32(41)18-26-17-27(36-33(42)25-13-15-35-16-14-25)11-12-30(26)44-31(22)20-38(3)34(43)37-29-10-6-8-24-7-4-5-9-28(24)29/h4-17,22-23,31,40H,18-21H2,1-3H3,(H,36,42)(H,37,43)/t22-,23-,31-/m0/s1	LDEMJBAJJXLTPL-BVXAZASISA-N	595.279469334							108608
BRD-K80176886	LSM-20009		54613817	InChI=1S/C24H32FN3O5S/c1-16-13-28(17(2)15-29)24(30)12-18-11-20(7-10-22(18)33-23(16)14-27(3)4)26-34(31,32)21-8-5-19(25)6-9-21/h5-11,16-17,23,26,29H,12-15H2,1-4H3/t16-,17+,23+/m1/s1	VCRKNKMPQDEVAF-DGGJZMOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2CC1=O	BroadT	BRD-K80176886	BRD-K80176886-001-01-3	Broad Institute of MIT and Harvard	BRD-K80176886			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2CC1=O	InChI=1S/C24H32FN3O5S/c1-16-13-28(17(2)15-29)24(30)12-18-11-20(7-10-22(18)33-23(16)14-27(3)4)26-34(31,32)21-8-5-19(25)6-9-21/h5-11,16-17,23,26,29H,12-15H2,1-4H3/t16-,17+,23+/m1/s1	VCRKNKMPQDEVAF-DGGJZMOXSA-N	493.204670044							108609
BRD-K63364685	LSM-20010		44499154	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)24-10-7-11-25(33-31(38)32-23-8-5-4-6-9-23)29(24)41-28(20)17-34(3)16-22-12-13-26-27(14-22)40-19-39-26/h7,10-14,20-21,23,28,36H,4-6,8-9,15-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28-/m0/s1	QXBUWZYZXJXLTK-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)NC5CCCCC5)cccc4C1=O	BroadT	BRD-K63364685	BRD-K63364685-001-01-9	Broad Institute of MIT and Harvard	BRD-K63364685			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)24-10-7-11-25(33-31(38)32-23-8-5-4-6-9-23)29(24)41-28(20)17-34(3)16-22-12-13-26-27(14-22)40-19-39-26/h7,10-14,20-21,23,28,36H,4-6,8-9,15-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28-/m0/s1	QXBUWZYZXJXLTK-GTNJKRJXSA-N	566.310435104							108610
BRD-K42757676	LSM-20011		44503562	InChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20-,25+/m0/s1	LNIIROWVVFKABQ-ZYLNGJIFSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K42757676	BRD-K42757676-001-01-1	Broad Institute of MIT and Harvard	BRD-K42757676			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20-,25+/m0/s1	LNIIROWVVFKABQ-ZYLNGJIFSA-N	546.251205666							108611
CHEMBL2359795	LSM-20012	BRD-K74537058, SID85802754	44495903	InChI=1S/C25H38N4O5/c1-15(2)26-25(33)28(5)13-22-16(3)12-29(17(4)14-30)23(31)11-19-10-20(8-9-21(19)34-22)27-24(32)18-6-7-18/h8-10,15-18,22,30H,6-7,11-14H2,1-5H3,(H,26,33)(H,27,32)/t16-,17-,22-/m0/s1	DCTUMTORVFHGKV-HOIFWPIMSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K74537058	BRD-K74537058-001-01-6	Broad Institute of MIT and Harvard	BRD-K74537058			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C25H38N4O5/c1-15(2)26-25(33)28(5)13-22-16(3)12-29(17(4)14-30)23(31)11-19-10-20(8-9-21(19)34-22)27-24(32)18-6-7-18/h8-10,15-18,22,30H,6-7,11-14H2,1-5H3,(H,26,33)(H,27,32)/t16-,17-,22-/m0/s1	DCTUMTORVFHGKV-HOIFWPIMSA-N	474.284220356							108612
BRD-K65633211	LSM-20013		44485636	InChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16+,20-/m1/s1	HFFGMDRCIAVIES-GQIGUUNPSA-N	CNC[C@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K65633211	BRD-K65633211-001-01-8	Broad Institute of MIT and Harvard	BRD-K65633211			CNC[C@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16+,20-/m1/s1	HFFGMDRCIAVIES-GQIGUUNPSA-N	432.273655672							108613
BRD-K51790412	LSM-20014		44488608	InChI=1S/C18H29N3O3/c1-12-10-21(13(2)11-22)18(23)14-7-6-8-15(20(4)5)17(14)24-16(12)9-19-3/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13+,16-/m1/s1	XJHVRUWFSLOUIR-DVOMOZLQSA-N	CNC[C@H]1Oc2c(cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K51790412	BRD-K51790412-001-01-9	Broad Institute of MIT and Harvard	BRD-K51790412			CNC[C@H]1Oc2c(cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C18H29N3O3/c1-12-10-21(13(2)11-22)18(23)14-7-6-8-15(20(4)5)17(14)24-16(12)9-19-3/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13+,16-/m1/s1	XJHVRUWFSLOUIR-DVOMOZLQSA-N	335.220891818							108614
BRD-K69147598	LSM-20015		44504156	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28+/m1/s1	WWNAWZZZIRHUSD-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)Nc4ccccc4)cc3CC1=O	BroadT	BRD-K69147598	BRD-K69147598-001-01-8	Broad Institute of MIT and Harvard	BRD-K69147598			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28+/m1/s1	WWNAWZZZIRHUSD-CJYOKPGZSA-N	598.22613377							108615
BRD-K54362440	LSM-20016		44491525	InChI=1S/C22H35N3O5S/c1-15-11-25(16(2)14-26)22(27)10-18-9-19(23-31(4,28)29)7-8-20(18)30-21(15)13-24(3)12-17-5-6-17/h7-9,15-17,21,23,26H,5-6,10-14H2,1-4H3/t15-,16+,21+/m0/s1	LKTOUOMEFKMKTF-GCKMJXCFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K54362440	BRD-K54362440-001-01-0	Broad Institute of MIT and Harvard	BRD-K54362440			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C22H35N3O5S/c1-15-11-25(16(2)14-26)22(27)10-18-9-19(23-31(4,28)29)7-8-20(18)30-21(15)13-24(3)12-17-5-6-17/h7-9,15-17,21,23,26H,5-6,10-14H2,1-4H3/t15-,16+,21+/m0/s1	LKTOUOMEFKMKTF-GCKMJXCFSA-N	453.22974194							108616
BRD-K16966765	LSM-20017		44491571	InChI=1S/C32H37F3N4O5/c1-20-17-39(21(2)19-40)30(42)16-23-15-24(36-29(41)13-14-32(33,34)35)11-12-27(23)44-28(20)18-38(3)31(43)37-26-10-6-8-22-7-4-5-9-25(22)26/h4-12,15,20-21,28,40H,13-14,16-19H2,1-3H3,(H,36,41)(H,37,43)/t20-,21+,28+/m1/s1	QFRXUVVOSLWYNG-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)CCC(F)(F)F)cc4CC1=O	BroadT	BRD-K16966765	BRD-K16966765-001-01-2	Broad Institute of MIT and Harvard	BRD-K16966765			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C32H37F3N4O5/c1-20-17-39(21(2)19-40)30(42)16-23-15-24(36-29(41)13-14-32(33,34)35)11-12-27(23)44-28(20)18-38(3)31(43)37-26-10-6-8-22-7-4-5-9-25(22)26/h4-12,15,20-21,28,40H,13-14,16-19H2,1-3H3,(H,36,41)(H,37,43)/t20-,21+,28+/m1/s1	QFRXUVVOSLWYNG-GGJMMHKRSA-N	614.271604924							108617
BRD-K12440228	LSM-20018		54613806	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m1/s1	WWNAWZZZIRHUSD-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)Nc4ccccc4)cc3CC1=O	BroadT	BRD-K12440228	BRD-K12440228-001-01-3	Broad Institute of MIT and Harvard	BRD-K12440228			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m1/s1	WWNAWZZZIRHUSD-GGJMMHKRSA-N	598.22613377							108618
BRD-K95114614	LSM-20019		44490775	InChI=1S/C28H34F3N5O5S/c1-18-12-36(19(2)16-37)27(38)22-6-5-7-23(33-42(39,40)25-15-35(4)17-32-25)26(22)41-24(18)14-34(3)13-20-8-10-21(11-9-20)28(29,30)31/h5-11,15,17-19,24,33,37H,12-14,16H2,1-4H3/t18-,19-,24-/m1/s1	DXKOHZBEBBERNQ-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3c(NS(=O)(=O)c4cn(C)cn4)cccc3C1=O	BroadT	BRD-K95114614	BRD-K95114614-001-01-6	Broad Institute of MIT and Harvard	BRD-K95114614			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C1=O	InChI=1S/C28H34F3N5O5S/c1-18-12-36(19(2)16-37)27(38)22-6-5-7-23(33-42(39,40)25-15-35(4)17-32-25)26(22)41-24(18)14-34(3)13-20-8-10-21(11-9-20)28(29,30)31/h5-11,15,17-19,24,33,37H,12-14,16H2,1-4H3/t18-,19-,24-/m1/s1	DXKOHZBEBBERNQ-KHCICDEESA-N	609.223274528							108619
BRD-K33016067	LSM-20020		44491889	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)16-7-6-8-17(20(16)31-18(12)9-23-5)24-22(30)25-19-14(3)26-32-15(19)4/h6-8,12-13,18,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13+,18-/m0/s1	MPDMLCBONFVZSW-JCGVRSQUSA-N	CNC[C@@H]1Oc2c(NC(=O)Nc3c(C)onc3C)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K33016067	BRD-K33016067-001-01-0	Broad Institute of MIT and Harvard	BRD-K33016067			CNC[C@@H]1Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)16-7-6-8-17(20(16)31-18(12)9-23-5)24-22(30)25-19-14(3)26-32-15(19)4/h6-8,12-13,18,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13+,18-/m0/s1	MPDMLCBONFVZSW-JCGVRSQUSA-N	445.232519142							108620
BRD-K08220319	LSM-20021		44496338	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18+,23-/m1/s1	ZIGDOLRJGHLEBT-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K08220319	BRD-K08220319-001-01-5	Broad Institute of MIT and Harvard	BRD-K08220319			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18+,23-/m1/s1	ZIGDOLRJGHLEBT-IEGUWTFLSA-N	490.224990918							108621
CHEMBL2141857	LSM-20022	BRD-K90858591, SID85808259	44501199	InChI=1S/C28H35Cl2N5O5S/c1-18-12-35(19(2)16-36)28(37)11-21-10-22(32-41(38,39)27-15-34(4)17-31-27)6-8-25(21)40-26(18)14-33(3)13-20-5-7-23(29)24(30)9-20/h5-10,15,17-19,26,32,36H,11-14,16H2,1-4H3/t18-,19-,26-/m1/s1	VWQPHETXZDMYNJ-LJKQEARRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NS(=O)(=O)c4cn(C)cn4)cc3CC1=O	BroadT	BRD-K90858591	BRD-K90858591-001-01-0	Broad Institute of MIT and Harvard	BRD-K90858591			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC1=O	InChI=1S/C28H35Cl2N5O5S/c1-18-12-35(19(2)16-36)28(37)11-21-10-22(32-41(38,39)27-15-34(4)17-31-27)6-8-25(21)40-26(18)14-33(3)13-20-5-7-23(29)24(30)9-20/h5-10,15,17-19,26,32,36H,11-14,16H2,1-4H3/t18-,19-,26-/m1/s1	VWQPHETXZDMYNJ-LJKQEARRSA-N	623.17359538							108622
BRD-K02624724	LSM-20023		44503281	InChI=1S/C24H38N4O4/c1-16-14-28(17(2)15-29)23(30)12-18-11-20(9-10-21(18)32-22(16)13-25-3)27-24(31)26-19-7-5-4-6-8-19/h9-11,16-17,19,22,25,29H,4-8,12-15H2,1-3H3,(H2,26,27,31)/t16-,17-,22+/m1/s1	UULCDSMPFJBLQO-YVHKJVDXSA-N	CNC[C@@H]1Oc2ccc(NC(=O)NC3CCCCC3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K02624724	BRD-K02624724-001-01-3	Broad Institute of MIT and Harvard	BRD-K02624724			CNC[C@@H]1Oc2ccc(NC(=O)NC3CCCCC3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H38N4O4/c1-16-14-28(17(2)15-29)23(30)12-18-11-20(9-10-21(18)32-22(16)13-25-3)27-24(31)26-19-7-5-4-6-8-19/h9-11,16-17,19,22,25,29H,4-8,12-15H2,1-3H3,(H2,26,27,31)/t16-,17-,22+/m1/s1	UULCDSMPFJBLQO-YVHKJVDXSA-N	446.289305736							108623
BRD-K26552461	LSM-20024		44483901	InChI=1S/C25H38N4O5/c1-15(2)26-25(33)28(5)13-22-16(3)12-29(17(4)14-30)23(31)11-19-10-20(8-9-21(19)34-22)27-24(32)18-6-7-18/h8-10,15-18,22,30H,6-7,11-14H2,1-5H3,(H,26,33)(H,27,32)/t16-,17-,22-/m1/s1	DCTUMTORVFHGKV-DRSNIGMVSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K26552461	BRD-K26552461-001-01-5	Broad Institute of MIT and Harvard	BRD-K26552461			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C25H38N4O5/c1-15(2)26-25(33)28(5)13-22-16(3)12-29(17(4)14-30)23(31)11-19-10-20(8-9-21(19)34-22)27-24(32)18-6-7-18/h8-10,15-18,22,30H,6-7,11-14H2,1-5H3,(H,26,33)(H,27,32)/t16-,17-,22-/m1/s1	DCTUMTORVFHGKV-DRSNIGMVSA-N	474.284220356							108624
BRD-K01922054	LSM-20025		44484360	InChI=1S/C20H29N5O5S/c1-13-9-25(14(2)11-26)20(27)15-6-5-7-16(19(15)30-17(13)8-21-3)23-31(28,29)18-10-24(4)12-22-18/h5-7,10,12-14,17,21,23,26H,8-9,11H2,1-4H3/t13-,14+,17+/m0/s1	KOTZITAVGRXIOH-JJRVBVJISA-N	CNC[C@H]1Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K01922054	BRD-K01922054-001-01-2	Broad Institute of MIT and Harvard	BRD-K01922054			CNC[C@H]1Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C20H29N5O5S/c1-13-9-25(14(2)11-26)20(27)15-6-5-7-16(19(15)30-17(13)8-21-3)23-31(28,29)18-10-24(4)12-22-18/h5-7,10,12-14,17,21,23,26H,8-9,11H2,1-4H3/t13-,14+,17+/m0/s1	KOTZITAVGRXIOH-JJRVBVJISA-N	451.188939768							108625
BRD-K62202988	LSM-20026		44499409	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15-,21-/m1/s1	LUEPMRNQGZCFGP-VTJXTGGHSA-N	CNC[C@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K62202988	BRD-K62202988-001-01-6	Broad Institute of MIT and Harvard	BRD-K62202988			CNC[C@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15-,21-/m1/s1	LUEPMRNQGZCFGP-VTJXTGGHSA-N	470.21653472							108626
BRD-K60517939	LSM-20027		44497916	InChI=1S/C28H31Cl2N5O4/c1-17-13-35(18(2)16-36)28(38)20-5-4-6-23(33-27(37)24-12-31-9-10-32-24)26(20)39-25(17)15-34(3)14-19-7-8-21(29)22(30)11-19/h4-12,17-18,25,36H,13-16H2,1-3H3,(H,33,37)/t17-,18+,25-/m0/s1	KGMOSJADCSKDLW-ATLLOTDBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K60517939	BRD-K60517939-001-01-9	Broad Institute of MIT and Harvard	BRD-K60517939			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H31Cl2N5O4/c1-17-13-35(18(2)16-36)28(38)20-5-4-6-23(33-27(37)24-12-31-9-10-32-24)26(20)39-25(17)15-34(3)14-19-7-8-21(29)22(30)11-19/h4-12,17-18,25,36H,13-16H2,1-3H3,(H,33,37)/t17-,18+,25-/m0/s1	KGMOSJADCSKDLW-ATLLOTDBSA-N	571.175309942							108627
BRD-K09261031	LSM-20028		44498005	InChI=1S/C30H36N4O6S/c1-20-13-15-24(16-14-20)41(38,39)33(4)18-27-21(2)17-34(22(3)19-35)29(36)25-11-8-12-26(28(25)40-27)32-30(37)31-23-9-6-5-7-10-23/h5-16,21-22,27,35H,17-19H2,1-4H3,(H2,31,32,37)/t21-,22-,27-/m1/s1	KABIQBXSOPPDGJ-VHFRWLAGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3c(NC(=O)Nc4ccccc4)cccc3C1=O	BroadT	BRD-K09261031	BRD-K09261031-001-01-5	Broad Institute of MIT and Harvard	BRD-K09261031			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	InChI=1S/C30H36N4O6S/c1-20-13-15-24(16-14-20)41(38,39)33(4)18-27-21(2)17-34(22(3)19-35)29(36)25-11-8-12-26(28(25)40-27)32-30(37)31-23-9-6-5-7-10-23/h5-16,21-22,27,35H,17-19H2,1-4H3,(H2,31,32,37)/t21-,22-,27-/m1/s1	KABIQBXSOPPDGJ-VHFRWLAGSA-N	580.235555602							108628
BRD-K14431723	LSM-20029		44488105	InChI=1S/C29H37N3O6/c1-18-13-32(19(2)16-33)28(34)12-22-11-23(30-29(35)21-5-6-21)7-9-24(22)38-27(18)15-31(3)14-20-4-8-25-26(10-20)37-17-36-25/h4,7-11,18-19,21,27,33H,5-6,12-17H2,1-3H3,(H,30,35)/t18-,19-,27-/m0/s1	WXJCYEGRNWVSCE-BATDWUPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)C5CC5)cc4CC1=O	BroadT	BRD-K14431723	BRD-K14431723-001-01-0	Broad Institute of MIT and Harvard	BRD-K14431723			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)C3CC3)cc2CC1=O	InChI=1S/C29H37N3O6/c1-18-13-32(19(2)16-33)28(34)12-22-11-23(30-29(35)21-5-6-21)7-9-24(22)38-27(18)15-31(3)14-20-4-8-25-26(10-20)37-17-36-25/h4,7-11,18-19,21,27,33H,5-6,12-17H2,1-3H3,(H,30,35)/t18-,19-,27-/m0/s1	WXJCYEGRNWVSCE-BATDWUPUSA-N	523.268235934							108629
BRD-K76661445	LSM-20030		44617327	InChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20+,25+/m0/s1	LNIIROWVVFKABQ-WZOHSFFVSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K76661445	BRD-K76661445-001-01-4	Broad Institute of MIT and Harvard	BRD-K76661445			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20+,25+/m0/s1	LNIIROWVVFKABQ-WZOHSFFVSA-N	546.251205666							108630
BRD-K35142716	LSM-20031		44498774	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)23-12-9-13-24(30-29(37)31-26-20(3)32-39-21(26)4)27(23)38-25(18)16-33(5)15-22-10-7-6-8-11-22/h9,12-13,18-19,22,25,35H,6-8,10-11,14-17H2,1-5H3,(H2,30,31,37)/t18-,19+,25-/m0/s1	SKOKKYKZTHPAKC-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)Nc4c(C)onc4C)cccc3C1=O	BroadT	BRD-K35142716	BRD-K35142716-001-01-7	Broad Institute of MIT and Harvard	BRD-K35142716			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C1=O	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)23-12-9-13-24(30-29(37)31-26-20(3)32-39-21(26)4)27(23)38-25(18)16-33(5)15-22-10-7-6-8-11-22/h9,12-13,18-19,22,25,35H,6-8,10-11,14-17H2,1-5H3,(H2,30,31,37)/t18-,19+,25-/m0/s1	SKOKKYKZTHPAKC-CEYNDMKZSA-N	541.326419526							108631
BRD-K66963756	LSM-20032		44489255	InChI=1S/C33H39N3O6/c1-22-18-36(23(2)21-37)32(39)17-27-16-28(34-31(38)15-24-7-5-4-6-8-24)13-14-29(27)42-30(22)20-35(3)19-25-9-11-26(12-10-25)33(40)41/h4-14,16,22-23,30,37H,15,17-21H2,1-3H3,(H,34,38)(H,40,41)/t22-,23-,30-/m1/s1	VWLXYKZHRWDJAR-IQLGONJTSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K66963756	BRD-K66963756-001-01-9	Broad Institute of MIT and Harvard	BRD-K66963756			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C33H39N3O6/c1-22-18-36(23(2)21-37)32(39)17-27-16-28(34-31(38)15-24-7-5-4-6-8-24)13-14-29(27)42-30(22)20-35(3)19-25-9-11-26(12-10-25)33(40)41/h4-14,16,22-23,30,37H,15,17-21H2,1-3H3,(H,34,38)(H,40,41)/t22-,23-,30-/m1/s1	VWLXYKZHRWDJAR-IQLGONJTSA-N	573.283885998							131253
BRD-K67586245	LSM-20033		44492007	InChI=1S/C25H38N4O5/c1-15(2)26-25(33)28(5)13-22-16(3)12-29(17(4)14-30)23(31)11-19-10-20(8-9-21(19)34-22)27-24(32)18-6-7-18/h8-10,15-18,22,30H,6-7,11-14H2,1-5H3,(H,26,33)(H,27,32)/t16-,17-,22+/m1/s1	DCTUMTORVFHGKV-YVHKJVDXSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K67586245	BRD-K67586245-001-01-6	Broad Institute of MIT and Harvard	BRD-K67586245			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C25H38N4O5/c1-15(2)26-25(33)28(5)13-22-16(3)12-29(17(4)14-30)23(31)11-19-10-20(8-9-21(19)34-22)27-24(32)18-6-7-18/h8-10,15-18,22,30H,6-7,11-14H2,1-5H3,(H,26,33)(H,27,32)/t16-,17-,22+/m1/s1	DCTUMTORVFHGKV-YVHKJVDXSA-N	474.284220356							108634
MLS002474273	LSM-20034	BRD-K98758203, SID85201847	44202926	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15+,20+/m0/s1	RAWZADNKXQBMBA-BXTJHSDWSA-N	CNC[C@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K98758203	BRD-K98758203-001-02-2	Broad Institute of MIT and Harvard	BRD-K98758203			CNC[C@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15+,20+/m0/s1	RAWZADNKXQBMBA-BXTJHSDWSA-N	465.173369916							108635
BRD-K20454972-001-01-2	LSM-20035	BRD-K20454972	44491983	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14-,18+/m1/s1	WYKJOBISBUCKND-LBTNJELSSA-N	CNC[C@@H]1Oc2ccc(cc2CC(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K20454972	BRD-K20454972-001-01-2	Broad Institute of MIT and Harvard	BRD-K20454972			CNC[C@@H]1Oc2ccc(cc2CC(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14-,18+/m1/s1	WYKJOBISBUCKND-LBTNJELSSA-N	349.236541882							108636
BRD-K22189231	LSM-20036		44495569	InChI=1S/C21H31N7O4/c1-14-9-28(15(2)12-29)21(31)8-16-7-17(23-20(30)11-27-13-22-24-25-27)5-6-18(16)32-19(14)10-26(3)4/h5-7,13-15,19,29H,8-12H2,1-4H3,(H,23,30)/t14-,15+,19+/m1/s1	FEGVFSOLSHLDDV-VCBZYWHSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	BroadT	BRD-K22189231	BRD-K22189231-001-01-9	Broad Institute of MIT and Harvard	BRD-K22189231			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	InChI=1S/C21H31N7O4/c1-14-9-28(15(2)12-29)21(31)8-16-7-17(23-20(30)11-27-13-22-24-25-27)5-6-18(16)32-19(14)10-26(3)4/h5-7,13-15,19,29H,8-12H2,1-4H3,(H,23,30)/t14-,15+,19+/m1/s1	FEGVFSOLSHLDDV-VCBZYWHSSA-N	445.243752542							108637
BRD-K88156935	LSM-20037		44494858	InChI=1S/C25H33FN4O4/c1-16-13-30(17(2)15-31)24(32)21-12-20(28(3)4)10-11-22(21)34-23(16)14-29(5)25(33)27-19-8-6-18(26)7-9-19/h6-12,16-17,23,31H,13-15H2,1-5H3,(H,27,33)/t16-,17-,23-/m0/s1	FXKMHYTYNRWQSP-QQMNAOGKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K88156935	BRD-K88156935-001-01-8	Broad Institute of MIT and Harvard	BRD-K88156935			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H33FN4O4/c1-16-13-30(17(2)15-31)24(32)21-12-20(28(3)4)10-11-22(21)34-23(16)14-29(5)25(33)27-19-8-6-18(26)7-9-19/h6-12,16-17,23,31H,13-15H2,1-5H3,(H,27,33)/t16-,17-,23-/m0/s1	FXKMHYTYNRWQSP-QQMNAOGKSA-N	472.248583776							108638
BRD-K11105500	LSM-20038		44491981	InChI=1S/C22H35N3O5S/c1-15-11-25(16(2)14-26)22(27)10-18-9-19(23-31(4,28)29)7-8-20(18)30-21(15)13-24(3)12-17-5-6-17/h7-9,15-17,21,23,26H,5-6,10-14H2,1-4H3/t15-,16-,21+/m1/s1	LKTOUOMEFKMKTF-ZOCZFRKYSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K11105500	BRD-K11105500-001-01-2	Broad Institute of MIT and Harvard	BRD-K11105500			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C22H35N3O5S/c1-15-11-25(16(2)14-26)22(27)10-18-9-19(23-31(4,28)29)7-8-20(18)30-21(15)13-24(3)12-17-5-6-17/h7-9,15-17,21,23,26H,5-6,10-14H2,1-4H3/t15-,16-,21+/m1/s1	LKTOUOMEFKMKTF-ZOCZFRKYSA-N	453.22974194							108639
BRD-K84775364	LSM-20039		44495920	InChI=1S/C35H45N5O5/c1-23-20-40(24(2)22-41)33(42)19-26-18-28(37-34(43)36-27-12-5-4-6-13-27)16-17-31(26)45-32(23)21-39(3)35(44)38-30-15-9-11-25-10-7-8-14-29(25)30/h7-11,14-18,23-24,27,32,41H,4-6,12-13,19-22H2,1-3H3,(H,38,44)(H2,36,37,43)/t23-,24-,32+/m1/s1	ICEMUJZXENLAMO-LFQYBHLRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)NC5CCCCC5)cc4CC1=O	BroadT	BRD-K84775364	BRD-K84775364-001-01-9	Broad Institute of MIT and Harvard	BRD-K84775364			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)NC3CCCCC3)cc2CC1=O	InChI=1S/C35H45N5O5/c1-23-20-40(24(2)22-41)33(42)19-26-18-28(37-34(43)36-27-12-5-4-6-13-27)16-17-31(26)45-32(23)21-39(3)35(44)38-30-15-9-11-25-10-7-8-14-29(25)30/h7-11,14-18,23-24,27,32,41H,4-6,12-13,19-22H2,1-3H3,(H,38,44)(H2,36,37,43)/t23-,24-,32+/m1/s1	ICEMUJZXENLAMO-LFQYBHLRSA-N	615.342069590001							108640
BRD-K83946740	LSM-20040		44497700	InChI=1S/C27H35N3O6S/c1-18-15-30(19(2)17-31)26(32)14-21-13-22(28-27(33)20-9-10-20)11-12-24(21)36-25(18)16-29(3)37(34,35)23-7-5-4-6-8-23/h4-8,11-13,18-20,25,31H,9-10,14-17H2,1-3H3,(H,28,33)/t18-,19-,25+/m1/s1	MWSPHKIBVREWDU-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(NC(=O)C4CC4)cc3CC1=O	BroadT	BRD-K83946740	BRD-K83946740-001-01-2	Broad Institute of MIT and Harvard	BRD-K83946740			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(NC(=O)C3CC3)cc2CC1=O	InChI=1S/C27H35N3O6S/c1-18-15-30(19(2)17-31)26(32)14-21-13-22(28-27(33)20-9-10-20)11-12-24(21)36-25(18)16-29(3)37(34,35)23-7-5-4-6-8-23/h4-8,11-13,18-20,25,31H,9-10,14-17H2,1-3H3,(H,28,33)/t18-,19-,25+/m1/s1	MWSPHKIBVREWDU-RRQZXNHTSA-N	529.22465656							108641
BRD-K52157065	LSM-20041		44499472	InChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21+,26+/m1/s1	QPEXUVZRKHXLPB-SWYRRKHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)C4CCOCC4)cccc3C1=O	BroadT	BRD-K52157065	BRD-K52157065-001-01-0	Broad Institute of MIT and Harvard	BRD-K52157065			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21+,26+/m1/s1	QPEXUVZRKHXLPB-SWYRRKHMSA-N	515.33592157							108642
MLS002474451	LSM-20042	BRD-K74267000, SID85201593	44202677	InChI=1S/C25H36F3N3O4/c1-16-12-31(17(2)15-32)24(34)11-19-10-20(29-23(33)8-9-25(26,27)28)6-7-21(19)35-22(16)14-30(3)13-18-4-5-18/h6-7,10,16-18,22,32H,4-5,8-9,11-15H2,1-3H3,(H,29,33)/t16-,17-,22-/m0/s1	OWJOIEFDHRCHNY-HOIFWPIMSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC1=O	BroadT	BRD-K74267000	BRD-K74267000-001-01-9	Broad Institute of MIT and Harvard	BRD-K74267000			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C25H36F3N3O4/c1-16-12-31(17(2)15-32)24(34)11-19-10-20(29-23(33)8-9-25(26,27)28)6-7-21(19)35-22(16)14-30(3)13-18-4-5-18/h6-7,10,16-18,22,32H,4-5,8-9,11-15H2,1-3H3,(H,29,33)/t16-,17-,22-/m0/s1	OWJOIEFDHRCHNY-HOIFWPIMSA-N	499.265791262							108643
BRD-K80816131	LSM-20043		44503802	InChI=1S/C23H37N3O3/c1-16-12-26(17(2)15-27)23(28)11-19-10-20(24(3)4)8-9-21(19)29-22(16)14-25(5)13-18-6-7-18/h8-10,16-18,22,27H,6-7,11-15H2,1-5H3/t16-,17-,22+/m0/s1	DVEIBRZUURAMSY-PNLZDCPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K80816131	BRD-K80816131-001-01-7	Broad Institute of MIT and Harvard	BRD-K80816131			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C23H37N3O3/c1-16-12-26(17(2)15-27)23(28)11-19-10-20(24(3)4)8-9-21(19)29-22(16)14-25(5)13-18-6-7-18/h8-10,16-18,22,27H,6-7,11-15H2,1-5H3/t16-,17-,22+/m0/s1	DVEIBRZUURAMSY-PNLZDCPESA-N	403.283492074							108644
BRD-K24167233	LSM-20044		44495934	InChI=1S/C28H34N4O4/c1-18-16-32(19(2)17-33)27(34)14-21-13-22(11-12-25(21)36-26(18)15-29-3)30-28(35)31-24-10-6-8-20-7-4-5-9-23(20)24/h4-13,18-19,26,29,33H,14-17H2,1-3H3,(H2,30,31,35)/t18-,19-,26+/m0/s1	KOOMWTSRVMNQAA-LZJCXSABSA-N	CNC[C@H]1Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K24167233	BRD-K24167233-001-01-1	Broad Institute of MIT and Harvard	BRD-K24167233			CNC[C@H]1Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H34N4O4/c1-18-16-32(19(2)17-33)27(34)14-21-13-22(11-12-25(21)36-26(18)15-29-3)30-28(35)31-24-10-6-8-20-7-4-5-9-23(20)24/h4-13,18-19,26,29,33H,14-17H2,1-3H3,(H2,30,31,35)/t18-,19-,26+/m0/s1	KOOMWTSRVMNQAA-LZJCXSABSA-N	490.258005608							108645
BRD-K34360192	LSM-20045		44495419	InChI=1S/C18H29N3O5S/c1-12-10-21(13(2)11-22)18(23)8-14-7-15(20-27(4,24)25)5-6-16(14)26-17(12)9-19-3/h5-7,12-13,17,19-20,22H,8-11H2,1-4H3/t12-,13-,17+/m0/s1	XOTYHNIEAMYTDW-GDZNZVCISA-N	CNC[C@H]1Oc2ccc(NS(=O)(=O)C)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K34360192	BRD-K34360192-001-01-9	Broad Institute of MIT and Harvard	BRD-K34360192			CNC[C@H]1Oc2ccc(NS(C)(=O)=O)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C18H29N3O5S/c1-12-10-21(13(2)11-22)18(23)8-14-7-15(20-27(4,24)25)5-6-16(14)26-17(12)9-19-3/h5-7,12-13,17,19-20,22H,8-11H2,1-4H3/t12-,13-,17+/m0/s1	XOTYHNIEAMYTDW-GDZNZVCISA-N	399.182791748							108646
BRD-K66993610	LSM-20046		44485605	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14+,18-/m1/s1	TWHSADQACYCNBZ-QWQRMKEZSA-N	CNC[C@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K66993610	BRD-K66993610-001-01-2	Broad Institute of MIT and Harvard	BRD-K66993610			CNC[C@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14+,18-/m1/s1	TWHSADQACYCNBZ-QWQRMKEZSA-N	413.206304394							108647
BRD-K91361836	LSM-20047		44493038	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23-,29+/m1/s1	JWXWRTLQHUTWJR-SGQNLQFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K91361836	BRD-K91361836-001-01-9	Broad Institute of MIT and Harvard	BRD-K91361836			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23-,29+/m1/s1	JWXWRTLQHUTWJR-SGQNLQFHSA-N	564.331170548							108648
BRD-K11705648	LSM-20048		54613812	InChI=1S/C23H37N3O3/c1-16-12-26(17(2)15-27)23(28)11-19-10-20(24(3)4)8-9-21(19)29-22(16)14-25(5)13-18-6-7-18/h8-10,16-18,22,27H,6-7,11-15H2,1-5H3/t16-,17+,22+/m0/s1	DVEIBRZUURAMSY-GSHUGGBRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K11705648	BRD-K11705648-001-01-2	Broad Institute of MIT and Harvard	BRD-K11705648			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C23H37N3O3/c1-16-12-26(17(2)15-27)23(28)11-19-10-20(24(3)4)8-9-21(19)29-22(16)14-25(5)13-18-6-7-18/h8-10,16-18,22,27H,6-7,11-15H2,1-5H3/t16-,17+,22+/m0/s1	DVEIBRZUURAMSY-GSHUGGBRSA-N	403.283492074							108649
BRD-K01894374	LSM-20049		44483883	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14-,18-/m1/s1	WYKJOBISBUCKND-HBUWYVDXSA-N	CNC[C@H]1Oc2ccc(cc2CC(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K01894374	BRD-K01894374-001-01-6	Broad Institute of MIT and Harvard	BRD-K01894374			CNC[C@H]1Oc2ccc(cc2CC(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14-,18-/m1/s1	WYKJOBISBUCKND-HBUWYVDXSA-N	349.236541882							108650
BRD-K51399866	LSM-20050		44499416	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15-,20-/m1/s1	RAWZADNKXQBMBA-STXHMFSFSA-N	CNC[C@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K51399866	BRD-K51399866-001-01-0	Broad Institute of MIT and Harvard	BRD-K51399866			CNC[C@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15-,20-/m1/s1	RAWZADNKXQBMBA-STXHMFSFSA-N	465.173369916							108651
BRD-K37131263	LSM-20051		44489668	InChI=1S/C33H35N5O5/c1-21-18-38(22(2)20-39)32(41)26-11-7-13-28(35-31(40)24-14-16-34-17-15-24)30(26)43-29(21)19-37(3)33(42)36-27-12-6-9-23-8-4-5-10-25(23)27/h4-17,21-22,29,39H,18-20H2,1-3H3,(H,35,40)(H,36,42)/t21-,22+,29+/m0/s1	UCPVSNSDYZNCRX-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)c5ccncc5)cccc4C1=O	BroadT	BRD-K37131263	BRD-K37131263-001-01-5	Broad Institute of MIT and Harvard	BRD-K37131263			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C33H35N5O5/c1-21-18-38(22(2)20-39)32(41)26-11-7-13-28(35-31(40)24-14-16-34-17-15-24)30(26)43-29(21)19-37(3)33(42)36-27-12-6-9-23-8-4-5-10-25(23)27/h4-17,21-22,29,39H,18-20H2,1-3H3,(H,35,40)(H,36,42)/t21-,22+,29+/m0/s1	UCPVSNSDYZNCRX-DKGMKSHISA-N	581.26381927							108652
BRD-K38980456	LSM-20052		44617959	InChI=1S/C32H45N5O6/c1-21-18-37(22(2)20-38)30(39)17-23-16-26(34-31(40)33-24-8-6-5-7-9-24)12-15-28(23)43-29(21)19-36(3)32(41)35-25-10-13-27(42-4)14-11-25/h10-16,21-22,24,29,38H,5-9,17-20H2,1-4H3,(H,35,41)(H2,33,34,40)/t21-,22+,29+/m1/s1	SMGQOPDVSHJVMI-BXOOBUKZSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)NC4CCCCC4)cc3CC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K38980456	BRD-K38980456-001-01-1	Broad Institute of MIT and Harvard	BRD-K38980456			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)NC4CCCCC4)cc3CC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C32H45N5O6/c1-21-18-37(22(2)20-38)30(39)17-23-16-26(34-31(40)33-24-8-6-5-7-9-24)12-15-28(23)43-29(21)19-36(3)32(41)35-25-10-13-27(42-4)14-11-25/h10-16,21-22,24,29,38H,5-9,17-20H2,1-4H3,(H,35,41)(H2,33,34,40)/t21-,22+,29+/m1/s1	SMGQOPDVSHJVMI-BXOOBUKZSA-N	595.33698421							108653
BRD-K07605157-001-01-3	LSM-20053	BRD-K07605157	44488021	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15-,19+/m0/s1	YQJJHWKDDJGBPX-YZVOILCLSA-N	CNC[C@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K07605157	BRD-K07605157-001-01-3	Broad Institute of MIT and Harvard	BRD-K07605157			CNC[C@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15-,19+/m0/s1	YQJJHWKDDJGBPX-YZVOILCLSA-N	468.183126106							108654
BRD-K11247495	LSM-20054		44618596	InChI=1S/C26H37N3O6S/c1-18-15-29(19(2)17-30)26(31)14-20-13-21(27(3)4)7-12-24(20)35-25(18)16-28(5)36(32,33)23-10-8-22(34-6)9-11-23/h7-13,18-19,25,30H,14-17H2,1-6H3/t18-,19+,25+/m1/s1	JDKUWABUTZZKAJ-WYEJZRMESA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3ccc(cc3CC(=O)N(C[C@H]2C)[C@@H](C)CO)N(C)C	BroadT	BRD-K11247495	BRD-K11247495-001-01-9	Broad Institute of MIT and Harvard	BRD-K11247495			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2ccc(cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C26H37N3O6S/c1-18-15-29(19(2)17-30)26(31)14-20-13-21(27(3)4)7-12-24(20)35-25(18)16-28(5)36(32,33)23-10-8-22(34-6)9-11-23/h7-13,18-19,25,30H,14-17H2,1-6H3/t18-,19+,25+/m1/s1	JDKUWABUTZZKAJ-WYEJZRMESA-N	519.240306624							108655
BRD-K61168987	LSM-20055		54613816	InChI=1S/C29H41FN4O6S/c1-20-17-34(21(2)19-35)29(37)16-22-15-24(31-28(36)7-6-14-32(3)4)10-13-26(22)40-27(20)18-33(5)41(38,39)25-11-8-23(30)9-12-25/h8-13,15,20-21,27,35H,6-7,14,16-19H2,1-5H3,(H,31,36)/t20-,21+,27+/m0/s1	QROKXOKLOVAMIJ-FYQCMVGJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)CCCN(C)C)cc3CC1=O	BroadT	BRD-K61168987	BRD-K61168987-001-01-1	Broad Institute of MIT and Harvard	BRD-K61168987			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)CCCN(C)C)cc2CC1=O	InChI=1S/C29H41FN4O6S/c1-20-17-34(21(2)19-35)29(37)16-22-15-24(31-28(36)7-6-14-32(3)4)10-13-26(22)40-27(20)18-33(5)41(38,39)25-11-8-23(30)9-12-25/h8-13,15,20-21,27,35H,6-7,14,16-19H2,1-5H3,(H,31,36)/t20-,21+,27+/m0/s1	QROKXOKLOVAMIJ-FYQCMVGJSA-N	592.273083962							108656
BRD-K99034771	LSM-20056		44483853	InChI=1S/C29H37N3O6/c1-18-13-32(19(2)16-33)28(34)12-22-11-23(30-29(35)21-5-6-21)7-9-24(22)38-27(18)15-31(3)14-20-4-8-25-26(10-20)37-17-36-25/h4,7-11,18-19,21,27,33H,5-6,12-17H2,1-3H3,(H,30,35)/t18-,19+,27-/m1/s1	WXJCYEGRNWVSCE-VXLXPWSCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)C5CC5)cc4CC1=O	BroadT	BRD-K99034771	BRD-K99034771-001-01-1	Broad Institute of MIT and Harvard	BRD-K99034771			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)C3CC3)cc2CC1=O	InChI=1S/C29H37N3O6/c1-18-13-32(19(2)16-33)28(34)12-22-11-23(30-29(35)21-5-6-21)7-9-24(22)38-27(18)15-31(3)14-20-4-8-25-26(10-20)37-17-36-25/h4,7-11,18-19,21,27,33H,5-6,12-17H2,1-3H3,(H,30,35)/t18-,19+,27-/m1/s1	WXJCYEGRNWVSCE-VXLXPWSCSA-N	523.268235934							108657
CHEMBL2360857	LSM-20057	SID87218817, BRD-K94775036	44506594	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,29-/m1/s1	SREUWAAPQJIJAQ-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K94775036	BRD-K94775036-001-01-5	Broad Institute of MIT and Harvard	BRD-K94775036			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,29-/m1/s1	SREUWAAPQJIJAQ-IEOSBIPESA-N	559.315854842							108658
BRD-K43341819	LSM-20058		44495376	InChI=1S/C35H43N3O6/c1-24-20-38(25(2)23-39)35(41)30-10-7-11-31(36-34(40)27-16-18-42-19-17-27)33(30)44-32(24)22-37(3)21-26-12-14-29(15-13-26)43-28-8-5-4-6-9-28/h4-15,24-25,27,32,39H,16-23H2,1-3H3,(H,36,40)/t24-,25-,32-/m1/s1	CCYKTEMVMBOJBS-NCLPYWGKSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K43341819	BRD-K43341819-001-01-1	Broad Institute of MIT and Harvard	BRD-K43341819			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C35H43N3O6/c1-24-20-38(25(2)23-39)35(41)30-10-7-11-31(36-34(40)27-16-18-42-19-17-27)33(30)44-32(24)22-37(3)21-26-12-14-29(15-13-26)43-28-8-5-4-6-9-28/h4-15,24-25,27,32,39H,16-23H2,1-3H3,(H,36,40)/t24-,25-,32-/m1/s1	CCYKTEMVMBOJBS-NCLPYWGKSA-N	601.315186126							108659
BRD-K22504397-001-01-9	LSM-20059	BRD-K22504397	44489180	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)27-16-10-18-29(36-33(42)35-25-13-5-4-6-14-25)31(27)44-30(22)20-38(3)34(43)37-28-17-9-12-24-11-7-8-15-26(24)28/h7-12,15-18,22-23,25,30,40H,4-6,13-14,19-21H2,1-3H3,(H,37,43)(H2,35,36,42)/t22-,23-,30+/m0/s1	DNNIAXRFSGYFCB-ZTNZZFSWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)NC5CCCCC5)cccc4C1=O	BroadT	BRD-K22504397	BRD-K22504397-001-01-9	Broad Institute of MIT and Harvard	BRD-K22504397			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)27-16-10-18-29(36-33(42)35-25-13-5-4-6-14-25)31(27)44-30(22)20-38(3)34(43)37-28-17-9-12-24-11-7-8-15-26(24)28/h7-12,15-18,22-23,25,30,40H,4-6,13-14,19-21H2,1-3H3,(H,37,43)(H2,35,36,42)/t22-,23-,30+/m0/s1	DNNIAXRFSGYFCB-ZTNZZFSWSA-N	601.326419526							108660
BRD-K44328896-001-01-3	LSM-20060	BRD-K44328896	44489219	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14+,18-/m1/s1	WYKJOBISBUCKND-QWQRMKEZSA-N	CNC[C@H]1Oc2ccc(cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K44328896	BRD-K44328896-001-01-3	Broad Institute of MIT and Harvard	BRD-K44328896			CNC[C@H]1Oc2ccc(cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14+,18-/m1/s1	WYKJOBISBUCKND-QWQRMKEZSA-N	349.236541882							108661
BRD-K75844451	LSM-20061		44619226	InChI=1S/C28H35Cl2N5O5S/c1-18-12-35(19(2)16-36)28(37)11-21-10-22(32-41(38,39)27-15-34(4)17-31-27)6-8-25(21)40-26(18)14-33(3)13-20-5-7-23(29)24(30)9-20/h5-10,15,17-19,26,32,36H,11-14,16H2,1-4H3/t18-,19+,26+/m1/s1	VWQPHETXZDMYNJ-MVYHEMRASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NS(=O)(=O)c4cn(C)cn4)cc3CC1=O	BroadT	BRD-K75844451	BRD-K75844451-001-01-8	Broad Institute of MIT and Harvard	BRD-K75844451			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC1=O	InChI=1S/C28H35Cl2N5O5S/c1-18-12-35(19(2)16-36)28(37)11-21-10-22(32-41(38,39)27-15-34(4)17-31-27)6-8-25(21)40-26(18)14-33(3)13-20-5-7-23(29)24(30)9-20/h5-10,15,17-19,26,32,36H,11-14,16H2,1-4H3/t18-,19+,26+/m1/s1	VWQPHETXZDMYNJ-MVYHEMRASA-N	623.17359538							108662
CHEMBL2362501	LSM-20062	BRD-K31748787, SID85799245	44492546	InChI=1S/C30H41ClN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h9-15,20-21,24,28,36H,4-8,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28-/m1/s1	XMVMBOAJKPBQKX-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3ccc(NC(=O)NC4CCCCC4)cc3CC1=O	BroadT	BRD-K31748787	BRD-K31748787-001-01-9	Broad Institute of MIT and Harvard	BRD-K31748787			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)NC3CCCCC3)cc2CC1=O	InChI=1S/C30H41ClN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h9-15,20-21,24,28,36H,4-8,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28-/m1/s1	XMVMBOAJKPBQKX-PHVLTXCSSA-N	620.243533472							108663
CHEMBL2359943	LSM-20063	BRD-K20525312, SID85805870	44498908	InChI=1S/C28H31Cl2N5O4/c1-17-13-35(18(2)16-36)28(38)20-5-4-6-23(33-27(37)24-12-31-9-10-32-24)26(20)39-25(17)15-34(3)14-19-7-8-21(29)22(30)11-19/h4-12,17-18,25,36H,13-16H2,1-3H3,(H,33,37)/t17-,18+,25+/m1/s1	KGMOSJADCSKDLW-UZEJHQAJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K20525312	BRD-K20525312-001-01-8	Broad Institute of MIT and Harvard	BRD-K20525312			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H31Cl2N5O4/c1-17-13-35(18(2)16-36)28(38)20-5-4-6-23(33-27(37)24-12-31-9-10-32-24)26(20)39-25(17)15-34(3)14-19-7-8-21(29)22(30)11-19/h4-12,17-18,25,36H,13-16H2,1-3H3,(H,33,37)/t17-,18+,25+/m1/s1	KGMOSJADCSKDLW-UZEJHQAJSA-N	571.175309942							108664
BRD-K92167240	LSM-20064		44486220	InChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16+,20-/m0/s1	HFFGMDRCIAVIES-YRNRMSPPSA-N	CNC[C@@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K92167240	BRD-K92167240-001-01-9	Broad Institute of MIT and Harvard	BRD-K92167240			CNC[C@@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16+,20-/m0/s1	HFFGMDRCIAVIES-YRNRMSPPSA-N	432.273655672							108665
BRD-K78789413	LSM-20065		44499938	InChI=1S/C30H41FN4O4/c1-20-16-35(21(2)19-36)29(37)25-10-7-11-26(33-30(38)32-24-14-12-23(31)13-15-24)28(25)39-27(20)18-34(3)17-22-8-5-4-6-9-22/h7,10-15,20-22,27,36H,4-6,8-9,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,27-/m1/s1	COSGGAMFLVSIQD-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)Nc4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K78789413	BRD-K78789413-001-01-9	Broad Institute of MIT and Harvard	BRD-K78789413			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)Nc3ccc(F)cc3)cccc2C1=O	InChI=1S/C30H41FN4O4/c1-20-16-35(21(2)19-36)29(37)25-10-7-11-26(33-30(38)32-24-14-12-23(31)13-15-24)28(25)39-27(20)18-34(3)17-22-8-5-4-6-9-22/h7,10-15,20-22,27,36H,4-6,8-9,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,27-/m1/s1	COSGGAMFLVSIQD-PBDKAQRYSA-N	540.311184032							108666
BRD-K80166820	LSM-20066		44491325	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11+,14-/m1/s1	CZXYLKJVFUIZEK-UHIISALHSA-N	CNC[C@H]1Oc2c(N)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K80166820	BRD-K80166820-001-01-3	Broad Institute of MIT and Harvard	BRD-K80166820			CNC[C@H]1Oc2c(N)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11+,14-/m1/s1	CZXYLKJVFUIZEK-UHIISALHSA-N	307.18959169							108667
BRD-K70286959	LSM-20067		44504007	InChI=1S/C20H33N3O5S/c1-14-11-23(15(2)13-24)20(25)10-16-9-17(21(3)4)7-8-18(16)28-19(14)12-22(5)29(6,26)27/h7-9,14-15,19,24H,10-13H2,1-6H3/t14-,15-,19+/m0/s1	GJNVPSGZCJMKRU-YZVOILCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ccc(cc2CC1=O)N(C)C	BroadT	BRD-K70286959	BRD-K70286959-001-01-4	Broad Institute of MIT and Harvard	BRD-K70286959			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C20H33N3O5S/c1-14-11-23(15(2)13-24)20(25)10-16-9-17(21(3)4)7-8-18(16)28-19(14)12-22(5)29(6,26)27/h7-9,14-15,19,24H,10-13H2,1-6H3/t14-,15-,19+/m0/s1	GJNVPSGZCJMKRU-YZVOILCLSA-N	427.214091876							108668
BRD-K89967940	LSM-20068		44499298	InChI=1S/C30H36N4O6S/c1-20-13-15-24(16-14-20)41(38,39)33(4)18-27-21(2)17-34(22(3)19-35)29(36)25-11-8-12-26(28(25)40-27)32-30(37)31-23-9-6-5-7-10-23/h5-16,21-22,27,35H,17-19H2,1-4H3,(H2,31,32,37)/t21-,22+,27+/m0/s1	KABIQBXSOPPDGJ-OREGWCPLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3c(NC(=O)Nc4ccccc4)cccc3C1=O	BroadT	BRD-K89967940	BRD-K89967940-001-01-0	Broad Institute of MIT and Harvard	BRD-K89967940			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	InChI=1S/C30H36N4O6S/c1-20-13-15-24(16-14-20)41(38,39)33(4)18-27-21(2)17-34(22(3)19-35)29(36)25-11-8-12-26(28(25)40-27)32-30(37)31-23-9-6-5-7-10-23/h5-16,21-22,27,35H,17-19H2,1-4H3,(H2,31,32,37)/t21-,22+,27+/m0/s1	KABIQBXSOPPDGJ-OREGWCPLSA-N	580.235555602							108669
BRD-K83481256	LSM-20069		44489099	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11+,14+/m0/s1	CZXYLKJVFUIZEK-MISXGVKJSA-N	CNC[C@H]1Oc2c(N)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K83481256	BRD-K83481256-001-02-4	Broad Institute of MIT and Harvard	BRD-K83481256			CNC[C@H]1Oc2c(N)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11+,14+/m0/s1	CZXYLKJVFUIZEK-MISXGVKJSA-N	307.18959169							108670
BRD-K87815532	LSM-20070		44485191	InChI=1S/C23H33N3O5S2/c1-16-13-26(17(2)15-27)22(28)12-18-11-19(24(3)4)8-9-20(18)31-21(16)14-25(5)33(29,30)23-7-6-10-32-23/h6-11,16-17,21,27H,12-15H2,1-5H3/t16-,17+,21+/m0/s1	AXGDQZYYEHOPOR-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K87815532	BRD-K87815532-001-01-7	Broad Institute of MIT and Harvard	BRD-K87815532			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C23H33N3O5S2/c1-16-13-26(17(2)15-27)22(28)12-18-11-19(24(3)4)8-9-20(18)31-21(16)14-25(5)33(29,30)23-7-6-10-32-23/h6-11,16-17,21,27H,12-15H2,1-5H3/t16-,17+,21+/m0/s1	AXGDQZYYEHOPOR-CSODHUTKSA-N	495.186162566							108671
BRD-K35964249	LSM-20071		44495924	InChI=1S/C23H35N5O5S/c1-16-11-28(17(2)14-29)23(30)10-18-9-19(25(3)4)7-8-20(18)33-21(16)12-27(6)34(31,32)22-13-26(5)15-24-22/h7-9,13,15-17,21,29H,10-12,14H2,1-6H3/t16-,17-,21+/m1/s1	XKGXVARXDYWWSM-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K35964249	BRD-K35964249-001-01-0	Broad Institute of MIT and Harvard	BRD-K35964249			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C23H35N5O5S/c1-16-11-28(17(2)14-29)23(30)10-18-9-19(25(3)4)7-8-20(18)33-21(16)12-27(6)34(31,32)22-13-26(5)15-24-22/h7-9,13,15-17,21,29H,10-12,14H2,1-6H3/t16-,17-,21+/m1/s1	XKGXVARXDYWWSM-LZJOCLMNSA-N	493.23588996							108672
BRD-K17753765	LSM-20072		44485651	InChI=1S/C31H37N3O8S/c1-20-15-34(21(2)18-35)31(36)25-6-5-7-26(32-43(37,38)24-11-9-23(39-4)10-12-24)30(25)42-29(20)17-33(3)16-22-8-13-27-28(14-22)41-19-40-27/h5-14,20-21,29,32,35H,15-19H2,1-4H3/t20-,21-,29-/m1/s1	AELUQFUEWCFKFM-GVNDJSPXSA-N	COc1ccc(cc1)S(=O)(=O)Nc2cccc3C(=O)N(C[C@@H](C)[C@@H](CN(C)Cc4ccc5OCOc5c4)Oc23)[C@H](C)CO	BroadT	BRD-K17753765	BRD-K17753765-001-01-3	Broad Institute of MIT and Harvard	BRD-K17753765			COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1O[C@H](CN(C)Cc1ccc3OCOc3c1)[C@H](C)CN([C@H](C)CO)C2=O	InChI=1S/C31H37N3O8S/c1-20-15-34(21(2)18-35)31(36)25-6-5-7-26(32-43(37,38)24-11-9-23(39-4)10-12-24)30(25)42-29(20)17-33(3)16-22-8-13-27-28(14-22)41-19-40-27/h5-14,20-21,29,32,35H,15-19H2,1-4H3/t20-,21-,29-/m1/s1	AELUQFUEWCFKFM-GVNDJSPXSA-N	611.230135864							108673
BRD-K20373726	LSM-20073		54613809	InChI=1S/C27H33ClF3N3O6S/c1-17-14-34(18(2)16-35)26(37)13-19-12-21(32-25(36)10-11-27(29,30)31)6-9-23(19)40-24(17)15-33(3)41(38,39)22-7-4-20(28)5-8-22/h4-9,12,17-18,24,35H,10-11,13-16H2,1-3H3,(H,32,36)/t17-,18+,24+/m1/s1	BTSOZOCIIHDJJX-YTZAWJCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC1=O	BroadT	BRD-K20373726	BRD-K20373726-001-01-3	Broad Institute of MIT and Harvard	BRD-K20373726			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C27H33ClF3N3O6S/c1-17-14-34(18(2)16-35)26(37)13-19-12-21(32-25(36)10-11-27(29,30)31)6-9-23(19)40-24(17)15-33(3)41(38,39)22-7-4-20(28)5-8-22/h4-9,12,17-18,24,35H,10-11,13-16H2,1-3H3,(H,32,36)/t17-,18+,24+/m1/s1	BTSOZOCIIHDJJX-YTZAWJCFSA-N	619.173068806							108674
CHEMBL2133685	LSM-20074	BRD-K18637162, SID85808740	44501672	InChI=1S/C36H40N4O4/c1-25-21-40(26(2)24-41)35(42)20-31-19-32(38-36(43)30-15-17-37-18-16-30)13-14-33(31)44-34(25)23-39(3)22-27-9-11-29(12-10-27)28-7-5-4-6-8-28/h4-19,25-26,34,41H,20-24H2,1-3H3,(H,38,43)/t25-,26-,34+/m1/s1	IQSVNIDGIMJPQN-UVNCRYBCSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)Oc4ccc(NC(=O)c5ccncc5)cc4CC1=O	BroadT	BRD-K18637162	BRD-K18637162-001-01-6	Broad Institute of MIT and Harvard	BRD-K18637162			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C36H40N4O4/c1-25-21-40(26(2)24-41)35(42)20-31-19-32(38-36(43)30-15-17-37-18-16-30)13-14-33(31)44-34(25)23-39(3)22-27-9-11-29(12-10-27)28-7-5-4-6-8-28/h4-19,25-26,34,41H,20-24H2,1-3H3,(H,38,43)/t25-,26-,34+/m1/s1	IQSVNIDGIMJPQN-UVNCRYBCSA-N	592.3049558							108675
BRD-K20906316	LSM-20075		44497621	InChI=1S/C30H41FN4O4/c1-20-16-35(21(2)19-36)29(37)25-10-7-11-26(33-30(38)32-24-14-12-23(31)13-15-24)28(25)39-27(20)18-34(3)17-22-8-5-4-6-9-22/h7,10-15,20-22,27,36H,4-6,8-9,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,27-/m0/s1	COSGGAMFLVSIQD-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)Nc4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K20906316	BRD-K20906316-001-01-6	Broad Institute of MIT and Harvard	BRD-K20906316			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)Nc3ccc(F)cc3)cccc2C1=O	InChI=1S/C30H41FN4O4/c1-20-16-35(21(2)19-36)29(37)25-10-7-11-26(33-30(38)32-24-14-12-23(31)13-15-24)28(25)39-27(20)18-34(3)17-22-8-5-4-6-9-22/h7,10-15,20-22,27,36H,4-6,8-9,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,27-/m0/s1	COSGGAMFLVSIQD-ISCCLHIJSA-N	540.311184032							108676
CHEMBL2138565	LSM-20076	BRD-K40724407, SID85802363	44495523	InChI=1S/C30H41ClN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h9-15,20-21,24,28,36H,4-8,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m0/s1	XMVMBOAJKPBQKX-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3ccc(NC(=O)NC4CCCCC4)cc3CC1=O	BroadT	BRD-K40724407	BRD-K40724407-001-01-9	Broad Institute of MIT and Harvard	BRD-K40724407			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)NC3CCCCC3)cc2CC1=O	InChI=1S/C30H41ClN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h9-15,20-21,24,28,36H,4-8,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m0/s1	XMVMBOAJKPBQKX-BALWLHIASA-N	620.243533472							108677
BRD-K07802542	LSM-20077		44504261	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18-,24-/m1/s1	JIVQHRCMRGEILI-QZTZHPFYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3c(NC(=O)C4CC4)cccc3C1=O	BroadT	BRD-K07802542	BRD-K07802542-001-01-0	Broad Institute of MIT and Harvard	BRD-K07802542			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2c(NC(=O)C3CC3)cccc2C1=O	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18-,24-/m1/s1	JIVQHRCMRGEILI-QZTZHPFYSA-N	509.25258587							108678
BRD-K35693854	LSM-20078		44485688	InChI=1S/C25H33N3O4/c1-17-15-28(18(2)16-29)25(31)13-20-12-21(9-10-22(20)32-23(17)14-26-3)27-24(30)11-19-7-5-4-6-8-19/h4-10,12,17-18,23,26,29H,11,13-16H2,1-3H3,(H,27,30)/t17-,18-,23+/m0/s1	RIHRPLOFFJCHJI-IUKKYPGJSA-N	CNC[C@H]1Oc2ccc(NC(=O)Cc3ccccc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K35693854	BRD-K35693854-001-01-1	Broad Institute of MIT and Harvard	BRD-K35693854			CNC[C@H]1Oc2ccc(NC(=O)Cc3ccccc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C25H33N3O4/c1-17-15-28(18(2)16-29)25(31)13-20-12-21(9-10-22(20)32-23(17)14-26-3)27-24(30)11-19-7-5-4-6-8-19/h4-10,12,17-18,23,26,29H,11,13-16H2,1-3H3,(H,27,30)/t17-,18-,23+/m0/s1	RIHRPLOFFJCHJI-IUKKYPGJSA-N	439.247106566							108679
BRD-K94742710	LSM-20079		44485644	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-41(38,39)23-14-12-21(30)13-15-23)27(24)40-26(19)17-33(3)29(37)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,26,32,35H,4-6,8-9,16-18H2,1-3H3,(H,31,37)/t19-,20-,26-/m1/s1	PZASEUVCJBPSCE-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3c(NS(=O)(=O)c4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K94742710	BRD-K94742710-001-01-8	Broad Institute of MIT and Harvard	BRD-K94742710			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C1=O	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-41(38,39)23-14-12-21(30)13-15-23)27(24)40-26(19)17-33(3)29(37)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,26,32,35H,4-6,8-9,16-18H2,1-3H3,(H,31,37)/t19-,20-,26-/m1/s1	PZASEUVCJBPSCE-XMERXJNXSA-N	590.257433898							108680
BRD-K86004174	LSM-20080		44490778	InChI=1S/C33H35N5O5/c1-21-18-38(22(2)20-39)32(41)26-11-7-13-28(35-31(40)24-14-16-34-17-15-24)30(26)43-29(21)19-37(3)33(42)36-27-12-6-9-23-8-4-5-10-25(23)27/h4-17,21-22,29,39H,18-20H2,1-3H3,(H,35,40)(H,36,42)/t21-,22-,29-/m1/s1	UCPVSNSDYZNCRX-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)c5ccncc5)cccc4C1=O	BroadT	BRD-K86004174	BRD-K86004174-001-01-2	Broad Institute of MIT and Harvard	BRD-K86004174			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C33H35N5O5/c1-21-18-38(22(2)20-39)32(41)26-11-7-13-28(35-31(40)24-14-16-34-17-15-24)30(26)43-29(21)19-37(3)33(42)36-27-12-6-9-23-8-4-5-10-25(23)27/h4-17,21-22,29,39H,18-20H2,1-3H3,(H,35,40)(H,36,42)/t21-,22-,29-/m1/s1	UCPVSNSDYZNCRX-IEOSBIPESA-N	581.26381927							108681
BRD-K11010670	LSM-20081		44496704	InChI=1S/C25H41N3O3/c1-18-14-28(19(2)17-29)25(30)22-13-21(26(3)4)11-12-23(22)31-24(18)16-27(5)15-20-9-7-6-8-10-20/h11-13,18-20,24,29H,6-10,14-17H2,1-5H3/t18-,19+,24+/m0/s1	ISZUZFSFVMPJQK-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K11010670	BRD-K11010670-001-01-8	Broad Institute of MIT and Harvard	BRD-K11010670			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H41N3O3/c1-18-14-28(19(2)17-29)25(30)22-13-21(26(3)4)11-12-23(22)31-24(18)16-27(5)15-20-9-7-6-8-10-20/h11-13,18-20,24,29H,6-10,14-17H2,1-5H3/t18-,19+,24+/m0/s1	ISZUZFSFVMPJQK-XLNZFTOWSA-N	431.314792202							108682
BRD-K52190624	LSM-20082		44503556	InChI=1S/C31H49N5O6/c1-22-19-36(23(2)21-37)30(39)18-24-17-26(32-29(38)11-12-35-13-15-41-16-14-35)9-10-27(24)42-28(22)20-34(3)31(40)33-25-7-5-4-6-8-25/h9-10,17,22-23,25,28,37H,4-8,11-16,18-21H2,1-3H3,(H,32,38)(H,33,40)/t22-,23-,28+/m0/s1	VGGDTLLTAGJVNH-UXWDXCIHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)CCN4CCOCC4)cc3CC1=O	BroadT	BRD-K52190624	BRD-K52190624-001-01-5	Broad Institute of MIT and Harvard	BRD-K52190624			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC1=O	InChI=1S/C31H49N5O6/c1-22-19-36(23(2)21-37)30(39)18-24-17-26(32-29(38)11-12-35-13-15-41-16-14-35)9-10-27(24)42-28(22)20-34(3)31(40)33-25-7-5-4-6-8-25/h9-10,17,22-23,25,28,37H,4-8,11-16,18-21H2,1-3H3,(H,32,38)(H,33,40)/t22-,23-,28+/m0/s1	VGGDTLLTAGJVNH-UXWDXCIHSA-N	587.368284338							108683
BRD-K33010769	LSM-15078		44483885	InChI=1S/C26H36N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h6-13,18-19,24,31H,14-17H2,1-5H3,(H,27,33)/t18-,19-,24-/m1/s1	QJWSWWKQIHLYJD-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K33010769	BRD-K33010769-001-01-4	Broad Institute of MIT and Harvard	BRD-K33010769			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C26H36N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h6-13,18-19,24,31H,14-17H2,1-5H3,(H,27,33)/t18-,19-,24-/m1/s1	QJWSWWKQIHLYJD-KHCICDEESA-N	468.273655672							103734
BRD-K38282015	LSM-20083		44503482	InChI=1S/C31H49N5O6/c1-22-19-36(23(2)21-37)30(39)18-24-17-26(32-29(38)11-12-35-13-15-41-16-14-35)9-10-27(24)42-28(22)20-34(3)31(40)33-25-7-5-4-6-8-25/h9-10,17,22-23,25,28,37H,4-8,11-16,18-21H2,1-3H3,(H,32,38)(H,33,40)/t22-,23-,28-/m1/s1	VGGDTLLTAGJVNH-MVOZIGHISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)CCN4CCOCC4)cc3CC1=O	BroadT	BRD-K38282015	BRD-K38282015-001-01-6	Broad Institute of MIT and Harvard	BRD-K38282015			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC1=O	InChI=1S/C31H49N5O6/c1-22-19-36(23(2)21-37)30(39)18-24-17-26(32-29(38)11-12-35-13-15-41-16-14-35)9-10-27(24)42-28(22)20-34(3)31(40)33-25-7-5-4-6-8-25/h9-10,17,22-23,25,28,37H,4-8,11-16,18-21H2,1-3H3,(H,32,38)(H,33,40)/t22-,23-,28-/m1/s1	VGGDTLLTAGJVNH-MVOZIGHISA-N	587.368284338							108684
BRD-K80724972	LSM-20084		44616932	InChI=1S/C25H31F3N4O4/c1-15-13-32(16(2)14-33)23(34)11-17-10-20(8-9-21(17)36-22(15)12-29-3)31-24(35)30-19-6-4-18(5-7-19)25(26,27)28/h4-10,15-16,22,29,33H,11-14H2,1-3H3,(H2,30,31,35)/t15-,16+,22+/m0/s1	NMJAJKSBHFWFOJ-WJONJSRFSA-N	CNC[C@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K80724972	BRD-K80724972-001-01-5	Broad Institute of MIT and Harvard	BRD-K80724972			CNC[C@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C25H31F3N4O4/c1-15-13-32(16(2)14-33)23(34)11-17-10-20(8-9-21(17)36-22(15)12-29-3)31-24(35)30-19-6-4-18(5-7-19)25(26,27)28/h4-10,15-16,22,29,33H,11-14H2,1-3H3,(H2,30,31,35)/t15-,16+,22+/m0/s1	NMJAJKSBHFWFOJ-WJONJSRFSA-N	508.229740112							108685
BRD-K28874552	LSM-20085		44490476	InChI=1S/C29H37N3O6/c1-18-13-32(19(2)16-33)28(34)12-22-11-23(30-29(35)21-5-6-21)7-9-24(22)38-27(18)15-31(3)14-20-4-8-25-26(10-20)37-17-36-25/h4,7-11,18-19,21,27,33H,5-6,12-17H2,1-3H3,(H,30,35)/t18-,19+,27+/m1/s1	WXJCYEGRNWVSCE-RYTUXRKISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)C5CC5)cc4CC1=O	BroadT	BRD-K28874552	BRD-K28874552-001-01-1	Broad Institute of MIT and Harvard	BRD-K28874552			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)C3CC3)cc2CC1=O	InChI=1S/C29H37N3O6/c1-18-13-32(19(2)16-33)28(34)12-22-11-23(30-29(35)21-5-6-21)7-9-24(22)38-27(18)15-31(3)14-20-4-8-25-26(10-20)37-17-36-25/h4,7-11,18-19,21,27,33H,5-6,12-17H2,1-3H3,(H,30,35)/t18-,19+,27+/m1/s1	WXJCYEGRNWVSCE-RYTUXRKISA-N	523.268235934							108686
BRD-K41875112	LSM-20086		44501270	InChI=1S/C31H41FN4O5/c1-20-17-36(21(2)19-37)29(38)16-23-15-26(33-30(39)22-7-5-4-6-8-22)13-14-27(23)41-28(20)18-35(3)31(40)34-25-11-9-24(32)10-12-25/h9-15,20-22,28,37H,4-8,16-19H2,1-3H3,(H,33,39)(H,34,40)/t20-,21-,28-/m0/s1	KWOBPQGHYDHVIO-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3ccc(NC(=O)C4CCCCC4)cc3CC1=O	BroadT	BRD-K41875112	BRD-K41875112-001-01-4	Broad Institute of MIT and Harvard	BRD-K41875112			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ccc(NC(=O)C3CCCCC3)cc2CC1=O	InChI=1S/C31H41FN4O5/c1-20-17-36(21(2)19-37)29(38)16-23-15-26(33-30(39)22-7-5-4-6-8-22)13-14-27(23)41-28(20)18-35(3)31(40)34-25-11-9-24(32)10-12-25/h9-15,20-22,28,37H,4-8,16-19H2,1-3H3,(H,33,39)(H,34,40)/t20-,21-,28-/m0/s1	KWOBPQGHYDHVIO-CZBREUMFSA-N	568.306098652							108687
BRD-K99702099	LSM-20087		44489657	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)16-7-6-8-17(20(16)31-18(12)9-23-5)24-22(30)25-19-14(3)26-32-15(19)4/h6-8,12-13,18,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13+,18+/m0/s1	MPDMLCBONFVZSW-VEVIJQCQSA-N	CNC[C@H]1Oc2c(NC(=O)Nc3c(C)onc3C)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K99702099	BRD-K99702099-001-02-6	Broad Institute of MIT and Harvard	BRD-K99702099			CNC[C@H]1Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)16-7-6-8-17(20(16)31-18(12)9-23-5)24-22(30)25-19-14(3)26-32-15(19)4/h6-8,12-13,18,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13+,18+/m0/s1	MPDMLCBONFVZSW-VEVIJQCQSA-N	445.232519142							108688
BRD-K57200567	LSM-20088		54613810	InChI=1S/C30H42Cl2N4O4/c1-20-16-36(21(2)19-37)30(39)15-23-14-24(33-29(38)7-6-12-34(3)4)9-11-27(23)40-28(20)18-35(5)17-22-8-10-25(31)26(32)13-22/h8-11,13-14,20-21,28,37H,6-7,12,15-19H2,1-5H3,(H,33,38)/t20-,21+,28+/m0/s1	VXWQLHDADGJUOT-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NC(=O)CCCN(C)C)cc3CC1=O	BroadT	BRD-K57200567	BRD-K57200567-001-01-6	Broad Institute of MIT and Harvard	BRD-K57200567			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NC(=O)CCCN(C)C)cc2CC1=O	InChI=1S/C30H42Cl2N4O4/c1-20-16-36(21(2)19-37)30(39)15-23-14-24(33-29(38)7-6-12-34(3)4)9-11-27(23)40-28(20)18-35(5)17-22-8-10-25(31)26(32)13-22/h8-11,13-14,20-21,28,37H,6-7,12,15-19H2,1-5H3,(H,33,38)/t20-,21+,28+/m0/s1	VXWQLHDADGJUOT-BALWLHIASA-N	592.258311284							108689
BRD-K17420784	LSM-20089		44489670	InChI=1S/C33H40N4O6/c1-21-18-37(22(2)20-38)32(40)26-11-7-13-28(34-31(39)24-14-16-42-17-15-24)30(26)43-29(21)19-36(3)33(41)35-27-12-6-9-23-8-4-5-10-25(23)27/h4-13,21-22,24,29,38H,14-20H2,1-3H3,(H,34,39)(H,35,41)/t21-,22+,29+/m0/s1	XPBUGQRVLIPCFW-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K17420784	BRD-K17420784-001-01-6	Broad Institute of MIT and Harvard	BRD-K17420784			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C33H40N4O6/c1-21-18-37(22(2)20-38)32(40)26-11-7-13-28(34-31(39)24-14-16-42-17-15-24)30(26)43-29(21)19-36(3)33(41)35-27-12-6-9-23-8-4-5-10-25(23)27/h4-13,21-22,24,29,38H,14-20H2,1-3H3,(H,34,39)(H,35,41)/t21-,22+,29+/m0/s1	XPBUGQRVLIPCFW-DKGMKSHISA-N	588.29478504							108690
BRD-K33269038	LSM-20090		54613815	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)31(38)17-25-16-27(34-32(39)33-26-10-13-28(40-4)14-11-26)12-15-29(25)41-30(22)20-35(3)19-24-8-6-5-7-9-24/h10-16,22-24,30,37H,5-9,17-21H2,1-4H3,(H2,33,34,39)/t22-,23+,30+/m1/s1	QTHBIZIZCLMCFV-HFZPWKHCSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H](CN(C)CC4CCCCC4)[C@H](C)CN([C@@H](C)CO)C(=O)Cc3c2)cc1	BroadT	BRD-K33269038	BRD-K33269038-001-01-1	Broad Institute of MIT and Harvard	BRD-K33269038			COc1ccc(NC(=O)Nc2ccc3O[C@@H](CN(C)CC4CCCCC4)[C@H](C)CN([C@@H](C)CO)C(=O)Cc3c2)cc1	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)31(38)17-25-16-27(34-32(39)33-26-10-13-28(40-4)14-11-26)12-15-29(25)41-30(22)20-35(3)19-24-8-6-5-7-9-24/h10-16,22-24,30,37H,5-9,17-21H2,1-4H3,(H2,33,34,39)/t22-,23+,30+/m1/s1	QTHBIZIZCLMCFV-HFZPWKHCSA-N	566.346820612							108691
BRD-K03654379	LSM-20091		44503058	InChI=1S/C22H36N4O6S/c1-14(2)23-22(29)24-18-7-8-19-17(9-18)10-21(28)26(16(4)13-27)11-15(3)20(32-19)12-25(5)33(6,30)31/h7-9,14-16,20,27H,10-13H2,1-6H3,(H2,23,24,29)/t15-,16-,20-/m0/s1	IDOMJCFPTXQKSJ-FTRWYGJKSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)S(=O)(=O)C)[C@@H](C)CN([C@@H](C)CO)C(=O)Cc2c1	BroadT	BRD-K03654379	BRD-K03654379-001-01-7	Broad Institute of MIT and Harvard	BRD-K03654379			CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)S(C)(=O)=O)[C@@H](C)CN([C@@H](C)CO)C(=O)Cc2c1	InChI=1S/C22H36N4O6S/c1-14(2)23-22(29)24-18-7-8-19-17(9-18)10-21(28)26(16(4)13-27)11-15(3)20(32-19)12-25(5)33(6,30)31/h7-9,14-16,20,27H,10-13H2,1-6H3,(H2,23,24,29)/t15-,16-,20-/m0/s1	IDOMJCFPTXQKSJ-FTRWYGJKSA-N	484.235555602							108692
BRD-K80880506	LSM-20092		44497638	InChI=1S/C24H32N4O4/c1-16-13-28(17(2)15-29)23(30)19-11-8-12-20(22(19)32-21(16)14-27(3)4)26-24(31)25-18-9-6-5-7-10-18/h5-12,16-17,21,29H,13-15H2,1-4H3,(H2,25,26,31)/t16-,17-,21-/m1/s1	SSJJWSMGDNAKCS-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	BroadT	BRD-K80880506	BRD-K80880506-001-01-0	Broad Institute of MIT and Harvard	BRD-K80880506			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	InChI=1S/C24H32N4O4/c1-16-13-28(17(2)15-29)23(30)19-11-8-12-20(22(19)32-21(16)14-27(3)4)26-24(31)25-18-9-6-5-7-10-18/h5-12,16-17,21,29H,13-15H2,1-4H3,(H2,25,26,31)/t16-,17-,21-/m1/s1	SSJJWSMGDNAKCS-CBGDNZLLSA-N	440.242355544							108693
BRD-K46149455	LSM-20093		44489673	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11+,14+/m1/s1	CZXYLKJVFUIZEK-SUNKGSAMSA-N	CNC[C@@H]1Oc2c(N)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K46149455	BRD-K46149455-001-01-4	Broad Institute of MIT and Harvard	BRD-K46149455			CNC[C@@H]1Oc2c(N)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11+,14+/m1/s1	CZXYLKJVFUIZEK-SUNKGSAMSA-N	307.18959169							108694
BRD-K47883435	LSM-20094		44504648	InChI=1S/C29H38F3N3O5/c1-19-15-35(20(2)18-36)28(38)14-22-13-23(33-27(37)11-12-29(30,31)32)7-10-25(22)40-26(19)17-34(3)16-21-5-8-24(39-4)9-6-21/h5-10,13,19-20,26,36H,11-12,14-18H2,1-4H3,(H,33,37)/t19-,20-,26+/m1/s1	IUJLOVQYFFXLDN-KYTVRQNUSA-N	COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K47883435	BRD-K47883435-001-01-2	Broad Institute of MIT and Harvard	BRD-K47883435			COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C29H38F3N3O5/c1-19-15-35(20(2)18-36)28(38)14-22-13-23(33-27(37)11-12-29(30,31)32)7-10-25(22)40-26(19)17-34(3)16-21-5-8-24(39-4)9-6-21/h5-10,13,19-20,26,36H,11-12,14-18H2,1-4H3,(H,33,37)/t19-,20-,26+/m1/s1	IUJLOVQYFFXLDN-KYTVRQNUSA-N	565.276355946							108695
BRD-K99036206	LSM-20095		44507984	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,29+/m0/s1	SREUWAAPQJIJAQ-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K99036206	BRD-K99036206-001-01-1	Broad Institute of MIT and Harvard	BRD-K99036206			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,29+/m0/s1	SREUWAAPQJIJAQ-IHMCZWCLSA-N	559.315854842							108696
BRD-K76176797	LSM-20096		44502186	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20-,27+/m1/s1	FITMUQCJUCLPTO-DVHCVUMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4c(C)onc4C)cc3CC1=O	BroadT	BRD-K76176797	BRD-K76176797-001-01-7	Broad Institute of MIT and Harvard	BRD-K76176797			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3c(C)noc3C)cc2CC1=O	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20-,27+/m1/s1	FITMUQCJUCLPTO-DVHCVUMVSA-N	576.298155858							108697
BRD-K00463125	LSM-20097		44499888	InChI=1S/C23H33N5O4/c1-14-11-28(16(3)13-29)23(31)17-8-7-9-18(21(17)32-20(14)12-26(4)5)24-22(30)19-10-15(2)25-27(19)6/h7-10,14,16,20,29H,11-13H2,1-6H3,(H,24,30)/t14-,16+,20-/m0/s1	ADWJBSWPWOPVMW-NBQZKYEYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2c(NC(=O)c3cc(C)nn3C)cccc2C1=O	BroadT	BRD-K00463125	BRD-K00463125-001-01-3	Broad Institute of MIT and Harvard	BRD-K00463125			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2c(NC(=O)c3cc(C)nn3C)cccc2C1=O	InChI=1S/C23H33N5O4/c1-14-11-28(16(3)13-29)23(31)17-8-7-9-18(21(17)32-20(14)12-26(4)5)24-22(30)19-10-15(2)25-27(19)6/h7-10,14,16,20,29H,11-13H2,1-6H3,(H,24,30)/t14-,16+,20-/m0/s1	ADWJBSWPWOPVMW-NBQZKYEYSA-N	443.253254586							108698
BRD-K32472782	LSM-20098		44499130	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18+,24-/m0/s1	JIVQHRCMRGEILI-RHGYRFJNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3c(NC(=O)C4CC4)cccc3C1=O	BroadT	BRD-K32472782	BRD-K32472782-001-01-0	Broad Institute of MIT and Harvard	BRD-K32472782			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2c(NC(=O)C3CC3)cccc2C1=O	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18+,24-/m0/s1	JIVQHRCMRGEILI-RHGYRFJNSA-N	509.25258587							108699
BRD-K93830491	LSM-20099		44489659	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15+,19+/m0/s1	YQJJHWKDDJGBPX-QMTMVMCOSA-N	CNC[C@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K93830491	BRD-K93830491-001-01-7	Broad Institute of MIT and Harvard	BRD-K93830491			CNC[C@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15+,19+/m0/s1	YQJJHWKDDJGBPX-QMTMVMCOSA-N	468.183126106							108700
BRD-K72519622	LSM-20100		44499695	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15-,21+/m0/s1	LUEPMRNQGZCFGP-VFCRVFHLSA-N	CNC[C@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K72519622	BRD-K72519622-001-01-3	Broad Institute of MIT and Harvard	BRD-K72519622			CNC[C@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15-,21+/m0/s1	LUEPMRNQGZCFGP-VFCRVFHLSA-N	470.21653472							108701
BRD-K04155570	LSM-20101		44484423	InChI=1S/C22H35N3O3/c1-15-11-25(16(2)14-26)22(27)18-7-6-8-19(23(3)4)21(18)28-20(15)13-24(5)12-17-9-10-17/h6-8,15-17,20,26H,9-14H2,1-5H3/t15-,16+,20-/m0/s1	NQBYIEPUWCEMNR-YRNRMSPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K04155570	BRD-K04155570-001-01-1	Broad Institute of MIT and Harvard	BRD-K04155570			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C22H35N3O3/c1-15-11-25(16(2)14-26)22(27)18-7-6-8-19(23(3)4)21(18)28-20(15)13-24(5)12-17-9-10-17/h6-8,15-17,20,26H,9-14H2,1-5H3/t15-,16+,20-/m0/s1	NQBYIEPUWCEMNR-YRNRMSPPSA-N	389.26784201							108702
BRD-K78500251	LSM-20102		44500646	InChI=1S/C31H39F3N4O5/c1-19-16-38(20(2)18-39)29(41)25-15-24(35-28(40)21-7-5-4-6-8-21)13-14-26(25)43-27(19)17-37(3)30(42)36-23-11-9-22(10-12-23)31(32,33)34/h9-15,19-21,27,39H,4-8,16-18H2,1-3H3,(H,35,40)(H,36,42)/t19-,20+,27-/m1/s1	AZWNSNCWAAAZSD-IOKPGSKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K78500251	BRD-K78500251-001-01-5	Broad Institute of MIT and Harvard	BRD-K78500251			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C31H39F3N4O5/c1-19-16-38(20(2)18-39)29(41)25-15-24(35-28(40)21-7-5-4-6-8-21)13-14-26(25)43-27(19)17-37(3)30(42)36-23-11-9-22(10-12-23)31(32,33)34/h9-15,19-21,27,39H,4-8,16-18H2,1-3H3,(H,35,40)(H,36,42)/t19-,20+,27-/m1/s1	AZWNSNCWAAAZSD-IOKPGSKQSA-N	604.287254988							108703
CHEMBL1863870	LSM-20103	BRD-K36132544, SID85806473	44499475	InChI=1S/C30H36N4O6S/c1-20-13-15-24(16-14-20)41(38,39)33(4)18-27-21(2)17-34(22(3)19-35)29(36)25-11-8-12-26(28(25)40-27)32-30(37)31-23-9-6-5-7-10-23/h5-16,21-22,27,35H,17-19H2,1-4H3,(H2,31,32,37)/t21-,22+,27+/m1/s1	KABIQBXSOPPDGJ-VHSZZVNMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3c(NC(=O)Nc4ccccc4)cccc3C1=O	BroadT	BRD-K36132544	BRD-K36132544-001-01-5	Broad Institute of MIT and Harvard	BRD-K36132544			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	InChI=1S/C30H36N4O6S/c1-20-13-15-24(16-14-20)41(38,39)33(4)18-27-21(2)17-34(22(3)19-35)29(36)25-11-8-12-26(28(25)40-27)32-30(37)31-23-9-6-5-7-10-23/h5-16,21-22,27,35H,17-19H2,1-4H3,(H2,31,32,37)/t21-,22+,27+/m1/s1	KABIQBXSOPPDGJ-VHSZZVNMSA-N	580.235555602							108704
BRD-K57497543	LSM-20104		44498017	InChI=1S/C23H33N5O4/c1-14-11-28(16(3)13-29)23(31)17-8-7-9-18(21(17)32-20(14)12-26(4)5)24-22(30)19-10-15(2)25-27(19)6/h7-10,14,16,20,29H,11-13H2,1-6H3,(H,24,30)/t14-,16-,20-/m1/s1	ADWJBSWPWOPVMW-AKCHCHLHSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)c3cc(C)nn3C)cccc2C1=O	BroadT	BRD-K57497543	BRD-K57497543-001-01-7	Broad Institute of MIT and Harvard	BRD-K57497543			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)c3cc(C)nn3C)cccc2C1=O	InChI=1S/C23H33N5O4/c1-14-11-28(16(3)13-29)23(31)17-8-7-9-18(21(17)32-20(14)12-26(4)5)24-22(30)19-10-15(2)25-27(19)6/h7-10,14,16,20,29H,11-13H2,1-6H3,(H,24,30)/t14-,16-,20-/m1/s1	ADWJBSWPWOPVMW-AKCHCHLHSA-N	443.253254586							108705
BRD-K81400584	LSM-20105		44494049	InChI=1S/C21H31N7O4/c1-14-9-28(15(2)12-29)21(31)8-16-7-17(23-20(30)11-27-13-22-24-25-27)5-6-18(16)32-19(14)10-26(3)4/h5-7,13-15,19,29H,8-12H2,1-4H3,(H,23,30)/t14-,15-,19-/m0/s1	FEGVFSOLSHLDDV-DOXZYTNZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	BroadT	BRD-K81400584	BRD-K81400584-001-01-1	Broad Institute of MIT and Harvard	BRD-K81400584			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	InChI=1S/C21H31N7O4/c1-14-9-28(15(2)12-29)21(31)8-16-7-17(23-20(30)11-27-13-22-24-25-27)5-6-18(16)32-19(14)10-26(3)4/h5-7,13-15,19,29H,8-12H2,1-4H3,(H,23,30)/t14-,15-,19-/m0/s1	FEGVFSOLSHLDDV-DOXZYTNZSA-N	445.243752542							108706
BRD-K96987864	LSM-20106		44497922	InChI=1S/C30H43N3O6S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-40(36,37)25-15-13-24(38-4)14-16-25)29(26)39-28(21)19-32(3)18-23-9-6-5-7-10-23/h8,11-16,21-23,28,31,34H,5-7,9-10,17-20H2,1-4H3/t21-,22+,28-/m0/s1	VVRSDBHKTRDHNY-TYPXCFOJSA-N	COc1ccc(cc1)S(=O)(=O)Nc2cccc3C(=O)N(C[C@H](C)[C@H](CN(C)CC4CCCCC4)Oc23)[C@H](C)CO	BroadT	BRD-K96987864	BRD-K96987864-001-01-1	Broad Institute of MIT and Harvard	BRD-K96987864			COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1O[C@@H](CN(C)CC1CCCCC1)[C@@H](C)CN([C@H](C)CO)C2=O	InChI=1S/C30H43N3O6S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-40(36,37)25-15-13-24(38-4)14-16-25)29(26)39-28(21)19-32(3)18-23-9-6-5-7-10-23/h8,11-16,21-23,28,31,34H,5-7,9-10,17-20H2,1-4H3/t21-,22+,28-/m0/s1	VVRSDBHKTRDHNY-TYPXCFOJSA-N	573.287256816							108707
BRD-K92059157	LSM-20107		44491417	InChI=1S/C21H31N3O4/c1-13-11-24(14(2)12-25)20(26)9-16-8-17(23-21(27)15-4-5-15)6-7-18(16)28-19(13)10-22-3/h6-8,13-15,19,22,25H,4-5,9-12H2,1-3H3,(H,23,27)/t13-,14-,19+/m0/s1	DLUYSMSGKJYNFL-CKFHNAJUSA-N	CNC[C@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K92059157	BRD-K92059157-001-01-9	Broad Institute of MIT and Harvard	BRD-K92059157			CNC[C@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C21H31N3O4/c1-13-11-24(14(2)12-25)20(26)9-16-8-17(23-21(27)15-4-5-15)6-7-18(16)28-19(13)10-22-3/h6-8,13-15,19,22,25H,4-5,9-12H2,1-3H3,(H,23,27)/t13-,14-,19+/m0/s1	DLUYSMSGKJYNFL-CKFHNAJUSA-N	389.231456502							108708
BRD-K56126872	LSM-20108		44491863	InChI=1S/C22H36N4O4/c1-15-13-26(16(2)14-27)22(29)18-11-17(24-21(28)7-6-10-25(4)5)8-9-19(18)30-20(15)12-23-3/h8-9,11,15-16,20,23,27H,6-7,10,12-14H2,1-5H3,(H,24,28)/t15-,16+,20-/m0/s1	YREQKLPEMWXCQY-YRNRMSPPSA-N	CNC[C@@H]1Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K56126872	BRD-K56126872-001-01-4	Broad Institute of MIT and Harvard	BRD-K56126872			CNC[C@@H]1Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C22H36N4O4/c1-15-13-26(16(2)14-27)22(29)18-11-17(24-21(28)7-6-10-25(4)5)8-9-19(18)30-20(15)12-23-3/h8-9,11,15-16,20,23,27H,6-7,10,12-14H2,1-5H3,(H,24,28)/t15-,16+,20-/m0/s1	YREQKLPEMWXCQY-YRNRMSPPSA-N	420.273655672							108709
CHEMBL2136464	LSM-20109	BRD-K40318276, SID85802736	44495885	InChI=1S/C34H36FN5O5/c1-21-18-40(22(2)20-41)32(42)27-11-7-13-29(38-33(43)37-28-12-6-9-23-8-4-5-10-26(23)28)31(27)45-30(21)19-39(3)34(44)36-25-16-14-24(35)15-17-25/h4-17,21-22,30,41H,18-20H2,1-3H3,(H,36,44)(H2,37,38,43)/t21-,22-,30-/m1/s1	INJMWLLCIWTMDU-NPKFRGRUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3c(NC(=O)Nc4cccc5ccccc45)cccc3C1=O	BroadT	BRD-K40318276	BRD-K40318276-001-01-8	Broad Institute of MIT and Harvard	BRD-K40318276			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C1=O	InChI=1S/C34H36FN5O5/c1-21-18-40(22(2)20-41)32(42)27-11-7-13-29(38-33(43)37-28-12-6-9-23-8-4-5-10-26(23)28)31(27)45-30(21)19-39(3)34(44)36-25-16-14-24(35)15-17-25/h4-17,21-22,30,41H,18-20H2,1-3H3,(H,36,44)(H2,37,38,43)/t21-,22-,30-/m1/s1	INJMWLLCIWTMDU-NPKFRGRUSA-N	613.270047502							108710
BRD-K49424866	LSM-20110		44488107	InChI=1S/C32H37F3N4O5/c1-20-17-39(21(2)19-40)30(42)16-23-15-24(36-29(41)13-14-32(33,34)35)11-12-27(23)44-28(20)18-38(3)31(43)37-26-10-6-8-22-7-4-5-9-25(22)26/h4-12,15,20-21,28,40H,13-14,16-19H2,1-3H3,(H,36,41)(H,37,43)/t20-,21-,28-/m0/s1	QFRXUVVOSLWYNG-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)CCC(F)(F)F)cc4CC1=O	BroadT	BRD-K49424866	BRD-K49424866-001-01-1	Broad Institute of MIT and Harvard	BRD-K49424866			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C32H37F3N4O5/c1-20-17-39(21(2)19-40)30(42)16-23-15-24(36-29(41)13-14-32(33,34)35)11-12-27(23)44-28(20)18-38(3)31(43)37-26-10-6-8-22-7-4-5-9-25(22)26/h4-12,15,20-21,28,40H,13-14,16-19H2,1-3H3,(H,36,41)(H,37,43)/t20-,21-,28-/m0/s1	QFRXUVVOSLWYNG-CZBREUMFSA-N	614.271604924							108711
BRD-K73681382	LSM-20111		44487943	InChI=1S/C22H36N4O4/c1-15-13-26(16(2)14-27)22(29)18-11-17(24-21(28)7-6-10-25(4)5)8-9-19(18)30-20(15)12-23-3/h8-9,11,15-16,20,23,27H,6-7,10,12-14H2,1-5H3,(H,24,28)/t15-,16-,20+/m0/s1	YREQKLPEMWXCQY-TWOQFEAHSA-N	CNC[C@H]1Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K73681382	BRD-K73681382-001-01-0	Broad Institute of MIT and Harvard	BRD-K73681382			CNC[C@H]1Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C22H36N4O4/c1-15-13-26(16(2)14-27)22(29)18-11-17(24-21(28)7-6-10-25(4)5)8-9-19(18)30-20(15)12-23-3/h8-9,11,15-16,20,23,27H,6-7,10,12-14H2,1-5H3,(H,24,28)/t15-,16-,20+/m0/s1	YREQKLPEMWXCQY-TWOQFEAHSA-N	420.273655672							108712
BRD-K66735566	LSM-20112		44507992	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,29+/m1/s1	SREUWAAPQJIJAQ-QLVXXPONSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K66735566	BRD-K66735566-001-01-1	Broad Institute of MIT and Harvard	BRD-K66735566			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,29+/m1/s1	SREUWAAPQJIJAQ-QLVXXPONSA-N	559.315854842							108713
BRD-K11675166	LSM-20113		44499306	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)30-22-13-9-12-21-24(22)37-23(18(3)14-32(25(21)34)19(4)16-33)15-31(5)27(36)29-20-10-7-6-8-11-20/h6-13,17-19,23,33H,14-16H2,1-5H3,(H,29,36)(H2,28,30,35)/t18-,19+,23-/m0/s1	FNAJZGJPYUNJBY-YYDVJCTNSA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@H](C)[C@H](CN(C)C(=O)Nc3ccccc3)Oc12)[C@H](C)CO	BroadT	BRD-K11675166	BRD-K11675166-001-01-9	Broad Institute of MIT and Harvard	BRD-K11675166			CC(C)NC(=O)Nc1cccc2C(=O)N([C@H](C)CO)C[C@H](C)[C@H](CN(C)C(=O)Nc3ccccc3)Oc12	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)30-22-13-9-12-21-24(22)37-23(18(3)14-32(25(21)34)19(4)16-33)15-31(5)27(36)29-20-10-7-6-8-11-20/h6-13,17-19,23,33H,14-16H2,1-5H3,(H,29,36)(H2,28,30,35)/t18-,19+,23-/m0/s1	FNAJZGJPYUNJBY-YYDVJCTNSA-N	511.279469334							108714
BRD-K65178566	LSM-20114		44495103	InChI=1S/C30H41ClN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h9-15,20-21,24,28,36H,4-8,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m1/s1	XMVMBOAJKPBQKX-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3ccc(NC(=O)NC4CCCCC4)cc3CC1=O	BroadT	BRD-K65178566	BRD-K65178566-001-01-5	Broad Institute of MIT and Harvard	BRD-K65178566			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)NC3CCCCC3)cc2CC1=O	InChI=1S/C30H41ClN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h9-15,20-21,24,28,36H,4-8,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m1/s1	XMVMBOAJKPBQKX-GGJMMHKRSA-N	620.243533472							108715
BRD-K48294384	LSM-20115		44495110	InChI=1S/C35H45N5O5/c1-23-20-40(24(2)22-41)33(42)19-26-18-28(37-34(43)36-27-12-5-4-6-13-27)16-17-31(26)45-32(23)21-39(3)35(44)38-30-15-9-11-25-10-7-8-14-29(25)30/h7-11,14-18,23-24,27,32,41H,4-6,12-13,19-22H2,1-3H3,(H,38,44)(H2,36,37,43)/t23-,24+,32+/m1/s1	ICEMUJZXENLAMO-FXZPAHAQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)NC5CCCCC5)cc4CC1=O	BroadT	BRD-K48294384	BRD-K48294384-001-01-2	Broad Institute of MIT and Harvard	BRD-K48294384			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)NC3CCCCC3)cc2CC1=O	InChI=1S/C35H45N5O5/c1-23-20-40(24(2)22-41)33(42)19-26-18-28(37-34(43)36-27-12-5-4-6-13-27)16-17-31(26)45-32(23)21-39(3)35(44)38-30-15-9-11-25-10-7-8-14-29(25)30/h7-11,14-18,23-24,27,32,41H,4-6,12-13,19-22H2,1-3H3,(H,38,44)(H2,36,37,43)/t23-,24+,32+/m1/s1	ICEMUJZXENLAMO-FXZPAHAQSA-N	615.342069590001							108716
BRD-K93496326	LSM-20116		44503939	InChI=1S/C24H33N3O6S/c1-16-14-27(17(2)15-28)24(29)12-18-11-19(5-10-22(18)33-23(16)13-25-3)26-34(30,31)21-8-6-20(32-4)7-9-21/h5-11,16-17,23,25-26,28H,12-15H2,1-4H3/t16-,17-,23-/m1/s1	WHSSCNZRIKSNFR-SEPYTNNBSA-N	CNC[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K93496326	BRD-K93496326-001-01-8	Broad Institute of MIT and Harvard	BRD-K93496326			CNC[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H33N3O6S/c1-16-14-27(17(2)15-28)24(29)12-18-11-19(5-10-22(18)33-23(16)13-25-3)26-34(30,31)21-8-6-20(32-4)7-9-21/h5-11,16-17,23,25-26,28H,12-15H2,1-4H3/t16-,17-,23-/m1/s1	WHSSCNZRIKSNFR-SEPYTNNBSA-N	491.209006496							108717
BRD-K30117087	LSM-20117		44492570	InChI=1S/C30H41N5O5/c1-20-17-35(21(2)19-36)28(37)16-23-15-25(32-29(38)22-11-13-31-14-12-22)9-10-26(23)40-27(20)18-34(3)30(39)33-24-7-5-4-6-8-24/h9-15,20-21,24,27,36H,4-8,16-19H2,1-3H3,(H,32,38)(H,33,39)/t20-,21-,27-/m1/s1	OBYISRQTVLJVSP-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)c4ccncc4)cc3CC1=O	BroadT	BRD-K30117087	BRD-K30117087-001-01-5	Broad Institute of MIT and Harvard	BRD-K30117087			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C30H41N5O5/c1-20-17-35(21(2)19-36)28(37)16-23-15-25(32-29(38)22-11-13-31-14-12-22)9-10-26(23)40-27(20)18-34(3)30(39)33-24-7-5-4-6-8-24/h9-15,20-21,24,27,36H,4-8,16-19H2,1-3H3,(H,32,38)(H,33,39)/t20-,21-,27-/m1/s1	OBYISRQTVLJVSP-LGVUCKNBSA-N	551.310769462							108718
BRD-K23598860	LSM-20118		44490836	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15-,19-/m0/s1	YQJJHWKDDJGBPX-DOXZYTNZSA-N	CNC[C@@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K23598860	BRD-K23598860-001-01-8	Broad Institute of MIT and Harvard	BRD-K23598860			CNC[C@@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15-,19-/m0/s1	YQJJHWKDDJGBPX-DOXZYTNZSA-N	468.183126106							108719
BRD-K19020285	LSM-20119		44499111	InChI=1S/C26H35ClN4O6S/c1-16(2)28-26(34)30(5)14-23-17(3)13-31(18(4)15-32)25(33)21-7-6-8-22(24(21)37-23)29-38(35,36)20-11-9-19(27)10-12-20/h6-12,16-18,23,29,32H,13-15H2,1-5H3,(H,28,34)/t17-,18+,23-/m0/s1	ROXPMFGZZQEKHB-IXFSTUDKSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NS(=O)(=O)c3ccc(Cl)cc3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K19020285	BRD-K19020285-001-01-6	Broad Institute of MIT and Harvard	BRD-K19020285			CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NS(=O)(=O)c3ccc(Cl)cc3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H35ClN4O6S/c1-16(2)28-26(34)30(5)14-23-17(3)13-31(18(4)15-32)25(33)21-7-6-8-22(24(21)37-23)29-38(35,36)20-11-9-19(27)10-12-20/h6-12,16-18,23,29,32H,13-15H2,1-5H3,(H,28,34)/t17-,18+,23-/m0/s1	ROXPMFGZZQEKHB-IXFSTUDKSA-N	566.19658328							108720
BRD-K82376876	LSM-20120		44486875	InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18-,22-/m1/s1	QKNVOCCOOAXREN-JBYIUTFZSA-N	CNC[C@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K82376876	BRD-K82376876-001-01-9	Broad Institute of MIT and Harvard	BRD-K82376876			CNC[C@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18-,22-/m1/s1	QKNVOCCOOAXREN-JBYIUTFZSA-N	462.284220356							108721
BRD-K42828928	LSM-20121		54613811	InChI=1S/C27H35N3O6S/c1-18-15-30(19(2)17-31)26(32)14-21-13-22(28-27(33)20-9-10-20)11-12-24(21)36-25(18)16-29(3)37(34,35)23-7-5-4-6-8-23/h4-8,11-13,18-20,25,31H,9-10,14-17H2,1-3H3,(H,28,33)/t18-,19+,25+/m1/s1	MWSPHKIBVREWDU-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(NC(=O)C4CC4)cc3CC1=O	BroadT	BRD-K42828928	BRD-K42828928-001-01-6	Broad Institute of MIT and Harvard	BRD-K42828928			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(NC(=O)C3CC3)cc2CC1=O	InChI=1S/C27H35N3O6S/c1-18-15-30(19(2)17-31)26(32)14-21-13-22(28-27(33)20-9-10-20)11-12-24(21)36-25(18)16-29(3)37(34,35)23-7-5-4-6-8-23/h4-8,11-13,18-20,25,31H,9-10,14-17H2,1-3H3,(H,28,33)/t18-,19+,25+/m1/s1	MWSPHKIBVREWDU-WYEJZRMESA-N	529.22465656							108722
BRD-K67874412	LSM-20122		44493464	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17+,22-/m0/s1	FXDXYRRSNQUVQL-JKSBSHDWSA-N	CNC[C@@H]1Oc2c(NC(=O)c3ccc(cc3)c4nccs4)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K67874412	BRD-K67874412-001-01-3	Broad Institute of MIT and Harvard	BRD-K67874412			CNC[C@@H]1Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17+,22-/m0/s1	FXDXYRRSNQUVQL-JKSBSHDWSA-N	494.19877617							108723
BRD-K90019187	LSM-20123		44486862	InChI=1S/C27H32N4O4/c1-17-15-31(18(2)16-32)26(33)21-11-7-13-23(25(21)35-24(17)14-28-3)30-27(34)29-22-12-6-9-19-8-4-5-10-20(19)22/h4-13,17-18,24,28,32H,14-16H2,1-3H3,(H2,29,30,34)/t17-,18-,24-/m1/s1	KUARZOKVBLHXEU-QZTZHPFYSA-N	CNC[C@H]1Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K90019187	BRD-K90019187-001-01-9	Broad Institute of MIT and Harvard	BRD-K90019187			CNC[C@H]1Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C27H32N4O4/c1-17-15-31(18(2)16-32)26(33)21-11-7-13-23(25(21)35-24(17)14-28-3)30-27(34)29-22-12-6-9-19-8-4-5-10-20(19)22/h4-13,17-18,24,28,32H,14-16H2,1-3H3,(H2,29,30,34)/t17-,18-,24-/m1/s1	KUARZOKVBLHXEU-QZTZHPFYSA-N	476.242355544							108724
BRD-K38861721	LSM-20124		44494063	InChI=1S/C25H37N5O5/c1-15-12-30(16(2)14-31)23(32)11-19-10-20(28(5)6)8-9-21(19)34-22(15)13-29(7)25(33)26-24-17(3)27-35-18(24)4/h8-10,15-16,22,31H,11-14H2,1-7H3,(H,26,33)/t15-,16-,22-/m0/s1	GPPKFMUWSJEKJP-WCJKSRRJSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K38861721	BRD-K38861721-001-01-2	Broad Institute of MIT and Harvard	BRD-K38861721			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C25H37N5O5/c1-15-12-30(16(2)14-31)23(32)11-19-10-20(28(5)6)8-9-21(19)34-22(15)13-29(7)25(33)26-24-17(3)27-35-18(24)4/h8-10,15-16,22,31H,11-14H2,1-7H3,(H,26,33)/t15-,16-,22-/m0/s1	GPPKFMUWSJEKJP-WCJKSRRJSA-N	487.279469334							108725
BRD-K77594363	LSM-20125		44503452	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)31(38)17-25-16-27(34-32(39)33-26-10-13-28(40-4)14-11-26)12-15-29(25)41-30(22)20-35(3)19-24-8-6-5-7-9-24/h10-16,22-24,30,37H,5-9,17-21H2,1-4H3,(H2,33,34,39)/t22-,23+,30-/m1/s1	QTHBIZIZCLMCFV-DUELTEGESA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)CC4CCCCC4)[C@H](C)CN([C@@H](C)CO)C(=O)Cc3c2)cc1	BroadT	BRD-K77594363	BRD-K77594363-001-01-4	Broad Institute of MIT and Harvard	BRD-K77594363			COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)CC4CCCCC4)[C@H](C)CN([C@@H](C)CO)C(=O)Cc3c2)cc1	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)31(38)17-25-16-27(34-32(39)33-26-10-13-28(40-4)14-11-26)12-15-29(25)41-30(22)20-35(3)19-24-8-6-5-7-9-24/h10-16,22-24,30,37H,5-9,17-21H2,1-4H3,(H2,33,34,39)/t22-,23+,30-/m1/s1	QTHBIZIZCLMCFV-DUELTEGESA-N	566.346820612							108726
BRD-K64537490	LSM-20126		44484970	InChI=1S/C20H29N5O5S/c1-13-9-25(14(2)11-26)20(27)15-6-5-7-16(19(15)30-17(13)8-21-3)23-31(28,29)18-10-24(4)12-22-18/h5-7,10,12-14,17,21,23,26H,8-9,11H2,1-4H3/t13-,14+,17-/m1/s1	KOTZITAVGRXIOH-JKIFEVAISA-N	CNC[C@H]1Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K64537490	BRD-K64537490-001-01-4	Broad Institute of MIT and Harvard	BRD-K64537490			CNC[C@H]1Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C20H29N5O5S/c1-13-9-25(14(2)11-26)20(27)15-6-5-7-16(19(15)30-17(13)8-21-3)23-31(28,29)18-10-24(4)12-22-18/h5-7,10,12-14,17,21,23,26H,8-9,11H2,1-4H3/t13-,14+,17-/m1/s1	KOTZITAVGRXIOH-JKIFEVAISA-N	451.188939768							108727
BRD-K63468420	LSM-20127		44495892	InChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)11-18-10-19(4-5-20(18)31-21(15)12-24-3)26-23(30)17-6-8-25-9-7-17/h4-10,15-16,21,24,28H,11-14H2,1-3H3,(H,26,30)/t15-,16-,21-/m0/s1	FZIMPWDREOYZDI-QYWGDWMGSA-N	CNC[C@@H]1Oc2ccc(NC(=O)c3ccncc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K63468420	BRD-K63468420-001-01-8	Broad Institute of MIT and Harvard	BRD-K63468420			CNC[C@@H]1Oc2ccc(NC(=O)c3ccncc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)11-18-10-19(4-5-20(18)31-21(15)12-24-3)26-23(30)17-6-8-25-9-7-17/h4-10,15-16,21,24,28H,11-14H2,1-3H3,(H,26,30)/t15-,16-,21-/m0/s1	FZIMPWDREOYZDI-QYWGDWMGSA-N	426.22670548							108728
BRD-K21620541	LSM-20128		44495826	InChI=1S/C18H29N3O5S/c1-12-9-21(13(2)11-22)18(23)14-7-6-8-15(19-27(5,24)25)17(14)26-16(12)10-20(3)4/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13-,16+/m0/s1	NGOQGDZIZPAXSN-HEHGZKQESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2c(NS(=O)(=O)C)cccc2C1=O	BroadT	BRD-K21620541	BRD-K21620541-001-01-9	Broad Institute of MIT and Harvard	BRD-K21620541			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2c(NS(C)(=O)=O)cccc2C1=O	InChI=1S/C18H29N3O5S/c1-12-9-21(13(2)11-22)18(23)14-7-6-8-15(19-27(5,24)25)17(14)26-16(12)10-20(3)4/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13-,16+/m0/s1	NGOQGDZIZPAXSN-HEHGZKQESA-N	399.182791748							108729
BRD-K63779242-001-01-4	LSM-20129	BRD-K63779242	44497403	InChI=1S/C24H33N3O5S2/c1-16-12-27(17(2)15-28)24(29)19-6-4-7-20(25-34(30,31)22-8-5-11-33-22)23(19)32-21(16)14-26(3)13-18-9-10-18/h4-8,11,16-18,21,25,28H,9-10,12-15H2,1-3H3/t16-,17+,21+/m0/s1	JSDMQXJTQZGOQF-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3c(NS(=O)(=O)c4cccs4)cccc3C1=O	BroadT	BRD-K63779242	BRD-K63779242-001-02-2	Broad Institute of MIT and Harvard	BRD-K63779242			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2c(NS(=O)(=O)c3cccs3)cccc2C1=O	InChI=1S/C24H33N3O5S2/c1-16-12-27(17(2)15-28)24(29)19-6-4-7-20(25-34(30,31)22-8-5-11-33-22)23(19)32-21(16)14-26(3)13-18-9-10-18/h4-8,11,16-18,21,25,28H,9-10,12-15H2,1-3H3/t16-,17+,21+/m0/s1	JSDMQXJTQZGOQF-CSODHUTKSA-N	507.186162566							108730
BRD-K54948591	LSM-20130		44504793	InChI=1S/C24H38N4O4/c1-16-14-28(17(2)15-29)23(30)12-18-11-20(9-10-21(18)32-22(16)13-25-3)27-24(31)26-19-7-5-4-6-8-19/h9-11,16-17,19,22,25,29H,4-8,12-15H2,1-3H3,(H2,26,27,31)/t16-,17-,22-/m1/s1	UULCDSMPFJBLQO-DRSNIGMVSA-N	CNC[C@H]1Oc2ccc(NC(=O)NC3CCCCC3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K54948591	BRD-K54948591-001-01-3	Broad Institute of MIT and Harvard	BRD-K54948591			CNC[C@H]1Oc2ccc(NC(=O)NC3CCCCC3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H38N4O4/c1-16-14-28(17(2)15-29)23(30)12-18-11-20(9-10-21(18)32-22(16)13-25-3)27-24(31)26-19-7-5-4-6-8-19/h9-11,16-17,19,22,25,29H,4-8,12-15H2,1-3H3,(H2,26,27,31)/t16-,17-,22-/m1/s1	UULCDSMPFJBLQO-DRSNIGMVSA-N	446.289305736							108731
BRD-K43298189	LSM-20131		44504652	InChI=1S/C28H40N4O4/c1-19(2)29-28(35)30-24-11-12-25-23(13-24)14-27(34)32(21(4)18-33)15-20(3)26(36-25)17-31(5)16-22-9-7-6-8-10-22/h6-13,19-21,26,33H,14-18H2,1-5H3,(H2,29,30,35)/t20-,21-,26+/m1/s1	ZPQZMRPPCAYKJS-YPCDYVTLSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)Cc2c1	BroadT	BRD-K43298189	BRD-K43298189-001-01-5	Broad Institute of MIT and Harvard	BRD-K43298189			CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)Cc2c1	InChI=1S/C28H40N4O4/c1-19(2)29-28(35)30-24-11-12-25-23(13-24)14-27(34)32(21(4)18-33)15-20(3)26(36-25)17-31(5)16-22-9-7-6-8-10-22/h6-13,19-21,26,33H,14-18H2,1-5H3,(H2,29,30,35)/t20-,21-,26+/m1/s1	ZPQZMRPPCAYKJS-YPCDYVTLSA-N	496.3049558							108732
BRD-K26231789	LSM-20132		44617831	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18+,23+/m1/s1	ZIGDOLRJGHLEBT-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K26231789	BRD-K26231789-001-01-1	Broad Institute of MIT and Harvard	BRD-K26231789			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18+,23+/m1/s1	ZIGDOLRJGHLEBT-STSQHVNTSA-N	490.224990918							108733
BRD-K41717353	LSM-20133		44504256	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15+,21-/m1/s1	LUEPMRNQGZCFGP-LRAJWGHMSA-N	CNC[C@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K41717353	BRD-K41717353-001-01-6	Broad Institute of MIT and Harvard	BRD-K41717353			CNC[C@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15+,21-/m1/s1	LUEPMRNQGZCFGP-LRAJWGHMSA-N	470.21653472							108734
BRD-K91490997	LSM-20134		44494057	InChI=1S/C30H41N5O5/c1-20-17-35(21(2)19-36)28(37)16-23-15-25(32-29(38)22-11-13-31-14-12-22)9-10-26(23)40-27(20)18-34(3)30(39)33-24-7-5-4-6-8-24/h9-15,20-21,24,27,36H,4-8,16-19H2,1-3H3,(H,32,38)(H,33,39)/t20-,21-,27-/m0/s1	OBYISRQTVLJVSP-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)c4ccncc4)cc3CC1=O	BroadT	BRD-K91490997	BRD-K91490997-001-01-1	Broad Institute of MIT and Harvard	BRD-K91490997			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C30H41N5O5/c1-20-17-35(21(2)19-36)28(37)16-23-15-25(32-29(38)22-11-13-31-14-12-22)9-10-26(23)40-27(20)18-34(3)30(39)33-24-7-5-4-6-8-24/h9-15,20-21,24,27,36H,4-8,16-19H2,1-3H3,(H,32,38)(H,33,39)/t20-,21-,27-/m0/s1	OBYISRQTVLJVSP-IZVMNLJQSA-N	551.310769462							108735
BRD-K18984088	LSM-20135		54613813	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18+,23+/m0/s1	ZIGDOLRJGHLEBT-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K18984088	BRD-K18984088-001-01-3	Broad Institute of MIT and Harvard	BRD-K18984088			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18+,23+/m0/s1	ZIGDOLRJGHLEBT-YZZKKUAISA-N	490.224990918							108736
BRD-K75845970	LSM-20136		44485643	InChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16-,20-/m1/s1	HFFGMDRCIAVIES-JXXFODFXSA-N	CNC[C@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K75845970	BRD-K75845970-001-01-7	Broad Institute of MIT and Harvard	BRD-K75845970			CNC[C@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16-,20-/m1/s1	HFFGMDRCIAVIES-JXXFODFXSA-N	432.273655672							108737
BRD-K28339544	LSM-20137		44488680	InChI=1S/C35H45N5O5/c1-23-20-40(24(2)22-41)33(42)19-26-18-28(37-34(43)36-27-12-5-4-6-13-27)16-17-31(26)45-32(23)21-39(3)35(44)38-30-15-9-11-25-10-7-8-14-29(25)30/h7-11,14-18,23-24,27,32,41H,4-6,12-13,19-22H2,1-3H3,(H,38,44)(H2,36,37,43)/t23-,24-,32+/m0/s1	ICEMUJZXENLAMO-TXAHVWHTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)NC5CCCCC5)cc4CC1=O	BroadT	BRD-K28339544	BRD-K28339544-001-01-6	Broad Institute of MIT and Harvard	BRD-K28339544			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)NC3CCCCC3)cc2CC1=O	InChI=1S/C35H45N5O5/c1-23-20-40(24(2)22-41)33(42)19-26-18-28(37-34(43)36-27-12-5-4-6-13-27)16-17-31(26)45-32(23)21-39(3)35(44)38-30-15-9-11-25-10-7-8-14-29(25)30/h7-11,14-18,23-24,27,32,41H,4-6,12-13,19-22H2,1-3H3,(H,38,44)(H2,36,37,43)/t23-,24-,32+/m0/s1	ICEMUJZXENLAMO-TXAHVWHTSA-N	615.342069590001							108738
BRD-K66580188	LSM-20138		44496927	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23+,29+/m0/s1	JWXWRTLQHUTWJR-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K66580188	BRD-K66580188-001-01-9	Broad Institute of MIT and Harvard	BRD-K66580188			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23+,29+/m0/s1	JWXWRTLQHUTWJR-QFWOEDSFSA-N	564.331170548							108739
CHEMBL2362630	LSM-20139	SID85804802, BRD-K71755682	44497899	InChI=1S/C26H35ClN4O6S/c1-16(2)28-26(34)30(5)14-23-17(3)13-31(18(4)15-32)25(33)21-7-6-8-22(24(21)37-23)29-38(35,36)20-11-9-19(27)10-12-20/h6-12,16-18,23,29,32H,13-15H2,1-5H3,(H,28,34)/t17-,18-,23+/m0/s1	ROXPMFGZZQEKHB-IUKKYPGJSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2c(NS(=O)(=O)c3ccc(Cl)cc3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K71755682	BRD-K71755682-001-01-1	Broad Institute of MIT and Harvard	BRD-K71755682			CC(C)NC(=O)N(C)C[C@H]1Oc2c(NS(=O)(=O)c3ccc(Cl)cc3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H35ClN4O6S/c1-16(2)28-26(34)30(5)14-23-17(3)13-31(18(4)15-32)25(33)21-7-6-8-22(24(21)37-23)29-38(35,36)20-11-9-19(27)10-12-20/h6-12,16-18,23,29,32H,13-15H2,1-5H3,(H,28,34)/t17-,18-,23+/m0/s1	ROXPMFGZZQEKHB-IUKKYPGJSA-N	566.19658328							108740
BRD-K22280519	LSM-20140		44491324	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15+,19-/m1/s1	YQJJHWKDDJGBPX-ZRGWGRIASA-N	CNC[C@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K22280519	BRD-K22280519-001-01-9	Broad Institute of MIT and Harvard	BRD-K22280519			CNC[C@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15+,19-/m1/s1	YQJJHWKDDJGBPX-ZRGWGRIASA-N	468.183126106							108741
BRD-K03067757	LSM-20141		44496930	InChI=1S/C33H40N4O7/c1-21-16-37(22(2)19-38)32(39)14-24-13-25(34-33(40)35-26-8-12-29-30(15-26)43-20-42-29)7-11-28(24)44-31(21)18-36(3)17-23-5-9-27(41-4)10-6-23/h5-13,15,21-22,31,38H,14,16-20H2,1-4H3,(H2,34,35,40)/t21-,22+,31+/m1/s1	VJXHRMPDQSPMOP-XASJVRKQSA-N	COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)Nc4ccc5OCOc5c4)cc3CC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K03067757	BRD-K03067757-001-01-4	Broad Institute of MIT and Harvard	BRD-K03067757			COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)Nc4ccc5OCOc5c4)cc3CC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C33H40N4O7/c1-21-16-37(22(2)19-38)32(39)14-24-13-25(34-33(40)35-26-8-12-29-30(15-26)43-20-42-29)7-11-28(24)44-31(21)18-36(3)17-23-5-9-27(41-4)10-6-23/h5-13,15,21-22,31,38H,14,16-20H2,1-4H3,(H2,34,35,40)/t21-,22+,31+/m1/s1	VJXHRMPDQSPMOP-XASJVRKQSA-N	604.28969966							108742
BRD-K08504955	LSM-20142		44503804	InChI=1S/C27H39N5O5/c1-16-12-32(17(2)15-33)25(34)11-21-10-22(28-27(35)29-26-18(3)30-37-19(26)4)8-9-23(21)36-24(16)14-31(5)13-20-6-7-20/h8-10,16-17,20,24,33H,6-7,11-15H2,1-5H3,(H2,28,29,35)/t16-,17-,24+/m0/s1	RRKRQZMEMKUNGW-WOGXIUBCSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3CC1=O	BroadT	BRD-K08504955	BRD-K08504955-001-01-1	Broad Institute of MIT and Harvard	BRD-K08504955			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2CC1=O	InChI=1S/C27H39N5O5/c1-16-12-32(17(2)15-33)25(34)11-21-10-22(28-27(35)29-26-18(3)30-37-19(26)4)8-9-23(21)36-24(16)14-31(5)13-20-6-7-20/h8-10,16-17,20,24,33H,6-7,11-15H2,1-5H3,(H2,28,29,35)/t16-,17-,24+/m0/s1	RRKRQZMEMKUNGW-WOGXIUBCSA-N	513.295119398							108743
BRD-K07895476	LSM-20143		44500884	InChI=1S/C27H37N3O5/c1-18-13-30(19(2)16-31)27(32)12-21-11-22(28(3)4)7-9-23(21)35-26(18)15-29(5)14-20-6-8-24-25(10-20)34-17-33-24/h6-11,18-19,26,31H,12-17H2,1-5H3/t18-,19+,26-/m0/s1	VAKWQMKHOINUIK-ANSQWYIGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(cc4CC1=O)N(C)C	BroadT	BRD-K07895476	BRD-K07895476-001-01-4	Broad Institute of MIT and Harvard	BRD-K07895476			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C27H37N3O5/c1-18-13-30(19(2)16-31)27(32)12-21-11-22(28(3)4)7-9-23(21)35-26(18)15-29(5)14-20-6-8-24-25(10-20)34-17-33-24/h6-11,18-19,26,31H,12-17H2,1-5H3/t18-,19+,26-/m0/s1	VAKWQMKHOINUIK-ANSQWYIGSA-N	483.273321314							108744
BRD-K71742655	LSM-20144		44504671	InChI=1S/C34H37N5O5/c1-22-19-39(23(2)21-40)32(41)18-26-17-27(36-33(42)25-13-15-35-16-14-25)11-12-30(26)44-31(22)20-38(3)34(43)37-29-10-6-8-24-7-4-5-9-28(24)29/h4-17,22-23,31,40H,18-21H2,1-3H3,(H,36,42)(H,37,43)/t22-,23-,31+/m0/s1	LDEMJBAJJXLTPL-WDCWYOMISA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)c5ccncc5)cc4CC1=O	BroadT	BRD-K71742655	BRD-K71742655-001-01-2	Broad Institute of MIT and Harvard	BRD-K71742655			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C34H37N5O5/c1-22-19-39(23(2)21-40)32(41)18-26-17-27(36-33(42)25-13-15-35-16-14-25)11-12-30(26)44-31(22)20-38(3)34(43)37-29-10-6-8-24-7-4-5-9-28(24)29/h4-17,22-23,31,40H,18-21H2,1-3H3,(H,36,42)(H,37,43)/t22-,23-,31+/m0/s1	LDEMJBAJJXLTPL-WDCWYOMISA-N	595.279469334							108745
BRD-K29083370	LSM-20145		44499923	InChI=1S/C29H34FN5O4/c1-19-15-35(20(2)18-36)28(37)24-5-4-6-25(33-29(38)32-23-9-7-22(30)8-10-23)27(24)39-26(19)17-34(3)16-21-11-13-31-14-12-21/h4-14,19-20,26,36H,15-18H2,1-3H3,(H2,32,33,38)/t19-,20+,26-/m1/s1	VBGZKSFWINXWAF-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3c(NC(=O)Nc4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K29083370	BRD-K29083370-001-01-8	Broad Institute of MIT and Harvard	BRD-K29083370			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2c(NC(=O)Nc3ccc(F)cc3)cccc2C1=O	InChI=1S/C29H34FN5O4/c1-19-15-35(20(2)18-36)28(37)24-5-4-6-25(33-29(38)32-23-9-7-22(30)8-10-23)27(24)39-26(19)17-34(3)16-21-11-13-31-14-12-21/h4-14,19-20,26,36H,15-18H2,1-3H3,(H2,32,33,38)/t19-,20+,26-/m1/s1	VBGZKSFWINXWAF-BVFVYWQFSA-N	535.259482818							108746
BRD-K82768815	LSM-20146		44491364	InChI=1S/C24H29F3N4O4/c1-14-12-31(15(2)13-32)22(33)18-5-4-6-19(21(18)35-20(14)11-28-3)30-23(34)29-17-9-7-16(8-10-17)24(25,26)27/h4-10,14-15,20,28,32H,11-13H2,1-3H3,(H2,29,30,34)/t14-,15-,20-/m1/s1	KNPSDLIHJHZPLR-STXHMFSFSA-N	CNC[C@H]1Oc2c(NC(=O)Nc3ccc(cc3)C(F)(F)F)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K82768815	BRD-K82768815-001-01-1	Broad Institute of MIT and Harvard	BRD-K82768815			CNC[C@H]1Oc2c(NC(=O)Nc3ccc(cc3)C(F)(F)F)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H29F3N4O4/c1-14-12-31(15(2)13-32)22(33)18-5-4-6-19(21(18)35-20(14)11-28-3)30-23(34)29-17-9-7-16(8-10-17)24(25,26)27/h4-10,14-15,20,28,32H,11-13H2,1-3H3,(H2,29,30,34)/t14-,15-,20-/m1/s1	KNPSDLIHJHZPLR-STXHMFSFSA-N	494.214090048							108747
BRD-K98223571	LSM-20147		44485642	InChI=1S/C29H39N5O5/c1-19-16-34(20(2)18-35)28(37)23-10-7-11-24(32-27(36)21-12-14-30-15-13-21)26(23)39-25(19)17-33(3)29(38)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,25,35H,4-6,8-9,16-18H2,1-3H3,(H,31,38)(H,32,36)/t19-,20+,25-/m1/s1	KKCRHGGATFNVQS-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K98223571	BRD-K98223571-001-01-3	Broad Institute of MIT and Harvard	BRD-K98223571			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C29H39N5O5/c1-19-16-34(20(2)18-35)28(37)23-10-7-11-24(32-27(36)21-12-14-30-15-13-21)26(23)39-25(19)17-33(3)29(38)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,25,35H,4-6,8-9,16-18H2,1-3H3,(H,31,38)(H,32,36)/t19-,20+,25-/m1/s1	KKCRHGGATFNVQS-OHUGHZGNSA-N	537.295119398							108748
BRD-K30633507	LSM-20148		44501694	InChI=1S/C24H32FN3O5S/c1-16-13-28(17(2)15-29)24(30)12-18-11-20(7-10-22(18)33-23(16)14-27(3)4)26-34(31,32)21-8-5-19(25)6-9-21/h5-11,16-17,23,26,29H,12-15H2,1-4H3/t16-,17-,23+/m0/s1	VCRKNKMPQDEVAF-HKARXFIJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2CC1=O	BroadT	BRD-K30633507	BRD-K30633507-001-01-3	Broad Institute of MIT and Harvard	BRD-K30633507			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2CC1=O	InChI=1S/C24H32FN3O5S/c1-16-13-28(17(2)15-29)24(30)12-18-11-20(7-10-22(18)33-23(16)14-27(3)4)26-34(31,32)21-8-5-19(25)6-9-21/h5-11,16-17,23,26,29H,12-15H2,1-4H3/t16-,17-,23+/m0/s1	VCRKNKMPQDEVAF-HKARXFIJSA-N	493.204670044							108749
BRD-K80439500	LSM-20149		44493522	InChI=1S/C32H37FN4O6/c1-20-16-37(21(2)19-38)30(39)15-24-14-27(35-32(42)34-26-10-8-25(33)9-11-26)12-13-28(24)43-29(20)18-36(3)17-22-4-6-23(7-5-22)31(40)41/h4-14,20-21,29,38H,15-19H2,1-3H3,(H,40,41)(H2,34,35,42)/t20-,21-,29-/m0/s1	KTBFUFCVUDUHMK-WURXVLGASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc3CC1=O	BroadT	BRD-K80439500	BRD-K80439500-001-01-1	Broad Institute of MIT and Harvard	BRD-K80439500			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2CC1=O	InChI=1S/C32H37FN4O6/c1-20-16-37(21(2)19-38)30(39)15-24-14-27(35-32(42)34-26-10-8-25(33)9-11-26)12-13-28(24)43-29(20)18-36(3)17-22-4-6-23(7-5-22)31(40)41/h4-14,20-21,29,38H,15-19H2,1-3H3,(H,40,41)(H2,34,35,42)/t20-,21-,29-/m0/s1	KTBFUFCVUDUHMK-WURXVLGASA-N	592.269713144							108750
BRD-K00509183	LSM-20150		44504676	InChI=1S/C33H39N7O5/c1-23-17-40(24(2)21-41)33(43)16-26-15-27(35-32(42)20-39-22-34-36-37-39)11-14-30(26)45-31(23)19-38(3)18-25-9-12-29(13-10-25)44-28-7-5-4-6-8-28/h4-15,22-24,31,41H,16-21H2,1-3H3,(H,35,42)/t23-,24-,31+/m0/s1	PROAVNUGSAEHPP-ISTJGCCRSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(NC(=O)Cn5cnnn5)cc4CC1=O	BroadT	BRD-K00509183	BRD-K00509183-001-01-2	Broad Institute of MIT and Harvard	BRD-K00509183			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	InChI=1S/C33H39N7O5/c1-23-17-40(24(2)21-41)33(43)16-26-15-27(35-32(42)20-39-22-34-36-37-39)11-14-30(26)45-31(23)19-38(3)18-25-9-12-29(13-10-25)44-28-7-5-4-6-8-28/h4-15,22-24,31,41H,16-21H2,1-3H3,(H,35,42)/t23-,24-,31+/m0/s1	PROAVNUGSAEHPP-ISTJGCCRSA-N	613.301267418							108751
MLS002473909	LSM-20151	BRD-K74150320, SID85201436	44202520	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16+,20+/m0/s1	DJIXJENXBPUHIX-RZQQEMMASA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K74150320	BRD-K74150320-001-02-8	Broad Institute of MIT and Harvard	BRD-K74150320			CC(C)NC(=O)N(C)C[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16+,20+/m0/s1	DJIXJENXBPUHIX-RZQQEMMASA-N	460.268570292							108752
BRD-K44139185	LSM-20152		44503540	InChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20-,25+/m1/s1	LNIIROWVVFKABQ-FHAGJXEFSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K44139185	BRD-K44139185-001-01-4	Broad Institute of MIT and Harvard	BRD-K44139185			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20-,25+/m1/s1	LNIIROWVVFKABQ-FHAGJXEFSA-N	546.251205666							108753
BRD-K67522096	LSM-20153		54613814	InChI=1S/C31H49N5O6/c1-22-19-36(23(2)21-37)30(39)18-24-17-26(32-29(38)11-12-35-13-15-41-16-14-35)9-10-27(24)42-28(22)20-34(3)31(40)33-25-7-5-4-6-8-25/h9-10,17,22-23,25,28,37H,4-8,11-16,18-21H2,1-3H3,(H,32,38)(H,33,40)/t22-,23+,28+/m1/s1	VGGDTLLTAGJVNH-IWHLBADBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)CCN4CCOCC4)cc3CC1=O	BroadT	BRD-K67522096	BRD-K67522096-001-01-1	Broad Institute of MIT and Harvard	BRD-K67522096			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC1=O	InChI=1S/C31H49N5O6/c1-22-19-36(23(2)21-37)30(39)18-24-17-26(32-29(38)11-12-35-13-15-41-16-14-35)9-10-27(24)42-28(22)20-34(3)31(40)33-25-7-5-4-6-8-25/h9-10,17,22-23,25,28,37H,4-8,11-16,18-21H2,1-3H3,(H,32,38)(H,33,40)/t22-,23+,28+/m1/s1	VGGDTLLTAGJVNH-IWHLBADBSA-N	587.368284338							108754
BRD-K81586131	LSM-20154		44486322	InChI=1S/C25H32N4O6/c1-15-12-29(16(2)13-30)24(31)9-17-8-18(4-6-20(17)35-23(15)11-26-3)27-25(32)28-19-5-7-21-22(10-19)34-14-33-21/h4-8,10,15-16,23,26,30H,9,11-14H2,1-3H3,(H2,27,28,32)/t15-,16-,23+/m1/s1	BRYKRAAGJVMQDR-LNPFQXMTSA-N	CNC[C@@H]1Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K81586131	BRD-K81586131-001-01-5	Broad Institute of MIT and Harvard	BRD-K81586131			CNC[C@@H]1Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C25H32N4O6/c1-15-12-29(16(2)13-30)24(31)9-17-8-18(4-6-20(17)35-23(15)11-26-3)27-25(32)28-19-5-7-21-22(10-19)34-14-33-21/h4-8,10,15-16,23,26,30H,9,11-14H2,1-3H3,(H2,27,28,32)/t15-,16-,23+/m1/s1	BRYKRAAGJVMQDR-LNPFQXMTSA-N	484.232184784							108755
BRD-K26169592	LSM-20155		44488019	InChI=1S/C33H35N5O5/c1-21-18-38(22(2)20-39)32(41)26-11-7-13-28(35-31(40)24-14-16-34-17-15-24)30(26)43-29(21)19-37(3)33(42)36-27-12-6-9-23-8-4-5-10-25(23)27/h4-17,21-22,29,39H,18-20H2,1-3H3,(H,35,40)(H,36,42)/t21-,22-,29+/m0/s1	UCPVSNSDYZNCRX-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)c5ccncc5)cccc4C1=O	BroadT	BRD-K26169592	BRD-K26169592-001-01-0	Broad Institute of MIT and Harvard	BRD-K26169592			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C33H35N5O5/c1-21-18-38(22(2)20-39)32(41)26-11-7-13-28(35-31(40)24-14-16-34-17-15-24)30(26)43-29(21)19-37(3)33(42)36-27-12-6-9-23-8-4-5-10-25(23)27/h4-17,21-22,29,39H,18-20H2,1-3H3,(H,35,40)(H,36,42)/t21-,22-,29+/m0/s1	UCPVSNSDYZNCRX-IHMCZWCLSA-N	581.26381927							108756
BRD-K36002293	LSM-20156		44503500	InChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20-,25-/m0/s1	LNIIROWVVFKABQ-RLSLOFABSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K36002293	BRD-K36002293-001-01-3	Broad Institute of MIT and Harvard	BRD-K36002293			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20-,25-/m0/s1	LNIIROWVVFKABQ-RLSLOFABSA-N	546.251205666							108757
BRD-K16826019	LSM-20157		44503007	InChI=1S/C22H36N4O6S/c1-14(2)23-22(29)24-18-7-8-19-17(9-18)10-21(28)26(16(4)13-27)11-15(3)20(32-19)12-25(5)33(6,30)31/h7-9,14-16,20,27H,10-13H2,1-6H3,(H2,23,24,29)/t15-,16-,20-/m1/s1	IDOMJCFPTXQKSJ-JXXFODFXSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)S(=O)(=O)C)[C@H](C)CN([C@H](C)CO)C(=O)Cc2c1	BroadT	BRD-K16826019	BRD-K16826019-001-01-2	Broad Institute of MIT and Harvard	BRD-K16826019			CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)S(C)(=O)=O)[C@H](C)CN([C@H](C)CO)C(=O)Cc2c1	InChI=1S/C22H36N4O6S/c1-14(2)23-22(29)24-18-7-8-19-17(9-18)10-21(28)26(16(4)13-27)11-15(3)20(32-19)12-25(5)33(6,30)31/h7-9,14-16,20,27H,10-13H2,1-6H3,(H2,23,24,29)/t15-,16-,20-/m1/s1	IDOMJCFPTXQKSJ-JXXFODFXSA-N	484.235555602							108758
BRD-K08476323	LSM-20158		44501202	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18-,23-/m1/s1	ZIGDOLRJGHLEBT-PMAPCBKXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K08476323	BRD-K08476323-001-01-7	Broad Institute of MIT and Harvard	BRD-K08476323			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18-,23-/m1/s1	ZIGDOLRJGHLEBT-PMAPCBKXSA-N	490.224990918							108759
BRD-K48459037	LSM-20159		44503017	InChI=1S/C25H34N4O4/c1-17-14-29(18(2)16-30)24(31)13-19-12-21(10-11-22(19)33-23(17)15-28(3)4)27-25(32)26-20-8-6-5-7-9-20/h5-12,17-18,23,30H,13-16H2,1-4H3,(H2,26,27,32)/t17-,18-,23-/m0/s1	VPMPLFBICILMPX-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	BroadT	BRD-K48459037	BRD-K48459037-001-01-2	Broad Institute of MIT and Harvard	BRD-K48459037			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	InChI=1S/C25H34N4O4/c1-17-14-29(18(2)16-30)24(31)13-19-12-21(10-11-22(19)33-23(17)15-28(3)4)27-25(32)26-20-8-6-5-7-9-20/h5-12,17-18,23,30H,13-16H2,1-4H3,(H2,26,27,32)/t17-,18-,23-/m0/s1	VPMPLFBICILMPX-BSRJHKFKSA-N	454.258005608							108760
BRD-K90485414	LSM-20160		44498292	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)23-12-9-13-24(30-29(37)31-26-20(3)32-39-21(26)4)27(23)38-25(18)16-33(5)15-22-10-7-6-8-11-22/h9,12-13,18-19,22,25,35H,6-8,10-11,14-17H2,1-5H3,(H2,30,31,37)/t18-,19+,25+/m0/s1	SKOKKYKZTHPAKC-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)Nc4c(C)onc4C)cccc3C1=O	BroadT	BRD-K90485414	BRD-K90485414-001-01-7	Broad Institute of MIT and Harvard	BRD-K90485414			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C1=O	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)23-12-9-13-24(30-29(37)31-26-20(3)32-39-21(26)4)27(23)38-25(18)16-33(5)15-22-10-7-6-8-11-22/h9,12-13,18-19,22,25,35H,6-8,10-11,14-17H2,1-5H3,(H2,30,31,37)/t18-,19+,25+/m0/s1	SKOKKYKZTHPAKC-OSWQYVSFSA-N	541.326419526							108761
MLS002474087	LSM-20161	BRD-K75967530, SID85201648	44202732	InChI=1S/C30H43N3O6S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-40(36,37)25-15-13-24(38-4)14-16-25)29(26)39-28(21)19-32(3)18-23-9-6-5-7-10-23/h8,11-16,21-23,28,31,34H,5-7,9-10,17-20H2,1-4H3/t21-,22+,28+/m0/s1	VVRSDBHKTRDHNY-PFPZSTESSA-N	COc1ccc(cc1)S(=O)(=O)Nc2cccc3C(=O)N(C[C@H](C)[C@@H](CN(C)CC4CCCCC4)Oc23)[C@H](C)CO	BroadT	BRD-K75967530	BRD-K75967530-001-02-0	Broad Institute of MIT and Harvard	BRD-K75967530			COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1O[C@H](CN(C)CC1CCCCC1)[C@@H](C)CN([C@H](C)CO)C2=O	InChI=1S/C30H43N3O6S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-40(36,37)25-15-13-24(38-4)14-16-25)29(26)39-28(21)19-32(3)18-23-9-6-5-7-10-23/h8,11-16,21-23,28,31,34H,5-7,9-10,17-20H2,1-4H3/t21-,22+,28+/m0/s1	VVRSDBHKTRDHNY-PFPZSTESSA-N	573.287256816							108762
BRD-K99100679	LSM-20162		44489112	InChI=1S/C33H40N4O6/c1-21-18-37(22(2)20-38)32(40)26-11-7-13-28(34-31(39)24-14-16-42-17-15-24)30(26)43-29(21)19-36(3)33(41)35-27-12-6-9-23-8-4-5-10-25(23)27/h4-13,21-22,24,29,38H,14-20H2,1-3H3,(H,34,39)(H,35,41)/t21-,22+,29+/m1/s1	XPBUGQRVLIPCFW-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K99100679	BRD-K99100679-001-01-3	Broad Institute of MIT and Harvard	BRD-K99100679			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C33H40N4O6/c1-21-18-37(22(2)20-38)32(40)26-11-7-13-28(34-31(39)24-14-16-42-17-15-24)30(26)43-29(21)19-36(3)33(41)35-27-12-6-9-23-8-4-5-10-25(23)27/h4-13,21-22,24,29,38H,14-20H2,1-3H3,(H,34,39)(H,35,41)/t21-,22+,29+/m1/s1	XPBUGQRVLIPCFW-BXOOBUKZSA-N	588.29478504							108763
BRD-K81992781-001-01-8	LSM-20163	BRD-K81992781	44497849	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15+,20+/m1/s1	RAWZADNKXQBMBA-SIFCLUCFSA-N	CNC[C@@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K81992781	BRD-K81992781-001-01-8	Broad Institute of MIT and Harvard	BRD-K81992781			CNC[C@@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15+,20+/m1/s1	RAWZADNKXQBMBA-SIFCLUCFSA-N	465.173369916							108764
BRD-K00135177-001-01-4	LSM-20164	BRD-K00135177	44499480	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15-,20+/m1/s1	RAWZADNKXQBMBA-SXGZJXTBSA-N	CNC[C@@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K00135177	BRD-K00135177-001-01-4	Broad Institute of MIT and Harvard	BRD-K00135177			CNC[C@@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15-,20+/m1/s1	RAWZADNKXQBMBA-SXGZJXTBSA-N	465.173369916							108765
BRD-K84790105	LSM-20165		44503957	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20-,27-/m0/s1	FITMUQCJUCLPTO-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4c(C)onc4C)cc3CC1=O	BroadT	BRD-K84790105	BRD-K84790105-001-01-2	Broad Institute of MIT and Harvard	BRD-K84790105			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3c(C)noc3C)cc2CC1=O	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20-,27-/m0/s1	FITMUQCJUCLPTO-OSOCVKALSA-N	576.298155858							108766
BRD-K48987279	LSM-20166		44492979	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17+,22-/m1/s1	FXDXYRRSNQUVQL-HYFFOGBASA-N	CNC[C@H]1Oc2c(NC(=O)c3ccc(cc3)c4nccs4)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K48987279	BRD-K48987279-001-01-9	Broad Institute of MIT and Harvard	BRD-K48987279			CNC[C@H]1Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17+,22-/m1/s1	FXDXYRRSNQUVQL-HYFFOGBASA-N	494.19877617							108767
BRD-K75325409	LSM-20167		44485592	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18+,23-/m0/s1	BMWRPMHXUFNAQO-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K75325409	BRD-K75325409-001-01-1	Broad Institute of MIT and Harvard	BRD-K75325409			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18+,23-/m0/s1	BMWRPMHXUFNAQO-IXFSTUDKSA-N	466.258005608							108768
BRD-K67632894	LSM-20168		44497516	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13+,17-/m1/s1	COTDYGDWXSSLGS-IIYDPXPESA-N	CNC[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K67632894	BRD-K67632894-001-01-2	Broad Institute of MIT and Harvard	BRD-K67632894			CNC[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13+,17-/m1/s1	COTDYGDWXSSLGS-IIYDPXPESA-N	375.215806438							108769
BRD-K20039572	LSM-20169		54613820	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15+,21-/m0/s1	LUEPMRNQGZCFGP-ZSDSOXJFSA-N	CNC[C@@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K20039572	BRD-K20039572-001-01-5	Broad Institute of MIT and Harvard	BRD-K20039572			CNC[C@@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15+,21-/m0/s1	LUEPMRNQGZCFGP-ZSDSOXJFSA-N	470.21653472							108770
BRD-K10048365	LSM-20170		54613818	InChI=1S/C33H39N7O5/c1-23-17-40(24(2)21-41)33(43)16-26-15-27(35-32(42)20-39-22-34-36-37-39)11-14-30(26)45-31(23)19-38(3)18-25-9-12-29(13-10-25)44-28-7-5-4-6-8-28/h4-15,22-24,31,41H,16-21H2,1-3H3,(H,35,42)/t23-,24+,31+/m1/s1	PROAVNUGSAEHPP-OXYPMYLPSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(NC(=O)Cn5cnnn5)cc4CC1=O	BroadT	BRD-K10048365	BRD-K10048365-001-01-9	Broad Institute of MIT and Harvard	BRD-K10048365			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	InChI=1S/C33H39N7O5/c1-23-17-40(24(2)21-41)33(43)16-26-15-27(35-32(42)20-39-22-34-36-37-39)11-14-30(26)45-31(23)19-38(3)18-25-9-12-29(13-10-25)44-28-7-5-4-6-8-28/h4-15,22-24,31,41H,16-21H2,1-3H3,(H,35,42)/t23-,24+,31+/m1/s1	PROAVNUGSAEHPP-OXYPMYLPSA-N	613.301267418							108771
BRD-K19580273	LSM-20171		44486245	InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)23-13-9-15-25(31(3)4)27(23)37-26(19)17-32(5)29(36)30-24-14-8-11-21-10-6-7-12-22(21)24/h6-15,19-20,26,34H,16-18H2,1-5H3,(H,30,36)/t19-,20+,26-/m1/s1	QINKYHPKCUNNMN-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K19580273	BRD-K19580273-001-01-3	Broad Institute of MIT and Harvard	BRD-K19580273			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)23-13-9-15-25(31(3)4)27(23)37-26(19)17-32(5)29(36)30-24-14-8-11-21-10-6-7-12-22(21)24/h6-15,19-20,26,34H,16-18H2,1-5H3,(H,30,36)/t19-,20+,26-/m1/s1	QINKYHPKCUNNMN-BVFVYWQFSA-N	504.273655672							108772
BRD-K00773626	LSM-20172		44490837	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)16-7-6-8-17(20(16)31-18(12)9-23-5)24-22(30)25-19-14(3)26-32-15(19)4/h6-8,12-13,18,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13-,18-/m0/s1	MPDMLCBONFVZSW-LXIYXOSZSA-N	CNC[C@@H]1Oc2c(NC(=O)Nc3c(C)onc3C)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K00773626	BRD-K00773626-001-01-9	Broad Institute of MIT and Harvard	BRD-K00773626			CNC[C@@H]1Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)16-7-6-8-17(20(16)31-18(12)9-23-5)24-22(30)25-19-14(3)26-32-15(19)4/h6-8,12-13,18,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13-,18-/m0/s1	MPDMLCBONFVZSW-LXIYXOSZSA-N	445.232519142							108773
BRD-K14251637	LSM-20173		44619987	InChI=1S/C29H35F3N4O7/c1-17-13-36(18(2)15-37)27(39)11-19-10-20(33-26(38)8-9-29(30,31)32)4-6-22(19)43-25(17)14-35(3)28(40)34-21-5-7-23-24(12-21)42-16-41-23/h4-7,10,12,17-18,25,37H,8-9,11,13-16H2,1-3H3,(H,33,38)(H,34,40)/t17-,18+,25+/m1/s1	PUSPJJJYURZHGK-UZEJHQAJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCC(F)(F)F)cc4CC1=O	BroadT	BRD-K14251637	BRD-K14251637-001-01-7	Broad Institute of MIT and Harvard	BRD-K14251637			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C29H35F3N4O7/c1-17-13-36(18(2)15-37)27(39)11-19-10-20(33-26(38)8-9-29(30,31)32)4-6-22(19)43-25(17)14-35(3)28(40)34-21-5-7-23-24(12-21)42-16-41-23/h4-7,10,12,17-18,25,37H,8-9,11,13-16H2,1-3H3,(H,33,38)(H,34,40)/t17-,18+,25+/m1/s1	PUSPJJJYURZHGK-UZEJHQAJSA-N	608.2457841							108774
BRD-K99800590	LSM-20174		44503119	InChI=1S/C30H50N4O4/c1-22-18-34(23(2)21-35)30(37)17-25-16-26(31-29(36)12-9-15-32(3)4)13-14-27(25)38-28(22)20-33(5)19-24-10-7-6-8-11-24/h13-14,16,22-24,28,35H,6-12,15,17-21H2,1-5H3,(H,31,36)/t22-,23-,28+/m0/s1	XTYMFXBEGHIJAG-UXWDXCIHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)CCCN(C)C)cc3CC1=O	BroadT	BRD-K99800590	BRD-K99800590-001-01-4	Broad Institute of MIT and Harvard	BRD-K99800590			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)CCCN(C)C)cc2CC1=O	InChI=1S/C30H50N4O4/c1-22-18-34(23(2)21-35)30(37)17-25-16-26(31-29(36)12-9-15-32(3)4)13-14-27(25)38-28(22)20-33(5)19-24-10-7-6-8-11-24/h13-14,16,22-24,28,35H,6-12,15,17-21H2,1-5H3,(H,31,36)/t22-,23-,28+/m0/s1	XTYMFXBEGHIJAG-UXWDXCIHSA-N	530.38320612							108775
BRD-K27782186	LSM-20175		44503475	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)31(38)17-25-16-27(34-32(39)33-26-10-13-28(40-4)14-11-26)12-15-29(25)41-30(22)20-35(3)19-24-8-6-5-7-9-24/h10-16,22-24,30,37H,5-9,17-21H2,1-4H3,(H2,33,34,39)/t22-,23-,30-/m1/s1	QTHBIZIZCLMCFV-IQLGONJTSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)CC4CCCCC4)[C@H](C)CN([C@H](C)CO)C(=O)Cc3c2)cc1	BroadT	BRD-K27782186	BRD-K27782186-001-01-1	Broad Institute of MIT and Harvard	BRD-K27782186			COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)CC4CCCCC4)[C@H](C)CN([C@H](C)CO)C(=O)Cc3c2)cc1	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)31(38)17-25-16-27(34-32(39)33-26-10-13-28(40-4)14-11-26)12-15-29(25)41-30(22)20-35(3)19-24-8-6-5-7-9-24/h10-16,22-24,30,37H,5-9,17-21H2,1-4H3,(H2,33,34,39)/t22-,23-,30-/m1/s1	QTHBIZIZCLMCFV-IQLGONJTSA-N	566.346820612							108776
BRD-K62888534	LSM-20176		44485585	InChI=1S/C20H29N5O5S/c1-13-9-25(14(2)11-26)20(27)15-6-5-7-16(19(15)30-17(13)8-21-3)23-31(28,29)18-10-24(4)12-22-18/h5-7,10,12-14,17,21,23,26H,8-9,11H2,1-4H3/t13-,14+,17-/m0/s1	KOTZITAVGRXIOH-VBQJREDUSA-N	CNC[C@@H]1Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K62888534	BRD-K62888534-001-01-1	Broad Institute of MIT and Harvard	BRD-K62888534			CNC[C@@H]1Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C20H29N5O5S/c1-13-9-25(14(2)11-26)20(27)15-6-5-7-16(19(15)30-17(13)8-21-3)23-31(28,29)18-10-24(4)12-22-18/h5-7,10,12-14,17,21,23,26H,8-9,11H2,1-4H3/t13-,14+,17-/m0/s1	KOTZITAVGRXIOH-VBQJREDUSA-N	451.188939768							108777
BRD-K85162396	LSM-20177		44495426	InChI=1S/C30H41ClN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h9-15,20-21,24,28,36H,4-8,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28+/m0/s1	XMVMBOAJKPBQKX-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3ccc(NC(=O)NC4CCCCC4)cc3CC1=O	BroadT	BRD-K85162396	BRD-K85162396-001-01-1	Broad Institute of MIT and Harvard	BRD-K85162396			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)NC3CCCCC3)cc2CC1=O	InChI=1S/C30H41ClN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h9-15,20-21,24,28,36H,4-8,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28+/m0/s1	XMVMBOAJKPBQKX-YHGPEZAFSA-N	620.243533472							108778
BRD-K22420708	LSM-20178		44501194	InChI=1S/C26H37N3O6S/c1-18-15-29(19(2)17-30)26(31)14-20-13-21(27(3)4)7-12-24(20)35-25(18)16-28(5)36(32,33)23-10-8-22(34-6)9-11-23/h7-13,18-19,25,30H,14-17H2,1-6H3/t18-,19+,25-/m1/s1	JDKUWABUTZZKAJ-HHJKRLRDSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2Oc3ccc(cc3CC(=O)N(C[C@H]2C)[C@@H](C)CO)N(C)C	BroadT	BRD-K22420708	BRD-K22420708-001-01-2	Broad Institute of MIT and Harvard	BRD-K22420708			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1Oc2ccc(cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C26H37N3O6S/c1-18-15-29(19(2)17-30)26(31)14-20-13-21(27(3)4)7-12-24(20)35-25(18)16-28(5)36(32,33)23-10-8-22(34-6)9-11-23/h7-13,18-19,25,30H,14-17H2,1-6H3/t18-,19+,25-/m1/s1	JDKUWABUTZZKAJ-HHJKRLRDSA-N	519.240306624							108779
BRD-K03821002	LSM-20179		44499618	InChI=1S/C26H34N4O6/c1-16-12-30(17(2)14-31)25(32)19-7-6-8-20(28(3)4)24(19)36-23(16)13-29(5)26(33)27-18-9-10-21-22(11-18)35-15-34-21/h6-11,16-17,23,31H,12-15H2,1-5H3,(H,27,33)/t16-,17-,23-/m1/s1	DFCREXDAKHJSKD-SEPYTNNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K03821002	BRD-K03821002-001-01-7	Broad Institute of MIT and Harvard	BRD-K03821002			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H34N4O6/c1-16-12-30(17(2)14-31)25(32)19-7-6-8-20(28(3)4)24(19)36-23(16)13-29(5)26(33)27-18-9-10-21-22(11-18)35-15-34-21/h6-11,16-17,23,31H,12-15H2,1-5H3,(H,27,33)/t16-,17-,23-/m1/s1	DFCREXDAKHJSKD-SEPYTNNBSA-N	498.247834848							108780
BRD-K36848506	LSM-20180		44490298	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23+,29-/m0/s1	JWXWRTLQHUTWJR-CTWZREHQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K36848506	BRD-K36848506-001-01-2	Broad Institute of MIT and Harvard	BRD-K36848506			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23+,29-/m0/s1	JWXWRTLQHUTWJR-CTWZREHQSA-N	564.331170548							108781
BRD-K19429335	LSM-20181		44493051	InChI=1S/C21H31N7O4/c1-14-9-28(15(2)12-29)21(31)8-16-7-17(23-20(30)11-27-13-22-24-25-27)5-6-18(16)32-19(14)10-26(3)4/h5-7,13-15,19,29H,8-12H2,1-4H3,(H,23,30)/t14-,15-,19+/m0/s1	FEGVFSOLSHLDDV-YZVOILCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	BroadT	BRD-K19429335	BRD-K19429335-001-01-9	Broad Institute of MIT and Harvard	BRD-K19429335			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	InChI=1S/C21H31N7O4/c1-14-9-28(15(2)12-29)21(31)8-16-7-17(23-20(30)11-27-13-22-24-25-27)5-6-18(16)32-19(14)10-26(3)4/h5-7,13-15,19,29H,8-12H2,1-4H3,(H,23,30)/t14-,15-,19+/m0/s1	FEGVFSOLSHLDDV-YZVOILCLSA-N	445.243752542							108782
BRD-K31300534	LSM-20182		44494056	InChI=1S/C33H40N4O7/c1-21-16-37(22(2)19-38)32(39)14-24-13-25(34-33(40)35-26-8-12-29-30(15-26)43-20-42-29)7-11-28(24)44-31(21)18-36(3)17-23-5-9-27(41-4)10-6-23/h5-13,15,21-22,31,38H,14,16-20H2,1-4H3,(H2,34,35,40)/t21-,22-,31-/m0/s1	VJXHRMPDQSPMOP-CYYCZYJVSA-N	COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)Nc4ccc5OCOc5c4)cc3CC(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K31300534	BRD-K31300534-001-01-5	Broad Institute of MIT and Harvard	BRD-K31300534			COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)Nc4ccc5OCOc5c4)cc3CC(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C33H40N4O7/c1-21-16-37(22(2)19-38)32(39)14-24-13-25(34-33(40)35-26-8-12-29-30(15-26)43-20-42-29)7-11-28(24)44-31(21)18-36(3)17-23-5-9-27(41-4)10-6-23/h5-13,15,21-22,31,38H,14,16-20H2,1-4H3,(H2,34,35,40)/t21-,22-,31-/m0/s1	VJXHRMPDQSPMOP-CYYCZYJVSA-N	604.28969966							108783
BRD-K19830171	LSM-20183		44498515	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28-/m0/s1	WWNAWZZZIRHUSD-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)Nc4ccccc4)cc3CC1=O	BroadT	BRD-K19830171	BRD-K19830171-001-01-5	Broad Institute of MIT and Harvard	BRD-K19830171			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28-/m0/s1	WWNAWZZZIRHUSD-CZBREUMFSA-N	598.22613377							108784
BRD-K42976515	LSM-20184		44486302	InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18-,22+/m1/s1	QKNVOCCOOAXREN-HMFYCAOWSA-N	CNC[C@@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K42976515	BRD-K42976515-001-01-2	Broad Institute of MIT and Harvard	BRD-K42976515			CNC[C@@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18-,22+/m1/s1	QKNVOCCOOAXREN-HMFYCAOWSA-N	462.284220356							108785
MLS002474139	LSM-20185	BRD-K01100412, SID85201694	44202778	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)30-22-13-9-12-21-24(22)37-23(18(3)14-32(25(21)34)19(4)16-33)15-31(5)27(36)29-20-10-7-6-8-11-20/h6-13,17-19,23,33H,14-16H2,1-5H3,(H,29,36)(H2,28,30,35)/t18-,19+,23+/m0/s1	FNAJZGJPYUNJBY-YCRNBWNJSA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@H](C)[C@@H](CN(C)C(=O)Nc3ccccc3)Oc12)[C@H](C)CO	BroadT	BRD-K01100412	BRD-K01100412-001-02-0	Broad Institute of MIT and Harvard	BRD-K01100412			CC(C)NC(=O)Nc1cccc2C(=O)N([C@H](C)CO)C[C@H](C)[C@@H](CN(C)C(=O)Nc3ccccc3)Oc12	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)30-22-13-9-12-21-24(22)37-23(18(3)14-32(25(21)34)19(4)16-33)15-31(5)27(36)29-20-10-7-6-8-11-20/h6-13,17-19,23,33H,14-16H2,1-5H3,(H,29,36)(H2,28,30,35)/t18-,19+,23+/m0/s1	FNAJZGJPYUNJBY-YCRNBWNJSA-N	511.279469334							108786
BRD-K54247106	LSM-20186		44486237	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14+,18-/m0/s1	TWHSADQACYCNBZ-IYOUNJFTSA-N	CNC[C@@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K54247106	BRD-K54247106-001-01-8	Broad Institute of MIT and Harvard	BRD-K54247106			CNC[C@@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14+,18-/m0/s1	TWHSADQACYCNBZ-IYOUNJFTSA-N	413.206304394							108787
BRD-K32918816	LSM-20187		44499226	InChI=1S/C26H35N3O5/c1-17-12-29(18(2)15-30)26(31)20-7-6-8-21(27(3)4)25(20)34-24(17)14-28(5)13-19-9-10-22-23(11-19)33-16-32-22/h6-11,17-18,24,30H,12-16H2,1-5H3/t17-,18-,24-/m1/s1	MTQIGCHWPBYMPN-QZTZHPFYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K32918816	BRD-K32918816-001-01-2	Broad Institute of MIT and Harvard	BRD-K32918816			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H35N3O5/c1-17-12-29(18(2)15-30)26(31)20-7-6-8-21(27(3)4)25(20)34-24(17)14-28(5)13-19-9-10-22-23(11-19)33-16-32-22/h6-11,17-18,24,30H,12-16H2,1-5H3/t17-,18-,24-/m1/s1	MTQIGCHWPBYMPN-QZTZHPFYSA-N	469.25767125							108788
BRD-K47098496	LSM-20188		44504643	InChI=1S/C28H35Cl2N5O5S/c1-18-12-35(19(2)16-36)28(37)11-21-10-22(32-41(38,39)27-15-34(4)17-31-27)6-8-25(21)40-26(18)14-33(3)13-20-5-7-23(29)24(30)9-20/h5-10,15,17-19,26,32,36H,11-14,16H2,1-4H3/t18-,19-,26+/m1/s1	VWQPHETXZDMYNJ-UDCNLSRBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NS(=O)(=O)c4cn(C)cn4)cc3CC1=O	BroadT	BRD-K47098496	BRD-K47098496-001-01-3	Broad Institute of MIT and Harvard	BRD-K47098496			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC1=O	InChI=1S/C28H35Cl2N5O5S/c1-18-12-35(19(2)16-36)28(37)11-21-10-22(32-41(38,39)27-15-34(4)17-31-27)6-8-25(21)40-26(18)14-33(3)13-20-5-7-23(29)24(30)9-20/h5-10,15,17-19,26,32,36H,11-14,16H2,1-4H3/t18-,19-,26+/m1/s1	VWQPHETXZDMYNJ-UDCNLSRBSA-N	623.17359538							108789
BRD-K79370508	LSM-20189		44497230	InChI=1S/C29H41FN4O6S/c1-20-17-34(21(2)19-35)29(37)16-22-15-24(31-28(36)7-6-14-32(3)4)10-13-26(22)40-27(20)18-33(5)41(38,39)25-11-8-23(30)9-12-25/h8-13,15,20-21,27,35H,6-7,14,16-19H2,1-5H3,(H,31,36)/t20-,21-,27-/m0/s1	QROKXOKLOVAMIJ-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)CCCN(C)C)cc3CC1=O	BroadT	BRD-K79370508	BRD-K79370508-001-01-3	Broad Institute of MIT and Harvard	BRD-K79370508			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)CCCN(C)C)cc2CC1=O	InChI=1S/C29H41FN4O6S/c1-20-17-34(21(2)19-35)29(37)16-22-15-24(31-28(36)7-6-14-32(3)4)10-13-26(22)40-27(20)18-33(5)41(38,39)25-11-8-23(30)9-12-25/h8-13,15,20-21,27,35H,6-7,14,16-19H2,1-5H3,(H,31,36)/t20-,21-,27-/m0/s1	QROKXOKLOVAMIJ-IZVMNLJQSA-N	592.273083962							108790
BRD-K99978187	LSM-20190		44493542	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23-,29-/m0/s1	JWXWRTLQHUTWJR-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K99978187	BRD-K99978187-001-01-7	Broad Institute of MIT and Harvard	BRD-K99978187			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23-,29-/m0/s1	JWXWRTLQHUTWJR-BOSRLCDASA-N	564.331170548							108791
BRD-K15898103	LSM-20191		44493025	InChI=1S/C27H36F3N3O3/c1-18-14-33(19(2)17-34)26(35)13-21-12-23(31(3)4)10-11-24(21)36-25(18)16-32(5)15-20-6-8-22(9-7-20)27(28,29)30/h6-12,18-19,25,34H,13-17H2,1-5H3/t18-,19-,25-/m0/s1	RAYQZOVLGJUDGR-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K15898103	BRD-K15898103-001-01-9	Broad Institute of MIT and Harvard	BRD-K15898103			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C27H36F3N3O3/c1-18-14-33(19(2)17-34)26(35)13-21-12-23(31(3)4)10-11-24(21)36-25(18)16-32(5)15-20-6-8-22(9-7-20)27(28,29)30/h6-12,18-19,25,34H,13-17H2,1-5H3/t18-,19-,25-/m0/s1	RAYQZOVLGJUDGR-MHPIHPPYSA-N	507.270876642							108792
BRD-K08829593	LSM-20192		44506715	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,29+/m0/s1	SREUWAAPQJIJAQ-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K08829593	BRD-K08829593-001-01-0	Broad Institute of MIT and Harvard	BRD-K08829593			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,29+/m0/s1	SREUWAAPQJIJAQ-DKGMKSHISA-N	559.315854842							108793
BRD-K27320944	LSM-20193		44497892	InChI=1S/C30H41FN4O4/c1-20-16-35(21(2)19-36)29(37)25-10-7-11-26(33-30(38)32-24-14-12-23(31)13-15-24)28(25)39-27(20)18-34(3)17-22-8-5-4-6-9-22/h7,10-15,20-22,27,36H,4-6,8-9,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,27+/m0/s1	COSGGAMFLVSIQD-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)Nc4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K27320944	BRD-K27320944-001-01-3	Broad Institute of MIT and Harvard	BRD-K27320944			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)Nc3ccc(F)cc3)cccc2C1=O	InChI=1S/C30H41FN4O4/c1-20-16-35(21(2)19-36)29(37)25-10-7-11-26(33-30(38)32-24-14-12-23(31)13-15-24)28(25)39-27(20)18-34(3)17-22-8-5-4-6-9-22/h7,10-15,20-22,27,36H,4-6,8-9,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,27+/m0/s1	COSGGAMFLVSIQD-NOMHHCBYSA-N	540.311184032							108794
BRD-K57035236	LSM-20194		44500321	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18-,23-/m0/s1	ZIGDOLRJGHLEBT-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K57035236	BRD-K57035236-001-01-7	Broad Institute of MIT and Harvard	BRD-K57035236			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18-,23-/m0/s1	ZIGDOLRJGHLEBT-BSRJHKFKSA-N	490.224990918							108795
BRD-K67626198-001-01-7	LSM-20195	BRD-K67626198	44497929	InChI=1S/C30H36N4O6S/c1-20-13-15-24(16-14-20)41(38,39)33(4)18-27-21(2)17-34(22(3)19-35)29(36)25-11-8-12-26(28(25)40-27)32-30(37)31-23-9-6-5-7-10-23/h5-16,21-22,27,35H,17-19H2,1-4H3,(H2,31,32,37)/t21-,22+,27-/m0/s1	KABIQBXSOPPDGJ-XXAUWVGASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3c(NC(=O)Nc4ccccc4)cccc3C1=O	BroadT	BRD-K67626198	BRD-K67626198-001-01-7	Broad Institute of MIT and Harvard	BRD-K67626198			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	InChI=1S/C30H36N4O6S/c1-20-13-15-24(16-14-20)41(38,39)33(4)18-27-21(2)17-34(22(3)19-35)29(36)25-11-8-12-26(28(25)40-27)32-30(37)31-23-9-6-5-7-10-23/h5-16,21-22,27,35H,17-19H2,1-4H3,(H2,31,32,37)/t21-,22+,27-/m0/s1	KABIQBXSOPPDGJ-XXAUWVGASA-N	580.235555602							108796
BRD-K92929998	LSM-20196		44490760	InChI=1S/C22H36N4O4/c1-15-13-26(16(2)14-27)22(29)18-11-17(24-21(28)7-6-10-25(4)5)8-9-19(18)30-20(15)12-23-3/h8-9,11,15-16,20,23,27H,6-7,10,12-14H2,1-5H3,(H,24,28)/t15-,16-,20-/m0/s1	YREQKLPEMWXCQY-FTRWYGJKSA-N	CNC[C@@H]1Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K92929998	BRD-K92929998-001-01-6	Broad Institute of MIT and Harvard	BRD-K92929998			CNC[C@@H]1Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C22H36N4O4/c1-15-13-26(16(2)14-27)22(29)18-11-17(24-21(28)7-6-10-25(4)5)8-9-19(18)30-20(15)12-23-3/h8-9,11,15-16,20,23,27H,6-7,10,12-14H2,1-5H3,(H,24,28)/t15-,16-,20-/m0/s1	YREQKLPEMWXCQY-FTRWYGJKSA-N	420.273655672							108797
BRD-K07667606	LSM-20197		44496817	InChI=1S/C25H31F3N4O4/c1-15-13-32(16(2)14-33)23(34)11-17-10-20(8-9-21(17)36-22(15)12-29-3)31-24(35)30-19-6-4-18(5-7-19)25(26,27)28/h4-10,15-16,22,29,33H,11-14H2,1-3H3,(H2,30,31,35)/t15-,16-,22-/m1/s1	NMJAJKSBHFWFOJ-XCGNWRKASA-N	CNC[C@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K07667606	BRD-K07667606-001-01-0	Broad Institute of MIT and Harvard	BRD-K07667606			CNC[C@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C25H31F3N4O4/c1-15-13-32(16(2)14-33)23(34)11-17-10-20(8-9-21(17)36-22(15)12-29-3)31-24(35)30-19-6-4-18(5-7-19)25(26,27)28/h4-10,15-16,22,29,33H,11-14H2,1-3H3,(H2,30,31,35)/t15-,16-,22-/m1/s1	NMJAJKSBHFWFOJ-XCGNWRKASA-N	508.229740112							108798
MLS002473821	LSM-20198	BRD-K07300437, SID85201351	44202435	InChI=1S/C22H35N3O5S/c1-15-11-25(16(2)14-26)22(27)10-18-9-19(23-31(4,28)29)7-8-20(18)30-21(15)13-24(3)12-17-5-6-17/h7-9,15-17,21,23,26H,5-6,10-14H2,1-4H3/t15-,16-,21+/m0/s1	LKTOUOMEFKMKTF-CKJXQJPGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K07300437	BRD-K07300437-001-01-3	Broad Institute of MIT and Harvard	BRD-K07300437			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C22H35N3O5S/c1-15-11-25(16(2)14-26)22(27)10-18-9-19(23-31(4,28)29)7-8-20(18)30-21(15)13-24(3)12-17-5-6-17/h7-9,15-17,21,23,26H,5-6,10-14H2,1-4H3/t15-,16-,21+/m0/s1	LKTOUOMEFKMKTF-CKJXQJPGSA-N	453.22974194							108799
BRD-K07939054	LSM-20199		44500550	InChI=1S/C32H44N4O7/c1-22-17-36(23(2)20-37)32(39)16-25-15-26(33-31(38)8-9-35-10-12-40-13-11-35)5-7-27(25)43-30(22)19-34(3)18-24-4-6-28-29(14-24)42-21-41-28/h4-7,14-15,22-23,30,37H,8-13,16-21H2,1-3H3,(H,33,38)/t22-,23-,30-/m0/s1	NYPOLWMMHTZHKU-ZRLASMASSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCN5CCOCC5)cc4CC1=O	BroadT	BRD-K07939054	BRD-K07939054-001-01-0	Broad Institute of MIT and Harvard	BRD-K07939054			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC1=O	InChI=1S/C32H44N4O7/c1-22-17-36(23(2)20-37)32(39)16-25-15-26(33-31(38)8-9-35-10-12-40-13-11-35)5-7-27(25)43-30(22)19-34(3)18-24-4-6-28-29(14-24)42-21-41-28/h4-7,14-15,22-23,30,37H,8-13,16-21H2,1-3H3,(H,33,38)/t22-,23-,30-/m0/s1	NYPOLWMMHTZHKU-ZRLASMASSA-N	596.320999788							108800
BRD-K16190564	LSM-20200		44504176	InChI=1S/C25H36F3N3O4/c1-16-12-31(17(2)15-32)24(34)11-19-10-20(29-23(33)8-9-25(26,27)28)6-7-21(19)35-22(16)14-30(3)13-18-4-5-18/h6-7,10,16-18,22,32H,4-5,8-9,11-15H2,1-3H3,(H,29,33)/t16-,17-,22+/m0/s1	OWJOIEFDHRCHNY-PNLZDCPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC1=O	BroadT	BRD-K16190564	BRD-K16190564-001-01-2	Broad Institute of MIT and Harvard	BRD-K16190564			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C25H36F3N3O4/c1-16-12-31(17(2)15-32)24(34)11-19-10-20(29-23(33)8-9-25(26,27)28)6-7-21(19)35-22(16)14-30(3)13-18-4-5-18/h6-7,10,16-18,22,32H,4-5,8-9,11-15H2,1-3H3,(H,29,33)/t16-,17-,22+/m0/s1	OWJOIEFDHRCHNY-PNLZDCPESA-N	499.265791262							108801
BRD-K42126155	LSM-20201		44501645	InChI=1S/C32H44N4O7/c1-22-17-36(23(2)20-37)32(39)16-25-15-26(33-31(38)8-9-35-10-12-40-13-11-35)5-7-27(25)43-30(22)19-34(3)18-24-4-6-28-29(14-24)42-21-41-28/h4-7,14-15,22-23,30,37H,8-13,16-21H2,1-3H3,(H,33,38)/t22-,23-,30+/m1/s1	NYPOLWMMHTZHKU-JWUQWVJQSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCN5CCOCC5)cc4CC1=O	BroadT	BRD-K42126155	BRD-K42126155-001-01-9	Broad Institute of MIT and Harvard	BRD-K42126155			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC1=O	InChI=1S/C32H44N4O7/c1-22-17-36(23(2)20-37)32(39)16-25-15-26(33-31(38)8-9-35-10-12-40-13-11-35)5-7-27(25)43-30(22)19-34(3)18-24-4-6-28-29(14-24)42-21-41-28/h4-7,14-15,22-23,30,37H,8-13,16-21H2,1-3H3,(H,33,38)/t22-,23-,30+/m1/s1	NYPOLWMMHTZHKU-JWUQWVJQSA-N	596.320999788							108802
BRD-K82102697	LSM-20202		44484498	InChI=1S/C25H32N4O6/c1-15-12-29(16(2)13-30)24(31)9-17-8-18(4-6-20(17)35-23(15)11-26-3)27-25(32)28-19-5-7-21-22(10-19)34-14-33-21/h4-8,10,15-16,23,26,30H,9,11-14H2,1-3H3,(H2,27,28,32)/t15-,16-,23-/m1/s1	BRYKRAAGJVMQDR-CKNGIIGNSA-N	CNC[C@H]1Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K82102697	BRD-K82102697-001-01-6	Broad Institute of MIT and Harvard	BRD-K82102697			CNC[C@H]1Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C25H32N4O6/c1-15-12-29(16(2)13-30)24(31)9-17-8-18(4-6-20(17)35-23(15)11-26-3)27-25(32)28-19-5-7-21-22(10-19)34-14-33-21/h4-8,10,15-16,23,26,30H,9,11-14H2,1-3H3,(H2,27,28,32)/t15-,16-,23-/m1/s1	BRYKRAAGJVMQDR-CKNGIIGNSA-N	484.232184784							108803
BRD-K84761515	LSM-20203		44504812	InChI=1S/C27H35N3O6S/c1-18-15-30(19(2)17-31)26(32)14-21-13-22(28-27(33)20-9-10-20)11-12-24(21)36-25(18)16-29(3)37(34,35)23-7-5-4-6-8-23/h4-8,11-13,18-20,25,31H,9-10,14-17H2,1-3H3,(H,28,33)/t18-,19-,25-/m1/s1	MWSPHKIBVREWDU-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(NC(=O)C4CC4)cc3CC1=O	BroadT	BRD-K84761515	BRD-K84761515-001-01-7	Broad Institute of MIT and Harvard	BRD-K84761515			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(NC(=O)C3CC3)cc2CC1=O	InChI=1S/C27H35N3O6S/c1-18-15-30(19(2)17-31)26(32)14-21-13-22(28-27(33)20-9-10-20)11-12-24(21)36-25(18)16-29(3)37(34,35)23-7-5-4-6-8-23/h4-8,11-13,18-20,25,31H,9-10,14-17H2,1-3H3,(H,28,33)/t18-,19-,25-/m1/s1	MWSPHKIBVREWDU-MPCDZSKCSA-N	529.22465656							108804
BRD-K39020351	LSM-20204		44491539	InChI=1S/C32H37F3N4O5/c1-20-17-39(21(2)19-40)30(42)16-23-15-24(36-29(41)13-14-32(33,34)35)11-12-27(23)44-28(20)18-38(3)31(43)37-26-10-6-8-22-7-4-5-9-25(22)26/h4-12,15,20-21,28,40H,13-14,16-19H2,1-3H3,(H,36,41)(H,37,43)/t20-,21+,28+/m0/s1	QFRXUVVOSLWYNG-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)CCC(F)(F)F)cc4CC1=O	BroadT	BRD-K39020351	BRD-K39020351-001-01-1	Broad Institute of MIT and Harvard	BRD-K39020351			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C32H37F3N4O5/c1-20-17-39(21(2)19-40)30(42)16-23-15-24(36-29(41)13-14-32(33,34)35)11-12-27(23)44-28(20)18-38(3)31(43)37-26-10-6-8-22-7-4-5-9-25(22)26/h4-12,15,20-21,28,40H,13-14,16-19H2,1-3H3,(H,36,41)(H,37,43)/t20-,21+,28+/m0/s1	QFRXUVVOSLWYNG-BALWLHIASA-N	614.271604924							108805
BRD-K74927219	LSM-20205		44501277	InChI=1S/C31H38F3N5O5/c1-18-14-39(19(2)17-40)28(41)13-23-12-25(35-30(42)36-29-20(3)37-44-21(29)4)10-11-26(23)43-27(18)16-38(5)15-22-6-8-24(9-7-22)31(32,33)34/h6-12,18-19,27,40H,13-17H2,1-5H3,(H2,35,36,42)/t18-,19-,27+/m1/s1	XNWPWURMKBHVTJ-KFDHSVMUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3CC1=O	BroadT	BRD-K74927219	BRD-K74927219-001-01-5	Broad Institute of MIT and Harvard	BRD-K74927219			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2CC1=O	InChI=1S/C31H38F3N5O5/c1-18-14-39(19(2)17-40)28(41)13-23-12-25(35-30(42)36-29-20(3)37-44-21(29)4)10-11-26(23)43-27(18)16-38(5)15-22-6-8-24(9-7-22)31(32,33)34/h6-12,18-19,27,40H,13-17H2,1-5H3,(H2,35,36,42)/t18-,19-,27+/m1/s1	XNWPWURMKBHVTJ-KFDHSVMUSA-N	617.282503966							108806
BRD-K67484361	LSM-20206		44492964	InChI=1S/C30H37F3N4O6/c1-18-15-37(19(2)17-38)28(40)23-5-4-6-24(35-27(39)20-11-13-42-14-12-20)26(23)43-25(18)16-36(3)29(41)34-22-9-7-21(8-10-22)30(31,32)33/h4-10,18-20,25,38H,11-17H2,1-3H3,(H,34,41)(H,35,39)/t18-,19+,25-/m0/s1	TZPMNVZBAPWBQT-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)C4CCOCC4)cccc3C1=O	BroadT	BRD-K67484361	BRD-K67484361-001-01-2	Broad Institute of MIT and Harvard	BRD-K67484361			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C30H37F3N4O6/c1-18-15-37(19(2)17-38)28(40)23-5-4-6-24(35-27(39)20-11-13-42-14-12-20)26(23)43-25(18)16-36(3)29(41)34-22-9-7-21(8-10-22)30(31,32)33/h4-10,18-20,25,38H,11-17H2,1-3H3,(H,34,41)(H,35,39)/t18-,19+,25-/m0/s1	TZPMNVZBAPWBQT-CEYNDMKZSA-N	606.266519544							108807
BRD-K54657536	LSM-20207		44501223	InChI=1S/C26H42N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h11-13,18-19,21,24,31H,6-10,14-17H2,1-5H3,(H,27,33)/t18-,19-,24-/m1/s1	NUQLUNTVVQHOLK-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K54657536	BRD-K54657536-001-01-8	Broad Institute of MIT and Harvard	BRD-K54657536			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C26H42N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h11-13,18-19,21,24,31H,6-10,14-17H2,1-5H3,(H,27,33)/t18-,19-,24-/m1/s1	NUQLUNTVVQHOLK-KHCICDEESA-N	474.320605864							108808
BRD-K05050615	LSM-20208		44488079	InChI=1S/C29H37N3O6/c1-18-13-32(19(2)16-33)28(34)12-22-11-23(30-29(35)21-5-6-21)7-9-24(22)38-27(18)15-31(3)14-20-4-8-25-26(10-20)37-17-36-25/h4,7-11,18-19,21,27,33H,5-6,12-17H2,1-3H3,(H,30,35)/t18-,19-,27-/m1/s1	WXJCYEGRNWVSCE-DRGJWEBESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)C5CC5)cc4CC1=O	BroadT	BRD-K05050615	BRD-K05050615-001-01-0	Broad Institute of MIT and Harvard	BRD-K05050615			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)C3CC3)cc2CC1=O	InChI=1S/C29H37N3O6/c1-18-13-32(19(2)16-33)28(34)12-22-11-23(30-29(35)21-5-6-21)7-9-24(22)38-27(18)15-31(3)14-20-4-8-25-26(10-20)37-17-36-25/h4,7-11,18-19,21,27,33H,5-6,12-17H2,1-3H3,(H,30,35)/t18-,19-,27-/m1/s1	WXJCYEGRNWVSCE-DRGJWEBESA-N	523.268235934							108809
BRD-K75206048	LSM-20209		44493445	InChI=1S/C30H37N5O7/c1-17-12-35(18(2)15-36)29(37)22-7-6-8-23(31-30(38)32-27-19(3)33-42-20(27)4)28(22)41-26(17)14-34(5)13-21-9-10-24-25(11-21)40-16-39-24/h6-11,17-18,26,36H,12-16H2,1-5H3,(H2,31,32,38)/t17-,18-,26+/m0/s1	ROWKUSIEMFYXMA-QSAFDGGLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)Nc5c(C)onc5C)cccc4C1=O	BroadT	BRD-K75206048	BRD-K75206048-001-01-0	Broad Institute of MIT and Harvard	BRD-K75206048			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C1=O	InChI=1S/C30H37N5O7/c1-17-12-35(18(2)15-36)29(37)22-7-6-8-23(31-30(38)32-27-19(3)33-42-20(27)4)28(22)41-26(17)14-34(5)13-21-9-10-24-25(11-21)40-16-39-24/h6-11,17-18,26,36H,12-16H2,1-5H3,(H2,31,32,38)/t17-,18-,26+/m0/s1	ROWKUSIEMFYXMA-QSAFDGGLSA-N	579.269298574							108810
BRD-K08903301	LSM-20210		44503803	InChI=1S/C27H37N3O5/c1-18-13-30(19(2)16-31)27(32)12-21-11-22(28(3)4)7-9-23(21)35-26(18)15-29(5)14-20-6-8-24-25(10-20)34-17-33-24/h6-11,18-19,26,31H,12-17H2,1-5H3/t18-,19-,26+/m0/s1	VAKWQMKHOINUIK-LZJCXSABSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(cc4CC1=O)N(C)C	BroadT	BRD-K08903301	BRD-K08903301-001-01-6	Broad Institute of MIT and Harvard	BRD-K08903301			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C27H37N3O5/c1-18-13-30(19(2)16-31)27(32)12-21-11-22(28(3)4)7-9-23(21)35-26(18)15-29(5)14-20-6-8-24-25(10-20)34-17-33-24/h6-11,18-19,26,31H,12-17H2,1-5H3/t18-,19-,26+/m0/s1	VAKWQMKHOINUIK-LZJCXSABSA-N	483.273321314							108811
BRD-K25203350	LSM-20211		44486783	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18-,23+/m1/s1	BMWRPMHXUFNAQO-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K25203350	BRD-K25203350-001-01-0	Broad Institute of MIT and Harvard	BRD-K25203350			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18-,23+/m1/s1	BMWRPMHXUFNAQO-PNCHPQGNSA-N	466.258005608							108812
BRD-K39223744	LSM-20212		44500602	InChI=1S/C25H34N4O4/c1-17-14-29(18(2)16-30)24(31)13-19-12-21(10-11-22(19)33-23(17)15-28(3)4)27-25(32)26-20-8-6-5-7-9-20/h5-12,17-18,23,30H,13-16H2,1-4H3,(H2,26,27,32)/t17-,18-,23+/m0/s1	VPMPLFBICILMPX-IUKKYPGJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	BroadT	BRD-K39223744	BRD-K39223744-001-01-7	Broad Institute of MIT and Harvard	BRD-K39223744			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	InChI=1S/C25H34N4O4/c1-17-14-29(18(2)16-30)24(31)13-19-12-21(10-11-22(19)33-23(17)15-28(3)4)27-25(32)26-20-8-6-5-7-9-20/h5-12,17-18,23,30H,13-16H2,1-4H3,(H2,26,27,32)/t17-,18-,23+/m0/s1	VPMPLFBICILMPX-IUKKYPGJSA-N	454.258005608							108813
CHEMBL2144813	LSM-20213	BRD-K84118789, SID85813978	44506814	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,29-/m0/s1	SREUWAAPQJIJAQ-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K84118789	BRD-K84118789-001-01-9	Broad Institute of MIT and Harvard	BRD-K84118789			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,29-/m0/s1	SREUWAAPQJIJAQ-SYZUXVNWSA-N	559.315854842							108814
CHEMBL2141426	LSM-20214	SID85802257, BRD-K52956006	44495417	InChI=1S/C27H36F3N3O3/c1-18-14-33(19(2)17-34)26(35)13-21-12-23(31(3)4)10-11-24(21)36-25(18)16-32(5)15-20-6-8-22(9-7-20)27(28,29)30/h6-12,18-19,25,34H,13-17H2,1-5H3/t18-,19-,25+/m0/s1	RAYQZOVLGJUDGR-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K52956006	BRD-K52956006-001-01-7	Broad Institute of MIT and Harvard	BRD-K52956006			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C27H36F3N3O3/c1-18-14-33(19(2)17-34)26(35)13-21-12-23(31(3)4)10-11-24(21)36-25(18)16-32(5)15-20-6-8-22(9-7-20)27(28,29)30/h6-12,18-19,25,34H,13-17H2,1-5H3/t18-,19-,25+/m0/s1	RAYQZOVLGJUDGR-XHNVNVPESA-N	507.270876642							108815
BRD-K69854611	LSM-20215		44503821	InChI=1S/C28H39N5O6/c1-17(2)29-28(37)32(5)15-24-18(3)14-33(19(4)16-34)26(35)22-8-7-9-23(25(22)39-24)31-27(36)30-20-10-12-21(38-6)13-11-20/h7-13,17-19,24,34H,14-16H2,1-6H3,(H,29,37)(H2,30,31,36)/t18-,19+,24-/m0/s1	IBFNJHBZCKBINA-GLDPYIMESA-N	COc1ccc(NC(=O)Nc2cccc3C(=O)N(C[C@H](C)[C@H](CN(C)C(=O)NC(C)C)Oc23)[C@H](C)CO)cc1	BroadT	BRD-K69854611	BRD-K69854611-001-01-2	Broad Institute of MIT and Harvard	BRD-K69854611			COc1ccc(NC(=O)Nc2cccc3c2O[C@@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@H](C)CO)C3=O)cc1	InChI=1S/C28H39N5O6/c1-17(2)29-28(37)32(5)15-24-18(3)14-33(19(4)16-34)26(35)22-8-7-9-23(25(22)39-24)31-27(36)30-20-10-12-21(38-6)13-11-20/h7-13,17-19,24,34H,14-16H2,1-6H3,(H,29,37)(H2,30,31,36)/t18-,19+,24-/m0/s1	IBFNJHBZCKBINA-GLDPYIMESA-N	541.290034018							108816
BRD-K76088420	LSM-20216		44500139	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-19-15(3)11-26(16(4)13-27)21(28)17-9-8-10-18(24(5)6)20(17)30-19/h8-10,14-16,19,27H,11-13H2,1-7H3,(H,23,29)/t15-,16-,19-/m1/s1	XZXNUYDCQDAXAA-GPMSIDNRSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2c(cccc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K76088420	BRD-K76088420-001-01-9	Broad Institute of MIT and Harvard	BRD-K76088420			CC(C)NC(=O)N(C)C[C@H]1Oc2c(cccc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-19-15(3)11-26(16(4)13-27)21(28)17-9-8-10-18(24(5)6)20(17)30-19/h8-10,14-16,19,27H,11-13H2,1-7H3,(H,23,29)/t15-,16-,19-/m1/s1	XZXNUYDCQDAXAA-GPMSIDNRSA-N	420.273655672							108817
BRD-K63383299	LSM-20217		44488096	InChI=1S/C33H39N3O6/c1-22-18-36(23(2)21-37)32(39)17-27-16-28(34-31(38)15-24-7-5-4-6-8-24)13-14-29(27)42-30(22)20-35(3)19-25-9-11-26(12-10-25)33(40)41/h4-14,16,22-23,30,37H,15,17-21H2,1-3H3,(H,34,38)(H,40,41)/t22-,23-,30-/m0/s1	VWLXYKZHRWDJAR-ZRLASMASSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K63383299	BRD-K63383299-001-01-7	Broad Institute of MIT and Harvard	BRD-K63383299			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C33H39N3O6/c1-22-18-36(23(2)21-37)32(39)17-27-16-28(34-31(38)15-24-7-5-4-6-8-24)13-14-29(27)42-30(22)20-35(3)19-25-9-11-26(12-10-25)33(40)41/h4-14,16,22-23,30,37H,15,17-21H2,1-3H3,(H,34,38)(H,40,41)/t22-,23-,30-/m0/s1	VWLXYKZHRWDJAR-ZRLASMASSA-N	573.283885998							108818
MLS002474064	LSM-20218	SID85201628, BRD-K19310540	44202712	InChI=1S/C31H40F3N5O5/c1-19-16-39(20(2)18-40)28(41)24-10-7-11-25(37-29(42)35-22-8-5-4-6-9-22)27(24)44-26(19)17-38(3)30(43)36-23-14-12-21(13-15-23)31(32,33)34/h7,10-15,19-20,22,26,40H,4-6,8-9,16-18H2,1-3H3,(H,36,43)(H2,35,37,42)/t19-,20+,26+/m0/s1	DYMIOMKCTZAAFH-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)NC4CCCCC4)cccc3C1=O	BroadT	BRD-K19310540	BRD-K19310540-001-02-0	Broad Institute of MIT and Harvard	BRD-K19310540			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C31H40F3N5O5/c1-19-16-39(20(2)18-40)28(41)24-10-7-11-25(37-29(42)35-22-8-5-4-6-9-22)27(24)44-26(19)17-38(3)30(43)36-23-14-12-21(13-15-23)31(32,33)34/h7,10-15,19-20,22,26,40H,4-6,8-9,16-18H2,1-3H3,(H,36,43)(H2,35,37,42)/t19-,20+,26+/m0/s1	DYMIOMKCTZAAFH-OUDXUNEISA-N	619.29815403							108819
BRD-K99116119	LSM-20219		44491925	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11+,14-/m0/s1	CZXYLKJVFUIZEK-WDMOLILDSA-N	CNC[C@@H]1Oc2c(N)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K99116119	BRD-K99116119-001-01-7	Broad Institute of MIT and Harvard	BRD-K99116119			CNC[C@@H]1Oc2c(N)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11+,14-/m0/s1	CZXYLKJVFUIZEK-WDMOLILDSA-N	307.18959169							108820
BRD-K27352194	LSM-20220		44497898	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)23-12-9-13-24(30-29(37)31-26-20(3)32-39-21(26)4)27(23)38-25(18)16-33(5)15-22-10-7-6-8-11-22/h9,12-13,18-19,22,25,35H,6-8,10-11,14-17H2,1-5H3,(H2,30,31,37)/t18-,19-,25+/m0/s1	SKOKKYKZTHPAKC-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)Nc4c(C)onc4C)cccc3C1=O	BroadT	BRD-K27352194	BRD-K27352194-001-01-3	Broad Institute of MIT and Harvard	BRD-K27352194			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C1=O	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)23-12-9-13-24(30-29(37)31-26-20(3)32-39-21(26)4)27(23)38-25(18)16-33(5)15-22-10-7-6-8-11-22/h9,12-13,18-19,22,25,35H,6-8,10-11,14-17H2,1-5H3,(H2,30,31,37)/t18-,19-,25+/m0/s1	SKOKKYKZTHPAKC-XHNVNVPESA-N	541.326419526							108821
BRD-K26393435	LSM-20221		44486246	InChI=1S/C31H37N3O8S/c1-20-15-34(21(2)18-35)31(36)25-6-5-7-26(32-43(37,38)24-11-9-23(39-4)10-12-24)30(25)42-29(20)17-33(3)16-22-8-13-27-28(14-22)41-19-40-27/h5-14,20-21,29,32,35H,15-19H2,1-4H3/t20-,21+,29-/m1/s1	AELUQFUEWCFKFM-HNMNOHOESA-N	COc1ccc(cc1)S(=O)(=O)Nc2cccc3C(=O)N(C[C@@H](C)[C@@H](CN(C)Cc4ccc5OCOc5c4)Oc23)[C@@H](C)CO	BroadT	BRD-K26393435	BRD-K26393435-001-01-7	Broad Institute of MIT and Harvard	BRD-K26393435			COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1O[C@H](CN(C)Cc1ccc3OCOc3c1)[C@H](C)CN([C@@H](C)CO)C2=O	InChI=1S/C31H37N3O8S/c1-20-15-34(21(2)18-35)31(36)25-6-5-7-26(32-43(37,38)24-11-9-23(39-4)10-12-24)30(25)42-29(20)17-33(3)16-22-8-13-27-28(14-22)41-19-40-27/h5-14,20-21,29,32,35H,15-19H2,1-4H3/t20-,21+,29-/m1/s1	AELUQFUEWCFKFM-HNMNOHOESA-N	611.230135864							108822
BRD-K36190163	LSM-20222		44495123	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23+,29+/m1/s1	JWXWRTLQHUTWJR-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K36190163	BRD-K36190163-001-01-3	Broad Institute of MIT and Harvard	BRD-K36190163			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23+,29+/m1/s1	JWXWRTLQHUTWJR-AFKLWXAFSA-N	564.331170548							108823
MLS002473718	LSM-20223	BRD-K36718828, SID85201258	44202342	InChI=1S/C30H37N5O7/c1-17-12-35(18(2)15-36)29(37)22-7-6-8-23(31-30(38)32-27-19(3)33-42-20(27)4)28(22)41-26(17)14-34(5)13-21-9-10-24-25(11-21)40-16-39-24/h6-11,17-18,26,36H,12-16H2,1-5H3,(H2,31,32,38)/t17-,18+,26-/m0/s1	ROWKUSIEMFYXMA-DFXHWTJYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)Nc5c(C)onc5C)cccc4C1=O	BroadT	BRD-K36718828	BRD-K36718828-001-01-8	Broad Institute of MIT and Harvard	BRD-K36718828			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C1=O	InChI=1S/C30H37N5O7/c1-17-12-35(18(2)15-36)29(37)22-7-6-8-23(31-30(38)32-27-19(3)33-42-20(27)4)28(22)41-26(17)14-34(5)13-21-9-10-24-25(11-21)40-16-39-24/h6-11,17-18,26,36H,12-16H2,1-5H3,(H2,31,32,38)/t17-,18+,26-/m0/s1	ROWKUSIEMFYXMA-DFXHWTJYSA-N	579.269298574							108824
BRD-K28488100	LSM-20224		44617332	InChI=1S/C33H40N4O6/c1-22-19-37(23(2)21-38)32(40)18-25-17-27(34-31(39)16-24-8-6-5-7-9-24)12-15-29(25)43-30(22)20-36(3)33(41)35-26-10-13-28(42-4)14-11-26/h5-15,17,22-23,30,38H,16,18-21H2,1-4H3,(H,34,39)(H,35,41)/t22-,23+,30+/m0/s1	CGYYYKYOQGTOJG-DDFCPOBKSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)Cc4ccccc4)cc3CC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K28488100	BRD-K28488100-001-01-7	Broad Institute of MIT and Harvard	BRD-K28488100			COc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)Cc4ccccc4)cc3CC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C33H40N4O6/c1-22-19-37(23(2)21-38)32(40)18-25-17-27(34-31(39)16-24-8-6-5-7-9-24)12-15-29(25)43-30(22)20-36(3)33(41)35-26-10-13-28(42-4)14-11-26/h5-15,17,22-23,30,38H,16,18-21H2,1-4H3,(H,34,39)(H,35,41)/t22-,23+,30+/m0/s1	CGYYYKYOQGTOJG-DDFCPOBKSA-N	588.29478504							108825
CHEMBL2361555	LSM-20225	BRD-K88590066, SID85801152	44494354	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)24-10-7-11-25(33-31(38)32-23-8-5-4-6-9-23)29(24)41-28(20)17-34(3)16-22-12-13-26-27(14-22)40-19-39-26/h7,10-14,20-21,23,28,36H,4-6,8-9,15-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m0/s1	QXBUWZYZXJXLTK-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)NC5CCCCC5)cccc4C1=O	BroadT	BRD-K88590066	BRD-K88590066-001-02-7	Broad Institute of MIT and Harvard	BRD-K88590066			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)24-10-7-11-25(33-31(38)32-23-8-5-4-6-9-23)29(24)41-28(20)17-34(3)16-22-12-13-26-27(14-22)40-19-39-26/h7,10-14,20-21,23,28,36H,4-6,8-9,15-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m0/s1	QXBUWZYZXJXLTK-BALWLHIASA-N	566.310435104							108826
BRD-K02362691	LSM-20226		44501706	InChI=1S/C25H31F3N4O4/c1-15-13-32(16(2)14-33)23(34)11-17-10-20(8-9-21(17)36-22(15)12-29-3)31-24(35)30-19-6-4-18(5-7-19)25(26,27)28/h4-10,15-16,22,29,33H,11-14H2,1-3H3,(H2,30,31,35)/t15-,16-,22+/m0/s1	NMJAJKSBHFWFOJ-PONJGIIJSA-N	CNC[C@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K02362691	BRD-K02362691-001-01-9	Broad Institute of MIT and Harvard	BRD-K02362691			CNC[C@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C25H31F3N4O4/c1-15-13-32(16(2)14-33)23(34)11-17-10-20(8-9-21(17)36-22(15)12-29-3)31-24(35)30-19-6-4-18(5-7-19)25(26,27)28/h4-10,15-16,22,29,33H,11-14H2,1-3H3,(H2,30,31,35)/t15-,16-,22+/m0/s1	NMJAJKSBHFWFOJ-PONJGIIJSA-N	508.229740112							108827
BRD-K19231873	LSM-20227		44499231	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13-,17-/m1/s1	COTDYGDWXSSLGS-PBFPGSCMSA-N	CNC[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K19231873	BRD-K19231873-001-01-7	Broad Institute of MIT and Harvard	BRD-K19231873			CNC[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13-,17-/m1/s1	COTDYGDWXSSLGS-PBFPGSCMSA-N	375.215806438							108828
BRD-K92398088	LSM-20228		44495528	InChI=1S/C32H37FN4O6/c1-20-16-37(21(2)19-38)30(39)15-24-14-27(35-32(42)34-26-10-8-25(33)9-11-26)12-13-28(24)43-29(20)18-36(3)17-22-4-6-23(7-5-22)31(40)41/h4-14,20-21,29,38H,15-19H2,1-3H3,(H,40,41)(H2,34,35,42)/t20-,21+,29+/m0/s1	KTBFUFCVUDUHMK-BNJCFXFUSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc3CC1=O	BroadT	BRD-K92398088	BRD-K92398088-001-01-5	Broad Institute of MIT and Harvard	BRD-K92398088			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2CC1=O	InChI=1S/C32H37FN4O6/c1-20-16-37(21(2)19-38)30(39)15-24-14-27(35-32(42)34-26-10-8-25(33)9-11-26)12-13-28(24)43-29(20)18-36(3)17-22-4-6-23(7-5-22)31(40)41/h4-14,20-21,29,38H,15-19H2,1-3H3,(H,40,41)(H2,34,35,42)/t20-,21+,29+/m0/s1	KTBFUFCVUDUHMK-BNJCFXFUSA-N	592.269713144							108829
BRD-K64581877	LSM-20229		44499600	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)23-12-9-13-24(30-29(37)31-26-20(3)32-39-21(26)4)27(23)38-25(18)16-33(5)15-22-10-7-6-8-11-22/h9,12-13,18-19,22,25,35H,6-8,10-11,14-17H2,1-5H3,(H2,30,31,37)/t18-,19-,25-/m1/s1	SKOKKYKZTHPAKC-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)Nc4c(C)onc4C)cccc3C1=O	BroadT	BRD-K64581877	BRD-K64581877-001-01-5	Broad Institute of MIT and Harvard	BRD-K64581877			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C1=O	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)23-12-9-13-24(30-29(37)31-26-20(3)32-39-21(26)4)27(23)38-25(18)16-33(5)15-22-10-7-6-8-11-22/h9,12-13,18-19,22,25,35H,6-8,10-11,14-17H2,1-5H3,(H2,30,31,37)/t18-,19-,25-/m1/s1	SKOKKYKZTHPAKC-MPCDZSKCSA-N	541.326419526							108830
BRD-K28093873	LSM-20230		44499694	InChI=1S/C30H35N5O6/c1-19-16-35(20(2)18-36)29(38)24-6-5-7-25(33-28(37)21-12-14-31-15-13-21)27(24)41-26(19)17-34(3)30(39)32-22-8-10-23(40-4)11-9-22/h5-15,19-20,26,36H,16-18H2,1-4H3,(H,32,39)(H,33,37)/t19-,20-,26+/m0/s1	YPMOLAXPZMKSMS-CUVVAGTFSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3c(NC(=O)c4ccncc4)cccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K28093873	BRD-K28093873-001-01-0	Broad Institute of MIT and Harvard	BRD-K28093873			COc1ccc(NC(=O)N(C)C[C@H]2Oc3c(NC(=O)c4ccncc4)cccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C30H35N5O6/c1-19-16-35(20(2)18-36)29(38)24-6-5-7-25(33-28(37)21-12-14-31-15-13-21)27(24)41-26(19)17-34(3)30(39)32-22-8-10-23(40-4)11-9-22/h5-15,19-20,26,36H,16-18H2,1-4H3,(H,32,39)(H,33,37)/t19-,20-,26+/m0/s1	YPMOLAXPZMKSMS-CUVVAGTFSA-N	561.25873389							108831
BRD-K81568980-001-01-5	LSM-20231	BRD-K81568980	44491940	InChI=1S/C24H29F3N4O4/c1-14-12-31(15(2)13-32)22(33)18-5-4-6-19(21(18)35-20(14)11-28-3)30-23(34)29-17-9-7-16(8-10-17)24(25,26)27/h4-10,14-15,20,28,32H,11-13H2,1-3H3,(H2,29,30,34)/t14-,15+,20-/m1/s1	KNPSDLIHJHZPLR-QEEYODRMSA-N	CNC[C@H]1Oc2c(NC(=O)Nc3ccc(cc3)C(F)(F)F)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K81568980	BRD-K81568980-001-01-5	Broad Institute of MIT and Harvard	BRD-K81568980			CNC[C@H]1Oc2c(NC(=O)Nc3ccc(cc3)C(F)(F)F)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H29F3N4O4/c1-14-12-31(15(2)13-32)22(33)18-5-4-6-19(21(18)35-20(14)11-28-3)30-23(34)29-17-9-7-16(8-10-17)24(25,26)27/h4-10,14-15,20,28,32H,11-13H2,1-3H3,(H2,29,30,34)/t14-,15+,20-/m1/s1	KNPSDLIHJHZPLR-QEEYODRMSA-N	494.214090048							108832
BRD-K24109044	LSM-20232		44491937	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)16-7-6-8-17(20(16)31-18(12)9-23-5)24-22(30)25-19-14(3)26-32-15(19)4/h6-8,12-13,18,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13+,18-/m1/s1	MPDMLCBONFVZSW-FHSNZYRGSA-N	CNC[C@H]1Oc2c(NC(=O)Nc3c(C)onc3C)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K24109044	BRD-K24109044-001-01-2	Broad Institute of MIT and Harvard	BRD-K24109044			CNC[C@H]1Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)16-7-6-8-17(20(16)31-18(12)9-23-5)24-22(30)25-19-14(3)26-32-15(19)4/h6-8,12-13,18,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13+,18-/m1/s1	MPDMLCBONFVZSW-FHSNZYRGSA-N	445.232519142							108833
BRD-K13336710	LSM-20233		44504604	InChI=1S/C25H36F3N3O4/c1-16-12-31(17(2)15-32)24(34)11-19-10-20(29-23(33)8-9-25(26,27)28)6-7-21(19)35-22(16)14-30(3)13-18-4-5-18/h6-7,10,16-18,22,32H,4-5,8-9,11-15H2,1-3H3,(H,29,33)/t16-,17-,22-/m1/s1	OWJOIEFDHRCHNY-DRSNIGMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC1=O	BroadT	BRD-K13336710	BRD-K13336710-001-01-7	Broad Institute of MIT and Harvard	BRD-K13336710			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C25H36F3N3O4/c1-16-12-31(17(2)15-32)24(34)11-19-10-20(29-23(33)8-9-25(26,27)28)6-7-21(19)35-22(16)14-30(3)13-18-4-5-18/h6-7,10,16-18,22,32H,4-5,8-9,11-15H2,1-3H3,(H,29,33)/t16-,17-,22-/m1/s1	OWJOIEFDHRCHNY-DRSNIGMVSA-N	499.265791262							108834
BRD-K19474742	LSM-20234		44492029	InChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)11-18-10-19(4-5-20(18)31-21(15)12-24-3)26-23(30)17-6-8-25-9-7-17/h4-10,15-16,21,24,28H,11-14H2,1-3H3,(H,26,30)/t15-,16-,21+/m0/s1	FZIMPWDREOYZDI-CKJXQJPGSA-N	CNC[C@H]1Oc2ccc(NC(=O)c3ccncc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K19474742	BRD-K19474742-001-01-2	Broad Institute of MIT and Harvard	BRD-K19474742			CNC[C@H]1Oc2ccc(NC(=O)c3ccncc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)11-18-10-19(4-5-20(18)31-21(15)12-24-3)26-23(30)17-6-8-25-9-7-17/h4-10,15-16,21,24,28H,11-14H2,1-3H3,(H,26,30)/t15-,16-,21+/m0/s1	FZIMPWDREOYZDI-CKJXQJPGSA-N	426.22670548							108835
BRD-K20284960	LSM-20235		44499201	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16+,20-/m1/s1	DJIXJENXBPUHIX-GQIGUUNPSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K20284960	BRD-K20284960-001-01-7	Broad Institute of MIT and Harvard	BRD-K20284960			CC(C)NC(=O)N(C)C[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16+,20-/m1/s1	DJIXJENXBPUHIX-GQIGUUNPSA-N	460.268570292							108836
BRD-K04181823	LSM-20236		44494026	InChI=1S/C18H29N3O5S/c1-12-10-21(13(2)11-22)18(23)8-14-7-15(20-27(4,24)25)5-6-16(14)26-17(12)9-19-3/h5-7,12-13,17,19-20,22H,8-11H2,1-4H3/t12-,13-,17-/m1/s1	XOTYHNIEAMYTDW-PBFPGSCMSA-N	CNC[C@H]1Oc2ccc(NS(=O)(=O)C)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K04181823	BRD-K04181823-001-01-2	Broad Institute of MIT and Harvard	BRD-K04181823			CNC[C@H]1Oc2ccc(NS(C)(=O)=O)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C18H29N3O5S/c1-12-10-21(13(2)11-22)18(23)8-14-7-15(20-27(4,24)25)5-6-16(14)26-17(12)9-19-3/h5-7,12-13,17,19-20,22H,8-11H2,1-4H3/t12-,13-,17-/m1/s1	XOTYHNIEAMYTDW-PBFPGSCMSA-N	399.182791748							108837
BRD-K14970242	LSM-20237		44487336	InChI=1S/C20H28F3N3O4/c1-12-10-26(13(2)11-27)19(29)15-8-14(25-18(28)6-7-20(21,22)23)4-5-16(15)30-17(12)9-24-3/h4-5,8,12-13,17,24,27H,6-7,9-11H2,1-3H3,(H,25,28)/t12-,13-,17-/m0/s1	MJOLMSVGHZLLLZ-DCGLDWPTSA-N	CNC[C@@H]1Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K14970242	BRD-K14970242-001-01-9	Broad Institute of MIT and Harvard	BRD-K14970242			CNC[C@@H]1Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C20H28F3N3O4/c1-12-10-26(13(2)11-27)19(29)15-8-14(25-18(28)6-7-20(21,22)23)4-5-16(15)30-17(12)9-24-3/h4-5,8,12-13,17,24,27H,6-7,9-11H2,1-3H3,(H,25,28)/t12-,13-,17-/m0/s1	MJOLMSVGHZLLLZ-DCGLDWPTSA-N	431.203191006							108838
CHEMBL2144128	LSM-20238	BRD-K95153342, SID85798584	44491907	InChI=1S/C33H35N5O5/c1-21-18-38(22(2)20-39)32(41)26-11-7-13-28(35-31(40)24-14-16-34-17-15-24)30(26)43-29(21)19-37(3)33(42)36-27-12-6-9-23-8-4-5-10-25(23)27/h4-17,21-22,29,39H,18-20H2,1-3H3,(H,35,40)(H,36,42)/t21-,22+,29-/m0/s1	UCPVSNSDYZNCRX-KERYWQKISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)c5ccncc5)cccc4C1=O	BroadT	BRD-K95153342	BRD-K95153342-001-01-3	Broad Institute of MIT and Harvard	BRD-K95153342			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C33H35N5O5/c1-21-18-38(22(2)20-39)32(41)26-11-7-13-28(35-31(40)24-14-16-34-17-15-24)30(26)43-29(21)19-37(3)33(42)36-27-12-6-9-23-8-4-5-10-25(23)27/h4-17,21-22,29,39H,18-20H2,1-3H3,(H,35,40)(H,36,42)/t21-,22+,29-/m0/s1	UCPVSNSDYZNCRX-KERYWQKISA-N	581.26381927							108839
BRD-K51791049	LSM-20239		44486242	InChI=1S/C31H37N3O8S/c1-20-15-34(21(2)18-35)31(36)25-6-5-7-26(32-43(37,38)24-11-9-23(39-4)10-12-24)30(25)42-29(20)17-33(3)16-22-8-13-27-28(14-22)41-19-40-27/h5-14,20-21,29,32,35H,15-19H2,1-4H3/t20-,21+,29-/m0/s1	AELUQFUEWCFKFM-FONBTEPMSA-N	COc1ccc(cc1)S(=O)(=O)Nc2cccc3C(=O)N(C[C@H](C)[C@H](CN(C)Cc4ccc5OCOc5c4)Oc23)[C@H](C)CO	BroadT	BRD-K51791049	BRD-K51791049-001-01-8	Broad Institute of MIT and Harvard	BRD-K51791049			COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1O[C@@H](CN(C)Cc1ccc3OCOc3c1)[C@@H](C)CN([C@H](C)CO)C2=O	InChI=1S/C31H37N3O8S/c1-20-15-34(21(2)18-35)31(36)25-6-5-7-26(32-43(37,38)24-11-9-23(39-4)10-12-24)30(25)42-29(20)17-33(3)16-22-8-13-27-28(14-22)41-19-40-27/h5-14,20-21,29,32,35H,15-19H2,1-4H3/t20-,21+,29-/m0/s1	AELUQFUEWCFKFM-FONBTEPMSA-N	611.230135864							108840
BRD-K92826631	LSM-20240		44504789	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20-,27-/m1/s1	FITMUQCJUCLPTO-SEXOINJZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4c(C)onc4C)cc3CC1=O	BroadT	BRD-K92826631	BRD-K92826631-001-01-7	Broad Institute of MIT and Harvard	BRD-K92826631			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3c(C)noc3C)cc2CC1=O	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20-,27-/m1/s1	FITMUQCJUCLPTO-SEXOINJZSA-N	576.298155858							108841
BRD-K28140275	LSM-20241		44503767	InChI=1S/C27H39N5O5/c1-16-12-32(17(2)15-33)25(34)11-21-10-22(28-27(35)29-26-18(3)30-37-19(26)4)8-9-23(21)36-24(16)14-31(5)13-20-6-7-20/h8-10,16-17,20,24,33H,6-7,11-15H2,1-5H3,(H2,28,29,35)/t16-,17-,24-/m0/s1	RRKRQZMEMKUNGW-UAVUOLJFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3CC1=O	BroadT	BRD-K28140275	BRD-K28140275-001-01-3	Broad Institute of MIT and Harvard	BRD-K28140275			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2CC1=O	InChI=1S/C27H39N5O5/c1-16-12-32(17(2)15-33)25(34)11-21-10-22(28-27(35)29-26-18(3)30-37-19(26)4)8-9-23(21)36-24(16)14-31(5)13-20-6-7-20/h8-10,16-17,20,24,33H,6-7,11-15H2,1-5H3,(H2,28,29,35)/t16-,17-,24-/m0/s1	RRKRQZMEMKUNGW-UAVUOLJFSA-N	513.295119398							108842
BRD-K12281552	LSM-20242		54613819	InChI=1S/C31H41FN4O5/c1-20-17-36(21(2)19-37)29(38)16-23-15-26(33-30(39)22-7-5-4-6-8-22)13-14-27(23)41-28(20)18-35(3)31(40)34-25-11-9-24(32)10-12-25/h9-15,20-22,28,37H,4-8,16-19H2,1-3H3,(H,33,39)(H,34,40)/t20-,21-,28+/m1/s1	KWOBPQGHYDHVIO-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3ccc(NC(=O)C4CCCCC4)cc3CC1=O	BroadT	BRD-K12281552	BRD-K12281552-001-01-7	Broad Institute of MIT and Harvard	BRD-K12281552			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ccc(NC(=O)C3CCCCC3)cc2CC1=O	InChI=1S/C31H41FN4O5/c1-20-17-36(21(2)19-37)29(38)16-23-15-26(33-30(39)22-7-5-4-6-8-22)13-14-27(23)41-28(20)18-35(3)31(40)34-25-11-9-24(32)10-12-25/h9-15,20-22,28,37H,4-8,16-19H2,1-3H3,(H,33,39)(H,34,40)/t20-,21-,28+/m1/s1	KWOBPQGHYDHVIO-CJYOKPGZSA-N	568.306098652							108843
CHEMBL2360666	LSM-20243	BRD-K70819166, SID85806323	44499328	InChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21+,26-/m0/s1	QPEXUVZRKHXLPB-UZINWLIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)C4CCOCC4)cccc3C1=O	BroadT	BRD-K70819166	BRD-K70819166-001-01-1	Broad Institute of MIT and Harvard	BRD-K70819166			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21+,26-/m0/s1	QPEXUVZRKHXLPB-UZINWLIJSA-N	515.33592157							108844
BRD-K21955896	LSM-20244		44620105	InChI=1S/C36H40N4O4/c1-25-21-40(26(2)24-41)35(42)20-31-19-32(38-36(43)30-15-17-37-18-16-30)13-14-33(31)44-34(25)23-39(3)22-27-9-11-29(12-10-27)28-7-5-4-6-8-28/h4-19,25-26,34,41H,20-24H2,1-3H3,(H,38,43)/t25-,26+,34+/m0/s1	IQSVNIDGIMJPQN-XDWGWCSASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)c3ccccc3)Oc4ccc(NC(=O)c5ccncc5)cc4CC1=O	BroadT	BRD-K21955896	BRD-K21955896-001-01-0	Broad Institute of MIT and Harvard	BRD-K21955896			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)-c2ccccc2)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C36H40N4O4/c1-25-21-40(26(2)24-41)35(42)20-31-19-32(38-36(43)30-15-17-37-18-16-30)13-14-33(31)44-34(25)23-39(3)22-27-9-11-29(12-10-27)28-7-5-4-6-8-28/h4-19,25-26,34,41H,20-24H2,1-3H3,(H,38,43)/t25-,26+,34+/m0/s1	IQSVNIDGIMJPQN-XDWGWCSASA-N	592.3049558							108845
BRD-K59188100	LSM-20245		44493054	InChI=1S/C30H41N5O5/c1-20-17-35(21(2)19-36)28(37)16-23-15-25(32-29(38)22-11-13-31-14-12-22)9-10-26(23)40-27(20)18-34(3)30(39)33-24-7-5-4-6-8-24/h9-15,20-21,24,27,36H,4-8,16-19H2,1-3H3,(H,32,38)(H,33,39)/t20-,21-,27+/m0/s1	OBYISRQTVLJVSP-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)c4ccncc4)cc3CC1=O	BroadT	BRD-K59188100	BRD-K59188100-001-01-5	Broad Institute of MIT and Harvard	BRD-K59188100			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C30H41N5O5/c1-20-17-35(21(2)19-36)28(37)16-23-15-25(32-29(38)22-11-13-31-14-12-22)9-10-26(23)40-27(20)18-34(3)30(39)33-24-7-5-4-6-8-24/h9-15,20-21,24,27,36H,4-8,16-19H2,1-3H3,(H,32,38)(H,33,39)/t20-,21-,27+/m0/s1	OBYISRQTVLJVSP-NOMHHCBYSA-N	551.310769462							108846
BRD-K04980212	LSM-20246		44492508	InChI=1S/C27H36F3N3O3/c1-18-14-33(19(2)17-34)26(35)13-21-12-23(31(3)4)10-11-24(21)36-25(18)16-32(5)15-20-6-8-22(9-7-20)27(28,29)30/h6-12,18-19,25,34H,13-17H2,1-5H3/t18-,19+,25-/m0/s1	RAYQZOVLGJUDGR-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K04980212	BRD-K04980212-001-01-6	Broad Institute of MIT and Harvard	BRD-K04980212			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C27H36F3N3O3/c1-18-14-33(19(2)17-34)26(35)13-21-12-23(31(3)4)10-11-24(21)36-25(18)16-32(5)15-20-6-8-22(9-7-20)27(28,29)30/h6-12,18-19,25,34H,13-17H2,1-5H3/t18-,19+,25-/m0/s1	RAYQZOVLGJUDGR-CEYNDMKZSA-N	507.270876642							108847
BRD-K13089873-001-01-5	LSM-20247	BRD-K13089873	44490787	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11-,14-/m1/s1	CZXYLKJVFUIZEK-JTNHKYCSSA-N	CNC[C@H]1Oc2c(N)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K13089873	BRD-K13089873-001-01-5	Broad Institute of MIT and Harvard	BRD-K13089873			CNC[C@H]1Oc2c(N)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11-,14-/m1/s1	CZXYLKJVFUIZEK-JTNHKYCSSA-N	307.18959169							108848
BRD-K31883758	LSM-20248		44504015	InChI=1S/C31H41FN4O5/c1-20-17-36(21(2)19-37)29(38)16-23-15-26(33-30(39)22-7-5-4-6-8-22)13-14-27(23)41-28(20)18-35(3)31(40)34-25-11-9-24(32)10-12-25/h9-15,20-22,28,37H,4-8,16-19H2,1-3H3,(H,33,39)(H,34,40)/t20-,21-,28+/m0/s1	KWOBPQGHYDHVIO-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3ccc(NC(=O)C4CCCCC4)cc3CC1=O	BroadT	BRD-K31883758	BRD-K31883758-001-01-9	Broad Institute of MIT and Harvard	BRD-K31883758			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ccc(NC(=O)C3CCCCC3)cc2CC1=O	InChI=1S/C31H41FN4O5/c1-20-17-36(21(2)19-37)29(38)16-23-15-26(33-30(39)22-7-5-4-6-8-22)13-14-27(23)41-28(20)18-35(3)31(40)34-25-11-9-24(32)10-12-25/h9-15,20-22,28,37H,4-8,16-19H2,1-3H3,(H,33,39)(H,34,40)/t20-,21-,28+/m0/s1	KWOBPQGHYDHVIO-YHGPEZAFSA-N	568.306098652							108849
BRD-K01478290	LSM-20249		44501192	InChI=1S/C27H35N3O6S/c1-18-15-30(19(2)17-31)26(32)14-21-13-22(28-27(33)20-9-10-20)11-12-24(21)36-25(18)16-29(3)37(34,35)23-7-5-4-6-8-23/h4-8,11-13,18-20,25,31H,9-10,14-17H2,1-3H3,(H,28,33)/t18-,19+,25-/m1/s1	MWSPHKIBVREWDU-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(NC(=O)C4CC4)cc3CC1=O	BroadT	BRD-K01478290	BRD-K01478290-001-01-9	Broad Institute of MIT and Harvard	BRD-K01478290			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(NC(=O)C3CC3)cc2CC1=O	InChI=1S/C27H35N3O6S/c1-18-15-30(19(2)17-31)26(32)14-21-13-22(28-27(33)20-9-10-20)11-12-24(21)36-25(18)16-29(3)37(34,35)23-7-5-4-6-8-23/h4-8,11-13,18-20,25,31H,9-10,14-17H2,1-3H3,(H,28,33)/t18-,19+,25-/m1/s1	MWSPHKIBVREWDU-HHJKRLRDSA-N	529.22465656							108850
BRD-K60760423	LSM-20250		44503496	InChI=1S/C28H35Cl2N5O5S/c1-18-12-35(19(2)16-36)28(37)11-21-10-22(32-41(38,39)27-15-34(4)17-31-27)6-8-25(21)40-26(18)14-33(3)13-20-5-7-23(29)24(30)9-20/h5-10,15,17-19,26,32,36H,11-14,16H2,1-4H3/t18-,19-,26-/m0/s1	VWQPHETXZDMYNJ-DGUDUIIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NS(=O)(=O)c4cn(C)cn4)cc3CC1=O	BroadT	BRD-K60760423	BRD-K60760423-001-01-8	Broad Institute of MIT and Harvard	BRD-K60760423			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC1=O	InChI=1S/C28H35Cl2N5O5S/c1-18-12-35(19(2)16-36)28(37)11-21-10-22(32-41(38,39)27-15-34(4)17-31-27)6-8-25(21)40-26(18)14-33(3)13-20-5-7-23(29)24(30)9-20/h5-10,15,17-19,26,32,36H,11-14,16H2,1-4H3/t18-,19-,26-/m0/s1	VWQPHETXZDMYNJ-DGUDUIIESA-N	623.17359538							108851
BRD-K42150052	LSM-20251		44495572	InChI=1S/C25H37N5O5/c1-15-12-30(16(2)14-31)23(32)11-19-10-20(28(5)6)8-9-21(19)34-22(15)13-29(7)25(33)26-24-17(3)27-35-18(24)4/h8-10,15-16,22,31H,11-14H2,1-7H3,(H,26,33)/t15-,16+,22+/m1/s1	GPPKFMUWSJEKJP-VVBPWWLESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K42150052	BRD-K42150052-001-01-3	Broad Institute of MIT and Harvard	BRD-K42150052			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C25H37N5O5/c1-15-12-30(16(2)14-31)23(32)11-19-10-20(28(5)6)8-9-21(19)34-22(15)13-29(7)25(33)26-24-17(3)27-35-18(24)4/h8-10,15-16,22,31H,11-14H2,1-7H3,(H,26,33)/t15-,16+,22+/m1/s1	GPPKFMUWSJEKJP-VVBPWWLESA-N	487.279469334							108852
BRD-K39099034	LSM-20252		44500552	InChI=1S/C23H37N3O3/c1-16-12-26(17(2)15-27)23(28)11-19-10-20(24(3)4)8-9-21(19)29-22(16)14-25(5)13-18-6-7-18/h8-10,16-18,22,27H,6-7,11-15H2,1-5H3/t16-,17-,22-/m0/s1	DVEIBRZUURAMSY-HOIFWPIMSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K39099034	BRD-K39099034-001-01-0	Broad Institute of MIT and Harvard	BRD-K39099034			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C23H37N3O3/c1-16-12-26(17(2)15-27)23(28)11-19-10-20(24(3)4)8-9-21(19)29-22(16)14-25(5)13-18-6-7-18/h8-10,16-18,22,27H,6-7,11-15H2,1-5H3/t16-,17-,22-/m0/s1	DVEIBRZUURAMSY-HOIFWPIMSA-N	403.283492074							108853
CHEMBL2360236	LSM-20253	SID85804836, BRD-K74834319	44497933	InChI=1S/C25H35N3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(6)15-23-18(2)14-28(19(3)16-29)25(30)21-8-7-9-22(26(4)5)24(21)33-23/h7-13,18-19,23,29H,14-16H2,1-6H3/t18-,19+,23-/m1/s1	ANXKOFDVDMSSFK-SELNLUPBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K74834319	BRD-K74834319-001-01-2	Broad Institute of MIT and Harvard	BRD-K74834319			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C25H35N3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(6)15-23-18(2)14-28(19(3)16-29)25(30)21-8-7-9-22(26(4)5)24(21)33-23/h7-13,18-19,23,29H,14-16H2,1-6H3/t18-,19+,23-/m1/s1	ANXKOFDVDMSSFK-SELNLUPBSA-N	489.22974194							108854
BRD-K02602127	LSM-20254		54613807	InChI=1S/C33H40N4O6/c1-22-19-37(23(2)21-38)32(40)18-25-17-27(34-31(39)16-24-8-6-5-7-9-24)12-15-29(25)43-30(22)20-36(3)33(41)35-26-10-13-28(42-4)14-11-26/h5-15,17,22-23,30,38H,16,18-21H2,1-4H3,(H,34,39)(H,35,41)/t22-,23+,30+/m1/s1	CGYYYKYOQGTOJG-HFZPWKHCSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)Cc4ccccc4)cc3CC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K02602127	BRD-K02602127-001-01-2	Broad Institute of MIT and Harvard	BRD-K02602127			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)Cc4ccccc4)cc3CC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C33H40N4O6/c1-22-19-37(23(2)21-38)32(40)18-25-17-27(34-31(39)16-24-8-6-5-7-9-24)12-15-29(25)43-30(22)20-36(3)33(41)35-26-10-13-28(42-4)14-11-26/h5-15,17,22-23,30,38H,16,18-21H2,1-4H3,(H,34,39)(H,35,41)/t22-,23+,30+/m1/s1	CGYYYKYOQGTOJG-HFZPWKHCSA-N	588.29478504							108855
BRD-K52152765	LSM-20255		44484504	InChI=1S/C27H45N5O5/c1-18(2)28-27(36)31(7)16-24-19(3)15-32(20(4)17-33)26(35)14-21-13-22(10-11-23(21)37-24)29-25(34)9-8-12-30(5)6/h10-11,13,18-20,24,33H,8-9,12,14-17H2,1-7H3,(H,28,36)(H,29,34)/t19-,20-,24+/m0/s1	VLBHGRFCSTYTLU-MZLICYQSSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)CCCN(C)C)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K52152765	BRD-K52152765-001-01-4	Broad Institute of MIT and Harvard	BRD-K52152765			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)CCCN(C)C)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C27H45N5O5/c1-18(2)28-27(36)31(7)16-24-19(3)15-32(20(4)17-33)26(35)14-21-13-22(10-11-23(21)37-24)29-25(34)9-8-12-30(5)6/h10-11,13,18-20,24,33H,8-9,12,14-17H2,1-7H3,(H,28,36)(H,29,34)/t19-,20-,24+/m0/s1	VLBHGRFCSTYTLU-MZLICYQSSA-N	519.34206959							108856
BRD-K96745500	LSM-20256		44495121	InChI=1S/C30H41N5O5/c1-20-17-35(21(2)19-36)28(37)16-23-15-25(32-29(38)22-11-13-31-14-12-22)9-10-26(23)40-27(20)18-34(3)30(39)33-24-7-5-4-6-8-24/h9-15,20-21,24,27,36H,4-8,16-19H2,1-3H3,(H,32,38)(H,33,39)/t20-,21+,27+/m1/s1	OBYISRQTVLJVSP-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)c4ccncc4)cc3CC1=O	BroadT	BRD-K96745500	BRD-K96745500-001-01-3	Broad Institute of MIT and Harvard	BRD-K96745500			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C30H41N5O5/c1-20-17-35(21(2)19-36)28(37)16-23-15-25(32-29(38)22-11-13-31-14-12-22)9-10-26(23)40-27(20)18-34(3)30(39)33-24-7-5-4-6-8-24/h9-15,20-21,24,27,36H,4-8,16-19H2,1-3H3,(H,32,38)(H,33,39)/t20-,21+,27+/m1/s1	OBYISRQTVLJVSP-BUEREQSYSA-N	551.310769462							108857
BRD-K53198140	LSM-20257		44490817	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11-,14-/m0/s1	CZXYLKJVFUIZEK-MJVIPROJSA-N	CNC[C@@H]1Oc2c(N)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K53198140	BRD-K53198140-001-01-2	Broad Institute of MIT and Harvard	BRD-K53198140			CNC[C@@H]1Oc2c(N)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11-,14-/m0/s1	CZXYLKJVFUIZEK-MJVIPROJSA-N	307.18959169							108858
BRD-K28848179	LSM-20258		44495535	InChI=1S/C35H45N5O5/c1-23-20-40(24(2)22-41)33(42)19-26-18-28(37-34(43)36-27-12-5-4-6-13-27)16-17-31(26)45-32(23)21-39(3)35(44)38-30-15-9-11-25-10-7-8-14-29(25)30/h7-11,14-18,23-24,27,32,41H,4-6,12-13,19-22H2,1-3H3,(H,38,44)(H2,36,37,43)/t23-,24+,32+/m0/s1	ICEMUJZXENLAMO-JOUUIMRQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)NC5CCCCC5)cc4CC1=O	BroadT	BRD-K28848179	BRD-K28848179-001-01-8	Broad Institute of MIT and Harvard	BRD-K28848179			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)NC3CCCCC3)cc2CC1=O	InChI=1S/C35H45N5O5/c1-23-20-40(24(2)22-41)33(42)19-26-18-28(37-34(43)36-27-12-5-4-6-13-27)16-17-31(26)45-32(23)21-39(3)35(44)38-30-15-9-11-25-10-7-8-14-29(25)30/h7-11,14-18,23-24,27,32,41H,4-6,12-13,19-22H2,1-3H3,(H,38,44)(H2,36,37,43)/t23-,24+,32+/m0/s1	ICEMUJZXENLAMO-JOUUIMRQSA-N	615.342069590001							108859
BRD-K97052218	LSM-20259		44617473	InChI=1S/C34H37N5O5/c1-22-19-39(23(2)21-40)32(41)18-26-17-27(36-33(42)25-13-15-35-16-14-25)11-12-30(26)44-31(22)20-38(3)34(43)37-29-10-6-8-24-7-4-5-9-28(24)29/h4-17,22-23,31,40H,18-21H2,1-3H3,(H,36,42)(H,37,43)/t22-,23+,31+/m1/s1	LDEMJBAJJXLTPL-UDKTZTBJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)c5ccncc5)cc4CC1=O	BroadT	BRD-K97052218	BRD-K97052218-001-01-6	Broad Institute of MIT and Harvard	BRD-K97052218			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C34H37N5O5/c1-22-19-39(23(2)21-40)32(41)18-26-17-27(36-33(42)25-13-15-35-16-14-25)11-12-30(26)44-31(22)20-38(3)34(43)37-29-10-6-8-24-7-4-5-9-28(24)29/h4-17,22-23,31,40H,18-21H2,1-3H3,(H,36,42)(H,37,43)/t22-,23+,31+/m1/s1	LDEMJBAJJXLTPL-UDKTZTBJSA-N	595.279469334							108860
BRD-K80462316	LSM-20260		44493555	InChI=1S/C32H37FN4O6/c1-20-16-37(21(2)19-38)30(39)15-24-14-27(35-32(42)34-26-10-8-25(33)9-11-26)12-13-28(24)43-29(20)18-36(3)17-22-4-6-23(7-5-22)31(40)41/h4-14,20-21,29,38H,15-19H2,1-3H3,(H,40,41)(H2,34,35,42)/t20-,21-,29+/m1/s1	KTBFUFCVUDUHMK-RLCGNTSFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc3CC1=O	BroadT	BRD-K80462316	BRD-K80462316-001-01-7	Broad Institute of MIT and Harvard	BRD-K80462316			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2CC1=O	InChI=1S/C32H37FN4O6/c1-20-16-37(21(2)19-38)30(39)15-24-14-27(35-32(42)34-26-10-8-25(33)9-11-26)12-13-28(24)43-29(20)18-36(3)17-22-4-6-23(7-5-22)31(40)41/h4-14,20-21,29,38H,15-19H2,1-3H3,(H,40,41)(H2,34,35,42)/t20-,21-,29+/m1/s1	KTBFUFCVUDUHMK-RLCGNTSFSA-N	592.269713144							108861
BRD-K77541177	LSM-20261		44506801	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,29+/m1/s1	SREUWAAPQJIJAQ-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K77541177	BRD-K77541177-001-01-1	Broad Institute of MIT and Harvard	BRD-K77541177			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,29+/m1/s1	SREUWAAPQJIJAQ-BXOOBUKZSA-N	559.315854842							108862
BRD-K16862318	LSM-20262		44499753	InChI=1S/C28H31FN6O5/c1-17-14-35(18(2)16-36)27(38)21-5-4-6-22(33-26(37)23-13-30-11-12-31-23)25(21)40-24(17)15-34(3)28(39)32-20-9-7-19(29)8-10-20/h4-13,17-18,24,36H,14-16H2,1-3H3,(H,32,39)(H,33,37)/t17-,18-,24-/m1/s1	CPPFQQQOTXHNMM-QZTZHPFYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K16862318	BRD-K16862318-001-01-5	Broad Institute of MIT and Harvard	BRD-K16862318			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H31FN6O5/c1-17-14-35(18(2)16-36)27(38)21-5-4-6-22(33-26(37)23-13-30-11-12-31-23)25(21)40-24(17)15-34(3)28(39)32-20-9-7-19(29)8-10-20/h4-13,17-18,24,36H,14-16H2,1-3H3,(H,32,39)(H,33,37)/t17-,18-,24-/m1/s1	CPPFQQQOTXHNMM-QZTZHPFYSA-N	550.233996352							108863
BRD-K49745983	LSM-20263		44503481	InChI=1S/C27H37N3O5/c1-18-13-30(19(2)16-31)27(32)12-21-11-22(28(3)4)7-9-23(21)35-26(18)15-29(5)14-20-6-8-24-25(10-20)34-17-33-24/h6-11,18-19,26,31H,12-17H2,1-5H3/t18-,19-,26-/m1/s1	VAKWQMKHOINUIK-LJKQEARRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(cc4CC1=O)N(C)C	BroadT	BRD-K49745983	BRD-K49745983-001-01-7	Broad Institute of MIT and Harvard	BRD-K49745983			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C27H37N3O5/c1-18-13-30(19(2)16-31)27(32)12-21-11-22(28(3)4)7-9-23(21)35-26(18)15-29(5)14-20-6-8-24-25(10-20)34-17-33-24/h6-11,18-19,26,31H,12-17H2,1-5H3/t18-,19-,26-/m1/s1	VAKWQMKHOINUIK-LJKQEARRSA-N	483.273321314							108864
BRD-K87277021	LSM-20264		44503749	InChI=1S/C29H41FN4O6S/c1-20-17-34(21(2)19-35)29(37)16-22-15-24(31-28(36)7-6-14-32(3)4)10-13-26(22)40-27(20)18-33(5)41(38,39)25-11-8-23(30)9-12-25/h8-13,15,20-21,27,35H,6-7,14,16-19H2,1-5H3,(H,31,36)/t20-,21-,27-/m1/s1	QROKXOKLOVAMIJ-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)CCCN(C)C)cc3CC1=O	BroadT	BRD-K87277021	BRD-K87277021-001-01-8	Broad Institute of MIT and Harvard	BRD-K87277021			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)CCCN(C)C)cc2CC1=O	InChI=1S/C29H41FN4O6S/c1-20-17-34(21(2)19-35)29(37)16-22-15-24(31-28(36)7-6-14-32(3)4)10-13-26(22)40-27(20)18-33(5)41(38,39)25-11-8-23(30)9-12-25/h8-13,15,20-21,27,35H,6-7,14,16-19H2,1-5H3,(H,31,36)/t20-,21-,27-/m1/s1	QROKXOKLOVAMIJ-LGVUCKNBSA-N	592.273083962							108865
CHEMBL2136493	LSM-20265	SID85813963, BRD-K14216332	44506800	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,29-/m0/s1	SREUWAAPQJIJAQ-KERYWQKISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K14216332	BRD-K14216332-001-01-8	Broad Institute of MIT and Harvard	BRD-K14216332			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,29-/m0/s1	SREUWAAPQJIJAQ-KERYWQKISA-N	559.315854842							108866
BRD-K64376499	LSM-20266		44500580	InChI=1S/C31H36FN3O7S/c1-20-15-35(21(2)18-36)31(37)14-23-13-25(33-43(38,39)26-8-5-24(32)6-9-26)7-11-27(23)42-30(20)17-34(3)16-22-4-10-28-29(12-22)41-19-40-28/h4-13,20-21,30,33,36H,14-19H2,1-3H3/t20-,21-,30+/m1/s1	ZVLYFKSMWJQSMB-JAOJVIEDSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc4CC1=O	BroadT	BRD-K64376499	BRD-K64376499-001-01-8	Broad Institute of MIT and Harvard	BRD-K64376499			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2CC1=O	InChI=1S/C31H36FN3O7S/c1-20-15-35(21(2)18-36)31(37)14-23-13-25(33-43(38,39)26-8-5-24(32)6-9-26)7-11-27(23)42-30(20)17-34(3)16-22-4-10-28-29(12-22)41-19-40-28/h4-13,20-21,30,33,36H,14-19H2,1-3H3/t20-,21-,30+/m1/s1	ZVLYFKSMWJQSMB-JAOJVIEDSA-N	613.225799412							108867
BRD-K10027041	LSM-20267		44499446	InChI=1S/C29H34FN5O4/c1-19-15-35(20(2)18-36)28(37)24-5-4-6-25(33-29(38)32-23-9-7-22(30)8-10-23)27(24)39-26(19)17-34(3)16-21-11-13-31-14-12-21/h4-14,19-20,26,36H,15-18H2,1-3H3,(H2,32,33,38)/t19-,20+,26+/m0/s1	VBGZKSFWINXWAF-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3c(NC(=O)Nc4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K10027041	BRD-K10027041-001-01-5	Broad Institute of MIT and Harvard	BRD-K10027041			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2c(NC(=O)Nc3ccc(F)cc3)cccc2C1=O	InChI=1S/C29H34FN5O4/c1-19-15-35(20(2)18-36)28(37)24-5-4-6-25(33-29(38)32-23-9-7-22(30)8-10-23)27(24)39-26(19)17-34(3)16-21-11-13-31-14-12-21/h4-14,19-20,26,36H,15-18H2,1-3H3,(H2,32,33,38)/t19-,20+,26+/m0/s1	VBGZKSFWINXWAF-OUDXUNEISA-N	535.259482818							108868
BRD-K36393312	LSM-20268		44493056	InChI=1S/C25H37N5O5/c1-15-12-30(16(2)14-31)23(32)11-19-10-20(28(5)6)8-9-21(19)34-22(15)13-29(7)25(33)26-24-17(3)27-35-18(24)4/h8-10,15-16,22,31H,11-14H2,1-7H3,(H,26,33)/t15-,16-,22+/m0/s1	GPPKFMUWSJEKJP-PONJGIIJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K36393312	BRD-K36393312-001-01-3	Broad Institute of MIT and Harvard	BRD-K36393312			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C25H37N5O5/c1-15-12-30(16(2)14-31)23(32)11-19-10-20(28(5)6)8-9-21(19)34-22(15)13-29(7)25(33)26-24-17(3)27-35-18(24)4/h8-10,15-16,22,31H,11-14H2,1-7H3,(H,26,33)/t15-,16-,22+/m0/s1	GPPKFMUWSJEKJP-PONJGIIJSA-N	487.279469334							108869
BRD-K11259871	LSM-20269		44485014	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18-,23-/m1/s1	BMWRPMHXUFNAQO-PMAPCBKXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K11259871	BRD-K11259871-001-01-8	Broad Institute of MIT and Harvard	BRD-K11259871			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18-,23-/m1/s1	BMWRPMHXUFNAQO-PMAPCBKXSA-N	466.258005608							108870
BRD-K17384993	LSM-20270		44504147	InChI=1S/C27H35N3O6S/c1-18-15-30(19(2)17-31)26(32)14-21-13-22(28-27(33)20-9-10-20)11-12-24(21)36-25(18)16-29(3)37(34,35)23-7-5-4-6-8-23/h4-8,11-13,18-20,25,31H,9-10,14-17H2,1-3H3,(H,28,33)/t18-,19-,25-/m0/s1	MWSPHKIBVREWDU-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(NC(=O)C4CC4)cc3CC1=O	BroadT	BRD-K17384993	BRD-K17384993-001-01-1	Broad Institute of MIT and Harvard	BRD-K17384993			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(NC(=O)C3CC3)cc2CC1=O	InChI=1S/C27H35N3O6S/c1-18-15-30(19(2)17-31)26(32)14-21-13-22(28-27(33)20-9-10-20)11-12-24(21)36-25(18)16-29(3)37(34,35)23-7-5-4-6-8-23/h4-8,11-13,18-20,25,31H,9-10,14-17H2,1-3H3,(H,28,33)/t18-,19-,25-/m0/s1	MWSPHKIBVREWDU-MHPIHPPYSA-N	529.22465656							108871
BRD-K72468471	LSM-20271		44504173	InChI=1S/C28H40N4O4/c1-19(2)29-28(35)30-24-11-12-25-23(13-24)14-27(34)32(21(4)18-33)15-20(3)26(36-25)17-31(5)16-22-9-7-6-8-10-22/h6-13,19-21,26,33H,14-18H2,1-5H3,(H2,29,30,35)/t20-,21-,26+/m0/s1	ZPQZMRPPCAYKJS-ISJBWFOZSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)Cc2c1	BroadT	BRD-K72468471	BRD-K72468471-001-01-5	Broad Institute of MIT and Harvard	BRD-K72468471			CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)Cc2c1	InChI=1S/C28H40N4O4/c1-19(2)29-28(35)30-24-11-12-25-23(13-24)14-27(34)32(21(4)18-33)15-20(3)26(36-25)17-31(5)16-22-9-7-6-8-10-22/h6-13,19-21,26,33H,14-18H2,1-5H3,(H2,29,30,35)/t20-,21-,26+/m0/s1	ZPQZMRPPCAYKJS-ISJBWFOZSA-N	496.3049558							108872
BRD-K46082587	LSM-20272		44485589	InChI=1S/C29H39N5O5/c1-19-16-34(20(2)18-35)28(37)23-10-7-11-24(32-27(36)21-12-14-30-15-13-21)26(23)39-25(19)17-33(3)29(38)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,25,35H,4-6,8-9,16-18H2,1-3H3,(H,31,38)(H,32,36)/t19-,20+,25-/m0/s1	KKCRHGGATFNVQS-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K46082587	BRD-K46082587-001-01-8	Broad Institute of MIT and Harvard	BRD-K46082587			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C29H39N5O5/c1-19-16-34(20(2)18-35)28(37)23-10-7-11-24(32-27(36)21-12-14-30-15-13-21)26(23)39-25(19)17-33(3)29(38)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,25,35H,4-6,8-9,16-18H2,1-3H3,(H,31,38)(H,32,36)/t19-,20+,25-/m0/s1	KKCRHGGATFNVQS-DFIYOIEZSA-N	537.295119398							108873
BRD-K03875473	LSM-20273		44500632	InChI=1S/C31H39F3N4O5/c1-19-16-38(20(2)18-39)29(41)25-15-24(35-28(40)21-7-5-4-6-8-21)13-14-26(25)43-27(19)17-37(3)30(42)36-23-11-9-22(10-12-23)31(32,33)34/h9-15,19-21,27,39H,4-8,16-18H2,1-3H3,(H,35,40)(H,36,42)/t19-,20+,27-/m0/s1	AZWNSNCWAAAZSD-VKIDHGPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K03875473	BRD-K03875473-001-01-3	Broad Institute of MIT and Harvard	BRD-K03875473			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C31H39F3N4O5/c1-19-16-38(20(2)18-39)29(41)25-15-24(35-28(40)21-7-5-4-6-8-21)13-14-26(25)43-27(19)17-37(3)30(42)36-23-11-9-22(10-12-23)31(32,33)34/h9-15,19-21,27,39H,4-8,16-18H2,1-3H3,(H,35,40)(H,36,42)/t19-,20+,27-/m0/s1	AZWNSNCWAAAZSD-VKIDHGPPSA-N	604.287254988							108874
BRD-K61020385	LSM-20274		44495910	InChI=1S/C18H29N3O5S/c1-12-10-21(13(2)11-22)18(23)8-14-7-15(20-27(4,24)25)5-6-16(14)26-17(12)9-19-3/h5-7,12-13,17,19-20,22H,8-11H2,1-4H3/t12-,13-,17+/m1/s1	XOTYHNIEAMYTDW-XNJGSVPQSA-N	CNC[C@@H]1Oc2ccc(NS(=O)(=O)C)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K61020385	BRD-K61020385-001-01-2	Broad Institute of MIT and Harvard	BRD-K61020385			CNC[C@@H]1Oc2ccc(NS(C)(=O)=O)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C18H29N3O5S/c1-12-10-21(13(2)11-22)18(23)8-14-7-15(20-27(4,24)25)5-6-16(14)26-17(12)9-19-3/h5-7,12-13,17,19-20,22H,8-11H2,1-4H3/t12-,13-,17+/m1/s1	XOTYHNIEAMYTDW-XNJGSVPQSA-N	399.182791748							108875
BRD-K37433647	LSM-20275		44498286	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15+,21+/m0/s1	LUEPMRNQGZCFGP-PDSXEYIOSA-N	CNC[C@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K37433647	BRD-K37433647-001-01-2	Broad Institute of MIT and Harvard	BRD-K37433647			CNC[C@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15+,21+/m0/s1	LUEPMRNQGZCFGP-PDSXEYIOSA-N	470.21653472							108876
BRD-K77782946	LSM-20276		44503816	InChI=1S/C30H32F3N5O5/c1-18-15-38(19(2)17-39)28(41)24-14-23(35-27(40)20-10-12-34-13-11-20)8-9-25(24)43-26(18)16-37(3)29(42)36-22-6-4-21(5-7-22)30(31,32)33/h4-14,18-19,26,39H,15-17H2,1-3H3,(H,35,40)(H,36,42)/t18-,19-,26+/m1/s1	CEYHIDAYCYBVJJ-UDCNLSRBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K77782946	BRD-K77782946-001-01-1	Broad Institute of MIT and Harvard	BRD-K77782946			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C30H32F3N5O5/c1-18-15-38(19(2)17-39)28(41)24-14-23(35-27(40)20-10-12-34-13-11-20)8-9-25(24)43-26(18)16-37(3)29(42)36-22-6-4-21(5-7-22)30(31,32)33/h4-14,18-19,26,39H,15-17H2,1-3H3,(H,35,40)(H,36,42)/t18-,19-,26+/m1/s1	CEYHIDAYCYBVJJ-UDCNLSRBSA-N	599.235553774							108877
BRD-K01096898	LSM-20277		44501436	InChI=1S/C29H35F3N4O7/c1-17-13-36(18(2)15-37)27(39)11-19-10-20(33-26(38)8-9-29(30,31)32)4-6-22(19)43-25(17)14-35(3)28(40)34-21-5-7-23-24(12-21)42-16-41-23/h4-7,10,12,17-18,25,37H,8-9,11,13-16H2,1-3H3,(H,33,38)(H,34,40)/t17-,18-,25-/m1/s1	PUSPJJJYURZHGK-QJMRKGMQSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCC(F)(F)F)cc4CC1=O	BroadT	BRD-K01096898	BRD-K01096898-001-01-5	Broad Institute of MIT and Harvard	BRD-K01096898			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C29H35F3N4O7/c1-17-13-36(18(2)15-37)27(39)11-19-10-20(33-26(38)8-9-29(30,31)32)4-6-22(19)43-25(17)14-35(3)28(40)34-21-5-7-23-24(12-21)42-16-41-23/h4-7,10,12,17-18,25,37H,8-9,11,13-16H2,1-3H3,(H,33,38)(H,34,40)/t17-,18-,25-/m1/s1	PUSPJJJYURZHGK-QJMRKGMQSA-N	608.2457841							108878
BRD-K59445060	LSM-20278		44618733	InChI=1S/C26H37N3O6S/c1-18-15-29(19(2)17-30)26(31)14-20-13-21(27(3)4)7-12-24(20)35-25(18)16-28(5)36(32,33)23-10-8-22(34-6)9-11-23/h7-13,18-19,25,30H,14-17H2,1-6H3/t18-,19+,25+/m0/s1	JDKUWABUTZZKAJ-OSWQYVSFSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2Oc3ccc(cc3CC(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C	BroadT	BRD-K59445060	BRD-K59445060-001-01-7	Broad Institute of MIT and Harvard	BRD-K59445060			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1Oc2ccc(cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C26H37N3O6S/c1-18-15-29(19(2)17-30)26(31)14-20-13-21(27(3)4)7-12-24(20)35-25(18)16-28(5)36(32,33)23-10-8-22(34-6)9-11-23/h7-13,18-19,25,30H,14-17H2,1-6H3/t18-,19+,25+/m0/s1	JDKUWABUTZZKAJ-OSWQYVSFSA-N	519.240306624							108879
BRD-K25600773	LSM-20279		44504903	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28+/m0/s1	WWNAWZZZIRHUSD-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)Nc4ccccc4)cc3CC1=O	BroadT	BRD-K25600773	BRD-K25600773-001-01-6	Broad Institute of MIT and Harvard	BRD-K25600773			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28+/m0/s1	WWNAWZZZIRHUSD-YHGPEZAFSA-N	598.22613377							108880
BRD-K26184956	LSM-20280		44495911	InChI=1S/C21H31N5O5S/c1-14-10-26(15(2)12-27)21(28)8-16-7-17(5-6-18(16)31-19(14)9-22-3)24-32(29,30)20-11-25(4)13-23-20/h5-7,11,13-15,19,22,24,27H,8-10,12H2,1-4H3/t14-,15-,19+/m1/s1	CHBVISFKEYYRMC-CLCXKQKWSA-N	CNC[C@@H]1Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K26184956	BRD-K26184956-001-01-9	Broad Institute of MIT and Harvard	BRD-K26184956			CNC[C@@H]1Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C21H31N5O5S/c1-14-10-26(15(2)12-27)21(28)8-16-7-17(5-6-18(16)31-19(14)9-22-3)24-32(29,30)20-11-25(4)13-23-20/h5-7,11,13-15,19,22,24,27H,8-10,12H2,1-4H3/t14-,15-,19+/m1/s1	CHBVISFKEYYRMC-CLCXKQKWSA-N	465.204589832							108881
BRD-K34318928	LSM-20281		44500829	InChI=1S/C36H40N4O4/c1-25-21-40(26(2)24-41)35(42)20-31-19-32(38-36(43)30-15-17-37-18-16-30)13-14-33(31)44-34(25)23-39(3)22-27-9-11-29(12-10-27)28-7-5-4-6-8-28/h4-19,25-26,34,41H,20-24H2,1-3H3,(H,38,43)/t25-,26-,34+/m0/s1	IQSVNIDGIMJPQN-XIWHWFKQSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)c3ccccc3)Oc4ccc(NC(=O)c5ccncc5)cc4CC1=O	BroadT	BRD-K34318928	BRD-K34318928-001-01-8	Broad Institute of MIT and Harvard	BRD-K34318928			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)-c2ccccc2)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C36H40N4O4/c1-25-21-40(26(2)24-41)35(42)20-31-19-32(38-36(43)30-15-17-37-18-16-30)13-14-33(31)44-34(25)23-39(3)22-27-9-11-29(12-10-27)28-7-5-4-6-8-28/h4-19,25-26,34,41H,20-24H2,1-3H3,(H,38,43)/t25-,26-,34+/m0/s1	IQSVNIDGIMJPQN-XIWHWFKQSA-N	592.3049558							108882
BRD-K72792753-001-01-7	LSM-20282	BRD-K72792753	44494069	InChI=1S/C25H37N5O5/c1-15-12-30(16(2)14-31)23(32)11-19-10-20(28(5)6)8-9-21(19)34-22(15)13-29(7)25(33)26-24-17(3)27-35-18(24)4/h8-10,15-16,22,31H,11-14H2,1-7H3,(H,26,33)/t15-,16-,22+/m1/s1	GPPKFMUWSJEKJP-MCFFVMPBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K72792753	BRD-K72792753-001-01-7	Broad Institute of MIT and Harvard	BRD-K72792753			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C25H37N5O5/c1-15-12-30(16(2)14-31)23(32)11-19-10-20(28(5)6)8-9-21(19)34-22(15)13-29(7)25(33)26-24-17(3)27-35-18(24)4/h8-10,15-16,22,31H,11-14H2,1-7H3,(H,26,33)/t15-,16-,22+/m1/s1	GPPKFMUWSJEKJP-MCFFVMPBSA-N	487.279469334							108883
BRD-K96069147	LSM-20283		44497240	InChI=1S/C24H33N3O6S/c1-16-14-27(17(2)15-28)24(29)12-18-11-19(5-10-22(18)33-23(16)13-25-3)26-34(30,31)21-8-6-20(32-4)7-9-21/h5-11,16-17,23,25-26,28H,12-15H2,1-4H3/t16-,17-,23+/m0/s1	WHSSCNZRIKSNFR-HKARXFIJSA-N	CNC[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K96069147	BRD-K96069147-001-01-7	Broad Institute of MIT and Harvard	BRD-K96069147			CNC[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H33N3O6S/c1-16-14-27(17(2)15-28)24(29)12-18-11-19(5-10-22(18)33-23(16)13-25-3)26-34(30,31)21-8-6-20(32-4)7-9-21/h5-11,16-17,23,25-26,28H,12-15H2,1-4H3/t16-,17-,23+/m0/s1	WHSSCNZRIKSNFR-HKARXFIJSA-N	491.209006496							108884
BRD-K76755163	LSM-20284		44490827	InChI=1S/C24H29F3N4O4/c1-14-12-31(15(2)13-32)22(33)18-5-4-6-19(21(18)35-20(14)11-28-3)30-23(34)29-17-9-7-16(8-10-17)24(25,26)27/h4-10,14-15,20,28,32H,11-13H2,1-3H3,(H2,29,30,34)/t14-,15-,20-/m0/s1	KNPSDLIHJHZPLR-AVYPCKFXSA-N	CNC[C@@H]1Oc2c(NC(=O)Nc3ccc(cc3)C(F)(F)F)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K76755163	BRD-K76755163-001-01-4	Broad Institute of MIT and Harvard	BRD-K76755163			CNC[C@@H]1Oc2c(NC(=O)Nc3ccc(cc3)C(F)(F)F)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H29F3N4O4/c1-14-12-31(15(2)13-32)22(33)18-5-4-6-19(21(18)35-20(14)11-28-3)30-23(34)29-17-9-7-16(8-10-17)24(25,26)27/h4-10,14-15,20,28,32H,11-13H2,1-3H3,(H2,29,30,34)/t14-,15-,20-/m0/s1	KNPSDLIHJHZPLR-AVYPCKFXSA-N	494.214090048							108885
BRD-K87092114	LSM-20285		44503255	InChI=1S/C27H37N3O5/c1-18-13-30(19(2)16-31)27(32)12-21-11-22(28(3)4)7-9-23(21)35-26(18)15-29(5)14-20-6-8-24-25(10-20)34-17-33-24/h6-11,18-19,26,31H,12-17H2,1-5H3/t18-,19-,26-/m0/s1	VAKWQMKHOINUIK-DGUDUIIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(cc4CC1=O)N(C)C	BroadT	BRD-K87092114	BRD-K87092114-001-01-9	Broad Institute of MIT and Harvard	BRD-K87092114			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C27H37N3O5/c1-18-13-30(19(2)16-31)27(32)12-21-11-22(28(3)4)7-9-23(21)35-26(18)15-29(5)14-20-6-8-24-25(10-20)34-17-33-24/h6-11,18-19,26,31H,12-17H2,1-5H3/t18-,19-,26-/m0/s1	VAKWQMKHOINUIK-DGUDUIIESA-N	483.273321314							108886
BRD-K92009052	LSM-20286		44504123	InChI=1S/C25H31F3N4O4/c1-15-13-32(16(2)14-33)23(34)11-17-10-20(8-9-21(17)36-22(15)12-29-3)31-24(35)30-19-6-4-18(5-7-19)25(26,27)28/h4-10,15-16,22,29,33H,11-14H2,1-3H3,(H2,30,31,35)/t15-,16-,22-/m0/s1	NMJAJKSBHFWFOJ-WCJKSRRJSA-N	CNC[C@@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K92009052	BRD-K92009052-001-01-0	Broad Institute of MIT and Harvard	BRD-K92009052			CNC[C@@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C25H31F3N4O4/c1-15-13-32(16(2)14-33)23(34)11-17-10-20(8-9-21(17)36-22(15)12-29-3)31-24(35)30-19-6-4-18(5-7-19)25(26,27)28/h4-10,15-16,22,29,33H,11-14H2,1-3H3,(H2,30,31,35)/t15-,16-,22-/m0/s1	NMJAJKSBHFWFOJ-WCJKSRRJSA-N	508.229740112							108887
BRD-K82922770	LSM-20287		44618461	InChI=1S/C27H39N5O5/c1-16-12-32(17(2)15-33)25(34)11-21-10-22(28-27(35)29-26-18(3)30-37-19(26)4)8-9-23(21)36-24(16)14-31(5)13-20-6-7-20/h8-10,16-17,20,24,33H,6-7,11-15H2,1-5H3,(H2,28,29,35)/t16-,17+,24+/m0/s1	RRKRQZMEMKUNGW-OBWXTZQISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3CC1=O	BroadT	BRD-K82922770	BRD-K82922770-001-01-7	Broad Institute of MIT and Harvard	BRD-K82922770			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2CC1=O	InChI=1S/C27H39N5O5/c1-16-12-32(17(2)15-33)25(34)11-21-10-22(28-27(35)29-26-18(3)30-37-19(26)4)8-9-23(21)36-24(16)14-31(5)13-20-6-7-20/h8-10,16-17,20,24,33H,6-7,11-15H2,1-5H3,(H2,28,29,35)/t16-,17+,24+/m0/s1	RRKRQZMEMKUNGW-OBWXTZQISA-N	513.295119398							108888
BRD-K56401968	LSM-20288		44485204	InChI=1S/C30H42ClN3O5S/c1-21-17-34(22(2)20-35)30(36)16-24-15-26(32-40(37,38)27-12-9-25(31)10-13-27)11-14-28(24)39-29(21)19-33(3)18-23-7-5-4-6-8-23/h9-15,21-23,29,32,35H,4-8,16-20H2,1-3H3/t21-,22+,29+/m0/s1	YELAEPJECDEDIZ-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3CC1=O	BroadT	BRD-K56401968	BRD-K56401968-001-01-6	Broad Institute of MIT and Harvard	BRD-K56401968			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2CC1=O	InChI=1S/C30H42ClN3O5S/c1-21-17-34(22(2)20-35)30(36)16-24-15-26(32-40(37,38)27-12-9-25(31)10-13-27)11-14-28(24)39-29(21)19-33(3)18-23-7-5-4-6-8-23/h9-15,21-23,29,32,35H,4-8,16-20H2,1-3H3/t21-,22+,29+/m0/s1	YELAEPJECDEDIZ-DKGMKSHISA-N	591.253369874							108889
BRD-K64811593	LSM-20289		44499700	InChI=1S/C26H35N3O5/c1-17-12-29(18(2)15-30)26(31)20-7-6-8-21(27(3)4)25(20)34-24(17)14-28(5)13-19-9-10-22-23(11-19)33-16-32-22/h6-11,17-18,24,30H,12-16H2,1-5H3/t17-,18-,24+/m0/s1	MTQIGCHWPBYMPN-LLJLJFOGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K64811593	BRD-K64811593-001-01-9	Broad Institute of MIT and Harvard	BRD-K64811593			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H35N3O5/c1-17-12-29(18(2)15-30)26(31)20-7-6-8-21(27(3)4)25(20)34-24(17)14-28(5)13-19-9-10-22-23(11-19)33-16-32-22/h6-11,17-18,24,30H,12-16H2,1-5H3/t17-,18-,24+/m0/s1	MTQIGCHWPBYMPN-LLJLJFOGSA-N	469.25767125							108890
BRD-K77892726	LSM-20290		44486265	InChI=1S/C25H33N3O4/c1-17-15-28(18(2)16-29)25(31)13-20-12-21(9-10-22(20)32-23(17)14-26-3)27-24(30)11-19-7-5-4-6-8-19/h4-10,12,17-18,23,26,29H,11,13-16H2,1-3H3,(H,27,30)/t17-,18-,23-/m0/s1	RIHRPLOFFJCHJI-BSRJHKFKSA-N	CNC[C@@H]1Oc2ccc(NC(=O)Cc3ccccc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K77892726	BRD-K77892726-001-01-4	Broad Institute of MIT and Harvard	BRD-K77892726			CNC[C@@H]1Oc2ccc(NC(=O)Cc3ccccc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C25H33N3O4/c1-17-15-28(18(2)16-29)25(31)13-20-12-21(9-10-22(20)32-23(17)14-26-3)27-24(30)11-19-7-5-4-6-8-19/h4-10,12,17-18,23,26,29H,11,13-16H2,1-3H3,(H,27,30)/t17-,18-,23-/m0/s1	RIHRPLOFFJCHJI-BSRJHKFKSA-N	439.247106566							108891
BRD-K81169734	LSM-20291		44501189	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28-/m1/s1	WWNAWZZZIRHUSD-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)Nc4ccccc4)cc3CC1=O	BroadT	BRD-K81169734	BRD-K81169734-001-01-1	Broad Institute of MIT and Harvard	BRD-K81169734			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28-/m1/s1	WWNAWZZZIRHUSD-PHVLTXCSSA-N	598.22613377							108892
BRD-K30533903	LSM-20292		54613808	InChI=1S/C27H33ClF3N3O6S/c1-17-14-34(18(2)16-35)26(37)13-19-12-21(32-25(36)10-11-27(29,30)31)6-9-23(19)40-24(17)15-33(3)41(38,39)22-7-4-20(28)5-8-22/h4-9,12,17-18,24,35H,10-11,13-16H2,1-3H3,(H,32,36)/t17-,18+,24+/m0/s1	BTSOZOCIIHDJJX-HOOSLVGPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC1=O	BroadT	BRD-K30533903	BRD-K30533903-001-01-5	Broad Institute of MIT and Harvard	BRD-K30533903			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C27H33ClF3N3O6S/c1-17-14-34(18(2)16-35)26(37)13-19-12-21(32-25(36)10-11-27(29,30)31)6-9-23(19)40-24(17)15-33(3)41(38,39)22-7-4-20(28)5-8-22/h4-9,12,17-18,24,35H,10-11,13-16H2,1-3H3,(H,32,36)/t17-,18+,24+/m0/s1	BTSOZOCIIHDJJX-HOOSLVGPSA-N	619.173068806							108893
BRD-K32537206	LSM-20293		44491903	InChI=1S/C24H29F3N4O4/c1-14-12-31(15(2)13-32)22(33)18-5-4-6-19(21(18)35-20(14)11-28-3)30-23(34)29-17-9-7-16(8-10-17)24(25,26)27/h4-10,14-15,20,28,32H,11-13H2,1-3H3,(H2,29,30,34)/t14-,15+,20-/m0/s1	KNPSDLIHJHZPLR-MDOVXXIYSA-N	CNC[C@@H]1Oc2c(NC(=O)Nc3ccc(cc3)C(F)(F)F)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K32537206	BRD-K32537206-001-01-8	Broad Institute of MIT and Harvard	BRD-K32537206			CNC[C@@H]1Oc2c(NC(=O)Nc3ccc(cc3)C(F)(F)F)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H29F3N4O4/c1-14-12-31(15(2)13-32)22(33)18-5-4-6-19(21(18)35-20(14)11-28-3)30-23(34)29-17-9-7-16(8-10-17)24(25,26)27/h4-10,14-15,20,28,32H,11-13H2,1-3H3,(H2,29,30,34)/t14-,15+,20-/m0/s1	KNPSDLIHJHZPLR-MDOVXXIYSA-N	494.214090048							108894
CHEMBL2355969	LSM-20294	SID87218818, SID85813850, BRD-K54265757	44506687	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,29-/m1/s1	SREUWAAPQJIJAQ-UETOGOEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K54265757	BRD-K54265757-001-01-2	Broad Institute of MIT and Harvard	BRD-K54265757			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)25-9-8-12-28(35(3)4)30(25)41-29(21)19-36(5)18-23-13-15-24(16-14-23)31(39)34-27-11-7-6-10-26(27)33/h6-16,21-22,29,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,29-/m1/s1	SREUWAAPQJIJAQ-UETOGOEVSA-N	559.315854842							108895
BRD-K94360146	LSM-20295		44491000	InChI=1S/C22H35N3O5S/c1-15-11-25(16(2)14-26)22(27)10-18-9-19(23-31(4,28)29)7-8-20(18)30-21(15)13-24(3)12-17-5-6-17/h7-9,15-17,21,23,26H,5-6,10-14H2,1-4H3/t15-,16+,21+/m1/s1	LKTOUOMEFKMKTF-XFQAVAEZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K94360146	BRD-K94360146-001-01-3	Broad Institute of MIT and Harvard	BRD-K94360146			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C22H35N3O5S/c1-15-11-25(16(2)14-26)22(27)10-18-9-19(23-31(4,28)29)7-8-20(18)30-21(15)13-24(3)12-17-5-6-17/h7-9,15-17,21,23,26H,5-6,10-14H2,1-4H3/t15-,16+,21+/m1/s1	LKTOUOMEFKMKTF-XFQAVAEZSA-N	453.22974194							108896
BRD-K52223190	LSM-20296		44492537	InChI=1S/C28H34N4O4/c1-18-16-32(19(2)17-33)27(34)14-21-13-22(11-12-25(21)36-26(18)15-29-3)30-28(35)31-24-10-6-8-20-7-4-5-9-23(20)24/h4-13,18-19,26,29,33H,14-17H2,1-3H3,(H2,30,31,35)/t18-,19+,26-/m1/s1	KOOMWTSRVMNQAA-UYXZNNOOSA-N	CNC[C@H]1Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K52223190	BRD-K52223190-001-01-8	Broad Institute of MIT and Harvard	BRD-K52223190			CNC[C@H]1Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H34N4O4/c1-18-16-32(19(2)17-33)27(34)14-21-13-22(11-12-25(21)36-26(18)15-29-3)30-28(35)31-24-10-6-8-20-7-4-5-9-23(20)24/h4-13,18-19,26,29,33H,14-17H2,1-3H3,(H2,30,31,35)/t18-,19+,26-/m1/s1	KOOMWTSRVMNQAA-UYXZNNOOSA-N	490.258005608							108897
BRD-K04614055	LSM-20297		44503257	InChI=1S/C31H49N5O6/c1-22-19-36(23(2)21-37)30(39)18-24-17-26(32-29(38)11-12-35-13-15-41-16-14-35)9-10-27(24)42-28(22)20-34(3)31(40)33-25-7-5-4-6-8-25/h9-10,17,22-23,25,28,37H,4-8,11-16,18-21H2,1-3H3,(H,32,38)(H,33,40)/t22-,23-,28-/m0/s1	VGGDTLLTAGJVNH-LXWOLXCRSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)CCN4CCOCC4)cc3CC1=O	BroadT	BRD-K04614055	BRD-K04614055-001-01-1	Broad Institute of MIT and Harvard	BRD-K04614055			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC1=O	InChI=1S/C31H49N5O6/c1-22-19-36(23(2)21-37)30(39)18-24-17-26(32-29(38)11-12-35-13-15-41-16-14-35)9-10-27(24)42-28(22)20-34(3)31(40)33-25-7-5-4-6-8-25/h9-10,17,22-23,25,28,37H,4-8,11-16,18-21H2,1-3H3,(H,32,38)(H,33,40)/t22-,23-,28-/m0/s1	VGGDTLLTAGJVNH-LXWOLXCRSA-N	587.368284338							108898
BRD-K50617795	LSM-20298		44501571	InChI=1S/C28H40N4O4/c1-19(2)29-28(35)30-24-11-12-25-23(13-24)14-27(34)32(21(4)18-33)15-20(3)26(36-25)17-31(5)16-22-9-7-6-8-10-22/h6-13,19-21,26,33H,14-18H2,1-5H3,(H2,29,30,35)/t20-,21+,26-/m1/s1	ZPQZMRPPCAYKJS-YZIHRLCOSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)Cc2c1	BroadT	BRD-K50617795	BRD-K50617795-001-01-2	Broad Institute of MIT and Harvard	BRD-K50617795			CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)Cc2c1	InChI=1S/C28H40N4O4/c1-19(2)29-28(35)30-24-11-12-25-23(13-24)14-27(34)32(21(4)18-33)15-20(3)26(36-25)17-31(5)16-22-9-7-6-8-10-22/h6-13,19-21,26,33H,14-18H2,1-5H3,(H2,29,30,35)/t20-,21+,26-/m1/s1	ZPQZMRPPCAYKJS-YZIHRLCOSA-N	496.3049558							108899
BRD-K91268803	LSM-20299		44486922	InChI=1S/C25H32N4O6/c1-15-12-29(16(2)13-30)24(31)9-17-8-18(4-6-20(17)35-23(15)11-26-3)27-25(32)28-19-5-7-21-22(10-19)34-14-33-21/h4-8,10,15-16,23,26,30H,9,11-14H2,1-3H3,(H2,27,28,32)/t15-,16-,23-/m0/s1	BRYKRAAGJVMQDR-KXNSMUHISA-N	CNC[C@@H]1Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K91268803	BRD-K91268803-001-01-5	Broad Institute of MIT and Harvard	BRD-K91268803			CNC[C@@H]1Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C25H32N4O6/c1-15-12-29(16(2)13-30)24(31)9-17-8-18(4-6-20(17)35-23(15)11-26-3)27-25(32)28-19-5-7-21-22(10-19)34-14-33-21/h4-8,10,15-16,23,26,30H,9,11-14H2,1-3H3,(H2,27,28,32)/t15-,16-,23-/m0/s1	BRYKRAAGJVMQDR-KXNSMUHISA-N	484.232184784							108900
BRD-K96978561	LSM-20300		44497557	InChI=1S/C28H39N5O4/c1-19-15-33(20(2)18-34)28(36)22-10-7-11-23(31-27(35)24-14-29-12-13-30-24)26(22)37-25(19)17-32(3)16-21-8-5-4-6-9-21/h7,10-14,19-21,25,34H,4-6,8-9,15-18H2,1-3H3,(H,31,35)/t19-,20-,25-/m1/s1	QUBNYOYZPRCGDK-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K96978561	BRD-K96978561-001-01-6	Broad Institute of MIT and Harvard	BRD-K96978561			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H39N5O4/c1-19-15-33(20(2)18-34)28(36)22-10-7-11-23(31-27(35)24-14-29-12-13-30-24)26(22)37-25(19)17-32(3)16-21-8-5-4-6-9-21/h7,10-14,19-21,25,34H,4-6,8-9,15-18H2,1-3H3,(H,31,35)/t19-,20-,25-/m1/s1	QUBNYOYZPRCGDK-UMEGOILYSA-N	509.300204778							108901
BRD-K94616959	LSM-20301		44503988	InChI=1S/C32H45N5O6/c1-21-18-37(22(2)20-38)30(39)17-23-16-26(34-31(40)33-24-8-6-5-7-9-24)12-15-28(23)43-29(21)19-36(3)32(41)35-25-10-13-27(42-4)14-11-25/h10-16,21-22,24,29,38H,5-9,17-20H2,1-4H3,(H,35,41)(H2,33,34,40)/t21-,22-,29+/m1/s1	SMGQOPDVSHJVMI-QLVXXPONSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)NC4CCCCC4)cc3CC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K94616959	BRD-K94616959-001-01-4	Broad Institute of MIT and Harvard	BRD-K94616959			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)NC4CCCCC4)cc3CC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C32H45N5O6/c1-21-18-37(22(2)20-38)30(39)17-23-16-26(34-31(40)33-24-8-6-5-7-9-24)12-15-28(23)43-29(21)19-36(3)32(41)35-25-10-13-27(42-4)14-11-25/h10-16,21-22,24,29,38H,5-9,17-20H2,1-4H3,(H,35,41)(H2,33,34,40)/t21-,22-,29+/m1/s1	SMGQOPDVSHJVMI-QLVXXPONSA-N	595.33698421							108902
BRD-K64434200	LSM-20302		44495558	InChI=1S/C25H37N5O5/c1-15-12-30(16(2)14-31)23(32)11-19-10-20(28(5)6)8-9-21(19)34-22(15)13-29(7)25(33)26-24-17(3)27-35-18(24)4/h8-10,15-16,22,31H,11-14H2,1-7H3,(H,26,33)/t15-,16+,22+/m0/s1	GPPKFMUWSJEKJP-WJONJSRFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K64434200	BRD-K64434200-001-01-5	Broad Institute of MIT and Harvard	BRD-K64434200			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C25H37N5O5/c1-15-12-30(16(2)14-31)23(32)11-19-10-20(28(5)6)8-9-21(19)34-22(15)13-29(7)25(33)26-24-17(3)27-35-18(24)4/h8-10,15-16,22,31H,11-14H2,1-7H3,(H,26,33)/t15-,16+,22+/m0/s1	GPPKFMUWSJEKJP-WJONJSRFSA-N	487.279469334							108903
BRD-K00323141	LSM-20303		44491547	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14+,18+/m0/s1	WYKJOBISBUCKND-PMUMKWKESA-N	CNC[C@H]1Oc2ccc(cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K00323141	BRD-K00323141-001-01-9	Broad Institute of MIT and Harvard	BRD-K00323141			CNC[C@H]1Oc2ccc(cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14+,18+/m0/s1	WYKJOBISBUCKND-PMUMKWKESA-N	349.236541882							108904
BRD-K93335719	LSM-20304		44503062	InChI=1S/C27H39N5O5/c1-16-12-32(17(2)15-33)25(34)11-21-10-22(28-27(35)29-26-18(3)30-37-19(26)4)8-9-23(21)36-24(16)14-31(5)13-20-6-7-20/h8-10,16-17,20,24,33H,6-7,11-15H2,1-5H3,(H2,28,29,35)/t16-,17-,24+/m1/s1	RRKRQZMEMKUNGW-OJLQRUNKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3CC1=O	BroadT	BRD-K93335719	BRD-K93335719-001-01-3	Broad Institute of MIT and Harvard	BRD-K93335719			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2CC1=O	InChI=1S/C27H39N5O5/c1-16-12-32(17(2)15-33)25(34)11-21-10-22(28-27(35)29-26-18(3)30-37-19(26)4)8-9-23(21)36-24(16)14-31(5)13-20-6-7-20/h8-10,16-17,20,24,33H,6-7,11-15H2,1-5H3,(H2,28,29,35)/t16-,17-,24+/m1/s1	RRKRQZMEMKUNGW-OJLQRUNKSA-N	513.295119398							108905
BRD-K03191078	LSM-20305		44499892	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16+,20-/m0/s1	DJIXJENXBPUHIX-YRNRMSPPSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K03191078	BRD-K03191078-001-01-4	Broad Institute of MIT and Harvard	BRD-K03191078			CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16+,20-/m0/s1	DJIXJENXBPUHIX-YRNRMSPPSA-N	460.268570292							108906
BRD-K09767767	LSM-20306		44504791	InChI=1S/C31H38F3N5O5/c1-18-14-39(19(2)17-40)28(41)13-23-12-25(35-30(42)36-29-20(3)37-44-21(29)4)10-11-26(23)43-27(18)16-38(5)15-22-6-8-24(9-7-22)31(32,33)34/h6-12,18-19,27,40H,13-17H2,1-5H3,(H2,35,36,42)/t18-,19-,27-/m1/s1	XNWPWURMKBHVTJ-DRGJWEBESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3CC1=O	BroadT	BRD-K09767767	BRD-K09767767-001-01-1	Broad Institute of MIT and Harvard	BRD-K09767767			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2CC1=O	InChI=1S/C31H38F3N5O5/c1-18-14-39(19(2)17-40)28(41)13-23-12-25(35-30(42)36-29-20(3)37-44-21(29)4)10-11-26(23)43-27(18)16-38(5)15-22-6-8-24(9-7-22)31(32,33)34/h6-12,18-19,27,40H,13-17H2,1-5H3,(H2,35,36,42)/t18-,19-,27-/m1/s1	XNWPWURMKBHVTJ-DRGJWEBESA-N	617.282503966							108907
BRD-K05501176	LSM-20307		44488590	InChI=1S/C31H37N3O8S/c1-20-15-34(21(2)18-35)31(36)25-6-5-7-26(32-43(37,38)24-11-9-23(39-4)10-12-24)30(25)42-29(20)17-33(3)16-22-8-13-27-28(14-22)41-19-40-27/h5-14,20-21,29,32,35H,15-19H2,1-4H3/t20-,21+,29+/m1/s1	AELUQFUEWCFKFM-CGQTXMLISA-N	COc1ccc(cc1)S(=O)(=O)Nc2cccc3C(=O)N(C[C@@H](C)[C@H](CN(C)Cc4ccc5OCOc5c4)Oc23)[C@@H](C)CO	BroadT	BRD-K05501176	BRD-K05501176-001-01-3	Broad Institute of MIT and Harvard	BRD-K05501176			COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1O[C@@H](CN(C)Cc1ccc3OCOc3c1)[C@H](C)CN([C@@H](C)CO)C2=O	InChI=1S/C31H37N3O8S/c1-20-15-34(21(2)18-35)31(36)25-6-5-7-26(32-43(37,38)24-11-9-23(39-4)10-12-24)30(25)42-29(20)17-33(3)16-22-8-13-27-28(14-22)41-19-40-27/h5-14,20-21,29,32,35H,15-19H2,1-4H3/t20-,21+,29+/m1/s1	AELUQFUEWCFKFM-CGQTXMLISA-N	611.230135864							108908
BRD-K12384030	LSM-20308		44496714	InChI=1S/C28H31FN6O5/c1-17-14-35(18(2)16-36)27(38)21-5-4-6-22(33-26(37)23-13-30-11-12-31-23)25(21)40-24(17)15-34(3)28(39)32-20-9-7-19(29)8-10-20/h4-13,17-18,24,36H,14-16H2,1-3H3,(H,32,39)(H,33,37)/t17-,18+,24+/m0/s1	CPPFQQQOTXHNMM-HOOSLVGPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K12384030	BRD-K12384030-001-01-1	Broad Institute of MIT and Harvard	BRD-K12384030			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H31FN6O5/c1-17-14-35(18(2)16-36)27(38)21-5-4-6-22(33-26(37)23-13-30-11-12-31-23)25(21)40-24(17)15-34(3)28(39)32-20-9-7-19(29)8-10-20/h4-13,17-18,24,36H,14-16H2,1-3H3,(H,32,39)(H,33,37)/t17-,18+,24+/m0/s1	CPPFQQQOTXHNMM-HOOSLVGPSA-N	550.233996352							108909
BRD-K86288396	LSM-20309		44503763	InChI=1S/C33H39N7O5/c1-23-17-40(24(2)21-41)33(43)16-26-15-27(35-32(42)20-39-22-34-36-37-39)11-14-30(26)45-31(23)19-38(3)18-25-9-12-29(13-10-25)44-28-7-5-4-6-8-28/h4-15,22-24,31,41H,16-21H2,1-3H3,(H,35,42)/t23-,24-,31-/m0/s1	PROAVNUGSAEHPP-MKGJDZFWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(NC(=O)Cn5cnnn5)cc4CC1=O	BroadT	BRD-K86288396	BRD-K86288396-001-01-3	Broad Institute of MIT and Harvard	BRD-K86288396			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	InChI=1S/C33H39N7O5/c1-23-17-40(24(2)21-41)33(43)16-26-15-27(35-32(42)20-39-22-34-36-37-39)11-14-30(26)45-31(23)19-38(3)18-25-9-12-29(13-10-25)44-28-7-5-4-6-8-28/h4-15,22-24,31,41H,16-21H2,1-3H3,(H,35,42)/t23-,24-,31-/m0/s1	PROAVNUGSAEHPP-MKGJDZFWSA-N	613.301267418							108910
CHEMBL2134659	LSM-20310	BRD-K89687419, SID85800247	44493480	InChI=1S/C34H36FN5O5/c1-21-18-40(22(2)20-41)32(42)27-11-7-13-29(38-33(43)37-28-12-6-9-23-8-4-5-10-26(23)28)31(27)45-30(21)19-39(3)34(44)36-25-16-14-24(35)15-17-25/h4-17,21-22,30,41H,18-20H2,1-3H3,(H,36,44)(H2,37,38,43)/t21-,22+,30-/m0/s1	INJMWLLCIWTMDU-ZQLNOWDWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3c(NC(=O)Nc4cccc5ccccc45)cccc3C1=O	BroadT	BRD-K89687419	BRD-K89687419-001-01-6	Broad Institute of MIT and Harvard	BRD-K89687419			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C1=O	InChI=1S/C34H36FN5O5/c1-21-18-40(22(2)20-41)32(42)27-11-7-13-29(38-33(43)37-28-12-6-9-23-8-4-5-10-26(23)28)31(27)45-30(21)19-39(3)34(44)36-25-16-14-24(35)15-17-25/h4-17,21-22,30,41H,18-20H2,1-3H3,(H,36,44)(H2,37,38,43)/t21-,22+,30-/m0/s1	INJMWLLCIWTMDU-ZQLNOWDWSA-N	613.270047502							108911
BRD-K83942575	LSM-20311		44503074	InChI=1S/C29H35F3N4O7/c1-17-13-36(18(2)15-37)27(39)11-19-10-20(33-26(38)8-9-29(30,31)32)4-6-22(19)43-25(17)14-35(3)28(40)34-21-5-7-23-24(12-21)42-16-41-23/h4-7,10,12,17-18,25,37H,8-9,11,13-16H2,1-3H3,(H,33,38)(H,34,40)/t17-,18-,25+/m1/s1	PUSPJJJYURZHGK-GAKIBJFNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCC(F)(F)F)cc4CC1=O	BroadT	BRD-K83942575	BRD-K83942575-001-01-1	Broad Institute of MIT and Harvard	BRD-K83942575			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C29H35F3N4O7/c1-17-13-36(18(2)15-37)27(39)11-19-10-20(33-26(38)8-9-29(30,31)32)4-6-22(19)43-25(17)14-35(3)28(40)34-21-5-7-23-24(12-21)42-16-41-23/h4-7,10,12,17-18,25,37H,8-9,11,13-16H2,1-3H3,(H,33,38)(H,34,40)/t17-,18-,25+/m1/s1	PUSPJJJYURZHGK-GAKIBJFNSA-N	608.2457841							108912
BRD-K21838437	LSM-20312		44499954	InChI=1S/C30H43N3O6S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-40(36,37)25-15-13-24(38-4)14-16-25)29(26)39-28(21)19-32(3)18-23-9-6-5-7-10-23/h8,11-16,21-23,28,31,34H,5-7,9-10,17-20H2,1-4H3/t21-,22-,28-/m1/s1	VVRSDBHKTRDHNY-DQCZWYHMSA-N	COc1ccc(cc1)S(=O)(=O)Nc2cccc3C(=O)N(C[C@@H](C)[C@@H](CN(C)CC4CCCCC4)Oc23)[C@H](C)CO	BroadT	BRD-K21838437	BRD-K21838437-001-01-4	Broad Institute of MIT and Harvard	BRD-K21838437			COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1O[C@H](CN(C)CC1CCCCC1)[C@H](C)CN([C@H](C)CO)C2=O	InChI=1S/C30H43N3O6S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-40(36,37)25-15-13-24(38-4)14-16-25)29(26)39-28(21)19-32(3)18-23-9-6-5-7-10-23/h8,11-16,21-23,28,31,34H,5-7,9-10,17-20H2,1-4H3/t21-,22-,28-/m1/s1	VVRSDBHKTRDHNY-DQCZWYHMSA-N	573.287256816							108913
BRD-K59024795	LSM-15079		44484501	InChI=1S/C23H33N3O5S2/c1-16-13-26(17(2)15-27)22(28)12-18-11-19(24(3)4)8-9-20(18)31-21(16)14-25(5)33(29,30)23-7-6-10-32-23/h6-11,16-17,21,27H,12-15H2,1-5H3/t16-,17+,21-/m1/s1	AXGDQZYYEHOPOR-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K59024795	BRD-K59024795-001-01-2	Broad Institute of MIT and Harvard	BRD-K59024795			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C23H33N3O5S2/c1-16-13-26(17(2)15-27)22(28)12-18-11-19(24(3)4)8-9-20(18)31-21(16)14-25(5)33(29,30)23-7-6-10-32-23/h6-11,16-17,21,27H,12-15H2,1-5H3/t16-,17+,21-/m1/s1	AXGDQZYYEHOPOR-LLGFUMIMSA-N	495.186162566							103735
BRD-K41731186	LSM-20313		44499346	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13+,17-/m0/s1	COTDYGDWXSSLGS-AHIWAGSCSA-N	CNC[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K41731186	BRD-K41731186-001-01-0	Broad Institute of MIT and Harvard	BRD-K41731186			CNC[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13+,17-/m0/s1	COTDYGDWXSSLGS-AHIWAGSCSA-N	375.215806438							108914
BRD-K46655163	LSM-20314		44488560	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14+,18+/m0/s1	TWHSADQACYCNBZ-PMUMKWKESA-N	CNC[C@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K46655163	BRD-K46655163-001-01-3	Broad Institute of MIT and Harvard	BRD-K46655163			CNC[C@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14+,18+/m0/s1	TWHSADQACYCNBZ-PMUMKWKESA-N	413.206304394							108915
BRD-K46820725	LSM-20315		44491959	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15-,19-/m1/s1	YQJJHWKDDJGBPX-SPYBWZPUSA-N	CNC[C@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K46820725	BRD-K46820725-001-01-4	Broad Institute of MIT and Harvard	BRD-K46820725			CNC[C@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15-,19-/m1/s1	YQJJHWKDDJGBPX-SPYBWZPUSA-N	468.183126106							108916
BRD-K31939603	LSM-20316		44501196	InChI=1S/C32H39N3O6S/c1-22-10-13-28(14-11-22)42(39,40)34(4)20-30-23(2)19-35(24(3)21-36)32(38)18-26-17-27(12-15-29(26)41-30)33-31(37)16-25-8-6-5-7-9-25/h5-15,17,23-24,30,36H,16,18-21H2,1-4H3,(H,33,37)/t23-,24+,30-/m1/s1	JFKKEIVDTMFBMW-FSGGQHMVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K31939603	BRD-K31939603-001-01-6	Broad Institute of MIT and Harvard	BRD-K31939603			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C32H39N3O6S/c1-22-10-13-28(14-11-22)42(39,40)34(4)20-30-23(2)19-35(24(3)21-36)32(38)18-26-17-27(12-15-29(26)41-30)33-31(37)16-25-8-6-5-7-9-25/h5-15,17,23-24,30,36H,16,18-21H2,1-4H3,(H,33,37)/t23-,24+,30-/m1/s1	JFKKEIVDTMFBMW-FSGGQHMVSA-N	593.255956688							131254
BRD-K21137917	LSM-20317		44498061	InChI=1S/C29H34FN5O4/c1-19-15-35(20(2)18-36)28(37)24-5-4-6-25(33-29(38)32-23-9-7-22(30)8-10-23)27(24)39-26(19)17-34(3)16-21-11-13-31-14-12-21/h4-14,19-20,26,36H,15-18H2,1-3H3,(H2,32,33,38)/t19-,20+,26-/m0/s1	VBGZKSFWINXWAF-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3c(NC(=O)Nc4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K21137917	BRD-K21137917-001-01-0	Broad Institute of MIT and Harvard	BRD-K21137917			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2c(NC(=O)Nc3ccc(F)cc3)cccc2C1=O	InChI=1S/C29H34FN5O4/c1-19-15-35(20(2)18-36)28(37)24-5-4-6-25(33-29(38)32-23-9-7-22(30)8-10-23)27(24)39-26(19)17-34(3)16-21-11-13-31-14-12-21/h4-14,19-20,26,36H,15-18H2,1-3H3,(H2,32,33,38)/t19-,20+,26-/m0/s1	VBGZKSFWINXWAF-UNVFRBQDSA-N	535.259482818							108919
BRD-K27256143	LSM-20318		44493505	InChI=1S/C23H35N5O5S/c1-16-11-28(17(2)14-29)23(30)10-18-9-19(25(3)4)7-8-20(18)33-21(16)12-27(6)34(31,32)22-13-26(5)15-24-22/h7-9,13,15-17,21,29H,10-12,14H2,1-6H3/t16-,17-,21-/m1/s1	XKGXVARXDYWWSM-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K27256143	BRD-K27256143-001-01-8	Broad Institute of MIT and Harvard	BRD-K27256143			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C23H35N5O5S/c1-16-11-28(17(2)14-29)23(30)10-18-9-19(25(3)4)7-8-20(18)33-21(16)12-27(6)34(31,32)22-13-26(5)15-24-22/h7-9,13,15-17,21,29H,10-12,14H2,1-6H3/t16-,17-,21-/m1/s1	XKGXVARXDYWWSM-CBGDNZLLSA-N	493.23588996							108920
BRD-K72675584	LSM-20319		44494027	InChI=1S/C21H31N5O5S/c1-14-10-26(15(2)12-27)21(28)8-16-7-17(5-6-18(16)31-19(14)9-22-3)24-32(29,30)20-11-25(4)13-23-20/h5-7,11,13-15,19,22,24,27H,8-10,12H2,1-4H3/t14-,15-,19-/m1/s1	CHBVISFKEYYRMC-SPYBWZPUSA-N	CNC[C@H]1Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K72675584	BRD-K72675584-001-01-9	Broad Institute of MIT and Harvard	BRD-K72675584			CNC[C@H]1Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C21H31N5O5S/c1-14-10-26(15(2)12-27)21(28)8-16-7-17(5-6-18(16)31-19(14)9-22-3)24-32(29,30)20-11-25(4)13-23-20/h5-7,11,13-15,19,22,24,27H,8-10,12H2,1-4H3/t14-,15-,19-/m1/s1	CHBVISFKEYYRMC-SPYBWZPUSA-N	465.204589832							108921
BRD-K12555854	LSM-20320		44618085	InChI=1S/C29H38F3N3O5/c1-19-15-35(20(2)18-36)28(38)14-22-13-23(33-27(37)11-12-29(30,31)32)7-10-25(22)40-26(19)17-34(3)16-21-5-8-24(39-4)9-6-21/h5-10,13,19-20,26,36H,11-12,14-18H2,1-4H3,(H,33,37)/t19-,20+,26+/m0/s1	IUJLOVQYFFXLDN-OUDXUNEISA-N	COc1ccc(CN(C)C[C@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K12555854	BRD-K12555854-001-01-9	Broad Institute of MIT and Harvard	BRD-K12555854			COc1ccc(CN(C)C[C@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C29H38F3N3O5/c1-19-15-35(20(2)18-36)28(38)14-22-13-23(33-27(37)11-12-29(30,31)32)7-10-25(22)40-26(19)17-34(3)16-21-5-8-24(39-4)9-6-21/h5-10,13,19-20,26,36H,11-12,14-18H2,1-4H3,(H,33,37)/t19-,20+,26+/m0/s1	IUJLOVQYFFXLDN-OUDXUNEISA-N	565.276355946							108922
BRD-K05001008	LSM-20321		44504628	InChI=1S/C29H38F3N3O5/c1-19-15-35(20(2)18-36)28(38)14-22-13-23(33-27(37)11-12-29(30,31)32)7-10-25(22)40-26(19)17-34(3)16-21-5-8-24(39-4)9-6-21/h5-10,13,19-20,26,36H,11-12,14-18H2,1-4H3,(H,33,37)/t19-,20-,26-/m0/s1	IUJLOVQYFFXLDN-DYLHXGEVSA-N	COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K05001008	BRD-K05001008-001-01-8	Broad Institute of MIT and Harvard	BRD-K05001008			COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C29H38F3N3O5/c1-19-15-35(20(2)18-36)28(38)14-22-13-23(33-27(37)11-12-29(30,31)32)7-10-25(22)40-26(19)17-34(3)16-21-5-8-24(39-4)9-6-21/h5-10,13,19-20,26,36H,11-12,14-18H2,1-4H3,(H,33,37)/t19-,20-,26-/m0/s1	IUJLOVQYFFXLDN-DYLHXGEVSA-N	565.276355946							108923
BRD-K13225050	LSM-20322		44495112	InChI=1S/C18H29N3O5S/c1-12-10-21(13(2)11-22)18(23)8-14-7-15(20-27(4,24)25)5-6-16(14)26-17(12)9-19-3/h5-7,12-13,17,19-20,22H,8-11H2,1-4H3/t12-,13+,17+/m1/s1	XOTYHNIEAMYTDW-IGCXYCKISA-N	CNC[C@@H]1Oc2ccc(NS(=O)(=O)C)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K13225050	BRD-K13225050-001-01-0	Broad Institute of MIT and Harvard	BRD-K13225050			CNC[C@@H]1Oc2ccc(NS(C)(=O)=O)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C18H29N3O5S/c1-12-10-21(13(2)11-22)18(23)8-14-7-15(20-27(4,24)25)5-6-16(14)26-17(12)9-19-3/h5-7,12-13,17,19-20,22H,8-11H2,1-4H3/t12-,13+,17+/m1/s1	XOTYHNIEAMYTDW-IGCXYCKISA-N	399.182791748							108924
BRD-K15833017	LSM-20323		44617698	InChI=1S/C31H41FN4O5/c1-20-17-36(21(2)19-37)29(38)16-23-15-26(33-30(39)22-7-5-4-6-8-22)13-14-27(23)41-28(20)18-35(3)31(40)34-25-11-9-24(32)10-12-25/h9-15,20-22,28,37H,4-8,16-19H2,1-3H3,(H,33,39)(H,34,40)/t20-,21+,28+/m0/s1	KWOBPQGHYDHVIO-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3ccc(NC(=O)C4CCCCC4)cc3CC1=O	BroadT	BRD-K15833017	BRD-K15833017-001-01-1	Broad Institute of MIT and Harvard	BRD-K15833017			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ccc(NC(=O)C3CCCCC3)cc2CC1=O	InChI=1S/C31H41FN4O5/c1-20-17-36(21(2)19-37)29(38)16-23-15-26(33-30(39)22-7-5-4-6-8-22)13-14-27(23)41-28(20)18-35(3)31(40)34-25-11-9-24(32)10-12-25/h9-15,20-22,28,37H,4-8,16-19H2,1-3H3,(H,33,39)(H,34,40)/t20-,21+,28+/m0/s1	KWOBPQGHYDHVIO-BALWLHIASA-N	568.306098652							108925
MLS000681433	LSM-43869	SID24806024, BRD-K18314863	1359423	InChI=1S/C20H20N4O3S/c1-11-9-15(10-18-19(27)23-20(28-18)22-14(4)26)12(2)24(11)17-7-5-16(6-8-17)21-13(3)25/h5-10H,1-4H3,(H,21,25)(H,22,23,26,27)/b18-10-	YCSINBDUZCISEJ-ZDLGFXPLSA-N	CC(=O)NC1=NC(=O)\C(=C\c2cc(C)n(c2C)c3ccc(NC(=O)C)cc3)\S1	BroadT	BRD-K18314863	BRD-K18314863-001-05-5	ChemBridge Corporation	5969954			CC(=O)NC1=NC(=O)\C(S1)=C\c1cc(C)n(c1C)-c1ccc(NC(C)=O)cc1	InChI=1S/C20H20N4O3S/c1-11-9-15(10-18-19(27)23-20(28-18)22-14(4)26)12(2)24(11)17-7-5-16(6-8-17)21-13(3)25/h5-10H,1-4H3,(H,21,25)(H,22,23,26,27)/b18-10-	YCSINBDUZCISEJ-ZDLGFXPLSA-N	396.12561123							
2-(1,3-Benzodioxol-5-ylmethyl)isoindole-1,3-dione	LSM-20325	SID24724341, SID4258155, BRD-K26349294	714424	InChI=1S/C16H11NO4/c18-15-11-3-1-2-4-12(11)16(19)17(15)8-10-5-6-13-14(7-10)21-9-20-13/h1-7H,8-9H2	IJOUNEKMVDGTBS-UHFFFAOYSA-N	O=C1N(Cc2ccc3OCOc3c2)C(=O)c4ccccc14	BroadT	BRD-K26349294	BRD-K26349294-001-06-8	ChemBridge Corporation	7895961			O=C1N(Cc2ccc3OCOc3c2)C(=O)c2ccccc12	InChI=1S/C16H11NO4/c18-15-11-3-1-2-4-12(11)16(19)17(15)8-10-5-6-13-14(7-10)21-9-20-13/h1-7H,8-9H2	IJOUNEKMVDGTBS-UHFFFAOYSA-N	281.068807842							108927
SMR000220627	LSM-43870	SID17513106, BRD-K17307631	5781274	InChI=1S/C25H17Cl2N3O4S/c1-15-4-3-11-30-23(15)29-24(34-18-7-10-22(27)16(2)12-18)21(25(30)31)13-20(14-28)35(32,33)19-8-5-17(26)6-9-19/h3-13H,1-2H3/b20-13+	JCJDJFGFPSSNLX-DEDYPNTBSA-N	CC1=CC=CN2C(=O)C(=C(Oc3ccc(Cl)c(C)c3)N=C12)\C=C(/C#N)\S(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K17307631	BRD-K17307631-001-06-9	InterBioScreen Ltd.	STOCK5S-15180			Cc1cc(Oc2nc3c(C)cccn3c(=O)c2\C=C(/C#N)S(=O)(=O)c2ccc(Cl)cc2)ccc1Cl	InChI=1S/C25H17Cl2N3O4S/c1-15-4-3-11-30-23(15)29-24(34-18-7-10-22(27)16(2)12-18)21(25(30)31)13-20(14-28)35(32,33)19-8-5-17(26)6-9-19/h3-13H,1-2H3/b20-13+	JCJDJFGFPSSNLX-DEDYPNTBSA-N	525.031682164							
MLS000556676	LSM-20327	SID17407931, BRD-K86378149	1442755	InChI=1S/C23H22N4O2S/c1-14-3-2-4-15-13-18-19(24)21(30-23(18)26-20(14)15)22(28)25-16-5-7-17(8-6-16)27-9-11-29-12-10-27/h2-8,13H,9-12,24H2,1H3,(H,25,28)	FCAYVRJFEQPSKT-UHFFFAOYSA-N	Cc1cccc2cc3c(N)c(sc3nc12)C(=O)Nc4ccc(cc4)N5CCOCC5	BroadT	BRD-K86378149	BRD-K86378149-001-06-1	Asinex Ltd.	ASN 05543943			Cc1cccc2cc3c(N)c(sc3nc12)C(=O)Nc1ccc(cc1)N1CCOCC1	InChI=1S/C23H22N4O2S/c1-14-3-2-4-15-13-18-19(24)21(30-23(18)26-20(14)15)22(28)25-16-5-7-17(8-6-16)27-9-11-29-12-10-27/h2-8,13H,9-12,24H2,1H3,(H,25,28)	FCAYVRJFEQPSKT-UHFFFAOYSA-N	418.146346674							108929
34176-52-8	LSM-15300	BRD-K53635551	98613	InChI=1S/C9H9N3S/c10-12-9-11-8(6-13-9)7-4-2-1-3-5-7/h1-6H,10H2,(H,11,12)	VTOUNUQLXMNNMQ-UHFFFAOYSA-N	NNc1nc(cs1)c2ccccc2	BroadT	BRD-K53635551	BRD-K53635551-003-08-6	Enamine Ltd.	T5319280		Cl	NNc1nc(cs1)-c1ccccc1.Cl	InChI=1S/C9H9N3S.ClH/c10-12-9-11-8(6-13-9)7-4-2-1-3-5-7;/h1-6H,10H2,(H,11,12);1H	HVFGXXFFKPARFN-UHFFFAOYSA-N	191.051718008							103947, 103947
SMR000047872	LSM-20328	SID865349, BRD-K98654959	666603	InChI=1S/C18H12FN5S/c1-10-15-16(14-3-2-8-25-14)13(9-20)17(21)22-18(15)24(23-10)12-6-4-11(19)5-7-12/h2-8H,1H3,(H2,21,22)	UBLCHLNCMIOPPV-UHFFFAOYSA-N	Cc1nn(c2ccc(F)cc2)c3nc(N)c(C#N)c(c4cccs4)c13	BroadT	BRD-K98654959	BRD-K98654959-001-05-2	InterBioScreen Ltd.	STOCK5S-41323			Cc1nn(-c2ccc(F)cc2)c2nc(N)c(C#N)c(-c3cccs3)c12	InChI=1S/C18H12FN5S/c1-10-15-16(14-3-2-8-25-14)13(9-20)17(21)22-18(15)24(23-10)12-6-4-11(19)5-7-12/h2-8H,1H3,(H2,21,22)	UBLCHLNCMIOPPV-UHFFFAOYSA-N	349.079744324							108930
MLS000532817	LSM-20329	SID14735987, BRD-K09051701	871615	InChI=1S/C12H13N3OS2/c1-3-17-12-15-14-11(18-12)13-10(16)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H,13,14,16)	FXBZGRAJYQNAFJ-UHFFFAOYSA-N	CCSc1nnc(NC(=O)c2ccc(C)cc2)s1	BroadT	BRD-K09051701	BRD-K09051701-001-05-0	ChemBridge Corporation	5549294			CCSc1nnc(NC(=O)c2ccc(C)cc2)s1	InChI=1S/C12H13N3OS2/c1-3-17-12-15-14-11(18-12)13-10(16)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H,13,14,16)	FXBZGRAJYQNAFJ-UHFFFAOYSA-N	279.050003446							108931
AC1NA1D2	LSM-20330	BRD-K17003505	4419658	InChI=1S/C18H16N2O3S2/c1-20(15-9-11-16(21)12-10-15)18(14-6-3-2-4-7-14)19-25(22,23)17-8-5-13-24-17/h2-13,21H,1H3	WUQOBLLHKQLYFX-UHFFFAOYSA-N	CN(C(=NS(=O)(=O)c1cccs1)c2ccccc2)c3ccc(O)cc3	BroadT	BRD-K17003505	BRD-K17003505-001-07-5	Enamine Ltd.	T0503-3494			CN(C(=NS(=O)(=O)c1cccs1)c1ccccc1)c1ccc(O)cc1	InChI=1S/C18H16N2O3S2/c1-20(15-9-11-16(21)12-10-15)18(14-6-3-2-4-7-14)19-25(22,23)17-8-5-13-24-17/h2-13,21H,1H3	WUQOBLLHKQLYFX-UHFFFAOYSA-N	372.060233772							108932
SMR000123526	LSM-20331	SID14722493, SID87334550, BRD-K76539182	3168071	InChI=1S/C20H20N4O5S2/c1-13-3-9-16(10-4-13)31(27,28)24-17-11-18(25)23-20(22-17)30-12-19(26)21-14-5-7-15(29-2)8-6-14/h3-11H,12H2,1-2H3,(H,21,26)(H2,22,23,24,25)	NUGRGXXRCSYGGA-UHFFFAOYSA-N	COc1ccc(NC(=O)CSc2nc(O)cc(NS(=O)(=O)c3ccc(C)cc3)n2)cc1	BroadT	BRD-K76539182	BRD-K76539182-001-05-0	Asinex Ltd.	ASN 02749404			COc1ccc(NC(=O)CSc2nc(O)cc(NS(=O)(=O)c3ccc(C)cc3)n2)cc1	InChI=1S/C20H20N4O5S2/c1-13-3-9-16(10-4-13)31(27,28)24-17-11-18(25)23-20(22-17)30-12-19(26)21-14-5-7-15(29-2)8-6-14/h3-11H,12H2,1-2H3,(H,21,26)(H2,22,23,24,25)	NUGRGXXRCSYGGA-UHFFFAOYSA-N	460.08751116							108933
MLS000674502	LSM-20332	SID24823378, BRD-K05946362	1509346	InChI=1S/C18H11N3O3S2/c22-17-14-16(21(18(25)26-14)11-4-2-1-3-5-11)19-15(20-17)10-6-7-12-13(8-10)24-9-23-12/h1-8H,9H2,(H,19,20,22)	OVLHHZKMWPBWGJ-UHFFFAOYSA-N	Oc1nc(nc2N(C(=S)Sc12)c3ccccc3)c4ccc5OCOc5c4	BroadT	BRD-K05946362	BRD-K05946362-001-05-5	ChemDiv Inc.	8016-7020			Oc1nc(nc2n(-c3ccccc3)c(=S)sc12)-c1ccc2OCOc2c1	InChI=1S/C18H11N3O3S2/c22-17-14-16(21(18(25)26-14)11-4-2-1-3-5-11)19-15(20-17)10-6-7-12-13(8-10)24-9-23-12/h1-8H,9H2,(H,19,20,22)	OVLHHZKMWPBWGJ-UHFFFAOYSA-N	381.024182622							108934
SMR000046601	LSM-20333	SID864243, BRD-K89845601	665490	InChI=1S/C19H18ClN3O2/c1-19(2,3)22-17(24)12-8-4-5-9-13(12)18-21-16(23-25-18)14-10-6-7-11-15(14)20/h4-11H,1-3H3,(H,22,24)	SRQSCSZJKDFDKA-UHFFFAOYSA-N	CC(C)(C)NC(=O)c1ccccc1c2onc(n2)c3ccccc3Cl	BroadT	BRD-K89845601	BRD-K89845601-001-05-9	InterBioScreen Ltd.	STOCK5S-08037			CC(C)(C)NC(=O)c1ccccc1-c1nc(no1)-c1ccccc1Cl	InChI=1S/C19H18ClN3O2/c1-19(2,3)22-17(24)12-8-4-5-9-13(12)18-21-16(23-25-18)14-10-6-7-11-15(14)20/h4-11H,1-3H3,(H,22,24)	SRQSCSZJKDFDKA-UHFFFAOYSA-N	355.108754556							108935
O-tolyl thiosemicarbazide	LSM-20334	SID24820218, BRD-K71379001	1490896	InChI=1S/C8H11N3S/c1-6-4-2-3-5-7(6)10-11-8(9)12/h2-5,10H,1H3,(H3,9,11,12)	YRABENKRWXQGMK-UHFFFAOYSA-N	Cc1ccccc1NN=C(N)S	BroadT	BRD-K71379001	BRD-K71379001-001-05-5	Key Organics Ltd.	1P-072			Cc1ccccc1NN=C(N)S	InChI=1S/C8H11N3S/c1-6-4-2-3-5-7(6)10-11-8(9)12/h2-5,10H,1H3,(H3,9,11,12)	YRABENKRWXQGMK-UHFFFAOYSA-N	181.067368072							108936
SMR000147520	LSM-20335	SID14734310, BRD-K16768849	1939777	InChI=1S/C20H20N2O5/c1-26-10-4-9-22-19(24)16-8-7-13(11-17(16)20(22)25)18(23)21-14-5-3-6-15(12-14)27-2/h3,5-8,11-12H,4,9-10H2,1-2H3,(H,21,23)	HHBVZZKJEUFGTL-UHFFFAOYSA-N	COCCCN1C(=O)c2ccc(cc2C1=O)C(=O)Nc3cccc(OC)c3	BroadT	BRD-K16768849	BRD-K16768849-001-05-3	InterBioScreen Ltd.	STOCK2S-87051			COCCCN1C(=O)c2ccc(cc2C1=O)C(=O)Nc1cccc(OC)c1	InChI=1S/C20H20N2O5/c1-26-10-4-9-22-19(24)16-8-7-13(11-17(16)20(22)25)18(23)21-14-5-3-6-15(12-14)27-2/h3,5-8,11-12H,4,9-10H2,1-2H3,(H,21,23)	HHBVZZKJEUFGTL-UHFFFAOYSA-N	368.13722176							108937
MLS000388987	LSM-20336	SID22408164, BRD-K16059342	2421864	InChI=1S/C21H19N3O3/c1-13-21(15-7-3-4-8-16(15)22-13)19(25)12-27-20(26)11-24-14(2)23-17-9-5-6-10-18(17)24/h3-10,22H,11-12H2,1-2H3	RAQXMEIYUZVXHR-UHFFFAOYSA-N	Cc1[nH]c2ccccc2c1C(=O)COC(=O)Cn3c(C)nc4ccccc34	BroadT	BRD-K16059342	BRD-K16059342-001-05-9	Enamine Ltd.	T0515-7450			Cc1[nH]c2ccccc2c1C(=O)COC(=O)Cn1c(C)nc2ccccc12	InChI=1S/C21H19N3O3/c1-13-21(15-7-3-4-8-16(15)22-13)19(25)12-27-20(26)11-24-14(2)23-17-9-5-6-10-18(17)24/h3-10,22H,11-12H2,1-2H3	RAQXMEIYUZVXHR-UHFFFAOYSA-N	361.142641498							108938
AC1OS6TB	LSM-20337	BRD-K68452563	7714717	InChI=1S/C24H25N3O4/c1-31-22-12-16(8-9-20(22)28)15-25-27-23(30)21(29)13-19-18-7-3-2-6-17(18)14-24(26-19)10-4-5-11-24/h2-3,6-9,12,15,28H,4-5,10-11,13-14H2,1H3,(H,27,30)	NIJFNPWQAUEKMT-UHFFFAOYSA-N	COc1cc(C=NNC(=O)C(=O)CC2=NC3(CCCC3)Cc4ccccc24)ccc1O	BroadT	BRD-K68452563	BRD-K68452563-001-05-5	InterBioScreen Ltd.	STOCK5S-01599			COc1cc(C=NNC(=O)C(=O)CC2=NC3(CCCC3)Cc3ccccc23)ccc1O	InChI=1S/C24H25N3O4/c1-31-22-12-16(8-9-20(22)28)15-25-27-23(30)21(29)13-19-18-7-3-2-6-17(18)14-24(26-19)10-4-5-11-24/h2-3,6-9,12,15,28H,4-5,10-11,13-14H2,1H3,(H,27,30)	NIJFNPWQAUEKMT-UHFFFAOYSA-N	419.18450631							
AC1M76OQ	LSM-20338	SID26669717, BRD-K87488056	2461904	InChI=1S/C20H22FN3O5S/c1-22-19(25)14-29-20(26)15-3-2-4-18(13-15)30(27,28)24-11-9-23(10-12-24)17-7-5-16(21)6-8-17/h2-8,13H,9-12,14H2,1H3,(H,22,25)	HBZVCEFRKZBHTJ-UHFFFAOYSA-N	CNC(=O)COC(=O)c1cccc(c1)S(=O)(=O)N2CCN(CC2)c3ccc(F)cc3	BroadT	BRD-K87488056	BRD-K87488056-001-05-0	Enamine Ltd.	T0518-6133			CNC(=O)COC(=O)c1cccc(c1)S(=O)(=O)N1CCN(CC1)c1ccc(F)cc1	InChI=1S/C20H22FN3O5S/c1-22-19(25)14-29-20(26)15-3-2-4-18(13-15)30(27,28)24-11-9-23(10-12-24)17-7-5-16(21)6-8-17/h2-8,13H,9-12,14H2,1H3,(H,22,25)	HBZVCEFRKZBHTJ-UHFFFAOYSA-N	435.126419724							108940
AC1M73F4	LSM-20339	BRD-K14439837	2434952	InChI=1S/C25H23F4N3O5S/c1-16-3-11-21(12-4-16)38(34,35)32(2)15-17-5-7-18(8-6-17)23(33)31-30-14-19-9-10-20(36-24(26)27)13-22(19)37-25(28)29/h3-14,24-25H,15H2,1-2H3,(H,31,33)	CCMGSJUWOVIJBX-UHFFFAOYSA-N	CN(Cc1ccc(cc1)C(=O)NN=Cc2ccc(OC(F)F)cc2OC(F)F)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K14439837	BRD-K14439837-001-05-7	Enamine Ltd.	T0517-5922			CN(Cc1ccc(cc1)C(=O)NN=Cc1ccc(OC(F)F)cc1OC(F)F)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C25H23F4N3O5S/c1-16-3-11-21(12-4-16)38(34,35)32(2)15-17-5-7-18(8-6-17)23(33)31-30-14-19-9-10-20(36-24(26)27)13-22(19)37-25(28)29/h3-14,24-25H,15H2,1-2H3,(H,31,33)	CCMGSJUWOVIJBX-UHFFFAOYSA-N	553.129454356							108941
MLS000047386	LSM-20340	SID4248549, BRD-K20915411	3242617	InChI=1S/C19H20ClN3O5S/c20-14-1-4-16(5-2-14)29(25,26)23-9-7-22(8-10-23)12-19(24)21-15-3-6-17-18(11-15)28-13-27-17/h1-6,11H,7-10,12-13H2,(H,21,24)	ITIBNIJXGYOKFS-UHFFFAOYSA-N	Clc1ccc(cc1)S(=O)(=O)N2CCN(CC(=O)Nc3ccc4OCOc4c3)CC2	BroadT	BRD-K20915411	BRD-K20915411-001-06-0	ChemDiv Inc.	K940-0696			Clc1ccc(cc1)S(=O)(=O)N1CCN(CC(=O)Nc2ccc3OCOc3c2)CC1	InChI=1S/C19H20ClN3O5S/c20-14-1-4-16(5-2-14)29(25,26)23-9-7-22(8-10-23)12-19(24)21-15-3-6-17-18(11-15)28-13-27-17/h1-6,11H,7-10,12-13H2,(H,21,24)	ITIBNIJXGYOKFS-UHFFFAOYSA-N	437.08121917							108942
MLS000548816	LSM-43871	SID17504270, BRD-K87965790	6407360	InChI=1S/C22H21N5O4S2/c1-15-3-5-16(6-4-15)7-13-20(28)24-22(32)23-17-8-10-18(11-9-17)33(29,30)27-19-12-14-21(31-2)26-25-19/h3-14H,1-2H3,(H,25,27)(H2,23,24,28,32)/b13-7+	NGBXGOIXRHQJAU-NTUHNPAUSA-N	COc1ccc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)\C=C\c3ccc(C)cc3)cc2)nn1	BroadT	BRD-K87965790	BRD-K87965790-001-05-8	Asinex Ltd.	BAS 00331771			COc1ccc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)\C=C\c3ccc(C)cc3)cc2)nn1	InChI=1S/C22H21N5O4S2/c1-15-3-5-16(6-4-15)7-13-20(28)24-22(32)23-17-8-10-18(11-9-17)33(29,30)27-19-12-14-21(31-2)26-25-19/h3-14H,1-2H3,(H,25,27)(H2,23,24,28,32)/b13-7+	NGBXGOIXRHQJAU-NTUHNPAUSA-N	483.103495582							
Ethyl 2-[(pentafluorobenzoyl)amino]benzoate	LSM-20342	SID4255321, BRD-K24531387	2165947	InChI=1S/C16H10F5NO3/c1-2-25-16(24)7-5-3-4-6-8(7)22-15(23)9-10(17)12(19)14(21)13(20)11(9)18/h3-6H,2H2,1H3,(H,22,23)	VKBMFPURSITPQN-UHFFFAOYSA-N	CCOC(=O)c1ccccc1NC(=O)c2c(F)c(F)c(F)c(F)c2F	BroadT	BRD-K24531387	BRD-K24531387-001-05-3	ChemBridge Corporation	7272922			CCOC(=O)c1ccccc1NC(=O)c1c(F)c(F)c(F)c(F)c1F	InChI=1S/C16H10F5NO3/c1-2-25-16(24)7-5-3-4-6-8(7)22-15(23)9-10(17)12(19)14(21)13(20)11(9)18/h3-6H,2H2,1H3,(H,22,23)	VKBMFPURSITPQN-UHFFFAOYSA-N	359.05808419							108944
SMR000043998	LSM-43872	SID862075, BRD-K49513975	5389681	InChI=1S/C23H30N4O3/c1-3-26(4-2)19-12-10-18(11-13-19)24-16-20-21(28)25-23(30)27(22(20)29)15-14-17-8-6-5-7-9-17/h8,10-13,16,24H,3-7,9,14-15H2,1-2H3,(H,25,28,30)/b20-16-	RFMOXJHOOXIYIA-SILNSSARSA-N	CCN(CC)c1ccc(N\C=C/2\C(=O)NC(=O)N(CCC3=CCCCC3)C2=O)cc1	BroadT	BRD-K49513975	BRD-K49513975-001-05-0	InterBioScreen Ltd.	STOCK4S-27804			CCN(CC)c1ccc(N\C=C2\C(=O)NC(=O)N(CCC3=CCCCC3)C2=O)cc1	InChI=1S/C23H30N4O3/c1-3-26(4-2)19-12-10-18(11-13-19)24-16-20-21(28)25-23(30)27(22(20)29)15-14-17-8-6-5-7-9-17/h8,10-13,16,24H,3-7,9,14-15H2,1-2H3,(H,25,28,30)/b20-16-	RFMOXJHOOXIYIA-SILNSSARSA-N	410.23179086							
AC1NRLBX	LSM-20344	SID22411142, BRD-K96526318	5293831	InChI=1S/C18H17ClN4OS/c1-2-20-18(25)22-21-16-14-5-3-4-6-15(14)23(17(16)24)11-12-7-9-13(19)10-8-12/h3-10,24H,2,11H2,1H3,(H,20,25)	SBUUMMQPJROXGF-UHFFFAOYSA-N	CCN=C(S)N=Nc1c(O)n(Cc2ccc(Cl)cc2)c3ccccc13	BroadT	BRD-K96526318	BRD-K96526318-001-05-0	Enamine Ltd.	T0512-0603			CCN=C(S)N=Nc1c(O)n(Cc2ccc(Cl)cc2)c2ccccc12	InChI=1S/C18H17ClN4OS/c1-2-20-18(25)22-21-16-14-5-3-4-6-15(14)23(17(16)24)11-12-7-9-13(19)10-8-12/h3-10,24H,2,11H2,1H3,(H,20,25)	SBUUMMQPJROXGF-UHFFFAOYSA-N	372.081159604							
N-(1,3-Benzodioxol-5-yl)-2-(2,4-dimethylphenoxy)acetamide	LSM-20345	SID24808398, BRD-K45077223	835842	InChI=1S/C17H17NO4/c1-11-3-5-14(12(2)7-11)20-9-17(19)18-13-4-6-15-16(8-13)22-10-21-15/h3-8H,9-10H2,1-2H3,(H,18,19)	FSGKMSJYQKDZPE-UHFFFAOYSA-N	Cc1ccc(OCC(=O)Nc2ccc3OCOc3c2)c(C)c1	BroadT	BRD-K45077223	BRD-K45077223-001-07-6	Asinex Ltd.	BAS 08979135			Cc1ccc(OCC(=O)Nc2ccc3OCOc3c2)c(C)c1	InChI=1S/C17H17NO4/c1-11-3-5-14(12(2)7-11)20-9-17(19)18-13-4-6-15-16(8-13)22-10-21-15/h3-8H,9-10H2,1-2H3,(H,18,19)	FSGKMSJYQKDZPE-UHFFFAOYSA-N	299.115758034							108947
AR-318/42873174	LSM-20346	SID49825790, BRD-K31724839	986562	InChI=1S/C21H18ClN3O5S/c1-11-13(3)24-30-21(11)25-31(27,28)16-7-5-15(6-8-16)23-20(26)19-12(2)17-10-14(22)4-9-18(17)29-19/h4-10,25H,1-3H3,(H,23,26)	YCEJFOSSJLJUAW-UHFFFAOYSA-N	Cc1noc(NS(=O)(=O)c2ccc(NC(=O)c3oc4ccc(Cl)cc4c3C)cc2)c1C	BroadT	BRD-K31724839	BRD-K31724839-001-08-3	Specs	AR-318/42873174			Cc1noc(NS(=O)(=O)c2ccc(NC(=O)c3oc4ccc(Cl)cc4c3C)cc2)c1C	InChI=1S/C21H18ClN3O5S/c1-11-13(3)24-30-21(11)25-31(27,28)16-7-5-15(6-8-16)23-20(26)19-12(2)17-10-14(22)4-9-18(17)29-19/h4-10,25H,1-3H3,(H,23,26)	YCEJFOSSJLJUAW-UHFFFAOYSA-N	459.065569106							108948
SMR000093866	LSM-20347	SID26670557, SID7964903, BRD-A90304422	5307293	InChI=1S/C25H19N5O2/c31-25-20-8-2-1-7-19(20)24(30(25)15-18-6-4-12-32-18)27-17-9-10-21-22(13-17)29-23(28-21)16-5-3-11-26-14-16/h1-14,24,27H,15H2,(H,28,29)	HDDKUZXMQTXGTK-UHFFFAOYSA-N	O=C1N(Cc2occc2)C(Nc3ccc4[nH]c(nc4c3)c5cccnc5)c6ccccc16	BroadT	BRD-A90304422	BRD-A90304422-001-05-3	ChemDiv Inc.	C429-0135			O=C1N(Cc2ccco2)C(Nc2ccc3[nH]c(nc3c2)-c2cccnc2)c2ccccc12	InChI=1S/C25H19N5O2/c31-25-20-8-2-1-7-19(20)24(30(25)15-18-6-4-12-32-18)27-17-9-10-21-22(13-17)29-23(28-21)16-5-3-11-26-14-16/h1-14,24,27H,15H2,(H,28,29)	HDDKUZXMQTXGTK-UHFFFAOYSA-N	421.153874898							108949
ZINC03337076	LSM-20348	SID22402953, BRD-K44464569	2453291	InChI=1S/C22H23F3N2O2/c23-22(24,25)18-5-2-6-19(14-18)26-9-11-27(12-10-26)21(28)15-29-20-8-7-16-3-1-4-17(16)13-20/h2,5-8,13-14H,1,3-4,9-12,15H2	XRUPRZLYHGUBSK-UHFFFAOYSA-N	FC(F)(F)c1cccc(c1)N2CCN(CC2)C(=O)COc3ccc4CCCc4c3	BroadT	BRD-K44464569	BRD-K44464569-001-06-1	Enamine Ltd.	T5310691			FC(F)(F)c1cccc(c1)N1CCN(CC1)C(=O)COc1ccc2CCCc2c1	InChI=1S/C22H23F3N2O2/c23-22(24,25)18-5-2-6-19(14-18)26-9-11-27(12-10-26)21(28)15-29-20-8-7-16-3-1-4-17(16)13-20/h2,5-8,13-14H,1,3-4,9-12,15H2	XRUPRZLYHGUBSK-UHFFFAOYSA-N	404.171162596							108950
AC1NM0HX	LSM-20349	BRD-A71055325	4969186	InChI=1S/C21H17N3O2/c25-21(16-9-6-12-22-14-16)24-23-18-13-20(15-7-2-1-3-8-15)26-19-11-5-4-10-17(18)19/h1-12,14,20H,13H2,(H,24,25)	QBHBTIYFDZZHPR-UHFFFAOYSA-N	O=C(NN=C1CC(Oc2ccccc12)c3ccccc3)c4cccnc4	BroadT	BRD-A71055325	BRD-A71055325-001-05-2	Enamine Ltd.	T5330901			O=C(NN=C1CC(Oc2ccccc12)c1ccccc1)c1cccnc1	InChI=1S/C21H17N3O2/c25-21(16-9-6-12-22-14-16)24-23-18-13-20(15-7-2-1-3-8-15)26-19-11-5-4-10-17(18)19/h1-12,14,20H,13H2,(H,24,25)	QBHBTIYFDZZHPR-UHFFFAOYSA-N	343.132076814							108951
N-(3-Methoxyphenyl)quinazolin-4-amine	LSM-15301	SID103904646, BRD-K35957358	712193	InChI=1S/C15H13N3O/c1-19-12-6-4-5-11(9-12)18-15-13-7-2-3-8-14(13)16-10-17-15/h2-10H,1H3,(H,16,17,18)	LCYPRFCDTJTQPG-UHFFFAOYSA-N	COc1cccc(Nc2ncnc3ccccc23)c1	BroadT	BRD-K35957358	BRD-K35957358-003-06-6	Asinex Ltd.	BAS 03309811		Cl	COc1cccc(Nc2ncnc3ccccc23)c1.Cl	InChI=1S/C15H13N3O.ClH/c1-19-12-6-4-5-11(9-12)18-15-13-7-2-3-8-14(13)16-10-17-15;/h2-10H,1H3,(H,16,17,18);1H	JKXWTCGOHAXNQI-UHFFFAOYSA-N	251.105862066							103948, 103948
MLS000730126	LSM-20350	SID24812945, BRD-K94462582	2135733	InChI=1S/C19H20N2O3S/c1-4-24-15-8-6-14(7-9-15)21-12-16(20-19(21)25)13-5-10-17(22-2)18(11-13)23-3/h5-12H,4H2,1-3H3,(H,20,25)	KNTRTQJGFCKVTM-UHFFFAOYSA-N	CCOc1ccc(cc1)n2cc(nc2S)c3ccc(OC)c(OC)c3	BroadT	BRD-K94462582	BRD-K94462582-001-05-9	ChemDiv Inc.	C200-1626			CCOc1ccc(cc1)-n1cc(nc1S)-c1ccc(OC)c(OC)c1	InChI=1S/C19H20N2O3S/c1-4-24-15-8-6-14(7-9-15)21-12-16(20-19(21)25)13-5-10-17(22-2)18(11-13)23-3/h5-12H,4H2,1-3H3,(H,20,25)	KNTRTQJGFCKVTM-UHFFFAOYSA-N	356.11946321							108952
ST50029278	LSM-20351	SID14726905, BRD-K41189457	973865	InChI=1S/C15H11N3O2/c19-15(17-12-7-4-8-16-10-12)13-9-14(20-18-13)11-5-2-1-3-6-11/h1-10H,(H,17,19)	BBOYKJFHRWUCPG-UHFFFAOYSA-N	O=C(Nc1cccnc1)c2cc(on2)c3ccccc3	BroadT	BRD-K41189457	BRD-K41189457-001-06-2	Asinex Ltd.	BAS 09529656			O=C(Nc1cccnc1)c1cc(on1)-c1ccccc1	InChI=1S/C15H11N3O2/c19-15(17-12-7-4-8-16-10-12)13-9-14(20-18-13)11-5-2-1-3-6-11/h1-10H,(H,17,19)	BBOYKJFHRWUCPG-UHFFFAOYSA-N	265.085126622							108953
ASN 08223841	LSM-20352	SID843447, BRD-K75287229	645743	InChI=1S/C19H19FN2O3S/c1-3-25-19(24)16-9-17-15(8-12(2)26-17)22(16)11-18(23)21-10-13-4-6-14(20)7-5-13/h4-9H,3,10-11H2,1-2H3,(H,21,23)	VFQIVKZUNCYPMP-UHFFFAOYSA-N	CCOC(=O)c1cc2sc(C)cc2n1CC(=O)NCc3ccc(F)cc3	BroadT	BRD-K75287229	BRD-K75287229-001-05-2	Asinex Ltd.	ASN 08223841			CCOC(=O)c1cc2sc(C)cc2n1CC(=O)NCc1ccc(F)cc1	InChI=1S/C19H19FN2O3S/c1-3-25-19(24)16-9-17-15(8-12(2)26-17)22(16)11-18(23)21-10-13-4-6-14(20)7-5-13/h4-9H,3,10-11H2,1-2H3,(H,21,23)	VFQIVKZUNCYPMP-UHFFFAOYSA-N	374.110041378							108954
ST058751	LSM-20353	SID24791127, BRD-A95386002	2973636	InChI=1S/C25H21N3O3/c1-17-22(24(30)28(26(17)2)19-13-7-4-8-14-19)27-23(29)20-15-9-10-16-21(20)25(27,31)18-11-5-3-6-12-18/h3-16,31H,1-2H3	KUSDAEKSKFAWIZ-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)N2C(=O)c3ccccc3C2(O)c4ccccc4)c5ccccc5	BroadT	BRD-A95386002	BRD-A95386002-001-05-3	ChemBridge Corporation	7956765			Cc1c(N2C(=O)c3ccccc3C2(O)c2ccccc2)c(=O)n(-c2ccccc2)n1C	InChI=1S/C25H21N3O3/c1-17-22(24(30)28(26(17)2)19-13-7-4-8-14-19)27-23(29)20-15-9-10-16-21(20)25(27,31)18-11-5-3-6-12-18/h3-16,31H,1-2H3	KUSDAEKSKFAWIZ-UHFFFAOYSA-N	411.158291562							108955
SMR000097612	LSM-20354	BRD-A41502700	5307699	InChI=1S/C21H14FNO4S/c22-16-7-3-1-5-14(16)12-23-17-11-13(21(25)26)9-10-19(17)28(27)18-8-4-2-6-15(18)20(23)24/h1-11H,12H2,(H,25,26)	PLLOPZCELZQFPM-UHFFFAOYSA-N	OC(=O)c1ccc2c(c1)N(Cc3ccccc3F)C(=O)c4ccccc4S2=O	BroadT	BRD-A41502700	BRD-A41502700-001-04-8	ChemDiv Inc.	K780-0892			OC(=O)c1ccc2c(c1)N(Cc1ccccc1F)C(=O)c1ccccc1S2=O	InChI=1S/C21H14FNO4S/c22-16-7-3-1-5-14(16)12-23-17-11-13(21(25)26)9-10-19(17)28(27)18-8-4-2-6-15(18)20(23)24/h1-11H,12H2,(H,25,26)	PLLOPZCELZQFPM-UHFFFAOYSA-N	395.062756828							108956
AC1OB3AP	LSM-20355	SID864929, BRD-A64031152	6839430	InChI=1S/C21H20ClN3O3/c1-28-11-5-10-25-20(13-6-4-7-14(22)12-13)17-18(23-24-19(17)21(25)27)15-8-2-3-9-16(15)26/h2-4,6-9,12,20,26H,5,10-11H2,1H3,(H,23,24)	LGWWGJBLIPVTTH-UHFFFAOYSA-N	COCCCN1C(c2cccc(Cl)c2)c3c(n[nH]c3C1=O)c4ccccc4O	BroadT	BRD-A64031152	BRD-A64031152-001-06-8	InterBioScreen Ltd.	STOCK5S-32532			COCCCN1C(c2c(n[nH]c2C1=O)-c1ccccc1O)c1cccc(Cl)c1	InChI=1S/C21H20ClN3O3/c1-28-11-5-10-25-20(13-6-4-7-14(22)12-13)17-18(23-24-19(17)21(25)27)15-8-2-3-9-16(15)26/h2-4,6-9,12,20,26H,5,10-11H2,1H3,(H,23,24)	LGWWGJBLIPVTTH-UHFFFAOYSA-N	397.11931924							
MLS000625021	LSM-20356	SID24796964, BRD-K32436612	977715	InChI=1S/C19H22N2O/c1-14-5-10-18(15(2)13-14)19(22)20-16-6-8-17(9-7-16)21-11-3-4-12-21/h5-10,13H,3-4,11-12H2,1-2H3,(H,20,22)	TVNBYCYZEQXVHN-UHFFFAOYSA-N	Cc1ccc(C(=O)Nc2ccc(cc2)N3CCCC3)c(C)c1	BroadT	BRD-K32436612	BRD-K32436612-001-05-2	ChemBridge Corporation	7762535			Cc1ccc(C(=O)Nc2ccc(cc2)N2CCCC2)c(C)c1	InChI=1S/C19H22N2O/c1-14-5-10-18(15(2)13-14)19(22)20-16-6-8-17(9-7-16)21-11-3-4-12-21/h5-10,13H,3-4,11-12H2,1-2H3,(H,20,22)	TVNBYCYZEQXVHN-UHFFFAOYSA-N	294.173213344							108958
SMR000109224	LSM-20357	SID7972799, BRD-K66535388	804731	InChI=1S/C13H17BrN2OS/c1-15-5-7-16(8-6-15)13(18)10-3-4-12(17-2)11(14)9-10/h3-4,9H,5-8H2,1-2H3	ZTDROPBNMRZUIS-UHFFFAOYSA-N	COc1ccc(cc1Br)C(=S)N2CCN(C)CC2	BroadT	BRD-K66535388	BRD-K66535388-001-05-2	ChemBridge Corporation	7074813			COc1ccc(cc1Br)C(=S)N1CCN(C)CC1	InChI=1S/C13H17BrN2OS/c1-15-5-7-16(8-6-15)13(18)10-3-4-12(17-2)11(14)9-10/h3-4,9H,5-8H2,1-2H3	ZTDROPBNMRZUIS-UHFFFAOYSA-N	328.024496474							108959
AC1O9A9H	LSM-20358	SID14734052, BRD-K07956450	6776045	InChI=1S/C22H23N3O3/c1-13(2)12-28-17-9-10-18(19(26)11-17)21-20(14(3)24-22(23)25-21)15-5-7-16(27-4)8-6-15/h5-11,26H,1,12H2,2-4H3,(H2,23,24,25)	CQMISAYYTJGGAA-UHFFFAOYSA-N	COc1ccc(cc1)c2c(C)nc(N)nc2c3ccc(OCC(=C)C)cc3O	BroadT	BRD-K07956450	BRD-K07956450-001-05-5	InterBioScreen Ltd.	STOCK5S-09532			COc1ccc(cc1)-c1c(C)nc(N)nc1-c1ccc(OCC(C)=C)cc1O	InChI=1S/C22H23N3O3/c1-13(2)12-28-17-9-10-18(19(26)11-17)21-20(14(3)24-22(23)25-21)15-5-7-16(27-4)8-6-15/h5-11,26H,1,12H2,2-4H3,(H2,23,24,25)	CQMISAYYTJGGAA-UHFFFAOYSA-N	377.173941626							
ZINC00476313	LSM-20359	SID49826833, BRD-K98289084	898403	InChI=1S/C19H18N2OS/c1-13-8-9-18(23-13)17-12-15(19(22)21-10-4-5-11-21)14-6-2-3-7-16(14)20-17/h2-3,6-9,12H,4-5,10-11H2,1H3	FOPCJACNGCGECH-UHFFFAOYSA-N	Cc1ccc(s1)c2cc(C(=O)N3CCCC3)c4ccccc4n2	BroadT	BRD-K98289084	BRD-K98289084-001-05-5	ChemBridge Corporation	7275328			Cc1ccc(s1)-c1cc(C(=O)N2CCCC2)c2ccccc2n1	InChI=1S/C19H18N2OS/c1-13-8-9-18(23-13)17-12-15(19(22)21-10-4-5-11-21)14-6-2-3-7-16(14)20-17/h2-3,6-9,12H,4-5,10-11H2,1H3	FOPCJACNGCGECH-UHFFFAOYSA-N	322.113983906							108961
MLS000777088	LSM-20360	SID26660900, BRD-K36446555	899390	InChI=1S/C20H17N5O/c1-12-8-9-15-17(10-12)23-20(24-18(15)26)25-19-21-13(2)11-16(22-19)14-6-4-3-5-7-14/h3-11H,1-2H3,(H2,21,22,23,24,25,26)	WCARDDDMQORATQ-UHFFFAOYSA-N	Cc1ccc2c(O)nc(Nc3nc(C)cc(n3)c4ccccc4)nc2c1	BroadT	BRD-K36446555	BRD-K36446555-001-06-4	InterBioScreen Ltd.	STOCK1S-76988			Cc1ccc2c(O)nc(Nc3nc(C)cc(n3)-c3ccccc3)nc2c1	InChI=1S/C20H17N5O/c1-12-8-9-15-17(10-12)23-20(24-18(15)26)25-19-21-13(2)11-16(22-19)14-6-4-3-5-7-14/h3-11H,1-2H3,(H2,21,22,23,24,25,26)	WCARDDDMQORATQ-UHFFFAOYSA-N	343.143310214							108962
BDBM46570	LSM-20361	BRD-A85140454	40623375	InChI=1S/C21H19N3O3S/c1-13-7-8-14(2)19(9-13)28-12-20(26)27-11-18(25)15(10-22)21-23-16-5-3-4-6-17(16)24-21/h3-9,15H,11-12H2,1-2H3,(H,23,24)	BGCNMYPMRYTVLQ-UHFFFAOYSA-N	Cc1ccc(C)c(SCC(=O)OCC(=O)C(C#N)c2nc3ccccc3[nH]2)c1	BroadT	BRD-A85140454	BRD-A85140454-001-04-2	Enamine Ltd.	T0515-3963			Cc1ccc(C)c(SCC(=O)OCC(=O)C(C#N)c2nc3ccccc3[nH]2)c1	InChI=1S/C21H19N3O3S/c1-13-7-8-14(2)19(9-13)28-12-20(26)27-11-18(25)15(10-22)21-23-16-5-3-4-6-17(16)24-21/h3-9,15H,11-12H2,1-2H3,(H,23,24)	BGCNMYPMRYTVLQ-UHFFFAOYSA-N	393.114712188							108963
SMR000120303	LSM-20362	SID14725910, BRD-K28964801	3228652	InChI=1S/C22H19ClF3N7/c23-18-4-2-1-3-15(18)13-33-21-19(29-30-33)20(27-14-28-21)32-11-9-31(10-12-32)17-7-5-16(6-8-17)22(24,25)26/h1-8,14H,9-13H2	VYHOVKDOHANTRU-UHFFFAOYSA-N	FC(F)(F)c1ccc(cc1)N2CCN(CC2)c3ncnc4c3nnn4Cc5ccccc5Cl	BroadT	BRD-K28964801	BRD-K28964801-001-05-0	Asinex Ltd.	ASN 07479437			FC(F)(F)c1ccc(cc1)N1CCN(CC1)c1ncnc2n(Cc3ccccc3Cl)nnc12	InChI=1S/C22H19ClF3N7/c23-18-4-2-1-3-15(18)13-33-21-19(29-30-33)20(27-14-28-21)32-11-9-31(10-12-32)17-7-5-16(6-8-17)22(24,25)26/h1-8,14H,9-13H2	VYHOVKDOHANTRU-UHFFFAOYSA-N	473.134255988							108964
MLS000417563	LSM-20363	SID24791859, BRD-A01886227	4884957	InChI=1S/C22H18N2O6S/c1-12(25)23-14-6-7-15-13(8-21(27)30-17(15)9-14)11-29-20(26)10-19-22(28)24-16-4-2-3-5-18(16)31-19/h2-9,19H,10-11H2,1H3,(H,23,25)(H,24,28)	PWUYDOZCVLPUQW-UHFFFAOYSA-N	CC(=O)Nc1ccc2C(=CC(=O)Oc2c1)COC(=O)CC3Sc4ccccc4NC3=O	BroadT	BRD-A01886227	BRD-A01886227-001-05-4	Enamine Ltd.	T5339727			CC(=O)Nc1ccc2c(COC(=O)CC3Sc4ccccc4NC3=O)cc(=O)oc2c1	InChI=1S/C22H18N2O6S/c1-12(25)23-14-6-7-15-13(8-21(27)30-17(15)9-14)11-29-20(26)10-19-22(28)24-16-4-2-3-5-18(16)31-19/h2-9,19H,10-11H2,1H3,(H,23,25)(H,24,28)	PWUYDOZCVLPUQW-UHFFFAOYSA-N	438.088557006							108965
F3225-8499	LSM-20364	SID24829979, BRD-K33972619	2338540	InChI=1S/C16H20N4O/c1-2-3-6-9-20-10-13(21)14(15(20)17)16-18-11-7-4-5-8-12(11)19-16/h4-5,7-8H,2-3,6,9-10,17H2,1H3,(H,18,19)	RTOVTWXWLCETFP-UHFFFAOYSA-N	CCCCCN1CC(=O)C(=C1N)c2nc3ccccc3[nH]2	BroadT	BRD-K33972619	BRD-K33972619-001-05-8	Enamine Ltd.	T0507-5242			CCCCCN1CC(=O)C(c2nc3ccccc3[nH]2)=C1N	InChI=1S/C16H20N4O/c1-2-3-6-9-20-10-13(21)14(15(20)17)16-18-11-7-4-5-8-12(11)19-16/h4-5,7-8H,2-3,6,9-10,17H2,1H3,(H,18,19)	RTOVTWXWLCETFP-UHFFFAOYSA-N	284.1637113							108966
MLS000084362	LSM-20365	SID866102, BRD-A78063780	667361	InChI=1S/C17H17NO5/c1-20-13-9-8-11(14(21-2)15(13)22-3)17-18-16(19)10-6-4-5-7-12(10)23-17/h4-9,17H,1-3H3,(H,18,19)	VWABRPAMTFPUBM-UHFFFAOYSA-N	COc1ccc(C2NC(=O)c3ccccc3O2)c(OC)c1OC	BroadT	BRD-A78063780	BRD-A78063780-001-11-5	InterBioScreen Ltd.	STOCK5S-56841			COc1ccc(C2NC(=O)c3ccccc3O2)c(OC)c1OC	InChI=1S/C17H17NO5/c1-20-13-9-8-11(14(21-2)15(13)22-3)17-18-16(19)10-6-4-5-7-12(10)23-17/h4-9,17H,1-3H3,(H,18,19)	VWABRPAMTFPUBM-UHFFFAOYSA-N	315.110672654							108967
STK164818	LSM-20366	SID24794685, BRD-K61671995	1952370	InChI=1S/C15H17N3S/c1-12-6-5-9-14(17-12)18-15(19)16-11-10-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3,(H2,16,17,18,19)	BNAIDYBVJVKVHN-UHFFFAOYSA-N	Cc1cccc(N=C(S)NCCc2ccccc2)n1	BroadT	BRD-K61671995	BRD-K61671995-001-05-5	ChemBridge Corporation	7871969			Cc1cccc(N=C(S)NCCc2ccccc2)n1	InChI=1S/C15H17N3S/c1-12-6-5-9-14(17-12)18-15(19)16-11-10-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3,(H2,16,17,18,19)	BNAIDYBVJVKVHN-UHFFFAOYSA-N	271.114318264							108968
CID 2316010	LSM-20367	BRD-K40965700	2316010	InChI=1S/C14H17N3O2/c1-14(2)7-11(6-12(18)8-14)16-17-13(19)10-4-3-5-15-9-10/h3-5,9H,6-8H2,1-2H3,(H,17,19)	VKOUQXZIVFGMFZ-UHFFFAOYSA-N	CC1(C)CC(=O)CC(=NNC(=O)c2cccnc2)C1	BroadT	BRD-K40965700	BRD-K40965700-001-04-6	InterBioScreen Ltd.	STOCK1S-94140			CC1(C)CC(=O)CC(C1)=NNC(=O)c1cccnc1	InChI=1S/C14H17N3O2/c1-14(2)7-11(6-12(18)8-14)16-17-13(19)10-4-3-5-15-9-10/h3-5,9H,6-8H2,1-2H3,(H,17,19)	VKOUQXZIVFGMFZ-UHFFFAOYSA-N	259.132076814							108969
ZINC04889240	LSM-4055	BRD-K91913968, BRD-K70891562, SID49817298	6746099	InChI=1S/C13H11Cl2N3O2/c14-9-3-4-12(11(15)6-9)20-8-13(19)18-17-7-10-2-1-5-16-10/h1-7,16H,8H2,(H,18,19)/b17-7+	ZMIAMADGCOUQBT-REZTVBANSA-N	Clc1ccc(OCC(=O)N\N=C\c2ccc[nH]2)c(Cl)c1	BroadT	BRD-K91913968	BRD-K91913968-001-06-6	InterBioScreen Ltd.	STOCK3S-04022			Clc1ccc(OCC(=O)NN=Cc2ccc[nH]2)c(Cl)c1	InChI=1S/C13H11Cl2N3O2/c14-9-3-4-12(11(15)6-9)20-8-13(19)18-17-7-10-2-1-5-16-10/h1-7,16H,8H2,(H,18,19)	ZMIAMADGCOUQBT-UHFFFAOYSA-N	311.022832042							
SMR000014280	LSM-20368	SID843939, BRD-K67644391	646245	InChI=1S/C15H20N2O5S/c1-22-15(19)12-3-5-13(6-4-12)16-14(18)11-7-9-17(10-8-11)23(2,20)21/h3-6,11H,7-10H2,1-2H3,(H,16,18)	NUQPBQGXQKBZAJ-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)C)cc1	BroadT	BRD-K67644391	BRD-K67644391-001-05-6	Asinex Ltd.	BAS 07220816			COC(=O)c1ccc(NC(=O)C2CCN(CC2)S(C)(=O)=O)cc1	InChI=1S/C15H20N2O5S/c1-22-15(19)12-3-5-13(6-4-12)16-14(18)11-7-9-17(10-8-11)23(2,20)21/h3-6,11H,7-10H2,1-2H3,(H,16,18)	NUQPBQGXQKBZAJ-UHFFFAOYSA-N	340.10929245							108970
SMR000219714	LSM-20369	SID22400629, BRD-K21145934	15944702	InChI=1S/C28H21N3O5/c1-16(32)36-21-12-9-18(10-13-21)26(33)25-24-23(22-7-4-14-29-31(22)25)27(34)30(28(24)35)20-11-8-17-5-2-3-6-19(17)15-20/h2-15,22-25H,1H3/t22-,23-,24-,25+/m0/s1	DZIALMJGWGUREU-OJJQZRKESA-N	CC(=O)Oc1ccc(cc1)C(=O)[C@H]2[C@@H]3[C@H]([C@@H]4C=CC=NN24)C(=O)N(C3=O)c5ccc6ccccc6c5	BroadT	BRD-K21145934	BRD-K21145934-001-05-3	InterBioScreen Ltd.	STOCK4S-25009			CC(=O)Oc1ccc(cc1)C(=O)[C@H]1[C@@H]2[C@H]([C@@H]3C=CC=NN13)C(=O)N(C2=O)c1ccc2ccccc2c1	InChI=1S/C28H21N3O5/c1-16(32)36-21-12-9-18(10-13-21)26(33)25-24-23(22-7-4-14-29-31(22)25)27(34)30(28(24)35)20-11-8-17-5-2-3-6-19(17)15-20/h2-15,22-25H,1H3/t22-,23-,24-,25+/m0/s1	DZIALMJGWGUREU-OJJQZRKESA-N	479.148120802							108971
AC1LD3OJ	LSM-15302	BRD-K99273316	660739	InChI=1S/C18H28N2O3/c1-4-8-20(13-14-5-6-14)9-7-18(21)19-15-10-16(22-2)12-17(11-15)23-3/h10-12,14H,4-9,13H2,1-3H3,(H,19,21)	LKCKBYJFXFKLGE-UHFFFAOYSA-N	CCCN(CCC(=O)Nc1cc(OC)cc(OC)c1)CC2CC2	BroadT	BRD-K99273316	BRD-K99273316-003-05-4	InterBioScreen Ltd.	STOCK3S-14281		Cl	CCCN(CCC(=O)Nc1cc(OC)cc(OC)c1)CC1CC1.Cl	InChI=1S/C18H28N2O3.ClH/c1-4-8-20(13-14-5-6-14)9-7-18(21)19-15-10-16(22-2)12-17(11-15)23-3;/h10-12,14H,4-9,13H2,1-3H3,(H,19,21);1H	QFYJTJYQWDRVEC-UHFFFAOYSA-N	320.209992776							103949, 103949
SMR000008813	LSM-20370	SID848414, BRD-K64260848	650856	InChI=1S/C14H15NO3S2/c1-4-18-14(17)11-8(2)9(3)20-13(11)15-12(16)10-6-5-7-19-10/h5-7H,4H2,1-3H3,(H,15,16)	PZOGIWMIURSOPF-UHFFFAOYSA-N	CCOC(=O)c1c(C)c(C)sc1NC(=O)c2cccs2	BroadT	BRD-K64260848	BRD-K64260848-001-05-3	Asinex Ltd.	BAS 00396332			CCOC(=O)c1c(NC(=O)c2cccs2)sc(C)c1C	InChI=1S/C14H15NO3S2/c1-4-18-14(17)11-8(2)9(3)20-13(11)15-12(16)10-6-5-7-19-10/h5-7H,4H2,1-3H3,(H,15,16)	PZOGIWMIURSOPF-UHFFFAOYSA-N	309.04933473							108972
K858	LSM-5122	K3644, SID17408290	2930014	InChI=1S/C13H15N3O2S/c1-9(17)14-12-15-16(10(2)18)13(3,19-12)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,14,15,17)	JEFVYQYZCAVNTP-UHFFFAOYSA-N	CC(=O)NC1=NN(C(=O)C)C(C)(S1)c2ccccc2	BroadT	BRD-A67748489	BRD-A67748489-001-05-0	Asinex Ltd.	BAS 06574958			CC(=O)NC1=NN(C(C)=O)C(C)(S1)c1ccccc1	InChI=1S/C13H15N3O2S/c1-9(17)14-12-15-16(10(2)18)13(3,19-12)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,14,15,17)	JEFVYQYZCAVNTP-UHFFFAOYSA-N	277.08849744							94425
MLS000031351	LSM-20371	SID851694, BRD-A00595016	654287	InChI=1S/C20H22N6O4S/c1-30-18-6-2-5-16(12-18)22-20(27)15-4-3-11-25(13-15)31(28,29)19-9-7-17(8-10-19)26-14-21-23-24-26/h2,5-10,12,14-15H,3-4,11,13H2,1H3,(H,22,27)	MXXDERMISKKKKI-UHFFFAOYSA-N	COc1cccc(NC(=O)C2CCCN(C2)S(=O)(=O)c3ccc(cc3)n4cnnn4)c1	BroadT	BRD-A00595016	BRD-A00595016-001-05-7	Asinex Ltd.	ASN 05983293			COc1cccc(NC(=O)C2CCCN(C2)S(=O)(=O)c2ccc(cc2)-n2cnnn2)c1	InChI=1S/C20H22N6O4S/c1-30-18-6-2-5-16(12-18)22-20(27)15-4-3-11-25(13-15)31(28,29)19-9-7-17(8-10-19)26-14-21-23-24-26/h2,5-10,12,14-15H,3-4,11,13H2,1H3,(H,22,27)	MXXDERMISKKKKI-UHFFFAOYSA-N	442.142323934							108973
MLS000533430	LSM-20372	SID14746105, BRD-K43050344	1398093	InChI=1S/C17H13N3O/c1-11-6-8-12(9-7-11)20-17-16-15(18-10-19-17)13-4-2-3-5-14(13)21-16/h2-10H,1H3,(H,18,19,20)	CAZVRVVZXFTMFC-UHFFFAOYSA-N	Cc1ccc(Nc2ncnc3c2oc4ccccc34)cc1	BroadT	BRD-K43050344	BRD-K43050344-001-05-3	ChemBridge Corporation	5931629			Cc1ccc(Nc2ncnc3c4ccccc4oc23)cc1	InChI=1S/C17H13N3O/c1-11-6-8-12(9-7-11)20-17-16-15(18-10-19-17)13-4-2-3-5-14(13)21-16/h2-10H,1H3,(H,18,19,20)	CAZVRVVZXFTMFC-UHFFFAOYSA-N	275.105862066							108974
MLS000118160	LSM-20373	SID7965251, BRD-K53216036	5307507	InChI=1S/C20H18N4O3/c1-26-14-8-7-12-9-15-19(21)23-24(20(15)22-16(12)11-14)18(25)10-13-5-3-4-6-17(13)27-2/h3-9,11H,10H2,1-2H3,(H2,21,23)	AFARTCQWZVTVJO-UHFFFAOYSA-N	COc1ccc2cc3c(N)nn(C(=O)Cc4ccccc4OC)c3nc2c1	BroadT	BRD-K53216036	BRD-K53216036-001-04-3	ChemDiv Inc.	C594-0052			COc1ccc2cc3c(N)nn(C(=O)Cc4ccccc4OC)c3nc2c1	InChI=1S/C20H18N4O3/c1-26-14-8-7-12-9-15-19(21)23-24(20(15)22-16(12)11-14)18(25)10-13-5-3-4-6-17(13)27-2/h3-9,11H,10H2,1-2H3,(H2,21,23)	AFARTCQWZVTVJO-UHFFFAOYSA-N	362.137890476							108975
MLS000697349	LSM-20374	SID17515267, BRD-K19092030	2150391	InChI=1S/C10H15N3OS/c1-6(2)13-4-3-8-7(5-13)9(14)12-10(15)11-8/h6H,3-5H2,1-2H3,(H2,11,12,14,15)	AXHMZPFIRXUQEJ-UHFFFAOYSA-N	CC(C)N1CCc2nc(S)nc(O)c2C1	BroadT	BRD-K19092030	BRD-K19092030-001-05-4	Life Chemicals Inc.	F1607-0383			CC(C)N1CCc2nc(S)nc(O)c2C1	InChI=1S/C10H15N3OS/c1-6(2)13-4-3-8-7(5-13)9(14)12-10(15)11-8/h6H,3-5H2,1-2H3,(H2,11,12,14,15)	AXHMZPFIRXUQEJ-UHFFFAOYSA-N	225.09358282							108976
ZINC03513106	LSM-6523	BRD-K02421873, SID56324288, EMF-SUMO1-12	2630179	InChI=1S/C14H9N3O6/c18-14(10-6-7-12(22-10)17(19)20)21-8-11-15-16-13(23-11)9-4-2-1-3-5-9/h1-7H,8H2	NENLILZNTFFZKS-UHFFFAOYSA-N	[O-][N+](=O)c1oc(cc1)C(=O)OCc2oc(nn2)c3ccccc3	BroadT	BRD-K02421873	BRD-K02421873-001-08-8	UkrOrgSynthesis Ltd.	PB-01930921			[O-][N+](=O)c1ccc(o1)C(=O)OCc1nnc(o1)-c1ccccc1	InChI=1S/C14H9N3O6/c18-14(10-6-7-12(22-10)17(19)20)21-8-11-15-16-13(23-11)9-4-2-1-3-5-9/h1-7H,8H2	NENLILZNTFFZKS-UHFFFAOYSA-N	315.049135038							95223
MLS001007654	LSM-20375	SID24841399, BRD-A50771566	4969203	InChI=1S/C21H25N3O4S/c1-3-28-21(27)17-12(2)18(19(22)26)29-20(17)24-16(25)11-23-15-10-6-8-13-7-4-5-9-14(13)15/h4-5,7,9,15,23H,3,6,8,10-11H2,1-2H3,(H2,22,26)(H,24,25)	UPSNFRPKQDUYOE-UHFFFAOYSA-N	CCOC(=O)c1c(C)c(sc1NC(=O)CNC2CCCc3ccccc23)C(=O)N	BroadT	BRD-A50771566	BRD-A50771566-001-06-5	Enamine Ltd.	T5331151			CCOC(=O)c1c(NC(=O)CNC2CCCc3ccccc23)sc(C(N)=O)c1C	InChI=1S/C21H25N3O4S/c1-3-28-21(27)17-12(2)18(19(22)26)29-20(17)24-16(25)11-23-15-10-6-8-13-7-4-5-9-14(13)15/h4-5,7,9,15,23H,3,6,8,10-11H2,1-2H3,(H2,22,26)(H,24,25)	UPSNFRPKQDUYOE-UHFFFAOYSA-N	415.156577							108977
MLS001100506	LSM-20376	SID49720311, BRD-A24064662	24791047	InChI=1S/C22H23FN4OS/c1-22(2)11-18(26-20(28)14-29-21-8-3-4-9-24-21)17-13-25-27(19(17)12-22)16-7-5-6-15(23)10-16/h3-10,13,18H,11-12,14H2,1-2H3,(H,26,28)	FOVXODPNFLKDCV-UHFFFAOYSA-N	CC1(C)CC(NC(=O)CSc2ccccn2)c3cnn(c3C1)c4cccc(F)c4	BroadT	BRD-A24064662	BRD-A24064662-001-06-1	ChemBridge Corporation	14537873			CC1(C)CC(NC(=O)CSc2ccccn2)c2cnn(c2C1)-c1cccc(F)c1	InChI=1S/C22H23FN4OS/c1-22(2)11-18(26-20(28)14-29-21-8-3-4-9-24-21)17-13-25-27(19(17)12-22)16-7-5-6-15(23)10-16/h3-10,13,18H,11-12,14H2,1-2H3,(H,26,28)	FOVXODPNFLKDCV-UHFFFAOYSA-N	410.157660286							108978
MAYBRIDGE1_001279	LSM-20377	BRD-K47115439	2798967	InChI=1S/C10H11N3O2S/c1-16-10(11)13-12-5-7-2-3-8-9(4-7)15-6-14-8/h2-5H,6H2,1H3,(H2,11,13)	IXDXBXANPHFKBD-UHFFFAOYSA-N	CSC(=N)NN=Cc1ccc2OCOc2c1	BroadT	BRD-K47115439	BRD-K47115439-001-06-4	Maybridge	BTB 05213			CSC(=N)NN=Cc1ccc2OCOc2c1	InChI=1S/C10H11N3O2S/c1-16-10(11)13-12-5-7-2-3-8-9(4-7)15-6-14-8/h2-5H,6H2,1H3,(H2,11,13)	IXDXBXANPHFKBD-UHFFFAOYSA-N	237.057197312							108979
AF-399/15539330	LSM-20378	SID3712190, BRD-K71537388	703931	InChI=1S/C13H12N2O5/c1-2-18-13(17)12-9(16)6-15(14-12)8-3-4-10-11(5-8)20-7-19-10/h3-6,16H,2,7H2,1H3	PQZHKRLGLHSPRV-UHFFFAOYSA-N	CCOC(=O)c1nn(cc1O)c2ccc3OCOc3c2	BroadT	BRD-K71537388	BRD-K71537388-001-06-9	Enamine Ltd.	T0508-2536			CCOC(=O)c1nn(cc1O)-c1ccc2OCOc2c1	InChI=1S/C13H12N2O5/c1-2-18-13(17)12-9(16)6-15(14-12)8-3-4-10-11(5-8)20-7-19-10/h3-6,16H,2,7H2,1H3	PQZHKRLGLHSPRV-UHFFFAOYSA-N	276.074621504							108980
ST50834055	LSM-20379	SID24793607, BRD-K23236192	2207993	InChI=1S/C12H23N3O2S/c1-12(2,3)17-11(16)15-14-10(18)13-9-7-5-4-6-8-9/h9H,4-8H2,1-3H3,(H,15,16)(H2,13,14,18)	ULNFIZHMSLIIMT-UHFFFAOYSA-N	CC(C)(C)OC(=O)NN=C(S)NC1CCCCC1	BroadT	BRD-K23236192	BRD-K23236192-001-05-5	ChemBridge Corporation	7802711			CC(C)(C)OC(=O)NN=C(S)NC1CCCCC1	InChI=1S/C12H23N3O2S/c1-12(2,3)17-11(16)15-14-10(18)13-9-7-5-4-6-8-9/h9H,4-8H2,1-3H3,(H,15,16)(H2,13,14,18)	ULNFIZHMSLIIMT-UHFFFAOYSA-N	273.151097696							108981
2,3-Dihydro-7-methyl-5-phenyl-1H-1,4-benzodiazepin-2-one	LSM-20380	SID47201221, BRD-K45230280	613848	InChI=1S/C16H14N2O/c1-11-7-8-14-13(9-11)16(17-10-15(19)18-14)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,18,19)	ZZLQGKUTUGIQNL-UHFFFAOYSA-N	Cc1ccc2NC(=O)CN=C(c3ccccc3)c2c1	BroadT	BRD-K45230280	BRD-K45230280-001-06-3	Asinex Ltd.	BAS 00462483			Cc1ccc2NC(=O)CN=C(c3ccccc3)c2c1	InChI=1S/C16H14N2O/c1-11-7-8-14-13(9-11)16(17-10-15(19)18-14)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,18,19)	ZZLQGKUTUGIQNL-UHFFFAOYSA-N	250.110613088							108982
T0512-9909	LSM-20381	SID22403011, BRD-A34261988	4107884	InChI=1S/C15H19BrN2OS/c1-10-6-2-5-9-13(10)17-15(20)18-14(19)11-7-3-4-8-12(11)16/h3-4,7-8,10,13H,2,5-6,9H2,1H3,(H2,17,18,19,20)	NKLNOFMQXXTAHD-UHFFFAOYSA-N	CC1CCCCC1NC(=S)NC(=O)c2ccccc2Br	BroadT	BRD-A34261988	BRD-A34261988-001-05-0	Enamine Ltd.	T0512-9909			CC1CCCCC1NC(=S)NC(=O)c1ccccc1Br	InChI=1S/C15H19BrN2OS/c1-10-6-2-5-9-13(10)17-15(20)18-14(19)11-7-3-4-8-12(11)16/h3-4,7-8,10,13H,2,5-6,9H2,1H3,(H2,17,18,19,20)	NKLNOFMQXXTAHD-UHFFFAOYSA-N	354.040146538							108983
AC1MUSHL	LSM-20382	BRD-K83996830	3671102	InChI=1S/C14H13N3OS2/c1-10(12-5-3-7-18-12)16-17-11(9-20-14(17)15-2)13-6-4-8-19-13/h3-9H,1-2H3	SYZLBZVIQPEBQM-UHFFFAOYSA-N	CN=C1SC=C(N1N=C(C)c2occc2)c3cccs3	BroadT	BRD-K83996830	BRD-K83996830-001-05-9	Enamine Ltd.	T0514-5405			CN=c1scc(-c2cccs2)n1N=C(C)c1ccco1	InChI=1S/C14H13N3OS2/c1-10(12-5-3-7-18-12)16-17-11(9-20-14(17)15-2)13-6-4-8-19-13/h3-9H,1-2H3	SYZLBZVIQPEBQM-UHFFFAOYSA-N	303.050003446							108984
7-Methoxy-4,5-dihydro-1H-benzo[g]indazole-3-carboxylic acid	LSM-20383	SID4248019, SID48410086, BRD-K67772763	3242152	InChI=1S/C13H12N2O3/c1-18-8-3-5-9-7(6-8)2-4-10-11(9)14-15-12(10)13(16)17/h3,5-6H,2,4H2,1H3,(H,14,15)(H,16,17)	QYTVVDFVUGEKHF-UHFFFAOYSA-N	COc1ccc2c(CCc3c([nH]nc23)C(=O)O)c1	BroadT	BRD-K67772763	BRD-K67772763-001-05-5	ChemDiv Inc.	R052-2284			COc1ccc2-c3n[nH]c(C(O)=O)c3CCc2c1	InChI=1S/C13H12N2O3/c1-18-8-3-5-9-7(6-8)2-4-10-11(9)14-15-12(10)13(16)17/h3,5-6H,2,4H2,1H3,(H,14,15)(H,16,17)	QYTVVDFVUGEKHF-UHFFFAOYSA-N	244.084792264							108985
SMR000002898	LSM-20384	SID852976, BRD-K73316987	655621	InChI=1S/C18H22N2O3S/c1-2-20-17(22)14-10-6-7-11-15(14)19-18(20)24-12-16(21)23-13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9,12H2,1H3	OEOSFQTZMPOJNI-UHFFFAOYSA-N	CCN1C(=O)c2ccccc2N=C1SCC(=O)OC3CCCCC3	BroadT	BRD-K73316987	BRD-K73316987-001-05-3	Asinex Ltd.	ASN 04049329			CCn1c(SCC(=O)OC2CCCCC2)nc2ccccc2c1=O	InChI=1S/C18H22N2O3S/c1-2-20-17(22)14-10-6-7-11-15(14)19-18(20)24-12-16(21)23-13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9,12H2,1H3	OEOSFQTZMPOJNI-UHFFFAOYSA-N	346.135113274							108986
MLS001122505	LSM-20385	SID49722311, SID85176626, BRD-A68186173	24791863	InChI=1S/C21H25N5O/c1-13-7-5-9-18(15(13)3)26-19-10-6-8-17(16(19)12-22-26)23-21(27)20-11-14(2)24-25(20)4/h5,7,9,11-12,17H,6,8,10H2,1-4H3,(H,23,27)	BYIUTBBPZFVDJL-UHFFFAOYSA-N	Cc1cc(C(=O)NC2CCCc3c2cnn3c4cccc(C)c4C)n(C)n1	BroadT	BRD-A68186173	BRD-A68186173-001-06-1	ChemBridge Corporation	75397583			Cc1cc(C(=O)NC2CCCc3c2cnn3-c2cccc(C)c2C)n(C)n1	InChI=1S/C21H25N5O/c1-13-7-5-9-18(15(13)3)26-19-10-6-8-17(16(19)12-22-26)23-21(27)20-11-14(2)24-25(20)4/h5,7,9,11-12,17H,6,8,10H2,1-4H3,(H,23,27)	BYIUTBBPZFVDJL-UHFFFAOYSA-N	363.20591047							108987
BAS 02987633	LSM-20386	SID17507470, BRD-K75801280	1146111	InChI=1S/C21H16F3N3O4S/c1-29-14-5-2-12(3-6-14)15-9-18(21(22,23)24)27-20(26-15)32-10-19(28)25-13-4-7-16-17(8-13)31-11-30-16/h2-9H,10-11H2,1H3,(H,25,28)	YRVBNLPHORBMTD-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(nc(SCC(=O)Nc3ccc4OCOc4c3)n2)C(F)(F)F	BroadT	BRD-K75801280	BRD-K75801280-001-05-6	Asinex Ltd.	BAS 02987633			COc1ccc(cc1)-c1cc(nc(SCC(=O)Nc2ccc3OCOc3c2)n1)C(F)(F)F	InChI=1S/C21H16F3N3O4S/c1-29-14-5-2-12(3-6-14)15-9-18(21(22,23)24)27-20(26-15)32-10-19(28)25-13-4-7-16-17(8-13)31-11-30-16/h2-9H,10-11H2,1H3,(H,25,28)	YRVBNLPHORBMTD-UHFFFAOYSA-N	463.081361312							108988
STK300472	LSM-20387	SID7967006, BRD-K56381606	5308564	InChI=1S/C21H22ClN3O3/c1-13(2)25(21(26)17-11-16(22)8-9-18(17)27-4)12-19-23-20(24-28-19)15-7-5-6-14(3)10-15/h5-11,13H,12H2,1-4H3	ABYXKGBQBLVBCB-UHFFFAOYSA-N	COc1ccc(Cl)cc1C(=O)N(Cc2onc(n2)c3cccc(C)c3)C(C)C	BroadT	BRD-K56381606	BRD-K56381606-001-04-2	ChemDiv Inc.	C599-0552			COc1ccc(Cl)cc1C(=O)N(Cc1nc(no1)-c1cccc(C)c1)C(C)C	InChI=1S/C21H22ClN3O3/c1-13(2)25(21(26)17-11-16(22)8-9-18(17)27-4)12-19-23-20(24-28-19)15-7-5-6-14(3)10-15/h5-11,13H,12H2,1-4H3	ABYXKGBQBLVBCB-UHFFFAOYSA-N	399.134969304							108989
ZINC03901813	LSM-20388	SID866011, BRD-K30898665	667272	InChI=1S/C18H16N2O4/c1-2-12-23-19-15-10-6-7-11-16(15)20(18(22)17(19)21)24-13-14-8-4-3-5-9-14/h2-11H,1,12-13H2	XGHLVBQDIWWVSQ-UHFFFAOYSA-N	C=CCON1C(=O)C(=O)N(OCc2ccccc2)c3ccccc13	BroadT	BRD-K30898665	BRD-K30898665-001-05-1	InterBioScreen Ltd.	STOCK5S-57332			C=CCOn1c2ccccc2n(OCc2ccccc2)c(=O)c1=O	InChI=1S/C18H16N2O4/c1-2-12-23-19-15-10-6-7-11-16(15)20(18(22)17(19)21)24-13-14-8-4-3-5-9-14/h2-11H,1,12-13H2	XGHLVBQDIWWVSQ-UHFFFAOYSA-N	324.111007012							108990
F2016-0680	LSM-20389	SID24814375, BRD-K22629349	16194326	InChI=1S/C22H31N3O2S/c1-16(2)25(17(3)4)21(26)14-24-13-20(18-9-5-6-10-19(18)24)28-15-22(27)23-11-7-8-12-23/h5-6,9-10,13,16-17H,7-8,11-12,14-15H2,1-4H3	QYTHMVSXTBGMGR-UHFFFAOYSA-N	CC(C)N(C(C)C)C(=O)Cn1cc(SCC(=O)N2CCCC2)c3ccccc13	BroadT	BRD-K22629349	BRD-K22629349-001-05-4	ChemDiv Inc.	E587-0680			CC(C)N(C(C)C)C(=O)Cn1cc(SCC(=O)N2CCCC2)c2ccccc12	InChI=1S/C22H31N3O2S/c1-16(2)25(17(3)4)21(26)14-24-13-20(18-9-5-6-10-19(18)24)28-15-22(27)23-11-7-8-12-23/h5-6,9-10,13,16-17H,7-8,11-12,14-15H2,1-4H3	QYTHMVSXTBGMGR-UHFFFAOYSA-N	401.213697952							108991
4-[(2-Naphthyloxy)methyl]-1,3-thiazol-2-amine	LSM-20390	SID4257664, BRD-K93883950	973573	InChI=1S/C14H12N2OS/c15-14-16-12(9-18-14)8-17-13-6-5-10-3-1-2-4-11(10)7-13/h1-7,9H,8H2,(H2,15,16)	RJXDEFFGHIEMFG-UHFFFAOYSA-N	Nc1nc(COc2ccc3ccccc3c2)cs1	BroadT	BRD-K93883950	BRD-K93883950-001-05-1	ChemBridge Corporation	7900498			Nc1nc(COc2ccc3ccccc3c2)cs1	InChI=1S/C14H12N2OS/c15-14-16-12(9-18-14)8-17-13-6-5-10-3-1-2-4-11(10)7-13/h1-7,9H,8H2,(H2,15,16)	RJXDEFFGHIEMFG-UHFFFAOYSA-N	256.067033714							108992
AC1N5TY1	LSM-20391	BRD-K97595393	4203758	InChI=1S/C19H13FN8O4/c20-12-3-1-2-10(6-12)8-22-24-19(29)15-16(11-4-5-13-14(7-11)31-9-30-13)28(27-23-15)18-17(21)25-32-26-18/h1-8H,9H2,(H2,21,25)(H,24,29)	JHLKANOOHHKIET-UHFFFAOYSA-N	Nc1nonc1n2nnc(C(=O)NN=Cc3cccc(F)c3)c2c4ccc5OCOc5c4	BroadT	BRD-K97595393	BRD-K97595393-001-06-0	InterBioScreen Ltd.	STOCK5S-03598			Nc1nonc1-n1nnc(C(=O)NN=Cc2cccc(F)c2)c1-c1ccc2OCOc2c1	InChI=1S/C19H13FN8O4/c20-12-3-1-2-10(6-12)8-22-24-19(29)15-16(11-4-5-13-14(7-11)31-9-30-13)28(27-23-15)18-17(21)25-32-26-18/h1-8H,9H2,(H2,21,25)(H,24,29)	JHLKANOOHHKIET-UHFFFAOYSA-N	436.104379176							108993
Ethyl 4-chloro-1-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate	LSM-20392	SID24819244, BRD-K51163654	3803060	InChI=1S/C10H10ClN3O2/c1-3-16-10(15)7-4-12-9-6(8(7)11)5-13-14(9)2/h4-5H,3H2,1-2H3	ILWRYGALHSASQT-UHFFFAOYSA-N	CCOC(=O)c1cnc2c(cnn2C)c1Cl	BroadT	BRD-K51163654	BRD-K51163654-001-05-7	Key Organics Ltd.	5T-0007			CCOC(=O)c1cnc2n(C)ncc2c1Cl	InChI=1S/C10H10ClN3O2/c1-3-16-10(15)7-4-12-9-6(8(7)11)5-13-14(9)2/h4-5H,3H2,1-2H3	ILWRYGALHSASQT-UHFFFAOYSA-N	239.0461543							108994
AC1LI1W1	LSM-20393	BRD-K80326605	847525	InChI=1S/C13H12N2O2/c1-10-4-6-11(7-5-10)9-14-15-13(16)12-3-2-8-17-12/h2-9H,1H3,(H,15,16)	BGRVSNDRQOMCQJ-UHFFFAOYSA-N	Cc1ccc(C=NNC(=O)c2occc2)cc1	BroadT	BRD-K80326605	BRD-K80326605-001-05-5	InterBioScreen Ltd.	STOCK3S-65041			Cc1ccc(C=NNC(=O)c2ccco2)cc1	InChI=1S/C13H12N2O2/c1-10-4-6-11(7-5-10)9-14-15-13(16)12-3-2-8-17-12/h2-9H,1H3,(H,15,16)	BGRVSNDRQOMCQJ-UHFFFAOYSA-N	228.089877644							108995
2-Methoxy-n-(2-methylsulfanylphenyl)benzamide	LSM-20394	SID4263414, BRD-K11532823	307235	InChI=1S/C15H15NO2S/c1-18-13-9-5-3-7-11(13)15(17)16-12-8-4-6-10-14(12)19-2/h3-10H,1-2H3,(H,16,17)	BRQVDITYGYFMBF-UHFFFAOYSA-N	COc1ccccc1C(=O)Nc2ccccc2SC	BroadT	BRD-K11532823	BRD-K11532823-001-05-8	ChemBridge Corporation	7843533			COc1ccccc1C(=O)Nc1ccccc1SC	InChI=1S/C15H15NO2S/c1-18-13-9-5-3-7-11(13)15(17)16-12-8-4-6-10-14(12)19-2/h3-10H,1-2H3,(H,16,17)	BRQVDITYGYFMBF-UHFFFAOYSA-N	273.08234942							108996
MLS000674936	LSM-20395	SID24795936, BRD-K71993173	4316874	InChI=1S/C19H21N3O2/c23-18(21-16-6-2-1-3-7-16)14-8-10-17(11-9-14)22-19(24)15-5-4-12-20-13-15/h4-5,8-13,16H,1-3,6-7H2,(H,21,23)(H,22,24)	QOTLGSCXPSDHHK-UHFFFAOYSA-N	O=C(NC1CCCCC1)c2ccc(NC(=O)c3cccnc3)cc2	BroadT	BRD-K71993173	BRD-K71993173-001-12-1	ChemBridge Corporation	7359902			O=C(NC1CCCCC1)c1ccc(NC(=O)c2cccnc2)cc1	InChI=1S/C19H21N3O2/c23-18(21-16-6-2-1-3-7-16)14-8-10-17(11-9-14)22-19(24)15-5-4-12-20-13-15/h4-5,8-13,16H,1-3,6-7H2,(H,21,23)(H,22,24)	QOTLGSCXPSDHHK-UHFFFAOYSA-N	323.163376942							108997
AC1LOEBV	LSM-20396	BRD-K56342086	1219251	InChI=1S/C12H8BrN3O3S/c13-11-5-4-10(20-11)7-14-15-12(17)8-2-1-3-9(6-8)16(18)19/h1-7H,(H,15,17)	NPMWGRLXMPLNMQ-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C(=O)NN=Cc2ccc(Br)s2	BroadT	BRD-K56342086	BRD-K56342086-001-05-0	Specs	AK-968/11367421			[O-][N+](=O)c1cccc(c1)C(=O)NN=Cc1ccc(Br)s1	InChI=1S/C12H8BrN3O3S/c13-11-5-4-10(20-11)7-14-15-12(17)8-2-1-3-9(6-8)16(18)19/h1-7H,(H,15,17)	NPMWGRLXMPLNMQ-UHFFFAOYSA-N	352.946974436							108998
CHEMBL1370773	LSM-20397	BAS 03334733, BRD-K68025464	745587	InChI=1S/C18H22N2O2/c21-17-8-3-1-6-15(17)12-19-10-5-11-20(14-19)13-16-7-2-4-9-18(16)22/h1-4,6-9,21-22H,5,10-14H2	DTQFEZKWSNPMLU-UHFFFAOYSA-N	Oc1ccccc1CN2CCCN(Cc3ccccc3O)C2	BroadT	BRD-K68025464	BRD-K68025464-001-06-7	ChemBridge Corporation	6753190			Oc1ccccc1CN1CCCN(Cc2ccccc2O)C1	InChI=1S/C18H22N2O2/c21-17-8-3-1-6-15(17)12-19-10-5-11-20(14-19)13-16-7-2-4-9-18(16)22/h1-4,6-9,21-22H,5,10-14H2	DTQFEZKWSNPMLU-UHFFFAOYSA-N	298.168127964							108999
TCMDC-124557	LSM-20398	BRD-K51669773	617988	InChI=1S/C18H24N6O/c1-11-8-9-15-14(10-11)12(2)20-17(22-15)23-16(19)24-18(25)21-13-6-4-3-5-7-13/h8-10,13H,3-7H2,1-2H3,(H4,19,20,21,22,23,24,25)	IJFNMWRASZLSEN-UHFFFAOYSA-N	Cc1ccc2nc(N=C(N)NC(=O)NC3CCCCC3)nc(C)c2c1	BroadT	BRD-K51669773	BRD-K51669773-001-06-7	InterBioScreen Ltd.	STOCK1S-79316			Cc1ccc2nc(N=C(N)NC(=O)NC3CCCCC3)nc(C)c2c1	InChI=1S/C18H24N6O/c1-11-8-9-15-14(10-11)12(2)20-17(22-15)23-16(19)24-18(25)21-13-6-4-3-5-7-13/h8-10,13H,3-7H2,1-2H3,(H4,19,20,21,22,23,24,25)	IJFNMWRASZLSEN-UHFFFAOYSA-N	340.201159448							109000
SMR000017176	LSM-20399	SID7970977, BRD-K27874359	4155588	InChI=1S/C18H20N2O3S/c1-13-10-15-11-14(4-9-18(15)20(13)2)12-19-24(21,22)17-7-5-16(23-3)6-8-17/h4-11,19H,12H2,1-3H3	CNISVKFXGVWDNN-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)NCc2ccc3c(c2)cc(C)n3C	BroadT	BRD-K27874359	BRD-K27874359-001-04-1	Life Chemicals Inc.	F0651-0396			COc1ccc(cc1)S(=O)(=O)NCc1ccc2n(C)c(C)cc2c1	InChI=1S/C18H20N2O3S/c1-13-10-15-11-14(4-9-18(15)20(13)2)12-19-24(21,22)17-7-5-16(23-3)6-8-17/h4-11,19H,12H2,1-3H3	CNISVKFXGVWDNN-UHFFFAOYSA-N	344.11946321							109001
MLS000118128	LSM-20400	SID7968807, BRD-K68749322	5309613	InChI=1S/C23H32N4O2/c1-5-7-14-27(6-2)15-10-13-24-22(28)20-16-18-21(25(20)3)17-11-8-9-12-19(17)26(4)23(18)29/h8-9,11-12,16H,5-7,10,13-15H2,1-4H3,(H,24,28)	LZWIHINQWHMUFB-UHFFFAOYSA-N	CCCCN(CC)CCCNC(=O)c1cc2C(=O)N(C)c3ccccc3c2n1C	BroadT	BRD-K68749322	BRD-K68749322-001-04-9	ChemDiv Inc.	C593-0557			CCCCN(CC)CCCNC(=O)c1cc2c(n1C)c1ccccc1n(C)c2=O	InChI=1S/C23H32N4O2/c1-5-7-14-27(6-2)15-10-13-24-22(28)20-16-18-21(25(20)3)17-11-8-9-12-19(17)26(4)23(18)29/h8-9,11-12,16H,5-7,10,13-15H2,1-4H3,(H,24,28)	LZWIHINQWHMUFB-UHFFFAOYSA-N	396.252526304							109002
SMR000147588	LSM-20401	SID14734339, BRD-K22275564	1974623	InChI=1S/C21H17N3O2S/c22-18-17-16(15-10-5-11-26-15)13-8-4-9-14(13)24-21(17)27-19(18)20(25)23-12-6-2-1-3-7-12/h1-3,5-7,10-11H,4,8-9,22H2,(H,23,25)	NPSHXDKPAMHITL-UHFFFAOYSA-N	Nc1c(sc2nc3CCCc3c(c4occc4)c12)C(=O)Nc5ccccc5	BroadT	BRD-K22275564	BRD-K22275564-001-06-2	InterBioScreen Ltd.	STOCK3S-30175			Nc1c(sc2nc3CCCc3c(-c3ccco3)c12)C(=O)Nc1ccccc1	InChI=1S/C21H17N3O2S/c22-18-17-16(15-10-5-11-26-15)13-8-4-9-14(13)24-21(17)27-19(18)20(25)23-12-6-2-1-3-7-12/h1-3,5-7,10-11H,4,8-9,22H2,(H,23,25)	NPSHXDKPAMHITL-UHFFFAOYSA-N	375.104147504							109003
T0512-2142	LSM-20402	SID24836051, BRD-K66492511	2428192	InChI=1S/C16H18N2O6S/c1-18(2)25(21,22)14-7-5-12(6-8-14)16(20)24-11-15(19)17-10-13-4-3-9-23-13/h3-9H,10-11H2,1-2H3,(H,17,19)	JAMKKHBARFOEDV-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(cc1)C(=O)OCC(=O)NCc2occc2	BroadT	BRD-K66492511	BRD-K66492511-001-05-6	Enamine Ltd.	T0512-2142			CN(C)S(=O)(=O)c1ccc(cc1)C(=O)OCC(=O)NCc1ccco1	InChI=1S/C16H18N2O6S/c1-18(2)25(21,22)14-7-5-12(6-8-14)16(20)24-11-15(19)17-10-13-4-3-9-23-13/h3-9H,10-11H2,1-2H3,(H,17,19)	JAMKKHBARFOEDV-UHFFFAOYSA-N	366.088557006							109004
SMR000151900	LSM-20403	SID14747219, SID89850398, BRD-K25407876	2352949	InChI=1S/C21H23N5O4S3/c1-15-2-4-17(5-3-15)23-20-24-25-21(32-20)31-14-19(27)22-16-6-8-18(9-7-16)33(28,29)26-10-12-30-13-11-26/h2-9H,10-14H2,1H3,(H,22,27)(H,23,24)	FXWTTWSCXCWGPB-UHFFFAOYSA-N	Cc1ccc(Nc2nnc(SCC(=O)Nc3ccc(cc3)S(=O)(=O)N4CCOCC4)s2)cc1	BroadT	BRD-K25407876	BRD-K25407876-001-05-3	Enamine Ltd.	T0508-6755			Cc1ccc(Nc2nnc(SCC(=O)Nc3ccc(cc3)S(=O)(=O)N3CCOCC3)s2)cc1	InChI=1S/C21H23N5O4S3/c1-15-2-4-17(5-3-15)23-20-24-25-21(32-20)31-14-19(27)22-16-6-8-18(9-7-16)33(28,29)26-10-12-30-13-11-26/h2-9H,10-14H2,1H3,(H,22,27)(H,23,24)	FXWTTWSCXCWGPB-UHFFFAOYSA-N	505.091216336							109005
SMR000029855	LSM-20404	SID24838670, SID4250151, BRD-K14593914	3244004	InChI=1S/C25H28N6O3S/c1-16-5-8-19(9-6-16)15-31-24-22(28-29-31)25(32)27-23(26-24)20-10-12-30(13-11-20)35(33,34)21-14-17(2)4-7-18(21)3/h4-9,14,20H,10-13,15H2,1-3H3,(H,26,27,32)	RPUZVOGBSPSARV-UHFFFAOYSA-N	Cc1ccc(Cn2nnc3c(O)nc(nc23)C4CCN(CC4)S(=O)(=O)c5cc(C)ccc5C)cc1	BroadT	BRD-K14593914	BRD-K14593914-001-06-5	ChemDiv Inc.	D023-0048			Cc1ccc(Cn2nnc3c(O)nc(nc23)C2CCN(CC2)S(=O)(=O)c2cc(C)ccc2C)cc1	InChI=1S/C25H28N6O3S/c1-16-5-8-19(9-6-16)15-31-24-22(28-29-31)25(32)27-23(26-24)20-10-12-30(13-11-20)35(33,34)21-14-17(2)4-7-18(21)3/h4-9,14,20H,10-13,15H2,1-3H3,(H,26,27,32)	RPUZVOGBSPSARV-UHFFFAOYSA-N	492.194359506							
AC1MFFCW	LSM-20405	SID14739077, BRD-K54937281	2870856	InChI=1S/C14H12ClN3O2/c15-11-6-4-10(5-7-11)9-13(19)20-18-14(16)12-3-1-2-8-17-12/h1-8H,9H2,(H2,16,18)	CBQHRZBYQRVNES-UHFFFAOYSA-N	Clc1ccc(CC(=O)ONC(=N)c2ccccn2)cc1	BroadT	BRD-K54937281	BRD-K54937281-001-06-0	ChemBridge Corporation	5813556			Clc1ccc(cc1)CC(=O)ONC(=N)c1ccccn1	InChI=1S/C14H12ClN3O2/c15-11-6-4-10(5-7-11)9-13(19)20-18-14(16)12-3-1-2-8-17-12/h1-8H,9H2,(H2,16,18)	CBQHRZBYQRVNES-UHFFFAOYSA-N	289.061804364							109007
4-{4-[(3-Bromophenyl)sulfonyl]piperazino}-7-chloroquinoline	LSM-20406	SID50085542, BRD-K80481344	2823722	InChI=1S/C19H17BrClN3O2S/c20-14-2-1-3-16(12-14)27(25,26)24-10-8-23(9-11-24)19-6-7-22-18-13-15(21)4-5-17(18)19/h1-7,12-13H,8-11H2	PLXIPEBXLVKFAJ-UHFFFAOYSA-N	Clc1ccc2c(ccnc2c1)N3CCN(CC3)S(=O)(=O)c4cccc(Br)c4	BroadT	BRD-K80481344	BRD-K80481344-001-05-4	Maybridge	KM 11099			Clc1ccc2c(ccnc2c1)N1CCN(CC1)S(=O)(=O)c1cccc(Br)c1	InChI=1S/C19H17BrClN3O2S/c20-14-2-1-3-16(12-14)27(25,26)24-10-8-23(9-11-24)19-6-7-22-18-13-15(21)4-5-17(18)19/h1-7,12-13H,8-11H2	PLXIPEBXLVKFAJ-UHFFFAOYSA-N	464.991337814							109008
N-(5-Cyclopropyl-1,3,4-thiadiazol-2-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidine-3-carboxamide	LSM-20407	SID22407723, BRD-A11225902	3392370	InChI=1S/C18H18N4O4S/c23-15-7-11(16(24)19-18-21-20-17(27-18)10-1-2-10)9-22(15)12-3-4-13-14(8-12)26-6-5-25-13/h3-4,8,10-11H,1-2,5-7,9H2,(H,19,21,24)	SQDCKOMKGRKKFQ-UHFFFAOYSA-N	O=C(Nc1nnc(s1)C2CC2)C3CN(C(=O)C3)c4ccc5OCCOc5c4	BroadT	BRD-A11225902	BRD-A11225902-001-05-5	Enamine Ltd.	T5245981			O=C(Nc1nnc(s1)C1CC1)C1CN(C(=O)C1)c1ccc2OCCOc2c1	InChI=1S/C18H18N4O4S/c23-15-7-11(16(24)19-18-21-20-17(27-18)10-1-2-10)9-22(15)12-3-4-13-14(8-12)26-6-5-25-13/h3-4,8,10-11H,1-2,5-7,9H2,(H,19,21,24)	SQDCKOMKGRKKFQ-UHFFFAOYSA-N	386.104875786							109009
MLS000582629	LSM-20408	SID17413449, BRD-K73220266	2969164	InChI=1S/C20H24N4O3/c1-14-7-6-10-19(21-14)22-20(25)15-11-12-17(18(13-15)24(26)27)23(2)16-8-4-3-5-9-16/h6-7,10-13,16H,3-5,8-9H2,1-2H3,(H,21,22,25)	RHRQLRGZUIGXLQ-UHFFFAOYSA-N	CN(C1CCCCC1)c2ccc(cc2[N+](=O)[O-])C(=O)Nc3cccc(C)n3	BroadT	BRD-K73220266	BRD-K73220266-001-05-9	ChemBridge Corporation	7938476			CN(C1CCCCC1)c1ccc(cc1[N+]([O-])=O)C(=O)Nc1cccc(C)n1	InChI=1S/C20H24N4O3/c1-14-7-6-10-19(21-14)22-20(25)15-11-12-17(18(13-15)24(26)27)23(2)16-8-4-3-5-9-16/h6-7,10-13,16H,3-5,8-9H2,1-2H3,(H,21,22,25)	RHRQLRGZUIGXLQ-UHFFFAOYSA-N	368.184840668							109010
ZINC04192434	LSM-20409	SID17431868, BRD-K16528326	2894729	InChI=1S/C17H16F3N3O4S/c18-17(19,20)28(26,27)14-6-7-15(16(12-14)23(24)25)22-10-8-21(9-11-22)13-4-2-1-3-5-13/h1-7,12H,8-11H2	QTEQGCVJXJVIAE-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1N2CCN(CC2)c3ccccc3)S(=O)(=O)C(F)(F)F	BroadT	BRD-K16528326	BRD-K16528326-001-05-3	ChemBridge Corporation	6368441			[O-][N+](=O)c1cc(ccc1N1CCN(CC1)c1ccccc1)S(=O)(=O)C(F)(F)F	InChI=1S/C17H16F3N3O4S/c18-17(19,20)28(26,27)14-6-7-15(16(12-14)23(24)25)22-10-8-21(9-11-22)13-4-2-1-3-5-13/h1-7,12H,8-11H2	QTEQGCVJXJVIAE-UHFFFAOYSA-N	415.081361312							109011
STK593016	LSM-20410	SID865562, BRD-K19406336	666821	InChI=1S/C23H27N7O2/c1-16-3-2-4-18(11-16)25-23-27-21(26-22(24)28-23)14-30-9-7-29(8-10-30)13-17-5-6-19-20(12-17)32-15-31-19/h2-6,11-12H,7-10,13-15H2,1H3,(H3,24,25,26,27,28)	XJSZPZODEYGCDW-UHFFFAOYSA-N	Cc1cccc(Nc2nc(N)nc(CN3CCN(Cc4ccc5OCOc5c4)CC3)n2)c1	BroadT	BRD-K19406336	BRD-K19406336-001-05-7	InterBioScreen Ltd.	STOCK5S-46896			Cc1cccc(Nc2nc(N)nc(CN3CCN(Cc4ccc5OCOc5c4)CC3)n2)c1	InChI=1S/C23H27N7O2/c1-16-3-2-4-18(11-16)25-23-27-21(26-22(24)28-23)14-30-9-7-29(8-10-30)13-17-5-6-19-20(12-17)32-15-31-19/h2-6,11-12H,7-10,13-15H2,1H3,(H3,24,25,26,27,28)	XJSZPZODEYGCDW-UHFFFAOYSA-N	433.222623174							109012
MLS000068525	LSM-20411	SID853304, BRD-A81781867	655956	InChI=1S/C22H28N6OS/c1-29-19-10-5-4-9-18(19)26-12-14-27(15-13-26)21(20-11-6-16-30-20)22-23-24-25-28(22)17-7-2-3-8-17/h4-6,9-11,16-17,21H,2-3,7-8,12-15H2,1H3	PBWHJOMTCNWSLB-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)C(c3cccs3)c4nnnn4C5CCCC5	BroadT	BRD-A81781867	BRD-A81781867-001-05-5	Asinex Ltd.	ASN 05081310			COc1ccccc1N1CCN(CC1)C(c1cccs1)c1nnnn1C1CCCC1	InChI=1S/C22H28N6OS/c1-29-19-10-5-4-9-18(19)26-12-14-27(15-13-26)21(20-11-6-16-30-20)22-23-24-25-28(22)17-7-2-3-8-17/h4-6,9-11,16-17,21H,2-3,7-8,12-15H2,1H3	PBWHJOMTCNWSLB-UHFFFAOYSA-N	424.204530266							109013
MLS000525281	LSM-20412	SID14724031, BRD-K19923229	2246718	InChI=1S/C10H9F8N3O/c1-4-2-5(21-7(19)20-4)22-3-8(13,14)10(17,18)9(15,16)6(11)12/h2,6H,3H2,1H3,(H2,19,20,21)	PYLQFLPNCXPNNY-UHFFFAOYSA-N	Cc1cc(OCC(F)(F)C(F)(F)C(F)(F)C(F)F)nc(N)n1	BroadT	BRD-K19923229	BRD-K19923229-001-06-9	Asinex Ltd.	BAS 00489448			Cc1cc(OCC(F)(F)C(F)(F)C(F)(F)C(F)F)nc(N)n1	InChI=1S/C10H9F8N3O/c1-4-2-5(21-7(19)20-4)22-3-8(13,14)10(17,18)9(15,16)6(11)12/h2,6H,3H2,1H3,(H2,19,20,21)	PYLQFLPNCXPNNY-UHFFFAOYSA-N	339.061787538							109014
SMR000035856	LSM-20413	SID864979, BRD-A16346972	666227	InChI=1S/C28H32N4O3/c1-19-27-23(15-22(16-24(27)33)21-9-10-25(34-2)26(17-21)35-3)30-28(29-19)32-13-11-31(12-14-32)18-20-7-5-4-6-8-20/h4-10,17,22H,11-16,18H2,1-3H3	UARHQZKJXRGULB-UHFFFAOYSA-N	COc1ccc(cc1OC)C2CC(=O)c3c(C)nc(nc3C2)N4CCN(Cc5ccccc5)CC4	BroadT	BRD-A16346972	BRD-A16346972-001-06-7	InterBioScreen Ltd.	STOCK5S-35279			COc1ccc(cc1OC)C1CC(=O)c2c(C)nc(nc2C1)N1CCN(Cc2ccccc2)CC1	InChI=1S/C28H32N4O3/c1-19-27-23(15-22(16-24(27)33)21-9-10-25(34-2)26(17-21)35-3)30-28(29-19)32-13-11-31(12-14-32)18-20-7-5-4-6-8-20/h4-10,17,22H,11-16,18H2,1-3H3	UARHQZKJXRGULB-UHFFFAOYSA-N	472.247440924							109015
MLS000590190	LSM-43873	BRD-K41717398, SID17514119	1839201	InChI=1S/C18H16N2O4S/c1-23-13-6-4-12(5-7-13)19-18-20-17(22)16(25-18)10-11-3-8-14(21)15(9-11)24-2/h3-10,21H,1-2H3,(H,19,20,22)/b16-10-	NKPNQUGCYMLOHH-YBEGLDIGSA-N	COc1ccc(NC2=NC(=O)\C(=C\c3ccc(O)c(OC)c3)\S2)cc1	BroadT	BRD-K41717398	BRD-K41717398-001-06-2	InterBioScreen Ltd.	STOCK3S-51614			COc1ccc(NC2=NC(=O)\C(S2)=C\c2ccc(O)c(OC)c2)cc1	InChI=1S/C18H16N2O4S/c1-23-13-6-4-12(5-7-13)19-18-20-17(22)16(25-18)10-11-3-8-14(21)15(9-11)24-2/h3-10,21H,1-2H3,(H,19,20,22)/b16-10-	NKPNQUGCYMLOHH-YBEGLDIGSA-N	356.083077702							
4-Methoxy-n-[5-(4-methoxyphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide	LSM-20415	SID17431826, BRD-K82071023	1347412	InChI=1S/C24H19N3O5S/c1-31-19-11-5-16(6-12-19)22-21(15-3-9-18(10-4-15)27(29)30)25-24(33-22)26-23(28)17-7-13-20(32-2)14-8-17/h3-14H,1-2H3,(H,25,26,28)	UJKSYWKIKCDVGW-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)Nc2nc(c3ccc(cc3)[N+](=O)[O-])c(s2)c4ccc(OC)cc4	BroadT	BRD-K82071023	BRD-K82071023-001-05-9	ChemBridge Corporation	6348821			COc1ccc(cc1)C(=O)Nc1nc(c(s1)-c1ccc(OC)cc1)-c1ccc(cc1)[N+]([O-])=O	InChI=1S/C24H19N3O5S/c1-31-19-11-5-16(6-12-19)22-21(15-3-9-18(10-4-15)27(29)30)25-24(33-22)26-23(28)17-7-13-20(32-2)14-8-17/h3-14H,1-2H3,(H,25,26,28)	UJKSYWKIKCDVGW-UHFFFAOYSA-N	461.104541428							109017
MLS001007222	LSM-20416	SID24830440, BRD-K44624496	2349797	InChI=1S/C18H17N3S/c22-18(20-12-9-14-5-2-1-3-6-14)21-17-8-4-7-15-13-19-11-10-16(15)17/h1-8,10-11,13H,9,12H2,(H2,20,21,22)	KMFSWUHRISKCRW-UHFFFAOYSA-N	S=C(NCCc1ccccc1)Nc2cccc3cnccc23	BroadT	BRD-K44624496	BRD-K44624496-001-06-8	Enamine Ltd.	T0507-0244			S=C(NCCc1ccccc1)Nc1cccc2cnccc12	InChI=1S/C18H17N3S/c22-18(20-12-9-14-5-2-1-3-6-14)21-17-8-4-7-15-13-19-11-10-16(15)17/h1-8,10-11,13H,9,12H2,(H2,20,21,22)	KMFSWUHRISKCRW-UHFFFAOYSA-N	307.114318264							109018
MLS000085321	LSM-20417	BRD-K36025260	3241706	InChI=1S/C20H21N3O/c1-22-19-5-3-2-4-16(19)6-11-20(22)21-17-7-9-18(10-8-17)23-12-14-24-15-13-23/h2-11H,12-15H2,1H3	QMQBIGNXUXRHPE-UHFFFAOYSA-N	CN1C(=Nc2ccc(cc2)N3CCOCC3)C=Cc4ccccc14	BroadT	BRD-K36025260	BRD-K36025260-001-06-2	ChemDiv Inc.	5984-0301			Cn1c2ccccc2ccc1=Nc1ccc(cc1)N1CCOCC1	InChI=1S/C20H21N3O/c1-22-19-5-3-2-4-16(19)6-11-20(22)21-17-7-9-18(10-8-17)23-12-14-24-15-13-23/h2-11H,12-15H2,1H3	QMQBIGNXUXRHPE-UHFFFAOYSA-N	319.168462322							109019
(5-Allyl-6-methyl-2-methylsulfanyl-pyrimidin-4-yl)-phenyl-amine	LSM-20418	SID14721503, BRD-K74365325	623158	InChI=1S/C15H17N3S/c1-4-8-13-11(2)16-15(19-3)18-14(13)17-12-9-6-5-7-10-12/h4-7,9-10H,1,8H2,2-3H3,(H,16,17,18)	ZIDHKBXHAVJWKD-UHFFFAOYSA-N	CSc1nc(C)c(CC=C)c(Nc2ccccc2)n1	BroadT	BRD-K74365325	BRD-K74365325-001-06-8	Asinex Ltd.	BAS 00327943			CSc1nc(C)c(CC=C)c(Nc2ccccc2)n1	InChI=1S/C15H17N3S/c1-4-8-13-11(2)16-15(19-3)18-14(13)17-12-9-6-5-7-10-12/h4-7,9-10H,1,8H2,2-3H3,(H,16,17,18)	ZIDHKBXHAVJWKD-UHFFFAOYSA-N	271.114318264							109020
MLS000088965	LSM-20419	SID4256770, BRD-K30913912	1222070	InChI=1S/C24H23ClN2O5/c25-18-2-4-19(5-3-18)29-15-20-6-8-22(32-20)24(28)27-11-9-26(10-12-27)14-17-1-7-21-23(13-17)31-16-30-21/h1-8,13H,9-12,14-16H2	VLGIHPDIKKJWQT-UHFFFAOYSA-N	Clc1ccc(OCc2oc(cc2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)cc1	BroadT	BRD-K30913912	BRD-K30913912-001-06-7	ChemBridge Corporation	7536604			Clc1ccc(OCc2ccc(o2)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)cc1	InChI=1S/C24H23ClN2O5/c25-18-2-4-19(5-3-18)29-15-20-6-8-22(32-20)24(28)27-11-9-26(10-12-27)14-17-1-7-21-23(13-17)31-16-30-21/h1-8,13H,9-12,14-16H2	VLGIHPDIKKJWQT-UHFFFAOYSA-N	454.129549566							109021
SMR000095037	LSM-20420	SID7964963, BRD-K86569030	5307332	InChI=1S/C21H28N4O2/c1-5-25(6-2)13-9-12-22-20(26)18-14-16-19(23(18)3)15-10-7-8-11-17(15)24(4)21(16)27/h7-8,10-11,14H,5-6,9,12-13H2,1-4H3,(H,22,26)	GLVOAMYFNPKTDR-UHFFFAOYSA-N	CCN(CC)CCCNC(=O)c1cc2C(=O)N(C)c3ccccc3c2n1C	BroadT	BRD-K86569030	BRD-K86569030-001-05-9	ChemDiv Inc.	C593-0410			CCN(CC)CCCNC(=O)c1cc2c(n1C)c1ccccc1n(C)c2=O	InChI=1S/C21H28N4O2/c1-5-25(6-2)13-9-12-22-20(26)18-14-16-19(23(18)3)15-10-7-8-11-17(15)24(4)21(16)27/h7-8,10-11,14H,5-6,9,12-13H2,1-4H3,(H,22,26)	GLVOAMYFNPKTDR-UHFFFAOYSA-N	368.221226176							109022
AC1LDHN3	LSM-15303	BRD-K23016966	667225	InChI=1S/C12H16BrN5OS/c1-18-12(15-16-17-18)20-6-5-14-8-9-7-10(13)3-4-11(9)19-2/h3-4,7,14H,5-6,8H2,1-2H3	MWVFSBOSJAKLQG-UHFFFAOYSA-N	COc1ccc(Br)cc1CNCCSc2nnnn2C	BroadT	BRD-K23016966	BRD-K23016966-003-05-1	InterBioScreen Ltd.	STOCK5S-58169		Cl	COc1ccc(Br)cc1CNCCSc1nnnn1C.Cl	InChI=1S/C12H16BrN5OS.ClH/c1-18-12(15-16-17-18)20-6-5-14-8-9-7-10(13)3-4-11(9)19-2;/h3-4,7,14H,5-6,8H2,1-2H3;1H	NRBQHHKWZQNYEH-UHFFFAOYSA-N	357.025893472							103950, 103950
SMR000005326	LSM-20421	SID849471, BRD-K36284662	651965	InChI=1S/C20H22N4O4S/c1-14-15(7-12-27-14)19-21-22-20(28-19)29-13-18(25)24-10-8-23(9-11-24)16-5-3-4-6-17(16)26-2/h3-7,12H,8-11,13H2,1-2H3	YZBGMCRGUVPUHK-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)C(=O)CSc3oc(nn3)c4ccoc4C	BroadT	BRD-K36284662	BRD-K36284662-001-05-1	Asinex Ltd.	ASN 05666843			COc1ccccc1N1CCN(CC1)C(=O)CSc1nnc(o1)-c1ccoc1C	InChI=1S/C20H22N4O4S/c1-14-15(7-12-27-14)19-21-22-20(28-19)29-13-18(25)24-10-8-23(9-11-24)16-5-3-4-6-17(16)26-2/h3-7,12H,8-11,13H2,1-2H3	YZBGMCRGUVPUHK-UHFFFAOYSA-N	414.136175914							109023
ZINC01430105	LSM-20422	SID24788920, BRD-K81356814	1509921	InChI=1S/C12H13N3O4S/c1-15-8-10(7-13-15)20(16,17)14-9-2-3-11-12(6-9)19-5-4-18-11/h2-3,6-8,14H,4-5H2,1H3	HNHAGCHMIASXJI-UHFFFAOYSA-N	Cn1cc(cn1)S(=O)(=O)Nc2ccc3OCCOc3c2	BroadT	BRD-K81356814	BRD-K81356814-001-05-8	ChemDiv Inc.	8016-7752			Cn1cc(cn1)S(=O)(=O)Nc1ccc2OCCOc2c1	InChI=1S/C12H13N3O4S/c1-15-8-10(7-13-15)20(16,17)14-9-2-3-11-12(6-9)19-5-4-18-11/h2-3,6-8,14H,4-5H2,1H3	HNHAGCHMIASXJI-UHFFFAOYSA-N	295.062676616							109024
4-((Benzyl(methyl)amino)methyl)-7-hydroxy-8-methyl-2H-chromen-2-one	LSM-20423	SID26659132, BRD-K30190170	5615409	InChI=1S/C19H19NO3/c1-13-17(21)9-8-16-15(10-18(22)23-19(13)16)12-20(2)11-14-6-4-3-5-7-14/h3-10,21H,11-12H2,1-2H3	XIVGYNCEYFXQKN-UHFFFAOYSA-N	CN(CC1=CC(=O)Oc2c(C)c(O)ccc12)Cc3ccccc3	BroadT	BRD-K30190170	BRD-K30190170-001-06-9	InterBioScreen Ltd.	STOCK5S-60062			CN(Cc1ccccc1)Cc1cc(=O)oc2c(C)c(O)ccc12	InChI=1S/C19H19NO3/c1-13-17(21)9-8-16-15(10-18(22)23-19(13)16)12-20(2)11-14-6-4-3-5-7-14/h3-10,21H,11-12H2,1-2H3	XIVGYNCEYFXQKN-UHFFFAOYSA-N	309.136493478							109025
SMR000047648	LSM-20424	SID865144, BRD-K72142399	666394	InChI=1S/C20H14FN5/c1-12-17-18(13-7-9-14(21)10-8-13)16(11-22)19(23)24-20(17)26(25-12)15-5-3-2-4-6-15/h2-10H,1H3,(H2,23,24)	CDOWYMNKXWPDQS-UHFFFAOYSA-N	Cc1nn(c2ccccc2)c3nc(N)c(C#N)c(c4ccc(F)cc4)c13	BroadT	BRD-K72142399	BRD-K72142399-001-05-6	InterBioScreen Ltd.	STOCK5S-36570			Cc1nn(-c2ccccc2)c2nc(N)c(C#N)c(-c3ccc(F)cc3)c12	InChI=1S/C20H14FN5/c1-12-17-18(13-7-9-14(21)10-8-13)16(11-22)19(23)24-20(17)26(25-12)15-5-3-2-4-6-15/h2-10H,1H3,(H2,23,24)	CDOWYMNKXWPDQS-UHFFFAOYSA-N	343.123323698							109026
MLS000553319	LSM-20425	SID17408744, BRD-K18398566	801366	InChI=1S/C18H14N2O3S/c1-12-16(11-24-17(12)13-6-3-2-4-7-13)18(21)19-14-8-5-9-15(10-14)20(22)23/h2-11H,1H3,(H,19,21)	VQSIMGZYWMLUOD-UHFFFAOYSA-N	Cc1c(csc1c2ccccc2)C(=O)Nc3cccc(c3)[N+](=O)[O-]	BroadT	BRD-K18398566	BRD-K18398566-001-07-4	Asinex Ltd.	BAS 01843288			Cc1c(csc1-c1ccccc1)C(=O)Nc1cccc(c1)[N+]([O-])=O	InChI=1S/C18H14N2O3S/c1-12-16(11-24-17(12)13-6-3-2-4-7-13)18(21)19-14-8-5-9-15(10-14)20(22)23/h2-11H,1H3,(H,19,21)	VQSIMGZYWMLUOD-UHFFFAOYSA-N	338.072513018							109027
ASN 05072095	LSM-20426	SID851610, BRD-A27565568	654196	InChI=1S/C21H27N5S/c1-2-25(16-17-10-5-3-6-11-17)20(19-14-9-15-27-19)21-22-23-24-26(21)18-12-7-4-8-13-18/h3,5-6,9-11,14-15,18,20H,2,4,7-8,12-13,16H2,1H3	QLPCICJMQRAXDA-UHFFFAOYSA-N	CCN(Cc1ccccc1)C(c2cccs2)c3nnnn3C4CCCCC4	BroadT	BRD-A27565568	BRD-A27565568-001-07-7	Asinex Ltd.	ASN 05072095			CCN(Cc1ccccc1)C(c1cccs1)c1nnnn1C1CCCCC1	InChI=1S/C21H27N5S/c1-2-25(16-17-10-5-3-6-11-17)20(19-14-9-15-27-19)21-22-23-24-26(21)18-12-7-4-8-13-18/h3,5-6,9-11,14-15,18,20H,2,4,7-8,12-13,16H2,1H3	QLPCICJMQRAXDA-UHFFFAOYSA-N	381.198716604							109028
MLS000664665	LSM-20427	SID24794234, BRD-K24786917	2976095	InChI=1S/C23H22N4S/c1-17-15-22(19-9-5-6-10-20(19)24-17)26-11-13-27(14-12-26)23-25-21(16-28-23)18-7-3-2-4-8-18/h2-10,15-16H,11-14H2,1H3	HTZQTFJZCQZKBO-UHFFFAOYSA-N	Cc1cc(N2CCN(CC2)c3nc(cs3)c4ccccc4)c5ccccc5n1	BroadT	BRD-K24786917	BRD-K24786917-001-05-2	ChemBridge Corporation	7965146			Cc1cc(N2CCN(CC2)c2nc(cs2)-c2ccccc2)c2ccccc2n1	InChI=1S/C23H22N4S/c1-17-15-22(19-9-5-6-10-20(19)24-17)26-11-13-27(14-12-26)23-25-21(16-28-23)18-7-3-2-4-8-18/h2-10,15-16H,11-14H2,1H3	HTZQTFJZCQZKBO-UHFFFAOYSA-N	386.156517434							109029
2-[2-(4-Methoxyphenyl)-2-oxoethyl]-1H-1,2-benzisothiazole-1,1,3(2H)-trione	LSM-20428	SID26726873, BRD-K45793202	2815177	InChI=1S/C16H13NO5S/c1-22-12-8-6-11(7-9-12)14(18)10-17-16(19)13-4-2-3-5-15(13)23(17,20)21/h2-9H,10H2,1H3	ATFDVOJOQZNNMA-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)CN2C(=O)c3ccccc3S2(=O)=O	BroadT	BRD-K45793202	BRD-K45793202-001-04-0	Maybridge	HTS 10033			COc1ccc(cc1)C(=O)CN1C(=O)c2ccccc2S1(=O)=O	InChI=1S/C16H13NO5S/c1-22-12-8-6-11(7-9-12)14(18)10-17-16(19)13-4-2-3-5-15(13)23(17,20)21/h2-9H,10H2,1H3	ATFDVOJOQZNNMA-UHFFFAOYSA-N	331.051443216							109030
AC1M7ENZ	LSM-43874	SID22407075, BRD-K17665739	2416670	InChI=1S/C14H14N4O2/c1-20-7-6-17-14(19)11(8-15)12-9-4-2-3-5-10(9)13(16)18-12/h2-5H,6-7H2,1H3,(H2,16,18)(H,17,19)/b12-11-	BNOXWUGLSGXYDP-QXMHVHEDSA-N	COCCNC(=O)\C(=C\1/N=C(N)c2ccccc12)\C#N	BroadT	BRD-K17665739	BRD-K17665739-001-06-1	Enamine Ltd.	T5212626			COCCNC(=O)C(\C#N)=C1/N=C(N)c2ccccc12	InChI=1S/C14H14N4O2/c1-20-7-6-17-14(19)11(8-15)12-9-4-2-3-5-10(9)13(16)18-12/h2-5H,6-7H2,1H3,(H2,16,18)(H,17,19)/b12-11-	BNOXWUGLSGXYDP-QXMHVHEDSA-N	270.111675728							
T0514-7507	LSM-20430	BRD-K24873097	5971819	InChI=1S/C15H15N3O2S/c1-20-14-5-3-2-4-13(14)17-15(21)18-16-10-11-6-8-12(19)9-7-11/h2-10,19H,1H3,(H2,17,18,21)	PLWQDUUWXYBUQS-UHFFFAOYSA-N	COc1ccccc1N=C(S)NN=Cc2ccc(O)cc2	BroadT	BRD-K24873097	BRD-K24873097-001-06-8	Enamine Ltd.	T0514-7507			COc1ccccc1N=C(S)NN=Cc1ccc(O)cc1	InChI=1S/C15H15N3O2S/c1-20-14-5-3-2-4-13(14)17-15(21)18-16-10-11-6-8-12(19)9-7-11/h2-10,19H,1H3,(H2,17,18,21)	PLWQDUUWXYBUQS-UHFFFAOYSA-N	301.08849744							
AC1LWVUY	LSM-43875	BRD-K51749738	1759540	InChI=1S/C24H23N3O4S/c1-16-9-11-20(32-16)15-25-27-24(29)21(26-23(28)17-7-5-4-6-8-17)14-18-13-19(30-2)10-12-22(18)31-3/h4-15H,1-3H3,(H,26,28)(H,27,29)/b21-14-,25-15?	LBSAUOQDAXVOFA-CLDDIGBZSA-N	COc1ccc(OC)c(\C=C(/NC(=O)c2ccccc2)\C(=O)NN=Cc3ccc(C)s3)c1	BroadT	BRD-K51749738	BRD-K51749738-001-05-3	Specs	AN-655/15260142			COc1ccc(OC)c(\C=C(/NC(=O)c2ccccc2)C(=O)NN=Cc2ccc(C)s2)c1	InChI=1S/C24H23N3O4S/c1-16-9-11-20(32-16)15-25-27-24(29)21(26-23(28)17-7-5-4-6-8-17)14-18-13-19(30-2)10-12-22(18)31-3/h4-15H,1-3H3,(H,26,28)(H,27,29)/b21-14-,25-15?	LBSAUOQDAXVOFA-CLDDIGBZSA-N	449.140926936							
STK873220	LSM-20432	SID22415764, BRD-K61938702	2294592	InChI=1S/C16H13ClN2O2S/c17-13-8-6-12(7-9-13)15(21)19-16(22)18-10-14(20)11-4-2-1-3-5-11/h1-9H,10H2,(H2,18,19,21,22)	LIRJYNWOYWNOPD-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)NC(=S)NCC(=O)c2ccccc2	BroadT	BRD-K61938702	BRD-K61938702-001-05-2	ChemBridge Corporation	6963295			Clc1ccc(cc1)C(=O)NC(=S)NCC(=O)c1ccccc1	InChI=1S/C16H13ClN2O2S/c17-13-8-6-12(7-9-13)15(21)19-16(22)18-10-14(20)11-4-2-1-3-5-11/h1-9H,10H2,(H2,18,19,21,22)	LIRJYNWOYWNOPD-UHFFFAOYSA-N	332.038626076							109034
MLS000573268	LSM-20433	SID17431850, BRD-A54711552	2894570	InChI=1S/C19H20Cl3N3O2S/c1-2-13-8-10-15(11-9-13)27-12-16(26)24-17(19(20,21)22)25-18(28)23-14-6-4-3-5-7-14/h3-11,17H,2,12H2,1H3,(H,24,26)(H2,23,25,28)	GLMXMCCGBQKNOF-UHFFFAOYSA-N	CCc1ccc(OCC(=O)NC(N=C(S)Nc2ccccc2)C(Cl)(Cl)Cl)cc1	BroadT	BRD-A54711552	BRD-A54711552-001-05-5	ChemBridge Corporation	6367026			CCc1ccc(OCC(=O)NC(N=C(S)Nc2ccccc2)C(Cl)(Cl)Cl)cc1	InChI=1S/C19H20Cl3N3O2S/c1-2-13-8-10-15(11-9-13)27-12-16(26)24-17(19(20,21)22)25-18(28)23-14-6-4-3-5-7-14/h3-11,17H,2,12H2,1H3,(H,24,26)(H2,23,25,28)	GLMXMCCGBQKNOF-UHFFFAOYSA-N	459.03418073							109035
MLS000039682	LSM-20434	SID865771, BRD-K06479861	667032	InChI=1S/C23H27N7/c24-22-25-21(17-28-13-15-29(16-14-28)19-9-2-1-3-10-19)26-23(27-22)30-12-6-8-18-7-4-5-11-20(18)30/h1-5,7,9-11H,6,8,12-17H2,(H2,24,25,26,27)	XAPUHHALCZTLTF-UHFFFAOYSA-N	Nc1nc(CN2CCN(CC2)c3ccccc3)nc(n1)N4CCCc5ccccc45	BroadT	BRD-K06479861	BRD-K06479861-001-06-0	InterBioScreen Ltd.	STOCK5S-50522			Nc1nc(CN2CCN(CC2)c2ccccc2)nc(n1)N1CCCc2ccccc12	InChI=1S/C23H27N7/c24-22-25-21(17-28-13-15-29(16-14-28)19-9-2-1-3-10-19)26-23(27-22)30-12-6-8-18-7-4-5-11-20(18)30/h1-5,7,9-11H,6,8,12-17H2,(H2,24,25,26,27)	XAPUHHALCZTLTF-UHFFFAOYSA-N	401.232793934							109036
CHEMBL158287	LSM-15304	BRD-K91562519	647533	InChI=1S/C12H15N3OS/c1-15(2)8-9-17-12-14-13-11(16-12)10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3	YSGAMTVFIHHPJH-UHFFFAOYSA-N	CN(C)CCSc1oc(nn1)c2ccccc2	BroadT	BRD-K91562519	BRD-K91562519-003-05-3	Asinex Ltd.	BAS 06982259		Cl	CN(C)CCSc1nnc(o1)-c1ccccc1.Cl	InChI=1S/C12H15N3OS.ClH/c1-15(2)8-9-17-12-14-13-11(16-12)10-6-4-3-5-7-10;/h3-7H,8-9H2,1-2H3;1H	AQMCPVNGPXSDDQ-UHFFFAOYSA-N	249.09358282							103951, 103951
SMR000045480	LSM-20435	SID863182, BRD-K10473290	664429	InChI=1S/C20H19N3O3/c1-24-15-9-7-14(8-10-15)11-12-22-20-17(13-21)23-19(26-20)16-5-3-4-6-18(16)25-2/h3-10,22H,11-12H2,1-2H3	IXFPNFLNBKWULR-UHFFFAOYSA-N	COc1ccc(CCNc2oc(nc2C#N)c3ccccc3OC)cc1	BroadT	BRD-K10473290	BRD-K10473290-001-07-6	InterBioScreen Ltd.	STOCK4S-69671			COc1ccc(CCNc2oc(nc2C#N)-c2ccccc2OC)cc1	InChI=1S/C20H19N3O3/c1-24-15-9-7-14(8-10-15)11-12-22-20-17(13-21)23-19(26-20)16-5-3-4-6-18(16)25-2/h3-10,22H,11-12H2,1-2H3	IXFPNFLNBKWULR-UHFFFAOYSA-N	349.142641498							109037
AC1NSHQM	LSM-20436	SID7969170, BRD-A52415038	5309811	InChI=1S/C16H25NO3/c1-5-11(3)17-14(18)13-12(4)15(19)20-16(13)8-6-10(2)7-9-16/h10-11H,5-9H2,1-4H3,(H,17,18)	GQCQSKSVHJCCJF-UHFFFAOYSA-N	CCC(C)NC(=O)C1=C(C)C(=O)OC12CCC(C)CC2	BroadT	BRD-A52415038	BRD-A52415038-001-04-2	ChemDiv Inc.	C533-0940			CCC(C)NC(=O)C1=C(C)C(=O)OC11CCC(C)CC1	InChI=1S/C16H25NO3/c1-5-11(3)17-14(18)13-12(4)15(19)20-16(13)8-6-10(2)7-9-16/h10-11H,5-9H2,1-4H3,(H,17,18)	GQCQSKSVHJCCJF-UHFFFAOYSA-N	279.18344367							109038
AC1M51PQ	LSM-43876	SID26670324, BRD-K99562210	2320101	InChI=1S/C23H29N3O4S/c1-3-26(4-2)31(28,29)22-12-5-19(6-13-22)7-14-23(27)24-20-8-10-21(11-9-20)25-15-17-30-18-16-25/h5-14H,3-4,15-18H2,1-2H3,(H,24,27)/b14-7+	SSIRIVQINNOMAH-VGOFMYFVSA-N	CCN(CC)S(=O)(=O)c1ccc(\C=C\C(=O)Nc2ccc(cc2)N3CCOCC3)cc1	BroadT	BRD-K99562210	BRD-K99562210-001-05-1	Enamine Ltd.	T0503-7144			CCN(CC)S(=O)(=O)c1ccc(cc1)\C=C\C(=O)Nc1ccc(cc1)N1CCOCC1	InChI=1S/C23H29N3O4S/c1-3-26(4-2)31(28,29)22-12-5-19(6-13-22)7-14-23(27)24-20-8-10-21(11-9-20)25-15-17-30-18-16-25/h5-14H,3-4,15-18H2,1-2H3,(H,24,27)/b14-7+	SSIRIVQINNOMAH-VGOFMYFVSA-N	443.187877128							
SMR000124447	LSM-20438	SID14723175, BRD-A63843582	3231223	InChI=1S/C21H23N5O4S/c1-3-30-21(29)13-5-4-10-26(11-13)15-8-6-14(7-9-15)24-20(28)18-16-17(25-31-18)19(27)23-12(2)22-16/h6-9,13H,3-5,10-11H2,1-2H3,(H,24,28)(H,22,23,27)	SOMRSGZDUWXXCH-UHFFFAOYSA-N	CCOC(=O)C1CCCN(C1)c2ccc(NC(=O)c3snc4c(O)nc(C)nc34)cc2	BroadT	BRD-A63843582	BRD-A63843582-001-05-9	Asinex Ltd.	ASN 09646888			CCOC(=O)C1CCCN(C1)c1ccc(NC(=O)c2snc3c(O)nc(C)nc23)cc1	InChI=1S/C21H23N5O4S/c1-3-30-21(29)13-5-4-10-26(11-13)15-8-6-14(7-9-15)24-20(28)18-16-17(25-31-18)19(27)23-12(2)22-16/h6-9,13H,3-5,10-11H2,1-2H3,(H,24,28)(H,22,23,27)	SOMRSGZDUWXXCH-UHFFFAOYSA-N	441.147074956							109040
7-(2-Oxopropoxy)-3-phenyl-2H-chromen-2-one	LSM-20439	SID47196407, BRD-K89512238	1265303	InChI=1S/C18H14O4/c1-12(19)11-21-15-8-7-14-9-16(13-5-3-2-4-6-13)18(20)22-17(14)10-15/h2-10H,11H2,1H3	QRWTUBWNGMPQJR-UHFFFAOYSA-N	CC(=O)COc1ccc2C=C(C(=O)Oc2c1)c3ccccc3	BroadT	BRD-K89512238	BRD-K89512238-001-06-4	ChemBridge Corporation	7934884			CC(=O)COc1ccc2cc(-c3ccccc3)c(=O)oc2c1	InChI=1S/C18H14O4/c1-12(19)11-21-15-8-7-14-9-16(13-5-3-2-4-6-13)18(20)22-17(14)10-15/h2-10H,11H2,1H3	QRWTUBWNGMPQJR-UHFFFAOYSA-N	294.089208928							109041
MLS000112987	LSM-20440	SID7974144, BRD-K71826120	800932	InChI=1S/C14H10ClFO3/c15-11-2-1-3-12(16)10(11)7-14(19)9-5-4-8(17)6-13(9)18/h1-6,17-18H,7H2	ZDTYYXLZABVGDD-UHFFFAOYSA-N	Oc1ccc(C(=O)Cc2c(F)cccc2Cl)c(O)c1	BroadT	BRD-K71826120	BRD-K71826120-001-05-1	ChemBridge Corporation	6943970			Oc1ccc(C(=O)Cc2c(F)cccc2Cl)c(O)c1	InChI=1S/C14H10ClFO3/c15-11-2-1-3-12(16)10(11)7-14(19)9-5-4-8(17)6-13(9)18/h1-6,17-18H,7H2	ZDTYYXLZABVGDD-UHFFFAOYSA-N	280.03025009							109042
MLS001005762	LSM-20441	SID24837653, BRD-K25846980	2337974	InChI=1S/C17H16ClNO5/c18-13-5-3-12(4-6-13)15(20)7-8-17(22)24-11-16(21)19-10-14-2-1-9-23-14/h1-6,9H,7-8,10-11H2,(H,19,21)	WJIQPVRRCCNTBT-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)CCC(=O)OCC(=O)NCc2occc2	BroadT	BRD-K25846980	BRD-K25846980-001-05-5	Enamine Ltd.	T0506-0121			Clc1ccc(cc1)C(=O)CCC(=O)OCC(=O)NCc1ccco1	InChI=1S/C17H16ClNO5/c18-13-5-3-12(4-6-13)15(20)7-8-17(22)24-11-16(21)19-10-14-2-1-9-23-14/h1-6,9H,7-8,10-11H2,(H,19,21)	WJIQPVRRCCNTBT-UHFFFAOYSA-N	349.071700332							109043
2-(5-{2-[(4-Methylphenyl)thio]acetyl}-2-thienyl)acetic acid	LSM-20442	SID26730942, BRD-K94283871	2821274	InChI=1S/C15H14O3S2/c1-10-2-4-11(5-3-10)19-9-13(16)14-7-6-12(20-14)8-15(17)18/h2-7H,8-9H2,1H3,(H,17,18)	ZMVCRIFYVTXPMQ-UHFFFAOYSA-N	Cc1ccc(SCC(=O)c2ccc(CC(=O)O)s2)cc1	BroadT	BRD-K94283871	BRD-K94283871-001-05-9	Maybridge	KM 05953			Cc1ccc(SCC(=O)c2ccc(CC(O)=O)s2)cc1	InChI=1S/C15H14O3S2/c1-10-2-4-11(5-3-10)19-9-13(16)14-7-6-12(20-14)8-15(17)18/h2-7H,8-9H2,1H3,(H,17,18)	ZMVCRIFYVTXPMQ-UHFFFAOYSA-N	306.038435688							109044
SMR000066964	LSM-20443	SID24839994, SID3711365, BRD-K90545072	2116864	InChI=1S/C17H19N3O4S3/c1-2-24-13(22)6-9-7-25-17(19-9)26-8-12(21)20-16-14(15(18)23)10-4-3-5-11(10)27-16/h7H,2-6,8H2,1H3,(H2,18,23)(H,20,21)	KJLSJERLCUZMDK-UHFFFAOYSA-N	CCOC(=O)Cc1csc(SCC(=O)Nc2sc3CCCc3c2C(=O)N)n1	BroadT	BRD-K90545072	BRD-K90545072-001-05-2	Enamine Ltd.	T5245373			CCOC(=O)Cc1csc(SCC(=O)Nc2sc3CCCc3c2C(N)=O)n1	InChI=1S/C17H19N3O4S3/c1-2-24-13(22)6-9-7-25-17(19-9)26-8-12(21)20-16-14(15(18)23)10-4-3-5-11(10)27-16/h7H,2-6,8H2,1H3,(H2,18,23)(H,20,21)	KJLSJERLCUZMDK-UHFFFAOYSA-N	425.053768188							109045
BAS 02069912	LSM-20444	SID24805330, BRD-K74762648	788634	InChI=1S/C16H18N4OS/c1-12-6-5-9-14(10-12)17-11-15(21)19-20-16(22)18-13-7-3-2-4-8-13/h2-10,17H,11H2,1H3,(H,19,21)(H2,18,20,22)	GPHVZLQVSOUYKD-UHFFFAOYSA-N	Cc1cccc(NCC(=O)NN=C(S)Nc2ccccc2)c1	BroadT	BRD-K74762648	BRD-K74762648-001-06-6	Asinex Ltd.	BAS 02069912			Cc1cccc(NCC(=O)NN=C(S)Nc2ccccc2)c1	InChI=1S/C16H18N4OS/c1-12-6-5-9-14(10-12)17-11-15(21)19-20-16(22)18-13-7-3-2-4-8-13/h2-10,17H,11H2,1H3,(H,19,21)(H2,18,20,22)	GPHVZLQVSOUYKD-UHFFFAOYSA-N	314.120131926							109046
9H-Carbazole-3-carboxaldehyde, 9-ethyl-, oxime	LSM-20445	BRD-K42056083	785659	InChI=1S/C15H14N2O/c1-2-17-14-6-4-3-5-12(14)13-9-11(10-16-18)7-8-15(13)17/h3-10,18H,2H2,1H3	FTCBKTWYMQRPFV-UHFFFAOYSA-N	CCn1c2ccccc2c3cc(C=NO)ccc13	BroadT	BRD-K42056083	BRD-K42056083-001-06-4	Specs	AG-205/36566055			CCn1c2ccccc2c2cc(C=NO)ccc12	InChI=1S/C15H14N2O/c1-2-17-14-6-4-3-5-12(14)13-9-11(10-16-18)7-8-15(13)17/h3-10,18H,2H2,1H3	FTCBKTWYMQRPFV-UHFFFAOYSA-N	238.110613088							109047
BRD-A83478897	LSM-20446			InChI=1S/C16H17ClN2O3S/c1-4-22-15(21)13-9(2)18-16(23)19(10(3)20)14(13)11-5-7-12(17)8-6-11/h5-8,13-14H,4H2,1-3H3	XONILWCJQBNRTI-UHFFFAOYSA-N	CCOC(=O)C1C(N(C(=O)C)C(=S)N=C1C)c2ccc(Cl)cc2	BroadT	BRD-A83478897	BRD-A83478897-001-05-0	Asinex Ltd.	BAS 00279426			CCOC(=O)C1C(N(C(C)=O)C(=S)N=C1C)c1ccc(Cl)cc1	InChI=1S/C16H17ClN2O3S/c1-4-22-15(21)13-9(2)18-16(23)19(10(3)20)14(13)11-5-7-12(17)8-6-11/h5-8,13-14H,4H2,1-3H3	XONILWCJQBNRTI-UHFFFAOYSA-N	352.064840824							109048
SMR000241463	LSM-20447	BRD-K16862492, SID17517320	2088506	InChI=1S/C23H20N4O3S/c1-2-15-27(18-10-4-3-5-11-18)31(29,30)19-12-8-9-17(16-19)22(28)26-23-24-20-13-6-7-14-21(20)25-23/h2-14,16H,1,15H2,(H2,24,25,26,28)	GCKKMKDOAFFCMR-UHFFFAOYSA-N	C=CCN(c1ccccc1)S(=O)(=O)c2cccc(c2)C(=O)Nc3nc4ccccc4[nH]3	BroadT	BRD-K16862492	BRD-K16862492-001-06-2	Enamine Ltd.	T5265308			C=CCN(c1ccccc1)S(=O)(=O)c1cccc(c1)C(=O)Nc1nc2ccccc2[nH]1	InChI=1S/C23H20N4O3S/c1-2-15-27(18-10-4-3-5-11-18)31(29,30)19-12-8-9-17(16-19)22(28)26-23-24-20-13-6-7-14-21(20)25-23/h2-14,16H,1,15H2,(H2,24,25,26,28)	GCKKMKDOAFFCMR-UHFFFAOYSA-N	432.12561123							109049
AC1MIVYY	LSM-20448	SID24806882, BRD-K77069004	3127390	InChI=1S/C13H10N4O4/c18-12(9-5-1-2-7-11(9)17(20)21)15-16-13(19)10-6-3-4-8-14-10/h1-8H,(H,15,18)(H,16,19)	PIBAUNUWYKCFCJ-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1C(=O)NNC(=O)c2ccccn2	BroadT	BRD-K77069004	BRD-K77069004-001-06-1	Asinex Ltd.	BAS 01190011			[O-][N+](=O)c1ccccc1C(=O)NNC(=O)c1ccccn1	InChI=1S/C13H10N4O4/c18-12(9-5-1-2-7-11(9)17(20)21)15-16-13(19)10-6-3-4-8-14-10/h1-8H,(H,15,18)(H,16,19)	PIBAUNUWYKCFCJ-UHFFFAOYSA-N	286.07020484							109050
N-(6-Chloro-1,3-benzothiazol-2-yl)-1,5-dimethyl-1H-pyrazole-3-carboxamide	LSM-20449	SID26730431, BRD-K20599398	2738514	InChI=1S/C13H11ClN4OS/c1-7-5-10(17-18(7)2)12(19)16-13-15-9-4-3-8(14)6-11(9)20-13/h3-6H,1-2H3,(H,15,16,19)	FMDDFHIITFILTP-UHFFFAOYSA-N	Cc1cc(nn1C)C(=O)Nc2nc3ccc(Cl)cc3s2	BroadT	BRD-K20599398	BRD-K20599398-001-04-4	Maybridge	SCR 00698			Cc1cc(nn1C)C(=O)Nc1nc2ccc(Cl)cc2s1	InChI=1S/C13H11ClN4OS/c1-7-5-10(17-18(7)2)12(19)16-13-15-9-4-3-8(14)6-11(9)20-13/h3-6H,1-2H3,(H,15,16,19)	FMDDFHIITFILTP-UHFFFAOYSA-N	306.034209412							109051
MLS000331323	LSM-20450	SID17410017, BRD-A88073947	3763605	InChI=1S/C21H19NO3S/c1-16-11-13-18(14-12-16)26(23,24)22-19-9-5-6-10-21(19)25-15-20(22)17-7-3-2-4-8-17/h2-14,20H,15H2,1H3	GUILGOKXFRKEOS-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N2C(COc3ccccc23)c4ccccc4	BroadT	BRD-A88073947	BRD-A88073947-001-05-4	Key Organics Ltd.	5M-315S			Cc1ccc(cc1)S(=O)(=O)N1C(COc2ccccc12)c1ccccc1	InChI=1S/C21H19NO3S/c1-16-11-13-18(14-12-16)26(23,24)22-19-9-5-6-10-21(19)25-15-20(22)17-7-3-2-4-8-17/h2-14,20H,15H2,1H3	GUILGOKXFRKEOS-UHFFFAOYSA-N	365.108564168							109052
MLS000807075	LSM-20451	BRD-K79428338	2082412	InChI=1S/C12H12N2O2S/c1-14-7-8-17-12(14)13-11(15)9-3-5-10(16-2)6-4-9/h3-8H,1-2H3	SQDWSMPIRGBKQX-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)N=C2SC=CN2C	BroadT	BRD-K79428338	BRD-K79428338-001-05-6	Enamine Ltd.	T5260209			COc1ccc(cc1)C(=O)N=c1sccn1C	InChI=1S/C12H12N2O2S/c1-14-7-8-17-12(14)13-11(15)9-3-5-10(16-2)6-4-9/h3-8H,1-2H3	SQDWSMPIRGBKQX-UHFFFAOYSA-N	248.061948334							109053
AC1NJ2B4	LSM-20452	SID22411243, BRD-K37416407	4840534	InChI=1S/C26H30N4O4S/c1-18-9-11-20(35(33,34)29-13-5-3-6-14-29)17-22(18)28-25(31)19-10-12-21-23(16-19)27-24-8-4-2-7-15-30(24)26(21)32/h9-12,16-17H,2-8,13-15H2,1H3,(H,28,31)	XIEAAPGZUCTLEG-UHFFFAOYSA-N	Cc1ccc(cc1NC(=O)c2ccc3C(=O)N4CCCCCC4=Nc3c2)S(=O)(=O)N5CCCCC5	BroadT	BRD-K37416407	BRD-K37416407-001-03-3	Enamine Ltd.	T5339786			Cc1ccc(cc1NC(=O)c1ccc2c(c1)nc1CCCCCn1c2=O)S(=O)(=O)N1CCCCC1	InChI=1S/C26H30N4O4S/c1-18-9-11-20(35(33,34)29-13-5-3-6-14-29)17-22(18)28-25(31)19-10-12-21-23(16-19)27-24-8-4-2-7-15-30(24)26(21)32/h9-12,16-17H,2-8,13-15H2,1H3,(H,28,31)	XIEAAPGZUCTLEG-UHFFFAOYSA-N	494.19877617							109054
MLS000087806	LSM-20453	SID4245095, BRD-K91818342	3239604	InChI=1S/C14H18O5S/c1-11-3-5-12(6-4-11)20(16,17)14(13(15)18-2)7-9-19-10-8-14/h3-6H,7-10H2,1-2H3	LMWFDNMZTICDIT-UHFFFAOYSA-N	COC(=O)C1(CCOCC1)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K91818342	BRD-K91818342-001-05-6	ChemDiv Inc.	2900-0548			COC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C14H18O5S/c1-11-3-5-12(6-4-11)20(16,17)14(13(15)18-2)7-9-19-10-8-14/h3-6H,7-10H2,1-2H3	LMWFDNMZTICDIT-UHFFFAOYSA-N	298.087494366							109055
MLS000083755	LSM-20454	SID865029, BRD-K08742100	5390004	InChI=1S/C18H24N2O4/c1-2-13-9-15-14(10-18(23)24-17(15)11-16(13)22)12-20-5-3-19(4-6-20)7-8-21/h9-11,21-22H,2-8,12H2,1H3	JQAWKPMGFWIPSL-UHFFFAOYSA-N	CCc1cc2C(=CC(=O)Oc2cc1O)CN3CCN(CCO)CC3	BroadT	BRD-K08742100	BRD-K08742100-001-05-2	InterBioScreen Ltd.	STOCK5S-33452			CCc1cc2c(CN3CCN(CCO)CC3)cc(=O)oc2cc1O	InChI=1S/C18H24N2O4/c1-2-13-9-15-14(10-18(23)24-17(15)11-16(13)22)12-20-5-3-19(4-6-20)7-8-21/h9-11,21-22H,2-8,12H2,1H3	JQAWKPMGFWIPSL-UHFFFAOYSA-N	332.173607268							109056
MLS000085681	LSM-20455	SID4243724, BRD-K67390645	3238412	InChI=1S/C11H10N2O4S3/c1-3-17-9(15)6-19-11-7(4-12)10(13-20-11)18-5-8(14)16-2/h3H,1,5-6H2,2H3	LPYPBNDLZWQTLT-UHFFFAOYSA-N	COC(=O)CSc1nsc(SCC(=O)OC=C)c1C#N	BroadT	BRD-K67390645	BRD-K67390645-001-06-8	ChemDiv Inc.	8006-8523			COC(=O)CSc1nsc(SCC(=O)OC=C)c1C#N	InChI=1S/C11H10N2O4S3/c1-3-17-9(15)6-19-11-7(4-12)10(13-20-11)18-5-8(14)16-2/h3H,1,5-6H2,2H3	LPYPBNDLZWQTLT-UHFFFAOYSA-N	329.98026889							109057
MLS000534784	LSM-20456	SID14740382, BRD-K88665865	1332916	InChI=1S/C21H26N2O4S2/c1-3-27-21(26)17-13(2)18(19(25)22-14-8-5-4-6-9-14)29-20(17)23-16(24)12-15-10-7-11-28-15/h7,10-11,14H,3-6,8-9,12H2,1-2H3,(H,22,25)(H,23,24)	HNBFWBDBXIYEGU-UHFFFAOYSA-N	CCOC(=O)c1c(C)c(sc1NC(=O)Cc2cccs2)C(=O)NC3CCCCC3	BroadT	BRD-K88665865	BRD-K88665865-001-05-3	ChemBridge Corporation	7113138			CCOC(=O)c1c(NC(=O)Cc2cccs2)sc(C(=O)NC2CCCCC2)c1C	InChI=1S/C21H26N2O4S2/c1-3-27-21(26)17-13(2)18(19(25)22-14-8-5-4-6-9-14)29-20(17)23-16(24)12-15-10-7-11-28-15/h7,10-11,14H,3-6,8-9,12H2,1-2H3,(H,22,25)(H,23,24)	HNBFWBDBXIYEGU-UHFFFAOYSA-N	434.133398712							109058
AC1LR206	LSM-15305	BRD-K16709960	1361011	InChI=1S/C27H23N3O2/c31-27(25-15-17-30(18-16-25)20-23-7-3-1-4-8-23)29-28-19-22-11-13-26(14-12-22)32-21-24-9-5-2-6-10-24/h1-19H,20-21H2/p+1	AFDKQPMETSOVMT-UHFFFAOYSA-O	O=C(NN=Cc1ccc(OCc2ccccc2)cc1)c3cc[n+](Cc4ccccc4)cc3	BroadT	BRD-K16709960	BRD-K16709960-003-05-6	ChemBridge Corporation	5489879		Cl	O=C(NN=Cc1ccc(OCc2ccccc2)cc1)c1cc[n+](Cc2ccccc2)cc1.Cl	InChI=1S/C27H23N3O2.ClH/c31-27(25-15-17-30(18-16-25)20-23-7-3-1-4-8-23)29-28-19-22-11-13-26(14-12-22)32-21-24-9-5-2-6-10-24;/h1-19H,20-21H2;1H/p+1	BTZWEBRPPUJWPB-UHFFFAOYSA-O	422.186852038							103952, 103952
SMR000043858	LSM-43877	SID861883, BRD-A11552472	5389648	InChI=1S/C17H18ClN3O4/c1-10(19-9-13-3-2-8-25-13)14-15(22)20-17(24)21(16(14)23)12-6-4-11(18)5-7-12/h4-7,13,19H,2-3,8-9H2,1H3,(H,20,22,24)/b14-10+	RGCKYJOSEHCNTI-GXDHUFHOSA-N	C\C(=C/1\C(=O)NC(=O)N(C1=O)c2ccc(Cl)cc2)\NCC3CCCO3	BroadT	BRD-A11552472	BRD-A11552472-001-05-2	InterBioScreen Ltd.	STOCK4S-24197			C\C(NCC1CCCO1)=C1\C(=O)NC(=O)N(C1=O)c1ccc(Cl)cc1	InChI=1S/C17H18ClN3O4/c1-10(19-9-13-3-2-8-25-13)14-15(22)20-17(24)21(16(14)23)12-6-4-11(18)5-7-12/h4-7,13,19H,2-3,8-9H2,1H3,(H,20,22,24)/b14-10+	RGCKYJOSEHCNTI-GXDHUFHOSA-N	363.098583796							
AC1LNVP4	LSM-20458	BRD-K81217287	1209472	InChI=1S/C17H17ClFN3OS/c1-2-20-17(24)22-21-10-12-5-3-6-13(9-12)23-11-14-15(18)7-4-8-16(14)19/h3-10H,2,11H2,1H3,(H2,20,22,24)	HXRJELCRGDMZQB-UHFFFAOYSA-N	CCN=C(S)NN=Cc1cccc(OCc2c(F)cccc2Cl)c1	BroadT	BRD-K81217287	BRD-K81217287-001-06-8	Specs	AM-879/41890787			CCN=C(S)NN=Cc1cccc(OCc2c(F)cccc2Cl)c1	InChI=1S/C17H17ClFN3OS/c1-2-20-17(24)22-21-10-12-5-3-6-13(9-12)23-11-14-15(18)7-4-8-16(14)19/h3-10H,2,11H2,1H3,(H2,20,22,24)	HXRJELCRGDMZQB-UHFFFAOYSA-N	365.076488794							109060
MLS000586154	LSM-20459	SID17510789, BRD-K35177360	6405258	InChI=1S/C20H22N4O4/c1-25-13-5-7-17(27-3)15(11-13)21-19-9-10-20(24-23-19)22-16-12-14(26-2)6-8-18(16)28-4/h5-12H,1-4H3,(H,21,23)(H,22,24)	FNIFMQONEBLCKJ-UHFFFAOYSA-N	COc1ccc(OC)c(Nc2ccc(Nc3cc(OC)ccc3OC)nn2)c1	BroadT	BRD-K35177360	BRD-K35177360-001-07-9	ChemDiv Inc.	8014-1515			COc1ccc(OC)c(Nc2ccc(Nc3cc(OC)ccc3OC)nn2)c1	InChI=1S/C20H22N4O4/c1-25-13-5-7-17(27-3)15(11-13)21-19-9-10-20(24-23-19)22-16-12-14(26-2)6-8-18(16)28-4/h5-12H,1-4H3,(H,21,23)(H,22,24)	FNIFMQONEBLCKJ-UHFFFAOYSA-N	382.164105224							109061
F1843-0598	LSM-20460	SID24815351, BRD-A82120485	16194606	InChI=1S/C21H26N4O7S2/c1-15-2-6-18(7-3-15)34(30,31)25-12-13-32-19(25)14-24-21(27)20(26)23-11-10-16-4-8-17(9-5-16)33(22,28)29/h2-9,19H,10-14H2,1H3,(H,23,26)(H,24,27)(H2,22,28,29)	PGABMKDEMVYBCE-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N2CCOC2CNC(=O)C(=O)NCCc3ccc(cc3)S(=O)(=O)N	BroadT	BRD-A82120485	BRD-A82120485-001-06-5	Life Chemicals Inc.	F1843-0598			Cc1ccc(cc1)S(=O)(=O)N1CCOC1CNC(=O)C(=O)NCCc1ccc(cc1)S(N)(=O)=O	InChI=1S/C21H26N4O7S2/c1-15-2-6-18(7-3-15)34(30,31)25-12-13-32-19(25)14-24-21(27)20(26)23-11-10-16-4-8-17(9-5-16)33(22,28)29/h2-9,19H,10-14H2,1H3,(H,23,26)(H,24,27)(H2,22,28,29)	PGABMKDEMVYBCE-UHFFFAOYSA-N	510.124290592							109062
SMR000007170	LSM-20461	SID844044, BRD-A53956501	646354	InChI=1S/C21H26N2O5S/c1-3-28-19-8-4-7-17(14-19)22-21(24)16-6-5-13-23(15-16)29(25,26)20-11-9-18(27-2)10-12-20/h4,7-12,14,16H,3,5-6,13,15H2,1-2H3,(H,22,24)	RYSRHJSDUGVEOP-UHFFFAOYSA-N	CCOc1cccc(NC(=O)C2CCCN(C2)S(=O)(=O)c3ccc(OC)cc3)c1	BroadT	BRD-A53956501	BRD-A53956501-001-05-9	Asinex Ltd.	ASN 06744512			CCOc1cccc(NC(=O)C2CCCN(C2)S(=O)(=O)c2ccc(OC)cc2)c1	InChI=1S/C21H26N2O5S/c1-3-28-19-8-4-7-17(14-19)22-21(24)16-6-5-13-23(15-16)29(25,26)20-11-9-18(27-2)10-12-20/h4,7-12,14,16H,3,5-6,13,15H2,1-2H3,(H,22,24)	RYSRHJSDUGVEOP-UHFFFAOYSA-N	418.156242642							109063
SMR000038307	LSM-20462	SID856058, BRD-A03315925	657442	InChI=1S/C19H22N6O3/c1-24-15(22-17(26)20-13-9-5-3-6-10-13)16(25(2)19(24)28)23-18(27)21-14-11-7-4-8-12-14/h3-12,15-16H,1-2H3,(H2,20,22,26)(H2,21,23,27)	UDAQTAXNUHMCIL-UHFFFAOYSA-N	CN1C(NC(=O)Nc2ccccc2)C(NC(=O)Nc3ccccc3)N(C)C1=O	BroadT	BRD-A03315925	BRD-A03315925-001-05-7	InterBioScreen Ltd.	STOCK1S-02507			CN1C(NC(=O)Nc2ccccc2)C(NC(=O)Nc2ccccc2)N(C)C1=O	InChI=1S/C19H22N6O3/c1-24-15(22-17(26)20-13-9-5-3-6-10-13)16(25(2)19(24)28)23-18(27)21-14-11-7-4-8-12-14/h3-12,15-16H,1-2H3,(H2,20,22,26)(H2,21,23,27)	UDAQTAXNUHMCIL-UHFFFAOYSA-N	382.175338624							109064
2-[(4-Aminophenyl)sulfanyl]-n-(3-nitrophenyl)acetamide	LSM-20463	SID24819306, BRD-K21384399	3657747	InChI=1S/C14H13N3O3S/c15-10-4-6-13(7-5-10)21-9-14(18)16-11-2-1-3-12(8-11)17(19)20/h1-8H,9,15H2,(H,16,18)	ZBGSZXXCRMGRTB-UHFFFAOYSA-N	Nc1ccc(SCC(=O)Nc2cccc(c2)[N+](=O)[O-])cc1	BroadT	BRD-K21384399	BRD-K21384399-001-05-6	Key Organics Ltd.	JS-2091			Nc1ccc(SCC(=O)Nc2cccc(c2)[N+]([O-])=O)cc1	InChI=1S/C14H13N3O3S/c15-10-4-6-13(7-5-10)21-9-14(18)16-11-2-1-3-12(8-11)17(19)20/h1-8H,9,15H2,(H,16,18)	ZBGSZXXCRMGRTB-UHFFFAOYSA-N	303.067761996							109065
MLS000779097	LSM-20464	BRD-K43220084	1862335	InChI=1S/C19H14ClN3O2S/c20-12-6-8-15(9-7-12)26-11-13-10-16(24)17-18(21-13)22-23(19(17)25)14-4-2-1-3-5-14/h1-10,24-25H,11H2	FLVOODRTIGMRKL-UHFFFAOYSA-N	Oc1cc(CSc2ccc(Cl)cc2)nc3nn(c(O)c13)c4ccccc4	BroadT	BRD-K43220084	BRD-K43220084-001-04-9	InterBioScreen Ltd.	STOCK5S-42301			Clc1ccc(SCc2cc(=O)c3c([nH]n(-c4ccccc4)c3=O)[nH]2)cc1	InChI=1S/C19H14ClN3O2S/c20-12-6-8-15(9-7-12)26-11-13-10-16(24)17-18(21-13)22-23(19(17)25)14-4-2-1-3-5-14/h1-10H,11H2,(H2,21,22,24)	UDYYPRWBKNVMLH-UHFFFAOYSA-N	383.049525118							
ST50809788	LSM-20465	SID26668407, SID7972834, BRD-K61560881	1160013	InChI=1S/C21H28N2O6S2/c1-16-14-18(28-3)6-8-20(16)30(24,25)22-10-5-11-23(13-12-22)31(26,27)21-9-7-19(29-4)15-17(21)2/h6-9,14-15H,5,10-13H2,1-4H3	RTJDFEULLVVMTR-UHFFFAOYSA-N	COc1ccc(c(C)c1)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)c3ccc(OC)cc3C	BroadT	BRD-K61560881	BRD-K61560881-001-05-7	ChemBridge Corporation	6971103			COc1ccc(c(C)c1)S(=O)(=O)N1CCCN(CC1)S(=O)(=O)c1ccc(OC)cc1C	InChI=1S/C21H28N2O6S2/c1-16-14-18(28-3)6-8-20(16)30(24,25)22-10-5-11-23(13-12-22)31(26,27)21-9-7-19(29-4)15-17(21)2/h6-9,14-15H,5,10-13H2,1-4H3	RTJDFEULLVVMTR-UHFFFAOYSA-N	468.138878016							109067
MLS000549234	LSM-20466	SID17410355, BRD-K78230922	3825785	InChI=1S/C18H15N3OS2/c1-10-8-11(2)19-17-13(10)14-15(24-17)16(22)21-18(20-14)23-9-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3,(H,20,21,22)	MKHGNZQMAWYBRF-UHFFFAOYSA-N	Cc1cc(C)c2c(n1)sc3c(O)nc(SCc4ccccc4)nc23	BroadT	BRD-K78230922	BRD-K78230922-001-06-7	Key Organics Ltd.	5R-1325			Cc1cc(C)c2c(n1)sc1c(O)nc(SCc3ccccc3)nc21	InChI=1S/C18H15N3OS2/c1-10-8-11(2)19-17-13(10)14-15(24-17)16(22)21-18(20-14)23-9-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3,(H,20,21,22)	MKHGNZQMAWYBRF-UHFFFAOYSA-N	353.06565351							109068
SMR000369837	LSM-20467	SID24833064, BRD-K17226227	4869202	InChI=1S/C24H26N4O5S/c29-23-16-19(18-5-1-2-6-20(18)25-23)24(30)26-21-15-17(7-8-22(21)27-9-3-4-10-27)34(31,32)28-11-13-33-14-12-28/h1-2,5-8,15-16H,3-4,9-14H2,(H,25,29)(H,26,30)	BWGRZTGWWWUEFA-UHFFFAOYSA-N	Oc1cc(C(=O)Nc2cc(ccc2N3CCCC3)S(=O)(=O)N4CCOCC4)c5ccccc5n1	BroadT	BRD-K17226227	BRD-K17226227-001-05-3	Enamine Ltd.	T5322610			Oc1cc(C(=O)Nc2cc(ccc2N2CCCC2)S(=O)(=O)N2CCOCC2)c2ccccc2n1	InChI=1S/C24H26N4O5S/c29-23-16-19(18-5-1-2-6-20(18)25-23)24(30)26-21-15-17(7-8-22(21)27-9-3-4-10-27)34(31,32)28-11-13-33-14-12-28/h1-2,5-8,15-16H,3-4,9-14H2,(H,25,29)(H,26,30)	BWGRZTGWWWUEFA-UHFFFAOYSA-N	482.162390662							109069
N-Benzyl-2-bromobenzenesulfonamide	LSM-20468	SID26732434, BRD-K01751980	7938012	InChI=1S/C13H12BrNO2S/c14-12-8-4-5-9-13(12)18(16,17)15-10-11-6-2-1-3-7-11/h1-9,15H,10H2	FPQGRYUENBBEOH-UHFFFAOYSA-N	Brc1ccccc1S(=O)(=O)NCc2ccccc2	BroadT	BRD-K01751980	BRD-K01751980-001-05-5	University of Kansas CMLD	KUC101076N			Brc1ccccc1S(=O)(=O)NCc1ccccc1	InChI=1S/C13H12BrNO2S/c14-12-8-4-5-9-13(12)18(16,17)15-10-11-6-2-1-3-7-11/h1-9,15H,10H2	FPQGRYUENBBEOH-UHFFFAOYSA-N	324.977211924							109070
AC1M11HU	LSM-20469	SID22401595, BRD-K11638173	2087168	InChI=1S/C20H16N4O3S/c1-12-17(13-7-3-2-4-8-13)22-20(28-12)21-16(25)11-24-19(27)15-10-6-5-9-14(15)18(26)23-24/h2-10H,11H2,1H3,(H,23,26)(H,21,22,25)	YDCIWBQGMNWGIG-UHFFFAOYSA-N	Cc1sc(NC(=O)CN2NC(=O)c3ccccc3C2=O)nc1c4ccccc4	BroadT	BRD-K11638173	BRD-K11638173-001-05-9	Enamine Ltd.	T5265908			Cc1sc(NC(=O)Cn2[nH]c(=O)c3ccccc3c2=O)nc1-c1ccccc1	InChI=1S/C20H16N4O3S/c1-12-17(13-7-3-2-4-8-13)22-20(28-12)21-16(25)11-24-19(27)15-10-6-5-9-14(15)18(26)23-24/h2-10H,11H2,1H3,(H,23,26)(H,21,22,25)	YDCIWBQGMNWGIG-UHFFFAOYSA-N	392.094311102							109071
MLS000546696	LSM-20470	BRD-K05686793	900891	InChI=1S/C12H12N2OS/c1-9-8-16-12(14(9)2)13-11(15)10-6-4-3-5-7-10/h3-8H,1-2H3	RWCDQEQIQPRLCX-UHFFFAOYSA-N	CN1C(=CSC1=NC(=O)c2ccccc2)C	BroadT	BRD-K05686793	BRD-K05686793-001-05-6	Specs	AI-020/37280150			Cc1csc(=NC(=O)c2ccccc2)n1C	InChI=1S/C12H12N2OS/c1-9-8-16-12(14(9)2)13-11(15)10-6-4-3-5-7-10/h3-8H,1-2H3	RWCDQEQIQPRLCX-UHFFFAOYSA-N	232.067033714							109072
Methyl 2-amino-4-(3-chlorophenyl)-6-(furan-2-ylmethyl)-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carboxylate	LSM-20471	SID865237, BRD-A42328493	666491	InChI=1S/C22H19ClN2O5/c1-12-9-16-18(21(26)25(12)11-15-7-4-8-29-15)17(13-5-3-6-14(23)10-13)19(20(24)30-16)22(27)28-2/h3-10,17H,11,24H2,1-2H3	LEZQTDNNCYFIBU-UHFFFAOYSA-N	COC(=O)C1=C(N)OC2=C(C1c3cccc(Cl)c3)C(=O)N(Cc4occc4)C(=C2)C	BroadT	BRD-A42328493	BRD-A42328493-001-05-5	InterBioScreen Ltd.	STOCK5S-39141			COC(=O)C1=C(N)Oc2cc(C)n(Cc3ccco3)c(=O)c2C1c1cccc(Cl)c1	InChI=1S/C22H19ClN2O5/c1-12-9-16-18(21(26)25(12)11-15-7-4-8-29-15)17(13-5-3-6-14(23)10-13)19(20(24)30-16)22(27)28-2/h3-10,17H,11,24H2,1-2H3	LEZQTDNNCYFIBU-UHFFFAOYSA-N	426.098249438							109073
AC1LWY1V	LSM-43878	BRD-K73322901	1788295	InChI=1S/C17H21N3O3/c1-13(2)7-6-8-14(3)11-12-18-19-17(21)15-9-4-5-10-16(15)20(22)23/h4-5,7,9-12H,6,8H2,1-3H3,(H,19,21)/b14-11+,18-12?	DCVHIRLMZUUDEG-LIVPTCIVSA-N	CC(=CCC\C(=C\C=NNC(=O)c1ccccc1[N+](=O)[O-])\C)C	BroadT	BRD-K73322901	BRD-K73322901-001-05-4	Specs	AN-329/40150015			CC(C)=CCC\C(C)=C\C=NNC(=O)c1ccccc1[N+]([O-])=O	InChI=1S/C17H21N3O3/c1-13(2)7-6-8-14(3)11-12-18-19-17(21)15-9-4-5-10-16(15)20(22)23/h4-5,7,9-12H,6,8H2,1-3H3,(H,19,21)/b14-11+,18-12?	DCVHIRLMZUUDEG-LIVPTCIVSA-N	315.158291562							
ZINC05161650	LSM-15306	BRD-K09496781	1414958	InChI=1S/C18H15N3O/c1-2-15-20-16-13-10-6-7-11-14(13)22-17(16)18(21-15)19-12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,19,20,21)	VREFWGRWFUFDMN-UHFFFAOYSA-N	CCc1nc(Nc2ccccc2)c3oc4ccccc4c3n1	BroadT	BRD-K09496781	BRD-K09496781-003-05-6	InterBioScreen Ltd.	STOCK4S-63306		Cl	CCc1nc(Nc2ccccc2)c2oc3ccccc3c2n1.Cl	InChI=1S/C18H15N3O.ClH/c1-2-15-20-16-13-10-6-7-11-14(13)22-17(16)18(21-15)19-12-8-4-3-5-9-12;/h3-11H,2H2,1H3,(H,19,20,21);1H	HYVWFOMELZORHS-UHFFFAOYSA-N	289.12151213							103953, 103953
AK-968/15608615	LSM-20473	SID22413566, BRD-K57871036	832013	InChI=1S/C11H13N5O3/c1-4-14-10(9(6-12-14)16(18)19)11(17)15-8(3)5-7(2)13-15/h5-6H,4H2,1-3H3	AXDFLVHBQVEESJ-UHFFFAOYSA-N	CCn1ncc(c1C(=O)n2nc(C)cc2C)[N+](=O)[O-]	BroadT	BRD-K57871036	BRD-K57871036-001-05-8	Specs	AK-968/15608615			CCn1ncc(c1C(=O)n1nc(C)cc1C)[N+]([O-])=O	InChI=1S/C11H13N5O3/c1-4-14-10(9(6-12-14)16(18)19)11(17)15-8(3)5-7(2)13-15/h5-6H,4H2,1-3H3	AXDFLVHBQVEESJ-UHFFFAOYSA-N	263.101839326							109075
MLS000708100	LSM-15548	BRD-K43216843	964889	InChI=1S/C14H13ClFN/c15-14-4-2-1-3-12(14)10-17-9-11-5-7-13(16)8-6-11/h1-8,17H,9-10H2	XZIIOVUWCNGFPS-UHFFFAOYSA-N	Fc1ccc(CNCc2ccccc2Cl)cc1	BroadT	BRD-K43216843	BRD-K43216843-034-06-5	Asinex Ltd.	BAS 08261862		OC(=O)C(=O)O	Fc1ccc(CNCc2ccccc2Cl)cc1.OC(=O)C(=O)O	InChI=1S/C14H13ClFN.C2H2O4/c15-14-4-2-1-3-12(14)10-17-9-11-5-7-13(16)8-6-11;3-1(4)2(5)6/h1-8,17H,9-10H2;(H,3,4)(H,5,6)	MXBHBBYBJCHQKU-UHFFFAOYSA-N	249.072055336							104184, 104184
CID_741192	LSM-20474	BRD-A14327743	54556033	InChI=1S/C12H11NOS/c14-10-6-3-5-9-12(10)15-11-7-2-1-4-8(11)13-9/h1-2,4,7,12H,3,5-6H2	ZNFWXGFMLGEOGM-UHFFFAOYSA-N	O=C1CCCC2=Nc3ccccc3SC12	BroadT	BRD-A14327743	BRD-A14327743-001-07-5	InterBioScreen Ltd.	STOCK1S-39374			O=C1CCCC2=Nc3ccccc3SC12	InChI=1S/C12H11NOS/c14-10-6-3-5-9-12(10)15-11-7-2-1-4-8(11)13-9/h1-2,4,7,12H,3,5-6H2	ZNFWXGFMLGEOGM-UHFFFAOYSA-N	217.056134672							109076
AC1NU0KZ	LSM-43879	SID24803316, BRD-K48425246	5415540	InChI=1S/C11H9N3O4S/c1-13-10(16)7(12-11(13)19)4-6-2-3-9(15)8(5-6)14(17)18/h2-5,15H,1H3,(H,12,19)/b7-4-	XQSADVAZOQSCQV-DAXSKMNVSA-N	CN1C(=S)N\C(=C/c2ccc(O)c(c2)[N+](=O)[O-])\C1=O	BroadT	BRD-K48425246	BRD-K48425246-001-06-9	ChemBridge Corporation	6588287			CN1C(=S)N\C(=C/c2ccc(O)c(c2)[N+]([O-])=O)C1=O	InChI=1S/C11H9N3O4S/c1-13-10(16)7(12-11(13)19)4-6-2-3-9(15)8(5-6)14(17)18/h2-5,15H,1H3,(H,12,19)/b7-4-	XQSADVAZOQSCQV-DAXSKMNVSA-N	279.031376488							
AC1LWSKQ	LSM-20476	BRD-K37245233	1737771	InChI=1S/C21H17N3O7S/c1-30-19-11-10-15(12-20(19)31-32(28,29)18-8-3-2-4-9-18)14-22-23-21(25)16-6-5-7-17(13-16)24(26)27/h2-14H,1H3,(H,23,25)	BDPPMYZEYLKWLL-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)c2cccc(c2)[N+](=O)[O-])cc1OS(=O)(=O)c3ccccc3	BroadT	BRD-K37245233	BRD-K37245233-001-05-1	Specs	AH-487/40686918			COc1ccc(C=NNC(=O)c2cccc(c2)[N+]([O-])=O)cc1OS(=O)(=O)c1ccccc1	InChI=1S/C21H17N3O7S/c1-30-19-11-10-15(12-20(19)31-32(28,29)18-8-3-2-4-9-18)14-22-23-21(25)16-6-5-7-17(13-16)24(26)27/h2-14H,1H3,(H,23,25)	BDPPMYZEYLKWLL-UHFFFAOYSA-N	455.078720604							109078
MLS001150053	LSM-20477	SID49823159, BRD-K80707264	24818411	InChI=1S/C26H22ClN3O6/c1-15-21(13-25(32)28-14-17-11-19(30(34)35)7-10-24(17)31)22-12-20(36-2)8-9-23(22)29(15)26(33)16-3-5-18(27)6-4-16/h3-12,31H,13-14H2,1-2H3,(H,28,32)	TWKARRBOKOIBHF-UHFFFAOYSA-N	COc1ccc2c(c1)c(CC(=O)NCc3cc(ccc3O)[N+](=O)[O-])c(C)n2C(=O)c4ccc(Cl)cc4	BroadT	BRD-K80707264	BRD-K80707264-001-06-6	UkrOrgSynthesis Ltd.	PB-13612350			COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)NCc3cc(ccc3O)[N+]([O-])=O)c2c1	InChI=1S/C26H22ClN3O6/c1-15-21(13-25(32)28-14-17-11-19(30(34)35)7-10-24(17)31)22-12-20(36-2)8-9-23(22)29(15)26(33)16-3-5-18(27)6-4-16/h3-12,31H,13-14H2,1-2H3,(H,28,32)	TWKARRBOKOIBHF-UHFFFAOYSA-N	507.119713164							109079
ST50265595	LSM-20478	SID848215, BRD-K96334937	650642	InChI=1S/C12H10N2S/c1-8(2)9(7-13)12-14-10-5-3-4-6-11(10)15-12/h3-6H,1-2H3	LFRAFAQWIPZCRG-UHFFFAOYSA-N	CC(=C(C#N)c1nc2ccccc2s1)C	BroadT	BRD-K96334937	BRD-K96334937-001-05-0	Asinex Ltd.	BAS 02626949			CC(C)=C(C#N)c1nc2ccccc2s1	InChI=1S/C12H10N2S/c1-8(2)9(7-13)12-14-10-5-3-4-6-11(10)15-12/h3-6H,1-2H3	LFRAFAQWIPZCRG-UHFFFAOYSA-N	214.05646903							109080
MLS000850453	LSM-20479	SID26726561, BRD-K85486823	2815170	InChI=1S/C17H13NO6S/c19-13(11-5-6-14-15(9-11)24-8-7-23-14)10-18-17(20)12-3-1-2-4-16(12)25(18,21)22/h1-6,9H,7-8,10H2	RLZFUGVEEJGLAF-UHFFFAOYSA-N	O=C(CN1C(=O)c2ccccc2S1(=O)=O)c3ccc4OCCOc4c3	BroadT	BRD-K85486823	BRD-K85486823-001-08-2	Maybridge	HTS 10021			O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccc2OCCOc2c1	InChI=1S/C17H13NO6S/c19-13(11-5-6-14-15(9-11)24-8-7-23-14)10-18-17(20)12-3-1-2-4-16(12)25(18,21)22/h1-6,9H,7-8,10H2	RLZFUGVEEJGLAF-UHFFFAOYSA-N	359.046357836							109081
MLS000552640	LSM-20480	SID14730432, BRD-K94898720	3767937	InChI=1S/C25H23ClN4OS/c26-18-3-1-17(2-4-18)22-19(11-27)23(29)30-24(20(22)12-28)32-13-21(31)25-8-14-5-15(9-25)7-16(6-14)10-25/h1-4,14-16H,5-10,13H2,(H2,29,30)	YSPNDOLGAADMRD-UHFFFAOYSA-N	Nc1nc(SCC(=O)C23CC4CC(CC(C4)C2)C3)c(C#N)c(c5ccc(Cl)cc5)c1C#N	BroadT	BRD-K94898720	BRD-K94898720-001-05-7	InterBioScreen Ltd.	STOCK1S-41593			Nc1nc(SCC(=O)C23CC4CC(CC(C4)C2)C3)c(C#N)c(-c2ccc(Cl)cc2)c1C#N	InChI=1S/C25H23ClN4OS/c26-18-3-1-17(2-4-18)22-19(11-27)23(29)30-24(20(22)12-28)32-13-21(31)25-8-14-5-15(9-25)7-16(6-14)10-25/h1-4,14-16H,5-10,13H2,(H2,29,30)	YSPNDOLGAADMRD-UHFFFAOYSA-N	462.128109796							109082
ST50330252	LSM-20481	SID24795137, BRD-K70129728	2967628	InChI=1S/C15H13ClN2S/c1-11-3-2-4-15-17-13(9-18(11)15)10-19-14-7-5-12(16)6-8-14/h2-9H,10H2,1H3	LCWVNAWOVHXFSG-UHFFFAOYSA-N	Cc1cccc2nc(CSc3ccc(Cl)cc3)cn12	BroadT	BRD-K70129728	BRD-K70129728-001-05-7	ChemBridge Corporation	7932235			Cc1cccc2nc(CSc3ccc(Cl)cc3)cn12	InChI=1S/C15H13ClN2S/c1-11-3-2-4-15-17-13(9-18(11)15)10-19-14-7-5-12(16)6-8-14/h2-9H,10H2,1H3	LCWVNAWOVHXFSG-UHFFFAOYSA-N	288.048796836							109083
SMR000064027	LSM-20482	SID26670405, SID3714933, BRD-K71112571	2999017	InChI=1S/C28H28N4O4/c1-34-24-16-19(17-25(35-2)27(24)36-3)23-18-21(20-8-4-5-9-22(20)30-23)28(33)32-14-12-31(13-15-32)26-10-6-7-11-29-26/h4-11,16-18H,12-15H2,1-3H3	KYEGRIRKYLGVNS-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)c2cc(C(=O)N3CCN(CC3)c4ccccn4)c5ccccc5n2	BroadT	BRD-K71112571	BRD-K71112571-001-05-0	Enamine Ltd.	T5260679			COc1cc(cc(OC)c1OC)-c1cc(C(=O)N2CCN(CC2)c2ccccn2)c2ccccc2n1	InChI=1S/C28H28N4O4/c1-34-24-16-19(17-25(35-2)27(24)36-3)23-18-21(20-8-4-5-9-22(20)30-23)28(33)32-14-12-31(13-15-32)26-10-6-7-11-29-26/h4-11,16-18H,12-15H2,1-3H3	KYEGRIRKYLGVNS-UHFFFAOYSA-N	484.211055416							109084
ZINC00614622	LSM-20483	SID4263585, BRD-K90715098	973874	InChI=1S/C14H14N2O2/c17-14(16-8-4-5-9-16)12-10-13(18-15-12)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2	JDBDMIPWPHEKEQ-UHFFFAOYSA-N	O=C(N1CCCC1)c2cc(on2)c3ccccc3	BroadT	BRD-K90715098	BRD-K90715098-001-06-9	ChemBridge Corporation	7905058			O=C(N1CCCC1)c1cc(on1)-c1ccccc1	InChI=1S/C14H14N2O2/c17-14(16-8-4-5-9-16)12-10-13(18-15-12)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2	JDBDMIPWPHEKEQ-UHFFFAOYSA-N	242.105527708							109085
AC1M2SGK	LSM-43880	SID24785995, BRD-K48189030	2175336	InChI=1S/C20H14N2O3/c23-19(24)11-10-15-13-22(16-7-2-1-3-8-16)21-20(15)18-12-14-6-4-5-9-17(14)25-18/h1-13H,(H,23,24)/b11-10-	RPBVHEVTQXVWDL-KHPPLWFESA-N	OC(=O)\C=C/c1cn(nc1c2oc3ccccc3c2)c4ccccc4	BroadT	BRD-K48189030	BRD-K48189030-001-05-3	ChemBridge Corporation	7134583			OC(=O)\C=C/c1cn(nc1-c1cc2ccccc2o1)-c1ccccc1	InChI=1S/C20H14N2O3/c23-19(24)11-10-15-13-22(16-7-2-1-3-8-16)21-20(15)18-12-14-6-4-5-9-17(14)25-18/h1-13H,(H,23,24)/b11-10-	RPBVHEVTQXVWDL-KHPPLWFESA-N	330.100442328							
2-Methoxyethyl 6-amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate	LSM-20485	SID7975851, BRD-A14722744	2864862	InChI=1S/C18H18N2O6/c1-10-15(18(21)23-6-5-22-2)16(12(8-19)17(20)26-10)11-3-4-13-14(7-11)25-9-24-13/h3-4,7,16H,5-6,9,20H2,1-2H3	JXYHCJMZBZTZGS-UHFFFAOYSA-N	COCCOC(=O)C1=C(C)OC(=C(C#N)C1c2ccc3OCOc3c2)N	BroadT	BRD-A14722744	BRD-A14722744-001-05-0	ChemBridge Corporation	5725952			COCCOC(=O)C1=C(C)OC(N)=C(C#N)C1c1ccc2OCOc2c1	InChI=1S/C18H18N2O6/c1-10-15(18(21)23-6-5-22-2)16(12(8-19)17(20)26-10)11-3-4-13-14(7-11)25-9-24-13/h3-4,7,16H,5-6,9,20H2,1-2H3	JXYHCJMZBZTZGS-UHFFFAOYSA-N	358.116486316							109087
AG-670/40727668	LSM-20486	SID22412532, BRD-K08549180	1718149	InChI=1S/C18H21N3O3S/c1-2-3-4-7-16(22)21-18(25)20-14-10-8-13(9-11-14)19-17(23)15-6-5-12-24-15/h5-6,8-12H,2-4,7H2,1H3,(H,19,23)(H2,20,21,22,25)	CMDIDMXYVRKNLT-UHFFFAOYSA-N	CCCCCC(=O)NC(=S)Nc1ccc(NC(=O)c2occc2)cc1	BroadT	BRD-K08549180	BRD-K08549180-001-05-4	Specs	AG-670/40727668			CCCCCC(=O)NC(=S)Nc1ccc(NC(=O)c2ccco2)cc1	InChI=1S/C18H21N3O3S/c1-2-3-4-7-16(22)21-18(25)20-14-10-8-13(9-11-14)19-17(23)15-6-5-12-24-15/h5-6,8-12H,2-4,7H2,1H3,(H,19,23)(H2,20,21,22,25)	CMDIDMXYVRKNLT-UHFFFAOYSA-N	359.130362252							109088
AF-936/31271054	LSM-20487	SID17414403, BRD-K52453518	830655	InChI=1S/C19H17N3/c1-12-4-7-15(8-5-12)22-11-20-16-9-6-13(2)19-18(16)17(22)10-14(3)21-19/h4-11H,1-3H3	AKUBAYRXIKBKMD-UHFFFAOYSA-N	Cc1ccc(cc1)N2C=Nc3ccc(C)c4nc(C)cc2c34	BroadT	BRD-K52453518	BRD-K52453518-001-06-5	ChemBridge Corporation	5787453			Cc1ccc(cc1)-n1cnc2ccc(C)c3nc(C)cc1c23	InChI=1S/C19H17N3/c1-12-4-7-15(8-5-12)22-11-20-16-9-6-13(2)19-18(16)17(22)10-14(3)21-19/h4-11H,1-3H3	AKUBAYRXIKBKMD-UHFFFAOYSA-N	287.142247574							109089
SMR000033569	LSM-20488	SID4243279, BRD-K02998455	3238022	InChI=1S/C21H17N3O4/c1-27-18-11-5-4-10-17(18)24-21(26)16-9-3-2-8-15(16)19(23-24)20(25)22-13-14-7-6-12-28-14/h2-12H,13H2,1H3,(H,22,25)	BFAMULUPCYNQRW-UHFFFAOYSA-N	COc1ccccc1N2N=C(C(=O)NCc3occc3)c4ccccc4C2=O	BroadT	BRD-K02998455	BRD-K02998455-001-04-0	ChemDiv Inc.	K979-0653			COc1ccccc1-n1nc(C(=O)NCc2ccco2)c2ccccc2c1=O	InChI=1S/C21H17N3O4/c1-27-18-11-5-4-10-17(18)24-21(26)16-9-3-2-8-15(16)19(23-24)20(25)22-13-14-7-6-12-28-14/h2-12H,13H2,1H3,(H,22,25)	BFAMULUPCYNQRW-UHFFFAOYSA-N	375.121906054							109090
MLS000074637	LSM-20489	SID850470, BRD-K17974627	652991	InChI=1S/C15H14N4OS2/c1-2-9-19(14(20)12-4-3-10-21-12)15-18-17-13(22-15)11-5-7-16-8-6-11/h3-8,10H,2,9H2,1H3	ZSJZMIVNNZUWPH-UHFFFAOYSA-N	CCCN(C(=O)c1cccs1)c2nnc(s2)c3ccncc3	BroadT	BRD-K17974627	BRD-K17974627-001-05-4	Asinex Ltd.	ASN 05671803			CCCN(C(=O)c1cccs1)c1nnc(s1)-c1ccncc1	InChI=1S/C15H14N4OS2/c1-2-9-19(14(20)12-4-3-10-21-12)15-18-17-13(22-15)11-5-7-16-8-6-11/h3-8,10H,2,9H2,1H3	ZSJZMIVNNZUWPH-UHFFFAOYSA-N	330.060902488							109091
MLS001175478	LSM-20490	SID49676049, BRD-A03608603	16278296	InChI=1S/C16H16N4O3S/c1-9-10(2)24-16-14(9)15(18-8-19-16)17-7-13(21)11-3-5-12(6-4-11)20(22)23/h3-6,8,13,21H,7H2,1-2H3,(H,17,18,19)	AXWSXUZKVHSKRB-UHFFFAOYSA-N	Cc1sc2ncnc(NCC(O)c3ccc(cc3)[N+](=O)[O-])c2c1C	BroadT	BRD-A03608603	BRD-A03608603-001-06-2	Enamine Ltd.	T5507952			Cc1sc2ncnc(NCC(O)c3ccc(cc3)[N+]([O-])=O)c2c1C	InChI=1S/C16H16N4O3S/c1-9-10(2)24-16-14(9)15(18-8-19-16)17-7-13(21)11-3-5-12(6-4-11)20(22)23/h3-6,8,13,21H,7H2,1-2H3,(H,17,18,19)	AXWSXUZKVHSKRB-UHFFFAOYSA-N	344.094311102							109092
AC1NJOYN	LSM-20491	SID22401704, BRD-A75787575	4875468	InChI=1S/C20H17BrN2O4/c1-12(19(25)13-6-8-14(21)9-7-13)27-18(24)11-10-17-22-16-5-3-2-4-15(16)20(26)23-17/h2-9,12H,10-11H2,1H3,(H,22,23,26)	VWRPHYLRDNHSJG-UHFFFAOYSA-N	CC(OC(=O)CCc1nc(O)c2ccccc2n1)C(=O)c3ccc(Br)cc3	BroadT	BRD-A75787575	BRD-A75787575-001-05-3	Enamine Ltd.	T5294525			CC(OC(=O)CCc1nc(O)c2ccccc2n1)C(=O)c1ccc(Br)cc1	InChI=1S/C20H17BrN2O4/c1-12(19(25)13-6-8-14(21)9-7-13)27-18(24)11-10-17-22-16-5-3-2-4-15(16)20(26)23-17/h2-9,12H,10-11H2,1H3,(H,22,23,26)	VWRPHYLRDNHSJG-UHFFFAOYSA-N	428.037169644							109093
MLS000778414	LSM-43881	SID26725864, BRD-K05770968	1990677	InChI=1S/C21H15N3O4/c25-19-18(22-21(28)24(19)16-5-2-1-3-6-16)13-17-7-4-12-23(17)15-10-8-14(9-11-15)20(26)27/h1-13H,(H,22,28)(H,26,27)/b18-13+	SSHMKHPXXGTLGA-QGOAFFKASA-N	OC(=O)c1ccc(cc1)n2cccc2\C=C/3\NC(=O)N(C3=O)c4ccccc4	BroadT	BRD-K05770968	BRD-K05770968-001-06-5	InterBioScreen Ltd.	STOCK4S-02219			OC(=O)c1ccc(cc1)-n1cccc1\C=C1\NC(=O)N(C1=O)c1ccccc1	InChI=1S/C21H15N3O4/c25-19-18(22-21(28)24(19)16-5-2-1-3-6-16)13-17-7-4-12-23(17)15-10-8-14(9-11-15)20(26)27/h1-13H,(H,22,28)(H,26,27)/b18-13+	SSHMKHPXXGTLGA-QGOAFFKASA-N	373.10625599							
MLS000072898	LSM-20493	SID843725, BRD-K51579239	646027	InChI=1S/C27H30N6O3/c1-2-18-7-9-23-20(11-18)13-21(27(34)28-23)15-32(14-19-8-10-24-25(12-19)36-17-35-24)16-26-29-30-31-33(26)22-5-3-4-6-22/h7-13,22H,2-6,14-17H2,1H3,(H,28,34)	QHZVBMXEUDRGPR-UHFFFAOYSA-N	CCc1ccc2nc(O)c(CN(Cc3ccc4OCOc4c3)Cc5nnnn5C6CCCC6)cc2c1	BroadT	BRD-K51579239	BRD-K51579239-001-05-8	Asinex Ltd.	ASN 04369131			CCc1ccc2nc(O)c(CN(Cc3nnnn3C3CCCC3)Cc3ccc4OCOc4c3)cc2c1	InChI=1S/C27H30N6O3/c1-2-18-7-9-23-20(11-18)13-21(27(34)28-23)15-32(14-19-8-10-24-25(12-19)36-17-35-24)16-26-29-30-31-33(26)22-5-3-4-6-22/h7-13,22H,2-6,14-17H2,1H3,(H,28,34)	QHZVBMXEUDRGPR-UHFFFAOYSA-N	486.23793888							109095
SMR000204082	LSM-43882	SID17510283, BRD-K07606823	12005157	InChI=1S/C23H20N4O4S/c1-15-12-20(26-31-15)25-21(28)14-32-23-24-19(13-16-8-10-18(30-2)11-9-16)22(29)27(23)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3,(H,25,26,28)/b19-13+	LYBGHJWHZSMJAA-CPNJWEJPSA-N	COc1ccc(\C=C/2\N=C(SCC(=O)Nc3cc(C)on3)N(C2=O)c4ccccc4)cc1	BroadT	BRD-K07606823	BRD-K07606823-001-04-9	ChemDiv Inc.	5183-0281			COc1ccc(\C=C2\N=C(SCC(=O)Nc3cc(C)on3)N(C2=O)c2ccccc2)cc1	InChI=1S/C23H20N4O4S/c1-15-12-20(26-31-15)25-21(28)14-32-23-24-19(13-16-8-10-18(30-2)11-9-16)22(29)27(23)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3,(H,25,26,28)/b19-13+	LYBGHJWHZSMJAA-CPNJWEJPSA-N	448.12052585							
MLS000091453	LSM-20495	SID4245016, BRD-K67777588	3239540	InChI=1S/C20H22N2O3S/c1-16-20(17(2)25-21-16)26(23,24)22(15-19-11-7-4-8-12-19)14-13-18-9-5-3-6-10-18/h3-12H,13-15H2,1-2H3	AGBLCCFQXJWYBS-UHFFFAOYSA-N	Cc1onc(C)c1S(=O)(=O)N(CCc2ccccc2)Cc3ccccc3	BroadT	BRD-K67777588	BRD-K67777588-001-06-5	ChemDiv Inc.	C324-1333			Cc1noc(C)c1S(=O)(=O)N(CCc1ccccc1)Cc1ccccc1	InChI=1S/C20H22N2O3S/c1-16-20(17(2)25-21-16)26(23,24)22(15-19-11-7-4-8-12-19)14-13-18-9-5-3-6-10-18/h3-12H,13-15H2,1-2H3	AGBLCCFQXJWYBS-UHFFFAOYSA-N	370.135113274							109097
ASN 05555956	LSM-15307	BRD-A07656007	647521	InChI=1S/C21H31FN6/c1-2-20(27-14-12-26(13-15-27)19-6-4-3-5-7-19)21-23-24-25-28(21)16-17-8-10-18(22)11-9-17/h8-11,19-20H,2-7,12-16H2,1H3	SYXLOOHCNOJAFE-UHFFFAOYSA-N	CCC(N1CCN(CC1)C2CCCCC2)c3nnnn3Cc4ccc(F)cc4	BroadT	BRD-A07656007	BRD-A07656007-003-05-7	Asinex Ltd.	ASN 05555956		Cl	CCC(N1CCN(CC1)C1CCCCC1)c1nnnn1Cc1ccc(F)cc1.Cl	InChI=1S/C21H31FN6.ClH/c1-2-20(27-14-12-26(13-15-27)19-6-4-3-5-7-19)21-23-24-25-28(21)16-17-8-10-18(22)11-9-17;/h8-11,19-20H,2-7,12-16H2,1H3;1H	FOSOEANWABQAQG-UHFFFAOYSA-N	386.259423252							103954, 103954
SMR000095251	LSM-20496	SID7966022, BRD-A82823445	5307964	InChI=1S/C21H18ClN3O2/c1-2-27-16-10-8-15(9-11-16)24-20-17-5-3-4-6-18(17)21(26)25(20)19-12-7-14(22)13-23-19/h3-13,20,24H,2H2,1H3	OKOFZZBMDCWCAX-UHFFFAOYSA-N	CCOc1ccc(NC2N(C(=O)c3ccccc23)c4ccc(Cl)cn4)cc1	BroadT	BRD-A82823445	BRD-A82823445-001-05-5	ChemDiv Inc.	C612-0441			CCOc1ccc(NC2N(C(=O)c3ccccc23)c2ccc(Cl)cn2)cc1	InChI=1S/C21H18ClN3O2/c1-2-27-16-10-8-15(9-11-16)24-20-17-5-3-4-6-18(17)21(26)25(20)19-12-7-14(22)13-23-19/h3-13,20,24H,2H2,1H3	OKOFZZBMDCWCAX-UHFFFAOYSA-N	379.108754556							109098
6-Amino-4-(2,3-dimethoxyphenyl)-3-methyl-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile	LSM-20497	SID845933, BRD-A57500436	648301	InChI=1S/C22H20N4O3/c1-13-18-19(15-10-7-11-17(27-2)20(15)28-3)16(12-23)21(24)29-22(18)26(25-13)14-8-5-4-6-9-14/h4-11,19H,24H2,1-3H3	NMWKXTVRWVZUGE-UHFFFAOYSA-N	COc1cccc(C2C(=C(N)Oc3c2c(C)nn3c4ccccc4)C#N)c1OC	BroadT	BRD-A57500436	BRD-A57500436-001-06-9	Asinex Ltd.	BAS 00641243			COc1cccc(C2c3c(C)nn(c3OC(N)=C2C#N)-c2ccccc2)c1OC	InChI=1S/C22H20N4O3/c1-13-18-19(15-10-7-11-17(27-2)20(15)28-3)16(12-23)21(24)29-22(18)26(25-13)14-8-5-4-6-9-14/h4-11,19H,24H2,1-3H3	NMWKXTVRWVZUGE-UHFFFAOYSA-N	388.15354054							109099
3,8-Dibromo-7-hydroxy-4-methyl-2H-chromen-2-one	LSM-20498	SID24823436, BRD-K66622718	5795340	InChI=1S/C10H6Br2O3/c1-4-5-2-3-6(13)8(12)9(5)15-10(14)7(4)11/h2-3,13H,1H3	MSOLROYRAHCJNK-UHFFFAOYSA-N	CC1=C(Br)C(=O)Oc2c(Br)c(O)ccc12	BroadT	BRD-K66622718	BRD-K66622718-001-06-7	ChemDiv Inc.	K815-0059			Cc1c(Br)c(=O)oc2c(Br)c(O)ccc12	InChI=1S/C10H6Br2O3/c1-4-5-2-3-6(13)8(12)9(5)15-10(14)7(4)11/h2-3,13H,1H3	MSOLROYRAHCJNK-UHFFFAOYSA-N	331.868369252							109100
SMR000201082	LSM-20499	SID17506531, BRD-K44041571	1245647	InChI=1S/C19H14Cl2N2O2S/c20-12-6-7-13(15(21)9-12)14-10-26-19(17(14)18(22)25)23-16(24)8-11-4-2-1-3-5-11/h1-7,9-10H,8H2,(H2,22,25)(H,23,24)	XMGIGDNDRCSVQI-UHFFFAOYSA-N	NC(=O)c1c(NC(=O)Cc2ccccc2)scc1c3ccc(Cl)cc3Cl	BroadT	BRD-K44041571	BRD-K44041571-001-06-3	ChemBridge Corporation	7945523			NC(=O)c1c(NC(=O)Cc2ccccc2)scc1-c1ccc(Cl)cc1Cl	InChI=1S/C19H14Cl2N2O2S/c20-12-6-7-13(15(21)9-12)14-10-26-19(17(14)18(22)25)23-16(24)8-11-4-2-1-3-5-11/h1-7,9-10H,8H2,(H2,22,25)(H,23,24)	XMGIGDNDRCSVQI-UHFFFAOYSA-N	404.015303818							109101
AP-263/40971815	LSM-20500	SID17407508, BRD-K14784508	1077610	InChI=1S/C20H17NO3S/c22-17(18-10-5-11-25-18)12-24-20(23)19-13-6-1-3-8-15(13)21-16-9-4-2-7-14(16)19/h1,3,5-6,8,10-11H,2,4,7,9,12H2	ATSHBJSURJRITP-UHFFFAOYSA-N	O=C(COC(=O)c1c2CCCCc2nc3ccccc13)c4cccs4	BroadT	BRD-K14784508	BRD-K14784508-001-05-4	Asinex Ltd.	BAS 04999731			O=C(COC(=O)c1c2CCCCc2nc2ccccc12)c1cccs1	InChI=1S/C20H17NO3S/c22-17(18-10-5-11-25-18)12-24-20(23)19-13-6-1-3-8-15(13)21-16-9-4-2-7-14(16)19/h1,3,5-6,8,10-11H,2,4,7,9,12H2	ATSHBJSURJRITP-UHFFFAOYSA-N	351.092914104							109102
T6479793	LSM-20501	SID7978090, BRD-K88086149	874496	InChI=1S/C16H18N2O/c1-12(2)16(19)18-15-10-8-14(9-11-15)17-13-6-4-3-5-7-13/h3-12,17H,1-2H3,(H,18,19)	YBTHMBDFFKSYMV-UHFFFAOYSA-N	CC(C)C(=O)Nc1ccc(Nc2ccccc2)cc1	BroadT	BRD-K88086149	BRD-K88086149-001-06-8	ChemBridge Corporation	6125650			CC(C)C(=O)Nc1ccc(Nc2ccccc2)cc1	InChI=1S/C16H18N2O/c1-12(2)16(19)18-15-10-8-14(9-11-15)17-13-6-4-3-5-7-13/h3-12,17H,1-2H3,(H,18,19)	YBTHMBDFFKSYMV-UHFFFAOYSA-N	254.141913216							109103
AC1N5KMS	LSM-20502	BRD-K00255889	4196594	InChI=1S/C18H21N3S/c1-14-8-10-17(11-9-14)15(2)20-21-18(22)19-13-12-16-6-4-3-5-7-16/h3-11H,12-13H2,1-2H3,(H2,19,21,22)	XVYRUUGWAWBZML-UHFFFAOYSA-N	CC(=NN=C(S)NCCc1ccccc1)c2ccc(C)cc2	BroadT	BRD-K00255889	BRD-K00255889-001-05-0	Specs	AF-399/15029020			CC(=NN=C(S)NCCc1ccccc1)c1ccc(C)cc1	InChI=1S/C18H21N3S/c1-14-8-10-17(11-9-14)15(2)20-21-18(22)19-13-12-16-6-4-3-5-7-16/h3-11H,12-13H2,1-2H3,(H2,19,21,22)	XVYRUUGWAWBZML-UHFFFAOYSA-N	311.145618392							109104
SMR000067748	LSM-20503	SID3712703, BRD-K02239389	1459738	InChI=1S/C15H15N3O/c1-10-8-17-14(9-16-10)15(19)18-13-6-5-11-3-2-4-12(11)7-13/h5-9H,2-4H2,1H3,(H,18,19)	KSUSJKBOMCJPCS-UHFFFAOYSA-N	Cc1cnc(cn1)C(=O)Nc2ccc3CCCc3c2	BroadT	BRD-K02239389	BRD-K02239389-001-05-7	Enamine Ltd.	T5277587			Cc1cnc(cn1)C(=O)Nc1ccc2CCCc2c1	InChI=1S/C15H15N3O/c1-10-8-17-14(9-16-10)15(19)18-13-6-5-11-3-2-4-12(11)7-13/h5-9H,2-4H2,1H3,(H,18,19)	KSUSJKBOMCJPCS-UHFFFAOYSA-N	253.12151213							109105
N-[2-(4-Tert-butylphenoxy)ethyl]-2-(4-fluorophenyl)acetamide	LSM-20504	SID22416000, BRD-K50920343	2292474	InChI=1S/C20H24FNO2/c1-20(2,3)16-6-10-18(11-7-16)24-13-12-22-19(23)14-15-4-8-17(21)9-5-15/h4-11H,12-14H2,1-3H3,(H,22,23)	AMWLWLVDKVXLFK-UHFFFAOYSA-N	CC(C)(C)c1ccc(OCCNC(=O)Cc2ccc(F)cc2)cc1	BroadT	BRD-K50920343	BRD-K50920343-001-05-8	ChemBridge Corporation	6896487			CC(C)(C)c1ccc(OCCNC(=O)Cc2ccc(F)cc2)cc1	InChI=1S/C20H24FNO2/c1-20(2,3)16-6-10-18(11-7-16)24-13-12-22-19(23)14-15-4-8-17(21)9-5-15/h4-11H,12-14H2,1-3H3,(H,22,23)	AMWLWLVDKVXLFK-UHFFFAOYSA-N	329.179107218							109106
MLS000110189	LSM-20505	SID7977412, BRD-K93720444	846277	InChI=1S/C16H17N3O4S/c1-3-23-15(22)11-4-6-12(7-5-11)18-14(21)9-24-16-17-10(2)8-13(20)19-16/h4-8H,3,9H2,1-2H3,(H,18,21)(H,17,19,20)	MPTMBWCEQLUCHP-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)CSc2nc(C)cc(O)n2)cc1	BroadT	BRD-K93720444	BRD-K93720444-001-05-9	ChemBridge Corporation	6125968			CCOC(=O)c1ccc(NC(=O)CSc2nc(C)cc(O)n2)cc1	InChI=1S/C16H17N3O4S/c1-3-23-15(22)11-4-6-12(7-5-11)18-14(21)9-24-16-17-10(2)8-13(20)19-16/h4-8H,3,9H2,1-2H3,(H,18,21)(H,17,19,20)	MPTMBWCEQLUCHP-UHFFFAOYSA-N	347.093976744							109107
SMR000005598	LSM-20506	SID848690, BRD-K75691692	651141	InChI=1S/C19H21N3O3/c1-3-25-19(23)13-6-8-22(9-7-13)18-15(12-20)10-14-4-5-16(24-2)11-17(14)21-18/h4-5,10-11,13H,3,6-9H2,1-2H3	NMVJGIGSVTYBKH-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC1)c2nc3cc(OC)ccc3cc2C#N	BroadT	BRD-K75691692	BRD-K75691692-001-06-1	Asinex Ltd.	ASN 05815345			CCOC(=O)C1CCN(CC1)c1nc2cc(OC)ccc2cc1C#N	InChI=1S/C19H21N3O3/c1-3-25-19(23)13-6-8-22(9-7-13)18-15(12-20)10-14-4-5-16(24-2)11-17(14)21-18/h4-5,10-11,13H,3,6-9H2,1-2H3	NMVJGIGSVTYBKH-UHFFFAOYSA-N	339.158291562							109108
2-[(2-Methoxyphenoxy)methyl]-1H-benzimidazole	LSM-20507	SID4261167, BRD-K10119374	752039	InChI=1S/C15H14N2O2/c1-18-13-8-4-5-9-14(13)19-10-15-16-11-6-2-3-7-12(11)17-15/h2-9H,10H2,1H3,(H,16,17)	MWKOUPJMMYDGLH-UHFFFAOYSA-N	COc1ccccc1OCc2nc3ccccc3[nH]2	BroadT	BRD-K10119374	BRD-K10119374-001-05-8	ChemBridge Corporation	7361573			COc1ccccc1OCc1nc2ccccc2[nH]1	InChI=1S/C15H14N2O2/c1-18-13-8-4-5-9-14(13)19-10-15-16-11-6-2-3-7-12(11)17-15/h2-9H,10H2,1H3,(H,16,17)	MWKOUPJMMYDGLH-UHFFFAOYSA-N	254.105527708							109109
AK-968/37032063	LSM-20508	SID22412707, BRD-K12719718	2836811	InChI=1S/C22H20N2O4/c1-27-17-11-7-15(8-12-17)21(16-9-13-18(28-2)14-10-16)24-23-20-6-4-3-5-19(20)22(25)26/h3-14,23H,1-2H3,(H,25,26)	UCMMLUOVWVNVDJ-UHFFFAOYSA-N	COc1ccc(cc1)C(=NNc2ccccc2C(=O)O)c3ccc(OC)cc3	BroadT	BRD-K12719718	BRD-K12719718-001-05-8	Specs	AK-968/37032063			COc1ccc(cc1)C(=NNc1ccccc1C(O)=O)c1ccc(OC)cc1	InChI=1S/C22H20N2O4/c1-27-17-11-7-15(8-12-17)21(16-9-13-18(28-2)14-10-16)24-23-20-6-4-3-5-19(20)22(25)26/h3-14,23H,1-2H3,(H,25,26)	UCMMLUOVWVNVDJ-UHFFFAOYSA-N	376.14230714							109110
(4-Hydroxy-2-oxo-1,2-dihydro-quinolin-3-yl)-acetic acid pentyl ester	LSM-20509	SID850538, BRD-K29200634	54692912	InChI=1S/C16H19NO4/c1-2-3-6-9-21-14(18)10-12-15(19)11-7-4-5-8-13(11)17-16(12)20/h4-5,7-8H,2-3,6,9-10H2,1H3,(H2,17,19,20)	LCKMLFNQPPFLMU-UHFFFAOYSA-N	CCCCCOC(=O)Cc1c(O)nc2ccccc2c1O	BroadT	BRD-K29200634	BRD-K29200634-001-05-1	Asinex Ltd.	BAS 00505031			CCCCCOC(=O)Cc1c(O)nc2ccccc2c1O	InChI=1S/C16H19NO4/c1-2-3-6-9-21-14(18)10-12-15(19)11-7-4-5-8-13(11)17-16(12)20/h4-5,7-8H,2-3,6,9-10H2,1H3,(H2,17,19,20)	LCKMLFNQPPFLMU-UHFFFAOYSA-N	289.131408098							109111
T0505-0649	LSM-20510	SID3717324, BRD-K91489271	2329625	InChI=1S/C18H15N3O2/c1-2-8-16-15(7-1)17(19-11-13-5-3-9-22-13)21-18(16)20-12-14-6-4-10-23-14/h1-10H,11-12H2,(H,19,20,21)	DGHZEOSBRYIBME-UHFFFAOYSA-N	C(NC1=NC(=NCc2occc2)c3ccccc13)c4occc4	BroadT	BRD-K91489271	BRD-K91489271-001-05-1	Enamine Ltd.	T0505-0649			C(NC1=NC(=NCc2ccco2)c2ccccc12)c1ccco1	InChI=1S/C18H15N3O2/c1-2-8-16-15(7-1)17(19-11-13-5-3-9-22-13)21-18(16)20-12-14-6-4-10-23-14/h1-10H,11-12H2,(H,19,20,21)	DGHZEOSBRYIBME-UHFFFAOYSA-N	305.11642675							109112
MLS000521308	LSM-20511	SID14735586, BRD-K25615907	4218803	InChI=1S/C20H21ClF3N3O2/c1-29-18-5-3-2-4-17(18)27-10-8-26(9-11-27)13-19(28)25-14-6-7-16(21)15(12-14)20(22,23)24/h2-7,12H,8-11,13H2,1H3,(H,25,28)	BJGSHJCBKOQDNT-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)CC2	BroadT	BRD-K25615907	BRD-K25615907-001-05-4	ChemDiv Inc.	K940-1258			COc1ccccc1N1CCN(CC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)CC1	InChI=1S/C20H21ClF3N3O2/c1-29-18-5-3-2-4-17(18)27-10-8-26(9-11-27)13-19(28)25-14-6-7-16(21)15(12-14)20(22,23)24/h2-7,12H,8-11,13H2,1H3,(H,25,28)	BJGSHJCBKOQDNT-UHFFFAOYSA-N	427.127439252							109113
1-(2-Furoyl)benzo[cd]indol-2(1H)-one	LSM-20512	SID4262775, BRD-K08932351	2236435	InChI=1S/C16H9NO3/c18-15-11-6-1-4-10-5-2-7-12(14(10)11)17(15)16(19)13-8-3-9-20-13/h1-9H	ZRZBTHCAIRVGTE-UHFFFAOYSA-N	O=C(N1C(=O)c2cccc3cccc1c23)c4occc4	BroadT	BRD-K08932351	BRD-K08932351-001-04-8	ChemBridge Corporation	7977043			O=C(N1C(=O)c2cccc3cccc1c23)c1ccco1	InChI=1S/C16H9NO3/c18-15-11-6-1-4-10-5-2-7-12(14(10)11)17(15)16(19)13-8-3-9-20-13/h1-9H	ZRZBTHCAIRVGTE-UHFFFAOYSA-N	263.058243158							109114
AMBCB33414679	LSM-20513	SID24786252, BRD-K31941078	16189049	InChI=1S/C22H35N5O2/c1-15(2)13-18-14-20(25-24-18)22(29)27-11-7-19(8-12-27)26-9-5-16(6-10-26)21(28)23-17-3-4-17/h14-17,19H,3-13H2,1-2H3,(H,23,28)(H,24,25)	XBKJDHNYNFCGOA-UHFFFAOYSA-N	CC(C)Cc1cc([nH]n1)C(=O)N2CCC(CC2)N3CCC(CC3)C(=O)NC4CC4	BroadT	BRD-K31941078	BRD-K31941078-001-05-9	ChemBridge Corporation	33414679			CC(C)Cc1cc([nH]n1)C(=O)N1CCC(CC1)N1CCC(CC1)C(=O)NC1CC1	InChI=1S/C22H35N5O2/c1-15(2)13-18-14-20(25-24-18)22(29)27-11-7-19(8-12-27)26-9-5-16(6-10-26)21(28)23-17-3-4-17/h14-17,19H,3-13H2,1-2H3,(H,23,28)(H,24,25)	XBKJDHNYNFCGOA-UHFFFAOYSA-N	401.27907541							109115
SMR000020934	LSM-20514	SID4241415, BRD-K69285280	3236392	InChI=1S/C14H15N7O3S/c1-8(2)23-14(22)11-9(7-25-10-5-3-4-6-16-10)21(20-17-11)13-12(15)18-24-19-13/h3-6,8H,7H2,1-2H3,(H2,15,18)	BEYOQOUVIABFTO-UHFFFAOYSA-N	CC(C)OC(=O)c1nnn(c1CSc2ccccn2)c3nonc3N	BroadT	BRD-K69285280	BRD-K69285280-001-06-8	ChemDiv Inc.	8010-0847			CC(C)OC(=O)c1nnn(-c2nonc2N)c1CSc1ccccn1	InChI=1S/C14H15N7O3S/c1-8(2)23-14(22)11-9(7-25-10-5-3-4-6-16-10)21(20-17-11)13-12(15)18-24-19-13/h3-6,8H,7H2,1-2H3,(H2,15,18)	BEYOQOUVIABFTO-UHFFFAOYSA-N	361.0957081							109116
SMR000033232	LSM-20515	SID4248477, BRD-K21261696	3242546	InChI=1S/C20H20N2O2S/c1-14-18(15(2)23)11-19(16-7-4-3-5-8-16)22(14)13-20(24)21-12-17-9-6-10-25-17/h3-11H,12-13H2,1-2H3,(H,21,24)	QILRSGZKTDWJQU-UHFFFAOYSA-N	CC(=O)c1cc(c2ccccc2)n(CC(=O)NCc3cccs3)c1C	BroadT	BRD-K21261696	BRD-K21261696-001-05-6	ChemDiv Inc.	K906-2688			CC(=O)c1cc(-c2ccccc2)n(CC(=O)NCc2cccs2)c1C	InChI=1S/C20H20N2O2S/c1-14-18(15(2)23)11-19(16-7-4-3-5-8-16)22(14)13-20(24)21-12-17-9-6-10-25-17/h3-11H,12-13H2,1-2H3,(H,21,24)	QILRSGZKTDWJQU-UHFFFAOYSA-N	352.12454859							109117
N-(1,3-Benzodioxol-5-ylmethyl)-3-cyclopentyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide	LSM-20516	SID4245755, BRD-K09521040	3240191	InChI=1S/C22H21N3O5/c26-20(23-11-13-5-8-18-19(9-13)30-12-29-18)14-6-7-16-17(10-14)24-22(28)25(21(16)27)15-3-1-2-4-15/h5-10,15H,1-4,11-12H2,(H,23,26)(H,24,28)	FQQUMNHCVSJLIV-UHFFFAOYSA-N	O=C(NCc1ccc2OCOc2c1)c3ccc4C(=O)N(C5CCCC5)C(=O)Nc4c3	BroadT	BRD-K09521040	BRD-K09521040-001-06-0	ChemDiv Inc.	K221-3436			O=C(NCc1ccc2OCOc2c1)c1ccc2c(c1)[nH]c(=O)n(C1CCCC1)c2=O	InChI=1S/C22H21N3O5/c26-20(23-11-13-5-8-18-19(9-13)30-12-29-18)14-6-7-16-17(10-14)24-22(28)25(21(16)27)15-3-1-2-4-15/h5-10,15H,1-4,11-12H2,(H,23,26)(H,24,28)	FQQUMNHCVSJLIV-UHFFFAOYSA-N	407.148120802							109118
AC1MES0L	LSM-20517	SID17407564, BRD-A59442324	2883130	InChI=1S/C24H18N2O2/c27-23-21-19-15-7-1-2-8-16(15)20(18-10-4-3-9-17(18)19)22(21)24(28)26(23)13-14-6-5-11-25-12-14/h1-12,19-22H,13H2	GAMYNYOUCKVNQA-UHFFFAOYSA-N	O=C1C2C(C3c4ccccc4C2c5ccccc35)C(=O)N1Cc6cccnc6	BroadT	BRD-A59442324	BRD-A59442324-001-06-7	Asinex Ltd.	BAS 00610248			O=C1C2C(C3c4ccccc4C2c2ccccc32)C(=O)N1Cc1cccnc1	InChI=1S/C24H18N2O2/c27-23-21-19-15-7-1-2-8-16(15)20(18-10-4-3-9-17(18)19)22(21)24(28)26(23)13-14-6-5-11-25-12-14/h1-12,19-22H,13H2	GAMYNYOUCKVNQA-UHFFFAOYSA-N	366.136827836							109119
ST086869	LSM-20518	SID14727220, BRD-K24387667	3225182	InChI=1S/C24H21N3OS/c28-24(25-12-10-18-15-26-20-9-5-4-8-19(18)20)22-14-23-21(11-13-29-23)27(22)16-17-6-2-1-3-7-17/h1-9,11,13-15,26H,10,12,16H2,(H,25,28)	UMMCCSNASABNMS-UHFFFAOYSA-N	O=C(NCCc1c[nH]c2ccccc12)c3cc4sccc4n3Cc5ccccc5	BroadT	BRD-K24387667	BRD-K24387667-001-05-1	Asinex Ltd.	ASN 06914818			O=C(NCCc1c[nH]c2ccccc12)c1cc2sccc2n1Cc1ccccc1	InChI=1S/C24H21N3OS/c28-24(25-12-10-18-15-26-20-9-5-4-8-19(18)20)22-14-23-21(11-13-29-23)27(22)16-17-6-2-1-3-7-17/h1-9,11,13-15,26H,10,12,16H2,(H,25,28)	UMMCCSNASABNMS-UHFFFAOYSA-N	399.140533012							109120
CID 73887714	LSM-20519	SID7965383, BRD-A17588487	73887714	InChI=1S/C14H16N2O3/c1-3-9(2)15-14(18)11-8-13(19-16-11)10-6-4-5-7-12(10)17/h4-9,17H,3H2,1-2H3,(H,15,18)	YONUVPIHNZOGCZ-UHFFFAOYSA-N	CCC(C)NC(=O)c1cc(on1)c2ccccc2O	BroadT	BRD-A17588487	BRD-A17588487-001-05-3	ChemDiv Inc.	C226-2431			CCC(C)NC(=O)c1cc(on1)-c1ccccc1O	InChI=1S/C14H16N2O3/c1-3-9(2)15-14(18)11-8-13(19-16-11)10-6-4-5-7-12(10)17/h4-9,17H,3H2,1-2H3,(H,15,18)	YONUVPIHNZOGCZ-UHFFFAOYSA-N	260.116092392							
MLS000723967	LSM-20520	SID24782735, BRD-K02927228	16187935	InChI=1S/C29H29ClN6O/c30-22-6-5-7-23(20-22)33-12-18-36(19-13-33)29(37)26-21-32-28(25-9-2-1-8-24(25)26)35-16-14-34(15-17-35)27-10-3-4-11-31-27/h1-11,20-21H,12-19H2	JQQHQPKOGULZSL-UHFFFAOYSA-N	Clc1cccc(c1)N2CCN(CC2)C(=O)c3cnc(N4CCN(CC4)c5ccccn5)c6ccccc36	BroadT	BRD-K02927228	BRD-K02927228-001-06-0	ChemDiv Inc.	3909-9832			Clc1cccc(c1)N1CCN(CC1)C(=O)c1cnc(N2CCN(CC2)c2ccccn2)c2ccccc12	InChI=1S/C29H29ClN6O/c30-22-6-5-7-23(20-22)33-12-18-36(19-13-33)29(37)26-21-32-28(25-9-2-1-8-24(25)26)35-16-14-34(15-17-35)27-10-3-4-11-31-27/h1-11,20-21H,12-19H2	JQQHQPKOGULZSL-UHFFFAOYSA-N	512.209137318							109122
N-(2-Fluorophenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]propanamide	LSM-20521	SID4251506, BRD-K32772913	3245180	InChI=1S/C19H21F2N3O/c20-15-5-1-3-7-17(15)22-19(25)9-10-23-11-13-24(14-12-23)18-8-4-2-6-16(18)21/h1-8H,9-14H2,(H,22,25)	ZNBQFFOQYNKMNF-UHFFFAOYSA-N	Fc1ccccc1NC(=O)CCN2CCN(CC2)c3ccccc3F	BroadT	BRD-K32772913	BRD-K32772913-001-05-6	ChemDiv Inc.	K940-1520			Fc1ccccc1NC(=O)CCN1CCN(CC1)c1ccccc1F	InChI=1S/C19H21F2N3O/c20-15-5-1-3-7-17(15)22-19(25)9-10-23-11-13-24(14-12-23)18-8-4-2-6-16(18)21/h1-8H,9-14H2,(H,22,25)	ZNBQFFOQYNKMNF-UHFFFAOYSA-N	345.165268722							109123
ST037256	LSM-20522	BRD-A87353601	565752	InChI=1S/C19H14N4O4/c1-10-15-16(13(9-20)17(21)27-18(15)23-22-10)11-4-6-12(7-5-11)26-19(24)14-3-2-8-25-14/h2-8,13,16,21H,1H3,(H,22,23)	AWIGPGVAAAGGIV-UHFFFAOYSA-N	Cc1[nH]nc2OC(=N)C(C#N)C(c12)c1ccc(OC(=O)c2ccco2)cc1	BroadT	BRD-A87353601	BRD-A87353601-001-06-6	ChemDiv Inc.	8010-5452			Cc1n[nH]c2OC(N)=C(C#N)C(c12)c1ccc(OC(=O)c2ccco2)cc1	InChI=1S/C19H14N4O4/c1-10-15-16(13(9-20)17(21)27-18(15)23-22-10)11-4-6-12(7-5-11)26-19(24)14-3-2-8-25-14/h2-8,16H,21H2,1H3,(H,22,23)	YNUGWMQBQHUMLQ-UHFFFAOYSA-N	362.101504968							
SMR000156086	LSM-20523	SID17407140, BRD-K68964479	11958441	InChI=1S/C18H13ClN4O2S2/c1-10-15(27-18(20-10)23-16(24)14-3-2-8-25-14)13-9-26-17(22-13)21-12-6-4-11(19)5-7-12/h2-9H,1H3,(H,21,22)(H,20,23,24)	QKEWXZJHCYKZLR-UHFFFAOYSA-N	Cc1nc(NC(=O)c2occc2)sc1c3csc(Nc4ccc(Cl)cc4)n3	BroadT	BRD-K68964479	BRD-K68964479-001-07-8	University of California at Davis	CLY_Corr_D05			Cc1nc(NC(=O)c2ccco2)sc1-c1csc(Nc2ccc(Cl)cc2)n1	InChI=1S/C18H13ClN4O2S2/c1-10-15(27-18(20-10)23-16(24)14-3-2-8-25-14)13-9-26-17(22-13)21-12-6-4-11(19)5-7-12/h2-9H,1H3,(H,21,22)(H,20,23,24)	QKEWXZJHCYKZLR-UHFFFAOYSA-N	416.016844786							109125
SMR000127998	LSM-20524	BRD-K59144161	11957216	InChI=1S/C26H29N3O4/c1-2-33-21-14-12-20(13-15-21)29-26(32)18-10-8-17(9-11-18)16-27-22-23(25(31)24(22)30)28-19-6-4-3-5-7-19/h8-15,19,27-28H,2-7,16H2,1H3,(H,29,32)	AOYDKTYYXQGYAS-UHFFFAOYSA-N	CCOc1ccc(NC(=O)c2ccc(CNC3=C(NC4CCCCC4)C(=O)C3=O)cc2)cc1	BroadT	BRD-K59144161	BRD-K59144161-001-04-8	ChemDiv Inc.	C852-0572			CCOc1ccc(NC(=O)c2ccc(CN=c3c(O)c(O)c3=NC3CCCCC3)cc2)cc1	InChI=1S/C26H29N3O4/c1-2-33-21-14-12-20(13-15-21)29-26(32)18-10-8-17(9-11-18)16-27-22-23(25(31)24(22)30)28-19-6-4-3-5-7-19/h8-15,19,30-31H,2-7,16H2,1H3,(H,29,32)	HOFBYASVPKEFNK-UHFFFAOYSA-N	447.215806438							109126
AC1MCJ9E	LSM-20525	SID26730239, BRD-K09647230	2745117	InChI=1S/C12H10ClN3O3/c1-7-5-10(15-18-7)11(14)16-19-12(17)8-3-2-4-9(13)6-8/h2-6H,1H3,(H2,14,16)	IZXCMDLPALKTIR-UHFFFAOYSA-N	Cc1onc(c1)C(=N)NOC(=O)c2cccc(Cl)c2	BroadT	BRD-K09647230	BRD-K09647230-001-05-5	Maybridge	SPB 04135			Cc1cc(no1)C(=N)NOC(=O)c1cccc(Cl)c1	InChI=1S/C12H10ClN3O3/c1-7-5-10(15-18-7)11(14)16-19-12(17)8-3-2-4-9(13)6-8/h2-6H,1H3,(H2,14,16)	IZXCMDLPALKTIR-UHFFFAOYSA-N	279.04106892							109127
SMR000004039	LSM-20526	SID850166, SID26667481, BRD-K83726715	652678	InChI=1S/C21H20N6O4S2/c1-3-31-18(29)8-13-10-33-21(25-13)26-17(28)11-32-20-16-9-24-27(19(16)22-12-23-20)14-4-6-15(30-2)7-5-14/h4-7,9-10,12H,3,8,11H2,1-2H3,(H,25,26,28)	HGIOHVCLLQYRJR-UHFFFAOYSA-N	CCOC(=O)Cc1csc(NC(=O)CSc2ncnc3c2cnn3c4ccc(OC)cc4)n1	BroadT	BRD-K83726715	BRD-K83726715-001-05-0	Asinex Ltd.	ASN 05100451			CCOC(=O)Cc1csc(NC(=O)CSc2ncnc3n(ncc23)-c2ccc(OC)cc2)n1	InChI=1S/C21H20N6O4S2/c1-3-31-18(29)8-13-10-33-21(25-13)26-17(28)11-32-20-16-9-24-27(19(16)22-12-23-20)14-4-6-15(30-2)7-5-14/h4-7,9-10,12H,3,8,11H2,1-2H3,(H,25,26,28)	HGIOHVCLLQYRJR-UHFFFAOYSA-N	484.09874456							109128
(5-Methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-phenyl-acetonitrile	LSM-20527	SID853157, BRD-A21301884	655808	InChI=1S/C14H11N5/c1-10-7-13(19-14(18-10)16-9-17-19)12(8-15)11-5-3-2-4-6-11/h2-7,9,12H,1H3	XAIXXRRMUITDRQ-UHFFFAOYSA-N	Cc1cc(C(C#N)c2ccccc2)n3ncnc3n1	BroadT	BRD-A21301884	BRD-A21301884-001-06-2	Asinex Ltd.	ASN 09858075			Cc1cc(C(C#N)c2ccccc2)n2ncnc2n1	InChI=1S/C14H11N5/c1-10-7-13(19-14(18-10)16-9-17-19)12(8-15)11-5-3-2-4-6-11/h2-7,9,12H,1H3	XAIXXRRMUITDRQ-UHFFFAOYSA-N	249.101445402							109129
AC1LXVKH	LSM-43883	SID17511886, BRD-K14783876	1838209	InChI=1S/C23H22N6O4/c24-13-16(22(31)26-14-17-4-3-11-33-17)12-18-21(28-9-6-15(7-10-28)20(25)30)27-19-5-1-2-8-29(19)23(18)32/h1-5,8,11-12,15H,6-7,9-10,14H2,(H2,25,30)(H,26,31)/b16-12+	UARMNPWMAZWTCH-FOWTUZBSSA-N	NC(=O)C1CCN(CC1)C2=C(\C=C(/C#N)\C(=O)NCc3occc3)C(=O)N4C=CC=CC4=N2	BroadT	BRD-K14783876	BRD-K14783876-001-05-0	InterBioScreen Ltd.	STOCK3S-50661			NC(=O)C1CCN(CC1)c1nc2ccccn2c(=O)c1\C=C(/C#N)C(=O)NCc1ccco1	InChI=1S/C23H22N6O4/c24-13-16(22(31)26-14-17-4-3-11-33-17)12-18-21(28-9-6-15(7-10-28)20(25)30)27-19-5-1-2-8-29(19)23(18)32/h1-5,8,11-12,15H,6-7,9-10,14H2,(H2,25,30)(H,26,31)/b16-12+	UARMNPWMAZWTCH-FOWTUZBSSA-N	446.170253244							
SMR000097554	LSM-20529	SID7967038, BRD-K53867597	5308586	InChI=1S/C21H22N2O5S/c24-20(6-3-7-21(25)26)22-12-10-16-14-17(8-9-18(16)22)29(27,28)23-13-11-15-4-1-2-5-19(15)23/h1-2,4-5,8-9,14H,3,6-7,10-13H2,(H,25,26)	AWYXXQVWOOKQND-UHFFFAOYSA-N	OC(=O)CCCC(=O)N1CCc2cc(ccc12)S(=O)(=O)N3CCc4ccccc34	BroadT	BRD-K53867597	BRD-K53867597-001-04-4	ChemDiv Inc.	C515-0999			OC(=O)CCCC(=O)N1CCc2cc(ccc12)S(=O)(=O)N1CCc2ccccc12	InChI=1S/C21H22N2O5S/c24-20(6-3-7-21(25)26)22-12-10-16-14-17(8-9-18(16)22)29(27,28)23-13-11-15-4-1-2-5-19(15)23/h1-2,4-5,8-9,14H,3,6-7,10-13H2,(H,25,26)	AWYXXQVWOOKQND-UHFFFAOYSA-N	414.124942514							109131
MLS001004711	LSM-43618	BRD-K95035089	2319380	InChI=1S/C14H19BrN2O3/c15-13-4-2-12(20-13)3-5-14(18)16-6-1-7-17-8-10-19-11-9-17/h2-5H,1,6-11H2,(H,16,18)/b5-3+	XLUVCBOJTSJKTB-HWKANZROSA-N	Brc1oc(\C=C\C(=O)NCCCN2CCOCC2)cc1	BroadT	BRD-K95035089	BRD-K95035089-003-06-4	Enamine Ltd.	T0503-6604		Cl	Brc1ccc(o1)\C=C\C(=O)NCCCN1CCOCC1.Cl	InChI=1S/C14H19BrN2O3.ClH/c15-13-4-2-12(20-13)3-5-14(18)16-6-1-7-17-8-10-19-11-9-17;/h2-5H,1,6-11H2,(H,16,18);1H/b5-3+;	ZWAUIBTWBQNTDT-WGCWOXMQSA-N	342.057905088							, 
AC1LZSJK	LSM-20530	BRD-K80343363	1982134	InChI=1S/C27H23FN8O4/c1-17-3-2-4-19(13-17)15-38-21-9-5-18(6-10-21)14-30-32-27(37)24-23(16-39-22-11-7-20(28)8-12-22)36(35-31-24)26-25(29)33-40-34-26/h2-14H,15-16H2,1H3,(H2,29,33)(H,32,37)	SOLWWSVYXLDYHK-UHFFFAOYSA-N	Cc1cccc(COc2ccc(C=NNC(=O)c3nnn(c3COc4ccc(F)cc4)c5nonc5N)cc2)c1	BroadT	BRD-K80343363	BRD-K80343363-001-08-6	InterBioScreen Ltd.	STOCK4S-19962			Cc1cccc(COc2ccc(C=NNC(=O)c3nnn(c3COc3ccc(F)cc3)-c3nonc3N)cc2)c1	InChI=1S/C27H23FN8O4/c1-17-3-2-4-19(13-17)15-38-21-9-5-18(6-10-21)14-30-32-27(37)24-23(16-39-22-11-7-20(28)8-12-22)36(35-31-24)26-25(29)33-40-34-26/h2-14H,15-16H2,1H3,(H2,29,33)(H,32,37)	SOLWWSVYXLDYHK-UHFFFAOYSA-N	542.182629496							109132
N-[4-(Acetylamino)phenyl]-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamide	LSM-20531	SID24789108, BRD-K78494082	1537655	InChI=1S/C20H19N3O4/c1-13(24)21-14-8-10-15(11-9-14)22-18(25)7-4-12-23-19(26)16-5-2-3-6-17(16)20(23)27/h2-3,5-6,8-11H,4,7,12H2,1H3,(H,21,24)(H,22,25)	JAOFYOGMXDRJKZ-UHFFFAOYSA-N	CC(=O)Nc1ccc(NC(=O)CCCN2C(=O)c3ccccc3C2=O)cc1	BroadT	BRD-K78494082	BRD-K78494082-001-07-3	ChemBridge Corporation	5941181			CC(=O)Nc1ccc(NC(=O)CCCN2C(=O)c3ccccc3C2=O)cc1	InChI=1S/C20H19N3O4/c1-13(24)21-14-8-10-15(11-9-14)22-18(25)7-4-12-23-19(26)16-5-2-3-6-17(16)20(23)27/h2-3,5-6,8-11H,4,7,12H2,1H3,(H,21,24)(H,22,25)	JAOFYOGMXDRJKZ-UHFFFAOYSA-N	365.137556118							109133
MLS000092180	LSM-20532	SID4251959, BRD-A35234044	3245577	InChI=1S/C18H16F2N2O/c19-12-7-9-13(10-8-12)22-17(14-4-1-2-5-15(14)20)21-11-3-6-16(21)18(22)23/h1-2,4-5,7-10,16-17H,3,6,11H2	QVCGITUFJPEAIL-UHFFFAOYSA-N	Fc1ccc(cc1)N2C(N3CCCC3C2=O)c4ccccc4F	BroadT	BRD-A35234044	BRD-A35234044-001-05-8	ChemDiv Inc.	C466-0397			Fc1ccc(cc1)N1C(=O)C2CCCN2C1c1ccccc1F	InChI=1S/C18H16F2N2O/c19-12-7-9-13(10-8-12)22-17(14-4-1-2-5-15(14)20)21-11-3-6-16(21)18(22)23/h1-2,4-5,7-10,16-17H,3,6,11H2	QVCGITUFJPEAIL-UHFFFAOYSA-N	314.123069552							109134
MLS000073728	LSM-20533	SID853257, BRD-K72492942	655910	InChI=1S/C17H22N6O2S2/c1-5-14-19-21-16(27-14)18-13(24)9-26-17-22-20-15(23(17)8-10(2)3)12-6-7-25-11(12)4/h6-7,10H,5,8-9H2,1-4H3,(H,18,21,24)	HSMBFKVOTOXWBD-UHFFFAOYSA-N	CCc1nnc(NC(=O)CSc2nnc(c3ccoc3C)n2CC(C)C)s1	BroadT	BRD-K72492942	BRD-K72492942-001-05-7	Asinex Ltd.	ASN 05917349			CCc1nnc(NC(=O)CSc2nnc(-c3ccoc3C)n2CC(C)C)s1	InChI=1S/C17H22N6O2S2/c1-5-14-19-21-16(27-14)18-13(24)9-26-17-22-20-15(23(17)8-10(2)3)12-6-7-25-11(12)4/h6-7,10H,5,8-9H2,1-4H3,(H,18,21,24)	HSMBFKVOTOXWBD-UHFFFAOYSA-N	406.124565384							109135
AC1MVHNX	LSM-15309	BRD-A89618626	3707992	InChI=1S/C21H27NO3/c1-2-25-19-10-8-18(9-11-19)21(23)20(17-6-4-3-5-7-17)16-22-12-14-24-15-13-22/h3-11,20-21,23H,2,12-16H2,1H3	RTHRSTWGVRVJQO-UHFFFAOYSA-N	CCOc1ccc(cc1)C(O)C(CN2CCOCC2)c3ccccc3	BroadT	BRD-A89618626	BRD-A89618626-003-05-9	InterBioScreen Ltd.	STOCK1S-10485		Cl	CCOc1ccc(cc1)C(O)C(CN1CCOCC1)c1ccccc1.Cl	InChI=1S/C21H27NO3.ClH/c1-2-25-19-10-8-18(9-11-19)21(23)20(17-6-4-3-5-7-17)16-22-12-14-24-15-13-22;/h3-11,20-21,23H,2,12-16H2,1H3;1H	AGXFAJQFURRQGD-UHFFFAOYSA-N	341.199093734							103956, 103956
N-(4-Chlorophenyl)-4-methyl-1,3-thiazol-2-amine	LSM-20534	SID24793921, BRD-K74732223	2228702	InChI=1S/C10H9ClN2S/c1-7-6-14-10(12-7)13-9-4-2-8(11)3-5-9/h2-6H,1H3,(H,12,13)	YFMDICSBNKOPAE-UHFFFAOYSA-N	Cc1csc(Nc2ccc(Cl)cc2)n1	BroadT	BRD-K74732223	BRD-K74732223-001-05-4	ChemBridge Corporation	7957515			Cc1csc(Nc2ccc(Cl)cc2)n1	InChI=1S/C10H9ClN2S/c1-7-6-14-10(12-7)13-9-4-2-8(11)3-5-9/h2-6H,1H3,(H,12,13)	YFMDICSBNKOPAE-UHFFFAOYSA-N	224.017496708							109136
MLS001207806	LSM-43094	5-(4-Hydroxy-3-methoxy-benzylidene)-2-(2-methoxy-phenylimino)-thiazolidin-4-one, BRD-K38340366, SID47201167, MW-STK33-1C	5765514	InChI=1S/C18H16N2O4S/c1-23-14-6-4-3-5-12(14)19-18-20-17(22)16(25-18)10-11-7-8-13(21)15(9-11)24-2/h3-10,21H,1-2H3,(H,19,20,22)/b16-10-	VFLCEEKFNGVMNQ-YBEGLDIGSA-N	COc1ccccc1NC2=NC(=O)\C(=C\c3ccc(O)c(OC)c3)\S2	BroadT	BRD-K38340366	BRD-K38340366-001-10-8	Asinex Ltd.	BAS 01966230			COc1cc(ccc1O)\C=C1/SC(Nc2ccccc2OC)=NC1=O	InChI=1S/C18H16N2O4S/c1-23-14-6-4-3-5-12(14)19-18-20-17(22)16(25-18)10-11-7-8-13(21)15(9-11)24-2/h3-10,21H,1-2H3,(H,19,20,22)/b16-10-	VFLCEEKFNGVMNQ-YBEGLDIGSA-N	356.083077702							
SMR000095232	LSM-20535	SID7968148, BRD-K39836884	1093449	InChI=1S/C17H16N2O6S/c1-3-24-16(20)11-4-6-12(7-5-11)18-26(22,23)13-8-9-14-15(10-13)25-17(21)19(14)2/h4-10,18H,3H2,1-2H3	LQDXKBVVWFOXLJ-UHFFFAOYSA-N	CCOC(=O)c1ccc(NS(=O)(=O)c2ccc3N(C)C(=O)Oc3c2)cc1	BroadT	BRD-K39836884	BRD-K39836884-001-05-7	ChemDiv Inc.	C608-0032			CCOC(=O)c1ccc(NS(=O)(=O)c2ccc3n(C)c(=O)oc3c2)cc1	InChI=1S/C17H16N2O6S/c1-3-24-16(20)11-4-6-12(7-5-11)18-26(22,23)13-8-9-14-15(10-13)25-17(21)19(14)2/h4-10,18H,3H2,1-2H3	LQDXKBVVWFOXLJ-UHFFFAOYSA-N	376.072906942							109137
4-(5-Bromo-2-thienyl)-6-methyl-2-(1H-pyrrol-1-yl)pyrimidine	LSM-20536	SID24819004, BRD-K30680302	3755909	InChI=1S/C13H10BrN3S/c1-9-8-10(11-4-5-12(14)18-11)16-13(15-9)17-6-2-3-7-17/h2-8H,1H3	DMIQCCQPGJOZFK-UHFFFAOYSA-N	Cc1cc(nc(n1)n2cccc2)c3ccc(Br)s3	BroadT	BRD-K30680302	BRD-K30680302-001-04-5	Key Organics Ltd.	1T-9012			Cc1cc(nc(n1)-n1cccc1)-c1ccc(Br)s1	InChI=1S/C13H10BrN3S/c1-9-8-10(11-4-5-12(14)18-11)16-13(15-9)17-6-2-3-7-17/h2-8H,1H3	DMIQCCQPGJOZFK-UHFFFAOYSA-N	318.97788064							109138
SMR000047368	LSM-20537	SID864908, BRD-K03901298	666156	InChI=1S/C23H26N6/c1-18-13-19(2)26-22(25-18)27-23-24-16-28(14-20-9-5-3-6-10-20)17-29(23)15-21-11-7-4-8-12-21/h3-13H,14-17H2,1-2H3,(H,24,25,26,27)	ZKSJDJCDPAHDEZ-UHFFFAOYSA-N	Cc1cc(C)nc(NC2=NCN(Cc3ccccc3)CN2Cc4ccccc4)n1	BroadT	BRD-K03901298	BRD-K03901298-001-06-9	InterBioScreen Ltd.	STOCK5S-30933			Cc1cc(C)nc(NC2=NCN(Cc3ccccc3)CN2Cc2ccccc2)n1	InChI=1S/C23H26N6/c1-18-13-19(2)26-22(25-18)27-23-24-16-28(14-20-9-5-3-6-10-20)17-29(23)15-21-11-7-4-8-12-21/h3-13H,14-17H2,1-2H3,(H,24,25,26,27)	ZKSJDJCDPAHDEZ-UHFFFAOYSA-N	386.221894892							109139
MLS000543312	LSM-20538	SID17403067, BRD-K43137661	1473298	InChI=1S/C21H16ClN3O2S/c22-17-10-8-16(9-11-17)14-28-21-24-23-19(27-21)18-7-4-12-25(20(18)26)13-15-5-2-1-3-6-15/h1-12H,13-14H2	ZTSBHBIEADMSQQ-UHFFFAOYSA-N	Clc1ccc(CSc2oc(nn2)C3=CC=CN(Cc4ccccc4)C3=O)cc1	BroadT	BRD-K43137661	BRD-K43137661-001-05-3	Key Organics Ltd.	10E-402S			Clc1ccc(CSc2nnc(o2)-c2cccn(Cc3ccccc3)c2=O)cc1	InChI=1S/C21H16ClN3O2S/c22-17-10-8-16(9-11-17)14-28-21-24-23-19(27-21)18-7-4-12-25(20(18)26)13-15-5-2-1-3-6-15/h1-12H,13-14H2	ZTSBHBIEADMSQQ-UHFFFAOYSA-N	409.065175182							109140
SMR000014225	LSM-20539	SID844445, BRD-K87534453	646771	InChI=1S/C18H12N2O3S/c21-14(22)10-24-18-16-15(12-8-4-5-9-13(12)23-16)19-17(20-18)11-6-2-1-3-7-11/h1-9H,10H2,(H,21,22)	JJPOVMZLCXNDCU-UHFFFAOYSA-N	OC(=O)CSc1nc(nc2c1oc3ccccc23)c4ccccc4	BroadT	BRD-K87534453	BRD-K87534453-001-06-8	Asinex Ltd.	BAS 07119861			OC(=O)CSc1nc(nc2c3ccccc3oc12)-c1ccccc1	InChI=1S/C18H12N2O3S/c21-14(22)10-24-18-16-15(12-8-4-5-9-13(12)23-16)19-17(20-18)11-6-2-1-3-7-11/h1-9H,10H2,(H,21,22)	JJPOVMZLCXNDCU-UHFFFAOYSA-N	336.056862954							109141
AO-476/43362730	LSM-20540	SID26728303, BRD-K09302236	558673	InChI=1S/C13H17N3OS3/c1-8(17)11-10(14)9-12(19-11)15-20-13(9)18-7-6-16-4-2-3-5-16/h2-7,14H2,1H3	WLGMOXHXQGODFR-UHFFFAOYSA-N	CC(=O)c1sc2nsc(SCCN3CCCC3)c2c1N	BroadT	BRD-K09302236	BRD-K09302236-001-05-1	Maybridge	HTS 13178			CC(=O)c1sc2nsc(SCCN3CCCC3)c2c1N	InChI=1S/C13H17N3OS3/c1-8(17)11-10(14)9-12(19-11)15-20-13(9)18-7-6-16-4-2-3-5-16/h2-7,14H2,1H3	WLGMOXHXQGODFR-UHFFFAOYSA-N	327.053374264							109142
MLS000083714	LSM-20541	SID865945, BRD-K59586807	667202	InChI=1S/C23H25ClFN5O3/c1-32-17-7-5-16(6-8-17)30-13-11-29(12-14-30)10-9-26-22(31)23-28-27-21(33-23)15-18-19(24)3-2-4-20(18)25/h2-8H,9-15H2,1H3,(H,26,31)	NRYUZDWKDIXETJ-UHFFFAOYSA-N	COc1ccc(cc1)N2CCN(CCNC(=O)c3oc(Cc4c(F)cccc4Cl)nn3)CC2	BroadT	BRD-K59586807	BRD-K59586807-001-06-5	InterBioScreen Ltd.	STOCK5S-55043			COc1ccc(cc1)N1CCN(CCNC(=O)c2nnc(o2)Cc2c(F)cccc2Cl)CC1	InChI=1S/C23H25ClFN5O3/c1-32-17-7-5-16(6-8-17)30-13-11-29(12-14-30)10-9-26-22(31)23-28-27-21(33-23)15-18-19(24)3-2-4-20(18)25/h2-8H,9-15H2,1H3,(H,26,31)	NRYUZDWKDIXETJ-UHFFFAOYSA-N	473.16299562							109143
7-Chloro-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid	LSM-20542	SID24780764, BRD-K14749717	1132009	InChI=1S/C13H10ClNO2/c14-7-4-5-11-9(6-7)12(13(16)17)8-2-1-3-10(8)15-11/h4-6H,1-3H2,(H,16,17)	BRXPKYDOKVSIJG-UHFFFAOYSA-N	OC(=O)c1c2CCCc2nc3ccc(Cl)cc13	BroadT	BRD-K14749717	BRD-K14749717-001-05-4	Asinex Ltd.	BAS 02538237			OC(=O)c1c2CCCc2nc2ccc(Cl)cc12	InChI=1S/C13H10ClNO2/c14-7-4-5-11-9(6-7)12(13(16)17)8-2-1-3-10(8)15-11/h4-6H,1-3H2,(H,16,17)	BRXPKYDOKVSIJG-UHFFFAOYSA-N	247.04000628							109144
MLS000586449	LSM-20543	SID17510658, BRD-K67949523	12005295	InChI=1S/C21H21BrN2O2S/c1-15-21(19-5-3-4-6-20(19)23(15)2)16-11-13-24(14-12-16)27(25,26)18-9-7-17(22)8-10-18/h3-11H,12-14H2,1-2H3	ZGGJNHAEEIWHKY-UHFFFAOYSA-N	Cc1c(C2=CCN(CC2)S(=O)(=O)c3ccc(Br)cc3)c4ccccc4n1C	BroadT	BRD-K67949523	BRD-K67949523-001-07-6	ChemDiv Inc.	C614-0708			Cc1c(C2=CCN(CC2)S(=O)(=O)c2ccc(Br)cc2)c2ccccc2n1C	InChI=1S/C21H21BrN2O2S/c1-15-21(19-5-3-4-6-20(19)23(15)2)16-11-13-24(14-12-16)27(25,26)18-9-7-17(22)8-10-18/h3-11H,12-14H2,1-2H3	ZGGJNHAEEIWHKY-UHFFFAOYSA-N	444.050711222							131255
STK583937	LSM-20544	SID14743341, BRD-A23057545	4888164	InChI=1S/C17H23N5S/c1-12-6-2-4-8-14(12)22-10-18-16(19-11-22)21-17-20-13-7-3-5-9-15(13)23-17/h3,5,7,9,12,14H,2,4,6,8,10-11H2,1H3,(H2,18,19,20,21)	FDWGGRWUHUOODU-UHFFFAOYSA-N	CC1CCCCC1N2CNC(=NC2)Nc3nc4ccccc4s3	BroadT	BRD-A23057545	BRD-A23057545-001-05-1	InterBioScreen Ltd.	STOCK5S-37457			CC1CCCCC1N1CNC(Nc2nc3ccccc3s2)=NC1	InChI=1S/C17H23N5S/c1-12-6-2-4-8-14(12)22-10-18-16(19-11-22)21-17-20-13-7-3-5-9-15(13)23-17/h3,5,7,9,12,14H,2,4,6,8,10-11H2,1H3,(H2,18,19,20,21)	FDWGGRWUHUOODU-UHFFFAOYSA-N	329.167416476							109147
MLS000626748	LSM-20545	SID24803014, BRD-K55388141	2176412	InChI=1S/C20H14N4O6S/c25-15(26)5-6-24-9-11(8-13-17(27)21-20(31)22-18(13)28)16(23-24)12-7-10-3-1-2-4-14(10)30-19(12)29/h1-4,7-9H,5-6H2,(H,25,26)(H2,21,22,27,28,31)	LJKVWAWDRLURJW-UHFFFAOYSA-N	OC(=O)CCn1cc(C=C2C(=O)NC(=S)NC2=O)c(n1)C3=Cc4ccccc4OC3=O	BroadT	BRD-K55388141	BRD-K55388141-001-04-0	ChemBridge Corporation	7165557			OC(=O)CCn1cc(C=C2C(=O)NC(=S)NC2=O)c(n1)-c1cc2ccccc2oc1=O	InChI=1S/C20H14N4O6S/c25-15(26)5-6-24-9-11(8-13-17(27)21-20(31)22-18(13)28)16(23-24)12-7-10-3-1-2-4-14(10)30-19(12)29/h1-4,7-9H,5-6H2,(H,25,26)(H2,21,22,27,28,31)	LJKVWAWDRLURJW-UHFFFAOYSA-N	438.063404898							109148
MLS000034218	LSM-20546	SID844112, BRD-K62347225	646421	InChI=1S/C16H13FN4O2S/c17-12-1-3-13(4-2-12)19-14(22)7-10-24-16-21-20-15(23-16)11-5-8-18-9-6-11/h1-6,8-9H,7,10H2,(H,19,22)	AWFAHQNYGBLQIG-UHFFFAOYSA-N	Fc1ccc(NC(=O)CCSc2oc(nn2)c3ccncc3)cc1	BroadT	BRD-K62347225	BRD-K62347225-001-06-1	Asinex Ltd.	BAS 06981902			Fc1ccc(NC(=O)CCSc2nnc(o2)-c2ccncc2)cc1	InChI=1S/C16H13FN4O2S/c17-12-1-3-13(4-2-12)19-14(22)7-10-24-16-21-20-15(23-16)11-5-8-18-9-6-11/h1-6,8-9H,7,10H2,(H,19,22)	AWFAHQNYGBLQIG-UHFFFAOYSA-N	344.074324586							109149
F2004-0106	LSM-20547	SID24815653, BRD-K08819355	7207193	InChI=1S/C15H17N3O2S/c19-15(18-8-2-1-3-9-18)11-21-14-7-6-12(16-17-14)13-5-4-10-20-13/h4-7,10H,1-3,8-9,11H2	TXYIUQYOJRGGRI-UHFFFAOYSA-N	O=C(CSc1ccc(nn1)c2occc2)N3CCCCC3	BroadT	BRD-K08819355	BRD-K08819355-001-05-0	Life Chemicals Inc.	F2004-0106			O=C(CSc1ccc(nn1)-c1ccco1)N1CCCCC1	InChI=1S/C15H17N3O2S/c19-15(18-8-2-1-3-9-18)11-21-14-7-6-12(16-17-14)13-5-4-10-20-13/h4-7,10H,1-3,8-9,11H2	TXYIUQYOJRGGRI-UHFFFAOYSA-N	303.104147504							109150
STK849522	LSM-20548	SID864971, BRD-K25149583	666219	InChI=1S/C21H18N2O3S/c1-14-5-2-6-15-11-16(20(24)22-19(14)15)12-23(13-17-7-3-9-26-17)21(25)18-8-4-10-27-18/h2-11H,12-13H2,1H3,(H,22,24)	YRBQBGKDZJVSBA-UHFFFAOYSA-N	Cc1cccc2cc(CN(Cc3occc3)C(=O)c4cccs4)c(O)nc12	BroadT	BRD-K25149583	BRD-K25149583-001-05-5	InterBioScreen Ltd.	STOCK5S-35038			Cc1cccc2cc(CN(Cc3ccco3)C(=O)c3cccs3)c(O)nc12	InChI=1S/C21H18N2O3S/c1-14-5-2-6-15-11-16(20(24)22-19(14)15)12-23(13-17-7-3-9-26-17)21(25)18-8-4-10-27-18/h2-11H,12-13H2,1H3,(H,22,24)	YRBQBGKDZJVSBA-UHFFFAOYSA-N	378.103813146							109151
SMR000028220	LSM-20549	SID4251036, BRD-K38289181	3244773	InChI=1S/C22H22N4O3/c1-28-17-8-6-16(7-9-17)15-26-20(25-19-5-2-12-23-22(19)26)10-11-21(27)24-14-18-4-3-13-29-18/h2-9,12-13H,10-11,14-15H2,1H3,(H,24,27)	YLWMKFSHPQVQLE-UHFFFAOYSA-N	COc1ccc(Cn2c(CCC(=O)NCc3occc3)nc4cccnc24)cc1	BroadT	BRD-K38289181	BRD-K38289181-001-05-0	ChemDiv Inc.	C614-0941			COc1ccc(Cn2c(CCC(=O)NCc3ccco3)nc3cccnc23)cc1	InChI=1S/C22H22N4O3/c1-28-17-8-6-16(7-9-17)15-26-20(25-19-5-2-12-23-22(19)26)10-11-21(27)24-14-18-4-3-13-29-18/h2-9,12-13H,10-11,14-15H2,1H3,(H,24,27)	YLWMKFSHPQVQLE-UHFFFAOYSA-N	390.169190604							109152
MLS000527793	LSM-20550	SID14725935, BRD-A61717425	3229353	InChI=1S/C25H25F4N5O/c1-24(2,3)34-23(30-31-32-34)22(18-8-10-19(11-9-18)25(27,28)29)33(16-21-5-4-14-35-21)15-17-6-12-20(26)13-7-17/h4-14,22H,15-16H2,1-3H3	YNHWSBATNPTUPW-UHFFFAOYSA-N	CC(C)(C)n1nnnc1C(N(Cc2occc2)Cc3ccc(F)cc3)c4ccc(cc4)C(F)(F)F	BroadT	BRD-A61717425	BRD-A61717425-001-05-8	Asinex Ltd.	ASN 07887890			CC(C)(C)n1nnnc1C(N(Cc1ccco1)Cc1ccc(F)cc1)c1ccc(cc1)C(F)(F)F	InChI=1S/C25H25F4N5O/c1-24(2,3)34-23(30-31-32-34)22(18-8-10-19(11-9-18)25(27,28)29)33(16-21-5-4-14-35-21)15-17-6-12-20(26)13-7-17/h4-14,22H,15-16H2,1-3H3	YNHWSBATNPTUPW-UHFFFAOYSA-N	487.19952327							109153
MLS000683296	LSM-20551	SID24792076, BRD-K38821931	619852	InChI=1S/C16H12O3/c1-18-12-7-8-15-13(9-12)14(10-19-15)16(17)11-5-3-2-4-6-11/h2-10H,1H3	WBIYZPQWXHJJEE-UHFFFAOYSA-N	COc1ccc2occ(C(=O)c3ccccc3)c2c1	BroadT	BRD-K38821931	BRD-K38821931-001-06-1	ChemBridge Corporation	5919339			COc1ccc2occ(C(=O)c3ccccc3)c2c1	InChI=1S/C16H12O3/c1-18-12-7-8-15-13(9-12)14(10-19-15)16(17)11-5-3-2-4-6-11/h2-10H,1H3	WBIYZPQWXHJJEE-UHFFFAOYSA-N	252.078644244							109154
T0515-8135	LSM-20552	SID22408943, BRD-K87443636	2423054	InChI=1S/C21H22N2O/c1-14-8-10-18(11-9-14)22-21(24)20-13-16(3)23(17(20)4)19-7-5-6-15(2)12-19/h5-13H,1-4H3,(H,22,24)	BGFMLJRYKZBRRQ-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2cc(C)n(c2C)c3cccc(C)c3)cc1	BroadT	BRD-K87443636	BRD-K87443636-001-05-4	Enamine Ltd.	T0515-8135			Cc1cc(C(=O)Nc2ccc(C)cc2)c(C)n1-c1cccc(C)c1	InChI=1S/C21H22N2O/c1-14-8-10-18(11-9-14)22-21(24)20-13-16(3)23(17(20)4)19-7-5-6-15(2)12-19/h5-13H,1-4H3,(H,22,24)	BGFMLJRYKZBRRQ-UHFFFAOYSA-N	318.173213344							109155
SMR000008211	LSM-20553	SID848852, BRD-A74014140	651316	InChI=1S/C21H25N5O3/c1-27-13-12-26-21(22-23-24-26)20(16-8-9-18(28-2)19(14-16)29-3)25-11-10-15-6-4-5-7-17(15)25/h4-9,14,20H,10-13H2,1-3H3	VNXRYQGUOXLTPJ-UHFFFAOYSA-N	COCCn1nnnc1C(N2CCc3ccccc23)c4ccc(OC)c(OC)c4	BroadT	BRD-A74014140	BRD-A74014140-001-05-9	Asinex Ltd.	ASN 07878336			COCCn1nnnc1C(N1CCc2ccccc12)c1ccc(OC)c(OC)c1	InChI=1S/C21H25N5O3/c1-27-13-12-26-21(22-23-24-26)20(16-8-9-18(28-2)19(14-16)29-3)25-11-10-15-6-4-5-7-17(15)25/h4-9,14,20H,10-13H2,1-3H3	VNXRYQGUOXLTPJ-UHFFFAOYSA-N	395.19573971							109156
STK123305	LSM-20554	SID4260376, BRD-K09944219	868027	InChI=1S/C17H19NO4/c1-20-14-8-4-3-7-13(14)11-18-17(19)12-22-16-10-6-5-9-15(16)21-2/h3-10H,11-12H2,1-2H3,(H,18,19)	FDRIAZDRQICXMO-UHFFFAOYSA-N	COc1ccccc1CNC(=O)COc2ccccc2OC	BroadT	BRD-K09944219	BRD-K09944219-001-05-1	ChemBridge Corporation	5685961			COc1ccccc1CNC(=O)COc1ccccc1OC	InChI=1S/C17H19NO4/c1-20-14-8-4-3-7-13(14)11-18-17(19)12-22-16-10-6-5-9-15(16)21-2/h3-10H,11-12H2,1-2H3,(H,18,19)	FDRIAZDRQICXMO-UHFFFAOYSA-N	301.131408098							109157
AC1LFWC3	LSM-20555	BRD-K45890731	761162	InChI=1S/C18H21N3/c1-16-7-9-17(10-8-16)15-19-21-13-11-20(12-14-21)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3	YXZQFVGYUCERHF-UHFFFAOYSA-N	Cc1ccc(C=NN2CCN(CC2)c3ccccc3)cc1	BroadT	BRD-K45890731	BRD-K45890731-001-05-1	ChemBridge Corporation	5893280			Cc1ccc(C=NN2CCN(CC2)c2ccccc2)cc1	InChI=1S/C18H21N3/c1-16-7-9-17(10-8-16)15-19-21-13-11-20(12-14-21)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3	YXZQFVGYUCERHF-UHFFFAOYSA-N	279.173547702							109158
MLS000054197	LSM-20556	SID24840061, SID3715881, BRD-K61103134	2999387	InChI=1S/C24H25N3O6S/c28-23(25-17-21-9-5-15-32-21)18-33-24(29)19-6-4-10-22(16-19)34(30,31)27-13-11-26(12-14-27)20-7-2-1-3-8-20/h1-10,15-16H,11-14,17-18H2,(H,25,28)	LGAQKLZPUUURLS-UHFFFAOYSA-N	O=C(COC(=O)c1cccc(c1)S(=O)(=O)N2CCN(CC2)c3ccccc3)NCc4occc4	BroadT	BRD-K61103134	BRD-K61103134-001-05-1	Enamine Ltd.	T0512-8613			O=C(COC(=O)c1cccc(c1)S(=O)(=O)N1CCN(CC1)c1ccccc1)NCc1ccco1	InChI=1S/C24H25N3O6S/c28-23(25-17-21-9-5-15-32-21)18-33-24(29)19-6-4-10-22(16-19)34(30,31)27-13-11-26(12-14-27)20-7-2-1-3-8-20/h1-10,15-16H,11-14,17-18H2,(H,25,28)	LGAQKLZPUUURLS-UHFFFAOYSA-N	483.14640624							109159
SMR000201163	LSM-20557	SID17433304, BRD-K27685311	2972706	InChI=1S/C22H25ClN4O4/c23-17-5-4-6-18(21(17)26-9-2-1-3-10-26)24-22(28)16-7-8-19(20(15-16)27(29)30)25-11-13-31-14-12-25/h4-8,15H,1-3,9-14H2,(H,24,28)	NSCSIGAKFQMCAJ-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1N2CCOCC2)C(=O)Nc3cccc(Cl)c3N4CCCCC4	BroadT	BRD-K27685311	BRD-K27685311-001-05-5	ChemBridge Corporation	7953570			[O-][N+](=O)c1cc(ccc1N1CCOCC1)C(=O)Nc1cccc(Cl)c1N1CCCCC1	InChI=1S/C22H25ClN4O4/c23-17-5-4-6-18(21(17)26-9-2-1-3-10-26)24-22(28)16-7-8-19(20(15-16)27(29)30)25-11-13-31-14-12-25/h4-8,15H,1-3,9-14H2,(H,24,28)	NSCSIGAKFQMCAJ-UHFFFAOYSA-N	444.15643303							109160
ZINC02206596	LSM-20558	BRD-K94551863	1840112	InChI=1S/C19H12N2O4S2/c22-18-13-7-2-3-8-14(13)19(23)17(21-10-4-1-5-11-21)16(18)20-27(24,25)15-9-6-12-26-15/h1-12H/p+1	CMBUXPJABLCYJT-UHFFFAOYSA-O	O=C1C(=C(C(=O)c2ccccc12)[n+]3ccccc3)NS(=O)(=O)c4cccs4	BroadT	BRD-K94551863	BRD-K94551863-001-08-3	InterBioScreen Ltd.	STOCK3S-04273			O=C1c2ccccc2C(=O)C(=C1NS(=O)(=O)c1cccs1)[n+]1ccccc1	InChI=1S/C19H12N2O4S2/c22-18-13-7-2-3-8-14(13)19(23)17(21-10-4-1-5-11-21)16(18)20-27(24,25)15-9-6-12-26-15/h1-12H/p+1	CMBUXPJABLCYJT-UHFFFAOYSA-O	397.031673296							109161
SMR000095237	LSM-20559	SID7966421, BRD-K08600038	5308219	InChI=1S/C15H13FN2O4S/c1-9-3-4-10(7-12(9)16)17-23(20,21)11-5-6-13-14(8-11)22-15(19)18(13)2/h3-8,17H,1-2H3	FEEMTNADXWMRDR-UHFFFAOYSA-N	CN1C(=O)Oc2cc(ccc12)S(=O)(=O)Nc3ccc(C)c(F)c3	BroadT	BRD-K08600038	BRD-K08600038-001-04-2	ChemDiv Inc.	C608-0045			Cc1ccc(NS(=O)(=O)c2ccc3n(C)c(=O)oc3c2)cc1F	InChI=1S/C15H13FN2O4S/c1-9-3-4-10(7-12(9)16)17-23(20,21)11-5-6-13-14(8-11)22-15(19)18(13)2/h3-8,17H,1-2H3	FEEMTNADXWMRDR-UHFFFAOYSA-N	336.058005806							109162
AC1MK69A	LSM-20560	SID14721262, BRD-A60405379	3151135	InChI=1S/C17H22ClNO3S/c1-3-22-17(21)13-8-10-19(11-9-13)16(20)12(2)23-15-6-4-14(18)5-7-15/h4-7,12-13H,3,8-11H2,1-2H3	WEIFSHCLPPCJAG-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC1)C(=O)C(C)Sc2ccc(Cl)cc2	BroadT	BRD-A60405379	BRD-A60405379-001-05-7	Asinex Ltd.	BAS 04927688			CCOC(=O)C1CCN(CC1)C(=O)C(C)Sc1ccc(Cl)cc1	InChI=1S/C17H22ClNO3S/c1-3-22-17(21)13-8-10-19(11-9-13)16(20)12(2)23-15-6-4-14(18)5-7-15/h4-7,12-13H,3,8-11H2,1-2H3	WEIFSHCLPPCJAG-UHFFFAOYSA-N	355.100891974							109163
MLS001121489	LSM-20561	SID49723022, SID24395498, BRD-K27695682	16017591	InChI=1S/C13H13BrN4O4S2/c14-10-3-1-2-9(8-10)11(19)15-12-16-17-13(23-12)24(20,21)18-4-6-22-7-5-18/h1-3,8H,4-7H2,(H,15,16,19)	RQUSDTWRBIDVPI-UHFFFAOYSA-N	Brc1cccc(c1)C(=O)Nc2nnc(s2)S(=O)(=O)N3CCOCC3	BroadT	BRD-K27695682	BRD-K27695682-001-05-5	ChemDiv Inc.	E157-0998			Brc1cccc(c1)C(=O)Nc1nnc(s1)S(=O)(=O)N1CCOCC1	InChI=1S/C13H13BrN4O4S2/c14-10-3-1-2-9(8-10)11(19)15-12-16-17-13(23-12)24(20,21)18-4-6-22-7-5-18/h1-3,8H,4-7H2,(H,15,16,19)	RQUSDTWRBIDVPI-UHFFFAOYSA-N	431.956158916							109164
MLS001111222	LSM-20562	SID26729287, BRD-K43691462	2808819	InChI=1S/C19H22N4S/c1-14-12-24-19-17(14)18(20-13-21-19)22-16-7-9-23(10-8-16)11-15-5-3-2-4-6-15/h2-6,12-13,16H,7-11H2,1H3,(H,20,21,22)	GYQNXYQGNUDXME-UHFFFAOYSA-N	Cc1csc2ncnc(NC3CCN(Cc4ccccc4)CC3)c12	BroadT	BRD-K43691462	BRD-K43691462-001-06-8	Maybridge	GK 03210			Cc1csc2ncnc(NC3CCN(Cc4ccccc4)CC3)c12	InChI=1S/C19H22N4S/c1-14-12-24-19-17(14)18(20-13-21-19)22-16-7-9-23(10-8-16)11-15-5-3-2-4-6-15/h2-6,12-13,16H,7-11H2,1H3,(H,20,21,22)	GYQNXYQGNUDXME-UHFFFAOYSA-N	338.156517434							109165
MLS000556237	LSM-20563	SID14729667, BRD-K86418557	950362	InChI=1S/C15H18N2O3/c1-15(2)8-12(18)14(13(19)9-15)17-16-10-4-6-11(20-3)7-5-10/h4-7,16H,8-9H2,1-3H3	QBZKKBNWRSLLRY-UHFFFAOYSA-N	COc1ccc(NN=C2C(=O)CC(C)(C)CC2=O)cc1	BroadT	BRD-K86418557	BRD-K86418557-001-05-2	InterBioScreen Ltd.	STOCK3S-30776			COc1ccc(NN=C2C(=O)CC(C)(C)CC2=O)cc1	InChI=1S/C15H18N2O3/c1-15(2)8-12(18)14(13(19)9-15)17-16-10-4-6-11(20-3)7-5-10/h4-7,16H,8-9H2,1-3H3	QBZKKBNWRSLLRY-UHFFFAOYSA-N	274.131742456							109166
EN300-09475	LSM-20564	SID24826371, BRD-A63120617	3324499	InChI=1S/C15H19N3S2/c1-3-7-18-14(16-17-15(18)19)13-9-11-8-10(4-2)5-6-12(11)20-13/h3,9-10H,1,4-8H2,2H3,(H,17,19)	DPLPWLUXCYLNCG-UHFFFAOYSA-N	CCC1CCc2sc(cc2C1)c3nnc(S)n3CC=C	BroadT	BRD-A63120617	BRD-A63120617-001-05-1	Enamine Ltd.	EN300-09475			CCC1CCc2sc(cc2C1)-c1nnc(S)n1CC=C	InChI=1S/C15H19N3S2/c1-3-7-18-14(16-17-15(18)19)13-9-11-8-10(4-2)5-6-12(11)20-13/h3,9-10H,1,4-8H2,2H3,(H,17,19)	DPLPWLUXCYLNCG-UHFFFAOYSA-N	305.102039018							109167
SMR000036009	LSM-20565	SID865597, BRD-K88929251	666856	InChI=1S/C20H22N2O5/c1-24-20(23)16-11-15(3-4-17(16)22-6-8-25-9-7-22)21-12-14-2-5-18-19(10-14)27-13-26-18/h2-5,10-11,21H,6-9,12-13H2,1H3	XYNHSYFNMAMSBH-UHFFFAOYSA-N	COC(=O)c1cc(NCc2ccc3OCOc3c2)ccc1N4CCOCC4	BroadT	BRD-K88929251	BRD-K88929251-001-05-5	InterBioScreen Ltd.	STOCK5S-48147			COC(=O)c1cc(NCc2ccc3OCOc3c2)ccc1N1CCOCC1	InChI=1S/C20H22N2O5/c1-24-20(23)16-11-15(3-4-17(16)22-6-8-25-9-7-22)21-12-14-2-5-18-19(10-14)27-13-26-18/h2-5,10-11,21H,6-9,12-13H2,1H3	XYNHSYFNMAMSBH-UHFFFAOYSA-N	370.152871824							109168
MLS000039731	LSM-20566	SID865272, BRD-K50124496	666526	InChI=1S/C21H25N3O6/c1-28-19-10-14(2-5-18(19)30-13-20(22)25)12-23-15-3-4-17(16(11-15)21(26)27)24-6-8-29-9-7-24/h2-5,10-11,23H,6-9,12-13H2,1H3,(H2,22,25)(H,26,27)	DHTXANYWBYFQRT-UHFFFAOYSA-N	COc1cc(CNc2ccc(N3CCOCC3)c(c2)C(=O)O)ccc1OCC(=O)N	BroadT	BRD-K50124496	BRD-K50124496-001-05-2	InterBioScreen Ltd.	STOCK5S-40596			COc1cc(CNc2ccc(N3CCOCC3)c(c2)C(O)=O)ccc1OCC(N)=O	InChI=1S/C21H25N3O6/c1-28-19-10-14(2-5-18(19)30-13-20(22)25)12-23-15-3-4-17(16(11-15)21(26)27)24-6-8-29-9-7-24/h2-5,10-11,23H,6-9,12-13H2,1H3,(H2,22,25)(H,26,27)	DHTXANYWBYFQRT-UHFFFAOYSA-N	415.17433555							109169
SMR000015227	LSM-20567	SID853208, BRD-K22221338	655862	InChI=1S/C11H6N4O2S/c1-3-7(16-5-1)9-12-13-11-15(9)14-10(18-11)8-4-2-6-17-8/h1-6H	NTJAHJNZTGHMTR-UHFFFAOYSA-N	o1cccc1c2nn3c(nnc3s2)c4occc4	BroadT	BRD-K22221338	BRD-K22221338-001-05-3	Asinex Ltd.	BAS 09636908			c1coc(c1)-c1nn2c(nnc2s1)-c1ccco1	InChI=1S/C11H6N4O2S/c1-3-7(16-5-1)9-12-13-11-15(9)14-10(18-11)8-4-2-6-17-8/h1-6H	NTJAHJNZTGHMTR-UHFFFAOYSA-N	258.021146162							109170
MLS000561115	LSM-20568	SID26731832, BRD-A52968819	16746037	InChI=1S/C20H25N3O2S/c1-13(2)10-11-21-18(24)19-22-14(3)17(26-19)20(4)12-16(23-25-20)15-8-6-5-7-9-15/h5-9,13H,10-12H2,1-4H3,(H,21,24)	SRAYPXCUTOEYLC-UHFFFAOYSA-N	CC(C)CCNC(=O)c1nc(C)c(s1)C2(C)CC(=NO2)c3ccccc3	BroadT	BRD-A52968819	BRD-A52968819-001-05-2	University of California at Davis	LY-SH1-045			CC(C)CCNC(=O)c1nc(C)c(s1)C1(C)CC(=NO1)c1ccccc1	InChI=1S/C20H25N3O2S/c1-13(2)10-11-21-18(24)19-22-14(3)17(26-19)20(4)12-16(23-25-20)15-8-6-5-7-9-15/h5-9,13H,10-12H2,1-4H3,(H,21,24)	SRAYPXCUTOEYLC-UHFFFAOYSA-N	371.16674776							109171
ASN 04482193	LSM-20569	SID17408323, SID87225725, BRD-K39705272	1135734	InChI=1S/C24H21N5O2S2/c1-15-11-17-12-18(31-3)9-10-20(17)29-22(15)26-27-24(29)33-14-21(30)28(2)23-25-19(13-32-23)16-7-5-4-6-8-16/h4-13H,14H2,1-3H3	DLPNYXAJRXKNEW-UHFFFAOYSA-N	COc1ccc2c(c1)cc(C)c3nnc(SCC(=O)N(C)c4nc(cs4)c5ccccc5)n23	BroadT	BRD-K39705272	BRD-K39705272-001-05-4	Asinex Ltd.	ASN 04482193			COc1ccc2c(c1)cc(C)c1nnc(SCC(=O)N(C)c3nc(cs3)-c3ccccc3)n21	InChI=1S/C24H21N5O2S2/c1-15-11-17-12-18(31-3)9-10-20(17)29-22(15)26-27-24(29)33-14-21(30)28(2)23-25-19(13-32-23)16-7-5-4-6-8-16/h4-13H,14H2,1-3H3	DLPNYXAJRXKNEW-UHFFFAOYSA-N	475.113666342							109172
2-[Bis(5-Methylfuran-2-yl)methyl]-6-nitrophenol	LSM-20570	SID14740230, BRD-K44454431	2751436	InChI=1S/C17H15NO5/c1-10-6-8-14(22-10)16(15-9-7-11(2)23-15)12-4-3-5-13(17(12)19)18(20)21/h3-9,16,19H,1-2H3	LVYPAEPKTFJTIC-UHFFFAOYSA-N	Cc1oc(cc1)C(c2oc(C)cc2)c3cccc(c3O)[N+](=O)[O-]	BroadT	BRD-K44454431	BRD-K44454431-001-05-0	ChemBridge Corporation	6550692			Cc1ccc(o1)C(c1ccc(C)o1)c1cccc(c1O)[N+]([O-])=O	InChI=1S/C17H15NO5/c1-10-6-8-14(22-10)16(15-9-7-11(2)23-15)12-4-3-5-13(17(12)19)18(20)21/h3-9,16,19H,1-2H3	LVYPAEPKTFJTIC-UHFFFAOYSA-N	313.09502259							109173
BRD-K04385915	LSM-20571			InChI=1S/C17H21NO3/c1-17(2)8-15(19)14(16(20)9-17)11-18-10-12-4-6-13(21-3)7-5-12/h4-7,11,14H,8-10H2,1-3H3	JCNVZAFLBLCELF-UHFFFAOYSA-N	COc1ccc(CN=CC2C(=O)CC(C)(C)CC2=O)cc1	BroadT	BRD-K04385915	BRD-K04385915-001-06-7	ChemBridge Corporation	5325566			COc1ccc(CN=CC2C(=O)CC(C)(C)CC2=O)cc1	InChI=1S/C17H21NO3/c1-17(2)8-15(19)14(16(20)9-17)11-18-10-12-4-6-13(21-3)7-5-12/h4-7,11,14H,8-10H2,1-3H3	JCNVZAFLBLCELF-UHFFFAOYSA-N	287.152143542							109174
Ethyl 2-amino-1-[2-(morpholin-4-yl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate	LSM-20572	SID14743453, BRD-K38002544	1900690	InChI=1S/C19H23N5O3/c1-2-27-19(25)15-16-18(22-14-6-4-3-5-13(14)21-16)24(17(15)20)8-7-23-9-11-26-12-10-23/h3-6H,2,7-12,20H2,1H3	JWNKTKKBPANCLR-UHFFFAOYSA-N	CCOC(=O)c1c(N)n(CCN2CCOCC2)c3nc4ccccc4nc13	BroadT	BRD-K38002544	BRD-K38002544-001-05-9	InterBioScreen Ltd.	STOCK1S-63754			CCOC(=O)c1c(N)n(CCN2CCOCC2)c2nc3ccccc3nc12	InChI=1S/C19H23N5O3/c1-2-27-19(25)15-16-18(22-14-6-4-3-5-13(14)21-16)24(17(15)20)8-7-23-9-11-26-12-10-23/h3-6H,2,7-12,20H2,1H3	JWNKTKKBPANCLR-UHFFFAOYSA-N	369.180089646							109175
7-Amino-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidine-6-carbonitrile	LSM-20573	SID14726256, BRD-K20756798	619301	InChI=1S/C14H11N5/c1-9-12(10-5-3-2-4-6-10)14-17-8-11(7-15)13(16)19(14)18-9/h2-6,8H,16H2,1H3	XAFYBKNNHLDYKS-UHFFFAOYSA-N	Cc1nn2c(N)c(cnc2c1c3ccccc3)C#N	BroadT	BRD-K20756798	BRD-K20756798-001-05-3	Asinex Ltd.	BAS 03556231			Cc1nn2c(N)c(cnc2c1-c1ccccc1)C#N	InChI=1S/C14H11N5/c1-9-12(10-5-3-2-4-6-10)14-17-8-11(7-15)13(16)19(14)18-9/h2-6,8H,16H2,1H3	XAFYBKNNHLDYKS-UHFFFAOYSA-N	249.101445402							109176
SMR000095096	LSM-20574	SID7967345, BRD-K38506961	5308769	InChI=1S/C19H16N2O2S2/c1-2-21-15-8-4-3-7-13(15)17-14(19(21)23)10-16(25-17)18(22)20-11-12-6-5-9-24-12/h3-10H,2,11H2,1H3,(H,20,22)	VRQPWYSWGUEMGT-UHFFFAOYSA-N	CCN1C(=O)c2cc(sc2c3ccccc13)C(=O)NCc4cccs4	BroadT	BRD-K38506961	BRD-K38506961-001-05-3	ChemDiv Inc.	C593-0858			CCn1c2ccccc2c2sc(cc2c1=O)C(=O)NCc1cccs1	InChI=1S/C19H16N2O2S2/c1-2-21-15-8-4-3-7-13(15)17-14(19(21)23)10-16(25-17)18(22)20-11-12-6-5-9-24-12/h3-10H,2,11H2,1H3,(H,20,22)	VRQPWYSWGUEMGT-UHFFFAOYSA-N	368.065319152							109177
AMBCB80495035	LSM-20575	SID49732461, BRD-K68766876	24793157	InChI=1S/C18H17N3O3/c22-18(21-8-1-2-9-21)17-11-15(24-20-17)12-23-14-5-6-16-13(10-14)4-3-7-19-16/h3-7,10-11H,1-2,8-9,12H2	KAEPEHRFCSWKBY-UHFFFAOYSA-N	O=C(N1CCCC1)c2cc(COc3ccc4ncccc4c3)on2	BroadT	BRD-K68766876	BRD-K68766876-001-05-0	ChemBridge Corporation	80495035			O=C(N1CCCC1)c1cc(COc2ccc3ncccc3c2)on1	InChI=1S/C18H17N3O3/c22-18(21-8-1-2-9-21)17-11-15(24-20-17)12-23-14-5-6-16-13(10-14)4-3-7-19-16/h3-7,10-11H,1-2,8-9,12H2	KAEPEHRFCSWKBY-UHFFFAOYSA-N	323.126991434							109178
AC1MH7IA	LSM-15310	BRD-A19644769	2997512	InChI=1S/C19H24N2O3/c1-19(2)10-14-6-5-8-17(18(14)24-19)23-13-16(22)12-20-11-15-7-3-4-9-21-15/h3-9,16,20,22H,10-13H2,1-2H3	QEWSBKDMGYPSBU-UHFFFAOYSA-N	CC1(C)Cc2cccc(OCC(O)CNCc3ccccn3)c2O1	BroadT	BRD-A19644769	BRD-A19644769-003-05-7	Enamine Ltd.	T0515-7667		Cl	CC1(C)Cc2cccc(OCC(O)CNCc3ccccn3)c2O1.Cl	InChI=1S/C19H24N2O3.ClH/c1-19(2)10-14-6-5-8-17(18(14)24-19)23-13-16(22)12-20-11-15-7-3-4-9-21-15;/h3-9,16,20,22H,10-13H2,1-2H3;1H	DGIMMZIHOWLYCU-UHFFFAOYSA-N	328.178692648							103957, 103957
MLS000095583	LSM-20576	SID4247034, BRD-K64002590	3241294	InChI=1S/C18H23N3O5S2/c1-3-25-14(22)11-28-17-19-13-7-10-27-15(13)16(23)21(17)12-5-8-20(9-6-12)18(24)26-4-2/h7,10,12H,3-6,8-9,11H2,1-2H3	JPHZZDRNXQZZMP-UHFFFAOYSA-N	CCOC(=O)CSC1=Nc2ccsc2C(=O)N1C3CCN(CC3)C(=O)OCC	BroadT	BRD-K64002590	BRD-K64002590-001-05-9	ChemDiv Inc.	K292-1260			CCOC(=O)CSc1nc2ccsc2c(=O)n1C1CCN(CC1)C(=O)OCC	InChI=1S/C18H23N3O5S2/c1-3-25-14(22)11-28-17-19-13-7-10-27-15(13)16(23)21(17)12-5-8-20(9-6-12)18(24)26-4-2/h7,10,12H,3-6,8-9,11H2,1-2H3	JPHZZDRNXQZZMP-UHFFFAOYSA-N	425.107912246							109179
ZINC00412837	LSM-20577	SID49643266, BRD-K36475458	857262	InChI=1S/C15H14ClN3O2S/c1-8-12(14(21)18-11-5-3-2-4-10(11)16)22-15(17-8)19-13(20)9-6-7-9/h2-5,9H,6-7H2,1H3,(H,18,21)(H,17,19,20)	DDUKEPBTDBKOOD-UHFFFAOYSA-N	Cc1nc(NC(=O)C2CC2)sc1C(=O)Nc3ccccc3Cl	BroadT	BRD-K36475458	BRD-K36475458-001-07-9	Asinex Ltd.	ASN 05021238			Cc1nc(NC(=O)C2CC2)sc1C(=O)Nc1ccccc1Cl	InChI=1S/C15H14ClN3O2S/c1-8-12(14(21)18-11-5-3-2-4-10(11)16)22-15(17-8)19-13(20)9-6-7-9/h2-5,9H,6-7H2,1H3,(H,18,21)(H,17,19,20)	DDUKEPBTDBKOOD-UHFFFAOYSA-N	335.049525118							109180
MLS000830182	LSM-20578	SID125311368, SID26731437, BRD-K50199413	2810061	InChI=1S/C11H6N2O3S2/c14-9(7-2-1-4-16-7)13-11-12-6-3-5-17-8(6)10(15)18-11/h1-5H,(H,12,13,14)	VFHPAWYPWGGPTF-UHFFFAOYSA-N	O=C(NC1=Nc2ccsc2C(=O)S1)c3occc3	BroadT	BRD-K50199413	BRD-K50199413-001-04-7	Maybridge	HTS 01331			O=C(Nc1nc2ccsc2c(=O)s1)c1ccco1	InChI=1S/C11H6N2O3S2/c14-9(7-2-1-4-16-7)13-11-12-6-3-5-17-8(6)10(15)18-11/h1-5H,(H,12,13,14)	VFHPAWYPWGGPTF-UHFFFAOYSA-N	277.981983452							109181
STK321929	LSM-20579	SID4264987, BRD-K41357471	2194880	InChI=1S/C16H15N3O2/c1-2-7-14(8-3-1)20-11-5-9-15-18-16(19-21-15)13-6-4-10-17-12-13/h1-4,6-8,10,12H,5,9,11H2	YSCVJCOXGROLRZ-UHFFFAOYSA-N	C(COc1ccccc1)Cc2onc(n2)c3cccnc3	BroadT	BRD-K41357471	BRD-K41357471-001-07-5	ChemBridge Corporation	7628054			C(COc1ccccc1)Cc1nc(no1)-c1cccnc1	InChI=1S/C16H15N3O2/c1-2-7-14(8-3-1)20-11-5-9-15-18-16(19-21-15)13-6-4-10-17-12-13/h1-4,6-8,10,12H,5,9,11H2	YSCVJCOXGROLRZ-UHFFFAOYSA-N	281.11642675							109182
AC1MDIY5	LSM-20580	SID7974863, BRD-A01393306	2790354	InChI=1S/C15H19N3OS/c1-10-2-3-11-12(8-10)20-15-13(11)14(16-9-17-15)18-4-6-19-7-5-18/h9-10H,2-8H2,1H3	WYUXRKUQROPDTO-UHFFFAOYSA-N	CC1CCc2c(C1)sc3ncnc(N4CCOCC4)c23	BroadT	BRD-A01393306	BRD-A01393306-001-06-3	ChemBridge Corporation	6960960			CC1CCc2c(C1)sc1ncnc(N3CCOCC3)c21	InChI=1S/C15H19N3OS/c1-10-2-3-11-12(8-10)20-15-13(11)14(16-9-17-15)18-4-6-19-7-5-18/h9-10H,2-8H2,1H3	WYUXRKUQROPDTO-UHFFFAOYSA-N	289.124882948							109183
ST005973	LSM-20581	SID24792125, BRD-K86206896	2222912	InChI=1S/C16H17BrN2O3/c1-21-14-4-2-3-5-15(14)22-11-10-18-16(20)19-13-8-6-12(17)7-9-13/h2-9H,10-11H2,1H3,(H2,18,19,20)	AZKDKZLGMHOLSR-UHFFFAOYSA-N	COc1ccccc1OCCNC(=O)Nc2ccc(Br)cc2	BroadT	BRD-K86206896	BRD-K86206896-001-05-1	ChemBridge Corporation	5924993			COc1ccccc1OCCNC(=O)Nc1ccc(Br)cc1	InChI=1S/C16H17BrN2O3/c1-21-14-4-2-3-5-15(14)22-11-10-18-16(20)19-13-8-6-12(17)7-9-13/h2-9H,10-11H2,1H3,(H2,18,19,20)	AZKDKZLGMHOLSR-UHFFFAOYSA-N	364.042255024							109184
MLS000680738	LSM-43884	SID22416375, BRD-K99438237	844091	InChI=1S/C14H14N2O2/c1-11-5-6-13(18-11)7-8-14(17)16-10-12-4-2-3-9-15-12/h2-9H,10H2,1H3,(H,16,17)/b8-7+	QGEMQFGIZFACQF-BQYQJAHWSA-N	Cc1oc(\C=C\C(=O)NCc2ccccn2)cc1	BroadT	BRD-K99438237	BRD-K99438237-001-05-3	ChemBridge Corporation	7302647			Cc1ccc(\C=C\C(=O)NCc2ccccn2)o1	InChI=1S/C14H14N2O2/c1-11-5-6-13(18-11)7-8-14(17)16-10-12-4-2-3-9-15-12/h2-9H,10H2,1H3,(H,16,17)/b8-7+	QGEMQFGIZFACQF-BQYQJAHWSA-N	242.105527708							
MLS000523526	LSM-20583	SID14723859, BRD-K91408447	3228186	InChI=1S/C24H27N7O2/c1-24(2,3)23-25-20(29-11-13-30(14-12-29)22(32)18-10-7-15-33-18)19-21(26-23)31(28-27-19)16-17-8-5-4-6-9-17/h4-10,15H,11-14,16H2,1-3H3	PITQDHHHZHJSFE-UHFFFAOYSA-N	CC(C)(C)c1nc(N2CCN(CC2)C(=O)c3occc3)c4nnn(Cc5ccccc5)c4n1	BroadT	BRD-K91408447	BRD-K91408447-001-06-8	Asinex Ltd.	ASN 07369280			CC(C)(C)c1nc(N2CCN(CC2)C(=O)c2ccco2)c2nnn(Cc3ccccc3)c2n1	InChI=1S/C24H27N7O2/c1-24(2,3)23-25-20(29-11-13-30(14-12-29)22(32)18-10-7-15-33-18)19-21(26-23)31(28-27-19)16-17-8-5-4-6-9-17/h4-10,15H,11-14,16H2,1-3H3	PITQDHHHZHJSFE-UHFFFAOYSA-N	445.222623174							109186
MLS000767652	LSM-20584	SID26663579, BRD-K38090317	947436	InChI=1S/C18H10FNO2S/c19-14-9-5-4-8-12(14)16-20-17-15(18(21)22-16)13(10-23-17)11-6-2-1-3-7-11/h1-10H	BNUXVRXTVBPVAC-UHFFFAOYSA-N	Fc1ccccc1C2=Nc3scc(c4ccccc4)c3C(=O)O2	BroadT	BRD-K38090317	BRD-K38090317-001-04-2	InterBioScreen Ltd.	STOCK3S-01155			Fc1ccccc1-c1nc2scc(-c3ccccc3)c2c(=O)o1	InChI=1S/C18H10FNO2S/c19-14-9-5-4-8-12(14)16-20-17-15(18(21)22-16)13(10-23-17)11-6-2-1-3-7-11/h1-10H	BNUXVRXTVBPVAC-UHFFFAOYSA-N	323.04162746							109187
SMR000140815	LSM-20585	SID14740295, BRD-K86373565	877438	InChI=1S/C16H14N2O2/c1-11-3-5-13(6-4-11)16-17-15(18-20-16)12-7-9-14(19-2)10-8-12/h3-10H,1-2H3	PDIBOQMOKOEPCF-UHFFFAOYSA-N	COc1ccc(cc1)c2noc(n2)c3ccc(C)cc3	BroadT	BRD-K86373565	BRD-K86373565-001-05-9	ChemBridge Corporation	5928448			COc1ccc(cc1)-c1noc(n1)-c1ccc(C)cc1	InChI=1S/C16H14N2O2/c1-11-3-5-13(6-4-11)16-17-15(18-20-16)12-7-9-14(19-2)10-8-12/h3-10H,1-2H3	PDIBOQMOKOEPCF-UHFFFAOYSA-N	266.105527708							109188
MS-0935	LSM-20586	SID24822093, BRD-K74681953	3744539	InChI=1S/C16H13ClN2O3/c1-9-2-4-12-14(6-9)22-13-5-3-10(18-15(20)8-17)7-11(13)16(21)19-12/h2-7H,8H2,1H3,(H,18,20)(H,19,21)	MCYVKFXWVMREIA-UHFFFAOYSA-N	Cc1ccc2NC(=O)c3cc(NC(=O)CCl)ccc3Oc2c1	BroadT	BRD-K74681953	BRD-K74681953-001-09-1	Key Organics Ltd.	MS-0935			Cc1ccc2NC(=O)c3cc(NC(=O)CCl)ccc3Oc2c1	InChI=1S/C16H13ClN2O3/c1-9-2-4-12-14(6-9)22-13-5-3-10(18-15(20)8-17)7-11(13)16(21)19-12/h2-7H,8H2,1H3,(H,18,20)(H,19,21)	MCYVKFXWVMREIA-UHFFFAOYSA-N	316.061470006							109189
SMR000005029	LSM-20587	SID849507, BRD-A11267889	652000	InChI=1S/C23H28N6O2/c1-17(2)22(28-12-10-27(11-13-28)19-6-4-3-5-7-19)23-24-25-26-29(23)15-18-8-9-20-21(14-18)31-16-30-20/h3-9,14,17,22H,10-13,15-16H2,1-2H3	CFNUTLPYYGUBGM-UHFFFAOYSA-N	CC(C)C(N1CCN(CC1)c2ccccc2)c3nnnn3Cc4ccc5OCOc5c4	BroadT	BRD-A11267889	BRD-A11267889-001-05-4	Asinex Ltd.	ASN 05558008			CC(C)C(N1CCN(CC1)c1ccccc1)c1nnnn1Cc1ccc2OCOc2c1	InChI=1S/C23H28N6O2/c1-17(2)22(28-12-10-27(11-13-28)19-6-4-3-5-7-19)23-24-25-26-29(23)15-18-8-9-20-21(14-18)31-16-30-20/h3-9,14,17,22H,10-13,15-16H2,1-2H3	CFNUTLPYYGUBGM-UHFFFAOYSA-N	420.227374196							109190
AC1LCOKA	LSM-15311	BRD-K49473239	653507	InChI=1S/C21H23FN8/c22-17-6-7-20-19(14-17)23-26-30(20)18-9-11-28(12-10-18)15-21-24-25-27-29(21)13-8-16-4-2-1-3-5-16/h1-7,14,18H,8-13,15H2	IFIMIYHYVWTQAX-UHFFFAOYSA-N	Fc1ccc2c(c1)nnn2C3CCN(Cc4nnnn4CCc5ccccc5)CC3	BroadT	BRD-K49473239	BRD-K49473239-003-05-5	Asinex Ltd.	ASN 06367263		Cl	Fc1ccc2n(nnc2c1)C1CCN(Cc2nnnn2CCc2ccccc2)CC1.Cl	InChI=1S/C21H23FN8.ClH/c22-17-6-7-20-19(14-17)23-26-30(20)18-9-11-28(12-10-18)15-21-24-25-27-29(21)13-8-16-4-2-1-3-5-16;/h1-7,14,18H,8-13,15H2;1H	DRPOVSSKRYLEQH-UHFFFAOYSA-N	406.202971016							103958, 103958
CID_762523	LSM-20588	BRD-A30109207	91896982	InChI=1S/C12H10ClNOS/c13-7-4-5-11-9(6-7)14-8-2-1-3-10(15)12(8)16-11/h4-6,12H,1-3H2	QXHGPKXXVDTTNH-UHFFFAOYSA-N	Clc1ccc2SC3C(=O)CCCC3=Nc2c1	BroadT	BRD-A30109207	BRD-A30109207-001-07-6	InterBioScreen Ltd.	STOCK4S-78714			Clc1ccc2SC3C(=O)CCCC3=Nc2c1	InChI=1S/C12H10ClNOS/c13-7-4-5-11-9(6-7)14-8-2-1-3-10(15)12(8)16-11/h4-6,12H,1-3H2	QXHGPKXXVDTTNH-UHFFFAOYSA-N	251.01716235							109191
N-(4-Oxo-2-phenyl-1,4-dihydroquinazolin-3(2H)-yl)benzenesulfonamide	LSM-20589	SID24813320, BRD-A81830440	3629588	InChI=1S/C20H17N3O3S/c24-20-17-13-7-8-14-18(17)21-19(15-9-3-1-4-10-15)23(20)22-27(25,26)16-11-5-2-6-12-16/h1-14,19,21-22H	ZTQWHZCHQRNPHY-UHFFFAOYSA-N	O=C1N(NS(=O)(=O)c2ccccc2)C(Nc3ccccc13)c4ccccc4	BroadT	BRD-A81830440	BRD-A81830440-001-06-4	ChemDiv Inc.	6267-0049			O=C1N(NS(=O)(=O)c2ccccc2)C(Nc2ccccc12)c1ccccc1	InChI=1S/C20H17N3O3S/c24-20-17-13-7-8-14-18(17)21-19(15-9-3-1-4-10-15)23(20)22-27(25,26)16-11-5-2-6-12-16/h1-14,19,21-22H	ZTQWHZCHQRNPHY-UHFFFAOYSA-N	379.099062124							109192
2-(Furan-2-yl)-5-[(2-methoxyphenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one	LSM-20590	BRD-K97922547	3237150	InChI=1S/C16H11N3O3S/c1-21-11-6-3-2-5-10(11)9-13-15(20)19-16(23-13)17-14(18-19)12-7-4-8-22-12/h2-9H,1H3	ARTRSUNPGSVXOL-UHFFFAOYSA-N	COc1ccccc1C=C2Sc3nc(nn3C2=O)c4occc4	BroadT	BRD-K97922547	BRD-K97922547-001-05-3	ChemDiv Inc.	6672-0269			COc1ccccc1C=c1sc2nc(nn2c1=O)-c1ccco1	InChI=1S/C16H11N3O3S/c1-21-11-6-3-2-5-10(11)9-13-15(20)19-16(23-13)17-14(18-19)12-7-4-8-22-12/h2-9H,1H3	ARTRSUNPGSVXOL-UHFFFAOYSA-N	325.052111932							109193
MLS001005187	LSM-20591	SID24835552, BRD-K94339600	1215015	InChI=1S/C16H17NOS/c1-11-6-8-13(9-7-11)17-16(18)15-10-12-4-2-3-5-14(12)19-15/h6-10H,2-5H2,1H3,(H,17,18)	MGUJPNBADSXKKA-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2cc3CCCCc3s2)cc1	BroadT	BRD-K94339600	BRD-K94339600-001-05-7	Enamine Ltd.	ZT-7410604			Cc1ccc(NC(=O)c2cc3CCCCc3s2)cc1	InChI=1S/C16H17NOS/c1-11-6-8-13(9-7-11)17-16(18)15-10-12-4-2-3-5-14(12)19-15/h6-10H,2-5H2,1H3,(H,17,18)	MGUJPNBADSXKKA-UHFFFAOYSA-N	271.103084864							109194
SMR000006869	LSM-20592	SID842246, BRD-A76119771	644506	InChI=1S/C20H20N4O3S2/c1-27-15-8-4-13(5-9-15)11-21-19(25)18(17-3-2-10-28-17)24(14-6-7-14)20(26)16-12-29-23-22-16/h2-5,8-10,12,14,18H,6-7,11H2,1H3,(H,21,25)	QWEAYGBNBYCHCF-UHFFFAOYSA-N	COc1ccc(CNC(=O)C(N(C2CC2)C(=O)c3csnn3)c4cccs4)cc1	BroadT	BRD-A76119771	BRD-A76119771-001-05-0	Asinex Ltd.	ASN 06567185			COc1ccc(CNC(=O)C(N(C2CC2)C(=O)c2csnn2)c2cccs2)cc1	InChI=1S/C20H20N4O3S2/c1-27-15-8-4-13(5-9-15)11-21-19(25)18(17-3-2-10-28-17)24(14-6-7-14)20(26)16-12-29-23-22-16/h2-5,8-10,12,14,18H,6-7,11H2,1H3,(H,21,25)	QWEAYGBNBYCHCF-UHFFFAOYSA-N	428.09768192							109195
4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile	LSM-20593	SID14734767, BRD-K26974827	755479	InChI=1S/C22H22N4/c1-25(2)22-20(15-23)21(13-14-24-22)26(16-18-9-5-3-6-10-18)17-19-11-7-4-8-12-19/h3-14H,16-17H2,1-2H3	FSZZPPMHTJCPBD-UHFFFAOYSA-N	CN(C)c1nccc(N(Cc2ccccc2)Cc3ccccc3)c1C#N	BroadT	BRD-K26974827	BRD-K26974827-001-05-1	ChemBridge Corporation	6048567			CN(C)c1nccc(N(Cc2ccccc2)Cc2ccccc2)c1C#N	InChI=1S/C22H22N4/c1-25(2)22-20(15-23)21(13-14-24-22)26(16-18-9-5-3-6-10-18)17-19-11-7-4-8-12-19/h3-14H,16-17H2,1-2H3	FSZZPPMHTJCPBD-UHFFFAOYSA-N	342.184446744							109196
T0519-5433	LSM-20594	SID24828250, BRD-K60176877	4033867	InChI=1S/C16H13N3/c1-11-5-4-8-19-10-15(18-16(11)19)13-9-17-14-7-3-2-6-12(13)14/h2-10,17H,1H3	LCKFGODNUWTNDK-UHFFFAOYSA-N	Cc1cccn2cc(nc12)c3c[nH]c4ccccc34	BroadT	BRD-K60176877	BRD-K60176877-001-05-9	Enamine Ltd.	T0519-5433			Cc1cccn2cc(nc12)-c1c[nH]c2ccccc12	InChI=1S/C16H13N3/c1-11-5-4-8-19-10-15(18-16(11)19)13-9-17-14-7-3-2-6-12(13)14/h2-10,17H,1H3	LCKFGODNUWTNDK-UHFFFAOYSA-N	247.110947446							109197
(2E)-N-(3-chlorophenyl)-2-cyano-3-(pyridin-3-yl)acrylamide	LSM-43885	SID24792129, BRD-K45729009	877228	InChI=1S/C15H10ClN3O/c16-13-4-1-5-14(8-13)19-15(20)12(9-17)7-11-3-2-6-18-10-11/h1-8,10H,(H,19,20)/b12-7+	CXDFAGGCALQOEA-KPKJPENVSA-N	Clc1cccc(NC(=O)\C(=C\c2cccnc2)\C#N)c1	BroadT	BRD-K45729009	BRD-K45729009-001-05-6	ChemBridge Corporation	5919379			Clc1cccc(NC(=O)C(=C\c2cccnc2)\C#N)c1	InChI=1S/C15H10ClN3O/c16-13-4-1-5-14(8-13)19-15(20)12(9-17)7-11-3-2-6-18-10-11/h1-8,10H,(H,19,20)/b12-7+	CXDFAGGCALQOEA-KPKJPENVSA-N	283.05123968							
AC1NXENI	LSM-43886	SID17510071, BRD-K27945373	5803692	InChI=1S/C17H15NO2/c1-20-15-4-5-16-13(11-15)2-3-14(17(16)19)10-12-6-8-18-9-7-12/h4-11H,2-3H2,1H3/b14-10-	OMJQCRYAFOMMKI-UVTDQMKNSA-N	COc1ccc2C(=O)\C(=C/c3ccncc3)\CCc2c1	BroadT	BRD-K27945373	BRD-K27945373-001-05-8	ChemDiv Inc.	C151-0282			COc1ccc2C(=O)\C(CCc2c1)=C/c1ccncc1	InChI=1S/C17H15NO2/c1-20-15-4-5-16-13(11-15)2-3-14(17(16)19)10-12-6-8-18-9-7-12/h4-11H,2-3H2,1H3/b14-10-	OMJQCRYAFOMMKI-UVTDQMKNSA-N	265.11027873							
MLS000123556	LSM-20597	SID24274779, SID14722923, BRD-K36298981	893928	InChI=1S/C19H17NO3S/c1-13(21)14-4-6-15(7-5-14)20-16(9-11-19(22)23)8-10-17(20)18-3-2-12-24-18/h2-8,10,12H,9,11H2,1H3,(H,22,23)	VXZLRFFNODAIOP-UHFFFAOYSA-N	CC(=O)c1ccc(cc1)n2c(CCC(=O)O)ccc2c3cccs3	BroadT	BRD-K36298981	BRD-K36298981-001-06-3	Asinex Ltd.	BAS 06347807			CC(=O)c1ccc(cc1)-n1c(CCC(O)=O)ccc1-c1cccs1	InChI=1S/C19H17NO3S/c1-13(21)14-4-6-15(7-5-14)20-16(9-11-19(22)23)8-10-17(20)18-3-2-12-24-18/h2-8,10,12H,9,11H2,1H3,(H,22,23)	VXZLRFFNODAIOP-UHFFFAOYSA-N	339.092914104							109200
ZINC01907589	LSM-20598	BRD-K33379303	6740372	InChI=1S/C20H17N5O/c1-13-16(15-9-5-6-10-17(15)22-13)12-21-25-20(26)19-11-18(23-24-19)14-7-3-2-4-8-14/h2-12,22H,1H3,(H,23,24)(H,25,26)	FTURORQJMPESRY-UHFFFAOYSA-N	Cc1[nH]c2ccccc2c1C=NNC(=O)c3cc([nH]n3)c4ccccc4	BroadT	BRD-K33379303	BRD-K33379303-001-05-7	InterBioScreen Ltd.	STOCK3S-37324			Cc1[nH]c2ccccc2c1C=NNC(=O)c1cc([nH]n1)-c1ccccc1	InChI=1S/C20H17N5O/c1-13-16(15-9-5-6-10-17(15)22-13)12-21-25-20(26)19-11-18(23-24-19)14-7-3-2-4-8-14/h2-12,22H,1H3,(H,23,24)(H,25,26)	FTURORQJMPESRY-UHFFFAOYSA-N	343.143310214							
AC1LHXHZ	LSM-20599	SID4264292, BRD-K33514462	894549	InChI=1S/C11H11N3OS2/c1-16-11-13-10(17-14-11)12-9(15)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,12,13,14,15)	FKPXPIKZDFLVLQ-UHFFFAOYSA-N	CSc1nsc(NC(=O)Cc2ccccc2)n1	BroadT	BRD-K33514462	BRD-K33514462-001-05-6	ChemBridge Corporation	7626627			CSc1nsc(NC(=O)Cc2ccccc2)n1	InChI=1S/C11H11N3OS2/c1-16-11-13-10(17-14-11)12-9(15)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,12,13,14,15)	FKPXPIKZDFLVLQ-UHFFFAOYSA-N	265.034353382							109202
SMR000035431	LSM-20600	SID865338, BRD-A01465246	666592	InChI=1S/C20H19N3O3S/c1-25-15-6-4-14(5-7-15)17-9-19(24)23-12-22(11-16-3-2-8-26-16)13-27-20(23)18(17)10-21/h2-8,17H,9,11-13H2,1H3	AJHNSIOCFMVBSS-UHFFFAOYSA-N	COc1ccc(cc1)C2CC(=O)N3CN(Cc4occc4)CSC3=C2C#N	BroadT	BRD-A01465246	BRD-A01465246-001-07-0	InterBioScreen Ltd.	STOCK5S-40179			COc1ccc(cc1)C1CC(=O)N2CN(Cc3ccco3)CSC2=C1C#N	InChI=1S/C20H19N3O3S/c1-25-15-6-4-14(5-7-15)17-9-19(24)23-12-22(11-16-3-2-8-26-16)13-27-20(23)18(17)10-21/h2-8,17H,9,11-13H2,1H3	AJHNSIOCFMVBSS-UHFFFAOYSA-N	381.114712188							109203
T5238519	LSM-20601	SID26657806, BRD-A79149973	4023174	InChI=1S/C21H21N5O4S/c1-14(28)24-15-7-9-16(10-8-15)31(29,30)19(13-22)20-21(23-11-4-12-27)26-18-6-3-2-5-17(18)25-20/h2-3,5-10,19,27H,4,11-12H2,1H3,(H,23,26)(H,24,28)	NNAYASCVTJLOSH-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)S(=O)(=O)C(C#N)c2nc3ccccc3nc2NCCCO	BroadT	BRD-A79149973	BRD-A79149973-001-05-0	Enamine Ltd.	T5238519			CC(=O)Nc1ccc(cc1)S(=O)(=O)C(C#N)c1nc2ccccc2nc1NCCCO	InChI=1S/C21H21N5O4S/c1-14(28)24-15-7-9-16(10-8-15)31(29,30)19(13-22)20-21(23-11-4-12-27)26-18-6-3-2-5-17(18)25-20/h2-3,5-10,19,27H,4,11-12H2,1H3,(H,23,26)(H,24,28)	NNAYASCVTJLOSH-UHFFFAOYSA-N	439.131424892							109204
SMR000118833	LSM-20602	SID14721384, BRD-K46411922	3214173	InChI=1S/C19H18N6OS2/c1-2-16-23-24-18(28-16)22-15(26)12-27-19-21-14-9-6-10-20-17(14)25(19)11-13-7-4-3-5-8-13/h3-10H,2,11-12H2,1H3,(H,22,24,26)	TVZRJQBQOACIQC-UHFFFAOYSA-N	CCc1nnc(NC(=O)CSc2nc3cccnc3n2Cc4ccccc4)s1	BroadT	BRD-K46411922	BRD-K46411922-001-05-4	Asinex Ltd.	ASN 05923351			CCc1nnc(NC(=O)CSc2nc3cccnc3n2Cc2ccccc2)s1	InChI=1S/C19H18N6OS2/c1-2-16-23-24-18(28-16)22-15(26)12-27-19-21-14-9-6-10-20-17(14)25(19)11-13-7-4-3-5-8-13/h3-10H,2,11-12H2,1H3,(H,22,24,26)	TVZRJQBQOACIQC-UHFFFAOYSA-N	410.098350636							109205
MLS000698066	LSM-43887	SID22413802, BRD-K71335450	5455628	InChI=1S/C15H12N2O2S2/c1-19-11-6-4-10(5-7-11)17-14(18)13(16-15(17)20)9-12-3-2-8-21-12/h2-9H,1H3,(H,16,20)/b13-9-	OVQGUZGGWJZSBV-LCYFTJDESA-N	COc1ccc(cc1)N2C(=S)N\C(=C/c3cccs3)\C2=O	BroadT	BRD-K71335450	BRD-K71335450-001-05-3	Specs	AN-940/15356003			COc1ccc(cc1)N1C(=S)N\C(=C/c2cccs2)C1=O	InChI=1S/C15H12N2O2S2/c1-19-11-6-4-10(5-7-11)17-14(18)13(16-15(17)20)9-12-3-2-8-21-12/h2-9H,1H3,(H,16,20)/b13-9-	OVQGUZGGWJZSBV-LCYFTJDESA-N	316.034019024							
T0507-9590	LSM-43888	SID22405605, BRD-K43801981	2346338	InChI=1S/C17H17NO5/c1-21-14-5-2-4-13(10-14)7-8-17(20)23-12-16(19)18-11-15-6-3-9-22-15/h2-10H,11-12H2,1H3,(H,18,19)/b8-7+	QYQQQJYXLDPSBO-BQYQJAHWSA-N	COc1cccc(\C=C\C(=O)OCC(=O)NCc2occc2)c1	BroadT	BRD-K43801981	BRD-K43801981-001-05-7	Enamine Ltd.	T0507-9590			COc1cccc(\C=C\C(=O)OCC(=O)NCc2ccco2)c1	InChI=1S/C17H17NO5/c1-21-14-5-2-4-13(10-14)7-8-17(20)23-12-16(19)18-11-15-6-3-9-22-15/h2-10H,11-12H2,1H3,(H,18,19)/b8-7+	QYQQQJYXLDPSBO-BQYQJAHWSA-N	315.110672654							
MLS000704350	LSM-43889	SID24797698, BRD-K68151700	6059452	InChI=1S/C24H20N4O5/c1-15-6-2-3-10-19(15)25-21(29)14-28-22(30)20(26-24(28)33)13-18-9-5-11-27(18)17-8-4-7-16(12-17)23(31)32/h2-13H,14H2,1H3,(H,25,29)(H,26,33)(H,31,32)/b20-13-	ACUWQONVBQJTOB-MOSHPQCFSA-N	Cc1ccccc1NC(=O)CN2C(=O)N\C(=C/c3cccn3c4cccc(c4)C(=O)O)\C2=O	BroadT	BRD-K68151700	BRD-K68151700-001-06-5	Specs	AN-648/41664942			Cc1ccccc1NC(=O)CN1C(=O)N\C(=C/c2cccn2-c2cccc(c2)C(O)=O)C1=O	InChI=1S/C24H20N4O5/c1-15-6-2-3-10-19(15)25-21(29)14-28-22(30)20(26-24(28)33)13-18-9-5-11-27(18)17-8-4-7-16(12-17)23(31)32/h2-13H,14H2,1H3,(H,25,29)(H,26,33)(H,31,32)/b20-13-	ACUWQONVBQJTOB-MOSHPQCFSA-N	444.14336978							
AC1O9AKB	LSM-20606	BRD-K34630363	6753336	InChI=1S/C18H15N5O4/c1-11(14-7-2-3-8-17(14)24)19-22-18(25)16-10-15(20-21-16)12-5-4-6-13(9-12)23(26)27/h2-10,24H,1H3,(H,20,21)(H,22,25)	XIMDILWEQPWLEW-UHFFFAOYSA-N	CC(=NNC(=O)c1cc([nH]n1)c2cccc(c2)[N+](=O)[O-])c3ccccc3O	BroadT	BRD-K34630363	BRD-K34630363-001-07-5	ChemBridge Corporation	5968310			CC(=NNC(=O)c1cc([nH]n1)-c1cccc(c1)[N+]([O-])=O)c1ccccc1O	InChI=1S/C18H15N5O4/c1-11(14-7-2-3-8-17(14)24)19-22-18(25)16-10-15(20-21-16)12-5-4-6-13(9-12)23(26)27/h2-10,24H,1H3,(H,20,21)(H,22,25)	XIMDILWEQPWLEW-UHFFFAOYSA-N	365.11240401							
MLS000704062	LSM-20607	SID22414437, SID87457230, BRD-K28513206	994824	InChI=1S/C18H16N4O2S/c1-11-16(12-4-6-13(24-3)7-5-12)14(10-19)18(25-11)21-17(23)15-8-9-20-22(15)2/h4-9H,1-3H3,(H,21,23)	QPSQPHLXEVIHPZ-UHFFFAOYSA-N	COc1ccc(cc1)c2c(C)sc(NC(=O)c3ccnn3C)c2C#N	BroadT	BRD-K28513206	BRD-K28513206-001-07-2	Specs	AK-968/41018197			COc1ccc(cc1)-c1c(C)sc(NC(=O)c2ccnn2C)c1C#N	InChI=1S/C18H16N4O2S/c1-11-16(12-4-6-13(24-3)7-5-12)14(10-19)18(25-11)21-17(23)15-8-9-20-22(15)2/h4-9H,1-3H3,(H,21,23)	QPSQPHLXEVIHPZ-UHFFFAOYSA-N	352.099396482							109210
STK574030	LSM-20608	SID17513247, BRD-K85438123	1835126	InChI=1S/C20H19N5O3S/c1-26-13-6-4-12(5-7-13)15-11-16(22-21-15)19-23-24-20(29)25(19)17-10-14(27-2)8-9-18(17)28-3/h4-11H,1-3H3,(H,21,22)(H,24,29)	CIVGOFLQHLYHQX-UHFFFAOYSA-N	COc1ccc(cc1)c2cc([nH]n2)c3nnc(S)n3c4cc(OC)ccc4OC	BroadT	BRD-K85438123	BRD-K85438123-001-06-4	InterBioScreen Ltd.	STOCK3S-47376			COc1ccc(cc1)-c1cc([nH]n1)-c1nnc(S)n1-c1cc(OC)ccc1OC	InChI=1S/C20H19N5O3S/c1-26-13-6-4-12(5-7-13)15-11-16(22-21-15)19-23-24-20(29)25(19)17-10-14(27-2)8-9-18(17)28-3/h4-11H,1-3H3,(H,21,22)(H,24,29)	CIVGOFLQHLYHQX-UHFFFAOYSA-N	409.120860208							109211
BAS 06660432	LSM-20609	SID846794, BRD-K83060022	649187	InChI=1S/C15H17N3O4S/c19-13(9-18-14(20)10-23-15(18)21)16-11-1-3-12(4-2-11)17-5-7-22-8-6-17/h1-4H,5-10H2,(H,16,19)	OEBSTKZXMDTFCT-UHFFFAOYSA-N	O=C(CN1C(=O)CSC1=O)Nc2ccc(cc2)N3CCOCC3	BroadT	BRD-K83060022	BRD-K83060022-001-05-2	Asinex Ltd.	BAS 06660432			O=C(CN1C(=O)CSC1=O)Nc1ccc(cc1)N1CCOCC1	InChI=1S/C15H17N3O4S/c19-13(9-18-14(20)10-23-15(18)21)16-11-1-3-12(4-2-11)17-5-7-22-8-6-17/h1-4H,5-10H2,(H,16,19)	OEBSTKZXMDTFCT-UHFFFAOYSA-N	335.093976744							109212
Propyl 4-[(3,6-dichloro-2-methoxybenzoyl)amino]benzoate	LSM-20610	SID17432854, BRD-K54884347	1576321	InChI=1S/C18H17Cl2NO4/c1-3-10-25-18(23)11-4-6-12(7-5-11)21-17(22)15-13(19)8-9-14(20)16(15)24-2/h4-9H,3,10H2,1-2H3,(H,21,22)	VVJJAMABZXTOCM-UHFFFAOYSA-N	CCCOC(=O)c1ccc(NC(=O)c2c(Cl)ccc(Cl)c2OC)cc1	BroadT	BRD-K54884347	BRD-K54884347-001-05-8	ChemBridge Corporation	6049471			CCCOC(=O)c1ccc(NC(=O)c2c(Cl)ccc(Cl)c2OC)cc1	InChI=1S/C18H17Cl2NO4/c1-3-10-25-18(23)11-4-6-12(7-5-11)21-17(22)15-13(19)8-9-14(20)16(15)24-2/h4-9H,3,10H2,1-2H3,(H,21,22)	VVJJAMABZXTOCM-UHFFFAOYSA-N	381.053463454							109213
AC1ME7ZO	LSM-20611	BRD-K51725256	2824404	InChI=1S/C15H11Cl2NO3/c16-9-4-5-10(12(17)8-9)15(19)21-18-13-2-1-3-14-11(13)6-7-20-14/h4-8H,1-3H2	BWSJXFPGAQJCJD-UHFFFAOYSA-N	Clc1ccc(C(=O)ON=C2CCCc3occc23)c(Cl)c1	BroadT	BRD-K51725256	BRD-K51725256-001-05-5	Maybridge	MWP 00914			Clc1ccc(C(=O)ON=C2CCCc3occc23)c(Cl)c1	InChI=1S/C15H11Cl2NO3/c16-9-4-5-10(12(17)8-9)15(19)21-18-13-2-1-3-14-11(13)6-7-20-14/h4-8H,1-3H2	BWSJXFPGAQJCJD-UHFFFAOYSA-N	323.011598642							109214
Butyl 4-{[(3,4-dimethoxyphenyl)carbamoyl]amino}benzoate	LSM-20612	SID14740160, BRD-K64156640	1934597	InChI=1S/C20H24N2O5/c1-4-5-12-27-19(23)14-6-8-15(9-7-14)21-20(24)22-16-10-11-17(25-2)18(13-16)26-3/h6-11,13H,4-5,12H2,1-3H3,(H2,21,22,24)	CPPQMAVAROLTBI-UHFFFAOYSA-N	CCCCOC(=O)c1ccc(NC(=O)Nc2ccc(OC)c(OC)c2)cc1	BroadT	BRD-K64156640	BRD-K64156640-001-05-3	ChemBridge Corporation	5926790			CCCCOC(=O)c1ccc(NC(=O)Nc2ccc(OC)c(OC)c2)cc1	InChI=1S/C20H24N2O5/c1-4-5-12-27-19(23)14-6-8-15(9-7-14)21-20(24)22-16-10-11-17(25-2)18(13-16)26-3/h6-11,13H,4-5,12H2,1-3H3,(H2,21,22,24)	CPPQMAVAROLTBI-UHFFFAOYSA-N	372.168521888							109215
T0507-0234	LSM-20613	SID24829980, BRD-K08744819	2349790	InChI=1S/C17H26N2S/c1-17(2,3)14-11-7-8-12-15(14)19-16(20)18-13-9-5-4-6-10-13/h7-8,11-13H,4-6,9-10H2,1-3H3,(H2,18,19,20)	YGRYFCZQGYTLSY-UHFFFAOYSA-N	CC(C)(C)c1ccccc1N=C(S)NC2CCCCC2	BroadT	BRD-K08744819	BRD-K08744819-001-05-0	Enamine Ltd.	T0507-0234			CC(C)(C)c1ccccc1N=C(S)NC1CCCCC1	InChI=1S/C17H26N2S/c1-17(2,3)14-11-7-8-12-15(14)19-16(20)18-13-9-5-4-6-10-13/h7-8,11-13H,4-6,9-10H2,1-3H3,(H2,18,19,20)	YGRYFCZQGYTLSY-UHFFFAOYSA-N	290.181669542							109216
3-Methoxycinnoline	LSM-20614	SID26728325, BRD-K88140422	560720	InChI=1S/C9H8N2O/c1-12-9-6-7-4-2-3-5-8(7)10-11-9/h2-6H,1H3	XZPZVFAARDDFLG-UHFFFAOYSA-N	COc1cc2ccccc2nn1	BroadT	BRD-K88140422	BRD-K88140422-001-05-3	Maybridge	JFD 03445			COc1cc2ccccc2nn1	InChI=1S/C9H8N2O/c1-12-9-6-7-4-2-3-5-8(7)10-11-9/h2-6H,1H3	XZPZVFAARDDFLG-UHFFFAOYSA-N	160.063662896							109217
ASN 07162222	LSM-20615	SID14722887, BRD-K75536516	1432096	InChI=1S/C17H13ClN6O3/c18-11-4-1-3-10(7-11)9-24-15-13(22-23-24)16(25)21-14(20-15)17(26)19-8-12-5-2-6-27-12/h1-7H,8-9H2,(H,19,26)(H,20,21,25)	RPSTZWISHZSYDI-UHFFFAOYSA-N	Oc1nc(nc2c1nnn2Cc3cccc(Cl)c3)C(=O)NCc4occc4	BroadT	BRD-K75536516	BRD-K75536516-001-05-4	Asinex Ltd.	ASN 07162222			Oc1nc(nc2n(Cc3cccc(Cl)c3)nnc12)C(=O)NCc1ccco1	InChI=1S/C17H13ClN6O3/c18-11-4-1-3-10(7-11)9-24-15-13(22-23-24)16(25)21-14(20-15)17(26)19-8-12-5-2-6-27-12/h1-7H,8-9H2,(H,19,26)(H,20,21,25)	RPSTZWISHZSYDI-UHFFFAOYSA-N	384.073766046							
SMR000095091	LSM-20616	SID7965709, BRD-K62681880	5307782	InChI=1S/C20H19N3O2S/c1-22-17(19(24)21-9-7-13-8-10-26-12-13)11-15-18(22)14-5-3-4-6-16(14)23(2)20(15)25/h3-6,8,10-12H,7,9H2,1-2H3,(H,21,24)	UHLSOHRAJDHHDV-UHFFFAOYSA-N	CN1C(=O)c2cc(C(=O)NCCc3ccsc3)n(C)c2c4ccccc14	BroadT	BRD-K62681880	BRD-K62681880-001-05-1	ChemDiv Inc.	C593-0684			Cn1c(cc2c1c1ccccc1n(C)c2=O)C(=O)NCCc1ccsc1	InChI=1S/C20H19N3O2S/c1-22-17(19(24)21-9-7-13-8-10-26-12-13)11-15-18(22)14-5-3-4-6-16(14)23(2)20(15)25/h3-6,8,10-12H,7,9H2,1-2H3,(H,21,24)	UHLSOHRAJDHHDV-UHFFFAOYSA-N	365.119797568							109219
T0510-6817	LSM-20617	SID22409651, BRD-K29335335	2384164	InChI=1S/C20H26N2O3S/c1-24-16-10-8-14(9-11-16)19-17(12-13-18(23)25-2)26-20(22-19)21-15-6-4-3-5-7-15/h8-11,15H,3-7,12-13H2,1-2H3,(H,21,22)	FLYURFLDYAXJMJ-UHFFFAOYSA-N	COC(=O)CCc1sc(NC2CCCCC2)nc1c3ccc(OC)cc3	BroadT	BRD-K29335335	BRD-K29335335-001-06-5	Enamine Ltd.	T0510-6817			COC(=O)CCc1sc(NC2CCCCC2)nc1-c1ccc(OC)cc1	InChI=1S/C20H26N2O3S/c1-24-16-10-8-14(9-11-16)19-17(12-13-18(23)25-2)26-20(22-19)21-15-6-4-3-5-7-15/h8-11,15H,3-7,12-13H2,1-2H3,(H,21,22)	FLYURFLDYAXJMJ-UHFFFAOYSA-N	374.166413402							109220
3,6-Dichloro-n-(pyridin-3-ylmethyl)-1-benzothiophene-2-carboxamide	LSM-20618	SID17413768, BRD-K43291761	935329	InChI=1S/C15H10Cl2N2OS/c16-10-3-4-11-12(6-10)21-14(13(11)17)15(20)19-8-9-2-1-5-18-7-9/h1-7H,8H2,(H,19,20)	QRJSGOWRBQNHBU-UHFFFAOYSA-N	Clc1ccc2c(Cl)c(sc2c1)C(=O)NCc3cccnc3	BroadT	BRD-K43291761	BRD-K43291761-001-06-5	ChemBridge Corporation	7937901			Clc1c(sc2cc(Cl)ccc12)C(=O)NCc1cccnc1	InChI=1S/C15H10Cl2N2OS/c16-10-3-4-11-12(6-10)21-14(13(11)17)15(20)19-8-9-2-1-5-18-7-9/h1-7H,8H2,(H,19,20)	QRJSGOWRBQNHBU-UHFFFAOYSA-N	335.98908907							109221
AC1MKP92	LSM-20619	SID14720848, BRD-A91543377	3207680	InChI=1S/C18H19N3O2S/c1-12-4-2-5-13-8-14(9-19)18(21-17(12)13)24-11-16(22)20-10-15-6-3-7-23-15/h2,4-5,8,15H,3,6-7,10-11H2,1H3,(H,20,22)	HKLLGDGHTQAYBR-UHFFFAOYSA-N	Cc1cccc2cc(C#N)c(SCC(=O)NCC3CCCO3)nc12	BroadT	BRD-A91543377	BRD-A91543377-001-05-0	Asinex Ltd.	ASN 05546033			Cc1cccc2cc(C#N)c(SCC(=O)NCC3CCCO3)nc12	InChI=1S/C18H19N3O2S/c1-12-4-2-5-13-8-14(9-19)18(21-17(12)13)24-11-16(22)20-10-15-6-3-7-23-15/h2,4-5,8,15H,3,6-7,10-11H2,1H3,(H,20,22)	HKLLGDGHTQAYBR-UHFFFAOYSA-N	341.119797568							109222
T5755444	LSM-20620	SID843467, BRD-K97246258	645762	InChI=1S/C16H14N4O3/c1-23-16(22)11-5-4-6-12(9-11)17-15(21)10-20-14-8-3-2-7-13(14)18-19-20/h2-9H,10H2,1H3,(H,17,21)	WKORLPDHDZUTLF-UHFFFAOYSA-N	COC(=O)c1cccc(NC(=O)Cn2nnc3ccccc23)c1	BroadT	BRD-K97246258	BRD-K97246258-001-06-4	Asinex Ltd.	ASN 03017770			COC(=O)c1cccc(NC(=O)Cn2nnc3ccccc23)c1	InChI=1S/C16H14N4O3/c1-23-16(22)11-5-4-6-12(9-11)17-15(21)10-20-14-8-3-2-7-13(14)18-19-20/h2-9H,10H2,1H3,(H,17,21)	WKORLPDHDZUTLF-UHFFFAOYSA-N	310.106590348							109223
T5347015	LSM-20621	SID24839828, SID3715151, BRD-K08518249	2571429	InChI=1S/C20H20N2O8S2/c1-4-28-20(26)16-10(2)15-17(24)21-13(22-18(15)32-16)8-31-9-14(23)29-7-11-5-6-12(30-11)19(25)27-3/h5-6H,4,7-9H2,1-3H3,(H,21,22,24)	ROCDSTISGVINIB-UHFFFAOYSA-N	CCOC(=O)c1sc2nc(CSCC(=O)OCc3oc(cc3)C(=O)OC)nc(O)c2c1C	BroadT	BRD-K08518249	BRD-K08518249-001-05-8	Enamine Ltd.	T5347015			CCOC(=O)c1sc2nc(CSCC(=O)OCc3ccc(o3)C(=O)OC)nc(O)c2c1C	InChI=1S/C20H20N2O8S2/c1-4-28-20(26)16-10(2)15-17(24)21-13(22-18(15)32-16)8-31-9-14(23)29-7-11-5-6-12(30-11)19(25)27-3/h5-6H,4,7-9H2,1-3H3,(H,21,22,24)	ROCDSTISGVINIB-UHFFFAOYSA-N	480.066107							109224
4F-056	LSM-20622	SID24824341, BRD-K73694358	1475763	InChI=1S/C14H10ClN7O/c15-9-1-3-10(4-2-9)22-13(17)11(5-16)12(20-14(22)23)6-21-8-18-7-19-21/h1-4,7-8,17H,6H2,(H,20,23)	NZVGAIZFQMFMLI-UHFFFAOYSA-N	Clc1ccc(cc1)N2C(=O)NC(=C(C#N)C2=N)Cn3cncn3	BroadT	BRD-K73694358	BRD-K73694358-001-06-2	Key Organics Ltd.	4F-056			Clc1ccc(cc1)-n1c(=O)[nH]c(Cn2cncn2)c(C#N)c1=N	InChI=1S/C14H10ClN7O/c15-9-1-3-10(4-2-9)22-13(17)11(5-16)12(20-14(22)23)6-21-8-18-7-19-21/h1-4,7-8,17H,6H2,(H,20,23)	NZVGAIZFQMFMLI-UHFFFAOYSA-N	327.06353572							
N-(4-Chlorobenzyl)-n'-[2-(3,4-dimethoxyphenyl)ethyl]ethanediamide	LSM-20623	SID24810981, BRD-K14096863	2053597	InChI=1S/C19H21ClN2O4/c1-25-16-8-5-13(11-17(16)26-2)9-10-21-18(23)19(24)22-12-14-3-6-15(20)7-4-14/h3-8,11H,9-10,12H2,1-2H3,(H,21,23)(H,22,24)	UXAWUPHQRVJVGZ-UHFFFAOYSA-N	COc1ccc(CCNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1OC	BroadT	BRD-K14096863	BRD-K14096863-001-06-0	ChemDiv Inc.	4031-0927			COc1ccc(CCNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1OC	InChI=1S/C19H21ClN2O4/c1-25-16-8-5-13(11-17(16)26-2)9-10-21-18(23)19(24)22-12-14-3-6-15(20)7-4-14/h3-8,11H,9-10,12H2,1-2H3,(H,21,23)(H,22,24)	UXAWUPHQRVJVGZ-UHFFFAOYSA-N	376.118984882							109226
SMR000093909	LSM-20624	SID24838741, SID7967060, BRD-A03797239	5308601	InChI=1S/C24H20N2O5/c27-24-18-4-2-1-3-17(18)23(25-16-6-8-19-22(12-16)29-10-9-28-19)26(24)13-15-5-7-20-21(11-15)31-14-30-20/h1-8,11-12,23,25H,9-10,13-14H2	CAJQOVPEDOVOOP-UHFFFAOYSA-N	O=C1N(Cc2ccc3OCOc3c2)C(Nc4ccc5OCCOc5c4)c6ccccc16	BroadT	BRD-A03797239	BRD-A03797239-001-05-7	ChemDiv Inc.	C430-0146			O=C1N(Cc2ccc3OCOc3c2)C(Nc2ccc3OCCOc3c2)c2ccccc12	InChI=1S/C24H20N2O5/c27-24-18-4-2-1-3-17(18)23(25-16-6-8-19-22(12-16)29-10-9-28-19)26(24)13-15-5-7-20-21(11-15)31-14-30-20/h1-8,11-12,23,25H,9-10,13-14H2	CAJQOVPEDOVOOP-UHFFFAOYSA-N	416.13722176							109227
SMR000017045	LSM-20625	SID4251397, SID7971272, BRD-K17871396	3245092	InChI=1S/C26H29ClN6O2/c1-18-8-9-20(27)16-21(18)32-14-12-31(13-15-32)17-22-28-24-23(25(34)29-26(35)30(24)2)33(22)11-10-19-6-4-3-5-7-19/h3-9,16H,10-15,17H2,1-2H3,(H,29,34,35)	DMXSESYFIYHLOH-UHFFFAOYSA-N	CN1C(=O)NC(=O)c2c1nc(CN3CCN(CC3)c4cc(Cl)ccc4C)n2CCc5ccccc5	BroadT	BRD-K17871396	BRD-K17871396-001-05-1	Life Chemicals Inc.	F0669-0571			Cc1ccc(Cl)cc1N1CCN(Cc2nc3n(C)c(=O)[nH]c(=O)c3n2CCc2ccccc2)CC1	InChI=1S/C26H29ClN6O2/c1-18-8-9-20(27)16-21(18)32-14-12-31(13-15-32)17-22-28-24-23(25(34)29-26(35)30(24)2)33(22)11-10-19-6-4-3-5-7-19/h3-9,16H,10-15,17H2,1-2H3,(H,29,34,35)	DMXSESYFIYHLOH-UHFFFAOYSA-N	492.204051938							109228
ZINC00184213	LSM-20626	SID7977744, BRD-K46807608	744029	InChI=1S/C17H19N3O/c1-11-5-6-16(12(2)7-11)20-17-15(9-18)14(10-21-4)8-13(3)19-17/h5-8H,10H2,1-4H3,(H,19,20)	STMMOTYDISGBFG-UHFFFAOYSA-N	COCc1cc(C)nc(Nc2ccc(C)cc2C)c1C#N	BroadT	BRD-K46807608	BRD-K46807608-001-05-4	ChemBridge Corporation	5675275			COCc1cc(C)nc(Nc2ccc(C)cc2C)c1C#N	InChI=1S/C17H19N3O/c1-11-5-6-16(12(2)7-11)20-17-15(9-18)14(10-21-4)8-13(3)19-17/h5-8H,10H2,1-4H3,(H,19,20)	STMMOTYDISGBFG-UHFFFAOYSA-N	281.152812258							109229
AK-968/41018775	LSM-20627	SID17415314, BRD-K46362471	841942	InChI=1S/C13H11Cl2N3S/c14-11-4-3-10(6-12(11)15)18-13(19)17-8-9-2-1-5-16-7-9/h1-7H,8H2,(H2,17,18,19)	LIJQCIJGALPOPS-UHFFFAOYSA-N	Clc1ccc(NC(=S)NCc2cccnc2)cc1Cl	BroadT	BRD-K46362471	BRD-K46362471-001-05-4	ChemBridge Corporation	6058220			Clc1ccc(NC(=S)NCc2cccnc2)cc1Cl	InChI=1S/C13H11Cl2N3S/c14-11-4-3-10(6-12(11)15)18-13(19)17-8-9-2-1-5-16-7-9/h1-7H,8H2,(H2,17,18,19)	LIJQCIJGALPOPS-UHFFFAOYSA-N	311.005073492							109230
BRD-A98536659	LSM-20628			InChI=1S/C14H10N2O2/c15-10-12(13-8-4-5-9-16-13)14(17)18-11-6-2-1-3-7-11/h1-9,12H	YWKXAAUIDFETHB-UHFFFAOYSA-N	O=C(Oc1ccccc1)C(C#N)c2ccccn2	BroadT	BRD-A98536659	BRD-A98536659-001-05-6	Enamine Ltd.	T0507-3312			O=C(Oc1ccccc1)C(C#N)c1ccccn1	InChI=1S/C14H10N2O2/c15-10-12(13-8-4-5-9-16-13)14(17)18-11-6-2-1-3-7-11/h1-9,12H	YWKXAAUIDFETHB-UHFFFAOYSA-N	238.07422758							109231
(3-Chloro-phenyl)-carbamic acid 2-isopropoxycarbonylamino-ethyl ester	LSM-20629	SID853529, BRD-K47953120	656183	InChI=1S/C13H17ClN2O4/c1-9(2)20-12(17)15-6-7-19-13(18)16-11-5-3-4-10(14)8-11/h3-5,8-9H,6-7H2,1-2H3,(H,15,17)(H,16,18)	FHLOMVFBBXBFMS-UHFFFAOYSA-N	CC(C)OC(=O)NCCOC(=O)Nc1cccc(Cl)c1	BroadT	BRD-K47953120	BRD-K47953120-001-05-4	Asinex Ltd.	BAS 00018705			CC(C)OC(=O)NCCOC(=O)Nc1cccc(Cl)c1	InChI=1S/C13H17ClN2O4/c1-9(2)20-12(17)15-6-7-19-13(18)16-11-5-3-4-10(14)8-11/h3-5,8-9H,6-7H2,1-2H3,(H,15,17)(H,16,18)	FHLOMVFBBXBFMS-UHFFFAOYSA-N	300.087684754							109232
MLS000071249	LSM-20630	SID857186, SID56422732, BRD-K66902199	658540	InChI=1S/C23H29N5/c1-2-27-14-11-19-20(15-24)23(28-12-7-4-8-13-28)26-22(21(19)17-27)25-16-18-9-5-3-6-10-18/h3,5-6,9-10H,2,4,7-8,11-14,16-17H2,1H3,(H,25,26)	OFVQTBJOUGGQOD-UHFFFAOYSA-N	CCN1CCc2c(C1)c(NCc3ccccc3)nc(N4CCCCC4)c2C#N	BroadT	BRD-K66902199	BRD-K66902199-001-05-3	InterBioScreen Ltd.	STOCK1S-60910			CCN1CCc2c(C1)c(NCc1ccccc1)nc(N1CCCCC1)c2C#N	InChI=1S/C23H29N5/c1-2-27-14-11-19-20(15-24)23(28-12-7-4-8-13-28)26-22(21(19)17-27)25-16-18-9-5-3-6-10-18/h3,5-6,9-10H,2,4,7-8,11-14,16-17H2,1H3,(H,25,26)	OFVQTBJOUGGQOD-UHFFFAOYSA-N	375.242295978							109233
SMR000045836	LSM-20631	SID863510, BRD-A08481510	5389885	InChI=1S/C19H23NO4S/c1-12(2)6-8-23-18(22)15-14-5-7-19(24-14)11-20(17(21)16(15)19)10-13-4-3-9-25-13/h3-5,7,9,12,14-16H,6,8,10-11H2,1-2H3/t14-,15?,16+,19-/m1/s1	QSPUODWHQMJTCS-QBKPQXPVSA-N	CC(C)CCOC(=O)C1[C@@H]2O[C@@]3(CN(Cc4cccs4)C(=O)[C@H]13)C=C2	BroadT	BRD-A08481510	BRD-A08481510-001-05-3	InterBioScreen Ltd.	STOCK4S-80259			CC(C)CCOC(=O)C1[C@@H]2O[C@@]3(CN(Cc4cccs4)C(=O)[C@H]13)C=C2	InChI=1S/C19H23NO4S/c1-12(2)6-8-23-18(22)15-14-5-7-19(24-14)11-20(17(21)16(15)19)10-13-4-3-9-25-13/h3-5,7,9,12,14-16H,6,8,10-11H2,1-2H3/t14-,15?,16+,19-/m1/s1	QSPUODWHQMJTCS-QBKPQXPVSA-N	361.134778916							109234
AC1LYQNH	LSM-20632	BRD-K34097624	1931308	InChI=1S/C23H20BrN3O5S/c24-19-10-12-20(13-11-19)33(31,32)27(15-17-6-2-1-3-7-17)16-22(28)26-25-14-18-8-4-5-9-21(18)23(29)30/h1-14H,15-16H2,(H,26,28)(H,29,30)	DOLIZNCGVFAHJT-UHFFFAOYSA-N	OC(=O)c1ccccc1C=NNC(=O)CN(Cc2ccccc2)S(=O)(=O)c3ccc(Br)cc3	BroadT	BRD-K34097624	BRD-K34097624-001-05-6	InterBioScreen Ltd.	STOCK2S-70064			OC(=O)c1ccccc1C=NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1	InChI=1S/C23H20BrN3O5S/c24-19-10-12-20(13-11-19)33(31,32)27(15-17-6-2-1-3-7-17)16-22(28)26-25-14-18-8-4-5-9-21(18)23(29)30/h1-14H,15-16H2,(H,26,28)(H,29,30)	DOLIZNCGVFAHJT-UHFFFAOYSA-N	529.03070406							109235
MLS001049367	LSM-20633	SID26659458, SID134964734, BRD-K40644589	1255814	InChI=1S/C24H18N4/c1-17-12-14-18(15-13-17)21-16-28-24(25-21)26-22(19-8-4-2-5-9-19)23(27-28)20-10-6-3-7-11-20/h2-16H,1H3	PSTITRYDAFFGSV-UHFFFAOYSA-N	Cc1ccc(cc1)c2cn3nc(c4ccccc4)c(nc3n2)c5ccccc5	BroadT	BRD-K40644589	BRD-K40644589-001-04-3	InterBioScreen Ltd.	STOCK1S-70381			Cc1ccc(cc1)-c1cn2nc(-c3ccccc3)c(nc2n1)-c1ccccc1	InChI=1S/C24H18N4/c1-17-12-14-18(15-13-17)21-16-28-24(25-21)26-22(19-8-4-2-5-9-19)23(27-28)20-10-6-3-7-11-20/h2-16H,1H3	PSTITRYDAFFGSV-UHFFFAOYSA-N	362.153146616							109236
MLS000101823	LSM-20634	SID7970130, BRD-K68512803	3669496	InChI=1S/C20H26N6O4/c1-4-7-26-15(21-17-16(26)19(28)23(3)20(29)22(17)2)13-24-8-10-25(11-9-24)18(27)14-6-5-12-30-14/h5-6,12H,4,7-11,13H2,1-3H3	BCWXIMFFQBZFRO-UHFFFAOYSA-N	CCCn1c(CN2CCN(CC2)C(=O)c3occc3)nc4N(C)C(=O)N(C)C(=O)c14	BroadT	BRD-K68512803	BRD-K68512803-001-05-6	Life Chemicals Inc.	F0634-0046			CCCn1c(CN2CCN(CC2)C(=O)c2ccco2)nc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C20H26N6O4/c1-4-7-26-15(21-17-16(26)19(28)23(3)20(29)22(17)2)13-24-8-10-25(11-9-24)18(27)14-6-5-12-30-14/h5-6,12H,4,7-11,13H2,1-3H3	BCWXIMFFQBZFRO-UHFFFAOYSA-N	414.201553372							109237
ILP-IV-32	LSM-20635	SID26732681, BRD-K95320521	16746627	InChI=1S/C26H36ClN5O6/c1-25(2,3)37-23(35)18(9-7-8-14-28-24(36)38-26(4,5)6)32-22(34)20-19(29-15-30-20)21(33)31-17-12-10-16(27)11-13-17/h10-13,15,18H,7-9,14H2,1-6H3,(H,28,36)(H,29,30)(H,31,33)(H,32,34)/t18-/m0/s1	JLUULHGEQBSZIV-SFHVURJKSA-N	CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)c1[nH]cnc1C(=O)Nc2ccc(Cl)cc2)C(=O)OC(C)(C)C	BroadT	BRD-K95320521	BRD-K95320521-001-06-0	University of Tulsa	ILP-IV-32 AE10_AN05			CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)c1[nH]cnc1C(=O)Nc1ccc(Cl)cc1)C(=O)OC(C)(C)C	InChI=1S/C26H36ClN5O6/c1-25(2,3)37-23(35)18(9-7-8-14-28-24(36)38-26(4,5)6)32-22(34)20-19(29-15-30-20)21(33)31-17-12-10-16(27)11-13-17/h10-13,15,18H,7-9,14H2,1-6H3,(H,28,36)(H,29,30)(H,31,33)(H,32,34)/t18-/m0/s1	JLUULHGEQBSZIV-SFHVURJKSA-N	549.235411632							109238
SMR000218761	LSM-20636	SID17513917, BRD-K77763641	1880613	InChI=1S/C17H19BrN2S/c1-3-4-6-14-12(2)20-16-8-7-13(18)11-15(16)17(14)21-10-5-9-19/h7-8,11H,3-6,10H2,1-2H3	DXCDMEQEVRYHCJ-UHFFFAOYSA-N	CCCCc1c(C)nc2ccc(Br)cc2c1SCCC#N	BroadT	BRD-K77763641	BRD-K77763641-001-02-7	InterBioScreen Ltd.	STOCK3S-07893			CCCCc1c(C)nc2ccc(Br)cc2c1SCCC#N	InChI=1S/C17H19BrN2S/c1-3-4-6-14-12(2)20-16-8-7-13(18)11-15(16)17(14)21-10-5-9-19/h7-8,11H,3-6,10H2,1-2H3	DXCDMEQEVRYHCJ-UHFFFAOYSA-N	362.045231918							109239
SMR000003878	LSM-20637	SID26668562, SID843891, BRD-K39146910	646200	InChI=1S/C20H21ClN6O4S/c1-31-19-12-16(4-7-18(19)27-13-22-24-25-27)23-20(28)14-8-10-26(11-9-14)32(29,30)17-5-2-15(21)3-6-17/h2-7,12-14H,8-11H2,1H3,(H,23,28)	QDIPDVLYDAZMQE-UHFFFAOYSA-N	COc1cc(NC(=O)C2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3)ccc1n4cnnn4	BroadT	BRD-K39146910	BRD-K39146910-001-05-9	Asinex Ltd.	ASN 05018539			COc1cc(NC(=O)C2CCN(CC2)S(=O)(=O)c2ccc(Cl)cc2)ccc1-n1cnnn1	InChI=1S/C20H21ClN6O4S/c1-31-19-12-16(4-7-18(19)27-13-22-24-25-27)23-20(28)14-8-10-26(11-9-14)32(29,30)17-5-2-15(21)3-6-17/h2-7,12-14H,8-11H2,1H3,(H,23,28)	QDIPDVLYDAZMQE-UHFFFAOYSA-N	476.103351612							109240
AN-740/37278023	LSM-15312	BRD-K40242921	820025	InChI=1S/C15H17Cl2N3/c16-4-6-19-7-9-20(10-8-19)15-3-5-18-14-11-12(17)1-2-13(14)15/h1-3,5,11H,4,6-10H2	DKALJSKWAPJDDK-UHFFFAOYSA-N	ClCCN1CCN(CC1)c2ccnc3cc(Cl)ccc23	BroadT	BRD-K40242921	BRD-K40242921-003-06-4	Specs	AN-740/37278023		Cl	ClCCN1CCN(CC1)c1ccnc2cc(Cl)ccc12.Cl	InChI=1S/C15H17Cl2N3.ClH/c16-4-6-19-7-9-20(10-8-19)15-3-5-18-14-11-12(17)1-2-13(14)15;/h1-3,5,11H,4,6-10H2;1H	ZUJAQNUKNAPWQG-UHFFFAOYSA-N	309.079952994							103959, 103959
MLS000767700	LSM-20638	SID26661299, BRD-K85363252	1418293	InChI=1S/C20H20N2O4/c1-13-11-16(23)14-7-6-10-18(26-3)20(14)22(13)12-19(24)21-15-8-4-5-9-17(15)25-2/h4-11H,12H2,1-3H3,(H,21,24)	ABMYNZIMQPLIFB-UHFFFAOYSA-N	COc1ccccc1NC(=O)CN2C(=CC(=O)c3cccc(OC)c23)C	BroadT	BRD-K85363252	BRD-K85363252-001-10-9	InterBioScreen Ltd.	STOCK2S-98382			COc1ccccc1NC(=O)Cn1c(C)cc(=O)c2cccc(OC)c12	InChI=1S/C20H20N2O4/c1-13-11-16(23)14-7-6-10-18(26-3)20(14)22(13)12-19(24)21-15-8-4-5-9-17(15)25-2/h4-11H,12H2,1-3H3,(H,21,24)	ABMYNZIMQPLIFB-UHFFFAOYSA-N	352.14230714							109241
2-Methyl-3-phenyl-n-(propan-2-yl)-6,7-dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidin-8-amine	LSM-20639	SID26665756, BRD-K94052032	1858680	InChI=1S/C19H22N4/c1-12(2)20-18-15-10-7-11-16(15)21-19-17(13(3)22-23(18)19)14-8-5-4-6-9-14/h4-6,8-9,12,20H,7,10-11H2,1-3H3	FTKGGDDYJKDDDL-UHFFFAOYSA-N	CC(C)Nc1c2CCCc2nc3c(c(C)nn13)c4ccccc4	BroadT	BRD-K94052032	BRD-K94052032-001-05-4	InterBioScreen Ltd.	STOCK5S-40703			CC(C)Nc1c2CCCc2nc2c(c(C)nn12)-c1ccccc1	InChI=1S/C19H22N4/c1-12(2)20-18-15-10-7-11-16(15)21-19-17(13(3)22-23(18)19)14-8-5-4-6-9-14/h4-6,8-9,12,20H,7,10-11H2,1-3H3	FTKGGDDYJKDDDL-UHFFFAOYSA-N	306.184446744							109242
CID 74686162	LSM-20640	BRD-A28653047	74686162	InChI=1S/C24H28N2O7/c1-5-31-22(28)19-14(3)25-15(4)20(23(29)32-6-2)21(19)24(30)33-13-18(27)26-12-11-16-9-7-8-10-17(16)26/h7-10,19,21H,5-6,11-13H2,1-4H3	JASALOSCNYTWES-UHFFFAOYSA-N	CCOC(=O)C1C(C(=O)OCC(=O)N2CCc3ccccc23)C(=C(C)N=C1C)C(=O)OCC	BroadT	BRD-A28653047	BRD-A28653047-001-05-5	Enamine Ltd.	T5249286			CCOC(=O)C1C(C(=O)OCC(=O)N2CCc3ccccc23)C(C(=O)OCC)=C(C)N=C1C	InChI=1S/C24H28N2O7/c1-5-31-22(28)19-14(3)25-15(4)20(23(29)32-6-2)21(19)24(30)33-13-18(27)26-12-11-16-9-7-8-10-17(16)26/h7-10,19,21H,5-6,11-13H2,1-4H3	JASALOSCNYTWES-UHFFFAOYSA-N	456.189651256							109243
N-(2-Methyl-1,3-benzothiazol-6-yl)furan-2-carboxamide	LSM-20641	SID24805512, BRD-K89900454	1085170	InChI=1S/C13H10N2O2S/c1-8-14-10-5-4-9(7-12(10)18-8)15-13(16)11-3-2-6-17-11/h2-7H,1H3,(H,15,16)	OSGDREQHDAWRMM-UHFFFAOYSA-N	Cc1nc2ccc(NC(=O)c3occc3)cc2s1	BroadT	BRD-K89900454	BRD-K89900454-001-06-8	Asinex Ltd.	BAS 06612863			Cc1nc2ccc(NC(=O)c3ccco3)cc2s1	InChI=1S/C13H10N2O2S/c1-8-14-10-5-4-9(7-12(10)18-8)15-13(16)11-3-2-6-17-11/h2-7H,1H3,(H,15,16)	OSGDREQHDAWRMM-UHFFFAOYSA-N	258.04629827							109244
AC1LKI23	LSM-20642	BRD-K45588744	1018752	InChI=1S/C20H18BrN3O4S/c1-13-3-12-19(28-13)20(25)22-17-8-4-15(5-9-17)14(2)23-24-29(26,27)18-10-6-16(21)7-11-18/h3-12,24H,1-2H3,(H,22,25)	ZWLZMDAILFCXRX-UHFFFAOYSA-N	CC(=NNS(=O)(=O)c1ccc(Br)cc1)c2ccc(NC(=O)c3oc(C)cc3)cc2	BroadT	BRD-K45588744	BRD-K45588744-001-05-6	Specs	AK-968/40709590			CC(=NNS(=O)(=O)c1ccc(Br)cc1)c1ccc(NC(=O)c2ccc(C)o2)cc1	InChI=1S/C20H18BrN3O4S/c1-13-3-12-19(28-13)20(25)22-17-8-4-15(5-9-17)14(2)23-24-29(26,27)18-10-6-16(21)7-11-18/h3-12,24H,1-2H3,(H,22,25)	ZWLZMDAILFCXRX-UHFFFAOYSA-N	475.020139376							109245
MLS000072568	LSM-20643	SID848324, BRD-K74143231	650759	InChI=1S/C16H21N3OS/c1-2-21-16-17-13-8-4-5-9-14(13)19(16)12-15(20)18-10-6-3-7-11-18/h4-5,8-9H,2-3,6-7,10-12H2,1H3	CVCVTBPAWRMOHF-UHFFFAOYSA-N	CCSc1nc2ccccc2n1CC(=O)N3CCCCC3	BroadT	BRD-K74143231	BRD-K74143231-001-06-2	Asinex Ltd.	BAS 04203780			CCSc1nc2ccccc2n1CC(=O)N1CCCCC1	InChI=1S/C16H21N3OS/c1-2-21-16-17-13-8-4-5-9-14(13)19(16)12-15(20)18-10-6-3-7-11-18/h4-5,8-9H,2-3,6-7,10-12H2,1H3	CVCVTBPAWRMOHF-UHFFFAOYSA-N	303.140533012							109246
MLS000118724	LSM-20644	SID24838327, SID7965690, BRD-K68589224	5307771	InChI=1S/C24H24FN5OS/c1-16-11-17(2)13-19(12-16)26-23(31)15-32-24-28-27-22(14-21-5-4-10-29(21)3)30(24)20-8-6-18(25)7-9-20/h4-13H,14-15H2,1-3H3,(H,26,31)	LYXJGNOOZKYQIK-UHFFFAOYSA-N	Cc1cc(C)cc(NC(=O)CSc2nnc(Cc3cccn3C)n2c4ccc(F)cc4)c1	BroadT	BRD-K68589224	BRD-K68589224-001-04-8	ChemDiv Inc.	C677-0241			Cc1cc(C)cc(NC(=O)CSc2nnc(Cc3cccn3C)n2-c2ccc(F)cc2)c1	InChI=1S/C24H24FN5OS/c1-16-11-17(2)13-19(12-16)26-23(31)15-32-24-28-27-22(14-21-5-4-10-29(21)3)30(24)20-8-6-18(25)7-9-20/h4-13H,14-15H2,1-3H3,(H,26,31)	LYXJGNOOZKYQIK-UHFFFAOYSA-N	449.168559328							109247
SMR000022043	LSM-20645	SID4247402, BRD-A77190195	3241618	InChI=1S/C25H31N3O5/c1-27-23(17-8-9-20(31-2)21(16-17)32-3)22(18-6-4-5-7-19(18)25(27)30)24(29)26-10-11-28-12-14-33-15-13-28/h4-9,16,22-23H,10-15H2,1-3H3,(H,26,29)	WHDIKNJNRRSIBR-UHFFFAOYSA-N	COc1ccc(cc1OC)C2C(C(=O)NCCN3CCOCC3)c4ccccc4C(=O)N2C	BroadT	BRD-A77190195	BRD-A77190195-001-05-8	ChemDiv Inc.	C096-1319			COc1ccc(cc1OC)C1C(C(=O)NCCN2CCOCC2)c2ccccc2C(=O)N1C	InChI=1S/C25H31N3O5/c1-27-23(17-8-9-20(31-2)21(16-17)32-3)22(18-6-4-5-7-19(18)25(27)30)24(29)26-10-11-28-12-14-33-15-13-28/h4-9,16,22-23H,10-15H2,1-3H3,(H,26,29)	WHDIKNJNRRSIBR-UHFFFAOYSA-N	453.226371122							109248
SMR000031901	LSM-20646	SID24839462, SID4249959, BRD-K59186070	3243835	InChI=1S/C23H23ClN2O6S/c1-15-17-14-16(33(28,29)26-10-8-23(9-11-26)30-12-13-31-23)6-7-20(17)32-21(15)22(27)25-19-5-3-2-4-18(19)24/h2-7,14H,8-13H2,1H3,(H,25,27)	VAZRXXJZSPGIKC-UHFFFAOYSA-N	Cc1c(oc2ccc(cc12)S(=O)(=O)N3CCC4(CC3)OCCO4)C(=O)Nc5ccccc5Cl	BroadT	BRD-K59186070	BRD-K59186070-001-05-6	ChemDiv Inc.	K786-1322			Cc1c(oc2ccc(cc12)S(=O)(=O)N1CCC2(CC1)OCCO2)C(=O)Nc1ccccc1Cl	InChI=1S/C23H23ClN2O6S/c1-15-17-14-16(33(28,29)26-10-8-23(9-11-26)30-12-13-31-23)6-7-20(17)32-21(15)22(27)25-19-5-3-2-4-18(19)24/h2-7,14H,8-13H2,1H3,(H,25,27)	VAZRXXJZSPGIKC-UHFFFAOYSA-N	490.096534876							109249
MLS000888841	LSM-20647	SID26670052, BRD-K39805394	16682608	InChI=1S/C22H23N3O/c23-22-24-15-19(14-16-8-10-20(26)11-9-16)25(22)13-12-18-6-3-5-17-4-1-2-7-21(17)18/h1-11,19,26H,12-15H2,(H2,23,24)/t19-/m0/s1	PZECGPMKEVSTQM-IBGZPJMESA-N	NC1=NC[C@H](Cc2ccc(O)cc2)N1CCc3cccc4ccccc34	BroadT	BRD-K39805394	BRD-K39805394-001-05-5	Torrey Pines Institute for Molecular Studies	1656-49			NC1=NC[C@H](Cc2ccc(O)cc2)N1CCc1cccc2ccccc12	InChI=1S/C22H23N3O/c23-22-24-15-19(14-16-8-10-20(26)11-9-16)25(22)13-12-18-6-3-5-17-4-1-2-7-21(17)18/h1-11,19,26H,12-15H2,(H2,23,24)/t19-/m0/s1	PZECGPMKEVSTQM-IBGZPJMESA-N	345.184112386							109250
ZINC02865451	LSM-20648	SID17416150, BRD-K43559450	2218619	InChI=1S/C22H16N2O2S/c1-13-7-6-12-18-20(13)23-22(27-18)24-21(25)19-14-8-2-4-10-16(14)26-17-11-5-3-9-15(17)19/h2-12,19H,1H3,(H,23,24,25)	HVELMGFBVFHJIR-UHFFFAOYSA-N	Cc1cccc2sc(NC(=O)C3c4ccccc4Oc5ccccc35)nc12	BroadT	BRD-K43559450	BRD-K43559450-001-06-1	ChemBridge Corporation	7908714			Cc1cccc2sc(NC(=O)C3c4ccccc4Oc4ccccc34)nc12	InChI=1S/C22H16N2O2S/c1-13-7-6-12-18-20(13)23-22(27-18)24-21(25)19-14-8-2-4-10-16(14)26-17-11-5-3-9-15(17)19/h2-12,19H,1H3,(H,23,24,25)	HVELMGFBVFHJIR-UHFFFAOYSA-N	372.093248462							109251
8H-944	LSM-20649	SID14733183, BRD-K12521787	1486453	InChI=1S/C17H12ClF3N2O2/c1-25-15(24)6-10-9-23(14-5-3-2-4-12(10)14)16-13(18)7-11(8-22-16)17(19,20)21/h2-5,7-9H,6H2,1H3	FWXGCAPUMGLGOF-UHFFFAOYSA-N	COC(=O)Cc1cn(c2ncc(cc2Cl)C(F)(F)F)c3ccccc13	BroadT	BRD-K12521787	BRD-K12521787-001-05-4	Key Organics Ltd.	8H-944			COC(=O)Cc1cn(-c2ncc(cc2Cl)C(F)(F)F)c2ccccc12	InChI=1S/C17H12ClF3N2O2/c1-25-15(24)6-10-9-23(14-5-3-2-4-12(10)14)16-13(18)7-11(8-22-16)17(19,20)21/h2-5,7-9H,6H2,1H3	FWXGCAPUMGLGOF-UHFFFAOYSA-N	368.053939954							109252
SMR000124764	LSM-20650	SID85272995, SID14723357, BRD-K01552729	1453660	InChI=1S/C22H29N5O6S/c28-22(26-9-13-31-14-10-26)25-7-5-18(6-8-25)21-23-20(24-33-21)17-1-3-19(4-2-17)34(29,30)27-11-15-32-16-12-27/h1-4,18H,5-16H2	RIUAUUUBLADUJT-UHFFFAOYSA-N	O=C(N1CCOCC1)N2CCC(CC2)c3onc(n3)c4ccc(cc4)S(=O)(=O)N5CCOCC5	BroadT	BRD-K01552729	BRD-K01552729-001-05-3	Asinex Ltd.	ASN 06930689			O=C(N1CCOCC1)N1CCC(CC1)c1nc(no1)-c1ccc(cc1)S(=O)(=O)N1CCOCC1	InChI=1S/C22H29N5O6S/c28-22(26-9-13-31-14-10-26)25-7-5-18(6-8-25)21-23-20(24-33-21)17-1-3-19(4-2-17)34(29,30)27-11-15-32-16-12-27/h1-4,18H,5-16H2	RIUAUUUBLADUJT-UHFFFAOYSA-N	491.183854388							109253
ML141	LSM-1429	SID24796017, BRD-A28422330	2950007	InChI=1S/C22H21N3O3S/c1-28-19-11-7-17(8-12-19)22-15-21(16-5-3-2-4-6-16)24-25(22)18-9-13-20(14-10-18)29(23,26)27/h2-14,22H,15H2,1H3,(H2,23,26,27)	QBNZBMVRFYREHK-UHFFFAOYSA-N	COc1ccc(cc1)C2CC(=NN2c3ccc(cc3)S(=O)(=O)N)c4ccccc4	BroadT	BRD-A28422330	BRD-A28422330-001-06-9	ChemBridge Corporation	7725949			COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccccc1	InChI=1S/C22H21N3O3S/c1-28-19-11-7-17(8-12-19)22-15-21(16-5-3-2-4-6-16)24-25(22)18-9-13-20(14-10-18)29(23,26)27/h2-14,22H,15H2,1H3,(H2,23,26,27)	QBNZBMVRFYREHK-UHFFFAOYSA-N	407.130362252							91613
T5311225	LSM-43890	SID24838013, BRD-K15744063	6217066	InChI=1S/C17H9ClF4N2O/c18-13(7-9-2-1-3-11(19)6-9)15-23-14-8-10(17(20,21)22)4-5-12(14)16(25)24-15/h1-8H,(H,23,24,25)/b13-7-	WACXMKNYUWMODN-QPEQYQDCSA-N	Oc1nc(nc2cc(ccc12)C(F)(F)F)\C(=C\c3cccc(F)c3)\Cl	BroadT	BRD-K15744063	BRD-K15744063-001-05-4	Enamine Ltd.	T5311225			Oc1nc(nc2cc(ccc12)C(F)(F)F)C(\Cl)=C\c1cccc(F)c1	InChI=1S/C17H9ClF4N2O/c18-13(7-9-2-1-3-11(19)6-9)15-23-14-8-10(17(20,21)22)4-5-12(14)16(25)24-15/h1-8H,(H,23,24,25)/b13-7-	WACXMKNYUWMODN-QPEQYQDCSA-N	368.033953438							
2-{2-[5-Amino-4-(3-thienyl)-1H-pyrazol-1-yl]-4-phenyl-1,3-thiazol-5-yl}acetic acid	LSM-20652	SID24820561, BRD-K32825886	3816576	InChI=1S/C18H14N4O2S2/c19-17-13(12-6-7-25-10-12)9-20-22(17)18-21-16(11-4-2-1-3-5-11)14(26-18)8-15(23)24/h1-7,9-10H,8,19H2,(H,23,24)	FEPOQBJSQBMFJH-UHFFFAOYSA-N	Nc1c(cnn1c2nc(c(CC(=O)O)s2)c3ccccc3)c4ccsc4	BroadT	BRD-K32825886	BRD-K32825886-001-05-5	Key Organics Ltd.	4T-0834			Nc1c(cnn1-c1nc(c(CC(O)=O)s1)-c1ccccc1)-c1ccsc1	InChI=1S/C18H14N4O2S2/c19-17-13(12-6-7-25-10-12)9-20-22(17)18-21-16(11-4-2-1-3-5-11)14(26-18)8-15(23)24/h1-7,9-10H,8,19H2,(H,23,24)	FEPOQBJSQBMFJH-UHFFFAOYSA-N	382.055817108							109255
MLS000521426	LSM-20653	SID14732927, BRD-K75913329	6615755	InChI=1S/C25H22N2O6S/c1-3-4-12-32-25(29)22-14(2)33-20-10-8-15(13-18(20)22)27-34(30,31)21-11-9-19-23-16(21)6-5-7-17(23)24(28)26-19/h5-11,13,27H,3-4,12H2,1-2H3,(H,26,28)	LWESVAXZNLNFCM-UHFFFAOYSA-N	CCCCOC(=O)c1c(C)oc2ccc(NS(=O)(=O)c3ccc4NC(=O)c5cccc3c45)cc12	BroadT	BRD-K75913329	BRD-K75913329-001-06-0	ChemDiv Inc.	4456-0517			CCCCOC(=O)c1c(C)oc2ccc(NS(=O)(=O)c3ccc4NC(=O)c5cccc3c45)cc12	InChI=1S/C25H22N2O6S/c1-3-4-12-32-25(29)22-14(2)33-20-10-8-15(13-18(20)22)27-34(30,31)21-11-9-19-23-16(21)6-5-7-17(23)24(28)26-19/h5-11,13,27H,3-4,12H2,1-2H3,(H,26,28)	LWESVAXZNLNFCM-UHFFFAOYSA-N	478.119857134							109256
F2004-0099	LSM-20654	SID24813900, BRD-K17658096	16194187	InChI=1S/C14H11N3S2/c1-3-11(9-15-7-1)10-19-14-6-5-12(16-17-14)13-4-2-8-18-13/h1-9H,10H2	DFPYKZRJDUFPCN-UHFFFAOYSA-N	C(Sc1ccc(nn1)c2cccs2)c3cccnc3	BroadT	BRD-K17658096	BRD-K17658096-001-05-5	ChemDiv Inc.	E547-0099			C(Sc1ccc(nn1)-c1cccs1)c1cccnc1	InChI=1S/C14H11N3S2/c1-3-11(9-15-7-1)10-19-14-6-5-12(16-17-14)13-4-2-8-18-13/h1-9H,10H2	DFPYKZRJDUFPCN-UHFFFAOYSA-N	285.039438762							109257
AC1MS1J3	LSM-20655	SID26661750, BRD-K70612829	3577201	InChI=1S/C17H14N2O2S/c1-11-13-7-15-16(21-10-20-15)8-14(13)18-17(22)19(11)9-12-5-3-2-4-6-12/h2-8H,1,9-10H2,(H,18,22)	TYWJRVSGRQNHTN-UHFFFAOYSA-N	SC1=Nc2cc3OCOc3cc2C(=C)N1Cc4ccccc4	BroadT	BRD-K70612829	BRD-K70612829-001-04-3	InterBioScreen Ltd.	STOCK3S-67293			SC1=Nc2cc3OCOc3cc2C(=C)N1Cc1ccccc1	InChI=1S/C17H14N2O2S/c1-11-13-7-15-16(21-10-20-15)8-14(13)18-17(22)19(11)9-12-5-3-2-4-6-12/h2-8H,1,9-10H2,(H,18,22)	TYWJRVSGRQNHTN-UHFFFAOYSA-N	310.077598398							109258
MLS000053811	LSM-20656	SID3711101, BRD-K80891389	2997504	InChI=1S/C17H16N4O/c1-3-21-17-15(10-19-21)16(8-12(2)20-17)22-11-14-6-4-13(9-18)5-7-14/h4-8,10H,3,11H2,1-2H3	QKORJTKJSBWIMU-UHFFFAOYSA-N	CCn1ncc2c(OCc3ccc(cc3)C#N)cc(C)nc12	BroadT	BRD-K80891389	BRD-K80891389-001-06-8	Enamine Ltd.	T5335897			CCn1ncc2c(OCc3ccc(cc3)C#N)cc(C)nc12	InChI=1S/C17H16N4O/c1-3-21-17-15(10-19-21)16(8-12(2)20-17)22-11-14-6-4-13(9-18)5-7-14/h4-8,10H,3,11H2,1-2H3	QKORJTKJSBWIMU-UHFFFAOYSA-N	292.132411172							109259
1H-[1,2,4]triazole-3-Carboxylic acid (3,3,5-trimethyl-cyclohexyl)-amide	LSM-20657	SID17407621, BRD-A76484682	2914105	InChI=1S/C12H20N4O/c1-8-4-9(6-12(2,3)5-8)15-11(17)10-13-7-14-16-10/h7-9H,4-6H2,1-3H3,(H,15,17)(H,13,14,16)	FZDGDQZXMLTTGG-UHFFFAOYSA-N	CC1CC(CC(C)(C)C1)NC(=O)c2nc[nH]n2	BroadT	BRD-A76484682	BRD-A76484682-001-05-6	Asinex Ltd.	BAS 03592789			CC1CC(CC(C)(C)C1)NC(=O)c1nc[nH]n1	InChI=1S/C12H20N4O/c1-8-4-9(6-12(2,3)5-8)15-11(17)10-13-7-14-16-10/h7-9H,4-6H2,1-3H3,(H,15,17)(H,13,14,16)	FZDGDQZXMLTTGG-UHFFFAOYSA-N	236.1637113							109260
2-(3-Chlorobenzyl)-6-phenyl-5-piperidino-3(2H)-pyridazinone	LSM-20658	SID17402696, BRD-K58719193	1472482	InChI=1S/C22H22ClN3O/c23-19-11-7-8-17(14-19)16-26-21(27)15-20(25-12-5-2-6-13-25)22(24-26)18-9-3-1-4-10-18/h1,3-4,7-11,14-15H,2,5-6,12-13,16H2	JMKXAXUZIWRZPA-UHFFFAOYSA-N	Clc1cccc(CN2N=C(C(=CC2=O)N3CCCCC3)c4ccccc4)c1	BroadT	BRD-K58719193	BRD-K58719193-001-06-5	Key Organics Ltd.	2R-1073			Clc1cccc(Cn2nc(-c3ccccc3)c(cc2=O)N2CCCCC2)c1	InChI=1S/C22H22ClN3O/c23-19-11-7-8-17(14-19)16-26-21(27)15-20(25-12-5-2-6-13-25)22(24-26)18-9-3-1-4-10-18/h1,3-4,7-11,14-15H,2,5-6,12-13,16H2	JMKXAXUZIWRZPA-UHFFFAOYSA-N	379.145140064							109261
MLS000911499	LSM-20659	SID26725583, BRD-K96142743	16745803	InChI=1S/C19H15F3N4O4/c1-29-14-6-10(5-13(8-14)26-17(28)15-9-24-18(23)30-15)16(27)25-12-4-2-3-11(7-12)19(20,21)22/h2-9H,1H3,(H2,23,24)(H,25,27)(H,26,28)	IHKCCTBYRVJSIN-UHFFFAOYSA-N	COc1cc(NC(=O)c2oc(N)nc2)cc(c1)C(=O)Nc3cccc(c3)C(F)(F)F	BroadT	BRD-K96142743	BRD-K96142743-001-05-1	Dana Farber Cancer Institute	AMY001-053			COc1cc(NC(=O)c2cnc(N)o2)cc(c1)C(=O)Nc1cccc(c1)C(F)(F)F	InChI=1S/C19H15F3N4O4/c1-29-14-6-10(5-13(8-14)26-17(28)15-9-24-18(23)30-15)16(27)25-12-4-2-3-11(7-12)19(20,21)22/h2-9H,1H3,(H2,23,24)(H,25,27)(H,26,28)	IHKCCTBYRVJSIN-UHFFFAOYSA-N	420.1045396							109262, 109262
ZINC06113772	LSM-20660	SID24837707, BRD-K18724050	4877989	InChI=1S/C16H21N3O5S/c1-5-19(6-2)25(21,22)12-7-8-15(23-4)13(10-12)17-16(20)14-9-11(3)24-18-14/h7-10H,5-6H2,1-4H3,(H,17,20)	VQIDEOZUCYXNIM-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)c2cc(C)on2)c1	BroadT	BRD-K18724050	BRD-K18724050-001-05-8	Enamine Ltd.	T5307866			CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)c2cc(C)on2)c1	InChI=1S/C16H21N3O5S/c1-5-19(6-2)25(21,22)12-7-8-15(23-4)13(10-12)17-16(20)14-9-11(3)24-18-14/h7-10H,5-6H2,1-4H3,(H,17,20)	VQIDEOZUCYXNIM-UHFFFAOYSA-N	367.120191492							109263
UPCMLD02AMDF002084	LSM-20661	SID24708041, SID17385245, BRD-K91515153	3247129	InChI=1S/C36H33F4N3O5/c1-41(2)33(45)30-18-28-29(42(30)20-23-11-15-27(16-12-23)48-36(38,39)40)17-25-21-43(32(44)24-7-5-4-6-8-24)35(31(25)28,34(46)47-3)19-22-9-13-26(37)14-10-22/h4-16,18,25,31H,17,19-21H2,1-3H3/t25-,31+,35+/m0/s1	WQNVBEYGWAEVOI-ARROIKNCSA-N	COC(=O)[C@@]1(Cc2ccc(F)cc2)[C@@H]3[C@H](CN1C(=O)c4ccccc4)Cc5c3cc(C(=O)N(C)C)n5Cc6ccc(OC(F)(F)F)cc6	BroadT	BRD-K91515153	BRD-K91515153-001-03-1	University of Pittsburgh CMLD	UPCMLD02AMDF002084			COC(=O)[C@@]1(Cc2ccc(F)cc2)[C@@H]2[C@H](CN1C(=O)c1ccccc1)Cc1c2cc(C(=O)N(C)C)n1Cc1ccc(OC(F)(F)F)cc1	InChI=1S/C36H33F4N3O5/c1-41(2)33(45)30-18-28-29(42(30)20-23-11-15-27(16-12-23)48-36(38,39)40)17-25-21-43(32(44)24-7-5-4-6-8-24)35(31(25)28,34(46)47-3)19-22-9-13-26(37)14-10-22/h4-16,18,25,31H,17,19-21H2,1-3H3/t25-,31+,35+/m0/s1	WQNVBEYGWAEVOI-ARROIKNCSA-N	663.235633986							109264
SMR000003701	LSM-20662	SID842561, SID26668156, BRD-K08584008	644830	InChI=1S/C22H24FN5O4S/c1-3-31-20-14-22(21(32-4-2)13-19(20)28-15-24-25-26-28)33(29,30)27-11-9-17(10-12-27)16-5-7-18(23)8-6-16/h5-9,13-15H,3-4,10-12H2,1-2H3	FXFQRHLCDVQUNC-UHFFFAOYSA-N	CCOc1cc(c(OCC)cc1n2cnnn2)S(=O)(=O)N3CCC(=CC3)c4ccc(F)cc4	BroadT	BRD-K08584008	BRD-K08584008-001-05-1	Asinex Ltd.	ASN 04886943			CCOc1cc(c(OCC)cc1-n1cnnn1)S(=O)(=O)N1CCC(=CC1)c1ccc(F)cc1	InChI=1S/C22H24FN5O4S/c1-3-31-20-14-22(21(32-4-2)13-19(20)28-15-24-25-26-28)33(29,30)27-11-9-17(10-12-27)16-5-7-18(23)8-6-16/h5-9,13-15H,3-4,10-12H2,1-2H3	FXFQRHLCDVQUNC-UHFFFAOYSA-N	473.153303188							109265
AC1MBUBE	LSM-20663	SID26727697, BRD-A28734572	2731396	InChI=1S/C17H14N2O/c1-11-6-8-12(9-7-11)15-10-16-13-4-2-3-5-14(13)17(20)19(16)18-15/h2-9,16H,10H2,1H3	AIPJVLYJNYNDQF-UHFFFAOYSA-N	Cc1ccc(cc1)C2=NN3C(C2)c4ccccc4C3=O	BroadT	BRD-A28734572	BRD-A28734572-001-06-4	Maybridge	S 04573			Cc1ccc(cc1)C1=NN2C(C1)c1ccccc1C2=O	InChI=1S/C17H14N2O/c1-11-6-8-12(9-7-11)15-10-16-13-4-2-3-5-14(13)17(20)19(16)18-15/h2-9,16H,10H2,1H3	AIPJVLYJNYNDQF-UHFFFAOYSA-N	262.110613088							109266
F1808-0069	LSM-20664	SID7970995, BRD-K94443957	2149377	InChI=1S/C23H22N2O5/c1-2-29-22(27)15-30-20-9-5-7-18-17(20)11-12-24(23(18)28)14-21(26)25-13-10-16-6-3-4-8-19(16)25/h3-9,11-12H,2,10,13-15H2,1H3	HIOQZVKOEGYGAK-UHFFFAOYSA-N	CCOC(=O)COc1cccc2C(=O)N(CC(=O)N3CCc4ccccc34)C=Cc12	BroadT	BRD-K94443957	BRD-K94443957-001-04-9	Life Chemicals Inc.	F1808-0069			CCOC(=O)COc1cccc2c1ccn(CC(=O)N1CCc3ccccc13)c2=O	InChI=1S/C23H22N2O5/c1-2-29-22(27)15-30-20-9-5-7-18-17(20)11-12-24(23(18)28)14-21(26)25-13-10-16-6-3-4-8-19(16)25/h3-9,11-12H,2,10,13-15H2,1H3	HIOQZVKOEGYGAK-UHFFFAOYSA-N	406.152871824							109267
N'1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-2-cyanoethanohydrazide	LSM-20665	SID26731678, BRD-K18936407	5112429	InChI=1S/C10H6F3N5O5/c11-10(12,13)5-3-6(17(20)21)9(7(4-5)18(22)23)16-15-8(19)1-2-14/h3-4,16H,1H2,(H,15,19)	NOWASIRLKQFITN-UHFFFAOYSA-N	[O-][N+](=O)c1cc(cc(c1NNC(=O)CC#N)[N+](=O)[O-])C(F)(F)F	BroadT	BRD-K18936407	BRD-K18936407-001-05-8	Maybridge	CD 03571			[O-][N+](=O)c1cc(cc(c1NNC(=O)CC#N)[N+]([O-])=O)C(F)(F)F	InChI=1S/C10H6F3N5O5/c11-10(12,13)5-3-6(17(20)21)9(7(4-5)18(22)23)16-15-8(19)1-2-14/h3-4,16H,1H2,(H,15,19)	NOWASIRLKQFITN-UHFFFAOYSA-N	333.032102942							109268
MLS000770016	LSM-20666	SID26666087, BRD-K31427456	1983669	InChI=1S/C22H22N4O2/c1-4-26-22-18(13-16-11-14(2)5-10-19(16)23-22)21(25-26)24-20(27)12-15-6-8-17(28-3)9-7-15/h5-11,13H,4,12H2,1-3H3,(H,24,25,27)	GOECNYYIXGRBNW-UHFFFAOYSA-N	CCn1nc(NC(=O)Cc2ccc(OC)cc2)c3cc4cc(C)ccc4nc13	BroadT	BRD-K31427456	BRD-K31427456-001-06-9	InterBioScreen Ltd.	STOCK4S-01707			CCn1nc(NC(=O)Cc2ccc(OC)cc2)c2cc3cc(C)ccc3nc12	InChI=1S/C22H22N4O2/c1-4-26-22-18(13-16-11-14(2)5-10-19(16)23-22)21(25-26)24-20(27)12-15-6-8-17(28-3)9-7-15/h5-11,13H,4,12H2,1-3H3,(H,24,25,27)	GOECNYYIXGRBNW-UHFFFAOYSA-N	374.174275984							109269
2-Methoxy-3-[5-(2-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-6-methylpyridine	LSM-20667	SID4264507, BRD-K81917690	913814	InChI=1S/C16H15N3O3/c1-10-8-9-12(15(17-10)21-3)14-18-16(22-19-14)11-6-4-5-7-13(11)20-2/h4-9H,1-3H3	COTBDPHBVPAEOX-UHFFFAOYSA-N	COc1ccccc1c2onc(n2)c3ccc(C)nc3OC	BroadT	BRD-K81917690	BRD-K81917690-001-06-4	ChemBridge Corporation	7786888			COc1ccccc1-c1nc(no1)-c1ccc(C)nc1OC	InChI=1S/C16H15N3O3/c1-10-8-9-12(15(17-10)21-3)14-18-16(22-19-14)11-6-4-5-7-13(11)20-2/h4-9H,1-3H3	COTBDPHBVPAEOX-UHFFFAOYSA-N	297.11134137							109270
ZINC00504352	LSM-20668	BRD-K41872267	5494521	InChI=1S/C13H15N3O/c1-17-8-5-6-11-10(7-8)9-3-2-4-12(16-14)13(9)15-11/h5-7,15H,2-4,14H2,1H3	PNNZEUNXMCNLOQ-UHFFFAOYSA-N	COc1ccc2[nH]c3C(=NN)CCCc3c2c1	BroadT	BRD-K41872267	BRD-K41872267-001-05-5	InterBioScreen Ltd.	STOCK1S-94716			COc1ccc2[nH]c3c(CCCC3=NN)c2c1	InChI=1S/C13H15N3O/c1-17-8-5-6-11-10(7-8)9-3-2-4-12(16-14)13(9)15-11/h5-7,15H,2-4,14H2,1H3	PNNZEUNXMCNLOQ-UHFFFAOYSA-N	229.12151213							
Ethyl 4-phenoxy-2-phenyl-5-pyrimidinecarboxylate	LSM-20669	SID17411180, BRD-K33798284	1474625	InChI=1S/C19H16N2O3/c1-2-23-19(22)16-13-20-17(14-9-5-3-6-10-14)21-18(16)24-15-11-7-4-8-12-15/h3-13H,2H2,1H3	YXRZPWSCYIXPDK-UHFFFAOYSA-N	CCOC(=O)c1cnc(nc1Oc2ccccc2)c3ccccc3	BroadT	BRD-K33798284	BRD-K33798284-001-05-1	Key Organics Ltd.	11M-574S			CCOC(=O)c1cnc(nc1Oc1ccccc1)-c1ccccc1	InChI=1S/C19H16N2O3/c1-2-23-19(22)16-13-20-17(14-9-5-3-6-10-14)21-18(16)24-15-11-7-4-8-12-15/h3-13H,2H2,1H3	YXRZPWSCYIXPDK-UHFFFAOYSA-N	320.116092392							109272
BRD-A47226259	LSM-20670			InChI=1S/C24H21N3O3/c1-15-7-8-16(2)19(11-15)22(28)20-21(18-6-4-10-26-13-18)27(24(30)23(20)29)14-17-5-3-9-25-12-17/h3-13,20-21H,14H2,1-2H3	CGOGFZVEMXOBMD-UHFFFAOYSA-N	Cc1ccc(C)c(c1)C(=O)C2C(N(Cc3cccnc3)C(=O)C2=O)c4cccnc4	BroadT	BRD-A47226259	BRD-A47226259-001-05-0	Asinex Ltd.	BAS 06026882			Cc1ccc(C)c(c1)C(=O)C1C(N(Cc2cccnc2)C(=O)C1=O)c1cccnc1	InChI=1S/C24H21N3O3/c1-15-7-8-16(2)19(11-15)22(28)20-21(18-6-4-10-26-13-18)27(24(30)23(20)29)14-17-5-3-9-25-12-17/h3-13,20-21H,14H2,1-2H3	CGOGFZVEMXOBMD-UHFFFAOYSA-N	399.158291562							109273
AH-034/07357035	LSM-20671	SID49644681, BRD-K44697642	1736002	InChI=1S/C19H17N5O5S/c1-12-11-13(2)21-19(20-12)23-30(28,29)15-9-7-14(8-10-15)22-18(25)16-5-3-4-6-17(16)24(26)27/h3-11H,1-2H3,(H,22,25)(H,20,21,23)	AGHRYYKCIBSXOG-UHFFFAOYSA-N	Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2)n1	BroadT	BRD-K44697642	BRD-K44697642-001-05-9	Asinex Ltd.	BAS 00803236			Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3[N+]([O-])=O)cc2)n1	InChI=1S/C19H17N5O5S/c1-12-11-13(2)21-19(20-12)23-30(28,29)15-9-7-14(8-10-15)22-18(25)16-5-3-4-6-17(16)24(26)27/h3-11H,1-2H3,(H,22,25)(H,20,21,23)	AGHRYYKCIBSXOG-UHFFFAOYSA-N	427.095039384							109274
F1811-0096	LSM-20672	SID7970431, BRD-K69289993	2149976	InChI=1S/C12H18N4O4/c17-10(7-9-8-11(18)15-12(19)14-9)13-1-2-16-3-5-20-6-4-16/h8H,1-7H2,(H,13,17)(H2,14,15,18,19)	GICVUYWOEGQCFG-UHFFFAOYSA-N	Oc1cc(CC(=O)NCCN2CCOCC2)nc(O)n1	BroadT	BRD-K69289993	BRD-K69289993-001-05-0	Life Chemicals Inc.	F1811-0096			Oc1cc(CC(=O)NCCN2CCOCC2)nc(O)n1	InChI=1S/C12H18N4O4/c17-10(7-9-8-11(18)15-12(19)14-9)13-1-2-16-3-5-20-6-4-16/h8H,1-7H2,(H,13,17)(H2,14,15,18,19)	GICVUYWOEGQCFG-UHFFFAOYSA-N	282.132805096							109275
MLS000039439	LSM-20673	SID864501, BRD-K86918695	665745	InChI=1S/C13H15N3O2S/c17-11(10-7-4-8-18-10)14-13-16-15-12(19-13)9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,14,16,17)	SBHIZIZLGXXVTL-UHFFFAOYSA-N	O=C(Nc1nnc(s1)C2CCCCC2)c3occc3	BroadT	BRD-K86918695	BRD-K86918695-001-05-4	InterBioScreen Ltd.	STOCK5S-23360			O=C(Nc1nnc(s1)C1CCCCC1)c1ccco1	InChI=1S/C13H15N3O2S/c17-11(10-7-4-8-18-10)14-13-16-15-12(19-13)9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,14,16,17)	SBHIZIZLGXXVTL-UHFFFAOYSA-N	277.08849744							109276
AC1N4BWN	LSM-15313	BRD-K31132128	4153055	InChI=1S/C26H34ClN3O5S/c1-3-29(4-2)17-18-35-26(32)20-9-12-22(13-10-20)28-25(31)21-11-14-23(27)24(19-21)36(33,34)30-15-7-5-6-8-16-30/h9-14,19H,3-8,15-18H2,1-2H3,(H,28,31)	IXBZKSGTYRHANP-UHFFFAOYSA-N	CCN(CC)CCOC(=O)c1ccc(NC(=O)c2ccc(Cl)c(c2)S(=O)(=O)N3CCCCCC3)cc1	BroadT	BRD-K31132128	BRD-K31132128-003-05-1	Enamine Ltd.	T0505-4606		Cl	CCN(CC)CCOC(=O)c1ccc(NC(=O)c2ccc(Cl)c(c2)S(=O)(=O)N2CCCCCC2)cc1.Cl	InChI=1S/C26H34ClN3O5S.ClH/c1-3-29(4-2)17-18-35-26(32)20-9-12-22(13-10-20)28-25(31)21-11-14-23(27)24(19-21)36(33,34)30-15-7-5-6-8-16-30;/h9-14,19H,3-8,15-18H2,1-2H3,(H,28,31);1H	CXDTURBNAVTGFQ-UHFFFAOYSA-N	535.190769618							103960, 103960
ZINC03212908	LSM-20674	SID24827207, BRD-K49505282	2331656	InChI=1S/C13H14N2/c1-10-6-8-11(9-7-10)15-13-5-3-2-4-12(13)14/h2-9,15H,14H2,1H3	UUFIHEBXYDLWTO-UHFFFAOYSA-N	Cc1ccc(Nc2ccccc2N)cc1	BroadT	BRD-K49505282	BRD-K49505282-001-05-4	Enamine Ltd.	T0514-1509			Cc1ccc(Nc2ccccc2N)cc1	InChI=1S/C13H14N2/c1-10-6-8-11(9-7-10)15-13-5-3-2-4-12(13)14/h2-9,15H,14H2,1H3	UUFIHEBXYDLWTO-UHFFFAOYSA-N	198.115698468							109277
SMR000031388	LSM-20675	SID4247980, BRD-A57431786	3242118	InChI=1S/C14H12N2O3S/c1-7-12-11(9-5-3-4-6-10(9)20-12)13(17)16(15-7)8(2)14(18)19/h3-6,8H,1-2H3,(H,18,19)	OSERJAMIDNURES-UHFFFAOYSA-N	CC(N1N=C(C)c2sc3ccccc3c2C1=O)C(=O)O	BroadT	BRD-A57431786	BRD-A57431786-001-05-5	ChemDiv Inc.	K780-1094			CC(C(O)=O)n1nc(C)c2sc3ccccc3c2c1=O	InChI=1S/C14H12N2O3S/c1-7-12-11(9-5-3-4-6-10(9)20-12)13(17)16(15-7)8(2)14(18)19/h3-6,8H,1-2H3,(H,18,19)	OSERJAMIDNURES-UHFFFAOYSA-N	288.056862954							109278
ZINC03065565	LSM-20676	SID24830931, BRD-K09494032	2302746	InChI=1S/C18H16N2O/c21-18(20-16-10-2-1-3-11-16)19-13-15-9-6-8-14-7-4-5-12-17(14)15/h1-12H,13H2,(H2,19,20,21)	VFDZNBDGZLNNHI-UHFFFAOYSA-N	O=C(NCc1cccc2ccccc12)Nc3ccccc3	BroadT	BRD-K09494032	BRD-K09494032-001-05-2	Enamine Ltd.	T0400-4158			O=C(NCc1cccc2ccccc12)Nc1ccccc1	InChI=1S/C18H16N2O/c21-18(20-16-10-2-1-3-11-16)19-13-15-9-6-8-14-7-4-5-12-17(14)15/h1-12H,13H2,(H2,19,20,21)	VFDZNBDGZLNNHI-UHFFFAOYSA-N	276.126263152							109279
SMR000015484	LSM-42840	BRD-K01578344, SID7970927, SID87225488, SID89650203, SID89650212	5310346	InChI=1S/C19H22N4O2S/c1-3-4-12-23-15-16(22(2)18(25)21-17(15)24)20-19(23)26-13-8-11-14-9-6-5-7-10-14/h3-7,9-10H,8,11-13H2,1-2H3,(H,21,24,25)/b4-3+	MGHRGGHCCMMDND-ONEGZZNKSA-N	C\C=C\Cn1c(SCCCc2ccccc2)nc3N(C)C(=O)NC(=O)c13	BroadT	BRD-K01578344	BRD-K01578344-001-05-3	Life Chemicals Inc.	F0381-3333			C\C=C\Cn1c(SCCCc2ccccc2)nc2n(C)c(=O)[nH]c(=O)c12	InChI=1S/C19H22N4O2S/c1-3-4-12-23-15-16(22(2)18(25)21-17(15)24)20-19(23)26-13-8-11-14-9-6-5-7-10-14/h3-7,9-10H,8,11-13H2,1-2H3,(H,21,24,25)/b4-3+	MGHRGGHCCMMDND-ONEGZZNKSA-N	370.146346674							
N'-(3-methylphenyl)cyclobutanecarbohydrazide	LSM-20677	SID26726487, BRD-K55763533	2812381	InChI=1S/C12H16N2O/c1-9-4-2-7-11(8-9)13-14-12(15)10-5-3-6-10/h2,4,7-8,10,13H,3,5-6H2,1H3,(H,14,15)	ACTRZKFUNCFTJE-UHFFFAOYSA-N	Cc1cccc(NNC(=O)C2CCC2)c1	BroadT	BRD-K55763533	BRD-K55763533-001-05-7	Maybridge	HTS 05360			Cc1cccc(NNC(=O)C2CCC2)c1	InChI=1S/C12H16N2O/c1-9-4-2-7-11(8-9)13-14-12(15)10-5-3-6-10/h2,4,7-8,10,13H,3,5-6H2,1H3,(H,14,15)	ACTRZKFUNCFTJE-UHFFFAOYSA-N	204.126263152							109280
2-Ethylsulfanyl-5-(4-methoxy-phenyl)-[1,3,4]oxadiazole	LSM-20678	SID848948, BRD-K12852670	651410	InChI=1S/C11H12N2O2S/c1-3-16-11-13-12-10(15-11)8-4-6-9(14-2)7-5-8/h4-7H,3H2,1-2H3	RWIXHUVOMHDDPG-UHFFFAOYSA-N	CCSc1oc(nn1)c2ccc(OC)cc2	BroadT	BRD-K12852670	BRD-K12852670-001-05-3	Asinex Ltd.	BAS 04370613			CCSc1nnc(o1)-c1ccc(OC)cc1	InChI=1S/C11H12N2O2S/c1-3-16-11-13-12-10(15-11)8-4-6-9(14-2)7-5-8/h4-7H,3H2,1-2H3	RWIXHUVOMHDDPG-UHFFFAOYSA-N	236.061948334							109281
3-Benzylquinoxalin-2(1H)-one	LSM-20679	SID858399, BRD-K66258392	659725	InChI=1S/C15H12N2O/c18-15-14(10-11-6-2-1-3-7-11)16-12-8-4-5-9-13(12)17-15/h1-9H,10H2,(H,17,18)	XEVRCXXOIPCZGJ-UHFFFAOYSA-N	Oc1nc2ccccc2nc1Cc3ccccc3	BroadT	BRD-K66258392	BRD-K66258392-001-05-5	InterBioScreen Ltd.	STOCK2S-48771			Oc1nc2ccccc2nc1Cc1ccccc1	InChI=1S/C15H12N2O/c18-15-14(10-11-6-2-1-3-7-11)16-12-8-4-5-9-13(12)17-15/h1-9H,10H2,(H,17,18)	XEVRCXXOIPCZGJ-UHFFFAOYSA-N	236.094963024							109282
9-(1H-Indol-3-yl)acridine	LSM-20680	SID14727081, BRD-K33554807	3131058	InChI=1S/C21H14N2/c1-4-10-18-14(7-1)17(13-22-18)21-15-8-2-5-11-19(15)23-20-12-6-3-9-16(20)21/h1-13,22H	GDVZXLBQMLKZDB-UHFFFAOYSA-N	c1ccc2c(c3c[nH]c4ccccc34)c5ccccc5nc2c1	BroadT	BRD-K33554807	BRD-K33554807-001-06-4	Asinex Ltd.	BAS 01371054			c1[nH]c2ccccc2c1-c1c2ccccc2nc2ccccc12	InChI=1S/C21H14N2/c1-4-10-18-14(7-1)17(13-22-18)21-15-8-2-5-11-19(15)23-20-12-6-3-9-16(20)21/h1-13,22H	GDVZXLBQMLKZDB-UHFFFAOYSA-N	294.115698468							109283
AC1OAKVQ	LSM-20681	BRD-A81956678	6831281	InChI=1S/C18H19BrN4O3/c19-15-1-2-16(24)14(11-15)12-21-22-18(25)17(13-3-5-20-6-4-13)23-7-9-26-10-8-23/h1-6,11-12,17,24H,7-10H2,(H,22,25)	WCSXSFXABUGTAD-UHFFFAOYSA-N	Oc1ccc(Br)cc1C=NNC(=O)C(N2CCOCC2)c3ccncc3	BroadT	BRD-A81956678	BRD-A81956678-001-06-0	InterBioScreen Ltd.	STOCK2S-68224			Oc1ccc(Br)cc1C=NNC(=O)C(N1CCOCC1)c1ccncc1	InChI=1S/C18H19BrN4O3/c19-15-1-2-16(24)14(11-15)12-21-22-18(25)17(13-3-5-20-6-4-13)23-7-9-26-10-8-23/h1-6,11-12,17,24H,7-10H2,(H,22,25)	WCSXSFXABUGTAD-UHFFFAOYSA-N	418.064053108							
ZINC01036119	LSM-20682	SID26731428, BRD-K78496697	2816622	InChI=1S/C20H16N2O3S2/c1-24-13-8-9-15(16(10-13)25-2)22-19(23)14-11-17(12-6-4-3-5-7-12)27-18(14)21-20(22)26/h3-11H,1-2H3,(H,21,26)	DJMPOERCABAULR-UHFFFAOYSA-N	COc1ccc(N2C(=S)Nc3sc(cc3C2=O)c4ccccc4)c(OC)c1	BroadT	BRD-K78496697	BRD-K78496697-001-05-9	Maybridge	HTS 12828			COc1ccc(c(OC)c1)-n1c(=S)[nH]c2sc(cc2c1=O)-c1ccccc1	InChI=1S/C20H16N2O3S2/c1-24-13-8-9-15(16(10-13)25-2)22-19(23)14-11-17(12-6-4-3-5-7-12)27-18(14)21-20(22)26/h3-11H,1-2H3,(H,21,26)	DJMPOERCABAULR-UHFFFAOYSA-N	396.060233772							109285
MLS000571505	LSM-20683	SID16953644, BRD-K07250593	2124930	InChI=1S/C17H24N2O2S/c1-17(2,3)13-6-8-14(9-7-13)21-11-4-5-15(20)19-16-18-10-12-22-16/h6-9H,4-5,10-12H2,1-3H3,(H,18,19,20)	IXMAETAZRNHAQE-UHFFFAOYSA-N	CC(C)(C)c1ccc(OCCCC(=O)NC2=NCCS2)cc1	BroadT	BRD-K07250593	BRD-K07250593-001-06-9	Enamine Ltd.	T5252829			CC(C)(C)c1ccc(OCCCC(=O)NC2=NCCS2)cc1	InChI=1S/C17H24N2O2S/c1-17(2,3)13-6-8-14(9-7-13)21-11-4-5-15(20)19-16-18-10-12-22-16/h6-9H,4-5,10-12H2,1-3H3,(H,18,19,20)	IXMAETAZRNHAQE-UHFFFAOYSA-N	320.155848718							109286
1-(3-Phenoxypropyl)-1H-indole-3-carbonitrile	LSM-20684	SID14725951, BRD-K66660676	1814064	InChI=1S/C18H16N2O/c19-13-15-14-20(18-10-5-4-9-17(15)18)11-6-12-21-16-7-2-1-3-8-16/h1-5,7-10,14H,6,11-12H2	AGPINAKWCPQLMO-UHFFFAOYSA-N	N#Cc1cn(CCCOc2ccccc2)c3ccccc13	BroadT	BRD-K66660676	BRD-K66660676-001-06-7	Asinex Ltd.	BAS 06662196			N#Cc1cn(CCCOc2ccccc2)c2ccccc12	InChI=1S/C18H16N2O/c19-13-15-14-20(18-10-5-4-9-17(15)18)11-6-12-21-16-7-2-1-3-8-16/h1-5,7-10,14H,6,11-12H2	AGPINAKWCPQLMO-UHFFFAOYSA-N	276.126263152							109287
ILP-II-33	LSM-20685	SID24833103, BRD-K18167003	16196401	InChI=1S/C22H30N4O4/c1-14(2)11-16(21(29)30-22(3,4)5)26-20(28)18-17(24-13-25-18)19(27)23-12-15-9-7-6-8-10-15/h6-10,13-14,16H,11-12H2,1-5H3,(H,23,27)(H,24,25)(H,26,28)/t16-/m0/s1	DLXSERVXPFDFMM-INIZCTEOSA-N	CC(C)C[C@H](NC(=O)c1[nH]cnc1C(=O)NCc2ccccc2)C(=O)OC(C)(C)C	BroadT	BRD-K18167003	BRD-K18167003-001-06-6	University of Tulsa	ILP-II-33 AE08_PA05			CC(C)C[C@H](NC(=O)c1[nH]cnc1C(=O)NCc1ccccc1)C(=O)OC(C)(C)C	InChI=1S/C22H30N4O4/c1-14(2)11-16(21(29)30-22(3,4)5)26-20(28)18-17(24-13-25-18)19(27)23-12-15-9-7-6-8-10-15/h6-10,13-14,16H,11-12H2,1-5H3,(H,23,27)(H,24,25)(H,26,28)/t16-/m0/s1	DLXSERVXPFDFMM-INIZCTEOSA-N	414.22670548							109288
MLS000094684	LSM-20686	SID4247042, BRD-A37823663	3241299	InChI=1S/C19H25N3O4/c1-2-3-4-9-20-17(23)13-7-8-15-16(11-13)21-19(25)22(18(15)24)12-14-6-5-10-26-14/h7-8,11,14H,2-6,9-10,12H2,1H3,(H,20,23)(H,21,25)	RENFDUMNIKCHGX-UHFFFAOYSA-N	CCCCCNC(=O)c1ccc2C(=O)N(CC3CCCO3)C(=O)Nc2c1	BroadT	BRD-A37823663	BRD-A37823663-001-06-4	ChemDiv Inc.	K221-3260			CCCCCNC(=O)c1ccc2c(c1)[nH]c(=O)n(CC1CCCO1)c2=O	InChI=1S/C19H25N3O4/c1-2-3-4-9-20-17(23)13-7-8-15-16(11-13)21-19(25)22(18(15)24)12-14-6-5-10-26-14/h7-8,11,14H,2-6,9-10,12H2,1H3,(H,20,23)(H,21,25)	RENFDUMNIKCHGX-UHFFFAOYSA-N	359.18450631							109289
AC1MYZDS	LSM-20687	SID26662519, BRD-K52539770	3839974	InChI=1S/C20H21N5OS/c1-4-12(5-2)19-24-25-17(21)15(18(26)23-20(25)27-19)10-14-11(3)22-16-9-7-6-8-13(14)16/h6-10,12,21-22H,4-5H2,1-3H3/b15-10+,21-17?	RKNUHQSHORJKPG-INIXKHHFSA-N	CCC(CC)C1=NN2C(=NC(=O)\C(=C\c3c(C)[nH]c4ccccc34)\C2=N)S1	BroadT	BRD-K52539770	BRD-K52539770-001-05-6	InterBioScreen Ltd.	STOCK5S-07219			CCC(CC)C1=NN2C(S1)=NC(=O)\C(=C\c1c(C)[nH]c3ccccc13)C2=N	InChI=1S/C20H21N5OS/c1-4-12(5-2)19-24-25-17(21)15(18(26)23-20(25)27-19)10-14-11(3)22-16-9-7-6-8-13(14)16/h6-10,12,21-22H,4-5H2,1-3H3/b15-10+,21-17?	RKNUHQSHORJKPG-INIXKHHFSA-N	379.146681032							
Chalepensin	LSM-20688	SID26725091, SID22405480, BRD-K01892695	128834	InChI=1S/C16H14O3/c1-4-16(2,3)12-8-11-7-10-5-6-18-13(10)9-14(11)19-15(12)17/h4-9H,1H2,2-3H3	FYCCCUNGXGKNJV-UHFFFAOYSA-N	CC(C)(C=C)C1=Cc2cc3ccoc3cc2OC1=O	BroadT	BRD-K01892695	BRD-K01892695-001-06-1	University of North Carolina at Chapel Hill	Chalepensin LBT-07			CC(C)(C=C)c1cc2cc3ccoc3cc2oc1=O	InChI=1S/C16H14O3/c1-4-16(2,3)12-8-11-7-10-5-6-18-13(10)9-14(11)19-15(12)17/h4-9H,1H2,2-3H3	FYCCCUNGXGKNJV-UHFFFAOYSA-N	254.094294308							3572
MLS000699454	LSM-20689	SID22403374, BRD-K96678250	1790658	InChI=1S/C18H18ClN3O5S/c1-25-13-8-11(9-14(26-2)15(13)27-3)17(24)21-22-18(28)20-16(23)10-4-6-12(19)7-5-10/h4-9H,1-3H3,(H,21,24)(H2,20,22,23,28)	ACNWFEJEHMZZTJ-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)NNC(=S)NC(=O)c2ccc(Cl)cc2	BroadT	BRD-K96678250	BRD-K96678250-001-07-5	Specs	AN-329/41563807			COc1cc(cc(OC)c1OC)C(=O)NNC(=S)NC(=O)c1ccc(Cl)cc1	InChI=1S/C18H18ClN3O5S/c1-25-13-8-11(9-14(26-2)15(13)27-3)17(24)21-22-18(28)20-16(23)10-4-6-12(19)7-5-10/h4-9H,1-3H3,(H,21,24)(H2,20,22,23,28)	ACNWFEJEHMZZTJ-UHFFFAOYSA-N	423.065569106							109291
5-({[5-Benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole	LSM-20690	SID4265906, BRD-K03485843	1249303	InChI=1S/C22H16FN5OS2/c23-16-8-10-17(11-9-16)28-19(13-15-5-2-1-3-6-15)25-26-22(28)31-14-20-24-21(27-29-20)18-7-4-12-30-18/h1-12H,13-14H2	WKPFOSNUERXNOJ-UHFFFAOYSA-N	Fc1ccc(cc1)n2c(Cc3ccccc3)nnc2SCc4onc(n4)c5cccs5	BroadT	BRD-K03485843	BRD-K03485843-001-05-5	ChemBridge Corporation	7953966			Fc1ccc(cc1)-n1c(Cc2ccccc2)nnc1SCc1nc(no1)-c1cccs1	InChI=1S/C22H16FN5OS2/c23-16-8-10-17(11-9-16)28-19(13-15-5-2-1-3-6-15)25-26-22(28)31-14-20-24-21(27-29-20)18-7-4-12-30-18/h1-12H,13-14H2	WKPFOSNUERXNOJ-UHFFFAOYSA-N	449.078029762							109292
AC1LIZS9	LSM-20691	SID26669395, BRD-K88404286	914399	InChI=1S/C16H20N4O/c1-3-16(4-2)9-10-7-5-6-8-11(10)13-12(16)14(21)19-15(18-13)20-17/h5-8H,3-4,9,17H2,1-2H3,(H2,18,19,20,21)	JTKNPFVJLYNBFR-UHFFFAOYSA-N	CCC1(CC)Cc2ccccc2c3nc(NN)nc(O)c13	BroadT	BRD-K88404286	BRD-K88404286-001-05-8	InterBioScreen Ltd.	STOCK1S-44728			CCC1(CC)Cc2ccccc2-c2nc(NN)nc(O)c12	InChI=1S/C16H20N4O/c1-3-16(4-2)9-10-7-5-6-8-11(10)13-12(16)14(21)19-15(18-13)20-17/h5-8H,3-4,9,17H2,1-2H3,(H2,18,19,20,21)	JTKNPFVJLYNBFR-UHFFFAOYSA-N	284.1637113							109293
MLS000094290	LSM-20692	SID4246116, BRD-K36724856	3240500	InChI=1S/C18H24N4OS/c1-2-21-9-11-22(12-10-21)14-15-5-7-16(8-6-15)19-18(23)20-17-4-3-13-24-17/h3-8,13H,2,9-12,14H2,1H3,(H2,19,20,23)	CZDJAOWKZQKIOG-UHFFFAOYSA-N	CCN1CCN(Cc2ccc(NC(=O)Nc3cccs3)cc2)CC1	BroadT	BRD-K36724856	BRD-K36724856-001-05-2	ChemDiv Inc.	E002-0043			CCN1CCN(Cc2ccc(NC(=O)Nc3cccs3)cc2)CC1	InChI=1S/C18H24N4OS/c1-2-21-9-11-22(12-10-21)14-15-5-7-16(8-6-15)19-18(23)20-17-4-3-13-24-17/h3-8,13H,2,9-12,14H2,1H3,(H2,19,20,23)	CZDJAOWKZQKIOG-UHFFFAOYSA-N	344.167082118							109294
ZINC00350245	LSM-20693	SID24808647, BRD-K05146155	828719	InChI=1S/C15H15N3OS/c1-2-7-18-10-16-12-9-11(5-6-13(12)18)17-15(19)14-4-3-8-20-14/h3-6,8-10H,2,7H2,1H3,(H,17,19)	MCSFXOOAQRIUGA-UHFFFAOYSA-N	CCCn1cnc2cc(NC(=O)c3cccs3)ccc12	BroadT	BRD-K05146155	BRD-K05146155-001-05-3	Asinex Ltd.	BAS 10209860			CCCn1cnc2cc(NC(=O)c3cccs3)ccc12	InChI=1S/C15H15N3OS/c1-2-7-18-10-16-12-9-11(5-6-13(12)18)17-15(19)14-4-3-8-20-14/h3-6,8-10H,2,7H2,1H3,(H,17,19)	MCSFXOOAQRIUGA-UHFFFAOYSA-N	285.09358282							109295
T6158250	LSM-20694	SID4247857, BRD-K73578757	3242010	InChI=1S/C10H11N3OS2/c14-6-7-15-10-13-12-9(16-10)11-8-4-2-1-3-5-8/h1-5,14H,6-7H2,(H,11,12)	WVXJMKWHXSHISK-UHFFFAOYSA-N	OCCSc1nnc(Nc2ccccc2)s1	BroadT	BRD-K73578757	BRD-K73578757-001-05-6	ChemDiv Inc.	5822-0015			OCCSc1nnc(Nc2ccccc2)s1	InChI=1S/C10H11N3OS2/c14-6-7-15-10-13-12-9(16-10)11-8-4-2-1-3-5-8/h1-5,14H,6-7H2,(H,11,12)	WVXJMKWHXSHISK-UHFFFAOYSA-N	253.034353382							109296
N-(4-Fluorophenyl)-4-methylpiperidine-1-carbothioamide	LSM-20695	SID22403978, BRD-K69654496	681249	InChI=1S/C13H17FN2S/c1-10-6-8-16(9-7-10)13(17)15-12-4-2-11(14)3-5-12/h2-5,10H,6-9H2,1H3,(H,15,17)	CSJXZIYTOPXCEY-UHFFFAOYSA-N	CC1CCN(CC1)C(=Nc2ccc(F)cc2)S	BroadT	BRD-K69654496	BRD-K69654496-001-05-7	ChemBridge Corporation	6224231			CC1CCN(CC1)C(S)=Nc1ccc(F)cc1	InChI=1S/C13H17FN2S/c1-10-6-8-16(9-7-10)13(17)15-12-4-2-11(14)3-5-12/h2-5,10H,6-9H2,1H3,(H,15,17)	CSJXZIYTOPXCEY-UHFFFAOYSA-N	252.109647454							109297
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-n-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]acetamide	LSM-20696	SID4260793, BRD-K17186708	1017568	InChI=1S/C20H21F3N6O4/c1-26-17-16(18(31)27(2)19(26)32)24-11-29(17)10-15(30)25-13-9-12(20(21,22)23)3-4-14(13)28-5-7-33-8-6-28/h3-4,9,11H,5-8,10H2,1-2H3,(H,25,30)	IABMUKYFUPBYAS-UHFFFAOYSA-N	CN1C(=O)N(C)c2c(ncn2CC(=O)Nc3cc(ccc3N4CCOCC4)C(F)(F)F)C1=O	BroadT	BRD-K17186708	BRD-K17186708-001-05-7	ChemBridge Corporation	7837343			Cn1c2n(CC(=O)Nc3cc(ccc3N3CCOCC3)C(F)(F)F)cnc2c(=O)n(C)c1=O	InChI=1S/C20H21F3N6O4/c1-26-17-16(18(31)27(2)19(26)32)24-11-29(17)10-15(30)25-13-9-12(20(21,22)23)3-4-14(13)28-5-7-33-8-6-28/h3-4,9,11H,5-8,10H2,1-2H3,(H,25,30)	IABMUKYFUPBYAS-UHFFFAOYSA-N	466.157637812							109298
STK284307	LSM-20697	SID4259689, BRD-K54075813	2226500	InChI=1S/C16H15NO3/c1-12(18)20-15-9-7-14(8-10-15)17-16(19)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,17,19)	QEXMAYMATHBQRP-UHFFFAOYSA-N	CC(=O)Oc1ccc(NC(=O)Cc2ccccc2)cc1	BroadT	BRD-K54075813	BRD-K54075813-001-05-8	ChemBridge Corporation	7951512			CC(=O)Oc1ccc(NC(=O)Cc2ccccc2)cc1	InChI=1S/C16H15NO3/c1-12(18)20-15-9-7-14(8-10-15)17-16(19)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,17,19)	QEXMAYMATHBQRP-UHFFFAOYSA-N	269.10519335							109299
AC1LXX4R	LSM-43891	SID26669593, BRD-K56695267	1839213	InChI=1S/C24H25N5O3/c1-17-8-6-12-29-21(17)27-22(28-10-4-2-3-5-11-28)20(24(29)31)14-18(15-25)23(30)26-16-19-9-7-13-32-19/h6-9,12-14H,2-5,10-11,16H2,1H3,(H,26,30)/b18-14+	NYIFFEFWAYPYMW-NBVRZTHBSA-N	CC1=CC=CN2C(=O)C(=C(N=C12)N3CCCCCC3)\C=C(/C#N)\C(=O)NCc4occc4	BroadT	BRD-K56695267	BRD-K56695267-001-04-5	InterBioScreen Ltd.	STOCK3S-51629			Cc1cccn2c1nc(N1CCCCCC1)c(\C=C(/C#N)C(=O)NCc1ccco1)c2=O	InChI=1S/C24H25N5O3/c1-17-8-6-12-29-21(17)27-22(28-10-4-2-3-5-11-28)20(24(29)31)14-18(15-25)23(30)26-16-19-9-7-13-32-19/h6-9,12-14H,2-5,10-11,16H2,1H3,(H,26,30)/b18-14+	NYIFFEFWAYPYMW-NBVRZTHBSA-N	431.19573971							
SMR000129372	LSM-20699	SID14735330, BRD-K66293378	4018255	InChI=1S/C22H22N2O3/c1-22(2,3)16-8-6-15(7-9-16)20(25)23-17-10-12-18(13-11-17)24-21(26)19-5-4-14-27-19/h4-14H,1-3H3,(H,23,25)(H,24,26)	OIECWUVIVYHSMW-UHFFFAOYSA-N	CC(C)(C)c1ccc(cc1)C(=O)Nc2ccc(NC(=O)c3occc3)cc2	BroadT	BRD-K66293378	BRD-K66293378-001-05-0	ChemDiv Inc.	2006-0171			CC(C)(C)c1ccc(cc1)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1	InChI=1S/C22H22N2O3/c1-22(2,3)16-8-6-15(7-9-16)20(25)23-17-10-12-18(13-11-17)24-21(26)19-5-4-14-27-19/h4-14H,1-3H3,(H,23,25)(H,24,26)	OIECWUVIVYHSMW-UHFFFAOYSA-N	362.163042584							109301
MLS000702038	LSM-20700	SID22405167, BRD-K03447246	5197142	InChI=1S/C32H48N4O2/c1-31(2,3)27-13-9-25(10-14-27)29(37)33-17-7-19-35-21-23-36(24-22-35)20-8-18-34-30(38)26-11-15-28(16-12-26)32(4,5)6/h9-16H,7-8,17-24H2,1-6H3,(H,33,37)(H,34,38)	WTTJSZMHLRCCHR-UHFFFAOYSA-N	CC(C)(C)c1ccc(cc1)C(=O)NCCCN2CCN(CCCNC(=O)c3ccc(cc3)C(C)(C)C)CC2	BroadT	BRD-K03447246	BRD-K03447246-001-06-6	Specs	AK-968/41926811			CC(C)(C)c1ccc(cc1)C(=O)NCCCN1CCN(CCCNC(=O)c2ccc(cc2)C(C)(C)C)CC1	InChI=1S/C32H48N4O2/c1-31(2,3)27-13-9-25(10-14-27)29(37)33-17-7-19-35-21-23-36(24-22-35)20-8-18-34-30(38)26-11-15-28(16-12-26)32(4,5)6/h9-16H,7-8,17-24H2,1-6H3,(H,33,37)(H,34,38)	WTTJSZMHLRCCHR-UHFFFAOYSA-N	520.377726816							109302
ST50895218	LSM-20701	SID24795149, BRD-K78623196	1261442	InChI=1S/C19H14BrN5O/c1-12-5-6-17-15(7-12)16(19(26)24-25-10-21-22-11-25)9-18(23-17)13-3-2-4-14(20)8-13/h2-11H,1H3,(H,24,26)	ZJPDYYQUXMXISP-UHFFFAOYSA-N	Cc1ccc2nc(cc(C(=O)Nn3cnnc3)c2c1)c4cccc(Br)c4	BroadT	BRD-K78623196	BRD-K78623196-001-05-4	ChemBridge Corporation	7923373			Cc1ccc2nc(cc(C(=O)Nn3cnnc3)c2c1)-c1cccc(Br)c1	InChI=1S/C19H14BrN5O/c1-12-5-6-17-15(7-12)16(19(26)24-25-10-21-22-11-25)9-18(23-17)13-3-2-4-14(20)8-13/h2-11H,1H3,(H,24,26)	ZJPDYYQUXMXISP-UHFFFAOYSA-N	407.038172718							109303
MLS000737094	LSM-20702	NSC-81750, BRD-K17859412	255834	InChI=1S/C15H15N5O4/c1-19-12-11(13(21)20(2)15(19)24)17-10(18-12)7-16-9-5-3-8(4-6-9)14(22)23/h3-6,16H,7H2,1-2H3,(H,17,18)(H,22,23)	ADUXQWIKSOSSDH-UHFFFAOYSA-N	CN1C(=O)N(C)c2[nH]c(CNc3ccc(cc3)C(=O)O)nc2C1=O	BroadT	BRD-K17859412	BRD-K17859412-001-06-4	National Cancer Institute Chemotherapeutic Agents Repository	81750			Cn1c2[nH]c(CNc3ccc(cc3)C(O)=O)nc2c(=O)n(C)c1=O	InChI=1S/C15H15N5O4/c1-19-12-11(13(21)20(2)15(19)24)17-10(18-12)7-16-9-5-3-8(4-6-9)14(22)23/h3-6,16H,7H2,1-2H3,(H,17,18)(H,22,23)	ADUXQWIKSOSSDH-UHFFFAOYSA-N	329.11240401							109304
Ethyl 4-[6-(4-oxo-2-thioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanoyl]piperazine-1-carboxylate	LSM-20703	SID24811948, BRD-K18218705	3670171	InChI=1S/C19H26N4O4S2/c1-2-27-19(26)22-11-9-21(10-12-22)15(24)6-4-3-5-8-23-17(25)16-14(7-13-29-16)20-18(23)28/h7,13H,2-6,8-12H2,1H3,(H,20,28)	LDBVGHOXBANFDD-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)CCCCCN2C(=S)Nc3ccsc3C2=O	BroadT	BRD-K18218705	BRD-K18218705-001-05-0	ChemDiv Inc.	K292-1563			CCOC(=O)N1CCN(CC1)C(=O)CCCCCn1c(=S)[nH]c2ccsc2c1=O	InChI=1S/C19H26N4O4S2/c1-2-27-19(26)22-11-9-21(10-12-22)15(24)6-4-3-5-8-23-17(25)16-14(7-13-29-16)20-18(23)28/h7,13H,2-6,8-12H2,1H3,(H,20,28)	LDBVGHOXBANFDD-UHFFFAOYSA-N	438.139546732							109305
AC1NM3CN	LSM-20704	SID14743184, BRD-A39671704	4971144	InChI=1S/C20H17ClN2O2/c1-13-10-20(24)23(19-5-3-2-4-17(13)19)12-16-11-18(22-25-16)14-6-8-15(21)9-7-14/h2-10,16H,11-12H2,1H3	ATXXZPRIZZTJII-UHFFFAOYSA-N	CC1=CC(=O)N(CC2CC(=NO2)c3ccc(Cl)cc3)c4ccccc14	BroadT	BRD-A39671704	BRD-A39671704-001-05-8	InterBioScreen Ltd.	STOCK5S-58338			Cc1cc(=O)n(CC2CC(=NO2)c2ccc(Cl)cc2)c2ccccc12	InChI=1S/C20H17ClN2O2/c1-13-10-20(24)23(19-5-3-2-4-17(13)19)12-16-11-18(22-25-16)14-6-8-15(21)9-7-14/h2-10,16H,11-12H2,1H3	ATXXZPRIZZTJII-UHFFFAOYSA-N	352.097855514							109306
MLS000094551	LSM-20705	SID4245992, BRD-K81320658	3240390	InChI=1S/C15H19N3O6S/c1-2-23-15(20)17-5-7-18(8-6-17)25(21,22)11-3-4-12-13(9-11)24-10-14(19)16-12/h3-4,9H,2,5-8,10H2,1H3,(H,16,19)	DLDSJSUYAFFPOP-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)S(=O)(=O)c2ccc3NC(=O)COc3c2	BroadT	BRD-K81320658	BRD-K81320658-001-06-1	ChemDiv Inc.	E245-0068			CCOC(=O)N1CCN(CC1)S(=O)(=O)c1ccc2NC(=O)COc2c1	InChI=1S/C15H19N3O6S/c1-2-23-15(20)17-5-7-18(8-6-17)25(21,22)11-3-4-12-13(9-11)24-10-14(19)16-12/h3-4,9H,2,5-8,10H2,1H3,(H,16,19)	DLDSJSUYAFFPOP-UHFFFAOYSA-N	369.099456048							109307
AC1LZ6V9	LSM-20706	BRD-K14588079	1943195	InChI=1S/C16H13BrN4O2/c1-10-7-14(20-19-10)16(22)21-18-9-13-5-6-15(23-13)11-3-2-4-12(17)8-11/h2-9H,1H3,(H,19,20)(H,21,22)	RTVJLIRTEZUTGU-UHFFFAOYSA-N	Cc1cc([nH]n1)C(=O)NN=Cc2oc(cc2)c3cccc(Br)c3	BroadT	BRD-K14588079	BRD-K14588079-001-04-1	InterBioScreen Ltd.	STOCK2S-89722			Cc1cc([nH]n1)C(=O)NN=Cc1ccc(o1)-c1cccc(Br)c1	InChI=1S/C16H13BrN4O2/c1-10-7-14(20-19-10)16(22)21-18-9-13-5-6-15(23-13)11-3-2-4-12(17)8-11/h2-9H,1H3,(H,19,20)(H,21,22)	RTVJLIRTEZUTGU-UHFFFAOYSA-N	372.022188296							109308
ILP-II-35	LSM-20707	SID24833891, BRD-K63426977	16196552	InChI=1S/C25H43N5O6/c1-16(2)14-17(22(33)35-24(3,4)5)30-21(32)19-18(28-15-29-19)20(31)26-12-10-9-11-13-27-23(34)36-25(6,7)8/h15-17H,9-14H2,1-8H3,(H,26,31)(H,27,34)(H,28,29)(H,30,32)/t17-/m0/s1	KMLVYALFXPFUSH-KRWDZBQOSA-N	CC(C)C[C@H](NC(=O)c1[nH]cnc1C(=O)NCCCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C	BroadT	BRD-K63426977	BRD-K63426977-001-05-4	University of Tulsa	ILP-II-35 AE08_PA07			CC(C)C[C@H](NC(=O)c1[nH]cnc1C(=O)NCCCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C	InChI=1S/C25H43N5O6/c1-16(2)14-17(22(33)35-24(3,4)5)30-21(32)19-18(28-15-29-19)20(31)26-12-10-9-11-13-27-23(34)36-25(6,7)8/h15-17H,9-14H2,1-8H3,(H,26,31)(H,27,34)(H,28,29)(H,30,32)/t17-/m0/s1	KMLVYALFXPFUSH-KRWDZBQOSA-N	509.321334146							109309
MLS001215820	LSM-20708	BRD-K01580628	16014987	InChI=1S/C22H19BrFN3O3/c1-29-20-9-13(11-25-15-6-7-18-19(10-15)27-22(28)26-18)8-16(23)21(20)30-12-14-4-2-3-5-17(14)24/h2-10,25H,11-12H2,1H3,(H2,26,27,28)	PEDJPQCZLJXYHL-UHFFFAOYSA-N	COc1cc(CNc2ccc3[nH]c(O)nc3c2)cc(Br)c1OCc4ccccc4F	BroadT	BRD-K01580628	BRD-K01580628-001-05-6	InterBioScreen Ltd.	STOCK6S-14031			COc1cc(CNc2ccc3[nH]c(O)nc3c2)cc(Br)c1OCc1ccccc1F	InChI=1S/C22H19BrFN3O3/c1-29-20-9-13(11-25-15-6-7-18-19(10-15)27-22(28)26-18)8-16(23)21(20)30-12-14-4-2-3-5-17(14)24/h2-10,25H,11-12H2,1H3,(H2,26,27,28)	PEDJPQCZLJXYHL-UHFFFAOYSA-N	471.059382298							109310
MLS000520489	LSM-20709	SID14735403, BRD-A37177090	9550700	InChI=1S/C19H30N2OS/c1-14-10-15(2)12-21(11-14)9-5-8-20-19(22)17-13-23-18-7-4-3-6-16(17)18/h13-15H,3-12H2,1-2H3,(H,20,22)	PSUWUZOXZUGHPC-UHFFFAOYSA-N	CC1CC(C)CN(CCCNC(=O)c2csc3CCCCc23)C1	BroadT	BRD-A37177090	BRD-A37177090-001-05-0	ChemDiv Inc.	C760-0466			CC1CC(C)CN(CCCNC(=O)c2csc3CCCCc23)C1	InChI=1S/C19H30N2OS/c1-14-10-15(2)12-21(11-14)9-5-8-20-19(22)17-13-23-18-7-4-3-6-16(17)18/h13-15H,3-12H2,1-2H3,(H,20,22)	PSUWUZOXZUGHPC-UHFFFAOYSA-N	334.20788429							109311
Furan-2-carboxylic acid [2,5-diethoxy-4-(3-isobutyl-thioureido)-phenyl]-amide	LSM-20710	SID17508237, BRD-K71525190	1172861	InChI=1S/C20H27N3O4S/c1-5-25-17-11-15(23-20(28)21-12-13(3)4)18(26-6-2)10-14(17)22-19(24)16-8-7-9-27-16/h7-11,13H,5-6,12H2,1-4H3,(H,22,24)(H2,21,23,28)	NVFVOIKPRWVFFX-UHFFFAOYSA-N	CCOc1cc(N=C(S)NCC(C)C)c(OCC)cc1NC(=O)c2occc2	BroadT	BRD-K71525190	BRD-K71525190-001-05-4	Asinex Ltd.	ASN 03271044			CCOc1cc(N=C(S)NCC(C)C)c(OCC)cc1NC(=O)c1ccco1	InChI=1S/C20H27N3O4S/c1-5-25-17-11-15(23-20(28)21-12-13(3)4)18(26-6-2)10-14(17)22-19(24)16-8-7-9-27-16/h7-11,13H,5-6,12H2,1-4H3,(H,22,24)(H2,21,23,28)	NVFVOIKPRWVFFX-UHFFFAOYSA-N	405.172227064							109312
SMR000247596	LSM-20711	SID22401670, BRD-K63158014	4831290	InChI=1S/C22H22F4N2O5S/c23-17-7-5-15(6-8-17)13-27-20(29)14-33-21(30)16-9-11-28(12-10-16)34(31,32)19-4-2-1-3-18(19)22(24,25)26/h1-8,16H,9-14H2,(H,27,29)	IDFOBVTYXQNKLI-UHFFFAOYSA-N	Fc1ccc(CNC(=O)COC(=O)C2CCN(CC2)S(=O)(=O)c3ccccc3C(F)(F)F)cc1	BroadT	BRD-K63158014	BRD-K63158014-001-05-8	Enamine Ltd.	T5292263			Fc1ccc(CNC(=O)COC(=O)C2CCN(CC2)S(=O)(=O)c2ccccc2C(F)(F)F)cc1	InChI=1S/C22H22F4N2O5S/c23-17-7-5-15(6-8-17)13-27-20(29)14-33-21(30)16-9-11-28(12-10-16)34(31,32)19-4-2-1-3-18(19)22(24,25)26/h1-8,16H,9-14H2,(H,27,29)	IDFOBVTYXQNKLI-UHFFFAOYSA-N	502.118555314							109313
SMR000217055	LSM-43892	SID17505988, BRD-K42476671	754779	InChI=1S/C17H11FN2O2S/c18-13-8-6-12(7-9-13)16(22)20-14(15(21)19-17(20)23)10-11-4-2-1-3-5-11/h1-10H,(H,19,21,23)/b14-10+	PSIHFKPXRKBLPT-GXDHUFHOSA-N	Fc1ccc(cc1)C(=O)N2C(=S)NC(=O)/C/2=C\c3ccccc3	BroadT	BRD-K42476671	BRD-K42476671-001-05-4	InterBioScreen Ltd.	STOCK1S-21182			Fc1ccc(cc1)C(=O)N1C(=S)NC(=O)\C1=C/c1ccccc1	InChI=1S/C17H11FN2O2S/c18-13-8-6-12(7-9-13)16(22)20-14(15(21)19-17(20)23)10-11-4-2-1-3-5-11/h1-10H,(H,19,21,23)/b14-10+	PSIHFKPXRKBLPT-GXDHUFHOSA-N	326.052526502							
SMR000237372	LSM-20713	SID17514878, BRD-K04871302	5129679	InChI=1S/C24H19F3N2OS/c25-18-8-3-1-6-16(18)15-31-22-14-29(21-11-4-2-7-17(21)22)13-12-28-24(30)23-19(26)9-5-10-20(23)27/h1-11,14H,12-13,15H2,(H,28,30)	XQIPXGBPLYVWAO-UHFFFAOYSA-N	Fc1ccccc1CSc2cn(CCNC(=O)c3c(F)cccc3F)c4ccccc24	BroadT	BRD-K04871302	BRD-K04871302-001-04-2	Life Chemicals Inc.	F0554-0905			Fc1ccccc1CSc1cn(CCNC(=O)c2c(F)cccc2F)c2ccccc12	InChI=1S/C24H19F3N2OS/c25-18-8-3-1-6-16(18)15-31-22-14-29(21-11-4-2-7-17(21)22)13-12-28-24(30)23-19(26)9-5-10-20(23)27/h1-11,14H,12-13,15H2,(H,28,30)	XQIPXGBPLYVWAO-UHFFFAOYSA-N	440.117018538							109315
2-[2-(3,4-Dihydro-2H-quinolin-1-yl)-1-methyl-2-oxo-ethyl]-isoindole-1,3-dione	LSM-20714	SID14725598, BRD-A69581309	2927339	InChI=1S/C20H18N2O3/c1-13(22-19(24)15-9-3-4-10-16(15)20(22)25)18(23)21-12-6-8-14-7-2-5-11-17(14)21/h2-5,7,9-11,13H,6,8,12H2,1H3	NKNFPVOPLUIORL-UHFFFAOYSA-N	CC(N1C(=O)c2ccccc2C1=O)C(=O)N3CCCc4ccccc34	BroadT	BRD-A69581309	BRD-A69581309-001-05-1	Asinex Ltd.	BAS 04914200			CC(N1C(=O)c2ccccc2C1=O)C(=O)N1CCCc2ccccc12	InChI=1S/C20H18N2O3/c1-13(22-19(24)15-9-3-4-10-16(15)20(22)25)18(23)21-12-6-8-14-7-2-5-11-17(14)21/h2-5,7,9-11,13H,6,8,12H2,1H3	NKNFPVOPLUIORL-UHFFFAOYSA-N	334.131742456							109316
MLS000889273	LSM-20715	SID26667946, SID848448, BRD-K68756555	650889	InChI=1S/C20H23N3O5S/c1-5-6-9-23(19(24)14-8-7-10-28-14)20-22-21-18(29-20)13-11-15(25-2)17(27-4)16(12-13)26-3/h7-8,10-12H,5-6,9H2,1-4H3	OFVLNBHHTWJVHV-UHFFFAOYSA-N	CCCCN(C(=O)c1occc1)c2nnc(s2)c3cc(OC)c(OC)c(OC)c3	BroadT	BRD-K68756555	BRD-K68756555-001-05-9	Asinex Ltd.	ASN 06108530			CCCCN(C(=O)c1ccco1)c1nnc(s1)-c1cc(OC)c(OC)c(OC)c1	InChI=1S/C20H23N3O5S/c1-5-6-9-23(19(24)14-8-7-10-28-14)20-22-21-18(29-20)13-11-15(25-2)17(27-4)16(12-13)26-3/h7-8,10-12H,5-6,9H2,1-4H3	OFVLNBHHTWJVHV-UHFFFAOYSA-N	417.135841556							109317
SMR000006424	LSM-20716	SID847192, BRD-K94166726	649590	InChI=1S/C21H19N5O3S/c1-28-15-6-4-14(5-7-15)17-18-19(30-24-17)20(23-13-22-18)25-8-10-26(11-9-25)21(27)16-3-2-12-29-16/h2-7,12-13H,8-11H2,1H3	AGQAENFTCGWHKW-UHFFFAOYSA-N	COc1ccc(cc1)c2nsc3c(ncnc23)N4CCN(CC4)C(=O)c5occc5	BroadT	BRD-K94166726	BRD-K94166726-001-05-3	Asinex Ltd.	ASN 06353470			COc1ccc(cc1)-c1nsc2c(ncnc12)N1CCN(CC1)C(=O)c1ccco1	InChI=1S/C21H19N5O3S/c1-28-15-6-4-14(5-7-15)17-18-19(30-24-17)20(23-13-22-18)25-8-10-26(11-9-25)21(27)16-3-2-12-29-16/h2-7,12-13H,8-11H2,1H3	AGQAENFTCGWHKW-UHFFFAOYSA-N	421.120860208							109318
4-(6-Amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-methoxyphenyl benzoate	LSM-20717	SID17401839, BRD-A67704743	3259106	InChI=1S/C22H18N4O4/c1-12-18-19(15(11-23)20(24)30-21(18)26-25-12)14-8-9-16(17(10-14)28-2)29-22(27)13-6-4-3-5-7-13/h3-10,19H,24H2,1-2H3,(H,25,26)	NJYKWBKAGBGGBL-UHFFFAOYSA-N	COc1cc(ccc1OC(=O)c2ccccc2)C3C(=C(N)Oc4[nH]nc(C)c34)C#N	BroadT	BRD-A67704743	BRD-A67704743-001-06-3	InterBioScreen Ltd.	STOCK2S-22447			COc1cc(ccc1OC(=O)c1ccccc1)C1c2c(C)n[nH]c2OC(N)=C1C#N	InChI=1S/C22H18N4O4/c1-12-18-19(15(11-23)20(24)30-21(18)26-25-12)14-8-9-16(17(10-14)28-2)29-22(27)13-6-4-3-5-7-13/h3-10,19H,24H2,1-2H3,(H,25,26)	NJYKWBKAGBGGBL-UHFFFAOYSA-N	402.132805096							109319
[1-(4-Ethoxy-phenyl)-2,5-dioxo-pyrrolidin-3-ylamino]-acetonitrile	LSM-20718	SID47200786, BRD-A60179873	2866408	InChI=1S/C14H15N3O3/c1-2-20-11-5-3-10(4-6-11)17-13(18)9-12(14(17)19)16-8-7-15/h3-6,12,16H,2,8-9H2,1H3	LNKOACNOJFAKRD-UHFFFAOYSA-N	CCOc1ccc(cc1)N2C(=O)CC(NCC#N)C2=O	BroadT	BRD-A60179873	BRD-A60179873-001-05-9	Asinex Ltd.	BAS 00866933			CCOc1ccc(cc1)N1C(=O)CC(NCC#N)C1=O	InChI=1S/C14H15N3O3/c1-2-20-11-5-3-10(4-6-11)17-13(18)9-12(14(17)19)16-8-7-15/h3-6,12,16H,2,8-9H2,1H3	LNKOACNOJFAKRD-UHFFFAOYSA-N	273.11134137							109320
N,N'-Diethyl-6-(n-methyl-hydrazino)-[1,3,5]triazine-2,4-diamine	LSM-20719	SID17407584, BRD-K71052595	827408	InChI=1S/C8H17N7/c1-4-10-6-12-7(11-5-2)14-8(13-6)15(3)9/h4-5,9H2,1-3H3,(H2,10,11,12,13,14)	GHAXSYPBTJDEFE-UHFFFAOYSA-N	CCNc1nc(NCC)nc(n1)N(C)N	BroadT	BRD-K71052595	BRD-K71052595-001-06-8	Asinex Ltd.	BAS 01321632			CCNc1nc(NCC)nc(n1)N(C)N	InChI=1S/C8H17N7/c1-4-10-6-12-7(11-5-2)14-8(13-6)15(3)9/h4-5,9H2,1-3H3,(H2,10,11,12,13,14)	GHAXSYPBTJDEFE-UHFFFAOYSA-N	211.154543614							109321
AC1LEX8D	LSM-20720	SID47198462, BRD-K59215605	743359	InChI=1S/C16H19NOS/c1-18-16-7-6-13-4-2-3-5-14(13)15(16)12-17-8-10-19-11-9-17/h2-7H,8-12H2,1H3	CTANMUUMVKQBQS-UHFFFAOYSA-N	COc1ccc2ccccc2c1CN3CCSCC3	BroadT	BRD-K59215605	BRD-K59215605-001-05-7	ChemBridge Corporation	5428317			COc1ccc2ccccc2c1CN1CCSCC1	InChI=1S/C16H19NOS/c1-18-16-7-6-13-4-2-3-5-14(13)15(16)12-17-8-10-19-11-9-17/h2-7H,8-12H2,1H3	CTANMUUMVKQBQS-UHFFFAOYSA-N	273.118734928							109322
AC1N4BO7	LSM-20721	SID49715535, BRD-K23828572	4176332	InChI=1S/C19H19BrN4OS/c1-23-8-10-24(11-9-23)22-19(25)14-12-16(17-6-7-18(20)26-17)21-15-5-3-2-4-13(14)15/h2-7,12H,8-11H2,1H3,(H,22,25)	BFFWUVUPLLRZQV-UHFFFAOYSA-N	CN1CCN(CC1)NC(=O)c2cc(nc3ccccc23)c4ccc(Br)s4	BroadT	BRD-K23828572	BRD-K23828572-001-05-9	ChemDiv Inc.	C167-0273			CN1CCN(CC1)NC(=O)c1cc(nc2ccccc12)-c1ccc(Br)s1	InChI=1S/C19H19BrN4OS/c1-23-8-10-24(11-9-23)22-19(25)14-12-16(17-6-7-18(20)26-17)21-15-5-3-2-4-13(14)15/h2-7,12H,8-11H2,1H3,(H,22,25)	BFFWUVUPLLRZQV-UHFFFAOYSA-N	430.046294558							109323
SMR000105318	LSM-20722	BRD-K37211799	549453	InChI=1S/C14H15F2NO/c1-14(2)7-10(6-11(18)8-14)17-13-4-3-9(15)5-12(13)16/h3-6,17H,7-8H2,1-2H3	XHITZSIFDPYHCU-UHFFFAOYSA-N	CC1(C)CC(=O)C=C(C1)Nc1ccc(F)cc1F	BroadT	BRD-K37211799	BRD-K37211799-001-06-7	ChemBridge Corporation	5845668			CC1(C)CC(=O)C=C(C1)Nc1ccc(F)cc1F	InChI=1S/C14H15F2NO/c1-14(2)7-10(6-11(18)8-14)17-13-4-3-9(15)5-12(13)16/h3-6,17H,7-8H2,1-2H3	XHITZSIFDPYHCU-UHFFFAOYSA-N	251.11217051							109324
SMR000093583	LSM-20723	SID7965677, BRD-K66031775	5307761	InChI=1S/C16H19N5O3/c1-9-6-14(21-16(17-9)18-10(2)20-21)19-11-7-12(22-3)15(24-5)13(8-11)23-4/h6-8,19H,1-5H3	KEOQSRHBFGLCBV-UHFFFAOYSA-N	COc1cc(Nc2cc(C)nc3nc(C)nn23)cc(OC)c1OC	BroadT	BRD-K66031775	BRD-K66031775-001-04-6	ChemDiv Inc.	C301-0793			COc1cc(Nc2cc(C)nc3nc(C)nn23)cc(OC)c1OC	InChI=1S/C16H19N5O3/c1-9-6-14(21-16(17-9)18-10(2)20-21)19-11-7-12(22-3)15(24-5)13(8-11)23-4/h6-8,19H,1-5H3	KEOQSRHBFGLCBV-UHFFFAOYSA-N	329.148789518							109325
N'-(4-nitrophenyl)-9-oxobicyclo[3.3.1]nonane-3-carbohydrazide	LSM-20724	SID17413730, BRD-A16654364	4982384	InChI=1S/C16H19N3O4/c20-15-10-2-1-3-11(15)9-12(8-10)16(21)18-17-13-4-6-14(7-5-13)19(22)23/h4-7,10-12,17H,1-3,8-9H2,(H,18,21)	QQICBDDTOCDQPL-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NNC(=O)C2CC3CCCC(C2)C3=O)cc1	BroadT	BRD-A16654364	BRD-A16654364-001-05-2	ChemBridge Corporation	7936029			[O-][N+](=O)c1ccc(NNC(=O)C2CC3CCCC(C2)C3=O)cc1	InChI=1S/C16H19N3O4/c20-15-10-2-1-3-11(15)9-12(8-10)16(21)18-17-13-4-6-14(7-5-13)19(22)23/h4-7,10-12,17H,1-3,8-9H2,(H,18,21)	QQICBDDTOCDQPL-UHFFFAOYSA-N	317.137556118							109326
MLS000756408	LSM-20725	SID26664848, BRD-K37759571	301926	InChI=1S/C16H18O4/c1-9-7-13-14(8-10(9)2)16(20-12(4)18)6-5-15(13)19-11(3)17/h5-6H,7-8H2,1-4H3	SEGUKPAFTPETCX-UHFFFAOYSA-N	CC(=O)Oc1ccc(OC(=O)C)c2CC(=C(C)Cc12)C	BroadT	BRD-K37759571	BRD-K37759571-001-05-1	National Cancer Institute Chemotherapeutic Agents Repository	180964			CC(=O)Oc1ccc(OC(C)=O)c2CC(C)=C(C)Cc12	InChI=1S/C16H18O4/c1-9-7-13-14(8-10(9)2)16(20-12(4)18)6-5-15(13)19-11(3)17/h5-6H,7-8H2,1-4H3	SEGUKPAFTPETCX-UHFFFAOYSA-N	274.120509056							109327
AC1LIOQC	LSM-20726	SID14733656, BRD-K18119614	935214	InChI=1S/C15H17N3O2S/c1-20-12-6-4-11(5-7-12)15(8-2-3-9-15)13(19)17-14-18-16-10-21-14/h4-7,10H,2-3,8-9H2,1H3,(H,17,18,19)	WKXOWZIRSJGNSU-UHFFFAOYSA-N	COc1ccc(cc1)C2(CCCC2)C(=O)Nc3nncs3	BroadT	BRD-K18119614	BRD-K18119614-001-05-0	ChemBridge Corporation	7936159			COc1ccc(cc1)C1(CCCC1)C(=O)Nc1nncs1	InChI=1S/C15H17N3O2S/c1-20-12-6-4-11(5-7-12)15(8-2-3-9-15)13(19)17-14-18-16-10-21-14/h4-7,10H,2-3,8-9H2,1H3,(H,17,18,19)	WKXOWZIRSJGNSU-UHFFFAOYSA-N	303.104147504							109328
ST50728958	LSM-20727	SID24809722, BRD-K10201294	786021	InChI=1S/C11H8ClN3O3S/c1-6-5-19-11(13-6)14-10(16)8-3-2-7(12)4-9(8)15(17)18/h2-5H,1H3,(H,13,14,16)	ARGXKQUFWANHMW-UHFFFAOYSA-N	Cc1csc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])n1	BroadT	BRD-K10201294	BRD-K10201294-001-05-1	Asinex Ltd.	BAS 00804317			Cc1csc(NC(=O)c2ccc(Cl)cc2[N+]([O-])=O)n1	InChI=1S/C11H8ClN3O3S/c1-6-5-19-11(13-6)14-10(16)8-3-2-7(12)4-9(8)15(17)18/h2-5H,1H3,(H,13,14,16)	ARGXKQUFWANHMW-UHFFFAOYSA-N	296.997489546							109329
MLS000697350	LSM-20728	SID17514481, BRD-A10300508	12005853	InChI=1S/C21H18FN3O2S/c22-17-8-4-7-16(13-17)21-14-20(15-5-2-1-3-6-15)24-25(21)18-9-11-19(12-10-18)28(23,26)27/h1-13,21H,14H2,(H2,23,26,27)	AOUHEBALMWXJRC-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(cc1)N2N=C(CC2c3cccc(F)c3)c4ccccc4	BroadT	BRD-A10300508	BRD-A10300508-001-05-5	Life Chemicals Inc.	F1622-0031			NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc(F)c1)c1ccccc1	InChI=1S/C21H18FN3O2S/c22-17-8-4-7-16(13-17)21-14-20(15-5-2-1-3-6-15)24-25(21)18-9-11-19(12-10-18)28(23,26)27/h1-13,21H,14H2,(H2,23,26,27)	AOUHEBALMWXJRC-UHFFFAOYSA-N	395.110375736							109330
SMR000061655	LSM-20729	SID3711213, BRD-K36372945	2366220	InChI=1S/C20H20ClN3O3S2/c21-17-9-7-15(8-10-17)14-28-20-23-22-19(27-20)16-5-4-6-18(13-16)29(25,26)24-11-2-1-3-12-24/h4-10,13H,1-3,11-12,14H2	MIOXIBMYFKDWGM-UHFFFAOYSA-N	Clc1ccc(CSc2oc(nn2)c3cccc(c3)S(=O)(=O)N4CCCCC4)cc1	BroadT	BRD-K36372945	BRD-K36372945-001-05-3	Enamine Ltd.	T0509-8341			Clc1ccc(CSc2nnc(o2)-c2cccc(c2)S(=O)(=O)N2CCCCC2)cc1	InChI=1S/C20H20ClN3O3S2/c21-17-9-7-15(8-10-17)14-28-20-23-22-19(27-20)16-5-4-6-18(13-16)29(25,26)24-11-2-1-3-12-24/h4-10,13H,1-3,11-12,14H2	MIOXIBMYFKDWGM-UHFFFAOYSA-N	449.06346062							109331
MLS001116943	LSM-20730	SID49735764, BRD-K09180808	22548337	InChI=1S/C17H18N2O6S/c1-10-4-14-15(25-9-17(20)18-14)8-16(10)26(21,22)19-11-5-12(23-2)7-13(6-11)24-3/h4-8,19H,9H2,1-3H3,(H,18,20)	MMZYVKZJQYUWDP-UHFFFAOYSA-N	COc1cc(NS(=O)(=O)c2cc3OCC(=O)Nc3cc2C)cc(OC)c1	BroadT	BRD-K09180808	BRD-K09180808-001-05-9	ChemDiv Inc.	E245-0321			COc1cc(NS(=O)(=O)c2cc3OCC(=O)Nc3cc2C)cc(OC)c1	InChI=1S/C17H18N2O6S/c1-10-4-14-15(25-9-17(20)18-14)8-16(10)26(21,22)19-11-5-12(23-2)7-13(6-11)24-3/h4-8,19H,9H2,1-3H3,(H,18,20)	MMZYVKZJQYUWDP-UHFFFAOYSA-N	378.088557006							109332
STK020432	LSM-20731	SID4264897, BRD-K00119882	898263	InChI=1S/C16H16N2O3/c1-12(19)17-14-8-5-9-15(10-14)21-11-16(20)18-13-6-3-2-4-7-13/h2-10H,11H2,1H3,(H,17,19)(H,18,20)	WGZZKVRMBFIFGD-UHFFFAOYSA-N	CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1	BroadT	BRD-K00119882	BRD-K00119882-001-05-5	ChemBridge Corporation	7271310			CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1	InChI=1S/C16H16N2O3/c1-12(19)17-14-8-5-9-15(10-14)21-11-16(20)18-13-6-3-2-4-7-13/h2-10H,11H2,1H3,(H,17,19)(H,18,20)	WGZZKVRMBFIFGD-UHFFFAOYSA-N	284.116092392							109333
F0695-0247	LSM-20732	SID17515779, BRD-K96213070	12006140	InChI=1S/C23H21N3O2S2/c1-15-8-9-18(22-25-20-7-4-12-24-23(20)29-22)14-21(15)26-30(27,28)19-11-10-16-5-2-3-6-17(16)13-19/h4,7-14,26H,2-3,5-6H2,1H3	LMZQJGGRXMHMEB-UHFFFAOYSA-N	Cc1ccc(cc1NS(=O)(=O)c2ccc3CCCCc3c2)c4nc5cccnc5s4	BroadT	BRD-K96213070	BRD-K96213070-001-04-6	Life Chemicals Inc.	F0695-0247			Cc1ccc(cc1NS(=O)(=O)c1ccc2CCCCc2c1)-c1nc2cccnc2s1	InChI=1S/C23H21N3O2S2/c1-15-8-9-18(22-25-20-7-4-12-24-23(20)29-22)14-21(15)26-30(27,28)19-11-10-16-5-2-3-6-17(16)13-19/h4,7-14,26H,2-3,5-6H2,1H3	LMZQJGGRXMHMEB-UHFFFAOYSA-N	435.107518322							109334
CHEMBL1088173	LSM-20733	SID7972727, BRD-K17419962	871987	InChI=1S/C16H16N2O3/c1-11(19)17-12-6-5-7-13(10-12)18-16(20)14-8-3-4-9-15(14)21-2/h3-10H,1-2H3,(H,17,19)(H,18,20)	GECAYOSQSVQYCM-UHFFFAOYSA-N	COc1ccccc1C(=O)Nc2cccc(NC(=O)C)c2	BroadT	BRD-K17419962	BRD-K17419962-001-05-3	ChemBridge Corporation	5560103			COc1ccccc1C(=O)Nc1cccc(NC(C)=O)c1	InChI=1S/C16H16N2O3/c1-11(19)17-12-6-5-7-13(10-12)18-16(20)14-8-3-4-9-15(14)21-2/h3-10H,1-2H3,(H,17,19)(H,18,20)	GECAYOSQSVQYCM-UHFFFAOYSA-N	284.116092392							109335
4-Amino-n-(1-phenylethyl)benzamide	LSM-20734	SID24793360, BRD-A07214010	126157	InChI=1S/C15H16N2O/c1-11(12-5-3-2-4-6-12)17-15(18)13-7-9-14(16)10-8-13/h2-11H,16H2,1H3,(H,17,18)	LRMURALCBANCSV-UHFFFAOYSA-N	CC(NC(=O)c1ccc(N)cc1)c2ccccc2	BroadT	BRD-A07214010	BRD-A07214010-001-05-4	ChemBridge Corporation	7965646			CC(NC(=O)c1ccc(N)cc1)c1ccccc1	InChI=1S/C15H16N2O/c1-11(12-5-3-2-4-6-12)17-15(18)13-7-9-14(16)10-8-13/h2-11H,16H2,1H3,(H,17,18)	LRMURALCBANCSV-UHFFFAOYSA-N	240.126263152							109336
F0582-0241	LSM-20735	SID17514853, BRD-K92656944	2156504	InChI=1S/C26H20N2O3S/c29-25(20-16-18-10-4-7-13-22(18)31-26(20)30)27-14-15-32-24-19-11-5-6-12-21(19)28-23(24)17-8-2-1-3-9-17/h1-13,16,28H,14-15H2,(H,27,29)	FKIZCSAKSFIFST-UHFFFAOYSA-N	O=C(NCCSc1c([nH]c2ccccc12)c3ccccc3)C4=Cc5ccccc5OC4=O	BroadT	BRD-K92656944	BRD-K92656944-001-04-4	Life Chemicals Inc.	F0582-0241			O=C(NCCSc1c([nH]c2ccccc12)-c1ccccc1)c1cc2ccccc2oc1=O	InChI=1S/C26H20N2O3S/c29-25(20-16-18-10-4-7-13-22(18)31-26(20)30)27-14-15-32-24-19-11-5-6-12-21(19)28-23(24)17-8-2-1-3-9-17/h1-13,16,28H,14-15H2,(H,27,29)	FKIZCSAKSFIFST-UHFFFAOYSA-N	440.11946321							109337
MLS000037800	LSM-4547	ST-4028268, SID856815	658169	InChI=1S/C10H12N2S/c1-4-8-6(2)9(5-11)10(13)12-7(8)3/h4H2,1-3H3,(H,12,13)	IMLGWNWCXQYTLB-UHFFFAOYSA-N	CCc1c(C)nc(S)c(C#N)c1C	BroadT	BRD-K14444135	BRD-K14444135-001-04-9	InterBioScreen Ltd.	STOCK1S-29444			CCc1c(C)[nH]c(=S)c(C#N)c1C	InChI=1S/C10H12N2S/c1-4-8-6(2)9(5-11)10(13)12-7(8)3/h4H2,1-3H3,(H,12,13)	IMLGWNWCXQYTLB-UHFFFAOYSA-N	192.072119094							93964
1,2,3-Benzotriazin-4(3H)-one, 3-(4-bromophenyl)-	LSM-20736	SID26729715, BRD-K35969228	593390	InChI=1S/C13H8BrN3O/c14-9-5-7-10(8-6-9)17-13(18)11-3-1-2-4-12(11)15-16-17/h1-8H	CXBNGMLYZXDWOG-UHFFFAOYSA-N	Brc1ccc(cc1)N2N=Nc3ccccc3C2=O	BroadT	BRD-K35969228	BRD-K35969228-001-06-3	Maybridge	RB 00242			Brc1ccc(cc1)-n1nnc2ccccc2c1=O	InChI=1S/C13H8BrN3O/c14-9-5-7-10(8-6-9)17-13(18)11-3-1-2-4-12(11)15-16-17/h1-8H	CXBNGMLYZXDWOG-UHFFFAOYSA-N	300.985074506							109338
BAS 01549908	LSM-20737	SID24786998, BRD-K33500127	881482	InChI=1S/C15H11ClN2O2S/c16-13-8-9-14(12-6-2-1-5-11(12)13)21(19,20)18-15-7-3-4-10-17-15/h1-10H,(H,17,18)	QOZADSWVTBGRKS-UHFFFAOYSA-N	Clc1ccc(c2ccccc12)S(=O)(=O)Nc3ccccn3	BroadT	BRD-K33500127	BRD-K33500127-001-05-2	Asinex Ltd.	BAS 01549908			Clc1ccc(c2ccccc12)S(=O)(=O)Nc1ccccn1	InChI=1S/C15H11ClN2O2S/c16-13-8-9-14(12-6-2-1-5-11(12)13)21(19,20)18-15-7-3-4-10-17-15/h1-10H,(H,17,18)	QOZADSWVTBGRKS-UHFFFAOYSA-N	318.022976012							109339
MLS000949974	LSM-20738	SID49724803, BRD-K36431928	24792237	InChI=1S/C23H26N4O/c1-5-6-11-27-20-13-18-17(26-23(28)21(24-18)14(2)3)12-19(20)25-22(27)16-10-8-7-9-15(16)4/h7-10,12-14H,5-6,11H2,1-4H3,(H,26,28)	YOMURRVRWJODEU-UHFFFAOYSA-N	CCCCn1c(nc2cc3nc(O)c(nc3cc12)C(C)C)c4ccccc4C	BroadT	BRD-K36431928	BRD-K36431928-001-05-8	University of California at Davis	R-R13-R215-R362			CCCCn1c(nc2cc3nc(O)c(nc3cc12)C(C)C)-c1ccccc1C	InChI=1S/C23H26N4O/c1-5-6-11-27-20-13-18-17(26-23(28)21(24-18)14(2)3)12-19(20)25-22(27)16-10-8-7-9-15(16)4/h7-10,12-14H,5-6,11H2,1-4H3,(H,26,28)	YOMURRVRWJODEU-UHFFFAOYSA-N	374.210661492							109340
7E-514	LSM-20739	SID17411195, BRD-K45171380	1483022	InChI=1S/C18H14Cl2N2O3S/c19-16-8-6-13(10-17(16)20)11-22-12-14(7-9-18(22)23)21-26(24,25)15-4-2-1-3-5-15/h1-10,12,21H,11H2	RIZHEPFCVROKLB-UHFFFAOYSA-N	Clc1ccc(CN2C=C(NS(=O)(=O)c3ccccc3)C=CC2=O)cc1Cl	BroadT	BRD-K45171380	BRD-K45171380-001-05-0	Key Organics Ltd.	7E-514			Clc1ccc(Cn2cc(NS(=O)(=O)c3ccccc3)ccc2=O)cc1Cl	InChI=1S/C18H14Cl2N2O3S/c19-16-8-6-13(10-17(16)20)11-22-12-14(7-9-18(22)23)21-26(24,25)15-4-2-1-3-5-15/h1-10,12,21H,11H2	RIZHEPFCVROKLB-UHFFFAOYSA-N	408.010218438							109341
MLS000102772	LSM-20740	SID7971518, BRD-K44607884	5310488	InChI=1S/C10H15N3O2S2/c1-3-4-17(14,15)11-5-9-6-13-8(2)7-16-10(13)12-9/h6-7,11H,3-5H2,1-2H3	KKSHWAITTSRIHM-UHFFFAOYSA-N	CCCS(=O)(=O)NCc1cn2c(C)csc2n1	BroadT	BRD-K44607884	BRD-K44607884-001-06-3	Life Chemicals Inc.	F0690-0085			CCCS(=O)(=O)NCc1cn2c(C)csc2n1	InChI=1S/C10H15N3O2S2/c1-3-4-17(14,15)11-5-9-6-13-8(2)7-16-10(13)12-9/h6-7,11H,3-5H2,1-2H3	KKSHWAITTSRIHM-UHFFFAOYSA-N	273.06056813							109342
3-Benzyl-5,7-dihydroxy-4-methyl-2H-chromen-2-one	LSM-20741	SID24786556, BRD-K08900543	5428531	InChI=1S/C17H14O4/c1-10-13(7-11-5-3-2-4-6-11)17(20)21-15-9-12(18)8-14(19)16(10)15/h2-6,8-9,18-19H,7H2,1H3	UKYMHVBZOSPIOA-UHFFFAOYSA-N	CC1=C(Cc2ccccc2)C(=O)Oc3cc(O)cc(O)c13	BroadT	BRD-K08900543	BRD-K08900543-001-07-7	ChemBridge Corporation	7910920			Cc1c(Cc2ccccc2)c(=O)oc2cc(O)cc(O)c12	InChI=1S/C17H14O4/c1-10-13(7-11-5-3-2-4-6-11)17(20)21-15-9-12(18)8-14(19)16(10)15/h2-6,8-9,18-19H,7H2,1H3	UKYMHVBZOSPIOA-UHFFFAOYSA-N	282.089208928							109343
ZINC00350745	LSM-20742	SID7977953, BRD-K28393999	2894525	InChI=1S/C19H16N4OS/c1-2-23-15-11-7-6-10-14(15)17-18(23)20-19(22-21-17)25-12-16(24)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3	UTCSFZAWSRTXFH-UHFFFAOYSA-N	CCn1c2ccccc2c3nnc(SCC(=O)c4ccccc4)nc13	BroadT	BRD-K28393999	BRD-K28393999-001-05-4	ChemBridge Corporation	6364946			CCn1c2ccccc2c2nnc(SCC(=O)c3ccccc3)nc12	InChI=1S/C19H16N4OS/c1-2-23-15-11-7-6-10-14(15)17-18(23)20-19(22-21-17)25-12-16(24)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3	UTCSFZAWSRTXFH-UHFFFAOYSA-N	348.104481862							109344
AC1MFKUU	LSM-20743	SID24792915, BRD-A11246516	2920810	InChI=1S/C15H14ClN3O2/c16-11-5-3-10(4-6-11)14-19-13(8-17)15(21-14)18-9-12-2-1-7-20-12/h3-6,12,18H,1-2,7,9H2	CTAHOIKHXVKLQS-UHFFFAOYSA-N	Clc1ccc(cc1)c2oc(NCC3CCCO3)c(n2)C#N	BroadT	BRD-A11246516	BRD-A11246516-001-05-9	ChemBridge Corporation	6961898			Clc1ccc(cc1)-c1nc(C#N)c(NCC2CCCO2)o1	InChI=1S/C15H14ClN3O2/c16-11-5-3-10(4-6-11)14-19-13(8-17)15(21-14)18-9-12-2-1-7-20-12/h3-6,12,18H,1-2,7,9H2	CTAHOIKHXVKLQS-UHFFFAOYSA-N	303.077454428							109345
MLS000118801	LSM-20744	SID7967034, BRD-A02907341	5308583	InChI=1S/C21H22N4O3/c26-20(23-13-16-6-4-10-28-16)14-25-21(27)18-8-2-1-7-17(18)19(24-25)11-15-5-3-9-22-12-15/h1-3,5,7-9,12,16H,4,6,10-11,13-14H2,(H,23,26)	ULGYIQDOQSDSMQ-UHFFFAOYSA-N	O=C(CN1N=C(Cc2cccnc2)c3ccccc3C1=O)NCC4CCCO4	BroadT	BRD-A02907341	BRD-A02907341-001-04-1	ChemDiv Inc.	C696-1041			O=C(Cn1nc(Cc2cccnc2)c2ccccc2c1=O)NCC1CCCO1	InChI=1S/C21H22N4O3/c26-20(23-13-16-6-4-10-28-16)14-25-21(27)18-8-2-1-7-17(18)19(24-25)11-15-5-3-9-22-12-15/h1-3,5,7-9,12,16H,4,6,10-11,13-14H2,(H,23,26)	ULGYIQDOQSDSMQ-UHFFFAOYSA-N	378.169190604							109346
GNF-PF-4046	LSM-20745	GNF-PF-4046, BRD-K91355301	819097	InChI=1S/C13H16N2O2/c1-10-6-8-11(9-7-10)14-13(16)17-15-12-4-2-3-5-12/h6-9H,2-5H2,1H3,(H,14,16)	HVOYKTIJNJWOGS-UHFFFAOYSA-N	Cc1ccc(NC(=O)ON=C2CCCC2)cc1	BroadT	BRD-K91355301	BRD-K91355301-001-07-4	Asinex Ltd.	BAS 00346624			Cc1ccc(NC(=O)ON=C2CCCC2)cc1	InChI=1S/C13H16N2O2/c1-10-6-8-11(9-7-10)14-13(16)17-15-12-4-2-3-5-12/h6-9H,2-5H2,1H3,(H,14,16)	HVOYKTIJNJWOGS-UHFFFAOYSA-N	232.121177772							109347
ZINC01148742	LSM-20746	SID4263304, BRD-K51004159	1319649	InChI=1S/C13H16BrFN2O3S/c1-21(19,20)17-6-4-9(5-7-17)13(18)16-12-3-2-10(14)8-11(12)15/h2-3,8-9H,4-7H2,1H3,(H,16,18)	XOJFXDQXLFPMRW-UHFFFAOYSA-N	CS(=O)(=O)N1CCC(CC1)C(=O)Nc2ccc(Br)cc2F	BroadT	BRD-K51004159	BRD-K51004159-001-05-3	ChemBridge Corporation	7624171			CS(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(Br)cc1F	InChI=1S/C13H16BrFN2O3S/c1-21(19,20)17-6-4-9(5-7-17)13(18)16-12-3-2-10(14)8-11(12)15/h2-3,8-9H,4-7H2,1H3,(H,16,18)	XOJFXDQXLFPMRW-UHFFFAOYSA-N	378.004903882							109348
MLS000737834	LSM-43893	BRD-K84058877	5354758	InChI=1S/C11H13NO2/c1-8(7-9(2)13)12-10-5-3-4-6-11(10)14/h3-7,12,14H,1-2H3/b8-7+	DQRCPPWVTPMGHV-BQYQJAHWSA-N	C\C(=C/C(=O)C)\Nc1ccccc1O	BroadT	BRD-K84058877	BRD-K84058877-001-05-1	National Cancer Institute Chemotherapeutic Agents Repository	18415			CC(=O)\C=C(/C)Nc1ccccc1O	InChI=1S/C11H13NO2/c1-8(7-9(2)13)12-10-5-3-4-6-11(10)14/h3-7,12,14H,1-2H3/b8-7+	DQRCPPWVTPMGHV-BQYQJAHWSA-N	191.094628666							
AC1LS5TG	LSM-20748	BRD-K50553926	1482817	InChI=1S/C17H14ClNO2/c18-14-8-3-7-13(11-14)17(20)21-19-16-10-4-6-12-5-1-2-9-15(12)16/h1-3,5,7-9,11H,4,6,10H2	LAMHKUBSEMGAIF-UHFFFAOYSA-N	Clc1cccc(c1)C(=O)ON=C2CCCc3ccccc23	BroadT	BRD-K50553926	BRD-K50553926-001-05-2	Key Organics Ltd.	10R-1132			Clc1cccc(c1)C(=O)ON=C1CCCc2ccccc12	InChI=1S/C17H14ClNO2/c18-14-8-3-7-13(11-14)17(20)21-19-16-10-4-6-12-5-1-2-9-15(12)16/h1-3,5,7-9,11H,4,6,10H2	LAMHKUBSEMGAIF-UHFFFAOYSA-N	299.071306408							109350
2-Benzoylhydrazinecarbothioamide	LSM-20749	SID17411603, BRD-K51240517	781748	InChI=1S/C8H9N3OS/c9-8(13)11-10-7(12)6-4-2-1-3-5-6/h1-5H,(H,10,12)(H3,9,11,13)	OWKWAVBMKKZMHE-UHFFFAOYSA-N	NC(=NNC(=O)c1ccccc1)S	BroadT	BRD-K51240517	BRD-K51240517-001-05-0	ChemBridge Corporation	5404648			NC(S)=NNC(=O)c1ccccc1	InChI=1S/C8H9N3OS/c9-8(13)11-10-7(12)6-4-2-1-3-5-6/h1-5H,(H,10,12)(H3,9,11,13)	OWKWAVBMKKZMHE-UHFFFAOYSA-N	195.046632628							109351
F2019-0116	LSM-20750	SID49723845, BRD-K52587256	7208587	InChI=1S/C21H22N4OS2/c1-14-5-7-17-19(11-14)28-21(23-17)25(10-4-9-24(2)3)20(26)15-6-8-16-18(12-15)27-13-22-16/h5-8,11-13H,4,9-10H2,1-3H3	SMRJRHVRJGOCKF-UHFFFAOYSA-N	CN(C)CCCN(C(=O)c1ccc2ncsc2c1)c3nc4ccc(C)cc4s3	BroadT	BRD-K52587256	BRD-K52587256-001-05-8	ChemDiv Inc.	E677-0116			CN(C)CCCN(C(=O)c1ccc2ncsc2c1)c1nc2ccc(C)cc2s1	InChI=1S/C21H22N4OS2/c1-14-5-7-17-19(11-14)28-21(23-17)25(10-4-9-24(2)3)20(26)15-6-8-16-18(12-15)27-13-22-16/h5-8,11-13H,4,9-10H2,1-3H3	SMRJRHVRJGOCKF-UHFFFAOYSA-N	410.123502744							109352
SMR000126779	LSM-20751	SID14732730, BRD-K61110090	4068910	InChI=1S/C19H11Cl3N4O2S/c1-9-15(16(26-28-9)11-4-2-3-5-13(11)21)17(27)23-19-25-24-18(29-19)12-7-6-10(20)8-14(12)22/h2-8H,1H3,(H,23,25,27)	JJOQQBQTIHXEGO-UHFFFAOYSA-N	Cc1onc(c2ccccc2Cl)c1C(=O)Nc3nnc(s3)c4ccc(Cl)cc4Cl	BroadT	BRD-K61110090	BRD-K61110090-001-05-8	Life Chemicals Inc.	F0453-0227			Cc1onc(c1C(=O)Nc1nnc(s1)-c1ccc(Cl)cc1Cl)-c1ccccc1Cl	InChI=1S/C19H11Cl3N4O2S/c1-9-15(16(26-28-9)11-4-2-3-5-13(11)21)17(27)23-19-25-24-18(29-19)12-7-6-10(20)8-14(12)22/h2-8H,1H3,(H,23,25,27)	JJOQQBQTIHXEGO-UHFFFAOYSA-N	463.966829452							109353
T0516-4798	LSM-20752	SID24828099, BRD-K52812752	2364346	InChI=1S/C15H21BrClNO/c1-12-5-8-18(9-6-12)7-2-10-19-15-4-3-13(17)11-14(15)16/h3-4,11-12H,2,5-10H2,1H3	JEPORSKVSUFAPU-UHFFFAOYSA-N	CC1CCN(CCCOc2ccc(Cl)cc2Br)CC1	BroadT	BRD-K52812752	BRD-K52812752-001-05-9	Enamine Ltd.	T0516-4798			CC1CCN(CCCOc2ccc(Cl)cc2Br)CC1	InChI=1S/C15H21BrClNO/c1-12-5-8-18(9-6-12)7-2-10-19-15-4-3-13(17)11-14(15)16/h3-4,11-12H,2,5-10H2,1H3	JEPORSKVSUFAPU-UHFFFAOYSA-N	345.049504612							109354
SMR000096839	LSM-20753	SID7966721, BRD-K05896385	5308404	InChI=1S/C21H23N5O2/c1-12-10-13(2)23-20-19(12)21-24-14(3)17(15(4)26(21)25-20)7-8-18(27)22-11-16-6-5-9-28-16/h5-6,9-10H,7-8,11H2,1-4H3,(H,22,27)	IXTLASJDWBHVIU-UHFFFAOYSA-N	Cc1cc(C)c2c(n1)nn3c(C)c(CCC(=O)NCc4occc4)c(C)nc23	BroadT	BRD-K05896385	BRD-K05896385-001-04-8	ChemDiv Inc.	C919-0458			Cc1cc(C)c2c(nn3c(C)c(CCC(=O)NCc4ccco4)c(C)nc23)n1	InChI=1S/C21H23N5O2/c1-12-10-13(2)23-20-19(12)21-24-14(3)17(15(4)26(21)25-20)7-8-18(27)22-11-16-6-5-9-28-16/h5-6,9-10H,7-8,11H2,1-4H3,(H,22,27)	IXTLASJDWBHVIU-UHFFFAOYSA-N	377.185175026							109355
SMR000019276	LSM-20754	SID4250315, BRD-K60852040	773295	InChI=1S/C10H11N3OS/c14-9(13-10-11-6-7-15-10)12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,11,12,13,14)	OMBKPYVPESRSDE-UHFFFAOYSA-N	O=C(NC1=NCCS1)Nc2ccccc2	BroadT	BRD-K60852040	BRD-K60852040-001-05-7	ChemDiv Inc.	1969-6019			O=C(NC1=NCCS1)Nc1ccccc1	InChI=1S/C10H11N3OS/c14-9(13-10-11-6-7-15-10)12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,11,12,13,14)	OMBKPYVPESRSDE-UHFFFAOYSA-N	221.062282692							109356
STK144384	LSM-20755	SID17432808, BRD-K87212715	797456	InChI=1S/C19H23N3OS/c1-23-18-9-5-8-17(14-18)20-19(24)22-12-10-21(11-13-22)15-16-6-3-2-4-7-16/h2-9,14H,10-13,15H2,1H3,(H,20,24)	LQCBYQAQSZUBRW-UHFFFAOYSA-N	COc1cccc(NC(=S)N2CCN(Cc3ccccc3)CC2)c1	BroadT	BRD-K87212715	BRD-K87212715-001-05-7	ChemBridge Corporation	6669615			COc1cccc(NC(=S)N2CCN(Cc3ccccc3)CC2)c1	InChI=1S/C19H23N3OS/c1-23-18-9-5-8-17(14-18)20-19(24)22-12-10-21(11-13-22)15-16-6-3-2-4-7-16/h2-9,14H,10-13,15H2,1H3,(H,20,24)	LQCBYQAQSZUBRW-UHFFFAOYSA-N	341.156183076							109357
2-Methyl-1,3-dithian-5-one o-(2,6-dichlorobenzyl)oxime	LSM-20756	SID26728621, BRD-K69274520	2805549	InChI=1S/C12H13Cl2NOS2/c1-8-17-6-9(7-18-8)15-16-5-10-11(13)3-2-4-12(10)14/h2-4,8H,5-7H2,1H3	QSMARTFZAUEIQU-UHFFFAOYSA-N	CC1SCC(=NOCc2c(Cl)cccc2Cl)CS1	BroadT	BRD-K69274520	BRD-K69274520-001-05-4	Maybridge	CD 10044			CC1SCC(CS1)=NOCc1c(Cl)cccc1Cl	InChI=1S/C12H13Cl2NOS2/c1-8-17-6-9(7-18-8)15-16-5-10-11(13)3-2-4-12(10)14/h2-4,8H,5-7H2,1H3	QSMARTFZAUEIQU-UHFFFAOYSA-N	320.981560846							
AC1LD4I0	LSM-20757	SID859801, BRD-K82542855	661103	InChI=1S/C11H10N2O2/c1-13(15)7-9-6-5-8-3-2-4-10(14)11(8)12-9/h2-7,14H,1H3/b13-7+	RSUJKVFIFBVKPR-NTUHNPAUSA-N	C\[N+](=C/c1ccc2cccc(O)c2n1)\[O-]	BroadT	BRD-K82542855	BRD-K82542855-001-05-2	InterBioScreen Ltd.	STOCK3S-34940			C\[N+]([O-])=C/c1ccc2cccc(O)c2n1	InChI=1S/C11H10N2O2/c1-13(15)7-9-6-5-8-3-2-4-10(14)11(8)12-9/h2-7,14H,1H3/b13-7+	RSUJKVFIFBVKPR-NTUHNPAUSA-N	202.07422758							
N-(2-Chloro-6-phenoxybenzyl)benzenesulfonamide	LSM-20758	SID26729216, BRD-K65783007	2811916	InChI=1S/C19H16ClNO3S/c20-18-12-7-13-19(24-15-8-3-1-4-9-15)17(18)14-21-25(22,23)16-10-5-2-6-11-16/h1-13,21H,14H2	LHJRUEQDLZJWMQ-UHFFFAOYSA-N	Clc1cccc(Oc2ccccc2)c1CNS(=O)(=O)c3ccccc3	BroadT	BRD-K65783007	BRD-K65783007-001-05-0	Maybridge	HTS 04646			Clc1cccc(Oc2ccccc2)c1CNS(=O)(=O)c1ccccc1	InChI=1S/C19H16ClNO3S/c20-18-12-7-13-19(24-15-8-3-1-4-9-15)17(18)14-21-25(22,23)16-10-5-2-6-11-16/h1-13,21H,14H2	LHJRUEQDLZJWMQ-UHFFFAOYSA-N	373.053941782							109360
Ethyl 2-amino-4-(4-chlorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate	LSM-20759	SID26664121, BRD-A80522280	5110957	InChI=1S/C18H16ClNO6/c1-2-24-18(23)14-13(9-3-5-10(19)6-4-9)16-15(26-17(14)20)12(22)7-11(8-21)25-16/h3-7,13,21H,2,8,20H2,1H3	PZMAVCPAPLFDKJ-UHFFFAOYSA-N	CCOC(=O)C1=C(N)OC2=C(OC(=CC2=O)CO)C1c3ccc(Cl)cc3	BroadT	BRD-A80522280	BRD-A80522280-001-05-3	InterBioScreen Ltd.	STOCK4S-55527			CCOC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)C1c1ccc(Cl)cc1	InChI=1S/C18H16ClNO6/c1-2-24-18(23)14-13(9-3-5-10(19)6-4-9)16-15(26-17(14)20)12(22)7-11(8-21)25-16/h3-7,13,21H,2,8,20H2,1H3	PZMAVCPAPLFDKJ-UHFFFAOYSA-N	377.066614952							109361
AC1LXRVY	LSM-20760	BRD-K15387690, SID14729715	1806165	InChI=1S/C25H29N3O4/c1-3-5-15-27(16-6-4-2)23(30)20-13-9-10-14-21(20)26-22(29)17-28-24(31)18-11-7-8-12-19(18)25(28)32/h7-14H,3-6,15-17H2,1-2H3,(H,26,29)	GJCCJDRRBVXLGE-UHFFFAOYSA-N	CCCCN(CCCC)C(=O)c1ccccc1NC(=O)CN2C(=O)c3ccccc3C2=O	BroadT	BRD-K15387690	BRD-K15387690-001-05-3	ChemBridge Corporation	5716105			CCCCN(CCCC)C(=O)c1ccccc1NC(=O)CN1C(=O)c2ccccc2C1=O	InChI=1S/C25H29N3O4/c1-3-5-15-27(16-6-4-2)23(30)20-13-9-10-14-21(20)26-22(29)17-28-24(31)18-11-7-8-12-19(18)25(28)32/h7-14H,3-6,15-17H2,1-2H3,(H,26,29)	GJCCJDRRBVXLGE-UHFFFAOYSA-N	435.215806438							109362
2-Ethoxy-n-[4-(4-methyl-pyrimidin-2-ylsulfamoyl)-phenyl]-benzamide	LSM-20761	SID49643898, BRD-K85808903	1150969	InChI=1S/C20H20N4O4S/c1-3-28-18-7-5-4-6-17(18)19(25)23-15-8-10-16(11-9-15)29(26,27)24-20-21-13-12-14(2)22-20/h4-13H,3H2,1-2H3,(H,23,25)(H,21,22,24)	QTXVATMWRBCVEZ-UHFFFAOYSA-N	CCOc1ccccc1C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nccc(C)n3	BroadT	BRD-K85808903	BRD-K85808903-001-05-6	Asinex Ltd.	BAS 02066677			CCOc1ccccc1C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nccc(C)n1	InChI=1S/C20H20N4O4S/c1-3-28-18-7-5-4-6-17(18)19(25)23-15-8-10-16(11-9-15)29(26,27)24-20-21-13-12-14(2)22-20/h4-13H,3H2,1-2H3,(H,23,25)(H,21,22,24)	QTXVATMWRBCVEZ-UHFFFAOYSA-N	412.12052585							109363
MLS000666455	LSM-20762	SID24802935, BRD-K64134051	2208880	InChI=1S/C13H11BrClN3O2S/c14-11-6-5-10(20-11)12(19)17-18-13(21)16-7-8-1-3-9(15)4-2-8/h1-6H,7H2,(H,17,19)(H2,16,18,21)	LVWAWTKAIJTWBK-UHFFFAOYSA-N	Clc1ccc(CNC(=S)NNC(=O)c2oc(Br)cc2)cc1	BroadT	BRD-K64134051	BRD-K64134051-001-05-2	ChemBridge Corporation	7806994			Clc1ccc(CNC(=S)NNC(=O)c2ccc(Br)o2)cc1	InChI=1S/C13H11BrClN3O2S/c14-11-6-5-10(20-11)12(19)17-18-13(21)16-7-8-1-3-9(15)4-2-8/h1-6H,7H2,(H,17,19)(H2,16,18,21)	LVWAWTKAIJTWBK-UHFFFAOYSA-N	386.944387622							109364
ZINC02663800	LSM-20763	SID22407700, BRD-K52269807	2127949	InChI=1S/C20H18N2O4S/c1-14-2-6-16(7-3-14)21-20-22-17(13-27-20)11-26-19(24)12-25-18-8-4-15(10-23)5-9-18/h2-10,13H,11-12H2,1H3,(H,21,22)	XPDAVXLVGXYYMR-UHFFFAOYSA-N	Cc1ccc(Nc2nc(COC(=O)COc3ccc(C=O)cc3)cs2)cc1	BroadT	BRD-K52269807	BRD-K52269807-001-05-7	Enamine Ltd.	T5255417			Cc1ccc(Nc2nc(COC(=O)COc3ccc(C=O)cc3)cs2)cc1	InChI=1S/C20H18N2O4S/c1-14-2-6-16(7-3-14)21-20-22-17(13-27-20)11-26-19(24)12-25-18-8-4-15(10-23)5-9-18/h2-10,13H,11-12H2,1H3,(H,21,22)	XPDAVXLVGXYYMR-UHFFFAOYSA-N	382.098727766							109365
MLS-0390843.0001	LSM-2890	BRD-K40224283, SID57287589, SID85147011	1409759	InChI=1S/C20H19N3O4S/c1-3-9-23-19(14-5-4-6-15(10-14)27-2)21-22-20(23)28-12-18(26)13-7-8-16(24)17(25)11-13/h3-8,10-11,24-25H,1,9,12H2,2H3	SLHDNIDGJASXKC-UHFFFAOYSA-N	COc1cccc(c1)c2nnc(SCC(=O)c3ccc(O)c(O)c3)n2CC=C	BroadT	BRD-K40224283	BRD-K40224283-001-04-3	Sanford-Burnham Medical Research Institute	MLS-0390843.0001			COc1cccc(c1)-c1nnc(SCC(=O)c2ccc(O)c(O)c2)n1CC=C	InChI=1S/C20H19N3O4S/c1-3-9-23-19(14-5-4-6-15(10-14)27-2)21-22-20(23)28-12-18(26)13-7-8-16(24)17(25)11-13/h3-8,10-11,24-25H,1,9,12H2,2H3	SLHDNIDGJASXKC-UHFFFAOYSA-N	397.109626808							92706
Ethyl 2-{4-[(3,4-dichlorobenzoyl)amino]phenyl}-3,3,3-trifluoro-2-hydroxypropanoate	LSM-20764	SID26727394, BRD-A20394483	2729405	InChI=1S/C18H14Cl2F3NO4/c1-2-28-16(26)17(27,18(21,22)23)11-4-6-12(7-5-11)24-15(25)10-3-8-13(19)14(20)9-10/h3-9,27H,2H2,1H3,(H,24,25)	OJNAVZCWIDOPQT-UHFFFAOYSA-N	CCOC(=O)C(O)(c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1)C(F)(F)F	BroadT	BRD-A20394483	BRD-A20394483-001-05-5	Maybridge	RJC 02711			CCOC(=O)C(O)(c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1)C(F)(F)F	InChI=1S/C18H14Cl2F3NO4/c1-2-28-16(26)17(27,18(21,22)23)11-4-6-12(7-5-11)24-15(25)10-3-8-13(19)14(20)9-10/h3-9,27H,2H2,1H3,(H,24,25)	OJNAVZCWIDOPQT-UHFFFAOYSA-N	435.025197958							109366
MLS000767776	LSM-20765	SID26663225, BRD-K03859991	4385641	InChI=1S/C16H16N2OS2/c1-17-6-8-18(9-7-17)16(19)14-10-13-15(21-14)11-4-2-3-5-12(11)20-13/h2-5,10H,6-9H2,1H3	HQGSYTHDYZFBEW-UHFFFAOYSA-N	CN1CCN(CC1)C(=O)c2cc3sc4ccccc4c3s2	BroadT	BRD-K03859991	BRD-K03859991-001-06-9	InterBioScreen Ltd.	STOCK3S-06948			CN1CCN(CC1)C(=O)c1cc2sc3ccccc3c2s1	InChI=1S/C16H16N2OS2/c1-17-6-8-18(9-7-17)16(19)14-10-13-15(21-14)11-4-2-3-5-12(11)20-13/h2-5,10H,6-9H2,1H3	HQGSYTHDYZFBEW-UHFFFAOYSA-N	316.070404532							109367
SMR000025699	LSM-20766	SID4251042, BRD-K29788124	3244778	InChI=1S/C22H25N3O2/c1-4-17-8-6-7-9-19(17)25(5-2)21(26)15-14-20-23-22(24-27-20)18-12-10-16(3)11-13-18/h6-13H,4-5,14-15H2,1-3H3	YZWKOVLMMJEJLP-UHFFFAOYSA-N	CCN(C(=O)CCc1onc(n1)c2ccc(C)cc2)c3ccccc3CC	BroadT	BRD-K29788124	BRD-K29788124-001-05-2	ChemDiv Inc.	C289-0604			CCN(C(=O)CCc1nc(no1)-c1ccc(C)cc1)c1ccccc1CC	InChI=1S/C22H25N3O2/c1-4-17-8-6-7-9-19(17)25(5-2)21(26)15-14-20-23-22(24-27-20)18-12-10-16(3)11-13-18/h6-13H,4-5,14-15H2,1-3H3	YZWKOVLMMJEJLP-UHFFFAOYSA-N	363.19467707							109368
F1105-0226	LSM-20767	SID24824286, BRD-K96426659	4578108	InChI=1S/C16H9N3O3S/c20-14(8-1-4-12-13(5-8)23-7-17-12)18-9-2-3-10-11(6-9)16(22)19-15(10)21/h1-7H,(H,18,20)(H,19,21,22)	IXOYMIUQSYKGNJ-UHFFFAOYSA-N	O=C(Nc1ccc2C(=O)NC(=O)c2c1)c3ccc4ncsc4c3	BroadT	BRD-K96426659	BRD-K96426659-001-05-0	Life Chemicals Inc.	F1105-0226			O=C(Nc1ccc2C(=O)NC(=O)c2c1)c1ccc2ncsc2c1	InChI=1S/C16H9N3O3S/c20-14(8-1-4-12-13(5-8)23-7-17-12)18-9-2-3-10-11(6-9)16(22)19-15(10)21/h1-7H,(H,18,20)(H,19,21,22)	IXOYMIUQSYKGNJ-UHFFFAOYSA-N	323.036461868							109369
SMR000032319	LSM-20768	SID4246848, BRD-A34064931	3241136	InChI=1S/C21H29N3O2/c25-20-13-18(15-24(20)19-7-3-4-8-19)21(26)22-10-12-23-11-9-16-5-1-2-6-17(16)14-23/h1-2,5-6,18-19H,3-4,7-15H2,(H,22,26)	PONUMWZQSDCKKP-UHFFFAOYSA-N	O=C(NCCN1CCc2ccccc2C1)C3CN(C4CCCC4)C(=O)C3	BroadT	BRD-A34064931	BRD-A34064931-001-05-6	ChemDiv Inc.	K786-7003			O=C(NCCN1CCc2ccccc2C1)C1CN(C2CCCC2)C(=O)C1	InChI=1S/C21H29N3O2/c25-20-13-18(15-24(20)19-7-3-4-8-19)21(26)22-10-12-23-11-9-16-5-1-2-6-17(16)14-23/h1-2,5-6,18-19H,3-4,7-15H2,(H,22,26)	PONUMWZQSDCKKP-UHFFFAOYSA-N	355.225977198							109370
SMR000068383	LSM-20769	BRD-K50946180, SID3713760	2998537	InChI=1S/C21H23ClN4O3S/c1-2-11-26-18-8-4-3-7-17(18)23-21(26)24-20(27)15-9-10-16(22)19(14-15)30(28,29)25-12-5-6-13-25/h3-4,7-10,14H,2,5-6,11-13H2,1H3,(H,23,24,27)	DBQAKCWLWNCHLC-UHFFFAOYSA-N	CCCn1c(NC(=O)c2ccc(Cl)c(c2)S(=O)(=O)N3CCCC3)nc4ccccc14	BroadT	BRD-K50946180	BRD-K50946180-001-07-5	Enamine Ltd.	T5341074			CCCn1c(NC(=O)c2ccc(Cl)c(c2)S(=O)(=O)N2CCCC2)nc2ccccc12	InChI=1S/C21H23ClN4O3S/c1-2-11-26-18-8-4-3-7-17(18)23-21(26)24-20(27)15-9-10-16(22)19(14-15)30(28,29)25-12-5-6-13-25/h3-4,7-10,14H,2,5-6,11-13H2,1H3,(H,23,24,27)	DBQAKCWLWNCHLC-UHFFFAOYSA-N	446.117939036							109371
STK511295	LSM-15314	BRD-K71137167	1817859	InChI=1S/C17H22N2O/c20-13-12-18-10-11-19-14-15-6-8-17(9-7-15)16-4-2-1-3-5-16/h1-9,18-20H,10-14H2	KQHVPQPDJJPAAU-UHFFFAOYSA-N	OCCNCCNCc1ccc(cc1)c2ccccc2	BroadT	BRD-K71137167	BRD-K71137167-003-03-8	ChemBridge Corporation	7935258		Cl	OCCNCCNCc1ccc(cc1)-c1ccccc1.Cl	InChI=1S/C17H22N2O.ClH/c20-13-12-18-10-11-19-14-15-6-8-17(9-7-15)16-4-2-1-3-5-16;/h1-9,18-20H,10-14H2;1H	CEPGMEIIRMPPQV-UHFFFAOYSA-N	270.173213344							103961, 103961
2-[1-(2-Oxo-2-{[4-(2-thienyl)benzyl]amino}ethyl)cyclohexyl]acetic acid	LSM-20770	SID26726902, BRD-K89353352	2738305	InChI=1S/C21H25NO3S/c23-19(13-21(14-20(24)25)10-2-1-3-11-21)22-15-16-6-8-17(9-7-16)18-5-4-12-26-18/h4-9,12H,1-3,10-11,13-15H2,(H,22,23)(H,24,25)	XNTWJMJXMUOEAK-UHFFFAOYSA-N	OC(=O)CC1(CC(=O)NCc2ccc(cc2)c3cccs3)CCCCC1	BroadT	BRD-K89353352	BRD-K89353352-001-05-5	Maybridge	SCR 00321			OC(=O)CC1(CC(=O)NCc2ccc(cc2)-c2cccs2)CCCCC1	InChI=1S/C21H25NO3S/c23-19(13-21(14-20(24)25)10-2-1-3-11-21)22-15-16-6-8-17(9-7-16)18-5-4-12-26-18/h4-9,12H,1-3,10-11,13-15H2,(H,22,23)(H,24,25)	XNTWJMJXMUOEAK-UHFFFAOYSA-N	371.15551436							109372
ST50675192	LSM-20771	SID7966942, BRD-K13591916	5308525	InChI=1S/C16H18N2O3/c1-20-14-8-4-3-7-12(14)15-11-13(17-21-15)16(19)18-9-5-2-6-10-18/h3-4,7-8,11H,2,5-6,9-10H2,1H3	BXFYHKIKABSLND-UHFFFAOYSA-N	COc1ccccc1c2onc(c2)C(=O)N3CCCCC3	BroadT	BRD-K13591916	BRD-K13591916-001-05-0	ChemDiv Inc.	C226-0945			COc1ccccc1-c1cc(no1)C(=O)N1CCCCC1	InChI=1S/C16H18N2O3/c1-20-14-8-4-3-7-12(14)15-11-13(17-21-15)16(19)18-9-5-2-6-10-18/h3-4,7-8,11H,2,5-6,9-10H2,1H3	BXFYHKIKABSLND-UHFFFAOYSA-N	286.131742456							109373
CBMICRO_020045	LSM-20772	BRD-K38657184	2243914	InChI=1S/C21H15BrFN3O2/c22-18-7-3-1-5-16(18)20(27)25-19-8-4-2-6-17(19)21(28)26-24-13-14-9-11-15(23)12-10-14/h1-13H,(H,25,27)(H,26,28)	STNZKWZLJQOCIW-UHFFFAOYSA-N	Fc1ccc(C=NNC(=O)c2ccccc2NC(=O)c3ccccc3Br)cc1	BroadT	BRD-K38657184	BRD-K38657184-001-05-5	ChemBridge Corporation	5377770			Fc1ccc(C=NNC(=O)c2ccccc2NC(=O)c2ccccc2Br)cc1	InChI=1S/C21H15BrFN3O2/c22-18-7-3-1-5-16(18)20(27)25-19-8-4-2-6-17(19)21(28)26-24-13-14-9-11-15(23)12-10-14/h1-13H,(H,25,27)(H,26,28)	STNZKWZLJQOCIW-UHFFFAOYSA-N	439.03316755							109374
SMR000310799	LSM-20773	SID24812156, BRD-A77016449	16193537	InChI=1S/C27H32N4O4S/c32-25(28-18-22-7-4-14-35-22)19-36-27-29-24-9-8-21(30-12-15-34-16-13-30)17-23(24)26(33)31(27)11-10-20-5-2-1-3-6-20/h1-3,5-6,8-9,17,22H,4,7,10-16,18-19H2,(H,28,32)	GJKRCJKXXVVAMV-UHFFFAOYSA-N	O=C(CSC1=Nc2ccc(cc2C(=O)N1CCc3ccccc3)N4CCOCC4)NCC5CCCO5	BroadT	BRD-A77016449	BRD-A77016449-001-05-9	ChemDiv Inc.	K284-6982			O=C(CSc1nc2ccc(cc2c(=O)n1CCc1ccccc1)N1CCOCC1)NCC1CCCO1	InChI=1S/C27H32N4O4S/c32-25(28-18-22-7-4-14-35-22)19-36-27-29-24-9-8-21(30-12-15-34-16-13-30)17-23(24)26(33)31(27)11-10-20-5-2-1-3-6-20/h1-3,5-6,8-9,17,22H,4,7,10-16,18-19H2,(H,28,32)	GJKRCJKXXVVAMV-UHFFFAOYSA-N	508.214426234							109375
MLS000710840	LSM-20774	SID24789409, BRD-K67791947	1108315	InChI=1S/C16H14N2O4S2/c1-22-11-5-3-4-10(8-11)15(19)18-16-17-13-7-6-12(24(2,20)21)9-14(13)23-16/h3-9H,1-2H3,(H,17,18,19)	DCVFEYXHYOXRRO-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Nc2nc3ccc(cc3s2)S(=O)(=O)C	BroadT	BRD-K67791947	BRD-K67791947-001-06-2	Asinex Ltd.	BAS 00854199			COc1cccc(c1)C(=O)Nc1nc2ccc(cc2s1)S(C)(=O)=O	InChI=1S/C16H14N2O4S2/c1-22-11-5-3-4-10(8-11)15(19)18-16-17-13-7-6-12(24(2,20)21)9-14(13)23-16/h3-9H,1-2H3,(H,17,18,19)	DCVFEYXHYOXRRO-UHFFFAOYSA-N	362.039498328							109376
370072-43-8	LSM-43894	SID26660236, BRD-K62556342	5918537	InChI=1S/C17H16FNO3/c1-10-15(17(21)22-3)11(2)19-16(10)14(20)9-8-12-6-4-5-7-13(12)18/h4-9,19H,1-3H3/b9-8+	IQXVSXSWELSBKG-CMDGGOBGSA-N	COC(=O)c1c(C)[nH]c(C(=O)\C=C\c2ccccc2F)c1C	BroadT	BRD-K62556342	BRD-K62556342-001-05-7	InterBioScreen Ltd.	STOCK1S-16780			COC(=O)c1c(C)[nH]c(C(=O)\C=C\c2ccccc2F)c1C	InChI=1S/C17H16FNO3/c1-10-15(17(21)22-3)11(2)19-16(10)14(20)9-8-12-6-4-5-7-13(12)18/h4-9,19H,1-3H3/b9-8+	IQXVSXSWELSBKG-CMDGGOBGSA-N	301.111421582							
MLS000096050	LSM-20776	SID4247426, BRD-A11196529	3241640	InChI=1S/C22H25N3O4/c1-27-17-9-10-19(28-2)16(12-17)13-23-21(26)15-6-5-11-25(14-15)22-24-18-7-3-4-8-20(18)29-22/h3-4,7-10,12,15H,5-6,11,13-14H2,1-2H3,(H,23,26)	KJOPOFVOPPIOLH-UHFFFAOYSA-N	COc1ccc(OC)c(CNC(=O)C2CCCN(C2)c3oc4ccccc4n3)c1	BroadT	BRD-A11196529	BRD-A11196529-001-05-1	ChemDiv Inc.	K786-3310			COc1ccc(OC)c(CNC(=O)C2CCCN(C2)c2nc3ccccc3o2)c1	InChI=1S/C22H25N3O4/c1-27-17-9-10-19(28-2)16(12-17)13-23-21(26)15-6-5-11-25(14-15)22-24-18-7-3-4-8-20(18)29-22/h3-4,7-10,12,15H,5-6,11,13-14H2,1-2H3,(H,23,26)	KJOPOFVOPPIOLH-UHFFFAOYSA-N	395.18450631							109378
N-[2-[2-[(3-Hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]-2,2-diphenylacetamide	LSM-20777	BRD-K22021793	1969687	InChI=1S/C23H21N3O3/c27-20-13-7-8-17(14-20)15-25-26-21(28)16-24-23(29)22(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-15,22,27H,16H2,(H,24,29)(H,26,28)	BMDNUNGSIXGMNR-UHFFFAOYSA-N	Oc1cccc(C=NNC(=O)CNC(=O)C(c2ccccc2)c3ccccc3)c1	BroadT	BRD-K22021793	BRD-K22021793-001-06-3	InterBioScreen Ltd.	STOCK3S-26655			Oc1cccc(C=NNC(=O)CNC(=O)C(c2ccccc2)c2ccccc2)c1	InChI=1S/C23H21N3O3/c27-20-13-7-8-17(14-20)15-25-26-21(28)16-24-23(29)22(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-15,22,27H,16H2,(H,24,29)(H,26,28)	BMDNUNGSIXGMNR-UHFFFAOYSA-N	387.158291562							109379
AC1LUD53	LSM-20778	SID26671467, BRD-K90708444	1627636	InChI=1S/C9H9N5OS2/c10-12-8(16)11-6-3-1-2-5(4-6)7-13-14-9(17)15-7/h1-4H,10H2,(H,14,17)(H2,11,12,16)	LHXWPDUWZAYBJV-UHFFFAOYSA-N	NN=C(S)Nc1cccc(c1)c2oc(S)nn2	BroadT	BRD-K90708444	BRD-K90708444-001-05-7	InterBioScreen Ltd.	STOCK4S-97297			NN=C(S)Nc1cccc(c1)-c1nnc(S)o1	InChI=1S/C9H9N5OS2/c10-12-8(16)11-6-3-1-2-5(4-6)7-13-14-9(17)15-7/h1-4H,10H2,(H,14,17)(H2,11,12,16)	LHXWPDUWZAYBJV-UHFFFAOYSA-N	267.024851338							109380
AC1MQDOC	LSM-20779	BRD-K38868462	3475121	InChI=1S/C18H18N2O/c1-12-7-9-15(13(2)11-12)18(21)20-19-17-10-8-14-5-3-4-6-16(14)17/h3-7,9,11H,8,10H2,1-2H3,(H,20,21)	ULUXQPHPQOPMLI-UHFFFAOYSA-N	Cc1ccc(C(=O)NN=C2CCc3ccccc23)c(C)c1	BroadT	BRD-K38868462	BRD-K38868462-001-05-1	Enamine Ltd.	T0517-4487			Cc1ccc(C(=O)NN=C2CCc3ccccc23)c(C)c1	InChI=1S/C18H18N2O/c1-12-7-9-15(13(2)11-12)18(21)20-19-17-10-8-14-5-3-4-6-16(14)17/h3-7,9,11H,8,10H2,1-2H3,(H,20,21)	ULUXQPHPQOPMLI-UHFFFAOYSA-N	278.141913216							109381
AC1MDSF5	LSM-20780	BRD-K65406869	2816082	InChI=1S/C15H14N4OS2/c1-8-6-9(2)18-15-11(8)12(16)13(22-15)14(20)19-17-7-10-4-3-5-21-10/h3-7H,16H2,1-2H3,(H,19,20)	XVVUWKWSRDRMEN-UHFFFAOYSA-N	Cc1cc(C)c2c(N)c(sc2n1)C(=O)NN=Cc3cccs3	BroadT	BRD-K65406869	BRD-K65406869-001-04-8	Maybridge	HTS 12095			Cc1cc(C)c2c(N)c(sc2n1)C(=O)NN=Cc1cccs1	InChI=1S/C15H14N4OS2/c1-8-6-9(2)18-15-11(8)12(16)13(22-15)14(20)19-17-7-10-4-3-5-21-10/h3-7H,16H2,1-2H3,(H,19,20)	XVVUWKWSRDRMEN-UHFFFAOYSA-N	330.060902488							109382
N5-(4-Chlorophenyl)-3-methyl-1-(4-methylbenzyl)-1H-pyrazole-5-carboxamide	LSM-20781	SID26729855, BRD-K70318282	2747052	InChI=1S/C19H18ClN3O/c1-13-3-5-15(6-4-13)12-23-18(11-14(2)22-23)19(24)21-17-9-7-16(20)8-10-17/h3-11H,12H2,1-2H3,(H,21,24)	SMYCVOZVZYQMFD-UHFFFAOYSA-N	Cc1ccc(Cn2nc(C)cc2C(=O)Nc3ccc(Cl)cc3)cc1	BroadT	BRD-K70318282	BRD-K70318282-001-04-7	Maybridge	SPB 07764			Cc1cc(C(=O)Nc2ccc(Cl)cc2)n(Cc2ccc(C)cc2)n1	InChI=1S/C19H18ClN3O/c1-13-3-5-15(6-4-13)12-23-18(11-14(2)22-23)19(24)21-17-9-7-16(20)8-10-17/h3-11H,12H2,1-2H3,(H,21,24)	SMYCVOZVZYQMFD-UHFFFAOYSA-N	339.113839936							109383
MLS000721184	LSM-20782	SID24822280, BRD-K52563512	1485012	InChI=1S/C17H16N6OS/c1-12-6-5-9-15(19-12)23-10-14(18-11-23)16(24)21-22-17(25)20-13-7-3-2-4-8-13/h2-11H,1H3,(H,21,24)(H2,20,22,25)	HZIHMEUDXCSJHM-UHFFFAOYSA-N	Cc1cccc(n1)n2cnc(c2)C(=O)NN=C(S)Nc3ccccc3	BroadT	BRD-K52563512	BRD-K52563512-001-06-7	Key Organics Ltd.	7P-715			Cc1cccc(n1)-n1cnc(c1)C(=O)NN=C(S)Nc1ccccc1	InChI=1S/C17H16N6OS/c1-12-6-5-9-15(19-12)23-10-14(18-11-23)16(24)21-22-17(25)20-13-7-3-2-4-8-13/h2-11H,1H3,(H,21,24)(H2,20,22,25)	HZIHMEUDXCSJHM-UHFFFAOYSA-N	352.110629882							109384
1-(3-Fluorophenyl)-3-(pyridin-2-ylmethyl)thiourea	LSM-20783	SID17433108, BRD-K83234554	738692	InChI=1S/C13H12FN3S/c14-10-4-3-6-11(8-10)17-13(18)16-9-12-5-1-2-7-15-12/h1-8H,9H2,(H2,16,17,18)	QWPQRTRZXNQTBN-UHFFFAOYSA-N	Fc1cccc(NC(=NCc2ccccn2)S)c1	BroadT	BRD-K83234554	BRD-K83234554-001-05-9	ChemBridge Corporation	6689622			Fc1cccc(NC(S)=NCc2ccccn2)c1	InChI=1S/C13H12FN3S/c14-10-4-3-6-11(8-10)17-13(18)16-9-12-5-1-2-7-15-12/h1-8H,9H2,(H2,16,17,18)	QWPQRTRZXNQTBN-UHFFFAOYSA-N	261.073596304							109385
MLS000578653	LSM-20784	SID17432618, BRD-K44477399	738585	InChI=1S/C17H21NO2S/c1-19-15-8-14(9-16(10-15)20-2)12-18-11-13-4-6-17(21-3)7-5-13/h4-10,18H,11-12H2,1-3H3	QQQBKKSIWXTIBX-UHFFFAOYSA-N	COc1cc(CNCc2ccc(SC)cc2)cc(OC)c1	BroadT	BRD-K44477399	BRD-K44477399-001-05-1	ChemBridge Corporation	5536676			COc1cc(CNCc2ccc(SC)cc2)cc(OC)c1	InChI=1S/C17H21NO2S/c1-19-15-8-14(9-16(10-15)20-2)12-18-11-13-4-6-17(21-3)7-5-13/h4-10,18H,11-12H2,1-3H3	QQQBKKSIWXTIBX-UHFFFAOYSA-N	303.129299612							109386
AC1MC9U4	LSM-20785	SID26731386, BRD-K19228147	2739058	InChI=1S/C13H13N5O/c14-12(11-8-4-5-9-15-11)17-18-13(19)16-10-6-2-1-3-7-10/h1-9H,(H2,14,17)(H2,16,18,19)	QKWPOOOLYRSMDG-UHFFFAOYSA-N	N=C(NNC(=O)Nc1ccccc1)c2ccccn2	BroadT	BRD-K19228147	BRD-K19228147-001-04-7	Maybridge	SEW 00368			N=C(NNC(=O)Nc1ccccc1)c1ccccn1	InChI=1S/C13H13N5O/c14-12(11-8-4-5-9-15-11)17-18-13(19)16-10-6-2-1-3-7-10/h1-9H,(H2,14,17)(H2,16,18,19)	QKWPOOOLYRSMDG-UHFFFAOYSA-N	255.112010086							109387
AMBCB68574826	LSM-20786	SID49825439, BRD-K23980932	24818934	InChI=1S/C19H26N4O5S/c1-14-11-18(28-21-14)13-20-19(24)15-5-4-6-17(12-15)27-16-7-9-23(10-8-16)29(25,26)22(2)3/h4-6,11-12,16H,7-10,13H2,1-3H3,(H,20,24)	DFMAQRFHHYFEQR-UHFFFAOYSA-N	CN(C)S(=O)(=O)N1CCC(CC1)Oc2cccc(c2)C(=O)NCc3onc(C)c3	BroadT	BRD-K23980932	BRD-K23980932-001-06-1	ChemBridge Corporation	68574826			CN(C)S(=O)(=O)N1CCC(CC1)Oc1cccc(c1)C(=O)NCc1cc(C)no1	InChI=1S/C19H26N4O5S/c1-14-11-18(28-21-14)13-20-19(24)15-5-4-6-17(12-15)27-16-7-9-23(10-8-16)29(25,26)22(2)3/h4-6,11-12,16H,7-10,13H2,1-3H3,(H,20,24)	DFMAQRFHHYFEQR-UHFFFAOYSA-N	422.162390662							109388
4-(1H-Benzimidazol-2-yl)quinoline	LSM-20787	SID7971978, BRD-K53994001	723044	InChI=1S/C16H11N3/c1-2-6-13-11(5-1)12(9-10-17-13)16-18-14-7-3-4-8-15(14)19-16/h1-10H,(H,18,19)	WQWLWMHHMQYNIE-UHFFFAOYSA-N	c1ccc2[nH]c(nc2c1)c3ccnc4ccccc34	BroadT	BRD-K53994001	BRD-K53994001-001-05-3	ChemBridge Corporation	5727127			c1ccc2[nH]c(nc2c1)-c1ccnc2ccccc12	InChI=1S/C16H11N3/c1-2-6-13-11(5-1)12(9-10-17-13)16-18-14-7-3-4-8-15(14)19-16/h1-10H,(H,18,19)	WQWLWMHHMQYNIE-UHFFFAOYSA-N	245.095297382							109389, 109389
NSC99657	LSM-20788	SID26664630, SID403309, SID4253482, BRD-K88302796	3034554	InChI=1S/C13H19N5OS2/c1-16-10-9(11(20)17(2)13(16)19)14-12(15-10)21-8-7-18-5-3-4-6-18/h3-8H2,1-2H3,(H,14,15)	KLAIFKHPSDRWRR-UHFFFAOYSA-N	CN1C(=O)N(C)c2[nH]c(SCCN3CCCC3)nc2C1=S	BroadT	BRD-K88302796	BRD-K88302796-001-05-7	National Cancer Institute Chemotherapeutic Agents Repository	Theophylline, 8-[(2-pyrrolidinoethyl)thio]-6-thio- 99657			Cn1c2[nH]c(SCCN3CCCC3)nc2c(=S)n(C)c1=O	InChI=1S/C13H19N5OS2/c1-16-10-9(11(20)17(2)13(16)19)14-12(15-10)21-8-7-18-5-3-4-6-18/h3-8H2,1-2H3,(H,14,15)	KLAIFKHPSDRWRR-UHFFFAOYSA-N	325.103101658							109390
MLS000036918	LSM-20789	SID50102667, SID860549, BRD-K03994072	661833	InChI=1S/C20H23N3O/c1-4-8-15-9-7-10-16(19(15)24)13-21-20-22-17-11-5-6-12-18(17)23(20)14(2)3/h4-7,9-12,14,24H,1,8,13H2,2-3H3,(H,21,22)	KVSQJRLYXTVULX-UHFFFAOYSA-N	CC(C)n1c(NCc2cccc(CC=C)c2O)nc3ccccc13	BroadT	BRD-K03994072	BRD-K03994072-001-05-8	InterBioScreen Ltd.	STOCK3S-80568			CC(C)n1c(NCc2cccc(CC=C)c2O)nc2ccccc12	InChI=1S/C20H23N3O/c1-4-8-15-9-7-10-16(19(15)24)13-21-20-22-17-11-5-6-12-18(17)23(20)14(2)3/h4-7,9-12,14,24H,1,8,13H2,2-3H3,(H,21,22)	KVSQJRLYXTVULX-UHFFFAOYSA-N	321.184112386							109391
SMR000156141	LSM-20790	SID17407151, BRD-A00489811	11958452	InChI=1S/C21H26N4O3S2/c1-6-7-12(2)19(26)25-21-22-13(3)18(30-21)16-11-29-20(24-16)23-15-10-14(27-4)8-9-17(15)28-5/h8-12H,6-7H2,1-5H3,(H,23,24)(H,22,25,26)	JAZWKYQDMWHNDM-UHFFFAOYSA-N	CCCC(C)C(=O)Nc1nc(C)c(s1)c2csc(Nc3cc(OC)ccc3OC)n2	BroadT	BRD-A00489811	BRD-A00489811-001-05-0	University of California at Davis	CLY_Corr_I10			CCCC(C)C(=O)Nc1nc(C)c(s1)-c1csc(Nc2cc(OC)ccc2OC)n1	InChI=1S/C21H26N4O3S2/c1-6-7-12(2)19(26)25-21-22-13(3)18(30-21)16-11-29-20(24-16)23-15-10-14(27-4)8-9-17(15)28-5/h8-12H,6-7H2,1-5H3,(H,23,24)(H,22,25,26)	JAZWKYQDMWHNDM-UHFFFAOYSA-N	446.144632112							109392
AC1M3E7F	LSM-43895	SID24787761, BRD-K32902045	2188292	InChI=1S/C17H13ClN2O4/c1-10-6-7-12(24-10)8-13-15(21)19-17(23)20(16(13)22)9-11-4-2-3-5-14(11)18/h2-8H,9H2,1H3,(H,19,21,23)/b13-8+	QLYYBGQYQIWCTK-MDWZMJQESA-N	Cc1oc(\C=C\2/C(=O)NC(=O)N(Cc3ccccc3Cl)C2=O)cc1	BroadT	BRD-K32902045	BRD-K32902045-001-06-8	ChemBridge Corporation	7406628			Cc1ccc(\C=C2/C(=O)NC(=O)N(Cc3ccccc3Cl)C2=O)o1	InChI=1S/C17H13ClN2O4/c1-10-6-7-12(24-10)8-13-15(21)19-17(23)20(16(13)22)9-11-4-2-3-5-14(11)18/h2-8H,9H2,1H3,(H,19,21,23)/b13-8+	QLYYBGQYQIWCTK-MDWZMJQESA-N	344.056384626							
1-(2-(2,4-Dichlorophenoxy)acetyl)-4-(4-methoxyphenyl)thiosemicarbazide	LSM-20792	SID17515044, BRD-K96938523	4128012	InChI=1S/C16H15Cl2N3O3S/c1-23-12-5-3-11(4-6-12)19-16(25)21-20-15(22)9-24-14-7-2-10(17)8-13(14)18/h2-8H,9H2,1H3,(H,20,22)(H2,19,21,25)	LNPBULPTWCKZSR-UHFFFAOYSA-N	COc1ccc(NC(=NNC(=O)COc2ccc(Cl)cc2Cl)S)cc1	BroadT	BRD-K96938523	BRD-K96938523-001-05-8	Life Chemicals Inc.	F0807-0307			COc1ccc(NC(S)=NNC(=O)COc2ccc(Cl)cc2Cl)cc1	InChI=1S/C16H15Cl2N3O3S/c1-23-12-5-3-11(4-6-12)19-16(25)21-20-15(22)9-24-14-7-2-10(17)8-13(14)18/h2-8H,9H2,1H3,(H,20,22)(H2,19,21,25)	LNPBULPTWCKZSR-UHFFFAOYSA-N	399.02111748							109394
F3097-2317	LSM-20793	SID7974999, BRD-K75466993	1562746	InChI=1S/C15H22N2O3/c1-2-3-10-20-15(18)16-13-4-6-14(7-5-13)17-8-11-19-12-9-17/h4-7H,2-3,8-12H2,1H3,(H,16,18)	DANGKLACZOJVJD-UHFFFAOYSA-N	CCCCOC(=O)Nc1ccc(cc1)N2CCOCC2	BroadT	BRD-K75466993	BRD-K75466993-001-05-6	ChemBridge Corporation	6666963			CCCCOC(=O)Nc1ccc(cc1)N1CCOCC1	InChI=1S/C15H22N2O3/c1-2-3-10-20-15(18)16-13-4-6-14(7-5-13)17-8-11-19-12-9-17/h4-7H,2-3,8-12H2,1H3,(H,16,18)	DANGKLACZOJVJD-UHFFFAOYSA-N	278.163042584							109395
SMR000075867	LSM-20794	SID4257074, BRD-K41365318	1291441	InChI=1S/C19H19N5O3S/c1-12-8-9-16(13(2)10-12)24-19(21-22-23-24)28-11-17(25)20-15-7-5-4-6-14(15)18(26)27-3/h4-10H,11H2,1-3H3,(H,20,25)	YRPXOLGFWXYTOU-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)CSc2nnnn2c3ccc(C)cc3C	BroadT	BRD-K41365318	BRD-K41365318-001-07-5	ChemBridge Corporation	7749348			COC(=O)c1ccccc1NC(=O)CSc1nnnn1-c1ccc(C)cc1C	InChI=1S/C19H19N5O3S/c1-12-8-9-16(13(2)10-12)24-19(21-22-23-24)28-11-17(25)20-15-7-5-4-6-14(15)18(26)27-3/h4-10H,11H2,1-3H3,(H,20,25)	YRPXOLGFWXYTOU-UHFFFAOYSA-N	397.120860208							109396
ASN 04372485	LSM-20795	SID14721637, BRD-K75212763	1172189	InChI=1S/C16H15N3O/c1-11-6-5-7-13(10-11)18-16(20)15-12(2)17-14-8-3-4-9-19(14)15/h3-10H,1-2H3,(H,18,20)	ODAVLIHEFNQTRP-UHFFFAOYSA-N	Cc1cccc(NC(=O)c2c(C)nc3ccccn23)c1	BroadT	BRD-K75212763	BRD-K75212763-001-05-2	Asinex Ltd.	ASN 04372485			Cc1nc2ccccn2c1C(=O)Nc1cccc(C)c1	InChI=1S/C16H15N3O/c1-11-6-5-7-13(10-11)18-16(20)15-12(2)17-14-8-3-4-9-19(14)15/h3-10H,1-2H3,(H,18,20)	ODAVLIHEFNQTRP-UHFFFAOYSA-N	265.12151213							109397
SMR000095255	LSM-20796	SID7964912, BRD-K00585002	5307298	InChI=1S/C19H21N3O4/c1-24-16-8-7-13(17(25-2)18(16)26-3)9-10-20-19(23)15-12-14-6-4-5-11-22(14)21-15/h4-8,11-12H,9-10H2,1-3H3,(H,20,23)	YGVJIWOUUZVPAG-UHFFFAOYSA-N	COc1ccc(CCNC(=O)c2cc3ccccn3n2)c(OC)c1OC	BroadT	BRD-K00585002	BRD-K00585002-001-04-5	ChemDiv Inc.	C613-0036			COc1ccc(CCNC(=O)c2cc3ccccn3n2)c(OC)c1OC	InChI=1S/C19H21N3O4/c1-24-16-8-7-13(17(25-2)18(16)26-3)9-10-20-19(23)15-12-14-6-4-5-11-22(14)21-15/h4-8,11-12H,9-10H2,1-3H3,(H,20,23)	YGVJIWOUUZVPAG-UHFFFAOYSA-N	355.153206182							109398
MLS000549167	LSM-20797	SID14727640, BRD-K26501704	841995	InChI=1S/C14H11Cl2N3OS/c1-19-7-8(6-18-19)5-17-14(20)13-12(16)11-9(15)3-2-4-10(11)21-13/h2-4,6-7H,5H2,1H3,(H,17,20)	WQVVNESXOJZMTN-UHFFFAOYSA-N	Cn1cc(CNC(=O)c2sc3cccc(Cl)c3c2Cl)cn1	BroadT	BRD-K26501704	BRD-K26501704-001-06-8	Specs	AK-968/41022352			Cn1cc(CNC(=O)c2sc3cccc(Cl)c3c2Cl)cn1	InChI=1S/C14H11Cl2N3OS/c1-19-7-8(6-18-19)5-17-14(20)13-12(16)11-9(15)3-2-4-10(11)21-13/h2-4,6-7H,5H2,1H3,(H,17,20)	WQVVNESXOJZMTN-UHFFFAOYSA-N	338.999988112							109399
AC1NSCEM	LSM-20798	SID7965015, BRD-A95381012	5307369	InChI=1S/C18H13ClN4O/c19-12-8-9-15(21-11-12)22-17-13-5-1-2-6-14(13)18(24)23(17)16-7-3-4-10-20-16/h1-11,17H,(H,21,22)	UKEQQUYLXANNTR-UHFFFAOYSA-N	Clc1ccc(NC2N(C(=O)c3ccccc23)c4ccccn4)nc1	BroadT	BRD-A95381012	BRD-A95381012-001-05-2	ChemDiv Inc.	C430-0253			Clc1ccc(NC2N(C(=O)c3ccccc23)c2ccccn2)nc1	InChI=1S/C18H13ClN4O/c19-12-8-9-15(21-11-12)22-17-13-5-1-2-6-14(13)18(24)23(17)16-7-3-4-10-20-16/h1-11,17H,(H,21,22)	UKEQQUYLXANNTR-UHFFFAOYSA-N	336.077788786							109400
MLS000094160	LSM-20799	SID4250986, BRD-K10291183	3244729	InChI=1S/C17H16N2O3S2/c1-13-19-14(12-23-13)11-18-24(20,21)17-9-7-16(8-10-17)22-15-5-3-2-4-6-15/h2-10,12,18H,11H2,1H3	OXTHLNRFVHLMQI-UHFFFAOYSA-N	Cc1nc(CNS(=O)(=O)c2ccc(Oc3ccccc3)cc2)cs1	BroadT	BRD-K10291183	BRD-K10291183-001-05-6	Life Chemicals Inc.	F0684-0035			Cc1nc(CNS(=O)(=O)c2ccc(Oc3ccccc3)cc2)cs1	InChI=1S/C17H16N2O3S2/c1-13-19-14(12-23-13)11-18-24(20,21)17-9-7-16(8-10-17)22-15-5-3-2-4-6-15/h2-10,12,18H,11H2,1H3	OXTHLNRFVHLMQI-UHFFFAOYSA-N	360.060233772							109401
MLS000554960	LSM-20800	SID14741215, BRD-K90500528	7367443	InChI=1S/C16H17BrN2/c1-9-13(14-11(7-8-18)16(14,2)3)10-5-4-6-12(17)15(10)19-9/h4-6,11,14,19H,7H2,1-3H3/t11-,14-/m1/s1	XBXMATSTHLYKNO-BXUZGUMPSA-N	Cc1[nH]c2c(Br)cccc2c1[C@H]3[C@@H](CC#N)C3(C)C	BroadT	BRD-K90500528	BRD-K90500528-001-05-7	InterBioScreen Ltd.	STOCK2S-46615			Cc1[nH]c2c(Br)cccc2c1[C@H]1[C@@H](CC#N)C1(C)C	InChI=1S/C16H17BrN2/c1-9-13(14-11(7-8-18)16(14,2)3)10-5-4-6-12(17)15(10)19-9/h4-6,11,14,19H,7H2,1-3H3/t11-,14-/m1/s1	XBXMATSTHLYKNO-BXUZGUMPSA-N	316.057511164							109402
F2506-0946	LSM-20801	SID49678021, BRD-K69410744	7531559	InChI=1S/C14H14N4S/c1-3-10-4-6-11(7-5-10)12-8-9-13-15-16-14(19-2)18(13)17-12/h4-9H,3H2,1-2H3	YHOKCNDILXFXFM-UHFFFAOYSA-N	CCc1ccc(cc1)c2ccc3nnc(SC)n3n2	BroadT	BRD-K69410744	BRD-K69410744-001-05-4	Life Chemicals Inc.	F2506-0946			CCc1ccc(cc1)-c1ccc2nnc(SC)n2n1	InChI=1S/C14H14N4S/c1-3-10-4-6-11(7-5-10)12-8-9-13-15-16-14(19-2)18(13)17-12/h4-9H,3H2,1-2H3	YHOKCNDILXFXFM-UHFFFAOYSA-N	270.093917178							109403
MLS000712628	LSM-20802	SID24820973, BRD-K17367766	3115435	InChI=1S/C18H18ClN3O5/c1-11-3-8-15(26-2)14(9-11)20-17(24)18(25)22-21-16(23)10-27-13-6-4-12(19)5-7-13/h3-9H,10H2,1-2H3,(H,20,24)(H,21,23)(H,22,25)	MJAYKSVSWMXNOV-UHFFFAOYSA-N	COc1ccc(C)cc1NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2	BroadT	BRD-K17367766	BRD-K17367766-001-06-0	Asinex Ltd.	BAS 00678686			COc1ccc(C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	InChI=1S/C18H18ClN3O5/c1-11-3-8-15(26-2)14(9-11)20-17(24)18(25)22-21-16(23)10-27-13-6-4-12(19)5-7-13/h3-9H,10H2,1-2H3,(H,20,24)(H,21,23)(H,22,25)	MJAYKSVSWMXNOV-UHFFFAOYSA-N	391.093498416							109404
MLS000850149	LSM-20803	BRD-K39476596, SID26730451	2810913	InChI=1S/C18H16FN3O5S2/c19-12-1-4-14(5-2-12)29(24,25)10-9-28-18-21-20-17(23)22(18)13-3-6-15-16(11-13)27-8-7-26-15/h1-6,11H,7-10H2,(H,20,23)	RKIYIKNRUZFVSI-UHFFFAOYSA-N	Oc1nnc(SCCS(=O)(=O)c2ccc(F)cc2)n1c3ccc4OCCOc4c3	BroadT	BRD-K39476596	BRD-K39476596-001-06-9	Maybridge	HTS 02879			Oc1nnc(SCCS(=O)(=O)c2ccc(F)cc2)n1-c1ccc2OCCOc2c1	InChI=1S/C18H16FN3O5S2/c19-12-1-4-14(5-2-12)29(24,25)10-9-28-18-21-20-17(23)22(18)13-3-6-15-16(11-13)27-8-7-26-15/h1-6,11H,7-10H2,(H,20,23)	RKIYIKNRUZFVSI-UHFFFAOYSA-N	437.051540222							109405
MLS000660991	LSM-20804	SID24789242, BRD-K41894486	16189409	InChI=1S/C24H26N4O3S2/c29-20(25-15-17-7-5-14-31-17)16-32-24-26-21-18-8-1-2-9-19(18)33-22(21)23(30)28(24)13-6-12-27-10-3-4-11-27/h1-2,5,7-9,14H,3-4,6,10-13,15-16H2,(H,25,29)	VEFSFFLGADFVLS-UHFFFAOYSA-N	O=C(CSC1=Nc2c(sc3ccccc23)C(=O)N1CCCN4CCCC4)NCc5occc5	BroadT	BRD-K41894486	BRD-K41894486-001-05-4	ChemDiv Inc.	K263-0538			O=C(CSc1nc2c3ccccc3sc2c(=O)n1CCCN1CCCC1)NCc1ccco1	InChI=1S/C24H26N4O3S2/c29-20(25-15-17-7-5-14-31-17)16-32-24-26-21-18-8-1-2-9-19(18)33-22(21)23(30)28(24)13-6-12-27-10-3-4-11-27/h1-2,5,7-9,14H,3-4,6,10-13,15-16H2,(H,25,29)	VEFSFFLGADFVLS-UHFFFAOYSA-N	482.144632112							109406
F0611-0047	LSM-20805	SID4247347, BRD-K73391299	3241566	InChI=1S/C18H17BrN2O3/c1-10-7-13-9-12(17(22)21-14(13)8-11(10)2)5-6-20-18(23)15-3-4-16(19)24-15/h3-4,7-9H,5-6H2,1-2H3,(H,20,23)(H,21,22)	RQMUJRQFJXFLLI-UHFFFAOYSA-N	Cc1cc2cc(CCNC(=O)c3oc(Br)cc3)c(O)nc2cc1C	BroadT	BRD-K73391299	BRD-K73391299-001-05-9	ChemDiv Inc.	C279-0042			Cc1cc2cc(CCNC(=O)c3ccc(Br)o3)c(O)nc2cc1C	InChI=1S/C18H17BrN2O3/c1-10-7-13-9-12(17(22)21-14(13)8-11(10)2)5-6-20-18(23)15-3-4-16(19)24-15/h3-4,7-9H,5-6H2,1-2H3,(H,20,23)(H,21,22)	RQMUJRQFJXFLLI-UHFFFAOYSA-N	388.042255024							109407
AC1MP5HH	LSM-20806	SID24812962, BRD-K17888261	3379882	InChI=1S/C20H18N4O3/c1-12-7-8-16(27-3)14(10-12)21-19(25)15-11-13-18(23(15)2)22-17-6-4-5-9-24(17)20(13)26/h4-11H,1-3H3,(H,21,25)	XSAAZZOKFFSLBT-UHFFFAOYSA-N	COc1ccc(C)cc1NC(=O)c2cc3C(=O)N4C=CC=CC4=Nc3n2C	BroadT	BRD-K17888261	BRD-K17888261-001-06-5	ChemDiv Inc.	E201-0170			COc1ccc(C)cc1NC(=O)c1cc2c(nc3ccccn3c2=O)n1C	InChI=1S/C20H18N4O3/c1-12-7-8-16(27-3)14(10-12)21-19(25)15-11-13-18(23(15)2)22-17-6-4-5-9-24(17)20(13)26/h4-11H,1-3H3,(H,21,25)	XSAAZZOKFFSLBT-UHFFFAOYSA-N	362.137890476							109408
Methyl 3-[(tert-butylamino)sulfonyl]-4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate	LSM-20807	SID26727011, BRD-K63393573	2740351	InChI=1S/C17H18F3NO4S2/c1-16(2,3)21-27(23,24)13-11(10-8-6-5-7-9-10)14(17(18,19)20)26-12(13)15(22)25-4/h5-9,21H,1-4H3	IUTYZZXGSSUDQE-UHFFFAOYSA-N	COC(=O)c1sc(c(c2ccccc2)c1S(=O)(=O)NC(C)(C)C)C(F)(F)F	BroadT	BRD-K63393573	BRD-K63393573-001-06-2	Maybridge	SEW 03485			COC(=O)c1sc(c(c1S(=O)(=O)NC(C)(C)C)-c1ccccc1)C(F)(F)F	InChI=1S/C17H18F3NO4S2/c1-16(2,3)21-27(23,24)13-11(10-8-6-5-7-9-10)14(17(18,19)20)26-12(13)15(22)25-4/h5-9,21H,1-4H3	IUTYZZXGSSUDQE-UHFFFAOYSA-N	421.062934046							109409
105362-06-9	LSM-15315	BRD-K53436696	616435	InChI=1S/C11H10N2O2S/c12-11-13-8(6-16-11)7-1-2-9-10(5-7)15-4-3-14-9/h1-2,5-6H,3-4H2,(H2,12,13)	QNDNSJKGUGRQDK-UHFFFAOYSA-N	Nc1nc(cs1)c2ccc3OCCOc3c2	BroadT	BRD-K53436696	BRD-K53436696-003-03-6	Asinex Ltd.	BAS 03242546		Cl	N=c1[nH]c(cs1)-c1ccc2OCCOc2c1.Cl	InChI=1S/C11H10N2O2S.ClH/c12-11-13-8(6-16-11)7-1-2-9-10(5-7)15-4-3-14-9;/h1-2,5-6H,3-4H2,(H2,12,13);1H	VBAFHESUNIEPDS-UHFFFAOYSA-N	234.04629827							103962, 103962
MLS001217475	LSM-20808	SID49730057, BRD-K13913591	54679960	InChI=1S/C19H17N3O4/c1-11-6-5-7-12(10-11)17(24)20-21-18(25)15-16(23)13-8-3-4-9-14(13)22(2)19(15)26/h3-10,23H,1-2H3,(H,20,24)(H,21,25)	VXOPKODTVDTKHL-UHFFFAOYSA-N	CN1C(=O)C(=C(O)c2ccccc12)C(=O)NNC(=O)c3cccc(C)c3	BroadT	BRD-K13913591	BRD-K13913591-001-06-6	Asinex Ltd.	BAS 00693341			Cc1cccc(c1)C(=O)NNC(=O)c1c(O)c2ccccc2n(C)c1=O	InChI=1S/C19H17N3O4/c1-11-6-5-7-12(10-11)17(24)20-21-18(25)15-16(23)13-8-3-4-9-14(13)22(2)19(15)26/h3-10,23H,1-2H3,(H,20,24)(H,21,25)	VXOPKODTVDTKHL-UHFFFAOYSA-N	351.121906054							109410
AC1OCEH5	LSM-20809	BRD-K49746007	6937156	InChI=1S/C12H11BrN2O2/c13-9-3-1-8(2-4-9)11(16)7-10-12(17)15-6-5-14-10/h1-4H,5-7H2,(H,15,17)	SVOBVMOCQSFOFO-UHFFFAOYSA-N	Brc1ccc(cc1)C(=O)CC2=NCCNC2=O	BroadT	BRD-K49746007	BRD-K49746007-001-04-1	InterBioScreen Ltd.	STOCK1S-16925			Brc1ccc(cc1)C(=O)CC1=NCCNC1=O	InChI=1S/C12H11BrN2O2/c13-9-3-1-8(2-4-9)11(16)7-10-12(17)15-6-5-14-10/h1-4H,5-7H2,(H,15,17)	SVOBVMOCQSFOFO-UHFFFAOYSA-N	294.000390212							109411
AC1MR43F	LSM-20810	SID24810236, BRD-K91214625	3512076	InChI=1S/C22H22ClN3S/c1-16-8-10-18(11-9-16)14-26(15-19-5-4-12-24-13-19)22(27)25-21-7-3-6-20(23)17(21)2/h3-13H,14-15H2,1-2H3,(H,25,27)	SFOXSUVVSTUULR-UHFFFAOYSA-N	Cc1ccc(CN(Cc2cccnc2)C(=Nc3cccc(Cl)c3C)S)cc1	BroadT	BRD-K91214625	BRD-K91214625-001-06-4	ChemDiv Inc.	C087-0604			Cc1ccc(CN(Cc2cccnc2)C(S)=Nc2cccc(Cl)c2C)cc1	InChI=1S/C22H22ClN3S/c1-16-8-10-18(11-9-16)14-26(15-19-5-4-12-24-13-19)22(27)25-21-7-3-6-20(23)17(21)2/h3-13H,14-15H2,1-2H3,(H,25,27)	SFOXSUVVSTUULR-UHFFFAOYSA-N	395.122296134							109412
SMR000011386	LSM-20811	SID26668474, SID847387, BRD-A40912626	649782	InChI=1S/C28H26N4O3S/c1-17-9-7-12-22(18(17)2)32-24(33)16-36-28-21(15-29)26(23-13-8-14-35-23)25(19(3)30-28)27(34)31-20-10-5-4-6-11-20/h4-14,26,30H,16H2,1-3H3,(H,31,34)(H,32,33)	RJTGZCXDBPSENF-UHFFFAOYSA-N	CC1=C(C(C(=C(N1)SCC(=O)Nc2cccc(C)c2C)C#N)c3occc3)C(=O)Nc4ccccc4	BroadT	BRD-A40912626	BRD-A40912626-001-05-8	Asinex Ltd.	BAS 02589725			Cc1cccc(NC(=O)CSC2=C(C#N)C(c3ccco3)C(C(=O)Nc3ccccc3)=C(C)N2)c1C	InChI=1S/C28H26N4O3S/c1-17-9-7-12-22(18(17)2)32-24(33)16-36-28-21(15-29)26(23-13-8-14-35-23)25(19(3)30-28)27(34)31-20-10-5-4-6-11-20/h4-14,26,30H,16H2,1-3H3,(H,31,34)(H,32,33)	RJTGZCXDBPSENF-UHFFFAOYSA-N	498.172561422							109413
4J-555S	LSM-20812	SID17411183, BRD-A36258658	3794816	InChI=1S/C17H16F3NO4S/c1-16(23,11-26(24,25)14-8-3-2-4-9-14)15(22)21-13-7-5-6-12(10-13)17(18,19)20/h2-10,23H,11H2,1H3,(H,21,22)	YYLALWXEJOYRET-UHFFFAOYSA-N	CC(O)(CS(=O)(=O)c1ccccc1)C(=O)Nc2cccc(c2)C(F)(F)F	BroadT	BRD-A36258658	BRD-A36258658-001-05-3	Key Organics Ltd.	4J-555S			CC(O)(CS(=O)(=O)c1ccccc1)C(=O)Nc1cccc(c1)C(F)(F)F	InChI=1S/C17H16F3NO4S/c1-16(23,11-26(24,25)14-8-3-2-4-9-14)15(22)21-13-7-5-6-12(10-13)17(18,19)20/h2-10,23H,11H2,1H3,(H,21,22)	YYLALWXEJOYRET-UHFFFAOYSA-N	387.075213292							109414
N-[2-(3-Acetylamino-phenyl)-1H-benzoimidazol-5-yl]-acetamide	LSM-20813	SID845283, BRD-K54128895	647623	InChI=1S/C17H16N4O2/c1-10(22)18-13-5-3-4-12(8-13)17-20-15-7-6-14(19-11(2)23)9-16(15)21-17/h3-9H,1-2H3,(H,18,22)(H,19,23)(H,20,21)	LJKOXLDKQJOYSH-UHFFFAOYSA-N	CC(=O)Nc1cccc(c1)c2nc3cc(NC(=O)C)ccc3[nH]2	BroadT	BRD-K54128895	BRD-K54128895-001-05-6	Asinex Ltd.	BAS 03421396			CC(=O)Nc1cccc(c1)-c1nc2cc(NC(C)=O)ccc2[nH]1	InChI=1S/C17H16N4O2/c1-10(22)18-13-5-3-4-12(8-13)17-20-15-7-6-14(19-11(2)23)9-16(15)21-17/h3-9H,1-2H3,(H,18,22)(H,19,23)(H,20,21)	LJKOXLDKQJOYSH-UHFFFAOYSA-N	308.127325792							109415
ZINC02880198	LSM-20814	SID4257959, BRD-K91195567	2232324	InChI=1S/C16H16N2O3/c1-21-14-10-6-5-9-13(14)16(20)17-11-15(19)18-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,17,20)(H,18,19)	BYMGLOKVVQNTEO-UHFFFAOYSA-N	COc1ccccc1C(=O)NCC(=O)Nc2ccccc2	BroadT	BRD-K91195567	BRD-K91195567-001-05-7	ChemBridge Corporation	7968099			COc1ccccc1C(=O)NCC(=O)Nc1ccccc1	InChI=1S/C16H16N2O3/c1-21-14-10-6-5-9-13(14)16(20)17-11-15(19)18-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,17,20)(H,18,19)	BYMGLOKVVQNTEO-UHFFFAOYSA-N	284.116092392							109416
4,5-Dichloro-n-pyridin-2-yldithiol-3-imine	LSM-20815	BRD-K02720166	695507	InChI=1S/C8H4Cl2N2S2/c9-6-7(10)13-14-8(6)12-5-3-1-2-4-11-5/h1-4H	RRGKLDYMLXTTEX-UHFFFAOYSA-N	ClC1=C(Cl)C(=Nc2ccccn2)SS1	BroadT	BRD-K02720166	BRD-K02720166-001-06-3	ChemDiv Inc.	8008-8240			Clc1ssc(=Nc2ccccn2)c1Cl	InChI=1S/C8H4Cl2N2S2/c9-6-7(10)13-14-8(6)12-5-3-1-2-4-11-5/h1-4H	RRGKLDYMLXTTEX-UHFFFAOYSA-N	261.919294948							109417
MLS000042558	LSM-20816	SID864819, BRD-K46698069	666067	InChI=1S/C19H29N5/c1-14(2)6-8-21-18-16(12-20)15-7-11-23(3)13-17(15)19(22-18)24-9-4-5-10-24/h14H,4-11,13H2,1-3H3,(H,21,22)	RGMLPLCSNQEKLO-UHFFFAOYSA-N	CC(C)CCNc1nc(N2CCCC2)c3CN(C)CCc3c1C#N	BroadT	BRD-K46698069	BRD-K46698069-001-06-7	InterBioScreen Ltd.	STOCK5S-32315			CC(C)CCNc1nc(N2CCCC2)c2CN(C)CCc2c1C#N	InChI=1S/C19H29N5/c1-14(2)6-8-21-18-16(12-20)15-7-11-23(3)13-17(15)19(22-18)24-9-4-5-10-24/h14H,4-11,13H2,1-3H3,(H,21,22)	RGMLPLCSNQEKLO-UHFFFAOYSA-N	327.242295978							109418
MLS000572617	LSM-20817	SID17416233, BRD-K94116118	879331	InChI=1S/C17H19NO3S/c1-10-8-12(9-19)11(2)18(10)16-15(17(20)21-3)13-6-4-5-7-14(13)22-16/h8-9H,4-7H2,1-3H3	OXFIWBCFEMDNNG-UHFFFAOYSA-N	COC(=O)c1c2CCCCc2sc1n3c(C)cc(C=O)c3C	BroadT	BRD-K94116118	BRD-K94116118-001-05-4	ChemBridge Corporation	6083802			COC(=O)c1c2CCCCc2sc1-n1c(C)cc(C=O)c1C	InChI=1S/C17H19NO3S/c1-10-8-12(9-19)11(2)18(10)16-15(17(20)21-3)13-6-4-5-7-14(13)22-16/h8-9H,4-7H2,1-3H3	OXFIWBCFEMDNNG-UHFFFAOYSA-N	317.108564168							109419
N-[2-(1-Phenylethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]methanesulfonamide	LSM-20818	SID24793177, BRD-A91804054	2969074	InChI=1S/C19H22N4O2S/c1-14(15-6-4-3-5-7-15)22-10-11-23-18-9-8-16(21-26(2,24)25)12-17(18)20-19(23)13-22/h3-9,12,14,21H,10-11,13H2,1-2H3	GLKOCNVIMGSYIJ-UHFFFAOYSA-N	CC(N1CCn2c(C1)nc3cc(NS(=O)(=O)C)ccc23)c4ccccc4	BroadT	BRD-A91804054	BRD-A91804054-001-06-4	ChemBridge Corporation	7938019			CC(N1CCn2c(C1)nc1cc(NS(C)(=O)=O)ccc21)c1ccccc1	InChI=1S/C19H22N4O2S/c1-14(15-6-4-3-5-7-15)22-10-11-23-18-9-8-16(21-26(2,24)25)12-17(18)20-19(23)13-22/h3-9,12,14,21H,10-11,13H2,1-2H3	GLKOCNVIMGSYIJ-UHFFFAOYSA-N	370.146346674							109420
Ethyl 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropan]-2-yl)benzoate	LSM-20819	SID14740614, BRD-A35360906	2861058	InChI=1S/C20H19NO4/c1-2-25-19(24)11-4-3-5-12(10-11)21-17(22)15-13-6-7-14(16(15)18(21)23)20(13)8-9-20/h3-7,10,13-16H,2,8-9H2,1H3	LTYOSFJRLOPDLJ-UHFFFAOYSA-N	CCOC(=O)c1cccc(c1)N2C(=O)C3C4C=CC(C3C2=O)C45CC5	BroadT	BRD-A35360906	BRD-A35360906-001-05-8	ChemBridge Corporation	5676753			CCOC(=O)c1cccc(c1)N1C(=O)C2C(C3C=CC2C32CC2)C1=O	InChI=1S/C20H19NO4/c1-2-25-19(24)11-4-3-5-12(10-11)21-17(22)15-13-6-7-14(16(15)18(21)23)20(13)8-9-20/h3-7,10,13-16H,2,8-9H2,1H3	LTYOSFJRLOPDLJ-UHFFFAOYSA-N	337.131408098							109421
SMR000092043	LSM-20820	SID7967124, BRD-K36505620	4619755	InChI=1S/C26H33N3O4/c1-18-5-7-19(8-6-18)29-22-16-26(2,3)17-23(30)20(22)15-21(25(29)32)24(31)27-9-4-10-28-11-13-33-14-12-28/h5-8,15H,4,9-14,16-17H2,1-3H3,(H,27,31)	BIHFUOLREKBUEB-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=O)C(=CC3=C2CC(C)(C)CC3=O)C(=O)NCCCN4CCOCC4	BroadT	BRD-K36505620	BRD-K36505620-001-04-3	ChemDiv Inc.	6075-0025			Cc1ccc(cc1)-n1c2CC(C)(C)CC(=O)c2cc(C(=O)NCCCN2CCOCC2)c1=O	InChI=1S/C26H33N3O4/c1-18-5-7-19(8-6-18)29-22-16-26(2,3)17-23(30)20(22)15-21(25(29)32)24(31)27-9-4-10-28-11-13-33-14-12-28/h5-8,15H,4,9-14,16-17H2,1-3H3,(H,27,31)	BIHFUOLREKBUEB-UHFFFAOYSA-N	451.247106566							109422
SMR000032058	LSM-20821	SID24839159, SID4240950, BRD-A86354449	3235987	InChI=1S/C19H27Cl2N3O3/c1-4-13(3)24(15-8-10-23(11-9-15)19(26)27-5-2)18(25)22-14-6-7-16(20)17(21)12-14/h6-7,12-13,15H,4-5,8-11H2,1-3H3,(H,22,25)	UMRGNIRTRURPLM-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)N(C(C)CC)C(=O)Nc2ccc(Cl)c(Cl)c2	BroadT	BRD-A86354449	BRD-A86354449-001-05-3	ChemDiv Inc.	K786-5019			CCOC(=O)N1CCC(CC1)N(C(C)CC)C(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C19H27Cl2N3O3/c1-4-13(3)24(15-8-10-23(11-9-15)19(26)27-5-2)18(25)22-14-6-7-16(20)17(21)12-14/h6-7,12-13,15H,4-5,8-11H2,1-3H3,(H,22,25)	UMRGNIRTRURPLM-UHFFFAOYSA-N	415.142947174							109423
1-(3-Methylphenyl)-n-[(3-methylphenyl)methylideneamino]methanimine	LSM-20822	BRD-K62353545	1714665	InChI=1S/C16H16N2/c1-13-5-3-7-15(9-13)11-17-18-12-16-8-4-6-14(2)10-16/h3-12H,1-2H3	WHDOTVYJQXLOJU-UHFFFAOYSA-N	Cc1cccc(C=NN=Cc2cccc(C)c2)c1	BroadT	BRD-K62353545	BRD-K62353545-001-05-4	Specs	AR-299/42656396			Cc1cccc(C=NN=Cc2cccc(C)c2)c1	InChI=1S/C16H16N2/c1-13-5-3-7-15(9-13)11-17-18-12-16-8-4-6-14(2)10-16/h3-12H,1-2H3	WHDOTVYJQXLOJU-UHFFFAOYSA-N	236.131348532							109424
F0748-0427	LSM-20823	SID7971029, BRD-A43894321	4137647	InChI=1S/C15H15ClN6OS2/c1-3-11(24-15-21-17-8-22(15)2)12(23)18-14-20-19-13(25-14)9-6-4-5-7-10(9)16/h4-8,11H,3H2,1-2H3,(H,18,20,23)	JGOLFYKTVLYSDQ-UHFFFAOYSA-N	CCC(Sc1nncn1C)C(=O)Nc2nnc(s2)c3ccccc3Cl	BroadT	BRD-A43894321	BRD-A43894321-001-04-6	Life Chemicals Inc.	F0748-0427			CCC(Sc1nncn1C)C(=O)Nc1nnc(s1)-c1ccccc1Cl	InChI=1S/C15H15ClN6OS2/c1-3-11(24-15-21-17-8-22(15)2)12(23)18-14-20-19-13(25-14)9-6-4-5-7-10(9)16/h4-8,11H,3H2,1-2H3,(H,18,20,23)	JGOLFYKTVLYSDQ-UHFFFAOYSA-N	394.04372825							109425
F3111-2070	LSM-20824	SID24803800, BRD-K48462635	1991432	InChI=1S/C17H19N3OS/c18-16-15(17-19-12-8-4-5-9-14(12)22-17)13(21)10-20(16)11-6-2-1-3-7-11/h4-5,8-9,11H,1-3,6-7,10,18H2	ZKFARNQRVNQGBF-UHFFFAOYSA-N	NC1=C(C(=O)CN1C2CCCCC2)c3nc4ccccc4s3	BroadT	BRD-K48462635	BRD-K48462635-001-06-1	Asinex Ltd.	BAS 05197215			NC1=C(C(=O)CN1C1CCCCC1)c1nc2ccccc2s1	InChI=1S/C17H19N3OS/c18-16-15(17-19-12-8-4-5-9-14(12)22-17)13(21)10-20(16)11-6-2-1-3-7-11/h4-5,8-9,11H,1-3,6-7,10,18H2	ZKFARNQRVNQGBF-UHFFFAOYSA-N	313.124882948							109426
MLS000540120	LSM-20825	SID17386077, BRD-K36007927	990655	InChI=1S/C20H17N3O2S/c1-10-21-17-16-15(11-6-8-12(25-2)9-7-11)13-4-3-5-14(13)23-20(16)26-18(17)19(24)22-10/h6-9H,3-5H2,1-2H3,(H,21,22,24)	QPILCAPDQVLDHF-UHFFFAOYSA-N	COc1ccc(cc1)c2c3CCCc3nc4sc5c(O)nc(C)nc5c24	BroadT	BRD-K36007927	BRD-K36007927-001-05-7	Specs	AO-799/40842416			COc1ccc(cc1)-c1c2CCCc2nc2sc3c(O)nc(C)nc3c12	InChI=1S/C20H17N3O2S/c1-10-21-17-16-15(11-6-8-12(25-2)9-7-11)13-4-3-5-14(13)23-20(16)26-18(17)19(24)22-10/h6-9H,3-5H2,1-2H3,(H,21,22,24)	QPILCAPDQVLDHF-UHFFFAOYSA-N	363.104147504							109427
AC1LROE8	LSM-20826	SID49728170, BRD-K90029366	1450725	InChI=1S/C17H15N3O4S/c18-8-12-5-11-6-14-15(24-10-23-14)7-13(11)19-17(12)25-9-16(21)20-1-3-22-4-2-20/h5-7H,1-4,9-10H2	NBBPNOABAKNGMI-UHFFFAOYSA-N	O=C(CSc1nc2cc3OCOc3cc2cc1C#N)N4CCOCC4	BroadT	BRD-K90029366	BRD-K90029366-001-05-2	Asinex Ltd.	ASN 05588816			O=C(CSc1nc2cc3OCOc3cc2cc1C#N)N1CCOCC1	InChI=1S/C17H15N3O4S/c18-8-12-5-11-6-14-15(24-10-23-14)7-13(11)19-17(12)25-9-16(21)20-1-3-22-4-2-20/h5-7H,1-4,9-10H2	NBBPNOABAKNGMI-UHFFFAOYSA-N	357.07832668							109428
N-(4-Chloro-3-nitrophenyl)-3-phenylbutanamide	LSM-20827	SID17413027, BRD-A11073684	2915906	InChI=1S/C16H15ClN2O3/c1-11(12-5-3-2-4-6-12)9-16(20)18-13-7-8-14(17)15(10-13)19(21)22/h2-8,10-11H,9H2,1H3,(H,18,20)	MJWFBVJELFJTHE-UHFFFAOYSA-N	CC(CC(=O)Nc1ccc(Cl)c(c1)[N+](=O)[O-])c2ccccc2	BroadT	BRD-A11073684	BRD-A11073684-001-05-3	ChemBridge Corporation	6847391			CC(CC(=O)Nc1ccc(Cl)c(c1)[N+]([O-])=O)c1ccccc1	InChI=1S/C16H15ClN2O3/c1-11(12-5-3-2-4-6-12)9-16(20)18-13-7-8-14(17)15(10-13)19(21)22/h2-8,10-11H,9H2,1H3,(H,18,20)	MJWFBVJELFJTHE-UHFFFAOYSA-N	318.07712007							109429
HMS2612F14	LSM-43896	BRD-K88506712	12004963	InChI=1S/C15H18N2O4/c1-15(2,3)21-14(18)17-16-8-4-5-11-6-7-12-13(9-11)20-10-19-12/h4-9H,10H2,1-3H3,(H,17,18)/b5-4+,16-8?	NPWNJBYIYDACEO-UCHVEPNOSA-N	CC(C)(C)OC(=O)NN=C\C=C\c1ccc2OCOc2c1	BroadT	BRD-K88506712	BRD-K88506712-001-05-4	ChemDiv Inc.	4328-0299			CC(C)(C)OC(=O)NN=C\C=C\c1ccc2OCOc2c1	InChI=1S/C15H18N2O4/c1-15(2,3)21-14(18)17-16-8-4-5-11-6-7-12-13(9-11)20-10-19-12/h4-9H,10H2,1-3H3,(H,17,18)/b5-4+,16-8?	NPWNJBYIYDACEO-UCHVEPNOSA-N	290.126657076							
BRD-A99224684	LSM-20829			InChI=1S/C21H22N2O5/c1-10-6-7-15-13(8-10)9-14(19(24)23-15)18-16(20(25)27-4)11(2)22-12(3)17(18)21(26)28-5/h6-9,16,18H,1-5H3,(H,23,24)	UPKUNMJOVISLAR-UHFFFAOYSA-N	COC(=O)C1C(C(=C(C)N=C1C)C(=O)OC)c2cc3cc(C)ccc3nc2O	BroadT	BRD-A99224684	BRD-A99224684-001-05-7	Asinex Ltd.	ASN 02592940			COC(=O)C1C(c2cc3cc(C)ccc3nc2O)C(C(=O)OC)=C(C)N=C1C	InChI=1S/C21H22N2O5/c1-10-6-7-15-13(8-10)9-14(19(24)23-15)18-16(20(25)27-4)11(2)22-12(3)17(18)21(26)28-5/h6-9,16,18H,1-5H3,(H,23,24)	UPKUNMJOVISLAR-UHFFFAOYSA-N	382.152871824							109431
AC1M6T7Z	LSM-20830	SID24829879, BRD-K21995356	2429802	InChI=1S/C19H18N2O4/c1-13-10-17(14(2)21(13)11-16-4-3-9-24-16)18(22)12-25-19(23)15-5-7-20-8-6-15/h3-10H,11-12H2,1-2H3	PPVQVVYILHCBSQ-UHFFFAOYSA-N	Cc1cc(C(=O)COC(=O)c2ccncc2)c(C)n1Cc3occc3	BroadT	BRD-K21995356	BRD-K21995356-001-05-0	Enamine Ltd.	T5222399			Cc1cc(C(=O)COC(=O)c2ccncc2)c(C)n1Cc1ccco1	InChI=1S/C19H18N2O4/c1-13-10-17(14(2)21(13)11-16-4-3-9-24-16)18(22)12-25-19(23)15-5-7-20-8-6-15/h3-10H,11-12H2,1-2H3	PPVQVVYILHCBSQ-UHFFFAOYSA-N	338.126657076							109432
T0519-5778	LSM-20831	SID24839646, BRD-K84439715	2488863	InChI=1S/C18H17N5O2S/c1-2-22(10-12-9-16(24)23-7-8-26-18(23)19-12)11-15-20-14-6-4-3-5-13(14)17(25)21-15/h3-9H,2,10-11H2,1H3,(H,20,21,25)	GAPZEUGGJUYNNV-UHFFFAOYSA-N	CCN(CC1=CC(=O)N2C=CSC2=N1)Cc3nc(O)c4ccccc4n3	BroadT	BRD-K84439715	BRD-K84439715-001-05-9	Enamine Ltd.	T0519-5778			CCN(Cc1cc(=O)n2ccsc2n1)Cc1nc(O)c2ccccc2n1	InChI=1S/C18H17N5O2S/c1-2-22(10-12-9-16(24)23-7-8-26-18(23)19-12)11-15-20-14-6-4-3-5-13(14)17(25)21-15/h3-9H,2,10-11H2,1H3,(H,20,21,25)	GAPZEUGGJUYNNV-UHFFFAOYSA-N	367.110295524							109433
MLS000570883	LSM-20832	BRD-K22854800	873924	InChI=1S/C21H22N4/c1-2-9-21-19(6-1)7-3-8-20(21)17-24-11-13-25(14-12-24)23-16-18-5-4-10-22-15-18/h1-10,15-16H,11-14,17H2	NYLAUQJTBURUOI-UHFFFAOYSA-N	C(N1CCN(CC1)N=Cc2cccnc2)c3cccc4ccccc34	BroadT	BRD-K22854800	BRD-K22854800-001-06-8	ChemBridge Corporation	5813024			C(N1CCN(CC1)N=Cc1cccnc1)c1cccc2ccccc12	InChI=1S/C21H22N4/c1-2-9-21-19(6-1)7-3-8-20(21)17-24-11-13-25(14-12-24)23-16-18-5-4-10-22-15-18/h1-10,15-16H,11-14,17H2	NYLAUQJTBURUOI-UHFFFAOYSA-N	330.184446744							109434
8-Hydroxyquinoline-2-carboxylic acid	LSM-20833	SID26728552, SID48410106, BRD-K05512067	74079	InChI=1S/C10H7NO3/c12-8-3-1-2-6-4-5-7(10(13)14)11-9(6)8/h1-5,12H,(H,13,14)	UHBIKXOBLZWFKM-UHFFFAOYSA-N	OC(=O)c1ccc2cccc(O)c2n1	BroadT	BRD-K05512067	BRD-K05512067-001-06-1	Maybridge	AC 34762			OC(=O)c1ccc2cccc(O)c2n1	InChI=1S/C10H7NO3/c12-8-3-1-2-6-4-5-7(10(13)14)11-9(6)8/h1-5,12H,(H,13,14)	UHBIKXOBLZWFKM-UHFFFAOYSA-N	189.042593094							109435
SMR000028828	LSM-20834	SID4252196, BRD-K25285670	3245779	InChI=1S/C22H31N3O3/c1-6-28-22(27)19-15-20(18-9-7-16(2)8-10-18)25(17(19)3)13-11-21(26)23-12-14-24(4)5/h7-10,15H,6,11-14H2,1-5H3,(H,23,26)	LNVXTFBKKJARDM-UHFFFAOYSA-N	CCOC(=O)c1cc(c2ccc(C)cc2)n(CCC(=O)NCCN(C)C)c1C	BroadT	BRD-K25285670	BRD-K25285670-001-05-1	ChemDiv Inc.	C721-0643			CCOC(=O)c1cc(-c2ccc(C)cc2)n(CCC(=O)NCCN(C)C)c1C	InChI=1S/C22H31N3O3/c1-6-28-22(27)19-15-20(18-9-7-16(2)8-10-18)25(17(19)3)13-11-21(26)23-12-14-24(4)5/h7-10,15H,6,11-14H2,1-5H3,(H,23,26)	LNVXTFBKKJARDM-UHFFFAOYSA-N	385.236541882							109436
MLS000756446	LSM-20835	BRD-K60015026	2803091	InChI=1S/C14H14N2O2S/c1-18-13-4-2-3-11(9-13)16-14(19)15-10-5-7-12(17)8-6-10/h2-9,17H,1H3,(H2,15,16,19)	QMAJUXRVBPSIHG-UHFFFAOYSA-N	COc1cccc(NC(=S)Nc2ccc(O)cc2)c1	BroadT	BRD-K60015026	BRD-K60015026-001-05-9	National Cancer Institute Chemotherapeutic Agents Repository	201634			COc1cccc(NC(=S)Nc2ccc(O)cc2)c1	InChI=1S/C14H14N2O2S/c1-18-13-4-2-3-11(9-13)16-14(19)15-10-5-7-12(17)8-6-10/h2-9,17H,1H3,(H2,15,16,19)	QMAJUXRVBPSIHG-UHFFFAOYSA-N	274.077598398							109437
T0507-6805	LSM-20836	SID3714342, BRD-K44460174	2998763	InChI=1S/C8H8N4O2S/c1-12-8(9-10-11-12)15-5-6(13)7-3-2-4-14-7/h2-4H,5H2,1H3	KHUHQNPKJAKBBJ-UHFFFAOYSA-N	Cn1nnnc1SCC(=O)c2occc2	BroadT	BRD-K44460174	BRD-K44460174-001-05-8	Enamine Ltd.	T0506-8506			Cn1nnnc1SCC(=O)c1ccco1	InChI=1S/C8H8N4O2S/c1-12-8(9-10-11-12)15-5-6(13)7-3-2-4-14-7/h2-4H,5H2,1H3	KHUHQNPKJAKBBJ-UHFFFAOYSA-N	224.036796226							109438
MLS000097524	LSM-20837	SID3713715, BRD-A41381731	2772277	InChI=1S/C9H17NO3S/c11-14(12)5-3-8(7-14)10-6-9-2-1-4-13-9/h8-10H,1-7H2	FKPZYRCJJKDBAX-UHFFFAOYSA-N	O=S1(=O)CCC(C1)NCC2CCCO2	BroadT	BRD-A41381731	BRD-A41381731-001-05-7	Enamine Ltd.	T5224696			O=S1(=O)CCC(C1)NCC1CCCO1	InChI=1S/C9H17NO3S/c11-14(12)5-3-8(7-14)10-6-9-2-1-4-13-9/h8-10H,1-7H2	FKPZYRCJJKDBAX-UHFFFAOYSA-N	219.092914104							109439
AC1LM2EQ	LSM-15204	MMV396723, BRD-K32758139	1121234	InChI=1S/C22H24Cl2N4O/c23-17-9-8-16(14-18(17)24)21(29)15-28-20-7-3-2-6-19(20)27(22(28)25)13-12-26-10-4-1-5-11-26/h2-3,6-9,14,25H,1,4-5,10-13,15H2	GXFUZNHIKQMEJC-UHFFFAOYSA-N	Clc1ccc(cc1Cl)C(=O)CN2C(=N)N(CCN3CCCCC3)c4ccccc24	BroadT	BRD-K32758139	BRD-K32758139-004-04-0	InterBioScreen Ltd.	STOCK2S-08841		Br	Clc1ccc(cc1Cl)C(=O)Cn1c2ccccc2n(CCN2CCCCC2)c1=N.Br	InChI=1S/C22H24Cl2N4O.BrH/c23-17-9-8-16(14-18(17)24)21(29)15-28-20-7-3-2-6-19(20)27(22(28)25)13-12-26-10-4-1-5-11-26;/h2-3,6-9,14,25H,1,4-5,10-13,15H2;1H	JOHWJNITFKMFJL-UHFFFAOYSA-N	430.132716848							103853, 103853
5-Methyl-8-(tetrahydro-2-furanylmethyl)-7,8-dihydro-6H-pyrazolo[1,5-a]pyrrolo[3,2-e]pyrimidine-3-carbonitrile	LSM-20838	SID24817840, BRD-A71013443	2766108	InChI=1S/C15H17N5O/c1-10-13-4-5-19(9-12-3-2-6-21-12)15(13)20-14(18-10)11(7-16)8-17-20/h8,12H,2-6,9H2,1H3	FZZAQKDCPWTFHF-UHFFFAOYSA-N	Cc1nc2c(cnn2c3N(CC4CCCO4)CCc13)C#N	BroadT	BRD-A71013443	BRD-A71013443-001-05-8	Key Organics Ltd.	10T-0235			Cc1nc2c(cnn2c2N(CC3CCCO3)CCc12)C#N	InChI=1S/C15H17N5O/c1-10-13-4-5-19(9-12-3-2-6-21-12)15(13)20-14(18-10)11(7-16)8-17-20/h8,12H,2-6,9H2,1H3	FZZAQKDCPWTFHF-UHFFFAOYSA-N	283.143310214							109440
STK040580	LSM-20839	SID843989, BRD-K98296319	646295	InChI=1S/C15H11BrN2O/c1-10-4-2-3-5-13(10)15-18-17-14(19-15)11-6-8-12(16)9-7-11/h2-9H,1H3	BJDAQLQUKDJIGB-UHFFFAOYSA-N	Cc1ccccc1c2oc(nn2)c3ccc(Br)cc3	BroadT	BRD-K98296319	BRD-K98296319-001-05-7	Asinex Ltd.	BAS 00287572			Cc1ccccc1-c1nnc(o1)-c1ccc(Br)cc1	InChI=1S/C15H11BrN2O/c1-10-4-2-3-5-13(10)15-18-17-14(19-15)11-6-8-12(16)9-7-11/h2-9H,1H3	BJDAQLQUKDJIGB-UHFFFAOYSA-N	314.005475592							109441
MLS000911553	LSM-20840	SID26731952, BRD-K56181586	16746151	InChI=1S/C20H23ClN6/c1-27(2)10-4-9-22-19-8-7-15(13-23-19)18-12-20(25-14-24-18)26-17-6-3-5-16(21)11-17/h3,5-8,11-14H,4,9-10H2,1-2H3,(H,22,23)(H,24,25,26)	YDJIFKISSQNAIS-UHFFFAOYSA-N	CN(C)CCCNc1ccc(cn1)c2cc(Nc3cccc(Cl)c3)ncn2	BroadT	BRD-K56181586	BRD-K56181586-001-08-1	Dana Farber Cancer Institute	AMY001-037			CN(C)CCCNc1ccc(cn1)-c1cc(Nc2cccc(Cl)c2)ncn1	InChI=1S/C20H23ClN6/c1-27(2)10-4-9-22-19-8-7-15(13-23-19)18-12-20(25-14-24-18)26-17-6-3-5-16(21)11-17/h3,5-8,11-14H,4,9-10H2,1-2H3,(H,22,23)(H,24,25,26)	YDJIFKISSQNAIS-UHFFFAOYSA-N	382.167272506							109442
MLS000098923	LSM-43897	SID3716634, BRD-K25879375	2120108	InChI=1S/C12H11NO2S/c1-8-4-2-3-5-9(8)10(14)6-12-13-11(15)7-16-12/h2-6H,7H2,1H3,(H,13,15)/b12-6+	WIBUPYDOTYSKFW-WUXMJOGZSA-N	Cc1ccccc1C(=O)\C=C\2/NC(=O)CS2	BroadT	BRD-K25879375	BRD-K25879375-001-06-7	Enamine Ltd.	T5247578			Cc1ccccc1C(=O)\C=C1/NC(=O)CS1	InChI=1S/C12H11NO2S/c1-8-4-2-3-5-9(8)10(14)6-12-13-11(15)7-16-12/h2-6H,7H2,1H3,(H,13,15)/b12-6+	WIBUPYDOTYSKFW-WUXMJOGZSA-N	233.051049292							
UPCMLD04BGHW001081	LSM-20842	SID17384982, SID24708218, BRD-K61910461	3247351	InChI=1S/C29H29N3O3/c1-18-15-25(32-35-18)28(34)31-26(21-10-5-4-6-11-21)29(3)17-24(29)19(2)27(33)30-23-14-13-20-9-7-8-12-22(20)16-23/h4-16,19,24,26H,17H2,1-3H3,(H,30,33)(H,31,34)/t19-,24-,26-,29+/m1/s1	GEZMALYAXNUEJF-JUCUOUSCSA-N	C[C@H]([C@H]1C[C@]1(C)[C@H](NC(=O)c2cc(C)on2)c3ccccc3)C(=O)Nc4ccc5ccccc5c4	BroadT	BRD-K61910461	BRD-K61910461-001-06-0	University of Pittsburgh CMLD	UPCMLD04BGHW001081			C[C@H]([C@H]1C[C@]1(C)[C@H](NC(=O)c1cc(C)on1)c1ccccc1)C(=O)Nc1ccc2ccccc2c1	InChI=1S/C29H29N3O3/c1-18-15-25(32-35-18)28(34)31-26(21-10-5-4-6-11-21)29(3)17-24(29)19(2)27(33)30-23-14-13-20-9-7-8-12-22(20)16-23/h4-16,19,24,26H,17H2,1-3H3,(H,30,33)(H,31,34)/t19-,24-,26-,29+/m1/s1	GEZMALYAXNUEJF-JUCUOUSCSA-N	467.220891818							109444
SMR000032476	LSM-20843	SID4245907, SID51088692, BRD-A94055601	3240318	InChI=1S/C22H33N3O2/c26-21-17-20(18-25(21)16-11-19-9-4-3-5-10-19)22(27)23-12-8-15-24-13-6-1-2-7-14-24/h3-5,9-10,20H,1-2,6-8,11-18H2,(H,23,27)	KJILWBZUTQOJFA-UHFFFAOYSA-N	O=C(NCCCN1CCCCCC1)C2CN(CCc3ccccc3)C(=O)C2	BroadT	BRD-A94055601	BRD-A94055601-001-05-0	ChemDiv Inc.	K786-8594			O=C(NCCCN1CCCCCC1)C1CN(CCc2ccccc2)C(=O)C1	InChI=1S/C22H33N3O2/c26-21-17-20(18-25(21)16-11-19-9-4-3-5-10-19)22(27)23-12-8-15-24-13-6-1-2-7-14-24/h3-5,9-10,20H,1-2,6-8,11-18H2,(H,23,27)	KJILWBZUTQOJFA-UHFFFAOYSA-N	371.257277326							109445
ST50178937	LSM-20844	SID24824172, BRD-K62326950	4442467	InChI=1S/C14H14N4OS/c19-13(12-15-6-7-16-12)18-14-17-9-11(20-14)8-10-4-2-1-3-5-10/h1-5,9H,6-8H2,(H,15,16)(H,17,18,19)	MWBDLRSLPPAPFE-UHFFFAOYSA-N	O=C(Nc1ncc(Cc2ccccc2)s1)C3=NCCN3	BroadT	BRD-K62326950	BRD-K62326950-001-05-8	Life Chemicals Inc.	F1787-0363			O=C(Nc1ncc(Cc2ccccc2)s1)C1=NCCN1	InChI=1S/C14H14N4OS/c19-13(12-15-6-7-16-12)18-14-17-9-11(20-14)8-10-4-2-1-3-5-10/h1-5,9H,6-8H2,(H,15,16)(H,17,18,19)	MWBDLRSLPPAPFE-UHFFFAOYSA-N	286.088831798							109446
N-Benzothiazol-2-yl-n-methyl-benzamide	LSM-20845	SID844348, BRD-K73563981	646668	InChI=1S/C15H12N2OS/c1-17(14(18)11-7-3-2-4-8-11)15-16-12-9-5-6-10-13(12)19-15/h2-10H,1H3	HZIHROTYRLKEHQ-UHFFFAOYSA-N	CN(C(=O)c1ccccc1)c2nc3ccccc3s2	BroadT	BRD-K73563981	BRD-K73563981-001-06-4	Asinex Ltd.	BAS 00470410			CN(C(=O)c1ccccc1)c1nc2ccccc2s1	InChI=1S/C15H12N2OS/c1-17(14(18)11-7-3-2-4-8-11)15-16-12-9-5-6-10-13(12)19-15/h2-10H,1H3	HZIHROTYRLKEHQ-UHFFFAOYSA-N	268.067033714							109447
Methyl 3-[(methylsulfonyl)amino]benzoate	LSM-20846	SID26728593, BRD-K59137509	2806372	InChI=1S/C9H11NO4S/c1-14-9(11)7-4-3-5-8(6-7)10-15(2,12)13/h3-6,10H,1-2H3	UQIOKJVVJMHUTP-UHFFFAOYSA-N	COC(=O)c1cccc(NS(=O)(=O)C)c1	BroadT	BRD-K59137509	BRD-K59137509-001-05-0	Maybridge	DFP 00321			COC(=O)c1cccc(NS(C)(=O)=O)c1	InChI=1S/C9H11NO4S/c1-14-9(11)7-4-3-5-8(6-7)10-15(2,12)13/h3-6,10H,1-2H3	UQIOKJVVJMHUTP-UHFFFAOYSA-N	229.040878532							109448
MLS000830152	LSM-20847	SID26729157, BRD-K49953514	2809849	InChI=1S/C21H21F2N3O/c1-21(2,3)19-12-18(20(27)24-17-10-8-16(23)9-11-17)26(25-19)13-14-4-6-15(22)7-5-14/h4-12H,13H2,1-3H3,(H,24,27)	LATPUUXSVWSLNK-UHFFFAOYSA-N	CC(C)(C)c1cc(C(=O)Nc2ccc(F)cc2)n(Cc3ccc(F)cc3)n1	BroadT	BRD-K49953514	BRD-K49953514-001-06-4	Maybridge	HTS 00913			CC(C)(C)c1cc(C(=O)Nc2ccc(F)cc2)n(Cc2ccc(F)cc2)n1	InChI=1S/C21H21F2N3O/c1-21(2,3)19-12-18(20(27)24-17-10-8-16(23)9-11-17)26(25-19)13-14-4-6-15(22)7-5-14/h4-12H,13H2,1-3H3,(H,24,27)	LATPUUXSVWSLNK-UHFFFAOYSA-N	369.165268722							109449
MLS000775691	LSM-43898	SID24833072, BRD-K52712957	2454926	InChI=1S/C17H18N2O2S/c20-15-5-3-14(4-6-15)18-9-11-19(12-10-18)17(21)8-7-16-2-1-13-22-16/h1-8,13,20H,9-12H2/b8-7+	BFSPAPKTIGPYOV-BQYQJAHWSA-N	Oc1ccc(cc1)N2CCN(CC2)C(=O)\C=C\c3cccs3	BroadT	BRD-K52712957	BRD-K52712957-001-05-4	Enamine Ltd.	T0517-0824			Oc1ccc(cc1)N1CCN(CC1)C(=O)\C=C\c1cccs1	InChI=1S/C17H18N2O2S/c20-15-5-3-14(4-6-15)18-9-11-19(12-10-18)17(21)8-7-16-2-1-13-22-16/h1-8,13,20H,9-12H2/b8-7+	BFSPAPKTIGPYOV-BQYQJAHWSA-N	314.108898526							
T0509-6890	LSM-20849	SID22408629, BRD-K27314800	2363733	InChI=1S/C18H15NO3/c1-12-6-8-13(9-7-12)18(21)22-11-17(20)15-10-19-16-5-3-2-4-14(15)16/h2-10,19H,11H2,1H3	DIFBWLKLJKGVGQ-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)OCC(=O)c2c[nH]c3ccccc23	BroadT	BRD-K27314800	BRD-K27314800-001-06-8	Enamine Ltd.	T0509-6890			Cc1ccc(cc1)C(=O)OCC(=O)c1c[nH]c2ccccc12	InChI=1S/C18H15NO3/c1-12-6-8-13(9-7-12)18(21)22-11-17(20)15-10-19-16-5-3-2-4-14(15)16/h2-10,19H,11H2,1H3	DIFBWLKLJKGVGQ-UHFFFAOYSA-N	293.10519335							109451
UPCMLD02ASTW001174	LSM-20850	SID17385267, SID24708068, BRD-K38612098	3247242	InChI=1S/C33H36FN3O5/c1-41-17-16-36-27-18-24-21-37(30(38)23-8-4-3-5-9-23)33(32(40)42-2,20-22-10-12-25(34)13-11-22)29(24)26(27)19-28(36)31(39)35-14-6-7-15-35/h3-5,8-13,19,24,29H,6-7,14-18,20-21H2,1-2H3/t24-,29+,33+/m0/s1	KFRNSSKSYNGVQA-PICNGLBESA-N	COCCn1c2C[C@H]3CN(C(=O)c4ccccc4)[C@](Cc5ccc(F)cc5)([C@H]3c2cc1C(=O)N6CCCC6)C(=O)OC	BroadT	BRD-K38612098	BRD-K38612098-001-02-2	University of Pittsburgh CMLD	UPCMLD02ASTW001174			COCCn1c2C[C@H]3CN(C(=O)c4ccccc4)[C@@](Cc4ccc(F)cc4)(C(=O)OC)[C@H]3c2cc1C(=O)N1CCCC1	InChI=1S/C33H36FN3O5/c1-41-17-16-36-27-18-24-21-37(30(38)23-8-4-3-5-9-23)33(32(40)42-2,20-22-10-12-25(34)13-11-22)29(24)26(27)19-28(36)31(39)35-14-6-7-15-35/h3-5,8-13,19,24,29H,6-7,14-18,20-21H2,1-2H3/t24-,29+,33+/m0/s1	KFRNSSKSYNGVQA-PICNGLBESA-N	573.263899482							109452
1-(6-Methyl-2-pyridinyl)-n-(3-pyridinyl)-1H-imidazole-4-carboxamide	LSM-20851	SID17409510, BRD-K80587932	1491423	InChI=1S/C15H13N5O/c1-11-4-2-6-14(18-11)20-9-13(17-10-20)15(21)19-12-5-3-7-16-8-12/h2-10H,1H3,(H,19,21)	DNDXLTGZQWNZNF-UHFFFAOYSA-N	Cc1cccc(n1)n2cnc(c2)C(=O)Nc3cccnc3	BroadT	BRD-K80587932	BRD-K80587932-001-05-6	Key Organics Ltd.	1R-0804			Cc1cccc(n1)-n1cnc(c1)C(=O)Nc1cccnc1	InChI=1S/C15H13N5O/c1-11-4-2-6-14(18-11)20-9-13(17-10-20)15(21)19-12-5-3-7-16-8-12/h2-10H,1H3,(H,19,21)	DNDXLTGZQWNZNF-UHFFFAOYSA-N	279.112010086							109453
2,6-Di(1H-pyrazol-1-yl)pyrazine	LSM-20852	SID24818039, BRD-K74754846	1487780	InChI=1S/C10H8N6/c1-3-12-15(5-1)9-7-11-8-10(14-9)16-6-2-4-13-16/h1-8H	DRODYRLLEVCLTL-UHFFFAOYSA-N	c1cnn(c1)c2cncc(n2)n3cccn3	BroadT	BRD-K74754846	BRD-K74754846-001-05-5	Key Organics Ltd.	10W-0849			c1cnn(c1)-c1cncc(n1)-n1cccn1	InChI=1S/C10H8N6/c1-3-12-15(5-1)9-7-11-8-10(14-9)16-6-2-4-13-16/h1-8H	DRODYRLLEVCLTL-UHFFFAOYSA-N	212.081044316							131256
SMR000155138	LSM-20853	SID14744811, BRD-K48428632	2683296	InChI=1S/C19H24N2O3S/c1-5-21(6-2)25(23,24)18-9-7-8-16(13-18)19(22)20-17-11-14(3)10-15(4)12-17/h7-13H,5-6H2,1-4H3,(H,20,22)	NZVWJHIUNJGOPD-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)Nc2cc(C)cc(C)c2	BroadT	BRD-K48428632	BRD-K48428632-001-05-7	Enamine Ltd.	ZT-2187967			CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)Nc1cc(C)cc(C)c1	InChI=1S/C19H24N2O3S/c1-5-21(6-2)25(23,24)18-9-7-8-16(13-18)19(22)20-17-11-14(3)10-15(4)12-17/h7-13H,5-6H2,1-4H3,(H,20,22)	NZVWJHIUNJGOPD-UHFFFAOYSA-N	360.150763338							109456
MLS000561585	LSM-20854	SID17407181, BRD-K81627996	11958481	InChI=1S/C20H23ClN4O2S2/c1-4-5-6-7-17(26)25-20-22-12(2)18(29-20)15-11-28-19(24-15)23-14-10-13(21)8-9-16(14)27-3/h8-11H,4-7H2,1-3H3,(H,23,24)(H,22,25,26)	BQNJPPDEVRRACC-UHFFFAOYSA-N	CCCCCC(=O)Nc1nc(C)c(s1)c2csc(Nc3cc(Cl)ccc3OC)n2	BroadT	BRD-K81627996	BRD-K81627996-001-05-2	University of California at Davis	CLY_Corr_F09			CCCCCC(=O)Nc1nc(C)c(s1)-c1csc(Nc2cc(Cl)ccc2OC)n1	InChI=1S/C20H23ClN4O2S2/c1-4-5-6-7-17(26)25-20-22-12(2)18(29-20)15-11-28-19(24-15)23-14-10-13(21)8-9-16(14)27-3/h8-11H,4-7H2,1-3H3,(H,23,24)(H,22,25,26)	BQNJPPDEVRRACC-UHFFFAOYSA-N	450.095095106							109457
SMR000059980	LSM-15501	SID3715649, BRD-K99951485	2999300	InChI=1S/C20H29N3O/c1-20(2)14-17(13-19(15-20)23-8-10-24-11-9-23)21-16-6-5-7-18(12-16)22(3)4/h5-7,12-13H,8-11,14-15H2,1-4H3	NVKIURJVXMOXJA-UHFFFAOYSA-N	CN(C)c1cccc(c1)N=C2CC(C)(C)CC(=C2)N3CCOCC3	BroadT	BRD-K99951485	BRD-K99951485-005-05-5	Enamine Ltd.	T0500-6118		I	CN(C)c1cccc(c1)N=C1CC(C)(C)CC(=C1)N1CCOCC1.I	InChI=1S/C20H29N3O.HI/c1-20(2)14-17(13-19(15-20)23-8-10-24-11-9-23)21-16-6-5-7-18(12-16)22(3)4;/h5-7,12-13H,8-11,14-15H2,1-4H3;1H	YYMLTCSGZRYOSJ-UHFFFAOYSA-N	327.231062578							104142, 104142
AC1MRDYK	LSM-20855	SID26725886, BRD-A66343377	3516533	InChI=1S/C13H11FN4OS/c14-8-4-2-1-3-6(8)9-7(5-15)11(16)18-13(20)10(9)12(17)19/h1-4,9-10H,16H2,(H2,17,19)(H,18,20)	YAAPJKWMAGHGGK-UHFFFAOYSA-N	NC(=O)C1C(C(=C(N)N=C1S)C#N)c2ccccc2F	BroadT	BRD-A66343377	BRD-A66343377-001-06-4	InterBioScreen Ltd.	STOCK1S-28917			NC(=O)C1C(c2ccccc2F)C(C#N)=C(N)N=C1S	InChI=1S/C13H11FN4OS/c14-8-4-2-1-3-6(8)9-7(5-15)11(16)18-13(20)10(9)12(17)19/h1-4,9-10H,16H2,(H2,17,19)(H,18,20)	YAAPJKWMAGHGGK-UHFFFAOYSA-N	290.063759902							109458
ZINC00614702	LSM-20856	SID14736089, BRD-K50379498	973927	InChI=1S/C17H13N3O/c1-2-9-15-13(6-1)7-5-8-14(15)12-21-20-17-11-4-3-10-16(17)18-19-20/h1-11H,12H2	LABYLHDKTXLLHI-UHFFFAOYSA-N	C(On1nnc2ccccc12)c3cccc4ccccc34	BroadT	BRD-K50379498	BRD-K50379498-001-06-8	ChemBridge Corporation	7906233			C(On1nnc2ccccc12)c1cccc2ccccc12	InChI=1S/C17H13N3O/c1-2-9-15-13(6-1)7-5-8-14(15)12-21-20-17-11-4-3-10-16(17)18-19-20/h1-11H,12H2	LABYLHDKTXLLHI-UHFFFAOYSA-N	275.105862066							109459
MLS000581707	LSM-20857	SID17432184, BRD-K19030687	967267	InChI=1S/C13H11N3O3S/c1-9-5-6-14-13(15-9)20-8-12(17)10-3-2-4-11(7-10)16(18)19/h2-7H,8H2,1H3	YCTJDGGSVYNCHN-UHFFFAOYSA-N	Cc1ccnc(SCC(=O)c2cccc(c2)[N+](=O)[O-])n1	BroadT	BRD-K19030687	BRD-K19030687-001-06-8	ChemBridge Corporation	7916783			Cc1ccnc(SCC(=O)c2cccc(c2)[N+]([O-])=O)n1	InChI=1S/C13H11N3O3S/c1-9-5-6-14-13(15-9)20-8-12(17)10-3-2-4-11(7-10)16(18)19/h2-7H,8H2,1H3	YCTJDGGSVYNCHN-UHFFFAOYSA-N	289.052111932							109460
AC1O9WJ8	LSM-20858	SID24803001, BRD-K73143512	6738922	InChI=1S/C20H20N4O2/c1-4-12-9-13(17(26)10-16(12)25)19-18(11(2)22-23-19)20-21-14-7-5-6-8-15(14)24(20)3/h5-10,25-26H,4H2,1-3H3,(H,22,23)	APQCBAKMOBMKMP-UHFFFAOYSA-N	CCc1cc(c(O)cc1O)c2[nH]nc(C)c2c3nc4ccccc4n3C	BroadT	BRD-K73143512	BRD-K73143512-001-04-8	Asinex Ltd.	BAS 01057789			CCc1cc(-c2n[nH]c(C)c2-c2nc3ccccc3n2C)c(O)cc1O	InChI=1S/C20H20N4O2/c1-4-12-9-13(17(26)10-16(12)25)19-18(11(2)22-23-19)20-21-14-7-5-6-8-15(14)24(20)3/h5-10,25-26H,4H2,1-3H3,(H,22,23)	APQCBAKMOBMKMP-UHFFFAOYSA-N	348.15862592							
SMR000104063	LSM-20859	SID7972384, BRD-K34754397	725675	InChI=1S/C16H13NO3/c1-19-13-8-6-12(7-9-13)17-16(18)15-10-11-4-2-3-5-14(11)20-15/h2-10H,1H3,(H,17,18)	TXXUEJSPPYBINY-UHFFFAOYSA-N	COc1ccc(NC(=O)c2oc3ccccc3c2)cc1	BroadT	BRD-K34754397	BRD-K34754397-001-05-7	ChemBridge Corporation	5720499			COc1ccc(NC(=O)c2cc3ccccc3o2)cc1	InChI=1S/C16H13NO3/c1-19-13-8-6-12(7-9-13)17-16(18)15-10-11-4-2-3-5-14(11)20-15/h2-10H,1H3,(H,17,18)	TXXUEJSPPYBINY-UHFFFAOYSA-N	267.089543286							109462
BRD-K67118123	LSM-3495	SID85147382	73759147	InChI=1S/C18H19N3O2/c1-2-3-12-21-15-10-6-4-8-13(15)17(18(21)23)20-19-14-9-5-7-11-16(14)22/h4-11,22-23H,2-3,12H2,1H3	ROUWLSYGZNMXGO-UHFFFAOYSA-N	CCCCn1c(O)c(N=Nc2ccccc2O)c3ccccc13	BroadT	BRD-K67118123	BRD-K67118123-001-04-9	Sanford-Burnham Medical Research Institute	MLS-0106435.0004			CCCCn1c(O)c(N=Nc2ccccc2O)c2ccccc12	InChI=1S/C18H19N3O2/c1-2-3-12-21-15-10-6-4-8-13(15)17(18(21)23)20-19-14-9-5-7-11-16(14)22/h4-11,22-23H,2-3,12H2,1H3	ROUWLSYGZNMXGO-UHFFFAOYSA-N	309.147726878							
Benzyl-(2',4'-dimethyl-[4,5']bithiazolyl-2-yl)-amine	LSM-20860	SID852588, BRD-K79732458	655211	InChI=1S/C15H15N3S2/c1-10-14(20-11(2)17-10)13-9-19-15(18-13)16-8-12-6-4-3-5-7-12/h3-7,9H,8H2,1-2H3,(H,16,18)	NNJQVTFINZWWKM-UHFFFAOYSA-N	Cc1nc(C)c(s1)c2csc(NCc3ccccc3)n2	BroadT	BRD-K79732458	BRD-K79732458-001-05-5	Asinex Ltd.	BAS 08770551			Cc1nc(C)c(s1)-c1csc(NCc2ccccc2)n1	InChI=1S/C15H15N3S2/c1-10-14(20-11(2)17-10)13-9-19-15(18-13)16-8-12-6-4-3-5-7-12/h3-7,9H,8H2,1-2H3,(H,16,18)	NNJQVTFINZWWKM-UHFFFAOYSA-N	301.07073889							109463
2-(3-Methyl-2,4-dioxo-thiazolidin-5-ylamino)-benzoic acid	LSM-20861	SID851022, BRD-A81373721	653574	InChI=1S/C11H10N2O4S/c1-13-9(14)8(18-11(13)17)12-7-5-3-2-4-6(7)10(15)16/h2-5,8,12H,1H3,(H,15,16)	XVBCBEUDXRDOLG-UHFFFAOYSA-N	CN1C(=O)SC(Nc2ccccc2C(=O)O)C1=O	BroadT	BRD-A81373721	BRD-A81373721-001-05-7	Asinex Ltd.	BAS 07247891			CN1C(=O)SC(Nc2ccccc2C(O)=O)C1=O	InChI=1S/C11H10N2O4S/c1-13-9(14)8(18-11(13)17)12-7-5-3-2-4-6(7)10(15)16/h2-5,8,12H,1H3,(H,15,16)	XVBCBEUDXRDOLG-UHFFFAOYSA-N	266.03612751							109464
1-{2-[(4-Chlorophenoxy)methyl]-1,3-thiazol-4-yl}ethan-1-one	LSM-20862	SID26729672, BRD-K35578331	2744804	InChI=1S/C12H10ClNO2S/c1-8(15)11-7-17-12(14-11)6-16-10-4-2-9(13)3-5-10/h2-5,7H,6H2,1H3	BKMKHUOYYSYZRD-UHFFFAOYSA-N	CC(=O)c1csc(COc2ccc(Cl)cc2)n1	BroadT	BRD-K35578331	BRD-K35578331-001-05-8	Maybridge	SPB 03561			CC(=O)c1csc(COc2ccc(Cl)cc2)n1	InChI=1S/C12H10ClNO2S/c1-8(15)11-7-17-12(14-11)6-16-10-4-2-9(13)3-5-10/h2-5,7H,6H2,1H3	BKMKHUOYYSYZRD-UHFFFAOYSA-N	267.01207697							109465
AC1O9XR5	LSM-20863	SID4242635, BRD-K63613104	6740108	InChI=1S/C10H16N6O2/c1-18-10-13-8(7(11)15-17)12-9(14-10)16-5-3-2-4-6-16/h17H,2-6H2,1H3,(H2,11,15)	NGYYAZPHRXDUDE-UHFFFAOYSA-N	COc1nc(nc(n1)C(=N)NO)N2CCCCC2	BroadT	BRD-K63613104	BRD-K63613104-001-05-3	ChemDiv Inc.	8014-9262			COc1nc(nc(n1)C(=N)NO)N1CCCCC1	InChI=1S/C10H16N6O2/c1-18-10-13-8(7(11)15-17)12-9(14-10)16-5-3-2-4-6-16/h17H,2-6H2,1H3,(H2,11,15)	NGYYAZPHRXDUDE-UHFFFAOYSA-N	252.133473812							
ZINC00210497	LSM-20864	SID24788623, BRD-K23772856	755651	InChI=1S/C15H16N2O2/c18-14(11-7-3-1-4-8-11)15-16-12-9-5-2-6-10-13(12)17(15)19/h1,3-4,7-8,19H,2,5-6,9-10H2	MTUBOZOUYQCLOH-UHFFFAOYSA-N	On1c2CCCCCc2nc1C(=O)c3ccccc3	BroadT	BRD-K23772856	BRD-K23772856-001-05-6	ChemBridge Corporation	6486847			On1c(nc2CCCCCc12)C(=O)c1ccccc1	InChI=1S/C15H16N2O2/c18-14(11-7-3-1-4-8-11)15-16-12-9-5-2-6-10-13(12)17(15)19/h1,3-4,7-8,19H,2,5-6,9-10H2	MTUBOZOUYQCLOH-UHFFFAOYSA-N	256.121177772							109467
MLS000589409	LSM-20865	SID17505808, BRD-K62046989	3743865	InChI=1S/C16H22N4O3/c1-15(2,3)17-14-12(20(22)23)8-7-11-13(14)18-16(19(11)21)9-5-4-6-10-16/h7-8,17H,4-6,9-10H2,1-3H3	AFBAUCIRKZNOEI-UHFFFAOYSA-N	CC(C)(C)NC1=C(C=CC2=[N+]([O-])C3(CCCCC3)N=C12)[N+](=O)[O-]	BroadT	BRD-K62046989	BRD-K62046989-001-05-7	InterBioScreen Ltd.	STOCK1S-01501			CC(C)(C)Nc1c(ccc2=[N+]([O-])C3(CCCCC3)N=c12)[N+]([O-])=O	InChI=1S/C16H22N4O3/c1-15(2,3)17-14-12(20(22)23)8-7-11-13(14)18-16(19(11)21)9-5-4-6-10-16/h7-8,17H,4-6,9-10H2,1-3H3	AFBAUCIRKZNOEI-UHFFFAOYSA-N	318.169190604							
AC1MY09Z	LSM-20866	BRD-K33245893	3798859	InChI=1S/C15H13N3O2/c1-11-2-4-13(5-3-11)17-18-14(10-19)15(20)12-6-8-16-9-7-12/h2-10,17H,1H3	JSSCFAOMJYSWJY-UHFFFAOYSA-N	Cc1ccc(NN=C(C=O)C(=O)c2ccncc2)cc1	BroadT	BRD-K33245893	BRD-K33245893-001-05-6	Key Organics Ltd.	3M-008			Cc1ccc(NN=C(C=O)C(=O)c2ccncc2)cc1	InChI=1S/C15H13N3O2/c1-11-2-4-13(5-3-11)17-18-14(10-19)15(20)12-6-8-16-9-7-12/h2-10,17H,1H3	JSSCFAOMJYSWJY-UHFFFAOYSA-N	267.100776686							109469
CID 85032906	LSM-20867	BRD-A40973878	85032906	InChI=1S/C23H26BrNO6/c1-12(2)28-7-8-29-23(27)20-13(3)25-16-5-4-6-17(26)22(16)21(20)14-9-18-19(10-15(14)24)31-11-30-18/h9-10,12,20-21H,4-8,11H2,1-3H3	JRMZBLUWBUFZGG-UHFFFAOYSA-N	CC(C)OCCOC(=O)C1C(C2=C(CCCC2=O)N=C1C)c3cc4OCOc4cc3Br	BroadT	BRD-A40973878	BRD-A40973878-001-05-5	Asinex Ltd.	BAS 02841848			CC(C)OCCOC(=O)C1C(c2cc3OCOc3cc2Br)C2=C(CCCC2=O)N=C1C	InChI=1S/C23H26BrNO6/c1-12(2)28-7-8-29-23(27)20-13(3)25-16-5-4-6-17(26)22(16)21(20)14-9-18-19(10-15(14)24)31-11-30-18/h9-10,12,20-21H,4-8,11H2,1-3H3	JRMZBLUWBUFZGG-UHFFFAOYSA-N	491.094350162							109470
AH-262/34795013	LSM-20868	SID22414080, BRD-K12957200	900072	InChI=1S/C13H16N2O2/c16-13(17)11-8-4-5-9-12(11)15-14-10-6-2-1-3-7-10/h4-5,8-9,15H,1-3,6-7H2,(H,16,17)	WPTNECWJEHGCKG-UHFFFAOYSA-N	OC(=O)c1ccccc1NN=C2CCCCC2	BroadT	BRD-K12957200	BRD-K12957200-001-05-9	Specs	AH-262/34795013			OC(=O)c1ccccc1NN=C1CCCCC1	InChI=1S/C13H16N2O2/c16-13(17)11-8-4-5-9-12(11)15-14-10-6-2-1-3-7-10/h4-5,8-9,15H,1-3,6-7H2,(H,16,17)	WPTNECWJEHGCKG-UHFFFAOYSA-N	232.121177772							109471
MLS000087006	LSM-20869	SID4250624, BRD-K40295826	3244410	InChI=1S/C15H11ClN2O3/c16-11-5-3-10(4-6-11)14-8-13(18-21-14)15(19)17-9-12-2-1-7-20-12/h1-8H,9H2,(H,17,19)	WOGSIOPIATXPQR-UHFFFAOYSA-N	Clc1ccc(cc1)c2onc(c2)C(=O)NCc3occc3	BroadT	BRD-K40295826	BRD-K40295826-001-05-4	ChemDiv Inc.	C226-0345			Clc1ccc(cc1)-c1cc(no1)C(=O)NCc1ccco1	InChI=1S/C15H11ClN2O3/c16-11-5-3-10(4-6-11)14-8-13(18-21-14)15(19)17-9-12-2-1-7-20-12/h1-8H,9H2,(H,17,19)	WOGSIOPIATXPQR-UHFFFAOYSA-N	302.045819942							109472
SMR000017262	LSM-20870	SID26669654, SID7970603, BRD-A24067767	4205296	InChI=1S/C22H28N4O6S/c1-12-23-22-26(24-12)20(27)19(33-22)17(25-8-6-13(7-9-25)21(28)32-5)14-10-15(29-2)18(31-4)16(11-14)30-3/h10-11,13,17,27H,6-9H2,1-5H3	UJLJXZUPIYSLTG-UHFFFAOYSA-N	COC(=O)C1CCN(CC1)C(c2cc(OC)c(OC)c(OC)c2)c3sc4nc(C)nn4c3O	BroadT	BRD-A24067767	BRD-A24067767-001-04-3	Life Chemicals Inc.	F0631-0366			COC(=O)C1CCN(CC1)C(c1sc2nc(C)nn2c1O)c1cc(OC)c(OC)c(OC)c1	InChI=1S/C22H28N4O6S/c1-12-23-22-26(24-12)20(27)19(33-22)17(25-8-6-13(7-9-25)21(28)32-5)14-10-15(29-2)18(31-4)16(11-14)30-3/h10-11,13,17,27H,6-9H2,1-5H3	UJLJXZUPIYSLTG-UHFFFAOYSA-N	476.172955346							109473
MLS001249995	LSM-20871	SID49824539, BRD-K60060103	24818812	InChI=1S/C20H22N2O3/c23-20-16-4-1-2-5-18(16)25-19-7-6-15(14-17(19)20)21-8-3-9-22-10-12-24-13-11-22/h1-2,4-7,14,21H,3,8-13H2	MXYRASMCXVZAHG-UHFFFAOYSA-N	O=C1c2ccccc2Oc3ccc(NCCCN4CCOCC4)cc13	BroadT	BRD-K60060103	BRD-K60060103-001-07-7	Iowa State University	ISUPSL100175			O=c1c2ccccc2oc2ccc(NCCCN3CCOCC3)cc12	InChI=1S/C20H22N2O3/c23-20-16-4-1-2-5-18(16)25-19-7-6-15(14-17(19)20)21-8-3-9-22-10-12-24-13-11-22/h1-2,4-7,14,21H,3,8-13H2	MXYRASMCXVZAHG-UHFFFAOYSA-N	338.163042584							109474
MLS000374351	LSM-20872	SID22409857, BRD-K08498681	6011912	InChI=1S/C19H17N3O3S/c1-14-2-12-19(13-3-14)26(24,25)22-17-6-4-15(5-7-17)20-21-16-8-10-18(23)11-9-16/h2-13,22-23H,1H3	HYRBPEPJMDRFKR-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)Nc2ccc(cc2)N=Nc3ccc(O)cc3	BroadT	BRD-K08498681	BRD-K08498681-001-05-8	Enamine Ltd.	T0502-4460			Cc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)N=Nc1ccc(O)cc1	InChI=1S/C19H17N3O3S/c1-14-2-12-19(13-3-14)26(24,25)22-17-6-4-15(5-7-17)20-21-16-8-10-18(23)11-9-16/h2-13,22-23H,1H3	HYRBPEPJMDRFKR-UHFFFAOYSA-N	367.099062124							
MLS000589410	LSM-20873	SID17503793, BRD-K60465723	3644772	InChI=1S/C16H22N4O3/c1-2-3-11-17-14-13(20(22)23)8-7-12-15(14)18-16(19(12)21)9-5-4-6-10-16/h7-8,17H,2-6,9-11H2,1H3	RTYCQFJBUAKOHH-UHFFFAOYSA-N	CCCCNC1=C(C=CC2=[N+]([O-])C3(CCCCC3)N=C12)[N+](=O)[O-]	BroadT	BRD-K60465723	BRD-K60465723-001-05-2	InterBioScreen Ltd.	STOCK1S-07070			CCCCNc1c(ccc2=[N+]([O-])C3(CCCCC3)N=c12)[N+]([O-])=O	InChI=1S/C16H22N4O3/c1-2-3-11-17-14-13(20(22)23)8-7-12-15(14)18-16(19(12)21)9-5-4-6-10-16/h7-8,17H,2-6,9-11H2,1H3	RTYCQFJBUAKOHH-UHFFFAOYSA-N	318.169190604							
Azaribine	LSM-20874	Azaribine, Triazure, CB-304	16574	InChI=1S/C14H17N3O9/c1-6(18)23-5-9-11(24-7(2)19)12(25-8(3)20)13(26-9)17-14(22)16-10(21)4-15-17/h4,9,11-13H,5H2,1-3H3,(H,16,21,22)/t9-,11-,12-,13-/m1/s1	QQOBRRFOVWGIMD-OJAKKHQRSA-N	CC(=O)OC[C@H]1O[C@H]([C@H](OC(=O)C)[C@@H]1OC(=O)C)N2N=CC(=O)NC2=O	BroadT	BRD-K58885221	BRD-K58885221-001-10-2	Sigma-Aldrich	115185			CC(=O)OC[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H]1OC(C)=O)n1ncc(=O)[nH]c1=O	InChI=1S/C14H17N3O9/c1-6(18)23-5-9-11(24-7(2)19)12(25-8(3)20)13(26-9)17-14(22)16-10(21)4-15-17/h4,9,11-13H,5H2,1-3H3,(H,16,21,22)/t9-,11-,12-,13-/m1/s1	QQOBRRFOVWGIMD-OJAKKHQRSA-N	371.096479154							88272
Ethyl [2-(4-fluorophenyl)hydrazinyl](oxo)acetate	LSM-20875	SID26726144, BRD-K45510231	1922102	InChI=1S/C10H11FN2O3/c1-2-16-10(15)9(14)13-12-8-5-3-7(11)4-6-8/h3-6,12H,2H2,1H3,(H,13,14)	QSWJAPATSOQZQJ-UHFFFAOYSA-N	CCOC(=O)C(=O)NNc1ccc(F)cc1	BroadT	BRD-K45510231	BRD-K45510231-001-05-0	InterBioScreen Ltd.	STOCK2S-47363			CCOC(=O)C(=O)NNc1ccc(F)cc1	InChI=1S/C10H11FN2O3/c1-2-16-10(15)9(14)13-12-8-5-3-7(11)4-6-8/h3-6,12H,2H2,1H3,(H,13,14)	QSWJAPATSOQZQJ-UHFFFAOYSA-N	226.075370432							109477
2-Amino-5-ethyl-4-(2-furyl)-6-propylnicotinonitrile	LSM-20876	SID4256607, BRD-K02211353	748950	InChI=1S/C15H17N3O/c1-3-6-12-10(4-2)14(13-7-5-8-19-13)11(9-16)15(17)18-12/h5,7-8H,3-4,6H2,1-2H3,(H2,17,18)	IIGDYRITGCHENR-UHFFFAOYSA-N	CCCc1nc(N)c(C#N)c(c1CC)c2occc2	BroadT	BRD-K02211353	BRD-K02211353-001-05-8	ChemBridge Corporation	5403723			CCCc1nc(N)c(C#N)c(-c2ccco2)c1CC	InChI=1S/C15H17N3O/c1-3-6-12-10(4-2)14(13-7-5-8-19-13)11(9-16)15(17)18-12/h5,7-8H,3-4,6H2,1-2H3,(H2,17,18)	IIGDYRITGCHENR-UHFFFAOYSA-N	255.137162194							109478
3-Acetyl-1-(phenylsulfonyl)pyrrole	LSM-20877	SID22415014, BRD-K77754458	555792	InChI=1S/C12H11NO3S/c1-10(14)11-7-8-13(9-11)17(15,16)12-5-3-2-4-6-12/h2-9H,1H3	HTMLKRFQINMFRA-UHFFFAOYSA-N	CC(=O)c1ccn(c1)S(=O)(=O)c2ccccc2	BroadT	BRD-K77754458	BRD-K77754458-001-06-9	Specs	AN-329/41189535			CC(=O)c1ccn(c1)S(=O)(=O)c1ccccc1	InChI=1S/C12H11NO3S/c1-10(14)11-7-8-13(9-11)17(15,16)12-5-3-2-4-6-12/h2-9H,1H3	HTMLKRFQINMFRA-UHFFFAOYSA-N	249.045963912							109479
ST50018011	LSM-20878	SID26667974, SID852463, BRD-A03549855	655084	InChI=1S/C22H16F4N4O2/c1-12-4-5-13-9-14(23)6-7-17(13)29(12)21(31)16-11-20-27-15(18-3-2-8-32-18)10-19(22(24,25)26)30(20)28-16/h2-3,6-12H,4-5H2,1H3	OOQHCHRXDFMUNN-UHFFFAOYSA-N	CC1CCc2cc(F)ccc2N1C(=O)c3cc4nc(cc(n4n3)C(F)(F)F)c5occc5	BroadT	BRD-A03549855	BRD-A03549855-001-05-5	Asinex Ltd.	BAS 03612043			CC1CCc2cc(F)ccc2N1C(=O)c1cc2nc(cc(n2n1)C(F)(F)F)-c1ccco1	InChI=1S/C22H16F4N4O2/c1-12-4-5-13-9-14(23)6-7-17(13)29(12)21(31)16-11-20-27-15(18-3-2-8-32-18)10-19(22(24,25)26)30(20)28-16/h2-3,6-12H,4-5H2,1H3	OOQHCHRXDFMUNN-UHFFFAOYSA-N	444.120938592							109480
AC1LUIH6	LSM-43899	BRD-K99110478	1607780	InChI=1S/C16H14N4O2S/c23-16-19-18-15(12-22-14-6-2-1-3-7-14)20(16)17-10-4-8-13-9-5-11-21-13/h1-11H,12H2,(H,19,23)/b8-4+,17-10?	VXVVMRDWWQCBQD-LMGJMYKPSA-N	Sc1nnc(COc2ccccc2)n1N=C\C=C\c3occc3	BroadT	BRD-K99110478	BRD-K99110478-001-05-6	InterBioScreen Ltd.	STOCK3S-00775			Sc1nnc(COc2ccccc2)n1N=C\C=C\c1ccco1	InChI=1S/C16H14N4O2S/c23-16-19-18-15(12-22-14-6-2-1-3-7-14)20(16)17-10-4-8-13-9-5-11-21-13/h1-11H,12H2,(H,19,23)/b8-4+,17-10?	VXVVMRDWWQCBQD-LMGJMYKPSA-N	326.083746418							
BAS 08859627	LSM-20880	SID17508904, BRD-A59790839	3157742	InChI=1S/C15H18N4OS/c1-4-9-19-13(17-18-15(19)21)11(3)16-14(20)12-8-6-5-7-10(12)2/h4-8,11H,1,9H2,2-3H3,(H,16,20)(H,18,21)	WUGYVZWSONIFTP-UHFFFAOYSA-N	CC(NC(=O)c1ccccc1C)c2nnc(S)n2CC=C	BroadT	BRD-A59790839	BRD-A59790839-001-05-9	Asinex Ltd.	BAS 08859627			CC(NC(=O)c1ccccc1C)c1nnc(S)n1CC=C	InChI=1S/C15H18N4OS/c1-4-9-19-13(17-18-15(19)21)11(3)16-14(20)12-8-6-5-7-10(12)2/h4-8,11H,1,9H2,2-3H3,(H,16,20)(H,18,21)	WUGYVZWSONIFTP-UHFFFAOYSA-N	302.120131926							109482
MLS000035819	LSM-20881	SID845450, BRD-A79962154	647801	InChI=1S/C17H33N3O4/c1-8-11(4)13(20-16(23)24-17(5,6)7)15(22)19-12(14(18)21)9-10(2)3/h10-13H,8-9H2,1-7H3,(H2,18,21)(H,19,22)(H,20,23)	LYALUJDOJBFGIU-UHFFFAOYSA-N	CCC(C)C(NC(=O)OC(C)(C)C)C(=O)NC(CC(C)C)C(=O)N	BroadT	BRD-A79962154	BRD-A79962154-001-05-7	Asinex Ltd.	BAS 00470249			CCC(C)C(NC(=O)OC(C)(C)C)C(=O)NC(CC(C)C)C(N)=O	InChI=1S/C17H33N3O4/c1-8-11(4)13(20-16(23)24-17(5,6)7)15(22)19-12(14(18)21)9-10(2)3/h10-13H,8-9H2,1-7H3,(H2,18,21)(H,19,22)(H,20,23)	LYALUJDOJBFGIU-UHFFFAOYSA-N	343.247106566							109483
T5423974	LSM-20882	SID3715926, BRD-A05166186	2999402	InChI=1S/C16H19N3O4/c1-16(12-5-3-2-4-6-12)14(21)19(15(22)17-16)11-13(20)18-7-9-23-10-8-18/h2-6H,7-11H2,1H3,(H,17,22)	DYJAIDXXLDHNLI-UHFFFAOYSA-N	CC1(NC(=O)N(CC(=O)N2CCOCC2)C1=O)c3ccccc3	BroadT	BRD-A05166186	BRD-A05166186-001-05-6	Enamine Ltd.	ZT-1835998			CC1(NC(=O)N(CC(=O)N2CCOCC2)C1=O)c1ccccc1	InChI=1S/C16H19N3O4/c1-16(12-5-3-2-4-6-12)14(21)19(15(22)17-16)11-13(20)18-7-9-23-10-8-18/h2-6H,7-11H2,1H3,(H,17,22)	DYJAIDXXLDHNLI-UHFFFAOYSA-N	317.137556118							109484
5-(4-Fluoro-phenyl)-3-furan-2-yl-1-phenyl-4,5-dihydro-1H-pyrazole	LSM-20883	SID17403500, BRD-A19953985	3119020	InChI=1S/C19H15FN2O/c20-15-10-8-14(9-11-15)18-13-17(19-7-4-12-23-19)21-22(18)16-5-2-1-3-6-16/h1-12,18H,13H2	QVGADSAEXXGQMO-UHFFFAOYSA-N	Fc1ccc(cc1)C2CC(=NN2c3ccccc3)c4occc4	BroadT	BRD-A19953985	BRD-A19953985-001-05-4	Asinex Ltd.	BAS 00793865			Fc1ccc(cc1)C1CC(=NN1c1ccccc1)c1ccco1	InChI=1S/C19H15FN2O/c20-15-10-8-14(9-11-15)18-13-17(19-7-4-12-23-19)21-22(18)16-5-2-1-3-6-16/h1-12,18H,13H2	QVGADSAEXXGQMO-UHFFFAOYSA-N	306.11684132							109485
T5318311	LSM-20884	SID22408788, BRD-K62066459	4431967	InChI=1S/C17H11FN4O2S2/c18-12-7-3-4-8-13(12)19-16-20-21-17(26-16)25-9-22-14(23)10-5-1-2-6-11(10)15(22)24/h1-8H,9H2,(H,19,20)	QIKOKQUHAPKEDH-UHFFFAOYSA-N	Fc1ccccc1Nc2nnc(SCN3C(=O)c4ccccc4C3=O)s2	BroadT	BRD-K62066459	BRD-K62066459-001-05-6	Enamine Ltd.	T5318311			Fc1ccccc1Nc1nnc(SCN2C(=O)c3ccccc3C2=O)s1	InChI=1S/C17H11FN4O2S2/c18-12-7-3-4-8-13(12)19-16-20-21-17(26-16)25-9-22-14(23)10-5-1-2-6-11(10)15(22)24/h1-8H,9H2,(H,19,20)	QIKOKQUHAPKEDH-UHFFFAOYSA-N	386.030745212							109486
AC1LZ98B	LSM-20885	BRD-K72043775	1944947	InChI=1S/C20H16BrN3O4/c1-2-27-20(26)14-5-3-13(4-6-14)18-8-7-17(28-18)12-23-24-19(25)15-9-16(21)11-22-10-15/h3-12H,2H2,1H3,(H,24,25)	JBZPKMIVMICUKG-UHFFFAOYSA-N	CCOC(=O)c1ccc(cc1)c2oc(C=NNC(=O)c3cncc(Br)c3)cc2	BroadT	BRD-K72043775	BRD-K72043775-001-05-0	InterBioScreen Ltd.	STOCK2S-91306			CCOC(=O)c1ccc(cc1)-c1ccc(C=NNC(=O)c2cncc(Br)c2)o1	InChI=1S/C20H16BrN3O4/c1-2-27-20(26)14-5-3-13(4-6-14)18-8-7-17(28-18)12-23-24-19(25)15-9-16(21)11-22-10-15/h3-12H,2H2,1H3,(H,24,25)	JBZPKMIVMICUKG-UHFFFAOYSA-N	441.032418622							109487
SMR000096754	LSM-20886	SID7964657, BRD-A53163627	5307153	InChI=1S/C13H21N3O2/c1-10-3-4-12-11(7-10)8-16(15-12)9-13(17)14-5-6-18-2/h8,10H,3-7,9H2,1-2H3,(H,14,17)	JTTYACLKNABFSJ-UHFFFAOYSA-N	COCCNC(=O)Cn1cc2CC(C)CCc2n1	BroadT	BRD-A53163627	BRD-A53163627-001-04-4	ChemDiv Inc.	C881-0728			COCCNC(=O)Cn1cc2CC(C)CCc2n1	InChI=1S/C13H21N3O2/c1-10-3-4-12-11(7-10)8-16(15-12)9-13(17)14-5-6-18-2/h8,10H,3-7,9H2,1-2H3,(H,14,17)	JTTYACLKNABFSJ-UHFFFAOYSA-N	251.163376942							109488
MLS000107811	LSM-20887	SID7976974, BRD-K54500304	1100808	InChI=1S/C20H15F3N4O3/c1-29-13-6-4-12(5-7-13)15-9-17(20(21,22)23)27-18(25-15)10-16(26-27)19(28)24-11-14-3-2-8-30-14/h2-10H,11H2,1H3,(H,24,28)	KBGGOKIGTSIMGV-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(n3nc(cc3n2)C(=O)NCc4occc4)C(F)(F)F	BroadT	BRD-K54500304	BRD-K54500304-001-05-1	ChemBridge Corporation	5672379			COc1ccc(cc1)-c1cc(n2nc(cc2n1)C(=O)NCc1ccco1)C(F)(F)F	InChI=1S/C20H15F3N4O3/c1-29-13-6-4-12(5-7-13)15-9-17(20(21,22)23)27-18(25-15)10-16(26-27)19(28)24-11-14-3-2-8-30-14/h2-10H,11H2,1H3,(H,24,28)	KBGGOKIGTSIMGV-UHFFFAOYSA-N	416.10962498							109489
STK377262	LSM-20888	BRD-K28664021	1377933	InChI=1S/C22H21ClN2O2/c1-16-2-3-17(23)14-21(16)22-9-8-20(27-22)15-24-18-4-6-19(7-5-18)25-10-12-26-13-11-25/h2-9,14-15H,10-13H2,1H3	SCIAMNQLJKDEMQ-UHFFFAOYSA-N	Cc1ccc(Cl)cc1c2oc(C=Nc3ccc(cc3)N4CCOCC4)cc2	BroadT	BRD-K28664021	BRD-K28664021-001-05-0	ChemBridge Corporation	5305430			Cc1ccc(Cl)cc1-c1ccc(C=Nc2ccc(cc2)N2CCOCC2)o1	InChI=1S/C22H21ClN2O2/c1-16-2-3-17(23)14-21(16)22-9-8-20(27-22)15-24-18-4-6-19(7-5-18)25-10-12-26-13-11-25/h2-9,14-15H,10-13H2,1H3	SCIAMNQLJKDEMQ-UHFFFAOYSA-N	380.129155642							109490
AC1MVHVX	LSM-20889	SID14741091, BRD-A26225199	3708096	InChI=1S/C18H19NO2/c1-12-6-13(2)8-15(7-12)19-16-9-14(10-17(20)11-16)18-4-3-5-21-18/h3-8,11,14,19H,9-10H2,1-2H3	GOTWOIBOGABBNR-UHFFFAOYSA-N	Cc1cc(C)cc(NC2=CC(=O)CC(C2)c3occc3)c1	BroadT	BRD-A26225199	BRD-A26225199-001-05-0	InterBioScreen Ltd.	STOCK3S-64888			Cc1cc(C)cc(NC2=CC(=O)CC(C2)c2ccco2)c1	InChI=1S/C18H19NO2/c1-12-6-13(2)8-15(7-12)19-16-9-14(10-17(20)11-16)18-4-3-5-21-18/h3-8,11,14,19H,9-10H2,1-2H3	GOTWOIBOGABBNR-UHFFFAOYSA-N	281.141578858							109491
SMR000630953	LSM-20890	SID49719454, BRD-K06582489	20946715	InChI=1S/C23H28N4O4S/c1-4-16-8-10-17(11-9-16)32(30,31)24-18-14-20-21(26(3)23(29)22(28)25(20)2)15-19(18)27-12-6-5-7-13-27/h8-11,14-15,24H,4-7,12-13H2,1-3H3	GBRAGAORDLUKBI-UHFFFAOYSA-N	CCc1ccc(cc1)S(=O)(=O)Nc2cc3N(C)C(=O)C(=O)N(C)c3cc2N4CCCCC4	BroadT	BRD-K06582489	BRD-K06582489-001-05-5	ChemDiv Inc.	G266-0209			CCc1ccc(cc1)S(=O)(=O)Nc1cc2n(C)c(=O)c(=O)n(C)c2cc1N1CCCCC1	InChI=1S/C23H28N4O4S/c1-4-16-8-10-17(11-9-16)32(30,31)24-18-14-20-21(26(3)23(29)22(28)25(20)2)15-19(18)27-12-6-5-7-13-27/h8-11,14-15,24H,4-7,12-13H2,1-3H3	GBRAGAORDLUKBI-UHFFFAOYSA-N	456.183126106							109492
SMR000003775	LSM-20891	SID843633, BRD-K34380566	645930	InChI=1S/C18H23N5O3S/c1-2-26-17(25)14-10-6-7-11-15(14)19-16(24)12-27-18-20-21-22-23(18)13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9,12H2,1H3,(H,19,24)	VUFMASCGMANIAG-UHFFFAOYSA-N	CCOC(=O)c1ccccc1NC(=O)CSc2nnnn2C3CCCCC3	BroadT	BRD-K34380566	BRD-K34380566-001-05-6	Asinex Ltd.	ASN 04891384			CCOC(=O)c1ccccc1NC(=O)CSc1nnnn1C1CCCCC1	InChI=1S/C18H23N5O3S/c1-2-26-17(25)14-10-6-7-11-15(14)19-16(24)12-27-18-20-21-22-23(18)13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9,12H2,1H3,(H,19,24)	VUFMASCGMANIAG-UHFFFAOYSA-N	389.152160336							109493
AC1LD0RU	LSM-20892	SID858033, BRD-A34915942	659390	InChI=1S/C13H21NOS2/c1-12(2)9-13(5-7-17-12)4-3-6-14-10(15)8-16-11(13)14/h11H,3-9H2,1-2H3	SVIFFIZIVQFEFR-UHFFFAOYSA-N	CC1(C)CC2(CCCN3C2SCC3=O)CCS1	BroadT	BRD-A34915942	BRD-A34915942-001-05-6	InterBioScreen Ltd.	STOCK2S-14078			CC1(C)CC2(CCCN3C2SCC3=O)CCS1	InChI=1S/C13H21NOS2/c1-12(2)9-13(5-7-17-12)4-3-6-14-10(15)8-16-11(13)14/h11H,3-9H2,1-2H3	SVIFFIZIVQFEFR-UHFFFAOYSA-N	271.106455682							109494
F0666-1531	LSM-20893	SID4247589, BRD-K25135854	3241781	InChI=1S/C19H17NO5/c1-3-24-19(22)17-16(14-9-4-5-10-15(14)25-17)20-18(21)12-7-6-8-13(11-12)23-2/h4-11H,3H2,1-2H3,(H,20,21)	XEFIJHMTCVALFO-UHFFFAOYSA-N	CCOC(=O)c1oc2ccccc2c1NC(=O)c3cccc(OC)c3	BroadT	BRD-K25135854	BRD-K25135854-001-05-6	ChemDiv Inc.	C686-1428			CCOC(=O)c1oc2ccccc2c1NC(=O)c1cccc(OC)c1	InChI=1S/C19H17NO5/c1-3-24-19(22)17-16(14-9-4-5-10-15(14)25-17)20-18(21)12-7-6-8-13(11-12)23-2/h4-11H,3H2,1-2H3,(H,20,21)	XEFIJHMTCVALFO-UHFFFAOYSA-N	339.110672654							109495
6-Methoxy-2-oxo-2H-chromene-3-carboxylic acid (pyridin-3-ylmethyl)-amide	LSM-20894	SID14726395, BRD-K18435680	712609	InChI=1S/C17H14N2O4/c1-22-13-4-5-15-12(7-13)8-14(17(21)23-15)16(20)19-10-11-3-2-6-18-9-11/h2-9H,10H2,1H3,(H,19,20)	BQQOIHBDAZKFTO-UHFFFAOYSA-N	COc1ccc2OC(=O)C(=Cc2c1)C(=O)NCc3cccnc3	BroadT	BRD-K18435680	BRD-K18435680-001-05-9	Asinex Ltd.	BAS 03391154			COc1ccc2oc(=O)c(cc2c1)C(=O)NCc1cccnc1	InChI=1S/C17H14N2O4/c1-22-13-4-5-15-12(7-13)8-14(17(21)23-15)16(20)19-10-11-3-2-6-18-9-11/h2-9H,10H2,1H3,(H,19,20)	BQQOIHBDAZKFTO-UHFFFAOYSA-N	310.095356948							109496
MLS000030531	LSM-20895	SID856778, BRD-A59973262	658134	InChI=1S/C19H24N2O4S/c1-2-25-19(24)14-11-8-9-12-13(15(11)26-16(14)20)18(23)21(17(12)22)10-6-4-3-5-7-10/h10,12-13H,2-9,20H2,1H3	IQOIFVALVZGMDY-UHFFFAOYSA-N	CCOC(=O)c1c(N)sc2C3C(CCc12)C(=O)N(C4CCCCC4)C3=O	BroadT	BRD-A59973262	BRD-A59973262-001-05-7	InterBioScreen Ltd.	STOCK1S-31055			CCOC(=O)c1c(N)sc2C3C(CCc12)C(=O)N(C1CCCCC1)C3=O	InChI=1S/C19H24N2O4S/c1-2-25-19(24)14-11-8-9-12-13(15(11)26-16(14)20)18(23)21(17(12)22)10-6-4-3-5-7-10/h10,12-13H,2-9,20H2,1H3	IQOIFVALVZGMDY-UHFFFAOYSA-N	376.145677958							109497
AC1M77FJ	LSM-20896	SID14744751, BRD-K81628216	2412560	InChI=1S/C18H16N2O4/c1-12-8-18(22)24-16-9-14(5-6-15(12)16)23-11-17(21)20-10-13-4-2-3-7-19-13/h2-9H,10-11H2,1H3,(H,20,21)	LBCYLKQMVUMYRW-UHFFFAOYSA-N	CC1=CC(=O)Oc2cc(OCC(=O)NCc3ccccn3)ccc12	BroadT	BRD-K81628216	BRD-K81628216-001-05-4	Enamine Ltd.	T5211136			Cc1cc(=O)oc2cc(OCC(=O)NCc3ccccn3)ccc12	InChI=1S/C18H16N2O4/c1-12-8-18(22)24-16-9-14(5-6-15(12)16)23-11-17(21)20-10-13-4-2-3-7-19-13/h2-9H,10-11H2,1H3,(H,20,21)	LBCYLKQMVUMYRW-UHFFFAOYSA-N	324.111007012							109498
SMR000218728	LSM-20897	SID17505850, BRD-K46688456	3457056	InChI=1S/C19H19N5O2S/c1-13-8-6-7-11-16(13)18(26)22-21-17(25)12-27-19-23-20-14(2)24(19)15-9-4-3-5-10-15/h3-11H,12H2,1-2H3,(H,21,25)(H,22,26)	ODRLVGBEHYSGAM-UHFFFAOYSA-N	Cc1ccccc1C(=O)NNC(=O)CSc2nnc(C)n2c3ccccc3	BroadT	BRD-K46688456	BRD-K46688456-001-05-1	InterBioScreen Ltd.	STOCK3S-73132			Cc1nnc(SCC(=O)NNC(=O)c2ccccc2C)n1-c1ccccc1	InChI=1S/C19H19N5O2S/c1-13-8-6-7-11-16(13)18(26)22-21-17(25)12-27-19-23-20-14(2)24(19)15-9-4-3-5-10-15/h3-11H,12H2,1-2H3,(H,21,25)(H,22,26)	ODRLVGBEHYSGAM-UHFFFAOYSA-N	381.125945588							109499
MLS000704419	LSM-20898	SID24796723, BRD-A75109755	11842128	InChI=1S/C23H26N2O4/c26-21(24-15-14-16-8-2-1-3-9-16)19-12-6-7-13-20(19)25-22(27)17-10-4-5-11-18(17)23(28)29/h1-3,6-9,12-13,17-18H,4-5,10-11,14-15H2,(H,24,26)(H,25,27)(H,28,29)	AALCHAKPJXCSQC-UHFFFAOYSA-N	OC(=O)C1CCCCC1C(=O)Nc2ccccc2C(=O)NCCc3ccccc3	BroadT	BRD-A75109755	BRD-A75109755-001-04-5	Specs	AQ-360/42570728			OC(=O)C1CCCCC1C(=O)Nc1ccccc1C(=O)NCCc1ccccc1	InChI=1S/C23H26N2O4/c26-21(24-15-14-16-8-2-1-3-9-16)19-12-6-7-13-20(19)25-22(27)17-10-4-5-11-18(17)23(28)29/h1-3,6-9,12-13,17-18H,4-5,10-11,14-15H2,(H,24,26)(H,25,27)(H,28,29)	AALCHAKPJXCSQC-UHFFFAOYSA-N	394.189257332							109500
MLS000042569	LSM-20899	SID865053, BRD-K36814366	666299	InChI=1S/C15H18N2O4/c1-4-19-14(18)12-11(16)9-5-8-7-20-15(2,3)6-10(8)17-13(9)21-12/h5H,4,6-7,16H2,1-3H3	GVONFQICPIJSDU-UHFFFAOYSA-N	CCOC(=O)c1oc2nc3CC(C)(C)OCc3cc2c1N	BroadT	BRD-K36814366	BRD-K36814366-001-05-4	InterBioScreen Ltd.	STOCK5S-34292			CCOC(=O)c1oc2nc3CC(C)(C)OCc3cc2c1N	InChI=1S/C15H18N2O4/c1-4-19-14(18)12-11(16)9-5-8-7-20-15(2,3)6-10(8)17-13(9)21-12/h5H,4,6-7,16H2,1-3H3	GVONFQICPIJSDU-UHFFFAOYSA-N	290.126657076							109501
4-[Methyl(Methylsulfonyl)amino]-n-(2-phenylethyl)benzamide	LSM-20900	SID14732643, BRD-K46376991	894029	InChI=1S/C17H20N2O3S/c1-19(23(2,21)22)16-10-8-15(9-11-16)17(20)18-13-12-14-6-4-3-5-7-14/h3-11H,12-13H2,1-2H3,(H,18,20)	YLFUOJFVQKNVIJ-UHFFFAOYSA-N	CN(c1ccc(cc1)C(=O)NCCc2ccccc2)S(=O)(=O)C	BroadT	BRD-K46376991	BRD-K46376991-001-05-5	ChemBridge Corporation	7607354			CN(c1ccc(cc1)C(=O)NCCc1ccccc1)S(C)(=O)=O	InChI=1S/C17H20N2O3S/c1-19(23(2,21)22)16-10-8-15(9-11-16)17(20)18-13-12-14-6-4-3-5-7-14/h3-11H,12-13H2,1-2H3,(H,18,20)	YLFUOJFVQKNVIJ-UHFFFAOYSA-N	332.11946321							109502
AC1LFWJE	LSM-20901	BRD-K47727762	784981	InChI=1S/C16H17N3O4/c1-19-10-11(4-7-15(19)20)16(21)18-17-9-12-8-13(22-2)5-6-14(12)23-3/h4-10H,1-3H3,(H,18,21)	ZGIMPNZNMBBIEI-UHFFFAOYSA-N	COc1ccc(OC)c(C=NNC(=O)C2=CN(C)C(=O)C=C2)c1	BroadT	BRD-K47727762	BRD-K47727762-001-05-5	Asinex Ltd.	BAS 00853749			COc1ccc(OC)c(C=NNC(=O)c2ccc(=O)n(C)c2)c1	InChI=1S/C16H17N3O4/c1-19-10-11(4-7-15(19)20)16(21)18-17-9-12-8-13(22-2)5-6-14(12)23-3/h4-10H,1-3H3,(H,18,21)	ZGIMPNZNMBBIEI-UHFFFAOYSA-N	315.121906054							109503
MLS000114640	LSM-20902	SID7964840, BRD-K37853756	954417	InChI=1S/C18H21NO/c1-4-20-18-8-6-5-7-17(18)19-11-15-9-13(2)14(3)10-16(15)12-19/h5-10H,4,11-12H2,1-3H3	DIHHLRLLBQWWDB-UHFFFAOYSA-N	CCOc1ccccc1N2Cc3cc(C)c(C)cc3C2	BroadT	BRD-K37853756	BRD-K37853756-001-05-9	ChemDiv Inc.	6061-0054			CCOc1ccccc1N1Cc2cc(C)c(C)cc2C1	InChI=1S/C18H21NO/c1-4-20-18-8-6-5-7-17(18)19-11-15-9-13(2)14(3)10-16(15)12-19/h5-10H,4,11-12H2,1-3H3	DIHHLRLLBQWWDB-UHFFFAOYSA-N	267.162314302							109504
AC1MVWIQ	LSM-20903	BRD-K84399875	3739773	InChI=1S/C12H12ClF3N4OS/c1-6(19-20-11(17)22)4-10(21)18-9-3-2-7(13)5-8(9)12(14,15)16/h2-3,5H,4H2,1H3,(H,18,21)(H3,17,20,22)	DYBCULMZPQWAIG-UHFFFAOYSA-N	CC(=NN=C(N)S)CC(=O)Nc1ccc(Cl)cc1C(F)(F)F	BroadT	BRD-K84399875	BRD-K84399875-001-04-4	InterBioScreen Ltd.	STOCK2S-73989			CC(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)=NN=C(N)S	InChI=1S/C12H12ClF3N4OS/c1-6(19-20-11(17)22)4-10(21)18-9-3-2-7(13)5-8(9)12(14,15)16/h2-3,5H,4H2,1H3,(H,18,21)(H3,17,20,22)	DYBCULMZPQWAIG-UHFFFAOYSA-N	352.037244044							109505
SMR000054488	LSM-20904	SID7978372, BRD-K68670895	720004	InChI=1S/C12H13N3O2S/c1-3-10-14-15-12(18-10)13-11(16)8-5-4-6-9(7-8)17-2/h4-7H,3H2,1-2H3,(H,13,15,16)	UZGXRDAFOTZPAT-UHFFFAOYSA-N	CCc1nnc(NC(=O)c2cccc(OC)c2)s1	BroadT	BRD-K68670895	BRD-K68670895-001-06-9	ChemBridge Corporation	5230143			CCc1nnc(NC(=O)c2cccc(OC)c2)s1	InChI=1S/C12H13N3O2S/c1-3-10-14-15-12(18-10)13-11(16)8-5-4-6-9(7-8)17-2/h4-7H,3H2,1-2H3,(H,13,15,16)	UZGXRDAFOTZPAT-UHFFFAOYSA-N	263.072847376							109506
AC1MS31J	LSM-20905	SID24790599, BRD-K83720391	3577878	InChI=1S/C16H17ClN2S2/c1-12-2-6-14(7-3-12)19-16(20)18-10-11-21-15-8-4-13(17)5-9-15/h2-9H,10-11H2,1H3,(H2,18,19,20)	SLIIHRMQGFXOGC-UHFFFAOYSA-N	Cc1ccc(NC(=NCCSc2ccc(Cl)cc2)S)cc1	BroadT	BRD-K83720391	BRD-K83720391-001-05-4	ChemDiv Inc.	K786-5436			Cc1ccc(NC(S)=NCCSc2ccc(Cl)cc2)cc1	InChI=1S/C16H17ClN2S2/c1-12-2-6-14(7-3-12)19-16(20)18-10-11-21-15-8-4-13(17)5-9-15/h2-9H,10-11H2,1H3,(H2,18,19,20)	SLIIHRMQGFXOGC-UHFFFAOYSA-N	336.052167654							109507
5-Amino-2-p-tolylisoindole-1,3-dione	LSM-20906	SID852169, BRD-K60079337	654782	InChI=1S/C15H12N2O2/c1-9-2-5-11(6-3-9)17-14(18)12-7-4-10(16)8-13(12)15(17)19/h2-8H,16H2,1H3	FHABPHDBZIXDNX-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=O)c3ccc(N)cc3C2=O	BroadT	BRD-K60079337	BRD-K60079337-001-05-9	Asinex Ltd.	BAS 00095822			Cc1ccc(cc1)N1C(=O)c2ccc(N)cc2C1=O	InChI=1S/C15H12N2O2/c1-9-2-5-11(6-3-9)17-14(18)12-7-4-10(16)8-13(12)15(17)19/h2-8H,16H2,1H3	FHABPHDBZIXDNX-UHFFFAOYSA-N	252.089877644							109508
CHEMDIV2_005698	LSM-20907	SID22402225, BRD-K21051323	6619097	InChI=1S/C22H19N3O3S/c1-2-14-4-3-5-17(12-14)23-20(26)16-8-6-15(7-9-16)13-25-21(27)19-18(10-11-29-19)24-22(25)28/h3-12H,2,13H2,1H3,(H,23,26)(H,24,28)	QRJDWTDZHJTIFG-UHFFFAOYSA-N	CCc1cccc(NC(=O)c2ccc(CN3C(=O)Nc4ccsc4C3=O)cc2)c1	BroadT	BRD-K21051323	BRD-K21051323-001-05-2	ChemDiv Inc.	C203-0072			CCc1cccc(NC(=O)c2ccc(Cn3c(=O)[nH]c4ccsc4c3=O)cc2)c1	InChI=1S/C22H19N3O3S/c1-2-14-4-3-5-17(12-14)23-20(26)16-8-6-15(7-9-16)13-25-21(27)19-18(10-11-29-19)24-22(25)28/h3-12H,2,13H2,1H3,(H,23,26)(H,24,28)	QRJDWTDZHJTIFG-UHFFFAOYSA-N	405.114712188							109509
1-Azabicyclo[2.2.2]oct-3-yl[bis(3-chlorophenyl)]methanol	LSM-15316	BRD-A70267707	566329	InChI=1S/C20H21Cl2NO/c21-17-5-1-3-15(11-17)20(24,16-4-2-6-18(22)12-16)19-13-23-9-7-14(19)8-10-23/h1-6,11-12,14,19,24H,7-10,13H2	LLAWTBLIBJUONA-UHFFFAOYSA-N	OC(C1CN2CCC1CC2)(c3cccc(Cl)c3)c4cccc(Cl)c4	BroadT	BRD-A70267707	BRD-A70267707-003-05-8	Asinex Ltd.	BAS 03662536		Cl	OC(C1CN2CCC1CC2)(c1cccc(Cl)c1)c1cccc(Cl)c1.Cl	InChI=1S/C20H21Cl2NO.ClH/c21-17-5-1-3-15(11-17)20(24,16-4-2-6-18(22)12-16)19-13-23-9-7-14(19)8-10-23;/h1-6,11-12,14,19,24H,7-10,13H2;1H	MHAULCCKFNKBQM-UHFFFAOYSA-N	361.100019722							103963, 103963
MLS000773526	LSM-20908	SID24841000, BRD-K82975754	5472164	InChI=1S/C11H11N5O3S/c1-2-12-11(20)15-14-9-7-5-6(16(18)19)3-4-8(7)13-10(9)17/h3-5,13,17H,2H2,1H3,(H,12,20)	CHQYIZFPXOODLW-UHFFFAOYSA-N	CCN=C(S)N=Nc1c(O)[nH]c2ccc(cc12)[N+](=O)[O-]	BroadT	BRD-K82975754	BRD-K82975754-001-06-4	Enamine Ltd.	T0513-4020			CCN=C(S)N=Nc1c(O)[nH]c2ccc(cc12)[N+]([O-])=O	InChI=1S/C11H11N5O3S/c1-2-12-11(20)15-14-9-7-5-6(16(18)19)3-4-8(7)13-10(9)17/h3-5,13,17H,2H2,1H3,(H,12,20)	CHQYIZFPXOODLW-UHFFFAOYSA-N	293.058259952							
MLS000549760	LSM-20909	SID17409076, BRD-K07431265	803807	InChI=1S/C18H12N4S/c1-10-7-8-12-15-16(23-18(12)21-10)14(11-5-3-2-4-6-11)13(9-19)17(20)22-15/h2-8H,1H3,(H2,20,22)	JXDFFCDUPOKUII-UHFFFAOYSA-N	Cc1ccc2c(n1)sc3c(c4ccccc4)c(C#N)c(N)nc23	BroadT	BRD-K07431265	BRD-K07431265-001-05-4	Asinex Ltd.	BAS 00537237			Cc1ccc2c(n1)sc1c(-c3ccccc3)c(C#N)c(N)nc21	InChI=1S/C18H12N4S/c1-10-7-8-12-15-16(23-18(12)21-10)14(11-5-3-2-4-6-11)13(9-19)17(20)22-15/h2-8H,1H3,(H2,20,22)	JXDFFCDUPOKUII-UHFFFAOYSA-N	316.078267114							109511
N-[3-(Benzothiazol-2-ylsulfanyl)-5-nitro-phenyl]-2-fluoro-benzamide	LSM-20910	SID17409162, BRD-K41385861	3114905	InChI=1S/C20H12FN3O3S2/c21-16-6-2-1-5-15(16)19(25)22-12-9-13(24(26)27)11-14(10-12)28-20-23-17-7-3-4-8-18(17)29-20/h1-11H,(H,22,25)	VSIRHCUECHYOBG-UHFFFAOYSA-N	[O-][N+](=O)c1cc(NC(=O)c2ccccc2F)cc(Sc3nc4ccccc4s3)c1	BroadT	BRD-K41385861	BRD-K41385861-001-06-6	Asinex Ltd.	BAS 00666429			[O-][N+](=O)c1cc(NC(=O)c2ccccc2F)cc(Sc2nc3ccccc3s2)c1	InChI=1S/C20H12FN3O3S2/c21-16-6-2-1-5-15(16)19(25)22-12-9-13(24(26)27)11-14(10-12)28-20-23-17-7-3-4-8-18(17)29-20/h1-11H,(H,22,25)	VSIRHCUECHYOBG-UHFFFAOYSA-N	425.030410854							109512
5-(3-Butoxyphenyl)-1,3,4-thiadiazol-2-amine	LSM-20911	SID858384, BRD-K03722219	659709	InChI=1S/C12H15N3OS/c1-2-3-7-16-10-6-4-5-9(8-10)11-14-15-12(13)17-11/h4-6,8H,2-3,7H2,1H3,(H2,13,15)	CDUSDSXOBNLGOJ-UHFFFAOYSA-N	CCCCOc1cccc(c1)c2nnc(N)s2	BroadT	BRD-K03722219	BRD-K03722219-001-06-5	InterBioScreen Ltd.	STOCK2S-33071			CCCCOc1cccc(c1)-c1nnc(N)s1	InChI=1S/C12H15N3OS/c1-2-3-7-16-10-6-4-5-9(8-10)11-14-15-12(13)17-11/h4-6,8H,2-3,7H2,1H3,(H2,13,15)	CDUSDSXOBNLGOJ-UHFFFAOYSA-N	249.09358282							109513
N-(6-Butyrylamino-4-methyl-pyridin-3-yl)-isonicotinamide	LSM-20912	SID852578, BRD-K56532296	655201	InChI=1S/C16H18N4O2/c1-3-4-15(21)20-14-9-11(2)13(10-18-14)19-16(22)12-5-7-17-8-6-12/h5-10H,3-4H2,1-2H3,(H,19,22)(H,18,20,21)	UABXJCJORJQWBU-UHFFFAOYSA-N	CCCC(=O)Nc1cc(C)c(NC(=O)c2ccncc2)cn1	BroadT	BRD-K56532296	BRD-K56532296-001-05-2	Asinex Ltd.	ASN 05804057			CCCC(=O)Nc1cc(C)c(NC(=O)c2ccncc2)cn1	InChI=1S/C16H18N4O2/c1-3-4-15(21)20-14-9-11(2)13(10-18-14)19-16(22)12-5-7-17-8-6-12/h5-10H,3-4H2,1-2H3,(H,19,22)(H,18,20,21)	UABXJCJORJQWBU-UHFFFAOYSA-N	298.142975856							109514
MLS000109175	LSM-20913	SID7972526, SID26668860, BRD-K12618745	1355631	InChI=1S/C22H21N3O4S/c1-4-25-19-13-12-18(16-6-5-7-17(20(16)19)22(25)27)23-21(26)14-8-10-15(11-9-14)30(28,29)24(2)3/h5-13H,4H2,1-3H3,(H,23,26)	KNFAFDWZNXLQKN-UHFFFAOYSA-N	CCN1C(=O)c2cccc3c(NC(=O)c4ccc(cc4)S(=O)(=O)N(C)C)ccc1c23	BroadT	BRD-K12618745	BRD-K12618745-001-05-9	ChemBridge Corporation	5914317			CCN1C(=O)c2cccc3c(NC(=O)c4ccc(cc4)S(=O)(=O)N(C)C)ccc1c23	InChI=1S/C22H21N3O4S/c1-4-25-19-13-12-18(16-6-5-7-17(20(16)19)22(25)27)23-21(26)14-8-10-15(11-9-14)30(28,29)24(2)3/h5-13H,4H2,1-3H3,(H,23,26)	KNFAFDWZNXLQKN-UHFFFAOYSA-N	423.125276872							109515
4-Phenylthiazole-2-thiol	LSM-20914	SID24834746, BRD-K06821538	3000729	InChI=1S/C9H7NS2/c11-9-10-8(6-12-9)7-4-2-1-3-5-7/h1-6H,(H,10,11)	CYCKHTAVNBPQDB-UHFFFAOYSA-N	Sc1nc(cs1)c2ccccc2	BroadT	BRD-K06821538	BRD-K06821538-001-05-8	Enamine Ltd.	T0520-0527			Sc1nc(cs1)-c1ccccc1	InChI=1S/C9H7NS2/c11-9-10-8(6-12-9)7-4-2-1-3-5-7/h1-6H,(H,10,11)	CYCKHTAVNBPQDB-UHFFFAOYSA-N	193.001990614							109516
F0593-0068	LSM-20915	SID51088974, BRD-K87583716	2051169	InChI=1S/C18H22N4O4S/c1-12-8-10-22(11-9-12)27(24,25)15-6-4-13(5-7-15)16(23)19-18-21-20-17(26-18)14-2-3-14/h4-7,12,14H,2-3,8-11H2,1H3,(H,19,21,23)	ZXPCSLJLDNVNNY-UHFFFAOYSA-N	CC1CCN(CC1)S(=O)(=O)c2ccc(cc2)C(=O)Nc3oc(nn3)C4CC4	BroadT	BRD-K87583716	BRD-K87583716-001-05-0	Life Chemicals Inc.	F0593-0068			CC1CCN(CC1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(o1)C1CC1	InChI=1S/C18H22N4O4S/c1-12-8-10-22(11-9-12)27(24,25)15-6-4-13(5-7-15)16(23)19-18-21-20-17(26-18)14-2-3-14/h4-7,12,14H,2-3,8-11H2,1H3,(H,19,21,23)	ZXPCSLJLDNVNNY-UHFFFAOYSA-N	390.136175914							109517
AC1O9I42	LSM-20916	BRD-K41384084	6786630	InChI=1S/C15H19N5/c16-12-14(19-18-13-8-4-3-5-9-13)15(17)20-10-6-1-2-7-11-20/h3-5,8-9,17-18H,1-2,6-7,10-11H2	PJJUHTJTUHEASX-UHFFFAOYSA-N	N=C(N1CCCCCC1)C(=NNc2ccccc2)C#N	BroadT	BRD-K41384084	BRD-K41384084-001-06-0	InterBioScreen Ltd.	STOCK1S-10627			N=C(N1CCCCCC1)C(=NNc1ccccc1)C#N	InChI=1S/C15H19N5/c16-12-14(19-18-13-8-4-3-5-9-13)15(17)20-10-6-1-2-7-11-20/h3-5,8-9,17-18H,1-2,6-7,10-11H2	PJJUHTJTUHEASX-UHFFFAOYSA-N	269.164045658							109518
MLS000332639	LSM-20917	SID26660136, BRD-K26929066	939495	InChI=1S/C20H20N4O2/c1-12(2)11-24-19-15(10-14-9-13(3)6-7-16(14)21-19)18(23-24)22-20(25)17-5-4-8-26-17/h4-10,12H,11H2,1-3H3,(H,22,23,25)	WMVQZIABIMIQEH-UHFFFAOYSA-N	CC(C)Cn1nc(NC(=O)c2occc2)c3cc4cc(C)ccc4nc13	BroadT	BRD-K26929066	BRD-K26929066-001-06-3	InterBioScreen Ltd.	STOCK4S-38719			CC(C)Cn1nc(NC(=O)c2ccco2)c2cc3cc(C)ccc3nc12	InChI=1S/C20H20N4O2/c1-12(2)11-24-19-15(10-14-9-13(3)6-7-16(14)21-19)18(23-24)22-20(25)17-5-4-8-26-17/h4-10,12H,11H2,1-3H3,(H,22,23,25)	WMVQZIABIMIQEH-UHFFFAOYSA-N	348.15862592							109519
ZINC00556578	LSM-20918	SID4256426, BRD-K23648048	952577	InChI=1S/C18H12N2O2/c21-18(17-11-12-5-1-2-9-16(12)22-17)20-15-8-3-7-14-13(15)6-4-10-19-14/h1-11H,(H,20,21)	WQBCPNHKOYADJN-UHFFFAOYSA-N	O=C(Nc1cccc2ncccc12)c3oc4ccccc4c3	BroadT	BRD-K23648048	BRD-K23648048-001-06-5	ChemBridge Corporation	7912754			O=C(Nc1cccc2ncccc12)c1cc2ccccc2o1	InChI=1S/C18H12N2O2/c21-18(17-11-12-5-1-2-9-16(12)22-17)20-15-8-3-7-14-13(15)6-4-10-19-14/h1-11H,(H,20,21)	WQBCPNHKOYADJN-UHFFFAOYSA-N	288.089877644							109520
AC1MSQZP	LSM-20919	BRD-K26503698	3588706	InChI=1S/C22H22FN9O3/c1-31(2)12-17-19(26-30-32(17)21-20(24)28-35-29-21)22(33)27-25-11-15-5-3-4-6-18(15)34-13-14-7-9-16(23)10-8-14/h3-11H,12-13H2,1-2H3,(H2,24,28)(H,27,33)	BYFXZSJFKNLVKP-UHFFFAOYSA-N	CN(C)Cc1c(nnn1c2nonc2N)C(=O)NN=Cc3ccccc3OCc4ccc(F)cc4	BroadT	BRD-K26503698	BRD-K26503698-001-05-4	ChemDiv Inc.	6011-0662			CN(C)Cc1c(nnn1-c1nonc1N)C(=O)NN=Cc1ccccc1OCc1ccc(F)cc1	InChI=1S/C22H22FN9O3/c1-31(2)12-17-19(26-30-32(17)21-20(24)28-35-29-21)22(33)27-25-11-15-5-3-4-6-18(15)34-13-14-7-9-16(23)10-8-14/h3-11H,12-13H2,1-2H3,(H2,24,28)(H,27,33)	BYFXZSJFKNLVKP-UHFFFAOYSA-N	479.182963854							109521
AC1NSDLC	LSM-20920	SID7965943, BRD-K77837571	5307925	InChI=1S/C21H34N4O4S/c1-16-20(17(2)29-22-16)30(27,28)25-14-6-18(7-15-25)21(26)24-12-8-19(9-13-24)23-10-4-3-5-11-23/h18-19H,3-15H2,1-2H3	ZUGPWZFCZDOZIC-UHFFFAOYSA-N	Cc1onc(C)c1S(=O)(=O)N2CCC(CC2)C(=O)N3CCC(CC3)N4CCCCC4	BroadT	BRD-K77837571	BRD-K77837571-001-04-9	ChemDiv Inc.	C324-1580			Cc1noc(C)c1S(=O)(=O)N1CCC(CC1)C(=O)N1CCC(CC1)N1CCCCC1	InChI=1S/C21H34N4O4S/c1-16-20(17(2)29-22-16)30(27,28)25-14-6-18(7-15-25)21(26)24-12-8-19(9-13-24)23-10-4-3-5-11-23/h18-19H,3-15H2,1-2H3	ZUGPWZFCZDOZIC-UHFFFAOYSA-N	438.230076298							109522
BAS 07240749	LSM-20921	SID842416, BRD-K40671994	644682	InChI=1S/C14H10Cl2N2O3/c15-9-4-3-6-10(13(9)16)18-12(19)8-21-14(20)11-5-1-2-7-17-11/h1-7H,8H2,(H,18,19)	AVYINTPRJGWUCL-UHFFFAOYSA-N	Clc1cccc(NC(=O)COC(=O)c2ccccn2)c1Cl	BroadT	BRD-K40671994	BRD-K40671994-001-05-2	Asinex Ltd.	BAS 07240749			Clc1cccc(NC(=O)COC(=O)c2ccccn2)c1Cl	InChI=1S/C14H10Cl2N2O3/c15-9-4-3-6-10(13(9)16)18-12(19)8-21-14(20)11-5-1-2-7-17-11/h1-7H,8H2,(H,18,19)	AVYINTPRJGWUCL-UHFFFAOYSA-N	324.00684762							109523
1-(2-Fluorophenyl)-3-[5-(2-fluorophenyl)-1,3,4-thiadiazol-2-yl]urea	LSM-20922	SID24802581, BRD-K21695594	1390940	InChI=1S/C15H10F2N4OS/c16-10-6-2-1-5-9(10)13-20-21-15(23-13)19-14(22)18-12-8-4-3-7-11(12)17/h1-8H,(H2,18,19,21,22)	QOQYBMYMROZNFU-UHFFFAOYSA-N	Fc1ccccc1NC(=O)Nc2nnc(s2)c3ccccc3F	BroadT	BRD-K21695594	BRD-K21695594-001-05-8	ChemBridge Corporation	6379052			Fc1ccccc1NC(=O)Nc1nnc(s1)-c1ccccc1F	InChI=1S/C15H10F2N4OS/c16-10-6-2-1-5-9(10)13-20-21-15(23-13)19-14(22)18-12-8-4-3-7-11(12)17/h1-8H,(H2,18,19,21,22)	QOQYBMYMROZNFU-UHFFFAOYSA-N	332.05433807							109524
MLS000116692	LSM-20923	SID7969003, BRD-K80516971	5309716	InChI=1S/C17H15N5O/c1-2-23-15-10-6-4-8-13(15)20-16-17-21-18-11-22(17)14-9-5-3-7-12(14)19-16/h3-11H,2H2,1H3,(H,19,20)	BBLIWJJYMSCXRB-UHFFFAOYSA-N	CCOc1ccccc1Nc2nc3ccccc3n4cnnc24	BroadT	BRD-K80516971	BRD-K80516971-001-05-7	ChemDiv Inc.	C301-1248			CCOc1ccccc1Nc1nc2ccccc2n2cnnc12	InChI=1S/C17H15N5O/c1-2-23-15-10-6-4-8-13(15)20-16-17-21-18-11-22(17)14-9-5-3-7-12(14)19-16/h3-11H,2H2,1H3,(H,19,20)	BBLIWJJYMSCXRB-UHFFFAOYSA-N	305.12766015							109525
BRD-A00250346	LSM-20924			InChI=1S/C25H24ClNO6/c1-13-21(25(30)33-11-15-4-3-9-31-15)22(23-18(27-13)5-2-6-19(23)28)17-12-32-20-8-7-14(26)10-16(20)24(17)29/h7-8,10,12,15,22-23H,2-6,9,11H2,1H3	WZCPUFBHRAGEOV-UHFFFAOYSA-N	CC1=C(C(C2C(=O)CCCC2=N1)C3=COc4ccc(Cl)cc4C3=O)C(=O)OCC5CCCO5	BroadT	BRD-A00250346	BRD-A00250346-001-05-0	Asinex Ltd.	BAS 02169816			CC1=C(C(C2C(=O)CCCC2=N1)c1coc2ccc(Cl)cc2c1=O)C(=O)OCC1CCCO1	InChI=1S/C25H24ClNO6/c1-13-21(25(30)33-11-15-4-3-9-31-15)22(23-18(27-13)5-2-6-19(23)28)17-12-32-20-8-7-14(26)10-16(20)24(17)29/h7-8,10,12,15,22-23H,2-6,9,11H2,1H3	WZCPUFBHRAGEOV-UHFFFAOYSA-N	469.129215208							109526
2-(Cyclohexylamino)-n-(4-ethylphenyl)-2-thioxoacetamide	LSM-20925	SID24819092, BRD-K26503271	678808	InChI=1S/C16H22N2OS/c1-2-12-8-10-14(11-9-12)17-15(19)16(20)18-13-6-4-3-5-7-13/h8-11,13H,2-7H2,1H3,(H,17,19)(H,18,20)	CAGPYNHFGUOVCO-UHFFFAOYSA-N	CCc1ccc(NC(=O)C(=NC2CCCCC2)S)cc1	BroadT	BRD-K26503271	BRD-K26503271-001-05-9	Key Organics Ltd.	JS-0400			CCc1ccc(NC(=O)C(S)=NC2CCCCC2)cc1	InChI=1S/C16H22N2OS/c1-2-12-8-10-14(11-9-12)17-15(19)16(20)18-13-6-4-3-5-7-13/h8-11,13H,2-7H2,1H3,(H,17,19)(H,18,20)	CAGPYNHFGUOVCO-UHFFFAOYSA-N	290.145284034							109527
T5304854	LSM-20926	SID24837540, BRD-K99554417	2575953	InChI=1S/C18H26N4O3/c23-16-8-4-3-7-15(16)22-11-9-21(10-12-22)13-17(24)20-18(25)19-14-5-1-2-6-14/h3-4,7-8,14,23H,1-2,5-6,9-13H2,(H2,19,20,24,25)	CYNLWMXZXMFXSM-UHFFFAOYSA-N	Oc1ccccc1N2CCN(CC(=O)NC(=O)NC3CCCC3)CC2	BroadT	BRD-K99554417	BRD-K99554417-001-05-9	Enamine Ltd.	T5304854			Oc1ccccc1N1CCN(CC(=O)NC(=O)NC2CCCC2)CC1	InChI=1S/C18H26N4O3/c23-16-8-4-3-7-15(16)22-11-9-21(10-12-22)13-17(24)20-18(25)19-14-5-1-2-6-14/h3-4,7-8,14,23H,1-2,5-6,9-13H2,(H2,19,20,24,25)	CYNLWMXZXMFXSM-UHFFFAOYSA-N	346.200490732							109528
SMR000003224	LSM-20927	SID26668042, SID850708, BRD-A95201648	653237	InChI=1S/C25H28N6O3/c1-33-21-9-10-23-19(13-21)12-20(25(32)26-23)15-30(16-22-8-5-11-34-22)17-24-27-28-29-31(24)14-18-6-3-2-4-7-18/h2-4,6-7,9-10,12-13,22H,5,8,11,14-17H2,1H3,(H,26,32)	GJMNUJOXQRUNPQ-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(CC3CCCO3)Cc4nnnn4Cc5ccccc5)cc2c1	BroadT	BRD-A95201648	BRD-A95201648-001-05-4	Asinex Ltd.	ASN 04370256			COc1ccc2nc(O)c(CN(CC3CCCO3)Cc3nnnn3Cc3ccccc3)cc2c1	InChI=1S/C25H28N6O3/c1-33-21-9-10-23-19(13-21)12-20(25(32)26-23)15-30(16-22-8-5-11-34-22)17-24-27-28-29-31(24)14-18-6-3-2-4-7-18/h2-4,6-7,9-10,12-13,22H,5,8,11,14-17H2,1H3,(H,26,32)	GJMNUJOXQRUNPQ-UHFFFAOYSA-N	460.222288816							109529
313516-66-4	LSM-2690	BRD-K31843556, SID26753272	2777391	InChI=1S/C12H8ClN3O3/c13-11-2-1-9(16(18)19)7-10(11)12(17)15-8-3-5-14-6-4-8/h1-7H,(H,14,15,17)	FRPJSHKMZHWJBE-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(Cl)c(c1)C(=O)Nc2ccncc2	BroadT	BRD-K31843556	BRD-K31843556-001-01-7	Tocris Bioscience	2301	1		[O-][N+](=O)c1ccc(Cl)c(c1)C(=O)Nc1ccncc1	InChI=1S/C12H8ClN3O3/c13-11-2-1-9(16(18)19)7-10(11)12(17)15-8-3-5-14-6-4-8/h1-7H,(H,14,15,17)	FRPJSHKMZHWJBE-UHFFFAOYSA-N	277.025418856							92553
Oxaprozin	LSM-2553	Oxaprozin, Daypro, WY-21743	4614	InChI=1S/C18H15NO3/c20-16(21)12-11-15-19-17(13-7-3-1-4-8-13)18(22-15)14-9-5-2-6-10-14/h1-10H,11-12H2,(H,20,21)	OFPXSFXSNFPTHF-UHFFFAOYSA-N	OC(=O)CCc1oc(c2ccccc2)c(n1)c3ccccc3	BroadT	BRD-K25394294	BRD-K25394294-001-04-0	MicroSource Discovery Systems Inc.	1505267			OC(=O)CCc1nc(c(o1)-c1ccccc1)-c1ccccc1	InChI=1S/C18H15NO3/c20-16(21)12-11-15-19-17(13-7-3-1-4-8-13)18(22-15)14-9-5-2-6-10-14/h1-10H,11-12H2,(H,20,21)	OFPXSFXSNFPTHF-UHFFFAOYSA-N	293.10519335							7822, 7822
Lysergol	LSM-2609	SID11113286, SID24824134	14987	InChI=1S/C16H18N2O/c1-18-8-10(9-19)5-13-12-3-2-4-14-16(12)11(7-17-14)6-15(13)18/h2-5,7,10,15,17,19H,6,8-9H2,1H3/t10-,15-/m1/s1	BIXJFIJYBLJTMK-MEBBXXQBSA-N	CN1C[C@H](CO)C=C2[C@H]1Cc3c[nH]c4cccc2c34	BroadT	BRD-K27871032	BRD-K27871032-001-02-6	AnalytiCon Discovery GmbH	NP-009925			CN1C[C@H](CO)C=C2[C@H]1Cc1c[nH]c3cccc2c13	InChI=1S/C16H18N2O/c1-18-8-10(9-19)5-13-12-3-2-4-14-16(12)11(7-17-14)6-15(13)18/h2-5,7,10,15,17,19H,6,8-9H2,1H3/t10-,15-/m1/s1	BIXJFIJYBLJTMK-MEBBXXQBSA-N	254.141913216							60528, 60528
CTK8E8566	LSM-2746	BRD-K34170797	447713	InChI=1S/C32H36N2O3/c1-33(2)29-19-17-27(18-20-29)26-15-12-25(13-16-26)23-34(32(36)28-9-5-4-6-10-28)30-11-7-8-24(22-30)14-21-31(35)37-3/h7-8,11-22,28H,4-6,9-10,23H2,1-3H3	VLQTUNDJHLEFEQ-UHFFFAOYSA-N	COC(=O)C=Cc1cccc(c1)N(Cc2ccc(cc2)c3ccc(cc3)N(C)C)C(=O)C4CCCCC4	BroadT	BRD-K34170797	BRD-K34170797-001-01-1	Tocris Bioscience	2563	1		COC(=O)C=Cc1cccc(c1)N(Cc1ccc(cc1)-c1ccc(cc1)N(C)C)C(=O)C1CCCCC1	InChI=1S/C32H36N2O3/c1-33(2)29-19-17-27(18-20-29)26-15-12-25(13-16-26)23-34(32(36)28-9-5-4-6-10-28)30-11-7-8-24(22-30)14-21-31(35)37-3/h7-8,11-22,28H,4-6,9-10,23H2,1-3H3	VLQTUNDJHLEFEQ-UHFFFAOYSA-N	496.272593032							92597
ZK-93423	LSM-2741	ZK-93423, BRD-K33882852	121926	InChI=1S/C23H22N2O4/c1-3-28-23(26)22-18(14-27-2)21-17-11-16(29-13-15-7-5-4-6-8-15)9-10-19(17)25-20(21)12-24-22/h4-12,25H,3,13-14H2,1-2H3	ALBKMJDFBZVHAK-UHFFFAOYSA-N	CCOC(=O)c1ncc2[nH]c3ccc(OCc4ccccc4)cc3c2c1COC	BroadT	BRD-K33882852	BRD-K33882852-003-01-0	Tocris Bioscience	1994	1	Cl	CCOC(=O)c1ncc2[nH]c3ccc(OCc4ccccc4)cc3c2c1COC.Cl	InChI=1S/C23H22N2O4.ClH/c1-3-28-23(26)22-18(14-27-2)21-17-11-16(29-13-15-7-5-4-6-8-15)9-10-19(17)25-20(21)12-24-22;/h4-12,25H,3,13-14H2,1-2H3;1H	KHMDBPAODAAMBQ-UHFFFAOYSA-N	390.157957204							92593
Trim	LSM-20928	1-[2-(Trifluoromethyl)Phenyl]Imidazole	1359	InChI=1S/C10H7F3N2/c11-10(12,13)8-3-1-2-4-9(8)15-6-5-14-7-15/h1-7H	WZBWBNCQUTXYEL-UHFFFAOYSA-N	FC(F)(F)c1ccccc1n2ccnc2	BroadT	BRD-K36851334	BRD-K36851334-001-03-0	Biomol International Inc.	CN-266	2840(V2)-3-N1305		FC(F)(F)c1ccccc1-n1ccnc1	InChI=1S/C10H7F3N2/c11-10(12,13)8-3-1-2-4-9(8)15-6-5-14-7-15/h1-7H	WZBWBNCQUTXYEL-UHFFFAOYSA-N	212.056132844							109530
Diltiazem	LSM-2523	Diltzac, Diltiazem, Tiamate, Tiazac, Cardizem, Dilt-CD	39186	InChI=1S/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3/t20-,21+/m1/s1	HSUGRBWQSSZJOP-RTWAWAEBSA-N	COc1ccc(cc1)[C@@H]2Sc3ccccc3N(CCN(C)C)C(=O)[C@@H]2OC(=O)C	BroadT	BRD-K24023109	BRD-K24023109-001-02-5	Biomol International Inc.	CA-205	2840(V2)-3-N1305		COc1ccc(cc1)[C@@H]1Sc2ccccc2N(CCN(C)C)C(=O)[C@@H]1OC(C)=O	InChI=1S/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3/t20-,21+/m1/s1	HSUGRBWQSSZJOP-RTWAWAEBSA-N	414.161328022							101278, 101278, 101278
Roxithromycin	LSM-45095	Roxithromycin, Rulide, RU-28965, RU-965	5480431	InChI=1S/C41H76N2O15/c1-15-29-41(10,49)34(45)24(4)31(42-53-21-52-17-16-50-13)22(2)19-39(8,48)36(58-38-32(44)28(43(11)12)18-23(3)54-38)25(5)33(26(6)37(47)56-29)57-30-20-40(9,51-14)35(46)27(7)55-30/h22-30,32-36,38,44-46,48-49H,15-21H2,1-14H3/b42-31+/t22-,23-,24+,25+,26-,27+,28+,29-,30+,32-,33+,34-,35+,36-,38+,39-,40-,41-/m1/s1	RXZBMPWDPOLZGW-XMRMVWPWSA-N	CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@@H]([C@H]3O)N(C)C)[C@](C)(O)C[C@@H](C)\C(=N/OCOCCOC)\[C@H](C)[C@@H](O)[C@]1(C)O	BroadT	BRD-K38684403	BRD-K38684403-001-02-1	MicroSource Discovery Systems Inc.	1503276			CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C)(O)C[C@@H](C)\C(=N/OCOCCOC)[C@H](C)[C@@H](O)[C@]1(C)O	InChI=1S/C41H76N2O15/c1-15-29-41(10,49)34(45)24(4)31(42-53-21-52-17-16-50-13)22(2)19-39(8,48)36(58-38-32(44)28(43(11)12)18-23(3)54-38)25(5)33(26(6)37(47)56-29)57-30-20-40(9,51-14)35(46)27(7)55-30/h22-30,32-36,38,44-46,48-49H,15-21H2,1-14H3/b42-31+/t22-,23-,24+,25+,26-,27+,28+,29-,30+,32-,33+,34-,35+,36-,38+,39-,40-,41-/m1/s1	RXZBMPWDPOLZGW-XMRMVWPWSA-N	836.524569752001							48935
Bumetanide	LSM-2848	Bumetanide, Bumex, Burinex, Lixil, RO-106338	2471	InChI=1S/C17H20N2O5S/c1-2-3-9-19-14-10-12(17(20)21)11-15(25(18,22)23)16(14)24-13-7-5-4-6-8-13/h4-8,10-11,19H,2-3,9H2,1H3,(H,20,21)(H2,18,22,23)	MAEIEVLCKWDQJH-UHFFFAOYSA-N	CCCCNc1cc(cc(c1Oc2ccccc2)S(=O)(=O)N)C(=O)O	BroadT	BRD-K38197229	BRD-K38197229-001-06-7	Biomol International Inc.	EI-168	2840(V2)-3-N1305		CCCCNc1cc(cc(c1Oc1ccccc1)S(N)(=O)=O)C(O)=O	InChI=1S/C17H20N2O5S/c1-2-3-9-19-14-10-12(17(20)21)11-15(25(18,22)23)16(14)24-13-7-5-4-6-8-13/h4-8,10-11,19H,2-3,9H2,1H3,(H,20,21)(H2,18,22,23)	MAEIEVLCKWDQJH-UHFFFAOYSA-N	364.10929245							3213
Sulfachlorpyridazine	LSM-5456	Sulphachlorpyridazine, Sulfachlorpyridazine, Sulfachloropyridazine, Sonilyn, Nefrosul	6634	InChI=1S/C10H9ClN4O2S/c11-9-5-6-10(14-13-9)15-18(16,17)8-3-1-7(12)2-4-8/h1-6H,12H2,(H,14,15)	XOXHILFPRYWFOD-UHFFFAOYSA-N	Nc1ccc(cc1)S(=O)(=O)Nc2ccc(Cl)nn2	BroadT	BRD-K32021043	BRD-K32021043-001-04-4	MicroSource Discovery Systems Inc.	1501142			Nc1ccc(cc1)S(=O)(=O)Nc1ccc(Cl)nn1	InChI=1S/C10H9ClN4O2S/c11-9-5-6-10(14-13-9)15-18(16,17)8-3-1-7(12)2-4-8/h1-6H,12H2,(H,14,15)	XOXHILFPRYWFOD-UHFFFAOYSA-N	284.013473968							59057
1-(1,3-Benzodioxol-5-ylcarbonyl)piperidine	LSM-20930	SID26752045, SID11113881	1370	InChI=1S/C13H15NO3/c15-13(14-6-2-1-3-7-14)10-4-5-11-12(8-10)17-9-16-11/h4-5,8H,1-3,6-7,9H2	BXBNADAPIHHXJQ-UHFFFAOYSA-N	O=C(N1CCCCC1)c2ccc3OCOc3c2	BroadT	BRD-K25140590	BRD-K25140590-001-01-4	Biomol International Inc.	AC-440	2817-N1277		O=C(N1CCCCC1)c1ccc2OCOc2c1	InChI=1S/C13H15NO3/c15-13(14-6-2-1-3-7-14)10-4-5-11-12(8-10)17-9-16-11/h4-5,8H,1-3,6-7,9H2	BXBNADAPIHHXJQ-UHFFFAOYSA-N	233.10519335							109531
CHEMBL168972	LSM-2435	SID11112890, SR-95639A	195165	InChI=1S/C19H24N4O/c1-2-7-17-15(4-1)5-3-6-16-14-18(21-22-19(16)17)20-8-9-23-10-12-24-13-11-23/h1-2,4,7,14H,3,5-6,8-13H2,(H,20,21)	RUTYAHFAKWVMNH-UHFFFAOYSA-N	C(CN1CCOCC1)Nc2cc3CCCc4ccccc4c3nn2	BroadT	BRD-K19309090	BRD-K19309090-300-03-0	Prestwick Chemical Inc.	Prestw-406	D0701-MP04-ST03-200-	Cl.Cl	C(CN1CCOCC1)Nc1cc2CCCc3ccccc3-c2nn1.Cl.Cl	InChI=1S/C19H24N4O.2ClH/c1-2-7-17-15(4-1)5-3-6-16-14-18(21-22-19(16)17)20-8-9-23-10-12-24-13-11-23;;/h1-2,4,7,14H,3,5-6,8-13H2,(H,20,21);2*1H	LAROMNHHFPRNET-UHFFFAOYSA-N	324.195011428							92355, 92355
CHEMBL73824	LSM-2649	BRD-K29668683, SID11113758, SID26751941	574780	InChI=1S/C13H18Cl2N2/c1-16-6-8-17(9-7-16)5-4-11-2-3-12(14)13(15)10-11/h2-3,10H,4-9H2,1H3	SUIZRDJCBVPASY-UHFFFAOYSA-N	CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	BroadT	BRD-K29668683	BRD-K29668683-300-01-4	Tocris Bioscience	883	3	Cl.Cl	CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1.Cl.Cl	InChI=1S/C13H18Cl2N2.2ClH/c1-16-6-8-17(9-7-16)5-4-11-2-3-12(14)13(15)10-11;;/h2-3,10H,4-9H2,1H3;2*1H	NXFDBTLQOARIMH-UHFFFAOYSA-N	272.084704016							92519
Morphothebaine	LSM-2702	SID26756531	5351542	InChI=1S/C18H19NO3/c1-19-6-5-11-7-12(20)9-13-16(11)14(19)8-10-3-4-15(22-2)18(21)17(10)13/h3-4,7,9,14,20-21H,5-6,8H2,1-2H3/t14-/m1/s1	LEWKYIVLAXKZAS-CQSZACIVSA-N	COc1ccc2C[C@H]3N(C)CCc4cc(O)cc(c34)c2c1O	BroadT	BRD-K32412559	BRD-K32412559-001-01-7	Biomol International Inc.	AC-827	2812-3-N1298		COc1ccc2C[C@H]3N(C)CCc4cc(O)cc(c34)-c2c1O	InChI=1S/C18H19NO3/c1-19-6-5-11-7-12(20)9-13-16(11)14(19)8-10-3-4-15(22-2)18(21)17(10)13/h3-4,7,9,14,20-21H,5-6,8H2,1-2H3/t14-/m1/s1	LEWKYIVLAXKZAS-CQSZACIVSA-N	297.136493478							92561, 92561
Pyrantel	LSM-43219	Pyrantel	708857	InChI=1S/C11H14N2S/c1-13-8-3-7-12-11(13)6-5-10-4-2-9-14-10/h2,4-6,9H,3,7-8H2,1H3/b6-5+	YSAUAVHXTIETRK-AATRIKPKSA-N	CN1CCCN=C1\C=C\c2cccs2	BroadT	BRD-K20672254	BRD-K20672254-046-02-1	Prestwick Chemical Inc.	Prestw-212	D0701-MP04-ST03-200-	O[C@H]([C@@H](O)C(=O)O)C(=O)O	CN1CCCN=C1\C=C\c1cccs1.O[C@H]([C@@H](O)C(=O)O)C(=O)O	InChI=1S/C11H14N2S.C4H6O6/c1-13-8-3-7-12-11(13)6-5-10-4-2-9-14-10;5-1(3(7)8)2(6)4(9)10/h2,4-6,9H,3,7-8H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/b6-5+;/t;1-,2-/m.1/s1	VWRCYAZJKNPEQR-NIEARKAZSA-N	206.087769158							8654, 8654, 8654, 8654
Neostigmine	LSM-5360	Neostigmine, Neostigmine Bromide	4456	InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1	ALWKGYPQUAPLQC-UHFFFAOYSA-N	CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C	BroadT	BRD-K18922609	BRD-K18922609-004-04-1	Prestwick Chemical Inc.	Prestw-468	D0701-MP04-ST03-200-	Br	CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C.Br	InChI=1S/C12H19N2O2.BrH/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5;/h6-9H,1-5H3;1H/q+1;	LULNWZDBKTWDGK-UHFFFAOYSA-N	223.144652868							7514, 7514, 7514
Cephalothin	LSM-15184	Cefalotin, Seffin, Cephalothin	6024	InChI=1S/C16H16N2O6S2/c1-8(19)24-6-9-7-26-15-12(14(21)18(15)13(9)16(22)23)17-11(20)5-10-3-2-4-25-10/h2-4,12,15H,5-7H2,1H3,(H,17,20)(H,22,23)/t12-,15-/m1/s1	XIURVHNZVLADCM-IUODEOHRSA-N	CC(=O)OCC1=C(N2[C@H](SC1)[C@H](NC(=O)Cc3cccs3)C2=O)C(=O)O	BroadT	BRD-K28210218	BRD-K28210218-236-04-0	MicroSource Discovery Systems Inc.	1500166		[Na]	CC(=O)OCC1=C(N2[C@H](SC1)[C@H](NC(=O)Cc1cccs1)C2=O)C(O)=O.[Na]	InChI=1S/C16H16N2O6S2.Na.H/c1-8(19)24-6-9-7-26-15-12(14(21)18(15)13(9)16(22)23)17-11(20)5-10-3-2-4-25-10;;/h2-4,12,15H,5-7H2,1H3,(H,17,20)(H,22,23);;/t12-,15-;;/m1../s1	LOWUXHJREAZGHL-DGPOFWGLSA-N	396.044977632							124991, 124991
Bentazon	LSM-20931	Bentazone, SID26747733, SID26753698	2328	InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3	ZOMSMJKLGFBRBS-UHFFFAOYSA-N	CC(C)N1C(=O)c2ccccc2NS1(=O)=O	BroadT	BRD-K33986892	BRD-K33986892-001-02-3	MicroSource Discovery Systems Inc.	330039			CC(C)N1C(=O)c2ccccc2NS1(=O)=O	InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3	ZOMSMJKLGFBRBS-UHFFFAOYSA-N	240.056862954							3018
Dcebio	LSM-2704	BRD-K32526544, SID11111113, SID11114078	656765	InChI=1S/C9H8Cl2N2O/c1-2-13-8-4-6(11)5(10)3-7(8)12-9(13)14/h3-4H,2H2,1H3,(H,12,14)	LKHRMULASXZCLG-UHFFFAOYSA-N	CCN1C(=O)Nc2cc(Cl)c(Cl)cc12	BroadT	BRD-K32526544	BRD-K32526544-001-01-2	Tocris Bioscience	1422	2		CCn1c2cc(Cl)c(Cl)cc2[nH]c1=O	InChI=1S/C9H8Cl2N2O/c1-2-13-8-4-6(11)5(10)3-7(8)12-9(13)14/h3-4H,2H2,1H3,(H,12,14)	LKHRMULASXZCLG-UHFFFAOYSA-N	230.001368316							34662
NS-3694	LSM-2591	SID29217607, NS3694	10109069	InChI=1S/C15H10ClF3N2O3/c16-9-4-5-11(13(22)23)12(7-9)21-14(24)20-10-3-1-2-8(6-10)15(17,18)19/h1-7H,(H,22,23)(H2,20,21,24)	GNCZTZCPXFDPLI-UHFFFAOYSA-N	OC(=O)c1ccc(Cl)cc1NC(=O)Nc2cccc(c2)C(F)(F)F	BroadT	BRD-K26979635	BRD-K26979635-001-01-1	Calbiochem	178494			OC(=O)c1ccc(Cl)cc1NC(=O)Nc1cccc(c1)C(F)(F)F	InChI=1S/C15H10ClF3N2O3/c16-9-4-5-11(13(22)23)12(7-9)21-14(24)20-10-3-1-2-8(6-10)15(17,18)19/h1-7H,(H,22,23)(H2,20,21,24)	GNCZTZCPXFDPLI-UHFFFAOYSA-N	358.03320451							92474
131780-47-7	LSM-2686	BRD-K31633810	16759155	InChI=1S/C17H21N3O3/c1-19-12-6-7-13(19)9-14(8-12)23-17(22)20-10-11-4-2-3-5-15(11)18-16(20)21/h2-5,12-14H,6-10H2,1H3,(H,18,21)/t12-,13+,14?	NWXCDQHBVVPPTL-PBWFPOADSA-N	CN1[C@H]2CC[C@@H]1CC(C2)OC(=O)N3Cc4ccccc4NC3=O	BroadT	BRD-K31633810	BRD-K31633810-003-01-0	Tocris Bioscience	2096	1	Cl	CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)N1Cc2ccccc2NC1=O.Cl	InChI=1S/C17H21N3O3.ClH/c1-19-12-6-7-13(19)9-14(8-12)23-17(22)20-10-11-4-2-3-5-15(11)18-16(20)21;/h2-5,12-14H,6-10H2,1H3,(H,18,21);1H/t12-,13+,14+;	FDERDDSQHZRNGC-MGMJSKNASA-N	315.158291562							92549
BMY-7378	LSM-2673	BMY-7378, BRD-K31054881	2419	InChI=1S/C22H31N3O3/c1-28-19-7-3-2-6-18(19)24-13-10-23(11-14-24)12-15-25-20(26)16-22(17-21(25)27)8-4-5-9-22/h2-3,6-7H,4-5,8-17H2,1H3	AYYCFGDXLUPJAQ-UHFFFAOYSA-N	COc1ccccc1N2CCN(CCN3C(=O)CC4(CCCC4)CC3=O)CC2	BroadT	BRD-K31054881	BRD-K31054881-300-01-3	Tocris Bioscience	1006	1	Cl.Cl	COc1ccccc1N1CCN(CCN2C(=O)CC3(CCCC3)CC2=O)CC1.Cl.Cl	InChI=1S/C22H31N3O3.2ClH/c1-28-19-7-3-2-6-18(19)24-13-10-23(11-14-24)12-15-25-20(26)16-22(17-21(25)27)8-4-5-9-22;;/h2-3,6-7H,4-5,8-17H2,1H3;2*1H	NIBOMXUDFLRHRV-UHFFFAOYSA-N	385.236541882							92539, 92539, 92539
Chelidonine	LSM-2715	Chelidonine, (+)-Chelidonine	197810	InChI=1S/C20H19NO5/c1-21-7-13-11(2-3-15-20(13)26-9-23-15)18-14(22)4-10-5-16-17(25-8-24-16)6-12(10)19(18)21/h2-3,5-6,14,18-19,22H,4,7-9H2,1H3/t14-,18-,19+/m0/s1	GHKISGDRQRSCII-ZOCIIQOWSA-N	CN1Cc2c3OCOc3ccc2[C@H]4[C@@H](O)Cc5cc6OCOc6cc5[C@@H]14	BroadT	BRD-K32828673	BRD-K32828673-001-01-5	AnalytiCon Discovery GmbH	NP-006299			CN1Cc2c3OCOc3ccc2[C@H]2[C@@H](O)Cc3cc4OCOc4cc3[C@@H]12	InChI=1S/C20H19NO5/c1-21-7-13-11(2-3-15-20(13)26-9-23-15)18-14(22)4-10-5-16-17(25-8-24-16)6-12(10)19(18)21/h2-3,5-6,14,18-19,22H,4,7-9H2,1H3/t14-,18-,19+/m0/s1	GHKISGDRQRSCII-ZOCIIQOWSA-N	353.126322718							31389
Ketotifen	LSM-2637	Ketotifen, (R)-Ketotifen	3827	InChI=1S/C19H19NOS/c1-20-9-6-13(7-10-20)18-15-5-3-2-4-14(15)12-17(21)19-16(18)8-11-22-19/h2-5,8,11H,6-7,9-10,12H2,1H3	ZCVMWBYGMWKGHF-UHFFFAOYSA-N	CN1CCC(=C2c3ccccc3CC(=O)c4sccc24)CC1	BroadT	BRD-K28936863	BRD-K28936863-051-04-1	MicroSource Discovery Systems Inc.	1500668		OC(=O)/C=C/C(=O)O	CN1CCC(CC1)=C1c2ccsc2C(=O)Cc2ccccc12.OC(=O)/C=C/C(=O)O	InChI=1S/C19H19NOS.C4H4O4/c1-20-9-6-13(7-10-20)18-15-5-3-2-4-14(15)12-17(21)19-16(18)8-11-22-19;5-3(6)1-2-4(7)8/h2-5,8,11H,6-7,9-10,12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+	YNQQEYBLVYAWNX-WLHGVMLRSA-N	309.118734928							92511, 92511, 92511
Vanoxerine	LSM-2703	Vanoxerine, GBR-12909	3455	InChI=1S/C28H32F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-3,5-6,8-15,28H,4,7,16-22H2	NAUWTFJOPJWYOT-UHFFFAOYSA-N	Fc1ccc(cc1)C(OCCN2CCN(CCCc3ccccc3)CC2)c4ccc(F)cc4	BroadT	BRD-K32501161	BRD-K32501161-001-01-7	Biomol International Inc.	D-104	2812-3-N1298		Fc1ccc(cc1)C(OCCN1CCN(CCCc2ccccc2)CC1)c1ccc(F)cc1	InChI=1S/C28H32F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-3,5-6,8-15,28H,4,7,16-22H2	NAUWTFJOPJWYOT-UHFFFAOYSA-N	450.248270064							64089, 64089, 64089, 64089, 64089
Levonorgestrel	LSM-2768	Norplant, Mirena, Levonorgestrel, Ovrette, Prefest, Previfem, Skyla, Sprintec, WY-3707, WY-5104, Norplant II, Norplant System, Plan B, Plan B One-Step, Tri-Previfem, Tri-Sprintec	13109	InChI=1S/C21H28O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,16-19,23H,3,5-12H2,1H3/t16-,17+,18+,19-,20-,21-/m0/s1	WWYNJERNGUHSAO-XUDSTZEESA-N	CC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C	BroadT	BRD-K35189033	BRD-K35189033-001-03-0	Prestwick Chemical Inc.	Prestw-773	D0701-MP04-ST03-200-		CC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C	InChI=1S/C21H28O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,16-19,23H,3,5-12H2,1H3/t16-,17+,18+,19-,20-,21-/m0/s1	WWYNJERNGUHSAO-XUDSTZEESA-N	312.208930136							6443
M-Chloro-Phenyl-Biguanide	LSM-2812	3-Chloro-Phenyl Biguanide, N-(3-Chlorophenyl)Imidodicarbonimidic Diamide, M-Chlorophenylbiguanide, M-Chlorophenylbiguanidine	1354	InChI=1S/C8H10ClN5/c9-5-2-1-3-6(4-5)13-8(12)14-7(10)11/h1-4H,(H6,10,11,12,13,14)	DIHXJZHAIHGSAW-UHFFFAOYSA-N	NC(=N)NC(=N)Nc1cccc(Cl)c1	BroadT	BRD-K36965586	BRD-K36965586-001-01-7	Biomol International Inc.	AC-557	2813-N1283		NC(=N)NC(=N)Nc1cccc(Cl)c1	InChI=1S/C8H10ClN5/c9-5-2-1-3-6(4-5)13-8(12)14-7(10)11/h1-4H,(H6,10,11,12,13,14)	DIHXJZHAIHGSAW-UHFFFAOYSA-N	211.06247308							32347, 32347
GR-79236	LSM-2899	BRD-K40578143, GR79236, GR-79236	9884817	InChI=1S/C15H21N5O5/c21-4-9-11(23)12(24)15(25-9)20-6-18-10-13(16-5-17-14(10)20)19-7-2-1-3-8(7)22/h5-9,11-12,15,21-24H,1-4H2,(H,16,17,19)/t7-,8-,9+,11+,12+,15+/m0/s1	GYWXTRVEUURNEW-TVDBPQCTSA-N	OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(N[C@H]4CCC[C@@H]4O)ncnc23	BroadT	BRD-K40578143	BRD-K40578143-001-01-8	Tocris Bioscience	1957	1		OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@H]3CCC[C@@H]3O)ncnc12	InChI=1S/C15H21N5O5/c21-4-9-11(23)12(24)15(25-9)20-6-18-10-13(16-5-17-14(10)20)19-7-2-1-3-8(7)22/h5-9,11-12,15,21-24H,1-4H2,(H,16,17,19)/t7-,8-,9+,11+,12+,15+/m0/s1	GYWXTRVEUURNEW-TVDBPQCTSA-N	351.154268822							92714
Mitoxantrone	LSM-2481	Novantrone, Mitoxantrone, Mitoxantrone HCl	4212	InChI=1S/C22H28N4O6/c27-11-9-23-5-7-25-13-1-2-14(26-8-6-24-10-12-28)18-17(13)21(31)19-15(29)3-4-16(30)20(19)22(18)32/h1-4,23-30H,5-12H2	KKZJGLLVHKMTCM-UHFFFAOYSA-N	OCCNCCNc1ccc(NCCNCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12	BroadT	BRD-K21680192	BRD-K21680192-300-05-2	Prestwick Chemical Inc.	Prestw-385	D0701-MP04-ST03-200-	Cl.Cl	OCCNCCNc1ccc(NCCNCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12.Cl.Cl	InChI=1S/C22H28N4O6.2ClH/c27-11-9-23-5-7-25-13-1-2-14(26-8-6-24-10-12-28)18-17(13)21(31)19-15(29)3-4-16(30)20(19)22(18)32;;/h1-4,23-30H,5-12H2;2*1H	ZAHQPTJLOCWVPG-UHFFFAOYSA-N	444.200884656							50729, 50729
Simvastatin	LSM-2492	Simvastatin, Synvinolin, Zocor, MK-733, Simvastatin Hydroxy Acid	54454	InChI=1S/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1	RYMZZMVNJRMUDD-HGQWONQESA-N	CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12	BroadT	BRD-K22134346	BRD-K22134346-001-04-1	MicroSource Discovery Systems Inc.	1504236			CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12	InChI=1S/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1	RYMZZMVNJRMUDD-HGQWONQESA-N	418.271924316							9150
N-Oleoyldopamine (olda)	LSM-20932	BRD-K36376229	443751	InChI=1S/C26H43NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(30)27-21-20-23-18-19-24(28)25(29)22-23/h9-10,18-19,22,28-29H,2-8,11-17,20-21H2,1H3,(H,27,30)	QQBPLXNESPTPNU-UHFFFAOYSA-N	CCCCCCCCC=CCCCCCCCC(=O)NCCc1ccc(O)c(O)c1	BroadT	BRD-K36376229	BRD-K36376229-001-01-0	Tocris Bioscience	1641	2		CCCCCCCCC=CCCCCCCCC(=O)NCCc1ccc(O)c(O)c1	InChI=1S/C26H43NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(30)27-21-20-23-18-19-24(28)25(29)22-23/h9-10,18-19,22,28-29H,2-8,11-17,20-21H2,1H3,(H,27,30)	QQBPLXNESPTPNU-UHFFFAOYSA-N	417.324294246							109532
U 46619	LSM-42901	SID11532954, U-46619	5311493	InChI=1S/C21H34O4/c1-2-3-6-9-17(22)12-13-19-18(16-14-20(19)25-15-16)10-7-4-5-8-11-21(23)24/h4,7,12-13,16-20,22H,2-3,5-6,8-11,14-15H2,1H3,(H,23,24)/b7-4-,13-12+/t16-,17+,18+,19-,20-/m1/s1	LQANGKSBLPMBTJ-BRSNVKEHSA-N	CCCCC[C@H](O)\C=C\[C@@H]1[C@@H](C\C=C/CCCC(=O)O)[C@H]2CO[C@@H]1C2	BroadT	BRD-K18757346	BRD-K18757346-001-02-9	Biomol International Inc.	PG023	2840(V2)-3-N1305		CCCCC[C@H](O)\C=C\[C@H]1[C@H]2C[C@H](CO2)[C@@H]1C\C=C/CCCC(O)=O	InChI=1S/C21H34O4/c1-2-3-6-9-17(22)12-13-19-18(16-14-20(19)25-15-16)10-7-4-5-8-11-21(23)24/h4,7,12-13,16-20,22H,2-3,5-6,8-11,14-15H2,1H3,(H,23,24)/b7-4-,13-12+/t16-,17+,18+,19-,20-/m1/s1	LQANGKSBLPMBTJ-BRSNVKEHSA-N	350.245709568							
Ehna	LSM-2600	SID11114005, SID26752142, SID26752143, SID90340660	149784	InChI=1S/C14H23N5O/c1-3-4-5-6-7-11(10(2)20)19-9-18-12-13(15)16-8-17-14(12)19/h8-11,20H,3-7H2,1-2H3,(H2,15,16,17)/t10-,11+/m1/s1	IOSAAWHGJUZBOG-MNOVXSKESA-N	CCCCCC[C@@H]([C@@H](C)O)n1cnc2c(N)ncnc12	BroadT	BRD-K27450477	BRD-K27450477-001-03-9	Biomol International Inc.	PD129	2840(V2)-3-N1305		CCCCCC[C@@H]([C@@H](C)O)n1cnc2c(N)ncnc12	InChI=1S/C14H23N5O/c1-3-4-5-6-7-11(10(2)20)19-9-18-12-13(15)16-8-17-14(12)19/h8-11,20H,3-7H2,1-2H3,(H2,15,16,17)/t10-,11+/m1/s1	IOSAAWHGJUZBOG-MNOVXSKESA-N	277.190260406							63058, 63058
1-[2-Chloro-2-(2,4-dichlorophenyl)ethenyl]-1H-1,2,4-triazole	LSM-2614	BRD-K28137194	71333	InChI=1S/C10H6Cl3N3/c11-7-1-2-8(9(12)3-7)10(13)4-16-6-14-5-15-16/h1-6H	XGLHZTBDUXXHOM-UHFFFAOYSA-N	ClC(=Cn1cncn1)c2ccc(Cl)cc2Cl	BroadT	BRD-K28137194	BRD-K28137194-003-01-3	Tocris Bioscience	1295	2	Cl	ClC(=Cn1cncn1)c1ccc(Cl)cc1Cl.Cl	InChI=1S/C10H6Cl3N3.ClH/c11-7-1-2-8(9(12)3-7)10(13)4-16-6-14-5-15-16;/h1-6H;1H	AWKSVFLKVCVVFQ-UHFFFAOYSA-N	272.962730352							92491
Epirizole	LSM-2868	Epirizole, Mepirizole, Methopyrimazole, DA-398	3242	InChI=1S/C11H14N4O2/c1-7-5-9(16-3)13-11(12-7)15-10(17-4)6-8(2)14-15/h5-6H,1-4H3	RHAXSHUQNIEUEY-UHFFFAOYSA-N	COc1cc(C)nc(n1)n2nc(C)cc2OC	BroadT	BRD-K39339537	BRD-K39339537-001-03-8	Prestwick Chemical Inc.	Prestw-32	D0701-MP04-ST03-200-		COc1cc(C)nn1-c1nc(C)cc(OC)n1	InChI=1S/C11H14N4O2/c1-7-5-9(16-3)13-11(12-7)15-10(17-4)6-8(2)14-15/h5-6H,1-4H3	RHAXSHUQNIEUEY-UHFFFAOYSA-N	234.111675728							92689
Hesperetin	LSM-20933	NSC-57654	72281	InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1	AIONOLUJZLIMTK-AWEZNQCLSA-N	COc1ccc(cc1O)[C@@H]2CC(=O)c3c(O)cc(O)cc3O2	BroadT	BRD-K30553453	BRD-K30553453-001-04-1	MicroSource Discovery Systems Inc.	310012			COc1ccc(cc1O)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1	InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1	AIONOLUJZLIMTK-AWEZNQCLSA-N	302.079038168							28230
Benzydamine	LSM-5423	Benzydamine	12555	InChI=1S/C19H23N3O/c1-21(2)13-8-14-23-19-17-11-6-7-12-18(17)22(20-19)15-16-9-4-3-5-10-16/h3-7,9-12H,8,13-15H2,1-2H3	CNBGNNVCVSKAQZ-UHFFFAOYSA-N	CN(C)CCCOc1nn(Cc2ccccc2)c3ccccc13	BroadT	BRD-K28542495	BRD-K28542495-003-03-6	Prestwick Chemical Inc.	Prestw-297	D0701-MP04-ST03-200-	Cl	CN(C)CCCOc1nn(Cc2ccccc2)c2ccccc12.Cl	InChI=1S/C19H23N3O.ClH/c1-21(2)13-8-14-23-19-17-11-6-7-12-18(17)22(20-19)15-16-9-4-3-5-10-16;/h3-7,9-12H,8,13-15H2,1-2H3;1H	HNNIWKQLJSNAEQ-UHFFFAOYSA-N	309.184112386							94563, 94563
Butaclamol	LSM-20934	Butaclamol	37459	InChI=1S/C25H31NO/c1-24(2,3)25(27)13-14-26-16-21-19-9-5-4-7-17(19)11-12-18-8-6-10-20(23(18)21)22(26)15-25/h4-10,21-22,27H,11-16H2,1-3H3/t21-,22-,25-/m0/s1	ZZJYIKPMDIWRSN-HWBMXIPRSA-N	CC(C)(C)[C@]1(O)CCN2C[C@H]3c4ccccc4CCc5cccc([C@@H]2C1)c35	BroadT	BRD-K20620780	BRD-K20620780-001-01-0	Biomol International Inc.	AC-747	2812-3-N1298		CC(C)(C)[C@]1(O)CCN2C[C@H]3c4ccccc4CCc4cccc([C@@H]2C1)c34	InChI=1S/C25H31NO/c1-24(2,3)25(27)13-14-26-16-21-19-9-5-4-7-17(19)11-12-18-8-6-10-20(23(18)21)22(26)15-25/h4-10,21-22,27H,11-16H2,1-3H3/t21-,22-,25-/m0/s1	ZZJYIKPMDIWRSN-HWBMXIPRSA-N	361.240564622							109533, 109533
Bisacodyl	LSM-2883	Bisacodyl, Dulcolax, Theralax, Correctol Tablets, Caplets, Feen-A-Mint Tablets, SK-Bisacodyl	2391	InChI=1S/C22H19NO4/c1-15(24)26-19-10-6-17(7-11-19)22(21-5-3-4-14-23-21)18-8-12-20(13-9-18)27-16(2)25/h3-14,22H,1-2H3	KHOITXIGCFIULA-UHFFFAOYSA-N	CC(=O)Oc1ccc(cc1)C(c2ccc(OC(=O)C)cc2)c3ccccn3	BroadT	BRD-K39987650	BRD-K39987650-001-04-3	MicroSource Discovery Systems Inc.	1500147			CC(=O)Oc1ccc(cc1)C(c1ccc(OC(C)=O)cc1)c1ccccn1	InChI=1S/C22H19NO4/c1-15(24)26-19-10-6-17(7-11-19)22(21-5-3-4-14-23-21)18-8-12-20(13-9-18)27-16(2)25/h3-14,22H,1-2H3	KHOITXIGCFIULA-UHFFFAOYSA-N	361.131408098							92700
BD-1047	LSM-2810	BRD-K36864847, SID11113817, SID26751990	188914	InChI=1S/C13H20Cl2N2/c1-16(2)8-9-17(3)7-6-11-4-5-12(14)13(15)10-11/h4-5,10H,6-9H2,1-3H3	MGVRNMUKTZOQOW-UHFFFAOYSA-N	CN(C)CCN(C)CCc1ccc(Cl)c(Cl)c1	BroadT	BRD-K36864847	BRD-K36864847-303-01-7	Tocris Bioscience	956	2	Br.Br	CN(C)CCN(C)CCc1ccc(Cl)c(Cl)c1.Br.Br	InChI=1S/C13H20Cl2N2.2BrH/c1-16(2)8-9-17(3)7-6-11-4-5-12(14)13(15)10-11;;/h4-5,10H,6-9H2,1-3H3;2*1H	WOALTFHGLDVJHK-UHFFFAOYSA-N	274.10035408							92648
Pectolinarin	LSM-20935		6708644	InChI=1S/C29H34O15/c1-11-20(31)23(34)25(36)28(41-11)40-10-18-21(32)24(35)26(37)29(44-18)43-17-9-16-19(22(33)27(17)39-3)14(30)8-15(42-16)12-4-6-13(38-2)7-5-12/h4-9,11,18,20-21,23-26,28-29,31-37H,10H2,1-3H3/t11-,18+,20-,21+,23+,24-,25+,26+,28+,29-/m0/s1	DUXQKCCELUKXOE-NCNDPSPSSA-N	COc1ccc(cc1)C2=CC(=O)c3c(O)c(OC)c(O[C@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2	BroadT	BRD-K20043699	BRD-K20043699-001-02-3	MicroSource Discovery Systems Inc.	200115			COc1ccc(cc1)-c1cc(=O)c2c(O)c(OC)c(O[C@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc2o1	InChI=1S/C29H34O15/c1-11-20(31)23(34)25(36)28(41-11)40-10-18-21(32)24(35)26(37)29(44-18)43-17-9-16-19(22(33)27(17)39-3)14(30)8-15(42-16)12-4-6-13(38-2)7-5-12/h4-9,11,18,20-21,23-26,28-29,31-37H,10H2,1-3H3/t11-,18+,20-,21+,23+,24-,25+,26+,28+,29-/m0/s1	DUXQKCCELUKXOE-NCNDPSPSSA-N	622.189770388							109534
Ethamivan	LSM-2846	Etamivan, Ethamivan, Vandid	9363	InChI=1S/C12H17NO3/c1-4-13(5-2)12(15)9-6-7-10(14)11(8-9)16-3/h6-8,14H,4-5H2,1-3H3	BQJODPIMMWWMFC-UHFFFAOYSA-N	CCN(CC)C(=O)c1ccc(O)c(OC)c1	BroadT	BRD-K38055836	BRD-K38055836-001-03-9	Prestwick Chemical Inc.	Prestw-500	D0701-MP04-ST03-200-		CCN(CC)C(=O)c1ccc(O)c(OC)c1	InChI=1S/C12H17NO3/c1-4-13(5-2)12(15)9-6-7-10(14)11(8-9)16-3/h6-8,14H,4-5H2,1-3H3	BQJODPIMMWWMFC-UHFFFAOYSA-N	223.120843414							92675
MK-212	LSM-2443	MK 212, MK-212	107992	InChI=1S/C8H11ClN4/c9-7-5-11-6-8(12-7)13-3-1-10-2-4-13/h5-6,10H,1-4H2	CJAWPFJGFFNXQI-UHFFFAOYSA-N	Clc1cncc(n1)N2CCNCC2	BroadT	BRD-K19554809	BRD-K19554809-001-01-1	Biomol International Inc.	AC-549	2813-N1283		Clc1cncc(n1)N1CCNCC1	InChI=1S/C8H11ClN4/c9-7-5-11-6-8(12-7)13-3-1-10-2-4-13/h5-6,10H,1-4H2	CJAWPFJGFFNXQI-UHFFFAOYSA-N	198.067224102							92360, 92360
Hinokitiol	LSM-2835	Beta-Thujaplicin	3611	InChI=1S/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12)	FUWUEFKEXZQKKA-UHFFFAOYSA-N	CC(C)C1=CC=CC(=O)C(=C1)O	BroadT	BRD-K37691127	BRD-K37691127-001-02-2	Biomol International Inc.	FR-110	2840(V2)-3-N1305		CC(C)c1cccc(=O)c(O)c1	InChI=1S/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12)	FUWUEFKEXZQKKA-UHFFFAOYSA-N	164.083729624							10447, 10447
Neopine	LSM-20936		5462437	InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-4,6,12-13,17,20H,5,7-9H2,1-2H3/t12-,13+,17+,18+/m1/s1	NNDKZTBFZTWKLA-QISBLDNZSA-N	COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@H](O)CC=C35	BroadT	BRD-K34252131	BRD-K34252131-001-02-0	MicroSource Discovery Systems Inc.	1800065			COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@H](O)CC=C35	InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-4,6,12-13,17,20H,5,7-9H2,1-2H3/t12-,13+,17+,18+/m1/s1	NNDKZTBFZTWKLA-QISBLDNZSA-N	299.152143542							7509
Ketoconazole	LSM-5430	SID144204227	456201	InChI=1S/C26H28Cl2N4O4/c1-19(33)31-10-12-32(13-11-31)21-3-5-22(6-4-21)34-15-23-16-35-26(36-23,17-30-9-8-29-18-30)24-7-2-20(27)14-25(24)28/h2-9,14,18,23H,10-13,15-17H2,1H3/t23-,26-/m0/s1	XMAYWYJOQHXEEK-OZXSUGGESA-N	CC(=O)N1CCN(CC1)c2ccc(OC[C@H]3CO[C@@](Cn4ccnc4)(O3)c5ccc(Cl)cc5Cl)cc2	BroadT	BRD-K29113274	BRD-K29113274-001-03-6	Prestwick Chemical Inc.	Prestw-389	D0701-MP04-ST03-200-		CC(=O)N1CCN(CC1)c1ccc(OC[C@H]2CO[C@@](Cn3ccnc3)(O2)c2ccc(Cl)cc2Cl)cc1	InChI=1S/C26H28Cl2N4O4/c1-19(33)31-10-12-32(13-11-31)21-3-5-22(6-4-21)34-15-23-16-35-26(36-23,17-30-9-8-29-18-30)24-7-2-20(27)14-25(24)28/h2-9,14,18,23H,10-13,15-17H2,1H3/t23-,26-/m0/s1	XMAYWYJOQHXEEK-OZXSUGGESA-N	530.148760836							48336
Clopenthixol	LSM-42927	Clopenthixol, Chlorpenthixol, Zuclopenthixol, N-746, AY-62021	5311507	InChI=1S/C22H25ClN2OS/c23-17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)27-22)5-3-9-24-10-12-25(13-11-24)14-15-26/h1-2,4-8,16,26H,3,9-15H2/b18-5-	WFPIAZLQTJBIFN-DVZOWYKESA-N	OCCN1CCN(CC\C=C/2\c3ccccc3Sc4ccc(Cl)cc24)CC1	BroadT	BRD-K28761384	BRD-K28761384-003-03-6	Prestwick Chemical Inc.	Prestw-998	D0701-MP04-ST03-200-	Cl	OCCN1CCN(CC\C=C2\c3ccccc3Sc3ccc(Cl)cc23)CC1.Cl	InChI=1S/C22H25ClN2OS.ClH/c23-17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)27-22)5-3-9-24-10-12-25(13-11-24)14-15-26;/h1-2,4-8,16,26H,3,9-15H2;1H/b18-5-;	BUVIOIVVDWLSMQ-CVIBNLPVSA-N	400.13761184							51364, 51364, 51364
102649-78-5	LSM-2565	BRD-K25875056, SID11113499	124172	InChI=1S/C22H24ClNO2S/c23-21-15-8-14-20-19(21)13-9-16-22(20)27(25,26)24-17-7-2-1-4-10-18-11-5-3-6-12-18/h3,5-6,8-9,11-16,24H,1-2,4,7,10,17H2	YUXMTDYHFPRPLG-UHFFFAOYSA-N	Clc1cccc2c(cccc12)S(=O)(=O)NCCCCCCc3ccccc3	BroadT	BRD-K25875056	BRD-K25875056-001-01-2	Tocris Bioscience	433	2		Clc1cccc2c(cccc12)S(=O)(=O)NCCCCCCc1ccccc1	InChI=1S/C22H24ClNO2S/c23-21-15-8-14-20-19(21)13-9-16-22(20)27(25,26)24-17-7-2-1-4-10-18-11-5-3-6-12-18/h3,5-6,8-9,11-16,24H,1-2,4,7,10,17H2	YUXMTDYHFPRPLG-UHFFFAOYSA-N	401.121627418							92454
GYKI-52466	LSM-2530	GYKI-52466, BRD-K24240364	3538	InChI=1S/C17H15N3O2/c1-10-6-12-7-15-16(22-9-21-15)8-14(12)17(20-19-10)11-2-4-13(18)5-3-11/h2-5,7-8H,6,9,18H2,1H3	LFBZZHVSGAHQPP-UHFFFAOYSA-N	CC1=NN=C(c2ccc(N)cc2)c3cc4OCOc4cc3C1	BroadT	BRD-K24240364	BRD-K24240364-003-02-1	Tocris Bioscience	1454	5	Cl	CC1=NN=C(c2ccc(N)cc2)c2cc3OCOc3cc2C1.Cl	InChI=1S/C17H15N3O2.ClH/c1-10-6-12-7-15-16(22-9-21-15)8-14(12)17(20-19-10)11-2-4-13(18)5-3-11;/h2-5,7-8H,6,9,18H2,1H3;1H	RUBSCPARMVJNKX-UHFFFAOYSA-N	293.11642675							79560, 79560
HMS3268H18	LSM-2398	O-1918	40469923	InChI=1S/C19H26O2/c1-12(2)15-8-7-13(3)9-16(15)19-17(20-5)10-14(4)11-18(19)21-6/h9-11,15-16H,1,7-8H2,2-6H3/t15-,16+/m0/s1	ICHJMVMWPKLUKT-JKSUJKDBSA-N	COc1cc(C)cc(OC)c1[C@@H]2C=C(C)CC[C@H]2C(=C)C	BroadT	BRD-K18316707	BRD-K18316707-001-01-9	Tocris Bioscience	2288	1		COc1cc(C)cc(OC)c1[C@@H]1C=C(C)CC[C@H]1C(C)=C	InChI=1S/C19H26O2/c1-12(2)15-8-7-13(3)9-16(15)19-17(20-5)10-14(4)11-18(19)21-6/h9-11,15-16H,1,7-8H2,2-6H3/t15-,16+/m0/s1	ICHJMVMWPKLUKT-JKSUJKDBSA-N	286.193280072							92328
Benzthiazide	LSM-2474		2343	InChI=1S/C15H14ClN3O4S3/c16-11-6-12-14(7-13(11)25(17,20)21)26(22,23)19-15(18-12)9-24-8-10-4-2-1-3-5-10/h1-7H,8-9H2,(H,18,19)(H2,17,20,21)	NDTSRXAMMQDVSW-UHFFFAOYSA-N	NS(=O)(=O)c1cc2c(NC(=NS2(=O)=O)CSCc3ccccc3)cc1Cl	BroadT	BRD-K21450440	BRD-K21450440-001-04-7	MicroSource Discovery Systems Inc.	1500141			NS(=O)(=O)c1cc2c(cc1Cl)N=C(CSCc1ccccc1)NS2(=O)=O	InChI=1S/C15H14ClN3O4S3/c16-11-6-12-14(7-13(11)25(17,20)21)26(22,23)19-15(18-12)9-24-8-10-4-2-1-3-5-10/h1-7H,8-9H2,(H,18,19)(H2,17,20,21)	NDTSRXAMMQDVSW-UHFFFAOYSA-N	430.983495738							3047
Levcromakalim	LSM-2535	Levcromakalim, BRL-38227, BRD-K24526313	93504	InChI=1S/C16H18N2O3/c1-16(2)15(20)14(18-7-3-4-13(18)19)11-8-10(9-17)5-6-12(11)21-16/h5-6,8,14-15,20H,3-4,7H2,1-2H3/t14-,15+/m1/s1	TVZCRIROJQEVOT-CABCVRRESA-N	CC1(C)Oc2ccc(cc2[C@H]([C@@H]1O)N3CCCC3=O)C#N	BroadT	BRD-K24526313	BRD-K24526313-001-08-6	Tocris Bioscience	1378	1		CC1(C)Oc2ccc(cc2[C@H]([C@@H]1O)N1CCCC1=O)C#N	InChI=1S/C16H18N2O3/c1-16(2)15(20)14(18-7-3-4-13(18)19)11-8-10(9-17)5-6-12(11)21-16/h5-6,8,14-15,20H,3-4,7H2,1-2H3/t14-,15+/m1/s1	TVZCRIROJQEVOT-CABCVRRESA-N	286.131742456							6436
Trimethobenzamide	LSM-2750	Trimethobenzamide	5577	InChI=1S/C21H28N2O5/c1-23(2)10-11-28-17-8-6-15(7-9-17)14-22-21(24)16-12-18(25-3)20(27-5)19(13-16)26-4/h6-9,12-13H,10-11,14H2,1-5H3,(H,22,24)	FEZBIKUBAYAZIU-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)NCc2ccc(OCCN(C)C)cc2	BroadT	BRD-K34415467	BRD-K34415467-003-04-9	MicroSource Discovery Systems Inc.	1500594		Cl	COc1cc(cc(OC)c1OC)C(=O)NCc1ccc(OCCN(C)C)cc1.Cl	InChI=1S/C21H28N2O5.ClH/c1-23(2)10-11-28-17-8-6-15(7-9-17)14-22-21(24)16-12-18(25-3)20(27-5)19(13-16)26-4;/h6-9,12-13H,10-11,14H2,1-5H3,(H,22,24);1H	WIIZEEPFHXAUND-UHFFFAOYSA-N	388.199822016							27796, 27796
Carbacyclin	LSM-42923	SID26754830, SID26754829, SID26754828	6436393	InChI=1S/C21H34O4/c1-2-3-4-8-17(22)10-11-18-19-13-15(7-5-6-9-21(24)25)12-16(19)14-20(18)23/h7,10-11,16-20,22-23H,2-6,8-9,12-14H2,1H3,(H,24,25)/b11-10+,15-7+/t16-,17-,18+,19-,20+/m0/s1	XZFRIPGNUQRGPI-WBQKLGIQSA-N	CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H]2C\C(=C/CCCC(=O)O)\C[C@H]12	BroadT	BRD-K27499107	BRD-K27499107-001-02-6	Biomol International Inc.	PG035	2840(V2)-3-N1305		CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H]2C\C(C[C@H]12)=C/CCCC(O)=O	InChI=1S/C21H34O4/c1-2-3-4-8-17(22)10-11-18-19-13-15(7-5-6-9-21(24)25)12-16(19)14-20(18)23/h7,10-11,16-20,22-23H,2-6,8-9,12-14H2,1H3,(H,24,25)/b11-10+,15-7+/t16-,17-,18+,19-,20+/m0/s1	XZFRIPGNUQRGPI-WBQKLGIQSA-N	350.245709568							
Tyrphostin A9	LSM-4617	Tyrphostin A9, Tyrphostin-A9	5614	InChI=1S/C18H22N2O/c1-17(2,3)14-8-12(7-13(10-19)11-20)9-15(16(14)21)18(4,5)6/h7-9,21H,1-6H3	MZOPWQKISXCCTP-UHFFFAOYSA-N	CC(C)(C)c1cc(C=C(C#N)C#N)cc(c1O)C(C)(C)C	BroadT	BRD-K40255344	BRD-K40255344-001-05-1	Biomol International Inc.	EI-215	2840(V2)-3-N1305		CC(C)(C)c1cc(C=C(C#N)C#N)cc(c1O)C(C)(C)C	InChI=1S/C18H22N2O/c1-17(2,3)14-8-12(7-13(10-19)11-20)9-15(16(14)21)18(4,5)6/h7-9,21H,1-6H3	MZOPWQKISXCCTP-UHFFFAOYSA-N	282.173213344							82168
ABT-724	LSM-15492	BRD-K37714784, ABT-724	5025739	InChI=1S/C17H19N5/c1-2-6-15-14(5-1)19-16(20-15)13-21-9-11-22(12-10-21)17-7-3-4-8-18-17/h1-8H,9-13H2,(H,19,20)	FRPJGTNLZNXQEX-UHFFFAOYSA-N	C(N1CCN(CC1)c2ccccn2)c3nc4ccccc4[nH]3	BroadT	BRD-K37714784	BRD-K37714784-305-01-3	Tocris Bioscience	2214	1	Cl.Cl.Cl	C(N1CCN(CC1)c1ccccn1)c1nc2ccccc2[nH]1.Cl.Cl.Cl	InChI=1S/C17H19N5.3ClH/c1-2-6-15-14(5-1)19-16(20-15)13-21-9-11-22(12-10-21)17-7-3-4-8-18-17;;;/h1-8H,9-13H2,(H,19,20);3*1H	AZFUVPBLKQGSRI-UHFFFAOYSA-N	293.164045658							104134, 104134
3,7-Dihydroxyflavone	LSM-20937	3,7-Dihydroxy-Flavone, 3,7-Dihydroxyflavone, 7-Hydroxyflavonol, BRD-K35133923	5393152	InChI=1S/C15H10O4/c16-10-6-7-11-12(8-10)19-15(14(18)13(11)17)9-4-2-1-3-5-9/h1-8,16,18H	UWQJWDYDYIJWKY-UHFFFAOYSA-N	OC1=C(Oc2cc(O)ccc2C1=O)c3ccccc3	BroadT	BRD-K35133923	BRD-K35133923-001-02-3	MicroSource Discovery Systems Inc.	1504130			Oc1ccc2c(c1)oc(-c1ccccc1)c(O)c2=O	InChI=1S/C15H10O4/c16-10-6-7-11-12(8-10)19-15(14(18)13(11)17)9-4-2-1-3-5-9/h1-8,16,18H	UWQJWDYDYIJWKY-UHFFFAOYSA-N	254.0579088							109535, 109535
Concneorine	LSM-2629	Fillalbin	933171	InChI=1S/C16H21NO4/c1-17-11-4-5-12(17)9-13(8-11)21-16(19)10-3-6-14(18)15(7-10)20-2/h3,6-7,11-13,18H,4-5,8-9H2,1-2H3/t11-,12+,13?	OZKTVDIYALBSMA-FUNVUKJBSA-N	COc1cc(ccc1O)C(=O)OC2C[C@@H]3CC[C@H](C2)N3C	BroadT	BRD-K28667196	BRD-K28667196-001-02-9	Prestwick Chemical Inc.	Prestw-691	D0701-MP04-ST03-200-		COc1cc(ccc1O)C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)N2C	InChI=1S/C16H21NO4/c1-17-11-4-5-12(17)9-13(8-11)21-16(19)10-3-6-14(18)15(7-10)20-2/h3,6-7,11-13,18H,4-5,8-9H2,1-2H3/t11-,12+,13+	OZKTVDIYALBSMA-ITGUQSILSA-N	291.147058162							92504
PNU-282987	LSM-2634	BRD-K28863208, PNU282987, PNU-282987	9795278	InChI=1S/C14H17ClN2O/c15-12-3-1-11(2-4-12)14(18)16-13-9-17-7-5-10(13)6-8-17/h1-4,10,13H,5-9H2,(H,16,18)/t13-/m0/s1	WECKJONDRAUFDD-ZDUSSCGKSA-N	Clc1ccc(cc1)C(=O)N[C@H]2CN3CCC2CC3	BroadT	BRD-K28863208	BRD-K28863208-001-01-2	Tocris Bioscience	2303	1		Clc1ccc(cc1)C(=O)N[C@H]1CN2CCC1CC2	InChI=1S/C14H17ClN2O/c15-12-3-1-11(2-4-12)14(18)16-13-9-17-7-5-10(13)6-8-17/h1-4,10,13H,5-9H2,(H,16,18)/t13-/m0/s1	WECKJONDRAUFDD-ZDUSSCGKSA-N	264.102940894							92508, 92508
SC-514	LSM-2579	BRD-K26373640, SC-514	2807869	InChI=1S/C9H8N2OS2/c10-6-3-7(5-1-2-13-4-5)14-8(6)9(11)12/h1-4H,10H2,(H2,11,12)	BMUACLADCKCNKZ-UHFFFAOYSA-N	NC(=O)c1sc(cc1N)c2ccsc2	BroadT	BRD-K26373640	BRD-K26373640-001-02-8	Biomol International Inc.	EI-343	2832A(V2.2)-3-N1290		NC(=O)c1sc(cc1N)-c1ccsc1	InChI=1S/C9H8N2OS2/c10-6-3-7(5-1-2-13-4-5)14-8(6)9(11)12/h1-4H,10H2,(H2,11,12)	BMUACLADCKCNKZ-UHFFFAOYSA-N	224.007804276							92464
Xylazine	LSM-2477	Xylazine	5707	InChI=1S/C12H16N2S/c1-9-5-3-6-10(2)11(9)14-12-13-7-4-8-15-12/h3,5-6H,4,7-8H2,1-2H3,(H,13,14)	BPICBUSOMSTKRF-UHFFFAOYSA-N	Cc1cccc(C)c1NC2=NCCCS2	BroadT	BRD-K21565985	BRD-K21565985-001-04-3	MicroSource Discovery Systems Inc.	1501200			Cc1cccc(C)c1NC1=NCCCS1	InChI=1S/C12H16N2S/c1-9-5-3-6-10(2)11(9)14-12-13-7-4-8-15-12/h3,5-6H,4,7-8H2,1-2H3,(H,13,14)	BPICBUSOMSTKRF-UHFFFAOYSA-N	220.103419222							92386, 92386
ANANDAMIDE (22:4,N-6)	LSM-43901	Anandamide(22, Docosatetra-7z,10z,13z,16z-Enoyl Ethanolamide	5282273	InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(27)25-22-23-26/h6-7,9-10,12-13,15-16,26H,2-5,8,11,14,17-23H2,1H3,(H,25,27)/b7-6-,10-9-,13-12-,16-15-	FMVHVRYFQIXOAF-DOFZRALJSA-N	CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCCCC(=O)NCCO	BroadT	BRD-K30199352	BRD-K30199352-001-02-9	Biomol International Inc.	FA020	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCCCC(=O)NCCO	InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(27)25-22-23-26/h6-7,9-10,12-13,15-16,26H,2-5,8,11,14,17-23H2,1H3,(H,25,27)/b7-6-,10-9-,13-12-,16-15-	FMVHVRYFQIXOAF-DOFZRALJSA-N	375.313729562							34478
Phenamil	LSM-2472	Phenamil	4755	InChI=1S/C12H12ClN7O/c13-8-10(15)19-9(14)7(18-8)11(21)20-12(16)17-6-4-2-1-3-5-6/h1-5H,(H4,14,15,19)(H3,16,17,20,21)	NIOHELZQFBGCEO-UHFFFAOYSA-N	Nc1nc(N)c(nc1Cl)C(=O)NC(=N)Nc2ccccc2	BroadT	BRD-K21350491	BRD-K21350491-001-02-1	Biomol International Inc.	AC-131	2840(V2)-3-N1305		Nc1nc(N)c(nc1Cl)C(=O)NC(=N)Nc1ccccc1	InChI=1S/C12H12ClN7O/c13-8-10(15)19-9(14)7(18-8)11(21)20-12(16)17-6-4-2-1-3-5-6/h1-5H,(H4,14,15,19)(H3,16,17,20,21)	NIOHELZQFBGCEO-UHFFFAOYSA-N	305.079185784							34919, 34919
Pinosylvin Methyl Ether	LSM-43902	SID26749505, SID87336079	5281719	InChI=1S/C15H14O2/c1-17-15-10-13(9-14(16)11-15)8-7-12-5-3-2-4-6-12/h2-11,16H,1H3/b8-7+	JVIXPWIEOVZVJC-BQYQJAHWSA-N	COc1cc(O)cc(\C=C\c2ccccc2)c1	BroadT	BRD-K18438502	BRD-K18438502-001-02-6	MicroSource Discovery Systems Inc.	201067			COc1cc(O)cc(\C=C\c2ccccc2)c1	InChI=1S/C15H14O2/c1-17-15-10-13(9-14(16)11-15)8-7-12-5-3-2-4-6-12/h2-11,16H,1H3/b8-7+	JVIXPWIEOVZVJC-BQYQJAHWSA-N	226.099379688							8227
Cyproheptadine	LSM-5419	Cyproheptadine	2913	InChI=1S/C21H21N/c1-22-14-12-18(13-15-22)21-19-8-4-2-6-16(19)10-11-17-7-3-5-9-20(17)21/h2-11H,12-15H2,1H3	JJCFRYNCJDLXIK-UHFFFAOYSA-N	CN1CCC(=C2c3ccccc3C=Cc4ccccc24)CC1	BroadT	BRD-K28143534	BRD-K28143534-001-01-4	Biomol International Inc.	AC-550	2813-N1283		CN1CCC(CC1)=C1c2ccccc2C=Cc2ccccc12	InChI=1S/C21H21N/c1-22-14-12-18(13-15-22)21-19-8-4-2-6-16(19)10-11-17-7-3-5-9-20(17)21/h2-11H,12-15H2,1H3	JJCFRYNCJDLXIK-UHFFFAOYSA-N	287.167399682							4046, 4046
Skimmianine	LSM-2560	Skimmianine	6760	InChI=1S/C14H13NO4/c1-16-10-5-4-8-11(13(10)18-3)15-14-9(6-7-19-14)12(8)17-2/h4-7H,1-3H3	SLSIBLKBHNKZTB-UHFFFAOYSA-N	COc1ccc2c(OC)c3ccoc3nc2c1OC	BroadT	BRD-K25741894	BRD-K25741894-001-03-8	Prestwick Chemical Inc.	Prestw-668	D0701-MP04-ST03-200-		COc1ccc2c(OC)c3ccoc3nc2c1OC	InChI=1S/C14H13NO4/c1-16-10-5-4-8-11(13(10)18-3)15-14-9(6-7-19-14)12(8)17-2/h4-7H,1-3H3	SLSIBLKBHNKZTB-UHFFFAOYSA-N	259.084457906							9172
8-Cyclopentyltheophylline	LSM-20940	8-Cyclopentyltheophylline, 8-Cyclopentyl Theophylline, SID11110875, SID26747498	1917	InChI=1S/C12H16N4O2/c1-15-10-8(11(17)16(2)12(15)18)13-9(14-10)7-5-3-4-6-7/h7H,3-6H2,1-2H3,(H,13,14)	SCVHFRLUNIOSGI-UHFFFAOYSA-N	CN1C(=O)N(C)c2[nH]c(nc2C1=O)C3CCCC3	BroadT	BRD-K38347298	BRD-K38347298-001-02-3	MicroSource Discovery Systems Inc.	2300193			Cn1c2[nH]c(nc2c(=O)n(C)c1=O)C1CCCC1	InChI=1S/C12H16N4O2/c1-15-10-8(11(17)16(2)12(15)18)13-9(14-10)7-5-3-4-6-7/h7H,3-6H2,1-2H3,(H,13,14)	SCVHFRLUNIOSGI-UHFFFAOYSA-N	248.127325792							109538
Methylprednisolone	LSM-5485	Medrol, Methylprednisolone, U-67590A	6741	InChI=1S/C22H30O5/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,9,12,14-15,17,19,23,25,27H,5,7-8,10-11H2,1-3H3/t12-,14-,15-,17-,19+,20-,21-,22-/m0/s1	VHRSUDSXCMQTMA-PJHHCJLFSA-N	C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]4(C)C=CC(=O)C=C14	BroadT	BRD-K35240538	BRD-K35240538-001-03-1	Prestwick Chemical Inc.	Prestw-279	D0701-MP04-ST03-200-		C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)C=CC(=O)C=C12	InChI=1S/C22H30O5/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,9,12,14-15,17,19,23,25,27H,5,7-8,10-11H2,1-3H3/t12-,14-,15-,17-,19+,20-,21-,22-/m0/s1	VHRSUDSXCMQTMA-PJHHCJLFSA-N	374.20932406							6888, 6888
INCA-6	LSM-2729	SID26753213	230748	InChI=1S/C20H12O2/c21-15-9-10-16(22)20-18-12-6-2-1-5-11(12)17(19(15)20)13-7-3-4-8-14(13)18/h1-10,17-18H	GCHPUOHXXCNSQL-UHFFFAOYSA-N	O=C1C=CC(=O)C2=C1C3c4ccccc4C2c5ccccc35	BroadT	BRD-K33308633	BRD-K33308633-001-01-6	Tocris Bioscience	2162	1		O=C1C=CC(=O)C2=C1C1c3ccccc3C2c2ccccc12	InChI=1S/C20H12O2/c21-15-9-10-16(22)20-18-12-6-2-1-5-11(12)17(19(15)20)13-7-3-4-8-14(13)18/h1-10,17-18H	GCHPUOHXXCNSQL-UHFFFAOYSA-N	284.083729624							92582
Methyl beta-carboline-3 carboxylate	LSM-2630	Methyl-Beta-Carboline-3-Carboxylate	107704	InChI=1S/C13H10N2O2/c1-17-13(16)11-6-9-8-4-2-3-5-10(8)15-12(9)7-14-11/h2-7,15H,1H3	UKHFPVCOXBJPIN-UHFFFAOYSA-N	COC(=O)c1cc2c(cn1)[nH]c3ccccc23	BroadT	BRD-K28680267	BRD-K28680267-001-01-8	Biomol International Inc.	AC-977	2819-N1292		COC(=O)c1cc2c(cn1)[nH]c1ccccc21	InChI=1S/C13H10N2O2/c1-17-13(16)11-6-9-8-4-2-3-5-10(8)15-12(9)7-14-11/h2-7,15H,1H3	UKHFPVCOXBJPIN-UHFFFAOYSA-N	226.07422758							92505
Prometryn	LSM-20941	SID89854492, SID50107261	4929	InChI=1S/C10H19N5S/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)	AAEVYOVXGOFMJO-UHFFFAOYSA-N	CSc1nc(NC(C)C)nc(NC(C)C)n1	BroadT	BRD-K32582260	BRD-K32582260-001-02-5	MicroSource Discovery Systems Inc.	330037			CSc1nc(NC(C)C)nc(NC(C)C)n1	InChI=1S/C10H19N5S/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)	AAEVYOVXGOFMJO-UHFFFAOYSA-N	241.136116348							26276
221243-82-9	LSM-20942	BRD-K29542628	4877	InChI=1S/C19H19N5/c1-19(2,3)24-18-15(17(20)21-11-22-18)16(23-24)14-10-6-8-12-7-4-5-9-13(12)14/h4-11H,1-3H3,(H2,20,21,22)	XSHQBIXMLULFEV-UHFFFAOYSA-N	CC(C)(C)n1nc(c2cccc3ccccc23)c4c(N)ncnc14	BroadT	BRD-K29542628	BRD-K29542628-001-01-3	Tocris Bioscience	3063	1		CC(C)(C)n1nc(-c2cccc3ccccc23)c2c(N)ncnc12	InChI=1S/C19H19N5/c1-19(2,3)24-18-15(17(20)21-11-22-18)16(23-24)14-10-6-8-12-7-4-5-9-13(12)14/h4-11H,1-3H3,(H2,20,21,22)	XSHQBIXMLULFEV-UHFFFAOYSA-N	317.164045658							52310
Isocorydine	LSM-20943	Isocorydine, (+)-Isocorydine	10143	InChI=1S/C20H23NO4/c1-21-8-7-12-10-15(24-3)20(25-4)18-16(12)13(21)9-11-5-6-14(23-2)19(22)17(11)18/h5-6,10,13,22H,7-9H2,1-4H3/t13-/m0/s1	QELDJEKNFOQJOY-ZDUSSCGKSA-N	COc1ccc2C[C@@H]3N(C)CCc4cc(OC)c(OC)c(c34)c2c1O	BroadT	BRD-K37049577	BRD-K37049577-001-04-4	MicroSource Discovery Systems Inc.	1500860			COc1ccc2C[C@@H]3N(C)CCc4cc(OC)c(OC)c(c34)-c2c1O	InChI=1S/C20H23NO4/c1-21-8-7-12-10-15(24-3)20(25-4)18-16(12)13(21)9-11-5-6-14(23-2)19(22)17(11)18/h5-6,10,13,22H,7-9H2,1-4H3/t13-/m0/s1	QELDJEKNFOQJOY-ZDUSSCGKSA-N	341.162708226							6000, 6000
Devazepide	LSM-2674	Devazepide, BRD-K31238592, MK-329, L-364718	443375	InChI=1S/C25H20N4O2/c1-29-21-14-8-6-12-18(21)22(16-9-3-2-4-10-16)27-23(25(29)31)28-24(30)20-15-17-11-5-7-13-19(17)26-20/h2-15,23,26H,1H3,(H,28,30)/t23-/m1/s1	NFHRQQKPEBFUJK-HSZRJFAPSA-N	CN1C(=O)[C@@H](NC(=O)c2cc3ccccc3[nH]2)N=C(c4ccccc4)c5ccccc15	BroadT	BRD-K31238592	BRD-K31238592-001-01-6	Tocris Bioscience	2304	1		CN1c2ccccc2C(=N[C@H](NC(=O)c2cc3ccccc3[nH]2)C1=O)c1ccccc1	InChI=1S/C25H20N4O2/c1-29-21-14-8-6-12-18(21)22(16-9-3-2-4-10-16)27-23(25(29)31)28-24(30)20-15-17-11-5-7-13-19(17)26-20/h2-15,23,26H,1H3,(H,28,30)/t23-/m1/s1	NFHRQQKPEBFUJK-HSZRJFAPSA-N	408.15862592							4460
Methysergide	LSM-2786	Methysergide, Sansert	9681	InChI=1S/C21H27N3O2/c1-4-15(12-25)22-21(26)14-8-17-16-6-5-7-18-20(16)13(10-23(18)2)9-19(17)24(3)11-14/h5-8,10,14-15,19,25H,4,9,11-12H2,1-3H3,(H,22,26)/t14-,15+,19-/m1/s1	KPJZHOPZRAFDTN-ZRGWGRIASA-N	CC[C@@H](CO)NC(=O)[C@H]1CN(C)[C@@H]2Cc3cn(C)c4cccc(C2=C1)c34	BroadT	BRD-K35941380	BRD-K35941380-001-01-7	Biomol International Inc.	AC-577	2813-N1283		CC[C@@H](CO)NC(=O)[C@H]1CN(C)[C@@H]2Cc3cn(C)c4cccc(C2=C1)c34	InChI=1S/C21H27N3O2/c1-4-15(12-25)22-21(26)14-8-17-16-6-5-7-18-20(16)13(10-23(18)2)9-19(17)24(3)11-14/h5-8,10,14-15,19,25H,4,9,11-12H2,1-3H3,(H,22,26)/t14-,15+,19-/m1/s1	KPJZHOPZRAFDTN-ZRGWGRIASA-N	353.210327134							92629, 92629
Chrysin	LSM-6566	NSC-407436	5281607	InChI=1S/C15H10O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-8,16-17H	RTIXKCRFFJGDFG-UHFFFAOYSA-N	Oc1cc(O)c2C(=O)C=C(Oc2c1)c3ccccc3	BroadT	BRD-K22861715	BRD-K22861715-001-03-4	AnalytiCon Discovery GmbH	NP-005901			Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccccc1	InChI=1S/C15H10O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-8,16-17H	RTIXKCRFFJGDFG-UHFFFAOYSA-N	254.0579088							75095
SB 203186	LSM-2594	SB 2031861-PIPERIDINYLETHYL-1H-INDOLE-3-CARBOXYLATE HYDROCHLORIDE, SB-203186	3272300	InChI=1S/C16H20N2O2/c19-16(20-11-10-18-8-4-1-5-9-18)14-12-17-15-7-3-2-6-13(14)15/h2-3,6-7,12,17H,1,4-5,8-11H2	YGKPIROTKVQCCU-UHFFFAOYSA-N	O=C(OCCN1CCCCC1)c2c[nH]c3ccccc23	BroadT	BRD-K27141178	BRD-K27141178-001-01-0	Biomol International Inc.	AC-571	2813-N1283		O=C(OCCN1CCCCC1)c1c[nH]c2ccccc12	InChI=1S/C16H20N2O2/c19-16(20-11-10-18-8-4-1-5-9-18)14-12-17-15-7-3-2-6-13(14)15/h2-3,6-7,12,17H,1,4-5,8-11H2	YGKPIROTKVQCCU-UHFFFAOYSA-N	272.1524779							92477, 92477
DP-5-CT	LSM-2709	N,N-Dipropyl-5-Carboxamidotryptamine Maleate, SID11111033, SID26755673, SID50111034, SID90340592	156314	InChI=1S/C17H25N3O/c1-3-8-20(9-4-2)10-7-14-12-19-16-6-5-13(17(18)21)11-15(14)16/h5-6,11-12,19H,3-4,7-10H2,1-2H3,(H2,18,21)	DPXOFRGRKPFZOD-UHFFFAOYSA-N	CCCN(CCC)CCc1c[nH]c2ccc(cc12)C(=O)N	BroadT	BRD-K32645441	BRD-K32645441-001-01-4	Biomol International Inc.	AC-845	2813-N1283		CCCN(CCC)CCc1c[nH]c2ccc(cc12)C(N)=O	InChI=1S/C17H25N3O/c1-3-8-20(9-4-2)10-7-14-12-19-16-6-5-13(17(18)21)11-15(14)16/h5-6,11-12,19H,3-4,7-10H2,1-2H3,(H2,18,21)	DPXOFRGRKPFZOD-UHFFFAOYSA-N	287.19976245							92566, 92566
Denbufylline	LSM-2837	Denbufylline, BRL-30892	2984	InChI=1S/C16H24N4O3/c1-4-6-8-19-14-13(18(11-17-14)10-12(3)21)15(22)20(16(19)23)9-7-5-2/h11H,4-10H2,1-3H3	HJPRDDKCXVCFOH-UHFFFAOYSA-N	CCCCN1C(=O)N(CCCC)c2ncn(CC(=O)C)c2C1=O	BroadT	BRD-K37792168	BRD-K37792168-001-01-0	Calbiochem	253500			CCCCn1c2ncn(CC(C)=O)c2c(=O)n(CCCC)c1=O	InChI=1S/C16H24N4O3/c1-4-6-8-19-14-13(18(11-17-14)10-12(3)21)15(22)20(16(19)23)9-7-5-2/h11H,4-10H2,1-3H3	HJPRDDKCXVCFOH-UHFFFAOYSA-N	320.184840668							92669
Zardaverine	LSM-2833	Zardaverine	5723	InChI=1S/C12H10F2N2O3/c1-18-10-6-7(2-4-9(10)19-12(13)14)8-3-5-11(17)16-15-8/h2-6,12H,1H3,(H,16,17)	HJMQDJPMQIHLPB-UHFFFAOYSA-N	COc1cc(ccc1OC(F)F)C2=NNC(=O)C=C2	BroadT	BRD-K37561857	BRD-K37561857-001-04-9	Biomol International Inc.	PD-195	2840(V2)-3-N1305		COc1cc(ccc1OC(F)F)-c1ccc(=O)[nH]n1	InChI=1S/C12H10F2N2O3/c1-18-10-6-7(2-4-9(10)19-12(13)14)8-3-5-11(17)16-15-8/h2-6,12H,1H3,(H,16,17)	HJMQDJPMQIHLPB-UHFFFAOYSA-N	268.0659486							46548
Epiafzelechin Trimethyl Ether	LSM-20944		6708630	InChI=1S/C18H20O5/c1-20-12-6-4-11(5-7-12)18-15(19)10-14-16(22-3)8-13(21-2)9-17(14)23-18/h4-9,15,18-19H,10H2,1-3H3/t15-,18-/m1/s1	NMLBREXWQRPOJH-CRAIPNDOSA-N	COc1ccc(cc1)[C@H]2Oc3cc(OC)cc(OC)c3C[C@H]2O	BroadT	BRD-K25064302	BRD-K25064302-001-02-3	MicroSource Discovery Systems Inc.	210211			COc1ccc(cc1)[C@H]1Oc2cc(OC)cc(OC)c2C[C@H]1O	InChI=1S/C18H20O5/c1-20-12-6-4-11(5-7-12)18-15(19)10-14-16(22-3)8-13(21-2)9-17(14)23-18/h4-9,15,18-19H,10H2,1-3H3/t15-,18-/m1/s1	NMLBREXWQRPOJH-CRAIPNDOSA-N	316.13107374							109539
4-Chloro-2-(imidazolin-2-yl)isoindoline	LSM-2572	BRD-K26160755, SID11113762	127951	InChI=1S/C11H12ClN3/c12-10-3-1-2-8-6-15(7-9(8)10)11-13-4-5-14-11/h1-3H,4-7H2,(H,13,14)	IVCMOOBKRRDNHX-UHFFFAOYSA-N	Clc1cccc2CN(Cc12)C3=NCCN3	BroadT	BRD-K26160755	BRD-K26160755-003-01-8	Tocris Bioscience	889	12	Cl	Clc1cccc2CN(Cc12)C1=NCCN1.Cl	InChI=1S/C11H12ClN3.ClH/c12-10-3-1-2-8-6-15(7-9(8)10)11-13-4-5-14-11;/h1-3H,4-7H2,(H,13,14);1H	WRYJNVYEPVATQV-UHFFFAOYSA-N	221.071975124							92457
3,4 Dichloroisocoumarin	LSM-20945	3,4-Dichloroisocoumarin	1609	InChI=1S/C9H4Cl2O2/c10-7-5-3-1-2-4-6(5)9(12)13-8(7)11/h1-4H	SUGXUUGGLDCZKB-UHFFFAOYSA-N	ClC1=C(Cl)c2ccccc2C(=O)O1	BroadT	BRD-K23704908	BRD-K23704908-001-03-2	Biomol International Inc.	PI-110	2840(V2)-3-N1305		Clc1oc(=O)c2ccccc2c1Cl	InChI=1S/C9H4Cl2O2/c10-7-5-3-1-2-4-6(5)9(12)13-8(7)11/h1-4H	SUGXUUGGLDCZKB-UHFFFAOYSA-N	213.958834788							109540
Paroxetine	LSM-2843	Paroxetine, Paxil, Pexeva, BRL-29060, Paxil [As Hydrochloride]	43815	InChI=1S/C19H20FNO3/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18/h1-6,9,14,17,21H,7-8,10-12H2/t14-,17-/m0/s1	AHOUBRCZNHFOSL-YOEHRIQHSA-N	Fc1ccc(cc1)[C@@H]2CCNC[C@H]2COc3ccc4OCOc4c3	BroadT	BRD-K37991163	BRD-K37991163-050-05-1	Tocris Bioscience	2141	1	OC(=O)/C=C\C(=O)O	Fc1ccc(cc1)[C@@H]1CCNC[C@H]1COc1ccc2OCOc2c1.OC(=O)/C=C\C(=O)O	InChI=1S/C19H20FNO3.C4H4O4/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18;5-3(6)1-2-4(7)8/h1-6,9,14,17,21H,7-8,10-12H2;1-2H,(H,5,6)(H,7,8)/b;2-1-/t14-,17-;/m0./s1	AEIUZSKXSWGSRU-QXGDPHCHSA-N	329.14272171							7936, 7936, 7936, 7936, 7936, 7936, 7936
Betamethasone	LSM-2864	Betatrex, Betasolan, Betamethasone, Celestone, Dermabet, Flubenisolone, Lotrisone, Alphatrex, Taclonex, Uticort, SCH-4831, Beta-Val, Beta-Methasone	9782	InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15-,16-,17-,19-,20-,21-,22-/m0/s1	UREBDLICKHMUKA-DVTGEIKXSA-N	C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO	BroadT	BRD-K39188321	BRD-K39188321-001-03-9	Prestwick Chemical Inc.	Prestw-362	D0701-MP04-ST03-200-		C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO	InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15-,16-,17-,19-,20-,21-,22-/m0/s1	UREBDLICKHMUKA-DVTGEIKXSA-N	392.199902228							3077, 3077, 3077
Skiii	LSM-2462	SID26753202, SID29215127, SID103904804, SKI-II	753704	InChI=1S/C15H11ClN2OS/c16-11-3-1-10(2-4-11)14-9-20-15(18-14)17-12-5-7-13(19)8-6-12/h1-9,19H,(H,17,18)	ZFGXZJKLOFCECI-UHFFFAOYSA-N	Oc1ccc(Nc2nc(cs2)c3ccc(Cl)cc3)cc1	BroadT	BRD-K20755323	BRD-K20755323-001-01-8	Tocris Bioscience	2097	1		Oc1ccc(Nc2nc(cs2)-c2ccc(Cl)cc2)cc1	InChI=1S/C15H11ClN2OS/c16-11-3-1-10(2-4-11)14-9-20-15(18-14)17-12-5-7-13(19)8-6-12/h1-9,19H,(H,17,18)	ZFGXZJKLOFCECI-UHFFFAOYSA-N	302.028061392							92375
Coralyne Sulfoacetate	LSM-15517	Coralyne	23307	InChI=1S/C22H22NO4/c1-13-16-11-21(26-4)20(25-3)10-15(16)8-18-17-12-22(27-5)19(24-2)9-14(17)6-7-23(13)18/h6-12H,1-5H3/q+1	GOEJQGGEIVSVOK-UHFFFAOYSA-N	COc1cc2cc[n+]3c(C)c4cc(OC)c(OC)cc4cc3c2cc1OC	BroadT	BRD-K24443173	BRD-K24443173-311-03-7	Prestwick Chemical Inc.	Prestw-431	D0701-MP04-ST03-200-	O.Cl	COc1cc2cc3c4cc(OC)c(OC)cc4cc[n+]3c(C)c2cc1OC.O.Cl	InChI=1S/C22H22NO4.ClH.H2O/c1-13-16-11-21(26-4)20(25-3)10-15(16)8-18-17-12-22(27-5)19(24-2)9-14(17)6-7-23(13)18;;/h6-12H,1-5H3;1H;1H2/q+1;;	FJIKEFFDENQLIH-UHFFFAOYSA-N	364.154883194							104157, 104157, 104157, 104157
Sulfacetamide	LSM-5374	Sulfacetamide, Sulphacetamide, Sulster, Klaron, Cetamide, Sulfair-15, Sulten-10, Sulfacel-15, Sulf-15, Sulf-10, Ocusulf-30, Ocusulf-10, Bleph-30, Bleph-10, Sulfacetamide (Triple Sulfa), FML-S	5320	InChI=1S/C8H10N2O3S/c1-6(11)10-14(12,13)8-4-2-7(9)3-5-8/h2-5H,9H2,1H3,(H,10,11)	SKIVFJLNDNKQPD-UHFFFAOYSA-N	CC(=O)NS(=O)(=O)c1ccc(N)cc1	BroadT	BRD-K21520694	BRD-K21520694-001-02-4	MicroSource Discovery Systems Inc.	1500545			CC(=O)NS(=O)(=O)c1ccc(N)cc1	InChI=1S/C8H10N2O3S/c1-6(11)10-14(12,13)8-4-2-7(9)3-5-8/h2-5H,9H2,1H3,(H,10,11)	SKIVFJLNDNKQPD-UHFFFAOYSA-N	214.04121289							63845, 63845, 63845
Pirenperone	LSM-2550	Pirenperone, R-47465	4847	InChI=1S/C23H24FN3O2/c1-16-20(23(29)27-12-3-2-4-21(27)25-16)11-15-26-13-9-18(10-14-26)22(28)17-5-7-19(24)8-6-17/h2-8,12,18H,9-11,13-15H2,1H3	HXCNRYXBZNHDNE-UHFFFAOYSA-N	CC1=C(CCN2CCC(CC2)C(=O)c3ccc(F)cc3)C(=O)N4C=CC=CC4=N1	BroadT	BRD-K25224017	BRD-K25224017-001-04-5	MicroSource Discovery Systems Inc.	1504188			Cc1nc2ccccn2c(=O)c1CCN1CCC(CC1)C(=O)c1ccc(F)cc1	InChI=1S/C23H24FN3O2/c1-16-20(23(29)27-12-3-2-4-21(27)25-16)11-15-26-13-9-18(10-14-26)22(28)17-5-7-19(24)8-6-17/h2-8,12,18H,9-11,13-15H2,1H3	HXCNRYXBZNHDNE-UHFFFAOYSA-N	393.185255238							92444
5-(Z)-7-(4-o-hydroxyphenyl-2-trifluoromethyl-1,3 dioxan-cis-5-yl)heptenoic acid	LSM-43903	BRD-K29133151, SID11113729	5311390	InChI=1S/C18H21F3O5/c19-18(20,21)17-25-11-12(7-3-1-2-4-10-15(23)24)16(26-17)13-8-5-6-9-14(13)22/h1,3,5-6,8-9,12,16-17,22H,2,4,7,10-11H2,(H,23,24)/b3-1-/t12-,16+,17+/m1/s1	ZWAVGFSZMACJHA-PMNBYGLBSA-N	OC(=O)CCC\C=C/C[C@@H]1CO[C@@H](O[C@@H]1c2ccccc2O)C(F)(F)F	BroadT	BRD-K29133151	BRD-K29133151-001-02-4	MicroSource Discovery Systems Inc.	1502067			OC(=O)CCC\C=C/C[C@@H]1CO[C@@H](O[C@@H]1c1ccccc1O)C(F)(F)F	InChI=1S/C18H21F3O5/c19-18(20,21)17-25-11-12(7-3-1-2-4-10-15(23)24)16(26-17)13-8-5-6-9-14(13)22/h1,3,5-6,8-9,12,16-17,22H,2,4,7,10-11H2,(H,23,24)/b3-1-/t12-,16+,17+/m1/s1	ZWAVGFSZMACJHA-PMNBYGLBSA-N	374.134108372							
ZM-241385	LSM-2444	ZM 241385, ZM-241385, BRD-K19605405	176407	InChI=1S/C16H15N7O2/c17-14-20-15(18-8-7-10-3-5-11(24)6-4-10)21-16-19-13(22-23(14)16)12-2-1-9-25-12/h1-6,9,24H,7-8H2,(H3,17,18,19,20,21,22)	PWTBZOIUWZOPFT-UHFFFAOYSA-N	Nc1nc(NCCc2ccc(O)cc2)nc3nc(nn13)c4occc4	BroadT	BRD-K19605405	BRD-K19605405-001-01-9	Tocris Bioscience	1036	12		Nc1nc(NCCc2ccc(O)cc2)nc2nc(nn12)-c1ccco1	InChI=1S/C16H15N7O2/c17-14-20-15(18-8-7-10-3-5-11(24)6-4-10)21-16-19-13(22-23(14)16)12-2-1-9-25-12/h1-6,9,24H,7-8H2,(H3,17,18,19,20,21,22)	PWTBZOIUWZOPFT-UHFFFAOYSA-N	337.12872279							92361, 92361
92953-43-0	LSM-2465	SID26751741, SID26751742, U-54494A	183470	InChI=1S/C18H24Cl2N2O/c1-21(18(23)13-8-9-14(19)15(20)12-13)16-6-2-3-7-17(16)22-10-4-5-11-22/h8-9,12,16-17H,2-7,10-11H2,1H3/t16-,17+/m1/s1	JUBNVWGVNWIXMB-SJORKVTESA-N	CN([C@@H]1CCCC[C@@H]1N2CCCC2)C(=O)c3ccc(Cl)c(Cl)c3	BroadT	BRD-K20995441	BRD-K20995441-001-01-7	Biomol International Inc.	EA-144	2817-N1277		CN([C@@H]1CCCC[C@@H]1N1CCCC1)C(=O)c1ccc(Cl)c(Cl)c1	InChI=1S/C18H24Cl2N2O/c1-21(18(23)13-8-9-14(19)15(20)12-13)16-6-2-3-7-17(16)22-10-4-5-11-22/h8-9,12,16-17H,2-7,10-11H2,1H3/t16-,17+/m1/s1	JUBNVWGVNWIXMB-SJORKVTESA-N	354.126568828							92378
Naproxol	LSM-2742	Naproxol, RS-4034	3032818	InChI=1S/C14H16O2/c1-10(9-15)11-3-4-13-8-14(16-2)6-5-12(13)7-11/h3-8,10,15H,9H2,1-2H3/t10-/m1/s1	LTRANDSQVZFZDG-SNVBAGLBSA-N	COc1ccc2cc(ccc2c1)[C@H](C)CO	BroadT	BRD-K34014345	BRD-K34014345-001-02-6	MicroSource Discovery Systems Inc.	1503801			COc1ccc2cc(ccc2c1)[C@H](C)CO	InChI=1S/C14H16O2/c1-10(9-15)11-3-4-13-8-14(16-2)6-5-12(13)7-11/h3-8,10,15H,9H2,1-2H3/t10-/m1/s1	LTRANDSQVZFZDG-SNVBAGLBSA-N	216.115029752							61022
BRD-K38477985	LSM-2854		44483329	InChI=1S/C18H22N2O/c1-17(2,3)14-9-12(8-13(11-19)20-7)10-15(16(14)21)18(4,5)6/h8-10,21H,1-6H3	MKUVGSJPVXTADZ-UHFFFAOYSA-N	CC(C)(C)c1cc(C=C(C#N)[N+]#[C-])cc(c1O)C(C)(C)C	BroadT	BRD-K38477985	BRD-K38477985-001-01-8	Tocris Bioscience	479	1		CC(C)(C)c1cc(C=C(C#N)[N+]#[C-])cc(c1O)C(C)(C)C	InChI=1S/C18H22N2O/c1-17(2,3)14-9-12(8-13(11-19)20-7)10-15(16(14)21)18(4,5)6/h8-10,21H,1-6H3	MKUVGSJPVXTADZ-UHFFFAOYSA-N	282.173213344							92678
SPBIO_000926	LSM-2903	SID26749714, Baeomycesic Acid	6710741	InChI=1S/C19H18O8/c1-8-5-13(26-4)11(7-20)17(22)14(8)19(25)27-12-6-9(2)16(21)15(10(12)3)18(23)24/h5-7,21-22H,1-4H3,(H,23,24)	IGTAVCGEZLIHKG-UHFFFAOYSA-N	COc1cc(C)c(C(=O)Oc2cc(C)c(O)c(C(=O)O)c2C)c(O)c1C=O	BroadT	BRD-K40742111	BRD-K40742111-001-02-6	MicroSource Discovery Systems Inc.	1505218			COc1cc(C)c(C(=O)Oc2cc(C)c(O)c(C(O)=O)c2C)c(O)c1C=O	InChI=1S/C19H18O8/c1-8-5-13(26-4)11(7-20)17(22)14(8)19(25)27-12-6-9(2)16(21)15(10(12)3)18(23)24/h5-7,21-22H,1-4H3,(H,23,24)	IGTAVCGEZLIHKG-UHFFFAOYSA-N	374.100167536							92718
Quinpirole	LSM-2582	Quinpirole	54562	InChI=1S/C13H21N3/c1-2-5-16-6-3-4-10-7-12-11(8-13(10)16)9-14-15-12/h9-10,13H,2-8H2,1H3,(H,14,15)/t10-,13-/m1/s1	FTSUPYGMFAPCFZ-ZWNOBZJWSA-N	CCCN1CCC[C@@H]2Cc3n[nH]cc3C[C@@H]12	BroadT	BRD-K26548821	BRD-K26548821-001-01-8	Biomol International Inc.	D-109	2812-3-N1298		CCCN1CCC[C@@H]2Cc3n[nH]cc3C[C@@H]12	InChI=1S/C13H21N3/c1-2-5-16-6-3-4-10-7-12-11(8-13(10)16)9-14-15-12/h9-10,13H,2-8H2,1H3,(H,14,15)/t10-,13-/m1/s1	FTSUPYGMFAPCFZ-ZWNOBZJWSA-N	219.173547702							75401, 75401, 75401
Ethionamide	LSM-5620	1314 TH, Ethionamide, Trecator, Trecator-SC	2761171	InChI=1S/C8H10N2S/c1-2-7-5-6(8(9)11)3-4-10-7/h3-5H,2H2,1H3,(H2,9,11)	AEOCXXJPGCBFJA-UHFFFAOYSA-N	CCc1cc(ccn1)C(=S)N	BroadT	BRD-K33710385	BRD-K33710385-001-05-4	Prestwick Chemical Inc.	Prestw-526	D0701-MP04-ST03-200-		CCc1cc(ccn1)C(N)=S	InChI=1S/C8H10N2S/c1-2-7-5-6(8(9)11)3-4-10-7/h3-5H,2H2,1H3,(H2,9,11)	AEOCXXJPGCBFJA-UHFFFAOYSA-N	166.05646903							4885
Fluprostenol	LSM-42934	Fluprostenol	5311100	InChI=1S/C23H29F3O6/c24-23(25,26)15-6-5-7-17(12-15)32-14-16(27)10-11-19-18(20(28)13-21(19)29)8-3-1-2-4-9-22(30)31/h1,3,5-7,10-12,16,18-21,27-29H,2,4,8-9,13-14H2,(H,30,31)/b3-1-,11-10+/t16-,18-,19-,20+,21-/m1/s1	WWSWYXNVCBLWNZ-QIZQQNKQSA-N	O[C@@H](COc1cccc(c1)C(F)(F)F)\C=C\[C@H]2[C@H](O)C[C@H](O)[C@@H]2C\C=C/CCCC(=O)O	BroadT	BRD-K31611373	BRD-K31611373-001-02-7	Biomol International Inc.	RA105	2840(V2)-3-N1305		O[C@@H](COc1cccc(c1)C(F)(F)F)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O	InChI=1S/C23H29F3O6/c24-23(25,26)15-6-5-7-17(12-15)32-14-16(27)10-11-19-18(20(28)13-21(19)29)8-3-1-2-4-9-22(30)31/h1,3,5-7,10-12,16,18-21,27-29H,2,4,8-9,13-14H2,(H,30,31)/b3-1-,11-10+/t16-,18-,19-,20+,21-/m1/s1	WWSWYXNVCBLWNZ-QIZQQNKQSA-N	458.191623248							60782
T091317	LSM-2509	T0901317, T-0901317, BRD-K23383398	447912	InChI=1S/C17H12F9NO3S/c18-14(19,20)10-27(31(29,30)13-4-2-1-3-5-13)12-8-6-11(7-9-12)15(28,16(21,22)23)17(24,25)26/h1-9,28H,10H2	SGIWFELWJPNFDH-UHFFFAOYSA-N	OC(c1ccc(cc1)N(CC(F)(F)F)S(=O)(=O)c2ccccc2)(C(F)(F)F)C(F)(F)F	BroadT	BRD-K23383398	BRD-K23383398-001-01-6	Tocris Bioscience	2373	1		OC(c1ccc(cc1)N(CC(F)(F)F)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F	InChI=1S/C17H12F9NO3S/c18-14(19,20)10-27(31(29,30)13-4-2-1-3-5-13)12-8-6-11(7-9-12)15(28,16(21,22)23)17(24,25)26/h1-9,28H,10H2	SGIWFELWJPNFDH-UHFFFAOYSA-N	481.039417744							
Immepip	LSM-2567	Immepip, BRD-K25906698	3035842	InChI=1S/C9H15N3/c1-3-10-4-2-8(1)5-9-6-11-7-12-9/h6-8,10H,1-5H2,(H,11,12)	MCNGUYXRBCIGOV-UHFFFAOYSA-N	C(C1CCNCC1)c2c[nH]cn2	BroadT	BRD-K25906698	BRD-K25906698-303-01-9	Tocris Bioscience	932	4	Br.Br	C(C1CCNCC1)c1c[nH]cn1.Br.Br	InChI=1S/C9H15N3.2BrH/c1-3-10-4-2-8(1)5-9-6-11-7-12-9;;/h6-8,10H,1-5H2,(H,11,12);2*1H	YGNJPNRDGXJQJX-UHFFFAOYSA-N	165.12659751							81390
Aklomide	LSM-20947	Aklomide, Clomide	2075	InChI=1S/C7H5ClN2O3/c8-6-3-4(10(12)13)1-2-5(6)7(9)11/h1-3H,(H2,9,11)	GFGSZUNNBQXGMK-UHFFFAOYSA-N	NC(=O)c1ccc(cc1Cl)[N+](=O)[O-]	BroadT	BRD-K26807903	BRD-K26807903-001-02-7	MicroSource Discovery Systems Inc.	1503014			NC(=O)c1ccc(cc1Cl)[N+]([O-])=O	InChI=1S/C7H5ClN2O3/c8-6-3-4(10(12)13)1-2-5(6)7(9)11/h1-3H,(H2,9,11)	GFGSZUNNBQXGMK-UHFFFAOYSA-N	199.99886975							109542
5ALPHA-THDOC	LSM-20948	5-Alpha-Pregnane-3-Alpha-2,1-Diol-20-one, SID26756640	101771	InChI=1S/C21H34O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h13-18,22-23H,3-12H2,1-2H3/t13-,14+,15-,16-,17-,18+,20-,21-/m0/s1	CYKYBWRSLLXBOW-GDYGHMJCSA-N	C[C@]12CC[C@@H](O)C[C@@H]1CC[C@H]3[C@@H]4CC[C@H](C(=O)CO)[C@@]4(C)CC[C@H]23	BroadT	BRD-K36764776	BRD-K36764776-001-01-4	Biomol International Inc.	AC-972	2819-N1292		C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO	InChI=1S/C21H34O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h13-18,22-23H,3-12H2,1-2H3/t13-,14+,15-,16-,17-,18+,20-,21-/m0/s1	CYKYBWRSLLXBOW-GDYGHMJCSA-N	334.250794948							34461
Tolazamide	LSM-2699	Tolazamide, Tolinase, U-17835	5503	InChI=1S/C14H21N3O3S/c1-12-6-8-13(9-7-12)21(19,20)16-14(18)15-17-10-4-2-3-5-11-17/h6-9H,2-5,10-11H2,1H3,(H2,15,16,18)	OUDSBRTVNLOZBN-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NC(=O)NN2CCCCCC2	BroadT	BRD-K32164935	BRD-K32164935-001-06-8	Biomol International Inc.	KC-135	2840(V2)-3-N1305		Cc1ccc(cc1)S(=O)(=O)NC(=O)NN1CCCCCC1	InChI=1S/C14H21N3O3S/c1-12-6-8-13(9-7-12)21(19,20)16-14(18)15-17-10-4-2-3-5-11-17/h6-9H,2-5,10-11H2,1H3,(H2,15,16,18)	OUDSBRTVNLOZBN-UHFFFAOYSA-N	311.130362252							9613
Hesperidin	LSM-2858	Hesperidin, NSC-31048	10621	InChI=1S/C28H34O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-7,10,17,19,21-30,32-37H,8-9H2,1-2H3/t10-,17-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1	QUQPHWDTPGMPEX-QJBIFVCTSA-N	COc1ccc(cc1O)[C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2	BroadT	BRD-K38903228	BRD-K38903228-001-02-8	Prestwick Chemical Inc.	Prestw-400	D0701-MP04-ST03-200-		COc1ccc(cc1O)[C@@H]1CC(=O)c2c(O)cc(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc2O1	InChI=1S/C28H34O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-7,10,17,19,21-30,32-37H,8-9H2,1-2H3/t10-,17-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1	QUQPHWDTPGMPEX-QJBIFVCTSA-N	610.189770388							28775
Broxyquinoline	LSM-20949	Dibromohydroxyquinoline, Broxyquinoline	2453	InChI=1S/C9H5Br2NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H	ZDASUJMDVPTNTF-UHFFFAOYSA-N	Oc1c(Br)cc(Br)c2cccnc12	BroadT	BRD-K23301018	BRD-K23301018-001-02-6	MicroSource Discovery Systems Inc.	1500623			Oc1c(Br)cc(Br)c2cccnc12	InChI=1S/C9H5Br2NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H	ZDASUJMDVPTNTF-UHFFFAOYSA-N	300.87378899							109543
Reserpic acid	LSM-2712	SID120571	65747	InChI=1S/C22H28N2O5/c1-28-12-3-4-13-14-5-6-24-10-11-7-18(25)21(29-2)19(22(26)27)15(11)9-17(24)20(14)23-16(13)8-12/h3-4,8,11,15,17-19,21,23,25H,5-7,9-10H2,1-2H3,(H,26,27)/t11-,15+,17-,18-,19+,21+/m1/s1	JVHNBFFHWQQPLL-WOXROFTLSA-N	CO[C@H]1[C@H](O)C[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(=O)O	BroadT	BRD-K32755366	BRD-K32755366-003-03-4	Prestwick Chemical Inc.	Prestw-984	D0701-MP04-ST03-200-	Cl	CO[C@H]1[C@H](O)C[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(O)=O.Cl	InChI=1S/C22H28N2O5.ClH/c1-28-12-3-4-13-14-5-6-24-10-11-7-18(25)21(29-2)19(22(26)27)15(11)9-17(24)20(14)23-16(13)8-12;/h3-4,8,11,15,17-19,21,23,25H,5-7,9-10H2,1-2H3,(H,26,27);1H/t11-,15+,17-,18-,19+,21+;/m1./s1	QLKKMNXYROCXRE-BCRILHLVSA-N	400.199822016							46690, 46690
Calcitriol	LSM-43088	1a,25-Dihydroxyvitamin D3, 1alpha,25-Dihydroxyvitamin D3, 1alpha,25-Dihydroxycholecalciferol, Calcitriol, Dihydroxycholecalciferol, Rocaltrol, Topitriol, Vectical, Calcijex, Dihydroxyvitamin D 3, RO-215535	5280453	InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-11,18,22-25,28-30H,2,6-9,12-17H2,1,3-5H3/b20-10+,21-11-/t18-,22-,23-,24+,25+,27-/m1/s1	GMRQFYUYWCNGIN-NKMMMXOESA-N	C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@@H](O)C[C@H](O)C3=C)\CCC[C@]12C	BroadT	BRD-K27316855	BRD-K27316855-001-02-6	Biomol International Inc.	DM200	2840(V2)-3-N1305		C[C@H](CCCC(C)(C)O)[C@H]1CC[C@@H]2[C@]1(C)CCC\C2=C/C=C1/C[C@@H](O)C[C@H](O)C1=C	InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-11,18,22-25,28-30H,2,6-9,12-17H2,1,3-5H3/b20-10+,21-11-/t18-,22-,23-,24+,25+,27-/m1/s1	GMRQFYUYWCNGIN-NKMMMXOESA-N	416.329045268							17823, 17823
Phenyl Biguanide	LSM-4586	1-Phenylbiguanide, N-Phenylimidodicarbonimidic Diamide, Phenyl Biguanide	4780	InChI=1S/C8H11N5/c9-7(10)13-8(11)12-6-4-2-1-3-5-6/h1-5H,(H6,9,10,11,12,13)	CUQCMXFWIMOWRP-UHFFFAOYSA-N	NC(=N)NC(=N)Nc1ccccc1	BroadT	BRD-K31491153	BRD-K31491153-001-01-2	Biomol International Inc.	AC-559	2813-N1283		NC(=N)NC(=N)Nc1ccccc1	InChI=1S/C8H11N5/c9-7(10)13-8(11)12-6-4-2-1-3-5-6/h1-5H,(H6,9,10,11,12,13)	CUQCMXFWIMOWRP-UHFFFAOYSA-N	177.101445402							75377, 75377
Torsemide	LSM-2662	Torasemide, Demadex, Torsemide, BM-02015, AC4464, AC-4464	41781	InChI=1S/C16H20N4O3S/c1-11(2)18-16(21)20-24(22,23)15-10-17-8-7-14(15)19-13-6-4-5-12(3)9-13/h4-11H,1-3H3,(H,17,19)(H2,18,20,21)	NGBFQHCMQULJNZ-UHFFFAOYSA-N	CC(C)NC(=O)NS(=O)(=O)c1cnccc1Nc2cccc(C)c2	BroadT	BRD-K30480208	BRD-K30480208-001-04-5	MicroSource Discovery Systems Inc.	1505211			CC(C)NC(=O)NS(=O)(=O)c1cnccc1Nc1cccc(C)c1	InChI=1S/C16H20N4O3S/c1-11(2)18-16(21)20-24(22,23)15-10-17-8-7-14(15)19-13-6-4-5-12(3)9-13/h4-11H,1-3H3,(H,17,19)(H2,18,20,21)	NGBFQHCMQULJNZ-UHFFFAOYSA-N	348.12561123							9637
Nilutamide	LSM-2513	Nilutamide, Nilandron, Anadron, RU-23908	4493	InChI=1S/C12H10F3N3O4/c1-11(2)9(19)17(10(20)16-11)6-3-4-8(18(21)22)7(5-6)12(13,14)15/h3-5H,1-2H3,(H,16,20)	XWXYUMMDTVBTOU-UHFFFAOYSA-N	CC1(C)NC(=O)N(C1=O)c2ccc(c(c2)C(F)(F)F)[N+](=O)[O-]	BroadT	BRD-K23566484	BRD-K23566484-001-04-5	MicroSource Discovery Systems Inc.	1504152			CC1(C)NC(=O)N(C1=O)c1ccc(c(c1)C(F)(F)F)[N+]([O-])=O	InChI=1S/C12H10F3N3O4/c1-11(2)9(19)17(10(20)16-11)6-3-4-8(18(21)22)7(5-6)12(13,14)15/h3-5H,1-2H3,(H,16,20)	XWXYUMMDTVBTOU-UHFFFAOYSA-N	317.06234043							7573
Primidone	LSM-2700	Primidone, Neurosyn, Mysoline, Lepsiral	4909	InChI=1S/C12H14N2O2/c1-2-12(9-6-4-3-5-7-9)10(15)13-8-14-11(12)16/h3-7H,2,8H2,1H3,(H,13,15)(H,14,16)	DQMZLTXERSFNPB-UHFFFAOYSA-N	CCC1(C(=O)NCNC1=O)c2ccccc2	BroadT	BRD-K32247306	BRD-K32247306-001-04-7	MicroSource Discovery Systems Inc.	1500501			CCC1(C(=O)NCNC1=O)c1ccccc1	InChI=1S/C12H14N2O2/c1-2-12(9-6-4-3-5-7-9)10(15)13-8-14-11(12)16/h3-7H,2,8H2,1H3,(H,13,15)(H,14,16)	DQMZLTXERSFNPB-UHFFFAOYSA-N	218.105527708							8412
Ditolylguanidine	LSM-2732	1,3-Di-O-Tolylguanidine, Ditolylguanidine, BRD-K33459542, Di-O-Tolylguanidine	7333	InChI=1S/C15H17N3/c1-11-7-3-5-9-13(11)17-15(16)18-14-10-6-4-8-12(14)2/h3-10H,1-2H3,(H3,16,17,18)	OPNUROKCUBTKLF-UHFFFAOYSA-N	Cc1ccccc1NC(=N)Nc2ccccc2C	BroadT	BRD-K33459542	BRD-K33459542-001-02-5	Tocris Bioscience	841	3		Cc1ccccc1NC(=N)Nc1ccccc1C	InChI=1S/C15H17N3/c1-11-7-3-5-9-13(11)17-15(16)18-14-10-6-4-8-12(14)2/h3-10H,1-2H3,(H3,16,17,18)	OPNUROKCUBTKLF-UHFFFAOYSA-N	239.142247574							92585
Alrestatin	LSM-2775	Alrestatin, AY-22284	2120	InChI=1S/C14H9NO4/c16-11(17)7-15-13(18)9-5-1-3-8-4-2-6-10(12(8)9)14(15)19/h1-6H,7H2,(H,16,17)	GCUCIFQCGJIRNT-UHFFFAOYSA-N	OC(=O)CN1C(=O)c2cccc3cccc(C1=O)c23	BroadT	BRD-K35498378	BRD-K35498378-001-03-8	Biomol International Inc.	T-112	2840(V2)-3-N1305		OC(=O)CN1C(=O)c2cccc3cccc(C1=O)c23	InChI=1S/C14H9NO4/c16-11(17)7-15-13(18)9-5-1-3-8-4-2-6-10(12(8)9)14(15)19/h1-6H,7H2,(H,16,17)	GCUCIFQCGJIRNT-UHFFFAOYSA-N	255.053157778							, 
CHEMBL57427	LSM-2840	N-(4-Bromobenzyl)-5-Methoxytryptamine, SID26756540	5124753	InChI=1S/C18H19BrN2O/c1-22-16-6-7-18-17(10-16)14(12-21-18)8-9-20-11-13-2-4-15(19)5-3-13/h2-7,10,12,20-21H,8-9,11H2,1H3	XHLOUFPZLUULGI-UHFFFAOYSA-N	COc1ccc2[nH]cc(CCNCc3ccc(Br)cc3)c2c1	BroadT	BRD-K37883585	BRD-K37883585-001-01-2	Biomol International Inc.	AC-556	2813-N1283		COc1ccc2[nH]cc(CCNCc3ccc(Br)cc3)c2c1	InChI=1S/C18H19BrN2O/c1-22-16-6-7-18-17(10-16)14(12-21-18)8-9-20-11-13-2-4-15(19)5-3-13/h2-7,10,12,20-21H,8-9,11H2,1H3	XHLOUFPZLUULGI-UHFFFAOYSA-N	358.068075848							92671
Rhein	LSM-20950	Rhein	10168	InChI=1S/C15H8O6/c16-9-3-1-2-7-11(9)14(19)12-8(13(7)18)4-6(15(20)21)5-10(12)17/h1-5,16-17H,(H,20,21)	FCDLCPWAQCPTKC-UHFFFAOYSA-N	OC(=O)c1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1	BroadT	BRD-K27335680	BRD-K27335680-001-01-9	AnalytiCon Discovery GmbH	NP-010642			OC(=O)c1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1	InChI=1S/C15H8O6/c16-9-3-1-2-7-11(9)14(19)12-8(13(7)18)4-6(15(20)21)5-10(12)17/h1-5,16-17H,(H,20,21)	FCDLCPWAQCPTKC-UHFFFAOYSA-N	284.032087976							8825
SPECTRUM_001129	LSM-6561	Bergenin	6708706	InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12-,13+/m1/s1	YWJXCIXBAKGUKZ-BPTACTMOSA-N	COc1c(O)cc2C(=O)O[C@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]3c2c1O	BroadT	BRD-K18550767	BRD-K18550767-001-02-8	MicroSource Discovery Systems Inc.	1500819			COc1c(O)cc2C(=O)O[C@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]3c2c1O	InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12-,13+/m1/s1	YWJXCIXBAKGUKZ-BPTACTMOSA-N	328.079432092							95241
Hydroflumethiazide	LSM-5497	Saluron, Hydroflumethiazide, Diucardin	3647	InChI=1S/C8H8F3N3O4S2/c9-8(10,11)4-1-5-7(2-6(4)19(12,15)16)20(17,18)14-3-13-5/h1-2,13-14H,3H2,(H2,12,15,16)	DMDGGSIALPNSEE-UHFFFAOYSA-N	NS(=O)(=O)c1cc2c(NCNS2(=O)=O)cc1C(F)(F)F	BroadT	BRD-K36862742	BRD-K36862742-001-04-1	MicroSource Discovery Systems Inc.	1500341			NS(=O)(=O)c1cc2c(NCNS2(=O)=O)cc1C(F)(F)F	InChI=1S/C8H8F3N3O4S2/c9-8(10,11)4-1-5-7(2-6(4)19(12,15)16)20(17,18)14-3-13-5/h1-2,13-14H,3H2,(H2,12,15,16)	DMDGGSIALPNSEE-UHFFFAOYSA-N	330.990831746							5784
Dictamnine	LSM-2642	4-Methoxyfuro[2,3-B]Quinoline, Dictamine, Dictamnine	68085	InChI=1S/C12H9NO2/c1-14-11-8-4-2-3-5-10(8)13-12-9(11)6-7-15-12/h2-7H,1H3	WIONIXOBNMDJFJ-UHFFFAOYSA-N	COc1c2ccoc2nc3ccccc13	BroadT	BRD-K29178788	BRD-K29178788-001-02-0	MicroSource Discovery Systems Inc.	100541			COc1c2ccoc2nc2ccccc12	InChI=1S/C12H9NO2/c1-14-11-8-4-2-3-5-10(8)13-12-9(11)6-7-15-12/h2-7H,1H3	WIONIXOBNMDJFJ-UHFFFAOYSA-N	199.063328538							4512
NNC 63-0532	LSM-2789	BRD-K36009368, SID11114215	3906780	InChI=1S/C27H29N3O3/c1-33-25(31)19-29-20-30(24-9-3-2-4-10-24)27(26(29)32)13-15-28(16-14-27)18-21-11-12-22-7-5-6-8-23(22)17-21/h2-12,17H,13-16,18-20H2,1H3	DSEIKQVUTKGLGT-UHFFFAOYSA-N	COC(=O)CN1CN(c2ccccc2)C3(CCN(Cc4ccc5ccccc5c4)CC3)C1=O	BroadT	BRD-K36009368	BRD-K36009368-001-01-8	Tocris Bioscience	1780	1		COC(=O)CN1CN(c2ccccc2)C2(CCN(Cc3ccc4ccccc4c3)CC2)C1=O	InChI=1S/C27H29N3O3/c1-33-25(31)19-29-20-30(24-9-3-2-4-10-24)27(26(29)32)13-15-28(16-14-27)18-21-11-12-22-7-5-6-8-23(22)17-21/h2-12,17H,13-16,18-20H2,1H3	DSEIKQVUTKGLGT-UHFFFAOYSA-N	443.220891818							92631
SU 1498	LSM-42944	SU1498, SU-1498	5941539	InChI=1S/C25H30N2O2/c1-17(2)22-14-20(15-23(18(3)4)24(22)28)13-21(16-26)25(29)27-12-8-11-19-9-6-5-7-10-19/h5-7,9-10,13-15,17-18,28H,8,11-12H2,1-4H3,(H,27,29)/b21-13+	JANPYFTYAGTSIN-FYJGNVAPSA-N	CC(C)c1cc(\C=C(/C#N)\C(=O)NCCCc2ccccc2)cc(C(C)C)c1O	BroadT	BRD-K34995470	BRD-K34995470-001-02-3	EMD Biosciences	572888			CC(C)c1cc(cc(C(C)C)c1O)\C=C(/C#N)C(=O)NCCCc1ccccc1	InChI=1S/C25H30N2O2/c1-17(2)22-14-20(15-23(18(3)4)24(22)28)13-21(16-26)25(29)27-12-8-11-19-9-6-5-7-10-19/h5-7,9-10,13-15,17-18,28H,8,11-12H2,1-4H3,(H,27,29)/b21-13+	JANPYFTYAGTSIN-FYJGNVAPSA-N	390.23072822							87158
L-Hyoscyamine	LSM-2897		154417	InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15?,16-/m1/s1	RKUNBYITZUJHSG-VFSICIBPSA-N	CN1[C@H]2CC[C@@H]1CC(C2)OC(=O)[C@H](CO)c3ccccc3	BroadT	BRD-K40530731	BRD-K40530731-001-02-5	Prestwick Chemical Inc.	Prestw-233	D0701-MP04-ST03-200-		CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)[C@H](CO)c1ccccc1	InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16-/m1/s1	RKUNBYITZUJHSG-FXUDXRNXSA-N	289.167793606							92712
Dioxybenzone	LSM-2493	Dioxybenzone	8569	InChI=1S/C14H12O4/c1-18-9-6-7-11(13(16)8-9)14(17)10-4-2-3-5-12(10)15/h2-8,15-16H,1H3	MEZZCSHVIGVWFI-UHFFFAOYSA-N	COc1ccc(C(=O)c2ccccc2O)c(O)c1	BroadT	BRD-K22193694	BRD-K22193694-001-04-5	MicroSource Discovery Systems Inc.	1500255			COc1ccc(C(=O)c2ccccc2O)c(O)c1	InChI=1S/C14H12O4/c1-18-9-6-7-11(13(16)8-9)14(17)10-4-2-3-5-12(10)15/h2-8,15-16H,1H3	MEZZCSHVIGVWFI-UHFFFAOYSA-N	244.073558864							34208
2,4-Dinitrophenol	LSM-20951	2,4-Dinitrophenol, 2,4-Dinitro-Phenol, SR-1C5	1493	InChI=1S/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H	UFBJCMHMOXMLKC-UHFFFAOYSA-N	Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]	BroadT	BRD-K21910317	BRD-K21910317-001-02-4	MicroSource Discovery Systems Inc.	330008			Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O	InChI=1S/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H	UFBJCMHMOXMLKC-UHFFFAOYSA-N	184.012021248							42017
Isobergaptene	LSM-20952	SID22405528, SID26749584, SID50107653	68082	InChI=1S/C12H8O4/c1-14-9-6-10-8(4-5-15-10)12-7(9)2-3-11(13)16-12/h2-6H,1H3	AJSPSRWWZBBIOR-UHFFFAOYSA-N	COc1cc2occc2c3OC(=O)C=Cc13	BroadT	BRD-K31678817	BRD-K31678817-001-02-0	MicroSource Discovery Systems Inc.	300032			COc1cc2occc2c2oc(=O)ccc12	InChI=1S/C12H8O4/c1-14-9-6-10-8(4-5-15-10)12-7(9)2-3-11(13)16-12/h2-6H,1H3	AJSPSRWWZBBIOR-UHFFFAOYSA-N	216.042258736							81487
(1S,2R)-Phenylpropanolamine	LSM-5416	Phenylpropanolamine	26934	InChI=1S/C9H13NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,9,11H,10H2,1H3/t7-,9-/m1/s1	DLNKOYKMWOXYQA-VXNVDRBHSA-N	C[C@@H](N)[C@@H](O)c1ccccc1	BroadT	BRD-K27853494	BRD-K27853494-003-02-1	Prestwick Chemical Inc.	Prestw-324	D0701-MP04-ST03-200-	Cl	C[C@@H](N)[C@@H](O)c1ccccc1.Cl	InChI=1S/C9H13NO.ClH/c1-7(10)9(11)8-5-3-2-4-6-8;/h2-7,9,11H,10H2,1H3;1H/t7-,9-;/m1./s1	DYWNLSQWJMTVGJ-PRCZDLBKSA-N	151.099714046							36, 36
CHEMBL19130	LSM-2863	R(-)-2,10,11-Trihydroxyaporphine, SID50111046, SID90340939	6603797	InChI=1S/C17H17NO3/c1-18-5-4-10-6-11(19)8-12-15(10)13(18)7-9-2-3-14(20)17(21)16(9)12/h2-3,6,8,13,19-21H,4-5,7H2,1H3/t13-/m1/s1	QNBCPLWFVGLFHO-CYBMUJFWSA-N	CN1CCc2cc(O)cc3c2[C@H]1Cc4ccc(O)c(O)c34	BroadT	BRD-K39187410	BRD-K39187410-001-01-7	Biomol International Inc.	AC-830	2812-3-N1298		CN1CCc2cc(O)cc-3c2[C@H]1Cc1ccc(O)c(O)c-31	InChI=1S/C17H17NO3/c1-18-5-4-10-6-11(19)8-12-15(10)13(18)7-9-2-3-14(20)17(21)16(9)12/h2-3,6,8,13,19-21H,4-5,7H2,1H3/t13-/m1/s1	QNBCPLWFVGLFHO-CYBMUJFWSA-N	283.120843414							92685, 92685
Harmine	LSM-5451		5280953	InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3	BXNJHAXVSOCGBA-UHFFFAOYSA-N	COc1ccc2c(c1)[nH]c3c(C)nccc23	BroadT	BRD-K30984264	BRD-K30984264-001-02-1	AnalytiCon Discovery GmbH	NP-010657			COc1ccc2c(c1)[nH]c1c(C)nccc21	InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3	BXNJHAXVSOCGBA-UHFFFAOYSA-N	212.094963024							28121, 28121, 28121
Farnesylcysteine Methyl Ester	LSM-43200	SID26754861, SID26754862, Farnesylcysteine-Methyl-Ester, S-Trans,Trans-Farnesyl-L-Cysteine Methylester	6439225	InChI=1S/C19H33NO2S/c1-15(2)8-6-9-16(3)10-7-11-17(4)12-13-23-14-18(20)19(21)22-5/h8,10,12,18H,6-7,9,11,13-14,20H2,1-5H3/b16-10+,17-12+/t18-/m0/s1	SIEHZFPZQUNSAS-GCVUPTOQSA-N	COC(=O)[C@@H](N)CSC\C=C(/C)\CC\C=C(/C)\CCC=C(C)C	BroadT	BRD-K38756014	BRD-K38756014-001-02-8	Biomol International Inc.	G-201	2840(V2)-3-N1305		COC(=O)[C@@H](N)CSC\C=C(/C)CC\C=C(/C)CCC=C(C)C	InChI=1S/C19H33NO2S/c1-15(2)8-6-9-16(3)10-7-11-17(4)12-13-23-14-18(20)19(21)22-5/h8,10,12,18H,6-7,9,11,13-14,20H2,1-5H3/b16-10+,17-12+/t18-/m0/s1	SIEHZFPZQUNSAS-GCVUPTOQSA-N	339.223199996							87167
CHEMBL59836	LSM-2580	BRD-K26429091	9821459	InChI=1S/C24H36N2O2/c1-19(2)9-8-16-26-17-14-22(15-18-26)25-23(27)24(28,21-12-6-7-13-21)20-10-4-3-5-11-20/h3-5,9-11,21-22,28H,6-8,12-18H2,1-2H3,(H,25,27)/t24-/m0/s1	YECZUVJTDYORCB-DEOSSOPVSA-N	CC(=CCCN1CCC(CC1)NC(=O)[C@@](O)(C2CCCC2)c3ccccc3)C	BroadT	BRD-K26429091	BRD-K26429091-051-01-9	Tocris Bioscience	2507	1	OC(=O)/C=C/C(=O)O	CC(C)=CCCN1CCC(CC1)NC(=O)[C@@](O)(C1CCCC1)c1ccccc1.OC(=O)/C=C/C(=O)O	InChI=1S/C24H36N2O2.C4H4O4/c1-19(2)9-8-16-26-17-14-22(15-18-26)25-23(27)24(28,21-12-6-7-13-21)20-10-4-3-5-11-20;5-3(6)1-2-4(7)8/h3-5,9-11,21-22,28H,6-8,12-18H2,1-2H3,(H,25,27);1-2H,(H,5,6)(H,7,8)/b;2-1+/t24-;/m0./s1	HUCQUCITPHOUAC-DSSYAJFBSA-N	384.277678412							92465
IN1183	LSM-2694	BRD-K31987754	4383	InChI=1S/C20H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h9-10,22H,2-8,11-19H2,1H3,(H,21,23)	BOWVQLFMWHZBEF-UHFFFAOYSA-N	CCCCCCCCC=CCCCCCCCC(=O)NCCO	BroadT	BRD-K31987754	BRD-K31987754-001-01-2	Tocris Bioscience	1484	3		CCCCCCCCC=CCCCCCCCC(=O)NCCO	InChI=1S/C20H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h9-10,22H,2-8,11-19H2,1H3,(H,21,23)	BOWVQLFMWHZBEF-UHFFFAOYSA-N	325.298079498							
Buflomedil	LSM-5365	Buflomedil	2467	InChI=1S/C17H25NO4/c1-20-13-11-15(21-2)17(16(12-13)22-3)14(19)7-6-10-18-8-4-5-9-18/h11-12H,4-10H2,1-3H3	OWYLAEYXIQKAOL-UHFFFAOYSA-N	COc1cc(OC)c(C(=O)CCCN2CCCC2)c(OC)c1	BroadT	BRD-K19462402	BRD-K19462402-003-03-0	Prestwick Chemical Inc.	Prestw-426	D0701-MP04-ST03-200-	Cl	COc1cc(OC)c(C(=O)CCCN2CCCC2)c(OC)c1.Cl	InChI=1S/C17H25NO4.ClH/c1-20-13-11-15(21-2)17(16(12-13)22-3)14(19)7-6-10-18-8-4-5-9-18;/h11-12H,4-10H2,1-3H3;1H	ZDPACSAHMZADFZ-UHFFFAOYSA-N	307.17835829							94538, 94538
Prochlorperazine	LSM-2436	Compazine, Compro, Prochlorperazine, Prochlorperazine Mesilate	4917	InChI=1S/C20H24ClN3S/c1-22-11-13-23(14-12-22)9-4-10-24-17-5-2-3-6-19(17)25-20-8-7-16(21)15-18(20)24/h2-3,5-8,15H,4,9-14H2,1H3	WIKYUJGCLQQFNW-UHFFFAOYSA-N	CN1CCN(CCCN2c3ccccc3Sc4ccc(Cl)cc24)CC1	BroadT	BRD-K19352500	BRD-K19352500-332-03-7	Prestwick Chemical Inc.	Prestw-399	D0701-MP04-ST03-200-	OC(=O)/C=C\C(=O)O.OC(=O)/C=C\C(=O)O	CN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc23)CC1.OC(=O)/C=C\C(=O)O.OC(=O)/C=C\C(=O)O	InChI=1S/C20H24ClN3S.2C4H4O4/c1-22-11-13-23(14-12-22)9-4-10-24-17-5-2-3-6-19(17)25-20-8-7-16(21)15-18(20)24;2*5-3(6)1-2-4(7)8/h2-3,5-8,15H,4,9-14H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-	DSKIOWHQLUWFLG-SPIKMXEPSA-N	373.137946198							8435, 8435, 8435, 8435
6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid	LSM-2681	Mycophenolic Acid	4272	InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)	HPNSFSBZBAHARI-UHFFFAOYSA-N	COc1c(C)c2COC(=O)c2c(O)c1CC=C(C)CCC(=O)O	BroadT	BRD-K31542390	BRD-K31542390-001-01-5	Tocris Bioscience	1505	1		COc1c(C)c2COC(=O)c2c(O)c1CC=C(C)CCC(O)=O	InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)	HPNSFSBZBAHARI-UHFFFAOYSA-N	320.12598836							92545
Nafcillin	LSM-2402	Nafcillin, Nallpen, Unipen	8982	InChI=1S/C21H22N2O5S/c1-4-28-13-10-9-11-7-5-6-8-12(11)14(13)17(24)22-15-18(25)23-16(20(26)27)21(2,3)29-19(15)23/h5-10,15-16,19H,4H2,1-3H3,(H,22,24)(H,26,27)/t15-,16+,19-/m1/s1	GPXLMGHLHQJAGZ-JTDSTZFVSA-N	CCOc1ccc2ccccc2c1C(=O)N[C@H]3[C@H]4SC(C)(C)[C@@H](N4C3=O)C(=O)O	BroadT	BRD-K18574842	BRD-K18574842-323-03-3	Prestwick Chemical Inc.	Prestw-843	D0701-MP04-ST03-200-	O.[Na]	CCOc1ccc2ccccc2c1C(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C(O)=O.O.[Na]	InChI=1S/C21H22N2O5S.Na.H2O.H/c1-4-28-13-10-9-11-7-5-6-8-12(11)14(13)17(24)22-15-18(25)23-16(20(26)27)21(2,3)29-19(15)23;;;/h5-10,15-16,19H,4H2,1-3H3,(H,22,24)(H,26,27);;1H2;/t15-,16+,19-;;;/m1.../s1	AKHCTWCGFJWGSM-AMHPYMOHSA-N	414.124942514							7447, 7447, 7447
Diflunisal	LSM-2490	Diflunisal, Dolobid	3059	InChI=1S/C13H8F2O3/c14-8-2-3-9(11(15)6-8)7-1-4-12(16)10(5-7)13(17)18/h1-6,16H,(H,17,18)	HUPFGZXOMWLGNK-UHFFFAOYSA-N	OC(=O)c1cc(ccc1O)c2ccc(F)cc2F	BroadT	BRD-K22031190	BRD-K22031190-001-04-6	MicroSource Discovery Systems Inc.	1500245			OC(=O)c1cc(ccc1O)-c1ccc(F)cc1F	InChI=1S/C13H8F2O3/c14-8-2-3-9(11(15)6-8)7-1-4-12(16)10(5-7)13(17)18/h1-6,16H,(H,17,18)	HUPFGZXOMWLGNK-UHFFFAOYSA-N	250.044150516							39669
Estradiol	LSM-2421	Gynoestryl, Gynodiol, Gynergon, Gvnodiol, Fempatch, Evamist, Estrogel, Estring, Estrasorb, Gynogen, Innofem, Menostar, Oestradiol, Vagifem, Vivelle, Minivelle, Agofollin, Alfatradiol, Alora, Aquagen, Climara, Destradiol, Dihydrotheelin, Dihydroxyestrin, Divigel, Estradiol, Estraderm, Estrace, Esclim, Elestrin, Elestrim, Vagifem 18, Vagifem 8, Estradiol Hemihydrate, Vivelle-DOT, B-Estradiol, Climara PRO, Depo-Estradiol, E-Cypionate	5757	InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1	VOXZDWNPVJITMN-ZBRFXRBCSA-N	C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@H]2O	BroadT	BRD-K18910433	BRD-K18910433-001-04-4	Biomol International Inc.	BL-093	2840(V2)-3-N1305		C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@H]2O	InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1	VOXZDWNPVJITMN-ZBRFXRBCSA-N	272.177630008							16469
Perillic Acid (-)	LSM-20953		5702197	InChI=1S/C10H14O2/c1-7(2)8-3-5-9(6-4-8)10(11)12/h5,8H,1,3-4,6H2,2H3,(H,11,12)/t8-/m0/s1	CDSMSBUVCWHORP-QMMMGPOBSA-N	CC(=C)[C@@H]1CCC(=CC1)C(=O)O	BroadT	BRD-K35963610	BRD-K35963610-001-02-1	MicroSource Discovery Systems Inc.	1502101			CC(=C)[C@@H]1CCC(=CC1)C(O)=O	InChI=1S/C10H14O2/c1-7(2)8-3-5-9(6-4-8)10(11)12/h5,8H,1,3-4,6H2,2H3,(H,11,12)/t8-/m0/s1	CDSMSBUVCWHORP-QMMMGPOBSA-N	166.099379688							109544
Flutamide	LSM-2621	Flutamide, Eulexin, Drogenil, SCH-13521	3397	InChI=1S/C11H11F3N2O3/c1-6(2)10(17)15-7-3-4-9(16(18)19)8(5-7)11(12,13)14/h3-6H,1-2H3,(H,15,17)	MKXKFYHWDHIYRV-UHFFFAOYSA-N	CC(C)C(=O)Nc1ccc(c(c1)C(F)(F)F)[N+](=O)[O-]	BroadT	BRD-K28307902	BRD-K28307902-001-04-3	MicroSource Discovery Systems Inc.	1500995			CC(C)C(=O)Nc1ccc(c(c1)C(F)(F)F)[N+]([O-])=O	InChI=1S/C11H11F3N2O3/c1-6(2)10(17)15-7-3-4-9(16(18)19)8(5-7)11(12,13)14/h3-6H,1-2H3,(H,15,17)	MKXKFYHWDHIYRV-UHFFFAOYSA-N	276.072176832							5132
D-64131	LSM-2592	D-64131, BRD-K26997899	3921152	InChI=1S/C16H13NO2/c1-19-13-7-8-14-12(9-13)10-15(17-14)16(18)11-5-3-2-4-6-11/h2-10,17H,1H3	ICMIJSRDISNKOC-UHFFFAOYSA-N	COc1ccc2[nH]c(cc2c1)C(=O)c3ccccc3	BroadT	BRD-K26997899	BRD-K26997899-001-01-4	Tocris Bioscience	1643	1		COc1ccc2[nH]c(cc2c1)C(=O)c1ccccc1	InChI=1S/C16H13NO2/c1-19-13-7-8-14-12(9-13)10-15(17-14)16(18)11-5-3-2-4-6-11/h2-10,17H,1H3	ICMIJSRDISNKOC-UHFFFAOYSA-N	251.094628666							92475
6-Chloromelatonin	LSM-20954	6-Chloromelatonin, BRD-K34663752	1858	InChI=1S/C13H15ClN2O2/c1-8(17)15-4-3-9-7-16-12-6-11(14)13(18-2)5-10(9)12/h5-7,16H,3-4H2,1-2H3,(H,15,17)	LUINDDOUWHRIPW-UHFFFAOYSA-N	COc1cc2c(CCNC(=O)C)c[nH]c2cc1Cl	BroadT	BRD-K34663752	BRD-K34663752-001-02-6	Tocris Bioscience	443	2		COc1cc2c(CCNC(C)=O)c[nH]c2cc1Cl	InChI=1S/C13H15ClN2O2/c1-8(17)15-4-3-9-7-16-12-6-11(14)13(18-2)5-10(9)12/h5-7,16H,3-4H2,1-2H3,(H,15,17)	LUINDDOUWHRIPW-UHFFFAOYSA-N	266.08220545							109545
2,2-Dichloro-n-[(1R,2S)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide	LSM-20955	Chloramphenicol	146033	InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9+/m0/s1	WIIZWVCIJKGZOK-DTWKUNHWSA-N	OC[C@H](NC(=O)C(Cl)Cl)[C@H](O)c1ccc(cc1)[N+](=O)[O-]	BroadT	BRD-K22969690	BRD-K22969690-001-02-6	MicroSource Discovery Systems Inc.	1500174			OC[C@H](NC(=O)C(Cl)Cl)[C@H](O)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9+/m0/s1	WIIZWVCIJKGZOK-DTWKUNHWSA-N	322.012326924							109546
Azathioprine	LSM-42936		2265	InChI=1S/C9H7N7O2S/c1-15-4-14-7(16(17)18)9(15)19-8-5-6(11-2-10-5)12-3-13-8/h2-4H,1H3,(H,10,11,12,13)	LMEKQMALGUDUQG-UHFFFAOYSA-N	Cn1cnc(c1Sc2[nH]cnc3ncnc23)[N+](=O)[O-]	BroadT	BRD-K32821942	BRD-K32821942-001-04-9	MicroSource Discovery Systems Inc.	1500133			Cn1cnc(c1Sc1[nH]cnc2ncnc12)[N+]([O-])=O	InChI=1S/C9H7N7O2S/c1-15-4-14-7(16(17)18)9(15)19-8-5-6(11-2-10-5)12-3-13-8/h2-4H,1H3,(H,10,11,12,13)	LMEKQMALGUDUQG-UHFFFAOYSA-N	277.038193224							2948, 2948
O-Demethylated Adapalene	LSM-6237	CD-437, O-Demethylated Adapalene	135411	InChI=1S/C27H26O3/c28-25-6-5-22(20-1-2-21-11-23(26(29)30)4-3-19(21)10-20)12-24(25)27-13-16-7-17(14-27)9-18(8-16)15-27/h1-6,10-12,16-18,28H,7-9,13-15H2,(H,29,30)	LDGIHZJOIQSHPB-UHFFFAOYSA-N	OC(=O)c1ccc2cc(ccc2c1)c3ccc(O)c(c3)C45CC6CC(CC(C6)C4)C5	BroadT	BRD-K28907958	BRD-K28907958-001-01-9	Tocris Bioscience	1549	1		OC(=O)c1ccc2cc(ccc2c1)-c1ccc(O)c(c1)C12CC3CC(CC(C3)C1)C2	InChI=1S/C27H26O3/c28-25-6-5-22(20-1-2-21-11-23(26(29)30)4-3-19(21)10-20)12-24(25)27-13-16-7-17(14-27)9-18(8-16)15-27/h1-6,10-12,16-18,28H,7-9,13-15H2,(H,29,30)	LDGIHZJOIQSHPB-UHFFFAOYSA-N	398.188194692							88334
Mifepristone	LSM-2822	Mifepristone, Korlym, Mifeprex, RU-38486, RU-486	55245	InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17,24-26,32H,8,11-14,16,18H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1	VKHAHZOOUSRJNA-GCNJZUOMSA-N	CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c5ccc(cc5)N(C)C	BroadT	BRD-K37270826	BRD-K37270826-001-03-7	EMD Biosciences	475838			CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc(cc1)N(C)C	InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17,24-26,32H,8,11-14,16,18H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1	VKHAHZOOUSRJNA-GCNJZUOMSA-N	429.26677937							50692
Amthamine	LSM-2874	Amthamine, BRD-K39670393	126688	InChI=1S/C6H11N3S/c1-4-5(2-3-7)10-6(8)9-4/h2-3,7H2,1H3,(H2,8,9)	LHVRFUVVRXGZPV-UHFFFAOYSA-N	Cc1nc(N)sc1CCN	BroadT	BRD-K39670393	BRD-K39670393-303-01-3	Tocris Bioscience	668	2	Br.Br	Cc1nc(N)sc1CCN.Br.Br	InChI=1S/C6H11N3S.2BrH/c1-4-5(2-3-7)10-6(8)9-4;;/h2-3,7H2,1H3,(H2,8,9);2*1H	XFXNNOPUDSFVJE-UHFFFAOYSA-N	157.067368072							92694, 92694
Diphenylpyraline	LSM-5385	Diphenylpyraline	3103	InChI=1S/C19H23NO/c1-20-14-12-18(13-15-20)21-19(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18-19H,12-15H2,1H3	OWQUZNMMYNAXSL-UHFFFAOYSA-N	CN1CCC(CC1)OC(c2ccccc2)c3ccccc3	BroadT	BRD-K22936972	BRD-K22936972-003-04-6	MicroSource Discovery Systems Inc.	1500258		Cl	CN1CCC(CC1)OC(c1ccccc1)c1ccccc1.Cl	InChI=1S/C19H23NO.ClH/c1-20-14-12-18(13-15-20)21-19(16-8-4-2-5-9-16)17-10-6-3-7-11-17;/h2-11,18-19H,12-15H2,1H3;1H	LPRLDRXGWKXRMQ-UHFFFAOYSA-N	281.177964366							59788, 59788
Rimexolone	LSM-2685	Rimexolone, Vexol, ORG-6216	5311412	InChI=1S/C24H34O3/c1-6-20(27)24(5)14(2)11-18-17-8-7-15-12-16(25)9-10-22(15,3)21(17)19(26)13-23(18,24)4/h9-10,12,14,17-19,21,26H,6-8,11,13H2,1-5H3/t14-,17+,18+,19+,21-,22+,23+,24-/m1/s1	QTTRZHGPGKRAFB-OOKHYKNYSA-N	CCC(=O)[C@@]1(C)[C@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]12C	BroadT	BRD-K31627533	BRD-K31627533-001-03-8	Prestwick Chemical Inc.	Prestw-1020	D0701-MP04-ST03-200-		CCC(=O)[C@@]1(C)[C@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]12C	InChI=1S/C24H34O3/c1-6-20(27)24(5)14(2)11-18-17-8-7-15-12-16(25)9-10-22(15,3)21(17)19(26)13-23(18,24)4/h9-10,12,14,17-19,21,26H,6-8,11,13H2,1-5H3/t14-,17+,18+,19+,21-,22+,23+,24-/m1/s1	QTTRZHGPGKRAFB-OOKHYKNYSA-N	370.250794948							
Phenacetin	LSM-2851	Acetophenetidin, Acetphenetidin, Phenacetin	4754	InChI=1S/C10H13NO2/c1-3-13-10-6-4-9(5-7-10)11-8(2)12/h4-7H,3H2,1-2H3,(H,11,12)	CPJSUEIXXCENMM-UHFFFAOYSA-N	CCOc1ccc(NC(=O)C)cc1	BroadT	BRD-K38323065	BRD-K38323065-001-05-8	Prestwick Chemical Inc.	Prestw-533	D0701-MP04-ST03-200-		CCOc1ccc(NC(C)=O)cc1	InChI=1S/C10H13NO2/c1-3-13-10-6-4-9(5-7-10)11-8(2)12/h4-7H,3H2,1-2H3,(H,11,12)	CPJSUEIXXCENMM-UHFFFAOYSA-N	179.094628666							8050, 8050
N-(4-Hydroxyphenyl)icosa-5,8,11,14-tetraenamide	LSM-2480	BRD-K21667562	2127	InChI=1S/C26H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(29)27-24-20-22-25(28)23-21-24/h6-7,9-10,12-13,15-16,20-23,28H,2-5,8,11,14,17-19H2,1H3,(H,27,29)	IJBZOOZRAXHERC-UHFFFAOYSA-N	CCCCCC=CCC=CCC=CCC=CCCCC(=O)Nc1ccc(O)cc1	BroadT	BRD-K21667562	BRD-K21667562-001-01-4	Tocris Bioscience	1116	12		CCCCCC=CCC=CCC=CCC=CCCCC(=O)Nc1ccc(O)cc1	InChI=1S/C26H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(29)27-24-20-22-25(28)23-21-24/h6-7,9-10,12-13,15-16,20-23,28H,2-5,8,11,14,17-19H2,1H3,(H,27,29)	IJBZOOZRAXHERC-UHFFFAOYSA-N	395.282429434							92389
CGP-53353	LSM-2701	BRD-K32292990, Daph 2, CGP-53353	6711154	InChI=1S/C20H13F2N3O2/c21-11-1-5-13(6-2-11)23-17-9-15-16(20(27)25-19(15)26)10-18(17)24-14-7-3-12(22)4-8-14/h1-10,23-24H,(H,25,26,27)	RONQPWQYDRPRGG-UHFFFAOYSA-N	Fc1ccc(Nc2cc3C(=O)NC(=O)c3cc2Nc4ccc(F)cc4)cc1	BroadT	BRD-K32292990	BRD-K32292990-001-01-0	Tocris Bioscience	2442	1		Fc1ccc(Nc2cc3C(=O)NC(=O)c3cc2Nc2ccc(F)cc2)cc1	InChI=1S/C20H13F2N3O2/c21-11-1-5-13(6-2-11)23-17-9-15-16(20(27)25-19(15)26)10-18(17)24-14-7-3-12(22)4-8-14/h1-10,23-24H,(H,25,26,27)	RONQPWQYDRPRGG-UHFFFAOYSA-N	365.097583086							92560
GP 2A	LSM-2757	BRD-K34608650, SID50112968	16094766	InChI=1S/C24H23Cl2N3O/c1-14-7-9-18-15(11-14)12-19-22(24(30)27-17-5-3-2-4-6-17)28-29(23(18)19)21-10-8-16(25)13-20(21)26/h7-11,13,17H,2-6,12H2,1H3,(H,27,30)	SPEFJYZGXZENAF-UHFFFAOYSA-N	Cc1ccc2c(Cc3c(nn(c23)c4ccc(Cl)cc4Cl)C(=O)NC5CCCCC5)c1	BroadT	BRD-K34608650	BRD-K34608650-001-01-6	Tocris Bioscience	2678	1		Cc1ccc-2c(Cc3c(nn(c-23)-c2ccc(Cl)cc2Cl)C(=O)NC2CCCCC2)c1	InChI=1S/C24H23Cl2N3O/c1-14-7-9-18-15(11-14)12-19-22(24(30)27-17-5-3-2-4-6-17)28-29(23(18)19)21-10-8-16(25)13-20(21)26/h7-11,13,17H,2-6,12H2,1H3,(H,27,30)	SPEFJYZGXZENAF-UHFFFAOYSA-N	439.121817806							92606
CGS-12066A	LSM-2420	CGS-12066B	2689	InChI=1S/C17H17F3N4/c1-22-7-9-23(10-8-22)16-15-3-2-6-24(15)14-5-4-12(17(18,19)20)11-13(14)21-16/h2-6,11H,7-10H2,1H3	LXFHSCDLMBZYKY-UHFFFAOYSA-N	CN1CCN(CC1)c2nc3cc(ccc3n4cccc24)C(F)(F)F	BroadT	BRD-K18909381	BRD-K18909381-001-01-4	Biomol International Inc.	NS-085	2813-N1283		CN1CCN(CC1)c1nc2cc(ccc2n2cccc12)C(F)(F)F	InChI=1S/C17H17F3N4/c1-22-7-9-23(10-8-22)16-15-3-2-6-24(15)14-5-4-12(17(18,19)20)11-13(14)21-16/h2-6,11H,7-10H2,1H3	LXFHSCDLMBZYKY-UHFFFAOYSA-N	334.140531184							64055, 64055
Arvanil	LSM-42941	SID26755757, SID26755756	6449767	InChI=1S/C28H41NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28(31)29-24-25-21-22-26(30)27(23-25)32-2/h7-8,10-11,13-14,16-17,21-23,30H,3-6,9,12,15,18-20,24H2,1-2H3,(H,29,31)/b8-7-,11-10-,14-13-,17-16-	QVLMCRFQGHWOPM-ZKWNWVNESA-N	CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCc1ccc(O)c(OC)c1	BroadT	BRD-K34092021	BRD-K34092021-001-02-3	Biomol International Inc.	VR101	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCc1ccc(O)c(OC)c1	InChI=1S/C28H41NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28(31)29-24-25-21-22-26(30)27(23-25)32-2/h7-8,10-11,13-14,16-17,21-23,30H,3-6,9,12,15,18-20,24H2,1-2H3,(H,29,31)/b8-7-,11-10-,14-13-,17-16-	QVLMCRFQGHWOPM-ZKWNWVNESA-N	439.308644182							
Ethaverine	LSM-5495	Ethaverine	3280	InChI=1S/C24H29NO4/c1-5-26-21-10-9-17(14-22(21)27-6-2)13-20-19-16-24(29-8-4)23(28-7-3)15-18(19)11-12-25-20/h9-12,14-16H,5-8,13H2,1-4H3	ZOWYFYXTIWQBEP-UHFFFAOYSA-N	CCOc1ccc(Cc2nccc3cc(OCC)c(OCC)cc23)cc1OCC	BroadT	BRD-K36756879	BRD-K36756879-003-04-6	MicroSource Discovery Systems Inc.	1501000		Cl	CCOc1ccc(Cc2nccc3cc(OCC)c(OCC)cc23)cc1OCC.Cl	InChI=1S/C24H29NO4.ClH/c1-5-26-21-10-9-17(14-22(21)27-6-2)13-20-19-16-24(29-8-4)23(28-7-3)15-18(19)11-12-25-20;/h9-12,14-16H,5-8,13H2,1-4H3;1H	UPUDVKWQBVIKBG-UHFFFAOYSA-N	395.209658418							94592, 94592
(-)-Epicatechin	LSM-20956	Epicatechin, Epi-Catechin	72276	InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15-/m1/s1	PFTAWBLQPZVEMU-UKRRQHHQSA-N	O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3ccc(O)c(O)c3	BroadT	BRD-K30656344	BRD-K30656344-001-02-9	AnalytiCon Discovery GmbH	NP-000180			O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1ccc(O)c(O)c1	InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15-/m1/s1	PFTAWBLQPZVEMU-UKRRQHHQSA-N	290.079038168							90
Cilostamide	LSM-2628		2753	InChI=1S/C20H26N2O3/c1-22(16-6-3-2-4-7-16)20(24)8-5-13-25-17-10-11-18-15(14-17)9-12-19(23)21-18/h9-12,14,16H,2-8,13H2,1H3,(H,21,23)	UIAYVIIHMORPSJ-UHFFFAOYSA-N	CN(C1CCCCC1)C(=O)CCCOc2ccc3NC(=O)C=Cc3c2	BroadT	BRD-K28578425	BRD-K28578425-001-01-3	Calbiochem	231085			CN(C1CCCCC1)C(=O)CCCOc1ccc2[nH]c(=O)ccc2c1	InChI=1S/C20H26N2O3/c1-22(16-6-3-2-4-7-16)20(24)8-5-13-25-17-10-11-18-15(14-17)9-12-19(23)21-18/h9-12,14,16H,2-8,13H2,1H3,(H,21,23)	UIAYVIIHMORPSJ-UHFFFAOYSA-N	342.194342712							92503
Mefexamide	LSM-2459	Mefexamide	4045	InChI=1S/C15H24N2O3/c1-4-17(5-2)11-10-16-15(18)12-20-14-8-6-13(19-3)7-9-14/h6-9H,4-5,10-12H2,1-3H3,(H,16,18)	HUNIPYLVUPMFCZ-UHFFFAOYSA-N	CCN(CC)CCNC(=O)COc1ccc(OC)cc1	BroadT	BRD-K20655524	BRD-K20655524-003-04-7	Prestwick Chemical Inc.	Prestw-215	D0701-MP04-ST03-200-	Cl	CCN(CC)CCNC(=O)COc1ccc(OC)cc1.Cl	InChI=1S/C15H24N2O3.ClH/c1-4-17(5-2)11-10-16-15(18)12-20-14-8-6-13(19-3)7-9-14;/h6-9H,4-5,10-12H2,1-3H3,(H,16,18);1H	AXBHPHPHZHAOAK-UHFFFAOYSA-N	280.178692648							92373, 92373
Cearoin	LSM-20957	Cearoin	3938139	InChI=1S/C14H12O4/c1-18-13-8-11(15)10(7-12(13)16)14(17)9-5-3-2-4-6-9/h2-8,15-16H,1H3	NFJVELXCUBWAFL-UHFFFAOYSA-N	COc1cc(O)c(cc1O)C(=O)c2ccccc2	BroadT	BRD-K20420220	BRD-K20420220-001-02-1	MicroSource Discovery Systems Inc.	290030			COc1cc(O)c(cc1O)C(=O)c1ccccc1	InChI=1S/C14H12O4/c1-18-13-8-11(15)10(7-12(13)16)14(17)9-5-3-2-4-6-9/h2-8,15-16H,1H3	NFJVELXCUBWAFL-UHFFFAOYSA-N	244.073558864							109547
Clocortolone Pivalate	LSM-2844	Cloderm, SH-863, Clocortolone Pivalate	5282493	InChI=1S/C27H36ClFO5/c1-14-9-16-17-11-19(29)18-10-15(30)7-8-26(18,6)27(17,28)21(32)12-25(16,5)22(14)20(31)13-34-23(33)24(2,3)4/h7-8,10,14,16-17,19,21-22,32H,9,11-13H2,1-6H3/t14-,16+,17+,19+,21+,22-,25+,26+,27+/m1/s1	SXYZQZLHAIHKKY-GSTUPEFVSA-N	C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@]2(C)[C@H]1C(=O)COC(=O)C(C)(C)C	BroadT	BRD-K38003476	BRD-K38003476-001-03-4	Prestwick Chemical Inc.	Prestw-1119	D0701-MP04-ST03-200-		C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@]2(C)[C@H]1C(=O)COC(=O)C(C)(C)C	InChI=1S/C27H36ClFO5/c1-14-9-16-17-11-19(29)18-10-15(30)7-8-26(18,6)27(17,28)21(32)12-25(16,5)22(14)20(31)13-34-23(33)24(2,3)4/h7-8,10,14,16-17,19,21-22,32H,9,11-13H2,1-6H3/t14-,16+,17+,19+,21+,22-,25+,26+,27+/m1/s1	SXYZQZLHAIHKKY-GSTUPEFVSA-N	494.223530162							59583
3-Acetylcoumarin	LSM-6573	BRD-K26954192, SID11112551, SID56463087, SID90486	77553	InChI=1S/C11H8O3/c1-7(12)9-6-8-4-2-3-5-10(8)14-11(9)13/h2-6H,1H3	CSPIFKKOBWYOEX-UHFFFAOYSA-N	CC(=O)C1=Cc2ccccc2OC1=O	BroadT	BRD-K26954192	BRD-K26954192-001-03-5	Prestwick Chemical Inc.	Prestw-891	D0701-MP04-ST03-200-		CC(=O)c1cc2ccccc2oc1=O	InChI=1S/C11H8O3/c1-7(12)9-6-8-4-2-3-5-10(8)14-11(9)13/h2-6H,1H3	CSPIFKKOBWYOEX-UHFFFAOYSA-N	188.047344116							95250
Gossypol	LSM-6229	Gossypol, (-)-Gossypol	3503	InChI=1S/C30H30O8/c1-11(2)19-15-7-13(5)21(27(35)23(15)17(9-31)25(33)29(19)37)22-14(6)8-16-20(12(3)4)30(38)26(34)18(10-32)24(16)28(22)36/h7-12,33-38H,1-6H3	QBKSWRVVCFFDOT-UHFFFAOYSA-N	CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)c3c(C)cc4c(C(C)C)c(O)c(O)c(C=O)c4c3O	BroadT	BRD-K19295594	BRD-K19295594-001-04-4	MicroSource Discovery Systems Inc.	1504019			CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O	InChI=1S/C30H30O8/c1-11(2)19-15-7-13(5)21(27(35)23(15)17(9-31)25(33)29(19)37)22-14(6)8-16-20(12(3)4)30(38)26(34)18(10-32)24(16)28(22)36/h7-12,33-38H,1-6H3	QBKSWRVVCFFDOT-UHFFFAOYSA-N	518.19406792							, 
Methyl Robustone	LSM-20958	SID26749763	3473650	InChI=1S/C22H18O6/c1-22(2)7-6-13-16(28-22)9-18-19(21(13)24-3)20(23)14(10-25-18)12-4-5-15-17(8-12)27-11-26-15/h4-10H,11H2,1-3H3	OKBNMQXBQLZQEM-UHFFFAOYSA-N	COc1c2C=CC(C)(C)Oc2cc3OC=C(C(=O)c13)c4ccc5OCOc5c4	BroadT	BRD-K25811799	BRD-K25811799-001-02-7	MicroSource Discovery Systems Inc.	1401401			COc1c2C=CC(C)(C)Oc2cc2occ(-c3ccc4OCOc4c3)c(=O)c12	InChI=1S/C22H18O6/c1-22(2)7-6-13-16(28-22)9-18-19(21(13)24-3)20(23)14(10-25-18)12-4-5-15-17(8-12)27-11-26-15/h4-10H,11H2,1-3H3	OKBNMQXBQLZQEM-UHFFFAOYSA-N	378.110338296							109548
CHEMBL586058	LSM-2796	SID26753214, BRD-K36258877	16759160	InChI=1S/C18H13Cl2N5O4/c1-2-5-21-16(26)11-7-10(25(28)29)8-12-15(11)23-18(24-17(12)27)22-9-3-4-13(19)14(20)6-9/h2-4,6-8H,1,5H2,(H,21,26)(H2,22,23,24,27)	VUBILPOZTRGZJK-UHFFFAOYSA-N	[O-][N+](=O)c1cc(C(=O)NCC=C)c2N=C(Nc3ccc(Cl)c(Cl)c3)NC(=O)c2c1	BroadT	BRD-K36258877	BRD-K36258877-001-01-5	Tocris Bioscience	2172	1		[O-][N+](=O)c1cc(C(=O)NCC=C)c2nc(Nc3ccc(Cl)c(Cl)c3)[nH]c(=O)c2c1	InChI=1S/C18H13Cl2N5O4/c1-2-5-21-16(26)11-7-10(25(28)29)8-12-15(11)23-18(24-17(12)27)22-9-3-4-13(19)14(20)6-9/h2-4,6-8H,1,5H2,(H,21,26)(H2,22,23,24,27)	VUBILPOZTRGZJK-UHFFFAOYSA-N	433.034459366							92637
Chlorotrianisene	LSM-5411	Trianisestrol, Tace, Chlortrianisestrol, Chlorotrianisene	11289	InChI=1S/C23H21ClO3/c1-25-19-10-4-16(5-11-19)22(17-6-12-20(26-2)13-7-17)23(24)18-8-14-21(27-3)15-9-18/h4-15H,1-3H3	BFPSDSIWYFKGBC-UHFFFAOYSA-N	COc1ccc(cc1)C(=C(c2ccc(OC)cc2)c3ccc(OC)cc3)Cl	BroadT	BRD-K27062708	BRD-K27062708-001-04-1	MicroSource Discovery Systems Inc.	1500181			COc1ccc(cc1)C(Cl)=C(c1ccc(OC)cc1)c1ccc(OC)cc1	InChI=1S/C23H21ClO3/c1-25-19-10-4-16(5-11-19)22(17-6-12-20(26-2)13-7-17)23(24)18-8-14-21(27-3)15-9-18/h4-15H,1-3H3	BFPSDSIWYFKGBC-UHFFFAOYSA-N	380.117922242							3641
Clozapine	LSM-2823	Clozapine, Clozaril, Fazaclo, HF-1854, Fazaclo ODT	2818	InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3	QZUDBNBUXVUHMW-UHFFFAOYSA-N	CN1CCN(CC1)C2=Nc3cc(Cl)ccc3Nc4ccccc24	BroadT	BRD-K37289225	BRD-K37289225-001-07-5	Biomol International Inc.	D107	2840(V2)-3-N1305		CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12	InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3	QZUDBNBUXVUHMW-UHFFFAOYSA-N	326.129824358							3766, 3766
BAY 59-3074	LSM-2414	BRD-K18799075, BAY-593074	10479060	InChI=1S/C18H13F6NO4S/c19-17(20,21)8-3-9-30(26,27)29-13-5-1-4-12(10-13)28-16-7-2-6-15(14(16)11-25)18(22,23)24/h1-2,4-7,10H,3,8-9H2	LWUSZIVDPJPVBW-UHFFFAOYSA-N	FC(F)(F)CCCS(=O)(=O)Oc1cccc(Oc2cccc(c2C#N)C(F)(F)F)c1	BroadT	BRD-K18799075	BRD-K18799075-001-01-0	Tocris Bioscience	2500	1		FC(F)(F)CCCS(=O)(=O)Oc1cccc(Oc2cccc(c2C#N)C(F)(F)F)c1	InChI=1S/C18H13F6NO4S/c19-17(20,21)8-3-9-30(26,27)29-13-5-1-4-12(10-13)28-16-7-2-6-15(14(16)11-25)18(22,23)24/h1-2,4-7,10H,3,8-9H2	LWUSZIVDPJPVBW-UHFFFAOYSA-N	453.046947796							92339
3-Bromo-7-nitroindazole	LSM-20959	SID90341482, SID85230935, SID50104558, SID50104557, Bromo-7-Nitroindazole 3-Bromo-7-Nitroindazole	1649	InChI=1S/C7H4BrN3O2/c8-7-4-2-1-3-5(11(12)13)6(4)9-10-7/h1-3H,(H,9,10)	NFSTZPMYAZRZPC-UHFFFAOYSA-N	[O-][N+](=O)c1cccc2c(Br)n[nH]c12	BroadT	BRD-K24689407	BRD-K24689407-001-04-8	Biomol International Inc.	CN252	2840(V2)-3-N1305		[O-][N+](=O)c1cccc2c(Br)n[nH]c12	InChI=1S/C7H4BrN3O2/c8-7-4-2-1-3-5(11(12)13)6(4)9-10-7/h1-3H,(H,9,10)	NFSTZPMYAZRZPC-UHFFFAOYSA-N	240.948688998							
Sulfamethizole	LSM-5455	Thiosulfil, Tetracid, Sulphamethylthiadiazole, Sulphamethizole, Sulfamethizole, Proklar, Microsul, Methazol	5328	InChI=1S/C9H10N4O2S2/c1-6-11-12-9(16-6)13-17(14,15)8-4-2-7(10)3-5-8/h2-5H,10H2,1H3,(H,12,13)	VACCAVUAMIDAGB-UHFFFAOYSA-N	Cc1nnc(NS(=O)(=O)c2ccc(N)cc2)s1	BroadT	BRD-K31682896	BRD-K31682896-001-04-2	MicroSource Discovery Systems Inc.	1500549			Cc1nnc(NS(=O)(=O)c2ccc(N)cc2)s1	InChI=1S/C9H10N4O2S2/c1-6-11-12-9(16-6)13-17(14,15)8-4-2-7(10)3-5-8/h2-5H,10H2,1H3,(H,12,13)	VACCAVUAMIDAGB-UHFFFAOYSA-N	270.02451698							9331
LOPAC-L-133	LSM-2633	L-750,667 TRIHYDROCHLORIDE(?)-3-4-IODOPHENYL)-1-PIPERAZYL METHYLPYRROLO 2,3-B PYRIMIDINE, SID50111123, SID90341040	6603897	InChI=1S/C18H19IN4/c19-15-3-5-16(6-4-15)23-10-8-22(9-11-23)13-14-12-21-18-17(14)2-1-7-20-18/h1-7,12H,8-11,13H2,(H,20,21)	OOEUHRGMLFVKQO-UHFFFAOYSA-N	Ic1ccc(cc1)N2CCN(Cc3c[nH]c4ncccc34)CC2	BroadT	BRD-K28806945	BRD-K28806945-001-01-9	Biomol International Inc.	AC-818	2812-3-N1298		Ic1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1	InChI=1S/C18H19IN4/c19-15-3-5-16(6-4-15)23-10-8-22(9-11-23)13-14-12-21-18-17(14)2-1-7-20-18/h1-7,12H,8-11,13H2,(H,20,21)	OOEUHRGMLFVKQO-UHFFFAOYSA-N	418.065439648							92507, 92507, 92507
Sulfamethoxazole	LSM-5422	Urobak, Suphamethoxazole, Sulphamethoxazole, Sulfamethoxazole, Sinomin, Gantanol, Acetylsulfamethoxazole, RO-42130, Sulfamethoxazole Sodium, Gantanol-DS	5329	InChI=1S/C10H11N3O3S/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)	JLKIGFTWXXRPMT-UHFFFAOYSA-N	Cc1onc(NS(=O)(=O)c2ccc(N)cc2)c1	BroadT	BRD-K28494619	BRD-K28494619-001-04-3	MicroSource Discovery Systems Inc.	1500550			Cc1cc(NS(=O)(=O)c2ccc(N)cc2)no1	InChI=1S/C10H11N3O3S/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)	JLKIGFTWXXRPMT-UHFFFAOYSA-N	253.052111932							9332
SPECTRUM_000726	LSM-20960	BRD-K26376097	6708693	InChI=1S/C16H20O2/c1-16-8-7-13(17)9-12(16)5-3-11-4-6-14(18-2)10-15(11)16/h4,6,10,12H,3,5,7-9H2,1-2H3/t12-,16+/m1/s1	MMDQZMROSQWSDC-WBMJQRKESA-N	COc1ccc2CC[C@@H]3CC(=O)CC[C@]3(C)c2c1	BroadT	BRD-K26376097	BRD-K26376097-001-02-9	MicroSource Discovery Systems Inc.	100254			COc1ccc2CC[C@@H]3CC(=O)CC[C@]3(C)c2c1	InChI=1S/C16H20O2/c1-16-8-7-13(17)9-12(16)5-3-11-4-6-14(18-2)10-15(11)16/h4,6,10,12H,3,5,7-9H2,1-2H3/t12-,16+/m1/s1	MMDQZMROSQWSDC-WBMJQRKESA-N	244.14632988							
Moricizine	LSM-2476	Moricizine, Moracizine, Ethmozine, EN-313	34633	InChI=1S/C22H25N3O4S/c1-2-29-22(27)23-16-7-8-20-18(15-16)25(17-5-3-4-6-19(17)30-20)21(26)9-10-24-11-13-28-14-12-24/h3-8,15H,2,9-14H2,1H3,(H,23,27)	FUBVWMNBEHXPSU-UHFFFAOYSA-N	CCOC(=O)Nc1ccc2Sc3ccccc3N(C(=O)CCN4CCOCC4)c2c1	BroadT	BRD-K21548250	BRD-K21548250-001-01-3	TimTec LLC	ST012322			CCOC(=O)Nc1ccc2Sc3ccccc3N(C(=O)CCN3CCOCC3)c2c1	InChI=1S/C22H25N3O4S/c1-2-29-22(27)23-16-7-8-20-18(15-16)25(17-5-3-4-6-19(17)30-20)21(26)9-10-24-11-13-28-14-12-24/h3-8,15H,2,9-14H2,1H3,(H,23,27)	FUBVWMNBEHXPSU-UHFFFAOYSA-N	427.156577							6997, 6997
Dexamethasone	LSM-5512	Dexone, Fluormethylprednisolone, Hexadrol, Maxidex, Mymethasone, Neodecadron, Ozurdex, Dalalone, Decaderm, Decadron, Decaspray, Dexacort, Dexair, Dexamethasone, Dexone 0.5, Dexone 0.75, Dexone 1.5, Dexone 4, Dexacen-4, Dexamethasone Intensol, Dexamethasone Metasulfobenzoate Sodium, Dexamethasone Palmitate, Dexamethasone Valerate, Kortico Injection, Aeroseb-Dex, Decadron-LA	5743	InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1	UREBDLICKHMUKA-CXSFZGCWSA-N	C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO	BroadT	BRD-K38775274	BRD-K38775274-001-02-3	Biomol International Inc.	EI-126	2840(V2)-3-N1305		C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO	InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1	UREBDLICKHMUKA-CXSFZGCWSA-N	392.199902228							41879
Sphondin	LSM-20961	SID22405507, SID26749579	108104	InChI=1S/C12H8O4/c1-14-9-6-7-2-3-10(13)16-11(7)8-4-5-15-12(8)9/h2-6H,1H3	DLCJNIBLOSKIQW-UHFFFAOYSA-N	COc1cc2C=CC(=O)Oc2c3ccoc13	BroadT	BRD-K33260002	BRD-K33260002-001-02-0	MicroSource Discovery Systems Inc.	300005			COc1cc2ccc(=O)oc2c2ccoc12	InChI=1S/C12H8O4/c1-14-9-6-7-2-3-10(13)16-11(7)8-4-5-15-12(8)9/h2-6H,1H3	DLCJNIBLOSKIQW-UHFFFAOYSA-N	216.042258736							81486
Ebselen	LSM-2644	Ebselen	3194	InChI=1S/C13H9NOSe/c15-13-11-8-4-5-9-12(11)16-14(13)10-6-2-1-3-7-10/h1-9H	DYEFUKCXAQOFHX-UHFFFAOYSA-N	O=C1N([Se]c2ccccc12)c3ccccc3	BroadT	BRD-K29359156	BRD-K29359156-001-04-6	MicroSource Discovery Systems Inc.	1501188			O=c1n([se]c2ccccc12)-c1ccccc1	InChI=1S/C13H9NOSe/c15-13-11-8-4-5-9-12(11)16-14(13)10-6-2-1-3-7-10/h1-9H	DYEFUKCXAQOFHX-UHFFFAOYSA-N	274.984935718							77543
Seneciphylline	LSM-42953	Seneciphylline	5281750	InChI=1S/C18H23NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,14-15,22H,2,6-10H2,1,3H3/b12-4-/t14-,15-,18-/m1/s1	FCEVNJIUIMLVML-QPSVUOIXSA-N	C\C=C/1\CC(=C)[C@@](C)(O)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@@H]23	BroadT	BRD-K38449220	BRD-K38449220-001-03-8	Prestwick Chemical Inc.	Prestw-599	D0701-MP04-ST03-200-		C\C=C1\CC(=C)[C@@](C)(O)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@@H]23	InChI=1S/C18H23NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,14-15,22H,2,6-10H2,1,3H3/b12-4-/t14-,15-,18-/m1/s1	FCEVNJIUIMLVML-QPSVUOIXSA-N	333.157622846							9108
LY 303511	LSM-2497	LY-303511, BRD-K22385716	3971	InChI=1S/C19H18N2O2/c22-17-13-18(21-11-9-20-10-12-21)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13,20H,9-12H2	NGAGMBNBKCDCDJ-UHFFFAOYSA-N	O=C1C=C(Oc2c1cccc2c3ccccc3)N4CCNCC4	BroadT	BRD-K22385716	BRD-K22385716-001-01-7	Tocris Bioscience	2418	1		O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCNCC1	InChI=1S/C19H18N2O2/c22-17-13-18(21-11-9-20-10-12-21)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13,20H,9-12H2	NGAGMBNBKCDCDJ-UHFFFAOYSA-N	306.136827836							92399
Tryptoline	LSM-2711	Noreleagnine	107838	InChI=1S/C11H12N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-4,12-13H,5-7H2	CFTOTSJVQRFXOF-UHFFFAOYSA-N	C1Cc2c(CN1)[nH]c3ccccc23	BroadT	BRD-K32696739	BRD-K32696739-001-02-6	MicroSource Discovery Systems Inc.	1500939			C1Cc2c(CN1)[nH]c1ccccc21	InChI=1S/C11H12N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-4,12-13H,5-7H2	CFTOTSJVQRFXOF-UHFFFAOYSA-N	172.100048404							92568
Coumarin	LSM-2519	Coumarin	323	InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H	ZYGHJZDHTFUPRJ-UHFFFAOYSA-N	O=C1Oc2ccccc2C=C1	BroadT	BRD-K23913458	BRD-K23913458-001-02-5	MicroSource Discovery Systems Inc.	1400208			O=c1ccc2ccccc2o1	InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H	ZYGHJZDHTFUPRJ-UHFFFAOYSA-N	146.036779432							28794
RG 14620	LSM-42910	SID26756728, RG-14620	5926218	InChI=1S/C14H8Cl2N2/c15-13-5-10(6-14(16)7-13)4-12(8-17)11-2-1-3-18-9-11/h1-7,9H/b12-4+	TYXIVBJQPBWBHO-UUILKARUSA-N	Clc1cc(Cl)cc(\C=C(/C#N)\c2cccnc2)c1	BroadT	BRD-K21853356	BRD-K21853356-001-04-4	Biomol International Inc.	EI-253	2840(V2)-3-N1305		Clc1cc(Cl)cc(c1)\C=C(/C#N)c1cccnc1	InChI=1S/C14H8Cl2N2/c15-13-5-10(6-14(16)7-13)4-12(8-17)11-2-1-3-18-9-11/h1-7,9H/b12-4+	TYXIVBJQPBWBHO-UUILKARUSA-N	274.006453696							
Dimaprit	LSM-5390	Dimaprit	3077	InChI=1S/C6H15N3S/c1-9(2)4-3-5-10-6(7)8/h3-5H2,1-2H3,(H3,7,8)	OLHQOJYVQUNWPL-UHFFFAOYSA-N	CN(C)CCCSC(=N)N	BroadT	BRD-K23541596	BRD-K23541596-300-04-9	Tocris Bioscience	506	2	Cl.Cl	CN(C)CCCSC(N)=N.Cl.Cl	InChI=1S/C6H15N3S.2ClH/c1-9(2)4-3-5-10-6(7)8;;/h3-5H2,1-2H3,(H3,7,8);2*1H	DFWCPLGXFMSUCW-UHFFFAOYSA-N	161.0986682							81389, 81389
RS-39604	LSM-2461	RS 39604, RS-39604	5145950	InChI=1S/C26H36ClN3O6S/c1-34-20-12-19(13-21(14-20)35-2)17-36-26-16-24(28)23(27)15-22(26)25(31)5-4-18-6-9-30(10-7-18)11-8-29-37(3,32)33/h12-16,18,29H,4-11,17,28H2,1-3H3	BKVIWGRFRKLFIO-UHFFFAOYSA-N	COc1cc(COc2cc(N)c(Cl)cc2C(=O)CCC3CCN(CCNS(=O)(=O)C)CC3)cc(OC)c1	BroadT	BRD-K20742498	BRD-K20742498-001-01-5	Biomol International Inc.	AC-570	2813-N1283		COc1cc(COc2cc(N)c(Cl)cc2C(=O)CCC2CCN(CCNS(C)(=O)=O)CC2)cc(OC)c1	InChI=1S/C26H36ClN3O6S/c1-34-20-12-19(13-21(14-20)35-2)17-36-26-16-24(28)23(27)15-22(26)25(31)5-4-18-6-9-30(10-7-18)11-8-29-37(3,32)33/h12-16,18,29H,4-11,17,28H2,1-3H3	BKVIWGRFRKLFIO-UHFFFAOYSA-N	553.201334302							64083, 64083
Levocabastine	LSM-2731	Levocabastine, R-50547		InChI=1S/C26H29FN2O2/c1-19-17-29(16-15-26(19,24(30)31)21-5-3-2-4-6-21)23-11-13-25(18-28,14-12-23)20-7-9-22(27)10-8-20/h2-10,19,23H,11-17H2,1H3,(H,30,31)/t19-,23-,25-,26-/m1/s1	ZCGOMHNNNFPNMX-KYTRFIICSA-N	C[C@@H]1CN(CC[C@]1(C(=O)O)c2ccccc2)[C@@H]3CC[C@@](CC3)(C#N)c4ccc(F)cc4	BroadT	BRD-K33453211	BRD-K33453211-003-03-2	Prestwick Chemical Inc.	Prestw-1039	D0701-MP04-ST03-200-	Cl	C[C@@H]1CN(CC[C@]1(C(O)=O)c1ccccc1)[C@H]1CC[C@](CC1)(C#N)c1ccc(F)cc1.Cl	InChI=1S/C26H29FN2O2.ClH/c1-19-17-29(16-15-26(19,24(30)31)21-5-3-2-4-6-21)23-11-13-25(18-28,14-12-23)20-7-9-22(27)10-8-20;/h2-10,19,23H,11-17H2,1H3,(H,30,31);1H/t19-,23-,25-,26-;/m1./s1	OICFWWJHIMKBCD-VALQNVSPSA-N	420.221306388							, 
Cnqx	LSM-3184	6-Cyano-7-Nitroquinoxaline-2,3-Dione, SID11113401, SID11113878, SID26751641, BRD-K53545112	3721046	InChI=1S/C9H4N4O4/c10-3-4-1-5-6(2-7(4)13(16)17)12-9(15)8(14)11-5/h1-2H,(H,11,14)(H,12,15)	RPXVIAFEQBNEAX-UHFFFAOYSA-N	Oc1nc2cc(C#N)c(cc2nc1O)[N+](=O)[O-]	BroadT	BRD-K19438463	BRD-K19438463-001-01-4	Biomol International Inc.	AC-396	2817-N1277		[O-][N+](=O)c1cc2[nH]c(=O)c(=O)[nH]c2cc1C#N	InChI=1S/C9H4N4O4/c10-3-4-1-5-6(2-7(4)13(16)17)12-9(15)8(14)11-5/h1-2H,(H,11,14)(H,12,15)	RPXVIAFEQBNEAX-UHFFFAOYSA-N	232.023254648							34468, 34468
Paraxanthine	LSM-20962	Paraxanthine(72%)	4687	InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)11(2)7(13)9-5/h3H,1-2H3,(H,9,13)	QUNWUDVFRNGTCO-UHFFFAOYSA-N	CN1C(=O)Nc2ncn(C)c2C1=O	BroadT	BRD-K24084088	BRD-K24084088-001-02-2	MicroSource Discovery Systems Inc.	2300170			Cn1cnc2[nH]c(=O)n(C)c(=O)c12	InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)11(2)7(13)9-5/h3H,1-2H3,(H,9,13)	QUNWUDVFRNGTCO-UHFFFAOYSA-N	180.064725536							25858
STK179629	LSM-2626	Nitrocaramiphen, SID124882724, SID26751730, SID124882723	3941250	InChI=1S/C18H26N2O4/c1-3-19(4-2)13-14-24-17(21)18(11-5-6-12-18)15-7-9-16(10-8-15)20(22)23/h7-10H,3-6,11-14H2,1-2H3	NSHMVLOWOAQFTP-UHFFFAOYSA-N	CCN(CC)CCOC(=O)C1(CCCC1)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K28453807	BRD-K28453807-003-05-4	Tocris Bioscience	469	1	Cl	CCN(CC)CCOC(=O)C1(CCCC1)c1ccc(cc1)[N+]([O-])=O.Cl	InChI=1S/C18H26N2O4.ClH/c1-3-19(4-2)13-14-24-17(21)18(11-5-6-12-18)15-7-9-16(10-8-15)20(22)23;/h7-10H,3-6,11-14H2,1-2H3;1H	XWQWACGTGFICFO-UHFFFAOYSA-N	334.189257332							92501, 92501
Riluzole	LSM-2471	Riluzole, Rilutek, RP-54274	5070	InChI=1S/C8H5F3N2OS/c9-8(10,11)14-4-1-2-5-6(3-4)15-7(12)13-5/h1-3H,(H2,12,13)	FTALBRSUTCGOEG-UHFFFAOYSA-N	Nc1nc2ccc(OC(F)(F)F)cc2s1	BroadT	BRD-K21283037	BRD-K21283037-001-02-5	Biomol International Inc.	AC-501	2819-N1292		Nc1nc2ccc(OC(F)(F)F)cc2s1	InChI=1S/C8H5F3N2OS/c9-8(10,11)14-4-1-2-5-6(3-4)15-7(12)13-5/h1-3H,(H2,12,13)	FTALBRSUTCGOEG-UHFFFAOYSA-N	234.00746809							8863, 8863
Fenspiride	LSM-5410	Fenspiride	3344	InChI=1S/C15H20N2O2/c18-14-16-12-15(19-14)7-10-17(11-8-15)9-6-13-4-2-1-3-5-13/h1-5H,6-12H2,(H,16,18)	FVNFBBAOMBJTST-UHFFFAOYSA-N	O=C1NCC2(CCN(CCc3ccccc3)CC2)O1	BroadT	BRD-K26739552	BRD-K26739552-003-04-8	MicroSource Discovery Systems Inc.	1501021		Cl	O=C1NCC2(CCN(CCc3ccccc3)CC2)O1.Cl	InChI=1S/C15H20N2O2.ClH/c18-14-16-12-15(19-14)7-10-17(11-8-15)9-6-13-4-2-1-3-5-13;/h1-5H,6-12H2,(H,16,18);1H	FIKFLLIUPUVONI-UHFFFAOYSA-N	260.1524779							94558, 94558
Hydrocotarnine	LSM-2830	Hydrocotarnine	3646	InChI=1S/C12H15NO3/c1-13-4-3-8-5-10-12(16-7-15-10)11(14-2)9(8)6-13/h5H,3-4,6-7H2,1-2H3	XXANNZJIZQTCBP-UHFFFAOYSA-N	COc1c2CN(C)CCc2cc3OCOc13	BroadT	BRD-K37447567	BRD-K37447567-001-01-8	MicroSource Discovery Systems Inc.	1505350			COc1c2OCOc2cc2CCN(C)Cc12	InChI=1S/C12H15NO3/c1-13-4-3-8-5-10-12(16-7-15-10)11(14-2)9(8)6-13/h5H,3-4,6-7H2,1-2H3	XXANNZJIZQTCBP-UHFFFAOYSA-N	221.10519335							92664, 92664, 92664
GW3965	LSM-2738	BRD-K33818169, GW3965	447905	InChI=1S/C33H31ClF3NO3/c34-32-27(15-8-17-30(32)33(35,36)37)22-38(18-9-19-41-28-16-7-10-24(20-28)21-31(39)40)23-29(25-11-3-1-4-12-25)26-13-5-2-6-14-26/h1-8,10-17,20,29H,9,18-19,21-23H2,(H,39,40)	NAXSRXHZFIBFMI-UHFFFAOYSA-N	OC(=O)Cc1cccc(OCCCN(CC(c2ccccc2)c3ccccc3)Cc4cccc(c4Cl)C(F)(F)F)c1	BroadT	BRD-K33818169	BRD-K33818169-003-01-2	Tocris Bioscience	2474	2	Cl	OC(=O)Cc1cccc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)c1.Cl	InChI=1S/C33H31ClF3NO3.ClH/c34-32-27(15-8-17-30(32)33(35,36)37)22-38(18-9-19-41-28-16-7-10-24(20-28)21-31(39)40)23-29(25-11-3-1-4-12-25)26-13-5-2-6-14-26;/h1-8,10-17,20,29H,9,18-19,21-23H2,(H,39,40);1H	NMPUWJFHNOUNQU-UHFFFAOYSA-N	581.194456172							79995
133040-77-4	LSM-2740	BRD-K33864865, SID11113857	4355450	InChI=1S/C27H24BrN3O2/c1-17(2)33-21-7-5-6-20(15-21)31-26(30-25-9-4-3-8-22(25)27(31)32)13-10-18-16-29-24-12-11-19(28)14-23(18)24/h3-9,11-12,14-17,29H,10,13H2,1-2H3	KUECXUACQOYKNB-UHFFFAOYSA-N	CC(C)Oc1cccc(c1)N2C(=Nc3ccccc3C2=O)CCc4c[nH]c5ccc(Br)cc45	BroadT	BRD-K33864865	BRD-K33864865-001-01-7	Tocris Bioscience	1018	2		CC(C)Oc1cccc(c1)-n1c(CCc2c[nH]c3ccc(Br)cc23)nc2ccccc2c1=O	InChI=1S/C27H24BrN3O2/c1-17(2)33-21-7-5-6-20(15-21)31-26(30-25-9-4-3-8-22(25)27(31)32)13-10-18-16-29-24-12-11-19(28)14-23(18)24/h3-9,11-12,14-17,29H,10,13H2,1-2H3	KUECXUACQOYKNB-UHFFFAOYSA-N	501.105189638							92592
Guanfacine	LSM-2716	Guanfacine, Tenex	3519	InChI=1S/C9H9Cl2N3O/c10-6-2-1-3-7(11)5(6)4-8(15)14-9(12)13/h1-3H,4H2,(H4,12,13,14,15)	INJOMKTZOLKMBF-UHFFFAOYSA-N	NC(=N)NC(=O)Cc1c(Cl)cccc1Cl	BroadT	BRD-K32830106	BRD-K32830106-003-11-3	Tocris Bioscience	1030	5	Cl	NC(=N)NC(=O)Cc1c(Cl)cccc1Cl.Cl	InChI=1S/C9H9Cl2N3O.ClH/c10-6-2-1-3-7(11)5(6)4-8(15)14-9(12)13;/h1-3H,4H2,(H4,12,13,14,15);1H	DGFYECXYGUIODH-UHFFFAOYSA-N	245.012267358							5558, 5558
Felamidin	LSM-2804		1042895	InChI=1S/C21H18O5/c1-21(2,26-20(23)13-6-4-3-5-7-13)18-11-15-10-14-8-9-19(22)25-16(14)12-17(15)24-18/h3-10,12,18H,11H2,1-2H3/t18-/m0/s1	VIPXLQMQEIDXMH-SFHVURJKSA-N	CC(C)(OC(=O)c1ccccc1)[C@@H]2Cc3cc4C=CC(=O)Oc4cc3O2	BroadT	BRD-K36638198	BRD-K36638198-001-02-8	MicroSource Discovery Systems Inc.	1504164			CC(C)(OC(=O)c1ccccc1)[C@@H]1Cc2cc3ccc(=O)oc3cc2O1	InChI=1S/C21H18O5/c1-21(2,26-20(23)13-6-4-3-5-7-13)18-11-15-10-14-8-9-19(22)25-16(14)12-17(15)24-18/h3-10,12,18H,11H2,1-2H3/t18-/m0/s1	VIPXLQMQEIDXMH-SFHVURJKSA-N	350.115423676							92642
Pifithrin-beta	LSM-2688	Cyclic Pft-Alpha, Pifithrin-Beta	443278	InChI=1S/C16H16N2S/c1-11-6-8-12(9-7-11)13-10-18-14-4-2-3-5-15(14)19-16(18)17-13/h6-10H,2-5H2,1H3	IMUKUMUNZJILCG-UHFFFAOYSA-N	Cc1ccc(cc1)c2cn3c4CCCCc4sc3n2	BroadT	BRD-K31792052	BRD-K31792052-004-01-9	Calbiochem	506134		Br	Cc1ccc(cc1)-c1cn2c3CCCCc3sc2n1.Br	InChI=1S/C16H16N2S.BrH/c1-11-6-8-12(9-7-11)13-10-18-14-4-2-3-5-15(14)19-16(18)17-13;/h6-10H,2-5H2,1H3;1H	SGNCOAOESGSEOP-UHFFFAOYSA-N	268.103419222							92551, 92551
Glyburide	LSM-2811	Glyburide, Glynase, Glibenclamide, Diabeta, Micronase, HB 419, HB-419, U-26452, Glyburide (Micronized), Glynase Prestab	3488	InChI=1S/C23H28ClN3O5S/c1-32-21-12-9-17(24)15-20(21)22(28)25-14-13-16-7-10-19(11-8-16)33(30,31)27-23(29)26-18-5-3-2-4-6-18/h7-12,15,18H,2-6,13-14H2,1H3,(H,25,28)(H2,26,27,29)	ZNNLBTZKUZBEKO-UHFFFAOYSA-N	COc1ccc(Cl)cc1C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)NC3CCCCC3	BroadT	BRD-K36927236	BRD-K36927236-001-06-0	Biomol International Inc.	KC-120	2840(V2)-3-N1305		COc1ccc(Cl)cc1C(=O)NCCc1ccc(cc1)S(=O)(=O)NC(=O)NC1CCCCC1	InChI=1S/C23H28ClN3O5S/c1-32-21-12-9-17(24)15-20(21)22(28)25-14-13-16-7-10-19(11-8-16)33(30,31)27-23(29)26-18-5-3-2-4-6-18/h7-12,15,18H,2-6,13-14H2,1H3,(H,25,28)(H2,26,27,29)	ZNNLBTZKUZBEKO-UHFFFAOYSA-N	493.143819426							5441
2-BFI	LSM-15317	2-BFI, BRD-K22745370	3080926	InChI=1S/C11H10N2O/c1-2-4-9-8(3-1)7-10(14-9)11-12-5-6-13-11/h1-4,7H,5-6H2,(H,12,13)	YTJOHEUHUVBKSB-UHFFFAOYSA-N	C1CN=C(N1)c2oc3ccccc3c2	BroadT	BRD-K22745370	BRD-K22745370-003-01-5	Tocris Bioscience	348	3	Cl	C1CN=C(N1)c1cc2ccccc2o1.Cl	InChI=1S/C11H10N2O.ClH/c1-2-4-9-8(3-1)7-10(14-9)11-12-5-6-13-11;/h1-4,7H,5-6H2,(H,12,13);1H	RFNFFVDVGWOSNZ-UHFFFAOYSA-N	186.07931296							103964, 103964
Benzylbutylphthalate	LSM-20963	SID17390004, SID26752797, SID56462768	2347	InChI=1S/C19H20O4/c1-2-3-13-22-18(20)16-11-7-8-12-17(16)19(21)23-14-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3	IRIAEXORFWYRCZ-UHFFFAOYSA-N	CCCCOC(=O)c1ccccc1C(=O)OCc2ccccc2	BroadT	BRD-K34359596	BRD-K34359596-001-02-1	MicroSource Discovery Systems Inc.	330087			CCCCOC(=O)c1ccccc1C(=O)OCc1ccccc1	InChI=1S/C19H20O4/c1-2-3-13-22-18(20)16-11-7-8-12-17(16)19(21)23-14-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3	IRIAEXORFWYRCZ-UHFFFAOYSA-N	312.13615912							34595
Dextromethorphan	LSM-2726	Dextromethorphan, Dimetane-DX	5360696	InChI=1S/C18H25NO/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18/h6-7,12,15,17H,3-5,8-11H2,1-2H3/t15-,17+,18+/m1/s1	MKXZASYAUGDDCJ-NJAFHUGGSA-N	COc1ccc2C[C@H]3[C@H]4CCCC[C@@]4(CCN3C)c2c1	BroadT	BRD-K33211335	BRD-K33211335-337-03-7	Prestwick Chemical Inc.	Prestw-359	D0701-MP04-ST03-200-	O.Br	COc1ccc2C[C@H]3[C@H]4CCCC[C@@]4(CCN3C)c2c1.O.Br	InChI=1S/C18H25NO.BrH.H2O/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18;;/h6-7,12,15,17H,3-5,8-11H2,1-2H3;1H;1H2/t15-,17+,18+;;/m1../s1	STTADZBLEUMJRG-IKNOHUQMSA-N	271.19361443							92579, 92579, 92579
Desoxycorticosterone Acetate	LSM-20964	56-47-3, Percorten, Desoxycortone, Deoxycortone, Doca, BRD-K24556098, Desoxycorticosterone Acetate, Deoxycorticosterone Acetate	5952	InChI=1S/C23H32O4/c1-14(24)27-13-21(26)20-7-6-18-17-5-4-15-12-16(25)8-10-22(15,2)19(17)9-11-23(18,20)3/h12,17-20H,4-11,13H2,1-3H3/t17-,18-,19-,20+,22-,23-/m0/s1	VPGRYOFKCNULNK-ACXQXYJUSA-N	CC(=O)OCC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C	BroadT	BRD-K24556098	BRD-K24556098-001-01-9	AnalytiCon Discovery GmbH	NP-011005			CC(=O)OCC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C	InChI=1S/C23H32O4/c1-14(24)27-13-21(26)20-7-6-18-17-5-4-15-12-16(25)8-10-22(15,2)19(17)9-11-23(18,20)3/h12,17-20H,4-11,13H2,1-3H3/t17-,18-,19-,20+,22-,23-/m0/s1	VPGRYOFKCNULNK-ACXQXYJUSA-N	372.230059504							34671
Ramelteon	LSM-20965	Ramelteon, Rozerem, TAK-375	208902	InChI=1S/C16H21NO2/c1-2-15(18)17-9-7-12-4-3-11-5-6-14-13(16(11)12)8-10-19-14/h5-6,12H,2-4,7-10H2,1H3,(H,17,18)/t12-/m0/s1	YLXDSYKOBKBWJQ-LBPRGKRZSA-N	CCC(=O)NCC[C@@H]1CCc2ccc3OCCc3c12	BroadT	BRD-K28761891	BRD-K28761891-001-01-0	MicroSource Discovery Systems Inc.	1505817			CCC(=O)NCC[C@@H]1CCc2ccc3OCCc3c12	InChI=1S/C16H21NO2/c1-2-15(18)17-9-7-12-4-3-11-5-6-14-13(16(11)12)8-10-19-14/h5-6,12H,2-4,7-10H2,1H3,(H,17,18)/t12-/m0/s1	YLXDSYKOBKBWJQ-LBPRGKRZSA-N	259.157228922							109549
Lonchocarpic acid	LSM-20966	SID26749742, SID454504	54683839	InChI=1S/C26H26O6/c1-14(2)6-11-17-22-18(12-13-26(3,4)32-22)23(30-5)20-21(28)19(25(29)31-24(17)20)15-7-9-16(27)10-8-15/h6-10,12-13,27-28H,11H2,1-5H3	QKTFIWUHGFCLHF-UHFFFAOYSA-N	COc1c2C=CC(C)(C)Oc2c(CC=C(C)C)c3OC(=O)C(=C(O)c13)c4ccc(O)cc4	BroadT	BRD-K32049721	BRD-K32049721-001-02-8	MicroSource Discovery Systems Inc.	300228			COc1c2C=CC(C)(C)Oc2c(CC=C(C)C)c2oc(=O)c(-c3ccc(O)cc3)c(O)c12	InChI=1S/C26H26O6/c1-14(2)6-11-17-22-18(12-13-26(3,4)32-22)23(30-5)20-21(28)19(25(29)31-24(17)20)15-7-9-16(27)10-8-15/h6-10,12-13,27-28H,11H2,1-5H3	QKTFIWUHGFCLHF-UHFFFAOYSA-N	434.172938552							109550
Epigallocatechin	LSM-20967	Epigallocatechin, (-)-Epigallocatechin, Epi-Gallocatechin	72277	InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1	XMOCLSLCDHWDHP-IUODEOHRSA-N	O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3cc(O)c(O)c(O)c3	BroadT	BRD-K27529556	BRD-K27529556-001-02-6	MicroSource Discovery Systems Inc.	205113			O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1	InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1	XMOCLSLCDHWDHP-IUODEOHRSA-N	306.073952788							42255
Clofibric acid	LSM-2427	Clofibric-Acid, Clofibric Acid	2797	InChI=1S/C10H11ClO3/c1-10(2,9(12)13)14-8-5-3-7(11)4-6-8/h3-6H,1-2H3,(H,12,13)	TXCGAZHTZHNUAI-UHFFFAOYSA-N	CC(C)(Oc1ccc(Cl)cc1)C(=O)O	BroadT	BRD-K19111024	BRD-K19111024-001-04-3	MicroSource Discovery Systems Inc.	1500195			CC(C)(Oc1ccc(Cl)cc1)C(O)=O	InChI=1S/C10H11ClO3/c1-10(2,9(12)13)14-8-5-3-7(11)4-6-8/h3-6H,1-2H3,(H,12,13)	TXCGAZHTZHNUAI-UHFFFAOYSA-N	214.039671922							34648, 34648, 34648, 34648
Diacylglycerol Kinase Inhibitor II	LSM-20968	Diacylglycerol Kinase Inhibitor II	657356	InChI=1S/C28H25F2N3OS/c29-22-9-5-19(6-10-22)26(20-7-11-23(30)12-8-20)21-13-15-32(16-14-21)17-18-33-27(34)24-3-1-2-4-25(24)31-28(33)35/h1-12H,13-18H2,(H,31,35)	ZCNBZFRECRPCKU-UHFFFAOYSA-N	Fc1ccc(cc1)C(=C2CCN(CCN3C(=S)Nc4ccccc4C3=O)CC2)c5ccc(F)cc5	BroadT	BRD-K31273080	BRD-K31273080-001-01-2	EMD Biosciences	266788			Fc1ccc(cc1)C(c1ccc(F)cc1)=C1CCN(CCn2c(=S)[nH]c3ccccc3c2=O)CC1	InChI=1S/C28H25F2N3OS/c29-22-9-5-19(6-10-22)26(20-7-11-23(30)12-8-20)21-13-15-32(16-14-21)17-18-33-27(34)24-3-1-2-4-25(24)31-28(33)35/h1-12H,13-18H2,(H,31,35)	ZCNBZFRECRPCKU-UHFFFAOYSA-N	489.16863954							109551
A-77636	LSM-20969	A-77636	6603703	InChI=1S/C20H27NO3/c21-10-17-14-1-2-16(22)19(23)15(14)6-18(24-17)20-7-11-3-12(8-20)5-13(4-11)9-20/h1-2,11-13,17-18,22-23H,3-10,21H2/t11?,12?,13?,17-,18-,20?/m0/s1	QLJOSZATCBCBDR-DFKUFRTHSA-N	NC[C@@H]1O[C@@H](Cc2c(O)c(O)ccc12)C34CC5CC(CC(C5)C3)C4	BroadT	BRD-K24396733	BRD-K24396733-001-01-1	Biomol International Inc.	AC-822	2812-3-N1298		NC[C@@H]1O[C@@H](Cc2c(O)c(O)ccc12)C12CC3CC(CC(C3)C1)C2	InChI=1S/C20H27NO3/c21-10-17-14-1-2-16(22)19(23)15(14)6-18(24-17)20-7-11-3-12(8-20)5-13(4-11)9-20/h1-2,11-13,17-18,22-23H,3-10,21H2/t11?,12?,13?,17-,18-,20?/m0/s1	QLJOSZATCBCBDR-DFKUFRTHSA-N	329.199093734							64080, 64080
Chromanol 293B	LSM-20970	BRD-K27911943	121846	InChI=1S/C15H20N2O4S/c1-5-22(19,20)17(4)13-11-8-10(9-16)6-7-12(11)21-15(2,3)14(13)18/h6-8,13-14,18H,5H2,1-4H3/t13-,14+/m0/s1	HVSJHHXUORMCGK-UONOGXRCSA-N	CCS(=O)(=O)N(C)[C@@H]1[C@@H](O)C(C)(C)Oc2ccc(cc12)C#N	BroadT	BRD-K27911943	BRD-K27911943-001-01-0	Tocris Bioscience	1475	2		CCS(=O)(=O)N(C)[C@@H]1[C@@H](O)C(C)(C)Oc2ccc(cc12)C#N	InChI=1S/C15H20N2O4S/c1-5-22(19,20)17(4)13-11-8-10(9-16)6-7-12(11)21-15(2,3)14(13)18/h6-8,13-14,18H,5H2,1-4H3/t13-,14+/m0/s1	HVSJHHXUORMCGK-UONOGXRCSA-N	324.11437783							34637
Pyrithyldione	LSM-5490	Pyrithyldione	4994	InChI=1S/C9H13NO2/c1-3-9(4-2)7(11)5-6-10-8(9)12/h5-6H,3-4H2,1-2H3,(H,10,12)	NZASCBIBXNPDMH-UHFFFAOYSA-N	CCC1(CC)C(=O)NC=CC1=O	BroadT	BRD-K36116267	BRD-K36116267-001-05-4	Prestwick Chemical Inc.	Prestw-803	D0701-MP04-ST03-200-		CCC1(CC)C(=O)NC=CC1=O	InChI=1S/C9H13NO2/c1-3-9(4-2)7(11)5-6-10-8(9)12/h5-6H,3-4H2,1-2H3,(H,10,12)	NZASCBIBXNPDMH-UHFFFAOYSA-N	167.094628666							94590
Nomegestrol Acetate	LSM-2598	Nomegestrolacetate, ORG-10486-0, TX-066, Nomegestrol Acetate	91668	InChI=1S/C23H30O4/c1-13-11-20-18(17-6-5-16(26)12-19(13)17)7-9-22(4)21(20)8-10-23(22,14(2)24)27-15(3)25/h11-12,17-18,20-21H,5-10H2,1-4H3/t17-,18-,20-,21+,22+,23+/m1/s1	IIVBFTNIGYRNQY-YQLZSBIMSA-N	CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C)C(=O)C	BroadT	BRD-K27351809	BRD-K27351809-001-02-0	Prestwick Chemical Inc.	Prestw-1033	D0701-MP04-ST03-200-		CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C)C(C)=O	InChI=1S/C23H30O4/c1-13-11-20-18(17-6-5-16(26)12-19(13)17)7-9-22(4)21(20)8-10-23(22,14(2)24)27-15(3)25/h11-12,17-18,20-21H,5-10H2,1-4H3/t17-,18-,20-,21+,22+,23+/m1/s1	IIVBFTNIGYRNQY-YQLZSBIMSA-N	370.21440944							
H 8	LSM-2410	SID26755703, SID124880801, SID11111503, H-8	3540	InChI=1S/C12H15N3O2S/c1-13-7-8-15-18(16,17)12-4-2-3-10-9-14-6-5-11(10)12/h2-6,9,13,15H,7-8H2,1H3	PJWUXKNZVMEPPH-UHFFFAOYSA-N	CNCCNS(=O)(=O)c1cccc2cnccc12	BroadT	BRD-K18742343	BRD-K18742343-001-03-2	Biomol International Inc.	EI-158	2832A(V2.2)-3-N1290		CNCCNS(=O)(=O)c1cccc2cnccc12	InChI=1S/C12H15N3O2S/c1-13-7-8-15-18(16,17)12-4-2-3-10-9-14-6-5-11(10)12/h2-6,9,13,15H,7-8H2,1H3	PJWUXKNZVMEPPH-UHFFFAOYSA-N	265.08849744							43561, 43561
U 0126	LSM-42806	U0126, U-0126	3006531	InChI=1S/C18H16N6S2/c19-9-11(17(23)25-15-7-3-1-5-13(15)21)12(10-20)18(24)26-16-8-4-2-6-14(16)22/h1-8H,21-24H2/b17-11+,18-12+	DVEXZJFMOKTQEZ-JYFOCSDGSA-N	N\C(=C(\C#N)/C(=C(\N)/Sc1ccccc1N)/C#N)\Sc2ccccc2N	BroadT	BRD-K18787491	BRD-K18787491-001-05-2	Biomol International Inc.	EI282	2840(V2)-3-N1305		N\C(Sc1ccccc1N)=C(C#N)/C(C#N)=C(\N)Sc1ccccc1N	InChI=1S/C18H16N6S2/c19-9-11(17(23)25-15-7-3-1-5-13(15)21)12(10-20)18(24)26-16-8-4-2-6-14(16)22/h1-8H,21-24H2/b17-11+,18-12+	DVEXZJFMOKTQEZ-JYFOCSDGSA-N	380.087785952							90693, 64208
Disulfiram	LSM-5467	Antabuse, Disulfiram, NSC-25953	3117	InChI=1S/C10H20N2S4/c1-5-11(6-2)9(13)15-16-10(14)12(7-3)8-4/h5-8H2,1-4H3	AUZONCFQVSMFAP-UHFFFAOYSA-N	CCN(CC)C(=S)SSC(=S)N(CC)CC	BroadT	BRD-K32744045	BRD-K32744045-001-04-9	MicroSource Discovery Systems Inc.	1500262			CCN(CC)C(=S)SSC(=S)N(CC)CC	InChI=1S/C10H20N2S4/c1-5-11(6-2)9(13)15-16-10(14)12(7-3)8-4/h5-8H2,1-4H3	AUZONCFQVSMFAP-UHFFFAOYSA-N	296.05093142							4659
ABT702	LSM-15487	ABT-702	1973	InChI=1S/C22H19BrN6O/c23-16-3-1-2-14(10-16)17-11-18(28-22-20(17)21(24)26-13-27-22)15-4-5-19(25-12-15)29-6-8-30-9-7-29/h1-5,10-13H,6-9H2,(H2,24,26,27,28)	RQCXKDWOCUJWQZ-UHFFFAOYSA-N	Nc1ncnc2nc(cc(c3cccc(Br)c3)c12)c4ccc(nc4)N5CCOCC5	BroadT	BRD-K36021395	BRD-K36021395-300-01-6	Tocris Bioscience	2372	1	Cl.Cl	Nc1ncnc2nc(cc(-c3cccc(Br)c3)c12)-c1ccc(nc1)N1CCOCC1.Cl.Cl	InChI=1S/C22H19BrN6O.2ClH/c23-16-3-1-2-14(10-16)17-11-18(28-22-20(17)21(24)26-13-27-22)15-4-5-19(25-12-15)29-6-8-30-9-7-29;;/h1-5,10-13H,6-9H2,(H2,24,26,27,28);2*1H	OOXNYFKPOPJIOT-UHFFFAOYSA-N	462.080371888							104129, 104129
Lavendustin A	LSM-2514	Lavendustin-A	3894	InChI=1S/C21H19NO6/c23-16-6-8-19(25)14(9-16)12-22(11-13-3-1-2-4-18(13)24)15-5-7-20(26)17(10-15)21(27)28/h1-10,23-26H,11-12H2,(H,27,28)	ULTTYPMRMMDONC-UHFFFAOYSA-N	OC(=O)c1cc(ccc1O)N(Cc2ccccc2O)Cc3cc(O)ccc3O	BroadT	BRD-K23583188	BRD-K23583188-001-05-6	Biomol International Inc.	EI185	2840(V2)-3-N1305		OC(=O)c1cc(ccc1O)N(Cc1ccccc1O)Cc1cc(O)ccc1O	InChI=1S/C21H19NO6/c23-16-6-8-19(25)14(9-16)12-22(11-13-3-1-2-4-18(13)24)15-5-7-20(26)17(10-15)21(27)28/h1-10,23-26H,11-12H2,(H,27,28)	ULTTYPMRMMDONC-UHFFFAOYSA-N	381.121237338							92413
Fisetin	LSM-6579	NSC-407010	5281614	InChI=1S/C15H10O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,16-18,20H	XHEFDIBZLJXQHF-UHFFFAOYSA-N	OC1=C(Oc2cc(O)ccc2C1=O)c3ccc(O)c(O)c3	BroadT	BRD-K31836715	BRD-K31836715-001-02-7	MicroSource Discovery Systems Inc.	1502247			Oc1ccc2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O	InChI=1S/C15H10O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,16-18,20H	XHEFDIBZLJXQHF-UHFFFAOYSA-N	286.04773804							42567, 42567
Pregnenolone Carbonitrile	LSM-2870	Pregnenolone-16alpha-Carbonitrile, Pregnenolone 16 Alpha Carbonitrile, Pregnenolone-16(Alpha)-Carbonitrile	15032	InChI=1S/C22H31NO2/c1-13(24)20-14(12-23)10-19-17-5-4-15-11-16(25)6-8-21(15,2)18(17)7-9-22(19,20)3/h4,14,16-20,25H,5-11H2,1-3H3/t14-,16-,17+,18-,19-,20-,21-,22-/m0/s1	VSBHRRMYCDQLJF-ZDNYCOCVSA-N	CC(=O)[C@H]1[C@@H](C[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C#N	BroadT	BRD-K39356024	BRD-K39356024-001-02-4	Biomol International Inc.	S620	2840(V2)-3-N1305		CC(=O)[C@H]1[C@@H](C[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C#N	InChI=1S/C22H31NO2/c1-13(24)20-14(12-23)10-19-17-5-4-15-11-16(25)6-8-21(15,2)18(17)7-9-22(19,20)3/h4,14,16-20,25H,5-11H2,1-3H3/t14-,16-,17+,18-,19-,20-,21-,22-/m0/s1	VSBHRRMYCDQLJF-ZDNYCOCVSA-N	341.235479242							35591
L-161,982	LSM-2875	BRD-K39733634, L-161982	9961192	InChI=1S/C32H29F3N4O4S2/c1-3-4-13-28-36-39(26-11-7-6-10-25(26)32(33,34)35)31(41)38(28)20-22-14-16-23(17-15-22)24-9-5-8-12-27(24)45(42,43)37-30(40)29-21(2)18-19-44-29/h5-12,14-19H,3-4,13,20H2,1-2H3,(H,37,40)	MMDNKTXNUZFVKD-UHFFFAOYSA-N	CCCCC1=NN(C(=O)N1Cc2ccc(cc2)c3ccccc3S(=O)(=O)NC(=O)c4sccc4C)c5ccccc5C(F)(F)F	BroadT	BRD-K39733634	BRD-K39733634-001-01-8	Tocris Bioscience	2514	1		CCCCc1nn(-c2ccccc2C(F)(F)F)c(=O)n1Cc1ccc(cc1)-c1ccccc1S(=O)(=O)NC(=O)c1sccc1C	InChI=1S/C32H29F3N4O4S2/c1-3-4-13-28-36-39(26-11-7-6-10-25(26)32(33,34)35)31(41)38(28)20-22-14-16-23(17-15-22)24-9-5-8-12-27(24)45(42,43)37-30(40)29-21(2)18-19-44-29/h5-12,14-19H,3-4,13,20H2,1-2H3,(H,37,40)	MMDNKTXNUZFVKD-UHFFFAOYSA-N	654.158231428							92695, 92695
AC1L3XM7	LSM-2743	BRD-K34034388	123956	InChI=1S/C28H32N2O/c1-4-11-25(12-5-1)13-10-18-29-19-21-30(22-20-29)23-24-31-28(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-17,28H,18-24H2	XFBDGHFDKJITGC-UHFFFAOYSA-N	C(CN1CCN(CC=Cc2ccccc2)CC1)OC(c3ccccc3)c4ccccc4	BroadT	BRD-K34034388	BRD-K34034388-300-01-0	Tocris Bioscience	513	3	Cl.Cl	C(CN1CCN(CC=Cc2ccccc2)CC1)OC(c1ccccc1)c1ccccc1.Cl.Cl	InChI=1S/C28H32N2O.2ClH/c1-4-11-25(12-5-1)13-10-18-29-19-21-30(22-20-29)23-24-31-28(26-14-6-2-7-15-26)27-16-8-3-9-17-27;;/h1-17,28H,18-24H2;2*1H	HJDXBLLTRMCYNC-UHFFFAOYSA-N	412.251463664							92594
L-694247	LSM-2416	L-694247, L-694,247, L694,247	132059	InChI=1S/C20H21N5O3S/c1-29(26,27)25-16-5-2-13(3-6-16)10-19-23-20(28-24-19)14-4-7-18-17(11-14)15(8-9-21)12-22-18/h2-7,11-12,22,25H,8-10,21H2,1H3	HKXMQLISPYELRD-UHFFFAOYSA-N	CS(=O)(=O)Nc1ccc(Cc2noc(n2)c3ccc4[nH]cc(CCN)c4c3)cc1	BroadT	BRD-K18816859	BRD-K18816859-001-01-4	Tocris Bioscience	781	4		CS(=O)(=O)Nc1ccc(Cc2noc(n2)-c2ccc3[nH]cc(CCN)c3c2)cc1	InChI=1S/C20H21N5O3S/c1-29(26,27)25-16-5-2-13(3-6-16)10-19-23-20(28-24-19)14-4-7-18-17(11-14)15(8-9-21)12-22-18/h2-7,11-12,22,25H,8-10,21H2,1H3	HKXMQLISPYELRD-UHFFFAOYSA-N	411.136510272							92341, 92341
Doconexent	LSM-42954	Doconexent, Omega-3 Marine Triglycerides	445580	InChI=1S/C22H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-	MBMBGCFOFBJSGT-KUBAVDMBSA-N	CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCC(=O)O	BroadT	BRD-K39965020	BRD-K39965020-001-02-6	Biomol International Inc.	FA-002	2840(V2)-3-N1305		CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCC(O)=O	InChI=1S/C22H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-	MBMBGCFOFBJSGT-KUBAVDMBSA-N	328.240230264							28125
Ergocornine	LSM-2437	Ergocornine	73453	InChI=1S/C31H39N5O5/c1-16(2)26-28(38)35-11-7-10-24(35)31(40)36(26)29(39)30(41-31,17(3)4)33-27(37)19-12-21-20-8-6-9-22-25(20)18(14-32-22)13-23(21)34(5)15-19/h6,8-9,12,14,16-17,19,23-24,26,32,40H,7,10-11,13,15H2,1-5H3,(H,33,37)/t19-,23-,24+,26+,30-,31+/m1/s1	UJYGDMFEEDNVBF-OGGGUQDZSA-N	CC(C)[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)[C@@H]4Cc5c[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]7CCCN7C1=O)C(C)C	BroadT	BRD-K19360254	BRD-K19360254-001-01-3	Biomol International Inc.	AC-819	2812-3-N1298		CC(C)[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)[C@@H]4Cc5c[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]2CCCN2C1=O)C(C)C	InChI=1S/C31H39N5O5/c1-16(2)26-28(38)35-11-7-10-24(35)31(40)36(26)29(39)30(41-31,17(3)4)33-27(37)19-12-21-20-8-6-9-22-25(20)18(14-32-22)13-23(21)34(5)15-19/h6,8-9,12,14,16-17,19,23-24,26,32,40H,7,10-11,13,15H2,1-5H3,(H,33,37)/t19-,23-,24+,26+,30-,31+/m1/s1	UJYGDMFEEDNVBF-OGGGUQDZSA-N	561.295119398							4820
Levothyroxine	LSM-5447	Levothyroxine	5819	InChI=1S/C15H11I4NO4/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23/h1-2,4-5,12,21H,3,20H2,(H,22,23)/t12-/m0/s1	XUIIKFGFIJCVMT-LBPRGKRZSA-N	N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(=O)O	BroadT	BRD-K30685142	BRD-K30685142-001-04-8	MicroSource Discovery Systems Inc.	1500774			N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(O)=O	InChI=1S/C15H11I4NO4/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23/h1-2,4-5,12,21H,3,20H2,(H,22,23)/t12-/m0/s1	XUIIKFGFIJCVMT-LBPRGKRZSA-N	776.686679842							58448, 18332, 18332, 58448
Niclosamide	LSM-2787	Lintex, Niclocide, Niclosamide, Nicloside, Yomesan, BAY-2353, Ex A Lint	4477	InChI=1S/C13H8Cl2N2O4/c14-7-1-4-12(18)9(5-7)13(19)16-11-3-2-8(17(20)21)6-10(11)15/h1-6,18H,(H,16,19)	RJMUSRYZPJIFPJ-UHFFFAOYSA-N	Oc1ccc(Cl)cc1C(=O)Nc2ccc(cc2Cl)[N+](=O)[O-]	BroadT	BRD-K35960502	BRD-K35960502-001-04-4	MicroSource Discovery Systems Inc.	1503265			Oc1ccc(Cl)cc1C(=O)Nc1ccc(cc1Cl)[N+]([O-])=O	InChI=1S/C13H8Cl2N2O4/c14-7-1-4-12(18)9(5-7)13(19)16-11-3-2-8(17(20)21)6-10(11)15/h1-6,18H,(H,16,19)	RJMUSRYZPJIFPJ-UHFFFAOYSA-N	325.986112176							92630
Euparin	LSM-20971	Euparin	119039	InChI=1S/C13H12O3/c1-7(2)12-5-9-4-10(8(3)14)11(15)6-13(9)16-12/h4-6,15H,1H2,2-3H3	OPUFDNZTKHPZHM-UHFFFAOYSA-N	CC(=C)c1oc2cc(O)c(cc2c1)C(=O)C	BroadT	BRD-K26383086	BRD-K26383086-001-02-8	MicroSource Discovery Systems Inc.	300007			CC(=C)c1cc2cc(C(C)=O)c(O)cc2o1	InChI=1S/C13H12O3/c1-7(2)12-5-9-4-10(8(3)14)11(15)6-13(9)16-12/h4-6,15H,1H2,2-3H3	OPUFDNZTKHPZHM-UHFFFAOYSA-N	216.078644244							67437
Bifemelane	LSM-2413	Bifemelane, BRD-K18779551, Bifemelane HCl	2377	InChI=1S/C18H23NO/c1-19-13-7-8-14-20-18-12-6-5-11-17(18)15-16-9-3-2-4-10-16/h2-6,9-12,19H,7-8,13-15H2,1H3	QSQQPMHPCBLLGX-UHFFFAOYSA-N	CNCCCCOc1ccccc1Cc2ccccc2	BroadT	BRD-K18779551	BRD-K18779551-003-03-7	Tocris Bioscience	767	2	Cl	CNCCCCOc1ccccc1Cc1ccccc1.Cl	InChI=1S/C18H23NO.ClH/c1-19-13-7-8-14-20-18-12-6-5-11-17(18)15-16-9-3-2-4-10-16;/h2-6,9-12,19H,7-8,13-15H2,1H3;1H	MEAHDXWXNNDSAK-UHFFFAOYSA-N	269.177964366							92338, 92338
Gramine	LSM-6572	Gramine	6890	InChI=1S/C11H14N2/c1-13(2)8-9-7-12-11-6-4-3-5-10(9)11/h3-7,12H,8H2,1-2H3	OCDGBSUVYYVKQZ-UHFFFAOYSA-N	CN(C)Cc1c[nH]c2ccccc12	BroadT	BRD-K26005076	BRD-K26005076-001-03-7	Prestwick Chemical Inc.	Prestw-629	D0701-MP04-ST03-200-		CN(C)Cc1c[nH]c2ccccc12	InChI=1S/C11H14N2/c1-13(2)8-9-7-12-11-6-4-3-5-10(9)11/h3-7,12H,8H2,1-2H3	OCDGBSUVYYVKQZ-UHFFFAOYSA-N	174.115698468							
Lintitript	LSM-2780	Lintitript, BRD-K35629949, SR-27897	122077	InChI=1S/C20H14ClN3O3S/c21-14-7-3-2-6-13(14)15-11-28-20(22-15)23-19(27)17-9-12-5-1-4-8-16(12)24(17)10-18(25)26/h1-9,11H,10H2,(H,25,26)(H,22,23,27)	ILNRQFBVVQUOLP-UHFFFAOYSA-N	OC(=O)Cn1c(cc2ccccc12)C(=O)Nc3nc(cs3)c4ccccc4Cl	BroadT	BRD-K35629949	BRD-K35629949-001-01-2	Tocris Bioscience	2190	1		OC(=O)Cn1c(cc2ccccc12)C(=O)Nc1nc(cs1)-c1ccccc1Cl	InChI=1S/C20H14ClN3O3S/c21-14-7-3-2-6-13(14)15-11-28-20(22-15)23-19(27)17-9-12-5-1-4-8-16(12)24(17)10-18(25)26/h1-9,11H,10H2,(H,25,26)(H,22,23,27)	ILNRQFBVVQUOLP-UHFFFAOYSA-N	411.044439738							92624
Orsellinic acid	LSM-20972	Orsellinic Acid	68072	InChI=1S/C8H8O4/c1-4-2-5(9)3-6(10)7(4)8(11)12/h2-3,9-10H,1H3,(H,11,12)	AMKYESDOVDKZKV-UHFFFAOYSA-N	Cc1cc(O)cc(O)c1C(=O)O	BroadT	BRD-K31330911	BRD-K31330911-001-02-3	MicroSource Discovery Systems Inc.	300001			Cc1cc(O)cc(O)c1C(O)=O	InChI=1S/C8H8O4/c1-4-2-5(9)3-6(10)7(4)8(11)12/h2-3,9-10H,1H3,(H,11,12)	AMKYESDOVDKZKV-UHFFFAOYSA-N	168.042258736							32807
Methyl Everninic acid	LSM-2680	SID26749835	596344	InChI=1S/C10H12O4/c1-6-4-7(13-2)5-8(11)9(6)10(12)14-3/h4-5,11H,1-3H3	PFVPJOAAHSOENR-UHFFFAOYSA-N	COC(=O)c1c(C)cc(OC)cc1O	BroadT	BRD-K31477169	BRD-K31477169-001-02-1	MicroSource Discovery Systems Inc.	210924			COC(=O)c1c(C)cc(OC)cc1O	InChI=1S/C10H12O4/c1-6-4-7(13-2)5-8(11)9(6)10(12)14-3/h4-5,11H,1-3H3	PFVPJOAAHSOENR-UHFFFAOYSA-N	196.073558864							92544
Ceforanide	LSM-2838	Ceforanide, Precef, BL-S786	43507	InChI=1S/C20H21N7O6S2/c21-6-11-4-2-1-3-10(11)5-13(28)22-15-17(31)27-16(19(32)33)12(8-34-18(15)27)9-35-20-23-24-25-26(20)7-14(29)30/h1-4,15,18H,5-9,21H2,(H,22,28)(H,29,30)(H,32,33)/t15-,18-/m1/s1	SLAYUXIURFNXPG-CRAIPNDOSA-N	NCc1ccccc1CC(=O)N[C@H]2[C@H]3SCC(=C(N3C2=O)C(=O)O)CSc4nnnn4CC(=O)O	BroadT	BRD-K37848908	BRD-K37848908-001-03-1	Prestwick Chemical Inc.	Prestw-470	D0701-MP04-ST03-200-		NCc1ccccc1CC(=O)N[C@H]1[C@H]2SCC(CSc3nnnn3CC(O)=O)=C(N2C1=O)C(O)=O	InChI=1S/C20H21N7O6S2/c21-6-11-4-2-1-3-10(11)5-13(28)22-15-17(31)27-16(19(32)33)12(8-34-18(15)27)9-35-20-23-24-25-26(20)7-14(29)30/h1-4,15,18H,5-9,21H2,(H,22,28)(H,29,30)(H,32,33)/t15-,18-/m1/s1	SLAYUXIURFNXPG-CRAIPNDOSA-N	519.099472842							3495
Edaravone	LSM-5486	Radicut, Edaravone, MCI-186	4021	InChI=1S/C10H10N2O/c1-8-7-10(13)12(11-8)9-5-3-2-4-6-9/h2-6H,7H2,1H3	QELUYTUMUWHWMC-UHFFFAOYSA-N	CC1=NN(C(=O)C1)c2ccccc2	BroadT	BRD-K35458079	BRD-K35458079-001-04-2	Biomol International Inc.	FR103	2840(V2)-3-N1305		CC1=NN(C(=O)C1)c1ccccc1	InChI=1S/C10H10N2O/c1-8-7-10(13)12(11-8)9-5-3-2-4-6-9/h2-6H,7H2,1H3	QELUYTUMUWHWMC-UHFFFAOYSA-N	174.07931296							31530
Sulfadiazine	LSM-5457	Thermazene, Sulphadiazine, Sulfolex, Sulfapyrimidine, Sulfadiazine, Adiazine, Diazyl, Ssd, Sildaflo, Silvadene, Sulfacombin, Sulfadiazine (Trisulfapyrimidines), Coco-Diazine	5215	InChI=1S/C10H10N4O2S/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10/h1-7H,11H2,(H,12,13,14)	SEEPANYCNGTZFQ-UHFFFAOYSA-N	Nc1ccc(cc1)S(=O)(=O)Nc2ncccn2	BroadT	BRD-K32273377	BRD-K32273377-001-04-7	MicroSource Discovery Systems Inc.	1500546			Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1	InChI=1S/C10H10N4O2S/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10/h1-7H,11H2,(H,12,13,14)	SEEPANYCNGTZFQ-UHFFFAOYSA-N	250.05244629							9328, 9328, 9328, 9328
H89	LSM-42924	H-89	449241	InChI=1S/C20H20BrN3O2S/c21-18-8-6-16(7-9-18)3-2-11-22-13-14-24-27(25,26)20-5-1-4-17-15-23-12-10-19(17)20/h1-10,12,15,22,24H,11,13-14H2/b3-2+	ZKZXNDJNWUTGDK-NSCUHMNNSA-N	Brc1ccc(\C=C\CNCCNS(=O)(=O)c2cccc3cnccc23)cc1	BroadT	BRD-K27737647	BRD-K27737647-001-03-4	Biomol International Inc.	EI-196	2832A(V2.2)-3-N1290		Brc1ccc(\C=C\CNCCNS(=O)(=O)c2cccc3cnccc23)cc1	InChI=1S/C20H20BrN3O2S/c21-18-8-6-16(7-9-18)3-2-11-22-13-14-24-27(25,26)20-5-1-4-17-15-23-12-10-19(17)20/h1-10,12,15,22,24H,11,13-14H2/b3-2+	ZKZXNDJNWUTGDK-NSCUHMNNSA-N	445.0459602							, 
Piplartine	LSM-42914	Piplartine, Piperlongumine	637858	InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+	VABYUUZNAVQNPG-BQYQJAHWSA-N	COc1cc(\C=C\C(=O)N2CCC=CC2=O)cc(OC)c1OC	BroadT	BRD-K24132293	BRD-K24132293-001-02-0	AnalytiCon Discovery GmbH	NP-003716			COc1cc(cc(OC)c1OC)\C=C\C(=O)N1CCC=CC1=O	InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+	VABYUUZNAVQNPG-BQYQJAHWSA-N	317.126322718							8241
Tracazolate	LSM-2745	Tracazolate, ICI-136753	5522	InChI=1S/C16H24N4O2/c1-5-8-9-17-14-12-10-18-20(6-2)15(12)19-11(4)13(14)16(21)22-7-3/h10H,5-9H2,1-4H3,(H,17,19)	PCTRYMLLRKWXGF-UHFFFAOYSA-N	CCCCNc1c(C(=O)OCC)c(C)nc2c1cnn2CC	BroadT	BRD-K34154330	BRD-K34154330-003-04-9	Tocris Bioscience	1558	1	Cl	CCCCNc1c(C(=O)OCC)c(C)nc2n(CC)ncc12.Cl	InChI=1S/C16H24N4O2.ClH/c1-5-8-9-17-14-12-10-18-20(6-2)15(12)19-11(4)13(14)16(21)22-7-3;/h10H,5-9H2,1-4H3,(H,17,19);1H	TUIXDPUEMQXVHO-UHFFFAOYSA-N	304.189926048							92596, 92596
Ichthynone	LSM-2615		3428129	InChI=1S/C23H20O7/c1-23(2)6-5-12-21-14(8-19(26-4)22(12)30-23)20(24)15(10-27-21)13-7-17-18(29-11-28-17)9-16(13)25-3/h5-10H,11H2,1-4H3	NPYOKEDYJXYSTA-UHFFFAOYSA-N	COc1cc2C(=O)C(=COc2c3C=CC(C)(C)Oc13)c4cc5OCOc5cc4OC	BroadT	BRD-K28167849	BRD-K28167849-001-02-1	AnalytiCon Discovery GmbH	NP-004882			COc1cc2OCOc2cc1-c1coc2c3C=CC(C)(C)Oc3c(OC)cc2c1=O	InChI=1S/C23H20O7/c1-23(2)6-5-12-21-14(8-19(26-4)22(12)30-23)20(24)15(10-27-21)13-7-17-18(29-11-28-17)9-16(13)25-3/h5-10H,11H2,1-4H3	NPYOKEDYJXYSTA-UHFFFAOYSA-N	408.12090298							92492
Dihomo-Gamma-Linolenic acid	LSM-42904	Cis-8,11,14-Eicosatrienoicacid	5280581	InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13H,2-5,8,11,14-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-	HOBAELRKJCKHQD-QNEBEIHSSA-N	CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(=O)O	BroadT	BRD-K20152659	BRD-K20152659-001-02-0	Biomol International Inc.	FA-009	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(O)=O	InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13H,2-5,8,11,14-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-	HOBAELRKJCKHQD-QNEBEIHSSA-N	306.255880328							53486, 53486
Megestrol Acetate	LSM-2441	5071, Ovaban, Megestrol, Megace, SC-10363, BDH-1298, Megestrol Acetate, Megace ES	11683	InChI=1S/C24H32O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h12-13,18-20H,6-11H2,1-5H3/t18-,19+,20+,22-,23+,24+/m1/s1	RQZAXGRLVPAYTJ-GQFGMJRRSA-N	CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(=O)C	BroadT	BRD-K19507340	BRD-K19507340-001-03-1	Prestwick Chemical Inc.	Prestw-956	D0701-MP04-ST03-200-		CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=O	InChI=1S/C24H32O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h12-13,18-20H,6-11H2,1-5H3/t18-,19+,20+,22-,23+,24+/m1/s1	RQZAXGRLVPAYTJ-GQFGMJRRSA-N	384.230059504							
(R)-3-(piperidin-2-Yl)pyridine	LSM-2805	Anabasine, SID26754388, SID11113089	641266	InChI=1S/C10H14N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h3-4,6,8,10,12H,1-2,5,7H2/t10-/m1/s1	MTXSIJUGVMTTMU-SNVBAGLBSA-N	C1CC[C@@H](NC1)c2cccnc2	BroadT	BRD-K36638830	BRD-K36638830-001-02-2	Prestwick Chemical Inc.	Prestw-669	D0701-MP04-ST03-200-		C1CC[C@@H](NC1)c1cccnc1	InChI=1S/C10H14N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h3-4,6,8,10,12H,1-2,5,7H2/t10-/m1/s1	MTXSIJUGVMTTMU-SNVBAGLBSA-N	162.115698468							92643
Yohimbic acid	LSM-6586		72131	InChI=1S/C20H24N2O3/c23-17-6-5-11-10-22-8-7-13-12-3-1-2-4-15(12)21-19(13)16(22)9-14(11)18(17)20(24)25/h1-4,11,14,16-18,21,23H,5-10H2,(H,24,25)/t11-,14-,16-,17-,18+/m0/s1	AADVZSXPNRLYLV-GKMXPDSGSA-N	O[C@H]1CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@@H]2[C@H]1C(=O)O	BroadT	BRD-K37282009	BRD-K37282009-001-02-3	MicroSource Discovery Systems Inc.	1504076			O[C@H]1CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@@H]2[C@H]1C(O)=O	InChI=1S/C20H24N2O3/c23-17-6-5-11-10-22-8-7-13-12-3-1-2-4-15(12)21-19(13)16(22)9-14(11)18(17)20(24)25/h1-4,11,14,16-18,21,23H,5-10H2,(H,24,25)/t11-,14-,16-,17-,18+/m0/s1	AADVZSXPNRLYLV-GKMXPDSGSA-N	340.178692648							35633, 35633
Procaine	LSM-5396	Novocain, Procaine	4914	InChI=1S/C13H20N2O2/c1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H3	MFDFERRIHVXMIY-UHFFFAOYSA-N	CCN(CC)CCOC(=O)c1ccc(N)cc1	BroadT	BRD-K24616672	BRD-K24616672-003-04-5	MicroSource Discovery Systems Inc.	1500504		Cl	CCN(CC)CCOC(=O)c1ccc(N)cc1.Cl	InChI=1S/C13H20N2O2.ClH/c1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11;/h5-8H,3-4,9-10,14H2,1-2H3;1H	HCBIBCJNVBAKAB-UHFFFAOYSA-N	236.1524779							8430, 8430
Methylergonovine	LSM-2758	Methylergometrine, Methylergonovine	8226	InChI=1S/C20H25N3O2/c1-3-14(11-24)22-20(25)13-7-16-15-5-4-6-17-19(15)12(9-21-17)8-18(16)23(2)10-13/h4-7,9,13-14,18,21,24H,3,8,10-11H2,1-2H3,(H,22,25)/t13-,14+,18-/m1/s1	UNBRKDKAWYKMIV-QWQRMKEZSA-N	CC[C@@H](CO)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34	BroadT	BRD-K34685430	BRD-K34685430-001-01-1	Biomol International Inc.	AC-576	2813-N1283		CC[C@@H](CO)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34	InChI=1S/C20H25N3O2/c1-3-14(11-24)22-20(25)13-7-16-15-5-4-6-17-19(15)12(9-21-17)8-18(16)23(2)10-13/h4-7,9,13-14,18,21,24H,3,8,10-11H2,1-2H3,(H,22,25)/t13-,14+,18-/m1/s1	UNBRKDKAWYKMIV-QWQRMKEZSA-N	339.19467707							92607, 92607
Propoxycaine	LSM-2397	Propoxycaine	6843	InChI=1S/C16H26N2O3/c1-4-10-20-15-12-13(17)7-8-14(15)16(19)21-11-9-18(5-2)6-3/h7-8,12H,4-6,9-11,17H2,1-3H3	CAJIGINSTLKQMM-UHFFFAOYSA-N	CCCOc1cc(N)ccc1C(=O)OCCN(CC)CC	BroadT	BRD-K18250272	BRD-K18250272-003-03-7	Prestwick Chemical Inc.	Prestw-1059	D0701-MP04-ST03-200-	Cl	CCCOc1cc(N)ccc1C(=O)OCCN(CC)CC.Cl	InChI=1S/C16H26N2O3.ClH/c1-4-10-20-15-12-13(17)7-8-14(15)16(19)21-11-9-18(5-2)6-3;/h7-8,12H,4-6,9-11,17H2,1-3H3;1H	GITPCGSPKUQZTE-UHFFFAOYSA-N	294.194342712							8496, 8496
Apafant	LSM-2613	Apafant, BRD-K28115081, WEB 2086 BS, WEB-2086	65889	InChI=1S/C22H22ClN5O2S/c1-14-25-26-19-13-24-21(16-4-2-3-5-18(16)23)17-12-15(31-22(17)28(14)19)6-7-20(29)27-8-10-30-11-9-27/h2-5,12H,6-11,13H2,1H3	JGPJQFOROWSRRS-UHFFFAOYSA-N	Cc1nnc2CN=C(c3ccccc3Cl)c4cc(CCC(=O)N5CCOCC5)sc4n12	BroadT	BRD-K28115081	BRD-K28115081-001-01-9	Tocris Bioscience	2339	1		Cc1nnc2CN=C(c3cc(CCC(=O)N4CCOCC4)sc3-n12)c1ccccc1Cl	InChI=1S/C22H22ClN5O2S/c1-14-25-26-19-13-24-21(16-4-2-3-5-18(16)23)17-12-15(31-22(17)28(14)19)6-7-20(29)27-8-10-30-11-9-27/h2-5,12H,6-11,13H2,1H3	JGPJQFOROWSRRS-UHFFFAOYSA-N	455.118273394							92490
Maprotiline	LSM-2043	Maprotiline, BA-34276 [AS HYDROCHLORIDE]	4011	InChI=1S/C20H23N/c1-21-14-6-12-20-13-11-15(16-7-2-4-9-18(16)20)17-8-3-5-10-19(17)20/h2-5,7-10,15,21H,6,11-14H2,1H3	QSLMDECMDJKHMQ-UHFFFAOYSA-N	CNCCCC12CCC(c3ccccc13)c4ccccc24	BroadT	BRD-K25433859	BRD-K25433859-003-11-4	Tocris Bioscience	935	4	Cl	CNCCCC12CCC(c3ccccc13)c1ccccc21.Cl	InChI=1S/C20H23N.ClH/c1-21-14-6-12-20-13-11-15(16-7-2-4-9-18(16)20)17-8-3-5-10-19(17)20;/h2-5,7-10,15,21H,6,11-14H2,1H3;1H	NZDMFGKECODQRY-UHFFFAOYSA-N	277.183049746							6690, 6690
3-Deshydroxysappanol trimethyl ether	LSM-20973	BRD-K22715231	6708683	InChI=1S/C19H22O5/c1-21-14-5-6-15-17(10-14)24-11-13(19(15)20)8-12-4-7-16(22-2)18(9-12)23-3/h4-7,9-10,13,19-20H,8,11H2,1-3H3/t13-,19+/m1/s1	KXFFLWDYUNIJNU-YJYMSZOUSA-N	COc1ccc2[C@@H](O)[C@H](Cc3ccc(OC)c(OC)c3)COc2c1	BroadT	BRD-K22715231	BRD-K22715231-001-02-9	MicroSource Discovery Systems Inc.	1504036			COc1ccc2[C@@H](O)[C@H](Cc3ccc(OC)c(OC)c3)COc2c1	InChI=1S/C19H22O5/c1-21-14-5-6-15-17(10-14)24-11-13(19(15)20)8-12-4-7-16(22-2)18(9-12)23-3/h4-7,9-10,13,19-20H,8,11H2,1-3H3/t13-,19+/m1/s1	KXFFLWDYUNIJNU-YJYMSZOUSA-N	330.146723804							109552
Tilorone	LSM-20974	Tilorone, Amixin IC	5475	InChI=1S/C25H34N2O3/c1-5-26(6-2)13-15-29-19-9-11-21-22-12-10-20(30-16-14-27(7-3)8-4)18-24(22)25(28)23(21)17-19/h9-12,17-18H,5-8,13-16H2,1-4H3	MPMFCABZENCRHV-UHFFFAOYSA-N	CCN(CC)CCOc1ccc2c(c1)C(=O)c3cc(OCCN(CC)CC)ccc23	BroadT	BRD-K34568562	BRD-K34568562-001-02-7	MicroSource Discovery Systems Inc.	2300009			CCN(CC)CCOc1ccc2-c3ccc(OCCN(CC)CC)cc3C(=O)c2c1	InChI=1S/C25H34N2O3/c1-5-26(6-2)13-15-29-19-9-11-21-22-12-10-20(30-16-14-27(7-3)8-4)18-24(22)25(28)23(21)17-19/h9-12,17-18H,5-8,13-16H2,1-4H3	MPMFCABZENCRHV-UHFFFAOYSA-N	410.256942968							109553, 109553
Astemizole	LSM-5502	Hismanal, Astemizole, R-43512, GNF-PF-2461	2247	InChI=1S/C28H31FN4O/c1-34-25-12-8-21(9-13-25)14-17-32-18-15-24(16-19-32)30-28-31-26-4-2-3-5-27(26)33(28)20-22-6-10-23(29)11-7-22/h2-13,24H,14-20H2,1H3,(H,30,31)	GXDALQBWZGODGZ-UHFFFAOYSA-N	COc1ccc(CCN2CCC(CC2)Nc3nc4ccccc4n3Cc5ccc(F)cc5)cc1	BroadT	BRD-K37249724	BRD-K37249724-001-04-2	MicroSource Discovery Systems Inc.	2300094			COc1ccc(CCN2CCC(CC2)Nc2nc3ccccc3n2Cc2ccc(F)cc2)cc1	InChI=1S/C28H31FN4O/c1-34-25-12-8-21(9-13-25)14-17-32-18-15-24(16-19-32)30-28-31-26-4-2-3-5-27(26)33(28)20-22-6-10-23(29)11-7-22/h2-13,24H,14-20H2,1H3,(H,30,31)	GXDALQBWZGODGZ-UHFFFAOYSA-N	458.248189852							2896, 2896
NCGC00025312-01	LSM-2901	BRD-K40656405, SID11114233	4364841	InChI=1S/C22H26O7/c1-2-4-19-20(10-5-16(11-12-23)22(19)26)28-14-3-13-27-17-6-8-18(9-7-17)29-15-21(24)25/h5-10,12,26H,2-4,11,13-15H2,1H3,(H,24,25)	YBEZORYMVISYOA-UHFFFAOYSA-N	CCCc1c(O)c(CC=O)ccc1OCCCOc2ccc(OCC(=O)O)cc2	BroadT	BRD-K40656405	BRD-K40656405-001-01-5	Tocris Bioscience	1856	1		CCCc1c(OCCCOc2ccc(OCC(O)=O)cc2)ccc(CC=O)c1O	InChI=1S/C22H26O7/c1-2-4-19-20(10-5-16(11-12-23)22(19)26)28-14-3-13-27-17-6-8-18(9-7-17)29-15-21(24)25/h5-10,12,26H,2-4,11,13-15H2,1H3,(H,24,25)	YBEZORYMVISYOA-UHFFFAOYSA-N	402.167853172							92716
Arecaidine Propargyl Ester	LSM-2520	BRD-K23922020, Arecaidine Propargyl Ester	2229	InChI=1S/C10H13NO2/c1-3-7-13-10(12)9-5-4-6-11(2)8-9/h1,5H,4,6-8H2,2H3	SPHRJZBOFYIKMC-UHFFFAOYSA-N	CN1CCC=C(C1)C(=O)OCC#C	BroadT	BRD-K23922020	BRD-K23922020-075-01-1	Tocris Bioscience	383	2	Cc1ccc(cc1)S(=O)(=O)O	CN1CCC=C(C1)C(=O)OCC#C.Cc1ccc(cc1)S(=O)(=O)O	InChI=1S/C10H13NO2.C7H8O3S/c1-3-7-13-10(12)9-5-4-6-11(2)8-9;1-6-2-4-7(5-3-6)11(8,9)10/h1,5H,4,6-8H2,2H3;2-5H,1H3,(H,8,9,10)	LYHWIOMAWPVTPI-UHFFFAOYSA-N	179.094628666							92418, 92418, 92418
Atomoxetine	LSM-2452	Atomoxetine, Strattera, BRD-K20141153	54841	InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3/t17-/m1/s1	VHGCDTVCOLNTBX-QGZVFWFLSA-N	CNCC[C@@H](Oc1ccccc1C)c2ccccc2	BroadT	BRD-K20141153	BRD-K20141153-003-03-8	Tocris Bioscience	2011	1	Cl	CNCC[C@@H](Oc1ccccc1C)c1ccccc1.Cl	InChI=1S/C17H21NO.ClH/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15;/h3-11,17-18H,12-13H2,1-2H3;1H/t17-;/m1./s1	LUCXVPAZUDVVBT-UNTBIKODSA-N	255.162314302							127342, 127342
Acetyl-L-Leucine	LSM-20975	Acetylleucine, SID11112472, Acetyl Leucine	70912	InChI=1S/C8H15NO3/c1-5(2)4-7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)/t7-/m0/s1	WXNXCEHXYPACJF-ZETCQYMHSA-N	CC(C)C[C@H](NC(=O)C)C(=O)O	BroadT	BRD-K27406233	BRD-K27406233-001-05-1	Prestwick Chemical Inc.	Prestw-896	D0701-MP04-ST03-200-		CC(C)C[C@H](NC(C)=O)C(O)=O	InChI=1S/C8H15NO3/c1-5(2)4-7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)/t7-/m0/s1	WXNXCEHXYPACJF-ZETCQYMHSA-N	173.10519335							17786
CHEMBL1165368	LSM-42920	3-(4-Dimethylaminobenzylidene)Anabaseine, BRD-K26573499	9926048	InChI=1S/C19H21N3/c1-22(2)18-9-7-15(8-10-18)13-16-5-4-12-21-19(16)17-6-3-11-20-14-17/h3,6-11,13-14H,4-5,12H2,1-2H3/b16-13+	KHUUTHZSRXABAC-DTQAZKPQSA-N	CN(C)c1ccc(\C=C\2/CCCN=C2c3cccnc3)cc1	BroadT	BRD-K26573499	BRD-K26573499-300-01-3	Tocris Bioscience	2241	1	Cl.Cl	CN(C)c1ccc(cc1)\C=C1CCCN=C/1c1cccnc1.Cl.Cl	InChI=1S/C19H21N3.2ClH/c1-22(2)18-9-7-15(8-10-18)13-16-5-4-12-21-19(16)17-6-3-11-20-14-17;;/h3,6-11,13-14H,4-5,12H2,1-2H3;2*1H/b16-13+;;	DHCNEWWWKHBASC-YNHPUKFJSA-N	291.173547702							, 
5-AIQ	LSM-15318	SID29217484	2072	InChI=1S/C9H8N2O/c10-8-3-1-2-7-6(8)4-5-11-9(7)12/h1-5H,10H2,(H,11,12)	SVASVGVAQIVSEZ-UHFFFAOYSA-N	Nc1cccc2C(=O)NC=Cc12	BroadT	BRD-K25408656	BRD-K25408656-003-01-2	Calbiochem	164300		Cl	Nc1cccc2c1cc[nH]c2=O.Cl	InChI=1S/C9H8N2O.ClH/c10-8-3-1-2-7-6(8)4-5-11-9(7)12;/h1-5H,10H2,(H,11,12);1H	KWNLARCFSYAXLT-UHFFFAOYSA-N	160.063662896							103965
Etoposide	LSM-6348	Vepesid, Toposar, Etoposide, VP-16-213	36462	InChI=1S/C29H32O13/c1-11-36-9-20-27(40-11)24(31)25(32)29(41-20)42-26-14-7-17-16(38-10-39-17)6-13(14)21(22-15(26)8-37-28(22)33)12-4-18(34-2)23(30)19(5-12)35-3/h4-7,11,15,20-22,24-27,29-32H,8-10H2,1-3H3/t11-,15+,20-,21-,22+,24-,25-,26-,27-,29+/m1/s1	VJJPUSNTGOMMGY-MRVIYFEKSA-N	COc1cc(cc(OC)c1O)[C@H]2[C@@H]3[C@H](COC3=O)[C@H](O[C@@H]4O[C@@H]5CO[C@@H](C)O[C@H]5[C@H](O)[C@H]4O)c6cc7OCOc7cc26	BroadT	BRD-K37798499	BRD-K37798499-001-02-5	Prestwick Chemical Inc.	Prestw-396	D0701-MP04-ST03-200-		COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](O[C@@H]2O[C@@H]3CO[C@@H](C)O[C@H]3[C@H](O)[C@H]2O)c2cc3OCOc3cc12	InChI=1S/C29H32O13/c1-11-36-9-20-27(40-11)24(31)25(32)29(41-20)42-26-14-7-17-16(38-10-39-17)6-13(14)21(22-15(26)8-37-28(22)33)12-4-18(34-2)23(30)19(5-12)35-3/h4-7,11,15,20-22,24-27,29-32H,8-10H2,1-3H3/t11-,15+,20-,21-,22+,24-,25-,26-,27-,29+/m1/s1	VJJPUSNTGOMMGY-MRVIYFEKSA-N	588.184291084							4911
Levulinic acid,  3-benzylidenyl-	LSM-43904	BRD-K33104513, SID26749908	5951068	InChI=1S/C12H12O3/c1-9(13)11(8-12(14)15)7-10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,14,15)/b11-7-	BNQYXFAVUMPZFG-XFFZJAGNSA-N	CC(=O)\C(=C/c1ccccc1)\CC(=O)O	BroadT	BRD-K33104513	BRD-K33104513-001-02-2	MicroSource Discovery Systems Inc.	1504009			CC(=O)C(\CC(O)=O)=C/c1ccccc1	InChI=1S/C12H12O3/c1-9(13)11(8-12(14)15)7-10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,14,15)/b11-7-	BNQYXFAVUMPZFG-XFFZJAGNSA-N	204.078644244							
Levobunolol	LSM-6578	Levobunolol	39468	InChI=1S/C17H25NO3/c1-17(2,3)18-10-12(19)11-21-16-9-5-6-13-14(16)7-4-8-15(13)20/h5-6,9,12,18-19H,4,7-8,10-11H2,1-3H3/t12-/m0/s1	IXHBTMCLRNMKHZ-LBPRGKRZSA-N	CC(C)(C)NC[C@H](O)COc1cccc2C(=O)CCCc12	BroadT	BRD-K31812033	BRD-K31812033-003-03-7	Prestwick Chemical Inc.	Prestw-847	D0701-MP04-ST03-200-	Cl	CC(C)(C)NC[C@H](O)COc1cccc2C(=O)CCCc12.Cl	InChI=1S/C17H25NO3.ClH/c1-17(2,3)18-10-12(19)11-21-16-9-5-6-13-14(16)7-4-8-15(13)20;/h5-6,9,12,18-19H,4,7-8,10-11H2,1-3H3;1H/t12-;/m0./s1	DNTDOBSIBZKFCP-YDALLXLXSA-N	291.18344367							6438, 6438
Loxapine	LSM-2881	Loxapac, Loxapine, Loxitane, Adasuve, CL-62362, SUM 3170, SUM-3170, Loxitane Intramuscular [As Hydrochloride], Loxitane-C Oral Suspension [As Hydrochloride]	3964	InChI=1S/C18H18ClN3O/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3	XJGVXQDUIWGIRW-UHFFFAOYSA-N	CN1CCN(CC1)C2=Nc3ccccc3Oc4ccc(Cl)cc24	BroadT	BRD-K39915878	BRD-K39915878-036-04-6	MicroSource Discovery Systems Inc.	2300242		OC(=O)CCC(=O)O	CN1CCN(CC1)C1=Nc2ccccc2Oc2ccc(Cl)cc12.OC(=O)CCC(=O)O	InChI=1S/C18H18ClN3O.C4H6O4/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18;5-3(6)1-2-4(7)8/h2-7,12H,8-11H2,1H3;1-2H2,(H,5,6)(H,7,8)	YQZBAXDVDZTKEQ-UHFFFAOYSA-N	327.113839936							50841, 50841, 50841
Linolenic acid	LSM-42939	Alpha-Linolenic Acid	5280934	InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-	DTOSIQBPPRVQHS-PDBXOOCHSA-N	CC\C=C/C\C=C/C\C=C/CCCCCCCC(=O)O	BroadT	BRD-K33396764	BRD-K33396764-001-02-0	Biomol International Inc.	FA005	2840(V2)-3-N1305		CC\C=C/C\C=C/C\C=C/CCCCCCCC(O)=O	InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-	DTOSIQBPPRVQHS-PDBXOOCHSA-N	278.2245802							27432, 27432
Acetylserotonin	LSM-20977	N-Acetylserotonin, N-Acetyl-Serotonin	903	InChI=1S/C12H14N2O2/c1-8(15)13-5-4-9-7-14-12-3-2-10(16)6-11(9)12/h2-3,6-7,14,16H,4-5H2,1H3,(H,13,15)	MVAWJSIDNICKHF-UHFFFAOYSA-N	CC(=O)NCCc1c[nH]c2ccc(O)cc12	BroadT	BRD-K26140483	BRD-K26140483-001-01-3	MicroSource Discovery Systems Inc.	1500700			CC(=O)NCCc1c[nH]c2ccc(O)cc12	InChI=1S/C12H14N2O2/c1-8(15)13-5-4-9-7-14-12-3-2-10(16)6-11(9)12/h2-3,6-7,14,16H,4-5H2,1H3,(H,13,15)	MVAWJSIDNICKHF-UHFFFAOYSA-N	218.105527708							17697
Aldicarb	LSM-45096	Carbamyl, Aldicarb, SID26752808, SID26752809, SID17390059	5353395	InChI=1S/C7H14N2O2S/c1-7(2,12-4)5-9-11-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5+	QGLZXHRNAYXIBU-WEVVVXLNSA-N	CNC(=O)O\N=C\C(C)(C)SC	BroadT	BRD-K32595626	BRD-K32595626-001-01-8	MicroSource Discovery Systems Inc.	330061			CNC(=O)O\N=C\C(C)(C)SC	InChI=1S/C7H14N2O2S/c1-7(2,12-4)5-9-11-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5+	QGLZXHRNAYXIBU-WEVVVXLNSA-N	190.077598398							
IN1241	LSM-2253	BRD-K23432132	24906275	InChI=1S/C16H12F3N3S/c17-16(18,19)14-4-2-1-3-12(14)13(9-20)15(22)23-11-7-5-10(21)6-8-11/h1-8H,21-22H2	JLOXTZFYJNCPIS-UHFFFAOYSA-N	NC(=C(C#N)c1ccccc1C(F)(F)F)Sc2ccc(N)cc2	BroadT	BRD-K23432132	BRD-K23432132-001-01-2	Tocris Bioscience	1969	1		NC(Sc1ccc(N)cc1)=C(C#N)c1ccccc1C(F)(F)F	InChI=1S/C16H12F3N3S/c17-16(18,19)14-4-2-1-3-12(14)13(9-20)15(22)23-11-7-5-10(21)6-8-11/h1-8H,21-22H2	JLOXTZFYJNCPIS-UHFFFAOYSA-N	335.070402704							92211
Clemastine	LSM-2655	Clemastine, HS-592	26987	InChI=1S/C21H26ClNO/c1-21(17-7-4-3-5-8-17,18-10-12-19(22)13-11-18)24-16-14-20-9-6-15-23(20)2/h3-5,7-8,10-13,20H,6,9,14-16H2,1-2H3/t20-,21-/m1/s1	YNNUSGIPVFPVBX-NHCUHLMSSA-N	CN1CCC[C@@H]1CCO[C@](C)(c2ccccc2)c3ccc(Cl)cc3	BroadT	BRD-K30240666	BRD-K30240666-051-05-0	Prestwick Chemical Inc.	Prestw-306	D0701-MP04-ST03-200-	OC(=O)/C=C/C(=O)O	CN1CCC[C@@H]1CCO[C@](C)(c1ccccc1)c1ccc(Cl)cc1.OC(=O)/C=C/C(=O)O	InChI=1S/C21H26ClNO.C4H4O4/c1-21(17-7-4-3-5-8-17,18-10-12-19(22)13-11-18)24-16-14-20-9-6-15-23(20)2;5-3(6)1-2-4(7)8/h3-5,7-8,10-13,20H,6,9,14-16H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t20-,21-;/m1./s1	PMGQWSIVQFOFOQ-YKVZVUFRSA-N	343.170292172							3738, 3738
2-Amino-3-hydroxybenzoic acid	LSM-20979	3-Hydroxyanthranilic Acid, BRD-K27265817	86	InChI=1S/C7H7NO3/c8-6-4(7(10)11)2-1-3-5(6)9/h1-3,9H,8H2,(H,10,11)	WJXSWCUQABXPFS-UHFFFAOYSA-N	Nc1c(O)cccc1C(=O)O	BroadT	BRD-K27265817	BRD-K27265817-001-01-4	AnalytiCon Discovery GmbH	NP-004781			Nc1c(O)cccc1C(O)=O	InChI=1S/C7H7NO3/c8-6-4(7(10)11)2-1-3-5(6)9/h1-3,9H,8H2,(H,10,11)	WJXSWCUQABXPFS-UHFFFAOYSA-N	153.042593094							15793
Hypericin	LSM-2650	Hypericin	5281051	InChI=1S/C30H16O8/c1-7-3-9(31)19-23-15(7)16-8(2)4-10(32)20-24(16)28-26-18(12(34)6-14(36)22(26)30(20)38)17-11(33)5-13(35)21(29(19)37)25(17)27(23)28/h3-6,31-36H,1-2H3	BTXNYTINYBABQR-UHFFFAOYSA-N	Cc1cc(O)c2C(=O)c3c(O)cc(O)c4c5c(O)cc(O)c6C(=O)c7c(O)cc(C)c8c1c2c(c34)c(c78)c56	BroadT	BRD-K29673530	BRD-K29673530-001-03-9	Biomol International Inc.	EI-226	2832A(V2.2)-3-N1290		Cc1cc(O)c2c3c1c1c(C)cc(O)c4c1c1c3c3c(c(O)cc(O)c3c2=O)c2c(O)cc(O)c(c12)c4=O	InChI=1S/C30H16O8/c1-7-3-9(31)19-23-15(7)16-8(2)4-10(32)20-24(16)28-26-18(12(34)6-14(36)22(26)30(20)38)17-11(33)5-13(35)21(29(19)37)25(17)27(23)28/h3-6,31-36H,1-2H3	BTXNYTINYBABQR-UHFFFAOYSA-N	504.084517472							5835
GF-109203	LSM-2677	Bisindolylmaleimide, GF-109203, GF-109203X	2396	InChI=1S/C25H24N4O2/c1-28(2)12-7-13-29-15-19(17-9-4-6-11-21(17)29)23-22(24(30)27-25(23)31)18-14-26-20-10-5-3-8-16(18)20/h3-6,8-11,14-15,26H,7,12-13H2,1-2H3,(H,27,30,31)	QMGUOJYZJKLOLH-UHFFFAOYSA-N	CN(C)CCCn1cc(C2=C(C(=O)NC2=O)c3c[nH]c4ccccc34)c5ccccc15	BroadT	BRD-K31342827	BRD-K31342827-001-05-4	Biomol International Inc.	EI-246	2840(V2)-3-N1305		CN(C)CCCn1cc(C2=C(C(=O)NC2=O)c2c[nH]c3ccccc23)c2ccccc12	InChI=1S/C25H24N4O2/c1-28(2)12-7-13-29-15-19(17-9-4-6-11-21(17)29)23-22(24(30)27-25(23)31)18-14-26-20-10-5-3-8-16(18)20/h3-6,8-11,14-15,26H,7,12-13H2,1-2H3,(H,27,30,31)	QMGUOJYZJKLOLH-UHFFFAOYSA-N	412.189926048							
Cycloheximide	LSM-2791	Cicloheximide, Cycloheximide, GNF-PF-5118, NSC-171, TCMDC-125838	6197	InChI=1S/C15H23NO4/c1-8-3-9(2)15(20)11(4-8)12(17)5-10-6-13(18)16-14(19)7-10/h8-12,17H,3-7H2,1-2H3,(H,16,18,19)/t8-,9-,11-,12+/m0/s1	YPHMISFOHDHNIV-FSZOTQKASA-N	C[C@H]1C[C@H](C)C(=O)[C@@H](C1)[C@H](O)CC2CC(=O)NC(=O)C2	BroadT	BRD-K36055864	BRD-K36055864-001-04-4	MicroSource Discovery Systems Inc.	1502112			C[C@H]1C[C@H](C)C(=O)[C@@H](C1)[C@H](O)CC1CC(=O)NC(=O)C1	InChI=1S/C15H23NO4/c1-8-3-9(2)15(20)11(4-8)12(17)5-10-6-13(18)16-14(19)7-10/h8-12,17H,3-7H2,1-2H3,(H,16,18,19)/t8-,9-,11-,12+/m0/s1	YPHMISFOHDHNIV-FSZOTQKASA-N	281.162708226							27641
LY-294002	LSM-2597	LY-294002, LY 294002, LY294002	3973	InChI=1S/C19H17NO3/c21-17-13-18(20-9-11-22-12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2	CZQHHVNHHHRRDU-UHFFFAOYSA-N	O=C1C=C(Oc2c1cccc2c3ccccc3)N4CCOCC4	BroadT	BRD-K27305650	BRD-K27305650-001-04-2	Biomol International Inc.	ST-420	2832A(V2.2)-3-N1290		O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCOCC1	InChI=1S/C19H17NO3/c21-17-13-18(20-9-11-22-12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2	CZQHHVNHHHRRDU-UHFFFAOYSA-N	307.120843414							65329, 65329
Bithionol	LSM-2862	Bithionol, Lorothidol	2406	InChI=1S/C12H6Cl4O2S/c13-5-1-7(15)11(17)9(3-5)19-10-4-6(14)2-8(16)12(10)18/h1-4,17-18H	JFIOVJDNOJYLKP-UHFFFAOYSA-N	Oc1c(Cl)cc(Cl)cc1Sc2cc(Cl)cc(Cl)c2O	BroadT	BRD-K39120595	BRD-K39120595-304-02-1	MicroSource Discovery Systems Inc.	1500148		[Na].[Na]	Oc1c(Cl)cc(Cl)cc1Sc1cc(Cl)cc(Cl)c1O.[Na].[Na]	InChI=1S/C12H6Cl4O2S.2Na.2H/c13-5-1-7(15)11(17)9(3-5)19-10-4-6(14)2-8(16)12(10)18;;;;/h1-4,17-18H;;;;	KVZXONXEMHCKKU-UHFFFAOYSA-N	353.884260962							3131, 3131
FR-122047	LSM-2672	BRD-K30990140, FR-122047	196841	InChI=1S/C23H25N3O3S/c1-25-12-14-26(15-13-25)23(27)22-24-20(16-4-8-18(28-2)9-5-16)21(30-22)17-6-10-19(29-3)11-7-17/h4-11H,12-15H2,1-3H3	UBHKJRYGKOSQDJ-UHFFFAOYSA-N	COc1ccc(cc1)c2nc(sc2c3ccc(OC)cc3)C(=O)N4CCN(C)CC4	BroadT	BRD-K30990140	BRD-K30990140-003-01-6	Tocris Bioscience	1507	3	Cl	COc1ccc(cc1)-c1nc(sc1-c1ccc(OC)cc1)C(=O)N1CCN(C)CC1.Cl	InChI=1S/C23H25N3O3S.ClH/c1-25-12-14-26(15-13-25)23(27)22-24-20(16-4-8-18(28-2)9-5-16)21(30-22)17-6-10-19(29-3)11-7-17;/h4-11H,12-15H2,1-3H3;1H	YWMAVHIKOAOSFM-UHFFFAOYSA-N	423.16166238							92538
IN1054	LSM-2388	BRD-K19533706	5527	InChI=1S/C18H17NO5/c1-23-15-9-7-12(11-16(15)24-2)8-10-17(20)19-14-6-4-3-5-13(14)18(21)22/h3-11H,1-2H3,(H,19,20)(H,21,22)	NZHGWWWHIYHZNX-UHFFFAOYSA-N	COc1ccc(C=CC(=O)Nc2ccccc2C(=O)O)cc1OC	BroadT	BRD-K19533706	BRD-K19533706-001-01-9	Tocris Bioscience	1098	1		COc1ccc(C=CC(=O)Nc2ccccc2C(O)=O)cc1OC	InChI=1S/C18H17NO5/c1-23-15-9-7-12(11-16(15)24-2)8-10-17(20)19-14-6-4-3-5-13(14)18(21)22/h3-11H,1-2H3,(H,19,20)(H,21,22)	NZHGWWWHIYHZNX-UHFFFAOYSA-N	327.110672654							92320
SB-216641	LSM-2671	SB 216641, SID11113989, SID26752130, SID29215037	3292447	InChI=1S/C28H30N4O4/c1-18-16-22(27-29-19(2)36-31-27)10-12-24(18)20-6-8-21(9-7-20)28(33)30-23-11-13-25(34-5)26(17-23)35-15-14-32(3)4/h6-13,16-17H,14-15H2,1-5H3,(H,30,33)	JRNUKVFYILMMLX-UHFFFAOYSA-N	COc1ccc(NC(=O)c2ccc(cc2)c3ccc(cc3C)c4noc(C)n4)cc1OCCN(C)C	BroadT	BRD-K30867024	BRD-K30867024-001-01-1	Biomol International Inc.	AC-541	2813-N1283		COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc1OCCN(C)C	InChI=1S/C28H30N4O4/c1-18-16-22(27-29-19(2)36-31-27)10-12-24(18)20-6-8-21(9-7-20)28(33)30-23-11-13-25(34-5)26(17-23)35-15-14-32(3)4/h6-13,16-17H,14-15H2,1-5H3,(H,30,33)	JRNUKVFYILMMLX-UHFFFAOYSA-N	486.22670548							92537
Paxilline	LSM-2849	Paxilline	105008	InChI=1S/C27H33NO4/c1-24(2,30)23-20(29)14-18-21(32-23)10-11-25(3)26(4)15(9-12-27(18,25)31)13-17-16-7-5-6-8-19(16)28-22(17)26/h5-8,14-15,21,23,28,30-31H,9-13H2,1-4H3/t15-,21-,23-,25+,26+,27+/m0/s1	ACNHBCIZLNNLRS-UBGQALKQSA-N	CC(C)(O)[C@H]1O[C@H]2CC[C@@]3(C)[C@@](O)(CC[C@H]4Cc5c([nH]c6ccccc56)[C@]34C)C2=CC1=O	BroadT	BRD-K38251852	BRD-K38251852-001-02-5	Biomol International Inc.	KC-155	2840(V2)-3-N1305		CC(C)(O)[C@H]1O[C@H]2CC[C@]3(C)[C@]4(C)[C@H](Cc5c4[nH]c4ccccc54)CC[C@@]3(O)C2=CC1=O	InChI=1S/C27H33NO4/c1-24(2,30)23-20(29)14-18-21(32-23)10-11-25(3)26(4)15(9-12-27(18,25)31)13-17-16-7-5-6-8-19(16)28-22(17)26/h5-8,14-15,21,23,28,30-31H,9-13H2,1-4H3/t15-,21-,23-,25+,26+,27+/m0/s1	ACNHBCIZLNNLRS-UBGQALKQSA-N	435.240958546							34907
Zuclomiphene	LSM-42849	Zuclomiphene, Zuclomifene, Transclomiphene, Clomifene, RMI-16312, Isomer A	1548955	InChI=1S/C26H28ClNO/c1-3-28(4-2)19-20-29-24-17-15-22(16-18-24)25(21-11-7-5-8-12-21)26(27)23-13-9-6-10-14-23/h5-18H,3-4,19-20H2,1-2H3/b26-25-	GKIRPKYJQBWNGO-QPLCGJKRSA-N	CCN(CC)CCOc1ccc(cc1)\C(=C(/Cl)\c2ccccc2)\c3ccccc3	BroadT	BRD-K29950728	BRD-K29950728-048-02-6	MicroSource Discovery Systems Inc.	1500196		OC(=O)CC(O)(CC(=O)O)C(=O)O	CCN(CC)CCOc1ccc(cc1)C(=C(/Cl)c1ccccc1)\c1ccccc1.OC(=O)CC(O)(CC(=O)O)C(=O)O	InChI=1S/C26H28ClNO.C6H8O7/c1-3-28(4-2)19-20-29-24-17-15-22(16-18-24)25(21-11-7-5-8-12-21)26(27)23-13-9-6-10-14-23;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-18H,3-4,19-20H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b26-25-;	PYTMYKVIJXPNBD-OQKDUQJOSA-N	405.185942236							, 
A-70108	LSM-15319	A-70108, BRD-K33400588	122324	InChI=1S/C16H17NO3/c17-9-15-11-6-7-13(18)16(19)12(11)8-14(20-15)10-4-2-1-3-5-10/h1-7,14-15,18-19H,8-9,17H2/t14-,15-/m0/s1	SUHGRZPINGKYNV-GJZGRUSLSA-N	NC[C@@H]1O[C@@H](Cc2c(O)c(O)ccc12)c3ccccc3	BroadT	BRD-K33400588	BRD-K33400588-003-01-2	Biomol International Inc.	AC-1357	2812-3-N1298	Cl	NC[C@@H]1O[C@@H](Cc2c(O)c(O)ccc12)c1ccccc1.Cl	InChI=1S/C16H17NO3.ClH/c17-9-15-11-6-7-13(18)16(19)12(11)8-14(20-15)10-4-2-1-3-5-10;/h1-7,14-15,18-19H,8-9,17H2;1H/t14-,15-;/m0./s1	PQPGUUQPTSMLKU-YYLIZZNMSA-N	271.120843414							103966, 103966
Guthion	LSM-20980	Guthion, Azinphos Methyl	2268	InChI=1S/C10H12N3O3PS2/c1-15-17(18,16-2)19-7-13-10(14)8-5-3-4-6-9(8)11-12-13/h3-6H,7H2,1-2H3	CJJOSEISRRTUQB-UHFFFAOYSA-N	COP(=S)(OC)SCN1N=Nc2ccccc2C1=O	BroadT	BRD-K21893543	BRD-K21893543-001-02-8	MicroSource Discovery Systems Inc.	330013			COP(=S)(OC)SCn1nnc2ccccc2c1=O	InChI=1S/C10H12N3O3PS2/c1-15-17(18,16-2)19-7-13-10(14)8-5-3-4-6-9(8)11-12-13/h3-6H,7H2,1-2H3	CJJOSEISRRTUQB-UHFFFAOYSA-N	317.005769164							2953
Splitomicin	LSM-2607	Splitomycin, SID11114129, SID26752214	5269	InChI=1S/C13H10O2/c14-13-8-6-11-10-4-2-1-3-9(10)5-7-12(11)15-13/h1-5,7H,6,8H2	ISFPDBUKMJDAJH-UHFFFAOYSA-N	O=C1CCc2c(O1)ccc3ccccc23	BroadT	BRD-K27710560	BRD-K27710560-001-02-6	Biomol International Inc.	GR-331	2840(V2)-3-N1305		O=C1CCc2c(O1)ccc1ccccc21	InChI=1S/C13H10O2/c14-13-8-6-11-10-4-2-1-3-9(10)5-7-12(11)15-13/h1-5,7H,6,8H2	ISFPDBUKMJDAJH-UHFFFAOYSA-N	198.06807956							75272
Cimetidine	LSM-2404		2756	InChI=1S/C10H16N6S/c1-8-9(16-7-15-8)5-17-4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)	AQIXAKUUQRKLND-UHFFFAOYSA-N	CNC(=NC#N)NCCSCc1nc[nH]c1C	BroadT	BRD-K34157611	BRD-K34157611-001-03-8	MicroSource Discovery Systems Inc.	1500684			CN\C(NCCSCc1nc[nH]c1C)=N/C#N	InChI=1S/C10H16N6S/c1-8-9(16-7-15-8)5-17-4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)	AQIXAKUUQRKLND-UHFFFAOYSA-N	252.115715262							3699, 3699
Chloroguanide	LSM-2618	Proguanil, Chloroguanide	4923	InChI=1S/C11H16ClN5/c1-7(2)15-10(13)17-11(14)16-9-5-3-8(12)4-6-9/h3-7H,1-2H3,(H5,13,14,15,16,17)	SSOLNOMRVKKSON-UHFFFAOYSA-N	CC(C)NC(=N)NC(=N)Nc1ccc(Cl)cc1	BroadT	BRD-K28183345	BRD-K28183345-003-05-6	Prestwick Chemical Inc.	Prestw-999	D0701-MP04-ST03-200-	Cl	CC(C)NC(=N)NC(=N)Nc1ccc(Cl)cc1.Cl	InChI=1S/C11H16ClN5.ClH/c1-7(2)15-10(13)17-11(14)16-9-5-3-8(12)4-6-9;/h3-7H,1-2H3,(H5,13,14,15,16,17);1H	SARMGXPVOFNNNG-UHFFFAOYSA-N	253.109423272							8455, 8455, 8455
201038-74-6	LSM-2529	SB-269970, BRD-K24201553	6604889	InChI=1S/C18H28N2O3S/c1-15-7-11-19(12-8-15)13-9-16-4-3-10-20(16)24(22,23)18-6-2-5-17(21)14-18/h2,5-6,14-16,21H,3-4,7-13H2,1H3/t16-/m1/s1	HWKROQUZSKPIKQ-MRXNPFEDSA-N	CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c3cccc(O)c3)CC1	BroadT	BRD-K24201553	BRD-K24201553-003-02-4	Tocris Bioscience	1612	6	Cl	CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(O)c2)CC1.Cl	InChI=1S/C18H28N2O3S.ClH/c1-15-7-11-19(12-8-15)13-9-16-4-3-10-20(16)24(22,23)18-6-2-5-17(21)14-18;/h2,5-6,14-16,21H,3-4,7-13H2,1H3;1H/t16-;/m1./s1	XQCJOYZLWFNDIO-PKLMIRHRSA-N	352.182063466							92426, 92426
Propazine	LSM-20981	SID17507556, SID26747715, SID26753690	4937	InChI=1S/C9H16ClN5/c1-5(2)11-8-13-7(10)14-9(15-8)12-6(3)4/h5-6H,1-4H3,(H2,11,12,13,14,15)	WJNRPILHGGKWCK-UHFFFAOYSA-N	CC(C)Nc1nc(Cl)nc(NC(C)C)n1	BroadT	BRD-K37595074	BRD-K37595074-001-02-8	MicroSource Discovery Systems Inc.	330026			CC(C)Nc1nc(Cl)nc(NC(C)C)n1	InChI=1S/C9H16ClN5/c1-5(2)11-8-13-7(10)14-9(15-8)12-6(3)4/h5-6H,1-4H3,(H2,11,12,13,14,15)	WJNRPILHGGKWCK-UHFFFAOYSA-N	229.109423272							38067
Ftorpropazine	LSM-15488	Ftorpropazine, BRD-K19040732	219081	InChI=1S/C22H24F3N3O2S/c23-22(24,25)16-5-6-20-18(15-16)28(17-3-1-2-4-19(17)31-20)21(30)7-8-26-9-11-27(12-10-26)13-14-29/h1-6,15,29H,7-14H2	KRMKBOUUDPUIDK-UHFFFAOYSA-N	OCCN1CCN(CCC(=O)N2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1	BroadT	BRD-K19040732	BRD-K19040732-300-01-9	ChemBridge Corporation	5216181		Cl.Cl	OCCN1CCN(CCC(=O)N2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1.Cl.Cl	InChI=1S/C22H24F3N3O2S.2ClH/c23-22(24,25)16-5-6-20-18(15-16)28(17-3-1-2-4-19(17)31-20)21(30)7-8-26-9-11-27(12-10-26)13-14-29;;/h1-6,15,29H,7-14H2;2*1H	IMHFQKWBANUGPH-UHFFFAOYSA-N	451.154132328							104130, 104130
Tyrphostin B7	LSM-42938	AG-370	5328748	InChI=1S/C15H9N5/c16-7-12(15(19)13(8-17)9-18)6-10-1-2-14-11(5-10)3-4-20-14/h1-6,20H,19H2/b12-6+	CMMDWEJTQUTCKG-WUXMJOGZSA-N	NC(=C(C#N)C#N)\C(=C\c1ccc2[nH]ccc2c1)\C#N	BroadT	BRD-K33204703	BRD-K33204703-001-04-6	Biomol International Inc.	EI-229	2840(V2)-3-N1305		NC(=C(C#N)C#N)C(\C#N)=C\c1ccc2[nH]ccc2c1	InChI=1S/C15H9N5/c16-7-12(15(19)13(8-17)9-18)6-10-1-2-14-11(5-10)3-4-20-14/h1-6,20H,19H2/b12-6+	CMMDWEJTQUTCKG-WUXMJOGZSA-N	259.085795338							
Yohimbine	LSM-2779	Yohimbine, Yohimbine Hydrochloride	8969	InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19+/m0/s1	BLGXFZZNTVWLAY-SCYLSFHTSA-N	COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12	BroadT	BRD-K35586044	BRD-K35586044-001-02-6	Biomol International Inc.	AC-161	2840(V2)-3-N1305		COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12	InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19+/m0/s1	BLGXFZZNTVWLAY-SCYLSFHTSA-N	354.194342712							10093, 10093
UNII-2V2JET5YTL	LSM-5387	Dizocilpine	6337640	InChI=1S/C16H15N/c1-16-13-8-4-2-6-11(13)10-15(17-16)12-7-3-5-9-14(12)16/h2-9,15,17H,10H2,1H3/t15-,16+/m0/s1	LBOJYSIDWZQNJS-JKSUJKDBSA-N	C[C@@]12N[C@@H](Cc3ccccc13)c4ccccc24	BroadT	BRD-K23163214	BRD-K23163214-001-01-4	Tocris Bioscience	955	1		C[C@@]12N[C@@H](Cc3ccccc13)c1ccccc21	InChI=1S/C16H15N/c1-16-13-8-4-2-6-11(13)10-15(17-16)12-7-3-5-9-14(12)16/h2-9,15,17H,10H2,1H3/t15-,16+/m0/s1	LBOJYSIDWZQNJS-JKSUJKDBSA-N	221.12044949							94547, 94547
Rofecoxib	LSM-2482	Rofecoxib, Vioxx, MK-966, MK-0966	5090	InChI=1S/C17H14O4S/c1-22(19,20)14-9-7-12(8-10-14)15-11-21-17(18)16(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3	RZJQGNCSTQAWON-UHFFFAOYSA-N	CS(=O)(=O)c1ccc(cc1)C2=C(C(=O)OC2)c3ccccc3	BroadT	BRD-K21733600	BRD-K21733600-001-02-6	MicroSource Discovery Systems Inc.	1504235			CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1	InChI=1S/C17H14O4S/c1-22(19,20)14-9-7-12(8-10-14)15-11-21-17(18)16(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3	RZJQGNCSTQAWON-UHFFFAOYSA-N	314.061279618							8887
CHEMBL304929	LSM-20982	BRD-K25280080, SID26756762	16045442	InChI=1S/C18H15N3O2/c1-4-12-6-5-7-13(8-12)21-18-14-9-16(22-2)17(23-3)10-15(14)19-11-20-18/h1,5-11H,2-3H3,(H,19,20,21)	XOTGKYTUNDYTBS-UHFFFAOYSA-N	COc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OC	BroadT	BRD-K25280080	BRD-K25280080-001-02-3	Biomol International Inc.	EI-346	2832A(V2.2)-3-N1290		COc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OC	InChI=1S/C18H15N3O2/c1-4-12-6-5-7-13(8-12)21-18-14-9-16(22-2)17(23-3)10-15(14)19-11-20-18/h1,5-11H,2-3H3,(H,19,20,21)	XOTGKYTUNDYTBS-UHFFFAOYSA-N	305.11642675							109555
SNC-80	LSM-20983	BRD-K29546239, SNC 80, SNC-80	123924	InChI=1S/C28H39N3O2/c1-7-17-30-19-22(5)31(20-21(30)4)27(25-11-10-12-26(18-25)33-6)23-13-15-24(16-14-23)28(32)29(8-2)9-3/h7,10-16,18,21-22,27H,1,8-9,17,19-20H2,2-6H3/t21-,22+,27-/m1/s1	KQWVAUSXZDRQPZ-UMTXDNHDSA-N	CCN(CC)C(=O)c1ccc(cc1)[C@@H](N2C[C@@H](C)N(CC=C)C[C@@H]2C)c3cccc(OC)c3	BroadT	BRD-K29546239	BRD-K29546239-001-01-5	Tocris Bioscience	764	15		CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(OC)c1	InChI=1S/C28H39N3O2/c1-7-17-30-19-22(5)31(20-21(30)4)27(25-11-10-12-26(18-25)33-6)23-13-15-24(16-14-23)28(32)29(8-2)9-3/h7,10-16,18,21-22,27H,1,8-9,17,19-20H2,2-6H3/t21-,22+,27-/m1/s1	KQWVAUSXZDRQPZ-UMTXDNHDSA-N	449.304227518							109556
Fipexide	LSM-5507	Fipexide	3351	InChI=1S/C20H21ClN2O4/c21-16-2-4-17(5-3-16)25-13-20(24)23-9-7-22(8-10-23)12-15-1-6-18-19(11-15)27-14-26-18/h1-6,11H,7-10,12-14H2	BFUJHVVEMMWLHC-UHFFFAOYSA-N	Clc1ccc(OCC(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)cc1	BroadT	BRD-K37688416	BRD-K37688416-003-04-0	MicroSource Discovery Systems Inc.	1503222		Cl	Clc1ccc(OCC(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)cc1.Cl	InChI=1S/C20H21ClN2O4.ClH/c21-16-2-4-17(5-3-16)25-13-20(24)23-9-7-22(8-10-23)12-15-1-6-18-19(11-15)27-14-26-18;/h1-6,11H,7-10,12-14H2;1H	MVOWQBJZZKOQNU-UHFFFAOYSA-N	388.118984882							94598, 94598
CGP71683A	LSM-2692	BRD-K31912990	5312114	InChI=1S/C26H29N5O2S/c27-25-22-9-3-4-10-23(22)30-26(31-25)28-16-18-12-14-19(15-13-18)17-29-34(32,33)24-11-5-7-20-6-1-2-8-21(20)24/h1-11,18-19,29H,12-17H2,(H3,27,28,30,31)	UULIGRNKXHCLQN-UHFFFAOYSA-N	Nc1nc(NCC2CCC(CNS(=O)(=O)c3cccc4ccccc34)CC2)nc5ccccc15	BroadT	BRD-K31912990	BRD-K31912990-003-01-0	Tocris Bioscience	2199	2	Cl	Nc1nc(NCC2CCC(CNS(=O)(=O)c3cccc4ccccc34)CC2)nc2ccccc12.Cl	InChI=1S/C26H29N5O2S.ClH/c27-25-22-9-3-4-10-23(22)30-26(31-25)28-16-18-12-14-19(15-13-18)17-29-34(32,33)24-11-5-7-20-6-1-2-8-21(20)24;/h1-11,18-19,29H,12-17H2,(H3,27,28,30,31);1H	DIQDKUNCSVFGHH-UHFFFAOYSA-N	475.204195908							92555, 92555, 92555
Erythromycin Estolate	LSM-2876	Erythromycin, Erythromycin Propionate	71277	InChI=1S/C40H71NO14/c1-15-27-40(11,48)33(44)22(5)30(43)20(3)18-38(9,47)35(55-37-32(53-28(42)16-2)26(41(12)13)17-21(4)50-37)23(6)31(24(7)36(46)52-27)54-29-19-39(10,49-14)34(45)25(8)51-29/h20-27,29,31-35,37,44-45,47-48H,15-19H2,1-14H3/t20-,21-,22+,23+,24-,25+,26+,27-,29+,31+,32-,33-,34+,35-,37+,38-,39-,40-/m1/s1	TYQXKHPOXXXCTP-CSLYCKPJSA-N	CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@@H]([C@H]3OC(=O)CC)N(C)C)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O	BroadT	BRD-K39746403	BRD-K39746403-084-02-3	MicroSource Discovery Systems Inc.	1501176		CCCCCCCCCCCCOS(=O)(=O)O	CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2OC(=O)CC)N(C)C)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O.CCCCCCCCCCCCOS(=O)(=O)O	InChI=1S/C40H71NO14.C12H26O4S/c1-15-27-40(11,48)33(44)22(5)30(43)20(3)18-38(9,47)35(55-37-32(53-28(42)16-2)26(41(12)13)17-21(4)50-37)23(6)31(24(7)36(46)52-27)54-29-19-39(10,49-14)34(45)25(8)51-29;1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h20-27,29,31-35,37,44-45,47-48H,15-19H2,1-14H3;2-12H2,1H3,(H,13,14,15)/t20-,21-,22+,23+,24-,25+,26+,27-,29+,31+,32-,33-,34+,35-,37+,38-,39-,40-;/m1./s1	AWMFUEJKWXESNL-JZBHMOKNSA-N	789.487455962							48913, 48913
Isoliquiritigenin	LSM-43093	Isoliquiritigenin, Iso-Liquiritigenin	638278	InChI=1S/C15H12O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-9,16-17,19H/b8-3+	DXDRHHKMWQZJHT-FPYGCLRLSA-N	Oc1ccc(\C=C\C(=O)c2ccc(O)cc2O)cc1	BroadT	BRD-K33583600	BRD-K33583600-001-03-9	AnalytiCon Discovery GmbH	NP-004577			Oc1ccc(cc1)\C=C\C(=O)c1ccc(O)cc1O	InChI=1S/C15H12O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-9,16-17,19H/b8-3+	DXDRHHKMWQZJHT-FPYGCLRLSA-N	256.073558864							310312
Mestranol	LSM-2693	33355, Mestranol, EE3-ME	6291	InChI=1S/C21H26O2/c1-4-21(22)12-10-19-18-7-5-14-13-15(23-3)6-8-16(14)17(18)9-11-20(19,21)2/h1,6,8,13,17-19,22H,5,7,9-12H2,2-3H3/t17-,18-,19+,20+,21+/m1/s1	IMSSROKUHAOUJS-MJCUULBUSA-N	COc1ccc2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]4(O)C#C)[C@@H]3CCc2c1	BroadT	BRD-K31920458	BRD-K31920458-001-03-8	Prestwick Chemical Inc.	Prestw-846	D0701-MP04-ST03-200-		COc1ccc2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]4(O)C#C)[C@@H]3CCc2c1	InChI=1S/C21H26O2/c1-4-21(22)12-10-19-18-7-5-14-13-15(23-3)6-8-16(14)17(18)9-11-20(19,21)2/h1,6,8,13,17-19,22H,5,7,9-12H2,2-3H3/t17-,18-,19+,20+,21+/m1/s1	IMSSROKUHAOUJS-MJCUULBUSA-N	310.193280072							6784
Butamben	LSM-5413	Butesin, Butamben, Butyl Aminobenzoate	2482	InChI=1S/C11H15NO2/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7H,2-3,8,12H2,1H3	IUWVALYLNVXWKX-UHFFFAOYSA-N	CCCCOC(=O)c1ccc(N)cc1	BroadT	BRD-K27217864	BRD-K27217864-001-05-8	Prestwick Chemical Inc.	Prestw-761	D0701-MP04-ST03-200-		CCCCOC(=O)c1ccc(N)cc1	InChI=1S/C11H15NO2/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7H,2-3,8,12H2,1H3	IUWVALYLNVXWKX-UHFFFAOYSA-N	193.11027873							3231, 3231
Dinoprostone	LSM-42919	Cervidil, Dinoprostone, Prepidil, Prostin E2, U-12062, Dinoprostone Beta-Cyclodextrin Clathrate	5280360	InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-17,19,21,23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,19+/m0/s1	XEYBRNLFEZDVAW-ARSRFYASSA-N	CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(=O)O	BroadT	BRD-K26521938	BRD-K26521938-001-04-9	Tocris Bioscience	2296	1		CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O	InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-17,19,21,23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,19+/m0/s1	XEYBRNLFEZDVAW-ARSRFYASSA-N	352.224974124							15551
Imipramine	LSM-2852	Imipramine, Janimine, Pramine, Presamine, Tofranil, Tofranil-PM	3696	InChI=1S/C19H24N2/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21/h3-6,8-11H,7,12-15H2,1-2H3	BCGWQEUPMDMJNV-UHFFFAOYSA-N	CN(C)CCCN1c2ccccc2CCc3ccccc13	BroadT	BRD-K38436528	BRD-K38436528-003-04-8	MicroSource Discovery Systems Inc.	1500348		Cl	CN(C)CCCN1c2ccccc2CCc2ccccc12.Cl	InChI=1S/C19H24N2.ClH/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21;/h3-6,8-11H,7,12-15H2,1-2H3;1H	XZZXIYZZBJDEEP-UHFFFAOYSA-N	280.193948788							47499, 47499, 47499
Rhoifolin	LSM-20984	Rhoifolin, Apigenin-7-Neohesperidoside	5282150	InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3/t10-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1	RPMNUQRUHXIGHK-PYXJVEIZSA-N	C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4C(=O)C=C(Oc4c3)c5ccc(O)cc5)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	BroadT	BRD-K23327891	BRD-K23327891-001-02-3	MicroSource Discovery Systems Inc.	1504075			C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)oc(cc4=O)-c3ccc(O)cc3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3/t10-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1	RPMNUQRUHXIGHK-PYXJVEIZSA-N	578.16355564							31227
Cinnarazine	LSM-43906	SID26748724	5353532	InChI=1S/C26H28N2/c1-4-11-23(12-5-1)13-10-18-27-19-21-28(22-20-27)26(24-14-6-2-7-15-24)25-16-8-3-9-17-25/h1-12,14-18,26H,13,19-22H2/b18-10+	SSKFWBSXNIWCBH-VCHYOVAHSA-N	C(\C=C\N1CCN(CC1)C(c2ccccc2)c3ccccc3)c4ccccc4	BroadT	BRD-K32256916	BRD-K32256916-001-02-4	MicroSource Discovery Systems Inc.	1503204			C(\C=C\N1CCN(CC1)C(c1ccccc1)c1ccccc1)c1ccccc1	InChI=1S/C26H28N2/c1-4-11-23(12-5-1)13-10-18-27-19-21-28(22-20-27)26(24-14-6-2-7-15-24)25-16-8-3-9-17-25/h1-12,14-18,26H,13,19-22H2/b18-10+	SSKFWBSXNIWCBH-VCHYOVAHSA-N	368.225248916							
Piromidic acid	LSM-5506	PD-93, Piromidic-Acid, Piromidic Acid	4855	InChI=1S/C14H16N4O3/c1-2-17-8-10(13(20)21)11(19)9-7-15-14(16-12(9)17)18-5-3-4-6-18/h7-8H,2-6H2,1H3,(H,20,21)	RCIMBBZXSXFZBV-UHFFFAOYSA-N	CCN1C=C(C(=O)O)C(=O)c2cnc(nc12)N3CCCC3	BroadT	BRD-K37682401	BRD-K37682401-001-05-1	Prestwick Chemical Inc.	Prestw-805	D0701-MP04-ST03-200-		CCn1cc(C(O)=O)c(=O)c2cnc(nc12)N1CCCC1	InChI=1S/C14H16N4O3/c1-2-17-8-10(13(20)21)11(19)9-7-15-14(16-12(9)17)18-5-3-4-6-18/h7-8H,2-6H2,1H3,(H,20,21)	RCIMBBZXSXFZBV-UHFFFAOYSA-N	288.122240412							94597
1-(4-Chlorophenyl)guanidine	LSM-15320	4-Chlorophenylguanidine Hydrochloride, N-(4-Chlorophenyl)Guanidine	2757788	InChI=1S/C7H8ClN3/c8-5-1-3-6(4-2-5)11-7(9)10/h1-4H,(H4,9,10,11)	ZSJNJAJDBNFVCA-UHFFFAOYSA-N	NC(=N)Nc1ccc(Cl)cc1	BroadT	BRD-K39160765	BRD-K39160765-003-01-1	Tocris Bioscience	442	1	Cl	NC(=N)Nc1ccc(Cl)cc1.Cl	InChI=1S/C7H8ClN3.ClH/c8-5-1-3-6(4-2-5)11-7(9)10;/h1-4H,(H4,9,10,11);1H	RMFZXBDENVVLSL-UHFFFAOYSA-N	169.040674996							103967
UNM000003657701	LSM-2545	BRD-K24925364, SID49824511	6622773	InChI=1S/C17H18N4O2/c1-11(2)16(22)19-13-9-12(5-6-15(13)23-3)14-10-21-8-4-7-18-17(21)20-14/h4-11H,1-3H3,(H,19,22)	XRYOQOUJMQVCBW-UHFFFAOYSA-N	COc1ccc(cc1NC(=O)C(C)C)c2cn3cccnc3n2	BroadT	BRD-K24925364	BRD-K24925364-001-01-3	ChemDiv Inc.	C638-0163			COc1ccc(cc1NC(=O)C(C)C)-c1cn2cccnc2n1	InChI=1S/C17H18N4O2/c1-11(2)16(22)19-13-9-12(5-6-15(13)23-3)14-10-21-8-4-7-18-17(21)20-14/h4-11H,1-3H3,(H,19,22)	XRYOQOUJMQVCBW-UHFFFAOYSA-N	310.142975856							92440
MRS 1220	LSM-2834	BRD-K37618799, MRS-1220	393595	InChI=1S/C21H14ClN5O2/c22-14-8-9-16-15(12-14)20-25-19(17-7-4-10-29-17)26-27(20)21(23-16)24-18(28)11-13-5-2-1-3-6-13/h1-10,12H,11H2,(H,23,24,28)	TWWFAXQOKNBUCR-UHFFFAOYSA-N	Clc1ccc2nc(NC(=O)Cc3ccccc3)n4nc(nc4c2c1)c5occc5	BroadT	BRD-K37618799	BRD-K37618799-001-01-4	Tocris Bioscience	1217	2		Clc1ccc2nc(NC(=O)Cc3ccccc3)n3nc(nc3c2c1)-c1ccco1	InChI=1S/C21H14ClN5O2/c22-14-8-9-16-15(12-14)20-25-19(17-7-4-10-29-17)26-27(20)21(23-16)24-18(28)11-13-5-2-1-3-6-13/h1-10,12H,11H2,(H,23,24,28)	TWWFAXQOKNBUCR-UHFFFAOYSA-N	403.083602448							92667
2,3-Diphenylquinoxaline-6-carboxylic acid	LSM-2706	BML-257, SID17508972, SID26756759	629852	InChI=1S/C21H14N2O2/c24-21(25)16-11-12-17-18(13-16)23-20(15-9-5-2-6-10-15)19(22-17)14-7-3-1-4-8-14/h1-13H,(H,24,25)	LFWGZXMTCUOPFI-UHFFFAOYSA-N	OC(=O)c1ccc2nc(c3ccccc3)c(nc2c1)c4ccccc4	BroadT	BRD-K32584078	BRD-K32584078-001-02-3	Biomol International Inc.	EI-336	2832A(V2.2)-3-N1290		OC(=O)c1ccc2nc(-c3ccccc3)c(nc2c1)-c1ccccc1	InChI=1S/C21H14N2O2/c24-21(25)16-11-12-17-18(13-16)23-20(15-9-5-2-6-10-15)19(22-17)14-7-3-1-4-8-14/h1-13H,(H,24,25)	LFWGZXMTCUOPFI-UHFFFAOYSA-N	326.105527708							92563
Domperidone	LSM-2850	Domperidone, Motilium, R-33812	3151	InChI=1S/C22H24ClN5O2/c23-15-6-7-20-18(14-15)25-22(30)28(20)16-8-12-26(13-9-16)10-3-11-27-19-5-2-1-4-17(19)24-21(27)29/h1-2,4-7,14,16H,3,8-13H2,(H,24,29)(H,25,30)	FGXWKSZFVQUSTL-UHFFFAOYSA-N	Clc1ccc2N(C3CCN(CCCN4C(=O)Nc5ccccc45)CC3)C(=O)Nc2c1	BroadT	BRD-K38305202	BRD-K38305202-001-01-8	MicroSource Discovery Systems Inc.	2300212			Clc1ccc2n(C3CCN(CCCn4c5ccccc5[nH]c4=O)CC3)c(=O)[nH]c2c1	InChI=1S/C22H24ClN5O2/c23-15-6-7-20-18(14-15)25-22(30)28(20)16-8-12-26(13-9-16)10-3-11-27-19-5-2-1-4-17(19)24-21(27)29/h1-2,4-7,14,16H,3,8-13H2,(H,24,29)(H,25,30)	FGXWKSZFVQUSTL-UHFFFAOYSA-N	425.161852768							31515, 31515
Arachidonamide	LSM-42929	Arachidonamide, BRD-K29555132	5283393	InChI=1S/C20H33NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H2,21,22)/b7-6-,10-9-,13-12-,16-15-	BNBSCAZCQDLUDU-DOFZRALJSA-N	CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)N	BroadT	BRD-K29555132	BRD-K29555132-001-02-2	Biomol International Inc.	FA022	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(N)=O	InChI=1S/C20H33NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H2,21,22)/b7-6-,10-9-,13-12-,16-15-	BNBSCAZCQDLUDU-DOFZRALJSA-N	303.256214686							
SR59230A	LSM-2774	BRD-K35430135, SR-59230A	5311452	InChI=1S/C21H27NO2/c1-2-16-8-4-6-13-21(16)24-15-18(23)14-22-20-12-7-10-17-9-3-5-11-19(17)20/h3-6,8-9,11,13,18,20,22-23H,2,7,10,12,14-15H2,1H3/t18-,20-/m0/s1	VFDHMSXXELYMRW-ICSRJNTNSA-N	CCc1ccccc1OC[C@@H](O)CN[C@H]2CCCc3ccccc23	BroadT	BRD-K35430135	BRD-K35430135-003-01-5	Tocris Bioscience	1511	2	Cl	CCc1ccccc1OC[C@@H](O)CN[C@H]1CCCc2ccccc12.Cl	InChI=1S/C21H27NO2.ClH/c1-2-16-8-4-6-13-21(16)24-15-18(23)14-22-20-12-7-10-17-9-3-5-11-19(17)20;/h3-6,8-9,11,13,18,20,22-23H,2,7,10,12,14-15H2,1H3;1H/t18-,20-;/m0./s1	SHUCXUIOEAAJJL-MKSBGGEFSA-N	325.204179114							92621, 92621
MLS001173561	LSM-2507	SID29215138, SID49647468, SID90341217, SID26753295, BRD-K23335153	1894361	InChI=1S/C28H28N2/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)29-21-22-30-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,27-30H,21-22H2	DTZDSNQYNPNCPK-UHFFFAOYSA-N	C(CNC(c1ccccc1)c2ccccc2)NC(c3ccccc3)c4ccccc4	BroadT	BRD-K23335153	BRD-K23335153-300-01-7	Tocris Bioscience	2385	1	Cl.Cl	C(CNC(c1ccccc1)c1ccccc1)NC(c1ccccc1)c1ccccc1.Cl.Cl	InChI=1S/C28H28N2.2ClH/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)29-21-22-30-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;;/h1-20,27-30H,21-22H2;2*1H	YRQCDCNQANSUPB-UHFFFAOYSA-N	392.225248916							92409, 92409
NCGC00024919-01	LSM-2460	SID26752009, RS 56812, SID11113835, RS-56812	6604789	InChI=1S/C18H21N3O2/c1-20-10-14(13-4-2-3-5-16(13)20)17(22)18(23)19-15-11-21-8-6-12(15)7-9-21/h2-5,10,12,15H,6-9,11H2,1H3,(H,19,23)/t15-/m0/s1	ZNAPADWWBWFMCQ-HNNXBMFYSA-N	Cn1cc(C(=O)C(=O)N[C@H]2CN3CCC2CC3)c4ccccc14	BroadT	BRD-K20714604	BRD-K20714604-001-01-5	Biomol International Inc.	AC-560	2813-N1283		Cn1cc(C(=O)C(=O)N[C@H]2CN3CCC2CC3)c2ccccc12	InChI=1S/C18H21N3O2/c1-20-10-14(13-4-2-3-5-16(13)20)17(22)18(23)19-15-11-21-8-6-12(15)7-9-21/h2-5,10,12,15H,6-9,11H2,1H3,(H,19,23)/t15-/m0/s1	ZNAPADWWBWFMCQ-HNNXBMFYSA-N	311.163376942							92374
5-Methoxytryptamine	LSM-4582	5-Methoxytryptamine, 5-Methoxy Tryptamine	1833	InChI=1S/C11H14N2O/c1-14-9-2-3-11-10(6-9)8(4-5-12)7-13-11/h2-3,6-7,13H,4-5,12H2,1H3	JTEJPPKMYBDEMY-UHFFFAOYSA-N	COc1ccc2[nH]cc(CCN)c2c1	BroadT	BRD-K30197592	BRD-K30197592-001-01-5	Biomol International Inc.	AC-841	2813-N1283		COc1ccc2[nH]cc(CCN)c2c1	InChI=1S/C11H14N2O/c1-14-9-2-3-11-10(6-9)8(4-5-12)7-13-11/h2-3,6-7,13H,4-5,12H2,1H3	JTEJPPKMYBDEMY-UHFFFAOYSA-N	190.110613088							2089, 2089
Flunarizine	LSM-42878	Flunarizine	941361	InChI=1S/C26H26F2N2/c27-24-12-8-22(9-13-24)26(23-10-14-25(28)15-11-23)30-19-17-29(18-20-30)16-4-7-21-5-2-1-3-6-21/h1-15,26H,16-20H2/b7-4+	SMANXXCATUTDDT-QPJJXVBHSA-N	Fc1ccc(cc1)C(N2CCN(C\C=C\c3ccccc3)CC2)c4ccc(F)cc4	BroadT	BRD-K29582677	BRD-K29582677-001-02-7	Biomol International Inc.	CA-225	2840(V2)-3-N1305		Fc1ccc(cc1)C(N1CCN(C\C=C\c2ccccc2)CC1)c1ccc(F)cc1	InChI=1S/C26H26F2N2/c27-24-12-8-22(9-13-24)26(23-10-14-25(28)15-11-23)30-19-17-29(18-20-30)16-4-7-21-5-2-1-3-6-21/h1-15,26H,16-20H2/b7-4+	SMANXXCATUTDDT-QPJJXVBHSA-N	404.206405252							, , 
(+)-Timolol	LSM-15524	Timolol	168613	InChI=1S/C13H24N4O3S/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17/h10,14,18H,4-9H2,1-3H3/t10-/m1/s1	BLJRIMJGRPQVNF-SNVBAGLBSA-N	CC(C)(C)NC[C@@H](O)COc1nsnc1N2CCOCC2	BroadT	BRD-K30421593	BRD-K30421593-050-02-3	MicroSource Discovery Systems Inc.	1500578		OC(=O)/C=C\C(=O)O	CC(C)(C)NC[C@@H](O)COc1nsnc1N1CCOCC1.OC(=O)/C=C\C(=O)O	InChI=1S/C13H24N4O3S.C4H4O4/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17;5-3(6)1-2-4(7)8/h10,14,18H,4-9H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t10-;/m1./s1	WLRMANUAADYWEA-ASSQPYIHSA-N	316.156911358							39466
WAY-170523	LSM-2795	BRD-K36198571, WAY-170523	9830392	InChI=1S/C33H31N3O7S/c1-22-18-23(2)31(28(19-22)32(37)35-39)36(21-24-8-4-3-5-9-24)44(40,41)27-14-12-26(13-15-27)42-17-16-34-33(38)30-20-25-10-6-7-11-29(25)43-30/h3-15,18-20,39H,16-17,21H2,1-2H3,(H,34,38)(H,35,37)	FARMEEAGJWMFSZ-UHFFFAOYSA-N	Cc1cc(C)c(N(Cc2ccccc2)S(=O)(=O)c3ccc(OCCNC(=O)c4oc5ccccc5c4)cc3)c(c1)C(=O)NO	BroadT	BRD-K36198571	BRD-K36198571-001-01-2	Tocris Bioscience	2633	1		Cc1cc(C)c(N(Cc2ccccc2)S(=O)(=O)c2ccc(OCCNC(=O)c3cc4ccccc4o3)cc2)c(c1)C(=O)NO	InChI=1S/C33H31N3O7S/c1-22-18-23(2)31(28(19-22)32(37)35-39)36(21-24-8-4-3-5-9-24)44(40,41)27-14-12-26(13-15-27)42-17-16-34-33(38)30-20-25-10-6-7-11-29(25)43-30/h3-15,18-20,39H,16-17,21H2,1-2H3,(H,34,38)(H,35,37)	FARMEEAGJWMFSZ-UHFFFAOYSA-N	613.188271052							92636
NCGC00025322-01	LSM-2687	BRD-K31699485	9604993	InChI=1S/C16H16N2O2/c1-19-15-7-3-5-13(9-15)11-17-12-18-14-6-4-8-16(10-14)20-2/h3-12H,1-2H3	CWHVUMNEZIBZFC-UHFFFAOYSA-N	COc1cccc(C=NC=Nc2cccc(OC)c2)c1	BroadT	BRD-K31699485	BRD-K31699485-001-01-9	Tocris Bioscience	1953	1		COc1cccc(C=NC=Nc2cccc(OC)c2)c1	InChI=1S/C16H16N2O2/c1-19-15-7-3-5-13(9-15)11-17-12-18-14-6-4-8-16(10-14)20-2/h3-12H,1-2H3	CWHVUMNEZIBZFC-UHFFFAOYSA-N	268.121177772							92550
Iodomelatonin	LSM-20986	2-Iodomelatonin, Iodomelatonin, BRD-K25649279	115348	InChI=1S/C13H15IN2O2/c1-8(17)15-6-5-10-11-7-9(18-2)3-4-12(11)16-13(10)14/h3-4,7,16H,5-6H2,1-2H3,(H,15,17)	FJDDSMSDZHURBJ-UHFFFAOYSA-N	COc1ccc2[nH]c(I)c(CCNC(=O)C)c2c1	BroadT	BRD-K25649279	BRD-K25649279-001-01-2	Tocris Bioscience	737	2		COc1ccc2[nH]c(I)c(CCNC(C)=O)c2c1	InChI=1S/C13H15IN2O2/c1-8(17)15-6-5-10-11-7-9(18-2)3-4-12(11)16-13(10)14/h3-4,7,16H,5-6H2,1-2H3,(H,15,17)	FJDDSMSDZHURBJ-UHFFFAOYSA-N	358.01782074							109558, 109558
Ouabain	LSM-2781	NSC-25485	439501	InChI=1S/C29H44O12/c1-13-22(34)23(35)24(36)25(40-13)41-15-8-19(32)28(12-30)21-17(3-5-27(28,37)9-15)29(38)6-4-16(14-7-20(33)39-11-14)26(29,2)10-18(21)31/h7,13,15-19,21-25,30-32,34-38H,3-6,8-12H2,1-2H3/t13-,15-,16+,17+,18+,19+,21+,22-,23+,24+,25-,26+,27-,28+,29-/m0/s1	LPMXVESGRSUGHW-HBYQJFLCSA-N	C[C@@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)[C@H]4[C@H](O)C[C@]5(C)[C@H](CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)C6=CC(=O)OC6)[C@H](O)[C@H](O)[C@H]1O	BroadT	BRD-K35708212	BRD-K35708212-331-03-1	Prestwick Chemical Inc.	Prestw-471	D0701-MP04-ST03-200-	O.O.O.O.O.O.O.O	C[C@@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)[C@H]4[C@H](O)C[C@]5(C)[C@H](CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)C2=CC(=O)OC2)[C@H](O)[C@H](O)[C@H]1O.O.O.O.O.O.O.O.O	InChI=1S/C29H44O12.8H2O/c1-13-22(34)23(35)24(36)25(40-13)41-15-8-19(32)28(12-30)21-17(3-5-27(28,37)9-15)29(38)6-4-16(14-7-20(33)39-11-14)26(29,2)10-18(21)31;;;;;;;;/h7,13,15-19,21-25,30-32,34-38H,3-6,8-12H2,1-2H3;8*1H2/t13-,15-,16+,17+,18+,19+,21+,22-,23+,24+,25-,26+,27-,28+,29-;;;;;;;;/m0......../s1	TYBARJRCFHUHSN-DMJRSANLSA-N	584.283276848							472805, 472805, 472805
Digoxin	LSM-2511	Lanoxicaps, Digoxin, Lanoxin, Vanoxin, Digoxin Pediatric, Lanoxin Pediatric	2724385	InChI=1S/C41H64O14/c1-19-36(47)28(42)15-34(50-19)54-38-21(3)52-35(17-30(38)44)55-37-20(2)51-33(16-29(37)43)53-24-8-10-39(4)23(13-24)6-7-26-27(39)14-31(45)40(5)25(9-11-41(26,40)48)22-12-32(46)49-18-22/h12,19-21,23-31,33-38,42-45,47-48H,6-11,13-18H2,1-5H3/t19-,20-,21-,23-,24+,25-,26-,27+,28+,29+,30+,31-,33+,34+,35+,36-,37-,38-,39+,40+,41+/m1/s1	LTMHDMANZUZIPE-PUGKRICDSA-N	C[C@H]1O[C@H](C[C@H](O)[C@@H]1O)O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5C[C@@H](O)[C@]7(C)[C@H](CC[C@]67O)C8=CC(=O)OC8)C4)O[C@@H]3C)O[C@@H]2C	BroadT	BRD-K23478508	BRD-K23478508-001-03-7	Prestwick Chemical Inc.	Prestw-437	D0701-MP04-ST03-200-		C[C@H]1O[C@H](C[C@H](O)[C@@H]1O)O[C@H]1[C@@H](O)C[C@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3CC[C@@]4(C)[C@H](CC[C@@H]5[C@@H]4C[C@@H](O)[C@]4(C)[C@H](CC[C@]54O)C4=CC(=O)OC4)C3)O[C@@H]2C)O[C@@H]1C	InChI=1S/C41H64O14/c1-19-36(47)28(42)15-34(50-19)54-38-21(3)52-35(17-30(38)44)55-37-20(2)51-33(16-29(37)43)53-24-8-10-39(4)23(13-24)6-7-26-27(39)14-31(45)40(5)25(9-11-41(26,40)48)22-12-32(46)49-18-22/h12,19-21,23-31,33-38,42-45,47-48H,6-11,13-18H2,1-5H3/t19-,20-,21-,23-,24+,25-,26-,27+,28+,29+,30+,31-,33+,34+,35+,36-,37-,38-,39+,40+,41+/m1/s1	LTMHDMANZUZIPE-PUGKRICDSA-N	780.429606728001							4551
T0515-7212	LSM-20987	SID22406399, BRD-K48949410	2421432	InChI=1S/C22H19N3O4S2/c1-25(31(27,28)18-7-3-2-4-8-18)16-11-13-17(14-12-16)29-15-21(26)24-22-23-19-9-5-6-10-20(19)30-22/h2-14H,15H2,1H3,(H,23,24,26)	KTSIKAWLVZSOAW-UHFFFAOYSA-N	CN(c1ccc(OCC(=O)Nc2nc3ccccc3s2)cc1)S(=O)(=O)c4ccccc4	BroadT	BRD-K48949410	BRD-K48949410-001-05-0	Enamine Ltd.	T0515-7212			CN(c1ccc(OCC(=O)Nc2nc3ccccc3s2)cc1)S(=O)(=O)c1ccccc1	InChI=1S/C22H19N3O4S2/c1-25(31(27,28)18-7-3-2-4-8-18)16-11-13-17(14-12-16)29-15-21(26)24-22-23-19-9-5-6-10-20(19)30-22/h2-14H,15H2,1H3,(H,23,24,26)	KTSIKAWLVZSOAW-UHFFFAOYSA-N	453.081697498							109559
AC1NJZMN	LSM-20988	SID22408874, BRD-K87811421	4880128	InChI=1S/C17H20ClN3O3S/c1-12-15(18)8-5-9-16(12)20-17(22)11-19-13-6-4-7-14(10-13)25(23,24)21(2)3/h4-10,19H,11H2,1-3H3,(H,20,22)	MJJYGENADAVXIB-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cccc(NCC(=O)Nc2cccc(Cl)c2C)c1	BroadT	BRD-K87811421	BRD-K87811421-001-05-1	Enamine Ltd.	T5318042			CN(C)S(=O)(=O)c1cccc(NCC(=O)Nc2cccc(Cl)c2C)c1	InChI=1S/C17H20ClN3O3S/c1-12-15(18)8-5-9-16(12)20-17(22)11-19-13-6-4-7-14(10-13)25(23,24)21(2)3/h4-10,19H,11H2,1-3H3,(H,20,22)	MJJYGENADAVXIB-UHFFFAOYSA-N	381.09138993							109560
ASN 05296876	LSM-20989	SID842825, BRD-A42515343	645097	InChI=1S/C24H27N5O3S/c1-17(2)11-12-25-24(31)23(21-10-5-13-32-21)28(15-18-7-6-14-33-18)22(30)16-29-20-9-4-3-8-19(20)26-27-29/h3-10,13-14,17,23H,11-12,15-16H2,1-2H3,(H,25,31)	BGNGDYVINBVQHK-UHFFFAOYSA-N	CC(C)CCNC(=O)C(N(Cc1cccs1)C(=O)Cn2nnc3ccccc23)c4occc4	BroadT	BRD-A42515343	BRD-A42515343-001-04-2	Asinex Ltd.	ASN 05296876			CC(C)CCNC(=O)C(N(Cc1cccs1)C(=O)Cn1nnc2ccccc12)c1ccco1	InChI=1S/C24H27N5O3S/c1-17(2)11-12-25-24(31)23(21-10-5-13-32-21)28(15-18-7-6-14-33-18)22(30)16-29-20-9-4-3-8-19(20)26-27-29/h3-10,13-14,17,23H,11-12,15-16H2,1-2H3,(H,25,31)	BGNGDYVINBVQHK-UHFFFAOYSA-N	465.183460464							109561
7-Hydrazino-2,4-bis(trifluoromethyl)[1,8]naphthyridine	LSM-20990	SID24824526, BRD-K06080743	2764722	InChI=1S/C10H6F6N4/c11-9(12,13)5-3-6(10(14,15)16)18-8-4(5)1-2-7(19-8)20-17/h1-3H,17H2,(H,18,19,20)	ZYGWFTGHRLCDGP-UHFFFAOYSA-N	NNc1ccc2c(cc(nc2n1)C(F)(F)F)C(F)(F)F	BroadT	BRD-K06080743	BRD-K06080743-001-05-2	Key Organics Ltd.	10D-016			NNc1ccc2c(cc(nc2n1)C(F)(F)F)C(F)(F)F	InChI=1S/C10H6F6N4/c11-9(12,13)5-3-6(10(14,15)16)18-8-4(5)1-2-7(19-8)20-17/h1-3H,17H2,(H,18,19,20)	ZYGWFTGHRLCDGP-UHFFFAOYSA-N	296.049665432							109562
2F-065	LSM-20991	SID24820790, BRD-K18451291	3313569	InChI=1S/C20H18N2O4S/c1-13-4-10-16(11-5-13)27-17-12-18(23)22(21-19(17)20(24)26-3)14-6-8-15(25-2)9-7-14/h4-12H,1-3H3	DGMPKQJUJSNOBV-UHFFFAOYSA-N	COC(=O)C1=NN(C(=O)C=C1Sc2ccc(C)cc2)c3ccc(OC)cc3	BroadT	BRD-K18451291	BRD-K18451291-001-05-7	Key Organics Ltd.	2F-065			COC(=O)c1nn(-c2ccc(OC)cc2)c(=O)cc1Sc1ccc(C)cc1	InChI=1S/C20H18N2O4S/c1-13-4-10-16(11-5-13)27-17-12-18(23)22(21-19(17)20(24)26-3)14-6-8-15(25-2)9-7-14/h4-12H,1-3H3	DGMPKQJUJSNOBV-UHFFFAOYSA-N	382.098727766							109563
MLS000040640	LSM-20992	SID861006, BRD-K65592764	662276	InChI=1S/C18H25N5O2/c1-4-25-17(24)15-11-19-18(23-13(3)10-12(2)22-23)21-16(15)20-14-8-6-5-7-9-14/h10-11,14H,4-9H2,1-3H3,(H,19,20,21)	CHDHJASAMSWOTG-UHFFFAOYSA-N	CCOC(=O)c1cnc(nc1NC2CCCCC2)n3nc(C)cc3C	BroadT	BRD-K65592764	BRD-K65592764-001-07-4	InterBioScreen Ltd.	STOCK3S-97594			CCOC(=O)c1cnc(nc1NC1CCCCC1)-n1nc(C)cc1C	InChI=1S/C18H25N5O2/c1-4-25-17(24)15-11-19-18(23-13(3)10-12(2)22-23)21-16(15)20-14-8-6-5-7-9-14/h10-11,14H,4-9H2,1-3H3,(H,19,20,21)	CHDHJASAMSWOTG-UHFFFAOYSA-N	343.20082509							109564
MLS001033293	LSM-20993	SID24825201, BRD-K17176210	2424786	InChI=1S/C15H12N2O4S/c1-19-12-6-3-2-5-10(12)11(18)9-22-15-17-16-14(21-15)13-7-4-8-20-13/h2-8H,9H2,1H3	GHTPRJLCWBZZIL-UHFFFAOYSA-N	COc1ccccc1C(=O)CSc2oc(nn2)c3occc3	BroadT	BRD-K17176210	BRD-K17176210-001-07-5	Enamine Ltd.	T0520-6979			COc1ccccc1C(=O)CSc1nnc(o1)-c1ccco1	InChI=1S/C15H12N2O4S/c1-19-12-6-3-2-5-10(12)11(18)9-22-15-17-16-14(21-15)13-7-4-8-20-13/h2-8H,9H2,1H3	GHTPRJLCWBZZIL-UHFFFAOYSA-N	316.051777574							109565
SMR000131772	LSM-43907	SID17401935, BRD-K74753219	5837173	InChI=1S/C10H7N3O4S/c14-8-5(2-1-3-7(8)13(16)17)4-6-9(15)12-10(18)11-6/h1-4,14H,(H2,11,12,15,18)/b6-4+	VGLDMXKYORGLEN-GQCTYLIASA-N	Oc1c(\C=C/2\NC(=S)NC2=O)cccc1[N+](=O)[O-]	BroadT	BRD-K74753219	BRD-K74753219-001-05-6	ChemDiv Inc.	0928-0102			Oc1c(\C=C2\NC(=S)NC2=O)cccc1[N+]([O-])=O	InChI=1S/C10H7N3O4S/c14-8-5(2-1-3-7(8)13(16)17)4-6-9(15)12-10(18)11-6/h1-4,14H,(H2,11,12,15,18)/b6-4+	VGLDMXKYORGLEN-GQCTYLIASA-N	265.015726424							
5-(4-Chlorophenyl)-4H-1,2,4-triazole-3-thiol	LSM-20995	SID26666303, BRD-K65069448	689099	InChI=1S/C8H6ClN3S/c9-6-3-1-5(2-4-6)7-10-8(13)12-11-7/h1-4H,(H2,10,11,12,13)	NHEHIODVWGKDFV-UHFFFAOYSA-N	Sc1n[nH]c(n1)c2ccc(Cl)cc2	BroadT	BRD-K65069448	BRD-K65069448-001-05-1	InterBioScreen Ltd.	STOCK3S-79871			Sc1n[nH]c(n1)-c1ccc(Cl)cc1	InChI=1S/C8H6ClN3S/c9-6-3-1-5(2-4-6)7-10-8(13)12-11-7/h1-4H,(H2,10,11,12,13)	NHEHIODVWGKDFV-UHFFFAOYSA-N	210.997095622							109567
MLS000530277	LSM-20996	SID14734525, BRD-A20839751	2729311	InChI=1S/C10H16N4O3S/c1-3-4-5-17-9(16)6(2)11-7-8(15)12-10(18)14-13-7/h6H,3-5H2,1-2H3,(H,11,13)(H2,12,14,15,18)	BCYKHYUBEZWCKP-UHFFFAOYSA-N	CCCCOC(=O)C(C)Nc1nnc(S)nc1O	BroadT	BRD-A20839751	BRD-A20839751-001-03-9	ChemBridge Corporation	5276813			CCCCOC(=O)C(C)Nc1nnc(S)nc1O	InChI=1S/C10H16N4O3S/c1-3-4-5-17-9(16)6(2)11-7-8(15)12-10(18)14-13-7/h6H,3-5H2,1-2H3,(H,11,13)(H2,12,14,15,18)	BCYKHYUBEZWCKP-UHFFFAOYSA-N	272.094311102							109568
AC1OANDW	LSM-20997	BRD-K40929444	6832397	InChI=1S/C16H11ClN6O3S/c17-10-2-1-3-11(8-10)19-20-14-13(21-22(15(14)24)16(18)27)9-4-6-12(7-5-9)23(25)26/h1-8,24H,(H2,18,27)	QHSCARHMNIQUDB-UHFFFAOYSA-N	NC(=S)n1nc(c2ccc(cc2)[N+](=O)[O-])c(N=Nc3cccc(Cl)c3)c1O	BroadT	BRD-K40929444	BRD-K40929444-001-05-0	Asinex Ltd.	BAS 00477750			NC(=S)n1nc(c(N=Nc2cccc(Cl)c2)c1O)-c1ccc(cc1)[N+]([O-])=O	InChI=1S/C16H11ClN6O3S/c17-10-2-1-3-11(8-10)19-20-14-13(21-22(15(14)24)16(18)27)9-4-6-12(7-5-9)23(25)26/h1-8,24H,(H2,18,27)	QHSCARHMNIQUDB-UHFFFAOYSA-N	402.030186672							
SMR000039575	LSM-20998	SID857194, BRD-K37041657	658547	InChI=1S/C24H24N4O3S/c1-24(2)13-16-17(14-25)22(26-21(18(16)15-32-24)19-5-3-11-30-19)27-7-9-28(10-8-27)23(29)20-6-4-12-31-20/h3-6,11-12H,7-10,13,15H2,1-2H3	LLHVRXFKIUMHND-UHFFFAOYSA-N	CC1(C)Cc2c(CS1)c(nc(N3CCN(CC3)C(=O)c4occc4)c2C#N)c5occc5	BroadT	BRD-K37041657	BRD-K37041657-001-05-1	InterBioScreen Ltd.	STOCK1S-60594			CC1(C)Cc2c(CS1)c(nc(N1CCN(CC1)C(=O)c1ccco1)c2C#N)-c1ccco1	InChI=1S/C24H24N4O3S/c1-24(2)13-16-17(14-25)22(26-21(18(16)15-32-24)19-5-3-11-30-19)27-7-9-28(10-8-27)23(29)20-6-4-12-31-20/h3-6,11-12H,7-10,13,15H2,1-2H3	LLHVRXFKIUMHND-UHFFFAOYSA-N	448.156911358							109570
ST50419166	LSM-20999	SID4256473, BRD-K78611329	1248871	InChI=1S/C22H18N4O3S2/c1-14-4-7-16(8-5-14)26-21(19-3-2-10-30-19)24-25-22(26)31-12-20(27)23-15-6-9-17-18(11-15)29-13-28-17/h2-11H,12-13H2,1H3,(H,23,27)	QBTGMKJIHVEGEW-UHFFFAOYSA-N	Cc1ccc(cc1)n2c(SCC(=O)Nc3ccc4OCOc4c3)nnc2c5cccs5	BroadT	BRD-K78611329	BRD-K78611329-001-05-9	ChemBridge Corporation	7911413			Cc1ccc(cc1)-n1c(SCC(=O)Nc2ccc3OCOc3c2)nnc1-c1cccs1	InChI=1S/C22H18N4O3S2/c1-14-4-7-16(8-5-14)26-21(19-3-2-10-30-19)24-25-22(26)31-12-20(27)23-15-6-9-17-18(11-15)29-13-28-17/h2-11H,12-13H2,1H3,(H,23,27)	QBTGMKJIHVEGEW-UHFFFAOYSA-N	450.082031856							109571
Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate	LSM-21000	SID14718861, BRD-K49232368	840126	InChI=1S/C14H22N2O3S/c1-6-16(7-2)13(17)11-9(5)10(12(15)20-11)14(18)19-8(3)4/h8H,6-7,15H2,1-5H3	DTTKSMRPORHRTD-UHFFFAOYSA-N	CCN(CC)C(=O)c1sc(N)c(C(=O)OC(C)C)c1C	BroadT	BRD-K49232368	BRD-K49232368-001-05-2	Specs	AK-968/37166364			CCN(CC)C(=O)c1sc(N)c(C(=O)OC(C)C)c1C	InChI=1S/C14H22N2O3S/c1-6-16(7-2)13(17)11-9(5)10(12(15)20-11)14(18)19-8(3)4/h8H,6-7,15H2,1-5H3	DTTKSMRPORHRTD-UHFFFAOYSA-N	298.135113274							109572
MLS000574317	LSM-21001	SID17412070, BRD-K19644706	886393	InChI=1S/C15H13ClO3S/c1-18-13-8-3-10(9-14(13)19-2)15(17)20-12-6-4-11(16)5-7-12/h3-9H,1-2H3	HXZLPWRTIGTCLO-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)Sc2ccc(Cl)cc2	BroadT	BRD-K19644706	BRD-K19644706-001-08-9	ChemBridge Corporation	6654908			COc1ccc(cc1OC)C(=O)Sc1ccc(Cl)cc1	InChI=1S/C15H13ClO3S/c1-18-13-8-3-10(9-14(13)19-2)15(17)20-12-6-4-11(16)5-7-12/h3-9H,1-2H3	HXZLPWRTIGTCLO-UHFFFAOYSA-N	308.027392676							109573
MLS000394839	LSM-43908	SID22411460, BRD-K17057495	6141196	InChI=1S/C25H21N3O4S/c1-27(19-7-3-2-4-8-19)21-13-11-17(16-22(21)28(31)32)15-18(12-14-24(29)30)25-26-20-9-5-6-10-23(20)33-25/h2-11,13,15-16H,12,14H2,1H3,(H,29,30)/b18-15+	XQILZURWAUDZSB-OBGWFSINSA-N	CN(c1ccccc1)c2ccc(\C=C(/CCC(=O)O)\c3nc4ccccc4s3)cc2[N+](=O)[O-]	BroadT	BRD-K17057495	BRD-K17057495-001-06-5	Enamine Ltd.	T5230124			CN(c1ccccc1)c1ccc(\C=C(/CCC(O)=O)c2nc3ccccc3s2)cc1[N+]([O-])=O	InChI=1S/C25H21N3O4S/c1-27(19-7-3-2-4-8-19)21-13-11-17(16-22(21)28(31)32)15-18(12-14-24(29)30)25-26-20-9-5-6-10-23(20)33-25/h2-11,13,15-16H,12,14H2,1H3,(H,29,30)/b18-15+	XQILZURWAUDZSB-OBGWFSINSA-N	459.125276872							
SMR000065011	LSM-21003	SID3713626, BRD-K03217169	2612601	InChI=1S/C17H15N3O2S2/c1-21-12-6-8-13(9-7-12)22-10-11-23-16-18-19-17-20(16)14-4-2-3-5-15(14)24-17/h2-9H,10-11H2,1H3	CFGZDYLHKGUMKS-UHFFFAOYSA-N	COc1ccc(OCCSc2nnc3sc4ccccc4n23)cc1	BroadT	BRD-K03217169	BRD-K03217169-001-05-8	Enamine Ltd.	ZT-3930754			COc1ccc(OCCSc2nnc3sc4ccccc4n23)cc1	InChI=1S/C17H15N3O2S2/c1-21-12-6-8-13(9-7-12)22-10-11-23-16-18-19-17-20(16)14-4-2-3-5-15(14)24-17/h2-9H,10-11H2,1H3	CFGZDYLHKGUMKS-UHFFFAOYSA-N	357.06056813							109575
ST50674680	LSM-21004	SID4248082, BRD-K53298907	3242202	InChI=1S/C21H20ClN3O3/c1-27-19-8-3-2-7-18(19)24-9-11-25(12-10-24)21(26)17-14-20(28-23-17)15-5-4-6-16(22)13-15/h2-8,13-14H,9-12H2,1H3	QLKGVECXEKDGRM-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)C(=O)c3cc(on3)c4cccc(Cl)c4	BroadT	BRD-K53298907	BRD-K53298907-001-05-4	ChemDiv Inc.	C226-1380			COc1ccccc1N1CCN(CC1)C(=O)c1cc(on1)-c1cccc(Cl)c1	InChI=1S/C21H20ClN3O3/c1-27-19-8-3-2-7-18(19)24-9-11-25(12-10-24)21(26)17-14-20(28-23-17)15-5-4-6-16(22)13-15/h2-8,13-14H,9-12H2,1H3	QLKGVECXEKDGRM-UHFFFAOYSA-N	397.11931924							109576
SMR000131386	LSM-21005	SID14735439, BRD-K18645340	4547303	InChI=1S/C14H12ClNO2S/c1-18-14(17)9-2-7-13(12(16)8-9)19-11-5-3-10(15)4-6-11/h2-8H,16H2,1H3	RTEDDABNZSWIMZ-UHFFFAOYSA-N	COC(=O)c1ccc(Sc2ccc(Cl)cc2)c(N)c1	BroadT	BRD-K18645340	BRD-K18645340-001-06-3	ChemDiv Inc.	K784-2048			COC(=O)c1ccc(Sc2ccc(Cl)cc2)c(N)c1	InChI=1S/C14H12ClNO2S/c1-18-14(17)9-2-7-13(12(16)8-9)19-11-5-3-10(15)4-6-11/h2-8H,16H2,1H3	RTEDDABNZSWIMZ-UHFFFAOYSA-N	293.027727034							109577
AC1LLLDX	LSM-21006	SID17408608, BRD-K96969764	1086372	InChI=1S/C23H20ClN3O2S/c1-29-20-7-3-5-17(13-20)21-9-8-18(14-25)23(27-21)30-15-22(28)26-11-10-16-4-2-6-19(24)12-16/h2-9,12-13H,10-11,15H2,1H3,(H,26,28)	LVEKLDDDZPRYNR-UHFFFAOYSA-N	COc1cccc(c1)c2ccc(C#N)c(SCC(=O)NCCc3cccc(Cl)c3)n2	BroadT	BRD-K96969764	BRD-K96969764-001-05-1	Asinex Ltd.	BAS 06900531			COc1cccc(c1)-c1ccc(C#N)c(SCC(=O)NCCc2cccc(Cl)c2)n1	InChI=1S/C23H20ClN3O2S/c1-29-20-7-3-5-17(13-20)21-9-8-18(14-25)23(27-21)30-15-22(28)26-11-10-16-4-2-6-19(24)12-16/h2-9,12-13H,10-11,15H2,1H3,(H,26,28)	LVEKLDDDZPRYNR-UHFFFAOYSA-N	437.09647531							109578
T0517-6995	LSM-21007	SID17517103, BRD-K66184663	4296292	InChI=1S/C20H17ClN4O5/c1-12-9-13(2)24(23-12)16-6-3-14(4-7-16)20(27)30-11-19(26)22-17-8-5-15(21)10-18(17)25(28)29/h3-10H,11H2,1-2H3,(H,22,26)	ZYKURNWGLNKKRW-UHFFFAOYSA-N	Cc1cc(C)n(n1)c2ccc(cc2)C(=O)OCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-]	BroadT	BRD-K66184663	BRD-K66184663-001-05-5	Enamine Ltd.	T0517-6995			Cc1cc(C)n(n1)-c1ccc(cc1)C(=O)OCC(=O)Nc1ccc(Cl)cc1[N+]([O-])=O	InChI=1S/C20H17ClN4O5/c1-12-9-13(2)24(23-12)16-6-3-14(4-7-16)20(27)30-11-19(26)22-17-8-5-15(21)10-18(17)25(28)29/h3-10H,11H2,1-2H3,(H,22,26)	ZYKURNWGLNKKRW-UHFFFAOYSA-N	428.088747394							109579
AC1M5BI8	LSM-21008	SID22409772, BRD-K67923665	2325502	InChI=1S/C17H15N3S/c1-13-16(17(21)18-14-8-4-2-5-9-14)12-20(19-13)15-10-6-3-7-11-15/h2-12H,1H3,(H,18,21)	UBYPTYAEDLWULZ-UHFFFAOYSA-N	Cc1nn(cc1C(=Nc2ccccc2)S)c3ccccc3	BroadT	BRD-K67923665	BRD-K67923665-001-05-3	Enamine Ltd.	T0504-5878			Cc1nn(cc1C(S)=Nc1ccccc1)-c1ccccc1	InChI=1S/C17H15N3S/c1-13-16(17(21)18-14-8-4-2-5-9-14)12-20(19-13)15-10-6-3-7-11-15/h2-12H,1H3,(H,18,21)	UBYPTYAEDLWULZ-UHFFFAOYSA-N	293.0986682							109580
ST50852862	LSM-21009	SID24805857, BRD-K04248452	2211649	InChI=1S/C15H12Cl2N2O2S/c1-8-2-3-9(14(20)21)6-13(8)19-15(22)18-12-5-4-10(16)7-11(12)17/h2-7H,1H3,(H,20,21)(H2,18,19,22)	HXPZIFSWLLXYFM-UHFFFAOYSA-N	Cc1ccc(cc1N=C(S)Nc2ccc(Cl)cc2Cl)C(=O)O	BroadT	BRD-K04248452	BRD-K04248452-001-05-8	ChemBridge Corporation	7835639			Cc1ccc(cc1N=C(S)Nc1ccc(Cl)cc1Cl)C(O)=O	InChI=1S/C15H12Cl2N2O2S/c1-8-2-3-9(14(20)21)6-13(8)19-15(22)18-12-5-4-10(16)7-11(12)17/h2-7H,1H3,(H,20,21)(H2,18,19,22)	HXPZIFSWLLXYFM-UHFFFAOYSA-N	353.999653754							109581
MLS000583575	LSM-21010	SID17509856, BRD-K80646282	5009230	InChI=1S/C16H17ClN2OS/c17-12-6-7-13-14(10-12)18-16(21)19(15(13)20)9-8-11-4-2-1-3-5-11/h4,6-7,10H,1-3,5,8-9H2,(H,18,21)	HQOPYEXMXURNHR-UHFFFAOYSA-N	Clc1ccc2C(=O)N(CCC3=CCCCC3)C(=S)Nc2c1	BroadT	BRD-K80646282	BRD-K80646282-001-05-6	ChemDiv Inc.	K287-0343			Clc1ccc2c(c1)[nH]c(=S)n(CCC1=CCCCC1)c2=O	InChI=1S/C16H17ClN2OS/c17-12-6-7-13-14(10-12)18-16(21)19(15(13)20)9-8-11-4-2-1-3-5-11/h4,6-7,10H,1-3,5,8-9H2,(H,18,21)	HQOPYEXMXURNHR-UHFFFAOYSA-N	320.075011584							109582
MLS000588330	LSM-43909	SID17511424, BRD-A07237805	5780532	InChI=1S/C13H12N2O3S3/c16-12-11(6-9-2-1-4-14-7-9)20-13(19)15(12)10-3-5-21(17,18)8-10/h1-2,4,6-7,10H,3,5,8H2/b11-6-	SPNNEPQLTTUSOV-WDZFZDKYSA-N	O=C1N(C2CCS(=O)(=O)C2)C(=S)S/C/1=C\c3cccnc3	BroadT	BRD-A07237805	BRD-A07237805-001-06-2	InterBioScreen Ltd.	STOCK1S-73769			O=C1N(C2CCS(=O)(=O)C2)C(=S)S\C1=C/c1cccnc1	InChI=1S/C13H12N2O3S3/c16-12-11(6-9-2-1-4-14-7-9)20-13(19)15(12)10-3-5-21(17,18)8-10/h1-2,4,6-7,10H,3,5,8H2/b11-6-	SPNNEPQLTTUSOV-WDZFZDKYSA-N	340.001004334							
SMR000026489	LSM-21012	SID4248513, SID46500805, BRD-A00214921	3242580	InChI=1S/C23H25N3O5S/c1-2-15-6-3-4-8-20(15)26-32(29,30)17-9-10-21-18(12-17)22(27)19(14-24-21)23(28)25-13-16-7-5-11-31-16/h3-4,6,8-10,12,14,16,26H,2,5,7,11,13H2,1H3,(H,24,27)(H,25,28)	GFFHTABJSQSYGU-UHFFFAOYSA-N	CCc1ccccc1NS(=O)(=O)c2ccc3ncc(C(=O)NCC4CCCO4)c(O)c3c2	BroadT	BRD-A00214921	BRD-A00214921-001-04-2	ChemDiv Inc.	C385-0243			CCc1ccccc1NS(=O)(=O)c1ccc2[nH]cc(C(=O)NCC3CCCO3)c(=O)c2c1	InChI=1S/C23H25N3O5S/c1-2-15-6-3-4-8-20(15)26-32(29,30)17-9-10-21-18(12-17)22(27)19(14-24-21)23(28)25-13-16-7-5-11-31-16/h3-4,6,8-10,12,14,16,26H,2,5,7,11,13H2,1H3,(H,24,27)(H,25,28)	GFFHTABJSQSYGU-UHFFFAOYSA-N	455.15149162							109584
STK336984	LSM-21013	SID49730082, BRD-K84812005	965764	InChI=1S/C19H17NO4/c1-12-4-3-5-16(13(12)2)23-11-18(21)20-15-7-8-17-14(10-15)6-9-19(22)24-17/h3-10H,11H2,1-2H3,(H,20,21)	UMCCTVQMAWLKCQ-UHFFFAOYSA-N	Cc1cccc(OCC(=O)Nc2ccc3OC(=O)C=Cc3c2)c1C	BroadT	BRD-K84812005	BRD-K84812005-001-05-6	Asinex Ltd.	BAS 08208036			Cc1cccc(OCC(=O)Nc2ccc3oc(=O)ccc3c2)c1C	InChI=1S/C19H17NO4/c1-12-4-3-5-16(13(12)2)23-11-18(21)20-15-7-8-17-14(10-15)6-9-19(22)24-17/h3-10H,11H2,1-2H3,(H,20,21)	UMCCTVQMAWLKCQ-UHFFFAOYSA-N	323.115758034							109585
T0503-5104	LSM-43910	SID22403518, BRD-K19004603	6151264	InChI=1S/C24H18F3N3O4S/c1-2-34-20(31)11-14-13-35-23(29-14)28-12-17-15-7-3-4-8-16(15)21(32)30(22(17)33)19-10-6-5-9-18(19)24(25,26)27/h3-10,12-13H,2,11H2,1H3,(H,28,29)/b17-12+	WKGGBAOWGXKNGQ-SFQUDFHCSA-N	CCOC(=O)Cc1csc(N\C=C/2\C(=O)N(C(=O)c3ccccc23)c4ccccc4C(F)(F)F)n1	BroadT	BRD-K19004603	BRD-K19004603-001-05-6	Enamine Ltd.	T0503-5104			CCOC(=O)Cc1csc(N\C=C2\C(=O)N(C(=O)c3ccccc23)c2ccccc2C(F)(F)F)n1	InChI=1S/C24H18F3N3O4S/c1-2-34-20(31)11-14-13-35-23(29-14)28-12-17-15-7-3-4-8-16(15)21(32)30(22(17)33)19-10-6-5-9-18(19)24(25,26)27/h3-10,12-13H,2,11H2,1H3,(H,28,29)/b17-12+	WKGGBAOWGXKNGQ-SFQUDFHCSA-N	501.097011376							
AC1N2X0Z	LSM-21015	BRD-K23781190	4078385	InChI=1S/C16H14Cl2N6O/c1-9-7-14(25)21-16(20-9)22-19-8-11-10(2)23-24(15(11)18)13-6-4-3-5-12(13)17/h3-8H,1-2H3,(H2,20,21,22,25)	BRYGUYDFOAUGPN-UHFFFAOYSA-N	Cc1cc(O)nc(NN=Cc2c(C)nn(c2Cl)c3ccccc3Cl)n1	BroadT	BRD-K23781190	BRD-K23781190-001-05-2	Enamine Ltd.	T0506-8258			Cc1nn(c(Cl)c1C=NNc1nc(C)cc(O)n1)-c1ccccc1Cl	InChI=1S/C16H14Cl2N6O/c1-9-7-14(25)21-16(20-9)22-19-8-11-10(2)23-24(15(11)18)13-6-4-3-5-12(13)17/h3-8H,1-2H3,(H2,20,21,22,25)	BRYGUYDFOAUGPN-UHFFFAOYSA-N	376.060614548							109587
MLS000335119	LSM-21016	SID17516946, BRD-K34396016	5237490	InChI=1S/C19H16N4O2S/c1-12-7-8-14-16(11-12)26-19(20-14)21-18(25)15-9-10-17(24)23(22-15)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H,20,21,25)	MYNOXPBWJAHVJZ-UHFFFAOYSA-N	Cc1ccc2nc(NC(=O)C3=NN(C(=O)CC3)c4ccccc4)sc2c1	BroadT	BRD-K34396016	BRD-K34396016-001-05-8	Enamine Ltd.	T5272293			Cc1ccc2nc(NC(=O)C3=NN(C(=O)CC3)c3ccccc3)sc2c1	InChI=1S/C19H16N4O2S/c1-12-7-8-14-16(11-12)26-19(20-14)21-18(25)15-9-10-17(24)23(22-15)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H,20,21,25)	MYNOXPBWJAHVJZ-UHFFFAOYSA-N	364.099396482							109588
MLS000678515	LSM-21017	SID24815703, BRD-K37501571	7162438	InChI=1S/C15H12N4S/c1-3-9-16-12(5-1)11-20-15-8-7-14(18-19-15)13-6-2-4-10-17-13/h1-10H,11H2	BMHGUWQJWGVXMD-UHFFFAOYSA-N	C(Sc1ccc(nn1)c2ccccn2)c3ccccn3	BroadT	BRD-K37501571	BRD-K37501571-001-05-7	Life Chemicals Inc.	F2005-0151			C(Sc1ccc(nn1)-c1ccccn1)c1ccccn1	InChI=1S/C15H12N4S/c1-3-9-16-12(5-1)11-20-15-8-7-14(18-19-15)13-6-2-4-10-17-13/h1-10H,11H2	BMHGUWQJWGVXMD-UHFFFAOYSA-N	280.078267114							109589
SMR000041927	LSM-21018	SID860032, BRD-K40078981	661339	InChI=1S/C25H33N5O3/c1-3-5-13-26-16-23(31)28-19-9-7-18(8-10-19)25-30-21-15-20(11-12-22(21)33-25)29-24(32)17-27-14-6-4-2/h7-12,15,26-27H,3-6,13-14,16-17H2,1-2H3,(H,28,31)(H,29,32)	IKSJWIBLHRKRQE-UHFFFAOYSA-N	CCCCNCC(=O)Nc1ccc(cc1)c2oc3ccc(NC(=O)CNCCCC)cc3n2	BroadT	BRD-K40078981	BRD-K40078981-001-04-8	InterBioScreen Ltd.	STOCK3S-44212			CCCCNCC(=O)Nc1ccc(cc1)-c1nc2cc(NC(=O)CNCCCC)ccc2o1	InChI=1S/C25H33N5O3/c1-3-5-13-26-16-23(31)28-19-9-7-18(8-10-19)25-30-21-15-20(11-12-22(21)33-25)29-24(32)17-27-14-6-4-2/h7-12,15,26-27H,3-6,13-14,16-17H2,1-2H3,(H,28,31)(H,29,32)	IKSJWIBLHRKRQE-UHFFFAOYSA-N	451.258339966							109590
8-Phenyl-2,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazole	LSM-15493	BRD-K80246058	1402971	InChI=1S/C20H18N2/c1-2-5-14(6-3-1)15-9-10-19-17(13-15)16-7-4-8-18-20(16)22(19)12-11-21-18/h1-3,5-6,9-10,13H,4,7-8,11-12H2	WXPVMCVBNSRZQA-UHFFFAOYSA-N	C1CC2=NCCn3c2c(C1)c4cc(ccc34)c5ccccc5	BroadT	BRD-K80246058	BRD-K80246058-066-06-8	InterBioScreen Ltd.	STOCK4S-23542		CS(=O)(=O)O	C1Cc2c3C(C1)=NCCn3c1ccc(cc21)-c1ccccc1.CS(=O)(=O)O	InChI=1S/C20H18N2.CH4O3S/c1-2-5-14(6-3-1)15-9-10-19-17(13-15)16-7-4-8-18-20(16)22(19)12-11-21-18;1-5(2,3)4/h1-3,5-6,9-10,13H,4,7-8,11-12H2;1H3,(H,2,3,4)	SKLOVDQNXCPFNQ-UHFFFAOYSA-N	286.146998596							104135, 104135
SMR000014841	LSM-21019	SID846038, BRD-K02445961	648410	InChI=1S/C22H27N3O2/c1-16(2)22(27)25-14-12-24(13-15-25)20-7-5-4-6-19(20)23-21(26)18-10-8-17(3)9-11-18/h4-11,16H,12-15H2,1-3H3,(H,23,26)	IGHRTZWXWJQQTP-UHFFFAOYSA-N	CC(C)C(=O)N1CCN(CC1)c2ccccc2NC(=O)c3ccc(C)cc3	BroadT	BRD-K02445961	BRD-K02445961-001-05-6	Asinex Ltd.	BAS 08206948			CC(C)C(=O)N1CCN(CC1)c1ccccc1NC(=O)c1ccc(C)cc1	InChI=1S/C22H27N3O2/c1-16(2)22(27)25-14-12-24(13-15-25)20-7-5-4-6-19(20)23-21(26)18-10-8-17(3)9-11-18/h4-11,16H,12-15H2,1-3H3,(H,23,26)	IGHRTZWXWJQQTP-UHFFFAOYSA-N	365.210327134							109591
T5310773	LSM-21020	SID24784726, BRD-A15255131	4837470	InChI=1S/C27H24N4O4S/c1-16-4-13-21-22(14-16)36-24(29-21)17-5-9-19(10-6-17)28-23(32)15-31-25(33)27(2,30-26(31)34)18-7-11-20(35-3)12-8-18/h4-14H,15H2,1-3H3,(H,28,32)(H,30,34)	IPOUKHNMIBKMTR-UHFFFAOYSA-N	COc1ccc(cc1)C2(C)NC(=O)N(CC(=O)Nc3ccc(cc3)c4nc5ccc(C)cc5s4)C2=O	BroadT	BRD-A15255131	BRD-A15255131-001-05-1	Enamine Ltd.	T5310773			COc1ccc(cc1)C1(C)NC(=O)N(CC(=O)Nc2ccc(cc2)-c2nc3ccc(C)cc3s2)C1=O	InChI=1S/C27H24N4O4S/c1-16-4-13-21-22(14-16)36-24(29-21)17-5-9-19(10-6-17)28-23(32)15-31-25(33)27(2,30-26(31)34)18-7-11-20(35-3)12-8-18/h4-14H,15H2,1-3H3,(H,28,32)(H,30,34)	IPOUKHNMIBKMTR-UHFFFAOYSA-N	500.151825978							109592
AC1MEY3O	LSM-21021	SID24803973, BRD-A93751380	2886035	InChI=1S/C14H14N4O2S/c1-8-3-9(2)5-10(4-8)18-12(19)6-11(13(18)20)21-14-15-7-16-17-14/h3-5,7,11H,6H2,1-2H3,(H,15,16,17)	ZFKWFHMKVZEDEN-UHFFFAOYSA-N	Cc1cc(C)cc(c1)N2C(=O)CC(Sc3nc[nH]n3)C2=O	BroadT	BRD-A93751380	BRD-A93751380-001-11-0	Asinex Ltd.	BAS 02101437			Cc1cc(C)cc(c1)N1C(=O)CC(Sc2nc[nH]n2)C1=O	InChI=1S/C14H14N4O2S/c1-8-3-9(2)5-10(4-8)18-12(19)6-11(13(18)20)21-14-15-7-16-17-14/h3-5,7,11H,6H2,1-2H3,(H,15,16,17)	ZFKWFHMKVZEDEN-UHFFFAOYSA-N	302.083746418							109593
MLS000704894	LSM-43911	BRD-K81177682	5995173	InChI=1S/C29H25N3O5S/c1-36-22-12-8-21(9-13-22)31-29-32(15-14-20-17-30-25-5-3-2-4-24(20)25)28(35)26(38-29)16-19-6-10-23(11-7-19)37-18-27(33)34/h2-13,16-17,30H,14-15,18H2,1H3,(H,33,34)/b26-16-,31-29?	WZPMXNLVZLIWBV-FDHMRPASSA-N	COc1ccc(cc1)N=C2S\C(=C/c3ccc(OCC(=O)O)cc3)\C(=O)N2CCc4c[nH]c5ccccc45	BroadT	BRD-K81177682	BRD-K81177682-001-04-0	Specs	AN-698/40781109			COc1ccc(cc1)N=C1S\C(=C/c2ccc(OCC(O)=O)cc2)C(=O)N1CCc1c[nH]c2ccccc12	InChI=1S/C29H25N3O5S/c1-36-22-12-8-21(9-13-22)31-29-32(15-14-20-17-30-25-5-3-2-4-24(20)25)28(35)26(38-29)16-19-6-10-23(11-7-19)37-18-27(33)34/h2-13,16-17,30H,14-15,18H2,1H3,(H,33,34)/b26-16-,31-29?	WZPMXNLVZLIWBV-FDHMRPASSA-N	527.15149162							
AC1O25ZB	LSM-21023	SID24823738, BRD-A72665222	6167339	InChI=1S/C18H20N4O2S/c23-15(19-11-6-2-1-3-7-11)10-14-17(24)22-16(20-14)12-8-4-5-9-13(12)21-18(22)25/h4-5,8-9,11,14H,1-3,6-7,10H2,(H,19,23)(H,21,25)	RSPBALXCEINKCZ-UHFFFAOYSA-N	O=C(CC1N=C2N(C(=S)Nc3ccccc23)C1=O)NC4CCCCC4	BroadT	BRD-A72665222	BRD-A72665222-001-03-6	ChemDiv Inc.	K279-0437			O=C(CC1N=C2N(C1=O)C(=S)Nc1ccccc21)NC1CCCCC1	InChI=1S/C18H20N4O2S/c23-15(19-11-6-2-1-3-7-11)10-14-17(24)22-16(20-14)12-8-4-5-9-13(12)21-18(22)25/h4-5,8-9,11,14H,1-3,6-7,10H2,(H,19,23)(H,21,25)	RSPBALXCEINKCZ-UHFFFAOYSA-N	356.13069661							109595
5-(4-Nitrophenyl)-4-phenyl-1,3-thiazol-2-amine	LSM-21024	SID24820069, BRD-K76971068	626715	InChI=1S/C15H11N3O2S/c16-15-17-13(10-4-2-1-3-5-10)14(21-15)11-6-8-12(9-7-11)18(19)20/h1-9H,(H2,16,17)	DABFRTXQVAEIHW-UHFFFAOYSA-N	Nc1nc(c2ccccc2)c(s1)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-K76971068	BRD-K76971068-001-05-4	ChemDiv Inc.	8004-9641			Nc1nc(c(s1)-c1ccc(cc1)[N+]([O-])=O)-c1ccccc1	InChI=1S/C15H11N3O2S/c16-15-17-13(10-4-2-1-3-5-10)14(21-15)11-6-8-12(9-7-11)18(19)20/h1-9H,(H2,16,17)	DABFRTXQVAEIHW-UHFFFAOYSA-N	297.057197312							109596
MLS000923822	LSM-21025	BRD-K95864593	24789555	InChI=1S/C22H29N9O3/c1-14(2)33-17-6-4-16(5-7-17)12-24-26-22(32)19-18(13-30-10-8-15(3)9-11-30)31(29-25-19)21-20(23)27-34-28-21/h4-7,12,14-15H,8-11,13H2,1-3H3,(H2,23,27)(H,26,32)	PSCYMHJAJFMXMI-UHFFFAOYSA-N	CC(C)Oc1ccc(C=NNC(=O)c2nnn(c2CN3CCC(C)CC3)c4nonc4N)cc1	BroadT	BRD-K95864593	BRD-K95864593-001-05-2	ChemDiv Inc.	6011-0834			CC(C)Oc1ccc(C=NNC(=O)c2nnn(c2CN2CCC(C)CC2)-c2nonc2N)cc1	InChI=1S/C22H29N9O3/c1-14(2)33-17-6-4-16(5-7-17)12-24-26-22(32)19-18(13-30-10-8-15(3)9-11-30)31(29-25-19)21-20(23)27-34-28-21/h4-7,12,14-15H,8-11,13H2,1-3H3,(H2,23,27)(H,26,32)	PSCYMHJAJFMXMI-UHFFFAOYSA-N	467.239335878							109597
MLS000334409	LSM-21026	SID22402841, BRD-K42662468	2482966	InChI=1S/C22H18FN3O2S2/c23-16-9-7-15(8-10-16)13-26-21(28)18-5-1-2-6-19(18)25-22(26)30-14-20(27)24-12-17-4-3-11-29-17/h1-11H,12-14H2,(H,24,27)	FHBRJJQTFSTYDE-UHFFFAOYSA-N	Fc1ccc(CN2C(=Nc3ccccc3C2=O)SCC(=O)NCc4cccs4)cc1	BroadT	BRD-K42662468	BRD-K42662468-001-06-4	Enamine Ltd.	T5285150			Fc1ccc(Cn2c(SCC(=O)NCc3cccs3)nc3ccccc3c2=O)cc1	InChI=1S/C22H18FN3O2S2/c23-16-9-7-15(8-10-16)13-26-21(28)18-5-1-2-6-19(18)25-22(26)30-14-20(27)24-12-17-4-3-11-29-17/h1-11H,12-14H2,(H,24,27)	FHBRJJQTFSTYDE-UHFFFAOYSA-N	439.082446426							109598
ST50202888	LSM-21027	SID49641639, BRD-K79711355	734484	InChI=1S/C14H15N3O/c1-9-8-10(2)16-14(15-9)17-13-6-4-12(5-7-13)11(3)18/h4-8H,1-3H3,(H,15,16,17)	KFRUEQDRNCSEGM-UHFFFAOYSA-N	CC(=O)c1ccc(Nc2nc(C)cc(C)n2)cc1	BroadT	BRD-K79711355	BRD-K79711355-001-05-3	Asinex Ltd.	BAS 09525062			CC(=O)c1ccc(Nc2nc(C)cc(C)n2)cc1	InChI=1S/C14H15N3O/c1-9-8-10(2)16-14(15-9)17-13-6-4-12(5-7-13)11(3)18/h4-8H,1-3H3,(H,15,16,17)	KFRUEQDRNCSEGM-UHFFFAOYSA-N	241.12151213							109599
BAS 10217617	LSM-21028	SID24809743, BRD-K77665426	3918464	InChI=1S/C16H16FN3O3S/c1-10-8-12(5-6-13(10)17)24(22,23)18-11-4-7-14-15(9-11)20(3)16(21)19(14)2/h4-9,18H,1-3H3	JUBCMJWXGXWPHB-UHFFFAOYSA-N	CN1C(=O)N(C)c2cc(NS(=O)(=O)c3ccc(F)c(C)c3)ccc12	BroadT	BRD-K77665426	BRD-K77665426-001-05-8	Asinex Ltd.	BAS 10217617			Cc1cc(ccc1F)S(=O)(=O)Nc1ccc2n(C)c(=O)n(C)c2c1	InChI=1S/C16H16FN3O3S/c1-10-8-12(5-6-13(10)17)24(22,23)18-11-4-7-14-15(9-11)20(3)16(21)19(14)2/h4-9,18H,1-3H3	JUBCMJWXGXWPHB-UHFFFAOYSA-N	349.089640292							109600
BRD-A37419342	LSM-21029			InChI=1S/C19H28N2O7/c1-7-26-17(23)14-11(5)21-12(6)15(18(24)27-8-2)16(14)19(25)28-9-13(22)20-10(3)4/h10,14,16H,7-9H2,1-6H3,(H,20,22)	ILICJIYOUZKPOK-UHFFFAOYSA-N	CCOC(=O)C1C(C(=O)OCC(=O)NC(C)C)C(=C(C)N=C1C)C(=O)OCC	BroadT	BRD-A37419342	BRD-A37419342-001-06-0	Enamine Ltd.	T5210870			CCOC(=O)C1C(C(=O)OCC(=O)NC(C)C)C(C(=O)OCC)=C(C)N=C1C	InChI=1S/C19H28N2O7/c1-7-26-17(23)14-11(5)21-12(6)15(18(24)27-8-2)16(14)19(25)28-9-13(22)20-10(3)4/h10,14,16H,7-9H2,1-6H3,(H,20,22)	ILICJIYOUZKPOK-UHFFFAOYSA-N	396.189651256							109601
2-[Allylsulfanyl-(4,5,6,7-Tetrahydro-1H-indol-2-yl)-methylene]-malononitrile	LSM-21030	SID14725347, BRD-K19179855	3127253	InChI=1S/C15H15N3S/c1-2-7-19-15(12(9-16)10-17)14-8-11-5-3-4-6-13(11)18-14/h2,8,18H,1,3-7H2	GERXZJXJRKYFKX-UHFFFAOYSA-N	C=CCSC(=C(C#N)C#N)c1cc2CCCCc2[nH]1	BroadT	BRD-K19179855	BRD-K19179855-001-07-7	Asinex Ltd.	BAS 01184138			C=CCSC(=C(C#N)C#N)c1cc2CCCCc2[nH]1	InChI=1S/C15H15N3S/c1-2-7-19-15(12(9-16)10-17)14-8-11-5-3-4-6-13(11)18-14/h2,8,18H,1,3-7H2	GERXZJXJRKYFKX-UHFFFAOYSA-N	269.0986682							109602
GNF-PF-4945	LSM-21031	GNF-PF-4945, BRD-K31256330	1116028	InChI=1S/C18H15NO2S3/c1-10-6-7-12-11(9-10)14-15(23-24-17(14)22)18(2,3)19(12)16(20)13-5-4-8-21-13/h4-9H,1-3H3	NEVVRUDKXFSGJC-UHFFFAOYSA-N	Cc1ccc2N(C(=O)c3occc3)C(C)(C)C4=C(C(=S)SS4)c2c1	BroadT	BRD-K31256330	BRD-K31256330-001-05-6	Asinex Ltd.	BAS 00126795			Cc1ccc2N(C(=O)c3ccco3)C(C)(C)c3ssc(=S)c3-c2c1	InChI=1S/C18H15NO2S3/c1-10-6-7-12-11(9-10)14-15(23-24-17(14)22)18(2,3)19(12)16(20)13-5-4-8-21-13/h4-9H,1-3H3	NEVVRUDKXFSGJC-UHFFFAOYSA-N	373.0264908							109603
CHEMBL1215029	LSM-21032	SID14718866, BRD-K75094682	684664	InChI=1S/C17H15N5/c18-10-13-15(12-6-2-1-3-7-12)14(11-19)17(21-16(13)20)22-8-4-5-9-22/h1-3,6-7H,4-5,8-9H2,(H2,20,21)	DQDILNDNGZRYFK-UHFFFAOYSA-N	Nc1nc(N2CCCC2)c(C#N)c(c3ccccc3)c1C#N	BroadT	BRD-K75094682	BRD-K75094682-001-05-2	Specs	AG-205/36871014			Nc1nc(N2CCCC2)c(C#N)c(-c2ccccc2)c1C#N	InChI=1S/C17H15N5/c18-10-13-15(12-6-2-1-3-7-12)14(11-19)17(21-16(13)20)22-8-4-5-9-22/h1-3,6-7H,4-5,8-9H2,(H2,20,21)	DQDILNDNGZRYFK-UHFFFAOYSA-N	289.13274553							109604
AC1LYSWE	LSM-43912	SID24817669, BRD-K25065137	1932984	InChI=1S/C16H15N3O3S2/c1-22-12-7-4-11(5-8-12)6-9-14(20)17-16(23)19-18-15(21)13-3-2-10-24-13/h2-10H,1H3,(H,18,21)(H2,17,19,20,23)/b9-6+	WIZLNTLMXHHOKH-RMKNXTFCSA-N	COc1ccc(\C=C\C(=O)NC(=S)NNC(=O)c2cccs2)cc1	BroadT	BRD-K25065137	BRD-K25065137-001-05-4	Asinex Ltd.	BAS 01555513			COc1ccc(\C=C\C(=O)NC(=S)NNC(=O)c2cccs2)cc1	InChI=1S/C16H15N3O3S2/c1-22-12-7-4-11(5-8-12)6-9-14(20)17-16(23)19-18-15(21)13-3-2-10-24-13/h2-10H,1H3,(H,18,21)(H2,17,19,20,23)/b9-6+	WIZLNTLMXHHOKH-RMKNXTFCSA-N	361.05548275							
AC1NPL5K	LSM-21034	BRD-K63753056	5205900	InChI=1S/C21H22N8O3/c1-32-18-10-9-15(13-17(18)29(30)31)14-22-27-20-24-19(23-16-7-3-2-4-8-16)25-21(26-20)28-11-5-6-12-28/h2-4,7-10,13-14H,5-6,11-12H2,1H3,(H2,23,24,25,26,27)	LHZYCIWASXAPRQ-UHFFFAOYSA-N	COc1ccc(C=NNc2nc(Nc3ccccc3)nc(n2)N4CCCC4)cc1[N+](=O)[O-]	BroadT	BRD-K63753056	BRD-K63753056-001-06-3	ChemDiv Inc.	3229-0884			COc1ccc(C=NNc2nc(Nc3ccccc3)nc(n2)N2CCCC2)cc1[N+]([O-])=O	InChI=1S/C21H22N8O3/c1-32-18-10-9-15(13-17(18)29(30)31)14-22-27-20-24-19(23-16-7-3-2-4-8-16)25-21(26-20)28-11-5-6-12-28/h2-4,7-10,13-14H,5-6,11-12H2,1H3,(H2,23,24,25,26,27)	LHZYCIWASXAPRQ-UHFFFAOYSA-N	434.181486644							109606
MLS000074009	LSM-21035	SID845435, BRD-A46124835	647786	InChI=1S/C12H10Cl2N2O4S/c1-6(11(17)15-5-7-3-2-4-19-7)20-12(18)9-8(13)10(14)21-16-9/h2-4,6H,5H2,1H3,(H,15,17)	XWFUUIKRNQMEEN-UHFFFAOYSA-N	CC(OC(=O)c1nsc(Cl)c1Cl)C(=O)NCc2occc2	BroadT	BRD-A46124835	BRD-A46124835-001-06-9	Asinex Ltd.	ASN 06396779			CC(OC(=O)c1nsc(Cl)c1Cl)C(=O)NCc1ccco1	InChI=1S/C12H10Cl2N2O4S/c1-6(11(17)15-5-7-3-2-4-19-7)20-12(18)9-8(13)10(14)21-16-9/h2-4,6H,5H2,1H3,(H,15,17)	XWFUUIKRNQMEEN-UHFFFAOYSA-N	347.97383293							109607
MLS001075748	LSM-42950	BRD-K86966177, SID49817234, SID87544525	1985027	InChI=1S/C23H22N2O4S2/c1-2-15-5-7-16(8-6-15)14-19-21(27)25(23(30)31-19)13-3-4-20(26)24-18-11-9-17(10-12-18)22(28)29/h5-12,14H,2-4,13H2,1H3,(H,24,26)(H,28,29)/b19-14-	PITVDYLNTHZLRC-RGEXLXHISA-N	CCc1ccc(\C=C\2/SC(=S)N(CCCC(=O)Nc3ccc(cc3)C(=O)O)C2=O)cc1	BroadT	BRD-K86966177	BRD-K86966177-001-07-6	InterBioScreen Ltd.	STOCK2S-30157			CCc1ccc(cc1)\C=C1/SC(=S)N(CCCC(=O)Nc2ccc(cc2)C(O)=O)C1=O	InChI=1S/C23H22N2O4S2/c1-2-15-5-7-16(8-6-15)14-19-21(27)25(23(30)31-19)13-3-4-20(26)24-18-11-9-17(10-12-18)22(28)29/h5-12,14H,2-4,13H2,1H3,(H,24,26)(H,28,29)/b19-14-	PITVDYLNTHZLRC-RGEXLXHISA-N	454.102098584							
STK326891	LSM-21036	SID24794265, BRD-A87545460	2946511	InChI=1S/C15H21ClN2O2S/c1-10-5-4-6-18(9-10)15(21)17-12-8-13(19-2)11(16)7-14(12)20-3/h7-8,10H,4-6,9H2,1-3H3,(H,17,21)	DWTZCYQJCYKXHX-UHFFFAOYSA-N	COc1cc(N=C(S)N2CCCC(C)C2)c(OC)cc1Cl	BroadT	BRD-A87545460	BRD-A87545460-001-05-9	ChemBridge Corporation	7666026			COc1cc(N=C(S)N2CCCC(C)C2)c(OC)cc1Cl	InChI=1S/C15H21ClN2O2S/c1-10-5-4-6-18(9-10)15(21)17-12-8-13(19-2)11(16)7-14(12)20-3/h7-8,10H,4-6,9H2,1-3H3,(H,17,21)	DWTZCYQJCYKXHX-UHFFFAOYSA-N	328.101226332							109608
STK163319	LSM-21037	SID17506268, BRD-K20983019	960353	InChI=1S/C17H16ClN3O3/c18-14-11-12(7-8-16(14)20-9-3-4-10-20)19-17(22)13-5-1-2-6-15(13)21(23)24/h1-2,5-8,11H,3-4,9-10H2,(H,19,22)	YXKXHGQWYNXLGM-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1C(=O)Nc2ccc(N3CCCC3)c(Cl)c2	BroadT	BRD-K20983019	BRD-K20983019-001-05-6	ChemBridge Corporation	6742346			[O-][N+](=O)c1ccccc1C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	InChI=1S/C17H16ClN3O3/c18-14-11-12(7-8-16(14)20-9-3-4-10-20)19-17(22)13-5-1-2-6-15(13)21(23)24/h1-2,5-8,11H,3-4,9-10H2,(H,19,22)	YXKXHGQWYNXLGM-UHFFFAOYSA-N	345.088019112							109609
AC1MMN43	LSM-21038	SID4247081, BRD-A31237708	3241332	InChI=1S/C24H26N4O3S/c1-3-27(4-2)32(30,31)20-14-12-19(13-15-20)26-23-22-21(11-8-16-25-22)24(29)28(23)17-18-9-6-5-7-10-18/h5-16,23,26H,3-4,17H2,1-2H3	ZFRCKALEJSTNHE-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(NC2N(Cc3ccccc3)C(=O)c4cccnc24)cc1	BroadT	BRD-A31237708	BRD-A31237708-001-05-2	ChemDiv Inc.	C612-0390			CCN(CC)S(=O)(=O)c1ccc(NC2N(Cc3ccccc3)C(=O)c3cccnc23)cc1	InChI=1S/C24H26N4O3S/c1-3-27(4-2)32(30,31)20-14-12-19(13-15-20)26-23-22-21(11-8-16-25-22)24(29)28(23)17-18-9-6-5-7-10-18/h5-16,23,26H,3-4,17H2,1-2H3	ZFRCKALEJSTNHE-UHFFFAOYSA-N	450.172561422							109610
AC1O9QGC	LSM-6556	EMF-SUMO1-4, BRD-K17343332	6765054	InChI=1S/C18H19Br2N3O/c19-16-10-15(18(24)17(20)11-16)12-21-23-8-6-22(7-9-23)13-14-4-2-1-3-5-14/h1-5,10-12,24H,6-9,13H2	GDLYESHVJHYNEC-UHFFFAOYSA-N	Oc1c(Br)cc(Br)cc1C=NN2CCN(Cc3ccccc3)CC2	BroadT	BRD-K17343332	BRD-K17343332-001-08-2	InterBioScreen Ltd.	STOCK3S-10593			Oc1c(Br)cc(Br)cc1C=NN1CCN(Cc2ccccc2)CC1	InChI=1S/C18H19Br2N3O/c19-16-10-15(18(24)17(20)11-16)12-21-23-8-6-22(7-9-23)13-14-4-2-1-3-5-14/h1-5,10-12,24H,6-9,13H2	GDLYESHVJHYNEC-UHFFFAOYSA-N	450.989487458							
STK255083	LSM-21039	SID17409026, BRD-K58633762	1088818	InChI=1S/C23H22ClN3O4/c24-17-3-9-20(10-4-17)31-16-22(28)25-18-5-7-19(8-6-18)26-11-13-27(14-12-26)23(29)21-2-1-15-30-21/h1-10,15H,11-14,16H2,(H,25,28)	LMEBUDRQJGLULG-UHFFFAOYSA-N	Clc1ccc(OCC(=O)Nc2ccc(cc2)N3CCN(CC3)C(=O)c4occc4)cc1	BroadT	BRD-K58633762	BRD-K58633762-001-05-1	Asinex Ltd.	BAS 07245812			Clc1ccc(OCC(=O)Nc2ccc(cc2)N2CCN(CC2)C(=O)c2ccco2)cc1	InChI=1S/C23H22ClN3O4/c24-17-3-9-20(10-4-17)31-16-22(28)25-18-5-7-19(8-6-18)26-11-13-27(14-12-26)23(29)21-2-1-15-30-21/h1-10,15H,11-14,16H2,(H,25,28)	LMEBUDRQJGLULG-UHFFFAOYSA-N	439.129883924							109611
AC1O9FPU	LSM-21040	SID14740574, BRD-K66624788	6757307	InChI=1S/C22H18N2O3S/c1-2-27-22(26)19-20(25)18(28-21(19)24-15-8-4-3-5-9-15)12-14-13-23-17-11-7-6-10-16(14)17/h3-13,24-25H,2H2,1H3/b14-12+	HLYKAZNYFXPIOO-WYMLVPIESA-N	CCOC(=O)c1c(O)c(\C=C\2/C=Nc3ccccc23)sc1Nc4ccccc4	BroadT	BRD-K66624788	BRD-K66624788-001-05-0	ChemBridge Corporation	7092631			CCOC(=O)c1c(Nc2ccccc2)sc(\C=C2/C=Nc3ccccc23)c1O	InChI=1S/C22H18N2O3S/c1-2-27-22(26)19-20(25)18(28-21(19)24-15-8-4-3-5-9-15)12-14-13-23-17-11-7-6-10-16(14)17/h3-13,24-25H,2H2,1H3/b14-12+	HLYKAZNYFXPIOO-WYMLVPIESA-N	390.103813146							
MLS000375249	LSM-21041	SID24791896, SID104219692, BRD-A33279164	4831653	InChI=1S/C29H33N5O2/c1-5-33(6-2)24-17-15-23(16-18-24)31-27(35)19-34-26-10-8-7-9-25(26)32-28(34)21(4)30-29(36)22-13-11-20(3)12-14-22/h7-18,21H,5-6,19H2,1-4H3,(H,30,36)(H,31,35)	OOVMZULLYUWVCB-UHFFFAOYSA-N	CCN(CC)c1ccc(NC(=O)Cn2c(nc3ccccc23)C(C)NC(=O)c4ccc(C)cc4)cc1	BroadT	BRD-A33279164	BRD-A33279164-001-04-2	Enamine Ltd.	T5293853			CCN(CC)c1ccc(NC(=O)Cn2c(nc3ccccc23)C(C)NC(=O)c2ccc(C)cc2)cc1	InChI=1S/C29H33N5O2/c1-5-33(6-2)24-17-15-23(16-18-24)31-27(35)19-34-26-10-8-7-9-25(26)32-28(34)21(4)30-29(36)22-13-11-20(3)12-14-22/h7-18,21H,5-6,19H2,1-4H3,(H,30,36)(H,31,35)	OOVMZULLYUWVCB-UHFFFAOYSA-N	483.263425346							109613
SMR000204266	LSM-21042	SID17510197, BRD-K88828294	1034157	InChI=1S/C18H14ClNO4S/c1-23-13-8-3-10-9-14(25-18(22)15(10)16(13)24-2)17(21)20-12-6-4-11(19)5-7-12/h3-9H,1-2H3,(H,20,21)	PKQUUPBTVBVULJ-UHFFFAOYSA-N	COc1ccc2C=C(SC(=O)c2c1OC)C(=O)Nc3ccc(Cl)cc3	BroadT	BRD-K88828294	BRD-K88828294-001-07-4	ChemDiv Inc.	6427-1097			COc1ccc2cc(sc(=O)c2c1OC)C(=O)Nc1ccc(Cl)cc1	InChI=1S/C18H14ClNO4S/c1-23-13-8-3-10-9-14(25-18(22)15(10)16(13)24-2)17(21)20-12-6-4-11(19)5-7-12/h3-9H,1-2H3,(H,20,21)	PKQUUPBTVBVULJ-UHFFFAOYSA-N	375.033206338							109614
N-(4-Ethoxyphenyl)-1,2,5-thiadiazole-3-carboxamide	LSM-21043	SID4256889, BRD-K57698736	900722	InChI=1S/C11H11N3O2S/c1-2-16-9-5-3-8(4-6-9)13-11(15)10-7-12-17-14-10/h3-7H,2H2,1H3,(H,13,15)	KLTHZZMEMHCNNG-UHFFFAOYSA-N	CCOc1ccc(NC(=O)c2cnsn2)cc1	BroadT	BRD-K57698736	BRD-K57698736-001-05-8	ChemBridge Corporation	7726002			CCOc1ccc(NC(=O)c2cnsn2)cc1	InChI=1S/C11H11N3O2S/c1-2-16-9-5-3-8(4-6-9)13-11(15)10-7-12-17-14-10/h3-7H,2H2,1H3,(H,13,15)	KLTHZZMEMHCNNG-UHFFFAOYSA-N	249.057197312							109615
2-({3-[(4-Methylbenzyl)oxy]-2-thienyl}carbonyl)-1-hydrazinecarbothioamide	LSM-21044	SID24824576, BRD-K13095486	1482507	InChI=1S/C14H15N3O2S2/c1-9-2-4-10(5-3-9)8-19-11-6-7-21-12(11)13(18)16-17-14(15)20/h2-7H,8H2,1H3,(H,16,18)(H3,15,17,20)	MTNMOZVPZJGTNU-UHFFFAOYSA-N	Cc1ccc(COc2ccsc2C(=O)NN=C(N)S)cc1	BroadT	BRD-K13095486	BRD-K13095486-001-06-0	Key Organics Ltd.	7D-046			Cc1ccc(COc2ccsc2C(=O)NN=C(N)S)cc1	InChI=1S/C14H15N3O2S2/c1-9-2-4-10(5-3-9)8-19-11-6-7-21-12(11)13(18)16-17-14(15)20/h2-7H,8H2,1H3,(H,16,18)(H3,15,17,20)	MTNMOZVPZJGTNU-UHFFFAOYSA-N	321.06056813							109616
2-(Methylamino)-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile	LSM-21045	SID26727202, BRD-K02769364	2726257	InChI=1S/C12H8F3N3S/c1-17-11-7(6-16)8(12(13,14)15)5-9(18-11)10-3-2-4-19-10/h2-5H,1H3,(H,17,18)	FFJWSMNUSHDPEA-UHFFFAOYSA-N	CNc1nc(cc(c1C#N)C(F)(F)F)c2cccs2	BroadT	BRD-K02769364	BRD-K02769364-001-05-2	Maybridge	RF 01020			CNc1nc(cc(c1C#N)C(F)(F)F)-c1cccs1	InChI=1S/C12H8F3N3S/c1-17-11-7(6-16)8(12(13,14)15)5-9(18-11)10-3-2-4-19-10/h2-5H,1H3,(H,17,18)	FFJWSMNUSHDPEA-UHFFFAOYSA-N	283.039102576							109617
STK345764	LSM-21046	SID4256785, BRD-K53459057	1091589	InChI=1S/C21H25N3O2/c1-3-20(25)22-17-8-10-18(11-9-17)23-12-14-24(15-13-23)21(26)19-7-5-4-6-16(19)2/h4-11H,3,12-15H2,1-2H3,(H,22,25)	PAUYPTCSCWPZSU-UHFFFAOYSA-N	CCC(=O)Nc1ccc(cc1)N2CCN(CC2)C(=O)c3ccccc3C	BroadT	BRD-K53459057	BRD-K53459057-001-05-0	ChemBridge Corporation	7856528			CCC(=O)Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccccc1C	InChI=1S/C21H25N3O2/c1-3-20(25)22-17-8-10-18(11-9-17)23-12-14-24(15-13-23)21(26)19-7-5-4-6-16(19)2/h4-11H,3,12-15H2,1-2H3,(H,22,25)	PAUYPTCSCWPZSU-UHFFFAOYSA-N	351.19467707							109618
T5344788	LSM-21047	SID3716241, BRD-K00272700	2565381	InChI=1S/C18H11FN4O4S/c19-12-4-1-10(2-5-12)16-21-20-15(26-16)8-28-18-23-22-17(27-18)11-3-6-13-14(7-11)25-9-24-13/h1-7H,8-9H2	FYWMFAYWSDLBRO-UHFFFAOYSA-N	Fc1ccc(cc1)c2oc(CSc3oc(nn3)c4ccc5OCOc5c4)nn2	BroadT	BRD-K00272700	BRD-K00272700-001-05-2	Enamine Ltd.	T5344788			Fc1ccc(cc1)-c1nnc(CSc2nnc(o2)-c2ccc3OCOc3c2)o1	InChI=1S/C18H11FN4O4S/c19-12-4-1-10(2-5-12)16-21-20-15(26-16)8-28-18-23-22-17(27-18)11-3-6-13-14(7-11)25-9-24-13/h1-7H,8-9H2	FYWMFAYWSDLBRO-UHFFFAOYSA-N	398.048503762							109619
AC1LKXMR	LSM-21048	BRD-K30626555	1100459	InChI=1S/C18H13N3O5/c22-16-7-2-1-6-15(16)18(23)20-19-11-14-8-9-17(26-14)12-4-3-5-13(10-12)21(24)25/h1-11,22H,(H,20,23)	SJETXPAPDOHMPR-UHFFFAOYSA-N	Oc1ccccc1C(=O)NN=Cc2oc(cc2)c3cccc(c3)[N+](=O)[O-]	BroadT	BRD-K30626555	BRD-K30626555-001-08-3	Asinex Ltd.	BAS 00392437			Oc1ccccc1C(=O)NN=Cc1ccc(o1)-c1cccc(c1)[N+]([O-])=O	InChI=1S/C18H13N3O5/c22-16-7-2-1-6-15(16)18(23)20-19-11-14-8-9-17(26-14)12-4-3-5-13(10-12)21(24)25/h1-11,22H,(H,20,23)	SJETXPAPDOHMPR-UHFFFAOYSA-N	351.085520546							109620
AC1NIMV5	LSM-21049	SID24834542, BRD-A60497270	4833565	InChI=1S/C18H28N2O4S/c1-4-14(2)16-5-7-17(8-6-16)25(23,24)20-11-9-19(10-12-20)15(3)13-18(21)22/h5-8,14-15H,4,9-13H2,1-3H3,(H,21,22)	LGMCGWLSDVQJAE-UHFFFAOYSA-N	CCC(C)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(C)CC(=O)O	BroadT	BRD-A60497270	BRD-A60497270-001-05-4	Enamine Ltd.	T5302390			CCC(C)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(C)CC(O)=O	InChI=1S/C18H28N2O4S/c1-4-14(2)16-5-7-17(8-6-16)25(23,24)20-11-9-19(10-12-20)15(3)13-18(21)22/h5-8,14-15H,4,9-13H2,1-3H3,(H,21,22)	LGMCGWLSDVQJAE-UHFFFAOYSA-N	368.176978086							109621
N-Benzyl-6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-amine	LSM-15321	BRD-K48298508	6460631	InChI=1S/C16H17N3S/c1-3-13-9-14-15(18-11(2)19-16(14)20-13)17-10-12-7-5-4-6-8-12/h4-9H,3,10H2,1-2H3,(H,17,18,19)	XMEMQJRLEKJRSV-UHFFFAOYSA-N	CCc1cc2c(NCc3ccccc3)nc(C)nc2s1	BroadT	BRD-K48298508	BRD-K48298508-003-05-1	ChemBridge Corporation	9027723		Cl	CCc1cc2c(NCc3ccccc3)nc(C)nc2s1.Cl	InChI=1S/C16H17N3S.ClH/c1-3-13-9-14-15(18-11(2)19-16(14)20-13)17-10-12-7-5-4-6-8-12;/h4-9H,3,10H2,1-2H3,(H,17,18,19);1H	JTHDDXPZNHLKKK-UHFFFAOYSA-N	283.114318264							103968, 103968
ASN 05984788	LSM-21050	SID843966, BRD-A21730004	646272	InChI=1S/C18H20ClN3O4S/c1-26-17-7-6-15(10-16(17)19)27(24,25)22-9-3-4-13(12-22)18(23)21-14-5-2-8-20-11-14/h2,5-8,10-11,13H,3-4,9,12H2,1H3,(H,21,23)	FOJPDRZHZMAXSQ-UHFFFAOYSA-N	COc1ccc(cc1Cl)S(=O)(=O)N2CCCC(C2)C(=O)Nc3cccnc3	BroadT	BRD-A21730004	BRD-A21730004-001-05-9	Asinex Ltd.	ASN 05984788			COc1ccc(cc1Cl)S(=O)(=O)N1CCCC(C1)C(=O)Nc1cccnc1	InChI=1S/C18H20ClN3O4S/c1-26-17-7-6-15(10-16(17)19)27(24,25)22-9-3-4-13(12-22)18(23)21-14-5-2-8-20-11-14/h2,5-8,10-11,13H,3-4,9,12H2,1H3,(H,21,23)	FOJPDRZHZMAXSQ-UHFFFAOYSA-N	409.08630455							109622
AC1N39OF	LSM-6516	EMF-SUMO1-1, SID49667485, BRD-A97833537	4084010	InChI=1S/C22H16ClFN2O2/c23-15-10-11-19-17(12-15)21(14-6-2-1-3-7-14)26(13-20(27)25-19)22(28)16-8-4-5-9-18(16)24/h1-12,21H,13H2,(H,25,27)	JVDNHGVLKRELPZ-UHFFFAOYSA-N	Fc1ccccc1C(=O)N2CC(=O)Nc3ccc(Cl)cc3C2c4ccccc4	BroadT	BRD-A97833537	BRD-A97833537-001-09-8	ChemDiv Inc.	C076-0680			Fc1ccccc1C(=O)N1CC(=O)Nc2ccc(Cl)cc2C1c1ccccc1	InChI=1S/C22H16ClFN2O2/c23-15-10-11-19-17(12-15)21(14-6-2-1-3-7-14)26(13-20(27)25-19)22(28)16-8-4-5-9-18(16)24/h1-12,21H,13H2,(H,25,27)	JVDNHGVLKRELPZ-UHFFFAOYSA-N	394.088433682							95218
AC1MIUOR	LSM-21051	SID17508011, BRD-A60059110	3101958	InChI=1S/C16H21Cl3N2O3S/c1-4-24-14(23)11-9-6-5-7-10(9)25-13(11)21-15(16(17,18)19)20-12(22)8(2)3/h8,15,21H,4-7H2,1-3H3,(H,20,22)	LUVINOPLWTUFRM-UHFFFAOYSA-N	CCOC(=O)c1c(NC(NC(=O)C(C)C)C(Cl)(Cl)Cl)sc2CCCc12	BroadT	BRD-A60059110	BRD-A60059110-001-06-4	Asinex Ltd.	BAS 00354902			CCOC(=O)c1c(NC(NC(=O)C(C)C)C(Cl)(Cl)Cl)sc2CCCc12	InChI=1S/C16H21Cl3N2O3S/c1-4-24-14(23)11-9-6-5-7-10(9)25-13(11)21-15(16(17,18)19)20-12(22)8(2)3/h8,15,21H,4-7H2,1-3H3,(H,20,22)	LUVINOPLWTUFRM-UHFFFAOYSA-N	426.033846372							109623
SMR000019641	LSM-21052	SID4244982, BRD-K98291134	2049312	InChI=1S/C13H12N4O/c1-8-3-4-11(9(2)5-8)17-12-10(6-16-17)13(18)15-7-14-12/h3-7H,1-2H3,(H,14,15,18)	AIQYAGCWQZIFBM-UHFFFAOYSA-N	Cc1ccc(c(C)c1)n2ncc3c(O)ncnc23	BroadT	BRD-K98291134	BRD-K98291134-001-05-1	ChemDiv Inc.	5228-4099			Cc1ccc(c(C)c1)-n1ncc2c(O)ncnc12	InChI=1S/C13H12N4O/c1-8-3-4-11(9(2)5-8)17-12-10(6-16-17)13(18)15-7-14-12/h3-7H,1-2H3,(H,14,15,18)	AIQYAGCWQZIFBM-UHFFFAOYSA-N	240.101111044							
MLS000553526	LSM-21053	BRD-A62612258	3117079	InChI=1S/C23H15Cl2N5OS/c1-13-20(21(16(10-26)11-27)15-4-8-18(25)9-5-15)22(31)30(29-13)23-28-12-19(32-23)14-2-6-17(24)7-3-14/h2-9,12,16,21,31H,1H3	FPGNZUBEOPRKFS-UHFFFAOYSA-N	Cc1nn(c(O)c1C(C(C#N)C#N)c2ccc(Cl)cc2)c3ncc(s3)c4ccc(Cl)cc4	BroadT	BRD-A62612258	BRD-A62612258-001-06-0	Asinex Ltd.	BAS 00732708			Cc1nn(-c2ncc(s2)-c2ccc(Cl)cc2)c(O)c1C(C(C#N)C#N)c1ccc(Cl)cc1	InChI=1S/C23H15Cl2N5OS/c1-13-20(21(16(10-26)11-27)15-4-8-18(25)9-5-15)22(31)30(29-13)23-28-12-19(32-23)14-2-6-17(24)7-3-14/h2-9,12,16,21,31H,1H3	FPGNZUBEOPRKFS-UHFFFAOYSA-N	479.03743626							
T5221129	LSM-21054	SID26670160, BRD-K43016568	3908773	InChI=1S/C22H18N2O9S/c1-32-15-8-6-14(7-9-15)21(26)13-33-22(27)17-4-2-3-5-18(17)23-34(30,31)16-10-11-20(25)19(12-16)24(28)29/h2-12,23,25H,13H2,1H3	PWAJCFGQHHRUJH-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)COC(=O)c2ccccc2NS(=O)(=O)c3ccc(O)c(c3)[N+](=O)[O-]	BroadT	BRD-K43016568	BRD-K43016568-001-05-3	Enamine Ltd.	T5221129			COc1ccc(cc1)C(=O)COC(=O)c1ccccc1NS(=O)(=O)c1ccc(O)c(c1)[N+]([O-])=O	InChI=1S/C22H18N2O9S/c1-32-15-8-6-14(7-9-15)21(26)13-33-22(27)17-4-2-3-5-18(17)23-34(30,31)16-10-11-20(25)19(12-16)24(28)29/h2-12,23,25H,13H2,1H3	PWAJCFGQHHRUJH-UHFFFAOYSA-N	486.073300866							109626
AC1LFTVM	LSM-21055	SID17411684, BRD-K94872534	783786	InChI=1S/C19H31NO/c1-19(2,3)16-9-11-17(12-10-16)20-14-13-15-7-5-6-8-18(15)21-4/h5-8,16-17,20H,9-14H2,1-4H3	WHIGUJZLRRODIW-UHFFFAOYSA-N	COc1ccccc1CCNC2CCC(CC2)C(C)(C)C	BroadT	BRD-K94872534	BRD-K94872534-001-06-6	ChemBridge Corporation	5452386			COc1ccccc1CCNC1CCC(CC1)C(C)(C)C	InChI=1S/C19H31NO/c1-19(2,3)16-9-11-17(12-10-16)20-14-13-15-7-5-6-8-18(15)21-4/h5-8,16-17,20H,9-14H2,1-4H3	WHIGUJZLRRODIW-UHFFFAOYSA-N	289.240564622							109627
ZINC00060445	LSM-21056	BRD-K66609220	6739238	InChI=1S/C19H21N3O3/c1-3-7-14-8-6-9-15(19(14)24)12-21-22-18(23)13-20-16-10-4-5-11-17(16)25-2/h3-6,8-12,20,24H,1,7,13H2,2H3,(H,22,23)	FCTBQQCTKGINNH-UHFFFAOYSA-N	COc1ccccc1NCC(=O)NN=Cc2cccc(CC=C)c2O	BroadT	BRD-K66609220	BRD-K66609220-001-07-3	ChemDiv Inc.	1761-0345			COc1ccccc1NCC(=O)NN=Cc1cccc(CC=C)c1O	InChI=1S/C19H21N3O3/c1-3-7-14-8-6-9-15(19(14)24)12-21-22-18(23)13-20-16-10-4-5-11-17(16)25-2/h3-6,8-12,20,24H,1,7,13H2,2H3,(H,22,23)	FCTBQQCTKGINNH-UHFFFAOYSA-N	339.158291562							
STK225359	LSM-21057	SID24797379, BRD-K68619066	1304852	InChI=1S/C19H21NO7/c1-23-12-6-11(7-13(8-12)24-2)18(21)20-15-10-17(26-4)16(25-3)9-14(15)19(22)27-5/h6-10H,1-5H3,(H,20,21)	PHDLCFJTWAUHTC-UHFFFAOYSA-N	COC(=O)c1cc(OC)c(OC)cc1NC(=O)c2cc(OC)cc(OC)c2	BroadT	BRD-K68619066	BRD-K68619066-001-06-9	ChemBridge Corporation	7391579			COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cc(OC)cc(OC)c1	InChI=1S/C19H21NO7/c1-23-12-6-11(7-13(8-12)24-2)18(21)20-15-10-17(26-4)16(25-3)9-14(15)19(22)27-5/h6-10H,1-5H3,(H,20,21)	PHDLCFJTWAUHTC-UHFFFAOYSA-N	375.131802022							109629
AC1LW7SC	LSM-21058	BRD-K34662997	1719972	InChI=1S/C26H23Cl2N3O4/c1-26(2,3)25(34)30-19-11-8-16(9-12-19)23(32)31-29-15-17-6-4-5-7-22(17)35-24(33)20-13-10-18(27)14-21(20)28/h4-15H,1-3H3,(H,30,34)(H,31,32)	VMRMXLSQHMRHLT-UHFFFAOYSA-N	CC(C)(C)C(=O)Nc1ccc(cc1)C(=O)NN=Cc2ccccc2OC(=O)c3ccc(Cl)cc3Cl	BroadT	BRD-K34662997	BRD-K34662997-001-05-6	Asinex Ltd.	BAS 00394770			CC(C)(C)C(=O)Nc1ccc(cc1)C(=O)NN=Cc1ccccc1OC(=O)c1ccc(Cl)cc1Cl	InChI=1S/C26H23Cl2N3O4/c1-26(2,3)25(34)30-19-11-8-16(9-12-19)23(32)31-29-15-17-6-4-5-7-22(17)35-24(33)20-13-10-18(27)14-21(20)28/h4-15H,1-3H3,(H,30,34)(H,31,32)	VMRMXLSQHMRHLT-UHFFFAOYSA-N	511.106561666							109630
SMR000148691	LSM-21059	SID14742799, BRD-A49233126	4208156	InChI=1S/C27H37N3O2/c1-3-29(4-2)23-15-13-21(14-16-23)26-24-12-8-9-17-27(24,32)18-19-30(26)20-25(31)28-22-10-6-5-7-11-22/h5-7,10-11,13-16,24,26,32H,3-4,8-9,12,17-20H2,1-2H3,(H,28,31)	JLTGEHTYNHUIRG-UHFFFAOYSA-N	CCN(CC)c1ccc(cc1)C2C3CCCCC3(O)CCN2CC(=O)Nc4ccccc4	BroadT	BRD-A49233126	BRD-A49233126-001-05-5	InterBioScreen Ltd.	STOCK4S-61990			CCN(CC)c1ccc(cc1)C1C2CCCCC2(O)CCN1CC(=O)Nc1ccccc1	InChI=1S/C27H37N3O2/c1-3-29(4-2)23-15-13-21(14-16-23)26-24-12-8-9-17-27(24,32)18-19-30(26)20-25(31)28-22-10-6-5-7-11-22/h5-7,10-11,13-16,24,26,32H,3-4,8-9,12,17-20H2,1-2H3,(H,28,31)	JLTGEHTYNHUIRG-UHFFFAOYSA-N	435.288577454							109631
HMS2653O21	LSM-21060	BRD-K61065756	16194186	InChI=1S/C24H24N4O5/c1-14-8-19(13-25-26-22(29)16-6-5-7-20(10-16)27(3)4)15(2)28(14)21-11-17(23(30)31)9-18(12-21)24(32)33/h5-13H,1-4H3,(H,26,29)(H,30,31)(H,32,33)	IGIJYSJRSGLAGQ-UHFFFAOYSA-N	CN(C)c1cccc(c1)C(=O)NN=Cc2cc(C)n(c2C)c3cc(cc(c3)C(=O)O)C(=O)O	BroadT	BRD-K61065756	BRD-K61065756-001-05-9	ChemDiv Inc.	4764-3576			CN(C)c1cccc(c1)C(=O)NN=Cc1cc(C)n(c1C)-c1cc(cc(c1)C(O)=O)C(O)=O	InChI=1S/C24H24N4O5/c1-14-8-19(13-25-26-22(29)16-6-5-7-20(10-16)27(3)4)15(2)28(14)21-11-17(23(30)31)9-18(12-21)24(32)33/h5-13H,1-4H3,(H,26,29)(H,30,31)(H,32,33)	IGIJYSJRSGLAGQ-UHFFFAOYSA-N	448.174669908							109632
SMR000041048	LSM-21061	SID858854, BRD-K82837100	660161	InChI=1S/C26H30N4O3/c1-18-2-4-22-20(12-18)21-15-30(7-6-23(21)27-22)26(31)16-29-10-8-28(9-11-29)14-19-3-5-24-25(13-19)33-17-32-24/h2-5,12-13,27H,6-11,14-17H2,1H3	CXBSZNOKLYYNQU-UHFFFAOYSA-N	Cc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)CN4CCN(Cc5ccc6OCOc6c5)CC4	BroadT	BRD-K82837100	BRD-K82837100-001-05-9	InterBioScreen Ltd.	STOCK2S-69118			Cc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)CN1CCN(Cc2ccc3OCOc3c2)CC1	InChI=1S/C26H30N4O3/c1-18-2-4-22-20(12-18)21-15-30(7-6-23(21)27-22)26(31)16-29-10-8-28(9-11-29)14-19-3-5-24-25(13-19)33-17-32-24/h2-5,12-13,27H,6-11,14-17H2,1H3	CXBSZNOKLYYNQU-UHFFFAOYSA-N	446.23179086							109633
AC1LD15Y	LSM-21062	SID858218, BRD-A32435422	659565	InChI=1S/C18H18N2O2/c1-20-12-11-19-18(20)17(21)15-7-9-16(10-8-15)22-13-14-5-3-2-4-6-14/h2-12,17,21H,13H2,1H3	DUQGHXKEIJQUTQ-UHFFFAOYSA-N	Cn1ccnc1C(O)c2ccc(OCc3ccccc3)cc2	BroadT	BRD-A32435422	BRD-A32435422-001-05-6	InterBioScreen Ltd.	STOCK2S-30412			Cn1ccnc1C(O)c1ccc(OCc2ccccc2)cc1	InChI=1S/C18H18N2O2/c1-20-12-11-19-18(20)17(21)15-7-9-16(10-8-15)22-13-14-5-3-2-4-6-14/h2-12,17,21H,13H2,1H3	DUQGHXKEIJQUTQ-UHFFFAOYSA-N	294.136827836							109634
ZINC04661958	LSM-21063	SID17412614, BRD-K10651801	2851314	InChI=1S/C19H30N2O2S/c1-16-8-17(2)10-18(3,9-16)13-19(11-16,12-17)14(22)20-15(24)21-4-6-23-7-5-21/h4-13H2,1-3H3,(H,20,22,24)	WTOMJIJRSMZRED-UHFFFAOYSA-N	CC12CC3(C)CC(C)(C1)CC(C3)(C2)C(=O)NC(=S)N4CCOCC4	BroadT	BRD-K10651801	BRD-K10651801-001-05-3	ChemBridge Corporation	5542961			CC12CC3(C)CC(C)(C1)CC(C2)(C3)C(=O)NC(=S)N1CCOCC1	InChI=1S/C19H30N2O2S/c1-16-8-17(2)10-18(3,9-16)13-19(11-16,12-17)14(22)20-15(24)21-4-6-23-7-5-21/h4-13H2,1-3H3,(H,20,22,24)	WTOMJIJRSMZRED-UHFFFAOYSA-N	350.20279891							109635
SMR000023723	LSM-21064	SID4249543, BRD-K33998880	3243483	InChI=1S/C21H21N3O3S/c1-23-17-8-4-3-7-15(17)18-16(20(25)22-12-14-6-5-11-28-14)13-24(9-10-27-2)21(26)19(18)23/h3-8,11,13H,9-10,12H2,1-2H3,(H,22,25)	MDEDRWLOWXJCQI-UHFFFAOYSA-N	COCCN1C=C(C(=O)NCc2cccs2)c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K33998880	BRD-K33998880-001-05-5	ChemDiv Inc.	C237-1218			COCCn1cc(C(=O)NCc2cccs2)c2c3ccccc3n(C)c2c1=O	InChI=1S/C21H21N3O3S/c1-23-17-8-4-3-7-15(17)18-16(20(25)22-12-14-6-5-11-28-14)13-24(9-10-27-2)21(26)19(18)23/h3-8,11,13H,9-10,12H2,1-2H3,(H,22,25)	MDEDRWLOWXJCQI-UHFFFAOYSA-N	395.130362252							109636
SMR000041125	LSM-21065	SID858909, BRD-K52808536	660211	InChI=1S/C22H23ClN4O3/c1-30-22(29)21-20(17-7-2-3-8-18(17)24-21)25-19(28)14-26-9-11-27(12-10-26)16-6-4-5-15(23)13-16/h2-8,13,24H,9-12,14H2,1H3,(H,25,28)	YJLAGRNZXPNFEG-UHFFFAOYSA-N	COC(=O)c1[nH]c2ccccc2c1NC(=O)CN3CCN(CC3)c4cccc(Cl)c4	BroadT	BRD-K52808536	BRD-K52808536-001-05-0	InterBioScreen Ltd.	STOCK2S-77141			COC(=O)c1[nH]c2ccccc2c1NC(=O)CN1CCN(CC1)c1cccc(Cl)c1	InChI=1S/C22H23ClN4O3/c1-30-22(29)21-20(17-7-2-3-8-18(17)24-21)25-19(28)14-26-9-11-27(12-10-26)16-6-4-5-15(23)13-16/h2-8,13,24H,9-12,14H2,1H3,(H,25,28)	YJLAGRNZXPNFEG-UHFFFAOYSA-N	426.145868346							109637
SMR000184316	LSM-21066	SID17432531, BRD-K22827270	2827046	InChI=1S/C27H31Cl3N2O4/c28-24-4-2-1-3-21(24)27(22-7-5-19(17-25(22)29)31(9-13-33)10-14-34)23-8-6-20(18-26(23)30)32(11-15-35)12-16-36/h1-8,17-18,27,33-36H,9-16H2	VLCFEOVOOOOSGK-UHFFFAOYSA-N	OCCN(CCO)c1ccc(C(c2ccccc2Cl)c3ccc(cc3Cl)N(CCO)CCO)c(Cl)c1	BroadT	BRD-K22827270	BRD-K22827270-001-07-3	ChemBridge Corporation	5102813			OCCN(CCO)c1ccc(C(c2ccccc2Cl)c2ccc(cc2Cl)N(CCO)CCO)c(Cl)c1	InChI=1S/C27H31Cl3N2O4/c28-24-4-2-1-3-21(24)27(22-7-5-19(17-25(22)29)31(9-13-33)10-14-34)23-8-6-20(18-26(23)30)32(11-15-35)12-16-36/h1-8,17-18,27,33-36H,9-16H2	VLCFEOVOOOOSGK-UHFFFAOYSA-N	552.134940622							109638
T5317505	LSM-21067	SID24833362, BRD-K60922735	4965392	InChI=1S/C14H19N5O3S3/c1-3-19(4-2)25(21,22)11-7-5-6-10(8-11)16-12(20)9-23-14-18-17-13(15)24-14/h5-8H,3-4,9H2,1-2H3,(H2,15,17)(H,16,20)	ANNXJQNNQXTYRF-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1cccc(NC(=O)CSc2nnc(N)s2)c1	BroadT	BRD-K60922735	BRD-K60922735-001-05-8	Enamine Ltd.	T5317505			CCN(CC)S(=O)(=O)c1cccc(NC(=O)CSc2nnc(N)s2)c1	InChI=1S/C14H19N5O3S3/c1-3-19(4-2)25(21,22)11-7-5-6-10(8-11)16-12(20)9-23-14-18-17-13(15)24-14/h5-8H,3-4,9H2,1-2H3,(H2,15,17)(H,16,20)	ANNXJQNNQXTYRF-UHFFFAOYSA-N	401.065001588							109639
AC1MDGG0	LSM-21068	BRD-K99176207	2789183	InChI=1S/C9H9N5O2/c1-6-2-3-7(16-6)4-10-13-8-5-11-14-9(15)12-8/h2-5H,1H3,(H2,12,13,14,15)	VKRGPDJCPFGKHB-UHFFFAOYSA-N	Cc1oc(C=NNc2cnnc(O)n2)cc1	BroadT	BRD-K99176207	BRD-K99176207-001-05-5	ChemDiv Inc.	3232-1821			Cc1ccc(C=NNc2cnnc(O)n2)o1	InChI=1S/C9H9N5O2/c1-6-2-3-7(16-6)4-10-13-8-5-11-14-9(15)12-8/h2-5H,1H3,(H2,12,13,14,15)	VKRGPDJCPFGKHB-UHFFFAOYSA-N	219.075624578							109640
SMR000242874	LSM-21069	SID22409102, BRD-K93825118	2683950	InChI=1S/C26H23NO6S/c1-4-27(20-8-6-5-7-9-20)34(30,31)24-15-19(11-10-17(24)2)26(29)32-21-12-13-22-18(3)14-25(28)33-23(22)16-21/h5-16H,4H2,1-3H3	SFHITDRPAVZIPO-UHFFFAOYSA-N	CCN(c1ccccc1)S(=O)(=O)c2cc(ccc2C)C(=O)Oc3ccc4C(=CC(=O)Oc4c3)C	BroadT	BRD-K93825118	BRD-K93825118-001-05-1	Enamine Ltd.	ZT-2191967			CCN(c1ccccc1)S(=O)(=O)c1cc(ccc1C)C(=O)Oc1ccc2c(C)cc(=O)oc2c1	InChI=1S/C26H23NO6S/c1-4-27(20-8-6-5-7-9-20)34(30,31)24-15-19(11-10-17(24)2)26(29)32-21-12-13-22-18(3)14-25(28)33-23(22)16-21/h5-16H,4H2,1-3H3	SFHITDRPAVZIPO-UHFFFAOYSA-N	477.124608156							109641
CBDIVE_008987	LSM-21070	SID26663133, BRD-A23283632	2836557	InChI=1S/C21H19BrN4O4S2/c22-12-5-3-11(4-6-12)13(14-16(27)23-20-25(18(14)29)7-1-9-31-20)15-17(28)24-21-26(19(15)30)8-2-10-32-21/h3-6,13,27,30H,1-2,7-10H2	MRCWYWRZBAWCHH-UHFFFAOYSA-N	OC1=C(C(C2=C(O)N3CCCSC3=NC2=O)c4ccc(Br)cc4)C(=O)N5CCCSC5=N1	BroadT	BRD-A23283632	BRD-A23283632-001-05-7	InterBioScreen Ltd.	STOCK1S-21771			Oc1nc2SCCCn2c(=O)c1C(c1ccc(Br)cc1)c1c(O)n2CCCSc2nc1=O	InChI=1S/C21H19BrN4O4S2/c22-12-5-3-11(4-6-12)13(14-16(27)23-20-25(18(14)29)7-1-9-31-20)15-17(28)24-21-26(19(15)30)8-2-10-32-21/h3-6,13,27,30H,1-2,7-10H2	MRCWYWRZBAWCHH-UHFFFAOYSA-N	534.003109108							
SMR000193307	LSM-21071	SID17413251, BRD-A48027948	2870823	InChI=1S/C17H18N2O4/c20-16(18-19-17(21)15-9-4-10-22-15)11-23-14-8-3-6-12-5-1-2-7-13(12)14/h1-3,5-8,15H,4,9-11H2,(H,18,20)(H,19,21)	YNLGEOOSIKTHMM-UHFFFAOYSA-N	O=C(COc1cccc2ccccc12)NNC(=O)C3CCCO3	BroadT	BRD-A48027948	BRD-A48027948-001-05-8	ChemBridge Corporation	5813155			O=C(COc1cccc2ccccc12)NNC(=O)C1CCCO1	InChI=1S/C17H18N2O4/c20-16(18-19-17(21)15-9-4-10-22-15)11-23-14-8-3-6-12-5-1-2-7-13(12)14/h1-3,5-8,15H,4,9-11H2,(H,18,20)(H,19,21)	YNLGEOOSIKTHMM-UHFFFAOYSA-N	314.126657076							109643
BAS 00473199	LSM-15322	BRD-K18391050	830271	InChI=1S/C19H19N5O/c1-13-18(19(25)24(23(13)2)14-8-4-3-5-9-14)20-12-17-21-15-10-6-7-11-16(15)22-17/h3-11,20H,12H2,1-2H3,(H,21,22)	UDDKKSYJXXGONM-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)NCc2nc3ccccc3[nH]2)c4ccccc4	BroadT	BRD-K18391050	BRD-K18391050-003-05-2	Enamine Ltd.	T0504-2846		Cl	Cc1c(NCc2nc3ccccc3[nH]2)c(=O)n(-c2ccccc2)n1C.Cl	InChI=1S/C19H19N5O.ClH/c1-13-18(19(25)24(23(13)2)14-8-4-3-5-9-14)20-12-17-21-15-10-6-7-11-16(15)22-17;/h3-11,20H,12H2,1-2H3,(H,21,22);1H	RBRUNMCBCIQEMB-UHFFFAOYSA-N	333.158960278							103969, 103969
ASN 06873838	LSM-21072	SID848620, BRD-K77321821	651073	InChI=1S/C17H17FN2O3/c18-15-5-1-3-13(9-15)11-20(16(21)6-7-17(22)23)12-14-4-2-8-19-10-14/h1-5,8-10H,6-7,11-12H2,(H,22,23)	CLTYJNKBJYAQSI-UHFFFAOYSA-N	OC(=O)CCC(=O)N(Cc1cccnc1)Cc2cccc(F)c2	BroadT	BRD-K77321821	BRD-K77321821-001-05-9	Asinex Ltd.	ASN 06873838			OC(=O)CCC(=O)N(Cc1cccnc1)Cc1cccc(F)c1	InChI=1S/C17H17FN2O3/c18-15-5-1-3-13(9-15)11-20(16(21)6-7-17(22)23)12-14-4-2-8-19-10-14/h1-5,8-10H,6-7,11-12H2,(H,22,23)	CLTYJNKBJYAQSI-UHFFFAOYSA-N	316.122320624							109644
MLS000113457	LSM-21073	SID7978146, BRD-K72732970	804965	InChI=1S/C15H10O4S/c1-9(16)14-13(10-5-2-3-7-12(10)20-14)19-15(17)11-6-4-8-18-11/h2-8H,1H3	MYLXADGEQWLSJF-UHFFFAOYSA-N	CC(=O)c1sc2ccccc2c1OC(=O)c3occc3	BroadT	BRD-K72732970	BRD-K72732970-001-05-1	ChemBridge Corporation	7113945			CC(=O)c1sc2ccccc2c1OC(=O)c1ccco1	InChI=1S/C15H10O4S/c1-9(16)14-13(10-5-2-3-7-12(10)20-14)19-15(17)11-6-4-8-18-11/h2-8H,1H3	MYLXADGEQWLSJF-UHFFFAOYSA-N	286.02997949							109645
ENAMINE_001167	LSM-21074	SID22409523, BRD-K58853364	2322492	InChI=1S/C16H13ClN2OS/c1-9-3-5-12(7-10(9)2)18-16(20)15-13-8-11(17)4-6-14(13)19-21-15/h3-8H,1-2H3,(H,18,20)	FAXNSPPOTHZMIX-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2snc3ccc(Cl)cc23)cc1C	BroadT	BRD-K58853364	BRD-K58853364-001-05-7	Enamine Ltd.	T0504-1758			Cc1ccc(NC(=O)c2snc3ccc(Cl)cc23)cc1C	InChI=1S/C16H13ClN2OS/c1-9-3-5-12(7-10(9)2)18-16(20)15-13-8-11(17)4-6-14(13)19-21-15/h3-8H,1-2H3,(H,18,20)	FAXNSPPOTHZMIX-UHFFFAOYSA-N	316.043711456							109646
F2018-5080	LSM-15323	BRD-K22511543	24892506	InChI=1S/C24H31N3O3S2/c1-5-26(6-2)13-14-27(24-25-23-19(4)16-18(3)17-21(23)31-24)22(28)12-15-32(29,30)20-10-8-7-9-11-20/h7-11,16-17H,5-6,12-15H2,1-4H3	TYWFUHXAJCCBFU-UHFFFAOYSA-N	CCN(CC)CCN(C(=O)CCS(=O)(=O)c1ccccc1)c2nc3c(C)cc(C)cc3s2	BroadT	BRD-K22511543	BRD-K22511543-003-06-2	Life Chemicals Inc.	F2018-5080		Cl	CCN(CC)CCN(C(=O)CCS(=O)(=O)c1ccccc1)c1nc2c(C)cc(C)cc2s1.Cl	InChI=1S/C24H31N3O3S2.ClH/c1-5-26(6-2)13-14-27(24-25-23-19(4)16-18(3)17-21(23)31-24)22(28)12-15-32(29,30)20-10-8-7-9-11-20;/h7-11,16-17H,5-6,12-15H2,1-4H3;1H	WJGPNKPTVURVBT-UHFFFAOYSA-N	473.180683262							103970, 103970
SMR000061066	LSM-21075	SID3714454, BRD-A72651344	2998807	InChI=1S/C23H19N3O2S/c27-21-16-29-23(25(21)14-19-12-7-13-28-19)20-15-26(18-10-5-2-6-11-18)24-22(20)17-8-3-1-4-9-17/h1-13,15,23H,14,16H2	UNEPQNSJOQNWJW-UHFFFAOYSA-N	O=C1CSC(N1Cc2occc2)c3cn(nc3c4ccccc4)c5ccccc5	BroadT	BRD-A72651344	BRD-A72651344-001-05-4	Enamine Ltd.	T0506-3884			O=C1CSC(N1Cc1ccco1)c1cn(nc1-c1ccccc1)-c1ccccc1	InChI=1S/C23H19N3O2S/c27-21-16-29-23(25(21)14-19-12-7-13-28-19)20-15-26(18-10-5-2-6-11-18)24-22(20)17-8-3-1-4-9-17/h1-13,15,23H,14,16H2	UNEPQNSJOQNWJW-UHFFFAOYSA-N	401.119797568							109647
SMR000080080	LSM-21076	SID4256742, BRD-K61519207	1242987	InChI=1S/C15H14BrClN2O2/c16-13-7-6-12(21-13)15(20)18-11-5-3-4-10(17)14(11)19-8-1-2-9-19/h3-7H,1-2,8-9H2,(H,18,20)	HQQJPMDLXCJWKU-UHFFFAOYSA-N	Clc1cccc(NC(=O)c2oc(Br)cc2)c1N3CCCC3	BroadT	BRD-K61519207	BRD-K61519207-001-07-6	ChemBridge Corporation	7941122			Clc1cccc(NC(=O)c2ccc(Br)o2)c1N1CCCC1	InChI=1S/C15H14BrClN2O2/c16-13-7-6-12(21-13)15(20)18-11-5-3-4-10(17)14(11)19-8-1-2-9-19/h3-7H,1-2,8-9H2,(H,18,20)	HQQJPMDLXCJWKU-UHFFFAOYSA-N	367.992718018							109648
AC1OAR7P	LSM-21077	BRD-K65907256	6834114	InChI=1S/C21H16BrN5O2/c1-28-20-8-3-2-7-17(20)18-13-24-27-21(25-18)26-23-12-16-9-10-19(29-16)14-5-4-6-15(22)11-14/h2-13H,1H3,(H,25,26,27)	RCFJOTXEXWEBHO-UHFFFAOYSA-N	COc1ccccc1c2cnnc(NN=Cc3oc(cc3)c4cccc(Br)c4)n2	BroadT	BRD-K65907256	BRD-K65907256-001-05-3	Specs	AN-655/14411048			COc1ccccc1-c1cnnc(NN=Cc2ccc(o2)-c2cccc(Br)c2)n1	InChI=1S/C21H16BrN5O2/c1-28-20-8-3-2-7-17(20)18-13-24-27-21(25-18)26-23-12-16-9-10-19(29-16)14-5-4-6-15(22)11-14/h2-13H,1H3,(H,25,26,27)	RCFJOTXEXWEBHO-UHFFFAOYSA-N	449.048737402							109649
SMR000178575	LSM-2708	BRD-K32644160, SID17410558, SID87218802	1090779	InChI=1S/C17H12N4S/c1-2-6-14-12(4-1)5-3-7-15(14)19-17-21-20-16(22-17)13-8-10-18-11-9-13/h1-11H,(H,19,21)	FNNACNWDEVQPDH-UHFFFAOYSA-N	N(c1cccc2ccccc12)c3nnc(s3)c4ccncc4	BroadT	BRD-K32644160	BRD-K32644160-001-12-3	Asinex Ltd.	BAS 07778946			N(c1nnc(s1)-c1ccncc1)c1cccc2ccccc12	InChI=1S/C17H12N4S/c1-2-6-14-12(4-1)5-3-7-15(14)19-17-21-20-16(22-17)13-8-10-18-11-9-13/h1-11H,(H,19,21)	FNNACNWDEVQPDH-UHFFFAOYSA-N	304.078267114							92565
HMS2997B08	LSM-21078	BRD-K27489218	24818575	InChI=1S/C23H18FN3O3/c24-18-5-3-4-15(8-18)13-27-14-17(21-6-1-2-7-22(21)27)12-25-26-23(30)16-9-19(28)11-20(29)10-16/h1-12,14,28-29H,13H2,(H,26,30)	WVVKNKDBZMZCCR-UHFFFAOYSA-N	Oc1cc(O)cc(c1)C(=O)NN=Cc2cn(Cc3cccc(F)c3)c4ccccc24	BroadT	BRD-K27489218	BRD-K27489218-001-05-6	Chemical Technologies & Investigations	DBZA-064104			Oc1cc(O)cc(c1)C(=O)NN=Cc1cn(Cc2cccc(F)c2)c2ccccc12	InChI=1S/C23H18FN3O3/c24-18-5-3-4-15(8-18)13-27-14-17(21-6-1-2-7-22(21)27)12-25-26-23(30)16-9-19(28)11-20(29)10-16/h1-12,14,28-29H,13H2,(H,26,30)	WVVKNKDBZMZCCR-UHFFFAOYSA-N	403.133219666							109650
STK392665	LSM-43913	SID49645449, BRD-K34778556	1369404	InChI=1S/C19H13Cl2NO4S2/c20-13-5-4-12(15(21)8-13)10-26-14-3-1-2-11(6-14)7-16-18(25)22(9-17(23)24)19(27)28-16/h1-8H,9-10H2,(H,23,24)/b16-7+	OLZVBHXSBXOAJU-FRKPEAEDSA-N	OC(=O)CN1C(=S)S\C(=C\c2cccc(OCc3ccc(Cl)cc3Cl)c2)\C1=O	BroadT	BRD-K34778556	BRD-K34778556-001-06-1	Asinex Ltd.	BAS 00469177			OC(=O)CN1C(=S)S\C(=C\c2cccc(OCc3ccc(Cl)cc3Cl)c2)C1=O	InChI=1S/C19H13Cl2NO4S2/c20-13-5-4-12(15(21)8-13)10-26-14-3-1-2-11(6-14)7-16-18(25)22(9-17(23)24)19(27)28-16/h1-8H,9-10H2,(H,23,24)/b16-7+	OLZVBHXSBXOAJU-FRKPEAEDSA-N	452.966304706							
SMR000063305	LSM-21080	SID3712194, BRD-K03805184	2095897	InChI=1S/C19H21NO4/c1-13-6-8-20(9-7-13)18(22)12-24-19(23)16-10-14-4-2-3-5-15(14)11-17(16)21/h2-5,10-11,13,21H,6-9,12H2,1H3	FNJJBUJUTCSQHD-UHFFFAOYSA-N	CC1CCN(CC1)C(=O)COC(=O)c2cc3ccccc3cc2O	BroadT	BRD-K03805184	BRD-K03805184-001-05-1	Enamine Ltd.	T5229607			CC1CCN(CC1)C(=O)COC(=O)c1cc2ccccc2cc1O	InChI=1S/C19H21NO4/c1-13-6-8-20(9-7-13)18(22)12-24-19(23)16-10-14-4-2-3-5-15(14)11-17(16)21/h2-5,10-11,13,21H,6-9,12H2,1H3	FNJJBUJUTCSQHD-UHFFFAOYSA-N	327.147058162							109652
MLS000053467	LSM-21081	SID3717723, SID24840013, BRD-K10870310	2121076	InChI=1S/C21H21N3O5S3/c22-20(26)16-13-17(14-4-2-1-3-5-14)31-21(16)23-18(25)12-15-6-7-19(30-15)32(27,28)24-8-10-29-11-9-24/h1-7,13H,8-12H2,(H2,22,26)(H,23,25)	MSYCTQCXKWCEQM-UHFFFAOYSA-N	NC(=O)c1cc(sc1NC(=O)Cc2ccc(s2)S(=O)(=O)N3CCOCC3)c4ccccc4	BroadT	BRD-K10870310	BRD-K10870310-001-05-3	Enamine Ltd.	T5248345			NC(=O)c1cc(sc1NC(=O)Cc1ccc(s1)S(=O)(=O)N1CCOCC1)-c1ccccc1	InChI=1S/C21H21N3O5S3/c22-20(26)16-13-17(14-4-2-1-3-5-14)31-21(16)23-18(25)12-15-6-7-19(30-15)32(27,28)24-8-10-29-11-9-24/h1-7,13H,8-12H2,(H2,22,26)(H,23,25)	MSYCTQCXKWCEQM-UHFFFAOYSA-N	491.064332872							109653
ST50832564	LSM-21082	SID17407010, SID56373485, BRD-K45144245	998878	InChI=1S/C14H14BrN3O2S/c1-8-3-4-9(2)10(7-8)16-14(21)18-17-13(19)11-5-6-12(15)20-11/h3-7H,1-2H3,(H,17,19)(H2,16,18,21)	ZBCDIULMPGHKDR-UHFFFAOYSA-N	Cc1ccc(C)c(NC(=NNC(=O)c2oc(Br)cc2)S)c1	BroadT	BRD-K45144245	BRD-K45144245-001-05-2	Specs	AK-968/41923360			Cc1ccc(C)c(NC(S)=NNC(=O)c2ccc(Br)o2)c1	InChI=1S/C14H14BrN3O2S/c1-8-3-4-9(2)10(7-8)16-14(21)18-17-13(19)11-5-6-12(15)20-11/h3-7H,1-2H3,(H,17,19)(H2,16,18,21)	ZBCDIULMPGHKDR-UHFFFAOYSA-N	366.999010008							109654
73942-87-7	LSM-21083	SID24820604, BRD-K64001752	1482373	InChI=1S/C12H13NO3/c1-15-10-5-8-3-4-13-12(14)7-9(8)6-11(10)16-2/h3-6H,7H2,1-2H3,(H,13,14)	CPNZASIAJKSBBH-UHFFFAOYSA-N	COc1cc2CC(=O)NC=Cc2cc1OC	BroadT	BRD-K64001752	BRD-K64001752-001-05-5	Key Organics Ltd.	6X-0944			COc1cc2CC(=O)NC=Cc2cc1OC	InChI=1S/C12H13NO3/c1-15-10-5-8-3-4-13-12(14)7-9(8)6-11(10)16-2/h3-6H,7H2,1-2H3,(H,13,14)	CPNZASIAJKSBBH-UHFFFAOYSA-N	219.089543286							109655
SMR000028327	LSM-21084	SID4248904, BRD-K37552761	3242922	InChI=1S/C24H18ClN5O2/c1-14-21(28-24-26-11-6-12-30(14)24)16-7-5-8-17(13-16)27-23(31)20-15(2)32-29-22(20)18-9-3-4-10-19(18)25/h3-13H,1-2H3,(H,27,31)	JIOKYSCECFYDKL-UHFFFAOYSA-N	Cc1onc(c2ccccc2Cl)c1C(=O)Nc3cccc(c3)c4nc5ncccn5c4C	BroadT	BRD-K37552761	BRD-K37552761-001-06-8	ChemDiv Inc.	C638-0397			Cc1onc(c1C(=O)Nc1cccc(c1)-c1nc2ncccn2c1C)-c1ccccc1Cl	InChI=1S/C24H18ClN5O2/c1-14-21(28-24-26-11-6-12-30(14)24)16-7-5-8-17(13-16)27-23(31)20-15(2)32-29-22(20)18-9-3-4-10-19(18)25/h3-13H,1-2H3,(H,27,31)	JIOKYSCECFYDKL-UHFFFAOYSA-N	443.114902576							109656
SMR000109554	LSM-21085	SID7978389, BRD-A17023758	2928864	InChI=1S/C17H17NO3/c1-12-4-6-13(7-5-12)9-14-10-16(19)18(17(14)20)11-15-3-2-8-21-15/h2-8,14H,9-11H2,1H3	YOLUVGBTNHDCSC-UHFFFAOYSA-N	Cc1ccc(CC2CC(=O)N(Cc3occc3)C2=O)cc1	BroadT	BRD-A17023758	BRD-A17023758-001-05-3	ChemBridge Corporation	7165128			Cc1ccc(CC2CC(=O)N(Cc3ccco3)C2=O)cc1	InChI=1S/C17H17NO3/c1-12-4-6-13(7-5-12)9-14-10-16(19)18(17(14)20)11-15-3-2-8-21-15/h2-8,14H,9-11H2,1H3	YOLUVGBTNHDCSC-UHFFFAOYSA-N	283.120843414							109657
SMR000026430	LSM-21086	SID4251855, BRD-K35468290	3245490	InChI=1S/C18H14N2O3S/c1-22-13-4-5-15-11(8-13)7-12-9-16(23-18(12)20-15)17(21)19-10-14-3-2-6-24-14/h2-9H,10H2,1H3,(H,19,21)	UBKVGMKTRIFDBG-UHFFFAOYSA-N	COc1ccc2nc3oc(cc3cc2c1)C(=O)NCc4cccs4	BroadT	BRD-K35468290	BRD-K35468290-001-05-1	ChemDiv Inc.	C369-0162			COc1ccc2nc3oc(cc3cc2c1)C(=O)NCc1cccs1	InChI=1S/C18H14N2O3S/c1-22-13-4-5-15-11(8-13)7-12-9-16(23-18(12)20-15)17(21)19-10-14-3-2-6-24-14/h2-9H,10H2,1H3,(H,19,21)	UBKVGMKTRIFDBG-UHFFFAOYSA-N	338.072513018							109658
MLS001208521	LSM-21087	SID47204595, BRD-K16247687	6502649	InChI=1S/C20H20N2O4/c1-25-17-8-7-13(11-18(17)26-2)9-10-21-19-14-5-3-4-6-16(14)22-20(24)15(19)12-23/h3-8,11-12H,9-10H2,1-2H3,(H2,21,22,24)	RRUNZPUDYVIFGJ-UHFFFAOYSA-N	COc1ccc(CCNc2c(C=O)c(O)nc3ccccc23)cc1OC	BroadT	BRD-K16247687	BRD-K16247687-001-06-1	Asinex Ltd.	ASN 15710582			COc1ccc(CCNc2c(C=O)c(O)nc3ccccc23)cc1OC	InChI=1S/C20H20N2O4/c1-25-17-8-7-13(11-18(17)26-2)9-10-21-19-14-5-3-4-6-16(14)22-20(24)15(19)12-23/h3-8,11-12H,9-10H2,1-2H3,(H2,21,22,24)	RRUNZPUDYVIFGJ-UHFFFAOYSA-N	352.14230714							109659
AC1O9TV2	LSM-21088	SID858366, BRD-K38702363	6772139	InChI=1S/C19H17N3O3/c1-12-11-17(21-14-9-7-13(8-10-14)19(24)25-2)22-18(20-12)15-5-3-4-6-16(15)23/h3-11,23H,1-2H3,(H,20,21,22)	UHGKECWMKCFMNO-UHFFFAOYSA-N	COC(=O)c1ccc(Nc2cc(C)nc(n2)c3ccccc3O)cc1	BroadT	BRD-K38702363	BRD-K38702363-001-05-2	InterBioScreen Ltd.	STOCK2S-33855			COC(=O)c1ccc(Nc2cc(C)nc(n2)-c2ccccc2O)cc1	InChI=1S/C19H17N3O3/c1-12-11-17(21-14-9-7-13(8-10-14)19(24)25-2)22-18(20-12)15-5-3-4-6-16(15)23/h3-11,23H,1-2H3,(H,20,21,22)	UHGKECWMKCFMNO-UHFFFAOYSA-N	335.126991434							
AK-968/11844486	LSM-21089	SID17412708, BRD-K95174966	1220098	InChI=1S/C23H18N2O3S/c1-14-6-5-7-15(12-14)20-13-17(16-8-3-4-9-18(16)24-20)22(26)25-19-10-11-29-21(19)23(27)28-2/h3-13H,1-2H3,(H,25,26)	YOQUGKSHYMXJHS-UHFFFAOYSA-N	COC(=O)c1sccc1NC(=O)c2cc(nc3ccccc23)c4cccc(C)c4	BroadT	BRD-K95174966	BRD-K95174966-001-05-5	ChemBridge Corporation	5700412			COC(=O)c1sccc1NC(=O)c1cc(nc2ccccc12)-c1cccc(C)c1	InChI=1S/C23H18N2O3S/c1-14-6-5-7-15(12-14)20-13-17(16-8-3-4-9-18(16)24-20)22(26)25-19-10-11-29-21(19)23(27)28-2/h3-13H,1-2H3,(H,25,26)	YOQUGKSHYMXJHS-UHFFFAOYSA-N	402.103813146							109661
SMR000048526	LSM-21090	SID865845, BRD-A77566727	667105	InChI=1S/C20H16N4O3/c1-12-8-16-18(20(25)24(12)11-14-5-3-7-26-14)17(13-4-2-6-23-10-13)15(9-21)19(22)27-16/h2-8,10,17H,11,22H2,1H3	NLVQIZSMRAUGAR-UHFFFAOYSA-N	CC1=CC2=C(C(C(=C(N)O2)C#N)c3cccnc3)C(=O)N1Cc4occc4	BroadT	BRD-A77566727	BRD-A77566727-001-05-6	InterBioScreen Ltd.	STOCK5S-55314			Cc1cc2OC(N)=C(C#N)C(c3cccnc3)c2c(=O)n1Cc1ccco1	InChI=1S/C20H16N4O3/c1-12-8-16-18(20(25)24(12)11-14-5-3-7-26-14)17(13-4-2-6-23-10-13)15(9-21)19(22)27-16/h2-8,10,17H,11,22H2,1H3	NLVQIZSMRAUGAR-UHFFFAOYSA-N	360.122240412							109662
AC1NJ227	LSM-21091	BRD-K65387714	4840403	InChI=1S/C23H27N3O5/c1-2-30-21-13-17(15-24-25-19-8-6-7-18(14-19)23(28)29)9-10-20(21)31-16-22(27)26-11-4-3-5-12-26/h6-10,13-15,25H,2-5,11-12,16H2,1H3,(H,28,29)	ZMONBZDQTDCXJT-UHFFFAOYSA-N	CCOc1cc(C=NNc2cccc(c2)C(=O)O)ccc1OCC(=O)N3CCCCC3	BroadT	BRD-K65387714	BRD-K65387714-001-03-9	Enamine Ltd.	T5338945			CCOc1cc(C=NNc2cccc(c2)C(O)=O)ccc1OCC(=O)N1CCCCC1	InChI=1S/C23H27N3O5/c1-2-30-21-13-17(15-24-25-19-8-6-7-18(14-19)23(28)29)9-10-20(21)31-16-22(27)26-11-4-3-5-12-26/h6-10,13-15,25H,2-5,11-12,16H2,1H3,(H,28,29)	ZMONBZDQTDCXJT-UHFFFAOYSA-N	425.195070994							109663
2-[Ethyl-[(4-Oxo-1H-quinazolin-2-yl)methyl]amino]-n-(3-fluorophenyl)acetamide	LSM-21092	SID24833368, SID56373761, BRD-K49181073	4879819	InChI=1S/C19H19FN4O2/c1-2-24(12-18(25)21-14-7-5-6-13(20)10-14)11-17-22-16-9-4-3-8-15(16)19(26)23-17/h3-10H,2,11-12H2,1H3,(H,21,25)(H,22,23,26)	WIRGMXCGXDTZIJ-UHFFFAOYSA-N	CCN(CC(=O)Nc1cccc(F)c1)Cc2nc(O)c3ccccc3n2	BroadT	BRD-K49181073	BRD-K49181073-001-05-7	Enamine Ltd.	T5317514			CCN(CC(=O)Nc1cccc(F)c1)Cc1nc(O)c2ccccc2n1	InChI=1S/C19H19FN4O2/c1-2-24(12-18(25)21-14-7-5-6-13(20)10-14)11-17-22-16-9-4-3-8-15(16)19(26)23-17/h3-10H,2,11-12H2,1H3,(H,21,25)(H,22,23,26)	WIRGMXCGXDTZIJ-UHFFFAOYSA-N	354.149204088							109664
N-Ethyl-2-(phenylacetyl)hydrazinecarbothioamide	LSM-21093	SID17401244, BRD-K74836786	1817063	InChI=1S/C11H15N3OS/c1-2-12-11(16)14-13-10(15)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,13,15)(H2,12,14,16)	CTIYYGZNUOIIBY-UHFFFAOYSA-N	CCN=C(S)NNC(=O)Cc1ccccc1	BroadT	BRD-K74836786	BRD-K74836786-001-06-0	Specs	AO-476/40219263			CCN=C(S)NNC(=O)Cc1ccccc1	InChI=1S/C11H15N3OS/c1-2-12-11(16)14-13-10(15)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,13,15)(H2,12,14,16)	CTIYYGZNUOIIBY-UHFFFAOYSA-N	237.09358282							109665
SMR000016254	LSM-21094	SID26669967, SID4249899, BRD-A08391654	3243779	InChI=1S/C23H21N3O4S2/c1-14-9-17-21(32-14)22(28)26(11-15-5-3-2-4-6-15)23(25-17)31-12-20(27)24-16-7-8-18-19(10-16)30-13-29-18/h2-8,10,14H,9,11-13H2,1H3,(H,24,27)	WGYABKZBKZPIDM-UHFFFAOYSA-N	CC1CC2=C(S1)C(=O)N(Cc3ccccc3)C(=N2)SCC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-A08391654	BRD-A08391654-001-06-8	Life Chemicals Inc.	F0612-0337			CC1Cc2nc(SCC(=O)Nc3ccc4OCOc4c3)n(Cc3ccccc3)c(=O)c2S1	InChI=1S/C23H21N3O4S2/c1-14-9-17-21(32-14)22(28)26(11-15-5-3-2-4-6-15)23(25-17)31-12-20(27)24-16-7-8-18-19(10-16)30-13-29-18/h2-8,10,14H,9,11-13H2,1H3,(H,24,27)	WGYABKZBKZPIDM-UHFFFAOYSA-N	467.097347562							109666
MLS000102452	LSM-21095	SID7971540, BRD-A83736414	5310496	InChI=1S/C24H29N3O3S2/c1-19(25-32(28,29)20-9-4-3-5-10-20)24(23-13-8-18-31-23)27-16-14-26(15-17-27)21-11-6-7-12-22(21)30-2/h3-13,18-19,24-25H,14-17H2,1-2H3	CSEFYVKZPKHWJA-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)C(C(C)NS(=O)(=O)c3ccccc3)c4cccs4	BroadT	BRD-A83736414	BRD-A83736414-001-05-5	Life Chemicals Inc.	F0655-0832			COc1ccccc1N1CCN(CC1)C(C(C)NS(=O)(=O)c1ccccc1)c1cccs1	InChI=1S/C24H29N3O3S2/c1-19(25-32(28,29)20-9-4-3-5-10-20)24(23-13-8-18-31-23)27-16-14-26(15-17-27)21-11-6-7-12-22(21)30-2/h3-13,18-19,24-25H,14-17H2,1-2H3	CSEFYVKZPKHWJA-UHFFFAOYSA-N	471.165033198							109667
T5288797	LSM-21096	SID24825044, BRD-K04898296	2501115	InChI=1S/C18H16N2OS/c1-12-3-5-15(6-4-12)18(21)20-16-9-7-14(8-10-16)17-11-22-13(2)19-17/h3-11H,1-2H3,(H,20,21)	RBTGPLDYCIKNQJ-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)Nc2ccc(cc2)c3csc(C)n3	BroadT	BRD-K04898296	BRD-K04898296-001-05-0	Enamine Ltd.	T5288797			Cc1nc(cs1)-c1ccc(NC(=O)c2ccc(C)cc2)cc1	InChI=1S/C18H16N2OS/c1-12-3-5-15(6-4-12)18(21)20-16-9-7-14(8-10-16)17-11-22-13(2)19-17/h3-11H,1-2H3,(H,20,21)	RBTGPLDYCIKNQJ-UHFFFAOYSA-N	308.098333842							109668
MLS000050818	LSM-21097	SID26668470, SID4262056, BRD-K73442993	2217920	InChI=1S/C23H23N5O5S/c1-2-33-18(30)11-7-6-10-17(29)20-16(25-22(32)26-20)13-34-23-27-19(14-8-4-3-5-9-14)15(12-24)21(31)28-23/h3-5,8-9H,2,6-7,10-11,13H2,1H3,(H2,25,26,32)(H,27,28,31)	PVSZILJUJHCSJB-UHFFFAOYSA-N	CCOC(=O)CCCCC(=O)c1[nH]c(O)nc1CSc2nc(O)c(C#N)c(n2)c3ccccc3	BroadT	BRD-K73442993	BRD-K73442993-001-05-9	ChemBridge Corporation	7907762			CCOC(=O)CCCCC(=O)c1[nH]c(O)nc1CSc1nc(O)c(C#N)c(n1)-c1ccccc1	InChI=1S/C23H23N5O5S/c1-2-33-18(30)11-7-6-10-17(29)20-16(25-22(32)26-20)13-34-23-27-19(14-8-4-3-5-9-14)15(12-24)21(31)28-23/h3-5,8-9H,2,6-7,10-11,13H2,1H3,(H2,25,26,32)(H,27,28,31)	PVSZILJUJHCSJB-UHFFFAOYSA-N	481.141989576							109669
SMR000172103	LSM-21098	SID17505338, BRD-K01116344	1107365	InChI=1S/C25H16N2O5S/c28-17-7-5-16(6-8-17)27-24(30)20-12-11-19(14-21(20)25(27)31)32-18-9-3-15(4-10-18)26-23(29)22-2-1-13-33-22/h1-14,28H,(H,26,29)	ZRMKNWYOYJXOFR-UHFFFAOYSA-N	Oc1ccc(cc1)N2C(=O)c3ccc(Oc4ccc(NC(=O)c5cccs5)cc4)cc3C2=O	BroadT	BRD-K01116344	BRD-K01116344-001-06-0	Asinex Ltd.	BAS 02225105			Oc1ccc(cc1)N1C(=O)c2ccc(Oc3ccc(NC(=O)c4cccs4)cc3)cc2C1=O	InChI=1S/C25H16N2O5S/c28-17-7-5-16(6-8-17)27-24(30)20-12-11-19(14-21(20)25(27)31)32-18-9-3-15(4-10-18)26-23(29)22-2-1-13-33-22/h1-14,28H,(H,26,29)	ZRMKNWYOYJXOFR-UHFFFAOYSA-N	456.077992322							109670
HMS2984D05	LSM-21099	BRD-K12270207	24818535	InChI=1S/C24H21N3O3/c1-30-23-13-18(11-12-22(23)28)24(29)26-25-14-19-16-27(15-17-7-3-2-4-8-17)21-10-6-5-9-20(19)21/h2-14,16,28H,15H2,1H3,(H,26,29)	KGHKSDNFYFJSDH-UHFFFAOYSA-N	COc1cc(ccc1O)C(=O)NN=Cc2cn(Cc3ccccc3)c4ccccc24	BroadT	BRD-K12270207	BRD-K12270207-001-05-0	Chemical Technologies & Investigations	DBZA-069504			COc1cc(ccc1O)C(=O)NN=Cc1cn(Cc2ccccc2)c2ccccc12	InChI=1S/C24H21N3O3/c1-30-23-13-18(11-12-22(23)28)24(29)26-25-14-19-16-27(15-17-7-3-2-4-8-17)21-10-6-5-9-20(19)21/h2-14,16,28H,15H2,1H3,(H,26,29)	KGHKSDNFYFJSDH-UHFFFAOYSA-N	399.158291562							109671
N-[2-(3,4-Diethoxyphenyl)ethyl]-1-(6-morpholin-4-ylpyridazin-3-yl)piperidine-4-carboxamide	LSM-21100	SID4252303, BRD-K57939083	3245876	InChI=1S/C26H37N5O4/c1-3-34-22-6-5-20(19-23(22)35-4-2)9-12-27-26(32)21-10-13-30(14-11-21)24-7-8-25(29-28-24)31-15-17-33-18-16-31/h5-8,19,21H,3-4,9-18H2,1-2H3,(H,27,32)	GHFPSJBDOMRIEH-UHFFFAOYSA-N	CCOc1ccc(CCNC(=O)C2CCN(CC2)c3ccc(nn3)N4CCOCC4)cc1OCC	BroadT	BRD-K57939083	BRD-K57939083-001-05-5	ChemDiv Inc.	C591-0385			CCOc1ccc(CCNC(=O)C2CCN(CC2)c2ccc(nn2)N2CCOCC2)cc1OCC	InChI=1S/C26H37N5O4/c1-3-34-22-6-5-20(19-23(22)35-4-2)9-12-27-26(32)21-10-13-30(14-11-21)24-7-8-25(29-28-24)31-15-17-33-18-16-31/h5-8,19,21H,3-4,9-18H2,1-2H3,(H,27,32)	GHFPSJBDOMRIEH-UHFFFAOYSA-N	483.284554714							109672
SMR000065428	LSM-21101	SID3712644, BRD-K89561892	2499918	InChI=1S/C21H17FN6O3S/c22-15-3-5-16(6-4-15)28-19(14-7-9-23-10-8-14)26-27-21(28)32-13-18(29)25-20(30)24-12-17-2-1-11-31-17/h1-11H,12-13H2,(H2,24,25,29,30)	HEDBGTSQVYBAMV-UHFFFAOYSA-N	Fc1ccc(cc1)n2c(SCC(=O)NC(=O)NCc3occc3)nnc2c4ccncc4	BroadT	BRD-K89561892	BRD-K89561892-001-06-8	Enamine Ltd.	ZU-4388194			Fc1ccc(cc1)-n1c(SCC(=O)NC(=O)NCc2ccco2)nnc1-c1ccncc1	InChI=1S/C21H17FN6O3S/c22-15-3-5-16(6-4-15)28-19(14-7-9-23-10-8-14)26-27-21(28)32-13-18(29)25-20(30)24-12-17-2-1-11-31-17/h1-11H,12-13H2,(H2,24,25,29,30)	HEDBGTSQVYBAMV-UHFFFAOYSA-N	452.106687354							109673
Ethyl 4-(furan-2-yl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate	LSM-21102	SID26665572, BRD-A46280016	2748280	InChI=1S/C12H14N2O3S/c1-3-16-11(15)9-7(2)13-12(18)14-10(9)8-5-4-6-17-8/h4-6,10H,3H2,1-2H3,(H2,13,14,18)	ZMMCCRDZRJWDQX-UHFFFAOYSA-N	CCOC(=O)C1=C(C)N=C(S)NC1c2occc2	BroadT	BRD-A46280016	BRD-A46280016-001-05-2	InterBioScreen Ltd.	STOCK1S-59255			CCOC(=O)C1=C(C)N=C(S)NC1c1ccco1	InChI=1S/C12H14N2O3S/c1-3-16-11(15)9-7(2)13-12(18)14-10(9)8-5-4-6-17-8/h4-6,10H,3H2,1-2H3,(H2,13,14,18)	ZMMCCRDZRJWDQX-UHFFFAOYSA-N	266.072513018							109674
4-[(Bicyclo[4.1.0]heptane-7-carbonyl)-amino]-benzoic acid ethyl ester	LSM-21103	SID47201564, BRD-A72763822	579213	InChI=1S/C17H21NO3/c1-2-21-17(20)11-7-9-12(10-8-11)18-16(19)15-13-5-3-4-6-14(13)15/h7-10,13-15H,2-6H2,1H3,(H,18,19)	VQKYKLMBBOMMNX-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)C2C3CCCCC23)cc1	BroadT	BRD-A72763822	BRD-A72763822-001-06-6	Asinex Ltd.	BAS 00190464			CCOC(=O)c1ccc(NC(=O)C2C3CCCCC23)cc1	InChI=1S/C17H21NO3/c1-2-21-17(20)11-7-9-12(10-8-11)18-16(19)15-13-5-3-4-6-14(13)15/h7-10,13-15H,2-6H2,1H3,(H,18,19)	VQKYKLMBBOMMNX-UHFFFAOYSA-N	287.152143542							109675
ZINC04924784	LSM-21104	SID17510409, BRD-K42722906	7416707	InChI=1S/C21H23ClFN3O/c22-19-18(24-11-13-1-3-17(23)4-2-13)12-25-26(20(19)27)21-8-14-5-15(9-21)7-16(6-14)10-21/h1-4,12,14-16,24H,5-11H2	ANRSIGUDHUBZOA-UHFFFAOYSA-N	Fc1ccc(CNC2=C(Cl)C(=O)N(N=C2)C34CC5CC(CC(C5)C3)C4)cc1	BroadT	BRD-K42722906	BRD-K42722906-001-06-6	ChemDiv Inc.	C301-1534			Fc1ccc(CNc2cnn(c(=O)c2Cl)C23CC4CC(CC(C4)C2)C3)cc1	InChI=1S/C21H23ClFN3O/c22-19-18(24-11-13-1-3-17(23)4-2-13)12-25-26(20(19)27)21-8-14-5-15(9-21)7-16(6-14)10-21/h1-4,12,14-16,24H,5-11H2	ANRSIGUDHUBZOA-UHFFFAOYSA-N	387.151368296							109676
AC1LJAF5	LSM-15175	BRD-K66752484	947360	InChI=1S/C15H15N3O4/c1-9-8-13(16-11-5-3-2-4-10(9)11)18-17-12(15(21)22)6-7-14(19)20/h2-5,8H,6-7H2,1H3,(H,16,18)(H,19,20)(H,21,22)	UDHWXDSRBZYMPZ-UHFFFAOYSA-N	Cc1cc(NN=C(CCC(=O)O)C(=O)O)nc2ccccc12	BroadT	BRD-K66752484	BRD-K66752484-237-05-6	InterBioScreen Ltd.	STOCK3S-59391		[K]	Cc1cc(NN=C(CCC(O)=O)C(O)=O)nc2ccccc12.[K]	InChI=1S/C15H15N3O4.K.H/c1-9-8-13(16-11-5-3-2-4-10(9)11)18-17-12(15(21)22)6-7-14(19)20;;/h2-5,8H,6-7H2,1H3,(H,16,18)(H,19,20)(H,21,22);;	FYTNEGQAJBTUTN-UHFFFAOYSA-N	301.10625599							103831
T0508-5037	LSM-21105	SID3716407, BRD-K58108432	2351209	InChI=1S/C14H11N3O5/c18-13(7-20-14(19)10-6-15-3-4-16-10)17-9-1-2-11-12(5-9)22-8-21-11/h1-6H,7-8H2,(H,17,18)	WILPFGPWGSQYHR-UHFFFAOYSA-N	O=C(COC(=O)c1cnccn1)Nc2ccc3OCOc3c2	BroadT	BRD-K58108432	BRD-K58108432-001-05-4	Enamine Ltd.	T0508-5037			O=C(COC(=O)c1cnccn1)Nc1ccc2OCOc2c1	InChI=1S/C14H11N3O5/c18-13(7-20-14(19)10-6-15-3-4-16-10)17-9-1-2-11-12(5-9)22-8-21-11/h1-6H,7-8H2,(H,17,18)	WILPFGPWGSQYHR-UHFFFAOYSA-N	301.069870482							109677
ST50925563	LSM-21106	SID4264954, BRD-K55722508	257057	InChI=1S/C11H22N2O4/c1-5-16-9(14)12-7-11(3,4)8-13-10(15)17-6-2/h5-8H2,1-4H3,(H,12,14)(H,13,15)	DCSHCWQETQJKPE-UHFFFAOYSA-N	CCOC(=O)NCC(C)(C)CNC(=O)OCC	BroadT	BRD-K55722508	BRD-K55722508-001-05-4	ChemBridge Corporation	7275610			CCOC(=O)NCC(C)(C)CNC(=O)OCC	InChI=1S/C11H22N2O4/c1-5-16-9(14)12-7-11(3,4)8-13-10(15)17-6-2/h5-8H2,1-4H3,(H,12,14)(H,13,15)	DCSHCWQETQJKPE-UHFFFAOYSA-N	246.157957204							109678
SMR000152607	LSM-21107	SID14745866, BRD-A94198358	4249305	InChI=1S/C24H24ClN5O/c25-18-11-9-16(10-12-18)24(31)27-21(14-17-15-26-20-7-4-3-6-19(17)20)23-29-28-22-8-2-1-5-13-30(22)23/h3-4,6-7,9-12,15,21,26H,1-2,5,8,13-14H2,(H,27,31)	VZZWBMBAXOFQMQ-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)NC(Cc2c[nH]c3ccccc23)c4nnc5CCCCCn45	BroadT	BRD-A94198358	BRD-A94198358-001-05-3	Enamine Ltd.	T0503-7126			Clc1ccc(cc1)C(=O)NC(Cc1c[nH]c2ccccc12)c1nnc2CCCCCn12	InChI=1S/C24H24ClN5O/c25-18-11-9-16(10-12-18)24(31)27-21(14-17-15-26-20-7-4-3-6-19(17)20)23-29-28-22-8-2-1-5-13-30(22)23/h3-4,6-7,9-12,15,21,26H,1-2,5,8,13-14H2,(H,27,31)	VZZWBMBAXOFQMQ-UHFFFAOYSA-N	433.166938148							109679
5-(3-Nitrophenyl)-n-{[2-(pyrrolidin-1-yl)phenyl]carbamothioyl}furan-2-carboxamide	LSM-21108	SID14741240, BRD-K10696173	1423969	InChI=1S/C22H20N4O4S/c27-21(20-11-10-19(30-20)15-6-5-7-16(14-15)26(28)29)24-22(31)23-17-8-1-2-9-18(17)25-12-3-4-13-25/h1-2,5-11,14H,3-4,12-13H2,(H2,23,24,27,31)	AWXTVMYBDNOCOU-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)c2oc(cc2)C(=O)NC(=S)Nc3ccccc3N4CCCC4	BroadT	BRD-K10696173	BRD-K10696173-001-05-8	InterBioScreen Ltd.	STOCK4S-61738			[O-][N+](=O)c1cccc(c1)-c1ccc(o1)C(=O)NC(=S)Nc1ccccc1N1CCCC1	InChI=1S/C22H20N4O4S/c27-21(20-11-10-19(30-20)15-6-5-7-16(14-15)26(28)29)24-22(31)23-17-8-1-2-9-18(17)25-12-3-4-13-25/h1-2,5-11,14H,3-4,12-13H2,(H2,23,24,27,31)	AWXTVMYBDNOCOU-UHFFFAOYSA-N	436.12052585							109680
ST50489969	LSM-21109	SID24795495, BRD-K81877528	2992227	InChI=1S/C14H12FN3O4/c1-22-9-6-7-12(13(8-9)18(20)21)17-14(19)16-11-5-3-2-4-10(11)15/h2-8H,1H3,(H2,16,17,19)	VLEFIHFSHCPVHS-UHFFFAOYSA-N	COc1ccc(NC(=O)Nc2ccccc2F)c(c1)[N+](=O)[O-]	BroadT	BRD-K81877528	BRD-K81877528-001-05-0	ChemBridge Corporation	9007256			COc1ccc(NC(=O)Nc2ccccc2F)c(c1)[N+]([O-])=O	InChI=1S/C14H12FN3O4/c1-22-9-6-7-12(13(8-9)18(20)21)17-14(19)16-11-5-3-2-4-10(11)15/h2-8H,1H3,(H2,16,17,19)	VLEFIHFSHCPVHS-UHFFFAOYSA-N	305.081184094							109681
MLS000521373	LSM-21110	SID14732909, BRD-K66250052	747366	InChI=1S/C12H11NO2S/c1-2-13-10-7-3-5-9-6-4-8-11(12(9)10)16(13,14)15/h3-8H,2H2,1H3	FMQSQMHNQGKEMO-UHFFFAOYSA-N	CCN1c2cccc3cccc(c23)S1(=O)=O	BroadT	BRD-K66250052	BRD-K66250052-001-05-3	ChemDiv Inc.	1615-0232			CCN1c2cccc3cccc(c23)S1(=O)=O	InChI=1S/C12H11NO2S/c1-2-13-10-7-3-5-9-6-4-8-11(12(9)10)16(13,14)15/h3-8H,2H2,1H3	FMQSQMHNQGKEMO-UHFFFAOYSA-N	233.051049292							109682
ST50049347	LSM-21111	SID3716677, BRD-A71467562	2999715	InChI=1S/C17H24N2O4S/c1-11-3-4-12-13(9-11)24-16(15(12)17(21)22-2)18-14(20)10-19-5-7-23-8-6-19/h11H,3-10H2,1-2H3,(H,18,20)	VCOFQHYEUCQCLG-UHFFFAOYSA-N	COC(=O)c1c2CCC(C)Cc2sc1NC(=O)CN3CCOCC3	BroadT	BRD-A71467562	BRD-A71467562-001-05-1	Enamine Ltd.	T0513-4829			COC(=O)c1c(NC(=O)CN2CCOCC2)sc2CC(C)CCc12	InChI=1S/C17H24N2O4S/c1-11-3-4-12-13(9-11)24-16(15(12)17(21)22-2)18-14(20)10-19-5-7-23-8-6-19/h11H,3-10H2,1-2H3,(H,18,20)	VCOFQHYEUCQCLG-UHFFFAOYSA-N	352.145677958							109683
ST50131487	LSM-21112	SID17433757, BRD-K96492506	914066	InChI=1S/C10H14N2O2S2/c1-3-11-10(15)12-16(13,14)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H2,11,12,15)	QKXAKHONQHLDJH-UHFFFAOYSA-N	CCN=C(S)NS(=O)(=O)c1ccc(C)cc1	BroadT	BRD-K96492506	BRD-K96492506-001-05-7	ChemBridge Corporation	7772665			CCN=C(S)NS(=O)(=O)c1ccc(C)cc1	InChI=1S/C10H14N2O2S2/c1-3-11-10(15)12-16(13,14)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H2,11,12,15)	QKXAKHONQHLDJH-UHFFFAOYSA-N	258.049669088							109684
1G-013	LSM-43914	SID24822364, BRD-A13883216	16195260	InChI=1S/C16H11ClN2O5/c17-9-5-6-14(20)12(7-9)18-8-13(19(22)23)15-10-3-1-2-4-11(10)16(21)24-15/h1-8,15,18,20H/b13-8+	LPWFEDGLJDFTSH-MDWZMJQESA-N	Oc1ccc(Cl)cc1N\C=C(/C2OC(=O)c3ccccc23)\[N+](=O)[O-]	BroadT	BRD-A13883216	BRD-A13883216-001-06-8	Key Organics Ltd.	1G-013			Oc1ccc(Cl)cc1N\C=C(/C1OC(=O)c2ccccc12)[N+]([O-])=O	InChI=1S/C16H11ClN2O5/c17-9-5-6-14(20)12(7-9)18-8-13(19(22)23)15-10-3-1-2-4-11(10)16(21)24-15/h1-8,15,18,20H/b13-8+	LPWFEDGLJDFTSH-MDWZMJQESA-N	346.035649182							
MLS000849558	LSM-21114	SID26732692, BRD-K99459213	16746638	InChI=1S/C20H20N4O3/c1-13(14-6-4-3-5-7-14)23-19(25)17-18(22-12-21-17)20(26)24-15-8-10-16(27-2)11-9-15/h3-13H,1-2H3,(H,21,22)(H,23,25)(H,24,26)/t13-/m1/s1	DERCBWLVMLBEMQ-CYBMUJFWSA-N	COc1ccc(NC(=O)c2[nH]cnc2C(=O)N[C@H](C)c3ccccc3)cc1	BroadT	BRD-K99459213	BRD-K99459213-001-05-7	University of Tulsa	ILP-I-76 AN02_PA02			COc1ccc(NC(=O)c2[nH]cnc2C(=O)N[C@H](C)c2ccccc2)cc1	InChI=1S/C20H20N4O3/c1-13(14-6-4-3-5-7-14)23-19(25)17-18(22-12-21-17)20(26)24-15-8-10-16(27-2)11-9-15/h3-13H,1-2H3,(H,21,22)(H,23,25)(H,24,26)/t13-/m1/s1	DERCBWLVMLBEMQ-CYBMUJFWSA-N	364.15354054							109686
SMR000152196	LSM-21115	BRD-K40846160	2369515	InChI=1S/C11H10N4S/c12-9(16)5-10-13-11-8-4-2-1-3-7(8)6-15(11)14-10/h1-4H,5-6H2,(H2,12,16)	GJYQNPPFPPSYNH-UHFFFAOYSA-N	SC(=N)Cc1nc2c3ccccc3Cn2n1	BroadT	BRD-K40846160	BRD-K40846160-001-05-8	Enamine Ltd.	T0506-3567			SC(=N)Cc1nc2-c3ccccc3Cn2n1	InChI=1S/C11H10N4S/c12-9(16)5-10-13-11-8-4-2-1-3-7(8)6-15(11)14-10/h1-4H,5-6H2,(H2,12,16)	GJYQNPPFPPSYNH-UHFFFAOYSA-N	230.06261705							109687
4-Bromo-1-methyl-n-(1,3-thiazol-2-yl)-1H-pyrazole-3-carboxamide	LSM-21116	SID22414609, BRD-K38905862	903362	InChI=1S/C8H7BrN4OS/c1-13-4-5(9)6(12-13)7(14)11-8-10-2-3-15-8/h2-4H,1H3,(H,10,11,14)	CYXOTJGNKAZAES-UHFFFAOYSA-N	Cn1cc(Br)c(n1)C(=O)Nc2nccs2	BroadT	BRD-K38905862	BRD-K38905862-001-06-5	Specs	AK-968/12116091			Cn1cc(Br)c(n1)C(=O)Nc1nccs1	InChI=1S/C8H7BrN4OS/c1-13-4-5(9)6(12-13)7(14)11-8-10-2-3-15-8/h2-4H,1H3,(H,10,11,14)	CYXOTJGNKAZAES-UHFFFAOYSA-N	285.952394174							109688
SMR000154646	LSM-21117	SID14746587, BRD-K62716057	705841	InChI=1S/C16H16ClNO3S/c1-9-14(16(20)21-3)10(2)18-15(9)13(19)8-22-12-6-4-11(17)5-7-12/h4-7,18H,8H2,1-3H3	UFYMVJLILOQOCV-UHFFFAOYSA-N	COC(=O)c1c(C)[nH]c(C(=O)CSc2ccc(Cl)cc2)c1C	BroadT	BRD-K62716057	BRD-K62716057-001-05-2	Enamine Ltd.	T0505-7737			COC(=O)c1c(C)[nH]c(C(=O)CSc2ccc(Cl)cc2)c1C	InChI=1S/C16H16ClNO3S/c1-9-14(16(20)21-3)10(2)18-15(9)13(19)8-22-12-6-4-11(17)5-7-12/h4-7,18H,8H2,1-3H3	UFYMVJLILOQOCV-UHFFFAOYSA-N	337.053941782							109689
SMR000045550	LSM-21118	SID863453, BRD-K72760840	664705	InChI=1S/C21H20ClN3O5/c1-3-25(13-5-7-16-17(9-13)30-11-29-16)10-18(26)24-19-14-8-12(22)4-6-15(14)23-20(19)21(27)28-2/h4-9,23H,3,10-11H2,1-2H3,(H,24,26)	JBAHTOFBDDWQRM-UHFFFAOYSA-N	CCN(CC(=O)Nc1c([nH]c2ccc(Cl)cc12)C(=O)OC)c3ccc4OCOc4c3	BroadT	BRD-K72760840	BRD-K72760840-001-05-0	InterBioScreen Ltd.	STOCK4S-71733			CCN(CC(=O)Nc1c([nH]c2ccc(Cl)cc12)C(=O)OC)c1ccc2OCOc2c1	InChI=1S/C21H20ClN3O5/c1-3-25(13-5-7-16-17(9-13)30-11-29-16)10-18(26)24-19-14-8-12(22)4-6-15(14)23-20(19)21(27)28-2/h4-9,23H,3,10-11H2,1-2H3,(H,24,26)	JBAHTOFBDDWQRM-UHFFFAOYSA-N	429.10914848							109690
SMR000142116	LSM-21119	SID14746415, BRD-K83320634	1329040	InChI=1S/C24H26N2O6S/c1-29-17-11-14(12-18(30-2)21(17)31-3)22(27)26-24-20(16-8-4-5-9-19(16)33-24)23(28)25-13-15-7-6-10-32-15/h6-7,10-12H,4-5,8-9,13H2,1-3H3,(H,25,28)(H,26,27)	KORNZWXYQMBINC-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)Nc2sc3CCCCc3c2C(=O)NCc4occc4	BroadT	BRD-K83320634	BRD-K83320634-001-06-8	ChemBridge Corporation	7018444			COc1cc(cc(OC)c1OC)C(=O)Nc1sc2CCCCc2c1C(=O)NCc1ccco1	InChI=1S/C24H26N2O6S/c1-29-17-11-14(12-18(30-2)21(17)31-3)22(27)26-24-20(16-8-4-5-9-19(16)33-24)23(28)25-13-15-7-6-10-32-15/h6-7,10-12H,4-5,8-9,13H2,1-3H3,(H,25,28)(H,26,27)	KORNZWXYQMBINC-UHFFFAOYSA-N	470.151157262							109691
MLS000394288	LSM-4238	BRD-K99475920, SID22410759, SID87225730	15945391	InChI=1S/C20H24N2O5S2/c1-26-17-7-6-15(29(24,25)22-8-10-27-11-9-22)13-16(17)21-20(23)19-12-14-4-2-3-5-18(14)28-19/h6-7,12-13H,2-5,8-11H2,1H3,(H,21,23)	HRQXJJWQYKYFHP-UHFFFAOYSA-N	COc1ccc(cc1NC(=O)c2cc3CCCCc3s2)S(=O)(=O)N4CCOCC4	BroadT	BRD-K99475920	BRD-K99475920-001-05-7	Enamine Ltd.	ZT-7452822			COc1ccc(cc1NC(=O)c1cc2CCCCc2s1)S(=O)(=O)N1CCOCC1	InChI=1S/C20H24N2O5S2/c1-26-17-7-6-15(29(24,25)22-8-10-27-11-9-22)13-16(17)21-20(23)19-12-14-4-2-3-5-18(14)28-19/h6-7,12-13H,2-5,8-11H2,1H3,(H,21,23)	HRQXJJWQYKYFHP-UHFFFAOYSA-N	436.112663268							93739
MLS000558213	LSM-21120	SID14742213, BRD-K75656771	944105	InChI=1S/C16H15N3OS/c1-10-13-9-14(15(20)17-11-7-8-11)21-16(13)19(18-10)12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,17,20)	RVIPGMCDIBEWAQ-UHFFFAOYSA-N	Cc1nn(c2ccccc2)c3sc(cc13)C(=O)NC4CC4	BroadT	BRD-K75656771	BRD-K75656771-001-06-8	InterBioScreen Ltd.	STOCK4S-64872			Cc1nn(-c2ccccc2)c2sc(cc12)C(=O)NC1CC1	InChI=1S/C16H15N3OS/c1-10-13-9-14(15(20)17-11-7-8-11)21-16(13)19(18-10)12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,17,20)	RVIPGMCDIBEWAQ-UHFFFAOYSA-N	297.09358282							109692
SMR000046379	LSM-21121	SID864003, BRD-K64929039	665255	InChI=1S/C22H29N3O6/c1-3-28-15-5-6-17-16(13-15)19(20(23-17)21(27)29-4-2)24-18(26)14-25-9-7-22(8-10-25)30-11-12-31-22/h5-6,13,23H,3-4,7-12,14H2,1-2H3,(H,24,26)	ONLPJGMXXNUEHT-UHFFFAOYSA-N	CCOC(=O)c1[nH]c2ccc(OCC)cc2c1NC(=O)CN3CCC4(CC3)OCCO4	BroadT	BRD-K64929039	BRD-K64929039-001-05-2	InterBioScreen Ltd.	STOCK5S-00197			CCOC(=O)c1[nH]c2ccc(OCC)cc2c1NC(=O)CN1CCC2(CC1)OCCO2	InChI=1S/C22H29N3O6/c1-3-28-15-5-6-17-16(13-15)19(20(23-17)21(27)29-4-2)24-18(26)14-25-9-7-22(8-10-25)30-11-12-31-22/h5-6,13,23H,3-4,7-12,14H2,1-2H3,(H,24,26)	ONLPJGMXXNUEHT-UHFFFAOYSA-N	431.205635678							109693
SMR000077743	LSM-21122	SID4262089, BRD-K79387603	2960340	InChI=1S/C24H24FN3O4S/c1-32-22-11-9-21(10-12-22)27-13-15-28(16-14-27)24(29)18-5-7-20(8-6-18)26-33(30,31)23-4-2-3-19(25)17-23/h2-12,17,26H,13-16H2,1H3	SLADHNDVHKCEFU-UHFFFAOYSA-N	COc1ccc(cc1)N2CCN(CC2)C(=O)c3ccc(NS(=O)(=O)c4cccc(F)c4)cc3	BroadT	BRD-K79387603	BRD-K79387603-001-05-2	ChemBridge Corporation	7875632			COc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc(NS(=O)(=O)c2cccc(F)c2)cc1	InChI=1S/C24H24FN3O4S/c1-32-22-11-9-21(10-12-22)27-13-15-28(16-14-27)24(29)18-5-7-20(8-6-18)26-33(30,31)23-4-2-3-19(25)17-23/h2-12,17,26H,13-16H2,1H3	SLADHNDVHKCEFU-UHFFFAOYSA-N	469.147155168							109694
SMR000003008	LSM-21123	SID26667847, SID853200, BRD-A60306743	655855	InChI=1S/C23H23ClN2O6S/c24-17-3-5-19(6-4-17)33(28,29)26(14-18-2-1-7-30-18)13-16-10-15-11-21-22(32-9-8-31-21)12-20(15)25-23(16)27/h3-6,10-12,18H,1-2,7-9,13-14H2,(H,25,27)	WOQBEMQFEMPSLJ-UHFFFAOYSA-N	Oc1nc2cc3OCCOc3cc2cc1CN(CC4CCCO4)S(=O)(=O)c5ccc(Cl)cc5	BroadT	BRD-A60306743	BRD-A60306743-001-05-6	Asinex Ltd.	ASN 04197033			Oc1nc2cc3OCCOc3cc2cc1CN(CC1CCCO1)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H23ClN2O6S/c24-17-3-5-19(6-4-17)33(28,29)26(14-18-2-1-7-30-18)13-16-10-15-11-21-22(32-9-8-31-21)12-20(15)25-23(16)27/h3-6,10-12,18H,1-2,7-9,13-14H2,(H,25,27)	WOQBEMQFEMPSLJ-UHFFFAOYSA-N	490.096534876							109695
N'-[(4-phenoxybutanoyl)oxy]benzenecarboximidamide	LSM-21124	SID17506331, BRD-K42366638	2195339	InChI=1S/C17H18N2O3/c18-17(14-8-3-1-4-9-14)19-22-16(20)12-7-13-21-15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2,(H2,18,19)	MKNLBAAYTVOHKM-UHFFFAOYSA-N	N=C(NOC(=O)CCCOc1ccccc1)c2ccccc2	BroadT	BRD-K42366638	BRD-K42366638-001-06-7	ChemBridge Corporation	7634586			N=C(NOC(=O)CCCOc1ccccc1)c1ccccc1	InChI=1S/C17H18N2O3/c18-17(14-8-3-1-4-9-14)19-22-16(20)12-7-13-21-15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2,(H2,18,19)	MKNLBAAYTVOHKM-UHFFFAOYSA-N	298.131742456							109696
SMR000004341	LSM-21125	SID843744, BRD-A23203166	646046	InChI=1S/C27H32N6O3/c1-6-27(2,3)28-26(35)25(23-12-9-17-31(23)4)33(19-13-15-20(36-5)16-14-19)24(34)18-32-22-11-8-7-10-21(22)29-30-32/h7-17,25H,6,18H2,1-5H3,(H,28,35)	DCFLKOQTJRBBNT-UHFFFAOYSA-N	CCC(C)(C)NC(=O)C(N(C(=O)Cn1nnc2ccccc12)c3ccc(OC)cc3)c4cccn4C	BroadT	BRD-A23203166	BRD-A23203166-001-06-7	Asinex Ltd.	ASN 05297355			CCC(C)(C)NC(=O)C(N(C(=O)Cn1nnc2ccccc12)c1ccc(OC)cc1)c1cccn1C	InChI=1S/C27H32N6O3/c1-6-27(2,3)28-26(35)25(23-12-9-17-31(23)4)33(19-13-15-20(36-5)16-14-19)24(34)18-32-22-11-8-7-10-21(22)29-30-32/h7-17,25H,6,18H2,1-5H3,(H,28,35)	DCFLKOQTJRBBNT-UHFFFAOYSA-N	488.253588944							109697
AC1N59AI	LSM-21126	SID24823758, BRD-K80660686	4191472	InChI=1S/C26H23N5O2S/c1-33-19-9-7-18(8-10-19)29-12-14-30(15-13-29)25(32)17-6-11-20-22(16-17)28-26(34)31-23-5-3-2-4-21(23)27-24(20)31/h2-11,16H,12-15H2,1H3,(H,28,34)	MHNCNEAYEIKRDF-UHFFFAOYSA-N	COc1ccc(cc1)N2CCN(CC2)C(=O)c3ccc4c(c3)nc(S)n5c6ccccc6nc45	BroadT	BRD-K80660686	BRD-K80660686-001-03-4	ChemDiv Inc.	K250-0318			COc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc2c3nc4ccccc4n3c(S)nc2c1	InChI=1S/C26H23N5O2S/c1-33-19-9-7-18(8-10-19)29-12-14-30(15-13-29)25(32)17-6-11-20-22(16-17)28-26(34)31-23-5-3-2-4-21(23)27-24(20)31/h2-11,16H,12-15H2,1H3,(H,28,34)	MHNCNEAYEIKRDF-UHFFFAOYSA-N	469.157245716							109698
MLS000777255	LSM-43915	SID26659369, BRD-K02933128	1922279	InChI=1S/C15H15NO4S2/c1-2-20-11-5-3-10(4-6-11)9-12-14(19)16(15(21)22-12)8-7-13(17)18/h3-6,9H,2,7-8H2,1H3,(H,17,18)/b12-9-	AYUXOHIOPIWDOF-XFXZXTDPSA-N	CCOc1ccc(\C=C\2/SC(=S)N(CCC(=O)O)C2=O)cc1	BroadT	BRD-K02933128	BRD-K02933128-001-08-5	InterBioScreen Ltd.	STOCK2S-47796			CCOc1ccc(cc1)\C=C1/SC(=S)N(CCC(O)=O)C1=O	InChI=1S/C15H15NO4S2/c1-2-20-11-5-3-10(4-6-11)9-12-14(19)16(15(21)22-12)8-7-13(17)18/h3-6,9H,2,7-8H2,1H3,(H,17,18)/b12-9-	AYUXOHIOPIWDOF-XFXZXTDPSA-N	337.04424935							
MLS000519828	LSM-21128	SID85281139, SID14735442, BRD-K24860708	3249260	InChI=1S/C16H11ClF3N3O/c17-11-5-3-10(4-6-11)9-21-15-22-12(13-2-1-7-24-13)8-14(23-15)16(18,19)20/h1-8H,9H2,(H,21,22,23)	OIEOWSSHDYBEKX-UHFFFAOYSA-N	FC(F)(F)c1cc(nc(NCc2ccc(Cl)cc2)n1)c3occc3	BroadT	BRD-K24860708	BRD-K24860708-001-07-4	ChemDiv Inc.	C130-0474			FC(F)(F)c1cc(nc(NCc2ccc(Cl)cc2)n1)-c1ccco1	InChI=1S/C16H11ClF3N3O/c17-11-5-3-10(4-6-11)9-21-15-22-12(13-2-1-7-24-13)8-14(23-15)16(18,19)20/h1-8H,9H2,(H,21,22,23)	OIEOWSSHDYBEKX-UHFFFAOYSA-N	353.054274312							109700
1-Benzyl-1H-benzimidazole	LSM-21129	SID14724955, BRD-K67491786	563347	InChI=1S/C14H12N2/c1-2-6-12(7-3-1)10-16-11-15-13-8-4-5-9-14(13)16/h1-9,11H,10H2	MNEIJGDSFRHGMS-UHFFFAOYSA-N	C(c1ccccc1)n2cnc3ccccc23	BroadT	BRD-K67491786	BRD-K67491786-001-04-8	Asinex Ltd.	BAS 00619109			C(c1ccccc1)n1cnc2ccccc12	InChI=1S/C14H12N2/c1-2-6-12(7-3-1)10-16-11-15-13-8-4-5-9-14(13)16/h1-9,11H,10H2	MNEIJGDSFRHGMS-UHFFFAOYSA-N	208.100048404							109701
N-(3-Phenylpropyl)-9H-purin-6-amine	LSM-43916	SID124889405, SID7970804, BRD-K89251722	134684	InChI=1S/C14H15N5/c1-2-5-11(6-3-1)7-4-8-15-13-12-14(17-9-16-12)19-10-18-13/h1-3,5-6,9-10H,4,7-8H2,(H2,15,16,17,18,19)	FVBWMJCJGPRURZ-UHFFFAOYSA-N	C(CNc1[nH]cnc2ncnc12)Cc3ccccc3	BroadT	BRD-K89251722	BRD-K89251722-001-04-7	Life Chemicals Inc.	F0578-0082			C(CNc1[nH]cnc2ncnc12)Cc1ccccc1	InChI=1S/C14H15N5/c1-2-5-11(6-3-1)7-4-8-15-13-12-14(17-9-16-12)19-10-18-13/h1-3,5-6,9-10H,4,7-8H2,(H2,15,16,17,18,19)	FVBWMJCJGPRURZ-UHFFFAOYSA-N	253.13274553							
AC1LDHYQ	LSM-21131	SID846004, BRD-K57247366	648371	InChI=1S/C18H16N2O5S/c1-23-14-10-12(20-18(22)16-6-4-8-26-16)15(24-2)9-11(14)19-17(21)13-5-3-7-25-13/h3-10H,1-2H3,(H,19,21)(H,20,22)	OJIWQOKZZYAZAV-UHFFFAOYSA-N	COc1cc(NC(=O)c2cccs2)c(OC)cc1NC(=O)c3occc3	BroadT	BRD-K57247366	BRD-K57247366-001-05-1	Asinex Ltd.	ASN 03066284			COc1cc(NC(=O)c2cccs2)c(OC)cc1NC(=O)c1ccco1	InChI=1S/C18H16N2O5S/c1-23-14-10-12(20-18(22)16-6-4-8-26-16)15(24-2)9-11(14)19-17(21)13-5-3-7-25-13/h3-10H,1-2H3,(H,19,21)(H,20,22)	OJIWQOKZZYAZAV-UHFFFAOYSA-N	372.077992322							109703
SMR000221133	LSM-21132	SID17511547, BRD-K04357270	3373363	InChI=1S/C24H18N6/c1-29-19-14-8-7-13-18(19)28-23(29)20-21-24(27-17-12-6-5-11-16(17)26-21)30(22(20)25)15-9-3-2-4-10-15/h2-14H,25H2,1H3	YRNYPXPYNHRXHD-UHFFFAOYSA-N	Cn1c(nc2ccccc12)c3c(N)n(c4ccccc4)c5nc6ccccc6nc35	BroadT	BRD-K04357270	BRD-K04357270-001-05-7	InterBioScreen Ltd.	STOCK2S-87415			Cn1c(nc2ccccc12)-c1c(N)n(-c2ccccc2)c2nc3ccccc3nc12	InChI=1S/C24H18N6/c1-29-19-14-8-7-13-18(19)28-23(29)20-21-24(27-17-12-6-5-11-16(17)26-21)30(22(20)25)15-9-3-2-4-10-15/h2-14H,25H2,1H3	YRNYPXPYNHRXHD-UHFFFAOYSA-N	390.159294636							109704
AC1MJAHL	LSM-21133	SID24807973, BRD-K74535597	3134396	InChI=1S/C16H13F3N2O5/c17-16(18,19)11-3-6-14(13(9-11)21(24)25)26-12-4-1-10(2-5-12)15(23)20-7-8-22/h1-6,9,22H,7-8H2,(H,20,23)	BSYPHDMFWPEYHD-UHFFFAOYSA-N	OCCNC(=O)c1ccc(Oc2ccc(cc2[N+](=O)[O-])C(F)(F)F)cc1	BroadT	BRD-K74535597	BRD-K74535597-001-05-9	Asinex Ltd.	BAS 01847320			OCCNC(=O)c1ccc(Oc2ccc(cc2[N+]([O-])=O)C(F)(F)F)cc1	InChI=1S/C16H13F3N2O5/c17-16(18,19)11-3-6-14(13(9-11)21(24)25)26-12-4-1-10(2-5-12)15(23)20-7-8-22/h1-6,9,22H,7-8H2,(H,20,23)	BSYPHDMFWPEYHD-UHFFFAOYSA-N	370.077656136							109705
SMR000035617	LSM-21134	SID7967225, SID857977, BRD-K95969955	659325	InChI=1S/C19H24N4O2/c1-19(2)10-13-14(11-20)18(21-7-8-23(3)4)22-17(15(13)12-25-19)16-6-5-9-24-16/h5-6,9H,7-8,10,12H2,1-4H3,(H,21,22)	UKTMLBHOZGIKPY-UHFFFAOYSA-N	CN(C)CCNc1nc(c2COC(C)(C)Cc2c1C#N)c3occc3	BroadT	BRD-K95969955	BRD-K95969955-001-05-1	InterBioScreen Ltd.	STOCK2S-07370			CN(C)CCNc1nc(-c2ccco2)c2COC(C)(C)Cc2c1C#N	InChI=1S/C19H24N4O2/c1-19(2)10-13-14(11-20)18(21-7-8-23(3)4)22-17(15(13)12-25-19)16-6-5-9-24-16/h5-6,9H,7-8,10,12H2,1-4H3,(H,21,22)	UKTMLBHOZGIKPY-UHFFFAOYSA-N	340.189926048							109706
AC1NULM6	LSM-43917	SID22402276, BRD-K08995946	5455094	InChI=1S/C20H20N4O4/c1-12-4-7-15(10-13(12)2)24-19(26)17(18(25)22-20(24)27)11-21-23-14-5-8-16(28-3)9-6-14/h4-11,21,23H,1-3H3,(H,22,25,27)/b17-11-	SBMRCXHMWMVWPF-BOPFTXTBSA-N	COc1ccc(NN\C=C/2\C(=O)NC(=O)N(C2=O)c3ccc(C)c(C)c3)cc1	BroadT	BRD-K08995946	BRD-K08995946-001-07-0	Specs	AN-465/13286030			COc1ccc(NN\C=C2\C(=O)NC(=O)N(C2=O)c2ccc(C)c(C)c2)cc1	InChI=1S/C20H20N4O4/c1-12-4-7-15(10-13(12)2)24-19(26)17(18(25)22-20(24)27)11-21-23-14-5-8-16(28-3)9-6-14/h4-11,21,23H,1-3H3,(H,22,25,27)/b17-11-	SBMRCXHMWMVWPF-BOPFTXTBSA-N	380.14845516							
SMR000124769	LSM-21136	SID14723335, BRD-K66883633	3231862	InChI=1S/C24H26N4O4S2/c1-17-23(26-24(33-17)25-22(29)16-27-11-13-32-14-12-27)19-7-8-21-18(15-19)9-10-28(21)34(30,31)20-5-3-2-4-6-20/h2-8,15H,9-14,16H2,1H3,(H,25,26,29)	YLBJBGDKDRUJNN-UHFFFAOYSA-N	Cc1sc(NC(=O)CN2CCOCC2)nc1c3ccc4N(CCc4c3)S(=O)(=O)c5ccccc5	BroadT	BRD-K66883633	BRD-K66883633-001-06-7	Asinex Ltd.	ASN 10295794			Cc1sc(NC(=O)CN2CCOCC2)nc1-c1ccc2N(CCc2c1)S(=O)(=O)c1ccccc1	InChI=1S/C24H26N4O4S2/c1-17-23(26-24(33-17)25-22(29)16-27-11-13-32-14-12-27)19-7-8-21-18(15-19)9-10-28(21)34(30,31)20-5-3-2-4-6-20/h2-8,15H,9-14,16H2,1H3,(H,25,26,29)	YLBJBGDKDRUJNN-UHFFFAOYSA-N	498.139546732							109708
MLS000080755	LSM-21137	SID865329, BRD-A90025074	666583	InChI=1S/C17H18N4O5/c1-20-14-13(16(24)21(2)17(20)25)9(15(23)19-14)8-12(22)18-10-6-4-5-7-11(10)26-3/h4-7,9H,8H2,1-3H3,(H,18,22)(H,19,23)	LAFVQHDPCXQYIG-UHFFFAOYSA-N	COc1ccccc1NC(=O)CC2C(=O)NC3=C2C(=O)N(C)C(=O)N3C	BroadT	BRD-A90025074	BRD-A90025074-001-05-5	InterBioScreen Ltd.	STOCK5S-41111			COc1ccccc1NC(=O)CC1C(=O)Nc2c1c(=O)n(C)c(=O)n2C	InChI=1S/C17H18N4O5/c1-20-14-13(16(24)21(2)17(20)25)9(15(23)19-14)8-12(22)18-10-6-4-5-7-11(10)26-3/h4-7,9H,8H2,1-3H3,(H,18,22)(H,19,23)	LAFVQHDPCXQYIG-UHFFFAOYSA-N	358.127719716							109709
AC1NML9N	LSM-21138	BRD-K13002672	5027787	InChI=1S/C27H19N5O2/c33-27(22-16-28-23-12-6-5-11-21(22)23)30-29-15-19-17-32(20-9-2-1-3-10-20)31-26(19)25-14-18-8-4-7-13-24(18)34-25/h1-17,28H,(H,30,33)	OMUNCMNLGJWBIB-UHFFFAOYSA-N	O=C(NN=Cc1cn(nc1c2oc3ccccc3c2)c4ccccc4)c5c[nH]c6ccccc56	BroadT	BRD-K13002672	BRD-K13002672-001-05-2	Enamine Ltd.	T0520-3819			O=C(NN=Cc1cn(nc1-c1cc2ccccc2o1)-c1ccccc1)c1c[nH]c2ccccc12	InChI=1S/C27H19N5O2/c33-27(22-16-28-23-12-6-5-11-21(22)23)30-29-15-19-17-32(20-9-2-1-3-10-20)31-26(19)25-14-18-8-4-7-13-24(18)34-25/h1-17,28H,(H,30,33)	OMUNCMNLGJWBIB-UHFFFAOYSA-N	445.153874898							109710
F0096-0081	LSM-21139	SID4247591, BRD-K66658880	3241783	InChI=1S/C16H13BrN4OS/c1-9-7-10(2)21-14(17)12(19-15(21)18-9)8-23-16-20-11-5-3-4-6-13(11)22-16/h3-7H,8H2,1-2H3	UQDCURYGCLBBAC-UHFFFAOYSA-N	Cc1cc(C)n2c(Br)c(CSc3oc4ccccc4n3)nc2n1	BroadT	BRD-K66658880	BRD-K66658880-001-06-3	ChemDiv Inc.	1488-0144			Cc1cc(C)n2c(Br)c(CSc3nc4ccccc4o3)nc2n1	InChI=1S/C16H13BrN4OS/c1-9-7-10(2)21-14(17)12(19-15(21)18-9)8-23-16-20-11-5-3-4-6-13(11)22-16/h3-7H,8H2,1-2H3	UQDCURYGCLBBAC-UHFFFAOYSA-N	387.999344366							109711
BRD-A29021272	LSM-21140	SID4259413		InChI=1S/C20H20N2O3/c23-21-14-20(22(24)19-9-5-4-8-18(19)21)15-10-12-17(13-11-15)25-16-6-2-1-3-7-16/h1-3,6-7,10-14,18-19H,4-5,8-9H2	QUQPREFMDUPVMG-UHFFFAOYSA-N	[O-][N+]1=CC(=[N+]([O-])C2CCCCC12)c3ccc(Oc4ccccc4)cc3	BroadT	BRD-A29021272	BRD-A29021272-001-05-0	ChemBridge Corporation	7925560			[O-][N+]1=CC(c2ccc(Oc3ccccc3)cc2)=[N+]([O-])C2CCCCC12	InChI=1S/C20H20N2O3/c23-21-14-20(22(24)19-9-5-4-8-18(19)21)15-10-12-17(13-11-15)25-16-6-2-1-3-7-16/h1-3,6-7,10-14,18-19H,4-5,8-9H2	QUQPREFMDUPVMG-UHFFFAOYSA-N	336.14739252							109712
3-[2-(3-Phenoxy-propyl)-2H-tetrazol-5-yl]-pyridine	LSM-21141	SID849979, BRD-K14370374	652487	InChI=1S/C15H15N5O/c1-2-7-14(8-3-1)21-11-5-10-20-18-15(17-19-20)13-6-4-9-16-12-13/h1-4,6-9,12H,5,10-11H2	PUNBVKNEVSHWHX-UHFFFAOYSA-N	C(COc1ccccc1)Cn2nnc(n2)c3cccnc3	BroadT	BRD-K14370374	BRD-K14370374-001-05-3	Asinex Ltd.	ASN 07609885			C(COc1ccccc1)Cn1nnc(n1)-c1cccnc1	InChI=1S/C15H15N5O/c1-2-7-14(8-3-1)21-11-5-10-20-18-15(17-19-20)13-6-4-9-16-12-13/h1-4,6-9,12H,5,10-11H2	PUNBVKNEVSHWHX-UHFFFAOYSA-N	281.12766015							109713
MLS000737954	LSM-21142	SID26664425, BRD-K81832374	223751	InChI=1S/C17H21N5/c1-5-14-19-15(21-17(2,3)4)13-11-18-22(16(13)20-14)12-9-7-6-8-10-12/h6-11H,5H2,1-4H3,(H,19,20,21)	SQVRTCIIPOPEAG-UHFFFAOYSA-N	CCc1nc(NC(C)(C)C)c2cnn(c3ccccc3)c2n1	BroadT	BRD-K81832374	BRD-K81832374-001-05-0	National Cancer Institute Chemotherapeutic Agents Repository	11664			CCc1nc(NC(C)(C)C)c2cnn(-c3ccccc3)c2n1	InChI=1S/C17H21N5/c1-5-14-19-15(21-17(2,3)4)13-11-18-22(16(13)20-14)12-9-7-6-8-10-12/h6-11H,5H2,1-4H3,(H,19,20,21)	SQVRTCIIPOPEAG-UHFFFAOYSA-N	295.179695722							109714
MLS000700096	LSM-21143	SID22412413, BRD-A97406690	4343946	InChI=1S/C20H20N2O4/c1-3-26-19(24)17-13-20(25,16-11-9-14(2)10-12-16)22(21-17)18(23)15-7-5-4-6-8-15/h4-12,25H,3,13H2,1-2H3	ABQRHGHOVQWKHE-UHFFFAOYSA-N	CCOC(=O)C1=NN(C(=O)c2ccccc2)C(O)(C1)c3ccc(C)cc3	BroadT	BRD-A97406690	BRD-A97406690-001-07-0	Specs	AG-690/36660062			CCOC(=O)C1=NN(C(=O)c2ccccc2)C(O)(C1)c1ccc(C)cc1	InChI=1S/C20H20N2O4/c1-3-26-19(24)17-13-20(25,16-11-9-14(2)10-12-16)22(21-17)18(23)15-7-5-4-6-8-15/h4-12,25H,3,13H2,1-2H3	ABQRHGHOVQWKHE-UHFFFAOYSA-N	352.14230714							109715
ASN 04456685	LSM-21144	SID24808134, BRD-K92650255	1175834	InChI=1S/C21H23N3O5S/c1-3-26-18-12-16(24-21(30)22-13-14-7-5-9-28-14)19(27-4-2)11-15(18)23-20(25)17-8-6-10-29-17/h5-12H,3-4,13H2,1-2H3,(H,23,25)(H2,22,24,30)	ODUFWGFYXBTOHL-UHFFFAOYSA-N	CCOc1cc(N=C(S)NCc2occc2)c(OCC)cc1NC(=O)c3occc3	BroadT	BRD-K92650255	BRD-K92650255-001-05-7	Asinex Ltd.	ASN 04456685			CCOc1cc(N=C(S)NCc2ccco2)c(OCC)cc1NC(=O)c1ccco1	InChI=1S/C21H23N3O5S/c1-3-26-18-12-16(24-21(30)22-13-14-7-5-9-28-14)19(27-4-2)11-15(18)23-20(25)17-8-6-10-29-17/h5-12H,3-4,13H2,1-2H3,(H,23,25)(H2,22,24,30)	ODUFWGFYXBTOHL-UHFFFAOYSA-N	429.135841556							109716
AC1LEP18	LSM-21145	BRD-K85305931	739572	InChI=1S/C14H12ClN3O/c15-13-3-1-11(2-4-13)9-14(19)18-17-10-12-5-7-16-8-6-12/h1-8,10H,9H2,(H,18,19)	LOZBKDDHVYZBMU-UHFFFAOYSA-N	Clc1ccc(CC(=O)NN=Cc2ccncc2)cc1	BroadT	BRD-K85305931	BRD-K85305931-001-06-7	Asinex Ltd.	BAS 00696857			Clc1ccc(CC(=O)NN=Cc2ccncc2)cc1	InChI=1S/C14H12ClN3O/c15-13-3-1-11(2-4-13)9-14(19)18-17-10-12-5-7-16-8-6-12/h1-8,10H,9H2,(H,18,19)	LOZBKDDHVYZBMU-UHFFFAOYSA-N	273.066889744							109717
MLS000046288	LSM-21146	SID4251367, BRD-K84023600	3245066	InChI=1S/C22H24N2O5S/c1-14-4-5-17(12-15(14)2)23-22(25)21-16(3)19-13-18(6-7-20(19)29-21)30(26,27)24-8-10-28-11-9-24/h4-7,12-13H,8-11H2,1-3H3,(H,23,25)	WOFAMZWZAGNJDE-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2oc3ccc(cc3c2C)S(=O)(=O)N4CCOCC4)cc1C	BroadT	BRD-K84023600	BRD-K84023600-001-05-9	ChemDiv Inc.	K786-1308			Cc1c(oc2ccc(cc12)S(=O)(=O)N1CCOCC1)C(=O)Nc1ccc(C)c(C)c1	InChI=1S/C22H24N2O5S/c1-14-4-5-17(12-15(14)2)23-22(25)21-16(3)19-13-18(6-7-20(19)29-21)30(26,27)24-8-10-28-11-9-24/h4-7,12-13H,8-11H2,1-3H3,(H,23,25)	WOFAMZWZAGNJDE-UHFFFAOYSA-N	428.140592578							109718
MLS000562937	LSM-21147	SID46500589, SID17385566, BRD-A76169767	5459727	InChI=1S/C27H30ClF3N4O2/c1-25(24(37)33-16-8-15-32-22-21(28)17-20(18-34-22)27(29,30)31)13-14-26(11-6-3-7-12-26)35(25)23(36)19-9-4-2-5-10-19/h2,4-5,9-10,13-14,17-18H,3,6-8,11-12,15-16H2,1H3,(H,32,34)(H,33,37)	XDRZVQDEWUNICW-UHFFFAOYSA-N	CC1(C=CC2(CCCCC2)N1C(=O)c3ccccc3)C(=O)NCCCNc4ncc(cc4Cl)C(F)(F)F	BroadT	BRD-A76169767	BRD-A76169767-001-04-4	University of Pittsburgh CMLD	UPCMLD08ADHK001125			CC1(C=CC2(CCCCC2)N1C(=O)c1ccccc1)C(=O)NCCCNc1ncc(cc1Cl)C(F)(F)F	InChI=1S/C27H30ClF3N4O2/c1-25(24(37)33-16-8-15-32-22-21(28)17-20(18-34-22)27(29,30)31)13-14-26(11-6-3-7-12-26)35(25)23(36)19-9-4-2-5-10-19/h2,4-5,9-10,13-14,17-18H,3,6-8,11-12,15-16H2,1H3,(H,32,34)(H,33,37)	XDRZVQDEWUNICW-UHFFFAOYSA-N	534.20093855							109719
STK223710	LSM-21148	SID17414310, BRD-K57795363	889089	InChI=1S/C20H16N2O2S/c1-13-7-8-18-17(10-13)22-20(24-18)14-4-2-5-15(11-14)21-19(23)12-16-6-3-9-25-16/h2-11H,12H2,1H3,(H,21,23)	OPMWDIBAAWLKQY-UHFFFAOYSA-N	Cc1ccc2oc(nc2c1)c3cccc(NC(=O)Cc4cccs4)c3	BroadT	BRD-K57795363	BRD-K57795363-001-05-2	ChemBridge Corporation	7370988			Cc1ccc2oc(nc2c1)-c1cccc(NC(=O)Cc2cccs2)c1	InChI=1S/C20H16N2O2S/c1-13-7-8-18-17(10-13)22-20(24-18)14-4-2-5-15(11-14)21-19(23)12-16-6-3-9-25-16/h2-11H,12H2,1H3,(H,21,23)	OPMWDIBAAWLKQY-UHFFFAOYSA-N	348.093248462							109720
AC1MFS2C	LSM-21149	BRD-A42823521	2899821	InChI=1S/C16H14N2O2S/c19-15-13-9-3-4-10(12-6-11(9)12)14(13)16(20)18(15)17-7-8-2-1-5-21-8/h1-5,7,9-14H,6H2	OECXUCUSQUVKMW-UHFFFAOYSA-N	O=C1C2C3C=CC(C4CC34)C2C(=O)N1N=Cc5cccs5	BroadT	BRD-A42823521	BRD-A42823521-001-05-1	ChemBridge Corporation	6484170			O=C1C2C(C3C=CC2C2CC32)C(=O)N1N=Cc1cccs1	InChI=1S/C16H14N2O2S/c19-15-13-9-3-4-10(12-6-11(9)12)14(13)16(20)18(15)17-7-8-2-1-5-21-8/h1-5,7,9-14H,6H2	OECXUCUSQUVKMW-UHFFFAOYSA-N	298.077598398							109721
1-[(2,5-Dimethoxyphenyl)sulfonyl]-4-ethylpiperazine	LSM-21150	SID4255337, BRD-K27279217	971615	InChI=1S/C14H22N2O4S/c1-4-15-7-9-16(10-8-15)21(17,18)14-11-12(19-2)5-6-13(14)20-3/h5-6,11H,4,7-10H2,1-3H3	JLENCVNNHJNEOA-UHFFFAOYSA-N	CCN1CCN(CC1)S(=O)(=O)c2cc(OC)ccc2OC	BroadT	BRD-K27279217	BRD-K27279217-001-05-2	ChemBridge Corporation	7825872			CCN1CCN(CC1)S(=O)(=O)c1cc(OC)ccc1OC	InChI=1S/C14H22N2O4S/c1-4-15-7-9-16(10-8-15)21(17,18)14-11-12(19-2)5-6-13(14)20-3/h5-6,11H,4,7-10H2,1-3H3	JLENCVNNHJNEOA-UHFFFAOYSA-N	314.130027894							109722
MLS000683383	LSM-21151	SID22403141, BRD-K46744742	710873	InChI=1S/C16H11N3O5/c20-14(17-10-4-3-5-11(8-10)19(23)24)9-18-15(21)12-6-1-2-7-13(12)16(18)22/h1-8H,9H2,(H,17,20)	IXLBXRJLVSNXEY-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(NC(=O)CN2C(=O)c3ccccc3C2=O)c1	BroadT	BRD-K46744742	BRD-K46744742-001-12-2	ChemBridge Corporation	5991089			[O-][N+](=O)c1cccc(NC(=O)CN2C(=O)c3ccccc3C2=O)c1	InChI=1S/C16H11N3O5/c20-14(17-10-4-3-5-11(8-10)19(23)24)9-18-15(21)12-6-1-2-7-13(12)16(18)22/h1-8H,9H2,(H,17,20)	IXLBXRJLVSNXEY-UHFFFAOYSA-N	325.069870482							109723
1774-11-4	LSM-21152	SID4249625, BRD-K17157813	699513	InChI=1S/C10H10O3/c11-8-4-7(5-9(12)6-8)10-2-1-3-13-10/h1-3,7H,4-6H2	FYLTVHCMIYGVPZ-UHFFFAOYSA-N	O=C1CC(CC(=O)C1)c2occc2	BroadT	BRD-K17157813	BRD-K17157813-001-08-4	InterBioScreen Ltd.	STOCK1S-65710			O=C1CC(CC(=O)C1)c1ccco1	InChI=1S/C10H10O3/c11-8-4-7(5-9(12)6-8)10-2-1-3-13-10/h1-3,7H,4-6H2	FYLTVHCMIYGVPZ-UHFFFAOYSA-N	178.06299418							109724
T5313594	LSM-21153	SID24836447, BRD-K79207701	2460838	InChI=1S/C19H21N3O2S/c1-24-17-9-7-16(8-10-17)20-19(25)22-13-11-21(12-14-22)18(23)15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H,20,25)	FLGJWXLAVXGUGC-UHFFFAOYSA-N	COc1ccc(NC(=S)N2CCN(CC2)C(=O)c3ccccc3)cc1	BroadT	BRD-K79207701	BRD-K79207701-001-06-1	Enamine Ltd.	T5313594			COc1ccc(NC(=S)N2CCN(CC2)C(=O)c2ccccc2)cc1	InChI=1S/C19H21N3O2S/c1-24-17-9-7-16(8-10-17)20-19(25)22-13-11-21(12-14-22)18(23)15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H,20,25)	FLGJWXLAVXGUGC-UHFFFAOYSA-N	355.135447632							109725
ASN 04427581	LSM-21154	SID26668331, SID847681, BRD-K05056349	650090	InChI=1S/C20H17FN4O3S2/c1-23-17-16(18(27)24(2)20(23)28)25(10-12-5-7-13(21)8-6-12)19(22-17)30-11-14(26)15-4-3-9-29-15/h3-9H,10-11H2,1-2H3	LDAMUYGSAJJUBT-UHFFFAOYSA-N	CN1C(=O)N(C)c2nc(SCC(=O)c3cccs3)n(Cc4ccc(F)cc4)c2C1=O	BroadT	BRD-K05056349	BRD-K05056349-001-05-1	Asinex Ltd.	ASN 04427581			Cn1c2nc(SCC(=O)c3cccs3)n(Cc3ccc(F)cc3)c2c(=O)n(C)c1=O	InChI=1S/C20H17FN4O3S2/c1-23-17-16(18(27)24(2)20(23)28)25(10-12-5-7-13(21)8-6-12)19(22-17)30-11-14(26)15-4-3-9-29-15/h3-9H,10-11H2,1-2H3	LDAMUYGSAJJUBT-UHFFFAOYSA-N	444.072610024							109726
SMR000044853	LSM-21155	SID862809, BRD-K07177450	664042	InChI=1S/C22H24N4O5/c1-14-5-6-15-16(12-14)23-20(22(29)30-2)19(15)24-18(27)13-25-7-9-26(10-8-25)21(28)17-4-3-11-31-17/h3-6,11-12,23H,7-10,13H2,1-2H3,(H,24,27)	TVUZUPRVECIGSD-UHFFFAOYSA-N	COC(=O)c1[nH]c2cc(C)ccc2c1NC(=O)CN3CCN(CC3)C(=O)c4occc4	BroadT	BRD-K07177450	BRD-K07177450-001-05-8	InterBioScreen Ltd.	STOCK4S-53846			COC(=O)c1[nH]c2cc(C)ccc2c1NC(=O)CN1CCN(CC1)C(=O)c1ccco1	InChI=1S/C22H24N4O5/c1-14-5-6-15-16(12-14)23-20(22(29)30-2)19(15)24-18(27)13-25-7-9-26(10-8-25)21(28)17-4-3-11-31-17/h3-6,11-12,23H,7-10,13H2,1-2H3,(H,24,27)	TVUZUPRVECIGSD-UHFFFAOYSA-N	424.174669908							109727
MLS000586656	LSM-21156	SID17505296, BRD-K65987339	4194881	InChI=1S/C22H27N3O5S2/c1-4-5-10-24-32(27,28)15-8-9-18-16(12-15)17(22(26)23-14-21(29-2)30-3)13-19(25-18)20-7-6-11-31-20/h6-9,11-13,21,24H,4-5,10,14H2,1-3H3,(H,23,26)	YLXOIVVLOFESKD-UHFFFAOYSA-N	CCCCNS(=O)(=O)c1ccc2nc(cc(C(=O)NCC(OC)OC)c2c1)c3cccs3	BroadT	BRD-K65987339	BRD-K65987339-001-03-1	ChemDiv Inc.	K788-9688			CCCCNS(=O)(=O)c1ccc2nc(cc(C(=O)NCC(OC)OC)c2c1)-c1cccs1	InChI=1S/C22H27N3O5S2/c1-4-5-10-24-32(27,28)15-8-9-18-16(12-15)17(22(26)23-14-21(29-2)30-3)13-19(25-18)20-7-6-11-31-20/h6-9,11-13,21,24H,4-5,10,14H2,1-3H3,(H,23,26)	YLXOIVVLOFESKD-UHFFFAOYSA-N	477.139212374							109728
AC1LRTRZ	LSM-21157	SID24780638, BRD-K30209183	1453301	InChI=1S/C23H25N3O2/c1-16-8-7-9-17(14-16)23(28)26(18-10-3-2-4-11-18)15-21-24-20-13-6-5-12-19(20)22(27)25-21/h5-9,12-14,18H,2-4,10-11,15H2,1H3,(H,24,25,27)	PRKQBVQZSNFNAS-UHFFFAOYSA-N	Cc1cccc(c1)C(=O)N(Cc2nc(O)c3ccccc3n2)C4CCCCC4	BroadT	BRD-K30209183	BRD-K30209183-001-05-4	Asinex Ltd.	ASN 05812488			Cc1cccc(c1)C(=O)N(Cc1nc(O)c2ccccc2n1)C1CCCCC1	InChI=1S/C23H25N3O2/c1-16-8-7-9-17(14-16)23(28)26(18-10-3-2-4-11-18)15-21-24-20-13-6-5-12-19(20)22(27)25-21/h5-9,12-14,18H,2-4,10-11,15H2,1H3,(H,24,25,27)	PRKQBVQZSNFNAS-UHFFFAOYSA-N	375.19467707							109729
SMR000036043	LSM-21158	SID858746, BRD-K97584676	660052	InChI=1S/C23H21N3O2S/c1-15-7-2-4-9-18(15)25-21(27)14-29-23-17(13-24)22(20-11-6-12-28-20)16-8-3-5-10-19(16)26-23/h2,4,6-7,9,11-12H,3,5,8,10,14H2,1H3,(H,25,27)	WTFVDPWAUMHNLS-UHFFFAOYSA-N	Cc1ccccc1NC(=O)CSc2nc3CCCCc3c(c4occc4)c2C#N	BroadT	BRD-K97584676	BRD-K97584676-001-05-4	InterBioScreen Ltd.	STOCK2S-62905			Cc1ccccc1NC(=O)CSc1nc2CCCCc2c(-c2ccco2)c1C#N	InChI=1S/C23H21N3O2S/c1-15-7-2-4-9-18(15)25-21(27)14-29-23-17(13-24)22(20-11-6-12-28-20)16-8-3-5-10-19(16)26-23/h2,4,6-7,9,11-12H,3,5,8,10,14H2,1H3,(H,25,27)	WTFVDPWAUMHNLS-UHFFFAOYSA-N	403.135447632							109730
MLS001003740	LSM-21159	SID24829583, BRD-K14162210	2314952	InChI=1S/C15H18N4O3/c1-15(2,3)10-7-5-9(6-8-10)12(20)17-14-16-11(18-19-14)13(21)22-4/h5-8H,1-4H3,(H2,16,17,18,19,20)	LVKKWCOINMSBPK-UHFFFAOYSA-N	COC(=O)c1n[nH]c(NC(=O)c2ccc(cc2)C(C)(C)C)n1	BroadT	BRD-K14162210	BRD-K14162210-001-06-0	Enamine Ltd.	T0503-0536			COC(=O)c1n[nH]c(NC(=O)c2ccc(cc2)C(C)(C)C)n1	InChI=1S/C15H18N4O3/c1-15(2,3)10-7-5-9(6-8-10)12(20)17-14-16-11(18-19-14)13(21)22-4/h5-8H,1-4H3,(H2,16,17,18,19,20)	LVKKWCOINMSBPK-UHFFFAOYSA-N	302.137890476							109731
3-[5,6-Bis-(4-methoxy-phenyl)-furo[2,3-d]pyrimidin-4-ylamino]-propan-1-ol	LSM-21160	SID49644280, BRD-K92964966	3145239	InChI=1S/C23H23N3O4/c1-28-17-8-4-15(5-9-17)19-20-22(24-12-3-13-27)25-14-26-23(20)30-21(19)16-6-10-18(29-2)11-7-16/h4-11,14,27H,3,12-13H2,1-2H3,(H,24,25,26)	NPOZFKXPQMRTAM-UHFFFAOYSA-N	COc1ccc(cc1)c2oc3ncnc(NCCCO)c3c2c4ccc(OC)cc4	BroadT	BRD-K92964966	BRD-K92964966-001-05-2	Asinex Ltd.	BAS 03072473			COc1ccc(cc1)-c1oc2ncnc(NCCCO)c2c1-c1ccc(OC)cc1	InChI=1S/C23H23N3O4/c1-28-17-8-4-15(5-9-17)19-20-22(24-12-3-13-27)25-14-26-23(20)30-21(19)16-6-10-18(29-2)11-7-16/h4-11,14,27H,3,12-13H2,1-2H3,(H,24,25,26)	NPOZFKXPQMRTAM-UHFFFAOYSA-N	405.168856246							109732
MLS000064192	LSM-21161	SID4259848, BRD-K11090775	947363	InChI=1S/C18H19NO6/c1-11-4-6-13(25-11)7-9-16(20)19-15-10-12(17(21)23-2)5-8-14(15)18(22)24-3/h4-6,8,10H,7,9H2,1-3H3,(H,19,20)	WPNRKSLKGMWAJF-UHFFFAOYSA-N	COC(=O)c1ccc(C(=O)OC)c(NC(=O)CCc2oc(C)cc2)c1	BroadT	BRD-K11090775	BRD-K11090775-001-06-3	ChemBridge Corporation	7767619			COC(=O)c1ccc(C(=O)OC)c(NC(=O)CCc2ccc(C)o2)c1	InChI=1S/C18H19NO6/c1-11-4-6-13(25-11)7-9-16(20)19-15-10-12(17(21)23-2)5-8-14(15)18(22)24-3/h4-6,8,10H,7,9H2,1-3H3,(H,19,20)	WPNRKSLKGMWAJF-UHFFFAOYSA-N	345.121237338							109733
BDBM89589	LSM-21162	BRD-A77728002	91899147	InChI=1S/C29H27N3O5/c1-20-6-2-3-7-22(20)18-37-23-11-9-21(10-12-23)27(33)25-26(24-8-4-17-36-24)32(29(35)28(25)34)15-5-14-31-16-13-30-19-31/h2-4,6-13,16-17,19,25-26H,5,14-15,18H2,1H3	HDSNOFDRPPUGLN-UHFFFAOYSA-N	Cc1ccccc1COc2ccc(cc2)C(=O)C3C(N(CCCn4ccnc4)C(=O)C3=O)c5occc5	BroadT	BRD-A77728002	BRD-A77728002-001-05-8	InterBioScreen Ltd.	STOCK4S-31732			Cc1ccccc1COc1ccc(cc1)C(=O)C1C(N(CCCn2ccnc2)C(=O)C1=O)c1ccco1	InChI=1S/C29H27N3O5/c1-20-6-2-3-7-22(20)18-37-23-11-9-21(10-12-23)27(33)25-26(24-8-4-17-36-24)32(29(35)28(25)34)15-5-14-31-16-13-30-19-31/h2-4,6-13,16-17,19,25-26H,5,14-15,18H2,1H3	HDSNOFDRPPUGLN-UHFFFAOYSA-N	497.195070994							109734
AC1LKRAV	LSM-21163	BRD-K18347729	996569	InChI=1S/C26H29N5O3/c1-16-8-7-9-17(2)25(16)31-19(4)11-21(20(31)5)13-28-30-24(32)15-34-26-23(12-27)22(14-33-6)10-18(3)29-26/h7-11,13H,14-15H2,1-6H3,(H,30,32)	MMINSLKCRLIUGO-UHFFFAOYSA-N	COCc1cc(C)nc(OCC(=O)NN=Cc2cc(C)n(c2C)c3c(C)cccc3C)c1C#N	BroadT	BRD-K18347729	BRD-K18347729-001-05-9	Specs	AN-988/40680137			COCc1cc(C)nc(OCC(=O)NN=Cc2cc(C)n(c2C)-c2c(C)cccc2C)c1C#N	InChI=1S/C26H29N5O3/c1-16-8-7-9-17(2)25(16)31-19(4)11-21(20(31)5)13-28-30-24(32)15-34-26-23(12-27)22(14-33-6)10-18(3)29-26/h7-11,13H,14-15H2,1-6H3,(H,30,32)	MMINSLKCRLIUGO-UHFFFAOYSA-N	459.227039838							109735
MLS000688088	LSM-21164	SID24817346, BRD-A03895395	3170657	InChI=1S/C22H22N2O3S/c1-26-18-11-9-16(10-12-18)20-15-28-22(23-20)24(14-19-8-5-13-27-19)21(25)17-6-3-2-4-7-17/h2-4,6-7,9-12,15,19H,5,8,13-14H2,1H3	CYYJCFMSSVQPCR-UHFFFAOYSA-N	COc1ccc(cc1)c2csc(n2)N(CC3CCCO3)C(=O)c4ccccc4	BroadT	BRD-A03895395	BRD-A03895395-001-06-7	Asinex Ltd.	ASN 03269884			COc1ccc(cc1)-c1csc(n1)N(CC1CCCO1)C(=O)c1ccccc1	InChI=1S/C22H22N2O3S/c1-26-18-11-9-16(10-12-18)20-15-28-22(23-20)24(14-19-8-5-13-27-19)21(25)17-6-3-2-4-7-17/h2-4,6-7,9-12,15,19H,5,8,13-14H2,1H3	CYYJCFMSSVQPCR-UHFFFAOYSA-N	394.135113274							109736
SMR000206589	LSM-21165	SID17509591, BRD-K02308976	4091869	InChI=1S/C21H25N2O5P/c1-3-26-29(24,27-4-2)20-21(23-12-14-25-15-13-23)28-19(22-20)18-11-7-9-16-8-5-6-10-17(16)18/h5-11H,3-4,12-15H2,1-2H3	HSFMETJHHSSNFA-UHFFFAOYSA-N	CCOP(=O)(OCC)c1nc(oc1N2CCOCC2)c3cccc4ccccc34	BroadT	BRD-K02308976	BRD-K02308976-001-05-9	ChemDiv Inc.	D055-0319			CCOP(=O)(OCC)c1nc(oc1N1CCOCC1)-c1cccc2ccccc12	InChI=1S/C21H25N2O5P/c1-3-26-29(24,27-4-2)20-21(23-12-14-25-15-13-23)28-19(22-20)18-11-7-9-16-8-5-6-10-17(16)18/h5-11H,3-4,12-15H2,1-2H3	HSFMETJHHSSNFA-UHFFFAOYSA-N	416.15010843							109737
MLS000760992	LSM-21166	SID24841134, BRD-K53407273	2490212	InChI=1S/C18H16N4O3S2/c1-11-3-2-4-14(9-11)20-17-21-22-18(27-17)26-10-15(23)19-13-7-5-12(6-8-13)16(24)25/h2-9H,10H2,1H3,(H,19,23)(H,20,21)(H,24,25)	LFEVDFNYMWKMJP-UHFFFAOYSA-N	Cc1cccc(Nc2nnc(SCC(=O)Nc3ccc(cc3)C(=O)O)s2)c1	BroadT	BRD-K53407273	BRD-K53407273-001-05-7	Enamine Ltd.	T5314557			Cc1cccc(Nc2nnc(SCC(=O)Nc3ccc(cc3)C(O)=O)s2)c1	InChI=1S/C18H16N4O3S2/c1-11-3-2-4-14(9-11)20-17-21-22-18(27-17)26-10-15(23)19-13-7-5-12(6-8-13)16(24)25/h2-9H,10H2,1H3,(H,19,23)(H,20,21)(H,24,25)	LFEVDFNYMWKMJP-UHFFFAOYSA-N	400.066381792							109738
3-Acetyl-6-bromo-2-methylquinoline-4-carboxylic acid	LSM-21167	SID7967671, BRD-K14712469	3623814	InChI=1S/C13H10BrNO3/c1-6-11(7(2)16)12(13(17)18)9-5-8(14)3-4-10(9)15-6/h3-5H,1-2H3,(H,17,18)	NYMTZNXTKIERCU-UHFFFAOYSA-N	CC(=O)c1c(C)nc2ccc(Br)cc2c1C(=O)O	BroadT	BRD-K14712469	BRD-K14712469-001-04-5	ChemDiv Inc.	6921-0002			CC(=O)c1c(C)nc2ccc(Br)cc2c1C(O)=O	InChI=1S/C13H10BrNO3/c1-6-11(7(2)16)12(13(17)18)9-5-8(14)3-4-10(9)15-6/h3-5H,1-2H3,(H,17,18)	NYMTZNXTKIERCU-UHFFFAOYSA-N	306.98440579							109739
SMR000046425	LSM-21168	SID864054, BRD-K16324754	665305	InChI=1S/C16H18N4O/c1-4-5-14(21)18-15-12-9-11-7-6-10(2)8-13(11)17-16(12)20(3)19-15/h6-9H,4-5H2,1-3H3,(H,18,19,21)	KIWKLFHHVGFZFN-UHFFFAOYSA-N	CCCC(=O)Nc1nn(C)c2nc3cc(C)ccc3cc12	BroadT	BRD-K16324754	BRD-K16324754-001-03-3	InterBioScreen Ltd.	STOCK5S-02185			CCCC(=O)Nc1nn(C)c2nc3cc(C)ccc3cc12	InChI=1S/C16H18N4O/c1-4-5-14(21)18-15-12-9-11-7-6-10(2)8-13(11)17-16(12)20(3)19-15/h6-9H,4-5H2,1-3H3,(H,18,19,21)	KIWKLFHHVGFZFN-UHFFFAOYSA-N	282.148061236							109740
MLS000806914	LSM-21169	SID26664144, BRD-A40654873	4356534	InChI=1S/C22H20ClN3O5/c1-30-14-7-8-16-13(10-14)11-15(22(23)24-16)18-12-17(19-4-3-9-31-19)25-26(18)20(27)5-2-6-21(28)29/h3-4,7-11,18H,2,5-6,12H2,1H3,(H,28,29)	HLSPTDWBJQDVGR-UHFFFAOYSA-N	COc1ccc2nc(Cl)c(cc2c1)C3CC(=NN3C(=O)CCCC(=O)O)c4occc4	BroadT	BRD-A40654873	BRD-A40654873-001-05-6	InterBioScreen Ltd.	STOCK3S-37563			COc1ccc2nc(Cl)c(cc2c1)C1CC(=NN1C(=O)CCCC(O)=O)c1ccco1	InChI=1S/C22H20ClN3O5/c1-30-14-7-8-16-13(10-14)11-15(22(23)24-16)18-12-17(19-4-3-9-31-19)25-26(18)20(27)5-2-6-21(28)29/h3-4,7-11,18H,2,5-6,12H2,1H3,(H,28,29)	HLSPTDWBJQDVGR-UHFFFAOYSA-N	441.10914848							109741
MLS-0315821.0002	LSM-3022	BRD-K46285453, SID56373753, SID56373769, SID85147388	807820	InChI=1S/C9H7FN4O/c10-7-3-1-2-6(4-7)8(15)13-9-11-5-12-14-9/h1-5H,(H2,11,12,13,14,15)	AQERYHSAKUBTEX-UHFFFAOYSA-N	Fc1cccc(c1)C(=O)Nc2nc[nH]n2	BroadT	BRD-K46285453	BRD-K46285453-001-04-2	Sanford-Burnham Medical Research Institute	3-fluoro-N-1H-1,2,4-triazol-3-ylbenzamide MLS-0315821.0002			Fc1cccc(c1)C(=O)Nc1nc[nH]n1	InChI=1S/C9H7FN4O/c10-7-3-1-2-6(4-7)8(15)13-9-11-5-12-14-9/h1-5H,(H2,11,12,13,14,15)	AQERYHSAKUBTEX-UHFFFAOYSA-N	206.060389084							92810
MLS000520942	LSM-21170	SID14734100, BRD-K55494798	3448551	InChI=1S/C12H10Cl2N4O2S/c1-20-11(19)7-5-15-18-10(7)17-12(21)16-6-2-3-8(13)9(14)4-6/h2-5H,1H3,(H3,15,16,17,18,21)	DDCFFLWLRNIQJS-UHFFFAOYSA-N	COC(=O)c1c[nH]nc1N=C(S)Nc2ccc(Cl)c(Cl)c2	BroadT	BRD-K55494798	BRD-K55494798-001-06-7	ChemDiv Inc.	K781-0327			COC(=O)c1c[nH]nc1N=C(S)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C12H10Cl2N4O2S/c1-20-11(19)7-5-15-18-10(7)17-12(21)16-6-2-3-8(13)9(14)4-6/h2-5H,1H3,(H3,15,16,17,18,21)	DDCFFLWLRNIQJS-UHFFFAOYSA-N	343.99015171							109742
AC1MXB33	LSM-21171	BRD-K84101661	3762817	InChI=1S/C11H11N3OS/c1-14-7-8-16-11(14)13-10(15)12-9-5-3-2-4-6-9/h2-8H,1H3,(H,12,15)	KWALDNQIQIFHQI-UHFFFAOYSA-N	CN1C=CSC1=NC(=O)Nc2ccccc2	BroadT	BRD-K84101661	BRD-K84101661-001-05-9	Key Organics Ltd.	MS-3271			Cn1ccsc1=NC(=O)Nc1ccccc1	InChI=1S/C11H11N3OS/c1-14-7-8-16-11(14)13-10(15)12-9-5-3-2-4-6-9/h2-8H,1H3,(H,12,15)	KWALDNQIQIFHQI-UHFFFAOYSA-N	233.062282692							109743
MLS000085412	LSM-21172	SID4252385, BRD-K27588880	3245944	InChI=1S/C14H12F3N5O2/c1-3-21-6-8(7(2)19-21)9-4-11(14(15,16)17)22-12(18-9)5-10(20-22)13(23)24/h4-6H,3H2,1-2H3,(H,23,24)	DSWAZXIQQUTGLD-UHFFFAOYSA-N	CCn1cc(c(C)n1)c2cc(n3nc(cc3n2)C(=O)O)C(F)(F)F	BroadT	BRD-K27588880	BRD-K27588880-001-05-2	ChemDiv Inc.	6049-0144			CCn1cc(c(C)n1)-c1cc(n2nc(cc2n1)C(O)=O)C(F)(F)F	InChI=1S/C14H12F3N5O2/c1-3-21-6-8(7(2)19-21)9-4-11(14(15,16)17)22-12(18-9)5-10(20-22)13(23)24/h4-6H,3H2,1-2H3,(H,23,24)	DSWAZXIQQUTGLD-UHFFFAOYSA-N	339.094309274							109744
AC1NOCQR	LSM-21173	SID22402468, BRD-A50043445	5136089	InChI=1S/C23H27N3O3S2/c1-5-29-23(28)20-15(3)19-21(25-16(4)26-22(19)31-20)30-13-18(27)24-14(2)11-12-17-9-7-6-8-10-17/h6-10,14H,5,11-13H2,1-4H3,(H,24,27)	YZXJKUSVBRYWQK-UHFFFAOYSA-N	CCOC(=O)c1sc2nc(C)nc(SCC(=O)NC(C)CCc3ccccc3)c2c1C	BroadT	BRD-A50043445	BRD-A50043445-001-05-8	Enamine Ltd.	T5286512			CCOC(=O)c1sc2nc(C)nc(SCC(=O)NC(C)CCc3ccccc3)c2c1C	InChI=1S/C23H27N3O3S2/c1-5-29-23(28)20-15(3)19-21(25-16(4)26-22(19)31-20)30-13-18(27)24-14(2)11-12-17-9-7-6-8-10-17/h6-10,14H,5,11-13H2,1-4H3,(H,24,27)	YZXJKUSVBRYWQK-UHFFFAOYSA-N	457.149383134							109745
1-((2-Nitrophenyl)sulfonyl)piperidine	LSM-21174	SID17505227, BRD-K94788358	796971	InChI=1S/C11H14N2O4S/c14-13(15)10-6-2-3-7-11(10)18(16,17)12-8-4-1-5-9-12/h2-3,6-7H,1,4-5,8-9H2	AACRWZVDRSTLKY-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1S(=O)(=O)N2CCCCC2	BroadT	BRD-K94788358	BRD-K94788358-001-05-9	Asinex Ltd.	BAS 00861142			[O-][N+](=O)c1ccccc1S(=O)(=O)N1CCCCC1	InChI=1S/C11H14N2O4S/c14-13(15)10-6-2-3-7-11(10)18(16,17)12-8-4-1-5-9-12/h2-3,6-7H,1,4-5,8-9H2	AACRWZVDRSTLKY-UHFFFAOYSA-N	270.067427638							109746
N~3~-(2,4-dimethylphenyl)-n~1~-phenyl-1H-pyrazole-1,3-dicarboxamide	LSM-21175	SID24782805, BRD-K80007769	5219026	InChI=1S/C19H18N4O2/c1-13-8-9-16(14(2)12-13)21-18(24)17-10-11-23(22-17)19(25)20-15-6-4-3-5-7-15/h3-12H,1-2H3,(H,20,25)(H,21,24)	PQJCMDLWTYZJFV-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2ccn(n2)C(=O)Nc3ccccc3)c(C)c1	BroadT	BRD-K80007769	BRD-K80007769-001-05-3	ChemDiv Inc.	3647-5257			Cc1ccc(NC(=O)c2ccn(n2)C(=O)Nc2ccccc2)c(C)c1	InChI=1S/C19H18N4O2/c1-13-8-9-16(14(2)12-13)21-18(24)17-10-11-23(22-17)19(25)20-15-6-4-3-5-7-15/h3-12H,1-2H3,(H,20,25)(H,21,24)	PQJCMDLWTYZJFV-UHFFFAOYSA-N	334.142975856							109747
SMR000030747	LSM-21176	BRD-A69196860, SID24838205, SID4250981	3244725	InChI=1S/C28H42N4O2/c1-20-16-21(2)18-32(17-20)13-7-12-29-27(33)24-10-14-31(15-11-24)19-26-23(4)34-28(30-26)25-9-6-5-8-22(25)3/h5-6,8-9,20-21,24H,7,10-19H2,1-4H3,(H,29,33)	MRHJNIMUABLZHR-UHFFFAOYSA-N	CC1CC(C)CN(CCCNC(=O)C2CCN(Cc3nc(oc3C)c4ccccc4C)CC2)C1	BroadT	BRD-A69196860	BRD-A69196860-001-05-9	ChemDiv Inc.	C522-0902			CC1CC(C)CN(CCCNC(=O)C2CCN(Cc3nc(oc3C)-c3ccccc3C)CC2)C1	InChI=1S/C28H42N4O2/c1-20-16-21(2)18-32(17-20)13-7-12-29-27(33)24-10-14-31(15-11-24)19-26-23(4)34-28(30-26)25-9-6-5-8-22(25)3/h5-6,8-9,20-21,24H,7,10-19H2,1-4H3,(H,29,33)	MRHJNIMUABLZHR-UHFFFAOYSA-N	466.330776624							109748
BRD-A56657521	LSM-21177			InChI=1S/C26H28N4O6/c1-32-18-10-9-14(11-19(18)33-2)23-22-16(7-6-8-17(22)31)27-26-28-25(29-30(23)26)15-12-20(34-3)24(36-5)21(13-15)35-4/h9-13,22-23H,6-8H2,1-5H3	NASQBAFZWBTLQN-UHFFFAOYSA-N	COc1ccc(cc1OC)C2C3C(=O)CCCC3=Nc4nc(nn24)c5cc(OC)c(OC)c(OC)c5	BroadT	BRD-A56657521	BRD-A56657521-001-05-6	ChemDiv Inc.	5225-4088			COc1ccc(cc1OC)C1C2C(=O)CCCC2=Nc2nc(nn12)-c1cc(OC)c(OC)c(OC)c1	InChI=1S/C26H28N4O6/c1-32-18-10-9-14(11-19(18)33-2)23-22-16(7-6-8-17(22)31)27-26-28-25(29-30(23)26)15-12-20(34-3)24(36-5)21(13-15)35-4/h9-13,22-23H,6-8H2,1-5H3	NASQBAFZWBTLQN-UHFFFAOYSA-N	492.200884656							109749
MLS000763219	LSM-21178	SID26662405, BRD-K15623320	1862923	InChI=1S/C17H18ClN3O/c1-9(2)7-12-10-5-3-4-6-11(10)13-14-15(22-17(13)21-12)16(18)20-8-19-14/h8-9H,3-7H2,1-2H3	GJYHXNUFBHVTSK-UHFFFAOYSA-N	CC(C)Cc1nc2oc3c(Cl)ncnc3c2c4CCCCc14	BroadT	BRD-K15623320	BRD-K15623320-001-06-7	InterBioScreen Ltd.	STOCK5S-42571			CC(C)Cc1nc2oc3c(Cl)ncnc3c2c2CCCCc12	InChI=1S/C17H18ClN3O/c1-9(2)7-12-10-5-3-4-6-11(10)13-14-15(22-17(13)21-12)16(18)20-8-19-14/h8-9H,3-7H2,1-2H3	GJYHXNUFBHVTSK-UHFFFAOYSA-N	315.113839936							109750
2-(3-Acetyl-thioureido)-5-ethyl-thiophene-3-carboxylic acid ethyl ester	LSM-21179	SID17408496, BRD-K82852127	786620	InChI=1S/C12H16N2O3S2/c1-4-8-6-9(11(16)17-5-2)10(19-8)14-12(18)13-7(3)15/h6H,4-5H2,1-3H3,(H2,13,14,15,18)	ZEEQQOSXJRSPPM-UHFFFAOYSA-N	CCOC(=O)c1cc(CC)sc1NC(=S)NC(=O)C	BroadT	BRD-K82852127	BRD-K82852127-001-05-7	Asinex Ltd.	BAS 00796096			CCOC(=O)c1cc(CC)sc1NC(=S)NC(C)=O	InChI=1S/C12H16N2O3S2/c1-4-8-6-9(11(16)17-5-2)10(19-8)14-12(18)13-7(3)15/h6H,4-5H2,1-3H3,(H2,13,14,15,18)	ZEEQQOSXJRSPPM-UHFFFAOYSA-N	300.060233772							109751
5-Methyl-6-phenylthieno[2,3-d]pyrimidine-4(3H)-thione	LSM-21180	SID24821202, BRD-K01914170	712206	InChI=1S/C13H10N2S2/c1-8-10-12(16)14-7-15-13(10)17-11(8)9-5-3-2-4-6-9/h2-7H,1H3,(H,14,15,16)	GPWGHFYBLZAHLA-UHFFFAOYSA-N	Cc1c(sc2ncnc(S)c12)c3ccccc3	BroadT	BRD-K01914170	BRD-K01914170-001-05-9	ChemDiv Inc.	8013-6108			Cc1c(sc2ncnc(S)c12)-c1ccccc1	InChI=1S/C13H10N2S2/c1-8-10-12(16)14-7-15-13(10)17-11(8)9-5-3-2-4-6-9/h2-7H,1H3,(H,14,15,16)	GPWGHFYBLZAHLA-UHFFFAOYSA-N	258.02853972							109752
SMR000199786	LSM-21181	SID17415553, BRD-K50292362	2205503	InChI=1S/C20H25NOS2/c1-16-7-9-19(10-8-16)24-13-11-20(22)21-12-14-23-15-18-6-4-3-5-17(18)2/h3-10H,11-15H2,1-2H3,(H,21,22)	RMPQMISLVWLPCK-UHFFFAOYSA-N	Cc1ccc(SCCC(=O)NCCSCc2ccccc2C)cc1	BroadT	BRD-K50292362	BRD-K50292362-001-05-8	ChemBridge Corporation	7788359			Cc1ccc(SCCC(=O)NCCSCc2ccccc2C)cc1	InChI=1S/C20H25NOS2/c1-16-7-9-19(10-8-16)24-13-11-20(22)21-12-14-23-15-18-6-4-3-5-17(18)2/h3-10H,11-15H2,1-2H3,(H,21,22)	RMPQMISLVWLPCK-UHFFFAOYSA-N	359.13775581							109753
AC1OAPGU	LSM-21182	SID17401579, BRD-A07703688	6808281	InChI=1S/C27H24ClN3O5S/c1-35-18-10-12-24(36-2)20(14-18)23-15-22(30-31(23)37(3,33)34)26-25(16-7-5-4-6-8-16)19-13-17(28)9-11-21(19)29-27(26)32/h4-14,23H,15H2,1-3H3,(H,29,32)	XQUUEDZHVNSTCV-UHFFFAOYSA-N	COc1ccc(OC)c(c1)C2CC(=NN2S(=O)(=O)C)c3c(O)nc4ccc(Cl)cc4c3c5ccccc5	BroadT	BRD-A07703688	BRD-A07703688-001-05-7	InterBioScreen Ltd.	STOCK2S-86256			COc1ccc(OC)c(c1)C1CC(=NN1S(C)(=O)=O)c1c(O)nc2ccc(Cl)cc2c1-c1ccccc1	InChI=1S/C27H24ClN3O5S/c1-35-18-10-12-24(36-2)20(14-18)23-15-22(30-31(23)37(3,33)34)26-25(16-7-5-4-6-8-16)19-13-17(28)9-11-21(19)29-27(26)32/h4-14,23H,15H2,1-3H3,(H,29,32)	XQUUEDZHVNSTCV-UHFFFAOYSA-N	537.112519298							
1-(4-Bromophenyl)-4-methyl-1H-pyrazol-3-ol	LSM-21183	BRD-K97107694	687960	InChI=1S/C10H9BrN2O/c1-7-6-13(12-10(7)14)9-4-2-8(11)3-5-9/h2-6H,1H3,(H,12,14)	MASVYRJFLZAGNC-UHFFFAOYSA-N	Cc1cn(nc1O)c2ccc(Br)cc2	BroadT	BRD-K97107694	BRD-K97107694-001-05-2	ChemBridge Corporation	7955098			Cc1cn(nc1O)-c1ccc(Br)cc1	InChI=1S/C10H9BrN2O/c1-7-6-13(12-10(7)14)9-4-2-8(11)3-5-9/h2-6H,1H3,(H,12,14)	MASVYRJFLZAGNC-UHFFFAOYSA-N	251.989825528							109755
MLS000806933	LSM-43918	SID26658848, BRD-K28931458	1611092	InChI=1S/C16H15NO4S2/c1-2-9-21-12-5-3-11(4-6-12)10-13-15(20)17(16(22)23-13)8-7-14(18)19/h2-6,10H,1,7-9H2,(H,18,19)/b13-10-	AEZGVSCOIZTTBC-RAXLEYEMSA-N	OC(=O)CCN1C(=S)S\C(=C/c2ccc(OCC=C)cc2)\C1=O	BroadT	BRD-K28931458	BRD-K28931458-001-09-7	InterBioScreen Ltd.	STOCK3S-36214			OC(=O)CCN1C(=S)S\C(C1=O)=C/c1ccc(OCC=C)cc1	InChI=1S/C16H15NO4S2/c1-2-9-21-12-5-3-11(4-6-12)10-13-15(20)17(16(22)23-13)8-7-14(18)19/h2-6,10H,1,7-9H2,(H,18,19)/b13-10-	AEZGVSCOIZTTBC-RAXLEYEMSA-N	349.04424935							
AC1MLC16	LSM-21185	SID24808374, BRD-A34077069	3192429	InChI=1S/C18H18N2O2S/c1-22-17(21)13-6-9-14(10-7-13)19-18(23)20-16-11-8-12-4-2-3-5-15(12)16/h2-7,9-10,16H,8,11H2,1H3,(H2,19,20,23)	FWRVALXMNQZUCK-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=NC2CCc3ccccc23)S)cc1	BroadT	BRD-A34077069	BRD-A34077069-001-05-2	Asinex Ltd.	ASN 04935769			COC(=O)c1ccc(NC(S)=NC2CCc3ccccc23)cc1	InChI=1S/C18H18N2O2S/c1-22-17(21)13-6-9-14(10-7-13)19-18(23)20-16-11-8-12-4-2-3-5-15(12)16/h2-7,9-10,16H,8,11H2,1H3,(H2,19,20,23)	FWRVALXMNQZUCK-UHFFFAOYSA-N	326.108898526							109757
AC1LFAQG	LSM-21186	SID17511735, BRD-K48879817	750693	InChI=1S/C14H13N3S/c15-8-10-13(12-6-3-7-18-12)9-4-1-2-5-11(9)17-14(10)16/h3,6-7H,1-2,4-5H2,(H2,16,17)	FTKATHYCSFVXJI-UHFFFAOYSA-N	Nc1nc2CCCCc2c(c3cccs3)c1C#N	BroadT	BRD-K48879817	BRD-K48879817-001-05-8	InterBioScreen Ltd.	STOCK1S-27625			Nc1nc2CCCCc2c(-c2cccs2)c1C#N	InChI=1S/C14H13N3S/c15-8-10-13(12-6-3-7-18-12)9-4-1-2-5-11(9)17-14(10)16/h3,6-7H,1-2,4-5H2,(H2,16,17)	FTKATHYCSFVXJI-UHFFFAOYSA-N	255.083018136							109758
SMR000064944	LSM-21187	SID3717416, BRD-K06049311	2630150	InChI=1S/C19H21N5O3S2/c1-5-27-18(26)16-15(13-8-6-11(2)7-9-13)12(3)29-17(16)20-14(25)10-28-19-21-22-23-24(19)4/h6-9H,5,10H2,1-4H3,(H,20,25)	GROXOIPUBSRSOA-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)CSc2nnnn2C)sc(C)c1c3ccc(C)cc3	BroadT	BRD-K06049311	BRD-K06049311-001-05-9	Enamine Ltd.	ZT-2054287			CCOC(=O)c1c(NC(=O)CSc2nnnn2C)sc(C)c1-c1ccc(C)cc1	InChI=1S/C19H21N5O3S2/c1-5-27-18(26)16-15(13-8-6-11(2)7-9-13)12(3)29-17(16)20-14(25)10-28-19-21-22-23-24(19)4/h6-9H,5,10H2,1-4H3,(H,20,25)	GROXOIPUBSRSOA-UHFFFAOYSA-N	431.108580962							109759
6-Methyl-5-phenyl-2-(phenylsulfanyl)nicotinonitrile	LSM-21188	SID17402150, BRD-K30498580	1476369	InChI=1S/C19H14N2S/c1-14-18(15-8-4-2-5-9-15)12-16(13-20)19(21-14)22-17-10-6-3-7-11-17/h2-12H,1H3	SGPJOMQRMNICCX-UHFFFAOYSA-N	Cc1nc(Sc2ccccc2)c(cc1c3ccccc3)C#N	BroadT	BRD-K30498580	BRD-K30498580-001-06-0	Key Organics Ltd.	4J-409S			Cc1nc(Sc2ccccc2)c(cc1-c1ccccc1)C#N	InChI=1S/C19H14N2S/c1-14-18(15-8-4-2-5-9-15)12-16(13-20)19(21-14)22-17-10-6-3-7-11-17/h2-12H,1H3	SGPJOMQRMNICCX-UHFFFAOYSA-N	302.087769158							109760
BRD-K08829872-001-04-6	LSM-21189	SID26731689, SID85281130, BRD-K08829872	2744120	InChI=1S/C17H12Cl2N4O2S/c18-11-6-4-10(5-7-11)15-21-16(25)23-17(22-15)26-9-14(24)20-13-3-1-2-12(19)8-13/h1-8H,9H2,(H,20,24)(H,21,22,23,25)	VYNAMHOZGALHLW-UHFFFAOYSA-N	Oc1nc(SCC(=O)Nc2cccc(Cl)c2)nc(n1)c3ccc(Cl)cc3	BroadT	BRD-K08829872	BRD-K08829872-001-07-9	Maybridge	SPB 02390			Oc1nc(SCC(=O)Nc2cccc(Cl)c2)nc(n1)-c1ccc(Cl)cc1	InChI=1S/C17H12Cl2N4O2S/c18-11-6-4-10(5-7-11)15-21-16(25)23-17(22-15)26-9-14(24)20-13-3-1-2-12(19)8-13/h1-8H,9H2,(H,20,24)(H,21,22,23,25)	VYNAMHOZGALHLW-UHFFFAOYSA-N	406.005801774							109761
4-[4-(Tert-butyl)benzoyl]-n-[2-(2-pyridinyl)ethyl]-1H-pyrrole-2-carboxamide	LSM-21190	SID24819164, BRD-K62497215	1485096	InChI=1S/C23H25N3O2/c1-23(2,3)18-9-7-16(8-10-18)21(27)17-14-20(26-15-17)22(28)25-13-11-19-6-4-5-12-24-19/h4-10,12,14-15,26H,11,13H2,1-3H3,(H,25,28)	BOPGFRQPXYLMRT-UHFFFAOYSA-N	CC(C)(C)c1ccc(cc1)C(=O)c2c[nH]c(c2)C(=O)NCCc3ccccn3	BroadT	BRD-K62497215	BRD-K62497215-001-05-8	Key Organics Ltd.	7R-0221			CC(C)(C)c1ccc(cc1)C(=O)c1c[nH]c(c1)C(=O)NCCc1ccccn1	InChI=1S/C23H25N3O2/c1-23(2,3)18-9-7-16(8-10-18)21(27)17-14-20(26-15-17)22(28)25-13-11-19-6-4-5-12-24-19/h4-10,12,14-15,26H,11,13H2,1-3H3,(H,25,28)	BOPGFRQPXYLMRT-UHFFFAOYSA-N	375.19467707							109762
MLS000529145	LSM-21191	SID14727031, BRD-A57334865	3229910	InChI=1S/C21H26N4/c1-4-18-10-5-6-11-24(18)21-13-16(3)22-20-14-19(23-25(20)21)17-9-7-8-15(2)12-17/h7-9,12-14,18H,4-6,10-11H2,1-3H3	DHLLUTCBIJFEBI-UHFFFAOYSA-N	CCC1CCCCN1c2cc(C)nc3cc(nn23)c4cccc(C)c4	BroadT	BRD-A57334865	BRD-A57334865-001-06-3	Asinex Ltd.	ASN 08734325			CCC1CCCCN1c1cc(C)nc2cc(nn12)-c1cccc(C)c1	InChI=1S/C21H26N4/c1-4-18-10-5-6-11-24(18)21-13-16(3)22-20-14-19(23-25(20)21)17-9-7-8-15(2)12-17/h7-9,12-14,18H,4-6,10-11H2,1-3H3	DHLLUTCBIJFEBI-UHFFFAOYSA-N	334.215746872							109763
ZINC00468145	LSM-21192	SID24791303, BRD-K44219568	892239	InChI=1S/C14H14ClN3O/c1-9(2)8-17-14-12(7-16)18-13(19-14)10-5-3-4-6-11(10)15/h3-6,9,17H,8H2,1-2H3	NOIRNXCAWABLAT-UHFFFAOYSA-N	CC(C)CNc1oc(nc1C#N)c2ccccc2Cl	BroadT	BRD-K44219568	BRD-K44219568-001-05-2	ChemBridge Corporation	7524591			CC(C)CNc1oc(nc1C#N)-c1ccccc1Cl	InChI=1S/C14H14ClN3O/c1-9(2)8-17-14-12(7-16)18-13(19-14)10-5-3-4-6-11(10)15/h3-6,9,17H,8H2,1-2H3	NOIRNXCAWABLAT-UHFFFAOYSA-N	275.082539808							109764
T5285439	LSM-21193	SID24784089, BRD-K89915931	2484034	InChI=1S/C18H12ClN3OS/c19-14-7-2-1-6-12(14)13-10-24-18-16(13)17(23)21-15(22-18)9-11-5-3-4-8-20-11/h1-8,10H,9H2,(H,21,22,23)	OCTKITMFDWMOJU-UHFFFAOYSA-N	Oc1nc(Cc2ccccn2)nc3scc(c4ccccc4Cl)c13	BroadT	BRD-K89915931	BRD-K89915931-001-05-1	Enamine Ltd.	T5285439			Oc1nc(Cc2ccccn2)nc2scc(-c3ccccc3Cl)c12	InChI=1S/C18H12ClN3OS/c19-14-7-2-1-6-12(14)13-10-24-18-16(13)17(23)21-15(22-18)9-11-5-3-4-8-20-11/h1-8,10H,9H2,(H,21,22,23)	OCTKITMFDWMOJU-UHFFFAOYSA-N	353.038960434							109765
ZINC00472108	LSM-21194	SID24787784, BRD-K04348193	895198	InChI=1S/C16H11NO5/c1-21-13-4-2-3-11-9-14(22-16(11)13)15(18)10-5-7-12(8-6-10)17(19)20/h2-9H,1H3	IPXKWWPMUVBBCM-UHFFFAOYSA-N	COc1cccc2cc(oc12)C(=O)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-K04348193	BRD-K04348193-001-05-0	ChemBridge Corporation	7638215			COc1cccc2cc(oc12)C(=O)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C16H11NO5/c1-21-13-4-2-3-11-9-14(22-16(11)13)15(18)10-5-7-12(8-6-10)17(19)20/h2-9H,1H3	IPXKWWPMUVBBCM-UHFFFAOYSA-N	297.063722462							109766
4448-72-0	LSM-21195	SID49674944, BRD-K00991216	78192	InChI=1S/C15H14O3/c16-11-15(14(17)18,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,16H,11H2,(H,17,18)	XENQGGFBIYOFES-UHFFFAOYSA-N	OCC(C(=O)O)(c1ccccc1)c2ccccc2	BroadT	BRD-K00991216	BRD-K00991216-001-05-4	Stanford University	JDUBOIS_265			OCC(C(O)=O)(c1ccccc1)c1ccccc1	InChI=1S/C15H14O3/c16-11-15(14(17)18,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,16H,11H2,(H,17,18)	XENQGGFBIYOFES-UHFFFAOYSA-N	242.094294308							109767
SMR000046233	LSM-43919	SID863988, BRD-K08434989	5389928	InChI=1S/C23H24N4O4/c28-21-20(22(29)27(23(30)25-21)16-17-4-2-1-3-5-17)14-24-19-8-6-18(7-9-19)15-26-10-12-31-13-11-26/h1-9,14,24H,10-13,15-16H2,(H,25,28,30)/b20-14+	XPPNZOBEJLLGSI-XSFVSMFZSA-N	O=C1NC(=O)\C(=C/Nc2ccc(CN3CCOCC3)cc2)\C(=O)N1Cc4ccccc4	BroadT	BRD-K08434989	BRD-K08434989-001-06-0	InterBioScreen Ltd.	STOCK4S-94488			O=C1NC(=O)\C(=C/Nc2ccc(CN3CCOCC3)cc2)C(=O)N1Cc1ccccc1	InChI=1S/C23H24N4O4/c28-21-20(22(29)27(23(30)25-21)16-17-4-2-1-3-5-17)14-24-19-8-6-18(7-9-19)15-26-10-12-31-13-11-26/h1-9,14,24H,10-13,15-16H2,(H,25,28,30)/b20-14+	XPPNZOBEJLLGSI-XSFVSMFZSA-N	420.179755288							
F0608-0627	LSM-21197	SID24816114, BRD-K50153919	4446326	InChI=1S/C19H15F2N3O2/c20-14-6-3-7-15(21)16(14)17(25)22-19-24-23-18(26-19)13-9-8-11-4-1-2-5-12(11)10-13/h3,6-10H,1-2,4-5H2,(H,22,24,25)	OOSXJRTZMCAXPR-UHFFFAOYSA-N	Fc1cccc(F)c1C(=O)Nc2oc(nn2)c3ccc4CCCCc4c3	BroadT	BRD-K50153919	BRD-K50153919-001-07-6	Life Chemicals Inc.	F0608-0627			Fc1cccc(F)c1C(=O)Nc1nnc(o1)-c1ccc2CCCCc2c1	InChI=1S/C19H15F2N3O2/c20-14-6-3-7-15(21)16(14)17(25)22-19-24-23-18(26-19)13-9-8-11-4-1-2-5-12(11)10-13/h3,6-10H,1-2,4-5H2,(H,22,24,25)	OOSXJRTZMCAXPR-UHFFFAOYSA-N	355.11323315							109769
ST50867467	LSM-21198	SID49827189, BRD-K38337863	8444513	InChI=1S/C19H18N2S/c1-2-14-7-5-10-16(13-14)20-19(22)21-18-12-6-9-15-8-3-4-11-17(15)18/h3-13H,2H2,1H3,(H2,20,21,22)	YFEIHYHCJJJMIW-UHFFFAOYSA-N	CCc1cccc(NC(=Nc2cccc3ccccc23)S)c1	BroadT	BRD-K38337863	BRD-K38337863-001-05-2	Chemical Technologies & Investigations	AMNCS-31349			CCc1cccc(NC(S)=Nc2cccc3ccccc23)c1	InChI=1S/C19H18N2S/c1-2-14-7-5-10-16(13-14)20-19(22)21-18-12-6-9-15-8-3-4-11-17(15)18/h3-13H,2H2,1H3,(H2,20,21,22)	YFEIHYHCJJJMIW-UHFFFAOYSA-N	306.119069286							109770
1-Methyl-3-phenylpyrazino[1,2-a]benzimidazole	LSM-21199	SID22405064, SID515590, BRD-K48812970	384468	InChI=1S/C17H13N3/c1-12-17-19-14-9-5-6-10-16(14)20(17)11-15(18-12)13-7-3-2-4-8-13/h2-11H,1H3	OZEPKGBSALEXRT-UHFFFAOYSA-N	Cc1nc(cn2c3ccccc3nc12)c4ccccc4	BroadT	BRD-K48812970	BRD-K48812970-001-05-2	Specs	AJ-131/36477015			Cc1nc(cn2c3ccccc3nc12)-c1ccccc1	InChI=1S/C17H13N3/c1-12-17-19-14-9-5-6-10-16(14)20(17)11-15(18-12)13-7-3-2-4-8-13/h2-11H,1H3	OZEPKGBSALEXRT-UHFFFAOYSA-N	259.110947446							109771
AC1LP611	LSM-21200	BRD-K19346089	1281902	InChI=1S/C14H11BrN4OS/c1-10-2-4-12(5-3-10)21-14-13(15)6-11(20-14)7-18-19-8-16-17-9-19/h2-9H,1H3	KYIFWUUWPAIDTB-UHFFFAOYSA-N	Cc1ccc(Sc2oc(C=Nn3cnnc3)cc2Br)cc1	BroadT	BRD-K19346089	BRD-K19346089-001-06-2	ChemBridge Corporation	6715967			Cc1ccc(Sc2oc(C=Nn3cnnc3)cc2Br)cc1	InChI=1S/C14H11BrN4OS/c1-10-2-4-12(5-3-10)21-14-13(15)6-11(20-14)7-18-19-8-16-17-9-19/h2-9H,1H3	KYIFWUUWPAIDTB-UHFFFAOYSA-N	361.983694302							109772
SMR000094554	LSM-21201	SID24838422, SID7966305, BRD-A89403480	5308146	InChI=1S/C25H33ClN4O4/c1-3-33-25(32)30-12-9-21(10-13-30)27-23(31)19-7-5-11-29(15-19)16-22-17(2)34-24(28-22)18-6-4-8-20(26)14-18/h4,6,8,14,19,21H,3,5,7,9-13,15-16H2,1-2H3,(H,27,31)	AUGUBBXUTRDLNA-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)NC(=O)C2CCCN(Cc3nc(oc3C)c4cccc(Cl)c4)C2	BroadT	BRD-A89403480	BRD-A89403480-001-06-3	ChemDiv Inc.	C522-4926			CCOC(=O)N1CCC(CC1)NC(=O)C1CCCN(Cc2nc(oc2C)-c2cccc(Cl)c2)C1	InChI=1S/C25H33ClN4O4/c1-3-33-25(32)30-12-9-21(10-13-30)27-23(31)19-7-5-11-29(15-19)16-22-17(2)34-24(28-22)18-6-4-8-20(26)14-18/h4,6,8,14,19,21H,3,5,7,9-13,15-16H2,1-2H3,(H,27,31)	AUGUBBXUTRDLNA-UHFFFAOYSA-N	488.219033286							109773
MLS000567778	LSM-21202	SID16952803, BRD-K83924065	2512344	InChI=1S/C9H8N2O3S3/c1-13-7(12)6-3-2-5(14-6)4-16-9-11-10-8(15)17-9/h2-3H,4H2,1H3,(H,10,15)	NQKJCPUZVXUGJR-UHFFFAOYSA-N	COC(=O)c1oc(CSc2nnc(S)s2)cc1	BroadT	BRD-K83924065	BRD-K83924065-001-07-3	Enamine Ltd.	T5290592			COC(=O)c1ccc(CSc2nnc(S)s2)o1	InChI=1S/C9H8N2O3S3/c1-13-7(12)6-3-2-5(14-6)4-16-9-11-10-8(15)17-9/h2-3H,4H2,1H3,(H,10,15)	NQKJCPUZVXUGJR-UHFFFAOYSA-N	287.969704206							109774
MLS001004480	LSM-21203	SID24828857, BRD-K93970870	2381470	InChI=1S/C18H19N3O4S/c1-3-5-8-21-15-14(16(22)20-18(21)24)11(17(23)25-4-2)10-12(19-15)13-7-6-9-26-13/h6-7,9-10H,3-5,8H2,1-2H3,(H,20,22,24)	YBKQPUJZLKPUBQ-UHFFFAOYSA-N	CCCCN1C(=O)NC(=O)c2c(cc(nc12)c3cccs3)C(=O)OCC	BroadT	BRD-K93970870	BRD-K93970870-001-06-1	Enamine Ltd.	T0513-3245			CCCCn1c2nc(cc(C(=O)OCC)c2c(=O)[nH]c1=O)-c1cccs1	InChI=1S/C18H19N3O4S/c1-3-5-8-21-15-14(16(22)20-18(21)24)11(17(23)25-4-2)10-12(19-15)13-7-6-9-26-13/h6-7,9-10H,3-5,8H2,1-2H3,(H,20,22,24)	YBKQPUJZLKPUBQ-UHFFFAOYSA-N	373.109626808							109775
AC1NVUYH	LSM-43920	SID14738079, BRD-K73812177	5603670	InChI=1S/C22H24N4O3/c1-3-25(4-2)18-12-10-17(11-13-18)23-14-19-20(27)24-22(29)26(21(19)28)15-16-8-6-5-7-9-16/h5-14,23H,3-4,15H2,1-2H3,(H,24,27,29)/b19-14-	BNNUFBYKHRMADK-RGEXLXHISA-N	CCN(CC)c1ccc(N\C=C/2\C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1	BroadT	BRD-K73812177	BRD-K73812177-001-07-7	ChemDiv Inc.	8014-6492			CCN(CC)c1ccc(N\C=C2\C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1	InChI=1S/C22H24N4O3/c1-3-25(4-2)18-12-10-17(11-13-18)23-14-19-20(27)24-22(29)26(21(19)28)15-16-8-6-5-7-9-16/h5-14,23H,3-4,15H2,1-2H3,(H,24,27,29)/b19-14-	BNNUFBYKHRMADK-RGEXLXHISA-N	392.184840668							
2-Phenethyl-benzooxazol-5-ylamine	LSM-21205	SID4251197, BRD-K73132023	765854	InChI=1S/C15H14N2O/c16-12-7-8-14-13(10-12)17-15(18-14)9-6-11-4-2-1-3-5-11/h1-5,7-8,10H,6,9,16H2	JYDYEDVFQNITAL-UHFFFAOYSA-N	Nc1ccc2oc(CCc3ccccc3)nc2c1	BroadT	BRD-K73132023	BRD-K73132023-001-05-0	ChemDiv Inc.	0717-0952			Nc1ccc2oc(CCc3ccccc3)nc2c1	InChI=1S/C15H14N2O/c16-12-7-8-14-13(10-12)17-15(18-14)9-6-11-4-2-1-3-5-11/h1-5,7-8,10H,6,9,16H2	JYDYEDVFQNITAL-UHFFFAOYSA-N	238.110613088							109777
SMR000041882	LSM-21206	SID859948, BRD-A58235937	661250	InChI=1S/C25H33N5O3/c1-5-16(3)26-14-23(31)28-19-9-7-18(8-10-19)25-30-21-13-20(11-12-22(21)33-25)29-24(32)15-27-17(4)6-2/h7-13,16-17,26-27H,5-6,14-15H2,1-4H3,(H,28,31)(H,29,32)	QUJPHEWRQFVCKY-UHFFFAOYSA-N	CCC(C)NCC(=O)Nc1ccc(cc1)c2oc3ccc(NC(=O)CNC(C)CC)cc3n2	BroadT	BRD-A58235937	BRD-A58235937-001-04-0	InterBioScreen Ltd.	STOCK3S-41924			CCC(C)NCC(=O)Nc1ccc(cc1)-c1nc2cc(NC(=O)CNC(C)CC)ccc2o1	InChI=1S/C25H33N5O3/c1-5-16(3)26-14-23(31)28-19-9-7-18(8-10-19)25-30-21-13-20(11-12-22(21)33-25)29-24(32)15-27-17(4)6-2/h7-13,16-17,26-27H,5-6,14-15H2,1-4H3,(H,28,31)(H,29,32)	QUJPHEWRQFVCKY-UHFFFAOYSA-N	451.258339966							109778
F3225-6370	LSM-21207	SID14743220, BRD-K95260605	1862875	InChI=1S/C20H16N2O3/c1-12(2)18-21-19-16(17(23)14-10-6-7-11-15(14)25-19)20(24)22(18)13-8-4-3-5-9-13/h3-12H,1-2H3	FIKKMCDXXDNJBD-UHFFFAOYSA-N	CC(C)C1=NC2=C(C(=O)N1c3ccccc3)C(=O)c4ccccc4O2	BroadT	BRD-K95260605	BRD-K95260605-001-06-7	InterBioScreen Ltd.	STOCK5S-42551			CC(C)c1nc2oc3ccccc3c(=O)c2c(=O)n1-c1ccccc1	InChI=1S/C20H16N2O3/c1-12(2)18-21-19-16(17(23)14-10-6-7-11-15(14)25-19)20(24)22(18)13-8-4-3-5-9-13/h3-12H,1-2H3	FIKKMCDXXDNJBD-UHFFFAOYSA-N	332.116092392							109779
MLS001030134	LSM-21208	SID26659970, BRD-K12726095	2883018	InChI=1S/C12H13N5/c13-6-8-9-4-2-1-3-5-17(9)11-10(8)15-7-16-12(11)14/h7H,1-5H2,(H2,14,15,16)	ZJKJCMVEAVZAGT-UHFFFAOYSA-N	Nc1ncnc2c(C#N)c3CCCCCn3c12	BroadT	BRD-K12726095	BRD-K12726095-001-06-4	InterBioScreen Ltd.	STOCK1S-94630			Nc1ncnc2c(C#N)c3CCCCCn3c12	InChI=1S/C12H13N5/c13-6-8-9-4-2-1-3-5-17(9)11-10(8)15-7-16-12(11)14/h7H,1-5H2,(H2,14,15,16)	ZJKJCMVEAVZAGT-UHFFFAOYSA-N	227.117095466							109780
AC1NTK7M	LSM-21209	SID26664869, BRD-K27097585	5382833	InChI=1S/C14H12N2O4/c1-20-13-8-9(6-7-12(13)17)15-16-11-5-3-2-4-10(11)14(18)19/h2-8,17H,1H3,(H,18,19)	CZGWCKMLZNHPDG-UHFFFAOYSA-N	COc1cc(ccc1O)N=Nc2ccccc2C(=O)O	BroadT	BRD-K27097585	BRD-K27097585-001-06-0	National Cancer Institute Chemotherapeutic Agents Repository	153172			COc1cc(ccc1O)N=Nc1ccccc1C(O)=O	InChI=1S/C14H12N2O4/c1-20-13-8-9(6-7-12(13)17)15-16-11-5-3-2-4-10(11)14(18)19/h2-8,17H,1H3,(H,18,19)	CZGWCKMLZNHPDG-UHFFFAOYSA-N	272.079706884							
SMR000128302	LSM-21210	SID17402011, BRD-K42112504	11957251	InChI=1S/C15H10BrN5O2S2/c16-10-6-4-9(5-7-10)12-8-14(17)21(18-12)25(22,23)13-3-1-2-11-15(13)20-24-19-11/h1-8H,17H2	WSZWPRMGVHHVON-UHFFFAOYSA-N	Nc1cc(nn1S(=O)(=O)c2cccc3nsnc23)c4ccc(Br)cc4	BroadT	BRD-K42112504	BRD-K42112504-001-04-1	ChemDiv Inc.	C665-0322			Nc1cc(nn1S(=O)(=O)c1cccc2nsnc12)-c1ccc(Br)cc1	InChI=1S/C15H10BrN5O2S2/c16-10-6-4-9(5-7-10)12-8-14(17)21(18-12)25(22,23)13-3-1-2-11-15(13)20-24-19-11/h1-8H,17H2	WSZWPRMGVHHVON-UHFFFAOYSA-N	434.94592859							109782
T0508-0813	LSM-21211	SID3712555, BRD-K35131668	2347404	InChI=1S/C19H20N2O5S/c1-14-6-8-16(9-7-14)27(24,25)20-12-19(23)26-13-18(22)21-11-10-15-4-2-3-5-17(15)21/h2-9,20H,10-13H2,1H3	OWJIQEKTENFGED-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NCC(=O)OCC(=O)N2CCc3ccccc23	BroadT	BRD-K35131668	BRD-K35131668-001-05-9	Enamine Ltd.	T0508-0813			Cc1ccc(cc1)S(=O)(=O)NCC(=O)OCC(=O)N1CCc2ccccc12	InChI=1S/C19H20N2O5S/c1-14-6-8-16(9-7-14)27(24,25)20-12-19(23)26-13-18(22)21-11-10-15-4-2-3-5-17(15)21/h2-9,20H,10-13H2,1H3	OWJIQEKTENFGED-UHFFFAOYSA-N	388.10929245							109783
N-[3-Fluoro-4-(4-phenylpiperazino)phenyl]-2-morpholinoacetamide	LSM-21212	SID24819785, BRD-K97440061	3784426	InChI=1S/C22H27FN4O2/c23-20-16-18(24-22(28)17-25-12-14-29-15-13-25)6-7-21(20)27-10-8-26(9-11-27)19-4-2-1-3-5-19/h1-7,16H,8-15,17H2,(H,24,28)	FWZOTNIGAMRXHS-UHFFFAOYSA-N	Fc1cc(NC(=O)CN2CCOCC2)ccc1N3CCN(CC3)c4ccccc4	BroadT	BRD-K97440061	BRD-K97440061-001-05-2	Key Organics Ltd.	8R-1200			Fc1cc(NC(=O)CN2CCOCC2)ccc1N1CCN(CC1)c1ccccc1	InChI=1S/C22H27FN4O2/c23-20-16-18(24-22(28)17-25-12-14-29-15-13-25)6-7-21(20)27-10-8-26(9-11-27)19-4-2-1-3-5-19/h1-7,16H,8-15,17H2,(H,24,28)	FWZOTNIGAMRXHS-UHFFFAOYSA-N	398.211804344							109784
2-(4-Methoxyphenyl)-2-oxo-1-phenylethyl 2-chlorobenzoate	LSM-21213	SID17431835, BRD-A47287916	2898194	InChI=1S/C22H17ClO4/c1-26-17-13-11-15(12-14-17)20(24)21(16-7-3-2-4-8-16)27-22(25)18-9-5-6-10-19(18)23/h2-14,21H,1H3	QDWOMEADNZNOIH-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)C(OC(=O)c2ccccc2Cl)c3ccccc3	BroadT	BRD-A47287916	BRD-A47287916-001-05-7	ChemBridge Corporation	6433038			COc1ccc(cc1)C(=O)C(OC(=O)c1ccccc1Cl)c1ccccc1	InChI=1S/C22H17ClO4/c1-26-17-13-11-15(12-14-17)20(24)21(16-7-3-2-4-8-16)27-22(25)18-9-5-6-10-19(18)23/h2-14,21H,1H3	QDWOMEADNZNOIH-UHFFFAOYSA-N	380.081536734							109785
SMR000217187	LSM-21214	SID17512791, BRD-K03856069	1912719	InChI=1S/C20H18F2NO3P/c1-14-11-12-16(13-15(14)2)23-27(24,25-19-9-5-3-7-17(19)21)26-20-10-6-4-8-18(20)22/h3-13H,1-2H3,(H,23,24)	WHJWJTIRYQALEO-UHFFFAOYSA-N	Cc1ccc(NP(=O)(Oc2ccccc2F)Oc3ccccc3F)cc1C	BroadT	BRD-K03856069	BRD-K03856069-001-06-2	InterBioScreen Ltd.	STOCK1S-94473			Cc1ccc(NP(=O)(Oc2ccccc2F)Oc2ccccc2F)cc1C	InChI=1S/C20H18F2NO3P/c1-14-11-12-16(13-15(14)2)23-27(24,25-19-9-5-3-7-17(19)21)26-20-10-6-4-8-18(20)22/h3-13H,1-2H3,(H,23,24)	WHJWJTIRYQALEO-UHFFFAOYSA-N	389.099236356							109786
BAS 06741351	LSM-21215	SID3716975, BRD-K27473553	1085670	InChI=1S/C20H20N2O5S/c1-2-26-15-9-11-17(12-10-15)28(24,25)22-19-8-4-3-7-18(19)20(23)21-14-16-6-5-13-27-16/h3-13,22H,2,14H2,1H3,(H,21,23)	ZBCZVYPNVVAGAO-UHFFFAOYSA-N	CCOc1ccc(cc1)S(=O)(=O)Nc2ccccc2C(=O)NCc3occc3	BroadT	BRD-K27473553	BRD-K27473553-001-05-3	Enamine Ltd.	T0506-2217			CCOc1ccc(cc1)S(=O)(=O)Nc1ccccc1C(=O)NCc1ccco1	InChI=1S/C20H20N2O5S/c1-2-26-15-9-11-17(12-10-15)28(24,25)22-19-8-4-3-7-18(19)20(23)21-14-16-6-5-13-27-16/h3-13,22H,2,14H2,1H3,(H,21,23)	ZBCZVYPNVVAGAO-UHFFFAOYSA-N	400.10929245							109787
MLS000044269	LSM-21216	SID4243046, BRD-K88658606	1279745	InChI=1S/C16H17F3N2O5/c17-15(18,19)16(25-11-3-1-2-4-12(11)26-16)20-13(22)21-7-5-14(6-8-21)23-9-10-24-14/h1-4H,5-10H2,(H,20,22)	HRACSWZKJNFLFC-UHFFFAOYSA-N	FC(F)(F)C1(NC(=O)N2CCC3(CC2)OCCO3)Oc4ccccc4O1	BroadT	BRD-K88658606	BRD-K88658606-001-05-2	Life Chemicals Inc.	F0564-0162			FC(F)(F)C1(NC(=O)N2CCC3(CC2)OCCO3)Oc2ccccc2O1	InChI=1S/C16H17F3N2O5/c17-15(18,19)16(25-11-3-1-2-4-12(11)26-16)20-13(22)21-7-5-14(6-8-21)23-9-10-24-14/h1-4H,5-10H2,(H,20,22)	HRACSWZKJNFLFC-UHFFFAOYSA-N	374.108956264							109788
SMR000077549	LSM-21217	SID4258861, BRD-K79126085	2214399	InChI=1S/C15H14N4O3S3/c1-2-22-14(21)12-9(10-4-3-5-23-10)6-24-13(12)18-11(20)7-25-15-16-8-17-19-15/h3-6,8H,2,7H2,1H3,(H,18,20)(H,16,17,19)	JRKDQGNFXYQKBA-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)CSc2nc[nH]n2)scc1c3cccs3	BroadT	BRD-K79126085	BRD-K79126085-001-05-1	ChemBridge Corporation	7859120			CCOC(=O)c1c(NC(=O)CSc2nc[nH]n2)scc1-c1cccs1	InChI=1S/C15H14N4O3S3/c1-2-22-14(21)12-9(10-4-3-5-23-10)6-24-13(12)18-11(20)7-25-15-16-8-17-19-15/h3-6,8H,2,7H2,1H3,(H,18,20)(H,16,17,19)	JRKDQGNFXYQKBA-UHFFFAOYSA-N	394.022802418							109789
MLS000039052	LSM-21218	SID858479, BRD-K07867787	659792	InChI=1S/C16H16N2O4/c1-21-11-5-4-6-12(9-11)22-10-15(19)18-14-8-3-2-7-13(14)16(17)20/h2-9H,10H2,1H3,(H2,17,20)(H,18,19)	AGCXEVKTJDFEIW-UHFFFAOYSA-N	COc1cccc(OCC(=O)Nc2ccccc2C(=O)N)c1	BroadT	BRD-K07867787	BRD-K07867787-001-05-8	InterBioScreen Ltd.	STOCK2S-42721			COc1cccc(OCC(=O)Nc2ccccc2C(N)=O)c1	InChI=1S/C16H16N2O4/c1-21-11-5-4-6-12(9-11)22-10-15(19)18-14-8-3-2-7-13(14)16(17)20/h2-9H,10H2,1H3,(H2,17,20)(H,18,19)	AGCXEVKTJDFEIW-UHFFFAOYSA-N	300.111007012							109790
MLS000522425	LSM-21219	SID14731770, BRD-K90563640	9550165	InChI=1S/C22H26N4O/c1-16-7-8-20(17(2)15-16)25-11-13-26(14-12-25)22(27)10-9-21-23-18-5-3-4-6-19(18)24-21/h3-8,15H,9-14H2,1-2H3,(H,23,24)	TXLQWIKFVYRXDW-UHFFFAOYSA-N	Cc1ccc(N2CCN(CC2)C(=O)CCc3nc4ccccc4[nH]3)c(C)c1	BroadT	BRD-K90563640	BRD-K90563640-001-05-8	ChemDiv Inc.	C301-1991			Cc1ccc(N2CCN(CC2)C(=O)CCc2nc3ccccc3[nH]2)c(C)c1	InChI=1S/C22H26N4O/c1-16-7-8-20(17(2)15-16)25-11-13-26(14-12-25)22(27)10-9-21-23-18-5-3-4-6-19(18)24-21/h3-8,15H,9-14H2,1-2H3,(H,23,24)	TXLQWIKFVYRXDW-UHFFFAOYSA-N	362.210661492							109791
AC1LKV6I	LSM-21220	BRD-K53725835	999921	InChI=1S/C20H17ClN2O4/c1-25-15-8-6-14(7-9-15)12-22-23-20(24)19-11-10-16(27-19)13-26-18-5-3-2-4-17(18)21/h2-12H,13H2,1H3,(H,23,24)	BQGDCUBBCXAHON-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)c2oc(COc3ccccc3Cl)cc2)cc1	BroadT	BRD-K53725835	BRD-K53725835-001-06-1	Specs	AK-968/40605334			COc1ccc(C=NNC(=O)c2ccc(COc3ccccc3Cl)o2)cc1	InChI=1S/C20H17ClN2O4/c1-25-15-8-6-14(7-9-15)12-22-23-20(24)19-11-10-16(27-19)13-26-18-5-3-2-4-17(18)21/h2-12H,13H2,1H3,(H,23,24)	BQGDCUBBCXAHON-UHFFFAOYSA-N	384.087684754							109792
MLS000683088	LSM-21221	SID24779544, BRD-K64948483	4656856	InChI=1S/C12H7BrN4O2S/c13-9-2-1-8(20-9)10(18)15-12-17-16-11(19-12)7-3-5-14-6-4-7/h1-6H,(H,15,17,18)	NLJVDCNHKSWEFL-UHFFFAOYSA-N	Brc1ccc(s1)C(=O)Nc2oc(nn2)c3ccncc3	BroadT	BRD-K64948483	BRD-K64948483-001-06-1	Life Chemicals Inc.	F0608-1108			Brc1ccc(s1)C(=O)Nc1nnc(o1)-c1ccncc1	InChI=1S/C12H7BrN4O2S/c13-9-2-1-8(20-9)10(18)15-12-17-16-11(19-12)7-3-5-14-6-4-7/h1-6H,(H,15,17,18)	NLJVDCNHKSWEFL-UHFFFAOYSA-N	349.947308794							109793
MLS000060525	LSM-21222	SID3715664, BRD-K39922283	2620914	InChI=1S/C18H18N2O2S/c1-4-9-20-12(2)10-14(13(20)3)16(21)11-23-18-19-15-7-5-6-8-17(15)22-18/h4-8,10H,1,9,11H2,2-3H3	VDZYKTVXIQGYID-UHFFFAOYSA-N	Cc1cc(C(=O)CSc2oc3ccccc3n2)c(C)n1CC=C	BroadT	BRD-K39922283	BRD-K39922283-001-05-2	Enamine Ltd.	ZT-4730971			Cc1cc(C(=O)CSc2nc3ccccc3o2)c(C)n1CC=C	InChI=1S/C18H18N2O2S/c1-4-9-20-12(2)10-14(13(20)3)16(21)11-23-18-19-15-7-5-6-8-17(15)22-18/h4-8,10H,1,9,11H2,2-3H3	VDZYKTVXIQGYID-UHFFFAOYSA-N	326.108898526							109794
SMR000022421	LSM-21223	SID24839398, SID4249574, BRD-A31986446	3243508	InChI=1S/C20H21BrN2O5S/c1-12-7-14-8-15(21)9-19(20(14)23(12)13(2)24)29(25,26)22-10-16-11-27-17-5-3-4-6-18(17)28-16/h3-6,8-9,12,16,22H,7,10-11H2,1-2H3	SIBRQXJGJMWOEK-UHFFFAOYSA-N	CC1Cc2cc(Br)cc(c2N1C(=O)C)S(=O)(=O)NCC3COc4ccccc4O3	BroadT	BRD-A31986446	BRD-A31986446-001-05-1	ChemDiv Inc.	C137-2699			CC1Cc2cc(Br)cc(c2N1C(C)=O)S(=O)(=O)NCC1COc2ccccc2O1	InChI=1S/C20H21BrN2O5S/c1-12-7-14-8-15(21)9-19(20(14)23(12)13(2)24)29(25,26)22-10-16-11-27-17-5-3-4-6-18(17)28-16/h3-6,8-9,12,16,22H,7,10-11H2,1-2H3	SIBRQXJGJMWOEK-UHFFFAOYSA-N	480.035455082							109795
SMR000080398	LSM-21224	SID4261769, BRD-K86231088	1245644	InChI=1S/C22H22N2O3/c25-21(19-16-18-8-4-5-9-20(18)27-22(19)26)24-14-12-23(13-15-24)11-10-17-6-2-1-3-7-17/h1-9,16H,10-15H2	DRCGCJBXZNCPEW-UHFFFAOYSA-N	O=C(N1CCN(CCc2ccccc2)CC1)C3=Cc4ccccc4OC3=O	BroadT	BRD-K86231088	BRD-K86231088-001-07-3	ChemBridge Corporation	7945509			O=C(N1CCN(CCc2ccccc2)CC1)c1cc2ccccc2oc1=O	InChI=1S/C22H22N2O3/c25-21(19-16-18-8-4-5-9-20(18)27-22(19)26)24-14-12-23(13-15-24)11-10-17-6-2-1-3-7-17/h1-9,16H,10-15H2	DRCGCJBXZNCPEW-UHFFFAOYSA-N	362.163042584							109796
SMR000065745	LSM-21225	SID3711342, BRD-K77543425	1950083	InChI=1S/C17H19NO3S2/c1-20-9-7-18(8-10-21-2)17(19)15-11-14-16(23-15)12-5-3-4-6-13(12)22-14/h3-6,11H,7-10H2,1-2H3	YEUVBWOZBPFBGW-UHFFFAOYSA-N	COCCN(CCOC)C(=O)c1cc2sc3ccccc3c2s1	BroadT	BRD-K77543425	BRD-K77543425-001-05-8	Enamine Ltd.	T0503-2928			COCCN(CCOC)C(=O)c1cc2sc3ccccc3c2s1	InChI=1S/C17H19NO3S2/c1-20-9-7-18(8-10-21-2)17(19)15-11-14-16(23-15)12-5-3-4-6-13(12)22-14/h3-6,11H,7-10H2,1-2H3	YEUVBWOZBPFBGW-UHFFFAOYSA-N	349.080634858							109797
MLS000708273	LSM-21226	SID24820826, BRD-K79257366	3148028	InChI=1S/C11H8ClN3O4S/c12-7-1-3-8(4-2-7)19-6-9(16)14-11-13-5-10(20-11)15(17)18/h1-5H,6H2,(H,13,14,16)	UYTYUPKOCVMOCG-UHFFFAOYSA-N	[O-][N+](=O)c1cnc(NC(=O)COc2ccc(Cl)cc2)s1	BroadT	BRD-K79257366	BRD-K79257366-001-07-0	Asinex Ltd.	BAS 03588897			[O-][N+](=O)c1cnc(NC(=O)COc2ccc(Cl)cc2)s1	InChI=1S/C11H8ClN3O4S/c12-7-1-3-8(4-2-7)19-6-9(16)14-11-13-5-10(20-11)15(17)18/h1-5H,6H2,(H,13,14,16)	UYTYUPKOCVMOCG-UHFFFAOYSA-N	312.992404166							109798
MLS000778242	LSM-21227	SID26671365, BRD-K78659113	3838677	InChI=1S/C11H10N4O5S/c1-6-12-10(15(19)20)11(13-6)21-5-7-2-3-9(16)8(4-7)14(17)18/h2-4,16H,5H2,1H3,(H,12,13)	KXYCTXGJIAIUDC-UHFFFAOYSA-N	Cc1nc(SCc2ccc(O)c(c2)[N+](=O)[O-])c([nH]1)[N+](=O)[O-]	BroadT	BRD-K78659113	BRD-K78659113-001-05-8	InterBioScreen Ltd.	STOCK3S-72877			Cc1nc(SCc2ccc(O)c(c2)[N+]([O-])=O)c([nH]1)[N+]([O-])=O	InChI=1S/C11H10N4O5S/c1-6-12-10(15(19)20)11(13-6)21-5-7-2-3-9(16)8(4-7)14(17)18/h2-4,16H,5H2,1H3,(H,12,13)	KXYCTXGJIAIUDC-UHFFFAOYSA-N	310.03719015							109799
SMR000008531	LSM-21228	SID842539, BRD-A42155366	644809	InChI=1S/C17H25NO4/c1-4-5-6-11-22-14-9-7-13(8-10-14)16(19)18-15(12(2)3)17(20)21/h7-10,12,15H,4-6,11H2,1-3H3,(H,18,19)(H,20,21)	HHFZQEVZQYBHAR-UHFFFAOYSA-N	CCCCCOc1ccc(cc1)C(=O)NC(C(C)C)C(=O)O	BroadT	BRD-A42155366	BRD-A42155366-001-05-6	Asinex Ltd.	BAS 00294126			CCCCCOc1ccc(cc1)C(=O)NC(C(C)C)C(O)=O	InChI=1S/C17H25NO4/c1-4-5-6-11-22-14-9-7-13(8-10-14)16(19)18-15(12(2)3)17(20)21/h7-10,12,15H,4-6,11H2,1-3H3,(H,18,19)(H,20,21)	HHFZQEVZQYBHAR-UHFFFAOYSA-N	307.17835829							109800
MLS000678396	LSM-21229	SID24807926, BRD-K30734914	6403001	InChI=1S/C20H15N3O4S/c1-25-14-8-6-13(7-9-14)15(24)12-28-20-21-18(16-4-2-10-26-16)19(22-23-20)17-5-3-11-27-17/h2-11H,12H2,1H3	QYWTZJSMNORGMR-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)CSc2nnc(c3occc3)c(n2)c4occc4	BroadT	BRD-K30734914	BRD-K30734914-001-05-7	Asinex Ltd.	BAS 02833844			COc1ccc(cc1)C(=O)CSc1nnc(-c2ccco2)c(n1)-c1ccco1	InChI=1S/C20H15N3O4S/c1-25-14-8-6-13(7-9-14)15(24)12-28-20-21-18(16-4-2-10-26-16)19(22-23-20)17-5-3-11-27-17/h2-11H,12H2,1H3	QYWTZJSMNORGMR-UHFFFAOYSA-N	393.07832668							109801
AC1N6LAO	LSM-21230	BRD-K30449060	4217245	InChI=1S/C23H20N2O5/c1-2-29-21-13-16(15-24-25-19-10-6-9-18(14-19)22(26)27)11-12-20(21)30-23(28)17-7-4-3-5-8-17/h3-15,25H,2H2,1H3,(H,26,27)	MPGVZRQJFBDTLE-UHFFFAOYSA-N	CCOc1cc(C=NNc2cccc(c2)C(=O)O)ccc1OC(=O)c3ccccc3	BroadT	BRD-K30449060	BRD-K30449060-001-07-0	Specs	AK-968/40641306			CCOc1cc(C=NNc2cccc(c2)C(O)=O)ccc1OC(=O)c1ccccc1	InChI=1S/C23H20N2O5/c1-2-29-21-13-16(15-24-25-19-10-6-9-18(14-19)22(26)27)11-12-20(21)30-23(28)17-7-4-3-5-8-17/h3-15,25H,2H2,1H3,(H,26,27)	MPGVZRQJFBDTLE-UHFFFAOYSA-N	404.13722176							109802
T5291165	LSM-21231	SID24825058, BRD-K21903914	4830999	InChI=1S/C26H29F3N6O3/c1-2-34(22-23(30)35(25(38)31-24(22)37)16-18-7-4-3-5-8-18)21(36)17-32-11-13-33(14-12-32)20-10-6-9-19(15-20)26(27,28)29/h3-10,15H,2,11-14,16-17,30H2,1H3,(H,31,37,38)	FDZQMJNFMMZITR-UHFFFAOYSA-N	CCN(C(=O)CN1CCN(CC1)c2cccc(c2)C(F)(F)F)C3=C(N)N(Cc4ccccc4)C(=O)NC3=O	BroadT	BRD-K21903914	BRD-K21903914-001-05-9	Enamine Ltd.	T5291165			CCN(C(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O	InChI=1S/C26H29F3N6O3/c1-2-34(22-23(30)35(25(38)31-24(22)37)16-18-7-4-3-5-8-18)21(36)17-32-11-13-33(14-12-32)20-10-6-9-19(15-20)26(27,28)29/h3-10,15H,2,11-14,16-17,30H2,1H3,(H,31,37,38)	FDZQMJNFMMZITR-UHFFFAOYSA-N	530.225323448							109803
AN-652/41376266	LSM-21232	SID14723112, BRD-K60795227	836514	InChI=1S/C12H8BrNO4/c13-10-6-5-9(18-10)11(15)14-8-4-2-1-3-7(8)12(16)17/h1-6H,(H,14,15)(H,16,17)	JLRIYLNGSBNQBF-UHFFFAOYSA-N	OC(=O)c1ccccc1NC(=O)c2oc(Br)cc2	BroadT	BRD-K60795227	BRD-K60795227-001-05-3	Asinex Ltd.	BAS 09175075			OC(=O)c1ccccc1NC(=O)c1ccc(Br)o1	InChI=1S/C12H8BrNO4/c13-10-6-5-9(18-10)11(15)14-8-4-2-1-3-7(8)12(16)17/h1-6H,(H,14,15)(H,16,17)	JLRIYLNGSBNQBF-UHFFFAOYSA-N	308.963670346							109804
MLS000520956	LSM-21233	SID17402060, BRD-K41520507	4244375	InChI=1S/C13H14N4O2S/c1-8-5-3-4-6-10(8)15-13(20)16-11-9(7-14-17-11)12(18)19-2/h3-7H,1-2H3,(H3,14,15,16,17,20)	LTSKUXQBYQHKHB-UHFFFAOYSA-N	COC(=O)c1c[nH]nc1N=C(S)Nc2ccccc2C	BroadT	BRD-K41520507	BRD-K41520507-001-05-0	ChemDiv Inc.	K781-3507			COC(=O)c1c[nH]nc1N=C(S)Nc1ccccc1C	InChI=1S/C13H14N4O2S/c1-8-5-3-4-6-10(8)15-13(20)16-11-9(7-14-17-11)12(18)19-2/h3-7H,1-2H3,(H3,14,15,16,17,20)	LTSKUXQBYQHKHB-UHFFFAOYSA-N	290.083746418							109805
AC1LYJTX	LSM-43921	SID24797814, BRD-K06865836	1876861	InChI=1S/C21H19NO4/c1-13-4-8-16(9-5-13)22-14(2)19(21(25)26-3)20(24)18(22)12-15-6-10-17(23)11-7-15/h4-12,23H,1-3H3/b18-12+	CKDJFQXSGGYYSF-LDADJPATSA-N	COC(=O)C1=C(C)N(\C(=C\c2ccc(O)cc2)\C1=O)c3ccc(C)cc3	BroadT	BRD-K06865836	BRD-K06865836-001-05-4	ChemBridge Corporation	5916425			COC(=O)C1=C(C)N(\C(=C\c2ccc(O)cc2)C1=O)c1ccc(C)cc1	InChI=1S/C21H19NO4/c1-13-4-8-16(9-5-13)22-14(2)19(21(25)26-3)20(24)18(22)12-15-6-10-17(23)11-7-15/h4-12,23H,1-3H3/b18-12+	CKDJFQXSGGYYSF-LDADJPATSA-N	349.131408098							
SMR000065278	LSM-43922	SID3714775, BRD-K88096758	2698138	InChI=1S/C20H24N4O5S/c25-19(22-20(26)21-15-18-7-4-13-29-18)16-23-9-11-24(12-10-23)30(27,28)14-8-17-5-2-1-3-6-17/h1-8,13-14H,9-12,15-16H2,(H2,21,22,25,26)/b14-8+	UCAUFTLUBFRUPJ-RIYZIHGNSA-N	O=C(CN1CCN(CC1)S(=O)(=O)\C=C\c2ccccc2)NC(=O)NCc3occc3	BroadT	BRD-K88096758	BRD-K88096758-001-05-1	Enamine Ltd.	ZT-9957744			O=C(CN1CCN(CC1)S(=O)(=O)\C=C\c1ccccc1)NC(=O)NCc1ccco1	InChI=1S/C20H24N4O5S/c25-19(22-20(26)21-15-18-7-4-13-29-18)16-23-9-11-24(12-10-23)30(27,28)14-8-17-5-2-1-3-6-17/h1-8,13-14H,9-12,15-16H2,(H2,21,22,25,26)/b14-8+	UCAUFTLUBFRUPJ-RIYZIHGNSA-N	432.146740598							
ST50196517	LSM-21236	SID14740683, BRD-K45941996	1193364	InChI=1S/C25H20N2O5/c1-16-6-10-18(11-7-16)26-23(29)17-8-12-19(13-9-17)32-22(28)14-15-27-24(30)20-4-2-3-5-21(20)25(27)31/h2-13H,14-15H2,1H3,(H,26,29)	SFBNFKRRYXPMQF-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2ccc(OC(=O)CCN3C(=O)c4ccccc4C3=O)cc2)cc1	BroadT	BRD-K45941996	BRD-K45941996-001-09-4	ChemBridge Corporation	7594379			Cc1ccc(NC(=O)c2ccc(OC(=O)CCN3C(=O)c4ccccc4C3=O)cc2)cc1	InChI=1S/C25H20N2O5/c1-16-6-10-18(11-7-16)26-23(29)17-8-12-19(13-9-17)32-22(28)14-15-27-24(30)20-4-2-3-5-21(20)25(27)31/h2-13H,14-15H2,1H3,(H,26,29)	SFBNFKRRYXPMQF-UHFFFAOYSA-N	428.13722176							109808
1-(3,4-Dichlorophenyl)-3-(3,5-dimethylphenyl)thiourea	LSM-21237	SID24791616, BRD-K00899044	976947	InChI=1S/C15H14Cl2N2S/c1-9-5-10(2)7-12(6-9)19-15(20)18-11-3-4-13(16)14(17)8-11/h3-8H,1-2H3,(H2,18,19,20)	LSLBZAFVKUEBJS-UHFFFAOYSA-N	Cc1cc(C)cc(NC(=Nc2ccc(Cl)c(Cl)c2)S)c1	BroadT	BRD-K00899044	BRD-K00899044-001-05-7	ChemBridge Corporation	7735510			Cc1cc(C)cc(NC(S)=Nc2ccc(Cl)c(Cl)c2)c1	InChI=1S/C15H14Cl2N2S/c1-9-5-10(2)7-12(6-9)19-15(20)18-11-3-4-13(16)14(17)8-11/h3-8H,1-2H3,(H2,18,19,20)	LSLBZAFVKUEBJS-UHFFFAOYSA-N	324.025474578							109809
SMR000107676	LSM-21238	SID7972966, BRD-K49216061	828953	InChI=1S/C19H22N4O/c1-15-12-16(14-24-2)18(13-20)19(21-15)23-10-8-22(9-11-23)17-6-4-3-5-7-17/h3-7,12H,8-11,14H2,1-2H3	SGSDAYHACHGJRA-UHFFFAOYSA-N	COCc1cc(C)nc(N2CCN(CC2)c3ccccc3)c1C#N	BroadT	BRD-K49216061	BRD-K49216061-001-05-5	ChemBridge Corporation	6248269			COCc1cc(C)nc(N2CCN(CC2)c2ccccc2)c1C#N	InChI=1S/C19H22N4O/c1-15-12-16(14-24-2)18(13-20)19(21-15)23-10-8-22(9-11-23)17-6-4-3-5-7-17/h3-7,12H,8-11,14H2,1-2H3	SGSDAYHACHGJRA-UHFFFAOYSA-N	322.179361364							109810
SMR000031368	LSM-2820	BRD-K37150847, SID4250000, SID99245544	3243873	InChI=1S/C16H14N2O2/c1-20-15(19)11-18-14-10-6-5-9-13(14)16(17-18)12-7-3-2-4-8-12/h2-10H,11H2,1H3	RBYOCUDWQCQSAM-UHFFFAOYSA-N	COC(=O)Cn1nc(c2ccccc2)c3ccccc13	BroadT	BRD-K37150847	BRD-K37150847-001-09-3	ChemDiv Inc.	K780-0840			COC(=O)Cn1nc(-c2ccccc2)c2ccccc12	InChI=1S/C16H14N2O2/c1-20-15(19)11-18-14-10-6-5-9-13(14)16(17-18)12-7-3-2-4-8-12/h2-10H,11H2,1H3	RBYOCUDWQCQSAM-UHFFFAOYSA-N	266.105527708							92656
MLS000567396	LSM-21239	SID17388477, BRD-K37820685	4969360	InChI=1S/C24H26N4O3S2/c1-3-12-28(24-25-22(18-32-24)19-8-5-4-6-9-19)23(29)20-10-7-11-21(17-20)33(30,31)27-15-13-26(2)14-16-27/h3-11,17-18H,1,12-16H2,2H3	JCIVNYNONXFQPG-UHFFFAOYSA-N	CN1CCN(CC1)S(=O)(=O)c2cccc(c2)C(=O)N(CC=C)c3nc(cs3)c4ccccc4	BroadT	BRD-K37820685	BRD-K37820685-001-05-4	Enamine Ltd.	T5332575			CN1CCN(CC1)S(=O)(=O)c1cccc(c1)C(=O)N(CC=C)c1nc(cs1)-c1ccccc1	InChI=1S/C24H26N4O3S2/c1-3-12-28(24-25-22(18-32-24)19-8-5-4-6-9-19)23(29)20-10-7-11-21(17-20)33(30,31)27-15-13-26(2)14-16-27/h3-11,17-18H,1,12-16H2,2H3	JCIVNYNONXFQPG-UHFFFAOYSA-N	482.144632112							109811
AC1MFTNP	LSM-21240	SID24796486, BRD-K89216905	2950550	InChI=1S/C18H17ClN4O/c19-14-7-5-12(6-8-14)17(24)23-18(20)21-10-9-13-11-22-16-4-2-1-3-15(13)16/h1-8,11,22H,9-10H2,(H3,20,21,23,24)	IRSKWUPUVXQPMX-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)NC(=N)NCCc2c[nH]c3ccccc23	BroadT	BRD-K89216905	BRD-K89216905-001-05-6	Asinex Ltd.	BAS 07099962			Clc1ccc(cc1)C(=O)NC(=N)NCCc1c[nH]c2ccccc12	InChI=1S/C18H17ClN4O/c19-14-7-5-12(6-8-14)17(24)23-18(20)21-10-9-13-11-22-16-4-2-1-3-15(13)16/h1-8,11,22H,9-10H2,(H3,20,21,23,24)	IRSKWUPUVXQPMX-UHFFFAOYSA-N	340.109088914							109812
ST50922033	LSM-21241	SID49680615, BRD-K51908075	2932435	InChI=1S/C24H19N3O3/c1-30-18-12-8-15(9-13-18)22-14-20(19-4-2-3-5-21(19)27-22)24(29)26-17-10-6-16(7-11-17)23(25)28/h2-14H,1H3,(H2,25,28)(H,26,29)	WSRZIMXAUHITJY-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(C(=O)Nc3ccc(cc3)C(=O)N)c4ccccc4n2	BroadT	BRD-K51908075	BRD-K51908075-001-06-4	Enamine Ltd.	T0505-6741			COc1ccc(cc1)-c1cc(C(=O)Nc2ccc(cc2)C(N)=O)c2ccccc2n1	InChI=1S/C24H19N3O3/c1-30-18-12-8-15(9-13-18)22-14-20(19-4-2-3-5-21(19)27-22)24(29)26-17-10-6-16(7-11-17)23(25)28/h2-14H,1H3,(H2,25,28)(H,26,29)	WSRZIMXAUHITJY-UHFFFAOYSA-N	397.142641498							109813
F1142-6630	LSM-21242	SID4257478, BRD-K63355328	1277344	InChI=1S/C20H23N3O2S2/c1-4-10-23-19(24)17-14-8-6-5-7-9-16(14)27-18(17)21-20(23)26-11-15-12(2)22-25-13(15)3/h4H,1,5-11H2,2-3H3	RBTURZSCIGSYAQ-UHFFFAOYSA-N	Cc1onc(C)c1CSC2=Nc3sc4CCCCCc4c3C(=O)N2CC=C	BroadT	BRD-K63355328	BRD-K63355328-001-07-7	ChemBridge Corporation	7405459			Cc1noc(C)c1CSc1nc2sc3CCCCCc3c2c(=O)n1CC=C	InChI=1S/C20H23N3O2S2/c1-4-10-23-19(24)17-14-8-6-5-7-9-16(14)27-18(17)21-20(23)26-11-15-12(2)22-25-13(15)3/h4H,1,5-11H2,2-3H3	RBTURZSCIGSYAQ-UHFFFAOYSA-N	401.123168386							109814
ZINC04994158	LSM-43923	SID26666587, BRD-K12257780	5925511	InChI=1S/C17H12ClNO2/c1-11-4-2-5-12-10-13(17(18)19-16(11)12)7-8-14(20)15-6-3-9-21-15/h2-10H,1H3/b8-7+	IJXXEWAWFROJHX-BQYQJAHWSA-N	Cc1cccc2cc(\C=C\C(=O)c3occc3)c(Cl)nc12	BroadT	BRD-K12257780	BRD-K12257780-001-04-5	InterBioScreen Ltd.	STOCK3S-38579			Cc1cccc2cc(\C=C\C(=O)c3ccco3)c(Cl)nc12	InChI=1S/C17H12ClNO2/c1-11-4-2-5-12-10-13(17(18)19-16(11)12)7-8-14(20)15-6-3-9-21-15/h2-10H,1H3/b8-7+	IJXXEWAWFROJHX-BQYQJAHWSA-N	297.055656344							
AC1MMR8X	LSM-21244	SID24838499, SID4249183, BRD-A32406671	3243170	InChI=1S/C22H20ClN3O3/c1-28-16-8-5-14(6-9-16)13-26-21(20-17(22(26)27)4-3-11-24-20)25-18-12-15(23)7-10-19(18)29-2/h3-12,21,25H,13H2,1-2H3	CQWHSRNYGGHZSM-UHFFFAOYSA-N	COc1ccc(CN2C(Nc3cc(Cl)ccc3OC)c4ncccc4C2=O)cc1	BroadT	BRD-A32406671	BRD-A32406671-001-06-3	ChemDiv Inc.	C612-0610			COc1ccc(CN2C(Nc3cc(Cl)ccc3OC)c3ncccc3C2=O)cc1	InChI=1S/C22H20ClN3O3/c1-28-16-8-5-14(6-9-16)13-26-21(20-17(22(26)27)4-3-11-24-20)25-18-12-15(23)7-10-19(18)29-2/h3-12,21,25H,13H2,1-2H3	CQWHSRNYGGHZSM-UHFFFAOYSA-N	409.11931924							109816
MLS000572793	LSM-21245	SID17415936, BRD-K51058716	1181202	InChI=1S/C22H16O5S/c1-13-8-14(2)10-16(9-13)26-19-12-25-18-11-15(5-6-17(18)21(19)23)27-22(24)20-4-3-7-28-20/h3-12H,1-2H3	BBHGOGWYKOOQFU-UHFFFAOYSA-N	Cc1cc(C)cc(OC2=COc3cc(OC(=O)c4cccs4)ccc3C2=O)c1	BroadT	BRD-K51058716	BRD-K51058716-001-06-3	ChemBridge Corporation	6313301			Cc1cc(C)cc(Oc2coc3cc(OC(=O)c4cccs4)ccc3c2=O)c1	InChI=1S/C22H16O5S/c1-13-8-14(2)10-16(9-13)26-19-12-25-18-11-15(5-6-17(18)21(19)23)27-22(24)20-4-3-7-28-20/h3-12H,1-2H3	BBHGOGWYKOOQFU-UHFFFAOYSA-N	392.071844302							109817
3,4-Dichloro-n-(pyridin-2-ylmethylideneamino)benzamide	LSM-21246	BRD-K89100005	872785	InChI=1S/C13H9Cl2N3O/c14-11-5-4-9(7-12(11)15)13(19)18-17-8-10-3-1-2-6-16-10/h1-8H,(H,18,19)	DWKRDOPIHNRCGC-UHFFFAOYSA-N	Clc1ccc(cc1Cl)C(=O)NN=Cc2ccccn2	BroadT	BRD-K89100005	BRD-K89100005-001-07-7	Chemical Technologies & Investigations	DBZA-003998			Clc1ccc(cc1Cl)C(=O)NN=Cc1ccccn1	InChI=1S/C13H9Cl2N3O/c14-11-5-4-9(7-12(11)15)13(19)18-17-8-10-3-1-2-6-16-10/h1-8H,(H,18,19)	DWKRDOPIHNRCGC-UHFFFAOYSA-N	293.012267358							109818
4-[4-Methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]morpholine	LSM-21247	SID845601, BRD-K34966669	647957	InChI=1S/C14H23N5O/c1-12-11-13(18-5-3-17(2)4-6-18)16-14(15-12)19-7-9-20-10-8-19/h11H,3-10H2,1-2H3	BMBIEKJDTGAZCY-UHFFFAOYSA-N	CN1CCN(CC1)c2cc(C)nc(n2)N3CCOCC3	BroadT	BRD-K34966669	BRD-K34966669-001-05-8	Asinex Ltd.	BAS 03357967			CN1CCN(CC1)c1cc(C)nc(n1)N1CCOCC1	InChI=1S/C14H23N5O/c1-12-11-13(18-5-3-17(2)4-6-18)16-14(15-12)19-7-9-20-10-8-19/h11H,3-10H2,1-2H3	BMBIEKJDTGAZCY-UHFFFAOYSA-N	277.190260406							109819
SMR000042322	LSM-21248	SID860472, SID50102437, BRD-K93809140	661761	InChI=1S/C23H23N3O5/c1-2-29-23(28)22-21(16-9-18-19(31-13-30-18)10-17(16)24-22)25-20(27)12-26-8-7-14-5-3-4-6-15(14)11-26/h3-6,9-10,24H,2,7-8,11-13H2,1H3,(H,25,27)	LYURDMGWTPAOKT-UHFFFAOYSA-N	CCOC(=O)c1[nH]c2cc3OCOc3cc2c1NC(=O)CN4CCc5ccccc5C4	BroadT	BRD-K93809140	BRD-K93809140-001-05-7	InterBioScreen Ltd.	STOCK3S-73945			CCOC(=O)c1[nH]c2cc3OCOc3cc2c1NC(=O)CN1CCc2ccccc2C1	InChI=1S/C23H23N3O5/c1-2-29-23(28)22-21(16-9-18-19(31-13-30-18)10-17(16)24-22)25-20(27)12-26-8-7-14-5-3-4-6-15(14)11-26/h3-6,9-10,24H,2,7-8,11-13H2,1H3,(H,25,27)	LYURDMGWTPAOKT-UHFFFAOYSA-N	421.163770866							109820
2-{Acetyl[(4-Methylphenyl)sulfonyl]amino}phenyl acetate	LSM-21249	SID24813213, BRD-K05414716	284329	InChI=1S/C17H17NO5S/c1-12-8-10-15(11-9-12)24(21,22)18(13(2)19)16-6-4-5-7-17(16)23-14(3)20/h4-11H,1-3H3	HYRHGRFQWVPUFG-UHFFFAOYSA-N	CC(=O)Oc1ccccc1N(C(=O)C)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K05414716	BRD-K05414716-001-07-3	ChemDiv Inc.	1325-0113			CC(=O)Oc1ccccc1N(C(C)=O)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C17H17NO5S/c1-12-8-10-15(11-9-12)24(21,22)18(13(2)19)16-6-4-5-7-17(16)23-14(3)20/h4-11H,1-3H3	HYRHGRFQWVPUFG-UHFFFAOYSA-N	347.082743344							109821
3H-Benzo[e]indole-2-carboxylic acid	LSM-21250	SID4261679, BRD-K96161896	354966	InChI=1S/C13H9NO2/c15-13(16)12-7-10-9-4-2-1-3-8(9)5-6-11(10)14-12/h1-7,14H,(H,15,16)	PZHFTOALJLZERX-UHFFFAOYSA-N	OC(=O)c1cc2c(ccc3ccccc23)[nH]1	BroadT	BRD-K96161896	BRD-K96161896-001-05-6	ChemBridge Corporation	6346613			OC(=O)c1cc2c(ccc3ccccc23)[nH]1	InChI=1S/C13H9NO2/c15-13(16)12-7-10-9-4-2-1-3-8(9)5-6-11(10)14-12/h1-7,14H,(H,15,16)	PZHFTOALJLZERX-UHFFFAOYSA-N	211.063328538							109822
SMR000061069	LSM-21251	SID3712573, BRD-K35779212	2380799	InChI=1S/C17H14FN3O2S/c18-11-7-5-10(6-8-11)15(22)20-12-9-19-17-21(16(12)23)13-3-1-2-4-14(13)24-17/h5-9H,1-4H2,(H,20,22)	DTVLQHDDWZXUBG-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)NC2=CN=C3SC4=C(CCCC4)N3C2=O	BroadT	BRD-K35779212	BRD-K35779212-001-05-6	Enamine Ltd.	T0506-4647			Fc1ccc(cc1)C(=O)Nc1cnc2sc3CCCCc3n2c1=O	InChI=1S/C17H14FN3O2S/c18-11-7-5-10(6-8-11)15(22)20-12-9-19-17-21(16(12)23)13-3-1-2-4-14(13)24-17/h5-9H,1-4H2,(H,20,22)	DTVLQHDDWZXUBG-UHFFFAOYSA-N	343.079075608							109823
SMR000094347	LSM-21252	SID24838788, SID7967654, BRD-K84896953	5308954	InChI=1S/C21H21F2N3O5S/c1-4-30-17-8-6-16(7-9-17)26(32(28,29)21-13(2)25-31-14(21)3)12-20(27)24-15-5-10-18(22)19(23)11-15/h5-11H,4,12H2,1-3H3,(H,24,27)	XBKVDFVQUCOXRE-UHFFFAOYSA-N	CCOc1ccc(cc1)N(CC(=O)Nc2ccc(F)c(F)c2)S(=O)(=O)c3c(C)onc3C	BroadT	BRD-K84896953	BRD-K84896953-001-04-4	ChemDiv Inc.	C517-4276			CCOc1ccc(cc1)N(CC(=O)Nc1ccc(F)c(F)c1)S(=O)(=O)c1c(C)noc1C	InChI=1S/C21H21F2N3O5S/c1-4-30-17-8-6-16(7-9-17)26(32(28,29)21-13(2)25-31-14(21)3)12-20(27)24-15-5-10-18(22)19(23)11-15/h5-11H,4,12H2,1-3H3,(H,24,27)	XBKVDFVQUCOXRE-UHFFFAOYSA-N	465.116997892							109824
AC1N4QSO	LSM-21253	SID24823401, BRD-A33120952	4133077	InChI=1S/C16H16ClN7O3S/c1-3-10(2)19-15-20-14(17)21-16(22-15)23(8-18)9-24-13(25)11-6-4-5-7-12(11)28(24,26)27/h4-7,10H,3,9H2,1-2H3,(H,19,20,21,22)	OMGBOSSCVRHNAO-UHFFFAOYSA-N	CCC(C)Nc1nc(Cl)nc(n1)N(CN2C(=O)c3ccccc3S2(=O)=O)C#N	BroadT	BRD-A33120952	BRD-A33120952-001-06-9	ChemDiv Inc.	2858-0412			CCC(C)Nc1nc(Cl)nc(n1)N(CN1C(=O)c2ccccc2S1(=O)=O)C#N	InChI=1S/C16H16ClN7O3S/c1-3-10(2)19-15-20-14(17)21-16(22-15)23(8-18)9-24-13(25)11-6-4-5-7-12(11)28(24,26)27/h4-7,10H,3,9H2,1-2H3,(H,19,20,21,22)	OMGBOSSCVRHNAO-UHFFFAOYSA-N	421.072385842							109825
AC1M1XET	LSM-21254	SID24816840, BRD-K60583472	2157933	InChI=1S/C24H22F2N4S/c1-16-21(22-13-19(26)6-9-23(22)28-16)10-12-30(15-17-3-2-11-27-14-17)24(31)29-20-7-4-18(25)5-8-20/h2-9,11,13-14,28H,10,12,15H2,1H3,(H,29,31)	BIHVGGSXBOJXJF-UHFFFAOYSA-N	Cc1[nH]c2ccc(F)cc2c1CCN(Cc3cccnc3)C(=Nc4ccc(F)cc4)S	BroadT	BRD-K60583472	BRD-K60583472-001-07-1	Life Chemicals Inc.	F0591-1126			Cc1[nH]c2ccc(F)cc2c1CCN(Cc1cccnc1)C(S)=Nc1ccc(F)cc1	InChI=1S/C24H22F2N4S/c1-16-21(22-13-19(26)6-9-23(22)28-16)10-12-30(15-17-3-2-11-27-14-17)24(31)29-20-7-4-18(25)5-8-20/h2-9,11,13-14,28H,10,12,15H2,1H3,(H,29,31)	BIHVGGSXBOJXJF-UHFFFAOYSA-N	436.153323834							109826
MLS000121287	LSM-21255	SID14721210, BRD-K74280897	3142724	InChI=1S/C11H17N3O2S/c1-3-5-6-17-11-13-7-8(9(12)14-11)10(15)16-4-2/h7H,3-6H2,1-2H3,(H2,12,13,14)	ZGIWBBOWHHBPTF-UHFFFAOYSA-N	CCCCSc1ncc(C(=O)OCC)c(N)n1	BroadT	BRD-K74280897	BRD-K74280897-001-06-7	Asinex Ltd.	BAS 02748755			CCCCSc1ncc(C(=O)OCC)c(N)n1	InChI=1S/C11H17N3O2S/c1-3-5-6-17-11-13-7-8(9(12)14-11)10(15)16-4-2/h7H,3-6H2,1-2H3,(H2,12,13,14)	ZGIWBBOWHHBPTF-UHFFFAOYSA-N	255.104147504							109827
MLS000580382	LSM-43924	SID17513237, BRD-K48726147	2040656	InChI=1S/C17H17NO4S/c1-12(10-13-6-3-2-4-7-13)11-14-16(21)18(17(22)23-14)9-5-8-15(19)20/h2-4,6-7,10-11H,5,8-9H2,1H3,(H,19,20)/b12-10+,14-11-	GYNBIQYSIWHSCB-MQZPGMTCSA-N	C\C(=C/c1ccccc1)\C=C\2/SC(=O)N(CCCC(=O)O)C2=O	BroadT	BRD-K48726147	BRD-K48726147-001-15-1	InterBioScreen Ltd.	STOCK4S-85992			CC(=C/c1ccccc1)\C=C1/SC(=O)N(CCCC(O)=O)C1=O	InChI=1S/C17H17NO4S/c1-12(10-13-6-3-2-4-7-13)11-14-16(21)18(17(22)23-14)9-5-8-15(19)20/h2-4,6-7,10-11H,5,8-9H2,1H3,(H,19,20)/b12-10+,14-11-	GYNBIQYSIWHSCB-MQZPGMTCSA-N	331.087828724							
AC1O9ZRN	LSM-21257	BRD-K74268166	6742304	InChI=1S/C16H12N4O4/c21-15-6-5-11(20(23)24)7-10(15)8-18-19-16(22)13-9-17-14-4-2-1-3-12(13)14/h1-9,17,21H,(H,19,22)	ADBBSOYEJZICJG-UHFFFAOYSA-N	Oc1ccc(cc1C=NNC(=O)c2c[nH]c3ccccc23)[N+](=O)[O-]	BroadT	BRD-K74268166	BRD-K74268166-001-06-6	InterBioScreen Ltd.	STOCK3S-10750			Oc1ccc(cc1C=NNC(=O)c1c[nH]c2ccccc12)[N+]([O-])=O	InChI=1S/C16H12N4O4/c21-15-6-5-11(20(23)24)7-10(15)8-18-19-16(22)13-9-17-14-4-2-1-3-12(13)14/h1-9,17,21H,(H,19,22)	ADBBSOYEJZICJG-UHFFFAOYSA-N	324.085854904							
MLS000526265	LSM-21258	SID17388235, BRD-K55637053	2902308	InChI=1S/C15H13N5O3S2/c1-8-13(25-15(16-8)17-9(2)21)12-7-24-14(19-12)18-10-4-3-5-11(6-10)20(22)23/h3-7H,1-2H3,(H,18,19)(H,16,17,21)	VCGYNRNTEBKAIL-UHFFFAOYSA-N	CC(=O)Nc1nc(C)c(s1)c2csc(Nc3cccc(c3)[N+](=O)[O-])n2	BroadT	BRD-K55637053	BRD-K55637053-001-06-1	Asinex Ltd.	BAS 02936895			CC(=O)Nc1nc(C)c(s1)-c1csc(Nc2cccc(c2)[N+]([O-])=O)n1	InChI=1S/C15H13N5O3S2/c1-8-13(25-15(16-8)17-9(2)21)12-7-24-14(19-12)18-10-4-3-5-11(6-10)20(22)23/h3-7H,1-2H3,(H,18,19)(H,16,17,21)	VCGYNRNTEBKAIL-UHFFFAOYSA-N	375.045980706							109830
SMR000072725	LSM-21259	SID4259970, BRD-K87805900	890981	InChI=1S/C10H12ClNO2S/c11-9-4-3-5-10(8-9)15(13,14)12-6-1-2-7-12/h3-5,8H,1-2,6-7H2	ZNZXPUJFWPBWFF-UHFFFAOYSA-N	Clc1cccc(c1)S(=O)(=O)N2CCCC2	BroadT	BRD-K87805900	BRD-K87805900-001-05-3	ChemBridge Corporation	7455726			Clc1cccc(c1)S(=O)(=O)N1CCCC1	InChI=1S/C10H12ClNO2S/c11-9-4-3-5-10(8-9)15(13,14)12-6-1-2-7-12/h3-5,8H,1-2,6-7H2	ZNZXPUJFWPBWFF-UHFFFAOYSA-N	245.027727034							109831
AN-329/42342310	LSM-43925	SID17515453, SID104222698, BRD-K28455229	5840375	InChI=1S/C14H9FN2OS/c15-11-6-3-10(4-7-11)5-8-13-16-17-14(18-13)12-2-1-9-19-12/h1-9H/b8-5+	QURYWDULRWUVDV-VMPITWQZSA-N	Fc1ccc(\C=C\c2oc(nn2)c3cccs3)cc1	BroadT	BRD-K28455229	BRD-K28455229-001-05-3	Life Chemicals Inc.	F1685-0035			Fc1ccc(\C=C\c2nnc(o2)-c2cccs2)cc1	InChI=1S/C14H9FN2OS/c15-11-6-3-10(4-7-11)5-8-13-16-17-14(18-13)12-2-1-9-19-12/h1-9H/b8-5+	QURYWDULRWUVDV-VMPITWQZSA-N	272.041961818							
SMR000243168	LSM-21261	SID22411129, BRD-K94298796	3415366	InChI=1S/C22H21ClN2O5S/c1-25(2)31(28,29)20-13-17(10-11-19(20)23)24-21(26)14-30-22(27)12-16-8-5-7-15-6-3-4-9-18(15)16/h3-11,13H,12,14H2,1-2H3,(H,24,26)	IFKMZBOAQLTCCK-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cc(NC(=O)COC(=O)Cc2cccc3ccccc23)ccc1Cl	BroadT	BRD-K94298796	BRD-K94298796-001-05-9	Enamine Ltd.	T0514-2127			CN(C)S(=O)(=O)c1cc(NC(=O)COC(=O)Cc2cccc3ccccc23)ccc1Cl	InChI=1S/C22H21ClN2O5S/c1-25(2)31(28,29)20-13-17(10-11-19(20)23)24-21(26)14-30-22(27)12-16-8-5-7-15-6-3-4-9-18(15)16/h3-11,13H,12,14H2,1-2H3,(H,24,26)	IFKMZBOAQLTCCK-UHFFFAOYSA-N	460.085970192							109833
T0508-0180	LSM-21262	SID22407026, BRD-K62469090	4245719	InChI=1S/C24H33N3O2S/c1-2-29-21-6-4-3-5-20(21)26-7-9-27(10-8-26)23(30)25-22(28)24-14-17-11-18(15-24)13-19(12-17)16-24/h3-6,17-19H,2,7-16H2,1H3,(H,25,28,30)	VKOGOVJXOGKGCJ-UHFFFAOYSA-N	CCOc1ccccc1N2CCN(CC2)C(=S)NC(=O)C34CC5CC(CC(C5)C3)C4	BroadT	BRD-K62469090	BRD-K62469090-001-07-3	Enamine Ltd.	T0508-0180			CCOc1ccccc1N1CCN(CC1)C(=S)NC(=O)C12CC3CC(CC(C3)C1)C2	InChI=1S/C24H33N3O2S/c1-2-29-21-6-4-3-5-20(21)26-7-9-27(10-8-26)23(30)25-22(28)24-14-17-11-18(15-24)13-19(12-17)16-24/h3-6,17-19H,2,7-16H2,1H3,(H,25,28,30)	VKOGOVJXOGKGCJ-UHFFFAOYSA-N	427.229348016							109834
AC1N9OFI	LSM-21263	SID22413108, BRD-K60120557	4413840	InChI=1S/C9H10N4O/c1-3-6-14-9-5-4-8-11-10-7(2)13(8)12-9/h3-5H,1,6H2,2H3	MKDUMAXIYMQOCJ-UHFFFAOYSA-N	Cc1nnc2ccc(OCC=C)nn12	BroadT	BRD-K60120557	BRD-K60120557-001-05-4	Specs	AJ-292/37143024			Cc1nnc2ccc(OCC=C)nn12	InChI=1S/C9H10N4O/c1-3-6-14-9-5-4-8-11-10-7(2)13(8)12-9/h3-5H,1,6H2,2H3	MKDUMAXIYMQOCJ-UHFFFAOYSA-N	190.08546098							109835
AC1MJ1LZ	LSM-21264	BRD-K17165305	3129927	InChI=1S/C18H17Cl2N3O2/c1-11-6-3-4-7-13(11)18(25)23-22-12(2)10-16(24)21-15-9-5-8-14(19)17(15)20/h3-9H,10H2,1-2H3,(H,21,24)(H,23,25)	YGVPPZWKNMHULZ-UHFFFAOYSA-N	CC(=NNC(=O)c1ccccc1C)CC(=O)Nc2cccc(Cl)c2Cl	BroadT	BRD-K17165305	BRD-K17165305-001-06-6	Asinex Ltd.	BAS 01314284			CC(CC(=O)Nc1cccc(Cl)c1Cl)=NNC(=O)c1ccccc1C	InChI=1S/C18H17Cl2N3O2/c1-11-6-3-4-7-13(11)18(25)23-22-12(2)10-16(24)21-15-9-5-8-14(19)17(15)20/h3-9H,10H2,1-2H3,(H,21,24)(H,23,25)	YGVPPZWKNMHULZ-UHFFFAOYSA-N	377.069782234							109836
ASN 07088465	LSM-21265	SID3717889, BRD-A79317887	3000183	InChI=1S/C19H22N2O2/c1-15(21-11-13-23-14-12-21)19(22)20-18-10-6-5-9-17(18)16-7-3-2-4-8-16/h2-10,15H,11-14H2,1H3,(H,20,22)	NLNQBSOZEVFYLC-UHFFFAOYSA-N	CC(N1CCOCC1)C(=O)Nc2ccccc2c3ccccc3	BroadT	BRD-A79317887	BRD-A79317887-001-05-8	Enamine Ltd.	ZT-9933483			CC(N1CCOCC1)C(=O)Nc1ccccc1-c1ccccc1	InChI=1S/C19H22N2O2/c1-15(21-11-13-23-14-12-21)19(22)20-18-10-6-5-9-17(18)16-7-3-2-4-8-16/h2-10,15H,11-14H2,1H3,(H,20,22)	NLNQBSOZEVFYLC-UHFFFAOYSA-N	310.168127964							109837
MLS000673115	LSM-21266	SID24788883, BRD-K28027597	16189382	InChI=1S/C21H18N2O2S/c1-12-5-4-6-14(9-12)23(3)21(25)18-11-16-19(26-18)15-10-13(2)7-8-17(15)22-20(16)24/h4-11H,1-3H3,(H,22,24)	IAIBBTPNZXNDBG-UHFFFAOYSA-N	CN(C(=O)c1cc2c(O)nc3ccc(C)cc3c2s1)c4cccc(C)c4	BroadT	BRD-K28027597	BRD-K28027597-001-07-0	ChemDiv Inc.	C734-0154			CN(C(=O)c1cc2c(O)nc3ccc(C)cc3c2s1)c1cccc(C)c1	InChI=1S/C21H18N2O2S/c1-12-5-4-6-14(9-12)23(3)21(25)18-11-16-19(26-18)15-10-13(2)7-8-17(15)22-20(16)24/h4-11H,1-3H3,(H,22,24)	IAIBBTPNZXNDBG-UHFFFAOYSA-N	362.108898526							109838
MLS000693532	LSM-21267	SID24791942, BRD-K49505990	2958807	InChI=1S/C15H13N3O5S2/c16-25(20,21)11-4-2-10(3-5-11)17-15(24)18-14(19)9-1-6-12-13(7-9)23-8-22-12/h1-7H,8H2,(H2,16,20,21)(H2,17,18,19,24)	XJYZIRYULSLJTH-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2ccc3OCOc3c2)cc1	BroadT	BRD-K49505990	BRD-K49505990-001-05-7	ChemBridge Corporation	7849170			NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2ccc3OCOc3c2)cc1	InChI=1S/C15H13N3O5S2/c16-25(20,21)11-4-2-10(3-5-11)17-15(24)18-14(19)9-1-6-12-13(7-9)23-8-22-12/h1-7H,8H2,(H2,16,20,21)(H2,17,18,19,24)	XJYZIRYULSLJTH-UHFFFAOYSA-N	379.029661926							109839
BAS 03086644	LSM-21268	SID24806737, BRD-K90077791	772656	InChI=1S/C15H22N2O4/c1-19-12-3-4-13(14(11-12)20-2)16-15(18)5-6-17-7-9-21-10-8-17/h3-4,11H,5-10H2,1-2H3,(H,16,18)	CUTHMKQBRIUQAD-UHFFFAOYSA-N	COc1ccc(NC(=O)CCN2CCOCC2)c(OC)c1	BroadT	BRD-K90077791	BRD-K90077791-001-05-6	Asinex Ltd.	BAS 03086644			COc1ccc(NC(=O)CCN2CCOCC2)c(OC)c1	InChI=1S/C15H22N2O4/c1-19-12-3-4-13(14(11-12)20-2)16-15(18)5-6-17-7-9-21-10-8-17/h3-4,11H,5-10H2,1-2H3,(H,16,18)	CUTHMKQBRIUQAD-UHFFFAOYSA-N	294.157957204							109840
MLS000060560	LSM-21269	SID3713070, BRD-A77047565	2998267	InChI=1S/C18H22N4O2S2/c1-5-24-18(23)15-11(2)14-16(20-10-21-17(14)26-15)19-9-12(22(3)4)13-7-6-8-25-13/h6-8,10,12H,5,9H2,1-4H3,(H,19,20,21)	JZEWNXLPVCBZMQ-UHFFFAOYSA-N	CCOC(=O)c1sc2ncnc(NCC(N(C)C)c3cccs3)c2c1C	BroadT	BRD-A77047565	BRD-A77047565-001-06-0	Enamine Ltd.	T5329696			CCOC(=O)c1sc2ncnc(NCC(N(C)C)c3cccs3)c2c1C	InChI=1S/C18H22N4O2S2/c1-5-24-18(23)15-11(2)14-16(20-10-21-17(14)26-15)19-9-12(22(3)4)13-7-6-8-25-13/h6-8,10,12H,5,9H2,1-4H3,(H,19,20,21)	JZEWNXLPVCBZMQ-UHFFFAOYSA-N	390.118417364							109841
AK-777/37037008	LSM-21270	SID14727478, BRD-K20929305	1215650	InChI=1S/C19H19BrN4S/c20-14-6-4-13(5-7-14)12-25-18-16(11-22)19(8-2-1-3-9-19)15(10-21)17(23)24-18/h4-7,24H,1-3,8-9,12,23H2	AHWXPMSTZOIWOT-UHFFFAOYSA-N	NC1=C(C#N)C2(CCCCC2)C(=C(N1)SCc3ccc(Br)cc3)C#N	BroadT	BRD-K20929305	BRD-K20929305-001-06-0	Specs	AK-777/37037008			NC1=C(C#N)C2(CCCCC2)C(C#N)=C(N1)SCc1ccc(Br)cc1	InChI=1S/C19H19BrN4S/c20-14-6-4-13(5-7-14)12-25-18-16(11-22)19(8-2-1-3-9-19)15(10-21)17(23)24-18/h4-7,24H,1-3,8-9,12,23H2	AHWXPMSTZOIWOT-UHFFFAOYSA-N	414.051379938							109842
F1736-0861	LSM-21271	SID17515259, BRD-K25171989	2146623	InChI=1S/C20H17NO3S/c1-14(22)15-7-9-16(10-8-15)21-20(23)19-12-11-17(24-19)13-25-18-5-3-2-4-6-18/h2-12H,13H2,1H3,(H,21,23)	NMONIVDHRRRWGP-UHFFFAOYSA-N	CC(=O)c1ccc(NC(=O)c2oc(CSc3ccccc3)cc2)cc1	BroadT	BRD-K25171989	BRD-K25171989-001-05-9	Life Chemicals Inc.	F1736-0861			CC(=O)c1ccc(NC(=O)c2ccc(CSc3ccccc3)o2)cc1	InChI=1S/C20H17NO3S/c1-14(22)15-7-9-16(10-8-15)21-20(23)19-12-11-17(24-19)13-25-18-5-3-2-4-6-18/h2-12H,13H2,1H3,(H,21,23)	NMONIVDHRRRWGP-UHFFFAOYSA-N	351.092914104							109843
MLS000374402	LSM-15324	BRD-A37111681	4624669	InChI=1S/C23H24ClN3O4S2/c24-17-7-9-18(10-8-17)33(29,30)26-20-5-2-1-4-19(20)23(28)25-16-21(22-6-3-15-32-22)27-11-13-31-14-12-27/h1-10,15,21,26H,11-14,16H2,(H,25,28)	NPRHIOZJUCSTDW-UHFFFAOYSA-N	Clc1ccc(cc1)S(=O)(=O)Nc2ccccc2C(=O)NCC(N3CCOCC3)c4cccs4	BroadT	BRD-A37111681	BRD-A37111681-003-06-8	Enamine Ltd.	T0503-3086		Cl	Clc1ccc(cc1)S(=O)(=O)Nc1ccccc1C(=O)NCC(N1CCOCC1)c1cccs1.Cl	InChI=1S/C23H24ClN3O4S2.ClH/c24-17-7-9-18(10-8-17)33(29,30)26-20-5-2-1-4-19(20)23(28)25-16-21(22-6-3-15-32-22)27-11-13-31-14-12-27;/h1-10,15,21,26H,11-14,16H2,(H,25,28);1H	MOWOJHVUFVJMGH-UHFFFAOYSA-N	505.089675368							103971, 103971
4-((E)-{4-[(e)-(2,4-dihydroxyquinolin-3-yl)diazenyl]-2-methylphenyl}diazenyl)-n,n-dimethylbenzamide	LSM-21272	SID26665115, BRD-K34906147	5356455	InChI=1S/C25H22N6O3/c1-15-14-18(28-30-22-23(32)19-6-4-5-7-21(19)26-24(22)33)12-13-20(15)29-27-17-10-8-16(9-11-17)25(34)31(2)3/h4-14H,1-3H3,(H2,26,32,33)	UUWOOGAKBOGZIN-UHFFFAOYSA-N	CN(C)C(=O)c1ccc(cc1)N=Nc2ccc(cc2C)N=Nc3c(O)nc4ccccc4c3O	BroadT	BRD-K34906147	BRD-K34906147-001-04-9	National Cancer Institute Chemotherapeutic Agents Repository	58052			CN(C)C(=O)c1ccc(cc1)N=Nc1ccc(cc1C)N=Nc1c(O)nc2ccccc2c1O	InChI=1S/C25H22N6O3/c1-15-14-18(28-30-22-23(32)19-6-4-5-7-21(19)26-24(22)33)12-13-20(15)29-27-17-10-8-16(9-11-17)25(34)31(2)3/h4-14H,1-3H3,(H2,26,32,33)	UUWOOGAKBOGZIN-UHFFFAOYSA-N	454.175338624							
AC1MA8WA	LSM-15325	BRD-K77064446	2573298	InChI=1S/C17H15N3O2S/c18-17-20(10-11-23-17)12-16(21)19-14-8-4-5-9-15(14)22-13-6-2-1-3-7-13/h1-11,18H,12H2,(H,19,21)	XSWLGKVTOCFBBQ-UHFFFAOYSA-N	N=C1SC=CN1CC(=O)Nc2ccccc2Oc3ccccc3	BroadT	BRD-K77064446	BRD-K77064446-003-05-6	Enamine Ltd.	T5304138		Cl	N=c1sccn1CC(=O)Nc1ccccc1Oc1ccccc1.Cl	InChI=1S/C17H15N3O2S.ClH/c18-17-20(10-11-23-17)12-16(21)19-14-8-4-5-9-15(14)22-13-6-2-1-3-7-13;/h1-11,18H,12H2,(H,19,21);1H	ZROISBZUFSABQK-UHFFFAOYSA-N	325.08849744							103972, 103972
Methyl 4-(3-amino-5-bromo-1-benzofuran-2-yl)-4-oxobutanoate	LSM-21273	SID7966404, SID858940, BRD-K31061166	660246	InChI=1S/C13H12BrNO4/c1-18-11(17)5-3-9(16)13-12(15)8-6-7(14)2-4-10(8)19-13/h2,4,6H,3,5,15H2,1H3	FKMIASWZTUXLNT-UHFFFAOYSA-N	COC(=O)CCC(=O)c1oc2ccc(Br)cc2c1N	BroadT	BRD-K31061166	BRD-K31061166-001-05-9	InterBioScreen Ltd.	STOCK2S-86285			COC(=O)CCC(=O)c1oc2ccc(Br)cc2c1N	InChI=1S/C13H12BrNO4/c1-18-11(17)5-3-9(16)13-12(15)8-6-7(14)2-4-10(8)19-13/h2,4,6H,3,5,15H2,1H3	FKMIASWZTUXLNT-UHFFFAOYSA-N	324.994970474							109845
MLS000112906	LSM-21274	SID7976429, BRD-K77677771	1167733	InChI=1S/C23H23N3O2S/c1-15-10-11-19-18(12-15)16(2)13-23(3,4)26(19)20(27)14-29-22-25-24-21(28-22)17-8-6-5-7-9-17/h5-13H,14H2,1-4H3	AYQGFKIZSAKEBZ-UHFFFAOYSA-N	CC1=CC(C)(C)N(C(=O)CSc2oc(nn2)c3ccccc3)c4ccc(C)cc14	BroadT	BRD-K77677771	BRD-K77677771-001-05-4	ChemBridge Corporation	6921392			Cc1ccc2N(C(=O)CSc3nnc(o3)-c3ccccc3)C(C)(C)C=C(C)c2c1	InChI=1S/C23H23N3O2S/c1-15-10-11-19-18(12-15)16(2)13-23(3,4)26(19)20(27)14-29-22-25-24-21(28-22)17-8-6-5-7-9-17/h5-13H,14H2,1-4H3	AYQGFKIZSAKEBZ-UHFFFAOYSA-N	405.151097696							109846
MLS000046518	LSM-21275	SID4240808, BRD-A20114232	3235868	InChI=1S/C22H30N4O2/c1-17-6-8-19(9-7-17)20-10-11-22(28)26(24-20)15-12-21(27)23-13-16-25-14-4-3-5-18(25)2/h6-11,18H,3-5,12-16H2,1-2H3,(H,23,27)	SXORXEDYBXYZMG-UHFFFAOYSA-N	CC1CCCCN1CCNC(=O)CCN2N=C(C=CC2=O)c3ccc(C)cc3	BroadT	BRD-A20114232	BRD-A20114232-001-06-9	ChemDiv Inc.	K786-9003			CC1CCCCN1CCNC(=O)CCn1nc(ccc1=O)-c1ccc(C)cc1	InChI=1S/C22H30N4O2/c1-17-6-8-19(9-7-17)20-10-11-22(28)26(24-20)15-12-21(27)23-13-16-25-14-4-3-5-18(25)2/h6-11,18H,3-5,12-16H2,1-2H3,(H,23,27)	SXORXEDYBXYZMG-UHFFFAOYSA-N	382.23687624							109847
MLS000037432	LSM-15326	BRD-K11524566	660091	InChI=1S/C26H32N4O/c1-18-7-8-23-21(15-18)22-16-30(10-9-24(22)27-23)26(31)17-28-11-13-29(14-12-28)25-6-4-5-19(2)20(25)3/h4-8,15,27H,9-14,16-17H2,1-3H3	RBAQJKQTFAIPRX-UHFFFAOYSA-N	Cc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)CN4CCN(CC4)c5cccc(C)c5C	BroadT	BRD-K11524566	BRD-K11524566-003-05-2	InterBioScreen Ltd.	STOCK2S-70656		Cl	Cc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)CN1CCN(CC1)c1cccc(C)c1C.Cl	InChI=1S/C26H32N4O.ClH/c1-18-7-8-23-21(15-18)22-16-30(10-9-24(22)27-23)26(31)17-28-11-13-29(14-12-28)25-6-4-5-19(2)20(25)3;/h4-8,15,27H,9-14,16-17H2,1-3H3;1H	XJPCFEJDCJFGFK-UHFFFAOYSA-N	416.257611684							103973, 103973
ST50676631	LSM-21276	SID4244498, BRD-K47595857	2745204	InChI=1S/C13H14N2O2S/c16-13(15-6-2-1-3-7-15)10-9-11(17-14-10)12-5-4-8-18-12/h4-5,8-9H,1-3,6-7H2	LCIGQGPHUWDYGN-UHFFFAOYSA-N	O=C(N1CCCCC1)c2cc(on2)c3cccs3	BroadT	BRD-K47595857	BRD-K47595857-001-05-2	ChemDiv Inc.	C226-1857			O=C(N1CCCCC1)c1cc(on1)-c1cccs1	InChI=1S/C13H14N2O2S/c16-13(15-6-2-1-3-7-15)10-9-11(17-14-10)12-5-4-8-18-12/h4-5,8-9H,1-3,6-7H2	LCIGQGPHUWDYGN-UHFFFAOYSA-N	262.077598398							109848
SMR000130121	LSM-21277	SID14737784, SID24267210, BRD-K11330425	5058847	InChI=1S/C21H22N2O5/c1-13-9-14-7-5-6-8-16(14)21(25)23(13)12-19(24)22-15-10-17(26-2)20(28-4)18(11-15)27-3/h5-11H,12H2,1-4H3,(H,22,24)	CAZGIWNATCYFBK-UHFFFAOYSA-N	COc1cc(NC(=O)CN2C(=Cc3ccccc3C2=O)C)cc(OC)c1OC	BroadT	BRD-K11330425	BRD-K11330425-001-05-9	ChemDiv Inc.	C067-0033			COc1cc(NC(=O)Cn2c(C)cc3ccccc3c2=O)cc(OC)c1OC	InChI=1S/C21H22N2O5/c1-13-9-14-7-5-6-8-16(14)21(25)23(13)12-19(24)22-15-10-17(26-2)20(28-4)18(11-15)27-3/h5-11H,12H2,1-4H3,(H,22,24)	CAZGIWNATCYFBK-UHFFFAOYSA-N	382.152871824							109849
Benzo[b]thiophen-3(2H)-one, 2-[(methylamino)methylene]-	LSM-21278	BRD-K27321739	6846187	InChI=1S/C10H9NOS/c1-11-6-9-10(12)7-4-2-3-5-8(7)13-9/h2-6,12H,1H3	VSUGCSCYLWLWDC-UHFFFAOYSA-N	CN=Cc1sc2ccccc2c1O	BroadT	BRD-K27321739	BRD-K27321739-001-05-1	ChemDiv Inc.	3237-0023			CN=Cc1sc2ccccc2c1O	InChI=1S/C10H9NOS/c1-11-6-9-10(12)7-4-2-3-5-8(7)13-9/h2-6,12H,1H3	VSUGCSCYLWLWDC-UHFFFAOYSA-N	191.040484608							
STK119110	LSM-21279	SID4255375, BRD-K27484213	1074986	InChI=1S/C16H16N4O3S2/c1-10-8-24-15(17-10)18-13(21)9-25-16-20-19-14(23-16)7-11-3-5-12(22-2)6-4-11/h3-6,8H,7,9H2,1-2H3,(H,17,18,21)	SPJDZQSRXOBJIS-UHFFFAOYSA-N	COc1ccc(Cc2oc(SCC(=O)Nc3nc(C)cs3)nn2)cc1	BroadT	BRD-K27484213	BRD-K27484213-001-05-2	ChemBridge Corporation	7855109			COc1ccc(Cc2nnc(SCC(=O)Nc3nc(C)cs3)o2)cc1	InChI=1S/C16H16N4O3S2/c1-10-8-24-15(17-10)18-13(21)9-25-16-20-19-14(23-16)7-11-3-5-12(22-2)6-4-11/h3-6,8H,7,9H2,1-2H3,(H,17,18,21)	SPJDZQSRXOBJIS-UHFFFAOYSA-N	376.066381792							109851
SMR000064586	LSM-21280	SID3717785, BRD-A23679683	3000139	InChI=1S/C22H22N2O3/c1-14-12-19(15(2)24(14)16-8-4-3-5-9-16)20(25)13-23-21(26)17-10-6-7-11-18(17)22(23)27/h3-9,12,17-18H,10-11,13H2,1-2H3	LOWWUGJFIKLJBS-UHFFFAOYSA-N	Cc1cc(C(=O)CN2C(=O)C3CC=CCC3C2=O)c(C)n1c4ccccc4	BroadT	BRD-A23679683	BRD-A23679683-001-06-2	Enamine Ltd.	T5334992			Cc1cc(C(=O)CN2C(=O)C3CC=CCC3C2=O)c(C)n1-c1ccccc1	InChI=1S/C22H22N2O3/c1-14-12-19(15(2)24(14)16-8-4-3-5-9-16)20(25)13-23-21(26)17-10-6-7-11-18(17)22(23)27/h3-9,12,17-18H,10-11,13H2,1-2H3	LOWWUGJFIKLJBS-UHFFFAOYSA-N	362.163042584							109852
MLS000762429	LSM-21281	SID26662393, BRD-A43389649	3727325	InChI=1S/C17H19NO3/c1-10(19)16-15(12-7-5-4-6-8-12)14-11(2)21-18-13(14)9-17(16,3)20/h4-8,15-16,20H,9H2,1-3H3	PNBALNBXZGZUSR-UHFFFAOYSA-N	CC(=O)C1C(c2ccccc2)c3c(C)onc3CC1(C)O	BroadT	BRD-A43389649	BRD-A43389649-001-05-9	InterBioScreen Ltd.	STOCK4S-86423			CC(=O)C1C(c2c(CC1(C)O)noc2C)c1ccccc1	InChI=1S/C17H19NO3/c1-10(19)16-15(12-7-5-4-6-8-12)14-11(2)21-18-13(14)9-17(16,3)20/h4-8,15-16,20H,9H2,1-3H3	PNBALNBXZGZUSR-UHFFFAOYSA-N	285.136493478							109853
AC1OA3FR	LSM-21282	BRD-K22967752	6746243	InChI=1S/C11H11N3S2/c1-16-11(15)14-13-7-8-6-12-10-5-3-2-4-9(8)10/h2-7,12H,1H3,(H,14,15)	MQILUGFUDMJLIX-UHFFFAOYSA-N	CSC(=NN=Cc1c[nH]c2ccccc12)S	BroadT	BRD-K22967752	BRD-K22967752-001-05-8	InterBioScreen Ltd.	STOCK1S-32971			CSC(S)=NN=Cc1c[nH]c2ccccc12	InChI=1S/C11H11N3S2/c1-16-11(15)14-13-7-8-6-12-10-5-3-2-4-9(8)10/h2-7,12H,1H3,(H,14,15)	MQILUGFUDMJLIX-UHFFFAOYSA-N	249.039438762							
SMR000077242	LSM-21283	SID4259677, BRD-K37352137	2957910	InChI=1S/C19H20N4OS/c24-14-8-5-7-13-16(14)19(10-3-4-11-19)23-17(20-13)22-18-21-12-6-1-2-9-15(12)25-18/h1-2,6,9H,3-5,7-8,10-11H2,(H2,20,21,22,23)	ODANYRXUIXFPLA-UHFFFAOYSA-N	O=C1CCCC2=C1C3(CCCC3)NC(=N2)Nc4nc5ccccc5s4	BroadT	BRD-K37352137	BRD-K37352137-001-05-2	ChemBridge Corporation	7840660			O=C1CCCC2=C1C1(CCCC1)NC(Nc1nc3ccccc3s1)=N2	InChI=1S/C19H20N4OS/c24-14-8-5-7-13-16(14)19(10-3-4-11-19)23-17(20-13)22-18-21-12-6-1-2-9-15(12)25-18/h1-2,6,9H,3-5,7-8,10-11H2,(H2,20,21,22,23)	ODANYRXUIXFPLA-UHFFFAOYSA-N	352.13578199							109855
SMR000068767	LSM-21284	SID3716214, BRD-K80682129	2569075	InChI=1S/C18H25N3O3S/c1-5-6-14-10-17(23)20-18(19-14)25-11-16(22)15-9-12(2)21(13(15)3)7-8-24-4/h9-10H,5-8,11H2,1-4H3,(H,19,20,23)	YWVUMGSIQSWJPZ-UHFFFAOYSA-N	CCCc1cc(O)nc(SCC(=O)c2cc(C)n(CCOC)c2C)n1	BroadT	BRD-K80682129	BRD-K80682129-001-05-8	Enamine Ltd.	ZT-4742670			CCCc1cc(O)nc(SCC(=O)c2cc(C)n(CCOC)c2C)n1	InChI=1S/C18H25N3O3S/c1-5-6-14-10-17(23)20-18(19-14)25-11-16(22)15-9-12(2)21(13(15)3)7-8-24-4/h9-10H,5-8,11H2,1-4H3,(H,19,20,23)	YWVUMGSIQSWJPZ-UHFFFAOYSA-N	363.16166238							109856
MLS000697767	LSM-21285	SID24708129, SID26514140, BRD-K19301906	16066614	InChI=1S/C13H10ClN5/c1-9-4-6-10(7-5-9)19-17-13(16-18-19)11-3-2-8-15-12(11)14/h2-8H,1H3	RCEMVBIZOPRKNR-UHFFFAOYSA-N	Cc1ccc(cc1)n2nnc(n2)c3cccnc3Cl	BroadT	BRD-K19301906	BRD-K19301906-001-05-0	Sanford-Burnham Medical Research Institute	2-chloro-3-(2-p-tolyl-2H-tetrazol-5-yl)pyridine TZTO02			Cc1ccc(cc1)-n1nnc(n1)-c1cccnc1Cl	InChI=1S/C13H10ClN5/c1-9-4-6-10(7-5-9)19-17-13(16-18-19)11-3-2-8-15-12(11)14/h2-8H,1H3	RCEMVBIZOPRKNR-UHFFFAOYSA-N	271.06247308							109857
MLS000733689	LSM-21286	SID24800805, BRD-A81185370	16192474	InChI=1S/C19H26FN3O/c1-3-11-24-16-7-6-10-23(14-16)13-15-12-22(2)21-19(15)17-8-4-5-9-18(17)20/h4-5,8-9,12,16H,3,6-7,10-11,13-14H2,1-2H3	GCRXGEMRISJXQX-UHFFFAOYSA-N	CCCOC1CCCN(Cc2cn(C)nc2c3ccccc3F)C1	BroadT	BRD-A81185370	BRD-A81185370-001-06-7	ChemBridge Corporation	57702736			CCCOC1CCCN(Cc2cn(C)nc2-c2ccccc2F)C1	InChI=1S/C19H26FN3O/c1-3-11-24-16-7-6-10-23(14-16)13-15-12-22(2)21-19(15)17-8-4-5-9-18(17)20/h4-5,8-9,12,16H,3,6-7,10-11,13-14H2,1-2H3	GCRXGEMRISJXQX-UHFFFAOYSA-N	331.205990682							109858
2-(3-Bromophenyl)-n-(4,5-dihydro-1,3-thiazol-2-yl)-4-quinolinecarboxamide	LSM-21287	SID22416368, BRD-K87303356	1009385	InChI=1S/C19H14BrN3OS/c20-13-5-3-4-12(10-13)17-11-15(14-6-1-2-7-16(14)22-17)18(24)23-19-21-8-9-25-19/h1-7,10-11H,8-9H2,(H,21,23,24)	PSAHNMPLXGWEFE-UHFFFAOYSA-N	Brc1cccc(c1)c2cc(C(=O)NC3=NCCS3)c4ccccc4n2	BroadT	BRD-K87303356	BRD-K87303356-001-06-6	ChemBridge Corporation	7303872			Brc1cccc(c1)-c1cc(C(=O)NC2=NCCS2)c2ccccc2n1	InChI=1S/C19H14BrN3OS/c20-13-5-3-4-12(10-13)17-11-15(14-6-1-2-7-16(14)22-17)18(24)23-19-21-8-9-25-19/h1-7,10-11H,8-9H2,(H,21,23,24)	PSAHNMPLXGWEFE-UHFFFAOYSA-N	411.004095388							109859
2,3-Diphenylquinoxaline-6-carboxylic acid	LSM-2706	BML-257, SID17508972, SID26756759	629852	InChI=1S/C21H14N2O2/c24-21(25)16-11-12-17-18(13-16)23-20(15-9-5-2-6-10-15)19(22-17)14-7-3-1-4-8-14/h1-13H,(H,24,25)	LFWGZXMTCUOPFI-UHFFFAOYSA-N	OC(=O)c1ccc2nc(c3ccccc3)c(nc2c1)c4ccccc4	BroadT	BRD-K32584078	BRD-K32584078-001-07-2	Asinex Ltd.	BAS 00891215			OC(=O)c1ccc2nc(-c3ccccc3)c(nc2c1)-c1ccccc1	InChI=1S/C21H14N2O2/c24-21(25)16-11-12-17-18(13-16)23-20(15-9-5-2-6-10-15)19(22-17)14-7-3-1-4-8-14/h1-13H,(H,24,25)	LFWGZXMTCUOPFI-UHFFFAOYSA-N	326.105527708							92563
BRD-K29887651-001-01-2	LSM-21288	BRD-K29887651	54620044	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18+,23-/m1/s1	YZGVRROAGSWMNC-IEGUWTFLSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K29887651	BRD-K29887651-001-01-2	Broad Institute of MIT and Harvard	BRD-K29887651			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18+,23-/m1/s1	YZGVRROAGSWMNC-IEGUWTFLSA-N	507.220320108							109860
BRD-K23686679-001-01-2	LSM-21289	BRD-K23686679	54620156	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17+,21-/m0/s1	IGKRWIJRXULJPM-FVJLSDCUSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc3ccncc3	BroadT	BRD-K23686679	BRD-K23686679-001-01-2	Broad Institute of MIT and Harvard	BRD-K23686679			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc1ccncc1	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17+,21-/m0/s1	IGKRWIJRXULJPM-FVJLSDCUSA-N	429.172227064							109861
BRD-K51796593-001-01-7	LSM-21290	BRD-K51796593	54619944	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17-,21-/m0/s1	IGKRWIJRXULJPM-FIKGOQFSSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc3ccncc3	BroadT	BRD-K51796593	BRD-K51796593-001-01-7	Broad Institute of MIT and Harvard	BRD-K51796593			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc1ccncc1	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17-,21-/m0/s1	IGKRWIJRXULJPM-FIKGOQFSSA-N	429.172227064							109862
SCHEMBL15635205	LSM-21291	BRD-K02715495	54620113	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22-,26-/m1/s1	HNBFIRYNWWOTHM-XLGIIRLISA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K02715495	BRD-K02715495-001-01-6	Broad Institute of MIT and Harvard	BRD-K02715495			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22-,26-/m1/s1	HNBFIRYNWWOTHM-XLGIIRLISA-N	527.245392004							109863
CHEMBL3184153	LSM-21292	BRD-K22788622	54620034	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27+/m1/s1	JOUFKROXUSGCKL-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K22788622	BRD-K22788622-001-01-5	Broad Institute of MIT and Harvard	BRD-K22788622			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27+/m1/s1	JOUFKROXUSGCKL-GNMOFYLKSA-N	520.214426234							109864
BRD-K23893992-001-01-4	LSM-21293	BRD-K23893992	54620011	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22-,28+/m1/s1	WFHCWVTWIFSLHF-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K23893992	BRD-K23893992-001-01-4	Broad Institute of MIT and Harvard	BRD-K23893992			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22-,28+/m1/s1	WFHCWVTWIFSLHF-XJGOYTCSSA-N	544.240721194							109865
BRD-K20436049-001-01-8	LSM-21294	BRD-K20436049	54619994	InChI=1S/C28H39N3O4/c1-19-15-31(20(2)18-32)28(33)25-13-23(22-10-7-11-24(12-22)34-4)14-29-27(25)35-26(19)17-30(3)16-21-8-5-6-9-21/h7,10-14,19-21,26,32H,5-6,8-9,15-18H2,1-4H3/t19-,20+,26-/m0/s1	IDUFABHFDSGNRC-UNVFRBQDSA-N	COc1cccc(c1)c2cnc3O[C@@H](CN(C)CC4CCCC4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K20436049	BRD-K20436049-001-01-8	Broad Institute of MIT and Harvard	BRD-K20436049			COc1cccc(c1)-c1cnc2O[C@@H](CN(C)CC3CCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O4/c1-19-15-31(20(2)18-32)28(33)25-13-23(22-10-7-11-24(12-22)34-4)14-29-27(25)35-26(19)17-30(3)16-21-8-5-6-9-21/h7,10-14,19-21,26,32H,5-6,8-9,15-18H2,1-4H3/t19-,20+,26-/m0/s1	IDUFABHFDSGNRC-UNVFRBQDSA-N	481.294056758							109866
BRD-K02630067-001-01-5	LSM-21295	BRD-K02630067	54619891	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22+,26-/m0/s1	QKGFYTRNDUTRSH-VRUMLPLGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K02630067	BRD-K02630067-001-01-5	Broad Institute of MIT and Harvard	BRD-K02630067			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22+,26-/m0/s1	QKGFYTRNDUTRSH-VRUMLPLGSA-N	555.240306624							109867
BRD-K54415429-001-01-1	LSM-21296	BRD-K54415429	54620063	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19-,24-/m0/s1	JHVMXPAASGDEJW-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K54415429	BRD-K54415429-001-01-1	Broad Institute of MIT and Harvard	BRD-K54415429			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19-,24-/m0/s1	JHVMXPAASGDEJW-JXQFQVJHSA-N	516.240640982							109868
BRD-K25216602-001-01-8	LSM-21297	BRD-K25216602	54620153	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22+,26+/m1/s1	HNBFIRYNWWOTHM-UFPGJGBJSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K25216602	BRD-K25216602-001-01-8	Broad Institute of MIT and Harvard	BRD-K25216602			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22+,26+/m1/s1	HNBFIRYNWWOTHM-UFPGJGBJSA-N	527.245392004							109869
BRD-K66518476-001-01-0	LSM-21298	BRD-K66518476	54619951	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16+,20+/m1/s1	LAMQXQQGALMYJX-GUXCAODWSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3cncnc3	BroadT	BRD-K66518476	BRD-K66518476-001-01-0	Broad Institute of MIT and Harvard	BRD-K66518476			CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cncnc1	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16+,20+/m1/s1	LAMQXQQGALMYJX-GUXCAODWSA-N	456.248503564							109870
BRD-K69967147-001-01-5	LSM-21299	BRD-K69967147	54619968	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19+,24+/m1/s1	JHVMXPAASGDEJW-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K69967147	BRD-K69967147-001-01-5	Broad Institute of MIT and Harvard	BRD-K69967147			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19+,24+/m1/s1	JHVMXPAASGDEJW-IMWIBFENSA-N	516.240640982							109871
BRD-K96812714-001-01-3	LSM-21300	BRD-K96812714	54620147	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21-,27-/m1/s1	GYMQUQFWPBAZQS-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ncc(cc3C1=O)c4cccc(c4)C(=O)N(C)C	BroadT	BRD-K96812714	BRD-K96812714-001-01-3	Broad Institute of MIT and Harvard	BRD-K96812714			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21-,27-/m1/s1	GYMQUQFWPBAZQS-LGVUCKNBSA-N	580.235555602							109872
BRD-K78064647-001-01-5	LSM-21301	BRD-K78064647	54620002	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18+,22-/m0/s1	UDSHYHUEGCAODY-SVMVAKDDSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K78064647	BRD-K78064647-001-01-5	Broad Institute of MIT and Harvard	BRD-K78064647			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18+,22-/m0/s1	UDSHYHUEGCAODY-SVMVAKDDSA-N	479.245392004							109873
BRD-K98645774-001-01-2	LSM-21302	BRD-K98645774	54619901	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22+,26-/m0/s1	HNBFIRYNWWOTHM-VRUMLPLGSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K98645774	BRD-K98645774-001-01-2	Broad Institute of MIT and Harvard	BRD-K98645774			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22+,26-/m0/s1	HNBFIRYNWWOTHM-VRUMLPLGSA-N	527.245392004							109874
MLS003129022	LSM-21303	SID99359632, BRD-K30964799	46904194	InChI=1S/C22H28BrFN2O4S/c1-15-11-26(16(2)14-27)31(28,29)22-9-8-18(23)10-20(22)30-21(15)13-25(3)12-17-6-4-5-7-19(17)24/h4-10,15-16,21,27H,11-14H2,1-3H3/t15-,16+,21+/m1/s1	YUIZGYZJTZMJNG-XFQAVAEZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2F)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K30964799	BRD-K30964799-001-01-9	Broad Institute of MIT and Harvard	BRD-K30964799			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2F)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H28BrFN2O4S/c1-15-11-26(16(2)14-27)31(28,29)22-9-8-18(23)10-20(22)30-21(15)13-25(3)12-17-6-4-5-7-19(17)24/h4-10,15-16,21,27H,11-14H2,1-3H3/t15-,16+,21+/m1/s1	YUIZGYZJTZMJNG-XFQAVAEZSA-N	514.093718886							109875
BRD-K02507754-001-01-3	LSM-21304	BRD-K02507754	54619972	InChI=1S/C27H36N2O4S/c1-5-6-8-11-23-14-15-27-25(16-23)33-26(19-28(4)18-24-12-9-7-10-13-24)21(2)17-29(22(3)20-30)34(27,31)32/h7,9-10,12-16,21-22,26,30H,5-6,17-20H2,1-4H3/t21-,22+,26+/m1/s1	ADEWQMCOYJIEMS-UFPGJGBJSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K02507754	BRD-K02507754-001-01-3	Broad Institute of MIT and Harvard	BRD-K02507754			CCCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O4S/c1-5-6-8-11-23-14-15-27-25(16-23)33-26(19-28(4)18-24-12-9-7-10-13-24)21(2)17-29(22(3)20-30)34(27,31)32/h7,9-10,12-16,21-22,26,30H,5-6,17-20H2,1-4H3/t21-,22+,26+/m1/s1	ADEWQMCOYJIEMS-UFPGJGBJSA-N	484.239578342							109876
BRD-K47629116-001-01-5	LSM-43926	BRD-K47629116	54619952	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18+,24-/m1/s1	RIYOKFYBASFFQM-NGGVJXNZSA-N	C\C=C\c1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K47629116	BRD-K47629116-001-01-5	Broad Institute of MIT and Harvard	BRD-K47629116			C\C=C\c1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18+,24-/m1/s1	RIYOKFYBASFFQM-NGGVJXNZSA-N	467.242021186							
CHEMBL2360635	LSM-21306	SID131415229, BRD-K67347297	54620061	InChI=1S/C27H36N2O4S/c1-5-6-8-11-23-14-15-27-25(16-23)33-26(19-28(4)18-24-12-9-7-10-13-24)21(2)17-29(22(3)20-30)34(27,31)32/h7,9-10,12-16,21-22,26,30H,5-6,17-20H2,1-4H3/t21-,22+,26+/m0/s1	ADEWQMCOYJIEMS-VVZHRXSXSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K67347297	BRD-K67347297-001-01-0	Broad Institute of MIT and Harvard	BRD-K67347297			CCCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O4S/c1-5-6-8-11-23-14-15-27-25(16-23)33-26(19-28(4)18-24-12-9-7-10-13-24)21(2)17-29(22(3)20-30)34(27,31)32/h7,9-10,12-16,21-22,26,30H,5-6,17-20H2,1-4H3/t21-,22+,26+/m0/s1	ADEWQMCOYJIEMS-VVZHRXSXSA-N	484.239578342							109878
BRD-K68575474-001-01-0	LSM-21307	BRD-K68575474	54620057	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22-,27+/m0/s1	SOAPYNAROURGPA-BCQCSXDESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K68575474	BRD-K68575474-001-01-0	Broad Institute of MIT and Harvard	BRD-K68575474			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22-,27+/m0/s1	SOAPYNAROURGPA-BCQCSXDESA-N	537.22974194							109879
BRD-K31930652-001-01-5	LSM-21308	BRD-K31930652	54620000	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18-,23-/m1/s1	JSXDBGGCWARADO-YTSMVRMISA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K31930652	BRD-K31930652-001-01-5	Broad Institute of MIT and Harvard	BRD-K31930652			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18-,23-/m1/s1	JSXDBGGCWARADO-YTSMVRMISA-N	548.224654732							109880
BRD-K02820233-001-01-1	LSM-21309	BRD-K02820233	54620161	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22-,27-/m1/s1	NEJWGONYBYROJQ-VHFRWLAGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K02820233	BRD-K02820233-001-01-1	Broad Institute of MIT and Harvard	BRD-K02820233			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22-,27-/m1/s1	NEJWGONYBYROJQ-VHFRWLAGSA-N	519.273321314							109881
BRD-K38811738-001-01-8	LSM-21310	BRD-K38811738	44489818	InChI=1S/C21H28N4O3/c1-15-11-25(16(2)14-26)21(27)18-5-4-8-23-20(18)28-19(15)13-24(3)12-17-6-9-22-10-7-17/h4-10,15-16,19,26H,11-14H2,1-3H3/t15-,16+,19-/m0/s1	YXDQQKHKJLPYLI-FCEWJHQRSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ncccc3C1=O	BroadT	BRD-K38811738	BRD-K38811738-001-01-8	Broad Institute of MIT and Harvard	BRD-K38811738			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ncccc2C1=O	InChI=1S/C21H28N4O3/c1-15-11-25(16(2)14-26)21(27)18-5-4-8-23-20(18)28-19(15)13-24(3)12-17-6-9-22-10-7-17/h4-10,15-16,19,26H,11-14H2,1-3H3/t15-,16+,19-/m0/s1	YXDQQKHKJLPYLI-FCEWJHQRSA-N	384.216140796							109882
BRD-K30585686-001-01-8	LSM-21311	BRD-K30585686	54619943	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20-,24+/m1/s1	IWCIQXTVMOHXRP-REHUZNOOSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K30585686	BRD-K30585686-001-01-8	Broad Institute of MIT and Harvard	BRD-K30585686			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20-,24+/m1/s1	IWCIQXTVMOHXRP-REHUZNOOSA-N	506.245057646							109883
BRD-K17341552-001-01-4	LSM-21312	BRD-K17341552	54620082	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17-,20+/m1/s1	WPCNIHGKOXVEOP-HLIPFELVSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K17341552	BRD-K17341552-001-01-4	Broad Institute of MIT and Harvard	BRD-K17341552			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17-,20+/m1/s1	WPCNIHGKOXVEOP-HLIPFELVSA-N	408.208278214							109884
CHEMBL2355340	LSM-21313	SID131415135, BRD-K42692167	54619970	InChI=1S/C29H38N2O6S/c1-20(2)7-6-8-23-11-14-28-26(15-23)37-27(21(3)16-31(22(4)19-32)38(28,35)36)18-30(5)17-24-9-12-25(13-10-24)29(33)34/h9-15,20-22,27,32H,7,16-19H2,1-5H3,(H,33,34)/t21-,22+,27+/m0/s1	RBCXQKUITVRWCX-OREGWCPLSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K42692167	BRD-K42692167-001-01-6	Broad Institute of MIT and Harvard	BRD-K42692167			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C29H38N2O6S/c1-20(2)7-6-8-23-11-14-28-26(15-23)37-27(21(3)16-31(22(4)19-32)38(28,35)36)18-30(5)17-24-9-12-25(13-10-24)29(33)34/h9-15,20-22,27,32H,7,16-19H2,1-5H3,(H,33,34)/t21-,22+,27+/m0/s1	RBCXQKUITVRWCX-OREGWCPLSA-N	542.245057646							109885
BRD-K29863922-001-01-6	LSM-21314	BRD-K29863922	54619985	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17+,21+/m1/s1	GOVSZGQIERTMRS-WWMYMODYSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K29863922	BRD-K29863922-001-01-6	Broad Institute of MIT and Harvard	BRD-K29863922			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17+,21+/m1/s1	GOVSZGQIERTMRS-WWMYMODYSA-N	466.213757518							109886
BRD-K24727119-001-01-1	LSM-21315	BRD-K24727119	54619926	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19-,24+/m1/s1	JHVMXPAASGDEJW-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K24727119	BRD-K24727119-001-01-1	Broad Institute of MIT and Harvard	BRD-K24727119			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19-,24+/m1/s1	JHVMXPAASGDEJW-IECBHUPTSA-N	516.240640982							109887
BRD-K53813116-001-01-6	LSM-21316	BRD-K53813116	54620062	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17-,23-/m1/s1	SBQRHQGOZJVRTE-SEPYTNNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(F)c4	BroadT	BRD-K53813116	BRD-K53813116-001-01-6	Broad Institute of MIT and Harvard	BRD-K53813116			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(F)c1	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17-,23-/m1/s1	SBQRHQGOZJVRTE-SEPYTNNBSA-N	490.193771002							109888
BRD-K79150543-001-01-6	LSM-21317	BRD-K79150543	54620144	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22+,27-/m0/s1	NEJWGONYBYROJQ-XXAUWVGASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K79150543	BRD-K79150543-001-01-6	Broad Institute of MIT and Harvard	BRD-K79150543			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22+,27-/m0/s1	NEJWGONYBYROJQ-XXAUWVGASA-N	519.273321314							109889
BRD-K69326486-001-01-3	LSM-21318	BRD-K69326486	54620006	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27+/m0/s1	JOUFKROXUSGCKL-FYQCMVGJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K69326486	BRD-K69326486-001-01-3	Broad Institute of MIT and Harvard	BRD-K69326486			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27+/m0/s1	JOUFKROXUSGCKL-FYQCMVGJSA-N	520.214426234							109890
BRD-K29574758-001-01-8	LSM-21319	BRD-K29574758	54620086	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17-,21-/m1/s1	IGKRWIJRXULJPM-CBGDNZLLSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc3ccncc3	BroadT	BRD-K29574758	BRD-K29574758-001-01-8	Broad Institute of MIT and Harvard	BRD-K29574758			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc1ccncc1	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17-,21-/m1/s1	IGKRWIJRXULJPM-CBGDNZLLSA-N	429.172227064							109891
BRD-K23511844-001-01-2	LSM-21320	BRD-K23511844	54620124	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22+,27+/m0/s1	SOAPYNAROURGPA-OREGWCPLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K23511844	BRD-K23511844-001-01-2	Broad Institute of MIT and Harvard	BRD-K23511844			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22+,27+/m0/s1	SOAPYNAROURGPA-OREGWCPLSA-N	537.22974194							109892
BRD-K13210164-001-01-5	LSM-21321	BRD-K13210164	54620007	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18+,23+/m0/s1	YZGVRROAGSWMNC-YZZKKUAISA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K13210164	BRD-K13210164-001-01-5	Broad Institute of MIT and Harvard	BRD-K13210164			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18+,23+/m0/s1	YZGVRROAGSWMNC-YZZKKUAISA-N	507.220320108							109893
BRD-K51480751-001-01-6	LSM-21322	BRD-K51480751	54620149	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21-,27+/m0/s1	GYMQUQFWPBAZQS-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ncc(cc3C1=O)c4cccc(c4)C(=O)N(C)C	BroadT	BRD-K51480751	BRD-K51480751-001-01-6	Broad Institute of MIT and Harvard	BRD-K51480751			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21-,27+/m0/s1	GYMQUQFWPBAZQS-NOMHHCBYSA-N	580.235555602							109894
CHEMBL3187565	LSM-21323	BRD-K43170571	54620169	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27+/m0/s1	JOUFKROXUSGCKL-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K43170571	BRD-K43170571-001-01-2	Broad Institute of MIT and Harvard	BRD-K43170571			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27+/m0/s1	JOUFKROXUSGCKL-NOMHHCBYSA-N	520.214426234							131257
BRD-K92779190-001-01-1	LSM-21324	BRD-K92779190	54620101	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18+,23-/m1/s1	JSXDBGGCWARADO-SCYDXJQRSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K92779190	BRD-K92779190-001-01-1	Broad Institute of MIT and Harvard	BRD-K92779190			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18+,23-/m1/s1	JSXDBGGCWARADO-SCYDXJQRSA-N	548.224654732							109897
BRD-K02248137-001-01-2	LSM-21325	BRD-K02248137	54619908	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15+,19+/m0/s1	YKXPYIASKYVMCP-QMTMVMCOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)C3=CCCC3	BroadT	BRD-K02248137	BRD-K02248137-001-01-2	Broad Institute of MIT and Harvard	BRD-K02248137			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15+,19+/m0/s1	YKXPYIASKYVMCP-QMTMVMCOSA-N	437.198441812							109898
BRD-K62930716-001-01-1	LSM-21326	BRD-K62930716	54619930	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16+,20+/m1/s1	AMHLQJBMVIBTQJ-GUXCAODWSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K62930716	BRD-K62930716-001-01-1	Broad Institute of MIT and Harvard	BRD-K62930716			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16+,20+/m1/s1	AMHLQJBMVIBTQJ-GUXCAODWSA-N	431.242021186							109899
BRD-K25089397-001-01-8	LSM-21327	BRD-K25089397	54620049	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16-,21-/m1/s1	PQYRKZJHUJLFNK-WHSLLNHNSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K25089397	BRD-K25089397-001-01-8	Broad Institute of MIT and Harvard	BRD-K25089397			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16-,21-/m1/s1	PQYRKZJHUJLFNK-WHSLLNHNSA-N	459.21694929							109900
BRD-K47012709-001-01-7	LSM-43927	BRD-K47012709	54620106	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18-,24-/m1/s1	RIYOKFYBASFFQM-ZLOUIBTLSA-N	C\C=C\c1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K47012709	BRD-K47012709-001-01-7	Broad Institute of MIT and Harvard	BRD-K47012709			C\C=C\c1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18-,24-/m1/s1	RIYOKFYBASFFQM-ZLOUIBTLSA-N	467.242021186							
BRD-K90894196-001-01-4	LSM-21329	BRD-K90894196	54619907	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21-,27+/m1/s1	GYMQUQFWPBAZQS-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ncc(cc3C1=O)c4cccc(c4)C(=O)N(C)C	BroadT	BRD-K90894196	BRD-K90894196-001-01-4	Broad Institute of MIT and Harvard	BRD-K90894196			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21-,27+/m1/s1	GYMQUQFWPBAZQS-GNMOFYLKSA-N	580.235555602							109902
BRD-K18501428-001-01-4	LSM-21330	BRD-K18501428	54620155	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20-,25+/m1/s1	WLSSZJWPMNLWIC-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K18501428	BRD-K18501428-001-01-4	Broad Institute of MIT and Harvard	BRD-K18501428			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20-,25+/m1/s1	WLSSZJWPMNLWIC-FHAGJXEFSA-N	492.26579309							109903
BRD-K38373222-001-01-2	LSM-21331	BRD-K38373222	54619967	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22+,26+/m1/s1	QKGFYTRNDUTRSH-UFPGJGBJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K38373222	BRD-K38373222-001-01-2	Broad Institute of MIT and Harvard	BRD-K38373222			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22+,26+/m1/s1	QKGFYTRNDUTRSH-UFPGJGBJSA-N	555.240306624							109904
BRD-K06371081-001-01-4	LSM-21332	BRD-K06371081	54619992	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16+,21+/m1/s1	PQYRKZJHUJLFNK-XFQAVAEZSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K06371081	BRD-K06371081-001-01-4	Broad Institute of MIT and Harvard	BRD-K06371081			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16+,21+/m1/s1	PQYRKZJHUJLFNK-XFQAVAEZSA-N	459.21694929							109905
BRD-K05427057-001-01-5	LSM-21333	BRD-K05427057	54620175	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18+,23-/m0/s1	JSXDBGGCWARADO-JFNLIGNMSA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K05427057	BRD-K05427057-001-01-5	Broad Institute of MIT and Harvard	BRD-K05427057			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18+,23-/m0/s1	JSXDBGGCWARADO-JFNLIGNMSA-N	548.224654732							109906
BRD-K98437219-001-01-7	LSM-21334	BRD-K98437219	54619899	InChI=1S/C28H33N3O5/c1-18-14-31(19(2)17-32)27(33)24-12-21(10-9-20-7-8-20)13-29-26(24)36-25(18)16-30(3)15-22-5-4-6-23(11-22)28(34)35/h4-6,11-13,18-20,25,32H,7-8,14-17H2,1-3H3,(H,34,35)/t18-,19-,25+/m0/s1	UQQOYFSIYPJILQ-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3ncc(cc3C1=O)C#CC4CC4	BroadT	BRD-K98437219	BRD-K98437219-001-01-7	Broad Institute of MIT and Harvard	BRD-K98437219			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2ncc(cc2C1=O)C#CC1CC1	InChI=1S/C28H33N3O5/c1-18-14-31(19(2)17-32)27(33)24-12-21(10-9-20-7-8-20)13-29-26(24)36-25(18)16-30(3)15-22-5-4-6-23(11-22)28(34)35/h4-6,11-13,18-20,25,32H,7-8,14-17H2,1-3H3,(H,34,35)/t18-,19-,25+/m0/s1	UQQOYFSIYPJILQ-XHNVNVPESA-N	491.242021186							109907
BRD-K92894683-001-01-2	LSM-21335	BRD-K92894683	54619949	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22-,28-/m1/s1	WFHCWVTWIFSLHF-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K92894683	BRD-K92894683-001-01-2	Broad Institute of MIT and Harvard	BRD-K92894683			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22-,28-/m1/s1	WFHCWVTWIFSLHF-DQCZWYHMSA-N	544.240721194							109908
MLS003130176	LSM-21336	SID99358825, BRD-K62599818	46903574	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22+,27+/m0/s1	RGYLHRJGNKTVCX-OREGWCPLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K62599818	BRD-K62599818-001-02-9	Broad Institute of MIT and Harvard	BRD-K62599818			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22+,27+/m0/s1	RGYLHRJGNKTVCX-OREGWCPLSA-N	518.289305736							109909
BRD-K15330604-001-01-7	LSM-43928	BRD-K15330604	54619954	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18+,24+/m0/s1	RIYOKFYBASFFQM-OKSWABHPSA-N	C\C=C\c1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K15330604	BRD-K15330604-001-01-7	Broad Institute of MIT and Harvard	BRD-K15330604			C\C=C\c1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18+,24+/m0/s1	RIYOKFYBASFFQM-OKSWABHPSA-N	467.242021186							
BRD-K19972891-001-01-4	LSM-21338	BRD-K19972891	54620138	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19+,24-/m1/s1	JHVMXPAASGDEJW-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K19972891	BRD-K19972891-001-01-4	Broad Institute of MIT and Harvard	BRD-K19972891			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19+,24-/m1/s1	JHVMXPAASGDEJW-YDIMBITNSA-N	516.240640982							109911
BRD-K11901937-001-01-7	LSM-21339	BRD-K11901937	54620077	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22-,27+/m0/s1	RGYLHRJGNKTVCX-BCQCSXDESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K11901937	BRD-K11901937-001-01-7	Broad Institute of MIT and Harvard	BRD-K11901937			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22-,27+/m0/s1	RGYLHRJGNKTVCX-BCQCSXDESA-N	518.289305736							109912
BRD-K92414293-001-01-1	LSM-21340	BRD-K92414293	54620087	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19+,25+/m1/s1	DGDCFHNDGOPSJV-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K92414293	BRD-K92414293-001-01-1	Broad Institute of MIT and Harvard	BRD-K92414293			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19+,25+/m1/s1	DGDCFHNDGOPSJV-WYEJZRMESA-N	499.221954458							109913
BRD-K07363008-001-01-0	LSM-21341	BRD-K07363008	54620148	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21+,27+/m1/s1	GYMQUQFWPBAZQS-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ncc(cc3C1=O)c4cccc(c4)C(=O)N(C)C	BroadT	BRD-K07363008	BRD-K07363008-001-01-0	Broad Institute of MIT and Harvard	BRD-K07363008			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21+,27+/m1/s1	GYMQUQFWPBAZQS-BUEREQSYSA-N	580.235555602							109914
BRD-K40723689-001-01-0	LSM-21342	BRD-K40723689	54620123	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19-,25-/m1/s1	DGDCFHNDGOPSJV-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K40723689	BRD-K40723689-001-01-0	Broad Institute of MIT and Harvard	BRD-K40723689			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19-,25-/m1/s1	DGDCFHNDGOPSJV-MPCDZSKCSA-N	499.221954458							109915
BRD-K06444139-001-01-1	LSM-21343	BRD-K06444139	54619953	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16-,20-/m1/s1	LAMQXQQGALMYJX-JXXFODFXSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3cncnc3	BroadT	BRD-K06444139	BRD-K06444139-001-01-1	Broad Institute of MIT and Harvard	BRD-K06444139			CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1cncnc1	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16-,20-/m1/s1	LAMQXQQGALMYJX-JXXFODFXSA-N	456.248503564							109916
BRD-K33408298-001-01-0	LSM-21344	BRD-K33408298	54620026	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22-,27-/m0/s1	RGYLHRJGNKTVCX-BERHBOFZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K33408298	BRD-K33408298-001-01-0	Broad Institute of MIT and Harvard	BRD-K33408298			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22-,27-/m0/s1	RGYLHRJGNKTVCX-BERHBOFZSA-N	518.289305736							109917
BRD-K53473163-001-01-1	LSM-43929	BRD-K53473163	54620025	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18-,23+/m0/s1	BFKPGMXAQGECHU-AUWTYGASSA-N	C\C=C\c1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K53473163	BRD-K53473163-001-01-1	Broad Institute of MIT and Harvard	BRD-K53473163			C\C=C\c1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18-,23+/m0/s1	BFKPGMXAQGECHU-AUWTYGASSA-N	441.242770114							
BRD-K13430092-001-01-6	LSM-21346	BRD-K13430092	54620031	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22-,27-/m1/s1	RGYLHRJGNKTVCX-VHFRWLAGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K13430092	BRD-K13430092-001-01-6	Broad Institute of MIT and Harvard	BRD-K13430092			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22-,27-/m1/s1	RGYLHRJGNKTVCX-VHFRWLAGSA-N	518.289305736							109919
MLS003130308	LSM-21347	SID99359211, BRD-K16172315	46903823	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18+,23+/m1/s1	JSXDBGGCWARADO-ZHSNQQFMSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K16172315	BRD-K16172315-001-02-0	Broad Institute of MIT and Harvard	BRD-K16172315			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18+,23+/m1/s1	JSXDBGGCWARADO-ZHSNQQFMSA-N	548.224654732							109920
BRD-K09964242	LSM-15109		54619906	InChI=1S/C25H33N3O4S/c1-5-12-27(4)16-24-18(2)15-28(19(3)17-29)33(30,31)25-11-10-22(13-23(25)32-24)21-8-6-20(14-26)7-9-21/h6-11,13,18-19,24,29H,5,12,15-17H2,1-4H3/t18-,19-,24-/m0/s1	MGOWLZBQMGKWLP-JXQFQVJHSA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K09964242	BRD-K09964242-001-01-9	Broad Institute of MIT and Harvard	BRD-K09964242			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H33N3O4S/c1-5-12-27(4)16-24-18(2)15-28(19(3)17-29)33(30,31)25-11-10-22(13-23(25)32-24)21-8-6-20(14-26)7-9-21/h6-11,13,18-19,24,29H,5,12,15-17H2,1-4H3/t18-,19-,24-/m0/s1	MGOWLZBQMGKWLP-JXQFQVJHSA-N	471.219177256							103765
BRD-K92043077	LSM-15169		54619902	InChI=1S/C25H36N2O4S/c1-6-13-26(5)16-24-19(3)15-27(20(4)17-28)32(29,30)25-12-11-21(14-23(25)31-24)22-10-8-7-9-18(22)2/h7-12,14,19-20,24,28H,6,13,15-17H2,1-5H3/t19-,20+,24-/m0/s1	OGNBHIXSMVQURJ-ROKPMTFOSA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3C	BroadT	BRD-K92043077	BRD-K92043077-001-01-0	Broad Institute of MIT and Harvard	BRD-K92043077			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1C	InChI=1S/C25H36N2O4S/c1-6-13-26(5)16-24-19(3)15-27(20(4)17-28)32(29,30)25-12-11-21(14-23(25)31-24)22-10-8-7-9-18(22)2/h7-12,14,19-20,24,28H,6,13,15-17H2,1-5H3/t19-,20+,24-/m0/s1	OGNBHIXSMVQURJ-ROKPMTFOSA-N	460.239578342							103825
BRD-K19137968-001-01-2	LSM-21348	BRD-K19137968	54619898	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m1/s1	JOUFKROXUSGCKL-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K19137968	BRD-K19137968-001-01-2	Broad Institute of MIT and Harvard	BRD-K19137968			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m1/s1	JOUFKROXUSGCKL-LGVUCKNBSA-N	520.214426234							109921
BRD-K54256401-001-01-1	LSM-21349	BRD-K54256401	54620038	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m0/s1	JOUFKROXUSGCKL-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K54256401	BRD-K54256401-001-01-1	Broad Institute of MIT and Harvard	BRD-K54256401			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m0/s1	JOUFKROXUSGCKL-IZVMNLJQSA-N	520.214426234							109922
BRD-K17263879-001-01-6	LSM-21350	BRD-K17263879	54620108	InChI=1S/C23H33N3O4/c1-7-21(28)25(6)13-20-16(4)12-26(17(5)14-27)23(29)19-10-18(9-8-15(2)3)11-24-22(19)30-20/h10-11,15-17,20,27H,7,12-14H2,1-6H3/t16-,17-,20+/m1/s1	YINCXXWYKWHBGE-HLIPFELVSA-N	CCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC(C)C	BroadT	BRD-K17263879	BRD-K17263879-001-01-6	Broad Institute of MIT and Harvard	BRD-K17263879			CCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC(C)C	InChI=1S/C23H33N3O4/c1-7-21(28)25(6)13-20-16(4)12-26(17(5)14-27)23(29)19-10-18(9-8-15(2)3)11-24-22(19)30-20/h10-11,15-17,20,27H,7,12-14H2,1-6H3/t16-,17-,20+/m1/s1	YINCXXWYKWHBGE-HLIPFELVSA-N	415.247106566							109923
BRD-K07922534	LSM-15106		54620066	InChI=1S/C25H33N3O4S/c1-5-12-27(4)16-24-18(2)15-28(19(3)17-29)33(30,31)25-11-10-22(13-23(25)32-24)21-8-6-20(14-26)7-9-21/h6-11,13,18-19,24,29H,5,12,15-17H2,1-4H3/t18-,19+,24-/m1/s1	MGOWLZBQMGKWLP-YDIMBITNSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K07922534	BRD-K07922534-001-01-6	Broad Institute of MIT and Harvard	BRD-K07922534			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H33N3O4S/c1-5-12-27(4)16-24-18(2)15-28(19(3)17-29)33(30,31)25-11-10-22(13-23(25)32-24)21-8-6-20(14-26)7-9-21/h6-11,13,18-19,24,29H,5,12,15-17H2,1-4H3/t18-,19+,24-/m1/s1	MGOWLZBQMGKWLP-YDIMBITNSA-N	471.219177256							103762
BRD-K00702553-001-01-5	LSM-21351	BRD-K00702553	54619929	InChI=1S/C27H35N3O5S2/c1-19-16-30(20(2)18-31)27(32)23-14-22(11-6-10-21-8-4-5-9-21)15-28-26(23)35-24(19)17-29(3)37(33,34)25-12-7-13-36-25/h7,12-15,19-21,24,31H,4-5,8-10,16-18H2,1-3H3/t19-,20+,24+/m1/s1	VAEQCBKICRQYMW-NMMYMHLASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)Oc3ncc(cc3C1=O)C#CCC4CCCC4	BroadT	BRD-K00702553	BRD-K00702553-001-01-5	Broad Institute of MIT and Harvard	BRD-K00702553			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H35N3O5S2/c1-19-16-30(20(2)18-31)27(32)23-14-22(11-6-10-21-8-4-5-9-21)15-28-26(23)35-24(19)17-29(3)37(33,34)25-12-7-13-36-25/h7,12-15,19-21,24,31H,4-5,8-10,16-18H2,1-3H3/t19-,20+,24+/m1/s1	VAEQCBKICRQYMW-NMMYMHLASA-N	545.20181263							109924
MLS003130157	LSM-21352	SID99358806, BRD-K23486660	46903555	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27-/m1/s1	JOUFKROXUSGCKL-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K23486660	BRD-K23486660-001-02-6	Broad Institute of MIT and Harvard	BRD-K23486660			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27-/m1/s1	JOUFKROXUSGCKL-PBDKAQRYSA-N	520.214426234							109925
BRD-K81551657-001-01-3	LSM-21353	BRD-K81551657	54619935	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16+,21-/m0/s1	PQYRKZJHUJLFNK-MRUHUIDDSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K81551657	BRD-K81551657-001-01-3	Broad Institute of MIT and Harvard	BRD-K81551657			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16+,21-/m0/s1	PQYRKZJHUJLFNK-MRUHUIDDSA-N	459.21694929							109926
BRD-K50002196-001-01-2	LSM-21354	BRD-K50002196	54620060	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17+,21+/m0/s1	GOVSZGQIERTMRS-CSODHUTKSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K50002196	BRD-K50002196-001-01-2	Broad Institute of MIT and Harvard	BRD-K50002196			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17+,21+/m0/s1	GOVSZGQIERTMRS-CSODHUTKSA-N	466.213757518							109927
BRD1295	LSM-21355	BRD-K64831295	54619982	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17-,21+/m0/s1	IGKRWIJRXULJPM-XGHQBKJUSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc3ccncc3	BroadT	BRD-K64831295	BRD-K64831295-001-01-8	Broad Institute of MIT and Harvard	BRD-K64831295			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc1ccncc1	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17-,21+/m0/s1	IGKRWIJRXULJPM-XGHQBKJUSA-N	429.172227064							109928
BRD-K99529239-001-01-6	LSM-21356	BRD-K99529239	54619999	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22+,27-/m0/s1	SOAPYNAROURGPA-XXAUWVGASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K99529239	BRD-K99529239-001-01-6	Broad Institute of MIT and Harvard	BRD-K99529239			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22+,27-/m0/s1	SOAPYNAROURGPA-XXAUWVGASA-N	537.22974194							109929
BRD-K22663366-001-01-0	LSM-21357	BRD-K22663366	54619966	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20-,27-/m1/s1	OEWYWQPTOLBINC-SEXOINJZSA-N	COc1ccccc1c2cnc3O[C@H](CN(C)Cc4ccc(F)cc4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K22663366	BRD-K22663366-001-01-0	Broad Institute of MIT and Harvard	BRD-K22663366			COc1ccccc1-c1cnc2O[C@H](CN(C)Cc3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20-,27-/m1/s1	OEWYWQPTOLBINC-SEXOINJZSA-N	507.253334798							109930
BRD-K00248354	LSM-43605		54619990	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19+,23-/m1/s1	DIUXSDCPAZQGFR-XPKHAYSGSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K00248354	BRD-K00248354-001-01-0	Broad Institute of MIT and Harvard	BRD-K00248354			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19+,23-/m1/s1	DIUXSDCPAZQGFR-XPKHAYSGSA-N	478.250143026							
CHEMBL2357608	LSM-21358	SID131415068, BRD-K15676905	54619904	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16+,21-/m1/s1	PQYRKZJHUJLFNK-VWKPWSFCSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K15676905	BRD-K15676905-001-01-9	Broad Institute of MIT and Harvard	BRD-K15676905			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16+,21-/m1/s1	PQYRKZJHUJLFNK-VWKPWSFCSA-N	459.21694929							109931
BRD-K83246264-001-01-3	LSM-21359	BRD-K83246264	54620178	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15+,19-/m0/s1	YKXPYIASKYVMCP-KHYOSLBOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)C3=CCCC3	BroadT	BRD-K83246264	BRD-K83246264-001-01-3	Broad Institute of MIT and Harvard	BRD-K83246264			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15+,19-/m0/s1	YKXPYIASKYVMCP-KHYOSLBOSA-N	437.198441812							109932
BRD-K31916947-001-01-9	LSM-21360	BRD-K31916947	54620030	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18-,23+/m0/s1	JSXDBGGCWARADO-DDOIHHOZSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K31916947	BRD-K31916947-001-01-9	Broad Institute of MIT and Harvard	BRD-K31916947			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18-,23+/m0/s1	JSXDBGGCWARADO-DDOIHHOZSA-N	548.224654732							109933
BRD-K06018734-001-01-2	LSM-21361	BRD-K06018734	54620172	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16+,20-/m0/s1	LAMQXQQGALMYJX-YRNRMSPPSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3cncnc3	BroadT	BRD-K06018734	BRD-K06018734-001-01-2	Broad Institute of MIT and Harvard	BRD-K06018734			CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cncnc1	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16+,20-/m0/s1	LAMQXQQGALMYJX-YRNRMSPPSA-N	456.248503564							109934
BRD-K95654059-001-01-3	LSM-21362	BRD-K95654059	54620141	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27-/m0/s1	JOUFKROXUSGCKL-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K95654059	BRD-K95654059-001-01-3	Broad Institute of MIT and Harvard	BRD-K95654059			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27-/m0/s1	JOUFKROXUSGCKL-ISCCLHIJSA-N	520.214426234							109935
BRD-K45194047-001-01-6	LSM-21363	BRD-K45194047	54620032	InChI=1S/C25H36N2O4S/c1-6-13-26(5)16-24-19(3)15-27(20(4)17-28)32(29,30)25-12-11-21(14-23(25)31-24)22-10-8-7-9-18(22)2/h7-12,14,19-20,24,28H,6,13,15-17H2,1-5H3/t19-,20-,24-/m1/s1	OGNBHIXSMVQURJ-YOSAUDMPSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3C	BroadT	BRD-K45194047	BRD-K45194047-001-01-6	Broad Institute of MIT and Harvard	BRD-K45194047			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1C	InChI=1S/C25H36N2O4S/c1-6-13-26(5)16-24-19(3)15-27(20(4)17-28)32(29,30)25-12-11-21(14-23(25)31-24)22-10-8-7-9-18(22)2/h7-12,14,19-20,24,28H,6,13,15-17H2,1-5H3/t19-,20-,24-/m1/s1	OGNBHIXSMVQURJ-YOSAUDMPSA-N	460.239578342							109936
BRD-K91917046-001-01-4	LSM-21364	BRD-K91917046	54620023	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18-,23-/m1/s1	JSXDBGGCWARADO-OIMFZILRSA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K91917046	BRD-K91917046-001-01-4	Broad Institute of MIT and Harvard	BRD-K91917046			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18-,23-/m1/s1	JSXDBGGCWARADO-OIMFZILRSA-N	548.224654732							109937
BRD-K11345268-001-01-6	LSM-21365	BRD-K11345268	54620018	InChI=1S/C27H36N2O4S/c1-5-6-8-11-23-14-15-27-25(16-23)33-26(19-28(4)18-24-12-9-7-10-13-24)21(2)17-29(22(3)20-30)34(27,31)32/h7,9-10,12-16,21-22,26,30H,5-6,17-20H2,1-4H3/t21-,22-,26-/m1/s1	ADEWQMCOYJIEMS-XLGIIRLISA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K11345268	BRD-K11345268-001-01-6	Broad Institute of MIT and Harvard	BRD-K11345268			CCCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O4S/c1-5-6-8-11-23-14-15-27-25(16-23)33-26(19-28(4)18-24-12-9-7-10-13-24)21(2)17-29(22(3)20-30)34(27,31)32/h7,9-10,12-16,21-22,26,30H,5-6,17-20H2,1-4H3/t21-,22-,26-/m1/s1	ADEWQMCOYJIEMS-XLGIIRLISA-N	484.239578342							109938
BRD-K91996209-001-01-1	LSM-21366	BRD-K91996209	54619987	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20-,24-/m1/s1	IWCIQXTVMOHXRP-YOSAUDMPSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K91996209	BRD-K91996209-001-01-1	Broad Institute of MIT and Harvard	BRD-K91996209			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20-,24-/m1/s1	IWCIQXTVMOHXRP-YOSAUDMPSA-N	506.245057646							109939
BRD-K17215500-001-01-3	LSM-21367	BRD-K17215500	54620154	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22-,27+/m1/s1	RGYLHRJGNKTVCX-LOYIFYEOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K17215500	BRD-K17215500-001-01-3	Broad Institute of MIT and Harvard	BRD-K17215500			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22-,27+/m1/s1	RGYLHRJGNKTVCX-LOYIFYEOSA-N	518.289305736							109940
BRD-K59261651	LSM-15043		54620067	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20-,25+/m0/s1	WLSSZJWPMNLWIC-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K59261651	BRD-K59261651-001-01-3	Broad Institute of MIT and Harvard	BRD-K59261651			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20-,25+/m0/s1	WLSSZJWPMNLWIC-ZYLNGJIFSA-N	492.26579309							103699
BRD-K08982929-001-01-2	LSM-21368	BRD-K08982929	54620042	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19+,25-/m0/s1	DGDCFHNDGOPSJV-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K08982929	BRD-K08982929-001-01-2	Broad Institute of MIT and Harvard	BRD-K08982929			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19+,25-/m0/s1	DGDCFHNDGOPSJV-CEYNDMKZSA-N	499.221954458							109941
BRD-K67110065-001-01-2	LSM-43930	BRD-K67110065	54620097	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17-,22+/m1/s1	OYMACNCEHZXLLK-BHXJVOJVSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K67110065	BRD-K67110065-001-01-2	Broad Institute of MIT and Harvard	BRD-K67110065			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17-,22+/m1/s1	OYMACNCEHZXLLK-BHXJVOJVSA-N	455.22203467							
BRD-K95946433-001-01-0	LSM-43931	BRD-K95946433	54619948	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17-,22+/m0/s1	OYMACNCEHZXLLK-NVQMMVJZSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K95946433	BRD-K95946433-001-01-0	Broad Institute of MIT and Harvard	BRD-K95946433			C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17-,22+/m0/s1	OYMACNCEHZXLLK-NVQMMVJZSA-N	455.22203467							
BRD-K85029073-001-01-2	LSM-21371	BRD-K85029073	54620098	InChI=1S/C28H33N3O5/c1-18-14-31(19(2)17-32)27(33)24-12-21(10-9-20-7-8-20)13-29-26(24)36-25(18)16-30(3)15-22-5-4-6-23(11-22)28(34)35/h4-6,11-13,18-20,25,32H,7-8,14-17H2,1-3H3,(H,34,35)/t18-,19+,25-/m1/s1	UQQOYFSIYPJILQ-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3ncc(cc3C1=O)C#CC4CC4	BroadT	BRD-K85029073	BRD-K85029073-001-01-2	Broad Institute of MIT and Harvard	BRD-K85029073			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2ncc(cc2C1=O)C#CC1CC1	InChI=1S/C28H33N3O5/c1-18-14-31(19(2)17-32)27(33)24-12-21(10-9-20-7-8-20)13-29-26(24)36-25(18)16-30(3)15-22-5-4-6-23(11-22)28(34)35/h4-6,11-13,18-20,25,32H,7-8,14-17H2,1-3H3,(H,34,35)/t18-,19+,25-/m1/s1	UQQOYFSIYPJILQ-HHJKRLRDSA-N	491.242021186							109944
BRD-K04320847-001-01-8	LSM-21372	BRD-K04320847	54620071	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21+,27+/m0/s1	GYMQUQFWPBAZQS-FYQCMVGJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ncc(cc3C1=O)c4cccc(c4)C(=O)N(C)C	BroadT	BRD-K04320847	BRD-K04320847-001-01-8	Broad Institute of MIT and Harvard	BRD-K04320847			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21+,27+/m0/s1	GYMQUQFWPBAZQS-FYQCMVGJSA-N	580.235555602							109945
BRD-K72723881-001-01-7	LSM-43932	BRD-K72723881	54620157	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18+,22+/m0/s1	QZTHWNUUUJWOTB-FCJXAUIASA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)Cc3ccccn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K72723881	BRD-K72723881-001-01-7	Broad Institute of MIT and Harvard	BRD-K72723881			C\C=C\c1cnc2O[C@H](CN(C)C(=O)Cc3ccccn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18+,22+/m0/s1	QZTHWNUUUJWOTB-FCJXAUIASA-N	452.242355544							
BRD-K26579401-001-01-1	LSM-43933	BRD-K26579401	54620115	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18+,23+/m0/s1	BFKPGMXAQGECHU-CVUMNSLOSA-N	C\C=C\c1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K26579401	BRD-K26579401-001-01-1	Broad Institute of MIT and Harvard	BRD-K26579401			C\C=C\c1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18+,23+/m0/s1	BFKPGMXAQGECHU-CVUMNSLOSA-N	441.242770114							
BRD-K29663484-001-01-0	LSM-21375	BRD-K29663484	54620187	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22-,27+/m1/s1	NEJWGONYBYROJQ-LOYIFYEOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K29663484	BRD-K29663484-001-01-0	Broad Institute of MIT and Harvard	BRD-K29663484			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22-,27+/m1/s1	NEJWGONYBYROJQ-LOYIFYEOSA-N	519.273321314							109948
BRD-K48786364-001-01-1	LSM-21376	BRD-K48786364	54619984	InChI=1S/C23H33N3O4/c1-7-21(28)25(6)13-20-16(4)12-26(17(5)14-27)23(29)19-10-18(9-8-15(2)3)11-24-22(19)30-20/h10-11,15-17,20,27H,7,12-14H2,1-6H3/t16-,17+,20+/m0/s1	YINCXXWYKWHBGE-SQGPQFPESA-N	CCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)C	BroadT	BRD-K48786364	BRD-K48786364-001-01-1	Broad Institute of MIT and Harvard	BRD-K48786364			CCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)C	InChI=1S/C23H33N3O4/c1-7-21(28)25(6)13-20-16(4)12-26(17(5)14-27)23(29)19-10-18(9-8-15(2)3)11-24-22(19)30-20/h10-11,15-17,20,27H,7,12-14H2,1-6H3/t16-,17+,20+/m0/s1	YINCXXWYKWHBGE-SQGPQFPESA-N	415.247106566							109949
BRD-K53886241-001-01-0	LSM-21377	BRD-K53886241	54619963	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19-,25-/m1/s1	LKWROLXNVKNHNW-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)c4ccccc4	BroadT	BRD-K53886241	BRD-K53886241-001-01-0	Broad Institute of MIT and Harvard	BRD-K53886241			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)-c1ccccc1	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19-,25-/m1/s1	LKWROLXNVKNHNW-MPCDZSKCSA-N	491.22203467							109950
BRD-K77089907-001-01-8	LSM-21378	BRD-K77089907	54619916	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16+,20-/m1/s1	LAMQXQQGALMYJX-GQIGUUNPSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3cncnc3	BroadT	BRD-K77089907	BRD-K77089907-001-01-8	Broad Institute of MIT and Harvard	BRD-K77089907			CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cncnc1	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16+,20-/m1/s1	LAMQXQQGALMYJX-GQIGUUNPSA-N	456.248503564							109951
BRD-K60216900-001-01-3	LSM-21379	BRD-K60216900	54620140	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17-,21+/m0/s1	GOVSZGQIERTMRS-XGHQBKJUSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K60216900	BRD-K60216900-001-01-3	Broad Institute of MIT and Harvard	BRD-K60216900			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17-,21+/m0/s1	GOVSZGQIERTMRS-XGHQBKJUSA-N	466.213757518							109952
BRD-K35443780	LSM-15136		54620040	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22-,28-/m0/s1	WFHCWVTWIFSLHF-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K35443780	BRD-K35443780-001-01-0	Broad Institute of MIT and Harvard	BRD-K35443780			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22-,28-/m0/s1	WFHCWVTWIFSLHF-VPYPWEPUSA-N	544.240721194							103792
BRD-K12469269-001-01-2	LSM-21380	BRD-K12469269	54619988	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22+,26+/m0/s1	QKGFYTRNDUTRSH-VVZHRXSXSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K12469269	BRD-K12469269-001-01-2	Broad Institute of MIT and Harvard	BRD-K12469269			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22+,26+/m0/s1	QKGFYTRNDUTRSH-VVZHRXSXSA-N	555.240306624							109953
BRD-K50627341-001-01-0	LSM-21381	BRD-K50627341	54619912	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17-,21-/m1/s1	GOVSZGQIERTMRS-CBGDNZLLSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K50627341	BRD-K50627341-001-01-0	Broad Institute of MIT and Harvard	BRD-K50627341			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17-,21-/m1/s1	GOVSZGQIERTMRS-CBGDNZLLSA-N	466.213757518							109954
BRD-K68315360	LSM-15154		54620037	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22+,28-/m0/s1	WFHCWVTWIFSLHF-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K68315360	BRD-K68315360-001-01-8	Broad Institute of MIT and Harvard	BRD-K68315360			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22+,28-/m0/s1	WFHCWVTWIFSLHF-TYPXCFOJSA-N	544.240721194							103810
BRD-K37905497-001-01-0	LSM-21382	BRD-K37905497	54619896	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18-,23-/m1/s1	YZGVRROAGSWMNC-PMAPCBKXSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K37905497	BRD-K37905497-001-01-0	Broad Institute of MIT and Harvard	BRD-K37905497			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18-,23-/m1/s1	YZGVRROAGSWMNC-PMAPCBKXSA-N	507.220320108							109955
BRD-K18273912-001-01-3	LSM-21383	BRD-K18273912	54619989	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16-,21+/m0/s1	PQYRKZJHUJLFNK-CKJXQJPGSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K18273912	BRD-K18273912-001-01-3	Broad Institute of MIT and Harvard	BRD-K18273912			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16-,21+/m0/s1	PQYRKZJHUJLFNK-CKJXQJPGSA-N	459.21694929							109956
BRD-K96638043-001-01-4	LSM-43934	BRD-K96638043	54620095	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18-,23-/m0/s1	BFKPGMXAQGECHU-NDFOOXLDSA-N	C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K96638043	BRD-K96638043-001-01-4	Broad Institute of MIT and Harvard	BRD-K96638043			C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18-,23-/m0/s1	BFKPGMXAQGECHU-NDFOOXLDSA-N	441.242770114							
BRD-K53731727-001-01-1	LSM-21385	BRD-K53731727	54620185	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20-,27-/m0/s1	OEWYWQPTOLBINC-OSOCVKALSA-N	COc1ccccc1c2cnc3O[C@@H](CN(C)Cc4ccc(F)cc4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K53731727	BRD-K53731727-001-01-1	Broad Institute of MIT and Harvard	BRD-K53731727			COc1ccccc1-c1cnc2O[C@@H](CN(C)Cc3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H34FN3O4/c1-19-15-33(20(2)18-34)29(35)25-13-22(24-7-5-6-8-26(24)36-4)14-31-28(25)37-27(19)17-32(3)16-21-9-11-23(30)12-10-21/h5-14,19-20,27,34H,15-18H2,1-4H3/t19-,20-,27-/m0/s1	OEWYWQPTOLBINC-OSOCVKALSA-N	507.253334798							109958
BRD-K35081305-001-01-4	LSM-21386	BRD-K35081305	54620072	InChI=1S/C23H33N3O4/c1-7-21(28)25(6)13-20-16(4)12-26(17(5)14-27)23(29)19-10-18(9-8-15(2)3)11-24-22(19)30-20/h10-11,15-17,20,27H,7,12-14H2,1-6H3/t16-,17+,20-/m1/s1	YINCXXWYKWHBGE-FUHIMQAGSA-N	CCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)C	BroadT	BRD-K35081305	BRD-K35081305-001-01-4	Broad Institute of MIT and Harvard	BRD-K35081305			CCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)C	InChI=1S/C23H33N3O4/c1-7-21(28)25(6)13-20-16(4)12-26(17(5)14-27)23(29)19-10-18(9-8-15(2)3)11-24-22(19)30-20/h10-11,15-17,20,27H,7,12-14H2,1-6H3/t16-,17+,20-/m1/s1	YINCXXWYKWHBGE-FUHIMQAGSA-N	415.247106566							109959
BRD-K35021164-001-01-0	LSM-43935	BRD-K35021164	54620024	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18+,23-/m1/s1	BFKPGMXAQGECHU-VSZQWZHASA-N	C\C=C\c1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K35021164	BRD-K35021164-001-01-0	Broad Institute of MIT and Harvard	BRD-K35021164			C\C=C\c1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18+,23-/m1/s1	BFKPGMXAQGECHU-VSZQWZHASA-N	441.242770114							
MLS003130164	LSM-15048	BRD-K66703091, SID99358813	46903562	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21-,27-/m0/s1	XTWZIVUPDNYJMX-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K66703091	BRD-K66703091-001-02-1	Broad Institute of MIT and Harvard	BRD-K66703091			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21-,27-/m0/s1	XTWZIVUPDNYJMX-IZVMNLJQSA-N	502.238019092							103704
BRD-K47139673-001-01-0	LSM-21388	BRD-K47139673	54620130	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18-,22+/m1/s1	UDSHYHUEGCAODY-HMFYCAOWSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K47139673	BRD-K47139673-001-01-0	Broad Institute of MIT and Harvard	BRD-K47139673			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18-,22+/m1/s1	UDSHYHUEGCAODY-HMFYCAOWSA-N	479.245392004							109961
BRD-K08459332-001-01-2	LSM-21389	BRD-K08459332	54620122	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22-,26+/m0/s1	QKGFYTRNDUTRSH-AOJNWGRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K08459332	BRD-K08459332-001-01-2	Broad Institute of MIT and Harvard	BRD-K08459332			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22-,26+/m0/s1	QKGFYTRNDUTRSH-AOJNWGRGSA-N	555.240306624							109962
BRD-K52987155-001-01-1	LSM-21390	BRD-K52987155	54620075	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18-,22-/m0/s1	UDSHYHUEGCAODY-SPEDKVCISA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K52987155	BRD-K52987155-001-01-1	Broad Institute of MIT and Harvard	BRD-K52987155			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18-,22-/m0/s1	UDSHYHUEGCAODY-SPEDKVCISA-N	479.245392004							109963
BRD-K31165886-001-01-6	LSM-43936	BRD-K31165886	54620092	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19-,23+/m1/s1	DIUXSDCPAZQGFR-HUUKXORASA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K31165886	BRD-K31165886-001-01-6	Broad Institute of MIT and Harvard	BRD-K31165886			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19-,23+/m1/s1	DIUXSDCPAZQGFR-HUUKXORASA-N	478.250143026							
BRD-K95793811-001-01-8	LSM-21392	BRD-K95793811	54619895	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18+,23+/m1/s1	YVWHEBSLRQSAGP-STSQHVNTSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3cccc(c3)C#N	BroadT	BRD-K95793811	BRD-K95793811-001-01-8	Broad Institute of MIT and Harvard	BRD-K95793811			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cccc(c1)C#N	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18+,23+/m1/s1	YVWHEBSLRQSAGP-STSQHVNTSA-N	479.253254586							109965
BRD-K40777138-001-01-3	LSM-43937	BRD-K40777138	54619914	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17+,22-/m1/s1	OYMACNCEHZXLLK-RKSGROMUSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K40777138	BRD-K40777138-001-01-3	Broad Institute of MIT and Harvard	BRD-K40777138			C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17+,22-/m1/s1	OYMACNCEHZXLLK-RKSGROMUSA-N	455.22203467							
BRD-K93169170-001-01-8	LSM-43938	BRD-K93169170	54620165	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18+,22-/m0/s1	QZTHWNUUUJWOTB-XUUGNWBGSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Cc3ccccn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K93169170	BRD-K93169170-001-01-8	Broad Institute of MIT and Harvard	BRD-K93169170			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Cc3ccccn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18+,22-/m0/s1	QZTHWNUUUJWOTB-XUUGNWBGSA-N	452.242355544							
BRD-K95971121-001-01-5	LSM-21395	BRD-K95971121	54619976	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17-,21+/m1/s1	GOVSZGQIERTMRS-LZJOCLMNSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K95971121	BRD-K95971121-001-01-5	Broad Institute of MIT and Harvard	BRD-K95971121			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17-,21+/m1/s1	GOVSZGQIERTMRS-LZJOCLMNSA-N	466.213757518							109968
BRD-K75528981-001-01-6	LSM-21396	BRD-K75528981	54619924	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19+,25+/m0/s1	LKWROLXNVKNHNW-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)c4ccccc4	BroadT	BRD-K75528981	BRD-K75528981-001-01-6	Broad Institute of MIT and Harvard	BRD-K75528981			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)-c1ccccc1	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19+,25+/m0/s1	LKWROLXNVKNHNW-OSWQYVSFSA-N	491.22203467							109969
BRD-K46168416-001-01-2	LSM-43939	BRD-K46168416	54620028	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19-,23+/m0/s1	DIUXSDCPAZQGFR-DRNXGGFFSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K46168416	BRD-K46168416-001-01-2	Broad Institute of MIT and Harvard	BRD-K46168416			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19-,23+/m0/s1	DIUXSDCPAZQGFR-DRNXGGFFSA-N	478.250143026							
BRD-K64379850-001-01-5	LSM-43940	BRD-K64379850	54620103	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18-,24+/m1/s1	RIYOKFYBASFFQM-WEKXCRNGSA-N	C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K64379850	BRD-K64379850-001-01-5	Broad Institute of MIT and Harvard	BRD-K64379850			C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18-,24+/m1/s1	RIYOKFYBASFFQM-WEKXCRNGSA-N	467.242021186							
BRD-K43351931-001-01-3	LSM-21399	BRD-K43351931	54619934	InChI=1S/C28H39N3O4/c1-19-15-31(20(2)18-32)28(33)25-13-23(22-10-7-11-24(12-22)34-4)14-29-27(25)35-26(19)17-30(3)16-21-8-5-6-9-21/h7,10-14,19-21,26,32H,5-6,8-9,15-18H2,1-4H3/t19-,20+,26+/m1/s1	IDUFABHFDSGNRC-GOHWNWGWSA-N	COc1cccc(c1)c2cnc3O[C@@H](CN(C)CC4CCCC4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K43351931	BRD-K43351931-001-01-3	Broad Institute of MIT and Harvard	BRD-K43351931			COc1cccc(c1)-c1cnc2O[C@@H](CN(C)CC3CCCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O4/c1-19-15-31(20(2)18-32)28(33)25-13-23(22-10-7-11-24(12-22)34-4)14-29-27(25)35-26(19)17-30(3)16-21-8-5-6-9-21/h7,10-14,19-21,26,32H,5-6,8-9,15-18H2,1-4H3/t19-,20+,26+/m1/s1	IDUFABHFDSGNRC-GOHWNWGWSA-N	481.294056758							109972
BRD-K90379662-001-01-1	LSM-43941	BRD-K90379662	54620133	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18-,22-/m0/s1	QZTHWNUUUJWOTB-OPJMQWPPSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Cc3ccccn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K90379662	BRD-K90379662-001-01-1	Broad Institute of MIT and Harvard	BRD-K90379662			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Cc3ccccn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18-,22-/m0/s1	QZTHWNUUUJWOTB-OPJMQWPPSA-N	452.242355544							
BRD-K38604313-001-01-0	LSM-21401	BRD-K38604313	54620158	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18+,22+/m0/s1	UDSHYHUEGCAODY-NJNPRVFISA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K38604313	BRD-K38604313-001-01-0	Broad Institute of MIT and Harvard	BRD-K38604313			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18+,22+/m0/s1	UDSHYHUEGCAODY-NJNPRVFISA-N	479.245392004							109974
BRD-K68312902-001-01-0	LSM-21402	BRD-K68312902	54619937	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22-,27-/m0/s1	NEJWGONYBYROJQ-BERHBOFZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K68312902	BRD-K68312902-001-01-0	Broad Institute of MIT and Harvard	BRD-K68312902			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22-,27-/m0/s1	NEJWGONYBYROJQ-BERHBOFZSA-N	519.273321314							109975
BRD-K43781234-001-01-5	LSM-21403	BRD-K43781234	54620029	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22+,27-/m0/s1	RGYLHRJGNKTVCX-XXAUWVGASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K43781234	BRD-K43781234-001-01-5	Broad Institute of MIT and Harvard	BRD-K43781234			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22+,27-/m0/s1	RGYLHRJGNKTVCX-XXAUWVGASA-N	518.289305736							109976
BRD-K85270293-001-01-6	LSM-21404	BRD-K85270293	54619915	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22-,27-/m0/s1	SOAPYNAROURGPA-BERHBOFZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K85270293	BRD-K85270293-001-01-6	Broad Institute of MIT and Harvard	BRD-K85270293			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22-,27-/m0/s1	SOAPYNAROURGPA-BERHBOFZSA-N	537.22974194							109977
BRD-K59131057-001-01-8	LSM-43942	BRD-K59131057	54619973	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18+,24-/m0/s1	RIYOKFYBASFFQM-YODBPKAKSA-N	C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K59131057	BRD-K59131057-001-01-8	Broad Institute of MIT and Harvard	BRD-K59131057			C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18+,24-/m0/s1	RIYOKFYBASFFQM-YODBPKAKSA-N	467.242021186							
BRD-K61947065-001-01-3	LSM-21406	BRD-K61947065	54619962	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15+,19-/m1/s1	YKXPYIASKYVMCP-ZRGWGRIASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)C3=CCCC3	BroadT	BRD-K61947065	BRD-K61947065-001-01-3	Broad Institute of MIT and Harvard	BRD-K61947065			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15+,19-/m1/s1	YKXPYIASKYVMCP-ZRGWGRIASA-N	437.198441812							109979
BRD-K98849963-001-01-1	LSM-21407	BRD-K98849963	54619919	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18-,23+/m1/s1	JSXDBGGCWARADO-NWFVXXGESA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K98849963	BRD-K98849963-001-01-1	Broad Institute of MIT and Harvard	BRD-K98849963			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18-,23+/m1/s1	JSXDBGGCWARADO-NWFVXXGESA-N	548.224654732							109980
BRD-K02892219-001-01-8	LSM-43943	BRD-K02892219	54620021	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17-,22-/m0/s1	OYMACNCEHZXLLK-MRXSJHDESA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K02892219	BRD-K02892219-001-01-8	Broad Institute of MIT and Harvard	BRD-K02892219			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17-,22-/m0/s1	OYMACNCEHZXLLK-MRXSJHDESA-N	455.22203467							
BRD-K87632135-001-01-7	LSM-21409	BRD-K87632135	54619995	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17-,23-/m0/s1	SBQRHQGOZJVRTE-QQMNAOGKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(F)c4	BroadT	BRD-K87632135	BRD-K87632135-001-01-7	Broad Institute of MIT and Harvard	BRD-K87632135			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(F)c1	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17-,23-/m0/s1	SBQRHQGOZJVRTE-QQMNAOGKSA-N	490.193771002							109982
BRD-K87024306-001-01-0	LSM-21410	BRD-K87024306	54619960	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19+,23-/m1/s1	LXUHOAUTESRKLV-SELNLUPBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K87024306	BRD-K87024306-001-01-0	Broad Institute of MIT and Harvard	BRD-K87024306			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19+,23-/m1/s1	LXUHOAUTESRKLV-SELNLUPBSA-N	468.273655672							109983
BRD-K11230389-001-01-4	LSM-21411	BRD-K11230389	54620166	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19+,25-/m1/s1	LKWROLXNVKNHNW-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)c4ccccc4	BroadT	BRD-K11230389	BRD-K11230389-001-01-4	Broad Institute of MIT and Harvard	BRD-K11230389			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)-c1ccccc1	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19+,25-/m1/s1	LKWROLXNVKNHNW-HHJKRLRDSA-N	491.22203467							109984
BRD-K55276838-001-01-1	LSM-21412	BRD-K55276838	54620118	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17-,21+/m1/s1	IGKRWIJRXULJPM-LZJOCLMNSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc3ccncc3	BroadT	BRD-K55276838	BRD-K55276838-001-01-1	Broad Institute of MIT and Harvard	BRD-K55276838			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc1ccncc1	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17-,21+/m1/s1	IGKRWIJRXULJPM-LZJOCLMNSA-N	429.172227064							109985
BRD-K67713041-001-01-2	LSM-21413	BRD-K67713041	54620045	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18+,24+/m1/s1	FWSGSYZJGWMBSU-YTZAWJCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K67713041	BRD-K67713041-001-01-2	Broad Institute of MIT and Harvard	BRD-K67713041			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18+,24+/m1/s1	FWSGSYZJGWMBSU-YTZAWJCFSA-N	500.217203436							109986
BRD-K10012999-001-01-9	LSM-21414	BRD-K10012999	54619983	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16-,21+/m1/s1	PQYRKZJHUJLFNK-ZOCZFRKYSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K10012999	BRD-K10012999-001-01-9	Broad Institute of MIT and Harvard	BRD-K10012999			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16-,21+/m1/s1	PQYRKZJHUJLFNK-ZOCZFRKYSA-N	459.21694929							109987
BRD-K97178849-001-01-6	LSM-21415	BRD-K97178849	54620129	InChI=1S/C25H36N2O4S/c1-6-13-26(5)16-24-19(3)15-27(20(4)17-28)32(29,30)25-12-11-21(14-23(25)31-24)22-10-8-7-9-18(22)2/h7-12,14,19-20,24,28H,6,13,15-17H2,1-5H3/t19-,20+,24-/m1/s1	OGNBHIXSMVQURJ-JXALWOEJSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3C	BroadT	BRD-K97178849	BRD-K97178849-001-01-6	Broad Institute of MIT and Harvard	BRD-K97178849			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1C	InChI=1S/C25H36N2O4S/c1-6-13-26(5)16-24-19(3)15-27(20(4)17-28)32(29,30)25-12-11-21(14-23(25)31-24)22-10-8-7-9-18(22)2/h7-12,14,19-20,24,28H,6,13,15-17H2,1-5H3/t19-,20+,24-/m1/s1	OGNBHIXSMVQURJ-JXALWOEJSA-N	460.239578342							109988
BRD-K53624900-001-01-7	LSM-21416	BRD-K53624900	54619927	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18+,24-/m0/s1	FWSGSYZJGWMBSU-RHGYRFJNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K53624900	BRD-K53624900-001-01-7	Broad Institute of MIT and Harvard	BRD-K53624900			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18+,24-/m0/s1	FWSGSYZJGWMBSU-RHGYRFJNSA-N	500.217203436							109989
BRD-K19894843-001-01-9	LSM-21417	BRD-K19894843	54620152	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15-,19+/m1/s1	YKXPYIASKYVMCP-CLCXKQKWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)C3=CCCC3	BroadT	BRD-K19894843	BRD-K19894843-001-01-9	Broad Institute of MIT and Harvard	BRD-K19894843			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15-,19+/m1/s1	YKXPYIASKYVMCP-CLCXKQKWSA-N	437.198441812							109990
BRD-K59025717-001-01-4	LSM-21418	BRD-K59025717	54620073	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19-,25-/m0/s1	LKWROLXNVKNHNW-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)c4ccccc4	BroadT	BRD-K59025717	BRD-K59025717-001-01-4	Broad Institute of MIT and Harvard	BRD-K59025717			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)-c1ccccc1	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19-,25-/m0/s1	LKWROLXNVKNHNW-MHPIHPPYSA-N	491.22203467							109991
MLS003129942	LSM-21419	SID99358488, BRD-K90016262	46903316	InChI=1S/C21H32BrN3O5S/c1-14-11-25(15(2)13-26)31(28,29)20-9-8-16(22)10-18(20)30-19(14)12-24(3)21(27)23-17-6-4-5-7-17/h8-10,14-15,17,19,26H,4-7,11-13H2,1-3H3,(H,23,27)/t14-,15+,19+/m0/s1	SZIKTFJCEPOTBZ-QMTMVMCOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K90016262	BRD-K90016262-001-01-3	Broad Institute of MIT and Harvard	BRD-K90016262			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C21H32BrN3O5S/c1-14-11-25(15(2)13-26)31(28,29)20-9-8-16(22)10-18(20)30-19(14)12-24(3)21(27)23-17-6-4-5-7-17/h8-10,14-15,17,19,26H,4-7,11-13H2,1-3H3,(H,23,27)/t14-,15+,19+/m0/s1	SZIKTFJCEPOTBZ-QMTMVMCOSA-N	517.124604444							109992
BRD-K63215447-001-01-2	LSM-21420	BRD-K63215447	54619981	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16-,20-/m0/s1	AMHLQJBMVIBTQJ-FTRWYGJKSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K63215447	BRD-K63215447-001-01-2	Broad Institute of MIT and Harvard	BRD-K63215447			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16-,20-/m0/s1	AMHLQJBMVIBTQJ-FTRWYGJKSA-N	431.242021186							109993
BRD-K02480217-001-01-4	LSM-21421	BRD-K02480217	54619955	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17+,23+/m0/s1	SBQRHQGOZJVRTE-YGKZAACZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(F)c4	BroadT	BRD-K02480217	BRD-K02480217-001-01-4	Broad Institute of MIT and Harvard	BRD-K02480217			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(F)c1	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17+,23+/m0/s1	SBQRHQGOZJVRTE-YGKZAACZSA-N	490.193771002							109994
BRD-K53394379-001-01-9	LSM-21422	BRD-K53394379	54620160	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20-,24-/m0/s1	IWCIQXTVMOHXRP-SKPFHBQLSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K53394379	BRD-K53394379-001-01-9	Broad Institute of MIT and Harvard	BRD-K53394379			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20-,24-/m0/s1	IWCIQXTVMOHXRP-SKPFHBQLSA-N	506.245057646							109995
BRD-K88384956-001-01-0	LSM-43944	BRD-K88384956	54620139	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17+,22+/m0/s1	OYMACNCEHZXLLK-ZKLGMUCWSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K88384956	BRD-K88384956-001-01-0	Broad Institute of MIT and Harvard	BRD-K88384956			C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17+,22+/m0/s1	OYMACNCEHZXLLK-ZKLGMUCWSA-N	455.22203467							
BRD-K50979335-001-01-3	LSM-21424	BRD-K50979335	54620109	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17+,20+/m1/s1	WPCNIHGKOXVEOP-UWVAXJGDSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K50979335	BRD-K50979335-001-01-3	Broad Institute of MIT and Harvard	BRD-K50979335			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17+,20+/m1/s1	WPCNIHGKOXVEOP-UWVAXJGDSA-N	408.208278214							109997
BRD-K61313778-001-01-6	LSM-21425	BRD-K61313778	54619959	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17-,21-/m0/s1	GOVSZGQIERTMRS-FIKGOQFSSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K61313778	BRD-K61313778-001-01-6	Broad Institute of MIT and Harvard	BRD-K61313778			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17-,21-/m0/s1	GOVSZGQIERTMRS-FIKGOQFSSA-N	466.213757518							109998
BRD-K02309749-001-01-2	LSM-21426	BRD-K02309749	54620173	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16-,21-/m0/s1	PQYRKZJHUJLFNK-QYWGDWMGSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K02309749	BRD-K02309749-001-01-2	Broad Institute of MIT and Harvard	BRD-K02309749			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16-,21-/m0/s1	PQYRKZJHUJLFNK-QYWGDWMGSA-N	459.21694929							109999
BRD-K85266003-001-01-5	LSM-21427	BRD-K85266003	54620114	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18-,23+/m1/s1	YVWHEBSLRQSAGP-PNCHPQGNSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3cccc(c3)C#N	BroadT	BRD-K85266003	BRD-K85266003-001-01-5	Broad Institute of MIT and Harvard	BRD-K85266003			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1cccc(c1)C#N	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18-,23+/m1/s1	YVWHEBSLRQSAGP-PNCHPQGNSA-N	479.253254586							110000
BRD-K27517283-001-01-3	LSM-21428	BRD-K27517283	54620033	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19-,23+/m1/s1	LXUHOAUTESRKLV-PWHSHALESA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K27517283	BRD-K27517283-001-01-3	Broad Institute of MIT and Harvard	BRD-K27517283			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19-,23+/m1/s1	LXUHOAUTESRKLV-PWHSHALESA-N	468.273655672							110001
BRD-K29211776	LSM-15030		54620145	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21-,27+/m0/s1	XTWZIVUPDNYJMX-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K29211776	BRD-K29211776-001-01-5	Broad Institute of MIT and Harvard	BRD-K29211776			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21-,27+/m0/s1	XTWZIVUPDNYJMX-NOMHHCBYSA-N	502.238019092							103686
BRD-K91321198-001-01-5	LSM-21429	BRD-K91321198	54619945	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19+,25-/m1/s1	DGDCFHNDGOPSJV-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K91321198	BRD-K91321198-001-01-5	Broad Institute of MIT and Harvard	BRD-K91321198			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19+,25-/m1/s1	DGDCFHNDGOPSJV-HHJKRLRDSA-N	499.221954458							110002
BRD-K42505092-001-01-0	LSM-21430	BRD-K42505092	54620183	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27+/m1/s1	JOUFKROXUSGCKL-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K42505092	BRD-K42505092-001-01-0	Broad Institute of MIT and Harvard	BRD-K42505092			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C28H32N4O4S/c1-20-16-32(21(2)19-33)37(34,35)28-12-11-24(23-9-7-22(15-29)8-10-23)14-26(28)36-27(20)18-31(3)17-25-6-4-5-13-30-25/h4-14,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27+/m1/s1	JOUFKROXUSGCKL-BUEREQSYSA-N	520.214426234							110003
BRD-K32033013-001-01-1	LSM-21431	BRD-K32033013	54620041	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18+,23-/m1/s1	YVWHEBSLRQSAGP-IEGUWTFLSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3cccc(c3)C#N	BroadT	BRD-K32033013	BRD-K32033013-001-01-1	Broad Institute of MIT and Harvard	BRD-K32033013			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cccc(c1)C#N	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18+,23-/m1/s1	YVWHEBSLRQSAGP-IEGUWTFLSA-N	479.253254586							110004
BRD-K23330877-001-01-7	LSM-43945	BRD-K23330877	54620012	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18-,24-/m0/s1	RIYOKFYBASFFQM-YYXFMYSKSA-N	C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K23330877	BRD-K23330877-001-01-7	Broad Institute of MIT and Harvard	BRD-K23330877			C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18-,24-/m0/s1	RIYOKFYBASFFQM-YYXFMYSKSA-N	467.242021186							
BRD-K54195882-001-01-9	LSM-21433	BRD-K54195882	54620017	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19-,24-/m1/s1	JHVMXPAASGDEJW-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K54195882	BRD-K54195882-001-01-9	Broad Institute of MIT and Harvard	BRD-K54195882			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19-,24-/m1/s1	JHVMXPAASGDEJW-KHCICDEESA-N	516.240640982							110006
BRD-K74268052-001-01-4	LSM-21434	BRD-K74268052	54619977	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22+,27-/m1/s1	RGYLHRJGNKTVCX-UMTXDNHDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K74268052	BRD-K74268052-001-01-4	Broad Institute of MIT and Harvard	BRD-K74268052			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22+,27-/m1/s1	RGYLHRJGNKTVCX-UMTXDNHDSA-N	518.289305736							110007
BRD-K36978906-001-01-3	LSM-21435	BRD-K36978906	54620009	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17+,21+/m1/s1	IGKRWIJRXULJPM-WWMYMODYSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc3ccncc3	BroadT	BRD-K36978906	BRD-K36978906-001-01-3	Broad Institute of MIT and Harvard	BRD-K36978906			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc1ccncc1	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17+,21+/m1/s1	IGKRWIJRXULJPM-WWMYMODYSA-N	429.172227064							110008
MLS003129007	LSM-21436	SID99359568, BRD-K61739794	46904130	InChI=1S/C22H28BrFN2O4S/c1-15-11-26(16(2)14-27)31(28,29)22-9-8-18(23)10-20(22)30-21(15)13-25(3)12-17-6-4-5-7-19(17)24/h4-10,15-16,21,27H,11-14H2,1-3H3/t15-,16-,21-/m0/s1	YUIZGYZJTZMJNG-QYWGDWMGSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2F)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K61739794	BRD-K61739794-001-01-2	Broad Institute of MIT and Harvard	BRD-K61739794			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2F)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H28BrFN2O4S/c1-15-11-26(16(2)14-27)31(28,29)22-9-8-18(23)10-20(22)30-21(15)13-25(3)12-17-6-4-5-7-19(17)24/h4-10,15-16,21,27H,11-14H2,1-3H3/t15-,16-,21-/m0/s1	YUIZGYZJTZMJNG-QYWGDWMGSA-N	514.093718886							110009
BRD-K28006752-001-01-8	LSM-21437	BRD-K28006752	54619918	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16-,20-/m0/s1	LAMQXQQGALMYJX-FTRWYGJKSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3cncnc3	BroadT	BRD-K28006752	BRD-K28006752-001-01-8	Broad Institute of MIT and Harvard	BRD-K28006752			CC(C)NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1cncnc1	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16-,20-/m0/s1	LAMQXQQGALMYJX-FTRWYGJKSA-N	456.248503564							110010
BRD-K53473196-001-01-2	LSM-21438	BRD-K53473196	54620182	InChI=1S/C27H35N3O5S2/c1-19-16-30(20(2)18-31)27(32)23-14-22(11-6-10-21-8-4-5-9-21)15-28-26(23)35-24(19)17-29(3)37(33,34)25-12-7-13-36-25/h7,12-15,19-21,24,31H,4-5,8-10,16-18H2,1-3H3/t19-,20-,24+/m0/s1	VAEQCBKICRQYMW-MZLICYQSSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc3ncc(cc3C1=O)C#CCC4CCCC4	BroadT	BRD-K53473196	BRD-K53473196-001-01-2	Broad Institute of MIT and Harvard	BRD-K53473196			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H35N3O5S2/c1-19-16-30(20(2)18-31)27(32)23-14-22(11-6-10-21-8-4-5-9-21)15-28-26(23)35-24(19)17-29(3)37(33,34)25-12-7-13-36-25/h7,12-15,19-21,24,31H,4-5,8-10,16-18H2,1-3H3/t19-,20-,24+/m0/s1	VAEQCBKICRQYMW-MZLICYQSSA-N	545.20181263							110011
BRD-K58125881-001-01-3	LSM-21439	BRD-K58125881	54620135	InChI=1S/C25H36N2O4S/c1-6-13-26(5)16-24-19(3)15-27(20(4)17-28)32(29,30)25-12-11-21(14-23(25)31-24)22-10-8-7-9-18(22)2/h7-12,14,19-20,24,28H,6,13,15-17H2,1-5H3/t19-,20-,24-/m0/s1	OGNBHIXSMVQURJ-SKPFHBQLSA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3C	BroadT	BRD-K58125881	BRD-K58125881-001-01-3	Broad Institute of MIT and Harvard	BRD-K58125881			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1C	InChI=1S/C25H36N2O4S/c1-6-13-26(5)16-24-19(3)15-27(20(4)17-28)32(29,30)25-12-11-21(14-23(25)31-24)22-10-8-7-9-18(22)2/h7-12,14,19-20,24,28H,6,13,15-17H2,1-5H3/t19-,20-,24-/m0/s1	OGNBHIXSMVQURJ-SKPFHBQLSA-N	460.239578342							110012
BRD-K16809868-001-01-0	LSM-43946	BRD-K16809868	54620104	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18+,23+/m1/s1	BFKPGMXAQGECHU-XUCRUEBISA-N	C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K16809868	BRD-K16809868-001-01-0	Broad Institute of MIT and Harvard	BRD-K16809868			C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18+,23+/m1/s1	BFKPGMXAQGECHU-XUCRUEBISA-N	441.242770114							
BRD-K60387964-001-01-5	LSM-21441	BRD-K60387964	54619913	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20+,25+/m0/s1	WLSSZJWPMNLWIC-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K60387964	BRD-K60387964-001-01-5	Broad Institute of MIT and Harvard	BRD-K60387964			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20+,25+/m0/s1	WLSSZJWPMNLWIC-WZOHSFFVSA-N	492.26579309							110014
BRD-K08200735-001-01-3	LSM-43947	BRD-K08200735	54620001	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17+,22-/m0/s1	OYMACNCEHZXLLK-HVPMLNLYSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K08200735	BRD-K08200735-001-01-3	Broad Institute of MIT and Harvard	BRD-K08200735			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17+,22-/m0/s1	OYMACNCEHZXLLK-HVPMLNLYSA-N	455.22203467							
BRD-K92682487-001-01-9	LSM-21443	BRD-K92682487	54619942	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22-,26-/m0/s1	HNBFIRYNWWOTHM-MCEYFSPLSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K92682487	BRD-K92682487-001-01-9	Broad Institute of MIT and Harvard	BRD-K92682487			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22-,26-/m0/s1	HNBFIRYNWWOTHM-MCEYFSPLSA-N	527.245392004							110016
BRD-K91078372-001-01-9	LSM-21444	BRD-K91078372	54619938	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22-,26-/m1/s1	QKGFYTRNDUTRSH-XLGIIRLISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K91078372	BRD-K91078372-001-01-9	Broad Institute of MIT and Harvard	BRD-K91078372			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22-,26-/m1/s1	QKGFYTRNDUTRSH-XLGIIRLISA-N	555.240306624							110017
BRD-K98772502-001-01-3	LSM-21445	BRD-K98772502	54620143	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21-,27-/m1/s1	XTWZIVUPDNYJMX-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K98772502	BRD-K98772502-001-01-3	Broad Institute of MIT and Harvard	BRD-K98772502			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21-,27-/m1/s1	XTWZIVUPDNYJMX-LGVUCKNBSA-N	502.238019092							110018
BRD-K47724214	LSM-15141		54620005	InChI=1S/C25H33N3O4S/c1-5-12-27(4)16-24-18(2)15-28(19(3)17-29)33(30,31)25-11-10-22(13-23(25)32-24)21-8-6-20(14-26)7-9-21/h6-11,13,18-19,24,29H,5,12,15-17H2,1-4H3/t18-,19+,24-/m0/s1	MGOWLZBQMGKWLP-GLDPYIMESA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K47724214	BRD-K47724214-001-01-5	Broad Institute of MIT and Harvard	BRD-K47724214			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H33N3O4S/c1-5-12-27(4)16-24-18(2)15-28(19(3)17-29)33(30,31)25-11-10-22(13-23(25)32-24)21-8-6-20(14-26)7-9-21/h6-11,13,18-19,24,29H,5,12,15-17H2,1-4H3/t18-,19+,24-/m0/s1	MGOWLZBQMGKWLP-GLDPYIMESA-N	471.219177256							103797
BRD-K54396076-001-01-9	LSM-21446	BRD-K54396076	54620112	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19+,23-/m0/s1	LXUHOAUTESRKLV-YYDVJCTNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K54396076	BRD-K54396076-001-01-9	Broad Institute of MIT and Harvard	BRD-K54396076			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19+,23-/m0/s1	LXUHOAUTESRKLV-YYDVJCTNSA-N	468.273655672							110019
BRD-K20400143-001-01-9	LSM-21447	BRD-K20400143	54620059	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22-,27-/m1/s1	SOAPYNAROURGPA-VHFRWLAGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K20400143	BRD-K20400143-001-01-9	Broad Institute of MIT and Harvard	BRD-K20400143			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22-,27-/m1/s1	SOAPYNAROURGPA-VHFRWLAGSA-N	537.22974194							110020
BRD-K34922955-001-01-3	LSM-21448	BRD-K34922955	54619940	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22-,26-/m0/s1	QKGFYTRNDUTRSH-MCEYFSPLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K34922955	BRD-K34922955-001-01-3	Broad Institute of MIT and Harvard	BRD-K34922955			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22-,26-/m0/s1	QKGFYTRNDUTRSH-MCEYFSPLSA-N	555.240306624							110021
BRD-K92478944-001-01-9	LSM-43948	BRD-K92478944	54619939	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19-,23-/m1/s1	DIUXSDCPAZQGFR-QLTIVBBBSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K92478944	BRD-K92478944-001-01-9	Broad Institute of MIT and Harvard	BRD-K92478944			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19-,23-/m1/s1	DIUXSDCPAZQGFR-QLTIVBBBSA-N	478.250143026							
BRD-K10139498-001-01-6	LSM-21450	BRD-K10139498	54619958	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18+,23+/m1/s1	JSXDBGGCWARADO-YDSTWLSQSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K10139498	BRD-K10139498-001-01-6	Broad Institute of MIT and Harvard	BRD-K10139498			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18+,23+/m1/s1	JSXDBGGCWARADO-YDSTWLSQSA-N	548.224654732							110023
BRD-K41129686-001-01-2	LSM-21451	BRD-K41129686	54620150	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21+,27-/m1/s1	GYMQUQFWPBAZQS-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ncc(cc3C1=O)c4cccc(c4)C(=O)N(C)C	BroadT	BRD-K41129686	BRD-K41129686-001-01-2	Broad Institute of MIT and Harvard	BRD-K41129686			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21+,27-/m1/s1	GYMQUQFWPBAZQS-PBDKAQRYSA-N	580.235555602							110024
BRD-K34824520-001-01-7	LSM-43949	BRD-K34824520	54620170	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18-,23+/m1/s1	BFKPGMXAQGECHU-FXSWEOMTSA-N	C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K34824520	BRD-K34824520-001-01-7	Broad Institute of MIT and Harvard	BRD-K34824520			C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18-,23+/m1/s1	BFKPGMXAQGECHU-FXSWEOMTSA-N	441.242770114							
BRD-K42748942-001-01-8	LSM-21453	BRD-K42748942	54620035	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18+,22-/m1/s1	UDSHYHUEGCAODY-KGVIQGDOSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K42748942	BRD-K42748942-001-01-8	Broad Institute of MIT and Harvard	BRD-K42748942			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18+,22-/m1/s1	UDSHYHUEGCAODY-KGVIQGDOSA-N	479.245392004							110026
BRD-K60479766-001-01-0	LSM-21454	BRD-K60479766	54619890	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18+,23-/m0/s1	YZGVRROAGSWMNC-IXFSTUDKSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K60479766	BRD-K60479766-001-01-0	Broad Institute of MIT and Harvard	BRD-K60479766			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18+,23-/m0/s1	YZGVRROAGSWMNC-IXFSTUDKSA-N	507.220320108							110027
BRD-K56772972-001-01-4	LSM-21455	BRD-K56772972	54619931	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22+,27+/m1/s1	NEJWGONYBYROJQ-VHSZZVNMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K56772972	BRD-K56772972-001-01-4	Broad Institute of MIT and Harvard	BRD-K56772972			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22+,27+/m1/s1	NEJWGONYBYROJQ-VHSZZVNMSA-N	519.273321314							110028
BRD-K54200040-001-01-6	LSM-21456	BRD-K54200040	54619964	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17+,20-/m1/s1	WPCNIHGKOXVEOP-FUHIMQAGSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K54200040	BRD-K54200040-001-01-6	Broad Institute of MIT and Harvard	BRD-K54200040			CC(C)C#Cc1ccc2c(O[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17+,20-/m1/s1	WPCNIHGKOXVEOP-FUHIMQAGSA-N	408.208278214							110029
BRD-K60025532-001-01-4	LSM-21457	BRD-K60025532	54620008	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19-,23-/m0/s1	LXUHOAUTESRKLV-YDHSSHFGSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K60025532	BRD-K60025532-001-01-4	Broad Institute of MIT and Harvard	BRD-K60025532			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19-,23-/m0/s1	LXUHOAUTESRKLV-YDHSSHFGSA-N	468.273655672							110030
BRD-K93967984-001-01-1	LSM-21458	BRD-K93967984	54620055	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19+,25-/m0/s1	LKWROLXNVKNHNW-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)c4ccccc4	BroadT	BRD-K93967984	BRD-K93967984-001-01-1	Broad Institute of MIT and Harvard	BRD-K93967984			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)-c1ccccc1	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19+,25-/m0/s1	LKWROLXNVKNHNW-CEYNDMKZSA-N	491.22203467							110031
BRD-K77147967-001-01-1	LSM-21459	BRD-K77147967	54620081	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18-,23+/m0/s1	JSXDBGGCWARADO-DWKCODDLSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K77147967	BRD-K77147967-001-01-1	Broad Institute of MIT and Harvard	BRD-K77147967			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18-,23+/m0/s1	JSXDBGGCWARADO-DWKCODDLSA-N	548.224654732							110032
BRD-K54857179-001-01-6	LSM-21460	BRD-K54857179	54620146	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21-,27-/m0/s1	GYMQUQFWPBAZQS-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ncc(cc3C1=O)c4cccc(c4)C(=O)N(C)C	BroadT	BRD-K54857179	BRD-K54857179-001-01-6	Broad Institute of MIT and Harvard	BRD-K54857179			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21-,27-/m0/s1	GYMQUQFWPBAZQS-IZVMNLJQSA-N	580.235555602							110033
BRD-K48856040-001-01-4	LSM-21461	BRD-K48856040	54620134	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19-,25+/m1/s1	LKWROLXNVKNHNW-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)c4ccccc4	BroadT	BRD-K48856040	BRD-K48856040-001-01-4	Broad Institute of MIT and Harvard	BRD-K48856040			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)-c1ccccc1	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19-,25+/m1/s1	LKWROLXNVKNHNW-RRQZXNHTSA-N	491.22203467							110034
BRD-K66943396-001-01-7	LSM-21462	BRD-K66943396	54620020	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16-,20+/m1/s1	AMHLQJBMVIBTQJ-QINHECLXSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K66943396	BRD-K66943396-001-01-7	Broad Institute of MIT and Harvard	BRD-K66943396			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16-,20+/m1/s1	AMHLQJBMVIBTQJ-QINHECLXSA-N	431.242021186							110035
BRD-K85347477	LSM-15059		54619975	InChI=1S/C28H39N3O4/c1-19-15-31(20(2)18-32)28(33)25-13-23(22-10-7-11-24(12-22)34-4)14-29-27(25)35-26(19)17-30(3)16-21-8-5-6-9-21/h7,10-14,19-21,26,32H,5-6,8-9,15-18H2,1-4H3/t19-,20-,26+/m0/s1	IDUFABHFDSGNRC-CUVVAGTFSA-N	COc1cccc(c1)c2cnc3O[C@H](CN(C)CC4CCCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K85347477	BRD-K85347477-001-01-0	Broad Institute of MIT and Harvard	BRD-K85347477			COc1cccc(c1)-c1cnc2O[C@H](CN(C)CC3CCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O4/c1-19-15-31(20(2)18-32)28(33)25-13-23(22-10-7-11-24(12-22)34-4)14-29-27(25)35-26(19)17-30(3)16-21-8-5-6-9-21/h7,10-14,19-21,26,32H,5-6,8-9,15-18H2,1-4H3/t19-,20-,26+/m0/s1	IDUFABHFDSGNRC-CUVVAGTFSA-N	481.294056758							103715
BRD-K26001353-001-01-4	LSM-21463	BRD-K26001353	54620068	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22-,26+/m1/s1	QKGFYTRNDUTRSH-DRLORSAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K26001353	BRD-K26001353-001-01-4	Broad Institute of MIT and Harvard	BRD-K26001353			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22-,26+/m1/s1	QKGFYTRNDUTRSH-DRLORSAXSA-N	555.240306624							110036
BRD-K00914226-001-01-3	LSM-21464	BRD-K00914226	54619947	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22+,26+/m0/s1	HNBFIRYNWWOTHM-VVZHRXSXSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K00914226	BRD-K00914226-001-01-3	Broad Institute of MIT and Harvard	BRD-K00914226			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22+,26+/m0/s1	HNBFIRYNWWOTHM-VVZHRXSXSA-N	527.245392004							110037
BRD-K91294486-001-01-5	LSM-43950	BRD-K91294486	54619905	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18+,24+/m1/s1	RIYOKFYBASFFQM-WNEORKMCSA-N	C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K91294486	BRD-K91294486-001-01-5	Broad Institute of MIT and Harvard	BRD-K91294486			C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18+,24+/m1/s1	RIYOKFYBASFFQM-WNEORKMCSA-N	467.242021186							
BRD-K43290683-001-01-3	LSM-21466	BRD-K43290683	54620120	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19-,23+/m0/s1	LXUHOAUTESRKLV-SFYKDHMMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K43290683	BRD-K43290683-001-01-3	Broad Institute of MIT and Harvard	BRD-K43290683			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19-,23+/m0/s1	LXUHOAUTESRKLV-SFYKDHMMSA-N	468.273655672							110039
BRD-K95825762-001-01-7	LSM-21467	BRD-K95825762	54620046	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18+,24-/m1/s1	FWSGSYZJGWMBSU-NXMSCROESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K95825762	BRD-K95825762-001-01-7	Broad Institute of MIT and Harvard	BRD-K95825762			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18+,24-/m1/s1	FWSGSYZJGWMBSU-NXMSCROESA-N	500.217203436							110040
BRD-K27791208-001-01-6	LSM-21468	BRD-K27791208	54620186	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15-,19+/m0/s1	YKXPYIASKYVMCP-YZVOILCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)C3=CCCC3	BroadT	BRD-K27791208	BRD-K27791208-001-01-6	Broad Institute of MIT and Harvard	BRD-K27791208			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15-,19+/m0/s1	YKXPYIASKYVMCP-YZVOILCLSA-N	437.198441812							110041
BRD-K37293617-001-01-6	LSM-21469	BRD-K37293617	54620010	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17-,20-/m1/s1	WPCNIHGKOXVEOP-MBOZVWFJSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)C)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K37293617	BRD-K37293617-001-01-6	Broad Institute of MIT and Harvard	BRD-K37293617			CC(C)C#Cc1ccc2c(O[C@H](CN(C)C)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17-,20-/m1/s1	WPCNIHGKOXVEOP-MBOZVWFJSA-N	408.208278214							110042
CHEMBL2362313	LSM-15155	SID131415237, BRD-K69936404	54620069	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22+,28+/m1/s1	WFHCWVTWIFSLHF-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K69936404	BRD-K69936404-001-01-8	Broad Institute of MIT and Harvard	BRD-K69936404			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22+,28+/m1/s1	WFHCWVTWIFSLHF-WENCSYSZSA-N	544.240721194							103811
BRD-K71340039-001-01-2	LSM-21470	BRD-K71340039	54619957	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22-,27+/m1/s1	SOAPYNAROURGPA-LOYIFYEOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K71340039	BRD-K71340039-001-01-2	Broad Institute of MIT and Harvard	BRD-K71340039			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22-,27+/m1/s1	SOAPYNAROURGPA-LOYIFYEOSA-N	537.22974194							110043
BRD-K31056828-001-01-8	LSM-21471	BRD-K31056828	54620096	InChI=1S/C27H35N3O5S2/c1-19-16-30(20(2)18-31)27(32)23-14-22(11-6-10-21-8-4-5-9-21)15-28-26(23)35-24(19)17-29(3)37(33,34)25-12-7-13-36-25/h7,12-15,19-21,24,31H,4-5,8-10,16-18H2,1-3H3/t19-,20+,24-/m1/s1	VAEQCBKICRQYMW-JXALWOEJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc3ncc(cc3C1=O)C#CCC4CCCC4	BroadT	BRD-K31056828	BRD-K31056828-001-01-8	Broad Institute of MIT and Harvard	BRD-K31056828			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H35N3O5S2/c1-19-16-30(20(2)18-31)27(32)23-14-22(11-6-10-21-8-4-5-9-21)15-28-26(23)35-24(19)17-29(3)37(33,34)25-12-7-13-36-25/h7,12-15,19-21,24,31H,4-5,8-10,16-18H2,1-3H3/t19-,20+,24-/m1/s1	VAEQCBKICRQYMW-JXALWOEJSA-N	545.20181263							110044
BRD-K29557490-001-01-6	LSM-43951	BRD-K29557490	54620142	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19+,23-/m0/s1	DIUXSDCPAZQGFR-PWDATIAQSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K29557490	BRD-K29557490-001-01-6	Broad Institute of MIT and Harvard	BRD-K29557490			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19+,23-/m0/s1	DIUXSDCPAZQGFR-PWDATIAQSA-N	478.250143026							
BRD-K89815866-001-01-1	LSM-21473	BRD-K89815866	54619928	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18-,23-/m1/s1	YVWHEBSLRQSAGP-PMAPCBKXSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3cccc(c3)C#N	BroadT	BRD-K89815866	BRD-K89815866-001-01-1	Broad Institute of MIT and Harvard	BRD-K89815866			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1cccc(c1)C#N	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18-,23-/m1/s1	YVWHEBSLRQSAGP-PMAPCBKXSA-N	479.253254586							110046
BRD-K76319839-001-01-3	LSM-21474	BRD-K76319839	54620167	InChI=1S/C23H33N3O4/c1-7-21(28)25(6)13-20-16(4)12-26(17(5)14-27)23(29)19-10-18(9-8-15(2)3)11-24-22(19)30-20/h10-11,15-17,20,27H,7,12-14H2,1-6H3/t16-,17+,20-/m0/s1	YINCXXWYKWHBGE-QKLQHJQFSA-N	CCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)C	BroadT	BRD-K76319839	BRD-K76319839-001-01-3	Broad Institute of MIT and Harvard	BRD-K76319839			CCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)C	InChI=1S/C23H33N3O4/c1-7-21(28)25(6)13-20-16(4)12-26(17(5)14-27)23(29)19-10-18(9-8-15(2)3)11-24-22(19)30-20/h10-11,15-17,20,27H,7,12-14H2,1-6H3/t16-,17+,20-/m0/s1	YINCXXWYKWHBGE-QKLQHJQFSA-N	415.247106566							110047
BRD-K60754998-001-01-6	LSM-21475	BRD-K60754998	54620039	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18+,23-/m0/s1	YVWHEBSLRQSAGP-IXFSTUDKSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3cccc(c3)C#N	BroadT	BRD-K60754998	BRD-K60754998-001-01-6	Broad Institute of MIT and Harvard	BRD-K60754998			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cccc(c1)C#N	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18+,23-/m0/s1	YVWHEBSLRQSAGP-IXFSTUDKSA-N	479.253254586							110048
BRD-K68353541-001-01-1	LSM-21476	BRD-K68353541	54620119	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20+,25-/m0/s1	WLSSZJWPMNLWIC-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K68353541	BRD-K68353541-001-01-1	Broad Institute of MIT and Harvard	BRD-K68353541			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20+,25-/m0/s1	WLSSZJWPMNLWIC-DFIYOIEZSA-N	492.26579309							110049
BRD-K10292006-001-01-8	LSM-21477	BRD-K10292006	54619897	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18-,24+/m0/s1	FWSGSYZJGWMBSU-LLJLJFOGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K10292006	BRD-K10292006-001-01-8	Broad Institute of MIT and Harvard	BRD-K10292006			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18-,24+/m0/s1	FWSGSYZJGWMBSU-LLJLJFOGSA-N	500.217203436							110050
BRD-K66581298	LSM-15047		54620121	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21+,27+/m1/s1	XTWZIVUPDNYJMX-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K66581298	BRD-K66581298-001-01-4	Broad Institute of MIT and Harvard	BRD-K66581298			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21+,27+/m1/s1	XTWZIVUPDNYJMX-BUEREQSYSA-N	502.238019092							103703
BRD-K15612496-001-01-9	LSM-21478	BRD-K15612496	54619986	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15+,19+/m1/s1	YKXPYIASKYVMCP-VCBZYWHSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)C3=CCCC3	BroadT	BRD-K15612496	BRD-K15612496-001-01-9	Broad Institute of MIT and Harvard	BRD-K15612496			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15+,19+/m1/s1	YKXPYIASKYVMCP-VCBZYWHSSA-N	437.198441812							110051
BRD-K70571261-001-01-2	LSM-21479	BRD-K70571261	54620022	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17+,21-/m0/s1	GOVSZGQIERTMRS-FVJLSDCUSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K70571261	BRD-K70571261-001-01-2	Broad Institute of MIT and Harvard	BRD-K70571261			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17+,21-/m0/s1	GOVSZGQIERTMRS-FVJLSDCUSA-N	466.213757518							110052
BRD-K11968295-001-01-2	LSM-21480	BRD-K11968295	54620188	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19+,24-/m0/s1	JHVMXPAASGDEJW-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K11968295	BRD-K11968295-001-01-2	Broad Institute of MIT and Harvard	BRD-K11968295			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19+,24-/m0/s1	JHVMXPAASGDEJW-GLDPYIMESA-N	516.240640982							110053
BRD-K37786698-001-01-1	LSM-21481	BRD-K37786698	54620003	InChI=1S/C28H33N3O5/c1-18-14-31(19(2)17-32)27(33)24-12-21(10-9-20-7-8-20)13-29-26(24)36-25(18)16-30(3)15-22-5-4-6-23(11-22)28(34)35/h4-6,11-13,18-20,25,32H,7-8,14-17H2,1-3H3,(H,34,35)/t18-,19-,25-/m0/s1	UQQOYFSIYPJILQ-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3ncc(cc3C1=O)C#CC4CC4	BroadT	BRD-K37786698	BRD-K37786698-001-01-1	Broad Institute of MIT and Harvard	BRD-K37786698			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2ncc(cc2C1=O)C#CC1CC1	InChI=1S/C28H33N3O5/c1-18-14-31(19(2)17-32)27(33)24-12-21(10-9-20-7-8-20)13-29-26(24)36-25(18)16-30(3)15-22-5-4-6-23(11-22)28(34)35/h4-6,11-13,18-20,25,32H,7-8,14-17H2,1-3H3,(H,34,35)/t18-,19-,25-/m0/s1	UQQOYFSIYPJILQ-MHPIHPPYSA-N	491.242021186							110054
BRD-K71982936	LSM-15051		54620131	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21+,27+/m0/s1	XTWZIVUPDNYJMX-FYQCMVGJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K71982936	BRD-K71982936-001-01-5	Broad Institute of MIT and Harvard	BRD-K71982936			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21+,27+/m0/s1	XTWZIVUPDNYJMX-FYQCMVGJSA-N	502.238019092							103707
BRD-K22835048-001-01-0	LSM-21482	BRD-K22835048	54620014	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18-,24+/m1/s1	FWSGSYZJGWMBSU-GGUMNFRJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K22835048	BRD-K22835048-001-01-0	Broad Institute of MIT and Harvard	BRD-K22835048			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18-,24+/m1/s1	FWSGSYZJGWMBSU-GGUMNFRJSA-N	500.217203436							110055
BRD-K53219679-001-01-5	LSM-21483	BRD-K53219679	54620088	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18+,23-/m0/s1	JSXDBGGCWARADO-OVCNXMPXSA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K53219679	BRD-K53219679-001-01-5	Broad Institute of MIT and Harvard	BRD-K53219679			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18+,23-/m0/s1	JSXDBGGCWARADO-OVCNXMPXSA-N	548.224654732							110056
BRD-K11634244-001-01-2	LSM-43952	BRD-K11634244	54620132	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18-,23-/m1/s1	BFKPGMXAQGECHU-VAKHBYJMSA-N	C\C=C\c1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K11634244	BRD-K11634244-001-01-2	Broad Institute of MIT and Harvard	BRD-K11634244			C\C=C\c1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18-,23-/m1/s1	BFKPGMXAQGECHU-VAKHBYJMSA-N	441.242770114							
BRD-K97038945-001-01-5	LSM-21485	BRD-K97038945	54620085	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18-,23+/m1/s1	YZGVRROAGSWMNC-PNCHPQGNSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K97038945	BRD-K97038945-001-01-5	Broad Institute of MIT and Harvard	BRD-K97038945			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18-,23+/m1/s1	YZGVRROAGSWMNC-PNCHPQGNSA-N	507.220320108							110058
BRD-K29876990-001-01-5	LSM-21486	BRD-K29876990	54620171	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16-,20+/m0/s1	AMHLQJBMVIBTQJ-TWOQFEAHSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K29876990	BRD-K29876990-001-01-5	Broad Institute of MIT and Harvard	BRD-K29876990			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16-,20+/m0/s1	AMHLQJBMVIBTQJ-TWOQFEAHSA-N	431.242021186							110059
BRD-K96956737-001-01-1	LSM-21487	BRD-K96956737	54619917	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16+,20+/m0/s1	LAMQXQQGALMYJX-RZQQEMMASA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3cncnc3	BroadT	BRD-K96956737	BRD-K96956737-001-01-1	Broad Institute of MIT and Harvard	BRD-K96956737			CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cncnc1	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16+,20+/m0/s1	LAMQXQQGALMYJX-RZQQEMMASA-N	456.248503564							110060
BRD-K45744480-001-01-2	LSM-21488	BRD-K45744480	54620074	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19+,25+/m1/s1	LKWROLXNVKNHNW-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)c4ccccc4	BroadT	BRD-K45744480	BRD-K45744480-001-01-2	Broad Institute of MIT and Harvard	BRD-K45744480			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)-c1ccccc1	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19+,25+/m1/s1	LKWROLXNVKNHNW-WYEJZRMESA-N	491.22203467							110061
BRD-K54320646-001-01-0	LSM-21489	BRD-K54320646	54619886	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18+,23+/m0/s1	JSXDBGGCWARADO-PMECCGAFSA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K54320646	BRD-K54320646-001-01-0	Broad Institute of MIT and Harvard	BRD-K54320646			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18+,23+/m0/s1	JSXDBGGCWARADO-PMECCGAFSA-N	548.224654732							110062
BRD-K68857517-001-01-1	LSM-21490	BRD-K68857517	54620116	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17+,21-/m1/s1	IGKRWIJRXULJPM-LLGFUMIMSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc3ccncc3	BroadT	BRD-K68857517	BRD-K68857517-001-01-1	Broad Institute of MIT and Harvard	BRD-K68857517			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc1ccncc1	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17+,21-/m1/s1	IGKRWIJRXULJPM-LLGFUMIMSA-N	429.172227064							110063
BRD-K01065567-001-01-0	LSM-43953	BRD-K01065567	54619885	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19+,23+/m1/s1	DIUXSDCPAZQGFR-LZYJUXAGSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K01065567	BRD-K01065567-001-01-0	Broad Institute of MIT and Harvard	BRD-K01065567			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19+,23+/m1/s1	DIUXSDCPAZQGFR-LZYJUXAGSA-N	478.250143026							
BRD-K95593113	LSM-15069		54620164	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21-,27+/m1/s1	XTWZIVUPDNYJMX-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K95593113	BRD-K95593113-001-01-7	Broad Institute of MIT and Harvard	BRD-K95593113			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21-,27+/m1/s1	XTWZIVUPDNYJMX-GNMOFYLKSA-N	502.238019092							103725
BRD-K73338579-001-01-0	LSM-21492	BRD-K73338579	54619923	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18+,24+/m0/s1	FWSGSYZJGWMBSU-HOOSLVGPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K73338579	BRD-K73338579-001-01-0	Broad Institute of MIT and Harvard	BRD-K73338579			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18+,24+/m0/s1	FWSGSYZJGWMBSU-HOOSLVGPSA-N	500.217203436							110065
BRD-K80353086-001-01-6	LSM-21493	BRD-K80353086	54620019	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16+,20-/m1/s1	AMHLQJBMVIBTQJ-GQIGUUNPSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K80353086	BRD-K80353086-001-01-6	Broad Institute of MIT and Harvard	BRD-K80353086			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16+,20-/m1/s1	AMHLQJBMVIBTQJ-GQIGUUNPSA-N	431.242021186							110066
BRD-K27732957	LSM-15028		54619971	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21+,27-/m0/s1	XTWZIVUPDNYJMX-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K27732957	BRD-K27732957-001-01-3	Broad Institute of MIT and Harvard	BRD-K27732957			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21+,27-/m0/s1	XTWZIVUPDNYJMX-ISCCLHIJSA-N	502.238019092							103684
BRD-K01465228-001-01-3	LSM-21494	BRD-K01465228	54619888	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18-,23-/m0/s1	JSXDBGGCWARADO-FXKZBUDASA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K01465228	BRD-K01465228-001-01-3	Broad Institute of MIT and Harvard	BRD-K01465228			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18-,23-/m0/s1	JSXDBGGCWARADO-FXKZBUDASA-N	548.224654732							110067
BRD-K44789523-001-01-7	LSM-21495	BRD-K44789523	54620102	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16-,20+/m0/s1	LAMQXQQGALMYJX-TWOQFEAHSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3cncnc3	BroadT	BRD-K44789523	BRD-K44789523-001-01-7	Broad Institute of MIT and Harvard	BRD-K44789523			CC(C)NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1cncnc1	InChI=1S/C23H32N6O4/c1-14(2)27-23(32)28(5)11-20-15(3)10-29(16(4)12-30)22(31)19-6-17(9-26-21(19)33-20)18-7-24-13-25-8-18/h6-9,13-16,20,30H,10-12H2,1-5H3,(H,27,32)/t15-,16-,20+/m0/s1	LAMQXQQGALMYJX-TWOQFEAHSA-N	456.248503564							110068
BRD-K90288250-001-01-2	LSM-21496	BRD-K90288250	54620174	InChI=1S/C28H39N3O4/c1-19-15-31(20(2)18-32)28(33)25-13-23(22-10-7-11-24(12-22)34-4)14-29-27(25)35-26(19)17-30(3)16-21-8-5-6-9-21/h7,10-14,19-21,26,32H,5-6,8-9,15-18H2,1-4H3/t19-,20+,26+/m0/s1	IDUFABHFDSGNRC-OUDXUNEISA-N	COc1cccc(c1)c2cnc3O[C@H](CN(C)CC4CCCC4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K90288250	BRD-K90288250-001-01-2	Broad Institute of MIT and Harvard	BRD-K90288250			COc1cccc(c1)-c1cnc2O[C@H](CN(C)CC3CCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O4/c1-19-15-31(20(2)18-32)28(33)25-13-23(22-10-7-11-24(12-22)34-4)14-29-27(25)35-26(19)17-30(3)16-21-8-5-6-9-21/h7,10-14,19-21,26,32H,5-6,8-9,15-18H2,1-4H3/t19-,20+,26+/m0/s1	IDUFABHFDSGNRC-OUDXUNEISA-N	481.294056758							110069
BRD-K05464051-001-01-4	LSM-21497	BRD-K05464051	54620064	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18-,23-/m0/s1	YZGVRROAGSWMNC-BSRJHKFKSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K05464051	BRD-K05464051-001-01-4	Broad Institute of MIT and Harvard	BRD-K05464051			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18-,23-/m0/s1	YZGVRROAGSWMNC-BSRJHKFKSA-N	507.220320108							110070
BRD-K22158067-001-01-3	LSM-21498	BRD-K22158067	54620184	InChI=1S/C25H36N2O4S/c1-6-13-26(5)16-24-19(3)15-27(20(4)17-28)32(29,30)25-12-11-21(14-23(25)31-24)22-10-8-7-9-18(22)2/h7-12,14,19-20,24,28H,6,13,15-17H2,1-5H3/t19-,20+,24+/m1/s1	OGNBHIXSMVQURJ-NMMYMHLASA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3C	BroadT	BRD-K22158067	BRD-K22158067-001-01-3	Broad Institute of MIT and Harvard	BRD-K22158067			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1C	InChI=1S/C25H36N2O4S/c1-6-13-26(5)16-24-19(3)15-27(20(4)17-28)32(29,30)25-12-11-21(14-23(25)31-24)22-10-8-7-9-18(22)2/h7-12,14,19-20,24,28H,6,13,15-17H2,1-5H3/t19-,20+,24+/m1/s1	OGNBHIXSMVQURJ-NMMYMHLASA-N	460.239578342							110071
BRD-K71470519-001-01-6	LSM-21499	BRD-K71470519	54620094	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19+,23+/m0/s1	LXUHOAUTESRKLV-YCRNBWNJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K71470519	BRD-K71470519-001-01-6	Broad Institute of MIT and Harvard	BRD-K71470519			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19+,23+/m0/s1	LXUHOAUTESRKLV-YCRNBWNJSA-N	468.273655672							110072
MLS003130041	LSM-15129	BRD-K30180607, SID99358625	46903404	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22+,28+/m0/s1	WFHCWVTWIFSLHF-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K30180607	BRD-K30180607-001-02-2	Broad Institute of MIT and Harvard	BRD-K30180607			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22+,28+/m0/s1	WFHCWVTWIFSLHF-PFPZSTESSA-N	544.240721194							103785
BRD-K49344195-001-01-3	LSM-21500	BRD-K49344195	54620162	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19-,25-/m0/s1	DGDCFHNDGOPSJV-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K49344195	BRD-K49344195-001-01-3	Broad Institute of MIT and Harvard	BRD-K49344195			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19-,25-/m0/s1	DGDCFHNDGOPSJV-MHPIHPPYSA-N	499.221954458							110073
BRD-K66288362	LSM-15046		54619996	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20-,25-/m1/s1	WLSSZJWPMNLWIC-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K66288362	BRD-K66288362-001-01-7	Broad Institute of MIT and Harvard	BRD-K66288362			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20-,25-/m1/s1	WLSSZJWPMNLWIC-UMEGOILYSA-N	492.26579309							103702
BRD-K14719629-001-01-3	LSM-21501	BRD-K14719629	54619978	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19+,24+/m0/s1	JHVMXPAASGDEJW-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K14719629	BRD-K14719629-001-01-3	Broad Institute of MIT and Harvard	BRD-K14719629			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19+,24+/m0/s1	JHVMXPAASGDEJW-XLNZFTOWSA-N	516.240640982							110074
BRD-K97396966-001-01-1	LSM-21502	BRD-K97396966	54620111	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17+,20-/m0/s1	WPCNIHGKOXVEOP-QKLQHJQFSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K97396966	BRD-K97396966-001-01-1	Broad Institute of MIT and Harvard	BRD-K97396966			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17+,20-/m0/s1	WPCNIHGKOXVEOP-QKLQHJQFSA-N	408.208278214							110075
BRD-K23354958-001-01-9	LSM-43954	BRD-K23354958	54620090	InChI=1S/C34H36N4O4/c1-23-20-38(24(2)22-39)33(40)29-18-26(17-16-25-10-5-4-6-11-25)19-35-32(29)42-31(23)21-37(3)34(41)36-30-15-9-13-27-12-7-8-14-28(27)30/h4-19,23-24,31,39H,20-22H2,1-3H3,(H,36,41)/b17-16+/t23-,24+,31-/m0/s1	KPTNOAWZVSDLGM-RDRBEEPQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ncc(\C=C\c5ccccc5)cc4C1=O	BroadT	BRD-K23354958	BRD-K23354958-001-01-9	Broad Institute of MIT and Harvard	BRD-K23354958			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C34H36N4O4/c1-23-20-38(24(2)22-39)33(40)29-18-26(17-16-25-10-5-4-6-11-25)19-35-32(29)42-31(23)21-37(3)34(41)36-30-15-9-13-27-12-7-8-14-28(27)30/h4-19,23-24,31,39H,20-22H2,1-3H3,(H,36,41)/b17-16+/t23-,24+,31-/m0/s1	KPTNOAWZVSDLGM-RDRBEEPQSA-N	564.273655672							
BRD-K07517409-001-01-6	LSM-21504	BRD-K07517409	54620056	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17-,20-/m0/s1	WPCNIHGKOXVEOP-ZWOKBUDYSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K07517409	BRD-K07517409-001-01-6	Broad Institute of MIT and Harvard	BRD-K07517409			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17-,20-/m0/s1	WPCNIHGKOXVEOP-ZWOKBUDYSA-N	408.208278214							110077
BRD-K45349150-001-01-9	LSM-21505	BRD-K45349150	54620151	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18-,23-/m0/s1	YVWHEBSLRQSAGP-BSRJHKFKSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3cccc(c3)C#N	BroadT	BRD-K45349150	BRD-K45349150-001-01-9	Broad Institute of MIT and Harvard	BRD-K45349150			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1cccc(c1)C#N	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18-,23-/m0/s1	YVWHEBSLRQSAGP-BSRJHKFKSA-N	479.253254586							110078
BRD-K74387408-001-01-3	LSM-21506	BRD-K74387408	54620100	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17+,21-/m1/s1	GOVSZGQIERTMRS-LLGFUMIMSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K74387408	BRD-K74387408-001-01-3	Broad Institute of MIT and Harvard	BRD-K74387408			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C23H34N2O6S/c1-16-12-25(17(2)14-26)32(28,29)22-10-9-19(18-7-5-6-8-18)11-20(22)31-21(16)13-24(3)23(27)15-30-4/h7,9-11,16-17,21,26H,5-6,8,12-15H2,1-4H3/t16-,17+,21-/m1/s1	GOVSZGQIERTMRS-LLGFUMIMSA-N	466.213757518							110079
BRD-K43130710-001-01-8	LSM-21507	BRD-K43130710	54620015	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20+,24-/m0/s1	IWCIQXTVMOHXRP-ROKPMTFOSA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K43130710	BRD-K43130710-001-01-8	Broad Institute of MIT and Harvard	BRD-K43130710			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20+,24-/m0/s1	IWCIQXTVMOHXRP-ROKPMTFOSA-N	506.245057646							110080
BRD-K92052123-001-01-5	LSM-21508	BRD-K92052123	54620013	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20-,25-/m0/s1	WLSSZJWPMNLWIC-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K92052123	BRD-K92052123-001-01-5	Broad Institute of MIT and Harvard	BRD-K92052123			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20-,25-/m0/s1	WLSSZJWPMNLWIC-RLSLOFABSA-N	492.26579309							110081
BRD-K84739106-001-01-8	LSM-21509	BRD-K84739106	54620107	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17+,20+/m0/s1	WPCNIHGKOXVEOP-SQGPQFPESA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K84739106	BRD-K84739106-001-01-8	Broad Institute of MIT and Harvard	BRD-K84739106			CC(C)C#Cc1ccc2c(O[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17+,20+/m0/s1	WPCNIHGKOXVEOP-SQGPQFPESA-N	408.208278214							110082
BRD-K18371519-001-01-2	LSM-21510	BRD-K18371519	54619991	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17-,23+/m1/s1	SBQRHQGOZJVRTE-QZMQVMSPSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(F)c4	BroadT	BRD-K18371519	BRD-K18371519-001-01-2	Broad Institute of MIT and Harvard	BRD-K18371519			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(F)c1	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17-,23+/m1/s1	SBQRHQGOZJVRTE-QZMQVMSPSA-N	490.193771002							110083
BRD-K75175729-001-01-3	LSM-21511	BRD-K75175729	54620043	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18+,23+/m0/s1	YVWHEBSLRQSAGP-YZZKKUAISA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3cccc(c3)C#N	BroadT	BRD-K75175729	BRD-K75175729-001-01-3	Broad Institute of MIT and Harvard	BRD-K75175729			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cccc(c1)C#N	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18+,23+/m0/s1	YVWHEBSLRQSAGP-YZZKKUAISA-N	479.253254586							110084
BRD-K19258623-001-01-3	LSM-43955	BRD-K19258623	54620159	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18+,22-/m1/s1	QZTHWNUUUJWOTB-YWOJKNMPSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)Cc3ccccn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K19258623	BRD-K19258623-001-01-3	Broad Institute of MIT and Harvard	BRD-K19258623			C\C=C\c1cnc2O[C@H](CN(C)C(=O)Cc3ccccn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18+,22-/m1/s1	QZTHWNUUUJWOTB-YWOJKNMPSA-N	452.242355544							
BRD-K49527167-001-01-7	LSM-21513	BRD-K49527167	54620176	InChI=1S/C27H36N2O4S/c1-5-6-8-11-23-14-15-27-25(16-23)33-26(19-28(4)18-24-12-9-7-10-13-24)21(2)17-29(22(3)20-30)34(27,31)32/h7,9-10,12-16,21-22,26,30H,5-6,17-20H2,1-4H3/t21-,22-,26+/m1/s1	ADEWQMCOYJIEMS-DRLORSAXSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K49527167	BRD-K49527167-001-01-7	Broad Institute of MIT and Harvard	BRD-K49527167			CCCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O4S/c1-5-6-8-11-23-14-15-27-25(16-23)33-26(19-28(4)18-24-12-9-7-10-13-24)21(2)17-29(22(3)20-30)34(27,31)32/h7,9-10,12-16,21-22,26,30H,5-6,17-20H2,1-4H3/t21-,22-,26+/m1/s1	ADEWQMCOYJIEMS-DRLORSAXSA-N	484.239578342							110086
BRD-K07678613-001-01-8	LSM-21514	BRD-K07678613	54619946	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19-,24+/m0/s1	JHVMXPAASGDEJW-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K07678613	BRD-K07678613-001-01-8	Broad Institute of MIT and Harvard	BRD-K07678613			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H36N4O5S/c1-18-14-30(19(2)16-31)36(33,34)25-10-9-21(22-12-27-17-28-13-22)11-23(25)35-24(18)15-29(3)26(32)20-7-5-4-6-8-20/h9-13,17-20,24,31H,4-8,14-16H2,1-3H3/t18-,19-,24+/m0/s1	JHVMXPAASGDEJW-AXHZCLLHSA-N	516.240640982							110087
BRD-K29097491	LSM-15128		54620047	InChI=1S/C28H37N3O4S/c1-21-17-31(22(2)20-32)36(33,34)28-13-12-23(10-11-24-9-6-14-29-16-24)15-26(28)35-27(21)19-30(3)18-25-7-4-5-8-25/h6,9,12-16,21-22,25,27,32H,4-5,7-8,17-20H2,1-3H3/t21-,22-,27+/m1/s1	VXDFRUAWHFSTRR-LOYIFYEOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccnc4	BroadT	BRD-K29097491	BRD-K29097491-001-01-2	Broad Institute of MIT and Harvard	BRD-K29097491			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccnc1	InChI=1S/C28H37N3O4S/c1-21-17-31(22(2)20-32)36(33,34)28-13-12-23(10-11-24-9-6-14-29-16-24)15-26(28)35-27(21)19-30(3)18-25-7-4-5-8-25/h6,9,12-16,21-22,25,27,32H,4-5,7-8,17-20H2,1-3H3/t21-,22-,27+/m1/s1	VXDFRUAWHFSTRR-LOYIFYEOSA-N	511.250477384							103784
BRD-K68376840-001-01-0	LSM-43956	BRD-K68376840	54620125	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18-,22-/m1/s1	QZTHWNUUUJWOTB-WDDPZZSTSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)Cc3ccccn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K68376840	BRD-K68376840-001-01-0	Broad Institute of MIT and Harvard	BRD-K68376840			C\C=C\c1cnc2O[C@H](CN(C)C(=O)Cc3ccccn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18-,22-/m1/s1	QZTHWNUUUJWOTB-WDDPZZSTSA-N	452.242355544							
BRD-K18577063-001-01-4	LSM-21516	BRD-K18577063	54619887	InChI=1S/C28H33N3O5/c1-18-14-31(19(2)17-32)27(33)24-12-21(10-9-20-7-8-20)13-29-26(24)36-25(18)16-30(3)15-22-5-4-6-23(11-22)28(34)35/h4-6,11-13,18-20,25,32H,7-8,14-17H2,1-3H3,(H,34,35)/t18-,19-,25-/m1/s1	UQQOYFSIYPJILQ-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3ncc(cc3C1=O)C#CC4CC4	BroadT	BRD-K18577063	BRD-K18577063-001-01-4	Broad Institute of MIT and Harvard	BRD-K18577063			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2ncc(cc2C1=O)C#CC1CC1	InChI=1S/C28H33N3O5/c1-18-14-31(19(2)17-32)27(33)24-12-21(10-9-20-7-8-20)13-29-26(24)36-25(18)16-30(3)15-22-5-4-6-23(11-22)28(34)35/h4-6,11-13,18-20,25,32H,7-8,14-17H2,1-3H3,(H,34,35)/t18-,19-,25-/m1/s1	UQQOYFSIYPJILQ-MPCDZSKCSA-N	491.242021186							110089
BRD-K28428891-001-01-6	LSM-21517	BRD-K28428891	54620052	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18-,24-/m0/s1	FWSGSYZJGWMBSU-XFAGBWLFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K28428891	BRD-K28428891-001-01-6	Broad Institute of MIT and Harvard	BRD-K28428891			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18-,24-/m0/s1	FWSGSYZJGWMBSU-XFAGBWLFSA-N	500.217203436							110090
BRD-K54072830-001-01-3	LSM-21518	BRD-K54072830	54620076	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22+,27+/m1/s1	SOAPYNAROURGPA-VHSZZVNMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K54072830	BRD-K54072830-001-01-3	Broad Institute of MIT and Harvard	BRD-K54072830			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22+,27+/m1/s1	SOAPYNAROURGPA-VHSZZVNMSA-N	537.22974194							110091
BRD-K27256442-001-01-6	LSM-21519	BRD-K27256442	54620181	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20+,24-/m1/s1	IWCIQXTVMOHXRP-JXALWOEJSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K27256442	BRD-K27256442-001-01-6	Broad Institute of MIT and Harvard	BRD-K27256442			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20+,24-/m1/s1	IWCIQXTVMOHXRP-JXALWOEJSA-N	506.245057646							110092
BRD-K01712684-001-01-5	LSM-21520	BRD-K01712684	54620054	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19-,23-/m1/s1	LXUHOAUTESRKLV-DNVFCKCGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K01712684	BRD-K01712684-001-01-5	Broad Institute of MIT and Harvard	BRD-K01712684			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19-,23-/m1/s1	LXUHOAUTESRKLV-DNVFCKCGSA-N	468.273655672							110093
MLS003129038	LSM-21521	SID99359646, BRD-K85084982	46904208	InChI=1S/C21H26BrN3O5S/c1-14-11-25(15(2)13-26)31(28,29)20-7-6-17(22)9-18(20)30-19(14)12-24(3)21(27)16-5-4-8-23-10-16/h4-10,14-15,19,26H,11-13H2,1-3H3/t14-,15-,19-/m0/s1	RBIYCKWDAFMQQR-DOXZYTNZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K85084982	BRD-K85084982-001-01-7	Broad Institute of MIT and Harvard	BRD-K85084982			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C21H26BrN3O5S/c1-14-11-25(15(2)13-26)31(28,29)20-7-6-17(22)9-18(20)30-19(14)12-24(3)21(27)16-5-4-8-23-10-16/h4-10,14-15,19,26H,11-13H2,1-3H3/t14-,15-,19-/m0/s1	RBIYCKWDAFMQQR-DOXZYTNZSA-N	511.077654252							110094
BRD-K68479950-001-01-8	LSM-21522	BRD-K68479950	54619969	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19-,25+/m1/s1	DGDCFHNDGOPSJV-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K68479950	BRD-K68479950-001-01-8	Broad Institute of MIT and Harvard	BRD-K68479950			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19-,25+/m1/s1	DGDCFHNDGOPSJV-RRQZXNHTSA-N	499.221954458							110095
BRD-K97965912-001-01-8	LSM-21523	BRD-K97965912	54619910	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19-,25+/m0/s1	DGDCFHNDGOPSJV-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K97965912	BRD-K97965912-001-01-8	Broad Institute of MIT and Harvard	BRD-K97965912			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19-,25+/m0/s1	DGDCFHNDGOPSJV-XHNVNVPESA-N	499.221954458							110096
BRD-K18677940-001-01-1	LSM-21524	BRD-K18677940	54620180	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22+,26-/m1/s1	QKGFYTRNDUTRSH-TVZXLZGTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K18677940	BRD-K18677940-001-01-1	Broad Institute of MIT and Harvard	BRD-K18677940			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C29H37N3O6S/c1-21-18-32(22(2)20-33)39(36,37)27-7-6-23(8-13-29(35)11-4-5-12-29)16-25(27)38-26(21)19-31(3)28(34)17-24-9-14-30-15-10-24/h6-7,9-10,14-16,21-22,26,33,35H,4-5,11-12,17-20H2,1-3H3/t21-,22+,26-/m1/s1	QKGFYTRNDUTRSH-TVZXLZGTSA-N	555.240306624							110097
BRD-K33264564-001-01-4	LSM-21525	BRD-K33264564	54620099	InChI=1S/C23H33N3O4/c1-7-21(28)25(6)13-20-16(4)12-26(17(5)14-27)23(29)19-10-18(9-8-15(2)3)11-24-22(19)30-20/h10-11,15-17,20,27H,7,12-14H2,1-6H3/t16-,17+,20+/m1/s1	YINCXXWYKWHBGE-UWVAXJGDSA-N	CCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)C	BroadT	BRD-K33264564	BRD-K33264564-001-01-4	Broad Institute of MIT and Harvard	BRD-K33264564			CCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)C	InChI=1S/C23H33N3O4/c1-7-21(28)25(6)13-20-16(4)12-26(17(5)14-27)23(29)19-10-18(9-8-15(2)3)11-24-22(19)30-20/h10-11,15-17,20,27H,7,12-14H2,1-6H3/t16-,17+,20+/m1/s1	YINCXXWYKWHBGE-UWVAXJGDSA-N	415.247106566							110098
BRD-K93581394-001-01-4	LSM-21526	BRD-K93581394	54619997	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18-,23-/m0/s1	JSXDBGGCWARADO-ORQYLMBXSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K93581394	BRD-K93581394-001-01-4	Broad Institute of MIT and Harvard	BRD-K93581394			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18-,23-/m0/s1	JSXDBGGCWARADO-ORQYLMBXSA-N	548.224654732							110099
BRD-K76631152-001-01-0	LSM-21527	BRD-K76631152	54619911	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16+,21+/m0/s1	PQYRKZJHUJLFNK-GCKMJXCFSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K76631152	BRD-K76631152-001-01-0	Broad Institute of MIT and Harvard	BRD-K76631152			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C24H30FN3O5/c1-15-11-28(16(2)13-29)24(31)19-9-17(18-7-5-6-8-20(18)25)10-26-23(19)33-21(15)12-27(3)22(30)14-32-4/h5-10,15-16,21,29H,11-14H2,1-4H3/t15-,16+,21+/m0/s1	PQYRKZJHUJLFNK-GCKMJXCFSA-N	459.21694929							110100
BRD-K84951013-001-01-1	LSM-43957	BRD-K84951013	54620189	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18+,23-/m0/s1	BFKPGMXAQGECHU-QSVUANERSA-N	C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K84951013	BRD-K84951013-001-01-1	Broad Institute of MIT and Harvard	BRD-K84951013			C\C=C\c1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H32FN3O3/c1-5-8-19-11-21-24(27-12-19)32-23(17(2)13-29(25(21)31)18(3)16-30)15-28(4)14-20-9-6-7-10-22(20)26/h5-12,17-18,23,30H,13-16H2,1-4H3/b8-5+/t17-,18+,23-/m0/s1	BFKPGMXAQGECHU-QSVUANERSA-N	441.242770114							
BRD-K30807415-001-01-4	LSM-43958	BRD-K30807415	54620093	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17+,22+/m1/s1	OYMACNCEHZXLLK-WLCOASNISA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K30807415	BRD-K30807415-001-01-4	Broad Institute of MIT and Harvard	BRD-K30807415			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17+,22+/m1/s1	OYMACNCEHZXLLK-WLCOASNISA-N	455.22203467							
BRD-K85885782-001-01-9	LSM-43959	BRD-K85885782	54620105	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18-,24+/m0/s1	RIYOKFYBASFFQM-KNPXHDOISA-N	C\C=C\c1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K85885782	BRD-K85885782-001-01-9	Broad Institute of MIT and Harvard	BRD-K85885782			C\C=C\c1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N3O5/c1-5-6-19-9-21-25(27-11-19)34-24(17(2)12-29(26(21)31)18(3)15-30)14-28(4)13-20-7-8-22-23(10-20)33-16-32-22/h5-11,17-18,24,30H,12-16H2,1-4H3/b6-5+/t17-,18-,24+/m0/s1	RIYOKFYBASFFQM-KNPXHDOISA-N	467.242021186							
BRD-K72219390-001-01-0	LSM-21531	BRD-K72219390	54620065	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20+,25-/m1/s1	WLSSZJWPMNLWIC-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K72219390	BRD-K72219390-001-01-0	Broad Institute of MIT and Harvard	BRD-K72219390			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20+,25-/m1/s1	WLSSZJWPMNLWIC-OHUGHZGNSA-N	492.26579309							110104
BRD-K35757815-001-01-2	LSM-21532	BRD-K35757815	54620137	InChI=1S/C27H36N2O4S/c1-5-6-8-11-23-14-15-27-25(16-23)33-26(19-28(4)18-24-12-9-7-10-13-24)21(2)17-29(22(3)20-30)34(27,31)32/h7,9-10,12-16,21-22,26,30H,5-6,17-20H2,1-4H3/t21-,22+,26-/m1/s1	ADEWQMCOYJIEMS-TVZXLZGTSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K35757815	BRD-K35757815-001-01-2	Broad Institute of MIT and Harvard	BRD-K35757815			CCCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O4S/c1-5-6-8-11-23-14-15-27-25(16-23)33-26(19-28(4)18-24-12-9-7-10-13-24)21(2)17-29(22(3)20-30)34(27,31)32/h7,9-10,12-16,21-22,26,30H,5-6,17-20H2,1-4H3/t21-,22+,26-/m1/s1	ADEWQMCOYJIEMS-TVZXLZGTSA-N	484.239578342							110105
BRD-K53573182-001-01-5	LSM-21533	BRD-K53573182	54619974	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18+,23+/m1/s1	YZGVRROAGSWMNC-STSQHVNTSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K53573182	BRD-K53573182-001-01-5	Broad Institute of MIT and Harvard	BRD-K53573182			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18+,23+/m1/s1	YZGVRROAGSWMNC-STSQHVNTSA-N	507.220320108							110106
BRD-K68281658-001-01-3	LSM-21534	BRD-K68281658	54619933	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20+,25+/m1/s1	WLSSZJWPMNLWIC-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCC4	BroadT	BRD-K68281658	BRD-K68281658-001-01-3	Broad Institute of MIT and Harvard	BRD-K68281658			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(30,31)26-9-8-23(22-6-4-5-7-22)14-24(26)33-25(19)17-27(3)16-21-10-12-32-13-11-21/h6,8-9,14,19-21,25,29H,4-5,7,10-13,15-18H2,1-3H3/t19-,20+,25+/m1/s1	WLSSZJWPMNLWIC-RNHFSVANSA-N	492.26579309							110107
BRD-K27172113-001-01-3	LSM-43960	BRD-K27172113	54619894	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18-,22+/m0/s1	QZTHWNUUUJWOTB-ZWSDPYEUSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)Cc3ccccn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K27172113	BRD-K27172113-001-01-3	Broad Institute of MIT and Harvard	BRD-K27172113			C\C=C\c1cnc2O[C@H](CN(C)C(=O)Cc3ccccn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18-,22+/m0/s1	QZTHWNUUUJWOTB-ZWSDPYEUSA-N	452.242355544							
BRD-K16907738-001-01-0	LSM-21536	BRD-K16907738	54620050	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17-,23+/m0/s1	SBQRHQGOZJVRTE-HKARXFIJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(F)c4	BroadT	BRD-K16907738	BRD-K16907738-001-01-0	Broad Institute of MIT and Harvard	BRD-K16907738			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(F)c1	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17-,23+/m0/s1	SBQRHQGOZJVRTE-HKARXFIJSA-N	490.193771002							110109
BRD-K78648432-001-01-4	LSM-21537	BRD-K78648432	44494944	InChI=1S/C27H31N5O6S/c1-17-12-32(18(2)15-33)27(34)21-9-20(23-10-19-7-5-6-8-22(19)37-23)11-28-26(21)38-24(17)13-31(4)39(35,36)25-14-30(3)16-29-25/h5-11,14,16-18,24,33H,12-13,15H2,1-4H3/t17-,18+,24-/m0/s1	QDXUGGAJHDZAHH-RHGYRFJNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ncc(cc3C1=O)c4oc5ccccc5c4	BroadT	BRD-K78648432	BRD-K78648432-001-01-4	Broad Institute of MIT and Harvard	BRD-K78648432			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ncc(cc2C1=O)-c1cc2ccccc2o1	InChI=1S/C27H31N5O6S/c1-17-12-32(18(2)15-33)27(34)21-9-20(23-10-19-7-5-6-8-22(19)37-23)11-28-26(21)38-24(17)13-31(4)39(35,36)25-14-30(3)16-29-25/h5-11,14,16-18,24,33H,12-13,15H2,1-4H3/t17-,18+,24-/m0/s1	QDXUGGAJHDZAHH-RHGYRFJNSA-N	553.199504452							110110
BRD-K48957279-001-01-2	LSM-21538	BRD-K48957279	54619883	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20+,24+/m1/s1	IWCIQXTVMOHXRP-NMMYMHLASA-N	COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K48957279	BRD-K48957279-001-01-2	Broad Institute of MIT and Harvard	BRD-K48957279			COCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20+,24+/m1/s1	IWCIQXTVMOHXRP-NMMYMHLASA-N	506.245057646							110111
BRD-K96219823-001-01-9	LSM-43961	BRD-K96219823	54619900	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18+,22+/m1/s1	QZTHWNUUUJWOTB-QCCQOXKASA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Cc3ccccn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K96219823	BRD-K96219823-001-01-9	Broad Institute of MIT and Harvard	BRD-K96219823			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Cc3ccccn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18+,22+/m1/s1	QZTHWNUUUJWOTB-QCCQOXKASA-N	452.242355544							
SCHEMBL15634899	LSM-21540	BRD-K08390999	54620091	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22-,26+/m0/s1	HNBFIRYNWWOTHM-AOJNWGRGSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K08390999	BRD-K08390999-001-01-3	Broad Institute of MIT and Harvard	BRD-K08390999			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22-,26+/m0/s1	HNBFIRYNWWOTHM-AOJNWGRGSA-N	527.245392004							110113
BRD-K67703656-001-01-9	LSM-21541	BRD-K67703656	54619961	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21+,27-/m0/s1	GYMQUQFWPBAZQS-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ncc(cc3C1=O)c4cccc(c4)C(=O)N(C)C	BroadT	BRD-K67703656	BRD-K67703656-001-01-9	Broad Institute of MIT and Harvard	BRD-K67703656			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ncc(cc2C1=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C30H36N4O6S/c1-20-17-34(21(2)19-35)30(37)26-15-24(22-10-9-11-23(14-22)29(36)32(3)4)16-31-28(26)40-27(20)18-33(5)41(38,39)25-12-7-6-8-13-25/h6-16,20-21,27,35H,17-19H2,1-5H3/t20-,21+,27-/m0/s1	GYMQUQFWPBAZQS-ISCCLHIJSA-N	580.235555602							110114
BRD-K29821532-001-01-6	LSM-21542	BRD-K29821532	54620126	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18+,22+/m1/s1	UDSHYHUEGCAODY-FGSXEWAUSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K29821532	BRD-K29821532-001-01-6	Broad Institute of MIT and Harvard	BRD-K29821532			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18+,22+/m1/s1	UDSHYHUEGCAODY-FGSXEWAUSA-N	479.245392004							110115
BRD-K35595943-001-01-1	LSM-21543	BRD-K35595943	54619993	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20-,24+/m0/s1	IWCIQXTVMOHXRP-MZLICYQSSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K35595943	BRD-K35595943-001-01-1	Broad Institute of MIT and Harvard	BRD-K35595943			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20-,24+/m0/s1	IWCIQXTVMOHXRP-MZLICYQSSA-N	506.245057646							110116
BRD-K44051882-001-01-7	LSM-21544	BRD-K44051882	54619892	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18-,23+/m0/s1	YZGVRROAGSWMNC-IUKKYPGJSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K44051882	BRD-K44051882-001-01-7	Broad Institute of MIT and Harvard	BRD-K44051882			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C25H34FN3O5S/c1-5-12-27-25(31)28(4)15-23-17(2)14-29(18(3)16-30)35(32,33)24-11-10-19(13-22(24)34-23)20-8-6-7-9-21(20)26/h6-11,13,17-18,23,30H,5,12,14-16H2,1-4H3,(H,27,31)/t17-,18-,23+/m0/s1	YZGVRROAGSWMNC-IUKKYPGJSA-N	507.220320108							110117
BRD-K81224183	LSM-15056		44493090	InChI=1S/C20H30N4O3/c1-14-12-24(15(2)13-25)20(26)17-9-16(7-6-8-23(4)5)10-22-19(17)27-18(14)11-21-3/h9-10,14-15,18,21,25H,8,11-13H2,1-5H3/t14-,15+,18-/m0/s1	QMNNXCXXHUAUDR-DAYGRLMNSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCN(C)C	BroadT	BRD-K81224183	BRD-K81224183-001-01-0	Broad Institute of MIT and Harvard	BRD-K81224183			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCN(C)C	InChI=1S/C20H30N4O3/c1-14-12-24(15(2)13-25)20(26)17-9-16(7-6-8-23(4)5)10-22-19(17)27-18(14)11-21-3/h9-10,14-15,18,21,25H,8,11-13H2,1-5H3/t14-,15+,18-/m0/s1	QMNNXCXXHUAUDR-DAYGRLMNSA-N	374.23179086							103712
BRD-K04464439-001-01-8	LSM-43962	BRD-K04464439	54620128	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17-,22-/m1/s1	OYMACNCEHZXLLK-UREUOEFNSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K04464439	BRD-K04464439-001-01-8	Broad Institute of MIT and Harvard	BRD-K04464439			C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cccc(F)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H30FN3O4/c1-5-7-18-10-21-23(27-12-18)33-22(16(2)13-29(25(21)32)17(3)15-30)14-28(4)24(31)19-8-6-9-20(26)11-19/h5-12,16-17,22,30H,13-15H2,1-4H3/b7-5+/t16-,17-,22-/m1/s1	OYMACNCEHZXLLK-UREUOEFNSA-N	455.22203467							
BRD-K08820756-001-01-2	LSM-21546	BRD-K08820756	54619884	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22+,27+/m1/s1	RGYLHRJGNKTVCX-VHSZZVNMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K08820756	BRD-K08820756-001-01-2	Broad Institute of MIT and Harvard	BRD-K08820756			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h5,8-9,12-13,16-17,21-23,27,35H,4,6-7,10-11,18-20H2,1-3H3,(H,32,37)/t21-,22+,27+/m1/s1	RGYLHRJGNKTVCX-VHSZZVNMSA-N	518.289305736							110119
BRD-K14113384-001-01-4	LSM-43963	BRD-K14113384	54620163	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18-,22+/m1/s1	QZTHWNUUUJWOTB-ISMAAFNOSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Cc3ccccn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K14113384	BRD-K14113384-001-01-4	Broad Institute of MIT and Harvard	BRD-K14113384			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)Cc3ccccn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H32N4O4/c1-5-8-19-11-21-24(27-13-19)33-22(17(2)14-29(25(21)32)18(3)16-30)15-28(4)23(31)12-20-9-6-7-10-26-20/h5-11,13,17-18,22,30H,12,14-16H2,1-4H3/b8-5+/t17-,18-,22+/m1/s1	QZTHWNUUUJWOTB-ISMAAFNOSA-N	452.242355544							
BRD-K47675707-001-01-3	LSM-21548	BRD-K47675707	54619922	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19-,25+/m0/s1	LKWROLXNVKNHNW-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)c4ccccc4	BroadT	BRD-K47675707	BRD-K47675707-001-01-3	Broad Institute of MIT and Harvard	BRD-K47675707			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)-c1ccccc1	InChI=1S/C28H30FN3O4/c1-18-15-32(19(2)17-33)28(35)23-13-21(20-9-5-4-6-10-20)14-30-26(23)36-25(18)16-31(3)27(34)22-11-7-8-12-24(22)29/h4-14,18-19,25,33H,15-17H2,1-3H3/t18-,19-,25+/m0/s1	LKWROLXNVKNHNW-XHNVNVPESA-N	491.22203467							110121
BRD-K96094948-001-01-6	LSM-21549	BRD-K96094948	54619998	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18+,23+/m0/s1	JSXDBGGCWARADO-VOLVWJTLSA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K96094948	BRD-K96094948-001-01-6	Broad Institute of MIT and Harvard	BRD-K96094948			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18+,23+/m0/s1	JSXDBGGCWARADO-VOLVWJTLSA-N	548.224654732							110122
BRD-K90691514-001-01-9	LSM-21550	BRD-K90691514	54620083	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16+,20-/m0/s1	AMHLQJBMVIBTQJ-YRNRMSPPSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K90691514	BRD-K90691514-001-01-9	Broad Institute of MIT and Harvard	BRD-K90691514			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16+,20-/m0/s1	AMHLQJBMVIBTQJ-YRNRMSPPSA-N	431.242021186							110123
BRD-K01570985-001-01-3	LSM-21551	BRD-K01570985	54620036	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22+,28-/m1/s1	WFHCWVTWIFSLHF-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K01570985	BRD-K01570985-001-01-3	Broad Institute of MIT and Harvard	BRD-K01570985			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22+,28-/m1/s1	WFHCWVTWIFSLHF-RZIGYZOXSA-N	544.240721194							110124
BRD-K14316553-001-01-8	LSM-21552	BRD-K14316553	54620177	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20+,24+/m0/s1	IWCIQXTVMOHXRP-DCLXLUIPSA-N	COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K14316553	BRD-K14316553-001-01-8	Broad Institute of MIT and Harvard	BRD-K14316553			COCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H38N2O6S/c1-19-15-28(20(2)17-29)35(31,32)25-13-12-22(11-7-10-21-8-5-6-9-21)14-23(25)34-24(19)16-27(3)26(30)18-33-4/h12-14,19-21,24,29H,5-6,8-10,15-18H2,1-4H3/t19-,20+,24+/m0/s1	IWCIQXTVMOHXRP-DCLXLUIPSA-N	506.245057646							110125
BRD-K89615341-001-01-0	LSM-21553	BRD-K89615341	54619909	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15-,19-/m1/s1	YKXPYIASKYVMCP-SPYBWZPUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ncc(cc2C1=O)C3=CCCC3	BroadT	BRD-K89615341	BRD-K89615341-001-01-0	Broad Institute of MIT and Harvard	BRD-K89615341			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C21H31N3O5S/c1-14-11-24(15(2)13-25)21(26)18-9-17(16-7-5-6-8-16)10-22-20(18)29-19(14)12-23(3)30(4,27)28/h7,9-10,14-15,19,25H,5-6,8,11-13H2,1-4H3/t14-,15-,19-/m1/s1	YKXPYIASKYVMCP-SPYBWZPUSA-N	437.198441812							110126
MLS003129960	LSM-21554	SID99358505, BRD-K98072304	46903333	InChI=1S/C21H32BrN3O5S/c1-14-11-25(15(2)13-26)31(28,29)20-9-8-16(22)10-18(20)30-19(14)12-24(3)21(27)23-17-6-4-5-7-17/h8-10,14-15,17,19,26H,4-7,11-13H2,1-3H3,(H,23,27)/t14-,15-,19-/m1/s1	SZIKTFJCEPOTBZ-SPYBWZPUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K98072304	BRD-K98072304-001-01-8	Broad Institute of MIT and Harvard	BRD-K98072304			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C21H32BrN3O5S/c1-14-11-25(15(2)13-26)31(28,29)20-9-8-16(22)10-18(20)30-19(14)12-24(3)21(27)23-17-6-4-5-7-17/h8-10,14-15,17,19,26H,4-7,11-13H2,1-3H3,(H,23,27)/t14-,15-,19-/m1/s1	SZIKTFJCEPOTBZ-SPYBWZPUSA-N	517.124604444							110127
CHEMBL2355491	LSM-21555	SID131415353, BRD-K58557132	54620179	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22-,28+/m0/s1	WFHCWVTWIFSLHF-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccccc4F	BroadT	BRD-K58557132	BRD-K58557132-001-01-4	Broad Institute of MIT and Harvard	BRD-K58557132			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F	InChI=1S/C29H37FN2O5S/c1-21-17-32(22(2)20-33)38(34,35)29-11-9-23(8-10-25-6-4-5-7-26(25)30)16-27(29)37-28(21)19-31(3)18-24-12-14-36-15-13-24/h4-7,9,11,16,21-22,24,28,33H,12-15,17-20H2,1-3H3/t21-,22-,28+/m0/s1	WFHCWVTWIFSLHF-RXYILKCJSA-N	544.240721194							110128
BRD-K34573361-001-01-2	LSM-21556	BRD-K34573361	54619965	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19+,25+/m0/s1	DGDCFHNDGOPSJV-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc3ncc(cc3C1=O)c4ccc(cc4)C#N	BroadT	BRD-K34573361	BRD-K34573361-001-01-2	Broad Institute of MIT and Harvard	BRD-K34573361			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc2ncc(cc2C1=O)-c1ccc(cc1)C#N	InChI=1S/C28H29N5O4/c1-18-15-33(19(2)17-34)28(36)24-11-23(21-8-6-20(12-29)7-9-21)14-31-26(24)37-25(18)16-32(3)27(35)22-5-4-10-30-13-22/h4-11,13-14,18-19,25,34H,15-17H2,1-3H3/t18-,19+,25+/m0/s1	DGDCFHNDGOPSJV-OSWQYVSFSA-N	499.221954458							110129
BRD-K25996664-001-01-0	LSM-21557	BRD-K25996664	54620016	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22+,27-/m1/s1	SOAPYNAROURGPA-UMTXDNHDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4ccc(C)cc4	BroadT	BRD-K25996664	BRD-K25996664-001-01-0	Broad Institute of MIT and Harvard	BRD-K25996664			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1ccc(C)cc1	InChI=1S/C29H35N3O5S/c1-20-10-12-23(13-11-20)24-14-15-28-26(16-24)37-27(21(2)17-32(22(3)19-33)38(28,35)36)18-31(4)29(34)30-25-8-6-5-7-9-25/h5-16,21-22,27,33H,17-19H2,1-4H3,(H,30,34)/t21-,22+,27-/m1/s1	SOAPYNAROURGPA-UMTXDNHDSA-N	537.22974194							110130
BRD-K35975131-001-01-7	LSM-21558	BRD-K35975131	54619903	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22+,27+/m0/s1	NEJWGONYBYROJQ-OREGWCPLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K35975131	BRD-K35975131-001-01-7	Broad Institute of MIT and Harvard	BRD-K35975131			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22+,27+/m0/s1	NEJWGONYBYROJQ-OREGWCPLSA-N	519.273321314							110131
BRD-K30494479-001-01-4	LSM-21559	BRD-K30494479	54620168	InChI=1S/C28H39N3O4/c1-19-15-31(20(2)18-32)28(33)25-13-23(22-10-7-11-24(12-22)34-4)14-29-27(25)35-26(19)17-30(3)16-21-8-5-6-9-21/h7,10-14,19-21,26,32H,5-6,8-9,15-18H2,1-4H3/t19-,20-,26+/m1/s1	IDUFABHFDSGNRC-KYTVRQNUSA-N	COc1cccc(c1)c2cnc3O[C@@H](CN(C)CC4CCCC4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K30494479	BRD-K30494479-001-01-4	Broad Institute of MIT and Harvard	BRD-K30494479			COc1cccc(c1)-c1cnc2O[C@@H](CN(C)CC3CCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H39N3O4/c1-19-15-31(20(2)18-32)28(33)25-13-23(22-10-7-11-24(12-22)34-4)14-29-27(25)35-26(19)17-30(3)16-21-8-5-6-9-21/h7,10-14,19-21,26,32H,5-6,8-9,15-18H2,1-4H3/t19-,20-,26+/m1/s1	IDUFABHFDSGNRC-KYTVRQNUSA-N	481.294056758							110132
BRD-K29441747-001-01-4	LSM-21560	BRD-K29441747	54620058	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16-,20-/m1/s1	AMHLQJBMVIBTQJ-JXXFODFXSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K29441747	BRD-K29441747-001-01-4	Broad Institute of MIT and Harvard	BRD-K29441747			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16-,20-/m1/s1	AMHLQJBMVIBTQJ-JXXFODFXSA-N	431.242021186							110133
BRD-K63514750-001-01-9	LSM-21561	BRD-K63514750	54620127	InChI=1S/C29H38N2O6S/c1-20(2)7-6-8-23-11-14-28-26(15-23)37-27(21(3)16-31(22(4)19-32)38(28,35)36)18-30(5)17-24-9-12-25(13-10-24)29(33)34/h9-15,20-22,27,32H,7,16-19H2,1-5H3,(H,33,34)/t21-,22+,27+/m1/s1	RBCXQKUITVRWCX-VHSZZVNMSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K63514750	BRD-K63514750-001-01-9	Broad Institute of MIT and Harvard	BRD-K63514750			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C29H38N2O6S/c1-20(2)7-6-8-23-11-14-28-26(15-23)37-27(21(3)16-31(22(4)19-32)38(28,35)36)18-30(5)17-24-9-12-25(13-10-24)29(33)34/h9-15,20-22,27,32H,7,16-19H2,1-5H3,(H,33,34)/t21-,22+,27+/m1/s1	RBCXQKUITVRWCX-VHSZZVNMSA-N	542.245057646							110134
BRD-K67866268-001-01-4	LSM-21562	BRD-K67866268	54619941	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22+,27-/m1/s1	NEJWGONYBYROJQ-UMTXDNHDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K67866268	BRD-K67866268-001-01-4	Broad Institute of MIT and Harvard	BRD-K67866268			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22+,27-/m1/s1	NEJWGONYBYROJQ-UMTXDNHDSA-N	519.273321314							110135
BRD-K24122647-001-01-6	LSM-21563	BRD-K24122647	54620084	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17+,23+/m1/s1	SBQRHQGOZJVRTE-DGGJZMOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(F)c4	BroadT	BRD-K24122647	BRD-K24122647-001-01-6	Broad Institute of MIT and Harvard	BRD-K24122647			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(F)c1	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17+,23+/m1/s1	SBQRHQGOZJVRTE-DGGJZMOXSA-N	490.193771002							110136
BRD-K51418408-001-01-3	LSM-21564	BRD-K51418408	54620080	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18-,23+/m1/s1	JSXDBGGCWARADO-MIVHDCIWSA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K51418408	BRD-K51418408-001-01-3	Broad Institute of MIT and Harvard	BRD-K51418408			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17+,18-,23+/m1/s1	JSXDBGGCWARADO-MIVHDCIWSA-N	548.224654732							110137
BRD-K49109646-001-01-5	LSM-21565	BRD-K49109646	54619936	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17+,21+/m0/s1	IGKRWIJRXULJPM-CSODHUTKSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc3ccncc3	BroadT	BRD-K49109646	BRD-K49109646-001-01-5	Broad Institute of MIT and Harvard	BRD-K49109646			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc1ccncc1	InChI=1S/C22H27N3O4S/c1-16-14-25(17(2)15-26)30(27,28)22-7-6-19(5-4-18-8-10-24-11-9-18)12-20(22)29-21(16)13-23-3/h6-12,16-17,21,23,26H,13-15H2,1-3H3/t16-,17+,21+/m0/s1	IGKRWIJRXULJPM-CSODHUTKSA-N	429.172227064							110138
SCHEMBL15635785	LSM-21566	BRD-K04609311	54620089	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22-,26+/m1/s1	HNBFIRYNWWOTHM-DRLORSAXSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K04609311	BRD-K04609311-001-01-1	Broad Institute of MIT and Harvard	BRD-K04609311			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22-,26+/m1/s1	HNBFIRYNWWOTHM-DRLORSAXSA-N	527.245392004							110139
BRD-K69862745-001-01-4	LSM-43964	BRD-K69862745	54620027	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19-,23-/m0/s1	DIUXSDCPAZQGFR-PKZJSCAISA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K69862745	BRD-K69862745-001-01-4	Broad Institute of MIT and Harvard	BRD-K69862745			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19-,23-/m0/s1	DIUXSDCPAZQGFR-PKZJSCAISA-N	478.250143026							
BRD-K61088764-001-01-0	LSM-21568	BRD-K61088764	54620078	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17-,20+/m0/s1	WPCNIHGKOXVEOP-ABSDTBQOSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K61088764	BRD-K61088764-001-01-0	Broad Institute of MIT and Harvard	BRD-K61088764			CC(C)C#Cc1ccc2c(O[C@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C21H32N2O4S/c1-15(2)7-8-18-9-10-21-19(11-18)27-20(13-22(5)6)16(3)12-23(17(4)14-24)28(21,25)26/h9-11,15-17,20,24H,12-14H2,1-6H3/t16-,17-,20+/m0/s1	WPCNIHGKOXVEOP-ABSDTBQOSA-N	408.208278214							110141
BRD-K03547220-001-01-4	LSM-21569	BRD-K03547220	54620004	InChI=1S/C27H35N3O5S2/c1-19-16-30(20(2)18-31)27(32)23-14-22(11-6-10-21-8-4-5-9-21)15-28-26(23)35-24(19)17-29(3)37(33,34)25-12-7-13-36-25/h7,12-15,19-21,24,31H,4-5,8-10,16-18H2,1-3H3/t19-,20+,24+/m0/s1	VAEQCBKICRQYMW-DCLXLUIPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc3ncc(cc3C1=O)C#CCC4CCCC4	BroadT	BRD-K03547220	BRD-K03547220-001-01-4	Broad Institute of MIT and Harvard	BRD-K03547220			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H35N3O5S2/c1-19-16-30(20(2)18-31)27(32)23-14-22(11-6-10-21-8-4-5-9-21)15-28-26(23)35-24(19)17-29(3)37(33,34)25-12-7-13-36-25/h7,12-15,19-21,24,31H,4-5,8-10,16-18H2,1-3H3/t19-,20+,24+/m0/s1	VAEQCBKICRQYMW-DCLXLUIPSA-N	545.20181263							110142
BRD-K88925856	LSM-15063		54620051	InChI=1S/C28H37N3O4S/c1-21-17-31(22(2)20-32)36(33,34)28-13-12-23(10-11-24-9-6-14-29-16-24)15-26(28)35-27(21)19-30(3)18-25-7-4-5-8-25/h6,9,12-16,21-22,25,27,32H,4-5,7-8,17-20H2,1-3H3/t21-,22+,27+/m1/s1	VXDFRUAWHFSTRR-VHSZZVNMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccnc4	BroadT	BRD-K88925856	BRD-K88925856-001-01-1	Broad Institute of MIT and Harvard	BRD-K88925856			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccnc1	InChI=1S/C28H37N3O4S/c1-21-17-31(22(2)20-32)36(33,34)28-13-12-23(10-11-24-9-6-14-29-16-24)15-26(28)35-27(21)19-30(3)18-25-7-4-5-8-25/h6,9,12-16,21-22,25,27,32H,4-5,7-8,17-20H2,1-3H3/t21-,22+,27+/m1/s1	VXDFRUAWHFSTRR-VHSZZVNMSA-N	511.250477384							103719
BRD-K13312254-001-01-0	LSM-21570	BRD-K13312254	54619921	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16+,20+/m0/s1	AMHLQJBMVIBTQJ-RZQQEMMASA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K13312254	BRD-K13312254-001-01-0	Broad Institute of MIT and Harvard	BRD-K13312254			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C23H33N3O5/c1-15-11-26(16(2)13-27)23(29)19-9-18(17-7-5-6-8-17)10-24-22(19)31-20(15)12-25(3)21(28)14-30-4/h7,9-10,15-16,20,27H,5-6,8,11-14H2,1-4H3/t15-,16+,20+/m0/s1	AMHLQJBMVIBTQJ-RZQQEMMASA-N	431.242021186							110143
BRD-K14534316-001-01-4	LSM-21571	BRD-K14534316	54619889	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18-,24-/m1/s1	FWSGSYZJGWMBSU-QZTZHPFYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K14534316	BRD-K14534316-001-01-4	Broad Institute of MIT and Harvard	BRD-K14534316			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18-,24-/m1/s1	FWSGSYZJGWMBSU-QZTZHPFYSA-N	500.217203436							110144
BRD-K20662800-001-01-8	LSM-21572	BRD-K20662800	54620070	InChI=1S/C27H35N3O5S2/c1-19-16-30(20(2)18-31)27(32)23-14-22(11-6-10-21-8-4-5-9-21)15-28-26(23)35-24(19)17-29(3)37(33,34)25-12-7-13-36-25/h7,12-15,19-21,24,31H,4-5,8-10,16-18H2,1-3H3/t19-,20-,24+/m1/s1	VAEQCBKICRQYMW-REHUZNOOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)Oc3ncc(cc3C1=O)C#CCC4CCCC4	BroadT	BRD-K20662800	BRD-K20662800-001-01-8	Broad Institute of MIT and Harvard	BRD-K20662800			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H35N3O5S2/c1-19-16-30(20(2)18-31)27(32)23-14-22(11-6-10-21-8-4-5-9-21)15-28-26(23)35-24(19)17-29(3)37(33,34)25-12-7-13-36-25/h7,12-15,19-21,24,31H,4-5,8-10,16-18H2,1-3H3/t19-,20-,24+/m1/s1	VAEQCBKICRQYMW-REHUZNOOSA-N	545.20181263							110145
BRD-K57050180-001-01-2	LSM-21573	BRD-K57050180	54619893	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22+,26-/m1/s1	HNBFIRYNWWOTHM-TVZXLZGTSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K57050180	BRD-K57050180-001-01-2	Broad Institute of MIT and Harvard	BRD-K57050180			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H37N3O5S/c1-20(2)8-6-9-23-11-12-27-25(14-23)36-26(21(3)17-31(22(4)19-32)37(27,34)35)18-30(5)28(33)15-24-10-7-13-29-16-24/h7,10-14,16,20-22,26,32H,8,15,17-19H2,1-5H3/t21-,22+,26-/m1/s1	HNBFIRYNWWOTHM-TVZXLZGTSA-N	527.245392004							110146
BRD-K98778402-001-01-1	LSM-43965	BRD-K98778402	54620136	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19+,23+/m0/s1	DIUXSDCPAZQGFR-DJHUDNPDSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K98778402	BRD-K98778402-001-01-1	Broad Institute of MIT and Harvard	BRD-K98778402			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H38N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5,9,12-14,18-19,21,23,28H,6-8,10-11,15-17H2,1-4H3/b9-5+/t18-,19+,23+/m0/s1	DIUXSDCPAZQGFR-DJHUDNPDSA-N	478.250143026							
BRD-K43604823-001-01-6	LSM-21575	BRD-K43604823	54620048	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17+,23-/m0/s1	SBQRHQGOZJVRTE-MFEFFIJZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(F)c4	BroadT	BRD-K43604823	BRD-K43604823-001-01-6	Broad Institute of MIT and Harvard	BRD-K43604823			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(F)c1	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17+,23-/m0/s1	SBQRHQGOZJVRTE-MFEFFIJZSA-N	490.193771002							110148
BRD-K79049051-001-01-4	LSM-21576	BRD-K79049051	54620110	InChI=1S/C23H33N3O4/c1-7-21(28)25(6)13-20-16(4)12-26(17(5)14-27)23(29)19-10-18(9-8-15(2)3)11-24-22(19)30-20/h10-11,15-17,20,27H,7,12-14H2,1-6H3/t16-,17-,20+/m0/s1	YINCXXWYKWHBGE-ABSDTBQOSA-N	CCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC(C)C	BroadT	BRD-K79049051	BRD-K79049051-001-01-4	Broad Institute of MIT and Harvard	BRD-K79049051			CCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC(C)C	InChI=1S/C23H33N3O4/c1-7-21(28)25(6)13-20-16(4)12-26(17(5)14-27)23(29)19-10-18(9-8-15(2)3)11-24-22(19)30-20/h10-11,15-17,20,27H,7,12-14H2,1-6H3/t16-,17-,20+/m0/s1	YINCXXWYKWHBGE-ABSDTBQOSA-N	415.247106566							110149
BRD-K02332779-001-01-7	LSM-21577	BRD-K02332779	54619950	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18-,23+/m0/s1	YVWHEBSLRQSAGP-IUKKYPGJSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3cccc(c3)C#N	BroadT	BRD-K02332779	BRD-K02332779-001-01-7	Broad Institute of MIT and Harvard	BRD-K02332779			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1cccc(c1)C#N	InChI=1S/C26H33N5O4/c1-5-9-28-26(34)30(4)15-23-17(2)14-31(18(3)16-32)25(33)22-11-21(13-29-24(22)35-23)20-8-6-7-19(10-20)12-27/h6-8,10-11,13,17-18,23,32H,5,9,14-16H2,1-4H3,(H,28,34)/t17-,18-,23+/m0/s1	YVWHEBSLRQSAGP-IUKKYPGJSA-N	479.253254586							110150
BRD-K89824635-001-01-3	LSM-21578	BRD-K89824635	54619925	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17+,23-/m1/s1	SBQRHQGOZJVRTE-SAHWJRBASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(F)c4	BroadT	BRD-K89824635	BRD-K89824635-001-01-3	Broad Institute of MIT and Harvard	BRD-K89824635			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(F)c1	InChI=1S/C25H31FN2O5S/c1-16-13-28(17(2)15-29)34(31,32)24-10-9-20(19-5-4-6-21(26)11-19)12-22(24)33-23(16)14-27(3)25(30)18-7-8-18/h4-6,9-12,16-18,23,29H,7-8,13-15H2,1-3H3/t16-,17+,23-/m1/s1	SBQRHQGOZJVRTE-SAHWJRBASA-N	490.193771002							110151
BRD-K59525271-001-01-1	LSM-21579	BRD-K59525271	54619979	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18-,22-/m1/s1	UDSHYHUEGCAODY-JBYIUTFZSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K59525271	BRD-K59525271-001-01-1	Broad Institute of MIT and Harvard	BRD-K59525271			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18-,22-/m1/s1	UDSHYHUEGCAODY-JBYIUTFZSA-N	479.245392004							110152
BRD-K79739848-001-01-8	LSM-21580	BRD-K79739848	54619980	InChI=1S/C27H36N2O4S/c1-5-6-8-11-23-14-15-27-25(16-23)33-26(19-28(4)18-24-12-9-7-10-13-24)21(2)17-29(22(3)20-30)34(27,31)32/h7,9-10,12-16,21-22,26,30H,5-6,17-20H2,1-4H3/t21-,22+,26-/m0/s1	ADEWQMCOYJIEMS-VRUMLPLGSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K79739848	BRD-K79739848-001-01-8	Broad Institute of MIT and Harvard	BRD-K79739848			CCCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C27H36N2O4S/c1-5-6-8-11-23-14-15-27-25(16-23)33-26(19-28(4)18-24-12-9-7-10-13-24)21(2)17-29(22(3)20-30)34(27,31)32/h7,9-10,12-16,21-22,26,30H,5-6,17-20H2,1-4H3/t21-,22+,26-/m0/s1	ADEWQMCOYJIEMS-VRUMLPLGSA-N	484.239578342							110153
BRD-K30026130-001-01-5	LSM-21581	BRD-K30026130	54619956	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18-,22+/m0/s1	UDSHYHUEGCAODY-NPPFBWRTSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K30026130	BRD-K30026130-001-01-5	Broad Institute of MIT and Harvard	BRD-K30026130			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C24H37N3O5S/c1-5-12-25-24(29)26(4)15-22-17(2)14-27(18(3)16-28)33(30,31)23-11-10-20(13-21(23)32-22)19-8-6-7-9-19/h8,10-11,13,17-18,22,28H,5-7,9,12,14-16H2,1-4H3,(H,25,29)/t17-,18-,22+/m0/s1	UDSHYHUEGCAODY-NPPFBWRTSA-N	479.245392004							110154
BRD-K20427246-001-01-8	LSM-21582	BRD-K20427246	54620053	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19+,23+/m1/s1	LXUHOAUTESRKLV-MSYCTHLASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)c3ccc(C)cc3	BroadT	BRD-K20427246	BRD-K20427246-001-01-8	Broad Institute of MIT and Harvard	BRD-K20427246			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C26H36N4O4/c1-17-7-9-20(10-8-17)21-11-22-25(27-12-21)34-23(14-29(6)24(32)15-28(4)5)18(2)13-30(26(22)33)19(3)16-31/h7-12,18-19,23,31H,13-16H2,1-6H3/t18-,19+,23+/m1/s1	LXUHOAUTESRKLV-MSYCTHLASA-N	468.273655672							110155
BRD-K70968200-001-01-4	LSM-21583	BRD-K70968200	54619920	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21+,27-/m1/s1	XTWZIVUPDNYJMX-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K70968200	BRD-K70968200-001-01-4	Broad Institute of MIT and Harvard	BRD-K70968200			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C29H31FN4O3/c1-20-16-34(21(2)19-35)29(36)26-13-24(7-6-22-5-4-12-31-14-22)15-32-28(26)37-27(20)18-33(3)17-23-8-10-25(30)11-9-23/h4-5,8-15,20-21,27,35H,16-19H2,1-3H3/t20-,21+,27-/m1/s1	XTWZIVUPDNYJMX-PBDKAQRYSA-N	502.238019092							110156
BRD-K14291650-001-01-5	LSM-21584	BRD-K14291650	54620117	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22-,27+/m0/s1	NEJWGONYBYROJQ-BCQCSXDESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C#CCc4ccccc4	BroadT	BRD-K14291650	BRD-K14291650-001-01-5	Broad Institute of MIT and Harvard	BRD-K14291650			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CCc1ccccc1	InChI=1S/C30H37N3O5/c1-21-18-33(22(2)20-34)30(36)26-16-24(11-7-10-23-8-5-4-6-9-23)17-31-28(26)38-27(21)19-32(3)29(35)25-12-14-37-15-13-25/h4-6,8-9,16-17,21-22,25,27,34H,10,12-15,18-20H2,1-3H3/t21-,22-,27+/m0/s1	NEJWGONYBYROJQ-BCQCSXDESA-N	519.273321314							110157
BRD-K29454465-001-01-7	LSM-21585	BRD-K29454465	54620079	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18+,23-/m1/s1	JSXDBGGCWARADO-PRHHBONVSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K29454465	BRD-K29454465-001-01-7	Broad Institute of MIT and Harvard	BRD-K29454465			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)C(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H31F3N4O5/c1-16-13-34(17(2)15-35)25(37)22-11-19(6-5-18(3)36)12-31-24(22)39-23(16)14-33(4)26(38)32-21-9-7-20(8-10-21)27(28,29)30/h7-12,16-18,23,35-36H,13-15H2,1-4H3,(H,32,38)/t16-,17-,18+,23-/m1/s1	JSXDBGGCWARADO-PRHHBONVSA-N	548.224654732							110158
Pinacidil	LSM-1557	BRD-A58207013	4826	InChI=1S/C13H19N5/c1-10(13(2,3)4)17-12(16-9-14)18-11-5-7-15-8-6-11/h5-8,10H,1-4H3,(H2,15,16,17,18)	IVVNZDGDKPTYHK-UHFFFAOYSA-N	CC(\N=C(/NC#N)\Nc1ccncc1)C(C)(C)C	BroadT	BRD-A58207013	BRD-A58207013-001-01-2	Tocris Bioscience	1503	2		CC(NC(Nc1ccncc1)=NC#N)C(C)(C)C	InChI=1S/C13H19N5/c1-10(13(2,3)4)17-12(16-9-14)18-11-5-7-15-8-6-11/h5-8,10H,1-4H3,(H2,15,16,17,18)	IVVNZDGDKPTYHK-UHFFFAOYSA-N	245.164045658							91706, 91706
NSC23766	LSM-1818	NSC-23766	409805	InChI=1S/C24H35N7/c1-6-31(7-2)12-8-9-16(3)27-24-28-18(5)14-23(30-24)29-19-10-11-22-20(15-19)21(25)13-17(4)26-22/h10-11,13-16H,6-9,12H2,1-5H3,(H2,25,26)(H2,27,28,29,30)	DEFBCZWQLILOJF-UHFFFAOYSA-N	CCN(CC)CCCC(C)Nc1nc(C)cc(Nc2ccc3nc(C)cc(N)c3c2)n1	BroadT	BRD-A80213327	BRD-A80213327-305-01-8	Tocris Bioscience	2161	1	Cl.Cl.Cl	CCN(CC)CCCC(C)Nc1nc(C)cc(Nc2ccc3nc(C)cc(N)c3c2)n1.Cl.Cl.Cl	InChI=1S/C24H35N7.3ClH/c1-6-31(7-2)12-8-9-16(3)27-24-28-18(5)14-23(30-24)29-19-10-11-22-20(15-19)21(25)13-17(4)26-22;;;/h10-11,13-16H,6-9,12H2,1-5H3,(H2,25,26)(H2,27,28,29,30);3*1H	CPUHORIUXPQCHW-UHFFFAOYSA-N	421.29539419							91883, 91883, 91883
N-Methyltropan-3-yl 2-(4-bromophenyl)propionate	LSM-1747	BRD-A70268693, SID26751868	133002	InChI=1S/C17H22BrNO2/c1-11(12-3-5-13(18)6-4-12)17(20)21-16-9-14-7-8-15(10-16)19(14)2/h3-6,11,14-16H,7-10H2,1-2H3	GHDWIFTUSXQYGK-UHFFFAOYSA-N	CC(C(=O)OC1CC2CCC(C1)N2C)c3ccc(Br)cc3	BroadT	BRD-A70268693	BRD-A70268693-103-01-9	Tocris Bioscience	750	1	OC(=O)C=CC(=O)O	CC(C(=O)OC1CC2CCC(C1)N2C)c1ccc(Br)cc1.OC(=O)C=CC(=O)O	InChI=1S/C17H22BrNO2.C4H4O4/c1-11(12-3-5-13(18)6-4-12)17(20)21-16-9-14-7-8-15(10-16)19(14)2;5-3(6)1-2-4(7)8/h3-6,11,14-16H,7-10H2,1-2H3;1-2H,(H,5,6)(H,7,8)	VBUSCULTLLOSLM-UHFFFAOYSA-N	351.083391554							91831, 91831
KBIO1_001774	LSM-21586	BRD-A67508925	6708758	InChI=1S/C28H38O6/c1-16(29)33-22-13-19-25(2,3)21(30)8-11-26(19,4)18-7-10-27(5)20(28(18,22)6)14-23(31)34-24(27)17-9-12-32-15-17/h9,12,14-15,18-19,21-22,24,30H,7-8,10-11,13H2,1-6H3/t18?,19?,21-,22+,24-,26?,27+,28?/m0/s1	FJIIOEQLAAKWEL-VISHRWGOSA-N	CC(=O)O[C@@H]1CC2C(C)(C)[C@@H](O)CCC2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4C13C)c5cocc5	BroadT	BRD-A67508925	BRD-A67508925-001-02-7	MicroSource Discovery Systems Inc.	102035			CC(=O)O[C@@H]1CC2C(C)(C)[C@@H](O)CCC2(C)C2CC[C@@]3(C)[C@@H](OC(=O)C=C3C12C)c1ccoc1	InChI=1S/C28H38O6/c1-16(29)33-22-13-19-25(2,3)21(30)8-11-26(19,4)18-7-10-27(5)20(28(18,22)6)14-23(31)34-24(27)17-9-12-32-15-17/h9,12,14-15,18-19,21-22,24,30H,7-8,10-11,13H2,1-6H3/t18?,19?,21-,22+,24-,26?,27+,28?/m0/s1	FJIIOEQLAAKWEL-VISHRWGOSA-N	470.266838936							110159
Omeprazole	LSM-1651	Omeprazole, BRD-A55962179	4594	InChI=1S/C17H19N3O3S/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)	SUBDBMMJDZJVOS-UHFFFAOYSA-N	COc1ccc2nc([nH]c2c1)S(=O)Cc3ncc(C)c(OC)c3C	BroadT	BRD-A55962179	BRD-A55962179-001-01-5	Maybridge	KM 07219			COc1ccc2nc([nH]c2c1)S(=O)Cc1ncc(C)c(OC)c1C	InChI=1S/C17H19N3O3S/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)	SUBDBMMJDZJVOS-UHFFFAOYSA-N	345.114712188							91766, 91766, 91766, 91766, 77260, 77260, 77260, 77260
Pheneticillin	LSM-15176	Pheneticillin, Phenethicillin	272833	InChI=1S/C17H20N2O5S/c1-9(24-10-7-5-4-6-8-10)13(20)18-11-14(21)19-12(16(22)23)17(2,3)25-15(11)19/h4-9,11-12,15H,1-3H3,(H,18,20)(H,22,23)/t9?,11-,12+,15-/m1/s1	NONJJLVGHLVQQM-JHXYUMNGSA-N	CC(Oc1ccccc1)C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O	BroadT	BRD-A66025870	BRD-A66025870-237-05-1	Prestwick Chemical Inc.	Prestw-723	D0701-MP04-ST03-200-	[K]	CC(Oc1ccccc1)C(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C(O)=O.[K]	InChI=1S/C17H20N2O5S.K.H/c1-9(24-10-7-5-4-6-8-10)13(20)18-11-14(21)19-12(16(22)23)17(2,3)25-15(11)19;;/h4-9,11-12,15H,1-3H3,(H,18,20)(H,22,23);;/t9?,11-,12+,15-;;/m1../s1	HUPMDHBXZNXKDX-CIVUSVFMSA-N	364.10929245							52427, 52427
SCHEMBL10583556	LSM-1657	Piroxicam	9880620	InChI=1S/C15H13N3O4S/c1-18-13(15(20)17-12-8-4-5-9-16-12)14(19)10-6-2-3-7-11(10)23(18,21)22/h2-9,13H,1H3,(H,16,17,20)	MNSCVRXKDINXEY-UHFFFAOYSA-N	CN1C(C(=O)Nc2ccccn2)C(=O)c3ccccc3S1(=O)=O	BroadT	BRD-A57382968	BRD-A57382968-001-06-8	Biomol International Inc.	EI219	2840(V2)-3-N1305		CN1C(C(=O)Nc2ccccn2)C(=O)c2ccccc2S1(=O)=O	InChI=1S/C15H13N3O4S/c1-18-13(15(20)17-12-8-4-5-9-16-12)14(19)10-6-2-3-7-11(10)23(18,21)22/h2-9,13H,1H3,(H,16,17,20)	MNSCVRXKDINXEY-UHFFFAOYSA-N	331.062676616							91770
Racephedrine	LSM-1633		5032	InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3	KWGRBVOPPLSCSI-UHFFFAOYSA-N	CNC(C)C(O)c1ccccc1	BroadT	BRD-A54236247	BRD-A54236247-003-02-7	MicroSource Discovery Systems Inc.	1500525		Cl	CNC(C)C(O)c1ccccc1.Cl	InChI=1S/C10H15NO.ClH/c1-8(11-2)10(12)9-6-4-3-5-7-9;/h3-8,10-12H,1-2H3;1H	BALXUFOVQVENIU-UHFFFAOYSA-N	165.11536411							
Zacopride	LSM-1715	Zacopride, BRD-A65615053	108182	InChI=1S/C15H20ClN3O2/c1-21-14-7-12(17)11(16)6-10(14)15(20)18-13-8-19-4-2-9(13)3-5-19/h6-7,9,13H,2-5,8,17H2,1H3,(H,18,20)	FEROPKNOYKURCJ-UHFFFAOYSA-N	COc1cc(N)c(Cl)cc1C(=O)NC2CN3CCC2CC3	BroadT	BRD-A65615053	BRD-A65615053-003-01-4	Tocris Bioscience	1795	2	Cl	COc1cc(N)c(Cl)cc1C(=O)NC1CN2CCC1CC2.Cl	InChI=1S/C15H20ClN3O2.ClH/c1-21-14-7-12(17)11(16)6-10(14)15(20)18-13-8-19-4-2-9(13)3-5-19;/h6-7,9,13H,2-5,8,17H2,1H3,(H,18,20);1H	ITXVOUSORXSTQH-UHFFFAOYSA-N	309.12440462							91810, 91810, 91810
Scopoline	LSM-1903		6708684	InChI=1S/C8H13NO2/c1-9-5-2-4-3-6(9)8(11-4)7(5)10/h4-8,10H,2-3H2,1H3/t4?,5?,6-,7?,8?/m0/s1	MEGPURSNXMUDAE-LTHVNZCTSA-N	CN1C2CC3C[C@H]1C(O3)C2O	BroadT	BRD-A92161634	BRD-A92161634-001-02-6	MicroSource Discovery Systems Inc.	310038			CN1[C@H]2CC3CC1C(O)C2O3	InChI=1S/C8H13NO2/c1-9-5-2-4-3-6(9)8(11-4)7(5)10/h4-8,10H,2-3H2,1H3/t4?,5?,6-,7?,8?/m0/s1	MEGPURSNXMUDAE-LTHVNZCTSA-N	155.094628666							91957
Indapamide	LSM-1936	Lozol, Indapamide	3702	InChI=1S/C16H16ClN3O3S/c1-10-8-11-4-2-3-5-14(11)20(10)19-16(21)12-6-7-13(17)15(9-12)24(18,22)23/h2-7,9-10H,8H2,1H3,(H,19,21)(H2,18,22,23)	NDDAHWYSQHTHNT-UHFFFAOYSA-N	CC1Cc2ccccc2N1NC(=O)c3ccc(Cl)c(c3)S(=O)(=O)N	BroadT	BRD-A95869247	BRD-A95869247-001-03-8	MicroSource Discovery Systems Inc.	1500349			CC1Cc2ccccc2N1NC(=O)c1ccc(Cl)c(c1)S(N)(=O)=O	InChI=1S/C16H16ClN3O3S/c1-10-8-11-4-2-3-5-14(11)20(10)19-16(21)12-6-7-13(17)15(9-12)24(18,22)23/h2-7,9-10H,8H2,1H3,(H,19,21)(H2,18,22,23)	NDDAHWYSQHTHNT-UHFFFAOYSA-N	365.060089802							5893
Guaifenesin	LSM-1896	Guaifenesin, Guaiphenesin, Gecolate, Amonidron, Humabid, Methphenoxydiol, Mucinex, Robitussin, Guaiacol Glyceryl Ether, Glyceryl Guaiacolate, Glycerol Guaiacolate	3516	InChI=1S/C10H14O4/c1-13-9-4-2-3-5-10(9)14-7-8(12)6-11/h2-5,8,11-12H,6-7H2,1H3	HSRJKNPTNIJEKV-UHFFFAOYSA-N	COc1ccccc1OCC(O)CO	BroadT	BRD-A90515964	BRD-A90515964-001-05-8	Prestwick Chemical Inc.	Prestw-776	D0701-MP04-ST03-200-		COc1ccccc1OCC(O)CO	InChI=1S/C10H14O4/c1-13-9-4-2-3-5-10(9)14-7-8(12)6-11/h2-5,8,11-12H,6-7H2,1H3	HSRJKNPTNIJEKV-UHFFFAOYSA-N	198.089208928							91952
D,L-Stepholidine	LSM-1754	L-Stepholidine	5290	InChI=1S/C19H21NO4/c1-23-18-8-12-5-6-20-10-14-11(3-4-16(21)19(14)24-2)7-15(20)13(12)9-17(18)22/h3-4,8-9,15,21-22H,5-7,10H2,1-2H3	JKPISQIIWUONPB-UHFFFAOYSA-N	COc1cc2CCN3Cc4c(CC3c2cc1O)ccc(O)c4OC	BroadT	BRD-A71203467	BRD-A71203467-001-01-5	Calbiochem	569403			COc1cc2CCN3Cc4c(CC3c2cc1O)ccc(O)c4OC	InChI=1S/C19H21NO4/c1-23-18-8-12-5-6-20-10-14-11(3-4-16(21)19(14)24-2)7-15(20)13(12)9-17(18)22/h3-4,8-9,15,21-22H,5-7,10H2,1-2H3	JKPISQIIWUONPB-UHFFFAOYSA-N	327.147058162							91837
Budesonide	LSM-1835	BRD-A82238138	2462	InChI=1S/C25H34O6/c1-4-5-21-30-20-11-17-16-7-6-14-10-15(27)8-9-23(14,2)22(16)18(28)12-24(17,3)25(20,31-21)19(29)13-26/h8-10,16-18,20-22,26,28H,4-7,11-13H2,1-3H3	VOVIALXJUBGFJZ-UHFFFAOYSA-N	CCCC1OC2CC3C4CCC5=CC(=O)C=CC5(C)C4C(O)CC3(C)C2(O1)C(=O)CO	BroadT	BRD-A82238138	BRD-A82238138-001-01-7	Tocris Bioscience	2671	1		CCCC1OC2CC3C4CCC5=CC(=O)C=CC5(C)C4C(O)CC3(C)C2(O1)C(=O)CO	InChI=1S/C25H34O6/c1-4-5-21-30-20-11-17-16-7-6-14-10-15(27)8-9-23(14,2)22(16)18(28)12-24(17,3)25(20,31-21)19(29)13-26/h8-10,16-18,20-22,26,28H,4-7,11-13H2,1-3H3	VOVIALXJUBGFJZ-UHFFFAOYSA-N	430.235538808							91899
Clidinium	LSM-6447	Clidinium, Clidinium Bromide	2784	InChI=1S/C22H26NO3/c1-23-14-12-17(13-15-23)20(16-23)26-21(24)22(25,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,17,20,25H,12-16H2,1H3/q+1	HOOSGZJRQIVJSZ-UHFFFAOYSA-N	C[N+]12CCC(CC1)C(C2)OC(=O)C(O)(c3ccccc3)c4ccccc4	BroadT	BRD-A46066006	BRD-A46066006-004-04-4	MicroSource Discovery Systems Inc.	1500192		Br	C[N+]12CCC(CC1)C(C2)OC(=O)C(O)(c1ccccc1)c1ccccc1.Br	InChI=1S/C22H26NO3.BrH/c1-23-14-12-17(13-15-23)20(16-23)26-21(24)22(25,18-8-4-2-5-9-18)19-10-6-3-7-11-19;/h2-11,17,20,25H,12-16H2,1H3;1H/q+1;	GKEGFOKQMZHVOW-UHFFFAOYSA-N	352.191268702							95170, 95170
4-P-PDOT	LSM-21587	BRD-A67482312, SID26752040	3976006	InChI=1S/C19H21NO/c1-2-19(21)20-16-12-15-10-6-7-11-17(15)18(13-16)14-8-4-3-5-9-14/h3-11,16,18H,2,12-13H2,1H3,(H,20,21)	RCYLUNPFECYGDW-UHFFFAOYSA-N	CCC(=O)NC1CC(c2ccccc2)c3ccccc3C1	BroadT	BRD-A67482312	BRD-A67482312-001-01-8	Tocris Bioscience	1034	4		CCC(=O)NC1CC(c2ccccc2)c2ccccc2C1	InChI=1S/C19H21NO/c1-2-19(21)20-16-12-15-10-6-7-11-17(15)18(13-16)14-8-4-3-5-9-14/h3-11,16,18H,2,12-13H2,1H3,(H,20,21)	RCYLUNPFECYGDW-UHFFFAOYSA-N	279.162314302							110160
Nisoxetine	LSM-1934	Nisoxetine, Compound 89218, LY-94939	4500	InChI=1S/C17H21NO2/c1-18-13-12-15(14-8-4-3-5-9-14)20-17-11-7-6-10-16(17)19-2/h3-11,15,18H,12-13H2,1-2H3	ITJNARMNRKSWTA-UHFFFAOYSA-N	CNCCC(Oc1ccccc1OC)c2ccccc2	BroadT	BRD-A95696066	BRD-A95696066-003-06-2	Tocris Bioscience	1025	5	Cl	CNCCC(Oc1ccccc1OC)c1ccccc1.Cl	InChI=1S/C17H21NO2.ClH/c1-18-13-12-15(14-8-4-3-5-9-14)20-17-11-7-6-10-16(17)19-2;/h3-11,15,18H,12-13H2,1-2H3;1H	LCEURBZEQJZUPV-UHFFFAOYSA-N	271.157228922							73410, 73410, 73410
Amisulpride	LSM-1669	Amisulpride, BRD-A60197193	2159	InChI=1S/C17H27N3O4S/c1-4-20-8-6-7-12(20)11-19-17(21)13-9-16(25(22,23)5-2)14(18)10-15(13)24-3/h9-10,12H,4-8,11,18H2,1-3H3,(H,19,21)	NTJOBXMMWNYJFB-UHFFFAOYSA-N	CCN1CCCC1CNC(=O)c2cc(c(N)cc2OC)S(=O)(=O)CC	BroadT	BRD-A60197193	BRD-A60197193-001-05-4	Tocris Bioscience	2132	1		CCN1CCCC1CNC(=O)c1cc(c(N)cc1OC)S(=O)(=O)CC	InChI=1S/C17H27N3O4S/c1-4-20-8-6-7-12(20)11-19-17(21)13-9-16(25(22,23)5-2)14(18)10-15(13)24-3/h9-10,12H,4-8,11,18H2,1-3H3,(H,19,21)	NTJOBXMMWNYJFB-UHFFFAOYSA-N	369.172227064							64045
Fexofenadine	LSM-1770	Allegra, Fexofenadine	3348	InChI=1S/C32H39NO4/c1-31(2,30(35)36)25-17-15-24(16-18-25)29(34)14-9-21-33-22-19-28(20-23-33)32(37,26-10-5-3-6-11-26)27-12-7-4-8-13-27/h3-8,10-13,15-18,28-29,34,37H,9,14,19-23H2,1-2H3,(H,35,36)	RWTNPBWLLIMQHL-UHFFFAOYSA-N	CC(C)(C(=O)O)c1ccc(cc1)C(O)CCCN2CCC(CC2)C(O)(c3ccccc3)c4ccccc4	BroadT	BRD-A73368467	BRD-A73368467-003-02-8	MicroSource Discovery Systems Inc.	1504179		Cl	CC(C)(C(O)=O)c1ccc(cc1)C(O)CCCN1CCC(CC1)C(O)(c1ccccc1)c1ccccc1.Cl	InChI=1S/C32H39NO4.ClH/c1-31(2,30(35)36)25-17-15-24(16-18-25)29(34)14-9-21-33-22-19-28(20-23-33)32(37,26-10-5-3-6-11-26)27-12-7-4-8-13-27;/h3-8,10-13,15-18,28-29,34,37H,9,14,19-23H2,1-2H3,(H,35,36);1H	RRJFVPUCXDGFJB-UHFFFAOYSA-N	501.287908738							5050, 5050
KBIO3_000986	LSM-21588	BRD-A86629089	6708749	InChI=1S/C29H38O8/c1-16-19-8-10-27(5)25(18-9-11-34-15-18)36-24(32)14-29(16,27)37-22-13-21(35-17(2)30)26(3,4)20(28(19,22)6)12-23(31)33-7/h9,11,15,19-22,25H,1,8,10,12-14H2,2-7H3/t19?,20-,21-,22-,25-,27-,28+,29-/m0/s1	UWOANMOYULTSJG-UASXDGGGSA-N	COC(=O)C[C@H]1C(C)(C)[C@H](C[C@@H]2O[C@]34CC(=O)O[C@@H](c5cocc5)[C@]3(C)CCC(C4=C)[C@]12C)OC(=O)C	BroadT	BRD-A86629089	BRD-A86629089-001-02-0	MicroSource Discovery Systems Inc.	100651			COC(=O)C[C@H]1C(C)(C)[C@H](C[C@@H]2O[C@]34CC(=O)O[C@@H](c5ccoc5)[C@]3(C)CCC(C4=C)[C@]12C)OC(C)=O	InChI=1S/C29H38O8/c1-16-19-8-10-27(5)25(18-9-11-34-15-18)36-24(32)14-29(16,27)37-22-13-21(35-17(2)30)26(3,4)20(28(19,22)6)12-23(31)33-7/h9,11,15,19-22,25H,1,8,10,12-14H2,2-7H3/t19?,20-,21-,22-,25-,27-,28+,29-/m0/s1	UWOANMOYULTSJG-UASXDGGGSA-N	514.256668176							110161
PRESTWICK3_000121	LSM-1670	Bromocriptine	5284353	InChI=1S/C32H40BrN5O5/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39)/t18-,23?,24+,25+,31-,32+/m1/s1	OZVBMTJYIDMWIL-BGNMTYTCSA-N	CC(C)C[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)C4Cc5c(Br)[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]7CCCN7C1=O)C(C)C	BroadT	BRD-A60274948	BRD-A60274948-066-02-9	Prestwick Chemical Inc.	Prestw-121	D0701-MP04-ST03-200-	CS(=O)(=O)O	CC(C)C[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)C4Cc5c(Br)[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]2CCCN2C1=O)C(C)C.CS(=O)(=O)O	InChI=1S/C32H40BrN5O5.CH4O3S/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18;1-5(2,3)4/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39);1H3,(H,2,3,4)/t18-,23?,24+,25+,31-,32+;/m1./s1	NOJMTMIRQRDZMT-JGYCFGIMSA-N	653.22128203							91779, 91779
Bendroflumethiazide	LSM-1816	Bendroflumethiazide, Benzydroflumethiazide, Naturetin, Bendrofluazide, Naturetin-10, Naturetin-2.5, Naturetin-5	2315	InChI=1S/C15H14F3N3O4S2/c16-15(17,18)10-7-11-13(8-12(10)26(19,22)23)27(24,25)21-14(20-11)6-9-4-2-1-3-5-9/h1-5,7-8,14,20-21H,6H2,(H2,19,22,23)	HDWIHXWEUNVBIY-UHFFFAOYSA-N	NS(=O)(=O)c1cc2c(NC(Cc3ccccc3)NS2(=O)=O)cc1C(F)(F)F	BroadT	BRD-A80017228	BRD-A80017228-001-04-2	MicroSource Discovery Systems Inc.	1503104			NS(=O)(=O)c1cc2c(NC(Cc3ccccc3)NS2(=O)=O)cc1C(F)(F)F	InChI=1S/C15H14F3N3O4S2/c16-15(17,18)10-7-11-13(8-12(10)26(19,22)23)27(24,25)21-14(20-11)6-9-4-2-1-3-5-9/h1-5,7-8,14,20-21H,6H2,(H2,19,22,23)	HDWIHXWEUNVBIY-UHFFFAOYSA-N	421.037781938							3013
Vesamicol	LSM-15327	SID90341156, SID50086378, SID14730560	5662	InChI=1S/C17H25NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-17,19H,4-5,8-13H2	YSSBJODGIYRAMI-UHFFFAOYSA-N	OC1CCCCC1N2CCC(CC2)c3ccccc3	BroadT	BRD-A76904477	BRD-A76904477-003-03-3	Tocris Bioscience	653	3	Cl	OC1CCCCC1N1CCC(CC1)c1ccccc1.Cl	InChI=1S/C17H25NO.ClH/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14;/h1-3,6-7,15-17,19H,4-5,8-13H2;1H	XJNUHVMJVWOYCW-UHFFFAOYSA-N	259.19361443							103974, 103974, 103974
Hydroquinine	LSM-1805		2734756	InChI=1S/C20H26N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h4-6,8,11,13-14,19-20,23H,3,7,9-10,12H2,1-2H3/t13-,14?,19-,20+/m0/s1	LJOQGZACKSYWCH-VOMFEXJBSA-N	CC[C@H]1CN2CCC1C[C@H]2[C@H](O)c3ccnc4ccc(OC)cc34	BroadT	BRD-A78295502	BRD-A78295502-337-03-5	Prestwick Chemical Inc.	Prestw-635	D0701-MP04-ST03-200-	O.Br	CC[C@H]1CN2CCC1C[C@H]2[C@H](O)c1ccnc2ccc(OC)cc12.O.Br	InChI=1S/C20H26N2O2.BrH.H2O/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;;/h4-6,8,11,13-14,19-20,23H,3,7,9-10,12H2,1-2H3;1H;1H2/t13-,14?,19-,20+;;/m0../s1	IWSVSZYIGVGHCN-RYQNUWOSSA-N	326.199428092							91876, 91876
Primaquine	LSM-1649	Primaquine	4908	InChI=1S/C15H21N3O/c1-11(5-3-7-16)18-14-10-13(19-2)9-12-6-4-8-17-15(12)14/h4,6,8-11,18H,3,5,7,16H2,1-2H3	INDBQLZJXZLFIT-UHFFFAOYSA-N	COc1cc(NC(C)CCCN)c2ncccc2c1	BroadT	BRD-A55913614	BRD-A55913614-316-04-7	MicroSource Discovery Systems Inc.	1500500		OP(=O)(O)O.OP(=O)(O)O	COc1cc(NC(C)CCCN)c2ncccc2c1.OP(=O)(O)O.OP(=O)(O)O	InChI=1S/C15H21N3O.2H3O4P/c1-11(5-3-7-16)18-14-10-13(19-2)9-12-6-4-8-17-15(12)14;2*1-5(2,3)4/h4,6,8-11,18H,3,5,7,16H2,1-2H3;2*(H3,1,2,3,4)	GJOHLWZHWQUKAU-UHFFFAOYSA-N	259.168462322							8405, 8405, 8405, 8405
Clobenztropine	LSM-15328	SID26751967, SID144203645, SID104171119, BRD-A51713165	1687	InChI=1S/C21H24ClNO/c1-23-18-11-12-19(23)14-20(13-18)24-21(15-5-3-2-4-6-15)16-7-9-17(22)10-8-16/h2-10,18-21H,11-14H2,1H3	OCAXFDULERPAJM-UHFFFAOYSA-N	CN1C2CCC1CC(C2)OC(c3ccccc3)c4ccc(Cl)cc4	BroadT	BRD-A51713165	BRD-A51713165-003-01-8	Tocris Bioscience	917	1	Cl	CN1C2CCC1CC(C2)OC(c1ccccc1)c1ccc(Cl)cc1.Cl	InChI=1S/C21H24ClNO.ClH/c1-23-18-11-12-19(23)14-20(13-18)24-21(15-5-3-2-4-6-15)16-7-9-17(22)10-8-16;/h2-10,18-21H,11-14H2,1H3;1H	FXKCQWIUITUJFU-UHFFFAOYSA-N	341.154642108							103975, 103975
Cyclopentolate	LSM-1800	Cyclopentolate	2905	InChI=1S/C17H25NO3/c1-18(2)12-13-21-16(19)15(14-8-4-3-5-9-14)17(20)10-6-7-11-17/h3-5,8-9,15,20H,6-7,10-13H2,1-2H3	SKYSRIRYMSLOIN-UHFFFAOYSA-N	CN(C)CCOC(=O)C(c1ccccc1)C2(O)CCCC2	BroadT	BRD-A77291778	BRD-A77291778-003-04-8	MicroSource Discovery Systems Inc.	1500212		Cl	CN(C)CCOC(=O)C(c1ccccc1)C1(O)CCCC1.Cl	InChI=1S/C17H25NO3.ClH/c1-18(2)12-13-21-16(19)15(14-8-4-3-5-9-14)17(20)10-6-7-11-17;/h3-5,8-9,15,20H,6-7,10-13H2,1-2H3;1H	RHKZVMUBMXGOLL-UHFFFAOYSA-N	291.18344367							4024, 4024
SKF 89976-A	LSM-1596	SKF-89976A, SKF-89976, SKF 89976A HYDROCHLORIDE1-(4,4-DIPHENYL-3-BUTENYL)-3-PIPERIDINECARBOXYLIC ACID HYDROCHLORIDE	92409	InChI=1S/C22H25NO2/c24-22(25)20-13-7-15-23(17-20)16-8-14-21(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-12,14,20H,7-8,13,15-17H2,(H,24,25)	TXQKSMSLZVKQBI-UHFFFAOYSA-N	OC(=O)C1CCCN(CCC=C(c2ccccc2)c3ccccc3)C1	BroadT	BRD-A49046702	BRD-A49046702-001-01-2	Biomol International Inc.	AC-502	2819-N1292		OC(=O)C1CCCN(CCC=C(c2ccccc2)c2ccccc2)C1	InChI=1S/C22H25NO2/c24-22(25)20-13-7-15-23(17-20)16-8-14-21(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-12,14,20H,7-8,13,15-17H2,(H,24,25)	TXQKSMSLZVKQBI-UHFFFAOYSA-N	335.18852905							91734, 91734
SYM-2206	LSM-21589	SYM 2206, SID26751993	5039877	InChI=1S/C20H22N4O3/c1-3-8-22-20(25)24-12(2)15-9-17-18(27-11-26-17)10-16(15)19(23-24)13-4-6-14(21)7-5-13/h4-7,9-10,12H,3,8,11,21H2,1-2H3,(H,22,25)	OFUDZKKOKPGXOH-UHFFFAOYSA-N	CCCNC(=O)N1N=C(c2ccc(N)cc2)c3cc4OCOc4cc3C1C	BroadT	BRD-A77218119	BRD-A77218119-001-02-7	Tocris Bioscience	961	9		CCCNC(=O)N1N=C(c2ccc(N)cc2)c2cc3OCOc3cc2C1C	InChI=1S/C20H22N4O3/c1-3-8-22-20(25)24-12(2)15-9-17-18(27-11-26-17)10-16(15)19(23-24)13-4-6-14(21)7-5-13/h4-7,9-10,12H,3,8,11,21H2,1-2H3,(H,22,25)	OFUDZKKOKPGXOH-UHFFFAOYSA-N	366.169190604							110162
Glemanserin	LSM-1685	Glemanserin, BRD-A62057054, MDL-11939	71781	InChI=1S/C20H25NO/c22-20(18-9-5-2-6-10-18)19-12-15-21(16-13-19)14-11-17-7-3-1-4-8-17/h1-10,19-20,22H,11-16H2	AXNGJCOYCMDPQG-UHFFFAOYSA-N	OC(C1CCN(CCc2ccccc2)CC1)c3ccccc3	BroadT	BRD-A62057054	BRD-A62057054-001-01-5	Tocris Bioscience	870	2		OC(C1CCN(CCc2ccccc2)CC1)c1ccccc1	InChI=1S/C20H25NO/c22-20(18-9-5-2-6-10-18)19-12-15-21(16-13-19)14-11-17-7-3-1-4-8-17/h1-10,19-20,22H,11-16H2	AXNGJCOYCMDPQG-UHFFFAOYSA-N	295.19361443							91790
CGP55845	LSM-1892	CGP 55845, CGP-55845	5311042	InChI=1S/C18H22Cl2NO3P/c1-13(15-7-8-17(19)18(20)9-15)21-10-16(22)12-25(23,24)11-14-5-3-2-4-6-14/h2-9,13,16,21-22H,10-12H2,1H3,(H,23,24)/t13-,16-/m0/s1	ZODSPDOOCZZEIM-BBRMVZONSA-N	C[C@H](NC[C@H](O)CP(=O)(O)Cc1ccccc1)c2ccc(Cl)c(Cl)c2	BroadT	BRD-A89672324	BRD-A89672324-001-02-2	Tocris Bioscience	1248	1		C[C@H](NC[C@H](O)CP(O)(=O)Cc1ccccc1)c1ccc(Cl)c(Cl)c1	InChI=1S/C18H22Cl2NO3P/c1-13(15-7-8-17(19)18(20)9-15)21-10-16(22)12-25(23,24)11-14-5-3-2-4-6-14/h2-9,13,16,21-22H,10-12H2,1H3,(H,23,24)/t13-,16-/m0/s1	ZODSPDOOCZZEIM-BBRMVZONSA-N	401.071435504							91949
Dehydrorotenone	LSM-21590		303993	InChI=1S/C23H20O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,16H,1,8,10H2,2-4H3	GFERNZCCTZEIET-UHFFFAOYSA-N	COc1cc2OCC3=C(C(=O)c4ccc5OC(Cc5c4O3)C(=C)C)c2cc1OC	BroadT	BRD-A84913188	BRD-A84913188-001-02-0	MicroSource Discovery Systems Inc.	201154			COc1cc2OCc3oc4c5CC(Oc5ccc4c(=O)c3-c2cc1OC)C(C)=C	InChI=1S/C23H20O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,16H,1,8,10H2,2-4H3	GFERNZCCTZEIET-UHFFFAOYSA-N	392.12598836							110163
SKF-77434	LSM-1702	BRD-A64227845, SID50104926, SID90341006	1241	InChI=1S/C19H21NO2/c1-2-9-20-10-8-15-11-18(21)19(22)12-16(15)17(13-20)14-6-4-3-5-7-14/h2-7,11-12,17,21-22H,1,8-10,13H2	QBUVZVXIRYFENV-UHFFFAOYSA-N	Oc1cc2CCN(CC=C)CC(c3ccccc3)c2cc1O	BroadT	BRD-A64227845	BRD-A64227845-004-02-8	Tocris Bioscience	1662	1	Br	Oc1cc2CCN(CC=C)CC(c3ccccc3)c2cc1O.Br	InChI=1S/C19H21NO2.BrH/c1-2-9-20-10-8-15-11-18(21)19(22)12-16(15)17(13-20)14-6-4-3-5-7-14;/h2-7,11-12,17,21-22H,1,8-10,13H2;1H	JWQRAXTWDYUBFI-UHFFFAOYSA-N	295.157228922							63988, 63988, 63988
L-655,708	LSM-1859	BRD-A84389091	4203080	InChI=1S/C18H19N3O4/c1-3-25-18(23)15-16-14-5-4-8-20(14)17(22)12-9-11(24-2)6-7-13(12)21(16)10-19-15/h6-7,9-10,14H,3-5,8H2,1-2H3	YKYOQIXTECBVBB-UHFFFAOYSA-N	CCOC(=O)c1ncn2c1C3CCCN3C(=O)c4cc(OC)ccc24	BroadT	BRD-A84389091	BRD-A84389091-001-01-1	Tocris Bioscience	1327	1		CCOC(=O)c1ncn-2c1C1CCCN1C(=O)c1cc(OC)ccc-21	InChI=1S/C18H19N3O4/c1-3-25-18(23)15-16-14-5-4-8-20(14)17(22)12-9-11(24-2)6-7-13(12)21(16)10-19-15/h6-7,9-10,14H,3-5,8H2,1-2H3	YKYOQIXTECBVBB-UHFFFAOYSA-N	341.137556118							91920
Flumethazone Pivalate	LSM-21591	Flumethasone Pivalate	5702055	InChI=1S/C27H36F2O6/c1-14-9-16-17-11-19(28)18-10-15(30)7-8-24(18,5)26(17,29)20(31)12-25(16,6)27(14,34)21(32)13-35-22(33)23(2,3)4/h7-8,10,14,16-17,19-20,31,34H,9,11-13H2,1-6H3/t14-,16?,17?,19+,20+,24+,25+,26+,27+/m1/s1	JWRMHDSINXPDHB-DCPWPRNHSA-N	C[C@@H]1CC2C3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)C(C)(C)C	BroadT	BRD-A50064262	BRD-A50064262-001-02-1	MicroSource Discovery Systems Inc.	1500300			C[C@@H]1CC2C3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)C(C)(C)C	InChI=1S/C27H36F2O6/c1-14-9-16-17-11-19(28)18-10-15(30)7-8-24(18,5)26(17,29)20(31)12-25(16,6)27(14,34)21(32)13-35-22(33)23(2,3)4/h7-8,10,14,16-17,19-20,31,34H,9,11-13H2,1-6H3/t14-,16?,17?,19+,20+,24+,25+,26+,27+/m1/s1	JWRMHDSINXPDHB-DCPWPRNHSA-N	494.247995272							
Sulconazole	LSM-1751	Exelderm, Sulconazole	5318	InChI=1S/C18H15Cl3N2S/c19-14-3-1-13(2-4-14)11-24-18(10-23-8-7-22-12-23)16-6-5-15(20)9-17(16)21/h1-9,12,18H,10-11H2	AFNXATANNDIXLG-UHFFFAOYSA-N	Clc1ccc(CSC(Cn2ccnc2)c3ccc(Cl)cc3Cl)cc1	BroadT	BRD-A70649075	BRD-A70649075-008-04-3	MicroSource Discovery Systems Inc.	1501148		O[N+](=O)[O-]	Clc1ccc(CSC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1.O[N+](=O)[O-]	InChI=1S/C18H15Cl3N2S.HNO3/c19-14-3-1-13(2-4-14)11-24-18(10-23-8-7-22-12-23)16-6-5-15(20)9-17(16)21;2-1(3)4/h1-9,12,18H,10-11H2;(H,2,3,4)	CRKGMGQUHDNAPB-UHFFFAOYSA-N	396.00215232							77776, 77776
Estrone Benzoate	LSM-21592	BRD-A90969585	6710682	InChI=1S/C25H26O3/c1-25-14-13-20-19-10-8-18(28-24(27)16-5-3-2-4-6-16)15-17(19)7-9-21(20)22(25)11-12-23(25)26/h2-6,8,10,15,20-22H,7,9,11-14H2,1H3/t20?,21?,22?,25-/m0/s1	HKUKRSLIEVXDMS-DJYNTIJESA-N	C[C@]12CCC3C(CCc4cc(OC(=O)c5ccccc5)ccc34)C1CCC2=O	BroadT	BRD-A90969585	BRD-A90969585-001-02-3	MicroSource Discovery Systems Inc.	307123			C[C@]12CCC3C(CCc4cc(OC(=O)c5ccccc5)ccc34)C1CCC2=O	InChI=1S/C25H26O3/c1-25-14-13-20-19-10-8-18(28-24(27)16-5-3-2-4-6-16)15-17(19)7-9-21(20)22(25)11-12-23(25)26/h2-6,8,10,15,20-22H,7,9,11-14H2,1H3/t20?,21?,22?,25-/m0/s1	HKUKRSLIEVXDMS-DJYNTIJESA-N	374.188194692							110164
Mefloquine	LSM-5180	Mefloquine, Mefaquin, Lariam, WR-142490, RO-215998, GNF-PF-5544	4046	InChI=1S/C17H16F6N2O/c18-16(19,20)11-5-3-4-9-10(15(26)12-6-1-2-7-24-12)8-13(17(21,22)23)25-14(9)11/h3-5,8,12,15,24,26H,1-2,6-7H2	XEEQGYMUWCZPDN-UHFFFAOYSA-N	OC(C1CCCCN1)c2cc(nc3c(cccc23)C(F)(F)F)C(F)(F)F	BroadT	BRD-A89585551	BRD-A89585551-003-03-4	Prestwick Chemical Inc.	Prestw-126	D0701-MP04-ST03-200-	Cl	OC(C1CCCCN1)c1cc(nc2c(cccc12)C(F)(F)F)C(F)(F)F.Cl	InChI=1S/C17H16F6N2O.ClH/c18-16(19,20)11-5-3-4-9-10(15(26)12-6-1-2-7-24-12)8-13(17(21,22)23)25-14(9)11;/h3-5,8,12,15,24,26H,1-2,6-7H2;1H	WESWYMRNZNDGBX-UHFFFAOYSA-N	378.116682352							63681, 63681
Fenoldopam	LSM-1609	Fenoldopam, SK&F-82526, SK-82526	3341	InChI=1S/C16H16ClNO3/c17-15-11-5-6-18-8-13(9-1-3-10(19)4-2-9)12(11)7-14(20)16(15)21/h1-4,7,13,18-21H,5-6,8H2	TVURRHSHRRELCG-UHFFFAOYSA-N	Oc1ccc(cc1)C2CNCCc3c(Cl)c(O)c(O)cc23	BroadT	BRD-A50684349	BRD-A50684349-001-01-5	Biomol International Inc.	AC-257	2812-3-N1298		Oc1ccc(cc1)C1CNCCc2c(Cl)c(O)c(O)cc12	InChI=1S/C16H16ClNO3/c17-15-11-5-6-18-8-13(9-1-3-10(19)4-2-9)12(11)7-14(20)16(15)21/h1-4,7,13,18-21H,5-6,8H2	TVURRHSHRRELCG-UHFFFAOYSA-N	305.081871092							5002, 5002, 5002
SPECTRUM_000402	LSM-6476	Cortisone	6708812	InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14?,15?,18?,19-,20-,21-/m0/s1	MFYSYFVPBJMHGN-BDQMTFAOSA-N	C[C@]12CCC(=O)C=C1CCC3C4CC[C@](O)(C(=O)CO)[C@@]4(C)CC(=O)C23	BroadT	BRD-A62731508	BRD-A62731508-001-02-5	AnalytiCon Discovery GmbH	NP-011003			C[C@]12CC(=O)C3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@]2(O)C(=O)CO	InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14?,15?,18?,19-,20-,21-/m0/s1	MFYSYFVPBJMHGN-BDQMTFAOSA-N	360.193673996							
Sertaconazole	LSM-1938	99592-32-2, Sertaconazole, Demofix, Ertaczo	65863	InChI=1S/C20H15Cl3N2OS/c21-14-4-5-16(18(23)8-14)19(9-25-7-6-24-12-25)26-10-13-11-27-20-15(13)2-1-3-17(20)22/h1-8,11-12,19H,9-10H2	JLGKQTAYUIMGRK-UHFFFAOYSA-N	Clc1ccc(C(Cn2ccnc2)OCc3csc4c(Cl)cccc34)c(Cl)c1	BroadT	BRD-A95939040	BRD-A95939040-008-03-3	Prestwick Chemical Inc.	Prestw-1045	D0701-MP04-ST03-200-	O[N+](=O)[O-]	Clc1ccc(C(Cn2ccnc2)OCc2csc3c(Cl)cccc23)c(Cl)c1.O[N+](=O)[O-]	InChI=1S/C20H15Cl3N2OS.HNO3/c21-14-4-5-16(18(23)8-14)19(9-25-7-6-24-12-25)26-10-13-11-27-20-15(13)2-1-3-17(20)22;2-1(3)4/h1-8,11-12,19H,9-10H2;(H,2,3,4)	HAAITRDZHUANGT-UHFFFAOYSA-N	435.99706694							83682, 83682
2-Methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol	LSM-21593	BRD-A79248021	1573	InChI=1S/C19H26O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,18,20-21H,3-8H2,1-2H3	CQOQDQWUFQDJMK-UHFFFAOYSA-N	COc1cc2C3CCC4(C)C(O)CCC4C3CCc2cc1O	BroadT	BRD-A79248021	BRD-A79248021-001-01-1	Tocris Bioscience	1807	1		COc1cc2C3CCC4(C)C(O)CCC4C3CCc2cc1O	InChI=1S/C19H26O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,18,20-21H,3-8H2,1-2H3	CQOQDQWUFQDJMK-UHFFFAOYSA-N	302.188194692							110165
BRL-15,572	LSM-1618	BRL-15572, BRL 155724-(3-CHLOROPHENYL)-ALPHA-(DIPHENYLMETHYL)-1-PIPERAZINEETHANOL HYDROCHLORIDE	3654103	InChI=1S/C25H27ClN2O/c26-22-12-7-13-23(18-22)28-16-14-27(15-17-28)19-24(29)25(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-13,18,24-25,29H,14-17,19H2	QJHCTHPYUOXOGM-UHFFFAOYSA-N	OC(CN1CCN(CC1)c2cccc(Cl)c2)C(c3ccccc3)c4ccccc4	BroadT	BRD-A51829654	BRD-A51829654-001-01-4	Biomol International Inc.	AC-536	2813-N1283		OC(CN1CCN(CC1)c1cccc(Cl)c1)C(c1ccccc1)c1ccccc1	InChI=1S/C25H27ClN2O/c26-22-12-7-13-23(18-22)28-16-14-27(15-17-28)19-24(29)25(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-13,18,24-25,29H,14-17,19H2	QJHCTHPYUOXOGM-UHFFFAOYSA-N	406.181191214							64060, 64060
SPBIO_000483	LSM-21594	BRD-A59009217	6708553	InChI=1S/C28H34O8/c1-14(29)34-20-12-18(30)26(5)16-7-9-25(4)21(15-8-10-33-13-15)35-23(32)22-28(25,36-22)27(16,6)19(31)11-17(26)24(20,2)3/h8,10,13,16-17,20-22H,7,9,11-12H2,1-6H3/t16?,17?,20-,21+,22?,25+,26-,27+,28?/m1/s1	AFBBIVHQSLMMLH-TWDGNWCTSA-N	CC(=O)O[C@@H]1CC(=O)[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C5OC45[C@]3(C)C(=O)CC2C1(C)C)c6cocc6	BroadT	BRD-A59009217	BRD-A59009217-001-02-3	MicroSource Discovery Systems Inc.	100585			CC(=O)O[C@@H]1CC(=O)[C@@]2(C)C(CC(=O)[C@]3(C)C2CC[C@@]2(C)[C@@H](OC(=O)C4OC324)c2ccoc2)C1(C)C	InChI=1S/C28H34O8/c1-14(29)34-20-12-18(30)26(5)16-7-9-25(4)21(15-8-10-33-13-15)35-23(32)22-28(25,36-22)27(16,6)19(31)11-17(26)24(20,2)3/h8,10,13,16-17,20-22H,7,9,11-12H2,1-6H3/t16?,17?,20-,21+,22?,25+,26-,27+,28?/m1/s1	AFBBIVHQSLMMLH-TWDGNWCTSA-N	498.225368048							
CHEMBL1616521	LSM-1793	BRD-A75769826	16741282	InChI=1S/C26H26N2O3/c1-14(2)13-28-10-9-25-21-15-7-8-19(29)23(21)31-24(25)22-17(12-26(25,30)20(28)11-15)16-5-3-4-6-18(16)27-22/h3-8,20,24,27,29-30H,1,9-13H2,2H3/t20?,24-,25-,26+/m0/s1	ZFMVWAWSKLAVOE-OOGIKFLQSA-N	CC(=C)CN1CC[C@]23[C@H]4Oc5c(O)ccc(CC1[C@]2(O)Cc6c4[nH]c7ccccc67)c35	BroadT	BRD-A75769826	BRD-A75769826-003-01-3	Tocris Bioscience	1410	1	Cl	CC(=C)CN1CC[C@@]23[C@H]4Oc5c2c(CC1[C@]3(O)Cc1c4[nH]c2ccccc12)ccc5O.Cl	InChI=1S/C26H26N2O3.ClH/c1-14(2)13-28-10-9-25-21-15-7-8-19(29)23(21)31-24(25)22-17(12-26(25,30)20(28)11-15)16-5-3-4-6-18(16)27-22;/h3-8,20,24,27,29-30H,1,9-13H2,2H3;1H/t20?,24-,25-,26+;/m0./s1	QLLCUVACGPLGAX-XXCZMEBESA-N	414.194342712							91867, 91867
3-Tropanyl-3,5-dichlorobenzoate	LSM-1871	Bemesetron	1683	InChI=1S/C15H17Cl2NO2/c1-18-12-2-3-13(18)8-14(7-12)20-15(19)9-4-10(16)6-11(17)5-9/h4-6,12-14H,2-3,7-8H2,1H3	MNJNPLVXBISNSX-UHFFFAOYSA-N	CN1C2CCC1CC(C2)OC(=O)c3cc(Cl)cc(Cl)c3	BroadT	BRD-A85587465	BRD-A85587465-001-01-7	Biomol International Inc.	NS-530	2813-N1283		CN1C2CCC1CC(C2)OC(=O)c1cc(Cl)cc(Cl)c1	InChI=1S/C15H17Cl2NO2/c1-18-12-2-3-13(18)8-14(7-12)20-15(19)9-4-10(16)6-11(17)5-9/h4-6,12-14H,2-3,7-8H2,1H3	MNJNPLVXBISNSX-UHFFFAOYSA-N	313.063634214							91931, 91931
2,4-Dichlorophenoxyacetic acid, isooctyl ester	LSM-21595	2,4-Dichlorophenoxyacetic Acid Isooctyl Ester, Caswell No. 315au, SID26747745	1487	InChI=1S/C16H22Cl2O3/c1-3-4-5-6-7-12(2)21-16(19)11-20-15-9-8-13(17)10-14(15)18/h8-10,12H,3-7,11H2,1-2H3	GJNVTNDAZUATRV-UHFFFAOYSA-N	CCCCCCC(C)OC(=O)COc1ccc(Cl)cc1Cl	BroadT	BRD-A81260764	BRD-A81260764-001-02-1	MicroSource Discovery Systems Inc.	330048			CCCCCCC(C)OC(=O)COc1ccc(Cl)cc1Cl	InChI=1S/C16H22Cl2O3/c1-3-4-5-6-7-12(2)21-16(19)11-20-15-9-8-13(17)10-14(15)18/h8-10,12H,3-7,11H2,1-2H3	GJNVTNDAZUATRV-UHFFFAOYSA-N	332.094599984							110166
Lobelanidine	LSM-1665		96946	InChI=1S/C22H29NO2/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18/h2-7,9-12,19-22,24-25H,8,13-16H2,1H3	OWGJQNXIWMMDTH-UHFFFAOYSA-N	CN1C(CC(O)c2ccccc2)CCCC1CC(O)c3ccccc3	BroadT	BRD-A59215453	BRD-A59215453-003-03-3	Prestwick Chemical Inc.	Prestw-582	D0701-MP04-ST03-200-	Cl	CN1C(CC(O)c2ccccc2)CCCC1CC(O)c1ccccc1.Cl	InChI=1S/C22H29NO2.ClH/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18;/h2-7,9-12,19-22,24-25H,8,13-16H2,1H3;1H	IDPAEJSVXMLVBS-UHFFFAOYSA-N	339.219829178							91776, 91776
Brazilin	LSM-1844	SID26749472, SID74299, SID93576884	222515	InChI=1S/C16H14O5/c17-9-1-2-10-14(4-9)21-7-16(20)6-8-3-12(18)13(19)5-11(8)15(10)16/h1-5,15,17-20H,6-7H2	UWHUTZOCTZJUKC-UHFFFAOYSA-N	Oc1ccc2C3c4cc(O)c(O)cc4CC3(O)COc2c1	BroadT	BRD-A83326220	BRD-A83326220-001-02-6	MicroSource Discovery Systems Inc.	200012			Oc1ccc2C3c4cc(O)c(O)cc4CC3(O)COc2c1	InChI=1S/C16H14O5/c17-9-1-2-10-14(4-9)21-7-16(20)6-8-3-12(18)13(19)5-11(8)15(10)16/h1-5,15,17-20H,6-7H2	UWHUTZOCTZJUKC-UHFFFAOYSA-N	286.084123548							91908
Fursultiamine	LSM-42831	Fursultiamine, Ttfd, Fursultiamine HCl	3002119	InChI=1S/C17H26N4O3S2/c1-12(16(5-6-22)26-25-10-15-4-3-7-24-15)21(11-23)9-14-8-19-13(2)20-17(14)18/h8,11,15,22H,3-7,9-10H2,1-2H3,(H2,18,19,20)/b16-12+	JTLXCMOFVBXEKD-FOWTUZBSSA-N	C\C(=C(\CCO)/SSCC1CCCO1)\N(Cc2cnc(C)nc2N)C=O	BroadT	BRD-A71157293	BRD-A71157293-003-03-5	Prestwick Chemical Inc.	Prestw-1007	D0701-MP04-ST03-200-	Cl	C\C(N(Cc1cnc(C)nc1N)C=O)=C(\CCO)SSCC1CCCO1.Cl	InChI=1S/C17H26N4O3S2.ClH/c1-12(16(5-6-22)26-25-10-15-4-3-7-24-15)21(11-23)9-14-8-19-13(2)20-17(14)18;/h8,11,15,22H,3-7,9-10H2,1-2H3,(H2,18,19,20);1H/b16-12+;	OPGOLNDOMSBSCW-CLNHMMGSSA-N	398.144632112							, 
KF 38789	LSM-1641	BRD-A54927599, SID50112985, SID7976777	6842860	InChI=1S/C19H21NO5S/c1-11-8-15(21)18(19(22)25-11)14-10-17(26-7-6-20-14)13-5-4-12(23-2)9-16(13)24-3/h4-5,8-9,17,21H,6-7,10H2,1-3H3	NHFIAAAMCYVRIW-UHFFFAOYSA-N	COc1ccc(C2CC(=NCCS2)C3=C(O)C=C(C)OC3=O)c(OC)c1	BroadT	BRD-A54927599	BRD-A54927599-001-07-8	Tocris Bioscience	2748	1		COc1ccc(C2CC(=NCCS2)c2c(O)cc(C)oc2=O)c(OC)c1	InChI=1S/C19H21NO5S/c1-11-8-15(21)18(19(22)25-11)14-10-17(26-7-6-20-14)13-5-4-12(23-2)9-16(13)24-3/h4-5,8-9,17,21H,6-7,10H2,1-3H3	NHFIAAAMCYVRIW-UHFFFAOYSA-N	375.114043472							
Gallopamil	LSM-21596	Gallopamil	1234	InChI=1S/C28H40N2O5/c1-20(2)28(19-29,22-17-25(33-6)27(35-8)26(18-22)34-7)13-9-14-30(3)15-12-21-10-11-23(31-4)24(16-21)32-5/h10-11,16-18,20H,9,12-15H2,1-8H3	XQLWNAFCTODIRK-UHFFFAOYSA-N	COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2cc(OC)c(OC)c(OC)c2)cc1OC	BroadT	BRD-A52922642	BRD-A52922642-001-02-9	Biomol International Inc.	AC-103	2840(V2)-3-N1305		COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2cc(OC)c(OC)c(OC)c2)cc1OC	InChI=1S/C28H40N2O5/c1-20(2)28(19-29,22-17-25(33-6)27(35-8)26(18-22)34-7)13-9-14-30(3)15-12-21-10-11-23(31-4)24(16-21)32-5/h10-11,16-18,20H,9,12-15H2,1-8H3	XQLWNAFCTODIRK-UHFFFAOYSA-N	484.2937224							34772, 34772
Mifobate	LSM-1761	Clenicor, Mifobate, BRD-A72066420, SR-202	60910	InChI=1S/C11H17ClO7P2/c1-15-20(13,16-2)11(19-21(14,17-3)18-4)9-5-7-10(12)8-6-9/h5-8,11H,1-4H3	VQHUQHAPWMNBLP-UHFFFAOYSA-N	COP(=O)(OC)OC(c1ccc(Cl)cc1)P(=O)(OC)OC	BroadT	BRD-A72066420	BRD-A72066420-001-01-1	Tocris Bioscience	2022	1		COP(=O)(OC)OC(c1ccc(Cl)cc1)P(=O)(OC)OC	InChI=1S/C11H17ClO7P2/c1-15-20(13,16-2)11(19-21(14,17-3)18-4)9-5-7-10(12)8-6-9/h5-8,11H,1-4H3	VQHUQHAPWMNBLP-UHFFFAOYSA-N	358.013803614							91842
C-2 Ceramide	LSM-1629	BRD-A53416814	2505	InChI=1S/C20H39NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(24)19(17-22)21-18(2)23/h15-16,19-20,22,24H,3-14,17H2,1-2H3,(H,21,23)	BLTCBVOJNNKFKC-UHFFFAOYSA-N	CCCCCCCCCCCCCC=CC(O)C(CO)NC(=O)C	BroadT	BRD-A53416814	BRD-A53416814-001-01-5	Tocris Bioscience	744	3		CCCCCCCCCCCCCC=CC(O)C(CO)NC(C)=O	InChI=1S/C20H39NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(24)19(17-22)21-18(2)23/h15-16,19-20,22,24H,3-14,17H2,1-2H3,(H,21,23)	BLTCBVOJNNKFKC-UHFFFAOYSA-N	341.292994118							91751
Chloroquine	LSM-1901	Chloroquine, Chlorochine, Aralen, NSC-187208	2719	InChI=1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21)	WHTVZRBIWZFKQO-UHFFFAOYSA-N	CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12	BroadT	BRD-A91699651	BRD-A91699651-316-04-2	MicroSource Discovery Systems Inc.	1500179		OP(=O)(O)O.OP(=O)(O)O	CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12.OP(=O)(O)O.OP(=O)(O)O	InChI=1S/C18H26ClN3.2H3O4P/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18;2*1-5(2,3)4/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21);2*(H3,1,2,3,4)	QKICWELGRMTQCR-UHFFFAOYSA-N	319.181525572							3638, 3638, 3638, 3638, 3638, 3638
Crustecdysone	LSM-21597		6708786	InChI=1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15?,17?,19-,20+,21?,22-,24-,25-,26-,27-/m1/s1	NKDFYOWSKOHCCO-QNDLOGEDSA-N	CC(C)(O)CC[C@@H](O)[C@](C)(O)C1CC[C@@]2(O)C3=CC(=O)C4C[C@@H](O)[C@@H](O)C[C@]4(C)C3CC[C@]12C	BroadT	BRD-A46778020	BRD-A46778020-001-02-6	MicroSource Discovery Systems Inc.	1504228			CC(C)(O)CC[C@@H](O)[C@](C)(O)C1CC[C@@]2(O)C3=CC(=O)C4C[C@@H](O)[C@@H](O)C[C@]4(C)C3CC[C@]12C	InChI=1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15?,17?,19-,20+,21?,22-,24-,25-,26-,27-/m1/s1	NKDFYOWSKOHCCO-QNDLOGEDSA-N	480.308703748							
Tropicamide	LSM-1814	Mydriafair, Tropicacyl, Tropicamide, Mydriacyl	5593	InChI=1S/C17H20N2O2/c1-2-19(12-14-8-10-18-11-9-14)17(21)16(13-20)15-6-4-3-5-7-15/h3-11,16,20H,2,12-13H2,1H3	BGDKAVGWHJFAGW-UHFFFAOYSA-N	CCN(Cc1ccncc1)C(=O)C(CO)c2ccccc2	BroadT	BRD-A79672927	BRD-A79672927-001-04-1	MicroSource Discovery Systems Inc.	1500599			CCN(Cc1ccncc1)C(=O)C(CO)c1ccccc1	InChI=1S/C17H20N2O2/c1-2-19(12-14-8-10-18-11-9-14)17(21)16(13-20)15-6-4-3-5-7-15/h3-11,16,20H,2,12-13H2,1H3	BGDKAVGWHJFAGW-UHFFFAOYSA-N	284.1524779							91881
Binospirone	LSM-1611	Binospirone, MDL-73005EF, MDL 73005 EF, MDL 73005EF	60769	InChI=1S/C20H26N2O4/c23-18-11-20(7-3-4-8-20)12-19(24)22(18)10-9-21-13-15-14-25-16-5-1-2-6-17(16)26-15/h1-2,5-6,15,21H,3-4,7-14H2	BVMYCHKQPGEOSI-UHFFFAOYSA-N	O=C1CC2(CCCC2)CC(=O)N1CCNCC3COc4ccccc4O3	BroadT	BRD-A50764878	BRD-A50764878-001-01-4	Biomol International Inc.	AC-531	2813-N1283		O=C1CC2(CCCC2)CC(=O)N1CCNCC1COc2ccccc2O1	InChI=1S/C20H26N2O4/c23-18-11-20(7-3-4-8-20)12-19(24)22(18)10-9-21-13-15-14-25-16-5-1-2-6-17(16)26-15/h1-2,5-6,15,21H,3-4,7-14H2	BVMYCHKQPGEOSI-UHFFFAOYSA-N	358.189257332							91740, 91740
SPECTRUM_000011	LSM-1767	Lasalocid	6708465	InChI=1S/C34H54O8/c1-9-25(31-21(6)18-34(11-3,42-31)26-16-17-33(40,10-2)23(8)41-26)30(37)22(7)28(35)19(4)12-14-24-15-13-20(5)29(36)27(24)32(38)39/h13,15,19,21-23,25-26,28,31,35-36,40H,9-12,14,16-18H2,1-8H3,(H,38,39)/t19-,21+,22?,23+,25+,26?,28+,31?,33-,34?/m1/s1	BBMULGJBVDDDNI-YFGMYPSKSA-N	CC[C@H](C1OC(CC)(C[C@@H]1C)C2CC[C@](O)(CC)[C@H](C)O2)C(=O)C(C)[C@@H](O)[C@H](C)CCc3ccc(C)c(O)c3C(=O)O	BroadT	BRD-A72711497	BRD-A72711497-236-02-0	MicroSource Discovery Systems Inc.	1503244		[Na]	CC[C@H](C1OC(CC)(C[C@@H]1C)C1CC[C@](O)(CC)[C@H](C)O1)C(=O)C(C)[C@@H](O)[C@H](C)CCc1ccc(C)c(O)c1C(O)=O.[Na]	InChI=1S/C34H54O8.Na.H/c1-9-25(31-21(6)18-34(11-3,42-31)26-16-17-33(40,10-2)23(8)41-26)30(37)22(7)28(35)19(4)12-14-24-15-13-20(5)29(36)27(24)32(38)39;;/h13,15,19,21-23,25-26,28,31,35-36,40H,9-12,14,16-18H2,1-8H3,(H,38,39);;/t19-,21+,22?,23+,25+,26?,28+,31?,33-,34?;;/m1../s1	ZBUDTVCYXSUIQF-VXPMNGCPSA-N	590.381868688							91848
CHEMBL301466	LSM-1683	BRD-A62021152, WAY-161503	3906894	InChI=1S/C11H11Cl2N3O/c12-6-3-8-9(4-7(6)13)16-2-1-14-5-10(16)11(17)15-8/h3-4,10,14H,1-2,5H2,(H,15,17)	PHGWDAICBXUJDU-UHFFFAOYSA-N	Clc1cc2NC(=O)C3CNCCN3c2cc1Cl	BroadT	BRD-A62021152	BRD-A62021152-003-01-8	Tocris Bioscience	1801	2	Cl	Clc1cc2NC(=O)C3CNCCN3c2cc1Cl.Cl	InChI=1S/C11H11Cl2N3O.ClH/c12-6-3-8-9(4-7(6)13)16-2-1-14-5-10(16)11(17)15-8;/h3-4,10,14H,1-2,5H2,(H,15,17);1H	YPNWSZJDAKOUAW-UHFFFAOYSA-N	271.027917422							91788
Bucladesine	LSM-1926	Bucladesine, Bucladesine Sodium	9687	InChI=1S/C18H24N5O8P/c1-3-5-11(24)22-16-13-17(20-8-19-16)23(9-21-13)18-15(30-12(25)6-4-2)14-10(29-18)7-28-32(26,27)31-14/h8-10,14-15,18H,3-7H2,1-2H3,(H,26,27)(H,19,20,22,24)/t10-,14-,15-,18-/m1/s1	CJGYSWNGNKCJSB-YVLZZHOMSA-N	CCCC(=O)Nc1ncnc2c1ncn2[C@@H]3O[C@@H]4COP(=O)(O)O[C@H]4[C@H]3OC(=O)CCC	BroadT	BRD-A94624445	BRD-A94624445-236-02-2	Biomol International Inc.	CN-125	2840(V2)-3-N1305	[Na]	CCCC(=O)Nc1ncnc2n(cnc12)[C@@H]1O[C@@H]2COP(O)(=O)O[C@H]2[C@H]1OC(=O)CCC.[Na]	InChI=1S/C18H24N5O8P.Na.H/c1-3-5-11(24)22-16-13-17(20-8-19-16)23(9-21-13)18-15(30-12(25)6-4-2)14-10(29-18)7-28-32(26,27)31-14;;/h8-10,14-15,18H,3-7H2,1-2H3,(H,26,27)(H,19,20,22,24);;/t10-,14-,15-,18-;;/m1../s1	DBXVIQJWMFGXGO-VMZSDVDQSA-N	469.136249288							50095, 50095, 50095
Condelphine	LSM-21598		441720	InChI=1S/C25H39NO6/c1-5-26-11-23(12-30-3)7-6-19(28)25-15-8-14-17(31-4)10-24(29,16(22(25)26)9-18(23)25)20(15)21(14)32-13(2)27/h14-22,28-29H,5-12H2,1-4H3/t14-,15-,16+,17+,18-,19+,20-,21+,22?,23+,24+,25-/m1/s1	ZEBMMHUDQRRILP-WZSMAATHSA-N	CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@@H]6[C@H](C[C@](O)([C@@H](C[C@H]23)C14)[C@H]5[C@H]6OC(=O)C)OC	BroadT	BRD-A84941884	BRD-A84941884-001-02-8	Prestwick Chemical Inc.	Prestw-1083	D0701-MP04-ST03-200-		CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](OC(C)=O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)C14	InChI=1S/C25H39NO6/c1-5-26-11-23(12-30-3)7-6-19(28)25-15-8-14-17(31-4)10-24(29,16(22(25)26)9-18(23)25)20(15)21(14)32-13(2)27/h14-22,28-29H,5-12H2,1-4H3/t14-,15-,16+,17+,18-,19+,20-,21+,22?,23+,24+,25-/m1/s1	ZEBMMHUDQRRILP-WZSMAATHSA-N	449.277737978							3852
Orphenadrine	LSM-1630	Norflex, Norgesic, Orphenadrine, Orphengesic, Invagesic, Disipal	4601	InChI=1S/C18H23NO/c1-15-9-7-8-12-17(15)18(20-14-13-19(2)3)16-10-5-4-6-11-16/h4-12,18H,13-14H2,1-3H3	QVYRGXJJSLMXQH-UHFFFAOYSA-N	CN(C)CCOC(c1ccccc1)c2ccccc2C	BroadT	BRD-A53576514	BRD-A53576514-003-03-1	Prestwick Chemical Inc.	Prestw-239	D0701-MP04-ST03-200-	Cl	CN(C)CCOC(c1ccccc1)c1ccccc1C.Cl	InChI=1S/C18H23NO.ClH/c1-15-9-7-8-12-17(15)18(20-14-13-19(2)3)16-10-5-4-6-11-16;/h4-12,18H,13-14H2,1-3H3;1H	UQZKYYIKWZOKKD-UHFFFAOYSA-N	269.177964366							7789, 7789, 7789
Diphenidine	LSM-15598	BRD-A86415025	206666	InChI=1S/C19H23N/c1-4-10-17(11-5-1)16-19(18-12-6-2-7-13-18)20-14-8-3-9-15-20/h1-2,4-7,10-13,19H,3,8-9,14-16H2	JQWJJJYHVHNXJH-UHFFFAOYSA-N	C(C(N1CCCCC1)c2ccccc2)c3ccccc3	BroadT	BRD-A86415025	BRD-A86415025-103-01-7	Tocris Bioscience	360	1	OC(=O)C=CC(=O)O	C(C(N1CCCCC1)c1ccccc1)c1ccccc1.OC(=O)C=CC(=O)O	InChI=1S/C19H23N.C4H4O4/c1-4-10-17(11-5-1)16-19(18-12-6-2-7-13-18)20-14-8-3-9-15-20;5-3(6)1-2-4(7)8/h1-2,4-7,10-13,19H,3,8-9,14-16H2;1-2H,(H,5,6)(H,7,8)	AEHZEDLXDLPQQD-UHFFFAOYSA-N	265.183049746							104234
ICI-118551	LSM-1812	BRD-A78942461, ICI-118551	3682	InChI=1S/C17H27NO2/c1-11(2)18-13(4)16(19)10-20-17-9-8-12(3)14-6-5-7-15(14)17/h8-9,11,13,16,18-19H,5-7,10H2,1-4H3	VFIDUCMKNJIJTO-UHFFFAOYSA-N	CC(C)NC(C)C(O)COc1ccc(C)c2CCCc12	BroadT	BRD-A78942461	BRD-A78942461-003-01-3	Tocris Bioscience	821	1	Cl	CC(C)NC(C)C(O)COc1ccc(C)c2CCCc12.Cl	InChI=1S/C17H27NO2.ClH/c1-11(2)18-13(4)16(19)10-20-17-9-8-12(3)14-6-5-7-15(14)17;/h8-9,11,13,16,18-19H,5-7,10H2,1-4H3;1H	KBXMBGWSOLBOQM-UHFFFAOYSA-N	277.204179114							91879, 91879
CTK8H3236	LSM-1838	BRD-A82590476	44208964	InChI=1S/C33H33N5O5/c1-36(22-23-10-3-2-4-11-23)32(40)28(21-24-17-18-25-12-5-6-13-26(25)20-24)34-31(39)30-16-9-19-37(30)33(41)35-27-14-7-8-15-29(27)38(42)43/h2-8,10-15,17-18,20,28,30H,9,16,19,21-22H2,1H3,(H,34,39)(H,35,41)	PCVSIMQAFWRUEC-UHFFFAOYSA-N	CN(Cc1ccccc1)C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C4CCCN4C(=O)Nc5ccccc5[N+](=O)[O-]	BroadT	BRD-A82590476	BRD-A82590476-001-01-1	Tocris Bioscience	2394	1		CN(Cc1ccccc1)C(=O)C(Cc1ccc2ccccc2c1)NC(=O)C1CCCN1C(=O)Nc1ccccc1[N+]([O-])=O	InChI=1S/C33H33N5O5/c1-36(22-23-10-3-2-4-11-23)32(40)28(21-24-17-18-25-12-5-6-13-26(25)20-24)34-31(39)30-16-9-19-37(30)33(41)35-27-14-7-8-15-29(27)38(42)43/h2-8,10-15,17-18,20,28,30H,9,16,19,21-22H2,1H3,(H,34,39)(H,35,41)	PCVSIMQAFWRUEC-UHFFFAOYSA-N	579.248169206							91902
L-755,507	LSM-1912	BRD-A93206962	19385000	InChI=1S/C30H40N4O6S/c1-2-3-4-5-19-32-30(37)33-24-10-16-29(17-11-24)41(38,39)34-25-8-6-23(7-9-25)18-20-31-21-27(36)22-40-28-14-12-26(35)13-15-28/h6-17,27,31,34-36H,2-5,18-22H2,1H3,(H2,32,33,37)	NYYJKMXNVNFOFQ-UHFFFAOYSA-N	CCCCCCNC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2ccc(CCNCC(O)COc3ccc(O)cc3)cc2	BroadT	BRD-A93206962	BRD-A93206962-001-01-2	Tocris Bioscience	2197	2		CCCCCCNC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(CCNCC(O)COc2ccc(O)cc2)cc1	InChI=1S/C30H40N4O6S/c1-2-3-4-5-19-32-30(37)33-24-10-16-29(17-11-24)41(38,39)34-25-8-6-23(7-9-25)18-20-31-21-27(36)22-40-28-14-12-26(35)13-15-28/h6-17,27,31,34-36H,2-5,18-22H2,1H3,(H2,32,33,37)	NYYJKMXNVNFOFQ-UHFFFAOYSA-N	584.26685573							91961
AC1L323L	LSM-15549	BRD-A51381734	133056	InChI=1S/C16H22INO/c1-2-10-18(11-4-9-17)14-8-7-13-5-3-6-16(19)15(13)12-14/h3-6,9,14,19H,2,7-8,10-12H2,1H3	QBXHUZJZYDSLRH-UHFFFAOYSA-N	CCCN(CC=CI)C1CCc2cccc(O)c2C1	BroadT	BRD-A51381734	BRD-A51381734-034-01-1	Tocris Bioscience	797	2	OC(=O)C(=O)O	CCCN(CC=CI)C1CCc2cccc(O)c2C1.OC(=O)C(=O)O	InChI=1S/C16H22INO.C2H2O4/c1-2-10-18(11-4-9-17)14-8-7-13-5-3-6-16(19)15(13)12-14;3-1(4)2(5)6/h3-6,9,14,19H,2,7-8,10-12H2,1H3;(H,3,4)(H,5,6)	XIBSIFOFYWBOAQ-UHFFFAOYSA-N	371.074607334							104185
Dipivefrin	LSM-1583	Dipivefrin, Dipivefrine, Dipivalyl Epinephrine	3105	InChI=1S/C19H29NO5/c1-18(2,3)16(22)24-14-9-8-12(13(21)11-20-7)10-15(14)25-17(23)19(4,5)6/h8-10,13,20-21H,11H2,1-7H3	OCUJLLGVOUDECM-UHFFFAOYSA-N	CNCC(O)c1ccc(OC(=O)C(C)(C)C)c(OC(=O)C(C)(C)C)c1	BroadT	BRD-A47494775	BRD-A47494775-003-03-0	Prestwick Chemical Inc.	Prestw-632	D0701-MP04-ST03-200-	Cl	CNCC(O)c1ccc(OC(=O)C(C)(C)C)c(OC(=O)C(C)(C)C)c1.Cl	InChI=1S/C19H29NO5.ClH/c1-18(2,3)16(22)24-14-9-8-12(13(21)11-20-7)10-15(14)25-17(23)19(4,5)6;/h8-10,13,20-21H,11H2,1-7H3;1H	VKFAUCPBMAGVRG-UHFFFAOYSA-N	351.204573038							4646, 4646, 4646, 4646, 4646
Articaine	LSM-1750	40 045, Articaine, Carticaine, Septocaine, HOE-045	32170	InChI=1S/C13H20N2O3S/c1-5-6-14-9(3)12(16)15-10-8(2)7-19-11(10)13(17)18-4/h7,9,14H,5-6H2,1-4H3,(H,15,16)	QTGIAADRBBLJGA-UHFFFAOYSA-N	CCCNC(C)C(=O)Nc1c(C)csc1C(=O)OC	BroadT	BRD-A70514680	BRD-A70514680-003-03-9	Prestwick Chemical Inc.	Prestw-1032	D0701-MP04-ST03-200-	Cl	CCCNC(C)C(=O)Nc1c(C)csc1C(=O)OC.Cl	InChI=1S/C13H20N2O3S.ClH/c1-5-6-14-9(3)12(16)15-10-8(2)7-19-11(10)13(17)18-4;/h7,9,14H,5-6H2,1-4H3,(H,15,16);1H	GDWDBGSWGNEMGJ-UHFFFAOYSA-N	284.11946321							91834, 91834
Catechin	LSM-1682	Cianidanol, Catechin, DL-Catechin	1203	InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2	PFTAWBLQPZVEMU-UHFFFAOYSA-N	OC1Cc2c(O)cc(O)cc2OC1c3ccc(O)c(O)c3	BroadT	BRD-A61899133	BRD-A61899133-002-02-2	Prestwick Chemical Inc.	Prestw-817	D0701-MP04-ST03-200-	O	OC1Cc2c(O)cc(O)cc2OC1c1ccc(O)c(O)c1.O	InChI=1S/C15H14O6.H2O/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7;/h1-5,13,15-20H,6H2;1H2	OFUMQWOJBVNKLR-UHFFFAOYSA-N	290.079038168							, 
AC1L9AQ9	LSM-6468	Cefadroxil	441194	InChI=1S/C16H17N3O5S/c1-7-6-25-15-11(14(22)19(15)12(7)16(23)24)18-13(21)10(17)8-2-4-9(20)5-3-8/h2-5,10-11,15,20H,6,17H2,1H3,(H,18,21)(H,23,24)/t10?,11-,15-/m1/s1	BOEGTKLJZSQCCD-HUFXEGEASA-N	CC1=C(N2[C@H](SC1)[C@H](NC(=O)C(N)c3ccc(O)cc3)C2=O)C(=O)O	BroadT	BRD-A56858165	BRD-A56858165-001-01-0	MicroSource Discovery Systems Inc.	1500163			CC1=C(N2[C@H](SC1)[C@H](NC(=O)C(N)c1ccc(O)cc1)C2=O)C(O)=O	InChI=1S/C16H17N3O5S/c1-7-6-25-15-11(14(22)19(15)12(7)16(23)24)18-13(21)10(17)8-2-4-9(20)5-3-8/h2-5,10-11,15,20H,6,17H2,1H3,(H,18,21)(H,23,24)/t10?,11-,15-/m1/s1	BOEGTKLJZSQCCD-HUFXEGEASA-N	363.088891364							95187
AC1O8PYD	LSM-1697	SID56463646, Clobetasol Propionate	6713978	InChI=1S/C25H32ClFO5/c1-5-21(31)32-25(20(30)13-26)14(2)10-18-17-7-6-15-11-16(28)8-9-22(15,3)24(17,27)19(29)12-23(18,25)4/h8-9,11,14,17-19,29H,5-7,10,12-13H2,1-4H3/t14-,17-,18-,19-,22-,23-,24-,25?/m0/s1	CBGUOGMQLZIXBE-DZLFUUCZSA-N	CCC(=O)OC1([C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)CCl	BroadT	BRD-A63894585	BRD-A63894585-001-03-4	Prestwick Chemical Inc.	Prestw-781	D0701-MP04-ST03-200-		CCC(=O)OC1([C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)CCl	InChI=1S/C25H32ClFO5/c1-5-21(31)32-25(20(30)13-26)14(2)10-18-17-7-6-15-11-16(28)8-9-22(15,3)24(17,27)19(29)12-23(18,25)4/h8-9,11,14,17-19,29H,5-7,10,12-13H2,1-4H3/t14-,17-,18-,19-,22-,23-,24-,25?/m0/s1	CBGUOGMQLZIXBE-DZLFUUCZSA-N	466.192230034							
SCHEMBL8922766	LSM-1595	IB-Meca	11957586	InChI=1S/C18H19IN6O4/c1-20-17(28)14-12(26)13(27)18(29-14)25-8-24-11-15(22-7-23-16(11)25)21-6-9-3-2-4-10(19)5-9/h2-5,7-8,12-14,18,26-27H,6H2,1H3,(H,20,28)(H,21,22,23)/t12-,13?,14+,18-/m1/s1	HUJXGQILHAUCCV-FEWYLQRLSA-N	CNC(=O)[C@H]1O[C@H](C(O)[C@H]1O)n2cnc3c(NCc4cccc(I)c4)ncnc23	BroadT	BRD-A48809242	BRD-A48809242-001-02-9	Biomol International Inc.	AC-582	2840(V2)-3-N1305		CNC(=O)[C@H]1O[C@H](C(O)[C@H]1O)n1cnc2c(NCc3cccc(I)c3)ncnc12	InChI=1S/C18H19IN6O4/c1-20-17(28)14-12(26)13(27)18(29-14)25-8-24-11-15(22-7-23-16(11)25)21-6-9-3-2-4-10(19)5-9/h2-5,7-8,12-14,18,26-27H,6H2,1H3,(H,20,28)(H,21,22,23)/t12-,13?,14+,18-/m1/s1	HUJXGQILHAUCCV-FEWYLQRLSA-N	510.051246148							91733
BSPBIO_002502	LSM-21599	11alpha-Acetoxyprogesterone	16667715	InChI=1S/C23H32O4/c1-13(24)18-7-8-19-17-6-5-15-11-16(26)9-10-22(15,3)21(17)20(27-14(2)25)12-23(18,19)4/h11,17-21H,5-10,12H2,1-4H3/t17?,18-,19?,20-,21?,22+,23-/m1/s1	IWRPVTXREVYBHT-QHXXRISESA-N	CC(=O)O[C@@H]1C[C@@]2(C)C(CC[C@@H]2C(=O)C)C3CCC4=CC(=O)CC[C@]4(C)C13	BroadT	BRD-A56884981	BRD-A56884981-001-01-8	MicroSource Discovery Systems Inc.	1505121			CC(=O)O[C@@H]1C[C@@]2(C)C(CC[C@@H]2C(C)=O)C2CCC3=CC(=O)CC[C@]3(C)C12	InChI=1S/C23H32O4/c1-13(24)18-7-8-19-17-6-5-15-11-16(26)9-10-22(15,3)21(17)20(27-14(2)25)12-23(18,19)4/h11,17-21H,5-10,12H2,1-4H3/t17?,18-,19?,20-,21?,22+,23-/m1/s1	IWRPVTXREVYBHT-QHXXRISESA-N	372.230059504							
BIO2_000040	LSM-1946	SID26756795, SID26756796, U-74389F	6610303	InChI=1S/C37H50N6O2/c1-36-13-11-27(44)23-26(36)7-8-28-29-9-10-31(37(29,2)14-12-30(28)36)32(45)25-40-19-21-42(22-20-40)34-24-33(41-15-3-4-16-41)38-35(39-34)43-17-5-6-18-43/h11-13,23-24,28-29,31H,3-10,14-22,25H2,1-2H3/t28?,29?,31-,36?,37?/m1/s1	LBGLGTAQLROFTM-PAHCNOFYSA-N	CC12CC=C3C(CCC4=CC(=O)C=CC34C)C1CC[C@@H]2C(=O)CN5CCN(CC5)c6cc(nc(n6)N7CCCC7)N8CCCC8	BroadT	BRD-A96897502	BRD-A96897502-001-02-0	Biomol International Inc.	FR-100	2840(V2)-3-N1305		CC12CC=C3C(CCC4=CC(=O)C=CC34C)C1CC[C@@H]2C(=O)CN1CCN(CC1)c1cc(nc(n1)N1CCCC1)N1CCCC1	InChI=1S/C37H50N6O2/c1-36-13-11-27(44)23-26(36)7-8-28-29-9-10-31(37(29,2)14-12-30(28)36)32(45)25-40-19-21-42(22-20-40)34-24-33(41-15-3-4-16-41)38-35(39-34)43-17-5-6-18-43/h11-13,23-24,28-29,31H,3-10,14-22,25H2,1-2H3/t28?,29?,31-,36?,37?/m1/s1	LBGLGTAQLROFTM-PAHCNOFYSA-N	610.3995249							91983
Metolazone	LSM-1680	Metolazone, Mykrox, Diulo, Zaroxolyn, SR-720-22	4170	InChI=1S/C16H16ClN3O3S/c1-9-5-3-4-6-14(9)20-10(2)19-13-8-12(17)15(24(18,22)23)7-11(13)16(20)21/h3-8,10,19H,1-2H3,(H2,18,22,23)	AQCHWTWZEMGIFD-UHFFFAOYSA-N	CC1Nc2cc(Cl)c(cc2C(=O)N1c3ccccc3C)S(=O)(=O)N	BroadT	BRD-A61793559	BRD-A61793559-001-04-0	MicroSource Discovery Systems Inc.	2300325			CC1Nc2cc(Cl)c(cc2C(=O)N1c1ccccc1C)S(N)(=O)=O	InChI=1S/C16H16ClN3O3S/c1-9-5-3-4-6-14(9)20-10(2)19-13-8-12(17)15(24(18,22)23)7-11(13)16(20)21/h3-8,10,19H,1-2H3,(H2,18,22,23)	AQCHWTWZEMGIFD-UHFFFAOYSA-N	365.060089802							64354
Albuterol	LSM-5178	Volmax, Ventolin, Salbutamol, Proventil, Duoneb, Combivent, Albuterol, Accuneb, Ventolin HFA, Proventil HFA, Proair HFA, Proventil-HFA	2083	InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3	NDAUXUAQIAJITI-UHFFFAOYSA-N	CC(C)(C)NCC(O)c1ccc(O)c(CO)c1	BroadT	BRD-A88254928	BRD-A88254928-001-04-6	Prestwick Chemical Inc.	Prestw-198	D0701-MP04-ST03-200-		CC(C)(C)NCC(O)c1ccc(O)c(CO)c1	InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3	NDAUXUAQIAJITI-UHFFFAOYSA-N	239.152143542							2549, 2549, 2549, 2549
Metrizamide	LSM-1575		443944	InChI=1S/C18H22I3N3O8/c1-5(26)22-12-9(19)8(10(20)14(11(12)21)24(3)6(2)27)17(30)23-13-16(29)15(28)7(4-25)32-18(13)31/h7,13,15-16,18,25,28-29,31H,4H2,1-3H3,(H,22,26)(H,23,30)/t7-,13-,15-,16-,18?/m1/s1	BAQCROVBDNBEEB-UBYUBLNFSA-N	CN(C(=O)C)c1c(I)c(NC(=O)C)c(I)c(C(=O)N[C@H]2C(O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1I	BroadT	BRD-A45543382	BRD-A45543382-001-02-7	Prestwick Chemical Inc.	Prestw-463	D0701-MP04-ST03-200-		CN(C(C)=O)c1c(I)c(NC(C)=O)c(I)c(C(=O)N[C@H]2C(O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1I	InChI=1S/C18H22I3N3O8/c1-5(26)22-12-9(19)8(10(20)14(11(12)21)24(3)6(2)27)17(30)23-13-16(29)15(28)7(4-25)32-18(13)31/h7,13,15-16,18,25,28-29,31H,4H2,1-3H3,(H,22,26)(H,23,30)/t7-,13-,15-,16-,18?/m1/s1	BAQCROVBDNBEEB-UBYUBLNFSA-N	788.854093694							91720
Chlorcyclizine	LSM-5088	Chlorcyclizine	2710	InChI=1S/C18H21ClN2/c1-20-11-13-21(14-12-20)18(15-5-3-2-4-6-15)16-7-9-17(19)10-8-16/h2-10,18H,11-14H2,1H3	WFNAKBGANONZEQ-UHFFFAOYSA-N	CN1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3	BroadT	BRD-A57133233	BRD-A57133233-003-03-7	Prestwick Chemical Inc.	Prestw-706	D0701-MP04-ST03-200-	Cl	CN1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1.Cl	InChI=1S/C18H21ClN2.ClH/c1-20-11-13-21(14-12-20)18(15-5-3-2-4-6-15)16-7-9-17(19)10-8-16;/h2-10,18H,11-14H2,1H3;1H	MSIJLVMSKDXAQN-UHFFFAOYSA-N	300.139326402							94402, 94402
Fordine	LSM-42822	SID29215281, Huperzine A	5912039	InChI=1S/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)/b11-3+	ZRJBHWIHUMBLCN-QDEBKDIKSA-N	C\C=C\1/C2CC3=C(C=CC(=O)N3)C1(N)CC(=C2)C	BroadT	BRD-A47065382	BRD-A47065382-001-02-9	Biomol International Inc.	C-117	2840(V2)-3-N1305		C\C=C1/C2Cc3[nH]c(=O)ccc3C1(N)CC(C)=C2	InChI=1S/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)/b11-3+	ZRJBHWIHUMBLCN-QDEBKDIKSA-N	242.141913216							
HSCI1_000121	LSM-21600	Cladribine	24167440	InChI=1S/C10H12ClN5O3/c11-10-14-8(12)7-9(15-10)16(3-13-7)6-1-4(18)5(2-17)19-6/h3-6,17-18H,1-2H2,(H2,12,14,15)/t4-,5?,6?/m1/s1	PTOAARAWEBMLNO-IISSFJTQSA-N	Nc1nc(Cl)nc2c1ncn2C3C[C@@H](O)C(CO)O3	BroadT	BRD-A89947015	BRD-A89947015-001-01-4	EMD Biosciences	220467			Nc1nc(Cl)nc2n(cnc12)C1C[C@@H](O)C(CO)O1	InChI=1S/C10H12ClN5O3/c11-10-14-8(12)7-9(15-10)16(3-13-7)6-1-4(18)5(2-17)19-6/h3-6,17-18H,1-2H2,(H2,12,14,15)/t4-,5?,6?/m1/s1	PTOAARAWEBMLNO-IISSFJTQSA-N	285.062867004							110167
Quinpirole Dihydrochloride	LSM-1868	BRD-A85280935	1257	InChI=1S/C13H21N3/c1-2-5-16-6-3-4-10-7-12-11(8-13(10)16)9-14-15-12/h9-10,13H,2-8H2,1H3,(H,14,15)	FTSUPYGMFAPCFZ-UHFFFAOYSA-N	CCCN1CCCC2Cc3n[nH]cc3CC12	BroadT	BRD-A85280935	BRD-A85280935-003-01-7	Tocris Bioscience	1061	8	Cl	CCCN1CCCC2Cc3n[nH]cc3CC12.Cl	InChI=1S/C13H21N3.ClH/c1-2-5-16-6-3-4-10-7-12-11(8-13(10)16)9-14-15-12;/h9-10,13H,2-8H2,1H3,(H,14,15);1H	HJHVRVJTYPKTHX-UHFFFAOYSA-N	219.173547702							91928, 91928
13-Methyl-7-[9-(4,4,5,5,5-pentafluoropentylsulfinyl)nonyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol	LSM-1895	BRD-A90490067	3478439	InChI=1S/C32H47F5O3S/c1-30-17-15-26-25-12-11-24(38)21-23(25)20-22(29(26)27(30)13-14-28(30)39)10-7-5-3-2-4-6-8-18-41(40)19-9-16-31(33,34)32(35,36)37/h11-12,21-22,26-29,38-39H,2-10,13-20H2,1H3	VWUXBMIQPBEWFH-UHFFFAOYSA-N	CC12CCC3C(C(CCCCCCCCCS(=O)CCCC(F)(F)C(F)(F)F)Cc4cc(O)ccc34)C1CCC2O	BroadT	BRD-A90490067	BRD-A90490067-001-01-9	Tocris Bioscience	1047	20		CC12CCC3C(C1CCC2O)C(CCCCCCCCCS(=O)CCCC(F)(F)C(F)(F)F)Cc1cc(O)ccc31	InChI=1S/C32H47F5O3S/c1-30-17-15-26-25-12-11-24(38)21-23(25)20-22(29(26)27(30)13-14-28(30)39)10-7-5-3-2-4-6-8-18-41(40)19-9-16-31(33,34)32(35,36)37/h11-12,21-22,26-29,38-39H,2-10,13-20H2,1H3	VWUXBMIQPBEWFH-UHFFFAOYSA-N	606.316607054							91951
Mephenytoin	LSM-1852	Methoin, Mesantoin, Mephenytoin	4060	InChI=1S/C12H14N2O2/c1-3-12(9-7-5-4-6-8-9)10(15)14(2)11(16)13-12/h4-8H,3H2,1-2H3,(H,13,16)	GMHKMTDVRCWUDX-UHFFFAOYSA-N	CCC1(NC(=O)N(C)C1=O)c2ccccc2	BroadT	BRD-A83937277	BRD-A83937277-001-03-0	Prestwick Chemical Inc.	Prestw-1108	D0701-MP04-ST03-200-		CCC1(NC(=O)N(C)C1=O)c1ccccc1	InChI=1S/C12H14N2O2/c1-3-12(9-7-5-4-6-8-9)10(15)14(2)11(16)13-12/h4-8H,3H2,1-2H3,(H,13,16)	GMHKMTDVRCWUDX-UHFFFAOYSA-N	218.105527708							91914
Chrysanthemic acid	LSM-21601	SID26747809, SID76632	2743	InChI=1S/C10H16O2/c1-6(2)5-7-8(9(11)12)10(7,3)4/h5,7-8H,1-4H3,(H,11,12)	XLOPRKKSAJMMEW-UHFFFAOYSA-N	CC(=CC1C(C(=O)O)C1(C)C)C	BroadT	BRD-A52893269	BRD-A52893269-001-02-4	MicroSource Discovery Systems Inc.	1504800			CC(C)=CC1C(C(O)=O)C1(C)C	InChI=1S/C10H16O2/c1-6(2)5-7-8(9(11)12)10(7,3)4/h5,7-8H,1-4H3,(H,11,12)	XLOPRKKSAJMMEW-UHFFFAOYSA-N	168.115029752							3680
SPBIO_000324	LSM-21602	8-Hydroxycarapinic Acid	6708747	InChI=1S/C26H30O8/c1-23(2)16(9-18(27)28)25(4)15-5-7-24(3)17(26(15,32)11-14(20(23)30)21(25)31)10-19(29)34-22(24)13-6-8-33-12-13/h6,8,10,12,14-16,22,32H,5,7,9,11H2,1-4H3,(H,27,28)/t14-,15?,16-,22-,24+,25+,26-/m0/s1	UKTUQKGXNWDYAI-UYFBHOMVSA-N	CC1(C)[C@H](CC(=O)O)[C@@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]3(O)C[C@@H](C1=O)C2=O)c5cocc5	BroadT	BRD-A73559168	BRD-A73559168-001-02-8	MicroSource Discovery Systems Inc.	100129			CC1(C)[C@H](CC(O)=O)[C@@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]3(O)C[C@@H](C1=O)C2=O)c1ccoc1	InChI=1S/C26H30O8/c1-23(2)16(9-18(27)28)25(4)15-5-7-24(3)17(26(15,32)11-14(20(23)30)21(25)31)10-19(29)34-22(24)13-6-8-33-12-13/h6,8,10,12,14-16,22,32H,5,7,9,11H2,1-4H3,(H,27,28)/t14-,15?,16-,22-,24+,25+,26-/m0/s1	UKTUQKGXNWDYAI-UYFBHOMVSA-N	470.19406792							
RX821002	LSM-1714	RX-821002	108094	InChI=1S/C12H14N2O3/c1-15-12(11-13-6-7-14-11)8-16-9-4-2-3-5-10(9)17-12/h2-5H,6-8H2,1H3,(H,13,14)	HQGWKNGAKBPTBX-UHFFFAOYSA-N	COC1(COc2ccccc2O1)C3=NCCN3	BroadT	BRD-A65597028	BRD-A65597028-003-02-4	Tocris Bioscience	1324	3	Cl	COC1(COc2ccccc2O1)C1=NCCN1.Cl	InChI=1S/C12H14N2O3.ClH/c1-15-12(11-13-6-7-14-11)8-16-9-4-2-3-5-10(9)17-12;/h2-5H,6-8H2,1H3,(H,13,14);1H	IMPOOMVZVWKSAP-UHFFFAOYSA-N	234.100442328							73287, 73287
Cromakalim	LSM-1794	Cromakalim, BRD-A76093993, BRL-34915	443423	InChI=1S/C16H18N2O3/c1-16(2)15(20)14(18-7-3-4-13(18)19)11-8-10(9-17)5-6-12(11)21-16/h5-6,8,14-15,20H,3-4,7H2,1-2H3	TVZCRIROJQEVOT-UHFFFAOYSA-N	CC1(C)Oc2ccc(cc2C(C1O)N3CCCC3=O)C#N	BroadT	BRD-A76093993	BRD-A76093993-001-01-8	Tocris Bioscience	1377	1		CC1(C)Oc2ccc(cc2C(C1O)N1CCCC1=O)C#N	InChI=1S/C16H18N2O3/c1-16(2)15(20)14(18-7-3-4-13(18)19)11-8-10(9-17)5-6-12(11)21-16/h5-6,8,14-15,20H,3-4,7H2,1-2H3	TVZCRIROJQEVOT-UHFFFAOYSA-N	286.131742456							3921
Naringenin	LSM-1927	SID11533047, SID26664470, SID26749980, SID26753777	932	InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2	FTVWIRXFELQLPI-UHFFFAOYSA-N	Oc1ccc(cc1)C2CC(=O)c3c(O)cc(O)cc3O2	BroadT	BRD-A94669766	BRD-A94669766-001-02-6	AnalytiCon Discovery GmbH	NP-000922			Oc1ccc(cc1)C1CC(=O)c2c(O)cc(O)cc2O1	InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2	FTVWIRXFELQLPI-UHFFFAOYSA-N	272.068473484							50202, 50202, 50202
Cloperastine	LSM-5161	Cloperastine, HT-11, Cloperastine HCl, Cloperastine Fendizoate	2805	InChI=1S/C20H24ClNO/c21-19-11-9-18(10-12-19)20(17-7-3-1-4-8-17)23-16-15-22-13-5-2-6-14-22/h1,3-4,7-12,20H,2,5-6,13-16H2	FLNXBVJLPJNOSI-UHFFFAOYSA-N	Clc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3	BroadT	BRD-A80908310	BRD-A80908310-003-04-7	MicroSource Discovery Systems Inc.	1503920		Cl	Clc1ccc(cc1)C(OCCN1CCCCC1)c1ccccc1.Cl	InChI=1S/C20H24ClNO.ClH/c21-19-11-9-18(10-12-19)20(17-7-3-1-4-8-17)23-16-15-22-13-5-2-6-14-22;/h1,3-4,7-12,20H,2,5-6,13-16H2;1H	UNPLRYRWJLTVAE-UHFFFAOYSA-N	329.154642108							94448, 94448
BIOMOL-NT_000059	LSM-1707	Dihydroergocristine	11072143	InChI=1S/C35H41N5O5/c1-20(2)34(37-31(41)23-16-25-24-11-7-12-26-30(24)22(18-36-26)17-27(25)38(3)19-23)33(43)40-28(15-21-9-5-4-6-10-21)32(42)39-14-8-13-29(39)35(40,44)45-34/h4-7,9-12,18,20,23,25,27-29,36,44H,8,13-17,19H2,1-3H3,(H,37,41)/t23-,25?,27-,28+,29+,34-,35+/m1/s1	DEQITUUQPICUMR-DLVWBKJWSA-N	CC(C)[C@@]1(NC(=O)[C@@H]2CC3[C@@H](Cc4c[nH]c5cccc3c45)N(C)C2)O[C@@]6(O)[C@@H]7CCCN7C(=O)[C@H](Cc8ccccc8)N6C1=O	BroadT	BRD-A65076780	BRD-A65076780-001-01-3	Biomol International Inc.	NS-108	2813-N1283		CC(C)[C@@]1(NC(=O)[C@@H]2CC3[C@@H](Cc4c[nH]c5cccc3c45)N(C)C2)O[C@@]2(O)[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O	InChI=1S/C35H41N5O5/c1-20(2)34(37-31(41)23-16-25-24-11-7-12-26-30(24)22(18-36-26)17-27(25)38(3)19-23)33(43)40-28(15-21-9-5-4-6-10-21)32(42)39-14-8-13-29(39)35(40,44)45-34/h4-7,9-12,18,20,23,25,27-29,36,44H,8,13-17,19H2,1-3H3,(H,37,41)/t23-,25?,27-,28+,29+,34-,35+/m1/s1	DEQITUUQPICUMR-DLVWBKJWSA-N	611.310769462							91805
AC1O9ATU	LSM-1760	Pravastatin	6728942	InChI=1S/C23H36O7/c1-4-13(2)23(29)30-20-11-17(25)9-15-6-5-14(3)19(22(15)20)8-7-16(24)10-18(26)12-21(27)28/h5-6,9,13-14,16-20,22,24-26H,4,7-8,10-12H2,1-3H3,(H,27,28)/t13?,14-,16+,17+,18+,19-,20-,22?/m0/s1	TUZYXOIXSAXUGO-XYLZAPOUSA-N	CCC(C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(=O)O)C12	BroadT	BRD-A71816415	BRD-A71816415-236-02-7	MicroSource Discovery Systems Inc.	1505803		[Na]	CCC(C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(O)=O)C12.[Na]	InChI=1S/C23H36O7.Na.H/c1-4-13(2)23(29)30-20-11-17(25)9-15-6-5-14(3)19(22(15)20)8-7-16(24)10-18(26)12-21(27)28;;/h5-6,9,13-14,16-20,22,24-26H,4,7-8,10-12H2,1-3H3,(H,27,28);;/t13?,14-,16+,17+,18+,19-,20-,22?;;/m0../s1	AOGODJAJIRDKOP-XYWHKNNFSA-N	424.246103492							91841
Nefopam	LSM-1811	Nefopam	4450	InChI=1S/C17H19NO/c1-18-11-12-19-17(14-7-3-2-4-8-14)16-10-6-5-9-15(16)13-18/h2-10,17H,11-13H2,1H3	RGPDEAGGEXEMMM-UHFFFAOYSA-N	CN1CCOC(c2ccccc2)c3ccccc3C1	BroadT	BRD-A78877355	BRD-A78877355-003-03-6	Prestwick Chemical Inc.	Prestw-229	D0701-MP04-ST03-200-	Cl	CN1CCOC(c2ccccc2)c2ccccc2C1.Cl	InChI=1S/C17H19NO.ClH/c1-18-11-12-19-17(14-7-3-2-4-8-14)16-10-6-5-9-15(16)13-18;/h2-10,17H,11-13H2,1H3;1H	CNNVSINJDJNHQK-UHFFFAOYSA-N	253.146664238							88318, 88318
Bifonazole	LSM-5184	Bifonazole, Mycospor, BAY-H-4502	2378	InChI=1S/C22H18N2/c1-3-7-18(8-4-1)19-11-13-21(14-12-19)22(24-16-15-23-17-24)20-9-5-2-6-10-20/h1-17,22H	OCAPBUJLXMYKEJ-UHFFFAOYSA-N	c1ccc(cc1)C(c2ccc(cc2)c3ccccc3)n4ccnc4	BroadT	BRD-A94543220	BRD-A94543220-001-02-3	MicroSource Discovery Systems Inc.	1505309			c1cn(cn1)C(c1ccccc1)c1ccc(cc1)-c1ccccc1	InChI=1S/C22H18N2/c1-3-7-18(8-4-1)19-11-13-21(14-12-19)22(24-16-15-23-17-24)20-9-5-2-6-10-20/h1-17,22H	OCAPBUJLXMYKEJ-UHFFFAOYSA-N	310.146998596							78692
Baclofen	LSM-5169	Lioresal, Baclofen, Kemstro, Gablofen, BA-34647	2284	InChI=1S/C10H12ClNO2/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)	KPYSYYIEGFHWSV-UHFFFAOYSA-N	NCC(CC(=O)O)c1ccc(Cl)cc1	BroadT	BRD-A84174873	BRD-A84174873-001-06-0	Prestwick Chemical Inc.	Prestw-85	D0701-MP04-ST03-200-		NCC(CC(O)=O)c1ccc(Cl)cc1	InChI=1S/C10H12ClNO2/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)	KPYSYYIEGFHWSV-UHFFFAOYSA-N	213.055656344							2972, 2972
AC1NWAPU	LSM-1690	Prednisone	5702108	InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14?,15?,18?,19-,20-,21-/m0/s1	XOFYZVNMUHMLCC-BDQMTFAOSA-N	C[C@]12CC(=O)C3C(CCC4=CC(=O)C=C[C@]34C)C1CC[C@]2(O)C(=O)CO	BroadT	BRD-A62525898	BRD-A62525898-001-02-9	MicroSource Discovery Systems Inc.	1500499			C[C@]12CC(=O)C3C(CCC4=CC(=O)C=C[C@]34C)C1CC[C@]2(O)C(=O)CO	InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14?,15?,18?,19-,20-,21-/m0/s1	XOFYZVNMUHMLCC-BDQMTFAOSA-N	358.178023932							
Furaltadone	LSM-44944	Furaltadone, Nitrofurmethone	5353635	InChI=1S/C13H16N4O6/c18-13-16(14-7-10-1-2-12(22-10)17(19)20)9-11(23-13)8-15-3-5-21-6-4-15/h1-2,7,11H,3-6,8-9H2/b14-7+	YVQVOQKFMFRVGR-VGOFMYFVSA-N	[O-][N+](=O)c1oc(\C=N\N2CC(CN3CCOCC3)OC2=O)cc1	BroadT	BRD-A67514145	BRD-A67514145-003-03-3	Prestwick Chemical Inc.	Prestw-764	D0701-MP04-ST03-200-	Cl	[O-][N+](=O)c1ccc(\C=N\N2CC(CN3CCOCC3)OC2=O)o1.Cl	InChI=1S/C13H16N4O6.ClH/c18-13-16(14-7-10-1-2-12(22-10)17(19)20)9-11(23-13)8-15-3-5-21-6-4-15;/h1-2,7,11H,3-6,8-9H2;1H/b14-7+;	PPSVFZXMDMUIGB-FJUODKGNSA-N	324.106984272							, 
PRESTWICK3_000685	LSM-1674	Nitrarine	23789069	InChI=1S/C20H25N3/c1-2-6-16-12(4-1)13-9-11-23-17-8-7-15(20(23)19(13)22-16)18-14(17)5-3-10-21-18/h1-2,4,6,14-15,17-18,20-22H,3,5,7-11H2/t14-,15?,17?,18-,20+/m0/s1	SBGPASZOVGSOFJ-ZOWGRLGGSA-N	C1CN[C@H]2[C@@H](C1)C3CCC2[C@H]4N3CCc5c4[nH]c6ccccc56	BroadT	BRD-A60583491	BRD-A60583491-300-02-7	Prestwick Chemical Inc.	Prestw-685	D0701-MP04-ST03-200-	Cl.Cl	C1CN[C@H]2[C@@H](C1)C1CCC2[C@H]2N1CCc1c2[nH]c2ccccc12.Cl.Cl	InChI=1S/C20H25N3.2ClH/c1-2-6-16-12(4-1)13-9-11-23-17-8-7-15(20(23)19(13)22-16)18-14(17)5-3-10-21-18;;/h1-2,4,6,14-15,17-18,20-22H,3,5,7-11H2;2*1H/t14-,15?,17?,18-,20+;;/m0../s1	AJFJKGLXKPEJMU-FZKHGFDQSA-N	307.20484783							91781
BRD-A57798559	LSM-15329	BRD-A57798559		InChI=1S/C21H20NO6/c1-22(2)6-5-11-7-15-16(26-9-25-15)8-13(11)18(22)19-12-3-4-14-20(27-10-24-14)17(12)21(23)28-19/h3-4,7-8,18-19H,5-6,9-10H2,1-2H3/q+1/t18?,19-/m1/s1	WDIQXKYUSINZME-MUMRKEEXSA-N	C[N+]1(C)CCc2cc3OCOc3cc2C1[C@@H]4OC(=O)c5c6OCOc6ccc45	BroadT	BRD-A57798559	BRD-A57798559-003-01-7	Tocris Bioscience	131	29	Cl	C[N+]1(C)CCc2cc3OCOc3cc2C1[C@@H]1OC(=O)c2c1ccc1OCOc21.Cl	InChI=1S/C21H20NO6.ClH/c1-22(2)6-5-11-7-15-16(26-9-25-15)8-13(11)18(22)19-12-3-4-14-20(27-10-24-14)17(12)21(23)28-19;/h3-4,7-8,18-19H,5-6,9-10H2,1-2H3;1H/q+1;/t18?,19-;/m1./s1	RLJKFAMYSYWMND-SQTGWKPBSA-N	382.12906237							103976
KBIO2_001155	LSM-21603	BRD-A77488069	6708566	InChI=1S/C21H30O3/c1-13(2)18-14-7-10-17-20(3,15(14)8-9-16(18)22)11-6-12-21(17,4)19(23)24-5/h8-9,13,17,22H,6-7,10-12H2,1-5H3/t17?,20-,21+/m1/s1	VEJJMTHWRMKGKN-SJRAPUSDSA-N	COC(=O)[C@@]1(C)CCC[C@@]2(C)C1CCc3c(C(C)C)c(O)ccc23	BroadT	BRD-A77488069	BRD-A77488069-001-02-6	MicroSource Discovery Systems Inc.	100612			COC(=O)[C@@]1(C)CCC[C@@]2(C)C1CCc1c2ccc(O)c1C(C)C	InChI=1S/C21H30O3/c1-13(2)18-14-7-10-17-20(3,15(14)8-9-16(18)22)11-6-12-21(17,4)19(23)24-5/h8-9,13,17,22H,6-7,10-12H2,1-5H3/t17?,20-,21+/m1/s1	VEJJMTHWRMKGKN-SJRAPUSDSA-N	330.21949482							110168
SKF-83566	LSM-1623	SK&F-83566, SK-83566	1243	InChI=1S/C17H18BrNO/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12/h2-6,9-10,15,20H,7-8,11H2,1H3	XFTVOHWWEQGXLS-UHFFFAOYSA-N	CN1CCc2cc(Br)c(O)cc2C(C1)c3ccccc3	BroadT	BRD-A52588987	BRD-A52588987-004-04-1	Tocris Bioscience	1586	4	Br	CN1CCc2cc(Br)c(O)cc2C(C1)c1ccccc1.Br	InChI=1S/C17H18BrNO.BrH/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12;/h2-6,9-10,15,20H,7-8,11H2,1H3;1H	SDQJYYGODYRPBR-UHFFFAOYSA-N	331.057176806							91747, 91747
AC1L99UL	LSM-1831	BRD-A81795050	415541	InChI=1S/C25H41NO2/c1-5-26(6-2)15-16-28-19-11-13-24(3)18(17-19)7-8-20-21-9-10-23(27)25(21,4)14-12-22(20)24/h7,19-22H,5-6,8-17H2,1-4H3	DMZCCFMMPHJWQY-UHFFFAOYSA-N	CCN(CC)CCOC1CCC2(C)C3CCC4(C)C(CCC4=O)C3CC=C2C1	BroadT	BRD-A81795050	BRD-A81795050-003-01-7	Tocris Bioscience	1638	1	Cl	CCN(CC)CCOC1CCC2(C)C3CCC4(C)C(CCC4=O)C3CC=C2C1.Cl	InChI=1S/C25H41NO2.ClH/c1-5-26(6-2)15-16-28-19-11-13-24(3)18(17-19)7-8-20-21-9-10-23(27)25(21,4)14-12-22(20)24;/h7,19-22H,5-6,8-17H2,1-4H3;1H	GZFYZYBWLCYBMI-UHFFFAOYSA-N	387.313729562							91895
PRESTWICK0_001107	LSM-1717	Ramipril, SID56463183	6714009	InChI=1S/C23H32N2O5/c1-3-30-23(29)18(13-12-16-8-5-4-6-9-16)24-15(2)21(26)25-19-11-7-10-17(19)14-20(25)22(27)28/h4-6,8-9,15,17-20,24H,3,7,10-14H2,1-2H3,(H,27,28)/t15-,17-,18-,19-,20?/m0/s1	HDACQVRGBOVJII-QJUJLUFUSA-N	CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N2[C@H]3CCC[C@H]3CC2C(=O)O	BroadT	BRD-A65739223	BRD-A65739223-001-03-7	Prestwick Chemical Inc.	Prestw-1107	D0701-MP04-ST03-200-		CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1[C@H]2CCC[C@H]2CC1C(O)=O	InChI=1S/C23H32N2O5/c1-3-30-23(29)18(13-12-16-8-5-4-6-9-16)24-15(2)21(26)25-19-11-7-10-17(19)14-20(25)22(27)28/h4-6,8-9,15,17-20,24H,3,7,10-14H2,1-2H3,(H,27,28)/t15-,17-,18-,19-,20?/m0/s1	HDACQVRGBOVJII-QJUJLUFUSA-N	416.231122144							91811
Eliprodil	LSM-1677	Eliprodil, BRD-A61392169	60703	InChI=1S/C20H23ClFNO/c21-18-5-3-17(4-6-18)20(24)14-23-11-9-16(10-12-23)13-15-1-7-19(22)8-2-15/h1-8,16,20,24H,9-14H2	GGUSQTSTQSHJAH-UHFFFAOYSA-N	OC(CN1CCC(Cc2ccc(F)cc2)CC1)c3ccc(Cl)cc3	BroadT	BRD-A61392169	BRD-A61392169-001-01-9	Tocris Bioscience	2195	1		OC(CN1CCC(Cc2ccc(F)cc2)CC1)c1ccc(Cl)cc1	InChI=1S/C20H23ClFNO/c21-18-5-3-17(4-6-18)20(24)14-23-11-9-16(10-12-23)13-15-1-7-19(22)8-2-15/h1-8,16,20,24H,9-14H2	GGUSQTSTQSHJAH-UHFFFAOYSA-N	347.145220276							91784
Tocainide	LSM-1909	Tocainide, W-36095	38945	InChI=1S/C11H16N2O/c1-7-5-4-6-8(2)10(7)13-11(14)9(3)12/h4-6,9H,12H2,1-3H3,(H,13,14)	BUJAGSGYPOAWEI-UHFFFAOYSA-N	CC(N)C(=O)Nc1c(C)cccc1C	BroadT	BRD-A92670106	BRD-A92670106-003-03-9	Prestwick Chemical Inc.	Prestw-1027	D0701-MP04-ST03-200-	Cl	CC(N)C(=O)Nc1c(C)cccc1C.Cl	InChI=1S/C11H16N2O.ClH/c1-7-5-4-6-8(2)10(7)13-11(14)9(3)12;/h4-6,9H,12H2,1-3H3,(H,13,14);1H	AMZACPWEJDQXGW-UHFFFAOYSA-N	192.126263152							9611, 9611
2'-Meccpa	LSM-21604	BRD-A60877539	44292754	InChI=1S/C16H22ClN5O4/c1-16(25)11(24)9(6-23)26-14(16)22-7-18-10-12(19-8-4-2-3-5-8)20-15(17)21-13(10)22/h7-9,11,14,23-25H,2-6H2,1H3,(H,19,20,21)	MMPAUXMIDJWGFO-UHFFFAOYSA-N	CC1(O)C(O)C(CO)OC1n2cnc3c(NC4CCCC4)nc(Cl)nc23	BroadT	BRD-A60877539	BRD-A60877539-001-01-3	Tocris Bioscience	2281	1		CC1(O)C(O)C(CO)OC1n1cnc2c(NC3CCCC3)nc(Cl)nc12	InChI=1S/C16H22ClN5O4/c1-16(25)11(24)9(6-23)26-14(16)22-7-18-10-12(19-8-4-2-3-5-8)20-15(17)21-13(10)22/h7-9,11,14,23-25H,2-6H2,1H3,(H,19,20,21)	MMPAUXMIDJWGFO-UHFFFAOYSA-N	383.136031944							110169
H7	LSM-5082	H-7, SID855933, SID90341587	3542	InChI=1S/C14H17N3O2S/c1-11-9-16-7-8-17(11)20(18,19)14-4-2-3-12-10-15-6-5-13(12)14/h2-6,10-11,16H,7-9H2,1H3	BDVFVCGFMNCYPV-UHFFFAOYSA-N	CC1CNCCN1S(=O)(=O)c2cccc3cnccc23	BroadT	BRD-A55756846	BRD-A55756846-001-05-5	Biomol International Inc.	EI-148	2840(V2)-3-N1305		CC1CNCCN1S(=O)(=O)c1cccc2cnccc12	InChI=1S/C14H17N3O2S/c1-11-9-16-7-8-17(11)20(18,19)14-4-2-3-12-10-15-6-5-13(12)14/h2-6,10-11,16H,7-9H2,1H3	BDVFVCGFMNCYPV-UHFFFAOYSA-N	291.104147504							43385, 83438, 83438, 43385, 83438, 43385
Salsoline	LSM-21605	SID26749332	46695	InChI=1S/C11H15NO2/c1-7-9-6-11(14-2)10(13)5-8(9)3-4-12-7/h5-7,12-13H,3-4H2,1-2H3	YTPRLBGPGZHUPD-UHFFFAOYSA-N	COc1cc2C(C)NCCc2cc1O	BroadT	BRD-A48323445	BRD-A48323445-001-02-6	MicroSource Discovery Systems Inc.	1504025			COc1cc2C(C)NCCc2cc1O	InChI=1S/C11H15NO2/c1-7-9-6-11(14-2)10(13)5-8(9)3-4-12-7/h5-7,12-13H,3-4H2,1-2H3	YTPRLBGPGZHUPD-UHFFFAOYSA-N	193.11027873							110170
5-Hydroxyiminoisocaryophyllene	LSM-45097	SID26749586	6392934	InChI=1S/C15H23NO/c1-10-6-8-14(16-17)11(2)5-7-13-12(10)9-15(13,3)4/h12-13,17H,1-2,5-9H2,3-4H3/b16-14-	LAVOESILOACOFW-PEZBUJJGSA-N	CC1(C)CC2C1CCC(=C)\C(=N/O)\CCC2=C	BroadT	BRD-A64957606	BRD-A64957606-001-02-5	MicroSource Discovery Systems Inc.	300049			CC1(C)CC2C1CCC(=C)\C(CCC2=C)=N/O	InChI=1S/C15H23NO/c1-10-6-8-14(16-17)11(2)5-7-13-12(10)9-15(13,3)4/h12-13,17H,1-2,5-9H2,3-4H3/b16-14-	LAVOESILOACOFW-PEZBUJJGSA-N	233.177964366							
Secnidazole	LSM-5131	Secnidazole, RP-14539, PM-185184	71815	InChI=1S/C7H11N3O3/c1-5(11)4-9-6(2)8-3-7(9)10(12)13/h3,5,11H,4H2,1-2H3	KPQZUUQMTUIKBP-UHFFFAOYSA-N	CC(O)Cn1c(C)ncc1[N+](=O)[O-]	BroadT	BRD-A70083328	BRD-A70083328-001-02-9	MicroSource Discovery Systems Inc.	1505304			CC(O)Cn1c(C)ncc1[N+]([O-])=O	InChI=1S/C7H11N3O3/c1-5(11)4-9-6(2)8-3-7(9)10(12)13/h3,5,11H,4H2,1-2H3	KPQZUUQMTUIKBP-UHFFFAOYSA-N	185.080041242							94433
Naltrindole	LSM-1839	BRD-A82656074	4430	InChI=1S/C26H26N2O3/c29-19-8-7-15-11-20-26(30)12-17-16-3-1-2-4-18(16)27-22(17)24-25(26,21(15)23(19)31-24)9-10-28(20)13-14-5-6-14/h1-4,7-8,14,20,24,27,29-30H,5-6,9-13H2	WIYUZYBFCWCCQJ-UHFFFAOYSA-N	Oc1ccc2CC3N(CC4CC4)CCC56C(Oc1c25)c7[nH]c8ccccc8c7CC36O	BroadT	BRD-A82656074	BRD-A82656074-003-01-2	Tocris Bioscience	740	9	Cl	Oc1ccc2CC3N(CC4CC4)CCC45C(Oc1c24)c1[nH]c2ccccc2c1CC35O.Cl	InChI=1S/C26H26N2O3.ClH/c29-19-8-7-15-11-20-26(30)12-17-16-3-1-2-4-18(16)27-22(17)24-25(26,21(15)23(19)31-24)9-10-28(20)13-14-5-6-14;/h1-4,7-8,14,20,24,27,29-30H,5-6,9-13H2;1H	KNJKRQXCFJCQHC-UHFFFAOYSA-N	414.194342712							91903
5'-N-ethylcarboxamidoadenosine	LSM-21607	5-N-Ethylcarboxamidoadenosine	11957539	InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7?,8+,12-/m1/s1	JADDQZYHOWSFJD-RWFUBLIZSA-N	CCNC(=O)[C@H]1O[C@H](C(O)[C@H]1O)n2cnc3c(N)ncnc23	BroadT	BRD-A57536034	BRD-A57536034-001-02-8	Biomol International Inc.	AC601	2840(V2)-3-N1305		CCNC(=O)[C@H]1O[C@H](C(O)[C@H]1O)n1cnc2c(N)ncnc12	InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7?,8+,12-/m1/s1	JADDQZYHOWSFJD-RWFUBLIZSA-N	308.123303052							110172
ICI 192,605	LSM-1887	BRD-A89208012	4330476	InChI=1S/C22H23ClO5/c23-18-11-6-4-9-16(18)22-27-14-15(8-2-1-3-13-20(25)26)21(28-22)17-10-5-7-12-19(17)24/h1-2,4-7,9-12,15,21-22,24H,3,8,13-14H2,(H,25,26)	WHUIENZXNGAHQI-UHFFFAOYSA-N	OC(=O)CCC=CCC1COC(OC1c2ccccc2O)c3ccccc3Cl	BroadT	BRD-A89208012	BRD-A89208012-001-01-4	Tocris Bioscience	837	2		OC(=O)CCC=CCC1COC(OC1c1ccccc1O)c1ccccc1Cl	InChI=1S/C22H23ClO5/c23-18-11-6-4-9-16(18)22-27-14-15(8-2-1-3-13-20(25)26)21(28-22)17-10-5-7-12-19(17)24/h1-2,4-7,9-12,15,21-22,24H,3,8,13-14H2,(H,25,26)	WHUIENZXNGAHQI-UHFFFAOYSA-N	402.123401546							91944
HSCI1_000279	LSM-21608	BRD-A63759745	23863209	InChI=1S/C10H13N5O2/c1-5-6(16)2-7(17-5)15-4-14-8-9(11)12-3-13-10(8)15/h3-7,16H,2H2,1H3,(H2,11,12,13)/t5?,6-,7?/m1/s1	FFHPXOJTVQDVMO-YURFNIAASA-N	CC1OC(C[C@H]1O)n2cnc3c(N)ncnc23	BroadT	BRD-A63759745	BRD-A63759745-001-01-0	Calbiochem	288104			CC1OC(C[C@H]1O)n1cnc2c(N)ncnc12	InChI=1S/C10H13N5O2/c1-5-6(16)2-7(17-5)15-4-14-8-9(11)12-3-13-10(8)15/h3-7,16H,2H2,1H3,(H2,11,12,13)/t5?,6-,7?/m1/s1	FFHPXOJTVQDVMO-YURFNIAASA-N	235.106924706							110173
SKF96365	LSM-1766	SKF-96365, SK&F-96365, SK-96365, BRD-A72703248	104956	InChI=1S/C22H26N2O3/c1-25-20-9-5-18(6-10-20)4-3-15-27-22(16-24-14-13-23-17-24)19-7-11-21(26-2)12-8-19/h5-14,17,22H,3-4,15-16H2,1-2H3	HLMBXBGDBBCYII-UHFFFAOYSA-N	COc1ccc(CCCOC(Cn2ccnc2)c3ccc(OC)cc3)cc1	BroadT	BRD-A72703248	BRD-A72703248-001-02-7	Biomol International Inc.	CA-230	2840(V2)-3-N1305		COc1ccc(CCCOC(Cn2ccnc2)c2ccc(OC)cc2)cc1	InChI=1S/C22H26N2O3/c1-25-20-9-5-18(6-10-20)4-3-15-27-22(16-24-14-13-23-17-24)19-7-11-21(26-2)12-8-19/h5-14,17,22H,3-4,15-16H2,1-2H3	HLMBXBGDBBCYII-UHFFFAOYSA-N	366.194342712							91847, 91847
CHEMBL81330	LSM-1931	BRD-A95096829, PNU-96415E	9909648	InChI=1S/C21H25FN2O/c22-18-5-7-19(8-6-18)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-25-21/h1-8,21H,9-16H2	UKOCGOXTVCIACM-UHFFFAOYSA-N	Fc1ccc(cc1)N2CCN(CCC3OCCc4ccccc34)CC2	BroadT	BRD-A95096829	BRD-A95096829-300-01-4	Biomol International Inc.	AC-1358	2812-3-N1298	Cl.Cl	Fc1ccc(cc1)N1CCN(CCC2OCCc3ccccc23)CC1.Cl.Cl	InChI=1S/C21H25FN2O.2ClH/c22-18-5-7-19(8-6-18)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-25-21;;/h1-8,21H,9-16H2;2*1H	OGMGYKPECFQXJJ-UHFFFAOYSA-N	340.19509164							91973
Minocycline	LSM-15330		54575046	InChI=1S/C23H27N3O7/c1-25(2)12-5-6-13(27)15-10(12)7-9-8-11-17(26(3)4)19(29)16(22(24)32)21(31)23(11,33)20(30)14(9)18(15)28/h5-6,9,11,14,16-17,27,33H,7-8H2,1-4H3,(H2,24,32)/t9-,11-,14?,16?,17-,23-/m0/s1	ZZZRUAITSXLWBH-CSYJEMQYSA-N	CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(ccc(O)c4C(=O)C3C(=O)[C@]2(O)C(=O)C(C(=O)N)C1=O)N(C)C	BroadT	BRD-A69651145	BRD-A69651145-003-03-1	MicroSource Discovery Systems Inc.	1500414		Cl	CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(ccc(O)c4C(=O)C3C(=O)[C@]2(O)C(=O)C(C(N)=O)C1=O)N(C)C.Cl	InChI=1S/C23H27N3O7.ClH/c1-25(2)12-5-6-13(27)15-10(12)7-9-8-11-17(26(3)4)19(29)16(22(24)32)21(31)23(11,33)20(30)14(9)18(15)28;/h5-6,9,11,14,16-17,27,33H,7-8H2,1-4H3,(H2,24,32);1H/t9-,11-,14?,16?,17-,23-;/m0./s1	BMVXJFPUXYXFRZ-IRZJJIRCSA-N	457.184900234							
BRD-A72596465	LSM-1765		44483340	InChI=1S/C35H36F3N3O5/c1-4-44-34(43)39-22-29(40-23(2)20-32(42)26-12-14-28(15-13-26)35(36,37)38)21-25-10-16-30(17-11-25)45-19-18-31-24(3)46-33(41-31)27-8-6-5-7-9-27/h5-17,20,29,40H,4,18-19,21-22H2,1-3H3,(H,39,43)	UEPVEQWUZJXOKB-UHFFFAOYSA-N	CCOC(=O)NCC(Cc1ccc(OCCc2nc(oc2C)c3ccccc3)cc1)NC(=CC(=O)c4ccc(cc4)C(F)(F)F)C	BroadT	BRD-A72596465	BRD-A72596465-001-01-3	Tocris Bioscience	2271	1		CCOC(=O)NCC(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1)NC(C)=CC(=O)c1ccc(cc1)C(F)(F)F	InChI=1S/C35H36F3N3O5/c1-4-44-34(43)39-22-29(40-23(2)20-32(42)26-12-14-28(15-13-26)35(36,37)38)21-25-10-16-30(17-11-25)45-19-18-31-24(3)46-33(41-31)27-8-6-5-7-9-27/h5-17,20,29,40H,4,18-19,21-22H2,1-3H3,(H,39,43)	UEPVEQWUZJXOKB-UHFFFAOYSA-N	635.260705882							91846
Isradipine	LSM-1897	Isradipine, Dynacirc, Isrodipine, PN-200-110, Dynacirc CR	3784	InChI=1S/C19H21N3O5/c1-9(2)26-19(24)15-11(4)20-10(3)14(18(23)25-5)16(15)12-7-6-8-13-17(12)22-27-21-13/h6-9,16,20H,1-5H3	HMJIYCCIJYRONP-UHFFFAOYSA-N	COC(=O)C1=C(C)NC(=C(C1c2cccc3nonc23)C(=O)OC(C)C)C	BroadT	BRD-A90799790	BRD-A90799790-001-04-1	Tocris Bioscience	2004	1		COC(=O)C1=C(C)NC(C)=C(C1c1cccc2nonc12)C(=O)OC(C)C	InChI=1S/C19H21N3O5/c1-9(2)26-19(24)15-11(4)20-10(3)14(18(23)25-5)16(15)12-7-6-8-13-17(12)22-27-21-13/h6-9,16,20H,1-5H3	HMJIYCCIJYRONP-UHFFFAOYSA-N	371.148120802							91953
Spiroxatrine	LSM-1764	Spiroxamide, Spiroxatrine, R-5188	5268	InChI=1S/C22H25N3O3/c26-21-22(25(16-23-21)17-6-2-1-3-7-17)10-12-24(13-11-22)14-18-15-27-19-8-4-5-9-20(19)28-18/h1-9,18H,10-16H2,(H,23,26)	JVGBTTIJPBFLTE-UHFFFAOYSA-N	O=C1NCN(c2ccccc2)C13CCN(CC4COc5ccccc5O4)CC3	BroadT	BRD-A72483914	BRD-A72483914-001-01-1	Biomol International Inc.	NS-830	2813-N1283		O=C1NCN(c2ccccc2)C11CCN(CC2COc3ccccc3O2)CC1	InChI=1S/C22H25N3O3/c26-21-22(25(16-23-21)17-6-2-1-3-7-17)10-12-24(13-11-22)14-18-15-27-19-8-4-5-9-20(19)28-18/h1-9,18H,10-16H2,(H,23,26)	JVGBTTIJPBFLTE-UHFFFAOYSA-N	379.18959169							91845, 91845
8-OH-DPAT	LSM-21609	8-Hydroxy-2-(Di-N-Propylamino)Tetralin	1220	InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3	ASXGJMSKWNBENU-UHFFFAOYSA-N	CCCN(CCC)C1CCc2cccc(O)c2C1	BroadT	BRD-A48015106	BRD-A48015106-001-01-0	Biomol International Inc.	NS-150	2813-N1283		CCCN(CCC)C1CCc2cccc(O)c2C1	InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3	ASXGJMSKWNBENU-UHFFFAOYSA-N	247.19361443							73364, 73364, 73364
Hyoscyamine	LSM-1806	Hyoscyamine		InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14?,15-,16-/m1/s1	RKUNBYITZUJHSG-QGAIPKOMSA-N	CN1[C@@H]2CCC1C[C@@H](C2)OC(=O)[C@H](CO)c3ccccc3	BroadT	BRD-A78303415	BRD-A78303415-001-02-7	MicroSource Discovery Systems Inc.	1500346			CN1C2CC[C@@H]1C[C@H](C2)OC(=O)[C@H](CO)c1ccccc1	InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14?,15-,16-/m1/s1	RKUNBYITZUJHSG-QGAIPKOMSA-N	289.167793606							
[5-(6-Amino-9H-purin-9-yl)tetrahydrofuran-2-yl]methanol	LSM-21610	BRD-A50913845, SID402653	263976	InChI=1S/C10H13N5O2/c11-9-8-10(13-4-12-9)15(5-14-8)7-2-1-6(3-16)17-7/h4-7,16H,1-3H2,(H2,11,12,13)	WVXRAFOPTSTNLL-UHFFFAOYSA-N	Nc1ncnc2c1ncn2C3CCC(CO)O3	BroadT	BRD-A50913845	BRD-A50913845-001-01-7	Calbiochem	288103			Nc1ncnc2n(cnc12)C1CCC(CO)O1	InChI=1S/C10H13N5O2/c11-9-8-10(13-4-12-9)15(5-14-8)7-2-1-6(3-16)17-7/h4-7,16H,1-3H2,(H2,11,12,13)	WVXRAFOPTSTNLL-UHFFFAOYSA-N	235.106924706							110174
NCGC00166323-01	LSM-6478	Trifluridine	6708818	InChI=1S/C10H11F3N2O5/c11-10(12,13)4-2-15(9(19)14-8(4)18)7-1-5(17)6(3-16)20-7/h2,5-7,16-17H,1,3H2,(H,14,18,19)/t5-,6+,7?/m0/s1	VSQQQLOSPVPRAZ-GFCOJPQKSA-N	OC[C@H]1OC(C[C@@H]1O)N2C=C(C(=O)NC2=O)C(F)(F)F	BroadT	BRD-A64485570	BRD-A64485570-001-02-9	MicroSource Discovery Systems Inc.	1504183			OC[C@H]1OC(C[C@@H]1O)n1cc(c(=O)[nH]c1=O)C(F)(F)F	InChI=1S/C10H11F3N2O5/c11-10(12,13)4-2-15(9(19)14-8(4)18)7-1-5(17)6(3-16)20-7/h2,5-7,16-17H,1,3H2,(H,14,18,19)/t5-,6+,7?/m0/s1	VSQQQLOSPVPRAZ-GFCOJPQKSA-N	296.062006072							95193
Mexicanolide	LSM-21611		6708581	InChI=1S/C27H32O7/c1-25(2)19(12-20(28)32-5)27(4)17-6-8-26(3)18(15(17)10-16(22(25)30)23(27)31)11-21(29)34-24(26)14-7-9-33-13-14/h7,9,13,16-17,19,24H,6,8,10-12H2,1-5H3/t16-,17?,19-,24-,26+,27+/m0/s1	DNFJSIPZGYBGON-UOJRNWJQSA-N	COC(=O)C[C@H]1C(C)(C)C(=O)[C@@H]2CC3=C4CC(=O)O[C@@H](c5cocc5)[C@]4(C)CCC3[C@@]1(C)C2=O	BroadT	BRD-A64523751	BRD-A64523751-001-02-8	MicroSource Discovery Systems Inc.	100060			COC(=O)C[C@H]1C(C)(C)C(=O)[C@@H]2CC3=C4CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CCC3[C@@]1(C)C2=O	InChI=1S/C27H32O7/c1-25(2)19(12-20(28)32-5)27(4)17-6-8-26(3)18(15(17)10-16(22(25)30)23(27)31)11-21(29)34-24(26)14-7-9-33-13-14/h7,9,13,16-17,19,24H,6,8,10-12H2,1-5H3/t16-,17?,19-,24-,26+,27+/m0/s1	DNFJSIPZGYBGON-UOJRNWJQSA-N	468.214803364							
AC1NDE46	LSM-1631	BRD-A54029483	4574540	InChI=1S/C36H35N3O4/c1-23-17-24(2)19-28(18-23)35(41)39(3)33(20-25-13-15-27(16-14-25)26-9-5-4-6-10-26)34(40)38-32(36(42)43)21-29-22-37-31-12-8-7-11-30(29)31/h4-19,22,32-33,37H,20-21H2,1-3H3,(H,38,40)(H,42,43)	UZDORQWMYRRLQV-UHFFFAOYSA-N	CN(C(Cc1ccc(cc1)c2ccccc2)C(=O)NC(Cc3c[nH]c4ccccc34)C(=O)O)C(=O)c5cc(C)cc(C)c5	BroadT	BRD-A54029483	BRD-A54029483-001-01-5	Tocris Bioscience	1838	1		CN(C(Cc1ccc(cc1)-c1ccccc1)C(=O)NC(Cc1c[nH]c2ccccc12)C(O)=O)C(=O)c1cc(C)cc(C)c1	InChI=1S/C36H35N3O4/c1-23-17-24(2)19-28(18-23)35(41)39(3)33(20-25-13-15-27(16-14-25)26-9-5-4-6-10-26)34(40)38-32(36(42)43)21-29-22-37-31-12-8-7-11-30(29)31/h4-19,22,32-33,37H,20-21H2,1-3H3,(H,38,40)(H,42,43)	UZDORQWMYRRLQV-UHFFFAOYSA-N	573.26275663							91752
BSPBIO_001542	LSM-42823	SID26756812, SID26756813, Calyculin A	16760037	InChI=1S/C50H81N4O15P/c1-29(20-22-51)16-14-17-30(2)32(4)24-33(5)42(57)35(7)38(55)25-41(65-13)45-46(69-70(61,62)63)49(8,9)50(68-45)26-39(56)34(6)40(67-50)19-15-18-36-27-66-48(53-36)31(3)21-23-52-47(60)44(59)43(58)37(28-64-12)54(10)11/h14-18,20,24,27,31,33-35,37-46,55-59H,19,21,23,25-26,28H2,1-13H3,(H,52,60)(H2,61,62,63)/b16-14+,18-15+,29-20-,30-17+,32-24+/t31-,33+,34-,35-,37-,38-,39+,40-,41-,42+,43-,44-,45?,46-,50?/m1/s1	FKAWLXNLHHIHLA-OQLQHIBWSA-N	COC[C@H]([C@@H](O)[C@@H](O)C(=O)NCC[C@@H](C)c1occ(\C=C\C[C@H]2OC3(C[C@H](O)[C@H]2C)OC([C@@H](C[C@@H](O)[C@@H](C)[C@@H](O)[C@@H](C)\C=C(/C)\C(=C\C=C\C(=C/C#N)\C)\C)OC)[C@@H](OP(=O)(O)O)C3(C)C)n1)N(C)C	BroadT	BRD-A47513740	BRD-A47513740-001-02-5	Biomol International Inc.	EI192	2840(V2)-3-N1305		COC[C@H]([C@@H](O)[C@@H](O)C(=O)NCC[C@@H](C)c1nc(\C=C\C[C@H]2OC3(C[C@H](O)[C@H]2C)OC([C@@H](C[C@@H](O)[C@@H](C)[C@@H](O)[C@@H](C)\C=C(C)\C(C)=C\C=C\C(C)=C/C#N)OC)[C@@H](OP(O)(O)=O)C3(C)C)co1)N(C)C	InChI=1S/C50H81N4O15P/c1-29(20-22-51)16-14-17-30(2)32(4)24-33(5)42(57)35(7)38(55)25-41(65-13)45-46(69-70(61,62)63)49(8,9)50(68-45)26-39(56)34(6)40(67-50)19-15-18-36-27-66-48(53-36)31(3)21-23-52-47(60)44(59)43(58)37(28-64-12)54(10)11/h14-18,20,24,27,31,33-35,37-46,55-59H,19,21,23,25-26,28H2,1-13H3,(H,52,60)(H2,61,62,63)/b16-14+,18-15+,29-20-,30-17+,32-24+/t31-,33+,34-,35-,37-,38-,39+,40-,41-,42+,43-,44-,45?,46-,50?/m1/s1	FKAWLXNLHHIHLA-OQLQHIBWSA-N	1008.543604442							
BDBM79205	LSM-1571	Meclocycline	44634699	InChI=1S/C22H21ClN2O8/c1-6-9-7(23)4-5-8(26)11(9)16(27)12-10(6)17(28)14-15(25(2)3)18(29)13(21(24)32)20(31)22(14,33)19(12)30/h4-5,10,12-15,17,26,28,33H,1H2,2-3H3,(H2,24,32)/t10?,12?,13?,14-,15+,17+,22+/m1/s1	YKYBWGJKLYMCFI-SKNFAPOLSA-N	CN(C)[C@H]1[C@@H]2[C@@H](O)C3C(C(=O)c4c(O)ccc(Cl)c4C3=C)C(=O)[C@]2(O)C(=O)C(C(=O)N)C1=O	BroadT	BRD-A45140972	BRD-A45140972-060-02-4	Prestwick Chemical Inc.	Prestw-456	D0701-MP04-ST03-200-	OC(=O)c1cc(ccc1O)S(=O)(=O)O	CN(C)[C@H]1[C@@H]2[C@@H](O)C3C(C(=O)c4c(O)ccc(Cl)c4C3=C)C(=O)[C@]2(O)C(=O)C(C(N)=O)C1=O.OC(=O)c1cc(ccc1O)S(=O)(=O)O	InChI=1S/C22H21ClN2O8.C7H6O6S/c1-6-9-7(23)4-5-8(26)11(9)16(27)12-10(6)17(28)14-15(25(2)3)18(29)13(21(24)32)20(31)22(14,33)19(12)30;8-6-2-1-4(14(11,12)13)3-5(6)7(9)10/h4-5,10,12-15,17,26,28,33H,1H2,2-3H3,(H2,24,32);1-3,8H,(H,9,10)(H,11,12,13)/t10?,12?,13?,14-,15+,17+,22+;/m1./s1	YQMRHKPQEPFLOG-QBVOUROCSA-N	476.098643362							91717
Terbutaline	LSM-5065	Brethaire, Brethine, Bricanyl, Terbutaline	5403	InChI=1S/C12H19NO3/c1-12(2,3)13-7-11(16)8-4-9(14)6-10(15)5-8/h4-6,11,13-16H,7H2,1-3H3	XWTYSIMOBUGWOL-UHFFFAOYSA-N	CC(C)(C)NCC(O)c1cc(O)cc(O)c1	BroadT	BRD-A50157456	BRD-A50157456-065-02-4	MicroSource Discovery Systems Inc.	1500558		OS(=O)(=O)O	CC(C)(C)NCC(O)c1cc(O)cc(O)c1.OS(=O)(=O)O	InChI=1S/C12H19NO3.H2O4S/c1-12(2,3)13-7-11(16)8-4-9(14)6-10(15)5-8;1-5(2,3)4/h4-6,11,13-16H,7H2,1-3H3;(H2,1,2,3,4)	MUPQZWGSBCWCAV-UHFFFAOYSA-N	225.136493478							9449, 9449, 9449
Isoconazole	LSM-6515	Isoconazole, R-15454 [AS NITRATE SALT], Isoconazole Nitrate	3760	InChI=1S/C18H14Cl4N2O/c19-12-4-5-13(17(22)8-12)18(9-24-7-6-23-11-24)25-10-14-15(20)2-1-3-16(14)21/h1-8,11,18H,9-10H2	MPIPASJGOJYODL-UHFFFAOYSA-N	Clc1ccc(C(Cn2ccnc2)OCc3c(Cl)cccc3Cl)c(Cl)c1	BroadT	BRD-A93353767	BRD-A93353767-001-03-5	Prestwick Chemical Inc.	Prestw-127	D0701-MP04-ST03-200-		Clc1ccc(C(Cn2ccnc2)OCc2c(Cl)cccc2Cl)c(Cl)c1	InChI=1S/C18H14Cl4N2O/c19-12-4-5-13(17(22)8-12)18(9-24-7-6-23-11-24)25-10-14-15(20)2-1-3-16(14)21/h1-8,11,18H,9-10H2	MPIPASJGOJYODL-UHFFFAOYSA-N	413.986023928							83667
1,2Alpha-epoxy-7-deacetoxy-7-oxodihydrogedunin	LSM-21612	BRD-A86550573	23847178	InChI=1S/C26H30O7/c1-22(2)14-10-15(27)25(5)13(24(14,4)19-16(31-19)17(22)28)6-8-23(3)18(12-7-9-30-11-12)32-21(29)20-26(23,25)33-20/h7,9,11,13-14,16,18-20H,6,8,10H2,1-5H3/t13?,14?,16-,18-,19-,20+,23-,24+,25-,26+/m0/s1	QIAYKQSCKSMIJW-FAZBILBSSA-N	CC1(C)C2CC(=O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@@]345)c6cocc6)[C@@]2(C)[C@H]7O[C@H]7C1=O	BroadT	BRD-A86550573	BRD-A86550573-001-01-3	MicroSource Discovery Systems Inc.	100368			CC1(C)C2CC(=O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@@]345)c3ccoc3)[C@@]2(C)[C@H]2O[C@H]2C1=O	InChI=1S/C26H30O7/c1-22(2)14-10-15(27)25(5)13(24(14,4)19-16(31-19)17(22)28)6-8-23(3)18(12-7-9-30-11-12)32-21(29)20-26(23,25)33-20/h7,9,11,13-14,16,18-20H,6,8,10H2,1-5H3/t13?,14?,16-,18-,19-,20+,23-,24+,25-,26+/m0/s1	QIAYKQSCKSMIJW-FAZBILBSSA-N	454.1991533							
Lufenuron	LSM-21613	Lufenuron	71777	InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)	PWPJGUXAGUPAHP-UHFFFAOYSA-N	FC(C(F)(F)F)C(F)(F)Oc1cc(Cl)c(NC(=O)NC(=O)c2c(F)cccc2F)cc1Cl	BroadT	BRD-A71774530	BRD-A71774530-001-01-8	MicroSource Discovery Systems Inc.	1505355			FC(C(F)(F)F)C(F)(F)Oc1cc(Cl)c(NC(=O)NC(=O)c2c(F)cccc2F)cc1Cl	InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)	PWPJGUXAGUPAHP-UHFFFAOYSA-N	509.978423156							39384
CHEBI:82814	LSM-1744	Diltiazem	3076	InChI=1S/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3	HSUGRBWQSSZJOP-UHFFFAOYSA-N	COc1ccc(cc1)C2Sc3ccccc3N(CCN(C)C)C(=O)C2OC(=O)C	BroadT	BRD-A69636825	BRD-A69636825-003-02-1	MicroSource Discovery Systems Inc.	2300214		Cl	COc1ccc(cc1)C1Sc2ccccc2N(CCN(C)C)C(=O)C1OC(C)=O.Cl	InChI=1S/C22H26N2O4S.ClH/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3;/h5-12,20-21H,13-14H2,1-4H3;1H	HDRXZJPWHTXQRI-UHFFFAOYSA-N	414.161328022							82814, 82814
SDZ-201106	LSM-21614	SDZ-201106	5190	InChI=1S/C29H30N4O2/c30-19-24-18-26-27(31-24)12-7-13-28(26)35-21-25(34)20-32-14-16-33(17-15-32)29(22-8-3-1-4-9-22)23-10-5-2-6-11-23/h1-13,18,25,29,31,34H,14-17,20-21H2	BYBYHCOEAFHGJL-UHFFFAOYSA-N	OC(COc1cccc2[nH]c(cc12)C#N)CN3CCN(CC3)C(c4ccccc4)c5ccccc5	BroadT	BRD-A64553394	BRD-A64553394-001-02-8	Biomol International Inc.	NA-116	2840(V2)-3-N1305		OC(COc1cccc2[nH]c(cc12)C#N)CN1CCN(CC1)C(c1ccccc1)c1ccccc1	InChI=1S/C29H30N4O2/c30-19-24-18-26-27(31-24)12-7-13-28(26)35-21-25(34)20-32-14-16-33(17-15-32)29(22-8-3-1-4-9-22)23-10-5-2-6-11-23/h1-13,18,25,29,31,34H,14-17,20-21H2	BYBYHCOEAFHGJL-UHFFFAOYSA-N	466.23687624							110175
AF-DX 384	LSM-21615	BRD-A93436351, AF-DX-384	119357	InChI=1S/C27H38N6O2/c1-3-16-31(17-4-2)20-21-10-7-8-18-32(21)19-15-29-27(35)33-24-13-6-5-11-22(24)26(34)30-23-12-9-14-28-25(23)33/h5-6,9,11-14,21H,3-4,7-8,10,15-20H2,1-2H3,(H,29,35)(H,30,34)	MZDYABXXPZNUCT-UHFFFAOYSA-N	CCCN(CCC)CC1CCCCN1CCNC(=O)N2c3ccccc3C(=O)Nc4cccnc24	BroadT	BRD-A93436351	BRD-A93436351-001-01-4	Tocris Bioscience	1345	2		CCCN(CCC)CC1CCCCN1CCNC(=O)N1c2ccccc2C(=O)Nc2cccnc12	InChI=1S/C27H38N6O2/c1-3-16-31(17-4-2)20-21-10-7-8-18-32(21)19-15-29-27(35)33-24-13-6-5-11-22(24)26(34)30-23-12-9-14-28-25(23)33/h5-6,9,11-14,21H,3-4,7-8,10,15-20H2,1-2H3,(H,29,35)(H,30,34)	MZDYABXXPZNUCT-UHFFFAOYSA-N	478.305624516							110176, 110176
Cytisine	LSM-6464		6708720	InChI=1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2/t8-,9?/m1/s1	ANJTVLIZGCUXLD-VEDVMXKPSA-N	O=C1C=CC=C2C3CNC[C@@H](C3)CN12	BroadT	BRD-A55579717	BRD-A55579717-001-02-4	MicroSource Discovery Systems Inc.	1504027			O=c1cccc2C3CNC[C@@H](C3)Cn12	InChI=1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2/t8-,9?/m1/s1	ANJTVLIZGCUXLD-VEDVMXKPSA-N	190.110613088							95183
STK009254	LSM-1910	Lupanine	6708718	InChI=1S/C15H24N2O/c18-15-6-3-5-14-11-8-12(10-17(14)15)13-4-1-2-7-16(13)9-11/h11-14H,1-10H2/t11?,12?,13-,14?/m0/s1	JYIJIIVLEOETIQ-RFPFOJJUSA-N	O=C1CCCC2C3CC(CN12)[C@@H]4CCCCN4C3	BroadT	BRD-A92826379	BRD-A92826379-009-02-6	MicroSource Discovery Systems Inc.	1505242		OCl(=O)(=O)=O	O=C1CCCC2C3CC(CN12)[C@@H]1CCCCN1C3.OCl(=O)(=O)=O	InChI=1S/C15H24N2O.ClHO4/c18-15-6-3-5-14-11-8-12(10-17(14)15)13-4-1-2-7-16(13)9-11;2-1(3,4)5/h11-14H,1-10H2;(H,2,3,4,5)/t11?,12?,13-,14?;/m0./s1	DVZQTPMQQXAHSQ-CEAFXYPISA-N	248.188863408							91960
AC1NWAJC	LSM-43967	SID26749941, Vulpinic Acid	5701993	InChI=1S/C19H14O5/c1-23-18(21)15(13-10-6-3-7-11-13)17-16(20)14(19(22)24-17)12-8-4-2-5-9-12/h2-11,14H,1H3/b17-15-	JOFTYVPERBCMPJ-ICFOKQHNSA-N	COC(=O)\C(=C\1/OC(=O)C(C1=O)c2ccccc2)\c3ccccc3	BroadT	BRD-A89237309	BRD-A89237309-001-02-3	MicroSource Discovery Systems Inc.	300146			COC(=O)C(\c1ccccc1)=C1/OC(=O)C(C1=O)c1ccccc1	InChI=1S/C19H14O5/c1-23-18(21)15(13-10-6-3-7-11-13)17-16(20)14(19(22)24-17)12-8-4-2-5-9-12/h2-11,14H,1H3/b17-15-	JOFTYVPERBCMPJ-ICFOKQHNSA-N	322.084123548							
Tropisetron	LSM-5617	BRD-A79226577	656665	InChI=1S/C17H20N2O2/c1-19-11-6-7-12(19)9-13(8-11)21-17(20)15-10-18-16-5-3-2-4-14(15)16/h2-5,10-13,18H,6-9H2,1H3/t11-,12+,13?	ZNRGQMMCGHDTEI-FUNVUKJBSA-N	CN1[C@H]2CC[C@@H]1CC(C2)OC(=O)c3c[nH]c4ccccc34	BroadT	BRD-A79226577	BRD-A79226577-003-01-1	Prestwick Chemical Inc.	Prestw-461	D0701-MP04-ST03-200-	Cl	CN1[C@H]2CC[C@@H]1CC(C2)OC(=O)C1C=Nc2ccccc12.Cl	InChI=1S/C17H20N2O2.ClH/c1-19-11-6-7-12(19)9-13(8-11)21-17(20)15-10-18-16-5-3-2-4-14(15)16;/h2-5,10-13,15H,6-9H2,1H3;1H/t11-,12+,13?,15?;	ZAOQBEAHJFSJLY-NBVCILBMSA-N	284.1524779							94647
Althiazide	LSM-1654	Altizide, Althiazide, P-1779	2122	InChI=1S/C11H14ClN3O4S3/c1-2-3-20-6-11-14-8-4-7(12)9(21(13,16)17)5-10(8)22(18,19)15-11/h2,4-5,11,14-15H,1,3,6H2,(H2,13,16,17)	VGLGVJVUHYTIIU-UHFFFAOYSA-N	NS(=O)(=O)c1cc2c(NC(CSCC=C)NS2(=O)=O)cc1Cl	BroadT	BRD-A56675431	BRD-A56675431-001-04-0	Prestwick Chemical Inc.	Prestw-721	D0701-MP04-ST03-200-		NS(=O)(=O)c1cc2c(NC(CSCC=C)NS2(=O)=O)cc1Cl	InChI=1S/C11H14ClN3O4S3/c1-2-3-20-6-11-14-8-4-7(12)9(21(13,16)17)5-10(8)22(18,19)15-11/h2,4-5,11,14-15H,1,3,6H2,(H2,13,16,17)	VGLGVJVUHYTIIU-UHFFFAOYSA-N	382.983495738							91768
N6-Cyclopentyladenosine	LSM-1867	BRD-A85234536, SID46500424	4402	InChI=1S/C15H21N5O4/c21-5-9-11(22)12(23)15(24-9)20-7-18-10-13(16-6-17-14(10)20)19-8-3-1-2-4-8/h6-9,11-12,15,21-23H,1-5H2,(H,16,17,19)	SQMWSBKSHWARHU-UHFFFAOYSA-N	OCC1OC(C(O)C1O)n2cnc3c(NC4CCCC4)ncnc23	BroadT	BRD-A85234536	BRD-A85234536-001-04-5	Tocris Bioscience	1702	1		OCC1OC(C(O)C1O)n1cnc2c(NC3CCCC3)ncnc12	InChI=1S/C15H21N5O4/c21-5-9-11(22)12(23)15(24-9)20-7-18-10-13(16-6-17-14(10)20)19-8-3-1-2-4-8/h6-9,11-12,15,21-23H,1-5H2,(H,16,17,19)	SQMWSBKSHWARHU-UHFFFAOYSA-N	335.159354202							91927
Prilocaine	LSM-5078	Prilocaine, Citanest	4906	InChI=1S/C13H20N2O/c1-4-9-14-11(3)13(16)15-12-8-6-5-7-10(12)2/h5-8,11,14H,4,9H2,1-3H3,(H,15,16)	MVFGUOIZUNYYSO-UHFFFAOYSA-N	CCCNC(C)C(=O)Nc1ccccc1C	BroadT	BRD-A53952395	BRD-A53952395-003-04-6	MicroSource Discovery Systems Inc.	1503270		Cl	CCCNC(C)C(=O)Nc1ccccc1C.Cl	InChI=1S/C13H20N2O.ClH/c1-4-9-14-11(3)13(16)15-12-8-6-5-7-10(12)2;/h5-8,11,14H,4,9H2,1-3H3,(H,15,16);1H	BJPJNTKRKALCPP-UHFFFAOYSA-N	220.15756328							8404, 8404
PRESTWICK3_000689	LSM-1944	Ungerine	23760135	InChI=1S/C18H19NO5/c1-19-4-3-9-5-14(21-2)17-15(16(9)19)10-6-12-13(23-8-22-12)7-11(10)18(20)24-17/h5-7,14-17H,3-4,8H2,1-2H3/t14-,15?,16+,17+/m0/s1	DITOENWBJBNZSL-ORBLICNNSA-N	CO[C@H]1C=C2CCN(C)[C@H]2C3[C@@H]1OC(=O)c4cc5OCOc5cc34	BroadT	BRD-A96820077	BRD-A96820077-008-02-2	Prestwick Chemical Inc.	Prestw-689	D0701-MP04-ST03-200-	O[N+](=O)[O-]	CO[C@H]1C=C2CCN(C)[C@H]2C2[C@@H]1OC(=O)c1cc3OCOc3cc21.O[N+](=O)[O-]	InChI=1S/C18H19NO5.HNO3/c1-19-4-3-9-5-14(21-2)17-15(16(9)19)10-6-12-13(23-8-22-12)7-11(10)18(20)24-17;2-1(3)4/h5-7,14-17H,3-4,8H2,1-2H3;(H,2,3,4)/t14-,15?,16+,17+;/m0./s1	PSCZYIVKEHPWIP-KGUHFNSXSA-N	329.126322718							91981, 91981
IN1092	LSM-1739	BRD-A68929948, SID50112942	2956	InChI=1S/C23H26F2N2O4/c1-14(26-19(28)12-15-10-17(24)13-18(25)11-15)21(29)27-20(16-8-6-5-7-9-16)22(30)31-23(2,3)4/h5-11,13-14,20H,12H2,1-4H3,(H,26,28)(H,27,29)	DWJXYEABWRJFSP-UHFFFAOYSA-N	CC(NC(=O)Cc1cc(F)cc(F)c1)C(=O)NC(C(=O)OC(C)(C)C)c2ccccc2	BroadT	BRD-A68929948	BRD-A68929948-001-01-9	Tocris Bioscience	2634	1		CC(NC(=O)Cc1cc(F)cc(F)c1)C(=O)NC(C(=O)OC(C)(C)C)c1ccccc1	InChI=1S/C23H26F2N2O4/c1-14(26-19(28)12-15-10-17(24)13-18(25)11-15)21(29)27-20(16-8-6-5-7-9-16)22(30)31-23(2,3)4/h5-11,13-14,20H,12H2,1-4H3,(H,26,28)(H,27,29)	DWJXYEABWRJFSP-UHFFFAOYSA-N	432.186063732							91825
Lomefloxacin	LSM-5145	Maxaquin, Lomefloxacin, SC-47111A	3948	InChI=1S/C17H19F2N3O3/c1-3-21-8-11(17(24)25)16(23)10-6-12(18)15(13(19)14(10)21)22-5-4-20-9(2)7-22/h6,8-9,20H,3-5,7H2,1-2H3,(H,24,25)	ZEKZLJVOYLTDKK-UHFFFAOYSA-N	CCN1C=C(C(=O)O)C(=O)c2cc(F)c(N3CCNC(C)C3)c(F)c12	BroadT	BRD-A75850590	BRD-A75850590-003-04-9	MicroSource Discovery Systems Inc.	1502037		Cl	CCn1cc(C(O)=O)c(=O)c2cc(F)c(N3CCNC(C)C3)c(F)c12.Cl	InChI=1S/C17H19F2N3O3.ClH/c1-3-21-8-11(17(24)25)16(23)10-6-12(18)15(13(19)14(10)21)22-5-4-20-9(2)7-22;/h6,8-9,20H,3-5,7H2,1-2H3,(H,24,25);1H	KXEBLAPZMOQCKO-UHFFFAOYSA-N	351.139447898							116278, 116278, 116278
ST005177	LSM-1604	Foliosidine, SID26753576, SID50106299, SID56463579	2837663	InChI=1S/C16H21NO5/c1-16(2,20)13(18)9-22-11-7-5-6-10-12(21-4)8-14(19)17(3)15(10)11/h5-8,13,18,20H,9H2,1-4H3	IUPYLWAXGAJZQC-UHFFFAOYSA-N	COC1=CC(=O)N(C)c2c(OCC(O)C(C)(C)O)cccc12	BroadT	BRD-A49734948	BRD-A49734948-001-03-3	Prestwick Chemical Inc.	Prestw-667	D0701-MP04-ST03-200-		COc1cc(=O)n(C)c2c(OCC(O)C(C)(C)O)cccc12	InChI=1S/C16H21NO5/c1-16(2,20)13(18)9-22-11-7-5-6-10-12(21-4)8-14(19)17(3)15(10)11/h5-8,13,18,20H,9H2,1-4H3	IUPYLWAXGAJZQC-UHFFFAOYSA-N	307.141972782							91737
Cilastatin	LSM-1894	BRD-A90311807	104867	InChI=1S/C16H26N2O5S/c1-16(2)8-10(16)13(19)18-12(15(22)23)6-4-3-5-7-24-9-11(17)14(20)21/h6,10-11H,3-5,7-9,17H2,1-2H3,(H,18,19)(H,20,21)(H,22,23)	DHSUYTOATWAVLW-UHFFFAOYSA-N	CC1(C)CC1C(=O)NC(=CCCCCSCC(N)C(=O)O)C(=O)O	BroadT	BRD-A90311807	BRD-A90311807-236-01-4	Tocris Bioscience	2709	1	[Na]	CC1(C)CC1C(=O)NC(=CCCCCSCC(N)C(O)=O)C(O)=O.[Na]	InChI=1S/C16H26N2O5S.Na.H/c1-16(2)8-10(16)13(19)18-12(15(22)23)6-4-3-5-7-24-9-11(17)14(20)21;;/h6,10-11H,3-5,7-9,17H2,1-2H3,(H,18,19)(H,20,21)(H,22,23);;	XZZZVRIASMNPEN-UHFFFAOYSA-N	358.156242642							91950
Brompheniramine	LSM-1736	Bpn, Bromfed, Bromfenex, Brompheniramine, Dimetane, Dimetapp, Lodrane	6834	InChI=1S/C16H19BrN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3	ZDIGNSYAACHWNL-UHFFFAOYSA-N	CN(C)CCC(c1ccc(Br)cc1)c2ccccn2	BroadT	BRD-A68723818	BRD-A68723818-050-04-4	MicroSource Discovery Systems Inc.	1503985		OC(=O)/C=C\C(=O)O	CN(C)CCC(c1ccc(Br)cc1)c1ccccn1.OC(=O)/C=C\C(=O)O	InChI=1S/C16H19BrN2.C4H4O4/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13;5-3(6)1-2-4(7)8/h3-9,11,15H,10,12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-	SRGKFVAASLQVBO-BTJKTKAUSA-N	318.073161228							3183, 3183
Glycodeoxycholic acid	LSM-1775	Glycodesoxycholic Acid	3493	InChI=1S/C26H43NO5/c1-15(4-9-23(30)27-14-24(31)32)19-7-8-20-18-6-5-16-12-17(28)10-11-25(16,2)21(18)13-22(29)26(19,20)3/h15-22,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32)	WVULKSPCQVQLCU-UHFFFAOYSA-N	CC(CCC(=O)NCC(=O)O)C1CCC2C3CCC4CC(O)CCC4(C)C3CC(O)C12C	BroadT	BRD-A73859745	BRD-A73859745-236-01-8	EMD Biosciences	361311		[Na]	CC(CCC(=O)NCC(O)=O)C1CCC2C3CCC4CC(O)CCC4(C)C3CC(O)C12C.[Na]	InChI=1S/C26H43NO5.Na.H/c1-15(4-9-23(30)27-14-24(31)32)19-7-8-20-18-6-5-16-12-17(28)10-11-25(16,2)21(18)13-22(29)26(19,20)3;;/h15-22,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32);;	BMYWWGPEKRLDGW-UHFFFAOYSA-N	449.314123486							91852
Gliclazide	LSM-5096	Gliclazide, SE-1702	3475	InChI=1S/C15H21N3O3S/c1-11-5-7-14(8-6-11)22(20,21)17-15(19)16-18-9-12-3-2-4-13(12)10-18/h5-8,12-13H,2-4,9-10H2,1H3,(H2,16,17,19)	BOVGTQGAOIONJV-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NC(=O)NN2CC3CCCC3C2	BroadT	BRD-A61154809	BRD-A61154809-001-03-5	MicroSource Discovery Systems Inc.	1504145			Cc1ccc(cc1)S(=O)(=O)NC(=O)NN1CC2CCCC2C1	InChI=1S/C15H21N3O3S/c1-11-5-7-14(8-6-11)22(20,21)17-15(19)16-18-9-12-3-2-4-13(12)10-18/h5-8,12-13H,2-4,9-10H2,1H3,(H2,16,17,19)	BOVGTQGAOIONJV-UHFFFAOYSA-N	323.130362252							31654
Nimodipine	LSM-1659	Nimodipine, Nimotop, BAY-E-9736	4497	InChI=1S/C21H26N2O7/c1-12(2)30-21(25)18-14(4)22-13(3)17(20(24)29-10-9-28-5)19(18)15-7-6-8-16(11-15)23(26)27/h6-8,11-12,19,22H,9-10H2,1-5H3	UIAGMCDKSXEBJQ-UHFFFAOYSA-N	COCCOC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC(C)C)C	BroadT	BRD-A58048407	BRD-A58048407-001-06-3	Biomol International Inc.	CA-211	2840(V2)-3-N1305		COCCOC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC(C)C	InChI=1S/C21H26N2O7/c1-12(2)30-21(25)18-14(4)22-13(3)17(20(24)29-10-9-28-5)19(18)15-7-6-8-16(11-15)23(26)27/h6-8,11-12,19,22H,9-10H2,1-5H3	UIAGMCDKSXEBJQ-UHFFFAOYSA-N	418.174001192							7575
Pirlindole	LSM-1636	Pirlindole, Pirazidol	68802	InChI=1S/C15H18N2/c1-10-5-6-14-12(9-10)11-3-2-4-13-15(11)17(14)8-7-16-13/h5-6,9,13,16H,2-4,7-8H2,1H3	IWVRVEIKCBFZNF-UHFFFAOYSA-N	Cc1ccc2c(c1)c3CCCC4NCCn2c34	BroadT	BRD-A54490543	BRD-A54490543-066-04-4	Tocris Bioscience	724	1	CS(=O)(=O)O	Cc1ccc2n3CCNC4CCCc(c34)c2c1.CS(=O)(=O)O	InChI=1S/C15H18N2.CH4O3S/c1-10-5-6-14-12(9-10)11-3-2-4-13-15(11)17(14)8-7-16-13;1-5(2,3)4/h5-6,9,13,16H,2-4,7-8H2,1H3;1H3,(H,2,3,4)	PVUYTBQAVAYLDE-UHFFFAOYSA-N	226.146998596							91755, 91755, 91755
145040-37-5	LSM-1716	Candesartan, Candesartan Cilextil	2540	InChI=1S/C33H34N6O6/c1-3-42-32-34-28-15-9-14-27(31(40)43-21(2)44-33(41)45-24-10-5-4-6-11-24)29(28)39(32)20-22-16-18-23(19-17-22)25-12-7-8-13-26(25)30-35-37-38-36-30/h7-9,12-19,21,24H,3-6,10-11,20H2,1-2H3,(H,35,36,37,38)	GHOSNRCGJFBJIB-UHFFFAOYSA-N	CCOc1nc2cccc(C(=O)OC(C)OC(=O)OC3CCCCC3)c2n1Cc4ccc(cc4)c5ccccc5c6nnn[nH]6	BroadT	BRD-A65671304	BRD-A65671304-001-02-6	MicroSource Discovery Systems Inc.	1504261			CCOc1nc2cccc(C(=O)OC(C)OC(=O)OC3CCCCC3)c2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1	InChI=1S/C33H34N6O6/c1-3-42-32-34-28-15-9-14-27(31(40)43-21(2)44-33(41)45-24-10-5-4-6-11-24)29(28)39(32)20-22-16-18-23(19-17-22)25-12-7-8-13-26(25)30-35-37-38-36-30/h7-9,12-19,21,24H,3-6,10-11,20H2,1-2H3,(H,35,36,37,38)	GHOSNRCGJFBJIB-UHFFFAOYSA-N	610.253982868							3348
Siguazodan	LSM-1686	Siguazodan, SKF-94836, BRD-A91992993	72124	InChI=1S/C14H16N6O/c1-9-7-12(21)19-20-13(9)10-3-5-11(6-4-10)18-14(16-2)17-8-15/h3-6,9H,7H2,1-2H3,(H,19,21)(H2,16,17,18)	NUHPODZZKHQQET-UHFFFAOYSA-N	CN\C(=N/c1ccc(cc1)C2=NNC(=O)CC2C)\NC#N	BroadT	BRD-A91992993	BRD-A91992993-001-01-2	Tocris Bioscience	1148	1		CNC(NC#N)=Nc1ccc(cc1)C1=NNC(=O)CC1C	InChI=1S/C14H16N6O/c1-9-7-12(21)19-20-13(9)10-3-5-11(6-4-10)18-14(16-2)17-8-15/h3-6,9H,7H2,1-2H3,(H,19,21)(H2,16,17,18)	NUHPODZZKHQQET-UHFFFAOYSA-N	284.138559192							91791
Chromanol 293B	LSM-1847	BRD-A83695761	656731	InChI=1S/C15H20N2O4S/c1-5-22(19,20)17(4)13-11-8-10(9-16)6-7-12(11)21-15(2,3)14(13)18/h6-8,13-14,18H,5H2,1-4H3	HVSJHHXUORMCGK-UHFFFAOYSA-N	CCS(=O)(=O)N(C)C1C(O)C(C)(C)Oc2ccc(cc12)C#N	BroadT	BRD-A83695761	BRD-A83695761-001-01-1	Tocris Bioscience	1412	1		CCS(=O)(=O)N(C)C1C(O)C(C)(C)Oc2ccc(cc12)C#N	InChI=1S/C15H20N2O4S/c1-5-22(19,20)17(4)13-11-8-10(9-16)6-7-12(11)21-15(2,3)14(13)18/h6-8,13-14,18H,5H2,1-4H3	HVSJHHXUORMCGK-UHFFFAOYSA-N	324.11437783							34781
1-[[4-(Dimethylamino)-3-methylphenyl]methyl]-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid	LSM-1696	BRD-A63836183	4701	InChI=1S/C31H32N4O3/c1-21-16-22(14-15-26(21)33(2)3)18-34-20-32-25-19-35(28(31(37)38)17-27(25)34)30(36)29(23-10-6-4-7-11-23)24-12-8-5-9-13-24/h4-16,20,28-29H,17-19H2,1-3H3,(H,37,38)	YSTVFDAKLDMYCR-UHFFFAOYSA-N	CN(C)c1ccc(Cn2cnc3CN(C(Cc23)C(=O)O)C(=O)C(c4ccccc4)c5ccccc5)cc1C	BroadT	BRD-A63836183	BRD-A63836183-362-01-1	Tocris Bioscience	1361	2	OC(=O)C(F)(F)F.OC(=O)C(F)(F)F	CN(C)c1ccc(Cn2cnc3CN(C(Cc23)C(O)=O)C(=O)C(c2ccccc2)c2ccccc2)cc1C.OC(=O)C(F)(F)F.OC(=O)C(F)(F)F	InChI=1S/C31H32N4O3.2C2HF3O2/c1-21-16-22(14-15-26(21)33(2)3)18-34-20-32-25-19-35(28(31(37)38)17-27(25)34)30(36)29(23-10-6-4-7-11-23)24-12-8-5-9-13-24;2*3-2(4,5)1(6)7/h4-16,20,28-29H,17-19H2,1-3H3,(H,37,38);2*(H,6,7)	GPKQIEZLHVGJQH-UHFFFAOYSA-N	508.247440924							91799
Nemonapride	LSM-1726	Emonapride, Nemonapride, BRD-A66927094	4452	InChI=1S/C21H26ClN3O2/c1-14-18(9-10-25(14)13-15-7-5-4-6-8-15)24-21(26)16-11-17(22)19(23-2)12-20(16)27-3/h4-8,11-12,14,18,23H,9-10,13H2,1-3H3,(H,24,26)	KRVOJOCLBAAKSJ-UHFFFAOYSA-N	CNc1cc(OC)c(cc1Cl)C(=O)NC2CCN(Cc3ccccc3)C2C	BroadT	BRD-A66927094	BRD-A66927094-001-01-7	Tocris Bioscience	1746	1		CNc1cc(OC)c(cc1Cl)C(=O)NC1CCN(Cc2ccccc2)C1C	InChI=1S/C21H26ClN3O2/c1-14-18(9-10-25(14)13-15-7-5-4-6-8-15)24-21(26)16-11-17(22)19(23-2)12-20(16)27-3/h4-8,11-12,14,18,23H,9-10,13H2,1-3H3,(H,24,26)	KRVOJOCLBAAKSJ-UHFFFAOYSA-N	387.171354812							64217
Homatropine	LSM-1782	Homatropine Hydrobromide	5282593	InChI=1S/C16H21NO3/c1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11/h2-6,12-15,18H,7-10H2,1H3/t12-,13+,14?,15?	ZTVIKZXZYLEVOL-DGKWVBSXSA-N	CN1[C@H]2CC[C@@H]1CC(C2)OC(=O)C(O)c3ccccc3	BroadT	BRD-A74975734	BRD-A74975734-001-01-2	AnalytiCon Discovery GmbH	NP-010659			CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(O)c1ccccc1	InChI=1S/C16H21NO3/c1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11/h2-6,12-15,18H,7-10H2,1H3/t12-,13+,14+,15?	ZTVIKZXZYLEVOL-MCOXGKPRSA-N	275.152143542							91858
Methylpromazine	LSM-1599	Alimemazine, Trimeprazine, Methylpromazine, Temaril	5574	InChI=1S/C18H22N2S/c1-14(12-19(2)3)13-20-15-8-4-6-10-17(15)21-18-11-7-5-9-16(18)20/h4-11,14H,12-13H2,1-3H3	ZZHLYYDVIOPZBE-UHFFFAOYSA-N	CC(CN(C)C)CN1c2ccccc2Sc3ccccc13	BroadT	BRD-A49225603	BRD-A49225603-045-02-7	MicroSource Discovery Systems Inc.	1500593		OC(C(O)C(=O)O)C(=O)O	CC(CN(C)C)CN1c2ccccc2Sc2ccccc12.OC(C(O)C(=O)O)C(=O)O	InChI=1S/C18H22N2S.C4H6O6/c1-14(12-19(2)3)13-20-15-8-4-6-10-17(15)21-18-11-7-5-9-16(18)20;5-1(3(7)8)2(6)4(9)10/h4-11,14H,12-13H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)	ZEEPCWVFSHMOPI-UHFFFAOYSA-N	298.150369414							9725, 9725
Amethopterin	LSM-4285	Methotrexate, TCMDC-123832, TCMDC-125488, TCMDC-125858	4112	InChI=1S/C20H22N8O5/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30/h2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,23,26,27)	FBOZXECLQNJBKD-UHFFFAOYSA-N	CN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)NC(CCC(=O)O)C(=O)O	BroadT	BRD-A55424491	BRD-A55424491-001-04-1	MicroSource Discovery Systems Inc.	1500398			CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O	InChI=1S/C20H22N8O5/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30/h2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,23,26,27)	FBOZXECLQNJBKD-UHFFFAOYSA-N	454.171315884							93775
Nafronyl	LSM-1730	Naftidrofuryl, Nafronyl	4417	InChI=1S/C24H33NO3/c1-3-25(4-2)14-16-28-24(26)21(18-22-12-8-15-27-22)17-20-11-7-10-19-9-5-6-13-23(19)20/h5-7,9-11,13,21-22H,3-4,8,12,14-18H2,1-2H3	KBAFPSLPKGSANY-UHFFFAOYSA-N	CCN(CC)CCOC(=O)C(CC1CCCO1)Cc2cccc3ccccc23	BroadT	BRD-A67862938	BRD-A67862938-034-04-0	MicroSource Discovery Systems Inc.	1503419		OC(=O)C(=O)O	CCN(CC)CCOC(=O)C(CC1CCCO1)Cc1cccc2ccccc12.OC(=O)C(=O)O	InChI=1S/C24H33NO3.C2H2O4/c1-3-25(4-2)14-16-28-24(26)21(18-22-12-8-15-27-22)17-20-11-7-10-19-9-5-6-13-23(19)20;3-1(4)2(5)6/h5-7,9-11,13,21-22H,3-4,8,12,14-18H2,1-2H3;(H,3,4)(H,5,6)	SSAJNPNVUYMUCI-UHFFFAOYSA-N	383.246043926							91817, 91817
Acetyl Tyrosine Ethyl Ester	LSM-21617	SID26748361, Acetyltyrosine Ethyl Ester	2004	InChI=1S/C13H17NO4/c1-3-18-13(17)12(14-9(2)15)8-10-4-6-11(16)7-5-10/h4-7,12,16H,3,8H2,1-2H3,(H,14,15)	SKAWDTAMLOJQNK-UHFFFAOYSA-N	CCOC(=O)C(Cc1ccc(O)cc1)NC(=O)C	BroadT	BRD-A55063801	BRD-A55063801-001-02-6	MicroSource Discovery Systems Inc.	1500695			CCOC(=O)C(Cc1ccc(O)cc1)NC(C)=O	InChI=1S/C13H17NO4/c1-3-18-13(17)12(14-9(2)15)8-10-4-6-11(16)7-5-10/h4-7,12,16H,3,8H2,1-2H3,(H,14,15)	SKAWDTAMLOJQNK-UHFFFAOYSA-N	251.115758034							110178
Tiaprofenic acid	LSM-1769	Tiaprofenicacid, RU-15060, Tiaprofenic Acid	5468	InChI=1S/C14H12O3S/c1-9(14(16)17)11-7-8-12(18-11)13(15)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,17)	GUHPRPJDBZHYCJ-UHFFFAOYSA-N	CC(C(=O)O)c1ccc(s1)C(=O)c2ccccc2	BroadT	BRD-A72988804	BRD-A72988804-001-03-8	Prestwick Chemical Inc.	Prestw-496	D0701-MP04-ST03-200-		CC(C(O)=O)c1ccc(s1)C(=O)c1ccccc1	InChI=1S/C14H12O3S/c1-9(14(16)17)11-7-8-12(18-11)13(15)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,17)	GUHPRPJDBZHYCJ-UHFFFAOYSA-N	260.050714934							32221
Tetrahydrotrimethylhispidin	LSM-21618		592220	InChI=1S/C16H20O5/c1-18-13-9-12(21-16(17)10-13)6-4-11-5-7-14(19-2)15(8-11)20-3/h5,7-8,10,12H,4,6,9H2,1-3H3	HEURTYMJWQPWNN-UHFFFAOYSA-N	COC1=CC(=O)OC(CCc2ccc(OC)c(OC)c2)C1	BroadT	BRD-A86977540	BRD-A86977540-001-02-6	MicroSource Discovery Systems Inc.	240485			COC1=CC(=O)OC(CCc2ccc(OC)c(OC)c2)C1	InChI=1S/C16H20O5/c1-18-13-9-12(21-16(17)10-13)6-4-11-5-7-14(19-2)15(8-11)20-3/h5,7-8,10,12H,4,6,9H2,1-3H3	HEURTYMJWQPWNN-UHFFFAOYSA-N	292.13107374							110179
AC1MD3YP	LSM-1801	BRD-A77299732	2830510	InChI=1S/C21H17Cl3N4OS/c22-21(23,24)19(27-17(29)12-11-14-6-2-1-3-7-14)28-20(30)26-16-10-4-8-15-9-5-13-25-18(15)16/h1-13,19H,(H,27,29)(H2,26,28,30)	LCOIAYJMPKXARU-UHFFFAOYSA-N	ClC(Cl)(Cl)C(NC(=S)Nc1cccc2cccnc12)NC(=O)C=Cc3ccccc3	BroadT	BRD-A77299732	BRD-A77299732-001-01-6	Tocris Bioscience	2347	1		ClC(Cl)(Cl)C(NC(=O)C=Cc1ccccc1)NC(=S)Nc1cccc2cccnc12	InChI=1S/C21H17Cl3N4OS/c22-21(23,24)19(27-17(29)12-11-14-6-2-1-3-7-14)28-20(30)26-16-10-4-8-15-9-5-13-25-18(15)16/h1-13,19H,(H,27,29)(H2,26,28,30)	LCOIAYJMPKXARU-UHFFFAOYSA-N	478.018865024							91873
121083-05-4	LSM-1870	BRD-A85472596	129360	InChI=1S/C22H21F2NO4S/c1-30(28,29)16-7-5-13(6-8-16)12-25-21-14(9-20(26)27)3-2-4-17(21)18-10-15(23)11-19(24)22(18)25/h5-8,10-11,14H,2-4,9,12H2,1H3,(H,26,27)	GMJWAIMJHBTYPD-UHFFFAOYSA-N	CS(=O)(=O)c1ccc(Cn2c3C(CC(=O)O)CCCc3c4cc(F)cc(F)c24)cc1	BroadT	BRD-A85472596	BRD-A85472596-001-01-4	Tocris Bioscience	1949	1		CS(=O)(=O)c1ccc(Cn2c3C(CC(O)=O)CCCc3c3cc(F)cc(F)c23)cc1	InChI=1S/C22H21F2NO4S/c1-30(28,29)16-7-5-13(6-8-16)12-25-21-14(9-20(26)27)3-2-4-17(21)18-10-15(23)11-19(24)22(18)25/h5-8,10-11,14H,2-4,9,12H2,1H3,(H,26,27)	GMJWAIMJHBTYPD-UHFFFAOYSA-N	433.115935252							91930
CHEMBL1624027	LSM-5063	Metacycline	44246715	InChI=1S/C22H22N2O8/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29/h4-6,10,12-15,17,25,27,32H,1H2,2-3H3,(H2,23,31)/t10-,12?,13?,14-,15+,17+,22+/m1/s1	QNJKSUYWBCNWFI-KCDYASHQSA-N	CN(C)[C@H]1[C@@H]2[C@@H](O)[C@H]3C(C(=O)c4c(O)cccc4C3=C)C(=O)[C@]2(O)C(=O)C(C(=O)N)C1=O	BroadT	BRD-A49035384	BRD-A49035384-003-04-0	Prestwick Chemical Inc.	Prestw-964	D0701-MP04-ST03-200-	Cl	CN(C)[C@H]1[C@@H]2[C@@H](O)[C@H]3C(C(=O)c4c(O)cccc4C3=C)C(=O)[C@]2(O)C(=O)C(C(N)=O)C1=O.Cl	InChI=1S/C22H22N2O8.ClH/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29;/h4-6,10,12-15,17,25,27,32H,1H2,2-3H3,(H2,23,31);1H/t10-,12?,13?,14-,15+,17+,22+;/m1./s1	QLDITMUXIVQWNL-FROUXQBISA-N	442.137615684							, 
PRESTWICK3_000602	LSM-21619	Ajmaline, SID56463108	23760133	InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10-,11?,14-,15+,16?,17-,18+,19+,20?/m0/s1	CJDRUOGAGYHKKD-FCXWBZPOSA-N	CC[C@H]1C2C[C@H]3[C@@H]4N(C)c5ccccc5C46C[C@H](C2[C@H]6O)N3[C@@H]1O	BroadT	BRD-A89846380	BRD-A89846380-001-02-3	Prestwick Chemical Inc.	Prestw-602	D0701-MP04-ST03-200-		CC[C@H]1C2C[C@H]3[C@@H]4N(C)c5ccccc5C44C[C@H](C2[C@H]4O)N3[C@@H]1O	InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10-,11?,14-,15+,16?,17-,18+,19+,20?/m0/s1	CJDRUOGAGYHKKD-FCXWBZPOSA-N	326.199428092							110180
Terreic-acid	LSM-5107	(-)-Terreic Acid	44483234	InChI=1S/C7H6O4/c1-2-3(8)5(10)7-6(11-7)4(2)9/h2,6-7H,1H3/t2?,6-,7+/m1/s1	NYFMSQHOGRWGFD-OOEDRKFMSA-N	CC1C(=O)[C@H]2O[C@H]2C(=O)C1=O	BroadT	BRD-A64228451	BRD-A64228451-001-03-5	Biomol International Inc.	EI-328	2832A(V2.2)-3-N1290		CC1C(=O)[C@H]2O[C@H]2C(=O)C1=O	InChI=1S/C7H6O4/c1-2-3(8)5(10)7-6(11-7)4(2)9/h2,6-7H,1H3/t2?,6-,7+/m1/s1	NYFMSQHOGRWGFD-OOEDRKFMSA-N	154.026608672							94414
AC1N1TWZ	LSM-21620	6-Oxoprogesterone	4036085	InChI=1S/C21H28O3/c1-12(22)15-4-5-16-14-11-19(24)18-10-13(23)6-8-21(18,3)17(14)7-9-20(15,16)2/h10,14-17H,4-9,11H2,1-3H3	LASCNIPXMJNRGS-UHFFFAOYSA-N	CC(=O)C1CCC2C3CC(=O)C4=CC(=O)CCC4(C)C3CCC12C	BroadT	BRD-A55574211	BRD-A55574211-001-01-8	MicroSource Discovery Systems Inc.	1505219			CC(=O)C1CCC2C3CC(=O)C4=CC(=O)CCC4(C)C3CCC12C	InChI=1S/C21H28O3/c1-12(22)15-4-5-16-14-11-19(24)18-10-13(23)6-8-21(18,3)17(14)7-9-20(15,16)2/h10,14-17H,4-9,11H2,1-3H3	LASCNIPXMJNRGS-UHFFFAOYSA-N	328.203844756							110181
Dihydroegotamine	LSM-1639	BRD-A54845972	3066	InChI=1S/C33H37N5O5/c1-32(35-29(39)21-15-23-22-10-6-11-24-28(22)20(17-34-24)16-25(23)36(2)18-21)31(41)38-26(14-19-8-4-3-5-9-19)30(40)37-13-7-12-27(37)33(38,42)43-32/h3-6,8-11,17,21,23,25-27,34,42H,7,12-16,18H2,1-2H3,(H,35,39)	LUZRJRNZXALNLM-UHFFFAOYSA-N	CN1CC(CC2C1Cc3c[nH]c4cccc2c34)C(=O)NC5(C)OC6(O)C7CCCN7C(=O)C(Cc8ccccc8)N6C5=O	BroadT	BRD-A54845972	BRD-A54845972-066-01-5	Tocris Bioscience	475	1	CS(=O)(=O)O	CN1CC(CC2C1Cc1c[nH]c3cccc2c13)C(=O)NC1(C)OC2(O)C3CCCN3C(=O)C(Cc3ccccc3)N2C1=O.CS(=O)(=O)O	InChI=1S/C33H37N5O5.CH4O3S/c1-32(35-29(39)21-15-23-22-10-6-11-24-28(22)20(17-34-24)16-25(23)36(2)18-21)31(41)38-26(14-19-8-4-3-5-9-19)30(40)37-13-7-12-27(37)33(38,42)43-32;1-5(2,3)4/h3-6,8-11,17,21,23,25-27,34,42H,7,12-16,18H2,1-2H3,(H,35,39);1H3,(H,2,3,4)	ADYPXRFPBQGGAH-UHFFFAOYSA-N	583.279469334							91758
SPECTRUM_000090	LSM-1817	Bromocriptine	5702015	InChI=1S/C32H40BrN5O5/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39)/t18?,23-,24?,25+,31-,32?/m1/s1	OZVBMTJYIDMWIL-NXIPCUEUSA-N	CC(C)CC1N2C(=O)[C@](NC(=O)C3CN(C)[C@@H]4Cc5c(Br)[nH]c6cccc(C4=C3)c56)(OC2(O)[C@@H]7CCCN7C1=O)C(C)C	BroadT	BRD-A80151636	BRD-A80151636-066-02-2	MicroSource Discovery Systems Inc.	1500151		CS(=O)(=O)O	CC(C)CC1N2C(=O)[C@](NC(=O)C3CN(C)[C@@H]4Cc5c(Br)[nH]c6cccc(C4=C3)c56)(OC2(O)[C@@H]2CCCN2C1=O)C(C)C.CS(=O)(=O)O	InChI=1S/C32H40BrN5O5.CH4O3S/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18;1-5(2,3)4/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39);1H3,(H,2,3,4)/t18?,23-,24?,25+,31-,32?;/m1./s1	NOJMTMIRQRDZMT-NBKIJBDLSA-N	653.22128203							91882
SPECTRUM_001275	LSM-21621	Betamethasone Valerate	6710678	InChI=1S/C27H37FO6/c1-5-6-7-23(33)34-27(22(32)15-29)16(2)12-20-19-9-8-17-13-18(30)10-11-24(17,3)26(19,28)21(31)14-25(20,27)4/h10-11,13,16,19-21,29,31H,5-9,12,14-15H2,1-4H3/t16-,19?,20?,21?,24-,25-,26-,27-/m0/s1	SNHRLVCMMWUAJD-FHOZUDJNSA-N	CCCCC(=O)O[C@@]1([C@@H](C)CC2C3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(O)C[C@]12C)C(=O)CO	BroadT	BRD-A80594172	BRD-A80594172-001-02-0	MicroSource Discovery Systems Inc.	1500145			CCCCC(=O)O[C@@]1([C@@H](C)CC2C3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(O)C[C@]12C)C(=O)CO	InChI=1S/C27H37FO6/c1-5-6-7-23(33)34-27(22(32)15-29)16(2)12-20-19-9-8-17-13-18(30)10-11-24(17,3)26(19,28)21(31)14-25(20,27)4/h10-11,13,16,19-21,29,31H,5-9,12,14-15H2,1-4H3/t16-,19?,20?,21?,24-,25-,26-,27-/m0/s1	SNHRLVCMMWUAJD-FHOZUDJNSA-N	476.257417104							
Econazole	LSM-1617	Econazole, Spectazole	3198	InChI=1S/C18H15Cl3N2O/c19-14-3-1-13(2-4-14)11-24-18(10-23-8-7-22-12-23)16-6-5-15(20)9-17(16)21/h1-9,12,18H,10-11H2	LEZWWPYKPKIXLL-UHFFFAOYSA-N	Clc1ccc(COC(Cn2ccnc2)c3ccc(Cl)cc3Cl)cc1	BroadT	BRD-A51820102	BRD-A51820102-008-04-0	MicroSource Discovery Systems Inc.	1501185		O[N+](=O)[O-]	Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1.O[N+](=O)[O-]	InChI=1S/C18H15Cl3N2O.HNO3/c19-14-3-1-13(2-4-14)11-24-18(10-23-8-7-22-12-23)16-6-5-15(20)9-17(16)21;2-1(3)4/h1-9,12,18H,10-11H2;(H,2,3,4)	DDXORDQKGIZAME-UHFFFAOYSA-N	380.02499625							82873, 82873
MUUROLLADIE-3-ONE	LSM-21622	SID26749625	3989419	InChI=1S/C15H22O/c1-9(2)12-6-5-10(3)13-8-15(16)11(4)7-14(12)13/h5,7,9,12-14H,6,8H2,1-4H3	LMILVXQXGKTFSZ-UHFFFAOYSA-N	CC(C)C1CC=C(C)C2CC(=O)C(=CC12)C	BroadT	BRD-A75954196	BRD-A75954196-001-02-5	MicroSource Discovery Systems Inc.	307056			CC(C)C1CC=C(C)C2CC(=O)C(C)=CC12	InChI=1S/C15H22O/c1-9(2)12-6-5-10(3)13-8-15(16)11(4)7-14(12)13/h5,7,9,12-14H,6,8H2,1-4H3	LMILVXQXGKTFSZ-UHFFFAOYSA-N	218.167065324							110182
Delcorine	LSM-1882	SID56463077	441724	InChI=1S/C26H41NO7/c1-6-27-11-23(12-29-2)8-7-17(31-4)25-15-9-14-16(30-3)10-24(18(15)19(14)32-5)26(22(25)27,34-13-33-24)21(28)20(23)25/h14-22,28H,6-13H2,1-5H3/t14-,15-,16+,17+,18-,19+,20-,21+,22?,23+,24-,25+,26-/m1/s1	XTLROSDJDZHIIK-VIGIWSGCSA-N	CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@@H]6[C@H](C[C@@]7(OCO[C@]7([C@@H](O)[C@H]23)C14)[C@H]5[C@H]6OC)OC	BroadT	BRD-A88282067	BRD-A88282067-001-02-2	Prestwick Chemical Inc.	Prestw-664	D0701-MP04-ST03-200-		CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@@]5(C[C@@H]6OC)OCO[C@]5([C@@H](O)[C@H]23)C14	InChI=1S/C26H41NO7/c1-6-27-11-23(12-29-2)8-7-17(31-4)25-15-9-14-16(30-3)10-24(18(15)19(14)32-5)26(22(25)27,34-13-33-24)21(28)20(23)25/h14-22,28H,6-13H2,1-5H3/t14-,15-,16+,17+,18-,19+,20-,21+,22?,23+,24-,25+,26-/m1/s1	XTLROSDJDZHIIK-VIGIWSGCSA-N	479.288302662							4380
KN 62	LSM-1824	KN-62, SID137275814, SID26756742, SID26756743	3838	InChI=1S/C38H35N5O6S2/c1-41(50(45,46)36-11-5-7-29-26-39-19-17-33(29)36)35(38(44)43-23-21-42(22-24-43)31-9-3-2-4-10-31)25-28-13-15-32(16-14-28)49-51(47,48)37-12-6-8-30-27-40-20-18-34(30)37/h2-20,26-27,35H,21-25H2,1H3	RJVLFQBBRSMWHX-UHFFFAOYSA-N	CN(C(Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1)C(=O)N4CCN(CC4)c5ccccc5)S(=O)(=O)c6cccc7cnccc67	BroadT	BRD-A81177136	BRD-A81177136-001-03-6	Biomol International Inc.	EI-230	2832A(V2.2)-3-N1290		CN(C(Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1)C(=O)N1CCN(CC1)c1ccccc1)S(=O)(=O)c1cccc2cnccc12	InChI=1S/C38H35N5O6S2/c1-41(50(45,46)36-11-5-7-29-26-39-19-17-33(29)36)35(38(44)43-23-21-42(22-24-43)31-9-3-2-4-10-31)25-28-13-15-32(16-14-28)49-51(47,48)37-12-6-8-30-27-40-20-18-34(30)37/h2-20,26-27,35H,21-25H2,1H3	RJVLFQBBRSMWHX-UHFFFAOYSA-N	721.20287527							91888
AC1Q3NSV	LSM-1694	BRD-A63546914	46740	InChI=1S/C19H22ClNO2/c1-21-10-9-14-11-19(23-2)18(22)12-16(14)17(21)8-5-13-3-6-15(20)7-4-13/h3-4,6-7,11-12,17,22H,5,8-10H2,1-2H3	DSTWURHEHMZWEI-UHFFFAOYSA-N	COc1cc2CCN(C)C(CCc3ccc(Cl)cc3)c2cc1O	BroadT	BRD-A63546914	BRD-A63546914-003-01-2	Tocris Bioscience	2005	1	Cl	COc1cc2CCN(C)C(CCc3ccc(Cl)cc3)c2cc1O.Cl	InChI=1S/C19H22ClNO2.ClH/c1-21-10-9-14-11-19(23-2)18(22)12-16(14)17(21)8-5-13-3-6-15(20)7-4-13;/h3-4,6-7,11-12,17,22H,5,8-10H2,1-2H3;1H	NVIPBLQAFKRFSZ-UHFFFAOYSA-N	331.133906664							91797, 91797
Tianeptine	LSM-1626	Tianeptine, BRD-A53077924	68870	InChI=1S/C21H25ClN2O4S/c1-24-18-9-6-5-8-16(18)21(23-13-7-3-2-4-10-20(25)26)17-12-11-15(22)14-19(17)29(24,27)28/h5-6,8-9,11-12,14,21,23H,2-4,7,10,13H2,1H3,(H,25,26)	JICJBGPOMZQUBB-UHFFFAOYSA-N	CN1c2ccccc2C(NCCCCCCC(=O)O)c3ccc(Cl)cc3S1(=O)=O	BroadT	BRD-A53077924	BRD-A53077924-236-01-4	Tocris Bioscience	1972	1	[Na]	CN1c2ccccc2C(NCCCCCCC(O)=O)c2ccc(Cl)cc2S1(=O)=O.[Na]	InChI=1S/C21H25ClN2O4S.Na.H/c1-24-18-9-6-5-8-16(18)21(23-13-7-3-2-4-10-20(25)26)17-12-11-15(22)14-19(17)29(24,27)28;;/h5-6,8-9,11-12,14,21,23H,2-4,7,10,13H2,1H3,(H,25,26);;	WSXRXTKGVLJIQY-UHFFFAOYSA-N	436.1223557							91749, 91749
Ciglitazone	LSM-1911	Ciglitazone, ADD-3878, U-63287	2750	InChI=1S/C18H23NO3S/c1-18(9-3-2-4-10-18)12-22-14-7-5-13(6-8-14)11-15-16(20)19-17(21)23-15/h5-8,15H,2-4,9-12H2,1H3,(H,19,20,21)	YZFWTZACSRHJQD-UHFFFAOYSA-N	CC1(COc2ccc(CC3SC(=O)NC3=O)cc2)CCCCC1	BroadT	BRD-A93000692	BRD-A93000692-001-03-2	Tocris Bioscience	1307	1		CC1(COc2ccc(CC3SC(=O)NC3=O)cc2)CCCCC1	InChI=1S/C18H23NO3S/c1-18(9-3-2-4-10-18)12-22-14-7-5-13(6-8-14)11-15-16(20)19-17(21)23-15/h5-8,15H,2-4,9-12H2,1H3,(H,19,20,21)	YZFWTZACSRHJQD-UHFFFAOYSA-N	333.139864296							64227
9-[3-(3,5-Dimethylpiperazin-1-yl)propyl]-9H-carbazole	LSM-1693	BRD-A63346720	5072	InChI=1S/C21H27N3/c1-16-14-23(15-17(2)22-16)12-7-13-24-20-10-5-3-8-18(20)19-9-4-6-11-21(19)24/h3-6,8-11,16-17,22H,7,12-15H2,1-2H3	GUDVQJXODNJRIJ-UHFFFAOYSA-N	CC1CN(CCCn2c3ccccc3c4ccccc24)CC(C)N1	BroadT	BRD-A63346720	BRD-A63346720-300-01-1	Tocris Bioscience	1497	1	Cl.Cl	CC1CN(CCCn2c3ccccc3c3ccccc23)CC(C)N1.Cl.Cl	InChI=1S/C21H27N3.2ClH/c1-16-14-23(15-17(2)22-16)12-7-13-24-20-10-5-3-8-18(20)19-9-4-6-11-21(19)24;;/h3-6,8-11,16-17,22H,7,12-15H2,1-2H3;2*1H	ZWHRZGHGYMUSRM-UHFFFAOYSA-N	321.220497894							91796
GR-89696	LSM-1919	BRD-A93659613, GR-89696	3505	InChI=1S/C19H25Cl2N3O3/c1-27-19(26)23-8-9-24(15(13-23)12-22-6-2-3-7-22)18(25)11-14-4-5-16(20)17(21)10-14/h4-5,10,15H,2-3,6-9,11-13H2,1H3	HJUAKZYKCANOOZ-UHFFFAOYSA-N	COC(=O)N1CCN(C(CN2CCCC2)C1)C(=O)Cc3ccc(Cl)c(Cl)c3	BroadT	BRD-A93659613	BRD-A93659613-051-03-6	Tocris Bioscience	1483	1	OC(=O)/C=C/C(=O)O	COC(=O)N1CCN(C(CN2CCCC2)C1)C(=O)Cc1ccc(Cl)c(Cl)c1.OC(=O)/C=C/C(=O)O	InChI=1S/C19H25Cl2N3O3.C4H4O4/c1-27-19(26)23-8-9-24(15(13-23)12-22-6-2-3-7-22)18(25)11-14-4-5-16(20)17(21)10-14;5-3(6)1-2-4(7)8/h4-5,10,15H,2-3,6-9,11-13H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+	ABTNETSDXZBJTE-WLHGVMLRSA-N	413.12729711							91965, 91965
Tritylcysteine	LSM-21623	BRD-A81392774, SID121478, SID92763946	256411	InChI=1S/C22H21NO2S/c23-20(21(24)25)16-26-22(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20H,16,23H2,(H,24,25)	DLMYFMLKORXJPO-UHFFFAOYSA-N	NC(CSC(c1ccccc1)(c2ccccc2)c3ccccc3)C(=O)O	BroadT	BRD-A81392774	BRD-A81392774-001-01-2	Tocris Bioscience	2191	1		NC(CSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(O)=O	InChI=1S/C22H21NO2S/c23-20(21(24)25)16-26-22(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20H,16,23H2,(H,24,25)	DLMYFMLKORXJPO-UHFFFAOYSA-N	363.129299612							110183
Quinethazone	LSM-1666	Hydromox, Quinethazone, Chinethazone	6307	InChI=1S/C10H12ClN3O3S/c1-2-9-13-7-4-6(11)8(18(12,16)17)3-5(7)10(15)14-9/h3-4,9,13H,2H2,1H3,(H,14,15)(H2,12,16,17)	AGMMTXLNIQSRCG-UHFFFAOYSA-N	CCC1NC(=O)c2cc(c(Cl)cc2N1)S(=O)(=O)N	BroadT	BRD-A59303141	BRD-A59303141-001-03-9	Prestwick Chemical Inc.	Prestw-1050	D0701-MP04-ST03-200-		CCC1NC(=O)c2cc(c(Cl)cc2N1)S(N)(=O)=O	InChI=1S/C10H12ClN3O3S/c1-2-9-13-7-4-6(11)8(18(12,16)17)3-5(7)10(15)14-9/h3-4,9,13H,2H2,1H3,(H,14,15)(H2,12,16,17)	AGMMTXLNIQSRCG-UHFFFAOYSA-N	289.028789674							8717
Miconazole	LSM-5165	Oravig, Vusion, Monistat, Miconazole, Conofite, Dermazole, Micatin, Monistat-3, Monistat-Derm	4189	InChI=1S/C18H14Cl4N2O/c19-13-2-1-12(16(21)7-13)10-25-18(9-24-6-5-23-11-24)15-4-3-14(20)8-17(15)22/h1-8,11,18H,9-10H2	BYBLEWFAAKGYCD-UHFFFAOYSA-N	Clc1ccc(COC(Cn2ccnc2)c3ccc(Cl)cc3Cl)c(Cl)c1	BroadT	BRD-A82396632	BRD-A82396632-008-02-7	MicroSource Discovery Systems Inc.	1500413		O[N+](=O)[O-]	Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1.O[N+](=O)[O-]	InChI=1S/C18H14Cl4N2O.HNO3/c19-13-2-1-12(16(21)7-13)10-25-18(9-24-6-5-23-11-24)15-4-3-14(20)8-17(15)22;2-1(3)4/h1-8,11,18H,9-10H2;(H,2,3,4)	MCCACAIVAXEFAL-UHFFFAOYSA-N	413.986023928							82892, 82892
AC1NWAOC	LSM-21624	Medroxyprogesterone	5702080	InChI=1S/C24H34O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h13-14,18-20H,6-12H2,1-5H3/t14-,18?,19?,20?,22+,23-,24-/m0/s1	PSGAAPLEWMOORI-GDXVCIIOSA-N	C[C@H]1CC2C(CC[C@@]3(C)C2CC[C@]3(OC(=O)C)C(=O)C)[C@@]4(C)CCC(=O)C=C14	BroadT	BRD-A61221616	BRD-A61221616-001-02-7	MicroSource Discovery Systems Inc.	1500379			C[C@H]1CC2C3CC[C@](OC(C)=O)(C(C)=O)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12	InChI=1S/C24H34O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h13-14,18-20H,6-12H2,1-5H3/t14-,18?,19?,20?,22+,23-,24-/m0/s1	PSGAAPLEWMOORI-GDXVCIIOSA-N	386.245709568							
Aconitine	LSM-21625		6713948	InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19?,20-,21+,22?,23+,24+,25?,26-,27+,28-,29-,31+,32-,33+,34-/m1/s1	XFSBVAOIAHNAPC-CZFAXEQISA-N	CCN1C[C@]2(COC)[C@H](O)C[C@H](OC)[C@@]34C5C[C@]6(O)[C@H](OC)[C@H](O)[C@](OC(=O)C)([C@@H]([C@H](OC)C23)[C@@H]14)C5[C@H]6OC(=O)c7ccccc7	BroadT	BRD-A55025683	BRD-A55025683-001-03-6	Prestwick Chemical Inc.	Prestw-567	D0701-MP04-ST03-200-		CCN1C[C@@]2(COC)C3[C@@H](OC)[C@H]4[C@@H]1[C@@]3(C1C[C@@]3(O)[C@H](OC(=O)c5ccccc5)C1[C@]4(OC(C)=O)[C@@H](O)[C@H]3OC)[C@H](C[C@H]2O)OC	InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19?,20-,21+,22?,23+,24+,25?,26-,27+,28-,29-,31+,32-,33+,34-/m1/s1	XFSBVAOIAHNAPC-CZFAXEQISA-N	645.314911334							
Etodolac	LSM-1781	Etodolac, Lodine, AY-24236, Etodolic Acid, Lodine XL	3308	InChI=1S/C17H21NO3/c1-3-11-6-5-7-12-13-8-9-21-17(4-2,10-14(19)20)16(13)18-15(11)12/h5-7,18H,3-4,8-10H2,1-2H3,(H,19,20)	NNYBQONXHNTVIJ-UHFFFAOYSA-N	CCc1cccc2c3CCOC(CC)(CC(=O)O)c3[nH]c12	BroadT	BRD-A74667430	BRD-A74667430-001-04-6	MicroSource Discovery Systems Inc.	1501005			CCc1cccc2c3CCOC(CC)(CC(O)=O)c3[nH]c12	InChI=1S/C17H21NO3/c1-3-11-6-5-7-12-13-8-9-21-17(4-2,10-14(19)20)16(13)18-15(11)12/h5-7,18H,3-4,8-10H2,1-2H3,(H,19,20)	NNYBQONXHNTVIJ-UHFFFAOYSA-N	287.152143542							4909
MLS002222336	LSM-1855	Meloxicam, SID85271402	10291556	InChI=1S/C14H13N3O4S2/c1-8-7-15-14(22-8)16-13(19)11-12(18)9-5-3-4-6-10(9)23(20,21)17(11)2/h3-7,11H,1-2H3,(H,15,16,19)	ZAHQBPYQBHTECE-UHFFFAOYSA-N	CN1C(C(=O)Nc2ncc(C)s2)C(=O)c3ccccc3S1(=O)=O	BroadT	BRD-A84174393	BRD-A84174393-001-02-0	MicroSource Discovery Systems Inc.	1504150			CN1C(C(=O)Nc2ncc(C)s2)C(=O)c2ccccc2S1(=O)=O	InChI=1S/C14H13N3O4S2/c1-8-7-15-14(22-8)16-13(19)11-12(18)9-5-3-4-6-10(9)23(20,21)17(11)2/h3-7,11H,1-2H3,(H,15,16,19)	ZAHQBPYQBHTECE-UHFFFAOYSA-N	351.034747306							91917
3Beta-acetoxydeoxodihydrogedunin	LSM-21626		6708506	InChI=1S/C30H40O8/c1-16(31)35-21-9-11-27(5)19-8-12-28(6)23(18-10-13-34-15-18)37-25(33)24-30(28,38-24)29(19,7)22(36-17(2)32)14-20(27)26(21,3)4/h10,13,15,19-24H,8-9,11-12,14H2,1-7H3/t19?,20?,21-,22+,23-,24+,27+,28-,29-,30+/m0/s1	LCTHKUJMKQOYDY-ZYIGBFDLSA-N	CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@@]45[C@]3(C)[C@@H](CC2C1(C)C)OC(=O)C)c6cocc6	BroadT	BRD-A71001587	BRD-A71001587-001-02-6	MicroSource Discovery Systems Inc.	100497			CC(=O)O[C@H]1CC[C@@]2(C)C(C[C@@H](OC(C)=O)[C@]3(C)C2CC[C@@]2(C)[C@@H](OC(=O)[C@H]4O[C@@]324)c2ccoc2)C1(C)C	InChI=1S/C30H40O8/c1-16(31)35-21-9-11-27(5)19-8-12-28(6)23(18-10-13-34-15-18)37-25(33)24-30(28,38-24)29(19,7)22(36-17(2)32)14-20(27)26(21,3)4/h10,13,15,19-24H,8-9,11-12,14H2,1-7H3/t19?,20?,21-,22+,23-,24+,27+,28-,29-,30+/m0/s1	LCTHKUJMKQOYDY-ZYIGBFDLSA-N	528.27231824							
SQ22536	LSM-1656	SQ-22536	5270	InChI=1S/C9H11N5O/c10-8-7-9(12-4-11-8)14(5-13-7)6-2-1-3-15-6/h4-6H,1-3H2,(H2,10,11,12)	UKHMZCMKHPHFOT-UHFFFAOYSA-N	Nc1ncnc2c1ncn2C3CCCO3	BroadT	BRD-A56987319	BRD-A56987319-001-03-8	Biomol International Inc.	CN-140	2840(V2)-3-N1305		Nc1ncnc2n(cnc12)C1CCCO1	InChI=1S/C9H11N5O/c10-8-7-9(12-4-11-8)14(5-13-7)6-2-1-3-15-6/h4-6H,1-3H2,(H2,10,11,12)	UKHMZCMKHPHFOT-UHFFFAOYSA-N	205.096360022							90232
WAY 100135	LSM-15489	BRD-A66369147	115111	InChI=1S/C24H33N3O2/c1-24(2,3)25-23(28)20(19-10-6-5-7-11-19)18-26-14-16-27(17-15-26)21-12-8-9-13-22(21)29-4/h5-13,20H,14-18H2,1-4H3,(H,25,28)	UMTDAKAAYOXIKU-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC(C(=O)NC(C)(C)C)c3ccccc3)CC2	BroadT	BRD-A66369147	BRD-A66369147-300-01-5	Tocris Bioscience	1253	2	Cl.Cl	COc1ccccc1N1CCN(CC(C(=O)NC(C)(C)C)c2ccccc2)CC1.Cl.Cl	InChI=1S/C24H33N3O2.2ClH/c1-24(2,3)25-23(28)20(19-10-6-5-7-11-19)18-26-14-16-27(17-15-26)21-12-8-9-13-22(21)29-4;;/h5-13,20H,14-18H2,1-4H3,(H,25,28);2*1H	VJGZNBYDSDEOED-UHFFFAOYSA-N	395.257277326							104131
Bepridil	LSM-1898	Bepadin, Bepridil, Vascor	2351	InChI=1S/C24H34N2O/c1-21(2)19-27-20-24(25-15-9-10-16-25)18-26(23-13-7-4-8-14-23)17-22-11-5-3-6-12-22/h3-8,11-14,21,24H,9-10,15-20H2,1-2H3	UIEATEWHFDRYRU-UHFFFAOYSA-N	CC(C)COCC(CN(Cc1ccccc1)c2ccccc2)N3CCCC3	BroadT	BRD-A91008255	BRD-A91008255-001-02-8	Biomol International Inc.	AC-104	2840(V2)-3-N1305		CC(C)COCC(CN(Cc1ccccc1)c1ccccc1)N1CCCC1	InChI=1S/C24H34N2O/c1-21(2)19-27-20-24(25-15-9-10-16-25)18-26(23-13-7-4-8-14-23)17-22-11-5-3-6-12-22/h3-8,11-14,21,24H,9-10,15-20H2,1-2H3	UIEATEWHFDRYRU-UHFFFAOYSA-N	366.267113728							3061, 3061, 3061
2-Methoxy-3,17beta-dihydroxyestra-1,3,5(10)-triene	LSM-21627	BRD-A46950333	16760554	InChI=1S/C19H26O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,18,20-21H,3-8H2,1-2H3/t12?,13?,15?,18-,19-/m0/s1	CQOQDQWUFQDJMK-WRWXEFHESA-N	COc1cc2C3CC[C@]4(C)[C@@H](O)CCC4C3CCc2cc1O	BroadT	BRD-A46950333	BRD-A46950333-001-01-5	EMD Biosciences	454180			COc1cc2C3CC[C@]4(C)[C@@H](O)CCC4C3CCc2cc1O	InChI=1S/C19H26O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,18,20-21H,3-8H2,1-2H3/t12?,13?,15?,18-,19-/m0/s1	CQOQDQWUFQDJMK-WRWXEFHESA-N	302.188194692							
Metaxalone	LSM-1929	Metaxalone, Skelaxin, AHR-438	15459	InChI=1S/C12H15NO3/c1-8-3-9(2)5-10(4-8)15-7-11-6-13-12(14)16-11/h3-5,11H,6-7H2,1-2H3,(H,13,14)	IMWZZHHPURKASS-UHFFFAOYSA-N	Cc1cc(C)cc(OCC2CNC(=O)O2)c1	BroadT	BRD-A94709349	BRD-A94709349-001-02-6	MicroSource Discovery Systems Inc.	1504229			Cc1cc(C)cc(OCC2CNC(=O)O2)c1	InChI=1S/C12H15NO3/c1-8-3-9(2)5-10(4-8)15-7-11-6-13-12(14)16-11/h3-5,11H,6-7H2,1-2H3,(H,13,14)	IMWZZHHPURKASS-UHFFFAOYSA-N	221.10519335							6797
Citalopram	LSM-1585	Celexa, Citalopram	2771	InChI=1S/C20H21FN2O/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20/h4-9,12H,3,10-11,14H2,1-2H3	WSEQXVZVJXJVFP-UHFFFAOYSA-N	CN(C)CCCC1(OCc2cc(ccc12)C#N)c3ccc(F)cc3	BroadT	BRD-A47598013	BRD-A47598013-004-02-0	Biomol International Inc.	AR-116	2813-N1283	Br	CN(C)CCCC1(OCc2cc(ccc12)C#N)c1ccc(F)cc1.Br	InChI=1S/C20H21FN2O.BrH/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20;/h4-9,12H,3,10-11,14H2,1-2H3;1H	WIHMBLDNRMIGDW-UHFFFAOYSA-N	324.163791512							77397, 77397, 77397
Betamethasone 17,21-dipropionate	LSM-1725	BRD-A66861218	6708733	InChI=1S/C28H37FO7/c1-6-23(33)35-15-22(32)28(36-24(34)7-2)16(3)12-20-19-9-8-17-13-18(30)10-11-25(17,4)27(19,29)21(31)14-26(20,28)5/h10-11,13,16,19-21,31H,6-9,12,14-15H2,1-5H3/t16-,19?,20?,21-,25-,26-,27?,28-/m0/s1	CIWBQSYVNNPZIQ-YMSYXYNZSA-N	CCC(=O)OCC(=O)[C@@]1(OC(=O)CC)[C@@H](C)CC2C3CCC4=CC(=O)C=C[C@]4(C)C3(F)[C@@H](O)C[C@]12C	BroadT	BRD-A66861218	BRD-A66861218-001-02-7	MicroSource Discovery Systems Inc.	1503210			CCC(=O)OCC(=O)[C@@]1(OC(=O)CC)[C@@H](C)CC2C3CCC4=CC(=O)C=C[C@]4(C)C3(F)[C@@H](O)C[C@]12C	InChI=1S/C28H37FO7/c1-6-23(33)35-15-22(32)28(36-24(34)7-2)16(3)12-20-19-9-8-17-13-18(30)10-11-25(17,4)27(19,29)21(31)14-26(20,28)5/h10-11,13,16,19-21,31H,6-9,12,14-15H2,1-5H3/t16-,19?,20?,21-,25-,26-,27?,28-/m0/s1	CIWBQSYVNNPZIQ-YMSYXYNZSA-N	504.252331724							
Deoxysappanone B Trimethyl Ether	LSM-21628	SID26749514	4643334	InChI=1S/C19H20O5/c1-21-14-5-6-15-17(10-14)24-11-13(19(15)20)8-12-4-7-16(22-2)18(9-12)23-3/h4-7,9-10,13H,8,11H2,1-3H3	ZRSCGBGNKZDPOF-UHFFFAOYSA-N	COc1ccc2C(=O)C(Cc3ccc(OC)c(OC)c3)COc2c1	BroadT	BRD-A77164655	BRD-A77164655-001-02-3	MicroSource Discovery Systems Inc.	201331			COc1ccc2C(=O)C(Cc3ccc(OC)c(OC)c3)COc2c1	InChI=1S/C19H20O5/c1-21-14-5-6-15-17(10-14)24-11-13(19(15)20)8-12-4-7-16(22-2)18(9-12)23-3/h4-7,9-10,13H,8,11H2,1-3H3	ZRSCGBGNKZDPOF-UHFFFAOYSA-N	328.13107374							110184
8-Cyclohexyl-2,3,3a,4,5,6-hexahydro-1H-pyrazino[3,2,1-jk]carbazole	LSM-1624	AMA-2	160020	InChI=1S/C20H26N2/c1-2-5-14(6-3-1)15-9-10-19-17(13-15)16-7-4-8-18-20(16)22(19)12-11-21-18/h9-10,13-14,18,21H,1-8,11-12H2	AUXCHYJDVJZEPG-UHFFFAOYSA-N	C1CCC(CC1)c2ccc3c(c2)c4CCCC5NCCn3c45	BroadT	BRD-A52660433	BRD-A52660433-066-01-3	Tocris Bioscience	723	1	CS(=O)(=O)O	C1CCC(CC1)c1ccc2n3CCNC4CCCc(c34)c2c1.CS(=O)(=O)O	InChI=1S/C20H26N2.CH4O3S/c1-2-5-14(6-3-1)15-9-10-19-17(13-15)16-7-4-8-18-20(16)22(19)12-11-21-18;1-5(2,3)4/h9-10,13-14,18,21H,1-8,11-12H2;1H3,(H,2,3,4)	CWPNPYVNPOAMHY-UHFFFAOYSA-N	294.209598852							77813
AC1L1E8W	LSM-1832	BRD-A81866333	2691	InChI=1S/C23H29N7O6/c1-2-25-21(35)18-16(33)17(34)22(36-18)30-11-27-15-19(24)28-23(29-20(15)30)26-10-9-13-5-3-12(4-6-13)7-8-14(31)32/h3-6,11,16-18,22,33-34H,2,7-10H2,1H3,(H,25,35)(H,31,32)(H3,24,26,28,29)	PAOANWZGLPPROA-UHFFFAOYSA-N	CCNC(=O)C1OC(C(O)C1O)n2cnc3c(N)nc(NCCc4ccc(CCC(=O)O)cc4)nc23	BroadT	BRD-A81866333	BRD-A81866333-003-01-5	Tocris Bioscience	1063	9	Cl	CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(NCCc3ccc(CCC(O)=O)cc3)nc12.Cl	InChI=1S/C23H29N7O6.ClH/c1-2-25-21(35)18-16(33)17(34)22(36-18)30-11-27-15-19(24)28-23(29-20(15)30)26-10-9-13-5-3-12(4-6-13)7-8-14(31)32;/h3-6,11,16-18,22,33-34H,2,7-10H2,1H3,(H,25,35)(H,31,32)(H3,24,26,28,29);1H	QPHVMNOEKKJYJO-UHFFFAOYSA-N	499.217931718							91896
23981-80-8	LSM-1880	Naproxen, SID124886700, SID56463342	1302	InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)	CMWTZPSULFXXJA-UHFFFAOYSA-N	COc1ccc2cc(ccc2c1)C(C)C(=O)O	BroadT	BRD-A87719232	BRD-A87719232-001-02-4	Prestwick Chemical Inc.	Prestw-45	D0701-MP04-ST03-200-		COc1ccc2cc(ccc2c1)C(C)C(O)=O	InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)	CMWTZPSULFXXJA-UHFFFAOYSA-N	230.094294308							91939, 91939
Atpa	LSM-1708	BRD-A65145453, SID50105871, SID56463499, SID85230892	2253	InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)	PIXJURSCCVBKRF-UHFFFAOYSA-N	CC(C)(C)c1onc(O)c1CC(N)C(=O)O	BroadT	BRD-A65145453	BRD-A65145453-001-02-0	Tocris Bioscience	1107	6		CC(C)(C)c1onc(O)c1CC(N)C(O)=O	InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)	PIXJURSCCVBKRF-UHFFFAOYSA-N	228.111007012							91806
AC1NS4A1	LSM-45094	Cefuroxime	5353516	InChI=1S/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9+	JFPVXVDWJQMJEE-DJKKODMXSA-N	CO\N=C(\C(=O)NC1C2SCC(=C(N2C1=O)C(=O)O)COC(=O)N)/c3occc3	BroadT	BRD-A76746748	BRD-A76746748-236-02-9	MicroSource Discovery Systems Inc.	1502033		[Na]	CO\N=C(\C(=O)NC1C2SCC(COC(N)=O)=C(N2C1=O)C(O)=O)c1ccco1.[Na]	InChI=1S/C16H16N4O8S.Na.H/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20;;/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24);;/b19-9+;;	FEWRHZJCOHFQHI-IZIWWREUSA-N	424.068884202							, 
Clopidogrelum [Latin]	LSM-15331	SID29215228, SID29215227, BRD-A93269281, SID50109846	2806	InChI=1S/C16H16ClNO2S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14/h2-5,7,9,15H,6,8,10H2,1H3	GKTWGGQPFAXNFI-UHFFFAOYSA-N	COC(=O)C(N1CCc2sccc2C1)c3ccccc3Cl	BroadT	BRD-A93269281	BRD-A93269281-003-01-0	Tocris Bioscience	2490	1	Cl	COC(=O)C(N1CCc2sccc2C1)c1ccccc1Cl.Cl	InChI=1S/C16H16ClNO2S.ClH/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14;/h2-5,7,9,15H,6,8,10H2,1H3;1H	XIHVAFJSGWDBGA-UHFFFAOYSA-N	321.059027162							103977, 103977, 103977, 103977, 103977
Acenocoumarol	LSM-5112	Nicoumalone, Acenocoumarol, Acenocoumarin	54676537	InChI=1S/C19H15NO6/c1-11(21)10-15(12-6-8-13(9-7-12)20(24)25)17-18(22)14-4-2-3-5-16(14)26-19(17)23/h2-9,15,22H,10H2,1H3	VABCILAOYCMVPS-UHFFFAOYSA-N	CC(=O)CC(C1=C(O)c2ccccc2OC1=O)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-A65051990	BRD-A65051990-001-03-8	Prestwick Chemical Inc.	Prestw-110	D0701-MP04-ST03-200-		CC(=O)CC(c1ccc(cc1)[N+]([O-])=O)c1c(O)c2ccccc2oc1=O	InChI=1S/C19H15NO6/c1-11(21)10-15(12-6-8-13(9-7-12)20(24)25)17-18(22)14-4-2-3-5-16(14)26-19(17)23/h2-9,15,22H,10H2,1H3	VABCILAOYCMVPS-UHFFFAOYSA-N	353.08993721							53766
Htfmt	LSM-1720	BRD-A66435872	124846	InChI=1S/C19H25F3N4O/c1-14(24-11-10-17-12-23-13-25-17)4-2-3-5-18(27)26-16-8-6-15(7-9-16)19(20,21)22/h6-9,12-14,24H,2-5,10-11H2,1H3,(H,23,25)(H,26,27)	PMKJGGBYYNEYPA-UHFFFAOYSA-N	CC(CCCCC(=O)Nc1ccc(cc1)C(F)(F)F)NCCc2c[nH]cn2	BroadT	BRD-A66435872	BRD-A66435872-313-01-8	Tocris Bioscience	646	2	OC(=O)C=CC(=O)O.OC(=O)C=CC(=O)O	CC(CCCCC(=O)Nc1ccc(cc1)C(F)(F)F)NCCc1c[nH]cn1.OC(=O)C=CC(=O)O.OC(=O)C=CC(=O)O	InChI=1S/C19H25F3N4O.2C4H4O4/c1-14(24-11-10-17-12-23-13-25-17)4-2-3-5-18(27)26-16-8-6-15(7-9-16)19(20,21)22;2*5-3(6)1-2-4(7)8/h6-9,12-14,24H,2-5,10-11H2,1H3,(H,23,25)(H,26,27);2*1-2H,(H,5,6)(H,7,8)	ODAOZWTYNWZSBY-UHFFFAOYSA-N	382.19804606							91812, 91812
Petcm	LSM-1917		224859	InChI=1S/C8H8Cl3NO/c9-8(10,11)7(13)5-6-1-3-12-4-2-6/h1-4,7,13H,5H2	NGTDJJKTGRNNAU-UHFFFAOYSA-N	OC(Cc1ccncc1)C(Cl)(Cl)Cl	BroadT	BRD-A93477898	BRD-A93477898-001-01-8	Sigma-Aldrich	P0871			OC(Cc1ccncc1)C(Cl)(Cl)Cl	InChI=1S/C8H8Cl3NO/c9-8(10,11)7(13)5-6-1-3-12-4-2-6/h1-4,7,13H,5H2	NGTDJJKTGRNNAU-UHFFFAOYSA-N	238.967147016							91963
AC1MN7OA	LSM-1928	BRD-A94675310	3298213	InChI=1S/C21H26N2O/c1-22(21(24)16-18-10-4-2-5-11-18)20(17-23-14-8-9-15-23)19-12-6-3-7-13-19/h2-7,10-13,20H,8-9,14-17H2,1H3	OVZWUDZIAAHNFG-UHFFFAOYSA-N	CN(C(CN1CCCC1)c2ccccc2)C(=O)Cc3ccccc3	BroadT	BRD-A94675310	BRD-A94675310-003-01-2	Tocris Bioscience	783	1	Cl	CN(C(CN1CCCC1)c1ccccc1)C(=O)Cc1ccccc1.Cl	InChI=1S/C21H26N2O.ClH/c1-22(21(24)16-18-10-4-2-5-11-18)20(17-23-14-8-9-15-23)19-12-6-3-7-13-19;/h2-7,10-13,20H,8-9,14-17H2,1H3;1H	BJJKMJWQLJIRGF-UHFFFAOYSA-N	322.204513472							91972
AC1N92C7	LSM-1822	BRD-A80641450	4353886	InChI=1S/C33H44N6O5/c1-22(2)18-26(37-33(44)39-16-10-4-5-11-17-39)30(40)35-27(19-23-21-38(3)29-14-7-6-13-25(23)29)31(41)36-28(32(42)43)20-24-12-8-9-15-34-24/h6-9,12-15,21-22,26-28H,4-5,10-11,16-20H2,1-3H3,(H,35,40)(H,36,41)(H,37,44)(H,42,43)	LIOKMIQQPDDTNO-UHFFFAOYSA-N	CC(C)CC(NC(=O)N1CCCCCC1)C(=O)NC(Cc2cn(C)c3ccccc23)C(=O)NC(Cc4ccccn4)C(=O)O	BroadT	BRD-A80641450	BRD-A80641450-001-01-4	Tocris Bioscience	1210	1		CC(C)CC(NC(=O)N1CCCCCC1)C(=O)NC(Cc1cn(C)c2ccccc12)C(=O)NC(Cc1ccccn1)C(O)=O	InChI=1S/C33H44N6O5/c1-22(2)18-26(37-33(44)39-16-10-4-5-11-17-39)30(40)35-27(19-23-21-38(3)29-14-7-6-13-25(23)29)31(41)36-28(32(42)43)20-24-12-8-9-15-34-24/h6-9,12-15,21-22,26-28H,4-5,10-11,16-20H2,1-3H3,(H,35,40)(H,36,41)(H,37,44)(H,42,43)	LIOKMIQQPDDTNO-UHFFFAOYSA-N	604.337318568							91886
AC1NQ6YI	LSM-1601	BRD-A49370193	5191289	InChI=1S/C11H12ClFN2/c1-7(14)6-15-3-2-8-4-10(13)9(12)5-11(8)15/h2-5,7H,6,14H2,1H3	XJJZQXUGLLXTHO-UHFFFAOYSA-N	CC(N)Cn1ccc2cc(F)c(Cl)cc12	BroadT	BRD-A49370193	BRD-A49370193-051-01-7	Tocris Bioscience	1854	1	OC(=O)/C=C/C(=O)O	CC(N)Cn1ccc2cc(F)c(Cl)cc12.OC(=O)/C=C/C(=O)O	InChI=1S/C11H12ClFN2.C4H4O4/c1-7(14)6-15-3-2-8-4-10(13)9(12)5-11(8)15;5-3(6)1-2-4(7)8/h2-5,7H,6,14H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+	CEPHEXXZGQBXGT-WLHGVMLRSA-N	226.067304314							91736
Tropanyl-3,5-dimethylbenzoate	LSM-1860	MDL-72422, Tropanyl 3,5-Dimethylbenzoate	2837530	InChI=1S/C17H23NO2/c1-11-6-12(2)8-13(7-11)17(19)20-16-9-14-4-5-15(10-16)18(14)3/h6-8,14-16H,4-5,9-10H2,1-3H3	HDDNYFLPWFSBLN-UHFFFAOYSA-N	CN1C2CCC1CC(C2)OC(=O)c3cc(C)cc(C)c3	BroadT	BRD-A84389633	BRD-A84389633-001-01-6	Biomol International Inc.	AC-564	2813-N1283		CN1C2CCC1CC(C2)OC(=O)c1cc(C)cc(C)c1	InChI=1S/C17H23NO2/c1-11-6-12(2)8-13(7-11)17(19)20-16-9-14-4-5-15(10-16)18(14)3/h6-8,14-16H,4-5,9-10H2,1-3H3	HDDNYFLPWFSBLN-UHFFFAOYSA-N	273.172878986							91921
Blebbistatin	LSM-6195	SID26752243, SID26752245	3476986	InChI=1S/C18H16N2O2/c1-12-7-8-15-14(11-12)16(21)18(22)9-10-20(17(18)19-15)13-5-3-2-4-6-13/h2-8,11,22H,9-10H2,1H3	LZAXPYOBKSJSEX-UHFFFAOYSA-N	Cc1ccc2N=C3N(CCC3(O)C(=O)c2c1)c4ccccc4	BroadT	BRD-A75817871	BRD-A75817871-001-02-6	Biomol International Inc.	EI-315	2840(V2)-3-N1305		Cc1ccc2N=C3N(CCC3(O)C(=O)c2c1)c1ccccc1	InChI=1S/C18H16N2O2/c1-12-7-8-15-14(11-12)16(21)18(22)9-10-20(17(18)19-15)13-5-3-2-4-6-13/h2-8,11,22H,9-10H2,1H3	LZAXPYOBKSJSEX-UHFFFAOYSA-N	292.121177772							75379
Narcotine	LSM-21629	Noscapine, (+/-)-Noscapine	4544	InChI=1S/C22H23NO7/c1-23-8-7-11-9-14-20(29-10-28-14)21(27-4)15(11)17(23)18-12-5-6-13(25-2)19(26-3)16(12)22(24)30-18/h5-6,9,17-18H,7-8,10H2,1-4H3	AKNNEGZIBPJZJG-UHFFFAOYSA-N	COc1ccc2C(OC(=O)c2c1OC)C3N(C)CCc4cc5OCOc5c(OC)c34	BroadT	BRD-A77907596	BRD-A77907596-001-01-9	AnalytiCon Discovery GmbH	NP-014159			COc1ccc2C(OC(=O)c2c1OC)C1N(C)CCc2cc3OCOc3c(OC)c12	InChI=1S/C22H23NO7/c1-23-8-7-11-9-14-20(29-10-28-14)21(27-4)15(11)17(23)18-12-5-6-13(25-2)19(26-3)16(12)22(24)30-18/h5-6,9,17-18H,7-8,10H2,1-4H3	AKNNEGZIBPJZJG-UHFFFAOYSA-N	413.147452086							110185, 110185, 110185
RO 106-9920	LSM-21630	BRD-A53134341	3906779	InChI=1S/C10H7N5OS/c16-17(8-4-2-1-3-5-8)10-7-6-9-11-13-14-15(9)12-10/h1-7H	JFSXSNSCPNFCDM-UHFFFAOYSA-N	O=S(c1ccccc1)c2ccc3nnnn3n2	BroadT	BRD-A53134341	BRD-A53134341-001-01-6	Tocris Bioscience	1778	1		O=S(c1ccccc1)c1ccc2nnnn2n1	InChI=1S/C10H7N5OS/c16-17(8-4-2-1-3-5-8)10-7-6-9-11-13-14-15(9)12-10/h1-7H	JFSXSNSCPNFCDM-UHFFFAOYSA-N	245.037130584							110186
Thalidomide	LSM-1914	Thalidomide, Thalomid, K-17	5426	InChI=1S/C13H10N2O4/c16-10-6-5-9(11(17)14-10)15-12(18)7-3-1-2-4-8(7)13(15)19/h1-4,9H,5-6H2,(H,14,16,17)	UEJJHQNACJXSKW-UHFFFAOYSA-N	O=C1CCC(N2C(=O)c3ccccc3C2=O)C(=O)N1	BroadT	BRD-A93255169	BRD-A93255169-001-06-9	Biomol International Inc.	T-115	2840(V2)-3-N1305		O=C1N(C2CCC(=O)NC2=O)C(=O)c2ccccc12	InChI=1S/C13H10N2O4/c16-10-6-5-9(11(17)14-10)15-12(18)7-3-1-2-4-8(7)13(15)19/h1-4,9H,5-6H2,(H,14,16,17)	UEJJHQNACJXSKW-UHFFFAOYSA-N	258.06405682							74947
C24H29CLO4	LSM-21631	Cyproterone Acetate	5702030	InChI=1S/C24H29ClO4/c1-12(26)24(29-13(2)27)8-6-16-14-10-20(25)19-11-21(28)15-9-18(15)23(19,4)17(14)5-7-22(16,24)3/h10-11,14-18H,5-9H2,1-4H3/t14?,15-,16?,17?,18+,22+,23+,24+/m1/s1	UWFYSQMTEOIJJG-WMANOXGZSA-N	CC(=O)O[C@@]1(CCC2C3C=C(Cl)C4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)C3CC[C@]12C)C(=O)C	BroadT	BRD-A95207036	BRD-A95207036-001-02-8	MicroSource Discovery Systems Inc.	1500216			CC(=O)O[C@@]1(CCC2C3C=C(Cl)C4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)C3CC[C@]12C)C(C)=O	InChI=1S/C24H29ClO4/c1-12(26)24(29-13(2)27)8-6-16-14-10-20(25)19-11-21(28)15-9-18(15)23(19,4)17(14)5-7-22(16,24)3/h10-11,14-18H,5-9H2,1-4H3/t14?,15-,16?,17?,18+,22+,23+,24+/m1/s1	UWFYSQMTEOIJJG-WMANOXGZSA-N	416.175437118							
Fenclonine	LSM-21632	Fenclonine, CP-10188	4652	InChI=1S/C9H10ClNO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)	NIGWMJHCCYYCSF-UHFFFAOYSA-N	NC(Cc1ccc(Cl)cc1)C(=O)O	BroadT	BRD-A81615860	BRD-A81615860-001-02-9	MicroSource Discovery Systems Inc.	1502162			NC(Cc1ccc(Cl)cc1)C(O)=O	InChI=1S/C9H10ClNO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)	NIGWMJHCCYYCSF-UHFFFAOYSA-N	199.04000628							110187
AC1NOPAJ	LSM-1907	BRD-A92585442	5092098	InChI=1S/C25H38O4/c1-4-5-16-14-17-15-18(26)6-10-23(17,2)19-7-11-24(3)20(22(16)19)8-12-25(24,29)13-9-21(27)28/h15-16,19-20,22,29H,4-14H2,1-3H3,(H,27,28)	DNHCHRGCTVRAFT-UHFFFAOYSA-N	CCCC1CC2=CC(=O)CCC2(C)C3CCC4(C)C(CCC4(O)CCC(=O)O)C13	BroadT	BRD-A92585442	BRD-A92585442-237-01-0	Tocris Bioscience	1672	1	[K]	CCCC1CC2=CC(=O)CCC2(C)C2CCC3(C)C(CCC3(O)CCC(O)=O)C12.[K]	InChI=1S/C25H38O4.K.H/c1-4-5-16-14-17-15-18(26)6-10-23(17,2)19-7-11-24(3)20(22(16)19)8-12-25(24,29)13-9-21(27)28;;/h15-16,19-20,22,29H,4-14H2,1-3H3,(H,27,28);;	CBXKTPNUIRRWJO-UHFFFAOYSA-N	402.277009696							91958
Atropine Sulfate	LSM-15608		3661	InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3	RKUNBYITZUJHSG-UHFFFAOYSA-N	CN1C2CCC1CC(C2)OC(=O)C(CO)c3ccccc3	BroadT	BRD-A93739713	BRD-A93739713-065-02-7	MicroSource Discovery Systems Inc.	1500131		OS(=O)(=O)O	CN1C2CCC1CC(C2)OC(=O)C(CO)c1ccccc1.OS(=O)(=O)O	InChI=1S/C17H23NO3.H2O4S/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;1-5(2,3)4/h2-6,13-16,19H,7-11H2,1H3;(H2,1,2,3,4)	VJFQPODMEGSXHC-UHFFFAOYSA-N	289.167793606							104243, 104243, 104243
Tetrahydroberberine	LSM-21633	Tetrahydroberberine, Canadine	34458	InChI=1S/C20H21NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,8-9,16H,5-7,10-11H2,1-2H3	VZTUIEROBZXUFA-UHFFFAOYSA-N	COc1ccc2CC3N(CCc4cc5OCOc5cc34)Cc2c1OC	BroadT	BRD-A69950438	BRD-A69950438-001-01-1	TimTec LLC	ST4056994			COc1ccc2CC3N(CCc4cc5OCOc5cc34)Cc2c1OC	InChI=1S/C20H21NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,8-9,16H,5-7,10-11H2,1-2H3	VZTUIEROBZXUFA-UHFFFAOYSA-N	339.147058162							22998, 22998
Mexiletine	LSM-1700	Mexilitene, Mexiletine	4178	InChI=1S/C11H17NO/c1-8-5-4-6-9(2)11(8)13-7-10(3)12/h4-6,10H,7,12H2,1-3H3	VLPIATFUUWWMKC-UHFFFAOYSA-N	CC(N)COc1c(C)cccc1C	BroadT	BRD-A64092382	BRD-A64092382-003-03-5	MicroSource Discovery Systems Inc.	1503929		Cl	CC(N)COc1c(C)cccc1C.Cl	InChI=1S/C11H17NO.ClH/c1-8-5-4-6-9(2)11(8)13-7-10(3)12;/h4-6,10H,7,12H2,1-3H3;1H	NFEIBWMZVIVJLQ-UHFFFAOYSA-N	179.131014174							6916, 6916
FPL-55712	LSM-1940	BRD-A96456596, CHEMBL267475, FPL-55712	105007	InChI=1S/C27H30O9/c1-4-6-19-22(10-8-17(15(3)28)25(19)31)34-13-16(29)14-35-23-11-9-18-21(30)12-24(27(32)33)36-26(18)20(23)7-5-2/h8-12,16,29,31H,4-7,13-14H2,1-3H3,(H,32,33)	LMQBMWHHGVZWMR-UHFFFAOYSA-N	CCCc1c(O)c(ccc1OCC(O)COc2ccc3C(=O)C=C(Oc3c2CCC)C(=O)O)C(=O)C	BroadT	BRD-A96456596	BRD-A96456596-001-01-4	Tocris Bioscience	2276	1		CCCc1c(OCC(O)COc2ccc3c(oc(cc3=O)C(O)=O)c2CCC)ccc(C(C)=O)c1O	InChI=1S/C27H30O9/c1-4-6-19-22(10-8-17(15(3)28)25(19)31)34-13-16(29)14-35-23-11-9-18-21(30)12-24(27(32)33)36-26(18)20(23)7-5-2/h8-12,16,29,31H,4-7,13-14H2,1-3H3,(H,32,33)	LMQBMWHHGVZWMR-UHFFFAOYSA-N	498.18898254							91977, 91977
AC1MS7KY	LSM-1591	BRD-A48257147	3579925	InChI=1S/C17H14N2O3/c20-16(18-11-6-2-1-3-7-11)17-10-13(17)15(19-21)12-8-4-5-9-14(12)22-17/h1-9,13,21H,10H2,(H,18,20)	FPXPIEZPAXSELW-UHFFFAOYSA-N	ON=C1C2CC2(Oc3ccccc13)C(=O)Nc4ccccc4	BroadT	BRD-A48257147	BRD-A48257147-001-01-9	Tocris Bioscience	1027	4		ON=C1C2CC2(Oc2ccccc12)C(=O)Nc1ccccc1	InChI=1S/C17H14N2O3/c20-16(18-11-6-2-1-3-7-11)17-10-13(17)15(19-21)12-8-4-5-9-14(12)22-17/h1-9,13,21H,10H2,(H,18,20)	FPXPIEZPAXSELW-UHFFFAOYSA-N	294.100442328							91731
Prieuranin Acetate	LSM-21634		6710640	InChI=1S/C40H52O17/c1-11-20(2)33(55-24(6)44)36(48)56-35-34(53-19-41)32(21(3)40(49)28(45)14-26(39(35,40)9)25-12-13-51-17-25)38(8)27(15-30(46)50-10)37(7,18-52-22(4)42)57-31(47)16-29(38)54-23(5)43/h12-13,17,19-20,26-27,29,32-35,49H,3,11,14-16,18H2,1-2,4-10H3/t20?,26-,27?,29-,32?,33?,34+,35-,37+,38+,39+,40?/m0/s1	NIDUTZAIIODVCH-FHNSGPDVSA-N	CCC(C)C(OC(=O)C)C(=O)O[C@H]1[C@H](OC=O)C(C(=C)C2(O)C(=O)C[C@@H](c3cocc3)[C@]12C)[C@@]4(C)[C@H](CC(=O)O[C@](C)(COC(=O)C)C4CC(=O)OC)OC(=O)C	BroadT	BRD-A64374397	BRD-A64374397-001-02-6	MicroSource Discovery Systems Inc.	100069			CCC(C)C(OC(C)=O)C(=O)O[C@H]1[C@H](OC=O)C(C(=C)C2(O)C(=O)C[C@@H](c3ccoc3)[C@]12C)[C@@]1(C)[C@H](CC(=O)O[C@](C)(COC(C)=O)C1CC(=O)OC)OC(C)=O	InChI=1S/C40H52O17/c1-11-20(2)33(55-24(6)44)36(48)56-35-34(53-19-41)32(21(3)40(49)28(45)14-26(39(35,40)9)25-12-13-51-17-25)38(8)27(15-30(46)50-10)37(7,18-52-22(4)42)57-31(47)16-29(38)54-23(5)43/h12-13,17,19-20,26-27,29,32-35,49H,3,11,14-16,18H2,1-2,4-10H3/t20?,26-,27?,29-,32?,33?,34+,35-,37+,38+,39+,40?/m0/s1	NIDUTZAIIODVCH-FHNSGPDVSA-N	804.320450204001							110188
CHEMBL372631	LSM-1574	UBP-302, BRD-A45499626	11674376	InChI=1S/C15H15N3O6/c16-11(14(22)23)8-17-6-5-12(19)18(15(17)24)7-9-3-1-2-4-10(9)13(20)21/h1-6,11H,7-8,16H2,(H,20,21)(H,22,23)	UUIYULWYHDSXHL-UHFFFAOYSA-N	NC(CN1C=CC(=O)N(Cc2ccccc2C(=O)O)C1=O)C(=O)O	BroadT	BRD-A45499626	BRD-A45499626-001-01-0	Tocris Bioscience	2078	1		NC(Cn1ccc(=O)n(Cc2ccccc2C(O)=O)c1=O)C(O)=O	InChI=1S/C15H15N3O6/c16-11(14(22)23)8-17-6-5-12(19)18(15(17)24)7-9-3-1-2-4-10(9)13(20)21/h1-6,11H,7-8,16H2,(H,20,21)(H,22,23)	UUIYULWYHDSXHL-UHFFFAOYSA-N	333.09608523							91719
Androstenedone	LSM-1933	BRD-A95513702, Androsta-1,4-Dien-3,17-Dione	6710699	InChI=1S/C19H24O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,11,14-16H,3-6,8,10H2,1-2H3/t14?,15?,16?,18-,19-/m0/s1	LUJVUUWNAPIQQI-WFZCBACDSA-N	C[C@]12CCC3C(CCC4=CC(=O)C=C[C@]34C)C1CCC2=O	BroadT	BRD-A95513702	BRD-A95513702-001-02-2	MicroSource Discovery Systems Inc.	1701001			C[C@]12CCC3C(CCC4=CC(=O)C=C[C@]34C)C1CCC2=O	InChI=1S/C19H24O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,11,14-16H,3-6,8,10H2,1-2H3/t14?,15?,16?,18-,19-/m0/s1	LUJVUUWNAPIQQI-WFZCBACDSA-N	284.177630008							
SM 21	LSM-15599	BRD-A92933783, SID26751869	4679312	InChI=1S/C18H24ClNO3/c1-3-17(22-15-8-4-12(19)5-9-15)18(21)23-16-10-13-6-7-14(11-16)20(13)2/h4-5,8-9,13-14,16-17H,3,6-7,10-11H2,1-2H3	WTPAXDRULIZRDJ-UHFFFAOYSA-N	CCC(Oc1ccc(Cl)cc1)C(=O)OC2CC3CCC(C2)N3C	BroadT	BRD-A92933783	BRD-A92933783-103-01-3	Tocris Bioscience	751	3	OC(=O)C=CC(=O)O	CCC(Oc1ccc(Cl)cc1)C(=O)OC1CC2CCC(C1)N2C.OC(=O)C=CC(=O)O	InChI=1S/C18H24ClNO3.C4H4O4/c1-3-17(22-15-8-4-12(19)5-9-15)18(21)23-16-10-13-6-7-14(11-16)20(13)2;5-3(6)1-2-4(7)8/h4-5,8-9,13-14,16-17H,3,6-7,10-11H2,1-2H3;1-2H,(H,5,6)(H,7,8)	BHXGTFUQDGMXHA-UHFFFAOYSA-N	337.144471348							104235, 104235
CHEMBL8197	LSM-1851	Tropisetron, SID50111279, SID90340826	5595	InChI=1S/C17H20N2O2/c1-19-11-6-7-12(19)9-13(8-11)21-17(20)15-10-18-16-5-3-2-4-14(15)16/h2-5,10-13,18H,6-9H2,1H3	ZNRGQMMCGHDTEI-UHFFFAOYSA-N	CN1C2CCC1CC(C2)OC(=O)c3c[nH]c4ccccc34	BroadT	BRD-A83859836	BRD-A83859836-001-01-4	Biomol International Inc.	AC-844	2813-N1283		CN1C2CCC1CC(C2)OC(=O)c1c[nH]c2ccccc12	InChI=1S/C17H20N2O2/c1-19-11-6-7-12(19)9-13(8-11)21-17(20)15-10-18-16-5-3-2-4-14(15)16/h2-5,10-13,18H,6-9H2,1H3	ZNRGQMMCGHDTEI-UHFFFAOYSA-N	284.1524779							91913, 91913
BIO2_000516	LSM-1836	BRD-A82329351, SID26756791	6610302	InChI=1S/C19H29NO6/c1-4-26-18(24)10-20-16(22)8-13(9-17(20)23)7-15(21)14-6-11(2)5-12(3)19(14)25/h11-15,21H,4-10H2,1-3H3/t11-,12-,14?,15+/m0/s1	KWCVNASRVVSXHH-LYUYJPIDSA-N	CCOC(=O)CN1C(=O)CC(C[C@@H](O)C2C[C@@H](C)C[C@H](C)C2=O)CC1=O	BroadT	BRD-A82329351	BRD-A82329351-001-02-2	Biomol International Inc.	IM-100	2840(V2)-3-N1305		CCOC(=O)CN1C(=O)CC(C[C@@H](O)C2C[C@@H](C)C[C@H](C)C2=O)CC1=O	InChI=1S/C19H29NO6/c1-4-26-18(24)10-20-16(22)8-13(9-17(20)23)7-15(21)14-6-11(2)5-12(3)19(14)25/h11-15,21H,4-10H2,1-3H3/t11-,12-,14?,15+/m0/s1	KWCVNASRVVSXHH-LYUYJPIDSA-N	367.199487658							91900
AC1NWAJL	LSM-1643	Testosterone, SID85302060	5701998	InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14?,15?,16?,17-,18-,19-/m0/s1	MUMGGOZAMZWBJJ-PPORCNLBSA-N	C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@@H]2O	BroadT	BRD-A55393291	BRD-A55393291-001-02-4	MicroSource Discovery Systems Inc.	307023			C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC[C@@H]2O	InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14?,15?,16?,17-,18-,19-/m0/s1	MUMGGOZAMZWBJJ-PPORCNLBSA-N	288.208930136							
AC1MSQZQ	LSM-1945	BRD-A96882008	3563638	InChI=1S/C22H18F6N2O3/c1-12(31)30-19(8-14-10-29-18-5-3-2-4-17(14)18)20(32)33-11-13-6-15(21(23,24)25)9-16(7-13)22(26,27)28/h2-7,9-10,19,29H,8,11H2,1H3,(H,30,31)	BYYQYXVAWXAYQC-UHFFFAOYSA-N	CC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc3cc(cc(c3)C(F)(F)F)C(F)(F)F	BroadT	BRD-A96882008	BRD-A96882008-001-01-3	Tocris Bioscience	868	2		CC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F	InChI=1S/C22H18F6N2O3/c1-12(31)30-19(8-14-10-29-18-5-3-2-4-17(14)18)20(32)33-11-13-6-15(21(23,24)25)9-16(7-13)22(26,27)28/h2-7,9-10,19,29H,8,11H2,1H3,(H,30,31)	BYYQYXVAWXAYQC-UHFFFAOYSA-N	472.122161656							91982
CHEMBL404099	LSM-1802	RK-682	25067890	InChI=1S/C21H36O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(23)19-20(24)18(16-22)26-21(19)25/h18-19,22H,2-16H2,1H3	CPQQKPHTOQWKMF-UHFFFAOYSA-N	CCCCCCCCCCCCCCCC(=O)C1C(=O)OC(CO)C1=O	BroadT	BRD-A77349281	BRD-A77349281-001-02-2	Biomol International Inc.	PR-112	2840(V2)-3-N1305		CCCCCCCCCCCCCCCC(=O)C1C(=O)OC(CO)C1=O	InChI=1S/C21H36O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(23)19-20(24)18(16-22)26-21(19)25/h18-19,22H,2-16H2,1H3	CPQQKPHTOQWKMF-UHFFFAOYSA-N	368.256274252							91874
2-Methylene-5-(2,5-dioxotetrahydrofuran-3-yl)-6-oxo--10,10-dimethylbicyclo[7: 2: 0]undecane	LSM-21635	SID26749594, BRD-A58803929	3554670	InChI=1S/C18H24O4/c1-10-4-5-11(12-8-16(20)22-17(12)21)15(19)7-6-14-13(10)9-18(14,2)3/h11-14H,1,4-9H2,2-3H3	HIFLEGNWVFLGLY-UHFFFAOYSA-N	CC1(C)CC2C1CCC(=O)C(CCC2=C)C3CC(=O)OC3=O	BroadT	BRD-A58803929	BRD-A58803929-001-02-9	MicroSource Discovery Systems Inc.	300104			CC1(C)CC2C1CCC(=O)C(CCC2=C)C1CC(=O)OC1=O	InChI=1S/C18H24O4/c1-10-4-5-11(12-8-16(20)22-17(12)21)15(19)7-6-14-13(10)9-18(14,2)3/h11-14H,1,4-9H2,2-3H3	HIFLEGNWVFLGLY-UHFFFAOYSA-N	304.167459248							110189
1,3-Dideacetylkhivorin	LSM-21636		6708624	InChI=1S/C28H38O8/c1-14(29)34-20-11-17-24(2,3)18(30)12-19(31)26(17,5)16-7-9-25(4)21(15-8-10-33-13-15)35-23(32)22-28(25,36-22)27(16,20)6/h8,10,13,16-22,30-31H,7,9,11-12H2,1-6H3/t16?,17?,18-,19+,20-,21+,22-,25+,26-,27+,28-/m1/s1	IOTBHDLEPFTSHN-QRUJPHNVSA-N	CC(=O)O[C@@H]1CC2C(C)(C)[C@H](O)C[C@H](O)[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@@]45[C@]13C)c6cocc6	BroadT	BRD-A67787745	BRD-A67787745-001-02-5	MicroSource Discovery Systems Inc.	100378			CC(=O)O[C@@H]1CC2C(C)(C)[C@H](O)C[C@H](O)[C@]2(C)C2CC[C@@]3(C)[C@@H](OC(=O)[C@H]4O[C@@]34[C@]12C)c1ccoc1	InChI=1S/C28H38O8/c1-14(29)34-20-11-17-24(2,3)18(30)12-19(31)26(17,5)16-7-9-25(4)21(15-8-10-33-13-15)35-23(32)22-28(25,36-22)27(16,20)6/h8,10,13,16-22,30-31H,7,9,11-12H2,1-6H3/t16?,17?,18-,19+,20-,21+,22-,25+,26-,27+,28-/m1/s1	IOTBHDLEPFTSHN-QRUJPHNVSA-N	502.256668176							
3-Nor-3-oxopanasinsan-6-ol	LSM-21637	SID26749597, BRD-A59682351	4579738	InChI=1S/C14H22O2/c1-12(2)8-14-9(12)6-7-13(14,3)10(15)4-5-11(14)16/h9-10,15H,4-8H2,1-3H3	UHRWOVVMQAASAO-UHFFFAOYSA-N	CC1(C)CC23C1CCC2(C)C(O)CCC3=O	BroadT	BRD-A59682351	BRD-A59682351-001-02-3	MicroSource Discovery Systems Inc.	300110			CC1(C)CC23C1CCC2(C)C(O)CCC3=O	InChI=1S/C14H22O2/c1-12(2)8-14-9(12)6-7-13(14,3)10(15)4-5-11(14)16/h9-10,15H,4-8H2,1-3H3	UHRWOVVMQAASAO-UHFFFAOYSA-N	222.161979944							110190
Dexlansoprazole	LSM-5064	Lansoprazole	3883	InChI=1S/C16H14F3N3O2S/c1-10-13(20-7-6-14(10)24-9-16(17,18)19)8-25(23)15-21-11-4-2-3-5-12(11)22-15/h2-7H,8-9H2,1H3,(H,21,22)	MJIHNNLFOKEZEW-UHFFFAOYSA-N	Cc1c(OCC(F)(F)F)ccnc1CS(=O)c2nc3ccccc3[nH]2	BroadT	BRD-A49172652	BRD-A49172652-001-13-1	Tocris Bioscience	2582	1		Cc1c(OCC(F)(F)F)ccnc1CS(=O)c1nc2ccccc2[nH]1	InChI=1S/C16H14F3N3O2S/c1-10-13(20-7-6-14(10)24-9-16(17,18)19)8-25(23)15-21-11-4-2-3-5-12(11)22-15/h2-7H,8-9H2,1H3,(H,21,22)	MJIHNNLFOKEZEW-UHFFFAOYSA-N	369.075882008							6375
Mirtazapine	LSM-1706	Mirtazapine, Remeron, ORG-3770, BRD-A64977602, Remeron Soltab	4205	InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3	RONZAEMNMFQXRA-UHFFFAOYSA-N	CN1CCN2C(C1)c3ccccc3Cc4cccnc24	BroadT	BRD-A64977602	BRD-A64977602-001-01-9	Biomol International Inc.	AC-1366	2813-N1283		CN1CCN2C(C1)c1ccccc1Cc1cccnc21	InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3	RONZAEMNMFQXRA-UHFFFAOYSA-N	265.157897638							6950
MLS000756415	LSM-1695	Methylergometrine, BRD-A63667919, SID26666677	4140	InChI=1S/C20H25N3O2/c1-3-14(11-24)22-20(25)13-7-16-15-5-4-6-17-19(15)12(9-21-17)8-18(16)23(2)10-13/h4-7,9,13-14,18,21,24H,3,8,10-11H2,1-2H3,(H,22,25)	UNBRKDKAWYKMIV-UHFFFAOYSA-N	CCC(CO)NC(=O)C1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34	BroadT	BRD-A63667919	BRD-A63667919-103-01-9	Tocris Bioscience	549	1	OC(=O)C=CC(=O)O	CCC(CO)NC(=O)C1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34.OC(=O)C=CC(=O)O	InChI=1S/C20H25N3O2.C4H4O4/c1-3-14(11-24)22-20(25)13-7-16-15-5-4-6-17-19(15)12(9-21-17)8-18(16)23(2)10-13;5-3(6)1-2-4(7)8/h4-7,9,13-14,18,21,24H,3,8,10-11H2,1-2H3,(H,22,25);1-2H,(H,5,6)(H,7,8)	NOFOWWRHEPHDCY-UHFFFAOYSA-N	339.19467707							91798, 91798
Isoxsuprine	LSM-1778	Isoxsuprine	3783	InChI=1S/C18H23NO3/c1-13(12-22-17-6-4-3-5-7-17)19-14(2)18(21)15-8-10-16(20)11-9-15/h3-11,13-14,18-21H,12H2,1-2H3	BMUKKTUHUDJSNZ-UHFFFAOYSA-N	CC(COc1ccccc1)NC(C)C(O)c2ccc(O)cc2	BroadT	BRD-A74269027	BRD-A74269027-003-03-8	Prestwick Chemical Inc.	Prestw-68	D0701-MP04-ST03-200-	Cl	CC(COc1ccccc1)NC(C)C(O)c1ccc(O)cc1.Cl	InChI=1S/C18H23NO3.ClH/c1-13(12-22-17-6-4-3-5-7-17)19-14(2)18(21)15-8-10-16(20)11-9-15;/h3-11,13-14,18-21H,12H2,1-2H3;1H	QVPSGVSNYPRFAS-UHFFFAOYSA-N	301.167793606							91855, 91855
Midodrine	LSM-1815	Midodrine	4195	InChI=1S/C12H18N2O4/c1-17-8-3-4-11(18-2)9(5-8)10(15)7-14-12(16)6-13/h3-5,10,15H,6-7,13H2,1-2H3,(H,14,16)	PTKSEFOSCHHMPD-UHFFFAOYSA-N	COc1ccc(OC)c(c1)C(O)CNC(=O)CN	BroadT	BRD-A79981887	BRD-A79981887-003-04-0	MicroSource Discovery Systems Inc.	1503257		Cl	COc1ccc(OC)c(c1)C(O)CNC(=O)CN.Cl	InChI=1S/C12H18N2O4.ClH/c1-17-8-3-4-11(18-2)9(5-8)10(15)7-14-12(16)6-13;/h3-5,10,15H,6-7,13H2,1-2H3,(H,14,16);1H	MGCQZNBCJBRZDT-UHFFFAOYSA-N	254.126657076							6933
PSB 36	LSM-1748	BRD-A70407468, SID26755021	11689583	InChI=1S/C21H30N4O3/c1-2-3-5-25-18(27)16-17(24(20(25)28)6-4-7-26)23-19(22-16)21-11-13-8-14(12-21)10-15(21)9-13/h13-15,26H,2-12H2,1H3,(H,22,23)	CIBIXJYFYPFMTN-UHFFFAOYSA-N	CCCCN1C(=O)N(CCCO)c2nc([nH]c2C1=O)C34CC5CC(CC3C5)C4	BroadT	BRD-A70407468	BRD-A70407468-001-01-2	Tocris Bioscience	2019	1		CCCCn1c(=O)n(CCCO)c2nc([nH]c2c1=O)C12CC3CC1CC(C2)C3	InChI=1S/C21H30N4O3/c1-2-3-5-25-18(27)16-17(24(20(25)28)6-4-7-26)23-19(22-16)21-11-13-8-14(12-21)10-15(21)9-13/h13-15,26H,2-12H2,1H3,(H,22,23)	CIBIXJYFYPFMTN-UHFFFAOYSA-N	386.23179086							91832
Meclizine	LSM-1607	Meclozine, Meclizine	4034	InChI=1S/C25H27ClN2/c1-20-6-5-7-21(18-20)19-27-14-16-28(17-15-27)25(22-8-3-2-4-9-22)23-10-12-24(26)13-11-23/h2-13,18,25H,14-17,19H2,1H3	OCJYIGYOJCODJL-UHFFFAOYSA-N	Cc1cccc(CN2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4)c1	BroadT	BRD-A50311610	BRD-A50311610-300-04-7	MicroSource Discovery Systems Inc.	1500376		Cl.Cl	Cc1cccc(CN2CCN(CC2)C(c2ccccc2)c2ccc(Cl)cc2)c1.Cl.Cl	InChI=1S/C25H27ClN2.2ClH/c1-20-6-5-7-21(18-20)19-27-14-16-28(17-15-27)25(22-8-3-2-4-9-22)23-10-12-24(26)13-11-23;;/h2-13,18,25H,14-17,19H2,1H3;2*1H	VCTHNOIYJIXQLV-UHFFFAOYSA-N	390.186276594							6709, 6709, 6709, 6709
NSC695672	LSM-21638	SID524900, BRD-A83387524	393593	InChI=1S/C18H18ClIN6O4/c1-21-16(29)13-11(27)12(28)17(30-13)26-7-23-10-14(24-18(19)25-15(10)26)22-6-8-3-2-4-9(20)5-8/h2-5,7,11-13,17,27-28H,6H2,1H3,(H,21,29)(H,22,24,25)	IPSYPUKKXMNCNQ-UHFFFAOYSA-N	CNC(=O)C1OC(C(O)C1O)n2cnc3c(NCc4cccc(I)c4)nc(Cl)nc23	BroadT	BRD-A83387524	BRD-A83387524-001-01-3	Tocris Bioscience	1104	6		CNC(=O)C1OC(C(O)C1O)n1cnc2c(NCc3cccc(I)c3)nc(Cl)nc12	InChI=1S/C18H18ClIN6O4/c1-21-16(29)13-11(27)12(28)17(30-13)26-7-23-10-14(24-18(19)25-15(10)26)22-6-8-3-2-4-9(20)5-8/h2-5,7,11-13,17,27-28H,6H2,1H3,(H,21,29)(H,22,24,25)	IPSYPUKKXMNCNQ-UHFFFAOYSA-N	544.012273826							110191
Sulpiride	LSM-5080	Dogmatyl, Sulpiride	5355	InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)	BGRJTUBHPOOWDU-UHFFFAOYSA-N	CCN1CCCC1CNC(=O)c2cc(ccc2OC)S(=O)(=O)N	BroadT	BRD-A55272860	BRD-A55272860-001-03-9	Biomol International Inc.	AC-848	2813-N1283		CCN1CCCC1CNC(=O)c1cc(ccc1OC)S(N)(=O)=O	InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)	BGRJTUBHPOOWDU-UHFFFAOYSA-N	341.140926936							32168
Dihydroptaeroxylin	LSM-1900		612556	InChI=1S/C15H16O4/c1-8-3-4-10-12(18-7-8)6-13-14(15(10)17)11(16)5-9(2)19-13/h5-6,8,17H,3-4,7H2,1-2H3	XSGWRNKNCNDJLK-UHFFFAOYSA-N	CC1CCc2c(O)c3C(=O)C=C(C)Oc3cc2OC1	BroadT	BRD-A91477472	BRD-A91477472-001-02-2	MicroSource Discovery Systems Inc.	100719			CC1CCc2c(OC1)cc1oc(C)cc(=O)c1c2O	InChI=1S/C15H16O4/c1-8-3-4-10-12(18-7-8)6-13-14(15(10)17)11(16)5-9(2)19-13/h5-6,8,17H,3-4,7H2,1-2H3	XSGWRNKNCNDJLK-UHFFFAOYSA-N	260.104858992							91955
Medetomidine	LSM-1722	BRD-A66563878	68602	InChI=1S/C13H16N2/c1-9-5-4-6-12(10(9)2)11(3)13-7-14-8-15-13/h4-8,11H,1-3H3,(H,14,15)	CUHVIMMYOGQXCV-UHFFFAOYSA-N	CC(c1cnc[nH]1)c2cccc(C)c2C	BroadT	BRD-A66563878	BRD-A66563878-003-01-8	Tocris Bioscience	2023	1	Cl	CC(c1cnc[nH]1)c1cccc(C)c1C.Cl	InChI=1S/C13H16N2.ClH/c1-9-5-4-6-12(10(9)2)11(3)13-7-14-8-15-13;/h4-8,11H,1-3H3,(H,14,15);1H	VPNGEIHDPSLNMU-UHFFFAOYSA-N	200.131348532							48552, 48552
Hydroxyzine Pamoate	LSM-44962	"10246-75-0, Vistaril, Hydroxyzine, ""Hy-Pam """"""""25"""""""""", Hydroxyzine Pamoate, HY-Pam"	25096	InChI=1S/C23H16O6.C21H27ClN2O2/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;22-20-8-6-19(7-9-20)21(18-4-2-1-3-5-18)24-12-10-23(11-13-24)14-16-26-17-15-25/h1-10,24-25H,11H2,(H,26,27)(H,28,29);1-9,21,25H,10-17H2	ASDOKGIIKXGMNB-UHFFFAOYSA-N	OCCOCCN1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3.OC(=O)c4cc5ccccc5c(Cc6c(O)c(cc7ccccc67)C(=O)O)c4O	BroadT	BRD-A62428732	BRD-A62428732-096-02-6	MicroSource Discovery Systems Inc.	1500345		OC(=O)c1cc2ccccc2c(Cc3c(O)c(cc4ccccc34)C(=O)O)c1O	OCCOCCN1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1.OC(=O)c1cc2ccccc2c(Cc3c(O)c(cc4ccccc34)C(=O)O)c1O	InChI=1S/C23H16O6.C21H27ClN2O2/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;22-20-8-6-19(7-9-20)21(18-4-2-1-3-5-18)24-12-10-23(11-13-24)14-16-26-17-15-25/h1-10,24-25H,11H2,(H,26,27)(H,28,29);1-9,21,25H,10-17H2	ASDOKGIIKXGMNB-UHFFFAOYSA-N	762.270794066001							31680, 31680, 31680, 31680
ZM-226600	LSM-21639	ZM226600, SID26751940	5240098	InChI=1S/C16H14F3NO4S/c1-15(22,16(17,18)19)14(21)20-11-7-9-13(10-8-11)25(23,24)12-5-3-2-4-6-12/h2-10,22H,1H3,(H,20,21)	LJLXQHHFAKVTNP-UHFFFAOYSA-N	CC(O)(C(=O)Nc1ccc(cc1)S(=O)(=O)c2ccccc2)C(F)(F)F	BroadT	BRD-A62209527	BRD-A62209527-001-02-9	Biomol International Inc.	AC-114	2840(V2)-3-N1305		CC(O)(C(=O)Nc1ccc(cc1)S(=O)(=O)c1ccccc1)C(F)(F)F	InChI=1S/C16H14F3NO4S/c1-15(22,16(17,18)19)14(21)20-11-7-9-13(10-8-11)25(23,24)12-5-3-2-4-6-12/h2-10,22H,1H3,(H,20,21)	LJLXQHHFAKVTNP-UHFFFAOYSA-N	373.059563228							110192
BSPBIO_002272	LSM-43968	Cefprozil	10253795	InChI=1S/C18H19N3O5S/c1-2-3-10-8-27-17-13(16(24)21(17)14(10)18(25)26)20-15(23)12(19)9-4-6-11(22)7-5-9/h2-7,12-13,17,22H,8,19H2,1H3,(H,20,23)(H,25,26)/b3-2-	WDLWHQDACQUCJR-IHWYPQMZSA-N	C\C=C/C1=C(N2C(SC1)C(NC(=O)C(N)c3ccc(O)cc3)C2=O)C(=O)O	BroadT	BRD-A85137183	BRD-A85137183-001-01-2	MicroSource Discovery Systems Inc.	1505364			C\C=C/C1=C(N2C(SC1)C(NC(=O)C(N)c1ccc(O)cc1)C2=O)C(O)=O	InChI=1S/C18H19N3O5S/c1-2-3-10-8-27-17-13(16(24)21(17)14(10)18(25)26)20-15(23)12(19)9-4-6-11(22)7-5-9/h2-7,12-13,17,22H,8,19H2,1H3,(H,20,23)(H,25,26)/b3-2-	WDLWHQDACQUCJR-IHWYPQMZSA-N	389.104541428							
CHEMBL109783	LSM-15205	BRD-A83650191	4038180	InChI=1S/C14H19N3O3S/c1-21(19,20)17-13-10-3-2-4-11(14-15-7-8-16-14)9(10)5-6-12(13)18/h5-6,11,17-18H,2-4,7-8H2,1H3,(H,15,16)	OQFCXJDXHCDLHX-UHFFFAOYSA-N	CS(=O)(=O)Nc1c(O)ccc2C(CCCc12)C3=NCCN3	BroadT	BRD-A83650191	BRD-A83650191-004-01-0	Tocris Bioscience	1052	2	Br	CS(=O)(=O)Nc1c(O)ccc2C(CCCc12)C1=NCCN1.Br	InChI=1S/C14H19N3O3S.BrH/c1-21(19,20)17-13-10-3-2-4-11(14-15-7-8-16-14)9(10)5-6-12(13)18;/h5-6,11,17-18H,2-4,7-8H2,1H3,(H,15,16);1H	LRFLWCZMTGTUEP-UHFFFAOYSA-N	309.114712188							103854, 103854
Colchine	LSM-6449	BRD-A46684810, SID26747941, SID49671357	2833	InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)	IAKHMKGGTNLKSZ-UHFFFAOYSA-N	COC1=CC=C2C(=CC1=O)C(CCc3cc(OC)c(OC)c(OC)c23)NC(=O)C	BroadT	BRD-A46684810	BRD-A46684810-001-04-6	Tocris Bioscience	1364	1		COc1cc2CCC(NC(C)=O)c3cc(=O)c(OC)ccc3-c2c(OC)c1OC	InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)	IAKHMKGGTNLKSZ-UHFFFAOYSA-N	399.16818753							23359
Hyoscine N-Oxide	LSM-1606	Scopolamin-N-Oxide Hydrobromide	3000667	InChI=1S/C17H21NO5/c1-18(21)13-7-11(8-14(18)16-15(13)23-16)22-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11?,12-,13-,14+,15-,16+,18?/m1/s1	GSYQNAMOFFWAPF-IILNCVEESA-N	C[N+]1([O-])[C@H]2CC(C[C@@H]1[C@H]3O[C@@H]23)OC(=O)[C@H](CO)c4ccccc4	BroadT	BRD-A49906757	BRD-A49906757-004-03-1	Prestwick Chemical Inc.	Prestw-232	D0701-MP04-ST03-200-	Br	C[N+]1([O-])[C@H]2C[C@@H](C[C@@H]1[C@H]1O[C@@H]21)OC(=O)[C@H](CO)c1ccccc1.Br	InChI=1S/C17H21NO5.BrH/c1-18(21)13-7-11(8-14(18)16-15(13)23-16)22-17(20)12(9-19)10-5-3-2-4-6-10;/h2-6,11-16,19H,7-9H2,1H3;1H/t11-,12-,13-,14+,15-,16+,18?;/m1./s1	MGNNYKWRWHQLCR-FDJOISAFSA-N	319.141972782							91738
7-[4-(2-Hydroxyphenyl)-2-(trifluoromethyl)-1,3-dioxan-5-yl]hept-5-enoic acid	LSM-1619	BRD-A51929314	3392534	InChI=1S/C18H21F3O5/c19-18(20,21)17-25-11-12(7-3-1-2-4-10-15(23)24)16(26-17)13-8-5-6-9-14(13)22/h1,3,5-6,8-9,12,16-17,22H,2,4,7,10-11H2,(H,23,24)	ZWAVGFSZMACJHA-UHFFFAOYSA-N	OC(=O)CCCC=CCC1COC(OC1c2ccccc2O)C(F)(F)F	BroadT	BRD-A51929314	BRD-A51929314-001-01-4	Tocris Bioscience	836	2		OC(=O)CCCC=CCC1COC(OC1c1ccccc1O)C(F)(F)F	InChI=1S/C18H21F3O5/c19-18(20,21)17-25-11-12(7-3-1-2-4-10-15(23)24)16(26-17)13-8-5-6-9-14(13)22/h1,3,5-6,8-9,12,16-17,22H,2,4,7,10-11H2,(H,23,24)	ZWAVGFSZMACJHA-UHFFFAOYSA-N	374.134108372							91744
CHEMBL277800	LSM-1837	BRD-A82371568, SID50112931	354624	InChI=1S/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)	WDDPHFBMKLOVOX-UHFFFAOYSA-N	Nc1nc(Cl)nc2c1ncn2C3OC(CO)C(O)C3F	BroadT	BRD-A82371568	BRD-A82371568-001-01-5	Tocris Bioscience	2600	1		Nc1nc(Cl)nc2n(cnc12)C1OC(CO)C(O)C1F	InChI=1S/C10H11ClFN5O3/c11-10-15-7(13)5-8(16-10)17(2-14-5)9-4(12)6(19)3(1-18)20-9/h2-4,6,9,18-19H,1H2,(H2,13,15,16)	WDDPHFBMKLOVOX-UHFFFAOYSA-N	303.053445172							91901
Naltrexone-HCl	LSM-1850	BRD-A83855350	4428	InChI=1S/C20H23NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,15,18,22,24H,1-2,5-10H2	DQCKKXVULJGBQN-UHFFFAOYSA-N	Oc1ccc2CC3N(CC4CC4)CCC56C(Oc1c25)C(=O)CCC36O	BroadT	BRD-A83855350	BRD-A83855350-003-01-4	Tocris Bioscience	677	4	Cl	Oc1ccc2CC3N(CC4CC4)CCC45C(Oc1c24)C(=O)CCC35O.Cl	InChI=1S/C20H23NO4.ClH/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11;/h3-4,11,15,18,22,24H,1-2,5-10H2;1H	RHBRMCOKKKZVRY-UHFFFAOYSA-N	341.162708226							91912
Molindone	LSM-1709	Moban, Molindone	23897	InChI=1S/C16H24N2O2/c1-3-13-11(2)17-14-5-4-12(16(19)15(13)14)10-18-6-8-20-9-7-18/h12,17H,3-10H2,1-2H3	KLPWJLBORRMFGK-UHFFFAOYSA-N	CCc1c(C)[nH]c2CCC(CN3CCOCC3)C(=O)c12	BroadT	BRD-A65280694	BRD-A65280694-003-03-8	Prestwick Chemical Inc.	Prestw-1035	D0701-MP04-ST03-200-	Cl	CCc1c(C)[nH]c2CCC(CN3CCOCC3)C(=O)c12.Cl	InChI=1S/C16H24N2O2.ClH/c1-3-13-11(2)17-14-5-4-12(16(19)15(13)14)10-18-6-8-20-9-7-18;/h12,17H,3-10H2,1-2H3;1H	GQWNECFJGBQMBO-UHFFFAOYSA-N	276.183778028							6965, 6965
SPECTRUM_000249	LSM-21641	Neohesperidin Dihydrochalcone	5702145	InChI=1S/C28H36O15/c1-11-21(34)23(36)25(38)27(40-11)43-26-24(37)22(35)19(10-29)42-28(26)41-13-8-16(32)20(17(33)9-13)14(30)5-3-12-4-6-18(39-2)15(31)7-12/h4,6-9,11,19,21-29,31-38H,3,5,10H2,1-2H3/t11-,19+,21-,22?,23+,24-,25+,26?,27-,28+/m0/s1	ITVGXXMINPYUHD-YEQDQGAISA-N	COc1ccc(CCC(=O)c2c(O)cc(O[C@@H]3O[C@H](CO)C(O)[C@H](O)C3O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc2O)cc1O	BroadT	BRD-A84867566	BRD-A84867566-001-02-0	MicroSource Discovery Systems Inc.	1500750			COc1ccc(CCC(=O)c2c(O)cc(O[C@@H]3O[C@H](CO)C(O)[C@H](O)C3O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)cc2O)cc1O	InChI=1S/C28H36O15/c1-11-21(34)23(36)25(38)27(40-11)43-26-24(37)22(35)19(10-29)42-28(26)41-13-8-16(32)20(17(33)9-13)14(30)5-3-12-4-6-18(39-2)15(31)7-12/h4,6-9,11,19,21-29,31-38H,3,5,10H2,1-2H3/t11-,19+,21-,22?,23+,24-,25+,26?,27-,28+/m0/s1	ITVGXXMINPYUHD-YEQDQGAISA-N	612.205420452							110194
KBIO3_000927	LSM-21642	BRD-A48478073	6708569	InChI=1S/C28H36O7/c1-26(2)20(13-21(29)32-5)28(4)18-7-9-27(3)19(16(18)11-17(23(26)30)24(28)31)12-22(33-6)35-25(27)15-8-10-34-14-15/h8,10,14,17-18,20,22,25H,7,9,11-13H2,1-6H3/t17-,18?,20-,22?,25-,27+,28+/m0/s1	CCIZHVYHJSDEGH-OSXQZZJFSA-N	COC1CC2=C3C[C@H]4C(=O)C(C)(C)[C@H](CC(=O)OC)[C@@](C)(C3CC[C@@]2(C)[C@@H](O1)c5cocc5)C4=O	BroadT	BRD-A48478073	BRD-A48478073-001-02-7	MicroSource Discovery Systems Inc.	100158			COC1CC2=C3C[C@H]4C(=O)C(C)(C)[C@H](CC(=O)OC)[C@@](C)(C3CC[C@@]2(C)[C@@H](O1)c1ccoc1)C4=O	InChI=1S/C28H36O7/c1-26(2)20(13-21(29)32-5)28(4)18-7-9-27(3)19(16(18)11-17(23(26)30)24(28)31)12-22(33-6)35-25(27)15-8-10-34-14-15/h8,10,14,17-18,20,22,25H,7,9,11-13H2,1-6H3/t17-,18?,20-,22?,25-,27+,28+/m0/s1	CCIZHVYHJSDEGH-OSXQZZJFSA-N	484.246103492							
REV-5901	LSM-1734	REV-5901, REV-901	5059	InChI=1S/C22H25NO2/c1-2-3-4-12-22(24)18-9-7-10-20(15-18)25-16-19-14-13-17-8-5-6-11-21(17)23-19/h5-11,13-15,22,24H,2-4,12,16H2,1H3	JRLOEMCOOZSCQP-UHFFFAOYSA-N	CCCCCC(O)c1cccc(OCc2ccc3ccccc3n2)c1	BroadT	BRD-A68281735	BRD-A68281735-001-02-0	Biomol International Inc.	EI209-0010			CCCCCC(O)c1cccc(OCc2ccc3ccccc3n2)c1	InChI=1S/C22H25NO2/c1-2-3-4-12-22(24)18-9-7-10-20(15-18)25-16-19-14-13-17-8-5-6-11-21(17)23-19/h5-11,13-15,22,24H,2-4,12,16H2,1H3	JRLOEMCOOZSCQP-UHFFFAOYSA-N	335.18852905							91821
Gatifloxacin	LSM-5139	Zymaxid, Zymar, Tequin, Gatifloxacin, BMS-206584-01, AM-1155	5379	InChI=1S/C19H22FN3O4/c1-10-8-22(6-5-21-10)16-14(20)7-12-15(18(16)27-2)23(11-3-4-11)9-13(17(12)24)19(25)26/h7,9-11,21H,3-6,8H2,1-2H3,(H,25,26)	XUBOMFCQGDBHNK-UHFFFAOYSA-N	COc1c(N2CCNC(C)C2)c(F)cc3C(=O)C(=CN(C4CC4)c13)C(=O)O	BroadT	BRD-A74980173	BRD-A74980173-001-02-8	MicroSource Discovery Systems Inc.	1504272			COc1c(N2CCNC(C)C2)c(F)cc2c1n(cc(C(O)=O)c2=O)C1CC1	InChI=1S/C19H22FN3O4/c1-10-8-22(6-5-21-10)16-14(20)7-12-15(18(16)27-2)23(11-3-4-11)9-13(17(12)24)19(25)26/h7,9-11,21H,3-6,8H2,1-2H3,(H,25,26)	XUBOMFCQGDBHNK-UHFFFAOYSA-N	375.159434414							5280, 5280
CHEBI:48565	LSM-1614	Yohimbine, SID26657972, SID477087, Yohimbine Hydrochloride	2866	InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3	BLGXFZZNTVWLAY-UHFFFAOYSA-N	COC(=O)C1C(O)CCC2CN3CCc4c([nH]c5ccccc45)C3CC12	BroadT	BRD-A51410489	BRD-A51410489-001-01-4	AnalytiCon Discovery GmbH	NP-003301			COC(=O)C1C(O)CCC2CN3CCc4c([nH]c5ccccc45)C3CC12	InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3	BLGXFZZNTVWLAY-UHFFFAOYSA-N	354.194342712							48565, 48565
100599-27-7	LSM-1878	BRD-A87479750	57946	InChI=1S/C14H9ClN2O3S/c15-7-3-4-9-8(6-7)11(13(19)17(9)14(16)20)12(18)10-2-1-5-21-10/h1-6,11H,(H2,16,20)	IGPDWKCUDHIIRL-UHFFFAOYSA-N	NC(=O)N1C(=O)C(C(=O)c2cccs2)c3cc(Cl)ccc13	BroadT	BRD-A87479750	BRD-A87479750-001-01-9	Tocris Bioscience	2580	1		NC(=O)N1C(=O)C(C(=O)c2cccs2)c2cc(Cl)ccc12	InChI=1S/C14H9ClN2O3S/c15-7-3-4-9-8(6-7)11(13(19)17(9)14(16)20)12(18)10-2-1-5-21-10/h1-6,11H,(H2,16,20)	IGPDWKCUDHIIRL-UHFFFAOYSA-N	320.002240568							91938
Flurbiprofen	LSM-5174	Ocufen, Flurbiprofen, Ansaid, U-27182, BTS-18322, BTS 18322	3394	InChI=1S/C15H13FO2/c1-10(15(17)18)12-7-8-13(14(16)9-12)11-5-3-2-4-6-11/h2-10H,1H3,(H,17,18)	SYTBZMRGLBWNTM-UHFFFAOYSA-N	CC(C(=O)O)c1ccc(c(F)c1)c2ccccc2	BroadT	BRD-A86044036	BRD-A86044036-001-04-2	MicroSource Discovery Systems Inc.	1500308			CC(C(O)=O)c1ccc(c(F)c1)-c1ccccc1	InChI=1S/C15H13FO2/c1-10(15(17)18)12-7-8-13(14(16)9-12)11-5-3-2-4-6-11/h2-10H,1H3,(H,17,18)	SYTBZMRGLBWNTM-UHFFFAOYSA-N	244.089957856							5130, 5130
Venlafaxine	LSM-1616	Effexor, Venlafaxine	5656	InChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3	PNVNVHUZROJLTJ-UHFFFAOYSA-N	COc1ccc(cc1)C(CN(C)C)C2(O)CCCCC2	BroadT	BRD-A51714012	BRD-A51714012-001-02-3	MicroSource Discovery Systems Inc.	1504171			COc1ccc(cc1)C(CN(C)C)C1(O)CCCCC1	InChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3	PNVNVHUZROJLTJ-UHFFFAOYSA-N	277.204179114							9943, 9943, 9943
Fusidate	LSM-43308	Fusidate, Prestwick3_000390, Fusidic Acid	11973017	InChI=1S/C31H48O6/c1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32/h9,18,21-25,27,33-34H,8,10-16H2,1-7H3,(H,35,36)/b26-20-/t18-,21?,22-,23+,24+,25-,27-,29-,30-,31-/m0/s1	IECPWNUMDGFDKC-CDSRIIBBSA-N	C[C@@H]1[C@H](O)CC[C@@]2(C)C1CC[C@@]3(C)[C@H]2[C@H](O)C[C@H]4\C(=C(/CCC=C(C)C)\C(=O)O)\[C@H](C[C@]34C)OC(=O)C	BroadT	BRD-A78085235	BRD-A78085235-236-02-0	Prestwick Chemical Inc.	Prestw-390	D0701-MP04-ST03-200-	[Na]	C[C@@H]1[C@H](O)CC[C@@]2(C)C1CC[C@@]1(C)[C@H]2[C@H](O)C[C@@H]2[C@]1(C)C[C@H](OC(C)=O)\C2=C(\CCC=C(C)C)C(O)=O.[Na]	InChI=1S/C31H48O6.Na.H/c1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32;;/h9,18,21-25,27,33-34H,8,10-16H2,1-7H3,(H,35,36);;/b26-20-;;/t18-,21?,22-,23+,24+,25-,27-,29-,30-,31-;;/m0../s1	FGTQSDNPFTWCGG-GHSPNSPOSA-N	516.345089256							, 
Mepenzolate	LSM-5102	Mepenzolate, Mepenzolate Bromide	4057	InChI=1S/C21H26NO3/c1-22(2)15-9-14-19(16-22)25-20(23)21(24,17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19,24H,9,14-16H2,1-2H3/q+1	GKNPSSNBBWDAGH-UHFFFAOYSA-N	C[N+]1(C)CCCC(C1)OC(=O)C(O)(c2ccccc2)c3ccccc3	BroadT	BRD-A62421304	BRD-A62421304-004-04-9	MicroSource Discovery Systems Inc.	1500383		Br	C[N+]1(C)CCCC(C1)OC(=O)C(O)(c1ccccc1)c1ccccc1.Br	InChI=1S/C21H26NO3.BrH/c1-22(2)15-9-14-19(16-22)25-20(23)21(24,17-10-5-3-6-11-17)18-12-7-4-8-13-18;/h3-8,10-13,19,24H,9,14-16H2,1-2H3;1H/q+1;	JRRNZNSGDSFFIR-UHFFFAOYSA-N	340.191268702							94411, 94411
Cyclosporin A	LSM-42829	Ciclosporin, SID124891621, SID26747463, SID26747464, Cyclosporin-A	5280754	InChI=1S/C62H111N11O12/c1-25-27-28-40(15)52(75)51-56(79)65-43(26-2)58(81)67(18)33-48(74)68(19)44(29-34(3)4)55(78)66-49(38(11)12)61(84)69(20)45(30-35(5)6)54(77)63-41(16)53(76)64-42(17)57(80)70(21)46(31-36(7)8)59(82)71(22)47(32-37(9)10)60(83)72(23)50(39(13)14)62(85)73(51)24/h25,27,34-47,49-52,75H,26,28-33H2,1-24H3,(H,63,77)(H,64,76)(H,65,79)(H,66,78)/b27-25+	PMATZTZNYRCHOR-IMVLJIQESA-N	CCC1NC(=O)C(C(O)C(C)C\C=C\C)N(C)C(=O)C(C(C)C)N(C)C(=O)C(CC(C)C)N(C)C(=O)C(CC(C)C)N(C)C(=O)C(C)NC(=O)C(C)NC(=O)C(CC(C)C)N(C)C(=O)C(NC(=O)C(CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C	BroadT	BRD-A69815203	BRD-A69815203-001-02-7	MicroSource Discovery Systems Inc.	1502202			CCC1NC(=O)C(C(O)C(C)C\C=C\C)N(C)C(=O)C(C(C)C)N(C)C(=O)C(CC(C)C)N(C)C(=O)C(CC(C)C)N(C)C(=O)C(C)NC(=O)C(C)NC(=O)C(CC(C)C)N(C)C(=O)C(NC(=O)C(CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C	InChI=1S/C62H111N11O12/c1-25-27-28-40(15)52(75)51-56(79)65-43(26-2)58(81)67(18)33-48(74)68(19)44(29-34(3)4)55(78)66-49(38(11)12)61(84)69(20)45(30-35(5)6)54(77)63-41(16)53(76)64-42(17)57(80)70(21)46(31-36(7)8)59(82)71(22)47(32-37(9)10)60(83)72(23)50(39(13)14)62(85)73(51)24/h25,27,34-47,49-52,75H,26,28-33H2,1-24H3,(H,63,77)(H,64,76)(H,65,79)(H,66,78)/b27-25+	PMATZTZNYRCHOR-IMVLJIQESA-N	1201.841368102							
Fipronil	LSM-1608		3352	InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2	ZOCSXAVNDGMNBV-UHFFFAOYSA-N	Nc1c(c(nn1c2c(Cl)cc(cc2Cl)C(F)(F)F)C#N)S(=O)C(F)(F)F	BroadT	BRD-A50675702	BRD-A50675702-001-03-0	Biomol International Inc.	CM-102	2840(V2)-3-N1305		Nc1c(c(nn1-c1c(Cl)cc(cc1Cl)C(F)(F)F)C#N)S(=O)C(F)(F)F	InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2	ZOCSXAVNDGMNBV-UHFFFAOYSA-N	435.938706098							83394
Oxybutynin	LSM-5111	Anturol, Ditropan, Oxybutynin, Oxytrol, Oxytrol For Women	4634	InChI=1S/C22H31NO3/c1-3-23(4-2)17-11-12-18-26-21(24)22(25,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5,7-8,13-14,20,25H,3-4,6,9-10,15-18H2,1-2H3	XIQVNETUBQGFHX-UHFFFAOYSA-N	CCN(CC)CC#CCOC(=O)C(O)(C1CCCCC1)c2ccccc2	BroadT	BRD-A65013509	BRD-A65013509-003-03-8	Prestwick Chemical Inc.	Prestw-287	D0701-MP04-ST03-200-	Cl	CCN(CC)CC#CCOC(=O)C(O)(C1CCCCC1)c1ccccc1.Cl	InChI=1S/C22H31NO3.ClH/c1-3-23(4-2)17-11-12-18-26-21(24)22(25,19-13-7-5-8-14-19)20-15-9-6-10-16-20;/h5,7-8,13-14,20,25H,3-4,6,9-10,15-18H2,1-2H3;1H	SWIJYDAEGSIQPZ-UHFFFAOYSA-N	357.230393862							7856, 7856
Ciprofibrate	LSM-1600	52214-84-3, Ciprofibrate, WIN-35833	2763	InChI=1S/C13H14Cl2O3/c1-12(2,11(16)17)18-9-5-3-8(4-6-9)10-7-13(10,14)15/h3-6,10H,7H2,1-2H3,(H,16,17)	KPSRODZRAIWAKH-UHFFFAOYSA-N	CC(C)(Oc1ccc(cc1)C2CC2(Cl)Cl)C(=O)O	BroadT	BRD-A49358627	BRD-A49358627-001-03-9	Prestwick Chemical Inc.	Prestw-1076	D0701-MP04-ST03-200-		CC(C)(Oc1ccc(cc1)C1CC1(Cl)Cl)C(O)=O	InChI=1S/C13H14Cl2O3/c1-12(2,11(16)17)18-9-5-3-8(4-6-9)10-7-13(10,14)15/h3-6,10H,7H2,1-2H3,(H,16,17)	KPSRODZRAIWAKH-UHFFFAOYSA-N	288.031999728							50867
Maackiain	LSM-1932	SID26749524	363863	InChI=1S/C16H12O5/c17-8-1-2-9-12(3-8)18-6-11-10-4-14-15(20-7-19-14)5-13(10)21-16(9)11/h1-5,11,16-17H,6-7H2	HUKSJTUUSUGIDC-UHFFFAOYSA-N	Oc1ccc2C3Oc4cc5OCOc5cc4C3COc2c1	BroadT	BRD-A95445494	BRD-A95445494-001-02-9	AnalytiCon Discovery GmbH	NP-005240			Oc1ccc2C3Oc4cc5OCOc5cc4C3COc2c1	InChI=1S/C16H12O5/c17-8-1-2-9-12(3-8)18-6-11-10-4-14-15(20-7-19-14)5-13(10)21-16(9)11/h1-5,11,16-17H,6-7H2	HUKSJTUUSUGIDC-UHFFFAOYSA-N	284.068473484							73029
Ethyl 1-benzyl-4,5-dioxopyrrolidine-3-carboxylate	LSM-1941	Ebpc, BRD-A96485169, SID89852432	219271	InChI=1S/C14H15NO4/c1-2-19-14(18)11-9-15(13(17)12(11)16)8-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3	FQMSSTZJKSWSMP-UHFFFAOYSA-N	CCOC(=O)C1CN(Cc2ccccc2)C(=O)C1=O	BroadT	BRD-A96485169	BRD-A96485169-001-02-8	MicroSource Discovery Systems Inc.	2300078			CCOC(=O)C1CN(Cc2ccccc2)C(=O)C1=O	InChI=1S/C14H15NO4/c1-2-19-14(18)11-9-15(13(17)12(11)16)8-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3	FQMSSTZJKSWSMP-UHFFFAOYSA-N	261.10010797							91978
CGK733	LSM-1610	CGK-733, BRD-A50737080, SID29217536, SID50111704	6605258	InChI=1S/C23H18Cl3FN4O3S/c24-23(25,26)21(30-22(35)28-16-11-12-17(27)18(13-16)31(33)34)29-20(32)19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,19,21H,(H,29,32)(H2,28,30,35)	HLCDNLNLQNYZTK-UHFFFAOYSA-N	[O-][N+](=O)c1cc(NC(=S)NC(NC(=O)C(c2ccccc2)c3ccccc3)C(Cl)(Cl)Cl)ccc1F	BroadT	BRD-A50737080	BRD-A50737080-001-01-4	Tocris Bioscience	2639	1		[O-][N+](=O)c1cc(NC(=S)NC(NC(=O)C(c2ccccc2)c2ccccc2)C(Cl)(Cl)Cl)ccc1F	InChI=1S/C23H18Cl3FN4O3S/c24-23(25,26)21(30-22(35)28-16-11-12-17(27)18(13-16)31(33)34)29-20(32)19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,19,21H,(H,29,32)(H2,28,30,35)	HLCDNLNLQNYZTK-UHFFFAOYSA-N	554.014922496							91739
Pipenzolate	LSM-6459	Pipenzolate, Pipenzolate Bromide	4832	InChI=1S/C22H28NO3/c1-3-23(2)16-10-15-20(17-23)26-21(24)22(25,18-11-6-4-7-12-18)19-13-8-5-9-14-19/h4-9,11-14,20,25H,3,10,15-17H2,1-2H3/q+1	WPUKUEMZZRVAKZ-UHFFFAOYSA-N	CC[N+]1(C)CCCC(C1)OC(=O)C(O)(c2ccccc2)c3ccccc3	BroadT	BRD-A53561827	BRD-A53561827-004-04-1	MicroSource Discovery Systems Inc.	1503053		Br	CC[N+]1(C)CCCC(C1)OC(=O)C(O)(c1ccccc1)c1ccccc1.Br	InChI=1S/C22H28NO3.BrH/c1-3-23(2)16-10-15-20(17-23)26-21(24)22(25,18-11-6-4-7-12-18)19-13-8-5-9-14-19;/h4-9,11-14,20,25H,3,10,15-17H2,1-2H3;1H/q+1;	XEDCWWFPZMHXCM-UHFFFAOYSA-N	354.206918766							95178, 95178
5-Ethyl-1-[4-hydroxy-3-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4(1H,3H)-dione	LSM-21643	Edoxudine, SID26748734	3201	InChI=1S/C11H16N2O5/c1-2-6-3-13(11(17)12-9(6)16)10-7(4-14)8(15)5-18-10/h3,7-8,10,14-15H,2,4-5H2,1H3,(H,12,16,17)	QFVJRGJHSZSRJI-UHFFFAOYSA-N	CCC1=CN(C2OCC(O)C2CO)C(=O)N=C1O	BroadT	BRD-A62505706	BRD-A62505706-001-02-3	MicroSource Discovery Systems Inc.	1503214			CCc1cn(C2OCC(O)C2CO)c(=O)nc1O	InChI=1S/C11H16N2O5/c1-2-6-3-13(11(17)12-9(6)16)10-7(4-14)8(15)5-18-10/h3,7-8,10,14-15H,2,4-5H2,1H3,(H,12,16,17)	QFVJRGJHSZSRJI-UHFFFAOYSA-N	256.105921632							110195
BH3I-1&PRIME;	LSM-42832	BH3I-1	5717719	InChI=1S/C15H15NO3S2/c1-9(2)12(14(18)19)16-13(17)11(21-15(16)20)8-10-6-4-3-5-7-10/h3-9,12H,1-2H3,(H,18,19)/b11-8-	JZLLRVWRJBPACN-FLIBITNWSA-N	CC(C)C(N1C(=S)S\C(=C/c2ccccc2)\C1=O)C(=O)O	BroadT	BRD-A71799696	BRD-A71799696-001-01-5	EMD Biosciences	286892			CC(C)C(N1C(=S)S\C(=C/c2ccccc2)C1=O)C(O)=O	InChI=1S/C15H15NO3S2/c1-9(2)12(14(18)19)16-13(17)11(21-15(16)20)8-10-6-4-3-5-7-10/h3-9,12H,1-2H3,(H,18,19)/b11-8-	JZLLRVWRJBPACN-FLIBITNWSA-N	321.04933473							
SPECTRUM_000252	LSM-21644	Convallatoxin	6710620	InChI=1S/C29H42O10/c1-15-22(32)23(33)24(34)25(38-15)39-17-3-8-27(14-30)19-4-7-26(2)18(16-11-21(31)37-13-16)6-10-29(26,36)20(19)5-9-28(27,35)12-17/h11,14-15,17-20,22-25,32-36H,3-10,12-13H2,1-2H3/t15-,17-,18+,19?,20?,22-,23+,24+,25-,26+,27-,28-,29-/m0/s1	HULMNSIAKWANQO-OKPGQIJDSA-N	C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C=O)C4CC[C@]5(C)[C@H](CC[C@]5(O)C4CC[C@]3(O)C2)C6=CC(=O)OC6)[C@H](O)[C@H](O)[C@H]1O	BroadT	BRD-A80968824	BRD-A80968824-001-02-8	MicroSource Discovery Systems Inc.	1503994			C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C=O)C4CC[C@]5(C)[C@H](CC[C@]5(O)C4CC[C@]3(O)C2)C2=CC(=O)OC2)[C@H](O)[C@H](O)[C@H]1O	InChI=1S/C29H42O10/c1-15-22(32)23(33)24(34)25(38-15)39-17-3-8-27(14-30)19-4-7-26(2)18(16-11-21(31)37-13-16)6-10-29(26,36)20(19)5-9-28(27,35)12-17/h11,14-15,17-20,22-25,32-36H,3-10,12-13H2,1-2H3/t15-,17-,18+,19?,20?,22-,23+,24+,25-,26+,27-,28-,29-/m0/s1	HULMNSIAKWANQO-OKPGQIJDSA-N	550.277797544							
SPECTRUM_000894	LSM-1701	Dehydrocholic-Acid, Sodium Dehydrocholate	6602440	InChI=1S/C24H34O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29)/t13-,14?,16-,17?,18?,22?,23+,24-/m1/s1	OHXPGWPVLFPUSM-NDGTYXLASA-N	C[C@H](CCC(=O)O)[C@H]1CCC2C3C(CC(=O)[C@]12C)[C@@]4(C)CCC(=O)CC4CC3=O	BroadT	BRD-A64125466	BRD-A64125466-236-02-0	MicroSource Discovery Systems Inc.	1500225		[Na]	C[C@H](CCC(O)=O)[C@H]1CCC2C3C(CC(=O)[C@]12C)[C@@]1(C)CCC(=O)CC1CC3=O.[Na]	InChI=1S/C24H34O5.Na.H/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;;/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29);;/t13-,14?,16-,17?,18?,22?,23+,24-;;/m1../s1	YNHQMIITUXGAIW-ZDWWGTDFSA-N	402.240624188							91801
159559-71-4	LSM-1239	BRD-A59391763	132830	InChI=1S/C16H22INO/c1-2-9-18(10-3-8-17)15-6-4-13-5-7-16(19)12-14(13)11-15/h3,5,7-8,12,15,19H,2,4,6,9-11H2,1H3	RTMIJLQPWFKAFE-UHFFFAOYSA-N	CCCN(CC=CI)C1CCc2ccc(O)cc2C1	BroadT	BRD-A59391763	BRD-A59391763-103-01-9	Tocris Bioscience	719	3	OC(=O)C=CC(=O)O	CCCN(CC=CI)C1CCc2ccc(O)cc2C1.OC(=O)C=CC(=O)O	InChI=1S/C16H22INO.C4H4O4/c1-2-9-18(10-3-8-17)15-6-4-13-5-7-16(19)12-14(13)11-15;5-3(6)1-2-4(7)8/h3,5,7-8,12,15,19H,2,4,6,9-11H2,1H3;1-2H,(H,5,6)(H,7,8)	IQRDHLSQXOATHD-UHFFFAOYSA-N	371.074607334							91477
Pronetalol	LSM-5176	Pronethalol, Pronetalol, Nethalide, ICI-38174 [AS HYDROCHLORIDE], GNF-PF-2670, AY-6204 HCL	4930	InChI=1S/C15H19NO/c1-11(2)16-10-15(17)14-8-7-12-5-3-4-6-13(12)9-14/h3-9,11,15-17H,10H2,1-2H3	HRSANNODOVBCST-UHFFFAOYSA-N	CC(C)NCC(O)c1ccc2ccccc2c1	BroadT	BRD-A87715314	BRD-A87715314-003-04-5	MicroSource Discovery Systems Inc.	1503628		Cl	CC(C)NCC(O)c1ccc2ccccc2c1.Cl	InChI=1S/C15H19NO.ClH/c1-11(2)16-10-15(17)14-8-7-12-5-3-4-6-13(12)9-14;/h3-9,11,15-17H,10H2,1-2H3;1H	QONLGXRPRAIDGI-UHFFFAOYSA-N	229.146664238							8463, 8463
N-Formylmethionylalanine	LSM-1678	SID93576717	4363	InChI=1S/C9H16N2O4S/c1-6(9(14)15)11-8(13)7(10-5-12)3-4-16-2/h5-7H,3-4H2,1-2H3,(H,10,12)(H,11,13)(H,14,15)	GBWVAAKKEIOROG-UHFFFAOYSA-N	CSCCC(NC=O)C(=O)NC(C)C(=O)O	BroadT	BRD-A61470182	BRD-A61470182-001-02-4	MicroSource Discovery Systems Inc.	1502172			CSCCC(NC=O)C(=O)NC(C)C(O)=O	InChI=1S/C9H16N2O4S/c1-6(9(14)15)11-8(13)7(10-5-12)3-4-16-2/h5-7H,3-4H2,1-2H3,(H,10,12)(H,11,13)(H,14,15)	GBWVAAKKEIOROG-UHFFFAOYSA-N	248.083077702							91785
5,6-Dichlorobenzimidazole riboside	LSM-5138	Drb, EI-231	6610267	InChI=1S/C12H12Cl2N2O4/c13-5-1-7-8(2-6(5)14)16(4-15-7)12-11(19)10(18)9(3-17)20-12/h1-2,4,9-12,17-19H,3H2/t9-,10+,11?,12-/m1/s1	XHSQDZXAVJRBMX-AYLPWXGPSA-N	OC[C@H]1O[C@H](C(O)[C@H]1O)n2cnc3cc(Cl)c(Cl)cc23	BroadT	BRD-A74904029	BRD-A74904029-001-04-0	Biomol International Inc.	EI-231	2840(V2)-3-N1305		OC[C@H]1O[C@H](C(O)[C@H]1O)n1cnc2cc(Cl)c(Cl)cc12	InChI=1S/C12H12Cl2N2O4/c13-5-1-7-8(2-6(5)14)16(4-15-7)12-11(19)10(18)9(3-17)20-12/h1-2,4,9-12,17-19H,3H2/t9-,10+,11?,12-/m1/s1	XHSQDZXAVJRBMX-AYLPWXGPSA-N	318.017412304							94437
Fendiline	LSM-5133	Fendiline	3336	InChI=1S/C23H25N/c1-19(20-11-5-2-6-12-20)24-18-17-23(21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,19,23-24H,17-18H2,1H3	NMKSAYKQLCHXDK-UHFFFAOYSA-N	CC(NCCC(c1ccccc1)c2ccccc2)c3ccccc3	BroadT	BRD-A71033472	BRD-A71033472-003-04-9	MicroSource Discovery Systems Inc.	1501026		Cl	CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1.Cl	InChI=1S/C23H25N.ClH/c1-19(20-11-5-2-6-12-20)24-18-17-23(21-13-7-3-8-14-21)22-15-9-4-10-16-22;/h2-16,19,23-24H,17-18H2,1H3;1H	NJXWZWXCHBNOOG-UHFFFAOYSA-N	315.19869981							94434, 94434
Tremulacin	LSM-5099	Tremulacin, BRD-A61856038	442544	InChI=1S/C27H28O11/c28-14-19-21(30)22(31)23(38-24(32)16-8-2-1-3-9-16)25(37-19)36-18-11-5-4-10-17(18)15-35-26(33)27(34)13-7-6-12-20(27)29/h1-5,7-11,13,19,21-23,25,28,30-31,34H,6,12,14-15H2/t19-,21-,22+,23-,25-,27?/m1/s1	RCKCYCDBDYUIGM-LFMHJWGUSA-N	OC[C@H]1O[C@@H](Oc2ccccc2COC(=O)C3(O)C=CCCC3=O)[C@H](OC(=O)c4ccccc4)[C@@H](O)[C@@H]1O	BroadT	BRD-A61856038	BRD-A61856038-001-01-2	AnalytiCon Discovery GmbH	NP-004589			OC[C@H]1O[C@@H](Oc2ccccc2COC(=O)C2(O)C=CCCC2=O)[C@H](OC(=O)c2ccccc2)[C@@H](O)[C@@H]1O	InChI=1S/C27H28O11/c28-14-19-21(30)22(31)23(38-24(32)16-8-2-1-3-9-16)25(37-19)36-18-11-5-4-10-17(18)15-35-26(33)27(34)13-7-6-12-20(27)29/h1-5,7-11,13,19,21-23,25,28,30-31,34H,6,12,14-15H2/t19-,21-,22+,23-,25-,27?/m1/s1	RCKCYCDBDYUIGM-LFMHJWGUSA-N	528.163161716							9657
AC1MR9ZN	LSM-1642	BRD-A55369275, CGP-54626	3489614	InChI=1S/C18H28Cl2NO3P/c1-13(15-7-8-17(19)18(20)9-15)21-10-16(22)12-25(23,24)11-14-5-3-2-4-6-14/h7-9,13-14,16,21-22H,2-6,10-12H2,1H3,(H,23,24)	JGGVBBYJRQOPPA-UHFFFAOYSA-N	CC(NCC(O)CP(=O)(O)CC1CCCCC1)c2ccc(Cl)c(Cl)c2	BroadT	BRD-A55369275	BRD-A55369275-001-01-6	Biomol International Inc.	AC-488	2819-N1292		CC(NCC(O)CP(O)(=O)CC1CCCCC1)c1ccc(Cl)c(Cl)c1	InChI=1S/C18H28Cl2NO3P/c1-13(15-7-8-17(19)18(20)9-15)21-10-16(22)12-25(23,24)11-14-5-3-2-4-6-14/h7-9,13-14,16,21-22H,2-6,10-12H2,1H3,(H,23,24)	JGGVBBYJRQOPPA-UHFFFAOYSA-N	407.118385696							91761
8-Hydroxy-15,16-bisnor-11-labden-13-one	LSM-43969	BRD-A61864215	6857787	InChI=1S/C18H30O2/c1-13(19)7-8-15-17(4)11-6-10-16(2,3)14(17)9-12-18(15,5)20/h7-8,14-15,20H,6,9-12H2,1-5H3/b8-7-/t14?,15-,17+,18-/m1/s1	SNUHZNCSBAQVJV-DPGSLPGRSA-N	CC(=O)\C=C/[C@H]1[C@](C)(O)CCC2C(C)(C)CCC[C@]12C	BroadT	BRD-A61864215	BRD-A61864215-001-02-9	MicroSource Discovery Systems Inc.	300060			CC(=O)\C=C/[C@H]1[C@](C)(O)CCC2C(C)(C)CCC[C@]12C	InChI=1S/C18H30O2/c1-13(19)7-8-15-17(4)11-6-10-16(2,3)14(17)9-12-18(15,5)20/h7-8,14-15,20H,6,9-12H2,1-5H3/b8-7-/t14?,15-,17+,18-/m1/s1	SNUHZNCSBAQVJV-DPGSLPGRSA-N	278.2245802							
Clenbuterol	LSM-5144	Clenbuterol, NAB-365, Clenbuterol HCl	2783	InChI=1S/C12H18Cl2N2O/c1-12(2,3)16-6-10(17)7-4-8(13)11(15)9(14)5-7/h4-5,10,16-17H,6,15H2,1-3H3	STJMRWALKKWQGH-UHFFFAOYSA-N	CC(C)(C)NCC(O)c1cc(Cl)c(N)c(Cl)c1	BroadT	BRD-A75726477	BRD-A75726477-003-03-1	MicroSource Discovery Systems Inc.	1503917		Cl	CC(C)(C)NCC(O)c1cc(Cl)c(N)c(Cl)c1.Cl	InChI=1S/C12H18Cl2N2O.ClH/c1-12(2,3)16-6-10(17)7-4-8(13)11(15)9(14)5-7;/h4-5,10,16-17H,6,15H2,1-3H3;1H	OPXKTCUYRHXSBK-UHFFFAOYSA-N	276.079618636							174690, 174690
HMS3268G03	LSM-21646	BRD-A94046266	24868319	InChI=1S/C25H34O/c1-24-14-12-19(26)16-18(24)8-9-20-22-11-10-21(17-6-4-3-5-7-17)25(22,2)15-13-23(20)24/h3-7,10,18-20,22-23,26H,8-9,11-16H2,1-2H3	SINAMTXBCYKFDL-UHFFFAOYSA-N	CC12CCC(O)CC1CCC3C2CCC4(C)C3CC=C4c5ccccc5	BroadT	BRD-A94046266	BRD-A94046266-001-01-4	Tocris Bioscience	2681	1		CC12CCC3C(CCC4CC(O)CCC34C)C1CC=C2c1ccccc1	InChI=1S/C25H34O/c1-24-14-12-19(26)16-18(24)8-9-20-22-11-10-21(17-6-4-3-5-7-17)25(22,2)15-13-23(20)24/h3-7,10,18-20,22-23,26H,8-9,11-16H2,1-2H3	SINAMTXBCYKFDL-UHFFFAOYSA-N	350.260965708							110197
2,9-Dihydroxy-1,10-dimethoxyaporphine	LSM-6446	SID26665147, SID26749981, SID26753778, BRD-A44966919	248507	InChI=1S/C19H21NO4/c1-20-5-4-10-7-15(22)19(24-3)18-12-9-16(23-2)14(21)8-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3	LZJRNLRASBVRRX-UHFFFAOYSA-N	COc1cc2c(CC3N(C)CCc4cc(O)c(OC)c2c34)cc1O	BroadT	BRD-A44966919	BRD-A44966919-001-03-1	AnalytiCon Discovery GmbH	NP-009846			COc1cc-2c(CC3N(C)CCc4cc(O)c(OC)c-2c34)cc1O	InChI=1S/C19H21NO4/c1-20-5-4-10-7-15(22)19(24-3)18-12-9-16(23-2)14(21)8-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3	LZJRNLRASBVRRX-UHFFFAOYSA-N	327.147058162							95169
2-Phenylaminoadenosine	LSM-1705	BRD-A64933752	1585	InChI=1S/C16H18N6O4/c17-13-10-14(21-16(20-13)19-8-4-2-1-3-5-8)22(7-18-10)15-12(25)11(24)9(6-23)26-15/h1-5,7,9,11-12,15,23-25H,6H2,(H3,17,19,20,21)	SCNILGOVBBRMBK-UHFFFAOYSA-N	Nc1nc(Nc2ccccc2)nc3c1ncn3C4OC(CO)C(O)C4O	BroadT	BRD-A64933752	BRD-A64933752-001-01-0	Tocris Bioscience	1710	2		Nc1nc(Nc2ccccc2)nc2n(cnc12)C1OC(CO)C(O)C1O	InChI=1S/C16H18N6O4/c17-13-10-14(21-16(20-13)19-8-4-2-1-3-5-8)22(7-18-10)15-12(25)11(24)9(6-23)26-15/h1-5,7,9,11-12,15,23-25H,6H2,(H3,17,19,20,21)	SCNILGOVBBRMBK-UHFFFAOYSA-N	358.138953116							91804
IN1246	LSM-1790	BRD-A75478957	9918908	InChI=1S/C17H18BrNO4S/c1-11(2)16(17(20)21)19-24(22,23)15-9-5-13(6-10-15)12-3-7-14(18)8-4-12/h3-11,16,19H,1-2H3,(H,20,21)	GJOCABIDMCKCEG-UHFFFAOYSA-N	CC(C)C(NS(=O)(=O)c1ccc(cc1)c2ccc(Br)cc2)C(=O)O	BroadT	BRD-A75478957	BRD-A75478957-001-01-6	Tocris Bioscience	2520	1		CC(C)C(NS(=O)(=O)c1ccc(cc1)-c1ccc(Br)cc1)C(O)=O	InChI=1S/C17H18BrNO4S/c1-11(2)16(17(20)21)19-24(22,23)15-9-5-13(6-10-15)12-3-7-14(18)8-4-12/h3-11,16,19H,1-2H3,(H,20,21)	GJOCABIDMCKCEG-UHFFFAOYSA-N	411.013991356							91864
Resmethrin	LSM-1846	SID26757190, SID50111533	5053	InChI=1S/C22H26O3/c1-15(2)10-19-20(22(19,3)4)21(23)25-14-17-12-18(24-13-17)11-16-8-6-5-7-9-16/h5-10,12-13,19-20H,11,14H2,1-4H3	VEMKTZHHVJILDY-UHFFFAOYSA-N	CC(=CC1C(C(=O)OCc2coc(Cc3ccccc3)c2)C1(C)C)C	BroadT	BRD-A83431637	BRD-A83431637-001-01-3	EMD Biosciences	554300			CC(C)=CC1C(C(=O)OCc2coc(Cc3ccccc3)c2)C1(C)C	InChI=1S/C22H26O3/c1-15(2)10-19-20(22(19,3)4)21(23)25-14-17-12-18(24-13-17)11-16-8-6-5-7-9-16/h5-10,12-13,19-20H,11,14H2,1-4H3	VEMKTZHHVJILDY-UHFFFAOYSA-N	338.188194692							8811
Troxerutin	LSM-21647		6710736	InChI=1S/C33H42O19/c1-14-23(38)26(41)28(43)32(49-14)48-13-21-24(39)27(42)29(44)33(51-21)52-31-25(40)22-17(37)11-16(45-7-4-34)12-20(22)50-30(31)15-2-3-18(46-8-5-35)19(10-15)47-9-6-36/h2-3,10-12,14,21,23-24,26-29,32-39,41-44H,4-9,13H2,1H3/t14-,21+,23-,24+,26+,27-,28+,29+,32+,33?/m0/s1	IYVFNTXFRYQLRP-IIXSESAUSA-N	C[C@@H]1O[C@@H](OC[C@H]2OC(OC3=C(Oc4cc(OCCO)cc(O)c4C3=O)c5ccc(OCCO)c(OCCO)c5)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	BroadT	BRD-A74160776	BRD-A74160776-001-02-8	MicroSource Discovery Systems Inc.	1505245			C[C@@H]1O[C@@H](OC[C@H]2OC(Oc3c(oc4cc(OCCO)cc(O)c4c3=O)-c3ccc(OCCO)c(OCCO)c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	InChI=1S/C33H42O19/c1-14-23(38)26(41)28(43)32(49-14)48-13-21-24(39)27(42)29(44)33(51-21)52-31-25(40)22-17(37)11-16(45-7-4-34)12-20(22)50-30(31)15-2-3-18(46-8-5-35)19(10-15)47-9-6-36/h2-3,10-12,14,21,23-24,26-29,32-39,41-44H,4-9,13H2,1H3/t14-,21+,23-,24+,26+,27-,28+,29+,32+,33?/m0/s1	IYVFNTXFRYQLRP-IIXSESAUSA-N	742.232029124001							110198
Difluorobenztropine	LSM-21648	4,4-Difluor-3alpha-(Diphenylmethoxy)Tropane Hydrochloride, SID26751968	3929516	InChI=1S/C21H23F2NO/c1-24-18-10-11-19(24)13-20(12-18)25-21(14-2-6-16(22)7-3-14)15-4-8-17(23)9-5-15/h2-9,18-21H,10-13H2,1H3	MHNSOBBJZCWUGS-UHFFFAOYSA-N	CN1C2CCC1CC(C2)OC(c3ccc(F)cc3)c4ccc(F)cc4	BroadT	BRD-A85216385	BRD-A85216385-001-01-0	Biomol International Inc.	AC-269	2812-3-N1298		CN1C2CCC1CC(C2)OC(c1ccc(F)cc1)c1ccc(F)cc1	InChI=1S/C21H23F2NO/c1-24-18-10-11-19(24)13-20(12-18)25-21(14-2-6-16(22)7-3-14)15-4-8-17(23)9-5-15/h2-9,18-21H,10-13H2,1H3	MHNSOBBJZCWUGS-UHFFFAOYSA-N	343.174770766							110199, 110199
SKF-38393	LSM-21649	SK-383933, SK-38393, SK&F-383933, SK&F-38393, NCG-C00093856-01, SKF38393, SKF-38393	1242	InChI=1S/C16H17NO2/c18-15-8-12-6-7-17-10-14(13(12)9-16(15)19)11-4-2-1-3-5-11/h1-5,8-9,14,17-19H,6-7,10H2	JUDKOGFHZYMDMF-UHFFFAOYSA-N	Oc1cc2CCNCC(c3ccccc3)c2cc1O	BroadT	BRD-A88548664	BRD-A88548664-001-01-5	MicroSource Discovery Systems Inc.	1505101			Oc1cc2CCNCC(c3ccccc3)c2cc1O	InChI=1S/C16H17NO2/c18-15-8-12-6-7-17-10-14(13(12)9-16(15)19)11-4-2-1-3-5-11/h1-5,8-9,14,17-19H,6-7,10H2	JUDKOGFHZYMDMF-UHFFFAOYSA-N	255.125928794							110200, 110200, 110200, 131801, 131801, 131801
Hydroxyamphetamine	LSM-15206	Hydroxyamphetamine, Hydroxyamfetamine	3651	InChI=1S/C9H13NO/c1-7(10)6-8-2-4-9(11)5-3-8/h2-5,7,11H,6,10H2,1H3	GIKNHHRFLCDOEU-UHFFFAOYSA-N	CC(N)Cc1ccc(O)cc1	BroadT	BRD-A80871782	BRD-A80871782-004-01-0	MicroSource Discovery Systems Inc.	211425		Br	CC(N)Cc1ccc(O)cc1.Br	InChI=1S/C9H13NO.BrH/c1-7(10)6-8-2-4-9(11)5-3-8;/h2-5,7,11H,6,10H2,1H3;1H	RZCJLMTXBMNRAD-UHFFFAOYSA-N	151.099714046							103855, 103855
Flumequine	LSM-5129	Flumequine	3374	InChI=1S/C14H12FNO3/c1-7-2-3-8-4-9(15)5-10-12(8)16(7)6-11(13(10)17)14(18)19/h4-7H,2-3H2,1H3,(H,18,19)	DPSPPJIUMHPXMA-UHFFFAOYSA-N	CC1CCc2cc(F)cc3C(=O)C(=CN1c23)C(=O)O	BroadT	BRD-A69777949	BRD-A69777949-001-04-4	MicroSource Discovery Systems Inc.	1500992			CC1CCc2cc(F)cc3c2n1cc(C(O)=O)c3=O	InChI=1S/C14H12FNO3/c1-7-2-3-8-4-9(15)5-10-12(8)16(7)6-11(13(10)17)14(18)19/h4-7H,2-3H2,1H3,(H,18,19)	DPSPPJIUMHPXMA-UHFFFAOYSA-N	261.080121454							85269, 94431
CHEMBL192359	LSM-15332	BRD-A49544621, AC-7954	9797568	InChI=1S/C19H20ClNO2/c1-21(2)12-11-19(15-7-9-16(20)10-8-15)13-14-5-3-4-6-17(14)18(22)23-19/h3-10H,11-13H2,1-2H3	HIVBATDUVFEJFZ-UHFFFAOYSA-N	CN(C)CCC1(Cc2ccccc2C(=O)O1)c3ccc(Cl)cc3	BroadT	BRD-A49544621	BRD-A49544621-003-01-0	Tocris Bioscience	2484	1	Cl	CN(C)CCC1(Cc2ccccc2C(=O)O1)c1ccc(Cl)cc1.Cl	InChI=1S/C19H20ClNO2.ClH/c1-21(2)12-11-19(15-7-9-16(20)10-8-15)13-14-5-3-4-6-17(14)18(22)23-19;/h3-10H,11-13H2,1-2H3;1H	AJPGLOWFIBOGMH-UHFFFAOYSA-N	329.1182566							103978, 103978
Azelastine	LSM-5127	Azelastine	2267	InChI=1S/C22H24ClN3O/c1-25-13-4-5-18(12-14-25)26-22(27)20-7-3-2-6-19(20)21(24-26)15-16-8-10-17(23)11-9-16/h2-3,6-11,18H,4-5,12-15H2,1H3	MBUVEWMHONZEQD-UHFFFAOYSA-N	CN1CCCC(CC1)N2N=C(Cc3ccc(Cl)cc3)c4ccccc4C2=O	BroadT	BRD-A68888262	BRD-A68888262-003-02-9	MicroSource Discovery Systems Inc.	1505340		Cl	CN1CCCC(CC1)n1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O.Cl	InChI=1S/C22H24ClN3O.ClH/c1-25-13-4-5-18(12-14-25)26-22(27)20-7-3-2-6-19(20)21(24-26)15-16-8-10-17(23)11-9-16;/h2-3,6-11,18H,4-5,12-15H2,1H3;1H	YEJAJYAHJQIWNU-UHFFFAOYSA-N	381.160790128							2950, 2950
Monastrol	LSM-1809	Monastrol	2987927	InChI=1S/C14H16N2O3S/c1-3-19-13(18)11-8(2)15-14(20)16-12(11)9-5-4-6-10(17)7-9/h4-7,12,17H,3H2,1-2H3,(H2,15,16,20)	LOBCDGHHHHGHFA-UHFFFAOYSA-N	CCOC(=O)C1=C(C)NC(=S)NC1c2cccc(O)c2	BroadT	BRD-A78377521	BRD-A78377521-001-02-2	Biomol International Inc.	GR-322	2840(V2)-3-N1305		CCOC(=O)C1=C(C)NC(=S)NC1c1cccc(O)c1	InChI=1S/C14H16N2O3S/c1-3-19-13(18)11-8(2)15-14(20)16-12(11)9-5-4-6-10(17)7-9/h4-7,12,17H,3H2,1-2H3,(H2,15,16,20)	LOBCDGHHHHGHFA-UHFFFAOYSA-N	292.088163082							75382
CHEMBL299879	LSM-1923	BRD-A94413429	9982218	InChI=1S/C25H33N3O4S/c29-28(30)24-7-3-4-8-25(24)33(31,32)27-18-20-11-9-19(10-12-20)16-26-17-21-13-14-22-5-1-2-6-23(22)15-21/h1-8,19-21,26-27H,9-18H2	ISSSVYKMIIAPTH-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1S(=O)(=O)NCC2CCC(CNCC3CCc4ccccc4C3)CC2	BroadT	BRD-A94413429	BRD-A94413429-003-01-6	Tocris Bioscience	2155	2	Cl	[O-][N+](=O)c1ccccc1S(=O)(=O)NCC1CCC(CNCC2CCc3ccccc3C2)CC1.Cl	InChI=1S/C25H33N3O4S.ClH/c29-28(30)24-7-3-4-8-25(24)33(31,32)27-18-20-11-9-19(10-12-20)16-26-17-21-13-14-22-5-1-2-6-23(22)15-21;/h1-8,19-21,26-27H,9-18H2;1H	BKCQHNDMUNWNQC-UHFFFAOYSA-N	471.219177256							91969
Cucurbitacin I	LSM-42825		44483311	InChI=1S/C30H42O7/c1-25(2,36)12-11-21(33)30(8,37)23-19(32)14-27(5)20-10-9-16-17(13-18(31)24(35)26(16,3)4)29(20,7)22(34)15-28(23,27)6/h9,11-12,17,19-20,23,32,36-37H,10,13-15H2,1-8H3/b12-11+/t17?,19-,20+,23?,27+,28+,29+,30+/m1/s1	NZZOMHODWAPPJH-YPXOEWKESA-N	CC(C)(O)\C=C\C(=O)[C@](C)(O)C1[C@H](O)C[C@@]2(C)[C@@H]3CC=C4C(CC(=O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@@]12C	BroadT	BRD-A49680073	BRD-A49680073-001-01-9	Calbiochem	238590			CC(C)(O)\C=C\C(=O)[C@](C)(O)C1[C@H](O)C[C@@]2(C)[C@@H]3CC=C4C(CC(=O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@@]12C	InChI=1S/C30H42O7/c1-25(2,36)12-11-21(33)30(8,37)23-19(32)14-27(5)20-10-9-16-17(13-18(31)24(35)26(16,3)4)29(20,7)22(34)15-28(23,27)6/h9,11-12,17,19-20,23,32,36-37H,10,13-15H2,1-8H3/b12-11+/t17?,19-,20+,23?,27+,28+,29+,30+/m1/s1	NZZOMHODWAPPJH-YPXOEWKESA-N	514.293053684							
Salsolidine	LSM-5140	SID124882777, SID26753768	10302	InChI=1S/C12H17NO2/c1-8-10-7-12(15-3)11(14-2)6-9(10)4-5-13-8/h6-8,13H,4-5H2,1-3H3	HMYJLVDKPJHJCF-UHFFFAOYSA-N	COc1cc2CCNC(C)c2cc1OC	BroadT	BRD-A75140635	BRD-A75140635-001-02-0	AnalytiCon Discovery GmbH	NP-010994			COc1cc2CCNC(C)c2cc1OC	InChI=1S/C12H17NO2/c1-8-10-7-12(15-3)11(14-2)6-9(10)4-5-13-8/h6-8,13H,4-5H2,1-3H3	HMYJLVDKPJHJCF-UHFFFAOYSA-N	207.125928794							94438, 94438
PRESTWICK3_000989	LSM-1719	Asiaticoside	23874513	InChI=1S/C48H78O19/c1-20-10-13-48(15-14-46(6)23(29(48)21(20)2)8-9-28-44(4)16-24(51)39(60)45(5,19-50)27(44)11-12-47(28,46)7)43(61)67-42-36(58)33(55)31(53)26(65-42)18-62-40-37(59)34(56)38(25(17-49)64-40)66-41-35(57)32(54)30(52)22(3)63-41/h8,20-22,24-42,49-60H,9-19H2,1-7H3/t20-,21+,22+,24-,25-,26-,27?,28-,29+,30+,31-,32-,33+,34-,35-,36-,37-,38-,39+,40?,41?,42+,44+,45+,46-,47-,48+/m1/s1	WYQVAPGDARQUBT-PHRCFOMISA-N	C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(=O)O[C@@H]6O[C@H](COC7O[C@H](CO)[C@@H](OC8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O	BroadT	BRD-A66199457	BRD-A66199457-001-02-2	Prestwick Chemical Inc.	Prestw-989	D0701-MP04-ST03-200-		C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(=O)O[C@@H]1O[C@H](COC2O[C@H](CO)[C@@H](OC3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O	InChI=1S/C48H78O19/c1-20-10-13-48(15-14-46(6)23(29(48)21(20)2)8-9-28-44(4)16-24(51)39(60)45(5,19-50)27(44)11-12-47(28,46)7)43(61)67-42-36(58)33(55)31(53)26(65-42)18-62-40-37(59)34(56)38(25(17-49)64-40)66-41-35(57)32(54)30(52)22(3)63-41/h8,20-22,24-42,49-60H,9-19H2,1-7H3/t20-,21+,22+,24-,25-,26-,27?,28-,29+,30+,31-,32-,33+,34-,35-,36-,37-,38-,39+,40?,41?,42+,44+,45+,46-,47-,48+/m1/s1	WYQVAPGDARQUBT-PHRCFOMISA-N	958.513730276001							
SQ-29548	LSM-42837		16759359	InChI=1S/C21H29N3O4/c25-20(26)11-7-2-1-6-10-16-17(19-13-12-18(16)28-19)14-22-24-21(27)23-15-8-4-3-5-9-15/h1,3-6,8-9,16-19,22H,2,7,10-14H2,(H,25,26)(H2,23,24,27)/b6-1-	RJNDVCNWVBWHLY-BHQIHCQQSA-N	OC(=O)CCC\C=C/CC1C2CCC(O2)C1CNNC(=O)Nc3ccccc3	BroadT	BRD-A91866971	BRD-A91866971-001-02-2	Biomol International Inc.	RA-103	2840(V2)-3-N1305		OC(=O)CCC\C=C/CC1C2CCC(O2)C1CNNC(=O)Nc1ccccc1	InChI=1S/C21H29N3O4/c25-20(26)11-7-2-1-6-10-16-17(19-13-12-18(16)28-19)14-22-24-21(27)23-15-8-4-3-5-9-15/h1,3-6,8-9,16-19,22H,2,7,10-14H2,(H,25,26)(H2,23,24,27)/b6-1-	RJNDVCNWVBWHLY-BHQIHCQQSA-N	387.215806438							
87857-27-0	LSM-21650	SID124881008, SID26755716, SID50111214, SID90340589, (+/-)-Ppht	1240	InChI=1S/C21H27NO/c1-2-14-22(15-13-17-7-4-3-5-8-17)19-11-12-20-18(16-19)9-6-10-21(20)23/h3-10,19,23H,2,11-16H2,1H3	DEYFWGXTPWNADC-UHFFFAOYSA-N	CCCN(CCc1ccccc1)C2CCc3c(O)cccc3C2	BroadT	BRD-A82843133	BRD-A82843133-001-01-9	Biomol International Inc.	AC-837	2812-3-N1298		CCCN(CCc1ccccc1)C1CCc2c(O)cccc2C1	InChI=1S/C21H27NO/c1-2-14-22(15-13-17-7-4-3-5-8-17)19-11-12-20-18(16-19)9-6-10-21(20)23/h3-10,19,23H,2,11-16H2,1H3	DEYFWGXTPWNADC-UHFFFAOYSA-N	309.209264494							110201, 110201
SPECTRUM_001470	LSM-15333	Ancitabine	6708791	InChI=1S/C9H11N3O4/c10-5-1-2-12-8-7(16-9(12)11-5)6(14)4(3-13)15-8/h1-2,4,6-8,10,13-14H,3H2/t4-,6-,7+,8?/m1/s1	BBDAGFIXKZCXAH-STUHELBRSA-N	OC[C@H]1OC2[C@@H](OC3=NC(=N)C=CN23)[C@@H]1O	BroadT	BRD-A90462498	BRD-A90462498-003-02-1	MicroSource Discovery Systems Inc.	1504137		Cl	OC[C@H]1OC2[C@@H](Oc3nc(=N)ccn23)[C@@H]1O.Cl	InChI=1S/C9H11N3O4.ClH/c10-5-1-2-12-8-7(16-9(12)11-5)6(14)4(3-13)15-8;/h1-2,4,6-8,10,13-14H,3H2;1H/t4-,6-,7+,8?;/m1./s1	KZOWNALBTMILAP-MZXKVBEESA-N	225.074955862							103979
KBIO3_000995	LSM-21651	Totarol Acetate	6708782	InChI=1S/C22H32O2/c1-14(2)20-16-8-11-19-21(4,5)12-7-13-22(19,6)17(16)9-10-18(20)24-15(3)23/h9-10,14,19H,7-8,11-13H2,1-6H3/t19?,22-/m1/s1	ORVBSFQTFRBNRP-AVKWCDSFSA-N	CC(C)c1c2CCC3C(C)(C)CCC[C@]3(C)c2ccc1OC(=O)C	BroadT	BRD-A94366206	BRD-A94366206-001-02-7	MicroSource Discovery Systems Inc.	100267			CC(C)c1c(OC(C)=O)ccc2c1CCC1C(C)(C)CCC[C@]21C	InChI=1S/C22H32O2/c1-14(2)20-16-8-11-19-21(4,5)12-7-13-22(19,6)17(16)9-10-18(20)24-15(3)23/h9-10,14,19H,7-8,11-13H2,1-6H3/t19?,22-/m1/s1	ORVBSFQTFRBNRP-AVKWCDSFSA-N	328.240230264							110202
SPECTRUM_000251	LSM-21652	Quercitrin	6710619	InChI=1S/C21H20O11/c1-7-15(26)17(28)18(29)21(30-7)32-20-16(27)14-12(25)5-9(22)6-13(14)31-19(20)8-2-3-10(23)11(24)4-8/h2-7,15,17-18,21-26,28-29H,1H3/t7?,15-,17+,18+,21-/m0/s1	OXGUCUVFOIWWQJ-IWSUUXMFSA-N	CC1O[C@@H](OC2=C(Oc3cc(O)cc(O)c3C2=O)c4ccc(O)c(O)c4)[C@H](O)[C@H](O)[C@H]1O	BroadT	BRD-A76899420	BRD-A76899420-001-02-9	MicroSource Discovery Systems Inc.	1500752			CC1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O	InChI=1S/C21H20O11/c1-7-15(26)17(28)18(29)21(30-7)32-20-16(27)14-12(25)5-9(22)6-13(14)31-19(20)8-2-3-10(23)11(24)4-8/h2-7,15,17-18,21-26,28-29H,1H3/t7?,15-,17+,18+,21-/m0/s1	OXGUCUVFOIWWQJ-IWSUUXMFSA-N	448.10056146							110203
Cimaterol	LSM-1710	Cimaterol, AB-A-663, AC-263780	2755	InChI=1S/C12H17N3O/c1-8(2)15-7-12(16)9-3-4-11(14)10(5-9)6-13/h3-5,8,12,15-16H,7,14H2,1-2H3	BUXRLJCGHZZYNE-UHFFFAOYSA-N	CC(C)NCC(O)c1ccc(N)c(c1)C#N	BroadT	BRD-A65440446	BRD-A65440446-001-02-5	Biomol International Inc.	AC-183	2840(V2)-3-N1305		CC(C)NCC(O)c1ccc(N)c(c1)C#N	InChI=1S/C12H17N3O/c1-8(2)15-7-12(16)9-3-4-11(14)10(5-9)6-13/h3-5,8,12,15-16H,7,14H2,1-2H3	BUXRLJCGHZZYNE-UHFFFAOYSA-N	219.137162194							91807
KBIO3_000694	LSM-1582	BRD-A47144777	6708643	InChI=1S/C26H34O5/c1-23(2)17-12-20(28)26(5)16(24(17,3)10-7-19(23)27)6-9-25(4)18(26)13-21(29)31-22(25)15-8-11-30-14-15/h8,11,13-14,16-17,20,22,28H,6-7,9-10,12H2,1-5H3/t16?,17?,20-,22+,24-,25-,26-/m1/s1	BQDRKSSNLHIYIM-DFIIIIPRSA-N	CC1(C)C2C[C@@H](O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)C=C34)c5cocc5)[C@@]2(C)CCC1=O	BroadT	BRD-A47144777	BRD-A47144777-001-02-5	MicroSource Discovery Systems Inc.	100458			C[C@]12CCC(=O)C(C)(C)C1C[C@@H](O)[C@]1(C)C2CC[C@@]2(C)[C@@H](OC(=O)C=C12)c1ccoc1	InChI=1S/C26H34O5/c1-23(2)17-12-20(28)26(5)16(24(17,3)10-7-19(23)27)6-9-25(4)18(26)13-21(29)31-22(25)15-8-11-30-14-15/h8,11,13-14,16-17,20,22,28H,6-7,9-10,12H2,1-5H3/t16?,17?,20-,22+,24-,25-,26-/m1/s1	BQDRKSSNLHIYIM-DFIIIIPRSA-N	426.240624188							
SPECTRUM2_000897	LSM-21653	BRD-A68537732	6710755	InChI=1S/C9H11FN2O5/c1-3-5(13)6(14)8(17-3)12-2-4(10)7(15)11-9(12)16/h2-3,5-6,8,13-14H,1H3,(H,11,15,16)/t3-,5-,6?,8?/m1/s1	ZWAOHEXOSAUJHY-IRKUJEHTSA-N	C[C@H]1OC(C(O)[C@@H]1O)N2C=C(F)C(=O)NC2=O	BroadT	BRD-A68537732	BRD-A68537732-001-02-8	MicroSource Discovery Systems Inc.	1501189			C[C@H]1OC(C(O)[C@@H]1O)n1cc(F)c(=O)[nH]c1=O	InChI=1S/C9H11FN2O5/c1-3-5(13)6(14)8(17-3)12-2-4(10)7(15)11-9(12)16/h2-3,5-6,8,13-14H,1H3,(H,11,15,16)/t3-,5-,6?,8?/m1/s1	ZWAOHEXOSAUJHY-IRKUJEHTSA-N	246.065199672							110204
SCHEMBL11184005	LSM-1791	Isoxicam	20507134	InChI=1S/C14H13N3O5S/c1-8-7-11(16-22-8)15-14(19)12-13(18)9-5-3-4-6-10(9)23(20,21)17(12)2/h3-7,12H,1-2H3,(H,15,16,19)	SPTMROWPYQRZSX-UHFFFAOYSA-N	CN1C(C(=O)Nc2cc(C)on2)C(=O)c3ccccc3S1(=O)=O	BroadT	BRD-A75552914	BRD-A75552914-001-04-4	MicroSource Discovery Systems Inc.	1503242			CN1C(C(=O)Nc2cc(C)on2)C(=O)c2ccccc2S1(=O)=O	InChI=1S/C14H13N3O5S/c1-8-7-11(16-22-8)15-14(19)12-13(18)9-5-3-4-6-10(9)23(20,21)17(12)2/h3-7,12H,1-2H3,(H,15,16,19)	SPTMROWPYQRZSX-UHFFFAOYSA-N	335.057591236							91865
KBIO2_003865	LSM-15334	Eucatropine	3313	InChI=1S/C17H25NO3/c1-12-14(10-11-17(2,3)18(12)4)21-16(20)15(19)13-8-6-5-7-9-13/h5-9,12,14-15,19H,10-11H2,1-4H3	SXLHPJQSZRLJAE-UHFFFAOYSA-N	CC1C(CCC(C)(C)N1C)OC(=O)C(O)c2ccccc2	BroadT	BRD-A69786436	BRD-A69786436-003-02-5	MicroSource Discovery Systems Inc.	1500295		Cl	CC1C(CCC(C)(C)N1C)OC(=O)C(O)c1ccccc1.Cl	InChI=1S/C17H25NO3.ClH/c1-12-14(10-11-17(2,3)18(12)4)21-16(20)15(19)13-8-6-5-7-9-13;/h5-9,12,14-15,19H,10-11H2,1-4H3;1H	YHDGPLILCNUAKH-UHFFFAOYSA-N	291.18344367							103980
BSPBIO_001720	LSM-21654	Ajmaline	16667686	InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10-,11?,14?,15-,16?,17-,18?,19+,20+/m0/s1	CJDRUOGAGYHKKD-FYGXBCQKSA-N	CC[C@H]1C2CC3[C@@H]4N(C)c5ccccc5[C@]46C[C@@H](C2C6O)N3[C@@H]1O	BroadT	BRD-A48300215	BRD-A48300215-001-01-4	AnalytiCon Discovery GmbH	NP-009373			CC[C@H]1C2CC3[C@@H]4N(C)c5ccccc5[C@]44C[C@@H](C2C4O)N3[C@@H]1O	InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10-,11?,14?,15-,16?,17-,18?,19+,20+/m0/s1	CJDRUOGAGYHKKD-FYGXBCQKSA-N	326.199428092							110205
Dimethylpinocembrin	LSM-21655	5,7-Dimethoxyflavanone, Dimethylpinocembrin, BRD-A90249268	378567	InChI=1S/C17H16O4/c1-19-12-8-15(20-2)17-13(18)10-14(21-16(17)9-12)11-6-4-3-5-7-11/h3-9,14H,10H2,1-2H3	IAFBOKYTDSDNHV-UHFFFAOYSA-N	COc1cc(OC)c2C(=O)CC(Oc2c1)c3ccccc3	BroadT	BRD-A90249268	BRD-A90249268-001-02-4	AnalytiCon Discovery GmbH	NP-001522			COc1cc(OC)c2C(=O)CC(Oc2c1)c1ccccc1	InChI=1S/C17H16O4/c1-19-12-8-15(20-2)17-13(18)10-14(21-16(17)9-12)11-6-4-3-5-7-11/h3-9,14H,10H2,1-2H3	IAFBOKYTDSDNHV-UHFFFAOYSA-N	284.104858992							110206
CA-074 METHYL ESTER	LSM-1653	CA-074-ME	23760717	InChI=1S/C19H31N3O6/c1-5-9-20-16(23)14-15(28-14)17(24)21-13(11(3)6-2)18(25)22-10-7-8-12(22)19(26)27-4/h11-15H,5-10H2,1-4H3,(H,20,23)(H,21,24)/t11?,12-,13-,14-,15-/m0/s1	XGWSRLSPWIEMLQ-RQLZCWDZSA-N	CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@@H](C(C)CC)C(=O)N2CCC[C@H]2C(=O)OC	BroadT	BRD-A56020723	BRD-A56020723-001-02-0	Biomol International Inc.	PI126	2840(V2)-3-N1305		CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@@H](C(C)CC)C(=O)N1CCC[C@H]1C(=O)OC	InChI=1S/C19H31N3O6/c1-5-9-20-16(23)14-15(28-14)17(24)21-13(11(3)6-2)18(25)22-10-7-8-12(22)19(26)27-4/h11-15H,5-10H2,1-4H3,(H,20,23)(H,21,24)/t11?,12-,13-,14-,15-/m0/s1	XGWSRLSPWIEMLQ-RQLZCWDZSA-N	397.221285742							91767
BRD-K20595458-001-01-5	LSM-21656	BRD-K20595458	54647752	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m1/s1	MRXIFVFTBXIAKP-NARIEAHCSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K20595458	BRD-K20595458-001-01-5	Broad Institute of MIT and Harvard	BRD-K20595458			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m1/s1	MRXIFVFTBXIAKP-NARIEAHCSA-N	451.210721058							110207
BRD-K41360142-001-01-1	LSM-21657	BRD-K41360142	54647834	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22-,24-,27+/m0/s1	JUGVVXKOEIJUBH-FYOUZKJCSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K41360142	BRD-K41360142-001-01-1	Broad Institute of MIT and Harvard	BRD-K41360142			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22-,24-,27+/m0/s1	JUGVVXKOEIJUBH-FYOUZKJCSA-N	464.231122144							110208
BRD-K91039845-001-01-0	LSM-21658	BRD-K91039845	54647873	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23+,25+,27-/m0/s1	WDVMFXWGGYMVKP-BBVYRSAVSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K91039845	BRD-K91039845-001-01-0	Broad Institute of MIT and Harvard	BRD-K91039845			COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@@H](CO)O2)cc1	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23+,25+,27-/m0/s1	WDVMFXWGGYMVKP-BBVYRSAVSA-N	509.25258587							110209
BRD-K70414508-001-01-8	LSM-21659	BRD-K70414508	54647904	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21-,23-,25+/m1/s1	LRZRSLNOFHOUJI-VTBBIAPYSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K70414508	BRD-K70414508-001-01-8	Broad Institute of MIT and Harvard	BRD-K70414508			OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21-,23-,25+/m1/s1	LRZRSLNOFHOUJI-VTBBIAPYSA-N	486.18245739							110210
BRD-K71280542-001-01-0	LSM-21660	BRD-K71280542	54647998	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26-,28-/m1/s1	SQCXDLWHKVIWRB-BTBRWJRTSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K71280542	BRD-K71280542-001-01-0	Broad Institute of MIT and Harvard	BRD-K71280542			COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@@H](CO)O2)cc1	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26-,28-/m1/s1	SQCXDLWHKVIWRB-BTBRWJRTSA-N	556.167950178							110211
BRD-K58037351-001-01-1	LSM-21661	BRD-K58037351	54647814	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15-,17+,20+/m0/s1	QAHMIWPLJULOCY-BQCJVYABSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)N(C)C)C[C@H]3c2c1	BroadT	BRD-K58037351	BRD-K58037351-001-01-1	Broad Institute of MIT and Harvard	BRD-K58037351			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15-,17+,20+/m0/s1	QAHMIWPLJULOCY-BQCJVYABSA-N	391.210721058							110212
BRD-K10273027-001-01-3	LSM-21662	BRD-K10273027	54647974	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22-,25-/m1/s1	JQYAUOPJHODSNH-DPQLKAKJSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(Cl)cc4)C[C@H]3c2c1	BroadT	BRD-K10273027	BRD-K10273027-001-01-3	Broad Institute of MIT and Harvard	BRD-K10273027			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22-,25-/m1/s1	JQYAUOPJHODSNH-DPQLKAKJSA-N	487.1873988							110213
BRD-K45905787-001-01-9	LSM-21663	BRD-K45905787	54647911	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21-,23+/m1/s1	OLENBHWSUKSNPF-WACMXJRTSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)N(C)C)C[C@@H]4c3c2	BroadT	BRD-K45905787	BRD-K45905787-001-01-9	Broad Institute of MIT and Harvard	BRD-K45905787			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21-,23+/m1/s1	OLENBHWSUKSNPF-WACMXJRTSA-N	476.161721946							110214
BRD-K93005984-001-01-0	LSM-21664	BRD-K93005984	54647831	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22-,24-,27+/m1/s1	JUGVVXKOEIJUBH-AEDPIONSSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K93005984	BRD-K93005984-001-01-0	Broad Institute of MIT and Harvard	BRD-K93005984			C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22-,24-,27+/m1/s1	JUGVVXKOEIJUBH-AEDPIONSSA-N	464.231122144							110215
BRD-K33932270	LSM-15132		54647772	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21-,24-/m0/s1	DYFXALJZQJAGQY-PMSBSAKUSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4cccnc4)C[C@@H]3c2c1	BroadT	BRD-K33932270	BRD-K33932270-001-01-1	Broad Institute of MIT and Harvard	BRD-K33932270			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cccnc4)O[C@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21-,24-/m0/s1	DYFXALJZQJAGQY-PMSBSAKUSA-N	454.2216201							103788
BRD-K77251422-001-01-0	LSM-21665	BRD-K77251422	54647852	InChI=1S/C23H27FN2O4/c1-26(2)15-7-8-20-17(9-15)18-10-16(29-21(13-27)23(18)30-20)11-22(28)25-12-14-5-3-4-6-19(14)24/h3-9,16,18,21,23,27H,10-13H2,1-2H3,(H,25,28)/t16-,18-,21+,23+/m0/s1	XQYKWCFSNBOVNA-JOXJFCDYSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccccc4F)C[C@H]3c2c1	BroadT	BRD-K77251422	BRD-K77251422-001-01-0	Broad Institute of MIT and Harvard	BRD-K77251422			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C23H27FN2O4/c1-26(2)15-7-8-20-17(9-15)18-10-16(29-21(13-27)23(18)30-20)11-22(28)25-12-14-5-3-4-6-19(14)24/h3-9,16,18,21,23,27H,10-13H2,1-2H3,(H,25,28)/t16-,18-,21+,23+/m0/s1	XQYKWCFSNBOVNA-JOXJFCDYSA-N	414.195485564							110216
BRD-K01794752-001-01-0	LSM-21666	BRD-K01794752	54647764	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23+,25-,28-/m1/s1	HDZKHFXEQLFVHO-YZDMAOCNSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K01794752	BRD-K01794752-001-01-0	Broad Institute of MIT and Harvard	BRD-K01794752			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23+,25-,28-/m1/s1	HDZKHFXEQLFVHO-YZDMAOCNSA-N	476.231122144							110217
BRD-K08239968-001-01-9	LSM-21667	BRD-K08239968	54647991	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19+,21-,23-/m0/s1	QYXXDFPSNSEWLS-FTJYFCJYSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K08239968	BRD-K08239968-001-01-9	Broad Institute of MIT and Harvard	BRD-K08239968			COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(C)(=O)=O)cc34)[C@H](CO)O2)cc1	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19+,21-,23-/m0/s1	QYXXDFPSNSEWLS-FTJYFCJYSA-N	476.161721946							110218
CHEMBL2359420	LSM-21668	SID131444281, BRD-K07993026	54647890	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20-,23-,26+/m0/s1	RQLOITHXBXVBKT-AHNRGXKQSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K07993026	BRD-K07993026-001-01-2	Broad Institute of MIT and Harvard	BRD-K07993026			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20-,23-,26+/m0/s1	RQLOITHXBXVBKT-AHNRGXKQSA-N	468.206050248							110219
BRD-K46694269-001-01-5	LSM-21669	BRD-K46694269	54647822	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21+,23+,26-/m1/s1	HQMAMEQBJJAPDJ-HMMJVGNDSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)N4CCc5ccccc5C4)C[C@H]3c2c1	BroadT	BRD-K46694269	BRD-K46694269-001-01-5	Broad Institute of MIT and Harvard	BRD-K46694269			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21+,23+,26-/m1/s1	HQMAMEQBJJAPDJ-HMMJVGNDSA-N	466.2103867							110220
BRD-K55748336-001-01-6	LSM-21670	BRD-K55748336	54647964	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16-,18-,20+/m0/s1	MPRUPAINZQILBH-PFSLXQJOSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23	BroadT	BRD-K55748336	BRD-K55748336-001-01-6	Broad Institute of MIT and Harvard	BRD-K55748336			OC[C@@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16-,18-,20+/m0/s1	MPRUPAINZQILBH-PFSLXQJOSA-N	416.138364612							110221
BRD-K47009383-001-01-6	LSM-21671	BRD-K47009383	54647742	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22+,24-,26-/m1/s1	APWJOJJCKFYHHM-FWSIMYTDSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K47009383	BRD-K47009383-001-01-6	Broad Institute of MIT and Harvard	BRD-K47009383			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22+,24-,26-/m1/s1	APWJOJJCKFYHHM-FWSIMYTDSA-N	513.203048864							110222
BRD-K31987519-001-01-8	LSM-21672	BRD-K31987519	54647907	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21+,23+,25-/m1/s1	LRZRSLNOFHOUJI-PEHPGLIYSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K31987519	BRD-K31987519-001-01-8	Broad Institute of MIT and Harvard	BRD-K31987519			OC[C@@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21+,23+,25-/m1/s1	LRZRSLNOFHOUJI-PEHPGLIYSA-N	486.18245739							110223
BRD-K51516836-001-01-6	LSM-21673	BRD-K51516836	54647878	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25+,27+/m1/s1	WDVMFXWGGYMVKP-RESCMLIYSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K51516836	BRD-K51516836-001-01-6	Broad Institute of MIT and Harvard	BRD-K51516836			COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@H](CO)O2)cc1	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25+,27+/m1/s1	WDVMFXWGGYMVKP-RESCMLIYSA-N	509.25258587							110224
BRD-K99254482-001-01-5	LSM-21674	BRD-K99254482	54647715	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,23+/m0/s1	DBZIBAKRSCOVBR-LUFCQUEKSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K99254482	BRD-K99254482-001-01-5	Broad Institute of MIT and Harvard	BRD-K99254482			COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](C[C@H]3c2c1)CC(=O)NCc1ccncc1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,23+/m0/s1	DBZIBAKRSCOVBR-LUFCQUEKSA-N	441.189985614							110225
BRD-K67439836-001-01-3	LSM-21675	BRD-K67439836	54647966	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16+,18-,20-/m1/s1	MPRUPAINZQILBH-IHMNZUQTSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23	BroadT	BRD-K67439836	BRD-K67439836-001-01-3	Broad Institute of MIT and Harvard	BRD-K67439836			OC[C@H]1O[C@@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16+,18-,20-/m1/s1	MPRUPAINZQILBH-IHMNZUQTSA-N	416.138364612							110226
BRD-K30685156-001-01-7	LSM-21676	BRD-K30685156	54647866	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18+,20+,22-/m0/s1	LHJCGFYIVQCPBG-ZMUPPCTCSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	BroadT	BRD-K30685156	BRD-K30685156-001-01-7	Broad Institute of MIT and Harvard	BRD-K30685156			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18+,20+,22-/m0/s1	LHJCGFYIVQCPBG-ZMUPPCTCSA-N	493.182455562							110227
BRD-K15056578-001-01-0	LSM-21677	BRD-K15056578	54647867	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18+,20+,22-/m1/s1	LHJCGFYIVQCPBG-DCZASFAJSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	BroadT	BRD-K15056578	BRD-K15056578-001-01-0	Broad Institute of MIT and Harvard	BRD-K15056578			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18+,20+,22-/m1/s1	LHJCGFYIVQCPBG-DCZASFAJSA-N	493.182455562							110228
BRD-K09692366-001-01-6	LSM-21678	BRD-K09692366	54647950	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21-,23-,25+/m0/s1	ZUFBUKYSNNXFMC-YALMDMJRSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K09692366	BRD-K09692366-001-01-6	Broad Institute of MIT and Harvard	BRD-K09692366			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21-,23-,25+/m0/s1	ZUFBUKYSNNXFMC-YALMDMJRSA-N	474.190319972							110229
BRD-K68393298-001-01-2	LSM-21679	BRD-K68393298	54647729	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23+,26+/m1/s1	XOEUNFVLCGVFNC-BCHMZHATSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K68393298	BRD-K68393298-001-01-2	Broad Institute of MIT and Harvard	BRD-K68393298			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23+,26+/m1/s1	XOEUNFVLCGVFNC-BCHMZHATSA-N	468.206050248							110230
BRD-K25577161-001-01-6	LSM-21680	BRD-K25577161	54647999	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26-,28-/m0/s1	SQCXDLWHKVIWRB-FMWRLIIDSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K25577161	BRD-K25577161-001-01-6	Broad Institute of MIT and Harvard	BRD-K25577161			COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@H](CO)O2)cc1	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26-,28-/m0/s1	SQCXDLWHKVIWRB-FMWRLIIDSA-N	556.167950178							110231
BRD-K07102823-001-01-5	LSM-21681	BRD-K07102823	54647732	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19+,22+,25-/m0/s1	IYABYMCTXJKIHR-MNUQHFOJSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccccc4OC)C[C@@H]3c2c1	BroadT	BRD-K07102823	BRD-K07102823-001-01-5	Broad Institute of MIT and Harvard	BRD-K07102823			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccc4OC)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19+,22+,25-/m0/s1	IYABYMCTXJKIHR-MNUQHFOJSA-N	470.20530132							110232
BRD-K16882495-001-01-8	LSM-21682	BRD-K16882495	54648009	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19-,21+,24+/m1/s1	UJBMHCLCDUZLRI-GOSIJUEPSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CC5CC5)cc34)[C@H](CO)O2	BroadT	BRD-K16882495	BRD-K16882495-001-01-8	Broad Institute of MIT and Harvard	BRD-K16882495			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19-,21+,24+/m1/s1	UJBMHCLCDUZLRI-GOSIJUEPSA-N	443.242021186							110233
BRD-K55148639-001-01-3	LSM-21683	BRD-K55148639	54648006	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19+,21-,24-/m1/s1	UJBMHCLCDUZLRI-RMIRKMSDSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CC5CC5)cc34)[C@@H](CO)O2	BroadT	BRD-K55148639	BRD-K55148639-001-01-3	Broad Institute of MIT and Harvard	BRD-K55148639			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19+,21-,24-/m1/s1	UJBMHCLCDUZLRI-RMIRKMSDSA-N	443.242021186							110234
BRD-K31914849-001-01-3	LSM-21684	BRD-K31914849	54647807	InChI=1S/C20H20N2O6/c23-10-17-19-15(7-13(27-17)8-18(24)25)14-6-12(3-4-16(14)28-19)22-20(26)11-2-1-5-21-9-11/h1-6,9,13,15,17,19,23H,7-8,10H2,(H,22,26)(H,24,25)/t13-,15-,17+,19+/m1/s1	PXUNXEMZTUASEH-OVLVRJBISA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)c4cccnc4)cc23	BroadT	BRD-K31914849	BRD-K31914849-001-01-3	Broad Institute of MIT and Harvard	BRD-K31914849			OC[C@@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C20H20N2O6/c23-10-17-19-15(7-13(27-17)8-18(24)25)14-6-12(3-4-16(14)28-19)22-20(26)11-2-1-5-21-9-11/h1-6,9,13,15,17,19,23H,7-8,10H2,(H,22,26)(H,24,25)/t13-,15-,17+,19+/m1/s1	PXUNXEMZTUASEH-OVLVRJBISA-N	384.13213638							110235
BRD-K34738537-001-01-0	LSM-21685	BRD-K34738537	54647926	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16-,18+/m0/s1	XIBRYEMUGCVBEH-WIRVQXDCSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K34738537	BRD-K34738537-001-01-0	Broad Institute of MIT and Harvard	BRD-K34738537			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16-,18+/m0/s1	XIBRYEMUGCVBEH-WIRVQXDCSA-N	398.151157262							110236
BRD-K94920869-001-01-9	LSM-21686	BRD-K94920869	54647986	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19-,21-,23+/m1/s1	QYXXDFPSNSEWLS-LHWDRQQYSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K94920869	BRD-K94920869-001-01-9	Broad Institute of MIT and Harvard	BRD-K94920869			COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(C)(=O)=O)cc34)[C@@H](CO)O2)cc1	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19-,21-,23+/m1/s1	QYXXDFPSNSEWLS-LHWDRQQYSA-N	476.161721946							110237
BRD-K26025965-001-01-3	LSM-21687	BRD-K26025965	54647956	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22-,24-,26+/m1/s1	PIVZJJFMUFHLSR-DBSKKGOSSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K26025965	BRD-K26025965-001-01-3	Broad Institute of MIT and Harvard	BRD-K26025965			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22-,24-,26+/m1/s1	PIVZJJFMUFHLSR-DBSKKGOSSA-N	527.152634472							110238
BRD-K82799005-001-01-6	LSM-21688	BRD-K82799005	54647923	InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18-,20+,22+/m0/s1	VPKMSVVJWJDGNW-FDGCKHTNSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K82799005	BRD-K82799005-001-01-6	Broad Institute of MIT and Harvard	BRD-K82799005			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18-,20+,22+/m0/s1	VPKMSVVJWJDGNW-FDGCKHTNSA-N	447.236935806							110239
BRD-K01906250-001-01-7	LSM-21689	BRD-K01906250	54647977	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22+,25+/m1/s1	JQYAUOPJHODSNH-NARIEAHCSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(Cl)cc4)C[C@@H]3c2c1	BroadT	BRD-K01906250	BRD-K01906250-001-01-7	Broad Institute of MIT and Harvard	BRD-K01906250			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22+,25+/m1/s1	JQYAUOPJHODSNH-NARIEAHCSA-N	487.1873988							110240
BRD-K53117352-001-01-5	LSM-21690	BRD-K53117352	54647863	InChI=1S/C20H21NO7S/c22-11-18-20-16(9-13(27-18)10-19(23)24)15-8-12(6-7-17(15)28-20)21-29(25,26)14-4-2-1-3-5-14/h1-8,13,16,18,20-22H,9-11H2,(H,23,24)/t13-,16-,18+,20+/m1/s1	YMVYEFVBAYOYFR-GNYRAKODSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NS(=O)(=O)c4ccccc4)cc23	BroadT	BRD-K53117352	BRD-K53117352-001-01-5	Broad Institute of MIT and Harvard	BRD-K53117352			OC[C@@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C20H21NO7S/c22-11-18-20-16(9-13(27-18)10-19(23)24)15-8-12(6-7-17(15)28-20)21-29(25,26)14-4-2-1-3-5-14/h1-8,13,16,18,20-22H,9-11H2,(H,23,24)/t13-,16-,18+,20+/m1/s1	YMVYEFVBAYOYFR-GNYRAKODSA-N	419.103872712							110241
BRD-K55490017-001-01-1	LSM-21691	BRD-K55490017	54647944	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20+,22+,24-/m1/s1	YUJPPMQDMPRDFH-HLPIXKIESA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@H](CO)O1	BroadT	BRD-K55490017	BRD-K55490017-001-01-1	Broad Institute of MIT and Harvard	BRD-K55490017			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@H](CO)O1	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20+,22+,24-/m1/s1	YUJPPMQDMPRDFH-HLPIXKIESA-N	490.17737201							110242
BRD-K62933745-001-01-0	LSM-21692	BRD-K62933745	54647841	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22+,24-,27-/m0/s1	JUGVVXKOEIJUBH-HRXLLMHBSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K62933745	BRD-K62933745-001-01-0	Broad Institute of MIT and Harvard	BRD-K62933745			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22+,24-,27-/m0/s1	JUGVVXKOEIJUBH-HRXLLMHBSA-N	464.231122144							110243
BRD-K83919797-001-01-1	LSM-21693	BRD-K83919797	54647862	InChI=1S/C20H21NO7S/c22-11-18-20-16(9-13(27-18)10-19(23)24)15-8-12(6-7-17(15)28-20)21-29(25,26)14-4-2-1-3-5-14/h1-8,13,16,18,20-22H,9-11H2,(H,23,24)/t13-,16-,18+,20+/m0/s1	YMVYEFVBAYOYFR-XGJBHWFVSA-N	OC[C@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NS(=O)(=O)c4ccccc4)cc23	BroadT	BRD-K83919797	BRD-K83919797-001-01-1	Broad Institute of MIT and Harvard	BRD-K83919797			OC[C@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C20H21NO7S/c22-11-18-20-16(9-13(27-18)10-19(23)24)15-8-12(6-7-17(15)28-20)21-29(25,26)14-4-2-1-3-5-14/h1-8,13,16,18,20-22H,9-11H2,(H,23,24)/t13-,16-,18+,20+/m0/s1	YMVYEFVBAYOYFR-XGJBHWFVSA-N	419.103872712							110244
BRD-K40011398-001-01-2	LSM-21694	BRD-K40011398	54647946	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20+,22-,24-/m0/s1	YUJPPMQDMPRDFH-ZDUIBRFZSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@H](CO)O1	BroadT	BRD-K40011398	BRD-K40011398-001-01-2	Broad Institute of MIT and Harvard	BRD-K40011398			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@H](CO)O1	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20+,22-,24-/m0/s1	YUJPPMQDMPRDFH-ZDUIBRFZSA-N	490.17737201							110245
BRD-K55742482-001-01-1	LSM-21695	BRD-K55742482	54647884	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17+,21+,23-/m1/s1	OYAAAFLFGWLAPV-PADGLLGNSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	BroadT	BRD-K55742482	BRD-K55742482-001-01-1	Broad Institute of MIT and Harvard	BRD-K55742482			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17+,21+,23-/m1/s1	OYAAAFLFGWLAPV-PADGLLGNSA-N	454.174001192							110246
BRD-K92145016-001-01-7	LSM-21696	BRD-K92145016	54647995	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26-,28+/m0/s1	SQCXDLWHKVIWRB-IXQFDHPPSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K92145016	BRD-K92145016-001-01-7	Broad Institute of MIT and Harvard	BRD-K92145016			COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@H](CO)O2)cc1	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26-,28+/m0/s1	SQCXDLWHKVIWRB-IXQFDHPPSA-N	556.167950178							110247
BRD-K84928623-001-01-1	LSM-21697	BRD-K84928623	54647760	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23-,25-,28+/m1/s1	HDZKHFXEQLFVHO-FNIBFVHZSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K84928623	BRD-K84928623-001-01-1	Broad Institute of MIT and Harvard	BRD-K84928623			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23-,25-,28+/m1/s1	HDZKHFXEQLFVHO-FNIBFVHZSA-N	476.231122144							110248
BRD-K48181208-001-01-5	LSM-21698	BRD-K48181208	54647892	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20+,23-,26-/m1/s1	RQLOITHXBXVBKT-ZBYDKNLWSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K48181208	BRD-K48181208-001-01-5	Broad Institute of MIT and Harvard	BRD-K48181208			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20+,23-,26-/m1/s1	RQLOITHXBXVBKT-ZBYDKNLWSA-N	468.206050248							110249
BRD-K63921090-001-01-5	LSM-21699	BRD-K63921090	54647853	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16-,18-,21+/m1/s1	IMUPCUMLIPIWQW-OQBJRAFVSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K63921090	BRD-K63921090-001-01-5	Broad Institute of MIT and Harvard	BRD-K63921090			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16-,18-,21+/m1/s1	IMUPCUMLIPIWQW-OQBJRAFVSA-N	404.194736636							110250
BRD-K49259834-001-01-0	LSM-21700	BRD-K49259834	54648013	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15+,17+,19-/m1/s1	DXACVWBRXAONJE-FDZBUTDGSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)N4CCOCC4)C[C@H]3c2c1	BroadT	BRD-K49259834	BRD-K49259834-001-01-0	Broad Institute of MIT and Harvard	BRD-K49259834			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCOCC4)O[C@H]3CO)c2c1	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15+,17+,19-/m1/s1	DXACVWBRXAONJE-FDZBUTDGSA-N	426.146071882							110251
BRD-K37264475-001-01-8	LSM-21701	BRD-K37264475	54647875	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23+,25-,27-/m1/s1	WDVMFXWGGYMVKP-WWUYVNTOSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K37264475	BRD-K37264475-001-01-8	Broad Institute of MIT and Harvard	BRD-K37264475			COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@@H](CO)O2)cc1	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23+,25-,27-/m1/s1	WDVMFXWGGYMVKP-WWUYVNTOSA-N	509.25258587							110252
BRD-K66659512-001-01-8	LSM-21702	BRD-K66659512	54647837	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22-,24+,27+/m1/s1	JUGVVXKOEIJUBH-OGFPWRCLSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K66659512	BRD-K66659512-001-01-8	Broad Institute of MIT and Harvard	BRD-K66659512			C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22-,24+,27+/m1/s1	JUGVVXKOEIJUBH-OGFPWRCLSA-N	464.231122144							110253
BRD-K24745471-001-01-5	LSM-21703	BRD-K24745471	54647910	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21-,23+,25+/m0/s1	LRZRSLNOFHOUJI-FJSLEZNWSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K24745471	BRD-K24745471-001-01-5	Broad Institute of MIT and Harvard	BRD-K24745471			OC[C@H]1O[C@H](CC(=O)NC2CCCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21-,23+,25+/m0/s1	LRZRSLNOFHOUJI-FJSLEZNWSA-N	486.18245739							110254
BRD-K67194034-001-01-4	LSM-21704	BRD-K67194034	54647824	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21+,23-,26-/m0/s1	HQMAMEQBJJAPDJ-OXPRRSNCSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)N4CCc5ccccc5C4)C[C@@H]3c2c1	BroadT	BRD-K67194034	BRD-K67194034-001-01-4	Broad Institute of MIT and Harvard	BRD-K67194034			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21+,23-,26-/m0/s1	HQMAMEQBJJAPDJ-OXPRRSNCSA-N	466.2103867							110255
BRD-K75364998-001-01-7	LSM-21705	BRD-K75364998	54647765	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23+,25-,28-/m0/s1	HDZKHFXEQLFVHO-JWVZEJEHSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K75364998	BRD-K75364998-001-01-7	Broad Institute of MIT and Harvard	BRD-K75364998			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23+,25-,28-/m0/s1	HDZKHFXEQLFVHO-JWVZEJEHSA-N	476.231122144							110256
BRD-K58446192-001-01-7	LSM-21706	BRD-K58446192	54647790	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18-,20+,22+/m1/s1	FIBNIYVZMCRVDE-WOIRZILMSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	BroadT	BRD-K58446192	BRD-K58446192-001-01-7	Broad Institute of MIT and Harvard	BRD-K58446192			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18-,20+,22+/m1/s1	FIBNIYVZMCRVDE-WOIRZILMSA-N	446.151157262							110257
BRD-K15688039-001-01-3	LSM-21707	BRD-K15688039	54647813	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15+,17-,20-/m0/s1	QAHMIWPLJULOCY-IDVHHABFSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)N(C)C)C[C@@H]3c2c1	BroadT	BRD-K15688039	BRD-K15688039-001-01-3	Broad Institute of MIT and Harvard	BRD-K15688039			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15+,17-,20-/m0/s1	QAHMIWPLJULOCY-IDVHHABFSA-N	391.210721058							110258
BRD-K93287182-001-01-4	LSM-21708	BRD-K93287182	54647721	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m1/s1	DBZIBAKRSCOVBR-DUCQWWKISA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K93287182	BRD-K93287182-001-01-4	Broad Institute of MIT and Harvard	BRD-K93287182			COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](C[C@@H]3c2c1)CC(=O)NCc1ccncc1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m1/s1	DBZIBAKRSCOVBR-DUCQWWKISA-N	441.189985614							110259
BRD-K83134023-001-01-3	LSM-21709	BRD-K83134023	54647722	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23-,26+/m1/s1	XOEUNFVLCGVFNC-INZVZTLUSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K83134023	BRD-K83134023-001-01-3	Broad Institute of MIT and Harvard	BRD-K83134023			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23-,26+/m1/s1	XOEUNFVLCGVFNC-INZVZTLUSA-N	468.206050248							110260
BRD-K47027735-001-01-3	LSM-21710	BRD-K47027735	54647829	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22-,24-,27+/m0/s1	JUGVVXKOEIJUBH-MUNIKWPXSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K47027735	BRD-K47027735-001-01-3	Broad Institute of MIT and Harvard	BRD-K47027735			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22-,24-,27+/m0/s1	JUGVVXKOEIJUBH-MUNIKWPXSA-N	464.231122144							110261
BRD-K13680979-001-01-4	LSM-21711	BRD-K13680979	54647731	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19-,22-,25+/m0/s1	IYABYMCTXJKIHR-DOPDFTPFSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccc4OC)C[C@H]3c2c1	BroadT	BRD-K13680979	BRD-K13680979-001-01-4	Broad Institute of MIT and Harvard	BRD-K13680979			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccc4OC)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19-,22-,25+/m0/s1	IYABYMCTXJKIHR-DOPDFTPFSA-N	470.20530132							110262
BRD-K66628829-001-01-1	LSM-21712	BRD-K66628829	54647994	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26-,28+/m1/s1	SQCXDLWHKVIWRB-XILASOBOSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K66628829	BRD-K66628829-001-01-1	Broad Institute of MIT and Harvard	BRD-K66628829			COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@@H](CO)O2)cc1	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26-,28+/m1/s1	SQCXDLWHKVIWRB-XILASOBOSA-N	556.167950178							110263
BRD-K64582050-001-01-2	LSM-21713	BRD-K64582050	54647996	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26+,28-/m0/s1	SQCXDLWHKVIWRB-IXMDGTTKSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K64582050	BRD-K64582050-001-01-2	Broad Institute of MIT and Harvard	BRD-K64582050			COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@@H](CO)O2)cc1	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26+,28-/m0/s1	SQCXDLWHKVIWRB-IXMDGTTKSA-N	556.167950178							110264
BRD-K20290810-001-01-6	LSM-21714	BRD-K20290810	54647836	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22-,24+,27+/m0/s1	JUGVVXKOEIJUBH-FKUFEVMFSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K20290810	BRD-K20290810-001-01-6	Broad Institute of MIT and Harvard	BRD-K20290810			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22-,24+,27+/m0/s1	JUGVVXKOEIJUBH-FKUFEVMFSA-N	464.231122144							110265
BRD-K26397649-001-01-0	LSM-21715	BRD-K26397649	54648017	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15-,17+,19+/m1/s1	DXACVWBRXAONJE-OVLVRJBISA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)N4CCOCC4)C[C@@H]3c2c1	BroadT	BRD-K26397649	BRD-K26397649-001-01-0	Broad Institute of MIT and Harvard	BRD-K26397649			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N4CCOCC4)O[C@H]3CO)c2c1	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15-,17+,19+/m1/s1	DXACVWBRXAONJE-OVLVRJBISA-N	426.146071882							110266
BRD-K60731055-001-01-4	LSM-21716	BRD-K60731055	54647702	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15+,19+,21-/m0/s1	YVFPRJXGACQPOR-GYBPZWCXSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	BroadT	BRD-K60731055	BRD-K60731055-001-01-4	Broad Institute of MIT and Harvard	BRD-K60731055			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15+,19+,21-/m0/s1	YVFPRJXGACQPOR-GYBPZWCXSA-N	430.154014676							110267
BRD-K14396772-001-01-5	LSM-21717	BRD-K14396772	54647799	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19-,21-,23+/m0/s1	RNEATWJSKJKSLU-RAKJYXHLSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)N(C)C)C[C@H]4c3c2)cc1	BroadT	BRD-K14396772	BRD-K14396772-001-01-5	Broad Institute of MIT and Harvard	BRD-K14396772			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)N(C)C)O[C@H]4CO)c3c2)cc1	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19-,21-,23+/m0/s1	RNEATWJSKJKSLU-RAKJYXHLSA-N	455.205635678							110268
BRD-K13330969-001-01-8	LSM-21718	BRD-K13330969	54647981	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17+,20+,22-/m1/s1	YAXGDUBZOVIXTE-ITKSXJDCSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccccc4F)C[C@H]3c2c1	BroadT	BRD-K13330969	BRD-K13330969-001-01-8	Broad Institute of MIT and Harvard	BRD-K13330969			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17+,20+,22-/m1/s1	YAXGDUBZOVIXTE-ITKSXJDCSA-N	464.14173543							110269
BRD-K34937810-001-01-6	LSM-21719	BRD-K34937810	54647716	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,23-/m0/s1	DBZIBAKRSCOVBR-MVIJMRCYSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K34937810	BRD-K34937810-001-01-6	Broad Institute of MIT and Harvard	BRD-K34937810			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](C[C@@H]3c2c1)CC(=O)NCc1ccncc1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,23-/m0/s1	DBZIBAKRSCOVBR-MVIJMRCYSA-N	441.189985614							110270
BRD-K01511639-001-01-7	LSM-21720	BRD-K01511639	54647828	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22-,24-,27+/m1/s1	JUGVVXKOEIJUBH-CYSUVHFBSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K01511639	BRD-K01511639-001-01-7	Broad Institute of MIT and Harvard	BRD-K01511639			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22-,24-,27+/m1/s1	JUGVVXKOEIJUBH-CYSUVHFBSA-N	464.231122144							110271
BRD-K73676895-001-01-0	LSM-21721	BRD-K73676895	54647738	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22-,24-,26+/m1/s1	APWJOJJCKFYHHM-DFICYWPVSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K73676895	BRD-K73676895-001-01-0	Broad Institute of MIT and Harvard	BRD-K73676895			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22-,24-,26+/m1/s1	APWJOJJCKFYHHM-DFICYWPVSA-N	513.203048864							110272
BRD-K84497751-001-01-1	LSM-21722	BRD-K84497751	54647922	InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18+,20-,22-/m0/s1	VPKMSVVJWJDGNW-UPSSIMKTSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K84497751	BRD-K84497751-001-01-1	Broad Institute of MIT and Harvard	BRD-K84497751			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18+,20-,22-/m0/s1	VPKMSVVJWJDGNW-UPSSIMKTSA-N	447.236935806							110273
BRD-K08392687-001-01-6	LSM-21723	BRD-K08392687	54647751	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m0/s1	MRXIFVFTBXIAKP-FZIATNMDSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K08392687	BRD-K08392687-001-01-6	Broad Institute of MIT and Harvard	BRD-K08392687			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m0/s1	MRXIFVFTBXIAKP-FZIATNMDSA-N	451.210721058							110274
BRD-K55803958-001-01-6	LSM-21724	BRD-K55803958	54647745	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,25+/m1/s1	MRXIFVFTBXIAKP-HWZPKBPFSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K55803958	BRD-K55803958-001-01-6	Broad Institute of MIT and Harvard	BRD-K55803958			OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,25+/m1/s1	MRXIFVFTBXIAKP-HWZPKBPFSA-N	451.210721058							110275
BRD-K05285993-001-01-4	LSM-21725	BRD-K05285993	54647737	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19-,22+,25+/m1/s1	IYABYMCTXJKIHR-UALZOGQESA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccccc4OC)C[C@@H]3c2c1	BroadT	BRD-K05285993	BRD-K05285993-001-01-4	Broad Institute of MIT and Harvard	BRD-K05285993			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccc4OC)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19-,22+,25+/m1/s1	IYABYMCTXJKIHR-UALZOGQESA-N	470.20530132							110276
BRD-K85264253-001-01-7	LSM-21726	BRD-K85264253	54647901	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21+,23-,25-/m0/s1	PSOSBQVEQWFUAG-PYTYSOFPSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34)[C@H](CO)O2	BroadT	BRD-K85264253	BRD-K85264253-001-01-7	Broad Institute of MIT and Harvard	BRD-K85264253			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21+,23-,25-/m0/s1	PSOSBQVEQWFUAG-PYTYSOFPSA-N	498.227848332							110277
BRD-K04490402-001-01-6	LSM-21727	BRD-K04490402	54647784	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18-,20-,22+/m0/s1	FIBNIYVZMCRVDE-DKWQAAHISA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	BroadT	BRD-K04490402	BRD-K04490402-001-01-6	Broad Institute of MIT and Harvard	BRD-K04490402			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18-,20-,22+/m0/s1	FIBNIYVZMCRVDE-DKWQAAHISA-N	446.151157262							110278
BRD-K87509172-001-01-1	LSM-21728	BRD-K87509172	54647821	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21+,23+,26-/m0/s1	HQMAMEQBJJAPDJ-RLCNXLTRSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)N4CCc5ccccc5C4)C[C@@H]3c2c1	BroadT	BRD-K87509172	BRD-K87509172-001-01-1	Broad Institute of MIT and Harvard	BRD-K87509172			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N4CCc5ccccc5C4)O[C@@H]3CO)c2c1	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21+,23+,26-/m0/s1	HQMAMEQBJJAPDJ-RLCNXLTRSA-N	466.2103867							110279
BRD-K65180968-001-01-5	LSM-21729	BRD-K65180968	54647882	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17-,21-,23+/m0/s1	OYAAAFLFGWLAPV-HDVXSNRVSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	BroadT	BRD-K65180968	BRD-K65180968-001-01-5	Broad Institute of MIT and Harvard	BRD-K65180968			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17-,21-,23+/m0/s1	OYAAAFLFGWLAPV-HDVXSNRVSA-N	454.174001192							110280
BRD-K95449954-001-01-4	LSM-21730	BRD-K95449954	54647929	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16-,18-/m1/s1	XIBRYEMUGCVBEH-DPHWQOANSA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K95449954	BRD-K95449954-001-01-4	Broad Institute of MIT and Harvard	BRD-K95449954			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16-,18-/m1/s1	XIBRYEMUGCVBEH-DPHWQOANSA-N	398.151157262							110281
BRD-K33839420-001-01-7	LSM-21731	BRD-K33839420	54647802	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19+,21-,23-/m1/s1	RNEATWJSKJKSLU-GUBFDYSESA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)N(C)C)C[C@H]4c3c2)cc1	BroadT	BRD-K33839420	BRD-K33839420-001-01-7	Broad Institute of MIT and Harvard	BRD-K33839420			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)N(C)C)O[C@@H]4CO)c3c2)cc1	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19+,21-,23-/m1/s1	RNEATWJSKJKSLU-GUBFDYSESA-N	455.205635678							110282
BRD-K26450848-001-01-6	LSM-21732	BRD-K26450848	54647749	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m1/s1	MRXIFVFTBXIAKP-DPQLKAKJSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K26450848	BRD-K26450848-001-01-6	Broad Institute of MIT and Harvard	BRD-K26450848			OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m1/s1	MRXIFVFTBXIAKP-DPQLKAKJSA-N	451.210721058							110283
BRD-K46798264-001-01-9	LSM-21733	BRD-K46798264	54647744	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22-,24+,26+/m1/s1	APWJOJJCKFYHHM-GUAAGHCTSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K46798264	BRD-K46798264-001-01-9	Broad Institute of MIT and Harvard	BRD-K46798264			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22-,24+,26+/m1/s1	APWJOJJCKFYHHM-GUAAGHCTSA-N	513.203048864							110284
BRD-K76912633-001-01-3	LSM-21734	BRD-K76912633	54647763	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23+,25+,28-/m1/s1	HDZKHFXEQLFVHO-IBFWWDTPSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K76912633	BRD-K76912633-001-01-3	Broad Institute of MIT and Harvard	BRD-K76912633			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23+,25+,28-/m1/s1	HDZKHFXEQLFVHO-IBFWWDTPSA-N	476.231122144							110285
BRD-K13532300-001-01-7	LSM-21735	BRD-K13532300	54647916	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21-,23-/m0/s1	OLENBHWSUKSNPF-RZNKLVQRSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)N(C)C)C[C@@H]4c3c2	BroadT	BRD-K13532300	BRD-K13532300-001-01-7	Broad Institute of MIT and Harvard	BRD-K13532300			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21-,23-/m0/s1	OLENBHWSUKSNPF-RZNKLVQRSA-N	476.161721946							110286
BRD-K90319526-001-01-3	LSM-21736	BRD-K90319526	54647959	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22+,24-,26-/m1/s1	PIVZJJFMUFHLSR-OLTCJGHMSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K90319526	BRD-K90319526-001-01-3	Broad Institute of MIT and Harvard	BRD-K90319526			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22+,24-,26-/m1/s1	PIVZJJFMUFHLSR-OLTCJGHMSA-N	527.152634472							110287
BRD-K05225547-001-01-1	LSM-21737	BRD-K05225547	54647769	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21+,24-/m0/s1	DYFXALJZQJAGQY-FCMRVMJTSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cccnc4)C[C@@H]3c2c1	BroadT	BRD-K05225547	BRD-K05225547-001-01-1	Broad Institute of MIT and Harvard	BRD-K05225547			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cccnc4)O[C@@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21+,24-/m0/s1	DYFXALJZQJAGQY-FCMRVMJTSA-N	454.2216201							110288
BRD-K06816939-001-01-2	LSM-21738	BRD-K06816939	54647962	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22-,24+,26+/m1/s1	PIVZJJFMUFHLSR-IXVWUCSXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K06816939	BRD-K06816939-001-01-2	Broad Institute of MIT and Harvard	BRD-K06816939			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22-,24+,26+/m1/s1	PIVZJJFMUFHLSR-IXVWUCSXSA-N	527.152634472							110289
BRD-K11555731-001-01-9	LSM-21739	BRD-K11555731	54647806	InChI=1S/C20H20N2O6/c23-10-17-19-15(7-13(27-17)8-18(24)25)14-6-12(3-4-16(14)28-19)22-20(26)11-2-1-5-21-9-11/h1-6,9,13,15,17,19,23H,7-8,10H2,(H,22,26)(H,24,25)/t13-,15-,17-,19+/m1/s1	PXUNXEMZTUASEH-VWMOJTHMSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)c4cccnc4)cc23	BroadT	BRD-K11555731	BRD-K11555731-001-01-9	Broad Institute of MIT and Harvard	BRD-K11555731			OC[C@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C20H20N2O6/c23-10-17-19-15(7-13(27-17)8-18(24)25)14-6-12(3-4-16(14)28-19)22-20(26)11-2-1-5-21-9-11/h1-6,9,13,15,17,19,23H,7-8,10H2,(H,22,26)(H,24,25)/t13-,15-,17-,19+/m1/s1	PXUNXEMZTUASEH-VWMOJTHMSA-N	384.13213638							110290
BRD-K28297324-001-01-2	LSM-21740	BRD-K28297324	54647718	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,23-/m1/s1	DBZIBAKRSCOVBR-RWSUSOHTSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K28297324	BRD-K28297324-001-01-2	Broad Institute of MIT and Harvard	BRD-K28297324			COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](C[C@H]3c2c1)CC(=O)NCc1ccncc1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,23-/m1/s1	DBZIBAKRSCOVBR-RWSUSOHTSA-N	441.189985614							110291
BRD-K63598288-001-01-3	LSM-21741	BRD-K63598288	54647795	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17+,19-,21-/m1/s1	IEHAYHWJNYCLRG-JLGOVJKGSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)O)C[C@H]4c3c2	BroadT	BRD-K63598288	BRD-K63598288-001-01-3	Broad Institute of MIT and Harvard	BRD-K63598288			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(O)=O)O[C@@H]3CO)c2c1	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17+,19-,21-/m1/s1	IEHAYHWJNYCLRG-JLGOVJKGSA-N	449.114437396							110292
BRD-K06833081-001-01-3	LSM-21742	BRD-K06833081	54647940	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19+,22+/m1/s1	ZXIOEXCQTCPDNZ-XUAYLNFESA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K06833081	BRD-K06833081-001-01-3	Broad Institute of MIT and Harvard	BRD-K06833081			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19+,22+/m1/s1	ZXIOEXCQTCPDNZ-XUAYLNFESA-N	402.21547208							110293
BRD-K71815077-001-01-6	LSM-21743	BRD-K71815077	54647780	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22+,26-,28-/m0/s1	OEYUNRREIFVABF-HYRFHYEVSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K71815077	BRD-K71815077-001-01-6	Broad Institute of MIT and Harvard	BRD-K71815077			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22+,26-,28-/m0/s1	OEYUNRREIFVABF-HYRFHYEVSA-N	519.21694929							110294
BRD-K94309743-001-01-7	LSM-21744	BRD-K94309743	54647796	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17-,19+,21+/m0/s1	IEHAYHWJNYCLRG-QBGRRASTSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)O)C[C@H]4c3c2	BroadT	BRD-K94309743	BRD-K94309743-001-01-7	Broad Institute of MIT and Harvard	BRD-K94309743			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(O)=O)O[C@@H]3CO)c2c1	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17-,19+,21+/m0/s1	IEHAYHWJNYCLRG-QBGRRASTSA-N	449.114437396							110295
BRD-K48562317-001-01-4	LSM-21745	BRD-K48562317	54647857	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16+,18-,21-/m0/s1	IMUPCUMLIPIWQW-WTFQOOOSSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K48562317	BRD-K48562317-001-01-4	Broad Institute of MIT and Harvard	BRD-K48562317			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16+,18-,21-/m0/s1	IMUPCUMLIPIWQW-WTFQOOOSSA-N	404.194736636							110296
BRD-K93680643-001-01-3	LSM-21746	BRD-K93680643	54647789	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18-,20+,22+/m0/s1	FIBNIYVZMCRVDE-FZDNCAFZSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K93680643	BRD-K93680643-001-01-3	Broad Institute of MIT and Harvard	BRD-K93680643			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18-,20+,22+/m0/s1	FIBNIYVZMCRVDE-FZDNCAFZSA-N	446.151157262							110297
BRD-K25915020-001-01-9	LSM-21747	BRD-K25915020	54647846	InChI=1S/C23H23F4N3O5/c24-12-1-3-13(4-2-12)29-22(33)30-14-5-6-18-16(7-14)17-8-15(34-19(10-31)21(17)35-18)9-20(32)28-11-23(25,26)27/h1-7,15,17,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t15-,17+,19-,21-/m0/s1	SJYXGOSVXNMHEN-MRCYXTNMSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23	BroadT	BRD-K25915020	BRD-K25915020-001-01-9	Broad Institute of MIT and Harvard	BRD-K25915020			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C23H23F4N3O5/c24-12-1-3-13(4-2-12)29-22(33)30-14-5-6-18-16(7-14)17-8-15(34-19(10-31)21(17)35-18)9-20(32)28-11-23(25,26)27/h1-7,15,17,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t15-,17+,19-,21-/m0/s1	SJYXGOSVXNMHEN-MRCYXTNMSA-N	497.157383666							110298
BRD-K19301712-001-01-3	LSM-21748	BRD-K19301712	54647708	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20+,22+,24-/m0/s1	TUZKBHQBMODFEV-AYEZKCMBSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K19301712	BRD-K19301712-001-01-3	Broad Institute of MIT and Harvard	BRD-K19301712			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20+,22+,24-/m0/s1	TUZKBHQBMODFEV-AYEZKCMBSA-N	451.210721058							110299
BRD-K39619294-001-01-0	LSM-21749	BRD-K39619294	54647710	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20+,22-,24-/m1/s1	TUZKBHQBMODFEV-USHXRURQSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K39619294	BRD-K39619294-001-01-0	Broad Institute of MIT and Harvard	BRD-K39619294			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20+,22-,24-/m1/s1	TUZKBHQBMODFEV-USHXRURQSA-N	451.210721058							110300
BRD-K56674500-001-01-3	LSM-21750	BRD-K56674500	54647730	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19-,22-,25+/m1/s1	IYABYMCTXJKIHR-NUEVYEGOSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccccc4OC)C[C@@H]3c2c1	BroadT	BRD-K56674500	BRD-K56674500-001-01-3	Broad Institute of MIT and Harvard	BRD-K56674500			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccc4OC)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19-,22-,25+/m1/s1	IYABYMCTXJKIHR-NUEVYEGOSA-N	470.20530132							110301
BRD-K43251717-001-01-5	LSM-21751	BRD-K43251717	54647776	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22-,26-,28+/m0/s1	OEYUNRREIFVABF-UCAWGOPWSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K43251717	BRD-K43251717-001-01-5	Broad Institute of MIT and Harvard	BRD-K43251717			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22-,26-,28+/m0/s1	OEYUNRREIFVABF-UCAWGOPWSA-N	519.21694929							110302
BRD-K73521978-001-01-8	LSM-21752	BRD-K73521978	54647924	InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18-,20+,22+/m1/s1	VPKMSVVJWJDGNW-MDRHQERFSA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K73521978	BRD-K73521978-001-01-8	Broad Institute of MIT and Harvard	BRD-K73521978			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18-,20+,22+/m1/s1	VPKMSVVJWJDGNW-MDRHQERFSA-N	447.236935806							110303
BRD-K32766179-001-01-6	LSM-21753	BRD-K32766179	54647851	InChI=1S/C23H27FN2O4/c1-26(2)15-7-8-20-17(9-15)18-10-16(29-21(13-27)23(18)30-20)11-22(28)25-12-14-5-3-4-6-19(14)24/h3-9,16,18,21,23,27H,10-13H2,1-2H3,(H,25,28)/t16-,18-,21-,23+/m0/s1	XQYKWCFSNBOVNA-DJTDUFQSSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccc4F)C[C@H]3c2c1	BroadT	BRD-K32766179	BRD-K32766179-001-01-6	Broad Institute of MIT and Harvard	BRD-K32766179			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C23H27FN2O4/c1-26(2)15-7-8-20-17(9-15)18-10-16(29-21(13-27)23(18)30-20)11-22(28)25-12-14-5-3-4-6-19(14)24/h3-9,16,18,21,23,27H,10-13H2,1-2H3,(H,25,28)/t16-,18-,21-,23+/m0/s1	XQYKWCFSNBOVNA-DJTDUFQSSA-N	414.195485564							110304
BRD-K12661022-001-01-2	LSM-21754	BRD-K12661022	54647793	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17+,19+,21-/m0/s1	IEHAYHWJNYCLRG-IBRSFNOQSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)O)C[C@@H]4c3c2	BroadT	BRD-K12661022	BRD-K12661022-001-01-2	Broad Institute of MIT and Harvard	BRD-K12661022			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(O)=O)O[C@@H]3CO)c2c1	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17+,19+,21-/m0/s1	IEHAYHWJNYCLRG-IBRSFNOQSA-N	449.114437396							110305
BRD-K18394925-001-01-2	LSM-21755	BRD-K18394925	54647980	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17+,20+,22-/m0/s1	YAXGDUBZOVIXTE-QBLKZJFASA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccccc4F)C[C@@H]3c2c1	BroadT	BRD-K18394925	BRD-K18394925-001-01-2	Broad Institute of MIT and Harvard	BRD-K18394925			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17+,20+,22-/m0/s1	YAXGDUBZOVIXTE-QBLKZJFASA-N	464.14173543							110306
BRD-K50343904-001-01-3	LSM-21756	BRD-K50343904	54647936	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19+,22-/m1/s1	ZXIOEXCQTCPDNZ-TXDFXGTJSA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K50343904	BRD-K50343904-001-01-3	Broad Institute of MIT and Harvard	BRD-K50343904			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19+,22-/m1/s1	ZXIOEXCQTCPDNZ-TXDFXGTJSA-N	402.21547208							110307
BRD-K05410443-001-01-4	LSM-21757	BRD-K05410443	54647938	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19-,22-/m0/s1	ZXIOEXCQTCPDNZ-VYXPOXFGSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K05410443	BRD-K05410443-001-01-4	Broad Institute of MIT and Harvard	BRD-K05410443			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19-,22-/m0/s1	ZXIOEXCQTCPDNZ-VYXPOXFGSA-N	402.21547208							110308
BRD-K63542581-001-01-5	LSM-21758	BRD-K63542581	54647881	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17-,21-,23+/m1/s1	OYAAAFLFGWLAPV-AMZDVIMWSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	BroadT	BRD-K63542581	BRD-K63542581-001-01-5	Broad Institute of MIT and Harvard	BRD-K63542581			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17-,21-,23+/m1/s1	OYAAAFLFGWLAPV-AMZDVIMWSA-N	454.174001192							110309
BRD-K49875009-001-01-2	LSM-21759	BRD-K49875009	54647909	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21+,23-,25-/m0/s1	LRZRSLNOFHOUJI-XDCBZQCGSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K49875009	BRD-K49875009-001-01-2	Broad Institute of MIT and Harvard	BRD-K49875009			OC[C@@H]1O[C@H](CC(=O)NC2CCCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21+,23-,25-/m0/s1	LRZRSLNOFHOUJI-XDCBZQCGSA-N	486.18245739							110310
BRD-K36891205-001-01-6	LSM-21760	BRD-K36891205	54647794	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17+,19+,21-/m1/s1	IEHAYHWJNYCLRG-CUYZEOOHSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)O)C[C@H]4c3c2	BroadT	BRD-K36891205	BRD-K36891205-001-01-6	Broad Institute of MIT and Harvard	BRD-K36891205			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(O)=O)O[C@H]3CO)c2c1	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17+,19+,21-/m1/s1	IEHAYHWJNYCLRG-CUYZEOOHSA-N	449.114437396							110311
BRD-K40290605-001-01-1	LSM-21761	BRD-K40290605	54647756	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22+,25-,27-/m1/s1	FUBUSFISZJCQOM-QSEJSZHHSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K40290605	BRD-K40290605-001-01-1	Broad Institute of MIT and Harvard	BRD-K40290605			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22+,25-,27-/m1/s1	FUBUSFISZJCQOM-QSEJSZHHSA-N	562.13854183							110312
BRD-K20862478-001-01-5	LSM-21762	BRD-K20862478	54647937	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19-,22-/m1/s1	ZXIOEXCQTCPDNZ-MDDDDHJVSA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K20862478	BRD-K20862478-001-01-5	Broad Institute of MIT and Harvard	BRD-K20862478			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19-,22-/m1/s1	ZXIOEXCQTCPDNZ-MDDDDHJVSA-N	402.21547208							110313
BRD-K25708366-001-01-0	LSM-21763	BRD-K25708366	54647970	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22-,25+/m1/s1	JQYAUOPJHODSNH-HWZPKBPFSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(Cl)cc4)C[C@@H]3c2c1	BroadT	BRD-K25708366	BRD-K25708366-001-01-0	Broad Institute of MIT and Harvard	BRD-K25708366			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22-,25+/m1/s1	JQYAUOPJHODSNH-HWZPKBPFSA-N	487.1873988							110314
BRD-K24644316-001-01-9	LSM-21764	BRD-K24644316	54647817	InChI=1S/C19H28N2O4/c1-4-7-20-18(23)10-13-9-15-14-8-12(21(2)3)5-6-16(14)25-19(15)17(11-22)24-13/h5-6,8,13,15,17,19,22H,4,7,9-11H2,1-3H3,(H,20,23)/t13-,15-,17+,19+/m0/s1	OCZIBHZIBGZVHV-VGDUNAEUSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	BroadT	BRD-K24644316	BRD-K24644316-001-01-9	Broad Institute of MIT and Harvard	BRD-K24644316			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	InChI=1S/C19H28N2O4/c1-4-7-20-18(23)10-13-9-15-14-8-12(21(2)3)5-6-16(14)25-19(15)17(11-22)24-13/h5-6,8,13,15,17,19,22H,4,7,9-11H2,1-3H3,(H,20,23)/t13-,15-,17+,19+/m0/s1	OCZIBHZIBGZVHV-VGDUNAEUSA-N	348.204907396							110315
BRD-K17271382-001-01-9	LSM-21765	BRD-K17271382	54647965	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16+,18+,20-/m1/s1	MPRUPAINZQILBH-VKSDOSABSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23	BroadT	BRD-K17271382	BRD-K17271382-001-01-9	Broad Institute of MIT and Harvard	BRD-K17271382			OC[C@@H]1O[C@@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16+,18+,20-/m1/s1	MPRUPAINZQILBH-VKSDOSABSA-N	416.138364612							110316
BRD-K67429473-001-01-2	LSM-21766	BRD-K67429473	54648005	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19+,21+,24-/m1/s1	UJBMHCLCDUZLRI-OFYLTFBOSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CC5CC5)cc34)[C@H](CO)O2	BroadT	BRD-K67429473	BRD-K67429473-001-01-2	Broad Institute of MIT and Harvard	BRD-K67429473			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19+,21+,24-/m1/s1	UJBMHCLCDUZLRI-OFYLTFBOSA-N	443.242021186							110317
BRD-K15028550-001-01-1	LSM-21767	BRD-K15028550	54647844	InChI=1S/C23H23F4N3O5/c24-12-1-3-13(4-2-12)29-22(33)30-14-5-6-18-16(7-14)17-8-15(34-19(10-31)21(17)35-18)9-20(32)28-11-23(25,26)27/h1-7,15,17,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t15-,17-,19-,21+/m0/s1	SJYXGOSVXNMHEN-WRGRXTPVSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23	BroadT	BRD-K15028550	BRD-K15028550-001-01-1	Broad Institute of MIT and Harvard	BRD-K15028550			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C23H23F4N3O5/c24-12-1-3-13(4-2-12)29-22(33)30-14-5-6-18-16(7-14)17-8-15(34-19(10-31)21(17)35-18)9-20(32)28-11-23(25,26)27/h1-7,15,17,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t15-,17-,19-,21+/m0/s1	SJYXGOSVXNMHEN-WRGRXTPVSA-N	497.157383666							110318
BRD-K58473567-001-01-8	LSM-21768	BRD-K58473567	54647948	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20-,22+,24+/m1/s1	YUJPPMQDMPRDFH-OITMPTDNSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@H](CO)O1	BroadT	BRD-K58473567	BRD-K58473567-001-01-8	Broad Institute of MIT and Harvard	BRD-K58473567			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@H](CO)O1	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20-,22+,24+/m1/s1	YUJPPMQDMPRDFH-OITMPTDNSA-N	490.17737201							110319
BRD-K15714717-001-01-6	LSM-21769	BRD-K15714717	54647712	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20-,22+,24+/m0/s1	TUZKBHQBMODFEV-YCYVKTGYSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K15714717	BRD-K15714717-001-01-6	Broad Institute of MIT and Harvard	BRD-K15714717			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20-,22+,24+/m0/s1	TUZKBHQBMODFEV-YCYVKTGYSA-N	451.210721058							110320
BRD-K94513012-001-01-8	LSM-21770	BRD-K94513012	54647928	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16+,18-/m1/s1	XIBRYEMUGCVBEH-BSXOQXRQSA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K94513012	BRD-K94513012-001-01-8	Broad Institute of MIT and Harvard	BRD-K94513012			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16+,18-/m1/s1	XIBRYEMUGCVBEH-BSXOQXRQSA-N	398.151157262							110321
BRD-K82869371-001-01-3	LSM-21771	BRD-K82869371	54647854	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16-,18-,21+/m0/s1	IMUPCUMLIPIWQW-YZZRYBLGSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K82869371	BRD-K82869371-001-01-3	Broad Institute of MIT and Harvard	BRD-K82869371			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16-,18-,21+/m0/s1	IMUPCUMLIPIWQW-YZZRYBLGSA-N	404.194736636							110322
BRD-K50872561-001-01-5	LSM-21772	BRD-K50872561	54647987	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19-,21-,23+/m0/s1	QYXXDFPSNSEWLS-RAKJYXHLSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K50872561	BRD-K50872561-001-01-5	Broad Institute of MIT and Harvard	BRD-K50872561			COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(C)(=O)=O)cc34)[C@H](CO)O2)cc1	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19-,21-,23+/m0/s1	QYXXDFPSNSEWLS-RAKJYXHLSA-N	476.161721946							110323
BRD-K22538427-001-01-1	LSM-21773	BRD-K22538427	54647823	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21+,23-,26-/m1/s1	HQMAMEQBJJAPDJ-YDOBTQPPSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)N4CCc5ccccc5C4)C[C@H]3c2c1	BroadT	BRD-K22538427	BRD-K22538427-001-01-1	Broad Institute of MIT and Harvard	BRD-K22538427			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCc5ccccc5C4)O[C@@H]3CO)c2c1	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21+,23-,26-/m1/s1	HQMAMEQBJJAPDJ-YDOBTQPPSA-N	466.2103867							110324
BRD-K17486589-001-01-4	LSM-21774	BRD-K17486589	54647723	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23-,26+/m0/s1	XOEUNFVLCGVFNC-MDJJAXGLSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K17486589	BRD-K17486589-001-01-4	Broad Institute of MIT and Harvard	BRD-K17486589			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23-,26+/m0/s1	XOEUNFVLCGVFNC-MDJJAXGLSA-N	468.206050248							110325
BRD-K08929287-001-01-9	LSM-21775	BRD-K08929287	54647888	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17-,21+,23+/m1/s1	OYAAAFLFGWLAPV-UNXOBOICSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	BroadT	BRD-K08929287	BRD-K08929287-001-01-9	Broad Institute of MIT and Harvard	BRD-K08929287			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17-,21+,23+/m1/s1	OYAAAFLFGWLAPV-UNXOBOICSA-N	454.174001192							110326
BRD-K81208730-001-01-1	LSM-21776	BRD-K81208730	54647787	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18+,20-,22-/m1/s1	FIBNIYVZMCRVDE-SNDIGXPUSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K81208730	BRD-K81208730-001-01-1	Broad Institute of MIT and Harvard	BRD-K81208730			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18+,20-,22-/m1/s1	FIBNIYVZMCRVDE-SNDIGXPUSA-N	446.151157262							110327
BRD-K06979925-001-01-4	LSM-21777	BRD-K06979925	54647874	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23+,25+,27-/m1/s1	WDVMFXWGGYMVKP-WFHOOFKDSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K06979925	BRD-K06979925-001-01-4	Broad Institute of MIT and Harvard	BRD-K06979925			COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@H](CO)O2)cc1	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23+,25+,27-/m1/s1	WDVMFXWGGYMVKP-WFHOOFKDSA-N	509.25258587							110328
BRD-K63955326-001-01-9	LSM-21778	BRD-K63955326	54647879	InChI=1S/C23H27N3O5/c1-26(2)22(29)12-16-11-18-17-10-15(25-21(28)9-14-5-7-24-8-6-14)3-4-19(17)31-23(18)20(13-27)30-16/h3-8,10,16,18,20,23,27H,9,11-13H2,1-2H3,(H,25,28)/t16-,18+,20-,23-/m1/s1	MTNZWEPDKOJLIY-RWSUSOHTSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	BroadT	BRD-K63955326	BRD-K63955326-001-01-9	Broad Institute of MIT and Harvard	BRD-K63955326			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	InChI=1S/C23H27N3O5/c1-26(2)22(29)12-16-11-18-17-10-15(25-21(28)9-14-5-7-24-8-6-14)3-4-19(17)31-23(18)20(13-27)30-16/h3-8,10,16,18,20,23,27H,9,11-13H2,1-2H3,(H,25,28)/t16-,18+,20-,23-/m1/s1	MTNZWEPDKOJLIY-RWSUSOHTSA-N	425.195070994							110329
BRD-K03565207-001-01-3	LSM-21779	BRD-K03565207	54647861	InChI=1S/C20H21NO7S/c22-11-18-20-16(9-13(27-18)10-19(23)24)15-8-12(6-7-17(15)28-20)21-29(25,26)14-4-2-1-3-5-14/h1-8,13,16,18,20-22H,9-11H2,(H,23,24)/t13-,16-,18-,20+/m0/s1	YMVYEFVBAYOYFR-JQIPDMGMSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NS(=O)(=O)c4ccccc4)cc23	BroadT	BRD-K03565207	BRD-K03565207-001-01-3	Broad Institute of MIT and Harvard	BRD-K03565207			OC[C@@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C20H21NO7S/c22-11-18-20-16(9-13(27-18)10-19(23)24)15-8-12(6-7-17(15)28-20)21-29(25,26)14-4-2-1-3-5-14/h1-8,13,16,18,20-22H,9-11H2,(H,23,24)/t13-,16-,18-,20+/m0/s1	YMVYEFVBAYOYFR-JQIPDMGMSA-N	419.103872712							110330
BRD-K37207132-001-01-2	LSM-21780	BRD-K37207132	54647800	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19+,21+,23-/m0/s1	RNEATWJSKJKSLU-GBPFJNKXSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)N(C)C)C[C@@H]4c3c2)cc1	BroadT	BRD-K37207132	BRD-K37207132-001-01-2	Broad Institute of MIT and Harvard	BRD-K37207132			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)N(C)C)O[C@@H]4CO)c3c2)cc1	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19+,21+,23-/m0/s1	RNEATWJSKJKSLU-GBPFJNKXSA-N	455.205635678							110331
BRD-K50592466-001-01-5	LSM-21781	BRD-K50592466	54647947	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20-,22+,24+/m0/s1	YUJPPMQDMPRDFH-HYWXBTQMSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@@H](CO)O1	BroadT	BRD-K50592466	BRD-K50592466-001-01-5	Broad Institute of MIT and Harvard	BRD-K50592466			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@@H](CO)O1	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20-,22+,24+/m0/s1	YUJPPMQDMPRDFH-HYWXBTQMSA-N	490.17737201							110332
BRD-K84621347-001-01-7	LSM-21782	BRD-K84621347	54648004	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19+,21+,24-/m0/s1	UJBMHCLCDUZLRI-FCMRVMJTSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CC5CC5)cc34)[C@@H](CO)O2	BroadT	BRD-K84621347	BRD-K84621347-001-01-7	Broad Institute of MIT and Harvard	BRD-K84621347			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19+,21+,24-/m0/s1	UJBMHCLCDUZLRI-FCMRVMJTSA-N	443.242021186							110333
BRD-K93075513-001-01-3	LSM-21783	BRD-K93075513	54647864	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18-,20-,22+/m1/s1	LHJCGFYIVQCPBG-ZLLBNUPZSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	BroadT	BRD-K93075513	BRD-K93075513-001-01-3	Broad Institute of MIT and Harvard	BRD-K93075513			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18-,20-,22+/m1/s1	LHJCGFYIVQCPBG-ZLLBNUPZSA-N	493.182455562							110334
BRD-K99482429-001-01-8	LSM-21784	BRD-K99482429	54647743	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22-,24+,26+/m0/s1	APWJOJJCKFYHHM-LFSKCEFNSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K99482429	BRD-K99482429-001-01-8	Broad Institute of MIT and Harvard	BRD-K99482429			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22-,24+,26+/m0/s1	APWJOJJCKFYHHM-LFSKCEFNSA-N	513.203048864							110335
BRD-K26641951-001-01-3	LSM-21785	BRD-K26641951	54647816	InChI=1S/C19H28N2O4/c1-4-7-20-18(23)10-13-9-15-14-8-12(21(2)3)5-6-16(14)25-19(15)17(11-22)24-13/h5-6,8,13,15,17,19,22H,4,7,9-11H2,1-3H3,(H,20,23)/t13-,15+,17-,19-/m0/s1	OCZIBHZIBGZVHV-PZFZOXMESA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1	BroadT	BRD-K26641951	BRD-K26641951-001-01-3	Broad Institute of MIT and Harvard	BRD-K26641951			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1	InChI=1S/C19H28N2O4/c1-4-7-20-18(23)10-13-9-15-14-8-12(21(2)3)5-6-16(14)25-19(15)17(11-22)24-13/h5-6,8,13,15,17,19,22H,4,7,9-11H2,1-3H3,(H,20,23)/t13-,15+,17-,19-/m0/s1	OCZIBHZIBGZVHV-PZFZOXMESA-N	348.204907396							110336
BRD-K32327439-001-01-3	LSM-21786	BRD-K32327439	54647954	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21+,23-,25-/m0/s1	ZUFBUKYSNNXFMC-PYTYSOFPSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K32327439	BRD-K32327439-001-01-3	Broad Institute of MIT and Harvard	BRD-K32327439			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21+,23-,25-/m0/s1	ZUFBUKYSNNXFMC-PYTYSOFPSA-N	474.190319972							110337
CHEMBL2362548	LSM-21787	SID131444309, BRD-K81358947	54647918	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21+,23+/m1/s1	OLENBHWSUKSNPF-ZLTNCQPASA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)N(C)C)C[C@@H]4c3c2	BroadT	BRD-K81358947	BRD-K81358947-001-01-3	Broad Institute of MIT and Harvard	BRD-K81358947			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21+,23+/m1/s1	OLENBHWSUKSNPF-ZLTNCQPASA-N	476.161721946							110338
BRD-K65936712-001-01-9	LSM-21788	BRD-K65936712	54647734	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19+,22-,25-/m1/s1	IYABYMCTXJKIHR-NDZNVJBZSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccccc4OC)C[C@H]3c2c1	BroadT	BRD-K65936712	BRD-K65936712-001-01-9	Broad Institute of MIT and Harvard	BRD-K65936712			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccccc4OC)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19+,22-,25-/m1/s1	IYABYMCTXJKIHR-NDZNVJBZSA-N	470.20530132							110339
BRD-K82457502-001-01-9	LSM-21789	BRD-K82457502	54648015	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15+,17-,19-/m0/s1	DXACVWBRXAONJE-PZFZOXMESA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)N4CCOCC4)C[C@@H]3c2c1	BroadT	BRD-K82457502	BRD-K82457502-001-01-9	Broad Institute of MIT and Harvard	BRD-K82457502			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N4CCOCC4)O[C@H]3CO)c2c1	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15+,17-,19-/m0/s1	DXACVWBRXAONJE-PZFZOXMESA-N	426.146071882							110340
BRD-K74504120-001-01-0	LSM-21790	BRD-K74504120	54647889	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20-,23-,26+/m1/s1	RQLOITHXBXVBKT-SNMOHMLRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K74504120	BRD-K74504120-001-01-0	Broad Institute of MIT and Harvard	BRD-K74504120			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20-,23-,26+/m1/s1	RQLOITHXBXVBKT-SNMOHMLRSA-N	468.206050248							110341
BRD-K26293902-001-01-3	LSM-21791	BRD-K26293902	54647833	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22+,24+,27-/m1/s1	JUGVVXKOEIJUBH-PAGYXIEPSA-N	C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K26293902	BRD-K26293902-001-01-3	Broad Institute of MIT and Harvard	BRD-K26293902			C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22+,24+,27-/m1/s1	JUGVVXKOEIJUBH-PAGYXIEPSA-N	464.231122144							110342
BRD-K68133088-001-01-6	LSM-21792	BRD-K68133088	54647982	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17+,20-,22-/m1/s1	YAXGDUBZOVIXTE-WEMWZYORSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccccc4F)C[C@H]3c2c1	BroadT	BRD-K68133088	BRD-K68133088-001-01-6	Broad Institute of MIT and Harvard	BRD-K68133088			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17+,20-,22-/m1/s1	YAXGDUBZOVIXTE-WEMWZYORSA-N	464.14173543							110343
BRD-K65791062-001-01-4	LSM-21793	BRD-K65791062	54647997	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26+,28-/m1/s1	SQCXDLWHKVIWRB-HWMSKCLUSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K65791062	BRD-K65791062-001-01-4	Broad Institute of MIT and Harvard	BRD-K65791062			COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@H](CO)O2)cc1	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26+,28-/m1/s1	SQCXDLWHKVIWRB-HWMSKCLUSA-N	556.167950178							110344
BRD-K20135444-001-01-7	LSM-21794	BRD-K20135444	54647843	InChI=1S/C23H23F4N3O5/c24-12-1-3-13(4-2-12)29-22(33)30-14-5-6-18-16(7-14)17-8-15(34-19(10-31)21(17)35-18)9-20(32)28-11-23(25,26)27/h1-7,15,17,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t15-,17-,19-,21+/m1/s1	SJYXGOSVXNMHEN-WELBPKCISA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23	BroadT	BRD-K20135444	BRD-K20135444-001-01-7	Broad Institute of MIT and Harvard	BRD-K20135444			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C23H23F4N3O5/c24-12-1-3-13(4-2-12)29-22(33)30-14-5-6-18-16(7-14)17-8-15(34-19(10-31)21(17)35-18)9-20(32)28-11-23(25,26)27/h1-7,15,17,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t15-,17-,19-,21+/m1/s1	SJYXGOSVXNMHEN-WELBPKCISA-N	497.157383666							110345
BRD-K82103061-001-01-2	LSM-21795	BRD-K82103061	54647808	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15-,17-,20+/m1/s1	QAHMIWPLJULOCY-PCFVDWANSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)N(C)C)C[C@@H]3c2c1	BroadT	BRD-K82103061	BRD-K82103061-001-01-2	Broad Institute of MIT and Harvard	BRD-K82103061			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15-,17-,20+/m1/s1	QAHMIWPLJULOCY-PCFVDWANSA-N	391.210721058							110346
BRD-K15471766-001-01-3	LSM-21796	BRD-K15471766	54647860	InChI=1S/C20H21NO7S/c22-11-18-20-16(9-13(27-18)10-19(23)24)15-8-12(6-7-17(15)28-20)21-29(25,26)14-4-2-1-3-5-14/h1-8,13,16,18,20-22H,9-11H2,(H,23,24)/t13-,16-,18-,20+/m1/s1	YMVYEFVBAYOYFR-WGYMDGOUSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NS(=O)(=O)c4ccccc4)cc23	BroadT	BRD-K15471766	BRD-K15471766-001-01-3	Broad Institute of MIT and Harvard	BRD-K15471766			OC[C@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C20H21NO7S/c22-11-18-20-16(9-13(27-18)10-19(23)24)15-8-12(6-7-17(15)28-20)21-29(25,26)14-4-2-1-3-5-14/h1-8,13,16,18,20-22H,9-11H2,(H,23,24)/t13-,16-,18-,20+/m1/s1	YMVYEFVBAYOYFR-WGYMDGOUSA-N	419.103872712							110347
BRD-K72025290-001-01-2	LSM-21797	BRD-K72025290	54647724	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23+,26-/m0/s1	XOEUNFVLCGVFNC-RLCNXLTRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K72025290	BRD-K72025290-001-01-2	Broad Institute of MIT and Harvard	BRD-K72025290			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23+,26-/m0/s1	XOEUNFVLCGVFNC-RLCNXLTRSA-N	468.206050248							110348
BRD-K35237824-001-01-4	LSM-21798	BRD-K35237824	54647990	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19+,21-,23-/m1/s1	QYXXDFPSNSEWLS-GUBFDYSESA-N	COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K35237824	BRD-K35237824-001-01-4	Broad Institute of MIT and Harvard	BRD-K35237824			COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(C)(=O)=O)cc34)[C@@H](CO)O2)cc1	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19+,21-,23-/m1/s1	QYXXDFPSNSEWLS-GUBFDYSESA-N	476.161721946							110349
BRD-K33971016-001-01-8	LSM-21799	BRD-K33971016	54647781	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22-,26+,28+/m0/s1	OEYUNRREIFVABF-PWGWJTMSSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K33971016	BRD-K33971016-001-01-8	Broad Institute of MIT and Harvard	BRD-K33971016			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22-,26+,28+/m0/s1	OEYUNRREIFVABF-PWGWJTMSSA-N	519.21694929							110350
BRD-K28936732-001-01-1	LSM-21800	BRD-K28936732	54647741	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22+,24+,26-/m1/s1	APWJOJJCKFYHHM-GRTAZNFBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K28936732	BRD-K28936732-001-01-1	Broad Institute of MIT and Harvard	BRD-K28936732			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22+,24+,26-/m1/s1	APWJOJJCKFYHHM-GRTAZNFBSA-N	513.203048864							110351
BRD-K26141147-001-01-9	LSM-21801	BRD-K26141147	54647733	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19+,22+,25-/m1/s1	IYABYMCTXJKIHR-ZAZKGPHZSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccccc4OC)C[C@H]3c2c1	BroadT	BRD-K26141147	BRD-K26141147-001-01-9	Broad Institute of MIT and Harvard	BRD-K26141147			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccccc4OC)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19+,22+,25-/m1/s1	IYABYMCTXJKIHR-ZAZKGPHZSA-N	470.20530132							110352
BRD-K78120118-001-01-5	LSM-21802	BRD-K78120118	54647720	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m0/s1	DBZIBAKRSCOVBR-VSCJKUSUSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K78120118	BRD-K78120118-001-01-5	Broad Institute of MIT and Harvard	BRD-K78120118			COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](C[C@H]3c2c1)CC(=O)NCc1ccncc1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m0/s1	DBZIBAKRSCOVBR-VSCJKUSUSA-N	441.189985614							110353
BRD-K07147866-001-01-8	LSM-21803	BRD-K07147866	54647949	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21-,23-,25+/m1/s1	ZUFBUKYSNNXFMC-YTAKYCMFSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K07147866	BRD-K07147866-001-01-8	Broad Institute of MIT and Harvard	BRD-K07147866			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21-,23-,25+/m1/s1	ZUFBUKYSNNXFMC-YTAKYCMFSA-N	474.190319972							110354
BRD-K86947360-001-01-6	LSM-21804	BRD-K86947360	54647856	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16+,18-,21-/m1/s1	IMUPCUMLIPIWQW-HRWHDRTOSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K86947360	BRD-K86947360-001-01-6	Broad Institute of MIT and Harvard	BRD-K86947360			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16+,18-,21-/m1/s1	IMUPCUMLIPIWQW-HRWHDRTOSA-N	404.194736636							110355
BRD-K97278846-001-01-7	LSM-21805	BRD-K97278846	54647704	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15+,19-,21-/m1/s1	YVFPRJXGACQPOR-DIZIXXEVSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	BroadT	BRD-K97278846	BRD-K97278846-001-01-7	Broad Institute of MIT and Harvard	BRD-K97278846			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15+,19-,21-/m1/s1	YVFPRJXGACQPOR-DIZIXXEVSA-N	430.154014676							110356
BRD-K60426593-001-01-0	LSM-21806	BRD-K60426593	54648008	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19-,21+,24+/m0/s1	UJBMHCLCDUZLRI-NOOBJOLFSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CC5CC5)cc34)[C@@H](CO)O2	BroadT	BRD-K60426593	BRD-K60426593-001-01-0	Broad Institute of MIT and Harvard	BRD-K60426593			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19-,21+,24+/m0/s1	UJBMHCLCDUZLRI-NOOBJOLFSA-N	443.242021186							110357
BRD-K31763864-001-01-4	LSM-21807	BRD-K31763864	54647797	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17-,19+,21+/m1/s1	IEHAYHWJNYCLRG-DYZHCLJRSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)O)C[C@@H]4c3c2	BroadT	BRD-K31763864	BRD-K31763864-001-01-4	Broad Institute of MIT and Harvard	BRD-K31763864			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(O)=O)O[C@H]3CO)c2c1	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17-,19+,21+/m1/s1	IEHAYHWJNYCLRG-DYZHCLJRSA-N	449.114437396							110358
BRD-K55986495-001-01-9	LSM-21808	BRD-K55986495	54648007	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19+,21-,24-/m0/s1	UJBMHCLCDUZLRI-PMSBSAKUSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CC5CC5)cc34)[C@H](CO)O2	BroadT	BRD-K55986495	BRD-K55986495-001-01-9	Broad Institute of MIT and Harvard	BRD-K55986495			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19+,21-,24-/m0/s1	UJBMHCLCDUZLRI-PMSBSAKUSA-N	443.242021186							110359
BRD-K81210716-001-01-5	LSM-21809	BRD-K81210716	54647957	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22-,24-,26+/m0/s1	PIVZJJFMUFHLSR-CLKGCZJISA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K81210716	BRD-K81210716-001-01-5	Broad Institute of MIT and Harvard	BRD-K81210716			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22-,24-,26+/m0/s1	PIVZJJFMUFHLSR-CLKGCZJISA-N	527.152634472							110360
BRD-K63368351-001-01-3	LSM-21810	BRD-K63368351	54647976	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22+,25+/m0/s1	JQYAUOPJHODSNH-FZIATNMDSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(Cl)cc4)C[C@H]3c2c1	BroadT	BRD-K63368351	BRD-K63368351-001-01-3	Broad Institute of MIT and Harvard	BRD-K63368351			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22+,25+/m0/s1	JQYAUOPJHODSNH-FZIATNMDSA-N	487.1873988							110361
BRD-K33764155-001-01-8	LSM-21811	BRD-K33764155	54647740	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22+,24+,26-/m0/s1	APWJOJJCKFYHHM-RXDHMRHRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K33764155	BRD-K33764155-001-01-8	Broad Institute of MIT and Harvard	BRD-K33764155			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22+,24+,26-/m0/s1	APWJOJJCKFYHHM-RXDHMRHRSA-N	513.203048864							110362
BRD-K89182571-001-01-2	LSM-21812	BRD-K89182571	54647933	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19-,22+/m1/s1	ZXIOEXCQTCPDNZ-AWGCWCAXSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K89182571	BRD-K89182571-001-01-2	Broad Institute of MIT and Harvard	BRD-K89182571			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19-,22+/m1/s1	ZXIOEXCQTCPDNZ-AWGCWCAXSA-N	402.21547208							110363
BRD-K00335734-001-01-6	LSM-21813	BRD-K00335734	54647883	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17+,21+,23-/m0/s1	OYAAAFLFGWLAPV-SITNMCOISA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	BroadT	BRD-K00335734	BRD-K00335734-001-01-6	Broad Institute of MIT and Harvard	BRD-K00335734			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17+,21+,23-/m0/s1	OYAAAFLFGWLAPV-SITNMCOISA-N	454.174001192							110364
BRD-K20442772-001-01-9	LSM-21814	BRD-K20442772	54647761	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23-,25-,28+/m0/s1	HDZKHFXEQLFVHO-CRZMAGMNSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K20442772	BRD-K20442772-001-01-9	Broad Institute of MIT and Harvard	BRD-K20442772			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23-,25-,28+/m0/s1	HDZKHFXEQLFVHO-CRZMAGMNSA-N	476.231122144							110365
BRD-K16238204-001-01-5	LSM-21815	BRD-K16238204	54647971	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22-,25+/m0/s1	JQYAUOPJHODSNH-XZFMWLAQSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(Cl)cc4)C[C@H]3c2c1	BroadT	BRD-K16238204	BRD-K16238204-001-01-5	Broad Institute of MIT and Harvard	BRD-K16238204			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22-,25+/m0/s1	JQYAUOPJHODSNH-XZFMWLAQSA-N	487.1873988							110366
BRD-K39866897-001-01-8	LSM-21816	BRD-K39866897	54647898	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21+,23+,25-/m0/s1	PSOSBQVEQWFUAG-VUHNXCBZSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34)[C@@H](CO)O2	BroadT	BRD-K39866897	BRD-K39866897-001-01-8	Broad Institute of MIT and Harvard	BRD-K39866897			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21+,23+,25-/m0/s1	PSOSBQVEQWFUAG-VUHNXCBZSA-N	498.227848332							110367
BRD-K02051547-001-01-4	LSM-21817	BRD-K02051547	54647952	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21+,23+,25-/m1/s1	ZUFBUKYSNNXFMC-IQKBUIRBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K02051547	BRD-K02051547-001-01-4	Broad Institute of MIT and Harvard	BRD-K02051547			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21+,23+,25-/m1/s1	ZUFBUKYSNNXFMC-IQKBUIRBSA-N	474.190319972							110368
BRD-K69410368-001-01-8	LSM-21818	BRD-K69410368	54647876	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23+,25-,27-/m0/s1	WDVMFXWGGYMVKP-HFFYFMGZSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K69410368	BRD-K69410368-001-01-8	Broad Institute of MIT and Harvard	BRD-K69410368			COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@H](CO)O2)cc1	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23+,25-,27-/m0/s1	WDVMFXWGGYMVKP-HFFYFMGZSA-N	509.25258587							110369
BRD-K97754195-001-01-4	LSM-21819	BRD-K97754195	54647838	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22+,24-,27-/m0/s1	JUGVVXKOEIJUBH-DXGQNGFLSA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K97754195	BRD-K97754195-001-01-4	Broad Institute of MIT and Harvard	BRD-K97754195			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22+,24-,27-/m0/s1	JUGVVXKOEIJUBH-DXGQNGFLSA-N	464.231122144							110370
BRD-K46810672-001-01-8	LSM-21820	BRD-K46810672	54648002	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19-,21-,24+/m1/s1	UJBMHCLCDUZLRI-ISYUWZRGSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CC5CC5)cc34)[C@@H](CO)O2	BroadT	BRD-K46810672	BRD-K46810672-001-01-8	Broad Institute of MIT and Harvard	BRD-K46810672			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19-,21-,24+/m1/s1	UJBMHCLCDUZLRI-ISYUWZRGSA-N	443.242021186							110371
BRD-K44281965-001-01-0	LSM-21821	BRD-K44281965	54647791	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17-,19-,21+/m1/s1	IEHAYHWJNYCLRG-QTRJSKNGSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)O)C[C@@H]4c3c2	BroadT	BRD-K44281965	BRD-K44281965-001-01-0	Broad Institute of MIT and Harvard	BRD-K44281965			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(O)=O)O[C@@H]3CO)c2c1	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17-,19-,21+/m1/s1	IEHAYHWJNYCLRG-QTRJSKNGSA-N	449.114437396							110372
BRD-K46242184-001-01-5	LSM-21822	BRD-K46242184	54647830	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22+,24+,27-/m1/s1	JUGVVXKOEIJUBH-RPDOXZRWSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K46242184	BRD-K46242184-001-01-5	Broad Institute of MIT and Harvard	BRD-K46242184			C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22+,24+,27-/m1/s1	JUGVVXKOEIJUBH-RPDOXZRWSA-N	464.231122144							110373
BRD-K56237820-001-01-2	LSM-21823	BRD-K56237820	54647858	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16-,18+,21+/m0/s1	IMUPCUMLIPIWQW-XYPVVTQSSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K56237820	BRD-K56237820-001-01-2	Broad Institute of MIT and Harvard	BRD-K56237820			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16-,18+,21+/m0/s1	IMUPCUMLIPIWQW-XYPVVTQSSA-N	404.194736636							110374
BRD-K23443580-001-01-6	LSM-21824	BRD-K23443580	54648014	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15+,17-,19-/m1/s1	DXACVWBRXAONJE-ZSFPCNDZSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)N4CCOCC4)C[C@H]3c2c1	BroadT	BRD-K23443580	BRD-K23443580-001-01-6	Broad Institute of MIT and Harvard	BRD-K23443580			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCOCC4)O[C@@H]3CO)c2c1	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15+,17-,19-/m1/s1	DXACVWBRXAONJE-ZSFPCNDZSA-N	426.146071882							110375
BRD-K69251974-001-01-2	LSM-21825	BRD-K69251974	54647955	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21-,23+,25+/m0/s1	ZUFBUKYSNNXFMC-FEGXGRLVSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K69251974	BRD-K69251974-001-01-2	Broad Institute of MIT and Harvard	BRD-K69251974			OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21-,23+,25+/m0/s1	ZUFBUKYSNNXFMC-FEGXGRLVSA-N	474.190319972							110376
BRD-K23220352-001-01-4	LSM-21826	BRD-K23220352	54647935	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19+,22-/m0/s1	ZXIOEXCQTCPDNZ-YZYYZOEUSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K23220352	BRD-K23220352-001-01-4	Broad Institute of MIT and Harvard	BRD-K23220352			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19+,22-/m0/s1	ZXIOEXCQTCPDNZ-YZYYZOEUSA-N	402.21547208							110377
BRD-K84116129-001-01-2	LSM-21827	BRD-K84116129	54647896	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21-,23-,25+/m1/s1	PSOSBQVEQWFUAG-YTAKYCMFSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34)[C@@H](CO)O2	BroadT	BRD-K84116129	BRD-K84116129-001-01-2	Broad Institute of MIT and Harvard	BRD-K84116129			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21-,23-,25+/m1/s1	PSOSBQVEQWFUAG-YTAKYCMFSA-N	498.227848332							110378
BRD-K34479074-001-01-0	LSM-21828	BRD-K34479074	54647739	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22-,24-,26+/m0/s1	APWJOJJCKFYHHM-IFPZXYOKSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K34479074	BRD-K34479074-001-01-0	Broad Institute of MIT and Harvard	BRD-K34479074			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32ClN3O5/c28-17-7-5-16(6-8-17)14-29-25(33)13-20-12-22-21-11-19(31-27(34)30-18-3-1-2-4-18)9-10-23(21)36-26(22)24(15-32)35-20/h5-11,18,20,22,24,26,32H,1-4,12-15H2,(H,29,33)(H2,30,31,34)/t20-,22-,24-,26+/m0/s1	APWJOJJCKFYHHM-IFPZXYOKSA-N	513.203048864							110379
BRD-K61524166-001-01-8	LSM-21829	BRD-K61524166	54647914	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21+,23-/m1/s1	OLENBHWSUKSNPF-CTZMOBNVSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)N(C)C)C[C@H]4c3c2	BroadT	BRD-K61524166	BRD-K61524166-001-01-8	Broad Institute of MIT and Harvard	BRD-K61524166			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21+,23-/m1/s1	OLENBHWSUKSNPF-CTZMOBNVSA-N	476.161721946							110380
BRD-K55936117-001-01-2	LSM-21830	BRD-K55936117	54647736	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19-,22+,25+/m0/s1	IYABYMCTXJKIHR-CMJNZLRFSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccccc4OC)C[C@H]3c2c1	BroadT	BRD-K55936117	BRD-K55936117-001-01-2	Broad Institute of MIT and Harvard	BRD-K55936117			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccc4OC)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19-,22+,25+/m0/s1	IYABYMCTXJKIHR-CMJNZLRFSA-N	470.20530132							110381
BRD-K46240433-001-01-8	LSM-21831	BRD-K46240433	54647921	InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18+,20-,22-/m1/s1	VPKMSVVJWJDGNW-HOQQESESSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K46240433	BRD-K46240433-001-01-8	Broad Institute of MIT and Harvard	BRD-K46240433			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18+,20-,22-/m1/s1	VPKMSVVJWJDGNW-HOQQESESSA-N	447.236935806							110382
BRD-K90712953-001-01-1	LSM-21832	BRD-K90712953	54647902	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21-,23+,25+/m0/s1	PSOSBQVEQWFUAG-FEGXGRLVSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34)[C@@H](CO)O2	BroadT	BRD-K90712953	BRD-K90712953-001-01-1	Broad Institute of MIT and Harvard	BRD-K90712953			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21-,23+,25+/m0/s1	PSOSBQVEQWFUAG-FEGXGRLVSA-N	498.227848332							110383
BRD-K27013111-001-01-1	LSM-21833	BRD-K27013111	54647785	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18+,20+,22-/m0/s1	FIBNIYVZMCRVDE-NZIIXAFUSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K27013111	BRD-K27013111-001-01-1	Broad Institute of MIT and Harvard	BRD-K27013111			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18+,20+,22-/m0/s1	FIBNIYVZMCRVDE-NZIIXAFUSA-N	446.151157262							110384
BRD-K00118352-001-01-7	LSM-21834	BRD-K00118352	54647930	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16-,18-/m0/s1	XIBRYEMUGCVBEH-QUCGAITQSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K00118352	BRD-K00118352-001-01-7	Broad Institute of MIT and Harvard	BRD-K00118352			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16-,18-/m0/s1	XIBRYEMUGCVBEH-QUCGAITQSA-N	398.151157262							110385
BRD-K90567672-001-01-9	LSM-21835	BRD-K90567672	54647750	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m0/s1	MRXIFVFTBXIAKP-GPYREICYSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K90567672	BRD-K90567672-001-01-9	Broad Institute of MIT and Harvard	BRD-K90567672			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m0/s1	MRXIFVFTBXIAKP-GPYREICYSA-N	451.210721058							110386
BRD-K13867077-001-01-8	LSM-21836	BRD-K13867077	54647770	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21+,24-/m1/s1	DYFXALJZQJAGQY-OFYLTFBOSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cccnc4)C[C@H]3c2c1	BroadT	BRD-K13867077	BRD-K13867077-001-01-8	Broad Institute of MIT and Harvard	BRD-K13867077			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cccnc4)O[C@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21+,24-/m1/s1	DYFXALJZQJAGQY-OFYLTFBOSA-N	454.2216201							110387
BRD-K02425249-001-01-1	LSM-21837	BRD-K02425249	54647842	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22-,24+,27+/m1/s1	JUGVVXKOEIJUBH-OCYNDFMRSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K02425249	BRD-K02425249-001-01-1	Broad Institute of MIT and Harvard	BRD-K02425249			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22-,24+,27+/m1/s1	JUGVVXKOEIJUBH-OCYNDFMRSA-N	464.231122144							110388
BRD-K83033142-001-01-3	LSM-21838	BRD-K83033142	54647803	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19+,21-,23-/m0/s1	RNEATWJSKJKSLU-FTJYFCJYSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)N(C)C)C[C@@H]4c3c2)cc1	BroadT	BRD-K83033142	BRD-K83033142-001-01-3	Broad Institute of MIT and Harvard	BRD-K83033142			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)N(C)C)O[C@H]4CO)c3c2)cc1	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19+,21-,23-/m0/s1	RNEATWJSKJKSLU-FTJYFCJYSA-N	455.205635678							131258
BRD-K87337065-001-01-7	LSM-21839	BRD-K87337065	54647717	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,23-/m1/s1	DBZIBAKRSCOVBR-MRKDIWJRSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K87337065	BRD-K87337065-001-01-7	Broad Institute of MIT and Harvard	BRD-K87337065			COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](C[C@H]3c2c1)CC(=O)NCc1ccncc1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,23-/m1/s1	DBZIBAKRSCOVBR-MRKDIWJRSA-N	441.189985614							110391
BRD-K96031801-001-01-4	LSM-21840	BRD-K96031801	54647877	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25+,27+/m0/s1	WDVMFXWGGYMVKP-JZEPBHRJSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K96031801	BRD-K96031801-001-01-4	Broad Institute of MIT and Harvard	BRD-K96031801			COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@@H](CO)O2)cc1	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25+,27+/m0/s1	WDVMFXWGGYMVKP-JZEPBHRJSA-N	509.25258587							110392
BRD-K13204150-001-01-4	LSM-21841	BRD-K13204150	54647845	InChI=1S/C23H23F4N3O5/c24-12-1-3-13(4-2-12)29-22(33)30-14-5-6-18-16(7-14)17-8-15(34-19(10-31)21(17)35-18)9-20(32)28-11-23(25,26)27/h1-7,15,17,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t15-,17+,19-,21-/m1/s1	SJYXGOSVXNMHEN-UKHYVGRKSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23	BroadT	BRD-K13204150	BRD-K13204150-001-01-4	Broad Institute of MIT and Harvard	BRD-K13204150			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C23H23F4N3O5/c24-12-1-3-13(4-2-12)29-22(33)30-14-5-6-18-16(7-14)17-8-15(34-19(10-31)21(17)35-18)9-20(32)28-11-23(25,26)27/h1-7,15,17,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t15-,17+,19-,21-/m1/s1	SJYXGOSVXNMHEN-UKHYVGRKSA-N	497.157383666							110393
BRD-K04590890-001-01-2	LSM-21842	BRD-K04590890	54647707	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20-,22-,24+/m0/s1	TUZKBHQBMODFEV-UYLMIGBBSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K04590890	BRD-K04590890-001-01-2	Broad Institute of MIT and Harvard	BRD-K04590890			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20-,22-,24+/m0/s1	TUZKBHQBMODFEV-UYLMIGBBSA-N	451.210721058							110394
BRD-K47378186-001-01-4	LSM-21843	BRD-K47378186	54647798	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19-,21-,23+/m1/s1	RNEATWJSKJKSLU-LHWDRQQYSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)N(C)C)C[C@@H]4c3c2)cc1	BroadT	BRD-K47378186	BRD-K47378186-001-01-4	Broad Institute of MIT and Harvard	BRD-K47378186			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)N(C)C)O[C@@H]4CO)c3c2)cc1	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19-,21-,23+/m1/s1	RNEATWJSKJKSLU-LHWDRQQYSA-N	455.205635678							110395
BRD-K32338268-001-01-6	LSM-21844	BRD-K32338268	54647757	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22+,25-,27-/m0/s1	FUBUSFISZJCQOM-RRNWOQQDSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K32338268	BRD-K32338268-001-01-6	Broad Institute of MIT and Harvard	BRD-K32338268			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22+,25-,27-/m0/s1	FUBUSFISZJCQOM-RRNWOQQDSA-N	562.13854183							110396
BRD-K21780416-001-01-3	LSM-21845	BRD-K21780416	54647872	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25-,27+/m1/s1	WDVMFXWGGYMVKP-UFUIAINPSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K21780416	BRD-K21780416-001-01-3	Broad Institute of MIT and Harvard	BRD-K21780416			COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@@H](CO)O2)cc1	InChI=1S/C28H35N3O6/c1-35-20-9-6-17(7-10-20)15-29-26(33)14-21-13-23-22-12-19(31-28(34)30-18-4-2-3-5-18)8-11-24(22)37-27(23)25(16-32)36-21/h6-12,18,21,23,25,27,32H,2-5,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25-,27+/m1/s1	WDVMFXWGGYMVKP-UFUIAINPSA-N	509.25258587							110397
BRD-K70814002-001-01-0	LSM-21846	BRD-K70814002	54647905	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21-,23-,25+/m0/s1	LRZRSLNOFHOUJI-KRAAZVCLSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K70814002	BRD-K70814002-001-01-0	Broad Institute of MIT and Harvard	BRD-K70814002			OC[C@@H]1O[C@H](CC(=O)NC2CCCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21-,23-,25+/m0/s1	LRZRSLNOFHOUJI-KRAAZVCLSA-N	486.18245739							110398
BRD-K20931916-001-01-8	LSM-21847	BRD-K20931916	54647754	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22-,25-,27+/m0/s1	FUBUSFISZJCQOM-KUVOVLKESA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K20931916	BRD-K20931916-001-01-8	Broad Institute of MIT and Harvard	BRD-K20931916			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22-,25-,27+/m0/s1	FUBUSFISZJCQOM-KUVOVLKESA-N	562.13854183							110399
BRD-K44976583-001-01-7	LSM-21848	BRD-K44976583	54647951	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21+,23+,25-/m0/s1	ZUFBUKYSNNXFMC-VUHNXCBZSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K44976583	BRD-K44976583-001-01-7	Broad Institute of MIT and Harvard	BRD-K44976583			OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21+,23+,25-/m0/s1	ZUFBUKYSNNXFMC-VUHNXCBZSA-N	474.190319972							110400
BRD-K62174937-001-01-9	LSM-21849	BRD-K62174937	54647939	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19+,22+/m0/s1	ZXIOEXCQTCPDNZ-RNCHUUSHSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K62174937	BRD-K62174937-001-01-9	Broad Institute of MIT and Harvard	BRD-K62174937			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19+,22+/m0/s1	ZXIOEXCQTCPDNZ-RNCHUUSHSA-N	402.21547208							110401
BRD-K73771967-001-01-2	LSM-21850	BRD-K73771967	54647897	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21-,23-,25+/m0/s1	PSOSBQVEQWFUAG-YALMDMJRSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34)[C@H](CO)O2	BroadT	BRD-K73771967	BRD-K73771967-001-01-2	Broad Institute of MIT and Harvard	BRD-K73771967			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21-,23-,25+/m0/s1	PSOSBQVEQWFUAG-YALMDMJRSA-N	498.227848332							110402
BRD-K78326475-001-01-5	LSM-21851	BRD-K78326475	54647839	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22+,24-,27-/m1/s1	JUGVVXKOEIJUBH-FPLSKNHZSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K78326475	BRD-K78326475-001-01-5	Broad Institute of MIT and Harvard	BRD-K78326475			C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22+,24-,27-/m1/s1	JUGVVXKOEIJUBH-FPLSKNHZSA-N	464.231122144							110403
BRD-K19305859-001-01-7	LSM-21852	BRD-K19305859	54647766	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23-,25+,28+/m0/s1	HDZKHFXEQLFVHO-GUAPPOABSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K19305859	BRD-K19305859-001-01-7	Broad Institute of MIT and Harvard	BRD-K19305859			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23-,25+,28+/m0/s1	HDZKHFXEQLFVHO-GUAPPOABSA-N	476.231122144							110404
BRD-K00214649-001-01-7	LSM-21853	BRD-K00214649	54647985	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17-,20+,22+/m1/s1	YAXGDUBZOVIXTE-KHNCNGADSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccccc4F)C[C@@H]3c2c1	BroadT	BRD-K00214649	BRD-K00214649-001-01-7	Broad Institute of MIT and Harvard	BRD-K00214649			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17-,20+,22+/m1/s1	YAXGDUBZOVIXTE-KHNCNGADSA-N	464.14173543							110405
BRD-K52933876-001-01-3	LSM-21854	BRD-K52933876	54647774	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21+,24+/m1/s1	DYFXALJZQJAGQY-GOSIJUEPSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cccnc4)C[C@@H]3c2c1	BroadT	BRD-K52933876	BRD-K52933876-001-01-3	Broad Institute of MIT and Harvard	BRD-K52933876			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cccnc4)O[C@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21+,24+/m1/s1	DYFXALJZQJAGQY-GOSIJUEPSA-N	454.2216201							110406
BRD-K54772617-001-01-7	LSM-21855	BRD-K54772617	54648003	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19-,21-,24+/m0/s1	UJBMHCLCDUZLRI-JBIZMDSKSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CC5CC5)cc34)[C@H](CO)O2	BroadT	BRD-K54772617	BRD-K54772617-001-01-7	Broad Institute of MIT and Harvard	BRD-K54772617			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-6-8-27(9-7-26)23(30)13-17-12-19-18-11-16(25-22(29)10-15-2-3-15)4-5-20(18)32-24(19)21(14-28)31-17/h4-5,11,15,17,19,21,24,28H,2-3,6-10,12-14H2,1H3,(H,25,29)/t17-,19-,21-,24+/m0/s1	UJBMHCLCDUZLRI-JBIZMDSKSA-N	443.242021186							110407
BRD-K61574713-001-01-1	LSM-21856	BRD-K61574713	54647871	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18-,20+,22+/m1/s1	LHJCGFYIVQCPBG-MDRHQERFSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	BroadT	BRD-K61574713	BRD-K61574713-001-01-1	Broad Institute of MIT and Harvard	BRD-K61574713			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18-,20+,22+/m1/s1	LHJCGFYIVQCPBG-MDRHQERFSA-N	493.182455562							110408
BRD-K51805846-001-01-1	LSM-21857	BRD-K51805846	54647903	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21-,23+,25+/m1/s1	PSOSBQVEQWFUAG-ASASOQJESA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34)[C@H](CO)O2	BroadT	BRD-K51805846	BRD-K51805846-001-01-1	Broad Institute of MIT and Harvard	BRD-K51805846			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21-,23+,25+/m1/s1	PSOSBQVEQWFUAG-ASASOQJESA-N	498.227848332							110409
BRD-K37672679-001-01-6	LSM-21858	BRD-K37672679	54647711	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20+,22-,24-/m0/s1	TUZKBHQBMODFEV-FVSDWULHSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K37672679	BRD-K37672679-001-01-6	Broad Institute of MIT and Harvard	BRD-K37672679			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20+,22-,24-/m0/s1	TUZKBHQBMODFEV-FVSDWULHSA-N	451.210721058							110410
BRD-K83842680-001-01-5	LSM-21859	BRD-K83842680	54647755	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22+,25+,27-/m0/s1	FUBUSFISZJCQOM-OLKBXHEUSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K83842680	BRD-K83842680-001-01-5	Broad Institute of MIT and Harvard	BRD-K83842680			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22+,25+,27-/m0/s1	FUBUSFISZJCQOM-OLKBXHEUSA-N	562.13854183							110411
BRD-K14484802-001-01-3	LSM-21860	BRD-K14484802	54647818	InChI=1S/C19H28N2O4/c1-4-7-20-18(23)10-13-9-15-14-8-12(21(2)3)5-6-16(14)25-19(15)17(11-22)24-13/h5-6,8,13,15,17,19,22H,4,7,9-11H2,1-3H3,(H,20,23)/t13-,15-,17+,19+/m1/s1	OCZIBHZIBGZVHV-OVLVRJBISA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1	BroadT	BRD-K14484802	BRD-K14484802-001-01-3	Broad Institute of MIT and Harvard	BRD-K14484802			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1	InChI=1S/C19H28N2O4/c1-4-7-20-18(23)10-13-9-15-14-8-12(21(2)3)5-6-16(14)25-19(15)17(11-22)24-13/h5-6,8,13,15,17,19,22H,4,7,9-11H2,1-3H3,(H,20,23)/t13-,15-,17+,19+/m1/s1	OCZIBHZIBGZVHV-OVLVRJBISA-N	348.204907396							110412
BRD-K46262019-001-01-4	LSM-21861	BRD-K46262019	54647815	InChI=1S/C19H28N2O4/c1-4-7-20-18(23)10-13-9-15-14-8-12(21(2)3)5-6-16(14)25-19(15)17(11-22)24-13/h5-6,8,13,15,17,19,22H,4,7,9-11H2,1-3H3,(H,20,23)/t13-,15-,17-,19+/m1/s1	OCZIBHZIBGZVHV-VWMOJTHMSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	BroadT	BRD-K46262019	BRD-K46262019-001-01-4	Broad Institute of MIT and Harvard	BRD-K46262019			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	InChI=1S/C19H28N2O4/c1-4-7-20-18(23)10-13-9-15-14-8-12(21(2)3)5-6-16(14)25-19(15)17(11-22)24-13/h5-6,8,13,15,17,19,22H,4,7,9-11H2,1-3H3,(H,20,23)/t13-,15-,17-,19+/m1/s1	OCZIBHZIBGZVHV-VWMOJTHMSA-N	348.204907396							110413
BRD-K25924017-001-01-6	LSM-21862	BRD-K25924017	54647703	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15+,19+,21-/m1/s1	YVFPRJXGACQPOR-UZSHKEKKSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	BroadT	BRD-K25924017	BRD-K25924017-001-01-6	Broad Institute of MIT and Harvard	BRD-K25924017			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15+,19+,21-/m1/s1	YVFPRJXGACQPOR-UZSHKEKKSA-N	430.154014676							110414
BRD-K16127703-001-01-6	LSM-21863	BRD-K16127703	54647805	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19-,21+,23+/m1/s1	RNEATWJSKJKSLU-YZBYQZESSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)N(C)C)C[C@@H]4c3c2)cc1	BroadT	BRD-K16127703	BRD-K16127703-001-01-6	Broad Institute of MIT and Harvard	BRD-K16127703			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)N(C)C)O[C@H]4CO)c3c2)cc1	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19-,21+,23+/m1/s1	RNEATWJSKJKSLU-YZBYQZESSA-N	455.205635678							110415
BRD-K25976490-001-01-2	LSM-21864	BRD-K25976490	54647979	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17-,20-,22+/m0/s1	YAXGDUBZOVIXTE-HSSHKJKNSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccc4F)C[C@H]3c2c1	BroadT	BRD-K25976490	BRD-K25976490-001-01-2	Broad Institute of MIT and Harvard	BRD-K25976490			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17-,20-,22+/m0/s1	YAXGDUBZOVIXTE-HSSHKJKNSA-N	464.14173543							110416
BRD-K66390968-001-01-9	LSM-21865	BRD-K66390968	54647942	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20-,22-,24+/m0/s1	YUJPPMQDMPRDFH-LGCHTUQSSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@H](CO)O1	BroadT	BRD-K66390968	BRD-K66390968-001-01-9	Broad Institute of MIT and Harvard	BRD-K66390968			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@H](CO)O1	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20-,22-,24+/m0/s1	YUJPPMQDMPRDFH-LGCHTUQSSA-N	490.17737201							110417
BRD-K67316599-001-01-0	LSM-21866	BRD-K67316599	54647943	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20+,22+,24-/m0/s1	YUJPPMQDMPRDFH-ZUAOHOGDSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@@H](CO)O1	BroadT	BRD-K67316599	BRD-K67316599-001-01-0	Broad Institute of MIT and Harvard	BRD-K67316599			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@@H](CO)O1	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20+,22+,24-/m0/s1	YUJPPMQDMPRDFH-ZUAOHOGDSA-N	490.17737201							110418
BRD-K14518681-001-01-4	LSM-21867	BRD-K14518681	54647915	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21-,23-/m1/s1	OLENBHWSUKSNPF-LQOJQYNMSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)N(C)C)C[C@H]4c3c2	BroadT	BRD-K14518681	BRD-K14518681-001-01-4	Broad Institute of MIT and Harvard	BRD-K14518681			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21-,23-/m1/s1	OLENBHWSUKSNPF-LQOJQYNMSA-N	476.161721946							110419
BRD-K18143222-001-01-3	LSM-21868	BRD-K18143222	54647746	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,25+/m0/s1	MRXIFVFTBXIAKP-XZFMWLAQSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K18143222	BRD-K18143222-001-01-3	Broad Institute of MIT and Harvard	BRD-K18143222			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,25+/m0/s1	MRXIFVFTBXIAKP-XZFMWLAQSA-N	451.210721058							110420
BRD-K04509289-001-01-1	LSM-21869	BRD-K04509289	54647832	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22+,24+,27-/m0/s1	JUGVVXKOEIJUBH-PGIPIIDYSA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K04509289	BRD-K04509289-001-01-1	Broad Institute of MIT and Harvard	BRD-K04509289			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22+,24+,27-/m0/s1	JUGVVXKOEIJUBH-PGIPIIDYSA-N	464.231122144							110421
BRD-K27099493-001-01-8	LSM-21870	BRD-K27099493	54647869	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18+,20-,22-/m0/s1	LHJCGFYIVQCPBG-UPSSIMKTSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	BroadT	BRD-K27099493	BRD-K27099493-001-01-8	Broad Institute of MIT and Harvard	BRD-K27099493			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18+,20-,22-/m0/s1	LHJCGFYIVQCPBG-UPSSIMKTSA-N	493.182455562							110422
BRD-K28351301-001-01-4	LSM-21871	BRD-K28351301	54647983	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17+,20-,22-/m0/s1	YAXGDUBZOVIXTE-XFSCSUFISA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccc4F)C[C@@H]3c2c1	BroadT	BRD-K28351301	BRD-K28351301-001-01-4	Broad Institute of MIT and Harvard	BRD-K28351301			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17+,20-,22-/m0/s1	YAXGDUBZOVIXTE-XFSCSUFISA-N	464.14173543							131259
BRD-K80733101-001-01-0	LSM-21872	BRD-K80733101	54647771	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21-,24-/m1/s1	DYFXALJZQJAGQY-RMIRKMSDSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4cccnc4)C[C@H]3c2c1	BroadT	BRD-K80733101	BRD-K80733101-001-01-0	Broad Institute of MIT and Harvard	BRD-K80733101			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cccnc4)O[C@@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21-,24-/m1/s1	DYFXALJZQJAGQY-RMIRKMSDSA-N	454.2216201							110425
BRD-K97676527-001-01-8	LSM-21873	BRD-K97676527	54647848	InChI=1S/C24H30N2O5/c1-26(2)16-6-9-21-19(10-16)20-11-18(30-22(14-27)24(20)31-21)12-23(28)25-13-15-4-7-17(29-3)8-5-15/h4-10,18,20,22,24,27H,11-14H2,1-3H3,(H,25,28)/t18-,20-,22+,24+/m0/s1	FHQWFYFYGUWLTN-YCYVKTGYSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(cc34)N(C)C)[C@@H](CO)O2)cc1	BroadT	BRD-K97676527	BRD-K97676527-001-01-8	Broad Institute of MIT and Harvard	BRD-K97676527			COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(cc34)N(C)C)[C@@H](CO)O2)cc1	InChI=1S/C24H30N2O5/c1-26(2)16-6-9-21-19(10-16)20-11-18(30-22(14-27)24(20)31-21)12-23(28)25-13-15-4-7-17(29-3)8-5-15/h4-10,18,20,22,24,27H,11-14H2,1-3H3,(H,25,28)/t18-,20-,22+,24+/m0/s1	FHQWFYFYGUWLTN-YCYVKTGYSA-N	426.21547208							110426
BRD-K84815309-001-01-1	LSM-21874	BRD-K84815309	54647870	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18-,20+,22+/m0/s1	LHJCGFYIVQCPBG-FDGCKHTNSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	BroadT	BRD-K84815309	BRD-K84815309-001-01-1	Broad Institute of MIT and Harvard	BRD-K84815309			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18-,20+,22+/m0/s1	LHJCGFYIVQCPBG-FDGCKHTNSA-N	493.182455562							110427
BRD-K00250978-001-01-2	LSM-21875	BRD-K00250978	54647758	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22-,25+,27+/m0/s1	FUBUSFISZJCQOM-ZKOLXVITSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K00250978	BRD-K00250978-001-01-2	Broad Institute of MIT and Harvard	BRD-K00250978			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22-,25+,27+/m0/s1	FUBUSFISZJCQOM-ZKOLXVITSA-N	562.13854183							110428
BRD-K72588548-001-01-9	LSM-21876	BRD-K72588548	54647819	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21-,23-,26+/m1/s1	HQMAMEQBJJAPDJ-INZVZTLUSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)N4CCc5ccccc5C4)C[C@@H]3c2c1	BroadT	BRD-K72588548	BRD-K72588548-001-01-9	Broad Institute of MIT and Harvard	BRD-K72588548			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N4CCc5ccccc5C4)O[C@@H]3CO)c2c1	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21-,23-,26+/m1/s1	HQMAMEQBJJAPDJ-INZVZTLUSA-N	466.2103867							110429
BRD-K33743088-001-01-4	LSM-21877	BRD-K33743088	54647859	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16-,18+,21+/m1/s1	IMUPCUMLIPIWQW-GXLIZGDTSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K33743088	BRD-K33743088-001-01-4	Broad Institute of MIT and Harvard	BRD-K33743088			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16-,18+,21+/m1/s1	IMUPCUMLIPIWQW-GXLIZGDTSA-N	404.194736636							110430
BRD-K47829813-001-01-7	LSM-21878	BRD-K47829813	54647782	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22-,26+,28+/m1/s1	OEYUNRREIFVABF-OEZGUAFWSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K47829813	BRD-K47829813-001-01-7	Broad Institute of MIT and Harvard	BRD-K47829813			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22-,26+,28+/m1/s1	OEYUNRREIFVABF-OEZGUAFWSA-N	519.21694929							110431
BRD-K51241950-001-01-1	LSM-21879	BRD-K51241950	54647840	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22-,24+,27+/m0/s1	JUGVVXKOEIJUBH-AHVPVEJESA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K51241950	BRD-K51241950-001-01-1	Broad Institute of MIT and Harvard	BRD-K51241950			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22-,24+,27+/m0/s1	JUGVVXKOEIJUBH-AHVPVEJESA-N	464.231122144							110432
BRD-K83635807-001-01-1	LSM-21880	BRD-K83635807	54647906	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21+,23+,25-/m0/s1	LRZRSLNOFHOUJI-PFJUQGFLSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K83635807	BRD-K83635807-001-01-1	Broad Institute of MIT and Harvard	BRD-K83635807			OC[C@H]1O[C@H](CC(=O)NC2CCCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21+,23+,25-/m0/s1	LRZRSLNOFHOUJI-PFJUQGFLSA-N	486.18245739							110433
BRD-K61523438-001-01-2	LSM-21881	BRD-K61523438	54647989	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19+,21+,23-/m1/s1	QYXXDFPSNSEWLS-QXPQREGVSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K61523438	BRD-K61523438-001-01-2	Broad Institute of MIT and Harvard	BRD-K61523438			COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(C)(=O)=O)cc34)[C@H](CO)O2)cc1	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19+,21+,23-/m1/s1	QYXXDFPSNSEWLS-QXPQREGVSA-N	476.161721946							110434
BRD-K51653401-001-01-2	LSM-21882	BRD-K51653401	54647726	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23-,26-/m1/s1	XOEUNFVLCGVFNC-YDOBTQPPSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K51653401	BRD-K51653401-001-01-2	Broad Institute of MIT and Harvard	BRD-K51653401			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23-,26-/m1/s1	XOEUNFVLCGVFNC-YDOBTQPPSA-N	468.206050248							110435
BRD-K54241204-001-01-2	LSM-21883	BRD-K54241204	54647984	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17-,20+,22+/m0/s1	YAXGDUBZOVIXTE-RRZHCZHMSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccccc4F)C[C@H]3c2c1	BroadT	BRD-K54241204	BRD-K54241204-001-01-2	Broad Institute of MIT and Harvard	BRD-K54241204			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17-,20+,22+/m0/s1	YAXGDUBZOVIXTE-RRZHCZHMSA-N	464.14173543							110436
BRD-K62642733-001-01-1	LSM-21884	BRD-K62642733	54647894	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20-,23+,26+/m0/s1	RQLOITHXBXVBKT-DOYXTRFRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K62642733	BRD-K62642733-001-01-1	Broad Institute of MIT and Harvard	BRD-K62642733			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20-,23+,26+/m0/s1	RQLOITHXBXVBKT-DOYXTRFRSA-N	468.206050248							110437
BRD-K09434085-001-01-3	LSM-21885	BRD-K09434085	54647934	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19-,22+/m0/s1	ZXIOEXCQTCPDNZ-MNNBHYOVSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K09434085	BRD-K09434085-001-01-3	Broad Institute of MIT and Harvard	BRD-K09434085			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C22H30N2O5/c1-2-7-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-3-4-13)5-6-18(16)29-22(17)19(12-25)28-15/h5-6,9,13,15,17,19,22,25H,2-4,7-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19-,22+/m0/s1	ZXIOEXCQTCPDNZ-MNNBHYOVSA-N	402.21547208							110438
BRD-K01042616-001-01-0	LSM-21886	BRD-K01042616	54647960	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22+,24-,26-/m0/s1	PIVZJJFMUFHLSR-SFUHPXFESA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K01042616	BRD-K01042616-001-01-0	Broad Institute of MIT and Harvard	BRD-K01042616			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22+,24-,26-/m0/s1	PIVZJJFMUFHLSR-SFUHPXFESA-N	527.152634472							110439
BRD-K57653580-001-01-9	LSM-21887	BRD-K57653580	54647762	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23+,25+,28-/m0/s1	HDZKHFXEQLFVHO-BOYVHMQCSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K57653580	BRD-K57653580-001-01-9	Broad Institute of MIT and Harvard	BRD-K57653580			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23+,25+,28-/m0/s1	HDZKHFXEQLFVHO-BOYVHMQCSA-N	476.231122144							110440
BRD-K73485719-001-01-0	LSM-21888	BRD-K73485719	54647753	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22-,25-,27+/m1/s1	FUBUSFISZJCQOM-FQSWERQXSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K73485719	BRD-K73485719-001-01-0	Broad Institute of MIT and Harvard	BRD-K73485719			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22-,25-,27+/m1/s1	FUBUSFISZJCQOM-FQSWERQXSA-N	562.13854183							110441
BRD-K52190202-001-01-5	LSM-21889	BRD-K52190202	54647891	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20+,23+,26-/m0/s1	RQLOITHXBXVBKT-YESOXSADSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K52190202	BRD-K52190202-001-01-5	Broad Institute of MIT and Harvard	BRD-K52190202			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20+,23+,26-/m0/s1	RQLOITHXBXVBKT-YESOXSADSA-N	468.206050248							110442
BRD-K80474402-001-01-7	LSM-21890	BRD-K80474402	54647975	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22-,25-/m0/s1	JQYAUOPJHODSNH-GPYREICYSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(Cl)cc4)C[C@@H]3c2c1	BroadT	BRD-K80474402	BRD-K80474402-001-01-7	Broad Institute of MIT and Harvard	BRD-K80474402			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22-,25-/m0/s1	JQYAUOPJHODSNH-GPYREICYSA-N	487.1873988							110443
BRD-K36465106-001-01-9	LSM-21891	BRD-K36465106	54647912	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21-,23+/m0/s1	OLENBHWSUKSNPF-RAQQXGOJSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)N(C)C)C[C@H]4c3c2	BroadT	BRD-K36465106	BRD-K36465106-001-01-9	Broad Institute of MIT and Harvard	BRD-K36465106			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21-,23+/m0/s1	OLENBHWSUKSNPF-RAQQXGOJSA-N	476.161721946							110444
BRD-K29282144-001-01-1	LSM-21892	BRD-K29282144	54647908	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21+,23-,25-/m1/s1	LRZRSLNOFHOUJI-NGCSHXQWSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K29282144	BRD-K29282144-001-01-1	Broad Institute of MIT and Harvard	BRD-K29282144			OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C25H30N2O6S/c28-15-23-25-21(13-18(32-23)14-24(29)26-16-6-4-5-7-16)20-12-17(10-11-22(20)33-25)27-34(30,31)19-8-2-1-3-9-19/h1-3,8-12,16,18,21,23,25,27-28H,4-7,13-15H2,(H,26,29)/t18-,21+,23-,25-/m1/s1	LRZRSLNOFHOUJI-NGCSHXQWSA-N	486.18245739							110445
BRD-K59655055-001-01-8	LSM-21893	BRD-K59655055	54647820	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21-,23-,26+/m0/s1	HQMAMEQBJJAPDJ-MDJJAXGLSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)N4CCc5ccccc5C4)C[C@H]3c2c1	BroadT	BRD-K59655055	BRD-K59655055-001-01-8	Broad Institute of MIT and Harvard	BRD-K59655055			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21-,23-,26+/m0/s1	HQMAMEQBJJAPDJ-MDJJAXGLSA-N	466.2103867							110446
BRD-K27480812-001-01-4	LSM-21894	BRD-K27480812	54647792	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17-,19-,21+/m0/s1	IEHAYHWJNYCLRG-HIUUTZCYSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)O)C[C@H]4c3c2	BroadT	BRD-K27480812	BRD-K27480812-001-01-4	Broad Institute of MIT and Harvard	BRD-K27480812			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(O)=O)O[C@H]3CO)c2c1	InChI=1S/C21H23NO8S/c1-28-13-3-5-15(6-4-13)31(26,27)22-12-2-7-18-16(8-12)17-9-14(10-20(24)25)29-19(11-23)21(17)30-18/h2-8,14,17,19,21-23H,9-11H2,1H3,(H,24,25)/t14-,17-,19-,21+/m0/s1	IEHAYHWJNYCLRG-HIUUTZCYSA-N	449.114437396							110447
BRD-K60322656-001-01-5	LSM-21895	BRD-K60322656	54647826	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21-,23+,26+/m1/s1	HQMAMEQBJJAPDJ-BCHMZHATSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)N4CCc5ccccc5C4)C[C@@H]3c2c1	BroadT	BRD-K60322656	BRD-K60322656-001-01-5	Broad Institute of MIT and Harvard	BRD-K60322656			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21-,23+,26+/m1/s1	HQMAMEQBJJAPDJ-BCHMZHATSA-N	466.2103867							110448
BRD-K45322361-001-01-1	LSM-21896	BRD-K45322361	54647827	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22+,24+,27-/m0/s1	JUGVVXKOEIJUBH-NPVISYSTSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K45322361	BRD-K45322361-001-01-1	Broad Institute of MIT and Harvard	BRD-K45322361			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20+,22+,24+,27-/m0/s1	JUGVVXKOEIJUBH-NPVISYSTSA-N	464.231122144							110449
BRD-K33948274-001-01-3	LSM-21897	BRD-K33948274	54647714	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,23+/m1/s1	DBZIBAKRSCOVBR-WVVHNUNQSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K33948274	BRD-K33948274-001-01-3	Broad Institute of MIT and Harvard	BRD-K33948274			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](C[C@@H]3c2c1)CC(=O)NCc1ccncc1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,23+/m1/s1	DBZIBAKRSCOVBR-WVVHNUNQSA-N	441.189985614							110450
BRD-K36125999-001-01-9	LSM-21898	BRD-K36125999	54647719	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,23-/m0/s1	DBZIBAKRSCOVBR-IRLNJFMJSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K36125999	BRD-K36125999-001-01-9	Broad Institute of MIT and Harvard	BRD-K36125999			COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](C[C@@H]3c2c1)CC(=O)NCc1ccncc1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-2-3-19-17(8-15)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-14-4-6-24-7-5-14/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,23-/m0/s1	DBZIBAKRSCOVBR-IRLNJFMJSA-N	441.189985614							110451
BRD-K59790546-001-01-0	LSM-21899	BRD-K59790546	54647899	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21+,23+,25-/m1/s1	PSOSBQVEQWFUAG-IQKBUIRBSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34)[C@H](CO)O2	BroadT	BRD-K59790546	BRD-K59790546-001-01-0	Broad Institute of MIT and Harvard	BRD-K59790546			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21+,23+,25-/m1/s1	PSOSBQVEQWFUAG-IQKBUIRBSA-N	498.227848332							110452
BRD-K84045271-001-01-9	LSM-21900	BRD-K84045271	54647900	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21+,23-,25-/m1/s1	PSOSBQVEQWFUAG-RIPRBREISA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34)[C@@H](CO)O2	BroadT	BRD-K84045271	BRD-K84045271-001-01-9	Broad Institute of MIT and Harvard	BRD-K84045271			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C26H31FN4O5/c1-30-8-10-31(11-9-30)24(33)14-19-13-21-20-12-18(6-7-22(20)36-25(21)23(15-32)35-19)29-26(34)28-17-4-2-16(27)3-5-17/h2-7,12,19,21,23,25,32H,8-11,13-15H2,1H3,(H2,28,29,34)/t19-,21+,23-,25-/m1/s1	PSOSBQVEQWFUAG-RIPRBREISA-N	498.227848332							110453
BRD-K39293420-001-01-1	LSM-21901	BRD-K39293420	54647747	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m0/s1	MRXIFVFTBXIAKP-PMTIONAUSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K39293420	BRD-K39293420-001-01-1	Broad Institute of MIT and Harvard	BRD-K39293420			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m0/s1	MRXIFVFTBXIAKP-PMTIONAUSA-N	451.210721058							110454
BRD-K60930088-001-01-3	LSM-21902	BRD-K60930088	54647786	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18+,20+,22-/m1/s1	FIBNIYVZMCRVDE-LAKFJOCUSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	BroadT	BRD-K60930088	BRD-K60930088-001-01-3	Broad Institute of MIT and Harvard	BRD-K60930088			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18+,20+,22-/m1/s1	FIBNIYVZMCRVDE-LAKFJOCUSA-N	446.151157262							110455
BRD-K96563510-001-01-8	LSM-21903	BRD-K96563510	54647917	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21+,23+/m0/s1	OLENBHWSUKSNPF-PZMSFCMUSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)N(C)C)C[C@H]4c3c2	BroadT	BRD-K96563510	BRD-K96563510-001-01-8	Broad Institute of MIT and Harvard	BRD-K96563510			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21+,23+/m0/s1	OLENBHWSUKSNPF-PZMSFCMUSA-N	476.161721946							110456
BRD-K18709561-001-01-0	LSM-21904	BRD-K18709561	54647932	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16+,18+/m1/s1	XIBRYEMUGCVBEH-CAGXHZNZSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K18709561	BRD-K18709561-001-01-0	Broad Institute of MIT and Harvard	BRD-K18709561			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16+,18+/m1/s1	XIBRYEMUGCVBEH-CAGXHZNZSA-N	398.151157262							110457
BRD-K42671816-001-01-5	LSM-21905	BRD-K42671816	54647767	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21-,24+/m1/s1	DYFXALJZQJAGQY-ISYUWZRGSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4cccnc4)C[C@@H]3c2c1	BroadT	BRD-K42671816	BRD-K42671816-001-01-5	Broad Institute of MIT and Harvard	BRD-K42671816			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cccnc4)O[C@@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21-,24+/m1/s1	DYFXALJZQJAGQY-ISYUWZRGSA-N	454.2216201							110458
BRD-K31091950-001-01-5	LSM-21906	BRD-K31091950	54647825	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21-,23+,26+/m0/s1	HQMAMEQBJJAPDJ-UAHYIAQRSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)N4CCc5ccccc5C4)C[C@H]3c2c1	BroadT	BRD-K31091950	BRD-K31091950-001-01-5	Broad Institute of MIT and Harvard	BRD-K31091950			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCc5ccccc5C4)O[C@@H]3CO)c2c1	InChI=1S/C26H30N2O6/c1-32-15-24(30)27-18-6-7-22-20(10-18)21-11-19(33-23(14-29)26(21)34-22)12-25(31)28-9-8-16-4-2-3-5-17(16)13-28/h2-7,10,19,21,23,26,29H,8-9,11-15H2,1H3,(H,27,30)/t19-,21-,23+,26+/m0/s1	HQMAMEQBJJAPDJ-UAHYIAQRSA-N	466.2103867							110459
BRD-K43629349-001-01-8	LSM-21907	BRD-K43629349	54647804	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19-,21+,23+/m0/s1	RNEATWJSKJKSLU-VARILPKDSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)N(C)C)C[C@H]4c3c2)cc1	BroadT	BRD-K43629349	BRD-K43629349-001-01-8	Broad Institute of MIT and Harvard	BRD-K43629349			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)N(C)C)O[C@@H]4CO)c3c2)cc1	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19-,21+,23+/m0/s1	RNEATWJSKJKSLU-VARILPKDSA-N	455.205635678							110460
BRD-K27098560-001-01-8	LSM-21908	BRD-K27098560	54647967	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16+,18-,20-/m0/s1	MPRUPAINZQILBH-HUOQQOJOSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23	BroadT	BRD-K27098560	BRD-K27098560-001-01-8	Broad Institute of MIT and Harvard	BRD-K27098560			OC[C@@H]1O[C@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16+,18-,20-/m0/s1	MPRUPAINZQILBH-HUOQQOJOSA-N	416.138364612							110461
BRD-K93975480-001-01-3	LSM-21909	BRD-K93975480	54647788	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18+,20-,22-/m0/s1	FIBNIYVZMCRVDE-OPMXSGTGSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	BroadT	BRD-K93975480	BRD-K93975480-001-01-3	Broad Institute of MIT and Harvard	BRD-K93975480			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18+,20-,22-/m0/s1	FIBNIYVZMCRVDE-OPMXSGTGSA-N	446.151157262							110462
BRD-K29322424-001-01-6	LSM-21910	BRD-K29322424	54647775	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22-,26-,28+/m1/s1	OEYUNRREIFVABF-DFQMGKBUSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K29322424	BRD-K29322424-001-01-6	Broad Institute of MIT and Harvard	BRD-K29322424			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22-,26-,28+/m1/s1	OEYUNRREIFVABF-DFQMGKBUSA-N	519.21694929							110463
BRD-K32671998-001-01-7	LSM-21911	BRD-K32671998	54647931	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16+,18+/m0/s1	XIBRYEMUGCVBEH-BMGTVUPLSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K32671998	BRD-K32671998-001-01-7	Broad Institute of MIT and Harvard	BRD-K32671998			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16+,18+/m0/s1	XIBRYEMUGCVBEH-BMGTVUPLSA-N	398.151157262							110464
BRD-K54376194-001-01-8	LSM-21912	BRD-K54376194	54647706	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15-,19+,21+/m1/s1	YVFPRJXGACQPOR-WAXPWZKESA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	BroadT	BRD-K54376194	BRD-K54376194-001-01-8	Broad Institute of MIT and Harvard	BRD-K54376194			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15-,19+,21+/m1/s1	YVFPRJXGACQPOR-WAXPWZKESA-N	430.154014676							110465
BRD-K24104429-001-01-8	LSM-21913	BRD-K24104429	54647835	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22+,24-,27-/m1/s1	JUGVVXKOEIJUBH-OEWSYVFNSA-N	C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K24104429	BRD-K24104429-001-01-8	Broad Institute of MIT and Harvard	BRD-K24104429			C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C27H32N2O5/c1-16(18-5-3-2-4-6-18)28-26(32)14-20-13-22-21-12-19(29-25(31)11-17-7-8-17)9-10-23(21)34-27(22)24(15-30)33-20/h2-6,9-10,12,16-17,20,22,24,27,30H,7-8,11,13-15H2,1H3,(H,28,32)(H,29,31)/t16-,20-,22+,24-,27-/m1/s1	JUGVVXKOEIJUBH-OEWSYVFNSA-N	464.231122144							110466
BRD-K86066946-001-01-8	LSM-21914	BRD-K86066946	54647850	InChI=1S/C23H27FN2O4/c1-26(2)15-7-8-20-17(9-15)18-10-16(29-21(13-27)23(18)30-20)11-22(28)25-12-14-5-3-4-6-19(14)24/h3-9,16,18,21,23,27H,10-13H2,1-2H3,(H,25,28)/t16-,18-,21-,23+/m1/s1	XQYKWCFSNBOVNA-LBJGLMTLSA-N	CN(C)c1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccccc4F)C[C@@H]3c2c1	BroadT	BRD-K86066946	BRD-K86066946-001-01-8	Broad Institute of MIT and Harvard	BRD-K86066946			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C23H27FN2O4/c1-26(2)15-7-8-20-17(9-15)18-10-16(29-21(13-27)23(18)30-20)11-22(28)25-12-14-5-3-4-6-19(14)24/h3-9,16,18,21,23,27H,10-13H2,1-2H3,(H,25,28)/t16-,18-,21-,23+/m1/s1	XQYKWCFSNBOVNA-LBJGLMTLSA-N	414.195485564							110467
BRD-K57662232-001-01-2	LSM-21915	BRD-K57662232	54647812	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15+,17-,20-/m1/s1	QAHMIWPLJULOCY-YBLQJDFOSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)N(C)C)C[C@H]3c2c1	BroadT	BRD-K57662232	BRD-K57662232-001-01-2	Broad Institute of MIT and Harvard	BRD-K57662232			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15+,17-,20-/m1/s1	QAHMIWPLJULOCY-YBLQJDFOSA-N	391.210721058							110468
BRD-K43499287-001-01-0	LSM-21916	BRD-K43499287	54647927	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16+,18-/m0/s1	XIBRYEMUGCVBEH-VYOUMLOHSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K43499287	BRD-K43499287-001-01-0	Broad Institute of MIT and Harvard	BRD-K43499287			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16+,18-/m0/s1	XIBRYEMUGCVBEH-VYOUMLOHSA-N	398.151157262							110469
BRD-K69233724-001-01-3	LSM-21917	BRD-K69233724	54647847	InChI=1S/C24H30N2O5/c1-26(2)16-6-9-21-19(10-16)20-11-18(30-22(14-27)24(20)31-21)12-23(28)25-13-15-4-7-17(29-3)8-5-15/h4-10,18,20,22,24,27H,11-14H2,1-3H3,(H,25,28)/t18-,20+,22+,24-/m1/s1	FHQWFYFYGUWLTN-HJBWUJCXSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(cc34)N(C)C)[C@H](CO)O2)cc1	BroadT	BRD-K69233724	BRD-K69233724-001-01-3	Broad Institute of MIT and Harvard	BRD-K69233724			COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(cc34)N(C)C)[C@H](CO)O2)cc1	InChI=1S/C24H30N2O5/c1-26(2)16-6-9-21-19(10-16)20-11-18(30-22(14-27)24(20)31-21)12-23(28)25-13-15-4-7-17(29-3)8-5-15/h4-10,18,20,22,24,27H,11-14H2,1-3H3,(H,25,28)/t18-,20+,22+,24-/m1/s1	FHQWFYFYGUWLTN-HJBWUJCXSA-N	426.21547208							110470
BRD-K40690989	LSM-15138		54647773	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21+,24+/m0/s1	DYFXALJZQJAGQY-NOOBJOLFSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cccnc4)C[C@H]3c2c1	BroadT	BRD-K40690989	BRD-K40690989-001-01-8	Broad Institute of MIT and Harvard	BRD-K40690989			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cccnc4)O[C@@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21+,24+/m0/s1	DYFXALJZQJAGQY-NOOBJOLFSA-N	454.2216201							103794
BRD-K72422530-001-01-1	LSM-21918	BRD-K72422530	54647783	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18-,20-,22+/m1/s1	FIBNIYVZMCRVDE-HBPKQZLHSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K72422530	BRD-K72422530-001-01-1	Broad Institute of MIT and Harvard	BRD-K72422530			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C22H26N2O6S/c1-24(2)21(26)12-15-11-18-17-10-14(23-31(27,28)16-6-4-3-5-7-16)8-9-19(17)30-22(18)20(13-25)29-15/h3-10,15,18,20,22-23,25H,11-13H2,1-2H3/t15-,18-,20-,22+/m1/s1	FIBNIYVZMCRVDE-HBPKQZLHSA-N	446.151157262							110471
BRD-K52116417-001-01-1	LSM-21919	BRD-K52116417	54647925	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16-,18+/m1/s1	XIBRYEMUGCVBEH-BQUDOFGOSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K52116417	BRD-K52116417-001-01-1	Broad Institute of MIT and Harvard	BRD-K52116417			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C18H26N2O6S/c1-3-6-19-17(22)9-12-8-14-13-7-11(20-27(2,23)24)4-5-15(13)26-18(14)16(10-21)25-12/h4-5,7,12,14,16,18,20-21H,3,6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16-,18+/m1/s1	XIBRYEMUGCVBEH-BQUDOFGOSA-N	398.151157262							110472
BRD-K81776771-001-01-7	LSM-21920	BRD-K81776771	54647920	InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18-,20-,22+/m0/s1	VPKMSVVJWJDGNW-JXYHXMIBSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K81776771	BRD-K81776771-001-01-7	Broad Institute of MIT and Harvard	BRD-K81776771			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18-,20-,22+/m0/s1	VPKMSVVJWJDGNW-JXYHXMIBSA-N	447.236935806							110473
BRD-K04623830-001-01-4	LSM-21921	BRD-K04623830	54647978	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17-,20-,22+/m1/s1	YAXGDUBZOVIXTE-HHRWBCNNSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccccc4F)C[C@@H]3c2c1	BroadT	BRD-K04623830	BRD-K04623830-001-01-4	Broad Institute of MIT and Harvard	BRD-K04623830			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C22H25FN2O6S/c1-32(28,29)25-14-6-7-19-16(8-14)17-9-15(30-20(12-26)22(17)31-19)10-21(27)24-11-13-4-2-3-5-18(13)23/h2-8,15,17,20,22,25-26H,9-12H2,1H3,(H,24,27)/t15-,17-,20-,22+/m1/s1	YAXGDUBZOVIXTE-HHRWBCNNSA-N	464.14173543							110474
BRD-K69200868-001-01-8	LSM-21922	BRD-K69200868	54647865	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18-,20-,22+/m0/s1	LHJCGFYIVQCPBG-JXYHXMIBSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	BroadT	BRD-K69200868	BRD-K69200868-001-01-8	Broad Institute of MIT and Harvard	BRD-K69200868			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18-,20-,22+/m0/s1	LHJCGFYIVQCPBG-JXYHXMIBSA-N	493.182455562							110475
BRD-K99783537-001-01-8	LSM-21923	BRD-K99783537	54647887	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17-,21+,23+/m0/s1	OYAAAFLFGWLAPV-SSTRHAATSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	BroadT	BRD-K99783537	BRD-K99783537-001-01-8	Broad Institute of MIT and Harvard	BRD-K99783537			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17-,21+,23+/m0/s1	OYAAAFLFGWLAPV-SSTRHAATSA-N	454.174001192							110476
BRD-K76739593-001-01-8	LSM-21924	BRD-K76739593	54647810	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15+,17+,20-/m0/s1	QAHMIWPLJULOCY-XEQBAVFLSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)N(C)C)C[C@@H]3c2c1	BroadT	BRD-K76739593	BRD-K76739593-001-01-8	Broad Institute of MIT and Harvard	BRD-K76739593			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15+,17+,20-/m0/s1	QAHMIWPLJULOCY-XEQBAVFLSA-N	391.210721058							110477
BRD-K05844439-001-01-0	LSM-21925	BRD-K05844439	54647988	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19+,21+,23-/m0/s1	QYXXDFPSNSEWLS-GBPFJNKXSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K05844439	BRD-K05844439-001-01-0	Broad Institute of MIT and Harvard	BRD-K05844439			COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(C)(=O)=O)cc34)[C@@H](CO)O2)cc1	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19+,21+,23-/m0/s1	QYXXDFPSNSEWLS-GBPFJNKXSA-N	476.161721946							110478
BRD-K93693888-001-01-0	LSM-21926	BRD-K93693888	54647759	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22-,25+,27+/m1/s1	FUBUSFISZJCQOM-JEBXRSONSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K93693888	BRD-K93693888-001-01-0	Broad Institute of MIT and Harvard	BRD-K93693888			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22-,25+,27+/m1/s1	FUBUSFISZJCQOM-JEBXRSONSA-N	562.13854183							110479
BRD-K36333898-001-01-1	LSM-21927	BRD-K36333898	54647777	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22+,26+,28-/m0/s1	OEYUNRREIFVABF-PJDAHJOFSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K36333898	BRD-K36333898-001-01-1	Broad Institute of MIT and Harvard	BRD-K36333898			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22+,26+,28-/m0/s1	OEYUNRREIFVABF-PJDAHJOFSA-N	519.21694929							110480
BRD-K16803279-001-01-6	LSM-21928	BRD-K16803279	54647735	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19+,22-,25-/m0/s1	IYABYMCTXJKIHR-MZIKWEIESA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccc4OC)C[C@@H]3c2c1	BroadT	BRD-K16803279	BRD-K16803279-001-01-6	Broad Institute of MIT and Harvard	BRD-K16803279			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccc4OC)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-7-8-21-18(9-16)19-10-17(33-22(13-28)25(19)34-21)11-23(29)26-12-15-5-3-4-6-20(15)32-2/h3-9,17,19,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t17-,19+,22-,25-/m0/s1	IYABYMCTXJKIHR-MZIKWEIESA-N	470.20530132							110481
BRD-K80110418-001-01-9	LSM-21929	BRD-K80110418	54647855	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16+,18+,21-/m1/s1	IMUPCUMLIPIWQW-NHAHXKBOSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K80110418	BRD-K80110418-001-01-9	Broad Institute of MIT and Harvard	BRD-K80110418			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C21H28N2O6/c1-27-11-20(26)23-13-4-5-17-15(6-13)16-7-14(28-18(10-24)21(16)29-17)8-19(25)22-9-12-2-3-12/h4-6,12,14,16,18,21,24H,2-3,7-11H2,1H3,(H,22,25)(H,23,26)/t14-,16+,18+,21-/m1/s1	IMUPCUMLIPIWQW-NHAHXKBOSA-N	404.194736636							110482
BRD-K14884904-001-01-1	LSM-21930	BRD-K14884904	54647953	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21+,23-,25-/m1/s1	ZUFBUKYSNNXFMC-RIPRBREISA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K14884904	BRD-K14884904-001-01-1	Broad Institute of MIT and Harvard	BRD-K14884904			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H26N4O5/c31-15-23-25-21(11-19(34-23)12-24(32)29-13-16-5-8-27-9-6-16)20-10-18(3-4-22(20)35-25)30-26(33)17-2-1-7-28-14-17/h1-10,14,19,21,23,25,31H,11-13,15H2,(H,29,32)(H,30,33)/t19-,21+,23-,25-/m1/s1	ZUFBUKYSNNXFMC-RIPRBREISA-N	474.190319972							110483
BRD-K44938935-001-01-2	LSM-21931	BRD-K44938935	54648001	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26+,28+/m1/s1	SQCXDLWHKVIWRB-DZXBDMBVSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K44938935	BRD-K44938935-001-01-2	Broad Institute of MIT and Harvard	BRD-K44938935			COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@H](CO)O2)cc1	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26+,28+/m1/s1	SQCXDLWHKVIWRB-DZXBDMBVSA-N	556.167950178							110484
BRD-K94652836-001-01-8	LSM-21932	BRD-K94652836	54647779	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22+,26-,28-/m1/s1	OEYUNRREIFVABF-UKTDVOJESA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K94652836	BRD-K94652836-001-01-8	Broad Institute of MIT and Harvard	BRD-K94652836			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22+,26-,28-/m1/s1	OEYUNRREIFVABF-UKTDVOJESA-N	519.21694929							110485
BRD-K38683522-001-01-1	LSM-21933	BRD-K38683522	54647973	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22+,25-/m1/s1	JQYAUOPJHODSNH-XOQZDTPSSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(Cl)cc4)C[C@H]3c2c1	BroadT	BRD-K38683522	BRD-K38683522-001-01-1	Broad Institute of MIT and Harvard	BRD-K38683522			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22+,25-/m1/s1	JQYAUOPJHODSNH-XOQZDTPSSA-N	487.1873988							110486
BRD-K39546071-001-01-4	LSM-21934	BRD-K39546071	54647895	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20-,23+,26+/m1/s1	RQLOITHXBXVBKT-ZCXMQSQVSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K39546071	BRD-K39546071-001-01-4	Broad Institute of MIT and Harvard	BRD-K39546071			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20-,23+,26+/m1/s1	RQLOITHXBXVBKT-ZCXMQSQVSA-N	468.206050248							110487
BRD-K15729781-001-01-5	LSM-21935	BRD-K15729781	54647919	InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18-,20-,22+/m1/s1	VPKMSVVJWJDGNW-ZLLBNUPZSA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K15729781	BRD-K15729781-001-01-5	Broad Institute of MIT and Harvard	BRD-K15729781			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C23H33N3O6/c1-30-9-8-24-21(28)12-16-11-18-17-10-15(26-23(29)25-14-4-2-3-5-14)6-7-19(17)32-22(18)20(13-27)31-16/h6-7,10,14,16,18,20,22,27H,2-5,8-9,11-13H2,1H3,(H,24,28)(H2,25,26,29)/t16-,18-,20-,22+/m1/s1	VPKMSVVJWJDGNW-ZLLBNUPZSA-N	447.236935806							110488
BRD-K94935060-001-01-4	LSM-21936	BRD-K94935060	54647725	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23+,26-/m1/s1	XOEUNFVLCGVFNC-HMMJVGNDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K94935060	BRD-K94935060-001-01-4	Broad Institute of MIT and Harvard	BRD-K94935060			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23+,26-/m1/s1	XOEUNFVLCGVFNC-HMMJVGNDSA-N	468.206050248							110489
MLS003130005	LSM-21937	SID99358544, BRD-K13977293	46903372	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22+,25+,27-/m1/s1	FUBUSFISZJCQOM-KRPQKCCHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K13977293	BRD-K13977293-001-02-1	Broad Institute of MIT and Harvard	BRD-K13977293			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H25F3N2O6S/c28-16-1-5-20(6-2-16)39(35,36)32-18-4-8-24-21(10-18)22-11-19(37-25(14-33)27(22)38-24)12-26(34)31-13-15-9-17(29)3-7-23(15)30/h1-10,19,22,25,27,32-33H,11-14H2,(H,31,34)/t19-,22+,25+,27-/m1/s1	FUBUSFISZJCQOM-KRPQKCCHSA-N	562.13854183							110490
BRD-K97837218-001-01-0	LSM-21938	BRD-K97837218	54648011	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15-,17-,19+/m0/s1	DXACVWBRXAONJE-YMFLFHJQSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)N4CCOCC4)C[C@H]3c2c1	BroadT	BRD-K97837218	BRD-K97837218-001-01-0	Broad Institute of MIT and Harvard	BRD-K97837218			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCOCC4)O[C@H]3CO)c2c1	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15-,17-,19+/m0/s1	DXACVWBRXAONJE-YMFLFHJQSA-N	426.146071882							110491
BRD-K13451905-001-01-9	LSM-21939	BRD-K13451905	54647713	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20-,22+,24+/m1/s1	TUZKBHQBMODFEV-NROSNUSPSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K13451905	BRD-K13451905-001-01-9	Broad Institute of MIT and Harvard	BRD-K13451905			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20-,22+,24+/m1/s1	TUZKBHQBMODFEV-NROSNUSPSA-N	451.210721058							110492
MLS003129974	LSM-21940	SID99358517, BRD-K83218193	46903345	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23-,25+,28+/m1/s1	HDZKHFXEQLFVHO-NDZQKZDNSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K83218193	BRD-K83218193-001-02-6	Broad Institute of MIT and Harvard	BRD-K83218193			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C28H32N2O5/c31-16-25-28-23(22-12-20(7-8-24(22)35-28)29-26(32)11-17-5-6-17)13-21(34-25)14-27(33)30-10-9-18-3-1-2-4-19(18)15-30/h1-4,7-8,12,17,21,23,25,28,31H,5-6,9-11,13-16H2,(H,29,32)/t21-,23-,25+,28+/m1/s1	HDZKHFXEQLFVHO-NDZQKZDNSA-N	476.231122144							110493
BRD-K62119018-001-01-6	LSM-21941	BRD-K62119018	54647778	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22+,26+,28-/m1/s1	OEYUNRREIFVABF-HAGKMHAYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K62119018	BRD-K62119018-001-01-6	Broad Institute of MIT and Harvard	BRD-K62119018			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H30FN3O5/c30-23-8-4-5-9-24(23)33-29(36)32-19-10-11-25-21(14-19)22-15-20(37-26(17-34)28(22)38-25)16-27(35)31-13-12-18-6-2-1-3-7-18/h1-11,14,20,22,26,28,34H,12-13,15-17H2,(H,31,35)(H2,32,33,36)/t20-,22+,26+,28-/m1/s1	OEYUNRREIFVABF-HAGKMHAYSA-N	519.21694929							110494
BRD-K13035213-001-01-7	LSM-21942	BRD-K13035213	54647945	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20+,22-,24-/m1/s1	YUJPPMQDMPRDFH-LWSJSWBQSA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@@H](CO)O1	BroadT	BRD-K13035213	BRD-K13035213-001-01-7	Broad Institute of MIT and Harvard	BRD-K13035213			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@@H](CO)O1	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20+,22-,24-/m1/s1	YUJPPMQDMPRDFH-LWSJSWBQSA-N	490.17737201							110495
BRD-K20636606-001-01-8	LSM-21943	BRD-K20636606	54647748	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m1/s1	MRXIFVFTBXIAKP-XOQZDTPSSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K20636606	BRD-K20636606-001-01-8	Broad Institute of MIT and Harvard	BRD-K20636606			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(10-18(32-22)11-23(30)27-13-16-2-1-7-26-12-16)19-9-17(5-6-21(19)33-25)28-24(31)8-15-3-4-15/h1-2,5-7,9,12,15,18,20,22,25,29H,3-4,8,10-11,13-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m1/s1	MRXIFVFTBXIAKP-XOQZDTPSSA-N	451.210721058							110496
BRD-K07246389-001-01-6	LSM-21944	BRD-K07246389	54647968	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16-,18+,20+/m0/s1	MPRUPAINZQILBH-LBLLVPRASA-N	OC[C@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23	BroadT	BRD-K07246389	BRD-K07246389-001-01-6	Broad Institute of MIT and Harvard	BRD-K07246389			OC[C@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16-,18+,20+/m0/s1	MPRUPAINZQILBH-LBLLVPRASA-N	416.138364612							110497
BRD-K84694327-001-01-8	LSM-21945	BRD-K84694327	54647768	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21-,24+/m0/s1	DYFXALJZQJAGQY-JBIZMDSKSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4cccnc4)C[C@H]3c2c1	BroadT	BRD-K84694327	BRD-K84694327-001-01-8	Broad Institute of MIT and Harvard	BRD-K84694327			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cccnc4)O[C@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-5-6-20-18(8-16)19-9-17(32-21(14-29)24(19)33-20)10-22(30)26-12-15-4-3-7-25-11-15/h3-8,11,17,19,21,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21-,24+/m0/s1	DYFXALJZQJAGQY-JBIZMDSKSA-N	454.2216201							110498
BRD-K60898278-001-01-2	LSM-21946	BRD-K60898278	54648000	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26+,28+/m0/s1	SQCXDLWHKVIWRB-HVZNUZIDSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K60898278	BRD-K60898278-001-01-2	Broad Institute of MIT and Harvard	BRD-K60898278			COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@@H](CO)O2)cc1	InChI=1S/C28H29FN2O7S/c1-36-20-7-2-17(3-8-20)15-30-27(33)14-21-13-24-23-12-19(6-11-25(23)38-28(24)26(16-32)37-21)31-39(34,35)22-9-4-18(29)5-10-22/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26+,28+/m0/s1	SQCXDLWHKVIWRB-HVZNUZIDSA-N	556.167950178							110499
BRD-K86201426-001-01-0	LSM-21947	BRD-K86201426	54647728	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23+,26+/m0/s1	XOEUNFVLCGVFNC-UAHYIAQRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K86201426	BRD-K86201426-001-01-0	Broad Institute of MIT and Harvard	BRD-K86201426			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23+,26+/m0/s1	XOEUNFVLCGVFNC-UAHYIAQRSA-N	468.206050248							110500
BRD-K37451255-001-01-7	LSM-21948	BRD-K37451255	54647705	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15+,19-,21-/m0/s1	YVFPRJXGACQPOR-FPDBKICDSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	BroadT	BRD-K37451255	BRD-K37451255-001-01-7	Broad Institute of MIT and Harvard	BRD-K37451255			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15+,19-,21-/m0/s1	YVFPRJXGACQPOR-FPDBKICDSA-N	430.154014676							110501
MLS003130288	LSM-21949	BRD-K36391997	46903806	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22+,24+,26-/m1/s1	PIVZJJFMUFHLSR-WUHHYYHUSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K36391997	BRD-K36391997-001-02-7	Broad Institute of MIT and Harvard	BRD-K36391997			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22+,24+,26-/m1/s1	PIVZJJFMUFHLSR-WUHHYYHUSA-N	527.152634472							110502
BRD-K27442509-001-01-2	LSM-21950	BRD-K27442509	54647849	InChI=1S/C24H30N2O5/c1-26(2)16-6-9-21-19(10-16)20-11-18(30-22(14-27)24(20)31-21)12-23(28)25-13-15-4-7-17(29-3)8-5-15/h4-10,18,20,22,24,27H,11-14H2,1-3H3,(H,25,28)/t18-,20-,22+,24+/m1/s1	FHQWFYFYGUWLTN-NROSNUSPSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(cc34)N(C)C)[C@H](CO)O2)cc1	BroadT	BRD-K27442509	BRD-K27442509-001-01-2	Broad Institute of MIT and Harvard	BRD-K27442509			COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(cc34)N(C)C)[C@H](CO)O2)cc1	InChI=1S/C24H30N2O5/c1-26(2)16-6-9-21-19(10-16)20-11-18(30-22(14-27)24(20)31-21)12-23(28)25-13-15-4-7-17(29-3)8-5-15/h4-10,18,20,22,24,27H,11-14H2,1-3H3,(H,25,28)/t18-,20-,22+,24+/m1/s1	FHQWFYFYGUWLTN-NROSNUSPSA-N	426.21547208							110503
BRD-K42686913-001-01-5	LSM-21951	BRD-K42686913	54647958	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22+,24+,26-/m0/s1	PIVZJJFMUFHLSR-JFXHBBLLSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K42686913	BRD-K42686913-001-01-5	Broad Institute of MIT and Harvard	BRD-K42686913			OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22+,24+,26-/m0/s1	PIVZJJFMUFHLSR-JFXHBBLLSA-N	527.152634472							110504
BRD-K65519676-001-01-7	LSM-21952	BRD-K65519676	54647941	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20-,22-,24+/m1/s1	YUJPPMQDMPRDFH-QSOCRCLWSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@@H](CO)O1	BroadT	BRD-K65519676	BRD-K65519676-001-01-7	Broad Institute of MIT and Harvard	BRD-K65519676			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@@H](CO)O1	InChI=1S/C24H30N2O7S/c1-3-9-25-23(28)13-17-12-20-19-10-15(7-8-21(19)33-24(20)22(14-27)32-17)26-34(29,30)18-6-4-5-16(11-18)31-2/h4-8,10-11,17,20,22,24,26-27H,3,9,12-14H2,1-2H3,(H,25,28)/t17-,20-,22-,24+/m1/s1	YUJPPMQDMPRDFH-QSOCRCLWSA-N	490.17737201							110505
BRD-K34874615-001-01-8	LSM-21953	BRD-K34874615	54647993	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19-,21+,23+/m1/s1	QYXXDFPSNSEWLS-YZBYQZESSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K34874615	BRD-K34874615-001-01-8	Broad Institute of MIT and Harvard	BRD-K34874615			COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(C)(=O)=O)cc34)[C@H](CO)O2)cc1	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19-,21+,23+/m1/s1	QYXXDFPSNSEWLS-YZBYQZESSA-N	476.161721946							110506
BRD-K04927540-001-01-0	LSM-21954	BRD-K04927540	54647913	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21+,23-/m0/s1	OLENBHWSUKSNPF-DLBBVRJLSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)N(C)C)C[C@@H]4c3c2	BroadT	BRD-K04927540	BRD-K04927540-001-01-0	Broad Institute of MIT and Harvard	BRD-K04927540			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-9-14(7-8-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-6-4-5-15(10-17)30-3/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21+,23-/m0/s1	OLENBHWSUKSNPF-DLBBVRJLSA-N	476.161721946							110507
BRD-K92354346-001-01-6	LSM-21955	BRD-K92354346	54647809	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15-,17-,20+/m0/s1	QAHMIWPLJULOCY-NUADTHGBSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)N(C)C)C[C@H]3c2c1	BroadT	BRD-K92354346	BRD-K92354346-001-01-6	Broad Institute of MIT and Harvard	BRD-K92354346			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15-,17-,20+/m0/s1	QAHMIWPLJULOCY-NUADTHGBSA-N	391.210721058							110508
BRD-K91616208-001-01-6	LSM-21956	BRD-K91616208	54647727	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23-,26-/m0/s1	XOEUNFVLCGVFNC-OXPRRSNCSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K91616208	BRD-K91616208-001-01-6	Broad Institute of MIT and Harvard	BRD-K91616208			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-17-3-1-2-16(8-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-4-5-15)6-7-22(20)34-26(21)23(14-30)33-19/h1-3,6-8,10,15,19,21,23,26,30H,4-5,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23-,26-/m0/s1	XOEUNFVLCGVFNC-OXPRRSNCSA-N	468.206050248							110509
BRD-K40727078-001-01-0	LSM-21957	BRD-K40727078	54647992	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19-,21+,23+/m0/s1	QYXXDFPSNSEWLS-VARILPKDSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K40727078	BRD-K40727078-001-01-0	Broad Institute of MIT and Harvard	BRD-K40727078			COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(C)(=O)=O)cc34)[C@@H](CO)O2)cc1	InChI=1S/C23H28N2O7S/c1-30-16-6-3-14(4-7-16)12-24-22(27)11-17-10-19-18-9-15(25-33(2,28)29)5-8-20(18)32-23(19)21(13-26)31-17/h3-9,17,19,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t17-,19-,21+,23+/m0/s1	QYXXDFPSNSEWLS-VARILPKDSA-N	476.161721946							110510
BRD-K71828153-001-01-6	LSM-21958	BRD-K71828153	54647972	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22+,25-/m0/s1	JQYAUOPJHODSNH-PMTIONAUSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(Cl)cc4)C[C@@H]3c2c1	BroadT	BRD-K71828153	BRD-K71828153-001-01-6	Broad Institute of MIT and Harvard	BRD-K71828153			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30ClN3O5/c1-29(2)13-24(32)28-17-7-8-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-3-5-16(26)6-4-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22+,25-/m0/s1	JQYAUOPJHODSNH-PMTIONAUSA-N	487.1873988							110511
BRD-K20944232-001-01-8	LSM-21959	BRD-K20944232	54647893	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20+,23-,26-/m0/s1	RQLOITHXBXVBKT-PLDOSFOGSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K20944232	BRD-K20944232-001-01-8	Broad Institute of MIT and Harvard	BRD-K20944232			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29FN2O5/c27-21-4-2-1-3-16(21)13-28-24(31)12-18-11-20-19-10-17(29-25(32)9-15-5-6-15)7-8-22(19)34-26(20)23(14-30)33-18/h1-4,7-8,10,15,18,20,23,26,30H,5-6,9,11-14H2,(H,28,31)(H,29,32)/t18-,20+,23-,26-/m0/s1	RQLOITHXBXVBKT-PLDOSFOGSA-N	468.206050248							110512
BRD-K65279361-001-01-8	LSM-21960	BRD-K65279361	54648016	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15-,17+,19+/m0/s1	DXACVWBRXAONJE-VGDUNAEUSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)N4CCOCC4)C[C@H]3c2c1	BroadT	BRD-K65279361	BRD-K65279361-001-01-8	Broad Institute of MIT and Harvard	BRD-K65279361			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCOCC4)O[C@@H]3CO)c2c1	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15-,17+,19+/m0/s1	DXACVWBRXAONJE-VGDUNAEUSA-N	426.146071882							110513
BRD-K08065916-001-01-1	LSM-21961	BRD-K08065916	54647886	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17+,21-,23-/m0/s1	OYAAAFLFGWLAPV-KCLKCTNDSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	BroadT	BRD-K08065916	BRD-K08065916-001-01-1	Broad Institute of MIT and Harvard	BRD-K08065916			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17+,21-,23-/m0/s1	OYAAAFLFGWLAPV-KCLKCTNDSA-N	454.174001192							110514
BRD-K87203858-001-01-2	LSM-21962	BRD-K87203858	54647969	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16-,18+,20+/m1/s1	MPRUPAINZQILBH-BIJSTVTOSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23	BroadT	BRD-K87203858	BRD-K87203858-001-01-2	Broad Institute of MIT and Harvard	BRD-K87203858			OC[C@@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16-,18+,20+/m1/s1	MPRUPAINZQILBH-BIJSTVTOSA-N	416.138364612							110515
BRD-K16455772-001-01-7	LSM-21963	BRD-K16455772	54648012	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15+,17+,19-/m0/s1	DXACVWBRXAONJE-KOJWFEOWSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)N4CCOCC4)C[C@@H]3c2c1	BroadT	BRD-K16455772	BRD-K16455772-001-01-7	Broad Institute of MIT and Harvard	BRD-K16455772			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N4CCOCC4)O[C@@H]3CO)c2c1	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15+,17+,19-/m0/s1	DXACVWBRXAONJE-KOJWFEOWSA-N	426.146071882							110516
BRD-K44940994-001-01-6	LSM-21964	BRD-K44940994	54647963	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16-,18-,20+/m1/s1	MPRUPAINZQILBH-ODZKNYGOSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23	BroadT	BRD-K44940994	BRD-K44940994-001-01-6	Broad Institute of MIT and Harvard	BRD-K44940994			OC[C@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C21H21FN2O6/c22-11-1-3-12(4-2-11)23-21(28)24-13-5-6-17-15(7-13)16-8-14(9-19(26)27)29-18(10-25)20(16)30-17/h1-7,14,16,18,20,25H,8-10H2,(H,26,27)(H2,23,24,28)/t14-,16-,18-,20+/m1/s1	MPRUPAINZQILBH-ODZKNYGOSA-N	416.138364612							110517
BRD-K82368186-001-01-1	LSM-21965	BRD-K82368186	54647880	InChI=1S/C23H27N3O5/c1-26(2)22(29)12-16-11-18-17-10-15(25-21(28)9-14-5-7-24-8-6-14)3-4-19(17)31-23(18)20(13-27)30-16/h3-8,10,16,18,20,23,27H,9,11-13H2,1-2H3,(H,25,28)/t16-,18+,20-,23-/m0/s1	MTNZWEPDKOJLIY-IRLNJFMJSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	BroadT	BRD-K82368186	BRD-K82368186-001-01-1	Broad Institute of MIT and Harvard	BRD-K82368186			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	InChI=1S/C23H27N3O5/c1-26(2)22(29)12-16-11-18-17-10-15(25-21(28)9-14-5-7-24-8-6-14)3-4-19(17)31-23(18)20(13-27)30-16/h3-8,10,16,18,20,23,27H,9,11-13H2,1-2H3,(H,25,28)/t16-,18+,20-,23-/m0/s1	MTNZWEPDKOJLIY-IRLNJFMJSA-N	425.195070994							110518
BRD-K44328471-001-01-6	LSM-21966	BRD-K44328471	54647811	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15+,17+,20-/m1/s1	QAHMIWPLJULOCY-GKTLAZJLSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)N(C)C)C[C@H]3c2c1	BroadT	BRD-K44328471	BRD-K44328471-001-01-6	Broad Institute of MIT and Harvard	BRD-K44328471			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C20H29N3O5/c1-22(2)10-18(25)21-12-5-6-16-14(7-12)15-8-13(9-19(26)23(3)4)27-17(11-24)20(15)28-16/h5-7,13,15,17,20,24H,8-11H2,1-4H3,(H,21,25)/t13-,15+,17+,20-/m1/s1	QAHMIWPLJULOCY-GKTLAZJLSA-N	391.210721058							110519
BRD-K88865125-001-01-4	LSM-21967	BRD-K88865125	54647961	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22-,24+,26+/m0/s1	PIVZJJFMUFHLSR-TUTLFNSSSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K88865125	BRD-K88865125-001-01-4	Broad Institute of MIT and Harvard	BRD-K88865125			OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-1-4-20(5-2-17)37(33,34)30-18-3-6-23-21(11-18)22-12-19(35-24(15-31)26(22)36-23)13-25(32)29-14-16-7-9-28-10-8-16/h1-11,19,22,24,26,30-31H,12-15H2,(H,29,32)/t19-,22-,24+,26+/m0/s1	PIVZJJFMUFHLSR-TUTLFNSSSA-N	527.152634472							110520
BRD-K68799352-001-01-3	LSM-21968	BRD-K68799352	54647885	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17+,21-,23-/m1/s1	OYAAAFLFGWLAPV-AIVLZAJPSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	BroadT	BRD-K68799352	BRD-K68799352-001-01-3	Broad Institute of MIT and Harvard	BRD-K68799352			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C24H26N2O7/c1-26(2)22(28)10-15-9-17-16-8-14(4-6-18(16)33-23(17)21(11-27)32-15)25-24(29)13-3-5-19-20(7-13)31-12-30-19/h3-8,15,17,21,23,27H,9-12H2,1-2H3,(H,25,29)/t15-,17+,21-,23-/m1/s1	OYAAAFLFGWLAPV-AIVLZAJPSA-N	454.174001192							110521
BRD-K33003579-001-01-9	LSM-21969	BRD-K33003579	54648010	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15-,17-,19+/m1/s1	DXACVWBRXAONJE-VWMOJTHMSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)N4CCOCC4)C[C@@H]3c2c1	BroadT	BRD-K33003579	BRD-K33003579-001-01-9	Broad Institute of MIT and Harvard	BRD-K33003579			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N4CCOCC4)O[C@@H]3CO)c2c1	InChI=1S/C19H26N2O7S/c1-29(24,25)20-12-2-3-16-14(8-12)15-9-13(27-17(11-22)19(15)28-16)10-18(23)21-4-6-26-7-5-21/h2-3,8,13,15,17,19-20,22H,4-7,9-11H2,1H3/t13-,15-,17-,19+/m1/s1	DXACVWBRXAONJE-VWMOJTHMSA-N	426.146071882							110522
MLS003129063	LSM-21970	SID99359669, BRD-K77759000	46904231	InChI=1S/C21H23NO7S/c1-27-20(24)11-14-10-17-16-9-13(22-30(25,26)15-5-3-2-4-6-15)7-8-18(16)29-21(17)19(12-23)28-14/h2-9,14,17,19,21-23H,10-12H2,1H3/t14-,17-,19+,21+/m0/s1	NPRGNJUPYHXXCW-QBGRRASTSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K77759000	BRD-K77759000-001-02-0	Broad Institute of MIT and Harvard	BRD-K77759000			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C21H23NO7S/c1-27-20(24)11-14-10-17-16-9-13(22-30(25,26)15-5-3-2-4-6-15)7-8-18(16)29-21(17)19(12-23)28-14/h2-9,14,17,19,21-23H,10-12H2,1H3/t14-,17-,19+,21+/m0/s1	NPRGNJUPYHXXCW-QBGRRASTSA-N	433.119522776							110523
BRD-K55317887-001-01-3	LSM-21971	BRD-K55317887	54647801	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19+,21+,23-/m1/s1	RNEATWJSKJKSLU-QXPQREGVSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)N(C)C)C[C@H]4c3c2)cc1	BroadT	BRD-K55317887	BRD-K55317887-001-01-3	Broad Institute of MIT and Harvard	BRD-K55317887			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)N(C)C)O[C@H]4CO)c3c2)cc1	InChI=1S/C24H29N3O6/c1-27(2)22(29)12-17-11-19-18-10-15(6-9-20(18)33-23(19)21(13-28)32-17)26-24(30)25-14-4-7-16(31-3)8-5-14/h4-10,17,19,21,23,28H,11-13H2,1-3H3,(H2,25,26,30)/t17-,19+,21+,23-/m1/s1	RNEATWJSKJKSLU-QXPQREGVSA-N	455.205635678							110524
BRD-K97979071-001-01-6	LSM-21972	BRD-K97979071	54647868	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18+,20-,22-/m1/s1	LHJCGFYIVQCPBG-HOQQESESSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	BroadT	BRD-K97979071	BRD-K97979071-001-01-6	Broad Institute of MIT and Harvard	BRD-K97979071			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C24H26F3N3O5/c1-30(2)21(32)11-16-10-18-17-9-15(7-8-19(17)35-22(18)20(12-31)34-16)29-23(33)28-14-5-3-13(4-6-14)24(25,26)27/h3-9,16,18,20,22,31H,10-12H2,1-2H3,(H2,28,29,33)/t16-,18+,20-,22-/m1/s1	LHJCGFYIVQCPBG-HOQQESESSA-N	493.182455562							110525
BRD-K72233204-001-01-7	LSM-21973	BRD-K72233204	54647709	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20+,22+,24-/m1/s1	TUZKBHQBMODFEV-HJBWUJCXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K72233204	BRD-K72233204-001-01-7	Broad Institute of MIT and Harvard	BRD-K72233204			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)26-13-15-6-7-15)19-10-17(8-9-21(19)33-24)28-25(31)27-16-4-2-1-3-5-16/h1-5,8-10,15,18,20,22,24,29H,6-7,11-14H2,(H,26,30)(H2,27,28,31)/t18-,20+,22+,24-/m1/s1	TUZKBHQBMODFEV-HJBWUJCXSA-N	451.210721058							110526
MLS003129468	LSM-7269	BRD-K32294814, SID99357804	44486966	InChI=1S/C28H44N8O4/c1-21-17-35(22(2)19-37)27(38)6-5-11-36-25(16-29-31-36)20-40-26(21)18-33(4)28(39)30-23-7-9-24(10-8-23)34-14-12-32(3)13-15-34/h7-10,16,21-22,26,37H,5-6,11-15,17-20H2,1-4H3,(H,30,39)/t21-,22-,26+/m1/s1	LMWGPKORGYIWNW-DRLORSAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K32294814	BRD-K32294814-001-02-8	Broad Institute of MIT and Harvard	BRD-K32294814			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H44N8O4/c1-21-17-35(22(2)19-37)27(38)6-5-11-36-25(16-29-31-36)20-40-26(21)18-33(4)28(39)30-23-7-9-24(10-8-23)34-14-12-32(3)13-15-34/h7-10,16,21-22,26,37H,5-6,11-15,17-20H2,1-4H3,(H,30,39)/t21-,22-,26+/m1/s1	LMWGPKORGYIWNW-DRLORSAXSA-N	556.348551968							95890
BRD-K08023754	LSM-6959		44486958	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19+,22-/m0/s1	GMDADKPJAYHJFG-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K08023754	BRD-K08023754-001-01-5	Broad Institute of MIT and Harvard	BRD-K08023754			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19+,22-/m0/s1	GMDADKPJAYHJFG-JQVVWYNYSA-N	457.26890465							95580
BRD-K31039264	LSM-7252		44486352	InChI=1S/C23H33N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18+,21-/m0/s1	KNHKBBCFGVHHOP-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K31039264	BRD-K31039264-001-01-5	Broad Institute of MIT and Harvard	BRD-K31039264			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18+,21-/m0/s1	KNHKBBCFGVHHOP-UEXGIBASSA-N	443.253254586							95873
BRD-K60002786	LSM-7641		44498548	InChI=1S/C25H38N6O6/c1-17-12-31(18(2)15-32)24(33)7-6-10-30-13-19(27-28-30)16-37-23(17)14-29(3)25(34)26-21-9-8-20(35-4)11-22(21)36-5/h8-9,11,13,17-18,23,32H,6-7,10,12,14-16H2,1-5H3,(H,26,34)/t17-,18-,23-/m0/s1	DZDKJIRUSJXCKT-BSRJHKFKSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)c(OC)c1	BroadT	BRD-K60002786	BRD-K60002786-001-01-6	Broad Institute of MIT and Harvard	BRD-K60002786			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)c(OC)c1	InChI=1S/C25H38N6O6/c1-17-12-31(18(2)15-32)24(33)7-6-10-30-13-19(27-28-30)16-37-23(17)14-29(3)25(34)26-21-9-8-20(35-4)11-22(21)36-5/h8-9,11,13,17-18,23,32H,6-7,10,12,14-16H2,1-5H3,(H,26,34)/t17-,18-,23-/m0/s1	DZDKJIRUSJXCKT-BSRJHKFKSA-N	518.285282996							96262
SCHEMBL17487110	LSM-7080	BRD-K17663841	44492051	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15-,17-/m0/s1	CMMUKIKJYLMGMW-ZOBUZTSGSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K17663841	BRD-K17663841-001-01-2	Broad Institute of MIT and Harvard	BRD-K17663841			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15-,17-/m0/s1	CMMUKIKJYLMGMW-ZOBUZTSGSA-N	463.240639154							95701
BRD-K78352220	LSM-7871		44488704	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17+,22+/m0/s1	ATJIIPBEGAKQFE-GSHUGGBRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K78352220	BRD-K78352220-001-01-9	Broad Institute of MIT and Harvard	BRD-K78352220			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17+,22+/m0/s1	ATJIIPBEGAKQFE-GSHUGGBRSA-N	497.196045386							96492
BRD-K75990826	LSM-7832		44506065	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20+,23+/m0/s1	MEJUTVOAQGGYHA-MIZPHKNDSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K75990826	BRD-K75990826-001-01-7	Broad Institute of MIT and Harvard	BRD-K75990826			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20+,23+/m0/s1	MEJUTVOAQGGYHA-MIZPHKNDSA-N	443.289640094							96453
BRD-K34730083	LSM-7294		44487425	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13-,15+/m0/s1	DOGJCEWMCMFHOH-KCQAQPDRSA-N	CNC[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K34730083	BRD-K34730083-001-01-5	Broad Institute of MIT and Harvard	BRD-K34730083			CNC[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13-,15+/m0/s1	DOGJCEWMCMFHOH-KCQAQPDRSA-N	339.227039838							95915
BRD-K09069264	LSM-6970		44505904	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18-,22-/m1/s1	ZTOSEQHRKGCZOZ-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K09069264	BRD-K09069264-001-01-0	Broad Institute of MIT and Harvard	BRD-K09069264			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18-,22-/m1/s1	ZTOSEQHRKGCZOZ-JBYIUTFZSA-N	497.261374598							95591
BRD-K05662507	LSM-6935		44488694	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21+,25-/m0/s1	WYPGSQIBOYUSAK-BKSPAHHJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K05662507	BRD-K05662507-001-01-3	Broad Institute of MIT and Harvard	BRD-K05662507			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21+,25-/m0/s1	WYPGSQIBOYUSAK-BKSPAHHJSA-N	551.285617354							95556
MLS003129313	LSM-7956	BRD-K86569253, SID99357573	44504932	InChI=1S/C22H33N5O5S/c1-17-13-26(18(2)15-28)22(29)10-7-11-27-19(12-23-24-27)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,28H,7,10-11,13-16H2,1-3H3/t17-,18-,21-/m1/s1	YDFSFENEUSKTIZ-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K86569253	BRD-K86569253-001-02-6	Broad Institute of MIT and Harvard	BRD-K86569253			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H33N5O5S/c1-17-13-26(18(2)15-28)22(29)10-7-11-27-19(12-23-24-27)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,28H,7,10-11,13-16H2,1-3H3/t17-,18-,21-/m1/s1	YDFSFENEUSKTIZ-DBXWQHBBSA-N	479.220239896							96577
BRD-K70940447	LSM-7793		44486374	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13+,15-/m0/s1	DOGJCEWMCMFHOH-GUTXKFCHSA-N	CNC[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K70940447	BRD-K70940447-001-01-6	Broad Institute of MIT and Harvard	BRD-K70940447			CNC[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13+,15-/m0/s1	DOGJCEWMCMFHOH-GUTXKFCHSA-N	339.227039838							96414
MLS003129469	LSM-7909	SID99357805, BRD-K81821583	44505056	InChI=1S/C20H35N5O3/c1-15-10-24(16(2)13-26)20(27)5-4-8-25-18(9-21-22-25)14-28-19(15)12-23(3)11-17-6-7-17/h9,15-17,19,26H,4-8,10-14H2,1-3H3/t15-,16+,19+/m0/s1	BJEAXWIUXBEVDX-FRQCXROJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K81821583	BRD-K81821583-001-02-7	Broad Institute of MIT and Harvard	BRD-K81821583			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCc2cnnn2CCCC1=O	InChI=1S/C20H35N5O3/c1-15-10-24(16(2)13-26)20(27)5-4-8-25-18(9-21-22-25)14-28-19(15)12-23(3)11-17-6-7-17/h9,15-17,19,26H,4-8,10-14H2,1-3H3/t15-,16+,19+/m0/s1	BJEAXWIUXBEVDX-FRQCXROJSA-N	393.27399003							96530
MLS003130218	LSM-7683	BRD-K62567808	44505500	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)6-5-11-29-22(17-32-23)12-25-26-29/h7-10,12,19-20,23,30H,5-6,11,13-17H2,1-4H3/t19-,20+,23+/m0/s1	WGPDLCVCGOLGPE-MIZPHKNDSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K62567808	BRD-K62567808-001-02-8	Broad Institute of MIT and Harvard	BRD-K62567808			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)6-5-11-29-22(17-32-23)12-25-26-29/h7-10,12,19-20,23,30H,5-6,11,13-17H2,1-4H3/t19-,20+,23+/m0/s1	WGPDLCVCGOLGPE-MIZPHKNDSA-N	443.289640094							96304
BRD-K23038591	LSM-7149		44486358	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22-/m0/s1	VOGIWUFDXLFNKS-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K23038591	BRD-K23038591-001-01-1	Broad Institute of MIT and Harvard	BRD-K23038591			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22-/m0/s1	VOGIWUFDXLFNKS-JQVVWYNYSA-N	473.26381927							95770
BRD-K87400432	LSM-7972		44492581	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18-,21-/m1/s1	NJZPXWDDBMYIMJ-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K87400432	BRD-K87400432-001-01-9	Broad Institute of MIT and Harvard	BRD-K87400432			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18-,21-/m1/s1	NJZPXWDDBMYIMJ-DBXWQHBBSA-N	430.269239008							96593
MLS003129391	LSM-7645	BRD-K60129749, SID99357694	44487409	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19-,24+/m0/s1	XYWPMUCHOREPKK-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K60129749	BRD-K60129749-001-02-1	Broad Institute of MIT and Harvard	BRD-K60129749			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19-,24+/m0/s1	XYWPMUCHOREPKK-AXHZCLLHSA-N	510.259068248							96266
BRD-K40199965	LSM-7361		44485059	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19+,24-/m1/s1	BWTMYHAPSQQINJ-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K40199965	BRD-K40199965-001-01-8	Broad Institute of MIT and Harvard	BRD-K40199965			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19+,24-/m1/s1	BWTMYHAPSQQINJ-YDIMBITNSA-N	496.279803692							95982
BRD-K72783054	LSM-7805		44505438	InChI=1S/C25H38N6O6/c1-17-12-31(18(2)15-32)24(33)7-6-10-30-13-19(27-28-30)16-37-23(17)14-29(3)25(34)26-21-9-8-20(35-4)11-22(21)36-5/h8-9,11,13,17-18,23,32H,6-7,10,12,14-16H2,1-5H3,(H,26,34)/t17-,18-,23-/m1/s1	DZDKJIRUSJXCKT-PMAPCBKXSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)c(OC)c1	BroadT	BRD-K72783054	BRD-K72783054-001-01-2	Broad Institute of MIT and Harvard	BRD-K72783054			COc1ccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)c(OC)c1	InChI=1S/C25H38N6O6/c1-17-12-31(18(2)15-32)24(33)7-6-10-30-13-19(27-28-30)16-37-23(17)14-29(3)25(34)26-21-9-8-20(35-4)11-22(21)36-5/h8-9,11,13,17-18,23,32H,6-7,10,12,14-16H2,1-5H3,(H,26,34)/t17-,18-,23-/m1/s1	DZDKJIRUSJXCKT-PMAPCBKXSA-N	518.285282996							96426
BRD-K48222931	LSM-7469		44492062	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19+,22+/m1/s1	AIVZVDBTBOXKNA-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K48222931	BRD-K48222931-001-01-1	Broad Institute of MIT and Harvard	BRD-K48222931			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19+,22+/m1/s1	AIVZVDBTBOXKNA-DXIQSLLYSA-N	429.27399003							96090
BRD-K19960610	LSM-7108		44486370	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20+,25-/m1/s1	PJEXWGOYWCOKCP-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K19960610	BRD-K19960610-001-01-9	Broad Institute of MIT and Harvard	BRD-K19960610			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20+,25-/m1/s1	PJEXWGOYWCOKCP-OHUGHZGNSA-N	480.284889072							95729
BRD-K55231301	LSM-7574		44493585	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22-/m1/s1	QAXWADXATYBNKX-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K55231301	BRD-K55231301-001-01-4	Broad Institute of MIT and Harvard	BRD-K55231301			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22-/m1/s1	QAXWADXATYBNKX-JBYIUTFZSA-N	497.261374598							96195
MLS003129499	LSM-8059	BRD-K94672699	44485050	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15-,18+/m0/s1	HEIBNMHSSNMFIU-RLFYNMQTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K94672699	BRD-K94672699-001-02-0	Broad Institute of MIT and Harvard	BRD-K94672699			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15-,18+/m0/s1	HEIBNMHSSNMFIU-RLFYNMQTSA-N	407.253254586							96680
MLS003129504	LSM-7924	BRD-K83481956, SID99357836	44505130	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18+,22-/m0/s1	QVFRXOMYJDWMPT-SVMVAKDDSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K83481956	BRD-K83481956-001-02-7	Broad Institute of MIT and Harvard	BRD-K83481956			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18+,22-/m0/s1	QVFRXOMYJDWMPT-SVMVAKDDSA-N	509.23080458							96545
BRD-K08209559	LSM-6962		44496400	InChI=1S/C27H42N6O4/c1-19-14-33(20(2)17-34)25(35)8-7-13-32-15-23(29-30-32)18-37-24(19)16-31(6)26(36)28-22-11-9-21(10-12-22)27(3,4)5/h9-12,15,19-20,24,34H,7-8,13-14,16-18H2,1-6H3,(H,28,36)/t19-,20+,24-/m1/s1	APMQHRQBDHMONS-JXALWOEJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(C)(C)C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K08209559	BRD-K08209559-001-01-7	Broad Institute of MIT and Harvard	BRD-K08209559			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(C)(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H42N6O4/c1-19-14-33(20(2)17-34)25(35)8-7-13-32-15-23(29-30-32)18-37-24(19)16-31(6)26(36)28-22-11-9-21(10-12-22)27(3,4)5/h9-12,15,19-20,24,34H,7-8,13-14,16-18H2,1-6H3,(H,28,36)/t19-,20+,24-/m1/s1	APMQHRQBDHMONS-JXALWOEJSA-N	514.326753884							95583
MLS003129321	LSM-7762	BRD-K68350686, SID99357580	44505498	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)6-5-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-9-22(32-4)10-8-20/h7-10,12,18-19,23,30H,5-6,11,13-17H2,1-4H3/t18-,19+,23+/m1/s1	VZSMXRDPAZDIAR-MSYCTHLASA-N	COc1ccc(CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K68350686	BRD-K68350686-001-02-0	Broad Institute of MIT and Harvard	BRD-K68350686			COc1ccc(CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)6-5-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-9-22(32-4)10-8-20/h7-10,12,18-19,23,30H,5-6,11,13-17H2,1-4H3/t18-,19+,23+/m1/s1	VZSMXRDPAZDIAR-MSYCTHLASA-N	459.284554714							96383
MLS003130220	LSM-6892	BRD-K02420864, SID99359015	44493079	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28+/m0/s1	CUSMSBFNEHNGNQ-SXDGJLEOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K02420864	BRD-K02420864-001-02-4	Broad Institute of MIT and Harvard	BRD-K02420864			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28+/m0/s1	CUSMSBFNEHNGNQ-SXDGJLEOSA-N	521.300204778							95513
BRD-K37306329	LSM-7327		44492055	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21-/m1/s1	DTQFALQSFDATTM-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K37306329	BRD-K37306329-001-01-5	Broad Institute of MIT and Harvard	BRD-K37306329			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21-/m1/s1	DTQFALQSFDATTM-CBGDNZLLSA-N	526.251538196							95948
BRD-K15923694	LSM-7065		44486961	InChI=1S/C24H35N5O5/c1-18-12-29(19(2)15-30)23(31)10-7-11-28-13-21(25-26-28)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22-/m0/s1	STPKXVJXGDPGFM-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)OCc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K15923694	BRD-K15923694-001-01-0	Broad Institute of MIT and Harvard	BRD-K15923694			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)OCc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-18-12-29(19(2)15-30)23(31)10-7-11-28-13-21(25-26-28)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22-/m0/s1	STPKXVJXGDPGFM-JQVVWYNYSA-N	473.26381927							95686
MLS003129363	LSM-7944	BRD-K85398522, SID99357670	44486959	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19-,22+/m0/s1	GMDADKPJAYHJFG-CNNODRBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K85398522	BRD-K85398522-001-02-6	Broad Institute of MIT and Harvard	BRD-K85398522			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19-,22+/m0/s1	GMDADKPJAYHJFG-CNNODRBYSA-N	457.26890465							96565
BRD-K13765840	LSM-7034		44485070	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17-,22-/m1/s1	DEGZSTUNWMGQCY-DRSNIGMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K13765840	BRD-K13765840-001-01-0	Broad Institute of MIT and Harvard	BRD-K13765840			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17-,22-/m1/s1	DEGZSTUNWMGQCY-DRSNIGMVSA-N	502.253982868							95655
BRD-K67269534	LSM-7746		44485769	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13-,15+/m1/s1	DOGJCEWMCMFHOH-NFAWXSAZSA-N	CNC[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K67269534	BRD-K67269534-001-01-9	Broad Institute of MIT and Harvard	BRD-K67269534			CNC[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13-,15+/m1/s1	DOGJCEWMCMFHOH-NFAWXSAZSA-N	339.227039838							96367
BRD-K22790182	LSM-7145		44485085	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13-,15-/m1/s1	DOGJCEWMCMFHOH-UMVBOHGHSA-N	CNC[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K22790182	BRD-K22790182-001-01-3	Broad Institute of MIT and Harvard	BRD-K22790182			CNC[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13-,15-/m1/s1	DOGJCEWMCMFHOH-UMVBOHGHSA-N	339.227039838							95766
BRD-K22482035	LSM-7140		44485072	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20+,25-/m0/s1	XVJRXGRWNAMAGP-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K22482035	BRD-K22482035-001-01-6	Broad Institute of MIT and Harvard	BRD-K22482035			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20+,25-/m0/s1	XVJRXGRWNAMAGP-DFIYOIEZSA-N	508.279803692							95761
BRD-K48211485	LSM-7468		44505614	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21-/m1/s1	HYHIJLYQTCYSKX-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K48211485	BRD-K48211485-001-01-4	Broad Institute of MIT and Harvard	BRD-K48211485			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21-/m1/s1	HYHIJLYQTCYSKX-LVCYWYKZSA-N	458.264153628							96089
MLS003129716	LSM-7780	SID99358159, BRD-K69792860	44506093	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20-,24+/m1/s1	XBPVHNZVBFLVIV-REHUZNOOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K69792860	BRD-K69792860-001-02-0	Broad Institute of MIT and Harvard	BRD-K69792860			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc2cnnn2CCCC1=O	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20-,24+/m1/s1	XBPVHNZVBFLVIV-REHUZNOOSA-N	501.295119398							96401
BRD-K00846846	LSM-6868		44486369	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16+/m1/s1	WAHUPRWPWKVPJH-YCPHGPKFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K00846846	BRD-K00846846-001-01-7	Broad Institute of MIT and Harvard	BRD-K00846846			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16+/m1/s1	WAHUPRWPWKVPJH-YCPHGPKFSA-N	353.242689902							95489
BRD-K46807184	LSM-7444		44488156	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21-/m1/s1	DTQFALQSFDATTM-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K46807184	BRD-K46807184-001-01-5	Broad Institute of MIT and Harvard	BRD-K46807184			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21-/m1/s1	DTQFALQSFDATTM-LLGFUMIMSA-N	526.251538196							96065
BRD-K41005527	LSM-7371		44505204	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21-/m0/s1	HYHIJLYQTCYSKX-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K41005527	BRD-K41005527-001-01-7	Broad Institute of MIT and Harvard	BRD-K41005527			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21-/m0/s1	HYHIJLYQTCYSKX-WFXMLNOXSA-N	458.264153628							95992
MLS003129118	LSM-8079	BRD-K97186212	44496399	InChI=1S/C27H42N6O4/c1-19-14-33(20(2)17-34)25(35)8-7-13-32-15-23(29-30-32)18-37-24(19)16-31(6)26(36)28-22-11-9-21(10-12-22)27(3,4)5/h9-12,15,19-20,24,34H,7-8,13-14,16-18H2,1-6H3,(H,28,36)/t19-,20+,24+/m1/s1	APMQHRQBDHMONS-NMMYMHLASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(C)(C)C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K97186212	BRD-K97186212-001-02-6	Broad Institute of MIT and Harvard	BRD-K97186212			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(C)(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H42N6O4/c1-19-14-33(20(2)17-34)25(35)8-7-13-32-15-23(29-30-32)18-37-24(19)16-31(6)26(36)28-22-11-9-21(10-12-22)27(3,4)5/h9-12,15,19-20,24,34H,7-8,13-14,16-18H2,1-6H3,(H,28,36)/t19-,20+,24+/m1/s1	APMQHRQBDHMONS-NMMYMHLASA-N	514.326753884							96700
BRD-K08585415	LSM-6966		44506090	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28+/m1/s1	WVGLRASGSLBUCZ-IWHLBADBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K08585415	BRD-K08585415-001-01-4	Broad Institute of MIT and Harvard	BRD-K08585415			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28+/m1/s1	WVGLRASGSLBUCZ-IWHLBADBSA-N	521.300204778							95587
MLS003129366	LSM-7416	BRD-K44890352	44486345	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15+,18+/m1/s1	HEIBNMHSSNMFIU-VKJFTORMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K44890352	BRD-K44890352-001-02-7	Broad Institute of MIT and Harvard	BRD-K44890352			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15+,18+/m1/s1	HEIBNMHSSNMFIU-VKJFTORMSA-N	407.253254586							96037
BRD-K02229102	LSM-6890		44485077	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17+,22-/m1/s1	ATJIIPBEGAKQFE-HYFFOGBASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K02229102	BRD-K02229102-001-01-3	Broad Institute of MIT and Harvard	BRD-K02229102			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17+,22-/m1/s1	ATJIIPBEGAKQFE-HYFFOGBASA-N	497.196045386							95511
BRD-K61541549	LSM-7668		44487422	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	PJEXWGOYWCOKCP-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K61541549	BRD-K61541549-001-01-0	Broad Institute of MIT and Harvard	BRD-K61541549			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	PJEXWGOYWCOKCP-WZOHSFFVSA-N	480.284889072							96289
MLS003129419	LSM-7308	BRD-K35836352, SID99357717	44498560	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)6-5-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-9-22(32-4)10-8-20/h7-10,12,18-19,23,30H,5-6,11,13-17H2,1-4H3/t18-,19-,23+/m1/s1	VZSMXRDPAZDIAR-PWHSHALESA-N	COc1ccc(CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K35836352	BRD-K35836352-001-02-1	Broad Institute of MIT and Harvard	BRD-K35836352			COc1ccc(CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)6-5-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-9-22(32-4)10-8-20/h7-10,12,18-19,23,30H,5-6,11,13-17H2,1-4H3/t18-,19-,23+/m1/s1	VZSMXRDPAZDIAR-PWHSHALESA-N	459.284554714							95929
MLS003129563	LSM-21974	BRD-K53777872	44506086	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18+,22+/m1/s1	QPXXSBPXMIWUTR-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K53777872	BRD-K53777872-001-02-5	Broad Institute of MIT and Harvard	BRD-K53777872			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18+,22+/m1/s1	QPXXSBPXMIWUTR-FGSXEWAUSA-N	445.26890465							110527
MLS003129305	LSM-7854	BRD-K77323800	44505133	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18+,21-/m0/s1	QLGFDRXFQQZFKX-UEXGIBASSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K77323800	BRD-K77323800-001-02-7	Broad Institute of MIT and Harvard	BRD-K77323800			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18+,21-/m0/s1	QLGFDRXFQQZFKX-UEXGIBASSA-N	509.23080458							96475
MLS003129435	LSM-7558	BRD-K54395291	44504960	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18-,22+/m0/s1	RLIRIECCVMDDQV-NPPFBWRTSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K54395291	BRD-K54395291-001-02-8	Broad Institute of MIT and Harvard	BRD-K54395291			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18-,22+/m0/s1	RLIRIECCVMDDQV-NPPFBWRTSA-N	509.23080458							96179
BRD-K58790952	LSM-7628		44488709	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16-/m0/s1	WAHUPRWPWKVPJH-LZWOXQAQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K58790952	BRD-K58790952-001-01-8	Broad Institute of MIT and Harvard	BRD-K58790952			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16-/m0/s1	WAHUPRWPWKVPJH-LZWOXQAQSA-N	353.242689902							96249
BRD-K49594309-001-01-6	LSM-7489	BRD-K49594309	44505756	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17-,19+/m1/s1	UOJDQXZVAPFQKD-LMMKCTJWSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K49594309	BRD-K49594309-001-02-4	Broad Institute of MIT and Harvard	BRD-K49594309			CC(C)COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17-,19+/m1/s1	UOJDQXZVAPFQKD-LMMKCTJWSA-N	439.279469334							96110
MLS003130213	LSM-7426	BRD-K45663104	44485061	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21-,25+/m0/s1	WYPGSQIBOYUSAK-STWLZBDKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K45663104	BRD-K45663104-001-02-8	Broad Institute of MIT and Harvard	BRD-K45663104			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21-,25+/m0/s1	WYPGSQIBOYUSAK-STWLZBDKSA-N	551.285617354							96047
MLS003129743	LSM-7388	BRD-K42420111, SID99358186	44486956	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19+,24+/m0/s1	BWTMYHAPSQQINJ-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K42420111	BRD-K42420111-001-02-7	Broad Institute of MIT and Harvard	BRD-K42420111			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19+,24+/m0/s1	BWTMYHAPSQQINJ-XLNZFTOWSA-N	496.279803692							96009
MLS003130240	LSM-7650	BRD-K60520051	44485761	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15+,19+/m1/s1	ZMFVFBQYBHAIKE-VCBZYWHSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K60520051	BRD-K60520051-001-02-3	Broad Institute of MIT and Harvard	BRD-K60520051			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15+,19+/m1/s1	ZMFVFBQYBHAIKE-VCBZYWHSSA-N	477.26996729							96271
MLS003129306	LSM-7126	BRD-K21125707	44619742	InChI=1S/C28H44N8O4/c1-21-16-36(22(2)19-37)27(38)6-5-11-35-17-24(30-31-35)20-40-26(21)18-33(4)28(39)29-23-7-9-25(10-8-23)34-14-12-32(3)13-15-34/h7-10,17,21-22,26,37H,5-6,11-16,18-20H2,1-4H3,(H,29,39)/t21-,22-,26+/m1/s1	AFGWKCDRVGDDFW-DRLORSAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K21125707	BRD-K21125707-001-02-7	Broad Institute of MIT and Harvard	BRD-K21125707			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H44N8O4/c1-21-16-36(22(2)19-37)27(38)6-5-11-35-17-24(30-31-35)20-40-26(21)18-33(4)28(39)29-23-7-9-25(10-8-23)34-14-12-32(3)13-15-34/h7-10,17,21-22,26,37H,5-6,11-16,18-20H2,1-4H3,(H,29,39)/t21-,22-,26+/m1/s1	AFGWKCDRVGDDFW-DRLORSAXSA-N	556.348551968							95747
MLS003129369	LSM-7369	SID99357675, BRD-K40918107	44493572	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21+/m1/s1	XRXVGTRBMNTJPS-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K40918107	BRD-K40918107-001-02-8	Broad Institute of MIT and Harvard	BRD-K40918107			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21+/m1/s1	XRXVGTRBMNTJPS-LZJOCLMNSA-N	513.181267574							95990
SCHEMBL17487092	LSM-6884	BRD-K01676918	44487406	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15+,18-/m1/s1	HEIBNMHSSNMFIU-RVKKMQEKSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K01676918	BRD-K01676918-001-01-0	Broad Institute of MIT and Harvard	BRD-K01676918			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15+,18-/m1/s1	HEIBNMHSSNMFIU-RVKKMQEKSA-N	407.253254586							95505
BRD-K74504761	LSM-7820		44490870	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19-,22-/m1/s1	AIVZVDBTBOXKNA-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K74504761	BRD-K74504761-001-01-4	Broad Institute of MIT and Harvard	BRD-K74504761			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19-,22-/m1/s1	AIVZVDBTBOXKNA-WOIUINJBSA-N	429.27399003							96441
BRD-K51569524	LSM-7512		44504979	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,20-/m1/s1	NSEOCVGIAYKUAZ-MBOZVWFJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K51569524	BRD-K51569524-001-01-2	Broad Institute of MIT and Harvard	BRD-K51569524			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,20-/m1/s1	NSEOCVGIAYKUAZ-MBOZVWFJSA-N	444.248503564							96133
BRD-K49510739	LSM-7488		44505061	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28+/m0/s1	WVGLRASGSLBUCZ-SXDGJLEOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K49510739	BRD-K49510739-001-01-2	Broad Institute of MIT and Harvard	BRD-K49510739			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28+/m0/s1	WVGLRASGSLBUCZ-SXDGJLEOSA-N	521.300204778							96109
MLS003129413	LSM-7539	BRD-K53425819	44496406	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18-,22+/m1/s1	QPXXSBPXMIWUTR-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K53425819	BRD-K53425819-001-02-7	Broad Institute of MIT and Harvard	BRD-K53425819			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18-,22+/m1/s1	QPXXSBPXMIWUTR-HMFYCAOWSA-N	445.26890465							96160
BRD-K37167897	LSM-7323		44496407	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13+,15-/m0/s1	FOLOUAULJSJVDY-GUTXKFCHSA-N	CNC[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K37167897	BRD-K37167897-001-01-3	Broad Institute of MIT and Harvard	BRD-K37167897			CNC[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13+,15-/m0/s1	FOLOUAULJSJVDY-GUTXKFCHSA-N	339.227039838							95944
SCHEMBL17487105	LSM-8032	BRD-K92953664	44505976	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,20-/m0/s1	NSEOCVGIAYKUAZ-ZWOKBUDYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K92953664	BRD-K92953664-001-01-9	Broad Institute of MIT and Harvard	BRD-K92953664			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,20-/m0/s1	NSEOCVGIAYKUAZ-ZWOKBUDYSA-N	444.248503564							96653
BRD-K26273696	LSM-7181		44486963	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22-/m0/s1	VOGIWUFDXLFNKS-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K26273696	BRD-K26273696-001-01-5	Broad Institute of MIT and Harvard	BRD-K26273696			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22-/m0/s1	VOGIWUFDXLFNKS-IPJJNNNSSA-N	473.26381927							95802
BRD-K54885483	LSM-7570		44486356	InChI=1S/C24H35N5O5/c1-18-12-29(19(2)15-30)23(31)10-7-11-28-13-21(25-26-28)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22-/m1/s1	STPKXVJXGDPGFM-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)OCc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K54885483	BRD-K54885483-001-01-8	Broad Institute of MIT and Harvard	BRD-K54885483			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)OCc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-18-12-29(19(2)15-30)23(31)10-7-11-28-13-21(25-26-28)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22-/m1/s1	STPKXVJXGDPGFM-XQBPLPMBSA-N	473.26381927							96191
BRD-K37407046	LSM-7329		44485764	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16+/m0/s1	WAHUPRWPWKVPJH-SQWLQELKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K37407046	BRD-K37407046-001-01-3	Broad Institute of MIT and Harvard	BRD-K37407046			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16+/m0/s1	WAHUPRWPWKVPJH-SQWLQELKSA-N	353.242689902							95950
BRD-K23349860	LSM-7154		44487412	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19+,22-/m1/s1	GMDADKPJAYHJFG-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K23349860	BRD-K23349860-001-01-6	Broad Institute of MIT and Harvard	BRD-K23349860			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19+,22-/m1/s1	GMDADKPJAYHJFG-XQBPLPMBSA-N	457.26890465							95775
MLS003129556	LSM-7716	SID99357931, BRD-K65067638	44505365	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m1/s1	QVHCTLOUCAXGOY-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K65067638	BRD-K65067638-001-02-2	Broad Institute of MIT and Harvard	BRD-K65067638			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m1/s1	QVHCTLOUCAXGOY-RNHFSVANSA-N	529.23588996							96337
BRD-K80281472	LSM-7897		44495964	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18+,21-/m1/s1	NJZPXWDDBMYIMJ-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K80281472	BRD-K80281472-001-01-1	Broad Institute of MIT and Harvard	BRD-K80281472			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18+,21-/m1/s1	NJZPXWDDBMYIMJ-LVCYWYKZSA-N	430.269239008							96518
MLS003129201	LSM-6875	BRD-K01187795	44505798	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18-,21-/m0/s1	WMEBRZUCENJNIY-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K01187795	BRD-K01187795-001-02-4	Broad Institute of MIT and Harvard	BRD-K01187795			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18-,21-/m0/s1	WMEBRZUCENJNIY-WFXMLNOXSA-N	464.31110382							95496
BRD-K74055572	LSM-7818		44505153	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25-/m1/s1	QVHCTLOUCAXGOY-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K74055572	BRD-K74055572-001-01-6	Broad Institute of MIT and Harvard	BRD-K74055572			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25-/m1/s1	QVHCTLOUCAXGOY-OHUGHZGNSA-N	529.23588996							96439
MLS003129113	LSM-7522	BRD-K52159901, SID99357457	44505849	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21+/m0/s1	VTXUSJLMEZRIOV-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K52159901	BRD-K52159901-001-02-2	Broad Institute of MIT and Harvard	BRD-K52159901			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21+/m0/s1	VTXUSJLMEZRIOV-XGHQBKJUSA-N	476.254731796							96143
BRD-K66555134	LSM-7735		44484515	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22+,26-/m0/s1	OIASBGFOQSUHIL-VRUMLPLGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K66555134	BRD-K66555134-001-01-6	Broad Institute of MIT and Harvard	BRD-K66555134			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22+,26-/m0/s1	OIASBGFOQSUHIL-VRUMLPLGSA-N	541.337652926							96356
BRD-K23108726	LSM-7150		44504943	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25-/m0/s1	QVHCTLOUCAXGOY-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K23108726	BRD-K23108726-001-01-0	Broad Institute of MIT and Harvard	BRD-K23108726			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25-/m0/s1	QVHCTLOUCAXGOY-DFIYOIEZSA-N	529.23588996							95771
BRD-K12497208	LSM-7013		44485074	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20+,25+/m0/s1	XVJRXGRWNAMAGP-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K12497208	BRD-K12497208-001-01-7	Broad Institute of MIT and Harvard	BRD-K12497208			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20+,25+/m0/s1	XVJRXGRWNAMAGP-WZOHSFFVSA-N	508.279803692							95634
BRD-K85979978	LSM-7947		44485075	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15+,19-/m1/s1	ZMFVFBQYBHAIKE-ZRGWGRIASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K85979978	BRD-K85979978-001-01-4	Broad Institute of MIT and Harvard	BRD-K85979978			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15+,19-/m1/s1	ZMFVFBQYBHAIKE-ZRGWGRIASA-N	477.26996729							96568
MLS003130246	LSM-7457	BRD-K47520858, SID99359036	44505761	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18+,22-/m1/s1	DYYSINDAYMXOAQ-KGVIQGDOSA-N	COc1ccc(OC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K47520858	BRD-K47520858-001-02-6	Broad Institute of MIT and Harvard	BRD-K47520858			COc1ccc(OC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18+,22-/m1/s1	DYYSINDAYMXOAQ-KGVIQGDOSA-N	489.25873389							96078
BRD-K44541805-001-01-1	LSM-7413	BRD-K44541805	44505649	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)11-23(16(3)13-25)19(26)7-6-9-24-17(14-27-18)10-20-21-24/h10,15-16,18,25H,5-9,11-14H2,1-4H3/t15-,16+,18+/m1/s1	DWRDFVJCWRIGSC-RYRKJORJSA-N	CCCN(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K44541805	BRD-K44541805-001-02-9	Broad Institute of MIT and Harvard	BRD-K44541805			CCCN(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)11-23(16(3)13-25)19(26)7-6-9-24-17(14-27-18)10-20-21-24/h10,15-16,18,25H,5-9,11-14H2,1-4H3/t15-,16+,18+/m1/s1	DWRDFVJCWRIGSC-RYRKJORJSA-N	381.27399003							96034
MLS003129699	LSM-6866	BRD-K00468432, SID99358146	44504957	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18+,22+/m1/s1	RLIRIECCVMDDQV-FGSXEWAUSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K00468432	BRD-K00468432-001-02-8	Broad Institute of MIT and Harvard	BRD-K00468432			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18+,22+/m1/s1	RLIRIECCVMDDQV-FGSXEWAUSA-N	509.23080458							95487
MLS003129746	LSM-7107	BRD-K19845538	44505585	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)9-6-10-33-18(11-28-30-33)15-37-21(16)13-31(3)23(36)29-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,11,16-17,21,34H,6,9-10,12-15H2,1-3H3,(H,29,36)/t16-,17+,21+/m0/s1	MTUQQJRKJJVDPI-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K19845538	BRD-K19845538-001-02-9	Broad Institute of MIT and Harvard	BRD-K19845538			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)9-6-10-33-18(11-28-30-33)15-37-21(16)13-31(3)23(36)29-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,11,16-17,21,34H,6,9-10,12-15H2,1-3H3,(H,29,36)/t16-,17+,21+/m0/s1	MTUQQJRKJJVDPI-CSODHUTKSA-N	526.251538196							95728
BRD-K96839270	LSM-8078		44505811	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)6-5-11-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-9-21(34-4)10-8-19/h7-10,13,17-18,22,31H,5-6,11-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22-/m0/s1	OFOUXQSPHPQRAF-SPEDKVCISA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)cc1	BroadT	BRD-K96839270	BRD-K96839270-001-01-2	Broad Institute of MIT and Harvard	BRD-K96839270			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)cc1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)6-5-11-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-9-21(34-4)10-8-19/h7-10,13,17-18,22,31H,5-6,11-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22-/m0/s1	OFOUXQSPHPQRAF-SPEDKVCISA-N	488.274718312							96699
BRD-K33889536	LSM-7285		44506097	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13+,15-/m1/s1	FOLOUAULJSJVDY-VNHYZAJKSA-N	CNC[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K33889536	BRD-K33889536-001-01-3	Broad Institute of MIT and Harvard	BRD-K33889536			CNC[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13+,15-/m1/s1	FOLOUAULJSJVDY-VNHYZAJKSA-N	339.227039838							95906
MLS003129486	LSM-7676	BRD-K62191543, SID99357820	44488698	InChI=1S/C28H44N8O4/c1-21-17-35(22(2)19-37)27(38)6-5-11-36-25(16-29-31-36)20-40-26(21)18-33(4)28(39)30-23-7-9-24(10-8-23)34-14-12-32(3)13-15-34/h7-10,16,21-22,26,37H,5-6,11-15,17-20H2,1-4H3,(H,30,39)/t21-,22+,26+/m0/s1	LMWGPKORGYIWNW-VVZHRXSXSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K62191543	BRD-K62191543-001-02-7	Broad Institute of MIT and Harvard	BRD-K62191543			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H44N8O4/c1-21-17-35(22(2)19-37)27(38)6-5-11-36-25(16-29-31-36)20-40-26(21)18-33(4)28(39)30-23-7-9-24(10-8-23)34-14-12-32(3)13-15-34/h7-10,16,21-22,26,37H,5-6,11-15,17-20H2,1-4H3,(H,30,39)/t21-,22+,26+/m0/s1	LMWGPKORGYIWNW-VVZHRXSXSA-N	556.348551968							96297
MLS003129803	LSM-21975	SID99358283, BRD-K78176661	44505743	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21-/m1/s1	OOPGLCWBUZVAMU-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K78176661	BRD-K78176661-001-02-6	Broad Institute of MIT and Harvard	BRD-K78176661			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21-/m1/s1	OOPGLCWBUZVAMU-LLGFUMIMSA-N	497.210818064							110528
MLS003129156	LSM-7764	BRD-K68421632	44506015	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m1/s1	DVUZCPZOEGBIKA-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K68421632	BRD-K68421632-001-02-4	Broad Institute of MIT and Harvard	BRD-K68421632			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m1/s1	DVUZCPZOEGBIKA-LZJOCLMNSA-N	526.251538196							96385
BRD-K15428056	LSM-6801		44505243	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19+,24+/m1/s1	DSHPDBIZJLDJKA-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K15428056	BRD-K15428056-001-01-2	Broad Institute of MIT and Harvard	BRD-K15428056			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19+,24+/m1/s1	DSHPDBIZJLDJKA-IMWIBFENSA-N	487.279469334							95422
MLS003129725	LSM-7654	BRD-K60659225	44505148	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)9-6-10-28-20(16-33-22)12-24-25-28/h5,7-8,11-12,18-19,22,29H,6,9-10,13-16H2,1-4H3/t18-,19-,22+/m1/s1	GSLUEEWCAUTOBV-KNKQGSTJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K60659225	BRD-K60659225-001-02-0	Broad Institute of MIT and Harvard	BRD-K60659225			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)9-6-10-28-20(16-33-22)12-24-25-28/h5,7-8,11-12,18-19,22,29H,6,9-10,13-16H2,1-4H3/t18-,19-,22+/m1/s1	GSLUEEWCAUTOBV-KNKQGSTJSA-N	493.23588996							96275
BRD-K85967137	LSM-7946		44497252	InChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	AHKBAATWJXKTGZ-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K85967137	BRD-K85967137-001-01-7	Broad Institute of MIT and Harvard	BRD-K85967137			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	AHKBAATWJXKTGZ-DBXWQHBBSA-N	449.300204778							96567
BRD-K60679910	LSM-7655		44505423	InChI=1S/C22H38N6O4/c1-16-12-27(17(2)14-29)21(30)9-6-10-28-19(11-23-25-28)15-32-20(16)13-26(3)22(31)24-18-7-4-5-8-18/h11,16-18,20,29H,4-10,12-15H2,1-3H3,(H,24,31)/t16-,17+,20-/m1/s1	JDDXXTSIDDFAIE-FUHIMQAGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K60679910	BRD-K60679910-001-01-0	Broad Institute of MIT and Harvard	BRD-K60679910			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C22H38N6O4/c1-16-12-27(17(2)14-29)21(30)9-6-10-28-19(11-23-25-28)15-32-20(16)13-26(3)22(31)24-18-7-4-5-8-18/h11,16-18,20,29H,4-10,12-15H2,1-3H3,(H,24,31)/t16-,17+,20-/m1/s1	JDDXXTSIDDFAIE-FUHIMQAGSA-N	450.295453756							96276
MLS003129107	LSM-7632	BRD-K59453031	44505619	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21+/m0/s1	VTXUSJLMEZRIOV-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K59453031	BRD-K59453031-001-02-5	Broad Institute of MIT and Harvard	BRD-K59453031			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21+/m0/s1	VTXUSJLMEZRIOV-CSODHUTKSA-N	476.254731796							96253
MLS003130329	LSM-8029	BRD-K92803302	44488170	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19+,23+/m1/s1	QHTRHHVBBSPOHC-MSYCTHLASA-N	COc1ccccc1CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K92803302	BRD-K92803302-001-02-2	Broad Institute of MIT and Harvard	BRD-K92803302			COc1ccccc1CN(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19+,23+/m1/s1	QHTRHHVBBSPOHC-MSYCTHLASA-N	459.284554714							96650
BRD-K21709199-001-01-5	LSM-7131	BRD-K21709199	44485756	InChI=1S/C28H44N8O4/c1-21-17-35(22(2)19-37)27(38)6-5-11-36-25(16-29-31-36)20-40-26(21)18-33(4)28(39)30-23-7-9-24(10-8-23)34-14-12-32(3)13-15-34/h7-10,16,21-22,26,37H,5-6,11-15,17-20H2,1-4H3,(H,30,39)/t21-,22-,26-/m0/s1	LMWGPKORGYIWNW-MCEYFSPLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K21709199	BRD-K21709199-001-02-3	Broad Institute of MIT and Harvard	BRD-K21709199			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H44N8O4/c1-21-17-35(22(2)19-37)27(38)6-5-11-36-25(16-29-31-36)20-40-26(21)18-33(4)28(39)30-23-7-9-24(10-8-23)34-14-12-32(3)13-15-34/h7-10,16,21-22,26,37H,5-6,11-15,17-20H2,1-4H3,(H,30,39)/t21-,22-,26-/m0/s1	LMWGPKORGYIWNW-MCEYFSPLSA-N	556.348551968							95752
BRD-K67155745	LSM-7743		44485082	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20+,24+/m0/s1	ATOJIXFYNQCGDG-DCLXLUIPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K67155745	BRD-K67155745-001-01-5	Broad Institute of MIT and Harvard	BRD-K67155745			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20+,24+/m0/s1	ATOJIXFYNQCGDG-DCLXLUIPSA-N	501.295119398							96364
MLS003129251	LSM-7671	BRD-K61953981, SID99357520	44505407	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20+,25+/m0/s1	PZGTZQIYRXDXGV-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K61953981	BRD-K61953981-001-02-0	Broad Institute of MIT and Harvard	BRD-K61953981			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20+,25+/m0/s1	PZGTZQIYRXDXGV-WZOHSFFVSA-N	509.26381927							96292
SCHEMBL17487102	LSM-7062	BRD-K15845256	44487410	InChI=1S/C23H33N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	KNHKBBCFGVHHOP-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K15845256	BRD-K15845256-001-01-5	Broad Institute of MIT and Harvard	BRD-K15845256			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	KNHKBBCFGVHHOP-WFXMLNOXSA-N	443.253254586							95683
MLS003129345	LSM-6943	BRD-K06568278, SID99357655	44486968	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17-,22+/m0/s1	DEGZSTUNWMGQCY-PNLZDCPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K06568278	BRD-K06568278-001-02-6	Broad Institute of MIT and Harvard	BRD-K06568278			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17-,22+/m0/s1	DEGZSTUNWMGQCY-PNLZDCPESA-N	502.253982868							95564
SCHEMBL17487101	LSM-7535	BRD-K53174909	44488693	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19-,22-/m0/s1	GMDADKPJAYHJFG-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K53174909	BRD-K53174909-001-01-4	Broad Institute of MIT and Harvard	BRD-K53174909			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19-,22-/m0/s1	GMDADKPJAYHJFG-IPJJNNNSSA-N	457.26890465							96156
MLS003129550	LSM-7801	BRD-K72391864	44505337	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)8-5-9-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10-11,16-17,21,29H,5,8-9,12-15H2,1-3H3/t16-,17+,21+/m0/s1	KYGBGAWZQIYPEA-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K72391864	BRD-K72391864-001-02-2	Broad Institute of MIT and Harvard	BRD-K72391864			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)8-5-9-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10-11,16-17,21,29H,5,8-9,12-15H2,1-3H3/t16-,17+,21+/m0/s1	KYGBGAWZQIYPEA-CSODHUTKSA-N	497.210818064							96422
MLS003129502	LSM-7945	SID99357834, BRD-K85449516	44505537	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18+,22-/m1/s1	QVFRXOMYJDWMPT-KGVIQGDOSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K85449516	BRD-K85449516-001-02-5	Broad Institute of MIT and Harvard	BRD-K85449516			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18+,22-/m1/s1	QVFRXOMYJDWMPT-KGVIQGDOSA-N	509.23080458							96566
BRD-K76964118	LSM-7844		44489269	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22+,26+/m0/s1	HFDOIJULVRDPRU-VVZHRXSXSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K76964118	BRD-K76964118-001-01-8	Broad Institute of MIT and Harvard	BRD-K76964118			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22+,26+/m0/s1	HFDOIJULVRDPRU-VVZHRXSXSA-N	541.337652926							96465
MLS003129525	LSM-8016	BRD-K92125320, SID99357905	44496834	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18-,22+/m1/s1	DMKVVNQLOZTLAB-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K92125320	BRD-K92125320-001-02-8	Broad Institute of MIT and Harvard	BRD-K92125320			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18-,22+/m1/s1	DMKVVNQLOZTLAB-HMFYCAOWSA-N	497.261374598							96637
BRD-K33832590	LSM-7284		44485057	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19+,24-/m0/s1	BWTMYHAPSQQINJ-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K33832590	BRD-K33832590-001-01-6	Broad Institute of MIT and Harvard	BRD-K33832590			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19+,24-/m0/s1	BWTMYHAPSQQINJ-GLDPYIMESA-N	496.279803692							95905
MLS003129516	LSM-7253	BRD-K31045868	44505465	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22+/m1/s1	ZODITPIVHHGZAH-HMFYCAOWSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K31045868	BRD-K31045868-001-02-0	Broad Institute of MIT and Harvard	BRD-K31045868			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22+/m1/s1	ZODITPIVHHGZAH-HMFYCAOWSA-N	488.274718312							95874
BRD-K12957211	LSM-7024		44505020	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28-/m1/s1	PZMMCWSZGDQDET-MVOZIGHISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K12957211	BRD-K12957211-001-01-5	Broad Institute of MIT and Harvard	BRD-K12957211			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28-/m1/s1	PZMMCWSZGDQDET-MVOZIGHISA-N	505.305290158							95645
MLS003129292	LSM-7586	BRD-K55775078	44505608	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21+/m0/s1	HYHIJLYQTCYSKX-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K55775078	BRD-K55775078-001-02-9	Broad Institute of MIT and Harvard	BRD-K55775078			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21+/m0/s1	HYHIJLYQTCYSKX-WAOWUJCRSA-N	458.264153628							96207
BRD-K59578981	LSM-7637		44506048	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	QSHHTQCGWZKCKD-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K59578981	BRD-K59578981-001-01-1	Broad Institute of MIT and Harvard	BRD-K59578981			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	QSHHTQCGWZKCKD-DBXWQHBBSA-N	430.269239008							96258
BRD-K10580927	LSM-6989		44505983	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,20-/m0/s1	NSEOCVGIAYKUAZ-QKLQHJQFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K10580927	BRD-K10580927-001-01-2	Broad Institute of MIT and Harvard	BRD-K10580927			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,20-/m0/s1	NSEOCVGIAYKUAZ-QKLQHJQFSA-N	444.248503564							95610
BRD-K11582139	LSM-6997		44505474	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18+,21+/m0/s1	QSHHTQCGWZKCKD-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K11582139	BRD-K11582139-001-01-1	Broad Institute of MIT and Harvard	BRD-K11582139			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18+,21+/m0/s1	QSHHTQCGWZKCKD-WAOWUJCRSA-N	430.269239008							95618
MLS003129123	LSM-7618	BRD-K57873755, SID99357465	44490872	InChI=1S/C24H36N6O5/c1-17-13-29(18(2)15-31)23(32)10-7-11-30-19(12-25-27-30)16-35-22(17)14-28(3)24(33)26-20-8-5-6-9-21(20)34-4/h5-6,8-9,12,17-18,22,31H,7,10-11,13-16H2,1-4H3,(H,26,33)/t17-,18-,22+/m1/s1	LJFLDXJAOYTNMN-HMFYCAOWSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K57873755	BRD-K57873755-001-02-0	Broad Institute of MIT and Harvard	BRD-K57873755			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H36N6O5/c1-17-13-29(18(2)15-31)23(32)10-7-11-30-19(12-25-27-30)16-35-22(17)14-28(3)24(33)26-20-8-5-6-9-21(20)34-4/h5-6,8-9,12,17-18,22,31H,7,10-11,13-16H2,1-4H3,(H,26,33)/t17-,18-,22+/m1/s1	LJFLDXJAOYTNMN-HMFYCAOWSA-N	488.274718312							96239
MLS003129721	LSM-7639	SID99358164, BRD-K59870400	44485055	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19-,24+/m1/s1	XYWPMUCHOREPKK-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K59870400	BRD-K59870400-001-02-3	Broad Institute of MIT and Harvard	BRD-K59870400			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19-,24+/m1/s1	XYWPMUCHOREPKK-IECBHUPTSA-N	510.259068248							96260
BRD-K27675859	LSM-7197		44505841	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21-/m0/s1	QOPMKJNNAFOQDN-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K27675859	BRD-K27675859-001-01-3	Broad Institute of MIT and Harvard	BRD-K27675859			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21-/m0/s1	QOPMKJNNAFOQDN-FVJLSDCUSA-N	526.251538196							95818
SCHEMBL17487108	LSM-7317	BRD-K36718717	44488700	InChI=1S/C20H36N6O4/c1-14(2)21-20(29)24(5)11-18-15(3)9-26(16(4)12-27)19(28)7-6-8-25-10-17(13-30-18)22-23-25/h10,14-16,18,27H,6-9,11-13H2,1-5H3,(H,21,29)/t15-,16-,18-/m0/s1	UNRRBHFUILMFRI-BQFCYCMXSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K36718717	BRD-K36718717-001-01-2	Broad Institute of MIT and Harvard	BRD-K36718717			CC(C)NC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C20H36N6O4/c1-14(2)21-20(29)24(5)11-18-15(3)9-26(16(4)12-27)19(28)7-6-8-25-10-17(13-30-18)22-23-25/h10,14-16,18,27H,6-9,11-13H2,1-5H3,(H,21,29)/t15-,16-,18-/m0/s1	UNRRBHFUILMFRI-BQFCYCMXSA-N	424.279803692							95938
BRD-K09926293	LSM-6980		44496405	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22+/m0/s1	YNSZNIPNNMZZOV-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K09926293	BRD-K09926293-001-01-6	Broad Institute of MIT and Harvard	BRD-K09926293			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22+/m0/s1	YNSZNIPNNMZZOV-NJNPRVFISA-N	445.26890465							95601
MLS003129387	LSM-7396	BRD-K43145106, SID99357690	44493064	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21-/m0/s1	XRXVGTRBMNTJPS-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K43145106	BRD-K43145106-001-02-6	Broad Institute of MIT and Harvard	BRD-K43145106			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21-/m0/s1	XRXVGTRBMNTJPS-FVJLSDCUSA-N	513.181267574							96017
BRD-K62771544	LSM-7687		44491447	InChI=1S/C22H33N5O5S/c1-17-12-27(18(2)15-28)22(29)10-7-11-26-13-19(23-24-26)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,28H,7,10-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	BDEMCWTZQNVVEU-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K62771544	BRD-K62771544-001-01-7	Broad Institute of MIT and Harvard	BRD-K62771544			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H33N5O5S/c1-17-12-27(18(2)15-28)22(29)10-7-11-26-13-19(23-24-26)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,28H,7,10-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	BDEMCWTZQNVVEU-DBXWQHBBSA-N	479.220239896							96308
MLS003129464	LSM-7528	BRD-K52540534	44484528	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20+,25+/m1/s1	XVJRXGRWNAMAGP-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K52540534	BRD-K52540534-001-02-8	Broad Institute of MIT and Harvard	BRD-K52540534			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20+,25+/m1/s1	XVJRXGRWNAMAGP-RNHFSVANSA-N	508.279803692							96149
MLS003129380	LSM-6911	BRD-K03817886	44486954	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22+,26+/m0/s1	OIASBGFOQSUHIL-VVZHRXSXSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K03817886	BRD-K03817886-001-02-4	Broad Institute of MIT and Harvard	BRD-K03817886			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22+,26+/m0/s1	OIASBGFOQSUHIL-VVZHRXSXSA-N	541.337652926							95532
BRD-K29279625	LSM-7224		44484536	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20-,24-/m1/s1	ATOJIXFYNQCGDG-YOSAUDMPSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K29279625	BRD-K29279625-001-01-5	Broad Institute of MIT and Harvard	BRD-K29279625			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20-,24-/m1/s1	ATOJIXFYNQCGDG-YOSAUDMPSA-N	501.295119398							95845
BRD-K93061442	LSM-8037		44494084	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22-/m0/s1	QAXWADXATYBNKX-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K93061442	BRD-K93061442-001-01-9	Broad Institute of MIT and Harvard	BRD-K93061442			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22-/m0/s1	QAXWADXATYBNKX-SVMVAKDDSA-N	497.261374598							96658
BRD-K29335396	LSM-7226		44483907	InChI=1S/C22H33N5O5S/c1-17-12-27(18(2)15-28)22(29)10-7-11-26-13-19(23-24-26)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,28H,7,10-12,14-16H2,1-3H3/t17-,18+,21-/m0/s1	BDEMCWTZQNVVEU-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K29335396	BRD-K29335396-001-01-2	Broad Institute of MIT and Harvard	BRD-K29335396			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H33N5O5S/c1-17-12-27(18(2)15-28)22(29)10-7-11-26-13-19(23-24-26)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,28H,7,10-12,14-16H2,1-3H3/t17-,18+,21-/m0/s1	BDEMCWTZQNVVEU-UEXGIBASSA-N	479.220239896							95847
MLS003129247	LSM-7830	BRD-K75755028, SID99357444	44505387	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19-,24+/m1/s1	DZRIWTKXHLXUTO-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K75755028	BRD-K75755028-001-02-8	Broad Institute of MIT and Harvard	BRD-K75755028			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19-,24+/m1/s1	DZRIWTKXHLXUTO-IECBHUPTSA-N	510.259068248							96451
MLS003129547	LSM-7357	BRD-K39963927	44505575	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20-,25+/m1/s1	PZGTZQIYRXDXGV-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K39963927	BRD-K39963927-001-02-5	Broad Institute of MIT and Harvard	BRD-K39963927			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20-,25+/m1/s1	PZGTZQIYRXDXGV-FHAGJXEFSA-N	509.26381927							95978
MLS003129303	LSM-7134	BRD-K21991827	44506038	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18+,23+/m1/s1	BKRQCUCZQROLSQ-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K21991827	BRD-K21991827-001-02-7	Broad Institute of MIT and Harvard	BRD-K21991827			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18+,23+/m1/s1	BKRQCUCZQROLSQ-STSQHVNTSA-N	516.269632932							95755
BRD-K08460070	LSM-6965		44504925	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22-/m1/s1	DGDOMSZWPVXBGZ-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K08460070	BRD-K08460070-001-01-6	Broad Institute of MIT and Harvard	BRD-K08460070			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22-/m1/s1	DGDOMSZWPVXBGZ-WOIUINJBSA-N	493.23588996							95586
MLS003129104	LSM-6922	BRD-K04749191	44486960	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21+,25+/m1/s1	WYPGSQIBOYUSAK-CZSZKKDXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K04749191	BRD-K04749191-001-02-8	Broad Institute of MIT and Harvard	BRD-K04749191			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21+,25+/m1/s1	WYPGSQIBOYUSAK-CZSZKKDXSA-N	551.285617354							95543
MLS003129243	LSM-6951	BRD-K07417570	44505210	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23+/m0/s1	GOEWTOAFXZXQCM-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K07417570	BRD-K07417570-001-02-0	Broad Institute of MIT and Harvard	BRD-K07417570			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23+/m0/s1	GOEWTOAFXZXQCM-YZZKKUAISA-N	473.26381927							95572
MLS003129246	LSM-7128	BRD-K21153751	44505142	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18-,21-/m1/s1	QLGFDRXFQQZFKX-DBXWQHBBSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K21153751	BRD-K21153751-001-02-4	Broad Institute of MIT and Harvard	BRD-K21153751			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18-,21-/m1/s1	QLGFDRXFQQZFKX-DBXWQHBBSA-N	509.23080458							95749
MLS003129923	LSM-7002	BRD-K12057275	44505035	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)9-6-10-29-22(17-32-23)12-25-26-29/h5,7-8,11-12,19-20,23,30H,6,9-10,13-17H2,1-4H3/t19-,20-,23+/m1/s1	JFBDPIUUNLHCPK-VIZSFHNOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K12057275	BRD-K12057275-001-02-5	Broad Institute of MIT and Harvard	BRD-K12057275			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)9-6-10-29-22(17-32-23)12-25-26-29/h5,7-8,11-12,19-20,23,30H,6,9-10,13-17H2,1-4H3/t19-,20-,23+/m1/s1	JFBDPIUUNLHCPK-VIZSFHNOSA-N	443.289640094							95623
MLS003129761	LSM-7691	SID99358199, BRD-K62980388	44505363	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)9-6-10-28-20(16-33-22)12-24-25-28/h5,7-8,11-12,18-19,22,29H,6,9-10,13-16H2,1-4H3/t18-,19+,22-/m1/s1	GSLUEEWCAUTOBV-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K62980388	BRD-K62980388-001-02-1	Broad Institute of MIT and Harvard	BRD-K62980388			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)9-6-10-28-20(16-33-22)12-24-25-28/h5,7-8,11-12,18-19,22,29H,6,9-10,13-16H2,1-4H3/t18-,19+,22-/m1/s1	GSLUEEWCAUTOBV-XQBPLPMBSA-N	493.23588996							96312
MLS003129244	LSM-7100	BRD-K19471718	44488699	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17+,22+/m0/s1	DEGZSTUNWMGQCY-GSHUGGBRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K19471718	BRD-K19471718-001-02-6	Broad Institute of MIT and Harvard	BRD-K19471718			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17+,22+/m0/s1	DEGZSTUNWMGQCY-GSHUGGBRSA-N	502.253982868							95721
MLS003129576	LSM-7158	BRD-K23620459	44495431	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21+/m0/s1	XRXVGTRBMNTJPS-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K23620459	BRD-K23620459-001-02-5	Broad Institute of MIT and Harvard	BRD-K23620459			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21+/m0/s1	XRXVGTRBMNTJPS-CSODHUTKSA-N	513.181267574							95779
BRD-K13207999	LSM-7028		44486955	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19-,24-/m1/s1	XYWPMUCHOREPKK-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K13207999	BRD-K13207999-001-01-2	Broad Institute of MIT and Harvard	BRD-K13207999			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19-,24-/m1/s1	XYWPMUCHOREPKK-KHCICDEESA-N	510.259068248							95649
MLS003130340	LSM-7987	BRD-K88872152	44488697	InChI=1S/C28H44N8O4/c1-21-17-35(22(2)19-37)27(38)6-5-11-36-25(16-29-31-36)20-40-26(21)18-33(4)28(39)30-23-7-9-24(10-8-23)34-14-12-32(3)13-15-34/h7-10,16,21-22,26,37H,5-6,11-15,17-20H2,1-4H3,(H,30,39)/t21-,22+,26+/m1/s1	LMWGPKORGYIWNW-UFPGJGBJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K88872152	BRD-K88872152-001-02-4	Broad Institute of MIT and Harvard	BRD-K88872152			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H44N8O4/c1-21-17-35(22(2)19-37)27(38)6-5-11-36-25(16-29-31-36)20-40-26(21)18-33(4)28(39)30-23-7-9-24(10-8-23)34-14-12-32(3)13-15-34/h7-10,16,21-22,26,37H,5-6,11-15,17-20H2,1-4H3,(H,30,39)/t21-,22+,26+/m1/s1	LMWGPKORGYIWNW-UFPGJGBJSA-N	556.348551968							96608
MLS003129436	LSM-7074	SID99357779, BRD-K17266676	44505189	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24+/m1/s1	KMYKLRXROVKHNJ-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K17266676	BRD-K17266676-001-02-2	Broad Institute of MIT and Harvard	BRD-K17266676			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24+/m1/s1	KMYKLRXROVKHNJ-IECBHUPTSA-N	496.279803692							95695
MLS003130348	LSM-7729	BRD-K66035321	44485060	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19+,22+/m1/s1	GMDADKPJAYHJFG-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K66035321	BRD-K66035321-001-02-0	Broad Institute of MIT and Harvard	BRD-K66035321			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19+,22+/m1/s1	GMDADKPJAYHJFG-DXIQSLLYSA-N	457.26890465							96350
BRD-K66809950	LSM-7740		44504919	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)6-5-11-28-20(16-33-22)12-24-25-28/h7-10,12,18-19,22,29H,5-6,11,13-16H2,1-4H3/t18-,19+,22+/m0/s1	PBQVTRJHSYIUGU-NNMXDRDESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K66809950	BRD-K66809950-001-01-8	Broad Institute of MIT and Harvard	BRD-K66809950			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)6-5-11-28-20(16-33-22)12-24-25-28/h7-10,12,18-19,22,29H,5-6,11,13-16H2,1-4H3/t18-,19+,22+/m0/s1	PBQVTRJHSYIUGU-NNMXDRDESA-N	493.23588996							96361
BRD-K37563991	LSM-7333		44486355	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21-,25-/m0/s1	WYPGSQIBOYUSAK-WATLYSKOSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K37563991	BRD-K37563991-001-01-8	Broad Institute of MIT and Harvard	BRD-K37563991			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21-,25-/m0/s1	WYPGSQIBOYUSAK-WATLYSKOSA-N	551.285617354							95954
MLS003129491	LSM-7378	BRD-K41880142, SID99357824	44505163	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18+,22+/m0/s1	IZYFSJYDPLTURU-NJNPRVFISA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K41880142	BRD-K41880142-001-02-6	Broad Institute of MIT and Harvard	BRD-K41880142			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18+,22+/m0/s1	IZYFSJYDPLTURU-NJNPRVFISA-N	509.23080458							95999
MLS003129404	LSM-7210	BRD-K28185108	44505896	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19-,23+/m1/s1	GEARZFJDEYGDIT-PWHSHALESA-N	COc1cccc(CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)c1	BroadT	BRD-K28185108	BRD-K28185108-001-02-9	Broad Institute of MIT and Harvard	BRD-K28185108			COc1cccc(CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)c1	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19-,23+/m1/s1	GEARZFJDEYGDIT-PWHSHALESA-N	459.284554714							95831
MLS003129409	LSM-7060	BRD-K15713006, SID99357709	44505818	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m0/s1	DVUZCPZOEGBIKA-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K15713006	BRD-K15713006-001-02-6	Broad Institute of MIT and Harvard	BRD-K15713006			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m0/s1	DVUZCPZOEGBIKA-XGHQBKJUSA-N	526.251538196							95681
MLS003130251	LSM-7018	BRD-K12682252, SID99359041	44505424	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20-,23-/m1/s1	RIHXBZGHHXCGPP-TXTKFYIRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K12682252	BRD-K12682252-001-02-7	Broad Institute of MIT and Harvard	BRD-K12682252			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20-,23-/m1/s1	RIHXBZGHHXCGPP-TXTKFYIRSA-N	544.31216646							95639
BRD-K58377762	LSM-7624		44488690	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19-,24-/m1/s1	BWTMYHAPSQQINJ-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K58377762	BRD-K58377762-001-01-4	Broad Institute of MIT and Harvard	BRD-K58377762			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19-,24-/m1/s1	BWTMYHAPSQQINJ-KHCICDEESA-N	496.279803692							96245
BRD-K42737417	LSM-7392		44488685	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26-/m0/s1	OIASBGFOQSUHIL-MCEYFSPLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K42737417	BRD-K42737417-001-01-7	Broad Institute of MIT and Harvard	BRD-K42737417			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26-/m0/s1	OIASBGFOQSUHIL-MCEYFSPLSA-N	541.337652926							96013
BRD-K58034811	LSM-7621		44484516	InChI=1S/C23H33N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	KNHKBBCFGVHHOP-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K58034811	BRD-K58034811-001-01-2	Broad Institute of MIT and Harvard	BRD-K58034811			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	KNHKBBCFGVHHOP-DBXWQHBBSA-N	443.253254586							96242
BRD-K01008530	LSM-6870		44489265	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15+,17-/m1/s1	CMMUKIKJYLMGMW-HLLBOEOZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K01008530	BRD-K01008530-001-01-4	Broad Institute of MIT and Harvard	BRD-K01008530			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15+,17-/m1/s1	CMMUKIKJYLMGMW-HLLBOEOZSA-N	463.240639154							95491
MLS003129526	LSM-7312	BRD-K36217065	44505053	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19+,23+/m0/s1	GEARZFJDEYGDIT-YCRNBWNJSA-N	COc1cccc(CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)c1	BroadT	BRD-K36217065	BRD-K36217065-001-02-1	Broad Institute of MIT and Harvard	BRD-K36217065			COc1cccc(CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)c1	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19+,23+/m0/s1	GEARZFJDEYGDIT-YCRNBWNJSA-N	459.284554714							95933
MLS003129548	LSM-7246	BRD-K30653168, SID99357923	44505961	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16+/m0/s1	PUHFBKBPROGAIN-OFQRWUPVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K30653168	BRD-K30653168-001-02-9	Broad Institute of MIT and Harvard	BRD-K30653168			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16+/m0/s1	PUHFBKBPROGAIN-OFQRWUPVSA-N	417.204589832							95867
SCHEMBL17487103	LSM-7529	BRD-K52574175	44488691	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19-,24-/m0/s1	BWTMYHAPSQQINJ-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K52574175	BRD-K52574175-001-01-3	Broad Institute of MIT and Harvard	BRD-K52574175			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19-,24-/m0/s1	BWTMYHAPSQQINJ-JXQFQVJHSA-N	496.279803692							96150
BRD-K22033912	LSM-7135		44485076	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15+,19-/m0/s1	ZMFVFBQYBHAIKE-KHYOSLBOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K22033912	BRD-K22033912-001-01-5	Broad Institute of MIT and Harvard	BRD-K22033912			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15+,19-/m0/s1	ZMFVFBQYBHAIKE-KHYOSLBOSA-N	477.26996729							95756
MLS003129255	LSM-7454	BRD-K47380281, SID121282475	44485746	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19-,24+/m1/s1	BWTMYHAPSQQINJ-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K47380281	BRD-K47380281-001-02-2	Broad Institute of MIT and Harvard	BRD-K47380281			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19-,24+/m1/s1	BWTMYHAPSQQINJ-IECBHUPTSA-N	496.279803692							96075
MLS003129708	LSM-7696	BRD-K63473855	44505862	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18+,23+/m0/s1	BKRQCUCZQROLSQ-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K63473855	BRD-K63473855-001-02-0	Broad Institute of MIT and Harvard	BRD-K63473855			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18+,23+/m0/s1	BKRQCUCZQROLSQ-YZZKKUAISA-N	516.269632932							96317
BRD-K58134288	LSM-7623		44505250	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19+,23+/m1/s1	RQWMQWHENJCHFR-MSYCTHLASA-N	COc1cccc(CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)c1	BroadT	BRD-K58134288	BRD-K58134288-001-01-4	Broad Institute of MIT and Harvard	BRD-K58134288			COc1cccc(CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)c1	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19+,23+/m1/s1	RQWMQWHENJCHFR-MSYCTHLASA-N	459.284554714							96244
BRD-K20013327	LSM-7111		44485069	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17+,22-/m0/s1	DEGZSTUNWMGQCY-JKSBSHDWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K20013327	BRD-K20013327-001-01-8	Broad Institute of MIT and Harvard	BRD-K20013327			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17+,22-/m0/s1	DEGZSTUNWMGQCY-JKSBSHDWSA-N	502.253982868							95732
MLS003129650	LSM-7043	BRD-K14214369, SID99358052	44505636	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17-,22+/m1/s1	FSJQCDSATLDVBC-YVHKJVDXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K14214369	BRD-K14214369-001-02-7	Broad Institute of MIT and Harvard	BRD-K14214369			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17-,22+/m1/s1	FSJQCDSATLDVBC-YVHKJVDXSA-N	497.196045386							95664
BRD-K02724364	LSM-6896		44505164	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18+,22-/m1/s1	RLIRIECCVMDDQV-KGVIQGDOSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K02724364	BRD-K02724364-001-01-6	Broad Institute of MIT and Harvard	BRD-K02724364			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18+,22-/m1/s1	RLIRIECCVMDDQV-KGVIQGDOSA-N	509.23080458							95517
BRD-K58747666	LSM-7626		44505759	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17+,19-/m0/s1	UOJDQXZVAPFQKD-SCTDSRPQSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K58747666	BRD-K58747666-001-01-5	Broad Institute of MIT and Harvard	BRD-K58747666			CC(C)COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17+,19-/m0/s1	UOJDQXZVAPFQKD-SCTDSRPQSA-N	439.279469334							96247
MLS003129544	LSM-7425	SID99357919, BRD-K45656768	44505750	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24+/m0/s1	KMYKLRXROVKHNJ-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K45656768	BRD-K45656768-001-02-9	Broad Institute of MIT and Harvard	BRD-K45656768			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24+/m0/s1	KMYKLRXROVKHNJ-XLNZFTOWSA-N	496.279803692							96046
BRD-K51740186	LSM-7513		44484523	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22-/m1/s1	VOGIWUFDXLFNKS-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K51740186	BRD-K51740186-001-01-8	Broad Institute of MIT and Harvard	BRD-K51740186			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22-/m1/s1	VOGIWUFDXLFNKS-XQBPLPMBSA-N	473.26381927							96134
BRD-K39245862	LSM-7351		44486969	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20-,25-/m1/s1	XVJRXGRWNAMAGP-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K39245862	BRD-K39245862-001-01-6	Broad Institute of MIT and Harvard	BRD-K39245862			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20-,25-/m1/s1	XVJRXGRWNAMAGP-UMEGOILYSA-N	508.279803692							95972
MLS003130231	LSM-6976	BRD-K09407750, SID99359024	44505480	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18+,22+/m0/s1	QPXXSBPXMIWUTR-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K09407750	BRD-K09407750-001-02-1	Broad Institute of MIT and Harvard	BRD-K09407750			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18+,22+/m0/s1	QPXXSBPXMIWUTR-NJNPRVFISA-N	445.26890465							95597
BRD-K62875000	LSM-7689		44504973	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,20-/m1/s1	NSEOCVGIAYKUAZ-FUHIMQAGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K62875000	BRD-K62875000-001-01-3	Broad Institute of MIT and Harvard	BRD-K62875000			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,20-/m1/s1	NSEOCVGIAYKUAZ-FUHIMQAGSA-N	444.248503564							96310
BRD-K40099330	LSM-7359		44505139	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22-/m1/s1	AWVASGRLDZTAAI-JBYIUTFZSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K40099330	BRD-K40099330-001-01-8	Broad Institute of MIT and Harvard	BRD-K40099330			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22-/m1/s1	AWVASGRLDZTAAI-JBYIUTFZSA-N	509.23080458							95980
BRD-K94643104-001-01-2	LSM-8058	BRD-K94643104	44495968	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20-,25+/m1/s1	OKVDUKBBVHEMKE-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K94643104	BRD-K94643104-001-02-0	Broad Institute of MIT and Harvard	BRD-K94643104			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20-,25+/m1/s1	OKVDUKBBVHEMKE-FHAGJXEFSA-N	500.31110382							96679
BRD-K66363099	LSM-7734		44495439	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18-,21-/m0/s1	NJZPXWDDBMYIMJ-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K66363099	BRD-K66363099-001-01-8	Broad Institute of MIT and Harvard	BRD-K66363099			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18-,21-/m0/s1	NJZPXWDDBMYIMJ-WFXMLNOXSA-N	430.269239008							96355
MLS003129906	LSM-7031	BRD-K13614235	44505861	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22+/m1/s1	YYALKDZNPSDWDC-FGSXEWAUSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)c1	BroadT	BRD-K13614235	BRD-K13614235-001-02-1	Broad Institute of MIT and Harvard	BRD-K13614235			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)c1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22+/m1/s1	YYALKDZNPSDWDC-FGSXEWAUSA-N	488.274718312							95652
MLS003129890	LSM-7910	BRD-K81858438, SID99358392	44505902	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18-,22+/m1/s1	QZCZRKJJOTUXQW-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K81858438	BRD-K81858438-001-02-6	Broad Institute of MIT and Harvard	BRD-K81858438			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18-,22+/m1/s1	QZCZRKJJOTUXQW-HMFYCAOWSA-N	497.261374598							96531
MLS003129893	LSM-6978	BRD-K09757845	44489280	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19+,23+/m0/s1	QHTRHHVBBSPOHC-YCRNBWNJSA-N	COc1ccccc1CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K09757845	BRD-K09757845-001-02-6	Broad Institute of MIT and Harvard	BRD-K09757845			COc1ccccc1CN(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19+,23+/m0/s1	QHTRHHVBBSPOHC-YCRNBWNJSA-N	459.284554714							95599
BRD-K65837806	LSM-7727		44505398	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20+,25-/m0/s1	SUQKGVARFDJMIR-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K65837806	BRD-K65837806-001-01-6	Broad Institute of MIT and Harvard	BRD-K65837806			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20+,25-/m0/s1	SUQKGVARFDJMIR-DFIYOIEZSA-N	509.26381927							96348
BRD-K00913793	LSM-6869		44491450	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15-,17-/m1/s1	CMMUKIKJYLMGMW-BFYDXBDKSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K00913793	BRD-K00913793-001-01-8	Broad Institute of MIT and Harvard	BRD-K00913793			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15-,17-/m1/s1	CMMUKIKJYLMGMW-BFYDXBDKSA-N	463.240639154							95490
MLS003129431	LSM-8038	SID99357777, BRD-K93104606	44497719	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)6-5-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-9-22(32-4)10-8-20/h7-10,12,18-19,23,30H,5-6,11,13-17H2,1-4H3/t18-,19+,23+/m0/s1	VZSMXRDPAZDIAR-YCRNBWNJSA-N	COc1ccc(CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K93104606	BRD-K93104606-001-02-7	Broad Institute of MIT and Harvard	BRD-K93104606			COc1ccc(CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)6-5-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-9-22(32-4)10-8-20/h7-10,12,18-19,23,30H,5-6,11,13-17H2,1-4H3/t18-,19+,23+/m0/s1	VZSMXRDPAZDIAR-YCRNBWNJSA-N	459.284554714							96659
BRD-K55025062	LSM-7572		44486964	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22-/m1/s1	VOGIWUFDXLFNKS-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K55025062	BRD-K55025062-001-01-9	Broad Institute of MIT and Harvard	BRD-K55025062			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22-/m1/s1	VOGIWUFDXLFNKS-WOIUINJBSA-N	473.26381927							96193
BRD-K57987292	LSM-7620		44504990	InChI=1S/C23H33N5O5/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-19(24-25-27)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18+,21-/m0/s1	NWYXEXAEFWIOJN-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K57987292	BRD-K57987292-001-01-0	Broad Institute of MIT and Harvard	BRD-K57987292			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33N5O5/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-19(24-25-27)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18+,21-/m0/s1	NWYXEXAEFWIOJN-UEXGIBASSA-N	459.248169206							96241
BRD-K52199185	LSM-7523		44505073	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13-,15-/m0/s1	FOLOUAULJSJVDY-YDHLFZDLSA-N	CNC[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K52199185	BRD-K52199185-001-01-7	Broad Institute of MIT and Harvard	BRD-K52199185			CNC[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13-,15-/m0/s1	FOLOUAULJSJVDY-YDHLFZDLSA-N	339.227039838							96144
MLS003129316	LSM-7064	BRD-K15912359	51358831	InChI=1S/C28H44N8O4/c1-21-16-36(22(2)19-37)27(38)6-5-11-35-17-24(30-31-35)20-40-26(21)18-33(4)28(39)29-23-7-9-25(10-8-23)34-14-12-32(3)13-15-34/h7-10,17,21-22,26,37H,5-6,11-16,18-20H2,1-4H3,(H,29,39)/t21-,22+,26+/m1/s1	AFGWKCDRVGDDFW-UFPGJGBJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K15912359	BRD-K15912359-001-02-7	Broad Institute of MIT and Harvard	BRD-K15912359			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H44N8O4/c1-21-16-36(22(2)19-37)27(38)6-5-11-35-17-24(30-31-35)20-40-26(21)18-33(4)28(39)29-23-7-9-25(10-8-23)34-14-12-32(3)13-15-34/h7-10,17,21-22,26,37H,5-6,11-16,18-20H2,1-4H3,(H,29,39)/t21-,22+,26+/m1/s1	AFGWKCDRVGDDFW-UFPGJGBJSA-N	556.348551968							95685
BRD-K02612980	LSM-6894		44494079	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18+,21-/m1/s1	QXBLKCOAOVMUQM-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K02612980	BRD-K02612980-001-01-7	Broad Institute of MIT and Harvard	BRD-K02612980			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18+,21-/m1/s1	QXBLKCOAOVMUQM-LVCYWYKZSA-N	430.269239008							95515
BRD-K42800143	LSM-7393		44495438	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18+,21-/m0/s1	NJZPXWDDBMYIMJ-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K42800143	BRD-K42800143-001-01-4	Broad Institute of MIT and Harvard	BRD-K42800143			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18+,21-/m0/s1	NJZPXWDDBMYIMJ-UEXGIBASSA-N	430.269239008							96014
SCHEMBL17487104	LSM-7726	BRD-K65790118	44486951	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19-,24-/m0/s1	XYWPMUCHOREPKK-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K65790118	BRD-K65790118-001-01-0	Broad Institute of MIT and Harvard	BRD-K65790118			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19-,24-/m0/s1	XYWPMUCHOREPKK-JXQFQVJHSA-N	510.259068248							96347
BRD-K31569005	LSM-7259		44483910	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21-/m0/s1	DTQFALQSFDATTM-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K31569005	BRD-K31569005-001-01-5	Broad Institute of MIT and Harvard	BRD-K31569005			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21-/m0/s1	DTQFALQSFDATTM-FVJLSDCUSA-N	526.251538196							95880
BRD-K15505145	LSM-7056		44485749	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21-,25-/m1/s1	WYPGSQIBOYUSAK-DNRQZRRGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K15505145	BRD-K15505145-001-01-0	Broad Institute of MIT and Harvard	BRD-K15505145			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21-,25-/m1/s1	WYPGSQIBOYUSAK-DNRQZRRGSA-N	551.285617354							95677
MLS003129537	LSM-7547	BRD-K53839527, SID99357915	44505415	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23-/m0/s1	RIHXBZGHHXCGPP-MZKRTTBSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K53839527	BRD-K53839527-001-02-2	Broad Institute of MIT and Harvard	BRD-K53839527			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23-/m0/s1	RIHXBZGHHXCGPP-MZKRTTBSSA-N	544.31216646							96168
BRD-K86390887	LSM-7952		44504934	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22-/m0/s1	AWVASGRLDZTAAI-SVMVAKDDSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K86390887	BRD-K86390887-001-01-3	Broad Institute of MIT and Harvard	BRD-K86390887			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22-/m0/s1	AWVASGRLDZTAAI-SVMVAKDDSA-N	509.23080458							96573
BRD-K37487131	LSM-7330		44504999	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22-/m0/s1	IKCPXJXAZOQLMC-SVMVAKDDSA-N	COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)cc1	BroadT	BRD-K37487131	BRD-K37487131-001-01-1	Broad Institute of MIT and Harvard	BRD-K37487131			COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)cc1	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22-/m0/s1	IKCPXJXAZOQLMC-SVMVAKDDSA-N	489.25873389							95951
BRD-K43792870	LSM-7403		44486372	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20+,24+/m1/s1	ATOJIXFYNQCGDG-NMMYMHLASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K43792870	BRD-K43792870-001-01-1	Broad Institute of MIT and Harvard	BRD-K43792870			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20+,24+/m1/s1	ATOJIXFYNQCGDG-NMMYMHLASA-N	501.295119398							96024
MLS003130228	LSM-7896	BRD-K80112796	44505860	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22+/m0/s1	ZODITPIVHHGZAH-NJNPRVFISA-N	COc1ccccc1NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K80112796	BRD-K80112796-001-02-5	Broad Institute of MIT and Harvard	BRD-K80112796			COc1ccccc1NC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22+/m0/s1	ZODITPIVHHGZAH-NJNPRVFISA-N	488.274718312							96517
BRD-K54071713-001-01-7	LSM-21976	BRD-K54071713	44489809	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)9-6-10-29-12-18(26-27-29)15-34-21(16)13-28(3)23(33)25-20-8-5-4-7-19(20)24/h4-5,7-8,12,16-17,21,31H,6,9-11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21-/m0/s1	UGDLKAPALXLDHQ-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K54071713	BRD-K54071713-001-01-7	Broad Institute of MIT and Harvard	BRD-K54071713			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)9-6-10-29-12-18(26-27-29)15-34-21(16)13-28(3)23(33)25-20-8-5-4-7-19(20)24/h4-5,7-8,12,16-17,21,31H,6,9-11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21-/m0/s1	UGDLKAPALXLDHQ-FVJLSDCUSA-N	476.254731796							110529
MLS003129424	LSM-7772	BRD-K69343050, SID99357771	44505534	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19+,21+/m1/s1	PKTOTAWSKYPRKJ-DYXWJJEUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K69343050	BRD-K69343050-001-02-2	Broad Institute of MIT and Harvard	BRD-K69343050			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19+,21+/m1/s1	PKTOTAWSKYPRKJ-DYXWJJEUSA-N	493.23588996							96393
BRD-K09300252-001-01-3	LSM-6975	BRD-K09300252	44505946	InChI=1S/C28H37N5O6S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-23(16-29-30-33)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22+,27-/m0/s1	QEXGJGRYUGYWJV-XXAUWVGASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K09300252	BRD-K09300252-001-02-1	Broad Institute of MIT and Harvard	BRD-K09300252			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N5O6S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-23(16-29-30-33)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22+,27-/m0/s1	QEXGJGRYUGYWJV-XXAUWVGASA-N	571.246454644							95596
MLS003129271	LSM-7521	BRD-K52117630, SID99357535	44505326	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19-,21+/m1/s1	PKTOTAWSKYPRKJ-SBHAEUEKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K52117630	BRD-K52117630-001-02-8	Broad Institute of MIT and Harvard	BRD-K52117630			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19-,21+/m1/s1	PKTOTAWSKYPRKJ-SBHAEUEKSA-N	493.23588996							96142
BRD-K33407589	LSM-7276		44505259	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20+,23+/m0/s1	XSAFYGBYABXFOO-MIZPHKNDSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K33407589	BRD-K33407589-001-01-0	Broad Institute of MIT and Harvard	BRD-K33407589			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20+,23+/m0/s1	XSAFYGBYABXFOO-MIZPHKNDSA-N	443.289640094							95897
BRD-K47156219	LSM-7449		44495443	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22-/m1/s1	QAXWADXATYBNKX-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K47156219	BRD-K47156219-001-01-5	Broad Institute of MIT and Harvard	BRD-K47156219			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22-/m1/s1	QAXWADXATYBNKX-KGVIQGDOSA-N	497.261374598							96070
BRD-K45231869	LSM-7419		44496832	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18-,21+/m1/s1	QXBLKCOAOVMUQM-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K45231869	BRD-K45231869-001-01-1	Broad Institute of MIT and Harvard	BRD-K45231869			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18-,21+/m1/s1	QXBLKCOAOVMUQM-OPYAIIAOSA-N	430.269239008							96040
MLS003129301	LSM-7515	BRD-K51762600, SID99357562	44505038	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18+,22+/m0/s1	DXNYPMFBKGSJNE-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K51762600	BRD-K51762600-001-02-8	Broad Institute of MIT and Harvard	BRD-K51762600			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18+,22+/m0/s1	DXNYPMFBKGSJNE-NJNPRVFISA-N	497.261374598							96136
MLS003129663	LSM-7167	BRD-K25050358	44492573	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21+/m1/s1	FLBHXJCYMARYBO-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K25050358	BRD-K25050358-001-02-5	Broad Institute of MIT and Harvard	BRD-K25050358			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21+/m1/s1	FLBHXJCYMARYBO-LZJOCLMNSA-N	513.181267574							95788
MLS003129654	LSM-7850	BRD-K77229048, SID99358055	44498543	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22+/m1/s1	MESWQEBVROHANN-KNKQGSTJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K77229048	BRD-K77229048-001-02-8	Broad Institute of MIT and Harvard	BRD-K77229048			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22+/m1/s1	MESWQEBVROHANN-KNKQGSTJSA-N	457.26890465							96471
BRD-K01700755	LSM-6885		44498541	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16-/m0/s1	PUHFBKBPROGAIN-LZWOXQAQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K01700755	BRD-K01700755-001-01-4	Broad Institute of MIT and Harvard	BRD-K01700755			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16-/m0/s1	PUHFBKBPROGAIN-LZWOXQAQSA-N	417.204589832							95506
BRD-K62447749	LSM-7680		44505835	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21-/m1/s1	QOPMKJNNAFOQDN-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K62447749	BRD-K62447749-001-01-7	Broad Institute of MIT and Harvard	BRD-K62447749			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21-/m1/s1	QOPMKJNNAFOQDN-CBGDNZLLSA-N	526.251538196							96301
BRD-K63733272	LSM-7699		44505062	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19-,23-/m0/s1	RQWMQWHENJCHFR-YDHSSHFGSA-N	COc1cccc(CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)c1	BroadT	BRD-K63733272	BRD-K63733272-001-01-4	Broad Institute of MIT and Harvard	BRD-K63733272			COc1cccc(CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)c1	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19-,23-/m0/s1	RQWMQWHENJCHFR-YDHSSHFGSA-N	459.284554714							96320
MLS003129344	LSM-7721	BRD-K65466135, SID99357654	44506046	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28+/m1/s1	YAZCQYURBLEIHO-MRJKTFCFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K65466135	BRD-K65466135-001-02-4	Broad Institute of MIT and Harvard	BRD-K65466135			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28+/m1/s1	YAZCQYURBLEIHO-MRJKTFCFSA-N	505.305290158							96342
MLS003129330	LSM-7587	BRD-K55860636, SID99357588	44504933	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17-,21+/m0/s1	HYLLQKBLPQWSSO-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K55860636	BRD-K55860636-001-02-4	Broad Institute of MIT and Harvard	BRD-K55860636			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17-,21+/m0/s1	HYLLQKBLPQWSSO-XGHQBKJUSA-N	497.210818064							96208
MLS003129153	LSM-7923	BRD-K83437201, SID99357492	44505344	InChI=1S/C22H33N5O5S/c1-17-13-26(18(2)15-28)22(29)10-7-11-27-19(12-23-24-27)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,28H,7,10-11,13-16H2,1-3H3/t17-,18+,21-/m0/s1	YDFSFENEUSKTIZ-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K83437201	BRD-K83437201-001-02-2	Broad Institute of MIT and Harvard	BRD-K83437201			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H33N5O5S/c1-17-13-26(18(2)15-28)22(29)10-7-11-27-19(12-23-24-27)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,28H,7,10-11,13-16H2,1-3H3/t17-,18+,21-/m0/s1	YDFSFENEUSKTIZ-UEXGIBASSA-N	479.220239896							96544
BRD-K45843042	LSM-7432		44505047	InChI=1S/C25H37N5O5/c1-18-13-29(19(2)16-31)25(32)5-4-8-30-21(12-26-27-30)17-35-24(18)15-28(3)14-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11-12,18-19,24,31H,4-5,8-10,13-17H2,1-3H3/t18-,19-,24-/m1/s1	KKGFASYBCNAVFA-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K45843042	BRD-K45843042-001-01-3	Broad Institute of MIT and Harvard	BRD-K45843042			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H37N5O5/c1-18-13-29(19(2)16-31)25(32)5-4-8-30-21(12-26-27-30)17-35-24(18)15-28(3)14-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11-12,18-19,24,31H,4-5,8-10,13-17H2,1-3H3/t18-,19-,24-/m1/s1	KKGFASYBCNAVFA-KHCICDEESA-N	487.279469334							96053
BRD-K94479191-001-01-5	LSM-8055	BRD-K94479191	44489808	InChI=1S/C18H31N5O5/c1-13-8-23(14(2)11-24)17(25)6-5-7-22-9-15(19-20-22)12-28-16(13)10-21(3)18(26)27-4/h9,13-14,16,24H,5-8,10-12H2,1-4H3/t13-,14+,16-/m1/s1	UUDITCQIVHGHRN-IJEWVQPXSA-N	COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K94479191	BRD-K94479191-001-01-5	Broad Institute of MIT and Harvard	BRD-K94479191			COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C18H31N5O5/c1-13-8-23(14(2)11-24)17(25)6-5-7-22-9-15(19-20-22)12-28-16(13)10-21(3)18(26)27-4/h9,13-14,16,24H,5-8,10-12H2,1-4H3/t13-,14+,16-/m1/s1	UUDITCQIVHGHRN-IJEWVQPXSA-N	397.232519142							96676
BRD-K10046096	LSM-6981		44505646	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20+,25-/m0/s1	OLIWWUKSUJJEPA-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K10046096	BRD-K10046096-001-01-9	Broad Institute of MIT and Harvard	BRD-K10046096			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20+,25-/m0/s1	OLIWWUKSUJJEPA-DFIYOIEZSA-N	480.284889072							95602
MLS003129733	LSM-7789	SID99358176, BRD-K70102743	44505755	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19+/m1/s1	MNAJUJYQFCFYAB-LMMKCTJWSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K70102743	BRD-K70102743-001-02-2	Broad Institute of MIT and Harvard	BRD-K70102743			CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19+/m1/s1	MNAJUJYQFCFYAB-LMMKCTJWSA-N	439.279469334							96410
MLS003129666	LSM-7465	BRD-K48066866	44498546	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)9-6-10-33-18(11-28-30-33)15-37-21(16)13-31(3)23(36)29-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,11,16-17,21,34H,6,9-10,12-15H2,1-3H3,(H,29,36)/t16-,17+,21+/m1/s1	MTUQQJRKJJVDPI-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K48066866	BRD-K48066866-001-02-9	Broad Institute of MIT and Harvard	BRD-K48066866			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)9-6-10-33-18(11-28-30-33)15-37-21(16)13-31(3)23(36)29-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,11,16-17,21,34H,6,9-10,12-15H2,1-3H3,(H,29,36)/t16-,17+,21+/m1/s1	MTUQQJRKJJVDPI-WWMYMODYSA-N	526.251538196							96086
BRD-K57339160	LSM-7608		44505002	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20-,25-/m0/s1	SUQKGVARFDJMIR-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K57339160	BRD-K57339160-001-01-3	Broad Institute of MIT and Harvard	BRD-K57339160			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20-,25-/m0/s1	SUQKGVARFDJMIR-RLSLOFABSA-N	509.26381927							96229
MLS003129496	LSM-7109	BRD-K19973268	44505119	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19+,21+/m0/s1	BGKHIKCFNCIYGU-QKNQBKEWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K19973268	BRD-K19973268-001-02-5	Broad Institute of MIT and Harvard	BRD-K19973268			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19+,21+/m0/s1	BGKHIKCFNCIYGU-QKNQBKEWSA-N	493.23588996							95730
MLS003129497	LSM-7640	BRD-K60002680, SID99357829	44505587	InChI=1S/C24H35N5O5/c1-18-13-28(19(2)15-30)23(31)10-7-11-29-21(12-25-26-29)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,30H,7,10-11,13-17H2,1-3H3/t18-,19+,22+/m1/s1	DLYGSNKXPRYVCA-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)OCc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K60002680	BRD-K60002680-001-02-1	Broad Institute of MIT and Harvard	BRD-K60002680			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)OCc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-18-13-28(19(2)15-30)23(31)10-7-11-29-21(12-25-26-29)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,30H,7,10-11,13-17H2,1-3H3/t18-,19+,22+/m1/s1	DLYGSNKXPRYVCA-DXIQSLLYSA-N	473.26381927							96261
BRD-K31538032	LSM-7257		44488155	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21-/m0/s1	DTQFALQSFDATTM-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K31538032	BRD-K31538032-001-01-7	Broad Institute of MIT and Harvard	BRD-K31538032			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21-/m0/s1	DTQFALQSFDATTM-FIKGOQFSSA-N	526.251538196							95878
MLS003129488	LSM-7267	BRD-K32162364, SID99357822	44488171	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19-,23+/m1/s1	QHTRHHVBBSPOHC-PWHSHALESA-N	COc1ccccc1CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K32162364	BRD-K32162364-001-02-1	Broad Institute of MIT and Harvard	BRD-K32162364			COc1ccccc1CN(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19-,23+/m1/s1	QHTRHHVBBSPOHC-PWHSHALESA-N	459.284554714							95888
BRD-K47497589	LSM-7455		44486974	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20-,25-/m1/s1	PJEXWGOYWCOKCP-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K47497589	BRD-K47497589-001-01-5	Broad Institute of MIT and Harvard	BRD-K47497589			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20-,25-/m1/s1	PJEXWGOYWCOKCP-UMEGOILYSA-N	480.284889072							96076
BRD-K51197994	LSM-7505		44505052	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19-,23-/m1/s1	RQWMQWHENJCHFR-DNVFCKCGSA-N	COc1cccc(CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)c1	BroadT	BRD-K51197994	BRD-K51197994-001-01-3	Broad Institute of MIT and Harvard	BRD-K51197994			COc1cccc(CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)c1	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19-,23-/m1/s1	RQWMQWHENJCHFR-DNVFCKCGSA-N	459.284554714							96126
BRD-K50605719	LSM-7496		44484531	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17-,22-/m1/s1	ATJIIPBEGAKQFE-DRSNIGMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K50605719	BRD-K50605719-001-01-0	Broad Institute of MIT and Harvard	BRD-K50605719			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17-,22-/m1/s1	ATJIIPBEGAKQFE-DRSNIGMVSA-N	497.196045386							96117
MLS003129160	LSM-8017	BRD-K92135892	44505137	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17-,21+/m1/s1	HYLLQKBLPQWSSO-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K92135892	BRD-K92135892-001-02-5	Broad Institute of MIT and Harvard	BRD-K92135892			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17-,21+/m1/s1	HYLLQKBLPQWSSO-LZJOCLMNSA-N	497.210818064							96638
BRD-K37545156	LSM-7332		44485078	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16-/m1/s1	WAHUPRWPWKVPJH-IJEWVQPXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K37545156	BRD-K37545156-001-01-6	Broad Institute of MIT and Harvard	BRD-K37545156			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16-/m1/s1	WAHUPRWPWKVPJH-IJEWVQPXSA-N	353.242689902							95953
BRD-K93061078	LSM-8036		44485768	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13+,15-/m1/s1	DOGJCEWMCMFHOH-VNHYZAJKSA-N	CNC[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K93061078	BRD-K93061078-001-01-0	Broad Institute of MIT and Harvard	BRD-K93061078			CNC[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13+,15-/m1/s1	DOGJCEWMCMFHOH-VNHYZAJKSA-N	339.227039838							96657
MLS003129149	LSM-7790	BRD-K70345064	44497255	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m0/s1	QOPMKJNNAFOQDN-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K70345064	BRD-K70345064-001-02-8	Broad Institute of MIT and Harvard	BRD-K70345064			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m0/s1	QOPMKJNNAFOQDN-CSODHUTKSA-N	526.251538196							96411
BRD-K27835062	LSM-7203		44505633	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22-/m0/s1	YYALKDZNPSDWDC-SVMVAKDDSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)c1	BroadT	BRD-K27835062	BRD-K27835062-001-01-6	Broad Institute of MIT and Harvard	BRD-K27835062			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)c1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22-/m0/s1	YYALKDZNPSDWDC-SVMVAKDDSA-N	488.274718312							95824
MLS003129705	LSM-7262	BRD-K31788208	44486354	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21+,25+/m0/s1	WYPGSQIBOYUSAK-BPYKYCOYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K31788208	BRD-K31788208-001-02-4	Broad Institute of MIT and Harvard	BRD-K31788208			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21+,25+/m0/s1	WYPGSQIBOYUSAK-BPYKYCOYSA-N	551.285617354							95883
MLS003129452	LSM-8047	SID99357792, BRD-K94157828	44505728	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18-,22+/m1/s1	QVFRXOMYJDWMPT-HMFYCAOWSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K94157828	BRD-K94157828-001-02-6	Broad Institute of MIT and Harvard	BRD-K94157828			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18-,22+/m1/s1	QVFRXOMYJDWMPT-HMFYCAOWSA-N	509.23080458							96668
MLS003129492	LSM-6950	BRD-K07381195, SID99357825	44505971	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18+,22+/m0/s1	RLIRIECCVMDDQV-NJNPRVFISA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K07381195	BRD-K07381195-001-02-3	Broad Institute of MIT and Harvard	BRD-K07381195			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18+,22+/m0/s1	RLIRIECCVMDDQV-NJNPRVFISA-N	509.23080458							95571
MLS003129457	LSM-7219	SID99357797, BRD-K28907425	44505122	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19+,21-/m0/s1	PKTOTAWSKYPRKJ-ZVDOUQERSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K28907425	BRD-K28907425-001-02-2	Broad Institute of MIT and Harvard	BRD-K28907425			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19+,21-/m0/s1	PKTOTAWSKYPRKJ-ZVDOUQERSA-N	493.23588996							95840
BRD-K03373081	LSM-6906		44506058	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22-/m1/s1	KWAFQNIHTBJTFB-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K03373081	BRD-K03373081-001-01-3	Broad Institute of MIT and Harvard	BRD-K03373081			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22-/m1/s1	KWAFQNIHTBJTFB-JBYIUTFZSA-N	497.261374598							95527
BRD-K37513668	LSM-7331		44505866	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22-/m1/s1	ZODITPIVHHGZAH-KGVIQGDOSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K37513668	BRD-K37513668-001-01-5	Broad Institute of MIT and Harvard	BRD-K37513668			COc1ccccc1NC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22-/m1/s1	ZODITPIVHHGZAH-KGVIQGDOSA-N	488.274718312							95952
MLS003129148	LSM-7437	BRD-K46370825, SID99357488	44505383	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24+/m0/s1	DZRIWTKXHLXUTO-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K46370825	BRD-K46370825-001-02-7	Broad Institute of MIT and Harvard	BRD-K46370825			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24+/m0/s1	DZRIWTKXHLXUTO-XLNZFTOWSA-N	510.259068248							96058
BRD-K94263505	LSM-8048		44486976	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19+,23+/m0/s1	AIDUMHXRFRBIIP-YCRNBWNJSA-N	COc1ccccc1CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K94263505	BRD-K94263505-001-01-4	Broad Institute of MIT and Harvard	BRD-K94263505			COc1ccccc1CN(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19+,23+/m0/s1	AIDUMHXRFRBIIP-YCRNBWNJSA-N	459.284554714							96669
MLS003129643	LSM-7421	BRD-K45307499	44493077	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20+,25+/m1/s1	OKVDUKBBVHEMKE-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K45307499	BRD-K45307499-001-02-5	Broad Institute of MIT and Harvard	BRD-K45307499			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20+,25+/m1/s1	OKVDUKBBVHEMKE-RNHFSVANSA-N	500.31110382							96042
MLS003129701	LSM-7949	SID99358148, BRD-K86194107	44505615	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21+/m1/s1	VTXUSJLMEZRIOV-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K86194107	BRD-K86194107-001-02-1	Broad Institute of MIT and Harvard	BRD-K86194107			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21+/m1/s1	VTXUSJLMEZRIOV-LZJOCLMNSA-N	476.254731796							96570
BRD-K91899208	LSM-8014		44484534	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20+,25-/m0/s1	PJEXWGOYWCOKCP-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K91899208	BRD-K91899208-001-01-8	Broad Institute of MIT and Harvard	BRD-K91899208			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20+,25-/m0/s1	PJEXWGOYWCOKCP-DFIYOIEZSA-N	480.284889072							96635
BRD-K44900726	LSM-7417		44505813	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21-/m0/s1	DVUZCPZOEGBIKA-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K44900726	BRD-K44900726-001-01-5	Broad Institute of MIT and Harvard	BRD-K44900726			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21-/m0/s1	DVUZCPZOEGBIKA-FVJLSDCUSA-N	526.251538196							96038
MLS003129176	LSM-7839	BRD-K76703685	44505597	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m1/s1	APDMZOWNVCUUKT-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K76703685	BRD-K76703685-001-02-1	Broad Institute of MIT and Harvard	BRD-K76703685			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m1/s1	APDMZOWNVCUUKT-OPYAIIAOSA-N	464.31110382							96460
BRD-K78173425	LSM-7867		44498549	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22-/m0/s1	YYALKDZNPSDWDC-SPEDKVCISA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)c1	BroadT	BRD-K78173425	BRD-K78173425-001-01-2	Broad Institute of MIT and Harvard	BRD-K78173425			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)c1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22-/m0/s1	YYALKDZNPSDWDC-SPEDKVCISA-N	488.274718312							96488
BRD-K82906409	LSM-7916		44505368	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16+/m0/s1	KPZGSTQZFNZEDR-OFQRWUPVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K82906409	BRD-K82906409-001-01-9	Broad Institute of MIT and Harvard	BRD-K82906409			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16+/m0/s1	KPZGSTQZFNZEDR-OFQRWUPVSA-N	417.204589832							96537
MLS003129347	LSM-7070	BRD-K16671107, SID99357657	44485068	InChI=1S/C28H44N8O4/c1-21-17-35(22(2)19-37)27(38)6-5-11-36-25(16-29-31-36)20-40-26(21)18-33(4)28(39)30-23-7-9-24(10-8-23)34-14-12-32(3)13-15-34/h7-10,16,21-22,26,37H,5-6,11-15,17-20H2,1-4H3,(H,30,39)/t21-,22-,26-/m1/s1	LMWGPKORGYIWNW-XLGIIRLISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K16671107	BRD-K16671107-001-02-3	Broad Institute of MIT and Harvard	BRD-K16671107			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H44N8O4/c1-21-17-35(22(2)19-37)27(38)6-5-11-36-25(16-29-31-36)20-40-26(21)18-33(4)28(39)30-23-7-9-24(10-8-23)34-14-12-32(3)13-15-34/h7-10,16,21-22,26,37H,5-6,11-15,17-20H2,1-4H3,(H,30,39)/t21-,22-,26-/m1/s1	LMWGPKORGYIWNW-XLGIIRLISA-N	556.348551968							95691
BRD-K06260900	LSM-6938		44485765	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20+,25+/m1/s1	PJEXWGOYWCOKCP-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K06260900	BRD-K06260900-001-01-8	Broad Institute of MIT and Harvard	BRD-K06260900			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20+,25+/m1/s1	PJEXWGOYWCOKCP-RNHFSVANSA-N	480.284889072							95559
MLS003129437	LSM-8065	BRD-K95044179, SID85799282, SID99357780	44492583	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28+/m1/s1	CUSMSBFNEHNGNQ-MRJKTFCFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K95044179	BRD-K95044179-001-02-0	Broad Institute of MIT and Harvard	BRD-K95044179			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28+/m1/s1	CUSMSBFNEHNGNQ-MRJKTFCFSA-N	521.300204778							96686
MLS003130226	LSM-7569	BRD-K54864501	44505850	InChI=1S/C27H36N6O4/c1-19-15-32(20(2)17-34)26(35)12-7-13-33-22(14-28-30-33)18-37-25(19)16-31(3)27(36)29-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,34H,7,12-13,15-18H2,1-3H3,(H,29,36)/t19-,20+,25+/m0/s1	BDQCUWSGKZTQJJ-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K54864501	BRD-K54864501-001-02-9	Broad Institute of MIT and Harvard	BRD-K54864501			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H36N6O4/c1-19-15-32(20(2)17-34)26(35)12-7-13-33-22(14-28-30-33)18-37-25(19)16-31(3)27(36)29-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,34H,7,12-13,15-18H2,1-3H3,(H,29,36)/t19-,20+,25+/m0/s1	BDQCUWSGKZTQJJ-WZOHSFFVSA-N	508.279803692							96190
MLS003130241	LSM-7010	BRD-K12331173	44505327	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)6-5-11-28-20(16-33-22)12-24-25-28/h7-10,12,18-19,22,29H,5-6,11,13-16H2,1-4H3/t18-,19+,22-/m1/s1	PBQVTRJHSYIUGU-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K12331173	BRD-K12331173-001-02-7	Broad Institute of MIT and Harvard	BRD-K12331173			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)6-5-11-28-20(16-33-22)12-24-25-28/h7-10,12,18-19,22,29H,5-6,11,13-16H2,1-4H3/t18-,19+,22-/m1/s1	PBQVTRJHSYIUGU-XQBPLPMBSA-N	493.23588996							95631
MLS003129210	LSM-7775	BRD-K69431670	44505762	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17-,19+/m0/s1	UOJDQXZVAPFQKD-JENIJYKNSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K69431670	BRD-K69431670-001-02-5	Broad Institute of MIT and Harvard	BRD-K69431670			CC(C)COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17-,19+/m0/s1	UOJDQXZVAPFQKD-JENIJYKNSA-N	439.279469334							96396
BRD-K52371706	LSM-7524		44485051	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26-/m1/s1	OIASBGFOQSUHIL-XLGIIRLISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K52371706	BRD-K52371706-001-01-2	Broad Institute of MIT and Harvard	BRD-K52371706			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26-/m1/s1	OIASBGFOQSUHIL-XLGIIRLISA-N	541.337652926							96145
MLS003130344	LSM-7879	BRD-K78824440	44505071	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13+,15+/m0/s1	FOLOUAULJSJVDY-GZBFAFLISA-N	CNC[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K78824440	BRD-K78824440-001-02-9	Broad Institute of MIT and Harvard	BRD-K78824440			CNC[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13+,15+/m0/s1	FOLOUAULJSJVDY-GZBFAFLISA-N	339.227039838							96500
BRD-K57627685	LSM-7614		44486364	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20+,25-/m1/s1	XVJRXGRWNAMAGP-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K57627685	BRD-K57627685-001-01-7	Broad Institute of MIT and Harvard	BRD-K57627685			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20+,25-/m1/s1	XVJRXGRWNAMAGP-OHUGHZGNSA-N	508.279803692							96235
MLS003129325	LSM-7978	SID99357584, BRD-K87904079	44496392	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18+,21+/m0/s1	QLGFDRXFQQZFKX-WAOWUJCRSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K87904079	BRD-K87904079-001-02-6	Broad Institute of MIT and Harvard	BRD-K87904079			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18+,21+/m0/s1	QLGFDRXFQQZFKX-WAOWUJCRSA-N	509.23080458							96599
BRD-K75291656	LSM-7824		44485745	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19+,24-/m1/s1	XYWPMUCHOREPKK-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K75291656	BRD-K75291656-001-01-5	Broad Institute of MIT and Harvard	BRD-K75291656			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19+,24-/m1/s1	XYWPMUCHOREPKK-YDIMBITNSA-N	510.259068248							96445
BRD-K54647996	LSM-7563		44495442	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22+/m0/s1	QAXWADXATYBNKX-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K54647996	BRD-K54647996-001-01-2	Broad Institute of MIT and Harvard	BRD-K54647996			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22+/m0/s1	QAXWADXATYBNKX-NJNPRVFISA-N	497.261374598							96184
BRD-K39654705	LSM-7354		44485758	InChI=1S/C20H36N6O4/c1-14(2)21-20(29)24(5)11-18-15(3)9-26(16(4)12-27)19(28)7-6-8-25-10-17(13-30-18)22-23-25/h10,14-16,18,27H,6-9,11-13H2,1-5H3,(H,21,29)/t15-,16-,18-/m1/s1	UNRRBHFUILMFRI-JFIYKMOQSA-N	CC(C)NC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K39654705	BRD-K39654705-001-01-0	Broad Institute of MIT and Harvard	BRD-K39654705			CC(C)NC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C20H36N6O4/c1-14(2)21-20(29)24(5)11-18-15(3)9-26(16(4)12-27)19(28)7-6-8-25-10-17(13-30-18)22-23-25/h10,14-16,18,27H,6-9,11-13H2,1-5H3,(H,21,29)/t15-,16-,18-/m1/s1	UNRRBHFUILMFRI-JFIYKMOQSA-N	424.279803692							95975
BRD-K91201009	LSM-8004		44485748	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19-,22-/m1/s1	GMDADKPJAYHJFG-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K91201009	BRD-K91201009-001-01-8	Broad Institute of MIT and Harvard	BRD-K91201009			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19-,22-/m1/s1	GMDADKPJAYHJFG-WOIUINJBSA-N	457.26890465							96625
MLS003129415	LSM-8006	BRD-K91424547, SID99357714	44506061	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18-,22+/m1/s1	DXNYPMFBKGSJNE-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K91424547	BRD-K91424547-001-02-3	Broad Institute of MIT and Harvard	BRD-K91424547			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18-,22+/m1/s1	DXNYPMFBKGSJNE-HMFYCAOWSA-N	497.261374598							96627
BRD-K54671386	LSM-7564		44488711	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13-,15-/m0/s1	DOGJCEWMCMFHOH-YDHLFZDLSA-N	CNC[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K54671386	BRD-K54671386-001-01-0	Broad Institute of MIT and Harvard	BRD-K54671386			CNC[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13-,15-/m0/s1	DOGJCEWMCMFHOH-YDHLFZDLSA-N	339.227039838							96185
BRD-K72773058	LSM-8348		44484525	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17-,22-/m0/s1	DEGZSTUNWMGQCY-HOIFWPIMSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K72773058	BRD-K72773058-001-01-9	Broad Institute of MIT and Harvard	BRD-K72773058			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17-,22-/m0/s1	DEGZSTUNWMGQCY-HOIFWPIMSA-N	502.253982868							96969
MLS003129445	LSM-7384	BRD-K42269438, SID99357786	44505120	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19-,21-/m0/s1	PKTOTAWSKYPRKJ-ZJOUEHCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K42269438	BRD-K42269438-001-02-4	Broad Institute of MIT and Harvard	BRD-K42269438			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19-,21-/m0/s1	PKTOTAWSKYPRKJ-ZJOUEHCJSA-N	493.23588996							96005
MLS003129293	LSM-7051	BRD-K14744524, SID99357554	44489271	InChI=1S/C23H35N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,29H,7,10-11,13-17H2,1-3H3/t18-,19-,22+/m1/s1	AYVSZOBZIZEFEA-KNKQGSTJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K14744524	BRD-K14744524-001-02-5	Broad Institute of MIT and Harvard	BRD-K14744524			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,29H,7,10-11,13-17H2,1-3H3/t18-,19-,22+/m1/s1	AYVSZOBZIZEFEA-KNKQGSTJSA-N	429.27399003							95672
MLS003129601	LSM-7829	BRD-K75707803, SID99358012	44485754	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20-,23+/m1/s1	PUSZFNDBKFADMS-VIZSFHNOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K75707803	BRD-K75707803-001-02-0	Broad Institute of MIT and Harvard	BRD-K75707803			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20-,23+/m1/s1	PUSZFNDBKFADMS-VIZSFHNOSA-N	544.31216646							96450
BRD-K01121544	LSM-6873		44498144	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28+/m0/s1	PZMMCWSZGDQDET-SXDGJLEOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K01121544	BRD-K01121544-001-01-9	Broad Institute of MIT and Harvard	BRD-K01121544			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28+/m0/s1	PZMMCWSZGDQDET-SXDGJLEOSA-N	505.305290158							95494
MLS003130233	LSM-7670	BRD-K61872587, SID99359026	44505208	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17+,22+/m0/s1	FSJQCDSATLDVBC-GSHUGGBRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K61872587	BRD-K61872587-001-02-0	Broad Institute of MIT and Harvard	BRD-K61872587			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17+,22+/m0/s1	FSJQCDSATLDVBC-GSHUGGBRSA-N	497.196045386							96291
MLS003129609	LSM-7260	SID99358019, BRD-K31704218	44505027	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28+/m1/s1	YAZCQYURBLEIHO-IWHLBADBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K31704218	BRD-K31704218-001-02-9	Broad Institute of MIT and Harvard	BRD-K31704218			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28+/m1/s1	YAZCQYURBLEIHO-IWHLBADBSA-N	505.305290158							95881
MLS003129709	LSM-7076	BRD-K17360472	44485743	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22+,26+/m1/s1	OIASBGFOQSUHIL-UFPGJGBJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K17360472	BRD-K17360472-001-02-9	Broad Institute of MIT and Harvard	BRD-K17360472			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22+,26+/m1/s1	OIASBGFOQSUHIL-UFPGJGBJSA-N	541.337652926							95697
BRD-K55035262	LSM-7573		44485058	InChI=1S/C23H33N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18+,21-/m1/s1	KNHKBBCFGVHHOP-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K55035262	BRD-K55035262-001-01-6	Broad Institute of MIT and Harvard	BRD-K55035262			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18+,21-/m1/s1	KNHKBBCFGVHHOP-LVCYWYKZSA-N	443.253254586							96194
MLS003130227	LSM-6901	BRD-K02960110, SID99359022	44505177	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26+/m1/s1	MSGDIDWYZNYHQU-DRLORSAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K02960110	BRD-K02960110-001-02-1	Broad Institute of MIT and Harvard	BRD-K02960110			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26+/m1/s1	MSGDIDWYZNYHQU-DRLORSAXSA-N	541.337652926							95522
BRD-K16670827	LSM-7069		44505441	InChI=1S/C25H38N6O6/c1-17-12-31(18(2)15-32)24(33)7-6-10-30-13-19(27-28-30)16-37-23(17)14-29(3)25(34)26-21-9-8-20(35-4)11-22(21)36-5/h8-9,11,13,17-18,23,32H,6-7,10,12,14-16H2,1-5H3,(H,26,34)/t17-,18+,23-/m1/s1	DZDKJIRUSJXCKT-IEGUWTFLSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)c(OC)c1	BroadT	BRD-K16670827	BRD-K16670827-001-01-6	Broad Institute of MIT and Harvard	BRD-K16670827			COc1ccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)c(OC)c1	InChI=1S/C25H38N6O6/c1-17-12-31(18(2)15-32)24(33)7-6-10-30-13-19(27-28-30)16-37-23(17)14-29(3)25(34)26-21-9-8-20(35-4)11-22(21)36-5/h8-9,11,13,17-18,23,32H,6-7,10,12,14-16H2,1-5H3,(H,26,34)/t17-,18+,23-/m1/s1	DZDKJIRUSJXCKT-IEGUWTFLSA-N	518.285282996							95690
MLS003129529	LSM-6921	BRD-K04648846, SID99357908	44505579	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16+,18-/m0/s1	IKLKAEKDATVYNM-JZXOWHBKSA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K04648846	BRD-K04648846-001-02-1	Broad Institute of MIT and Harvard	BRD-K04648846			CC(C)OC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16+,18-/m0/s1	IKLKAEKDATVYNM-JZXOWHBKSA-N	425.26381927							95542
BRD-K35290760	LSM-7302		44488687	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19+,24-/m0/s1	XYWPMUCHOREPKK-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K35290760	BRD-K35290760-001-01-9	Broad Institute of MIT and Harvard	BRD-K35290760			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19+,24-/m0/s1	XYWPMUCHOREPKK-GLDPYIMESA-N	510.259068248							95923
BRD-K76825413	LSM-7840		44496828	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22-/m1/s1	ZODITPIVHHGZAH-JBYIUTFZSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K76825413	BRD-K76825413-001-01-3	Broad Institute of MIT and Harvard	BRD-K76825413			COc1ccccc1NC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22-/m1/s1	ZODITPIVHHGZAH-JBYIUTFZSA-N	488.274718312							96461
MLS003129782	LSM-7858	BRD-K77517292	44486957	InChI=1S/C23H33N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21+/m0/s1	KNHKBBCFGVHHOP-BBTUJRGHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K77517292	BRD-K77517292-001-02-9	Broad Institute of MIT and Harvard	BRD-K77517292			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21+/m0/s1	KNHKBBCFGVHHOP-BBTUJRGHSA-N	443.253254586							96479
MLS003129426	LSM-7591	BRD-K56304906, SID99357773	44486349	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19+,24+/m0/s1	XYWPMUCHOREPKK-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K56304906	BRD-K56304906-001-02-5	Broad Institute of MIT and Harvard	BRD-K56304906			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19+,24+/m0/s1	XYWPMUCHOREPKK-XLNZFTOWSA-N	510.259068248							96212
MLS003129769	LSM-7994	BRD-K89796490, SID99358254	44492578	InChI=1S/C18H31N5O5/c1-13-9-22(14(2)11-24)17(25)6-5-7-23-15(8-19-20-23)12-28-16(13)10-21(3)18(26)27-4/h8,13-14,16,24H,5-7,9-12H2,1-4H3/t13-,14+,16+/m1/s1	BOUWOFDIRQBKSW-YCPHGPKFSA-N	COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K89796490	BRD-K89796490-001-02-5	Broad Institute of MIT and Harvard	BRD-K89796490			COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C18H31N5O5/c1-13-9-22(14(2)11-24)17(25)6-5-7-23-15(8-19-20-23)12-28-16(13)10-21(3)18(26)27-4/h8,13-14,16,24H,5-7,9-12H2,1-4H3/t13-,14+,16+/m1/s1	BOUWOFDIRQBKSW-YCPHGPKFSA-N	397.232519142							96615
BRD-K62528537	LSM-7682		44505616	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21-/m1/s1	VTXUSJLMEZRIOV-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K62528537	BRD-K62528537-001-01-0	Broad Institute of MIT and Harvard	BRD-K62528537			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21-/m1/s1	VTXUSJLMEZRIOV-LLGFUMIMSA-N	476.254731796							96303
MLS003129745	LSM-8062	BRD-K94834134	44505401	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25+/m1/s1	WIMCLPXWPPGBKL-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K94834134	BRD-K94834134-001-02-9	Broad Institute of MIT and Harvard	BRD-K94834134			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25+/m1/s1	WIMCLPXWPPGBKL-FHAGJXEFSA-N	509.26381927							96683
MLS003129264	LSM-7247	BRD-K30658064, SID99357529	44505473	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28+/m0/s1	YAZCQYURBLEIHO-SXDGJLEOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K30658064	BRD-K30658064-001-02-3	Broad Institute of MIT and Harvard	BRD-K30658064			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28+/m0/s1	YAZCQYURBLEIHO-SXDGJLEOSA-N	505.305290158							95868
BRD-K91443444	LSM-8007		44505159	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18-,22-/m1/s1	RLIRIECCVMDDQV-JBYIUTFZSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K91443444	BRD-K91443444-001-01-9	Broad Institute of MIT and Harvard	BRD-K91443444			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18-,22-/m1/s1	RLIRIECCVMDDQV-JBYIUTFZSA-N	509.23080458							96628
BRD-K50754265	LSM-7499		44505459	InChI=1S/C24H36N6O5/c1-17-13-29(18(2)15-31)23(32)9-6-10-30-20(12-25-27-30)16-35-22(17)14-28(3)24(33)26-19-7-5-8-21(11-19)34-4/h5,7-8,11-12,17-18,22,31H,6,9-10,13-16H2,1-4H3,(H,26,33)/t17-,18+,22-/m1/s1	CFCAPIQLQJKCRL-KGVIQGDOSA-N	COc1cccc(NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K50754265	BRD-K50754265-001-01-4	Broad Institute of MIT and Harvard	BRD-K50754265			COc1cccc(NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)c1	InChI=1S/C24H36N6O5/c1-17-13-29(18(2)15-31)23(32)9-6-10-30-20(12-25-27-30)16-35-22(17)14-28(3)24(33)26-19-7-5-8-21(11-19)34-4/h5,7-8,11-12,17-18,22,31H,6,9-10,13-16H2,1-4H3,(H,26,33)/t17-,18+,22-/m1/s1	CFCAPIQLQJKCRL-KGVIQGDOSA-N	488.274718312							96120
MLS003129584	LSM-7962	BRD-K86895142, SID99357952	44504945	InChI=1S/C28H37N5O6S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-23(16-29-30-33)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22+,27+/m1/s1	QEXGJGRYUGYWJV-VHSZZVNMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K86895142	BRD-K86895142-001-02-0	Broad Institute of MIT and Harvard	BRD-K86895142			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N5O6S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-23(16-29-30-33)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22+,27+/m1/s1	QEXGJGRYUGYWJV-VHSZZVNMSA-N	571.246454644							96583
MLS003129189	LSM-7086	BRD-K18273607	44496391	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18-,21+/m1/s1	QLGFDRXFQQZFKX-OPYAIIAOSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K18273607	BRD-K18273607-001-02-1	Broad Institute of MIT and Harvard	BRD-K18273607			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18-,21+/m1/s1	QLGFDRXFQQZFKX-OPYAIIAOSA-N	509.23080458							95707
MLS003129553	LSM-7686	BRD-K62624932	44494482	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20+,25+/m1/s1	PZGTZQIYRXDXGV-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K62624932	BRD-K62624932-001-02-6	Broad Institute of MIT and Harvard	BRD-K62624932			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20+,25+/m1/s1	PZGTZQIYRXDXGV-RNHFSVANSA-N	509.26381927							96307
BRD-K94435288	LSM-8053		44493581	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18+,21-/m0/s1	QXBLKCOAOVMUQM-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K94435288	BRD-K94435288-001-01-1	Broad Institute of MIT and Harvard	BRD-K94435288			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18+,21-/m0/s1	QXBLKCOAOVMUQM-UEXGIBASSA-N	430.269239008							96674
BRD-K64249376	LSM-7709		44491457	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)9-6-10-29-12-18(26-27-29)15-34-21(16)13-28(3)23(33)25-20-8-5-4-7-19(20)24/h4-5,7-8,12,16-17,21,31H,6,9-11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21-/m1/s1	UGDLKAPALXLDHQ-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K64249376	BRD-K64249376-001-01-5	Broad Institute of MIT and Harvard	BRD-K64249376			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)9-6-10-29-12-18(26-27-29)15-34-21(16)13-28(3)23(33)25-20-8-5-4-7-19(20)24/h4-5,7-8,12,16-17,21,31H,6,9-11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21-/m1/s1	UGDLKAPALXLDHQ-LLGFUMIMSA-N	476.254731796							96330
MLS003129597	LSM-8074	BRD-K95798815	44506074	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)11-23(16(3)13-25)19(26)7-6-9-24-17(14-27-18)10-20-21-24/h10,15-16,18,25H,5-9,11-14H2,1-4H3/t15-,16+,18+/m0/s1	DWRDFVJCWRIGSC-LZLYRXPVSA-N	CCCN(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K95798815	BRD-K95798815-001-02-1	Broad Institute of MIT and Harvard	BRD-K95798815			CCCN(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)11-23(16(3)13-25)19(26)7-6-9-24-17(14-27-18)10-20-21-24/h10,15-16,18,25H,5-9,11-14H2,1-4H3/t15-,16+,18+/m0/s1	DWRDFVJCWRIGSC-LZLYRXPVSA-N	381.27399003							96695
MLS003129231	LSM-7209	BRD-K28179362	44506094	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20+,24+/m0/s1	XBPVHNZVBFLVIV-DCLXLUIPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K28179362	BRD-K28179362-001-02-3	Broad Institute of MIT and Harvard	BRD-K28179362			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc2cnnn2CCCC1=O	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20+,24+/m0/s1	XBPVHNZVBFLVIV-DCLXLUIPSA-N	501.295119398							95830
BRD-K78921480	LSM-7882		44489267	InChI=1S/C18H31N5O5/c1-13-8-23(14(2)11-24)17(25)6-5-7-22-9-15(19-20-22)12-28-16(13)10-21(3)18(26)27-4/h9,13-14,16,24H,5-8,10-12H2,1-4H3/t13-,14+,16-/m0/s1	UUDITCQIVHGHRN-LZWOXQAQSA-N	COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K78921480	BRD-K78921480-001-01-6	Broad Institute of MIT and Harvard	BRD-K78921480			COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C18H31N5O5/c1-13-8-23(14(2)11-24)17(25)6-5-7-22-9-15(19-20-22)12-28-16(13)10-21(3)18(26)27-4/h9,13-14,16,24H,5-8,10-12H2,1-4H3/t13-,14+,16-/m0/s1	UUDITCQIVHGHRN-LZWOXQAQSA-N	397.232519142							96503
MLS003129726	LSM-21977	SID99358169, BRD-K25430810	44505132	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)8-5-9-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10-11,16-17,21,29H,5,8-9,12-15H2,1-3H3/t16-,17-,21-/m1/s1	KYGBGAWZQIYPEA-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K25430810	BRD-K25430810-001-02-1	Broad Institute of MIT and Harvard	BRD-K25430810			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)8-5-9-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10-11,16-17,21,29H,5,8-9,12-15H2,1-3H3/t16-,17-,21-/m1/s1	KYGBGAWZQIYPEA-CBGDNZLLSA-N	497.210818064							110530
MLS003129758	LSM-7230	BRD-K29555302	44505790	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23+/m1/s1	RIHXBZGHHXCGPP-QTEQDKRBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K29555302	BRD-K29555302-001-02-6	Broad Institute of MIT and Harvard	BRD-K29555302			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23+/m1/s1	RIHXBZGHHXCGPP-QTEQDKRBSA-N	544.31216646							95851
MLS003129505	LSM-7027	SID99357837, BRD-K13205342	44505531	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)6-5-11-28-20(16-33-22)12-24-25-28/h7-10,12,18-19,22,29H,5-6,11,13-16H2,1-4H3/t18-,19+,22-/m0/s1	PBQVTRJHSYIUGU-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K13205342	BRD-K13205342-001-02-8	Broad Institute of MIT and Harvard	BRD-K13205342			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)6-5-11-28-20(16-33-22)12-24-25-28/h7-10,12,18-19,22,29H,5-6,11,13-16H2,1-4H3/t18-,19+,22-/m0/s1	PBQVTRJHSYIUGU-JQVVWYNYSA-N	493.23588996							95648
MLS003129370	LSM-7093	BRD-K19016577, SID85812511, SID99357676	44505406	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25+/m1/s1	WIMCLPXWPPGBKL-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K19016577	BRD-K19016577-001-02-9	Broad Institute of MIT and Harvard	BRD-K19016577			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25+/m1/s1	WIMCLPXWPPGBKL-RNHFSVANSA-N	509.26381927							95714
BRD-K89364593	LSM-7992		44505864	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22-/m1/s1	YYALKDZNPSDWDC-JBYIUTFZSA-N	COc1cccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)c1	BroadT	BRD-K89364593	BRD-K89364593-001-01-0	Broad Institute of MIT and Harvard	BRD-K89364593			COc1cccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)c1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22-/m1/s1	YYALKDZNPSDWDC-JBYIUTFZSA-N	488.274718312							96613
BRD-K20931972	LSM-7124		44505621	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21-/m1/s1	QOPMKJNNAFOQDN-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K20931972	BRD-K20931972-001-01-9	Broad Institute of MIT and Harvard	BRD-K20931972			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21-/m1/s1	QOPMKJNNAFOQDN-LLGFUMIMSA-N	526.251538196							95745
SCHEMBL16083218	LSM-7083	BRD-K17976466	44486949	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15-,18-/m0/s1	HEIBNMHSSNMFIU-MPGHIAIKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K17976466	BRD-K17976466-001-01-2	Broad Institute of MIT and Harvard	BRD-K17976466			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15-,18-/m0/s1	HEIBNMHSSNMFIU-MPGHIAIKSA-N	407.253254586							95704
BRD-K20037743	LSM-7113		44484539	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19+,23+/m1/s1	AIDUMHXRFRBIIP-MSYCTHLASA-N	COc1ccccc1CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K20037743	BRD-K20037743-001-01-3	Broad Institute of MIT and Harvard	BRD-K20037743			COc1ccccc1CN(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19+,23+/m1/s1	AIDUMHXRFRBIIP-MSYCTHLASA-N	459.284554714							95734
MLS003130223	LSM-8318	BRD-K65548588	44504944	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	QVHCTLOUCAXGOY-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K65548588	BRD-K65548588-001-02-1	Broad Institute of MIT and Harvard	BRD-K65548588			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	QVHCTLOUCAXGOY-WZOHSFFVSA-N	529.23588996							96939
SCHEMBL17487091	LSM-7939	BRD-K84876223	44484512	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15-,18-/m1/s1	HEIBNMHSSNMFIU-IIDMSEBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K84876223	BRD-K84876223-001-01-6	Broad Institute of MIT and Harvard	BRD-K84876223			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15-,18-/m1/s1	HEIBNMHSSNMFIU-IIDMSEBBSA-N	407.253254586							96560
BRD-K68246261	LSM-7759		44504958	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20-/m1/s1	JYOVEVCXPRGJRX-FUHIMQAGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K68246261	BRD-K68246261-001-01-5	Broad Institute of MIT and Harvard	BRD-K68246261			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20-/m1/s1	JYOVEVCXPRGJRX-FUHIMQAGSA-N	497.210818064							96380
BRD-K47571551	LSM-7458		44505593	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21-/m1/s1	APDMZOWNVCUUKT-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K47571551	BRD-K47571551-001-01-1	Broad Institute of MIT and Harvard	BRD-K47571551			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21-/m1/s1	APDMZOWNVCUUKT-DBXWQHBBSA-N	464.31110382							96079
MLS003129495	LSM-7812	BRD-K73532097, SID99357828	44494074	InChI=1S/C18H31N5O5/c1-13-9-22(14(2)11-24)17(25)6-5-7-23-15(8-19-20-23)12-28-16(13)10-21(3)18(26)27-4/h8,13-14,16,24H,5-7,9-12H2,1-4H3/t13-,14-,16+/m1/s1	BOUWOFDIRQBKSW-FMKPAKJESA-N	COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K73532097	BRD-K73532097-001-02-9	Broad Institute of MIT and Harvard	BRD-K73532097			COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C18H31N5O5/c1-13-9-22(14(2)11-24)17(25)6-5-7-23-15(8-19-20-23)12-28-16(13)10-21(3)18(26)27-4/h8,13-14,16,24H,5-7,9-12H2,1-4H3/t13-,14-,16+/m1/s1	BOUWOFDIRQBKSW-FMKPAKJESA-N	397.232519142							96433
BRD-K08212968	LSM-6963		44504965	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20-/m0/s1	JYOVEVCXPRGJRX-QKLQHJQFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K08212968	BRD-K08212968-001-01-6	Broad Institute of MIT and Harvard	BRD-K08212968			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20-/m0/s1	JYOVEVCXPRGJRX-QKLQHJQFSA-N	497.210818064							95584
MLS003129919	LSM-7763	SID99358412, BRD-K68359762	44505225	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20+,23+/m1/s1	UFUZIZHGCRPPRZ-QTEQDKRBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K68359762	BRD-K68359762-001-02-8	Broad Institute of MIT and Harvard	BRD-K68359762			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20+,23+/m1/s1	UFUZIZHGCRPPRZ-QTEQDKRBSA-N	443.289640094							96384
BRD-K12165191	LSM-7007		44486368	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17+,22+/m1/s1	ATJIIPBEGAKQFE-JLHGSKIFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K12165191	BRD-K12165191-001-01-9	Broad Institute of MIT and Harvard	BRD-K12165191			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17+,22+/m1/s1	ATJIIPBEGAKQFE-JLHGSKIFSA-N	497.196045386							95628
MLS003129710	LSM-7185	BRD-K26581628	44505004	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m0/s1	HYHIJLYQTCYSKX-BBTUJRGHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K26581628	BRD-K26581628-001-02-2	Broad Institute of MIT and Harvard	BRD-K26581628			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m0/s1	HYHIJLYQTCYSKX-BBTUJRGHSA-N	458.264153628							95806
MLS003129281	LSM-7481	BRD-K49123127	44504924	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19+,21+/m0/s1	PKTOTAWSKYPRKJ-QKNQBKEWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K49123127	BRD-K49123127-001-02-2	Broad Institute of MIT and Harvard	BRD-K49123127			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19+,21+/m0/s1	PKTOTAWSKYPRKJ-QKNQBKEWSA-N	493.23588996							96102
BRD-K75580081	LSM-7827		44492053	InChI=1S/C18H31N5O5/c1-13-8-23(14(2)11-24)17(25)6-5-7-22-9-15(19-20-22)12-28-16(13)10-21(3)18(26)27-4/h9,13-14,16,24H,5-8,10-12H2,1-4H3/t13-,14-,16-/m0/s1	UUDITCQIVHGHRN-DZKIICNBSA-N	COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K75580081	BRD-K75580081-001-01-6	Broad Institute of MIT and Harvard	BRD-K75580081			COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C18H31N5O5/c1-13-8-23(14(2)11-24)17(25)6-5-7-22-9-15(19-20-22)12-28-16(13)10-21(3)18(26)27-4/h9,13-14,16,24H,5-8,10-12H2,1-4H3/t13-,14-,16-/m0/s1	UUDITCQIVHGHRN-DZKIICNBSA-N	397.232519142							96448
BRD-K03795299	LSM-6910		44487420	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15-,19-/m0/s1	ZMFVFBQYBHAIKE-DOXZYTNZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K03795299	BRD-K03795299-001-01-5	Broad Institute of MIT and Harvard	BRD-K03795299			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15-,19-/m0/s1	ZMFVFBQYBHAIKE-DOXZYTNZSA-N	477.26996729							95531
BRD-K45788890	LSM-7429		44505858	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18+,23-/m1/s1	BKRQCUCZQROLSQ-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K45788890	BRD-K45788890-001-01-3	Broad Institute of MIT and Harvard	BRD-K45788890			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18+,23-/m1/s1	BKRQCUCZQROLSQ-IEGUWTFLSA-N	516.269632932							96050
BRD-K42466986	LSM-7389		44505160	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18+,22-/m0/s1	RLIRIECCVMDDQV-SVMVAKDDSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K42466986	BRD-K42466986-001-01-4	Broad Institute of MIT and Harvard	BRD-K42466986			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18+,22-/m0/s1	RLIRIECCVMDDQV-SVMVAKDDSA-N	509.23080458							96010
MLS003129338	LSM-7014	BRD-K12584650	44484513	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19+,24+/m1/s1	XYWPMUCHOREPKK-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K12584650	BRD-K12584650-001-02-3	Broad Institute of MIT and Harvard	BRD-K12584650			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19+,24+/m1/s1	XYWPMUCHOREPKK-IMWIBFENSA-N	510.259068248							95635
BRD-K46205969	LSM-7436		44486967	InChI=1S/C20H36N6O4/c1-14(2)21-20(29)24(5)11-18-15(3)9-26(16(4)12-27)19(28)7-6-8-25-10-17(13-30-18)22-23-25/h10,14-16,18,27H,6-9,11-13H2,1-5H3,(H,21,29)/t15-,16+,18-/m1/s1	UNRRBHFUILMFRI-SOLBZPMBSA-N	CC(C)NC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K46205969	BRD-K46205969-001-01-3	Broad Institute of MIT and Harvard	BRD-K46205969			CC(C)NC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C20H36N6O4/c1-14(2)21-20(29)24(5)11-18-15(3)9-26(16(4)12-27)19(28)7-6-8-25-10-17(13-30-18)22-23-25/h10,14-16,18,27H,6-9,11-13H2,1-5H3,(H,21,29)/t15-,16+,18-/m1/s1	UNRRBHFUILMFRI-SOLBZPMBSA-N	424.279803692							96057
BRD-K28638920	LSM-7215		44505229	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22-/m1/s1	HYDPWGICXZADLJ-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K28638920	BRD-K28638920-001-01-5	Broad Institute of MIT and Harvard	BRD-K28638920			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22-/m1/s1	HYDPWGICXZADLJ-KGVIQGDOSA-N	445.26890465							95836
MLS003129217	LSM-7902	BRD-K80711156	44505852	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22+/m0/s1	YYALKDZNPSDWDC-NJNPRVFISA-N	COc1cccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)c1	BroadT	BRD-K80711156	BRD-K80711156-001-02-8	Broad Institute of MIT and Harvard	BRD-K80711156			COc1cccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)c1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22+/m0/s1	YYALKDZNPSDWDC-NJNPRVFISA-N	488.274718312							96523
MLS003129371	LSM-7659	BRD-K60840479, SID99357677	44505564	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16+,18+/m0/s1	IKLKAEKDATVYNM-LZLYRXPVSA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K60840479	BRD-K60840479-001-02-9	Broad Institute of MIT and Harvard	BRD-K60840479			CC(C)OC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16+,18+/m0/s1	IKLKAEKDATVYNM-LZLYRXPVSA-N	425.26381927							96280
BRD-K10722141	LSM-6990		44505840	InChI=1S/C27H42N6O4/c1-19-14-33(20(2)17-34)25(35)8-7-13-32-15-23(29-30-32)18-37-24(19)16-31(6)26(36)28-22-11-9-21(10-12-22)27(3,4)5/h9-12,15,19-20,24,34H,7-8,13-14,16-18H2,1-6H3,(H,28,36)/t19-,20-,24-/m1/s1	APMQHRQBDHMONS-YOSAUDMPSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(C)(C)C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K10722141	BRD-K10722141-001-01-0	Broad Institute of MIT and Harvard	BRD-K10722141			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(C)(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H42N6O4/c1-19-14-33(20(2)17-34)25(35)8-7-13-32-15-23(29-30-32)18-37-24(19)16-31(6)26(36)28-22-11-9-21(10-12-22)27(3,4)5/h9-12,15,19-20,24,34H,7-8,13-14,16-18H2,1-6H3,(H,28,36)/t19-,20-,24-/m1/s1	APMQHRQBDHMONS-YOSAUDMPSA-N	514.326753884							95611
BRD-K42054363	LSM-7381		44483917	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18+,23+/m1/s1	ZLSVBQPGKZIPOU-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K42054363	BRD-K42054363-001-01-1	Broad Institute of MIT and Harvard	BRD-K42054363			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18+,23+/m1/s1	ZLSVBQPGKZIPOU-STSQHVNTSA-N	473.26381927							96002
MLS003129172	LSM-7533	BRD-K52947657	44505017	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20-,23+/m1/s1	UFUZIZHGCRPPRZ-VIZSFHNOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K52947657	BRD-K52947657-001-02-6	Broad Institute of MIT and Harvard	BRD-K52947657			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20-,23+/m1/s1	UFUZIZHGCRPPRZ-VIZSFHNOSA-N	443.289640094							96154
BRD-K95323941	LSM-8067		44485081	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20-,25+/m0/s1	PJEXWGOYWCOKCP-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K95323941	BRD-K95323941-001-01-7	Broad Institute of MIT and Harvard	BRD-K95323941			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20-,25+/m0/s1	PJEXWGOYWCOKCP-ZYLNGJIFSA-N	480.284889072							96688
MLS003130239	LSM-7589	BRD-K56242781	44505199	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16+,18-/m1/s1	IKLKAEKDATVYNM-SOLBZPMBSA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K56242781	BRD-K56242781-001-02-7	Broad Institute of MIT and Harvard	BRD-K56242781			CC(C)OC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16+,18-/m1/s1	IKLKAEKDATVYNM-SOLBZPMBSA-N	425.26381927							96210
BRD-K57341983	LSM-7609		44505378	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18-,22-/m0/s1	RLIRIECCVMDDQV-SPEDKVCISA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K57341983	BRD-K57341983-001-01-4	Broad Institute of MIT and Harvard	BRD-K57341983			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)9-6-10-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11,13,17-18,22,29H,6,9-10,12,14-16H2,1-4H3/t17-,18-,22-/m0/s1	RLIRIECCVMDDQV-SPEDKVCISA-N	509.23080458							96230
MLS003129588	LSM-7434	BRD-K45882653	44506095	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13-,15+/m1/s1	FOLOUAULJSJVDY-NFAWXSAZSA-N	CNC[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K45882653	BRD-K45882653-001-02-9	Broad Institute of MIT and Harvard	BRD-K45882653			CNC[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13-,15+/m1/s1	FOLOUAULJSJVDY-NFAWXSAZSA-N	339.227039838							96055
BRD-K92978552	LSM-8034		44497250	InChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18+,21-/m1/s1	AHKBAATWJXKTGZ-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K92978552	BRD-K92978552-001-01-1	Broad Institute of MIT and Harvard	BRD-K92978552			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18+,21-/m1/s1	AHKBAATWJXKTGZ-LVCYWYKZSA-N	449.300204778							96655
MLS003129719	LSM-7831	BRD-K75965029	44505149	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19+,22+/m1/s1	GKHFKOWAUNRHGL-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K75965029	BRD-K75965029-001-02-2	Broad Institute of MIT and Harvard	BRD-K75965029			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19+,22+/m1/s1	GKHFKOWAUNRHGL-DXIQSLLYSA-N	493.23588996							96452
BRD-K92266998	LSM-8020		44505985	InChI=1S/C23H33N5O5/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-19(24-25-27)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18+,21-/m1/s1	NWYXEXAEFWIOJN-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K92266998	BRD-K92266998-001-01-3	Broad Institute of MIT and Harvard	BRD-K92266998			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33N5O5/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-19(24-25-27)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18+,21-/m1/s1	NWYXEXAEFWIOJN-LVCYWYKZSA-N	459.248169206							96641
MLS003129545	LSM-7091	SID99357920, BRD-K18793708	44505963	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21+/m0/s1	OOPGLCWBUZVAMU-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K18793708	BRD-K18793708-001-02-6	Broad Institute of MIT and Harvard	BRD-K18793708			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21+/m0/s1	OOPGLCWBUZVAMU-CSODHUTKSA-N	497.210818064							95712
MLS003129573	LSM-7177	SID99357943, BRD-K25631986	44485755	InChI=1S/C28H44N8O4/c1-21-17-35(22(2)19-37)27(38)6-5-11-36-25(16-29-31-36)20-40-26(21)18-33(4)28(39)30-23-7-9-24(10-8-23)34-14-12-32(3)13-15-34/h7-10,16,21-22,26,37H,5-6,11-15,17-20H2,1-4H3,(H,30,39)/t21-,22+,26-/m1/s1	LMWGPKORGYIWNW-TVZXLZGTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K25631986	BRD-K25631986-001-02-2	Broad Institute of MIT and Harvard	BRD-K25631986			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H44N8O4/c1-21-17-35(22(2)19-37)27(38)6-5-11-36-25(16-29-31-36)20-40-26(21)18-33(4)28(39)30-23-7-9-24(10-8-23)34-14-12-32(3)13-15-34/h7-10,16,21-22,26,37H,5-6,11-15,17-20H2,1-4H3,(H,30,39)/t21-,22+,26-/m1/s1	LMWGPKORGYIWNW-TVZXLZGTSA-N	556.348551968							95798
BRD-K08043024	LSM-6960		44486366	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15-,19-/m1/s1	ZMFVFBQYBHAIKE-SPYBWZPUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K08043024	BRD-K08043024-001-01-7	Broad Institute of MIT and Harvard	BRD-K08043024			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15-,19-/m1/s1	ZMFVFBQYBHAIKE-SPYBWZPUSA-N	477.26996729							95581
BRD-K25348850	LSM-7172		44505040	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22-/m0/s1	HYDPWGICXZADLJ-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K25348850	BRD-K25348850-001-01-8	Broad Institute of MIT and Harvard	BRD-K25348850			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22-/m0/s1	HYDPWGICXZADLJ-SVMVAKDDSA-N	445.26890465							95793
BRD-K07473223	LSM-6954		44489270	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)9-6-10-29-12-18(26-27-29)15-34-21(16)13-28(3)23(33)25-20-8-5-4-7-19(20)24/h4-5,7-8,12,16-17,21,31H,6,9-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21-/m1/s1	UGDLKAPALXLDHQ-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K07473223	BRD-K07473223-001-01-6	Broad Institute of MIT and Harvard	BRD-K07473223			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)9-6-10-29-12-18(26-27-29)15-34-21(16)13-28(3)23(33)25-20-8-5-4-7-19(20)24/h4-5,7-8,12,16-17,21,31H,6,9-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21-/m1/s1	UGDLKAPALXLDHQ-CBGDNZLLSA-N	476.254731796							95575
BRD-K33454318	LSM-21978		54633523	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-7-6-10-26-12-19)17(2)15-34-22-11-20(27-18(3)30)8-9-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	GCQIYZLQWHNMPN-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3cccnc3	BroadT	BRD-K33454318	BRD-K33454318-001-01-0	Broad Institute of MIT and Harvard	BRD-K33454318			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1cccnc1	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-7-6-10-26-12-19)17(2)15-34-22-11-20(27-18(3)30)8-9-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	GCQIYZLQWHNMPN-YGKZAACZSA-N	468.237270164							110531
BRD-K42139332	LSM-21979		54633613	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17-,21+/m0/s1	NVAZGCBIIWIDIP-XGHQBKJUSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K42139332	BRD-K42139332-001-01-8	Broad Institute of MIT and Harvard	BRD-K42139332			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17-,21+/m0/s1	NVAZGCBIIWIDIP-XGHQBKJUSA-N	510.197061608							110532
BRD-K11942486	LSM-21980		54633770	InChI=1S/C27H35N3O6/c1-17-13-30(14-20-8-6-7-9-22(20)27(33)34)18(2)16-36-24-12-21(28-19(3)31)10-11-23(24)26(32)29(4)15-25(17)35-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)(H,33,34)/t17-,18+,25-/m0/s1	WQHRELCCFAZVAH-ATLLOTDBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3ccccc3C(=O)O)C[C@@H]1C	BroadT	BRD-K11942486	BRD-K11942486-001-01-6	Broad Institute of MIT and Harvard	BRD-K11942486			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2ccccc2C(O)=O)C[C@@H]1C	InChI=1S/C27H35N3O6/c1-17-13-30(14-20-8-6-7-9-22(20)27(33)34)18(2)16-36-24-12-21(28-19(3)31)10-11-23(24)26(32)29(4)15-25(17)35-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)(H,33,34)/t17-,18+,25-/m0/s1	WQHRELCCFAZVAH-ATLLOTDBSA-N	497.25258587							110533
BRD-K41047568	LSM-21981		54633528	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21+/m0/s1	HLZNZOORYNMGAS-XGHQBKJUSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K41047568	BRD-K41047568-001-01-9	Broad Institute of MIT and Harvard	BRD-K41047568			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H]1C)OC	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21+/m0/s1	HLZNZOORYNMGAS-XGHQBKJUSA-N	478.279134976							110534
BRD-K18268126	LSM-21982		54633697	InChI=1S/C25H32F3N5O4/c1-16-13-33(10-7-25(26,27)28)17(2)15-37-21-6-5-18(31-23(34)20-12-29-8-9-30-20)11-19(21)24(35)32(3)14-22(16)36-4/h5-6,8-9,11-12,16-17,22H,7,10,13-15H2,1-4H3,(H,31,34)/t16-,17-,22-/m1/s1	FJNIMBQBUGHQNO-DRSNIGMVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K18268126	BRD-K18268126-001-01-5	Broad Institute of MIT and Harvard	BRD-K18268126			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C25H32F3N5O4/c1-16-13-33(10-7-25(26,27)28)17(2)15-37-21-6-5-18(31-23(34)20-12-29-8-9-30-20)11-19(21)24(35)32(3)14-22(16)36-4/h5-6,8-9,11-12,16-17,22H,7,10,13-15H2,1-4H3,(H,31,34)/t16-,17-,22-/m1/s1	FJNIMBQBUGHQNO-DRSNIGMVSA-N	523.240639154							110535
BRD-K70924576	LSM-21983		54633565	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	BLKNSIVDUMMEFS-WZOHSFFVSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K70924576	BRD-K70924576-001-01-3	Broad Institute of MIT and Harvard	BRD-K70924576			COCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	BLKNSIVDUMMEFS-WZOHSFFVSA-N	489.320271506							110536
BRD-K11577431	LSM-21984		54633765	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17-,25-/m0/s1	BJYPLSOQEPUFOR-TZPNTHKFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3cc(F)ccc3F)C[C@@H]1C	BroadT	BRD-K11577431	BRD-K11577431-001-01-6	Broad Institute of MIT and Harvard	BRD-K11577431			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2cc(F)ccc2F)C[C@@H]1C	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17-,25-/m0/s1	BJYPLSOQEPUFOR-TZPNTHKFSA-N	489.243912966							110537
BRD-K24226959	LSM-21985		54633709	InChI=1S/C31H35F2N5O5/c1-19-16-38(31(41)36-24-10-6-8-22(33)14-24)20(2)18-43-27-12-11-25(15-26(27)29(39)37(3)17-28(19)42-4)35-30(40)34-23-9-5-7-21(32)13-23/h5-15,19-20,28H,16-18H2,1-4H3,(H,36,41)(H2,34,35,40)/t19-,20-,28-/m1/s1	FKCHYGGIXGVULC-NCXSOUSFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4cccc(F)c4	BroadT	BRD-K24226959	BRD-K24226959-001-01-7	Broad Institute of MIT and Harvard	BRD-K24226959			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1cccc(F)c1	InChI=1S/C31H35F2N5O5/c1-19-16-38(31(41)36-24-10-6-8-22(33)14-24)20(2)18-43-27-12-11-25(15-26(27)29(39)37(3)17-28(19)42-4)35-30(40)34-23-9-5-7-21(32)13-23/h5-15,19-20,28H,16-18H2,1-4H3,(H,36,41)(H2,34,35,40)/t19-,20-,28-/m1/s1	FKCHYGGIXGVULC-NCXSOUSFSA-N	595.26062567							110538
BRD-K54066059	LSM-21986		54633564	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	BLKNSIVDUMMEFS-FHAGJXEFSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K54066059	BRD-K54066059-001-01-9	Broad Institute of MIT and Harvard	BRD-K54066059			COCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	BLKNSIVDUMMEFS-FHAGJXEFSA-N	489.320271506							110539
BRD-K34264024	LSM-21987		54633635	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m1/s1	ZWIPCDYWVZDKTM-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K34264024	BRD-K34264024-001-01-7	Broad Institute of MIT and Harvard	BRD-K34264024			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m1/s1	ZWIPCDYWVZDKTM-NXMSCROESA-N	488.29987042							110540
BRD-K00620786	LSM-21988		54633569	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	BLKNSIVDUMMEFS-OHUGHZGNSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCCC3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K00620786	BRD-K00620786-001-01-8	Broad Institute of MIT and Harvard	BRD-K00620786			COCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCCC3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	BLKNSIVDUMMEFS-OHUGHZGNSA-N	489.320271506							110541
BRD-K43981353	LSM-21989		54633545	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19+,26+/m0/s1	AHCGLCWYVPJPSC-GNBJCERTSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K43981353	BRD-K43981353-001-01-6	Broad Institute of MIT and Harvard	BRD-K43981353			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19+,26+/m0/s1	AHCGLCWYVPJPSC-GNBJCERTSA-N	578.285282996							110542
BRD-K54476947	LSM-21990		54633695	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24+,31-/m1/s1	DZGZFXRKNSZUSK-ULPIOCOXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@H]1C	BroadT	BRD-K54476947	BRD-K54476947-001-01-6	Broad Institute of MIT and Harvard	BRD-K54476947			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc2ccc(cc2)-c2ccccn2)C[C@H]1C	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24+,31-/m1/s1	DZGZFXRKNSZUSK-ULPIOCOXSA-N	573.331504906							110543
BRD-K23543737	LSM-21991		54633708	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m1/s1	PVKMDQXGIZYRFS-HHJKRLRDSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K23543737	BRD-K23543737-001-01-5	Broad Institute of MIT and Harvard	BRD-K23543737			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m1/s1	PVKMDQXGIZYRFS-HHJKRLRDSA-N	485.268984862							110544
BRD-K34737616	LSM-21992		54633725	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	RZEAXGTWPWCQSI-WZOHSFFVSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K34737616	BRD-K34737616-001-01-6	Broad Institute of MIT and Harvard	BRD-K34737616			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	RZEAXGTWPWCQSI-WZOHSFFVSA-N	483.273321314							110545
BRD-K56563145	LSM-21993		54633575	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m0/s1	ZXTSYIHAQFFGAZ-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K56563145	BRD-K56563145-001-01-9	Broad Institute of MIT and Harvard	BRD-K56563145			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m0/s1	ZXTSYIHAQFFGAZ-MFEFFIJZSA-N	472.248583776							110546
BRD-K45908502	LSM-21994		54633594	InChI=1S/C22H32F3N3O4/c1-14-11-28(9-8-22(23,24)25)15(2)13-32-19-10-17(26-16(3)29)6-7-18(19)21(30)27(4)12-20(14)31-5/h6-7,10,14-15,20H,8-9,11-13H2,1-5H3,(H,26,29)/t14-,15-,20+/m0/s1	FSHTZNFJOZLSSX-AUSJPIAWSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K45908502	BRD-K45908502-001-01-7	Broad Institute of MIT and Harvard	BRD-K45908502			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C22H32F3N3O4/c1-14-11-28(9-8-22(23,24)25)15(2)13-32-19-10-17(26-16(3)29)6-7-18(19)21(30)27(4)12-20(14)31-5/h6-7,10,14-15,20H,8-9,11-13H2,1-5H3,(H,26,29)/t14-,15-,20+/m0/s1	FSHTZNFJOZLSSX-AUSJPIAWSA-N	459.234491134							110547
BRD-K47754225	LSM-21995		54633823	InChI=1S/C26H33N3O5/c1-17-14-29(19(3)30)18(2)16-34-23-13-21(27-25(31)20-9-7-6-8-10-20)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,31)/t17-,18-,24-/m0/s1	MYTMXMAZMZDXSF-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K47754225	BRD-K47754225-001-01-9	Broad Institute of MIT and Harvard	BRD-K47754225			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H33N3O5/c1-17-14-29(19(3)30)18(2)16-34-23-13-21(27-25(31)20-9-7-6-8-10-20)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,31)/t17-,18-,24-/m0/s1	MYTMXMAZMZDXSF-XFAGBWLFSA-N	467.242021186							110548
BRD-K39677043	LSM-21996		54633665	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20-,26+/m0/s1	ZQKSOPNYGIRHEN-CUVVAGTFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(CCc3ccccc3)C[C@@H]1C	BroadT	BRD-K39677043	BRD-K39677043-001-01-2	Broad Institute of MIT and Harvard	BRD-K39677043			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20-,26+/m0/s1	ZQKSOPNYGIRHEN-CUVVAGTFSA-N	467.278406694							110549
BRD-K89325755	LSM-21997		54633584	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18-,22-/m1/s1	ZDHXOKWVDFHFNO-JBYIUTFZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K89325755	BRD-K89325755-001-01-5	Broad Institute of MIT and Harvard	BRD-K89325755			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18-,22-/m1/s1	ZDHXOKWVDFHFNO-JBYIUTFZSA-N	475.214091876							131260
BRD-K13204142	LSM-21998		54633607	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21+,26+/m1/s1	KXFHRBKAIONQAO-SWYRRKHMSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K13204142	BRD-K13204142-001-01-5	Broad Institute of MIT and Harvard	BRD-K13204142			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21+,26+/m1/s1	KXFHRBKAIONQAO-SWYRRKHMSA-N	496.3049558							110553
BRD-K57894545	LSM-21999		54633602	InChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18+,23+/m1/s1	OOYNITMNEHZMFB-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(Cc3cccnc3)C[C@H]1C	BroadT	BRD-K57894545	BRD-K57894545-001-01-3	Broad Institute of MIT and Harvard	BRD-K57894545			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18+,23+/m1/s1	OOYNITMNEHZMFB-STSQHVNTSA-N	490.224990918							110554
BRD-K44292107	LSM-22000		54633768	InChI=1S/C27H35N3O6/c1-17-13-30(14-20-8-6-7-9-22(20)27(33)34)18(2)16-36-24-12-21(28-19(3)31)10-11-23(24)26(32)29(4)15-25(17)35-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)(H,33,34)/t17-,18-,25-/m1/s1	WQHRELCCFAZVAH-QJMRKGMQSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3ccccc3C(=O)O)C[C@H]1C	BroadT	BRD-K44292107	BRD-K44292107-001-01-6	Broad Institute of MIT and Harvard	BRD-K44292107			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2ccccc2C(O)=O)C[C@H]1C	InChI=1S/C27H35N3O6/c1-17-13-30(14-20-8-6-7-9-22(20)27(33)34)18(2)16-36-24-12-21(28-19(3)31)10-11-23(24)26(32)29(4)15-25(17)35-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)(H,33,34)/t17-,18-,25-/m1/s1	WQHRELCCFAZVAH-QJMRKGMQSA-N	497.25258587							110555
BRD-K85775326	LSM-22001		54633744	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15+,22-/m1/s1	XSWCXHAXMDYWQG-ZCCHDVMBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K85775326	BRD-K85775326-001-01-5	Broad Institute of MIT and Harvard	BRD-K85775326			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15+,22-/m1/s1	XSWCXHAXMDYWQG-ZCCHDVMBSA-N	472.232184784							110556
BRD-K99331577	LSM-22002		54633640	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m0/s1	BIISFJSDUGYLNA-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3ccncc3)C[C@@H]1C	BroadT	BRD-K99331577	BRD-K99331577-001-01-7	Broad Institute of MIT and Harvard	BRD-K99331577			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m0/s1	BIISFJSDUGYLNA-XFAGBWLFSA-N	454.258005608							110557
BRD-K36566880	LSM-22003		54633586	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18+,22+/m1/s1	ZDHXOKWVDFHFNO-FGSXEWAUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K36566880	BRD-K36566880-001-01-6	Broad Institute of MIT and Harvard	BRD-K36566880			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18+,22+/m1/s1	ZDHXOKWVDFHFNO-FGSXEWAUSA-N	475.214091876							110558
BRD-K29653370-001-01-8	LSM-22004	BRD-K29653370	54633507	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20+,29+/m1/s1	DXCXCRUBZQZACJ-IKDMDFKBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(Cc4cc(F)ccc4F)C[C@H]1C	BroadT	BRD-K29653370	BRD-K29653370-001-01-8	Broad Institute of MIT and Harvard	BRD-K29653370			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20+,29+/m1/s1	DXCXCRUBZQZACJ-IKDMDFKBSA-N	605.217126508							110559
BRD-K00631971	LSM-22005		54633721	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-12-19(27-24(30)26-18-8-6-5-7-9-18)10-11-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22-/m1/s1	QIMBDCVCKXPNLA-HYFFOGBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K00631971	BRD-K00631971-001-01-0	Broad Institute of MIT and Harvard	BRD-K00631971			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-12-19(27-24(30)26-18-8-6-5-7-9-18)10-11-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22-/m1/s1	QIMBDCVCKXPNLA-HYFFOGBASA-N	440.242355544							110560
BRD-K20714346	LSM-22006		54633760	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17-,25-/m1/s1	BJYPLSOQEPUFOR-RYUVBPIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@H]1C	BroadT	BRD-K20714346	BRD-K20714346-001-01-8	Broad Institute of MIT and Harvard	BRD-K20714346			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17-,25-/m1/s1	BJYPLSOQEPUFOR-RYUVBPIJSA-N	489.243912966							110561
BRD-K26734305	LSM-22007		54633724	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	RZEAXGTWPWCQSI-ZYLNGJIFSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K26734305	BRD-K26734305-001-01-9	Broad Institute of MIT and Harvard	BRD-K26734305			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	RZEAXGTWPWCQSI-ZYLNGJIFSA-N	483.273321314							110562
BRD-K74109014	LSM-22008		54633720	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-12-19(27-24(30)26-18-8-6-5-7-9-18)10-11-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22-/m0/s1	QIMBDCVCKXPNLA-JKSBSHDWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K74109014	BRD-K74109014-001-01-7	Broad Institute of MIT and Harvard	BRD-K74109014			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-12-19(27-24(30)26-18-8-6-5-7-9-18)10-11-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22-/m0/s1	QIMBDCVCKXPNLA-JKSBSHDWSA-N	440.242355544							110563
BRD-K19608763	LSM-22009		54633719	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-12-19(27-24(30)26-18-8-6-5-7-9-18)10-11-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22+/m1/s1	QIMBDCVCKXPNLA-JLHGSKIFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K19608763	BRD-K19608763-001-01-9	Broad Institute of MIT and Harvard	BRD-K19608763			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-12-19(27-24(30)26-18-8-6-5-7-9-18)10-11-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22+/m1/s1	QIMBDCVCKXPNLA-JLHGSKIFSA-N	440.242355544							110564
BRD-K30025024	LSM-22010		54633731	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18-,23+/m0/s1	LEPGJAGERZQBIM-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN3CCOCC3	BroadT	BRD-K30025024	BRD-K30025024-001-01-6	Broad Institute of MIT and Harvard	BRD-K30025024			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN1CCOCC1	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18-,23+/m0/s1	LEPGJAGERZQBIM-IUKKYPGJSA-N	490.279134976							110565
CHEMBL3182923	LSM-22011	BRD-K78612514	54633675	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25+/m0/s1	LJEPJNUBINCHMU-YYULODDRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3ccc(F)cc3)C[C@@H]1C	BroadT	BRD-K78612514	BRD-K78612514-001-01-1	Broad Institute of MIT and Harvard	BRD-K78612514			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2ccc(F)cc2)C[C@@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25+/m0/s1	LJEPJNUBINCHMU-YYULODDRSA-N	471.253334798							110566
BRD-K71298594	LSM-22012		54633791	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20+,26+/m1/s1	WIPGFEBUHVDPHK-GOHWNWGWSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccc(F)c3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K71298594	BRD-K71298594-001-01-9	Broad Institute of MIT and Harvard	BRD-K71298594			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccc(F)c3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20+,26+/m1/s1	WIPGFEBUHVDPHK-GOHWNWGWSA-N	499.284634926							110567
BRD-K39176069	LSM-22013		54633667	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20+,26+/m1/s1	ZQKSOPNYGIRHEN-GOHWNWGWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(CCc3ccccc3)C[C@H]1C	BroadT	BRD-K39176069	BRD-K39176069-001-01-4	Broad Institute of MIT and Harvard	BRD-K39176069			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20+,26+/m1/s1	ZQKSOPNYGIRHEN-GOHWNWGWSA-N	467.278406694							110568
BRD-K47164766	LSM-22014		54633659	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18-,24+/m0/s1	SKGDHEHUMDACHN-LLJLJFOGSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K47164766	BRD-K47164766-001-01-6	Broad Institute of MIT and Harvard	BRD-K47164766			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18-,24+/m0/s1	SKGDHEHUMDACHN-LLJLJFOGSA-N	515.243164038							110569
BRD-K22584556	LSM-22015		54633621	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25+/m1/s1	WLFCSTFPAYFGAE-GAKIBJFNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K22584556	BRD-K22584556-001-01-8	Broad Institute of MIT and Harvard	BRD-K22584556			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25+/m1/s1	WLFCSTFPAYFGAE-GAKIBJFNSA-N	497.25258587							110570
BRD-K43674766	LSM-22016		54633510	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20-,29-/m0/s1	DXCXCRUBZQZACJ-SGHJWQDXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(Cc4cc(F)ccc4F)C[C@@H]1C	BroadT	BRD-K43674766	BRD-K43674766-001-01-8	Broad Institute of MIT and Harvard	BRD-K43674766			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(Cc2cc(F)ccc2F)C[C@@H]1C	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20-,29-/m0/s1	DXCXCRUBZQZACJ-SGHJWQDXSA-N	605.217126508							110571
BRD-K00363054	LSM-22017		54633673	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25+/m1/s1	LJEPJNUBINCHMU-GAKIBJFNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3ccc(F)cc3)C[C@H]1C	BroadT	BRD-K00363054	BRD-K00363054-001-01-0	Broad Institute of MIT and Harvard	BRD-K00363054			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2ccc(F)cc2)C[C@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25+/m1/s1	LJEPJNUBINCHMU-GAKIBJFNSA-N	471.253334798							110572
BRD-K44004565	LSM-22018		54633749	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-8-6-7-9-23(20)28)19(2)16-36-24-12-21(29-26(32)17-34-4)10-11-22(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m0/s1	PGMRKFIOHDIEMF-MHPIHPPYSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccccc3F)[C@@H](C)COc2c1	BroadT	BRD-K44004565	BRD-K44004565-001-01-0	Broad Institute of MIT and Harvard	BRD-K44004565			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3F)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-8-6-7-9-23(20)28)19(2)16-36-24-12-21(29-26(32)17-34-4)10-11-22(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m0/s1	PGMRKFIOHDIEMF-MHPIHPPYSA-N	501.263899482							110573
BRD-K69487461	LSM-22019		54633718	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-12-19(27-24(30)26-18-8-6-5-7-9-18)10-11-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17-,22+/m0/s1	QIMBDCVCKXPNLA-PNLZDCPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K69487461	BRD-K69487461-001-01-2	Broad Institute of MIT and Harvard	BRD-K69487461			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-12-19(27-24(30)26-18-8-6-5-7-9-18)10-11-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17-,22+/m0/s1	QIMBDCVCKXPNLA-PNLZDCPESA-N	440.242355544							110574
BRD-K30071505	LSM-22020		54633616	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17+,21+/m0/s1	NVAZGCBIIWIDIP-CSODHUTKSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K30071505	BRD-K30071505-001-01-8	Broad Institute of MIT and Harvard	BRD-K30071505			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17+,21+/m0/s1	NVAZGCBIIWIDIP-CSODHUTKSA-N	510.197061608							110575
BRD-K73463737	LSM-22021		54633704	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m1/s1	PVKMDQXGIZYRFS-WYEJZRMESA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K73463737	BRD-K73463737-001-01-5	Broad Institute of MIT and Harvard	BRD-K73463737			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m1/s1	PVKMDQXGIZYRFS-WYEJZRMESA-N	485.268984862							110576
BRD-K65446780	LSM-22022		54633525	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-7-6-10-26-12-19)17(2)15-34-22-11-20(27-18(3)30)8-9-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	GCQIYZLQWHNMPN-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3cccnc3	BroadT	BRD-K65446780	BRD-K65446780-001-01-6	Broad Institute of MIT and Harvard	BRD-K65446780			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1cccnc1	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-7-6-10-26-12-19)17(2)15-34-22-11-20(27-18(3)30)8-9-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	GCQIYZLQWHNMPN-MFEFFIJZSA-N	468.237270164							110577
BRD-K15087476	LSM-22023		54633549	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16-,23+/m0/s1	ZNOAHICTVVWKDV-PBPSECFOSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K15087476	BRD-K15087476-001-01-8	Broad Institute of MIT and Harvard	BRD-K15087476			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16-,23+/m0/s1	ZNOAHICTVVWKDV-PBPSECFOSA-N	498.247834848							110578
BRD-K82397896	LSM-22024		54633810	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m0/s1	NUZAMTOBMKNCBP-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K82397896	BRD-K82397896-001-01-1	Broad Institute of MIT and Harvard	BRD-K82397896			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m0/s1	NUZAMTOBMKNCBP-WJONJSRFSA-N	458.232933712							110579
BRD-K19225848	LSM-22025		54633600	InChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23+/m1/s1	OOYNITMNEHZMFB-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3cccnc3)C[C@H]1C	BroadT	BRD-K19225848	BRD-K19225848-001-01-1	Broad Institute of MIT and Harvard	BRD-K19225848			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23+/m1/s1	OOYNITMNEHZMFB-PNCHPQGNSA-N	490.224990918							110580
BRD-K19045069	LSM-22026		54633758	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20+,26-/m1/s1	PWYLLXJABFYBFY-BVFVYWQFSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K19045069	BRD-K19045069-001-01-5	Broad Institute of MIT and Harvard	BRD-K19045069			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20+,26-/m1/s1	PWYLLXJABFYBFY-BVFVYWQFSA-N	513.283885998							110581
BRD-K15879529	LSM-22027		54633703	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m1/s1	PVKMDQXGIZYRFS-RRQZXNHTSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H]1C)OC	BroadT	BRD-K15879529	BRD-K15879529-001-01-5	Broad Institute of MIT and Harvard	BRD-K15879529			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m1/s1	PVKMDQXGIZYRFS-RRQZXNHTSA-N	485.268984862							110582
BRD-K25649596	LSM-22028		54633660	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18+,24+/m1/s1	SKGDHEHUMDACHN-YTZAWJCFSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K25649596	BRD-K25649596-001-01-8	Broad Institute of MIT and Harvard	BRD-K25649596			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18+,24+/m1/s1	SKGDHEHUMDACHN-YTZAWJCFSA-N	515.243164038							110583
BRD-K34311186	LSM-22029		54633774	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	LMAOWKPBCKGOJC-PNCHPQGNSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K34311186	BRD-K34311186-001-01-0	Broad Institute of MIT and Harvard	BRD-K34311186			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	LMAOWKPBCKGOJC-PNCHPQGNSA-N	485.26381927							110584
BRD-K30792491	LSM-22030		54633785	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m0/s1	NNNVUZWVJCJNJO-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H]1C	BroadT	BRD-K30792491	BRD-K30792491-001-01-5	Broad Institute of MIT and Harvard	BRD-K30792491			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m0/s1	NNNVUZWVJCJNJO-XFAGBWLFSA-N	454.258005608							110585
BRD-K02066524	LSM-22031		54633766	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17+,25-/m0/s1	BJYPLSOQEPUFOR-QLODZENZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@@H]1C	BroadT	BRD-K02066524	BRD-K02066524-001-01-9	Broad Institute of MIT and Harvard	BRD-K02066524			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@@H]1C	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17+,25-/m0/s1	BJYPLSOQEPUFOR-QLODZENZSA-N	489.243912966							110586
BRD-K33891642	LSM-22032		54633630	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24+/m1/s1	ZWIPCDYWVZDKTM-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K33891642	BRD-K33891642-001-01-0	Broad Institute of MIT and Harvard	BRD-K33891642			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24+/m1/s1	ZWIPCDYWVZDKTM-YTZAWJCFSA-N	488.29987042							110587
BRD-K50434315	LSM-22033		54633729	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18-,23-/m1/s1	LEPGJAGERZQBIM-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN3CCOCC3	BroadT	BRD-K50434315	BRD-K50434315-001-01-3	Broad Institute of MIT and Harvard	BRD-K50434315			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN1CCOCC1	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18-,23-/m1/s1	LEPGJAGERZQBIM-PMAPCBKXSA-N	490.279134976							110588
BRD-K71251432	LSM-22034		54633551	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16+,23+/m0/s1	ZNOAHICTVVWKDV-NXHTTZLHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K71251432	BRD-K71251432-001-01-4	Broad Institute of MIT and Harvard	BRD-K71251432			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16+,23+/m0/s1	ZNOAHICTVVWKDV-NXHTTZLHSA-N	498.247834848							110589
BRD-K97318603	LSM-22035		54633533	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20-,25-/m1/s1	XWLPDPDFVWQKHJ-UMEGOILYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K97318603	BRD-K97318603-001-01-4	Broad Institute of MIT and Harvard	BRD-K97318603			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20-,25-/m1/s1	XWLPDPDFVWQKHJ-UMEGOILYSA-N	525.295119398							110590
CHEMBL2357624	LSM-22036	SID131429958, BRD-K64730221	54633706	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m0/s1	PVKMDQXGIZYRFS-MHPIHPPYSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K64730221	BRD-K64730221-001-01-1	Broad Institute of MIT and Harvard	BRD-K64730221			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m0/s1	PVKMDQXGIZYRFS-MHPIHPPYSA-N	485.268984862							110591
BRD-K39752756	LSM-22037		54633649	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24-/m0/s1	SPZGDJFWGCVUSP-SRGWNRLKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K39752756	BRD-K39752756-001-01-0	Broad Institute of MIT and Harvard	BRD-K39752756			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24-/m0/s1	SPZGDJFWGCVUSP-SRGWNRLKSA-N	485.232599354							110592
BRD-K66748326	LSM-22038		54633539	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20+,25-/m0/s1	XWLPDPDFVWQKHJ-DFIYOIEZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K66748326	BRD-K66748326-001-01-5	Broad Institute of MIT and Harvard	BRD-K66748326			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20+,25-/m0/s1	XWLPDPDFVWQKHJ-DFIYOIEZSA-N	525.295119398							110593
BRD-K83115645	LSM-22039		54633566	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m0/s1	BLKNSIVDUMMEFS-RLSLOFABSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K83115645	BRD-K83115645-001-01-0	Broad Institute of MIT and Harvard	BRD-K83115645			COCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m0/s1	BLKNSIVDUMMEFS-RLSLOFABSA-N	489.320271506							110594
BRD-K70361311	LSM-22040		54633780	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m1/s1	NNNVUZWVJCJNJO-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H]1C	BroadT	BRD-K70361311	BRD-K70361311-001-01-8	Broad Institute of MIT and Harvard	BRD-K70361311			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m1/s1	NNNVUZWVJCJNJO-QZTZHPFYSA-N	454.258005608							110595
BRD-K41563239	LSM-22041		54633674	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25+/m1/s1	LJEPJNUBINCHMU-UZEJHQAJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3ccc(F)cc3)C[C@H]1C	BroadT	BRD-K41563239	BRD-K41563239-001-01-4	Broad Institute of MIT and Harvard	BRD-K41563239			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2ccc(F)cc2)C[C@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25+/m1/s1	LJEPJNUBINCHMU-UZEJHQAJSA-N	471.253334798							110596
BRD-K54351451	LSM-22042		54633811	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22-/m0/s1	NUZAMTOBMKNCBP-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K54351451	BRD-K54351451-001-01-9	Broad Institute of MIT and Harvard	BRD-K54351451			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22-/m0/s1	NUZAMTOBMKNCBP-WCJKSRRJSA-N	458.232933712							110597
BRD-K92022897	LSM-22043		54633686	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m0/s1	GJRFAEJZYRRRGG-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K92022897	BRD-K92022897-001-01-2	Broad Institute of MIT and Harvard	BRD-K92022897			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m0/s1	GJRFAEJZYRRRGG-IXFSTUDKSA-N	439.247106566							110598
BRD-K02393180	LSM-22044		54633789	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20-,26-/m1/s1	WIPGFEBUHVDPHK-XMERXJNXSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccc(F)c3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K02393180	BRD-K02393180-001-01-2	Broad Institute of MIT and Harvard	BRD-K02393180			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccc(F)c3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20-,26-/m1/s1	WIPGFEBUHVDPHK-XMERXJNXSA-N	499.284634926							110599
BRD-K42333498	LSM-22045		54633601	InChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23+/m0/s1	OOYNITMNEHZMFB-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(Cc3cccnc3)C[C@@H]1C	BroadT	BRD-K42333498	BRD-K42333498-001-01-7	Broad Institute of MIT and Harvard	BRD-K42333498			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23+/m0/s1	OOYNITMNEHZMFB-IUKKYPGJSA-N	490.224990918							110600
BRD-K14207150	LSM-22046		54633736	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18+,23-/m1/s1	LEPGJAGERZQBIM-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CN3CCOCC3	BroadT	BRD-K14207150	BRD-K14207150-001-01-6	Broad Institute of MIT and Harvard	BRD-K14207150			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CN1CCOCC1	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18+,23-/m1/s1	LEPGJAGERZQBIM-IEGUWTFLSA-N	490.279134976							110601
BRD-K50919513	LSM-22047		54633638	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m0/s1	BIISFJSDUGYLNA-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3ccncc3)C[C@@H]1C	BroadT	BRD-K50919513	BRD-K50919513-001-01-3	Broad Institute of MIT and Harvard	BRD-K50919513			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m0/s1	BIISFJSDUGYLNA-LLJLJFOGSA-N	454.258005608							110602
BRD-K10160311	LSM-22048		54633596	InChI=1S/C22H32F3N3O4/c1-14-11-28(9-8-22(23,24)25)15(2)13-32-19-10-17(26-16(3)29)6-7-18(19)21(30)27(4)12-20(14)31-5/h6-7,10,14-15,20H,8-9,11-13H2,1-5H3,(H,26,29)/t14-,15+,20-/m0/s1	FSHTZNFJOZLSSX-MDOVXXIYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K10160311	BRD-K10160311-001-01-7	Broad Institute of MIT and Harvard	BRD-K10160311			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C22H32F3N3O4/c1-14-11-28(9-8-22(23,24)25)15(2)13-32-19-10-17(26-16(3)29)6-7-18(19)21(30)27(4)12-20(14)31-5/h6-7,10,14-15,20H,8-9,11-13H2,1-5H3,(H,26,29)/t14-,15+,20-/m0/s1	FSHTZNFJOZLSSX-MDOVXXIYSA-N	459.234491134							110603
BRD-K40494117	LSM-22049		54633714	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23+/m0/s1	KVPJAUDUDGITLT-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K40494117	BRD-K40494117-001-01-0	Broad Institute of MIT and Harvard	BRD-K40494117			CO[C@H]1[C@@H](C)CN(C)[C@H](C)COc2cc(ccc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23+/m0/s1	KVPJAUDUDGITLT-YZZKKUAISA-N	475.214091876							110604
BRD-K28455914	LSM-22050		54633677	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25-/m1/s1	LJEPJNUBINCHMU-QJMRKGMQSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3ccc(F)cc3)C[C@H]1C	BroadT	BRD-K28455914	BRD-K28455914-001-01-2	Broad Institute of MIT and Harvard	BRD-K28455914			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2ccc(F)cc2)C[C@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25-/m1/s1	LJEPJNUBINCHMU-QJMRKGMQSA-N	471.253334798							110605
BRD-K86073842	LSM-22051		54633571	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m0/s1	ZXTSYIHAQFFGAZ-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K86073842	BRD-K86073842-001-01-9	Broad Institute of MIT and Harvard	BRD-K86073842			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m0/s1	ZXTSYIHAQFFGAZ-HKARXFIJSA-N	472.248583776							110606
BRD-K36662285	LSM-22052		54633626	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25-/m0/s1	WLFCSTFPAYFGAE-ATLLOTDBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K36662285	BRD-K36662285-001-01-4	Broad Institute of MIT and Harvard	BRD-K36662285			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25-/m0/s1	WLFCSTFPAYFGAE-ATLLOTDBSA-N	497.25258587							110607
BRD-K44936922	LSM-22053		54633612	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17-,21-/m1/s1	NVAZGCBIIWIDIP-CBGDNZLLSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K44936922	BRD-K44936922-001-01-1	Broad Institute of MIT and Harvard	BRD-K44936922			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17-,21-/m1/s1	NVAZGCBIIWIDIP-CBGDNZLLSA-N	510.197061608							110608
BRD-K45044525	LSM-22054		54633786	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m0/s1	NNNVUZWVJCJNJO-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H]1C	BroadT	BRD-K45044525	BRD-K45044525-001-01-4	Broad Institute of MIT and Harvard	BRD-K45044525			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m0/s1	NNNVUZWVJCJNJO-RHGYRFJNSA-N	454.258005608							110609
BRD-K23204256	LSM-22055		54633514	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18-,23+/m1/s1	BHMAENWMFITTIK-PNCHPQGNSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K23204256	BRD-K23204256-001-01-5	Broad Institute of MIT and Harvard	BRD-K23204256			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18-,23+/m1/s1	BHMAENWMFITTIK-PNCHPQGNSA-N	497.26381927							110610
BRD-K31896531	LSM-22056		54633591	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18+,22-/m1/s1	ZDHXOKWVDFHFNO-KGVIQGDOSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K31896531	BRD-K31896531-001-01-5	Broad Institute of MIT and Harvard	BRD-K31896531			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18+,22-/m1/s1	ZDHXOKWVDFHFNO-KGVIQGDOSA-N	475.214091876							110611
BRD-K32485819	LSM-22057		54633605	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21-,26+/m1/s1	KXFHRBKAIONQAO-YPCDYVTLSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K32485819	BRD-K32485819-001-01-9	Broad Institute of MIT and Harvard	BRD-K32485819			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21-,26+/m1/s1	KXFHRBKAIONQAO-YPCDYVTLSA-N	496.3049558							110612
BRD-K76980944	LSM-22058		54633609	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21-,26-/m1/s1	KXFHRBKAIONQAO-IPVFLDMMSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K76980944	BRD-K76980944-001-01-4	Broad Institute of MIT and Harvard	BRD-K76980944			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21-,26-/m1/s1	KXFHRBKAIONQAO-IPVFLDMMSA-N	496.3049558							110613
MLS003650052	LSM-22059	BRD-K22591777	53382709	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16-,23+/m1/s1	ZNOAHICTVVWKDV-LNPFQXMTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K22591777	BRD-K22591777-001-01-6	Broad Institute of MIT and Harvard	BRD-K22591777			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16-,23+/m1/s1	ZNOAHICTVVWKDV-LNPFQXMTSA-N	498.247834848							110614
BRD-K87269010	LSM-22060		54633690	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24-,31+/m1/s1	DZGZFXRKNSZUSK-GQIGMWPISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@H]1C	BroadT	BRD-K87269010	BRD-K87269010-001-01-8	Broad Institute of MIT and Harvard	BRD-K87269010			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc2ccc(cc2)-c2ccccn2)C[C@H]1C	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24-,31+/m1/s1	DZGZFXRKNSZUSK-GQIGMWPISA-N	573.331504906							110615
BRD-K74916896	LSM-22061		54633537	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20+,25+/m0/s1	XWLPDPDFVWQKHJ-WZOHSFFVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K74916896	BRD-K74916896-001-01-8	Broad Institute of MIT and Harvard	BRD-K74916896			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20+,25+/m0/s1	XWLPDPDFVWQKHJ-WZOHSFFVSA-N	525.295119398							110616
BRD-K77252933	LSM-22062		54633592	InChI=1S/C22H32F3N3O4/c1-14-11-28(9-8-22(23,24)25)15(2)13-32-19-10-17(26-16(3)29)6-7-18(19)21(30)27(4)12-20(14)31-5/h6-7,10,14-15,20H,8-9,11-13H2,1-5H3,(H,26,29)/t14-,15-,20-/m1/s1	FSHTZNFJOZLSSX-STXHMFSFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K77252933	BRD-K77252933-001-01-0	Broad Institute of MIT and Harvard	BRD-K77252933			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C22H32F3N3O4/c1-14-11-28(9-8-22(23,24)25)15(2)13-32-19-10-17(26-16(3)29)6-7-18(19)21(30)27(4)12-20(14)31-5/h6-7,10,14-15,20H,8-9,11-13H2,1-5H3,(H,26,29)/t14-,15-,20-/m1/s1	FSHTZNFJOZLSSX-STXHMFSFSA-N	459.234491134							110617
BRD-K58245454	LSM-22063		54633527	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21+/m1/s1	HLZNZOORYNMGAS-LZJOCLMNSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H]1C)OC	BroadT	BRD-K58245454	BRD-K58245454-001-01-6	Broad Institute of MIT and Harvard	BRD-K58245454			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H]1C)OC	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21+/m1/s1	HLZNZOORYNMGAS-LZJOCLMNSA-N	478.279134976							110618
BRD-K67082570	LSM-22064		54633691	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24+,31+/m1/s1	DZGZFXRKNSZUSK-OXYPMYLPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@H]1C	BroadT	BRD-K67082570	BRD-K67082570-001-01-1	Broad Institute of MIT and Harvard	BRD-K67082570			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc2ccc(cc2)-c2ccccn2)C[C@H]1C	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24+,31+/m1/s1	DZGZFXRKNSZUSK-OXYPMYLPSA-N	573.331504906							110619
BRD-K96175856	LSM-22065		54633526	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21-/m1/s1	HLZNZOORYNMGAS-CBGDNZLLSA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H]1C)OC	BroadT	BRD-K96175856	BRD-K96175856-001-01-3	Broad Institute of MIT and Harvard	BRD-K96175856			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H]1C)OC	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17-,21-/m1/s1	HLZNZOORYNMGAS-CBGDNZLLSA-N	478.279134976							110620
BRD-K02230174	LSM-22066		54633676	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25-/m0/s1	LJEPJNUBINCHMU-RPPIVITFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3ccc(F)cc3)C[C@@H]1C	BroadT	BRD-K02230174	BRD-K02230174-001-01-4	Broad Institute of MIT and Harvard	BRD-K02230174			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2ccc(F)cc2)C[C@@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25-/m0/s1	LJEPJNUBINCHMU-RPPIVITFSA-N	471.253334798							110621
BRD-K97746859	LSM-22067		54633698	InChI=1S/C25H35N3O7S2/c1-17-9-7-8-10-24(17)37(32,33)26-20-11-12-21-22(13-20)35-16-19(3)28(36(6,30)31)14-18(2)23(34-5)15-27(4)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19-,23-/m1/s1	OWRIETMUXQHNFA-DNVFCKCGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K97746859	BRD-K97746859-001-01-7	Broad Institute of MIT and Harvard	BRD-K97746859			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C25H35N3O7S2/c1-17-9-7-8-10-24(17)37(32,33)26-20-11-12-21-22(13-20)35-16-19(3)28(36(6,30)31)14-18(2)23(34-5)15-27(4)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19-,23-/m1/s1	OWRIETMUXQHNFA-DNVFCKCGSA-N	553.19164187							110622
BRD-K39193666	LSM-22068		54633682	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m1/s1	GJRFAEJZYRRRGG-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K39193666	BRD-K39193666-001-01-6	Broad Institute of MIT and Harvard	BRD-K39193666			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m1/s1	GJRFAEJZYRRRGG-STSQHVNTSA-N	439.247106566							110623
BRD-K97569931	LSM-22069		54633787	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m1/s1	NNNVUZWVJCJNJO-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3ccccn3)C[C@H]1C	BroadT	BRD-K97569931	BRD-K97569931-001-01-5	Broad Institute of MIT and Harvard	BRD-K97569931			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m1/s1	NNNVUZWVJCJNJO-NXMSCROESA-N	454.258005608							110624
BRD-K59402582	LSM-22070		54633746	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-8-6-7-9-23(20)28)19(2)16-36-24-12-21(29-26(32)17-34-4)10-11-22(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m1/s1	PGMRKFIOHDIEMF-RRQZXNHTSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccccc3F)[C@H](C)COc2c1	BroadT	BRD-K59402582	BRD-K59402582-001-01-7	Broad Institute of MIT and Harvard	BRD-K59402582			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-8-6-7-9-23(20)28)19(2)16-36-24-12-21(29-26(32)17-34-4)10-11-22(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m1/s1	PGMRKFIOHDIEMF-RRQZXNHTSA-N	501.263899482							110625
BRD-K30738175	LSM-22071		54633683	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m0/s1	GJRFAEJZYRRRGG-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K30738175	BRD-K30738175-001-01-1	Broad Institute of MIT and Harvard	BRD-K30738175			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m0/s1	GJRFAEJZYRRRGG-YZZKKUAISA-N	439.247106566							110626
BRD-K48436333	LSM-22072		54633821	InChI=1S/C26H33N3O5/c1-17-14-29(19(3)30)18(2)16-34-23-13-21(27-25(31)20-9-7-6-8-10-20)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,31)/t17-,18-,24+/m1/s1	MYTMXMAZMZDXSF-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K48436333	BRD-K48436333-001-01-1	Broad Institute of MIT and Harvard	BRD-K48436333			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33N3O5/c1-17-14-29(19(3)30)18(2)16-34-23-13-21(27-25(31)20-9-7-6-8-10-20)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,31)/t17-,18-,24+/m1/s1	MYTMXMAZMZDXSF-GGUMNFRJSA-N	467.242021186							110627
BRD-K04095185	LSM-22073		54633750	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-8-6-7-9-23(20)28)19(2)16-36-24-12-21(29-26(32)17-34-4)10-11-22(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m1/s1	PGMRKFIOHDIEMF-HHJKRLRDSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccc3F)[C@@H](C)COc2c1	BroadT	BRD-K04095185	BRD-K04095185-001-01-6	Broad Institute of MIT and Harvard	BRD-K04095185			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-8-6-7-9-23(20)28)19(2)16-36-24-12-21(29-26(32)17-34-4)10-11-22(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m1/s1	PGMRKFIOHDIEMF-HHJKRLRDSA-N	501.263899482							110628
BRD-K21356734	LSM-22074		54633576	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m1/s1	ZXTSYIHAQFFGAZ-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K21356734	BRD-K21356734-001-01-7	Broad Institute of MIT and Harvard	BRD-K21356734			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m1/s1	ZXTSYIHAQFFGAZ-SAHWJRBASA-N	472.248583776							110629
BRD-K31510624	LSM-22075		54633792	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20-,26+/m1/s1	WIPGFEBUHVDPHK-KYTVRQNUSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccc(F)c3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K31510624	BRD-K31510624-001-01-0	Broad Institute of MIT and Harvard	BRD-K31510624			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccc(F)c3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20-,26+/m1/s1	WIPGFEBUHVDPHK-KYTVRQNUSA-N	499.284634926							110630
BRD-K23617623	LSM-22076		54633650	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24-/m1/s1	SPZGDJFWGCVUSP-XVTZWQNCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K23617623	BRD-K23617623-001-01-4	Broad Institute of MIT and Harvard	BRD-K23617623			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24-/m1/s1	SPZGDJFWGCVUSP-XVTZWQNCSA-N	485.232599354							110631
BRD-K12226398	LSM-22077		54633767	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17+,25-/m1/s1	BJYPLSOQEPUFOR-LEHBWIKQSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3cc(F)ccc3F)C[C@H]1C	BroadT	BRD-K12226398	BRD-K12226398-001-01-0	Broad Institute of MIT and Harvard	BRD-K12226398			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17+,25-/m1/s1	BJYPLSOQEPUFOR-LEHBWIKQSA-N	489.243912966							110632
BRD-K90882192	LSM-22078		54633783	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m1/s1	NNNVUZWVJCJNJO-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H]1C	BroadT	BRD-K90882192	BRD-K90882192-001-01-3	Broad Institute of MIT and Harvard	BRD-K90882192			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m1/s1	NNNVUZWVJCJNJO-GGUMNFRJSA-N	454.258005608							110633
BRD-K39224209	LSM-22079		54633518	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18-,23-/m1/s1	BHMAENWMFITTIK-PMAPCBKXSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K39224209	BRD-K39224209-001-01-3	Broad Institute of MIT and Harvard	BRD-K39224209			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18-,23-/m1/s1	BHMAENWMFITTIK-PMAPCBKXSA-N	497.26381927							110634
BRD-K42732309	LSM-22080		54633712	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23+/m0/s1	KVPJAUDUDGITLT-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K42732309	BRD-K42732309-001-01-9	Broad Institute of MIT and Harvard	BRD-K42732309			CO[C@H]1[C@@H](C)CN(C)[C@@H](C)COc2cc(ccc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23+/m0/s1	KVPJAUDUDGITLT-IUKKYPGJSA-N	475.214091876							110635
BRD-K43206373	LSM-22081		54633778	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	LMAOWKPBCKGOJC-IXFSTUDKSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K43206373	BRD-K43206373-001-01-4	Broad Institute of MIT and Harvard	BRD-K43206373			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	LMAOWKPBCKGOJC-IXFSTUDKSA-N	485.26381927							110636
BRD-K50053371	LSM-22082		54633692	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24+,31+/m0/s1	DZGZFXRKNSZUSK-BKZGZDJESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@@H]1C	BroadT	BRD-K50053371	BRD-K50053371-001-01-2	Broad Institute of MIT and Harvard	BRD-K50053371			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc2ccc(cc2)-c2ccccn2)C[C@@H]1C	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24+,31+/m0/s1	DZGZFXRKNSZUSK-BKZGZDJESA-N	573.331504906							110637
BRD-K62718031	LSM-22083		54633509	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20+,29+/m0/s1	DXCXCRUBZQZACJ-HQLBTAIYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(Cc4cc(F)ccc4F)C[C@@H]1C	BroadT	BRD-K62718031	BRD-K62718031-001-01-8	Broad Institute of MIT and Harvard	BRD-K62718031			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@@H]1C	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20+,29+/m0/s1	DXCXCRUBZQZACJ-HQLBTAIYSA-N	605.217126508							110638
BRD-K28916436	LSM-22084		54633553	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16+,23-/m0/s1	ZNOAHICTVVWKDV-PXAQALGRSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K28916436	BRD-K28916436-001-01-2	Broad Institute of MIT and Harvard	BRD-K28916436			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16+,23-/m0/s1	ZNOAHICTVVWKDV-PXAQALGRSA-N	498.247834848							110639
BRD-K35124958	LSM-22085		54633516	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18+,23+/m0/s1	BHMAENWMFITTIK-YZZKKUAISA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K35124958	BRD-K35124958-001-01-2	Broad Institute of MIT and Harvard	BRD-K35124958			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18+,23+/m0/s1	BHMAENWMFITTIK-YZZKKUAISA-N	497.26381927							110640
BRD-K41946683	LSM-22086		54633557	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20-,27+/m0/s1	MBZIAPCTYFYNLY-OWOAZTCBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K41946683	BRD-K41946683-001-01-2	Broad Institute of MIT and Harvard	BRD-K41946683			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20-,27+/m0/s1	MBZIAPCTYFYNLY-OWOAZTCBSA-N	509.288971378							110641
BRD-K63583636	LSM-22087		54633737	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15-,22-/m1/s1	XSWCXHAXMDYWQG-DOQJBMMISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K63583636	BRD-K63583636-001-01-4	Broad Institute of MIT and Harvard	BRD-K63583636			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15-,22-/m1/s1	XSWCXHAXMDYWQG-DOQJBMMISA-N	472.232184784							110642
BRD-K88620071	LSM-22088		54633754	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20-,26+/m1/s1	PWYLLXJABFYBFY-KYTVRQNUSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K88620071	BRD-K88620071-001-01-7	Broad Institute of MIT and Harvard	BRD-K88620071			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20-,26+/m1/s1	PWYLLXJABFYBFY-KYTVRQNUSA-N	513.283885998							110643
BRD-K95922469	LSM-22089		54633775	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	LMAOWKPBCKGOJC-YZZKKUAISA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K95922469	BRD-K95922469-001-01-8	Broad Institute of MIT and Harvard	BRD-K95922469			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	LMAOWKPBCKGOJC-YZZKKUAISA-N	485.26381927							110644
BRD-K35587518	LSM-22090		54633562	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	BLKNSIVDUMMEFS-ZYLNGJIFSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K35587518	BRD-K35587518-001-01-3	Broad Institute of MIT and Harvard	BRD-K35587518			COCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCCC3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	BLKNSIVDUMMEFS-ZYLNGJIFSA-N	489.320271506							110645
BRD-K87358945	LSM-22091		54633610	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21+,26-/m0/s1	KXFHRBKAIONQAO-UZINWLIJSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K87358945	BRD-K87358945-001-01-9	Broad Institute of MIT and Harvard	BRD-K87358945			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21+,26-/m0/s1	KXFHRBKAIONQAO-UZINWLIJSA-N	496.3049558							110646
BRD-K89121101	LSM-22092		54633598	InChI=1S/C26H36N4O4/c1-6-13-30-15-18(2)24(33-5)16-29(4)26(32)21-11-10-20(14-23(21)34-17-19(30)3)28-25(31)22-9-7-8-12-27-22/h7-12,14,18-19,24H,6,13,15-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m1/s1	GANURQYVLISRBS-KHCICDEESA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@H]1C)OC	BroadT	BRD-K89121101	BRD-K89121101-001-01-9	Broad Institute of MIT and Harvard	BRD-K89121101			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@H]1C)OC	InChI=1S/C26H36N4O4/c1-6-13-30-15-18(2)24(33-5)16-29(4)26(32)21-11-10-20(14-23(21)34-17-19(30)3)28-25(31)22-9-7-8-12-27-22/h7-12,14,18-19,24H,6,13,15-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m1/s1	GANURQYVLISRBS-KHCICDEESA-N	468.273655672							110647
BRD-K11477112	LSM-22093		54633540	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20+,25-/m1/s1	XWLPDPDFVWQKHJ-OHUGHZGNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K11477112	BRD-K11477112-001-01-5	Broad Institute of MIT and Harvard	BRD-K11477112			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20+,25-/m1/s1	XWLPDPDFVWQKHJ-OHUGHZGNSA-N	525.295119398							110648
BRD-K99807388	LSM-22094		54633641	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m1/s1	BIISFJSDUGYLNA-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3ccncc3)C[C@H]1C	BroadT	BRD-K99807388	BRD-K99807388-001-01-5	Broad Institute of MIT and Harvard	BRD-K99807388			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m1/s1	BIISFJSDUGYLNA-NXMSCROESA-N	454.258005608							110649
BRD-K53094739-001-01-0	LSM-22095	BRD-K53094739	54633529	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21+/m1/s1	HLZNZOORYNMGAS-WWMYMODYSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K53094739	BRD-K53094739-001-01-0	Broad Institute of MIT and Harvard	BRD-K53094739			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H]1C)OC	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21+/m1/s1	HLZNZOORYNMGAS-WWMYMODYSA-N	478.279134976							110650
BRD-K75416889	LSM-22096		54633558	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20+,27+/m1/s1	MBZIAPCTYFYNLY-JVAFGIKQSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K75416889	BRD-K75416889-001-01-7	Broad Institute of MIT and Harvard	BRD-K75416889			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20+,27+/m1/s1	MBZIAPCTYFYNLY-JVAFGIKQSA-N	509.288971378							110651
BRD-K53104784	LSM-22097		54633672	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25+/m0/s1	LJEPJNUBINCHMU-DPOKWSEZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3ccc(F)cc3)C[C@@H]1C	BroadT	BRD-K53104784	BRD-K53104784-001-01-1	Broad Institute of MIT and Harvard	BRD-K53104784			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2ccc(F)cc2)C[C@@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25+/m0/s1	LJEPJNUBINCHMU-DPOKWSEZSA-N	471.253334798							110652
BRD-K89377615	LSM-22098		54633669	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20-,26-/m0/s1	ZQKSOPNYGIRHEN-DYLHXGEVSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(CCc3ccccc3)C[C@@H]1C	BroadT	BRD-K89377615	BRD-K89377615-001-01-6	Broad Institute of MIT and Harvard	BRD-K89377615			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20-,26-/m0/s1	ZQKSOPNYGIRHEN-DYLHXGEVSA-N	467.278406694							110653
BRD-K57507729	LSM-22099		54633813	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	NUZAMTOBMKNCBP-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K57507729	BRD-K57507729-001-01-9	Broad Institute of MIT and Harvard	BRD-K57507729			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	NUZAMTOBMKNCBP-ZMPRRUGASA-N	458.232933712							110654
BRD-K81660107	LSM-22100		54633800	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24-,31-/m1/s1	JEZVAYALKLQWEA-OVMXQCPESA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccc(cc3)c4ccccn4)[C@H](C)COc2c1	BroadT	BRD-K81660107	BRD-K81660107-001-01-8	Broad Institute of MIT and Harvard	BRD-K81660107			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24-,31-/m1/s1	JEZVAYALKLQWEA-OVMXQCPESA-N	558.320605864							110655
BRD-K88086273	LSM-22101		54633658	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18-,24+/m1/s1	SKGDHEHUMDACHN-GGUMNFRJSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K88086273	BRD-K88086273-001-01-7	Broad Institute of MIT and Harvard	BRD-K88086273			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18-,24+/m1/s1	SKGDHEHUMDACHN-GGUMNFRJSA-N	515.243164038							110656
BRD-K55142307	LSM-22102		54633804	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24+,31+/m0/s1	JEZVAYALKLQWEA-BKZGZDJESA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccc(cc3)c4ccccn4)[C@H](C)COc2c1	BroadT	BRD-K55142307	BRD-K55142307-001-01-7	Broad Institute of MIT and Harvard	BRD-K55142307			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24+,31+/m0/s1	JEZVAYALKLQWEA-BKZGZDJESA-N	558.320605864							110657
BRD-K96671994	LSM-22103		54633710	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23-/m1/s1	KVPJAUDUDGITLT-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K96671994	BRD-K96671994-001-01-4	Broad Institute of MIT and Harvard	BRD-K96671994			CO[C@H]1[C@H](C)CN(C)[C@H](C)COc2cc(ccc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23-/m1/s1	KVPJAUDUDGITLT-PMAPCBKXSA-N	475.214091876							110658
BRD-K24494475	LSM-22104		54633615	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17-,21+/m1/s1	NVAZGCBIIWIDIP-LZJOCLMNSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K24494475	BRD-K24494475-001-01-6	Broad Institute of MIT and Harvard	BRD-K24494475			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17-,21+/m1/s1	NVAZGCBIIWIDIP-LZJOCLMNSA-N	510.197061608							110659
BRD-K54151058	LSM-22105		54633662	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18+,24-/m0/s1	SKGDHEHUMDACHN-RHGYRFJNSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K54151058	BRD-K54151058-001-01-0	Broad Institute of MIT and Harvard	BRD-K54151058			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18+,24-/m0/s1	SKGDHEHUMDACHN-RHGYRFJNSA-N	515.243164038							110660
BRD-K20288742	LSM-22106		54633614	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17+,21+/m1/s1	NVAZGCBIIWIDIP-WWMYMODYSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K20288742	BRD-K20288742-001-01-3	Broad Institute of MIT and Harvard	BRD-K20288742			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17+,21+/m1/s1	NVAZGCBIIWIDIP-WWMYMODYSA-N	510.197061608							110661
BRD-K92565319	LSM-22107		54633688	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24-,31-/m1/s1	DZGZFXRKNSZUSK-OVMXQCPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@H]1C	BroadT	BRD-K92565319	BRD-K92565319-001-01-0	Broad Institute of MIT and Harvard	BRD-K92565319			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc2ccc(cc2)-c2ccccn2)C[C@H]1C	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24-,31-/m1/s1	DZGZFXRKNSZUSK-OVMXQCPESA-N	573.331504906							110662
BRD-K31460017	LSM-22108		54633679	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25-/m1/s1	LJEPJNUBINCHMU-FUMQJTLXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3ccc(F)cc3)C[C@H]1C	BroadT	BRD-K31460017	BRD-K31460017-001-01-3	Broad Institute of MIT and Harvard	BRD-K31460017			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2ccc(F)cc2)C[C@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25-/m1/s1	LJEPJNUBINCHMU-FUMQJTLXSA-N	471.253334798							110663
BRD-K85216683	LSM-22109		54633619	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17+,21-/m1/s1	NVAZGCBIIWIDIP-LLGFUMIMSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K85216683	BRD-K85216683-001-01-7	Broad Institute of MIT and Harvard	BRD-K85216683			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17+,21-/m1/s1	NVAZGCBIIWIDIP-LLGFUMIMSA-N	510.197061608							110664
BRD-K44121468	LSM-22110		54633812	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	NUZAMTOBMKNCBP-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K44121468	BRD-K44121468-001-01-0	Broad Institute of MIT and Harvard	BRD-K44121468			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	NUZAMTOBMKNCBP-DMPWYTOCSA-N	458.232933712							110665
BRD-K74259627	LSM-22111		54633727	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	RZEAXGTWPWCQSI-DFIYOIEZSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K74259627	BRD-K74259627-001-01-9	Broad Institute of MIT and Harvard	BRD-K74259627			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	RZEAXGTWPWCQSI-DFIYOIEZSA-N	483.273321314							110666
BRD-K96449536	LSM-22112		54633637	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m1/s1	BIISFJSDUGYLNA-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3ccncc3)C[C@H]1C	BroadT	BRD-K96449536	BRD-K96449536-001-01-0	Broad Institute of MIT and Harvard	BRD-K96449536			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m1/s1	BIISFJSDUGYLNA-GGUMNFRJSA-N	454.258005608							110667
BRD-K81757081	LSM-22113		54633735	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18+,23-/m0/s1	LEPGJAGERZQBIM-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN3CCOCC3	BroadT	BRD-K81757081	BRD-K81757081-001-01-2	Broad Institute of MIT and Harvard	BRD-K81757081			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN1CCOCC1	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18+,23-/m0/s1	LEPGJAGERZQBIM-IXFSTUDKSA-N	490.279134976							110668
BRD-K85580909	LSM-22114		54633657	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18-,24-/m1/s1	SKGDHEHUMDACHN-QZTZHPFYSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K85580909	BRD-K85580909-001-01-4	Broad Institute of MIT and Harvard	BRD-K85580909			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18-,24-/m1/s1	SKGDHEHUMDACHN-QZTZHPFYSA-N	515.243164038							110669
BRD-K01148617	LSM-22115		54633687	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m1/s1	GJRFAEJZYRRRGG-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K01148617	BRD-K01148617-001-01-4	Broad Institute of MIT and Harvard	BRD-K01148617			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m1/s1	GJRFAEJZYRRRGG-IEGUWTFLSA-N	439.247106566							110670
BRD-K31546068	LSM-22116		54633544	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19+,26+/m1/s1	AHCGLCWYVPJPSC-MVYHEMRASA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K31546068	BRD-K31546068-001-01-7	Broad Institute of MIT and Harvard	BRD-K31546068			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19+,26+/m1/s1	AHCGLCWYVPJPSC-MVYHEMRASA-N	578.285282996							110671
BRD-K16551475	LSM-22117		54633559	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20+,27+/m0/s1	MBZIAPCTYFYNLY-ASHZAFPQSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K16551475	BRD-K16551475-001-01-3	Broad Institute of MIT and Harvard	BRD-K16551475			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20+,27+/m0/s1	MBZIAPCTYFYNLY-ASHZAFPQSA-N	509.288971378							110672
BRD-K34957967	LSM-22118		54633593	InChI=1S/C22H32F3N3O4/c1-14-11-28(9-8-22(23,24)25)15(2)13-32-19-10-17(26-16(3)29)6-7-18(19)21(30)27(4)12-20(14)31-5/h6-7,10,14-15,20H,8-9,11-13H2,1-5H3,(H,26,29)/t14-,15-,20+/m1/s1	FSHTZNFJOZLSSX-SXGZJXTBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K34957967	BRD-K34957967-001-01-5	Broad Institute of MIT and Harvard	BRD-K34957967			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C22H32F3N3O4/c1-14-11-28(9-8-22(23,24)25)15(2)13-32-19-10-17(26-16(3)29)6-7-18(19)21(30)27(4)12-20(14)31-5/h6-7,10,14-15,20H,8-9,11-13H2,1-5H3,(H,26,29)/t14-,15-,20+/m1/s1	FSHTZNFJOZLSSX-SXGZJXTBSA-N	459.234491134							110673
BRD-K55891520	LSM-22119		54633824	InChI=1S/C26H33N3O5/c1-17-14-29(19(3)30)18(2)16-34-23-13-21(27-25(31)20-9-7-6-8-10-20)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,31)/t17-,18+,24-/m1/s1	MYTMXMAZMZDXSF-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K55891520	BRD-K55891520-001-01-0	Broad Institute of MIT and Harvard	BRD-K55891520			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33N3O5/c1-17-14-29(19(3)30)18(2)16-34-23-13-21(27-25(31)20-9-7-6-8-10-20)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,31)/t17-,18+,24-/m1/s1	MYTMXMAZMZDXSF-NXMSCROESA-N	467.242021186							110674
BRD-K32439647	LSM-22120		54633664	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20-,26-/m1/s1	ZQKSOPNYGIRHEN-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@H]1C	BroadT	BRD-K32439647	BRD-K32439647-001-01-4	Broad Institute of MIT and Harvard	BRD-K32439647			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20-,26-/m1/s1	ZQKSOPNYGIRHEN-XMERXJNXSA-N	467.278406694							110675
BRD-K83994491	LSM-22121		54633532	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21-/m1/s1	HLZNZOORYNMGAS-LLGFUMIMSA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K83994491	BRD-K83994491-001-01-3	Broad Institute of MIT and Harvard	BRD-K83994491			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H]1C)OC	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21-/m1/s1	HLZNZOORYNMGAS-LLGFUMIMSA-N	478.279134976							110676
BRD-K70042405	LSM-22122		54633743	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15+,22-/m0/s1	XSWCXHAXMDYWQG-KIMHZCHSSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K70042405	BRD-K70042405-001-01-1	Broad Institute of MIT and Harvard	BRD-K70042405			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15+,22-/m0/s1	XSWCXHAXMDYWQG-KIMHZCHSSA-N	472.232184784							110677
BRD-K38211037	LSM-22123		54633639	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m1/s1	BIISFJSDUGYLNA-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3ccncc3)C[C@H]1C	BroadT	BRD-K38211037	BRD-K38211037-001-01-9	Broad Institute of MIT and Harvard	BRD-K38211037			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m1/s1	BIISFJSDUGYLNA-YTZAWJCFSA-N	454.258005608							110678
BRD-K37780492	LSM-22124		54633599	InChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23-/m1/s1	OOYNITMNEHZMFB-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3cccnc3)C[C@H]1C	BroadT	BRD-K37780492	BRD-K37780492-001-01-2	Broad Institute of MIT and Harvard	BRD-K37780492			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23-/m1/s1	OOYNITMNEHZMFB-PMAPCBKXSA-N	490.224990918							110679
BRD-K62597218	LSM-22125		54633670	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20+,26-/m0/s1	ZQKSOPNYGIRHEN-UNVFRBQDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@@H]1C	BroadT	BRD-K62597218	BRD-K62597218-001-01-1	Broad Institute of MIT and Harvard	BRD-K62597218			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20+,26-/m0/s1	ZQKSOPNYGIRHEN-UNVFRBQDSA-N	467.278406694							110680
BRD-K52669647	LSM-22126		54633713	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23+/m1/s1	KVPJAUDUDGITLT-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K52669647	BRD-K52669647-001-01-1	Broad Institute of MIT and Harvard	BRD-K52669647			CO[C@@H]1[C@H](C)CN(C)[C@@H](C)COc2cc(ccc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23+/m1/s1	KVPJAUDUDGITLT-STSQHVNTSA-N	475.214091876							110681
BRD-K41307047	LSM-22127		54633759	InChI=1S/C25H35N3O6S/c1-17-14-27(3)18(2)16-34-23-12-7-19(13-22(23)25(29)28(4)15-24(17)33-6)26-35(30,31)21-10-8-20(32-5)9-11-21/h7-13,17-18,24,26H,14-16H2,1-6H3/t17-,18-,24-/m1/s1	DLZCGPUIYALDHF-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K41307047	BRD-K41307047-001-01-8	Broad Institute of MIT and Harvard	BRD-K41307047			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O6S/c1-17-14-27(3)18(2)16-34-23-12-7-19(13-22(23)25(29)28(4)15-24(17)33-6)26-35(30,31)21-10-8-20(32-5)9-11-21/h7-13,17-18,24,26H,14-16H2,1-6H3/t17-,18-,24-/m1/s1	DLZCGPUIYALDHF-QZTZHPFYSA-N	505.22465656							110682
BRD-K64770897	LSM-22128		54633795	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20+,26-/m0/s1	WIPGFEBUHVDPHK-UNVFRBQDSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccc(F)c3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K64770897	BRD-K64770897-001-01-0	Broad Institute of MIT and Harvard	BRD-K64770897			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccc(F)c3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20+,26-/m0/s1	WIPGFEBUHVDPHK-UNVFRBQDSA-N	499.284634926							110683
BRD-K02837259	LSM-22129		54633696	InChI=1S/C28H38N4O5/c1-6-8-26(33)30-22-10-11-23-24(14-22)37-18-20(3)32(27(34)13-21-9-7-12-29-15-21)16-19(2)25(36-5)17-31(4)28(23)35/h7,9-12,14-15,19-20,25H,6,8,13,16-18H2,1-5H3,(H,30,33)/t19-,20-,25-/m1/s1	UZEGMUHNMBZQHX-UMEGOILYSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)Cc3cccnc3	BroadT	BRD-K02837259	BRD-K02837259-001-01-4	Broad Institute of MIT and Harvard	BRD-K02837259			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)Cc2cccnc2)c1	InChI=1S/C28H38N4O5/c1-6-8-26(33)30-22-10-11-23-24(14-22)37-18-20(3)32(27(34)13-21-9-7-12-29-15-21)16-19(2)25(36-5)17-31(4)28(23)35/h7,9-12,14-15,19-20,25H,6,8,13,16-18H2,1-5H3,(H,30,33)/t19-,20-,25-/m1/s1	UZEGMUHNMBZQHX-UMEGOILYSA-N	510.284220356							110684
BRD-K41746201	LSM-22130		54633782	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m1/s1	NNNVUZWVJCJNJO-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3ccccn3)C[C@H]1C	BroadT	BRD-K41746201	BRD-K41746201-001-01-9	Broad Institute of MIT and Harvard	BRD-K41746201			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m1/s1	NNNVUZWVJCJNJO-YTZAWJCFSA-N	454.258005608							110685
BRD-K82681356	LSM-22131		54633771	InChI=1S/C27H35N3O6/c1-17-13-30(14-20-8-6-7-9-22(20)27(33)34)18(2)16-36-24-12-21(28-19(3)31)10-11-23(24)26(32)29(4)15-25(17)35-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)(H,33,34)/t17-,18+,25-/m1/s1	WQHRELCCFAZVAH-FUMQJTLXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3ccccc3C(=O)O)C[C@H]1C	BroadT	BRD-K82681356	BRD-K82681356-001-01-1	Broad Institute of MIT and Harvard	BRD-K82681356			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2ccccc2C(O)=O)C[C@H]1C	InChI=1S/C27H35N3O6/c1-17-13-30(14-20-8-6-7-9-22(20)27(33)34)18(2)16-36-24-12-21(28-19(3)31)10-11-23(24)26(32)29(4)15-25(17)35-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)(H,33,34)/t17-,18+,25-/m1/s1	WQHRELCCFAZVAH-FUMQJTLXSA-N	497.25258587							110686
BRD-K12328371	LSM-22132		54633519	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18+,23-/m0/s1	BHMAENWMFITTIK-IXFSTUDKSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K12328371	BRD-K12328371-001-01-5	Broad Institute of MIT and Harvard	BRD-K12328371			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18+,23-/m0/s1	BHMAENWMFITTIK-IXFSTUDKSA-N	497.26381927							110687
BRD-K63957636	LSM-22133		54633628	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24+/m0/s1	ZWIPCDYWVZDKTM-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K63957636	BRD-K63957636-001-01-0	Broad Institute of MIT and Harvard	BRD-K63957636			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24+/m0/s1	ZWIPCDYWVZDKTM-LLJLJFOGSA-N	488.29987042							110688
BRD-K00591281	LSM-22134		54633579	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21+/m1/s1	MRVBJXLMKDIORH-WWMYMODYSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	BroadT	BRD-K00591281	BRD-K00591281-001-01-1	Broad Institute of MIT and Harvard	BRD-K00591281			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21+/m1/s1	MRVBJXLMKDIORH-WWMYMODYSA-N	462.284220356							110689
BRD-K92891227	LSM-22135		54633732	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18+,23+/m1/s1	LEPGJAGERZQBIM-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CN3CCOCC3	BroadT	BRD-K92891227	BRD-K92891227-001-01-1	Broad Institute of MIT and Harvard	BRD-K92891227			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CN1CCOCC1	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18+,23+/m1/s1	LEPGJAGERZQBIM-STSQHVNTSA-N	490.279134976							110690
BRD-K68083867	LSM-22136		54633580	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21+/m0/s1	MRVBJXLMKDIORH-CSODHUTKSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	BroadT	BRD-K68083867	BRD-K68083867-001-01-0	Broad Institute of MIT and Harvard	BRD-K68083867			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21+/m0/s1	MRVBJXLMKDIORH-CSODHUTKSA-N	462.284220356							110691
BRD-K85604751	LSM-22137		54633814	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m1/s1	JZMVFBXUMGVJNA-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K85604751	BRD-K85604751-001-01-1	Broad Institute of MIT and Harvard	BRD-K85604751			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m1/s1	JZMVFBXUMGVJNA-MCFFVMPBSA-N	495.15946949							110692
BRD-K82284644	LSM-22138		54633816	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m1/s1	JZMVFBXUMGVJNA-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K82284644	BRD-K82284644-001-01-6	Broad Institute of MIT and Harvard	BRD-K82284644			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m1/s1	JZMVFBXUMGVJNA-VVBPWWLESA-N	495.15946949							110693
BRD-K88328128	LSM-22139		54633654	InChI=1S/C24H33N3O5S/c1-16-7-6-8-20(11-16)33(29,30)26-19-9-10-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23+/m1/s1	XSBCZNRPWNAZBQ-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(C)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K88328128	BRD-K88328128-001-01-0	Broad Institute of MIT and Harvard	BRD-K88328128			CO[C@H]1CN(C)C(=O)c2ccc(cc2OC[C@H](C)NC[C@H]1C)NS(=O)(=O)c1cccc(C)c1	InChI=1S/C24H33N3O5S/c1-16-7-6-8-20(11-16)33(29,30)26-19-9-10-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23+/m1/s1	XSBCZNRPWNAZBQ-STSQHVNTSA-N	475.214091876							110694
BRD-K77554584	LSM-22140		54633597	InChI=1S/C22H32F3N3O4/c1-14-11-28(9-8-22(23,24)25)15(2)13-32-19-10-17(26-16(3)29)6-7-18(19)21(30)27(4)12-20(14)31-5/h6-7,10,14-15,20H,8-9,11-13H2,1-5H3,(H,26,29)/t14-,15+,20-/m1/s1	FSHTZNFJOZLSSX-QEEYODRMSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K77554584	BRD-K77554584-001-01-1	Broad Institute of MIT and Harvard	BRD-K77554584			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C22H32F3N3O4/c1-14-11-28(9-8-22(23,24)25)15(2)13-32-19-10-17(26-16(3)29)6-7-18(19)21(30)27(4)12-20(14)31-5/h6-7,10,14-15,20H,8-9,11-13H2,1-5H3,(H,26,29)/t14-,15+,20-/m1/s1	FSHTZNFJOZLSSX-QEEYODRMSA-N	459.234491134							110695
BRD-K02839126	LSM-22141		54633624	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25+/m0/s1	WLFCSTFPAYFGAE-YYULODDRSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K02839126	BRD-K02839126-001-01-1	Broad Institute of MIT and Harvard	BRD-K02839126			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25+/m0/s1	WLFCSTFPAYFGAE-YYULODDRSA-N	497.25258587							110696
BRD-K36697652	LSM-22142		54633608	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21+,26+/m0/s1	KXFHRBKAIONQAO-LZCXECNNSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K36697652	BRD-K36697652-001-01-5	Broad Institute of MIT and Harvard	BRD-K36697652			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21+,26+/m0/s1	KXFHRBKAIONQAO-LZCXECNNSA-N	496.3049558							110697
BRD-K72175798	LSM-22143		54633717	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-12-19(27-24(30)26-18-8-6-5-7-9-18)10-11-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17-,22+/m1/s1	QIMBDCVCKXPNLA-YVHKJVDXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K72175798	BRD-K72175798-001-01-2	Broad Institute of MIT and Harvard	BRD-K72175798			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-12-19(27-24(30)26-18-8-6-5-7-9-18)10-11-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17-,22+/m1/s1	QIMBDCVCKXPNLA-YVHKJVDXSA-N	440.242355544							110698
BRD-K84690141	LSM-22144		54633534	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20-,25+/m0/s1	XWLPDPDFVWQKHJ-ZYLNGJIFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K84690141	BRD-K84690141-001-01-0	Broad Institute of MIT and Harvard	BRD-K84690141			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20-,25+/m0/s1	XWLPDPDFVWQKHJ-ZYLNGJIFSA-N	525.295119398							110699
BRD-K88636226	LSM-22145		54633636	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m1/s1	BIISFJSDUGYLNA-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3ccncc3)C[C@H]1C	BroadT	BRD-K88636226	BRD-K88636226-001-01-7	Broad Institute of MIT and Harvard	BRD-K88636226			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m1/s1	BIISFJSDUGYLNA-QZTZHPFYSA-N	454.258005608							110700
BRD-K63803358	LSM-22146		54633538	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20-,25-/m0/s1	XWLPDPDFVWQKHJ-RLSLOFABSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K63803358	BRD-K63803358-001-01-2	Broad Institute of MIT and Harvard	BRD-K63803358			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20-,25-/m0/s1	XWLPDPDFVWQKHJ-RLSLOFABSA-N	525.295119398							110701
BRD-K20071915	LSM-22147		54633603	InChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23-/m0/s1	OOYNITMNEHZMFB-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(Cc3cccnc3)C[C@@H]1C	BroadT	BRD-K20071915	BRD-K20071915-001-01-4	Broad Institute of MIT and Harvard	BRD-K20071915			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18-,23-/m0/s1	OOYNITMNEHZMFB-BSRJHKFKSA-N	490.224990918							110702
BRD-K69074358	LSM-22148		54633645	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24+/m1/s1	SPZGDJFWGCVUSP-KCYKTTMJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K69074358	BRD-K69074358-001-01-4	Broad Institute of MIT and Harvard	BRD-K69074358			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24+/m1/s1	SPZGDJFWGCVUSP-KCYKTTMJSA-N	485.232599354							110703
BRD-K56775726	LSM-22149		54633623	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25+/m1/s1	WLFCSTFPAYFGAE-UZEJHQAJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K56775726	BRD-K56775726-001-01-6	Broad Institute of MIT and Harvard	BRD-K56775726			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25+/m1/s1	WLFCSTFPAYFGAE-UZEJHQAJSA-N	497.25258587							110704
BRD-K09721867	LSM-22150		54633689	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24-,31+/m0/s1	DZGZFXRKNSZUSK-ISTJGCCRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@@H]1C	BroadT	BRD-K09721867	BRD-K09721867-001-01-7	Broad Institute of MIT and Harvard	BRD-K09721867			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc2ccc(cc2)-c2ccccn2)C[C@@H]1C	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24-,31+/m0/s1	DZGZFXRKNSZUSK-ISTJGCCRSA-N	573.331504906							110705
BRD-K36134264	LSM-22151		54633655	InChI=1S/C24H33N3O5S/c1-16-7-6-8-20(11-16)33(29,30)26-19-9-10-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23-/m0/s1	XSBCZNRPWNAZBQ-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(C)c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K36134264	BRD-K36134264-001-01-9	Broad Institute of MIT and Harvard	BRD-K36134264			CO[C@H]1CN(C)C(=O)c2ccc(cc2OC[C@@H](C)NC[C@@H]1C)NS(=O)(=O)c1cccc(C)c1	InChI=1S/C24H33N3O5S/c1-16-7-6-8-20(11-16)33(29,30)26-19-9-10-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23-/m0/s1	XSBCZNRPWNAZBQ-IXFSTUDKSA-N	475.214091876							110706
BRD-K43388152	LSM-22152		54633552	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16-,23-/m0/s1	ZNOAHICTVVWKDV-KXNSMUHISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K43388152	BRD-K43388152-001-01-7	Broad Institute of MIT and Harvard	BRD-K43388152			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16-,23-/m0/s1	ZNOAHICTVVWKDV-KXNSMUHISA-N	498.247834848							110707
BRD-K52300725	LSM-22153		54633627	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25-/m1/s1	WLFCSTFPAYFGAE-FUMQJTLXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K52300725	BRD-K52300725-001-01-8	Broad Institute of MIT and Harvard	BRD-K52300725			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25-/m1/s1	WLFCSTFPAYFGAE-FUMQJTLXSA-N	497.25258587							110708
BRD-K56301498	LSM-22154		54633542	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19-,26+/m1/s1	AHCGLCWYVPJPSC-UDCNLSRBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K56301498	BRD-K56301498-001-01-7	Broad Institute of MIT and Harvard	BRD-K56301498			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19-,26+/m1/s1	AHCGLCWYVPJPSC-UDCNLSRBSA-N	578.285282996							110709
BRD-K30065842	LSM-22155		54633777	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	LMAOWKPBCKGOJC-PMAPCBKXSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K30065842	BRD-K30065842-001-01-2	Broad Institute of MIT and Harvard	BRD-K30065842			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	LMAOWKPBCKGOJC-PMAPCBKXSA-N	485.26381927							110710
BRD-K21327356	LSM-22156		54633587	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18-,22+/m1/s1	ZDHXOKWVDFHFNO-HMFYCAOWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K21327356	BRD-K21327356-001-01-5	Broad Institute of MIT and Harvard	BRD-K21327356			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18-,22+/m1/s1	ZDHXOKWVDFHFNO-HMFYCAOWSA-N	475.214091876							110711
BRD-K17979415	LSM-22157		54633699	InChI=1S/C25H35N3O7S2/c1-17-9-7-8-10-24(17)37(32,33)26-20-11-12-21-22(13-20)35-16-19(3)28(36(6,30)31)14-18(2)23(34-5)15-27(4)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19+,23-/m0/s1	OWRIETMUXQHNFA-YYDVJCTNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)C	BroadT	BRD-K17979415	BRD-K17979415-001-01-8	Broad Institute of MIT and Harvard	BRD-K17979415			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@@H](C)N(C[C@@H]1C)S(C)(=O)=O	InChI=1S/C25H35N3O7S2/c1-17-9-7-8-10-24(17)37(32,33)26-20-11-12-21-22(13-20)35-16-19(3)28(36(6,30)31)14-18(2)23(34-5)15-27(4)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19+,23-/m0/s1	OWRIETMUXQHNFA-YYDVJCTNSA-N	553.19164187							110712
BRD-K97468369	LSM-22158		54633570	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m1/s1	ZXTSYIHAQFFGAZ-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K97468369	BRD-K97468369-001-01-1	Broad Institute of MIT and Harvard	BRD-K97468369			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m1/s1	ZXTSYIHAQFFGAZ-QZMQVMSPSA-N	472.248583776							110713
BRD-K75637705	LSM-22159		54633550	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16+,23+/m1/s1	ZNOAHICTVVWKDV-SYJLOODJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K75637705	BRD-K75637705-001-01-0	Broad Institute of MIT and Harvard	BRD-K75637705			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16+,23+/m1/s1	ZNOAHICTVVWKDV-SYJLOODJSA-N	498.247834848							110714
BRD-K14082333	LSM-22160		54633583	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21-/m1/s1	MRVBJXLMKDIORH-LLGFUMIMSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	BroadT	BRD-K14082333	BRD-K14082333-001-01-3	Broad Institute of MIT and Harvard	BRD-K14082333			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21-/m1/s1	MRVBJXLMKDIORH-LLGFUMIMSA-N	462.284220356							110715
BRD-K14394756	LSM-22161		54633546	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19+,26-/m0/s1	AHCGLCWYVPJPSC-ANSQWYIGSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K14394756	BRD-K14394756-001-01-0	Broad Institute of MIT and Harvard	BRD-K14394756			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19+,26-/m0/s1	AHCGLCWYVPJPSC-ANSQWYIGSA-N	578.285282996							110716
BRD-K97537859	LSM-22162		54633524	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-7-6-10-26-12-19)17(2)15-34-22-11-20(27-18(3)30)8-9-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	GCQIYZLQWHNMPN-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c3cccnc3	BroadT	BRD-K97537859	BRD-K97537859-001-01-0	Broad Institute of MIT and Harvard	BRD-K97537859			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1cccnc1	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-7-6-10-26-12-19)17(2)15-34-22-11-20(27-18(3)30)8-9-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	GCQIYZLQWHNMPN-SAHWJRBASA-N	468.237270164							110717
BRD-K85362541	LSM-22163		54633734	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18-,23-/m0/s1	LEPGJAGERZQBIM-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN3CCOCC3	BroadT	BRD-K85362541	BRD-K85362541-001-01-1	Broad Institute of MIT and Harvard	BRD-K85362541			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN1CCOCC1	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18-,23-/m0/s1	LEPGJAGERZQBIM-BSRJHKFKSA-N	490.279134976							110718
BRD-K36643302	LSM-22164		54633799	InChI=1S/C32H37FN4O6/c1-20-16-37(17-22-9-5-6-10-24(22)31(39)40)21(2)19-43-28-15-23(34-32(41)35-27-12-8-7-11-26(27)33)13-14-25(28)30(38)36(3)18-29(20)42-4/h5-15,20-21,29H,16-19H2,1-4H3,(H,39,40)(H2,34,35,41)/t20-,21+,29-/m1/s1	UVCFUAKKGJETNH-HNMNOHOESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(Cc4ccccc4C(=O)O)C[C@H]1C	BroadT	BRD-K36643302	BRD-K36643302-001-01-3	Broad Institute of MIT and Harvard	BRD-K36643302			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(Cc2ccccc2C(O)=O)C[C@H]1C	InChI=1S/C32H37FN4O6/c1-20-16-37(17-22-9-5-6-10-24(22)31(39)40)21(2)19-43-28-15-23(34-32(41)35-27-12-8-7-11-26(27)33)13-14-25(28)30(38)36(3)18-29(20)42-4/h5-15,20-21,29H,16-19H2,1-4H3,(H,39,40)(H2,34,35,41)/t20-,21+,29-/m1/s1	UVCFUAKKGJETNH-HNMNOHOESA-N	592.269713144							110719
BRD-K44416503	LSM-22165		54633634	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m0/s1	ZWIPCDYWVZDKTM-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K44416503	BRD-K44416503-001-01-1	Broad Institute of MIT and Harvard	BRD-K44416503			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m0/s1	ZWIPCDYWVZDKTM-RHGYRFJNSA-N	488.29987042							110720
BRD-K10494344	LSM-22166		54633806	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24+,31-/m1/s1	JEZVAYALKLQWEA-ULPIOCOXSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccc(cc3)c4ccccn4)[C@@H](C)COc2c1	BroadT	BRD-K10494344	BRD-K10494344-001-01-1	Broad Institute of MIT and Harvard	BRD-K10494344			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24+,31-/m1/s1	JEZVAYALKLQWEA-ULPIOCOXSA-N	558.320605864							110721
BRD-K22633587	LSM-22167		54633815	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m0/s1	JZMVFBXUMGVJNA-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K22633587	BRD-K22633587-001-01-6	Broad Institute of MIT and Harvard	BRD-K22633587			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m0/s1	JZMVFBXUMGVJNA-PONJGIIJSA-N	495.15946949							110722
BRD-K28305165	LSM-22168		54633642	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m0/s1	BIISFJSDUGYLNA-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3ccncc3)C[C@@H]1C	BroadT	BRD-K28305165	BRD-K28305165-001-01-5	Broad Institute of MIT and Harvard	BRD-K28305165			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-20-8-10-26-11-9-20)18(2)16-33-23-12-21(27-19(3)30)6-7-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m0/s1	BIISFJSDUGYLNA-RHGYRFJNSA-N	454.258005608							110723
BRD-K77535986	LSM-22169		54633653	InChI=1S/C24H33N3O5S/c1-16-7-6-8-20(11-16)33(29,30)26-19-9-10-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18-,23+/m0/s1	XSBCZNRPWNAZBQ-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(C)c3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K77535986	BRD-K77535986-001-01-4	Broad Institute of MIT and Harvard	BRD-K77535986			CO[C@@H]1CN(C)C(=O)c2ccc(cc2OC[C@H](C)NC[C@@H]1C)NS(=O)(=O)c1cccc(C)c1	InChI=1S/C24H33N3O5S/c1-16-7-6-8-20(11-16)33(29,30)26-19-9-10-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18-,23+/m0/s1	XSBCZNRPWNAZBQ-IUKKYPGJSA-N	475.214091876							131261
BRD-K52932858	LSM-22170		54633663	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18+,24-/m1/s1	SKGDHEHUMDACHN-NXMSCROESA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K52932858	BRD-K52932858-001-01-7	Broad Institute of MIT and Harvard	BRD-K52932858			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18+,24-/m1/s1	SKGDHEHUMDACHN-NXMSCROESA-N	515.243164038							110726
BRD-K59938516	LSM-22171		54633705	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m0/s1	PVKMDQXGIZYRFS-OSWQYVSFSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H]1C)OC	BroadT	BRD-K59938516	BRD-K59938516-001-01-1	Broad Institute of MIT and Harvard	BRD-K59938516			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m0/s1	PVKMDQXGIZYRFS-OSWQYVSFSA-N	485.268984862							110727
BRD-K05639803	LSM-22172		54633745	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-8-6-7-9-23(20)28)19(2)16-36-24-12-21(29-26(32)17-34-4)10-11-22(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m1/s1	PGMRKFIOHDIEMF-MPCDZSKCSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccc3F)[C@H](C)COc2c1	BroadT	BRD-K05639803	BRD-K05639803-001-01-2	Broad Institute of MIT and Harvard	BRD-K05639803			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-8-6-7-9-23(20)28)19(2)16-36-24-12-21(29-26(32)17-34-4)10-11-22(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m1/s1	PGMRKFIOHDIEMF-MPCDZSKCSA-N	501.263899482							110728
BRD-K21935128	LSM-22173		54633685	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23-/m1/s1	GJRFAEJZYRRRGG-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K21935128	BRD-K21935128-001-01-2	Broad Institute of MIT and Harvard	BRD-K21935128			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23-/m1/s1	GJRFAEJZYRRRGG-PMAPCBKXSA-N	439.247106566							110729
BRD-K02361314	LSM-22174		54633573	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m0/s1	ZXTSYIHAQFFGAZ-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K02361314	BRD-K02361314-001-01-8	Broad Institute of MIT and Harvard	BRD-K02361314			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m0/s1	ZXTSYIHAQFFGAZ-YGKZAACZSA-N	472.248583776							110730
BRD-K50829918	LSM-22175		54633784	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m0/s1	NNNVUZWVJCJNJO-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H]1C	BroadT	BRD-K50829918	BRD-K50829918-001-01-5	Broad Institute of MIT and Harvard	BRD-K50829918			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m0/s1	NNNVUZWVJCJNJO-HOOSLVGPSA-N	454.258005608							110731
BRD-K77060313	LSM-22176		54633517	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18-,23-/m0/s1	BHMAENWMFITTIK-BSRJHKFKSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K77060313	BRD-K77060313-001-01-7	Broad Institute of MIT and Harvard	BRD-K77060313			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18-,23-/m0/s1	BHMAENWMFITTIK-BSRJHKFKSA-N	497.26381927							110732
BRD-K02337960	LSM-22177		54633730	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18-,23+/m1/s1	LEPGJAGERZQBIM-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN3CCOCC3	BroadT	BRD-K02337960	BRD-K02337960-001-01-5	Broad Institute of MIT and Harvard	BRD-K02337960			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN1CCOCC1	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18-,23+/m1/s1	LEPGJAGERZQBIM-PNCHPQGNSA-N	490.279134976							110733
BRD-K30962012	LSM-22178		54633513	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18-,23+/m0/s1	BHMAENWMFITTIK-IUKKYPGJSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K30962012	BRD-K30962012-001-01-4	Broad Institute of MIT and Harvard	BRD-K30962012			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18-,23+/m0/s1	BHMAENWMFITTIK-IUKKYPGJSA-N	497.26381927							110734
BRD-K74600148	LSM-22179		54633643	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24-/m1/s1	SPZGDJFWGCVUSP-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K74600148	BRD-K74600148-001-01-4	Broad Institute of MIT and Harvard	BRD-K74600148			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24-/m1/s1	SPZGDJFWGCVUSP-HOZJOUCCSA-N	485.232599354							110735
BRD-K96384208	LSM-22180		54633511	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20+,29-/m0/s1	DXCXCRUBZQZACJ-LNIFMVABSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(Cc4cc(F)ccc4F)C[C@@H]1C	BroadT	BRD-K96384208	BRD-K96384208-001-01-6	Broad Institute of MIT and Harvard	BRD-K96384208			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@@H]1C	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20+,29-/m0/s1	DXCXCRUBZQZACJ-LNIFMVABSA-N	605.217126508							110736
BRD-K80424876	LSM-22181		54633794	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20-,26-/m0/s1	WIPGFEBUHVDPHK-DYLHXGEVSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccc(F)c3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K80424876	BRD-K80424876-001-01-9	Broad Institute of MIT and Harvard	BRD-K80424876			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccc(F)c3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20-,26-/m0/s1	WIPGFEBUHVDPHK-DYLHXGEVSA-N	499.284634926							110737
BRD-K39078753	LSM-22182		54633522	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-7-6-10-26-12-19)17(2)15-34-22-11-20(27-18(3)30)8-9-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	GCQIYZLQWHNMPN-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c3cccnc3	BroadT	BRD-K39078753	BRD-K39078753-001-01-3	Broad Institute of MIT and Harvard	BRD-K39078753			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1cccnc1	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-7-6-10-26-12-19)17(2)15-34-22-11-20(27-18(3)30)8-9-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	GCQIYZLQWHNMPN-DGGJZMOXSA-N	468.237270164							110738
BRD-K02637547	LSM-22183		54633790	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20-,26+/m0/s1	WIPGFEBUHVDPHK-CUVVAGTFSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccc(F)c3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K02637547	BRD-K02637547-001-01-0	Broad Institute of MIT and Harvard	BRD-K02637547			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccc(F)c3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20-,26+/m0/s1	WIPGFEBUHVDPHK-CUVVAGTFSA-N	499.284634926							110739
BRD-K13551202	LSM-22184		54633578	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17-,21+/m1/s1	MRVBJXLMKDIORH-LZJOCLMNSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	BroadT	BRD-K13551202	BRD-K13551202-001-01-6	Broad Institute of MIT and Harvard	BRD-K13551202			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17-,21+/m1/s1	MRVBJXLMKDIORH-LZJOCLMNSA-N	462.284220356							110740
BRD-K73531877	LSM-22185		54633707	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m0/s1	PVKMDQXGIZYRFS-CEYNDMKZSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H]1C)OC	BroadT	BRD-K73531877	BRD-K73531877-001-01-9	Broad Institute of MIT and Harvard	BRD-K73531877			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m0/s1	PVKMDQXGIZYRFS-CEYNDMKZSA-N	485.268984862							110741
BRD-K81925504	LSM-22186		54633561	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20+,27-/m1/s1	MBZIAPCTYFYNLY-IOKPGSKQSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K81925504	BRD-K81925504-001-01-4	Broad Institute of MIT and Harvard	BRD-K81925504			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20+,27-/m1/s1	MBZIAPCTYFYNLY-IOKPGSKQSA-N	509.288971378							110742
BRD-K57357721	LSM-22187		54633611	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21+,26-/m1/s1	KXFHRBKAIONQAO-YZIHRLCOSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K57357721	BRD-K57357721-001-01-7	Broad Institute of MIT and Harvard	BRD-K57357721			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21+,26-/m1/s1	KXFHRBKAIONQAO-YZIHRLCOSA-N	496.3049558							110743
BRD-K28080909	LSM-15126		54633555	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20-,27-/m1/s1	MBZIAPCTYFYNLY-SEXOINJZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K28080909	BRD-K28080909-001-01-5	Broad Institute of MIT and Harvard	BRD-K28080909			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20-,27-/m1/s1	MBZIAPCTYFYNLY-SEXOINJZSA-N	509.288971378							103782
BRD-K21011800-001-01-7	LSM-22188	BRD-K21011800	54633530	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21+/m0/s1	HLZNZOORYNMGAS-CSODHUTKSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H]1C)OC	BroadT	BRD-K21011800	BRD-K21011800-001-01-7	Broad Institute of MIT and Harvard	BRD-K21011800			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H]1C)OC	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21+/m0/s1	HLZNZOORYNMGAS-CSODHUTKSA-N	478.279134976							110744
BRD-K00976973	LSM-22189		54633803	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24+,31+/m1/s1	JEZVAYALKLQWEA-OXYPMYLPSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccc(cc3)c4ccccn4)[C@@H](C)COc2c1	BroadT	BRD-K00976973	BRD-K00976973-001-01-7	Broad Institute of MIT and Harvard	BRD-K00976973			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24+,31+/m1/s1	JEZVAYALKLQWEA-OXYPMYLPSA-N	558.320605864							110745
BRD-K35617935	LSM-22190		54633776	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18-,23-/m0/s1	LMAOWKPBCKGOJC-BSRJHKFKSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K35617935	BRD-K35617935-001-01-3	Broad Institute of MIT and Harvard	BRD-K35617935			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18-,23-/m0/s1	LMAOWKPBCKGOJC-BSRJHKFKSA-N	485.26381927							110746
BRD-K11596967	LSM-22191		54633793	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20+,26+/m0/s1	WIPGFEBUHVDPHK-OUDXUNEISA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccc(F)c3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K11596967	BRD-K11596967-001-01-8	Broad Institute of MIT and Harvard	BRD-K11596967			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccc(F)c3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20+,26+/m0/s1	WIPGFEBUHVDPHK-OUDXUNEISA-N	499.284634926							110747
BRD-K15047839	LSM-22192		54633668	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20+,26+/m0/s1	ZQKSOPNYGIRHEN-OUDXUNEISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@@H]1C	BroadT	BRD-K15047839	BRD-K15047839-001-01-4	Broad Institute of MIT and Harvard	BRD-K15047839			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20+,26+/m0/s1	ZQKSOPNYGIRHEN-OUDXUNEISA-N	467.278406694							110748
BRD-K77733130	LSM-22193		54633757	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20+,26-/m0/s1	PWYLLXJABFYBFY-UNVFRBQDSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K77733130	BRD-K77733130-001-01-0	Broad Institute of MIT and Harvard	BRD-K77733130			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20+,26-/m0/s1	PWYLLXJABFYBFY-UNVFRBQDSA-N	513.283885998							110749
BRD-K44719654	LSM-22194		54633589	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18-,22-/m0/s1	ZDHXOKWVDFHFNO-SPEDKVCISA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K44719654	BRD-K44719654-001-01-5	Broad Institute of MIT and Harvard	BRD-K44719654			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18-,22-/m0/s1	ZDHXOKWVDFHFNO-SPEDKVCISA-N	475.214091876							110750
BRD-K75177817	LSM-22195		54633801	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24-,31+/m1/s1	JEZVAYALKLQWEA-GQIGMWPISA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccc(cc3)c4ccccn4)[C@H](C)COc2c1	BroadT	BRD-K75177817	BRD-K75177817-001-01-2	Broad Institute of MIT and Harvard	BRD-K75177817			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24-,31+/m1/s1	JEZVAYALKLQWEA-GQIGMWPISA-N	558.320605864							110751
BRD-K50315405	LSM-22196		54633755	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20+,26+/m0/s1	PWYLLXJABFYBFY-OUDXUNEISA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K50315405	BRD-K50315405-001-01-5	Broad Institute of MIT and Harvard	BRD-K50315405			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20+,26+/m0/s1	PWYLLXJABFYBFY-OUDXUNEISA-N	513.283885998							110752
BRD-K18562194	LSM-22197		54633817	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m0/s1	JZMVFBXUMGVJNA-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K18562194	BRD-K18562194-001-01-8	Broad Institute of MIT and Harvard	BRD-K18562194			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m0/s1	JZMVFBXUMGVJNA-WJONJSRFSA-N	495.15946949							110753
BRD-K02269304	LSM-22198		54633764	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17+,25+/m0/s1	BJYPLSOQEPUFOR-RJYGXOMWSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@@H]1C	BroadT	BRD-K02269304	BRD-K02269304-001-01-5	Broad Institute of MIT and Harvard	BRD-K02269304			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@@H]1C	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17+,25+/m0/s1	BJYPLSOQEPUFOR-RJYGXOMWSA-N	489.243912966							110754
BRD-K61868194	LSM-22199		54633661	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18+,24+/m0/s1	SKGDHEHUMDACHN-HOOSLVGPSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K61868194	BRD-K61868194-001-01-5	Broad Institute of MIT and Harvard	BRD-K61868194			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O6/c1-17-13-31(27(34)20-8-6-7-9-22(20)28)18(2)15-37-23-12-19(29-25(32)16-35-4)10-11-21(23)26(33)30(3)14-24(17)36-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,29,32)/t17-,18+,24+/m0/s1	SKGDHEHUMDACHN-HOOSLVGPSA-N	515.243164038							110755
BRD-K32879108	LSM-22200		54633807	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	NUZAMTOBMKNCBP-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K32879108	BRD-K32879108-001-01-3	Broad Institute of MIT and Harvard	BRD-K32879108			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	NUZAMTOBMKNCBP-PONJGIIJSA-N	458.232933712							110756
BRD-K65494150	LSM-22201		54633728	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	RZEAXGTWPWCQSI-OHUGHZGNSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K65494150	BRD-K65494150-001-01-8	Broad Institute of MIT and Harvard	BRD-K65494150			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	RZEAXGTWPWCQSI-OHUGHZGNSA-N	483.273321314							110757
BRD-K52881132	LSM-22202		54633595	InChI=1S/C22H32F3N3O4/c1-14-11-28(9-8-22(23,24)25)15(2)13-32-19-10-17(26-16(3)29)6-7-18(19)21(30)27(4)12-20(14)31-5/h6-7,10,14-15,20H,8-9,11-13H2,1-5H3,(H,26,29)/t14-,15+,20+/m1/s1	FSHTZNFJOZLSSX-SIFCLUCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K52881132	BRD-K52881132-001-01-4	Broad Institute of MIT and Harvard	BRD-K52881132			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C22H32F3N3O4/c1-14-11-28(9-8-22(23,24)25)15(2)13-32-19-10-17(26-16(3)29)6-7-18(19)21(30)27(4)12-20(14)31-5/h6-7,10,14-15,20H,8-9,11-13H2,1-5H3,(H,26,29)/t14-,15+,20+/m1/s1	FSHTZNFJOZLSSX-SIFCLUCFSA-N	459.234491134							110758
BRD-K30992744	LSM-22203		54633763	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17+,25+/m1/s1	BJYPLSOQEPUFOR-YPBQGGFRSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3cc(F)ccc3F)C[C@H]1C	BroadT	BRD-K30992744	BRD-K30992744-001-01-6	Broad Institute of MIT and Harvard	BRD-K30992744			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17+,25+/m1/s1	BJYPLSOQEPUFOR-YPBQGGFRSA-N	489.243912966							110759
BRD-K45022385	LSM-22204		54633781	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m0/s1	NNNVUZWVJCJNJO-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H]1C	BroadT	BRD-K45022385	BRD-K45022385-001-01-9	Broad Institute of MIT and Harvard	BRD-K45022385			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C25H34N4O4/c1-17-13-29(14-21-8-6-7-11-26-21)18(2)16-33-23-10-9-20(27-19(3)30)12-22(23)25(31)28(4)15-24(17)32-5/h6-12,17-18,24H,13-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m0/s1	NNNVUZWVJCJNJO-LLJLJFOGSA-N	454.258005608							110760
BRD-K80196706	LSM-22205		54633680	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m0/s1	GJRFAEJZYRRRGG-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K80196706	BRD-K80196706-001-01-9	Broad Institute of MIT and Harvard	BRD-K80196706			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m0/s1	GJRFAEJZYRRRGG-IUKKYPGJSA-N	439.247106566							110761
CHEMBL2130605	LSM-22206	BRD-K98645985, SID131429945	54633693	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24-,31-/m0/s1	DZGZFXRKNSZUSK-MKGJDZFWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@@H]1C	BroadT	BRD-K98645985	BRD-K98645985-001-01-7	Broad Institute of MIT and Harvard	BRD-K98645985			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc2ccc(cc2)-c2ccccn2)C[C@@H]1C	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24-,31-/m0/s1	DZGZFXRKNSZUSK-MKGJDZFWSA-N	573.331504906							110762
BRD-K69443135	LSM-22207		54633818	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m0/s1	JZMVFBXUMGVJNA-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K69443135	BRD-K69443135-001-01-1	Broad Institute of MIT and Harvard	BRD-K69443135			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m0/s1	JZMVFBXUMGVJNA-DMPWYTOCSA-N	495.15946949							110763
BRD-K52319351	LSM-22208		54633648	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24-/m0/s1	SPZGDJFWGCVUSP-UAVUOLJFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K52319351	BRD-K52319351-001-01-9	Broad Institute of MIT and Harvard	BRD-K52319351			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24-/m0/s1	SPZGDJFWGCVUSP-UAVUOLJFSA-N	485.232599354							110764
BRD-K15775306	LSM-22209		54633644	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24+/m0/s1	SPZGDJFWGCVUSP-WOGXIUBCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K15775306	BRD-K15775306-001-01-4	Broad Institute of MIT and Harvard	BRD-K15775306			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24+/m0/s1	SPZGDJFWGCVUSP-WOGXIUBCSA-N	485.232599354							110765
BRD-K24039194	LSM-22210		54633825	InChI=1S/C26H33N3O5/c1-17-14-29(19(3)30)18(2)16-34-23-13-21(27-25(31)20-9-7-6-8-10-20)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,31)/t17-,18+,24-/m0/s1	MYTMXMAZMZDXSF-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K24039194	BRD-K24039194-001-01-9	Broad Institute of MIT and Harvard	BRD-K24039194			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H33N3O5/c1-17-14-29(19(3)30)18(2)16-34-23-13-21(27-25(31)20-9-7-6-8-10-20)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,31)/t17-,18+,24-/m0/s1	MYTMXMAZMZDXSF-RHGYRFJNSA-N	467.242021186							110766
BRD-K01577807	LSM-22211		54633568	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	BLKNSIVDUMMEFS-DFIYOIEZSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K01577807	BRD-K01577807-001-01-4	Broad Institute of MIT and Harvard	BRD-K01577807			COCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	BLKNSIVDUMMEFS-DFIYOIEZSA-N	489.320271506							110767
BRD-K25147028	LSM-22212		54633582	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21-/m0/s1	MRVBJXLMKDIORH-FVJLSDCUSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	BroadT	BRD-K25147028	BRD-K25147028-001-01-1	Broad Institute of MIT and Harvard	BRD-K25147028			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21-/m0/s1	MRVBJXLMKDIORH-FVJLSDCUSA-N	462.284220356							110768
BRD-K45694673	LSM-22213		54633788	InChI=1S/C26H33FN4O5/c1-16-13-31(26(34)29-22-9-7-6-8-21(22)27)17(2)15-36-23-12-19(28-18(3)32)10-11-20(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)(H,29,34)/t16-,17-,24-/m1/s1	FNYMCKICCBEBHQ-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc3ccccc3F	BroadT	BRD-K45694673	BRD-K45694673-001-01-6	Broad Institute of MIT and Harvard	BRD-K45694673			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1ccccc1F	InChI=1S/C26H33FN4O5/c1-16-13-31(26(34)29-22-9-7-6-8-21(22)27)17(2)15-36-23-12-19(28-18(3)32)10-11-20(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)(H,29,34)/t16-,17-,24-/m1/s1	FNYMCKICCBEBHQ-HOZJOUCCSA-N	500.243498396							110769
BRD-K07526417	LSM-22214		54633742	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15-,22-/m0/s1	XSWCXHAXMDYWQG-DFFLPILJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K07526417	BRD-K07526417-001-01-7	Broad Institute of MIT and Harvard	BRD-K07526417			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15-,22-/m0/s1	XSWCXHAXMDYWQG-DFFLPILJSA-N	472.232184784							110770
BRD-K03116744	LSM-22215		54633798	InChI=1S/C32H37FN4O6/c1-20-16-37(17-22-9-5-6-10-24(22)31(39)40)21(2)19-43-28-15-23(34-32(41)35-27-12-8-7-11-26(27)33)13-14-25(28)30(38)36(3)18-29(20)42-4/h5-15,20-21,29H,16-19H2,1-4H3,(H,39,40)(H2,34,35,41)/t20-,21+,29-/m0/s1	UVCFUAKKGJETNH-FONBTEPMSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(Cc4ccccc4C(=O)O)C[C@@H]1C	BroadT	BRD-K03116744	BRD-K03116744-001-01-5	Broad Institute of MIT and Harvard	BRD-K03116744			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(Cc2ccccc2C(O)=O)C[C@@H]1C	InChI=1S/C32H37FN4O6/c1-20-16-37(17-22-9-5-6-10-24(22)31(39)40)21(2)19-43-28-15-23(34-32(41)35-27-12-8-7-11-26(27)33)13-14-25(28)30(38)36(3)18-29(20)42-4/h5-15,20-21,29H,16-19H2,1-4H3,(H,39,40)(H2,34,35,41)/t20-,21+,29-/m0/s1	UVCFUAKKGJETNH-FONBTEPMSA-N	592.269713144							110771
BRD-K98510376	LSM-22216		54633796	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20+,26-/m1/s1	WIPGFEBUHVDPHK-BVFVYWQFSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccc(F)c3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K98510376	BRD-K98510376-001-01-0	Broad Institute of MIT and Harvard	BRD-K98510376			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cccc(F)c3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H38FN3O4/c1-6-8-27(33)30-23-11-12-25-24(14-23)28(34)31(4)17-26(35-5)19(2)15-32(20(3)18-36-25)16-21-9-7-10-22(29)13-21/h7,9-14,19-20,26H,6,8,15-18H2,1-5H3,(H,30,33)/t19-,20+,26-/m1/s1	WIPGFEBUHVDPHK-BVFVYWQFSA-N	499.284634926							110772
BRD-K01749472	LSM-22217		54633520	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18+,23-/m1/s1	BHMAENWMFITTIK-IEGUWTFLSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K01749472	BRD-K01749472-001-01-3	Broad Institute of MIT and Harvard	BRD-K01749472			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18+,23-/m1/s1	BHMAENWMFITTIK-IEGUWTFLSA-N	497.26381927							110773
BRD-K09017160	LSM-22218		54633515	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18+,23+/m1/s1	BHMAENWMFITTIK-STSQHVNTSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3cnccn3	BroadT	BRD-K09017160	BRD-K09017160-001-01-4	Broad Institute of MIT and Harvard	BRD-K09017160			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1cnccn1	InChI=1S/C26H35N5O5/c1-6-7-24(32)29-19-8-9-22-20(12-19)25(33)30(4)15-23(35-5)17(2)14-31(18(3)16-36-22)26(34)21-13-27-10-11-28-21/h8-13,17-18,23H,6-7,14-16H2,1-5H3,(H,29,32)/t17-,18+,23+/m1/s1	BHMAENWMFITTIK-STSQHVNTSA-N	497.26381927							110774
BRD-K90255725	LSM-22219		54633625	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25-/m0/s1	WLFCSTFPAYFGAE-RPPIVITFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K90255725	BRD-K90255725-001-01-8	Broad Institute of MIT and Harvard	BRD-K90255725			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25-/m0/s1	WLFCSTFPAYFGAE-RPPIVITFSA-N	497.25258587							110775
BRD-K46824282	LSM-22220		54633531	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21-/m0/s1	HLZNZOORYNMGAS-FVJLSDCUSA-N	COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H]1C)OC	BroadT	BRD-K46824282	BRD-K46824282-001-01-1	Broad Institute of MIT and Harvard	BRD-K46824282			COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H]1C)OC	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)26-18-8-9-19-20(10-18)34-13-17(4)28(22(29)14-32-6)11-16(3)21(33-7)12-27(5)23(19)30/h8-10,15-17,21H,11-14H2,1-7H3,(H2,25,26,31)/t16-,17+,21-/m0/s1	HLZNZOORYNMGAS-FVJLSDCUSA-N	478.279134976							110776
BRD-K92912768-001-01-0	LSM-22221	BRD-K92912768	54633508	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20-,29+/m1/s1	DXCXCRUBZQZACJ-PCFSMJPMSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(Cc4cc(F)ccc4F)C[C@H]1C	BroadT	BRD-K92912768	BRD-K92912768-001-01-0	Broad Institute of MIT and Harvard	BRD-K92912768			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20-,29+/m1/s1	DXCXCRUBZQZACJ-PCFSMJPMSA-N	605.217126508							110777
BRD-K17514980	LSM-22222		54633606	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21-,26+/m0/s1	KXFHRBKAIONQAO-ISJBWFOZSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K17514980	BRD-K17514980-001-01-8	Broad Institute of MIT and Harvard	BRD-K17514980			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C28H40N4O4/c1-6-14-29-28(34)30-23-12-13-24-25(15-23)36-19-21(3)32(17-22-10-8-7-9-11-22)16-20(2)26(35-5)18-31(4)27(24)33/h7-13,15,20-21,26H,6,14,16-19H2,1-5H3,(H2,29,30,34)/t20-,21-,26+/m0/s1	KXFHRBKAIONQAO-ISJBWFOZSA-N	496.3049558							110778
BRD-K89436979	LSM-22223		54633581	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17-,21-/m0/s1	MRVBJXLMKDIORH-FIKGOQFSSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	BroadT	BRD-K89436979	BRD-K89436979-001-01-0	Broad Institute of MIT and Harvard	BRD-K89436979			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17-,21-/m0/s1	MRVBJXLMKDIORH-FIKGOQFSSA-N	462.284220356							110779
BRD-K99038919	LSM-22224		54633805	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24+,31-/m0/s1	JEZVAYALKLQWEA-JLELKNTQSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccc(cc3)c4ccccn4)[C@H](C)COc2c1	BroadT	BRD-K99038919	BRD-K99038919-001-01-5	Broad Institute of MIT and Harvard	BRD-K99038919			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24+,31-/m0/s1	JEZVAYALKLQWEA-JLELKNTQSA-N	558.320605864							110780
BRD-K01910220	LSM-22225		54633629	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24+/m1/s1	ZWIPCDYWVZDKTM-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K01910220	BRD-K01910220-001-01-6	Broad Institute of MIT and Harvard	BRD-K01910220			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24+/m1/s1	ZWIPCDYWVZDKTM-GGUMNFRJSA-N	488.29987042							110781
BRD-K40894545	LSM-22226		54633590	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18+,22-/m0/s1	ZDHXOKWVDFHFNO-SVMVAKDDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K40894545	BRD-K40894545-001-01-3	Broad Institute of MIT and Harvard	BRD-K40894545			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18+,22-/m0/s1	ZDHXOKWVDFHFNO-SVMVAKDDSA-N	475.214091876							110782
BRD-K39140255	LSM-22227		54633797	InChI=1S/C32H37FN4O6/c1-20-16-37(17-22-9-5-6-10-24(22)31(39)40)21(2)19-43-28-15-23(34-32(41)35-27-12-8-7-11-26(27)33)13-14-25(28)30(38)36(3)18-29(20)42-4/h5-15,20-21,29H,16-19H2,1-4H3,(H,39,40)(H2,34,35,41)/t20-,21-,29-/m1/s1	UVCFUAKKGJETNH-GVNDJSPXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(Cc4ccccc4C(=O)O)C[C@H]1C	BroadT	BRD-K39140255	BRD-K39140255-001-01-4	Broad Institute of MIT and Harvard	BRD-K39140255			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(Cc2ccccc2C(O)=O)C[C@H]1C	InChI=1S/C32H37FN4O6/c1-20-16-37(17-22-9-5-6-10-24(22)31(39)40)21(2)19-43-28-15-23(34-32(41)35-27-12-8-7-11-26(27)33)13-14-25(28)30(38)36(3)18-29(20)42-4/h5-15,20-21,29H,16-19H2,1-4H3,(H,39,40)(H2,34,35,41)/t20-,21-,29-/m1/s1	UVCFUAKKGJETNH-GVNDJSPXSA-N	592.269713144							110783
BRD-K54903703	LSM-22228		54633751	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20-,26-/m1/s1	PWYLLXJABFYBFY-XMERXJNXSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K54903703	BRD-K54903703-001-01-3	Broad Institute of MIT and Harvard	BRD-K54903703			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20-,26-/m1/s1	PWYLLXJABFYBFY-XMERXJNXSA-N	513.283885998							110784
BRD-K35462157	LSM-22229		54633652	InChI=1S/C24H33N3O5S/c1-16-7-6-8-20(11-16)33(29,30)26-19-9-10-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18-,23+/m1/s1	XSBCZNRPWNAZBQ-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(C)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K35462157	BRD-K35462157-001-01-5	Broad Institute of MIT and Harvard	BRD-K35462157			CO[C@H]1CN(C)C(=O)c2ccc(cc2OC[C@@H](C)NC[C@H]1C)NS(=O)(=O)c1cccc(C)c1	InChI=1S/C24H33N3O5S/c1-16-7-6-8-20(11-16)33(29,30)26-19-9-10-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18-,23+/m1/s1	XSBCZNRPWNAZBQ-PNCHPQGNSA-N	475.214091876							110785
BRD-K42413274	LSM-22230		54633543	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19-,26+/m0/s1	AHCGLCWYVPJPSC-LZJCXSABSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K42413274	BRD-K42413274-001-01-7	Broad Institute of MIT and Harvard	BRD-K42413274			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19-,26+/m0/s1	AHCGLCWYVPJPSC-LZJCXSABSA-N	578.285282996							110786
BRD-K59239976	LSM-22231		54633622	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25+/m0/s1	WLFCSTFPAYFGAE-DPOKWSEZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K59239976	BRD-K59239976-001-01-7	Broad Institute of MIT and Harvard	BRD-K59239976			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25+/m0/s1	WLFCSTFPAYFGAE-DPOKWSEZSA-N	497.25258587							110787
BRD-K64055724	LSM-22232		54633756	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20-,26-/m0/s1	PWYLLXJABFYBFY-DYLHXGEVSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K64055724	BRD-K64055724-001-01-5	Broad Institute of MIT and Harvard	BRD-K64055724			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20-,26-/m0/s1	PWYLLXJABFYBFY-DYLHXGEVSA-N	513.283885998							110788
BRD-K81293413	LSM-22233		54633535	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20-,25+/m1/s1	XWLPDPDFVWQKHJ-FHAGJXEFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K81293413	BRD-K81293413-001-01-7	Broad Institute of MIT and Harvard	BRD-K81293413			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20-,25+/m1/s1	XWLPDPDFVWQKHJ-FHAGJXEFSA-N	525.295119398							110789
BRD-K95485901	LSM-22234		54633588	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18+,22+/m0/s1	ZDHXOKWVDFHFNO-NJNPRVFISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K95485901	BRD-K95485901-001-01-2	Broad Institute of MIT and Harvard	BRD-K95485901			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18+,22+/m0/s1	ZDHXOKWVDFHFNO-NJNPRVFISA-N	475.214091876							110790
BRD-K35808731	LSM-22235		54633726	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m0/s1	RZEAXGTWPWCQSI-RLSLOFABSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K35808731	BRD-K35808731-001-01-4	Broad Institute of MIT and Harvard	BRD-K35808731			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m0/s1	RZEAXGTWPWCQSI-RLSLOFABSA-N	483.273321314							110791
BRD-K13543055	LSM-22236		54633752	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20-,26+/m0/s1	PWYLLXJABFYBFY-CUVVAGTFSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K13543055	BRD-K13543055-001-01-1	Broad Institute of MIT and Harvard	BRD-K13543055			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20-,26+/m0/s1	PWYLLXJABFYBFY-CUVVAGTFSA-N	513.283885998							110792
BRD-K01266518	LSM-22237		54633547	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19+,26-/m1/s1	AHCGLCWYVPJPSC-UYXZNNOOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K01266518	BRD-K01266518-001-01-4	Broad Institute of MIT and Harvard	BRD-K01266518			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19+,26-/m1/s1	AHCGLCWYVPJPSC-UYXZNNOOSA-N	578.285282996							110793
BRD-K74860368	LSM-22238		54633733	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18+,23+/m0/s1	LEPGJAGERZQBIM-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN3CCOCC3	BroadT	BRD-K74860368	BRD-K74860368-001-01-7	Broad Institute of MIT and Harvard	BRD-K74860368			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN1CCOCC1	InChI=1S/C25H38N4O6/c1-17-13-29(24(31)15-28-8-10-34-11-9-28)18(2)16-35-22-12-20(26-19(3)30)6-7-21(22)25(32)27(4)14-23(17)33-5/h6-7,12,17-18,23H,8-11,13-16H2,1-5H3,(H,26,30)/t17-,18+,23+/m0/s1	LEPGJAGERZQBIM-YZZKKUAISA-N	490.279134976							110794
BRD-K84334677	LSM-22239		54633617	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17-,21-/m0/s1	NVAZGCBIIWIDIP-FIKGOQFSSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K84334677	BRD-K84334677-001-01-7	Broad Institute of MIT and Harvard	BRD-K84334677			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3nccs3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17-,21-/m0/s1	NVAZGCBIIWIDIP-FIKGOQFSSA-N	510.197061608							110795
BRD-K77354700	LSM-22240		54633671	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20+,26-/m1/s1	ZQKSOPNYGIRHEN-BVFVYWQFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(CCc3ccccc3)C[C@H]1C	BroadT	BRD-K77354700	BRD-K77354700-001-01-5	Broad Institute of MIT and Harvard	BRD-K77354700			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20+,26-/m1/s1	ZQKSOPNYGIRHEN-BVFVYWQFSA-N	467.278406694							110796
BRD-K37721603	LSM-22241		54633761	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17-,25+/m1/s1	BJYPLSOQEPUFOR-BFIDETRKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@H]1C	BroadT	BRD-K37721603	BRD-K37721603-001-01-2	Broad Institute of MIT and Harvard	BRD-K37721603			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17-,25+/m1/s1	BJYPLSOQEPUFOR-BFIDETRKSA-N	489.243912966							110797
BRD-K95591629	LSM-22242		54633802	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24-,31+/m0/s1	JEZVAYALKLQWEA-ISTJGCCRSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccc(cc3)c4ccccn4)[C@@H](C)COc2c1	BroadT	BRD-K95591629	BRD-K95591629-001-01-8	Broad Institute of MIT and Harvard	BRD-K95591629			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C33H42N4O4/c1-6-9-32(38)35-27-15-16-28-30(18-27)41-22-24(3)37(19-23(2)31(40-5)21-36(4)33(28)39)20-25-11-13-26(14-12-25)29-10-7-8-17-34-29/h7-8,10-18,23-24,31H,6,9,19-22H2,1-5H3,(H,35,38)/t23-,24-,31+/m0/s1	JEZVAYALKLQWEA-ISTJGCCRSA-N	558.320605864							110798
BRD-K90155857	LSM-22243		54633723	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	RZEAXGTWPWCQSI-FHAGJXEFSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccccc3)[C@H](C)COc2c1	BroadT	BRD-K90155857	BRD-K90155857-001-01-0	Broad Institute of MIT and Harvard	BRD-K90155857			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	RZEAXGTWPWCQSI-FHAGJXEFSA-N	483.273321314							110799
BRD-K18402224	LSM-22244		54633574	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m0/s1	ZXTSYIHAQFFGAZ-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K18402224	BRD-K18402224-001-01-1	Broad Institute of MIT and Harvard	BRD-K18402224			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m0/s1	ZXTSYIHAQFFGAZ-QQMNAOGKSA-N	472.248583776							110800
BRD-K93993174	LSM-22245		54633512	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20+,29-/m1/s1	DXCXCRUBZQZACJ-WAPJKPAKSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(Cc4cc(F)ccc4F)C[C@H]1C	BroadT	BRD-K93993174	BRD-K93993174-001-01-7	Broad Institute of MIT and Harvard	BRD-K93993174			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20+,29-/m1/s1	DXCXCRUBZQZACJ-WAPJKPAKSA-N	605.217126508							110801
BRD-K98418950	LSM-22246		54633585	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18-,22+/m0/s1	ZDHXOKWVDFHFNO-NPPFBWRTSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K98418950	BRD-K98418950-001-01-0	Broad Institute of MIT and Harvard	BRD-K98418950			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3C)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O5S/c1-16-8-6-7-9-23(16)33(29,30)26-19-10-11-21-20(12-19)24(28)27(4)14-22(31-5)17(2)13-25-18(3)15-32-21/h6-12,17-18,22,25-26H,13-15H2,1-5H3/t17-,18-,22+/m0/s1	ZDHXOKWVDFHFNO-NPPFBWRTSA-N	475.214091876							110802
BRD-K91624805	LSM-22247		54633577	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17-,21+/m0/s1	MRVBJXLMKDIORH-XGHQBKJUSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	BroadT	BRD-K91624805	BRD-K91624805-001-01-7	Broad Institute of MIT and Harvard	BRD-K91624805			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)NC(C)C	InChI=1S/C24H38N4O5/c1-8-22(29)26-18-9-10-20-19(11-18)23(30)27(6)13-21(32-7)16(4)12-28(17(5)14-33-20)24(31)25-15(2)3/h9-11,15-17,21H,8,12-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17-,21+/m0/s1	MRVBJXLMKDIORH-XGHQBKJUSA-N	462.284220356							110803
BRD-K61621331	LSM-22248		54633809	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	NUZAMTOBMKNCBP-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K61621331	BRD-K61621331-001-01-2	Broad Institute of MIT and Harvard	BRD-K61621331			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	NUZAMTOBMKNCBP-VVBPWWLESA-N	458.232933712							110804
BRD-K26163290	LSM-22249		54633702	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m0/s1	PVKMDQXGIZYRFS-XHNVNVPESA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K26163290	BRD-K26163290-001-01-8	Broad Institute of MIT and Harvard	BRD-K26163290			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m0/s1	PVKMDQXGIZYRFS-XHNVNVPESA-N	485.268984862							110805
BRD-K53127464	LSM-22250		54633711	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23+/m1/s1	KVPJAUDUDGITLT-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K53127464	BRD-K53127464-001-01-9	Broad Institute of MIT and Harvard	BRD-K53127464			CO[C@@H]1[C@H](C)CN(C)[C@H](C)COc2cc(ccc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23+/m1/s1	KVPJAUDUDGITLT-PNCHPQGNSA-N	475.214091876							110806
BRD-K57902040	LSM-22251		54633681	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m1/s1	GJRFAEJZYRRRGG-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K57902040	BRD-K57902040-001-01-4	Broad Institute of MIT and Harvard	BRD-K57902040			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m1/s1	GJRFAEJZYRRRGG-PNCHPQGNSA-N	439.247106566							110807
BRD-K62577212	LSM-22252		54633769	InChI=1S/C27H35N3O6/c1-17-13-30(14-20-8-6-7-9-22(20)27(33)34)18(2)16-36-24-12-21(28-19(3)31)10-11-23(24)26(32)29(4)15-25(17)35-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)(H,33,34)/t17-,18+,25+/m1/s1	WQHRELCCFAZVAH-UZEJHQAJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3ccccc3C(=O)O)C[C@H]1C	BroadT	BRD-K62577212	BRD-K62577212-001-01-9	Broad Institute of MIT and Harvard	BRD-K62577212			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2ccccc2C(O)=O)C[C@H]1C	InChI=1S/C27H35N3O6/c1-17-13-30(14-20-8-6-7-9-22(20)27(33)34)18(2)16-36-24-12-21(28-19(3)31)10-11-23(24)26(32)29(4)15-25(17)35-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)(H,33,34)/t17-,18+,25+/m1/s1	WQHRELCCFAZVAH-UZEJHQAJSA-N	497.25258587							110808
BRD-K13122423	LSM-22253		54633618	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17+,21-/m0/s1	NVAZGCBIIWIDIP-FVJLSDCUSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K13122423	BRD-K13122423-001-01-9	Broad Institute of MIT and Harvard	BRD-K13122423			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3nccs3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C23H34N4O5S2/c1-6-34(29,30)25-18-7-8-20-19(11-18)23(28)26(4)13-21(31-5)16(2)12-27(17(3)15-32-20)14-22-24-9-10-33-22/h7-11,16-17,21,25H,6,12-15H2,1-5H3/t16-,17+,21-/m0/s1	NVAZGCBIIWIDIP-FVJLSDCUSA-N	510.197061608							110809
BRD-K60948317	LSM-22254		54633747	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-8-6-7-9-23(20)28)19(2)16-36-24-12-21(29-26(32)17-34-4)10-11-22(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m1/s1	PGMRKFIOHDIEMF-WYEJZRMESA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccccc3F)[C@@H](C)COc2c1	BroadT	BRD-K60948317	BRD-K60948317-001-01-8	Broad Institute of MIT and Harvard	BRD-K60948317			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-8-6-7-9-23(20)28)19(2)16-36-24-12-21(29-26(32)17-34-4)10-11-22(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m1/s1	PGMRKFIOHDIEMF-WYEJZRMESA-N	501.263899482							110810
BRD-K16502264	LSM-22255		54633633	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24-/m1/s1	ZWIPCDYWVZDKTM-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K16502264	BRD-K16502264-001-01-1	Broad Institute of MIT and Harvard	BRD-K16502264			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24-/m1/s1	ZWIPCDYWVZDKTM-QZTZHPFYSA-N	488.29987042							110811
BRD-K52602815	LSM-22256		54633722	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	RZEAXGTWPWCQSI-RNHFSVANSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccccc3)[C@@H](C)COc2c1	BroadT	BRD-K52602815	BRD-K52602815-001-01-8	Broad Institute of MIT and Harvard	BRD-K52602815			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H37N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-13-22(28-26(31)18-33-4)11-12-23(24)27(32)29(3)16-25(19)34-5/h6-13,19-20,25H,14-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	RZEAXGTWPWCQSI-RNHFSVANSA-N	483.273321314							110812
BRD-K75610411	LSM-22257		54633819	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m1/s1	JZMVFBXUMGVJNA-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K75610411	BRD-K75610411-001-01-2	Broad Institute of MIT and Harvard	BRD-K75610411			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m1/s1	JZMVFBXUMGVJNA-ZMPRRUGASA-N	495.15946949							110813
CHEMBL2143676	LSM-22258	BRD-K55233780, SID131429946	54633694	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24+,31-/m0/s1	DZGZFXRKNSZUSK-JLELKNTQSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@@H]1C	BroadT	BRD-K55233780	BRD-K55233780-001-01-0	Broad Institute of MIT and Harvard	BRD-K55233780			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc2ccc(cc2)-c2ccccn2)C[C@@H]1C	InChI=1S/C33H43N5O4/c1-22(2)35-33(40)36-27-14-15-30-28(17-27)32(39)37(5)20-31(41-6)23(3)18-38(24(4)21-42-30)19-25-10-12-26(13-11-25)29-9-7-8-16-34-29/h7-17,22-24,31H,18-21H2,1-6H3,(H2,35,36,40)/t23-,24+,31-/m0/s1	DZGZFXRKNSZUSK-JLELKNTQSA-N	573.331504906							110814
BRD-K69080049	LSM-22259		54633646	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24+/m1/s1	SPZGDJFWGCVUSP-OJLQRUNKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K69080049	BRD-K69080049-001-01-6	Broad Institute of MIT and Harvard	BRD-K69080049			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24+/m1/s1	SPZGDJFWGCVUSP-OJLQRUNKSA-N	485.232599354							110815
BRD-K01362004	LSM-22260		54633572	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m1/s1	ZXTSYIHAQFFGAZ-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K01362004	BRD-K01362004-001-01-2	Broad Institute of MIT and Harvard	BRD-K01362004			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-18(27-25(32)28-21-9-7-6-8-20(21)26)10-11-19(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m1/s1	ZXTSYIHAQFFGAZ-DGGJZMOXSA-N	472.248583776							110816
BRD-K11054415	LSM-22261		54633521	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-7-6-10-26-12-19)17(2)15-34-22-11-20(27-18(3)30)8-9-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	GCQIYZLQWHNMPN-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3cccnc3	BroadT	BRD-K11054415	BRD-K11054415-001-01-6	Broad Institute of MIT and Harvard	BRD-K11054415			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1cccnc1	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-7-6-10-26-12-19)17(2)15-34-22-11-20(27-18(3)30)8-9-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	GCQIYZLQWHNMPN-SEPYTNNBSA-N	468.237270164							110817
BRD-K59841546	LSM-22262		54633701	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m1/s1	PVKMDQXGIZYRFS-MPCDZSKCSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H]1C)OC	BroadT	BRD-K59841546	BRD-K59841546-001-01-1	Broad Institute of MIT and Harvard	BRD-K59841546			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cccc(F)c3)ccc2OC[C@H]1C)OC	InChI=1S/C27H36FN3O4/c1-6-12-31-15-18(2)25(34-5)16-30(4)27(33)23-14-22(10-11-24(23)35-17-19(31)3)29-26(32)20-8-7-9-21(28)13-20/h7-11,13-14,18-19,25H,6,12,15-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m1/s1	PVKMDQXGIZYRFS-MPCDZSKCSA-N	485.268984862							110818
BRD-K53774864	LSM-22263		54633678	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25-/m0/s1	LJEPJNUBINCHMU-ATLLOTDBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3ccc(F)cc3)C[C@@H]1C	BroadT	BRD-K53774864	BRD-K53774864-001-01-4	Broad Institute of MIT and Harvard	BRD-K53774864			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2ccc(F)cc2)C[C@@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-6-8-21(27)9-7-20)18(2)16-34-24-11-10-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25-/m0/s1	LJEPJNUBINCHMU-ATLLOTDBSA-N	471.253334798							110819
BRD-K95569142	LSM-22264		54633656	InChI=1S/C24H33N3O5S/c1-16-7-6-8-20(11-16)33(29,30)26-19-9-10-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23-/m1/s1	XSBCZNRPWNAZBQ-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(C)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K95569142	BRD-K95569142-001-01-2	Broad Institute of MIT and Harvard	BRD-K95569142			CO[C@@H]1CN(C)C(=O)c2ccc(cc2OC[C@H](C)NC[C@H]1C)NS(=O)(=O)c1cccc(C)c1	InChI=1S/C24H33N3O5S/c1-16-7-6-8-20(11-16)33(29,30)26-19-9-10-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18+,23-/m1/s1	XSBCZNRPWNAZBQ-IEGUWTFLSA-N	475.214091876							110820
BRD-K01152687	LSM-22265		54633666	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20-,26+/m1/s1	ZQKSOPNYGIRHEN-KYTVRQNUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@H]1C	BroadT	BRD-K01152687	BRD-K01152687-001-01-1	Broad Institute of MIT and Harvard	BRD-K01152687			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C27H37N3O4/c1-19-16-30(14-13-22-9-7-6-8-10-22)20(2)18-34-25-12-11-23(28-21(3)31)15-24(25)27(32)29(4)17-26(19)33-5/h6-12,15,19-20,26H,13-14,16-18H2,1-5H3,(H,28,31)/t19-,20-,26+/m1/s1	ZQKSOPNYGIRHEN-KYTVRQNUSA-N	467.278406694							110821
BRD-K20495487	LSM-22266		54633715	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23-/m0/s1	KVPJAUDUDGITLT-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K20495487	BRD-K20495487-001-01-3	Broad Institute of MIT and Harvard	BRD-K20495487			CO[C@@H]1[C@@H](C)CN(C)[C@H](C)COc2cc(ccc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23-/m0/s1	KVPJAUDUDGITLT-IXFSTUDKSA-N	475.214091876							110822
BRD-K48689133	LSM-22267		54633554	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16+,23-/m1/s1	ZNOAHICTVVWKDV-VBURHUQHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K48689133	BRD-K48689133-001-01-7	Broad Institute of MIT and Harvard	BRD-K48689133			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16+,23-/m1/s1	ZNOAHICTVVWKDV-VBURHUQHSA-N	498.247834848							110823
BRD-K56015010	LSM-22268		54633647	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24+/m0/s1	SPZGDJFWGCVUSP-OBWXTZQISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K56015010	BRD-K56015010-001-01-2	Broad Institute of MIT and Harvard	BRD-K56015010			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-21(28-25(32)19-6-8-20(27)9-7-19)12-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24+/m0/s1	SPZGDJFWGCVUSP-OBWXTZQISA-N	485.232599354							110824
BRD-K36782804	LSM-22269		54633556	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20-,27+/m1/s1	MBZIAPCTYFYNLY-DVHCVUMVSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K36782804	BRD-K36782804-001-01-2	Broad Institute of MIT and Harvard	BRD-K36782804			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20-,27+/m1/s1	MBZIAPCTYFYNLY-DVHCVUMVSA-N	509.288971378							110825
BRD-K34710061	LSM-22270		54633541	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19-,26-/m1/s1	AHCGLCWYVPJPSC-LJKQEARRSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K34710061	BRD-K34710061-001-01-3	Broad Institute of MIT and Harvard	BRD-K34710061			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H38N6O6/c1-18-15-36(30(39)33-27-20(3)34-42-21(27)4)19(2)17-41-25-14-23(32-29(38)31-22-10-8-7-9-11-22)12-13-24(25)28(37)35(5)16-26(18)40-6/h7-14,18-19,26H,15-17H2,1-6H3,(H,33,39)(H2,31,32,38)/t18-,19-,26-/m1/s1	AHCGLCWYVPJPSC-LJKQEARRSA-N	578.285282996							110826
BRD-K57167256	LSM-22271		54633620	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25-/m1/s1	WLFCSTFPAYFGAE-QJMRKGMQSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K57167256	BRD-K57167256-001-01-3	Broad Institute of MIT and Harvard	BRD-K57167256			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-13-21(28-26(32)20-7-10-22(34-5)11-8-20)9-12-23(24)27(33)29(4)15-25(17)35-6/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25-/m1/s1	WLFCSTFPAYFGAE-QJMRKGMQSA-N	497.25258587							110827
BRD-K84788922	LSM-22272		54633741	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15+,22+/m0/s1	XSWCXHAXMDYWQG-SMASLZHESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K84788922	BRD-K84788922-001-01-7	Broad Institute of MIT and Harvard	BRD-K84788922			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15+,22+/m0/s1	XSWCXHAXMDYWQG-SMASLZHESA-N	472.232184784							110828
BRD-K20253608	LSM-22273		54633808	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	NUZAMTOBMKNCBP-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K20253608	BRD-K20253608-001-01-0	Broad Institute of MIT and Harvard	BRD-K20253608			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-10-9-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-17(25)6-8-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	NUZAMTOBMKNCBP-MCFFVMPBSA-N	458.232933712							110829
BRD-K71607378	LSM-22274		54633779	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	LMAOWKPBCKGOJC-IEGUWTFLSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K71607378	BRD-K71607378-001-01-3	Broad Institute of MIT and Harvard	BRD-K71607378			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	LMAOWKPBCKGOJC-IEGUWTFLSA-N	485.26381927							110830
BRD-K48863591	LSM-22275		54633773	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	LMAOWKPBCKGOJC-STSQHVNTSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K48863591	BRD-K48863591-001-01-3	Broad Institute of MIT and Harvard	BRD-K48863591			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	LMAOWKPBCKGOJC-STSQHVNTSA-N	485.26381927							110831
BRD-K50216418	LSM-22276		54633762	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17-,25+/m0/s1	BJYPLSOQEPUFOR-XOWTYJCDSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3cc(F)ccc3F)C[C@@H]1C	BroadT	BRD-K50216418	BRD-K50216418-001-01-0	Broad Institute of MIT and Harvard	BRD-K50216418			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2cc(F)ccc2F)C[C@@H]1C	InChI=1S/C26H33F2N3O4/c1-16-12-31(13-19-10-20(27)6-9-23(19)28)17(2)15-35-24-11-21(29-18(3)32)7-8-22(24)26(33)30(4)14-25(16)34-5/h6-11,16-17,25H,12-15H2,1-5H3,(H,29,32)/t16-,17-,25+/m0/s1	BJYPLSOQEPUFOR-XOWTYJCDSA-N	489.243912966							110832
BRD-K56283394	LSM-22277		54633748	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-8-6-7-9-23(20)28)19(2)16-36-24-12-21(29-26(32)17-34-4)10-11-22(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m0/s1	PGMRKFIOHDIEMF-OSWQYVSFSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccccc3F)[C@H](C)COc2c1	BroadT	BRD-K56283394	BRD-K56283394-001-01-2	Broad Institute of MIT and Harvard	BRD-K56283394			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3F)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O5/c1-18-13-31(14-20-8-6-7-9-23(20)28)19(2)16-36-24-12-21(29-26(32)17-34-4)10-11-22(24)27(33)30(3)15-25(18)35-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m0/s1	PGMRKFIOHDIEMF-OSWQYVSFSA-N	501.263899482							110833
BRD-K13119652	LSM-22278		54633563	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	BLKNSIVDUMMEFS-RNHFSVANSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K13119652	BRD-K13119652-001-01-7	Broad Institute of MIT and Harvard	BRD-K13119652			COCC(=O)Nc1ccc2OC[C@H](C)N(CC3CCCCC3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	BLKNSIVDUMMEFS-RNHFSVANSA-N	489.320271506							110834
BRD-K75583553	LSM-22279		54633716	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23-/m1/s1	KVPJAUDUDGITLT-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K75583553	BRD-K75583553-001-01-9	Broad Institute of MIT and Harvard	BRD-K75583553			CO[C@H]1[C@H](C)CN(C)[C@@H](C)COc2cc(ccc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-13-19(25-33(29,30)20-9-7-6-8-10-20)11-12-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23-/m1/s1	KVPJAUDUDGITLT-IEGUWTFLSA-N	475.214091876							110835
BRD-K97421379	LSM-22280		54633567	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m1/s1	BLKNSIVDUMMEFS-UMEGOILYSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K97421379	BRD-K97421379-001-01-8	Broad Institute of MIT and Harvard	BRD-K97421379			COCC(=O)Nc1ccc2OC[C@@H](C)N(CC3CCCCC3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H43N3O5/c1-19-14-30(15-21-9-7-6-8-10-21)20(2)17-35-24-12-11-22(28-26(31)18-33-4)13-23(24)27(32)29(3)16-25(19)34-5/h11-13,19-21,25H,6-10,14-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m1/s1	BLKNSIVDUMMEFS-UMEGOILYSA-N	489.320271506							110836
BRD-K52428486	LSM-22281		54633651	InChI=1S/C24H33N3O5S/c1-16-7-6-8-20(11-16)33(29,30)26-19-9-10-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18-,23-/m1/s1	XSBCZNRPWNAZBQ-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(C)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K52428486	BRD-K52428486-001-01-6	Broad Institute of MIT and Harvard	BRD-K52428486			CO[C@@H]1CN(C)C(=O)c2ccc(cc2OC[C@@H](C)NC[C@H]1C)NS(=O)(=O)c1cccc(C)c1	InChI=1S/C24H33N3O5S/c1-16-7-6-8-20(11-16)33(29,30)26-19-9-10-21-22(12-19)32-15-18(3)25-13-17(2)23(31-5)14-27(4)24(21)28/h6-12,17-18,23,25-26H,13-15H2,1-5H3/t17-,18-,23-/m1/s1	XSBCZNRPWNAZBQ-PMAPCBKXSA-N	475.214091876							110837
BRD-K71622214	LSM-22282		54633820	InChI=1S/C26H33N3O5/c1-17-14-29(19(3)30)18(2)16-34-23-13-21(27-25(31)20-9-7-6-8-10-20)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,31)/t17-,18-,24-/m1/s1	MYTMXMAZMZDXSF-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K71622214	BRD-K71622214-001-01-0	Broad Institute of MIT and Harvard	BRD-K71622214			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33N3O5/c1-17-14-29(19(3)30)18(2)16-34-23-13-21(27-25(31)20-9-7-6-8-10-20)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,31)/t17-,18-,24-/m1/s1	MYTMXMAZMZDXSF-QZTZHPFYSA-N	467.242021186							110838
BRD-K63960902	LSM-22283		54633548	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16-,23-/m1/s1	ZNOAHICTVVWKDV-CKNGIIGNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K63960902	BRD-K63960902-001-01-1	Broad Institute of MIT and Harvard	BRD-K63960902			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C26H34N4O6/c1-15-12-30(25(32)18-6-7-18)16(2)14-35-22-9-8-19(27-24(31)21-10-17(3)36-28-21)11-20(22)26(33)29(4)13-23(15)34-5/h8-11,15-16,18,23H,6-7,12-14H2,1-5H3,(H,27,31)/t15-,16-,23-/m1/s1	ZNOAHICTVVWKDV-CKNGIIGNSA-N	498.247834848							110839
BRD-K93900188	LSM-22284		54633631	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24+/m0/s1	ZWIPCDYWVZDKTM-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K93900188	BRD-K93900188-001-01-6	Broad Institute of MIT and Harvard	BRD-K93900188			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24+/m0/s1	ZWIPCDYWVZDKTM-HOOSLVGPSA-N	488.29987042							110840
BRD-K63809385	LSM-22285		54633560	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20+,27-/m0/s1	MBZIAPCTYFYNLY-VKIDHGPPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K63809385	BRD-K63809385-001-01-6	Broad Institute of MIT and Harvard	BRD-K63809385			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-9-10-21)20(2)18-37-26-14-23(30-28(33)22-7-6-8-24(13-22)35-4)11-12-25(26)29(34)31(3)17-27(19)36-5/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H,30,33)/t19-,20+,27-/m0/s1	MBZIAPCTYFYNLY-VKIDHGPPSA-N	509.288971378							110841
BRD-K67740871	LSM-22286		54633536	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20+,25+/m1/s1	XWLPDPDFVWQKHJ-RNHFSVANSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K67740871	BRD-K67740871-001-01-0	Broad Institute of MIT and Harvard	BRD-K67740871			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C28H39N5O5/c1-19-15-33(26(34)17-31(3)4)20(2)18-38-24-13-12-22(30-28(36)29-21-10-8-7-9-11-21)14-23(24)27(35)32(5)16-25(19)37-6/h7-14,19-20,25H,15-18H2,1-6H3,(H2,29,30,36)/t19-,20+,25+/m1/s1	XWLPDPDFVWQKHJ-RNHFSVANSA-N	525.295119398							110842
BRD-K77011363	LSM-22287		54633604	InChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18+,23-/m0/s1	OOYNITMNEHZMFB-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3cccnc3)C[C@@H]1C	BroadT	BRD-K77011363	BRD-K77011363-001-01-9	Broad Institute of MIT and Harvard	BRD-K77011363			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18+,23-/m0/s1	OOYNITMNEHZMFB-IXFSTUDKSA-N	490.224990918							110843
BRD-K34423419	LSM-22288		54633738	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15-,22+/m0/s1	XSWCXHAXMDYWQG-AYSMAOOMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K34423419	BRD-K34423419-001-01-2	Broad Institute of MIT and Harvard	BRD-K34423419			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15-,22+/m0/s1	XSWCXHAXMDYWQG-AYSMAOOMSA-N	472.232184784							110844
BRD-K07438795	LSM-22289		54633700	InChI=1S/C25H35N3O7S2/c1-17-9-7-8-10-24(17)37(32,33)26-20-11-12-21-22(13-20)35-16-19(3)28(36(6,30)31)14-18(2)23(34-5)15-27(4)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19+,23-/m1/s1	OWRIETMUXQHNFA-SELNLUPBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K07438795	BRD-K07438795-001-01-7	Broad Institute of MIT and Harvard	BRD-K07438795			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C25H35N3O7S2/c1-17-9-7-8-10-24(17)37(32,33)26-20-11-12-21-22(13-20)35-16-19(3)28(36(6,30)31)14-18(2)23(34-5)15-27(4)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19+,23-/m1/s1	OWRIETMUXQHNFA-SELNLUPBSA-N	553.19164187							110845
BRD-K35422614	LSM-22290		54633753	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20+,26+/m1/s1	PWYLLXJABFYBFY-GOHWNWGWSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K35422614	BRD-K35422614-001-01-6	Broad Institute of MIT and Harvard	BRD-K35422614			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O6/c1-19-14-31(15-21-9-7-8-10-24(21)35-5)20(2)17-37-25-12-11-22(29-27(32)18-34-4)13-23(25)28(33)30(3)16-26(19)36-6/h7-13,19-20,26H,14-18H2,1-6H3,(H,29,32)/t19-,20+,26+/m1/s1	PWYLLXJABFYBFY-GOHWNWGWSA-N	513.283885998							110846
BRD-K13715646	LSM-22291		54633739	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15-,22+/m1/s1	XSWCXHAXMDYWQG-HLFMIMNKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K13715646	BRD-K13715646-001-01-1	Broad Institute of MIT and Harvard	BRD-K13715646			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15-,22+/m1/s1	XSWCXHAXMDYWQG-HLFMIMNKSA-N	472.232184784							110847
BRD-K22679163	LSM-22292		54633740	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15+,22+/m1/s1	XSWCXHAXMDYWQG-GTQRCTGISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K22679163	BRD-K22679163-001-01-1	Broad Institute of MIT and Harvard	BRD-K22679163			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C24H32N4O6/c1-14-11-28(17(4)29)15(2)13-33-21-8-7-18(25-23(30)20-9-16(3)34-26-20)10-19(21)24(31)27(5)12-22(14)32-6/h7-10,14-15,22H,11-13H2,1-6H3,(H,25,30)/t14-,15+,22+/m1/s1	XSWCXHAXMDYWQG-GTQRCTGISA-N	472.232184784							110848
BRD-K96209756	LSM-22293		54633632	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24-/m0/s1	ZWIPCDYWVZDKTM-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K96209756	BRD-K96209756-001-01-1	Broad Institute of MIT and Harvard	BRD-K96209756			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H40N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h11-13,17-18,20,24H,6-10,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24-/m0/s1	ZWIPCDYWVZDKTM-XFAGBWLFSA-N	488.29987042							110849
BRD-K52416366	LSM-22294		54633772	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18-,23+/m0/s1	LMAOWKPBCKGOJC-IUKKYPGJSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K52416366	BRD-K52416366-001-01-6	Broad Institute of MIT and Harvard	BRD-K52416366			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H35N5O5/c1-17-11-30(12-19-9-26-16-27-10-19)18(2)14-35-22-7-6-20(28-24(31)15-33-4)8-21(22)25(32)29(3)13-23(17)34-5/h6-10,16-18,23H,11-15H2,1-5H3,(H,28,31)/t17-,18-,23+/m0/s1	LMAOWKPBCKGOJC-IUKKYPGJSA-N	485.26381927							110850
BRD-K01805176	LSM-22295		54633822	InChI=1S/C26H33N3O5/c1-17-14-29(19(3)30)18(2)16-34-23-13-21(27-25(31)20-9-7-6-8-10-20)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,31)/t17-,18+,24+/m1/s1	MYTMXMAZMZDXSF-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K01805176	BRD-K01805176-001-01-2	Broad Institute of MIT and Harvard	BRD-K01805176			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33N3O5/c1-17-14-29(19(3)30)18(2)16-34-23-13-21(27-25(31)20-9-7-6-8-10-20)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,31)/t17-,18+,24+/m1/s1	MYTMXMAZMZDXSF-YTZAWJCFSA-N	467.242021186							110851
BRD-K28165728	LSM-22296		54633684	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23-/m0/s1	GJRFAEJZYRRRGG-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K28165728	BRD-K28165728-001-01-3	Broad Institute of MIT and Harvard	BRD-K28165728			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-12-11-20(26-24(29)19-9-7-6-8-10-19)13-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23-/m0/s1	GJRFAEJZYRRRGG-BSRJHKFKSA-N	439.247106566							110852
BRD-K82967678	LSM-22297		44495985	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23+,24-,29-/m1/s1	VOOFHSDUWYITSP-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K82967678	BRD-K82967678-001-01-5	Broad Institute of MIT and Harvard	BRD-K82967678			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23+,24-,29-/m1/s1	VOOFHSDUWYITSP-CDLOMYRSSA-N	603.2978215							110853
BRD-K78610238-001-01-0	LSM-22298	BRD-K78610238	54614966	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,28+/m0/s1	DZFCVSNNMFSZPA-RTQSYTKOSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K78610238	BRD-K78610238-001-01-0	Broad Institute of MIT and Harvard	BRD-K78610238			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,28+/m0/s1	DZFCVSNNMFSZPA-RTQSYTKOSA-N	570.305349724							110854
BRD-K93613839	LSM-22299		44617922	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22+,26+/m1/s1	UJYZNBPSVBHVBP-QILISPFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K93613839	BRD-K93613839-001-01-8	Broad Institute of MIT and Harvard	BRD-K93613839			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22+,26+/m1/s1	UJYZNBPSVBHVBP-QILISPFLSA-N	579.3090549							110855
BRD-K85821470-001-01-1	LSM-22300	BRD-K85821470	54614919	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20-,21-,27-/m1/s1	JTLOVMZMVDHICP-NUFXCCFXSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K85821470	BRD-K85821470-001-01-1	Broad Institute of MIT and Harvard	BRD-K85821470			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20-,21-,27-/m1/s1	JTLOVMZMVDHICP-NUFXCCFXSA-N	594.302905052							110856
BRD-K83108629	LSM-22301		44498092	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18+,19+,25+/m0/s1	OIOMLIQJBPNRTR-UFXZXOMWSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K83108629	BRD-K83108629-001-01-5	Broad Institute of MIT and Harvard	BRD-K83108629			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18+,19+,25+/m0/s1	OIOMLIQJBPNRTR-UFXZXOMWSA-N	545.321334146							110857
BRD-K97149069	LSM-6169		44487439	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25-,26+,31+/m0/s1	SIHQACFNVCTPOW-PZTYDPALSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K97149069	BRD-K97149069-001-01-0	Broad Institute of MIT and Harvard	BRD-K97149069			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25-,26+,31+/m0/s1	SIHQACFNVCTPOW-PZTYDPALSA-N	582.37812074							94950
BRD-K89476673	LSM-22302		54614932	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24-,30+/m0/s1	XIVCQDXGZVVHDO-WUBQMYJQSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K89476673	BRD-K89476673-001-01-5	Broad Institute of MIT and Harvard	BRD-K89476673			COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(NS(C)(=O)=O)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24-,30+/m0/s1	XIVCQDXGZVVHDO-WUBQMYJQSA-N	605.313471564							110858
BRD-K85633971	LSM-22303		54614917	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28-,33-/m1/s1	XXBVUIDNUVBELT-UJCZQSIQSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K85633971	BRD-K85633971-001-01-4	Broad Institute of MIT and Harvard	BRD-K85633971			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28-,33-/m1/s1	XXBVUIDNUVBELT-UJCZQSIQSA-N	616.45637106							110859
BRD-K96641838	LSM-22304		54614953	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27-/m1/s1	OPIQAKQROYPQNZ-FGCFSOHPSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K96641838	BRD-K96641838-001-01-7	Broad Institute of MIT and Harvard	BRD-K96641838			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27-/m1/s1	OPIQAKQROYPQNZ-FGCFSOHPSA-N	565.26218492							110860
BRD-K90111788	LSM-22305		44485147	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23-,27+/m1/s1	LTGDTYHJVMKPBL-IDIXZGLXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K90111788	BRD-K90111788-001-01-7	Broad Institute of MIT and Harvard	BRD-K90111788			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23-,27+/m1/s1	LTGDTYHJVMKPBL-IDIXZGLXSA-N	534.37812074							110861
BRD-K89264608	LSM-22306		44619631	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19-,23-/m0/s1	QBUCHBBMZJBUJI-YWNPBTLJSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K89264608	BRD-K89264608-001-01-5	Broad Institute of MIT and Harvard	BRD-K89264608			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19-,23-/m0/s1	QBUCHBBMZJBUJI-YWNPBTLJSA-N	531.29200601							110862
BRD-K92195351	LSM-22307		44495461	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22-,23-,28-/m1/s1	SCSZUZCJLHTTSJ-TZTMDHJLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K92195351	BRD-K92195351-001-01-5	Broad Institute of MIT and Harvard	BRD-K92195351			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22-,23-,28-/m1/s1	SCSZUZCJLHTTSJ-TZTMDHJLSA-N	589.282171436							110863
BRD-K93442068	LSM-22308		54614943	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25-,30+/m1/s1	ZGCRSIABJPRXFC-GBRARVNLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K93442068	BRD-K93442068-001-01-4	Broad Institute of MIT and Harvard	BRD-K93442068			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25-,30+/m1/s1	ZGCRSIABJPRXFC-GBRARVNLSA-N	553.351571634							110864
BRD-K87080069	LSM-22309		44618934	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24+,25-,29+/m0/s1	NSUWFWDPIIGHAU-APSVEGKFSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K87080069	BRD-K87080069-001-01-9	Broad Institute of MIT and Harvard	BRD-K87080069			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24+,25-,29+/m0/s1	NSUWFWDPIIGHAU-APSVEGKFSA-N	562.409420868							110865
BRD-K90047132	LSM-22310		44494558	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23+,24-,29+/m1/s1	VOOFHSDUWYITSP-HZTMJRFTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K90047132	BRD-K90047132-001-01-6	Broad Institute of MIT and Harvard	BRD-K90047132			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23+,24-,29+/m1/s1	VOOFHSDUWYITSP-HZTMJRFTSA-N	603.2978215							110866
BRD-K84956158	LSM-22311		54614913	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24+,29-/m0/s1	XPIAMQJKSFNCJS-OODISRMCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K84956158	BRD-K84956158-001-01-5	Broad Institute of MIT and Harvard	BRD-K84956158			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24+,29-/m0/s1	XPIAMQJKSFNCJS-OODISRMCSA-N	603.2978215							110867
BRD-K82273064	LSM-22312		44619086	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24-,25+,31+/m1/s1	HLAXWBUNQRUQJP-CYOUBLJMSA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)N(C)C)cc1	BroadT	BRD-K82273064	BRD-K82273064-001-01-0	Broad Institute of MIT and Harvard	BRD-K82273064			COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)N(C)C)cc1	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24-,25+,31+/m1/s1	HLAXWBUNQRUQJP-CYOUBLJMSA-N	555.367221698							110868
BRD-K89040924	LSM-22313		44491519	InChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16+,17-,21+/m1/s1	XRGBJGDCXQTJDT-WOYCLPQFSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(N)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K89040924	BRD-K89040924-001-01-6	Broad Institute of MIT and Harvard	BRD-K89040924			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(N)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16+,17-,21+/m1/s1	XRGBJGDCXQTJDT-WOYCLPQFSA-N	407.278406694							110869
BRD-K82774801	LSM-22314		44492637	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27-/m0/s1	JMPHEZKYQLUQMM-RJESQKRESA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K82774801	BRD-K82774801-001-01-5	Broad Institute of MIT and Harvard	BRD-K82774801			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27-/m0/s1	JMPHEZKYQLUQMM-RJESQKRESA-N	517.351571634							110870
BRD-K85513337	LSM-22315		44620539	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23+,29-/m1/s1	QSYAMXVABCSWEP-KOBSQPAKSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K85513337	BRD-K85513337-001-01-7	Broad Institute of MIT and Harvard	BRD-K85513337			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23+,29-/m1/s1	QSYAMXVABCSWEP-KOBSQPAKSA-N	622.33420518							110871
BRD-K79267333	LSM-22316		44501136	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23+,24+,30-/m0/s1	OKIGVZMNGZVCJM-YTNVWYNJSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C	BroadT	BRD-K79267333	BRD-K79267333-001-01-2	Broad Institute of MIT and Harvard	BRD-K79267333			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23+,24+,30-/m0/s1	OKIGVZMNGZVCJM-YTNVWYNJSA-N	605.313471564							110872
BRD-K95251122	LSM-22317		54614948	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33+/m0/s1	FHYFYPZRCDKSKV-LIHQSLCGSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K95251122	BRD-K95251122-001-01-1	Broad Institute of MIT and Harvard	BRD-K95251122			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33+/m0/s1	FHYFYPZRCDKSKV-LIHQSLCGSA-N	608.393770804							110873
BRD-K95264594	LSM-22318		54614949	InChI=1S/C31H46N4O5/c1-6-16-34(5)20-29-22(2)19-35(23(3)21-36)31(38)27-18-26(33-30(37)25-12-14-32-15-13-25)10-11-28(27)40-24(4)9-7-8-17-39-29/h10-15,18,22-24,29,36H,6-9,16-17,19-21H2,1-5H3,(H,33,37)/t22-,23-,24+,29-/m1/s1	UGZNIWWZAWAINA-IDCDSMMUSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K95264594	BRD-K95264594-001-01-3	Broad Institute of MIT and Harvard	BRD-K95264594			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C31H46N4O5/c1-6-16-34(5)20-29-22(2)19-35(23(3)21-36)31(38)27-18-26(33-30(37)25-12-14-32-15-13-25)10-11-28(27)40-24(4)9-7-8-17-39-29/h10-15,18,22-24,29,36H,6-9,16-17,19-21H2,1-5H3,(H,33,37)/t22-,23-,24+,29-/m1/s1	UGZNIWWZAWAINA-IDCDSMMUSA-N	554.346820612							110874
BRD-K94306568	LSM-22319		44502285	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28+,33+/m0/s1	XXBVUIDNUVBELT-AMBSETBHSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K94306568	BRD-K94306568-001-01-5	Broad Institute of MIT and Harvard	BRD-K94306568			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28+,33+/m0/s1	XXBVUIDNUVBELT-AMBSETBHSA-N	616.45637106							110875
BRD-K96265882	LSM-22320		44485113	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28+/m0/s1	VTJNXDUZLOWMHH-KKQCDPINSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K96265882	BRD-K96265882-001-01-0	Broad Institute of MIT and Harvard	BRD-K96265882			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28+/m0/s1	VTJNXDUZLOWMHH-KKQCDPINSA-N	531.367221698							110876
MLS003128757	LSM-22321	BRD-K96549574, SID99358988	44502277	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24+,25+,30+/m0/s1	HYZLHQOJAWWHRH-RZDWVWPCSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K96549574	BRD-K96549574-001-01-0	Broad Institute of MIT and Harvard	BRD-K96549574			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24+,25+,30+/m0/s1	HYZLHQOJAWWHRH-RZDWVWPCSA-N	589.318556944							110877
BRD-K86911380	LSM-22322		54614924	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24+/m0/s1	ORDOAKKGIRZCMJ-CMCWBKRRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K86911380	BRD-K86911380-001-01-8	Broad Institute of MIT and Harvard	BRD-K86911380			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20-,24+/m0/s1	ORDOAKKGIRZCMJ-CMCWBKRRSA-N	513.287256816							110878
BRD-K94378105	LSM-22323		44492602	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24+,29-/m0/s1	ZQLCRBSTGDSWQO-OODISRMCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K94378105	BRD-K94378105-001-01-4	Broad Institute of MIT and Harvard	BRD-K94378105			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24+,29-/m0/s1	ZQLCRBSTGDSWQO-OODISRMCSA-N	526.351905992							110879
BRD-K96969336	LSM-22324		54614954	InChI=1S/C32H47FN4O5/c1-6-16-36(5)20-30-22(2)19-37(23(3)21-38)31(39)28-18-27(35-32(40)34-26-12-10-25(33)11-13-26)14-15-29(28)42-24(4)9-7-8-17-41-30/h10-15,18,22-24,30,38H,6-9,16-17,19-21H2,1-5H3,(H2,34,35,40)/t22-,23+,24-,30-/m1/s1	ZDZLFJDSEKLXNO-UTSVKBTJSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K96969336	BRD-K96969336-001-01-9	Broad Institute of MIT and Harvard	BRD-K96969336			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H47FN4O5/c1-6-16-36(5)20-30-22(2)19-37(23(3)21-38)31(39)28-18-27(35-32(40)34-26-12-10-25(33)11-13-26)14-15-29(28)42-24(4)9-7-8-17-41-30/h10-15,18,22-24,30,38H,6-9,16-17,19-21H2,1-5H3,(H2,34,35,40)/t22-,23+,24-,30-/m1/s1	ZDZLFJDSEKLXNO-UTSVKBTJSA-N	586.353048844							110880
BRD-K90349877	LSM-22325		44494557	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23+,24-,28+/m1/s1	FCDOAUZTELHSSL-PVIBPIFHSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K90349877	BRD-K90349877-001-01-5	Broad Institute of MIT and Harvard	BRD-K90349877			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23+,24-,28+/m1/s1	FCDOAUZTELHSSL-PVIBPIFHSA-N	548.393770804							110881
BRD-K87023633	LSM-22326		44487567	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,28+/m1/s1	BRKIAEBRDYHMFE-DHMIZTNRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K87023633	BRD-K87023633-001-01-6	Broad Institute of MIT and Harvard	BRD-K87023633			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,28+/m1/s1	BRKIAEBRDYHMFE-DHMIZTNRSA-N	540.331170548							110882
BRD-K84115096	LSM-22327		44498633	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28+/m0/s1	KDWFAOIYLGHTDK-SXKDZKFMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	BroadT	BRD-K84115096	BRD-K84115096-001-01-3	Broad Institute of MIT and Harvard	BRD-K84115096			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28+/m0/s1	KDWFAOIYLGHTDK-SXKDZKFMSA-N	579.277834984							110883
BRD-K98630904-001-01-7	LSM-6814	BRD0904, SD-6-035-A2	49842983	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24+,31+/m0/s1	WIYHORLWMFSPCL-UBWFJNMSSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K98630904	BRD-K98630904-001-01-7	Broad Institute of MIT and Harvard	BRD-K98630904			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24+,31+/m0/s1	WIYHORLWMFSPCL-UBWFJNMSSA-N	569.346486254							95435
BRD-K91120514	LSM-22328		49843157	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23+,30+/m1/s1	SIEZSLVXLUPDNY-LRKPSKMWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K91120514	BRD-K91120514-001-01-8	Broad Institute of MIT and Harvard	BRD-K91120514			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23+,30+/m1/s1	SIEZSLVXLUPDNY-LRKPSKMWSA-N	598.336649852							110884
BRD-K86050213	LSM-22329		44490337	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24+,29+/m0/s1	QUSLWNNTNFDPAB-PHBCIFJZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K86050213	BRD-K86050213-001-01-8	Broad Institute of MIT and Harvard	BRD-K86050213			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24+,29+/m0/s1	QUSLWNNTNFDPAB-PHBCIFJZSA-N	545.382871762							110885
BRD-K80895505	LSM-22330		44483931	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22-,23+,28-/m0/s1	GAZXHMFIMHCKKU-QKFCCHLXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K80895505	BRD-K80895505-001-01-9	Broad Institute of MIT and Harvard	BRD-K80895505			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22-,23+,28-/m0/s1	GAZXHMFIMHCKKU-QKFCCHLXSA-N	576.298155858							110886
BRD-K80690345	LSM-22331		44493607	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24+,29-/m1/s1	OJAAEAMCTGSNOQ-CAFXQFFASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K80690345	BRD-K80690345-001-01-8	Broad Institute of MIT and Harvard	BRD-K80690345			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24+,29-/m1/s1	OJAAEAMCTGSNOQ-CAFXQFFASA-N	575.30290688							110887
BRD-K98133478	LSM-22332		54614960	InChI=1S/C29H47N5O6S/c1-7-13-32(5)17-27-21(2)16-34(22(3)19-35)29(36)25-15-24(31-41(37,38)28-18-33(6)20-30-28)11-12-26(25)40-23(4)10-8-9-14-39-27/h11-12,15,18,20-23,27,31,35H,7-10,13-14,16-17,19H2,1-6H3/t21-,22-,23-,27-/m1/s1	IKHNOPCXKIAMPI-DVAKJLRASA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K98133478	BRD-K98133478-001-01-8	Broad Institute of MIT and Harvard	BRD-K98133478			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H47N5O6S/c1-7-13-32(5)17-27-21(2)16-34(22(3)19-35)29(36)25-15-24(31-41(37,38)28-18-33(6)20-30-28)11-12-26(25)40-23(4)10-8-9-14-39-27/h11-12,15,18,20-23,27,31,35H,7-10,13-14,16-17,19H2,1-6H3/t21-,22-,23-,27-/m1/s1	IKHNOPCXKIAMPI-DVAKJLRASA-N	593.324704964							110888
BRD-K97624648	LSM-22333		44619531	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28-/m1/s1	VUABGABXFJSUSX-TZTMDHJLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K97624648	BRD-K97624648-001-01-2	Broad Institute of MIT and Harvard	BRD-K97624648			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28-/m1/s1	VUABGABXFJSUSX-TZTMDHJLSA-N	546.37812074							110889
BRD-K97869597	LSM-22334		44491479	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20-,24-/m1/s1	JFWSYQFTTWMPPF-DBYOASNMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K97869597	BRD-K97869597-001-01-4	Broad Institute of MIT and Harvard	BRD-K97869597			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20-,24-/m1/s1	JFWSYQFTTWMPPF-DBYOASNMSA-N	545.307656074							110890
BRD-K83124600	LSM-22335		54614908	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20-,24+/m0/s1	ZPGALQDMRVAORJ-CMCWBKRRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K83124600	BRD-K83124600-001-01-5	Broad Institute of MIT and Harvard	BRD-K83124600			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20-,24+/m0/s1	ZPGALQDMRVAORJ-CMCWBKRRSA-N	609.269556004							110891
BRD-K83463455	LSM-22336		44487447	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28+/m0/s1	VTJNXDUZLOWMHH-HIAVRWOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K83463455	BRD-K83463455-001-01-3	Broad Institute of MIT and Harvard	BRD-K83463455			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28+/m0/s1	VTJNXDUZLOWMHH-HIAVRWOZSA-N	531.367221698							110892
BRD-K81465091	LSM-22337		44617651	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22-,23+,28-/m1/s1	BJJOMMAJAORXGV-SQVYLTPJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K81465091	BRD-K81465091-001-01-0	Broad Institute of MIT and Harvard	BRD-K81465091			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22-,23+,28-/m1/s1	BJJOMMAJAORXGV-SQVYLTPJSA-N	595.329121628							110893
BRD-K84741596	LSM-22338		54614912	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23-,29+/m0/s1	AGSKCAQZMPMVIM-FSDPBTBWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K84741596	BRD-K84741596-001-01-1	Broad Institute of MIT and Harvard	BRD-K84741596			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23-,29+/m0/s1	AGSKCAQZMPMVIM-FSDPBTBWSA-N	572.33739878							110894
BRD-K88679751	LSM-22339		44486378	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24+,25+,32-/m1/s1	HBVPERRGRWZCML-FLWJLJKUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	BroadT	BRD-K88679751	BRD-K88679751-001-01-0	Broad Institute of MIT and Harvard	BRD-K88679751			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24+,25+,32-/m1/s1	HBVPERRGRWZCML-FLWJLJKUSA-N	590.346820612							110895
BRD-K97763545	LSM-22340		44488759	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25-,26+,33-/m0/s1	UBYZDEGPUXBRQE-UWWLJTJFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K97763545	BRD-K97763545-001-01-2	Broad Institute of MIT and Harvard	BRD-K97763545			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25-,26+,33-/m0/s1	UBYZDEGPUXBRQE-UWWLJTJFSA-N	604.362470676							110896
BRD-K84386253	LSM-22341		44620016	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28-/m0/s1	MPJVZFHLUPPQBG-QBMQIYCRSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K84386253	BRD-K84386253-001-01-9	Broad Institute of MIT and Harvard	BRD-K84386253			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28-/m0/s1	MPJVZFHLUPPQBG-QBMQIYCRSA-N	577.282171436							110897
BRD-K99901517	LSM-22342		54614965	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24+,30-/m1/s1	XIVCQDXGZVVHDO-HTWFIQDWSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K99901517	BRD-K99901517-001-01-0	Broad Institute of MIT and Harvard	BRD-K99901517			COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(NS(C)(=O)=O)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24+,30-/m1/s1	XIVCQDXGZVVHDO-HTWFIQDWSA-N	605.313471564							110898
BRD-K90497082	LSM-22343		44501082	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24+,29-/m0/s1	PRCUBQSECBZBSK-SEAFADMZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K90497082	BRD-K90497082-001-01-3	Broad Institute of MIT and Harvard	BRD-K90497082			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24+,29-/m0/s1	PRCUBQSECBZBSK-SEAFADMZSA-N	575.30290688							110899
BRD-K79303560	LSM-22344		54614969	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21-,27+/m1/s1	QNMRQELCDYNENZ-CVWKGPCHSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K79303560	BRD-K79303560-001-01-9	Broad Institute of MIT and Harvard	BRD-K79303560			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21-,27+/m1/s1	QNMRQELCDYNENZ-CVWKGPCHSA-N	544.306098652							110900
MLS003128866	LSM-13401	BRD-K81461172, SID99359309	44487458	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25-,30+/m0/s1	OPCOPDBCCFUTHV-YDXRHMNESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K81461172	BRD-K81461172-001-01-1	Broad Institute of MIT and Harvard	BRD-K81461172			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25-,30+/m0/s1	OPCOPDBCCFUTHV-YDXRHMNESA-N	525.356657014							102041
BRD-K97595801	LSM-22345		54614958	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22+,23-,30-/m0/s1	SIEZSLVXLUPDNY-GOXVIRKJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K97595801	BRD-K97595801-001-01-7	Broad Institute of MIT and Harvard	BRD-K97595801			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22+,23-,30-/m0/s1	SIEZSLVXLUPDNY-GOXVIRKJSA-N	598.336649852							110901
BRD-K99564685	LSM-22346		54614963	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26+,27-,32+/m1/s1	ZMTJRORPEDZKCY-NIWNGRQCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K99564685	BRD-K99564685-001-01-2	Broad Institute of MIT and Harvard	BRD-K99564685			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26+,27-,32+/m1/s1	ZMTJRORPEDZKCY-NIWNGRQCSA-N	624.388685424							110902
BRD-K80306055	LSM-22347		44620422	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20-,24-/m1/s1	ZPGALQDMRVAORJ-ZBNTXBBCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K80306055	BRD-K80306055-001-01-1	Broad Institute of MIT and Harvard	BRD-K80306055			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20-,24-/m1/s1	ZPGALQDMRVAORJ-ZBNTXBBCSA-N	609.269556004							110903
BRD-K87159315	LSM-22348		44486413	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20-,24-/m1/s1	LBVOXJOHMPITGR-ZBNTXBBCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K87159315	BRD-K87159315-001-01-3	Broad Institute of MIT and Harvard	BRD-K87159315			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20-,24-/m1/s1	LBVOXJOHMPITGR-ZBNTXBBCSA-N	609.269556004							110904
BRD-K87595216	LSM-22349		44494090	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29-/m0/s1	KAHNNCGHTWSOBA-MVPDCNEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K87595216	BRD-K87595216-001-01-8	Broad Institute of MIT and Harvard	BRD-K87595216			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29-/m0/s1	KAHNNCGHTWSOBA-MVPDCNEZSA-N	554.346820612							110905
BRD-K85307083	LSM-22350		54614915	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18-,19-,25+/m0/s1	OIOMLIQJBPNRTR-WSZYKNRRSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K85307083	BRD-K85307083-001-01-0	Broad Institute of MIT and Harvard	BRD-K85307083			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18-,19-,25+/m0/s1	OIOMLIQJBPNRTR-WSZYKNRRSA-N	545.321334146							110906
BRD-K87412446	LSM-22351		44496011	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23-,24-,28-/m1/s1	FCDOAUZTELHSSL-CBUXHAPBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K87412446	BRD-K87412446-001-01-8	Broad Institute of MIT and Harvard	BRD-K87412446			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23-,24-,28-/m1/s1	FCDOAUZTELHSSL-CBUXHAPBSA-N	548.393770804							110907
BRD-K95455263	LSM-22352		44620409	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27+,28+,34-/m1/s1	NYAGJJIVOVZRJD-SLCANDRHSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K95455263	BRD-K95455263-001-01-7	Broad Institute of MIT and Harvard	BRD-K95455263			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27+,28+,34-/m1/s1	NYAGJJIVOVZRJD-SLCANDRHSA-N	616.362470676							110908
BRD-K93396907	LSM-22353		44494418	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24+,29-/m0/s1	ZQLCRBSTGDSWQO-SEAFADMZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K93396907	BRD-K93396907-001-01-7	Broad Institute of MIT and Harvard	BRD-K93396907			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24+,29-/m0/s1	ZQLCRBSTGDSWQO-SEAFADMZSA-N	526.351905992							110909
BRD-K85055578	LSM-22354		44619898	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23+,24+,30-/m1/s1	JGZXBABAHUXSMS-DLWGQWRRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K85055578	BRD-K85055578-001-01-7	Broad Institute of MIT and Harvard	BRD-K85055578			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23+,24+,30-/m1/s1	JGZXBABAHUXSMS-DLWGQWRRSA-N	569.346486254							110910
BRD-K85398599	LSM-22355		54614916	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22+,23-,28-/m0/s1	NMRMJZSCUHLPQY-KYALDGGBSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)CC3CC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K85398599	BRD-K85398599-001-01-6	Broad Institute of MIT and Harvard	BRD-K85398599			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)CC3CC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22+,23-,28-/m0/s1	NMRMJZSCUHLPQY-KYALDGGBSA-N	546.37812074							110911
BRD-K80736363	LSM-22356		44489869	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20-,24+/m1/s1	LBVOXJOHMPITGR-ZSTWQFLISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K80736363	BRD-K80736363-001-01-6	Broad Institute of MIT and Harvard	BRD-K80736363			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20-,24+/m1/s1	LBVOXJOHMPITGR-ZSTWQFLISA-N	609.269556004							110912
BRD-K92172862	LSM-22357		44494094	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29-/m0/s1	GPFIDTWNGXWRJK-MVPDCNEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K92172862	BRD-K92172862-001-01-6	Broad Institute of MIT and Harvard	BRD-K92172862			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29-/m0/s1	GPFIDTWNGXWRJK-MVPDCNEZSA-N	575.30290688							110913
BRD-K80819226	LSM-22358		54614973	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23-,28+/m0/s1	BJJOMMAJAORXGV-WYNJNVBPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K80819226	BRD-K80819226-001-01-7	Broad Institute of MIT and Harvard	BRD-K80819226			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23-,28+/m0/s1	BJJOMMAJAORXGV-WYNJNVBPSA-N	595.329121628							110914
BRD-K83370434	LSM-22359		44617984	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24-,30-/m0/s1	JGZXBABAHUXSMS-CQUCHYGKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K83370434	BRD-K83370434-001-01-6	Broad Institute of MIT and Harvard	BRD-K83370434			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24-,30-/m0/s1	JGZXBABAHUXSMS-CQUCHYGKSA-N	569.346486254							110915
BRD-K95672449	LSM-22360		44492124	InChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16+,17-,21+/m0/s1	XRGBJGDCXQTJDT-GRXQJBFDSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(N)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K95672449	BRD-K95672449-001-01-4	Broad Institute of MIT and Harvard	BRD-K95672449			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(N)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16+,17-,21+/m0/s1	XRGBJGDCXQTJDT-GRXQJBFDSA-N	407.278406694							110916
BRD-K82754613	LSM-22361		54614977	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27-/m1/s1	OPIQAKQROYPQNZ-NUFXCCFXSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K82754613	BRD-K82754613-001-01-5	Broad Institute of MIT and Harvard	BRD-K82754613			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27-/m1/s1	OPIQAKQROYPQNZ-NUFXCCFXSA-N	565.26218492							110917
BRD-K97638135	LSM-22362		54614959	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28-,33-/m0/s1	XXBVUIDNUVBELT-JIOPRJIZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K97638135	BRD-K97638135-001-01-2	Broad Institute of MIT and Harvard	BRD-K97638135			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28-,33-/m0/s1	XXBVUIDNUVBELT-JIOPRJIZSA-N	616.45637106							110918
BRD-K88281646	LSM-22363		44620095	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29+/m1/s1	LZRQCLPDICKWHD-NBOGMJGSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K88281646	BRD-K88281646-001-01-4	Broad Institute of MIT and Harvard	BRD-K88281646			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29+/m1/s1	LZRQCLPDICKWHD-NBOGMJGSSA-N	609.263934558							110919
BRD-K82814367	LSM-22364		44497753	InChI=1S/C31H46ClN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23+,24-,30-/m1/s1	XCNKIYRWXFRDDY-UTSVKBTJSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K82814367	BRD-K82814367-001-01-5	Broad Institute of MIT and Harvard	BRD-K82814367			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C31H46ClN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23+,24-,30-/m1/s1	XCNKIYRWXFRDDY-UTSVKBTJSA-N	623.279584622							110920
BRD-K98522669	LSM-22365		44485808	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28-/m1/s1	OWRRZEUGKXIWTQ-TZTMDHJLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K98522669	BRD-K98522669-001-01-1	Broad Institute of MIT and Harvard	BRD-K98522669			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23-,28-/m1/s1	OWRRZEUGKXIWTQ-TZTMDHJLSA-N	540.331170548							110921
BRD-K99903568	LSM-22366		44501096	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23+,24+,30-/m0/s1	JGZXBABAHUXSMS-YTNVWYNJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K99903568	BRD-K99903568-001-01-4	Broad Institute of MIT and Harvard	BRD-K99903568			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23+,24+,30-/m0/s1	JGZXBABAHUXSMS-YTNVWYNJSA-N	569.346486254							110922
BRD-K94921631	LSM-22367		54614947	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26-,27+,32+/m0/s1	ZMTJRORPEDZKCY-QAZWXMQQSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K94921631	BRD-K94921631-001-01-4	Broad Institute of MIT and Harvard	BRD-K94921631			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26-,27+,32+/m0/s1	ZMTJRORPEDZKCY-QAZWXMQQSA-N	624.388685424							110923
BRD-K86237035	LSM-22368		44494917	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20+,24-/m0/s1	PQNWFIFCFFWMJI-SMOZNVCYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K86237035	BRD-K86237035-001-01-7	Broad Institute of MIT and Harvard	BRD-K86237035			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20+,24-/m0/s1	PQNWFIFCFFWMJI-SMOZNVCYSA-N	449.325356886							110924
BRD-K96320811	LSM-22369		44494444	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23-/m0/s1	AHFPIWRBAUHSCU-LVBDUCALSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K96320811	BRD-K96320811-001-01-9	Broad Institute of MIT and Harvard	BRD-K96320811			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23-/m0/s1	AHFPIWRBAUHSCU-LVBDUCALSA-N	435.309706822							110925
BRD-K96106084	LSM-22370		44486430	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22-,23-,27-/m1/s1	LTGDTYHJVMKPBL-DVAKJLRASA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K96106084	BRD-K96106084-001-01-2	Broad Institute of MIT and Harvard	BRD-K96106084			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22-,23-,27-/m1/s1	LTGDTYHJVMKPBL-DVAKJLRASA-N	534.37812074							110926
BRD-K80766355	LSM-22371		44493120	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19-,23-/m0/s1	AHFPIWRBAUHSCU-KGYLXKDPSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K80766355	BRD-K80766355-001-01-3	Broad Institute of MIT and Harvard	BRD-K80766355			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19-,23-/m0/s1	AHFPIWRBAUHSCU-KGYLXKDPSA-N	435.309706822							110927
BRD-K87647164	LSM-22372		54614927	InChI=1S/C28H48N4O5/c1-20-18-32(21(2)19-33)28(35)24-16-23(30-27(34)11-9-14-31(5)6)12-13-25(24)37-22(3)10-7-8-15-36-26(20)17-29-4/h12-13,16,20-22,26,29,33H,7-11,14-15,17-19H2,1-6H3,(H,30,34)/t20-,21-,22-,26+/m1/s1	SBFFLWUBRLNFSF-BILGYAHESA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K87647164	BRD-K87647164-001-01-9	Broad Institute of MIT and Harvard	BRD-K87647164			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H48N4O5/c1-20-18-32(21(2)19-33)28(35)24-16-23(30-27(34)11-9-14-31(5)6)12-13-25(24)37-22(3)10-7-8-15-36-26(20)17-29-4/h12-13,16,20-22,26,29,33H,7-11,14-15,17-19H2,1-6H3,(H,30,34)/t20-,21-,22-,26+/m1/s1	SBFFLWUBRLNFSF-BILGYAHESA-N	520.362470676							110928
BRD-K78676275	LSM-22373		44495018	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25+,30+/m1/s1	OMPYFAIFRLVIFJ-DUXAABNJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K78676275	BRD-K78676275-001-01-5	Broad Institute of MIT and Harvard	BRD-K78676275			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25+,30+/m1/s1	OMPYFAIFRLVIFJ-DUXAABNJSA-N	621.338956202							110929
BRD-K81939454	LSM-22374		44490355	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21+,22-,27+/m0/s1	JLURSCHFCUHCJF-JLFWUPFSSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K81939454	BRD-K81939454-001-01-5	Broad Institute of MIT and Harvard	BRD-K81939454			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21+,22-,27+/m0/s1	JLURSCHFCUHCJF-JLFWUPFSSA-N	547.271606752							110930
MLS003130364	LSM-6158	BRD-K82524003, SID121282606	44485039	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24+,25+,31-/m0/s1	ZZWVGKUDLRNMBI-UMDYSXRGSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K82524003	BRD-K82524003-001-01-0	Broad Institute of MIT and Harvard	BRD-K82524003			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24+,25+,31-/m0/s1	ZZWVGKUDLRNMBI-UMDYSXRGSA-N	619.329121628							94939
BRD-K86025005	LSM-22375		54614920	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22+,27+/m0/s1	AOLQWFIMADKXQA-HCUOBIAZSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K86025005	BRD-K86025005-001-01-2	Broad Institute of MIT and Harvard	BRD-K86025005			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22+,27+/m0/s1	AOLQWFIMADKXQA-HCUOBIAZSA-N	511.304621442							110931
BRD-K88658905	LSM-22376		44495974	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23-,28-/m0/s1	GAZXHMFIMHCKKU-KYALDGGBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K88658905	BRD-K88658905-001-01-9	Broad Institute of MIT and Harvard	BRD-K88658905			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23-,28-/m0/s1	GAZXHMFIMHCKKU-KYALDGGBSA-N	576.298155858							110932
BRD-K85627183	LSM-22377		44617307	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27+/m1/s1	WPSSTONNMATWEF-RBZJZWSTSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K85627183	BRD-K85627183-001-01-0	Broad Institute of MIT and Harvard	BRD-K85627183			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27+/m1/s1	WPSSTONNMATWEF-RBZJZWSTSA-N	581.23263443							110933
BRD-K84975143	LSM-22378		54614914	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19+,23-/m1/s1	QBUCHBBMZJBUJI-GKAYAJSDSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K84975143	BRD-K84975143-001-01-3	Broad Institute of MIT and Harvard	BRD-K84975143			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19+,23-/m1/s1	QBUCHBBMZJBUJI-GKAYAJSDSA-N	531.29200601							110934
BRD-K93663012	LSM-22379		44620843	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,27+/m1/s1	QNMRQELCDYNENZ-RBZJZWSTSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K93663012	BRD-K93663012-001-01-2	Broad Institute of MIT and Harvard	BRD-K93663012			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,27+/m1/s1	QNMRQELCDYNENZ-RBZJZWSTSA-N	544.306098652							110935
BRD-K92570288	LSM-22380		54614939	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23+,24+,30-/m1/s1	OKIGVZMNGZVCJM-DLWGQWRRSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)N(C)C	BroadT	BRD-K92570288	BRD-K92570288-001-01-7	Broad Institute of MIT and Harvard	BRD-K92570288			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23+,24+,30-/m1/s1	OKIGVZMNGZVCJM-DLWGQWRRSA-N	605.313471564							110936
BRD-K86228587	LSM-22381		44489701	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28+/m0/s1	OWRRZEUGKXIWTQ-TUEWKVEFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K86228587	BRD-K86228587-001-01-8	Broad Institute of MIT and Harvard	BRD-K86228587			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28+/m0/s1	OWRRZEUGKXIWTQ-TUEWKVEFSA-N	540.331170548							110937
BRD-K83544408	LSM-22382		44493587	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24-,29-/m0/s1	OJAAEAMCTGSNOQ-MVPDCNEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K83544408	BRD-K83544408-001-01-8	Broad Institute of MIT and Harvard	BRD-K83544408			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24-,29-/m0/s1	OJAAEAMCTGSNOQ-MVPDCNEZSA-N	575.30290688							110938
BRD-K87479423	LSM-22383		44619525	InChI=1S/C26H45N3O6S/c1-7-13-28(5)17-25-19(2)16-29(20(3)18-30)26(31)23-15-22(27-36(6,32)33)11-12-24(23)35-21(4)10-8-9-14-34-25/h11-12,15,19-21,25,27,30H,7-10,13-14,16-18H2,1-6H3/t19-,20-,21+,25-/m1/s1	ZOEMVRGQCOXOOR-NAZDKBRTSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K87479423	BRD-K87479423-001-01-4	Broad Institute of MIT and Harvard	BRD-K87479423			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C26H45N3O6S/c1-7-13-28(5)17-25-19(2)16-29(20(3)18-30)26(31)23-15-22(27-36(6,32)33)11-12-24(23)35-21(4)10-8-9-14-34-25/h11-12,15,19-21,25,27,30H,7-10,13-14,16-18H2,1-6H3/t19-,20-,21+,25-/m1/s1	ZOEMVRGQCOXOOR-NAZDKBRTSA-N	527.30290688							110939
BRD-K82658511	LSM-22384		54614976	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29+/m0/s1	IMDGVULVCKQBDZ-HNFJUSDZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K82658511	BRD-K82658511-001-01-1	Broad Institute of MIT and Harvard	BRD-K82658511			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29+/m0/s1	IMDGVULVCKQBDZ-HNFJUSDZSA-N	539.33592157							110940
BRD-K83209781	LSM-22385		54614909	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23+,24-,30-/m1/s1	IYJPIDGCXVWPNR-UTSVKBTJSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)N(C)C)cc1	BroadT	BRD-K83209781	BRD-K83209781-001-01-5	Broad Institute of MIT and Harvard	BRD-K83209781			COc1ccc(NC(=O)N(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)N(C)C)cc1	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23+,24-,30-/m1/s1	IYJPIDGCXVWPNR-UTSVKBTJSA-N	584.357385296							110941
BRD-K83782929	LSM-22386		44496869	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22-,23-,27-/m0/s1	MTZUJVYQNWSRMQ-FAWUNYRSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K83782929	BRD-K83782929-001-01-4	Broad Institute of MIT and Harvard	BRD-K83782929			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22-,23-,27-/m0/s1	MTZUJVYQNWSRMQ-FAWUNYRSSA-N	598.34002067							110942
BRD-K80888333	LSM-22387		44618303	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25+,30+/m1/s1	DXYWKCBATINIRK-DUXAABNJSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K80888333	BRD-K80888333-001-01-2	Broad Institute of MIT and Harvard	BRD-K80888333			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25+,30+/m1/s1	DXYWKCBATINIRK-DUXAABNJSA-N	596.357385296							110943
BRD-K95935249	LSM-22388		54614951	InChI=1S/C29H47N5O6S/c1-7-13-32(5)17-27-21(2)16-34(22(3)19-35)29(36)25-15-24(31-41(37,38)28-18-33(6)20-30-28)11-12-26(25)40-23(4)10-8-9-14-39-27/h11-12,15,18,20-23,27,31,35H,7-10,13-14,16-17,19H2,1-6H3/t21-,22-,23+,27-/m1/s1	IKHNOPCXKIAMPI-IQXSCUCBSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K95935249	BRD-K95935249-001-01-7	Broad Institute of MIT and Harvard	BRD-K95935249			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H47N5O6S/c1-7-13-32(5)17-27-21(2)16-34(22(3)19-35)29(36)25-15-24(31-41(37,38)28-18-33(6)20-30-28)11-12-26(25)40-23(4)10-8-9-14-39-27/h11-12,15,18,20-23,27,31,35H,7-10,13-14,16-17,19H2,1-6H3/t21-,22-,23+,27-/m1/s1	IKHNOPCXKIAMPI-IQXSCUCBSA-N	593.324704964							110944
BRD-K81995936	LSM-22389		44490440	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24+,29+/m1/s1	ZJHDPNYYPDHDNF-CHCBTGSZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K81995936	BRD-K81995936-001-01-5	Broad Institute of MIT and Harvard	BRD-K81995936			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24+,29+/m1/s1	ZJHDPNYYPDHDNF-CHCBTGSZSA-N	539.33592157							110945
BRD-K90970920	LSM-6165		44487024	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24+,25-,31-/m1/s1	ZZWVGKUDLRNMBI-XDAUYTPDSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K90970920	BRD-K90970920-001-01-5	Broad Institute of MIT and Harvard	BRD-K90970920			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H49N3O7S/c1-7-17-34(5)21-31-23(2)20-35(24(3)22-36)32(37)29-19-26(11-16-30(29)42-25(4)10-8-9-18-41-31)33-43(38,39)28-14-12-27(40-6)13-15-28/h11-16,19,23-25,31,33,36H,7-10,17-18,20-22H2,1-6H3/t23-,24+,25-,31-/m1/s1	ZZWVGKUDLRNMBI-XDAUYTPDSA-N	619.329121628							94946
BRD-K88292241	LSM-22390		44620553	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29-/m1/s1	XPIAMQJKSFNCJS-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K88292241	BRD-K88292241-001-01-0	Broad Institute of MIT and Harvard	BRD-K88292241			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29-/m1/s1	XPIAMQJKSFNCJS-CDLOMYRSSA-N	603.2978215							110946
BRD-K92879007	LSM-22391		54614940	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24-,29-/m0/s1	PRCUBQSECBZBSK-UITIVDIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K92879007	BRD-K92879007-001-01-2	Broad Institute of MIT and Harvard	BRD-K92879007			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24-,29-/m0/s1	PRCUBQSECBZBSK-UITIVDIESA-N	575.30290688							110947
BRD-K84387578	LSM-22392		54614911	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32+/m1/s1	IDICBOGPMQOFGC-IXTDCBFRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K84387578	BRD-K84387578-001-01-5	Broad Institute of MIT and Harvard	BRD-K84387578			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32+/m1/s1	IDICBOGPMQOFGC-IXTDCBFRSA-N	616.326085168							110948
BRD-K99220724	LSM-22393		54614961	InChI=1S/C31H46N4O5/c1-6-16-34(5)20-29-22(2)19-35(23(3)21-36)31(38)27-18-26(33-30(37)25-12-14-32-15-13-25)10-11-28(27)40-24(4)9-7-8-17-39-29/h10-15,18,22-24,29,36H,6-9,16-17,19-21H2,1-5H3,(H,33,37)/t22-,23+,24-,29-/m1/s1	UGZNIWWZAWAINA-CDLOMYRSSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K99220724	BRD-K99220724-001-01-4	Broad Institute of MIT and Harvard	BRD-K99220724			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C31H46N4O5/c1-6-16-34(5)20-29-22(2)19-35(23(3)21-36)31(38)27-18-26(33-30(37)25-12-14-32-15-13-25)10-11-28(27)40-24(4)9-7-8-17-39-29/h10-15,18,22-24,29,36H,6-9,16-17,19-21H2,1-5H3,(H,33,37)/t22-,23+,24-,29-/m1/s1	UGZNIWWZAWAINA-CDLOMYRSSA-N	554.346820612							110949
BRD-K98496939	LSM-22394		44619018	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28-/m0/s1	DKJIIKWCTXJSNY-KYALDGGBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K98496939	BRD-K98496939-001-01-2	Broad Institute of MIT and Harvard	BRD-K98496939			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28-/m0/s1	DKJIIKWCTXJSNY-KYALDGGBSA-N	561.287256816							110950
BRD-K98225007	LSM-22395		44618153	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32-/m1/s1	OQPYQZIBKYAWRE-UOJGMACNSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K98225007	BRD-K98225007-001-01-2	Broad Institute of MIT and Harvard	BRD-K98225007			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32-/m1/s1	OQPYQZIBKYAWRE-UOJGMACNSA-N	622.37303536							110951
BRD-K89174739	LSM-22396		44483828	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26+,33-/m0/s1	UBYZDEGPUXBRQE-DSTDORTESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K89174739	BRD-K89174739-001-01-8	Broad Institute of MIT and Harvard	BRD-K89174739			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26+,33-/m0/s1	UBYZDEGPUXBRQE-DSTDORTESA-N	604.362470676							110952
BRD-K80009401	LSM-22397		44495026	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23+/m1/s1	AHFPIWRBAUHSCU-XQQXVUDOSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K80009401	BRD-K80009401-001-01-2	Broad Institute of MIT and Harvard	BRD-K80009401			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23+/m1/s1	AHFPIWRBAUHSCU-XQQXVUDOSA-N	435.309706822							110953
BRD-K90231936	LSM-22398		44487491	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19-,23+/m0/s1	HNAHSZOZZNPVNF-QPXQOZNCSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K90231936	BRD-K90231936-001-01-4	Broad Institute of MIT and Harvard	BRD-K90231936			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19-,23+/m0/s1	HNAHSZOZZNPVNF-QPXQOZNCSA-N	499.271606752							110954
BRD-K78755361	LSM-22399		54614968	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19-,23+/m0/s1	QBUCHBBMZJBUJI-KEXUJGGDSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K78755361	BRD-K78755361-001-01-2	Broad Institute of MIT and Harvard	BRD-K78755361			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19-,23+/m0/s1	QBUCHBBMZJBUJI-KEXUJGGDSA-N	531.29200601							110955
BRD-K82883803	LSM-22400		44489327	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27-/m0/s1	HNFJEPMYRFFBAZ-RJESQKRESA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K82883803	BRD-K82883803-001-01-2	Broad Institute of MIT and Harvard	BRD-K82883803			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27-/m0/s1	HNFJEPMYRFFBAZ-RJESQKRESA-N	526.315520484							110956
BRD-K93615384	LSM-22401		44493115	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22-,27-/m0/s1	JMPHEZKYQLUQMM-LFYAFONDSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K93615384	BRD-K93615384-001-01-2	Broad Institute of MIT and Harvard	BRD-K93615384			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22-,27-/m0/s1	JMPHEZKYQLUQMM-LFYAFONDSA-N	517.351571634							110957
BRD-K98935620	LSM-22402		44498664	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27+/m1/s1	AOLQWFIMADKXQA-RYBWSMFQSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K98935620	BRD-K98935620-001-01-3	Broad Institute of MIT and Harvard	BRD-K98935620			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27+/m1/s1	AOLQWFIMADKXQA-RYBWSMFQSA-N	511.304621442							110958
BRD-K98016463	LSM-22403		44498238	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22+,23-,29+/m1/s1	PSEUFYCSFOBFBF-MBWUYLOXSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K98016463	BRD-K98016463-001-01-2	Broad Institute of MIT and Harvard	BRD-K98016463			COc1ccc(NC(=O)Nc2ccc3O[C@H](C)CCCCO[C@@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22+,23-,29+/m1/s1	PSEUFYCSFOBFBF-MBWUYLOXSA-N	570.341735232							110959
BRD-K83010768	LSM-22404		44617129	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24-,29-/m1/s1	PRCUBQSECBZBSK-RWJVBYDYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K83010768	BRD-K83010768-001-01-4	Broad Institute of MIT and Harvard	BRD-K83010768			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24-,29-/m1/s1	PRCUBQSECBZBSK-RWJVBYDYSA-N	575.30290688							110960
BRD-K90127029	LSM-22405		44617086	InChI=1S/C31H46ClN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23+,24+,30-/m0/s1	XCNKIYRWXFRDDY-YTNVWYNJSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K90127029	BRD-K90127029-001-01-2	Broad Institute of MIT and Harvard	BRD-K90127029			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H46ClN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23+,24+,30-/m0/s1	XCNKIYRWXFRDDY-YTNVWYNJSA-N	623.279584622							110961
BRD-K85741537	LSM-22406		44496438	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18+,19-,25-/m0/s1	OIOMLIQJBPNRTR-XMNZWCOLSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K85741537	BRD-K85741537-001-01-2	Broad Institute of MIT and Harvard	BRD-K85741537			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18+,19-,25-/m0/s1	OIOMLIQJBPNRTR-XMNZWCOLSA-N	545.321334146							110962
BRD-K89724519	LSM-22407		44618198	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20-,21+,27+/m1/s1	JTLOVMZMVDHICP-MEFYPOPPSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K89724519	BRD-K89724519-001-01-6	Broad Institute of MIT and Harvard	BRD-K89724519			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20-,21+,27+/m1/s1	JTLOVMZMVDHICP-MEFYPOPPSA-N	594.302905052							110963
BRD-K92904754	LSM-22408		54614941	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27+/m0/s1	WPSSTONNMATWEF-ZZWZOVRCSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K92904754	BRD-K92904754-001-01-3	Broad Institute of MIT and Harvard	BRD-K92904754			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27+/m0/s1	WPSSTONNMATWEF-ZZWZOVRCSA-N	581.23263443							110964
BRD-K96280720	LSM-22409		44485794	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20-,21-,27-/m1/s1	AQPDNHSQVUKPGE-NUFXCCFXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K96280720	BRD-K96280720-001-01-5	Broad Institute of MIT and Harvard	BRD-K96280720			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20-,21-,27-/m1/s1	AQPDNHSQVUKPGE-NUFXCCFXSA-N	573.352634274							110965
BRD-K86600397	LSM-22410		44501134	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30-/m0/s1	RSKGZFLSRBPJST-RPQPUBLWSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K86600397	BRD-K86600397-001-01-8	Broad Institute of MIT and Harvard	BRD-K86600397			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30-/m0/s1	RSKGZFLSRBPJST-RPQPUBLWSA-N	617.41523453							110966
BRD-K91282650	LSM-22411		44619759	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24+,25-,30-/m0/s1	HYZLHQOJAWWHRH-SODQHWRNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K91282650	BRD-K91282650-001-01-0	Broad Institute of MIT and Harvard	BRD-K91282650			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24+,25-,30-/m0/s1	HYZLHQOJAWWHRH-SODQHWRNSA-N	589.318556944							110967
BRD-K82562625	LSM-22412		44494978	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22-,23+,28+/m0/s1	SCSZUZCJLHTTSJ-HIAVRWOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K82562625	BRD-K82562625-001-01-8	Broad Institute of MIT and Harvard	BRD-K82562625			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22-,23+,28+/m0/s1	SCSZUZCJLHTTSJ-HIAVRWOZSA-N	589.282171436							110968
MLS003128718	LSM-13539	BRD-K83548510	44494388	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24+,29+/m0/s1	ZQLCRBSTGDSWQO-CMSZEEODSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K83548510	BRD-K83548510-001-01-4	Broad Institute of MIT and Harvard	BRD-K83548510			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24+,29+/m0/s1	ZQLCRBSTGDSWQO-CMSZEEODSA-N	526.351905992							102181
BRD-K95517054-001-01-7	LSM-6786	BRD7054, SD-6-035-A6	46925828	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24+,31+/m1/s1	WIYHORLWMFSPCL-JYWVQFHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K95517054	BRD-K95517054-001-01-7	Broad Institute of MIT and Harvard	BRD-K95517054			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24+,31+/m1/s1	WIYHORLWMFSPCL-JYWVQFHMSA-N	569.346486254							95407
BRD-K83775558	LSM-22413		44501992	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25+,30-/m0/s1	KOPUKDVKYXJRIR-RPQPUBLWSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K83775558	BRD-K83775558-001-01-6	Broad Institute of MIT and Harvard	BRD-K83775558			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25+,30-/m0/s1	KOPUKDVKYXJRIR-RPQPUBLWSA-N	602.404335488							110969
BRD-K96076719	LSM-22414		49842959	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25+,30+/m1/s1	ZGCRSIABJPRXFC-DUXAABNJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K96076719	BRD-K96076719-001-01-0	Broad Institute of MIT and Harvard	BRD-K96076719			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25+,30+/m1/s1	ZGCRSIABJPRXFC-DUXAABNJSA-N	553.351571634							110970
BRD-K90360779	LSM-22415		54614934	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28-/m1/s1	XEPWKRSQLBTXFU-SQVYLTPJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K90360779	BRD-K90360779-001-01-1	Broad Institute of MIT and Harvard	BRD-K90360779			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28-/m1/s1	XEPWKRSQLBTXFU-SQVYLTPJSA-N	595.329121628							110971
BRD-K99214816	LSM-22416		44490398	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23-,28+/m1/s1	GAZXHMFIMHCKKU-KRHPZPPWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K99214816	BRD-K99214816-001-01-6	Broad Institute of MIT and Harvard	BRD-K99214816			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23-,28+/m1/s1	GAZXHMFIMHCKKU-KRHPZPPWSA-N	576.298155858							110972
BRD-K85803608	LSM-22417		54614918	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23-,29-/m0/s1	QSYAMXVABCSWEP-OJNHJINQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K85803608	BRD-K85803608-001-01-4	Broad Institute of MIT and Harvard	BRD-K85803608			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23-,29-/m0/s1	QSYAMXVABCSWEP-OJNHJINQSA-N	622.33420518							110973
BRD-K85456600	LSM-22418		44489711	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,28+/m0/s1	BRKIAEBRDYHMFE-TUEWKVEFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K85456600	BRD-K85456600-001-01-9	Broad Institute of MIT and Harvard	BRD-K85456600			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,28+/m0/s1	BRKIAEBRDYHMFE-TUEWKVEFSA-N	540.331170548							110974
CHEMBL3187960	LSM-22419	BRD-K85162983	44619886	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24+,29-/m0/s1	PRCUBQSECBZBSK-OODISRMCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K85162983	BRD-K85162983-001-01-0	Broad Institute of MIT and Harvard	BRD-K85162983			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24+,29-/m0/s1	PRCUBQSECBZBSK-OODISRMCSA-N	575.30290688							110975
BRD-K92359570	LSM-22420		44617824	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23-,30+/m1/s1	SIEZSLVXLUPDNY-BCSOFFBWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K92359570	BRD-K92359570-001-01-2	Broad Institute of MIT and Harvard	BRD-K92359570			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23-,30+/m1/s1	SIEZSLVXLUPDNY-BCSOFFBWSA-N	598.336649852							110976
BRD-K85200795	LSM-22421		44504045	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20+,24-/m0/s1	ZPGALQDMRVAORJ-SMOZNVCYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K85200795	BRD-K85200795-001-01-6	Broad Institute of MIT and Harvard	BRD-K85200795			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20+,24-/m0/s1	ZPGALQDMRVAORJ-SMOZNVCYSA-N	609.269556004							110977
BRD-K93260425	LSM-22422		54614942	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22+,23+,30-/m1/s1	SIEZSLVXLUPDNY-VVOVZLFDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K93260425	BRD-K93260425-001-01-8	Broad Institute of MIT and Harvard	BRD-K93260425			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22+,23+,30-/m1/s1	SIEZSLVXLUPDNY-VVOVZLFDSA-N	598.336649852							110978
BRD-K94353570	LSM-22423		44492623	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24+,29-/m0/s1	KAHNNCGHTWSOBA-OODISRMCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K94353570	BRD-K94353570-001-01-3	Broad Institute of MIT and Harvard	BRD-K94353570			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24+,29-/m0/s1	KAHNNCGHTWSOBA-OODISRMCSA-N	554.346820612							110979
BRD-K86855109	LSM-22424		44495510	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20+,24+/m1/s1	PQNWFIFCFFWMJI-XUJKJYMVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K86855109	BRD-K86855109-001-01-7	Broad Institute of MIT and Harvard	BRD-K86855109			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20+,24+/m1/s1	PQNWFIFCFFWMJI-XUJKJYMVSA-N	449.325356886							110980
BRD-K88485670	LSM-22425		54614930	InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24+,25-,30-/m1/s1	DPWBPPWCHVQSHF-FJRSXGRASA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K88485670	BRD-K88485670-001-01-0	Broad Institute of MIT and Harvard	BRD-K88485670			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24+,25-,30-/m1/s1	DPWBPPWCHVQSHF-FJRSXGRASA-N	553.351571634							110981
MLS003128764	LSM-13697	SID99359124, BRD-K86043715	44502461	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25+,30+/m0/s1	ZGCRSIABJPRXFC-RZDWVWPCSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K86043715	BRD-K86043715-001-01-6	Broad Institute of MIT and Harvard	BRD-K86043715			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25+,30+/m0/s1	ZGCRSIABJPRXFC-RZDWVWPCSA-N	553.351571634							102345
BRD-K80643530	LSM-22426		49843332	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22+,27+/m1/s1	HLGABPGRBQKPOU-HLIRBWCUSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K80643530	BRD-K80643530-001-01-2	Broad Institute of MIT and Harvard	BRD-K80643530			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22+,27+/m1/s1	HLGABPGRBQKPOU-HLIRBWCUSA-N	532.362470676							110982
BRD-K85901675	LSM-22427		44501842	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20+,21+,27-/m0/s1	JTLOVMZMVDHICP-XTYKIWRDSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K85901675	BRD-K85901675-001-01-4	Broad Institute of MIT and Harvard	BRD-K85901675			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20+,21+,27-/m0/s1	JTLOVMZMVDHICP-XTYKIWRDSA-N	594.302905052							110983
BRD-K89632963	LSM-22428		44491488	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21-,22-,27+/m0/s1	JLURSCHFCUHCJF-GHIUXRNCSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K89632963	BRD-K89632963-001-01-2	Broad Institute of MIT and Harvard	BRD-K89632963			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21-,22-,27+/m0/s1	JLURSCHFCUHCJF-GHIUXRNCSA-N	547.271606752							110984
BRD-K80763723	LSM-22429		44488178	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22+,28-/m1/s1	DYIGNVBEUCFAEB-DCRAHPAHSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K80763723	BRD-K80763723-001-01-5	Broad Institute of MIT and Harvard	BRD-K80763723			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22+,28-/m1/s1	DYIGNVBEUCFAEB-DCRAHPAHSA-N	558.321748716							110985
BRD-K97938674	LSM-22430		44617465	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22-,23-,28+/m1/s1	NMRMJZSCUHLPQY-IZXSZHORSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)CC3CC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K97938674	BRD-K97938674-001-01-3	Broad Institute of MIT and Harvard	BRD-K97938674			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)CC3CC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22-,23-,28+/m1/s1	NMRMJZSCUHLPQY-IZXSZHORSA-N	546.37812074							110986
BRD-K83300227	LSM-22431		44490347	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24-,29+/m0/s1	QUSLWNNTNFDPAB-HNFJUSDZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K83300227	BRD-K83300227-001-01-4	Broad Institute of MIT and Harvard	BRD-K83300227			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24-,29+/m0/s1	QUSLWNNTNFDPAB-HNFJUSDZSA-N	545.382871762							110987
BRD-K91696235	LSM-22432		44501055	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23+,27+/m0/s1	XJLXIOLTLBOFKC-IILZIBOQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K91696235	BRD-K91696235-001-01-5	Broad Institute of MIT and Harvard	BRD-K91696235			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23+,27+/m0/s1	XJLXIOLTLBOFKC-IILZIBOQSA-N	598.34002067							110988
BRD-K90103008	LSM-22433		44494445	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23+,24+,31-/m0/s1	DSXVWRRZDLHRDJ-WLCCTRHUSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K90103008	BRD-K90103008-001-01-8	Broad Institute of MIT and Harvard	BRD-K90103008			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23+,24+,31-/m0/s1	DSXVWRRZDLHRDJ-WLCCTRHUSA-N	576.331170548							110989
BRD-K92644013	LSM-22434		44619542	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25-,30+/m0/s1	ZGCRSIABJPRXFC-DNHJLFCISA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K92644013	BRD-K92644013-001-01-2	Broad Institute of MIT and Harvard	BRD-K92644013			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25-,30+/m0/s1	ZGCRSIABJPRXFC-DNHJLFCISA-N	553.351571634							110990
BRD-K97242998	LSM-22435		44483981	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20-,21-,27+/m1/s1	AQPDNHSQVUKPGE-CVWKGPCHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K97242998	BRD-K97242998-001-01-9	Broad Institute of MIT and Harvard	BRD-K97242998			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20-,21-,27+/m1/s1	AQPDNHSQVUKPGE-CVWKGPCHSA-N	573.352634274							110991
BRD-K79321447	LSM-22436		44494089	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23-,24+,29-/m0/s1	OJAAEAMCTGSNOQ-OODISRMCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K79321447	BRD-K79321447-001-01-0	Broad Institute of MIT and Harvard	BRD-K79321447			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23-,24+,29-/m0/s1	OJAAEAMCTGSNOQ-OODISRMCSA-N	575.30290688							110992
BRD-K87776049	LSM-22437		54614928	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23+,24+,29-/m1/s1	MOSVBDAIGOGSPE-CAFXQFFASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K87776049	BRD-K87776049-001-01-7	Broad Institute of MIT and Harvard	BRD-K87776049			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23+,24+,29-/m1/s1	MOSVBDAIGOGSPE-CAFXQFFASA-N	581.349857072							110993
BRD-K87107091	LSM-22438		54614926	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30-/m1/s1	KOPUKDVKYXJRIR-ZASNTINBSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K87107091	BRD-K87107091-001-01-2	Broad Institute of MIT and Harvard	BRD-K87107091			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30-/m1/s1	KOPUKDVKYXJRIR-ZASNTINBSA-N	602.404335488							110994
BRD-K85271599	LSM-22439		49850036	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28+/m1/s1	XEPWKRSQLBTXFU-FZVPRWPTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K85271599	BRD-K85271599-001-01-5	Broad Institute of MIT and Harvard	BRD-K85271599			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28+/m1/s1	XEPWKRSQLBTXFU-FZVPRWPTSA-N	595.329121628							110995
BRD-K89471250	LSM-22440		44487446	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25+,30+/m0/s1	OPCOPDBCCFUTHV-ZQIPMTRKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K89471250	BRD-K89471250-001-01-7	Broad Institute of MIT and Harvard	BRD-K89471250			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25+,30+/m0/s1	OPCOPDBCCFUTHV-ZQIPMTRKSA-N	525.356657014							110996
BRD-K87383650	LSM-22441		44617246	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25+,26+,32-/m1/s1	JCVAFPCEYZSYDX-XDMKPEOCSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K87383650	BRD-K87383650-001-01-2	Broad Institute of MIT and Harvard	BRD-K87383650			COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25+,26+,32-/m1/s1	JCVAFPCEYZSYDX-XDMKPEOCSA-N	612.388685424							110997
BRD-K87082948	LSM-22442		54614925	InChI=1S/C31H49N5O6/c1-8-14-35(7)18-28-20(2)17-36(21(3)19-37)30(38)26-16-25(32-31(39)33-29-23(5)34-42-24(29)6)12-13-27(26)41-22(4)11-9-10-15-40-28/h12-13,16,20-22,28,37H,8-11,14-15,17-19H2,1-7H3,(H2,32,33,39)/t20-,21+,22+,28-/m0/s1	WONHJTSKSOPZKP-WBJWTPEXSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K87082948	BRD-K87082948-001-01-2	Broad Institute of MIT and Harvard	BRD-K87082948			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H49N5O6/c1-8-14-35(7)18-28-20(2)17-36(21(3)19-37)30(38)26-16-25(32-31(39)33-29-23(5)34-42-24(29)6)12-13-27(26)41-22(4)11-9-10-15-40-28/h12-13,16,20-22,28,37H,8-11,14-15,17-19H2,1-7H3,(H2,32,33,39)/t20-,21+,22+,28-/m0/s1	WONHJTSKSOPZKP-WBJWTPEXSA-N	587.368284338							110998
BRD-K90673570	LSM-22443		44504571	InChI=1S/C28H48N4O5/c1-20-18-32(21(2)19-33)28(35)24-16-23(30-27(34)11-9-14-31(5)6)12-13-25(24)37-22(3)10-7-8-15-36-26(20)17-29-4/h12-13,16,20-22,26,29,33H,7-11,14-15,17-19H2,1-6H3,(H,30,34)/t20-,21+,22+,26-/m0/s1	SBFFLWUBRLNFSF-BOCITWAFSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K90673570	BRD-K90673570-001-01-8	Broad Institute of MIT and Harvard	BRD-K90673570			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H48N4O5/c1-20-18-32(21(2)19-33)28(35)24-16-23(30-27(34)11-9-14-31(5)6)12-13-25(24)37-22(3)10-7-8-15-36-26(20)17-29-4/h12-13,16,20-22,26,29,33H,7-11,14-15,17-19H2,1-6H3,(H,30,34)/t20-,21+,22+,26-/m0/s1	SBFFLWUBRLNFSF-BOCITWAFSA-N	520.362470676							110999
BRD-K82105167	LSM-22444		44504749	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21+,22+,28+/m0/s1	QZYXNEJVPTWBHC-CLYWQNBRSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K82105167	BRD-K82105167-001-01-0	Broad Institute of MIT and Harvard	BRD-K82105167			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21+,22+,28+/m0/s1	QZYXNEJVPTWBHC-CLYWQNBRSA-N	556.326085168							111000
BRD-K79855662	LSM-22445		49842961	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30+/m1/s1	RSKGZFLSRBPJST-DUXAABNJSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K79855662	BRD-K79855662-001-01-5	Broad Institute of MIT and Harvard	BRD-K79855662			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30+/m1/s1	RSKGZFLSRBPJST-DUXAABNJSA-N	617.41523453							111001
BRD-K83466873	LSM-22446		44619719	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19-,23+/m1/s1	QBUCHBBMZJBUJI-ZQAYVECASA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K83466873	BRD-K83466873-001-01-0	Broad Institute of MIT and Harvard	BRD-K83466873			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19-,23+/m1/s1	QBUCHBBMZJBUJI-ZQAYVECASA-N	531.29200601							111002
BRD-K95672029	LSM-22447		44487529	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m1/s1	VTJNXDUZLOWMHH-KRHPZPPWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K95672029	BRD-K95672029-001-01-2	Broad Institute of MIT and Harvard	BRD-K95672029			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m1/s1	VTJNXDUZLOWMHH-KRHPZPPWSA-N	531.367221698							111003
BRD-K97013733	LSM-22448		44617901	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26-,27+,32+/m0/s1	ZCLFEQBFHRMJFK-QAZWXMQQSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K97013733	BRD-K97013733-001-01-4	Broad Institute of MIT and Harvard	BRD-K97013733			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26-,27+,32+/m0/s1	ZCLFEQBFHRMJFK-QAZWXMQQSA-N	611.404669846							111004
BRD-K97472167	LSM-22449		54614956	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17+,18-,22+/m1/s1	GOTBAIXNEHVFNA-FOUBCARRSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K97472167	BRD-K97472167-001-01-7	Broad Institute of MIT and Harvard	BRD-K97472167			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17+,18-,22+/m1/s1	GOTBAIXNEHVFNA-FOUBCARRSA-N	485.255956688							131262
BRD-K91057865	LSM-22450		44489853	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21-,22-,29-/m0/s1	BFYBBBSDVFDXJC-BNXGODSSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	BroadT	BRD-K91057865	BRD-K91057865-001-01-7	Broad Institute of MIT and Harvard	BRD-K91057865			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21-,22-,29-/m0/s1	BFYBBBSDVFDXJC-BNXGODSSSA-N	584.320999788							111007
BRD-K95854766	LSM-22451		44496006	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23-,24+,29-/m1/s1	VOOFHSDUWYITSP-IDCDSMMUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K95854766	BRD-K95854766-001-01-3	Broad Institute of MIT and Harvard	BRD-K95854766			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23-,24+,29-/m1/s1	VOOFHSDUWYITSP-IDCDSMMUSA-N	603.2978215							111008
BRD-K92311828	LSM-22452		44617784	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19+,23+/m0/s1	QBUCHBBMZJBUJI-PABYOWBDSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K92311828	BRD-K92311828-001-01-3	Broad Institute of MIT and Harvard	BRD-K92311828			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18-,19+,23+/m0/s1	QBUCHBBMZJBUJI-PABYOWBDSA-N	531.29200601							111009
BRD-K80807286	LSM-22453		44620691	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25-,30+/m0/s1	KOPUKDVKYXJRIR-DNHJLFCISA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K80807286	BRD-K80807286-001-01-9	Broad Institute of MIT and Harvard	BRD-K80807286			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25-,30+/m0/s1	KOPUKDVKYXJRIR-DNHJLFCISA-N	602.404335488							111010
BRD-K85946956	LSM-15061		44486401	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28-,33-/m1/s1	YHPMBPSGDQLXHP-LSBIRFPWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K85946956	BRD-K85946956-001-01-9	Broad Institute of MIT and Harvard	BRD-K85946956			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28-,33-/m1/s1	YHPMBPSGDQLXHP-LSBIRFPWSA-N	610.409420868							103717
BRD-K99760897	LSM-22454		54614964	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29+/m0/s1	LZRQCLPDICKWHD-LQZKXZFMSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K99760897	BRD-K99760897-001-01-0	Broad Institute of MIT and Harvard	BRD-K99760897			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29+/m0/s1	LZRQCLPDICKWHD-LQZKXZFMSA-N	609.263934558							111011
BRD-K82578220	LSM-22455		44494429	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24+,29-/m0/s1	OJAAEAMCTGSNOQ-SEAFADMZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K82578220	BRD-K82578220-001-01-3	Broad Institute of MIT and Harvard	BRD-K82578220			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24+,29-/m0/s1	OJAAEAMCTGSNOQ-SEAFADMZSA-N	575.30290688							111012
BRD-K78643409	LSM-22456		44620337	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22+,23-,29+/m1/s1	AGSKCAQZMPMVIM-MBWUYLOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K78643409	BRD-K78643409-001-01-4	Broad Institute of MIT and Harvard	BRD-K78643409			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22+,23-,29+/m1/s1	AGSKCAQZMPMVIM-MBWUYLOXSA-N	572.33739878							111013
BRD-K93998074	LSM-22457		44502456	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23+,29+/m0/s1	QSYAMXVABCSWEP-KAMGSVSWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K93998074	BRD-K93998074-001-01-7	Broad Institute of MIT and Harvard	BRD-K93998074			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23+,29+/m0/s1	QSYAMXVABCSWEP-KAMGSVSWSA-N	622.33420518							111014
BRD-K80443236	LSM-22458		44495454	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23-,24-,29-/m1/s1	OJAAEAMCTGSNOQ-RWJVBYDYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K80443236	BRD-K80443236-001-01-4	Broad Institute of MIT and Harvard	BRD-K80443236			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23-,24-,29-/m1/s1	OJAAEAMCTGSNOQ-RWJVBYDYSA-N	575.30290688							111015
BRD-K94516254	LSM-22459		44489330	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m0/s1	LQSMEYMBJWSEPC-KYALDGGBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K94516254	BRD-K94516254-001-01-8	Broad Institute of MIT and Harvard	BRD-K94516254			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m0/s1	LQSMEYMBJWSEPC-KYALDGGBSA-N	525.320271506							111016
BRD-K88645787	LSM-22460		44620435	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22+,27-/m1/s1	AOLQWFIMADKXQA-RRHHDSEZSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K88645787	BRD-K88645787-001-01-9	Broad Institute of MIT and Harvard	BRD-K88645787			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22+,27-/m1/s1	AOLQWFIMADKXQA-RRHHDSEZSA-N	511.304621442							111017
BRD-K89110518	LSM-22461		44492642	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23+,24+,28-/m1/s1	FCDOAUZTELHSSL-YIIHUHPWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K89110518	BRD-K89110518-001-01-9	Broad Institute of MIT and Harvard	BRD-K89110518			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23+,24+,28-/m1/s1	FCDOAUZTELHSSL-YIIHUHPWSA-N	548.393770804							111018
BRD-K92456318	LSM-22462		44494962	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28+/m0/s1	GOBHPVUGCFRQAG-MIUQQGMZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	BroadT	BRD-K92456318	BRD-K92456318-001-01-3	Broad Institute of MIT and Harvard	BRD-K92456318			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28+/m0/s1	GOBHPVUGCFRQAG-MIUQQGMZSA-N	595.248284494							111019
BRD-K83487481	LSM-22463		44485778	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19-,23-/m1/s1	HNAHSZOZZNPVNF-ISJRUSPKSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K83487481	BRD-K83487481-001-01-0	Broad Institute of MIT and Harvard	BRD-K83487481			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19-,23-/m1/s1	HNAHSZOZZNPVNF-ISJRUSPKSA-N	499.271606752							111020
BRD-K90356496	LSM-22464		44490449	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22-,26+/m1/s1	ANVCKVJMNHXGBG-BILGYAHESA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K90356496	BRD-K90356496-001-01-1	Broad Institute of MIT and Harvard	BRD-K90356496			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22-,26+/m1/s1	ANVCKVJMNHXGBG-BILGYAHESA-N	581.259327506							111021
BRD-K89065802	LSM-22465		54614931	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22-,23-,30+/m1/s1	KQLDLPDWVHVVHP-BCSOFFBWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K89065802	BRD-K89065802-001-01-0	Broad Institute of MIT and Harvard	BRD-K89065802			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22-,23-,30+/m1/s1	KQLDLPDWVHVVHP-BCSOFFBWSA-N	619.29273612							111022
BRD-K94480039	LSM-22466		44491510	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22-,28+/m0/s1	DYIGNVBEUCFAEB-KJZXJLKKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K94480039	BRD-K94480039-001-01-9	Broad Institute of MIT and Harvard	BRD-K94480039			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22-,28+/m0/s1	DYIGNVBEUCFAEB-KJZXJLKKSA-N	558.321748716							111023
BRD-K90655269	LSM-22467		44489900	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25-,30+/m1/s1	OPCOPDBCCFUTHV-GBRARVNLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K90655269	BRD-K90655269-001-01-1	Broad Institute of MIT and Harvard	BRD-K90655269			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25-,30+/m1/s1	OPCOPDBCCFUTHV-GBRARVNLSA-N	525.356657014							111024
BRD-K86330848	LSM-22468		54614921	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22-,26-/m1/s1	UJYZNBPSVBHVBP-PIXQIBFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K86330848	BRD-K86330848-001-01-7	Broad Institute of MIT and Harvard	BRD-K86330848			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22-,26-/m1/s1	UJYZNBPSVBHVBP-PIXQIBFHSA-N	579.3090549							111025
MLS003128853	LSM-6813	SD-6-035-A12, SID99359300, BRD9678	46903876	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24+,31-/m1/s1	WIYHORLWMFSPCL-ZJKUCEDFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K94979678	BRD-K94979678-001-01-6	Broad Institute of MIT and Harvard	BRD-K94979678			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24+,31-/m1/s1	WIYHORLWMFSPCL-ZJKUCEDFSA-N	569.346486254							95434
BRD-K84949119	LSM-22469		44616622	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33+/m0/s1	FHYFYPZRCDKSKV-SQQWPVGBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K84949119	BRD-K84949119-001-01-8	Broad Institute of MIT and Harvard	BRD-K84949119			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33+/m0/s1	FHYFYPZRCDKSKV-SQQWPVGBSA-N	608.393770804							111026
BRD-K88739137	LSM-22470		44503691	InChI=1S/C32H54N4O5/c1-6-17-35(5)21-30-23(2)20-36(24(3)22-37)31(38)28-19-27(34-32(39)33-26-13-8-7-9-14-26)15-16-29(28)41-25(4)12-10-11-18-40-30/h15-16,19,23-26,30,37H,6-14,17-18,20-22H2,1-5H3,(H2,33,34,39)/t23-,24+,25+,30-/m0/s1	DKJNEIWLBYXYNW-RPQPUBLWSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K88739137	BRD-K88739137-001-01-7	Broad Institute of MIT and Harvard	BRD-K88739137			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H54N4O5/c1-6-17-35(5)21-30-23(2)20-36(24(3)22-37)31(38)28-19-27(34-32(39)33-26-13-8-7-9-14-26)15-16-29(28)41-25(4)12-10-11-18-40-30/h15-16,19,23-26,30,37H,6-14,17-18,20-22H2,1-5H3,(H2,33,34,39)/t23-,24+,25+,30-/m0/s1	DKJNEIWLBYXYNW-RPQPUBLWSA-N	574.409420868							111027
BRD-K90951880	LSM-22471		44620723	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24+,25-,30+/m1/s1	HYZLHQOJAWWHRH-ZXPXOXBPSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K90951880	BRD-K90951880-001-01-3	Broad Institute of MIT and Harvard	BRD-K90951880			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24+,25-,30+/m1/s1	HYZLHQOJAWWHRH-ZXPXOXBPSA-N	589.318556944							111028
BRD-K95543908	LSM-22472		44489899	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28+/m1/s1	VTJNXDUZLOWMHH-IZXSZHORSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K95543908	BRD-K95543908-001-01-1	Broad Institute of MIT and Harvard	BRD-K95543908			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28+/m1/s1	VTJNXDUZLOWMHH-IZXSZHORSA-N	531.367221698							111029
BRD-K91341416	LSM-22473		44490879	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22-,23-,28-/m1/s1	GAZXHMFIMHCKKU-TZTMDHJLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K91341416	BRD-K91341416-001-01-9	Broad Institute of MIT and Harvard	BRD-K91341416			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22-,23-,28-/m1/s1	GAZXHMFIMHCKKU-TZTMDHJLSA-N	576.298155858							111030
BRD-K95459450	LSM-22474		44484597	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28-/m0/s1	OWRRZEUGKXIWTQ-KYALDGGBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K95459450	BRD-K95459450-001-01-2	Broad Institute of MIT and Harvard	BRD-K95459450			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28-/m0/s1	OWRRZEUGKXIWTQ-KYALDGGBSA-N	540.331170548							111031
BRD-K83477969	LSM-22475		49843354	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22-,23+,29+/m1/s1	QSYAMXVABCSWEP-NBOGMJGSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K83477969	BRD-K83477969-001-01-2	Broad Institute of MIT and Harvard	BRD-K83477969			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22-,23+,29+/m1/s1	QSYAMXVABCSWEP-NBOGMJGSSA-N	622.33420518							111032
BRD-K90003650	LSM-22476		44497777	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23-,29+/m0/s1	QSYAMXVABCSWEP-LQZKXZFMSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K90003650	BRD-K90003650-001-01-1	Broad Institute of MIT and Harvard	BRD-K90003650			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H45F3N4O5/c1-21-18-39(22(2)20-40)30(41)27-17-26(37(4)5)14-15-28(27)44-23(3)9-7-8-16-43-29(21)19-38(6)31(42)36-25-12-10-24(11-13-25)32(33,34)35/h10-15,17,21-23,29,40H,7-9,16,18-20H2,1-6H3,(H,36,42)/t21-,22+,23-,29+/m0/s1	QSYAMXVABCSWEP-LQZKXZFMSA-N	622.33420518							111033
BRD-K87812655	LSM-22477		44617518	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m0/s1	OQPYQZIBKYAWRE-FBIDWWCOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K87812655	BRD-K87812655-001-01-5	Broad Institute of MIT and Harvard	BRD-K87812655			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m0/s1	OQPYQZIBKYAWRE-FBIDWWCOSA-N	622.37303536							111034
BRD-K96945047	LSM-22478		44496409	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27-,28+,34-/m0/s1	NYAGJJIVOVZRJD-YLLWZLIASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K96945047	BRD-K96945047-001-01-9	Broad Institute of MIT and Harvard	BRD-K96945047			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27-,28+,34-/m0/s1	NYAGJJIVOVZRJD-YLLWZLIASA-N	616.362470676							111035
BRD-K79954583	LSM-22479		44616911	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21+,28+/m1/s1	DZFCVSNNMFSZPA-MCWPVZSCSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K79954583	BRD-K79954583-001-01-2	Broad Institute of MIT and Harvard	BRD-K79954583			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21+,28+/m1/s1	DZFCVSNNMFSZPA-MCWPVZSCSA-N	570.305349724							111036
BRD-K90133009	LSM-22480		49850033	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m1/s1	OQPYQZIBKYAWRE-UJFVLINRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K90133009	BRD-K90133009-001-01-4	Broad Institute of MIT and Harvard	BRD-K90133009			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m1/s1	OQPYQZIBKYAWRE-UJFVLINRSA-N	622.37303536							111037
BRD-K87658102	LSM-22481		44494903	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20+,26+/m0/s1	YDWJBUOXSRVMJV-FDDOMMOESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C1=O	BroadT	BRD-K87658102	BRD-K87658102-001-01-1	Broad Institute of MIT and Harvard	BRD-K87658102			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20+,26+/m0/s1	YDWJBUOXSRVMJV-FDDOMMOESA-N	559.33698421							111038
BRD-K85664064	LSM-22482		44503712	InChI=1S/C30H43N3O5/c1-21-19-33(22(2)20-34)30(36)26-17-25(32-29(35)16-24-11-6-5-7-12-24)13-14-27(26)38-23(3)10-8-9-15-37-28(21)18-31-4/h5-7,11-14,17,21-23,28,31,34H,8-10,15-16,18-20H2,1-4H3,(H,32,35)/t21-,22+,23+,28+/m0/s1	GZRWXBHQPNTACC-TUEWKVEFSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K85664064	BRD-K85664064-001-01-7	Broad Institute of MIT and Harvard	BRD-K85664064			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H43N3O5/c1-21-19-33(22(2)20-34)30(36)26-17-25(32-29(35)16-24-11-6-5-7-12-24)13-14-27(26)38-23(3)10-8-9-15-37-28(21)18-31-4/h5-7,11-14,17,21-23,28,31,34H,8-10,15-16,18-20H2,1-4H3,(H,32,35)/t21-,22+,23+,28+/m0/s1	GZRWXBHQPNTACC-TUEWKVEFSA-N	525.320271506							111039
BRD-K90004516	LSM-22483		44620053	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24+,30+/m0/s1	JGZXBABAHUXSMS-GBXOJDCZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K90004516	BRD-K90004516-001-01-3	Broad Institute of MIT and Harvard	BRD-K90004516			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24+,30+/m0/s1	JGZXBABAHUXSMS-GBXOJDCZSA-N	569.346486254							111040
MLS003128880	LSM-14066	BRD-K91755384, SID99359319	44487524	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25+,26+,31+/m1/s1	SIHQACFNVCTPOW-OLHJXYGRSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K91755384	BRD-K91755384-001-01-8	Broad Institute of MIT and Harvard	BRD-K91755384			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25+,26+,31+/m1/s1	SIHQACFNVCTPOW-OLHJXYGRSA-N	582.37812074							102720
BRD-K81475473	LSM-22484		54614975	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20+,24-/m0/s1	ORDOAKKGIRZCMJ-KTIHBUSBSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K81475473	BRD-K81475473-001-01-7	Broad Institute of MIT and Harvard	BRD-K81475473			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20+,24-/m0/s1	ORDOAKKGIRZCMJ-KTIHBUSBSA-N	513.287256816							111041
BRD-K89748417	LSM-22485		54614933	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33-/m0/s1	FHYFYPZRCDKSKV-IULAASEQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K89748417	BRD-K89748417-001-01-8	Broad Institute of MIT and Harvard	BRD-K89748417			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33-/m0/s1	FHYFYPZRCDKSKV-IULAASEQSA-N	608.393770804							111042
BRD-K81543095	LSM-22486		44483962	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28-/m1/s1	LQSMEYMBJWSEPC-YFUNBVQMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K81543095	BRD-K81543095-001-01-0	Broad Institute of MIT and Harvard	BRD-K81543095			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28-/m1/s1	LQSMEYMBJWSEPC-YFUNBVQMSA-N	525.320271506							111043
CHEMBL3184660	LSM-22487	BRD-K88671309	44493623	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28-/m1/s1	GOBHPVUGCFRQAG-BUUPBASBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	BroadT	BRD-K88671309	BRD-K88671309-001-01-4	Broad Institute of MIT and Harvard	BRD-K88671309			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28-/m1/s1	GOBHPVUGCFRQAG-BUUPBASBSA-N	595.248284494							111044
BRD-K86358396	LSM-22488		54614922	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24-,30+/m1/s1	XIVCQDXGZVVHDO-KJMNMTOCSA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K86358396	BRD-K86358396-001-01-4	Broad Institute of MIT and Harvard	BRD-K86358396			COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NS(C)(=O)=O)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24-,30+/m1/s1	XIVCQDXGZVVHDO-KJMNMTOCSA-N	605.313471564							111045
BRD-K93486666	LSM-22489		44501520	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m0/s1	OQPYQZIBKYAWRE-MQBJWECPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K93486666	BRD-K93486666-001-01-7	Broad Institute of MIT and Harvard	BRD-K93486666			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32+/m0/s1	OQPYQZIBKYAWRE-MQBJWECPSA-N	622.37303536							111046
BRD-K87884409	LSM-22490		44616593	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33-/m1/s1	LFCBJIZGBQWHQM-JIXXDEQJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K87884409	BRD-K87884409-001-01-3	Broad Institute of MIT and Harvard	BRD-K87884409			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33-/m1/s1	LFCBJIZGBQWHQM-JIXXDEQJSA-N	602.346820612							111047
BRD-K83553001	LSM-22491		49843288	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23+,28+/m1/s1	VUABGABXFJSUSX-DHMIZTNRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K83553001	BRD-K83553001-001-01-0	Broad Institute of MIT and Harvard	BRD-K83553001			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23+,28+/m1/s1	VUABGABXFJSUSX-DHMIZTNRSA-N	546.37812074							111048
BRD-K90874005	LSM-22492		44618189	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26+,27+,32+/m1/s1	ZMTJRORPEDZKCY-ZPCULFKHSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K90874005	BRD-K90874005-001-01-7	Broad Institute of MIT and Harvard	BRD-K90874005			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26+,27+,32+/m1/s1	ZMTJRORPEDZKCY-ZPCULFKHSA-N	624.388685424							111049
CHEMBL2356345	LSM-22493	SID131409965, BRD-K81372179	54614974	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29+/m1/s1	LZRQCLPDICKWHD-MBWUYLOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K81372179	BRD-K81372179-001-01-3	Broad Institute of MIT and Harvard	BRD-K81372179			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29+/m1/s1	LZRQCLPDICKWHD-MBWUYLOXSA-N	609.263934558							111050
BRD-K82882121	LSM-22494		44487582	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23-,24-,29+/m1/s1	SEDRIVHSDUVLLE-XTGAJNFRSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K82882121	BRD-K82882121-001-01-9	Broad Institute of MIT and Harvard	BRD-K82882121			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23-,24-,29+/m1/s1	SEDRIVHSDUVLLE-XTGAJNFRSA-N	597.352634274							111051
BRD-K97485956	LSM-22495		54614957	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28+/m0/s1	DKJIIKWCTXJSNY-WYNJNVBPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K97485956	BRD-K97485956-001-01-4	Broad Institute of MIT and Harvard	BRD-K97485956			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28+/m0/s1	DKJIIKWCTXJSNY-WYNJNVBPSA-N	561.287256816							111052
BRD-K86981519	LSM-22496		44496872	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23-,29-/m0/s1	AGSKCAQZMPMVIM-VCTIXIOLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K86981519	BRD-K86981519-001-01-5	Broad Institute of MIT and Harvard	BRD-K86981519			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23-,29-/m0/s1	AGSKCAQZMPMVIM-VCTIXIOLSA-N	572.33739878							111053
BRD-K90020478	LSM-22497		44491497	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28+/m0/s1	LQSMEYMBJWSEPC-HIAVRWOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K90020478	BRD-K90020478-001-01-5	Broad Institute of MIT and Harvard	BRD-K90020478			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28+/m0/s1	LQSMEYMBJWSEPC-HIAVRWOZSA-N	525.320271506							111054
BRD-K93519076	LSM-22498		44490458	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20-,21-,25+/m1/s1	IUWUHICBQVKRRR-YCFYUYSTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K93519076	BRD-K93519076-001-01-9	Broad Institute of MIT and Harvard	BRD-K93519076			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20-,21-,25+/m1/s1	IUWUHICBQVKRRR-YCFYUYSTSA-N	559.323306138							111055
BRD-K90702609	LSM-22499		44616924	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23-,24-,30+/m1/s1	IYJPIDGCXVWPNR-KJMNMTOCSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)N(C)C)cc1	BroadT	BRD-K90702609	BRD-K90702609-001-01-0	Broad Institute of MIT and Harvard	BRD-K90702609			COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)N(C)C)cc1	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23-,24-,30+/m1/s1	IYJPIDGCXVWPNR-KJMNMTOCSA-N	584.357385296							111056
BRD-K88369626	LSM-22500		44501137	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21+,27+/m0/s1	QNMRQELCDYNENZ-ZAACQVCWSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K88369626	BRD-K88369626-001-01-1	Broad Institute of MIT and Harvard	BRD-K88369626			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21+,27+/m0/s1	QNMRQELCDYNENZ-ZAACQVCWSA-N	544.306098652							111057
BRD-K92767663	LSM-22501		44494539	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24+,29+/m1/s1	OJAAEAMCTGSNOQ-MSCBGTKOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K92767663	BRD-K92767663-001-01-4	Broad Institute of MIT and Harvard	BRD-K92767663			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24+,29+/m1/s1	OJAAEAMCTGSNOQ-MSCBGTKOSA-N	575.30290688							111058
BRD-K98239824	LSM-22502		44487479	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,28+/m0/s1	BRKIAEBRDYHMFE-WYNJNVBPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K98239824	BRD-K98239824-001-01-4	Broad Institute of MIT and Harvard	BRD-K98239824			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,28+/m0/s1	BRKIAEBRDYHMFE-WYNJNVBPSA-N	540.331170548							111059
BRD-K94401439	LSM-22503		44618803	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24-,25+,29+/m0/s1	NSUWFWDPIIGHAU-RGYUWNBKSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K94401439	BRD-K94401439-001-01-1	Broad Institute of MIT and Harvard	BRD-K94401439			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24-,25+,29+/m0/s1	NSUWFWDPIIGHAU-RGYUWNBKSA-N	562.409420868							111060
BRD-K78778188	LSM-15163		44495520	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21-,22+,28+/m1/s1	GMYAYTAKTSTYEI-XYFFEVBTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	BroadT	BRD-K78778188	BRD-K78778188-001-01-5	Broad Institute of MIT and Harvard	BRD-K78778188			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21-,22+,28+/m1/s1	GMYAYTAKTSTYEI-XYFFEVBTSA-N	608.318555116							103819
BRD-K86893953	LSM-22504		54614923	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23+,30-/m1/s1	SIEZSLVXLUPDNY-ORVIQXKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K86893953	BRD-K86893953-001-01-5	Broad Institute of MIT and Harvard	BRD-K86893953			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23+,30-/m1/s1	SIEZSLVXLUPDNY-ORVIQXKCSA-N	598.336649852							111061
BRD-K97707303	LSM-22505		44495506	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25-,30+/m0/s1	OMPYFAIFRLVIFJ-YDXRHMNESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K97707303	BRD-K97707303-001-01-1	Broad Institute of MIT and Harvard	BRD-K97707303			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25-,30+/m0/s1	OMPYFAIFRLVIFJ-YDXRHMNESA-N	621.338956202							111062
BRD-K92607052	LSM-22506		44490934	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20+,24+/m1/s1	JFWSYQFTTWMPPF-XUJKJYMVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K92607052	BRD-K92607052-001-01-1	Broad Institute of MIT and Harvard	BRD-K92607052			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20+,24+/m1/s1	JFWSYQFTTWMPPF-XUJKJYMVSA-N	545.307656074							111063
BRD-K81175414	LSM-22507		44501517	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25+,30+/m0/s1	KOPUKDVKYXJRIR-RZDWVWPCSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K81175414	BRD-K81175414-001-01-5	Broad Institute of MIT and Harvard	BRD-K81175414			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25+,30+/m0/s1	KOPUKDVKYXJRIR-RZDWVWPCSA-N	602.404335488							111064
BRD-K88344082	LSM-22508		44496470	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25+,30-/m1/s1	DXYWKCBATINIRK-UBRKHCEVSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K88344082	BRD-K88344082-001-01-1	Broad Institute of MIT and Harvard	BRD-K88344082			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25+,30-/m1/s1	DXYWKCBATINIRK-UBRKHCEVSA-N	596.357385296							111065
BRD-K87418665	LSM-22509		44497315	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22-,26+/m0/s1	UJYZNBPSVBHVBP-OYSWMMLKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K87418665	BRD-K87418665-001-01-9	Broad Institute of MIT and Harvard	BRD-K87418665			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22-,26+/m0/s1	UJYZNBPSVBHVBP-OYSWMMLKSA-N	579.3090549							111066
BRD-K87258738	LSM-22510		44494543	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29+/m1/s1	GPFIDTWNGXWRJK-MSCBGTKOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K87258738	BRD-K87258738-001-01-2	Broad Institute of MIT and Harvard	BRD-K87258738			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29+/m1/s1	GPFIDTWNGXWRJK-MSCBGTKOSA-N	575.30290688							111067
BRD-K91712163	LSM-22511		54614937	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27-/m0/s1	HLGABPGRBQKPOU-RJESQKRESA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K91712163	BRD-K91712163-001-01-6	Broad Institute of MIT and Harvard	BRD-K91712163			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27-/m0/s1	HLGABPGRBQKPOU-RJESQKRESA-N	532.362470676							111068
BRD-K90061492	LSM-22512		44483968	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22-,29-/m1/s1	BFYBBBSDVFDXJC-DJSJKVRESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	BroadT	BRD-K90061492	BRD-K90061492-001-01-1	Broad Institute of MIT and Harvard	BRD-K90061492			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22-,29-/m1/s1	BFYBBBSDVFDXJC-DJSJKVRESA-N	584.320999788							111069
BRD-K99908071	LSM-22513		44488180	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20+,24-/m1/s1	JFWSYQFTTWMPPF-KCOOYEKVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K99908071	BRD-K99908071-001-01-3	Broad Institute of MIT and Harvard	BRD-K99908071			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20+,24-/m1/s1	JFWSYQFTTWMPPF-KCOOYEKVSA-N	545.307656074							111070
BRD-K97237010	LSM-22514		44620045	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25-,26-,32+/m0/s1	IJPCFLZWEMVLEC-PXSDZQOHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C1=O	BroadT	BRD-K97237010	BRD-K97237010-001-01-3	Broad Institute of MIT and Harvard	BRD-K97237010			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25-,26-,32+/m0/s1	IJPCFLZWEMVLEC-PXSDZQOHSA-N	615.334207008							111071
BRD-K87748094	LSM-22515		44619906	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25-,30-/m1/s1	ZGCRSIABJPRXFC-FJRSXGRASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K87748094	BRD-K87748094-001-01-0	Broad Institute of MIT and Harvard	BRD-K87748094			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25-,30-/m1/s1	ZGCRSIABJPRXFC-FJRSXGRASA-N	553.351571634							111072
BRD-K93779718	LSM-15076		44496449	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30-/m0/s1	KOPUKDVKYXJRIR-SODQHWRNSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K93779718	BRD-K93779718-001-01-3	Broad Institute of MIT and Harvard	BRD-K93779718			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30-/m0/s1	KOPUKDVKYXJRIR-SODQHWRNSA-N	602.404335488							103732
BRD-K99380810-001-01-1	LSM-6787	BRD0810, SD-6-035-B1	44498186	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24-,31-/m1/s1	WIYHORLWMFSPCL-UMLQYNHOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K99380810	BRD-K99380810-001-01-1	Broad Institute of MIT and Harvard	BRD-K99380810			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24-,31-/m1/s1	WIYHORLWMFSPCL-UMLQYNHOSA-N	569.346486254							95408
MLS003128761	LSM-13296	BRD-K79768170, SID99359121	44494423	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29-/m0/s1	GPFIDTWNGXWRJK-SEAFADMZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K79768170	BRD-K79768170-001-01-5	Broad Institute of MIT and Harvard	BRD-K79768170			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24+,29-/m0/s1	GPFIDTWNGXWRJK-SEAFADMZSA-N	575.30290688							101935
BRD-K92884779	LSM-22516		44485126	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21-,22+,27+/m0/s1	FBKKOHUHBUWDTB-HCUOBIAZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K92884779	BRD-K92884779-001-01-8	Broad Institute of MIT and Harvard	BRD-K92884779			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21-,22+,27+/m0/s1	FBKKOHUHBUWDTB-HCUOBIAZSA-N	526.315520484							111073
BRD-K99416393	LSM-22517		44494505	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25-,30-/m0/s1	ZGCRSIABJPRXFC-XZSZPMDUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K99416393	BRD-K99416393-001-01-8	Broad Institute of MIT and Harvard	BRD-K99416393			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25-,30-/m0/s1	ZGCRSIABJPRXFC-XZSZPMDUSA-N	553.351571634							111074
BRD-K96054771	LSM-22518		54614952	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32+/m0/s1	OQPYQZIBKYAWRE-ZVJSOJQNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K96054771	BRD-K96054771-001-01-2	Broad Institute of MIT and Harvard	BRD-K96054771			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32+/m0/s1	OQPYQZIBKYAWRE-ZVJSOJQNSA-N	622.37303536							111075
BRD-K78565686-001-01-3	LSM-22519	BRD-K78565686	44620497	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20-,24+/m1/s1	ZPGALQDMRVAORJ-FIXDAVPBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K78565686	BRD-K78565686-001-01-3	Broad Institute of MIT and Harvard	BRD-K78565686			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20-,24+/m1/s1	ZPGALQDMRVAORJ-FIXDAVPBSA-N	609.269556004							111076
BRD-K81647747	LSM-22520		44490394	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29+/m1/s1	ZJHDPNYYPDHDNF-HZTMJRFTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K81647747	BRD-K81647747-001-01-1	Broad Institute of MIT and Harvard	BRD-K81647747			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29+/m1/s1	ZJHDPNYYPDHDNF-HZTMJRFTSA-N	539.33592157							111077
BRD-K81758631	LSM-22521		44617172	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28+/m1/s1	MPJVZFHLUPPQBG-LLTQPOKBSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K81758631	BRD-K81758631-001-01-5	Broad Institute of MIT and Harvard	BRD-K81758631			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28+/m1/s1	MPJVZFHLUPPQBG-LLTQPOKBSA-N	577.282171436							111078
BRD-K96243955	LSM-22522		44501847	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21+,22+,28-/m0/s1	QZYXNEJVPTWBHC-WBJWTPEXSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K96243955	BRD-K96243955-001-01-9	Broad Institute of MIT and Harvard	BRD-K96243955			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21+,22+,28-/m0/s1	QZYXNEJVPTWBHC-WBJWTPEXSA-N	556.326085168							111079
BRD-K97373334	LSM-22523		49843199	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32+/m1/s1	IDICBOGPMQOFGC-XPZOENDESA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K97373334	BRD-K97373334-001-01-5	Broad Institute of MIT and Harvard	BRD-K97373334			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32+/m1/s1	IDICBOGPMQOFGC-XPZOENDESA-N	616.326085168							111080
BRD-K95735171	LSM-22524		54614950	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28+/m0/s1	MPJVZFHLUPPQBG-SXKDZKFMSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K95735171	BRD-K95735171-001-01-3	Broad Institute of MIT and Harvard	BRD-K95735171			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28+/m0/s1	MPJVZFHLUPPQBG-SXKDZKFMSA-N	577.282171436							111081
BRD-K91277001	LSM-22525		44617690	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26-,27-,32+/m1/s1	SDZYTDXKXKHZJE-XLXCLFHOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K91277001	BRD-K91277001-001-01-6	Broad Institute of MIT and Harvard	BRD-K91277001			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26-,27-,32+/m1/s1	SDZYTDXKXKHZJE-XLXCLFHOSA-N	624.388685424							111082
BRD-K83898323	LSM-22526		44490249	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24+,29+/m0/s1	ZJHDPNYYPDHDNF-CMSZEEODSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K83898323	BRD-K83898323-001-01-0	Broad Institute of MIT and Harvard	BRD-K83898323			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24+,29+/m0/s1	ZJHDPNYYPDHDNF-CMSZEEODSA-N	539.33592157							111083
BRD-K89063617	LSM-22527		44620683	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24+,29-/m1/s1	CWMFJYTZROJEEY-IDCDSMMUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K89063617	BRD-K89063617-001-01-0	Broad Institute of MIT and Harvard	BRD-K89063617			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24+,29-/m1/s1	CWMFJYTZROJEEY-IDCDSMMUSA-N	622.33420518							111084
BRD-K79353214	LSM-22528		44489874	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25-,26+,31+/m1/s1	SIHQACFNVCTPOW-PCEYSVKOSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K79353214	BRD-K79353214-001-01-4	Broad Institute of MIT and Harvard	BRD-K79353214			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25-,26+,31+/m1/s1	SIHQACFNVCTPOW-PCEYSVKOSA-N	582.37812074							111085
BRD-K91833864	LSM-15066		54614938	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21-,28+/m1/s1	DZFCVSNNMFSZPA-MJXLQBTOSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K91833864	BRD-K91833864-001-01-2	Broad Institute of MIT and Harvard	BRD-K91833864			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21-,28+/m1/s1	DZFCVSNNMFSZPA-MJXLQBTOSA-N	570.305349724							103722
BRD-K98276754	LSM-22529		44618455	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24-,30+/m1/s1	JGZXBABAHUXSMS-KJMNMTOCSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K98276754	BRD-K98276754-001-01-0	Broad Institute of MIT and Harvard	BRD-K98276754			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24-,30+/m1/s1	JGZXBABAHUXSMS-KJMNMTOCSA-N	569.346486254							111086
BRD-K99824630	LSM-22530		44487572	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24-,25+,32+/m1/s1	HBVPERRGRWZCML-JORVKCOGSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	BroadT	BRD-K99824630	BRD-K99824630-001-01-6	Broad Institute of MIT and Harvard	BRD-K99824630			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24-,25+,32+/m1/s1	HBVPERRGRWZCML-JORVKCOGSA-N	590.346820612							111087
BRD-K80739863	LSM-22531		44502253	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21+,22+,26+/m0/s1	ZWQRBFIYGZIGKO-AVJFOWIRSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K80739863	BRD-K80739863-001-01-5	Broad Institute of MIT and Harvard	BRD-K80739863			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21+,22+,26+/m0/s1	ZWQRBFIYGZIGKO-AVJFOWIRSA-N	573.338956202							111088
BRD-K78642007	LSM-22532		44618797	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23+,28+/m0/s1	VUABGABXFJSUSX-HIAVRWOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K78642007	BRD-K78642007-001-01-2	Broad Institute of MIT and Harvard	BRD-K78642007			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22-,23+,28+/m0/s1	VUABGABXFJSUSX-HIAVRWOZSA-N	546.37812074							111089
BRD-K79212097	LSM-22533		44484602	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24+,29-/m1/s1	SEDRIVHSDUVLLE-CAFXQFFASA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K79212097	BRD-K79212097-001-01-4	Broad Institute of MIT and Harvard	BRD-K79212097			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24+,29-/m1/s1	SEDRIVHSDUVLLE-CAFXQFFASA-N	597.352634274							111090
BRD-K80593371	LSM-22534		44486435	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23-,24-,29+/m0/s1	SEDRIVHSDUVLLE-HGPRPZRGSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K80593371	BRD-K80593371-001-01-1	Broad Institute of MIT and Harvard	BRD-K80593371			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23-,24-,29+/m0/s1	SEDRIVHSDUVLLE-HGPRPZRGSA-N	597.352634274							111091
BRD-K94692455	LSM-22535		54614945	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19-,23+/m0/s1	QBUCHBBMZJBUJI-QPXQOZNCSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K94692455	BRD-K94692455-001-01-4	Broad Institute of MIT and Harvard	BRD-K94692455			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19-,23+/m0/s1	QBUCHBBMZJBUJI-QPXQOZNCSA-N	531.29200601							111092
BRD-K93590856	LSM-22536		44489346	InChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16-,17-,21-/m1/s1	XRGBJGDCXQTJDT-BZLDKRAPSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(N)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K93590856	BRD-K93590856-001-01-6	Broad Institute of MIT and Harvard	BRD-K93590856			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(N)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16-,17-,21-/m1/s1	XRGBJGDCXQTJDT-BZLDKRAPSA-N	407.278406694							111093
BRD-K90059152	LSM-22537		44616482	InChI=1S/C33H49N3O5/c1-6-17-35(5)22-31-24(2)21-36(25(3)23-37)33(39)29-20-28(34-32(38)19-27-13-8-7-9-14-27)15-16-30(29)41-26(4)12-10-11-18-40-31/h7-9,13-16,20,24-26,31,37H,6,10-12,17-19,21-23H2,1-5H3,(H,34,38)/t24-,25+,26-,31-/m1/s1	HWWNGGYYBIBPCQ-FVCFNFBRSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K90059152	BRD-K90059152-001-01-6	Broad Institute of MIT and Harvard	BRD-K90059152			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H49N3O5/c1-6-17-35(5)22-31-24(2)21-36(25(3)23-37)33(39)29-20-28(34-32(38)19-27-13-8-7-9-14-27)15-16-30(29)41-26(4)12-10-11-18-40-31/h7-9,13-16,20,24-26,31,37H,6,10-12,17-19,21-23H2,1-5H3,(H,34,38)/t24-,25+,26-,31-/m1/s1	HWWNGGYYBIBPCQ-FVCFNFBRSA-N	567.367221698							111094
BRD-K80996561	LSM-22538		44619768	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18+,19+,25-/m1/s1	OIOMLIQJBPNRTR-ANWNFGLHSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K80996561	BRD-K80996561-001-01-6	Broad Institute of MIT and Harvard	BRD-K80996561			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18+,19+,25-/m1/s1	OIOMLIQJBPNRTR-ANWNFGLHSA-N	545.321334146							111095
BRD-K82399478	LSM-22539		44617642	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21+,22+,26-/m1/s1	ZWQRBFIYGZIGKO-FYBXHKAZSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K82399478	BRD-K82399478-001-01-3	Broad Institute of MIT and Harvard	BRD-K82399478			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21+,22+,26-/m1/s1	ZWQRBFIYGZIGKO-FYBXHKAZSA-N	573.338956202							111096
BRD-K79184750	LSM-22540		44493638	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25-,30-/m1/s1	OMPYFAIFRLVIFJ-FJRSXGRASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K79184750	BRD-K79184750-001-01-3	Broad Institute of MIT and Harvard	BRD-K79184750			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25-,30-/m1/s1	OMPYFAIFRLVIFJ-FJRSXGRASA-N	621.338956202							111097
BRD-K95552726	LSM-22541		44490366	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21+,22+,26+/m1/s1	ANVCKVJMNHXGBG-QILISPFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K95552726	BRD-K95552726-001-01-2	Broad Institute of MIT and Harvard	BRD-K95552726			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21+,22+,26+/m1/s1	ANVCKVJMNHXGBG-QILISPFLSA-N	581.259327506							111098
BRD-K79568363	LSM-22542		49843300	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27+,28+,34+/m1/s1	NYAGJJIVOVZRJD-CBZWUMFZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K79568363	BRD-K79568363-001-01-6	Broad Institute of MIT and Harvard	BRD-K79568363			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27+,28+,34+/m1/s1	NYAGJJIVOVZRJD-CBZWUMFZSA-N	616.362470676							111099
BRD-K87617154	LSM-22543		44492597	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23-,24-,31-/m0/s1	DSXVWRRZDLHRDJ-WLFCTYPLSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K87617154	BRD-K87617154-001-01-4	Broad Institute of MIT and Harvard	BRD-K87617154			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23-,24-,31-/m0/s1	DSXVWRRZDLHRDJ-WLFCTYPLSA-N	576.331170548							111100
BRD-K82175530	LSM-22544		44486409	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22-,27-/m1/s1	FBKKOHUHBUWDTB-RSOWOKRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K82175530	BRD-K82175530-001-01-3	Broad Institute of MIT and Harvard	BRD-K82175530			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22-,27-/m1/s1	FBKKOHUHBUWDTB-RSOWOKRSSA-N	526.315520484							111101
BRD-K98934548	LSM-22545		44494996	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20-,26+/m0/s1	YDWJBUOXSRVMJV-GTPNXJITSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C1=O	BroadT	BRD-K98934548	BRD-K98934548-001-01-5	Broad Institute of MIT and Harvard	BRD-K98934548			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20-,26+/m0/s1	YDWJBUOXSRVMJV-GTPNXJITSA-N	559.33698421							111102
BRD-K83109105	LSM-22546		54614907	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21-,27+/m0/s1	QNMRQELCDYNENZ-MSZUUUALSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K83109105	BRD-K83109105-001-01-6	Broad Institute of MIT and Harvard	BRD-K83109105			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21-,27+/m0/s1	QNMRQELCDYNENZ-MSZUUUALSA-N	544.306098652							111103
BRD-K79839556-001-01-8	LSM-22547	BRD-K79839556	44620427	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26+,27-,32-/m1/s1	SDZYTDXKXKHZJE-ZQPSKXNCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K79839556	BRD-K79839556-001-01-8	Broad Institute of MIT and Harvard	BRD-K79839556			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26+,27-,32-/m1/s1	SDZYTDXKXKHZJE-ZQPSKXNCSA-N	624.388685424							111104
BRD-K90429860	LSM-22548		54614935	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22-,27-/m1/s1	AOLQWFIMADKXQA-XAYSYOTPSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K90429860	BRD-K90429860-001-01-4	Broad Institute of MIT and Harvard	BRD-K90429860			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22-,27-/m1/s1	AOLQWFIMADKXQA-XAYSYOTPSA-N	511.304621442							111105
BRD-K83786559	LSM-22549		44490902	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24-,29+/m0/s1	QUSLWNNTNFDPAB-HGPRPZRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K83786559	BRD-K83786559-001-01-2	Broad Institute of MIT and Harvard	BRD-K83786559			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24-,29+/m0/s1	QUSLWNNTNFDPAB-HGPRPZRGSA-N	545.382871762							111106
BRD-K79635719	LSM-22550		54614971	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27+,28-,34+/m1/s1	NYAGJJIVOVZRJD-PWTWFPBBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K79635719	BRD-K79635719-001-01-4	Broad Institute of MIT and Harvard	BRD-K79635719			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27+,28-,34+/m1/s1	NYAGJJIVOVZRJD-PWTWFPBBSA-N	616.362470676							111107
BRD-K94018786	LSM-22551		54614944	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27-/m1/s1	HLGABPGRBQKPOU-RSOWOKRSSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K94018786	BRD-K94018786-001-01-2	Broad Institute of MIT and Harvard	BRD-K94018786			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H48N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h13-14,16,20-23,27,30,34H,5-12,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27-/m1/s1	HLGABPGRBQKPOU-RSOWOKRSSA-N	532.362470676							111108
BRD-K81051633	LSM-22552		44490282	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23+,28-/m0/s1	GAZXHMFIMHCKKU-FPZRTEDSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K81051633	BRD-K81051633-001-01-3	Broad Institute of MIT and Harvard	BRD-K81051633			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23+,28-/m0/s1	GAZXHMFIMHCKKU-FPZRTEDSSA-N	576.298155858							111109
BRD-K78856515	LSM-22553		44498594	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22+,23-,28-/m1/s1	NMRMJZSCUHLPQY-JTNFPWQOSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)CC3CC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K78856515	BRD-K78856515-001-01-3	Broad Institute of MIT and Harvard	BRD-K78856515			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)CC3CC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22+,23-,28-/m1/s1	NMRMJZSCUHLPQY-JTNFPWQOSA-N	546.37812074							111110
BRD-K99581804-001-01-2	LSM-6815	BRD1804, SD-6-035-A10	49843158	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24+,31-/m0/s1	WIYHORLWMFSPCL-CBKFLQRHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K99581804	BRD-K99581804-001-01-2	Broad Institute of MIT and Harvard	BRD-K99581804			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24+,31-/m0/s1	WIYHORLWMFSPCL-CBKFLQRHSA-N	569.346486254							95436
BRD-K82671459	LSM-22554		44504562	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17+,18+,22+/m0/s1	GOTBAIXNEHVFNA-KCXPTXFHSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K82671459	BRD-K82671459-001-01-8	Broad Institute of MIT and Harvard	BRD-K82671459			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17+,18+,22+/m0/s1	GOTBAIXNEHVFNA-KCXPTXFHSA-N	485.255956688							111111
BRD-K88070373	LSM-22555		44489850	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22-,26-/m0/s1	ANVCKVJMNHXGBG-YGWSKSRPSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K88070373	BRD-K88070373-001-01-0	Broad Institute of MIT and Harvard	BRD-K88070373			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22-,26-/m0/s1	ANVCKVJMNHXGBG-YGWSKSRPSA-N	581.259327506							111112
BRD-K81728234	LSM-22556		44619713	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28+,33+/m1/s1	XXBVUIDNUVBELT-RPWGJLQWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K81728234	BRD-K81728234-001-01-9	Broad Institute of MIT and Harvard	BRD-K81728234			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28+,33+/m1/s1	XXBVUIDNUVBELT-RPWGJLQWSA-N	616.45637106							111113
BRD-K82877426	LSM-22557		44486393	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m1/s1	VTJNXDUZLOWMHH-JTNFPWQOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K82877426	BRD-K82877426-001-01-1	Broad Institute of MIT and Harvard	BRD-K82877426			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m1/s1	VTJNXDUZLOWMHH-JTNFPWQOSA-N	531.367221698							111114
BRD-K91784140	LSM-22558		44500227	InChI=1S/C26H45N3O6S/c1-7-13-28(5)17-25-19(2)16-29(20(3)18-30)26(31)23-15-22(27-36(6,32)33)11-12-24(23)35-21(4)10-8-9-14-34-25/h11-12,15,19-21,25,27,30H,7-10,13-14,16-18H2,1-6H3/t19-,20+,21+,25-/m0/s1	ZOEMVRGQCOXOOR-SMTRIPRVSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K91784140	BRD-K91784140-001-01-3	Broad Institute of MIT and Harvard	BRD-K91784140			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H45N3O6S/c1-7-13-28(5)17-25-19(2)16-29(20(3)18-30)26(31)23-15-22(27-36(6,32)33)11-12-24(23)35-21(4)10-8-9-14-34-25/h11-12,15,19-21,25,27,30H,7-10,13-14,16-18H2,1-6H3/t19-,20+,21+,25-/m0/s1	ZOEMVRGQCOXOOR-SMTRIPRVSA-N	527.30290688							111115
BRD-K95675012	LSM-22559		44617117	InChI=1S/C32H47FN4O5/c1-6-16-36(5)20-30-22(2)19-37(23(3)21-38)31(39)28-18-27(35-32(40)34-26-12-10-25(33)11-13-26)14-15-29(28)42-24(4)9-7-8-17-41-30/h10-15,18,22-24,30,38H,6-9,16-17,19-21H2,1-5H3,(H2,34,35,40)/t22-,23+,24+,30-/m1/s1	ZDZLFJDSEKLXNO-DLWGQWRRSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K95675012	BRD-K95675012-001-01-4	Broad Institute of MIT and Harvard	BRD-K95675012			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H47FN4O5/c1-6-16-36(5)20-30-22(2)19-37(23(3)21-38)31(39)28-18-27(35-32(40)34-26-12-10-25(33)11-13-26)14-15-29(28)42-24(4)9-7-8-17-41-30/h10-15,18,22-24,30,38H,6-9,16-17,19-21H2,1-5H3,(H2,34,35,40)/t22-,23+,24+,30-/m1/s1	ZDZLFJDSEKLXNO-DLWGQWRRSA-N	586.353048844							111116
BRD-K88447092	LSM-22560		44487456	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25-,26+,33+/m0/s1	UBYZDEGPUXBRQE-GMNHBYEWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K88447092	BRD-K88447092-001-01-0	Broad Institute of MIT and Harvard	BRD-K88447092			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25-,26+,33+/m0/s1	UBYZDEGPUXBRQE-GMNHBYEWSA-N	604.362470676							111117
BRD-K87465930	LSM-22561		44620463	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23+,29+/m0/s1	AGSKCAQZMPMVIM-UJUOIFIWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K87465930	BRD-K87465930-001-01-9	Broad Institute of MIT and Harvard	BRD-K87465930			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23+,29+/m0/s1	AGSKCAQZMPMVIM-UJUOIFIWSA-N	572.33739878							111118
BRD-K94445007	LSM-22562		44483829	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20+,21+,27-/m0/s1	AQPDNHSQVUKPGE-XTYKIWRDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K94445007	BRD-K94445007-001-01-0	Broad Institute of MIT and Harvard	BRD-K94445007			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20+,21+,27-/m0/s1	AQPDNHSQVUKPGE-XTYKIWRDSA-N	573.352634274							111119
BRD-K81619018	LSM-22563		49843316	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30+/m1/s1	KOPUKDVKYXJRIR-ZRIOWSNCSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K81619018	BRD-K81619018-001-01-2	Broad Institute of MIT and Harvard	BRD-K81619018			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30+/m1/s1	KOPUKDVKYXJRIR-ZRIOWSNCSA-N	602.404335488							111120
BRD-K82130737	LSM-22564		44494514	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21-,28-/m0/s1	DZFCVSNNMFSZPA-MWBFYPDXSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K82130737	BRD-K82130737-001-01-9	Broad Institute of MIT and Harvard	BRD-K82130737			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21-,28-/m0/s1	DZFCVSNNMFSZPA-MWBFYPDXSA-N	570.305349724							111121
BRD-K97697439	LSM-22565		49843066	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18-,19+,25+/m1/s1	OIOMLIQJBPNRTR-FRBSRZPYSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K97697439	BRD-K97697439-001-01-1	Broad Institute of MIT and Harvard	BRD-K97697439			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18-,19+,25+/m1/s1	OIOMLIQJBPNRTR-FRBSRZPYSA-N	545.321334146							111122
BRD-K93817456	LSM-22566		44619959	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28+/m1/s1	VUABGABXFJSUSX-KRHPZPPWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K93817456	BRD-K93817456-001-01-7	Broad Institute of MIT and Harvard	BRD-K93817456			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28+/m1/s1	VUABGABXFJSUSX-KRHPZPPWSA-N	546.37812074							111123
BRD-K79523827	LSM-22567		44489305	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24-,29-/m0/s1	QUSLWNNTNFDPAB-UITIVDIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K79523827	BRD-K79523827-001-01-1	Broad Institute of MIT and Harvard	BRD-K79523827			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24-,29-/m0/s1	QUSLWNNTNFDPAB-UITIVDIESA-N	545.382871762							111124
BRD-K84613654	LSM-22568		44619413	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21-,22-,28-/m1/s1	QZYXNEJVPTWBHC-SOLZYKTISA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K84613654	BRD-K84613654-001-01-1	Broad Institute of MIT and Harvard	BRD-K84613654			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21-,22-,28-/m1/s1	QZYXNEJVPTWBHC-SOLZYKTISA-N	556.326085168							111125
BRD-K88707941	LSM-22569		44618541	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21+,27+/m0/s1	OPIQAKQROYPQNZ-FRUANSSVSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K88707941	BRD-K88707941-001-01-0	Broad Institute of MIT and Harvard	BRD-K88707941			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21+,27+/m0/s1	OPIQAKQROYPQNZ-FRUANSSVSA-N	565.26218492							111126
BRD-K91235484	LSM-22570		54614936	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23+,24-,30+/m0/s1	JGZXBABAHUXSMS-WUBQMYJQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K91235484	BRD-K91235484-001-01-0	Broad Institute of MIT and Harvard	BRD-K91235484			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23+,24-,30+/m0/s1	JGZXBABAHUXSMS-WUBQMYJQSA-N	569.346486254							111127
BRD-K79684522	LSM-22571		54614972	InChI=1S/C33H47FN4O5/c1-22-18-38(23(2)21-39)32(40)29-17-28(36-33(41)35-27-12-10-26(34)11-13-27)14-15-30(29)43-24(3)7-5-6-16-42-31(22)20-37(4)19-25-8-9-25/h10-15,17,22-25,31,39H,5-9,16,18-21H2,1-4H3,(H2,35,36,41)/t22-,23+,24-,31-/m0/s1	STYUMYTXFXXJJW-PKWXPSSRSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc3C1=O	BroadT	BRD-K79684522	BRD-K79684522-001-01-9	Broad Institute of MIT and Harvard	BRD-K79684522			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C33H47FN4O5/c1-22-18-38(23(2)21-39)32(40)29-17-28(36-33(41)35-27-12-10-26(34)11-13-27)14-15-30(29)43-24(3)7-5-6-16-42-31(22)20-37(4)19-25-8-9-25/h10-15,17,22-25,31,39H,5-9,16,18-21H2,1-4H3,(H2,35,36,41)/t22-,23+,24-,31-/m0/s1	STYUMYTXFXXJJW-PKWXPSSRSA-N	598.353048844							111128
BRD-K97462883	LSM-22572		54614955	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28-/m1/s1	VUABGABXFJSUSX-JTNFPWQOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K97462883	BRD-K97462883-001-01-1	Broad Institute of MIT and Harvard	BRD-K97462883			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C30H50N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h14-15,17,21-24,28,35H,6-13,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28-/m1/s1	VUABGABXFJSUSX-JTNFPWQOSA-N	546.37812074							111129
BRD-K79562803	LSM-22573		44619431	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26+,27-,32+/m0/s1	SDZYTDXKXKHZJE-ACIRYHQQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K79562803	BRD-K79562803-001-01-7	Broad Institute of MIT and Harvard	BRD-K79562803			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26+,27-,32+/m0/s1	SDZYTDXKXKHZJE-ACIRYHQQSA-N	624.388685424							111130
BRD-K98145661	LSM-22574		44504494	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24+,29-/m0/s1	CWMFJYTZROJEEY-SEAFADMZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K98145661	BRD-K98145661-001-01-9	Broad Institute of MIT and Harvard	BRD-K98145661			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24+,29-/m0/s1	CWMFJYTZROJEEY-SEAFADMZSA-N	622.33420518							111131
BRD-K83143868	LSM-22575		44492641	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23+,24-,31-/m0/s1	DSXVWRRZDLHRDJ-PKWXPSSRSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K83143868	BRD-K83143868-001-01-2	Broad Institute of MIT and Harvard	BRD-K83143868			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23+,24-,31-/m0/s1	DSXVWRRZDLHRDJ-PKWXPSSRSA-N	576.331170548							111132
BRD-K81804676	LSM-22576		44619247	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21+,27-/m0/s1	OPIQAKQROYPQNZ-GRWWNZOSSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K81804676	BRD-K81804676-001-01-3	Broad Institute of MIT and Harvard	BRD-K81804676			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21+,27-/m0/s1	OPIQAKQROYPQNZ-GRWWNZOSSA-N	565.26218492							111133
BRD-K94855649	LSM-22577		49843060	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28+/m1/s1	MPJVZFHLUPPQBG-XYFFEVBTSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K94855649	BRD-K94855649-001-01-4	Broad Institute of MIT and Harvard	BRD-K94855649			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28+/m1/s1	MPJVZFHLUPPQBG-XYFFEVBTSA-N	577.282171436							111134
BRD-K94744294	LSM-22578		54614946	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28-/m1/s1	MPJVZFHLUPPQBG-BUUPBASBSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K94744294	BRD-K94744294-001-01-8	Broad Institute of MIT and Harvard	BRD-K94744294			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H43N3O7S/c1-20-18-32(21(2)19-33)29(34)26-16-23(31-40(35,36)25-12-10-24(37-5)11-13-25)9-14-27(26)39-22(3)8-6-7-15-38-28(20)17-30-4/h9-14,16,20-22,28,30-31,33H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28-/m1/s1	MPJVZFHLUPPQBG-BUUPBASBSA-N	577.282171436							111135
BRD-K99404845	LSM-22579		54614962	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24-,25+,30-/m0/s1	HYZLHQOJAWWHRH-INVAMZEASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K99404845	BRD-K99404845-001-01-8	Broad Institute of MIT and Harvard	BRD-K99404845			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24-,25+,30-/m0/s1	HYZLHQOJAWWHRH-INVAMZEASA-N	589.318556944							111136
BRD-K86938753	LSM-22580		44487563	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20+,21-,27+/m1/s1	AQPDNHSQVUKPGE-RBZJZWSTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K86938753	BRD-K86938753-001-01-0	Broad Institute of MIT and Harvard	BRD-K86938753			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20+,21-,27+/m1/s1	AQPDNHSQVUKPGE-RBZJZWSTSA-N	573.352634274							111137
BRD-K87532481	LSM-22581		44490944	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22-,28+/m1/s1	DYIGNVBEUCFAEB-LLTQPOKBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K87532481	BRD-K87532481-001-01-9	Broad Institute of MIT and Harvard	BRD-K87532481			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22-,28+/m1/s1	DYIGNVBEUCFAEB-LLTQPOKBSA-N	558.321748716							111138
BRD-K79202867	LSM-22582		44619185	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21+,22+,28+/m1/s1	QZYXNEJVPTWBHC-VYZXROPESA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K79202867	BRD-K79202867-001-01-3	Broad Institute of MIT and Harvard	BRD-K79202867			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21+,22+,28+/m1/s1	QZYXNEJVPTWBHC-VYZXROPESA-N	556.326085168							111139
BRD-K80298486	LSM-22583		49843252	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20+,21+,27+/m1/s1	JTLOVMZMVDHICP-GMAGDTKFSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K80298486	BRD-K80298486-001-01-9	Broad Institute of MIT and Harvard	BRD-K80298486			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H41F3N4O5/c1-19-17-37(20(2)18-38)28(39)25-15-24(36-29(40)35-23-10-8-22(9-11-23)30(31,32)33)12-13-26(25)42-21(3)7-5-6-14-41-27(19)16-34-4/h8-13,15,19-21,27,34,38H,5-7,14,16-18H2,1-4H3,(H2,35,36,40)/t19-,20+,21+,27+/m1/s1	JTLOVMZMVDHICP-GMAGDTKFSA-N	594.302905052							111140
BRD-K96288607	LSM-22584		44493612	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29-/m1/s1	GPFIDTWNGXWRJK-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K96288607	BRD-K96288607-001-01-6	Broad Institute of MIT and Harvard	BRD-K96288607			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23+,24-,29-/m1/s1	GPFIDTWNGXWRJK-CDLOMYRSSA-N	575.30290688							111141
BRD-K78741913	LSM-22585		54614967	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20+,24+/m0/s1	ZPGALQDMRVAORJ-PWSZPPJVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K78741913	BRD-K78741913-001-01-5	Broad Institute of MIT and Harvard	BRD-K78741913			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20+,24+/m0/s1	ZPGALQDMRVAORJ-PWSZPPJVSA-N	609.269556004							111142
BRD-K79438478	LSM-22586		54614970	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25+,26-,32-/m1/s1	JCVAFPCEYZSYDX-VUKRRIEASA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K79438478	BRD-K79438478-001-01-4	Broad Institute of MIT and Harvard	BRD-K79438478			COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25+,26-,32-/m1/s1	JCVAFPCEYZSYDX-VUKRRIEASA-N	612.388685424							111143
CHEMBL3187067	LSM-22587	BRD-K86923998	44494433	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22+,28-/m0/s1	GOBHPVUGCFRQAG-WBJWTPEXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	BroadT	BRD-K86923998	BRD-K86923998-001-01-7	Broad Institute of MIT and Harvard	BRD-K86923998			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22+,28-/m0/s1	GOBHPVUGCFRQAG-WBJWTPEXSA-N	595.248284494							111144
BRD-K83438939	LSM-22588		54614910	InChI=1S/C33H48N4O7/c1-6-14-36(5)19-31-22(2)18-37(23(3)20-38)32(39)27-16-25(10-12-28(27)44-24(4)9-7-8-15-41-31)34-33(40)35-26-11-13-29-30(17-26)43-21-42-29/h10-13,16-17,22-24,31,38H,6-9,14-15,18-21H2,1-5H3,(H2,34,35,40)/t22-,23+,24-,31-/m0/s1	XLNHBFSEXGTYPK-PKWXPSSRSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K83438939	BRD-K83438939-001-01-1	Broad Institute of MIT and Harvard	BRD-K83438939			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H48N4O7/c1-6-14-36(5)19-31-22(2)18-37(23(3)20-38)32(39)27-16-25(10-12-28(27)44-24(4)9-7-8-15-41-31)34-33(40)35-26-11-13-29-30(17-26)43-21-42-29/h10-13,16-17,22-24,31,38H,6-9,14-15,18-21H2,1-5H3,(H2,34,35,40)/t22-,23+,24-,31-/m0/s1	XLNHBFSEXGTYPK-PKWXPSSRSA-N	612.352299916							111145
BRD-K96733881	LSM-22589		44487496	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28+/m1/s1	VTJNXDUZLOWMHH-FZVPRWPTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K96733881	BRD-K96733881-001-01-8	Broad Institute of MIT and Harvard	BRD-K96733881			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28+/m1/s1	VTJNXDUZLOWMHH-FZVPRWPTSA-N	531.367221698							111146
BRD-K97486995	LSM-22590		44618687	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m0/s1	XHZKQAVNDGMQPU-WYNJNVBPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K97486995	BRD-K97486995-001-01-5	Broad Institute of MIT and Harvard	BRD-K97486995			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m0/s1	XHZKQAVNDGMQPU-WYNJNVBPSA-N	589.282171436							111147
BRD-K83673542	LSM-22591		44486987	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20-,24-/m0/s1	LBVOXJOHMPITGR-VKDGWMQASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K83673542	BRD-K83673542-001-01-2	Broad Institute of MIT and Harvard	BRD-K83673542			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20-,24-/m0/s1	LBVOXJOHMPITGR-VKDGWMQASA-N	609.269556004							111148
BRD-K87264606	LSM-22592		44502462	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22+,26+/m0/s1	UJYZNBPSVBHVBP-AVJFOWIRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K87264606	BRD-K87264606-001-01-9	Broad Institute of MIT and Harvard	BRD-K87264606			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22+,26+/m0/s1	UJYZNBPSVBHVBP-AVJFOWIRSA-N	579.3090549							111149
BRD-K90353825	LSM-22593		44619162	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25-,30-/m1/s1	KOPUKDVKYXJRIR-SFOWLQBLSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K90353825	BRD-K90353825-001-01-0	Broad Institute of MIT and Harvard	BRD-K90353825			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25-,30-/m1/s1	KOPUKDVKYXJRIR-SFOWLQBLSA-N	602.404335488							111150
BRD-K91917132	LSM-22594		44620802	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22-,23-,27-/m1/s1	MTZUJVYQNWSRMQ-DVAKJLRASA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K91917132	BRD-K91917132-001-01-9	Broad Institute of MIT and Harvard	BRD-K91917132			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22-,23-,27-/m1/s1	MTZUJVYQNWSRMQ-DVAKJLRASA-N	598.34002067							111151
BRD-K98156994	LSM-22595		44496919	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23+,24-,31+/m0/s1	DSXVWRRZDLHRDJ-PHSVBEEISA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K98156994	BRD-K98156994-001-01-4	Broad Institute of MIT and Harvard	BRD-K98156994			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23+,24-,31+/m0/s1	DSXVWRRZDLHRDJ-PHSVBEEISA-N	576.331170548							111152
BRD-K96379403	LSM-22596		44495452	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24-/m1/s1	PQNWFIFCFFWMJI-DBYOASNMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K96379403	BRD-K96379403-001-01-9	Broad Institute of MIT and Harvard	BRD-K96379403			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24-/m1/s1	PQNWFIFCFFWMJI-DBYOASNMSA-N	449.325356886							111153
CHEMBL3188184	LSM-22597	BRD-K86946907	44494582	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24+,29+/m1/s1	KAHNNCGHTWSOBA-CHCBTGSZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K86946907	BRD-K86946907-001-01-8	Broad Institute of MIT and Harvard	BRD-K86946907			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24+,29+/m1/s1	KAHNNCGHTWSOBA-CHCBTGSZSA-N	554.346820612							111154
BRD-K87878529	LSM-22598		54614929	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24+/m0/s1	ORDOAKKGIRZCMJ-AZXNSQLWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K87878529	BRD-K87878529-001-01-0	Broad Institute of MIT and Harvard	BRD-K87878529			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24+/m0/s1	ORDOAKKGIRZCMJ-AZXNSQLWSA-N	513.287256816							111155
BRD-K85440939	LSM-22599		44484587	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26-,33-/m0/s1	UBYZDEGPUXBRQE-CEMVDLCSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K85440939	BRD-K85440939-001-01-5	Broad Institute of MIT and Harvard	BRD-K85440939			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26-,33-/m0/s1	UBYZDEGPUXBRQE-CEMVDLCSSA-N	604.362470676							111156
BRD-K76510844	LSM-13108		54632164	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16+,21+/m0/s1	LPOPNFSKLDAMKV-GCKMJXCFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K76510844	BRD-K76510844-001-01-0	Broad Institute of MIT and Harvard	BRD-K76510844			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16+,21+/m0/s1	LPOPNFSKLDAMKV-GCKMJXCFSA-N	485.250141198							101746
BRD-K31067719-001-01-7	LSM-10303	BRD-K31067719	54631919	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	WJKSFTDVZIMVMK-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K31067719	BRD-K31067719-001-01-7	Broad Institute of MIT and Harvard	BRD-K31067719			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	WJKSFTDVZIMVMK-MCFFVMPBSA-N	474.203383222							98924
BRD-K62199122	LSM-12204		54632031	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m0/s1	PSXVKIUCJIMJLV-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(Cl)c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K62199122	BRD-K62199122-001-01-1	Broad Institute of MIT and Harvard	BRD-K62199122			CO[C@H]1CN(C)C(=O)c2ccc(cc2OC[C@@H](C)NC[C@@H]1C)NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m0/s1	PSXVKIUCJIMJLV-DMPWYTOCSA-N	495.15946949							100830
BRD-K83826057	LSM-13552		54631954	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m0/s1	BTAIGOZCFZRKBT-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K83826057	BRD-K83826057-001-01-3	Broad Institute of MIT and Harvard	BRD-K83826057			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m0/s1	BTAIGOZCFZRKBT-WJONJSRFSA-N	458.232933712							102194
BRD-K43732469	LSM-11096		54632083	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19+,24-/m1/s1	NFKQXDUJHPCZLU-YDIMBITNSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K43732469	BRD-K43732469-001-01-4	Broad Institute of MIT and Harvard	BRD-K43732469			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19+,24-/m1/s1	NFKQXDUJHPCZLU-YDIMBITNSA-N	504.240640982							99717
CHEMBL2358867	LSM-10775	SID131428217, BRD-K38681012	54631973	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25-/m1/s1	BEBQDKOSRNKXPA-QJMRKGMQSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3ccccc3F)C[C@H]1C	BroadT	BRD-K38681012	BRD-K38681012-001-01-2	Broad Institute of MIT and Harvard	BRD-K38681012			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2ccccc2F)C[C@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25-/m1/s1	BEBQDKOSRNKXPA-QJMRKGMQSA-N	471.253334798							99396
BRD-K18345986	LSM-9531		54632143	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21-/m0/s1	DHNAZJFKQHWVTC-MRUHUIDDSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3F)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K18345986	BRD-K18345986-001-01-0	Broad Institute of MIT and Harvard	BRD-K18345986			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3F)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21-/m0/s1	DHNAZJFKQHWVTC-MRUHUIDDSA-N	479.18901998							98152
BRD-K29532955	LSM-10219		54632202	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19-,25-/m1/s1	BBRWISDMGXAAHU-MPCDZSKCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K29532955	BRD-K29532955-001-01-7	Broad Institute of MIT and Harvard	BRD-K29532955			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19-,25-/m1/s1	BBRWISDMGXAAHU-MPCDZSKCSA-N	481.25767125							98840
BRD-K28810861	LSM-10175		54631990	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17+,24-/m1/s1	BVCIWUWSCCLIPT-XVTZWQNCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K28810861	BRD-K28810861-001-01-1	Broad Institute of MIT and Harvard	BRD-K28810861			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17+,24-/m1/s1	BVCIWUWSCCLIPT-XVTZWQNCSA-N	513.295119398							98796
BRD-K10734177	LSM-9078		54632191	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19-,25+/m0/s1	MFGGAADVNSTJDM-XHNVNVPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC4CC4	BroadT	BRD-K10734177	BRD-K10734177-001-01-2	Broad Institute of MIT and Harvard	BRD-K10734177			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19-,25+/m0/s1	MFGGAADVNSTJDM-XHNVNVPESA-N	499.304621442							97699
BRD-K04443175	LSM-8700		54632000	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26+/m1/s1	DJGRJRLVSKCCNZ-ZENTWMBTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K04443175	BRD-K04443175-001-01-0	Broad Institute of MIT and Harvard	BRD-K04443175			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26+/m1/s1	DJGRJRLVSKCCNZ-ZENTWMBTSA-N	596.275861164							97321
BRD-K37928755	LSM-10724		54632172	InChI=1S/C29H41N3O5/c1-7-10-28(33)30-23-13-14-24-26(15-23)37-19-21(3)32(17-22-11-8-9-12-25(22)35-5)16-20(2)27(36-6)18-31(4)29(24)34/h8-9,11-15,20-21,27H,7,10,16-19H2,1-6H3,(H,30,33)/t20-,21-,27-/m1/s1	GUQMFDIRRXPIMB-LGVUCKNBSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccc3OC)[C@H](C)COc2c1	BroadT	BRD-K37928755	BRD-K37928755-001-01-9	Broad Institute of MIT and Harvard	BRD-K37928755			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C29H41N3O5/c1-7-10-28(33)30-23-13-14-24-26(15-23)37-19-21(3)32(17-22-11-8-9-12-25(22)35-5)16-20(2)27(36-6)18-31(4)29(24)34/h8-9,11-15,20-21,27H,7,10,16-19H2,1-6H3,(H,30,33)/t20-,21-,27-/m1/s1	GUQMFDIRRXPIMB-LGVUCKNBSA-N	511.304621442							99345
BRD-K56150975	LSM-11822		54632222	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17-,21-/m1/s1	AOOMHDUDPOWWMY-CBGDNZLLSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)NC(C)C	BroadT	BRD-K56150975	BRD-K56150975-001-01-0	Broad Institute of MIT and Harvard	BRD-K56150975			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)NC(C)C)c1	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17-,21-/m1/s1	AOOMHDUDPOWWMY-CBGDNZLLSA-N	478.279134976							100447
BRD-K08720480	LSM-8957		54632030	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18+,22-/m1/s1	RUFIKNIWNRYTLQ-KGVIQGDOSA-N	CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K08720480	BRD-K08720480-001-01-7	Broad Institute of MIT and Harvard	BRD-K08720480			CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18+,22-/m1/s1	RUFIKNIWNRYTLQ-KGVIQGDOSA-N	476.29987042							97578
BRD-K91857575	LSM-14075		54632002	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19+,24-/m1/s1	OTFQVXLKCTXKNS-YDIMBITNSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K91857575	BRD-K91857575-001-01-1	Broad Institute of MIT and Harvard	BRD-K91857575			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19+,24-/m1/s1	OTFQVXLKCTXKNS-YDIMBITNSA-N	481.25767125							102729
BRD-K99567057	LSM-14544		54632061	InChI=1S/C24H37N5O5S/c1-7-10-29-12-17(2)22(33-6)13-28(5)24(30)20-9-8-19(11-21(20)34-15-18(29)3)26-35(31,32)23-14-27(4)16-25-23/h8-9,11,14,16-18,22,26H,7,10,12-13,15H2,1-6H3/t17-,18+,22-/m1/s1	LWIIWTGMFNHRDM-KGVIQGDOSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H]1C)OC	BroadT	BRD-K99567057	BRD-K99567057-001-01-5	Broad Institute of MIT and Harvard	BRD-K99567057			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H]1C)OC	InChI=1S/C24H37N5O5S/c1-7-10-29-12-17(2)22(33-6)13-28(5)24(30)20-9-8-19(11-21(20)34-15-18(29)3)26-35(31,32)23-14-27(4)16-25-23/h8-9,11,14,16-18,22,26H,7,10,12-13,15H2,1-6H3/t17-,18+,22-/m1/s1	LWIIWTGMFNHRDM-KGVIQGDOSA-N	507.251540024							103199
BRD-K97749477	LSM-14437		54632091	InChI=1S/C30H37N5O4/c1-21-18-35(15-12-23-8-6-5-7-9-23)22(2)20-39-27-16-24(33-29(36)26-17-31-13-14-32-26)10-11-25(27)30(37)34(3)19-28(21)38-4/h5-11,13-14,16-17,21-22,28H,12,15,18-20H2,1-4H3,(H,33,36)/t21-,22-,28-/m1/s1	BQPYXUUVDOUQTE-DQCZWYHMSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K97749477	BRD-K97749477-001-01-3	Broad Institute of MIT and Harvard	BRD-K97749477			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C30H37N5O4/c1-21-18-35(15-12-23-8-6-5-7-9-23)22(2)20-39-27-16-24(33-29(36)26-17-31-13-14-32-26)10-11-25(27)30(37)34(3)19-28(21)38-4/h5-11,13-14,16-17,21-22,28H,12,15,18-20H2,1-4H3,(H,33,36)/t21-,22-,28-/m1/s1	BQPYXUUVDOUQTE-DQCZWYHMSA-N	531.284554714							103092
BRD-K10762274	LSM-9079		54631959	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25-/m1/s1	WQZORWGHLUMPIH-HHJKRLRDSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K10762274	BRD-K10762274-001-01-5	Broad Institute of MIT and Harvard	BRD-K10762274			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25-/m1/s1	WQZORWGHLUMPIH-HHJKRLRDSA-N	487.304621442							97700
BRD-K01626010	LSM-8540		54632039	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22+/m1/s1	KJNJKXAQFIYZGQ-GTQRCTGISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K01626010	BRD-K01626010-001-01-2	Broad Institute of MIT and Harvard	BRD-K01626010			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22+/m1/s1	KJNJKXAQFIYZGQ-GTQRCTGISA-N	476.22351188							97161
BRD-K10054282	LSM-9044		54632096	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26-/m0/s1	DJGRJRLVSKCCNZ-XWXLMPLOSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K10054282	BRD-K10054282-001-01-7	Broad Institute of MIT and Harvard	BRD-K10054282			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26-/m0/s1	DJGRJRLVSKCCNZ-XWXLMPLOSA-N	596.275861164							97665
BRD-K57140889-001-01-5	LSM-11890	BRD-K57140889	54632228	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	WJKSFTDVZIMVMK-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K57140889	BRD-K57140889-001-01-5	Broad Institute of MIT and Harvard	BRD-K57140889			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	WJKSFTDVZIMVMK-DMPWYTOCSA-N	474.203383222							100516
BRD-K34385682	LSM-10502		54631945	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21-,26+/m1/s1	XLOJZIOISXYGBL-YPCDYVTLSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc3ccccc3)C[C@H]1C	BroadT	BRD-K34385682	BRD-K34385682-001-01-3	Broad Institute of MIT and Harvard	BRD-K34385682			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc2ccccc2)C[C@H]1C	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21-,26+/m1/s1	XLOJZIOISXYGBL-YPCDYVTLSA-N	496.3049558							99123
BRD-K52353085	LSM-11628		54632037	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16+,21+/m1/s1	LPOPNFSKLDAMKV-XFQAVAEZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K52353085	BRD-K52353085-001-01-1	Broad Institute of MIT and Harvard	BRD-K52353085			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16+,21+/m1/s1	LPOPNFSKLDAMKV-XFQAVAEZSA-N	485.250141198							100253
BRD-K78074929	LSM-13204		54631989	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	ITUDOLAPOXZKHG-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K78074929	BRD-K78074929-001-01-3	Broad Institute of MIT and Harvard	BRD-K78074929			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	ITUDOLAPOXZKHG-IEGUWTFLSA-N	475.214091876							101842
BRD-K29266727	LSM-10198		54631995	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19+,24+/m1/s1	OTFQVXLKCTXKNS-IMWIBFENSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K29266727	BRD-K29266727-001-01-9	Broad Institute of MIT and Harvard	BRD-K29266727			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19+,24+/m1/s1	OTFQVXLKCTXKNS-IMWIBFENSA-N	481.25767125							98819
BRD-K64023191	LSM-12337		54632216	InChI=1S/C29H45N3O4/c1-20-16-32(17-22-9-6-5-7-10-22)21(2)19-36-26-15-24(30-28(33)23-11-8-12-23)13-14-25(26)29(34)31(3)18-27(20)35-4/h13-15,20-23,27H,5-12,16-19H2,1-4H3,(H,30,33)/t20-,21+,27+/m0/s1	ZYUAJIZJWFLNII-FYQCMVGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(CC4CCCCC4)C[C@@H]1C	BroadT	BRD-K64023191	BRD-K64023191-001-01-7	Broad Institute of MIT and Harvard	BRD-K64023191			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C29H45N3O4/c1-20-16-32(17-22-9-6-5-7-10-22)21(2)19-36-26-15-24(30-28(33)23-11-8-12-23)13-14-25(26)29(34)31(3)18-27(20)35-4/h13-15,20-23,27H,5-12,16-19H2,1-4H3,(H,30,33)/t20-,21+,27+/m0/s1	ZYUAJIZJWFLNII-FYQCMVGJSA-N	499.34100695							100964
BRD-K79992300	LSM-13312		54632229	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19-,25-/m1/s1	RHXUULWZVSTJED-MPCDZSKCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc4ccncc4)C[C@H]1C	BroadT	BRD-K79992300	BRD-K79992300-001-01-4	Broad Institute of MIT and Harvard	BRD-K79992300			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19-,25-/m1/s1	RHXUULWZVSTJED-MPCDZSKCSA-N	480.273655672							101951
BRD-K13591554	LSM-9246		54632100	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19+,25-/m1/s1	RHXUULWZVSTJED-HHJKRLRDSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc4ccncc4)C[C@H]1C	BroadT	BRD-K13591554	BRD-K13591554-001-01-6	Broad Institute of MIT and Harvard	BRD-K13591554			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19+,25-/m1/s1	RHXUULWZVSTJED-HHJKRLRDSA-N	480.273655672							97867
BRD-K43048602	LSM-11046		54631933	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19-,24-/m0/s1	OTFQVXLKCTXKNS-JXQFQVJHSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K43048602	BRD-K43048602-001-01-3	Broad Institute of MIT and Harvard	BRD-K43048602			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19-,24-/m0/s1	OTFQVXLKCTXKNS-JXQFQVJHSA-N	481.25767125							99667
BRD-K87840555	LSM-13817		54631966	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25-/m1/s1	BEBQDKOSRNKXPA-FUMQJTLXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3ccccc3F)C[C@H]1C	BroadT	BRD-K87840555	BRD-K87840555-001-01-7	Broad Institute of MIT and Harvard	BRD-K87840555			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2ccccc2F)C[C@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25-/m1/s1	BEBQDKOSRNKXPA-FUMQJTLXSA-N	471.253334798							102467
BRD-K13707774	LSM-9258		54632107	InChI=1S/C27H34FN3O5/c1-6-25(32)29-21-11-12-22-23(13-21)36-16-18(3)31(26(33)19-7-9-20(28)10-8-19)14-17(2)24(35-5)15-30(4)27(22)34/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24+/m0/s1	DLQPGZNWCDDUSB-HOOSLVGPSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3ccc(F)cc3	BroadT	BRD-K13707774	BRD-K13707774-001-01-2	Broad Institute of MIT and Harvard	BRD-K13707774			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccc(F)cc2)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-21-11-12-22-23(13-21)36-16-18(3)31(26(33)19-7-9-20(28)10-8-19)14-17(2)24(35-5)15-30(4)27(22)34/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24+/m0/s1	DLQPGZNWCDDUSB-HOOSLVGPSA-N	499.248249418							97879
CHEMBL2361691	LSM-9570	BRD-K19042305, SID131428216	54631972	InChI=1S/C27H34N4O5/c1-17-14-31(27(34)22-7-5-6-12-28-22)18(2)16-36-23-13-20(29-25(32)19-8-9-19)10-11-21(23)26(33)30(3)15-24(17)35-4/h5-7,10-13,17-19,24H,8-9,14-16H2,1-4H3,(H,29,32)/t17-,18+,24+/m1/s1	ICZJHRYDJKYLQD-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccccn4	BroadT	BRD-K19042305	BRD-K19042305-001-01-6	Broad Institute of MIT and Harvard	BRD-K19042305			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccn1	InChI=1S/C27H34N4O5/c1-17-14-31(27(34)22-7-5-6-12-28-22)18(2)16-36-23-13-20(29-25(32)19-8-9-19)10-11-21(23)26(33)30(3)15-24(17)35-4/h5-7,10-13,17-19,24H,8-9,14-16H2,1-4H3,(H,29,32)/t17-,18+,24+/m1/s1	ICZJHRYDJKYLQD-YTZAWJCFSA-N	494.252920228							98191
BRD-K82825326	LSM-14952		54632166	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16-,22+/m0/s1	QUVWWXZLNVGVGD-PONJGIIJSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K82825326	BRD-K82825326-001-01-1	Broad Institute of MIT and Harvard	BRD-K82825326			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16-,22+/m0/s1	QUVWWXZLNVGVGD-PONJGIIJSA-N	502.242749468							103608
BRD-K18321170	LSM-9529		54631961	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18+,23+/m0/s1	ITUDOLAPOXZKHG-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K18321170	BRD-K18321170-001-01-7	Broad Institute of MIT and Harvard	BRD-K18321170			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18+,23+/m0/s1	ITUDOLAPOXZKHG-YZZKKUAISA-N	475.214091876							98150
BRD-K40060962	LSM-10871		54632156	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19+,25+/m1/s1	RHXUULWZVSTJED-WYEJZRMESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc4ccncc4)C[C@H]1C	BroadT	BRD-K40060962	BRD-K40060962-001-01-5	Broad Institute of MIT and Harvard	BRD-K40060962			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19+,25+/m1/s1	RHXUULWZVSTJED-WYEJZRMESA-N	480.273655672							99492
BRD-K61596998	LSM-12163		54631991	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19+,25+/m1/s1	MFGGAADVNSTJDM-WYEJZRMESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CC4CC4	BroadT	BRD-K61596998	BRD-K61596998-001-01-0	Broad Institute of MIT and Harvard	BRD-K61596998			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19+,25+/m1/s1	MFGGAADVNSTJDM-WYEJZRMESA-N	499.304621442							100789
BRD-K40603797	LSM-10910		54632060	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19+,23-/m1/s1	VMCYUUKPCWGJCJ-SELNLUPBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K40603797	BRD-K40603797-001-01-3	Broad Institute of MIT and Harvard	BRD-K40603797			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19+,23-/m1/s1	VMCYUUKPCWGJCJ-SELNLUPBSA-N	489.22974194							99531
BRD-K98062520	LSM-14457		54632154	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21+,26+/m1/s1	XLOJZIOISXYGBL-SWYRRKHMSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc3ccccc3)C[C@H]1C	BroadT	BRD-K98062520	BRD-K98062520-001-01-7	Broad Institute of MIT and Harvard	BRD-K98062520			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc2ccccc2)C[C@H]1C	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21+,26+/m1/s1	XLOJZIOISXYGBL-SWYRRKHMSA-N	496.3049558							103112
BRD-K04371396	LSM-8696		54632173	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20+,27-/m1/s1	NFEVTECKVPPYCJ-IOKPGSKQSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K04371396	BRD-K04371396-001-01-6	Broad Institute of MIT and Harvard	BRD-K04371396			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20+,27-/m1/s1	NFEVTECKVPPYCJ-IOKPGSKQSA-N	524.29987042							97317
BRD-K73324958	LSM-12920		54631917	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26-/m1/s1	DJGRJRLVSKCCNZ-UYPAYLBCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K73324958	BRD-K73324958-001-01-1	Broad Institute of MIT and Harvard	BRD-K73324958			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26-/m1/s1	DJGRJRLVSKCCNZ-UYPAYLBCSA-N	596.275861164							101557
BRD-K03888308	LSM-8671		54632220	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20+,27+/m0/s1	NFEVTECKVPPYCJ-ASHZAFPQSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K03888308	BRD-K03888308-001-01-7	Broad Institute of MIT and Harvard	BRD-K03888308			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20+,27+/m0/s1	NFEVTECKVPPYCJ-ASHZAFPQSA-N	524.29987042							97292
BRD-K99136192	LSM-14517		54632203	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	ITUDOLAPOXZKHG-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K99136192	BRD-K99136192-001-01-5	Broad Institute of MIT and Harvard	BRD-K99136192			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	ITUDOLAPOXZKHG-PMAPCBKXSA-N	475.214091876							103172
BRD-K08183383	LSM-8923		54632145	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16-,21+/m1/s1	DHNAZJFKQHWVTC-ZOCZFRKYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3F)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K08183383	BRD-K08183383-001-01-6	Broad Institute of MIT and Harvard	BRD-K08183383			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3F)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16-,21+/m1/s1	DHNAZJFKQHWVTC-ZOCZFRKYSA-N	479.18901998							97544
BRD-K71781760	LSM-12825		54632026	InChI=1S/C27H34N4O5/c1-17-14-31(27(34)22-7-5-6-12-28-22)18(2)16-36-23-13-20(29-25(32)19-8-9-19)10-11-21(23)26(33)30(3)15-24(17)35-4/h5-7,10-13,17-19,24H,8-9,14-16H2,1-4H3,(H,29,32)/t17-,18+,24+/m0/s1	ICZJHRYDJKYLQD-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccccn4	BroadT	BRD-K71781760	BRD-K71781760-001-01-2	Broad Institute of MIT and Harvard	BRD-K71781760			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccn1	InChI=1S/C27H34N4O5/c1-17-14-31(27(34)22-7-5-6-12-28-22)18(2)16-36-23-13-20(29-25(32)19-8-9-19)10-11-21(23)26(33)30(3)15-24(17)35-4/h5-7,10-13,17-19,24H,8-9,14-16H2,1-4H3,(H,29,32)/t17-,18+,24+/m0/s1	ICZJHRYDJKYLQD-HOOSLVGPSA-N	494.252920228							101462
BRD-K86631750	LSM-13735		54632139	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19+,24-/m0/s1	NFKQXDUJHPCZLU-GLDPYIMESA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K86631750	BRD-K86631750-001-01-4	Broad Institute of MIT and Harvard	BRD-K86631750			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19+,24-/m0/s1	NFKQXDUJHPCZLU-GLDPYIMESA-N	504.240640982							102384
BRD-K37457040	LSM-10692		54632212	InChI=1S/C24H37N5O5S/c1-7-10-29-12-17(2)22(33-6)13-28(5)24(30)20-9-8-19(11-21(20)34-15-18(29)3)26-35(31,32)23-14-27(4)16-25-23/h8-9,11,14,16-18,22,26H,7,10,12-13,15H2,1-6H3/t17-,18+,22+/m0/s1	LWIIWTGMFNHRDM-NJNPRVFISA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H]1C)OC	BroadT	BRD-K37457040	BRD-K37457040-001-01-4	Broad Institute of MIT and Harvard	BRD-K37457040			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H]1C)OC	InChI=1S/C24H37N5O5S/c1-7-10-29-12-17(2)22(33-6)13-28(5)24(30)20-9-8-19(11-21(20)34-15-18(29)3)26-35(31,32)23-14-27(4)16-25-23/h8-9,11,14,16-18,22,26H,7,10,12-13,15H2,1-6H3/t17-,18+,22+/m0/s1	LWIIWTGMFNHRDM-NJNPRVFISA-N	507.251540024							99313
BRD-K07937631	LSM-8907		54632048	InChI=1S/C21H28N4O5/c1-13-10-22-14(2)12-29-18-9-15(24-20(26)17-7-8-23-30-17)5-6-16(18)21(27)25(3)11-19(13)28-4/h5-9,13-14,19,22H,10-12H2,1-4H3,(H,24,26)/t13-,14-,19+/m1/s1	UYCGUZMTEQILNL-LPMFXHHGSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3oncc3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K07937631	BRD-K07937631-001-01-6	Broad Institute of MIT and Harvard	BRD-K07937631			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccno3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C21H28N4O5/c1-13-10-22-14(2)12-29-18-9-15(24-20(26)17-7-8-23-30-17)5-6-16(18)21(27)25(3)11-19(13)28-4/h5-9,13-14,19,22H,10-12H2,1-4H3,(H,24,26)/t13-,14-,19+/m1/s1	UYCGUZMTEQILNL-LPMFXHHGSA-N	416.205970036							97528
BRD-K89998644	LSM-13981		54632055	InChI=1S/C25H38N4O5/c1-15(2)26-25(32)29-12-16(3)22(33-6)13-28(5)24(31)20-11-19(27-23(30)18-7-8-18)9-10-21(20)34-14-17(29)4/h9-11,15-18,22H,7-8,12-14H2,1-6H3,(H,26,32)(H,27,30)/t16-,17-,22+/m1/s1	CYXOTKWKLUXHGN-YVHKJVDXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K89998644	BRD-K89998644-001-01-4	Broad Institute of MIT and Harvard	BRD-K89998644			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C25H38N4O5/c1-15(2)26-25(32)29-12-16(3)22(33-6)13-28(5)24(31)20-11-19(27-23(30)18-7-8-18)9-10-21(20)34-14-17(29)4/h9-11,15-18,22H,7-8,12-14H2,1-6H3,(H,26,32)(H,27,30)/t16-,17-,22+/m1/s1	CYXOTKWKLUXHGN-YVHKJVDXSA-N	474.284220356							102634
BRD-K14263251	LSM-9289		54632144	InChI=1S/C27H36N4O5/c1-6-8-25(32)29-21-10-11-22-23(13-21)36-17-19(3)31(26(33)20-9-7-12-28-14-20)15-18(2)24(35-5)16-30(4)27(22)34/h7,9-14,18-19,24H,6,8,15-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m0/s1	IERCBNABLGDWRK-XLNZFTOWSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3cccnc3	BroadT	BRD-K14263251	BRD-K14263251-001-01-7	Broad Institute of MIT and Harvard	BRD-K14263251			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2cccnc2)c1	InChI=1S/C27H36N4O5/c1-6-8-25(32)29-21-10-11-22-23(13-21)36-17-19(3)31(26(33)20-9-7-12-28-14-20)15-18(2)24(35-5)16-30(4)27(22)34/h7,9-14,18-19,24H,6,8,15-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m0/s1	IERCBNABLGDWRK-XLNZFTOWSA-N	496.268570292							97910
BRD-K68687385	LSM-12618		54632174	InChI=1S/C24H37N5O5S/c1-7-10-29-12-17(2)22(33-6)13-28(5)24(30)20-9-8-19(11-21(20)34-15-18(29)3)26-35(31,32)23-14-27(4)16-25-23/h8-9,11,14,16-18,22,26H,7,10,12-13,15H2,1-6H3/t17-,18+,22-/m0/s1	LWIIWTGMFNHRDM-SVMVAKDDSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H]1C)OC	BroadT	BRD-K68687385	BRD-K68687385-001-01-1	Broad Institute of MIT and Harvard	BRD-K68687385			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H]1C)OC	InChI=1S/C24H37N5O5S/c1-7-10-29-12-17(2)22(33-6)13-28(5)24(30)20-9-8-19(11-21(20)34-15-18(29)3)26-35(31,32)23-14-27(4)16-25-23/h8-9,11,14,16-18,22,26H,7,10,12-13,15H2,1-6H3/t17-,18+,22-/m0/s1	LWIIWTGMFNHRDM-SVMVAKDDSA-N	507.251540024							101250
BRD-K88352009	LSM-13859		54632206	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24+/m0/s1	ZQFWKBSGTDYKBN-HOOSLVGPSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	BroadT	BRD-K88352009	BRD-K88352009-001-01-4	Broad Institute of MIT and Harvard	BRD-K88352009			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24+/m0/s1	ZQFWKBSGTDYKBN-HOOSLVGPSA-N	530.25406308							102510
BRD-K86149851	LSM-13704		54631994	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19+,25+/m0/s1	BBRWISDMGXAAHU-OSWQYVSFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K86149851	BRD-K86149851-001-01-5	Broad Institute of MIT and Harvard	BRD-K86149851			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19+,25+/m0/s1	BBRWISDMGXAAHU-OSWQYVSFSA-N	481.25767125							102352
BRD-K58879212	LSM-11986		54632113	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18-,25-/m1/s1	ZVOSTPFCAQQCID-QJMRKGMQSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K58879212	BRD-K58879212-001-01-5	Broad Institute of MIT and Harvard	BRD-K58879212			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18-,25-/m1/s1	ZVOSTPFCAQQCID-QJMRKGMQSA-N	519.25447765							100612
BRD-K96345282	LSM-14339		54632108	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19-,23+/m1/s1	VMCYUUKPCWGJCJ-PWHSHALESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K96345282	BRD-K96345282-001-01-6	Broad Institute of MIT and Harvard	BRD-K96345282			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19-,23+/m1/s1	VMCYUUKPCWGJCJ-PWHSHALESA-N	489.22974194							102993
BRD-K82279920	LSM-13457		54632064	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21+/m0/s1	AOOMHDUDPOWWMY-CSODHUTKSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)NC(C)C	BroadT	BRD-K82279920	BRD-K82279920-001-01-1	Broad Institute of MIT and Harvard	BRD-K82279920			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)NC(C)C)c1	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21+/m0/s1	AOOMHDUDPOWWMY-CSODHUTKSA-N	478.279134976							102097
BRD-K51040159	LSM-11545		54632179	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19-,24+/m1/s1	NFKQXDUJHPCZLU-IECBHUPTSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K51040159	BRD-K51040159-001-01-6	Broad Institute of MIT and Harvard	BRD-K51040159			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19-,24+/m1/s1	NFKQXDUJHPCZLU-IECBHUPTSA-N	504.240640982							100168
BRD-K15719180	LSM-9371		54632024	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19+,24+/m0/s1	OTFQVXLKCTXKNS-XLNZFTOWSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K15719180	BRD-K15719180-001-01-3	Broad Institute of MIT and Harvard	BRD-K15719180			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19+,24+/m0/s1	OTFQVXLKCTXKNS-XLNZFTOWSA-N	481.25767125							97992
BRD-K05951707	LSM-8775		54632135	InChI=1S/C28H37FN4O4/c1-18-14-33(15-20-9-10-20)19(2)17-37-25-13-21(30-28(35)31-24-8-6-5-7-23(24)29)11-12-22(25)27(34)32(3)16-26(18)36-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H2,30,31,35)/t18-,19-,26+/m0/s1	SXLNUQFFJOVPKX-LZJCXSABSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K05951707	BRD-K05951707-001-01-8	Broad Institute of MIT and Harvard	BRD-K05951707			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H37FN4O4/c1-18-14-33(15-20-9-10-20)19(2)17-37-25-13-21(30-28(35)31-24-8-6-5-7-23(24)29)11-12-22(25)27(34)32(3)16-26(18)36-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H2,30,31,35)/t18-,19-,26+/m0/s1	SXLNUQFFJOVPKX-LZJCXSABSA-N	512.279883904							97396
BRD-K70860307	LSM-12752		54631997	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16-,20+/m0/s1	ILRMXYQNFGXKSX-TWOQFEAHSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(Cc3nccs3)C[C@@H]1C	BroadT	BRD-K70860307	BRD-K70860307-001-01-5	Broad Institute of MIT and Harvard	BRD-K70860307			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16-,20+/m0/s1	ILRMXYQNFGXKSX-TWOQFEAHSA-N	496.181411544							101389
BRD-K44579616	LSM-11141		54632029	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17+,24+/m0/s1	BVCIWUWSCCLIPT-OBWXTZQISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K44579616	BRD-K44579616-001-01-0	Broad Institute of MIT and Harvard	BRD-K44579616			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17+,24+/m0/s1	BVCIWUWSCCLIPT-OBWXTZQISA-N	513.295119398							99762
BRD-K43218507	LSM-11056		54632184	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22+/m1/s1	ULFQVHHILZHREN-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K43218507	BRD-K43218507-001-01-8	Broad Institute of MIT and Harvard	BRD-K43218507			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22+/m1/s1	ULFQVHHILZHREN-MCFFVMPBSA-N	443.22203467							99677
BRD-K72795491	LSM-12887		54632013	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-17-18(10-16)28-13-15(3)22-11-14(2)19(27-5)12-24(4)21(17)26/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19-/m1/s1	AZDABJQXNZGANX-ZRGWGRIASA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K72795491	BRD-K72795491-001-01-7	Broad Institute of MIT and Harvard	BRD-K72795491			CCCC(=O)Nc1ccc2c(OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-17-18(10-16)28-13-15(3)22-11-14(2)19(27-5)12-24(4)21(17)26/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19-/m1/s1	AZDABJQXNZGANX-ZRGWGRIASA-N	391.247106566							101524
BRD-K55730324	LSM-11803		54632118	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25+/m1/s1	WQZORWGHLUMPIH-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K55730324	BRD-K55730324-001-01-8	Broad Institute of MIT and Harvard	BRD-K55730324			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25+/m1/s1	WQZORWGHLUMPIH-RRQZXNHTSA-N	487.304621442							100428
BRD-K59974052	LSM-12053		54631939	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m1/s1	PSXVKIUCJIMJLV-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(Cl)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K59974052	BRD-K59974052-001-01-6	Broad Institute of MIT and Harvard	BRD-K59974052			CO[C@H]1CN(C)C(=O)c2ccc(cc2OC[C@H](C)NC[C@H]1C)NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m1/s1	PSXVKIUCJIMJLV-VVBPWWLESA-N	495.15946949							100679
BRD-K36296949	LSM-10621		54632058	InChI=1S/C27H36N4O5/c1-6-8-25(32)29-21-10-11-22-23(13-21)36-17-19(3)31(26(33)20-9-7-12-28-14-20)15-18(2)24(35-5)16-30(4)27(22)34/h7,9-14,18-19,24H,6,8,15-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m0/s1	IERCBNABLGDWRK-JXQFQVJHSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)c3cccnc3	BroadT	BRD-K36296949	BRD-K36296949-001-01-9	Broad Institute of MIT and Harvard	BRD-K36296949			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2cccnc2)c1	InChI=1S/C27H36N4O5/c1-6-8-25(32)29-21-10-11-22-23(13-21)36-17-19(3)31(26(33)20-9-7-12-28-14-20)15-18(2)24(35-5)16-30(4)27(22)34/h7,9-14,18-19,24H,6,8,15-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m0/s1	IERCBNABLGDWRK-JXQFQVJHSA-N	496.268570292							99242
BRD-K97116995	LSM-14397		54631981	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19+,25-/m1/s1	MFGGAADVNSTJDM-HHJKRLRDSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CC4CC4	BroadT	BRD-K97116995	BRD-K97116995-001-01-8	Broad Institute of MIT and Harvard	BRD-K97116995			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19+,25-/m1/s1	MFGGAADVNSTJDM-HHJKRLRDSA-N	499.304621442							103051
BRD-K39662808	LSM-10840		54632043	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18-,22+/m0/s1	RUFIKNIWNRYTLQ-NPPFBWRTSA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K39662808	BRD-K39662808-001-01-9	Broad Institute of MIT and Harvard	BRD-K39662808			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18-,22+/m0/s1	RUFIKNIWNRYTLQ-NPPFBWRTSA-N	476.29987042							99461
BRD-K84432438	LSM-13589		54632105	InChI=1S/C23H35F3N4O6S/c1-14(2)27-22(32)30-10-15(3)20(35-6)11-29(5)21(31)18-9-17(7-8-19(18)36-12-16(30)4)28-37(33,34)13-23(24,25)26/h7-9,14-16,20,28H,10-13H2,1-6H3,(H,27,32)/t15-,16+,20-/m0/s1	XOJAHRJNCMVABE-YRNRMSPPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K84432438	BRD-K84432438-001-01-9	Broad Institute of MIT and Harvard	BRD-K84432438			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C23H35F3N4O6S/c1-14(2)27-22(32)30-10-15(3)20(35-6)11-29(5)21(31)18-9-17(7-8-19(18)36-12-16(30)4)28-37(33,34)13-23(24,25)26/h7-9,14-16,20,28H,10-13H2,1-6H3,(H,27,32)/t15-,16+,20-/m0/s1	XOJAHRJNCMVABE-YRNRMSPPSA-N	552.22294017							102233
BRD-K94385358	LSM-14215		54631987	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24-/m1/s1	ZQFWKBSGTDYKBN-NXMSCROESA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K94385358	BRD-K94385358-001-01-3	Broad Institute of MIT and Harvard	BRD-K94385358			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24-/m1/s1	ZQFWKBSGTDYKBN-NXMSCROESA-N	530.25406308							102869
BRD-K37714126	LSM-10711		54632065	InChI=1S/C27H34N4O5/c1-17-14-31(27(34)22-7-5-6-12-28-22)18(2)16-36-23-13-20(29-25(32)19-8-9-19)10-11-21(23)26(33)30(3)15-24(17)35-4/h5-7,10-13,17-19,24H,8-9,14-16H2,1-4H3,(H,29,32)/t17-,18+,24-/m1/s1	ICZJHRYDJKYLQD-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccccn4	BroadT	BRD-K37714126	BRD-K37714126-001-01-5	Broad Institute of MIT and Harvard	BRD-K37714126			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccn1	InChI=1S/C27H34N4O5/c1-17-14-31(27(34)22-7-5-6-12-28-22)18(2)16-36-23-13-20(29-25(32)19-8-9-19)10-11-21(23)26(33)30(3)15-24(17)35-4/h5-7,10-13,17-19,24H,8-9,14-16H2,1-4H3,(H,29,32)/t17-,18+,24-/m1/s1	ICZJHRYDJKYLQD-NXMSCROESA-N	494.252920228							99332
BRD-K21285939	LSM-9722		54632221	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19+,25+/m1/s1	BBRWISDMGXAAHU-WYEJZRMESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K21285939	BRD-K21285939-001-01-1	Broad Institute of MIT and Harvard	BRD-K21285939			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19+,25+/m1/s1	BBRWISDMGXAAHU-WYEJZRMESA-N	481.25767125							98343
BRD-K54074847	LSM-11720		54632225	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19+,25-/m0/s1	MFGGAADVNSTJDM-CEYNDMKZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC4CC4	BroadT	BRD-K54074847	BRD-K54074847-001-01-0	Broad Institute of MIT and Harvard	BRD-K54074847			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19+,25-/m0/s1	MFGGAADVNSTJDM-CEYNDMKZSA-N	499.304621442							100345
BRD-K37219781	LSM-10674		54632119	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	BTAIGOZCFZRKBT-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K37219781	BRD-K37219781-001-01-1	Broad Institute of MIT and Harvard	BRD-K37219781			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	BTAIGOZCFZRKBT-DMPWYTOCSA-N	458.232933712							99295
BRD-K27817945	LSM-10108		54631941	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15-,19+/m1/s1	FSHWRMSUZBSSQF-CLCXKQKWSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K27817945	BRD-K27817945-001-01-7	Broad Institute of MIT and Harvard	BRD-K27817945			CCCNC(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15-,19+/m1/s1	FSHWRMSUZBSSQF-CLCXKQKWSA-N	406.258005608							98729
BRD-K42393177	LSM-10999		54632195	InChI=1S/C25H38N4O5/c1-15(2)26-25(32)29-12-16(3)22(33-6)13-28(5)24(31)20-11-19(27-23(30)18-7-8-18)9-10-21(20)34-14-17(29)4/h9-11,15-18,22H,7-8,12-14H2,1-6H3,(H,26,32)(H,27,30)/t16-,17-,22+/m0/s1	CYXOTKWKLUXHGN-PNLZDCPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K42393177	BRD-K42393177-001-01-9	Broad Institute of MIT and Harvard	BRD-K42393177			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C25H38N4O5/c1-15(2)26-25(32)29-12-16(3)22(33-6)13-28(5)24(31)20-11-19(27-23(30)18-7-8-18)9-10-21(20)34-14-17(29)4/h9-11,15-18,22H,7-8,12-14H2,1-6H3,(H,26,32)(H,27,30)/t16-,17-,22+/m0/s1	CYXOTKWKLUXHGN-PNLZDCPESA-N	474.284220356							99620
BRD-K54602409	LSM-11744		54632129	InChI=1S/C29H45N3O4/c1-20-16-32(17-22-9-6-5-7-10-22)21(2)19-36-26-15-24(30-28(33)23-11-8-12-23)13-14-25(26)29(34)31(3)18-27(20)35-4/h13-15,20-23,27H,5-12,16-19H2,1-4H3,(H,30,33)/t20-,21-,27+/m0/s1	ZYUAJIZJWFLNII-NOMHHCBYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(CC4CCCCC4)C[C@@H]1C	BroadT	BRD-K54602409	BRD-K54602409-001-01-8	Broad Institute of MIT and Harvard	BRD-K54602409			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C29H45N3O4/c1-20-16-32(17-22-9-6-5-7-10-22)21(2)19-36-26-15-24(30-28(33)23-11-8-12-23)13-14-25(26)29(34)31(3)18-27(20)35-4/h13-15,20-23,27H,5-12,16-19H2,1-4H3,(H,30,33)/t20-,21-,27+/m0/s1	ZYUAJIZJWFLNII-NOMHHCBYSA-N	499.34100695							100369
BRD-K39805076	LSM-10853		54632196	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19-,24-/m1/s1	OTFQVXLKCTXKNS-KHCICDEESA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K39805076	BRD-K39805076-001-01-9	Broad Institute of MIT and Harvard	BRD-K39805076			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19-,24-/m1/s1	OTFQVXLKCTXKNS-KHCICDEESA-N	481.25767125							99474
CHEMBL3186240	LSM-13179	BRD-K77719922	54631974	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m1/s1	PSXVKIUCJIMJLV-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(Cl)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K77719922	BRD-K77719922-001-01-1	Broad Institute of MIT and Harvard	BRD-K77719922			CO[C@H]1CN(C)C(=O)c2ccc(cc2OC[C@@H](C)NC[C@H]1C)NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m1/s1	PSXVKIUCJIMJLV-MCFFVMPBSA-N	495.15946949							101817
BRD-K37777176	LSM-10715		54632186	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18+,25-/m0/s1	ZVOSTPFCAQQCID-ATLLOTDBSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K37777176	BRD-K37777176-001-01-1	Broad Institute of MIT and Harvard	BRD-K37777176			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18+,25-/m0/s1	ZVOSTPFCAQQCID-ATLLOTDBSA-N	519.25447765							99336
BRD-K73290601	LSM-12916		54632014	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18-,22+/m1/s1	RUFIKNIWNRYTLQ-HMFYCAOWSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	BroadT	BRD-K73290601	BRD-K73290601-001-01-5	Broad Institute of MIT and Harvard	BRD-K73290601			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18-,22+/m1/s1	RUFIKNIWNRYTLQ-HMFYCAOWSA-N	476.29987042							101553
BRD-K46261417	LSM-11249		54632125	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16-,20+/m1/s1	ILRMXYQNFGXKSX-QINHECLXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3nccs3)C[C@H]1C	BroadT	BRD-K46261417	BRD-K46261417-001-01-4	Broad Institute of MIT and Harvard	BRD-K46261417			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16-,20+/m1/s1	ILRMXYQNFGXKSX-QINHECLXSA-N	496.181411544							99870
BRD-K84210283	LSM-13576		54632097	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17+,22+/m0/s1	WWIWLTDSUPVNED-GSHUGGBRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K84210283	BRD-K84210283-001-01-5	Broad Institute of MIT and Harvard	BRD-K84210283			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17+,22+/m0/s1	WWIWLTDSUPVNED-GSHUGGBRSA-N	431.278406694							102220
BRD-K09641927	LSM-9018		54632211	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16+,22+/m1/s1	QUVWWXZLNVGVGD-VVBPWWLESA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K09641927	BRD-K09641927-001-01-5	Broad Institute of MIT and Harvard	BRD-K09641927			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16+,22+/m1/s1	QUVWWXZLNVGVGD-VVBPWWLESA-N	502.242749468							97639
BRD-K33530763	LSM-10460		54632137	InChI=1S/C25H38N4O5/c1-15(2)26-25(32)29-12-16(3)22(33-6)13-28(5)24(31)20-11-19(27-23(30)18-7-8-18)9-10-21(20)34-14-17(29)4/h9-11,15-18,22H,7-8,12-14H2,1-6H3,(H,26,32)(H,27,30)/t16-,17+,22-/m1/s1	CYXOTKWKLUXHGN-HYFFOGBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K33530763	BRD-K33530763-001-01-7	Broad Institute of MIT and Harvard	BRD-K33530763			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C25H38N4O5/c1-15(2)26-25(32)29-12-16(3)22(33-6)13-28(5)24(31)20-11-19(27-23(30)18-7-8-18)9-10-21(20)34-14-17(29)4/h9-11,15-18,22H,7-8,12-14H2,1-6H3,(H,26,32)(H,27,30)/t16-,17+,22-/m1/s1	CYXOTKWKLUXHGN-HYFFOGBASA-N	474.284220356							99081
BRD-K61586432	LSM-12162		54632040	InChI=1S/C25H32F2N4O4/c1-15-12-30(3)16(2)14-35-22-11-18(7-8-19(22)24(32)31(4)13-23(15)34-5)28-25(33)29-21-10-17(26)6-9-20(21)27/h6-11,15-16,23H,12-14H2,1-5H3,(H2,28,29,33)/t15-,16-,23+/m0/s1	AKULYVRZEMKLJR-PBPSECFOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K61586432	BRD-K61586432-001-01-5	Broad Institute of MIT and Harvard	BRD-K61586432			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32F2N4O4/c1-15-12-30(3)16(2)14-35-22-11-18(7-8-19(22)24(32)31(4)13-23(15)34-5)28-25(33)29-21-10-17(26)6-9-20(21)27/h6-11,15-16,23H,12-14H2,1-5H3,(H2,28,29,33)/t15-,16-,23+/m0/s1	AKULYVRZEMKLJR-PBPSECFOSA-N	490.239161944							100788
BRD-K29004135	LSM-10187		54632084	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22-/m0/s1	KJNJKXAQFIYZGQ-KIMHZCHSSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K29004135	BRD-K29004135-001-01-0	Broad Institute of MIT and Harvard	BRD-K29004135			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22-/m0/s1	KJNJKXAQFIYZGQ-KIMHZCHSSA-N	476.22351188							98808
BRD-K63921140	LSM-12326		54632147	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	ITUDOLAPOXZKHG-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K63921140	BRD-K63921140-001-01-5	Broad Institute of MIT and Harvard	BRD-K63921140			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	ITUDOLAPOXZKHG-STSQHVNTSA-N	475.214091876							100953
BRD-K82462147	LSM-13465		54632019	InChI=1S/C25H32F2N4O4/c1-15-12-30(3)16(2)14-35-22-11-18(7-8-19(22)24(32)31(4)13-23(15)34-5)28-25(33)29-21-10-17(26)6-9-20(21)27/h6-11,15-16,23H,12-14H2,1-5H3,(H2,28,29,33)/t15-,16+,23+/m0/s1	AKULYVRZEMKLJR-NXHTTZLHSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K82462147	BRD-K82462147-001-01-0	Broad Institute of MIT and Harvard	BRD-K82462147			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32F2N4O4/c1-15-12-30(3)16(2)14-35-22-11-18(7-8-19(22)24(32)31(4)13-23(15)34-5)28-25(33)29-21-10-17(26)6-9-20(21)27/h6-11,15-16,23H,12-14H2,1-5H3,(H2,28,29,33)/t15-,16+,23+/m0/s1	AKULYVRZEMKLJR-NXHTTZLHSA-N	490.239161944							102105
BRD-K99950451	LSM-14573		54632168	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15-,19+/m0/s1	FSHWRMSUZBSSQF-YZVOILCLSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K99950451	BRD-K99950451-001-01-5	Broad Institute of MIT and Harvard	BRD-K99950451			CCCNC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15-,19+/m0/s1	FSHWRMSUZBSSQF-YZVOILCLSA-N	406.258005608							103229
BRD-K63841469	LSM-12319		54631984	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	BTAIGOZCFZRKBT-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K63841469	BRD-K63841469-001-01-8	Broad Institute of MIT and Harvard	BRD-K63841469			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	BTAIGOZCFZRKBT-MCFFVMPBSA-N	458.232933712							100946
BRD-K49623506	LSM-11446		54631979	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16+,22+/m0/s1	QUVWWXZLNVGVGD-WJONJSRFSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H]1C)OC	BroadT	BRD-K49623506	BRD-K49623506-001-01-4	Broad Institute of MIT and Harvard	BRD-K49623506			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H]1C)OC	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16+,22+/m0/s1	QUVWWXZLNVGVGD-WJONJSRFSA-N	502.242749468							100067
BRD-K78970311	LSM-13252		54632004	InChI=1S/C30H37N5O4/c1-21-18-35(15-12-23-8-6-5-7-9-23)22(2)20-39-27-16-24(33-29(36)26-17-31-13-14-32-26)10-11-25(27)30(37)34(3)19-28(21)38-4/h5-11,13-14,16-17,21-22,28H,12,15,18-20H2,1-4H3,(H,33,36)/t21-,22+,28-/m0/s1	BQPYXUUVDOUQTE-TYPXCFOJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K78970311	BRD-K78970311-001-01-8	Broad Institute of MIT and Harvard	BRD-K78970311			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C30H37N5O4/c1-21-18-35(15-12-23-8-6-5-7-9-23)22(2)20-39-27-16-24(33-29(36)26-17-31-13-14-32-26)10-11-25(27)30(37)34(3)19-28(21)38-4/h5-11,13-14,16-17,21-22,28H,12,15,18-20H2,1-4H3,(H,33,36)/t21-,22+,28-/m0/s1	BQPYXUUVDOUQTE-TYPXCFOJSA-N	531.284554714							101891
BRD-K09303054	LSM-8991		54632020	InChI=1S/C25H33F3N4O5S/c1-17-12-32(13-19-6-5-9-29-11-19)18(2)15-37-22-10-20(30-38(34,35)16-25(26,27)28)7-8-21(22)24(33)31(3)14-23(17)36-4/h5-11,17-18,23,30H,12-16H2,1-4H3/t17-,18-,23-/m0/s1	FDHKBRYHKGCIFQ-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(Cc3cccnc3)C[C@@H]1C	BroadT	BRD-K09303054	BRD-K09303054-001-01-7	Broad Institute of MIT and Harvard	BRD-K09303054			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C25H33F3N4O5S/c1-17-12-32(13-19-6-5-9-29-11-19)18(2)15-37-22-10-20(30-38(34,35)16-25(26,27)28)7-8-21(22)24(33)31(3)14-23(17)36-4/h5-11,17-18,23,30H,12-16H2,1-4H3/t17-,18-,23-/m0/s1	FDHKBRYHKGCIFQ-BSRJHKFKSA-N	558.212375486							97612
BRD-K19006997-001-01-4	LSM-22600	BRD-K19006997	54631916	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19+/m1/s1	FSHWRMSUZBSSQF-VCBZYWHSSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K19006997	BRD-K19006997-001-01-4	Broad Institute of MIT and Harvard	BRD-K19006997			CCCNC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19+/m1/s1	FSHWRMSUZBSSQF-VCBZYWHSSA-N	406.258005608							111157
BRD-K26929400	LSM-10062		54631992	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18+,22+/m0/s1	RUFIKNIWNRYTLQ-NJNPRVFISA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	BroadT	BRD-K26929400	BRD-K26929400-001-01-9	Broad Institute of MIT and Harvard	BRD-K26929400			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18+,22+/m0/s1	RUFIKNIWNRYTLQ-NJNPRVFISA-N	476.29987042							98683
BRD-K72316999	LSM-12862		54631928	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	WJKSFTDVZIMVMK-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K72316999	BRD-K72316999-001-01-9	Broad Institute of MIT and Harvard	BRD-K72316999			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	WJKSFTDVZIMVMK-VVBPWWLESA-N	474.203383222							101499
BRD-K70012251	LSM-12703		54631970	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16+,21-/m0/s1	LPOPNFSKLDAMKV-MRUHUIDDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K70012251	BRD-K70012251-001-01-9	Broad Institute of MIT and Harvard	BRD-K70012251			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16+,21-/m0/s1	LPOPNFSKLDAMKV-MRUHUIDDSA-N	485.250141198							101338
BRD-K68744630-001-01-3	LSM-22601	BRD-K68744630	54631915	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21-,28-/m1/s1	XXZJPGUPXRETOH-UMQWNRPGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K68744630	BRD-K68744630-001-01-3	Broad Institute of MIT and Harvard	BRD-K68744630			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21-,28-/m1/s1	XXZJPGUPXRETOH-UMQWNRPGSA-N	598.22613377							111158
BRD-K36908385	LSM-10661		54632140	InChI=1S/C27H36N4O5/c1-6-8-25(32)29-21-10-11-22-23(13-21)36-17-19(3)31(26(33)20-9-7-12-28-14-20)15-18(2)24(35-5)16-30(4)27(22)34/h7,9-14,18-19,24H,6,8,15-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m1/s1	IERCBNABLGDWRK-IMWIBFENSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3cccnc3	BroadT	BRD-K36908385	BRD-K36908385-001-01-0	Broad Institute of MIT and Harvard	BRD-K36908385			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2cccnc2)c1	InChI=1S/C27H36N4O5/c1-6-8-25(32)29-21-10-11-22-23(13-21)36-17-19(3)31(26(33)20-9-7-12-28-14-20)15-18(2)24(35-5)16-30(4)27(22)34/h7,9-14,18-19,24H,6,8,15-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m1/s1	IERCBNABLGDWRK-IMWIBFENSA-N	496.268570292							99282
BRD-K41703587	LSM-10963		54632162	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25+/m1/s1	BEBQDKOSRNKXPA-UZEJHQAJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3ccccc3F)C[C@H]1C	BroadT	BRD-K41703587	BRD-K41703587-001-01-4	Broad Institute of MIT and Harvard	BRD-K41703587			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2ccccc2F)C[C@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25+/m1/s1	BEBQDKOSRNKXPA-UZEJHQAJSA-N	471.253334798							99584
BRD-K31112909	LSM-10307		54632197	InChI=1S/C27H34FN3O5/c1-6-25(32)29-21-11-12-22-23(13-21)36-16-18(3)31(26(33)19-7-9-20(28)10-8-19)14-17(2)24(35-5)15-30(4)27(22)34/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24-/m1/s1	DLQPGZNWCDDUSB-NXMSCROESA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccc(F)cc3	BroadT	BRD-K31112909	BRD-K31112909-001-01-1	Broad Institute of MIT and Harvard	BRD-K31112909			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccc(F)cc2)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-21-11-12-22-23(13-21)36-16-18(3)31(26(33)19-7-9-20(28)10-8-19)14-17(2)24(35-5)15-30(4)27(22)34/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24-/m1/s1	DLQPGZNWCDDUSB-NXMSCROESA-N	499.248249418							98928
BRD-K72232421	LSM-12854		54631949	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18+/m1/s1	DDFPKKGQTCCPIA-LBTNJELSSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K72232421	BRD-K72232421-001-01-6	Broad Institute of MIT and Harvard	BRD-K72232421			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18+/m1/s1	DDFPKKGQTCCPIA-LBTNJELSSA-N	413.198441812							101491
BRD-K65517548	LSM-12427		54631955	InChI=1S/C25H32F2N4O4/c1-15-12-30(3)16(2)14-35-22-11-18(7-8-19(22)24(32)31(4)13-23(15)34-5)28-25(33)29-21-10-17(26)6-9-20(21)27/h6-11,15-16,23H,12-14H2,1-5H3,(H2,28,29,33)/t15-,16+,23-/m1/s1	AKULYVRZEMKLJR-VBURHUQHSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K65517548	BRD-K65517548-001-01-7	Broad Institute of MIT and Harvard	BRD-K65517548			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H32F2N4O4/c1-15-12-30(3)16(2)14-35-22-11-18(7-8-19(22)24(32)31(4)13-23(15)34-5)28-25(33)29-21-10-17(26)6-9-20(21)27/h6-11,15-16,23H,12-14H2,1-5H3,(H2,28,29,33)/t15-,16+,23-/m1/s1	AKULYVRZEMKLJR-VBURHUQHSA-N	490.239161944							101054
BRD-K12896711	LSM-9196		54632077	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19+,23+/m1/s1	VMCYUUKPCWGJCJ-MSYCTHLASA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K12896711	BRD-K12896711-001-01-0	Broad Institute of MIT and Harvard	BRD-K12896711			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19+,23+/m1/s1	VMCYUUKPCWGJCJ-MSYCTHLASA-N	489.22974194							97817
BRD-K71604153	LSM-12811		54632051	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22-/m1/s1	ULFQVHHILZHREN-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K71604153	BRD-K71604153-001-01-1	Broad Institute of MIT and Harvard	BRD-K71604153			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22-/m1/s1	ULFQVHHILZHREN-ZMPRRUGASA-N	443.22203467							101448
BRD-K30750630	LSM-10279		54632124	InChI=1S/C25H32F2N4O4/c1-15-12-30(3)16(2)14-35-22-11-18(7-8-19(22)24(32)31(4)13-23(15)34-5)28-25(33)29-21-10-17(26)6-9-20(21)27/h6-11,15-16,23H,12-14H2,1-5H3,(H2,28,29,33)/t15-,16+,23+/m1/s1	AKULYVRZEMKLJR-SYJLOODJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K30750630	BRD-K30750630-001-01-5	Broad Institute of MIT and Harvard	BRD-K30750630			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H32F2N4O4/c1-15-12-30(3)16(2)14-35-22-11-18(7-8-19(22)24(32)31(4)13-23(15)34-5)28-25(33)29-21-10-17(26)6-9-20(21)27/h6-11,15-16,23H,12-14H2,1-5H3,(H2,28,29,33)/t15-,16+,23+/m1/s1	AKULYVRZEMKLJR-SYJLOODJSA-N	490.239161944							98900
BRD-K63047641	LSM-12265		54632134	InChI=1S/C27H34N4O5/c1-17-14-31(27(34)22-7-5-6-12-28-22)18(2)16-36-23-13-20(29-25(32)19-8-9-19)10-11-21(23)26(33)30(3)15-24(17)35-4/h5-7,10-13,17-19,24H,8-9,14-16H2,1-4H3,(H,29,32)/t17-,18-,24+/m1/s1	ICZJHRYDJKYLQD-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccccn4	BroadT	BRD-K63047641	BRD-K63047641-001-01-3	Broad Institute of MIT and Harvard	BRD-K63047641			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccn1	InChI=1S/C27H34N4O5/c1-17-14-31(27(34)22-7-5-6-12-28-22)18(2)16-36-23-13-20(29-25(32)19-8-9-19)10-11-21(23)26(33)30(3)15-24(17)35-4/h5-7,10-13,17-19,24H,8-9,14-16H2,1-4H3,(H,29,32)/t17-,18-,24+/m1/s1	ICZJHRYDJKYLQD-GGUMNFRJSA-N	494.252920228							100891
BRD-K17429946	LSM-9476		54632189	InChI=1S/C25H32F2N4O4/c1-15-12-30(3)16(2)14-35-22-11-18(7-8-19(22)24(32)31(4)13-23(15)34-5)28-25(33)29-21-10-17(26)6-9-20(21)27/h6-11,15-16,23H,12-14H2,1-5H3,(H2,28,29,33)/t15-,16-,23+/m1/s1	AKULYVRZEMKLJR-LNPFQXMTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K17429946	BRD-K17429946-001-01-2	Broad Institute of MIT and Harvard	BRD-K17429946			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H32F2N4O4/c1-15-12-30(3)16(2)14-35-22-11-18(7-8-19(22)24(32)31(4)13-23(15)34-5)28-25(33)29-21-10-17(26)6-9-20(21)27/h6-11,15-16,23H,12-14H2,1-5H3,(H2,28,29,33)/t15-,16-,23+/m1/s1	AKULYVRZEMKLJR-LNPFQXMTSA-N	490.239161944							98097
BRD-K46273627	LSM-11251		54632152	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25-/m0/s1	WQZORWGHLUMPIH-MHPIHPPYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K46273627	BRD-K46273627-001-01-5	Broad Institute of MIT and Harvard	BRD-K46273627			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25-/m0/s1	WQZORWGHLUMPIH-MHPIHPPYSA-N	487.304621442							99872
BRD-K26298689	LSM-10022		54632046	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19-,25-/m1/s1	MFGGAADVNSTJDM-MPCDZSKCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC4CC4	BroadT	BRD-K26298689	BRD-K26298689-001-01-1	Broad Institute of MIT and Harvard	BRD-K26298689			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19-,25-/m1/s1	MFGGAADVNSTJDM-MPCDZSKCSA-N	499.304621442							98643
BRD-K62601469	LSM-12229		54632126	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21+,26-/m0/s1	XLOJZIOISXYGBL-UZINWLIJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc3ccccc3)C[C@@H]1C	BroadT	BRD-K62601469	BRD-K62601469-001-01-7	Broad Institute of MIT and Harvard	BRD-K62601469			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc2ccccc2)C[C@@H]1C	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21+,26-/m0/s1	XLOJZIOISXYGBL-UZINWLIJSA-N	496.3049558							100855
BRD-K60706752	LSM-12100		54632187	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17+,24+/m1/s1	BVCIWUWSCCLIPT-KCYKTTMJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K60706752	BRD-K60706752-001-01-2	Broad Institute of MIT and Harvard	BRD-K60706752			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17+,24+/m1/s1	BVCIWUWSCCLIPT-KCYKTTMJSA-N	513.295119398							100726
BRD-K64428314	LSM-12361		54632038	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19+,25-/m1/s1	BBRWISDMGXAAHU-HHJKRLRDSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K64428314	BRD-K64428314-001-01-0	Broad Institute of MIT and Harvard	BRD-K64428314			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19+,25-/m1/s1	BBRWISDMGXAAHU-HHJKRLRDSA-N	481.25767125							100988
BRD-K92096002	LSM-14087		54632208	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24-/m0/s1	MJQDMCPXEXXQJL-SRGWNRLKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K92096002	BRD-K92096002-001-01-8	Broad Institute of MIT and Harvard	BRD-K92096002			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24-/m0/s1	MJQDMCPXEXXQJL-SRGWNRLKSA-N	485.232599354							102741
BRD-K62314156	LSM-12213		54632050	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20-,27+/m0/s1	NFEVTECKVPPYCJ-OWOAZTCBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K62314156	BRD-K62314156-001-01-5	Broad Institute of MIT and Harvard	BRD-K62314156			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20-,27+/m0/s1	NFEVTECKVPPYCJ-OWOAZTCBSA-N	524.29987042							100839
BRD-K90610504	LSM-14009		54632136	InChI=1S/C27H34N4O5/c1-17-14-31(27(34)22-7-5-6-12-28-22)18(2)16-36-23-13-20(29-25(32)19-8-9-19)10-11-21(23)26(33)30(3)15-24(17)35-4/h5-7,10-13,17-19,24H,8-9,14-16H2,1-4H3,(H,29,32)/t17-,18+,24-/m0/s1	ICZJHRYDJKYLQD-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccccn4	BroadT	BRD-K90610504	BRD-K90610504-001-01-1	Broad Institute of MIT and Harvard	BRD-K90610504			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccn1	InChI=1S/C27H34N4O5/c1-17-14-31(27(34)22-7-5-6-12-28-22)18(2)16-36-23-13-20(29-25(32)19-8-9-19)10-11-21(23)26(33)30(3)15-24(17)35-4/h5-7,10-13,17-19,24H,8-9,14-16H2,1-4H3,(H,29,32)/t17-,18+,24-/m0/s1	ICZJHRYDJKYLQD-RHGYRFJNSA-N	494.252920228							102662
BRD-K48528697	LSM-11381		54632133	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m0/s1	PSXVKIUCJIMJLV-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(Cl)c3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K48528697	BRD-K48528697-001-01-5	Broad Institute of MIT and Harvard	BRD-K48528697			CO[C@@H]1CN(C)C(=O)c2ccc(cc2OC[C@H](C)NC[C@@H]1C)NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m0/s1	PSXVKIUCJIMJLV-PONJGIIJSA-N	495.15946949							100002
BRD-K80503839	LSM-13351		54631980	InChI=1S/C24H37N5O5S/c1-7-10-29-12-17(2)22(33-6)13-28(5)24(30)20-9-8-19(11-21(20)34-15-18(29)3)26-35(31,32)23-14-27(4)16-25-23/h8-9,11,14,16-18,22,26H,7,10,12-13,15H2,1-6H3/t17-,18-,22+/m1/s1	LWIIWTGMFNHRDM-HMFYCAOWSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H]1C)OC	BroadT	BRD-K80503839	BRD-K80503839-001-01-6	Broad Institute of MIT and Harvard	BRD-K80503839			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@H]1C)OC	InChI=1S/C24H37N5O5S/c1-7-10-29-12-17(2)22(33-6)13-28(5)24(30)20-9-8-19(11-21(20)34-15-18(29)3)26-35(31,32)23-14-27(4)16-25-23/h8-9,11,14,16-18,22,26H,7,10,12-13,15H2,1-6H3/t17-,18-,22+/m1/s1	LWIIWTGMFNHRDM-HMFYCAOWSA-N	507.251540024							101990
BRD-K72463020	LSM-14912		54632167	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18+,25-/m1/s1	ZVOSTPFCAQQCID-FUMQJTLXSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cc(F)ccc3F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K72463020	BRD-K72463020-001-01-2	Broad Institute of MIT and Harvard	BRD-K72463020			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cc(F)ccc3F)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18+,25-/m1/s1	ZVOSTPFCAQQCID-FUMQJTLXSA-N	519.25447765							103568
BRD-K56603522	LSM-11852		54631999	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24+/m1/s1	MJQDMCPXEXXQJL-OJLQRUNKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K56603522	BRD-K56603522-001-01-6	Broad Institute of MIT and Harvard	BRD-K56603522			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24+/m1/s1	MJQDMCPXEXXQJL-OJLQRUNKSA-N	485.232599354							100478
BRD-K95814727	LSM-14305		54632155	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22-/m1/s1	PSXVKIUCJIMJLV-XCGNWRKASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(Cl)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K95814727	BRD-K95814727-001-01-5	Broad Institute of MIT and Harvard	BRD-K95814727			CO[C@@H]1CN(C)C(=O)c2ccc(cc2OC[C@@H](C)NC[C@H]1C)NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22-/m1/s1	PSXVKIUCJIMJLV-XCGNWRKASA-N	495.15946949							102959
BRD-K93986444	LSM-14190		54632103	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17-,24+/m0/s1	BVCIWUWSCCLIPT-WOGXIUBCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K93986444	BRD-K93986444-001-01-5	Broad Institute of MIT and Harvard	BRD-K93986444			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17-,24+/m0/s1	BVCIWUWSCCLIPT-WOGXIUBCSA-N	513.295119398							102844
BRD-K71205264	LSM-12778		54632010	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m0/s1	WJKSFTDVZIMVMK-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K71205264	BRD-K71205264-001-01-3	Broad Institute of MIT and Harvard	BRD-K71205264			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m0/s1	WJKSFTDVZIMVMK-WJONJSRFSA-N	474.203383222							101415
BRD-K49158673	LSM-11416		54632159	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22-/m1/s1	BTAIGOZCFZRKBT-XCGNWRKASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K49158673	BRD-K49158673-001-01-8	Broad Institute of MIT and Harvard	BRD-K49158673			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22-/m1/s1	BTAIGOZCFZRKBT-XCGNWRKASA-N	458.232933712							100037
BRD-K98468968	LSM-14478		54632059	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19+,23-/m0/s1	VMCYUUKPCWGJCJ-YYDVJCTNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K98468968	BRD-K98468968-001-01-5	Broad Institute of MIT and Harvard	BRD-K98468968			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19+,23-/m0/s1	VMCYUUKPCWGJCJ-YYDVJCTNSA-N	489.22974194							103133
BRD-K96406750	LSM-14341		54632163	InChI=1S/C25H32F2N4O4/c1-15-12-30(3)16(2)14-35-22-11-18(7-8-19(22)24(32)31(4)13-23(15)34-5)28-25(33)29-21-10-17(26)6-9-20(21)27/h6-11,15-16,23H,12-14H2,1-5H3,(H2,28,29,33)/t15-,16+,23-/m0/s1	AKULYVRZEMKLJR-PXAQALGRSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K96406750	BRD-K96406750-001-01-9	Broad Institute of MIT and Harvard	BRD-K96406750			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(F)ccc3F)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32F2N4O4/c1-15-12-30(3)16(2)14-35-22-11-18(7-8-19(22)24(32)31(4)13-23(15)34-5)28-25(33)29-21-10-17(26)6-9-20(21)27/h6-11,15-16,23H,12-14H2,1-5H3,(H2,28,29,33)/t15-,16+,23-/m0/s1	AKULYVRZEMKLJR-PXAQALGRSA-N	490.239161944							102995
BRD-K30803694	LSM-10285		54631920	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19+,27-/m1/s1	KBKSWHGSXCIXAL-VXLXPWSCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)N(CC5CC5)C[C@H]1C	BroadT	BRD-K30803694	BRD-K30803694-001-01-5	Broad Institute of MIT and Harvard	BRD-K30803694			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19+,27-/m1/s1	KBKSWHGSXCIXAL-VXLXPWSCSA-N	523.268235934							98906
BRD-K55637344	LSM-11797		54631971	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25+/m1/s1	BEBQDKOSRNKXPA-GAKIBJFNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3ccccc3F)C[C@H]1C	BroadT	BRD-K55637344	BRD-K55637344-001-01-1	Broad Institute of MIT and Harvard	BRD-K55637344			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2ccccc2F)C[C@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25+/m1/s1	BEBQDKOSRNKXPA-GAKIBJFNSA-N	471.253334798							100422
BRD-K46005840	LSM-11232		54632194	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19-,23-/m1/s1	VMCYUUKPCWGJCJ-DNVFCKCGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K46005840	BRD-K46005840-001-01-2	Broad Institute of MIT and Harvard	BRD-K46005840			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19-,23-/m1/s1	VMCYUUKPCWGJCJ-DNVFCKCGSA-N	489.22974194							99853
BRD-K73427206	LSM-12926		54632054	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22+/m1/s1	KJNJKXAQFIYZGQ-HLFMIMNKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K73427206	BRD-K73427206-001-01-2	Broad Institute of MIT and Harvard	BRD-K73427206			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22+/m1/s1	KJNJKXAQFIYZGQ-HLFMIMNKSA-N	476.22351188							101563
BRD-K27803932	LSM-10105		54632138	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21-/m0/s1	AOOMHDUDPOWWMY-FVJLSDCUSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)NC(C)C	BroadT	BRD-K27803932	BRD-K27803932-001-01-2	Broad Institute of MIT and Harvard	BRD-K27803932			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)NC(C)C)c1	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21-/m0/s1	AOOMHDUDPOWWMY-FVJLSDCUSA-N	478.279134976							98726
BRD-K40628295	LSM-10912		54632015	InChI=1S/C30H37N5O4/c1-21-18-35(15-12-23-8-6-5-7-9-23)22(2)20-39-27-16-24(33-29(36)26-17-31-13-14-32-26)10-11-25(27)30(37)34(3)19-28(21)38-4/h5-11,13-14,16-17,21-22,28H,12,15,18-20H2,1-4H3,(H,33,36)/t21-,22+,28+/m1/s1	BQPYXUUVDOUQTE-WENCSYSZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K40628295	BRD-K40628295-001-01-7	Broad Institute of MIT and Harvard	BRD-K40628295			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C30H37N5O4/c1-21-18-35(15-12-23-8-6-5-7-9-23)22(2)20-39-27-16-24(33-29(36)26-17-31-13-14-32-26)10-11-25(27)30(37)34(3)19-28(21)38-4/h5-11,13-14,16-17,21-22,28H,12,15,18-20H2,1-4H3,(H,33,36)/t21-,22+,28+/m1/s1	BQPYXUUVDOUQTE-WENCSYSZSA-N	531.284554714							99533
BRD-K89920769	LSM-13973		54632142	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26+/m1/s1	DJGRJRLVSKCCNZ-KABRZNFWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K89920769	BRD-K89920769-001-01-7	Broad Institute of MIT and Harvard	BRD-K89920769			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26+/m1/s1	DJGRJRLVSKCCNZ-KABRZNFWSA-N	596.275861164							102626
BRD-K68776823	LSM-12625		54632146	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18-/m1/s1	DDFPKKGQTCCPIA-HBUWYVDXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K68776823	BRD-K68776823-001-01-2	Broad Institute of MIT and Harvard	BRD-K68776823			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18-/m1/s1	DDFPKKGQTCCPIA-HBUWYVDXSA-N	413.198441812							101258
BRD-K73307873	LSM-12918		54632120	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21+/m1/s1	DHNAZJFKQHWVTC-XFQAVAEZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3F)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K73307873	BRD-K73307873-001-01-8	Broad Institute of MIT and Harvard	BRD-K73307873			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3F)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21+/m1/s1	DHNAZJFKQHWVTC-XFQAVAEZSA-N	479.18901998							101555
BRD-K38311495	LSM-10749		54632092	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20-,27+/m1/s1	NFEVTECKVPPYCJ-DVHCVUMVSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K38311495	BRD-K38311495-001-01-2	Broad Institute of MIT and Harvard	BRD-K38311495			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20-,27+/m1/s1	NFEVTECKVPPYCJ-DVHCVUMVSA-N	524.29987042							99370
BRD-K89833114	LSM-13968		54632131	InChI=1S/C30H37N5O4/c1-21-18-35(15-12-23-8-6-5-7-9-23)22(2)20-39-27-16-24(33-29(36)26-17-31-13-14-32-26)10-11-25(27)30(37)34(3)19-28(21)38-4/h5-11,13-14,16-17,21-22,28H,12,15,18-20H2,1-4H3,(H,33,36)/t21-,22-,28-/m0/s1	BQPYXUUVDOUQTE-VPYPWEPUSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(CCc4ccccc4)C[C@@H]1C	BroadT	BRD-K89833114	BRD-K89833114-001-01-4	Broad Institute of MIT and Harvard	BRD-K89833114			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(CCc2ccccc2)C[C@@H]1C	InChI=1S/C30H37N5O4/c1-21-18-35(15-12-23-8-6-5-7-9-23)22(2)20-39-27-16-24(33-29(36)26-17-31-13-14-32-26)10-11-25(27)30(37)34(3)19-28(21)38-4/h5-11,13-14,16-17,21-22,28H,12,15,18-20H2,1-4H3,(H,33,36)/t21-,22-,28-/m0/s1	BQPYXUUVDOUQTE-VPYPWEPUSA-N	531.284554714							102621
BRD-K47514459	LSM-11324		54632075	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18-,25+/m0/s1	ZVOSTPFCAQQCID-DPOKWSEZSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cc(F)ccc3F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K47514459	BRD-K47514459-001-01-4	Broad Institute of MIT and Harvard	BRD-K47514459			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cc(F)ccc3F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18-,25+/m0/s1	ZVOSTPFCAQQCID-DPOKWSEZSA-N	519.25447765							99945
BRD-K91720591	LSM-14061		54632089	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m1/s1	ZQFWKBSGTDYKBN-GGUMNFRJSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	BroadT	BRD-K91720591	BRD-K91720591-001-01-1	Broad Institute of MIT and Harvard	BRD-K91720591			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m1/s1	ZQFWKBSGTDYKBN-GGUMNFRJSA-N	530.25406308							102714
BRD-K14460076	LSM-9304		54632008	InChI=1S/C30H37N5O4/c1-21-18-35(15-12-23-8-6-5-7-9-23)22(2)20-39-27-16-24(33-29(36)26-17-31-13-14-32-26)10-11-25(27)30(37)34(3)19-28(21)38-4/h5-11,13-14,16-17,21-22,28H,12,15,18-20H2,1-4H3,(H,33,36)/t21-,22+,28-/m1/s1	BQPYXUUVDOUQTE-RZIGYZOXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K14460076	BRD-K14460076-001-01-2	Broad Institute of MIT and Harvard	BRD-K14460076			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C30H37N5O4/c1-21-18-35(15-12-23-8-6-5-7-9-23)22(2)20-39-27-16-24(33-29(36)26-17-31-13-14-32-26)10-11-25(27)30(37)34(3)19-28(21)38-4/h5-11,13-14,16-17,21-22,28H,12,15,18-20H2,1-4H3,(H,33,36)/t21-,22+,28-/m1/s1	BQPYXUUVDOUQTE-RZIGYZOXSA-N	531.284554714							97925
BRD-K72072435	LSM-12843		54632192	InChI=1S/C23H35F3N4O6S/c1-14(2)27-22(32)30-10-15(3)20(35-6)11-29(5)21(31)18-9-17(7-8-19(18)36-12-16(30)4)28-37(33,34)13-23(24,25)26/h7-9,14-16,20,28H,10-13H2,1-6H3,(H,27,32)/t15-,16-,20+/m1/s1	XOJAHRJNCMVABE-QINHECLXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K72072435	BRD-K72072435-001-01-0	Broad Institute of MIT and Harvard	BRD-K72072435			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C23H35F3N4O6S/c1-14(2)27-22(32)30-10-15(3)20(35-6)11-29(5)21(31)18-9-17(7-8-19(18)36-12-16(30)4)28-37(33,34)13-23(24,25)26/h7-9,14-16,20,28H,10-13H2,1-6H3,(H,27,32)/t15-,16-,20+/m1/s1	XOJAHRJNCMVABE-QINHECLXSA-N	552.22294017							101480
BRD-K87408386	LSM-13790		54631996	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19+,27+/m0/s1	KBKSWHGSXCIXAL-DSNGTPCMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)N(CC5CC5)C[C@@H]1C	BroadT	BRD-K87408386	BRD-K87408386-001-01-8	Broad Institute of MIT and Harvard	BRD-K87408386			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19+,27+/m0/s1	KBKSWHGSXCIXAL-DSNGTPCMSA-N	523.268235934							102439
BRD-K68118564	LSM-12579		54632104	InChI=1S/C27H34FN3O5/c1-6-25(32)29-21-11-12-22-23(13-21)36-16-18(3)31(26(33)19-7-9-20(28)10-8-19)14-17(2)24(35-5)15-30(4)27(22)34/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18-,24+/m0/s1	DLQPGZNWCDDUSB-LLJLJFOGSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccc(F)cc3	BroadT	BRD-K68118564	BRD-K68118564-001-01-0	Broad Institute of MIT and Harvard	BRD-K68118564			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccc(F)cc2)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-21-11-12-22-23(13-21)36-16-18(3)31(26(33)19-7-9-20(28)10-8-19)14-17(2)24(35-5)15-30(4)27(22)34/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18-,24+/m0/s1	DLQPGZNWCDDUSB-LLJLJFOGSA-N	499.248249418							101210
BRD-K21600166	LSM-9741		54632101	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16+,20+/m1/s1	ILRMXYQNFGXKSX-GUXCAODWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(Cc3nccs3)C[C@H]1C	BroadT	BRD-K21600166	BRD-K21600166-001-01-5	Broad Institute of MIT and Harvard	BRD-K21600166			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16+,20+/m1/s1	ILRMXYQNFGXKSX-GUXCAODWSA-N	496.181411544							98362
BRD-K86078446	LSM-13699		54632130	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24-/m1/s1	MJQDMCPXEXXQJL-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K86078446	BRD-K86078446-001-01-8	Broad Institute of MIT and Harvard	BRD-K86078446			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24-/m1/s1	MJQDMCPXEXXQJL-HOZJOUCCSA-N	485.232599354							102347
BRD-K52544910	LSM-11638		54631921	InChI=1S/C27H39N5O4/c1-18(2)29-27(34)30-21-10-11-23-24(13-21)36-17-20(4)32(15-22-9-7-8-12-28-22)14-19(3)25(35-6)16-31(5)26(23)33/h7-13,18-20,25H,14-17H2,1-6H3,(H2,29,30,34)/t19-,20+,25+/m0/s1	YDXYYDXTJISMJT-WZOHSFFVSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H]1C	BroadT	BRD-K52544910	BRD-K52544910-001-01-6	Broad Institute of MIT and Harvard	BRD-K52544910			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C27H39N5O4/c1-18(2)29-27(34)30-21-10-11-23-24(13-21)36-17-20(4)32(15-22-9-7-8-12-28-22)14-19(3)25(35-6)16-31(5)26(23)33/h7-13,18-20,25H,14-17H2,1-6H3,(H2,29,30,34)/t19-,20+,25+/m0/s1	YDXYYDXTJISMJT-WZOHSFFVSA-N	497.300204778							100263
BRD-K05543852	LSM-8756		54632148	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22+/m1/s1	ULFQVHHILZHREN-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K05543852	BRD-K05543852-001-01-6	Broad Institute of MIT and Harvard	BRD-K05543852			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22+/m1/s1	ULFQVHHILZHREN-VVBPWWLESA-N	443.22203467							97377
BRD-K68629330	LSM-12613		54631960	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25-/m0/s1	WQZORWGHLUMPIH-CEYNDMKZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K68629330	BRD-K68629330-001-01-9	Broad Institute of MIT and Harvard	BRD-K68629330			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25-/m0/s1	WQZORWGHLUMPIH-CEYNDMKZSA-N	487.304621442							101245
BRD-K02061388	LSM-8559		54631922	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18+,22+/m1/s1	RUFIKNIWNRYTLQ-FGSXEWAUSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K02061388	BRD-K02061388-001-01-5	Broad Institute of MIT and Harvard	BRD-K02061388			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18+,22+/m1/s1	RUFIKNIWNRYTLQ-FGSXEWAUSA-N	476.29987042							97180
BRD-K85259624	LSM-13644		54632036	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24-/m0/s1	ZQFWKBSGTDYKBN-RHGYRFJNSA-N	COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	BroadT	BRD-K85259624	BRD-K85259624-001-01-9	Broad Institute of MIT and Harvard	BRD-K85259624			COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24-/m0/s1	ZQFWKBSGTDYKBN-RHGYRFJNSA-N	530.25406308							102291
BRD-K71550516	LSM-12806		54632157	InChI=1S/C27H35FN4O5/c1-6-25(33)29-19-11-12-23-20(13-19)26(34)31(4)15-24(36-5)17(2)14-32(18(3)16-37-23)27(35)30-22-10-8-7-9-21(22)28/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)(H,30,35)/t17-,18-,24-/m1/s1	RUAQTZPJPSJOEM-QZTZHPFYSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)Nc3ccccc3F	BroadT	BRD-K71550516	BRD-K71550516-001-01-8	Broad Institute of MIT and Harvard	BRD-K71550516			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)Nc1ccccc1F	InChI=1S/C27H35FN4O5/c1-6-25(33)29-19-11-12-23-20(13-19)26(34)31(4)15-24(36-5)17(2)14-32(18(3)16-37-23)27(35)30-22-10-8-7-9-21(22)28/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,33)(H,30,35)/t17-,18-,24-/m1/s1	RUAQTZPJPSJOEM-QZTZHPFYSA-N	514.25914846							101443
BRD-K16942988	LSM-9453		54632079	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21+,26+/m0/s1	XLOJZIOISXYGBL-LZCXECNNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc3ccccc3)C[C@@H]1C	BroadT	BRD-K16942988	BRD-K16942988-001-01-4	Broad Institute of MIT and Harvard	BRD-K16942988			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc2ccccc2)C[C@@H]1C	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21+,26+/m0/s1	XLOJZIOISXYGBL-LZCXECNNSA-N	496.3049558							98074
BRD-K90898708	LSM-14024		54632176	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22-/m0/s1	ULFQVHHILZHREN-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K90898708	BRD-K90898708-001-01-6	Broad Institute of MIT and Harvard	BRD-K90898708			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22-/m0/s1	ULFQVHHILZHREN-WCJKSRRJSA-N	443.22203467							102677
BRD-K40724605	LSM-10916		54632012	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18+/m0/s1	DDFPKKGQTCCPIA-PMUMKWKESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K40724605	BRD-K40724605-001-01-9	Broad Institute of MIT and Harvard	BRD-K40724605			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18+/m0/s1	DDFPKKGQTCCPIA-PMUMKWKESA-N	413.198441812							99537
BRD-K16172779	LSM-9403		54631934	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17+,22+/m1/s1	WWIWLTDSUPVNED-JLHGSKIFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K16172779	BRD-K16172779-001-01-1	Broad Institute of MIT and Harvard	BRD-K16172779			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17+,22+/m1/s1	WWIWLTDSUPVNED-JLHGSKIFSA-N	431.278406694							98024
BRD-K59904884	LSM-12048		54632080	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22+/m0/s1	ULFQVHHILZHREN-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K59904884	BRD-K59904884-001-01-7	Broad Institute of MIT and Harvard	BRD-K59904884			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22+/m0/s1	ULFQVHHILZHREN-PONJGIIJSA-N	443.22203467							100674
MLS003650048	LSM-11574	BRD-K51381937, SID125305350	53382706	InChI=1S/C29H45N3O4/c1-20-16-32(17-22-9-6-5-7-10-22)21(2)19-36-26-15-24(30-28(33)23-11-8-12-23)13-14-25(26)29(34)31(3)18-27(20)35-4/h13-15,20-23,27H,5-12,16-19H2,1-4H3,(H,30,33)/t20-,21+,27-/m1/s1	ZYUAJIZJWFLNII-PBDKAQRYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(CC4CCCCC4)C[C@H]1C	BroadT	BRD-K51381937	BRD-K51381937-001-01-3	Broad Institute of MIT and Harvard	BRD-K51381937			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C29H45N3O4/c1-20-16-32(17-22-9-6-5-7-10-22)21(2)19-36-26-15-24(30-28(33)23-11-8-12-23)13-14-25(26)29(34)31(3)18-27(20)35-4/h13-15,20-23,27H,5-12,16-19H2,1-4H3,(H,30,33)/t20-,21+,27-/m1/s1	ZYUAJIZJWFLNII-PBDKAQRYSA-N	499.34100695							100197
BRD-K85588347	LSM-13660		54631951	InChI=1S/C25H38N4O5/c1-15(2)26-25(32)29-12-16(3)22(33-6)13-28(5)24(31)20-11-19(27-23(30)18-7-8-18)9-10-21(20)34-14-17(29)4/h9-11,15-18,22H,7-8,12-14H2,1-6H3,(H,26,32)(H,27,30)/t16-,17-,22-/m0/s1	CYXOTKWKLUXHGN-HOIFWPIMSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K85588347	BRD-K85588347-001-01-7	Broad Institute of MIT and Harvard	BRD-K85588347			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C25H38N4O5/c1-15(2)26-25(32)29-12-16(3)22(33-6)13-28(5)24(31)20-11-19(27-23(30)18-7-8-18)9-10-21(20)34-14-17(29)4/h9-11,15-18,22H,7-8,12-14H2,1-6H3,(H,26,32)(H,27,30)/t16-,17-,22-/m0/s1	CYXOTKWKLUXHGN-HOIFWPIMSA-N	474.284220356							102307
BRD-K52076988	LSM-11614		54632115	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16-,21-/m1/s1	DHNAZJFKQHWVTC-WHSLLNHNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3F)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K52076988	BRD-K52076988-001-01-6	Broad Institute of MIT and Harvard	BRD-K52076988			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3F)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16-,21-/m1/s1	DHNAZJFKQHWVTC-WHSLLNHNSA-N	479.18901998							100237
BRD-K31682048	LSM-10349		54632213	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m1/s1	PSXVKIUCJIMJLV-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(Cl)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K31682048	BRD-K31682048-001-01-5	Broad Institute of MIT and Harvard	BRD-K31682048			CO[C@@H]1CN(C)C(=O)c2ccc(cc2OC[C@H](C)NC[C@H]1C)NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m1/s1	PSXVKIUCJIMJLV-ZMPRRUGASA-N	495.15946949							98970
BRD-K53914164	LSM-11704		54631978	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18+,25+/m0/s1	ZVOSTPFCAQQCID-YYULODDRSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K53914164	BRD-K53914164-001-01-3	Broad Institute of MIT and Harvard	BRD-K53914164			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18+,25+/m0/s1	ZVOSTPFCAQQCID-YYULODDRSA-N	519.25447765							100329
BRD-K95896215	LSM-14309		54631948	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26+/m0/s1	DJGRJRLVSKCCNZ-CUAXAMRHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K95896215	BRD-K95896215-001-01-1	Broad Institute of MIT and Harvard	BRD-K95896215			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26+/m0/s1	DJGRJRLVSKCCNZ-CUAXAMRHSA-N	596.275861164							102963
BRD-K77402297	LSM-13160		54632112	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19-,27+/m1/s1	KBKSWHGSXCIXAL-KFDHSVMUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)N(CC5CC5)C[C@H]1C	BroadT	BRD-K77402297	BRD-K77402297-001-01-1	Broad Institute of MIT and Harvard	BRD-K77402297			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19-,27+/m1/s1	KBKSWHGSXCIXAL-KFDHSVMUSA-N	523.268235934							101798
BRD-K83426111	LSM-13529		54631985	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	ITUDOLAPOXZKHG-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K83426111	BRD-K83426111-001-01-6	Broad Institute of MIT and Harvard	BRD-K83426111			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	ITUDOLAPOXZKHG-BSRJHKFKSA-N	475.214091876							102171
BRD-K32916048	LSM-10429		54631988	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17-,22+/m1/s1	WWIWLTDSUPVNED-YVHKJVDXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K32916048	BRD-K32916048-001-01-6	Broad Institute of MIT and Harvard	BRD-K32916048			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17-,22+/m1/s1	WWIWLTDSUPVNED-YVHKJVDXSA-N	431.278406694							99050
BRD-K45115014	LSM-11173		54631957	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24+/m1/s1	ZQFWKBSGTDYKBN-YTZAWJCFSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K45115014	BRD-K45115014-001-01-0	Broad Institute of MIT and Harvard	BRD-K45115014			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18+,24+/m1/s1	ZQFWKBSGTDYKBN-YTZAWJCFSA-N	530.25406308							99794
BRD-K83397037-001-01-0	LSM-13526	BRD-K83397037	54631931	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	BTAIGOZCFZRKBT-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K83397037	BRD-K83397037-001-01-0	Broad Institute of MIT and Harvard	BRD-K83397037			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	BTAIGOZCFZRKBT-ZMPRRUGASA-N	458.232933712							102168
BRD-K96989541	LSM-14384		54632175	InChI=1S/C27H39N5O4/c1-18(2)29-27(34)30-21-10-11-23-24(13-21)36-17-20(4)32(15-22-9-7-8-12-28-22)14-19(3)25(35-6)16-31(5)26(23)33/h7-13,18-20,25H,14-17H2,1-6H3,(H2,29,30,34)/t19-,20+,25+/m1/s1	YDXYYDXTJISMJT-RNHFSVANSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(Cc3ccccn3)C[C@H]1C	BroadT	BRD-K96989541	BRD-K96989541-001-01-8	Broad Institute of MIT and Harvard	BRD-K96989541			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C27H39N5O4/c1-18(2)29-27(34)30-21-10-11-23-24(13-21)36-17-20(4)32(15-22-9-7-8-12-28-22)14-19(3)25(35-6)16-31(5)26(23)33/h7-13,18-20,25H,14-17H2,1-6H3,(H2,29,30,34)/t19-,20+,25+/m1/s1	YDXYYDXTJISMJT-RNHFSVANSA-N	497.300204778							103038
BRD-K64497523	LSM-12365		54632207	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19-,27-/m1/s1	KBKSWHGSXCIXAL-DRGJWEBESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)N(CC5CC5)C[C@H]1C	BroadT	BRD-K64497523	BRD-K64497523-001-01-2	Broad Institute of MIT and Harvard	BRD-K64497523			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19-,27-/m1/s1	KBKSWHGSXCIXAL-DRGJWEBESA-N	523.268235934							100992
BRD-K47724900	LSM-11336		54632025	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25-/m0/s1	BEBQDKOSRNKXPA-ATLLOTDBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3ccccc3F)C[C@@H]1C	BroadT	BRD-K47724900	BRD-K47724900-001-01-4	Broad Institute of MIT and Harvard	BRD-K47724900			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2ccccc2F)C[C@@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25-/m0/s1	BEBQDKOSRNKXPA-ATLLOTDBSA-N	471.253334798							99957
BRD-K82824976	LSM-13489		54631993	InChI=1S/C23H35F3N4O6S/c1-14(2)27-22(32)30-10-15(3)20(35-6)11-29(5)21(31)18-9-17(7-8-19(18)36-12-16(30)4)28-37(33,34)13-23(24,25)26/h7-9,14-16,20,28H,10-13H2,1-6H3,(H,27,32)/t15-,16+,20+/m1/s1	XOJAHRJNCMVABE-GUXCAODWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K82824976	BRD-K82824976-001-01-7	Broad Institute of MIT and Harvard	BRD-K82824976			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C23H35F3N4O6S/c1-14(2)27-22(32)30-10-15(3)20(35-6)11-29(5)21(31)18-9-17(7-8-19(18)36-12-16(30)4)28-37(33,34)13-23(24,25)26/h7-9,14-16,20,28H,10-13H2,1-6H3,(H,27,32)/t15-,16+,20+/m1/s1	XOJAHRJNCMVABE-GUXCAODWSA-N	552.22294017							102129
BRD-K75867134	LSM-13068		54632067	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16-,20-/m0/s1	ILRMXYQNFGXKSX-FTRWYGJKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(Cc3nccs3)C[C@@H]1C	BroadT	BRD-K75867134	BRD-K75867134-001-01-4	Broad Institute of MIT and Harvard	BRD-K75867134			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16-,20-/m0/s1	ILRMXYQNFGXKSX-FTRWYGJKSA-N	496.181411544							101705
BRD-K50984462	LSM-11540		54632116	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22-/m0/s1	ULFQVHHILZHREN-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K50984462	BRD-K50984462-001-01-8	Broad Institute of MIT and Harvard	BRD-K50984462			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22-/m0/s1	ULFQVHHILZHREN-DMPWYTOCSA-N	443.22203467							100163
BRD-K93105623	LSM-14138		54632033	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22-/m0/s1	KJNJKXAQFIYZGQ-DFFLPILJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K93105623	BRD-K93105623-001-01-5	Broad Institute of MIT and Harvard	BRD-K93105623			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22-/m0/s1	KJNJKXAQFIYZGQ-DFFLPILJSA-N	476.22351188							102792
BRD-K12988428	LSM-9203		54632011	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16-,21+/m0/s1	DHNAZJFKQHWVTC-CKJXQJPGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3F)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K12988428	BRD-K12988428-001-01-9	Broad Institute of MIT and Harvard	BRD-K12988428			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3F)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16-,21+/m0/s1	DHNAZJFKQHWVTC-CKJXQJPGSA-N	479.18901998							97824
BRD-K36054906	LSM-10599		54632106	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19-,25-/m0/s1	BBRWISDMGXAAHU-MHPIHPPYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K36054906	BRD-K36054906-001-01-3	Broad Institute of MIT and Harvard	BRD-K36054906			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19-,25-/m0/s1	BBRWISDMGXAAHU-MHPIHPPYSA-N	481.25767125							99220
BRD-K05432839	LSM-8748		54632132	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19+,25+/m0/s1	MFGGAADVNSTJDM-OSWQYVSFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC4CC4	BroadT	BRD-K05432839	BRD-K05432839-001-01-0	Broad Institute of MIT and Harvard	BRD-K05432839			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19+,25+/m0/s1	MFGGAADVNSTJDM-OSWQYVSFSA-N	499.304621442							97369
BRD-K73478880	LSM-12929		54632178	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17-,22+/m0/s1	WWIWLTDSUPVNED-PNLZDCPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K73478880	BRD-K73478880-001-01-8	Broad Institute of MIT and Harvard	BRD-K73478880			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17-,22+/m0/s1	WWIWLTDSUPVNED-PNLZDCPESA-N	431.278406694							101566
BRD-K99880843	LSM-14565		54632056	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16+,20-/m1/s1	ILRMXYQNFGXKSX-GQIGUUNPSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(Cc3nccs3)C[C@H]1C	BroadT	BRD-K99880843	BRD-K99880843-001-01-1	Broad Institute of MIT and Harvard	BRD-K99880843			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16+,20-/m1/s1	ILRMXYQNFGXKSX-GQIGUUNPSA-N	496.181411544							103221
BRD-K21094215	LSM-9712		54632183	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25+/m1/s1	WQZORWGHLUMPIH-WYEJZRMESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K21094215	BRD-K21094215-001-01-2	Broad Institute of MIT and Harvard	BRD-K21094215			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25+/m1/s1	WQZORWGHLUMPIH-WYEJZRMESA-N	487.304621442							98333
BRD-K39738296	LSM-10848		54632153	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19+,27+/m1/s1	KBKSWHGSXCIXAL-RYTUXRKISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)N(CC5CC5)C[C@H]1C	BroadT	BRD-K39738296	BRD-K39738296-001-01-6	Broad Institute of MIT and Harvard	BRD-K39738296			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19+,27+/m1/s1	KBKSWHGSXCIXAL-RYTUXRKISA-N	523.268235934							99469
BRD-K08006444	LSM-8912		54631940	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19-,24+/m0/s1	OTFQVXLKCTXKNS-AXHZCLLHSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K08006444	BRD-K08006444-001-01-6	Broad Institute of MIT and Harvard	BRD-K08006444			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19-,24+/m0/s1	OTFQVXLKCTXKNS-AXHZCLLHSA-N	481.25767125							97533
BRD-K72051249	LSM-12841		54632072	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18-/m0/s1	DDFPKKGQTCCPIA-DEYYWGMASA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K72051249	BRD-K72051249-001-01-0	Broad Institute of MIT and Harvard	BRD-K72051249			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18-/m0/s1	DDFPKKGQTCCPIA-DEYYWGMASA-N	413.198441812							101478
BRD-K17491544	LSM-9478		54632049	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21+,28+/m1/s1	XXZJPGUPXRETOH-GGJMMHKRSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K17491544	BRD-K17491544-001-01-8	Broad Institute of MIT and Harvard	BRD-K17491544			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21+,28+/m1/s1	XXZJPGUPXRETOH-GGJMMHKRSA-N	598.22613377							98099
CHEMBL2354617	LSM-12867	BRD-K72360839, SID131428178	54631935	InChI=1S/C27H34FN3O5/c1-6-25(32)29-21-11-12-22-23(13-21)36-16-18(3)31(26(33)19-7-9-20(28)10-8-19)14-17(2)24(35-5)15-30(4)27(22)34/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24+/m1/s1	DLQPGZNWCDDUSB-YTZAWJCFSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccc(F)cc3	BroadT	BRD-K72360839	BRD-K72360839-001-01-1	Broad Institute of MIT and Harvard	BRD-K72360839			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccc(F)cc2)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-21-11-12-22-23(13-21)36-16-18(3)31(26(33)19-7-9-20(28)10-8-19)14-17(2)24(35-5)15-30(4)27(22)34/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24+/m1/s1	DLQPGZNWCDDUSB-YTZAWJCFSA-N	499.248249418							101504
BRD-K39701065	LSM-10845		54632224	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19+,25-/m0/s1	BBRWISDMGXAAHU-CEYNDMKZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K39701065	BRD-K39701065-001-01-3	Broad Institute of MIT and Harvard	BRD-K39701065			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19+,25-/m0/s1	BBRWISDMGXAAHU-CEYNDMKZSA-N	481.25767125							99466
BRD-K64440942	LSM-12362		54632032	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19-,25+/m1/s1	MFGGAADVNSTJDM-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC4CC4	BroadT	BRD-K64440942	BRD-K64440942-001-01-5	Broad Institute of MIT and Harvard	BRD-K64440942			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C28H41N3O5/c1-18-15-31(26(32)13-20-9-10-20)19(2)17-36-24-14-22(29-27(33)21-7-5-6-8-21)11-12-23(24)28(34)30(3)16-25(18)35-4/h11-12,14,18-21,25H,5-10,13,15-17H2,1-4H3,(H,29,33)/t18-,19-,25+/m1/s1	MFGGAADVNSTJDM-RRQZXNHTSA-N	499.304621442							100989
BRD-K80412673	LSM-13347		54631967	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19-,27+/m0/s1	KBKSWHGSXCIXAL-RWYJCYHVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)N(CC5CC5)C[C@@H]1C	BroadT	BRD-K80412673	BRD-K80412673-001-01-9	Broad Institute of MIT and Harvard	BRD-K80412673			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19-,27+/m0/s1	KBKSWHGSXCIXAL-RWYJCYHVSA-N	523.268235934							101986
BRD-K26663582	LSM-10046		54632122	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19+,25-/m0/s1	RHXUULWZVSTJED-CEYNDMKZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc4ccncc4)C[C@@H]1C	BroadT	BRD-K26663582	BRD-K26663582-001-01-4	Broad Institute of MIT and Harvard	BRD-K26663582			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19+,25-/m0/s1	RHXUULWZVSTJED-CEYNDMKZSA-N	480.273655672							98667
BRD-K05261220-001-01-0	LSM-8740	BRD-K05261220	54632128	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	BTAIGOZCFZRKBT-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K05261220	BRD-K05261220-001-01-0	Broad Institute of MIT and Harvard	BRD-K05261220			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	BTAIGOZCFZRKBT-VVBPWWLESA-N	458.232933712							97361
BRD-K43188042	LSM-11052		54632028	InChI=1S/C23H35F3N4O6S/c1-14(2)27-22(32)30-10-15(3)20(35-6)11-29(5)21(31)18-9-17(7-8-19(18)36-12-16(30)4)28-37(33,34)13-23(24,25)26/h7-9,14-16,20,28H,10-13H2,1-6H3,(H,27,32)/t15-,16+,20+/m0/s1	XOJAHRJNCMVABE-RZQQEMMASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K43188042	BRD-K43188042-001-01-5	Broad Institute of MIT and Harvard	BRD-K43188042			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C23H35F3N4O6S/c1-14(2)27-22(32)30-10-15(3)20(35-6)11-29(5)21(31)18-9-17(7-8-19(18)36-12-16(30)4)28-37(33,34)13-23(24,25)26/h7-9,14-16,20,28H,10-13H2,1-6H3,(H,27,32)/t15-,16+,20+/m0/s1	XOJAHRJNCMVABE-RZQQEMMASA-N	552.22294017							99673
BRD-K38493271	LSM-10757		54632076	InChI=1S/C27H39N5O4/c1-18(2)29-27(34)30-21-10-11-23-24(13-21)36-17-20(4)32(15-22-9-7-8-12-28-22)14-19(3)25(35-6)16-31(5)26(23)33/h7-13,18-20,25H,14-17H2,1-6H3,(H2,29,30,34)/t19-,20+,25-/m0/s1	YDXYYDXTJISMJT-DFIYOIEZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H]1C	BroadT	BRD-K38493271	BRD-K38493271-001-01-8	Broad Institute of MIT and Harvard	BRD-K38493271			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C27H39N5O4/c1-18(2)29-27(34)30-21-10-11-23-24(13-21)36-17-20(4)32(15-22-9-7-8-12-28-22)14-19(3)25(35-6)16-31(5)26(23)33/h7-13,18-20,25H,14-17H2,1-6H3,(H2,29,30,34)/t19-,20+,25-/m0/s1	YDXYYDXTJISMJT-DFIYOIEZSA-N	497.300204778							99378
BRD-K61968247	LSM-12187		54632093	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	WJKSFTDVZIMVMK-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K61968247	BRD-K61968247-001-01-0	Broad Institute of MIT and Harvard	BRD-K61968247			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	WJKSFTDVZIMVMK-PONJGIIJSA-N	474.203383222							100813
BRD-K36415399	LSM-10625		54632165	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26-/m0/s1	DJGRJRLVSKCCNZ-DFXHWTJYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K36415399	BRD-K36415399-001-01-0	Broad Institute of MIT and Harvard	BRD-K36415399			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26-/m0/s1	DJGRJRLVSKCCNZ-DFXHWTJYSA-N	596.275861164							99246
BRD-K51179640	LSM-11557		54632177	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21-,26-/m1/s1	XLOJZIOISXYGBL-IPVFLDMMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc3ccccc3)C[C@H]1C	BroadT	BRD-K51179640	BRD-K51179640-001-01-9	Broad Institute of MIT and Harvard	BRD-K51179640			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(Cc2ccccc2)C[C@H]1C	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21-,26-/m1/s1	XLOJZIOISXYGBL-IPVFLDMMSA-N	496.3049558							100180
BRD-K15028327	LSM-9331		54632098	InChI=1S/C24H32F3N5O6S/c1-15-10-32(39(35,36)22-12-30(3)14-28-22)16(2)13-38-19-8-17(29-21(33)9-24(25,26)27)6-7-18(19)23(34)31(4)11-20(15)37-5/h6-8,12,14-16,20H,9-11,13H2,1-5H3,(H,29,33)/t15-,16+,20+/m1/s1	ZYJJQNOXPHIYRR-GUXCAODWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)CC(F)(F)F)cc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K15028327	BRD-K15028327-001-01-3	Broad Institute of MIT and Harvard	BRD-K15028327			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)CC(F)(F)F)cc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)c1cn(C)cn1	InChI=1S/C24H32F3N5O6S/c1-15-10-32(39(35,36)22-12-30(3)14-28-22)16(2)13-38-19-8-17(29-21(33)9-24(25,26)27)6-7-18(19)23(34)31(4)11-20(15)37-5/h6-8,12,14-16,20H,9-11,13H2,1-5H3,(H,29,33)/t15-,16+,20+/m1/s1	ZYJJQNOXPHIYRR-GUXCAODWSA-N	575.202539084							97952
BRD-K72464155	LSM-12876		54632230	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17-,24+/m1/s1	BVCIWUWSCCLIPT-OJLQRUNKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K72464155	BRD-K72464155-001-01-7	Broad Institute of MIT and Harvard	BRD-K72464155			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17-,24+/m1/s1	BVCIWUWSCCLIPT-OJLQRUNKSA-N	513.295119398							101513
BRD-K71841447	LSM-12829		54632041	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16+,21-/m1/s1	LPOPNFSKLDAMKV-VWKPWSFCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K71841447	BRD-K71841447-001-01-5	Broad Institute of MIT and Harvard	BRD-K71841447			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16+,21-/m1/s1	LPOPNFSKLDAMKV-VWKPWSFCSA-N	485.250141198							101466
BRD-K35089608	LSM-10540		54632005	InChI=1S/C25H38N4O5/c1-15(2)26-25(32)29-12-16(3)22(33-6)13-28(5)24(31)20-11-19(27-23(30)18-7-8-18)9-10-21(20)34-14-17(29)4/h9-11,15-18,22H,7-8,12-14H2,1-6H3,(H,26,32)(H,27,30)/t16-,17+,22+/m0/s1	CYXOTKWKLUXHGN-GSHUGGBRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K35089608	BRD-K35089608-001-01-1	Broad Institute of MIT and Harvard	BRD-K35089608			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C25H38N4O5/c1-15(2)26-25(32)29-12-16(3)22(33-6)13-28(5)24(31)20-11-19(27-23(30)18-7-8-18)9-10-21(20)34-14-17(29)4/h9-11,15-18,22H,7-8,12-14H2,1-6H3,(H,26,32)(H,27,30)/t16-,17+,22+/m0/s1	CYXOTKWKLUXHGN-GSHUGGBRSA-N	474.284220356							99161
BRD-K70068422	LSM-12706		54632034	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24+/m0/s1	MJQDMCPXEXXQJL-OBWXTZQISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K70068422	BRD-K70068422-001-01-5	Broad Institute of MIT and Harvard	BRD-K70068422			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24+/m0/s1	MJQDMCPXEXXQJL-OBWXTZQISA-N	485.232599354							101341
BRD-K28336972	LSM-10143		54632086	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19+,27-/m0/s1	KBKSWHGSXCIXAL-CUMRGQLISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)N(CC5CC5)C[C@@H]1C	BroadT	BRD-K28336972	BRD-K28336972-001-01-3	Broad Institute of MIT and Harvard	BRD-K28336972			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19+,27-/m0/s1	KBKSWHGSXCIXAL-CUMRGQLISA-N	523.268235934							98764
BRD-K74260403	LSM-12975		54631918	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18+/m0/s1	DDFPKKGQTCCPIA-SUNYJGFJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K74260403	BRD-K74260403-001-01-7	Broad Institute of MIT and Harvard	BRD-K74260403			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18+/m0/s1	DDFPKKGQTCCPIA-SUNYJGFJSA-N	413.198441812							101612
BRD-K00346458	LSM-8446		54631998	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21+/m1/s1	AOOMHDUDPOWWMY-WWMYMODYSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)NC(C)C	BroadT	BRD-K00346458	BRD-K00346458-001-01-7	Broad Institute of MIT and Harvard	BRD-K00346458			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)NC(C)C)c1	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21+/m1/s1	AOOMHDUDPOWWMY-WWMYMODYSA-N	478.279134976							97067
BRD-K48114548	LSM-11359		54632001	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19-,25+/m0/s1	BBRWISDMGXAAHU-XHNVNVPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K48114548	BRD-K48114548-001-01-5	Broad Institute of MIT and Harvard	BRD-K48114548			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19-,25+/m0/s1	BBRWISDMGXAAHU-XHNVNVPESA-N	481.25767125							99980
BRD-K91188527	LSM-14037		54631923	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21-,28+/m0/s1	XXZJPGUPXRETOH-YHGPEZAFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K91188527	BRD-K91188527-001-01-0	Broad Institute of MIT and Harvard	BRD-K91188527			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc1cccnc1	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21-,28+/m0/s1	XXZJPGUPXRETOH-YHGPEZAFSA-N	598.22613377							102690
BRD-K52880714	LSM-11654		54631929	InChI=1S/C27H36N4O5/c1-6-8-25(32)29-21-10-11-22-23(13-21)36-17-19(3)31(26(33)20-9-7-12-28-14-20)15-18(2)24(35-5)16-30(4)27(22)34/h7,9-14,18-19,24H,6,8,15-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m1/s1	IERCBNABLGDWRK-YDIMBITNSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3cccnc3	BroadT	BRD-K52880714	BRD-K52880714-001-01-2	Broad Institute of MIT and Harvard	BRD-K52880714			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2cccnc2)c1	InChI=1S/C27H36N4O5/c1-6-8-25(32)29-21-10-11-22-23(13-21)36-17-19(3)31(26(33)20-9-7-12-28-14-20)15-18(2)24(35-5)16-30(4)27(22)34/h7,9-14,18-19,24H,6,8,15-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m1/s1	IERCBNABLGDWRK-YDIMBITNSA-N	496.268570292							100279
BRD-K65750227	LSM-12435		54632078	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16-,21+/m1/s1	LPOPNFSKLDAMKV-ZOCZFRKYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K65750227	BRD-K65750227-001-01-2	Broad Institute of MIT and Harvard	BRD-K65750227			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16-,21+/m1/s1	LPOPNFSKLDAMKV-ZOCZFRKYSA-N	485.250141198							101062
BRD-K61344432	LSM-12144		54632218	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19-,25+/m0/s1	RHXUULWZVSTJED-XHNVNVPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc4ccncc4)C[C@@H]1C	BroadT	BRD-K61344432	BRD-K61344432-001-01-9	Broad Institute of MIT and Harvard	BRD-K61344432			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19-,25+/m0/s1	RHXUULWZVSTJED-XHNVNVPESA-N	480.273655672							100770
BRD-K13648511-001-01-6	LSM-9250	BRD-K13648511	54632151	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21-,26-/m0/s1	XLOJZIOISXYGBL-WOVHNISZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc3ccccc3)C[C@@H]1C	BroadT	BRD-K13648511	BRD-K13648511-001-01-6	Broad Institute of MIT and Harvard	BRD-K13648511			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc2ccccc2)C[C@@H]1C	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21-,26-/m0/s1	XLOJZIOISXYGBL-WOVHNISZSA-N	496.3049558							97871
BRD-K77629773	LSM-13173		54632190	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26-/m1/s1	DJGRJRLVSKCCNZ-FIAZIHOUSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K77629773	BRD-K77629773-001-01-2	Broad Institute of MIT and Harvard	BRD-K77629773			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18+,26-/m1/s1	DJGRJRLVSKCCNZ-FIAZIHOUSA-N	596.275861164							101811
BRD-K07424227	LSM-8865		54632074	InChI=1S/C27H39N5O4/c1-18(2)29-27(34)30-21-10-11-23-24(13-21)36-17-20(4)32(15-22-9-7-8-12-28-22)14-19(3)25(35-6)16-31(5)26(23)33/h7-13,18-20,25H,14-17H2,1-6H3,(H2,29,30,34)/t19-,20-,25+/m0/s1	YDXYYDXTJISMJT-ZYLNGJIFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(Cc3ccccn3)C[C@@H]1C	BroadT	BRD-K07424227	BRD-K07424227-001-01-5	Broad Institute of MIT and Harvard	BRD-K07424227			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C27H39N5O4/c1-18(2)29-27(34)30-21-10-11-23-24(13-21)36-17-20(4)32(15-22-9-7-8-12-28-22)14-19(3)25(35-6)16-31(5)26(23)33/h7-13,18-20,25H,14-17H2,1-6H3,(H2,29,30,34)/t19-,20-,25+/m0/s1	YDXYYDXTJISMJT-ZYLNGJIFSA-N	497.300204778							97486
BRD-K40260510	LSM-10885		54632117	InChI=1S/C27H36N4O5/c1-6-8-25(32)29-21-10-11-22-23(13-21)36-17-19(3)31(26(33)20-9-7-12-28-14-20)15-18(2)24(35-5)16-30(4)27(22)34/h7,9-14,18-19,24H,6,8,15-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m1/s1	IERCBNABLGDWRK-KHCICDEESA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3cccnc3	BroadT	BRD-K40260510	BRD-K40260510-001-01-8	Broad Institute of MIT and Harvard	BRD-K40260510			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2cccnc2)c1	InChI=1S/C27H36N4O5/c1-6-8-25(32)29-21-10-11-22-23(13-21)36-17-19(3)31(26(33)20-9-7-12-28-14-20)15-18(2)24(35-5)16-30(4)27(22)34/h7,9-14,18-19,24H,6,8,15-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m1/s1	IERCBNABLGDWRK-KHCICDEESA-N	496.268570292							99506
BRD-K40240180	LSM-10884		54632210	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19-,23+/m0/s1	VMCYUUKPCWGJCJ-SFYKDHMMSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K40240180	BRD-K40240180-001-01-9	Broad Institute of MIT and Harvard	BRD-K40240180			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19-,23+/m0/s1	VMCYUUKPCWGJCJ-SFYKDHMMSA-N	489.22974194							99505
BRD-K13835847	LSM-9265		54632085	InChI=1S/C25H38N4O5/c1-15(2)26-25(32)29-12-16(3)22(33-6)13-28(5)24(31)20-11-19(27-23(30)18-7-8-18)9-10-21(20)34-14-17(29)4/h9-11,15-18,22H,7-8,12-14H2,1-6H3,(H,26,32)(H,27,30)/t16-,17+,22-/m0/s1	CYXOTKWKLUXHGN-JKSBSHDWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K13835847	BRD-K13835847-001-01-4	Broad Institute of MIT and Harvard	BRD-K13835847			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C25H38N4O5/c1-15(2)26-25(32)29-12-16(3)22(33-6)13-28(5)24(31)20-11-19(27-23(30)18-7-8-18)9-10-21(20)34-14-17(29)4/h9-11,15-18,22H,7-8,12-14H2,1-6H3,(H,26,32)(H,27,30)/t16-,17+,22-/m0/s1	CYXOTKWKLUXHGN-JKSBSHDWSA-N	474.284220356							97886
BRD-K68320080	LSM-12594		54632007	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17+,24-/m0/s1	BVCIWUWSCCLIPT-SRGWNRLKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K68320080	BRD-K68320080-001-01-7	Broad Institute of MIT and Harvard	BRD-K68320080			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17+,24-/m0/s1	BVCIWUWSCCLIPT-SRGWNRLKSA-N	513.295119398							101226
BRD-K88085458	LSM-13837		54631925	InChI=1S/C28H37FN4O4/c1-18-14-33(15-20-9-10-20)19(2)17-37-25-13-21(30-28(35)31-24-8-6-5-7-23(24)29)11-12-22(25)27(34)32(3)16-26(18)36-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H2,30,31,35)/t18-,19-,26-/m1/s1	SXLNUQFFJOVPKX-LJKQEARRSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K88085458	BRD-K88085458-001-01-6	Broad Institute of MIT and Harvard	BRD-K88085458			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H37FN4O4/c1-18-14-33(15-20-9-10-20)19(2)17-37-25-13-21(30-28(35)31-24-8-6-5-7-23(24)29)11-12-22(25)27(34)32(3)16-26(18)36-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H2,30,31,35)/t18-,19-,26-/m1/s1	SXLNUQFFJOVPKX-LJKQEARRSA-N	512.279883904							102488
BRD-K18384660	LSM-9535		54631953	InChI=1S/C21H28N4O5/c1-13-10-22-14(2)12-29-18-9-15(24-20(26)17-7-8-23-30-17)5-6-16(18)21(27)25(3)11-19(13)28-4/h5-9,13-14,19,22H,10-12H2,1-4H3,(H,24,26)/t13-,14-,19+/m0/s1	UYCGUZMTEQILNL-CKFHNAJUSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3oncc3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K18384660	BRD-K18384660-001-01-2	Broad Institute of MIT and Harvard	BRD-K18384660			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccno3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C21H28N4O5/c1-13-10-22-14(2)12-29-18-9-15(24-20(26)17-7-8-23-30-17)5-6-16(18)21(27)25(3)11-19(13)28-4/h5-9,13-14,19,22H,10-12H2,1-4H3,(H,24,26)/t13-,14-,19+/m0/s1	UYCGUZMTEQILNL-CKFHNAJUSA-N	416.205970036							98156
BRD-K63651474	LSM-12306		54632068	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21+,28-/m1/s1	XXZJPGUPXRETOH-PHVLTXCSSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K63651474	BRD-K63651474-001-01-4	Broad Institute of MIT and Harvard	BRD-K63651474			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21+,28-/m1/s1	XXZJPGUPXRETOH-PHVLTXCSSA-N	598.22613377							100933
BRD-K83201330-001-01-8	LSM-22602	BRD-K83201330	54631938	InChI=1S/C29H37N3O6/c1-18-15-32(28(34)21-6-7-21)19(2)17-38-25-13-10-22(14-24(25)29(35)31(3)16-26(18)37-5)30-27(33)20-8-11-23(36-4)12-9-20/h8-14,18-19,21,26H,6-7,15-17H2,1-5H3,(H,30,33)/t18-,19-,26-/m1/s1	VQKRXYOATRZMGV-LJKQEARRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K83201330	BRD-K83201330-001-01-8	Broad Institute of MIT and Harvard	BRD-K83201330			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C29H37N3O6/c1-18-15-32(28(34)21-6-7-21)19(2)17-38-25-13-10-22(14-24(25)29(35)31(3)16-26(18)37-5)30-27(33)20-8-11-23(36-4)12-9-20/h8-14,18-19,21,26H,6-7,15-17H2,1-5H3,(H,30,33)/t18-,19-,26-/m1/s1	VQKRXYOATRZMGV-LJKQEARRSA-N	523.268235934							111159
BRD-K01317665	LSM-8515		54632193	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17-,21+/m1/s1	AOOMHDUDPOWWMY-LZJOCLMNSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)NC(C)C	BroadT	BRD-K01317665	BRD-K01317665-001-01-6	Broad Institute of MIT and Harvard	BRD-K01317665			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)NC(C)C)c1	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17-,21+/m1/s1	AOOMHDUDPOWWMY-LZJOCLMNSA-N	478.279134976							97136
BRD-K49810938	LSM-11454		54631924	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m1/s1	DDFPKKGQTCCPIA-QWQRMKEZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K49810938	BRD-K49810938-001-01-5	Broad Institute of MIT and Harvard	BRD-K49810938			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m1/s1	DDFPKKGQTCCPIA-QWQRMKEZSA-N	413.198441812							100075
BRD-K16158586	LSM-9402		54632110	InChI=1S/C28H37FN4O4/c1-18-14-33(15-20-9-10-20)19(2)17-37-25-13-21(30-28(35)31-24-8-6-5-7-23(24)29)11-12-22(25)27(34)32(3)16-26(18)36-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H2,30,31,35)/t18-,19-,26+/m1/s1	SXLNUQFFJOVPKX-UDCNLSRBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K16158586	BRD-K16158586-001-01-3	Broad Institute of MIT and Harvard	BRD-K16158586			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H37FN4O4/c1-18-14-33(15-20-9-10-20)19(2)17-37-25-13-21(30-28(35)31-24-8-6-5-7-23(24)29)11-12-22(25)27(34)32(3)16-26(18)36-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H2,30,31,35)/t18-,19-,26+/m1/s1	SXLNUQFFJOVPKX-UDCNLSRBSA-N	512.279883904							98023
BRD-K59472190	LSM-12024		54631936	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24+/m1/s1	MJQDMCPXEXXQJL-KCYKTTMJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K59472190	BRD-K59472190-001-01-4	Broad Institute of MIT and Harvard	BRD-K59472190			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24+/m1/s1	MJQDMCPXEXXQJL-KCYKTTMJSA-N	485.232599354							100650
BRD-K81545342	LSM-13406		54632141	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	ITUDOLAPOXZKHG-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K81545342	BRD-K81545342-001-01-6	Broad Institute of MIT and Harvard	BRD-K81545342			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	ITUDOLAPOXZKHG-IXFSTUDKSA-N	475.214091876							102046
BRD-K71505729	LSM-12800		54632149	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16+,20-/m0/s1	ILRMXYQNFGXKSX-YRNRMSPPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3nccs3)C[C@@H]1C	BroadT	BRD-K71505729	BRD-K71505729-001-01-5	Broad Institute of MIT and Harvard	BRD-K71505729			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16+,20-/m0/s1	ILRMXYQNFGXKSX-YRNRMSPPSA-N	496.181411544							101437
BRD-K47078472	LSM-11303		54632127	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18-,23+/m1/s1	ITUDOLAPOXZKHG-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K47078472	BRD-K47078472-001-01-3	Broad Institute of MIT and Harvard	BRD-K47078472			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18-,23+/m1/s1	ITUDOLAPOXZKHG-PNCHPQGNSA-N	475.214091876							99924
BRD-K98135954	LSM-14462		54632070	InChI=1S/C21H28N4O5/c1-13-10-22-14(2)12-29-18-9-15(24-20(26)17-7-8-23-30-17)5-6-16(18)21(27)25(3)11-19(13)28-4/h5-9,13-14,19,22H,10-12H2,1-4H3,(H,24,26)/t13-,14-,19-/m0/s1	UYCGUZMTEQILNL-NJSLBKSFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3oncc3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K98135954	BRD-K98135954-001-01-6	Broad Institute of MIT and Harvard	BRD-K98135954			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccno3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C21H28N4O5/c1-13-10-22-14(2)12-29-18-9-15(24-20(26)17-7-8-23-30-17)5-6-16(18)21(27)25(3)11-19(13)28-4/h5-9,13-14,19,22H,10-12H2,1-4H3,(H,24,26)/t13-,14-,19-/m0/s1	UYCGUZMTEQILNL-NJSLBKSFSA-N	416.205970036							103117
BRD-K94766424	LSM-14239		54632090	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19-/m0/s1	FSHWRMSUZBSSQF-KHYOSLBOSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K94766424	BRD-K94766424-001-01-4	Broad Institute of MIT and Harvard	BRD-K94766424			CCCNC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19-/m0/s1	FSHWRMSUZBSSQF-KHYOSLBOSA-N	406.258005608							102893
MLS003650064	LSM-8640	BRD-K03301842, SID125305360	53382716	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m0/s1	ZQFWKBSGTDYKBN-LLJLJFOGSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K03301842	BRD-K03301842-001-01-4	Broad Institute of MIT and Harvard	BRD-K03301842			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24+/m0/s1	ZQFWKBSGTDYKBN-LLJLJFOGSA-N	530.25406308							97261
BRD-K84103449	LSM-13569		54632016	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16+,22-/m1/s1	QUVWWXZLNVGVGD-ZMPRRUGASA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K84103449	BRD-K84103449-001-01-3	Broad Institute of MIT and Harvard	BRD-K84103449			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16+,22-/m1/s1	QUVWWXZLNVGVGD-ZMPRRUGASA-N	502.242749468							102211
BRD-K63403474	LSM-12287		54632022	InChI=1S/C23H35F3N4O6S/c1-14(2)27-22(32)30-10-15(3)20(35-6)11-29(5)21(31)18-9-17(7-8-19(18)36-12-16(30)4)28-37(33,34)13-23(24,25)26/h7-9,14-16,20,28H,10-13H2,1-6H3,(H,27,32)/t15-,16+,20-/m1/s1	XOJAHRJNCMVABE-GQIGUUNPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K63403474	BRD-K63403474-001-01-0	Broad Institute of MIT and Harvard	BRD-K63403474			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C23H35F3N4O6S/c1-14(2)27-22(32)30-10-15(3)20(35-6)11-29(5)21(31)18-9-17(7-8-19(18)36-12-16(30)4)28-37(33,34)13-23(24,25)26/h7-9,14-16,20,28H,10-13H2,1-6H3,(H,27,32)/t15-,16+,20-/m1/s1	XOJAHRJNCMVABE-GQIGUUNPSA-N	552.22294017							100913
BRD-K43057855	LSM-11047		54632227	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16-,22-/m1/s1	QUVWWXZLNVGVGD-XCGNWRKASA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H]1C)OC	BroadT	BRD-K43057855	BRD-K43057855-001-01-8	Broad Institute of MIT and Harvard	BRD-K43057855			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H]1C)OC	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16-,22-/m1/s1	QUVWWXZLNVGVGD-XCGNWRKASA-N	502.242749468							99668
BRD-K76571344	LSM-13111		54632102	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24+/m0/s1	MJQDMCPXEXXQJL-WOGXIUBCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K76571344	BRD-K76571344-001-01-7	Broad Institute of MIT and Harvard	BRD-K76571344			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24+/m0/s1	MJQDMCPXEXXQJL-WOGXIUBCSA-N	485.232599354							101749
BRD-K78913846	LSM-13246		54632123	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16+,20+/m0/s1	ILRMXYQNFGXKSX-RZQQEMMASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3nccs3)C[C@@H]1C	BroadT	BRD-K78913846	BRD-K78913846-001-01-2	Broad Institute of MIT and Harvard	BRD-K78913846			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16+,20+/m0/s1	ILRMXYQNFGXKSX-RZQQEMMASA-N	496.181411544							101885
BRD-K63366453	LSM-12283		54632217	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16-,22+/m1/s1	QUVWWXZLNVGVGD-MCFFVMPBSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H]1C)OC	BroadT	BRD-K63366453	BRD-K63366453-001-01-4	Broad Institute of MIT and Harvard	BRD-K63366453			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H]1C)OC	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16-,22+/m1/s1	QUVWWXZLNVGVGD-MCFFVMPBSA-N	502.242749468							100909
BRD-K14558018	LSM-9312		54632160	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21-,28+/m1/s1	XXZJPGUPXRETOH-CJYOKPGZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K14558018	BRD-K14558018-001-01-4	Broad Institute of MIT and Harvard	BRD-K14558018			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21-,28+/m1/s1	XXZJPGUPXRETOH-CJYOKPGZSA-N	598.22613377							97933
BRD-K21747841	LSM-9750		54631986	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16-,21+/m0/s1	LPOPNFSKLDAMKV-CKJXQJPGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K21747841	BRD-K21747841-001-01-7	Broad Institute of MIT and Harvard	BRD-K21747841			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16-,21+/m0/s1	LPOPNFSKLDAMKV-CKJXQJPGSA-N	485.250141198							98371
BRD-K02928994	LSM-8617		54631963	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15-,19-/m0/s1	FSHWRMSUZBSSQF-DOXZYTNZSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K02928994	BRD-K02928994-001-01-1	Broad Institute of MIT and Harvard	BRD-K02928994			CCCNC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15-,19-/m0/s1	FSHWRMSUZBSSQF-DOXZYTNZSA-N	406.258005608							97238
BRD-K24257383	LSM-9897		54632180	InChI=1S/C31H38N4O4/c1-21-17-35(18-24-9-11-25(12-10-24)28-8-6-7-15-32-28)22(2)20-39-29-16-26(33-23(3)36)13-14-27(29)31(37)34(4)19-30(21)38-5/h6-16,21-22,30H,17-20H2,1-5H3,(H,33,36)/t21-,22-,30-/m1/s1	ILITXRRNALRLLT-NPKFRGRUSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@H]1C	BroadT	BRD-K24257383	BRD-K24257383-001-01-8	Broad Institute of MIT and Harvard	BRD-K24257383			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2ccc(cc2)-c2ccccn2)C[C@H]1C	InChI=1S/C31H38N4O4/c1-21-17-35(18-24-9-11-25(12-10-24)28-8-6-7-15-32-28)22(2)20-39-29-16-26(33-23(3)36)13-14-27(29)31(37)34(4)19-30(21)38-5/h6-16,21-22,30H,17-20H2,1-5H3,(H,33,36)/t21-,22-,30-/m1/s1	ILITXRRNALRLLT-NPKFRGRUSA-N	530.289305736							98518
BRD-K36651002	LSM-10643		54631982	InChI=1S/C24H37N5O5S/c1-7-10-29-12-17(2)22(33-6)13-28(5)24(30)20-9-8-19(11-21(20)34-15-18(29)3)26-35(31,32)23-14-27(4)16-25-23/h8-9,11,14,16-18,22,26H,7,10,12-13,15H2,1-6H3/t17-,18+,22+/m1/s1	LWIIWTGMFNHRDM-FGSXEWAUSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H]1C)OC	BroadT	BRD-K36651002	BRD-K36651002-001-01-9	Broad Institute of MIT and Harvard	BRD-K36651002			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H]1C)OC	InChI=1S/C24H37N5O5S/c1-7-10-29-12-17(2)22(33-6)13-28(5)24(30)20-9-8-19(11-21(20)34-15-18(29)3)26-35(31,32)23-14-27(4)16-25-23/h8-9,11,14,16-18,22,26H,7,10,12-13,15H2,1-6H3/t17-,18+,22+/m1/s1	LWIIWTGMFNHRDM-FGSXEWAUSA-N	507.251540024							99264
BRD-K61756858	LSM-12171		54632200	InChI=1S/C29H36N4O7S/c1-18-8-7-9-23(12-18)41(36,37)33-15-19(2)27(38-6)16-32(5)29(35)24-14-22(10-11-26(24)39-17-20(33)3)30-28(34)25-13-21(4)40-31-25/h7-14,19-20,27H,15-17H2,1-6H3,(H,30,34)/t19-,20-,27-/m1/s1	JQKUTVGMEZZDSF-SEXOINJZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c4cccc(C)c4	BroadT	BRD-K61756858	BRD-K61756858-001-01-9	Broad Institute of MIT and Harvard	BRD-K61756858			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c1cccc(C)c1	InChI=1S/C29H36N4O7S/c1-18-8-7-9-23(12-18)41(36,37)33-15-19(2)27(38-6)16-32(5)29(35)24-14-22(10-11-26(24)39-17-20(33)3)30-28(34)25-13-21(4)40-31-25/h7-14,19-20,27H,15-17H2,1-6H3,(H,30,34)/t19-,20-,27-/m1/s1	JQKUTVGMEZZDSF-SEXOINJZSA-N	584.230470222							100797
BRD-K31248348	LSM-10318		54631932	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25+/m0/s1	WQZORWGHLUMPIH-OSWQYVSFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K31248348	BRD-K31248348-001-01-2	Broad Institute of MIT and Harvard	BRD-K31248348			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25+/m0/s1	WQZORWGHLUMPIH-OSWQYVSFSA-N	487.304621442							98939
BRD-K48052985	LSM-11355		54631947	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m0/s1	DDFPKKGQTCCPIA-IYOUNJFTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K48052985	BRD-K48052985-001-01-7	Broad Institute of MIT and Harvard	BRD-K48052985			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m0/s1	DDFPKKGQTCCPIA-IYOUNJFTSA-N	413.198441812							99976
BRD-K10429990	LSM-9058		54632081	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21-,28-/m0/s1	XXZJPGUPXRETOH-CZBREUMFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K10429990	BRD-K10429990-001-01-4	Broad Institute of MIT and Harvard	BRD-K10429990			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc1cccnc1	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21-,28-/m0/s1	XXZJPGUPXRETOH-CZBREUMFSA-N	598.22613377							97679
BRD-K24496965	LSM-9913		54632099	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26+/m0/s1	DJGRJRLVSKCCNZ-QSAFDGGLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Nc4c(C)onc4C	BroadT	BRD-K24496965	BRD-K24496965-001-01-8	Broad Institute of MIT and Harvard	BRD-K24496965			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Nc1c(C)noc1C	InChI=1S/C30H37FN6O6/c1-17-14-37(30(40)34-27-19(3)35-43-20(27)4)18(2)16-42-25-11-10-23(13-24(25)28(38)36(5)15-26(17)41-6)33-29(39)32-22-9-7-8-21(31)12-22/h7-13,17-18,26H,14-16H2,1-6H3,(H,34,40)(H2,32,33,39)/t17-,18-,26+/m0/s1	DJGRJRLVSKCCNZ-QSAFDGGLSA-N	596.275861164							98534
BRD-K92209998	LSM-14091		54632201	InChI=1S/C33H39N3O6/c1-22-18-36(31(37)21-40-4)23(2)20-42-29-16-15-27(17-28(29)33(39)35(3)19-30(22)41-5)34-32(38)26-13-11-25(12-14-26)24-9-7-6-8-10-24/h6-17,22-23,30H,18-21H2,1-5H3,(H,34,38)/t22-,23-,30-/m1/s1	RAFMLKNPZZMZRA-IQLGONJTSA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(cc3)c4ccccc4)ccc2OC[C@H]1C)OC	BroadT	BRD-K92209998	BRD-K92209998-001-01-3	Broad Institute of MIT and Harvard	BRD-K92209998			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccc(cc3)-c3ccccc3)ccc2OC[C@H]1C)OC	InChI=1S/C33H39N3O6/c1-22-18-36(31(37)21-40-4)23(2)20-42-29-16-15-27(17-28(29)33(39)35(3)19-30(22)41-5)34-32(38)26-13-11-25(12-14-26)24-9-7-6-8-10-24/h6-17,22-23,30H,18-21H2,1-5H3,(H,34,38)/t22-,23-,30-/m1/s1	RAFMLKNPZZMZRA-IQLGONJTSA-N	573.283885998							102745
BRD-K81140509	LSM-13390		54631944	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21-/m1/s1	DHNAZJFKQHWVTC-VWKPWSFCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3F)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K81140509	BRD-K81140509-001-01-5	Broad Institute of MIT and Harvard	BRD-K81140509			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3F)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21-/m1/s1	DHNAZJFKQHWVTC-VWKPWSFCSA-N	479.18901998							131217
CHEMBL2361962	LSM-14158	BRD-K93450738, SID131428170	54631927	InChI=1S/C29H45N3O4/c1-20-16-32(17-22-9-6-5-7-10-22)21(2)19-36-26-15-24(30-28(33)23-11-8-12-23)13-14-25(26)29(34)31(3)18-27(20)35-4/h13-15,20-23,27H,5-12,16-19H2,1-4H3,(H,30,33)/t20-,21+,27-/m0/s1	ZYUAJIZJWFLNII-ISCCLHIJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(CC4CCCCC4)C[C@@H]1C	BroadT	BRD-K93450738	BRD-K93450738-001-01-7	Broad Institute of MIT and Harvard	BRD-K93450738			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(CC2CCCCC2)C[C@@H]1C	InChI=1S/C29H45N3O4/c1-20-16-32(17-22-9-6-5-7-10-22)21(2)19-36-26-15-24(30-28(33)23-11-8-12-23)13-14-25(26)29(34)31(3)18-27(20)35-4/h13-15,20-23,27H,5-12,16-19H2,1-4H3,(H,30,33)/t20-,21+,27-/m0/s1	ZYUAJIZJWFLNII-ISCCLHIJSA-N	499.34100695							102812
BRD-K22959724	LSM-9822		54631964	InChI=1S/C24H37N5O5S/c1-7-10-29-12-17(2)22(33-6)13-28(5)24(30)20-9-8-19(11-21(20)34-15-18(29)3)26-35(31,32)23-14-27(4)16-25-23/h8-9,11,14,16-18,22,26H,7,10,12-13,15H2,1-6H3/t17-,18-,22+/m0/s1	LWIIWTGMFNHRDM-NPPFBWRTSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H]1C)OC	BroadT	BRD-K22959724	BRD-K22959724-001-01-9	Broad Institute of MIT and Harvard	BRD-K22959724			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H]1C)OC	InChI=1S/C24H37N5O5S/c1-7-10-29-12-17(2)22(33-6)13-28(5)24(30)20-9-8-19(11-21(20)34-15-18(29)3)26-35(31,32)23-14-27(4)16-25-23/h8-9,11,14,16-18,22,26H,7,10,12-13,15H2,1-6H3/t17-,18-,22+/m0/s1	LWIIWTGMFNHRDM-NPPFBWRTSA-N	507.251540024							98443
BRD-K01405464	LSM-8523		54632121	InChI=1S/C27H34N4O5/c1-17-14-31(27(34)22-7-5-6-12-28-22)18(2)16-36-23-13-20(29-25(32)19-8-9-19)10-11-21(23)26(33)30(3)15-24(17)35-4/h5-7,10-13,17-19,24H,8-9,14-16H2,1-4H3,(H,29,32)/t17-,18-,24+/m0/s1	ICZJHRYDJKYLQD-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4ccccn4	BroadT	BRD-K01405464	BRD-K01405464-001-01-2	Broad Institute of MIT and Harvard	BRD-K01405464			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccn1	InChI=1S/C27H34N4O5/c1-17-14-31(27(34)22-7-5-6-12-28-22)18(2)16-36-23-13-20(29-25(32)19-8-9-19)10-11-21(23)26(33)30(3)15-24(17)35-4/h5-7,10-13,17-19,24H,8-9,14-16H2,1-4H3,(H,29,32)/t17-,18-,24+/m0/s1	ICZJHRYDJKYLQD-LLJLJFOGSA-N	494.252920228							97144
BRD-K04627808	LSM-8711		54632204	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20-,27-/m1/s1	NFEVTECKVPPYCJ-SEXOINJZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K04627808	BRD-K04627808-001-01-3	Broad Institute of MIT and Harvard	BRD-K04627808			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20-,27-/m1/s1	NFEVTECKVPPYCJ-SEXOINJZSA-N	524.29987042							97332
BRD-K28658046	LSM-10167		54631956	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22-/m1/s1	WJKSFTDVZIMVMK-XCGNWRKASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K28658046	BRD-K28658046-001-01-2	Broad Institute of MIT and Harvard	BRD-K28658046			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22-/m1/s1	WJKSFTDVZIMVMK-XCGNWRKASA-N	474.203383222							98788
BRD-K27292311	LSM-10077		54631942	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m0/s1	PSXVKIUCJIMJLV-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(Cl)c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K27292311	BRD-K27292311-001-01-9	Broad Institute of MIT and Harvard	BRD-K27292311			CO[C@@H]1CN(C)C(=O)c2ccc(cc2OC[C@@H](C)NC[C@@H]1C)NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-7-5-6-17(24)10-19)8-9-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m0/s1	PSXVKIUCJIMJLV-WJONJSRFSA-N	495.15946949							98698
BRD-K61220066	LSM-12136		54631930	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18-,25+/m1/s1	ZVOSTPFCAQQCID-GAKIBJFNSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K61220066	BRD-K61220066-001-01-4	Broad Institute of MIT and Harvard	BRD-K61220066			COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18-,25+/m1/s1	ZVOSTPFCAQQCID-GAKIBJFNSA-N	519.25447765							100762
BRD-K99978152-001-01-8	LSM-14574	BRD-K99978152	54632073	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	WJKSFTDVZIMVMK-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K99978152	BRD-K99978152-001-01-8	Broad Institute of MIT and Harvard	BRD-K99978152			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	WJKSFTDVZIMVMK-ZMPRRUGASA-N	474.203383222							103230
BRD-K71877850	LSM-12833		54632226	InChI=1S/C23H35F3N4O6S/c1-14(2)27-22(32)30-10-15(3)20(35-6)11-29(5)21(31)18-9-17(7-8-19(18)36-12-16(30)4)28-37(33,34)13-23(24,25)26/h7-9,14-16,20,28H,10-13H2,1-6H3,(H,27,32)/t15-,16-,20+/m0/s1	XOJAHRJNCMVABE-TWOQFEAHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K71877850	BRD-K71877850-001-01-9	Broad Institute of MIT and Harvard	BRD-K71877850			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C23H35F3N4O6S/c1-14(2)27-22(32)30-10-15(3)20(35-6)11-29(5)21(31)18-9-17(7-8-19(18)36-12-16(30)4)28-37(33,34)13-23(24,25)26/h7-9,14-16,20,28H,10-13H2,1-6H3,(H,27,32)/t15-,16-,20+/m0/s1	XOJAHRJNCMVABE-TWOQFEAHSA-N	552.22294017							101470
BRD-K73671483	LSM-12943		54632087	InChI=1S/C27H36N4O5/c1-6-8-25(32)29-21-10-11-22-23(13-21)36-17-19(3)31(26(33)20-9-7-12-28-14-20)15-18(2)24(35-5)16-30(4)27(22)34/h7,9-14,18-19,24H,6,8,15-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m0/s1	IERCBNABLGDWRK-GLDPYIMESA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3cccnc3	BroadT	BRD-K73671483	BRD-K73671483-001-01-9	Broad Institute of MIT and Harvard	BRD-K73671483			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2cccnc2)c1	InChI=1S/C27H36N4O5/c1-6-8-25(32)29-21-10-11-22-23(13-21)36-17-19(3)31(26(33)20-9-7-12-28-14-20)15-18(2)24(35-5)16-30(4)27(22)34/h7,9-14,18-19,24H,6,8,15-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m0/s1	IERCBNABLGDWRK-GLDPYIMESA-N	496.268570292							101580
BRD-K82176569	LSM-13452		54631950	InChI=1S/C25H33F3N4O5S/c1-17-12-32(13-19-6-5-9-29-11-19)18(2)15-37-22-10-20(30-38(34,35)16-25(26,27)28)7-8-21(22)24(33)31(3)14-23(17)36-4/h5-11,17-18,23,30H,12-16H2,1-4H3/t17-,18+,23-/m1/s1	FDHKBRYHKGCIFQ-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(Cc3cccnc3)C[C@H]1C	BroadT	BRD-K82176569	BRD-K82176569-001-01-5	Broad Institute of MIT and Harvard	BRD-K82176569			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C25H33F3N4O5S/c1-17-12-32(13-19-6-5-9-29-11-19)18(2)15-37-22-10-20(30-38(34,35)16-25(26,27)28)7-8-21(22)24(33)31(3)14-23(17)36-4/h5-11,17-18,23,30H,12-16H2,1-4H3/t17-,18+,23-/m1/s1	FDHKBRYHKGCIFQ-IEGUWTFLSA-N	558.212375486							102092
BRD-K05275169	LSM-8742		54632219	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19+,24-/m0/s1	OTFQVXLKCTXKNS-GLDPYIMESA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K05275169	BRD-K05275169-001-01-3	Broad Institute of MIT and Harvard	BRD-K05275169			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19+,24-/m0/s1	OTFQVXLKCTXKNS-GLDPYIMESA-N	481.25767125							97363
BRD-K49114771	LSM-11415		54632158	InChI=1S/C25H33N5O6/c1-16-12-30(23(31)15-34-4)17(2)14-36-21-10-18(28-24(32)20-11-26-8-9-27-20)6-7-19(21)25(33)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,32)/t16-,17+,22-/m0/s1	CTEQLXWVFDYWAW-JKSBSHDWSA-N	COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H]1C)OC	BroadT	BRD-K49114771	BRD-K49114771-001-01-2	Broad Institute of MIT and Harvard	BRD-K49114771			COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H]1C)OC	InChI=1S/C25H33N5O6/c1-16-12-30(23(31)15-34-4)17(2)14-36-21-10-18(28-24(32)20-11-26-8-9-27-20)6-7-19(21)25(33)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,32)/t16-,17+,22-/m0/s1	CTEQLXWVFDYWAW-JKSBSHDWSA-N	499.243083826							100036
BRD-K89284683	LSM-13924		54631969	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21+,26-/m1/s1	XLOJZIOISXYGBL-YZIHRLCOSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc3ccccc3)C[C@H]1C	BroadT	BRD-K89284683	BRD-K89284683-001-01-1	Broad Institute of MIT and Harvard	BRD-K89284683			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc2ccccc2)C[C@H]1C	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21+,26-/m1/s1	XLOJZIOISXYGBL-YZIHRLCOSA-N	496.3049558							102577
BRD-K77726270	LSM-13180		54632185	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19-,24-/m0/s1	NFKQXDUJHPCZLU-JXQFQVJHSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K77726270	BRD-K77726270-001-01-4	Broad Institute of MIT and Harvard	BRD-K77726270			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19-,24-/m0/s1	NFKQXDUJHPCZLU-JXQFQVJHSA-N	504.240640982							101818
BRD-K74294292	LSM-12978		54632209	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19+,25+/m0/s1	RHXUULWZVSTJED-OSWQYVSFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc4ccncc4)C[C@@H]1C	BroadT	BRD-K74294292	BRD-K74294292-001-01-0	Broad Institute of MIT and Harvard	BRD-K74294292			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19+,25+/m0/s1	RHXUULWZVSTJED-OSWQYVSFSA-N	480.273655672							101615
BRD-K46653995-001-01-2	LSM-11275	BRD-K46653995	54632042	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	BTAIGOZCFZRKBT-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K46653995	BRD-K46653995-001-01-2	Broad Institute of MIT and Harvard	BRD-K46653995			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-6-17(25)10-18)8-9-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	BTAIGOZCFZRKBT-PONJGIIJSA-N	458.232933712							99896
BRD-K98582396	LSM-14480		54631958	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19-,24-/m1/s1	NFKQXDUJHPCZLU-KHCICDEESA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K98582396	BRD-K98582396-001-01-5	Broad Institute of MIT and Harvard	BRD-K98582396			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19-,24-/m1/s1	NFKQXDUJHPCZLU-KHCICDEESA-N	504.240640982							103135
BRD-K64070950	LSM-12340		54632170	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17-,24-/m1/s1	BVCIWUWSCCLIPT-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K64070950	BRD-K64070950-001-01-9	Broad Institute of MIT and Harvard	BRD-K64070950			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C27H39N5O5/c1-16-12-32(13-20-7-8-20)17(2)15-36-23-11-21(28-27(34)29-25-18(3)30-37-19(25)4)9-10-22(23)26(33)31(5)14-24(16)35-6/h9-11,16-17,20,24H,7-8,12-15H2,1-6H3,(H2,28,29,34)/t16-,17-,24-/m1/s1	BVCIWUWSCCLIPT-HOZJOUCCSA-N	513.295119398							100967
BRD-K55197905	LSM-11774		54631977	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25+/m0/s1	BEBQDKOSRNKXPA-DPOKWSEZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3ccccc3F)C[C@@H]1C	BroadT	BRD-K55197905	BRD-K55197905-001-01-7	Broad Institute of MIT and Harvard	BRD-K55197905			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2ccccc2F)C[C@@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25+/m0/s1	BEBQDKOSRNKXPA-DPOKWSEZSA-N	471.253334798							100399
BRD-K29924325	LSM-10240		54632111	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16-,22-/m0/s1	QUVWWXZLNVGVGD-WCJKSRRJSA-N	COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K29924325	BRD-K29924325-001-01-9	Broad Institute of MIT and Harvard	BRD-K29924325			COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16-,22-/m0/s1	QUVWWXZLNVGVGD-WCJKSRRJSA-N	502.242749468							98861
BRD-K10838258	LSM-9090		54632057	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19-,25+/m1/s1	BBRWISDMGXAAHU-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K10838258	BRD-K10838258-001-01-3	Broad Institute of MIT and Harvard	BRD-K10838258			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O5/c1-18-15-30(20(3)31)19(2)17-35-24-12-11-22(28-26(32)13-21-9-7-6-8-10-21)14-23(24)27(33)29(4)16-25(18)34-5/h6-12,14,18-19,25H,13,15-17H2,1-5H3,(H,28,32)/t18-,19-,25+/m1/s1	BBRWISDMGXAAHU-RRQZXNHTSA-N	481.25767125							97711
BRD-K53349319	LSM-11682		54632181	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25+/m0/s1	WQZORWGHLUMPIH-XHNVNVPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K53349319	BRD-K53349319-001-01-6	Broad Institute of MIT and Harvard	BRD-K53349319			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25+/m0/s1	WQZORWGHLUMPIH-XHNVNVPESA-N	487.304621442							100307
BRD-K04251331	LSM-8689		54632006	InChI=1S/C21H28N4O5/c1-13-10-22-14(2)12-29-18-9-15(24-20(26)17-7-8-23-30-17)5-6-16(18)21(27)25(3)11-19(13)28-4/h5-9,13-14,19,22H,10-12H2,1-4H3,(H,24,26)/t13-,14+,19-/m0/s1	UYCGUZMTEQILNL-KSMMKXTCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3oncc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K04251331	BRD-K04251331-001-01-8	Broad Institute of MIT and Harvard	BRD-K04251331			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccno3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C21H28N4O5/c1-13-10-22-14(2)12-29-18-9-15(24-20(26)17-7-8-23-30-17)5-6-16(18)21(27)25(3)11-19(13)28-4/h5-9,13-14,19,22H,10-12H2,1-4H3,(H,24,26)/t13-,14+,19-/m0/s1	UYCGUZMTEQILNL-KSMMKXTCSA-N	416.205970036							97310
BRD-K65900075	LSM-12446		54631976	InChI=1S/C27H39N5O4/c1-18(2)29-27(34)30-21-10-11-23-24(13-21)36-17-20(4)32(15-22-9-7-8-12-28-22)14-19(3)25(35-6)16-31(5)26(23)33/h7-13,18-20,25H,14-17H2,1-6H3,(H2,29,30,34)/t19-,20+,25-/m1/s1	YDXYYDXTJISMJT-OHUGHZGNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(Cc3ccccn3)C[C@H]1C	BroadT	BRD-K65900075	BRD-K65900075-001-01-6	Broad Institute of MIT and Harvard	BRD-K65900075			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C27H39N5O4/c1-18(2)29-27(34)30-21-10-11-23-24(13-21)36-17-20(4)32(15-22-9-7-8-12-28-22)14-19(3)25(35-6)16-31(5)26(23)33/h7-13,18-20,25H,14-17H2,1-6H3,(H2,29,30,34)/t19-,20+,25-/m1/s1	YDXYYDXTJISMJT-OHUGHZGNSA-N	497.300204778							101074
BRD-K68441823	LSM-12604		54632109	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17-,21+/m0/s1	AOOMHDUDPOWWMY-XGHQBKJUSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)NC(C)C	BroadT	BRD-K68441823	BRD-K68441823-001-01-3	Broad Institute of MIT and Harvard	BRD-K68441823			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)NC(C)C)c1	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17-,21+/m0/s1	AOOMHDUDPOWWMY-XGHQBKJUSA-N	478.279134976							101236
BRD-K87967185	LSM-13828		54631983	InChI=1S/C27H34FN3O5/c1-6-25(32)29-21-11-12-22-23(13-21)36-16-18(3)31(26(33)19-7-9-20(28)10-8-19)14-17(2)24(35-5)15-30(4)27(22)34/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24-/m0/s1	DLQPGZNWCDDUSB-RHGYRFJNSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3ccc(F)cc3	BroadT	BRD-K87967185	BRD-K87967185-001-01-6	Broad Institute of MIT and Harvard	BRD-K87967185			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccc(F)cc2)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-21-11-12-22-23(13-21)36-16-18(3)31(26(33)19-7-9-20(28)10-8-19)14-17(2)24(35-5)15-30(4)27(22)34/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24-/m0/s1	DLQPGZNWCDDUSB-RHGYRFJNSA-N	499.248249418							102478
BRD-K24506271	LSM-9915		54632199	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24-/m1/s1	MJQDMCPXEXXQJL-XVTZWQNCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K24506271	BRD-K24506271-001-01-3	Broad Institute of MIT and Harvard	BRD-K24506271			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24-/m1/s1	MJQDMCPXEXXQJL-XVTZWQNCSA-N	485.232599354							98536
MLS003650044	LSM-12357	BRD-K64380616, SID125305347	53382703	InChI=1S/C25H33N5O6/c1-16-12-30(23(31)15-34-4)17(2)14-36-21-10-18(28-24(32)20-11-26-8-9-27-20)6-7-19(21)25(33)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,32)/t16-,17-,22+/m1/s1	CTEQLXWVFDYWAW-YVHKJVDXSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H]1C)OC	BroadT	BRD-K64380616	BRD-K64380616-001-01-8	Broad Institute of MIT and Harvard	BRD-K64380616			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@H]1C)OC	InChI=1S/C25H33N5O6/c1-16-12-30(23(31)15-34-4)17(2)14-36-21-10-18(28-24(32)20-11-26-8-9-27-20)6-7-19(21)25(33)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,32)/t16-,17-,22+/m1/s1	CTEQLXWVFDYWAW-YVHKJVDXSA-N	499.243083826							100984
BRD-K76403391-001-01-5	LSM-13102	BRD-K76403391	54632182	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22-/m0/s1	WJKSFTDVZIMVMK-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K76403391	BRD-K76403391-001-01-5	Broad Institute of MIT and Harvard	BRD-K76403391			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(Cl)c3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H31ClN4O4/c1-15-12-26-16(2)14-33-21-9-8-19(11-20(21)23(30)29(3)13-22(15)32-4)28-24(31)27-18-7-5-6-17(25)10-18/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22-/m0/s1	WJKSFTDVZIMVMK-WCJKSRRJSA-N	474.203383222							101740
BRD-K76257863	LSM-13089		54632063	InChI=1S/C29H45N3O4/c1-20-16-32(17-22-9-6-5-7-10-22)21(2)19-36-26-15-24(30-28(33)23-11-8-12-23)13-14-25(26)29(34)31(3)18-27(20)35-4/h13-15,20-23,27H,5-12,16-19H2,1-4H3,(H,30,33)/t20-,21+,27+/m1/s1	ZYUAJIZJWFLNII-BUEREQSYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(CC4CCCCC4)C[C@H]1C	BroadT	BRD-K76257863	BRD-K76257863-001-01-4	Broad Institute of MIT and Harvard	BRD-K76257863			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C29H45N3O4/c1-20-16-32(17-22-9-6-5-7-10-22)21(2)19-36-26-15-24(30-28(33)23-11-8-12-23)13-14-25(26)29(34)31(3)18-27(20)35-4/h13-15,20-23,27H,5-12,16-19H2,1-4H3,(H,30,33)/t20-,21+,27+/m1/s1	ZYUAJIZJWFLNII-BUEREQSYSA-N	499.34100695							101727
BRD-K06326887	LSM-8796		54632150	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22-/m1/s1	KJNJKXAQFIYZGQ-DOQJBMMISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K06326887	BRD-K06326887-001-01-4	Broad Institute of MIT and Harvard	BRD-K06326887			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22-/m1/s1	KJNJKXAQFIYZGQ-DOQJBMMISA-N	476.22351188							97417
BRD-K74852367	LSM-13018		54632161	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24-/m1/s1	ZQFWKBSGTDYKBN-QZTZHPFYSA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	BroadT	BRD-K74852367	BRD-K74852367-001-01-5	Broad Institute of MIT and Harvard	BRD-K74852367			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H]1C)OC	InChI=1S/C27H35FN4O6/c1-17-13-32(25(33)16-36-4)18(2)15-38-23-10-9-21(12-22(23)26(34)31(3)14-24(17)37-5)30-27(35)29-20-8-6-7-19(28)11-20/h6-12,17-18,24H,13-16H2,1-5H3,(H2,29,30,35)/t17-,18-,24-/m1/s1	ZQFWKBSGTDYKBN-QZTZHPFYSA-N	530.25406308							101655
BRD-K50673380	LSM-11515		54631952	InChI=1S/C27H34FN3O5/c1-6-25(32)29-21-11-12-22-23(13-21)36-16-18(3)31(26(33)19-7-9-20(28)10-8-19)14-17(2)24(35-5)15-30(4)27(22)34/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18-,24+/m1/s1	DLQPGZNWCDDUSB-GGUMNFRJSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3ccc(F)cc3	BroadT	BRD-K50673380	BRD-K50673380-001-01-6	Broad Institute of MIT and Harvard	BRD-K50673380			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccc(F)cc2)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-21-11-12-22-23(13-21)36-16-18(3)31(26(33)19-7-9-20(28)10-8-19)14-17(2)24(35-5)15-30(4)27(22)34/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18-,24+/m1/s1	DLQPGZNWCDDUSB-GGUMNFRJSA-N	499.248249418							100136
BRD-K97821886	LSM-14441		54632188	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19-,25-/m0/s1	RHXUULWZVSTJED-MHPIHPPYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc4ccncc4)C[C@@H]1C	BroadT	BRD-K97821886	BRD-K97821886-001-01-5	Broad Institute of MIT and Harvard	BRD-K97821886			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19-,25-/m0/s1	RHXUULWZVSTJED-MHPIHPPYSA-N	480.273655672							103096
BRD-K14255719	LSM-9287		54632223	InChI=1S/C30H36N6O6/c1-19-16-36(30(39)34-23-8-6-7-9-25(23)40-4)20(2)18-42-26-14-21(33-28(37)24-15-31-12-13-32-24)10-11-22(26)29(38)35(3)17-27(19)41-5/h6-15,19-20,27H,16-18H2,1-5H3,(H,33,37)(H,34,39)/t19-,20-,27-/m1/s1	ZWXQWYOEWBGKMN-SEXOINJZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4ccccc4OC	BroadT	BRD-K14255719	BRD-K14255719-001-01-9	Broad Institute of MIT and Harvard	BRD-K14255719			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1ccccc1OC	InChI=1S/C30H36N6O6/c1-19-16-36(30(39)34-23-8-6-7-9-25(23)40-4)20(2)18-42-26-14-21(33-28(37)24-15-31-12-13-32-24)10-11-22(26)29(38)35(3)17-27(19)41-5/h6-15,19-20,27H,16-18H2,1-5H3,(H,33,37)(H,34,39)/t19-,20-,27-/m1/s1	ZWXQWYOEWBGKMN-SEXOINJZSA-N	576.269632932							97908
BRD-K31900068	LSM-10363		54632023	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16+,22-/m0/s1	QUVWWXZLNVGVGD-DMPWYTOCSA-N	COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H]1C)OC	BroadT	BRD-K31900068	BRD-K31900068-001-01-6	Broad Institute of MIT and Harvard	BRD-K31900068			COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cc(C)on3)ccc2OC[C@H]1C)OC	InChI=1S/C25H34N4O7/c1-15-11-29(23(30)14-33-5)16(2)13-35-21-8-7-18(26-24(31)20-9-17(3)36-27-20)10-19(21)25(32)28(4)12-22(15)34-6/h7-10,15-16,22H,11-14H2,1-6H3,(H,26,31)/t15-,16+,22-/m0/s1	QUVWWXZLNVGVGD-DMPWYTOCSA-N	502.242749468							98984
BRD-K19455915	LSM-9601		54632171	InChI=1S/C24H32F3N5O6S/c1-15-10-32(39(35,36)22-12-30(3)14-28-22)16(2)13-38-19-8-17(29-21(33)9-24(25,26)27)6-7-18(19)23(34)31(4)11-20(15)37-5/h6-8,12,14-16,20H,9-11,13H2,1-5H3,(H,29,33)/t15-,16+,20+/m0/s1	ZYJJQNOXPHIYRR-RZQQEMMASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K19455915	BRD-K19455915-001-01-2	Broad Institute of MIT and Harvard	BRD-K19455915			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)c1cn(C)cn1	InChI=1S/C24H32F3N5O6S/c1-15-10-32(39(35,36)22-12-30(3)14-28-22)16(2)13-38-19-8-17(29-21(33)9-24(25,26)27)6-7-18(19)23(34)31(4)11-20(15)37-5/h6-8,12,14-16,20H,9-11,13H2,1-5H3,(H,29,33)/t15-,16+,20+/m0/s1	ZYJJQNOXPHIYRR-RZQQEMMASA-N	575.202539084							98222
BRD-K60272067	LSM-12072		54632062	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19+,23+/m0/s1	VMCYUUKPCWGJCJ-YCRNBWNJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K60272067	BRD-K60272067-001-01-5	Broad Institute of MIT and Harvard	BRD-K60272067			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3C)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H35N3O5S/c1-17-9-7-8-10-24(17)34(30,31)26-20-11-12-21-22(13-20)33-16-19(3)27(4)14-18(2)23(32-6)15-28(5)25(21)29/h7-13,18-19,23,26H,14-16H2,1-6H3/t18-,19+,23+/m0/s1	VMCYUUKPCWGJCJ-YCRNBWNJSA-N	489.22974194							100698
BRD-K59314947	LSM-12011		54632069	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22+/m0/s1	ULFQVHHILZHREN-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K59314947	BRD-K59314947-001-01-4	Broad Institute of MIT and Harvard	BRD-K59314947			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-10-9-17(27-23(29)18-7-5-6-8-20(18)25)11-19(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22+/m0/s1	ULFQVHHILZHREN-WJONJSRFSA-N	443.22203467							100637
BRD-K48545097	LSM-11382		54631962	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18+,22-/m0/s1	RUFIKNIWNRYTLQ-SVMVAKDDSA-N	CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	BroadT	BRD-K48545097	BRD-K48545097-001-01-5	Broad Institute of MIT and Harvard	BRD-K48545097			CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18+,22-/m0/s1	RUFIKNIWNRYTLQ-SVMVAKDDSA-N	476.29987042							100003
BRD-K31613395	LSM-10344		54632094	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20+,27+/m1/s1	NFEVTECKVPPYCJ-JVAFGIKQSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K31613395	BRD-K31613395-001-01-9	Broad Institute of MIT and Harvard	BRD-K31613395			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20+,27+/m1/s1	NFEVTECKVPPYCJ-JVAFGIKQSA-N	524.29987042							98965
BRD-K59746807	LSM-12039		54632018	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24-/m0/s1	MJQDMCPXEXXQJL-UAVUOLJFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K59746807	BRD-K59746807-001-01-6	Broad Institute of MIT and Harvard	BRD-K59746807			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3F)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-11-10-19(28-25(32)20-8-6-7-9-22(20)27)12-21(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24-/m0/s1	MJQDMCPXEXXQJL-UAVUOLJFSA-N	485.232599354							100665
BRD-K38092925	LSM-10734		54631943	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21-,26+/m0/s1	XLOJZIOISXYGBL-ISJBWFOZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc3ccccc3)C[C@@H]1C	BroadT	BRD-K38092925	BRD-K38092925-001-01-8	Broad Institute of MIT and Harvard	BRD-K38092925			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(Cc2ccccc2)C[C@@H]1C	InChI=1S/C28H40N4O4/c1-19(2)29-28(34)30-23-12-13-25-24(14-23)27(33)31(5)17-26(35-6)20(3)15-32(21(4)18-36-25)16-22-10-8-7-9-11-22/h7-14,19-21,26H,15-18H2,1-6H3,(H2,29,30,34)/t20-,21-,26+/m0/s1	XLOJZIOISXYGBL-ISJBWFOZSA-N	496.3049558							99355
BRD-K42613785	LSM-11012		54631946	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19-,24+/m1/s1	OTFQVXLKCTXKNS-IECBHUPTSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K42613785	BRD-K42613785-001-01-4	Broad Institute of MIT and Harvard	BRD-K42613785			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H35N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h7-14,18-19,24H,6,15-17H2,1-5H3,(H,28,32)/t18-,19-,24+/m1/s1	OTFQVXLKCTXKNS-IECBHUPTSA-N	481.25767125							99633
BRD-K50408407	LSM-11500		54631965	InChI=1S/C28H37FN4O4/c1-18-14-33(15-20-9-10-20)19(2)17-37-25-13-21(30-28(35)31-24-8-6-5-7-23(24)29)11-12-22(25)27(34)32(3)16-26(18)36-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H2,30,31,35)/t18-,19+,26+/m1/s1	SXLNUQFFJOVPKX-MVYHEMRASA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K50408407	BRD-K50408407-001-01-6	Broad Institute of MIT and Harvard	BRD-K50408407			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H37FN4O4/c1-18-14-33(15-20-9-10-20)19(2)17-37-25-13-21(30-28(35)31-24-8-6-5-7-23(24)29)11-12-22(25)27(34)32(3)16-26(18)36-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H2,30,31,35)/t18-,19+,26+/m1/s1	SXLNUQFFJOVPKX-MVYHEMRASA-N	512.279883904							100121
BRD-K08159565	LSM-8920		54632205	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16-,20-/m1/s1	ILRMXYQNFGXKSX-JXXFODFXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3nccs3)C[C@H]1C	BroadT	BRD-K08159565	BRD-K08159565-001-01-6	Broad Institute of MIT and Harvard	BRD-K08159565			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C22H32N4O5S2/c1-15-11-26(13-21-23-8-9-32-21)16(2)14-31-19-10-17(24-33(5,28)29)6-7-18(19)22(27)25(3)12-20(15)30-4/h6-10,15-16,20,24H,11-14H2,1-5H3/t15-,16-,20-/m1/s1	ILRMXYQNFGXKSX-JXXFODFXSA-N	496.181411544							97541
BRD-K75199888	LSM-13032		54632047	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21+,28+/m0/s1	XXZJPGUPXRETOH-BALWLHIASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K75199888	BRD-K75199888-001-01-0	Broad Institute of MIT and Harvard	BRD-K75199888			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc1cccnc1	InChI=1S/C30H35FN4O6S/c1-20-17-35(29(36)13-22-7-6-12-32-16-22)21(2)19-41-27-11-10-24(15-26(27)30(37)34(3)18-28(20)40-4)33-42(38,39)25-9-5-8-23(31)14-25/h5-12,14-16,20-21,28,33H,13,17-19H2,1-4H3/t20-,21+,28+/m0/s1	XXZJPGUPXRETOH-BALWLHIASA-N	598.22613377							101669
BRD-K66401835	LSM-12474		54632066	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21-/m1/s1	AOOMHDUDPOWWMY-LLGFUMIMSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)NC(C)C	BroadT	BRD-K66401835	BRD-K66401835-001-01-5	Broad Institute of MIT and Harvard	BRD-K66401835			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)NC(C)C)c1	InChI=1S/C24H38N4O6/c1-15(2)25-24(31)28-11-16(3)21(33-7)12-27(5)23(30)19-9-8-18(26-22(29)14-32-6)10-20(19)34-13-17(28)4/h8-10,15-17,21H,11-14H2,1-7H3,(H,25,31)(H,26,29)/t16-,17+,21-/m1/s1	AOOMHDUDPOWWMY-LLGFUMIMSA-N	478.279134976							101105
BRD-K28646532	LSM-10163		54632035	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19+/m0/s1	FSHWRMSUZBSSQF-QMTMVMCOSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K28646532	BRD-K28646532-001-01-8	Broad Institute of MIT and Harvard	BRD-K28646532			CCCNC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19+/m0/s1	FSHWRMSUZBSSQF-QMTMVMCOSA-N	406.258005608							98784
BRD-K77888550	LSM-13191		54632214	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20+,27-/m0/s1	NFEVTECKVPPYCJ-VKIDHGPPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K77888550	BRD-K77888550-001-01-3	Broad Institute of MIT and Harvard	BRD-K77888550			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H40N4O5/c1-19-15-33(16-21-9-10-21)20(2)18-38-26-12-11-23(14-25(26)28(34)32(3)17-27(19)37-5)31-29(35)30-22-7-6-8-24(13-22)36-4/h6-8,11-14,19-21,27H,9-10,15-18H2,1-5H3,(H2,30,31,35)/t19-,20+,27-/m0/s1	NFEVTECKVPPYCJ-VKIDHGPPSA-N	524.29987042							101829
BRD-K13633691	LSM-9249		54632045	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18+/m1/s1	DDFPKKGQTCCPIA-GLJUWKHASA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K13633691	BRD-K13633691-001-01-0	Broad Institute of MIT and Harvard	BRD-K13633691			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C19H31N3O5S/c1-13-10-21(3)14(2)12-27-17-8-7-15(20-28(6,24)25)9-16(17)19(23)22(4)11-18(13)26-5/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18+/m1/s1	DDFPKKGQTCCPIA-GLJUWKHASA-N	413.198441812							97870
BRD-K68552135	LSM-12610		54632071	InChI=1S/C25H33N5O6/c1-16-12-30(23(31)15-34-4)17(2)14-36-21-10-18(28-24(32)20-11-26-8-9-27-20)6-7-19(21)25(33)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,32)/t16-,17+,22+/m1/s1	CTEQLXWVFDYWAW-JLHGSKIFSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H]1C)OC	BroadT	BRD-K68552135	BRD-K68552135-001-01-0	Broad Institute of MIT and Harvard	BRD-K68552135			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H]1C)OC	InChI=1S/C25H33N5O6/c1-16-12-30(23(31)15-34-4)17(2)14-36-21-10-18(28-24(32)20-11-26-8-9-27-20)6-7-19(21)25(33)29(3)13-22(16)35-5/h6-11,16-17,22H,12-15H2,1-5H3,(H,28,32)/t16-,17+,22+/m1/s1	CTEQLXWVFDYWAW-JLHGSKIFSA-N	499.243083826							101242
BRD-K67215210	LSM-12518		54632053	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22-/m1/s1	KJNJKXAQFIYZGQ-ZCCHDVMBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K67215210	BRD-K67215210-001-01-3	Broad Institute of MIT and Harvard	BRD-K67215210			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22-/m1/s1	KJNJKXAQFIYZGQ-ZCCHDVMBSA-N	476.22351188							101149
BRD-K27411066	LSM-10081		54632017	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25+/m0/s1	BEBQDKOSRNKXPA-YYULODDRSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3ccccc3F)C[C@@H]1C	BroadT	BRD-K27411066	BRD-K27411066-001-01-2	Broad Institute of MIT and Harvard	BRD-K27411066			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2ccccc2F)C[C@@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-8-6-7-9-23(20)27)18(2)16-34-24-12-21(28-19(3)31)10-11-22(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25+/m0/s1	BEBQDKOSRNKXPA-YYULODDRSA-N	471.253334798							98702
BRD-K80059960	LSM-13317		54632021	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19+,24+/m0/s1	NFKQXDUJHPCZLU-XLNZFTOWSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K80059960	BRD-K80059960-001-01-0	Broad Institute of MIT and Harvard	BRD-K80059960			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19+,24+/m0/s1	NFKQXDUJHPCZLU-XLNZFTOWSA-N	504.240640982							101956
BRD-K03079643	LSM-8625		54632198	InChI=1S/C24H32FN3O7S2/c1-16-13-28(36(5,30)31)17(2)15-35-21-11-10-18(12-19(21)24(29)27(3)14-22(16)34-4)26-37(32,33)23-9-7-6-8-20(23)25/h6-12,16-17,22,26H,13-15H2,1-5H3/t16-,17-,22-/m1/s1	ONWIHRBTLGPDKS-DRSNIGMVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K03079643	BRD-K03079643-001-01-7	Broad Institute of MIT and Harvard	BRD-K03079643			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C24H32FN3O7S2/c1-16-13-28(36(5,30)31)17(2)15-35-21-11-10-18(12-19(21)24(29)27(3)14-22(16)34-4)26-37(32,33)23-9-7-6-8-20(23)25/h6-12,16-17,22,26H,13-15H2,1-5H3/t16-,17-,22-/m1/s1	ONWIHRBTLGPDKS-DRSNIGMVSA-N	557.166569974							97246
BRD-K59000636	LSM-11994		54632082	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19-,27-/m0/s1	KBKSWHGSXCIXAL-BATDWUPUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)N(CC5CC5)C[C@@H]1C	BroadT	BRD-K59000636	BRD-K59000636-001-01-5	Broad Institute of MIT and Harvard	BRD-K59000636			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H37N3O6/c1-18-13-32(14-20-5-6-20)19(2)16-36-24-10-8-22(12-23(24)29(34)31(3)15-27(18)35-4)30-28(33)21-7-9-25-26(11-21)38-17-37-25/h7-12,18-20,27H,5-6,13-17H2,1-4H3,(H,30,33)/t18-,19-,27-/m0/s1	KBKSWHGSXCIXAL-BATDWUPUSA-N	523.268235934							100620
BRD-K10701306	LSM-9076		54632088	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18-,25-/m0/s1	ZVOSTPFCAQQCID-RPPIVITFSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cc(F)ccc3F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K10701306	BRD-K10701306-001-01-5	Broad Institute of MIT and Harvard	BRD-K10701306			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cc(F)ccc3F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18-,25-/m0/s1	ZVOSTPFCAQQCID-RPPIVITFSA-N	519.25447765							97697
BRD-K99626027	LSM-14547		54631926	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18+,25+/m1/s1	ZVOSTPFCAQQCID-UZEJHQAJSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cc(F)ccc3F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K99626027	BRD-K99626027-001-01-6	Broad Institute of MIT and Harvard	BRD-K99626027			COCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cc(F)ccc3F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C27H35F2N3O5/c1-17-12-32(13-19-10-20(28)6-8-23(19)29)18(2)15-37-24-9-7-21(30-26(33)16-35-4)11-22(24)27(34)31(3)14-25(17)36-5/h6-11,17-18,25H,12-16H2,1-5H3,(H,30,33)/t17-,18+,25+/m1/s1	ZVOSTPFCAQQCID-UZEJHQAJSA-N	519.25447765							103202
BRD-K48415574	LSM-11373		54632095	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19-,25+/m1/s1	RHXUULWZVSTJED-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc4ccncc4)C[C@H]1C	BroadT	BRD-K48415574	BRD-K48415574-001-01-3	Broad Institute of MIT and Harvard	BRD-K48415574			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-9-11-28-12-10-20)19(2)17-35-24-13-22(29-26(32)21-5-6-21)7-8-23(24)27(33)30(3)16-25(18)34-4/h7-13,18-19,21,25H,5-6,14-17H2,1-4H3,(H,29,32)/t18-,19-,25+/m1/s1	RHXUULWZVSTJED-RRQZXNHTSA-N	480.273655672							99994
BRD-K36512157	LSM-10633		54632169	InChI=1S/C24H32F3N5O6S/c1-15-10-32(39(35,36)22-12-30(3)14-28-22)16(2)13-38-19-8-17(29-21(33)9-24(25,26)27)6-7-18(19)23(34)31(4)11-20(15)37-5/h6-8,12,14-16,20H,9-11,13H2,1-5H3,(H,29,33)/t15-,16+,20-/m0/s1	ZYJJQNOXPHIYRR-YRNRMSPPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K36512157	BRD-K36512157-001-01-6	Broad Institute of MIT and Harvard	BRD-K36512157			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)c1cn(C)cn1	InChI=1S/C24H32F3N5O6S/c1-15-10-32(39(35,36)22-12-30(3)14-28-22)16(2)13-38-19-8-17(29-21(33)9-24(25,26)27)6-7-18(19)23(34)31(4)11-20(15)37-5/h6-8,12,14-16,20H,9-11,13H2,1-5H3,(H,29,33)/t15-,16+,20-/m0/s1	ZYJJQNOXPHIYRR-YRNRMSPPSA-N	575.202539084							99254
BRD-K07809895	LSM-8900		54632044	InChI=1S/C21H28N4O5/c1-13-10-22-14(2)12-29-18-9-15(24-20(26)17-7-8-23-30-17)5-6-16(18)21(27)25(3)11-19(13)28-4/h5-9,13-14,19,22H,10-12H2,1-4H3,(H,24,26)/t13-,14+,19+/m1/s1	UYCGUZMTEQILNL-TYILLQQXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3oncc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K07809895	BRD-K07809895-001-01-8	Broad Institute of MIT and Harvard	BRD-K07809895			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccno3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C21H28N4O5/c1-13-10-22-14(2)12-29-18-9-15(24-20(26)17-7-8-23-30-17)5-6-16(18)21(27)25(3)11-19(13)28-4/h5-9,13-14,19,22H,10-12H2,1-4H3,(H,24,26)/t13-,14+,19+/m1/s1	UYCGUZMTEQILNL-TYILLQQXSA-N	416.205970036							97521
BRD-K89479751	LSM-13941		54631975	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25-/m1/s1	WQZORWGHLUMPIH-MPCDZSKCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K89479751	BRD-K89479751-001-01-4	Broad Institute of MIT and Harvard	BRD-K89479751			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25-/m1/s1	WQZORWGHLUMPIH-MPCDZSKCSA-N	487.304621442							102594
MLS003650023	LSM-11910	BRD-K57519495	53382685	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22+/m0/s1	KJNJKXAQFIYZGQ-AYSMAOOMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K57519495	BRD-K57519495-001-01-6	Broad Institute of MIT and Harvard	BRD-K57519495			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H30F2N4O4/c1-14-11-27-15(2)13-34-21-8-6-17(10-18(21)23(31)30(3)12-22(14)33-4)28-24(32)29-20-9-16(25)5-7-19(20)26/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22+/m0/s1	KJNJKXAQFIYZGQ-AYSMAOOMSA-N	476.22351188							100536
BRD-K44097254	LSM-11121		54632009	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18-,22-/m0/s1	RUFIKNIWNRYTLQ-SPEDKVCISA-N	CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K44097254	BRD-K44097254-001-01-0	Broad Institute of MIT and Harvard	BRD-K44097254			CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18-,22-/m0/s1	RUFIKNIWNRYTLQ-SPEDKVCISA-N	476.29987042							99742
BRD-K93672121	LSM-14172		54632052	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19-/m1/s1	FSHWRMSUZBSSQF-ZRGWGRIASA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K93672121	BRD-K93672121-001-01-1	Broad Institute of MIT and Harvard	BRD-K93672121			CCCNC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-18-17(10-16)20(26)25(4)12-19(28-5)14(2)11-23-15(3)13-29-18/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19-/m1/s1	FSHWRMSUZBSSQF-ZRGWGRIASA-N	406.258005608							102826
BRD-K62060607	LSM-12195		54632114	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16-,21-/m0/s1	LPOPNFSKLDAMKV-QYWGDWMGSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K62060607	BRD-K62060607-001-01-9	Broad Institute of MIT and Harvard	BRD-K62060607			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C24H34F3N3O4/c1-15-12-30(10-9-24(25,26)27)16(2)14-34-20-8-7-18(28-22(31)17-5-6-17)11-19(20)23(32)29(3)13-21(15)33-4/h7-8,11,15-17,21H,5-6,9-10,12-14H2,1-4H3,(H,28,31)/t15-,16-,21-/m0/s1	LPOPNFSKLDAMKV-QYWGDWMGSA-N	485.250141198							100821
BRD-K93369639	LSM-14154		54632215	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18-,23+/m0/s1	ITUDOLAPOXZKHG-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K93369639	BRD-K93369639-001-01-9	Broad Institute of MIT and Harvard	BRD-K93369639			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O5S/c1-17-13-25-18(2)15-32-22-11-10-20(12-21(22)24(28)27(3)14-23(17)31-4)26-33(29,30)16-19-8-6-5-7-9-19/h5-12,17-18,23,25-26H,13-16H2,1-4H3/t17-,18-,23+/m0/s1	ITUDOLAPOXZKHG-IUKKYPGJSA-N	475.214091876							102808
BRD-K73838369-001-01-3	LSM-22603	BRD-K73838369	54631937	InChI=1S/C27H39N5O4/c1-18(2)29-27(34)30-21-10-11-23-24(13-21)36-17-20(4)32(15-22-9-7-8-12-28-22)14-19(3)25(35-6)16-31(5)26(23)33/h7-13,18-20,25H,14-17H2,1-6H3,(H2,29,30,34)/t19-,20-,25+/m1/s1	YDXYYDXTJISMJT-FHAGJXEFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(Cc3ccccn3)C[C@H]1C	BroadT	BRD-K73838369	BRD-K73838369-001-01-3	Broad Institute of MIT and Harvard	BRD-K73838369			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C27H39N5O4/c1-18(2)29-27(34)30-21-10-11-23-24(13-21)36-17-20(4)32(15-22-9-7-8-12-28-22)14-19(3)25(35-6)16-31(5)26(23)33/h7-13,18-20,25H,14-17H2,1-6H3,(H2,29,30,34)/t19-,20-,25+/m1/s1	YDXYYDXTJISMJT-FHAGJXEFSA-N	497.300204778							111160
BRD-K60602279	LSM-12090		54631968	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19+,24+/m1/s1	NFKQXDUJHPCZLU-IMWIBFENSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K60602279	BRD-K60602279-001-01-7	Broad Institute of MIT and Harvard	BRD-K60602279			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-20-10-11-23-22(13-20)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-21-9-7-8-12-26-21/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19+,24+/m1/s1	NFKQXDUJHPCZLU-IMWIBFENSA-N	504.240640982							100716
BRD-K89222788	LSM-13920		54632027	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18-,22-/m1/s1	RUFIKNIWNRYTLQ-JBYIUTFZSA-N	CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	BroadT	BRD-K89222788	BRD-K89222788-001-01-5	Broad Institute of MIT and Harvard	BRD-K89222788			CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	InChI=1S/C25H40N4O5/c1-7-9-23(30)27-19-10-11-21-20(13-19)24(31)28(5)15-22(33-6)17(3)14-29(18(4)16-34-21)25(32)26-12-8-2/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,26,32)(H,27,30)/t17-,18-,22-/m1/s1	RUFIKNIWNRYTLQ-JBYIUTFZSA-N	476.29987042							102573
BRD-K87976657	LSM-13830		54632003	InChI=1S/C29H45N3O4/c1-20-16-32(17-22-9-6-5-7-10-22)21(2)19-36-26-15-24(30-28(33)23-11-8-12-23)13-14-25(26)29(34)31(3)18-27(20)35-4/h13-15,20-23,27H,5-12,16-19H2,1-4H3,(H,30,33)/t20-,21-,27+/m1/s1	ZYUAJIZJWFLNII-GNMOFYLKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(CC4CCCCC4)C[C@H]1C	BroadT	BRD-K87976657	BRD-K87976657-001-01-6	Broad Institute of MIT and Harvard	BRD-K87976657			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(CC2CCCCC2)C[C@H]1C	InChI=1S/C29H45N3O4/c1-20-16-32(17-22-9-6-5-7-10-22)21(2)19-36-26-15-24(30-28(33)23-11-8-12-23)13-14-25(26)29(34)31(3)18-27(20)35-4/h13-15,20-23,27H,5-12,16-19H2,1-4H3,(H,30,33)/t20-,21-,27+/m1/s1	ZYUAJIZJWFLNII-GNMOFYLKSA-N	499.34100695							102480
PRESTWICK3_000813	LSM-1335	Bucladesine	23874512	InChI=1S/C18H24N5O8P/c1-3-5-11(24)22-15-13-16(20-8-19-15)23(9-21-13)17-14(29-12(25)6-4-2)10-7-28-32(26,27)31-18(10)30-17/h8-10,14,17-18H,3-7H2,1-2H3,(H,26,27)(H,19,20,22,24)/t10-,14+,17+,18+/m0/s1	ZKSUYDZTGVUZGX-VBJMPTANSA-N	CCCC(=O)Nc1ncnc2c1ncn2[C@@H]3O[C@@H]4OP(=O)(O)OC[C@H]4[C@H]3OC(=O)CCC	BroadT	BRD-A15070535	BRD-A15070535-323-02-1	Prestwick Chemical Inc.	Prestw-813	D0701-MP04-ST03-200-	O.[Na]	CCCC(=O)Nc1ncnc2n(cnc12)[C@@H]1O[C@@H]2OP(O)(=O)OC[C@H]2[C@H]1OC(=O)CCC.O.[Na]	InChI=1S/C18H24N5O8P.Na.H2O.H/c1-3-5-11(24)22-15-13-16(20-8-19-15)23(9-21-13)17-14(29-12(25)6-4-2)10-7-28-32(26,27)31-18(10)30-17;;;/h8-10,14,17-18H,3-7H2,1-2H3,(H,26,27)(H,19,20,22,24);;1H2;/t10-,14+,17+,18+;;;/m0.../s1	BZDZSQPHHHGALL-AJKXEZEVSA-N	469.136249288							91546, 91546
Ornidazole	LSM-1548	Ornidazole, RO-70207	28061	InChI=1S/C7H10ClN3O3/c1-5-9-3-7(11(13)14)10(5)4-6(12)2-8/h3,6,12H,2,4H2,1H3	IPWKIXLWTCNBKN-UHFFFAOYSA-N	Cc1ncc([N+](=O)[O-])n1CC(O)CCl	BroadT	BRD-A42759514	BRD-A42759514-001-03-1	Prestwick Chemical Inc.	Prestw-164	D0701-MP04-ST03-200-		Cc1ncc(n1CC(O)CCl)[N+]([O-])=O	InChI=1S/C7H10ClN3O3/c1-5-9-3-7(11(13)14)10(5)4-6(12)2-8/h3,6,12H,2,4H2,1H3	IPWKIXLWTCNBKN-UHFFFAOYSA-N	219.04106892							75176
Tolperisone	LSM-4381	Tolperisone, Mydeton, N-553 [As Hydrochloride], Tolperisone HCl	5511	InChI=1S/C16H23NO/c1-13-6-8-15(9-7-13)16(18)14(2)12-17-10-4-3-5-11-17/h6-9,14H,3-5,10-12H2,1-2H3	FSKFPVLPFLJRQB-UHFFFAOYSA-N	CC(CN1CCCCC1)C(=O)c2ccc(C)cc2	BroadT	BRD-A27732521	BRD-A27732521-003-02-6	MicroSource Discovery Systems Inc.	1501194		Cl	CC(CN1CCCCC1)C(=O)c1ccc(C)cc1.Cl	InChI=1S/C16H23NO.ClH/c1-13-6-8-15(9-7-13)16(18)14(2)12-17-10-4-3-5-11-17;/h6-9,14H,3-5,10-12H2,1-2H3;1H	ZBUVYROEHQQAKL-UHFFFAOYSA-N	245.177964366							93835, 93835, 93835
Ovasterol-beta	LSM-1488	Estradiol-Benzoate, Estradiol Benzoate	3262	InChI=1S/C25H28O3/c1-25-14-13-20-19-10-8-18(28-24(27)16-5-3-2-4-6-16)15-17(19)7-9-21(20)22(25)11-12-23(25)26/h2-6,8,10,15,20-23,26H,7,9,11-14H2,1H3	UYIFTLBWAOGQBI-UHFFFAOYSA-N	CC12CCC3C(CCc4cc(OC(=O)c5ccccc5)ccc34)C1CCC2O	BroadT	BRD-A36066264	BRD-A36066264-001-02-3	MicroSource Discovery Systems Inc.	1501182			CC12CCC3C(CCc4cc(OC(=O)c5ccccc5)ccc34)C1CCC2O	InChI=1S/C25H28O3/c1-25-14-13-20-19-10-8-18(28-24(27)16-5-3-2-4-6-16)15-17(19)7-9-21(20)22(25)11-12-23(25)26/h2-6,8,10,15,20-23,26H,7,9,11-14H2,1H3	UYIFTLBWAOGQBI-UHFFFAOYSA-N	376.203844756							91653
Doxazosin	LSM-4335	Cardura, Doxazosin	3157	InChI=1S/C23H25N5O5/c1-30-18-11-14-15(12-19(18)31-2)25-23(26-21(14)24)28-9-7-27(8-10-28)22(29)20-13-32-16-5-3-4-6-17(16)33-20/h3-6,11-12,20H,7-10,13H2,1-2H3,(H2,24,25,26)	RUZYUOTYCVRMRZ-UHFFFAOYSA-N	COc1cc2nc(nc(N)c2cc1OC)N3CCN(CC3)C(=O)C4COc5ccccc5O4	BroadT	BRD-A13188892	BRD-A13188892-066-03-3	Prestwick Chemical Inc.	Prestw-858	D0701-MP04-ST03-200-	CS(=O)(=O)O	COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)C1COc2ccccc2O1.CS(=O)(=O)O	InChI=1S/C23H25N5O5.CH4O3S/c1-30-18-11-14-15(12-19(18)31-2)25-23(26-21(14)24)28-9-7-27(8-10-28)22(29)20-13-32-16-5-3-4-6-17(16)33-20;1-5(2,3)4/h3-6,11-12,20H,7-10,13H2,1-2H3,(H2,24,25,26);1H3,(H,2,3,4)	VJECBOKJABCYMF-UHFFFAOYSA-N	451.18556895							4708, 4708
Strychnine	LSM-1293		5702135	InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16?,17?,19-,20?,21+/m0/s1	QMGVPVSNSZLJIA-OFYMUHMXSA-N	O=C1CC2OCC=C3CN4CC[C@@]56C4C[C@@H]3[C@@H]2C5N1c7ccccc67	BroadT	BRD-A09094913	BRD-A09094913-001-02-3	MicroSource Discovery Systems Inc.	1500651			O=C1CC2OCC=C3CN4CC[C@@]56C4C[C@@H]3[C@@H]2C5N1c1ccccc61	InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16?,17?,19-,20?,21+/m0/s1	QMGVPVSNSZLJIA-OFYMUHMXSA-N	334.168127964							91513
Telithromycin	LSM-4342		23958736	InChI=1S/C43H65N5O10/c1-12-33-43(8)37(48(41(53)58-43)19-14-13-18-47-23-31(45-24-47)30-16-15-17-44-22-30)27(4)34(49)25(2)21-42(7,54-11)38(28(5)35(50)29(6)39(52)56-33)57-40-36(51)32(46(9)10)20-26(3)55-40/h15-17,22-29,32-33,36-38,40,51H,12-14,18-21H2,1-11H3/t25-,26-,27+,28+,29-,32+,33?,36-,37-,38-,40?,42-,43+/m1/s1	LJVAJPDWBABPEJ-HKEYBQESSA-N	CCC1OC(=O)[C@H](C)C(=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@](C)(C[C@@H](C)C(=O)[C@H](C)[C@H]3N(CCCCn4cnc(c4)c5cccnc5)C(=O)O[C@@]13C)OC	BroadT	BRD-A15798299	BRD-A15798299-001-01-7	MicroSource Discovery Systems Inc.	1505265			CCC1OC(=O)[C@H](C)C(=O)[C@H](C)[C@@H](OC2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@](C)(C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCCCn3cnc(c3)-c3cccnc3)C(=O)O[C@@]12C)OC	InChI=1S/C43H65N5O10/c1-12-33-43(8)37(48(41(53)58-43)19-14-13-18-47-23-31(45-24-47)30-16-15-17-44-22-30)27(4)34(49)25(2)21-42(7,54-11)38(28(5)35(50)29(6)39(52)56-33)57-40-36(51)32(46(9)10)20-26(3)55-40/h15-17,22-29,32-33,36-38,40,51H,12-14,18-21H2,1-11H3/t25-,26-,27+,28+,29-,32+,33?,36-,37-,38-,40?,42-,43+/m1/s1	LJVAJPDWBABPEJ-HKEYBQESSA-N	811.473143330001							
Tenoxicam	LSM-1396		9927768	InChI=1S/C13H11N3O4S2/c1-16-10(13(18)15-9-4-2-3-6-14-9)11(17)12-8(5-7-21-12)22(16,19)20/h2-7,10H,1H3,(H,14,15,18)	OTGJPAOGHQFBMI-UHFFFAOYSA-N	CN1C(C(=O)Nc2ccccn2)C(=O)c3sccc3S1(=O)=O	BroadT	BRD-A22844106	BRD-A22844106-001-04-7	MicroSource Discovery Systems Inc.	1503142			CN1C(C(=O)Nc2ccccn2)C(=O)c2sccc2S1(=O)=O	InChI=1S/C13H11N3O4S2/c1-16-10(13(18)15-9-4-2-3-6-14-9)11(17)12-8(5-7-21-12)22(16,19)20/h2-7,10H,1H3,(H,14,15,18)	OTGJPAOGHQFBMI-UHFFFAOYSA-N	337.019097242							91590
C24H30O6	LSM-1524	BRD-A39969961	21865526	InChI=1S/C24H30O6/c1-21-7-4-14(25)10-13(21)11-15(20(27)28-3)19-16-5-8-23(9-6-18(26)30-23)22(16,2)12-17-24(19,21)29-17/h10,15-17,19H,4-9,11-12H2,1-3H3	JUKPWJGBANNWMW-UHFFFAOYSA-N	COC(=O)C1CC2=CC(=O)CCC2(C)C34OC3CC5(C)C(CCC56CCC(=O)O6)C14	BroadT	BRD-A39969961	BRD-A39969961-001-01-3	Tocris Bioscience	2397	1		COC(=O)C1CC2=CC(=O)CCC2(C)C23OC2CC2(C)C(CCC22CCC(=O)O2)C13	InChI=1S/C24H30O6/c1-21-7-4-14(25)10-13(21)11-15(20(27)28-3)19-16-5-8-23(9-6-18(26)30-23)22(16,2)12-17-24(19,21)29-17/h10,15-17,19H,4-9,11-12H2,1-3H3	JUKPWJGBANNWMW-UHFFFAOYSA-N	414.20423868							91683
SPBIO_000455	LSM-4312	Tridesacetoxykhivorin	6708676	InChI=1S/C26H36O7/c1-22(2)15-10-18(29)25(5)14(24(15,4)17(28)11-16(22)27)6-8-23(3)19(13-7-9-31-12-13)32-21(30)20-26(23,25)33-20/h7,9,12,14-20,27-29H,6,8,10-11H2,1-5H3/t14?,15?,16-,17+,18-,19+,20-,23+,24-,25+,26-/m1/s1	MGQUMSFBIYXTTE-FIYJXLSPSA-N	CC1(C)[C@H](O)C[C@H](O)[C@@]2(C)C1C[C@@H](O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@@]345)c6cocc6	BroadT	BRD-A05422420	BRD-A05422420-001-02-6	MicroSource Discovery Systems Inc.	100576			CC1(C)[C@H](O)C[C@H](O)[C@@]2(C)C1C[C@@H](O)[C@]1(C)C2CC[C@@]2(C)[C@@H](OC(=O)[C@H]3O[C@@]123)c1ccoc1	InChI=1S/C26H36O7/c1-22(2)15-10-18(29)25(5)14(24(15,4)17(28)11-16(22)27)6-8-23(3)19(13-7-9-31-12-13)32-21(30)20-26(23,25)33-20/h7,9,12,14-20,27-29H,6,8,10-11H2,1-5H3/t14?,15?,16-,17+,18-,19+,20-,23+,24-,25+,26-/m1/s1	MGQUMSFBIYXTTE-FIYJXLSPSA-N	460.246103492							
KBIO1_001044	LSM-4373	3-Beta-Hydroxydeoxodihydrogedunin	6708504	InChI=1S/C28H38O7/c1-15(29)33-20-13-18-24(2,3)19(30)8-10-25(18,4)17-7-11-26(5)21(16-9-12-32-14-16)34-23(31)22-28(26,35-22)27(17,20)6/h9,12,14,17-22,30H,7-8,10-11,13H2,1-6H3/t17?,18?,19-,20+,21-,22+,25+,26-,27-,28+/m0/s1	IVHWWYNBMIROCV-CNUJFAARSA-N	CC(=O)O[C@@H]1CC2C(C)(C)[C@@H](O)CC[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@@]45[C@]13C)c6cocc6	BroadT	BRD-A24524033	BRD-A24524033-001-02-5	MicroSource Discovery Systems Inc.	100492			CC(=O)O[C@@H]1CC2C(C)(C)[C@@H](O)CC[C@]2(C)C2CC[C@@]3(C)[C@@H](OC(=O)[C@H]4O[C@@]34[C@]12C)c1ccoc1	InChI=1S/C28H38O7/c1-15(29)33-20-13-18-24(2,3)19(30)8-10-25(18,4)17-7-11-26(5)21(16-9-12-32-14-16)34-23(31)22-28(26,35-22)27(17,20)6/h9,12,14,17-22,30H,7-8,10-11,13H2,1-6H3/t17?,18?,19-,20+,21-,22+,25+,26-,27-,28+/m0/s1	IVHWWYNBMIROCV-CNUJFAARSA-N	486.261753556							
CGP-12177	LSM-1474	CGP-12177, BRD-A34706053	2687	InChI=1S/C14H21N3O3/c1-14(2,3)15-7-9(18)8-20-11-6-4-5-10-12(11)17-13(19)16-10/h4-6,9,15,18H,7-8H2,1-3H3,(H2,16,17,19)	UMQUQWCJKFOUGV-UHFFFAOYSA-N	CC(C)(C)NCC(O)COc1cccc2NC(=O)Nc12	BroadT	BRD-A34706053	BRD-A34706053-003-01-9	Tocris Bioscience	1134	4	Cl	CC(C)(C)NCC(O)COc1cccc2[nH]c(=O)[nH]c12.Cl	InChI=1S/C14H21N3O3.ClH/c1-14(2,3)15-7-9(18)8-20-11-6-4-5-10-12(11)17-13(19)16-10;/h4-6,9,15,18H,7-8H2,1-3H3,(H2,16,17,19);1H	YQVFCYCTITZLSX-UHFFFAOYSA-N	279.158291562							73288, 73288
Necrostatin	LSM-1494	Necrostatin, Necrostatin-1, Necrostatin 1	2828334	InChI=1S/C13H13N3OS/c1-16-12(17)11(15-13(16)18)6-8-7-14-10-5-3-2-4-9(8)10/h2-5,7,11,14H,6H2,1H3,(H,15,18)	TXUWMXQFNYDOEZ-UHFFFAOYSA-N	CN1C(=S)NC(Cc2c[nH]c3ccccc23)C1=O	BroadT	BRD-A36318220	BRD-A36318220-001-01-3	Tocris Bioscience	2324	1		CN1C(=S)NC(Cc2c[nH]c3ccccc23)C1=O	InChI=1S/C13H13N3OS/c1-16-12(17)11(15-13(16)18)6-8-7-14-10-5-3-2-4-9(8)10/h2-5,7,11,14H,6H2,1H3,(H,15,18)	TXUWMXQFNYDOEZ-UHFFFAOYSA-N	259.077932756							91658
Imiloxan	LSM-1308	Imiloxan, BRD-A10903566	133621	InChI=1S/C14H16N2O2/c1-2-16-8-7-15-14(16)9-11-10-17-12-5-3-4-6-13(12)18-11/h3-8,11H,2,9-10H2,1H3	UXABARREKCJULM-UHFFFAOYSA-N	CCn1ccnc1CC2COc3ccccc3O2	BroadT	BRD-A10903566	BRD-A10903566-003-02-8	Tocris Bioscience	986	4	Cl	CCn1ccnc1CC1COc2ccccc2O1.Cl	InChI=1S/C14H16N2O2.ClH/c1-2-16-8-7-15-14(16)9-11-10-17-12-5-3-4-6-13(12)18-11;/h3-8,11H,2,9-10H2,1H3;1H	ANDJPJNFVJXEKX-UHFFFAOYSA-N	244.121177772							91522, 91522
Homatropine	LSM-1299	Homatropine, Homatropine Hydrobromide		InChI=1S/C16H21NO3/c1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11/h2-6,12-15,18H,7-10H2,1H3/t12-,13?,14+,15?/m0/s1	ZTVIKZXZYLEVOL-FGZQJIAISA-N	CN1[C@H]2CCC1C[C@@H](C2)OC(=O)C(O)c3ccccc3	BroadT	BRD-A09539288	BRD-A09539288-004-02-8	MicroSource Discovery Systems Inc.	1500332		Br	CN1C2CC[C@H]1C[C@H](C2)OC(=O)C(O)c1ccccc1.Br	InChI=1S/C16H21NO3.BrH/c1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11;/h2-6,12-15,18H,7-10H2,1H3;1H/t12-,13?,14+,15?;/m0./s1	DWSGTFTVBLXELC-YPNZXITFSA-N	275.152143542							
Mesoridazine	LSM-1329		4078	InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3	SLVMESMUVMCQIY-UHFFFAOYSA-N	CN1CCCCC1CCN2c3ccccc3Sc4ccc(cc24)S(=O)C	BroadT	BRD-A14395271	BRD-A14395271-001-01-5	Biomol International Inc.	NS-531	2812-3-N1298		CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O	InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3	SLVMESMUVMCQIY-UHFFFAOYSA-N	386.148654852							6780, 6780
Deoxykhivorin	LSM-4425		6708722	InChI=1S/C32H42O9/c1-17(33)38-24-15-26(40-19(3)35)31(7)21-9-11-30(6)23(14-27(36)41-28(30)20-10-12-37-16-20)32(21,8)25(39-18(2)34)13-22(31)29(24,4)5/h10,12,14,16,21-22,24-26,28H,9,11,13,15H2,1-8H3/t21?,22?,24-,25-,26+,28+,30-,31-,32-/m1/s1	SUQFMFHTLHMZNM-SLBLICBISA-N	CC(=O)O[C@@H]1C[C@H](OC(=O)C)[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]3(C)[C@@H](CC2C1(C)C)OC(=O)C)c5cocc5	BroadT	BRD-A39660642	BRD-A39660642-001-02-3	MicroSource Discovery Systems Inc.	100139			CC(=O)O[C@@H]1C[C@H](OC(C)=O)[C@@]2(C)C(C[C@@H](OC(C)=O)[C@]3(C)C2CC[C@@]2(C)[C@@H](OC(=O)C=C32)c2ccoc2)C1(C)C	InChI=1S/C32H42O9/c1-17(33)38-24-15-26(40-19(3)35)31(7)21-9-11-30(6)23(14-27(36)41-28(30)20-10-12-37-16-20)32(21,8)25(39-18(2)34)13-22(31)29(24,4)5/h10,12,14,16,21-22,24-26,28H,9,11,13,15H2,1-8H3/t21?,22?,24-,25-,26+,28+,30-,31-,32-/m1/s1	SUQFMFHTLHMZNM-SLBLICBISA-N	570.282882924							
Procaterol	LSM-1391		4916	InChI=1S/C16H22N2O3/c1-4-12(17-9(2)3)16(21)11-5-7-13(19)15-10(11)6-8-14(20)18-15/h5-9,12,16-17,19,21H,4H2,1-3H3,(H,18,20)	FKNXQNWAXFXVNW-UHFFFAOYSA-N	CCC(NC(C)C)C(O)c1ccc(O)c2NC(=O)C=Cc12	BroadT	BRD-A22684332	BRD-A22684332-003-02-3	MicroSource Discovery Systems Inc.	1503232		Cl	CCC(NC(C)C)C(O)c1ccc(O)c2[nH]c(=O)ccc12.Cl	InChI=1S/C16H22N2O3.ClH/c1-4-12(17-9(2)3)16(21)11-5-7-13(19)15-10(11)6-8-14(20)18-15;/h5-9,12,16-17,19,21H,4H2,1-3H3,(H,18,20);1H	AEQDBKHAAWUCMT-UHFFFAOYSA-N	290.163042584							91585, 91585
7-OH-PIPAT	LSM-42809	Trans-7-Hydroxy-Pipat, SID26751851	6305587	InChI=1S/C16H22INO/c1-2-9-18(10-3-8-17)15-6-4-13-5-7-16(19)12-14(13)11-15/h3,5,7-8,12,15,19H,2,4,6,9-11H2,1H3/b8-3+	RTMIJLQPWFKAFE-FPYGCLRLSA-N	CCCN(C\C=C\I)C1CCc2ccc(O)cc2C1	BroadT	BRD-A01295252	BRD-A01295252-001-01-5	Biomol International Inc.	D-106	2812-3-N1298		CCCN(C\C=C\I)C1CCc2ccc(O)cc2C1	InChI=1S/C16H22INO/c1-2-9-18(10-3-8-17)15-6-4-13-5-7-16(19)12-14(13)11-15/h3,5,7-8,12,15,19H,2,4,6,9-11H2,1H3/b8-3+	RTMIJLQPWFKAFE-FPYGCLRLSA-N	371.074607334							64137
AC1NPD0F	LSM-1463	BRD-A32949107	5202074	InChI=1S/C21H22N2O6/c1-5-10-22-13(2)18(17(25)9-11-24)20(19(14(22)3)21(26)27-4)15-7-6-8-16(12-15)23-28-29-23/h1,6-8,12,20,24H,9-11H2,2-4H3	VNIMHBLANIQWNY-UHFFFAOYSA-N	COC(=O)C1=C(C)N(CC#C)C(=C(C1c2cccc(c2)n3oo3)C(=O)CCO)C	BroadT	BRD-A32949107	BRD-A32949107-001-01-7	Tocris Bioscience	1866	2		COC(=O)C1=C(C)N(CC#C)C(C)=C(C1c1cccc(c1)-n1oo1)C(=O)CCO	InChI=1S/C21H22N2O6/c1-5-10-22-13(2)18(17(25)9-11-24)20(19(14(22)3)21(26)27-4)15-7-6-8-16(12-15)23-28-29-23/h1,6-8,12,20,24H,9-11H2,2-4H3	VNIMHBLANIQWNY-UHFFFAOYSA-N	398.147786444							91636
AC1L1BPF	LSM-22604	BRD-A16827030	1547	InChI=1S/C15H20ClN5O4/c16-15-19-12(18-7-3-1-2-4-7)9-13(20-15)21(6-17-9)14-11(24)10(23)8(5-22)25-14/h6-8,10-11,14,22-24H,1-5H2,(H,18,19,20)	XSMYYYQVWPZWIZ-UHFFFAOYSA-N	OCC1OC(C(O)C1O)n2cnc3c(NC4CCCC4)nc(Cl)nc23	BroadT	BRD-A16827030	BRD-A16827030-001-01-7	Tocris Bioscience	1705	3		OCC1OC(C(O)C1O)n1cnc2c(NC3CCCC3)nc(Cl)nc12	InChI=1S/C15H20ClN5O4/c16-15-19-12(18-7-3-1-2-4-7)9-13(20-15)21(6-17-9)14-11(24)10(23)8(5-22)25-14/h6-8,10-11,14,22-24H,1-5H2,(H,18,19,20)	XSMYYYQVWPZWIZ-UHFFFAOYSA-N	369.12038188							111161
Safrolglycol	LSM-1505	SID26749447	97807	InChI=1S/C10H12O4/c11-5-8(12)3-7-1-2-9-10(4-7)14-6-13-9/h1-2,4,8,11-12H,3,5-6H2	FYDVPEVHFUBOJG-UHFFFAOYSA-N	OCC(O)Cc1ccc2OCOc2c1	BroadT	BRD-A37867643	BRD-A37867643-001-02-5	AnalytiCon Discovery GmbH	NP-010086			OCC(O)Cc1ccc2OCOc2c1	InChI=1S/C10H12O4/c11-5-8(12)3-7-1-2-9-10(4-7)14-6-13-9/h1-2,4,8,11-12H,3,5-6H2	FYDVPEVHFUBOJG-UHFFFAOYSA-N	196.073558864							91667
Dehydroabietylamine	LSM-15609	BRD-A27080191	118215	InChI=1S/C20H31N/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12,14,18H,5,7,9-11,13,21H2,1-4H3/t18?,19-,20+/m0/s1	JVVXZOOGOGPDRZ-NRRUETGQSA-N	CC(C)c1ccc2c(CCC3[C@](C)(CN)CCC[C@]23C)c1	BroadT	BRD-A27080191	BRD-A27080191-065-02-8	MicroSource Discovery Systems Inc.	1504234		OS(=O)(=O)O	CC(C)c1ccc2c(CCC3[C@](C)(CN)CCC[C@]23C)c1.OS(=O)(=O)O	InChI=1S/C20H31N.H2O4S/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4;1-5(2,3)4/h6,8,12,14,18H,5,7,9-11,13,21H2,1-4H3;(H2,1,2,3,4)/t18?,19-,20+;/m0./s1	FDYFHDKFDSGDKM-MGPZMBRGSA-N	285.245650002							104244, 104244
MR-16728	LSM-1443	SID26751758, BRD-A30590053	378811	InChI=1S/C23H36N2O/c26-23(24-16-11-19-25-17-9-1-2-10-18-25)22(20-12-5-3-6-13-20)21-14-7-4-8-15-21/h3,5-6,12-13,21-22H,1-2,4,7-11,14-19H2,(H,24,26)	AGKAAJMNNVUNDK-UHFFFAOYSA-N	O=C(NCCCN1CCCCCC1)C(C2CCCCC2)c3ccccc3	BroadT	BRD-A30590053	BRD-A30590053-003-01-1	Tocris Bioscience	537	1	Cl	O=C(NCCCN1CCCCCC1)C(C1CCCCC1)c1ccccc1.Cl	InChI=1S/C23H36N2O.ClH/c26-23(24-16-11-19-25-17-9-1-2-10-18-25)22(20-12-5-3-6-13-20)21-14-7-4-8-15-21;/h3,5-6,12-13,21-22H,1-2,4,7-11,14-19H2,(H,24,26);1H	QLMQSFIGPVLVAO-UHFFFAOYSA-N	356.282763792							91621
Warfarin	LSM-1405	Warfarin	54678486	InChI=1S/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3	PJVWKTKQMONHTI-UHFFFAOYSA-N	CC(=O)CC(C1=C(O)c2ccccc2OC1=O)c3ccccc3	BroadT	BRD-A24514565	BRD-A24514565-236-01-6	ChemBridge Corporation	5103026		[Na]	CC(=O)CC(c1ccccc1)c1c(O)c2ccccc2oc1=O.[Na]	InChI=1S/C19H16O4.Na.H/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22;;/h2-10,15,21H,11H2,1H3;;	XLVCDASBUUWUJI-UHFFFAOYSA-N	308.104858992							87732, 87732, 87732
CHEMBL128444	LSM-1496	SID90340627, SID50104546, SID26751843, BRD-A37347161	5244802	InChI=1S/C18H24Cl2N2O/c19-16-7-6-14(11-17(16)20)12-18(23)22-10-2-1-5-15(22)13-21-8-3-4-9-21/h6-7,11,15H,1-5,8-10,12-13H2	GHCCBWMZKJQGLS-UHFFFAOYSA-N	Clc1ccc(CC(=O)N2CCCCC2CN3CCCC3)cc1Cl	BroadT	BRD-A37347161	BRD-A37347161-003-01-8	Tocris Bioscience	699	3	Cl	Clc1ccc(CC(=O)N2CCCCC2CN2CCCC2)cc1Cl.Cl	InChI=1S/C18H24Cl2N2O.ClH/c19-16-7-6-14(11-17(16)20)12-18(23)22-10-2-1-5-15(22)13-21-8-3-4-9-21;/h6-7,11,15H,1-5,8-10,12-13H2;1H	NGVLSOWJSUUYDE-UHFFFAOYSA-N	354.126568828							91660, 91660
Dihydrodeoxygedunin	LSM-1253		6708636	InChI=1S/C28H36O6/c1-16(29)33-22-13-19-25(2,3)21(30)8-11-26(19,4)18-7-10-27(5)20(28(18,22)6)14-23(31)34-24(27)17-9-12-32-15-17/h9,12,14-15,18-19,22,24H,7-8,10-11,13H2,1-6H3/t18?,19?,22-,24+,26-,27-,28-/m1/s1	QDBAUJQKYJXHPB-OMRKLITNSA-N	CC(=O)O[C@@H]1CC2C(C)(C)C(=O)CC[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]13C)c5cocc5	BroadT	BRD-A02713983	BRD-A02713983-001-02-0	MicroSource Discovery Systems Inc.	100434			CC(=O)O[C@@H]1CC2[C@](C)(CCC(=O)C2(C)C)C2CC[C@@]3(C)[C@@H](OC(=O)C=C3[C@]12C)c1ccoc1	InChI=1S/C28H36O6/c1-16(29)33-22-13-19-25(2,3)21(30)8-11-26(19,4)18-7-10-27(5)20(28(18,22)6)14-23(31)34-24(27)17-9-12-32-15-17/h9,12,14-15,18-19,22,24H,7-8,10-11,13H2,1-6H3/t18?,19?,22-,24+,26-,27-,28-/m1/s1	QDBAUJQKYJXHPB-OMRKLITNSA-N	468.251188872							91485
Triadimefon	LSM-4424	Triadimefon	39385	InChI=1S/C14H16ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,13H,1-3H3	WURBVZBTWMNKQT-UHFFFAOYSA-N	CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n2cncn2	BroadT	BRD-A39506880	BRD-A39506880-001-02-9	MicroSource Discovery Systems Inc.	1505307			CC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1cncn1	InChI=1S/C14H16ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,13H,1-3H3	WURBVZBTWMNKQT-UHFFFAOYSA-N	293.093104492							84002
Sulmazole	LSM-4362		5353	InChI=1S/C14H13N3O2S/c1-19-12-8-9(20(2)18)5-6-10(12)13-16-11-4-3-7-15-14(11)17-13/h3-8H,1-2H3,(H,15,16,17)	XMFCOYRWYYXZMY-UHFFFAOYSA-N	COc1cc(ccc1c2nc3ncccc3[nH]2)S(=O)C	BroadT	BRD-A22081593	BRD-A22081593-001-03-8	MicroSource Discovery Systems Inc.	1501159			COc1cc(ccc1-c1nc2ncccc2[nH]1)S(C)=O	InChI=1S/C14H13N3O2S/c1-19-12-8-9(20(2)18)5-6-10(12)13-16-11-4-3-7-15-14(11)17-13/h3-8H,1-2H3,(H,15,16,17)	XMFCOYRWYYXZMY-UHFFFAOYSA-N	287.072847376							34988
Practolol	LSM-1531	Practolol, AY-21011, ICI-50172, [3-(4-Acetylamino-Phenoxy)-2-Hydroxy-Propyl]-Isopropyl-Ammonium	4883	InChI=1S/C14H22N2O3/c1-10(2)15-8-13(18)9-19-14-6-4-12(5-7-14)16-11(3)17/h4-7,10,13,15,18H,8-9H2,1-3H3,(H,16,17)	DURULFYMVIFBIR-UHFFFAOYSA-N	CC(C)NCC(O)COc1ccc(NC(=O)C)cc1	BroadT	BRD-A41304429	BRD-A41304429-001-04-9	Prestwick Chemical Inc.	Prestw-332	D0701-MP04-ST03-200-		CC(C)NCC(O)COc1ccc(NC(C)=O)cc1	InChI=1S/C14H22N2O3/c1-10(2)15-8-13(18)9-19-14-6-4-12(5-7-14)16-11(3)17/h4-7,10,13,15,18H,8-9H2,1-3H3,(H,16,17)	DURULFYMVIFBIR-UHFFFAOYSA-N	266.163042584							258351
Carvedilol	LSM-1310	Coreg, Carvedilol, BM-14.190, BM-14-190, BM 14.190, Coreg CR, Carvedilol Tartrate	2585	InChI=1S/C24H26N2O4/c1-28-21-10-4-5-11-22(21)29-14-13-25-15-17(27)16-30-23-12-6-9-20-24(23)18-7-2-3-8-19(18)26-20/h2-12,17,25-27H,13-16H2,1H3	OGHNVEJMJSYVRP-UHFFFAOYSA-N	COc1ccccc1OCCNCC(O)COc2cccc3[nH]c4ccccc4c23	BroadT	BRD-A10977446	BRD-A10977446-001-04-8	Tocris Bioscience	2685	1		COc1ccccc1OCCNCC(O)COc1cccc2[nH]c3ccccc3c12	InChI=1S/C24H26N2O4/c1-28-21-10-4-5-11-22(21)29-14-13-25-15-17(27)16-30-23-12-6-9-20-24(23)18-7-2-3-8-19(18)26-20/h2-12,17,25-27H,13-16H2,1H3	OGHNVEJMJSYVRP-UHFFFAOYSA-N	406.189257332							3441, 3441, 3441
Homochlorcyclizine	LSM-1394	Homochlorcyclizine, Homochlorcyclizine HCl	3627	InChI=1S/C19H23ClN2/c1-21-12-5-13-22(15-14-21)19(16-6-3-2-4-7-16)17-8-10-18(20)11-9-17/h2-4,6-11,19H,5,12-15H2,1H3	WEUCDJCFJHYFRL-UHFFFAOYSA-N	CN1CCCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3	BroadT	BRD-A22769835	BRD-A22769835-300-03-2	Prestwick Chemical Inc.	Prestw-283	D0701-MP04-ST03-200-	Cl.Cl	CN1CCCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1.Cl.Cl	InChI=1S/C19H23ClN2.2ClH/c1-21-12-5-13-22(15-14-21)19(16-6-3-2-4-7-16)17-8-10-18(20)11-9-17;;/h2-4,6-11,19H,5,12-15H2,1H3;2*1H	JLVFQWFTNVMTEG-UHFFFAOYSA-N	314.154976466							91588, 91588
IDRA 21	LSM-22605	BRD-A14344385	3688	InChI=1S/C8H9ClN2O2S/c1-5-10-7-3-2-6(9)4-8(7)14(12,13)11-5/h2-5,10-11H,1H3	VZRNTCHTJRLTMU-UHFFFAOYSA-N	CC1Nc2ccc(Cl)cc2S(=O)(=O)N1	BroadT	BRD-A14344385	BRD-A14344385-001-01-6	Biomol International Inc.	AC-442	2817-N1277		CC1Nc2ccc(Cl)cc2S(=O)(=O)N1	InChI=1S/C8H9ClN2O2S/c1-5-10-7-3-2-6(9)4-8(7)14(12,13)11-5/h2-5,10-11H,1H3	VZRNTCHTJRLTMU-UHFFFAOYSA-N	232.007325948							111162
Propranolol	LSM-4329	Propranolol, Inderal, Inderide-80/25, Inderide-40/25	4946	InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3	AQHHHDLHHXJYJD-UHFFFAOYSA-N	CC(C)NCC(O)COc1cccc2ccccc12	BroadT	BRD-A10070317	BRD-A10070317-003-05-1	MicroSource Discovery Systems Inc.	1505270		Cl	CC(C)NCC(O)COc1cccc2ccccc12.Cl	InChI=1S/C16H21NO2.ClH/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16;/h3-9,12,14,17-18H,10-11H2,1-2H3;1H	ZMRUPTIKESYGQW-UHFFFAOYSA-N	259.157228922							8499, 8499
Norethindrone Acetate	LSM-1295	Norethindrone, SID50085941	5702094	InChI=1S/C22H28O3/c1-4-22(25-14(2)23)12-10-20-19-7-5-15-13-16(24)6-8-17(15)18(19)9-11-21(20,22)3/h1,13,17-20H,5-12H2,2-3H3/t17-,18?,19?,20?,21-,22-/m0/s1	IMONTRJLAWHYGT-FJMAIUEKSA-N	CC(=O)O[C@]1(CCC2C3CCC4=CC(=O)CC[C@@H]4C3CC[C@]12C)C#C	BroadT	BRD-A09349126	BRD-A09349126-001-02-4	MicroSource Discovery Systems Inc.	1500438			CC(=O)O[C@]1(CCC2C3CCC4=CC(=O)CC[C@@H]4C3CC[C@]12C)C#C	InChI=1S/C22H28O3/c1-4-22(25-14(2)23)12-10-20-19-7-5-15-13-16(24)6-8-17(15)18(19)9-11-21(20,22)3/h1,13,17-20H,5-12H2,2-3H3/t17-,18?,19?,20?,21-,22-/m0/s1	IMONTRJLAWHYGT-FJMAIUEKSA-N	340.203844756							
Sotalol	LSM-1465	Sorine, Sotalol, Betapace, MJ-1999	5253	InChI=1S/C12H20N2O3S/c1-9(2)13-8-12(15)10-4-6-11(7-5-10)14-18(3,16)17/h4-7,9,12-15H,8H2,1-3H3	ZBMZVLHSJCTVON-UHFFFAOYSA-N	CC(C)NCC(O)c1ccc(NS(=O)(=O)C)cc1	BroadT	BRD-A33168282	BRD-A33168282-003-06-5	Tocris Bioscience	952	3	Cl	CC(C)NCC(O)c1ccc(NS(C)(=O)=O)cc1.Cl	InChI=1S/C12H20N2O3S.ClH/c1-9(2)13-8-12(15)10-4-6-11(7-5-10)14-18(3,16)17;/h4-7,9,12-15H,8H2,1-3H3;1H	VIDRYROWYFWGSY-UHFFFAOYSA-N	272.11946321							63622, 63622
Mepivacaine	LSM-4306	Polocaine, Mepivacaine, Carbocaine, Polocaine-MPF	4062	InChI=1S/C15H22N2O/c1-11-7-6-8-12(2)14(11)16-15(18)13-9-4-5-10-17(13)3/h6-8,13H,4-5,9-10H2,1-3H3,(H,16,18)	INWLQCZOYSRPNW-UHFFFAOYSA-N	CN1CCCCC1C(=O)Nc2c(C)cccc2C	BroadT	BRD-A03216249	BRD-A03216249-003-02-9	MicroSource Discovery Systems Inc.	1504148		Cl	CN1CCCCC1C(=O)Nc1c(C)cccc1C.Cl	InChI=1S/C15H22N2O.ClH/c1-11-7-6-8-12(2)14(11)16-15(18)13-9-4-5-10-17(13)3;/h6-8,13H,4-5,9-10H2,1-3H3,(H,16,18);1H	RETIMRUQNCDCQB-UHFFFAOYSA-N	246.173213344							6759, 6759
Bupivacaine	LSM-4301	Sensorcaine, Marcaine, Exparel, Bupivacaine, Anekain, SKY-0402	2474	InChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21)	LEBVLXFERQHONN-UHFFFAOYSA-N	CCCCN1CCCCC1C(=O)Nc2c(C)cccc2C	BroadT	BRD-A01636364	BRD-A01636364-003-04-5	MicroSource Discovery Systems Inc.	1503818		Cl	CCCCN1CCCCC1C(=O)Nc1c(C)cccc1C.Cl	InChI=1S/C18H28N2O.ClH/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3;/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21);1H	SIEYLFHKZGLBNX-UHFFFAOYSA-N	288.220163536							77431, 77431
Iopanoic acid	LSM-1545	Telepaque, Iopanoic-Acid, Iodopanoic Acid, Iopanoic Acid, Jopanoic Acid	3735	InChI=1S/C11H12I3NO2/c1-2-5(11(16)17)3-6-7(12)4-8(13)10(15)9(6)14/h4-5H,2-3,15H2,1H3,(H,16,17)	OIRFJRBSRORBCM-UHFFFAOYSA-N	CCC(Cc1c(I)cc(I)c(N)c1I)C(=O)O	BroadT	BRD-A42628519	BRD-A42628519-001-04-1	Prestwick Chemical Inc.	Prestw-1052	D0701-MP04-ST03-200-		CCC(Cc1c(I)cc(I)c(N)c1I)C(O)=O	InChI=1S/C11H12I3NO2/c1-2-5(11(16)17)3-6-7(12)4-8(13)10(15)9(6)14/h4-5H,2-3,15H2,1H3,(H,16,17)	OIRFJRBSRORBCM-UHFFFAOYSA-N	570.800207634							5951
Homatropine Methylbromide	LSM-4438	Homatropine Methylbromide		InChI=1S/C17H24NO3/c1-18(2)13-8-9-14(18)11-15(10-13)21-17(20)16(19)12-6-4-3-5-7-12/h3-7,13-16,19H,8-11H2,1-2H3/q+1/t13-,14?,15+,16?/m0/s1	WKWOJBUWWZTUQV-JWMHWRSXSA-N	C[N+]1(C)[C@H]2CCC1C[C@@H](C2)OC(=O)C(O)c3ccccc3	BroadT	BRD-A43999749	BRD-A43999749-004-02-5	MicroSource Discovery Systems Inc.	1500333		Br	C[N+]1(C)C2CC[C@H]1C[C@H](C2)OC(=O)C(O)c1ccccc1.Br	InChI=1S/C17H24NO3.BrH/c1-18(2)13-8-9-14(18)11-15(10-13)21-17(20)16(19)12-6-4-3-5-7-12;/h3-7,13-16,19H,8-11H2,1-2H3;1H/q+1;/t13-,14?,15+,16?;/m0./s1	FUFVKLQESJNNAN-SLMONAPUSA-N	290.175618638							
Chlorpheniramine	LSM-1263	Kloromin, Phenetron, Teldrin, Isoclor, Chlorpheniramine, Chlorphenamine, Antagonate, Chlor-Trimeton	2725	InChI=1S/C16H19ClN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3	SOYKEARSMXGVTM-UHFFFAOYSA-N	CN(C)CCC(c1ccc(Cl)cc1)c2ccccn2	BroadT	BRD-A04553218	BRD-A04553218-050-03-0	Prestwick Chemical Inc.	Prestw-117	D0701-MP04-ST03-200-	OC(=O)/C=C\C(=O)O	CN(C)CCC(c1ccc(Cl)cc1)c1ccccn1.OC(=O)/C=C\C(=O)O	InChI=1S/C16H19ClN2.C4H4O4/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13;5-3(6)1-2-4(7)8/h3-9,11,15H,10,12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-	DBAKFASWICGISY-BTJKTKAUSA-N	274.123676338							52010, 52010, 52010, 52010
Epoxygedunin	LSM-4314		6708724	InChI=1S/C28H34O8/c1-13(29)33-17-11-16-24(2,3)19(30)18-21(34-18)26(16,5)15-7-9-25(4)20(14-8-10-32-12-14)35-23(31)22-28(25,36-22)27(15,17)6/h8,10,12,15-18,20-22H,7,9,11H2,1-6H3/t15?,16?,17-,18?,20+,21?,22?,25+,26-,27+,28?/m1/s1	AZGNIKZHFDJEPU-FJONONFLSA-N	CC(=O)O[C@@H]1CC2C(C)(C)C(=O)C3OC3[C@]2(C)C4CC[C@@]5(C)[C@@H](OC(=O)C6OC56[C@]14C)c7cocc7	BroadT	BRD-A06232236	BRD-A06232236-001-02-2	MicroSource Discovery Systems Inc.	100173			CC(=O)O[C@@H]1CC2C(C)(C)C(=O)C3OC3[C@]2(C)C2CC[C@@]3(C)[C@@H](OC(=O)C4OC34[C@]12C)c1ccoc1	InChI=1S/C28H34O8/c1-13(29)33-17-11-16-24(2,3)19(30)18-21(34-18)26(16,5)15-7-9-25(4)20(14-8-10-32-12-14)35-23(31)22-28(25,36-22)27(15,17)6/h8,10,12,15-18,20-22H,7,9,11H2,1-6H3/t15?,16?,17-,18?,20+,21?,22?,25+,26-,27+,28?/m1/s1	AZGNIKZHFDJEPU-FJONONFLSA-N	498.225368048							
CHEMBL1201939	LSM-1399	BRD-A23683907	4233538	InChI=1S/C19H26N2O4/c1-2-16-10-15(12-21-5-8-22-9-6-21)13-25-19(16)18(3-1)24-14-17-11-20-4-7-23-17/h1-3,10,17,20H,4-9,11-14H2	RTKDBEOSPDFLGD-UHFFFAOYSA-N	C(Oc1cccc2C=C(CN3CCOCC3)COc12)C4CNCCO4	BroadT	BRD-A23683907	BRD-A23683907-334-01-0	Tocris Bioscience	1413	2	CS(=O)(=O)O.CS(=O)(=O)O	C(Oc1cccc2C=C(CN3CCOCC3)COc12)C1CNCCO1.CS(=O)(=O)O.CS(=O)(=O)O	InChI=1S/C19H26N2O4.2CH4O3S/c1-2-16-10-15(12-21-5-8-22-9-6-21)13-25-19(16)18(3-1)24-14-17-11-20-4-7-23-17;2*1-5(2,3)4/h1-3,10,17,20H,4-9,11-14H2;2*1H3,(H,2,3,4)	WMRMIRRDPBKNMY-UHFFFAOYSA-N	346.189257332							91593, 91593
Trimipramine	LSM-1371	7162 RP, Trimipramine, Trimeproprimine, Surmontil, Trimeprimine, IL-6001	5584	InChI=1S/C20H26N2/c1-16(14-21(2)3)15-22-19-10-6-4-8-17(19)12-13-18-9-5-7-11-20(18)22/h4-11,16H,12-15H2,1-3H3	ZSCDBOWYZJWBIY-UHFFFAOYSA-N	CC(CN(C)C)CN1c2ccccc2CCc3ccccc13	BroadT	BRD-A19195498	BRD-A19195498-050-04-2	MicroSource Discovery Systems Inc.	1503117		OC(=O)/C=C\C(=O)O	CC(CN(C)C)CN1c2ccccc2CCc2ccccc12.OC(=O)/C=C\C(=O)O	InChI=1S/C20H26N2.C4H4O4/c1-16(14-21(2)3)15-22-19-10-6-4-8-17(19)12-13-18-9-5-7-11-20(18)22;5-3(6)1-2-4(7)8/h4-11,16H,12-15H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-	YDGHCKHAXOUQOS-BTJKTKAUSA-N	294.209598852							9738, 9738
6-Hydroxyangolensic acid methyl ester	LSM-22606	BRD-A15454510	6708540	InChI=1S/C27H34O8/c1-14-16-7-9-25(4)22(15-8-10-33-13-15)34-19(29)12-27(14,25)35-18-11-17(28)24(2,3)21(26(16,18)5)20(30)23(31)32-6/h8,10,13,16,18,20-22,30H,1,7,9,11-12H2,2-6H3/t16?,18-,20?,21-,22-,25-,26-,27-/m0/s1	GOYZKWCPWBKPIG-RNKBQGBYSA-N	COC(=O)C(O)[C@H]1C(C)(C)C(=O)C[C@@H]2O[C@]34CC(=O)O[C@@H](c5cocc5)[C@]3(C)CCC(C4=C)[C@]12C	BroadT	BRD-A15454510	BRD-A15454510-001-02-8	MicroSource Discovery Systems Inc.	100058			COC(=O)C(O)[C@H]1C(C)(C)C(=O)C[C@@H]2O[C@]34CC(=O)O[C@@H](c5ccoc5)[C@]3(C)CCC(C4=C)[C@]12C	InChI=1S/C27H34O8/c1-14-16-7-9-25(4)22(15-8-10-33-13-15)34-19(29)12-27(14,25)35-18-11-17(28)24(2,3)21(26(16,18)5)20(30)23(31)32-6/h8,10,13,16,18,20-22,30H,1,7,9,11-12H2,2-6H3/t16?,18-,20?,21-,22-,25-,26-,27-/m0/s1	GOYZKWCPWBKPIG-RNKBQGBYSA-N	486.225368048							
PRESTWICK3_000684	LSM-1289	Heliotrine	23930397	InChI=1S/C16H27NO5/c1-10(2)16(20,11(3)21-4)15(19)22-9-12-5-7-17-8-6-13(18)14(12)17/h5,10-11,13-14,18,20H,6-9H2,1-4H3/t11-,13+,14-,16?/m1/s1	LMFKRLGHEKVMNT-GVCFFYALSA-N	CO[C@H](C)C(O)(C(C)C)C(=O)OCC1=CCN2CC[C@H](O)[C@@H]12	BroadT	BRD-A08709697	BRD-A08709697-001-02-9	Prestwick Chemical Inc.	Prestw-684	D0701-MP04-ST03-200-		CO[C@H](C)C(O)(C(C)C)C(=O)OCC1=CCN2CC[C@H](O)[C@@H]12	InChI=1S/C16H27NO5/c1-10(2)16(20,11(3)21-4)15(19)22-9-12-5-7-17-8-6-13(18)14(12)17/h5,10-11,13-14,18,20H,6-9H2,1-4H3/t11-,13+,14-,16?/m1/s1	LMFKRLGHEKVMNT-GVCFFYALSA-N	313.188922974							91511
MLS000877024	LSM-1479	5,7,3',5'-Tetrahydroxyflavanone, Eriodictyol	11095	InChI=1S/C15H12O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,13,16-19H,6H2	SBHXYTNGIZCORC-UHFFFAOYSA-N	Oc1cc(O)c2C(=O)CC(Oc2c1)c3ccc(O)c(O)c3	BroadT	BRD-A35033682	BRD-A35033682-001-01-0	AnalytiCon Discovery GmbH	NP-001578			Oc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(O)c(O)c1	InChI=1S/C15H12O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,13,16-19H,6H2	SBHXYTNGIZCORC-UHFFFAOYSA-N	288.063388104							91645
2-Amino-5,6-dihydro-6-methyl-4H-1,3-thiazine	LSM-1426	BRD-A28318179, SID50104606, SID90340565	1534	InChI=1S/C5H10N2S/c1-4-2-3-7-5(6)8-4/h4H,2-3H2,1H3,(H2,6,7)	BATVOUKHGLKDGQ-UHFFFAOYSA-N	CC1CCN=C(N)S1	BroadT	BRD-A28318179	BRD-A28318179-003-03-6	Tocris Bioscience	871	3	Cl	CC1CCN=C(N)S1.Cl	InChI=1S/C5H10N2S.ClH/c1-4-2-3-7-5(6)8-4;/h4H,2-3H2,1H3,(H2,6,7);1H	HVJCRMIQAMEJNM-UHFFFAOYSA-N	130.05646903							91610, 91610
BRD-A26787626-001-02-9	LSM-1420	Cyclopiazonic Acid	9902313	InChI=1S/C20H20N2O3/c1-9(23)14-18(24)17-16-11-8-21-13-6-4-5-10(15(11)13)7-12(16)20(2,3)22(17)19(14)25/h4-6,8,12,14,16-17,21H,7H2,1-3H3	TZCOBUQKVNFIQF-UHFFFAOYSA-N	CC(=O)C1C(=O)C2C3C(Cc4cccc5[nH]cc3c45)C(C)(C)N2C1=O	BroadT	BRD-A26787626	BRD-A26787626-001-02-9	MicroSource Discovery Systems Inc.	1503912			CC(=O)C1C(=O)C2C3C(Cc4cccc5[nH]cc3c45)C(C)(C)N2C1=O	InChI=1S/C20H20N2O3/c1-9(23)14-18(24)17-16-11-8-21-13-6-4-5-10(15(11)13)7-12(16)20(2,3)22(17)19(14)25/h4-6,8,12,14,16-17,21H,7H2,1-3H3	TZCOBUQKVNFIQF-UHFFFAOYSA-N	336.14739252							91606
4-Phenyl-1,2,3,4-tetrahydro-isoquinoline	LSM-22607	4-Phenyl-1,2,3,4-Tetrahydroisoquinoline, SID26751854	4236593	InChI=1S/C15H15N/c1-2-6-12(7-3-1)15-11-16-10-13-8-4-5-9-14(13)15/h1-9,15-16H,10-11H2	OSZMNJRKIPAVOS-UHFFFAOYSA-N	C1NCc2ccccc2C1c3ccccc3	BroadT	BRD-A40504327	BRD-A40504327-001-01-4	Biomol International Inc.	AC-274	2812-3-N1298		C1NCc2ccccc2C1c1ccccc1	InChI=1S/C15H15N/c1-2-6-12(7-3-1)15-11-16-10-13-8-4-5-9-14(13)15/h1-9,15-16H,10-11H2	OSZMNJRKIPAVOS-UHFFFAOYSA-N	209.12044949							111163
Metitepine	LSM-4320	Methiothepin, Metitepine	4106	InChI=1S/C20H24N2S2/c1-21-9-11-22(12-10-21)18-13-15-5-3-4-6-19(15)24-20-8-7-16(23-2)14-17(18)20/h3-8,14,18H,9-13H2,1-2H3	RLJFTICUTYVZDG-UHFFFAOYSA-N	CSc1ccc2Sc3ccccc3CC(N4CCN(C)CC4)c2c1	BroadT	BRD-A07932845	BRD-A07932845-001-01-1	Biomol International Inc.	EI-167	2813-N1283		CSc1ccc2Sc3ccccc3CC(N3CCN(C)CC3)c2c1	InChI=1S/C20H24N2S2/c1-21-9-11-22(12-10-21)18-13-15-5-3-4-6-19(15)24-20-8-7-16(23-2)14-17(18)20/h3-8,14,18H,9-13H2,1-2H3	RLJFTICUTYVZDG-UHFFFAOYSA-N	356.138090168							64203, 64203, 64203
Fissinolide	LSM-4386		6708523	InChI=1S/C29H36O8/c1-15(30)36-26-18-11-17-19(29(5,24(18)33)21(27(26,2)3)13-22(31)34-6)7-9-28(4)20(17)12-23(32)37-25(28)16-8-10-35-14-16/h8,10,14,18-19,21,25-26H,7,9,11-13H2,1-6H3/t18-,19?,21+,25+,26+,28-,29-/m1/s1	YOTCKRFNSMJTGD-PSWUJVJRSA-N	COC(=O)C[C@H]1C(C)(C)[C@@H](OC(=O)C)[C@@H]2CC3=C4CC(=O)O[C@@H](c5cocc5)[C@]4(C)CCC3[C@@]1(C)C2=O	BroadT	BRD-A29371732	BRD-A29371732-001-02-0	MicroSource Discovery Systems Inc.	100031			COC(=O)C[C@H]1C(C)(C)[C@@H](OC(C)=O)[C@@H]2CC3=C4CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CCC3[C@@]1(C)C2=O	InChI=1S/C29H36O8/c1-15(30)36-26-18-11-17-19(29(5,24(18)33)21(27(26,2)3)13-22(31)34-6)7-9-28(4)20(17)12-23(32)37-25(28)16-8-10-35-14-16/h8,10,14,18-19,21,25-26H,7,9,11-13H2,1-6H3/t18-,19?,21+,25+,26+,28-,29-/m1/s1	YOTCKRFNSMJTGD-PSWUJVJRSA-N	512.241018112							93838
Cyclothiazide	LSM-4421	35483, Anhydron, Cyclothiazide, Fluidil	2910	InChI=1S/C14H16ClN3O4S2/c15-10-5-11-13(6-12(10)23(16,19)20)24(21,22)18-14(17-11)9-4-7-1-2-8(9)3-7/h1-2,5-9,14,17-18H,3-4H2,(H2,16,19,20)	BOCUKUHCLICSIY-UHFFFAOYSA-N	NS(=O)(=O)c1cc2c(NC(NS2(=O)=O)C3CC4CC3C=C4)cc1Cl	BroadT	BRD-A38675539	BRD-A38675539-001-01-0	Biomol International Inc.	AC-441	2817-N1277		NS(=O)(=O)c1cc2c(NC(NS2(=O)=O)C2CC3CC2C=C3)cc1Cl	InChI=1S/C14H16ClN3O4S2/c15-10-5-11-13(6-12(10)23(16,19)20)24(21,22)18-14(17-11)9-4-7-1-2-8(9)3-7/h1-2,5-9,14,17-18H,3-4H2,(H2,16,19,20)	BOCUKUHCLICSIY-UHFFFAOYSA-N	389.027075112							31448
BDBM37533	LSM-4407	Demeclocycline	10050129	InChI=1S/C21H21ClN2O8/c1-24(2)14-7-5-6-10(16(27)12-9(25)4-3-8(22)11(12)15(6)26)18(29)21(7,32)19(30)13(17(14)28)20(23)31/h3-4,6-7,10,13-15,25-26,32H,5H2,1-2H3,(H2,23,31)/t6-,7-,10?,13?,14-,15-,21-/m0/s1	JHOHXJYRVSLQCB-AMESULRKSA-N	CN(C)[C@H]1[C@@H]2C[C@@H]3[C@H](O)c4c(Cl)ccc(O)c4C(=O)C3C(=O)[C@]2(O)C(=O)C(C(=O)N)C1=O	BroadT	BRD-A34145622	BRD-A34145622-003-04-6	MicroSource Discovery Systems Inc.	1500226		Cl	CN(C)[C@H]1[C@@H]2C[C@@H]3[C@H](O)c4c(Cl)ccc(O)c4C(=O)C3C(=O)[C@]2(O)C(=O)C(C(N)=O)C1=O.Cl	InChI=1S/C21H21ClN2O8.ClH/c1-24(2)14-7-5-6-10(16(27)12-9(25)4-3-8(22)11(12)15(6)26)18(29)21(7,32)19(30)13(17(14)28)20(23)31;/h3-4,6-7,10,13-15,25-26,32H,5H2,1-2H3,(H2,23,31);1H/t6-,7-,10?,13?,14-,15-,21-;/m0./s1	YBBPAVFLBSUQKB-VLSDTTAHSA-N	464.098643362							
KBIO2_006255	LSM-22608	BRD-A37056613	6708548	InChI=1S/C23H32O4/c1-13(24)18-7-8-19-17-6-5-15-11-16(27-14(2)25)9-10-22(15,3)20(17)12-21(26)23(18,19)4/h7,15-17,19-20H,5-6,8-12H2,1-4H3/t15-,16-,17?,19?,20?,22-,23+/m0/s1	MPXJSJVWSXWSNI-JHMAQGQSSA-N	CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CCC3C4CC=C(C(=O)C)[C@@]4(C)C(=O)CC23)C1	BroadT	BRD-A37056613	BRD-A37056613-001-02-1	MicroSource Discovery Systems Inc.	100580			CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CCC3C4CC=C(C(C)=O)[C@@]4(C)C(=O)CC23)C1	InChI=1S/C23H32O4/c1-13(24)18-7-8-19-17-6-5-15-11-16(27-14(2)25)9-10-22(15,3)20(17)12-21(26)23(18,19)4/h7,15-17,19-20H,5-6,8-12H2,1-4H3/t15-,16-,17?,19?,20?,22-,23+/m0/s1	MPXJSJVWSXWSNI-JHMAQGQSSA-N	372.230059504							111164
SDZ WAG 994	LSM-1448	SID50112874, BRD-A31007383	18755269	InChI=1S/C17H25N5O4/c1-25-14-13(24)11(7-23)26-17(14)22-9-20-12-15(18-8-19-16(12)22)21-10-5-3-2-4-6-10/h8-11,13-14,17,23-24H,2-7H2,1H3,(H,18,19,21)	JAKAFSGZUXCHLF-UHFFFAOYSA-N	COC1C(O)C(CO)OC1n2cnc3c(NC4CCCCC4)ncnc23	BroadT	BRD-A31007383	BRD-A31007383-001-01-0	Tocris Bioscience	2465	1		COC1C(O)C(CO)OC1n1cnc2c(NC3CCCCC3)ncnc12	InChI=1S/C17H25N5O4/c1-25-14-13(24)11(7-23)26-17(14)22-9-20-12-15(18-8-19-16(12)22)21-10-5-3-2-4-6-10/h8-11,13-14,17,23-24H,2-7H2,1H3,(H,18,19,21)	JAKAFSGZUXCHLF-UHFFFAOYSA-N	363.19065433							91624
CHEMBL3084797	LSM-1261	YO-2	5713	InChI=1S/C31H46N4O3/c1-2-3-4-5-6-7-18-34-31(37)29(35-30(36)27-12-8-25(22-32)9-13-27)21-24-10-14-28(15-11-24)38-23-26-16-19-33-20-17-26/h10-11,14-17,19-20,25,27,29H,2-9,12-13,18,21-23,32H2,1H3,(H,34,37)(H,35,36)	ZBCXDUNUUKRQSV-UHFFFAOYSA-N	CCCCCCCCNC(=O)C(Cc1ccc(OCc2ccncc2)cc1)NC(=O)C3CCC(CN)CC3	BroadT	BRD-A04026261	BRD-A04026261-001-01-0	Calbiochem	688190			CCCCCCCCNC(=O)C(Cc1ccc(OCc2ccncc2)cc1)NC(=O)C1CCC(CN)CC1	InChI=1S/C31H46N4O3/c1-2-3-4-5-6-7-18-34-31(37)29(35-30(36)27-12-8-25(22-32)9-13-27)21-24-10-14-28(15-11-24)38-23-26-16-19-33-20-17-26/h10-11,14-17,19-20,25,27,29H,2-9,12-13,18,21-23,32H2,1H3,(H,34,37)(H,35,36)	ZBCXDUNUUKRQSV-UHFFFAOYSA-N	522.356991372							91491
Flavanone	LSM-1283	NSC-50393	10251	InChI=1S/C15H12O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-9,15H,10H2	ZONYXWQDUYMKFB-UHFFFAOYSA-N	O=C1CC(Oc2ccccc12)c3ccccc3	BroadT	BRD-A07824748	BRD-A07824748-001-02-6	AnalytiCon Discovery GmbH	NP-009831			O=C1CC(Oc2ccccc12)c1ccccc1	InChI=1S/C15H12O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-9,15H,10H2	ZONYXWQDUYMKFB-UHFFFAOYSA-N	224.083729624							5070
SPECTRUM_001133	LSM-1434	Potassium Canrenoate, Canrenoic-Acid	195915	InChI=1S/C22H30O4/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21,26)12-8-19(24)25/h3-4,13,16-18,26H,5-12H2,1-2H3,(H,24,25)/t16?,17?,18?,20-,21-,22+/m0/s1	PBKZPPIHUVSDNM-GMTJQTPWSA-N	C[C@]12CCC(=O)C=C1C=CC3C2CC[C@@]4(C)C3CC[C@@]4(O)CCC(=O)O	BroadT	BRD-A29322418	BRD-A29322418-237-02-4	MicroSource Discovery Systems Inc.	1500828		[K]	C[C@]12CCC3C(C=CC4=CC(=O)CC[C@]34C)C1CC[C@@]2(O)CCC(O)=O.[K]	InChI=1S/C22H30O4.K.H/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21,26)12-8-19(24)25;;/h3-4,13,16-18,26H,5-12H2,1-2H3,(H,24,25);;/t16?,17?,18?,20-,21-,22+;;/m0../s1	YLXFIHIYNGPPSF-WBSXDWSYSA-N	358.21440944							
Naftopidil	LSM-4302	Naftopidil	4418	InChI=1S/C24H28N2O3/c1-28-24-11-5-4-10-22(24)26-15-13-25(14-16-26)17-20(27)18-29-23-12-6-8-19-7-2-3-9-21(19)23/h2-12,20,27H,13-18H2,1H3	HRRBJVNMSRJFHQ-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC(O)COc3cccc4ccccc34)CC2	BroadT	BRD-A01787639	BRD-A01787639-003-08-6	Tocris Bioscience	597	4	Cl	COc1ccccc1N1CCN(CC(O)COc2cccc3ccccc23)CC1.Cl	InChI=1S/C24H28N2O3.ClH/c1-28-24-11-5-4-10-22(24)26-15-13-25(14-16-26)17-20(27)18-29-23-12-6-8-19-7-2-3-9-21(19)23;/h2-12,20,27H,13-18H2,1H3;1H	VQAAEWMEVIOHTJ-UHFFFAOYSA-N	392.209992776							93788, 93788, 93788, 93788
KBIO2_000916	LSM-22609	BRD-A34891365	6708618	InChI=1S/C26H34O7/c1-22(2)15-10-18(29)25(5)14(24(15,4)17(28)11-16(22)27)6-8-23(3)19(13-7-9-31-12-13)32-21(30)20-26(23,25)33-20/h7,9,12,14-17,19-20,27-28H,6,8,10-11H2,1-5H3/t14?,15?,16-,17+,19+,20?,23+,24-,25+,26?/m1/s1	BBSPXZBAZKHYLF-HUBYRZTESA-N	CC1(C)[C@H](O)C[C@H](O)[C@@]2(C)C1CC(=O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)C5OC345)c6cocc6	BroadT	BRD-A34891365	BRD-A34891365-001-02-4	MicroSource Discovery Systems Inc.	100355			CC1(C)[C@H](O)C[C@H](O)[C@@]2(C)C1CC(=O)[C@]1(C)C2CC[C@@]2(C)[C@@H](OC(=O)C3OC123)c1ccoc1	InChI=1S/C26H34O7/c1-22(2)15-10-18(29)25(5)14(24(15,4)17(28)11-16(22)27)6-8-23(3)19(13-7-9-31-12-13)32-21(30)20-26(23,25)33-20/h7,9,12,14-17,19-20,27-28H,6,8,10-11H2,1-5H3/t14?,15?,16-,17+,19+,20?,23+,24-,25+,26?/m1/s1	BBSPXZBAZKHYLF-HUBYRZTESA-N	458.230453428							
3Alpha-acetoxydihydrodeoxygedunin	LSM-22610		6708514	InChI=1S/C30H40O7/c1-17(31)35-23-9-12-28(5)20-8-11-29(6)22(15-25(33)37-26(29)19-10-13-34-16-19)30(20,7)24(36-18(2)32)14-21(28)27(23,3)4/h10,13,15-16,20-21,23-24,26H,8-9,11-12,14H2,1-7H3/t20?,21?,23-,24-,26+,28-,29-,30-/m1/s1	HNFPPWVGLWDXQQ-FJPSVTAHSA-N	CC(=O)O[C@@H]1CC[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]3(C)[C@@H](CC2C1(C)C)OC(=O)C)c5cocc5	BroadT	BRD-A14098586	BRD-A14098586-001-02-3	MicroSource Discovery Systems Inc.	100205			CC(=O)O[C@@H]1CC[C@@]2(C)C(C[C@@H](OC(C)=O)[C@]3(C)C2CC[C@@]2(C)[C@@H](OC(=O)C=C32)c2ccoc2)C1(C)C	InChI=1S/C30H40O7/c1-17(31)35-23-9-12-28(5)20-8-11-29(6)22(15-25(33)37-26(29)19-10-13-34-16-19)30(20,7)24(36-18(2)32)14-21(28)27(23,3)4/h10,13,15-16,20-21,23-24,26H,8-9,11-12,14H2,1-7H3/t20?,21?,23-,24-,26+,28-,29-,30-/m1/s1	HNFPPWVGLWDXQQ-FJPSVTAHSA-N	512.27740362							
CHEMBL153158	LSM-1482	BRD-A35511923	9805390	InChI=1S/C25H29F2N5O3/c1-35-24(34)20(10-6-12-30-25(28)29)31-21(33)11-5-9-17-18-13-16(26)14-19(27)23(18)32-22(17)15-7-3-2-4-8-15/h2-4,7-8,13-14,20,32H,5-6,9-12H2,1H3,(H,31,33)(H4,28,29,30)	OPNMQSFIGUSHDH-UHFFFAOYSA-N	COC(=O)C(CCCNC(=N)N)NC(=O)CCCc1c([nH]c2c(F)cc(F)cc12)c3ccccc3	BroadT	BRD-A35511923	BRD-A35511923-019-01-6	Tocris Bioscience	1979	1	OC(=O)C(F)(F)F	COC(=O)C(CCCNC(N)=N)NC(=O)CCCc1c([nH]c2c(F)cc(F)cc12)-c1ccccc1.OC(=O)C(F)(F)F	InChI=1S/C25H29F2N5O3.C2HF3O2/c1-35-24(34)20(10-6-12-30-25(28)29)31-21(33)11-5-9-17-18-13-16(26)14-19(27)23(18)32-22(17)15-7-3-2-4-8-15;3-2(4,5)1(6)7/h2-4,7-8,13-14,20,32H,5-6,9-12H2,1H3,(H,31,33)(H4,28,29,30);(H,6,7)	IIRYZHRNVKQVGQ-UHFFFAOYSA-N	485.223846238							91648
Racecadotril	LSM-1286	Racecadotril	107751	InChI=1S/C21H23NO4S/c1-16(23)27-15-19(12-17-8-4-2-5-9-17)21(25)22-13-20(24)26-14-18-10-6-3-7-11-18/h2-11,19H,12-15H2,1H3,(H,22,25)	ODUOJXZPIYUATO-UHFFFAOYSA-N	CC(=O)SCC(Cc1ccccc1)C(=O)NCC(=O)OCc2ccccc2	BroadT	BRD-A08187463	BRD-A08187463-001-03-8	Prestwick Chemical Inc.	Prestw-626	D0701-MP04-ST03-200-		CC(=O)SCC(Cc1ccccc1)C(=O)NCC(=O)OCc1ccccc1	InChI=1S/C21H23NO4S/c1-16(23)27-15-19(12-17-8-4-2-5-9-17)21(25)22-13-20(24)26-14-18-10-6-3-7-11-18/h2-11,19H,12-15H2,1H3,(H,22,25)	ODUOJXZPIYUATO-UHFFFAOYSA-N	385.134778916							91508
Hydroquinidine	LSM-1275	Dihydroquinidine	442912	InChI=1S/C20H26N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h4-6,8,11,13-14,19-20,23H,3,7,9-10,12H2,1-2H3/t13-,14?,19+,20-/m0/s1	LJOQGZACKSYWCH-NBGVHYBESA-N	CC[C@H]1CN2CCC1C[C@@H]2[C@@H](O)c3ccnc4ccc(OC)cc34	BroadT	BRD-A06390036	BRD-A06390036-001-02-0	MicroSource Discovery Systems Inc.	1500657			CC[C@H]1CN2CCC1C[C@@H]2[C@@H](O)c1ccnc2ccc(OC)cc12	InChI=1S/C20H26N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h4-6,8,11,13-14,19-20,23H,3,7,9-10,12H2,1-2H3/t13-,14?,19+,20-/m0/s1	LJOQGZACKSYWCH-NBGVHYBESA-N	326.199428092							5792, 5792
CGP-20712A	LSM-1454	BRD-A31575449, CGP-20712A	2685	InChI=1S/C23H25F3N4O5/c1-30-12-20(23(24,25)26)29-22(30)14-2-4-16(5-3-14)35-13-15(31)11-28-8-9-34-17-6-7-19(32)18(10-17)21(27)33/h2-7,10,12,15,28,31-32H,8-9,11,13H2,1H3,(H2,27,33)	GKJZEKSHCJELPL-UHFFFAOYSA-N	Cn1cc(nc1c2ccc(OCC(O)CNCCOc3ccc(O)c(c3)C(=O)N)cc2)C(F)(F)F	BroadT	BRD-A31575449	BRD-A31575449-300-01-4	Tocris Bioscience	1024	1	Cl.Cl	Cn1cc(nc1-c1ccc(OCC(O)CNCCOc2ccc(O)c(c2)C(N)=O)cc1)C(F)(F)F.Cl.Cl	InChI=1S/C23H25F3N4O5.2ClH/c1-30-12-20(23(24,25)26)29-22(30)14-2-4-16(5-3-14)35-13-15(31)11-28-8-9-34-17-6-7-19(32)18(10-17)21(27)33;;/h2-7,10,12,15,28,31-32H,8-9,11,13H2,1H3,(H2,27,33);2*1H	PURFQCFKYNMIQF-UHFFFAOYSA-N	494.17770454							91628, 91628
NCGC00016774-01	LSM-1232	Nifurtimox, SID144204155, SID56463551	31772	InChI=1S/C10H13N3O5S/c1-8-7-19(16,17)5-4-12(8)11-6-9-2-3-10(18-9)13(14)15/h2-3,6,8H,4-5,7H2,1H3	ARFHIAQFJWUCFH-UHFFFAOYSA-N	CC1CS(=O)(=O)CCN1N=Cc2oc(cc2)[N+](=O)[O-]	BroadT	BRD-A00100033	BRD-A00100033-001-04-8	Prestwick Chemical Inc.	Prestw-1024	D0701-MP04-ST03-200-		CC1CS(=O)(=O)CCN1N=Cc1ccc(o1)[N+]([O-])=O	InChI=1S/C10H13N3O5S/c1-8-7-19(16,17)5-4-12(8)11-6-9-2-3-10(18-9)13(14)15/h2-3,6,8H,4-5,7H2,1H3	ARFHIAQFJWUCFH-UHFFFAOYSA-N	287.057591236							91472
Oxprenolol	LSM-1554	Oxeprenolol, Oxprenolol	4631	InChI=1S/C15H23NO3/c1-4-9-18-14-7-5-6-8-15(14)19-11-13(17)10-16-12(2)3/h4-8,12-13,16-17H,1,9-11H2,2-3H3	CEMAWMOMDPGJMB-UHFFFAOYSA-N	CC(C)NCC(O)COc1ccccc1OCC=C	BroadT	BRD-A43671941	BRD-A43671941-003-03-6	Prestwick Chemical Inc.	Prestw-1057	D0701-MP04-ST03-200-	Cl	CC(C)NCC(O)COc1ccccc1OCC=C.Cl	InChI=1S/C15H23NO3.ClH/c1-4-9-18-14-7-5-6-8-15(14)19-11-13(17)10-16-12(2)3;/h4-8,12-13,16-17H,1,9-11H2,2-3H3;1H	COAJXCLTPGGDAJ-UHFFFAOYSA-N	265.167793606							91704, 91704, 91704
KBIO1_001123	LSM-4395	Obacunol	6708542	InChI=1S/C26H32O7/c1-22(2)16-12-17(27)25(5)15(23(16,3)9-7-18(28)32-22)6-10-24(4)19(14-8-11-30-13-14)31-21(29)20-26(24,25)33-20/h7-9,11,13,15-17,19-20,27H,6,10,12H2,1-5H3/t15?,16?,17-,19+,20?,23-,24+,25+,26?/m1/s1	ADZYDUJXHKLXCN-MSYWIICTSA-N	CC1(C)OC(=O)C=C[C@@]2(C)C1C[C@@H](O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)C5OC345)c6cocc6	BroadT	BRD-A31602150	BRD-A31602150-001-02-7	MicroSource Discovery Systems Inc.	100066			C[C@@]12CCC3[C@@]4(C)C=CC(=O)OC(C)(C)C4C[C@@H](O)[C@@]3(C)C11OC1C(=O)O[C@H]2c1ccoc1	InChI=1S/C26H32O7/c1-22(2)16-12-17(27)25(5)15(23(16,3)9-7-18(28)32-22)6-10-24(4)19(14-8-11-30-13-14)31-21(29)20-26(24,25)33-20/h7-9,11,13,15-17,19-20,27H,6,10,12H2,1-5H3/t15?,16?,17-,19+,20?,23-,24+,25+,26?/m1/s1	ADZYDUJXHKLXCN-MSYWIICTSA-N	456.214803364							
Proglumide	LSM-4439	Nulsa, Proglumide, W-5219	4922	InChI=1S/C18H26N2O4/c1-3-12-20(13-4-2)18(24)15(10-11-16(21)22)19-17(23)14-8-6-5-7-9-14/h5-9,15H,3-4,10-13H2,1-2H3,(H,19,23)(H,21,22)	DGMKFQYCZXERLX-UHFFFAOYSA-N	CCCN(CCC)C(=O)C(CCC(=O)O)NC(=O)c1ccccc1	BroadT	BRD-A44863528	BRD-A44863528-001-04-1	MicroSource Discovery Systems Inc.	1501119			CCCN(CCC)C(=O)C(CCC(O)=O)NC(=O)c1ccccc1	InChI=1S/C18H26N2O4/c1-3-12-20(13-4-2)18(24)15(10-11-16(21)22)19-17(23)14-8-6-5-7-9-14/h5-9,15H,3-4,10-13H2,1-2H3,(H,19,23)(H,21,22)	DGMKFQYCZXERLX-UHFFFAOYSA-N	334.189257332							32058, 76266, 76266, 32058
4-Hydroxynon-2-enal	LSM-43066	4-Hydroxynonenal, BRD-A15914070	5283344	InChI=1S/C9H16O2/c1-2-3-4-6-9(11)7-5-8-10/h5,7-9,11H,2-4,6H2,1H3/b7-5+	JVJFIQYAHPMBBX-FNORWQNLSA-N	CCCCCC(O)\C=C\C=O	BroadT	BRD-A15914070	BRD-A15914070-001-01-5	Biomol International Inc.	HA004-0001			CCCCCC(O)\C=C\C=O	InChI=1S/C9H16O2/c1-2-3-4-6-9(11)7-5-8-10/h5,7-9,11H,2-4,6H2,1H3/b7-5+	JVJFIQYAHPMBBX-FNORWQNLSA-N	156.115029752							58968
BMY-14802	LSM-1339	BRD-A15435692, BMY-14802	108046	InChI=1S/C18H22F2N4O/c19-15-5-3-14(4-6-15)17(25)2-1-7-23-8-10-24(11-9-23)18-21-12-16(20)13-22-18/h3-6,12-13,17,25H,1-2,7-11H2	ZXUYYZPJUGQHLQ-UHFFFAOYSA-N	OC(CCCN1CCN(CC1)c2ncc(F)cn2)c3ccc(F)cc3	BroadT	BRD-A15435692	BRD-A15435692-003-01-5	Tocris Bioscience	1440	1	Cl	OC(CCCN1CCN(CC1)c1ncc(F)cn1)c1ccc(F)cc1.Cl	InChI=1S/C18H22F2N4O.ClH/c19-15-5-3-14(4-6-15)17(25)2-1-7-23-8-10-24(11-9-23)18-21-12-16(20)13-22-18;/h3-6,12-13,17,25H,1-2,7-11H2;1H	NIBVEFRJDFVQLM-UHFFFAOYSA-N	348.176167764							91549
AC1MLYN7	LSM-1317	BRD-A11609859	3277599	InChI=1S/C23H24N2O/c1-25-10-9-23(18-6-4-7-20(26)13-18)14-22-17(12-19(23)15-25)11-16-5-2-3-8-21(16)24-22/h2-8,11,13,19,26H,9-10,12,14-15H2,1H3	LEPBHAAYNPPRRA-UHFFFAOYSA-N	CN1CCC2(Cc3nc4ccccc4cc3CC2C1)c5cccc(O)c5	BroadT	BRD-A11609859	BRD-A11609859-303-01-2	Tocris Bioscience	921	2	Br.Br	CN1CCC2(Cc3nc4ccccc4cc3CC2C1)c1cccc(O)c1.Br.Br	InChI=1S/C23H24N2O.2BrH/c1-25-10-9-23(18-6-4-7-20(26)13-18)14-22-17(12-19(23)15-25)11-16-5-2-3-8-21(16)24-22;;/h2-8,11,13,19,26H,9-10,12,14-15H2,1H3;2*1H	GWXFBFMLKRAWEU-UHFFFAOYSA-N	344.188863408							91530
Nylidrin	LSM-1492	Buphenine, Nylidrin	4567	InChI=1S/C19H25NO2/c1-14(8-9-16-6-4-3-5-7-16)20-15(2)19(22)17-10-12-18(21)13-11-17/h3-7,10-15,19-22H,8-9H2,1-2H3	PTGXAUBQBSGPKF-UHFFFAOYSA-N	CC(CCc1ccccc1)NC(C)C(O)c2ccc(O)cc2	BroadT	BRD-A36267905	BRD-A36267905-003-02-8	MicroSource Discovery Systems Inc.	1500445		Cl	CC(CCc1ccccc1)NC(C)C(O)c1ccc(O)cc1.Cl	InChI=1S/C19H25NO2.ClH/c1-14(8-9-16-6-4-3-5-7-16)20-15(2)19(22)17-10-12-18(21)13-11-17;/h3-7,10-15,19-22H,8-9H2,1-2H3;1H	CLJHABUMMDMAFA-UHFFFAOYSA-N	299.18852905							91656, 91656
Enilconazole	LSM-4333	Enilconazole, R-23979	37175	InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2	PZBPKYOVPCNPJY-UHFFFAOYSA-N	Clc1ccc(C(Cn2ccnc2)OCC=C)c(Cl)c1	BroadT	BRD-A11776908	BRD-A11776908-001-03-6	Prestwick Chemical Inc.	Prestw-963	D0701-MP04-ST03-200-		Clc1ccc(C(Cn2ccnc2)OCC=C)c(Cl)c1	InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2	PZBPKYOVPCNPJY-UHFFFAOYSA-N	296.048318508							83829, 83829
SKF 81297	LSM-1301	BRD-A09828896, SID26756523, SID90341484, SID50104853	1218	InChI=1S/C16H16ClNO2/c17-15-11-6-7-18-9-13(10-4-2-1-3-5-10)12(11)8-14(19)16(15)20/h1-5,8,13,18-20H,6-7,9H2	GHWJEDJMOVUXEC-UHFFFAOYSA-N	Oc1cc2C(CNCCc2c(Cl)c1O)c3ccccc3	BroadT	BRD-A09828896	BRD-A09828896-004-04-5	Tocris Bioscience	1447	1	Br	Oc1cc2C(CNCCc2c(Cl)c1O)c1ccccc1.Br	InChI=1S/C16H16ClNO2.BrH/c17-15-11-6-7-18-9-13(10-4-2-1-3-5-10)12(11)8-14(19)16(15)20;/h1-5,8,13,18-20H,6-7,9H2;1H	RMIJGBMRNYUZRG-UHFFFAOYSA-N	289.086956472							91517, 91517
HSCI1_000237	LSM-22611	Dichlorobenzimidazole Riboside	23806119	InChI=1S/C12H12Cl2N2O4/c13-5-1-7-8(2-6(5)14)16(4-15-7)12-11(19)10(18)9(3-17)20-12/h1-2,4,9-12,17-19H,3H2/t9?,10-,11-,12?/m0/s1	XHSQDZXAVJRBMX-YECOWLKZSA-N	OCC1OC([C@@H](O)[C@H]1O)n2cnc3cc(Cl)c(Cl)cc23	BroadT	BRD-A05456882	BRD-A05456882-001-01-7	EMD Biosciences	287891			OCC1OC([C@@H](O)[C@H]1O)n1cnc2cc(Cl)c(Cl)cc12	InChI=1S/C12H12Cl2N2O4/c13-5-1-7-8(2-6(5)14)16(4-15-7)12-11(19)10(18)9(3-17)20-12/h1-2,4,9-12,17-19H,3H2/t9?,10-,11-,12?/m0/s1	XHSQDZXAVJRBMX-YECOWLKZSA-N	318.017412304							111165
AC1O8JZP	LSM-4360	Canrenone, SID85305151	6710732	InChI=1S/C22H28O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h3-4,13,16-18H,5-12H2,1-2H3/t16?,17?,18?,20-,21-,22+/m0/s1	UJVLDDZCTMKXJK-GMTJQTPWSA-N	C[C@]12CCC(=O)C=C1C=CC3C2CC[C@@]4(C)C3CC[C@@]45CCC(=O)O5	BroadT	BRD-A20644369	BRD-A20644369-001-02-9	MicroSource Discovery Systems Inc.	1505248			C[C@]12CCC3C(C=CC4=CC(=O)CC[C@]34C)C1CC[C@@]21CCC(=O)O1	InChI=1S/C22H28O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h3-4,13,16-18H,5-12H2,1-2H3/t16?,17?,18?,20-,21-,22+/m0/s1	UJVLDDZCTMKXJK-GMTJQTPWSA-N	340.203844756							
SCHEMBL12636892	LSM-1559	BRD-A43930669	9893887	InChI=1S/C26H42N4O5S2/c1-19-7-5-6-8-22(19)29-12-14-30(15-13-29)37(34,35)18-26-11-9-20(25(26,2)3)17-23(26)28-24(31)21(27)10-16-36(4,32)33/h5-8,20-21,23H,9-18,27H2,1-4H3,(H,28,31)/t20?,21-,23-,26?/m0/s1	MWIASLNTAGRGGA-WVJGRJQASA-N	Cc1ccccc1N2CCN(CC2)S(=O)(=O)CC34CCC(C[C@@H]3NC(=O)[C@@H](N)CCS(=O)(=O)C)C4(C)C	BroadT	BRD-A43930669	BRD-A43930669-003-01-0	Tocris Bioscience	2641	1	Cl	Cc1ccccc1N1CCN(CC1)S(=O)(=O)CC12CCC(C[C@@H]1NC(=O)[C@@H](N)CCS(C)(=O)=O)C2(C)C.Cl	InChI=1S/C26H42N4O5S2.ClH/c1-19-7-5-6-8-22(19)29-12-14-30(15-13-29)37(34,35)18-26-11-9-20(25(26,2)3)17-23(26)28-24(31)21(27)10-16-36(4,32)33;/h5-8,20-21,23H,9-18,27H2,1-4H3,(H,28,31);1H/t20?,21-,23-,26?;/m0./s1	GIUFQWFJHXXXEQ-PHSYAEQHSA-N	554.259661864							91708
AC1Q5RFA	LSM-43063	Fusidic Acid	3001077	InChI=1S/C31H48O6/c1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32/h9,18,21-25,27,33-34H,8,10-16H2,1-7H3,(H,35,36)/b26-20+/t18-,21-,22-,23+,24+,25-,27?,29-,30-,31-/m0/s1	IECPWNUMDGFDKC-FRVBXGIOSA-N	C[C@@H]1[C@H](O)CC[C@@]2(C)[C@H]1CC[C@@]3(C)C2[C@H](O)C[C@H]4\C(=C(\CCC=C(C)C)/C(=O)O)\[C@H](C[C@]34C)OC(=O)C	BroadT	BRD-A06935312	BRD-A06935312-001-02-7	MicroSource Discovery Systems Inc.	1500311			C[C@@H]1[C@H](O)CC[C@@]2(C)[C@H]1CC[C@@]1(C)C2[C@H](O)C[C@@H]2[C@]1(C)C[C@H](OC(C)=O)\C2=C(/CCC=C(C)C)C(O)=O	InChI=1S/C31H48O6/c1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32/h9,18,21-25,27,33-34H,8,10-16H2,1-7H3,(H,35,36)/b26-20+/t18-,21-,22-,23+,24+,25-,27?,29-,30-,31-/m0/s1	IECPWNUMDGFDKC-FRVBXGIOSA-N	516.345089256							
Norketamine	LSM-1305	Norketamine, BRD-A10355991	123767	InChI=1S/C12H14ClNO/c13-10-6-2-1-5-9(10)12(14)8-4-3-7-11(12)15/h1-2,5-6H,3-4,7-8,14H2	BEQZHFIKTBVCAU-UHFFFAOYSA-N	NC1(CCCCC1=O)c2ccccc2Cl	BroadT	BRD-A10355991	BRD-A10355991-003-01-8	Tocris Bioscience	1970	1	Cl	NC1(CCCCC1=O)c1ccccc1Cl.Cl	InChI=1S/C12H14ClNO.ClH/c13-10-6-2-1-5-9(10)12(14)8-4-3-7-11(12)15;/h1-2,5-6H,3-4,7-8,14H2;1H	CLPOJGPBUGCUKT-UHFFFAOYSA-N	223.076391788							91519
CHEMBL99377	LSM-22612	BRD-A07232941, SID26752041	5170952	InChI=1S/C14H19NO2/c1-3-14(16)15-11-8-7-10-5-4-6-13(17-2)12(10)9-11/h4-6,11H,3,7-9H2,1-2H3,(H,15,16)	RVIGBTUDFAGRTQ-UHFFFAOYSA-N	CCC(=O)NC1CCc2cccc(OC)c2C1	BroadT	BRD-A07232941	BRD-A07232941-001-01-9	Tocris Bioscience	1035	1		CCC(=O)NC1CCc2cccc(OC)c2C1	InChI=1S/C14H19NO2/c1-3-14(16)15-11-8-7-10-5-4-6-13(17-2)12(10)9-11/h4-6,11H,3,7-9H2,1-2H3,(H,15,16)	RVIGBTUDFAGRTQ-UHFFFAOYSA-N	233.141578858							111166
Betaxolol	LSM-1255	Kerledex, Kerlone, Betoptic, Betaxolol	2369	InChI=1S/C18H29NO3/c1-14(2)19-11-17(20)13-22-18-7-5-15(6-8-18)9-10-21-12-16-3-4-16/h5-8,14,16-17,19-20H,3-4,9-13H2,1-2H3	NWIUTZDMDHAVTP-UHFFFAOYSA-N	CC(C)NCC(O)COc1ccc(CCOCC2CC2)cc1	BroadT	BRD-A02759312	BRD-A02759312-003-11-2	Tocris Bioscience	906	2	Cl	CC(C)NCC(O)COc1ccc(CCOCC2CC2)cc1.Cl	InChI=1S/C18H29NO3.ClH/c1-14(2)19-11-17(20)13-22-18-7-5-15(6-8-18)9-10-21-12-16-3-4-16;/h5-8,14,16-17,19-20H,3-4,9-13H2,1-2H3;1H	CHDPSNLJFOQTRK-UHFFFAOYSA-N	307.214743798							3082, 3082
SPBIO_000066	LSM-22613	BRD-A37523642	6708577	InChI=1S/C26H30O5/c1-23(2)17-12-20(28)26(5)16(24(17,3)10-7-19(23)27)6-9-25(4)18(26)13-21(29)31-22(25)15-8-11-30-14-15/h7-8,10-11,13-14,16-17,22H,6,9,12H2,1-5H3/t16?,17?,22-,24+,25+,26+/m0/s1	SRWHWJLUDSYHLO-LUKAEVKMSA-N	CC1(C)C2CC(=O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)C=C34)c5cocc5)[C@@]2(C)C=CC1=O	BroadT	BRD-A37523642	BRD-A37523642-001-02-5	MicroSource Discovery Systems Inc.	100140			CC1(C)C2CC(=O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)C=C34)c3ccoc3)[C@@]2(C)C=CC1=O	InChI=1S/C26H30O5/c1-23(2)17-12-20(28)26(5)16(24(17,3)10-7-19(23)27)6-9-25(4)18(26)13-21(29)31-22(25)15-8-11-30-14-15/h7-8,10-11,13-14,16-17,22H,6,9,12H2,1-5H3/t16?,17?,22-,24+,25+,26+/m0/s1	SRWHWJLUDSYHLO-LUKAEVKMSA-N	422.20932406							
Propafenone	LSM-1416	Propafenone, Rythmol, GNF-PF-4594	4932	InChI=1S/C21H27NO3/c1-2-14-22-15-18(23)16-25-21-11-7-6-10-19(21)20(24)13-12-17-8-4-3-5-9-17/h3-11,18,22-23H,2,12-16H2,1H3	JWHAUXFOSRPERK-UHFFFAOYSA-N	CCCNCC(O)COc1ccccc1C(=O)CCc2ccccc2	BroadT	BRD-A26334849	BRD-A26334849-001-02-1	Biomol International Inc.	AC-124	2840(V2)-3-N1305		CCCNCC(O)COc1ccccc1C(=O)CCc1ccccc1	InChI=1S/C21H27NO3/c1-2-14-22-15-18(23)16-25-21-11-7-6-10-19(21)20(24)13-12-17-8-4-3-5-9-17/h3-11,18,22-23H,2,12-16H2,1H3	JWHAUXFOSRPERK-UHFFFAOYSA-N	341.199093734							63619, 63619
2-(3,4-Dichlorophenyl)-n-methyl-n-(2-pyrrolidin-1-ylcyclohexyl)acetamide	LSM-15335	BRD-A12822115	5619	InChI=1S/C19H26Cl2N2O/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23/h8-9,12,17-18H,2-7,10-11,13H2,1H3	VQLPLYSROCPWFF-UHFFFAOYSA-N	CN(C1CCCCC1N2CCCC2)C(=O)Cc3ccc(Cl)c(Cl)c3	BroadT	BRD-A12822115	BRD-A12822115-003-01-6	Tocris Bioscience	496	4	Cl	CN(C1CCCCC1N1CCCC1)C(=O)Cc1ccc(Cl)c(Cl)c1.Cl	InChI=1S/C19H26Cl2N2O.ClH/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23;/h8-9,12,17-18H,2-7,10-11,13H2,1H3;1H	KGMMGVIYOHGOKQ-UHFFFAOYSA-N	368.142218892							103981
Ipratropium	LSM-1497	BRD-A37432947		InChI=1S/C20H30NO3/c1-14(2)21(3)16-9-10-17(21)12-18(11-16)24-20(23)19(13-22)15-7-5-4-6-8-15/h4-8,14,16-19,22H,9-13H2,1-3H3/q+1/t16-,17-,18-,19?,21?/m1/s1	OEXHQOGQTVQTAT-ZFWRPDKHSA-N	CC(C)[N+]1(C)[C@@H]2CC[C@@H]1C[C@H](C2)OC(=O)C(CO)c3ccccc3	BroadT	BRD-A37432947	BRD-A37432947-004-02-5	Prestwick Chemical Inc.	Prestw-575	D0701-MP04-ST03-200-	Br	CC(C)[N+]1(C)[C@@H]2CC[C@@H]1C[C@H](C2)OC(=O)C(CO)c1ccccc1.Br	InChI=1S/C20H30NO3.BrH/c1-14(2)21(3)16-9-10-17(21)12-18(11-16)24-20(23)19(13-22)15-7-5-4-6-8-15;/h4-8,14,16-19,22H,9-13H2,1-3H3;1H/q+1;/t16-,17-,18-,19?,21?;/m1./s1	LHLMOSXCXGLMMN-PSXMSZGTSA-N	332.22256883							, 
Pentobarbital	LSM-1566	Pentobarbital, Nembutal, Mebumal, Mebubarbital, Pentobarbital Calcium	4737	InChI=1S/C11H18N2O3/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)	WEXRUCMBJFQVBZ-UHFFFAOYSA-N	CCCC(C)C1(CC)C(=O)NC(=O)NC1=O	BroadT	BRD-A44448661	BRD-A44448661-001-02-2	MicroSource Discovery Systems Inc.	1900006			CCCC(C)C1(CC)C(=O)NC(=O)NC1=O	InChI=1S/C11H18N2O3/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)	WEXRUCMBJFQVBZ-UHFFFAOYSA-N	226.131742456							7983, 7983
BW-723C86	LSM-1351	BW-723C86, BW 723C86	4284720	InChI=1S/C16H18N2OS/c1-11(17)7-12-9-18-16-5-4-13(8-15(12)16)19-10-14-3-2-6-20-14/h2-6,8-9,11,18H,7,10,17H2,1H3	ALFGDCNSEBJYSP-UHFFFAOYSA-N	CC(N)Cc1c[nH]c2ccc(OCc3cccs3)cc12	BroadT	BRD-A17428743	BRD-A17428743-001-01-1	Biomol International Inc.	AC-546	2813-N1283		CC(N)Cc1c[nH]c2ccc(OCc3cccs3)cc12	InChI=1S/C16H18N2OS/c1-11(17)7-12-9-18-16-5-4-13(8-15(12)16)19-10-14-3-2-6-20-14/h2-6,8-9,11,18H,7,10,17H2,1H3	ALFGDCNSEBJYSP-UHFFFAOYSA-N	286.113983906							91556, 91556
AC1O7M2Y	LSM-4321	L-744832	6610354	InChI=1S/C26H45N3O6S2/c1-6-19(4)23(28-15-21(27)17-36)16-34-24(14-20-10-8-7-9-11-20)25(30)29-22(12-13-37(5,32)33)26(31)35-18(2)3/h7-11,18-19,21-24,28,36H,6,12-17,27H2,1-5H3,(H,29,30)/t19?,21-,22+,23-,24+/m1/s1	PGOKBMWPBDRDGN-LVCZELDUSA-N	CCC(C)[C@@H](CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCS(=O)(=O)C)C(=O)OC(C)C)NC[C@@H](N)CS	BroadT	BRD-A07952294	BRD-A07952294-001-02-3	Biomol International Inc.	G-242	2840(V2)-3-N1305		CCC(C)[C@@H](CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)OC(C)C)NC[C@@H](N)CS	InChI=1S/C26H45N3O6S2/c1-6-19(4)23(28-15-21(27)17-36)16-34-24(14-20-10-8-7-9-11-20)25(30)29-22(12-13-37(5,32)33)26(31)35-18(2)3/h7-11,18-19,21-24,28,36H,6,12-17,27H2,1-5H3,(H,29,30)/t19?,21-,22+,23-,24+/m1/s1	PGOKBMWPBDRDGN-LVCZELDUSA-N	559.27497757							93798
UH-232	LSM-15600	BRD-A00327403	4638165	InChI=1S/C18H29NO/c1-5-12-19(13-6-2)17-11-10-16-15(14(17)3)8-7-9-18(16)20-4/h7-9,14,17H,5-6,10-13H2,1-4H3	BTOJYCTUJJHANF-UHFFFAOYSA-N	CCCN(CCC)C1CCc2c(OC)cccc2C1C	BroadT	BRD-A00327403	BRD-A00327403-103-01-9	Tocris Bioscience	775	3	OC(=O)C=CC(=O)O	CCCN(CCC)C1CCc2c(OC)cccc2C1C.OC(=O)C=CC(=O)O	InChI=1S/C18H29NO.C4H4O4/c1-5-12-19(13-6-2)17-11-10-16-15(14(17)3)8-7-9-18(16)20-4;5-3(6)1-2-4(7)8/h7-9,14,17H,5-6,10-13H2,1-4H3;1-2H,(H,5,6)(H,7,8)	MEQAJDYHKYAPJE-UHFFFAOYSA-N	275.224914558							104236
Hydroxyandrostenone	LSM-4359	Prasterone	9860744	InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-16,20H,4-11H2,1-2H3/t13-,14?,15?,16?,18-,19-/m0/s1	FMGSKLZLMKYGDP-INNQQZFDSA-N	C[C@]12CCC3C(CC=C4C[C@@H](O)CC[C@]34C)C1CCC2=O	BroadT	BRD-A20602349	BRD-A20602349-001-02-2	MicroSource Discovery Systems Inc.	100582			C[C@]12CCC3C(CC=C4C[C@@H](O)CC[C@]34C)C1CCC2=O	InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-16,20H,4-11H2,1-2H3/t13-,14?,15?,16?,18-,19-/m0/s1	FMGSKLZLMKYGDP-INNQQZFDSA-N	288.208930136							93823
Salmeterol	LSM-1240	Salmeterol, Serevent, Salmaterol, GR-33343X, GR-33343-X	5152	InChI=1S/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2	GIIZNNXWQWCKIB-UHFFFAOYSA-N	OCc1cc(ccc1O)C(O)CNCCCCCCOCCCCc2ccccc2	BroadT	BRD-A01320529	BRD-A01320529-001-05-9	Tocris Bioscience	1660	2		OCc1cc(ccc1O)C(O)CNCCCCCCOCCCCc1ccccc1	InChI=1S/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2	GIIZNNXWQWCKIB-UHFFFAOYSA-N	415.272258674							64064, 64064, 64064
N-Formylmethionylleucylphenylalanine	LSM-22614	F-Met-Leu-Phe	4364	InChI=1S/C21H31N3O5S/c1-14(2)11-17(23-19(26)16(22-13-25)9-10-30-3)20(27)24-18(21(28)29)12-15-7-5-4-6-8-15/h4-8,13-14,16-18H,9-12H2,1-3H3,(H,22,25)(H,23,26)(H,24,27)(H,28,29)	PRQROPMIIGLWRP-UHFFFAOYSA-N	CSCCC(NC=O)C(=O)NC(CC(C)C)C(=O)NC(Cc1ccccc1)C(=O)O	BroadT	BRD-A27693633	BRD-A27693633-001-02-9	MicroSource Discovery Systems Inc.	1502173			CSCCC(NC=O)C(=O)NC(CC(C)C)C(=O)NC(Cc1ccccc1)C(O)=O	InChI=1S/C21H31N3O5S/c1-14(2)11-17(23-19(26)16(22-13-25)9-10-30-3)20(27)24-18(21(28)29)12-15-7-5-4-6-8-15/h4-8,13-14,16-18H,9-12H2,1-3H3,(H,22,25)(H,23,26)(H,24,27)(H,28,29)	PRQROPMIIGLWRP-UHFFFAOYSA-N	437.198441812							111167
Metanephrine	LSM-1542	Metanephrine	21100	InChI=1S/C10H15NO3/c1-11-6-9(13)7-3-4-8(12)10(5-7)14-2/h3-5,9,11-13H,6H2,1-2H3	JWJCTZKFYGDABJ-UHFFFAOYSA-N	CNCC(O)c1ccc(O)c(OC)c1	BroadT	BRD-A42346008	BRD-A42346008-003-03-6	Prestwick Chemical Inc.	Prestw-122	D0701-MP04-ST03-200-	Cl	CNCC(O)c1ccc(O)c(OC)c1.Cl	InChI=1S/C10H15NO3.ClH/c1-11-6-9(13)7-3-4-8(12)10(5-7)14-2;/h3-5,9,11-13H,6H2,1-2H3;1H	HRIQFVCFOPJYEQ-UHFFFAOYSA-N	197.10519335							89633
Tetrahydropalmatine	LSM-1560	(+/-)-Tetrahydropalmatine	5417	InChI=1S/C21H25NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,10-11,17H,7-9,12H2,1-4H3	AEQDJSLRWYMAQI-UHFFFAOYSA-N	COc1cc2CCN3Cc4c(CC3c2cc1OC)ccc(OC)c4OC	BroadT	BRD-A43940795	BRD-A43940795-001-02-8	AnalytiCon Discovery GmbH	NP-001740			COc1cc2CCN3Cc4c(CC3c2cc1OC)ccc(OC)c4OC	InChI=1S/C21H25NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,10-11,17H,7-9,12H2,1-4H3	AEQDJSLRWYMAQI-UHFFFAOYSA-N	355.17835829							91709, 91709, 91709
Ondansetron	LSM-1375	Ondansetron, Zofran, Desmethylondansetron, Zuplenz, GR-38032F, GR-38032, Zofran ODT	4595	InChI=1S/C18H19N3O/c1-12-19-9-10-21(12)11-13-7-8-16-17(18(13)22)14-5-3-4-6-15(14)20(16)2/h3-6,9-10,13H,7-8,11H2,1-2H3	FELGMEQIXOGIFQ-UHFFFAOYSA-N	Cc1nccn1CC2CCc3c(C2=O)c4ccccc4n3C	BroadT	BRD-A19736161	BRD-A19736161-310-01-3	TimTec LLC	ST024023		O.O.Cl	Cc1nccn1CC1CCc2c(C1=O)c1ccccc1n2C.O.O.Cl	InChI=1S/C18H19N3O.ClH.2H2O/c1-12-19-9-10-21(12)11-13-7-8-16-17(18(13)22)14-5-3-4-6-15(14)20(16)2;;;/h3-6,9-10,13H,7-8,11H2,1-2H3;1H;2*1H2	VRSLTNZJOUZKLX-UHFFFAOYSA-N	293.152812258							7773, 7773, 7773, 7773
8Beta-hydroxycarapin, 3,8-hemiacetal	LSM-22615	8-Beta-Hydroxycarapin-3,8-Hemiacetal	6708727	InChI=1S/C27H32O8/c1-23(2)17(10-19(28)32-5)25(4)16-6-8-24(3)18(11-20(29)34-22(24)14-7-9-33-13-14)26(16)12-15(21(25)30)27(23,31)35-26/h7,9,11,13,15-17,22,31H,6,8,10,12H2,1-5H3/t15?,16?,17-,22-,24+,25+,26?,27?/m0/s1	URGZBBCARSDFSL-PTRNVCADSA-N	COC(=O)C[C@H]1C(C)(C)C2(O)OC34CC2C(=O)[C@]1(C)C3CC[C@@]5(C)[C@@H](OC(=O)C=C45)c6cocc6	BroadT	BRD-A17120244	BRD-A17120244-001-02-6	MicroSource Discovery Systems Inc.	100105			COC(=O)C[C@H]1C(C)(C)C2(O)OC34CC2C(=O)[C@]1(C)C3CC[C@@]1(C)[C@@H](OC(=O)C=C41)c1ccoc1	InChI=1S/C27H32O8/c1-23(2)17(10-19(28)32-5)25(4)16-6-8-24(3)18(11-20(29)34-22(24)14-7-9-33-13-14)26(16)12-15(21(25)30)27(23,31)35-26/h7,9,11,13,15-17,22,31H,6,8,10,12H2,1-5H3/t15?,16?,17-,22-,24+,25+,26?,27?/m0/s1	URGZBBCARSDFSL-PTRNVCADSA-N	484.209717984							
Ketorolac	LSM-1526	Ketorolac, Ketorolac Tromethamine	3826	InChI=1S/C15H13NO3/c17-14(10-4-2-1-3-5-10)13-7-6-12-11(15(18)19)8-9-16(12)13/h1-7,11H,8-9H2,(H,18,19)	OZWKMVRBQXNZKK-UHFFFAOYSA-N	OC(=O)C1CCn2c1ccc2C(=O)c3ccccc3	BroadT	BRD-A40639672	BRD-A40639672-234-04-0	MicroSource Discovery Systems Inc.	1503925		NC(CO)(CO)CO	OC(=O)C1CCn2c1ccc2C(=O)c1ccccc1.NC(CO)(CO)CO	InChI=1S/C15H13NO3.C4H11NO3/c17-14(10-4-2-1-3-5-10)13-7-6-12-11(15(18)19)8-9-16(12)13;5-4(1-6,2-7)3-8/h1-7,11H,8-9H2,(H,18,19);6-8H,1-3,5H2	BWHLPLXXIDYSNW-UHFFFAOYSA-N	255.089543286							76223, 76223
Nitrendipine	LSM-1246	Nitrendipine, Baypress, BAY-E-5009	4507	InChI=1S/C18H20N2O6/c1-5-26-18(22)15-11(3)19-10(2)14(17(21)25-4)16(15)12-7-6-8-13(9-12)20(23)24/h6-9,16,19H,5H2,1-4H3	PVHUJELLJLJGLN-UHFFFAOYSA-N	CCOC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C	BroadT	BRD-A02006392	BRD-A02006392-001-06-5	Biomol International Inc.	CA-212	2840(V2)-3-N1305		CCOC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC	InChI=1S/C18H20N2O6/c1-5-26-18(22)15-11(3)19-10(2)14(17(21)25-4)16(15)12-7-6-8-13(9-12)20(23)24/h6-9,16,19H,5H2,1-4H3	PVHUJELLJLJGLN-UHFFFAOYSA-N	360.13213638							7582
Abscisic acid	LSM-43067	(+/-)-Abscisic Acid, Abscisic Acid	5375199	InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-	JLIDBLDQVAYHNE-LXGGSRJLSA-N	C\C(=C\C(=O)O)\C=C\C1(O)C(=CC(=O)CC1(C)C)C	BroadT	BRD-A17658676	BRD-A17658676-001-02-2	MicroSource Discovery Systems Inc.	1502234			CC(\C=C\C1(O)C(C)=CC(=O)CC1(C)C)=C\C(O)=O	InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-	JLIDBLDQVAYHNE-LXGGSRJLSA-N	264.13615912							22152
Nicardipine	LSM-1418	Nicardipine	4474	InChI=1S/C26H29N3O6/c1-17-22(25(30)34-4)24(20-11-8-12-21(15-20)29(32)33)23(18(2)27-17)26(31)35-14-13-28(3)16-19-9-6-5-7-10-19/h5-12,15,24,27H,13-14,16H2,1-4H3	ZBBHBTPTTSWHBA-UHFFFAOYSA-N	COC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3ccccc3)C	BroadT	BRD-A26711594	BRD-A26711594-001-02-7	Biomol International Inc.	AC-108	2840(V2)-3-N1305		COC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OCCN(C)Cc1ccccc1	InChI=1S/C26H29N3O6/c1-17-22(25(30)34-4)24(20-11-8-12-21(15-20)29(32)33)23(18(2)27-17)26(31)35-14-13-28(3)16-19-9-6-5-7-10-19/h5-12,15,24,27H,13-14,16H2,1-4H3	ZBBHBTPTTSWHBA-UHFFFAOYSA-N	479.205635678							7550, 7550
Scopolamine	LSM-1330	BRD-A14566392	5184	InChI=1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3	STECJAGHUSJQJN-UHFFFAOYSA-N	CN1C2CC(CC1C3OC23)OC(=O)C(CO)c4ccccc4	BroadT	BRD-A14566392	BRD-A14566392-004-03-5	Tocris Bioscience	1414	3	Br	CN1C2CC(CC1C1OC21)OC(=O)C(CO)c1ccccc1.Br	InChI=1S/C17H21NO4.BrH/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10;/h2-6,11-16,19H,7-9H2,1H3;1H	WTGQALLALWYDJH-UHFFFAOYSA-N	303.147058162							91541, 91541, 91541
AC1L1I5D	LSM-1385	BRD-A21723284	4429	InChI=1S/C26H25NO4/c28-18-8-7-15-11-20-26(29)12-17-16-3-1-2-4-19(16)30-22(17)24-25(26,21(15)23(18)31-24)9-10-27(20)13-14-5-6-14/h1-4,7-8,14,20,24,28-29H,5-6,9-13H2	ZHVWWEYETMPAMX-UHFFFAOYSA-N	Oc1ccc2CC3N(CC4CC4)CCC56C(Oc1c25)c7oc8ccccc8c7CC36O	BroadT	BRD-A21723284	BRD-A21723284-066-01-7	Tocris Bioscience	892	4	CS(=O)(=O)O	Oc1ccc2CC3N(CC4CC4)CCC45C(Oc1c24)c1oc2ccccc2c1CC35O.CS(=O)(=O)O	InChI=1S/C26H25NO4.CH4O3S/c28-18-8-7-15-11-20-26(29)12-17-16-3-1-2-4-19(16)30-22(17)24-25(26,21(15)23(18)31-24)9-10-27(20)13-14-5-6-14;1-5(2,3)4/h1-4,7-8,14,20,24,28-29H,5-6,9-13H2;1H3,(H,2,3,4)	XRRFZOCDAWPIBB-UHFFFAOYSA-N	415.17835829							91581
1228746-78-8	LSM-1533	Ezetimibe	6710700	InChI=1S/C24H21F2NO3/c25-17-5-1-15(2-6-17)22(29)14-13-21-23(16-3-11-20(28)12-4-16)27(24(21)30)19-9-7-18(26)8-10-19/h1-12,21-23,28-29H,13-14H2/t21-,22?,23-/m1/s1	OLNTVTPDXPETLC-OJVMETQDSA-N	OC(CC[C@@H]1[C@H](N(C1=O)c2ccc(F)cc2)c3ccc(O)cc3)c4ccc(F)cc4	BroadT	BRD-A41519720	BRD-A41519720-001-02-2	MicroSource Discovery Systems Inc.	1505203			OC(CC[C@@H]1[C@H](N(C1=O)c1ccc(F)cc1)c1ccc(O)cc1)c1ccc(F)cc1	InChI=1S/C24H21F2NO3/c25-17-5-1-15(2-6-17)22(29)14-13-21-23(16-3-11-20(28)12-4-16)27(24(21)30)19-9-7-18(26)8-10-19/h1-12,21-23,28-29H,13-14H2/t21-,22?,23-/m1/s1	OLNTVTPDXPETLC-OJVMETQDSA-N	409.148949942							91688
AC1L1I54	LSM-1537	BRD-A41833852	4426	InChI=1S/C26H27N3O4/c1-2-13-29-14-12-25-21-17-8-9-19(30)22(21)33-23(25)18(10-11-26(25,32)20(29)15-17)27-28-24(31)16-6-4-3-5-7-16/h2-9,20,23,30,32H,1,10-15H2,(H,28,31)	AKXCFAYOTIEFOH-UHFFFAOYSA-N	Oc1ccc2CC3N(CC=C)CCC45C(Oc1c24)C(=NNC(=O)c6ccccc6)CCC35O	BroadT	BRD-A41833852	BRD-A41833852-001-01-9	Tocris Bioscience	1419	1		Oc1ccc2CC3N(CC=C)CCC45C(Oc1c24)C(CCC35O)=NNC(=O)c1ccccc1	InChI=1S/C26H27N3O4/c1-2-13-29-14-12-25-21-17-8-9-19(30)22(21)33-23(25)18(10-11-26(25,32)20(29)15-17)27-28-24(31)16-6-4-3-5-7-16/h2-9,20,23,30,32H,1,10-15H2,(H,28,31)	AKXCFAYOTIEFOH-UHFFFAOYSA-N	445.200156374							91692
Doxylamine	LSM-1563	Doxylamine, Unisom, Decapryn, Doxy-Sleep-Aid	3162	InChI=1S/C17H22N2O/c1-17(20-14-13-19(2)3,15-9-5-4-6-10-15)16-11-7-8-12-18-16/h4-12H,13-14H2,1-3H3	HCFDWZZGGLSKEP-UHFFFAOYSA-N	CN(C)CCOC(C)(c1ccccc1)c2ccccn2	BroadT	BRD-A44008656	BRD-A44008656-036-04-3	MicroSource Discovery Systems Inc.	1500267		OC(=O)CCC(=O)O	CN(C)CCOC(C)(c1ccccc1)c1ccccn1.OC(=O)CCC(=O)O	InChI=1S/C17H22N2O.C4H6O4/c1-17(20-14-13-19(2)3,15-9-5-4-6-10-15)16-11-7-8-12-18-16;5-3(6)1-2-4(7)8/h4-12H,13-14H2,1-3H3;1-2H2,(H,5,6)(H,7,8)	KBAUFVUYFNWQFM-UHFFFAOYSA-N	270.173213344							51380, 51380
Dcpib	LSM-1517	SID29215122, SID26753173, BRD-A39255369	10071166	InChI=1S/C22H28Cl2O4/c1-2-3-10-22(15-7-4-5-8-15)13-14-12-16(28-11-6-9-17(25)26)19(23)20(24)18(14)21(22)27/h12,15H,2-11,13H2,1H3,(H,25,26)	KHKGTPJPBOQECW-UHFFFAOYSA-N	CCCCC1(Cc2cc(OCCCC(=O)O)c(Cl)c(Cl)c2C1=O)C3CCCC3	BroadT	BRD-A39255369	BRD-A39255369-001-01-5	Tocris Bioscience	1540	1		CCCCC1(Cc2cc(OCCCC(O)=O)c(Cl)c(Cl)c2C1=O)C1CCCC1	InChI=1S/C22H28Cl2O4/c1-2-3-10-22(15-7-4-5-8-15)13-14-12-16(28-11-6-9-17(25)26)19(23)20(24)18(14)21(22)27/h12,15H,2-11,13H2,1H3,(H,25,26)	KHKGTPJPBOQECW-UHFFFAOYSA-N	426.136464796							91677
Bongkrekic acid	LSM-42821		16760034	InChI=1S/C28H38O7/c1-21(15-18-24(19-26(29)30)20-27(31)32)13-11-9-7-5-6-8-10-12-14-25(35-4)22(2)16-17-23(3)28(33)34/h6,8-12,15-19,21,25H,5,7,13-14,20H2,1-4H3,(H,29,30)(H,31,32)(H,33,34)/b8-6+,11-9-,12-10+,18-15-,22-16-,23-17+,24-19+	SHCXABJSXUACKU-IPUKGTGASA-N	COC(C\C=C\C=C\CC\C=C/CC(C)\C=C/C(=C\C(=O)O)/CC(=O)O)\C(=C/C=C(\C)/C(=O)O)\C	BroadT	BRD-A41301928	BRD-A41301928-001-02-5	Biomol International Inc.	CM-113	2840(V2)-3-N1305		COC(C\C=C\C=C\CC\C=C/CC(C)\C=C/C(CC(O)=O)=C\C(O)=O)C(\C)=C/C=C(\C)C(O)=O	InChI=1S/C28H38O7/c1-21(15-18-24(19-26(29)30)20-27(31)32)13-11-9-7-5-6-8-10-12-14-25(35-4)22(2)16-17-23(3)28(33)34/h6,8-12,15-19,21,25H,5,7,13-14,20H2,1-4H3,(H,29,30)(H,31,32)(H,33,34)/b8-6+,11-9-,12-10+,18-15-,22-16-,23-17+,24-19+	SHCXABJSXUACKU-IPUKGTGASA-N	486.261753556							
Triamcinolone Diacetate	LSM-1446	Triamcinolone	5702127	InChI=1S/C25H31FO8/c1-13(27)33-12-20(31)25(32)21(34-14(2)28)10-18-17-6-5-15-9-16(29)7-8-22(15,3)24(17,26)19(30)11-23(18,25)4/h7-9,17-19,21,30,32H,5-6,10-12H2,1-4H3/t17?,18?,19-,21+,22-,23-,24-,25+/m0/s1	XGMPVBXKDAHORN-KUZKEXDLSA-N	CC(=O)OCC(=O)[C@@]1(O)[C@@H](CC2C3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)OC(=O)C	BroadT	BRD-A30717181	BRD-A30717181-001-02-7	MicroSource Discovery Systems Inc.	1500588			CC(=O)OCC(=O)[C@@]1(O)[C@@H](CC2C3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)OC(C)=O	InChI=1S/C25H31FO8/c1-13(27)33-12-20(31)25(32)21(34-14(2)28)10-18-17-6-5-15-9-16(29)7-8-22(15,3)24(17,26)19(30)11-23(18,25)4/h7-9,17-19,21,30,32H,5-6,10-12H2,1-4H3/t17?,18?,19-,21+,22-,23-,24-,25+/m0/s1	XGMPVBXKDAHORN-KUZKEXDLSA-N	478.200296152							
Fenbutyramide	LSM-4377		7011	InChI=1S/C10H13NO/c1-2-9(10(11)12)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H2,11,12)	UNFGQCCHVMMMRF-UHFFFAOYSA-N	CCC(C(=O)N)c1ccccc1	BroadT	BRD-A25537246	BRD-A25537246-001-02-9	MicroSource Discovery Systems Inc.	1504223			CCC(C(N)=O)c1ccccc1	InChI=1S/C10H13NO/c1-2-9(10(11)12)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H2,11,12)	UNFGQCCHVMMMRF-UHFFFAOYSA-N	163.099714046							93832
Lomatin	LSM-1376	9-Hydroxy-8,8-Dimethyl-9,10-Dihydro-8H-Pyrano[2,3-F]Chromen-2-one, Lomatin, SID26749702, SID49642275	600670	InChI=1S/C14H14O4/c1-14(2)11(15)7-9-10(18-14)5-3-8-4-6-12(16)17-13(8)9/h3-6,11,15H,7H2,1-2H3	UJSHBYQGQRPVNO-UHFFFAOYSA-N	CC1(C)Oc2ccc3C=CC(=O)Oc3c2CC1O	BroadT	BRD-A19918940	BRD-A19918940-001-02-8	AnalytiCon Discovery GmbH	NP-006716			CC1(C)Oc2ccc3ccc(=O)oc3c2CC1O	InChI=1S/C14H14O4/c1-14(2)11(15)7-9-10(18-14)5-3-8-4-6-12(16)17-13(8)9/h3-6,11,15H,7H2,1-2H3	UJSHBYQGQRPVNO-UHFFFAOYSA-N	246.089208928							91573
LY 278584	LSM-1322	LY-278584	3970	InChI=1S/C17H22N4O/c1-20-12-7-8-13(20)10-11(9-12)18-17(22)16-14-5-3-4-6-15(14)21(2)19-16/h3-6,11-13H,7-10H2,1-2H3,(H,18,22)	DDHAJFBBJWHSBR-UHFFFAOYSA-N	CN1C2CCC1CC(C2)NC(=O)c3nn(C)c4ccccc34	BroadT	BRD-A12016240	BRD-A12016240-001-01-7	Biomol International Inc.	AC-849	2813-N1283		CN1C2CCC1CC(C2)NC(=O)c1nn(C)c2ccccc12	InChI=1S/C17H22N4O/c1-20-12-7-8-13(20)10-11(9-12)18-17(22)16-14-5-3-4-6-15(14)21(2)19-16/h3-6,11-13H,7-10H2,1-2H3,(H,18,22)	DDHAJFBBJWHSBR-UHFFFAOYSA-N	298.179361364							91535, 91535
Cyclopenthiazide	LSM-1529	Cyclopenthiazide, SU-8341	2904	InChI=1S/C13H18ClN3O4S2/c14-9-6-10-12(7-11(9)22(15,18)19)23(20,21)17-13(16-10)5-8-3-1-2-4-8/h6-8,13,16-17H,1-5H2,(H2,15,18,19)	BKYKPTRYDKTTJY-UHFFFAOYSA-N	NS(=O)(=O)c1cc2c(NC(CC3CCCC3)NS2(=O)=O)cc1Cl	BroadT	BRD-A41250306	BRD-A41250306-001-03-4	Prestwick Chemical Inc.	Prestw-994	D0701-MP04-ST03-200-		NS(=O)(=O)c1cc2c(NC(CC3CCCC3)NS2(=O)=O)cc1Cl	InChI=1S/C13H18ClN3O4S2/c14-9-6-10-12(7-11(9)22(15,18)19)23(20,21)17-13(16-10)5-8-3-1-2-4-8/h6-8,13,16-17H,1-5H2,(H2,15,18,19)	BKYKPTRYDKTTJY-UHFFFAOYSA-N	379.042725176							91686
Nomilin	LSM-1294	Nomilin Hydrochloride	6710776	InChI=1S/C28H34O9/c1-14(29)34-19-12-20(31)36-24(2,3)17-11-18(30)27(6)16(26(17,19)5)7-9-25(4)21(15-8-10-33-13-15)35-23(32)22-28(25,27)37-22/h8,10,13,16-17,19,21-22H,7,9,11-12H2,1-6H3/t16?,17?,19-,21+,22-,25+,26-,27+,28-/m1/s1	KPDOJFFZKAUIOE-ZUDUQEJMSA-N	CC(=O)O[C@@H]1CC(=O)OC(C)(C)C2CC(=O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@@]345)c6cocc6)[C@@]12C	BroadT	BRD-A09161221	BRD-A09161221-001-01-9	MicroSource Discovery Systems Inc.	1505341			CC(=O)O[C@@H]1CC(=O)OC(C)(C)C2CC(=O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@@]345)c3ccoc3)[C@@]12C	InChI=1S/C28H34O9/c1-14(29)34-19-12-20(31)36-24(2,3)17-11-18(30)27(6)16(26(17,19)5)7-9-25(4)21(15-8-10-33-13-15)35-23(32)22-28(25,27)37-22/h8,10,13,16-17,19,21-22H,7,9,11-12H2,1-6H3/t16?,17?,19-,21+,22-,25+,26-,27+,28-/m1/s1	KPDOJFFZKAUIOE-ZUDUQEJMSA-N	514.220282668							
Armodafinil	LSM-1343	Modafinil	4236	InChI=1S/C15H15NO2S/c16-14(17)11-19(18)15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,16,17)	YFGHCGITMMYXAQ-UHFFFAOYSA-N	NC(=O)CS(=O)C(c1ccccc1)c2ccccc2	BroadT	BRD-A16332958	BRD-A16332958-001-02-4	MicroSource Discovery Systems Inc.	1505361			NC(=O)CS(=O)C(c1ccccc1)c1ccccc1	InChI=1S/C15H15NO2S/c16-14(17)11-19(18)15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,16,17)	YFGHCGITMMYXAQ-UHFFFAOYSA-N	273.08234942							77585
1,3-Dideacetyldeoxykhivorin	LSM-22616		6710744	InChI=1S/C28H38O7/c1-15(29)34-22-11-18-25(2,3)20(30)13-21(31)27(18,5)17-7-9-26(4)19(28(17,22)6)12-23(32)35-24(26)16-8-10-33-14-16/h8,10,12,14,17-18,20-22,24,30-31H,7,9,11,13H2,1-6H3/t17?,18?,20-,21+,22-,24+,26+,27-,28-/m1/s1	UWNQSONNONTGTF-ZDFRXJMOSA-N	CC(=O)O[C@@H]1CC2C(C)(C)[C@H](O)C[C@H](O)[C@]2(C)C3CC[C@]4(C)[C@@H](OC(=O)C=C4[C@]13C)c5cocc5	BroadT	BRD-A12166214	BRD-A12166214-001-02-0	MicroSource Discovery Systems Inc.	212126			CC(=O)O[C@@H]1CC2C(C)(C)[C@H](O)C[C@H](O)[C@]2(C)C2CC[C@]3(C)[C@@H](OC(=O)C=C3[C@]12C)c1ccoc1	InChI=1S/C28H38O7/c1-15(29)34-22-11-18-25(2,3)20(30)13-21(31)27(18,5)17-7-9-26(4)19(28(17,22)6)12-23(32)35-24(26)16-8-10-33-14-16/h8,10,12,14,17-18,20-22,24,30-31H,7,9,11,13H2,1-6H3/t17?,18?,20-,21+,22-,24+,26+,27-,28-/m1/s1	UWNQSONNONTGTF-ZDFRXJMOSA-N	486.261753556							111168
Rolipram	LSM-1471	Rolipram, ZK-62771, ZK-62711	5092	InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)	HJORMJIFDVBMOB-UHFFFAOYSA-N	COc1ccc(cc1OC2CCCC2)C3CNC(=O)C3	BroadT	BRD-A34255068	BRD-A34255068-001-04-8	Biomol International Inc.	PD-175	2840(V2)-3-N1305		COc1ccc(cc1OC1CCCC1)C1CNC(=O)C1	InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)	HJORMJIFDVBMOB-UHFFFAOYSA-N	275.152143542							104872
AC1N0X2E	LSM-15336	BRD-A04258855	3970042	InChI=1S/C18H24Cl2N2O/c1-21(18(23)13-8-9-14(19)15(20)12-13)16-6-2-3-7-17(16)22-10-4-5-11-22/h8-9,12,16-17H,2-7,10-11H2,1H3	JUBNVWGVNWIXMB-UHFFFAOYSA-N	CN(C1CCCCC1N2CCCC2)C(=O)c3ccc(Cl)c(Cl)c3	BroadT	BRD-A04258855	BRD-A04258855-003-01-7	Tocris Bioscience	498	1	Cl	CN(C1CCCCC1N1CCCC1)C(=O)c1ccc(Cl)c(Cl)c1.Cl	InChI=1S/C18H24Cl2N2O.ClH/c1-21(18(23)13-8-9-14(19)15(20)12-13)16-6-2-3-7-17(16)22-10-4-5-11-22;/h8-9,12,16-17H,2-7,10-11H2,1H3;1H	WFUASZXAHZXJMX-UHFFFAOYSA-N	354.126568828							103982
Glafenine	LSM-4419	Glycerylaminophenaquine, Glaphenine, Glafenine, R-1707	3474	InChI=1S/C19H17ClN2O4/c20-12-5-6-14-17(7-8-21-18(14)9-12)22-16-4-2-1-3-15(16)19(25)26-11-13(24)10-23/h1-9,13,23-24H,10-11H2,(H,21,22)	GWOFUCIGLDBNKM-UHFFFAOYSA-N	OCC(O)COC(=O)c1ccccc1Nc2ccnc3cc(Cl)ccc23	BroadT	BRD-A38076815	BRD-A38076815-001-02-4	MicroSource Discovery Systems Inc.	1500996			OCC(O)COC(=O)c1ccccc1Nc1ccnc2cc(Cl)ccc12	InChI=1S/C19H17ClN2O4/c20-12-5-6-14-17(7-8-21-18(14)9-12)22-16-4-2-1-3-15(16)19(25)26-11-13(24)10-23/h1-9,13,23-24H,10-11H2,(H,21,22)	GWOFUCIGLDBNKM-UHFFFAOYSA-N	372.087684754							31653, 31653
Wiskostatin	LSM-1364	SID26756879	2775510	InChI=1S/C17H18Br2N2O/c1-20(2)9-13(22)10-21-16-5-3-11(18)7-14(16)15-8-12(19)4-6-17(15)21/h3-8,13,22H,9-10H2,1-2H3	XUBJEDZHBUPBKL-UHFFFAOYSA-N	CN(C)CC(O)Cn1c2ccc(Br)cc2c3cc(Br)ccc13	BroadT	BRD-A18579359	BRD-A18579359-001-03-1	Biomol International Inc.	T-126	2840(V2)-3-N1305		CN(C)CC(O)Cn1c2ccc(Br)cc2c2cc(Br)ccc12	InChI=1S/C17H18Br2N2O/c1-20(2)9-13(22)10-21-16-5-3-11(18)7-14(16)15-8-12(19)4-6-17(15)21/h3-8,13,22H,9-10H2,1-2H3	XUBJEDZHBUPBKL-UHFFFAOYSA-N	423.978588416							78012
LFM-A12	LSM-1567		9795867	InChI=1S/C12H9F3N2O3/c1-7(18)10(6-16)11(19)17-8-2-4-9(5-3-8)20-12(13,14)15/h2-5,10H,1H3,(H,17,19)	XXNKCLVHOZOIOC-UHFFFAOYSA-N	CC(=O)C(C#N)C(=O)Nc1ccc(OC(F)(F)F)cc1	BroadT	BRD-A44551378	BRD-A44551378-001-01-9	Calbiochem	435302			CC(=O)C(C#N)C(=O)Nc1ccc(OC(F)(F)F)cc1	InChI=1S/C12H9F3N2O3/c1-7(18)10(6-16)11(19)17-8-2-4-9(5-3-8)20-12(13,14)15/h2-5,10H,1H3,(H,17,19)	XXNKCLVHOZOIOC-UHFFFAOYSA-N	286.056526768							91713
Reboxetine	LSM-1561	Reboxetine, BRD-A43974499	3022645	InChI=1S/C19H23NO3/c1-2-21-16-10-6-7-11-17(16)23-19(15-8-4-3-5-9-15)18-14-20-12-13-22-18/h3-11,18-20H,2,12-14H2,1H3	CBQGYUDMJHNJBX-UHFFFAOYSA-N	CCOc1ccccc1OC(C2CNCCO2)c3ccccc3	BroadT	BRD-A43974499	BRD-A43974499-066-01-1	Tocris Bioscience	1982	4	CS(=O)(=O)O	CCOc1ccccc1OC(C1CNCCO1)c1ccccc1.CS(=O)(=O)O	InChI=1S/C19H23NO3.CH4O3S/c1-2-21-16-10-6-7-11-17(16)23-19(15-8-4-3-5-9-15)18-14-20-12-13-22-18;1-5(2,3)4/h3-11,18-20H,2,12-14H2,1H3;1H3,(H,2,3,4)	CGTZMJIMMUNLQD-UHFFFAOYSA-N	313.167793606							91710, 91710
Saclofen	LSM-1402		122150	InChI=1S/C9H12ClNO3S/c10-9-3-1-7(2-4-9)8(5-11)6-15(12,13)14/h1-4,8H,5-6,11H2,(H,12,13,14)	JYLNVJYYQQXNEK-UHFFFAOYSA-N	NCC(CS(=O)(=O)O)c1ccc(Cl)cc1	BroadT	BRD-A24122750	BRD-A24122750-001-01-1	Biomol International Inc.	AC-490	2819-N1292		NCC(CS(O)(=O)=O)c1ccc(Cl)cc1	InChI=1S/C9H12ClNO3S/c10-9-3-1-7(2-4-9)8(5-11)6-15(12,13)14/h1-4,8H,5-6,11H2,(H,12,13,14)	JYLNVJYYQQXNEK-UHFFFAOYSA-N	249.022641654							91596
362-74-3	LSM-1265	BRD-A04706586, SID104171395, SID26748671, SID427867	2460	InChI=1S/C18H24N5O8P/c1-3-5-11(24)22-16-13-17(20-8-19-16)23(9-21-13)18-15(30-12(25)6-4-2)14-10(29-18)7-28-32(26,27)31-14/h8-10,14-15,18H,3-7H2,1-2H3,(H,26,27)(H,19,20,22,24)	CJGYSWNGNKCJSB-UHFFFAOYSA-N	CCCC(=O)Nc1ncnc2c1ncn2C3OC4COP(=O)(O)OC4C3OC(=O)CCC	BroadT	BRD-A04706586	BRD-A04706586-236-01-7	Tocris Bioscience	1141	2	[Na]	CCCC(=O)Nc1ncnc2n(cnc12)C1OC2COP(O)(=O)OC2C1OC(=O)CCC.[Na]	InChI=1S/C18H24N5O8P.Na.H/c1-3-5-11(24)22-16-13-17(20-8-19-16)23(9-21-13)18-15(30-12(25)6-4-2)14-10(29-18)7-28-32(26,27)31-14;;/h8-10,14-15,18H,3-7H2,1-2H3,(H,26,27)(H,19,20,22,24);;	DBXVIQJWMFGXGO-UHFFFAOYSA-N	469.136249288							91494
Isoetharine	LSM-4374	Etyprenaline, Isoetarine, Isoetharine, WIN-3406	3762	InChI=1S/C13H21NO3/c1-4-10(14-8(2)3)13(17)9-5-6-11(15)12(16)7-9/h5-8,10,13-17H,4H2,1-3H3	HUYWAWARQUIQLE-UHFFFAOYSA-N	CCC(NC(C)C)C(O)c1ccc(O)c(O)c1	BroadT	BRD-A24587114	BRD-A24587114-066-03-5	Prestwick Chemical Inc.	Prestw-749	D0701-MP04-ST03-200-	CS(=O)(=O)O	CCC(NC(C)C)C(O)c1ccc(O)c(O)c1.CS(=O)(=O)O	InChI=1S/C13H21NO3.CH4O3S/c1-4-10(14-8(2)3)13(17)9-5-6-11(15)12(16)7-9;1-5(2,3)4/h5-8,10,13-17H,4H2,1-3H3;1H3,(H,2,3,4)	SOYAGMVKMXZVNZ-UHFFFAOYSA-N	239.152143542							6005, 6005, 6005
PCA-4248	LSM-1433	SID26751776, SID26751777, PCA 4248	4698	InChI=1S/C19H23NO4S/c1-12-16(18(21)23-4)13(2)20-14(3)17(12)19(22)24-10-11-25-15-8-6-5-7-9-15/h5-9,12,20H,10-11H2,1-4H3	DHCNAWNKZMNTIS-UHFFFAOYSA-N	COC(=O)C1=C(C)NC(=C(C1C)C(=O)OCCSc2ccccc2)C	BroadT	BRD-A29289453	BRD-A29289453-001-02-1	Biomol International Inc.	L-133	2840(V2)-3-N1305		COC(=O)C1=C(C)NC(C)=C(C1C)C(=O)OCCSc1ccccc1	InChI=1S/C19H23NO4S/c1-12-16(18(21)23-4)13(2)20-14(3)17(12)19(22)24-10-11-25-15-8-6-5-7-9-15/h5-9,12,20H,10-11H2,1-4H3	DHCNAWNKZMNTIS-UHFFFAOYSA-N	361.134778916							91615
Dehydrodihydrorotenone	LSM-4404		3950722	InChI=1S/C23H22O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,11,16H,8,10H2,1-4H3	BHCBWJBSVOKHRJ-UHFFFAOYSA-N	COc1cc2OCC3=C(C(=O)c4ccc5OC(Cc5c4O3)C(C)C)c2cc1OC	BroadT	BRD-A33119430	BRD-A33119430-001-02-2	MicroSource Discovery Systems Inc.	201484			COc1cc2OCc3oc4c5CC(Oc5ccc4c(=O)c3-c2cc1OC)C(C)C	InChI=1S/C23H22O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,11,16H,8,10H2,1-4H3	BHCBWJBSVOKHRJ-UHFFFAOYSA-N	394.141638424							93848
N-[(1-Ethylpyrrolidin-3-yl)methyl]-2-methoxy-5-sulfamoylbenzamide	LSM-1307	Sulpiride, SID26749932	4018928	InChI=1S/C15H23N3O4S/c1-3-18-7-6-11(10-18)9-17-15(19)13-8-12(23(16,20)21)4-5-14(13)22-2/h4-5,8,11H,3,6-7,9-10H2,1-2H3,(H,17,19)(H2,16,20,21)	IAGQNKXBDXVWPR-UHFFFAOYSA-N	CCN1CCC(CNC(=O)c2cc(ccc2OC)S(=O)(=O)N)C1	BroadT	BRD-A10715913	BRD-A10715913-001-02-0	MicroSource Discovery Systems Inc.	1501150			CCN1CCC(CNC(=O)c2cc(ccc2OC)S(N)(=O)=O)C1	InChI=1S/C15H23N3O4S/c1-3-18-7-6-11(10-18)9-17-15(19)13-8-12(23(16,20)21)4-5-14(13)22-2/h4-5,8,11H,3,6-7,9-10H2,1-2H3,(H,17,19)(H2,16,20,21)	IAGQNKXBDXVWPR-UHFFFAOYSA-N	341.140926936							91521
(1S,2R,4as,6as,6br,10S,12ar)-10-Hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid	LSM-22617	Ursolic Acid	3001199	InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21?,22?,23+,24?,27+,28-,29-,30+/m1/s1	WCGUUGGRBIKTOS-POPPTPIPSA-N	C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C2[C@H]1C)C(=O)O	BroadT	BRD-A34492468	BRD-A34492468-001-02-7	AnalytiCon Discovery GmbH	NP-000750			C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C2[C@H]1C)C(O)=O	InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21?,22?,23+,24?,27+,28-,29-,30+/m1/s1	WCGUUGGRBIKTOS-POPPTPIPSA-N	456.360345396							
Ambelline	LSM-1309		6708518	InChI=1S/C18H21NO5/c1-21-10-3-4-18-12-6-13-17(24-9-23-13)16(22-2)11(12)7-19(8-15(18)20)14(18)5-10/h3-4,6,10,14-15,20H,5,7-9H2,1-2H3/t10-,14?,15?,18?/m0/s1	QAHZAHIPKNLGAS-UVJOJOKMSA-N	CO[C@@H]1CC2N3CC(O)C2(C=C1)c4cc5OCOc5c(OC)c4C3	BroadT	BRD-A10969569	BRD-A10969569-001-02-0	MicroSource Discovery Systems Inc.	100530			CO[C@@H]1CC2N3CC(O)C2(C=C1)c1cc2OCOc2c(OC)c1C3	InChI=1S/C18H21NO5/c1-21-10-3-4-18-12-6-13-17(24-9-23-13)16(22-2)11(12)7-19(8-15(18)20)14(18)5-10/h3-4,6,10,14-15,20H,5,7-9H2,1-2H3/t10-,14?,15?,18?/m0/s1	QAHZAHIPKNLGAS-UVJOJOKMSA-N	331.141972782							91523
Pantoprazole	LSM-1390		4679	InChI=1S/C16H15F2N3O4S/c1-23-13-5-6-19-12(14(13)24-2)8-26(22)16-20-10-4-3-9(25-15(17)18)7-11(10)21-16/h3-7,15H,8H2,1-2H3,(H,20,21)	IQPSEEYGBUAQFF-UHFFFAOYSA-N	COc1ccnc(CS(=O)c2nc3cc(OC(F)F)ccc3[nH]2)c1OC	BroadT	BRD-A22380646	BRD-A22380646-001-01-5	MicroSource Discovery Systems Inc.	1505818			COc1ccnc(CS(=O)c2nc3cc(OC(F)F)ccc3[nH]2)c1OC	InChI=1S/C16H15F2N3O4S/c1-23-13-5-6-19-12(14(13)24-2)8-26(22)16-20-10-4-3-9(25-15(17)18)7-11(10)21-16/h3-7,15H,8H2,1-2H3,(H,20,21)	IQPSEEYGBUAQFF-UHFFFAOYSA-N	383.07513308							7915, 7915
Oxfendazole	LSM-1466		40854	InChI=1S/C15H13N3O3S/c1-21-15(19)18-14-16-12-8-7-11(9-13(12)17-14)22(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)	BEZZFPOZAYTVHN-UHFFFAOYSA-N	COC(=O)Nc1nc2ccc(cc2[nH]1)S(=O)c3ccccc3	BroadT	BRD-A33447119	BRD-A33447119-001-02-5	MicroSource Discovery Systems Inc.	1505296			COC(=O)Nc1nc2ccc(cc2[nH]1)S(=O)c1ccccc1	InChI=1S/C15H13N3O3S/c1-21-15(19)18-14-16-12-8-7-11(9-13(12)17-14)22(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)	BEZZFPOZAYTVHN-UHFFFAOYSA-N	315.067761996							35812
Methixene	LSM-1467	Metixene, Methixene	4167	InChI=1S/C20H23NS/c1-21-12-6-7-15(14-21)13-18-16-8-2-4-10-19(16)22-20-11-5-3-9-17(18)20/h2-5,8-11,15,18H,6-7,12-14H2,1H3	MJFJKKXQDNNUJF-UHFFFAOYSA-N	CN1CCCC(CC2c3ccccc3Sc4ccccc24)C1	BroadT	BRD-A33711280	BRD-A33711280-311-02-0	Prestwick Chemical Inc.	Prestw-491	D0701-MP04-ST03-200-	O.Cl	CN1CCCC(CC2c3ccccc3Sc3ccccc23)C1.O.Cl	InChI=1S/C20H23NS.ClH.H2O/c1-21-12-6-7-15(14-21)13-18-16-8-2-4-10-19(16)22-20-11-5-3-9-17(18)20;;/h2-5,8-11,15,18H,6-7,12-14H2,1H3;1H;1H2	RAOHHYUBMJLHNC-UHFFFAOYSA-N	309.155120436							51024, 51024, 51024
SPECTRUM_000541	LSM-4375	Deoxygedunin	6708508	InChI=1S/C28H34O6/c1-16(29)33-22-13-19-25(2,3)21(30)8-11-26(19,4)18-7-10-27(5)20(28(18,22)6)14-23(31)34-24(27)17-9-12-32-15-17/h8-9,11-12,14-15,18-19,22,24H,7,10,13H2,1-6H3/t18?,19?,22-,24+,26-,27-,28-/m1/s1	VOUDTVRGPAGHGA-OMRKLITNSA-N	CC(=O)O[C@@H]1CC2C(C)(C)C(=O)C=C[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]13C)c5cocc5	BroadT	BRD-A25243629	BRD-A25243629-001-02-1	MicroSource Discovery Systems Inc.	100432			CC(=O)O[C@@H]1CC2C(C)(C)C(=O)C=C[C@]2(C)C2CC[C@@]3(C)[C@@H](OC(=O)C=C3[C@]12C)c1ccoc1	InChI=1S/C28H34O6/c1-16(29)33-22-13-19-25(2,3)21(30)8-11-26(19,4)18-7-10-27(5)20(28(18,22)6)14-23(31)34-24(27)17-9-12-32-15-17/h8-9,11-12,14-15,18-19,22,24H,7,10,13H2,1-6H3/t18?,19?,22-,24+,26-,27-,28-/m1/s1	VOUDTVRGPAGHGA-OMRKLITNSA-N	466.235538808							93830
Amlodipine	LSM-1388	Amlodipine, Norvasc	2162	InChI=1S/C20H25ClN2O5/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21/h5-8,17,23H,4,9-11,22H2,1-3H3	HTIQEAQVCYTUBX-UHFFFAOYSA-N	CCOC(=O)C1=C(COCCN)NC(=C(C1c2ccccc2Cl)C(=O)OC)C	BroadT	BRD-A22032524	BRD-A22032524-074-03-2	Tocris Bioscience	2571	1	OS(=O)(=O)c1ccccc1	CCOC(=O)C1=C(COCCN)NC(C)=C(C1c1ccccc1Cl)C(=O)OC.OS(=O)(=O)c1ccccc1	InChI=1S/C20H25ClN2O5.C6H6O3S/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21;7-10(8,9)6-4-2-1-3-5-6/h5-8,17,23H,4,9-11,22H2,1-3H3;1-5H,(H,7,8,9)	ZPBWCRDSRKPIDG-UHFFFAOYSA-N	408.14519963							2668, 2668, 2668
Methocarbamol	LSM-1453	Methocarbamol, Miolaxin, Neuraxin, Forbaxin, Delaxin, Robaxin, Robaxin-750	4107	InChI=1S/C11H15NO5/c1-15-9-4-2-3-5-10(9)16-6-8(13)7-17-11(12)14/h2-5,8,13H,6-7H2,1H3,(H2,12,14)	GNXFOGHNGIVQEH-UHFFFAOYSA-N	COc1ccccc1OCC(O)COC(=O)N	BroadT	BRD-A31521121	BRD-A31521121-001-04-1	MicroSource Discovery Systems Inc.	1500397			COc1ccccc1OCC(O)COC(N)=O	InChI=1S/C11H15NO5/c1-15-9-4-2-3-5-10(9)16-6-8(13)7-17-11(12)14/h2-5,8,13H,6-7H2,1H3,(H2,12,14)	GNXFOGHNGIVQEH-UHFFFAOYSA-N	241.09502259							77498
AC1NWASB	LSM-22618	18-Alpha-Glycyrrhetinic Acid	5702158	InChI=1S/C30H46O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21-23,32H,8-15,17H2,1-7H3,(H,33,34)/t19-,21?,22+,23?,26-,27+,28+,29-,30-/m1/s1	MPDGHEJMBKOTSU-IYTIXWHISA-N	CC1(C)[C@@H](O)CC[C@@]2(C)C1CC[C@]3(C)C2C(=O)C=C4[C@H]5C[C@](C)(CC[C@]5(C)CC[C@@]34C)C(=O)O	BroadT	BRD-A20256229	BRD-A20256229-001-02-2	AnalytiCon Discovery GmbH	NP-010732			C[C@]12CC[C@@](C)(C[C@@H]1C1=CC(=O)C3[C@@]4(C)CC[C@H](O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(O)=O	InChI=1S/C30H46O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21-23,32H,8-15,17H2,1-7H3,(H,33,34)/t19-,21?,22+,23?,26-,27+,28+,29-,30-/m1/s1	MPDGHEJMBKOTSU-IYTIXWHISA-N	470.339609952							111169
ICI-89406	LSM-1257	BRD-A03359064, ICI 89406, ICI-89406	123686	InChI=1S/C19H22N4O3/c20-12-15-6-4-5-9-18(15)26-14-17(24)13-21-10-11-22-19(25)23-16-7-2-1-3-8-16/h1-9,17,21,24H,10-11,13-14H2,(H2,22,23,25)	HTLWRKRZKFAAAH-UHFFFAOYSA-N	OC(CNCCNC(=O)Nc1ccccc1)COc2ccccc2C#N	BroadT	BRD-A03359064	BRD-A03359064-001-01-5	Tocris Bioscience	832	1		OC(CNCCNC(=O)Nc1ccccc1)COc1ccccc1C#N	InChI=1S/C19H22N4O3/c20-12-15-6-4-5-9-18(15)26-14-17(24)13-21-10-11-22-19(25)23-16-7-2-1-3-8-16/h1-9,17,21,24H,10-11,13-14H2,(H2,22,23,25)	HTLWRKRZKFAAAH-UHFFFAOYSA-N	354.169190604							91488, 91488
Epibatidine	LSM-1518		1204	InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2	NLPRAJRHRHZCQQ-UHFFFAOYSA-N	Clc1ccc(cn1)C2CC3CCC2N3	BroadT	BRD-A39268308	BRD-A39268308-001-02-0	Biomol International Inc.	C114	2840(V2)-3-N1305		Clc1ccc(cn1)C1CC2CCC1N2	InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2	NLPRAJRHRHZCQQ-UHFFFAOYSA-N	208.076726146							91678, 91678, 91678
Lorglumide	LSM-4389	Lorglumide, CR-1409	3960	InChI=1S/C22H32Cl2N2O4/c1-3-5-7-13-26(14-8-6-4-2)22(30)19(11-12-20(27)28)25-21(29)16-9-10-17(23)18(24)15-16/h9-10,15,19H,3-8,11-14H2,1-2H3,(H,25,29)(H,27,28)	IEKOTSCYBBDIJC-UHFFFAOYSA-N	CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1	BroadT	BRD-A29854054	BRD-A29854054-236-03-5	Prestwick Chemical Inc.	Prestw-915	D0701-MP04-ST03-200-	[Na]	CCCCCN(CCCCC)C(=O)C(CCC(O)=O)NC(=O)c1ccc(Cl)c(Cl)c1.[Na]	InChI=1S/C22H32Cl2N2O4.Na.H/c1-3-5-7-13-26(14-8-6-4-2)22(30)19(11-12-20(27)28)25-21(29)16-9-10-17(23)18(24)15-16;;/h9-10,15,19H,3-8,11-14H2,1-2H3,(H,25,29)(H,27,28);;	VALRZGVAAOQAEK-UHFFFAOYSA-N	458.173912944							88307, 88307
ST092443	LSM-1481	BRD-A35338386, SID56422145, SID7975554	2868392	InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)	JADDQZYHOWSFJD-UHFFFAOYSA-N	CCNC(=O)C1OC(C(O)C1O)n2cnc3c(N)ncnc23	BroadT	BRD-A35338386	BRD-A35338386-001-04-6	Tocris Bioscience	1691	2		CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)ncnc12	InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)	JADDQZYHOWSFJD-UHFFFAOYSA-N	308.123303052							91647
Terfenadine	LSM-1273	Terfenadine, Seldane, RMI-9918	5405	InChI=1S/C32H41NO2/c1-31(2,3)26-18-16-25(17-19-26)30(34)15-10-22-33-23-20-29(21-24-33)32(35,27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-14,16-19,29-30,34-35H,10,15,20-24H2,1-3H3	GUGOEEXESWIERI-UHFFFAOYSA-N	CC(C)(C)c1ccc(cc1)C(O)CCCN2CCC(CC2)C(O)(c3ccccc3)c4ccccc4	BroadT	BRD-A06352418	BRD-A06352418-001-03-6	Prestwick Chemical Inc.	Prestw-138	D0701-MP04-ST03-200-		CC(C)(C)c1ccc(cc1)C(O)CCCN1CCC(CC1)C(O)(c1ccccc1)c1ccccc1	InChI=1S/C32H41NO2/c1-31(2,3)26-18-16-25(17-19-26)30(34)15-10-22-33-23-20-29(21-24-33)32(35,27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-14,16-19,29-30,34-35H,10,15,20-24H2,1-3H3	GUGOEEXESWIERI-UHFFFAOYSA-N	471.313729562							9453
Tubaic acid	LSM-1247	SID26749967	3919910	InChI=1S/C12H12O4/c1-6(2)10-5-8-9(16-10)4-3-7(11(8)13)12(14)15/h3-4,10,13H,1,5H2,2H3,(H,14,15)	CMXGHLJKXLIMAQ-UHFFFAOYSA-N	CC(=C)C1Cc2c(O)c(ccc2O1)C(=O)O	BroadT	BRD-A02176148	BRD-A02176148-001-02-2	MicroSource Discovery Systems Inc.	1600587			CC(=C)C1Cc2c(O1)ccc(C(O)=O)c2O	InChI=1S/C12H12O4/c1-6(2)10-5-8-9(16-10)4-3-7(11(8)13)12(14)15/h3-4,10,13H,1,5H2,2H3,(H,14,15)	CMXGHLJKXLIMAQ-UHFFFAOYSA-N	220.073558864							91480
CHEMBL602850	LSM-1328	BRD-A13964793	10040286	InChI=1S/C19H20FNO/c20-9-3-1-2-8(6-9)4-5-21-18-14-10-7-11-13-12(10)15(18)17(13)19(21,22)16(11)14/h1-3,6,10-18,22H,4-5,7H2	FYGREZKTJIXWIH-UHFFFAOYSA-N	OC12C3C4CC5C6C4C1C6C(C35)N2CCc7cccc(F)c7	BroadT	BRD-A13964793	BRD-A13964793-001-01-8	Tocris Bioscience	2669	1		OC12C3C4C5C3C(C3C5CC4C13)N2CCc1cccc(F)c1	InChI=1S/C19H20FNO/c20-9-3-1-2-8(6-9)4-5-21-18-14-10-7-11-13-12(10)15(18)17(13)19(21,22)16(11)14/h1-3,6,10-18,22H,4-5,7H2	FYGREZKTJIXWIH-UHFFFAOYSA-N	297.15289247							91540
KBIO2_006325	LSM-4372	BRD-A24436948	6708587	InChI=1S/C28H40O10/c1-13(29)35-18-12-19(36-14(2)30)26(6)15-9-10-25(5)20(22(32)34-8)37-23(33)21-28(25,38-21)27(15,7)17(31)11-16(26)24(18,3)4/h15-21,31H,9-12H2,1-8H3/t15?,16?,17-,18-,19+,20+,21?,25+,26-,27+,28?/m1/s1	HJESSLHNQMBHEX-LSIGHCQTSA-N	COC(=O)[C@@H]1OC(=O)C2OC23[C@@]1(C)CCC4[C@@]5(C)[C@H](C[C@@H](OC(=O)C)C(C)(C)C5C[C@@H](O)[C@@]34C)OC(=O)C	BroadT	BRD-A24436948	BRD-A24436948-001-02-6	MicroSource Discovery Systems Inc.	100650			COC(=O)[C@@H]1OC(=O)C2OC22[C@@]1(C)CCC1[C@@]3(C)[C@H](C[C@@H](OC(C)=O)C(C)(C)C3C[C@@H](O)[C@@]21C)OC(C)=O	InChI=1S/C28H40O10/c1-13(29)35-18-12-19(36-14(2)30)26(6)15-9-10-25(5)20(22(32)34-8)37-23(33)21-28(25,38-21)27(15,7)17(31)11-16(26)24(18,3)4/h15-21,31H,9-12H2,1-8H3/t15?,16?,17-,18-,19+,20+,21?,25+,26-,27+,28?/m1/s1	HJESSLHNQMBHEX-LSIGHCQTSA-N	536.26214748							
Mebeverine	LSM-1296	Mebeverine	4031	InChI=1S/C25H35NO5/c1-6-26(19(2)17-20-9-12-22(28-3)13-10-20)15-7-8-16-31-25(27)21-11-14-23(29-4)24(18-21)30-5/h9-14,18-19H,6-8,15-17H2,1-5H3	VYVKHNNGDFVQGA-UHFFFAOYSA-N	CCN(CCCCOC(=O)c1ccc(OC)c(OC)c1)C(C)Cc2ccc(OC)cc2	BroadT	BRD-A09467419	BRD-A09467419-003-04-2	Prestwick Chemical Inc.	Prestw-310	D0701-MP04-ST03-200-	Cl	CCN(CCCCOC(=O)c1ccc(OC)c(OC)c1)C(C)Cc1ccc(OC)cc1.Cl	InChI=1S/C25H35NO5.ClH/c1-6-26(19(2)17-20-9-12-22(28-3)13-10-20)15-7-8-16-31-25(27)21-11-14-23(29-4)24(18-21)30-5;/h9-14,18-19H,6-8,15-17H2,1-5H3;1H	PLGQWYOULXPJRE-UHFFFAOYSA-N	429.25152323							91514, 91514
SB 205384	LSM-1392	BRD-A22707317, SB-205384	197690	InChI=1S/C17H18N2O3S/c1-3-4-7-22-17(21)13-9(2)19-16-14(15(13)18)11-6-5-10(20)8-12(11)23-16/h10,20H,5-8H2,1-2H3,(H2,18,19)	JDTZAGLGBRRCJT-UHFFFAOYSA-N	CC#CCOC(=O)c1c(C)nc2sc3CC(O)CCc3c2c1N	BroadT	BRD-A22707317	BRD-A22707317-001-02-5	Tocris Bioscience	1512	1		CC#CCOC(=O)c1c(C)nc2sc3CC(O)CCc3c2c1N	InChI=1S/C17H18N2O3S/c1-3-4-7-22-17(21)13-9(2)19-16-14(15(13)18)11-6-5-10(20)8-12(11)23-16/h10,20H,5-8H2,1-2H3,(H2,18,19)	JDTZAGLGBRRCJT-UHFFFAOYSA-N	330.103813146							91586
Ifenprodil	LSM-4369	Ifenprodil, RC 61-91, Ifenprodil Tartrate	3689	InChI=1S/C21H27NO2/c1-16(21(24)19-7-9-20(23)10-8-19)22-13-11-18(12-14-22)15-17-5-3-2-4-6-17/h2-10,16,18,21,23-24H,11-15H2,1H3	UYNVMODNBIQBMV-UHFFFAOYSA-N	CC(C(O)c1ccc(O)cc1)N2CCC(Cc3ccccc3)CC2	BroadT	BRD-A24191444	BRD-A24191444-045-03-1	Prestwick Chemical Inc.	Prestw-311	D0701-MP04-ST03-200-	OC(C(O)C(=O)O)C(=O)O	CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1.OC(C(O)C(=O)O)C(=O)O	InChI=1S/C21H27NO2.C4H6O6/c1-16(21(24)19-7-9-20(23)10-8-19)22-13-11-18(12-14-22)15-17-5-3-2-4-6-17;5-1(3(7)8)2(6)4(9)10/h2-10,16,18,21,23-24H,11-15H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)	FFYMSFGBEJMSFP-UHFFFAOYSA-N	325.204179114							93829, 93829, 93829, 93829, 93829
Meptazinol	LSM-1252	Meptazinol	41049	InChI=1S/C15H23NO/c1-3-15(9-4-5-10-16(2)12-15)13-7-6-8-14(17)11-13/h6-8,11,17H,3-5,9-10,12H2,1-2H3	JLICHNCFTLFZJN-UHFFFAOYSA-N	CCC1(CCCCN(C)C1)c2cccc(O)c2	BroadT	BRD-A02710418	BRD-A02710418-003-03-5	Prestwick Chemical Inc.	Prestw-1004	D0701-MP04-ST03-200-	Cl	CCC1(CCCCN(C)C1)c1cccc(O)c1.Cl	InChI=1S/C15H23NO.ClH/c1-3-15(9-4-5-10-16(2)12-15)13-7-6-8-14(17)11-13;/h6-8,11,17H,3-5,9-10,12H2,1-2H3;1H	MPJUSISYVXABBH-UHFFFAOYSA-N	233.177964366							91484, 91484
AC1O0Z4E	LSM-22619	SID26751804, BRD-A04661934	6081682	InChI=1S/C21H23N5O/c27-21-23-19-9-5-4-8-18(19)20-22-16(15-26(20)21)14-24-10-12-25(13-11-24)17-6-2-1-3-7-17/h1-9,16H,10-15H2,(H,23,27)	ONSOQRPYFKDOEB-UHFFFAOYSA-N	O=C1Nc2ccccc2C3=NC(CN4CCN(CC4)c5ccccc5)CN13	BroadT	BRD-A04661934	BRD-A04661934-001-01-1	Tocris Bioscience	627	2		O=C1Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3)CN12	InChI=1S/C21H23N5O/c27-21-23-19-9-5-4-8-18(19)20-22-16(15-26(20)21)14-24-10-12-25(13-11-24)17-6-2-1-3-7-17/h1-9,16H,10-15H2,(H,23,27)	ONSOQRPYFKDOEB-UHFFFAOYSA-N	361.190260406							111170
AC1N6AX4	LSM-1272	BRD-A06276885	4257102	InChI=1S/C33H32N2O3/c36-26-13-12-22-16-27-33(37)17-24-23-8-4-5-9-25(23)35(19-20-6-2-1-3-7-20)29(24)31-32(33,28(22)30(26)38-31)14-15-34(27)18-21-10-11-21/h1-9,12-13,21,27,31,36-37H,10-11,14-19H2	PSPANKCQVWSVHM-UHFFFAOYSA-N	Oc1ccc2CC3N(CC4CC4)CCC56C(Oc1c25)c7c(CC36O)c8ccccc8n7Cc9ccccc9	BroadT	BRD-A06276885	BRD-A06276885-003-01-1	Tocris Bioscience	754	3	Cl	Oc1ccc2CC3N(CC4CC4)CCC45C(Oc1c24)c1c(CC35O)c2ccccc2n1Cc1ccccc1.Cl	InChI=1S/C33H32N2O3.ClH/c36-26-13-12-22-16-27-33(37)17-24-23-8-4-5-9-25(23)35(19-20-6-2-1-3-7-20)29(24)31-32(33,28(22)30(26)38-31)14-15-34(27)18-21-10-11-21;/h1-9,12-13,21,27,31,36-37H,10-11,14-19H2;1H	KDEBSUYWJUBPCB-UHFFFAOYSA-N	504.241292904							91499
Calcimycin	LSM-22620	SID26755301	40486	InChI=1S/C29H37N3O6/c1-15-10-11-29(17(3)13-16(2)27(38-29)18(4)26(33)20-7-6-12-31-20)37-22(15)14-23-32-25-21(36-23)9-8-19(30-5)24(25)28(34)35/h6-9,12,15-18,22,27,30-31H,10-11,13-14H2,1-5H3,(H,34,35)/t15-,16+,17+,18?,22-,27-,29?/m0/s1	HIYAVKIYRIFSCZ-CVXKHCKVSA-N	CNc1ccc2oc(C[C@@H]3OC4(CC[C@@H]3C)O[C@H](C(C)C(=O)c5ccc[nH]5)[C@H](C)C[C@H]4C)nc2c1C(=O)O	BroadT	BRD-A19134330	BRD-A19134330-001-03-8	Biomol International Inc.	CA-100	2840(V2)-3-N1305		CNc1ccc2oc(C[C@@H]3OC4(CC[C@@H]3C)O[C@H](C(C)C(=O)c3ccc[nH]3)[C@H](C)C[C@H]4C)nc2c1C(O)=O	InChI=1S/C29H37N3O6/c1-15-10-11-29(17(3)13-16(2)27(38-29)18(4)26(33)20-7-6-12-31-20)37-22(15)14-23-32-25-21(36-23)9-8-19(30-5)24(25)28(34)35/h6-9,12,15-18,22,27,30-31H,10-11,13-14H2,1-5H3,(H,34,35)/t15-,16+,17+,18?,22-,27-,29?/m0/s1	HIYAVKIYRIFSCZ-CVXKHCKVSA-N	523.268235934							3305
ICI-204448	LSM-1502	BRD-A37776212, ICI-204448	3683	InChI=1S/C23H26Cl2N2O4/c1-26(22(28)12-16-7-8-19(24)20(25)11-16)21(14-27-9-2-3-10-27)17-5-4-6-18(13-17)31-15-23(29)30/h4-8,11,13,21H,2-3,9-10,12,14-15H2,1H3,(H,29,30)	JKYJSFISYHSNOE-UHFFFAOYSA-N	CN(C(CN1CCCC1)c2cccc(OCC(=O)O)c2)C(=O)Cc3ccc(Cl)c(Cl)c3	BroadT	BRD-A37776212	BRD-A37776212-003-02-5	Tocris Bioscience	822	4	Cl	CN(C(CN1CCCC1)c1cccc(OCC(O)=O)c1)C(=O)Cc1ccc(Cl)c(Cl)c1.Cl	InChI=1S/C23H26Cl2N2O4.ClH/c1-26(22(28)12-16-7-8-19(24)20(25)11-16)21(14-27-9-2-3-10-27)17-5-4-6-18(13-17)31-15-23(29)30;/h4-8,11,13,21H,2-3,9-10,12,14-15H2,1H3,(H,29,30);1H	FNDGLVOYAQNQPE-UHFFFAOYSA-N	464.126962752							91666, 91666
Pheniramine	LSM-1397	Pheniramine	4761	InChI=1S/C16H20N2/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16/h3-10,12,15H,11,13H2,1-2H3	IJHNSHDBIRRJRN-UHFFFAOYSA-N	CN(C)CCC(c1ccccc1)c2ccccn2	BroadT	BRD-A23072235	BRD-A23072235-050-04-5	MicroSource Discovery Systems Inc.	1500478		OC(=O)/C=C\C(=O)O	CN(C)CCC(c1ccccc1)c1ccccn1.OC(=O)/C=C\C(=O)O	InChI=1S/C16H20N2.C4H4O4/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16;5-3(6)1-2-4(7)8/h3-10,12,15H,11,13H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-	SSOXZAQUVINQSA-BTJKTKAUSA-N	240.16264866							91591, 91591, 91591, 91591
Etilefrine	LSM-1302	Etilefrine, Etilefrine HCl	3306	InChI=1S/C10H15NO2/c1-2-11-7-10(13)8-4-3-5-9(12)6-8/h3-6,10-13H,2,7H2,1H3	SQVIAVUSQAWMKL-UHFFFAOYSA-N	CCNCC(O)c1cccc(O)c1	BroadT	BRD-A09925278	BRD-A09925278-003-03-1	Prestwick Chemical Inc.	Prestw-1017	D0701-MP04-ST03-200-	Cl	CCNCC(O)c1cccc(O)c1.Cl	InChI=1S/C10H15NO2.ClH/c1-2-11-7-10(13)8-4-3-5-9(12)6-8;/h3-6,10-13H,2,7H2,1H3;1H	KTNROWWHOBZQGK-UHFFFAOYSA-N	181.11027873							91518, 91518
Tetrahydrozoline	LSM-1430	Tetrahydrozoline, Tetryzoline, Tyzine	5419	InChI=1S/C13H16N2/c1-2-6-11-10(4-1)5-3-7-12(11)13-14-8-9-15-13/h1-2,4,6,12H,3,5,7-9H2,(H,14,15)	BYJAVTDNIXVSPW-UHFFFAOYSA-N	C1CC(C2=NCCN2)c3ccccc3C1	BroadT	BRD-A28856712	BRD-A28856712-003-04-7	MicroSource Discovery Systems Inc.	1500567		Cl	C1CN=C(N1)C1CCCc2ccccc12.Cl	InChI=1S/C13H16N2.ClH/c1-2-6-11-10(4-1)5-3-7-12(11)13-14-8-9-15-13;/h1-2,4,6,12H,3,5,7-9H2,(H,14,15);1H	BJORNXNYWNIWEY-UHFFFAOYSA-N	200.131348532							28674, 28674
Dyphylline	LSM-4299	Neothylline, Lufyllin, Glyphylline, Dyphylline, Diprophylline, Dilor, Dilor-400	3182	InChI=1S/C10H14N4O4/c1-12-8-7(9(17)13(2)10(12)18)14(5-11-8)3-6(16)4-15/h5-6,15-16H,3-4H2,1-2H3	KSCFJBIXMNOVSH-UHFFFAOYSA-N	CN1C(=O)N(C)c2ncn(CC(O)CO)c2C1=O	BroadT	BRD-A00827783	BRD-A00827783-001-04-8	MicroSource Discovery Systems Inc.	1500269			Cn1c2ncn(CC(O)CO)c2c(=O)n(C)c1=O	InChI=1S/C10H14N4O4/c1-12-8-7(9(17)13(2)10(12)18)14(5-11-8)3-6(16)4-15/h5-6,15-16H,3-4H2,1-2H3	KSCFJBIXMNOVSH-UHFFFAOYSA-N	254.101504968							4728
CGP-37157	LSM-1484	SID26752080	2688	InChI=1S/C15H11Cl2NOS/c16-9-5-6-13-11(7-9)15(20-8-14(19)18-13)10-3-1-2-4-12(10)17/h1-7,15H,8H2,(H,18,19)	KQEPIRKXSUIUTH-UHFFFAOYSA-N	Clc1ccc2NC(=O)CSC(c3ccccc3Cl)c2c1	BroadT	BRD-A35623999	BRD-A35623999-001-03-2	Biomol International Inc.	CM-119	2840(V2)-3-N1305		Clc1ccc2NC(=O)CSC(c3ccccc3Cl)c2c1	InChI=1S/C15H11Cl2NOS/c16-9-5-6-13-11(7-9)15(20-8-14(19)18-13)10-3-1-2-4-12(10)17/h1-7,15H,8H2,(H,18,19)	KQEPIRKXSUIUTH-UHFFFAOYSA-N	322.993840092							91650
KU14R	LSM-1509	BRD-A38747044	4302964	InChI=1S/C13H14N2O/c1-2-13(12-14-7-8-15-12)9-10-5-3-4-6-11(10)16-13/h3-8H,2,9H2,1H3,(H,14,15)	JCWVNNMJXQJVNC-UHFFFAOYSA-N	CCC1(Cc2ccccc2O1)c3ncc[nH]3	BroadT	BRD-A38747044	BRD-A38747044-001-01-5	Tocris Bioscience	1131	1		CCC1(Cc2ccccc2O1)c1ncc[nH]1	InChI=1S/C13H14N2O/c1-2-13(12-14-7-8-15-12)9-10-5-3-4-6-11(10)16-13/h3-8H,2,9H2,1H3,(H,14,15)	JCWVNNMJXQJVNC-UHFFFAOYSA-N	214.110613088							91671
Felodipine	LSM-1447	Felodipine, Plendil, H 154/82, H-154/82	3333	InChI=1S/C18H19Cl2NO4/c1-5-25-18(23)14-10(3)21-9(2)13(17(22)24-4)15(14)11-7-6-8-12(19)16(11)20/h6-8,15,21H,5H2,1-4H3	RZTAMFZIAATZDJ-UHFFFAOYSA-N	CCOC(=O)C1=C(C)NC(=C(C1c2cccc(Cl)c2Cl)C(=O)OC)C	BroadT	BRD-A30815329	BRD-A30815329-001-03-0	Prestwick Chemical Inc.	Prestw-478	D0701-MP04-ST03-200-		CCOC(=O)C1=C(C)NC(C)=C(C1c1cccc(Cl)c1Cl)C(=O)OC	InChI=1S/C18H19Cl2NO4/c1-5-25-18(23)14-10(3)21-9(2)13(17(22)24-4)15(14)11-7-6-8-12(19)16(11)20/h6-8,15,21H,5H2,1-4H3	RZTAMFZIAATZDJ-UHFFFAOYSA-N	383.069113518							585948
BRD1641	LSM-4310	BRD-A04231641	5137129	InChI=1S/C25H30N2O6/c1-32-20(30)7-6-19(29)26-16-8-9-25(31)18-12-15-4-5-17(28)22-21(15)24(25,23(16)33-22)10-11-27(18)13-14-2-3-14/h4-7,14,16,18,23,28,31H,2-3,8-13H2,1H3,(H,26,29)	PQKHESYTSKMWFP-UHFFFAOYSA-N	COC(=O)C=CC(=O)NC1CCC2(O)C3Cc4ccc(O)c5OC1C2(CCN3CC6CC6)c45	BroadT	BRD-A04231641	BRD-A04231641-003-01-3	Tocris Bioscience	926	7	Cl	COC(=O)C=CC(=O)NC1CCC2(O)C3Cc4ccc(O)c5OC1C2(CCN3CC1CC1)c45.Cl	InChI=1S/C25H30N2O6.ClH/c1-32-20(30)7-6-19(29)26-16-8-9-25(31)18-12-15-4-5-17(28)22-21(15)24(25,23(16)33-22)10-11-27(18)13-14-2-3-14;/h4-7,14,16,18,23,28,31H,2-3,8-13H2,1H3,(H,26,29);1H	BIPHUOBUKMPSQR-UHFFFAOYSA-N	454.2103867							93793, 93793
Acebutolol	LSM-4384	Acebutolol, Sectral	1978	InChI=1S/C18H28N2O4/c1-5-6-18(23)20-14-7-8-17(16(9-14)13(4)21)24-11-15(22)10-19-12(2)3/h7-9,12,15,19,22H,5-6,10-11H2,1-4H3,(H,20,23)	GOEMGAFJFRBGGG-UHFFFAOYSA-N	CCCC(=O)Nc1ccc(OCC(O)CNC(C)C)c(c1)C(=O)C	BroadT	BRD-A29260609	BRD-A29260609-003-04-7	MicroSource Discovery Systems Inc.	1500665		Cl	CCCC(=O)Nc1ccc(OCC(O)CNC(C)C)c(c1)C(C)=O.Cl	InChI=1S/C18H28N2O4.ClH/c1-5-6-18(23)20-14-7-8-17(16(9-14)13(4)21)24-11-15(22)10-19-12(2)3;/h7-9,12,15,19,22H,5-6,10-11H2,1-4H3,(H,20,23);1H	KTUFKADDDORSSI-UHFFFAOYSA-N	336.204907396							2379, 2379
CGP-52432	LSM-1264	CGP 52432, SID11113993	132252	InChI=1S/C15H24Cl2NO4P/c1-3-21-15(22-4-2)23(19,20)9-5-8-18-11-12-6-7-13(16)14(17)10-12/h6-7,10,15,18H,3-5,8-9,11H2,1-2H3,(H,19,20)	GJZVQXWEIYRHBE-UHFFFAOYSA-N	CCOC(OCC)P(=O)(O)CCCNCc1ccc(Cl)c(Cl)c1	BroadT	BRD-A04668240	BRD-A04668240-001-01-5	Biomol International Inc.	AC-487	2819-N1292		CCOC(OCC)P(O)(=O)CCCNCc1ccc(Cl)c(Cl)c1	InChI=1S/C15H24Cl2NO4P/c1-3-21-15(22-4-2)23(19,20)9-5-8-18-11-12-6-7-13(16)14(17)10-12/h6-7,10,15,18H,3-5,8-9,11H2,1-2H3,(H,19,20)	GJZVQXWEIYRHBE-UHFFFAOYSA-N	383.082000188							91493
Remacemide	LSM-1489	Remacemide, BRD-A36074203	60511	InChI=1S/C17H20N2O/c1-17(19-16(20)13-18,15-10-6-3-7-11-15)12-14-8-4-2-5-9-14/h2-11H,12-13,18H2,1H3,(H,19,20)	YSGASDXSLKIKOD-UHFFFAOYSA-N	CC(Cc1ccccc1)(NC(=O)CN)c2ccccc2	BroadT	BRD-A36074203	BRD-A36074203-003-03-5	Tocris Bioscience	1622	1	Cl	CC(Cc1ccccc1)(NC(=O)CN)c1ccccc1.Cl	InChI=1S/C17H20N2O.ClH/c1-17(19-16(20)13-18,15-10-6-3-7-11-15)12-14-8-4-2-5-9-14;/h2-11H,12-13,18H2,1H3,(H,19,20);1H	HYQMIUSWZXGTCC-UHFFFAOYSA-N	268.15756328							91654, 91654
Ibuprofen	LSM-1354	Medipren, Midol, Ibuprohm, Ibuprofen, Motrin, Nuprin, Profen, Rufen, Advil, Caldolor, Ibuprin, U-18573, IBU-TAB 200, Junior Strength Ibuprofen, Junior Strength Motrin, Midol Liquid Gels, Motrin IB, Motrin Migraine Pain, Pediatric Advil, Tab-Profen, Junior Strength Advil, Aches-N-Pain, Advil Liqui-Gels, Advil Migraine Liqui-Gels, Cap-Profen, Children'S Ibuprofen, Children'S Motrin, Children'S Advil, Children'S Advil-Flavored, Children'S Elixsure, IBU-Tab	3672	InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)	HEFNNWSXXWATRW-UHFFFAOYSA-N	CC(C)Cc1ccc(cc1)C(C)C(=O)O	BroadT	BRD-A17655518	BRD-A17655518-001-02-0	MicroSource Discovery Systems Inc.	1500347			CC(C)Cc1ccc(cc1)C(C)C(O)=O	InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)	HEFNNWSXXWATRW-UHFFFAOYSA-N	206.130679816							5855, 5855, 5855
AC1O8PXK	LSM-1538	Vitexin, SID56463768	6713958	InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21?/m1/s1	SGEWCQFRYRRZDC-YWFAZRBLSA-N	OC[C@H]1OC([C@H](O)[C@@H](O)[C@@H]1O)c2c(O)cc(O)c3C(=O)C=C(Oc23)c4ccc(O)cc4	BroadT	BRD-A41941932	BRD-A41941932-001-03-0	Prestwick Chemical Inc.	Prestw-661	D0701-MP04-ST03-200-		OC[C@H]1OC([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccc(O)cc1	InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21?/m1/s1	SGEWCQFRYRRZDC-YWFAZRBLSA-N	432.10564684							91693
SB-218078	LSM-1274	SB-218078, SB 218078	3387354	InChI=1S/C24H15N3O3/c28-23-19-17-11-5-1-3-7-13(11)26-15-9-10-16(30-15)27-14-8-4-2-6-12(14)18(22(27)21(17)26)20(19)24(29)25-23/h1-8,15-16H,9-10H2,(H,25,28,29)	OTPNDVKVEAIXTI-UHFFFAOYSA-N	O=C1NC(=O)c2c1c3c4ccccc4n5C6CCC(O6)n7c8ccccc8c2c7c35	BroadT	BRD-A06352508	BRD-A06352508-001-02-9	Tocris Bioscience	2560	1		O=C1NC(=O)c2c1c1c3ccccc3n3C4CCC(O4)n4c5ccccc5c2c4c13	InChI=1S/C24H15N3O3/c28-23-19-17-11-5-1-3-7-13(11)26-15-9-10-16(30-15)27-14-8-4-2-6-12(14)18(22(27)21(17)26)20(19)24(29)25-23/h1-8,15-16H,9-10H2,(H,25,28,29)	OTPNDVKVEAIXTI-UHFFFAOYSA-N	393.11134137							91500
Entandrophragmin	LSM-4430		6708543	InChI=1S/C43H56O17/c1-12-21(4)30(47)53-25-16-35(7)28(23-13-14-52-18-23)54-27(45)17-40(35)43-32(55-29(46)20(2)3)41(50)31(56-33(48)36(8)22(5)57-36)34(6)19-39(41,49)37(9,24(34)15-26(44)51-11)42(25,43)59-38(10,58-40)60-43/h13-14,18,20-22,24-25,28,31-32,49-50H,12,15-17,19H2,1-11H3/t21?,22?,24-,25+,28-,31-,32+,34-,35-,36?,37+,38?,39-,40?,41-,42?,43?/m0/s1	BUVRFGBECZFCRL-YDTKTFQDSA-N	CCC(C)C(=O)O[C@@H]1C[C@@]2(C)[C@@H](OC(=O)CC23OC4(C)OC15[C@]6(C)[C@@H](CC(=O)OC)[C@]7(C)C[C@@]6(O)[C@](O)([C@H]7OC(=O)C8(C)OC8C)[C@@H](OC(=O)C(C)C)C35O4)c9cocc9	BroadT	BRD-A41916216	BRD-A41916216-001-02-1	MicroSource Discovery Systems Inc.	100517			CCC(C)C(=O)O[C@@H]1C[C@@]2(C)[C@@H](OC(=O)CC22OC3(C)OC22[C@H](OC(=O)C(C)C)[C@@]4(O)[C@@H](OC(=O)C5(C)OC5C)[C@@]5(C)C[C@]4(O)[C@@](C)([C@H]5CC(=O)OC)C12O3)c1ccoc1	InChI=1S/C43H56O17/c1-12-21(4)30(47)53-25-16-35(7)28(23-13-14-52-18-23)54-27(45)17-40(35)43-32(55-29(46)20(2)3)41(50)31(56-33(48)36(8)22(5)57-36)34(6)19-39(41,49)37(9,24(34)15-26(44)51-11)42(25,43)59-38(10,58-40)60-43/h13-14,18,20-22,24-25,28,31-32,49-50H,12,15-17,19H2,1-11H3/t21?,22?,24-,25+,28-,31-,32+,34-,35-,36?,37+,38?,39-,40?,41-,42?,43?/m0/s1	BUVRFGBECZFCRL-YDTKTFQDSA-N	844.351750332							
2-MPMDQ	LSM-22621	BRD-A35871558, SID26751828	4534085	InChI=1S/C23H27N5O2/c1-25-19-8-4-3-7-18(19)22-24-17(16-28(22)23(25)29)15-26-11-13-27(14-12-26)20-9-5-6-10-21(20)30-2/h3-10,17H,11-16H2,1-2H3	OULFYKAESNCMFJ-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC3CN4C(=O)N(C)c5ccccc5C4=N3)CC2	BroadT	BRD-A35871558	BRD-A35871558-001-01-4	Tocris Bioscience	661	1		COc1ccccc1N1CCN(CC2CN3C(=N2)c2ccccc2N(C)C3=O)CC1	InChI=1S/C23H27N5O2/c1-25-19-8-4-3-7-18(19)22-24-17(16-28(22)23(25)29)15-26-11-13-27(14-12-26)20-9-5-6-10-21(20)30-2/h3-10,17H,11-16H2,1-2H3	OULFYKAESNCMFJ-UHFFFAOYSA-N	405.216475154							111171
3-Amino-beta-pinene	LSM-15337	BRD-A31576716	3612673	InChI=1S/C10H17N/c1-6-8-4-7(5-9(6)11)10(8,2)3/h7-9H,1,4-5,11H2,2-3H3	ZEKALTOSWFXTCN-UHFFFAOYSA-N	CC1(C)C2CC(N)C(=C)C1C2	BroadT	BRD-A31576716	BRD-A31576716-003-02-6	MicroSource Discovery Systems Inc.	300106		Cl	CC1(C)C2CC1C(=C)C(N)C2.Cl	InChI=1S/C10H17N.ClH/c1-6-8-4-7(5-9(6)11)10(8,2)3;/h7-9H,1,4-5,11H2,2-3H3;1H	SQSDBXYJKLVZJR-UHFFFAOYSA-N	151.136099554							103983, 103983
Procyclidine	LSM-4396	Procyclidine	4919	InChI=1S/C19H29NO/c21-19(17-9-3-1-4-10-17,18-11-5-2-6-12-18)13-16-20-14-7-8-15-20/h1,3-4,9-10,18,21H,2,5-8,11-16H2	WYDUSKDSKCASEF-UHFFFAOYSA-N	OC(CCN1CCCC1)(C2CCCCC2)c3ccccc3	BroadT	BRD-A31800922	BRD-A31800922-003-04-6	MicroSource Discovery Systems Inc.	1500507		Cl	OC(CCN1CCCC1)(C1CCCCC1)c1ccccc1.Cl	InChI=1S/C19H29NO.ClH/c21-19(17-9-3-1-4-10-17,18-11-5-2-6-12-18)13-16-20-14-7-8-15-20;/h1,3-4,9-10,18,21H,2,5-8,11-16H2;1H	ZFSPFXJSEHCTTR-UHFFFAOYSA-N	287.224914558							8448, 8448
SKF 82958	LSM-22622	SK&F-82958, SK-82958	1225	InChI=1S/C19H20ClNO2/c1-2-9-21-10-8-14-15(11-17(22)19(23)18(14)20)16(12-21)13-6-4-3-5-7-13/h2-7,11,16,22-23H,1,8-10,12H2	HJWHHQIVUHOBQN-UHFFFAOYSA-N	Oc1cc2C(CN(CC=C)CCc2c(Cl)c1O)c3ccccc3	BroadT	BRD-A04438777	BRD-A04438777-001-01-4	Biomol International Inc.	AC-826	2812-3-N1298		Oc1cc2C(CN(CC=C)CCc2c(Cl)c1O)c1ccccc1	InChI=1S/C19H20ClNO2/c1-2-9-21-10-8-14-15(11-17(22)19(23)18(14)20)16(12-21)13-6-4-3-5-7-13/h2-7,11,16,22-23H,1,8-10,12H2	HJWHHQIVUHOBQN-UHFFFAOYSA-N	329.1182566							111172, 111172
Zopiclone	LSM-4408	Zopiclone, Zopicloneimovane, RP-27267	5735	InChI=1S/C17H17ClN6O3/c1-22-6-8-23(9-7-22)17(26)27-16-14-13(19-4-5-20-14)15(25)24(16)12-3-2-11(18)10-21-12/h2-5,10,16H,6-9H2,1H3	GBBSUAFBMRNDJC-UHFFFAOYSA-N	CN1CCN(CC1)C(=O)OC2N(C(=O)c3nccnc23)c4ccc(Cl)cn4	BroadT	BRD-A34309505	BRD-A34309505-001-08-5	Tocris Bioscience	1094	1		CN1CCN(CC1)C(=O)OC1N(C(=O)c2nccnc12)c1ccc(Cl)cn1	InChI=1S/C17H17ClN6O3/c1-22-6-8-23(9-7-22)17(26)27-16-14-13(19-4-5-20-14)15(25)24(16)12-3-2-11(18)10-21-12/h2-5,10,16H,6-9H2,1H3	GBBSUAFBMRNDJC-UHFFFAOYSA-N	388.105066174							32315
Atenolol	LSM-4355	Unibloc, Tenormin, Ibinolo, Esatenolol, Atenolol, ICI-66082	2249	InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)	METKIMKYRPQLGS-UHFFFAOYSA-N	CC(C)NCC(O)COc1ccc(CC(=O)N)cc1	BroadT	BRD-A20239487	BRD-A20239487-001-02-5	MicroSource Discovery Systems Inc.	1501127			CC(C)NCC(O)COc1ccc(CC(N)=O)cc1	InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)	METKIMKYRPQLGS-UHFFFAOYSA-N	266.163042584							2904
Sulfinpyrazone	LSM-1491		5342	InChI=1S/C23H20N2O3S/c26-22-21(16-17-29(28)20-14-8-3-9-15-20)23(27)25(19-12-6-2-7-13-19)24(22)18-10-4-1-5-11-18/h1-15,21H,16-17H2	MBGGBVCUIVRRBF-UHFFFAOYSA-N	O=C1C(CCS(=O)c2ccccc2)C(=O)N(N1c3ccccc3)c4ccccc4	BroadT	BRD-A36217750	BRD-A36217750-001-04-9	MicroSource Discovery Systems Inc.	1500554			O=C1C(CCS(=O)c2ccccc2)C(=O)N(N1c1ccccc1)c1ccccc1	InChI=1S/C23H20N2O3S/c26-22-21(16-17-29(28)20-14-8-3-9-15-20)23(27)25(19-12-6-2-7-13-19)24(22)18-10-4-1-5-11-18/h1-15,21H,16-17H2	MBGGBVCUIVRRBF-UHFFFAOYSA-N	404.11946321							9342
Rebamipide	LSM-4343	Rebamipide	5042	InChI=1S/C19H15ClN2O4/c20-13-7-5-11(6-8-13)18(24)22-16(19(25)26)9-12-10-17(23)21-15-4-2-1-3-14(12)15/h1-8,10,16H,9H2,(H,21,23)(H,22,24)(H,25,26)	ALLWOAVDORUJLA-UHFFFAOYSA-N	OC(=O)C(CC1=CC(=O)Nc2ccccc12)NC(=O)c3ccc(Cl)cc3	BroadT	BRD-A15909516	BRD-A15909516-001-02-5	MicroSource Discovery Systems Inc.	1505310			OC(=O)C(Cc1cc(=O)[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	InChI=1S/C19H15ClN2O4/c20-13-7-5-11(6-8-13)18(24)22-16(19(25)26)9-12-10-17(23)21-15-4-2-1-3-14(12)15/h1-8,10,16H,9H2,(H,21,23)(H,22,24)(H,25,26)	ALLWOAVDORUJLA-UHFFFAOYSA-N	370.07203469							93814
SPECTRUM3_001992	LSM-1242	Chlormadinone, Chlormadinone Acetate	6710779	InChI=1S/C23H29ClO4/c1-13(25)23(28-14(2)26)10-7-18-16-12-20(24)19-11-15(27)5-8-21(19,3)17(16)6-9-22(18,23)4/h11-12,16-18H,5-10H2,1-4H3/t16?,17?,18?,21-,22+,23+/m1/s1	QMBJSIBWORFWQT-GDMUWPLKSA-N	CC(=O)O[C@@]1(CCC2C3C=C(Cl)C4=CC(=O)CC[C@]4(C)C3CC[C@]12C)C(=O)C	BroadT	BRD-A01593789	BRD-A01593789-001-01-5	MicroSource Discovery Systems Inc.	1505327			CC(=O)O[C@@]1(CCC2C3C=C(Cl)C4=CC(=O)CC[C@]4(C)C3CC[C@]12C)C(C)=O	InChI=1S/C23H29ClO4/c1-13(25)23(28-14(2)26)10-7-18-16-12-20(24)19-11-15(27)5-8-21(19,3)17(16)6-9-22(18,23)4/h11-12,16-18H,5-10H2,1-4H3/t16?,17?,18?,21-,22+,23+/m1/s1	QMBJSIBWORFWQT-GDMUWPLKSA-N	404.175437118							
Bambuterol	LSM-4346	Bambuterol	54766	InChI=1S/C18H29N3O5/c1-18(2,3)19-11-15(22)12-8-13(25-16(23)20(4)5)10-14(9-12)26-17(24)21(6)7/h8-10,15,19,22H,11H2,1-7H3	ANZXOIAKUNOVQU-UHFFFAOYSA-N	CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNC(C)(C)C	BroadT	BRD-A17462676	BRD-A17462676-003-03-3	Prestwick Chemical Inc.	Prestw-361	D0701-MP04-ST03-200-	Cl	CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNC(C)(C)C.Cl	InChI=1S/C18H29N3O5.ClH/c1-18(2,3)19-11-15(22)12-8-13(25-16(23)20(4)5)10-14(9-12)26-17(24)21(6)7;/h8-10,15,19,22H,11H2,1-7H3;1H	LBARATORRVNNQM-UHFFFAOYSA-N	367.210721058							553827, 553827
AM-92016	LSM-1319	BRD-A11813248, AM-92016	2129	InChI=1S/C19H24Cl2N2O4S/c1-23(10-9-14-3-8-18(20)19(21)11-14)12-16(24)13-27-17-6-4-15(5-7-17)22-28(2,25)26/h3-8,11,16,22,24H,9-10,12-13H2,1-2H3	BQBSHJUQVIWEFM-UHFFFAOYSA-N	CN(CCc1ccc(Cl)c(Cl)c1)CC(O)COc2ccc(NS(=O)(=O)C)cc2	BroadT	BRD-A11813248	BRD-A11813248-001-02-8	Biomol International Inc.	AC-115	2840(V2)-3-N1305		CN(CCc1ccc(Cl)c(Cl)c1)CC(O)COc1ccc(NS(C)(=O)=O)cc1	InChI=1S/C19H24Cl2N2O4S/c1-23(10-9-14-3-8-18(20)19(21)11-14)12-16(24)13-27-17-6-4-15(5-7-17)22-28(2,25)26/h3-8,11,16,22,24H,9-10,12-13H2,1-2H3	BQBSHJUQVIWEFM-UHFFFAOYSA-N	446.083383378							91532
DHZBEENLJMYSHQ-UHFFFAOYSA-N	LSM-4433	Cantharidin, SID26753535, SID26753536, SID50105998	2545	InChI=1S/C10H12O4/c1-9-5-3-4-6(13-5)10(9,2)8(12)14-7(9)11/h5-6H,3-4H2,1-2H3	DHZBEENLJMYSHQ-UHFFFAOYSA-N	CC12C3CCC(O3)C1(C)C(=O)OC2=O	BroadT	BRD-A43076080	BRD-A43076080-001-03-3	Tocris Bioscience	1548	1		CC12C3CCC(O3)C1(C)C(=O)OC2=O	InChI=1S/C10H12O4/c1-9-5-3-4-6(13-5)10(9,2)8(12)14-7(9)11/h5-6H,3-4H2,1-2H3	DHZBEENLJMYSHQ-UHFFFAOYSA-N	196.073558864							93862
BIOMOL-NT_000114	LSM-4316	Ondansetron	14474436	InChI=1S/C18H21N3O/c1-12-19-9-10-21(12)11-13-7-8-16-17(18(13)22)14-5-3-4-6-15(14)20(16)2/h3-6,9-10,13,16-17H,7-8,11H2,1-2H3	JIMWRSFMRULTNX-UHFFFAOYSA-N	CN1C2CCC(Cn3ccnc3C)C(=O)C2c4ccccc14	BroadT	BRD-A07195938	BRD-A07195938-001-01-3	Biomol International Inc.	.NS-145	2813-N1283		CN1C2CCC(Cn3ccnc3C)C(=O)C2c2ccccc12	InChI=1S/C18H21N3O/c1-12-19-9-10-21(12)11-13-7-8-16-17(18(13)22)14-5-3-4-6-15(14)20(16)2/h3-6,9-10,13,16-17H,7-8,11H2,1-2H3	JIMWRSFMRULTNX-UHFFFAOYSA-N	295.168462322							93795
RO-201724	LSM-22623	RO-20-1724, RO 20 1724, RO-201724	5087	InChI=1S/C15H22N2O3/c1-3-4-7-20-14-9-11(5-6-13(14)19-2)8-12-10-16-15(18)17-12/h5-6,9,12H,3-4,7-8,10H2,1-2H3,(H2,16,17,18)	PDMUULPVBYQBBK-UHFFFAOYSA-N	CCCCOc1cc(CC2CNC(=O)N2)ccc1OC	BroadT	BRD-A07207424	BRD-A07207424-001-04-1	Biomol International Inc.	EI-117	2840(V2)-3-N1305		CCCCOc1cc(CC2CNC(=O)N2)ccc1OC	InChI=1S/C15H22N2O3/c1-3-4-7-20-14-9-11(5-6-13(14)19-2)8-12-10-16-15(18)17-12/h5-6,9,12H,3-4,7-8,10H2,1-2H3,(H2,16,17,18)	PDMUULPVBYQBBK-UHFFFAOYSA-N	278.163042584							111173
Deoxyandirobin	LSM-4305		6708516	InChI=1S/C27H32O6/c1-16-18(26(4)11-8-21(28)25(2,3)20(26)14-22(29)31-6)7-10-27(5)19(16)13-23(30)33-24(27)17-9-12-32-15-17/h8-9,11-13,15,18,20,24H,1,7,10,14H2,2-6H3/t18?,20-,24-,26+,27+/m0/s1	CUJHOPQCBJBWQL-GJGRSQDYSA-N	COC(=O)C[C@H]1C(C)(C)C(=O)C=C[C@]1(C)C2CC[C@@]3(C)[C@@H](OC(=O)C=C3C2=C)c4cocc4	BroadT	BRD-A02799884	BRD-A02799884-001-02-9	MicroSource Discovery Systems Inc.	100016			COC(=O)C[C@H]1C(C)(C)C(=O)C=C[C@]1(C)C1CC[C@@]2(C)[C@@H](OC(=O)C=C2C1=C)c1ccoc1	InChI=1S/C27H32O6/c1-16-18(26(4)11-8-21(28)25(2,3)20(26)14-22(29)31-6)7-10-27(5)19(16)13-23(30)33-24(27)17-9-12-32-15-17/h8-9,11-13,15,18,20,24H,1,7,10,14H2,2-6H3/t18?,20-,24-,26+,27+/m0/s1	CUJHOPQCBJBWQL-GJGRSQDYSA-N	452.219888744							93790
Iocetamic acid	LSM-1498	Cholebrine, MP-620, Iocetamic Acid	27648	InChI=1S/C12H13I3N2O3/c1-5(12(19)20)4-17(6(2)18)11-8(14)3-7(13)10(16)9(11)15/h3,5H,4,16H2,1-2H3,(H,19,20)	GSVQIUGOUKJHRC-UHFFFAOYSA-N	CC(CN(C(=O)C)c1c(I)cc(I)c(N)c1I)C(=O)O	BroadT	BRD-A37492983	BRD-A37492983-001-03-8	Prestwick Chemical Inc.	Prestw-838	D0701-MP04-ST03-200-		CC(CN(C(C)=O)c1c(I)cc(I)c(N)c1I)C(O)=O	InChI=1S/C12H13I3N2O3/c1-5(12(19)20)4-17(6(2)18)11-8(14)3-7(13)10(16)9(11)15/h3,5H,4,16H2,1-2H3,(H,19,20)	GSVQIUGOUKJHRC-UHFFFAOYSA-N	613.806021296							91662
KBIO2_000585	LSM-22624	BRD-A12372458	6708622	InChI=1S/C26H32O7/c1-22(2)15-10-18(29)25(5)14(24(15,4)17(28)11-16(22)27)6-8-23(3)19(13-7-9-31-12-13)32-21(30)20-26(23,25)33-20/h7,9,12,14-16,19-20,27H,6,8,10-11H2,1-5H3/t14?,15?,16-,19+,20-,23+,24-,25+,26-/m1/s1	BSZLLSHGSWKZRE-IYLQSFRJSA-N	CC1(C)[C@H](O)CC(=O)[C@@]2(C)C1CC(=O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@@]345)c6cocc6	BroadT	BRD-A12372458	BRD-A12372458-001-02-9	MicroSource Discovery Systems Inc.	100358			CC1(C)[C@H](O)CC(=O)[C@@]2(C)C1CC(=O)[C@]1(C)C2CC[C@@]2(C)[C@@H](OC(=O)[C@H]3O[C@@]123)c1ccoc1	InChI=1S/C26H32O7/c1-22(2)15-10-18(29)25(5)14(24(15,4)17(28)11-16(22)27)6-8-23(3)19(13-7-9-31-12-13)32-21(30)20-26(23,25)33-20/h7,9,12,14-16,19-20,27H,6,8,10-11H2,1-5H3/t14?,15?,16-,19+,20-,23+,24-,25+,26-/m1/s1	BSZLLSHGSWKZRE-IYLQSFRJSA-N	456.214803364							
Tulobuterol	LSM-4417	Tulobuterol, Tulobuterol HCl	5606	InChI=1S/C12H18ClNO/c1-12(2,3)14-8-11(15)9-6-4-5-7-10(9)13/h4-7,11,14-15H,8H2,1-3H3	YREYLAVBNPACJM-UHFFFAOYSA-N	CC(C)(C)NCC(O)c1ccccc1Cl	BroadT	BRD-A37441042	BRD-A37441042-003-02-2	MicroSource Discovery Systems Inc.	1503954		Cl	CC(C)(C)NCC(O)c1ccccc1Cl.Cl	InChI=1S/C12H18ClNO.ClH/c1-12(2,3)14-8-11(15)9-6-4-5-7-10(9)13;/h4-7,11,14-15H,8H2,1-3H3;1H	RSLNRVYIRDVHLY-UHFFFAOYSA-N	227.107691916							93856, 93856
Ofloxacin	LSM-4370	Visiren, Tarivid, Ofloxacin, Ocuflox, Floxin, HOE-280, DL-8280, Floxin Otic	4583	InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)	GSDSWSVVBLHKDQ-UHFFFAOYSA-N	CC1COc2c(N3CCN(C)CC3)c(F)cc4C(=O)C(=CN1c24)C(=O)O	BroadT	BRD-A24228527	BRD-A24228527-001-04-2	MicroSource Discovery Systems Inc.	1502044			CC1COc2c(N3CCN(C)CC3)c(F)cc3c2n1cc(C(O)=O)c3=O	InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)	GSDSWSVVBLHKDQ-UHFFFAOYSA-N	361.14378435							7731, 7731
Carpindolol	LSM-1340	Carpindolol, BRD-A15530910	193949	InChI=1S/C19H28N2O4/c1-12(2)25-18(23)16-9-14-15(21-16)7-6-8-17(14)24-11-13(22)10-20-19(3,4)5/h6-9,12-13,20-22H,10-11H2,1-5H3	SJYFDORQYYEJLB-UHFFFAOYSA-N	CC(C)OC(=O)c1cc2c(OCC(O)CNC(C)(C)C)cccc2[nH]1	BroadT	BRD-A15530910	BRD-A15530910-001-01-3	Tocris Bioscience	1516	1		CC(C)OC(=O)c1cc2c(OCC(O)CNC(C)(C)C)cccc2[nH]1	InChI=1S/C19H28N2O4/c1-12(2)25-18(23)16-9-14-15(21-16)7-6-8-17(14)24-11-13(22)10-20-19(3,4)5/h6-9,12-13,20-22H,10-11H2,1-5H3	SJYFDORQYYEJLB-UHFFFAOYSA-N	348.204907396							91550
Tetrahydrocortisone-3,21-diacetate	LSM-6374	BRD-A03503284	6710630	InChI=1S/C25H36O7/c1-14(26)31-13-21(29)25(30)10-8-19-18-6-5-16-11-17(32-15(2)27)7-9-23(16,3)22(18)20(28)12-24(19,25)4/h16-19,22,30H,5-13H2,1-4H3/t16-,17-,18?,19?,22?,23+,24+,25+/m1/s1	PXQRJZNDFRAFTF-SJAFLYPYSA-N	CC(=O)OCC(=O)[C@@]1(O)CCC2C3CC[C@@H]4C[C@@H](CC[C@]4(C)C3C(=O)C[C@]12C)OC(=O)C	BroadT	BRD-A03503284	BRD-A03503284-001-02-0	MicroSource Discovery Systems Inc.	1701049			CC(=O)OCC(=O)[C@@]1(O)CCC2C3CC[C@@H]4C[C@@H](CC[C@]4(C)C3C(=O)C[C@]12C)OC(C)=O	InChI=1S/C25H36O7/c1-14(26)31-13-21(29)25(30)10-8-19-18-6-5-16-11-17(32-15(2)27)7-9-23(16,3)22(18)20(28)12-24(19,25)4/h16-19,22,30H,5-13H2,1-4H3/t16-,17-,18?,19?,22?,23+,24+,25+/m1/s1	PXQRJZNDFRAFTF-SJAFLYPYSA-N	448.246103492							95110
BH3I 1	LSM-42819	SID29217514, BH3I-1	5720188	InChI=1S/C15H14BrNO3S2/c1-8(2)12(14(19)20)17-13(18)11(22-15(17)21)7-9-3-5-10(16)6-4-9/h3-8,12H,1-2H3,(H,19,20)/b11-7-	COHIEJLWRGREHV-XFFZJAGNSA-N	CC(C)C(N1C(=S)S\C(=C/c2ccc(Br)cc2)\C1=O)C(=O)O	BroadT	BRD-A38913120	BRD-A38913120-001-01-0	EMD Biosciences	286890			CC(C)C(N1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O)C(O)=O	InChI=1S/C15H14BrNO3S2/c1-8(2)12(14(19)20)17-13(18)11(22-15(17)21)7-9-3-5-10(16)6-4-9/h3-8,12H,1-2H3,(H,19,20)/b11-7-	COHIEJLWRGREHV-XFFZJAGNSA-N	398.959847298							
Otenzepad	LSM-22625	Otenzepad, BRD-A00520476	107867	InChI=1S/C24H31N5O2/c1-3-27(4-2)16-18-10-7-8-15-28(18)17-22(30)29-21-13-6-5-11-19(21)24(31)26-20-12-9-14-25-23(20)29/h5-6,9,11-14,18H,3-4,7-8,10,15-17H2,1-2H3,(H,26,31)	UBRKDAVQCKZSPO-UHFFFAOYSA-N	CCN(CC)CC1CCCCN1CC(=O)N2c3ccccc3C(=O)Nc4cccnc24	BroadT	BRD-A00520476	BRD-A00520476-001-03-3	Tocris Bioscience	1105	2		CCN(CC)CC1CCCCN1CC(=O)N1c2ccccc2C(=O)Nc2cccnc12	InChI=1S/C24H31N5O2/c1-3-27(4-2)16-18-10-7-8-15-28(18)17-22(30)29-21-13-6-5-11-19(21)24(31)26-20-12-9-14-25-23(20)29/h5-6,9,11-14,18H,3-4,7-8,10,15-17H2,1-2H3,(H,26,31)	UBRKDAVQCKZSPO-UHFFFAOYSA-N	421.247775282							111174
Suprofen Methyl Ester	LSM-4332	SID26748396	3642305	InChI=1S/C15H14O3S/c1-10(15(17)18-2)11-5-7-12(8-6-11)14(16)13-4-3-9-19-13/h3-10H,1-2H3	XJKZZVPYOOIMPE-UHFFFAOYSA-N	COC(=O)C(C)c1ccc(cc1)C(=O)c2cccs2	BroadT	BRD-A11154023	BRD-A11154023-001-02-8	MicroSource Discovery Systems Inc.	1500779			COC(=O)C(C)c1ccc(cc1)C(=O)c1cccs1	InChI=1S/C15H14O3S/c1-10(15(17)18-2)11-5-7-12(8-6-11)14(16)13-4-3-9-19-13/h3-10H,1-2H3	XJKZZVPYOOIMPE-UHFFFAOYSA-N	274.066364998							93807
Atropine	LSM-4380	BRD-A27290375	174174	InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15?,16?	RKUNBYITZUJHSG-PJPHBNEVSA-N	CN1[C@H]2CC[C@@H]1CC(C2)OC(=O)C(CO)c3ccccc3	BroadT	BRD-A27290375	BRD-A27290375-001-01-8	AnalytiCon Discovery GmbH	NP-010662			CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)c1ccccc1	InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16?	RKUNBYITZUJHSG-SPUOUPEWSA-N	289.167793606							
Bupropion	LSM-1267	Bupropion	444	InChI=1S/C13H18ClNO/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10/h5-9,15H,1-4H3	SNPPWIUOZRMYNY-UHFFFAOYSA-N	CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1	BroadT	BRD-A05186015	BRD-A05186015-003-04-0	MicroSource Discovery Systems Inc.	1504174		Cl	CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1.Cl	InChI=1S/C13H18ClNO.ClH/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10;/h5-9,15H,1-4H3;1H	HEYVINCGKDONRU-UHFFFAOYSA-N	239.107691916							3219, 3219, 3219
Gemifloxacin	LSM-44972	175463-14-6, Gemifloxacin	5464436	InChI=1S/C18H20FN5O4/c1-28-22-14-8-23(6-9(14)5-20)17-13(19)4-11-15(25)12(18(26)27)7-24(10-2-3-10)16(11)21-17/h4,7,9-10H,2-3,5-6,8,20H2,1H3,(H,26,27)/b22-14+	ZRCVYEYHRGVLOC-HYARGMPZSA-N	CO\N=C\1/CN(CC1CN)c2nc3N(C=C(C(=O)O)C(=O)c3cc2F)C4CC4	BroadT	BRD-A40787240	BRD-A40787240-066-02-0	MicroSource Discovery Systems Inc.	1505802		CS(=O)(=O)O	CO\N=C1/CN(CC1CN)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1.CS(=O)(=O)O	InChI=1S/C18H20FN5O4.CH4O3S/c1-28-22-14-8-23(6-9(14)5-20)17-13(19)4-11-15(25)12(18(26)27)7-24(10-2-3-10)16(11)21-17;1-5(2,3)4/h4,7,9-10H,2-3,5-6,8,20H2,1H3,(H,26,27);1H3,(H,2,3,4)/b22-14+;	JIYMVSQRGZEYAX-CWUUNJJBSA-N	389.14993237							101853, 101853
Cpccoet	LSM-1360	BRD-A05729358, BRD-A18202423	5126051	InChI=1S/C13H13NO4/c1-2-17-12(15)13-7-9(13)11(14-16)8-5-3-4-6-10(8)18-13/h3-6,9,16H,2,7H2,1H3	FXCTZFMSAHZQTR-UHFFFAOYSA-N	CCOC(=O)C12CC1C(=NO)c3ccccc3O2	BroadT	BRD-A18202423	BRD-A18202423-001-01-6	Tocris Bioscience	1028	10		CCOC(=O)C12CC1C(=NO)c1ccccc1O2	InChI=1S/C13H13NO4/c1-2-17-12(15)13-7-9(13)11(14-16)8-5-3-4-6-10(8)18-13/h3-6,9,16H,2,7H2,1H3	FXCTZFMSAHZQTR-UHFFFAOYSA-N	247.084457906							91562
Chlormezanone	LSM-4356	Trancopal, Chlormezanone, Chlormethazanone	2717	InChI=1S/C11H12ClNO3S/c1-13-10(14)6-7-17(15,16)11(13)8-2-4-9(12)5-3-8/h2-5,11H,6-7H2,1H3	WEQAYVWKMWHEJO-UHFFFAOYSA-N	CN1C(c2ccc(Cl)cc2)S(=O)(=O)CCC1=O	BroadT	BRD-A20348246	BRD-A20348246-001-04-2	MicroSource Discovery Systems Inc.	2300062			CN1C(c2ccc(Cl)cc2)S(=O)(=O)CCC1=O	InChI=1S/C11H12ClNO3S/c1-13-10(14)6-7-17(15,16)11(13)8-2-4-9(12)5-3-8/h2-5,11H,6-7H2,1H3	WEQAYVWKMWHEJO-UHFFFAOYSA-N	273.022641654							3619
Stictic acid	LSM-4387	NSC-87511	73677	InChI=1S/C19H14O9/c1-6-4-9(25-3)8(5-20)15-10(6)17(22)27-14-7(2)13(21)11-12(16(14)26-15)19(24)28-18(11)23/h4-5,19,21,24H,1-3H3	SKCUFZLDTAYNBZ-UHFFFAOYSA-N	COc1cc(C)c2C(=O)Oc3c(C)c(O)c4C(=O)OC(O)c4c3Oc2c1C=O	BroadT	BRD-A29578214	BRD-A29578214-001-02-7	MicroSource Discovery Systems Inc.	300006			COc1cc(C)c2c(Oc3c4C(O)OC(=O)c4c(O)c(C)c3OC2=O)c1C=O	InChI=1S/C19H14O9/c1-6-4-9(25-3)8(5-20)15-10(6)17(22)27-14-7(2)13(21)11-12(16(14)26-15)19(24)28-18(11)23/h4-5,19,21,24H,1-3H3	SKCUFZLDTAYNBZ-UHFFFAOYSA-N	386.063782028							93839
Trichlormethiazide	LSM-4383	Trichlormethiazide, Trichlormas, Trichlorex, Naqua, Metahydrin	5560	InChI=1S/C8H8Cl3N3O4S2/c9-3-1-4-6(2-5(3)19(12,15)16)20(17,18)14-8(13-4)7(10)11/h1-2,7-8,13-14H,(H2,12,15,16)	LMJSLTNSBFUCMU-UHFFFAOYSA-N	NS(=O)(=O)c1cc2c(NC(NS2(=O)=O)C(Cl)Cl)cc1Cl	BroadT	BRD-A28940325	BRD-A28940325-001-04-2	MicroSource Discovery Systems Inc.	1500590			NS(=O)(=O)c1cc2c(NC(NS2(=O)=O)C(Cl)Cl)cc1Cl	InChI=1S/C8H8Cl3N3O4S2/c9-3-1-4-6(2-5(3)19(12,15)16)20(17,18)14-8(13-4)7(10)11/h1-2,7-8,13-14H,(H2,12,15,16)	LMJSLTNSBFUCMU-UHFFFAOYSA-N	378.902180276							9683
UB-165	LSM-1331	BRD-A14574269, UB-165	4694339	InChI=1S/C13H15ClN2/c14-13-7-4-9(8-15-13)11-3-1-2-10-5-6-12(11)16-10/h3-4,7-8,10,12,16H,1-2,5-6H2	TVSNVPGPFGAKPT-UHFFFAOYSA-N	Clc1ccc(cn1)C2=CCCC3CCC2N3	BroadT	BRD-A14574269	BRD-A14574269-051-01-4	Tocris Bioscience	1348	2	OC(=O)/C=C/C(=O)O	Clc1ccc(cn1)C1=CCCC2CCC1N2.OC(=O)/C=C/C(=O)O	InChI=1S/C13H15ClN2.C4H4O4/c14-13-7-4-9(8-15-13)11-3-1-2-10-5-6-12(11)16-10;5-3(6)1-2-4(7)8/h3-4,7-8,10,12,16H,1-2,5-6H2;1-2H,(H,5,6)(H,7,8)/b;2-1+	DZFRKSLRKAKJIB-WLHGVMLRSA-N	234.09237621							91542
Cetirizine	LSM-1544	Cetirizine	2678	InChI=1S/C21H25ClN2O3/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26/h1-9,21H,10-16H2,(H,25,26)	ZKLPARSLTMPFCP-UHFFFAOYSA-N	OC(=O)COCCN1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3	BroadT	BRD-A42571354	BRD-A42571354-300-01-3	TimTec LLC	ST024755		Cl.Cl	OC(=O)COCCN1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1.Cl.Cl	InChI=1S/C21H25ClN2O3.2ClH/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26;;/h1-9,21H,10-16H2,(H,25,26);2*1H	PGLIUCLTXOYQMV-UHFFFAOYSA-N	388.15537039							3561, 3561, 3561
KBIO3_001042	LSM-22626	BRD-A13983189	6708781	InChI=1S/C26H32O6/c1-22(2)16-12-18(28)25(5)15(23(16,3)9-7-17(22)27)6-10-24(4)19(14-8-11-30-13-14)31-21(29)20-26(24,25)32-20/h7-9,11,13,15-17,19-20,27H,6,10,12H2,1-5H3/t15?,16?,17-,19-,20+,23+,24-,25-,26+/m0/s1	APNJDIVXMGGHDX-MHKPZZPRSA-N	CC1(C)[C@@H](O)C=C[C@@]2(C)C1CC(=O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@@]345)c6cocc6	BroadT	BRD-A13983189	BRD-A13983189-001-02-8	MicroSource Discovery Systems Inc.	100901			CC1(C)[C@@H](O)C=C[C@@]2(C)C1CC(=O)[C@]1(C)C2CC[C@@]2(C)[C@@H](OC(=O)[C@H]3O[C@@]123)c1ccoc1	InChI=1S/C26H32O6/c1-22(2)16-12-18(28)25(5)15(23(16,3)9-7-17(22)27)6-10-24(4)19(14-8-11-30-13-14)31-21(29)20-26(24,25)32-20/h7-9,11,13,15-17,19-20,27H,6,10,12H2,1-5H3/t15?,16?,17-,19-,20+,23+,24-,25-,26+/m0/s1	APNJDIVXMGGHDX-MHKPZZPRSA-N	440.219888744							
Disopyramide	LSM-1439	Disopyramide, Norpace, SC-7031	3114	InChI=1S/C21H29N3O/c1-16(2)24(17(3)4)15-13-21(20(22)25,18-10-6-5-7-11-18)19-12-8-9-14-23-19/h5-12,14,16-17H,13,15H2,1-4H3,(H2,22,25)	UVTNFZQICZKOEM-UHFFFAOYSA-N	CC(C)N(CCC(C(=O)N)(c1ccccc1)c2ccccn2)C(C)C	BroadT	BRD-A29734509	BRD-A29734509-011-02-9	MicroSource Discovery Systems Inc.	1500261		OP(=O)(O)O	CC(C)N(CCC(C(N)=O)(c1ccccc1)c1ccccn1)C(C)C.OP(=O)(O)O	InChI=1S/C21H29N3O.H3O4P/c1-16(2)24(17(3)4)15-13-21(20(22)25,18-10-6-5-7-11-18)19-12-8-9-14-23-19;1-5(2,3)4/h5-12,14,16-17H,13,15H2,1-4H3,(H2,22,25);(H3,1,2,3,4)	CGDDQFMPGMYYQP-UHFFFAOYSA-N	339.231062578							4657, 4657
Alprenolol	LSM-1238	Alprenolol	2119	InChI=1S/C15H23NO2/c1-4-7-13-8-5-6-9-15(13)18-11-14(17)10-16-12(2)3/h4-6,8-9,12,14,16-17H,1,7,10-11H2,2-3H3	PAZJSJFMUHDSTF-UHFFFAOYSA-N	CC(C)NCC(O)COc1ccccc1CC=C	BroadT	BRD-A00993607	BRD-A00993607-003-04-8	MicroSource Discovery Systems Inc.	2300166		Cl	CC(C)NCC(O)COc1ccccc1CC=C.Cl	InChI=1S/C15H23NO2.ClH/c1-4-7-13-8-5-6-9-15(13)18-11-14(17)10-16-12(2)3;/h4-6,8-9,12,14,16-17H,1,7,10-11H2,2-3H3;1H	RRCPAXJDDNWJBI-UHFFFAOYSA-N	249.172878986							51211, 51211, 51211
Alfuzosin	LSM-1291	Alfuzosin, Uroxatral	2092	InChI=1S/C19H27N5O4/c1-24(8-5-7-21-18(25)14-6-4-9-28-14)19-22-13-11-16(27-3)15(26-2)10-12(13)17(20)23-19/h10-11,14H,4-9H2,1-3H3,(H,21,25)(H2,20,22,23)	WNMJYKCGWZFFKR-UHFFFAOYSA-N	COc1cc2nc(nc(N)c2cc1OC)N(C)CCCNC(=O)C3CCCO3	BroadT	BRD-A09056319	BRD-A09056319-003-03-6	Prestwick Chemical Inc.	Prestw-322	D0701-MP04-ST03-200-	Cl	COc1cc2nc(nc(N)c2cc1OC)N(C)CCCNC(=O)C1CCCO1.Cl	InChI=1S/C19H27N5O4.ClH/c1-24(8-5-7-21-18(25)14-6-4-9-28-14)19-22-13-11-16(27-3)15(26-2)10-12(13)17(20)23-19;/h10-11,14H,4-9H2,1-3H3,(H,21,25)(H2,20,22,23);1H	YTNKWDJILNVLGX-UHFFFAOYSA-N	389.206304394							51141, 51141
Badge	LSM-1345	SID26752169, SID26752170, SID26752171, SID17389141, Bisphenol-A	2286	InChI=1S/C21H24O4/c1-21(2,15-3-7-17(8-4-15)22-11-19-13-24-19)16-5-9-18(10-6-16)23-12-20-14-25-20/h3-10,19-20H,11-14H2,1-2H3	LCFVJGUPQDGYKZ-UHFFFAOYSA-N	CC(C)(c1ccc(OCC2CO2)cc1)c3ccc(OCC4CO4)cc3	BroadT	BRD-A16694057	BRD-A16694057-001-02-7	Biomol International Inc.	GR-244	2840(V2)-3-N1305		CC(C)(c1ccc(OCC2CO2)cc1)c1ccc(OCC2CO2)cc1	InChI=1S/C21H24O4/c1-21(2,15-3-7-17(8-4-15)22-11-19-13-24-19)16-5-9-18(10-6-16)23-12-20-14-25-20/h3-10,19-20H,11-14H2,1-2H3	LCFVJGUPQDGYKZ-UHFFFAOYSA-N	340.167459248							34578
Famprofazone	LSM-4322	Famprofazone	3326	InChI=1S/C24H31N3O/c1-18(2)23-22(17-25(4)19(3)16-20-12-8-6-9-13-20)26(5)27(24(23)28)21-14-10-7-11-15-21/h6-15,18-19H,16-17H2,1-5H3	GNUXVOXXWGNPIV-UHFFFAOYSA-N	CC(C)C1=C(CN(C)C(C)Cc2ccccc2)N(C)N(C1=O)c3ccccc3	BroadT	BRD-A08255417	BRD-A08255417-001-03-0	Prestwick Chemical Inc.	Prestw-703	D0701-MP04-ST03-200-		CC(Cc1ccccc1)N(C)Cc1c(C(C)C)c(=O)n(-c2ccccc2)n1C	InChI=1S/C24H31N3O/c1-18(2)23-22(17-25(4)19(3)16-20-12-8-6-9-13-20)26(5)27(24(23)28)21-14-10-7-11-15-21/h6-15,18-19H,16-17H2,1-5H3	GNUXVOXXWGNPIV-UHFFFAOYSA-N	377.246712642							93799
979-32-8	LSM-1523	Estradiol-Valerate, Estradiol Valerate	163332	InChI=1S/C23H32O3/c1-3-4-5-22(25)26-21-11-10-20-19-8-6-15-14-16(24)7-9-17(15)18(19)12-13-23(20,21)2/h7,9,14,18-21,24H,3-6,8,10-13H2,1-2H3/t18?,19?,20?,21-,23-/m0/s1	RSEPBGGWRJCQGY-ZZSVNSIZSA-N	CCCCC(=O)O[C@H]1CCC2C3CCc4cc(O)ccc4C3CC[C@]12C	BroadT	BRD-A39747742	BRD-A39747742-001-02-7	MicroSource Discovery Systems Inc.	1500284			CCCCC(=O)O[C@H]1CCC2C3CCc4cc(O)ccc4C3CC[C@]12C	InChI=1S/C23H32O3/c1-3-4-5-22(25)26-21-11-10-20-19-8-6-15-14-16(24)7-9-17(15)18(19)12-13-23(20,21)2/h7,9,14,18-21,24H,3-6,8,10-13H2,1-2H3/t18?,19?,20?,21-,23-/m0/s1	RSEPBGGWRJCQGY-ZZSVNSIZSA-N	356.235144884							91682
Isoproterenol	LSM-4311	Isoprenaline, Isoproterenol	3779	InChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8/h3-5,7,11-15H,6H2,1-2H3	JWZZKOKVBUJMES-UHFFFAOYSA-N	CC(C)NCC(O)c1ccc(O)c(O)c1	BroadT	BRD-A04322457	BRD-A04322457-003-03-9	MicroSource Discovery Systems Inc.	1500357		Cl	CC(C)NCC(O)c1ccc(O)c(O)c1.Cl	InChI=1S/C11H17NO3.ClH/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8;/h3-5,7,11-15H,6H2,1-2H3;1H	IROWCYIEJAOFOW-UHFFFAOYSA-N	211.120843414							64317, 64317, 64317
BAYK 8644	LSM-22627	Bayk-8644, (+/-)-Bay-K-8644, BAY-K-8644, NCG-C00025209-02	2303	InChI=1S/C16H15F3N2O4/c1-8-12(15(22)25-3)13(14(21(23)24)9(2)20-8)10-6-4-5-7-11(10)16(17,18)19/h4-7,13,20H,1-3H3	ZFLWDHHVRRZMEI-UHFFFAOYSA-N	COC(=O)C1=C(C)NC(=C(C1c2ccccc2C(F)(F)F)[N+](=O)[O-])C	BroadT	BRD-A05457250	BRD-A05457250-001-03-5	Biomol International Inc.	CA-410	2840(V2)-3-N1305		COC(=O)C1=C(C)NC(C)=C(C1c1ccccc1C(F)(F)F)[N+]([O-])=O	InChI=1S/C16H15F3N2O4/c1-8-12(15(22)25-3)13(14(21(23)24)9(2)20-8)10-6-4-5-7-11(10)16(17,18)19/h4-7,13,20H,1-3H3	ZFLWDHHVRRZMEI-UHFFFAOYSA-N	356.09839158							131345
Pseudopelletierine	LSM-1370		11096	InChI=1S/C9H15NO/c1-10-7-3-2-4-8(10)6-9(11)5-7/h7-8H,2-6H2,1H3	RHWSKVCZXBAWLZ-UHFFFAOYSA-N	CN1C2CCCC1CC(=O)C2	BroadT	BRD-A19053259	BRD-A19053259-003-03-3	Prestwick Chemical Inc.	Prestw-625	D0701-MP04-ST03-200-	Cl	CN1C2CCCC1CC(=O)C2.Cl	InChI=1S/C9H15NO.ClH/c1-10-7-3-2-4-8(10)6-9(11)5-7;/h7-8H,2-6H2,1H3;1H	CVGRGXQEVKWHHS-UHFFFAOYSA-N	153.11536411							, 
KBIO3_000989	LSM-22628	BRD-A04975445	6708599	InChI=1S/C26H32O7/c1-22(2)14-10-15(27)25(5)13(24(14,4)19-16(31-19)17(22)28)6-8-23(3)18(12-7-9-30-11-12)32-21(29)20-26(23,25)33-20/h7,9,11,13-16,18-20,27H,6,8,10H2,1-5H3/t13?,14?,15-,16+,18+,19+,20?,23+,24-,25+,26?/m1/s1	UIUKQADPLSFRBN-NIJWRPTQSA-N	CC1(C)C2C[C@@H](O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)C5OC345)c6cocc6)[C@@]2(C)[C@H]7O[C@H]7C1=O	BroadT	BRD-A04975445	BRD-A04975445-001-02-5	MicroSource Discovery Systems Inc.	100223			CC1(C)C2C[C@@H](O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)C5OC345)c3ccoc3)[C@@]2(C)[C@H]2O[C@H]2C1=O	InChI=1S/C26H32O7/c1-22(2)14-10-15(27)25(5)13(24(14,4)19-16(31-19)17(22)28)6-8-23(3)18(12-7-9-30-11-12)32-21(29)20-26(23,25)33-20/h7,9,11,13-16,18-20,27H,6,8,10H2,1-5H3/t13?,14?,15-,16+,18+,19+,20?,23+,24-,25+,26?/m1/s1	UIUKQADPLSFRBN-NIJWRPTQSA-N	456.214803364							
Metolachor	LSM-4435	Metolachlor, SID26749784, SID26753773	4169	InChI=1S/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3	WVQBLGZPHOPPFO-UHFFFAOYSA-N	CCc1cccc(C)c1N(C(C)COC)C(=O)CCl	BroadT	BRD-A43135847	BRD-A43135847-001-02-3	MicroSource Discovery Systems Inc.	330035			CCc1cccc(C)c1N(C(C)COC)C(=O)CCl	InChI=1S/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3	WVQBLGZPHOPPFO-UHFFFAOYSA-N	283.133906664							83645
AC1O8JZS	LSM-4402	Trandolapril	6710733	InChI=1S/C24H34N2O5/c1-3-31-24(30)19(14-13-17-9-5-4-6-10-17)25-16(2)22(27)26-20-12-8-7-11-18(20)15-21(26)23(28)29/h4-6,9-10,16,18-21,25H,3,7-8,11-15H2,1-2H3,(H,28,29)/t16-,18?,19+,20?,21+/m1/s1	VXFJYXUZANRPDJ-UPUXWEDPSA-N	CCOC(=O)[C@H](CCc1ccccc1)N[C@H](C)C(=O)N2C3CCCCC3C[C@H]2C(=O)O	BroadT	BRD-A32505112	BRD-A32505112-001-02-8	MicroSource Discovery Systems Inc.	1505264			CCOC(=O)[C@H](CCc1ccccc1)N[C@H](C)C(=O)N1C2CCCCC2C[C@H]1C(O)=O	InChI=1S/C24H34N2O5/c1-3-31-24(30)19(14-13-17-9-5-4-6-10-17)25-16(2)22(27)26-20-12-8-7-11-18(20)15-21(26)23(28)29/h4-6,9-10,16,18-21,25H,3,7-8,11-15H2,1-2H3,(H,28,29)/t16-,18?,19+,20?,21+/m1/s1	VXFJYXUZANRPDJ-UPUXWEDPSA-N	430.246772208							93846
Efaroxan	LSM-4331	Efaroxan	72016	InChI=1S/C13H16N2O/c1-2-13(12-14-7-8-15-12)9-10-5-3-4-6-11(10)16-13/h3-6H,2,7-9H2,1H3,(H,14,15)	RATZLMXRALDSJW-UHFFFAOYSA-N	CCC1(Cc2ccccc2O1)C3=NCCN3	BroadT	BRD-A10739734	BRD-A10739734-003-01-5	MicroSource Discovery Systems Inc.	2300218		Cl	CCC1(Cc2ccccc2O1)C1=NCCN1.Cl	InChI=1S/C13H16N2O.ClH/c1-2-13(12-14-7-8-15-12)9-10-5-3-4-6-11(10)16-13;/h3-6H,2,7-9H2,1H3,(H,14,15);1H	DWOIUCRHVWIHAH-UHFFFAOYSA-N	216.126263152							93806, 93806
N-Formylmethionylphenylalanine	LSM-22629		4365	InChI=1S/C15H20N2O4S/c1-22-8-7-12(16-10-18)14(19)17-13(15(20)21)9-11-5-3-2-4-6-11/h2-6,10,12-13H,7-9H2,1H3,(H,16,18)(H,17,19)(H,20,21)	VZQJQFGSAAGNSI-UHFFFAOYSA-N	CSCCC(NC=O)C(=O)NC(Cc1ccccc1)C(=O)O	BroadT	BRD-A09975616	BRD-A09975616-001-02-3	MicroSource Discovery Systems Inc.	1502175			CSCCC(NC=O)C(=O)NC(Cc1ccccc1)C(O)=O	InChI=1S/C15H20N2O4S/c1-22-8-7-12(16-10-18)14(19)17-13(15(20)21)9-11-5-3-2-4-6-11/h2-6,10,12-13H,7-9H2,1H3,(H,16,18)(H,17,19)(H,20,21)	VZQJQFGSAAGNSI-UHFFFAOYSA-N	324.11437783							111175
Drofenine	LSM-4364	Drofenine	3166	InChI=1S/C20H31NO2/c1-3-21(4-2)15-16-23-20(22)19(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5,7-8,11-12,18-19H,3-4,6,9-10,13-16H2,1-2H3	AGJBLWCLQCKRJP-UHFFFAOYSA-N	CCN(CC)CCOC(=O)C(C1CCCCC1)c2ccccc2	BroadT	BRD-A22267103	BRD-A22267103-003-04-0	MicroSource Discovery Systems Inc.	1500999		Cl	CCN(CC)CCOC(=O)C(C1CCCCC1)c1ccccc1.Cl	InChI=1S/C20H31NO2.ClH/c1-3-21(4-2)15-16-23-20(22)19(17-11-7-5-8-12-17)18-13-9-6-10-14-18;/h5,7-8,11-12,18-19H,3-4,6,9-10,13-16H2,1-2H3;1H	WIELVDXKOYPANK-UHFFFAOYSA-N	317.235479242							93825, 93825
Chlorthalidone	LSM-1417	Hygroton, Thalitone, Chlorthalidone, Chlortalidone, Phthalamudine, G-33182	2732	InChI=1S/C14H11ClN2O4S/c15-11-6-5-8(7-12(11)22(16,20)21)14(19)10-4-2-1-3-9(10)13(18)17-14/h1-7,19H,(H,17,18)(H2,16,20,21)	JIVPVXMEBJLZRO-UHFFFAOYSA-N	NS(=O)(=O)c1cc(ccc1Cl)C2(O)NC(=O)c3ccccc23	BroadT	BRD-A26384407	BRD-A26384407-001-04-6	MicroSource Discovery Systems Inc.	1500187			NS(=O)(=O)c1cc(ccc1Cl)C1(O)NC(=O)c2ccccc12	InChI=1S/C14H11ClN2O4S/c15-11-6-5-8(7-12(11)22(16,20)21)14(19)10-4-2-1-3-9(10)13(18)17-14/h1-7,19H,(H,17,18)(H2,16,20,21)	JIVPVXMEBJLZRO-UHFFFAOYSA-N	338.012805252							3654
OMDM-2	LSM-1521	BRD-A39522003	3906781	InChI=1S/C27H45NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27(31)28-25(23-29)22-24-18-20-26(30)21-19-24/h9-10,18-21,25,29-30H,2-8,11-17,22-23H2,1H3,(H,28,31)	ICDMLAQPOAVWNH-UHFFFAOYSA-N	CCCCCCCCC=CCCCCCCCC(=O)NC(CO)Cc1ccc(O)cc1	BroadT	BRD-A39522003	BRD-A39522003-001-01-0	Tocris Bioscience	1797	1		CCCCCCCCC=CCCCCCCCC(=O)NC(CO)Cc1ccc(O)cc1	InChI=1S/C27H45NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27(31)28-25(23-29)22-24-18-20-26(30)21-19-24/h9-10,18-21,25,29-30H,2-8,11-17,22-23H2,1H3,(H,28,31)	ICDMLAQPOAVWNH-UHFFFAOYSA-N	431.33994431							91680
Benfluorex	LSM-4365	Benfluorex	2318	InChI=1S/C19H20F3NO2/c1-14(12-15-6-5-9-17(13-15)19(20,21)22)23-10-11-25-18(24)16-7-3-2-4-8-16/h2-9,13-14,23H,10-12H2,1H3	CJAVTWRYCDNHSM-UHFFFAOYSA-N	CC(Cc1cccc(c1)C(F)(F)F)NCCOC(=O)c2ccccc2	BroadT	BRD-A22305049	BRD-A22305049-003-04-5	MicroSource Discovery Systems Inc.	1500669		Cl	CC(Cc1cccc(c1)C(F)(F)F)NCCOC(=O)c1ccccc1.Cl	InChI=1S/C19H20F3NO2.ClH/c1-14(12-15-6-5-9-17(13-15)19(20,21)22)23-10-11-25-18(24)16-7-3-2-4-8-16;/h2-9,13-14,23H,10-12H2,1H3;1H	NLOALSPYZIIXEO-UHFFFAOYSA-N	351.14461349							93826, 93826
Methoprene acid	LSM-42820	SID26754897	5353760	InChI=1S/C16H28O3/c1-13(10-7-11-16(3,4)19-5)8-6-9-14(2)12-15(17)18/h6,9,12-13H,7-8,10-11H2,1-5H3,(H,17,18)/b9-6+,14-12+	MNYBEULOKRVZKY-TZOAMJEDSA-N	COC(C)(C)CCCC(C)C\C=C\C(=C\C(=O)O)\C	BroadT	BRD-A41145729	BRD-A41145729-001-02-7	Biomol International Inc.	GR106	2840(V2)-3-N1305		COC(C)(C)CCCC(C)C\C=C\C(C)=C\C(O)=O	InChI=1S/C16H28O3/c1-13(10-7-11-16(3,4)19-5)8-6-9-14(2)12-15(17)18/h6,9,12-13H,7-8,10-11H2,1-5H3,(H,17,18)/b9-6+,14-12+	MNYBEULOKRVZKY-TZOAMJEDSA-N	268.203844756							
Diperodon	LSM-4393	Diperodon	10831	InChI=1S/C22H27N3O4/c26-21(23-18-10-4-1-5-11-18)28-17-20(16-25-14-8-3-9-15-25)29-22(27)24-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2,(H,23,26)(H,24,27)	YUGZHQHSNYIFLG-UHFFFAOYSA-N	O=C(Nc1ccccc1)OCC(CN2CCCCC2)OC(=O)Nc3ccccc3	BroadT	BRD-A30693873	BRD-A30693873-003-03-7	Prestwick Chemical Inc.	Prestw-300	D0701-MP04-ST03-200-	Cl	O=C(Nc1ccccc1)OCC(CN1CCCCC1)OC(=O)Nc1ccccc1.Cl	InChI=1S/C22H27N3O4.ClH/c26-21(23-18-10-4-1-5-11-18)28-17-20(16-25-14-8-3-9-15-25)29-22(27)24-19-12-6-2-7-13-19;/h1-2,4-7,10-13,20H,3,8-9,14-17H2,(H,23,26)(H,24,27);1H	OWULVAZDMWJBLB-UHFFFAOYSA-N	397.200156374							93842, 93842
Praziquantel	LSM-1387	Praziquantel, Droncit, Cestocur, Cesol, Biltricide, Embay-8440	4891	InChI=1S/C19H24N2O2/c22-18-13-20(19(23)15-7-2-1-3-8-15)12-17-16-9-5-4-6-14(16)10-11-21(17)18/h4-6,9,15,17H,1-3,7-8,10-13H2	FSVJFNAIGNNGKK-UHFFFAOYSA-N	O=C(C1CCCCC1)N2CC3N(CCc4ccccc34)C(=O)C2	BroadT	BRD-A21858158	BRD-A21858158-001-04-5	MicroSource Discovery Systems Inc.	1500494			O=C(C1CCCCC1)N1CC2N(CCc3ccccc23)C(=O)C1	InChI=1S/C19H24N2O2/c22-18-13-20(19(23)15-7-2-1-3-8-15)12-17-16-9-5-4-6-14(16)10-11-21(17)18/h4-6,9,15,17H,1-3,7-8,10-13H2	FSVJFNAIGNNGKK-UHFFFAOYSA-N	312.183778028							91583
Labetalol	LSM-1282	Labetalol, Normodyne, Normozide, Trandate	3869	InChI=1S/C19H24N2O3/c1-13(7-8-14-5-3-2-4-6-14)21-12-18(23)15-9-10-17(22)16(11-15)19(20)24/h2-6,9-11,13,18,21-23H,7-8,12H2,1H3,(H2,20,24)	SGUAFYQXFOLMHL-UHFFFAOYSA-N	CC(CCc1ccccc1)NCC(O)c2ccc(O)c(c2)C(=O)N	BroadT	BRD-A07440155	BRD-A07440155-003-04-9	MicroSource Discovery Systems Inc.	1503243		Cl	CC(CCc1ccccc1)NCC(O)c1ccc(O)c(c1)C(N)=O.Cl	InChI=1S/C19H24N2O3.ClH/c1-13(7-8-14-5-3-2-4-6-14)21-12-18(23)15-9-10-17(22)16(11-15)19(20)24;/h2-6,9-11,13,18,21-23H,7-8,12H2,1H3,(H2,20,24);1H	WQVZLXWQESQGIF-UHFFFAOYSA-N	328.178692648							6343, 6343
Hexestrol	LSM-4300	SID26748324, SID56463535	3606	InChI=1S/C18H22O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,17-20H,3-4H2,1-2H3	PBBGSZCBWVPOOL-UHFFFAOYSA-N	CCC(C(CC)c1ccc(O)cc1)c2ccc(O)cc2	BroadT	BRD-A01078468	BRD-A01078468-001-04-9	MicroSource Discovery Systems Inc.	1500632			CCC(C(CC)c1ccc(O)cc1)c1ccc(O)cc1	InChI=1S/C18H22O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,17-20H,3-4H2,1-2H3	PBBGSZCBWVPOOL-UHFFFAOYSA-N	270.161979944							31669
DL-Anabasine	LSM-4371	1,2,3,4,5,6-Hexahydro-[2,3']Bipyridinyl, Anabasine	2181	InChI=1S/C10H14N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h3-4,6,8,10,12H,1-2,5,7H2	MTXSIJUGVMTTMU-UHFFFAOYSA-N	C1CCC(NC1)c2cccnc2	BroadT	BRD-A24284985	BRD-A24284985-001-02-4	Sigma-Aldrich	A5656			C1CCC(NC1)c1cccnc1	InChI=1S/C10H14N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h3-4,6,8,10,12H,1-2,5,7H2	MTXSIJUGVMTTMU-UHFFFAOYSA-N	162.115698468							28986
Flecainide	LSM-1297	Flecainide	3356	InChI=1S/C17H20F6N2O3/c18-16(19,20)9-27-12-4-5-14(28-10-17(21,22)23)13(7-12)15(26)25-8-11-3-1-2-6-24-11/h4-5,7,11,24H,1-3,6,8-10H2,(H,25,26)	DJBNUMBKLMJRSA-UHFFFAOYSA-N	FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)C(=O)NCC2CCCCN2	BroadT	BRD-A09472452	BRD-A09472452-001-02-8	Biomol International Inc.	AC-130	2840(V2)-3-N1305		FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)C(=O)NCC1CCCCN1	InChI=1S/C17H20F6N2O3/c18-16(19,20)9-27-12-4-5-14(28-10-17(21,22)23)13(7-12)15(26)25-8-11-3-1-2-6-24-11/h4-5,7,11,24H,1-3,6,8-10H2,(H,25,26)	DJBNUMBKLMJRSA-UHFFFAOYSA-N	414.13781172							75984, 75984
Suprofen	LSM-4406	Sutoprofen, Suprofen, Profenal, R-25061	5359	InChI=1S/C14H12O3S/c1-9(14(16)17)10-4-6-11(7-5-10)13(15)12-3-2-8-18-12/h2-9H,1H3,(H,16,17)	MDKGKXOCJGEUJW-UHFFFAOYSA-N	CC(C(=O)O)c1ccc(cc1)C(=O)c2cccs2	BroadT	BRD-A34006693	BRD-A34006693-001-04-8	Prestwick Chemical Inc.	Prestw-816	D0701-MP04-ST03-200-		CC(C(O)=O)c1ccc(cc1)C(=O)c1cccs1	InChI=1S/C14H12O3S/c1-9(14(16)17)10-4-6-11(7-5-10)13(15)12-3-2-8-18-12/h2-9H,1H3,(H,16,17)	MDKGKXOCJGEUJW-UHFFFAOYSA-N	260.050714934							9362
Met-Leu-Phe	LSM-1249		4105	InChI=1S/C20H31N3O4S/c1-13(2)11-16(22-18(24)15(21)9-10-28-3)19(25)23-17(20(26)27)12-14-7-5-4-6-8-14/h4-8,13,15-17H,9-12,21H2,1-3H3,(H,22,24)(H,23,25)(H,26,27)	CHDYFPCQVUOJEB-UHFFFAOYSA-N	CSCCC(N)C(=O)NC(CC(C)C)C(=O)NC(Cc1ccccc1)C(=O)O	BroadT	BRD-A02189320	BRD-A02189320-015-02-5	MicroSource Discovery Systems Inc.	1502177		CC(=O)O	CSCCC(N)C(=O)NC(CC(C)C)C(=O)NC(Cc1ccccc1)C(O)=O.CC(=O)O	InChI=1S/C20H31N3O4S.C2H4O2/c1-13(2)11-16(22-18(24)15(21)9-10-28-3)19(25)23-17(20(26)27)12-14-7-5-4-6-8-14;1-2(3)4/h4-8,13,15-17H,9-12,21H2,1-3H3,(H,22,24)(H,23,25)(H,26,27);1H3,(H,3,4)	VMKWINFBLIASSN-UHFFFAOYSA-N	409.203527192							91481, 91481
SB-203580	LSM-1168	SB-203580, SB203580	176155	InChI=1S/C21H16FN3OS/c1-27(26)18-8-4-16(5-9-18)21-24-19(14-2-6-17(22)7-3-14)20(25-21)15-10-12-23-13-11-15/h2-13H,1H3,(H,24,25)	CDMGBJANTYXAIV-UHFFFAOYSA-N	CS(=O)c1ccc(cc1)c2nc(c3ccc(F)cc3)c([nH]2)c4ccncc4	BroadT	BRD-A37704979	BRD-A37704979-001-02-4	Biomol International Inc.	EI-286	2840(V2)-3-N1305		CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccncc1)-c1ccc(F)cc1	InChI=1S/C21H16FN3OS/c1-27(26)18-8-4-16(5-9-18)21-24-19(14-2-6-17(22)7-3-14)20(25-21)15-10-12-23-13-11-15/h2-13H,1H3,(H,24,25)	CDMGBJANTYXAIV-UHFFFAOYSA-N	377.099811052							90705
Sulindac	LSM-43065		1548887	InChI=1S/C20H17FO3S/c1-12-17(9-13-3-6-15(7-4-13)25(2)24)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b17-9-	MLKXDPUZXIRXEP-MFOYZWKCSA-N	CC1=C(CC(=O)O)c2cc(F)ccc2/C/1=C\c3ccc(cc3)S(=O)C	BroadT	BRD-A13946108	BRD-A13946108-001-03-1	MicroSource Discovery Systems Inc.	1500556			CC1=C(CC(O)=O)c2cc(F)ccc2C\1=C/c1ccc(cc1)S(C)=O	InChI=1S/C20H17FO3S/c1-12-17(9-13-3-6-15(7-4-13)25(2)24)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b17-9-	MLKXDPUZXIRXEP-MFOYZWKCSA-N	356.088243294							9352
IN1304	LSM-1338	BRD-A15415227	4516886	InChI=1S/C30H29N3O4/c1-33(28-13-7-8-18-31-28)19-20-37-24-16-14-22(15-17-24)21-27(30(35)36)32-26-12-6-5-11-25(26)29(34)23-9-3-2-4-10-23/h2-18,27,32H,19-21H2,1H3,(H,35,36)	QTQMRBZOBKYXCG-UHFFFAOYSA-N	CN(CCOc1ccc(CC(Nc2ccccc2C(=O)c3ccccc3)C(=O)O)cc1)c4ccccn4	BroadT	BRD-A15415227	BRD-A15415227-003-01-1	Tocris Bioscience	1664	3	Cl	CN(CCOc1ccc(CC(Nc2ccccc2C(=O)c2ccccc2)C(O)=O)cc1)c1ccccn1.Cl	InChI=1S/C30H29N3O4.ClH/c1-33(28-13-7-8-18-31-28)19-20-37-24-16-14-22(15-17-24)21-27(30(35)36)32-26-12-6-5-11-25(26)29(34)23-9-3-2-4-10-23;/h2-18,27,32H,19-21H2,1H3,(H,35,36);1H	KXNKIKXTGRMLEY-UHFFFAOYSA-N	495.215806438							91548
KBIO2_006165	LSM-4411	BRD-A34842997	6708640	InChI=1S/C27H36O10/c1-12(28)34-17-11-18(35-13(2)29)25(6)14-8-9-24(5)19(21(31)32)36-22(33)20-27(24,37-20)26(14,7)16(30)10-15(25)23(17,3)4/h14-15,17-20H,8-11H2,1-7H3,(H,31,32)/t14?,15?,17-,18+,19+,20?,24+,25-,26+,27?/m1/s1	WROKSYFOSDWFHL-UQVLWQGYSA-N	CC(=O)O[C@@H]1C[C@H](OC(=O)C)[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C5OC45[C@]3(C)C(=O)CC2C1(C)C)C(=O)O	BroadT	BRD-A34842997	BRD-A34842997-001-02-3	MicroSource Discovery Systems Inc.	100447			CC(=O)O[C@@H]1C[C@H](OC(C)=O)[C@@]2(C)C(CC(=O)[C@]3(C)C2CC[C@@]2(C)[C@@H](OC(=O)C4OC324)C(O)=O)C1(C)C	InChI=1S/C27H36O10/c1-12(28)34-17-11-18(35-13(2)29)25(6)14-8-9-24(5)19(21(31)32)36-22(33)20-27(24,37-20)26(14,7)16(30)10-15(25)23(17,3)4/h14-15,17-20H,8-11H2,1-7H3,(H,31,32)/t14?,15?,17-,18+,19+,20?,24+,25-,26+,27?/m1/s1	WROKSYFOSDWFHL-UQVLWQGYSA-N	520.230847352							
Methoxamine	LSM-4423	Methoxamine, Vasoxyl	6082	InChI=1S/C11H17NO3/c1-7(12)11(13)9-6-8(14-2)4-5-10(9)15-3/h4-7,11,13H,12H2,1-3H3	WJAJPNHVVFWKKL-UHFFFAOYSA-N	COc1ccc(OC)c(c1)C(O)C(C)N	BroadT	BRD-A39189014	BRD-A39189014-003-04-5	MicroSource Discovery Systems Inc.	1500399		Cl	COc1ccc(OC)c(c1)C(O)C(C)N.Cl	InChI=1S/C11H17NO3.ClH/c1-7(12)11(13)9-6-8(14-2)4-5-10(9)15-3;/h4-7,11,13H,12H2,1-3H3;1H	YGRFXPCHZBRUKP-UHFFFAOYSA-N	211.120843414							6839, 6839
Proxyphylline	LSM-4382	Proxyphylline	4977	InChI=1S/C10H14N4O3/c1-6(15)4-14-5-11-8-7(14)9(16)13(3)10(17)12(8)2/h5-6,15H,4H2,1-3H3	KYHQZNGJUGFTGR-UHFFFAOYSA-N	CC(O)Cn1cnc2N(C)C(=O)N(C)C(=O)c12	BroadT	BRD-A28887267	BRD-A28887267-001-03-7	Prestwick Chemical Inc.	Prestw-890	D0701-MP04-ST03-200-		CC(O)Cn1cnc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C10H14N4O3/c1-6(15)4-14-5-11-8-7(14)9(16)13(3)10(17)12(8)2/h5-6,15H,4H2,1-3H3	KYHQZNGJUGFTGR-UHFFFAOYSA-N	238.106590348							93836
CHEMBL212197	LSM-1450	BRD-A31195449, SID50112927	16046239	InChI=1S/C11H14BrNO2/c1-14-9-4-8(12)11(15-2)7-3-6(5-13)10(7)9/h4,6H,3,5,13H2,1-2H3	MPBCKKVERDTCEL-UHFFFAOYSA-N	COc1cc(Br)c(OC)c2CC(CN)c12	BroadT	BRD-A31195449	BRD-A31195449-004-01-9	Tocris Bioscience	2592	1	Br	COc1cc(Br)c(OC)c2CC(CN)c12.Br	InChI=1S/C11H14BrNO2.BrH/c1-14-9-4-8(12)11(15-2)7-3-6(5-13)10(7)9;/h4,6H,3,5,13H2,1-2H3;1H	TYMMXVZAUGQKRF-UHFFFAOYSA-N	271.020791298							91625
Hemado	LSM-1233		4043357	InChI=1S/C17H23N5O4/c1-3-4-5-6-7-11-20-15(18-2)12-16(21-11)22(9-19-12)17-14(25)13(24)10(8-23)26-17/h9-10,13-14,17,23-25H,3-5,8H2,1-2H3,(H,18,20,21)	KOCIMZNSNPOGOP-UHFFFAOYSA-N	CCCCC#Cc1nc(NC)c2ncn(C3OC(CO)C(O)C3O)c2n1	BroadT	BRD-A00267231	BRD-A00267231-001-01-1	Tocris Bioscience	1579	1		CCCCC#Cc1nc(NC)c2ncn(C3OC(CO)C(O)C3O)c2n1	InChI=1S/C17H23N5O4/c1-3-4-5-6-7-11-20-15(18-2)12-16(21-11)22(9-19-12)17-14(25)13(24)10(8-23)26-17/h9-10,13-14,17,23-25H,3-5,8H2,1-2H3,(H,18,20,21)	KOCIMZNSNPOGOP-UHFFFAOYSA-N	361.175004266							91473
BRD-A38898897	LSM-42818		44483335	InChI=1S/C19H31N3O4S/c1-14(2)17-18-15(22(19(17)24)27(3,25)26)9-13-21(18)16(23)8-7-12-20-10-5-4-6-11-20/h7-8,14-15,17-18H,4-6,9-13H2,1-3H3/b8-7+/t15-,17?,18-/m1/s1	NDNKNUMSTIMSHQ-PTJVQUAFSA-N	CC(C)C1[C@H]2[C@@H](CCN2C(=O)\C=C\CN3CCCCC3)N(C1=O)S(=O)(=O)C	BroadT	BRD-A38898897	BRD-A38898897-003-01-0	Tocris Bioscience	1959	1	Cl	CC(C)C1[C@H]2[C@@H](CCN2C(=O)\C=C\CN2CCCCC2)N(C1=O)S(C)(=O)=O.Cl	InChI=1S/C19H31N3O4S.ClH/c1-14(2)17-18-15(22(19(17)24)27(3,25)26)9-13-21(18)16(23)8-7-12-20-10-5-4-6-11-20;/h7-8,14-15,17-18H,4-6,9-13H2,1-3H3;1H/b8-7+;/t15-,17?,18-;/m1./s1	UFCZUKYPBPXODT-ASKLLEKPSA-N	397.203527192							
Securinine	LSM-1411	SID56463085	6338099	InChI=1S/C13H15NO2/c15-12-7-9-4-5-10-8-13(9,16-12)11-3-1-2-6-14(10)11/h4-5,7,10-11H,1-3,6,8H2/t10-,11-,13?/m1/s1	SWZMSZQQJRKFBP-KKPNGEORSA-N	O=C1OC23C[C@@H](C=CC2=C1)N4CCCC[C@H]34	BroadT	BRD-A25775766	BRD-A25775766-001-03-3	Prestwick Chemical Inc.	Prestw-841	D0701-MP04-ST03-200-		O=C1OC23C[C@@H](C=CC2=C1)N1CCCC[C@H]31	InChI=1S/C13H15NO2/c15-12-7-9-4-5-10-8-13(9,16-12)11-3-1-2-6-14(10)11/h4-5,7,10-11H,1-3,6,8H2/t10-,11-,13?/m1/s1	SWZMSZQQJRKFBP-KKPNGEORSA-N	217.11027873							91602
Carteolol	LSM-1541	51781-06-7, Carteolol, Cartrol, Ocupress	2583	InChI=1S/C16H24N2O3/c1-16(2,3)17-9-11(19)10-21-14-6-4-5-13-12(14)7-8-15(20)18-13/h4-6,11,17,19H,7-10H2,1-3H3,(H,18,20)	LWAFSWPYPHEXKX-UHFFFAOYSA-N	CC(C)(C)NCC(O)COc1cccc2NC(=O)CCc12	BroadT	BRD-A42167015	BRD-A42167015-003-03-7	Prestwick Chemical Inc.	Prestw-446	D0701-MP04-ST03-200-	Cl	CC(C)(C)NCC(O)COc1cccc2NC(=O)CCc12.Cl	InChI=1S/C16H24N2O3.ClH/c1-16(2,3)17-9-11(19)10-21-14-6-4-5-13-12(14)7-8-15(20)18-13;/h4-6,11,17,19H,7-10H2,1-3H3,(H,18,20);1H	FYBXRCFPOTXTJF-UHFFFAOYSA-N	292.178692648							3437, 3437
Fluoxetine	LSM-1449	Fluoxetine, Prozac, Sarafem, Symbyax	3386	InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3	RTHCYVBBDHJXIQ-UHFFFAOYSA-N	CNCCC(Oc1ccc(cc1)C(F)(F)F)c2ccccc2	BroadT	BRD-A31159102	BRD-A31159102-001-01-9	Biomol International Inc.	AC-573	2813-N1283		CNCCC(Oc1ccc(cc1)C(F)(F)F)c1ccccc1	InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3	RTHCYVBBDHJXIQ-UHFFFAOYSA-N	309.134048806							86990, 86990
Racemic-Timolol	LSM-4397	BRD-A31916785	5478	InChI=1S/C13H24N4O3S/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17/h10,14,18H,4-9H2,1-3H3	BLJRIMJGRPQVNF-UHFFFAOYSA-N	CC(C)(C)NCC(O)COc1nsnc1N2CCOCC2	BroadT	BRD-A31916785	BRD-A31916785-103-01-0	Tocris Bioscience	649	2	OC(=O)C=CC(=O)O	CC(C)(C)NCC(O)COc1nsnc1N1CCOCC1.OC(=O)C=CC(=O)O	InChI=1S/C13H24N4O3S.C4H4O4/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17;5-3(6)1-2-4(7)8/h10,14,18H,4-9H2,1-3H3;1-2H,(H,5,6)(H,7,8)	WLRMANUAADYWEA-UHFFFAOYSA-N	316.156911358							39465, 39465
Gelsemine	LSM-1353	SID56463531	23817963	InChI=1S/C20H22N2O2/c1-3-19-10-22(2)16-11-9-24-15(8-13(11)19)20(17(16)19)12-6-4-5-7-14(12)21-18(20)23/h3-7,11,13,15-17H,1,8-10H2,2H3,(H,21,23)/t11-,13?,15?,16+,17+,19-,20-/m0/s1	NFYYATWFXNPTRM-CLIGSAHWSA-N	CN1C[C@@]2(C=C)C3CC4OC[C@@H]3[C@@H]1[C@H]2[C@@]45C(=O)Nc6ccccc56	BroadT	BRD-A17535965	BRD-A17535965-001-02-2	Prestwick Chemical Inc.	Prestw-662	D0701-MP04-ST03-200-		CN1C[C@@]2(C=C)C3CC4OC[C@@H]3[C@@H]1[C@H]2[C@@]41C(=O)Nc2ccccc12	InChI=1S/C20H22N2O2/c1-3-19-10-22(2)16-11-9-24-15(8-13(11)19)20(17(16)19)12-6-4-5-7-14(12)21-18(20)23/h3-7,11,13,15-17H,1,8-10H2,2H3,(H,21,23)/t11-,13?,15?,16+,17+,19-,20-/m0/s1	NFYYATWFXNPTRM-CLIGSAHWSA-N	322.168127964							91558
SPECTRUM_000690	LSM-22630	BRD-A20182314	6708586	InChI=1S/C30H40O7/c1-17(31)35-23-9-12-28(5)20-8-11-29(6)22(15-25(33)37-26(29)19-10-13-34-16-19)30(20,7)24(36-18(2)32)14-21(28)27(23,3)4/h10,13,15-16,20-21,23-24,26H,8-9,11-12,14H2,1-7H3/t20?,21?,23-,24+,26-,28+,29+,30+/m0/s1	HNFPPWVGLWDXQQ-UDYWQXAESA-N	CC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]3(C)[C@@H](CC2C1(C)C)OC(=O)C)c5cocc5	BroadT	BRD-A20182314	BRD-A20182314-001-02-6	MicroSource Discovery Systems Inc.	100201			CC(=O)O[C@H]1CC[C@@]2(C)C(C[C@@H](OC(C)=O)[C@]3(C)C2CC[C@@]2(C)[C@@H](OC(=O)C=C32)c2ccoc2)C1(C)C	InChI=1S/C30H40O7/c1-17(31)35-23-9-12-28(5)20-8-11-29(6)22(15-25(33)37-26(29)19-10-13-34-16-19)30(20,7)24(36-18(2)32)14-21(28)27(23,3)4/h10,13,15-16,20-21,23-24,26H,8-9,11-12,14H2,1-7H3/t20?,21?,23-,24+,26-,28+,29+,30+/m0/s1	HNFPPWVGLWDXQQ-UDYWQXAESA-N	512.27740362							
WB4101	LSM-15338	WB 4101, WB-4101	5685	InChI=1S/C19H23NO5/c1-21-17-8-5-9-18(22-2)19(17)23-11-10-20-12-14-13-24-15-6-3-4-7-16(15)25-14/h3-9,14,20H,10-13H2,1-2H3	GYSZUJHYXCZAKI-UHFFFAOYSA-N	COc1cccc(OC)c1OCCNCC2COc3ccccc3O2	BroadT	BRD-A01493904	BRD-A01493904-003-02-2	MicroSource Discovery Systems Inc.	1503647		Cl	COc1cccc(OC)c1OCCNCC1COc2ccccc2O1.Cl	InChI=1S/C19H23NO5.ClH/c1-21-17-8-5-9-18(22-2)19(17)23-11-10-20-12-14-13-24-15-6-3-4-7-16(15)25-14;/h3-9,14,20H,10-13H2,1-2H3;1H	KAHMEWANVDFFCQ-UHFFFAOYSA-N	345.157622846							64098, 64098
7-Hydroxy-2-n,n-dipropylaminotetralin	LSM-22631	SID90341315	1219	InChI=1S/C16H25NO/c1-3-9-17(10-4-2)15-7-5-13-6-8-16(18)12-14(13)11-15/h6,8,12,15,18H,3-5,7,9-11H2,1-2H3	BLYMJBIZMIGWFK-UHFFFAOYSA-N	CCCN(CCC)C1CCc2ccc(O)cc2C1	BroadT	BRD-A18795974	BRD-A18795974-001-01-2	Biomol International Inc.	D-105	2812-3-N1298		CCCN(CCC)C1CCc2ccc(O)cc2C1	InChI=1S/C16H25NO/c1-3-9-17(10-4-2)15-7-5-13-6-8-16(18)12-14(13)11-15/h6,8,12,15,18H,3-5,7,9-11H2,1-2H3	BLYMJBIZMIGWFK-UHFFFAOYSA-N	247.19361443							111176, 111176
CHEMBL198368	LSM-1382	BRD-A20968261, SID50112953	24868316	InChI=1S/C16H13BrF2N2O4/c17-10-5-11(18)12(19)6-14(10)25-9-3-1-8(2-4-9)21-15(22)7-13(20)16(23)24/h1-6,13H,7,20H2,(H,21,22)(H,23,24)	BNYDDAAZMBUFRG-UHFFFAOYSA-N	NC(CC(=O)Nc1ccc(Oc2cc(F)c(F)cc2Br)cc1)C(=O)O	BroadT	BRD-A20968261	BRD-A20968261-001-01-3	Tocris Bioscience	2652	1		NC(CC(=O)Nc1ccc(Oc2cc(F)c(F)cc2Br)cc1)C(O)=O	InChI=1S/C16H13BrF2N2O4/c17-10-5-11(18)12(19)6-14(10)25-9-3-1-8(2-4-9)21-15(22)7-13(20)16(23)24/h1-6,13H,7,20H2,(H,21,22)(H,23,24)	BNYDDAAZMBUFRG-UHFFFAOYSA-N	414.002675916							91578
SPECTRUM_000380	LSM-22632	Hydroxyprogesterone	6710628	InChI=1S/C21H30O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h12,16-18,24H,4-11H2,1-3H3/t16?,17?,18?,19-,20-,21-/m0/s1	DBPWSSGDRRHUNT-AYUYWISESA-N	CC(=O)[C@@]1(O)CCC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C	BroadT	BRD-A39791822	BRD-A39791822-001-02-8	AnalytiCon Discovery GmbH	NP-011014			CC(=O)[C@@]1(O)CCC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C	InChI=1S/C21H30O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h12,16-18,24H,4-11H2,1-3H3/t16?,17?,18?,19-,20-,21-/m0/s1	DBPWSSGDRRHUNT-AYUYWISESA-N	330.21949482							
NCGC00167840-01	LSM-1436	BRD-A29437505, SID50112981	4684627	InChI=1S/C13H17N5O6/c1-2-3-17-6-9(15-12(14)16-10(6)22)18(13(17)23)11-8(21)7(20)5(4-19)24-11/h2,5,7-8,11,19-21H,1,3-4H2,(H3,14,15,16,22)	VDCRFBBZFHHYGT-UHFFFAOYSA-N	NC1=NC2=C(N(CC=C)C(=O)N2C3OC(CO)C(O)C3O)C(=O)N1	BroadT	BRD-A29437505	BRD-A29437505-001-01-6	Tocris Bioscience	2719	1		Nc1nc2n(C3OC(CO)C(O)C3O)c(=O)n(CC=C)c2c(=O)[nH]1	InChI=1S/C13H17N5O6/c1-2-3-17-6-9(15-12(14)16-10(6)22)18(13(17)23)11-8(21)7(20)5(4-19)24-11/h2,5,7-8,11,19-21H,1,3-4H2,(H3,14,15,16,22)	VDCRFBBZFHHYGT-UHFFFAOYSA-N	339.117883314							91616
AC1O7ENS	LSM-4366	Clindamycin	6602476	InChI=1S/C18H33ClN2O5S/c1-5-6-10-7-11(21(3)8-10)17(25)20-12(9(2)19)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,22-24H,5-8H2,1-4H3,(H,20,25)/t9-,10+,11-,12+,13-,14+,15+,16?,18+/m0/s1	KDLRVYVGXIQJDK-SSDYFQDUSA-N	CCC[C@@H]1C[C@H](N(C)C1)C(=O)N[C@H]([C@H](C)Cl)C2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O	BroadT	BRD-A23034328	BRD-A23034328-003-03-4	Prestwick Chemical Inc.	Prestw-137	D0701-MP04-ST03-200-	Cl	CCC[C@@H]1C[C@H](N(C)C1)C(=O)N[C@H]([C@H](C)Cl)C1O[C@H](SC)[C@H](O)[C@@H](O)[C@H]1O.Cl	InChI=1S/C18H33ClN2O5S.ClH/c1-5-6-10-7-11(21(3)8-10)17(25)20-12(9(2)19)16-14(23)13(22)15(24)18(26-16)27-4;/h9-16,18,22-24H,5-8H2,1-4H3,(H,20,25);1H/t9-,10+,11-,12+,13-,14+,15+,16?,18+;/m0./s1	AUODDLQVRAJAJM-PTTDBYGSSA-N	424.179870576							93827, 93827
BRD-A07870296	LSM-4319		46783703	InChI=1S/C20H17NO6/c1-21-5-4-10-6-14-15(25-8-24-14)7-12(10)17(21)18-11-2-3-13-19(26-9-23-13)16(11)20(22)27-18/h2-3,6-7,17-18H,4-5,8-9H2,1H3/t17?,18-/m1/s1	IYGYMKDQCDOMRE-QRWMCTBCSA-N	CN1CCc2cc3OCOc3cc2C1[C@@H]4OC(=O)c5c6OCOc6ccc45	BroadT	BRD-A07870296	BRD-A07870296-001-03-3	Tocris Bioscience	130	20		CN1CCc2cc3OCOc3cc2C1[C@@H]1OC(=O)c2c1ccc1OCOc21	InChI=1S/C20H17NO6/c1-21-5-4-10-6-14-15(25-8-24-14)7-12(10)17(21)18-11-2-3-13-19(26-9-23-13)16(11)20(22)27-18/h2-3,6-7,17-18H,4-5,8-9H2,1H3/t17?,18-/m1/s1	IYGYMKDQCDOMRE-QRWMCTBCSA-N	367.105587274							93797
BIO2_000330	LSM-1278	Dibutyryl Cyclic GMP	6610337	InChI=1S/C18H24N5O9P/c1-3-5-10(24)20-18-21-15-12(16(26)22-18)19-8-23(15)17-14(31-11(25)6-4-2)13-9(30-17)7-29-33(27,28)32-13/h8-9,13-14,17H,3-7H2,1-2H3,(H,27,28)(H2,20,21,22,24,26)/t9-,13-,14-,17?/m0/s1	SWTMOFFYOXKQNN-UVQKOMKVSA-N	CCCC(=O)NC1=Nc2c(ncn2C3O[C@H]4COP(=O)(O)O[C@@H]4[C@@H]3OC(=O)CCC)C(=O)N1	BroadT	BRD-A06726973	BRD-A06726973-001-02-0	Biomol International Inc.	CN-215	2840(V2)-3-N1305		CCCC(=O)Nc1nc2n(cnc2c(=O)[nH]1)C1O[C@H]2COP(O)(=O)O[C@@H]2[C@@H]1OC(=O)CCC	InChI=1S/C18H24N5O9P/c1-3-5-10(24)20-18-21-15-12(16(26)22-18)19-8-23(15)17-14(31-11(25)6-4-2)13-9(30-17)7-29-33(27,28)32-13/h8-9,13-14,17H,3-7H2,1-2H3,(H,27,28)(H2,20,21,22,24,26)/t9-,13-,14-,17?/m0/s1	SWTMOFFYOXKQNN-UVQKOMKVSA-N	485.131163908							91503
BDBM32023	LSM-4410	Tetracycline	54091660	InChI=1S/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,13-15,25,31-32H,7H2,1-3H3,(H2,23,30)/t9-,10-,13?,14?,15-,21+,22-/m0/s1	MUHBBHLZPHKTTR-GWFFGYACSA-N	CN(C)[C@H]1[C@@H]2C[C@H]3C(C(=O)c4c(O)cccc4[C@@]3(C)O)C(=O)[C@]2(O)C(=O)C(C(=O)N)C1=O	BroadT	BRD-A34788695	BRD-A34788695-003-04-5	MicroSource Discovery Systems Inc.	1500566		Cl	CN(C)[C@H]1[C@@H]2C[C@H]3C(C(=O)c4c(O)cccc4[C@@]3(C)O)C(=O)[C@]2(O)C(=O)C(C(N)=O)C1=O.Cl	InChI=1S/C22H24N2O8.ClH/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28;/h4-6,9-10,13-15,25,31-32H,7H2,1-3H3,(H2,23,30);1H/t9-,10-,13?,14?,15-,21+,22-;/m0./s1	JCBQYRBTRRPKMO-PMMNLZCOSA-N	444.153265748							
SPECTRUM_001025	LSM-4308	Methscopolamine Bromide	5702084	InChI=1S/C18H24NO4/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11/h3-7,12-17,20H,8-10H2,1-2H3/q+1/t12?,13-,14?,15?,16?,17?/m0/s1	LZCOQTDXKCNBEE-RUTJIGONSA-N	C[N+]1(C)C2CC(CC1C3OC23)OC(=O)[C@@H](CO)c4ccccc4	BroadT	BRD-A03932035	BRD-A03932035-004-02-7	MicroSource Discovery Systems Inc.	1500401		Br	C[N+]1(C)C2CC(CC1C1OC21)OC(=O)[C@@H](CO)c1ccccc1.Br	InChI=1S/C18H24NO4.BrH/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11;/h3-7,12-17,20H,8-10H2,1-2H3;1H/q+1;/t12?,13-,14?,15?,16?,17?;/m0./s1	CXYRUNPLKGGUJF-DDCDRLIVSA-N	318.170533258							93791
Phensuximide	LSM-1359	Phensuximide, Milontin	6839	InChI=1S/C11H11NO2/c1-12-10(13)7-9(11(12)14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3	WLWFNJKHKGIJNW-UHFFFAOYSA-N	CN1C(=O)CC(C1=O)c2ccccc2	BroadT	BRD-A18043272	BRD-A18043272-001-03-2	Prestwick Chemical Inc.	Prestw-1061	D0701-MP04-ST03-200-		CN1C(=O)CC(C1=O)c1ccccc1	InChI=1S/C11H11NO2/c1-12-10(13)7-9(11(12)14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3	WLWFNJKHKGIJNW-UHFFFAOYSA-N	189.078978602							8079
Verapamil	LSM-1298	Verapamil, Tarka, Isoptin, Iproveratril, Verelan, Calan, D-365, CP-165331, CP-16533-1, Covera-HS	2520	InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3	SGTNSNPWRIOYBX-UHFFFAOYSA-N	COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC	BroadT	BRD-A09533288	BRD-A09533288-001-02-7	Biomol International Inc.	CA-215	2840(V2)-3-N1305		COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC	InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3	SGTNSNPWRIOYBX-UHFFFAOYSA-N	454.283157716							77733, 77733, 77733, 77733
SPECTRUM_001522	LSM-1487	Amcinonide	5702266	InChI=1S/C28H35FO7/c1-16(30)34-15-22(33)28-23(35-26(36-28)9-4-5-10-26)13-20-19-7-6-17-12-18(31)8-11-24(17,2)27(19,29)21(32)14-25(20,28)3/h8,11-12,19-21,23,32H,4-7,9-10,13-15H2,1-3H3/t19?,20?,21-,23+,24-,25-,27-,28+/m0/s1	ILKJAFIWWBXGDU-ZYDCGBIBSA-N	CC(=O)OCC(=O)[C@@]12OC3(CCCC3)O[C@@H]1CC4C5CCC6=CC(=O)C=C[C@]6(C)[C@@]5(F)[C@@H](O)C[C@]24C	BroadT	BRD-A36010170	BRD-A36010170-001-02-4	MicroSource Discovery Systems Inc.	1503816			CC(=O)OCC(=O)[C@@]12OC3(CCCC3)O[C@@H]1CC1C3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]21C	InChI=1S/C28H35FO7/c1-16(30)34-15-22(33)28-23(35-26(36-28)9-4-5-10-26)13-20-19-7-6-17-12-18(31)8-11-24(17,2)27(19,29)21(32)14-25(20,28)3/h8,11-12,19-21,23,32H,4-7,9-10,13-15H2,1-3H3/t19?,20?,21-,23+,24-,25-,27-,28+/m0/s1	ILKJAFIWWBXGDU-ZYDCGBIBSA-N	502.23668166							
PK-11195	LSM-1532	PK-11195, PK11195	1345	InChI=1S/C21H21ClN2O/c1-4-14(2)24(3)21(25)19-13-15-9-5-6-10-16(15)20(23-19)17-11-7-8-12-18(17)22/h5-14H,4H2,1-3H3	RAVIZVQZGXBOQO-UHFFFAOYSA-N	CCC(C)N(C)C(=O)c1cc2ccccc2c(n1)c3ccccc3Cl	BroadT	BRD-A41451487	BRD-A41451487-001-01-3	Biomol International Inc.	CM-118	2819-N1292		CCC(C)N(C)C(=O)c1cc2ccccc2c(n1)-c1ccccc1Cl	InChI=1S/C21H21ClN2O/c1-4-14(2)24(3)21(25)19-13-15-9-5-6-10-16(15)20(23-19)17-11-7-8-12-18(17)22/h5-14H,4H2,1-3H3	RAVIZVQZGXBOQO-UHFFFAOYSA-N	352.134241022							73290, 73290, 73290
Methyllycaconitine	LSM-1457	BRD-A32164164	494471	InChI=1S/C37H50N2O10/c1-7-38-17-34(18-49-32(42)20-10-8-9-11-23(20)39-26(40)14-19(2)31(39)41)13-12-25(46-4)36-22-15-21-24(45-3)16-35(43,27(22)28(21)47-5)37(44,33(36)38)30(48-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,43-44H,7,12-18H2,1-6H3	XLTANAWLDBYGFU-UHFFFAOYSA-N	CCN1CC2(COC(=O)c3ccccc3N4C(=O)CC(C)C4=O)CCC(OC)C56C7CC8C(CC(O)(C7C8OC)C(O)(C(OC)C25)C16)OC	BroadT	BRD-A32164164	BRD-A32164164-048-01-4	Tocris Bioscience	1029	13	OC(=O)CC(O)(CC(=O)O)C(=O)O	CCN1CC2(COC(=O)c3ccccc3N3C(=O)CC(C)C3=O)CCC(OC)C34C5CC6C(OC)C5C(O)(CC6OC)C(O)(C(OC)C23)C14.OC(=O)CC(O)(CC(=O)O)C(=O)O	InChI=1S/C37H50N2O10.C6H8O7/c1-7-38-17-34(18-49-32(42)20-10-8-9-11-23(20)39-26(40)14-19(2)31(39)41)13-12-25(46-4)36-22-15-21-24(45-3)16-35(43,27(22)28(21)47-5)37(44,33(36)38)30(48-6)29(34)36;7-3(8)1-6(13,5(11)12)2-4(9)10/h8-11,19,21-22,24-25,27-30,33,43-44H,7,12-18H2,1-6H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)	INBLZNJHDLEWPS-UHFFFAOYSA-N	682.34654582							91631
Metaproterenol	LSM-4318	Metaproterenol, Orciprenaline	4086	InChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-9(13)5-10(14)4-8/h3-5,7,11-15H,6H2,1-2H3	LMOINURANNBYCM-UHFFFAOYSA-N	CC(C)NCC(O)c1cc(O)cc(O)c1	BroadT	BRD-A07780951	BRD-A07780951-001-02-2	MicroSource Discovery Systems Inc.	1500390			CC(C)NCC(O)c1cc(O)cc(O)c1	InChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-9(13)5-10(14)4-8/h3-5,7,11-15H,6H2,1-2H3	LMOINURANNBYCM-UHFFFAOYSA-N	211.120843414							83329, 83329, 6792, 83329, 6792, 83329, 6792, 6792
L-152804	LSM-1543	BRD-A42553870, SID26660266	3765615	InChI=1S/C23H26O4/c1-22(2)9-14(24)20(15(25)10-22)19-13-7-5-6-8-17(13)27-18-12-23(3,4)11-16(26)21(18)19/h5-8,19-20H,9-12H2,1-4H3	XQDXIHYKAGHZRX-UHFFFAOYSA-N	CC1(C)CC(=O)C(C2C3=C(CC(C)(C)CC3=O)Oc4ccccc24)C(=O)C1	BroadT	BRD-A42553870	BRD-A42553870-001-05-1	Tocris Bioscience	1382	1		CC1(C)CC(=O)C(C2c3ccccc3OC3=C2C(=O)CC(C)(C)C3)C(=O)C1	InChI=1S/C23H26O4/c1-22(2)9-14(24)20(15(25)10-22)19-13-7-5-6-8-17(13)27-18-12-23(3,4)11-16(26)21(18)19/h5-8,19-20H,9-12H2,1-4H3	XQDXIHYKAGHZRX-UHFFFAOYSA-N	366.183109312							91696
Amylocaine	LSM-1292	Amylocaine	10767	InChI=1S/C14H21NO2/c1-5-14(2,11-15(3)4)17-13(16)12-9-7-6-8-10-12/h6-10H,5,11H2,1-4H3	FDMBBCOBEAVDAO-UHFFFAOYSA-N	CCC(C)(CN(C)C)OC(=O)c1ccccc1	BroadT	BRD-A09062839	BRD-A09062839-003-03-5	Prestwick Chemical Inc.	Prestw-49	D0701-MP04-ST03-200-	Cl	CCC(C)(CN(C)C)OC(=O)c1ccccc1.Cl	InChI=1S/C14H21NO2.ClH/c1-5-14(2,11-15(3)4)17-13(16)12-9-7-6-8-10-12;/h6-10H,5,11H2,1-4H3;1H	YCAXNWFCHTZUMD-UHFFFAOYSA-N	235.157228922							34981, 34981
Cephalotaxine	LSM-1290	SID26749997, SID419802	278679	InChI=1S/C18H21NO4/c1-21-15-9-18-4-2-5-19(18)6-3-11-7-13-14(23-10-22-13)8-12(11)16(18)17(15)20/h7-9,16-17,20H,2-6,10H2,1H3	YMNCVRSYJBNGLD-UHFFFAOYSA-N	COC1=CC23CCCN2CCc4cc5OCOc5cc4C3C1O	BroadT	BRD-A08877921	BRD-A08877921-001-02-2	MicroSource Discovery Systems Inc.	1500826			COC1=CC23CCCN2CCc2cc4OCOc4cc2C3C1O	InChI=1S/C18H21NO4/c1-21-15-9-18-4-2-5-19(18)6-3-11-7-13-14(23-10-22-13)8-12(11)16(18)17(15)20/h7-9,16-17,20H,2-6,10H2,1H3	YMNCVRSYJBNGLD-UHFFFAOYSA-N	315.147058162							91512
BDBM52947	LSM-4323	Doxycycline	54416523	InChI=1S/C22H24N2O8/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29/h4-7,10,12-15,17,25,27,32H,1-3H3,(H2,23,31)/t7-,10+,12?,13?,14+,15-,17-,22-/m0/s1	VXVNYCRICCVPTD-MULYGRJNSA-N	C[C@@H]1[C@H]2[C@H](O)[C@H]3[C@H](N(C)C)C(=O)C(C(=O)N)C(=O)[C@@]3(O)C(=O)C2C(=O)c4c(O)cccc14	BroadT	BRD-A08545410	BRD-A08545410-003-02-9	MicroSource Discovery Systems Inc.	1500266		Cl	C[C@@H]1[C@H]2[C@H](O)[C@H]3[C@H](N(C)C)C(=O)C(C(N)=O)C(=O)[C@@]3(O)C(=O)C2C(=O)c2c(O)cccc12.Cl	InChI=1S/C22H24N2O8.ClH/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29;/h4-7,10,12-15,17,25,27,32H,1-3H3,(H2,23,31);1H/t7-,10+,12?,13?,14+,15-,17-,22-;/m0./s1	HRNBFGVJLBNWJQ-IEVNQOTPSA-N	444.153265748							
CYTO7H11	LSM-4351	BAX Channel Blocker, BAX-Channel-Blocker	2729027	InChI=1S/C19H21Br2N3O/c20-13-1-3-18-16(9-13)17-10-14(21)2-4-19(17)24(18)12-15(25)11-23-7-5-22-6-8-23/h1-4,9-10,15,22,25H,5-8,11-12H2	KUUJEXLRLIPQQJ-UHFFFAOYSA-N	OC(CN1CCNCC1)Cn2c3ccc(Br)cc3c4cc(Br)ccc24	BroadT	BRD-A18763547	BRD-A18763547-019-01-0	EMD Biosciences	196805		OC(=O)C(F)(F)F	OC(CN1CCNCC1)Cn1c2ccc(Br)cc2c2cc(Br)ccc12.OC(=O)C(F)(F)F	InChI=1S/C19H21Br2N3O.C2HF3O2/c20-13-1-3-18-16(9-13)17-10-14(21)2-4-19(17)24(18)12-15(25)11-23-7-5-22-6-8-23;3-2(4,5)1(6)7/h1-4,9-10,15,22,25H,5-8,11-12H2;(H,6,7)	SOUIEEXSIPMAMO-UHFFFAOYSA-N	465.005137522							93818, 93818
Abrine (L)	LSM-4361	N-Methyltryptophan, SID26747785, L-Abrine	914	InChI=1S/C12H14N2O2/c1-13-11(12(15)16)6-8-7-14-10-5-3-2-4-9(8)10/h2-5,7,11,13-14H,6H2,1H3,(H,15,16)	CZCIKBSVHDNIDH-UHFFFAOYSA-N	CNC(Cc1c[nH]c2ccccc12)C(=O)O	BroadT	BRD-A21524347	BRD-A21524347-001-02-9	MicroSource Discovery Systems Inc.	1502236			CNC(Cc1c[nH]c2ccccc12)C(O)=O	InChI=1S/C12H14N2O2/c1-13-11(12(15)16)6-8-7-14-10-5-3-2-4-9(8)10/h2-5,7,11,13-14H,6H2,1H3,(H,15,16)	CZCIKBSVHDNIDH-UHFFFAOYSA-N	218.105527708							93824
Bacterenomycin	LSM-4379	Puromycin	2724365	InChI=1S/C22H29N7O5/c1-28(2)19-17-20(25-10-24-19)29(11-26-17)22-18(31)16(15(9-30)34-22)27-21(32)14(23)8-12-4-6-13(33-3)7-5-12/h4-7,10-11,14-16,18,22,30-31H,8-9,23H2,1-3H3,(H,27,32)/t14?,15-,16-,18-,22-/m1/s1	RXWNCPJZOCPEPQ-ZRKVXJNMSA-N	COc1ccc(CC(N)C(=O)N[C@@H]2[C@@H](CO)O[C@H]([C@@H]2O)n3cnc4c(ncnc34)N(C)C)cc1	BroadT	BRD-A26222320	BRD-A26222320-001-02-6	Biomol International Inc.	GR-312	2840(V2)-3-N1305		COc1ccc(CC(N)C(=O)N[C@@H]2[C@@H](CO)O[C@H]([C@@H]2O)n2cnc3c(ncnc23)N(C)C)cc1	InChI=1S/C22H29N7O5/c1-28(2)19-17-20(25-10-24-19)29(11-26-17)22-18(31)16(15(9-30)34-22)27-21(32)14(23)8-12-4-6-13(33-3)7-5-12/h4-7,10-11,14-16,18,22,30-31H,8-9,23H2,1-3H3,(H,27,32)/t14?,15-,16-,18-,22-/m1/s1	RXWNCPJZOCPEPQ-ZRKVXJNMSA-N	471.223017098							93834
Anabasamine	LSM-4409	SID50109929	161313	InChI=1S/C16H19N3/c1-19-10-3-2-6-16(19)14-7-8-15(18-12-14)13-5-4-9-17-11-13/h4-5,7-9,11-12,16H,2-3,6,10H2,1H3	TZRDBHMKTWECOV-UHFFFAOYSA-N	CN1CCCCC1c2ccc(nc2)c3cccnc3	BroadT	BRD-A34774643	BRD-A34774643-003-02-2	MicroSource Discovery Systems Inc.	1504156		Cl	CN1CCCCC1c1ccc(nc1)-c1cccnc1.Cl	InChI=1S/C16H19N3.ClH/c1-19-10-3-2-6-16(19)14-7-8-15(18-12-14)13-5-4-9-17-11-13;/h4-5,7-9,11-12,16H,2-3,6,10H2,1H3;1H	PFWHFUPRJSEODI-UHFFFAOYSA-N	253.157897638							93850, 93850
Vakerin	LSM-1334	Bergenin	2356	InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3	YWJXCIXBAKGUKZ-UHFFFAOYSA-N	COc1c(O)cc2C(=O)OC3C(O)C(O)C(CO)OC3c2c1O	BroadT	BRD-A15034104	BRD-A15034104-002-03-6	Prestwick Chemical Inc.	Prestw-811	D0701-MP04-ST03-200-	O	COc1c(O)cc2C(=O)OC3C(O)C(O)C(CO)OC3c2c1O.O	InChI=1S/C14H16O9.H2O/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12;/h2,6,8,10,12-13,15-19H,3H2,1H3;1H2	QCWSXSAFDSGKAT-UHFFFAOYSA-N	328.079432092							91545, 91545
Phenothrin	LSM-4363	Sumithrin, Phenothrin, S-2539F	4767	InChI=1S/C23H26O3/c1-16(2)13-20-21(23(20,3)4)22(24)25-15-17-9-8-12-19(14-17)26-18-10-6-5-7-11-18/h5-14,20-21H,15H2,1-4H3	SBNFWQZLDJGRLK-UHFFFAOYSA-N	CC(=CC1C(C(=O)OCc2cccc(Oc3ccccc3)c2)C1(C)C)C	BroadT	BRD-A22106989	BRD-A22106989-001-01-9	MicroSource Discovery Systems Inc.	1504098			CC(C)=CC1C(C(=O)OCc2cccc(Oc3ccccc3)c2)C1(C)C	InChI=1S/C23H26O3/c1-16(2)13-20-21(23(20,3)4)22(24)25-15-17-9-8-12-19(14-17)26-18-10-6-5-7-11-18/h5-14,20-21H,15H2,1-4H3	SBNFWQZLDJGRLK-UHFFFAOYSA-N	350.188194692							34916
Laudanosine	LSM-1406	Laudanosine	15548	InChI=1S/C21H27NO4/c1-22-9-8-15-12-20(25-4)21(26-5)13-16(15)17(22)10-14-6-7-18(23-2)19(11-14)24-3/h6-7,11-13,17H,8-10H2,1-5H3	KGPAYJZAMGEDIQ-UHFFFAOYSA-N	COc1ccc(CC2N(C)CCc3cc(OC)c(OC)cc23)cc1OC	BroadT	BRD-A24817035	BRD-A24817035-001-04-7	MicroSource Discovery Systems Inc.	100575			COc1ccc(CC2N(C)CCc3cc(OC)c(OC)cc23)cc1OC	InChI=1S/C21H27NO4/c1-22-9-8-15-12-20(25-4)21(26-5)13-16(15)17(22)10-14-6-7-18(23-2)19(11-14)24-3/h6-7,11-13,17H,8-10H2,1-5H3	KGPAYJZAMGEDIQ-UHFFFAOYSA-N	357.194008354							91599
Chlorphenesin Carbamate	LSM-1516	Chlorphenesin, Maolate, U-19646, Chlorphensin Carbamate, Chlorphenesin Carbamate	2724	InChI=1S/C10H12ClNO4/c11-7-1-3-9(4-2-7)15-5-8(13)6-16-10(12)14/h1-4,8,13H,5-6H2,(H2,12,14)	SKPLBLUECSEIFO-UHFFFAOYSA-N	NC(=O)OCC(O)COc1ccc(Cl)cc1	BroadT	BRD-A39230911	BRD-A39230911-001-03-7	Prestwick Chemical Inc.	Prestw-234	D0701-MP04-ST03-200-		NC(=O)OCC(O)COc1ccc(Cl)cc1	InChI=1S/C10H12ClNO4/c11-7-1-3-9(4-2-7)15-5-8(13)6-16-10(12)14/h1-4,8,13H,5-6H2,(H2,12,14)	SKPLBLUECSEIFO-UHFFFAOYSA-N	245.045485584							3643
Nomifensine	LSM-4388	Nomifensine	4528	InChI=1S/C16H18N2/c1-18-10-14(12-6-3-2-4-7-12)13-8-5-9-16(17)15(13)11-18/h2-9,14H,10-11,17H2,1H3	XXPANQJNYNUNES-UHFFFAOYSA-N	CN1CC(c2ccccc2)c3cccc(N)c3C1	BroadT	BRD-A29644307	BRD-A29644307-050-04-8	MicroSource Discovery Systems Inc.	1503267		OC(=O)/C=C\C(=O)O	CN1CC(c2ccccc2)c2cccc(N)c2C1.OC(=O)/C=C\C(=O)O	InChI=1S/C16H18N2.C4H4O4/c1-18-10-14(12-6-3-2-4-7-12)13-8-5-9-16(17)15(13)11-18;5-3(6)1-2-4(7)8/h2-9,14H,10-11,17H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-	GEOCVSMCLVIOEV-BTJKTKAUSA-N	238.146998596							116225, 116225
HSCI1_000161	LSM-22633	BRD-A30547447	23806679	InChI=1S/C10H13N5O3S/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(19)6(17)4(1-16)18-10/h2-4,6-7,10,16-17,19H,1H2,(H2,11,12,13)/t4?,6-,7-,10?/m0/s1	VLRCFULRQZKFRM-JYQXIPBXSA-N	Nc1ncnc2c1ncn2C3OC(CO)[C@H](O)[C@@H]3S	BroadT	BRD-A30547447	BRD-A30547447-001-01-0	Calbiochem	589400			Nc1ncnc2n(cnc12)C1OC(CO)[C@H](O)[C@@H]1S	InChI=1S/C10H13N5O3S/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(19)6(17)4(1-16)18-10/h2-4,6-7,10,16-17,19H,1H2,(H2,11,12,13)/t4?,6-,7-,10?/m0/s1	VLRCFULRQZKFRM-JYQXIPBXSA-N	283.073910016							111177
Homosalate	LSM-1475	Heliophan, Homosalate, Homomenthyl Salicylate	8362	InChI=1S/C16H22O3/c1-11-8-12(10-16(2,3)9-11)19-15(18)13-6-4-5-7-14(13)17/h4-7,11-12,17H,8-10H2,1-3H3	WSSJONWNBBTCMG-UHFFFAOYSA-N	CC1CC(CC(C)(C)C1)OC(=O)c2ccccc2O	BroadT	BRD-A34751532	BRD-A34751532-001-03-6	Prestwick Chemical Inc.	Prestw-1090	D0701-MP04-ST03-200-		CC1CC(CC(C)(C)C1)OC(=O)c1ccccc1O	InChI=1S/C16H22O3/c1-11-8-12(10-16(2,3)9-11)19-15(18)13-6-4-5-7-14(13)17/h4-7,11-12,17H,8-10H2,1-3H3	WSSJONWNBBTCMG-UHFFFAOYSA-N	262.156894564							91642
Karakoline	LSM-1556	SID56463532	23986045	InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18?,19?,20+,21+,22-/m1/s1	HKQZUYOVMYOFIT-VEUUHKJVSA-N	CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6C(O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)C14	BroadT	BRD-A43849199	BRD-A43849199-001-02-3	Prestwick Chemical Inc.	Prestw-687	D0701-MP04-ST03-200-		CCN1C[C@]2(C)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6C(O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)C14	InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18?,19?,20+,21+,22-/m1/s1	HKQZUYOVMYOFIT-VEUUHKJVSA-N	377.25660861							
THR1 Inhibitor, 2	LSM-1445	LFM-A13	9906875	InChI=1S/C11H8Br2N2O2/c1-6(16)8(5-14)11(17)15-10-4-7(12)2-3-9(10)13/h2-4,8H,1H3,(H,15,17)	BQLDGDMKDYAGNE-UHFFFAOYSA-N	CC(=O)C(C#N)C(=O)Nc1cc(Br)ccc1Br	BroadT	BRD-A30655177	BRD-A30655177-001-04-1	Biomol International Inc.	EI-295	2840(V2)-3-N1305		CC(=O)C(C#N)C(=O)Nc1cc(Br)ccc1Br	InChI=1S/C11H8Br2N2O2/c1-6(16)8(5-14)11(17)15-10-4-7(12)2-3-9(10)13/h2-4,8H,1H3,(H,15,17)	BQLDGDMKDYAGNE-UHFFFAOYSA-N	357.895252716							91623
Oleanoic acid	LSM-4398		485707	InChI=1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20?,21?,22?,23-,27+,28-,29-,30+/m1/s1	MIJYXULNPSFWEK-LGSDIRQTSA-N	CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O)C(C)(C)C5CC[C@@]34C)C2C1)C(=O)O	BroadT	BRD-A31962514	BRD-A31962514-001-02-6	MicroSource Discovery Systems Inc.	100550			CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O)C(C)(C)C5CC[C@@]34C)C2C1)C(O)=O	InChI=1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20?,21?,22?,23-,27+,28-,29-,30+/m1/s1	MIJYXULNPSFWEK-LGSDIRQTSA-N	456.360345396							
Azadirachtin	LSM-43062		5702264	InChI=1S/C35H44O16/c1-8-15(2)24(38)49-18-12-19(48-16(3)36)32(26(39)43-6)13-46-21-22(32)31(18)14-47-34(42,27(40)44-7)25(31)29(4,23(21)37)35-20-11-17(30(35,5)51-35)33(41)9-10-45-28(33)50-20/h8-10,17-23,25,28,37,41-42H,11-14H2,1-7H3/b15-8+/t17-,18+,19-,20+,21-,22?,23-,25+,28?,29-,30+,31+,32+,33+,34+,35?/m1/s1	FTNJWQUOZFUQQJ-APTPXFPHSA-N	COC(=O)[C@@]1(O)OC[C@@]23[C@H](C[C@@H](OC(=O)C)[C@]4(CO[C@@H]([C@@H](O)[C@](C)([C@H]12)C56O[C@@]5(C)[C@H]7C[C@@H]6OC8OC=C[C@]78O)C34)C(=O)OC)OC(=O)\C(=C\C)\C	BroadT	BRD-A03898562	BRD-A03898562-001-02-7	MicroSource Discovery Systems Inc.	1503802			COC(=O)[C@@]1(O)OC[C@@]23C4[C@@H](OC[C@@]4([C@@H](C[C@@H]2OC(=O)C(\C)=C\C)OC(C)=O)C(=O)OC)[C@@H](O)[C@](C)([C@H]13)C12O[C@@]1(C)[C@H]1C[C@@H]2OC2OC=C[C@]12O	InChI=1S/C35H44O16/c1-8-15(2)24(38)49-18-12-19(48-16(3)36)32(26(39)43-6)13-46-21-22(32)31(18)14-47-34(42,27(40)44-7)25(31)29(4,23(21)37)35-20-11-17(30(35,5)51-35)33(41)9-10-45-28(33)50-20/h8-10,17-23,25,28,37,41-42H,11-14H2,1-7H3/b15-8+/t17-,18+,19-,20+,21-,22?,23-,25+,28?,29-,30+,31+,32+,33+,34+,35?/m1/s1	FTNJWQUOZFUQQJ-APTPXFPHSA-N	720.262935328							
BSPBIO_001530	LSM-1549	BRD-A42831637	6610319	InChI=1S/C21H28O4/c1-4-5-6-7-13-10-17(22)19-15-12-14(20(23)24)8-9-16(15)21(2,3)25-18(19)11-13/h10-12,15-16,22H,4-9H2,1-3H3,(H,23,24)/t15?,16-/m1/s1	YOVRGSHRZRJTLZ-OEMAIJDKSA-N	CCCCCc1cc(O)c2C3C=C(CC[C@H]3C(C)(C)Oc2c1)C(=O)O	BroadT	BRD-A42831637	BRD-A42831637-001-02-2	Biomol International Inc.	L-126	2840(V2)-3-N1305		CCCCCc1cc(O)c2C3C=C(CC[C@H]3C(C)(C)Oc2c1)C(O)=O	InChI=1S/C21H28O4/c1-4-5-6-7-13-10-17(22)19-15-12-14(20(23)24)8-9-16(15)21(2,3)25-18(19)11-13/h10-12,15-16,22H,4-9H2,1-3H3,(H,23,24)/t15?,16-/m1/s1	YOVRGSHRZRJTLZ-OEMAIJDKSA-N	344.198759376							91699
Cytisine	LSM-22634		22407	InChI=1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2	ANJTVLIZGCUXLD-UHFFFAOYSA-N	O=C1C=CC=C2C3CNCC(C3)CN12	BroadT	BRD-A38359809	BRD-A38359809-001-01-4	AnalytiCon Discovery GmbH	NP-009868			O=c1cccc2C3CNCC(C3)Cn12	InChI=1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2	ANJTVLIZGCUXLD-UHFFFAOYSA-N	190.110613088							111178
6-Methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol	LSM-4413	Apomorphine, SID50123632, SID90341294	2215	InChI=1S/C17H17NO2/c1-18-8-7-10-3-2-4-12-15(10)13(18)9-11-5-6-14(19)17(20)16(11)12/h2-6,13,19-20H,7-9H2,1H3	VMWNQDUVQKEIOC-UHFFFAOYSA-N	CN1CCc2cccc3c2C1Cc4ccc(O)c(O)c34	BroadT	BRD-A35931254	BRD-A35931254-003-02-7	MicroSource Discovery Systems Inc.	1500129		Cl	CN1CCc2cccc-3c2C1Cc1ccc(O)c(O)c-31.Cl	InChI=1S/C17H17NO2.ClH/c1-18-8-7-10-3-2-4-12-15(10)13(18)9-11-5-6-14(19)17(20)16(11)12;/h2-6,13,19-20H,7-9H2,1H3;1H	SKYZYDSNJIOXRL-UHFFFAOYSA-N	267.125928794							93852, 93852
Alexidine	LSM-4432	Alexidine, Compound 904, WIN-21904	2090	InChI=1S/C26H56N10/c1-5-9-15-21(7-3)19-33-25(29)35-23(27)31-17-13-11-12-14-18-32-24(28)36-26(30)34-20-22(8-4)16-10-6-2/h21-22H,5-20H2,1-4H3,(H5,27,29,31,33,35)(H5,28,30,32,34,36)	LFVVNPBBFUSSHL-UHFFFAOYSA-N	CCCCC(CC)CNC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NCC(CC)CCCC	BroadT	BRD-A42335949	BRD-A42335949-300-04-9	MicroSource Discovery Systems Inc.	1503074		Cl.Cl	CCCCC(CC)CNC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NCC(CC)CCCC.Cl.Cl	InChI=1S/C26H56N10.2ClH/c1-5-9-15-21(7-3)19-33-25(29)35-23(27)31-17-13-11-12-14-18-32-24(28)36-26(30)34-20-22(8-4)16-10-6-2;;/h21-22H,5-20H2,1-4H3,(H5,27,29,31,33,35)(H5,28,30,32,34,36);2*1H	BRJJFBHTDVWTCJ-UHFFFAOYSA-N	508.468941892							53661, 53661, 53661
C21H29NO	LSM-1495	Biperiden	5311030	InChI=1S/C21H29NO/c23-21(19-7-3-1-4-8-19,11-14-22-12-5-2-6-13-22)20-16-17-9-10-18(20)15-17/h1,3-4,7-10,17-18,20,23H,2,5-6,11-16H2/t17-,18+,20?,21?/m1/s1	YSXKPIUOCJLQIE-BDWAOYLISA-N	OC(CCN1CCCCC1)(C2C[C@H]3C[C@@H]2C=C3)c4ccccc4	BroadT	BRD-A36471396	BRD-A36471396-003-02-2	Prestwick Chemical Inc.	Prestw-502	D0701-MP04-ST03-200-	Cl	OC(CCN1CCCCC1)(C1C[C@H]2C[C@@H]1C=C2)c1ccccc1.Cl	InChI=1S/C21H29NO.ClH/c23-21(19-7-3-1-4-8-19,11-14-22-12-5-2-6-13-22)20-16-17-9-10-18(20)15-17;/h1,3-4,7-10,17-18,20,23H,2,5-6,11-16H2;1H/t17-,18+,20?,21?;/m1./s1	RDNLAULGBSQZMP-XYEFSAFDSA-N	311.224914558							91659, 91659
Dihydromunduletone	LSM-4348	SID26749529	3492326	InChI=1S/C25H28O6/c1-24(2)9-8-16-20(30-24)7-6-14(23(16)29-5)11-18(26)17-10-15-12-22(28)25(3,4)31-21(15)13-19(17)27/h6-10,13,22,27-28H,11-12H2,1-5H3	RMVZECFNOTWEKD-UHFFFAOYSA-N	COc1c(CC(=O)c2cc3CC(O)C(C)(C)Oc3cc2O)ccc4OC(C)(C)C=Cc14	BroadT	BRD-A17831693	BRD-A17831693-001-02-4	MicroSource Discovery Systems Inc.	210203			COc1c(CC(=O)c2cc3CC(O)C(C)(C)Oc3cc2O)ccc2OC(C)(C)C=Cc12	InChI=1S/C25H28O6/c1-24(2)9-8-16-20(30-24)7-6-14(23(16)29-5)11-18(26)17-10-15-12-22(28)25(3,4)31-21(15)13-19(17)27/h6-10,13,22,27-28H,11-12H2,1-5H3	RMVZECFNOTWEKD-UHFFFAOYSA-N	424.188588616							93816
Carbinoxamine	LSM-1435	Palgic, Clistin, Carbinoxamine	2564	InChI=1S/C16H19ClN2O/c1-19(2)11-12-20-16(15-5-3-4-10-18-15)13-6-8-14(17)9-7-13/h3-10,16H,11-12H2,1-2H3	OJFSXZCBGQGRNV-UHFFFAOYSA-N	CN(C)CCOC(c1ccc(Cl)cc1)c2ccccn2	BroadT	BRD-A29426959	BRD-A29426959-050-04-1	MicroSource Discovery Systems Inc.	1500161		OC(=O)/C=C\C(=O)O	CN(C)CCOC(c1ccc(Cl)cc1)c1ccccn1.OC(=O)/C=C\C(=O)O	InChI=1S/C16H19ClN2O.C4H4O4/c1-19(2)11-12-20-16(15-5-3-4-10-18-15)13-6-8-14(17)9-7-13;5-3(6)1-2-4(7)8/h3-10,16H,11-12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-	GVNWHCVWDRNXAZ-BTJKTKAUSA-N	290.118590958							3398, 3398, 3398
Cilnidipine	LSM-1284	BRD-A07875874	2752	InChI=1S/C27H28N2O7/c1-18-23(26(30)35-14-8-11-20-9-5-4-6-10-20)25(21-12-7-13-22(17-21)29(32)33)24(19(2)28-18)27(31)36-16-15-34-3/h4-13,17,25,28H,14-16H2,1-3H3	KJEBULYHNRNJTE-UHFFFAOYSA-N	COCCOC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCC=Cc3ccccc3)C	BroadT	BRD-A07875874	BRD-A07875874-001-01-6	Tocris Bioscience	2629	1		COCCOC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OCC=Cc1ccccc1	InChI=1S/C27H28N2O7/c1-18-23(26(30)35-14-8-11-20-9-5-4-6-10-20)25(21-12-7-13-22(17-21)29(32)33)24(19(2)28-18)27(31)36-16-15-34-3/h4-13,17,25,28H,14-16H2,1-3H3	KJEBULYHNRNJTE-UHFFFAOYSA-N	492.189651256							91506
(3-Hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) acetate	LSM-1398	Estradiol, SID26748543, SID93576670, BRD-A23226398	628698	InChI=1S/C20H26O3/c1-12(21)23-19-8-7-18-17-5-3-13-11-14(22)4-6-15(13)16(17)9-10-20(18,19)2/h4,6,11,16-19,22H,3,5,7-10H2,1-2H3	QAHOQNJVHDHYRN-UHFFFAOYSA-N	CC(=O)OC1CCC2C3CCc4cc(O)ccc4C3CCC12C	BroadT	BRD-A23226398	BRD-A23226398-001-02-7	MicroSource Discovery Systems Inc.	1501184			CC(=O)OC1CCC2C3CCc4cc(O)ccc4C3CCC12C	InChI=1S/C20H26O3/c1-12(21)23-19-8-7-18-17-5-3-13-11-14(22)4-6-15(13)16(17)9-10-20(18,19)2/h4,6,11,16-19,22H,3,5,7-10H2,1-2H3	QAHOQNJVHDHYRN-UHFFFAOYSA-N	314.188194692							91592
Azasetron	LSM-1565	Azasetron, Y-25130, Azasetron HCl	2264	InChI=1S/C17H20ClN3O3/c1-20-14-7-11(18)6-12(16(14)24-9-15(20)22)17(23)19-13-8-21-4-2-10(13)3-5-21/h6-7,10,13H,2-5,8-9H2,1H3,(H,19,23)	WUKZPHOXUVCQOR-UHFFFAOYSA-N	CN1C(=O)COc2c1cc(Cl)cc2C(=O)NC3CN4CCC3CC4	BroadT	BRD-A44133049	BRD-A44133049-001-01-5	Biomol International Inc.	NS-901	2813-N1283		CN1C(=O)COc2c1cc(Cl)cc2C(=O)NC1CN2CCC1CC2	InChI=1S/C17H20ClN3O3/c1-20-14-7-11(18)6-12(16(14)24-9-15(20)22)17(23)19-13-8-21-4-2-10(13)3-5-21/h6-7,10,13H,2-5,8-9H2,1H3,(H,19,23)	WUKZPHOXUVCQOR-UHFFFAOYSA-N	349.11931924							91712
Penicillic acid	LSM-1552	ST50405293, Pencillic Acid, Penicillic Acid, Penicillic-Acid	4728	InChI=1S/C8H10O4/c1-5(2)8(10)6(11-3)4-7(9)12-8/h4,10H,1H2,2-3H3	YCOFRPYSZKIPBQ-UHFFFAOYSA-N	COC1=CC(=O)OC1(O)C(=C)C	BroadT	BRD-A43150328	BRD-A43150328-001-02-0	AnalytiCon Discovery GmbH	NP-001422			COC1=CC(=O)OC1(O)C(C)=C	InChI=1S/C8H10O4/c1-5(2)8(10)6(11-3)4-7(9)12-8/h4,10H,1H2,2-3H3	YCOFRPYSZKIPBQ-UHFFFAOYSA-N	170.0579088							91702
83002-04-4	LSM-1260	BRD-A03816571	4412255	InChI=1S/C24H40O3/c1-4-5-6-7-14-24(2,3)19-11-13-21(23(27)16-19)22-17-20(26)12-10-18(22)9-8-15-25/h11,13,16,18,20,22,25-27H,4-10,12,14-15,17H2,1-3H3	YNZFFALZMRAPHQ-UHFFFAOYSA-N	CCCCCCC(C)(C)c1ccc(C2CC(O)CCC2CCCO)c(O)c1	BroadT	BRD-A03816571	BRD-A03816571-001-01-0	Tocris Bioscience	949	14		CCCCCCC(C)(C)c1ccc(C2CC(O)CCC2CCCO)c(O)c1	InChI=1S/C24H40O3/c1-4-5-6-7-14-24(2,3)19-11-13-21(23(27)16-19)22-17-20(26)12-10-18(22)9-8-15-25/h11,13,16,18,20,22,25-27H,4-10,12,14-15,17H2,1-3H3	YNZFFALZMRAPHQ-UHFFFAOYSA-N	376.29774514							91490
MDL 72832	LSM-1352	SID26751706, MDL-72832	182585	InChI=1S/C22H30N2O4/c25-20-13-22(9-3-4-10-22)14-21(26)24(20)12-6-5-11-23-15-17-16-27-18-7-1-2-8-19(18)28-17/h1-2,7-8,17,23H,3-6,9-16H2	HCVRCHQFYYZPHT-UHFFFAOYSA-N	O=C1CC2(CCCC2)CC(=O)N1CCCCNCC3COc4ccccc4O3	BroadT	BRD-A17453586	BRD-A17453586-001-01-9	Biomol International Inc.	AC-543	2813-N1283		O=C1CC2(CCCC2)CC(=O)N1CCCCNCC1COc2ccccc2O1	InChI=1S/C22H30N2O4/c25-20-13-22(9-3-4-10-22)14-21(26)24(20)12-6-5-11-23-15-17-16-27-18-7-1-2-8-19(18)28-17/h1-2,7-8,17,23H,3-6,9-16H2	HCVRCHQFYYZPHT-UHFFFAOYSA-N	386.22055746							91557
Diarylpropionitrile	LSM-1423	2,3-Bis(4-Hydroxyphenyl)Propanenitrile, Diarylpropionitrile, BRD-A27143604	102614	InChI=1S/C15H13NO2/c16-10-13(12-3-7-15(18)8-4-12)9-11-1-5-14(17)6-2-11/h1-8,13,17-18H,9H2	GHZHWDWADLAOIQ-UHFFFAOYSA-N	Oc1ccc(CC(C#N)c2ccc(O)cc2)cc1	BroadT	BRD-A27143604	BRD-A27143604-001-01-2	Tocris Bioscience	1494	3		Oc1ccc(CC(C#N)c2ccc(O)cc2)cc1	InChI=1S/C15H13NO2/c16-10-13(12-3-7-15(18)8-4-12)9-11-1-5-14(17)6-2-11/h1-8,13,17-18H,9H2	GHZHWDWADLAOIQ-UHFFFAOYSA-N	239.094628666							63949
Oleanolic Acid Acetate	LSM-1527		6708573	InChI=1S/C32H50O4/c1-20(33)36-25-12-13-29(6)23(28(25,4)5)11-14-31(8)24(29)10-9-21-22-19-27(2,3)15-17-32(22,26(34)35)18-16-30(21,31)7/h9,22-25H,10-19H2,1-8H3,(H,34,35)/t22?,23?,24?,25-,29+,30-,31-,32+/m1/s1	RIXNFYQZWDGQAE-JMGFFJFSSA-N	CC(=O)O[C@@H]1CC[C@@]2(C)C(CC[C@]3(C)C2CC=C4C5CC(C)(C)CC[C@@]5(CC[C@@]34C)C(=O)O)C1(C)C	BroadT	BRD-A41112154	BRD-A41112154-001-02-1	MicroSource Discovery Systems Inc.	102058			CC(=O)O[C@@H]1CC[C@@]2(C)C(CC[C@]3(C)C2CC=C2C4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C1(C)C	InChI=1S/C32H50O4/c1-20(33)36-25-12-13-29(6)23(28(25,4)5)11-14-31(8)24(29)10-9-21-22-19-27(2,3)15-17-32(22,26(34)35)18-16-30(21,31)7/h9,22-25H,10-19H2,1-8H3,(H,34,35)/t22?,23?,24?,25-,29+,30-,31-,32+/m1/s1	RIXNFYQZWDGQAE-JMGFFJFSSA-N	498.37091008							
Butoconazole	LSM-1344	Butoconazole, Gynazole-1	47472	InChI=1S/C19H17Cl3N2S/c20-15-7-4-14(5-8-15)6-9-16(12-24-11-10-23-13-24)25-19-17(21)2-1-3-18(19)22/h1-5,7-8,10-11,13,16H,6,9,12H2	SWLMUYACZKCSHZ-UHFFFAOYSA-N	Clc1ccc(CCC(Cn2ccnc2)Sc3c(Cl)cccc3Cl)cc1	BroadT	BRD-A16665823	BRD-A16665823-008-03-3	Prestwick Chemical Inc.	Prestw-408	D0701-MP04-ST03-200-	O[N+](=O)[O-]	Clc1ccc(CCC(Cn2ccnc2)Sc2c(Cl)cccc2Cl)cc1.O[N+](=O)[O-]	InChI=1S/C19H17Cl3N2S.HNO3/c20-15-7-4-14(5-8-15)6-9-16(12-24-11-10-23-13-24)25-19-17(21)2-1-3-18(19)22;2-1(3)4/h1-5,7-8,10-11,13,16H,6,9,12H2;(H,2,3,4)	ZHPWRQIPPNZNML-UHFFFAOYSA-N	410.017802384							3240, 3240
Aminoglutethimide	LSM-1409	Aminoglutethimide, Cytadren	2145	InChI=1S/C13H16N2O2/c1-2-13(8-7-11(16)15-12(13)17)9-3-5-10(14)6-4-9/h3-6H,2,7-8,14H2,1H3,(H,15,16,17)	ROBVIMPUHSLWNV-UHFFFAOYSA-N	CCC1(CCC(=O)NC1=O)c2ccc(N)cc2	BroadT	BRD-A25234499	BRD-A25234499-001-04-3	MicroSource Discovery Systems Inc.	1500115			CCC1(CCC(=O)NC1=O)c1ccc(N)cc1	InChI=1S/C13H16N2O2/c1-2-13(8-7-11(16)15-12(13)17)9-3-5-10(14)6-4-9/h3-6H,2,7-8,14H2,1H3,(H,15,16,17)	ROBVIMPUHSLWNV-UHFFFAOYSA-N	232.121177772							2654
Indoprofen	LSM-1564	Indoprofen, K-4277	3718	InChI=1S/C17H15NO3/c1-11(17(20)21)12-6-8-14(9-7-12)18-10-13-4-2-3-5-15(13)16(18)19/h2-9,11H,10H2,1H3,(H,20,21)	RJMIEHBSYVWVIN-UHFFFAOYSA-N	CC(C(=O)O)c1ccc(cc1)N2Cc3ccccc3C2=O	BroadT	BRD-A44090213	BRD-A44090213-001-04-1	MicroSource Discovery Systems Inc.	1500351			CC(C(O)=O)c1ccc(cc1)N1Cc2ccccc2C1=O	InChI=1S/C17H15NO3/c1-11(17(20)21)12-6-8-14(9-7-12)18-10-13-4-2-3-5-15(13)16(18)19/h2-9,11H,10H2,1H3,(H,20,21)	RJMIEHBSYVWVIN-UHFFFAOYSA-N	281.10519335							76162
Thiamylal	LSM-4367	Thiamylal, Thiamylal Sodium	3032285	InChI=1S/C12H18N2O2S/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16/h5,8H,2,4,6-7H2,1,3H3,(H2,13,14,15,16,17)	XLOMZPUITCYLMJ-UHFFFAOYSA-N	CCCC(C)C1(CC=C)C(=O)NC(=NC1=O)S	BroadT	BRD-A23970436	BRD-A23970436-236-02-6	MicroSource Discovery Systems Inc.	1900002		[Na]	CCCC(C)C1(CC=C)C(=O)NC(S)=NC1=O.[Na]	InChI=1S/C12H18N2O2S.Na.H/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16;;/h5,8H,2,4,6-7H2,1,3H3,(H2,13,14,15,16,17);;	FJXQYYPVZOKLMG-UHFFFAOYSA-N	254.108898526							9536, 9536
Zaldaride	LSM-1413	Zaldaride, BRD-A26032986	65909	InChI=1S/C26H28N4O2/c1-26(24-11-6-14-29(24)22-9-4-2-7-19(22)17-32-26)18-28-15-12-20(13-16-28)30-23-10-5-3-8-21(23)27-25(30)31/h2-11,14,20H,12-13,15-18H2,1H3,(H,27,31)	HTGCJAAPDHZCHL-UHFFFAOYSA-N	CC1(CN2CCC(CC2)N3C(=O)Nc4ccccc34)OCc5ccccc5n6cccc16	BroadT	BRD-A26032986	BRD-A26032986-050-01-3	Tocris Bioscience	2255	2	OC(=O)/C=C\C(=O)O	CC1(CN2CCC(CC2)n2c3ccccc3[nH]c2=O)OCc2ccccc2-n2cccc12.OC(=O)/C=C\C(=O)O	InChI=1S/C26H28N4O2.C4H4O4/c1-26(24-11-6-14-29(24)22-9-4-2-7-19(22)17-32-26)18-28-15-12-20(13-16-28)30-23-10-5-3-8-21(23)27-25(30)31;5-3(6)1-2-4(7)8/h2-11,14,20H,12-13,15-18H2,1H3,(H,27,31);1-2H,(H,5,6)(H,7,8)/b;2-1-	NGODOSILXOFQPH-BTJKTKAUSA-N	428.221226176							91604
Dihydro-Obliquin	LSM-1314	SID26749439	3503044	InChI=1S/C14H14O4/c1-8(2)13-7-16-11-6-10-9(5-12(11)17-13)3-4-14(15)18-10/h3-6,8,13H,7H2,1-2H3	IZXSTWMUJGTAMI-UHFFFAOYSA-N	CC(C)C1COc2cc3OC(=O)C=Cc3cc2O1	BroadT	BRD-A11483079	BRD-A11483079-001-02-4	MicroSource Discovery Systems Inc.	100543			CC(C)C1COc2cc3oc(=O)ccc3cc2O1	InChI=1S/C14H14O4/c1-8(2)13-7-16-11-6-10-9(5-12(11)17-13)3-4-14(15)18-10/h3-6,8,13H,7H2,1-2H3	IZXSTWMUJGTAMI-UHFFFAOYSA-N	246.089208928							91527
Metoprolol	LSM-1259	Metoprolol, Lopressidone, Toprol-XL	4171	InChI=1S/C15H25NO3/c1-12(2)16-10-14(17)11-19-15-6-4-13(5-7-15)8-9-18-3/h4-7,12,14,16-17H,8-11H2,1-3H3	IUBSYMUCCVWXPE-UHFFFAOYSA-N	COCCc1ccc(OCC(O)CNC(C)C)cc1	BroadT	BRD-A03623303	BRD-A03623303-045-02-0	MicroSource Discovery Systems Inc.	1500411		OC(C(O)C(=O)O)C(=O)O	COCCc1ccc(OCC(O)CNC(C)C)cc1.OC(C(O)C(=O)O)C(=O)O	InChI=1S/C15H25NO3.C4H6O6/c1-12(2)16-10-14(17)11-19-15-6-4-13(5-7-15)8-9-18-3;5-1(3(7)8)2(6)4(9)10/h4-7,12,14,16-17H,8-11H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)	WPTKISQJQVFSQI-UHFFFAOYSA-N	267.18344367							6904, 6904, 6904, 6904, 6904, 6904, 6904, 6904, 6904
Isomazole	LSM-1536	Sulmazole	55690	InChI=1S/C14H13N3O2S/c1-19-13-7-9(20(2)18)3-4-10(13)14-16-11-5-6-15-8-12(11)17-14/h3-8H,1-2H3,(H,16,17)	JQUKCPUPFALELS-UHFFFAOYSA-N	COc1cc(ccc1c2nc3ccncc3[nH]2)S(=O)C	BroadT	BRD-A41722204	BRD-A41722204-003-01-5	Calbiochem	419545		Cl	COc1cc(ccc1-c1nc2ccncc2[nH]1)S(C)=O.Cl	InChI=1S/C14H13N3O2S.ClH/c1-19-13-7-9(20(2)18)3-4-10(13)14-16-11-5-6-15-8-12(11)17-14;/h3-8H,1-2H3,(H,16,17);1H	OJDNVOWLGHYRPR-UHFFFAOYSA-N	287.072847376							91691, 91691
Isamoltan	LSM-1421	Isamoltan, Isamoltane	127404	InChI=1S/C16H22N2O2/c1-13(2)17-11-14(19)12-20-16-8-4-3-7-15(16)18-9-5-6-10-18/h3-10,13-14,17,19H,11-12H2,1-2H3	XVTVPGKWYHWYAD-UHFFFAOYSA-N	CC(C)NCC(O)COc1ccccc1n2cccc2	BroadT	BRD-A26845397	BRD-A26845397-001-01-4	Biomol International Inc.	AC-539	2813-N1283		CC(C)NCC(O)COc1ccccc1-n1cccc1	InChI=1S/C16H22N2O2/c1-13(2)17-11-14(19)12-20-16-8-4-3-7-15(16)18-9-5-6-10-18/h3-10,13-14,17,19H,11-12H2,1-2H3	XVTVPGKWYHWYAD-UHFFFAOYSA-N	274.168127964							91607
Idazoxan	LSM-4350	Idazoxan, RX-781094	54459	InChI=1S/C11H12N2O2/c1-2-4-9-8(3-1)14-7-10(15-9)11-12-5-6-13-11/h1-4,10H,5-7H2,(H,12,13)	HPMRFMKYPGXPEP-UHFFFAOYSA-N	C1CN=C(N1)C2COc3ccccc3O2	BroadT	BRD-A18696154	BRD-A18696154-003-11-9	Tocris Bioscience	793	5	Cl	C1CN=C(N1)C1COc2ccccc2O1.Cl	InChI=1S/C11H12N2O2.ClH/c1-2-4-9-8(3-1)14-7-10(15-9)11-12-5-6-13-11;/h1-4,10H,5-7H2,(H,12,13);1H	MYUBYOVCLMEAOH-UHFFFAOYSA-N	204.089877644							5862, 5862
Aceclidine	LSM-4403	Aceclidine, Glaucostat	1979	InChI=1S/C9H15NO2/c1-7(11)12-9-6-10-4-2-8(9)3-5-10/h8-9H,2-6H2,1H3	WRJPSSPFHGNBMG-UHFFFAOYSA-N	CC(=O)OC1CN2CCC1CC2	BroadT	BRD-A32673558	BRD-A32673558-003-02-1	MicroSource Discovery Systems Inc.	1501124		Cl	CC(=O)OC1CN2CCC1CC2.Cl	InChI=1S/C9H15NO2.ClH/c1-7(11)12-9-6-10-4-2-8(9)3-5-10;/h8-9H,2-6H2,1H3;1H	LWWSARSTZGNKGV-UHFFFAOYSA-N	169.11027873							93847
Dropropizine	LSM-4385	Dropropizine, UCB-1967	3169	InChI=1S/C13H20N2O2/c16-11-13(17)10-14-6-8-15(9-7-14)12-4-2-1-3-5-12/h1-5,13,16-17H,6-11H2	PTVWPYVOOKLBCG-UHFFFAOYSA-N	OCC(O)CN1CCN(CC1)c2ccccc2	BroadT	BRD-A29349577	BRD-A29349577-001-04-0	MicroSource Discovery Systems Inc.	1501004			OCC(O)CN1CCN(CC1)c1ccccc1	InChI=1S/C13H20N2O2/c16-11-13(17)10-14-6-8-15(9-7-14)12-4-2-1-3-5-12/h1-5,13,16-17H,6-11H2	PTVWPYVOOKLBCG-UHFFFAOYSA-N	236.1524779							93837
AC1O8PZP	LSM-1327	Flucloxacillin	6713996	InChI=1S/C19H17ClFN3O5S/c1-7-10(12(23-29-7)11-8(20)5-4-6-9(11)21)15(25)22-13-16(26)24-14(18(27)28)19(2,3)30-17(13)24/h4-6,13-14,17H,1-3H3,(H,22,25)(H,27,28)/t13-,14?,17-/m1/s1	UIOFUWFRIANQPC-SNVMCYLTSA-N	Cc1onc(c1C(=O)N[C@H]2[C@H]3SC(C)(C)C(N3C2=O)C(=O)O)c4c(F)cccc4Cl	BroadT	BRD-A13650332	BRD-A13650332-236-03-9	Prestwick Chemical Inc.	Prestw-1011	D0701-MP04-ST03-200-	[Na]	Cc1onc(c1C(=O)N[C@H]1[C@H]2SC(C)(C)C(N2C1=O)C(O)=O)-c1c(F)cccc1Cl.[Na]	InChI=1S/C19H17ClFN3O5S.Na.H/c1-7-10(12(23-29-7)11-8(20)5-4-6-9(11)21)15(25)22-13-16(26)24-14(18(27)28)19(2,3)30-17(13)24;;/h4-6,13-14,17H,1-3H3,(H,22,25)(H,27,28);;/t13-,14?,17-;;/m1../s1	QMROUFLSCAITBQ-YMRRHLTRSA-N	453.056147274							91539, 91539
Thiocolchicoside	LSM-1316	Thiocolchicoside, Thiocolchicine Glycoside	72067	InChI=1S/C27H33NO10S/c1-12(30)28-16-7-5-13-9-18(37-27-24(34)23(33)22(32)19(11-29)38-27)25(35-2)26(36-3)21(13)14-6-8-20(39-4)17(31)10-15(14)16/h6,8-10,16,19,22-24,27,29,32-34H,5,7,11H2,1-4H3,(H,28,30)/t16?,19-,22-,23+,24-,27-/m1/s1	LEQAKWQJCITZNK-MSQQGMGVSA-N	COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc3CCC(NC(=O)C)C4=CC(=O)C(=CC=C4c3c1OC)SC	BroadT	BRD-A11605036	BRD-A11605036-001-03-2	Prestwick Chemical Inc.	Prestw-539	D0701-MP04-ST03-200-		COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2CCC(NC(C)=O)c3cc(=O)c(SC)ccc3-c2c1OC	InChI=1S/C27H33NO10S/c1-12(30)28-16-7-5-13-9-18(37-27-24(34)23(33)22(32)19(11-29)38-27)25(35-2)26(36-3)21(13)14-6-8-20(39-4)17(31)10-15(14)16/h6,8-10,16,19,22-24,27,29,32-34H,5,7,11H2,1-4H3,(H,28,30)/t16?,19-,22-,23+,24-,27-/m1/s1	LEQAKWQJCITZNK-MSQQGMGVSA-N	563.182516956							91529
NSC627609	LSM-1318	Wortmannin, SID124881812, SID124881816, SID124881817	3003565	InChI=1S/C23H24O8/c1-10(24)30-13-7-22(2)12(5-6-14(22)25)16-18(13)23(3)15(9-28-4)31-21(27)11-8-29-20(17(11)23)19(16)26/h8,12-13,15H,5-7,9H2,1-4H3/t12?,13-,15-,22+,23+/m1/s1	QDLHCMPXEPAAMD-ZGSWIPFCSA-N	COC[C@H]1OC(=O)c2coc3C(=O)C4=C([C@@H](C[C@@]5(C)C4CCC5=O)OC(=O)C)[C@]1(C)c23	BroadT	BRD-A11678676	BRD-A11678676-001-02-6	Biomol International Inc.	ST-415	2832A(V2.2)-3-N1290		COC[C@H]1OC(=O)c2coc3c2[C@@]1(C)C1=C(C2CCC(=O)[C@@]2(C)C[C@H]1OC(C)=O)C3=O	InChI=1S/C23H24O8/c1-10(24)30-13-7-22(2)12(5-6-14(22)25)16-18(13)23(3)15(9-28-4)31-21(27)11-8-29-20(17(11)23)19(16)26/h8,12-13,15H,5-7,9H2,1-4H3/t12?,13-,15-,22+,23+/m1/s1	QDLHCMPXEPAAMD-ZGSWIPFCSA-N	428.147117728							91531
2-Hydroxysaclofen	LSM-22635	2-Hydroxysaclofen, BRD-A27924917	1564	InChI=1S/C9H12ClNO4S/c10-8-3-1-7(2-4-8)9(12,5-11)6-16(13,14)15/h1-4,12H,5-6,11H2,(H,13,14,15)	WBSMZVIMANOCNX-UHFFFAOYSA-N	NCC(O)(CS(=O)(=O)O)c1ccc(Cl)cc1	BroadT	BRD-A27924917	BRD-A27924917-001-01-7	Tocris Bioscience	245	19		NCC(O)(CS(O)(=O)=O)c1ccc(Cl)cc1	InChI=1S/C9H12ClNO4S/c10-8-3-1-7(2-4-8)9(12,5-11)6-16(13,14)15/h1-4,12H,5-6,11H2,(H,13,14,15)	WBSMZVIMANOCNX-UHFFFAOYSA-N	265.017556274							111179
IN1451	LSM-4349	5-Iodotubercidin, SID26756657, SID26756656, SID26756655, SID26753828	1830	InChI=1S/C11H13IN4O4/c12-4-1-16(10-6(4)9(13)14-3-15-10)11-8(19)7(18)5(2-17)20-11/h1,3,5,7-8,11,17-19H,2H2,(H2,13,14,15)	WHSIXKUPQCKWBY-UHFFFAOYSA-N	Nc1ncnc2c1c(I)cn2C3OC(CO)C(O)C3O	BroadT	BRD-A18497530	BRD-A18497530-001-04-6	Biomol International Inc.	EI-293	2840(V2)-3-N1305		Nc1ncnc2n(cc(I)c12)C1OC(CO)C(O)C1O	InChI=1S/C11H13IN4O4/c12-4-1-16(10-6(4)9(13)14-3-15-10)11-8(19)7(18)5(2-17)20-11/h1,3,5,7-8,11,17-19H,2H2,(H2,13,14,15)	WHSIXKUPQCKWBY-UHFFFAOYSA-N	391.998147936							93817
Brefeldin A	LSM-1349	BRD-A17065207	2430	InChI=1S/C16H24O4/c1-11-5-3-2-4-6-12-9-13(17)10-14(12)15(18)7-8-16(19)20-11/h4,6-8,11-15,17-18H,2-3,5,9-10H2,1H3	KQNZDYYTLMIZCT-UHFFFAOYSA-N	CC1CCCC=CC2CC(O)CC2C(O)C=CC(=O)O1	BroadT	BRD-A17065207	BRD-A17065207-001-06-9	Tocris Bioscience	1231	3		CC1CCCC=CC2CC(O)CC2C(O)C=CC(=O)O1	InChI=1S/C16H24O4/c1-11-5-3-2-4-6-12-9-13(17)10-14(12)15(18)7-8-16(19)20-11/h4,6-8,11-15,17-18H,2-3,5,9-10H2,1H3	KQNZDYYTLMIZCT-UHFFFAOYSA-N	280.167459248							91555
ChEBI91594	LSM-1400	Taxol, Paclitaxel, BRD-A23723433	4666	InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)	RCINICONZNJXQF-UHFFFAOYSA-N	CC(=O)OC1C(=O)C2(C)C(O)CC3OCC3(OC(=O)C)C2C(OC(=O)c4ccccc4)C5(O)CC(OC(=O)C(O)C(NC(=O)c6ccccc6)c7ccccc7)C(=C1C5(C)C)C	BroadT	BRD-A23723433	BRD-A23723433-001-01-2	Tocris Bioscience	1097	4		CC(=O)OC1C2=C(C)C(CC(O)(C(OC(=O)c3ccccc3)C3C4(COC4CC(O)C3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)C(O)C(NC(=O)c1ccccc1)c1ccccc1	InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)	RCINICONZNJXQF-UHFFFAOYSA-N	853.330955322							91594
AC1L1KV5	LSM-1395	BRD-A22783572	5667	InChI=1S/C46H58N4O9/c1-8-42(54)23-27-24-45(40(52)58-6,36-29(15-19-49(25-27)26-42)28-13-10-11-14-32(28)47-36)31-21-30-33(22-34(31)56-4)48(3)39-44(30)17-20-50-18-12-16-43(9-2,38(44)50)35(37(51)57-5)46(39,55)41(53)59-7/h10-14,16,21-22,27,35,38-39,47,54-55H,8-9,15,17-20,23-26H2,1-7H3	SLIRURSWQCRWFG-UHFFFAOYSA-N	CCC1(O)CC2CN(CCc3c([nH]c4ccccc34)C(C2)(C(=O)OC)c5cc6c(cc5OC)N(C)C7C(O)(C(C(=O)OC)C8(CC)C=CCN9CCC67C89)C(=O)OC)C1	BroadT	BRD-A22783572	BRD-A22783572-065-01-3	Tocris Bioscience	1256	1	OS(=O)(=O)O	CCC1(O)CC2CN(C1)CCc1c([nH]c3ccccc13)C(C2)(C(=O)OC)c1cc2c(cc1OC)N(C)C1C22CCN3CC=CC(CC)(C23)C(C(=O)OC)C1(O)C(=O)OC.OS(=O)(=O)O	InChI=1S/C46H58N4O9.H2O4S/c1-8-42(54)23-27-24-45(40(52)58-6,36-29(15-19-49(25-27)26-42)28-13-10-11-14-32(28)47-36)31-21-30-33(22-34(31)56-4)48(3)39-44(30)17-20-50-18-12-16-43(9-2,38(44)50)35(37(51)57-5)46(39,55)41(53)59-7;1-5(2,3)4/h10-14,16,21-22,27,35,38-39,47,54-55H,8-9,15,17-20,23-26H2,1-7H3;(H2,1,2,3,4)	PQRHLAKBRMUOGG-UHFFFAOYSA-N	810.420379476							91589
1-(3,5-Dimethoxyphenyl)-3-pyridin-3-ylthiourea	LSM-22636	SID17432225, BRD-K60045531	1974506	InChI=1S/C14H15N3O2S/c1-18-12-6-11(7-13(8-12)19-2)17-14(20)16-10-4-3-5-15-9-10/h3-9H,1-2H3,(H2,16,17,20)	JSTOLLBVRXQYDF-UHFFFAOYSA-N	COc1cc(NC(=Nc2cccnc2)S)cc(OC)c1	BroadT	BRD-K60045531	BRD-K60045531-001-05-4	ChemBridge Corporation	7865232			COc1cc(NC(S)=Nc2cccnc2)cc(OC)c1	InChI=1S/C14H15N3O2S/c1-18-12-6-11(7-13(8-12)19-2)17-14(20)16-10-4-3-5-15-9-10/h3-9H,1-2H3,(H2,16,17,20)	JSTOLLBVRXQYDF-UHFFFAOYSA-N	289.08849744							111180
AC1LDUJE	LSM-43970	SID17416101, BRD-K23526625	701648	InChI=1S/C13H14N2O2S2/c1-9-2-7-18-10(9)8-11-12(16)14-13(19-11)15-3-5-17-6-4-15/h2,7-8H,3-6H2,1H3/b11-8-	KZNUVOHTMZRUNU-FLIBITNWSA-N	Cc1ccsc1\C=C\2/SC(=NC2=O)N3CCOCC3	BroadT	BRD-K23526625	BRD-K23526625-001-05-6	ChemBridge Corporation	6289185			Cc1ccsc1\C=C1/SC(=NC1=O)N1CCOCC1	InChI=1S/C13H14N2O2S2/c1-9-2-7-18-10(9)8-11-12(16)14-13(19-11)15-3-5-17-6-4-15/h2,7-8H,3-6H2,1H3/b11-8-	KZNUVOHTMZRUNU-FLIBITNWSA-N	294.049669088							
10L-603S	LSM-22638	SID17410469, BRD-K12591421	1475531	InChI=1S/C17H19Cl2N3OS2/c1-24-11-13-9-16(22-4-6-23-7-5-22)21-17(20-13)25-10-12-2-3-14(18)15(19)8-12/h2-3,8-9H,4-7,10-11H2,1H3	WTRXEPZLZIHAFM-UHFFFAOYSA-N	CSCc1cc(nc(SCc2ccc(Cl)c(Cl)c2)n1)N3CCOCC3	BroadT	BRD-K12591421	BRD-K12591421-001-05-9	Key Organics Ltd.	10L-603S			CSCc1cc(nc(SCc2ccc(Cl)c(Cl)c2)n1)N1CCOCC1	InChI=1S/C17H19Cl2N3OS2/c1-24-11-13-9-16(22-4-6-23-7-5-22)21-17(20-13)25-10-12-2-3-14(18)15(19)8-12/h2-3,8-9H,4-7,10-11H2,1H3	WTRXEPZLZIHAFM-UHFFFAOYSA-N	415.034659058							111182
MLS000057334	LSM-22639	SID3714021, BRD-K66155843	2124211	InChI=1S/C20H20N2O4/c1-4-9-22-14(2)10-17(15(22)3)18(23)12-26-20(24)13-25-19-8-6-5-7-16(19)11-21/h4-8,10H,1,9,12-13H2,2-3H3	MNZSMOANAWFQPI-UHFFFAOYSA-N	Cc1cc(C(=O)COC(=O)COc2ccccc2C#N)c(C)n1CC=C	BroadT	BRD-K66155843	BRD-K66155843-001-05-8	Enamine Ltd.	T5251406			Cc1cc(C(=O)COC(=O)COc2ccccc2C#N)c(C)n1CC=C	InChI=1S/C20H20N2O4/c1-4-9-22-14(2)10-17(15(22)3)18(23)12-26-20(24)13-25-19-8-6-5-7-16(19)11-21/h4-8,10H,1,9,12-13H2,2-3H3	MNZSMOANAWFQPI-UHFFFAOYSA-N	352.14230714							111183
3-[Benzyl(Methyl)amino]-1-(4-ethoxyphenyl)pyrrolidine-2,5-dione	LSM-22640	SID14719340, BRD-A12510057	2839652	InChI=1S/C20H22N2O3/c1-3-25-17-11-9-16(10-12-17)22-19(23)13-18(20(22)24)21(2)14-15-7-5-4-6-8-15/h4-12,18H,3,13-14H2,1-2H3	FGWFOXWRPRARCN-UHFFFAOYSA-N	CCOc1ccc(cc1)N2C(=O)CC(N(C)Cc3ccccc3)C2=O	BroadT	BRD-A12510057	BRD-A12510057-001-05-2	ChemBridge Corporation	5301128			CCOc1ccc(cc1)N1C(=O)CC(N(C)Cc2ccccc2)C1=O	InChI=1S/C20H22N2O3/c1-3-25-17-11-9-16(10-12-17)22-19(23)13-18(20(22)24)21(2)14-15-7-5-4-6-8-15/h4-12,18H,3,13-14H2,1-2H3	FGWFOXWRPRARCN-UHFFFAOYSA-N	338.163042584							111184
2-(2,4-Dichloro-6-methylphenoxy)-n-(2-furylmethyl)acetamide	LSM-22641	SID7972812, BRD-K38491612	2275267	InChI=1S/C14H13Cl2NO3/c1-9-5-10(15)6-12(16)14(9)20-8-13(18)17-7-11-3-2-4-19-11/h2-6H,7-8H2,1H3,(H,17,18)	LLZGEIHNFCBNLX-UHFFFAOYSA-N	Cc1cc(Cl)cc(Cl)c1OCC(=O)NCc2occc2	BroadT	BRD-K38491612	BRD-K38491612-001-05-1	ChemBridge Corporation	6294393			Cc1cc(Cl)cc(Cl)c1OCC(=O)NCc1ccco1	InChI=1S/C14H13Cl2NO3/c1-9-5-10(15)6-12(16)14(9)20-8-13(18)17-7-11-3-2-4-19-11/h2-6H,7-8H2,1H3,(H,17,18)	LLZGEIHNFCBNLX-UHFFFAOYSA-N	313.027248706							111185
ST075222	LSM-22642	SID49642749, BRD-A56740231	2848518	InChI=1S/C20H25ClN4O3/c1-14-12-24(13-15(2)23-14)17-5-8-20(25(26)27)19(11-17)22-9-10-28-18-6-3-16(21)4-7-18/h3-8,11,14-15,22-23H,9-10,12-13H2,1-2H3	JPFRBOZKXOCNQU-UHFFFAOYSA-N	CC1CN(CC(C)N1)c2ccc(c(NCCOc3ccc(Cl)cc3)c2)[N+](=O)[O-]	BroadT	BRD-A56740231	BRD-A56740231-001-06-9	Asinex Ltd.	BAS 00434961			CC1CN(CC(C)N1)c1ccc(c(NCCOc2ccc(Cl)cc2)c1)[N+]([O-])=O	InChI=1S/C20H25ClN4O3/c1-14-12-24(13-15(2)23-14)17-5-8-20(25(26)27)19(11-17)22-9-10-28-18-6-3-16(21)4-7-18/h3-8,11,14-15,22-23H,9-10,12-13H2,1-2H3	JPFRBOZKXOCNQU-UHFFFAOYSA-N	404.16151841							111186
MLS000574019	LSM-43971	SID17411785, BRD-K73149307	1345238	InChI=1S/C20H19N3O2S2/c1-14-7-9-15(10-8-14)13-16-19(25)23(20(26)27-16)12-4-6-18(24)22-17-5-2-3-11-21-17/h2-3,5,7-11,13H,4,6,12H2,1H3,(H,21,22,24)/b16-13-	CMRCYZLRSDSGMN-SSZFMOIBSA-N	Cc1ccc(\C=C\2/SC(=S)N(CCCC(=O)Nc3ccccn3)C2=O)cc1	BroadT	BRD-K73149307	BRD-K73149307-001-06-9	ChemBridge Corporation	6602926			Cc1ccc(\C=C2/SC(=S)N(CCCC(=O)Nc3ccccn3)C2=O)cc1	InChI=1S/C20H19N3O2S2/c1-14-7-9-15(10-8-14)13-16-19(25)23(20(26)27-16)12-4-6-18(24)22-17-5-2-3-11-21-17/h2-3,5,7-11,13H,4,6,12H2,1H3,(H,21,22,24)/b16-13-	CMRCYZLRSDSGMN-SSZFMOIBSA-N	397.091868258							
SMR000030816	LSM-22644	SID4251571, BRD-K06624990	3245237	InChI=1S/C16H12N4OS/c1-10-6-2-4-8-12(10)17-15-19-20-14(21)11-7-3-5-9-13(11)18-16(20)22-15/h2-9H,1H3,(H,17,19)	FVSMUFZKSNZOGY-UHFFFAOYSA-N	Cc1ccccc1NC2=NN3C(=Nc4ccccc4C3=O)S2	BroadT	BRD-K06624990	BRD-K06624990-001-05-7	ChemDiv Inc.	K284-2363			Cc1ccccc1Nc1nn2c(nc3ccccc3c2=O)s1	InChI=1S/C16H12N4OS/c1-10-6-2-4-8-12(10)17-15-19-20-14(21)11-7-3-5-9-13(11)18-16(20)22-15/h2-9H,1H3,(H,17,19)	FVSMUFZKSNZOGY-UHFFFAOYSA-N	308.073181734							111188
AC1MDS7L	LSM-22645	BRD-K60404731	2815982	InChI=1S/C20H14N6S3/c27-20-23-22-19(17-9-5-11-29-17)26(20)21-12-14-13-25(15-6-2-1-3-7-15)24-18(14)16-8-4-10-28-16/h1-13H,(H,23,27)	RQEAZYGFPYYARZ-UHFFFAOYSA-N	Sc1nnc(c2cccs2)n1N=Cc3cn(nc3c4cccs4)c5ccccc5	BroadT	BRD-K60404731	BRD-K60404731-001-04-4	Maybridge	HTS 11984			Sc1nnc(-c2cccs2)n1N=Cc1cn(nc1-c1cccs1)-c1ccccc1	InChI=1S/C20H14N6S3/c27-20-23-22-19(17-9-5-11-29-17)26(20)21-12-14-13-25(15-6-2-1-3-7-15)24-18(14)16-8-4-10-28-16/h1-13H,(H,23,27)	RQEAZYGFPYYARZ-UHFFFAOYSA-N	434.044206578							111189
MLS000046462	LSM-22646	SID4243199, BRD-A51400446	3237953	InChI=1S/C20H21FN2O2/c1-14-2-4-16(5-3-14)13-23-18(10-11-19(23)24)20(25)22-12-15-6-8-17(21)9-7-15/h2-9,18H,10-13H2,1H3,(H,22,25)	JHKUFVHDYFRDTK-UHFFFAOYSA-N	Cc1ccc(CN2C(CCC2=O)C(=O)NCc3ccc(F)cc3)cc1	BroadT	BRD-A51400446	BRD-A51400446-001-05-8	ChemDiv Inc.	K786-8581			Cc1ccc(CN2C(CCC2=O)C(=O)NCc2ccc(F)cc2)cc1	InChI=1S/C20H21FN2O2/c1-14-2-4-16(5-3-14)13-23-18(10-11-19(23)24)20(25)22-12-15-6-8-17(21)9-7-15/h2-9,18H,10-13H2,1H3,(H,22,25)	JHKUFVHDYFRDTK-UHFFFAOYSA-N	340.158706132							111190
MLS000730993	LSM-22647	SID24383642, SID24812354, BRD-K82035305	16007475	InChI=1S/C19H23ClN2O2S/c1-24-10-4-9-21-18(23)12-25-19-14-5-2-3-6-16(14)22-17-8-7-13(20)11-15(17)19/h7-8,11H,2-6,9-10,12H2,1H3,(H,21,23)	GUQKTNXMYXOIIZ-UHFFFAOYSA-N	COCCCNC(=O)CSc1c2CCCCc2nc3ccc(Cl)cc13	BroadT	BRD-K82035305	BRD-K82035305-001-05-3	ChemDiv Inc.	C509-0766			COCCCNC(=O)CSc1c2CCCCc2nc2ccc(Cl)cc12	InChI=1S/C19H23ClN2O2S/c1-24-10-4-9-21-18(23)12-25-19-14-5-2-3-6-16(14)22-17-8-7-13(20)11-15(17)19/h7-8,11H,2-6,9-10,12H2,1H3,(H,21,23)	GUQKTNXMYXOIIZ-UHFFFAOYSA-N	378.116876396							111191
MLS000578898	LSM-22648	SID17506662, BRD-K44485152	1193361	InChI=1S/C23H20ClNO4/c1-15-3-8-19(9-4-15)25-23(27)17-5-10-20(11-6-17)29-22(26)14-28-21-12-7-18(24)13-16(21)2/h3-13H,14H2,1-2H3,(H,25,27)	GTUKCIQQCZYFIM-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2ccc(OC(=O)COc3ccc(Cl)cc3C)cc2)cc1	BroadT	BRD-K44485152	BRD-K44485152-001-05-1	ChemBridge Corporation	7575723			Cc1ccc(NC(=O)c2ccc(OC(=O)COc3ccc(Cl)cc3C)cc2)cc1	InChI=1S/C23H20ClNO4/c1-15-3-8-19(9-4-15)25-23(27)17-5-10-20(11-6-17)29-22(26)14-28-21-12-7-18(24)13-16(21)2/h3-13H,14H2,1-2H3,(H,25,27)	GTUKCIQQCZYFIM-UHFFFAOYSA-N	409.10808584							111192
NSC695326	LSM-22649	SID26727565, SID524764, BRD-K93067432	2730951	InChI=1S/C14H15N3OS/c1-10-4-3-5-13(15-10)17-14(19)16-11-6-8-12(18-2)9-7-11/h3-9H,1-2H3,(H2,15,16,17,19)	FJBXOQUCCBQUIY-UHFFFAOYSA-N	COc1ccc(NC(=Nc2cccc(C)n2)S)cc1	BroadT	BRD-K93067432	BRD-K93067432-001-05-9	Maybridge	S 00011			COc1ccc(cc1)NC(S)=Nc1cccc(C)n1	InChI=1S/C14H15N3OS/c1-10-4-3-5-13(15-10)17-14(19)16-11-6-8-12(18-2)9-7-11/h3-9H,1-2H3,(H2,15,16,17,19)	FJBXOQUCCBQUIY-UHFFFAOYSA-N	273.09358282							111193
F0562-0634	LSM-22650	SID51088972, BRD-K15902525	5095508	InChI=1S/C26H30N4O4S2/c1-4-15-30-16-14-21-22(17-30)35-26(23(21)25(32)27-2)28-24(31)18-10-12-20(13-11-18)36(33,34)29(3)19-8-6-5-7-9-19/h5-13H,4,14-17H2,1-3H3,(H,27,32)(H,28,31)	VFFSQBGZVVYBLT-UHFFFAOYSA-N	CCCN1CCc2c(C1)sc(NC(=O)c3ccc(cc3)S(=O)(=O)N(C)c4ccccc4)c2C(=O)NC	BroadT	BRD-K15902525	BRD-K15902525-001-06-8	Life Chemicals Inc.	F0562-0634			CCCN1CCc2c(C1)sc(NC(=O)c1ccc(cc1)S(=O)(=O)N(C)c1ccccc1)c2C(=O)NC	InChI=1S/C26H30N4O4S2/c1-4-15-30-16-14-21-22(17-30)35-26(23(21)25(32)27-2)28-24(31)18-10-12-20(13-11-18)36(33,34)29(3)19-8-6-5-7-9-19/h5-13H,4,14-17H2,1-3H3,(H,27,32)(H,28,31)	VFFSQBGZVVYBLT-UHFFFAOYSA-N	526.17084686							111194
MLS000698599	LSM-22651	SID22412205, BRD-A74913006	4765929	InChI=1S/C18H18BrF3N4O2/c1-10-8-17(28,18(20,21)22)26(23-10)16(27)14-6-4-13(5-7-14)9-25-12(3)15(19)11(2)24-25/h4-7,28H,8-9H2,1-3H3	MUDROFVVGAGUDR-UHFFFAOYSA-N	CC1=NN(C(=O)c2ccc(Cn3nc(C)c(Br)c3C)cc2)C(O)(C1)C(F)(F)F	BroadT	BRD-A74913006	BRD-A74913006-001-05-5	Specs	AK-968/41923048			CC1=NN(C(=O)c2ccc(Cn3nc(C)c(Br)c3C)cc2)C(O)(C1)C(F)(F)F	InChI=1S/C18H18BrF3N4O2/c1-10-8-17(28,18(20,21)22)26(23-10)16(27)14-6-4-13(5-7-14)9-25-12(3)15(19)11(2)24-25/h4-7,28H,8-9H2,1-3H3	MUDROFVVGAGUDR-UHFFFAOYSA-N	458.056523056							111195
F0915-1314	LSM-22652	SID24809973, BRD-A39570609	2876875	InChI=1S/C17H17ClN2O2/c1-12-19-15-7-3-4-8-16(15)20(12)10-13(21)11-22-17-9-5-2-6-14(17)18/h2-9,13,21H,10-11H2,1H3	QSNHAWLIONBKPZ-UHFFFAOYSA-N	Cc1nc2ccccc2n1CC(O)COc3ccccc3Cl	BroadT	BRD-A39570609	BRD-A39570609-001-06-6	Asinex Ltd.	BAS 02973560			Cc1nc2ccccc2n1CC(O)COc1ccccc1Cl	InChI=1S/C17H17ClN2O2/c1-12-19-15-7-3-4-8-16(15)20(12)10-13(21)11-22-17-9-5-2-6-14(17)18/h2-9,13,21H,10-11H2,1H3	QSNHAWLIONBKPZ-UHFFFAOYSA-N	316.097855514							111196
MLS000572940	LSM-43972	SID17415922, BRD-K17332392	1339487	InChI=1S/C21H17NO/c23-21(22-19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)16-17-10-4-1-5-11-17/h1-16H,(H,22,23)/b20-16+	LRWGRVABKCHCSI-CAPFRKAQSA-N	O=C(Nc1ccccc1)\C(=C\c2ccccc2)\c3ccccc3	BroadT	BRD-K17332392	BRD-K17332392-001-05-8	ChemBridge Corporation	6491321			O=C(Nc1ccccc1)C(=C\c1ccccc1)\c1ccccc1	InChI=1S/C21H17NO/c23-21(22-19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)16-17-10-4-1-5-11-17/h1-16H,(H,22,23)/b20-16+	LRWGRVABKCHCSI-CAPFRKAQSA-N	299.131014174							
MLS000063704	LSM-22654	SID4265701, BRD-K61131115	900714	InChI=1S/C17H16N4OS/c22-17(16-19-13-5-1-2-6-14(13)23-16)21-11-9-20(10-12-21)15-7-3-4-8-18-15/h1-8H,9-12H2	GEOUZRZOLPSTCW-UHFFFAOYSA-N	O=C(N1CCN(CC1)c2ccccn2)c3nc4ccccc4s3	BroadT	BRD-K61131115	BRD-K61131115-001-04-8	ChemBridge Corporation	7730136			O=C(N1CCN(CC1)c1ccccn1)c1nc2ccccc2s1	InChI=1S/C17H16N4OS/c22-17(16-19-13-5-1-2-6-14(13)23-16)21-11-9-20(10-12-21)15-7-3-4-8-18-15/h1-8H,9-12H2	GEOUZRZOLPSTCW-UHFFFAOYSA-N	324.104481862							111198
SMR000108318	LSM-22655	SID7974484, BRD-K77279454	2288023	InChI=1S/C16H21N3O4S3/c1-10-5-6-11(2)13(9-10)26(21,22)17-7-8-23-15(20)18-14-12(3)19(4)16(24)25-14/h5-6,9,17H,7-8H2,1-4H3,(H,18,20)	WYGAGHAVIDWXPU-UHFFFAOYSA-N	CN1C(=C(NC(=O)OCCNS(=O)(=O)c2cc(C)ccc2C)SC1=S)C	BroadT	BRD-K77279454	BRD-K77279454-001-05-3	ChemBridge Corporation	6820262			Cc1c(NC(=O)OCCNS(=O)(=O)c2cc(C)ccc2C)sc(=S)n1C	InChI=1S/C16H21N3O4S3/c1-10-5-6-11(2)13(9-10)26(21,22)17-7-8-23-15(20)18-14-12(3)19(4)16(24)25-14/h5-6,9,17H,7-8H2,1-4H3,(H,18,20)	WYGAGHAVIDWXPU-UHFFFAOYSA-N	415.069418252							111199
ST028979	LSM-22656	SID3712712, BRD-K26532096	722122	InChI=1S/C7H6Br2N2O2S/c8-5-3-6(9)7-10-14(12,13)2-1-11(7)4-5/h3-4H,1-2H2	JOCGPVJJXSYEAL-UHFFFAOYSA-N	BrC1=CN2CCS(=O)(=O)N=C2C(=C1)Br	BroadT	BRD-K26532096	BRD-K26532096-001-05-1	Enamine Ltd.	T0504-2323			BrC1=CN2CCS(=O)(=O)N=C2C(Br)=C1	InChI=1S/C7H6Br2N2O2S/c8-5-3-6(9)7-10-14(12,13)2-1-11(7)4-5/h3-4H,1-2H2	JOCGPVJJXSYEAL-UHFFFAOYSA-N	339.851673342							111200
STK562771	LSM-22657	SID26662834, BRD-A49587193	5136787	InChI=1S/C14H26N4S2/c1-5-7-9-13(3)15-11(19)18-14(4,10-8-6-2)16-12(20)17(13)18/h5-10H2,1-4H3,(H,15,19)(H,16,20)	RDNFFQNLAUZJTP-UHFFFAOYSA-N	CCCCC1(C)N=C(S)N2N1C(=NC2(C)CCCC)S	BroadT	BRD-A49587193	BRD-A49587193-001-05-2	InterBioScreen Ltd.	STOCK3S-32681			CCCCC1(C)N=C(S)N2N1C(S)=NC2(C)CCCC	InChI=1S/C14H26N4S2/c1-5-7-9-13(3)15-11(19)18-14(4,10-8-6-2)16-12(20)17(13)18/h5-10H2,1-4H3,(H,15,19)(H,16,20)	RDNFFQNLAUZJTP-UHFFFAOYSA-N	314.159888252							111201
MLS000051952	LSM-22658	SID4257464, SID26669407, BRD-K16717020	2228176	InChI=1S/C23H17F3N6O2/c1-14-5-2-3-6-15(14)13-31-9-8-20(30-31)29-22(33)16-12-27-32-19(23(24,25)26)11-17(28-21(16)32)18-7-4-10-34-18/h2-12H,13H2,1H3,(H,29,30,33)	ICAOWTCIJTUECG-UHFFFAOYSA-N	Cc1ccccc1Cn2ccc(NC(=O)c3cnn4c(cc(nc34)c5occc5)C(F)(F)F)n2	BroadT	BRD-K16717020	BRD-K16717020-001-06-9	ChemBridge Corporation	7954955			Cc1ccccc1Cn1ccc(NC(=O)c2cnn3c(cc(nc23)-c2ccco2)C(F)(F)F)n1	InChI=1S/C23H17F3N6O2/c1-14-5-2-3-6-15(14)13-31-9-8-20(30-31)29-22(33)16-12-27-32-19(23(24,25)26)11-17(28-21(16)32)18-7-4-10-34-18/h2-12H,13H2,1H3,(H,29,30,33)	ICAOWTCIJTUECG-UHFFFAOYSA-N	466.136508444							111202
MLS000554705	LSM-22659	SID14729407, BRD-A81338822	3742133	InChI=1S/C6H8N2O2S3/c1-3(4(9)10-2)12-6-8-7-5(11)13-6/h3H,1-2H3,(H,7,11)	OVFVNXZKMPNLJV-UHFFFAOYSA-N	COC(=O)C(C)Sc1nnc(S)s1	BroadT	BRD-A81338822	BRD-A81338822-001-06-6	InterBioScreen Ltd.	STOCK1S-30511			COC(=O)C(C)Sc1nnc(S)s1	InChI=1S/C6H8N2O2S3/c1-3(4(9)10-2)12-6-8-7-5(11)13-6/h3H,1-2H3,(H,7,11)	OVFVNXZKMPNLJV-UHFFFAOYSA-N	235.974789586							111203
T5313676	LSM-22660	SID17385987, BRD-K38698812	2467957	InChI=1S/C16H17N7O3S2/c1-22(10(24)8-27-16-21-20-14(18)28-16)11-12(17)23(15(26)19-13(11)25)7-9-5-3-2-4-6-9/h2-6H,7-8,17H2,1H3,(H2,18,20)(H,19,25,26)	XXYQHNSHYOLBFT-UHFFFAOYSA-N	CN(C(=O)CSc1nnc(N)s1)C2=C(N)N(Cc3ccccc3)C(=O)NC2=O	BroadT	BRD-K38698812	BRD-K38698812-001-05-9	Enamine Ltd.	T5313676			CN(C(=O)CSc1nnc(N)s1)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O	InChI=1S/C16H17N7O3S2/c1-22(10(24)8-27-16-21-20-14(18)28-16)11-12(17)23(15(26)19-13(11)25)7-9-5-3-2-4-6-9/h2-6H,7-8,17H2,1H3,(H2,18,20)(H,19,25,26)	XXYQHNSHYOLBFT-UHFFFAOYSA-N	419.083428854							111204
STK568834	LSM-22661	SID17504491, BRD-K20419492	1623337	InChI=1S/C21H13F7N4O2/c1-10-2-4-11(5-3-10)15-29-16-14(19(31-15,20(23,24)25)21(26,27)28)17(33)30-18(34)32(16)13-8-6-12(22)7-9-13/h2-9H,1H3,(H,29,31)(H,30,33,34)	UVWNKIZDVOMCKS-UHFFFAOYSA-N	Cc1ccc(cc1)C2=NC3=C(C(=O)NC(=O)N3c4ccc(F)cc4)C(N2)(C(F)(F)F)C(F)(F)F	BroadT	BRD-K20419492	BRD-K20419492-001-05-7	InterBioScreen Ltd.	STOCK4S-57517			Cc1ccc(cc1)C1=Nc2c(c(=O)[nH]c(=O)n2-c2ccc(F)cc2)C(N1)(C(F)(F)F)C(F)(F)F	InChI=1S/C21H13F7N4O2/c1-10-2-4-11(5-3-10)15-29-16-14(19(31-15,20(23,24)25)21(26,27)28)17(33)30-18(34)32(16)13-8-6-12(22)7-9-13/h2-9H,1H3,(H,29,31)(H,30,33,34)	UVWNKIZDVOMCKS-UHFFFAOYSA-N	486.092673096							111205
MLS-0223293.0001	LSM-2872	BRD-K39522184, SID17506147, SID56373729, SID85147385	3301126	InChI=1S/C10H9N5O3/c1-6-4-7(2-3-8(6)15(17)18)9(16)13-10-11-5-12-14-10/h2-5H,1H3,(H2,11,12,13,14,16)	WHQDNDFEPCHKOL-UHFFFAOYSA-N	Cc1cc(ccc1[N+](=O)[O-])C(=O)Nc2nc[nH]n2	BroadT	BRD-K39522184	BRD-K39522184-001-05-0	Sanford-Burnham Medical Research Institute	3-methyl-4-nitro-N-4H-1,2,4-triazol-3-ylbenzamide MLS-0223293.0001			Cc1cc(ccc1[N+]([O-])=O)C(=O)Nc1nc[nH]n1	InChI=1S/C10H9N5O3/c1-6-4-7(2-3-8(6)15(17)18)9(16)13-10-11-5-12-14-10/h2-5H,1H3,(H2,11,12,13,14,16)	WHQDNDFEPCHKOL-UHFFFAOYSA-N	247.070539198							92692
MLS000082833	LSM-22662	SID864446, BRD-K97980211	665693	InChI=1S/C15H10N4O/c16-9-11-10(14-5-3-7-20-14)8-13(19-15(11)17)12-4-1-2-6-18-12/h1-8H,(H2,17,19)	IHOYDYCSMDRJDB-UHFFFAOYSA-N	Nc1nc(cc(c2occc2)c1C#N)c3ccccn3	BroadT	BRD-K97980211	BRD-K97980211-001-05-6	InterBioScreen Ltd.	STOCK5S-13415			Nc1nc(cc(-c2ccco2)c1C#N)-c1ccccn1	InChI=1S/C15H10N4O/c16-9-11-10(14-5-3-7-20-14)8-13(19-15(11)17)12-4-1-2-6-18-12/h1-8H,(H2,17,19)	IHOYDYCSMDRJDB-UHFFFAOYSA-N	262.08546098							111206
SMR000082849	LSM-22663	SID4241800, BRD-K07679495	1462928	InChI=1S/C17H19N3O4S/c1-23-13-7-6-10(8-14(13)24-2)18-15(21)9-25-17-19-12-5-3-4-11(12)16(22)20-17/h6-8H,3-5,9H2,1-2H3,(H,18,21)(H,19,20,22)	NRTYCXOOEJJVDJ-UHFFFAOYSA-N	COc1ccc(NC(=O)CSc2nc(O)c3CCCc3n2)cc1OC	BroadT	BRD-K07679495	BRD-K07679495-001-06-8	ChemDiv Inc.	C700-1370			COc1ccc(NC(=O)CSc2nc3CCCc3c(O)n2)cc1OC	InChI=1S/C17H19N3O4S/c1-23-13-7-6-10(8-14(13)24-2)18-15(21)9-25-17-19-12-5-3-4-11(12)16(22)20-17/h6-8H,3-5,9H2,1-2H3,(H,18,21)(H,19,20,22)	NRTYCXOOEJJVDJ-UHFFFAOYSA-N	361.109626808							111207
BAS 08208996	LSM-22664	SID849183, BRD-K16557457	651652	InChI=1S/C17H14N6OS/c1-10-5-6-12(16-22-23-11(2)20-21-17(23)25-16)8-14(10)19-15(24)13-4-3-7-18-9-13/h3-9H,1-2H3,(H,19,24)	JEBPWJIDFWWMKB-UHFFFAOYSA-N	Cc1ccc(cc1NC(=O)c2cccnc2)c3nn4c(C)nnc4s3	BroadT	BRD-K16557457	BRD-K16557457-001-05-3	Asinex Ltd.	BAS 08208996			Cc1nnc2sc(nn12)-c1ccc(C)c(NC(=O)c2cccnc2)c1	InChI=1S/C17H14N6OS/c1-10-5-6-12(16-22-23-11(2)20-21-17(23)25-16)8-14(10)19-15(24)13-4-3-7-18-9-13/h3-9H,1-2H3,(H,19,24)	JEBPWJIDFWWMKB-UHFFFAOYSA-N	350.094979818							111208
SMR000065947	LSM-22665	SID24840665, SID3715489, BRD-A04241199	2999233	InChI=1S/C25H30N2O5/c1-3-30-23-7-5-4-6-22(23)27-12-10-26(11-13-27)16-19(28)17-31-20-8-9-21-18(2)14-25(29)32-24(21)15-20/h4-9,14-15,19,28H,3,10-13,16-17H2,1-2H3	SRSKROFDORFLPK-UHFFFAOYSA-N	CCOc1ccccc1N2CCN(CC(O)COc3ccc4C(=CC(=O)Oc4c3)C)CC2	BroadT	BRD-A04241199	BRD-A04241199-001-05-3	Enamine Ltd.	T0506-1885			CCOc1ccccc1N1CCN(CC(O)COc2ccc3c(C)cc(=O)oc3c2)CC1	InChI=1S/C25H30N2O5/c1-3-30-23-7-5-4-6-22(23)27-12-10-26(11-13-27)16-19(28)17-31-20-8-9-21-18(2)14-25(29)32-24(21)15-20/h4-9,14-15,19,28H,3,10-13,16-17H2,1-2H3	SRSKROFDORFLPK-UHFFFAOYSA-N	438.21547208							111209
MLS000045008	LSM-22666	SID4249526, BRD-A27816330	3243470	InChI=1S/C15H19N3O3S/c1-19-12-6-10-11(7-13(12)20-2)17-15(22)18-14(10)16-8-9-4-3-5-21-9/h6-7,9H,3-5,8H2,1-2H3,(H2,16,17,18,22)	CTYSCOMGJSFQHS-UHFFFAOYSA-N	COc1cc2nc(S)nc(NCC3CCCO3)c2cc1OC	BroadT	BRD-A27816330	BRD-A27816330-001-05-5	ChemDiv Inc.	C431-0035			COc1cc2nc(S)nc(NCC3CCCO3)c2cc1OC	InChI=1S/C15H19N3O3S/c1-19-12-6-10-11(7-13(12)20-2)17-15(22)18-14(10)16-8-9-4-3-5-21-9/h6-7,9H,3-5,8H2,1-2H3,(H2,16,17,18,22)	CTYSCOMGJSFQHS-UHFFFAOYSA-N	321.114712188							111210
MLS000850549	LSM-22667	SID26727024, BRD-K11155173	2819065	InChI=1S/C12H11N3O2S/c1-17-7-8-5-12(16)15-11(13-8)6-9(14-15)10-3-2-4-18-10/h2-6,16H,7H2,1H3	NPQDGZIAFNUKLK-UHFFFAOYSA-N	COCc1cc(O)n2nc(cc2n1)c3cccs3	BroadT	BRD-K11155173	BRD-K11155173-001-06-2	Maybridge	KM 00733			COCc1cc(O)n2nc(cc2n1)-c1cccs1	InChI=1S/C12H11N3O2S/c1-17-7-8-5-12(16)15-11(13-8)6-9(14-15)10-3-2-4-18-10/h2-6,16H,7H2,1H3	NPQDGZIAFNUKLK-UHFFFAOYSA-N	261.057197312							
F3222-2346	LSM-22668	SID14740538, BRD-K97256497	2229765	InChI=1S/C20H16N4O3S/c1-26-15-9-7-14(8-10-15)19-23-18(27-24-19)12-28-20-21-16(11-17(25)22-20)13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,21,22,25)	OKRBGIJXAFJLOR-UHFFFAOYSA-N	COc1ccc(cc1)c2noc(CSc3nc(O)cc(n3)c4ccccc4)n2	BroadT	BRD-K97256497	BRD-K97256497-001-06-4	ChemBridge Corporation	7961808			COc1ccc(cc1)-c1noc(CSc2nc(O)cc(n2)-c2ccccc2)n1	InChI=1S/C20H16N4O3S/c1-26-15-9-7-14(8-10-15)19-23-18(27-24-19)12-28-20-21-16(11-17(25)22-20)13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,21,22,25)	OKRBGIJXAFJLOR-UHFFFAOYSA-N	392.094311102							111212
MLS000054247	LSM-22669	SID3711884, BRD-K53353232	2997803	InChI=1S/C13H12N2S2/c1-2-4-11(5-3-1)9-16-10-12-8-15-6-7-17-13(15)14-12/h1-8H,9-10H2	GVBXFVDONRZCQG-UHFFFAOYSA-N	C(SCc1cn2ccsc2n1)c3ccccc3	BroadT	BRD-K53353232	BRD-K53353232-001-06-1	Enamine Ltd.	T0507-7724			C(SCc1ccccc1)c1cn2ccsc2n1	InChI=1S/C13H12N2S2/c1-2-4-11(5-3-1)9-16-10-12-8-15-6-7-17-13(15)14-12/h1-8H,9-10H2	GVBXFVDONRZCQG-UHFFFAOYSA-N	260.044189784							111213
STK562632	LSM-22670	SID49643939, BRD-K73843769	3151055	InChI=1S/C14H21N5O3/c1-3-22-9-8-19-10-11(17(2)14(21)16-12(10)20)15-13(19)18-6-4-5-7-18/h3-9H2,1-2H3,(H,16,20,21)	BIIKJSCRZKWBPK-UHFFFAOYSA-N	CCOCCn1c(nc2N(C)C(=O)NC(=O)c12)N3CCCC3	BroadT	BRD-K73843769	BRD-K73843769-001-05-0	Asinex Ltd.	BAS 04914629			CCOCCn1c(nc2n(C)c(=O)[nH]c(=O)c12)N1CCCC1	InChI=1S/C14H21N5O3/c1-3-22-9-8-19-10-11(17(2)14(21)16-12(10)20)15-13(19)18-6-4-5-7-18/h3-9H2,1-2H3,(H,16,20,21)	BIIKJSCRZKWBPK-UHFFFAOYSA-N	307.164439582							111214
AC1O9IXS	LSM-22671	BRD-K65612225	6759598	InChI=1S/C19H20ClN3O4S/c20-16-6-9-18(24)15(12-16)13-21-22-19(25)14-4-7-17(8-5-14)28(26,27)23-10-2-1-3-11-23/h4-9,12-13,24H,1-3,10-11H2,(H,22,25)	RVUJQYRYUXXFNM-UHFFFAOYSA-N	Oc1ccc(Cl)cc1C=NNC(=O)c2ccc(cc2)S(=O)(=O)N3CCCCC3	BroadT	BRD-K65612225	BRD-K65612225-001-09-9	ChemBridge Corporation	5217961			Oc1ccc(Cl)cc1C=NNC(=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1	InChI=1S/C19H20ClN3O4S/c20-16-6-9-18(24)15(12-16)13-21-22-19(25)14-4-7-17(8-5-14)28(26,27)23-10-2-1-3-11-23/h4-9,12-13,24H,1-3,10-11H2,(H,22,25)	RVUJQYRYUXXFNM-UHFFFAOYSA-N	421.08630455							
CID 25895985	LSM-22672	BRD-A49529277	25895985	InChI=1S/C16H16N6O2S/c1-2-7-22-15(24)20-21-16(22)25-9-13(23)10(8-17)14-18-11-5-3-4-6-12(11)19-14/h3-6,10H,2,7,9H2,1H3,(H,18,19)(H,20,24)	OKYCUCTZZXQGFP-UHFFFAOYSA-N	CCCn1c(O)nnc1SCC(=O)C(C#N)c2nc3ccccc3[nH]2	BroadT	BRD-A49529277	BRD-A49529277-001-05-3	Enamine Ltd.	T5216950			CCCn1c(O)nnc1SCC(=O)C(C#N)c1nc2ccccc2[nH]1	InChI=1S/C16H16N6O2S/c1-2-7-22-15(24)20-21-16(22)25-9-13(23)10(8-17)14-18-11-5-3-4-6-12(11)19-14/h3-6,10H,2,7,9H2,1H3,(H,18,19)(H,20,24)	OKYCUCTZZXQGFP-UHFFFAOYSA-N	356.105544502							111216
MLS000394757	LSM-22673	SID22409389, BRD-K14456180	4832851	InChI=1S/C20H25N3O3S2/c1-15-6-7-17(14-19(15)28(24,25)23-12-4-3-5-13-23)22-20(27)21-16-8-10-18(26-2)11-9-16/h6-11,14H,3-5,12-13H2,1-2H3,(H2,21,22,27)	GXXHYOHYGSDGIM-UHFFFAOYSA-N	COc1ccc(NC(=Nc2ccc(C)c(c2)S(=O)(=O)N3CCCCC3)S)cc1	BroadT	BRD-K14456180	BRD-K14456180-001-04-7	Enamine Ltd.	T5298484			COc1ccc(NC(S)=Nc2ccc(C)c(c2)S(=O)(=O)N2CCCCC2)cc1	InChI=1S/C20H25N3O3S2/c1-15-6-7-17(14-19(15)28(24,25)23-12-4-3-5-13-23)22-20(27)21-16-8-10-18(26-2)11-9-16/h6-11,14H,3-5,12-13H2,1-2H3,(H2,21,22,27)	GXXHYOHYGSDGIM-UHFFFAOYSA-N	419.13373307							111217
AC1MDQUU	LSM-22674	BRD-K79304807	2841377	InChI=1S/C10H9N7O3/c11-9(8-10(12)16-20-15-8)14-13-5-6-1-3-7(4-2-6)17(18)19/h1-5H,(H2,11,14)(H2,12,16)	FHMGFNBZNMKHGW-UHFFFAOYSA-N	NC(=NN=Cc1ccc(cc1)[N+](=O)[O-])c2nonc2N	BroadT	BRD-K79304807	BRD-K79304807-001-05-1	InterBioScreen Ltd.	STOCK1S-03464			NC(=NN=Cc1ccc(cc1)[N+]([O-])=O)c1nonc1N	InChI=1S/C10H9N7O3/c11-9(8-10(12)16-20-15-8)14-13-5-6-1-3-7(4-2-6)17(18)19/h1-5H,(H2,11,14)(H2,12,16)	FHMGFNBZNMKHGW-UHFFFAOYSA-N	275.076687218							111218
2-[(4-Chlorobenzyl)oxy]-6-methoxybenzonitrile	LSM-22675	SID26729701, BRD-K35083610	2824435	InChI=1S/C15H12ClNO2/c1-18-14-3-2-4-15(13(14)9-17)19-10-11-5-7-12(16)8-6-11/h2-8H,10H2,1H3	GOYLMWYDYSHDDL-UHFFFAOYSA-N	COc1cccc(OCc2ccc(Cl)cc2)c1C#N	BroadT	BRD-K35083610	BRD-K35083610-001-06-9	Maybridge	MWP 00986			COc1cccc(OCc2ccc(Cl)cc2)c1C#N	InChI=1S/C15H12ClNO2/c1-18-14-3-2-4-15(13(14)9-17)19-10-11-5-7-12(16)8-6-11/h2-8H,10H2,1H3	GOYLMWYDYSHDDL-UHFFFAOYSA-N	273.055656344							111219
1-Cyclopentyl-3-(4-phenoxyphenyl)thiourea	LSM-22676	SID17506511, BRD-K18822362	892293	InChI=1S/C18H20N2OS/c22-18(19-14-6-4-5-7-14)20-15-10-12-17(13-11-15)21-16-8-2-1-3-9-16/h1-3,8-14H,4-7H2,(H2,19,20,22)	QGDOGIHWGNKHTG-UHFFFAOYSA-N	S=C(NC1CCCC1)Nc2ccc(Oc3ccccc3)cc2	BroadT	BRD-K18822362	BRD-K18822362-001-05-3	ChemBridge Corporation	7527078			S=C(NC1CCCC1)Nc1ccc(Oc2ccccc2)cc1	InChI=1S/C18H20N2OS/c22-18(19-14-6-4-5-7-14)20-15-10-12-17(13-11-15)21-16-8-2-1-3-9-16/h1-3,8-14H,4-7H2,(H2,19,20,22)	QGDOGIHWGNKHTG-UHFFFAOYSA-N	312.12963397							111220
SMR000171735	LSM-22677	SID17506037, BRD-K24766052	2262121	InChI=1S/C23H23ClN2O3S2/c1-26(31(28,29)22-5-3-2-4-6-22)21-13-9-19(10-14-21)23(27)25-15-16-30-17-18-7-11-20(24)12-8-18/h2-14H,15-17H2,1H3,(H,25,27)	XUUBMSFXUIFJBX-UHFFFAOYSA-N	CN(c1ccc(cc1)C(=O)NCCSCc2ccc(Cl)cc2)S(=O)(=O)c3ccccc3	BroadT	BRD-K24766052	BRD-K24766052-001-05-9	Asinex Ltd.	BAS 00845831			CN(c1ccc(cc1)C(=O)NCCSCc1ccc(Cl)cc1)S(=O)(=O)c1ccccc1	InChI=1S/C23H23ClN2O3S2/c1-26(31(28,29)22-5-3-2-4-6-22)21-13-9-19(10-14-21)23(27)25-15-16-30-17-18-7-11-20(24)12-8-18/h2-14H,15-17H2,1H3,(H,25,27)	XUUBMSFXUIFJBX-UHFFFAOYSA-N	474.083861706							111221
ZINC02861394	LSM-22678	SID24805772, SID92708295, BRD-K66309573	2214684	InChI=1S/C17H19N3O3S2/c1-20(2)25(22,23)15-10-8-14(9-11-15)18-17(24)19-16(21)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H2,18,19,21,24)	KAHBTDGMUYLGIF-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1	BroadT	BRD-K66309573	BRD-K66309573-001-08-1	ChemBridge Corporation	7863089			CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)Cc2ccccc2)cc1	InChI=1S/C17H19N3O3S2/c1-20(2)25(22,23)15-10-8-14(9-11-15)18-17(24)19-16(21)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H2,18,19,21,24)	KAHBTDGMUYLGIF-UHFFFAOYSA-N	377.086782878							111222
CHEMBL162808	LSM-22679	SID24826288, BRD-K20125842	2539471	InChI=1S/C14H15N3OS/c18-13(10-5-1-2-6-10)17-14-16-12(9-19-14)11-7-3-4-8-15-11/h3-4,7-10H,1-2,5-6H2,(H,16,17,18)	BYRRVQLSJUPHPO-UHFFFAOYSA-N	O=C(Nc1nc(cs1)c2ccccn2)C3CCCC3	BroadT	BRD-K20125842	BRD-K20125842-001-05-7	Enamine Ltd.	T5337644			O=C(Nc1nc(cs1)-c1ccccn1)C1CCCC1	InChI=1S/C14H15N3OS/c18-13(10-5-1-2-6-10)17-14-16-12(9-19-14)11-7-3-4-8-15-11/h3-4,7-10H,1-2,5-6H2,(H,16,17,18)	BYRRVQLSJUPHPO-UHFFFAOYSA-N	273.09358282							111223
5-[(3-Chlorophenyl)amino]-1,3,4-thiadiazole-2-thiol	LSM-22680	SID24831550, BRD-K01031165	4962085	InChI=1S/C8H6ClN3S2/c9-5-2-1-3-6(4-5)10-7-11-12-8(13)14-7/h1-4H,(H,10,11)(H,12,13)	SWLINHYKFUPWGE-UHFFFAOYSA-N	Sc1nnc(Nc2cccc(Cl)c2)s1	BroadT	BRD-K01031165	BRD-K01031165-001-05-9	Enamine Ltd.	T5342880			Sc1nnc(Nc2cccc(Cl)c2)s1	InChI=1S/C8H6ClN3S2/c9-5-2-1-3-6(4-5)10-7-11-12-8(13)14-7/h1-4H,(H,10,11)(H,12,13)	SWLINHYKFUPWGE-UHFFFAOYSA-N	242.969166312							111224
SMR000063845	LSM-22681	SID3712558, BRD-K93232859	2125695	InChI=1S/C21H16N6OS2/c28-20-16-9-4-5-10-17(16)22-25-27(20)14-30-21-24-23-19(18-11-6-12-29-18)26(21)13-15-7-2-1-3-8-15/h1-12H,13-14H2	JAJRLWYJKXCGAY-UHFFFAOYSA-N	O=C1N(CSc2nnc(c3cccs3)n2Cc4ccccc4)N=Nc5ccccc15	BroadT	BRD-K93232859	BRD-K93232859-001-05-3	Enamine Ltd.	T5253477			O=c1n(CSc2nnc(-c3cccs3)n2Cc2ccccc2)nnc2ccccc12	InChI=1S/C21H16N6OS2/c28-20-16-9-4-5-10-17(16)22-25-27(20)14-30-21-24-23-19(18-11-6-12-29-18)26(21)13-15-7-2-1-3-8-15/h1-12H,13-14H2	JAJRLWYJKXCGAY-UHFFFAOYSA-N	432.082700572							111225
MLS000417979	LSM-15339	BRD-K52285668	4883936	InChI=1S/C20H20N2O/c1-15-14-20(21-19-5-3-2-4-18(15)19)16-6-8-17(9-7-16)22-10-12-23-13-11-22/h2-9,14H,10-13H2,1H3	XGSZPPXEIDZEMS-UHFFFAOYSA-N	Cc1cc(nc2ccccc12)c3ccc(cc3)N4CCOCC4	BroadT	BRD-K52285668	BRD-K52285668-003-05-7	Enamine Ltd.	T5332908		Cl	Cc1cc(nc2ccccc12)-c1ccc(cc1)N1CCOCC1.Cl	InChI=1S/C20H20N2O.ClH/c1-15-14-20(21-19-5-3-2-4-18(15)19)16-6-8-17(9-7-16)22-10-12-23-13-11-22;/h2-9,14H,10-13H2,1H3;1H	WWIVBRNQHDBBKB-UHFFFAOYSA-N	304.15756328							103984, 103984
8-[2-(4-Chloro-2,5-dimethylphenoxy)ethoxy]quinoline	LSM-22682	SID14738754, BRD-K69136754	2284632	InChI=1S/C19H18ClNO2/c1-13-12-18(14(2)11-16(13)20)23-10-9-22-17-7-3-5-15-6-4-8-21-19(15)17/h3-8,11-12H,9-10H2,1-2H3	UHZNJMPEZDPXFV-UHFFFAOYSA-N	Cc1cc(OCCOc2cccc3cccnc23)c(C)cc1Cl	BroadT	BRD-K69136754	BRD-K69136754-001-05-2	ChemBridge Corporation	6463772			Cc1cc(OCCOc2cccc3cccnc23)c(C)cc1Cl	InChI=1S/C19H18ClNO2/c1-13-12-18(14(2)11-16(13)20)23-10-9-22-17-7-3-5-15-6-4-8-21-19(15)17/h3-8,11-12H,9-10H2,1-2H3	UHZNJMPEZDPXFV-UHFFFAOYSA-N	327.102606536							111226
SMR000063691	LSM-22683	SID3713763, BRD-K69849083	2998538	InChI=1S/C16H14ClN3O3/c1-2-22-15-13(4-3-7-18-15)16(21)23-10-12-9-20-8-11(17)5-6-14(20)19-12/h3-9H,2,10H2,1H3	NKRNVINSQXBVMV-UHFFFAOYSA-N	CCOc1ncccc1C(=O)OCc2cn3cc(Cl)ccc3n2	BroadT	BRD-K69849083	BRD-K69849083-001-05-2	Enamine Ltd.	T5250041			CCOc1ncccc1C(=O)OCc1cn2cc(Cl)ccc2n1	InChI=1S/C16H14ClN3O3/c1-2-22-15-13(4-3-7-18-15)16(21)23-10-12-9-20-8-11(17)5-6-14(20)19-12/h3-9H,2,10H2,1H3	NKRNVINSQXBVMV-UHFFFAOYSA-N	331.072369048							111227
T0518-3563	LSM-22684	SID16952437, BRD-K86681028	2456084	InChI=1S/C21H17Cl2N3O7/c1-30-16-7-12(14(8-17(16)31-2)25-20(28)15-4-3-5-32-15)21(29)33-10-18(27)26-19-13(23)6-11(22)9-24-19/h3-9H,10H2,1-2H3,(H,25,28)(H,24,26,27)	DDBCUKBFZYQEJK-UHFFFAOYSA-N	COc1cc(NC(=O)c2occc2)c(cc1OC)C(=O)OCC(=O)Nc3ncc(Cl)cc3Cl	BroadT	BRD-K86681028	BRD-K86681028-001-05-6	Enamine Ltd.	T0518-3563			COc1cc(NC(=O)c2ccco2)c(cc1OC)C(=O)OCC(=O)Nc1ncc(Cl)cc1Cl	InChI=1S/C21H17Cl2N3O7/c1-30-16-7-12(14(8-17(16)31-2)25-20(28)15-4-3-5-32-15)21(29)33-10-18(27)26-19-13(23)6-11(22)9-24-19/h3-9H,10H2,1-2H3,(H,25,28)(H,24,26,27)	DDBCUKBFZYQEJK-UHFFFAOYSA-N	493.044355334							111228
MLS000705911	LSM-22685	SID22405002, BRD-K69420228	4196042	InChI=1S/C14H14N4OS/c1-8-4-5-11(6-9(8)2)18-13(15-16-14(18)20)12-7-10(3)19-17-12/h4-7H,1-3H3,(H,16,20)	MAUONHAEARXFHE-UHFFFAOYSA-N	Cc1onc(c1)c2nnc(S)n2c3ccc(C)c(C)c3	BroadT	BRD-K69420228	BRD-K69420228-001-06-6	Specs	AP-391/41079181			Cc1cc(no1)-c1nnc(S)n1-c1ccc(C)c(C)c1	InChI=1S/C14H14N4OS/c1-8-4-5-11(6-9(8)2)18-13(15-16-14(18)20)12-7-10(3)19-17-12/h4-7H,1-3H3,(H,16,20)	MAUONHAEARXFHE-UHFFFAOYSA-N	286.088831798							111229
AC1M0DM0	LSM-22686	BRD-K79021766	1973423	InChI=1S/C23H20N4O4/c1-30-22(29)14-27-13-17(18-8-2-3-9-19(18)27)12-25-26-21(28)15-31-20-10-4-6-16-7-5-11-24-23(16)20/h2-13H,14-15H2,1H3,(H,26,28)	YMWPUFARMXBPQC-UHFFFAOYSA-N	COC(=O)Cn1cc(C=NNC(=O)COc2cccc3cccnc23)c4ccccc14	BroadT	BRD-K79021766	BRD-K79021766-001-05-0	InterBioScreen Ltd.	STOCK4S-16536			COC(=O)Cn1cc(C=NNC(=O)COc2cccc3cccnc23)c2ccccc12	InChI=1S/C23H20N4O4/c1-30-22(29)14-27-13-17(18-8-2-3-9-19(18)27)12-25-26-21(28)15-31-20-10-4-6-16-7-5-11-24-23(16)20/h2-13H,14-15H2,1H3,(H,26,28)	YMWPUFARMXBPQC-UHFFFAOYSA-N	416.14845516							111230
MLS000031960	LSM-22687	SID844039, BRD-A92317048	646349	InChI=1S/C26H32N6O3/c1-17(2)24(25-28-29-30-32(25)16-22-10-6-12-35-22)31(15-21-9-5-11-34-21)14-20-13-19-8-4-7-18(3)23(19)27-26(20)33/h4,6-8,10,12-13,17,21,24H,5,9,11,14-16H2,1-3H3,(H,27,33)	LRBIOTSODMGLHL-UHFFFAOYSA-N	CC(C)C(N(CC1CCCO1)Cc2cc3cccc(C)c3nc2O)c4nnnn4Cc5occc5	BroadT	BRD-A92317048	BRD-A92317048-001-05-7	Asinex Ltd.	ASN 05387250			CC(C)C(N(CC1CCCO1)Cc1cc2cccc(C)c2nc1O)c1nnnn1Cc1ccco1	InChI=1S/C26H32N6O3/c1-17(2)24(25-28-29-30-32(25)16-22-10-6-12-35-22)31(15-21-9-5-11-34-21)14-20-13-19-8-4-7-18(3)23(19)27-26(20)33/h4,6-8,10,12-13,17,21,24H,5,9,11,14-16H2,1-3H3,(H,27,33)	LRBIOTSODMGLHL-UHFFFAOYSA-N	476.253588944							111231
AC1N7OUU	LSM-22688	SID26663540, BRD-K99758956	4282663	InChI=1S/C20H26N4S2/c1-4-5-9-15-13-7-6-8-14(13)16-17-18(26-19(16)23-15)20(22-12-21-17)25-11-10-24(2)3/h12H,4-11H2,1-3H3	QSWCNAHQOVQMEL-UHFFFAOYSA-N	CCCCc1nc2sc3c(SCCN(C)C)ncnc3c2c4CCCc14	BroadT	BRD-K99758956	BRD-K99758956-001-05-3	InterBioScreen Ltd.	STOCK4S-76791			CCCCc1nc2sc3c(SCCN(C)C)ncnc3c2c2CCCc12	InChI=1S/C20H26N4S2/c1-4-5-9-15-13-7-6-8-14(13)16-17-18(26-19(16)23-15)20(22-12-21-17)25-11-10-24(2)3/h12H,4-11H2,1-3H3	QSWCNAHQOVQMEL-UHFFFAOYSA-N	386.159888252							111232
MLS000043790	LSM-22689	SID4249461, BRD-K50759075	1201743	InChI=1S/C19H20O7/c1-22-15-7-5-12(9-17(15)24-3)14(20)11-26-19(21)13-6-8-16(23-2)18(10-13)25-4/h5-10H,11H2,1-4H3	XDZZNXXRZYKSGM-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)COC(=O)c2ccc(OC)c(OC)c2	BroadT	BRD-K50759075	BRD-K50759075-001-05-4	ChemDiv Inc.	8011-7951			COc1ccc(cc1OC)C(=O)COC(=O)c1ccc(OC)c(OC)c1	InChI=1S/C19H20O7/c1-22-15-7-5-12(9-17(15)24-3)14(20)11-26-19(21)13-6-8-16(23-2)18(10-13)25-4/h5-10H,11H2,1-4H3	XDZZNXXRZYKSGM-UHFFFAOYSA-N	360.12090298							111233
MLS000418020	LSM-22690	SID22409275, BRD-A03250038	3977521	InChI=1S/C23H20ClN3O4/c1-14-7-10-18(13-19(14)24)26-21(28)20(15-5-3-2-4-6-15)31-22(29)16-8-11-17(12-9-16)27-23(25)30/h2-13,20H,1H3,(H,26,28)(H3,25,27,30)	QHHAGKKNDWKSAB-UHFFFAOYSA-N	Cc1ccc(NC(=O)C(OC(=O)c2ccc(NC(=O)N)cc2)c3ccccc3)cc1Cl	BroadT	BRD-A03250038	BRD-A03250038-001-06-8	Enamine Ltd.	T0520-3686			Cc1ccc(NC(=O)C(OC(=O)c2ccc(NC(N)=O)cc2)c2ccccc2)cc1Cl	InChI=1S/C23H20ClN3O4/c1-14-7-10-18(13-19(14)24)26-21(28)20(15-5-3-2-4-6-15)31-22(29)16-8-11-17(12-9-16)27-23(25)30/h2-13,20H,1H3,(H,26,28)(H3,25,27,30)	QHHAGKKNDWKSAB-UHFFFAOYSA-N	437.11423386							111234
AC1NS1T0	LSM-22691	SID49714247, BRD-K51293705	5302177	InChI=1S/C17H17N3O3S/c21-17-14-12-13(24(22,23)19-9-3-1-4-10-19)7-8-15(14)20-11-5-2-6-16(20)18-17/h2,5-8,11-12H,1,3-4,9-10H2	IFESYHLZBRFKIF-UHFFFAOYSA-N	O=C1N=C2C=CC=CN2c3ccc(cc13)S(=O)(=O)N4CCCCC4	BroadT	BRD-K51293705	BRD-K51293705-001-05-1	ChemDiv Inc.	8017-9130			O=c1nc2ccccn2c2ccc(cc12)S(=O)(=O)N1CCCCC1	InChI=1S/C17H17N3O3S/c21-17-14-12-13(24(22,23)19-9-3-1-4-10-19)7-8-15(14)20-11-5-2-6-16(20)18-17/h2,5-8,11-12H,1,3-4,9-10H2	IFESYHLZBRFKIF-UHFFFAOYSA-N	343.099062124							111235
ST069205	LSM-22692	SID17511318, BRD-K57631144	5293145	InChI=1S/C17H23ClN2O5S/c18-14-6-8-15(9-7-14)25-26(22,23)19-17(21)24-12-13-4-3-11-20-10-2-1-5-16(13)20/h6-9,13,16H,1-5,10-12H2,(H,19,21)/t13-,16+/m0/s1	MZLRSFBNYSKEPU-XJKSGUPXSA-N	Clc1ccc(OS(=O)(=O)NC(=O)OC[C@@H]2CCCN3CCCC[C@H]23)cc1	BroadT	BRD-K57631144	BRD-K57631144-001-05-5	ChemDiv Inc.	8013-6314			Clc1ccc(OS(=O)(=O)NC(=O)OC[C@@H]2CCCN3CCCC[C@H]23)cc1	InChI=1S/C17H23ClN2O5S/c18-14-6-8-15(9-7-14)25-26(22,23)19-17(21)24-12-13-4-3-11-20-10-2-1-5-16(13)20/h6-9,13,16H,1-5,10-12H2,(H,19,21)/t13-,16+/m0/s1	MZLRSFBNYSKEPU-XJKSGUPXSA-N	402.101620256							111236
MLS000737207	LSM-22693	SID26664652, BRD-A77680104	3289174	InChI=1S/C14H21N5OS2/c1-4-19-7-5-6-9(8-19)22-13-15-10-11(16-13)17(2)14(20)18(3)12(10)21/h9H,4-8H2,1-3H3,(H,15,16)	APLDNAXBEDLBDA-UHFFFAOYSA-N	CCN1CCCC(C1)Sc2nc3C(=S)N(C)C(=O)N(C)c3[nH]2	BroadT	BRD-A77680104	BRD-A77680104-001-05-8	National Cancer Institute Chemotherapeutic Agents Repository	99660			CCN1CCCC(C1)Sc1nc2c([nH]1)n(C)c(=O)n(C)c2=S	InChI=1S/C14H21N5OS2/c1-4-19-7-5-6-9(8-19)22-13-15-10-11(16-13)17(2)14(20)18(3)12(10)21/h9H,4-8H2,1-3H3,(H,15,16)	APLDNAXBEDLBDA-UHFFFAOYSA-N	339.118751722							111237
2-Naphthalenol, [(phenylimino)methyl]-	LSM-22694	BRD-K98456486	5381159	InChI=1S/C17H13NO/c19-17-11-10-13-6-4-5-9-15(13)16(17)12-18-14-7-2-1-3-8-14/h1-12,19H	MUFLFHJOVXSNBI-UHFFFAOYSA-N	Oc1ccc2ccccc2c1C=Nc3ccccc3	BroadT	BRD-K98456486	BRD-K98456486-001-05-4	National Cancer Institute Chemotherapeutic Agents Repository	111846			Oc1ccc2ccccc2c1C=Nc1ccccc1	InChI=1S/C17H13NO/c19-17-11-10-13-6-4-5-9-15(13)16(17)12-18-14-7-2-1-3-8-14/h1-12,19H	MUFLFHJOVXSNBI-UHFFFAOYSA-N	247.099714046							
AG-690/11452024	LSM-22695	SID4241873, BRD-A55669276	3236789	InChI=1S/C16H19NO5/c1-22-16(21)12-8-4-5-9-13(12)17-14(18)10-6-2-3-7-11(10)15(19)20/h4-5,8-11H,2-3,6-7H2,1H3,(H,17,18)(H,19,20)	DEAVWQSRBJQFEW-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)C2CCCCC2C(=O)O	BroadT	BRD-A55669276	BRD-A55669276-001-06-7	ChemDiv Inc.	K603-0387			COC(=O)c1ccccc1NC(=O)C1CCCCC1C(O)=O	InChI=1S/C16H19NO5/c1-22-16(21)12-8-4-5-9-13(12)17-14(18)10-6-2-3-7-11(10)15(19)20/h4-5,8-11H,2-3,6-7H2,1H3,(H,17,18)(H,19,20)	DEAVWQSRBJQFEW-UHFFFAOYSA-N	305.126322718							111239
MLS000029458	LSM-22696	SID847255, SID85302346, BRD-K13046807	649654	InChI=1S/C13H20N4O5S/c1-3-5-6-22-9(18)7-14-11-12(20)15-13(17-16-11)23-8-10(19)21-4-2/h3-8H2,1-2H3,(H,14,16)(H,15,17,20)	KQVIFQDYXITVCY-UHFFFAOYSA-N	CCCCOC(=O)CNc1nnc(SCC(=O)OCC)nc1O	BroadT	BRD-K13046807	BRD-K13046807-001-06-5	Asinex Ltd.	BAS 00841169			CCCCOC(=O)CNc1nnc(SCC(=O)OCC)nc1O	InChI=1S/C13H20N4O5S/c1-3-5-6-22-9(18)7-14-11-12(20)15-13(17-16-11)23-8-10(19)21-4-2/h3-8H2,1-2H3,(H,14,16)(H,15,17,20)	KQVIFQDYXITVCY-UHFFFAOYSA-N	344.11544047							111240
SMR000218646	LSM-43973	SID17503772, BRD-K90142941	1227448	InChI=1S/C19H10F3NO4/c20-19(21,22)12-4-1-3-11(9-12)15-7-6-13(26-15)10-14-18(24)27-17(23-14)16-5-2-8-25-16/h1-10H/b14-10-	ZNSQBTBEQOALTN-UVTDQMKNSA-N	FC(F)(F)c1cccc(c1)c2oc(\C=C\3/N=C(OC3=O)c4occc4)cc2	BroadT	BRD-K90142941	BRD-K90142941-001-05-7	InterBioScreen Ltd.	STOCK2S-54840			FC(F)(F)c1cccc(c1)-c1ccc(\C=C2/N=C(OC2=O)c2ccco2)o1	InChI=1S/C19H10F3NO4/c20-19(21,22)12-4-1-3-11(9-12)15-7-6-13(26-15)10-14-18(24)27-17(23-14)16-5-2-8-25-16/h1-10H/b14-10-	ZNSQBTBEQOALTN-UVTDQMKNSA-N	373.05619241							
MLS000703257	LSM-43974	SID24780704, BRD-K63608008	5511401	InChI=1S/C17H11N3O4S2/c21-15-13(11-8-4-5-9-12(11)18-15)14-16(22)19-17(25-14)20-26(23,24)10-6-2-1-3-7-10/h1-9H,(H,18,21)(H,19,20,22)/b14-13-	QFUSEKPMUWRICY-YPKPFQOOSA-N	O=C1Nc2ccccc2/C/1=C\3/SC(=NC3=O)NS(=O)(=O)c4ccccc4	BroadT	BRD-K63608008	BRD-K63608008-001-06-8	Asinex Ltd.	BAS 01267333			O=C1Nc2ccccc2\C1=C1\SC(NS(=O)(=O)c2ccccc2)=NC1=O	InChI=1S/C17H11N3O4S2/c21-15-13(11-8-4-5-9-12(11)18-15)14-16(22)19-17(25-14)20-26(23,24)10-6-2-1-3-7-10/h1-9H,(H,18,21)(H,19,20,22)/b14-13-	QFUSEKPMUWRICY-YPKPFQOOSA-N	385.019097242							
ZINC00468547	LSM-22699	SID4255818, BRD-K23400629	892552	InChI=1S/C19H12N2O5/c22-17-14-7-6-13(10-15(14)18(23)21-17)26-12-4-1-3-11(9-12)20-19(24)16-5-2-8-25-16/h1-10H,(H,20,24)(H,21,22,23)	KSHMRKKHUPYEKG-UHFFFAOYSA-N	O=C(Nc1cccc(Oc2ccc3C(=O)NC(=O)c3c2)c1)c4occc4	BroadT	BRD-K23400629	BRD-K23400629-001-05-0	ChemBridge Corporation	7544117			O=C(Nc1cccc(Oc2ccc3C(=O)NC(=O)c3c2)c1)c1ccco1	InChI=1S/C19H12N2O5/c22-17-14-7-6-13(10-15(14)18(23)21-17)26-12-4-1-3-11(9-12)20-19(24)16-5-2-8-25-16/h1-10H,(H,20,24)(H,21,22,23)	KSHMRKKHUPYEKG-UHFFFAOYSA-N	348.074621504							111243
F2004-0162	LSM-22700	SID24815657, BRD-K21166090	7207258	InChI=1S/C15H11BrN2OS/c16-12-5-3-11(4-6-12)10-20-15-8-7-13(17-18-15)14-2-1-9-19-14/h1-9H,10H2	GHTDIOSUORRDJH-UHFFFAOYSA-N	Brc1ccc(CSc2ccc(nn2)c3occc3)cc1	BroadT	BRD-K21166090	BRD-K21166090-001-06-7	Life Chemicals Inc.	F2004-0162			Brc1ccc(CSc2ccc(nn2)-c2ccco2)cc1	InChI=1S/C15H11BrN2OS/c16-12-5-3-11(4-6-12)10-20-15-8-7-13(17-18-15)14-2-1-9-19-14/h1-9H,10H2	GHTDIOSUORRDJH-UHFFFAOYSA-N	345.977546282							111244
Dimethyl 2-[(phenoxycarbonyl)amino]terephthalate	LSM-22701	SID17433068, BRD-K12902456	728111	InChI=1S/C17H15NO6/c1-22-15(19)11-8-9-13(16(20)23-2)14(10-11)18-17(21)24-12-6-4-3-5-7-12/h3-10H,1-2H3,(H,18,21)	JYLOVBIKEYPSER-UHFFFAOYSA-N	COC(=O)c1ccc(C(=O)OC)c(NC(=O)Oc2ccccc2)c1	BroadT	BRD-K12902456	BRD-K12902456-001-05-6	ChemBridge Corporation	7930983			COC(=O)c1ccc(C(=O)OC)c(NC(=O)Oc2ccccc2)c1	InChI=1S/C17H15NO6/c1-22-15(19)11-8-9-13(16(20)23-2)14(10-11)18-17(21)24-12-6-4-3-5-7-12/h3-10H,1-2H3,(H,18,21)	JYLOVBIKEYPSER-UHFFFAOYSA-N	329.08993721							111245
SMR000041742	LSM-22702	SID859708, BRD-K45048983	661014	InChI=1S/C23H23N5O2/c1-4-25-22(29)17-12-18-21(26-20-15(3)6-5-11-27(20)23(18)30)28(19(17)24)13-16-9-7-14(2)8-10-16/h5-12,24H,4,13H2,1-3H3,(H,25,29)	PWIFMPSYRGQJEE-UHFFFAOYSA-N	CCNC(=O)C1=CC2=C(N=C3N(C=CC=C3C)C2=O)N(Cc4ccc(C)cc4)C1=N	BroadT	BRD-K45048983	BRD-K45048983-001-06-9	InterBioScreen Ltd.	STOCK3S-33333			CCNC(=O)c1cc2c(nc3c(C)cccn3c2=O)n(Cc2ccc(C)cc2)c1=N	InChI=1S/C23H23N5O2/c1-4-25-22(29)17-12-18-21(26-20-15(3)6-5-11-27(20)23(18)30)28(19(17)24)13-16-9-7-14(2)8-10-16/h5-12,24H,4,13H2,1-3H3,(H,25,29)	PWIFMPSYRGQJEE-UHFFFAOYSA-N	401.185175026							111246
AC1LV9PT	LSM-22703	BRD-K60029169	1679466	InChI=1S/C16H16N4O2/c21-15(19-14-4-2-1-3-5-14)6-7-16(22)20-18-12-13-8-10-17-11-9-13/h1-5,8-12H,6-7H2,(H,19,21)(H,20,22)	DROBBAOUJNKWAZ-UHFFFAOYSA-N	O=C(CCC(=O)Nc1ccccc1)NN=Cc2ccncc2	BroadT	BRD-K60029169	BRD-K60029169-001-06-5	ChemBridge Corporation	5474131			O=C(CCC(=O)Nc1ccccc1)NN=Cc1ccncc1	InChI=1S/C16H16N4O2/c21-15(19-14-4-2-1-3-5-14)6-7-16(22)20-18-12-13-8-10-17-11-9-13/h1-5,8-12H,6-7H2,(H,19,21)(H,20,22)	DROBBAOUJNKWAZ-UHFFFAOYSA-N	296.127325792							111247
AC1LOXE3	LSM-22704	BRD-K25644606	1249680	InChI=1S/C10H10N8O3/c1-7(6-17-15-10(14-16-17)18(20)21)12-13-9(19)8-2-4-11-5-3-8/h2-5H,6H2,1H3,(H,13,19)	VKDQBTIDWVLPQP-UHFFFAOYSA-N	CC(=NNC(=O)c1ccncc1)Cn2nnc(n2)[N+](=O)[O-]	BroadT	BRD-K25644606	BRD-K25644606-001-06-6	ChemDiv Inc.	8007-8943			CC(Cn1nnc(n1)[N+]([O-])=O)=NNC(=O)c1ccncc1	InChI=1S/C10H10N8O3/c1-7(6-17-15-10(14-16-17)18(20)21)12-13-9(19)8-2-4-11-5-3-8/h2-5H,6H2,1H3,(H,13,19)	VKDQBTIDWVLPQP-UHFFFAOYSA-N	290.08758626							111248
ZINC00445700	LSM-22705	BRD-K79112906	6745486	InChI=1S/C19H23N3O3/c1-24-17-8-4-3-7-16(17)21-10-12-22(13-11-21)20-14-15-6-5-9-18(25-2)19(15)23/h3-9,14,23H,10-13H2,1-2H3	GXHJDFKWUBEMIV-UHFFFAOYSA-N	COc1cccc(C=NN2CCN(CC2)c3ccccc3OC)c1O	BroadT	BRD-K79112906	BRD-K79112906-001-05-8	ChemBridge Corporation	5886444			COc1cccc(C=NN2CCN(CC2)c2ccccc2OC)c1O	InChI=1S/C19H23N3O3/c1-24-17-8-4-3-7-16(17)21-10-12-22(13-11-21)20-14-15-6-5-9-18(25-2)19(15)23/h3-9,14,23H,10-13H2,1-2H3	GXHJDFKWUBEMIV-UHFFFAOYSA-N	341.173941626							
ZINC00464294	LSM-22706	SID26667116, BRD-K37019592	889679	InChI=1S/C16H17N3OS2/c20-15(14-8-5-11-22-14)18-16(21)17-12-6-1-2-7-13(12)19-9-3-4-10-19/h1-2,5-8,11H,3-4,9-10H2,(H2,17,18,20,21)	QSBKHLSLBKPGBU-UHFFFAOYSA-N	O=C(NC(=S)Nc1ccccc1N2CCCC2)c3cccs3	BroadT	BRD-K37019592	BRD-K37019592-001-05-5	InterBioScreen Ltd.	STOCK3S-62943			O=C(NC(=S)Nc1ccccc1N1CCCC1)c1cccs1	InChI=1S/C16H17N3OS2/c20-15(14-8-5-11-22-14)18-16(21)17-12-6-1-2-7-13(12)19-9-3-4-10-19/h1-2,5-8,11H,3-4,9-10H2,(H2,17,18,20,21)	QSBKHLSLBKPGBU-UHFFFAOYSA-N	331.081303574							111250
MLS000708394	LSM-22707	SID24804987, BRD-K66134326	804795	InChI=1S/C19H18N4/c1-11-18-13(3)23(14(4)19(18)12(2)22-21-11)16-7-8-17-15(10-16)6-5-9-20-17/h5-10H,1-4H3	AZKXTCLZMLPGQU-UHFFFAOYSA-N	Cc1nnc(C)c2c(C)n(c(C)c12)c3ccc4ncccc4c3	BroadT	BRD-K66134326	BRD-K66134326-001-05-9	Asinex Ltd.	BAS 04358843			Cc1n(c(C)c2c(C)nnc(C)c12)-c1ccc2ncccc2c1	InChI=1S/C19H18N4/c1-11-18-13(3)23(14(4)19(18)12(2)22-21-11)16-7-8-17-15(10-16)6-5-9-20-17/h5-10H,1-4H3	AZKXTCLZMLPGQU-UHFFFAOYSA-N	302.153146616							111251
F0020-0864	LSM-22708	SID24780707, BRD-K36426534	1097565	InChI=1S/C15H10Cl3NO3S/c16-11-6-8-12(9-7-11)23(21,22)15(13(17)18)19-14(20)10-4-2-1-3-5-10/h1-9H,(H,19,20)	SSVRAODLVNXLIR-UHFFFAOYSA-N	ClC(=C(NC(=O)c1ccccc1)S(=O)(=O)c2ccc(Cl)cc2)Cl	BroadT	BRD-K36426534	BRD-K36426534-001-06-2	Asinex Ltd.	BAS 00093206			ClC(Cl)=C(NC(=O)c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C15H10Cl3NO3S/c16-11-6-8-12(9-7-11)23(21,22)15(13(17)18)19-14(20)10-4-2-1-3-5-10/h1-9H,(H,19,20)	SSVRAODLVNXLIR-UHFFFAOYSA-N	388.94469701							111252
5-(2-Chloroanilino)-3-hydroxyisothiazole-4-carbonitrile	LSM-22709	SID26727153, BRD-K25471411	2726559	InChI=1S/C10H6ClN3OS/c11-7-3-1-2-4-8(7)13-10-6(5-12)9(15)14-16-10/h1-4,13H,(H,14,15)	DDSXGKISGSWSIE-UHFFFAOYSA-N	Oc1nsc(Nc2ccccc2Cl)c1C#N	BroadT	BRD-K25471411	BRD-K25471411-001-05-1	Maybridge	RF 02367			Oc1nsc(Nc2ccccc2Cl)c1C#N	InChI=1S/C10H6ClN3OS/c11-7-3-1-2-4-8(7)13-10-6(5-12)9(15)14-16-10/h1-4,13H,(H,14,15)	DDSXGKISGSWSIE-UHFFFAOYSA-N	250.992010242							111253
AH-262/36680002	LSM-22710	SID7973598, BRD-K62267727	878737	InChI=1S/C16H17N3O2/c1-3-19-13-8-6-5-7-10(13)11-9-12(16(20)21-4-2)14(17)18-15(11)19/h5-9H,3-4H2,1-2H3,(H2,17,18)	RUWRGCBGNNYLCB-UHFFFAOYSA-N	CCOC(=O)c1cc2c3ccccc3n(CC)c2nc1N	BroadT	BRD-K62267727	BRD-K62267727-001-05-6	ChemBridge Corporation	6048052			CCOC(=O)c1cc2c3ccccc3n(CC)c2nc1N	InChI=1S/C16H17N3O2/c1-3-19-13-8-6-5-7-10(13)11-9-12(16(20)21-4-2)14(17)18-15(11)19/h5-9H,3-4H2,1-2H3,(H2,17,18)	RUWRGCBGNNYLCB-UHFFFAOYSA-N	283.132076814							111254
AC1LFHXQ	LSM-22711	SID24813435, BRD-K23619109	778341	InChI=1S/C15H12N4O2S2/c22-15(17-10-2-3-11-12(6-10)19-23-18-11)16-7-9-1-4-13-14(5-9)21-8-20-13/h1-6H,7-8H2,(H2,16,17,22)	GSCBKQRAURNVKC-UHFFFAOYSA-N	S=C(NCc1ccc2OCOc2c1)Nc3ccc4nsnc4c3	BroadT	BRD-K23619109	BRD-K23619109-001-06-2	Asinex Ltd.	BAS 04320262			S=C(NCc1ccc2OCOc2c1)Nc1ccc2nsnc2c1	InChI=1S/C15H12N4O2S2/c22-15(17-10-2-3-11-12(6-10)19-23-18-11)16-7-9-1-4-13-14(5-9)21-8-20-13/h1-6H,7-8H2,(H2,16,17,22)	GSCBKQRAURNVKC-UHFFFAOYSA-N	344.040167044							111255
MLS000879398	LSM-22712	SID26732237, BRD-A92304039	16746401	InChI=1S/C30H41NO5/c1-7-10-11-12-22-19-27(32)36-30-28(22)25(34-5)20-26(35-6)29(30)24(17-18-31(8-2)9-3)21-13-15-23(33-4)16-14-21/h13-16,19-20,24H,7-12,17-18H2,1-6H3	BNUZPBVFEWDFDK-UHFFFAOYSA-N	CCCCCC1=CC(=O)Oc2c(C(CCN(CC)CC)c3ccc(OC)cc3)c(OC)cc(OC)c12	BroadT	BRD-A92304039	BRD-A92304039-001-06-4	University of Kansas CMLD	KUC101473N			CCCCCc1cc(=O)oc2c(C(CCN(CC)CC)c3ccc(OC)cc3)c(OC)cc(OC)c12	InChI=1S/C30H41NO5/c1-7-10-11-12-22-19-27(32)36-30-28(22)25(34-5)20-26(35-6)29(30)24(17-18-31(8-2)9-3)21-13-15-23(33-4)16-14-21/h13-16,19-20,24H,7-12,17-18H2,1-6H3	BNUZPBVFEWDFDK-UHFFFAOYSA-N	495.298473422							111256
AC1M0SZU	LSM-22713	BRD-K33368614	2082865	InChI=1S/C23H18N4O/c1-16-8-10-17(11-9-16)14-25-27-23(28)20-13-22(18-5-4-12-24-15-18)26-21-7-3-2-6-19(20)21/h2-15H,1H3,(H,27,28)	SNBQNDVQCIVCRR-UHFFFAOYSA-N	Cc1ccc(C=NNC(=O)c2cc(nc3ccccc23)c4cccnc4)cc1	BroadT	BRD-K33368614	BRD-K33368614-001-05-4	Enamine Ltd.	T5274092			Cc1ccc(C=NNC(=O)c2cc(nc3ccccc23)-c2cccnc2)cc1	InChI=1S/C23H18N4O/c1-16-8-10-17(11-9-16)14-25-27-23(28)20-13-22(18-5-4-12-24-15-18)26-21-7-3-2-6-19(20)21/h2-15H,1H3,(H,27,28)	SNBQNDVQCIVCRR-UHFFFAOYSA-N	366.148061236							111257
AC1MGX04	LSM-22714	SID17506698, BRD-A07909002	2942807	InChI=1S/C24H20N2OS/c1-16-13-14-20-17(2)25-24(26-21(20)15-16)28-23(19-11-7-4-8-12-19)22(27)18-9-5-3-6-10-18/h3-15,23H,1-2H3	WQPKOZUXNMBWLU-UHFFFAOYSA-N	Cc1ccc2c(C)nc(SC(C(=O)c3ccccc3)c4ccccc4)nc2c1	BroadT	BRD-A07909002	BRD-A07909002-001-05-9	ChemBridge Corporation	7585418			Cc1ccc2c(C)nc(SC(C(=O)c3ccccc3)c3ccccc3)nc2c1	InChI=1S/C24H20N2OS/c1-16-13-14-20-17(2)25-24(26-21(20)15-16)28-23(19-11-7-4-8-12-19)22(27)18-9-5-3-6-10-18/h3-15,23H,1-2H3	WQPKOZUXNMBWLU-UHFFFAOYSA-N	384.12963397							111258
ZINC527088	LSM-15340	BRD-K24853024	6955704	InChI=1S/C9H13N5O3/c1-4(10)7(15)14-11-3-6-5(2)12-9(17)13-8(6)16/h3-4H,10H2,1-2H3,(H,14,15)(H2,12,13,16,17)/t4-/m0/s1	GCGZWLXVEDAVKA-BYPYZUCNSA-N	C[C@H](N)C(=O)NN=Cc1c(C)nc(O)nc1O	BroadT	BRD-K24853024	BRD-K24853024-003-05-6	InterBioScreen Ltd.	STOCK4S-05686		Cl	C[C@H](N)C(=O)NN=Cc1c(C)nc(O)nc1O.Cl	InChI=1S/C9H13N5O3.ClH/c1-4(10)7(15)14-11-3-6-5(2)12-9(17)13-8(6)16;/h3-4H,10H2,1-2H3,(H,14,15)(H2,12,13,16,17);1H/t4-;/m0./s1	LSHDWRMBQCEITN-WCCKRBBISA-N	239.101839326							
CHEMBL575494	LSM-22715	SID849110, BRD-K80375707	651581	InChI=1S/C12H17N5/c1-8-6-4-5-7-9(8)14-11-15-10(13)16-12(2,3)17-11/h4-7H,1-3H3,(H4,13,14,15,16,17)	BSBZXWIQLSREJM-UHFFFAOYSA-N	Cc1ccccc1NC2=NC(=NC(C)(C)N2)N	BroadT	BRD-K80375707	BRD-K80375707-001-05-9	Asinex Ltd.	BAS 05210809			Cc1ccccc1NC1=NC(N)=NC(C)(C)N1	InChI=1S/C12H17N5/c1-8-6-4-5-7-9(8)14-11-15-10(13)16-12(2,3)17-11/h4-7H,1-3H3,(H4,13,14,15,16,17)	BSBZXWIQLSREJM-UHFFFAOYSA-N	231.148395594							111259
AC1M5F2W	LSM-43975	SID17516649, BRD-K40369546	2327486	InChI=1S/C19H19ClN2O/c1-19(2)15-9-4-5-10-16(15)22(3)17(19)12-18(23)21-14-8-6-7-13(20)11-14/h4-12H,1-3H3,(H,21,23)/b17-12-	PXCUZFLUFFSJBS-ATVHPVEESA-N	CN1\C(=C/C(=O)Nc2cccc(Cl)c2)\C(C)(C)c3ccccc13	BroadT	BRD-K40369546	BRD-K40369546-001-05-6	Enamine Ltd.	T0501-7821			CN1c2ccccc2C(C)(C)\C1=C\C(=O)Nc1cccc(Cl)c1	InChI=1S/C19H19ClN2O/c1-19(2)15-9-4-5-10-16(15)22(3)17(19)12-18(23)21-14-8-6-7-13(20)11-14/h4-12H,1-3H3,(H,21,23)/b17-12-	PXCUZFLUFFSJBS-ATVHPVEESA-N	326.118590958							
2-[(Dimethylamino)methyl]-4-methyl-6-(1-methylcyclohexyl)phenol	LSM-22717	SID4260851, BRD-K74085601	714483	InChI=1S/C17H27NO/c1-13-10-14(12-18(3)4)16(19)15(11-13)17(2)8-6-5-7-9-17/h10-11,19H,5-9,12H2,1-4H3	MNMBYGSLWJITRQ-UHFFFAOYSA-N	CN(C)Cc1cc(C)cc(c1O)C2(C)CCCCC2	BroadT	BRD-K74085601	BRD-K74085601-001-05-9	ChemBridge Corporation	7651918			CN(C)Cc1cc(C)cc(c1O)C1(C)CCCCC1	InChI=1S/C17H27NO/c1-13-10-14(12-18(3)4)16(19)15(11-13)17(2)8-6-5-7-9-17/h10-11,19H,5-9,12H2,1-4H3	MNMBYGSLWJITRQ-UHFFFAOYSA-N	261.209264494							111261
MLS000554310	LSM-22718	SID14742381, BRD-K17921425	929445	InChI=1S/C16H17N5/c1-20-7-9-21(10-8-20)16-18-14(12-17)11-15(19-16)13-5-3-2-4-6-13/h2-6,11H,7-10H2,1H3	WZSQNGJVDDWAMW-UHFFFAOYSA-N	CN1CCN(CC1)c2nc(cc(n2)c3ccccc3)C#N	BroadT	BRD-K17921425	BRD-K17921425-001-05-9	InterBioScreen Ltd.	STOCK2S-53927			CN1CCN(CC1)c1nc(cc(n1)-c1ccccc1)C#N	InChI=1S/C16H17N5/c1-20-7-9-21(10-8-20)16-18-14(12-17)11-15(19-16)13-5-3-2-4-6-13/h2-6,11H,7-10H2,1H3	WZSQNGJVDDWAMW-UHFFFAOYSA-N	279.148395594							111262
BAS 01530349	LSM-15341	GNF-PF-2488, BRD-K02853839	1283503	InChI=1S/C18H18BrN3O3/c1-3-25-18(24)17-12-8-16(23)13(19)9-14(12)22(2)15(17)10-21-11-4-6-20-7-5-11/h4-9,23H,3,10H2,1-2H3,(H,20,21)	KWEKHEFJSXTKGY-UHFFFAOYSA-N	CCOC(=O)c1c(CNc2ccncc2)n(C)c3cc(Br)c(O)cc13	BroadT	BRD-K02853839	BRD-K02853839-003-05-7	Asinex Ltd.	BAS 01530349		Cl	CCOC(=O)c1c(CNc2ccncc2)n(C)c2cc(Br)c(O)cc12.Cl	InChI=1S/C18H18BrN3O3.ClH/c1-3-25-18(24)17-12-8-16(23)13(19)9-14(12)22(2)15(17)10-21-11-4-6-20-7-5-11;/h4-9,23H,3,10H2,1-2H3,(H,20,21);1H	HLPCUAMGASJOMZ-UHFFFAOYSA-N	403.053154066							103986, 103986
MLS000764723	LSM-22719	SID24806140, BRD-K41242406	1087077	InChI=1S/C16H15NO3S/c1-18-12-9-14(20-3)13(19-2)8-10(12)16-17-11-6-4-5-7-15(11)21-16/h4-9H,1-3H3	JOYFHMJAXMRBJM-UHFFFAOYSA-N	COc1cc(OC)c(cc1OC)c2nc3ccccc3s2	BroadT	BRD-K41242406	BRD-K41242406-001-05-3	Asinex Ltd.	BAS 06995834			COc1cc(OC)c(cc1OC)-c1nc2ccccc2s1	InChI=1S/C16H15NO3S/c1-18-12-9-14(20-3)13(19-2)8-10(12)16-17-11-6-4-5-7-15(11)21-16/h4-9H,1-3H3	JOYFHMJAXMRBJM-UHFFFAOYSA-N	301.07726404							111263
MLS000087309	LSM-22720	SID4245863, BRD-K18530700	3240282	InChI=1S/C15H14N4O2/c1-10-8-14(16-15(20)13-9-11(2)21-18-13)19(17-10)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,16,20)	BWDWMLAVEJYMCR-UHFFFAOYSA-N	Cc1onc(c1)C(=O)Nc2cc(C)nn2c3ccccc3	BroadT	BRD-K18530700	BRD-K18530700-001-06-1	ChemDiv Inc.	C226-2597			Cc1cc(NC(=O)c2cc(C)on2)n(n1)-c1ccccc1	InChI=1S/C15H14N4O2/c1-10-8-14(16-15(20)13-9-11(2)21-18-13)19(17-10)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,16,20)	BWDWMLAVEJYMCR-UHFFFAOYSA-N	282.111675728							111264
TCMDC-123808	LSM-22721	BRD-K93342583	3719799	InChI=1S/C17H22N6O/c1-11-13-9-5-6-10-14(13)21-16(19-11)22-15(18)23-17(24)20-12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8H2,1H3,(H4,18,19,20,21,22,23,24)	UIMLXGUORUFPOZ-UHFFFAOYSA-N	Cc1nc(N=C(N)NC(=O)NC2CCCCC2)nc3ccccc13	BroadT	BRD-K93342583	BRD-K93342583-001-05-3	InterBioScreen Ltd.	STOCK1S-69881			Cc1nc(N=C(N)NC(=O)NC2CCCCC2)nc2ccccc12	InChI=1S/C17H22N6O/c1-11-13-9-5-6-10-14(13)21-16(19-11)22-15(18)23-17(24)20-12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8H2,1H3,(H4,18,19,20,21,22,23,24)	UIMLXGUORUFPOZ-UHFFFAOYSA-N	326.185509384							111265
MLS000548527	LSM-22722	SID14728058, BRD-K30063533	850255	InChI=1S/C18H23ClN2O2/c1-11(2)13-7-12(3)8-14(9-13)23-15-10-20-21(18(4,5)6)17(22)16(15)19/h7-11H,1-6H3	HSQAXTWKKNFOHA-UHFFFAOYSA-N	CC(C)c1cc(C)cc(OC2=C(Cl)C(=O)N(N=C2)C(C)(C)C)c1	BroadT	BRD-K30063533	BRD-K30063533-001-06-0	Specs	AP-501/41079092			CC(C)c1cc(C)cc(Oc2cnn(c(=O)c2Cl)C(C)(C)C)c1	InChI=1S/C18H23ClN2O2/c1-11(2)13-7-12(3)8-14(9-13)23-15-10-20-21(18(4,5)6)17(22)16(15)19/h7-11H,1-6H3	HSQAXTWKKNFOHA-UHFFFAOYSA-N	334.144805706							111266
AC1MN3K4	LSM-22723	SID14742474, BRD-A41160238	3271009	InChI=1S/C19H12N6O2/c20-10-16-18(23)24(14-6-2-1-3-7-14)17(19(16,11-21)12-22)13-5-4-8-15(9-13)25(26)27/h1-9,17H,23H2	RSKVNGROIVCQOQ-UHFFFAOYSA-N	NC1=C(C#N)C(C#N)(C#N)C(N1c2ccccc2)c3cccc(c3)[N+](=O)[O-]	BroadT	BRD-A41160238	BRD-A41160238-001-06-1	InterBioScreen Ltd.	STOCK2S-80029			NC1=C(C#N)C(C#N)(C#N)C(N1c1ccccc1)c1cccc(c1)[N+]([O-])=O	InChI=1S/C19H12N6O2/c20-10-16-18(23)24(14-6-2-1-3-7-14)17(19(16,11-21)12-22)13-5-4-8-15(9-13)25(26)27/h1-9,17H,23H2	RSKVNGROIVCQOQ-UHFFFAOYSA-N	356.102173684							111267
MLS000536648	LSM-15207	BRD-K23775845	4406531	InChI=1S/C26H31BrNO3S/c1-17-24(32-16-28(17)15-23(29)21-2-4-22(27)5-3-21)6-7-31-25(30)14-26-11-18-8-19(12-26)10-20(9-18)13-26/h2-5,16,18-20H,6-15H2,1H3/q+1	NOLFVWIVGUIDAF-UHFFFAOYSA-N	Cc1c(CCOC(=O)CC23CC4CC(CC(C4)C2)C3)sc[n+]1CC(=O)c5ccc(Br)cc5	BroadT	BRD-K23775845	BRD-K23775845-004-07-3	Enamine Ltd.	T0505-0773		Br	Cc1c(CCOC(=O)CC23CC4CC(CC(C4)C2)C3)sc[n+]1CC(=O)c1ccc(Br)cc1.Br	InChI=1S/C26H31BrNO3S.BrH/c1-17-24(32-16-28(17)15-23(29)21-2-4-22(27)5-3-21)6-7-31-25(30)14-26-11-18-8-19(12-26)10-20(9-18)13-26;/h2-5,16,18-20H,6-15H2,1H3;1H/q+1;	JTLSTGJULMSMGB-UHFFFAOYSA-N	516.120802152							103856, 103856
SMR000075148	LSM-22724	SID26668800, SID4257672, BRD-K03470141	2199719	InChI=1S/C26H22ClN3O3/c27-20-11-9-18(10-12-20)26(32)30-15-13-29(14-16-30)22-7-3-2-6-21(22)28-25(31)24-17-19-5-1-4-8-23(19)33-24/h1-12,17H,13-16H2,(H,28,31)	VCSFCZWINCYADG-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)N2CCN(CC2)c3ccccc3NC(=O)c4oc5ccccc5c4	BroadT	BRD-K03470141	BRD-K03470141-001-05-6	ChemBridge Corporation	7710557			Clc1ccc(cc1)C(=O)N1CCN(CC1)c1ccccc1NC(=O)c1cc2ccccc2o1	InChI=1S/C26H22ClN3O3/c27-20-11-9-18(10-12-20)26(32)30-15-13-29(14-16-30)22-7-3-2-6-21(22)28-25(31)24-17-19-5-1-4-8-23(19)33-24/h1-12,17H,13-16H2,(H,28,31)	VCSFCZWINCYADG-UHFFFAOYSA-N	459.134969304							111268
SMR000079298	LSM-22725	SID4256478, SID47193648, BRD-K16354233	2221791	InChI=1S/C17H21ClN4O4S2/c1-11-7-13(18)15(28(24,25)22-12-5-3-2-4-6-12)8-14(11)26-9-16(23)20-17-21-19-10-27-17/h7-8,10,12,22H,2-6,9H2,1H3,(H,20,21,23)	BPFRGYGBVQPCEH-UHFFFAOYSA-N	Cc1cc(Cl)c(cc1OCC(=O)Nc2nncs2)S(=O)(=O)NC3CCCCC3	BroadT	BRD-K16354233	BRD-K16354233-001-05-6	ChemBridge Corporation	7926395			Cc1cc(Cl)c(cc1OCC(=O)Nc1nncs1)S(=O)(=O)NC1CCCCC1	InChI=1S/C17H21ClN4O4S2/c1-11-7-13(18)15(28(24,25)22-12-5-3-2-4-6-12)8-14(11)26-9-16(23)20-17-21-19-10-27-17/h7-8,10,12,22H,2-6,9H2,1H3,(H,20,21,23)	BPFRGYGBVQPCEH-UHFFFAOYSA-N	444.069274282							111269
AC1OALPW	LSM-22726	SID22404452, BRD-K99721130	6831652	InChI=1S/C24H28N4O4S/c1-17(2)16-28-21-12-5-4-11-20(21)22(24(28)30)25-26-23(29)18-9-8-10-19(15-18)33(31,32)27-13-6-3-7-14-27/h4-5,8-12,15,17,30H,3,6-7,13-14,16H2,1-2H3	RRRWWJGVCFXMTB-UHFFFAOYSA-N	CC(C)Cn1c(O)c(N=NC(=O)c2cccc(c2)S(=O)(=O)N3CCCCC3)c4ccccc14	BroadT	BRD-K99721130	BRD-K99721130-001-07-6	Enamine Ltd.	T0506-9928			CC(C)Cn1c(O)c(N=NC(=O)c2cccc(c2)S(=O)(=O)N2CCCCC2)c2ccccc12	InChI=1S/C24H28N4O4S/c1-17(2)16-28-21-12-5-4-11-20(21)22(24(28)30)25-26-23(29)18-9-8-10-19(15-18)33(31,32)27-13-6-3-7-14-27/h4-5,8-12,15,17,30H,3,6-7,13-14,16H2,1-2H3	RRRWWJGVCFXMTB-UHFFFAOYSA-N	468.183126106							
STK700393	LSM-22727	SID843008, BRD-K12038876	536700	InChI=1S/C17H20BrN3O3/c1-12(22)20-8-17(16(24)14-3-5-15(18)6-4-14)7-19(10-20)11-21(9-17)13(2)23/h3-6H,7-11H2,1-2H3	CIIPOUCLSKMZSL-UHFFFAOYSA-N	CC(=O)N1CN2CN(CC(C2)(C1)C(=O)c3ccc(Br)cc3)C(=O)C	BroadT	BRD-K12038876	BRD-K12038876-001-05-1	Asinex Ltd.	BAS 00337641			CC(=O)N1CN2CN(CC(C2)(C1)C(=O)c1ccc(Br)cc1)C(C)=O	InChI=1S/C17H20BrN3O3/c1-12(22)20-8-17(16(24)14-3-5-15(18)6-4-14)7-19(10-20)11-21(9-17)13(2)23/h3-6H,7-11H2,1-2H3	CIIPOUCLSKMZSL-UHFFFAOYSA-N	393.06880413							111271
F0622-0311	LSM-22728	SID17514649, BRD-A50622620	4463549	InChI=1S/C21H20FN3O4S3/c1-2-31(26,27)24-17-6-3-5-15(13-17)19-14-20(21-7-4-12-30-21)25(23-19)32(28,29)18-10-8-16(22)9-11-18/h3-13,20,24H,2,14H2,1H3	KAOAXFYRSNWRTB-UHFFFAOYSA-N	CCS(=O)(=O)Nc1cccc(c1)C2=NN(C(C2)c3cccs3)S(=O)(=O)c4ccc(F)cc4	BroadT	BRD-A50622620	BRD-A50622620-001-05-6	Life Chemicals Inc.	F0622-0311			CCS(=O)(=O)Nc1cccc(c1)C1=NN(C(C1)c1cccs1)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H20FN3O4S3/c1-2-31(26,27)24-17-6-3-5-15(13-17)19-14-20(21-7-4-12-30-21)25(23-19)32(28,29)18-10-8-16(22)9-11-18/h3-13,20,24H,2,14H2,1H3	KAOAXFYRSNWRTB-UHFFFAOYSA-N	493.05999642							111272
BRD-A25880250	LSM-43976			InChI=1S/C18H20N2O7/c1-4-25-17(23)14-10(3)20-13(15(14)21)8-11-6-7-12(27-11)9-19-16(22)18(24)26-5-2/h6-8,14H,4-5,9H2,1-3H3,(H,19,22)/b13-8+	VHCJLUSTUBKPAP-MDWZMJQESA-N	CCOC(=O)C1C(=N\C(=C\c2oc(CNC(=O)C(=O)OCC)cc2)\C1=O)C	BroadT	BRD-A25880250	BRD-A25880250-001-05-9	Asinex Ltd.	BAS 02289616			CCOC(=O)C1C(C)=N\C(=C\c2ccc(CNC(=O)C(=O)OCC)o2)C1=O	InChI=1S/C18H20N2O7/c1-4-25-17(23)14-10(3)20-13(15(14)21)8-11-6-7-12(27-11)9-19-16(22)18(24)26-5-2/h6-8,14H,4-5,9H2,1-3H3,(H,19,22)/b13-8+	VHCJLUSTUBKPAP-MDWZMJQESA-N	376.127051							
7-Hydroxy-5-methyl-2-(2-oxo-propyl)-8-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yl)-chromen-4-one	LSM-22730	SID26725075, BRD-A54304162	364666	InChI=1S/C19H22O9/c1-7-3-10(22)14(19-17(26)16(25)15(24)12(6-20)28-19)18-13(7)11(23)5-9(27-18)4-8(2)21/h3,5,12,15-17,19-20,22,24-26H,4,6H2,1-2H3	HKIKAXXIWJHWLY-UHFFFAOYSA-N	CC(=O)CC1=CC(=O)c2c(C)cc(O)c(C3OC(CO)C(O)C(O)C3O)c2O1	BroadT	BRD-A54304162	BRD-A54304162-001-05-1	AnalytiCon Discovery GmbH	NP-000313			CC(=O)Cc1cc(=O)c2c(C)cc(O)c(C3OC(CO)C(O)C(O)C3O)c2o1	InChI=1S/C19H22O9/c1-7-3-10(22)14(19-17(26)16(25)15(24)12(6-20)28-19)18-13(7)11(23)5-9(27-18)4-8(2)21/h3,5,12,15-17,19-20,22,24-26H,4,6H2,1-2H3	HKIKAXXIWJHWLY-UHFFFAOYSA-N	394.126382284							111274
MLS-0101838.0001	LSM-22731	SID17407222, SID56373483, BRD-K25925759	842630	InChI=1S/C14H17N5OS/c1-9-4-6-11(7-5-9)15-14(21)17-16-13(20)12-8-19(3)18-10(12)2/h4-8H,1-3H3,(H,16,20)(H2,15,17,21)	UMWSNLSHTPSJBX-UHFFFAOYSA-N	Cc1ccc(NC(=NNC(=O)c2cn(C)nc2C)S)cc1	BroadT	BRD-K25925759	BRD-K25925759-001-05-6	Specs	AK-968/41169516			Cc1nn(C)cc1C(=O)NN=C(S)Nc1ccc(C)cc1	InChI=1S/C14H17N5OS/c1-9-4-6-11(7-5-9)15-14(21)17-16-13(20)12-8-19(3)18-10(12)2/h4-8H,1-3H3,(H,16,20)(H2,15,17,21)	UMWSNLSHTPSJBX-UHFFFAOYSA-N	303.115380904							111275
5-Fluoroindole-2-carboxylic acid	LSM-22732	SID11110665, SID26746960, SID50086821	1820	InChI=1S/C9H6FNO2/c10-6-1-2-7-5(3-6)4-8(11-7)9(12)13/h1-4,11H,(H,12,13)	WTXBRZCVLDTWLP-UHFFFAOYSA-N	OC(=O)c1cc2cc(F)ccc2[nH]1	BroadT	BRD-K55273157	BRD-K55273157-001-15-1	Sigma-Aldrich	265128			OC(=O)c1cc2cc(F)ccc2[nH]1	InChI=1S/C9H6FNO2/c10-6-1-2-7-5(3-6)4-8(11-7)9(12)13/h1-4,11H,(H,12,13)	WTXBRZCVLDTWLP-UHFFFAOYSA-N	179.038256642							111276
SMR000066516	LSM-22733	SID3717087, BRD-K28540462	2103134	InChI=1S/C19H13N5O2S/c25-18-13-10-20-24(12-6-2-1-3-7-12)17(13)22-16(23-18)11-27-19-21-14-8-4-5-9-15(14)26-19/h1-10H,11H2,(H,22,23,25)	GXSQPNONQTYTEC-UHFFFAOYSA-N	Oc1nc(CSc2oc3ccccc3n2)nc4c1cnn4c5ccccc5	BroadT	BRD-K28540462	BRD-K28540462-001-05-8	Enamine Ltd.	T5235951			Oc1nc(CSc2nc3ccccc3o2)nc2n(ncc12)-c1ccccc1	InChI=1S/C19H13N5O2S/c25-18-13-10-20-24(12-6-2-1-3-7-12)17(13)22-16(23-18)11-27-19-21-14-8-4-5-9-15(14)26-19/h1-10H,11H2,(H,22,23,25)	GXSQPNONQTYTEC-UHFFFAOYSA-N	375.078995396							
MLS000731824	LSM-22734	SID24798382, BRD-A48771257	16190053	InChI=1S/C22H24N2O2S/c1-15-23-12-21(27-15)14-24-9-3-4-19(13-24)22(25)18-6-5-17-11-20(26-2)8-7-16(17)10-18/h5-8,10-12,19H,3-4,9,13-14H2,1-2H3	KQFDPMQZRUTXPA-UHFFFAOYSA-N	COc1ccc2cc(ccc2c1)C(=O)C3CCCN(Cc4cnc(C)s4)C3	BroadT	BRD-A48771257	BRD-A48771257-001-05-6	ChemBridge Corporation	69213299			COc1ccc2cc(ccc2c1)C(=O)C1CCCN(Cc2cnc(C)s2)C1	InChI=1S/C22H24N2O2S/c1-15-23-12-21(27-15)14-24-9-3-4-19(13-24)22(25)18-6-5-17-11-20(26-2)8-7-16(17)10-18/h5-8,10-12,19H,3-4,9,13-14H2,1-2H3	KQFDPMQZRUTXPA-UHFFFAOYSA-N	380.155848718							111278
1H-Indole-3-ethanol, 2-methyl-	LSM-22735	SID857841, BRD-K83217256	659192	InChI=1S/C11H13NO/c1-8-9(6-7-13)10-4-2-3-5-11(10)12-8/h2-5,12-13H,6-7H2,1H3	ZORUCKJDMLKIQX-UHFFFAOYSA-N	Cc1[nH]c2ccccc2c1CCO	BroadT	BRD-K83217256	BRD-K83217256-001-05-5	InterBioScreen Ltd.	STOCK2S-06628			Cc1[nH]c2ccccc2c1CCO	InChI=1S/C11H13NO/c1-8-9(6-7-13)10-4-2-3-5-11(10)12-8/h2-5,12-13H,6-7H2,1H3	ZORUCKJDMLKIQX-UHFFFAOYSA-N	175.099714046							111279
MLS000834651	LSM-22736	SID24833129, BRD-K12675127	16196418	InChI=1S/C25H28N4O4/c1-17(2)13-20(25(32)33-15-19-11-7-4-8-12-19)29-24(31)22-21(27-16-28-22)23(30)26-14-18-9-5-3-6-10-18/h3-12,16-17,20H,13-15H2,1-2H3,(H,26,30)(H,27,28)(H,29,31)/t20-/m0/s1	FBBKSODBIBNBSX-FQEVSTJZSA-N	CC(C)C[C@H](NC(=O)c1[nH]cnc1C(=O)NCc2ccccc2)C(=O)OCc3ccccc3	BroadT	BRD-K12675127	BRD-K12675127-001-06-5	University of Tulsa	AE04_PA05			CC(C)C[C@H](NC(=O)c1[nH]cnc1C(=O)NCc1ccccc1)C(=O)OCc1ccccc1	InChI=1S/C25H28N4O4/c1-17(2)13-20(25(32)33-15-19-11-7-4-8-12-19)29-24(31)22-21(27-16-28-22)23(30)26-14-18-9-5-3-6-10-18/h3-12,16-17,20H,13-15H2,1-2H3,(H,26,30)(H,27,28)(H,29,31)/t20-/m0/s1	FBBKSODBIBNBSX-FQEVSTJZSA-N	448.211055416							111280
SMR000045091	LSM-22737	SID862955, BRD-K79622319	664193	InChI=1S/C18H21N5O/c1-12-5-6-14-13(10-12)16-17(22-14)18(21-11-20-16)19-7-3-9-23-8-2-4-15(23)24/h5-6,10-11,22H,2-4,7-9H2,1H3,(H,19,20,21)	OOVANMUGXMIRNE-UHFFFAOYSA-N	Cc1ccc2[nH]c3c(NCCCN4CCCC4=O)ncnc3c2c1	BroadT	BRD-K79622319	BRD-K79622319-001-05-7	InterBioScreen Ltd.	STOCK4S-59858			Cc1ccc2[nH]c3c(NCCCN4CCCC4=O)ncnc3c2c1	InChI=1S/C18H21N5O/c1-12-5-6-14-13(10-12)16-17(22-14)18(21-11-20-16)19-7-3-9-23-8-2-4-15(23)24/h5-6,10-11,22H,2-4,7-9H2,1H3,(H,19,20,21)	OOVANMUGXMIRNE-UHFFFAOYSA-N	323.174610342							111281
AC1MZ71D	LSM-22738	SID26662396, BRD-A48736679	3893477	InChI=1S/C25H23N3O3/c1-30-18-10-7-17(8-11-18)21-20-12-9-16-5-2-3-6-19(16)23(20)31-25-22(21)24(26)28(15-27-25)13-4-14-29/h2-3,5-12,15,21,26,29H,4,13-14H2,1H3	KFTGCKODHJNYBX-UHFFFAOYSA-N	COc1ccc(cc1)C2C3=C(Oc4c2ccc5ccccc45)N=CN(CCCO)C3=N	BroadT	BRD-A48736679	BRD-A48736679-001-05-9	InterBioScreen Ltd.	STOCK4S-71571			COc1ccc(cc1)C1c2ccc3ccccc3c2Oc2ncn(CCCO)c(=N)c12	InChI=1S/C25H23N3O3/c1-30-18-10-7-17(8-11-18)21-20-12-9-16-5-2-3-6-19(16)23(20)31-25-22(21)24(26)28(15-27-25)13-4-14-29/h2-3,5-12,15,21,26,29H,4,13-14H2,1H3	KFTGCKODHJNYBX-UHFFFAOYSA-N	413.173941626							111282
SMR000064811	LSM-22739	SID3712254, BRD-K03439359	2571615	InChI=1S/C18H16Cl2N4O4/c1-10-7-14(23-28-10)21-15(25)9-27-18(26)16-11(2)22-24(17(16)20)8-12-5-3-4-6-13(12)19/h3-7H,8-9H2,1-2H3,(H,21,23,25)	ZTTBMJFGNVFXSK-UHFFFAOYSA-N	Cc1onc(NC(=O)COC(=O)c2c(C)nn(Cc3ccccc3Cl)c2Cl)c1	BroadT	BRD-K03439359	BRD-K03439359-001-06-6	Enamine Ltd.	T5347073			Cc1cc(NC(=O)COC(=O)c2c(C)nn(Cc3ccccc3Cl)c2Cl)no1	InChI=1S/C18H16Cl2N4O4/c1-10-7-14(23-28-10)21-15(25)9-27-18(26)16-11(2)22-24(17(16)20)8-12-5-3-4-6-13(12)19/h3-7H,8-9H2,1-2H3,(H,21,23,25)	ZTTBMJFGNVFXSK-UHFFFAOYSA-N	422.054860452							111283
Evernic acid	LSM-22740	SID26724131	10829	InChI=1S/C17H16O7/c1-8-5-11(7-12(18)14(8)16(20)21)24-17(22)15-9(2)4-10(23-3)6-13(15)19/h4-7,18-19H,1-3H3,(H,20,21)	GODLCSLPZIBRMG-UHFFFAOYSA-N	COc1cc(C)c(C(=O)Oc2cc(C)c(C(=O)O)c(O)c2)c(O)c1	BroadT	BRD-K09848432	BRD-K09848432-001-04-8	InterBioScreen Ltd.	STOCK1N-01340			COc1cc(C)c(C(=O)Oc2cc(C)c(C(O)=O)c(O)c2)c(O)c1	InChI=1S/C17H16O7/c1-8-5-11(7-12(18)14(8)16(20)21)24-17(22)15-9(2)4-10(23-3)6-13(15)19/h4-7,18-19H,1-3H3,(H,20,21)	GODLCSLPZIBRMG-UHFFFAOYSA-N	332.089602852							111284
CID 40785577	LSM-22741	BRD-A17808777	40785577	InChI=1S/C21H18N4O2S/c1-13-7-9-15(10-8-13)25-20(27)16-5-3-4-6-18(16)24-21(25)28-12-19(26)17(11-22)14(2)23/h3-10,17,23H,12H2,1-2H3	ZCFIIUPFTMHMFP-UHFFFAOYSA-N	CC(=N)C(C#N)C(=O)CSC1=Nc2ccccc2C(=O)N1c3ccc(C)cc3	BroadT	BRD-A17808777	BRD-A17808777-001-03-9	Enamine Ltd.	T5237677			CC(=N)C(C#N)C(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(C)cc1	InChI=1S/C21H18N4O2S/c1-13-7-9-15(10-8-13)25-20(27)16-5-3-4-6-18(16)24-21(25)28-12-19(26)17(11-22)14(2)23/h3-10,17,23H,12H2,1-2H3	ZCFIIUPFTMHMFP-UHFFFAOYSA-N	390.115046546							111285
AC1LG6Q4	LSM-22742	BRD-K82450720	766041	InChI=1S/C16H18N4O3/c1-18-8-10-19(11-9-18)17-12-15-6-7-16(23-15)13-2-4-14(5-3-13)20(21)22/h2-7,12H,8-11H2,1H3	HDXLSHZNIRHIJG-UHFFFAOYSA-N	CN1CCN(CC1)N=Cc2oc(cc2)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-K82450720	BRD-K82450720-001-06-9	Asinex Ltd.	BAS 01355474			CN1CCN(CC1)N=Cc1ccc(o1)-c1ccc(cc1)[N+]([O-])=O	InChI=1S/C16H18N4O3/c1-18-8-10-19(11-9-18)17-12-15-6-7-16(23-15)13-2-4-14(5-3-13)20(21)22/h2-7,12H,8-11H2,1H3	HDXLSHZNIRHIJG-UHFFFAOYSA-N	314.137890476							111286
Mibefradil	LSM-2192	Mibefradil, Posicor, BRD-K09549677	60663	InChI=1S/C29H38FN3O3/c1-20(2)28-23-12-11-22(30)18-21(23)13-14-29(28,36-27(34)19-35-4)15-17-33(3)16-7-10-26-31-24-8-5-6-9-25(24)32-26/h5-6,8-9,11-12,18,20,28H,7,10,13-17,19H2,1-4H3,(H,31,32)/t28-,29-/m0/s1	HBNPJJILLOYFJU-VMPREFPWSA-N	COCC(=O)O[C@]1(CCN(C)CCCc2nc3ccccc3[nH]2)CCc4cc(F)ccc4[C@@H]1C(C)C	BroadT	BRD-K09549677	BRD-K09549677-311-05-6	Sigma-Aldrich	M5441		O.Cl	COCC(=O)O[C@]1(CCN(C)CCCc2nc3ccccc3[nH]2)CCc2cc(F)ccc2[C@@H]1C(C)C.O.Cl	InChI=1S/C29H38FN3O3.ClH.H2O/c1-20(2)28-23-12-11-22(30)18-21(23)13-14-29(28,36-27(34)19-35-4)15-17-33(3)16-7-10-26-31-24-8-5-6-9-25(24)32-26;;/h5-6,8-9,11-12,18,20,28H,7,10,13-17,19H2,1-4H3,(H,31,32);1H;1H2/t28-,29-;;/m0../s1	WTEKKBNMVUOLJX-GDUXWEAWSA-N	495.289720306							6920, 6920, 6920
2-(Dimethylamino)ethyl 3-phenylpropanoate	LSM-15342	BRD-K25640588	114245	InChI=1S/C13H19NO2/c1-14(2)10-11-16-13(15)9-8-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3	LXELBKKGSDJSKX-UHFFFAOYSA-N	CN(C)CCOC(=O)CCc1ccccc1	BroadT	BRD-K25640588	BRD-K25640588-003-07-0	InterBioScreen Ltd.	STOCK2S-87265		Cl	CN(C)CCOC(=O)CCc1ccccc1.Cl	InChI=1S/C13H19NO2.ClH/c1-14(2)10-11-16-13(15)9-8-12-6-4-3-5-7-12;/h3-7H,8-11H2,1-2H3;1H	UQKGNLAEUNYNQU-UHFFFAOYSA-N	221.141578858							103987, 103987
SMR000149541	LSM-22743	SID14742780, BRD-K78055640	1863161	InChI=1S/C12H12ClN5S/c1-7-10(13)8(2)18-12(15-7)16-11(17-18)14-6-9-4-3-5-19-9/h3-5H,6H2,1-2H3,(H,14,17)	IZURVSTVECBPBQ-UHFFFAOYSA-N	Cc1nc2nc(NCc3cccs3)nn2c(C)c1Cl	BroadT	BRD-K78055640	BRD-K78055640-001-05-1	InterBioScreen Ltd.	STOCK5S-42687			Cc1nc2nc(NCc3cccs3)nn2c(C)c1Cl	InChI=1S/C12H12ClN5S/c1-7-10(13)8(2)18-12(15-7)16-11(17-18)14-6-9-4-3-5-19-9/h3-5H,6H2,1-2H3,(H,14,17)	IZURVSTVECBPBQ-UHFFFAOYSA-N	293.050193834							111287
MLS000091294	LSM-22744	SID4242860, BRD-K84014472	3237660	InChI=1S/C14H15N5/c15-11-13-14(18-9-5-2-6-10-18)17-19(16-13)12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-10H2	MORDGEGZZASYEZ-UHFFFAOYSA-N	N#Cc1nn(nc1N2CCCCC2)c3ccccc3	BroadT	BRD-K84014472	BRD-K84014472-001-05-3	ChemDiv Inc.	C301-1766			N#Cc1nn(nc1N1CCCCC1)-c1ccccc1	InChI=1S/C14H15N5/c15-11-13-14(18-9-5-2-6-10-18)17-19(16-13)12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-10H2	MORDGEGZZASYEZ-UHFFFAOYSA-N	253.13274553							111288
Methyl 4-hydroxy-8-methoxyquinoline-2-carboxylate	LSM-22745	SID26727949, BRD-K05684451	2801536	InChI=1S/C12H11NO4/c1-16-10-5-3-4-7-9(14)6-8(12(15)17-2)13-11(7)10/h3-6H,1-2H3,(H,13,14)	JFWIAQNNAPXWLS-UHFFFAOYSA-N	COC(=O)c1cc(O)c2cccc(OC)c2n1	BroadT	BRD-K05684451	BRD-K05684451-001-05-4	Maybridge	BTB 10048			COC(=O)c1cc(O)c2cccc(OC)c2n1	InChI=1S/C12H11NO4/c1-16-10-5-3-4-7-9(14)6-8(12(15)17-2)13-11(7)10/h3-6H,1-2H3,(H,13,14)	JFWIAQNNAPXWLS-UHFFFAOYSA-N	233.068807842							111289
F2004-0202	LSM-22746	SID24815658, BRD-K28243278	7207290	InChI=1S/C15H11ClN2OS/c16-12-5-3-11(4-6-12)10-20-15-8-7-13(17-18-15)14-2-1-9-19-14/h1-9H,10H2	LPPBUZPLSGDYOL-UHFFFAOYSA-N	Clc1ccc(CSc2ccc(nn2)c3occc3)cc1	BroadT	BRD-K28243278	BRD-K28243278-001-05-3	Life Chemicals Inc.	F2004-0202			Clc1ccc(CSc2ccc(nn2)-c2ccco2)cc1	InChI=1S/C15H11ClN2OS/c16-12-5-3-11(4-6-12)10-20-15-8-7-13(17-18-15)14-2-1-9-19-14/h1-9H,10H2	LPPBUZPLSGDYOL-UHFFFAOYSA-N	302.028061392							111290
STK070692	LSM-22747	SID24781875, BRD-K21380052	2293952	InChI=1S/C21H19N3O7/c1-22-19(25)17(20(26)23(2)21(22)27)13-14-5-3-4-6-18(14)31-12-11-30-16-9-7-15(8-10-16)24(28)29/h3-10,13H,11-12H2,1-2H3	HKLPLZNWZKJBJP-UHFFFAOYSA-N	CN1C(=O)N(C)C(=O)C(=Cc2ccccc2OCCOc3ccc(cc3)[N+](=O)[O-])C1=O	BroadT	BRD-K21380052	BRD-K21380052-001-05-2	ChemDiv Inc.	2958-7478			CN1C(=O)N(C)C(=O)C(=Cc2ccccc2OCCOc2ccc(cc2)[N+]([O-])=O)C1=O	InChI=1S/C21H19N3O7/c1-22-19(25)17(20(26)23(2)21(22)27)13-14-5-3-4-6-18(14)31-12-11-30-16-9-7-15(8-10-16)24(28)29/h3-10,13H,11-12H2,1-2H3	HKLPLZNWZKJBJP-UHFFFAOYSA-N	425.122299978							111291
MLS002415570	LSM-2955	SID85147015, SID57287605, BRD-K43131268	1394536	InChI=1S/C20H19N3O3S/c1-3-10-23-19(14-6-4-13(2)5-7-14)21-22-20(23)27-12-18(26)15-8-9-16(24)17(25)11-15/h3-9,11,24-25H,1,10,12H2,2H3	XQMYTQQHXORADL-UHFFFAOYSA-N	Cc1ccc(cc1)c2nnc(SCC(=O)c3ccc(O)c(O)c3)n2CC=C	BroadT	BRD-K43131268	BRD-K43131268-001-04-6	Sanford-Burnham Medical Research Institute	MLS-0390858.0001			Cc1ccc(cc1)-c1nnc(SCC(=O)c2ccc(O)c(O)c2)n1CC=C	InChI=1S/C20H19N3O3S/c1-3-10-23-19(14-6-4-13(2)5-7-14)21-22-20(23)27-12-18(26)15-8-9-16(24)17(25)11-15/h3-9,11,24-25H,1,10,12H2,2H3	XQMYTQQHXORADL-UHFFFAOYSA-N	381.114712188							92759
MLS000416469	LSM-22748	SID22406026, BRD-K98626876	2401602	InChI=1S/C25H23N3O4S/c29-23(26-18-12-14-20(15-13-18)32-19-7-2-1-3-8-19)17-31-24(30)11-6-16-33-25-27-21-9-4-5-10-22(21)28-25/h1-5,7-10,12-15H,6,11,16-17H2,(H,26,29)(H,27,28)	BVCQNERUSOKMJK-UHFFFAOYSA-N	O=C(COC(=O)CCCSc1nc2ccccc2[nH]1)Nc3ccc(Oc4ccccc4)cc3	BroadT	BRD-K98626876	BRD-K98626876-001-05-0	Enamine Ltd.	T0517-3483			O=C(COC(=O)CCCSc1nc2ccccc2[nH]1)Nc1ccc(Oc2ccccc2)cc1	InChI=1S/C25H23N3O4S/c29-23(26-18-12-14-20(15-13-18)32-19-7-2-1-3-8-19)17-31-24(30)11-6-16-33-25-27-21-9-4-5-10-22(21)28-25/h1-5,7-10,12-15H,6,11,16-17H2,(H,26,29)(H,27,28)	BVCQNERUSOKMJK-UHFFFAOYSA-N	461.140926936							111292
MLS000567084	LSM-22749	SID17385709, BRD-K65791726	4034051	InChI=1S/C21H23N5O3S/c27-20(6-3-15-30-21-22-18-4-1-2-5-19(18)23-21)25-13-11-24(12-14-25)16-7-9-17(10-8-16)26(28)29/h1-2,4-5,7-10H,3,6,11-15H2,(H,22,23)	IMTLAJUSIIVOOU-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=O)CCCSc3nc4ccccc4[nH]3	BroadT	BRD-K65791726	BRD-K65791726-001-06-1	Enamine Ltd.	T5286837			[O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(=O)CCCSc1nc2ccccc2[nH]1	InChI=1S/C21H23N5O3S/c27-20(6-3-15-30-21-22-18-4-1-2-5-19(18)23-21)25-13-11-24(12-14-25)16-7-9-17(10-8-16)26(28)29/h1-2,4-5,7-10H,3,6,11-15H2,(H,22,23)	IMTLAJUSIIVOOU-UHFFFAOYSA-N	425.152160336							111293
TCMDC-124585	LSM-22750	BRD-K93494194	1477780	InChI=1S/C21H26N4O3/c1-24-7-9-25(10-8-24)15-5-6-16-17(13-15)23-21(22-16)14-11-18(26-2)20(28-4)19(12-14)27-3/h5-6,11-13H,7-10H2,1-4H3,(H,22,23)	MDRZBFNKPZFCGE-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)c2nc3cc(ccc3[nH]2)N4CCN(C)CC4	BroadT	BRD-K93494194	BRD-K93494194-001-05-3	Key Organics Ltd.	4T-0244			COc1cc(cc(OC)c1OC)-c1nc2cc(ccc2[nH]1)N1CCN(C)CC1	InChI=1S/C21H26N4O3/c1-24-7-9-25(10-8-24)15-5-6-16-17(13-15)23-21(22-16)14-11-18(26-2)20(28-4)19(12-14)27-3/h5-6,11-13H,7-10H2,1-4H3,(H,22,23)	MDRZBFNKPZFCGE-UHFFFAOYSA-N	382.200490732							111294
ST50170619	LSM-22751	SID49729404, BRD-K59432463	3136220	InChI=1S/C12H11N3O4S/c16-15(17)11-2-1-3-12(8-11)20(18,19)14-9-10-4-6-13-7-5-10/h1-8,14H,9H2	FYNKLJOOLFWJLT-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)S(=O)(=O)NCc2ccncc2	BroadT	BRD-K59432463	BRD-K59432463-001-05-9	Asinex Ltd.	BAS 01926936			[O-][N+](=O)c1cccc(c1)S(=O)(=O)NCc1ccncc1	InChI=1S/C12H11N3O4S/c16-15(17)11-2-1-3-12(8-11)20(18,19)14-9-10-4-6-13-7-5-10/h1-8,14H,9H2	FYNKLJOOLFWJLT-UHFFFAOYSA-N	293.047026552							111295
1-(4-Amino-2-methylquinolin-3-yl)ethanone	LSM-22752	SID4257693, BRD-K42649977	672297	InChI=1S/C12H12N2O/c1-7-11(8(2)15)12(13)9-5-3-4-6-10(9)14-7/h3-6H,1-2H3,(H2,13,14)	YFGFFNPPTDOYLI-UHFFFAOYSA-N	CC(=O)c1c(C)nc2ccccc2c1N	BroadT	BRD-K42649977	BRD-K42649977-001-05-7	ChemBridge Corporation	7936782			CC(=O)c1c(C)nc2ccccc2c1N	InChI=1S/C12H12N2O/c1-7-11(8(2)15)12(13)9-5-3-4-6-10(9)14-7/h3-6H,1-2H3,(H2,13,14)	YFGFFNPPTDOYLI-UHFFFAOYSA-N	200.094963024							111296
MLS000027952	LSM-22753	SID843912, BRD-A42730531	5770889	InChI=1S/C18H20F3N5OS/c19-18(20,21)14-7-11(9-5-6-9)22-15-8-12(25-26(14)15)16(27)24-17-23-10-3-1-2-4-13(10)28-17/h8-9,11,14,22H,1-7H2,(H,23,24,27)	OOIIANIFWVIHLY-UHFFFAOYSA-N	FC(F)(F)C1CC(Nc2cc(nn12)C(=O)Nc3nc4CCCCc4s3)C5CC5	BroadT	BRD-A42730531	BRD-A42730531-001-05-6	Asinex Ltd.	ASN 05303120			FC(F)(F)C1CC(Nc2cc(nn12)C(=O)Nc1nc2CCCCc2s1)C1CC1	InChI=1S/C18H20F3N5OS/c19-18(20,21)14-7-11(9-5-6-9)22-15-8-12(25-26(14)15)16(27)24-17-23-10-3-1-2-4-13(10)28-17/h8-9,11,14,22H,1-7H2,(H,23,24,27)	OOIIANIFWVIHLY-UHFFFAOYSA-N	411.1340656							
AC1MMSVO	LSM-22754	SID4250028, BRD-K85693506	3243896	InChI=1S/C17H17ClN4O2/c1-17(2,3)22-15-13(8-20-22)16(24)21(10-19-15)9-14(23)11-4-6-12(18)7-5-11/h4-8,10H,9H2,1-3H3	RGHMGVRHYMHHPL-UHFFFAOYSA-N	CC(C)(C)n1ncc2C(=O)N(CC(=O)c3ccc(Cl)cc3)C=Nc12	BroadT	BRD-K85693506	BRD-K85693506-001-06-1	ChemDiv Inc.	C801-0686			CC(C)(C)n1ncc2c1ncn(CC(=O)c1ccc(Cl)cc1)c2=O	InChI=1S/C17H17ClN4O2/c1-17(2,3)22-15-13(8-20-22)16(24)21(10-19-15)9-14(23)11-4-6-12(18)7-5-11/h4-8,10H,9H2,1-3H3	RGHMGVRHYMHHPL-UHFFFAOYSA-N	344.104003534							111298
MLS000519348	LSM-22755	SID14738523, BRD-K64220004	3331652	InChI=1S/C11H16ClN5S/c1-4-5-6-17-10(13-14-11(17)18)9-8(12)7(2)16(3)15-9/h4-6H2,1-3H3,(H,14,18)	MLVYDAMMAXVCIA-UHFFFAOYSA-N	CCCCn1c(S)nnc1c2nn(C)c(C)c2Cl	BroadT	BRD-K64220004	BRD-K64220004-001-05-7	ChemDiv Inc.	6049-0226			CCCCn1c(S)nnc1-c1nn(C)c(C)c1Cl	InChI=1S/C11H16ClN5S/c1-4-5-6-17-10(13-14-11(17)18)9-8(12)7(2)16(3)15-9/h4-6H2,1-3H3,(H,14,18)	MLVYDAMMAXVCIA-UHFFFAOYSA-N	285.081493962							111299
SMR000154741	LSM-22756	SID17385935, BRD-K22755840	2352842	InChI=1S/C16H10BrN3O2S2/c17-9-5-6-11-13(7-9)24-15(18-11)20-14(21)8-23-16-19-10-3-1-2-4-12(10)22-16/h1-7H,8H2,(H,18,20,21)	OVTKOZRGWDPDID-UHFFFAOYSA-N	Brc1ccc2nc(NC(=O)CSc3oc4ccccc4n3)sc2c1	BroadT	BRD-K22755840	BRD-K22755840-001-06-9	Enamine Ltd.	T0508-6592			Brc1ccc2nc(NC(=O)CSc3nc4ccccc4o3)sc2c1	InChI=1S/C16H10BrN3O2S2/c17-9-5-6-11-13(7-9)24-15(18-11)20-14(21)8-23-16-19-10-3-1-2-4-12(10)22-16/h1-7H,8H2,(H,18,20,21)	OVTKOZRGWDPDID-UHFFFAOYSA-N	418.93978057							111300
MLS000334516	LSM-22757	SID22409876, BRD-K55419080	4875603	InChI=1S/C28H25N3O6/c1-19-16-27(32)37-26-17-24(10-11-25(19)26)36-18-20-2-4-21(5-3-20)28(33)30-14-12-29(13-15-30)22-6-8-23(9-7-22)31(34)35/h2-11,16-17H,12-15,18H2,1H3	ZOFSNNLJQCNHOO-UHFFFAOYSA-N	CC1=CC(=O)Oc2cc(OCc3ccc(cc3)C(=O)N4CCN(CC4)c5ccc(cc5)[N+](=O)[O-])ccc12	BroadT	BRD-K55419080	BRD-K55419080-001-04-6	Enamine Ltd.	T5295395			Cc1cc(=O)oc2cc(OCc3ccc(cc3)C(=O)N3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)ccc12	InChI=1S/C28H25N3O6/c1-19-16-27(32)37-26-17-24(10-11-25(19)26)36-18-20-2-4-21(5-3-20)28(33)30-14-12-29(13-15-30)22-6-8-23(9-7-22)31(34)35/h2-11,16-17H,12-15,18H2,1H3	ZOFSNNLJQCNHOO-UHFFFAOYSA-N	499.17433555							111301
5-(4-Methoxyphenyl)-4H-1,2,4-triazole-3-thiol	LSM-22758	SID7974016, SID56373883, SID125317275, BRD-K14266411	689101	InChI=1S/C9H9N3OS/c1-13-7-4-2-6(3-5-7)8-10-9(14)12-11-8/h2-5H,1H3,(H2,10,11,12,14)	USRWSSVQAGNWRI-UHFFFAOYSA-N	COc1ccc(cc1)c2n[nH]c(S)n2	BroadT	BRD-K14266411	BRD-K14266411-001-07-4	ChemBridge Corporation	5947627			COc1ccc(cc1)-c1n[nH]c(S)n1	InChI=1S/C9H9N3OS/c1-13-7-4-2-6(3-5-7)8-10-9(14)12-11-8/h2-5H,1H3,(H2,10,11,12,14)	USRWSSVQAGNWRI-UHFFFAOYSA-N	207.046632628							111302
SMR000262234	LSM-22759	SID17516406, BRD-K44284403	4651251	InChI=1S/C29H40N4O2S2/c1-34-26-9-5-3-7-24(26)32-28(36)30-22-15-11-20(12-16-22)19-21-13-17-23(18-14-21)31-29(37)33-25-8-4-6-10-27(25)35-2/h3-10,20-23H,11-19H2,1-2H3,(H2,30,32,36)(H2,31,33,37)	TUXSPMWDBJLFSE-UHFFFAOYSA-N	COc1ccccc1N=C(S)NC2CCC(CC3CCC(CC3)NC(=Nc4ccccc4OC)S)CC2	BroadT	BRD-K44284403	BRD-K44284403-001-05-5	Enamine Ltd.	T0505-0140			COc1ccccc1N=C(S)NC1CCC(CC2CCC(CC2)NC(S)=Nc2ccccc2OC)CC1	InChI=1S/C29H40N4O2S2/c1-34-26-9-5-3-7-24(26)32-28(36)30-22-15-11-20(12-16-22)19-21-13-17-23(18-14-21)31-29(37)33-25-8-4-6-10-27(25)35-2/h3-10,20-23H,11-19H2,1-2H3,(H2,30,32,36)(H2,31,33,37)	TUXSPMWDBJLFSE-UHFFFAOYSA-N	540.25926794							111303
SMR000147314	LSM-43977	SID17401564, BRD-K79114040	1965523	InChI=1S/C25H18N4O4S/c1-16-2-4-17(5-3-16)12-22-15-27-25(34-22)28-24(30)19(14-26)13-21-10-11-23(33-21)18-6-8-20(9-7-18)29(31)32/h2-11,13,15H,12H2,1H3,(H,27,28,30)/b19-13+	AHFUKBBKJQDPIW-CPNJWEJPSA-N	Cc1ccc(Cc2cnc(NC(=O)\C(=C\c3oc(cc3)c4ccc(cc4)[N+](=O)[O-])\C#N)s2)cc1	BroadT	BRD-K79114040	BRD-K79114040-001-05-1	InterBioScreen Ltd.	STOCK3S-24019			Cc1ccc(Cc2cnc(NC(=O)C(=C\c3ccc(o3)-c3ccc(cc3)[N+]([O-])=O)\C#N)s2)cc1	InChI=1S/C25H18N4O4S/c1-16-2-4-17(5-3-16)12-22-15-27-25(34-22)28-24(30)19(14-26)13-21-10-11-23(33-21)18-6-8-20(9-7-18)29(31)32/h2-11,13,15H,12H2,1H3,(H,27,28,30)/b19-13+	AHFUKBBKJQDPIW-CPNJWEJPSA-N	470.104875786							
MLS000778544	LSM-43978	SID26670939, BRD-K19650815	2021233	InChI=1S/C14H10N2O3S4/c17-13-12(9-10-5-4-8-21-10)22-14(20)16(13)15-23(18,19)11-6-2-1-3-7-11/h1-9,15H/b12-9-	VWAZCVPSBKHJKM-XFXZXTDPSA-N	O=C1N(NS(=O)(=O)c2ccccc2)C(=S)S/C/1=C\c3cccs3	BroadT	BRD-K19650815	BRD-K19650815-001-05-0	InterBioScreen Ltd.	STOCK4S-73757			O=C1N(NS(=O)(=O)c2ccccc2)C(=S)S\C1=C/c1cccs1	InChI=1S/C14H10N2O3S4/c17-13-12(9-10-5-4-8-21-10)22-14(20)16(13)15-23(18,19)11-6-2-1-3-7-11/h1-9,15H/b12-9-	VWAZCVPSBKHJKM-XFXZXTDPSA-N	381.95742496							
AC1N0LSG	LSM-22762	SID22405268, BRD-K34788422	3939859	InChI=1S/C21H28N2O4S2/c1-6-23(7-2)29(25,26)17-10-11-19(27-5)18(13-17)22-21(24)14-28-20-12-15(3)8-9-16(20)4/h8-13H,6-7,14H2,1-5H3,(H,22,24)	BBECHTZOSJYMLD-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)CSc2cc(C)ccc2C)c1	BroadT	BRD-K34788422	BRD-K34788422-001-05-4	Enamine Ltd.	T5269506			CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)CSc2cc(C)ccc2C)c1	InChI=1S/C21H28N2O4S2/c1-6-23(7-2)29(25,26)17-10-11-19(27-5)18(13-17)22-21(24)14-28-20-12-15(3)8-9-16(20)4/h8-13H,6-7,14H2,1-5H3,(H,22,24)	BBECHTZOSJYMLD-UHFFFAOYSA-N	436.149048776							111306
N,N'-Bis(3-phenylpropyl)butanediamide	LSM-22763	SID22416473, BRD-K13984972	2931469	InChI=1S/C22H28N2O2/c25-21(23-17-7-13-19-9-3-1-4-10-19)15-16-22(26)24-18-8-14-20-11-5-2-6-12-20/h1-6,9-12H,7-8,13-18H2,(H,23,25)(H,24,26)	WSBDCQQEFPJAKT-UHFFFAOYSA-N	O=C(CCC(=O)NCCCc1ccccc1)NCCCc2ccccc2	BroadT	BRD-K13984972	BRD-K13984972-001-05-8	ChemBridge Corporation	7240557			O=C(CCC(=O)NCCCc1ccccc1)NCCCc1ccccc1	InChI=1S/C22H28N2O2/c25-21(23-17-7-13-19-9-3-1-4-10-19)15-16-22(26)24-18-8-14-20-11-5-2-6-12-20/h1-6,9-12H,7-8,13-18H2,(H,23,25)(H,24,26)	WSBDCQQEFPJAKT-UHFFFAOYSA-N	352.215078156							111307
AC1LB8TA	LSM-22764	BRD-K45893282	578443	InChI=1S/C14H12N2O3/c17-11-5-3-4-10(8-11)9-15-16-14(19)12-6-1-2-7-13(12)18/h1-9,17-18H,(H,16,19)	AXQNMXSAYHDNGA-UHFFFAOYSA-N	Oc1cccc(C=NNC(=O)c2ccccc2O)c1	BroadT	BRD-K45893282	BRD-K45893282-001-05-8	Enamine Ltd.	T0510-5768			Oc1cccc(C=NNC(=O)c2ccccc2O)c1	InChI=1S/C14H12N2O3/c17-11-5-3-4-10(8-11)9-15-16-14(19)12-6-1-2-7-13(12)18/h1-9,17-18H,(H,16,19)	AXQNMXSAYHDNGA-UHFFFAOYSA-N	256.084792264							111308
ST50936909	LSM-22765	SID17506579, BRD-A01621507	2932192	InChI=1S/C24H22N2O3S/c1-13-10-11-16-19(12-13)30-24(21(16)22(25)27)26-23(28)20-14-6-2-4-8-17(14)29-18-9-5-3-7-15(18)20/h2-9,13,20H,10-12H2,1H3,(H2,25,27)(H,26,28)	DGFWCGTXBUOZKN-UHFFFAOYSA-N	CC1CCc2c(C1)sc(NC(=O)C3c4ccccc4Oc5ccccc35)c2C(=O)N	BroadT	BRD-A01621507	BRD-A01621507-001-06-4	ChemBridge Corporation	7256093			CC1CCc2c(C1)sc(NC(=O)C1c3ccccc3Oc3ccccc13)c2C(N)=O	InChI=1S/C24H22N2O3S/c1-13-10-11-16-19(12-13)30-24(21(16)22(25)27)26-23(28)20-14-6-2-4-8-17(14)29-18-9-5-3-7-15(18)20/h2-9,13,20H,10-12H2,1H3,(H2,25,27)(H,26,28)	DGFWCGTXBUOZKN-UHFFFAOYSA-N	418.135113274							111309
T0505-4846	LSM-22766	SID3715690, BRD-K28686926	2332871	InChI=1S/C25H27N3O5S/c1-2-33-19-11-13-20(14-12-19)34(30,31)27-22-8-4-3-7-21(22)25(29)26-23-9-5-6-10-24(23)28-15-17-32-18-16-28/h3-14,27H,2,15-18H2,1H3,(H,26,29)	DPONPIOYOBVPOK-UHFFFAOYSA-N	CCOc1ccc(cc1)S(=O)(=O)Nc2ccccc2C(=O)Nc3ccccc3N4CCOCC4	BroadT	BRD-K28686926	BRD-K28686926-001-05-9	Enamine Ltd.	T0505-4846			CCOc1ccc(cc1)S(=O)(=O)Nc1ccccc1C(=O)Nc1ccccc1N1CCOCC1	InChI=1S/C25H27N3O5S/c1-2-33-19-11-13-20(14-12-19)34(30,31)27-22-8-4-3-7-21(22)25(29)26-23-9-5-6-10-24(23)28-15-17-32-18-16-28/h3-14,27H,2,15-18H2,1H3,(H,26,29)	DPONPIOYOBVPOK-UHFFFAOYSA-N	481.167141684							111310
ZINC13865155	LSM-22767	BRD-K56382272	51529227	InChI=1S/C18H16N2O6/c1-25-15-9-5-13(6-10-15)19-16(18(22)26-2)11-17(21)12-3-7-14(8-4-12)20(23)24/h3-10H,11H2,1-2H3	GCMUNRPDMMKKTD-UHFFFAOYSA-N	COC(=O)C(=Nc1ccc(OC)cc1)CC(=O)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K56382272	BRD-K56382272-001-04-3	InterBioScreen Ltd.	STOCK4S-79867			COC(=O)C(CC(=O)c1ccc(cc1)[N+]([O-])=O)=Nc1ccc(OC)cc1	InChI=1S/C18H16N2O6/c1-25-15-9-5-13(6-10-15)19-16(18(22)26-2)11-17(21)12-3-7-14(8-4-12)20(23)24/h3-10H,11H2,1-2H3	GCMUNRPDMMKKTD-UHFFFAOYSA-N	356.100836252							111311
MLS000586255	LSM-22768	SID17510881, BRD-A42809639	4661512	InChI=1S/C21H31FN4OS/c1-16-15-21(2,3)23-20(28)26(16)10-6-9-19(27)25-13-11-24(12-14-25)18-8-5-4-7-17(18)22/h4-5,7-8,16H,6,9-15H2,1-3H3,(H,23,28)	FHPMCQOMXCVOKG-UHFFFAOYSA-N	CC1CC(C)(C)N=C(S)N1CCCC(=O)N2CCN(CC2)c3ccccc3F	BroadT	BRD-A42809639	BRD-A42809639-001-05-9	ChemDiv Inc.	C069-0671			CC1CC(C)(C)N=C(S)N1CCCC(=O)N1CCN(CC1)c1ccccc1F	InChI=1S/C21H31FN4OS/c1-16-15-21(2,3)23-20(28)26(16)10-6-9-19(27)25-13-11-24(12-14-25)18-8-5-4-7-17(18)22/h4-5,7-8,16H,6,9-15H2,1-3H3,(H,23,28)	FHPMCQOMXCVOKG-UHFFFAOYSA-N	406.220260542							111312
ML130	LSM-4000	BRD-K89306950, SID47203507, SID85176678, SID85248360	1088438	InChI=1S/C14H13N3O2S/c1-10-6-8-11(9-7-10)20(18,19)17-13-5-3-2-4-12(13)16-14(17)15/h2-9H,1H3,(H2,15,16)	SRFABRWQVPCPRG-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)n2c(N)nc3ccccc23	BroadT	BRD-K89306950	BRD-K89306950-001-05-9	Asinex Ltd.	BAS 07162070			Cc1ccc(cc1)S(=O)(=O)n1c(N)nc2ccccc12	InChI=1S/C14H13N3O2S/c1-10-6-8-11(9-7-10)20(18,19)17-13-5-3-2-4-12(13)16-14(17)15/h2-9H,1H3,(H2,15,16)	SRFABRWQVPCPRG-UHFFFAOYSA-N	287.072847376							93561
F0698-0259	LSM-22769	SID17515358, BRD-K37197712	4571789	InChI=1S/C17H13ClN2OS2/c1-11-3-2-4-13(9-11)16-19-17(23-20-16)22-10-15(21)12-5-7-14(18)8-6-12/h2-9H,10H2,1H3	ZKTYTEORWLGWQU-UHFFFAOYSA-N	Cc1cccc(c1)c2nsc(SCC(=O)c3ccc(Cl)cc3)n2	BroadT	BRD-K37197712	BRD-K37197712-001-05-4	Life Chemicals Inc.	F0698-0259			Cc1cccc(c1)-c1nsc(SCC(=O)c2ccc(Cl)cc2)n1	InChI=1S/C17H13ClN2OS2/c1-11-3-2-4-13(9-11)16-19-17(23-20-16)22-10-15(21)12-5-7-14(18)8-6-12/h2-9H,10H2,1H3	ZKTYTEORWLGWQU-UHFFFAOYSA-N	360.015782146							111313
636568-08-6	LSM-22770	SID24831048, BRD-K78362487	730292	InChI=1S/C12H11FN2O3/c1-2-18-12(17)11-10(16)7-15(14-11)9-5-3-8(13)4-6-9/h3-7,16H,2H2,1H3	WRWOTBYUDNAZFR-UHFFFAOYSA-N	CCOC(=O)c1nn(cc1O)c2ccc(F)cc2	BroadT	BRD-K78362487	BRD-K78362487-001-05-7	Enamine Ltd.	T0513-6170			CCOC(=O)c1nn(cc1O)-c1ccc(F)cc1	InChI=1S/C12H11FN2O3/c1-2-18-12(17)11-10(16)7-15(14-11)9-5-3-8(13)4-6-9/h3-7,16H,2H2,1H3	WRWOTBYUDNAZFR-UHFFFAOYSA-N	250.075370432							111314
SMR000067499	LSM-22771	SID3712754, BRD-A02534441	2998148	InChI=1S/C20H22N2O4S/c1-12-7-16(14(3)22(12)13(2)9-25-4)18(23)10-26-20(24)15-5-6-17-19(8-15)27-11-21-17/h5-8,11,13H,9-10H2,1-4H3	ZOILMRVXTXARLL-UHFFFAOYSA-N	COCC(C)n1c(C)cc(C(=O)COC(=O)c2ccc3ncsc3c2)c1C	BroadT	BRD-A02534441	BRD-A02534441-001-04-2	Enamine Ltd.	T5269120			COCC(C)n1c(C)cc(C(=O)COC(=O)c2ccc3ncsc3c2)c1C	InChI=1S/C20H22N2O4S/c1-12-7-16(14(3)22(12)13(2)9-25-4)18(23)10-26-20(24)15-5-6-17-19(8-15)27-11-21-17/h5-8,11,13H,9-10H2,1-4H3	ZOILMRVXTXARLL-UHFFFAOYSA-N	386.130027894							111315
4-(5,6-Dimethyl-1H-benzimidazol-1-yl)-5-phenylthieno[2,3-d]pyrimidine	LSM-22772	SID17415037, BRD-K15999772	1190256	InChI=1S/C21H16N4S/c1-13-8-17-18(9-14(13)2)25(12-24-17)20-19-16(15-6-4-3-5-7-15)10-26-21(19)23-11-22-20/h3-12H,1-2H3	JQSJRYIIMMVOBB-UHFFFAOYSA-N	Cc1cc2ncn(c3ncnc4scc(c5ccccc5)c34)c2cc1C	BroadT	BRD-K15999772	BRD-K15999772-001-05-6	ChemBridge Corporation	7176153			Cc1cc2ncn(-c3ncnc4scc(-c5ccccc5)c34)c2cc1C	InChI=1S/C21H16N4S/c1-13-8-17-18(9-14(13)2)25(12-24-17)20-19-16(15-6-4-3-5-7-15)10-26-21(19)23-11-22-20/h3-12H,1-2H3	JQSJRYIIMMVOBB-UHFFFAOYSA-N	356.109567242							111316
T5665623	LSM-22773	SID14744622, BRD-K99896754	2699975	InChI=1S/C19H22BrN3O2/c1-13-7-6-8-14(2)19(13)22-18(25)12-23(3)11-17(24)21-16-10-5-4-9-15(16)20/h4-10H,11-12H2,1-3H3,(H,21,24)(H,22,25)	FBXVTQQKABKSGF-UHFFFAOYSA-N	CN(CC(=O)Nc1ccccc1Br)CC(=O)Nc2c(C)cccc2C	BroadT	BRD-K99896754	BRD-K99896754-001-05-5	Enamine Ltd.	ZU-0141938			CN(CC(=O)Nc1ccccc1Br)CC(=O)Nc1c(C)cccc1C	InChI=1S/C19H22BrN3O2/c1-13-7-6-8-14(2)19(13)22-18(25)12-23(3)11-17(24)21-16-10-5-4-9-15(16)20/h4-10H,11-12H2,1-3H3,(H,21,24)(H,22,25)	FBXVTQQKABKSGF-UHFFFAOYSA-N	403.089539574							111317
AC1LBX68	LSM-15343	BRD-K47774638	565843	InChI=1S/C9H12N6S/c1-2-8-12-14-9(15(8)10)13-11-6-7-4-3-5-16-7/h3-6H,2,10H2,1H3,(H,13,14)	ZPURJGAZDHFZJW-UHFFFAOYSA-N	CCc1nnc(NN=Cc2cccs2)n1N	BroadT	BRD-K47774638	BRD-K47774638-003-05-5	Specs	AG-205/36953212		Cl	CCc1nnc(NN=Cc2cccs2)n1N.Cl	InChI=1S/C9H12N6S.ClH/c1-2-8-12-14-9(15(8)10)13-11-6-7-4-3-5-16-7;/h3-6H,2,10H2,1H3,(H,13,14);1H	NRYVCIJBHVSQRP-UHFFFAOYSA-N	236.084415134							103988
SMR000121999	LSM-22774	SID14727251, BRD-K67979626	1084322	InChI=1S/C11H11ClN4O/c1-2-16-9(5-6-14-16)11(17)15-10-4-3-8(12)7-13-10/h3-7H,2H2,1H3,(H,13,15,17)	MIQWXOOCLUJALO-UHFFFAOYSA-N	CCn1nccc1C(=O)Nc2ccc(Cl)cn2	BroadT	BRD-K67979626	BRD-K67979626-001-05-3	Asinex Ltd.	BAS 06332187			CCn1nccc1C(=O)Nc1ccc(Cl)cn1	InChI=1S/C11H11ClN4O/c1-2-16-9(5-6-14-16)11(17)15-10-4-3-8(12)7-13-10/h3-7H,2H2,1H3,(H,13,15,17)	MIQWXOOCLUJALO-UHFFFAOYSA-N	250.062138722							111318
ASN 06954838	LSM-22775	SID24801885, BRD-K34751288	1458414	InChI=1S/C14H15N3O3S2/c1-9(18)15-14-16-12(8-21-14)10-3-4-13-11(7-10)5-6-17(13)22(2,19)20/h3-4,7-8H,5-6H2,1-2H3,(H,15,16,18)	XAZFMIOYNXWNCL-UHFFFAOYSA-N	CC(=O)Nc1nc(cs1)c2ccc3N(CCc3c2)S(=O)(=O)C	BroadT	BRD-K34751288	BRD-K34751288-001-05-5	Asinex Ltd.	ASN 06954838			CC(=O)Nc1nc(cs1)-c1ccc2N(CCc2c1)S(C)(=O)=O	InChI=1S/C14H15N3O3S2/c1-9(18)15-14-16-12(8-21-14)10-3-4-13-11(7-10)5-6-17(13)22(2,19)20/h3-4,7-8H,5-6H2,1-2H3,(H,15,16,18)	XAZFMIOYNXWNCL-UHFFFAOYSA-N	337.05548275							111319
AC1MWSAB	LSM-15344	BRD-K28986887	3779146	InChI=1S/C15H22N2O3S/c1-10(2)6-7-20-13-5-4-11(9-21-15(16)17)8-12(13)14(18)19-3/h4-5,8,10H,6-7,9H2,1-3H3,(H3,16,17)	KTRMCWILXYBTEP-UHFFFAOYSA-N	COC(=O)c1cc(CSC(=N)N)ccc1OCCC(C)C	BroadT	BRD-K28986887	BRD-K28986887-003-05-6	InterBioScreen Ltd.	STOCK4S-37239		Cl	COC(=O)c1cc(CSC(N)=N)ccc1OCCC(C)C.Cl	InChI=1S/C15H22N2O3S.ClH/c1-10(2)6-7-20-13-5-4-11(9-21-15(16)17)8-12(13)14(18)19-3;/h4-5,8,10H,6-7,9H2,1-3H3,(H3,16,17);1H	YNOGAQKEVDPQRK-UHFFFAOYSA-N	310.135113274							131233, 131233
MLS000730561	LSM-22776	SID24810324, BRD-K51374612	16193062	InChI=1S/C21H25Cl2N3O/c1-15-5-6-20(19(23)11-15)25-21(27)24-13-16-7-9-26(10-8-16)14-17-3-2-4-18(22)12-17/h2-6,11-12,16H,7-10,13-14H2,1H3,(H2,24,25,27)	HZOLXPYFFFKORT-UHFFFAOYSA-N	Cc1ccc(NC(=O)NCC2CCN(Cc3cccc(Cl)c3)CC2)c(Cl)c1	BroadT	BRD-K51374612	BRD-K51374612-001-05-1	ChemDiv Inc.	C270-0548			Cc1ccc(NC(=O)NCC2CCN(Cc3cccc(Cl)c3)CC2)c(Cl)c1	InChI=1S/C21H25Cl2N3O/c1-15-5-6-20(19(23)11-15)25-21(27)24-13-16-7-9-26(10-8-16)14-17-3-2-4-18(22)12-17/h2-6,11-12,16H,7-10,13-14H2,1H3,(H2,24,25,27)	HZOLXPYFFFKORT-UHFFFAOYSA-N	405.13746787							111320
N-(6-Methoxypyridin-3-yl)thiophene-2-carboxamide	LSM-22777	SID26726475, BRD-K58708076	2747402	InChI=1S/C11H10N2O2S/c1-15-10-5-4-8(7-12-10)13-11(14)9-3-2-6-16-9/h2-7H,1H3,(H,13,14)	KYPSHZCQLRONKR-UHFFFAOYSA-N	COc1ccc(NC(=O)c2cccs2)cn1	BroadT	BRD-K58708076	BRD-K58708076-001-07-8	Maybridge	SPB 08388			COc1ccc(NC(=O)c2cccs2)cn1	InChI=1S/C11H10N2O2S/c1-15-10-5-4-8(7-12-10)13-11(14)9-3-2-6-16-9/h2-7H,1H3,(H,13,14)	KYPSHZCQLRONKR-UHFFFAOYSA-N	234.04629827							111321
MLS000733547	LSM-22778	SID24799924, BRD-K29390033	16191594	InChI=1S/C23H24F3NO2/c24-23(25,26)19-6-3-4-17(12-19)14-22(16-28)8-10-27(11-9-22)15-20-13-18-5-1-2-7-21(18)29-20/h1-7,12-13,28H,8-11,14-16H2	ZKLYGKBLLBOTEC-UHFFFAOYSA-N	OCC1(Cc2cccc(c2)C(F)(F)F)CCN(Cc3oc4ccccc4c3)CC1	BroadT	BRD-K29390033	BRD-K29390033-001-06-5	ChemBridge Corporation	63857884			OCC1(Cc2cccc(c2)C(F)(F)F)CCN(Cc2cc3ccccc3o2)CC1	InChI=1S/C23H24F3NO2/c24-23(25,26)19-6-3-4-17(12-19)14-22(16-28)8-10-27(11-9-22)15-20-13-18-5-1-2-7-21(18)29-20/h1-7,12-13,28H,8-11,14-16H2	ZKLYGKBLLBOTEC-UHFFFAOYSA-N	403.175913618							111322
N-(2-Hydroxy-5-methylphenyl)-2-furamide	LSM-22779	SID4259040, BRD-K55210119	2878765	InChI=1S/C12H11NO3/c1-8-4-5-10(14)9(7-8)13-12(15)11-3-2-6-16-11/h2-7,14H,1H3,(H,13,15)	RLKAWJIZIHNQHZ-UHFFFAOYSA-N	Cc1ccc(O)c(NC(=O)c2occc2)c1	BroadT	BRD-K55210119	BRD-K55210119-001-05-1	ChemBridge Corporation	5962524			Cc1ccc(O)c(NC(=O)c2ccco2)c1	InChI=1S/C12H11NO3/c1-8-4-5-10(14)9(7-8)13-12(15)11-3-2-6-16-11/h2-7,14H,1H3,(H,13,15)	RLKAWJIZIHNQHZ-UHFFFAOYSA-N	217.073893222							111323
AC1OAS35	LSM-22780	BRD-K90697663	6809445	InChI=1S/C14H19F2N3OS/c1-8(10-5-9(15)6-11(16)12(10)20)18-19-13(21)17-7-14(2,3)4/h5-6,20H,7H2,1-4H3,(H2,17,19,21)	AMAGDRKSRLIMBF-UHFFFAOYSA-N	CC(=NN=C(S)NCC(C)(C)C)c1cc(F)cc(F)c1O	BroadT	BRD-K90697663	BRD-K90697663-001-06-4	Maybridge	BTB 04138			CC(=NN=C(S)NCC(C)(C)C)c1cc(F)cc(F)c1O	InChI=1S/C14H19F2N3OS/c1-8(10-5-9(15)6-11(16)12(10)20)18-19-13(21)17-7-14(2,3)4/h5-6,20H,7H2,1-4H3,(H2,17,19,21)	AMAGDRKSRLIMBF-UHFFFAOYSA-N	315.121689348							
MLS000710898	LSM-22781	SID24783678, BRD-A49793373	3120237	InChI=1S/C18H17Cl2N3O5/c1-10(28-15-8-3-11(19)9-14(15)20)16(24)22-23-18(26)17(25)21-12-4-6-13(27-2)7-5-12/h3-10H,1-2H3,(H,21,25)(H,22,24)(H,23,26)	QOOYHJLOLPKPKP-UHFFFAOYSA-N	COc1ccc(NC(=O)C(=O)NNC(=O)C(C)Oc2ccc(Cl)cc2Cl)cc1	BroadT	BRD-A49793373	BRD-A49793373-001-06-6	Asinex Ltd.	BAS 00847850			COc1ccc(NC(=O)C(=O)NNC(=O)C(C)Oc2ccc(Cl)cc2Cl)cc1	InChI=1S/C18H17Cl2N3O5/c1-10(28-15-8-3-11(19)9-14(15)20)16(24)22-23-18(26)17(25)21-12-4-6-13(27-2)7-5-12/h3-10H,1-2H3,(H,21,25)(H,22,24)(H,23,26)	QOOYHJLOLPKPKP-UHFFFAOYSA-N	425.054526094							111325
MLS000402339	LSM-22782	SID24791682, BRD-K44512194	3676406	InChI=1S/C22H18ClN3O6S/c1-14-5-8-17(12-21(14)33(31,32)25-18-4-2-3-16(23)11-18)24-22(28)13-20(27)15-6-9-19(10-7-15)26(29)30/h2-12,25H,13H2,1H3,(H,24,28)	MOCJIIHPIBBYMI-UHFFFAOYSA-N	Cc1ccc(NC(=O)CC(=O)c2ccc(cc2)[N+](=O)[O-])cc1S(=O)(=O)Nc3cccc(Cl)c3	BroadT	BRD-K44512194	BRD-K44512194-001-05-2	Enamine Ltd.	T5224045			Cc1ccc(NC(=O)CC(=O)c2ccc(cc2)[N+]([O-])=O)cc1S(=O)(=O)Nc1cccc(Cl)c1	InChI=1S/C22H18ClN3O6S/c1-14-5-8-17(12-21(14)33(31,32)25-18-4-2-3-16(23)11-18)24-22(28)13-20(27)15-6-9-19(10-7-15)26(29)30/h2-12,25H,13H2,1H3,(H,24,28)	MOCJIIHPIBBYMI-UHFFFAOYSA-N	487.060483726							111326
STK285237	LSM-22783	SID24802247, BRD-K07574875	967793	InChI=1S/C19H21N3O3/c1-12-5-13(2)7-16(6-12)21-18(23)10-22-14(3)8-15(11-25-4)17(9-20)19(22)24/h5-8H,10-11H2,1-4H3,(H,21,23)	FHESDQOCRGRNBE-UHFFFAOYSA-N	COCC1=C(C#N)C(=O)N(CC(=O)Nc2cc(C)cc(C)c2)C(=C1)C	BroadT	BRD-K07574875	BRD-K07574875-001-05-3	Asinex Ltd.	BAS 07787075			COCc1cc(C)n(CC(=O)Nc2cc(C)cc(C)c2)c(=O)c1C#N	InChI=1S/C19H21N3O3/c1-12-5-13(2)7-16(6-12)21-18(23)10-22-14(3)8-15(11-25-4)17(9-20)19(22)24/h5-8H,10-11H2,1-4H3,(H,21,23)	FHESDQOCRGRNBE-UHFFFAOYSA-N	339.158291562							111327
AC1M5MVV	LSM-15550	BRD-K34133992	2381558	InChI=1S/C19H19ClN2O2/c20-15-8-9-17(21-18(23)13-22-10-4-5-11-22)16(12-15)19(24)14-6-2-1-3-7-14/h1-3,6-9,12H,4-5,10-11,13H2,(H,21,23)	MXXVQXHPBWSQQG-UHFFFAOYSA-N	Clc1ccc(NC(=O)CN2CCCC2)c(c1)C(=O)c3ccccc3	BroadT	BRD-K34133992	BRD-K34133992-034-06-2	Enamine Ltd.	T0506-8404		OC(=O)C(=O)O	Clc1ccc(NC(=O)CN2CCCC2)c(c1)C(=O)c1ccccc1.OC(=O)C(=O)O	InChI=1S/C19H19ClN2O2.C2H2O4/c20-15-8-9-17(21-18(23)13-22-10-4-5-11-22)16(12-15)19(24)14-6-2-1-3-7-14;3-1(4)2(5)6/h1-3,6-9,12H,4-5,10-11,13H2,(H,21,23);(H,3,4)(H,5,6)	XFECJNYYTWUNFL-UHFFFAOYSA-N	342.113505578							104186, 104186
[2-(2,3-Dimethoxyphenyl)-1,3-thiazol-4-yl]acetic acid	LSM-22784	SID3715833, BRD-K44133595	2526747	InChI=1S/C13H13NO4S/c1-17-10-5-3-4-9(12(10)18-2)13-14-8(7-19-13)6-11(15)16/h3-5,7H,6H2,1-2H3,(H,15,16)	SJLSXSKURJTDII-UHFFFAOYSA-N	COc1cccc(c1OC)c2nc(CC(=O)O)cs2	BroadT	BRD-K44133595	BRD-K44133595-001-05-2	Enamine Ltd.	T5334910			COc1cccc(-c2nc(CC(O)=O)cs2)c1OC	InChI=1S/C13H13NO4S/c1-17-10-5-3-4-9(12(10)18-2)13-14-8(7-19-13)6-11(15)16/h3-5,7H,6H2,1-2H3,(H,15,16)	SJLSXSKURJTDII-UHFFFAOYSA-N	279.056528596							111328
3-[(6-Methyl-4-phenylquinazolin-2-yl)amino]propan-1-ol	LSM-22785	SID14730461, BRD-K15800891	1943824	InChI=1S/C18H19N3O/c1-13-8-9-16-15(12-13)17(14-6-3-2-4-7-14)21-18(20-16)19-10-5-11-22/h2-4,6-9,12,22H,5,10-11H2,1H3,(H,19,20,21)	XDEQAODTFDNSFK-UHFFFAOYSA-N	Cc1ccc2nc(NCCCO)nc(c3ccccc3)c2c1	BroadT	BRD-K15800891	BRD-K15800891-001-05-2	InterBioScreen Ltd.	STOCK2S-90271			OCCCNc1nc(-c2ccccc2)c2cc(C)ccc2n1	InChI=1S/C18H19N3O/c1-13-8-9-16-15(12-13)17(14-6-3-2-4-7-14)21-18(20-16)19-10-5-11-22/h2-4,6-9,12,22H,5,10-11H2,1H3,(H,19,20,21)	XDEQAODTFDNSFK-UHFFFAOYSA-N	293.152812258							111329
MLS000681631	LSM-43979	SID24814700, SID87218885, BRD-K78289483	6477637	InChI=1S/C21H20O5/c1-25-19-11-13(3-7-17(19)22)9-15-5-6-16(21(15)24)10-14-4-8-18(23)20(12-14)26-2/h3-4,7-12,22-23H,5-6H2,1-2H3/b15-9-,16-10-	NZSRSKNDCCSSGY-VULZFCBJSA-N	COc1cc(\C=C/2\CC\C(=C\c3ccc(O)c(OC)c3)\C2=O)ccc1O	BroadT	BRD-K78289483	BRD-K78289483-001-08-0	ChemDiv Inc.	0203-0008			COc1cc(ccc1O)\C=C1\CC\C(C1=O)=C\c1ccc(O)c(OC)c1	InChI=1S/C21H20O5/c1-25-19-11-13(3-7-17(19)22)9-15-5-6-16(21(15)24)10-14-4-8-18(23)20(12-14)26-2/h3-4,7-12,22-23H,5-6H2,1-2H3/b15-9-,16-10-	NZSRSKNDCCSSGY-VULZFCBJSA-N	352.13107374							
MLS000559781	LSM-43980	BRD-A70198915	12004743	InChI=1S/C27H24N2O5S/c1-4-33-26(32)24-17(2)28-27-29(22(24)15-12-19-8-6-5-7-9-19)25(31)23(35-27)16-20-10-13-21(14-11-20)34-18(3)30/h5-16,22H,4H2,1-3H3/b15-12+,23-16?	RHJCNONRUZIWBT-PMRKBDKDSA-N	CCOC(=O)C1=C(C)N=C2SC(=Cc3ccc(OC(=O)C)cc3)C(=O)N2C1\C=C\c4ccccc4	BroadT	BRD-A70198915	BRD-A70198915-001-05-7	Asinex Ltd.	BAS 00664743			CCOC(=O)C1=C(C)N=c2sc(=Cc3ccc(OC(C)=O)cc3)c(=O)n2C1\C=C\c1ccccc1	InChI=1S/C27H24N2O5S/c1-4-33-26(32)24-17(2)28-27-29(22(24)15-12-19-8-6-5-7-9-19)25(31)23(35-27)16-20-10-13-21(14-11-20)34-18(3)30/h5-16,22H,4H2,1-3H3/b15-12+,23-16?	RHJCNONRUZIWBT-PMRKBDKDSA-N	488.140592578							
ZINC36080448	LSM-22788	BRD-K57183828	40586776	InChI=1S/C24H27N5O7/c1-14(2)13-36-24(32)27-19(10-16-12-25-18-7-5-4-6-17(16)18)23(31)28-26-11-15-8-20(29(33)34)22(30)21(9-15)35-3/h4-9,11-12,14,19,25,30H,10,13H2,1-3H3,(H,27,32)(H,28,31)/t19-/m0/s1	KOELPKSWMIZYTC-IBGZPJMESA-N	COc1cc(C=NNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OCC(C)C)cc(c1O)[N+](=O)[O-]	BroadT	BRD-K57183828	BRD-K57183828-001-05-0	InterBioScreen Ltd.	STOCK2S-13380			COc1cc(C=NNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OCC(C)C)cc(c1O)[N+]([O-])=O	InChI=1S/C24H27N5O7/c1-14(2)13-36-24(32)27-19(10-16-12-25-18-7-5-4-6-17(16)18)23(31)28-26-11-15-8-20(29(33)34)22(30)21(9-15)35-3/h4-9,11-12,14,19,25,30H,10,13H2,1-3H3,(H,27,32)(H,28,31)/t19-/m0/s1	KOELPKSWMIZYTC-IBGZPJMESA-N	497.191048254							
ST50070396	LSM-22789	SID24811954, BRD-K78009256	1522642	InChI=1S/C23H22N4O/c1-17-6-5-9-19(14-17)27-15-20(18-7-3-2-4-8-18)21-22(24-16-25-23(21)27)26-10-12-28-13-11-26/h2-9,14-16H,10-13H2,1H3	UYMPTKIKEQDZNI-UHFFFAOYSA-N	Cc1cccc(c1)n2cc(c3ccccc3)c4c(ncnc24)N5CCOCC5	BroadT	BRD-K78009256	BRD-K78009256-001-06-1	ChemDiv Inc.	K405-0676			Cc1cccc(c1)-n1cc(-c2ccccc2)c2c(ncnc12)N1CCOCC1	InChI=1S/C23H22N4O/c1-17-6-5-9-19(14-17)27-15-20(18-7-3-2-4-8-18)21-22(24-16-25-23(21)27)26-10-12-28-13-11-26/h2-9,14-16H,10-13H2,1H3	UYMPTKIKEQDZNI-UHFFFAOYSA-N	370.179361364							111333
AMBCB96609086	LSM-22790	SID24799757, BRD-K63578852	16191427	InChI=1S/C25H29F3N2O/c1-18-22(21-8-3-4-9-23(21)29(18)2)16-30-12-10-24(17-31,11-13-30)15-19-6-5-7-20(14-19)25(26,27)28/h3-9,14,31H,10-13,15-17H2,1-2H3	XUPRUNUGPGVWPP-UHFFFAOYSA-N	Cc1c(CN2CCC(CO)(Cc3cccc(c3)C(F)(F)F)CC2)c4ccccc4n1C	BroadT	BRD-K63578852	BRD-K63578852-001-06-0	ChemBridge Corporation	96609086			Cc1c(CN2CCC(CO)(Cc3cccc(c3)C(F)(F)F)CC2)c2ccccc2n1C	InChI=1S/C25H29F3N2O/c1-18-22(21-8-3-4-9-23(21)29(18)2)16-30-12-10-24(17-31,11-13-30)15-19-6-5-7-20(14-19)25(26,27)28/h3-9,14,31H,10-13,15-17H2,1-2H3	XUPRUNUGPGVWPP-UHFFFAOYSA-N	430.223198168							111334
AC1LX9EZ	LSM-22791	BRD-K76572740	1747923	InChI=1S/C23H19N3O2S/c1-15-11-12-29-22(15)14-24-26-23(27)18-13-20(17-8-4-6-10-21(17)28-2)25-19-9-5-3-7-16(18)19/h3-14H,1-2H3,(H,26,27)	DNYGCFCSLRQZIP-UHFFFAOYSA-N	COc1ccccc1c2cc(C(=O)NN=Cc3sccc3C)c4ccccc4n2	BroadT	BRD-K76572740	BRD-K76572740-001-05-6	Specs	AK-968/15606112			COc1ccccc1-c1cc(C(=O)NN=Cc2sccc2C)c2ccccc2n1	InChI=1S/C23H19N3O2S/c1-15-11-12-29-22(15)14-24-26-23(27)18-13-20(17-8-4-6-10-21(17)28-2)25-19-9-5-3-7-16(18)19/h3-14H,1-2H3,(H,26,27)	DNYGCFCSLRQZIP-UHFFFAOYSA-N	401.119797568							111335
MLS000674448	LSM-22792	BRD-K53643174, SID24793305	6409328	InChI=1S/C20H14N4/c1-3-7-15(8-4-1)18-19(16-9-5-2-6-10-16)23-24-20(22-18)17-11-13-21-14-12-17/h1-14H	HSJXYUNRWXCLBY-UHFFFAOYSA-N	c1ccc(cc1)c2nnc(nc2c3ccccc3)c4ccncc4	BroadT	BRD-K53643174	BRD-K53643174-001-06-5	ChemBridge Corporation	9029830			c1ccc(cc1)-c1nnc(nc1-c1ccccc1)-c1ccncc1	InChI=1S/C20H14N4/c1-3-7-15(8-4-1)18-19(16-9-5-2-6-10-16)23-24-20(22-18)17-11-13-21-14-12-17/h1-14H	HSJXYUNRWXCLBY-UHFFFAOYSA-N	310.121846488							111336
N-Benzoyl-n'-(3-nitrophenyl)thiourea	LSM-22793	SID26727708, BRD-K73597112	708498	InChI=1S/C14H11N3O3S/c18-13(10-5-2-1-3-6-10)16-14(21)15-11-7-4-8-12(9-11)17(19)20/h1-9H,(H2,15,16,18,21)	ISNKGMPVWYMBRJ-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(NC(=S)NC(=O)c2ccccc2)c1	BroadT	BRD-K73597112	BRD-K73597112-001-05-6	Maybridge	S 02660			[O-][N+](=O)c1cccc(NC(=S)NC(=O)c2ccccc2)c1	InChI=1S/C14H11N3O3S/c18-13(10-5-2-1-3-6-10)16-14(21)15-11-7-4-8-12(9-11)17(19)20/h1-9H,(H2,15,16,18,21)	ISNKGMPVWYMBRJ-UHFFFAOYSA-N	301.052111932							111337
AC1LISC3	LSM-22794	BRD-K14766223	937175	InChI=1S/C10H12N6O2/c1-2-18-9-4-3-7(5-8(9)17)6-12-16-10(11)13-14-15-16/h3-6,17H,2H2,1H3,(H2,11,13,15)	FBUPUTUNMNFNGW-UHFFFAOYSA-N	CCOc1ccc(C=Nn2nnnc2N)cc1O	BroadT	BRD-K14766223	BRD-K14766223-001-05-5	InterBioScreen Ltd.	STOCK4S-21422			CCOc1ccc(C=Nn2nnnc2N)cc1O	InChI=1S/C10H12N6O2/c1-2-18-9-4-3-7(5-8(9)17)6-12-16-10(11)13-14-15-16/h3-6,17H,2H2,1H3,(H2,11,13,15)	FBUPUTUNMNFNGW-UHFFFAOYSA-N	248.102173684							111338
SMR000029212	LSM-22795	SID4243532, BRD-K11397223	3238241	InChI=1S/C21H18N2O5/c1-26-17-10-6-4-8-14(17)22-19(24)12-23-15(21(25)27-2)11-18-20(23)13-7-3-5-9-16(13)28-18/h3-11H,12H2,1-2H3,(H,22,24)	CHMRNDLQEDOFJO-UHFFFAOYSA-N	COC(=O)c1cc2oc3ccccc3c2n1CC(=O)Nc4ccccc4OC	BroadT	BRD-K11397223	BRD-K11397223-001-05-2	ChemDiv Inc.	C794-0093			COC(=O)c1cc2oc3ccccc3c2n1CC(=O)Nc1ccccc1OC	InChI=1S/C21H18N2O5/c1-26-17-10-6-4-8-14(17)22-19(24)12-23-15(21(25)27-2)11-18-20(23)13-7-3-5-9-16(13)28-18/h3-11H,12H2,1-2H3,(H,22,24)	CHMRNDLQEDOFJO-UHFFFAOYSA-N	378.121571696							111339
STK131095	LSM-22796	SID852997, SID7967153, BRD-K08356368	655640	InChI=1S/C19H21N3O4S2/c1-3-21(4-2)28(25,26)15-11-9-14(10-12-15)20-18(23)13-22-16-7-5-6-8-17(16)27-19(22)24/h5-12H,3-4,13H2,1-2H3,(H,20,23)	SDNZGKCNHJCEGF-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2C(=O)Sc3ccccc23)cc1	BroadT	BRD-K08356368	BRD-K08356368-001-06-6	Asinex Ltd.	BAS 07459882			CCN(CC)S(=O)(=O)c1ccc(NC(=O)Cn2c3ccccc3sc2=O)cc1	InChI=1S/C19H21N3O4S2/c1-3-21(4-2)28(25,26)15-11-9-14(10-12-15)20-18(23)13-22-16-7-5-6-8-17(16)27-19(22)24/h5-12H,3-4,13H2,1-2H3,(H,20,23)	SDNZGKCNHJCEGF-UHFFFAOYSA-N	419.097347562							111340
T5289394	LSM-22797	SID3716094, BRD-K54005035	2367137	InChI=1S/C20H22N4O5/c1-23-18(21)17(19(27)24(2)20(23)28)15(25)11-29-16(26)9-5-6-12-10-22-14-8-4-3-7-13(12)14/h3-4,7-8,10,22H,5-6,9,11,21H2,1-2H3	AYSJAJQRWZRMLC-UHFFFAOYSA-N	CN1C(=C(C(=O)COC(=O)CCCc2c[nH]c3ccccc23)C(=O)N(C)C1=O)N	BroadT	BRD-K54005035	BRD-K54005035-001-05-7	Enamine Ltd.	T0509-8886			Cn1c(N)c(C(=O)COC(=O)CCCc2c[nH]c3ccccc23)c(=O)n(C)c1=O	InChI=1S/C20H22N4O5/c1-23-18(21)17(19(27)24(2)20(23)28)15(25)11-29-16(26)9-5-6-12-10-22-14-8-4-3-7-13(12)14/h3-4,7-8,10,22H,5-6,9,11,21H2,1-2H3	AYSJAJQRWZRMLC-UHFFFAOYSA-N	398.159019844							111341
HMS2286E23	LSM-43981	BRD-A24354128	11948856	InChI=1S/C21H25N3OS/c1-13-6-5-7-14(10-13)11-16-18(25)22-19(26-16)24-23-17-12-15-8-9-21(17,4)20(15,2)3/h5-7,10-11,15H,8-9,12H2,1-4H3,(H,22,24,25)/b16-11+,23-17?	KIKZTEFIKRIYPY-NBDIUVDISA-N	Cc1cccc(\C=C/2\SC(=NC2=O)NN=C3CC4CCC3(C)C4(C)C)c1	BroadT	BRD-A24354128	BRD-A24354128-001-06-4	Specs	AK-968/13024032			Cc1cccc(\C=C2\SC(NN=C3CC4CCC3(C)C4(C)C)=NC2=O)c1	InChI=1S/C21H25N3OS/c1-13-6-5-7-14(10-13)11-16-18(25)22-19(26-16)24-23-17-12-15-8-9-21(17,4)20(15,2)3/h5-7,10-11,15H,8-9,12H2,1-4H3,(H,22,24,25)/b16-11+,23-17?	KIKZTEFIKRIYPY-NBDIUVDISA-N	367.17183314							
SMR000039454	LSM-22799	SID857159, BRD-K63954280	6400919	InChI=1S/C12H13N3/c1-3-8-13-12-11-7-5-4-6-10(11)9(2)14-15-12/h3-7H,1,8H2,2H3,(H,13,15)	MGJMAATXYOZQJS-UHFFFAOYSA-N	Cc1nnc(NCC=C)c2ccccc12	BroadT	BRD-K63954280	BRD-K63954280-001-05-7	InterBioScreen Ltd.	STOCK1S-56315			Cc1nnc(NCC=C)c2ccccc12	InChI=1S/C12H13N3/c1-3-8-13-12-11-7-5-4-6-10(11)9(2)14-15-12/h3-7H,1,8H2,2H3,(H,13,15)	MGJMAATXYOZQJS-UHFFFAOYSA-N	199.110947446							111343
AC1NSEZN	LSM-22800	SID7967004, BRD-A59042375	5308562	InChI=1S/C26H38N4O4/c1-4-34-26(33)29-12-9-21(10-13-29)30-17-20-6-5-7-22(23(20)25(30)32)24(31)27-14-19-8-11-28(16-19)15-18(2)3/h5-7,18-19,21H,4,8-17H2,1-3H3,(H,27,31)	JKIWFSPGYAUEPD-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)N2Cc3cccc(C(=O)NCC4CCN(CC(C)C)C4)c3C2=O	BroadT	BRD-A59042375	BRD-A59042375-001-04-8	ChemDiv Inc.	C447-1550			CCOC(=O)N1CCC(CC1)N1Cc2cccc(C(=O)NCC3CCN(CC(C)C)C3)c2C1=O	InChI=1S/C26H38N4O4/c1-4-34-26(33)29-12-9-21(10-13-29)30-17-20-6-5-7-22(23(20)25(30)32)24(31)27-14-19-8-11-28(16-19)15-18(2)3/h5-7,18-19,21H,4,8-17H2,1-3H3,(H,27,31)	JKIWFSPGYAUEPD-UHFFFAOYSA-N	470.289305736							111344
SMR000032936	LSM-22801	SID4242096, BRD-A03900096	5771307	InChI=1S/C14H16N4OS/c1-9-8-12(10-4-6-11(19-2)7-5-10)18-13(15-9)16-14(17-18)20-3/h4-8,12H,1-3H3,(H,15,16,17)	CYRINNQESKZHGL-UHFFFAOYSA-N	COc1ccc(cc1)C2C=C(C)Nc3nc(SC)nn23	BroadT	BRD-A03900096	BRD-A03900096-001-05-9	ChemDiv Inc.	K832-3038			COc1ccc(cc1)C1C=C(C)Nc2nc(SC)nn12	InChI=1S/C14H16N4OS/c1-9-8-12(10-4-6-11(19-2)7-5-10)18-13(15-9)16-14(17-18)20-3/h4-8,12H,1-3H3,(H,15,16,17)	CYRINNQESKZHGL-UHFFFAOYSA-N	288.104481862							111345
SMR000000429	LSM-22802	SID844845, BRD-K81477330	647179	InChI=1S/C19H27N3O2/c23-17(22-13-7-8-14-22)19(11-5-2-6-12-19)21-18(24)20-15-16-9-3-1-4-10-16/h1,3-4,9-10H,2,5-8,11-15H2,(H2,20,21,24)	MAOPJHOUQJUPDK-UHFFFAOYSA-N	O=C(NCc1ccccc1)NC2(CCCCC2)C(=O)N3CCCC3	BroadT	BRD-K81477330	BRD-K81477330-001-04-0	Asinex Ltd.	ASN 08828749			O=C(NCc1ccccc1)NC1(CCCCC1)C(=O)N1CCCC1	InChI=1S/C19H27N3O2/c23-17(22-13-7-8-14-22)19(11-5-2-6-12-19)21-18(24)20-15-16-9-3-1-4-10-16/h1,3-4,9-10H,2,5-8,11-15H2,(H2,20,21,24)	MAOPJHOUQJUPDK-UHFFFAOYSA-N	329.210327134							111346
MLS001010720	LSM-22803	SID24835149, BRD-A28734536	4880443	InChI=1S/C17H26ClN3O3/c1-5-20-6-8-21(9-7-20)17(22)12(2)19-14-10-13(18)15(23-3)11-16(14)24-4/h10-12,19H,5-9H2,1-4H3	CCRQIVPKRVZJGE-UHFFFAOYSA-N	CCN1CCN(CC1)C(=O)C(C)Nc2cc(Cl)c(OC)cc2OC	BroadT	BRD-A28734536	BRD-A28734536-001-05-1	Enamine Ltd.	T5319139			CCN1CCN(CC1)C(=O)C(C)Nc1cc(Cl)c(OC)cc1OC	InChI=1S/C17H26ClN3O3/c1-5-20-6-8-21(9-7-20)17(22)12(2)19-14-10-13(18)15(23-3)11-16(14)24-4/h10-12,19H,5-9H2,1-4H3	CCRQIVPKRVZJGE-UHFFFAOYSA-N	355.166269432							111347
MLS000660666	LSM-22804	SID24791219, BRD-K27280726	16189639	InChI=1S/C25H28N4O5/c1-33-20-10-7-16(14-21(20)34-2)11-12-26-23(30)24(31)27-17-8-9-19-18(15-17)25(32)29-13-5-3-4-6-22(29)28-19/h7-10,14-15H,3-6,11-13H2,1-2H3,(H,26,30)(H,27,31)	AJWSMLZKBWKPDH-UHFFFAOYSA-N	COc1ccc(CCNC(=O)C(=O)Nc2ccc3N=C4CCCCCN4C(=O)c3c2)cc1OC	BroadT	BRD-K27280726	BRD-K27280726-001-06-2	ChemDiv Inc.	C909-0057			COc1ccc(CCNC(=O)C(=O)Nc2ccc3nc4CCCCCn4c(=O)c3c2)cc1OC	InChI=1S/C25H28N4O5/c1-33-20-10-7-16(14-21(20)34-2)11-12-26-23(30)24(31)27-17-8-9-19-18(15-17)25(32)29-13-5-3-4-6-22(29)28-19/h7-10,14-15H,3-6,11-13H2,1-2H3,(H,26,30)(H,27,31)	AJWSMLZKBWKPDH-UHFFFAOYSA-N	464.205970036							111348
MLS000056380	LSM-22805	SID3712176, BRD-K95758694	2086442	InChI=1S/C15H10N4O3S/c16-7-11-5-6-23-15(11)18-13(20)8-21-12-3-1-10(2-4-12)14-19-17-9-22-14/h1-6,9H,8H2,(H,18,20)	NBPYPVKMRZJRLR-UHFFFAOYSA-N	O=C(COc1ccc(cc1)c2ocnn2)Nc3sccc3C#N	BroadT	BRD-K95758694	BRD-K95758694-001-05-4	Enamine Ltd.	T5263851			O=C(COc1ccc(cc1)-c1nnco1)Nc1sccc1C#N	InChI=1S/C15H10N4O3S/c16-7-11-5-6-23-15(11)18-13(20)8-21-12-3-1-10(2-4-12)14-19-17-9-22-14/h1-6,9H,8H2,(H,18,20)	NBPYPVKMRZJRLR-UHFFFAOYSA-N	326.04736091							111349
MLS000085743	LSM-22806	SID4252418, BRD-K98672366	672465	InChI=1S/C14H16N2O4S/c1-3-19-12(17)9-21-13-15-10-7-5-6-8-11(10)16(13)14(18)20-4-2/h5-8H,3-4,9H2,1-2H3	QFHWKOBKNPQMBR-UHFFFAOYSA-N	CCOC(=O)CSc1nc2ccccc2n1C(=O)OCC	BroadT	BRD-K98672366	BRD-K98672366-001-05-1	ChemDiv Inc.	8008-9605			CCOC(=O)CSc1nc2ccccc2n1C(=O)OCC	InChI=1S/C14H16N2O4S/c1-3-19-12(17)9-21-13-15-10-7-5-6-8-11(10)16(13)14(18)20-4-2/h5-8H,3-4,9H2,1-2H3	QFHWKOBKNPQMBR-UHFFFAOYSA-N	308.083077702							111350
MLS000699064	LSM-22807	SID22413700, BRD-K01868680	585916	InChI=1S/C28H40O10/c1-3-7-27-25(5-1)35-21-17-31-13-11-29-9-10-30-12-14-32-18-22-36-26-6-2-4-8-28(26)38-24-20-34-16-15-33-19-23-37-27/h1-8H,9-24H2	GLWJYTMHGPSPNN-UHFFFAOYSA-N	C1COCCOCCOc2ccccc2OCCOCCOCCOc3ccccc3OCCOCCO1	BroadT	BRD-K01868680	BRD-K01868680-001-05-0	Specs	AF-962/32161016			C1COCCOCCOc2ccccc2OCCOCCOCCOc2ccccc2OCCOCCO1	InChI=1S/C28H40O10/c1-3-7-27-25(5-1)35-21-17-31-13-11-29-9-10-30-12-14-32-18-22-36-26-6-2-4-8-28(26)38-24-20-34-16-15-33-19-23-37-27/h1-8H,9-24H2	GLWJYTMHGPSPNN-UHFFFAOYSA-N	536.26214748							111351
AC1LFIA9	LSM-22808	BRD-K94632294	803424	InChI=1S/C11H8BrN3O2/c12-10-5-4-9(17-10)11(16)15-14-7-8-3-1-2-6-13-8/h1-7H,(H,15,16)	PEYBDTARUCNLSQ-UHFFFAOYSA-N	Brc1oc(cc1)C(=O)NN=Cc2ccccn2	BroadT	BRD-K94632294	BRD-K94632294-001-05-6	Asinex Ltd.	BAS 00541958			Brc1ccc(o1)C(=O)NN=Cc1ccccn1	InChI=1S/C11H8BrN3O2/c12-10-5-4-9(17-10)11(16)15-14-7-8-3-1-2-6-13-8/h1-7H,(H,15,16)	PEYBDTARUCNLSQ-UHFFFAOYSA-N	292.979989126							111352
SMR000004385	LSM-22809	SID26668996, SID852015, BRD-A44736730	654622	InChI=1S/C28H30N6O3/c1-3-26(27-30-31-32-34(27)19-24-10-7-15-37-24)33(14-13-20-8-5-4-6-9-20)18-22-16-21-11-12-23(36-2)17-25(21)29-28(22)35/h4-12,15-17,26H,3,13-14,18-19H2,1-2H3,(H,29,35)	SSZOIAVMSLBHAT-UHFFFAOYSA-N	CCC(N(CCc1ccccc1)Cc2cc3ccc(OC)cc3nc2O)c4nnnn4Cc5occc5	BroadT	BRD-A44736730	BRD-A44736730-001-05-0	Asinex Ltd.	ASN 05299913			CCC(N(CCc1ccccc1)Cc1cc2ccc(OC)cc2nc1O)c1nnnn1Cc1ccco1	InChI=1S/C28H30N6O3/c1-3-26(27-30-31-32-34(27)19-24-10-7-15-37-24)33(14-13-20-8-5-4-6-9-20)18-22-16-21-11-12-23(36-2)17-25(21)29-28(22)35/h4-12,15-17,26H,3,13-14,18-19H2,1-2H3,(H,29,35)	SSZOIAVMSLBHAT-UHFFFAOYSA-N	498.23793888							111353
AC1MRMSP	LSM-22810	SID14734077, BRD-A34206667	3520518	InChI=1S/C22H25N3O2/c1-2-16-9-11-17(12-10-16)14-23-21(26)18-6-5-13-25(15-18)22-24-19-7-3-4-8-20(19)27-22/h3-4,7-12,18H,2,5-6,13-15H2,1H3,(H,23,26)	CCDNBVPVBLTBBG-UHFFFAOYSA-N	CCc1ccc(CNC(=O)C2CCCN(C2)c3oc4ccccc4n3)cc1	BroadT	BRD-A34206667	BRD-A34206667-001-05-3	ChemDiv Inc.	K786-3315			CCc1ccc(CNC(=O)C2CCCN(C2)c2nc3ccccc3o2)cc1	InChI=1S/C22H25N3O2/c1-2-16-9-11-17(12-10-16)14-23-21(26)18-6-5-13-25(15-18)22-24-19-7-3-4-8-20(19)27-22/h3-4,7-12,18H,2,5-6,13-15H2,1H3,(H,23,26)	CCDNBVPVBLTBBG-UHFFFAOYSA-N	363.19467707							111354
SMR000035806	LSM-22811	SID861745, BRD-K90420105	662977	InChI=1S/C16H12N4OS/c1-21-13-9-7-12(8-10-13)15-19-20-14(17-18-16(20)22-15)11-5-3-2-4-6-11/h2-10H,1H3	OYYTYUQHNVLXFT-UHFFFAOYSA-N	COc1ccc(cc1)c2nn3c(nnc3s2)c4ccccc4	BroadT	BRD-K90420105	BRD-K90420105-001-05-9	InterBioScreen Ltd.	STOCK4S-19787			COc1ccc(cc1)-c1nn2c(nnc2s1)-c1ccccc1	InChI=1S/C16H12N4OS/c1-21-13-9-7-12(8-10-13)15-19-20-14(17-18-16(20)22-15)11-5-3-2-4-6-11/h2-10H,1H3	OYYTYUQHNVLXFT-UHFFFAOYSA-N	308.073181734							111355
1-((2,5-Dimethoxyphenyl)sulfonyl)-4-benzylpiperazine	LSM-22812	SID47202918, BRD-K89429521	1106577	InChI=1S/C19H24N2O4S/c1-24-17-8-9-18(25-2)19(14-17)26(22,23)21-12-10-20(11-13-21)15-16-6-4-3-5-7-16/h3-9,14H,10-13,15H2,1-2H3	FUJCDSZTDSDGBB-UHFFFAOYSA-N	COc1ccc(OC)c(c1)S(=O)(=O)N2CCN(Cc3ccccc3)CC2	BroadT	BRD-K89429521	BRD-K89429521-001-05-9	Asinex Ltd.	BAS 00804306			COc1ccc(OC)c(c1)S(=O)(=O)N1CCN(Cc2ccccc2)CC1	InChI=1S/C19H24N2O4S/c1-24-17-8-9-18(25-2)19(14-17)26(22,23)21-12-10-20(11-13-21)15-16-6-4-3-5-7-16/h3-9,14H,10-13,15H2,1-2H3	FUJCDSZTDSDGBB-UHFFFAOYSA-N	376.145677958							111356
STK872973	LSM-22813	BRD-K43507120	2152382	InChI=1S/C29H25ClFN5O5/c1-5-40-29(39)18-13-17-25(32-21-11-6-7-12-35(21)28(17)38)36(14-15(2)3)26(18)33-27(37)22-16(4)41-34-24(22)23-19(30)9-8-10-20(23)31/h6-13,15H,5,14H2,1-4H3	HOBSIHMXRZQPFM-UHFFFAOYSA-N	CCOC(=O)C1=CC2=C(N=C3C=CC=CN3C2=O)N(CC(C)C)C1=NC(=O)c4c(C)onc4c5c(F)cccc5Cl	BroadT	BRD-K43507120	BRD-K43507120-001-06-0	Life Chemicals Inc.	F0565-0389			CCOC(=O)c1cc2c(nc3ccccn3c2=O)n(CC(C)C)c1=NC(=O)c1c(C)onc1-c1c(F)cccc1Cl	InChI=1S/C29H25ClFN5O5/c1-5-40-29(39)18-13-17-25(32-21-11-6-7-12-35(21)28(17)38)36(14-15(2)3)26(18)33-27(37)22-16(4)41-34-24(22)23-19(30)9-8-10-20(23)31/h6-13,15H,5,14H2,1-4H3	HOBSIHMXRZQPFM-UHFFFAOYSA-N	577.15282486							111357
6-(Chloromethyl)-n-(2,5-dimethoxyphenyl)-1,3,5-triazine-2,4-diamine	LSM-22814	SID26662312, BRD-K46993292	715055	InChI=1S/C12H14ClN5O2/c1-19-7-3-4-9(20-2)8(5-7)15-12-17-10(6-13)16-11(14)18-12/h3-5H,6H2,1-2H3,(H3,14,15,16,17,18)	LRMITMUUQVAMMW-UHFFFAOYSA-N	COc1ccc(OC)c(Nc2nc(N)nc(CCl)n2)c1	BroadT	BRD-K46993292	BRD-K46993292-001-06-1	InterBioScreen Ltd.	STOCK4S-09694			COc1ccc(OC)c(Nc2nc(N)nc(CCl)n2)c1	InChI=1S/C12H14ClN5O2/c1-19-7-3-4-9(20-2)8(5-7)15-12-17-10(6-13)16-11(14)18-12/h3-5H,6H2,1-2H3,(H3,14,15,16,17,18)	LRMITMUUQVAMMW-UHFFFAOYSA-N	295.083602448							111358
BAS 00779103	LSM-43982	SID24804541, BRD-K60853704	1951245	InChI=1S/C19H23N3O2S2/c1-14-3-5-15(6-4-14)13-16-18(24)22(19(25)26-16)8-7-17(23)21-11-9-20(2)10-12-21/h3-6,13H,7-12H2,1-2H3/b16-13+	LLYNLQDHLONHOO-DTQAZKPQSA-N	CN1CCN(CC1)C(=O)CCN2C(=S)S\C(=C\c3ccc(C)cc3)\C2=O	BroadT	BRD-K60853704	BRD-K60853704-001-05-2	Asinex Ltd.	BAS 00779103			CN1CCN(CC1)C(=O)CCN1C(=S)S\C(=C\c2ccc(C)cc2)C1=O	InChI=1S/C19H23N3O2S2/c1-14-3-5-15(6-4-14)13-16-18(24)22(19(25)26-16)8-7-17(23)21-11-9-20(2)10-12-21/h3-6,13H,7-12H2,1-2H3/b16-13+	LLYNLQDHLONHOO-DTQAZKPQSA-N	389.123168386							
3-(4,8-Dimethyl-quinolin-2-ylsulfanyl)-propionic acid	LSM-22816	SID14720500, BRD-K55545301	744542	InChI=1S/C14H15NO2S/c1-9-4-3-5-11-10(2)8-12(15-14(9)11)18-7-6-13(16)17/h3-5,8H,6-7H2,1-2H3,(H,16,17)	UKJHYMDKFLEBCX-UHFFFAOYSA-N	Cc1cccc2c(C)cc(SCCC(=O)O)nc12	BroadT	BRD-K55545301	BRD-K55545301-001-06-6	Asinex Ltd.	BAS 02839802			Cc1cccc2c(C)cc(SCCC(O)=O)nc12	InChI=1S/C14H15NO2S/c1-9-4-3-5-11-10(2)8-12(15-14(9)11)18-7-6-13(16)17/h3-5,8H,6-7H2,1-2H3,(H,16,17)	UKJHYMDKFLEBCX-UHFFFAOYSA-N	261.08234942							111360
MLS000575713	LSM-22817	SID17412472, BRD-K91714046	1045434	InChI=1S/C25H14BrNO5/c26-18-9-17(12-27-13-18)25(29)32-20-7-8-21-22(11-20)30-14-23(24(21)28)31-19-6-5-15-3-1-2-4-16(15)10-19/h1-14H	BFZHTVPRXCNENQ-UHFFFAOYSA-N	Brc1cncc(c1)C(=O)Oc2ccc3C(=O)C(=COc3c2)Oc4ccc5ccccc5c4	BroadT	BRD-K91714046	BRD-K91714046-001-05-6	ChemBridge Corporation	6943710			Brc1cncc(c1)C(=O)Oc1ccc2c(c1)occ(Oc1ccc3ccccc3c1)c2=O	InChI=1S/C25H14BrNO5/c26-18-9-17(12-27-13-18)25(29)32-20-7-8-21-22(11-20)30-14-23(24(21)28)31-19-6-5-15-3-1-2-4-16(15)10-19/h1-14H	BFZHTVPRXCNENQ-UHFFFAOYSA-N	487.005535158							111361
AMBCB49307359	LSM-22818	SID24800007, BRD-K70885118	16191677	InChI=1S/C26H30N2O3/c1-3-31-25(29)26(17-20-6-4-9-23(16-20)30-2)11-14-28(15-12-26)19-22-8-5-7-21-18-27-13-10-24(21)22/h4-10,13,16,18H,3,11-12,14-15,17,19H2,1-2H3	IPPZMTWLYBHXSZ-UHFFFAOYSA-N	CCOC(=O)C1(Cc2cccc(OC)c2)CCN(Cc3cccc4cnccc34)CC1	BroadT	BRD-K70885118	BRD-K70885118-001-05-2	ChemBridge Corporation	49307359			CCOC(=O)C1(Cc2cccc(OC)c2)CCN(Cc2cccc3cnccc23)CC1	InChI=1S/C26H30N2O3/c1-3-31-25(29)26(17-20-6-4-9-23(16-20)30-2)11-14-28(15-12-26)19-22-8-5-7-21-18-27-13-10-24(21)22/h4-10,13,16,18H,3,11-12,14-15,17,19H2,1-2H3	IPPZMTWLYBHXSZ-UHFFFAOYSA-N	418.22564284							111362
SMR000063971	LSM-43983	SID3713136, BRD-K84450572	2128917	InChI=1S/C16H16F2N2O5S/c1-2-24-15(23)7-14-20(13(22)9-26-14)8-12(21)19-10-5-3-4-6-11(10)25-16(17)18/h3-7,16H,2,8-9H2,1H3,(H,19,21)/b14-7-	PSEUNLFDCXCPRW-AUWJEWJLSA-N	CCOC(=O)\C=C\1/SCC(=O)N1CC(=O)Nc2ccccc2OC(F)F	BroadT	BRD-K84450572	BRD-K84450572-001-05-8	Enamine Ltd.	T5256236			CCOC(=O)\C=C1/SCC(=O)N1CC(=O)Nc1ccccc1OC(F)F	InChI=1S/C16H16F2N2O5S/c1-2-24-15(23)7-14-20(13(22)9-26-14)8-12(21)19-10-5-3-4-6-11(10)25-16(17)18/h3-7,16H,2,8-9H2,1H3,(H,19,21)/b14-7-	PSEUNLFDCXCPRW-AUWJEWJLSA-N	386.074798722							
SMR000121590	LSM-22820	SID14726968, BRD-A34416461	3193750	InChI=1S/C22H28ClN5OS/c1-22(2,3)28-21(24-25-26-28)20(19-7-5-13-30-19)27(15-18-6-4-12-29-18)14-16-8-10-17(23)11-9-16/h5,7-11,13,18,20H,4,6,12,14-15H2,1-3H3	PKDQPZHGBXEAQY-UHFFFAOYSA-N	CC(C)(C)n1nnnc1C(N(CC2CCCO2)Cc3ccc(Cl)cc3)c4cccs4	BroadT	BRD-A34416461	BRD-A34416461-001-06-4	Asinex Ltd.	ASN 05094502			CC(C)(C)n1nnnc1C(N(CC1CCCO1)Cc1ccc(Cl)cc1)c1cccs1	InChI=1S/C22H28ClN5OS/c1-22(2,3)28-21(24-25-26-28)20(19-7-5-13-30-19)27(15-18-6-4-12-29-18)14-16-8-10-17(23)11-9-16/h5,7-11,13,18,20H,4,6,12,14-15H2,1-3H3	PKDQPZHGBXEAQY-UHFFFAOYSA-N	445.170308966							111364
AC1LOD2B	LSM-22821	BRD-K69492603	1237709	InChI=1S/C20H14ClN3O3/c21-17-6-2-1-5-16(17)20(26)27-15-10-8-14(9-11-15)13-23-24-19(25)18-7-3-4-12-22-18/h1-13H,(H,24,25)	HYLQDUPFGMBLGV-UHFFFAOYSA-N	Clc1ccccc1C(=O)Oc2ccc(C=NNC(=O)c3ccccn3)cc2	BroadT	BRD-K69492603	BRD-K69492603-001-05-2	ChemBridge Corporation	5557567			Clc1ccccc1C(=O)Oc1ccc(C=NNC(=O)c2ccccn2)cc1	InChI=1S/C20H14ClN3O3/c21-17-6-2-1-5-16(17)20(26)27-15-10-8-14(9-11-15)13-23-24-19(25)18-7-3-4-12-22-18/h1-13H,(H,24,25)	HYLQDUPFGMBLGV-UHFFFAOYSA-N	379.072369048							111365
ZINC01129058	LSM-22822	SID14731997, BRD-K29971471	1304440	InChI=1S/C25H18N2O2/c28-24(15-19-11-6-10-17-7-4-5-12-21(17)19)26-20-13-14-23-22(16-20)27-25(29-23)18-8-2-1-3-9-18/h1-14,16H,15H2,(H,26,28)	ZJQKJHDPNSOBAC-UHFFFAOYSA-N	O=C(Cc1cccc2ccccc12)Nc3ccc4oc(nc4c3)c5ccccc5	BroadT	BRD-K29971471	BRD-K29971471-001-05-3	ChemBridge Corporation	7681222			O=C(Cc1cccc2ccccc12)Nc1ccc2oc(nc2c1)-c1ccccc1	InChI=1S/C25H18N2O2/c28-24(15-19-11-6-10-17-7-4-5-12-21(17)19)26-20-13-14-23-22(16-20)27-25(29-23)18-8-2-1-3-9-18/h1-14,16H,15H2,(H,26,28)	ZJQKJHDPNSOBAC-UHFFFAOYSA-N	378.136827836							111366
5-Nitro-1-phenyl-1H-benzimidazole-2-thiol	LSM-22823	SID24840301, BRD-K04894851	3863654	InChI=1S/C13H9N3O2S/c17-16(18)10-6-7-12-11(8-10)14-13(19)15(12)9-4-2-1-3-5-9/h1-8H,(H,14,19)	AIHFDVZZSAZCQP-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2c(c1)nc(S)n2c3ccccc3	BroadT	BRD-K04894851	BRD-K04894851-001-06-4	Enamine Ltd.	T5215417			[O-][N+](=O)c1ccc2n(c(S)nc2c1)-c1ccccc1	InChI=1S/C13H9N3O2S/c17-16(18)10-6-7-12-11(8-10)14-13(19)15(12)9-4-2-1-3-5-9/h1-8H,(H,14,19)	AIHFDVZZSAZCQP-UHFFFAOYSA-N	271.041547248							111367
AC1LR6QI	LSM-15208	BRD-K13520327	1389311	InChI=1S/C21H22ClN2O/c1-25-19-12-6-16(7-13-19)20-15-24(18-10-8-17(22)9-11-18)21-5-3-2-4-14-23(20)21/h6-13,15H,2-5,14H2,1H3/q+1	VQHSVULGRFPZKL-UHFFFAOYSA-N	COc1ccc(cc1)c2c[n+](c3CCCCCn23)c4ccc(Cl)cc4	BroadT	BRD-K13520327	BRD-K13520327-004-07-2	InterBioScreen Ltd.	STOCK2S-27800		Br	COc1ccc(cc1)-c1c[n+](c2CCCCCn12)-c1ccc(Cl)cc1.Br	InChI=1S/C21H22ClN2O.BrH/c1-25-19-12-6-16(7-13-19)20-15-24(18-10-8-17(22)9-11-18)21-5-3-2-4-14-23(20)21;/h6-13,15H,2-5,14H2,1H3;1H/q+1;	XRXPYJKMLFJDDS-UHFFFAOYSA-N	353.142066054							103857, 103857
MLS000663204	LSM-22824	SID24791984, BRD-A67074479	2979141	InChI=1S/C12H14N2O2S2/c1-3-12(2)4-7-6(5-16-12)8-9(18-7)10(15)14-11(17)13-8/h3-5H2,1-2H3,(H2,13,14,15,17)	GUDVDUMEQMYGHR-UHFFFAOYSA-N	CCC1(C)Cc2sc3c(O)nc(S)nc3c2CO1	BroadT	BRD-A67074479	BRD-A67074479-001-05-3	ChemBridge Corporation	7974428			CCC1(C)Cc2sc3c(O)nc(S)nc3c2CO1	InChI=1S/C12H14N2O2S2/c1-3-12(2)4-7-6(5-16-12)8-9(18-7)10(15)14-11(17)13-8/h3-5H2,1-2H3,(H2,13,14,15,17)	GUDVDUMEQMYGHR-UHFFFAOYSA-N	282.049669088							111368
SMR000022478	LSM-22825	SID26724692, SID4250999, BRD-A56632232	3244741	InChI=1S/C25H27N3O6S/c1-16(17-5-8-22-23(13-17)34-12-11-33-22)26-25(30)20-15-27(2)21-7-6-18(14-19(21)24(20)29)35(31,32)28-9-3-4-10-28/h5-8,13-16H,3-4,9-12H2,1-2H3,(H,26,30)	IAHRFITVYHLZNO-UHFFFAOYSA-N	CC(NC(=O)C1=CN(C)c2ccc(cc2C1=O)S(=O)(=O)N3CCCC3)c4ccc5OCCOc5c4	BroadT	BRD-A56632232	BRD-A56632232-001-05-9	ChemDiv Inc.	C519-0318			CC(NC(=O)c1cn(C)c2ccc(cc2c1=O)S(=O)(=O)N1CCCC1)c1ccc2OCCOc2c1	InChI=1S/C25H27N3O6S/c1-16(17-5-8-22-23(13-17)34-12-11-33-22)26-25(30)20-15-27(2)21-7-6-18(14-19(21)24(20)29)35(31,32)28-9-3-4-10-28/h5-8,13-16H,3-4,9-12H2,1-2H3,(H,26,30)	IAHRFITVYHLZNO-UHFFFAOYSA-N	497.162056304							111369
ASN 05346196	LSM-15345	BRD-A20754559	654260	InChI=1S/C18H27N5/c1-14-10-12-22(13-11-14)16(15-8-6-5-7-9-15)17-19-20-21-23(17)18(2,3)4/h5-9,14,16H,10-13H2,1-4H3	NZNYJLMJUZNUEJ-UHFFFAOYSA-N	CC1CCN(CC1)C(c2ccccc2)c3nnnn3C(C)(C)C	BroadT	BRD-A20754559	BRD-A20754559-003-05-5	Asinex Ltd.	ASN 05346196		Cl	CC1CCN(CC1)C(c1nnnn1C(C)(C)C)c1ccccc1.Cl	InChI=1S/C18H27N5.ClH/c1-14-10-12-22(13-11-14)16(15-8-6-5-7-9-15)17-19-20-21-23(17)18(2,3)4;/h5-9,14,16H,10-13H2,1-4H3;1H	WXBAYXDCFMKZBC-UHFFFAOYSA-N	313.226645914							103991, 103991
STK582668	LSM-22826	SID14742873, BRD-A13951800	4892722	InChI=1S/C21H19N3O4/c25-18-21(19(26)24(20(27)22-18)15-7-2-1-3-8-15)12-14-6-4-5-9-16(14)23-10-11-28-13-17(21)23/h1-9,17H,10-13H2,(H,22,25,27)	HCBMHQSJBAJGHM-UHFFFAOYSA-N	O=C1NC(=O)C2(Cc3ccccc3N4CCOCC24)C(=O)N1c5ccccc5	BroadT	BRD-A13951800	BRD-A13951800-001-05-7	InterBioScreen Ltd.	STOCK5S-50269			O=C1NC(=O)C2(Cc3ccccc3N3CCOCC23)C(=O)N1c1ccccc1	InChI=1S/C21H19N3O4/c25-18-21(19(26)24(20(27)22-18)15-7-2-1-3-8-15)12-14-6-4-5-9-16(14)23-10-11-28-13-17(21)23/h1-9,17H,10-13H2,(H,22,25,27)	HCBMHQSJBAJGHM-UHFFFAOYSA-N	377.137556118							111370
1-Butan-2-yl-3-(4-ethoxyphenyl)urea	LSM-22827	SID24792665, BRD-A12514394	6471032	InChI=1S/C13H20N2O2/c1-4-10(3)14-13(16)15-11-6-8-12(9-7-11)17-5-2/h6-10H,4-5H2,1-3H3,(H2,14,15,16)	AXLAZAFBFRWKPT-UHFFFAOYSA-N	CCOc1ccc(NC(=O)NC(C)CC)cc1	BroadT	BRD-A12514394	BRD-A12514394-001-05-6	ChemBridge Corporation	9055910			CCOc1ccc(NC(=O)NC(C)CC)cc1	InChI=1S/C13H20N2O2/c1-4-10(3)14-13(16)15-11-6-8-12(9-7-11)17-5-2/h6-10H,4-5H2,1-3H3,(H2,14,15,16)	AXLAZAFBFRWKPT-UHFFFAOYSA-N	236.1524779							111371
BAS 03110057	LSM-22828	SID7972160, BRD-K55681640	770793	InChI=1S/C19H19N3O3/c1-12-8-16-17(9-13(12)2)22(11-20-16)10-18(23)21-15-7-5-4-6-14(15)19(24)25-3/h4-9,11H,10H2,1-3H3,(H,21,23)	LSNVXZMZSSMVNR-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)Cn2cnc3cc(C)c(C)cc23	BroadT	BRD-K55681640	BRD-K55681640-001-05-1	ChemBridge Corporation	6919523			COC(=O)c1ccccc1NC(=O)Cn1cnc2cc(C)c(C)cc12	InChI=1S/C19H19N3O3/c1-12-8-16-17(9-13(12)2)22(11-20-16)10-18(23)21-15-7-5-4-6-14(15)19(24)25-3/h4-9,11H,10H2,1-3H3,(H,21,23)	LSNVXZMZSSMVNR-UHFFFAOYSA-N	337.142641498							111372
MLS000084769	LSM-22829	SID4251066, BRD-K56135944	818375	InChI=1S/C15H15N3/c1-9-3-4-10(2)12(7-9)15-17-13-6-5-11(16)8-14(13)18-15/h3-8H,16H2,1-2H3,(H,17,18)	DESSBQFWZVRBJT-UHFFFAOYSA-N	Cc1ccc(C)c(c1)c2nc3cc(N)ccc3[nH]2	BroadT	BRD-K56135944	BRD-K56135944-001-05-0	ChemDiv Inc.	0812-1012			Cc1ccc(C)c(c1)-c1nc2cc(N)ccc2[nH]1	InChI=1S/C15H15N3/c1-9-3-4-10(2)12(7-9)15-17-13-6-5-11(16)8-14(13)18-15/h3-8H,16H2,1-2H3,(H,17,18)	DESSBQFWZVRBJT-UHFFFAOYSA-N	237.12659751							111373
F0608-0255	LSM-22830	SID17515772, BRD-K32275294	3593595	InChI=1S/C13H10ClN3O4/c14-9-3-1-8(2-4-9)11(18)15-13-17-16-12(21-13)10-7-19-5-6-20-10/h1-4,7H,5-6H2,(H,15,17,18)	YVEOEBNKTNAWKZ-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)Nc2oc(nn2)C3=COCCO3	BroadT	BRD-K32275294	BRD-K32275294-001-05-9	Life Chemicals Inc.	F0608-0255			Clc1ccc(cc1)C(=O)Nc1nnc(o1)C1=COCCO1	InChI=1S/C13H10ClN3O4/c14-9-3-1-8(2-4-9)11(18)15-13-17-16-12(21-13)10-7-19-5-6-20-10/h1-4,7H,5-6H2,(H,15,17,18)	YVEOEBNKTNAWKZ-UHFFFAOYSA-N	307.03598354							111374
SMR000020552	LSM-22831	SID4241590, BRD-A63473958	3236545	InChI=1S/C16H20N2O6/c1-10(14(20)18-8-12(19)7-13(18)15(21)22)17-16(23)24-9-11-5-3-2-4-6-11/h2-6,10,12-13,19H,7-9H2,1H3,(H,17,23)(H,21,22)	SKAZUZUAPBSAJR-UHFFFAOYSA-N	CC(NC(=O)OCc1ccccc1)C(=O)N2CC(O)CC2C(=O)O	BroadT	BRD-A63473958	BRD-A63473958-001-11-9	ChemDiv Inc.	6623-2026			CC(NC(=O)OCc1ccccc1)C(=O)N1CC(O)CC1C(O)=O	InChI=1S/C16H20N2O6/c1-10(14(20)18-8-12(19)7-13(18)15(21)22)17-16(23)24-9-11-5-3-2-4-6-11/h2-6,10,12-13,19H,7-9H2,1H3,(H,17,23)(H,21,22)	SKAZUZUAPBSAJR-UHFFFAOYSA-N	336.13213638							111375
AC1LWTTS	LSM-22832	BRD-K55689846	1758370	InChI=1S/C21H13BrN4O4/c22-14-5-3-4-13(10-14)19-11-17(16-6-1-2-7-18(16)24-19)21(27)25-23-12-15-8-9-20(30-15)26(28)29/h1-12H,(H,25,27)	PBIZVZSALKGSCY-UHFFFAOYSA-N	[O-][N+](=O)c1oc(C=NNC(=O)c2cc(nc3ccccc23)c4cccc(Br)c4)cc1	BroadT	BRD-K55689846	BRD-K55689846-001-07-2	Specs	AK-968/40728857			[O-][N+](=O)c1ccc(C=NNC(=O)c2cc(nc3ccccc23)-c2cccc(Br)c2)o1	InChI=1S/C21H13BrN4O4/c22-14-5-3-4-13(10-14)19-11-17(16-6-1-2-7-18(16)24-19)21(27)25-23-12-15-8-9-20(30-15)26(28)29/h1-12H,(H,25,27)	PBIZVZSALKGSCY-UHFFFAOYSA-N	464.012017536							111376
AC1MD8VX	LSM-22833	BRD-K57331804	2807553	InChI=1S/C15H17N5O2S/c1-22-10-5-6-11-9(7-10)3-2-4-12(11)19-20-15-17-13(8-23-15)14(21)18-16/h5-8H,2-4,16H2,1H3,(H,17,20)(H,18,21)	IDFQFWCLAOPALJ-UHFFFAOYSA-N	COc1ccc2C(=NNc3nc(cs3)C(=O)NN)CCCc2c1	BroadT	BRD-K57331804	BRD-K57331804-001-04-6	Maybridge	FM 00305			COc1ccc2C(CCCc2c1)=NNc1nc(cs1)C(=O)NN	InChI=1S/C15H17N5O2S/c1-22-10-5-6-11-9(7-10)3-2-4-12(11)19-20-15-17-13(8-23-15)14(21)18-16/h5-8H,2-4,16H2,1H3,(H,17,20)(H,18,21)	IDFQFWCLAOPALJ-UHFFFAOYSA-N	331.110295524							111377
T5231840	LSM-22834	SID22408840, BRD-A74098107	4613354	InChI=1S/C23H28ClN3O/c1-17-9-10-19(24)15-22(17)27-13-11-26(12-14-27)16-23(28)25-21-8-4-6-18-5-2-3-7-20(18)21/h2-3,5,7,9-10,15,21H,4,6,8,11-14,16H2,1H3,(H,25,28)	VTOWZCKBJXTYMT-UHFFFAOYSA-N	Cc1ccc(Cl)cc1N2CCN(CC(=O)NC3CCCc4ccccc34)CC2	BroadT	BRD-A74098107	BRD-A74098107-001-06-1	Enamine Ltd.	T5231840			Cc1ccc(Cl)cc1N1CCN(CC(=O)NC2CCCc3ccccc23)CC1	InChI=1S/C23H28ClN3O/c1-17-9-10-19(24)15-22(17)27-13-11-26(12-14-27)16-23(28)25-21-8-4-6-18-5-2-3-7-20(18)21/h2-3,5,7,9-10,15,21H,4,6,8,11-14,16H2,1H3,(H,25,28)	VTOWZCKBJXTYMT-UHFFFAOYSA-N	397.192090256							111378
MLS000121367	LSM-43984	SID14721281, BRD-K76885144	1933256	InChI=1S/C16H15N3O2S2/c20-14(9-8-12-5-2-1-3-6-12)17-16(22)19-18-15(21)11-13-7-4-10-23-13/h1-10H,11H2,(H,18,21)(H2,17,19,20,22)/b9-8+	JCUFETFRAJGEOW-CMDGGOBGSA-N	O=C(Cc1cccs1)NNC(=S)NC(=O)\C=C\c2ccccc2	BroadT	BRD-K76885144	BRD-K76885144-001-06-2	Asinex Ltd.	BAS 01555786			O=C(Cc1cccs1)NNC(=S)NC(=O)\C=C\c1ccccc1	InChI=1S/C16H15N3O2S2/c20-14(9-8-12-5-2-1-3-6-12)17-16(22)19-18-15(21)11-13-7-4-10-23-13/h1-10H,11H2,(H,18,21)(H2,17,19,20,22)/b9-8+	JCUFETFRAJGEOW-CMDGGOBGSA-N	345.06056813							
MLS000660557	LSM-22836	SID24813107, BRD-A79717904	16193920	InChI=1S/C26H34FN5OS/c1-17-13-18(2)15-31(14-17)10-4-9-28-26(33)19-7-11-32(12-8-19)25-24-23(29-16-30-25)22-20(27)5-3-6-21(22)34-24/h3,5-6,16-19H,4,7-15H2,1-2H3,(H,28,33)	RJDARHZKIIQTHN-UHFFFAOYSA-N	CC1CC(C)CN(CCCNC(=O)C2CCN(CC2)c3ncnc4c3sc5cccc(F)c45)C1	BroadT	BRD-A79717904	BRD-A79717904-001-03-3	ChemDiv Inc.	C860-0884			CC1CC(C)CN(CCCNC(=O)C2CCN(CC2)c2ncnc3c2sc2cccc(F)c32)C1	InChI=1S/C26H34FN5OS/c1-17-13-18(2)15-31(14-17)10-4-9-28-26(33)19-7-11-32(12-8-19)25-24-23(29-16-30-25)22-20(27)5-3-6-21(22)34-24/h3,5-6,16-19H,4,7-15H2,1-2H3,(H,28,33)	RJDARHZKIIQTHN-UHFFFAOYSA-N	483.246809648							111380
MLS000680326	LSM-43985	SID24803301, BRD-K25088777	1338981	InChI=1S/C18H16ClN3O3/c1-10-8-12(11(2)21(10)3)9-15-16(23)20-18(25)22(17(15)24)14-6-4-13(19)5-7-14/h4-9H,1-3H3,(H,20,23,25)/b15-9+	XZQPGSMFRVHRTM-OQLLNIDSSA-N	Cc1cc(\C=C\2/C(=O)NC(=O)N(C2=O)c3ccc(Cl)cc3)c(C)n1C	BroadT	BRD-K25088777	BRD-K25088777-001-06-9	ChemBridge Corporation	6223606			Cc1cc(\C=C2/C(=O)NC(=O)N(C2=O)c2ccc(Cl)cc2)c(C)n1C	InChI=1S/C18H16ClN3O3/c1-10-8-12(11(2)21(10)3)9-15-16(23)20-18(25)22(17(15)24)14-6-4-13(19)5-7-14/h4-9H,1-3H3,(H,20,23,25)/b15-9+	XZQPGSMFRVHRTM-OQLLNIDSSA-N	357.088019112							
SMR000004378	LSM-22838	SID26667779, SID847683, BRD-A40618371	650092	InChI=1S/C27H32N6O3/c1-3-25(26-29-30-31-33(26)16-19-8-5-4-6-9-19)32(18-23-10-7-13-36-23)17-21-14-20-15-22(35-2)11-12-24(20)28-27(21)34/h4-6,8-9,11-12,14-15,23,25H,3,7,10,13,16-18H2,1-2H3,(H,28,34)	GGNAEMSQXQYFTF-UHFFFAOYSA-N	CCC(N(CC1CCCO1)Cc2cc3cc(OC)ccc3nc2O)c4nnnn4Cc5ccccc5	BroadT	BRD-A40618371	BRD-A40618371-001-05-8	Asinex Ltd.	ASN 05299600			CCC(N(CC1CCCO1)Cc1cc2cc(OC)ccc2nc1O)c1nnnn1Cc1ccccc1	InChI=1S/C27H32N6O3/c1-3-25(26-29-30-31-33(26)16-19-8-5-4-6-9-19)32(18-23-10-7-13-36-23)17-21-14-20-15-22(35-2)11-12-24(20)28-27(21)34/h4-6,8-9,11-12,14-15,23,25H,3,7,10,13,16-18H2,1-2H3,(H,28,34)	GGNAEMSQXQYFTF-UHFFFAOYSA-N	488.253588944							111382
1-(4-Bromobenzyl)-3-(4-chlorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium	LSM-15209	BRD-K39909483	1604649	InChI=1S/C21H21BrClN2/c22-18-9-5-16(6-10-18)14-24-15-20(17-7-11-19(23)12-8-17)25-13-3-1-2-4-21(24)25/h5-12,15H,1-4,13-14H2/q+1	VGTLRNPQZKPXHY-UHFFFAOYSA-N	Clc1ccc(cc1)c2c[n+](Cc3ccc(Br)cc3)c4CCCCCn24	BroadT	BRD-K39909483	BRD-K39909483-004-06-9	InterBioScreen Ltd.	STOCK1S-12103		Br	Clc1ccc(cc1)-c1c[n+](Cc2ccc(Br)cc2)c2CCCCCn12.Br	InChI=1S/C21H21BrClN2.BrH/c22-18-9-5-16(6-10-18)14-24-15-20(17-7-11-19(23)12-8-17)25-13-3-1-2-4-21(24)25;/h5-12,15H,1-4,13-14H2;1H/q+1;	UCFVLUVIVXKKTO-UHFFFAOYSA-N	415.057664002							103858, 103858
5M-518S	LSM-22839	SID17402376, BRD-K06879346	1479619	InChI=1S/C13H14ClN3O/c1-9-4-6-10(7-5-9)17-13(18)12(14)11(8-15-17)16(2)3/h4-8H,1-3H3	IOQRBNSNIRQGRR-UHFFFAOYSA-N	CN(C)C1=C(Cl)C(=O)N(N=C1)c2ccc(C)cc2	BroadT	BRD-K06879346	BRD-K06879346-001-05-8	Key Organics Ltd.	5M-518S			CN(C)c1cnn(-c2ccc(C)cc2)c(=O)c1Cl	InChI=1S/C13H14ClN3O/c1-9-4-6-10(7-5-9)17-13(18)12(14)11(8-15-17)16(2)3/h4-8H,1-3H3	IOQRBNSNIRQGRR-UHFFFAOYSA-N	263.082539808							111383
F3168-2012	LSM-22840	SID26724750, SID4249064, BRD-K66932670	3243065	InChI=1S/C25H28N4O4S/c1-16-5-6-17(2)20(12-16)27-8-10-28(11-9-27)23(30)4-3-7-29-24(31)18-13-21-22(33-15-32-21)14-19(18)26-25(29)34/h5-6,12-14H,3-4,7-11,15H2,1-2H3,(H,26,34)	COLKKSSIWGXVIR-UHFFFAOYSA-N	Cc1ccc(C)c(c1)N2CCN(CC2)C(=O)CCCN3C(=S)Nc4cc5OCOc5cc4C3=O	BroadT	BRD-K66932670	BRD-K66932670-001-05-8	ChemDiv Inc.	K284-5274			Cc1ccc(C)c(c1)N1CCN(CC1)C(=O)CCCn1c(=S)[nH]c2cc3OCOc3cc2c1=O	InChI=1S/C25H28N4O4S/c1-16-5-6-17(2)20(12-16)27-8-10-28(11-9-27)23(30)4-3-7-29-24(31)18-13-21-22(33-15-32-21)14-19(18)26-25(29)34/h5-6,12-14H,3-4,7-11,15H2,1-2H3,(H,26,34)	COLKKSSIWGXVIR-UHFFFAOYSA-N	480.183126106							111384
2-(2-Bromo-4-chlorophenoxy)-n-cyclohexyl-n-methylacetamide	LSM-22841	SID49819163, BRD-K40812240	1226773	InChI=1S/C15H19BrClNO2/c1-18(12-5-3-2-4-6-12)15(19)10-20-14-8-7-11(17)9-13(14)16/h7-9,12H,2-6,10H2,1H3	DRPOZNLZQKKDCT-UHFFFAOYSA-N	CN(C1CCCCC1)C(=O)COc2ccc(Cl)cc2Br	BroadT	BRD-K40812240	BRD-K40812240-001-06-2	ChemBridge Corporation	7918510			CN(C1CCCCC1)C(=O)COc1ccc(Cl)cc1Br	InChI=1S/C15H19BrClNO2/c1-18(12-5-3-2-4-6-12)15(19)10-20-14-8-7-11(17)9-13(14)16/h7-9,12H,2-6,10H2,1H3	DRPOZNLZQKKDCT-UHFFFAOYSA-N	359.028769168							111385
HMS2593C15	LSM-43986	BRD-K95708753	16193252	InChI=1S/C20H19N3O5/c1-26-16-5-3-2-4-15(16)7-9-19(24)21-12-20(25)23-22-11-14-6-8-17-18(10-14)28-13-27-17/h2-11H,12-13H2,1H3,(H,21,24)(H,23,25)/b9-7+,22-11?	BPVZHVGNNDFMGB-VDBLCYJKSA-N	COc1ccccc1\C=C\C(=O)NCC(=O)NN=Cc2ccc3OCOc3c2	BroadT	BRD-K95708753	BRD-K95708753-001-05-7	ChemDiv Inc.	1286-0217			COc1ccccc1\C=C\C(=O)NCC(=O)NN=Cc1ccc2OCOc2c1	InChI=1S/C20H19N3O5/c1-26-16-5-3-2-4-15(16)7-9-19(24)21-12-20(25)23-22-11-14-6-8-17-18(10-14)28-13-27-17/h2-11H,12-13H2,1H3,(H,21,24)(H,23,25)/b9-7+,22-11?	BPVZHVGNNDFMGB-VDBLCYJKSA-N	381.132470738							
MLS000074351	LSM-22843	SID26668312, SID849101, BRD-K80057207	651572	InChI=1S/C24H27ClN4O3/c1-32-19-8-9-21-17(15-19)14-18(23(30)26-21)16-29(13-12-28-10-4-5-11-28)24(31)27-22-7-3-2-6-20(22)25/h2-3,6-9,14-15H,4-5,10-13,16H2,1H3,(H,26,30)(H,27,31)	YNGXAIGJLHEMHY-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(CCN3CCCC3)C(=O)Nc4ccccc4Cl)cc2c1	BroadT	BRD-K80057207	BRD-K80057207-001-05-8	Asinex Ltd.	ASN 05113065			COc1ccc2nc(O)c(CN(CCN3CCCC3)C(=O)Nc3ccccc3Cl)cc2c1	InChI=1S/C24H27ClN4O3/c1-32-19-8-9-21-17(15-19)14-18(23(30)26-21)16-29(13-12-28-10-4-5-11-28)24(31)27-22-7-3-2-6-20(22)25/h2-3,6-9,14-15H,4-5,10-13,16H2,1H3,(H,26,30)(H,27,31)	YNGXAIGJLHEMHY-UHFFFAOYSA-N	454.177168474							111387
125605-97-2	LSM-22844	SID26731192, BRD-A38811080	2802192	InChI=1S/C6H6N2O4S3/c9-3(10)1-2(4(11)12)14-6-8-7-5(13)15-6/h2H,1H2,(H,7,13)(H,9,10)(H,11,12)	YUMSRJNRCPVTBZ-UHFFFAOYSA-N	OC(=O)CC(Sc1nnc(S)s1)C(=O)O	BroadT	BRD-A38811080	BRD-A38811080-001-05-5	Maybridge	BTB 12608			OC(=O)CC(Sc1nnc(S)s1)C(O)=O	InChI=1S/C6H6N2O4S3/c9-3(10)1-2(4(11)12)14-6-8-7-5(13)15-6/h2H,1H2,(H,7,13)(H,9,10)(H,11,12)	YUMSRJNRCPVTBZ-UHFFFAOYSA-N	265.948968762							111388
MLS000113237	LSM-22845	SID7977326, BRD-K36834752	691702	InChI=1S/C14H14N6O4/c1-2-22-14(21)11-10(8-23-9-6-4-3-5-7-9)20(19-16-11)13-12(15)17-24-18-13/h3-7H,2,8H2,1H3,(H2,15,17)	RNABOYGBCYHTDS-UHFFFAOYSA-N	CCOC(=O)c1nnn(c1COc2ccccc2)c3nonc3N	BroadT	BRD-K36834752	BRD-K36834752-001-07-0	ChemBridge Corporation	7030424			CCOC(=O)c1nnn(-c2nonc2N)c1COc1ccccc1	InChI=1S/C14H14N6O4/c1-2-22-14(21)11-10(8-23-9-6-4-3-5-7-9)20(19-16-11)13-12(15)17-24-18-13/h3-7H,2,8H2,1H3,(H2,15,17)	RNABOYGBCYHTDS-UHFFFAOYSA-N	330.107652988							111389
AC1M67VN	LSM-22846	SID17517074, BRD-K71250531	2392997	InChI=1S/C15H13F3N2O3/c1-20-12(15(16,17)18)8-7-11(14(20)22)19-13(21)9-3-5-10(23-2)6-4-9/h3-8H,1-2H3,(H,19,21)	BWLBTNBENBKXPH-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NC2=CC=C(N(C)C2=O)C(F)(F)F	BroadT	BRD-K71250531	BRD-K71250531-001-05-7	Enamine Ltd.	T0517-3180			COc1ccc(cc1)C(=O)Nc1ccc(n(C)c1=O)C(F)(F)F	InChI=1S/C15H13F3N2O3/c1-20-12(15(16,17)18)8-7-11(14(20)22)19-13(21)9-3-5-10(23-2)6-4-9/h3-8H,1-2H3,(H,19,21)	BWLBTNBENBKXPH-UHFFFAOYSA-N	326.087826896							111390
SMR000264663	LSM-22847	SID22406984, BRD-A07853420	4883629	InChI=1S/C23H25N3O3S2/c1-16-8-9-18(12-17(16)2)21-13-26(20-6-4-3-5-7-20)23(25-21)30-14-22(27)24-19-10-11-31(28,29)15-19/h3-9,12-13,19H,10-11,14-15H2,1-2H3,(H,24,27)	MADXESLRZDMEKU-UHFFFAOYSA-N	Cc1ccc(cc1C)c2cn(c(SCC(=O)NC3CCS(=O)(=O)C3)n2)c4ccccc4	BroadT	BRD-A07853420	BRD-A07853420-001-06-1	Enamine Ltd.	T5331313			Cc1ccc(cc1C)-c1cn(c(SCC(=O)NC2CCS(=O)(=O)C2)n1)-c1ccccc1	InChI=1S/C23H25N3O3S2/c1-16-8-9-18(12-17(16)2)21-13-26(20-6-4-3-5-7-20)23(25-21)30-14-22(27)24-19-10-11-31(28,29)15-19/h3-9,12-13,19H,10-11,14-15H2,1-2H3,(H,24,27)	MADXESLRZDMEKU-UHFFFAOYSA-N	455.13373307							111391
AQ-390/40898047	LSM-22848	SID17416168, BRD-K39163260	1367782	InChI=1S/C19H13ClN2O3S3/c20-12-5-8-14(9-6-12)28(24,25)22-13-7-10-16(23)18(11-13)27-19-21-15-3-1-2-4-17(15)26-19/h1-11,22-23H	LRNSEWVOKBURRE-UHFFFAOYSA-N	Oc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1Sc3nc4ccccc4s3	BroadT	BRD-K39163260	BRD-K39163260-001-05-0	ChemBridge Corporation	6162879			Oc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1Sc1nc2ccccc2s1	InChI=1S/C19H13ClN2O3S3/c20-12-5-8-14(9-6-12)28(24,25)22-13-7-10-16(23)18(11-13)27-19-21-15-3-1-2-4-17(15)26-19/h1-11,22-23H	LRNSEWVOKBURRE-UHFFFAOYSA-N	447.977682076							111392
5-(1,5-Dimethyl-1H-pyrazol-3-yl)-4-phenyl-4H-1,2,4-triazole-3-thiol	LSM-22849	SID17510217, BRD-K45687855	4189487	InChI=1S/C13H13N5S/c1-9-8-11(16-17(9)2)12-14-15-13(19)18(12)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,15,19)	CZMJYYQHVSCJRX-UHFFFAOYSA-N	Cc1cc(nn1C)c2nnc(S)n2c3ccccc3	BroadT	BRD-K45687855	BRD-K45687855-001-05-1	ChemDiv Inc.	6049-0293			Cc1cc(nn1C)-c1nnc(S)n1-c1ccccc1	InChI=1S/C13H13N5S/c1-9-8-11(16-17(9)2)12-14-15-13(19)18(12)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,15,19)	CZMJYYQHVSCJRX-UHFFFAOYSA-N	271.089166156							111393
F2018-1570	LSM-15346	BRD-K10667100	7208276	InChI=1S/C19H25N3O3S/c1-21(2)8-9-22(18(23)13-6-4-3-5-7-13)19-20-14-10-15-16(25-12-24-15)11-17(14)26-19/h10-11,13H,3-9,12H2,1-2H3	YSQYZUUQAGHGFJ-UHFFFAOYSA-N	CN(C)CCN(C(=O)C1CCCCC1)c2nc3cc4OCOc4cc3s2	BroadT	BRD-K10667100	BRD-K10667100-003-05-3	Life Chemicals Inc.	F2018-1570		Cl	CN(C)CCN(C(=O)C1CCCCC1)c1nc2cc3OCOc3cc2s1.Cl	InChI=1S/C19H25N3O3S.ClH/c1-21(2)8-9-22(18(23)13-6-4-3-5-7-13)19-20-14-10-15-16(25-12-24-15)11-17(14)26-19;/h10-11,13H,3-9,12H2,1-2H3;1H	RNAVYUMFLVQTTA-UHFFFAOYSA-N	375.16166238							103992, 103992
(2E)-2-[2-(3,5-Dimethylphenyl)-2-oxoethylidene]-1,3-thiazolidin-4-one	LSM-43987	SID3715699, BRD-K70708621	5742533	InChI=1S/C13H13NO2S/c1-8-3-9(2)5-10(4-8)11(15)6-13-14-12(16)7-17-13/h3-6H,7H2,1-2H3,(H,14,16)/b13-6+	YJOZNRBAKVSPJY-AWNIVKPZSA-N	Cc1cc(C)cc(c1)C(=O)\C=C\2/NC(=O)CS2	BroadT	BRD-K70708621	BRD-K70708621-001-05-6	Enamine Ltd.	T5230735			Cc1cc(C)cc(c1)C(=O)\C=C1/NC(=O)CS1	InChI=1S/C13H13NO2S/c1-8-3-9(2)5-10(4-8)11(15)6-13-14-12(16)7-17-13/h3-6H,7H2,1-2H3,(H,14,16)/b13-6+	YJOZNRBAKVSPJY-AWNIVKPZSA-N	247.066699356							
BAS 09637027	LSM-22851	SID14727203, BRD-A04155648	3158809	InChI=1S/C21H21N3O4S/c1-4-28-17-10-5-13(11-18(17)27-3)19-23-20(25)16(12-22)21(29)24(19)14-6-8-15(26-2)9-7-14/h5-11,19,29H,4H2,1-3H3,(H,23,25)	NJLLDFWHGQSEIE-UHFFFAOYSA-N	CCOc1ccc(cc1OC)C2NC(=O)C(=C(S)N2c3ccc(OC)cc3)C#N	BroadT	BRD-A04155648	BRD-A04155648-001-05-2	Asinex Ltd.	BAS 09637027			CCOc1ccc(cc1OC)C1NC(=O)C(C#N)=C(S)N1c1ccc(OC)cc1	InChI=1S/C21H21N3O4S/c1-4-28-17-10-5-13(11-18(17)27-3)19-23-20(25)16(12-22)21(29)24(19)14-6-8-15(26-2)9-7-14/h5-11,19,29H,4H2,1-3H3,(H,23,25)	NJLLDFWHGQSEIE-UHFFFAOYSA-N	411.125276872							111395
AC1LCJZB	LSM-15347	BRD-A31275474	651416	InChI=1S/C18H27ClN6/c1-5-18(2,3)25-17(20-21-22-25)16(14-6-8-15(19)9-7-14)24-12-10-23(4)11-13-24/h6-9,16H,5,10-13H2,1-4H3	GVHBAMOZUBPHBK-UHFFFAOYSA-N	CCC(C)(C)n1nnnc1C(N2CCN(C)CC2)c3ccc(Cl)cc3	BroadT	BRD-A31275474	BRD-A31275474-003-05-0	Asinex Ltd.	ASN 05346475		Cl	CCC(C)(C)n1nnnc1C(N1CCN(C)CC1)c1ccc(Cl)cc1.Cl	InChI=1S/C18H27ClN6.ClH/c1-5-18(2,3)25-17(20-21-22-25)16(14-6-8-15(19)9-7-14)24-12-10-23(4)11-13-24;/h6-9,16H,5,10-13H2,1-4H3;1H	WPNJHUIGRGWBSB-UHFFFAOYSA-N	362.198572634							103993, 103993
STK847291	LSM-43988	SID17505868, BRD-K73832060	1622988	InChI=1S/C19H20N4OS/c1-13-7-9-23(10-8-13)19-21-18(24)16(25-19)11-15-12-20-22-17(15)14-5-3-2-4-6-14/h2-6,11-13H,7-10H2,1H3,(H,20,22)/b16-11-	QSCNMGHRKNZEBR-WJDWOHSUSA-N	CC1CCN(CC1)C2=NC(=O)\C(=C\c3c[nH]nc3c4ccccc4)\S2	BroadT	BRD-K73832060	BRD-K73832060-001-05-9	InterBioScreen Ltd.	STOCK4S-79662			CC1CCN(CC1)C1=NC(=O)\C(S1)=C\c1c[nH]nc1-c1ccccc1	InChI=1S/C19H20N4OS/c1-13-7-9-23(10-8-13)19-21-18(24)16(25-19)11-15-12-20-22-17(15)14-5-3-2-4-6-14/h2-6,11-13H,7-10H2,1H3,(H,20,22)/b16-11-	QSCNMGHRKNZEBR-WJDWOHSUSA-N	352.13578199							
AC1LI1OE	LSM-15551	BRD-K82193271	872967	InChI=1S/C17H21N3O/c1-11(2)18-10-16(21)20-17-12-6-3-4-8-14(12)19-15-9-5-7-13(15)17/h3-4,6,8,11,18H,5,7,9-10H2,1-2H3,(H,19,20,21)	FJYJIBYKCXJBMW-UHFFFAOYSA-N	CC(C)NCC(=O)Nc1c2CCCc2nc3ccccc13	BroadT	BRD-K82193271	BRD-K82193271-034-05-1	InterBioScreen Ltd.	STOCK2S-09130		OC(=O)C(=O)O	CC(C)NCC(=O)Nc1c2CCCc2nc2ccccc12.OC(=O)C(=O)O	InChI=1S/C17H21N3O.C2H2O4/c1-11(2)18-10-16(21)20-17-12-6-3-4-8-14(12)19-15-9-5-7-13(15)17;3-1(4)2(5)6/h3-4,6,8,11,18H,5,7,9-10H2,1-2H3,(H,19,20,21);(H,3,4)(H,5,6)	SGKUJBSBQSSAAL-UHFFFAOYSA-N	283.168462322							104187, 104187
2F-938	LSM-22853	SID24822252, BRD-K40000853	3776565	InChI=1S/C20H22N4O4/c1-3-28-20(26)17-12-14(13-21)18(22-19(17)25)24-10-8-23(9-11-24)15-4-6-16(27-2)7-5-15/h4-7,12H,3,8-11H2,1-2H3,(H,22,25)	CLELQUUCWLPTPN-UHFFFAOYSA-N	CCOC(=O)c1cc(C#N)c(nc1O)N2CCN(CC2)c3ccc(OC)cc3	BroadT	BRD-K40000853	BRD-K40000853-001-06-2	Key Organics Ltd.	2F-938			CCOC(=O)c1cc(C#N)c(nc1O)N1CCN(CC1)c1ccc(OC)cc1	InChI=1S/C20H22N4O4/c1-3-28-20(26)17-12-14(13-21)18(22-19(17)25)24-10-8-23(9-11-24)15-4-6-16(27-2)7-5-15/h4-7,12H,3,8-11H2,1-2H3,(H,22,25)	CLELQUUCWLPTPN-UHFFFAOYSA-N	382.164105224							111397
MLS000335922	LSM-22854	SID17516161, BRD-K11025923	5172057	InChI=1S/C22H25N3O5/c26-21(24-17-9-5-2-6-10-17)15-30-22(27)19-13-18(25(28)29)11-12-20(19)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-13,17,23H,2,5-6,9-10,14-15H2,(H,24,26)	PIOGBLCJURIDAW-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NCc2ccccc2)c(c1)C(=O)OCC(=O)NC3CCCCC3	BroadT	BRD-K11025923	BRD-K11025923-001-05-2	Enamine Ltd.	T5252980			[O-][N+](=O)c1ccc(NCc2ccccc2)c(c1)C(=O)OCC(=O)NC1CCCCC1	InChI=1S/C22H25N3O5/c26-21(24-17-9-5-2-6-10-17)15-30-22(27)19-13-18(25(28)29)11-12-20(19)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-13,17,23H,2,5-6,9-10,14-15H2,(H,24,26)	PIOGBLCJURIDAW-UHFFFAOYSA-N	411.17942093							111398
AC1MH8IE	LSM-22855	SID3712296, BRD-A57825933	2997968	InChI=1S/C15H20N4O2S/c1-11-6-7-14(20-2)13(9-11)19-15(16-17-18-19)22-10-12-5-3-4-8-21-12/h6-7,9,12H,3-5,8,10H2,1-2H3	QXXBRYHPFMNMKA-UHFFFAOYSA-N	COc1ccc(C)cc1n2nnnc2SCC3CCCCO3	BroadT	BRD-A57825933	BRD-A57825933-001-05-0	Enamine Ltd.	ZT-4751382			COc1ccc(C)cc1-n1nnnc1SCC1CCCCO1	InChI=1S/C15H20N4O2S/c1-11-6-7-14(20-2)13(9-11)19-15(16-17-18-19)22-10-12-5-3-4-8-21-12/h6-7,9,12H,3-5,8,10H2,1-2H3	QXXBRYHPFMNMKA-UHFFFAOYSA-N	320.13069661							111399
AC1N6Q6J	LSM-22856	BRD-K83294483	4264071	InChI=1S/C19H14Cl2N4/c20-15-10-9-14(17(21)12-15)13-23-25-19(18-8-4-5-11-22-18)24-16-6-2-1-3-7-16/h1-13H,(H,24,25)	HMNFZOLNAVJCNT-UHFFFAOYSA-N	Clc1ccc(C=NN=C(Nc2ccccc2)c3ccccn3)c(Cl)c1	BroadT	BRD-K83294483	BRD-K83294483-001-06-7	Asinex Ltd.	BAS 00365671			Clc1ccc(C=NN=C(Nc2ccccc2)c2ccccn2)c(Cl)c1	InChI=1S/C19H14Cl2N4/c20-15-10-9-14(17(21)12-15)13-23-25-19(18-8-4-5-11-22-18)24-16-6-2-1-3-7-16/h1-13H,(H,24,25)	HMNFZOLNAVJCNT-UHFFFAOYSA-N	368.059551908							111400
796886-59-4	LSM-15348	BRD-K62689407	900021	InChI=1S/C17H17N5O2/c18-15-12-4-1-2-5-13(12)19-17(20-15)22-9-7-21(8-10-22)16(23)14-6-3-11-24-14/h1-6,11H,7-10H2,(H2,18,19,20)	DECAUZVEBBDOOT-UHFFFAOYSA-N	Nc1nc(nc2ccccc12)N3CCN(CC3)C(=O)c4occc4	BroadT	BRD-K62689407	BRD-K62689407-003-06-2	Specs	AH-262/34226018		Cl	Nc1nc(nc2ccccc12)N1CCN(CC1)C(=O)c1ccco1.Cl	InChI=1S/C17H17N5O2.ClH/c18-15-12-4-1-2-5-13(12)19-17(20-15)22-9-7-21(8-10-22)16(23)14-6-3-11-24-14;/h1-6,11H,7-10H2,(H2,18,19,20);1H	HAEUKYJSFFVDNM-UHFFFAOYSA-N	323.138224834							103994, 103994
SBB038499	LSM-22857	SID3713006, BRD-K33919631	2310793	InChI=1S/C15H20N4/c1-12-6-8-13(9-7-12)16-11-15-18-17-14-5-3-2-4-10-19(14)15/h6-9,16H,2-5,10-11H2,1H3	OPHPDLOQUPTISP-UHFFFAOYSA-N	Cc1ccc(NCc2nnc3CCCCCn23)cc1	BroadT	BRD-K33919631	BRD-K33919631-001-05-3	Enamine Ltd.	T0502-5162			Cc1ccc(NCc2nnc3CCCCCn23)cc1	InChI=1S/C15H20N4/c1-12-6-8-13(9-7-12)16-11-15-18-17-14-5-3-2-4-10-19(14)15/h6-9,16H,2-5,10-11H2,1H3	OPHPDLOQUPTISP-UHFFFAOYSA-N	256.16879668							111401
MLS000779022	LSM-22858	SID26671044, BRD-K36223761	938783	InChI=1S/C13H7NO5S/c15-9-5-10(12-11(6-9)20-13(16)19-12)7-1-3-8(4-2-7)14(17)18/h1-6,15H	NGGKZEUPYOGAHM-UHFFFAOYSA-N	Oc1cc2SC(=O)Oc2c(c1)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-K36223761	BRD-K36223761-001-05-9	InterBioScreen Ltd.	STOCK4S-33575			Oc1cc(-c2ccc(cc2)[N+]([O-])=O)c2oc(=O)sc2c1	InChI=1S/C13H7NO5S/c15-9-5-10(12-11(6-9)20-13(16)19-12)7-1-3-8(4-2-7)14(17)18/h1-6,15H	NGGKZEUPYOGAHM-UHFFFAOYSA-N	289.004493024							111402
T5264335	LSM-22859	SID14745907, BRD-K94822432	2087454	InChI=1S/C20H27N5O3/c1-2-25(12-17-22-16-11-7-6-10-15(16)19(27)23-17)13-18(26)24-20(28)21-14-8-4-3-5-9-14/h6-7,10-11,14H,2-5,8-9,12-13H2,1H3,(H,22,23,27)(H2,21,24,26,28)	ACABFUSMARNGNL-UHFFFAOYSA-N	CCN(CC(=O)NC(=O)NC1CCCCC1)Cc2nc(O)c3ccccc3n2	BroadT	BRD-K94822432	BRD-K94822432-001-05-6	Enamine Ltd.	T5264335			CCN(CC(=O)NC(=O)NC1CCCCC1)Cc1nc(O)c2ccccc2n1	InChI=1S/C20H27N5O3/c1-2-25(12-17-22-16-11-7-6-10-15(16)19(27)23-17)13-18(26)24-20(28)21-14-8-4-3-5-9-14/h6-7,10-11,14H,2-5,8-9,12-13H2,1H3,(H,22,23,27)(H2,21,24,26,28)	ACABFUSMARNGNL-UHFFFAOYSA-N	385.211389774							111403
T0520-8489	LSM-43989	SID22407232, BRD-K04633433	2462422	InChI=1S/C25H20ClN3O2/c26-23-12-5-4-11-22(23)25(31)29-21-10-6-9-19(16-21)15-20(17-27)24(30)28-14-13-18-7-2-1-3-8-18/h1-12,15-16H,13-14H2,(H,28,30)(H,29,31)/b20-15+	QDRCCHBMMLQUME-HMMYKYKNSA-N	Clc1ccccc1C(=O)Nc2cccc(\C=C(/C#N)\C(=O)NCCc3ccccc3)c2	BroadT	BRD-K04633433	BRD-K04633433-001-06-3	Enamine Ltd.	T0520-8489			Clc1ccccc1C(=O)Nc1cccc(\C=C(/C#N)C(=O)NCCc2ccccc2)c1	InChI=1S/C25H20ClN3O2/c26-23-12-5-4-11-22(23)25(31)29-21-10-6-9-19(16-21)15-20(17-27)24(30)28-14-13-18-7-2-1-3-8-18/h1-12,15-16H,13-14H2,(H,28,30)(H,29,31)/b20-15+	QDRCCHBMMLQUME-HMMYKYKNSA-N	429.12440462							
BAS 09530750	LSM-22861	SID14723830, BRD-K44020402	1094050	InChI=1S/C20H20F2N4O2/c1-28-14-7-5-13(6-8-14)16-11-17(18(21)22)26-19(24-16)15(12-23-26)20(27)25-9-3-2-4-10-25/h5-8,11-12,18H,2-4,9-10H2,1H3	UXJKFVOSUYJJRU-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(C(F)F)n3ncc(C(=O)N4CCCCC4)c3n2	BroadT	BRD-K44020402	BRD-K44020402-001-06-2	Asinex Ltd.	BAS 09530750			COc1ccc(cc1)-c1cc(C(F)F)n2ncc(C(=O)N3CCCCC3)c2n1	InChI=1S/C20H20F2N4O2/c1-28-14-7-5-13(6-8-14)16-11-17(18(21)22)26-19(24-16)15(12-23-26)20(27)25-9-3-2-4-10-25/h5-8,11-12,18H,2-4,9-10H2,1H3	UXJKFVOSUYJJRU-UHFFFAOYSA-N	386.15543232							111405
N-[(2,5-Dimethoxyphenyl)sulfonyl]-n-methylglycine	LSM-22862	SID4264373, BRD-K55144308	935064	InChI=1S/C11H15NO6S/c1-12(7-11(13)14)19(15,16)10-6-8(17-2)4-5-9(10)18-3/h4-6H,7H2,1-3H3,(H,13,14)	BVQOYZHZQLWPOX-UHFFFAOYSA-N	COc1ccc(OC)c(c1)S(=O)(=O)N(C)CC(=O)O	BroadT	BRD-K55144308	BRD-K55144308-001-06-1	ChemBridge Corporation	7933934			COc1ccc(OC)c(c1)S(=O)(=O)N(C)CC(O)=O	InChI=1S/C11H15NO6S/c1-12(7-11(13)14)19(15,16)10-6-8(17-2)4-5-9(10)18-3/h4-6H,7H2,1-3H3,(H,13,14)	BVQOYZHZQLWPOX-UHFFFAOYSA-N	289.0620079							111406
AC1LOC5W	LSM-15349	BRD-K82452257	1237106	InChI=1S/C14H19N3O2/c1-11-5-3-4-6-13(11)15-16-14(12(2)18)17-7-9-19-10-8-17/h3-6,15H,7-10H2,1-2H3	LYJVIKGETNIJGO-UHFFFAOYSA-N	CC(=O)C(=NNc1ccccc1C)N2CCOCC2	BroadT	BRD-K82452257	BRD-K82452257-003-05-4	Specs	AF-886/30752026		Cl	CC(=O)C(=NNc1ccccc1C)N1CCOCC1.Cl	InChI=1S/C14H19N3O2.ClH/c1-11-5-3-4-6-13(11)15-16-14(12(2)18)17-7-9-19-10-8-17;/h3-6,15H,7-10H2,1-2H3;1H	VCEIXQWWDCGGSL-UHFFFAOYSA-N	261.147726878							103995
SMR000170972	LSM-22863	SID17507025, BRD-K21287452	1176185	InChI=1S/C23H24N2O5S/c1-12-6-7-13(2)21-15(12)8-14(3)22(25-21)31-11-20(26)24-17-10-19(30-5)18(29-4)9-16(17)23(27)28/h6-10H,11H2,1-5H3,(H,24,26)(H,27,28)	RKMNDAWJVXOWIR-UHFFFAOYSA-N	COc1cc(NC(=O)CSc2nc3c(C)ccc(C)c3cc2C)c(cc1OC)C(=O)O	BroadT	BRD-K21287452	BRD-K21287452-001-05-5	Asinex Ltd.	ASN 04459898			COc1cc(NC(=O)CSc2nc3c(C)ccc(C)c3cc2C)c(cc1OC)C(O)=O	InChI=1S/C23H24N2O5S/c1-12-6-7-13(2)21-15(12)8-14(3)22(25-21)31-11-20(26)24-17-10-19(30-5)18(29-4)9-16(17)23(27)28/h6-10H,11H2,1-5H3,(H,24,26)(H,27,28)	RKMNDAWJVXOWIR-UHFFFAOYSA-N	440.140592578							111407
BAS 07856893	LSM-22864	SID850015, BRD-K60448585	652526	InChI=1S/C12H14N2O3S/c1-3-17-8-4-5-9-10(6-8)18-12(13-9)14-11(15)7-16-2/h4-6H,3,7H2,1-2H3,(H,13,14,15)	SZPFSGXHTVEACE-UHFFFAOYSA-N	CCOc1ccc2nc(NC(=O)COC)sc2c1	BroadT	BRD-K60448585	BRD-K60448585-001-06-3	Asinex Ltd.	BAS 07856893			CCOc1ccc2nc(NC(=O)COC)sc2c1	InChI=1S/C12H14N2O3S/c1-3-17-8-4-5-9-10(6-8)18-12(13-9)14-11(15)7-16-2/h4-6H,3,7H2,1-2H3,(H,13,14,15)	SZPFSGXHTVEACE-UHFFFAOYSA-N	266.072513018							111408
MLS000098534	LSM-22865	SID3712705, BRD-K46643828	2998128	InChI=1S/C18H16N4O3S/c1-3-22-13-7-5-4-6-12(13)15-16(22)19-18(21-20-15)26-10-11-8-9-14(25-11)17(23)24-2/h4-9H,3,10H2,1-2H3	DTHZZOGDKUZVBT-UHFFFAOYSA-N	CCn1c2ccccc2c3nnc(SCc4oc(cc4)C(=O)OC)nc13	BroadT	BRD-K46643828	BRD-K46643828-001-05-7	Enamine Ltd.	ZU-4434093			CCn1c2ccccc2c2nnc(SCc3ccc(o3)C(=O)OC)nc12	InChI=1S/C18H16N4O3S/c1-3-22-13-7-5-4-6-12(13)15-16(22)19-18(21-20-15)26-10-11-8-9-14(25-11)17(23)24-2/h4-9H,3,10H2,1-2H3	DTHZZOGDKUZVBT-UHFFFAOYSA-N	368.094311102							111409
MLS001032399	LSM-22866	SID49816200, BRD-A62510567	16421865	InChI=1S/C25H23ClN2O7/c1-14-15-10-17(26)18(29)12-21(15)35-25(32)16(14)11-23(30)27-6-8-28(9-7-27)24(31)22-13-33-19-4-2-3-5-20(19)34-22/h2-5,10,12,22,29H,6-9,11,13H2,1H3	YCOAROPTJJWRMT-UHFFFAOYSA-N	CC1=C(CC(=O)N2CCN(CC2)C(=O)C3COc4ccccc4O3)C(=O)Oc5cc(O)c(Cl)cc15	BroadT	BRD-A62510567	BRD-A62510567-001-06-2	InterBioScreen Ltd.	STOCK6S-16913			Cc1c(CC(=O)N2CCN(CC2)C(=O)C2COc3ccccc3O2)c(=O)oc2cc(O)c(Cl)cc12	InChI=1S/C25H23ClN2O7/c1-14-15-10-17(26)18(29)12-21(15)35-25(32)16(14)11-23(30)27-6-8-28(9-7-27)24(31)22-13-33-19-4-2-3-5-20(19)34-22/h2-5,10,12,22,29H,6-9,11,13H2,1H3	YCOAROPTJJWRMT-UHFFFAOYSA-N	498.119378806							111410
MLS000729529	LSM-22867	SID24810336, BRD-K47391009	16193065	InChI=1S/C29H37N5OS/c35-28-25-21-24(11-12-26(25)32-27-10-5-2-6-17-34(27)28)31-29(36)30-15-7-16-33-18-13-23(14-19-33)20-22-8-3-1-4-9-22/h1,3-4,8-9,11-12,21,23H,2,5-7,10,13-20H2,(H2,30,31,36)	GWHHFRPVMDSYAW-UHFFFAOYSA-N	O=C1N2CCCCCC2=Nc3ccc(NC(=S)NCCCN4CCC(Cc5ccccc5)CC4)cc13	BroadT	BRD-K47391009	BRD-K47391009-001-07-9	ChemDiv Inc.	C066-3511			O=c1n2CCCCCc2nc2ccc(NC(=S)NCCCN3CCC(Cc4ccccc4)CC3)cc12	InChI=1S/C29H37N5OS/c35-28-25-21-24(11-12-26(25)32-27-10-5-2-6-17-34(27)28)31-29(36)30-15-7-16-33-18-13-23(14-19-33)20-22-8-3-1-4-9-22/h1,3-4,8-9,11-12,21,23H,2,5-7,10,13-20H2,(H2,30,31,36)	GWHHFRPVMDSYAW-UHFFFAOYSA-N	503.271881544							111411
MLS000727621	LSM-22868	SID24785003, BRD-A88118845	16188600	InChI=1S/C14H21N3S/c1-3-4-8-11-14(2)15-13(18)17(16-14)12-9-6-5-7-10-12/h5-7,9-10,16H,3-4,8,11H2,1-2H3,(H,15,18)	PNZKZFFPLXJZJA-UHFFFAOYSA-N	CCCCCC1(C)NN(C(=N1)S)c2ccccc2	BroadT	BRD-A88118845	BRD-A88118845-001-05-0	ChemDiv Inc.	6220-7408			CCCCCC1(C)NN(C(S)=N1)c1ccccc1	InChI=1S/C14H21N3S/c1-3-4-8-11-14(2)15-13(18)17(16-14)12-9-6-5-7-10-12/h5-7,9-10,16H,3-4,8,11H2,1-2H3,(H,15,18)	PNZKZFFPLXJZJA-UHFFFAOYSA-N	263.145618392							111412
64369-55-7	LSM-22869	SID24816219, BRD-K63471008	54680650	InChI=1S/C13H15NO3/c1-3-14(4-2)9-5-6-10-11(15)8-13(16)17-12(10)7-9/h5-8,15H,3-4H2,1-2H3	XTPBPGPAPLKZGO-UHFFFAOYSA-N	CCN(CC)c1ccc2C(=CC(=O)Oc2c1)O	BroadT	BRD-K63471008	BRD-K63471008-001-05-3	Life Chemicals Inc.	F1754-0126			CCN(CC)c1ccc2c(O)cc(=O)oc2c1	InChI=1S/C13H15NO3/c1-3-14(4-2)9-5-6-10-11(15)8-13(16)17-12(10)7-9/h5-8,15H,3-4H2,1-2H3	XTPBPGPAPLKZGO-UHFFFAOYSA-N	233.10519335							111413
2-[(3,4-Dimethylphenyl)thio]nicotinic acid	LSM-22870	SID22408654, BRD-K28994748	2454959	InChI=1S/C14H13NO2S/c1-9-5-6-11(8-10(9)2)18-13-12(14(16)17)4-3-7-15-13/h3-8H,1-2H3,(H,16,17)	CRLOVVXMPXCXPM-UHFFFAOYSA-N	Cc1ccc(Sc2ncccc2C(=O)O)cc1C	BroadT	BRD-K28994748	BRD-K28994748-001-05-3	Enamine Ltd.	T5311460			Cc1ccc(Sc2ncccc2C(O)=O)cc1C	InChI=1S/C14H13NO2S/c1-9-5-6-11(8-10(9)2)18-13-12(14(16)17)4-3-7-15-13/h3-8H,1-2H3,(H,16,17)	CRLOVVXMPXCXPM-UHFFFAOYSA-N	259.066699356							111414
AC1N2X23	LSM-22871	BRD-K95062972	4103406	InChI=1S/C17H14BrN3/c1-12-10-17(20-16-9-5-3-7-14(12)16)21-19-11-13-6-2-4-8-15(13)18/h2-11H,1H3,(H,20,21)	IUCDOPHSJXCCHP-UHFFFAOYSA-N	Cc1cc(NN=Cc2ccccc2Br)nc3ccccc13	BroadT	BRD-K95062972	BRD-K95062972-001-06-2	Enamine Ltd.	T0505-1891			Cc1cc(NN=Cc2ccccc2Br)nc2ccccc12	InChI=1S/C17H14BrN3/c1-12-10-17(20-16-9-5-3-7-14(12)16)21-19-11-13-6-2-4-8-15(13)18/h2-11H,1H3,(H,20,21)	IUCDOPHSJXCCHP-UHFFFAOYSA-N	339.037110078							111415
MLS000044972	LSM-22872	SID4242265, BRD-K39355539	3237143	InChI=1S/C20H20N2O3S/c23-19(21-14-16-7-4-10-25-16)18-13-17(15-5-2-1-3-6-15)20(26-18)22-8-11-24-12-9-22/h1-7,10,13H,8-9,11-12,14H2,(H,21,23)	YNQKTIWLJRLBMK-UHFFFAOYSA-N	O=C(NCc1occc1)c2cc(c3ccccc3)c(s2)N4CCOCC4	BroadT	BRD-K39355539	BRD-K39355539-001-05-7	ChemDiv Inc.	C430-0065			O=C(NCc1ccco1)c1cc(c(s1)N1CCOCC1)-c1ccccc1	InChI=1S/C20H20N2O3S/c23-19(21-14-16-7-4-10-25-16)18-13-17(15-5-2-1-3-6-15)20(26-18)22-8-11-24-12-9-22/h1-7,10,13H,8-9,11-12,14H2,(H,21,23)	YNQKTIWLJRLBMK-UHFFFAOYSA-N	368.11946321							111416
MLS000863981	LSM-22873	SID24839922, SID3713523, BRD-K81738907	2998437	InChI=1S/C23H29ClN2O6S/c1-3-31-21-16-20(26-10-12-30-13-11-26)22(32-4-2)15-19(21)25-23(27)9-14-33(28,29)18-7-5-17(24)6-8-18/h5-8,15-16H,3-4,9-14H2,1-2H3,(H,25,27)	VVBPVAVJVPCQNZ-UHFFFAOYSA-N	CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)CCS(=O)(=O)c3ccc(Cl)cc3	BroadT	BRD-K81738907	BRD-K81738907-001-05-5	Enamine Ltd.	T5228267			CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)CCS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H29ClN2O6S/c1-3-31-21-16-20(26-10-12-30-13-11-26)22(32-4-2)15-19(21)25-23(27)9-14-33(28,29)18-7-5-17(24)6-8-18/h5-8,15-16H,3-4,9-14H2,1-2H3,(H,25,27)	VVBPVAVJVPCQNZ-UHFFFAOYSA-N	496.143485068							111417
F5086-0425	LSM-22874	SID49817054, BRD-K74934846	6470985	InChI=1S/C12H11N3O3/c1-15-9(4-5-13-15)12(16)14-8-2-3-10-11(6-8)18-7-17-10/h2-6H,7H2,1H3,(H,14,16)	PDIGLVOXXHQAHD-UHFFFAOYSA-N	Cn1nccc1C(=O)Nc2ccc3OCOc3c2	BroadT	BRD-K74934846	BRD-K74934846-001-05-3	ChemBridge Corporation	9055813			Cn1nccc1C(=O)Nc1ccc2OCOc2c1	InChI=1S/C12H11N3O3/c1-15-9(4-5-13-15)12(16)14-8-2-3-10-11(6-8)18-7-17-10/h2-6H,7H2,1H3,(H,14,16)	PDIGLVOXXHQAHD-UHFFFAOYSA-N	245.080041242							111418
T5435519	LSM-22875	SID49676120, BRD-K68183263	16232432	InChI=1S/C22H30FN5O3S/c1-4-28(5-2)32(30,31)17-10-11-21(27-14-12-26(3)13-15-27)20(16-17)25-22(29)24-19-9-7-6-8-18(19)23/h6-11,16H,4-5,12-15H2,1-3H3,(H2,24,25,29)	ALBMUELERHFBCG-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(N2CCN(C)CC2)c(NC(=O)Nc3ccccc3F)c1	BroadT	BRD-K68183263	BRD-K68183263-001-05-9	Enamine Ltd.	T5435519			CCN(CC)S(=O)(=O)c1ccc(N2CCN(C)CC2)c(NC(=O)Nc2ccccc2F)c1	InChI=1S/C22H30FN5O3S/c1-4-28(5-2)32(30,31)17-10-11-21(27-14-12-26(3)13-15-27)20(16-17)25-22(29)24-19-9-7-6-8-18(19)23/h6-11,16H,4-5,12-15H2,1-3H3,(H2,24,25,29)	ALBMUELERHFBCG-UHFFFAOYSA-N	463.20533876							111419
SMR000142792	LSM-22876	SID14746216, BRD-K45285279	2297467	InChI=1S/C30H26N2O4/c1-18-14-19(2)29(20(3)15-18)32-28(33)17-35-25-10-6-5-9-24(25)30(34)31-21-12-13-23-22-8-4-7-11-26(22)36-27(23)16-21/h4-16H,17H2,1-3H3,(H,31,34)(H,32,33)	FQXWMYILVDZEQV-UHFFFAOYSA-N	Cc1cc(C)c(NC(=O)COc2ccccc2C(=O)Nc3ccc4c(oc5ccccc45)c3)c(C)c1	BroadT	BRD-K45285279	BRD-K45285279-001-06-0	ChemBridge Corporation	7006444			Cc1cc(C)c(NC(=O)COc2ccccc2C(=O)Nc2ccc3c(c2)oc2ccccc32)c(C)c1	InChI=1S/C30H26N2O4/c1-18-14-19(2)29(20(3)15-18)32-28(33)17-35-25-10-6-5-9-24(25)30(34)31-21-12-13-23-22-8-4-7-11-26(22)36-27(23)16-21/h4-16H,17H2,1-3H3,(H,31,34)(H,32,33)	FQXWMYILVDZEQV-UHFFFAOYSA-N	478.189257332							111420
SMR000248783	LSM-22877	SID17516004, BRD-A47821211	3376855	InChI=1S/C22H24N2O8/c1-12(25)14-5-6-16(18(9-14)29-3)11-31-17-8-7-15(10-19(17)30-4)21(27)32-13(2)20(26)24-22(23)28/h5-10,13H,11H2,1-4H3,(H3,23,24,26,28)	NQOXPGXXTGKKGE-UHFFFAOYSA-N	COc1cc(ccc1COc2ccc(cc2OC)C(=O)OC(C)C(=O)NC(=O)N)C(=O)C	BroadT	BRD-A47821211	BRD-A47821211-001-05-5	Enamine Ltd.	T5239804			COc1cc(ccc1COc1ccc(cc1OC)C(=O)OC(C)C(=O)NC(N)=O)C(C)=O	InChI=1S/C22H24N2O8/c1-12(25)14-5-6-16(18(9-14)29-3)11-31-17-8-7-15(10-19(17)30-4)21(27)32-13(2)20(26)24-22(23)28/h5-10,13H,11H2,1-4H3,(H3,23,24,26,28)	NQOXPGXXTGKKGE-UHFFFAOYSA-N	444.153265748							111421
MLS000674907	LSM-22878	SID24795751, BRD-A24572753	2936390	InChI=1S/C18H21N3S/c1-4-18(15-8-6-5-7-9-15)19-17(22)21(20-18)16-11-10-13(2)14(3)12-16/h5-12,20H,4H2,1-3H3,(H,19,22)	VNHWKVLJCWGPDC-UHFFFAOYSA-N	CCC1(NN(C(=N1)S)c2ccc(C)c(C)c2)c3ccccc3	BroadT	BRD-A24572753	BRD-A24572753-001-11-3	ChemBridge Corporation	7354833			CCC1(NN(C(S)=N1)c1ccc(C)c(C)c1)c1ccccc1	InChI=1S/C18H21N3S/c1-4-18(15-8-6-5-7-9-15)19-17(22)21(20-18)16-11-10-13(2)14(3)12-16/h5-12,20H,4H2,1-3H3,(H,19,22)	VNHWKVLJCWGPDC-UHFFFAOYSA-N	311.145618392							111422
ZINC05006957	LSM-22879	BRD-K03295978	6788657	InChI=1S/C20H21N3O2/c1-4-25-20-11-15(6-8-19(20)24)12-21-23-18-10-14(3)22-17-7-5-13(2)9-16(17)18/h5-12,24H,4H2,1-3H3,(H,22,23)	OWMKITNVFDMYFR-UHFFFAOYSA-N	CCOc1cc(C=NNc2cc(C)nc3ccc(C)cc23)ccc1O	BroadT	BRD-K03295978	BRD-K03295978-001-05-5	Asinex Ltd.	BAS 02379576			CCOc1cc(C=NNc2cc(C)nc3ccc(C)cc23)ccc1O	InChI=1S/C20H21N3O2/c1-4-25-20-11-15(6-8-19(20)24)12-21-23-18-10-14(3)22-17-7-5-13(2)9-16(17)18/h5-12,24H,4H2,1-3H3,(H,22,23)	OWMKITNVFDMYFR-UHFFFAOYSA-N	335.163376942							
MLS001049159	LSM-43990	SID26659057, BRD-K02679776	5718958	InChI=1S/C17H14N2O/c1-12-14(15-4-2-3-5-16(15)19-12)6-7-17(20)13-8-10-18-11-9-13/h2-11,19H,1H3/b7-6+	LKXOPRJGYYWDEI-VOTSOKGWSA-N	Cc1[nH]c2ccccc2c1\C=C\C(=O)c3ccncc3	BroadT	BRD-K02679776	BRD-K02679776-001-05-5	InterBioScreen Ltd.	STOCK1S-75250			Cc1[nH]c2ccccc2c1\C=C\C(=O)c1ccncc1	InChI=1S/C17H14N2O/c1-12-14(15-4-2-3-5-16(15)19-12)6-7-17(20)13-8-10-18-11-9-13/h2-11,19H,1H3/b7-6+	LKXOPRJGYYWDEI-VOTSOKGWSA-N	262.110613088							
KUC100029	LSM-22881	SID14728537, BRD-K96601418	6095343	InChI=1S/C19H17NO2/c1-14-7-5-6-10-16(14)17-11-12-18(22-17)19(21)20-13-15-8-3-2-4-9-15/h2-12H,13H2,1H3,(H,20,21)	NRDAHWVAKMEMEF-UHFFFAOYSA-N	Cc1ccccc1c2oc(cc2)C(=O)NCc3ccccc3	BroadT	BRD-K96601418	BRD-K96601418-001-05-0	University of Kansas CMLD	KUC100029			Cc1ccccc1-c1ccc(o1)C(=O)NCc1ccccc1	InChI=1S/C19H17NO2/c1-14-7-5-6-10-16(14)17-11-12-18(22-17)19(21)20-13-15-8-3-2-4-9-15/h2-12H,13H2,1H3,(H,20,21)	NRDAHWVAKMEMEF-UHFFFAOYSA-N	291.125928794							111425
Ethyl 4-piperidino-3-({[3-(trifluoromethyl)phenyl]sulfonyl}amino)benzoate	LSM-22882	SID26726698, BRD-K34826994	2818636	InChI=1S/C21H23F3N2O4S/c1-2-30-20(27)15-9-10-19(26-11-4-3-5-12-26)18(13-15)25-31(28,29)17-8-6-7-16(14-17)21(22,23)24/h6-10,13-14,25H,2-5,11-12H2,1H3	RQMWHSIXJAGYKG-UHFFFAOYSA-N	CCOC(=O)c1ccc(N2CCCCC2)c(NS(=O)(=O)c3cccc(c3)C(F)(F)F)c1	BroadT	BRD-K34826994	BRD-K34826994-001-05-0	Maybridge	JP 00623			CCOC(=O)c1ccc(N2CCCCC2)c(NS(=O)(=O)c2cccc(c2)C(F)(F)F)c1	InChI=1S/C21H23F3N2O4S/c1-2-30-20(27)15-9-10-19(26-11-4-3-5-12-26)18(13-15)25-31(28,29)17-8-6-7-16(14-17)21(22,23)24/h6-10,13-14,25H,2-5,11-12H2,1H3	RQMWHSIXJAGYKG-UHFFFAOYSA-N	456.133062526							111426
AC1O48WB	LSM-43991	SID26661213, BRD-K97267761	6356811	InChI=1S/C25H31N3O2/c1-5-27(6-2)16-10-15-26-17-22-20-13-7-8-14-21(20)24(29)28(25(22)30)23-18(3)11-9-12-19(23)4/h7-9,11-14,17,26H,5-6,10,15-16H2,1-4H3/b22-17+	CRVGULJJFAQILD-OQKWZONESA-N	CCN(CC)CCCN\C=C/1\C(=O)N(C(=O)c2ccccc12)c3c(C)cccc3C	BroadT	BRD-K97267761	BRD-K97267761-001-04-5	InterBioScreen Ltd.	STOCK5S-54726			CCN(CC)CCCN\C=C1\C(=O)N(C(=O)c2ccccc12)c1c(C)cccc1C	InChI=1S/C25H31N3O2/c1-5-27(6-2)16-10-15-26-17-22-20-13-7-8-14-21(20)24(29)28(25(22)30)23-18(3)11-9-12-19(23)4/h7-9,11-14,17,26H,5-6,10,15-16H2,1-4H3/b22-17+	CRVGULJJFAQILD-OQKWZONESA-N	405.241627262							
SMR000063053	LSM-22884	SID24839890, SID3715818, BRD-K47278119	2099531	InChI=1S/C21H17N3O4S3/c1-24-20(26)18-13(16-3-2-6-29-16)9-30-19(18)23-21(24)31-10-17(25)22-8-12-4-5-14-15(7-12)28-11-27-14/h2-7,9H,8,10-11H2,1H3,(H,22,25)	SOUBHHITTGQVPZ-UHFFFAOYSA-N	CN1C(=Nc2scc(c3cccs3)c2C1=O)SCC(=O)NCc4ccc5OCOc5c4	BroadT	BRD-K47278119	BRD-K47278119-001-05-9	Enamine Ltd.	T5223537			Cn1c(SCC(=O)NCc2ccc3OCOc3c2)nc2scc(-c3cccs3)c2c1=O	InChI=1S/C21H17N3O4S3/c1-24-20(26)18-13(16-3-2-6-29-16)9-30-19(18)23-21(24)31-10-17(25)22-8-12-4-5-14-15(7-12)28-11-27-14/h2-7,9H,8,10-11H2,1H3,(H,22,25)	SOUBHHITTGQVPZ-UHFFFAOYSA-N	471.038118124							111428
N-Dibenzofuran-3-yl-isobutyramide	LSM-22885	SID14727030, BRD-K48368237	3150699	InChI=1S/C16H15NO2/c1-10(2)16(18)17-11-7-8-13-12-5-3-4-6-14(12)19-15(13)9-11/h3-10H,1-2H3,(H,17,18)	ZFMQSEJCBHVOOS-UHFFFAOYSA-N	CC(C)C(=O)Nc1ccc2c(oc3ccccc23)c1	BroadT	BRD-K48368237	BRD-K48368237-001-05-4	Asinex Ltd.	BAS 04456711			CC(C)C(=O)Nc1ccc2c(c1)oc1ccccc21	InChI=1S/C16H15NO2/c1-10(2)16(18)17-11-7-8-13-12-5-3-4-6-14(12)19-15(13)9-11/h3-10H,1-2H3,(H,17,18)	ZFMQSEJCBHVOOS-UHFFFAOYSA-N	253.11027873							111429
1-[4-(1H-Indol-3-ylmethyl)piperazin-1-yl]-2-(naphthalen-2-yloxy)ethanone	LSM-15552	BRD-K69934199	1530475	InChI=1S/C25H25N3O2/c29-25(18-30-22-10-9-19-5-1-2-6-20(19)15-22)28-13-11-27(12-14-28)17-21-16-26-24-8-4-3-7-23(21)24/h1-10,15-16,26H,11-14,17-18H2	KDZXBGISISNCTN-UHFFFAOYSA-N	O=C(COc1ccc2ccccc2c1)N3CCN(Cc4c[nH]c5ccccc45)CC3	BroadT	BRD-K69934199	BRD-K69934199-034-06-2	InterBioScreen Ltd.	STOCK3S-26085		OC(=O)C(=O)O	O=C(COc1ccc2ccccc2c1)N1CCN(Cc2c[nH]c3ccccc23)CC1.OC(=O)C(=O)O	InChI=1S/C25H25N3O2.C2H2O4/c29-25(18-30-22-10-9-19-5-1-2-6-20(19)15-22)28-13-11-27(12-14-28)17-21-16-26-24-8-4-3-7-23(21)24;3-1(4)2(5)6/h1-10,15-16,26H,11-14,17-18H2;(H,3,4)(H,5,6)	MMLFHXINKWOJCF-UHFFFAOYSA-N	399.19467707							104188, 104188
ST50932326	LSM-22886	SID49730393, BRD-K37022610	4649795	InChI=1S/C23H21N3O3/c1-14(2)28-17-10-8-16(9-11-17)21-13-19(18-6-4-5-7-20(18)24-21)23(27)25-22-12-15(3)29-26-22/h4-14H,1-3H3,(H,25,26,27)	WBZRHYRXZZAKOM-UHFFFAOYSA-N	CC(C)Oc1ccc(cc1)c2cc(C(=O)Nc3cc(C)on3)c4ccccc4n2	BroadT	BRD-K37022610	BRD-K37022610-001-05-7	ChemDiv Inc.	6049-2458			CC(C)Oc1ccc(cc1)-c1cc(C(=O)Nc2cc(C)on2)c2ccccc2n1	InChI=1S/C23H21N3O3/c1-14(2)28-17-10-8-16(9-11-17)21-13-19(18-6-4-5-7-20(18)24-21)23(27)25-22-12-15(3)29-26-22/h4-14H,1-3H3,(H,25,26,27)	WBZRHYRXZZAKOM-UHFFFAOYSA-N	387.158291562							111430
SMR000171258	LSM-43992	SID17505138, BRD-K49307824	1968675	InChI=1S/C21H18FN5O4S2/c1-31-20-19(23-12-13-24-20)27-33(29,30)17-9-7-16(8-10-17)25-21(32)26-18(28)11-4-14-2-5-15(22)6-3-14/h2-13H,1H3,(H,23,27)(H2,25,26,28,32)/b11-4+	JBFQKYANYGPRJY-NYYWCZLTSA-N	COc1nccnc1NS(=O)(=O)c2ccc(NC(=S)NC(=O)\C=C\c3ccc(F)cc3)cc2	BroadT	BRD-K49307824	BRD-K49307824-001-05-0	Asinex Ltd.	BAS 00224426			COc1nccnc1NS(=O)(=O)c1ccc(NC(=S)NC(=O)\C=C\c2ccc(F)cc2)cc1	InChI=1S/C21H18FN5O4S2/c1-31-20-19(23-12-13-24-20)27-33(29,30)17-9-7-16(8-10-17)25-21(32)26-18(28)11-4-14-2-5-15(22)6-3-14/h2-13H,1H3,(H,23,27)(H2,25,26,28,32)/b11-4+	JBFQKYANYGPRJY-NYYWCZLTSA-N	487.078423686							
SMR000020474	LSM-22888	SID4251424, BRD-K91117991	3245113	InChI=1S/C22H20N4O6/c1-31-18-9-7-13(11-19(18)32-2)17(27)12-25-21(30)15(8-10-20(28)29)24-26-16-6-4-3-5-14(16)23-22(25)26/h3-7,9,11H,8,10,12H2,1-2H3,(H,28,29)	AEWZLQMPHQVZPN-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)CN2C(=O)C(=Nn3c2nc4ccccc34)CCC(=O)O	BroadT	BRD-K91117991	BRD-K91117991-001-06-5	ChemDiv Inc.	6325-0282			COc1ccc(cc1OC)C(=O)Cn1c2nc3ccccc3n2nc(CCC(O)=O)c1=O	InChI=1S/C22H20N4O6/c1-31-18-9-7-13(11-19(18)32-2)17(27)12-25-21(30)15(8-10-20(28)29)24-26-16-6-4-3-5-14(16)23-22(25)26/h3-7,9,11H,8,10,12H2,1-2H3,(H,28,29)	AEWZLQMPHQVZPN-UHFFFAOYSA-N	436.1382844							111432
BAS 03611890	LSM-22889	SID846476, SID26668108, BRD-K04176522	648864	InChI=1S/C21H17F3N6O2/c22-21(23,24)17-12-14(16-4-3-11-32-16)26-19-13-15(27-30(17)19)20(31)29-9-7-28(8-10-29)18-5-1-2-6-25-18/h1-6,11-13H,7-10H2	KQWJKFSJSPRXBB-UHFFFAOYSA-N	FC(F)(F)c1cc(nc2cc(nn12)C(=O)N3CCN(CC3)c4ccccn4)c5occc5	BroadT	BRD-K04176522	BRD-K04176522-001-05-7	Asinex Ltd.	BAS 03611890			FC(F)(F)c1cc(nc2cc(nn12)C(=O)N1CCN(CC1)c1ccccn1)-c1ccco1	InChI=1S/C21H17F3N6O2/c22-21(23,24)17-12-14(16-4-3-11-32-16)26-19-13-15(27-30(17)19)20(31)29-9-7-28(8-10-29)18-5-1-2-6-25-18/h1-6,11-13H,7-10H2	KQWJKFSJSPRXBB-UHFFFAOYSA-N	442.136508444							111433
N-(2-Methyl-1,3-benzothiazol-6-yl)benzamide	LSM-22890	SID24793691, BRD-K19113048	2729277	InChI=1S/C15H12N2OS/c1-10-16-13-8-7-12(9-14(13)19-10)17-15(18)11-5-3-2-4-6-11/h2-9H,1H3,(H,17,18)	HAJUZHWOPHZKNZ-UHFFFAOYSA-N	Cc1nc2ccc(NC(=O)c3ccccc3)cc2s1	BroadT	BRD-K19113048	BRD-K19113048-001-05-8	ChemBridge Corporation	7994176			Cc1nc2ccc(NC(=O)c3ccccc3)cc2s1	InChI=1S/C15H12N2OS/c1-10-16-13-8-7-12(9-14(13)19-10)17-15(18)11-5-3-2-4-6-11/h2-9H,1H3,(H,17,18)	HAJUZHWOPHZKNZ-UHFFFAOYSA-N	268.067033714							111434
AC1MWXRR	LSM-22891	SID26671341, BRD-A10785649	3756780	InChI=1S/C22H18N2O5S2/c1-10-3-6-12(7-4-10)24-20(26)16-15(11-5-8-13(25)14(9-11)29-2)17-19(23-22(28)31-17)30-18(16)21(24)27/h3-9,15-16,18,25H,1-2H3,(H,23,28)	LQRXVRDYPFEJOP-UHFFFAOYSA-N	COc1cc(ccc1O)C2C3C(Sc4nc(O)sc24)C(=O)N(C3=O)c5ccc(C)cc5	BroadT	BRD-A10785649	BRD-A10785649-001-07-3	InterBioScreen Ltd.	STOCK3S-94030			COc1cc(ccc1O)C1C2C(Sc3nc(O)sc13)C(=O)N(C2=O)c1ccc(C)cc1	InChI=1S/C22H18N2O5S2/c1-10-3-6-12(7-4-10)24-20(26)16-15(11-5-8-13(25)14(9-11)29-2)17-19(23-22(28)31-17)30-18(16)21(24)27/h3-9,15-16,18,25H,1-2H3,(H,23,28)	LQRXVRDYPFEJOP-UHFFFAOYSA-N	454.065713076							111435
ST51029420	LSM-22892	SID17414330, BRD-K43400236	2907665	InChI=1S/C17H24N4O2S/c22-21(23)16-8-6-15(7-9-16)19-10-12-20(13-11-19)17(24)18-14-4-2-1-3-5-14/h6-9,14H,1-5,10-13H2,(H,18,24)	IAFFAWSDWUDDKZ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=NC3CCCCC3)S	BroadT	BRD-K43400236	BRD-K43400236-001-05-1	ChemBridge Corporation	6639542			[O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(S)=NC1CCCCC1	InChI=1S/C17H24N4O2S/c22-21(23)16-8-6-15(7-9-16)19-10-12-20(13-11-19)17(24)18-14-4-2-1-3-5-14/h6-9,14H,1-5,10-13H2,(H,18,24)	IAFFAWSDWUDDKZ-UHFFFAOYSA-N	348.161996738							111436
4-Ethyl-2-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]pyridine	LSM-22893	SID26728761, BRD-K68206619	2811859	InChI=1S/C15H17N3O3S/c1-3-12-8-9-16-14(10-12)17-15(19)18-22(20,21)13-6-4-11(2)5-7-13/h4-10H,3H2,1-2H3,(H2,16,17,18,19)	GJTRUSPGDTVEHA-UHFFFAOYSA-N	CCc1ccnc(NC(=O)NS(=O)(=O)c2ccc(C)cc2)c1	BroadT	BRD-K68206619	BRD-K68206619-001-05-9	Maybridge	HTS 04555			CCc1ccnc(NC(=O)NS(=O)(=O)c2ccc(C)cc2)c1	InChI=1S/C15H17N3O3S/c1-3-12-8-9-16-14(10-12)17-15(19)18-22(20,21)13-6-4-11(2)5-7-13/h4-10H,3H2,1-2H3,(H2,16,17,18,19)	GJTRUSPGDTVEHA-UHFFFAOYSA-N	319.099062124							111437
T0518-6531	LSM-22894	SID22408241, BRD-A32427782	4399710	InChI=1S/C28H22ClN5O2S/c1-36-24-9-5-8-22(18-24)31-27(35)25(19-6-3-2-4-7-19)37-28-33-32-26(20-14-16-30-17-15-20)34(28)23-12-10-21(29)11-13-23/h2-18,25H,1H3,(H,31,35)	HEDGTPHWTWKAIJ-UHFFFAOYSA-N	COc1cccc(NC(=O)C(Sc2nnc(c3ccncc3)n2c4ccc(Cl)cc4)c5ccccc5)c1	BroadT	BRD-A32427782	BRD-A32427782-001-05-7	Enamine Ltd.	T0518-6531			COc1cccc(NC(=O)C(Sc2nnc(-c3ccncc3)n2-c2ccc(Cl)cc2)c2ccccc2)c1	InChI=1S/C28H22ClN5O2S/c1-36-24-9-5-8-22(18-24)31-27(35)25(19-6-3-2-4-7-19)37-28-33-32-26(20-14-16-30-17-15-20)34(28)23-12-10-21(29)11-13-23/h2-18,25H,1H3,(H,31,35)	HEDGTPHWTWKAIJ-UHFFFAOYSA-N	527.118273394							111438
SMR000063178	LSM-22895	SID3716490, BRD-K22832371	2083638	InChI=1S/C17H15N5OS3/c1-10-3-4-13(11(2)7-10)19-15-20-21-17(26-15)25-9-12-8-14(23)22-5-6-24-16(22)18-12/h3-8H,9H2,1-2H3,(H,19,20)	FELLCHJNIJXOJI-UHFFFAOYSA-N	Cc1ccc(Nc2nnc(SCC3=CC(=O)N4C=CSC4=N3)s2)c(C)c1	BroadT	BRD-K22832371	BRD-K22832371-001-05-5	Enamine Ltd.	T5226468			Cc1ccc(Nc2nnc(SCc3cc(=O)n4ccsc4n3)s2)c(C)c1	InChI=1S/C17H15N5OS3/c1-10-3-4-13(11(2)7-10)19-15-20-21-17(26-15)25-9-12-8-14(23)22-5-6-24-16(22)18-12/h3-8H,9H2,1-2H3,(H,19,20)	FELLCHJNIJXOJI-UHFFFAOYSA-N	401.04387222							111439
2-(2,3-Dioxo-2,3-dihydro-1H-indol-1-yl)-n-(2-phenylethyl)acetamide	LSM-22896	SID24785477, BRD-K24431631	4410320	InChI=1S/C18H16N2O3/c21-16(19-11-10-13-6-2-1-3-7-13)12-20-15-9-5-4-8-14(15)17(22)18(20)23/h1-9H,10-12H2,(H,19,21)	DLPGRXZQESYPTH-UHFFFAOYSA-N	O=C(CN1C(=O)C(=O)c2ccccc12)NCCc3ccccc3	BroadT	BRD-K24431631	BRD-K24431631-001-05-0	ChemDiv Inc.	6000-0529			O=C(CN1C(=O)C(=O)c2ccccc12)NCCc1ccccc1	InChI=1S/C18H16N2O3/c21-16(19-11-10-13-6-2-1-3-7-13)12-20-15-9-5-4-8-14(15)17(22)18(20)23/h1-9H,10-12H2,(H,19,21)	DLPGRXZQESYPTH-UHFFFAOYSA-N	308.116092392							111440
AC1O9LRS	LSM-22897	SID24791451, BRD-K86978811	6761672	InChI=1S/C24H21N3O6/c1-31-22-10-5-16(11-23(22)32-2)20-13-25-26-24(20)19-9-8-18(12-21(19)28)33-14-15-3-6-17(7-4-15)27(29)30/h3-13,28H,14H2,1-2H3,(H,25,26)	PZUSKQAPZIFDNZ-UHFFFAOYSA-N	COc1ccc(cc1OC)c2c[nH]nc2c3ccc(OCc4ccc(cc4)[N+](=O)[O-])cc3O	BroadT	BRD-K86978811	BRD-K86978811-001-06-5	InterBioScreen Ltd.	STOCK4S-53583			COc1ccc(cc1OC)-c1c[nH]nc1-c1ccc(OCc2ccc(cc2)[N+]([O-])=O)cc1O	InChI=1S/C24H21N3O6/c1-31-22-10-5-16(11-23(22)32-2)20-13-25-26-24(20)19-9-8-18(12-21(19)28)33-14-15-3-6-17(7-4-15)27(29)30/h3-13,28H,14H2,1-2H3,(H,25,26)	PZUSKQAPZIFDNZ-UHFFFAOYSA-N	447.143035422							
MLS001017599	LSM-22898	SID24828093, BRD-A57540624	3580640	InChI=1S/C19H27NO3/c21-19(20-16-6-3-1-2-4-7-16)15-9-11-17(12-10-15)23-14-18-8-5-13-22-18/h9-12,16,18H,1-8,13-14H2,(H,20,21)	AOHGWLYZVBCVCN-UHFFFAOYSA-N	O=C(NC1CCCCCC1)c2ccc(OCC3CCCO3)cc2	BroadT	BRD-A57540624	BRD-A57540624-001-05-9	Enamine Ltd.	T5253104			O=C(NC1CCCCCC1)c1ccc(OCC2CCCO2)cc1	InChI=1S/C19H27NO3/c21-19(20-16-6-3-1-2-4-7-16)15-9-11-17(12-10-15)23-14-18-8-5-13-22-18/h9-12,16,18H,1-8,13-14H2,(H,20,21)	AOHGWLYZVBCVCN-UHFFFAOYSA-N	317.199093734							111442
2-{Benzyl[(4-Methylphenyl)sulfonyl]amino}-n-{2-[(furan-2-ylmethyl)carbamoyl]phenyl}benzamide	LSM-22899	SID17433886, BRD-K86043307	1319436	InChI=1S/C33H29N3O5S/c1-24-17-19-27(20-18-24)42(39,40)36(23-25-10-3-2-4-11-25)31-16-8-6-14-29(31)33(38)35-30-15-7-5-13-28(30)32(37)34-22-26-12-9-21-41-26/h2-21H,22-23H2,1H3,(H,34,37)(H,35,38)	NKZDVQXLMZMPQT-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N(Cc2ccccc2)c3ccccc3C(=O)Nc4ccccc4C(=O)NCc5occc5	BroadT	BRD-K86043307	BRD-K86043307-001-05-1	ChemBridge Corporation	7620445			Cc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1ccccc1C(=O)Nc1ccccc1C(=O)NCc1ccco1	InChI=1S/C33H29N3O5S/c1-24-17-19-27(20-18-24)42(39,40)36(23-25-10-3-2-4-11-25)31-16-8-6-14-29(31)33(38)35-30-15-7-5-13-28(30)32(37)34-22-26-12-9-21-41-26/h2-21H,22-23H2,1H3,(H,34,37)(H,35,38)	NKZDVQXLMZMPQT-UHFFFAOYSA-N	579.182791748							111443
MLS001175985	LSM-22900	SID49673880, BRD-A81264506	4840012	InChI=1S/C22H26Cl2N4S/c1-28(2)11-5-10-25-22(29)27-14-18(16-9-8-15(23)12-20(16)24)19-13-26-21-7-4-3-6-17(19)21/h3-4,6-9,12-13,18,26H,5,10-11,14H2,1-2H3,(H2,25,27,29)	RYOMGTNXPFHHBB-UHFFFAOYSA-N	CN(C)CCCN=C(S)NCC(c1ccc(Cl)cc1Cl)c2c[nH]c3ccccc23	BroadT	BRD-A81264506	BRD-A81264506-001-06-7	Enamine Ltd.	T5336634			CN(C)CCCN=C(S)NCC(c1c[nH]c2ccccc12)c1ccc(Cl)cc1Cl	InChI=1S/C22H26Cl2N4S/c1-28(2)11-5-10-25-22(29)27-14-18(16-9-8-15(23)12-20(16)24)19-13-26-21-7-4-3-6-17(19)21/h3-4,6-9,12-13,18,26H,5,10-11,14H2,1-2H3,(H2,25,27,29)	RYOMGTNXPFHHBB-UHFFFAOYSA-N	448.125522982							111444
MLS000585415	LSM-43993	SID22401978, BRD-K10132543	6054970	InChI=1S/C21H24N4O3/c1-5-24-14(3)10-16(15(24)4)11-18-20(27)25(21(28)23-18)12-19(26)22-17-8-6-7-13(2)9-17/h6-11H,5,12H2,1-4H3,(H,22,26)(H,23,28)/b18-11+	KRLRNWKLQODOPC-WOJGMQOQSA-N	CCn1c(C)cc(\C=C/2\NC(=O)N(CC(=O)Nc3cccc(C)c3)C2=O)c1C	BroadT	BRD-K10132543	BRD-K10132543-001-05-7	ChemDiv Inc.	5775-2749			CCn1c(C)cc(\C=C2\NC(=O)N(CC(=O)Nc3cccc(C)c3)C2=O)c1C	InChI=1S/C21H24N4O3/c1-5-24-14(3)10-16(15(24)4)11-18-20(27)25(21(28)23-18)12-19(26)22-17-8-6-7-13(2)9-17/h6-11H,5,12H2,1-4H3,(H,22,26)(H,23,28)/b18-11+	KRLRNWKLQODOPC-WOJGMQOQSA-N	380.184840668							
EN300-34001	LSM-22902	BRD-K59629332	2816527	InChI=1S/C12H10N4O2S/c1-18-8-4-2-7(3-5-8)16-11(17)9-6-13-15-10(9)14-12(16)19/h2-6,17H,1H3,(H,14,15,19)	QJQXTMNXJUSKOR-UHFFFAOYSA-N	COc1ccc(cc1)n2c(S)nc3nncc3c2O	BroadT	BRD-K59629332	BRD-K59629332-001-05-9	Maybridge	HTS 12691			COc1ccc(cc1)-n1c(S)nc2nncc2c1O	InChI=1S/C12H10N4O2S/c1-18-8-4-2-7(3-5-8)16-11(17)9-6-13-15-10(9)14-12(16)19/h2-6,17H,1H3,(H,14,15,19)	QJQXTMNXJUSKOR-UHFFFAOYSA-N	274.05244629							
AMBCB37343325	LSM-22903	SID24798465, BRD-K01738259	16190136	InChI=1S/C23H26FN3O2/c1-28-21-8-6-20(7-9-21)27-16-18(15-26-12-10-22(29-2)11-13-26)23(25-27)17-4-3-5-19(24)14-17/h3-9,14,16,22H,10-13,15H2,1-2H3	SQQVQOVLNKJKPI-UHFFFAOYSA-N	COC1CCN(Cc2cn(nc2c3cccc(F)c3)c4ccc(OC)cc4)CC1	BroadT	BRD-K01738259	BRD-K01738259-001-05-6	ChemBridge Corporation	37343325			COC1CCN(Cc2cn(nc2-c2cccc(F)c2)-c2ccc(OC)cc2)CC1	InChI=1S/C23H26FN3O2/c1-28-21-8-6-20(7-9-21)27-16-18(15-26-12-10-22(29-2)11-13-26)23(25-27)17-4-3-5-19(24)14-17/h3-9,14,16,22H,10-13,15H2,1-2H3	SQQVQOVLNKJKPI-UHFFFAOYSA-N	395.200905302							111447
SMR000094528	LSM-22904	SID24838328, SID7968703, BRD-K18185026	5309555	InChI=1S/C19H20Cl2N2O6S/c1-2-28-19(25)23-10-8-22(9-11-23)18(24)16-7-6-13(29-16)12-30(26,27)17-14(20)4-3-5-15(17)21/h3-7H,2,8-12H2,1H3	QZGMYCFITBDQMF-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)c2oc(CS(=O)(=O)c3c(Cl)cccc3Cl)cc2	BroadT	BRD-K18185026	BRD-K18185026-001-06-1	ChemDiv Inc.	C521-2085			CCOC(=O)N1CCN(CC1)C(=O)c1ccc(CS(=O)(=O)c2c(Cl)cccc2Cl)o1	InChI=1S/C19H20Cl2N2O6S/c1-2-28-19(25)23-10-8-22(9-11-23)18(24)16-7-6-13(29-16)12-30(26,27)17-14(20)4-3-5-15(17)21/h3-7H,2,8-12H2,1H3	QZGMYCFITBDQMF-UHFFFAOYSA-N	474.04191249							111448
ASN 03929498	LSM-22905	SID24801635, BRD-A41389850	3180918	InChI=1S/C20H23N3O3/c1-13-5-3-7-18-22-19(14-8-9-16(24)17(11-14)25-2)20(23(13)18)21-12-15-6-4-10-26-15/h3,5,7-9,11,15,21,24H,4,6,10,12H2,1-2H3	HXZMXRGDQKXTQE-UHFFFAOYSA-N	COc1cc(ccc1O)c2nc3cccc(C)n3c2NCC4CCCO4	BroadT	BRD-A41389850	BRD-A41389850-001-05-5	Asinex Ltd.	ASN 03929498			COc1cc(ccc1O)-c1nc2cccc(C)n2c1NCC1CCCO1	InChI=1S/C20H23N3O3/c1-13-5-3-7-18-22-19(14-8-9-16(24)17(11-14)25-2)20(23(13)18)21-12-15-6-4-10-26-15/h3,5,7-9,11,15,21,24H,4,6,10,12H2,1-2H3	HXZMXRGDQKXTQE-UHFFFAOYSA-N	353.173941626							111449
MLS000333163	LSM-22906	SID26671679, BRD-K03679019	3518029	InChI=1S/C20H16N4O2S/c1-26-14-6-4-13(5-7-14)23-19(25)18-17(21)15-8-9-16(24-20(15)27-18)12-3-2-10-22-11-12/h2-11H,21H2,1H3,(H,23,25)	FWNSLTYTSOJHOP-UHFFFAOYSA-N	COc1ccc(NC(=O)c2sc3nc(ccc3c2N)c4cccnc4)cc1	BroadT	BRD-K03679019	BRD-K03679019-001-06-9	InterBioScreen Ltd.	STOCK4S-97790			COc1ccc(NC(=O)c2sc3nc(ccc3c2N)-c2cccnc2)cc1	InChI=1S/C20H16N4O2S/c1-26-14-6-4-13(5-7-14)23-19(25)18-17(21)15-8-9-16(24-20(15)27-18)12-3-2-10-22-11-12/h2-11H,21H2,1H3,(H,23,25)	FWNSLTYTSOJHOP-UHFFFAOYSA-N	376.099396482							111450
4-(9H-Fluoren-9-yl)-n-phenyltetrahydro-1(2H)-pyrazinecarboxamide	LSM-22907	SID26726495, BRD-K86295081	2814435	InChI=1S/C24H23N3O/c28-24(25-18-8-2-1-3-9-18)27-16-14-26(15-17-27)23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,23H,14-17H2,(H,25,28)	QTFCNSJRGFOCAC-UHFFFAOYSA-N	O=C(Nc1ccccc1)N2CCN(CC2)C3c4ccccc4c5ccccc35	BroadT	BRD-K86295081	BRD-K86295081-001-05-9	Maybridge	HTS 08790			O=C(Nc1ccccc1)N1CCN(CC1)C1c2ccccc2-c2ccccc12	InChI=1S/C24H23N3O/c28-24(25-18-8-2-1-3-9-18)27-16-14-26(15-17-27)23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,23H,14-17H2,(H,25,28)	QTFCNSJRGFOCAC-UHFFFAOYSA-N	369.184112386							111451
MLS000677506	LSM-22908	SID24792074, BRD-K97573126	2174625	InChI=1S/C17H20N2S2/c1-14-7-5-6-8-15(14)13-21-12-11-18-17(20)19-16-9-3-2-4-10-16/h2-10H,11-13H2,1H3,(H2,18,19,20)	RZHPANYKRJPBKP-UHFFFAOYSA-N	Cc1ccccc1CSCCN=C(S)Nc2ccccc2	BroadT	BRD-K97573126	BRD-K97573126-001-06-1	ChemBridge Corporation	7120755			Cc1ccccc1CSCCN=C(S)Nc1ccccc1	InChI=1S/C17H20N2S2/c1-14-7-5-6-8-15(14)13-21-12-11-18-17(20)19-16-9-3-2-4-10-16/h2-10H,11-13H2,1H3,(H2,18,19,20)	RZHPANYKRJPBKP-UHFFFAOYSA-N	316.10679004							111452
MLS000571561	LSM-22909	SID16953753, BRD-K98227422	2519274	InChI=1S/C26H29N3O3S/c1-28(2)33(31,32)22-15-16-24(29-17-9-10-18-29)23(19-22)26(30)27-25(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-8,11-16,19,25H,9-10,17-18H2,1-2H3,(H,27,30)	IRJCYQZNUUWHOO-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(c1)C(=O)NC(c3ccccc3)c4ccccc4	BroadT	BRD-K98227422	BRD-K98227422-001-06-4	Enamine Ltd.	T5292606			CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(c1)C(=O)NC(c1ccccc1)c1ccccc1	InChI=1S/C26H29N3O3S/c1-28(2)33(31,32)22-15-16-24(29-17-9-10-18-29)23(19-22)26(30)27-25(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-8,11-16,19,25H,9-10,17-18H2,1-2H3,(H,27,30)	IRJCYQZNUUWHOO-UHFFFAOYSA-N	463.192962508							111453
AC1LZBAF	LSM-22910	SID49644944, BRD-K27635868	54676094	InChI=1S/C20H21N3O3/c1-3-4-12-23-15-10-6-5-9-14(15)17(24)16(20(23)26)19(25)22-18-13(2)8-7-11-21-18/h5-11,24H,3-4,12H2,1-2H3,(H,21,22,25)	GXMOEXRSNMCIOC-UHFFFAOYSA-N	CCCCN1C(=O)C(=C(O)c2ccccc12)C(=O)Nc3ncccc3C	BroadT	BRD-K27635868	BRD-K27635868-001-05-7	Asinex Ltd.	BAS 00526001			CCCCn1c2ccccc2c(O)c(C(=O)Nc2ncccc2C)c1=O	InChI=1S/C20H21N3O3/c1-3-4-12-23-15-10-6-5-9-14(15)17(24)16(20(23)26)19(25)22-18-13(2)8-7-11-21-18/h5-11,24H,3-4,12H2,1-2H3,(H,21,22,25)	GXMOEXRSNMCIOC-UHFFFAOYSA-N	351.158291562							111454
NSC656596	LSM-22911	SID14726659, SID507266, BRD-K50525937	376112	InChI=1S/C19H14ClNO5/c1-25-18(23)14-13-10-12(16(22)11-6-4-3-5-7-11)8-9-21(13)17(20)15(14)19(24)26-2/h3-10H,1-2H3	PSYFVGWQOHNAMX-UHFFFAOYSA-N	COC(=O)c1c(Cl)n2ccc(cc2c1C(=O)OC)C(=O)c3ccccc3	BroadT	BRD-K50525937	BRD-K50525937-001-05-7	Asinex Ltd.	BAS 01953563			COC(=O)c1c(Cl)n2ccc(cc2c1C(=O)OC)C(=O)c1ccccc1	InChI=1S/C19H14ClNO5/c1-25-18(23)14-13-10-12(16(22)11-6-4-3-5-7-11)8-9-21(13)17(20)15(14)19(24)26-2/h3-10H,1-2H3	PSYFVGWQOHNAMX-UHFFFAOYSA-N	371.056050268							111455
MLS000720233	LSM-15210	BRD-K31802187	4270661	InChI=1S/C26H40NO/c1-8-25(4,5)22-14-15-24(23(19-22)26(6,7)9-2)28-18-11-10-16-27-17-12-13-21(3)20-27/h12-15,17,19-20H,8-11,16,18H2,1-7H3/q+1	PDJZSOPTHHVYSX-UHFFFAOYSA-N	CCC(C)(C)c1ccc(OCCCC[n+]2cccc(C)c2)c(c1)C(C)(C)CC	BroadT	BRD-K31802187	BRD-K31802187-004-09-7	ChemDiv Inc.	1671-0006		Br	CCC(C)(C)c1ccc(OCCCC[n+]2cccc(C)c2)c(c1)C(C)(C)CC.Br	InChI=1S/C26H40NO.BrH/c1-8-25(4,5)22-14-15-24(23(19-22)26(6,7)9-2)28-18-11-10-16-27-17-12-13-21(3)20-27;/h12-15,17,19-20H,8-11,16,18H2,1-7H3;1H/q+1;	ONXJLICLQBGQAB-UHFFFAOYSA-N	382.31098991							103859, 103859
AMBCB17261624	LSM-22912	SID47199849, BRD-A54797307	23723964	InChI=1S/C24H34N2O/c1-20-8-4-5-11-23(20)13-15-26-14-7-10-22(19-26)18-25(2)17-21-9-6-12-24(16-21)27-3/h4-6,8-9,11-12,16,22H,7,10,13-15,17-19H2,1-3H3	FWYQXRWQFDPBIS-UHFFFAOYSA-N	COc1cccc(CN(C)CC2CCCN(CCc3ccccc3C)C2)c1	BroadT	BRD-A54797307	BRD-A54797307-001-06-0	ChemBridge Corporation	17261624			COc1cccc(CN(C)CC2CCCN(CCc3ccccc3C)C2)c1	InChI=1S/C24H34N2O/c1-20-8-4-5-11-23(20)13-15-26-14-7-10-22(19-26)18-25(2)17-21-9-6-12-24(16-21)27-3/h4-6,8-9,11-12,16,22H,7,10,13-15,17-19H2,1-3H3	FWYQXRWQFDPBIS-UHFFFAOYSA-N	366.267113728							111456
SMR000025450	LSM-22913	SID4243553, BRD-K46753206	3238258	InChI=1S/C15H15BrN2O3S2/c1-17(23(20,21)15-7-6-13(16)22-15)10-14(19)18-9-8-11-4-2-3-5-12(11)18/h2-7H,8-10H2,1H3	CHVHRZFXPOOKIM-UHFFFAOYSA-N	CN(CC(=O)N1CCc2ccccc12)S(=O)(=O)c3ccc(Br)s3	BroadT	BRD-K46753206	BRD-K46753206-001-05-6	ChemDiv Inc.	C274-3195			CN(CC(=O)N1CCc2ccccc12)S(=O)(=O)c1ccc(Br)s1	InChI=1S/C15H15BrN2O3S2/c1-17(23(20,21)15-7-6-13(16)22-15)10-14(19)18-9-8-11-4-2-3-5-12(11)18/h2-7H,8-10H2,1H3	CHVHRZFXPOOKIM-UHFFFAOYSA-N	413.97074634							111457
MLS001004428	LSM-22914	SID24828913, BRD-A50850084	3902315	InChI=1S/C20H17N3O2S/c24-16-9-14-6-5-13-3-1-2-4-17(13)19(14)22(12-16)11-15-10-18(25)23-7-8-26-20(23)21-15/h1-8,10,16,24H,9,11-12H2	OJDHOYJFMJIZCR-UHFFFAOYSA-N	OC1CN(CC2=CC(=O)N3C=CSC3=N2)c4c(C1)ccc5ccccc45	BroadT	BRD-A50850084	BRD-A50850084-001-05-2	Enamine Ltd.	T0519-6501			OC1CN(Cc2cc(=O)n3ccsc3n2)c2c(C1)ccc1ccccc21	InChI=1S/C20H17N3O2S/c24-16-9-14-6-5-13-3-1-2-4-17(13)19(14)22(12-16)11-15-10-18(25)23-7-8-26-20(23)21-15/h1-8,10,16,24H,9,11-12H2	OJDHOYJFMJIZCR-UHFFFAOYSA-N	363.104147504							111458
STK030677	LSM-22915	SID4258844, BRD-K35127153	829956	InChI=1S/C14H10ClN3O2/c15-11-3-1-2-4-12(11)19-9-13-17-14(18-20-13)10-5-7-16-8-6-10/h1-8H,9H2	KICGTBMPZOAUDM-UHFFFAOYSA-N	Clc1ccccc1OCc2onc(n2)c3ccncc3	BroadT	BRD-K35127153	BRD-K35127153-001-04-2	ChemBridge Corporation	5802294			Clc1ccccc1OCc1nc(no1)-c1ccncc1	InChI=1S/C14H10ClN3O2/c15-11-3-1-2-4-12(11)19-9-13-17-14(18-20-13)10-5-7-16-8-6-10/h1-8H,9H2	KICGTBMPZOAUDM-UHFFFAOYSA-N	287.0461543							111459
MLS-0390851.0001	LSM-3751	BRD-K78056905, SID57287597, SID85147013	1400246	InChI=1S/C20H19N3O3S/c1-3-9-23-19(15-6-4-5-13(2)10-15)21-22-20(23)27-12-18(26)14-7-8-16(24)17(25)11-14/h3-8,10-11,24-25H,1,9,12H2,2H3	NDKRISOEDOWGCA-UHFFFAOYSA-N	Cc1cccc(c1)c2nnc(SCC(=O)c3ccc(O)c(O)c3)n2CC=C	BroadT	BRD-K78056905	BRD-K78056905-001-04-2	Sanford-Burnham Medical Research Institute	MLS-0390851.0001			Cc1cccc(c1)-c1nnc(SCC(=O)c2ccc(O)c(O)c2)n1CC=C	InChI=1S/C20H19N3O3S/c1-3-9-23-19(15-6-4-5-13(2)10-15)21-22-20(23)27-12-18(26)14-7-8-16(24)17(25)11-14/h3-8,10-11,24-25H,1,9,12H2,2H3	NDKRISOEDOWGCA-UHFFFAOYSA-N	381.114712188							93371
ASN 06538377	LSM-22916	SID24801704, BRD-K92587977	3221648	InChI=1S/C19H18N4O2S/c1-14-6-5-7-15-12-16(13-20)19(23-18(14)15)21-10-11-22-26(24,25)17-8-3-2-4-9-17/h2-9,12,22H,10-11H2,1H3,(H,21,23)	BOFYXBMYLMYWOV-UHFFFAOYSA-N	Cc1cccc2cc(C#N)c(NCCNS(=O)(=O)c3ccccc3)nc12	BroadT	BRD-K92587977	BRD-K92587977-001-05-8	Asinex Ltd.	ASN 06538377			Cc1cccc2cc(C#N)c(NCCNS(=O)(=O)c3ccccc3)nc12	InChI=1S/C19H18N4O2S/c1-14-6-5-7-15-12-16(13-20)19(23-18(14)15)21-10-11-22-26(24,25)17-8-3-2-4-9-17/h2-9,12,22H,10-11H2,1H3,(H,21,23)	BOFYXBMYLMYWOV-UHFFFAOYSA-N	366.115046546							111460
MLS000565629	LSM-43994	SID14745049, BRD-K54119731	2418641	InChI=1S/C20H26N4O4/c1-6-7-22-20(27)23-18(25)12-28-19(26)17(10-21)9-16-8-14(4)24(15(16)5)11-13(2)3/h6,8-9,13H,1,7,11-12H2,2-5H3,(H2,22,23,25,27)/b17-9+	XTIBIYNETUCIAQ-RQZCQDPDSA-N	CC(C)Cn1c(C)cc(\C=C(/C#N)\C(=O)OCC(=O)NC(=O)NCC=C)c1C	BroadT	BRD-K54119731	BRD-K54119731-001-06-1	Enamine Ltd.	T5213008			CC(C)Cn1c(C)cc(\C=C(/C#N)C(=O)OCC(=O)NC(=O)NCC=C)c1C	InChI=1S/C20H26N4O4/c1-6-7-22-20(27)23-18(25)12-28-19(26)17(10-21)9-16-8-14(4)24(15(16)5)11-13(2)3/h6,8-9,13H,1,7,11-12H2,2-5H3,(H2,22,23,25,27)/b17-9+	XTIBIYNETUCIAQ-RQZCQDPDSA-N	386.195405352							
MLS000882926	LSM-22918	SID26732179, BRD-K35896822	13249183	InChI=1S/C16H13NO/c18-16-10-11-17(12-13-6-2-1-3-7-13)15-9-5-4-8-14(15)16/h1-11H,12H2	KJOJZDHUUHJSOJ-UHFFFAOYSA-N	O=C1C=CN(Cc2ccccc2)c3ccccc13	BroadT	BRD-K35896822	BRD-K35896822-001-05-0	University of Kansas CMLD	KUC101744N			O=c1ccn(Cc2ccccc2)c2ccccc12	InChI=1S/C16H13NO/c18-16-10-11-17(12-13-6-2-1-3-7-13)15-9-5-4-8-14(15)16/h1-11H,12H2	KJOJZDHUUHJSOJ-UHFFFAOYSA-N	235.099714046							111462
MLS001239345	LSM-15350	BRD-K08813241	24892422	InChI=1S/C28H30N4O5S2/c1-30(2)14-7-15-32(28-29-23-16-24-25(37-19-36-24)17-26(23)38-28)27(33)21-10-12-22(13-11-21)39(34,35)31(3)18-20-8-5-4-6-9-20/h4-6,8-13,16-17H,7,14-15,18-19H2,1-3H3	VKMRRUWBTJCRHK-UHFFFAOYSA-N	CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N(C)Cc2ccccc2)c3nc4cc5OCOc5cc4s3	BroadT	BRD-K08813241	BRD-K08813241-003-06-5	Life Chemicals Inc.	F2019-1632		Cl	CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N(C)Cc1ccccc1)c1nc2cc3OCOc3cc2s1.Cl	InChI=1S/C28H30N4O5S2.ClH/c1-30(2)14-7-15-32(28-29-23-16-24-25(37-19-36-24)17-26(23)38-28)27(33)21-10-12-22(13-11-21)39(34,35)31(3)18-20-8-5-4-6-9-20;/h4-6,8-13,16-17H,7,14-15,18-19H2,1-3H3;1H	BNRISRPMTTUVGH-UHFFFAOYSA-N	566.16576148							103996, 103996
ST50186152	LSM-22919	BRD-K82924246	1182647	InChI=1S/C20H23N3O5S/c1-5-27-15-10-8-7-9-14(15)11-21-23-20(26)22-18-16(19(25)28-6-2)12(3)17(29-18)13(4)24/h7-11H,5-6H2,1-4H3,(H2,22,23,26)	VJOLUBNNOFXLMP-UHFFFAOYSA-N	CCOC(=O)c1c(C)c(sc1NC(=O)NN=Cc2ccccc2OCC)C(=O)C	BroadT	BRD-K82924246	BRD-K82924246-001-05-0	ChemDiv Inc.	2279-3090			CCOC(=O)c1c(NC(=O)NN=Cc2ccccc2OCC)sc(C(C)=O)c1C	InChI=1S/C20H23N3O5S/c1-5-27-15-10-8-7-9-14(15)11-21-23-20(26)22-18-16(19(25)28-6-2)12(3)17(29-18)13(4)24/h7-11H,5-6H2,1-4H3,(H2,22,23,26)	VJOLUBNNOFXLMP-UHFFFAOYSA-N	417.135841556							111463
MLS000539990	LSM-22920	BRD-K39611527	1471255	InChI=1S/C9H6Cl2N2S2/c1-5-4-6(10)2-3-7(5)12-9-8(11)13-15-14-9/h2-4H,1H3	BLHGSVBPZBUAOC-UHFFFAOYSA-N	Cc1cc(Cl)ccc1N=C2SSN=C2Cl	BroadT	BRD-K39611527	BRD-K39611527-001-05-7	Key Organics Ltd.	11K-019			Cc1cc(Cl)ccc1N=c1ssnc1Cl	InChI=1S/C9H6Cl2N2S2/c1-5-4-6(10)2-3-7(5)12-9-8(11)13-15-14-9/h2-4H,1H3	BLHGSVBPZBUAOC-UHFFFAOYSA-N	275.934945012							111464
SMR000060390	LSM-22921	SID3717343, BRD-A64604250	2999958	InChI=1S/C22H22N4O3S/c1-14-6-8-16(9-7-14)30(27,28)20-19-22(25-18-5-3-2-4-17(18)24-19)26(21(20)23)12-15-10-11-29-13-15/h2-9,15H,10-13,23H2,1H3	PATLRCDVWWHKOB-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)c2c(N)n(CC3CCOC3)c4nc5ccccc5nc24	BroadT	BRD-A64604250	BRD-A64604250-001-05-5	Enamine Ltd.	T0502-3950			Cc1ccc(cc1)S(=O)(=O)c1c(N)n(CC2CCOC2)c2nc3ccccc3nc12	InChI=1S/C22H22N4O3S/c1-14-6-8-16(9-7-14)30(27,28)20-19-22(25-18-5-3-2-4-17(18)24-19)26(21(20)23)12-15-10-11-29-13-15/h2-9,15H,10-13,23H2,1H3	PATLRCDVWWHKOB-UHFFFAOYSA-N	422.141261294							111465
CHEMBL1622788	LSM-15525	BRD-A90638298	14219809	InChI=1S/C21H22BrNOS/c22-16-5-6-20-18(11-16)21(17-4-2-1-3-15(17)13-25-20)24-19-12-23-9-7-14(19)8-10-23/h1-6,11,14,19,21H,7-10,12-13H2	LVUDIWHCHFHYEK-UHFFFAOYSA-N	Brc1ccc2SCc3ccccc3C(OC4CN5CCC4CC5)c2c1	BroadT	BRD-A90638298	BRD-A90638298-050-05-2	Specs	AE-641/30156011		OC(=O)/C=C\C(=O)O	Brc1ccc2SCc3ccccc3C(OC3CN4CCC3CC4)c2c1.OC(=O)/C=C\C(=O)O	InChI=1S/C21H22BrNOS.C4H4O4/c22-16-5-6-20-18(11-16)21(17-4-2-1-3-15(17)13-25-20)24-19-12-23-9-7-14(19)8-10-23;5-3(6)1-2-4(7)8/h1-6,11,14,19,21H,7-10,12-13H2;1-2H,(H,5,6)(H,7,8)/b;2-1-	HIQLIJNQONFAKG-BTJKTKAUSA-N	415.060547624							104161, 104161
CHEMBL1729272	LSM-22922	SID96099522, BRD-A51043367	46238453	InChI=1S/C16H16N2O4S2/c1-9-5-4-6-10(2)12(9)17-16(20)15-13(19)14-11(7-8-23-14)18(3)24(15,21)22/h4-8,15H,1-3H3,(H,17,20)	YPGZJJDHEDVKFE-UHFFFAOYSA-N	CN1c2ccsc2C(=O)C(C(=O)Nc3c(C)cccc3C)S1(=O)=O	BroadT	BRD-A51043367	BRD-A51043367-001-07-7	Key Organics Ltd.	11N-403S			CN1c2ccsc2C(=O)C(C(=O)Nc2c(C)cccc2C)S1(=O)=O	InChI=1S/C16H16N2O4S2/c1-9-5-4-6-10(2)12(9)17-16(20)15-13(19)14-11(7-8-23-14)18(3)24(15,21)22/h4-8,15H,1-3H3,(H,17,20)	YPGZJJDHEDVKFE-UHFFFAOYSA-N	364.055148392							111466
AC1MEDUM	LSM-22923	BRD-K51054162	2876835	InChI=1S/C15H13BrN2O2/c1-10-2-4-12(5-3-10)15(19)20-18-14(17)11-6-8-13(16)9-7-11/h2-9H,1H3,(H2,17,18)	UISPMHKDFGTWKI-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)ONC(=N)c2ccc(Br)cc2	BroadT	BRD-K51054162	BRD-K51054162-001-05-3	ChemBridge Corporation	5927150			Cc1ccc(cc1)C(=O)ONC(=N)c1ccc(Br)cc1	InChI=1S/C15H13BrN2O2/c1-10-2-4-12(5-3-10)15(19)20-18-14(17)11-6-8-13(16)9-7-11/h2-9H,1H3,(H2,17,18)	UISPMHKDFGTWKI-UHFFFAOYSA-N	332.016040276							111467
AC1N04EH	LSM-22924	SID22411440, BRD-A31210555	3957047	InChI=1S/C19H19N3O3S2/c1-2-27(24,25)22-12-14-8-4-3-7-13(14)11-16(22)18(23)21-19-20-15-9-5-6-10-17(15)26-19/h3-10,16H,2,11-12H2,1H3,(H,20,21,23)	NFJAXZDABROSEY-UHFFFAOYSA-N	CCS(=O)(=O)N1Cc2ccccc2CC1C(=O)Nc3nc4ccccc4s3	BroadT	BRD-A31210555	BRD-A31210555-001-07-9	Enamine Ltd.	T5273559			CCS(=O)(=O)N1Cc2ccccc2CC1C(=O)Nc1nc2ccccc2s1	InChI=1S/C19H19N3O3S2/c1-2-27(24,25)22-12-14-8-4-3-7-13(14)11-16(22)18(23)21-19-20-15-9-5-6-10-17(15)26-19/h3-10,16H,2,11-12H2,1H3,(H,20,21,23)	NFJAXZDABROSEY-UHFFFAOYSA-N	401.086782878							111468
MLS000676159	LSM-22925	SID24789004, BRD-K29687360	892808	InChI=1S/C12H9BrN2O2S/c13-10-7-6-9(17-10)11(16)15-12(18)14-8-4-2-1-3-5-8/h1-7H,(H2,14,15,16,18)	UDPRZVCDOIRPSE-UHFFFAOYSA-N	Brc1oc(cc1)C(=O)NC(=S)Nc2ccccc2	BroadT	BRD-K29687360	BRD-K29687360-001-05-9	ChemBridge Corporation	7178461			Brc1ccc(o1)C(=O)NC(=S)Nc1ccccc1	InChI=1S/C12H9BrN2O2S/c13-10-7-6-9(17-10)11(16)15-12(18)14-8-4-2-1-3-5-8/h1-7H,(H2,14,15,16,18)	UDPRZVCDOIRPSE-UHFFFAOYSA-N	323.956810838							111469
AC1OF8L4	LSM-22926	BRD-A03002738	7070811	InChI=1S/C13H10ClN3OS2/c1-7(16)9(5-15)11(18)6-19-13-17-10-4-8(14)2-3-12(10)20-13/h2-4,9,16H,6H2,1H3	ZJZCLYGPAWKYPK-UHFFFAOYSA-N	CC(=N)C(C#N)C(=O)CSc1nc2cc(Cl)ccc2s1	BroadT	BRD-A03002738	BRD-A03002738-001-05-8	Enamine Ltd.	ZT-1892567			CC(=N)C(C#N)C(=O)CSc1nc2cc(Cl)ccc2s1	InChI=1S/C13H10ClN3OS2/c1-7(16)9(5-15)11(18)6-19-13-17-10-4-8(14)2-3-12(10)20-13/h2-4,9,16H,6H2,1H3	ZJZCLYGPAWKYPK-UHFFFAOYSA-N	322.99538106							111470
BRD-K67998155	LSM-22927		44484415	InChI=1S/C30H39N3O7/c1-19-14-33(20(2)17-34)30(36)23-5-4-6-24(31-29(35)22-9-11-37-12-10-22)28(23)40-27(19)16-32(3)15-21-7-8-25-26(13-21)39-18-38-25/h4-8,13,19-20,22,27,34H,9-12,14-18H2,1-3H3,(H,31,35)/t19-,20-,27+/m1/s1	NQBSYXGUJZNUSC-DVHCVUMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K67998155	BRD-K67998155-001-01-1	Broad Institute of MIT and Harvard	BRD-K67998155			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C30H39N3O7/c1-19-14-33(20(2)17-34)30(36)23-5-4-6-24(31-29(35)22-9-11-37-12-10-22)28(23)40-27(19)16-32(3)15-21-7-8-25-26(13-21)39-18-38-25/h4-8,13,19-20,22,27,34H,9-12,14-18H2,1-3H3,(H,31,35)/t19-,20-,27+/m1/s1	NQBSYXGUJZNUSC-DVHCVUMVSA-N	553.278800618							111471
BRD-K28952606	LSM-22928		44497847	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-19-15(3)11-26(16(4)13-27)21(28)17-9-8-10-18(24(5)6)20(17)30-19/h8-10,14-16,19,27H,11-13H2,1-7H3,(H,23,29)/t15-,16+,19+/m1/s1	XZXNUYDCQDAXAA-GJYPPUQNSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2c(cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K28952606	BRD-K28952606-001-01-1	Broad Institute of MIT and Harvard	BRD-K28952606			CC(C)NC(=O)N(C)C[C@@H]1Oc2c(cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-19-15(3)11-26(16(4)13-27)21(28)17-9-8-10-18(24(5)6)20(17)30-19/h8-10,14-16,19,27H,11-13H2,1-7H3,(H,23,29)/t15-,16+,19+/m1/s1	XZXNUYDCQDAXAA-GJYPPUQNSA-N	420.273655672							111472
BRD-K05688586	LSM-22929		44619733	InChI=1S/C23H35N3O4/c1-15-13-26(16(2)14-27)23(29)19-11-18(9-10-20(19)30-21(15)12-24-3)25-22(28)17-7-5-4-6-8-17/h9-11,15-17,21,24,27H,4-8,12-14H2,1-3H3,(H,25,28)/t15-,16+,21-/m0/s1	NQJCYDIBEOZMBZ-MRUHUIDDSA-N	CNC[C@@H]1Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K05688586	BRD-K05688586-001-01-2	Broad Institute of MIT and Harvard	BRD-K05688586			CNC[C@@H]1Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H35N3O4/c1-15-13-26(16(2)14-27)23(29)19-11-18(9-10-20(19)30-21(15)12-24-3)25-22(28)17-7-5-4-6-8-17/h9-11,15-17,21,24,27H,4-8,12-14H2,1-3H3,(H,25,28)/t15-,16+,21-/m0/s1	NQJCYDIBEOZMBZ-MRUHUIDDSA-N	417.26275663							111473
BRD-K17367695	LSM-22930		44493254	InChI=1S/C27H41N3O4/c1-18-14-30(19(2)17-31)27(33)23-13-22(28-26(32)21-9-10-21)11-12-24(23)34-25(18)16-29(3)15-20-7-5-4-6-8-20/h11-13,18-21,25,31H,4-10,14-17H2,1-3H3,(H,28,32)/t18-,19+,25-/m0/s1	RZKDUVXCVDUJNN-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)C4CC4)cc3C1=O	BroadT	BRD-K17367695	BRD-K17367695-001-01-7	Broad Institute of MIT and Harvard	BRD-K17367695			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)C3CC3)cc2C1=O	InChI=1S/C27H41N3O4/c1-18-14-30(19(2)17-31)27(33)23-13-22(28-26(32)21-9-10-21)11-12-24(23)34-25(18)16-29(3)15-20-7-5-4-6-8-20/h11-13,18-21,25,31H,4-10,14-17H2,1-3H3,(H,28,32)/t18-,19+,25-/m0/s1	RZKDUVXCVDUJNN-CEYNDMKZSA-N	471.309706822							111474
CHEMBL2140613	LSM-22931	BRD-K78668110, SID85813451	44506343	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)26-16-25(35(3)4)14-15-29(26)41-30(21)19-36(5)18-23-10-12-24(13-11-23)31(39)34-28-9-7-6-8-27(28)33/h6-16,21-22,30,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,30-/m1/s1	QVMJLFZOFFUGMH-VDZJOXJSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K78668110	BRD-K78668110-001-01-1	Broad Institute of MIT and Harvard	BRD-K78668110			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)26-16-25(35(3)4)14-15-29(26)41-30(21)19-36(5)18-23-10-12-24(13-11-23)31(39)34-28-9-7-6-8-27(28)33/h6-16,21-22,30,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,30-/m1/s1	QVMJLFZOFFUGMH-VDZJOXJSSA-N	559.315854842							111475
BRD-K90863590	LSM-22932		44485888	InChI=1S/C35H38N4O6/c1-22-17-39(23(2)20-40)34(41)28-16-26(36-35(42)37-29-10-6-8-25-7-4-5-9-27(25)29)12-14-30(28)45-33(22)19-38(3)18-24-11-13-31-32(15-24)44-21-43-31/h4-16,22-23,33,40H,17-21H2,1-3H3,(H2,36,37,42)/t22-,23-,33+/m0/s1	MDVGURPVGABTFV-VYLNZKQVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)Nc5cccc6ccccc56)cc4C1=O	BroadT	BRD-K90863590	BRD-K90863590-001-01-1	Broad Institute of MIT and Harvard	BRD-K90863590			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C35H38N4O6/c1-22-17-39(23(2)20-40)34(41)28-16-26(36-35(42)37-29-10-6-8-25-7-4-5-9-27(25)29)12-14-30(28)45-33(22)19-38(3)18-24-11-13-31-32(15-24)44-21-43-31/h4-16,22-23,33,40H,17-21H2,1-3H3,(H2,36,37,42)/t22-,23-,33+/m0/s1	MDVGURPVGABTFV-VYLNZKQVSA-N	610.279134976							111476
BRD-K62182950	LSM-22933		44485346	InChI=1S/C27H34N4O4/c1-17-14-31(18(2)16-32)27(34)22-12-20(9-10-24(22)35-25(17)13-28-3)29-26(33)11-19-15-30(4)23-8-6-5-7-21(19)23/h5-10,12,15,17-18,25,28,32H,11,13-14,16H2,1-4H3,(H,29,33)/t17-,18-,25+/m0/s1	PPWFHLCHCLIHFE-DPOKWSEZSA-N	CNC[C@H]1Oc2ccc(NC(=O)Cc3cn(C)c4ccccc34)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K62182950	BRD-K62182950-001-01-4	Broad Institute of MIT and Harvard	BRD-K62182950			CNC[C@H]1Oc2ccc(NC(=O)Cc3cn(C)c4ccccc34)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C27H34N4O4/c1-17-14-31(18(2)16-32)27(34)22-12-20(9-10-24(22)35-25(17)13-28-3)29-26(33)11-19-15-30(4)23-8-6-5-7-21(19)23/h5-10,12,15,17-18,25,28,32H,11,13-14,16H2,1-4H3,(H,29,33)/t17-,18-,25+/m0/s1	PPWFHLCHCLIHFE-DPOKWSEZSA-N	478.258005608							111477
BRD-K42629542	LSM-22934		44487743	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)29-21-11-12-23-22(13-21)25(34)32(19(4)16-33)14-18(3)24(37-23)15-31(5)27(36)30-20-9-7-6-8-10-20/h6-13,17-19,24,33H,14-16H2,1-5H3,(H,30,36)(H2,28,29,35)/t18-,19-,24+/m0/s1	YWOLVGYTMULQAH-AXHZCLLHSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K42629542	BRD-K42629542-001-01-4	Broad Institute of MIT and Harvard	BRD-K42629542			CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)29-21-11-12-23-22(13-21)25(34)32(19(4)16-33)14-18(3)24(37-23)15-31(5)27(36)30-20-9-7-6-8-10-20/h6-13,17-19,24,33H,14-16H2,1-5H3,(H,30,36)(H2,28,29,35)/t18-,19-,24+/m0/s1	YWOLVGYTMULQAH-AXHZCLLHSA-N	511.279469334							111478
BRD-K56943525	LSM-22935		44491858	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)22-12-21(28-25(32)20-4-5-20)6-7-23(22)34-24(17)15-29(3)14-19-8-10-27-11-9-19/h6-12,17-18,20,24,31H,4-5,13-16H2,1-3H3,(H,28,32)/t17-,18+,24-/m0/s1	QDSHHCHLIAQNJH-RHGYRFJNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ccc(NC(=O)C4CC4)cc3C1=O	BroadT	BRD-K56943525	BRD-K56943525-001-01-3	Broad Institute of MIT and Harvard	BRD-K56943525			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(NC(=O)C3CC3)cc2C1=O	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)22-12-21(28-25(32)20-4-5-20)6-7-23(22)34-24(17)15-29(3)14-19-8-10-27-11-9-19/h6-12,17-18,20,24,31H,4-5,13-16H2,1-3H3,(H,28,32)/t17-,18+,24-/m0/s1	QDSHHCHLIAQNJH-RHGYRFJNSA-N	466.258005608							111479
BRD-K69840402	LSM-22936		44491868	InChI=1S/C22H36N4O4/c1-15-13-26(16(2)14-27)22(29)18-11-17(24-21(28)7-6-10-25(4)5)8-9-19(18)30-20(15)12-23-3/h8-9,11,15-16,20,23,27H,6-7,10,12-14H2,1-5H3,(H,24,28)/t15-,16+,20-/m1/s1	YREQKLPEMWXCQY-GQIGUUNPSA-N	CNC[C@H]1Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K69840402	BRD-K69840402-001-01-4	Broad Institute of MIT and Harvard	BRD-K69840402			CNC[C@H]1Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C22H36N4O4/c1-15-13-26(16(2)14-27)22(29)18-11-17(24-21(28)7-6-10-25(4)5)8-9-19(18)30-20(15)12-23-3/h8-9,11,15-16,20,23,27H,6-7,10,12-14H2,1-5H3,(H,24,28)/t15-,16+,20-/m1/s1	YREQKLPEMWXCQY-GQIGUUNPSA-N	420.273655672							111480
BRD-K87331568	LSM-22937		44485734	InChI=1S/C25H32N4O6/c1-15-12-29(16(2)13-30)24(31)9-17-8-18(4-6-20(17)35-23(15)11-26-3)27-25(32)28-19-5-7-21-22(10-19)34-14-33-21/h4-8,10,15-16,23,26,30H,9,11-14H2,1-3H3,(H2,27,28,32)/t15-,16-,23+/m0/s1	BRYKRAAGJVMQDR-PBPSECFOSA-N	CNC[C@H]1Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K87331568	BRD-K87331568-001-01-2	Broad Institute of MIT and Harvard	BRD-K87331568			CNC[C@H]1Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C25H32N4O6/c1-15-12-29(16(2)13-30)24(31)9-17-8-18(4-6-20(17)35-23(15)11-26-3)27-25(32)28-19-5-7-21-22(10-19)34-14-33-21/h4-8,10,15-16,23,26,30H,9,11-14H2,1-3H3,(H2,27,28,32)/t15-,16-,23+/m0/s1	BRYKRAAGJVMQDR-PBPSECFOSA-N	484.232184784							111481
BRD-K15261426	LSM-22938		44496522	InChI=1S/C30H37N3O5S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-39(4,36)37)29(26)38-28(21)19-32(3)18-23-13-15-25(16-14-23)24-9-6-5-7-10-24/h5-16,21-22,28,31,34H,17-20H2,1-4H3/t21-,22-,28+/m1/s1	YVBCCXLDGZBBDC-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)Oc4c(NS(=O)(=O)C)cccc4C1=O	BroadT	BRD-K15261426	BRD-K15261426-001-01-0	Broad Institute of MIT and Harvard	BRD-K15261426			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)Oc2c(NS(C)(=O)=O)cccc2C1=O	InChI=1S/C30H37N3O5S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-39(4,36)37)29(26)38-28(21)19-32(3)18-23-13-15-25(16-14-23)24-9-6-5-7-10-24/h5-16,21-22,28,31,34H,17-20H2,1-4H3/t21-,22-,28+/m1/s1	YVBCCXLDGZBBDC-XJGOYTCSSA-N	551.245392004							111482
MLS002473708	LSM-22939	BRD-K71632520, SID85272358	44246532	InChI=1S/C26H34N4O6/c1-16-12-30(17(2)14-31)25(32)19-7-6-8-20(28(3)4)24(19)36-23(16)13-29(5)26(33)27-18-9-10-21-22(11-18)35-15-34-21/h6-11,16-17,23,31H,12-15H2,1-5H3,(H,27,33)/t16-,17+,23+/m0/s1	DFCREXDAKHJSKD-YGKZAACZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K71632520	BRD-K71632520-001-02-6	Broad Institute of MIT and Harvard	BRD-K71632520			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H34N4O6/c1-16-12-30(17(2)14-31)25(32)19-7-6-8-20(28(3)4)24(19)36-23(16)13-29(5)26(33)27-18-9-10-21-22(11-18)35-15-34-21/h6-11,16-17,23,31H,12-15H2,1-5H3,(H,27,33)/t16-,17+,23+/m0/s1	DFCREXDAKHJSKD-YGKZAACZSA-N	498.247834848							111483
BRD-K44843474	LSM-22940		44493716	InChI=1S/C27H41N3O4/c1-18-14-30(19(2)17-31)27(33)23-13-22(28-26(32)21-9-10-21)11-12-24(23)34-25(18)16-29(3)15-20-7-5-4-6-8-20/h11-13,18-21,25,31H,4-10,14-17H2,1-3H3,(H,28,32)/t18-,19-,25+/m1/s1	RZKDUVXCVDUJNN-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)C4CC4)cc3C1=O	BroadT	BRD-K44843474	BRD-K44843474-001-01-1	Broad Institute of MIT and Harvard	BRD-K44843474			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)C3CC3)cc2C1=O	InChI=1S/C27H41N3O4/c1-18-14-30(19(2)17-31)27(33)23-13-22(28-26(32)21-9-10-21)11-12-24(23)34-25(18)16-29(3)15-20-7-5-4-6-8-20/h11-13,18-21,25,31H,4-10,14-17H2,1-3H3,(H,28,32)/t18-,19-,25+/m1/s1	RZKDUVXCVDUJNN-RRQZXNHTSA-N	471.309706822							111484
BRD-K54026235	LSM-22941		44487189	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)30(6)15-25-19(4)14-31(20(5)16-32)26(33)23-13-21(9-12-24(23)37-25)29-38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,29,32H,14-16H2,1-6H3,(H,28,34)/t19-,20-,25+/m0/s1	HJQIIGSKSQOFKI-ZYLNGJIFSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K54026235	BRD-K54026235-001-01-0	Broad Institute of MIT and Harvard	BRD-K54026235			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)30(6)15-25-19(4)14-31(20(5)16-32)26(33)23-13-21(9-12-24(23)37-25)29-38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,29,32H,14-16H2,1-6H3,(H,28,34)/t19-,20-,25+/m0/s1	HJQIIGSKSQOFKI-ZYLNGJIFSA-N	546.251205666							111485
BRD-K60437668	LSM-22942		44487344	InChI=1S/C26H31Cl2N7O4/c1-16-10-35(17(2)14-36)26(38)20-9-19(30-25(37)13-34-15-29-31-32-34)5-7-23(20)39-24(16)12-33(3)11-18-4-6-21(27)22(28)8-18/h4-9,15-17,24,36H,10-14H2,1-3H3,(H,30,37)/t16-,17-,24-/m0/s1	MIRHJXKFLNBQHA-UAVUOLJFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NC(=O)Cn4cnnn4)cc3C1=O	BroadT	BRD-K60437668	BRD-K60437668-001-01-7	Broad Institute of MIT and Harvard	BRD-K60437668			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NC(=O)Cn3cnnn3)cc2C1=O	InChI=1S/C26H31Cl2N7O4/c1-16-10-35(17(2)14-36)26(38)20-9-19(30-25(37)13-34-15-29-31-32-34)5-7-23(20)39-24(16)12-33(3)11-18-4-6-21(27)22(28)8-18/h4-9,15-17,24,36H,10-14H2,1-3H3,(H,30,37)/t16-,17-,24-/m0/s1	MIRHJXKFLNBQHA-UAVUOLJFSA-N	575.181457962							111486
BRD-K78432272	LSM-22943		44486074	InChI=1S/C30H34N4O6/c1-19-14-34(20(2)17-35)30(37)24-13-23(32-29(36)22-8-10-31-11-9-22)5-7-25(24)40-28(19)16-33(3)15-21-4-6-26-27(12-21)39-18-38-26/h4-13,19-20,28,35H,14-18H2,1-3H3,(H,32,36)/t19-,20+,28-/m1/s1	VPWIZKHQYUSQSD-NKQBKRSGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)c5ccncc5)cc4C1=O	BroadT	BRD-K78432272	BRD-K78432272-001-01-6	Broad Institute of MIT and Harvard	BRD-K78432272			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C30H34N4O6/c1-19-14-34(20(2)17-35)30(37)24-13-23(32-29(36)22-8-10-31-11-9-22)5-7-25(24)40-28(19)16-33(3)15-21-4-6-26-27(12-21)39-18-38-26/h4-13,19-20,28,35H,14-18H2,1-3H3,(H,32,36)/t19-,20+,28-/m1/s1	VPWIZKHQYUSQSD-NKQBKRSGSA-N	546.247834848							111487
MLS002474110	LSM-22944	BRD-K50378621, SID85201667	44202751	InChI=1S/C28H32N4O6S/c1-19-16-32(20(2)18-33)28(35)23-10-7-11-24(30-27(34)21-12-14-29-15-13-21)26(23)38-25(19)17-31(3)39(36,37)22-8-5-4-6-9-22/h4-15,19-20,25,33H,16-18H2,1-3H3,(H,30,34)/t19-,20+,25+/m0/s1	LXJZSYGAJCUBQM-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K50378621	BRD-K50378621-001-02-9	Broad Institute of MIT and Harvard	BRD-K50378621			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C28H32N4O6S/c1-19-16-32(20(2)18-33)28(35)23-10-7-11-24(30-27(34)21-12-14-29-15-13-21)26(23)38-25(19)17-31(3)39(36,37)22-8-5-4-6-9-22/h4-15,19-20,25,33H,16-18H2,1-3H3,(H,30,34)/t19-,20+,25+/m0/s1	LXJZSYGAJCUBQM-WZOHSFFVSA-N	552.204255474							111488
BRD-K31998691	LSM-22945		44494777	InChI=1S/C21H34N4O6S/c1-13(2)22-21(28)23-17-9-7-8-16-19(17)31-18(11-24(5)32(6,29)30)14(3)10-25(20(16)27)15(4)12-26/h7-9,13-15,18,26H,10-12H2,1-6H3,(H2,22,23,28)/t14-,15+,18-/m1/s1	JMXMRSKNTVHTGA-RVKKMQEKSA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc12)[C@@H](C)CO	BroadT	BRD-K31998691	BRD-K31998691-001-01-5	Broad Institute of MIT and Harvard	BRD-K31998691			CC(C)NC(=O)Nc1cccc2c1O[C@H](CN(C)S(C)(=O)=O)[C@H](C)CN([C@@H](C)CO)C2=O	InChI=1S/C21H34N4O6S/c1-13(2)22-21(28)23-17-9-7-8-16-19(17)31-18(11-24(5)32(6,29)30)14(3)10-25(20(16)27)15(4)12-26/h7-9,13-15,18,26H,10-12H2,1-6H3,(H2,22,23,28)/t14-,15+,18-/m1/s1	JMXMRSKNTVHTGA-RVKKMQEKSA-N	470.219905538							111489
BRD-K82512117	LSM-22946		44483414	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)17-8-16(6-7-18(17)31-19(12)9-23-5)24-22(30)25-20-14(3)26-32-15(20)4/h6-8,12-13,19,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13-,19+/m1/s1	HGTBFUICODGLJG-VPZZIHKRSA-N	CNC[C@@H]1Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K82512117	BRD-K82512117-001-01-8	Broad Institute of MIT and Harvard	BRD-K82512117			CNC[C@@H]1Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)17-8-16(6-7-18(17)31-19(12)9-23-5)24-22(30)25-20-14(3)26-32-15(20)4/h6-8,12-13,19,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13-,19+/m1/s1	HGTBFUICODGLJG-VPZZIHKRSA-N	445.232519142							111490
BRD-K38998073	LSM-22947		44493773	InChI=1S/C28H40N4O6S/c1-20-17-32(21(2)19-33)28(35)24-16-22(29-27(34)12-9-15-30(3)4)13-14-25(24)38-26(20)18-31(5)39(36,37)23-10-7-6-8-11-23/h6-8,10-11,13-14,16,20-21,26,33H,9,12,15,17-19H2,1-5H3,(H,29,34)/t20-,21+,26-/m0/s1	RYGUZWJSQXSRBK-UZINWLIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K38998073	BRD-K38998073-001-01-6	Broad Institute of MIT and Harvard	BRD-K38998073			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C28H40N4O6S/c1-20-17-32(21(2)19-33)28(35)24-16-22(29-27(34)12-9-15-30(3)4)13-14-25(24)38-26(20)18-31(5)39(36,37)23-10-7-6-8-11-23/h6-8,10-11,13-14,16,20-21,26,33H,9,12,15,17-19H2,1-5H3,(H,29,34)/t20-,21+,26-/m0/s1	RYGUZWJSQXSRBK-UZINWLIJSA-N	560.26685573							111491
BRD-K06537903	LSM-22948		44493854	InChI=1S/C24H35N5O5S/c1-16-10-29(17(2)14-30)24(31)20-9-19(26-35(32,33)23-13-28(4)15-25-23)7-8-21(20)34-22(16)12-27(3)11-18-5-6-18/h7-9,13,15-18,22,26,30H,5-6,10-12,14H2,1-4H3/t16-,17-,22-/m1/s1	KTPUHGRRTQXBGV-DRSNIGMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NS(=O)(=O)c4cn(C)cn4)cc3C1=O	BroadT	BRD-K06537903	BRD-K06537903-001-01-6	Broad Institute of MIT and Harvard	BRD-K06537903			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C24H35N5O5S/c1-16-10-29(17(2)14-30)24(31)20-9-19(26-35(32,33)23-13-28(4)15-25-23)7-8-21(20)34-22(16)12-27(3)11-18-5-6-18/h7-9,13,15-18,22,26,30H,5-6,10-12,14H2,1-4H3/t16-,17-,22-/m1/s1	KTPUHGRRTQXBGV-DRSNIGMVSA-N	505.23588996							111492
BRD-K49042040	LSM-22949		44493679	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)19-10-17(6-9-20(19)31-21(14)11-24-3)25-32(29,30)18-7-4-16(23)5-8-18/h4-10,14-15,21,24-25,27H,11-13H2,1-3H3/t14-,15+,21+/m0/s1	DERWQPYGNBVBMF-PDSXEYIOSA-N	CNC[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K49042040	BRD-K49042040-001-01-0	Broad Institute of MIT and Harvard	BRD-K49042040			CNC[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)19-10-17(6-9-20(19)31-21(14)11-24-3)25-32(29,30)18-7-4-16(23)5-8-18/h4-10,14-15,21,24-25,27H,11-13H2,1-3H3/t14-,15+,21+/m0/s1	DERWQPYGNBVBMF-PDSXEYIOSA-N	465.173369916							111493
BRD-K17322434	LSM-22950		44483861	InChI=1S/C26H33F3N4O6S/c1-16-13-33(17(2)15-34)24(35)12-18-11-21(31-40(4,37)38)9-10-22(18)39-23(16)14-32(3)25(36)30-20-7-5-19(6-8-20)26(27,28)29/h5-11,16-17,23,31,34H,12-15H2,1-4H3,(H,30,36)/t16-,17+,23-/m1/s1	ULBVSTNRUTTXDI-SAHWJRBASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K17322434	BRD-K17322434-001-01-8	Broad Institute of MIT and Harvard	BRD-K17322434			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C26H33F3N4O6S/c1-16-13-33(17(2)15-34)24(35)12-18-11-21(31-40(4,37)38)9-10-22(18)39-23(16)14-32(3)25(36)30-20-7-5-19(6-8-20)26(27,28)29/h5-11,16-17,23,31,34H,12-15H2,1-4H3,(H,30,36)/t16-,17+,23-/m1/s1	ULBVSTNRUTTXDI-SAHWJRBASA-N	586.207290106							111494
BRD-K09304381	LSM-22951		44487093	InChI=1S/C26H32FN3O6S/c1-16-13-30(17(2)15-31)26(33)22-12-20(28-25(32)18-4-5-18)8-11-23(22)36-24(16)14-29(3)37(34,35)21-9-6-19(27)7-10-21/h6-12,16-18,24,31H,4-5,13-15H2,1-3H3,(H,28,32)/t16-,17-,24+/m0/s1	AVAQDGZIUQEYTO-WOGXIUBCSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)C4CC4)cc3C1=O	BroadT	BRD-K09304381	BRD-K09304381-001-01-9	Broad Institute of MIT and Harvard	BRD-K09304381			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)C3CC3)cc2C1=O	InChI=1S/C26H32FN3O6S/c1-16-13-30(17(2)15-31)26(33)22-12-20(28-25(32)18-4-5-18)8-11-23(22)36-24(16)14-29(3)37(34,35)21-9-6-19(27)7-10-21/h6-12,16-18,24,31H,4-5,13-15H2,1-3H3,(H,28,32)/t16-,17-,24+/m0/s1	AVAQDGZIUQEYTO-WOGXIUBCSA-N	533.199584664							111495
BRD-K55782399	LSM-22952		44491918	InChI=1S/C33H40N4O6/c1-21-18-37(22(2)20-38)32(40)26-11-7-13-28(34-31(39)24-14-16-42-17-15-24)30(26)43-29(21)19-36(3)33(41)35-27-12-6-9-23-8-4-5-10-25(23)27/h4-13,21-22,24,29,38H,14-20H2,1-3H3,(H,34,39)(H,35,41)/t21-,22+,29-/m0/s1	XPBUGQRVLIPCFW-KERYWQKISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K55782399	BRD-K55782399-001-01-9	Broad Institute of MIT and Harvard	BRD-K55782399			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C33H40N4O6/c1-21-18-37(22(2)20-38)32(40)26-11-7-13-28(34-31(39)24-14-16-42-17-15-24)30(26)43-29(21)19-36(3)33(41)35-27-12-6-9-23-8-4-5-10-25(23)27/h4-13,21-22,24,29,38H,14-20H2,1-3H3,(H,34,39)(H,35,41)/t21-,22+,29-/m0/s1	XPBUGQRVLIPCFW-KERYWQKISA-N	588.29478504							111496
BRD-K64698855	LSM-22953		44493203	InChI=1S/C29H40FN5O5/c1-19-16-35(20(2)18-36)28(38)24-15-23(31-27(37)7-6-14-33(3)4)12-13-25(24)40-26(19)17-34(5)29(39)32-22-10-8-21(30)9-11-22/h8-13,15,19-20,26,36H,6-7,14,16-18H2,1-5H3,(H,31,37)(H,32,39)/t19-,20-,26+/m1/s1	UQFLYQXQOZGCNB-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K64698855	BRD-K64698855-001-01-3	Broad Institute of MIT and Harvard	BRD-K64698855			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H40FN5O5/c1-19-16-35(20(2)18-36)28(38)24-15-23(31-27(37)7-6-14-33(3)4)12-13-25(24)40-26(19)17-34(5)29(39)32-22-10-8-21(30)9-11-22/h8-13,15,19-20,26,36H,6-7,14,16-18H2,1-5H3,(H,31,37)(H,32,39)/t19-,20-,26+/m1/s1	UQFLYQXQOZGCNB-KYTVRQNUSA-N	557.30134763							111497
BRD-K67137502	LSM-22954		44485017	InChI=1S/C30H33F3N4O4/c1-19-15-37(20(2)18-38)29(40)24-5-4-6-25(35-28(39)22-11-13-34-14-12-22)27(24)41-26(19)17-36(3)16-21-7-9-23(10-8-21)30(31,32)33/h4-14,19-20,26,38H,15-18H2,1-3H3,(H,35,39)/t19-,20-,26-/m1/s1	KEFKPOALKIRQIF-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K67137502	BRD-K67137502-001-01-6	Broad Institute of MIT and Harvard	BRD-K67137502			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C30H33F3N4O4/c1-19-15-37(20(2)18-38)29(40)24-5-4-6-25(35-28(39)22-11-13-34-14-12-22)27(24)41-26(19)17-36(3)16-21-7-9-23(10-8-21)30(31,32)33/h4-14,19-20,26,38H,15-18H2,1-3H3,(H,35,39)/t19-,20-,26-/m1/s1	KEFKPOALKIRQIF-XMERXJNXSA-N	570.245390176							111498
BRD-K90544118	LSM-22955		44500950	InChI=1S/C32H44N4O7/c1-22-17-36(23(2)20-37)32(39)16-25-15-26(33-31(38)8-9-35-10-12-40-13-11-35)5-7-27(25)43-30(22)19-34(3)18-24-4-6-28-29(14-24)42-21-41-28/h4-7,14-15,22-23,30,37H,8-13,16-21H2,1-3H3,(H,33,38)/t22-,23-,30-/m1/s1	NYPOLWMMHTZHKU-IQLGONJTSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCN5CCOCC5)cc4CC1=O	BroadT	BRD-K90544118	BRD-K90544118-001-01-0	Broad Institute of MIT and Harvard	BRD-K90544118			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC1=O	InChI=1S/C32H44N4O7/c1-22-17-36(23(2)20-37)32(39)16-25-15-26(33-31(38)8-9-35-10-12-40-13-11-35)5-7-27(25)43-30(22)19-34(3)18-24-4-6-28-29(14-24)42-21-41-28/h4-7,14-15,22-23,30,37H,8-13,16-21H2,1-3H3,(H,33,38)/t22-,23-,30-/m1/s1	NYPOLWMMHTZHKU-IQLGONJTSA-N	596.320999788							111499
BRD-K41207293	LSM-22956		44487194	InChI=1S/C22H28N4O4/c1-14-12-26(15(2)13-27)22(29)18-10-17(4-5-19(18)30-20(14)11-23-3)25-21(28)16-6-8-24-9-7-16/h4-10,14-15,20,23,27H,11-13H2,1-3H3,(H,25,28)/t14-,15-,20+/m0/s1	ZXKRGMHNDBNPIZ-AUSJPIAWSA-N	CNC[C@H]1Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K41207293	BRD-K41207293-001-01-1	Broad Institute of MIT and Harvard	BRD-K41207293			CNC[C@H]1Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C22H28N4O4/c1-14-12-26(15(2)13-27)22(29)18-10-17(4-5-19(18)30-20(14)11-23-3)25-21(28)16-6-8-24-9-7-16/h4-10,14-15,20,23,27H,11-13H2,1-3H3,(H,25,28)/t14-,15-,20+/m0/s1	ZXKRGMHNDBNPIZ-AUSJPIAWSA-N	412.211055416							111500
BRD-K71319626	LSM-22957		44487719	InChI=1S/C27H31Cl2N3O5S2/c1-17-13-32(18(2)16-33)27(34)21-12-20(30-39(35,36)26-5-4-10-38-26)7-9-24(21)37-25(17)15-31(3)14-19-6-8-22(28)23(29)11-19/h4-12,17-18,25,30,33H,13-16H2,1-3H3/t17-,18-,25+/m0/s1	AATIEZKZMFDISZ-DPOKWSEZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NS(=O)(=O)c4cccs4)cc3C1=O	BroadT	BRD-K71319626	BRD-K71319626-001-01-5	Broad Institute of MIT and Harvard	BRD-K71319626			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NS(=O)(=O)c3cccs3)cc2C1=O	InChI=1S/C27H31Cl2N3O5S2/c1-17-13-32(18(2)16-33)27(34)21-12-20(30-39(35,36)26-5-4-10-38-26)7-9-24(21)37-25(17)15-31(3)14-19-6-8-22(28)23(29)11-19/h4-12,17-18,25,30,33H,13-16H2,1-3H3/t17-,18-,25+/m0/s1	AATIEZKZMFDISZ-DPOKWSEZSA-N	611.108217922							111501
BRD-K27584103	LSM-22958		44485005	InChI=1S/C29H39N5O5/c1-19-16-34(20(2)18-35)28(37)23-10-7-11-24(32-27(36)21-12-14-30-15-13-21)26(23)39-25(19)17-33(3)29(38)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,25,35H,4-6,8-9,16-18H2,1-3H3,(H,31,38)(H,32,36)/t19-,20-,25-/m1/s1	KKCRHGGATFNVQS-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K27584103	BRD-K27584103-001-01-1	Broad Institute of MIT and Harvard	BRD-K27584103			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C29H39N5O5/c1-19-16-34(20(2)18-35)28(37)23-10-7-11-24(32-27(36)21-12-14-30-15-13-21)26(23)39-25(19)17-33(3)29(38)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,25,35H,4-6,8-9,16-18H2,1-3H3,(H,31,38)(H,32,36)/t19-,20-,25-/m1/s1	KKCRHGGATFNVQS-UMEGOILYSA-N	537.295119398							111502
BRD-K01098976	LSM-22959		44498314	InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)17-8-7-9-18(24(3)4)21(17)32-19(15)11-26(6)33(30,31)20-12-25(5)14-23-20/h7-9,12,14-16,19,28H,10-11,13H2,1-6H3/t15-,16+,19+/m1/s1	NFFRJINEVFDSRM-GJYPPUQNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K01098976	BRD-K01098976-001-01-6	Broad Institute of MIT and Harvard	BRD-K01098976			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)17-8-7-9-18(24(3)4)21(17)32-19(15)11-26(6)33(30,31)20-12-25(5)14-23-20/h7-9,12,14-16,19,28H,10-11,13H2,1-6H3/t15-,16+,19+/m1/s1	NFFRJINEVFDSRM-GJYPPUQNSA-N	479.220239896							111545
BRD-K33597325	LSM-22960		44484411	InChI=1S/C18H29N3O3/c1-12-10-21(13(2)11-22)18(23)14-7-6-8-15(20(4)5)17(14)24-16(12)9-19-3/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13-,16+/m1/s1	XJHVRUWFSLOUIR-IOASZLSFSA-N	CNC[C@@H]1Oc2c(cccc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K33597325	BRD-K33597325-001-01-7	Broad Institute of MIT and Harvard	BRD-K33597325			CNC[C@@H]1Oc2c(cccc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C18H29N3O3/c1-12-10-21(13(2)11-22)18(23)14-7-6-8-15(20(4)5)17(14)24-16(12)9-19-3/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13-,16+/m1/s1	XJHVRUWFSLOUIR-IOASZLSFSA-N	335.220891818							111546
BRD-K17840858	LSM-22961		44503922	InChI=1S/C22H36N4O6S/c1-14(2)23-22(29)24-18-7-8-19-17(9-18)10-21(28)26(16(4)13-27)11-15(3)20(32-19)12-25(5)33(6,30)31/h7-9,14-16,20,27H,10-13H2,1-6H3,(H2,23,24,29)/t15-,16+,20-/m1/s1	IDOMJCFPTXQKSJ-GQIGUUNPSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)S(=O)(=O)C)[C@H](C)CN([C@@H](C)CO)C(=O)Cc2c1	BroadT	BRD-K17840858	BRD-K17840858-001-01-6	Broad Institute of MIT and Harvard	BRD-K17840858			CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)S(C)(=O)=O)[C@H](C)CN([C@@H](C)CO)C(=O)Cc2c1	InChI=1S/C22H36N4O6S/c1-14(2)23-22(29)24-18-7-8-19-17(9-18)10-21(28)26(16(4)13-27)11-15(3)20(32-19)12-25(5)33(6,30)31/h7-9,14-16,20,27H,10-13H2,1-6H3,(H2,23,24,29)/t15-,16+,20-/m1/s1	IDOMJCFPTXQKSJ-GQIGUUNPSA-N	484.235555602							111547
BRD-K34808207	LSM-22962		44490046	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16+,20-/m0/s1	GIKJWVQVMSIYNX-YRNRMSPPSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K34808207	BRD-K34808207-001-01-0	Broad Institute of MIT and Harvard	BRD-K34808207			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16+,20-/m0/s1	GIKJWVQVMSIYNX-YRNRMSPPSA-N	420.273655672							111548
BRD-K64329997	LSM-22963		44502652	InChI=1S/C32H44N4O7/c1-22-17-36(23(2)20-37)32(39)16-25-15-26(33-31(38)8-9-35-10-12-40-13-11-35)5-7-27(25)43-30(22)19-34(3)18-24-4-6-28-29(14-24)42-21-41-28/h4-7,14-15,22-23,30,37H,8-13,16-21H2,1-3H3,(H,33,38)/t22-,23-,30+/m0/s1	NYPOLWMMHTZHKU-ZTNZZFSWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCN5CCOCC5)cc4CC1=O	BroadT	BRD-K64329997	BRD-K64329997-001-01-4	Broad Institute of MIT and Harvard	BRD-K64329997			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC1=O	InChI=1S/C32H44N4O7/c1-22-17-36(23(2)20-37)32(39)16-25-15-26(33-31(38)8-9-35-10-12-40-13-11-35)5-7-27(25)43-30(22)19-34(3)18-24-4-6-28-29(14-24)42-21-41-28/h4-7,14-15,22-23,30,37H,8-13,16-21H2,1-3H3,(H,33,38)/t22-,23-,30+/m0/s1	NYPOLWMMHTZHKU-ZTNZZFSWSA-N	596.320999788							111549
BRD-K65000194	LSM-15090		44487159	InChI=1S/C32H38N4O7/c1-20-15-36(21(2)18-37)31(38)26-14-24(34-32(39)33-23-6-9-25(40-4)10-7-23)8-12-27(26)43-30(20)17-35(3)16-22-5-11-28-29(13-22)42-19-41-28/h5-14,20-21,30,37H,15-19H2,1-4H3,(H2,33,34,39)/t20-,21-,30+/m0/s1	NGRSXEMLDRQNMH-FNFPNEPISA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)Cc4ccc5OCOc5c4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K65000194	BRD-K65000194-001-01-1	Broad Institute of MIT and Harvard	BRD-K65000194			COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)Cc4ccc5OCOc5c4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C32H38N4O7/c1-20-15-36(21(2)18-37)31(38)26-14-24(34-32(39)33-23-6-9-25(40-4)10-7-23)8-12-27(26)43-30(20)17-35(3)16-22-5-11-28-29(13-22)42-19-41-28/h5-14,20-21,30,37H,15-19H2,1-4H3,(H2,33,34,39)/t20-,21-,30+/m0/s1	NGRSXEMLDRQNMH-FNFPNEPISA-N	590.274049596							103746
BRD-K73600333	LSM-22964		44499230	InChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21-,26-/m1/s1	QPEXUVZRKHXLPB-IPVFLDMMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)C4CCOCC4)cccc3C1=O	BroadT	BRD-K73600333	BRD-K73600333-001-01-0	Broad Institute of MIT and Harvard	BRD-K73600333			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21-,26-/m1/s1	QPEXUVZRKHXLPB-IPVFLDMMSA-N	515.33592157							111550
BRD-K17176016	LSM-22965		44483582	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)25-15-23(32-41(38,39)24-12-9-21(30)10-13-24)11-14-26(25)40-27(19)17-33(3)29(37)31-22-7-5-4-6-8-22/h9-15,19-20,22,27,32,35H,4-8,16-18H2,1-3H3,(H,31,37)/t19-,20-,27-/m0/s1	GFSCIXLFWMXIKM-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C1=O	BroadT	BRD-K17176016	BRD-K17176016-001-01-4	Broad Institute of MIT and Harvard	BRD-K17176016			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)25-15-23(32-41(38,39)24-12-9-21(30)10-13-24)11-14-26(25)40-27(19)17-33(3)29(37)31-22-7-5-4-6-8-22/h9-15,19-20,22,27,32,35H,4-8,16-18H2,1-3H3,(H,31,37)/t19-,20-,27-/m0/s1	GFSCIXLFWMXIKM-OSOCVKALSA-N	590.257433898							111551
BRD-K05074020	LSM-22966		44498016	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)27-12-9-13-28(32(3)4)30(27)38-29(22)20-33(5)19-24-14-16-26(17-15-24)37-25-10-7-6-8-11-25/h6-17,22-23,29,35H,18-21H2,1-5H3/t22-,23-,29-/m1/s1	KBWKSVZPOQKHGN-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K05074020	BRD-K05074020-001-01-9	Broad Institute of MIT and Harvard	BRD-K05074020			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)27-12-9-13-28(32(3)4)30(27)38-29(22)20-33(5)19-24-14-16-26(17-15-24)37-25-10-7-6-8-11-25/h6-17,22-23,29,35H,18-21H2,1-5H3/t22-,23-,29-/m1/s1	KBWKSVZPOQKHGN-VDWGHMIBSA-N	517.294056758							111552
BRD-K75384919	LSM-22967		44491193	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)28-18-26(35-33(42)37-29-15-9-11-24-10-7-8-14-27(24)29)16-17-30(28)44-31(22)20-38(3)34(43)36-25-12-5-4-6-13-25/h7-11,14-18,22-23,25,31,40H,4-6,12-13,19-21H2,1-3H3,(H,36,43)(H2,35,37,42)/t22-,23+,31-/m0/s1	QXYCJPXUIIEYFH-LWPQGVMLSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Nc4cccc5ccccc45)cc3C1=O	BroadT	BRD-K75384919	BRD-K75384919-001-01-1	Broad Institute of MIT and Harvard	BRD-K75384919			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)28-18-26(35-33(42)37-29-15-9-11-24-10-7-8-14-27(24)29)16-17-30(28)44-31(22)20-38(3)34(43)36-25-12-5-4-6-13-25/h7-11,14-18,22-23,25,31,40H,4-6,12-13,19-21H2,1-3H3,(H,36,43)(H2,35,37,42)/t22-,23+,31-/m0/s1	QXYCJPXUIIEYFH-LWPQGVMLSA-N	601.326419526							111553
BRD-K29614616	LSM-22968		44504162	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18-,23+/m1/s1	ZIGDOLRJGHLEBT-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K29614616	BRD-K29614616-001-01-4	Broad Institute of MIT and Harvard	BRD-K29614616			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18-,23+/m1/s1	ZIGDOLRJGHLEBT-PNCHPQGNSA-N	490.224990918							111554
BRD-K06237859	LSM-22969		44496596	InChI=1S/C30H37N3O5S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-39(4,36)37)29(26)38-28(21)19-32(3)18-23-13-15-25(16-14-23)24-9-6-5-7-10-24/h5-16,21-22,28,31,34H,17-20H2,1-4H3/t21-,22-,28+/m0/s1	YVBCCXLDGZBBDC-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)c3ccccc3)Oc4c(NS(=O)(=O)C)cccc4C1=O	BroadT	BRD-K06237859	BRD-K06237859-001-01-7	Broad Institute of MIT and Harvard	BRD-K06237859			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)-c2ccccc2)Oc2c(NS(C)(=O)=O)cccc2C1=O	InChI=1S/C30H37N3O5S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-39(4,36)37)29(26)38-28(21)19-32(3)18-23-13-15-25(16-14-23)24-9-6-5-7-10-24/h5-16,21-22,28,31,34H,17-20H2,1-4H3/t21-,22-,28+/m0/s1	YVBCCXLDGZBBDC-RXYILKCJSA-N	551.245392004							111555
BRD-K07152092	LSM-22970		44496091	InChI=1S/C30H43N3O6S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-40(36,37)25-15-13-24(38-4)14-16-25)29(26)39-28(21)19-32(3)18-23-9-6-5-7-10-23/h8,11-16,21-23,28,31,34H,5-7,9-10,17-20H2,1-4H3/t21-,22-,28+/m1/s1	VVRSDBHKTRDHNY-XJGOYTCSSA-N	COc1ccc(cc1)S(=O)(=O)Nc2cccc3C(=O)N(C[C@@H](C)[C@H](CN(C)CC4CCCCC4)Oc23)[C@H](C)CO	BroadT	BRD-K07152092	BRD-K07152092-001-01-4	Broad Institute of MIT and Harvard	BRD-K07152092			COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1O[C@@H](CN(C)CC1CCCCC1)[C@H](C)CN([C@H](C)CO)C2=O	InChI=1S/C30H43N3O6S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-40(36,37)25-15-13-24(38-4)14-16-25)29(26)39-28(21)19-32(3)18-23-9-6-5-7-10-23/h8,11-16,21-23,28,31,34H,5-7,9-10,17-20H2,1-4H3/t21-,22-,28+/m1/s1	VVRSDBHKTRDHNY-XJGOYTCSSA-N	573.287256816							111556
BRD-K82112239	LSM-22971		44493496	InChI=1S/C27H36F3N3O3/c1-18-14-33(19(2)17-34)26(35)13-21-12-23(31(3)4)10-11-24(21)36-25(18)16-32(5)15-20-6-8-22(9-7-20)27(28,29)30/h6-12,18-19,25,34H,13-17H2,1-5H3/t18-,19-,25-/m1/s1	RAYQZOVLGJUDGR-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K82112239	BRD-K82112239-001-01-0	Broad Institute of MIT and Harvard	BRD-K82112239			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C27H36F3N3O3/c1-18-14-33(19(2)17-34)26(35)13-21-12-23(31(3)4)10-11-24(21)36-25(18)16-32(5)15-20-6-8-22(9-7-20)27(28,29)30/h6-12,18-19,25,34H,13-17H2,1-5H3/t18-,19-,25-/m1/s1	RAYQZOVLGJUDGR-MPCDZSKCSA-N	507.270876642							111557
BRD-K03382006	LSM-22972		44498014	InChI=1S/C29H34FN5O4/c1-19-15-35(20(2)18-36)28(37)24-5-4-6-25(33-29(38)32-23-9-7-22(30)8-10-23)27(24)39-26(19)17-34(3)16-21-11-13-31-14-12-21/h4-14,19-20,26,36H,15-18H2,1-3H3,(H2,32,33,38)/t19-,20-,26-/m1/s1	VBGZKSFWINXWAF-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3c(NC(=O)Nc4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K03382006	BRD-K03382006-001-01-6	Broad Institute of MIT and Harvard	BRD-K03382006			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2c(NC(=O)Nc3ccc(F)cc3)cccc2C1=O	InChI=1S/C29H34FN5O4/c1-19-15-35(20(2)18-36)28(37)24-5-4-6-25(33-29(38)32-23-9-7-22(30)8-10-23)27(24)39-26(19)17-34(3)16-21-11-13-31-14-12-21/h4-14,19-20,26,36H,15-18H2,1-3H3,(H2,32,33,38)/t19-,20-,26-/m1/s1	VBGZKSFWINXWAF-XMERXJNXSA-N	535.259482818							111558
BRD-K47175449	LSM-22973		44501937	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20-,27+/m0/s1	FITMUQCJUCLPTO-OWOAZTCBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4c(C)onc4C)cc3CC1=O	BroadT	BRD-K47175449	BRD-K47175449-001-01-7	Broad Institute of MIT and Harvard	BRD-K47175449			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3c(C)noc3C)cc2CC1=O	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20-,27+/m0/s1	FITMUQCJUCLPTO-OWOAZTCBSA-N	576.298155858							111559
BRD-K78819886	LSM-22974		44490208	InChI=1S/C27H38N4O4/c1-18(2)28-27(34)29-23-13-9-12-22-25(23)35-24(16-30(5)15-21-10-7-6-8-11-21)19(3)14-31(26(22)33)20(4)17-32/h6-13,18-20,24,32H,14-17H2,1-5H3,(H2,28,29,34)/t19-,20+,24+/m1/s1	NCIZYGIVVKAPIW-NMMYMHLASA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@@H](C)[C@H](CN(C)Cc3ccccc3)Oc12)[C@@H](C)CO	BroadT	BRD-K78819886	BRD-K78819886-001-01-2	Broad Institute of MIT and Harvard	BRD-K78819886			CC(C)NC(=O)Nc1cccc2c1O[C@@H](CN(C)Cc1ccccc1)[C@H](C)CN([C@@H](C)CO)C2=O	InChI=1S/C27H38N4O4/c1-18(2)28-27(34)29-23-13-9-12-22-25(23)35-24(16-30(5)15-21-10-7-6-8-11-21)19(3)14-31(26(22)33)20(4)17-32/h6-13,18-20,24,32H,14-17H2,1-5H3,(H2,28,29,34)/t19-,20+,24+/m1/s1	NCIZYGIVVKAPIW-NMMYMHLASA-N	482.289305736							111560
BRD-K60912230	LSM-22975		44497646	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15-,21-/m0/s1	LUEPMRNQGZCFGP-GXZWQRSESA-N	CNC[C@@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K60912230	BRD-K60912230-001-01-8	Broad Institute of MIT and Harvard	BRD-K60912230			CNC[C@@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15-,21-/m0/s1	LUEPMRNQGZCFGP-GXZWQRSESA-N	470.21653472							111561
BRD-K41809155	LSM-22976		44501714	InChI=1S/C27H33ClF3N3O6S/c1-17-14-34(18(2)16-35)26(37)13-19-12-21(32-25(36)10-11-27(29,30)31)6-9-23(19)40-24(17)15-33(3)41(38,39)22-7-4-20(28)5-8-22/h4-9,12,17-18,24,35H,10-11,13-16H2,1-3H3,(H,32,36)/t17-,18-,24+/m0/s1	BTSOZOCIIHDJJX-LLJLJFOGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC1=O	BroadT	BRD-K41809155	BRD-K41809155-001-01-1	Broad Institute of MIT and Harvard	BRD-K41809155			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C27H33ClF3N3O6S/c1-17-14-34(18(2)16-35)26(37)13-19-12-21(32-25(36)10-11-27(29,30)31)6-9-23(19)40-24(17)15-33(3)41(38,39)22-7-4-20(28)5-8-22/h4-9,12,17-18,24,35H,10-11,13-16H2,1-3H3,(H,32,36)/t17-,18-,24+/m0/s1	BTSOZOCIIHDJJX-LLJLJFOGSA-N	619.173068806							111562
BRD-K35943892	LSM-22977		44486008	InChI=1S/C25H33FN4O4/c1-16-13-30(17(2)15-31)24(32)21-12-20(28(3)4)10-11-22(21)34-23(16)14-29(5)25(33)27-19-8-6-18(26)7-9-19/h6-12,16-17,23,31H,13-15H2,1-5H3,(H,27,33)/t16-,17+,23-/m0/s1	FXKMHYTYNRWQSP-MFEFFIJZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K35943892	BRD-K35943892-001-01-4	Broad Institute of MIT and Harvard	BRD-K35943892			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H33FN4O4/c1-16-13-30(17(2)15-31)24(32)21-12-20(28(3)4)10-11-22(21)34-23(16)14-29(5)25(33)27-19-8-6-18(26)7-9-19/h6-12,16-17,23,31H,13-15H2,1-5H3,(H,27,33)/t16-,17+,23-/m0/s1	FXKMHYTYNRWQSP-MFEFFIJZSA-N	472.248583776							111563
BRD-K88616914	LSM-22978		44492987	InChI=1S/C27H38N4O4/c1-18(2)28-27(34)29-23-13-9-12-22-25(23)35-24(16-30(5)15-21-10-7-6-8-11-21)19(3)14-31(26(22)33)20(4)17-32/h6-13,18-20,24,32H,14-17H2,1-5H3,(H2,28,29,34)/t19-,20-,24-/m0/s1	NCIZYGIVVKAPIW-SKPFHBQLSA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@H](C)[C@H](CN(C)Cc3ccccc3)Oc12)[C@@H](C)CO	BroadT	BRD-K88616914	BRD-K88616914-001-01-6	Broad Institute of MIT and Harvard	BRD-K88616914			CC(C)NC(=O)Nc1cccc2c1O[C@@H](CN(C)Cc1ccccc1)[C@@H](C)CN([C@@H](C)CO)C2=O	InChI=1S/C27H38N4O4/c1-18(2)28-27(34)29-23-13-9-12-22-25(23)35-24(16-30(5)15-21-10-7-6-8-11-21)19(3)14-31(26(22)33)20(4)17-32/h6-13,18-20,24,32H,14-17H2,1-5H3,(H2,28,29,34)/t19-,20-,24-/m0/s1	NCIZYGIVVKAPIW-SKPFHBQLSA-N	482.289305736							111564
BRD-K74807825	LSM-22979		44487109	InChI=1S/C30H36N4O4/c1-21-17-34(22(2)20-35)29(36)26-16-25(32-30(37)31-24-12-8-5-9-13-24)14-15-27(26)38-28(21)19-33(3)18-23-10-6-4-7-11-23/h4-16,21-22,28,35H,17-20H2,1-3H3,(H2,31,32,37)/t21-,22-,28+/m0/s1	HYMZOYYGWSDRHJ-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K74807825	BRD-K74807825-001-01-5	Broad Institute of MIT and Harvard	BRD-K74807825			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H36N4O4/c1-21-17-34(22(2)20-35)29(36)26-16-25(32-30(37)31-24-12-8-5-9-13-24)14-15-27(26)38-28(21)19-33(3)18-23-10-6-4-7-11-23/h4-16,21-22,28,35H,17-20H2,1-3H3,(H2,31,32,37)/t21-,22-,28+/m0/s1	HYMZOYYGWSDRHJ-RXYILKCJSA-N	516.273655672							111565
BRD-K37381656	LSM-22980		44502861	InChI=1S/C31H36FN3O7S/c1-20-15-35(21(2)18-36)31(37)14-23-13-25(33-43(38,39)26-8-5-24(32)6-9-26)7-11-27(23)42-30(20)17-34(3)16-22-4-10-28-29(12-22)41-19-40-28/h4-13,20-21,30,33,36H,14-19H2,1-3H3/t20-,21-,30-/m0/s1	ZVLYFKSMWJQSMB-LPBFERMMSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc4CC1=O	BroadT	BRD-K37381656	BRD-K37381656-001-01-1	Broad Institute of MIT and Harvard	BRD-K37381656			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2CC1=O	InChI=1S/C31H36FN3O7S/c1-20-15-35(21(2)18-36)31(37)14-23-13-25(33-43(38,39)26-8-5-24(32)6-9-26)7-11-27(23)42-30(20)17-34(3)16-22-4-10-28-29(12-22)41-19-40-28/h4-13,20-21,30,33,36H,14-19H2,1-3H3/t20-,21-,30-/m0/s1	ZVLYFKSMWJQSMB-LPBFERMMSA-N	613.225799412							111566
SA-243193	LSM-15077		44500308	InChI=1S/C26H42N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h11-13,18-19,21,24,31H,6-10,14-17H2,1-5H3,(H,27,33)/t18-,19+,24-/m1/s1	NUQLUNTVVQHOLK-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K63154426	BRD-K63154426-001-01-8	Broad Institute of MIT and Harvard	BRD-K63154426			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C26H42N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h11-13,18-19,21,24,31H,6-10,14-17H2,1-5H3,(H,27,33)/t18-,19+,24-/m1/s1	NUQLUNTVVQHOLK-YDIMBITNSA-N	474.320605864							103733
BRD-K26758344	LSM-22981		44486085	InChI=1S/C24H33N3O5S/c1-17-14-27(18(2)16-28)24(29)21-13-19(25(3)4)11-12-22(21)32-23(17)15-26(5)33(30,31)20-9-7-6-8-10-20/h6-13,17-18,23,28H,14-16H2,1-5H3/t17-,18+,23-/m1/s1	ZRFMJOMCDWKIOJ-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K26758344	BRD-K26758344-001-01-1	Broad Institute of MIT and Harvard	BRD-K26758344			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C24H33N3O5S/c1-17-14-27(18(2)16-28)24(29)21-13-19(25(3)4)11-12-22(21)32-23(17)15-26(5)33(30,31)20-9-7-6-8-10-20/h6-13,17-18,23,28H,14-16H2,1-5H3/t17-,18+,23-/m1/s1	ZRFMJOMCDWKIOJ-IEGUWTFLSA-N	475.214091876							111567
BRD-K34416015	LSM-22982		44484703	InChI=1S/C30H34N4O6/c1-19-14-34(20(2)17-35)30(37)24-13-23(32-29(36)22-8-10-31-11-9-22)5-7-25(24)40-28(19)16-33(3)15-21-4-6-26-27(12-21)39-18-38-26/h4-13,19-20,28,35H,14-18H2,1-3H3,(H,32,36)/t19-,20-,28+/m0/s1	VPWIZKHQYUSQSD-URCRQUEMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)c5ccncc5)cc4C1=O	BroadT	BRD-K34416015	BRD-K34416015-001-01-4	Broad Institute of MIT and Harvard	BRD-K34416015			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C30H34N4O6/c1-19-14-34(20(2)17-35)30(37)24-13-23(32-29(36)22-8-10-31-11-9-22)5-7-25(24)40-28(19)16-33(3)15-21-4-6-26-27(12-21)39-18-38-26/h4-13,19-20,28,35H,14-18H2,1-3H3,(H,32,36)/t19-,20-,28+/m0/s1	VPWIZKHQYUSQSD-URCRQUEMSA-N	546.247834848							111568
BRD-K84807411	LSM-22983		44494148	InChI=1S/C23H33N5O4/c1-14-11-28(16(3)13-29)23(31)17-8-7-9-18(21(17)32-20(14)12-26(4)5)24-22(30)19-10-15(2)25-27(19)6/h7-10,14,16,20,29H,11-13H2,1-6H3,(H,24,30)/t14-,16+,20+/m0/s1	ADWJBSWPWOPVMW-YYFZDKIDSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)c3cc(C)nn3C)cccc2C1=O	BroadT	BRD-K84807411	BRD-K84807411-001-01-3	Broad Institute of MIT and Harvard	BRD-K84807411			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)c3cc(C)nn3C)cccc2C1=O	InChI=1S/C23H33N5O4/c1-14-11-28(16(3)13-29)23(31)17-8-7-9-18(21(17)32-20(14)12-26(4)5)24-22(30)19-10-15(2)25-27(19)6/h7-10,14,16,20,29H,11-13H2,1-6H3,(H,24,30)/t14-,16+,20+/m0/s1	ADWJBSWPWOPVMW-YYFZDKIDSA-N	443.253254586							111569
BRD-K87569647-001-01-2	LSM-22984	BRD-K87569647	44496979	InChI=1S/C26H35ClN4O6S/c1-16(2)28-26(34)30(5)14-23-17(3)13-31(18(4)15-32)25(33)21-7-6-8-22(24(21)37-23)29-38(35,36)20-11-9-19(27)10-12-20/h6-12,16-18,23,29,32H,13-15H2,1-5H3,(H,28,34)/t17-,18-,23+/m1/s1	ROXPMFGZZQEKHB-PNCHPQGNSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NS(=O)(=O)c3ccc(Cl)cc3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K87569647	BRD-K87569647-001-01-2	Broad Institute of MIT and Harvard	BRD-K87569647			CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NS(=O)(=O)c3ccc(Cl)cc3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C26H35ClN4O6S/c1-16(2)28-26(34)30(5)14-23-17(3)13-31(18(4)15-32)25(33)21-7-6-8-22(24(21)37-23)29-38(35,36)20-11-9-19(27)10-12-20/h6-12,16-18,23,29,32H,13-15H2,1-5H3,(H,28,34)/t17-,18-,23+/m1/s1	ROXPMFGZZQEKHB-PNCHPQGNSA-N	566.19658328							111570
BRD-K98815321	LSM-22985		44488571	InChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16+,20+/m0/s1	HFFGMDRCIAVIES-RZQQEMMASA-N	CNC[C@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K98815321	BRD-K98815321-001-02-7	Broad Institute of MIT and Harvard	BRD-K98815321			CNC[C@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16+,20+/m0/s1	HFFGMDRCIAVIES-RZQQEMMASA-N	432.273655672							111571
BRD-K62541003	LSM-22986		44493444	InChI=1S/C34H36FN5O5/c1-21-18-40(22(2)20-41)32(42)27-11-7-13-29(38-33(43)37-28-12-6-9-23-8-4-5-10-26(23)28)31(27)45-30(21)19-39(3)34(44)36-25-16-14-24(35)15-17-25/h4-17,21-22,30,41H,18-20H2,1-3H3,(H,36,44)(H2,37,38,43)/t21-,22-,30+/m0/s1	INJMWLLCIWTMDU-MWXNICTNSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3c(NC(=O)Nc4cccc5ccccc45)cccc3C1=O	BroadT	BRD-K62541003	BRD-K62541003-001-01-8	Broad Institute of MIT and Harvard	BRD-K62541003			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C1=O	InChI=1S/C34H36FN5O5/c1-21-18-40(22(2)20-41)32(42)27-11-7-13-29(38-33(43)37-28-12-6-9-23-8-4-5-10-26(23)28)31(27)45-30(21)19-39(3)34(44)36-25-16-14-24(35)15-17-25/h4-17,21-22,30,41H,18-20H2,1-3H3,(H,36,44)(H2,37,38,43)/t21-,22-,30+/m0/s1	INJMWLLCIWTMDU-MWXNICTNSA-N	613.270047502							111572
BRD-K05846874	LSM-22987		44499656	InChI=1S/C29H36N4O5S/c1-20-8-10-24(11-9-20)39(36,37)31-26-7-5-6-25-28(26)38-27(18-32(4)17-23-12-14-30-15-13-23)21(2)16-33(29(25)35)22(3)19-34/h5-15,21-22,27,31,34H,16-19H2,1-4H3/t21-,22+,27+/m1/s1	JBHIQUJYWNKFSD-VHSZZVNMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc3c(NS(=O)(=O)c4ccc(C)cc4)cccc3C1=O	BroadT	BRD-K05846874	BRD-K05846874-001-01-7	Broad Institute of MIT and Harvard	BRD-K05846874			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc2c(NS(=O)(=O)c3ccc(C)cc3)cccc2C1=O	InChI=1S/C29H36N4O5S/c1-20-8-10-24(11-9-20)39(36,37)31-26-7-5-6-25-28(26)38-27(18-32(4)17-23-12-14-30-15-13-23)21(2)16-33(29(25)35)22(3)19-34/h5-15,21-22,27,31,34H,16-19H2,1-4H3/t21-,22+,27+/m1/s1	JBHIQUJYWNKFSD-VHSZZVNMSA-N	552.240640982							111573
BRD-K88395169	LSM-22988		44485902	InChI=1S/C34H43N5O6/c1-23-20-39(24(2)22-40)33(42)28-19-26(35-32(41)13-14-38-15-17-44-18-16-38)11-12-30(28)45-31(23)21-37(3)34(43)36-29-10-6-8-25-7-4-5-9-27(25)29/h4-12,19,23-24,31,40H,13-18,20-22H2,1-3H3,(H,35,41)(H,36,43)/t23-,24-,31+/m0/s1	NJKSMJYTSLFNSQ-ISTJGCCRSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)CCN5CCOCC5)cc4C1=O	BroadT	BRD-K88395169	BRD-K88395169-001-01-9	Broad Institute of MIT and Harvard	BRD-K88395169			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)CCN3CCOCC3)cc2C1=O	InChI=1S/C34H43N5O6/c1-23-20-39(24(2)22-40)33(42)28-19-26(35-32(41)13-14-38-15-17-44-18-16-38)11-12-30(28)45-31(23)21-37(3)34(43)36-29-10-6-8-25-7-4-5-9-27(25)29/h4-12,19,23-24,31,40H,13-18,20-22H2,1-3H3,(H,35,41)(H,36,43)/t23-,24-,31+/m0/s1	NJKSMJYTSLFNSQ-ISTJGCCRSA-N	617.321334146							111574
BRD-K62698674	LSM-22989		44496764	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18+,23-/m0/s1	ZIGDOLRJGHLEBT-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K62698674	BRD-K62698674-001-01-4	Broad Institute of MIT and Harvard	BRD-K62698674			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18+,23-/m0/s1	ZIGDOLRJGHLEBT-IXFSTUDKSA-N	490.224990918							111575
BRD-K78965436	LSM-22990		44485924	InChI=1S/C26H34F3N3O3/c1-17-13-32(18(2)16-33)25(34)22-12-21(30(3)4)10-11-23(22)35-24(17)15-31(5)14-19-6-8-20(9-7-19)26(27,28)29/h6-12,17-18,24,33H,13-16H2,1-5H3/t17-,18-,24+/m0/s1	MFZVISJYBZETPX-LLJLJFOGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K78965436	BRD-K78965436-001-01-8	Broad Institute of MIT and Harvard	BRD-K78965436			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C26H34F3N3O3/c1-17-13-32(18(2)16-33)25(34)22-12-21(30(3)4)10-11-23(22)35-24(17)15-31(5)14-19-6-8-20(9-7-19)26(27,28)29/h6-12,17-18,24,33H,13-16H2,1-5H3/t17-,18-,24+/m0/s1	MFZVISJYBZETPX-LLJLJFOGSA-N	493.255226578							111576
BRD-K31197155	LSM-22991		44495423	InChI=1S/C23H35N5O5S/c1-16-11-28(17(2)14-29)23(30)10-18-9-19(25(3)4)7-8-20(18)33-21(16)12-27(6)34(31,32)22-13-26(5)15-24-22/h7-9,13,15-17,21,29H,10-12,14H2,1-6H3/t16-,17-,21+/m0/s1	XKGXVARXDYWWSM-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K31197155	BRD-K31197155-001-01-3	Broad Institute of MIT and Harvard	BRD-K31197155			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C23H35N5O5S/c1-16-11-28(17(2)14-29)23(30)10-18-9-19(25(3)4)7-8-20(18)33-21(16)12-27(6)34(31,32)22-13-26(5)15-24-22/h7-9,13,15-17,21,29H,10-12,14H2,1-6H3/t16-,17-,21+/m0/s1	XKGXVARXDYWWSM-XGHQBKJUSA-N	493.23588996							111577
BRD-K85246097	LSM-22992		44496530	InChI=1S/C23H33N5O4/c1-14-11-28(16(3)13-29)23(31)17-8-7-9-18(21(17)32-20(14)12-26(4)5)24-22(30)19-10-15(2)25-27(19)6/h7-10,14,16,20,29H,11-13H2,1-6H3,(H,24,30)/t14-,16-,20+/m1/s1	ADWJBSWPWOPVMW-KKVAFCGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2c(NC(=O)c3cc(C)nn3C)cccc2C1=O	BroadT	BRD-K85246097	BRD-K85246097-001-01-4	Broad Institute of MIT and Harvard	BRD-K85246097			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2c(NC(=O)c3cc(C)nn3C)cccc2C1=O	InChI=1S/C23H33N5O4/c1-14-11-28(16(3)13-29)23(31)17-8-7-9-18(21(17)32-20(14)12-26(4)5)24-22(30)19-10-15(2)25-27(19)6/h7-10,14,16,20,29H,11-13H2,1-6H3,(H,24,30)/t14-,16-,20+/m1/s1	ADWJBSWPWOPVMW-KKVAFCGZSA-N	443.253254586							111578
BRD-K86454955	LSM-22993		44503599	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18-,23+/m0/s1	ZIGDOLRJGHLEBT-IUKKYPGJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K86454955	BRD-K86454955-001-01-4	Broad Institute of MIT and Harvard	BRD-K86454955			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)24(30)12-20-11-21(26-34(4,31)32)5-6-22(20)33-23(17)15-27(3)14-19-7-9-25-10-8-19/h5-11,17-18,23,26,29H,12-16H2,1-4H3/t17-,18-,23+/m0/s1	ZIGDOLRJGHLEBT-IUKKYPGJSA-N	490.224990918							111579
BRD-K82754593	LSM-22994		44486837	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14-,18+/m0/s1	TWHSADQACYCNBZ-SUNYJGFJSA-N	CNC[C@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K82754593	BRD-K82754593-001-01-9	Broad Institute of MIT and Harvard	BRD-K82754593			CNC[C@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14-,18+/m0/s1	TWHSADQACYCNBZ-SUNYJGFJSA-N	413.206304394							111580
BRD-K81647247	LSM-22995		44487619	InChI=1S/C25H33N3O4/c1-17-15-28(18(2)16-29)25(31)13-20-12-21(9-10-22(20)32-23(17)14-26-3)27-24(30)11-19-7-5-4-6-8-19/h4-10,12,17-18,23,26,29H,11,13-16H2,1-3H3,(H,27,30)/t17-,18+,23+/m1/s1	RIHRPLOFFJCHJI-STSQHVNTSA-N	CNC[C@@H]1Oc2ccc(NC(=O)Cc3ccccc3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K81647247	BRD-K81647247-001-01-6	Broad Institute of MIT and Harvard	BRD-K81647247			CNC[C@@H]1Oc2ccc(NC(=O)Cc3ccccc3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C25H33N3O4/c1-17-15-28(18(2)16-29)25(31)13-20-12-21(9-10-22(20)32-23(17)14-26-3)27-24(30)11-19-7-5-4-6-8-19/h4-10,12,17-18,23,26,29H,11,13-16H2,1-3H3,(H,27,30)/t17-,18+,23+/m1/s1	RIHRPLOFFJCHJI-STSQHVNTSA-N	439.247106566							111581
BRD-K18803930	LSM-22996		44484067	InChI=1S/C24H38N4O4/c1-16-13-28(17(2)15-29)23(30)20-12-19(10-11-21(20)32-22(16)14-27(3)4)26-24(31)25-18-8-6-5-7-9-18/h10-12,16-18,22,29H,5-9,13-15H2,1-4H3,(H2,25,26,31)/t16-,17-,22+/m0/s1	VXFJIZOVTNBNAE-PNLZDCPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K18803930	BRD-K18803930-001-01-5	Broad Institute of MIT and Harvard	BRD-K18803930			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C24H38N4O4/c1-16-13-28(17(2)15-29)23(30)20-12-19(10-11-21(20)32-22(16)14-27(3)4)26-24(31)25-18-8-6-5-7-9-18/h10-12,16-18,22,29H,5-9,13-15H2,1-4H3,(H2,25,26,31)/t16-,17-,22+/m0/s1	VXFJIZOVTNBNAE-PNLZDCPESA-N	446.289305736							111582
BRD-K98061543	LSM-22997		44485960	InChI=1S/C25H41N3O3/c1-18-14-28(19(2)17-29)25(30)22-13-21(26(3)4)11-12-23(22)31-24(18)16-27(5)15-20-9-7-6-8-10-20/h11-13,18-20,24,29H,6-10,14-17H2,1-5H3/t18-,19-,24+/m0/s1	ISZUZFSFVMPJQK-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K98061543	BRD-K98061543-001-01-2	Broad Institute of MIT and Harvard	BRD-K98061543			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H41N3O3/c1-18-14-28(19(2)17-29)25(30)22-13-21(26(3)4)11-12-23(22)31-24(18)16-27(5)15-20-9-7-6-8-10-20/h11-13,18-20,24,29H,6-10,14-17H2,1-5H3/t18-,19-,24+/m0/s1	ISZUZFSFVMPJQK-AXHZCLLHSA-N	431.314792202							111583
BRD-K49005954	LSM-22998		44485026	InChI=1S/C30H39N3O7/c1-19-14-33(20(2)17-34)30(36)23-5-4-6-24(31-29(35)22-9-11-37-12-10-22)28(23)40-27(19)16-32(3)15-21-7-8-25-26(13-21)39-18-38-25/h4-8,13,19-20,22,27,34H,9-12,14-18H2,1-3H3,(H,31,35)/t19-,20-,27-/m0/s1	NQBSYXGUJZNUSC-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K49005954	BRD-K49005954-001-01-1	Broad Institute of MIT and Harvard	BRD-K49005954			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C30H39N3O7/c1-19-14-33(20(2)17-34)30(36)23-5-4-6-24(31-29(35)22-9-11-37-12-10-22)28(23)40-27(19)16-32(3)15-21-7-8-25-26(13-21)39-18-38-25/h4-8,13,19-20,22,27,34H,9-12,14-18H2,1-3H3,(H,31,35)/t19-,20-,27-/m0/s1	NQBSYXGUJZNUSC-OSOCVKALSA-N	553.278800618							111584
BRD-K37872081	LSM-22999		44494747	InChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20-,26+/m0/s1	ODSKXFDDLKDNDM-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3c(NC(=O)C4CCCCC4)cccc3C1=O	BroadT	BRD-K37872081	BRD-K37872081-001-01-4	Broad Institute of MIT and Harvard	BRD-K37872081			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2c(NC(=O)C3CCCCC3)cccc2C1=O	InChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20-,26+/m0/s1	ODSKXFDDLKDNDM-CUVVAGTFSA-N	591.216984366							111585
BRD-K79450851	LSM-23000		44499794	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13-,17-/m0/s1	COTDYGDWXSSLGS-DCGLDWPTSA-N	CNC[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K79450851	BRD-K79450851-001-01-6	Broad Institute of MIT and Harvard	BRD-K79450851			CNC[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13-,17-/m0/s1	COTDYGDWXSSLGS-DCGLDWPTSA-N	375.215806438							111586
BRD-K69341434	LSM-23001		44500360	InChI=1S/C25H34N4O4/c1-17-14-29(18(2)16-30)24(31)13-19-12-21(10-11-22(19)33-23(17)15-28(3)4)27-25(32)26-20-8-6-5-7-9-20/h5-12,17-18,23,30H,13-16H2,1-4H3,(H2,26,27,32)/t17-,18-,23+/m1/s1	VPMPLFBICILMPX-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	BroadT	BRD-K69341434	BRD-K69341434-001-01-5	Broad Institute of MIT and Harvard	BRD-K69341434			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	InChI=1S/C25H34N4O4/c1-17-14-29(18(2)16-30)24(31)13-19-12-21(10-11-22(19)33-23(17)15-28(3)4)27-25(32)26-20-8-6-5-7-9-20/h5-12,17-18,23,30H,13-16H2,1-4H3,(H2,26,27,32)/t17-,18-,23+/m1/s1	VPMPLFBICILMPX-PNCHPQGNSA-N	454.258005608							111587
BRD-K60937893	LSM-23002		44483788	InChI=1S/C26H33F3N4O4/c1-16-13-33(17(2)15-34)24(35)20-7-6-8-21(31(3)4)23(20)37-22(16)14-32(5)25(36)30-19-11-9-18(10-12-19)26(27,28)29/h6-12,16-17,22,34H,13-15H2,1-5H3,(H,30,36)/t16-,17-,22+/m1/s1	UASMVRRVZNRGSL-YVHKJVDXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K60937893	BRD-K60937893-001-01-3	Broad Institute of MIT and Harvard	BRD-K60937893			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H33F3N4O4/c1-16-13-33(17(2)15-34)24(35)20-7-6-8-21(31(3)4)23(20)37-22(16)14-32(5)25(36)30-19-11-9-18(10-12-19)26(27,28)29/h6-12,16-17,22,34H,13-15H2,1-5H3,(H,30,36)/t16-,17-,22+/m1/s1	UASMVRRVZNRGSL-YVHKJVDXSA-N	522.245390176							111588
BRD-K21996189	LSM-23003		44495613	InChI=1S/C26H35ClN4O6S/c1-16(2)28-26(34)30(5)14-23-17(3)13-31(18(4)15-32)25(33)21-7-6-8-22(24(21)37-23)29-38(35,36)20-11-9-19(27)10-12-20/h6-12,16-18,23,29,32H,13-15H2,1-5H3,(H,28,34)/t17-,18+,23+/m1/s1	ROXPMFGZZQEKHB-STSQHVNTSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NS(=O)(=O)c3ccc(Cl)cc3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K21996189	BRD-K21996189-001-01-0	Broad Institute of MIT and Harvard	BRD-K21996189			CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NS(=O)(=O)c3ccc(Cl)cc3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H35ClN4O6S/c1-16(2)28-26(34)30(5)14-23-17(3)13-31(18(4)15-32)25(33)21-7-6-8-22(24(21)37-23)29-38(35,36)20-11-9-19(27)10-12-20/h6-12,16-18,23,29,32H,13-15H2,1-5H3,(H,28,34)/t17-,18+,23+/m1/s1	ROXPMFGZZQEKHB-STSQHVNTSA-N	566.19658328							111589
BRD-K61545233	LSM-23004		44487787	InChI=1S/C28H35F3N4O6/c1-17-14-35(18(2)16-36)26(38)22-13-20(32-25(37)11-12-28(29,30)31)7-10-23(22)41-24(17)15-34(3)27(39)33-19-5-8-21(40-4)9-6-19/h5-10,13,17-18,24,36H,11-12,14-16H2,1-4H3,(H,32,37)(H,33,39)/t17-,18+,24-/m0/s1	RKPQTFDXIVHBLJ-RHGYRFJNSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K61545233	BRD-K61545233-001-01-2	Broad Institute of MIT and Harvard	BRD-K61545233			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C28H35F3N4O6/c1-17-14-35(18(2)16-36)26(38)22-13-20(32-25(37)11-12-28(29,30)31)7-10-23(22)41-24(17)15-34(3)27(39)33-19-5-8-21(40-4)9-6-19/h5-10,13,17-18,24,36H,11-12,14-16H2,1-4H3,(H,32,37)(H,33,39)/t17-,18+,24-/m0/s1	RKPQTFDXIVHBLJ-RHGYRFJNSA-N	580.25086948							111590
BRD-K38519585	LSM-23005		44484195	InChI=1S/C27H31Cl2N3O5S2/c1-17-13-32(18(2)16-33)27(34)21-12-20(30-39(35,36)26-5-4-10-38-26)7-9-24(21)37-25(17)15-31(3)14-19-6-8-22(28)23(29)11-19/h4-12,17-18,25,30,33H,13-16H2,1-3H3/t17-,18-,25-/m0/s1	AATIEZKZMFDISZ-RPPIVITFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NS(=O)(=O)c4cccs4)cc3C1=O	BroadT	BRD-K38519585	BRD-K38519585-001-01-1	Broad Institute of MIT and Harvard	BRD-K38519585			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NS(=O)(=O)c3cccs3)cc2C1=O	InChI=1S/C27H31Cl2N3O5S2/c1-17-13-32(18(2)16-33)27(34)21-12-20(30-39(35,36)26-5-4-10-38-26)7-9-24(21)37-25(17)15-31(3)14-19-6-8-22(28)23(29)11-19/h4-12,17-18,25,30,33H,13-16H2,1-3H3/t17-,18-,25-/m0/s1	AATIEZKZMFDISZ-RPPIVITFSA-N	611.108217922							111591
BRD-K65963096	LSM-23006		44486854	InChI=1S/C22H35N3O3/c1-15-11-25(16(2)14-26)22(27)18-7-6-8-19(23(3)4)21(18)28-20(15)13-24(5)12-17-9-10-17/h6-8,15-17,20,26H,9-14H2,1-5H3/t15-,16+,20-/m1/s1	NQBYIEPUWCEMNR-GQIGUUNPSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K65963096	BRD-K65963096-001-01-9	Broad Institute of MIT and Harvard	BRD-K65963096			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C22H35N3O3/c1-15-11-25(16(2)14-26)22(27)18-7-6-8-19(23(3)4)21(18)28-20(15)13-24(5)12-17-9-10-17/h6-8,15-17,20,26H,9-14H2,1-5H3/t15-,16+,20-/m1/s1	NQBYIEPUWCEMNR-GQIGUUNPSA-N	389.26784201							111592
BRD-K00218372	LSM-23007		44486750	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)25-14-24(33-31(38)32-23-7-5-4-6-8-23)10-12-26(25)41-29(20)17-34(3)16-22-9-11-27-28(13-22)40-19-39-27/h9-14,20-21,23,29,36H,4-8,15-19H2,1-3H3,(H2,32,33,38)/t20-,21-,29+/m1/s1	WHPNVWBFVYVCKA-RLCGNTSFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)NC5CCCCC5)cc4C1=O	BroadT	BRD-K00218372	BRD-K00218372-001-01-1	Broad Institute of MIT and Harvard	BRD-K00218372			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)25-14-24(33-31(38)32-23-7-5-4-6-8-23)10-12-26(25)41-29(20)17-34(3)16-22-9-11-27-28(13-22)40-19-39-27/h9-14,20-21,23,29,36H,4-8,15-19H2,1-3H3,(H2,32,33,38)/t20-,21-,29+/m1/s1	WHPNVWBFVYVCKA-RLCGNTSFSA-N	566.310435104							111593
BRD-K28937085	LSM-23008		44501758	InChI=1S/C32H39N3O6S/c1-22-10-13-28(14-11-22)42(39,40)34(4)20-30-23(2)19-35(24(3)21-36)32(38)18-26-17-27(12-15-29(26)41-30)33-31(37)16-25-8-6-5-7-9-25/h5-15,17,23-24,30,36H,16,18-21H2,1-4H3,(H,33,37)/t23-,24-,30+/m0/s1	JFKKEIVDTMFBMW-FOUYOVOOSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K28937085	BRD-K28937085-001-01-2	Broad Institute of MIT and Harvard	BRD-K28937085			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C32H39N3O6S/c1-22-10-13-28(14-11-22)42(39,40)34(4)20-30-23(2)19-35(24(3)21-36)32(38)18-26-17-27(12-15-29(26)41-30)33-31(37)16-25-8-6-5-7-9-25/h5-15,17,23-24,30,36H,16,18-21H2,1-4H3,(H,33,37)/t23-,24-,30+/m0/s1	JFKKEIVDTMFBMW-FOUYOVOOSA-N	593.255956688							111594
BRD-K57494255-001-01-2	LSM-23009	BRD-K57494255	44504609	InChI=1S/C29H38F3N3O5/c1-19-15-35(20(2)18-36)28(38)14-22-13-23(33-27(37)11-12-29(30,31)32)7-10-25(22)40-26(19)17-34(3)16-21-5-8-24(39-4)9-6-21/h5-10,13,19-20,26,36H,11-12,14-18H2,1-4H3,(H,33,37)/t19-,20-,26-/m1/s1	IUJLOVQYFFXLDN-XMERXJNXSA-N	COc1ccc(CN(C)C[C@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K57494255	BRD-K57494255-001-01-2	Broad Institute of MIT and Harvard	BRD-K57494255			COc1ccc(CN(C)C[C@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C29H38F3N3O5/c1-19-15-35(20(2)18-36)28(38)14-22-13-23(33-27(37)11-12-29(30,31)32)7-10-25(22)40-26(19)17-34(3)16-21-5-8-24(39-4)9-6-21/h5-10,13,19-20,26,36H,11-12,14-18H2,1-4H3,(H,33,37)/t19-,20-,26-/m1/s1	IUJLOVQYFFXLDN-XMERXJNXSA-N	565.276355946							111595
MLS002474370	LSM-23010	BRD-K82157325, SID85200901	44202021	InChI=1S/C31H43N5O6/c1-20-17-36(21(2)19-37)29(38)26-16-24(33-30(39)32-23-10-13-25(41-4)14-11-23)12-15-27(26)42-28(20)18-35(3)31(40)34-22-8-6-5-7-9-22/h10-16,20-22,28,37H,5-9,17-19H2,1-4H3,(H,34,40)(H2,32,33,39)/t20-,21+,28+/m0/s1	RJROVUFZJIAJHT-BALWLHIASA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)C(=O)NC4CCCCC4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K82157325	BRD-K82157325-001-02-8	Broad Institute of MIT and Harvard	BRD-K82157325			COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)C(=O)NC4CCCCC4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H43N5O6/c1-20-17-36(21(2)19-37)29(38)26-16-24(33-30(39)32-23-10-13-25(41-4)14-11-23)12-15-27(26)42-28(20)18-35(3)31(40)34-22-8-6-5-7-9-22/h10-16,20-22,28,37H,5-9,17-19H2,1-4H3,(H,34,40)(H2,32,33,39)/t20-,21+,28+/m0/s1	RJROVUFZJIAJHT-BALWLHIASA-N	581.321334146							111596
BRD-K23703519	LSM-23011		44486030	InChI=1S/C30H41F3N4O4/c1-20-16-37(21(2)19-38)29(40)25-15-24(34-28(39)7-6-14-35(3)4)12-13-26(25)41-27(20)18-36(5)17-22-8-10-23(11-9-22)30(31,32)33/h8-13,15,20-21,27,38H,6-7,14,16-19H2,1-5H3,(H,34,39)/t20-,21+,27-/m0/s1	DDFOXWCTSAMXEO-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K23703519	BRD-K23703519-001-01-9	Broad Institute of MIT and Harvard	BRD-K23703519			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C30H41F3N4O4/c1-20-16-37(21(2)19-38)29(40)25-15-24(34-28(39)7-6-14-35(3)4)12-13-26(25)41-27(20)18-36(5)17-22-8-10-23(11-9-22)30(31,32)33/h8-13,15,20-21,27,38H,6-7,14,16-19H2,1-5H3,(H,34,39)/t20-,21+,27-/m0/s1	DDFOXWCTSAMXEO-ISCCLHIJSA-N	578.307990432							111597
BRD-K94223846	LSM-23012		44499553	InChI=1S/C30H35N5O6/c1-19-16-35(20(2)18-36)29(38)24-6-5-7-25(33-28(37)21-12-14-31-15-13-21)27(24)41-26(19)17-34(3)30(39)32-22-8-10-23(40-4)11-9-22/h5-15,19-20,26,36H,16-18H2,1-4H3,(H,32,39)(H,33,37)/t19-,20+,26-/m1/s1	YPMOLAXPZMKSMS-BVFVYWQFSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3c(NC(=O)c4ccncc4)cccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K94223846	BRD-K94223846-001-01-6	Broad Institute of MIT and Harvard	BRD-K94223846			COc1ccc(NC(=O)N(C)C[C@H]2Oc3c(NC(=O)c4ccncc4)cccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C30H35N5O6/c1-19-16-35(20(2)18-36)29(38)24-6-5-7-25(33-28(37)21-12-14-31-15-13-21)27(24)41-26(19)17-34(3)30(39)32-22-8-10-23(40-4)11-9-22/h5-15,19-20,26,36H,16-18H2,1-4H3,(H,32,39)(H,33,37)/t19-,20+,26-/m1/s1	YPMOLAXPZMKSMS-BVFVYWQFSA-N	561.25873389							111598
BRD-K00793226	LSM-23013		44486860	InChI=1S/C18H29N3O3/c1-12-10-21(13(2)11-22)18(23)14-7-6-8-15(20(4)5)17(14)24-16(12)9-19-3/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13-,16-/m1/s1	XJHVRUWFSLOUIR-XJKCOSOUSA-N	CNC[C@H]1Oc2c(cccc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K00793226	BRD-K00793226-001-01-1	Broad Institute of MIT and Harvard	BRD-K00793226			CNC[C@H]1Oc2c(cccc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C18H29N3O3/c1-12-10-21(13(2)11-22)18(23)14-7-6-8-15(20(4)5)17(14)24-16(12)9-19-3/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13-,16-/m1/s1	XJHVRUWFSLOUIR-XJKCOSOUSA-N	335.220891818							111599
CHEMBL2362470	LSM-23014	BRD-K57821544, SID85799648	44492917	InChI=1S/C35H43N3O6/c1-24-20-38(25(2)23-39)35(41)30-10-7-11-31(36-34(40)27-16-18-42-19-17-27)33(30)44-32(24)22-37(3)21-26-12-14-29(15-13-26)43-28-8-5-4-6-9-28/h4-15,24-25,27,32,39H,16-23H2,1-3H3,(H,36,40)/t24-,25+,32+/m0/s1	CCYKTEMVMBOJBS-BRUQSJHLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K57821544	BRD-K57821544-001-01-7	Broad Institute of MIT and Harvard	BRD-K57821544			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C35H43N3O6/c1-24-20-38(25(2)23-39)35(41)30-10-7-11-31(36-34(40)27-16-18-42-19-17-27)33(30)44-32(24)22-37(3)21-26-12-14-29(15-13-26)43-28-8-5-4-6-9-28/h4-15,24-25,27,32,39H,16-23H2,1-3H3,(H,36,40)/t24-,25+,32+/m0/s1	CCYKTEMVMBOJBS-BRUQSJHLSA-N	601.315186126							111600
BRD-K09178604	LSM-23015		44493255	InChI=1S/C24H33N3O5S/c1-17-14-27(18(2)16-28)24(29)21-13-19(25(3)4)11-12-22(21)32-23(17)15-26(5)33(30,31)20-9-7-6-8-10-20/h6-13,17-18,23,28H,14-16H2,1-5H3/t17-,18+,23-/m0/s1	ZRFMJOMCDWKIOJ-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K09178604	BRD-K09178604-001-01-8	Broad Institute of MIT and Harvard	BRD-K09178604			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C24H33N3O5S/c1-17-14-27(18(2)16-28)24(29)21-13-19(25(3)4)11-12-22(21)32-23(17)15-26(5)33(30,31)20-9-7-6-8-10-20/h6-13,17-18,23,28H,14-16H2,1-5H3/t17-,18+,23-/m0/s1	ZRFMJOMCDWKIOJ-IXFSTUDKSA-N	475.214091876							111601
BRD-K49946792	LSM-23016		44499023	InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)17-8-7-9-18(24(3)4)21(17)32-19(15)11-26(6)33(30,31)20-12-25(5)14-23-20/h7-9,12,14-16,19,28H,10-11,13H2,1-6H3/t15-,16-,19-/m1/s1	NFFRJINEVFDSRM-GPMSIDNRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K49946792	BRD-K49946792-001-01-2	Broad Institute of MIT and Harvard	BRD-K49946792			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)17-8-7-9-18(24(3)4)21(17)32-19(15)11-26(6)33(30,31)20-12-25(5)14-23-20/h7-9,12,14-16,19,28H,10-11,13H2,1-6H3/t15-,16-,19-/m1/s1	NFFRJINEVFDSRM-GPMSIDNRSA-N	479.220239896							111602
CHEMBL3182638	LSM-23017	BRD-K07486034	44490784	InChI=1S/C26H33F3N4O4/c1-16-13-33(17(2)15-34)24(35)20-7-6-8-21(31(3)4)23(20)37-22(16)14-32(5)25(36)30-19-11-9-18(10-12-19)26(27,28)29/h6-12,16-17,22,34H,13-15H2,1-5H3,(H,30,36)/t16-,17-,22-/m1/s1	UASMVRRVZNRGSL-DRSNIGMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K07486034	BRD-K07486034-001-01-7	Broad Institute of MIT and Harvard	BRD-K07486034			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H33F3N4O4/c1-16-13-33(17(2)15-34)24(35)20-7-6-8-21(31(3)4)23(20)37-22(16)14-32(5)25(36)30-19-11-9-18(10-12-19)26(27,28)29/h6-12,16-17,22,34H,13-15H2,1-5H3,(H,30,36)/t16-,17-,22-/m1/s1	UASMVRRVZNRGSL-DRSNIGMVSA-N	522.245390176							111603
BRD-K08803817	LSM-23018		44496349	InChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20+,25-/m1/s1	LNIIROWVVFKABQ-OHUGHZGNSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K08803817	BRD-K08803817-001-01-5	Broad Institute of MIT and Harvard	BRD-K08803817			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20+,25-/m1/s1	LNIIROWVVFKABQ-OHUGHZGNSA-N	546.251205666							111604
BRD-K93875187	LSM-23019		44490761	InChI=1S/C19H31N3O3/c1-13-10-22(14(2)12-23)19(24)16-9-15(21(5)6)7-8-17(16)25-18(13)11-20(3)4/h7-9,13-14,18,23H,10-12H2,1-6H3/t13-,14-,18-/m0/s1	WTLSFXRNHZPOMH-DEYYWGMASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K93875187	BRD-K93875187-001-01-1	Broad Institute of MIT and Harvard	BRD-K93875187			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C19H31N3O3/c1-13-10-22(14(2)12-23)19(24)16-9-15(21(5)6)7-8-17(16)25-18(13)11-20(3)4/h7-9,13-14,18,23H,10-12H2,1-6H3/t13-,14-,18-/m0/s1	WTLSFXRNHZPOMH-DEYYWGMASA-N	349.236541882							111605
BRD-K79199168	LSM-23020		44491392	InChI=1S/C33H40N4O6/c1-21-18-37(22(2)20-38)32(40)26-11-7-13-28(34-31(39)24-14-16-42-17-15-24)30(26)43-29(21)19-36(3)33(41)35-27-12-6-9-23-8-4-5-10-25(23)27/h4-13,21-22,24,29,38H,14-20H2,1-3H3,(H,34,39)(H,35,41)/t21-,22-,29-/m1/s1	XPBUGQRVLIPCFW-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K79199168	BRD-K79199168-001-01-7	Broad Institute of MIT and Harvard	BRD-K79199168			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C33H40N4O6/c1-21-18-37(22(2)20-38)32(40)26-11-7-13-28(34-31(39)24-14-16-42-17-15-24)30(26)43-29(21)19-36(3)33(41)35-27-12-6-9-23-8-4-5-10-25(23)27/h4-13,21-22,24,29,38H,14-20H2,1-3H3,(H,34,39)(H,35,41)/t21-,22-,29-/m1/s1	XPBUGQRVLIPCFW-IEOSBIPESA-N	588.29478504							111606
CHEMBL2355121	LSM-15036	BRD-K46176518, SID85804379	44497487	InChI=1S/C28H39N5O4/c1-19-15-33(20(2)18-34)28(36)22-10-7-11-23(31-27(35)24-14-29-12-13-30-24)26(22)37-25(19)17-32(3)16-21-8-5-4-6-9-21/h7,10-14,19-21,25,34H,4-6,8-9,15-18H2,1-3H3,(H,31,35)/t19-,20+,25-/m0/s1	QUBNYOYZPRCGDK-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K46176518	BRD-K46176518-001-01-2	Broad Institute of MIT and Harvard	BRD-K46176518			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H39N5O4/c1-19-15-33(20(2)18-34)28(36)22-10-7-11-23(31-27(35)24-14-29-12-13-30-24)26(22)37-25(19)17-32(3)16-21-8-5-4-6-9-21/h7,10-14,19-21,25,34H,4-6,8-9,15-18H2,1-3H3,(H,31,35)/t19-,20+,25-/m0/s1	QUBNYOYZPRCGDK-DFIYOIEZSA-N	509.300204778							103692
BRD-K30019337	LSM-23021		44486093	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16-,20-/m1/s1	GIKJWVQVMSIYNX-JXXFODFXSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K30019337	BRD-K30019337-001-01-1	Broad Institute of MIT and Harvard	BRD-K30019337			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16-,20-/m1/s1	GIKJWVQVMSIYNX-JXXFODFXSA-N	420.273655672							111607
BRD-K42712172	LSM-23022		44492883	InChI=1S/C24H33N3O5S/c1-17-14-27(18(2)16-28)24(29)21-13-19(25(3)4)11-12-22(21)32-23(17)15-26(5)33(30,31)20-9-7-6-8-10-20/h6-13,17-18,23,28H,14-16H2,1-5H3/t17-,18-,23-/m0/s1	ZRFMJOMCDWKIOJ-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K42712172	BRD-K42712172-001-01-5	Broad Institute of MIT and Harvard	BRD-K42712172			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C24H33N3O5S/c1-17-14-27(18(2)16-28)24(29)21-13-19(25(3)4)11-12-22(21)32-23(17)15-26(5)33(30,31)20-9-7-6-8-10-20/h6-13,17-18,23,28H,14-16H2,1-5H3/t17-,18-,23-/m0/s1	ZRFMJOMCDWKIOJ-BSRJHKFKSA-N	475.214091876							111608
BRD-K54420800	LSM-23023		44484999	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14-,18-/m1/s1	TWHSADQACYCNBZ-HBUWYVDXSA-N	CNC[C@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K54420800	BRD-K54420800-001-01-0	Broad Institute of MIT and Harvard	BRD-K54420800			CNC[C@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14-,18-/m1/s1	TWHSADQACYCNBZ-HBUWYVDXSA-N	413.206304394							111609
BRD-K41206520	LSM-23024		44490623	InChI=1S/C31H43N3O4/c1-22-18-34(23(2)21-35)31(37)27-17-26(32-30(36)16-24-10-6-4-7-11-24)14-15-28(27)38-29(22)20-33(3)19-25-12-8-5-9-13-25/h4,6-7,10-11,14-15,17,22-23,25,29,35H,5,8-9,12-13,16,18-21H2,1-3H3,(H,32,36)/t22-,23+,29-/m0/s1	WNQBBBBVHQGMNA-CTWZREHQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K41206520	BRD-K41206520-001-01-8	Broad Institute of MIT and Harvard	BRD-K41206520			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H43N3O4/c1-22-18-34(23(2)21-35)31(37)27-17-26(32-30(36)16-24-10-6-4-7-11-24)14-15-28(27)38-29(22)20-33(3)19-25-12-8-5-9-13-25/h4,6-7,10-11,14-15,17,22-23,25,29,35H,5,8-9,12-13,16,18-21H2,1-3H3,(H,32,36)/t22-,23+,29-/m0/s1	WNQBBBBVHQGMNA-CTWZREHQSA-N	521.325356886							111610
BRD-K64047585	LSM-23025		44485647	InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)23-13-9-15-25(31(3)4)27(23)37-26(19)17-32(5)29(36)30-24-14-8-11-21-10-6-7-12-22(21)24/h6-15,19-20,26,34H,16-18H2,1-5H3,(H,30,36)/t19-,20-,26-/m1/s1	QINKYHPKCUNNMN-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K64047585	BRD-K64047585-001-01-0	Broad Institute of MIT and Harvard	BRD-K64047585			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)23-13-9-15-25(31(3)4)27(23)37-26(19)17-32(5)29(36)30-24-14-8-11-21-10-6-7-12-22(21)24/h6-15,19-20,26,34H,16-18H2,1-5H3,(H,30,36)/t19-,20-,26-/m1/s1	QINKYHPKCUNNMN-XMERXJNXSA-N	504.273655672							111611
BRD-K29039402	LSM-23026		44498851	InChI=1S/C31H42N4O6/c1-20-17-35(21(2)19-36)30(38)25-11-8-12-26(33-29(37)22-9-6-5-7-10-22)28(25)41-27(20)18-34(3)31(39)32-23-13-15-24(40-4)16-14-23/h8,11-16,20-22,27,36H,5-7,9-10,17-19H2,1-4H3,(H,32,39)(H,33,37)/t20-,21-,27-/m0/s1	LSKFJJLXCXBANC-IZVMNLJQSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3c(NC(=O)C4CCCCC4)cccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K29039402	BRD-K29039402-001-01-2	Broad Institute of MIT and Harvard	BRD-K29039402			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3c(NC(=O)C4CCCCC4)cccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H42N4O6/c1-20-17-35(21(2)19-36)30(38)25-11-8-12-26(33-29(37)22-9-6-5-7-10-22)28(25)41-27(20)18-34(3)31(39)32-23-13-15-24(40-4)16-14-23/h8,11-16,20-22,27,36H,5-7,9-10,17-19H2,1-4H3,(H,32,39)(H,33,37)/t20-,21-,27-/m0/s1	LSKFJJLXCXBANC-IZVMNLJQSA-N	566.310435104							111612
BRD-K76426411	LSM-23027		44493485	InChI=1S/C27H38N4O4/c1-18(2)28-27(34)29-23-13-9-12-22-25(23)35-24(16-30(5)15-21-10-7-6-8-11-21)19(3)14-31(26(22)33)20(4)17-32/h6-13,18-20,24,32H,14-17H2,1-5H3,(H2,28,29,34)/t19-,20+,24-/m1/s1	NCIZYGIVVKAPIW-JXALWOEJSA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@@H](C)[C@@H](CN(C)Cc3ccccc3)Oc12)[C@@H](C)CO	BroadT	BRD-K76426411	BRD-K76426411-001-01-2	Broad Institute of MIT and Harvard	BRD-K76426411			CC(C)NC(=O)Nc1cccc2c1O[C@H](CN(C)Cc1ccccc1)[C@H](C)CN([C@@H](C)CO)C2=O	InChI=1S/C27H38N4O4/c1-18(2)28-27(34)29-23-13-9-12-22-25(23)35-24(16-30(5)15-21-10-7-6-8-11-21)19(3)14-31(26(22)33)20(4)17-32/h6-13,18-20,24,32H,14-17H2,1-5H3,(H2,28,29,34)/t19-,20+,24-/m1/s1	NCIZYGIVVKAPIW-JXALWOEJSA-N	482.289305736							111613
BRD-K97617600	LSM-23028		44485431	InChI=1S/C20H28F3N3O4/c1-12-10-26(13(2)11-27)19(29)15-8-14(25-18(28)6-7-20(21,22)23)4-5-16(15)30-17(12)9-24-3/h4-5,8,12-13,17,24,27H,6-7,9-11H2,1-3H3,(H,25,28)/t12-,13+,17-/m1/s1	MJOLMSVGHZLLLZ-IIYDPXPESA-N	CNC[C@H]1Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K97617600	BRD-K97617600-001-01-2	Broad Institute of MIT and Harvard	BRD-K97617600			CNC[C@H]1Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C20H28F3N3O4/c1-12-10-26(13(2)11-27)19(29)15-8-14(25-18(28)6-7-20(21,22)23)4-5-16(15)30-17(12)9-24-3/h4-5,8,12-13,17,24,27H,6-7,9-11H2,1-3H3,(H,25,28)/t12-,13+,17-/m1/s1	MJOLMSVGHZLLLZ-IIYDPXPESA-N	431.203191006							111614
BRD-K97410356	LSM-23029		44486687	InChI=1S/C27H41N3O4/c1-18-14-30(19(2)17-31)27(33)23-13-22(28-26(32)21-9-10-21)11-12-24(23)34-25(18)16-29(3)15-20-7-5-4-6-8-20/h11-13,18-21,25,31H,4-10,14-17H2,1-3H3,(H,28,32)/t18-,19+,25-/m1/s1	RZKDUVXCVDUJNN-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)C4CC4)cc3C1=O	BroadT	BRD-K97410356	BRD-K97410356-001-01-8	Broad Institute of MIT and Harvard	BRD-K97410356			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)C3CC3)cc2C1=O	InChI=1S/C27H41N3O4/c1-18-14-30(19(2)17-31)27(33)23-13-22(28-26(32)21-9-10-21)11-12-24(23)34-25(18)16-29(3)15-20-7-5-4-6-8-20/h11-13,18-21,25,31H,4-10,14-17H2,1-3H3,(H,28,32)/t18-,19+,25-/m1/s1	RZKDUVXCVDUJNN-HHJKRLRDSA-N	471.309706822							111615
BRD-K88795207	LSM-23030		44486886	InChI=1S/C30H42ClN3O5S/c1-21-17-34(22(2)20-35)30(36)16-24-15-26(32-40(37,38)27-12-9-25(31)10-13-27)11-14-28(24)39-29(21)19-33(3)18-23-7-5-4-6-8-23/h9-15,21-23,29,32,35H,4-8,16-20H2,1-3H3/t21-,22-,29-/m1/s1	YELAEPJECDEDIZ-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3CC1=O	BroadT	BRD-K88795207	BRD-K88795207-001-01-4	Broad Institute of MIT and Harvard	BRD-K88795207			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2CC1=O	InChI=1S/C30H42ClN3O5S/c1-21-17-34(22(2)20-35)30(36)16-24-15-26(32-40(37,38)27-12-9-25(31)10-13-27)11-14-28(24)39-29(21)19-33(3)18-23-7-5-4-6-8-23/h9-15,21-23,29,32,35H,4-8,16-20H2,1-3H3/t21-,22-,29-/m1/s1	YELAEPJECDEDIZ-IEOSBIPESA-N	591.253369874							111616
BRD-K13052191	LSM-23031	BRD-K13052191		InChI=1S/C27H37N3O5S/c1-18-8-12-22(13-9-18)36(33,34)28-24-7-5-6-23-26(24)35-25(16-29(4)15-21-10-11-21)19(2)14-30(27(23)32)20(3)17-31/h5-9,12-13,19-21,25,28,31H,10-11,14-17H2,1-4H3/t19-,20+,25-/m1/s1	WCCXVJAFWRLDGB-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3c(NS(=O)(=O)c4ccc(C)cc4)cccc3C1=O	BroadT	BRD-K13052191	BRD-K13052191-001-01-8	Broad Institute of MIT and Harvard	BRD-K13052191			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2c(NS(=O)(=O)c3ccc(C)cc3)cccc2C1=O	InChI=1S/C27H37N3O5S/c1-18-8-12-22(13-9-18)36(33,34)28-24-7-5-6-23-26(24)35-25(16-29(4)15-21-10-11-21)19(2)14-30(27(23)32)20(3)17-31/h5-9,12-13,19-21,25,28,31H,10-11,14-17H2,1-4H3/t19-,20+,25-/m1/s1	WCCXVJAFWRLDGB-OHUGHZGNSA-N	515.245392004							111617
BRD-K71184289	LSM-23032		44485899	InChI=1S/C25H33FN4O4/c1-16-13-30(17(2)15-31)24(32)21-12-20(28(3)4)10-11-22(21)34-23(16)14-29(5)25(33)27-19-8-6-18(26)7-9-19/h6-12,16-17,23,31H,13-15H2,1-5H3,(H,27,33)/t16-,17-,23+/m0/s1	FXKMHYTYNRWQSP-HKARXFIJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K71184289	BRD-K71184289-001-01-1	Broad Institute of MIT and Harvard	BRD-K71184289			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H33FN4O4/c1-16-13-30(17(2)15-31)24(32)21-12-20(28(3)4)10-11-22(21)34-23(16)14-29(5)25(33)27-19-8-6-18(26)7-9-19/h6-12,16-17,23,31H,13-15H2,1-5H3,(H,27,33)/t16-,17-,23+/m0/s1	FXKMHYTYNRWQSP-HKARXFIJSA-N	472.248583776							111618
BRD-K44845847	LSM-23033		44487160	InChI=1S/C28H38N4O6/c1-17(2)29-28(37)30-22-10-11-24-23(12-22)26(34)32(19(4)16-33)13-18(3)25(38-24)15-31(5)14-20-6-8-21(9-7-20)27(35)36/h6-12,17-19,25,33H,13-16H2,1-5H3,(H,35,36)(H2,29,30,37)/t18-,19-,25+/m0/s1	IVCWXLSTMUVHLA-XHNVNVPESA-N	CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K44845847	BRD-K44845847-001-01-6	Broad Institute of MIT and Harvard	BRD-K44845847			CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H38N4O6/c1-17(2)29-28(37)30-22-10-11-24-23(12-22)26(34)32(19(4)16-33)13-18(3)25(38-24)15-31(5)14-20-6-8-21(9-7-20)27(35)36/h6-12,17-19,25,33H,13-16H2,1-5H3,(H,35,36)(H2,29,30,37)/t18-,19-,25+/m0/s1	IVCWXLSTMUVHLA-XHNVNVPESA-N	526.279134976							111619
MLS002473905	LSM-23034	SID85201432, BRD-K94191869	44202516	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17-,22+/m0/s1	FXDXYRRSNQUVQL-PNLZDCPESA-N	CNC[C@H]1Oc2c(NC(=O)c3ccc(cc3)c4nccs4)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K94191869	BRD-K94191869-001-01-7	Broad Institute of MIT and Harvard	BRD-K94191869			CNC[C@H]1Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17-,22+/m0/s1	FXDXYRRSNQUVQL-PNLZDCPESA-N	494.19877617							111620
BRD-K71919076	LSM-23035		44493856	InChI=1S/C27H41N3O4/c1-18-14-30(19(2)17-31)27(33)23-13-22(28-26(32)21-9-10-21)11-12-24(23)34-25(18)16-29(3)15-20-7-5-4-6-8-20/h11-13,18-21,25,31H,4-10,14-17H2,1-3H3,(H,28,32)/t18-,19-,25-/m0/s1	RZKDUVXCVDUJNN-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)C4CC4)cc3C1=O	BroadT	BRD-K71919076	BRD-K71919076-001-01-7	Broad Institute of MIT and Harvard	BRD-K71919076			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)C3CC3)cc2C1=O	InChI=1S/C27H41N3O4/c1-18-14-30(19(2)17-31)27(33)23-13-22(28-26(32)21-9-10-21)11-12-24(23)34-25(18)16-29(3)15-20-7-5-4-6-8-20/h11-13,18-21,25,31H,4-10,14-17H2,1-3H3,(H,28,32)/t18-,19-,25-/m0/s1	RZKDUVXCVDUJNN-MHPIHPPYSA-N	471.309706822							111621
BRD-K49635910	LSM-23036		44491326	InChI=1S/C26H33F3N4O4/c1-16-13-33(17(2)15-34)24(35)20-7-6-8-21(31(3)4)23(20)37-22(16)14-32(5)25(36)30-19-11-9-18(10-12-19)26(27,28)29/h6-12,16-17,22,34H,13-15H2,1-5H3,(H,30,36)/t16-,17+,22-/m1/s1	UASMVRRVZNRGSL-HYFFOGBASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K49635910	BRD-K49635910-001-01-8	Broad Institute of MIT and Harvard	BRD-K49635910			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H33F3N4O4/c1-16-13-33(17(2)15-34)24(35)20-7-6-8-21(31(3)4)23(20)37-22(16)14-32(5)25(36)30-19-11-9-18(10-12-19)26(27,28)29/h6-12,16-17,22,34H,13-15H2,1-5H3,(H,30,36)/t16-,17+,22-/m1/s1	UASMVRRVZNRGSL-HYFFOGBASA-N	522.245390176							111622
BRD-K05417183	LSM-23037		44489208	InChI=1S/C26H33F3N4O6S/c1-16-13-33(17(2)15-34)24(35)12-18-11-21(31-40(4,37)38)9-10-22(18)39-23(16)14-32(3)25(36)30-20-7-5-19(6-8-20)26(27,28)29/h5-11,16-17,23,31,34H,12-15H2,1-4H3,(H,30,36)/t16-,17+,23-/m0/s1	ULBVSTNRUTTXDI-MFEFFIJZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ccc(NS(=O)(=O)C)cc3CC1=O	BroadT	BRD-K05417183	BRD-K05417183-001-01-3	Broad Institute of MIT and Harvard	BRD-K05417183			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ccc(NS(C)(=O)=O)cc2CC1=O	InChI=1S/C26H33F3N4O6S/c1-16-13-33(17(2)15-34)24(35)12-18-11-21(31-40(4,37)38)9-10-22(18)39-23(16)14-32(3)25(36)30-20-7-5-19(6-8-20)26(27,28)29/h5-11,16-17,23,31,34H,12-15H2,1-4H3,(H,30,36)/t16-,17+,23-/m0/s1	ULBVSTNRUTTXDI-MFEFFIJZSA-N	586.207290106							111623
BRD-K53772256	LSM-23038		44492874	InChI=1S/C29H39FN4O7S/c1-20-17-34(21(2)19-35)29(37)25-16-23(31-28(36)10-11-33-12-14-40-15-13-33)6-9-26(25)41-27(20)18-32(3)42(38,39)24-7-4-22(30)5-8-24/h4-9,16,20-21,27,35H,10-15,17-19H2,1-3H3,(H,31,36)/t20-,21-,27-/m0/s1	NKFYFMCKJSWXRC-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)CCN4CCOCC4)cc3C1=O	BroadT	BRD-K53772256	BRD-K53772256-001-01-4	Broad Institute of MIT and Harvard	BRD-K53772256			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2C1=O	InChI=1S/C29H39FN4O7S/c1-20-17-34(21(2)19-35)29(37)25-16-23(31-28(36)10-11-33-12-14-40-15-13-33)6-9-26(25)41-27(20)18-32(3)42(38,39)24-7-4-22(30)5-8-24/h4-9,16,20-21,27,35H,10-15,17-19H2,1-3H3,(H,31,36)/t20-,21-,27-/m0/s1	NKFYFMCKJSWXRC-IZVMNLJQSA-N	606.252348518							111624
BRD-K41241300	LSM-23039		44486112	InChI=1S/C35H38N4O5/c1-24-20-39(25(2)23-40)35(42)31-19-28(37-34(41)27-15-17-36-18-16-27)11-14-32(31)44-33(24)22-38(3)21-26-9-12-30(13-10-26)43-29-7-5-4-6-8-29/h4-19,24-25,33,40H,20-23H2,1-3H3,(H,37,41)/t24-,25-,33-/m0/s1	NYKHOXZKFLRULB-TZNXZYKKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(NC(=O)c5ccncc5)cc4C1=O	BroadT	BRD-K41241300	BRD-K41241300-001-01-1	Broad Institute of MIT and Harvard	BRD-K41241300			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H38N4O5/c1-24-20-39(25(2)23-40)35(42)31-19-28(37-34(41)27-15-17-36-18-16-27)11-14-32(31)44-33(24)22-38(3)21-26-9-12-30(13-10-26)43-29-7-5-4-6-8-29/h4-19,24-25,33,40H,20-23H2,1-3H3,(H,37,41)/t24-,25-,33-/m0/s1	NYKHOXZKFLRULB-TZNXZYKKSA-N	594.284220356							111625
BRD-K71472853	LSM-23040		44495859	InChI=1S/C30H37N5O7/c1-17-12-35(18(2)15-36)29(37)22-7-6-8-23(31-30(38)32-27-19(3)33-42-20(27)4)28(22)41-26(17)14-34(5)13-21-9-10-24-25(11-21)40-16-39-24/h6-11,17-18,26,36H,12-16H2,1-5H3,(H2,31,32,38)/t17-,18+,26-/m1/s1	ROWKUSIEMFYXMA-FIAZIHOUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)Nc5c(C)onc5C)cccc4C1=O	BroadT	BRD-K71472853	BRD-K71472853-001-01-6	Broad Institute of MIT and Harvard	BRD-K71472853			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C1=O	InChI=1S/C30H37N5O7/c1-17-12-35(18(2)15-36)29(37)22-7-6-8-23(31-30(38)32-27-19(3)33-42-20(27)4)28(22)41-26(17)14-34(5)13-21-9-10-24-25(11-21)40-16-39-24/h6-11,17-18,26,36H,12-16H2,1-5H3,(H2,31,32,38)/t17-,18+,26-/m1/s1	ROWKUSIEMFYXMA-FIAZIHOUSA-N	579.269298574							111626
CHEMBL2131059	LSM-23041	BRD-K88141157, SID85806022	44499057	InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)17-8-7-9-18(24(3)4)21(17)32-19(15)11-26(6)33(30,31)20-12-25(5)14-23-20/h7-9,12,14-16,19,28H,10-11,13H2,1-6H3/t15-,16+,19+/m0/s1	NFFRJINEVFDSRM-FRQCXROJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K88141157	BRD-K88141157-001-02-9	Broad Institute of MIT and Harvard	BRD-K88141157			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)17-8-7-9-18(24(3)4)21(17)32-19(15)11-26(6)33(30,31)20-12-25(5)14-23-20/h7-9,12,14-16,19,28H,10-11,13H2,1-6H3/t15-,16+,19+/m0/s1	NFFRJINEVFDSRM-FRQCXROJSA-N	479.220239896							111627
BRD-K03201037	LSM-23042		44500363	InChI=1S/C33H40N4O6/c1-22-19-37(23(2)21-38)32(40)18-25-17-27(34-31(39)16-24-8-6-5-7-9-24)12-15-29(25)43-30(22)20-36(3)33(41)35-26-10-13-28(42-4)14-11-26/h5-15,17,22-23,30,38H,16,18-21H2,1-4H3,(H,34,39)(H,35,41)/t22-,23-,30+/m1/s1	CGYYYKYOQGTOJG-JWUQWVJQSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)Cc4ccccc4)cc3CC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K03201037	BRD-K03201037-001-01-1	Broad Institute of MIT and Harvard	BRD-K03201037			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)Cc4ccccc4)cc3CC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C33H40N4O6/c1-22-19-37(23(2)21-38)32(40)18-25-17-27(34-31(39)16-24-8-6-5-7-9-24)12-15-29(25)43-30(22)20-36(3)33(41)35-26-10-13-28(42-4)14-11-26/h5-15,17,22-23,30,38H,16,18-21H2,1-4H3,(H,34,39)(H,35,41)/t22-,23-,30+/m1/s1	CGYYYKYOQGTOJG-JWUQWVJQSA-N	588.29478504							111628
BRD-K41700289	LSM-23043		44498004	InChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20-,26-/m1/s1	ODSKXFDDLKDNDM-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3c(NC(=O)C4CCCCC4)cccc3C1=O	BroadT	BRD-K41700289	BRD-K41700289-001-01-1	Broad Institute of MIT and Harvard	BRD-K41700289			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2c(NC(=O)C3CCCCC3)cccc2C1=O	InChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20-,26-/m1/s1	ODSKXFDDLKDNDM-XMERXJNXSA-N	591.216984366							111629
CHEMBL2357670	LSM-23044	BRD-K61407677, SID85794270	44487791	InChI=1S/C35H38N4O6/c1-22-17-39(23(2)20-40)34(41)28-16-26(36-35(42)37-29-10-6-8-25-7-4-5-9-27(25)29)12-14-30(28)45-33(22)19-38(3)18-24-11-13-31-32(15-24)44-21-43-31/h4-16,22-23,33,40H,17-21H2,1-3H3,(H2,36,37,42)/t22-,23+,33-/m0/s1	MDVGURPVGABTFV-KVSUUNMHSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)Nc5cccc6ccccc56)cc4C1=O	BroadT	BRD-K61407677	BRD-K61407677-001-01-8	Broad Institute of MIT and Harvard	BRD-K61407677			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C35H38N4O6/c1-22-17-39(23(2)20-40)34(41)28-16-26(36-35(42)37-29-10-6-8-25-7-4-5-9-27(25)29)12-14-30(28)45-33(22)19-38(3)18-24-11-13-31-32(15-24)44-21-43-31/h4-16,22-23,33,40H,17-21H2,1-3H3,(H2,36,37,42)/t22-,23+,33-/m0/s1	MDVGURPVGABTFV-KVSUUNMHSA-N	610.279134976							111630
BRD-K98739117	LSM-23045		44499442	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18-,24-/m0/s1	JIVQHRCMRGEILI-XFAGBWLFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3c(NC(=O)C4CC4)cccc3C1=O	BroadT	BRD-K98739117	BRD-K98739117-001-01-9	Broad Institute of MIT and Harvard	BRD-K98739117			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2c(NC(=O)C3CC3)cccc2C1=O	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18-,24-/m0/s1	JIVQHRCMRGEILI-XFAGBWLFSA-N	509.25258587							111631
CHEMBL2356693	LSM-6781	BRD-K23282736, SID85813528	44506420	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)26-16-25(35(3)4)14-15-29(26)41-30(21)19-36(5)18-23-10-12-24(13-11-23)31(39)34-28-9-7-6-8-27(28)33/h6-16,21-22,30,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,30-/m0/s1	QVMJLFZOFFUGMH-PWWNZBMUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K23282736	BRD-K23282736-001-01-1	Broad Institute of MIT and Harvard	BRD-K23282736			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)26-16-25(35(3)4)14-15-29(26)41-30(21)19-36(5)18-23-10-12-24(13-11-23)31(39)34-28-9-7-6-8-27(28)33/h6-16,21-22,30,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,30-/m0/s1	QVMJLFZOFFUGMH-PWWNZBMUSA-N	559.315854842							95402
BRD-K25512608	LSM-23046		44483441	InChI=1S/C26H32FN3O6S/c1-16-13-30(17(2)15-31)26(33)22-12-20(28-25(32)18-4-5-18)8-11-23(22)36-24(16)14-29(3)37(34,35)21-9-6-19(27)7-10-21/h6-12,16-18,24,31H,4-5,13-15H2,1-3H3,(H,28,32)/t16-,17-,24+/m1/s1	AVAQDGZIUQEYTO-OJLQRUNKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)C4CC4)cc3C1=O	BroadT	BRD-K25512608	BRD-K25512608-001-01-4	Broad Institute of MIT and Harvard	BRD-K25512608			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)C3CC3)cc2C1=O	InChI=1S/C26H32FN3O6S/c1-16-13-30(17(2)15-31)26(33)22-12-20(28-25(32)18-4-5-18)8-11-23(22)36-24(16)14-29(3)37(34,35)21-9-6-19(27)7-10-21/h6-12,16-18,24,31H,4-5,13-15H2,1-3H3,(H,28,32)/t16-,17-,24+/m1/s1	AVAQDGZIUQEYTO-OJLQRUNKSA-N	533.199584664							111632
BRD-K68653835	LSM-23047		44484476	InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18+,22-/m1/s1	QKNVOCCOOAXREN-KGVIQGDOSA-N	CNC[C@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K68653835	BRD-K68653835-001-01-9	Broad Institute of MIT and Harvard	BRD-K68653835			CNC[C@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18+,22-/m1/s1	QKNVOCCOOAXREN-KGVIQGDOSA-N	462.284220356							111633
BRD-K84480302	LSM-23048		44485894	InChI=1S/C24H35N5O5S/c1-16-10-29(17(2)14-30)24(31)20-9-19(26-35(32,33)23-13-28(4)15-25-23)7-8-21(20)34-22(16)12-27(3)11-18-5-6-18/h7-9,13,15-18,22,26,30H,5-6,10-12,14H2,1-4H3/t16-,17-,22+/m0/s1	KTPUHGRRTQXBGV-PNLZDCPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NS(=O)(=O)c4cn(C)cn4)cc3C1=O	BroadT	BRD-K84480302	BRD-K84480302-001-01-1	Broad Institute of MIT and Harvard	BRD-K84480302			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C24H35N5O5S/c1-16-10-29(17(2)14-30)24(31)20-9-19(26-35(32,33)23-13-28(4)15-25-23)7-8-21(20)34-22(16)12-27(3)11-18-5-6-18/h7-9,13,15-18,22,26,30H,5-6,10-12,14H2,1-4H3/t16-,17-,22+/m0/s1	KTPUHGRRTQXBGV-PNLZDCPESA-N	505.23588996							111634
BRD-K20670914	LSM-23049		44492532	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23+,29-/m1/s1	JWXWRTLQHUTWJR-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K20670914	BRD-K20670914-001-01-4	Broad Institute of MIT and Harvard	BRD-K20670914			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23+,29-/m1/s1	JWXWRTLQHUTWJR-RLPNJSHFSA-N	564.331170548							111635
BRD-K53401077	LSM-23050		44498345	InChI=1S/C28H32N4O6S/c1-19-16-32(20(2)18-33)28(35)23-10-7-11-24(30-27(34)21-12-14-29-15-13-21)26(23)38-25(19)17-31(3)39(36,37)22-8-5-4-6-9-22/h4-15,19-20,25,33H,16-18H2,1-3H3,(H,30,34)/t19-,20+,25+/m1/s1	LXJZSYGAJCUBQM-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K53401077	BRD-K53401077-001-01-7	Broad Institute of MIT and Harvard	BRD-K53401077			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C28H32N4O6S/c1-19-16-32(20(2)18-33)28(35)23-10-7-11-24(30-27(34)21-12-14-29-15-13-21)26(23)38-25(19)17-31(3)39(36,37)22-8-5-4-6-9-22/h4-15,19-20,25,33H,16-18H2,1-3H3,(H,30,34)/t19-,20+,25+/m1/s1	LXJZSYGAJCUBQM-RNHFSVANSA-N	552.204255474							111636
BRD-K82791632	LSM-23051		44484333	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)13-6-12(17)4-5-14(13)22-15(10)7-18-3/h4-6,10-11,15,18,20H,7-9,17H2,1-3H3/t10-,11+,15+/m1/s1	WSNJSIDVSXIFLT-ZETOZRRWSA-N	CNC[C@@H]1Oc2ccc(N)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K82791632	BRD-K82791632-001-01-4	Broad Institute of MIT and Harvard	BRD-K82791632			CNC[C@@H]1Oc2ccc(N)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)13-6-12(17)4-5-14(13)22-15(10)7-18-3/h4-6,10-11,15,18,20H,7-9,17H2,1-3H3/t10-,11+,15+/m1/s1	WSNJSIDVSXIFLT-ZETOZRRWSA-N	307.18959169							111637
BRD-K67411319	LSM-23052		44501932	InChI=1S/C28H43N3O4/c1-19-15-31(20(2)18-32)27(33)14-23-13-24(29-28(34)22-7-5-4-6-8-22)11-12-25(23)35-26(19)17-30(3)16-21-9-10-21/h11-13,19-22,26,32H,4-10,14-18H2,1-3H3,(H,29,34)/t19-,20-,26+/m0/s1	OICFVEIUUNSOQD-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NC(=O)C4CCCCC4)cc3CC1=O	BroadT	BRD-K67411319	BRD-K67411319-001-01-8	Broad Institute of MIT and Harvard	BRD-K67411319			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NC(=O)C3CCCCC3)cc2CC1=O	InChI=1S/C28H43N3O4/c1-19-15-31(20(2)18-32)27(33)14-23-13-24(29-28(34)22-7-5-4-6-8-22)11-12-25(23)35-26(19)17-30(3)16-21-9-10-21/h11-13,19-22,26,32H,4-10,14-18H2,1-3H3,(H,29,34)/t19-,20-,26+/m0/s1	OICFVEIUUNSOQD-CUVVAGTFSA-N	485.325356886							111638
BRD-K18515345	LSM-23053		44501757	InChI=1S/C31H36FN3O7S/c1-20-15-35(21(2)18-36)31(37)14-23-13-25(33-43(38,39)26-8-5-24(32)6-9-26)7-11-27(23)42-30(20)17-34(3)16-22-4-10-28-29(12-22)41-19-40-28/h4-13,20-21,30,33,36H,14-19H2,1-3H3/t20-,21-,30+/m0/s1	ZVLYFKSMWJQSMB-FNFPNEPISA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc4CC1=O	BroadT	BRD-K18515345	BRD-K18515345-001-01-4	Broad Institute of MIT and Harvard	BRD-K18515345			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2CC1=O	InChI=1S/C31H36FN3O7S/c1-20-15-35(21(2)18-36)31(37)14-23-13-25(33-43(38,39)26-8-5-24(32)6-9-26)7-11-27(23)42-30(20)17-34(3)16-22-4-10-28-29(12-22)41-19-40-28/h4-13,20-21,30,33,36H,14-19H2,1-3H3/t20-,21-,30+/m0/s1	ZVLYFKSMWJQSMB-FNFPNEPISA-N	613.225799412							111639
BRD-K75293299	LSM-23054		44489127	InChI=1S/C33H35N5O5/c1-21-18-38(22(2)20-39)32(41)26-11-7-13-28(35-31(40)24-14-16-34-17-15-24)30(26)43-29(21)19-37(3)33(42)36-27-12-6-9-23-8-4-5-10-25(23)27/h4-17,21-22,29,39H,18-20H2,1-3H3,(H,35,40)(H,36,42)/t21-,22+,29+/m1/s1	UCPVSNSDYZNCRX-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)c5ccncc5)cccc4C1=O	BroadT	BRD-K75293299	BRD-K75293299-001-01-4	Broad Institute of MIT and Harvard	BRD-K75293299			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C33H35N5O5/c1-21-18-38(22(2)20-39)32(41)26-11-7-13-28(35-31(40)24-14-16-34-17-15-24)30(26)43-29(21)19-37(3)33(42)36-27-12-6-9-23-8-4-5-10-25(23)27/h4-17,21-22,29,39H,18-20H2,1-3H3,(H,35,40)(H,36,42)/t21-,22+,29+/m1/s1	UCPVSNSDYZNCRX-BXOOBUKZSA-N	581.26381927							111640
BRD-K20203758	LSM-23055		44484004	InChI=1S/C30H36N4O4/c1-21-17-34(22(2)20-35)29(36)26-16-25(32-30(37)31-24-12-8-5-9-13-24)14-15-27(26)38-28(21)19-33(3)18-23-10-6-4-7-11-23/h4-16,21-22,28,35H,17-20H2,1-3H3,(H2,31,32,37)/t21-,22+,28+/m0/s1	HYMZOYYGWSDRHJ-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K20203758	BRD-K20203758-001-01-3	Broad Institute of MIT and Harvard	BRD-K20203758			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H36N4O4/c1-21-17-34(22(2)20-35)29(36)26-16-25(32-30(37)31-24-12-8-5-9-13-24)14-15-27(26)38-28(21)19-33(3)18-23-10-6-4-7-11-23/h4-16,21-22,28,35H,17-20H2,1-3H3,(H2,31,32,37)/t21-,22+,28+/m0/s1	HYMZOYYGWSDRHJ-PFPZSTESSA-N	516.273655672							111641
BRD-K43194164	LSM-23056		44490031	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)28-17-25(32(3)4)13-16-29(28)38-30(22)20-33(5)19-24-11-14-27(15-12-24)37-26-9-7-6-8-10-26/h6-17,22-23,30,35H,18-21H2,1-5H3/t22-,23-,30+/m0/s1	WHHZCPPSCKMHDQ-ZTNZZFSWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K43194164	BRD-K43194164-001-01-5	Broad Institute of MIT and Harvard	BRD-K43194164			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)28-17-25(32(3)4)13-16-29(28)38-30(22)20-33(5)19-24-11-14-27(15-12-24)37-26-9-7-6-8-10-26/h6-17,22-23,30,35H,18-21H2,1-5H3/t22-,23-,30+/m0/s1	WHHZCPPSCKMHDQ-ZTNZZFSWSA-N	517.294056758							111642
BRD-K79995866	LSM-23057		44484967	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)25-14-24(33-31(38)32-23-7-5-4-6-8-23)10-12-26(25)41-29(20)17-34(3)16-22-9-11-27-28(13-22)40-19-39-27/h9-14,20-21,23,29,36H,4-8,15-19H2,1-3H3,(H2,32,33,38)/t20-,21-,29-/m0/s1	WHPNVWBFVYVCKA-WURXVLGASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)NC5CCCCC5)cc4C1=O	BroadT	BRD-K79995866	BRD-K79995866-001-01-3	Broad Institute of MIT and Harvard	BRD-K79995866			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)25-14-24(33-31(38)32-23-7-5-4-6-8-23)10-12-26(25)41-29(20)17-34(3)16-22-9-11-27-28(13-22)40-19-39-27/h9-14,20-21,23,29,36H,4-8,15-19H2,1-3H3,(H2,32,33,38)/t20-,21-,29-/m0/s1	WHPNVWBFVYVCKA-WURXVLGASA-N	566.310435104							111643
BRD-K58242935	LSM-23058		44489158	InChI=1S/C26H33F3N4O4/c1-16-13-33(17(2)15-34)24(35)20-7-6-8-21(31(3)4)23(20)37-22(16)14-32(5)25(36)30-19-11-9-18(10-12-19)26(27,28)29/h6-12,16-17,22,34H,13-15H2,1-5H3,(H,30,36)/t16-,17+,22+/m1/s1	UASMVRRVZNRGSL-JLHGSKIFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K58242935	BRD-K58242935-001-01-2	Broad Institute of MIT and Harvard	BRD-K58242935			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H33F3N4O4/c1-16-13-33(17(2)15-34)24(35)20-7-6-8-21(31(3)4)23(20)37-22(16)14-32(5)25(36)30-19-11-9-18(10-12-19)26(27,28)29/h6-12,16-17,22,34H,13-15H2,1-5H3,(H,30,36)/t16-,17+,22+/m1/s1	UASMVRRVZNRGSL-JLHGSKIFSA-N	522.245390176							111644
BRD-K58585880	LSM-23059		44492034	InChI=1S/C25H38N4O5/c1-15(2)26-25(33)28(5)13-22-16(3)12-29(17(4)14-30)23(31)11-19-10-20(8-9-21(19)34-22)27-24(32)18-6-7-18/h8-10,15-18,22,30H,6-7,11-14H2,1-5H3,(H,26,33)(H,27,32)/t16-,17-,22+/m0/s1	DCTUMTORVFHGKV-PNLZDCPESA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K58585880	BRD-K58585880-001-01-9	Broad Institute of MIT and Harvard	BRD-K58585880			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C25H38N4O5/c1-15(2)26-25(33)28(5)13-22-16(3)12-29(17(4)14-30)23(31)11-19-10-20(8-9-21(19)34-22)27-24(32)18-6-7-18/h8-10,15-18,22,30H,6-7,11-14H2,1-5H3,(H,26,33)(H,27,32)/t16-,17-,22+/m0/s1	DCTUMTORVFHGKV-PNLZDCPESA-N	474.284220356							111645
BRD-K26695332	LSM-23060		44496582	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18-,24+/m0/s1	JIVQHRCMRGEILI-LLJLJFOGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3c(NC(=O)C4CC4)cccc3C1=O	BroadT	BRD-K26695332	BRD-K26695332-001-01-9	Broad Institute of MIT and Harvard	BRD-K26695332			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2c(NC(=O)C3CC3)cccc2C1=O	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18-,24+/m0/s1	JIVQHRCMRGEILI-LLJLJFOGSA-N	509.25258587							111646
BRD-K35345866	LSM-23061		44484043	InChI=1S/C30H39N5O6/c1-18-14-35(19(2)17-36)29(37)25-13-23(31-30(38)32-28-20(3)33-41-21(28)4)9-12-26(25)40-27(18)16-34(5)15-22-7-10-24(39-6)11-8-22/h7-13,18-19,27,36H,14-17H2,1-6H3,(H2,31,32,38)/t18-,19-,27+/m0/s1	BCKUAPRXEALVIM-RWYJCYHVSA-N	COc1ccc(CN(C)C[C@H]2Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K35345866	BRD-K35345866-001-01-4	Broad Institute of MIT and Harvard	BRD-K35345866			COc1ccc(CN(C)C[C@H]2Oc3ccc(NC(=O)Nc4c(C)noc4C)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C30H39N5O6/c1-18-14-35(19(2)17-36)29(37)25-13-23(31-30(38)32-28-20(3)33-41-21(28)4)9-12-26(25)40-27(18)16-34(5)15-22-7-10-24(39-6)11-8-22/h7-13,18-19,27,36H,14-17H2,1-6H3,(H2,31,32,38)/t18-,19-,27+/m0/s1	BCKUAPRXEALVIM-RWYJCYHVSA-N	565.290034018							111647
BRD-K34079336	LSM-23062		44484702	InChI=1S/C34H45N5O5/c1-22-18-39(23(2)21-40)33(42)28-17-26(35-32(41)16-24-19-37(3)29-13-9-8-12-27(24)29)14-15-30(28)44-31(22)20-38(4)34(43)36-25-10-6-5-7-11-25/h8-9,12-15,17,19,22-23,25,31,40H,5-7,10-11,16,18,20-21H2,1-4H3,(H,35,41)(H,36,43)/t22-,23-,31+/m0/s1	ZSZRFUWYOKUGNE-WDCWYOMISA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Cc4cn(C)c5ccccc45)cc3C1=O	BroadT	BRD-K34079336	BRD-K34079336-001-01-2	Broad Institute of MIT and Harvard	BRD-K34079336			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Cc3cn(C)c4ccccc34)cc2C1=O	InChI=1S/C34H45N5O5/c1-22-18-39(23(2)21-40)33(42)28-17-26(35-32(41)16-24-19-37(3)29-13-9-8-12-27(24)29)14-15-30(28)44-31(22)20-38(4)34(43)36-25-10-6-5-7-11-25/h8-9,12-15,17,19,22-23,25,31,40H,5-7,10-11,16,18,20-21H2,1-4H3,(H,35,41)(H,36,43)/t22-,23-,31+/m0/s1	ZSZRFUWYOKUGNE-WDCWYOMISA-N	603.34206959							111648
BRD-K76335200	LSM-23063		44487139	InChI=1S/C29H41N3O5S/c1-21-17-32(22(2)20-33)29(34)26-16-24(30-38(35,36)25-12-8-5-9-13-25)14-15-27(26)37-28(21)19-31(3)18-23-10-6-4-7-11-23/h5,8-9,12-16,21-23,28,30,33H,4,6-7,10-11,17-20H2,1-3H3/t21-,22-,28+/m0/s1	DAPIBIRMBOQELH-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K76335200	BRD-K76335200-001-01-0	Broad Institute of MIT and Harvard	BRD-K76335200			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H41N3O5S/c1-21-17-32(22(2)20-33)29(34)26-16-24(30-38(35,36)25-12-8-5-9-13-25)14-15-27(26)37-28(21)19-31(3)18-23-10-6-4-7-11-23/h5,8-9,12-16,21-23,28,30,33H,4,6-7,10-11,17-20H2,1-3H3/t21-,22-,28+/m0/s1	DAPIBIRMBOQELH-RXYILKCJSA-N	543.276692132							111649
BRD-K04786080	LSM-23064		44498133	InChI=1S/C33H40N4O6/c1-22-19-37(23(2)21-38)32(40)18-25-17-27(34-31(39)16-24-8-6-5-7-9-24)12-15-29(25)43-30(22)20-36(3)33(41)35-26-10-13-28(42-4)14-11-26/h5-15,17,22-23,30,38H,16,18-21H2,1-4H3,(H,34,39)(H,35,41)/t22-,23-,30+/m0/s1	CGYYYKYOQGTOJG-ZTNZZFSWSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)Cc4ccccc4)cc3CC(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K04786080	BRD-K04786080-001-01-6	Broad Institute of MIT and Harvard	BRD-K04786080			COc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)Cc4ccccc4)cc3CC(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C33H40N4O6/c1-22-19-37(23(2)21-38)32(40)18-25-17-27(34-31(39)16-24-8-6-5-7-9-24)12-15-29(25)43-30(22)20-36(3)33(41)35-26-10-13-28(42-4)14-11-26/h5-15,17,22-23,30,38H,16,18-21H2,1-4H3,(H,34,39)(H,35,41)/t22-,23-,30+/m0/s1	CGYYYKYOQGTOJG-ZTNZZFSWSA-N	588.29478504							111650
BRD-K07361992	LSM-23065		44484214	InChI=1S/C30H35N3O7S/c1-20-15-33(21(2)18-34)30(35)25-14-23(31-41(36,37)24-7-5-4-6-8-24)10-12-26(25)40-29(20)17-32(3)16-22-9-11-27-28(13-22)39-19-38-27/h4-14,20-21,29,31,34H,15-19H2,1-3H3/t20-,21-,29-/m0/s1	YPROYXXRHQGNKF-WURXVLGASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NS(=O)(=O)c5ccccc5)cc4C1=O	BroadT	BRD-K07361992	BRD-K07361992-001-01-2	Broad Institute of MIT and Harvard	BRD-K07361992			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H35N3O7S/c1-20-15-33(21(2)18-34)30(35)25-14-23(31-41(36,37)24-7-5-4-6-8-24)10-12-26(25)40-29(20)17-32(3)16-22-9-11-27-28(13-22)39-19-38-27/h4-14,20-21,29,31,34H,15-19H2,1-3H3/t20-,21-,29-/m0/s1	YPROYXXRHQGNKF-WURXVLGASA-N	581.21957118							111651
BRD-K72494918	LSM-23066		44495823	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11-,14+/m0/s1	CZXYLKJVFUIZEK-COPLHBTASA-N	CNC[C@H]1Oc2c(N)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K72494918	BRD-K72494918-001-01-2	Broad Institute of MIT and Harvard	BRD-K72494918			CNC[C@H]1Oc2c(N)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11-,14+/m0/s1	CZXYLKJVFUIZEK-COPLHBTASA-N	307.18959169							111652
BRD-K15105186	LSM-23067		44487114	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)19-10-17(6-9-20(19)31-21(14)11-24-3)25-32(29,30)18-7-4-16(23)5-8-18/h4-10,14-15,21,24-25,27H,11-13H2,1-3H3/t14-,15-,21+/m0/s1	DERWQPYGNBVBMF-VFCRVFHLSA-N	CNC[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K15105186	BRD-K15105186-001-01-9	Broad Institute of MIT and Harvard	BRD-K15105186			CNC[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)19-10-17(6-9-20(19)31-21(14)11-24-3)25-32(29,30)18-7-4-16(23)5-8-18/h4-10,14-15,21,24-25,27H,11-13H2,1-3H3/t14-,15-,21+/m0/s1	DERWQPYGNBVBMF-VFCRVFHLSA-N	465.173369916							111653
BRD-K45498945	LSM-23068		44484380	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14+,18+/m1/s1	TWHSADQACYCNBZ-GLJUWKHASA-N	CNC[C@@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K45498945	BRD-K45498945-001-01-4	Broad Institute of MIT and Harvard	BRD-K45498945			CNC[C@@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14+,18+/m1/s1	TWHSADQACYCNBZ-GLJUWKHASA-N	413.206304394							111654
BRD-K69278677	LSM-23069		44484057	InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)24-15-22(31(3)4)13-14-26(24)37-27(19)17-32(5)29(36)30-25-12-8-10-21-9-6-7-11-23(21)25/h6-15,19-20,27,34H,16-18H2,1-5H3,(H,30,36)/t19-,20-,27+/m0/s1	FZIWMBCZXHBNOC-OWOAZTCBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K69278677	BRD-K69278677-001-01-5	Broad Institute of MIT and Harvard	BRD-K69278677			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)24-15-22(31(3)4)13-14-26(24)37-27(19)17-32(5)29(36)30-25-12-8-10-21-9-6-7-11-23(21)25/h6-15,19-20,27,34H,16-18H2,1-5H3,(H,30,36)/t19-,20-,27+/m0/s1	FZIWMBCZXHBNOC-OWOAZTCBSA-N	504.273655672							111655
CHEMBL3184121	LSM-23070	BRD-K50334155	44485910	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)20-11-19(28(3)4)7-9-23(20)33-24(16)14-29(5)13-18-6-8-21(26)22(27)10-18/h6-11,16-17,24,31H,12-15H2,1-5H3/t16-,17-,24+/m0/s1	QSGCCBXTIZPHMD-WOGXIUBCSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K50334155	BRD-K50334155-001-01-8	Broad Institute of MIT and Harvard	BRD-K50334155			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)20-11-19(28(3)4)7-9-23(20)33-24(16)14-29(5)13-18-6-8-21(26)22(27)10-18/h6-11,16-17,24,31H,12-15H2,1-5H3/t16-,17-,24+/m0/s1	QSGCCBXTIZPHMD-WOGXIUBCSA-N	493.189897366							111656
BRD-K61278167	LSM-23071		44489110	InChI=1S/C28H34F3N5O5S/c1-18-12-36(19(2)16-37)27(38)22-6-5-7-23(33-42(39,40)25-15-35(4)17-32-25)26(22)41-24(18)14-34(3)13-20-8-10-21(11-9-20)28(29,30)31/h5-11,15,17-19,24,33,37H,12-14,16H2,1-4H3/t18-,19+,24+/m0/s1	DXKOHZBEBBERNQ-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3c(NS(=O)(=O)c4cn(C)cn4)cccc3C1=O	BroadT	BRD-K61278167	BRD-K61278167-001-01-0	Broad Institute of MIT and Harvard	BRD-K61278167			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C1=O	InChI=1S/C28H34F3N5O5S/c1-18-12-36(19(2)16-37)27(38)22-6-5-7-23(33-42(39,40)25-15-35(4)17-32-25)26(22)41-24(18)14-34(3)13-20-8-10-21(11-9-20)28(29,30)31/h5-11,15,17-19,24,33,37H,12-14,16H2,1-4H3/t18-,19+,24+/m0/s1	DXKOHZBEBBERNQ-XLNZFTOWSA-N	609.223274528							111657
MLS002474192	LSM-23072	BRD-K96510191, SID85201751	44202833	InChI=1S/C31H40F3N5O5/c1-19-16-39(20(2)18-40)28(41)24-10-7-11-25(37-29(42)35-22-8-5-4-6-9-22)27(24)44-26(19)17-38(3)30(43)36-23-14-12-21(13-15-23)31(32,33)34/h7,10-15,19-20,22,26,40H,4-6,8-9,16-18H2,1-3H3,(H,36,43)(H2,35,37,42)/t19-,20-,26-/m1/s1	DYMIOMKCTZAAFH-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)NC4CCCCC4)cccc3C1=O	BroadT	BRD-K96510191	BRD-K96510191-001-01-5	Broad Institute of MIT and Harvard	BRD-K96510191			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C31H40F3N5O5/c1-19-16-39(20(2)18-40)28(41)24-10-7-11-25(37-29(42)35-22-8-5-4-6-9-22)27(24)44-26(19)17-38(3)30(43)36-23-14-12-21(13-15-23)31(32,33)34/h7,10-15,19-20,22,26,40H,4-6,8-9,16-18H2,1-3H3,(H,36,43)(H2,35,37,42)/t19-,20-,26-/m1/s1	DYMIOMKCTZAAFH-XMERXJNXSA-N	619.29815403							111658
MLS002473774	LSM-23073	BRD-K32718856, SID85201313	44202397	InChI=1S/C30H48N4O5/c1-22-18-34(23(2)21-35)30(37)26-17-25(31-29(36)11-12-33-13-15-38-16-14-33)9-10-27(26)39-28(22)20-32(3)19-24-7-5-4-6-8-24/h9-10,17,22-24,28,35H,4-8,11-16,18-21H2,1-3H3,(H,31,36)/t22-,23+,28+/m0/s1	ICTRKSOOJQUIHO-SXDGJLEOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)CCN4CCOCC4)cc3C1=O	BroadT	BRD-K32718856	BRD-K32718856-001-02-5	Broad Institute of MIT and Harvard	BRD-K32718856			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2C1=O	InChI=1S/C30H48N4O5/c1-22-18-34(23(2)21-35)30(37)26-17-25(31-29(36)11-12-33-13-15-38-16-14-33)9-10-27(26)39-28(22)20-32(3)19-24-7-5-4-6-8-24/h9-10,17,22-24,28,35H,4-8,11-16,18-21H2,1-3H3,(H,31,36)/t22-,23+,28+/m0/s1	ICTRKSOOJQUIHO-SXDGJLEOSA-N	544.362470676							111659
BRD-K33503286	LSM-23074		44616435	InChI=1S/C31H38F3N5O5/c1-18-14-39(19(2)17-40)28(41)13-23-12-25(35-30(42)36-29-20(3)37-44-21(29)4)10-11-26(23)43-27(18)16-38(5)15-22-6-8-24(9-7-22)31(32,33)34/h6-12,18-19,27,40H,13-17H2,1-5H3,(H2,35,36,42)/t18-,19+,27+/m1/s1	XNWPWURMKBHVTJ-RYTUXRKISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3CC1=O	BroadT	BRD-K33503286	BRD-K33503286-001-01-2	Broad Institute of MIT and Harvard	BRD-K33503286			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2CC1=O	InChI=1S/C31H38F3N5O5/c1-18-14-39(19(2)17-40)28(41)13-23-12-25(35-30(42)36-29-20(3)37-44-21(29)4)10-11-26(23)43-27(18)16-38(5)15-22-6-8-24(9-7-22)31(32,33)34/h6-12,18-19,27,40H,13-17H2,1-5H3,(H2,35,36,42)/t18-,19+,27+/m1/s1	XNWPWURMKBHVTJ-RYTUXRKISA-N	617.282503966							111660
BRD-K14693153	LSM-23075		44483431	InChI=1S/C30H34N4O6/c1-19-14-34(20(2)17-35)30(37)24-13-23(32-29(36)22-8-10-31-11-9-22)5-7-25(24)40-28(19)16-33(3)15-21-4-6-26-27(12-21)39-18-38-26/h4-13,19-20,28,35H,14-18H2,1-3H3,(H,32,36)/t19-,20-,28+/m1/s1	VPWIZKHQYUSQSD-HIRWGAFWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)c5ccncc5)cc4C1=O	BroadT	BRD-K14693153	BRD-K14693153-001-01-4	Broad Institute of MIT and Harvard	BRD-K14693153			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C30H34N4O6/c1-19-14-34(20(2)17-35)30(37)24-13-23(32-29(36)22-8-10-31-11-9-22)5-7-25(24)40-28(19)16-33(3)15-21-4-6-26-27(12-21)39-18-38-26/h4-13,19-20,28,35H,14-18H2,1-3H3,(H,32,36)/t19-,20-,28+/m1/s1	VPWIZKHQYUSQSD-HIRWGAFWSA-N	546.247834848							111661
BRD-K22087209	LSM-23076		44498919	InChI=1S/C28H32N4O6S/c1-19-16-32(20(2)18-33)28(35)23-10-7-11-24(30-27(34)21-12-14-29-15-13-21)26(23)38-25(19)17-31(3)39(36,37)22-8-5-4-6-9-22/h4-15,19-20,25,33H,16-18H2,1-3H3,(H,30,34)/t19-,20-,25+/m1/s1	LXJZSYGAJCUBQM-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K22087209	BRD-K22087209-001-01-3	Broad Institute of MIT and Harvard	BRD-K22087209			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C28H32N4O6S/c1-19-16-32(20(2)18-33)28(35)23-10-7-11-24(30-27(34)21-12-14-29-15-13-21)26(23)38-25(19)17-31(3)39(36,37)22-8-5-4-6-9-22/h4-15,19-20,25,33H,16-18H2,1-3H3,(H,30,34)/t19-,20-,25+/m1/s1	LXJZSYGAJCUBQM-FHAGJXEFSA-N	552.204255474							111662
BRD-K69471644	LSM-23077		44502637	InChI=1S/C26H42N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h11-13,18-19,21,24,31H,6-10,14-17H2,1-5H3,(H,27,33)/t18-,19-,24+/m0/s1	NUQLUNTVVQHOLK-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K69471644	BRD-K69471644-001-01-6	Broad Institute of MIT and Harvard	BRD-K69471644			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C26H42N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h11-13,18-19,21,24,31H,6-10,14-17H2,1-5H3,(H,27,33)/t18-,19-,24+/m0/s1	NUQLUNTVVQHOLK-AXHZCLLHSA-N	474.320605864							111663
CHEMBL2140553	LSM-23078	BRD-K80381603, SID85806157	44499181	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)27-12-9-13-28(32(3)4)30(27)38-29(22)20-33(5)19-24-14-16-26(17-15-24)37-25-10-7-6-8-11-25/h6-17,22-23,29,35H,18-21H2,1-5H3/t22-,23+,29-/m1/s1	KBWKSVZPOQKHGN-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K80381603	BRD-K80381603-001-01-1	Broad Institute of MIT and Harvard	BRD-K80381603			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)27-12-9-13-28(32(3)4)30(27)38-29(22)20-33(5)19-24-14-16-26(17-15-24)37-25-10-7-6-8-11-25/h6-17,22-23,29,35H,18-21H2,1-5H3/t22-,23+,29-/m1/s1	KBWKSVZPOQKHGN-RLPNJSHFSA-N	517.294056758							111664
BRD-K33864113	LSM-23079		54613823	InChI=1S/C35H38N4O6/c1-22-17-39(23(2)20-40)34(41)28-16-26(36-35(42)37-29-10-6-8-25-7-4-5-9-27(25)29)12-14-30(28)45-33(22)19-38(3)18-24-11-13-31-32(15-24)44-21-43-31/h4-16,22-23,33,40H,17-21H2,1-3H3,(H2,36,37,42)/t22-,23-,33+/m1/s1	MDVGURPVGABTFV-CURJATOHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)Nc5cccc6ccccc56)cc4C1=O	BroadT	BRD-K33864113	BRD-K33864113-001-01-7	Broad Institute of MIT and Harvard	BRD-K33864113			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C35H38N4O6/c1-22-17-39(23(2)20-40)34(41)28-16-26(36-35(42)37-29-10-6-8-25-7-4-5-9-27(25)29)12-14-30(28)45-33(22)19-38(3)18-24-11-13-31-32(15-24)44-21-43-31/h4-16,22-23,33,40H,17-21H2,1-3H3,(H2,36,37,42)/t22-,23-,33+/m1/s1	MDVGURPVGABTFV-CURJATOHSA-N	610.279134976							111665
BRD-K02152970-001-01-6	LSM-23080	BRD-K02152970	44485846	InChI=1S/C27H41N3O4/c1-18-14-30(19(2)17-31)27(33)23-13-22(28-26(32)21-9-10-21)11-12-24(23)34-25(18)16-29(3)15-20-7-5-4-6-8-20/h11-13,18-21,25,31H,4-10,14-17H2,1-3H3,(H,28,32)/t18-,19+,25+/m0/s1	RZKDUVXCVDUJNN-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)C4CC4)cc3C1=O	BroadT	BRD-K02152970	BRD-K02152970-001-02-4	Broad Institute of MIT and Harvard	BRD-K02152970			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)C3CC3)cc2C1=O	InChI=1S/C27H41N3O4/c1-18-14-30(19(2)17-31)27(33)23-13-22(28-26(32)21-9-10-21)11-12-24(23)34-25(18)16-29(3)15-20-7-5-4-6-8-20/h11-13,18-21,25,31H,4-10,14-17H2,1-3H3,(H,28,32)/t18-,19+,25+/m0/s1	RZKDUVXCVDUJNN-OSWQYVSFSA-N	471.309706822							111666
MLS002473793	LSM-23081	SID85201327, BRD-K58432332	44202411	InChI=1S/C31H42N4O6/c1-20-17-35(21(2)19-36)30(38)25-11-8-12-26(33-29(37)22-9-6-5-7-10-22)28(25)41-27(20)18-34(3)31(39)32-23-13-15-24(40-4)16-14-23/h8,11-16,20-22,27,36H,5-7,9-10,17-19H2,1-4H3,(H,32,39)(H,33,37)/t20-,21+,27+/m0/s1	LSKFJJLXCXBANC-FYQCMVGJSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3c(NC(=O)C4CCCCC4)cccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K58432332	BRD-K58432332-001-02-6	Broad Institute of MIT and Harvard	BRD-K58432332			COc1ccc(NC(=O)N(C)C[C@H]2Oc3c(NC(=O)C4CCCCC4)cccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H42N4O6/c1-20-17-35(21(2)19-36)30(38)25-11-8-12-26(33-29(37)22-9-6-5-7-10-22)28(25)41-27(20)18-34(3)31(39)32-23-13-15-24(40-4)16-14-23/h8,11-16,20-22,27,36H,5-7,9-10,17-19H2,1-4H3,(H,32,39)(H,33,37)/t20-,21+,27+/m0/s1	LSKFJJLXCXBANC-FYQCMVGJSA-N	566.310435104							111667
BRD-K09991582	LSM-23082		44493159	InChI=1S/C24H35N5O5S/c1-16-10-29(17(2)14-30)24(31)20-9-19(26-35(32,33)23-13-28(4)15-25-23)7-8-21(20)34-22(16)12-27(3)11-18-5-6-18/h7-9,13,15-18,22,26,30H,5-6,10-12,14H2,1-4H3/t16-,17+,22+/m0/s1	KTPUHGRRTQXBGV-GSHUGGBRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NS(=O)(=O)c4cn(C)cn4)cc3C1=O	BroadT	BRD-K09991582	BRD-K09991582-001-02-8	Broad Institute of MIT and Harvard	BRD-K09991582			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C24H35N5O5S/c1-16-10-29(17(2)14-30)24(31)20-9-19(26-35(32,33)23-13-28(4)15-25-23)7-8-21(20)34-22(16)12-27(3)11-18-5-6-18/h7-9,13,15-18,22,26,30H,5-6,10-12,14H2,1-4H3/t16-,17+,22+/m0/s1	KTPUHGRRTQXBGV-GSHUGGBRSA-N	505.23588996							111668
BRD-K02784824-001-01-4	LSM-23083	BRD-K02784824	44488554	InChI=1S/C31H37N3O8S/c1-20-15-34(21(2)18-35)31(36)25-6-5-7-26(32-43(37,38)24-11-9-23(39-4)10-12-24)30(25)42-29(20)17-33(3)16-22-8-13-27-28(14-22)41-19-40-27/h5-14,20-21,29,32,35H,15-19H2,1-4H3/t20-,21+,29+/m0/s1	AELUQFUEWCFKFM-BNJCFXFUSA-N	COc1ccc(cc1)S(=O)(=O)Nc2cccc3C(=O)N(C[C@H](C)[C@@H](CN(C)Cc4ccc5OCOc5c4)Oc23)[C@H](C)CO	BroadT	BRD-K02784824	BRD-K02784824-001-02-2	Broad Institute of MIT and Harvard	BRD-K02784824			COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1O[C@H](CN(C)Cc1ccc3OCOc3c1)[C@@H](C)CN([C@H](C)CO)C2=O	InChI=1S/C31H37N3O8S/c1-20-15-34(21(2)18-35)31(36)25-6-5-7-26(32-43(37,38)24-11-9-23(39-4)10-12-24)30(25)42-29(20)17-33(3)16-22-8-13-27-28(14-22)41-19-40-27/h5-14,20-21,29,32,35H,15-19H2,1-4H3/t20-,21+,29+/m0/s1	AELUQFUEWCFKFM-BNJCFXFUSA-N	611.230135864							111669
BRD-K56884305	LSM-23084		44499531	InChI=1S/C30H35N5O6/c1-19-16-35(20(2)18-36)29(38)24-6-5-7-25(33-28(37)21-12-14-31-15-13-21)27(24)41-26(19)17-34(3)30(39)32-22-8-10-23(40-4)11-9-22/h5-15,19-20,26,36H,16-18H2,1-4H3,(H,32,39)(H,33,37)/t19-,20+,26-/m0/s1	YPMOLAXPZMKSMS-UNVFRBQDSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3c(NC(=O)c4ccncc4)cccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K56884305	BRD-K56884305-001-01-5	Broad Institute of MIT and Harvard	BRD-K56884305			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3c(NC(=O)c4ccncc4)cccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C30H35N5O6/c1-19-16-35(20(2)18-36)29(38)24-6-5-7-25(33-28(37)21-12-14-31-15-13-21)27(24)41-26(19)17-34(3)30(39)32-22-8-10-23(40-4)11-9-22/h5-15,19-20,26,36H,16-18H2,1-4H3,(H,32,39)(H,33,37)/t19-,20+,26-/m0/s1	YPMOLAXPZMKSMS-UNVFRBQDSA-N	561.25873389							111670
BRD-K07020302	LSM-23085		44486155	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)13-6-12(17)4-5-14(13)22-15(10)7-18-3/h4-6,10-11,15,18,20H,7-9,17H2,1-3H3/t10-,11-,15+/m0/s1	WSNJSIDVSXIFLT-ZIBATOQPSA-N	CNC[C@H]1Oc2ccc(N)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K07020302	BRD-K07020302-001-01-9	Broad Institute of MIT and Harvard	BRD-K07020302			CNC[C@H]1Oc2ccc(N)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)13-6-12(17)4-5-14(13)22-15(10)7-18-3/h4-6,10-11,15,18,20H,7-9,17H2,1-3H3/t10-,11-,15+/m0/s1	WSNJSIDVSXIFLT-ZIBATOQPSA-N	307.18959169							111671
BRD-K44402256	LSM-23086		44490052	InChI=1S/C29H40FN5O5/c1-19-16-35(20(2)18-36)28(38)24-15-23(31-27(37)7-6-14-33(3)4)12-13-25(24)40-26(19)17-34(5)29(39)32-22-10-8-21(30)9-11-22/h8-13,15,19-20,26,36H,6-7,14,16-18H2,1-5H3,(H,31,37)(H,32,39)/t19-,20+,26-/m0/s1	UQFLYQXQOZGCNB-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K44402256	BRD-K44402256-001-01-0	Broad Institute of MIT and Harvard	BRD-K44402256			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H40FN5O5/c1-19-16-35(20(2)18-36)28(38)24-15-23(31-27(37)7-6-14-33(3)4)12-13-25(24)40-26(19)17-34(5)29(39)32-22-10-8-21(30)9-11-22/h8-13,15,19-20,26,36H,6-7,14,16-18H2,1-5H3,(H,31,37)(H,32,39)/t19-,20+,26-/m0/s1	UQFLYQXQOZGCNB-UNVFRBQDSA-N	557.30134763							111672
BRD-K35520972	LSM-23087		44491065	InChI=1S/C35H38N4O6/c1-22-17-39(23(2)20-40)34(41)28-16-26(36-35(42)37-29-10-6-8-25-7-4-5-9-27(25)29)12-14-30(28)45-33(22)19-38(3)18-24-11-13-31-32(15-24)44-21-43-31/h4-16,22-23,33,40H,17-21H2,1-3H3,(H2,36,37,42)/t22-,23+,33+/m0/s1	MDVGURPVGABTFV-VCEFOFBQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)Nc5cccc6ccccc56)cc4C1=O	BroadT	BRD-K35520972	BRD-K35520972-001-01-3	Broad Institute of MIT and Harvard	BRD-K35520972			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C35H38N4O6/c1-22-17-39(23(2)20-40)34(41)28-16-26(36-35(42)37-29-10-6-8-25-7-4-5-9-27(25)29)12-14-30(28)45-33(22)19-38(3)18-24-11-13-31-32(15-24)44-21-43-31/h4-16,22-23,33,40H,17-21H2,1-3H3,(H2,36,37,42)/t22-,23+,33+/m0/s1	MDVGURPVGABTFV-VCEFOFBQSA-N	610.279134976							111673
BRD-K81482880	LSM-23088		44499787	InChI=1S/C29H36N4O5S/c1-20-8-10-24(11-9-20)39(36,37)31-26-7-5-6-25-28(26)38-27(18-32(4)17-23-12-14-30-15-13-23)21(2)16-33(29(25)35)22(3)19-34/h5-15,21-22,27,31,34H,16-19H2,1-4H3/t21-,22-,27-/m1/s1	JBHIQUJYWNKFSD-VHFRWLAGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3c(NS(=O)(=O)c4ccc(C)cc4)cccc3C1=O	BroadT	BRD-K81482880	BRD-K81482880-001-01-0	Broad Institute of MIT and Harvard	BRD-K81482880			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2c(NS(=O)(=O)c3ccc(C)cc3)cccc2C1=O	InChI=1S/C29H36N4O5S/c1-20-8-10-24(11-9-20)39(36,37)31-26-7-5-6-25-28(26)38-27(18-32(4)17-23-12-14-30-15-13-23)21(2)16-33(29(25)35)22(3)19-34/h5-15,21-22,27,31,34H,16-19H2,1-4H3/t21-,22-,27-/m1/s1	JBHIQUJYWNKFSD-VHFRWLAGSA-N	552.240640982							111674
BRD-K76788397	LSM-23089		44488062	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)19-7-6-8-22(28(3)4)24(19)33-23(16)14-29(5)13-18-9-10-20(26)21(27)11-18/h6-11,16-17,23,31H,12-15H2,1-5H3/t16-,17+,23-/m1/s1	VYDAAMPIABWJJO-SAHWJRBASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K76788397	BRD-K76788397-001-01-3	Broad Institute of MIT and Harvard	BRD-K76788397			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)19-7-6-8-22(28(3)4)24(19)33-23(16)14-29(5)13-18-9-10-20(26)21(27)11-18/h6-11,16-17,23,31H,12-15H2,1-5H3/t16-,17+,23-/m1/s1	VYDAAMPIABWJJO-SAHWJRBASA-N	493.189897366							111675
BRD-K30738873	LSM-23090		44619465	InChI=1S/C31H49N5O6/c1-22-19-36(23(2)21-37)30(39)18-24-17-26(32-29(38)11-12-35-13-15-41-16-14-35)9-10-27(24)42-28(22)20-34(3)31(40)33-25-7-5-4-6-8-25/h9-10,17,22-23,25,28,37H,4-8,11-16,18-21H2,1-3H3,(H,32,38)(H,33,40)/t22-,23+,28+/m0/s1	VGGDTLLTAGJVNH-SXDGJLEOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)CCN4CCOCC4)cc3CC1=O	BroadT	BRD-K30738873	BRD-K30738873-001-01-6	Broad Institute of MIT and Harvard	BRD-K30738873			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC1=O	InChI=1S/C31H49N5O6/c1-22-19-36(23(2)21-37)30(39)18-24-17-26(32-29(38)11-12-35-13-15-41-16-14-35)9-10-27(24)42-28(22)20-34(3)31(40)33-25-7-5-4-6-8-25/h9-10,17,22-23,25,28,37H,4-8,11-16,18-21H2,1-3H3,(H,32,38)(H,33,40)/t22-,23+,28+/m0/s1	VGGDTLLTAGJVNH-SXDGJLEOSA-N	587.368284338							111676
BRD-K11425684	LSM-23091		44497499	InChI=1S/C22H31N3O5S2/c1-15-12-25(16(2)14-26)22(27)17-8-6-9-18(23(3)4)21(17)30-19(15)13-24(5)32(28,29)20-10-7-11-31-20/h6-11,15-16,19,26H,12-14H2,1-5H3/t15-,16+,19-/m1/s1	ITZNTWNJFRQWKT-JTDSTZFVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K11425684	BRD-K11425684-001-01-2	Broad Institute of MIT and Harvard	BRD-K11425684			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C22H31N3O5S2/c1-15-12-25(16(2)14-26)22(27)17-8-6-9-18(23(3)4)21(17)30-19(15)13-24(5)32(28,29)20-10-7-11-31-20/h6-11,15-16,19,26H,12-14H2,1-5H3/t15-,16+,19-/m1/s1	ITZNTWNJFRQWKT-JTDSTZFVSA-N	481.170512502							111677
BRD-K24307790	LSM-23092		44485606	InChI=1S/C30H39N3O7/c1-19-14-33(20(2)17-34)30(36)23-5-4-6-24(31-29(35)22-9-11-37-12-10-22)28(23)40-27(19)16-32(3)15-21-7-8-25-26(13-21)39-18-38-25/h4-8,13,19-20,22,27,34H,9-12,14-18H2,1-3H3,(H,31,35)/t19-,20+,27-/m1/s1	NQBSYXGUJZNUSC-IOKPGSKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K24307790	BRD-K24307790-001-01-8	Broad Institute of MIT and Harvard	BRD-K24307790			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C30H39N3O7/c1-19-14-33(20(2)17-34)30(36)23-5-4-6-24(31-29(35)22-9-11-37-12-10-22)28(23)40-27(19)16-32(3)15-21-7-8-25-26(13-21)39-18-38-25/h4-8,13,19-20,22,27,34H,9-12,14-18H2,1-3H3,(H,31,35)/t19-,20+,27-/m1/s1	NQBSYXGUJZNUSC-IOKPGSKQSA-N	553.278800618							111678
BRD-K65201129	LSM-23093		44493059	InChI=1S/C33H40N4O7/c1-21-16-37(22(2)19-38)32(39)14-24-13-25(34-33(40)35-26-8-12-29-30(15-26)43-20-42-29)7-11-28(24)44-31(21)18-36(3)17-23-5-9-27(41-4)10-6-23/h5-13,15,21-22,31,38H,14,16-20H2,1-4H3,(H2,34,35,40)/t21-,22-,31+/m0/s1	VJXHRMPDQSPMOP-GUARRIROSA-N	COc1ccc(CN(C)C[C@H]2Oc3ccc(NC(=O)Nc4ccc5OCOc5c4)cc3CC(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K65201129	BRD-K65201129-001-01-5	Broad Institute of MIT and Harvard	BRD-K65201129			COc1ccc(CN(C)C[C@H]2Oc3ccc(NC(=O)Nc4ccc5OCOc5c4)cc3CC(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C33H40N4O7/c1-21-16-37(22(2)19-38)32(39)14-24-13-25(34-33(40)35-26-8-12-29-30(15-26)43-20-42-29)7-11-28(24)44-31(21)18-36(3)17-23-5-9-27(41-4)10-6-23/h5-13,15,21-22,31,38H,14,16-20H2,1-4H3,(H2,34,35,40)/t21-,22-,31+/m0/s1	VJXHRMPDQSPMOP-GUARRIROSA-N	604.28969966							111679
BRD-K71893034	LSM-23094		44490659	InChI=1S/C28H40N4O6S/c1-20-17-32(21(2)19-33)28(35)24-16-22(29-27(34)12-9-15-30(3)4)13-14-25(24)38-26(20)18-31(5)39(36,37)23-10-7-6-8-11-23/h6-8,10-11,13-14,16,20-21,26,33H,9,12,15,17-19H2,1-5H3,(H,29,34)/t20-,21-,26-/m1/s1	RYGUZWJSQXSRBK-IPVFLDMMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K71893034	BRD-K71893034-001-01-5	Broad Institute of MIT and Harvard	BRD-K71893034			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C28H40N4O6S/c1-20-17-32(21(2)19-33)28(35)24-16-22(29-27(34)12-9-15-30(3)4)13-14-25(24)38-26(20)18-31(5)39(36,37)23-10-7-6-8-11-23/h6-8,10-11,13-14,16,20-21,26,33H,9,12,15,17-19H2,1-5H3,(H,29,34)/t20-,21-,26-/m1/s1	RYGUZWJSQXSRBK-IPVFLDMMSA-N	560.26685573							111680
BRD-K44722555	LSM-23095		44498725	InChI=1S/C26H35ClN4O6S/c1-16(2)28-26(34)30(5)14-23-17(3)13-31(18(4)15-32)25(33)21-7-6-8-22(24(21)37-23)29-38(35,36)20-11-9-19(27)10-12-20/h6-12,16-18,23,29,32H,13-15H2,1-5H3,(H,28,34)/t17-,18+,23+/m0/s1	ROXPMFGZZQEKHB-YZZKKUAISA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2c(NS(=O)(=O)c3ccc(Cl)cc3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K44722555	BRD-K44722555-001-01-9	Broad Institute of MIT and Harvard	BRD-K44722555			CC(C)NC(=O)N(C)C[C@H]1Oc2c(NS(=O)(=O)c3ccc(Cl)cc3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H35ClN4O6S/c1-16(2)28-26(34)30(5)14-23-17(3)13-31(18(4)15-32)25(33)21-7-6-8-22(24(21)37-23)29-38(35,36)20-11-9-19(27)10-12-20/h6-12,16-18,23,29,32H,13-15H2,1-5H3,(H,28,34)/t17-,18+,23+/m0/s1	ROXPMFGZZQEKHB-YZZKKUAISA-N	566.19658328							111681
BRD-K37390332	LSM-23096		44620216	InChI=1S/C34H37N5O5/c1-22-19-39(23(2)21-40)32(41)18-26-17-27(36-33(42)25-13-15-35-16-14-25)11-12-30(26)44-31(22)20-38(3)34(43)37-29-10-6-8-24-7-4-5-9-28(24)29/h4-17,22-23,31,40H,18-21H2,1-3H3,(H,36,42)(H,37,43)/t22-,23+,31+/m0/s1	LDEMJBAJJXLTPL-INEJIFKHSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)c5ccncc5)cc4CC1=O	BroadT	BRD-K37390332	BRD-K37390332-001-01-4	Broad Institute of MIT and Harvard	BRD-K37390332			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C34H37N5O5/c1-22-19-39(23(2)21-40)32(41)18-26-17-27(36-33(42)25-13-15-35-16-14-25)11-12-30(26)44-31(22)20-38(3)34(43)37-29-10-6-8-24-7-4-5-9-28(24)29/h4-17,22-23,31,40H,18-21H2,1-3H3,(H,36,42)(H,37,43)/t22-,23+,31+/m0/s1	LDEMJBAJJXLTPL-INEJIFKHSA-N	595.279469334							111682
BRD-K88080089	LSM-23097		44487693	InChI=1S/C30H48N4O5/c1-22-18-34(23(2)21-35)30(37)26-17-25(31-29(36)11-12-33-13-15-38-16-14-33)9-10-27(26)39-28(22)20-32(3)19-24-7-5-4-6-8-24/h9-10,17,22-24,28,35H,4-8,11-16,18-21H2,1-3H3,(H,31,36)/t22-,23-,28+/m1/s1	ICTRKSOOJQUIHO-MRJKTFCFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)CCN4CCOCC4)cc3C1=O	BroadT	BRD-K88080089	BRD-K88080089-001-01-4	Broad Institute of MIT and Harvard	BRD-K88080089			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2C1=O	InChI=1S/C30H48N4O5/c1-22-18-34(23(2)21-35)30(37)26-17-25(31-29(36)11-12-33-13-15-38-16-14-33)9-10-27(26)39-28(22)20-32(3)19-24-7-5-4-6-8-24/h9-10,17,22-24,28,35H,4-8,11-16,18-21H2,1-3H3,(H,31,36)/t22-,23-,28+/m1/s1	ICTRKSOOJQUIHO-MRJKTFCFSA-N	544.362470676							111683
BRD-K99755021	LSM-23098		44495865	InChI=1S/C30H37F3N4O6/c1-18-15-37(19(2)17-38)28(40)23-5-4-6-24(35-27(39)20-11-13-42-14-12-20)26(23)43-25(18)16-36(3)29(41)34-22-9-7-21(8-10-22)30(31,32)33/h4-10,18-20,25,38H,11-17H2,1-3H3,(H,34,41)(H,35,39)/t18-,19+,25-/m1/s1	TZPMNVZBAPWBQT-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)C4CCOCC4)cccc3C1=O	BroadT	BRD-K99755021	BRD-K99755021-001-01-9	Broad Institute of MIT and Harvard	BRD-K99755021			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C30H37F3N4O6/c1-18-15-37(19(2)17-38)28(40)23-5-4-6-24(35-27(39)20-11-13-42-14-12-20)26(23)43-25(18)16-36(3)29(41)34-22-9-7-21(8-10-22)30(31,32)33/h4-10,18-20,25,38H,11-17H2,1-3H3,(H,34,41)(H,35,39)/t18-,19+,25-/m1/s1	TZPMNVZBAPWBQT-HHJKRLRDSA-N	606.266519544							111684
BRD-K73319773	LSM-23099		44483783	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15-,19+/m1/s1	YQJJHWKDDJGBPX-CLCXKQKWSA-N	CNC[C@@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K73319773	BRD-K73319773-001-01-4	Broad Institute of MIT and Harvard	BRD-K73319773			CNC[C@@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15-,19+/m1/s1	YQJJHWKDDJGBPX-CLCXKQKWSA-N	468.183126106							111685
BRD-K07667635	LSM-23100		44493416	InChI=1S/C30H37F3N4O6/c1-18-15-37(19(2)17-38)28(40)23-5-4-6-24(35-27(39)20-11-13-42-14-12-20)26(23)43-25(18)16-36(3)29(41)34-22-9-7-21(8-10-22)30(31,32)33/h4-10,18-20,25,38H,11-17H2,1-3H3,(H,34,41)(H,35,39)/t18-,19-,25+/m1/s1	TZPMNVZBAPWBQT-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)C4CCOCC4)cccc3C1=O	BroadT	BRD-K07667635	BRD-K07667635-001-01-5	Broad Institute of MIT and Harvard	BRD-K07667635			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C30H37F3N4O6/c1-18-15-37(19(2)17-38)28(40)23-5-4-6-24(35-27(39)20-11-13-42-14-12-20)26(23)43-25(18)16-36(3)29(41)34-22-9-7-21(8-10-22)30(31,32)33/h4-10,18-20,25,38H,11-17H2,1-3H3,(H,34,41)(H,35,39)/t18-,19-,25+/m1/s1	TZPMNVZBAPWBQT-RRQZXNHTSA-N	606.266519544							111686
BRD-K11020797	LSM-23101		44493861	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)17-8-16(6-7-18(17)31-19(12)9-23-5)24-22(30)25-20-14(3)26-32-15(20)4/h6-8,12-13,19,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13-,19-/m0/s1	HGTBFUICODGLJG-JMERFSKESA-N	CNC[C@@H]1Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K11020797	BRD-K11020797-001-01-5	Broad Institute of MIT and Harvard	BRD-K11020797			CNC[C@@H]1Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)17-8-16(6-7-18(17)31-19(12)9-23-5)24-22(30)25-20-14(3)26-32-15(20)4/h6-8,12-13,19,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13-,19-/m0/s1	HGTBFUICODGLJG-JMERFSKESA-N	445.232519142							111687
BRD-K74506886	LSM-15052		44499215	InChI=1S/C28H39N5O4/c1-19-15-33(20(2)18-34)28(36)22-10-7-11-23(31-27(35)24-14-29-12-13-30-24)26(22)37-25(19)17-32(3)16-21-8-5-4-6-9-21/h7,10-14,19-21,25,34H,4-6,8-9,15-18H2,1-3H3,(H,31,35)/t19-,20+,25-/m1/s1	QUBNYOYZPRCGDK-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K74506886	BRD-K74506886-001-01-9	Broad Institute of MIT and Harvard	BRD-K74506886			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H39N5O4/c1-19-15-33(20(2)18-34)28(36)22-10-7-11-23(31-27(35)24-14-29-12-13-30-24)26(22)37-25(19)17-32(3)16-21-8-5-4-6-9-21/h7,10-14,19-21,25,34H,4-6,8-9,15-18H2,1-3H3,(H,31,35)/t19-,20+,25-/m1/s1	QUBNYOYZPRCGDK-OHUGHZGNSA-N	509.300204778							103708
CHEMBL2139532	LSM-23102	SID85804883, BRD-K09826625	44497980	InChI=1S/C30H36N4O6S/c1-20-13-15-24(16-14-20)41(38,39)33(4)18-27-21(2)17-34(22(3)19-35)29(36)25-11-8-12-26(28(25)40-27)32-30(37)31-23-9-6-5-7-10-23/h5-16,21-22,27,35H,17-19H2,1-4H3,(H2,31,32,37)/t21-,22+,27-/m1/s1	KABIQBXSOPPDGJ-UMTXDNHDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3c(NC(=O)Nc4ccccc4)cccc3C1=O	BroadT	BRD-K09826625	BRD-K09826625-001-01-7	Broad Institute of MIT and Harvard	BRD-K09826625			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	InChI=1S/C30H36N4O6S/c1-20-13-15-24(16-14-20)41(38,39)33(4)18-27-21(2)17-34(22(3)19-35)29(36)25-11-8-12-26(28(25)40-27)32-30(37)31-23-9-6-5-7-10-23/h5-16,21-22,27,35H,17-19H2,1-4H3,(H2,31,32,37)/t21-,22+,27-/m1/s1	KABIQBXSOPPDGJ-UMTXDNHDSA-N	580.235555602							111688
BRD-K21196372	LSM-23103		44496131	InChI=1S/C28H31Cl2N5O4/c1-17-13-35(18(2)16-36)28(38)20-5-4-6-23(33-27(37)24-12-31-9-10-32-24)26(20)39-25(17)15-34(3)14-19-7-8-21(29)22(30)11-19/h4-12,17-18,25,36H,13-16H2,1-3H3,(H,33,37)/t17-,18-,25+/m1/s1	KGMOSJADCSKDLW-GAKIBJFNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K21196372	BRD-K21196372-001-01-4	Broad Institute of MIT and Harvard	BRD-K21196372			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H31Cl2N5O4/c1-17-13-35(18(2)16-36)28(38)20-5-4-6-23(33-27(37)24-12-31-9-10-32-24)26(20)39-25(17)15-34(3)14-19-7-8-21(29)22(30)11-19/h4-12,17-18,25,36H,13-16H2,1-3H3,(H,33,37)/t17-,18-,25+/m1/s1	KGMOSJADCSKDLW-GAKIBJFNSA-N	571.175309942							111689
CHEMBL2355586	LSM-6779	BRD-K86027709, SID85813532	44506424	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)26-16-25(35(3)4)14-15-29(26)41-30(21)19-36(5)18-23-10-12-24(13-11-23)31(39)34-28-9-7-6-8-27(28)33/h6-16,21-22,30,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,30+/m1/s1	QVMJLFZOFFUGMH-DGIFUFQNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K86027709	BRD-K86027709-001-01-7	Broad Institute of MIT and Harvard	BRD-K86027709			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)26-16-25(35(3)4)14-15-29(26)41-30(21)19-36(5)18-23-10-12-24(13-11-23)31(39)34-28-9-7-6-8-27(28)33/h6-16,21-22,30,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22+,30+/m1/s1	QVMJLFZOFFUGMH-DGIFUFQNSA-N	559.315854842							95400
BRD-K38788176	LSM-23104		44493808	InChI=1S/C22H28N4O4/c1-14-12-26(15(2)13-27)22(29)18-10-17(4-5-19(18)30-20(14)11-23-3)25-21(28)16-6-8-24-9-7-16/h4-10,14-15,20,23,27H,11-13H2,1-3H3,(H,25,28)/t14-,15+,20-/m1/s1	ZXKRGMHNDBNPIZ-QEEYODRMSA-N	CNC[C@H]1Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K38788176	BRD-K38788176-001-01-7	Broad Institute of MIT and Harvard	BRD-K38788176			CNC[C@H]1Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C22H28N4O4/c1-14-12-26(15(2)13-27)22(29)18-10-17(4-5-19(18)30-20(14)11-23-3)25-21(28)16-6-8-24-9-7-16/h4-10,14-15,20,23,27H,11-13H2,1-3H3,(H,25,28)/t14-,15+,20-/m1/s1	ZXKRGMHNDBNPIZ-QEEYODRMSA-N	412.211055416							111690
BRD-K13206026	LSM-23105		44502641	InChI=1S/C29H35F3N4O7/c1-17-13-36(18(2)15-37)27(39)11-19-10-20(33-26(38)8-9-29(30,31)32)4-6-22(19)43-25(17)14-35(3)28(40)34-21-5-7-23-24(12-21)42-16-41-23/h4-7,10,12,17-18,25,37H,8-9,11,13-16H2,1-3H3,(H,33,38)(H,34,40)/t17-,18-,25+/m0/s1	PUSPJJJYURZHGK-DPOKWSEZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCC(F)(F)F)cc4CC1=O	BroadT	BRD-K13206026	BRD-K13206026-001-01-1	Broad Institute of MIT and Harvard	BRD-K13206026			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C29H35F3N4O7/c1-17-13-36(18(2)15-37)27(39)11-19-10-20(33-26(38)8-9-29(30,31)32)4-6-22(19)43-25(17)14-35(3)28(40)34-21-5-7-23-24(12-21)42-16-41-23/h4-7,10,12,17-18,25,37H,8-9,11,13-16H2,1-3H3,(H,33,38)(H,34,40)/t17-,18-,25+/m0/s1	PUSPJJJYURZHGK-DPOKWSEZSA-N	608.2457841							111691
BRD-K81272371	LSM-23106		44496552	InChI=1S/C29H36N4O5S/c1-20-8-10-24(11-9-20)39(36,37)31-26-7-5-6-25-28(26)38-27(18-32(4)17-23-12-14-30-15-13-23)21(2)16-33(29(25)35)22(3)19-34/h5-15,21-22,27,31,34H,16-19H2,1-4H3/t21-,22-,27+/m1/s1	JBHIQUJYWNKFSD-LOYIFYEOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc3c(NS(=O)(=O)c4ccc(C)cc4)cccc3C1=O	BroadT	BRD-K81272371	BRD-K81272371-001-01-1	Broad Institute of MIT and Harvard	BRD-K81272371			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc2c(NS(=O)(=O)c3ccc(C)cc3)cccc2C1=O	InChI=1S/C29H36N4O5S/c1-20-8-10-24(11-9-20)39(36,37)31-26-7-5-6-25-28(26)38-27(18-32(4)17-23-12-14-30-15-13-23)21(2)16-33(29(25)35)22(3)19-34/h5-15,21-22,27,31,34H,16-19H2,1-4H3/t21-,22-,27+/m1/s1	JBHIQUJYWNKFSD-LOYIFYEOSA-N	552.240640982							111692
BRD-K30661365	LSM-23107		44495919	InChI=1S/C30H41ClN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h9-15,20-21,24,28,36H,4-8,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28+/m1/s1	XMVMBOAJKPBQKX-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3ccc(NC(=O)NC4CCCCC4)cc3CC1=O	BroadT	BRD-K30661365	BRD-K30661365-001-01-5	Broad Institute of MIT and Harvard	BRD-K30661365			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)NC3CCCCC3)cc2CC1=O	InChI=1S/C30H41ClN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h9-15,20-21,24,28,36H,4-8,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28+/m1/s1	XMVMBOAJKPBQKX-CJYOKPGZSA-N	620.243533472							111693
BRD-K41132979	LSM-23108		44491192	InChI=1S/C28H38N4O6/c1-17(2)29-28(37)30-22-10-11-24-23(12-22)26(34)32(19(4)16-33)13-18(3)25(38-24)15-31(5)14-20-6-8-21(9-7-20)27(35)36/h6-12,17-19,25,33H,13-16H2,1-5H3,(H,35,36)(H2,29,30,37)/t18-,19+,25-/m0/s1	IVCWXLSTMUVHLA-CEYNDMKZSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K41132979	BRD-K41132979-001-01-2	Broad Institute of MIT and Harvard	BRD-K41132979			CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H38N4O6/c1-17(2)29-28(37)30-22-10-11-24-23(12-22)26(34)32(19(4)16-33)13-18(3)25(38-24)15-31(5)14-20-6-8-21(9-7-20)27(35)36/h6-12,17-19,25,33H,13-16H2,1-5H3,(H,35,36)(H2,29,30,37)/t18-,19+,25-/m0/s1	IVCWXLSTMUVHLA-CEYNDMKZSA-N	526.279134976							111694
BRD-K30682979	LSM-23109		44503335	InChI=1S/C32H45N5O6/c1-21-18-37(22(2)20-38)30(39)17-23-16-26(34-31(40)33-24-8-6-5-7-9-24)12-15-28(23)43-29(21)19-36(3)32(41)35-25-10-13-27(42-4)14-11-25/h10-16,21-22,24,29,38H,5-9,17-20H2,1-4H3,(H,35,41)(H2,33,34,40)/t21-,22-,29+/m0/s1	SMGQOPDVSHJVMI-IHMCZWCLSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)NC4CCCCC4)cc3CC(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K30682979	BRD-K30682979-001-01-9	Broad Institute of MIT and Harvard	BRD-K30682979			COc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)NC4CCCCC4)cc3CC(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C32H45N5O6/c1-21-18-37(22(2)20-38)30(39)17-23-16-26(34-31(40)33-24-8-6-5-7-9-24)12-15-28(23)43-29(21)19-36(3)32(41)35-25-10-13-27(42-4)14-11-25/h10-16,21-22,24,29,38H,5-9,17-20H2,1-4H3,(H,35,41)(H2,33,34,40)/t21-,22-,29+/m0/s1	SMGQOPDVSHJVMI-IHMCZWCLSA-N	595.33698421							111695
BRD-K37285826	LSM-23110		44486698	InChI=1S/C28H36F3N5O5/c1-16(2)32-27(40)35(5)14-24-17(3)13-36(18(4)15-37)25(38)22-12-21(10-11-23(22)41-24)34-26(39)33-20-8-6-19(7-9-20)28(29,30)31/h6-12,16-18,24,37H,13-15H2,1-5H3,(H,32,40)(H2,33,34,39)/t17-,18+,24-/m1/s1	GUUFQQDCAZBWHX-NXMSCROESA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K37285826	BRD-K37285826-001-01-9	Broad Institute of MIT and Harvard	BRD-K37285826			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H36F3N5O5/c1-16(2)32-27(40)35(5)14-24-17(3)13-36(18(4)15-37)25(38)22-12-21(10-11-23(22)41-24)34-26(39)33-20-8-6-19(7-9-20)28(29,30)31/h6-12,16-18,24,37H,13-15H2,1-5H3,(H,32,40)(H2,33,34,39)/t17-,18+,24-/m1/s1	GUUFQQDCAZBWHX-NXMSCROESA-N	579.266853902							111696
BRD-K98207175	LSM-23111		44486002	InChI=1S/C29H40N4O4/c1-20-16-33(21(2)19-34)29(36)25-15-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)37-27(20)18-32(3)17-22-7-5-4-6-8-22/h9-15,20-22,27,34H,4-8,16-19H2,1-3H3,(H,31,35)/t20-,21+,27-/m0/s1	FYESYKULLQIDLV-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K98207175	BRD-K98207175-001-01-6	Broad Institute of MIT and Harvard	BRD-K98207175			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H40N4O4/c1-20-16-33(21(2)19-34)29(36)25-15-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)37-27(20)18-32(3)17-22-7-5-4-6-8-22/h9-15,20-22,27,34H,4-8,16-19H2,1-3H3,(H,31,35)/t20-,21+,27-/m0/s1	FYESYKULLQIDLV-ISCCLHIJSA-N	508.3049558							111697
BRD-K35945596	LSM-23112		44484982	InChI=1S/C20H29N5O5S/c1-13-9-25(14(2)11-26)20(27)15-6-5-7-16(19(15)30-17(13)8-21-3)23-31(28,29)18-10-24(4)12-22-18/h5-7,10,12-14,17,21,23,26H,8-9,11H2,1-4H3/t13-,14-,17-/m1/s1	KOTZITAVGRXIOH-CKEIUWERSA-N	CNC[C@H]1Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K35945596	BRD-K35945596-001-01-8	Broad Institute of MIT and Harvard	BRD-K35945596			CNC[C@H]1Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C20H29N5O5S/c1-13-9-25(14(2)11-26)20(27)15-6-5-7-16(19(15)30-17(13)8-21-3)23-31(28,29)18-10-24(4)12-22-18/h5-7,10,12-14,17,21,23,26H,8-9,11H2,1-4H3/t13-,14-,17-/m1/s1	KOTZITAVGRXIOH-CKEIUWERSA-N	451.188939768							111698
BRD-K78785607	LSM-23113		44489138	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)16-7-6-8-17(20(16)31-18(12)9-23-5)24-22(30)25-19-14(3)26-32-15(19)4/h6-8,12-13,18,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13+,18+/m1/s1	MPDMLCBONFVZSW-VBHSOAQHSA-N	CNC[C@@H]1Oc2c(NC(=O)Nc3c(C)onc3C)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K78785607	BRD-K78785607-001-01-3	Broad Institute of MIT and Harvard	BRD-K78785607			CNC[C@@H]1Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)16-7-6-8-17(20(16)31-18(12)9-23-5)24-22(30)25-19-14(3)26-32-15(19)4/h6-8,12-13,18,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13+,18+/m1/s1	MPDMLCBONFVZSW-VBHSOAQHSA-N	445.232519142							111699
CHEMBL2135405	LSM-23114	BRD-K06997715, SID85813504	44506396	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)26-16-25(35(3)4)14-15-29(26)41-30(21)19-36(5)18-23-10-12-24(13-11-23)31(39)34-28-9-7-6-8-27(28)33/h6-16,21-22,30,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,30-/m1/s1	QVMJLFZOFFUGMH-NPKFRGRUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K06997715	BRD-K06997715-001-01-0	Broad Institute of MIT and Harvard	BRD-K06997715			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)26-16-25(35(3)4)14-15-29(26)41-30(21)19-36(5)18-23-10-12-24(13-11-23)31(39)34-28-9-7-6-8-27(28)33/h6-16,21-22,30,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,30-/m1/s1	QVMJLFZOFFUGMH-NPKFRGRUSA-N	559.315854842							111700
BRD-K87432281	LSM-23115		44484713	InChI=1S/C23H35N3O4/c1-15-13-26(16(2)14-27)23(29)19-11-18(9-10-20(19)30-21(15)12-24-3)25-22(28)17-7-5-4-6-8-17/h9-11,15-17,21,24,27H,4-8,12-14H2,1-3H3,(H,25,28)/t15-,16-,21+/m0/s1	NQJCYDIBEOZMBZ-CKJXQJPGSA-N	CNC[C@H]1Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K87432281	BRD-K87432281-001-01-4	Broad Institute of MIT and Harvard	BRD-K87432281			CNC[C@H]1Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H35N3O4/c1-15-13-26(16(2)14-27)23(29)19-11-18(9-10-20(19)30-21(15)12-24-3)25-22(28)17-7-5-4-6-8-17/h9-11,15-17,21,24,27H,4-8,12-14H2,1-3H3,(H,25,28)/t15-,16-,21+/m0/s1	NQJCYDIBEOZMBZ-CKJXQJPGSA-N	417.26275663							111701
BRD-K54622858	LSM-23116		44498738	InChI=1S/C26H35N3O5/c1-17-12-29(18(2)15-30)26(31)20-7-6-8-21(27(3)4)25(20)34-24(17)14-28(5)13-19-9-10-22-23(11-19)33-16-32-22/h6-11,17-18,24,30H,12-16H2,1-5H3/t17-,18+,24+/m1/s1	MTQIGCHWPBYMPN-YTZAWJCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K54622858	BRD-K54622858-001-01-2	Broad Institute of MIT and Harvard	BRD-K54622858			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H35N3O5/c1-17-12-29(18(2)15-30)26(31)20-7-6-8-21(27(3)4)25(20)34-24(17)14-28(5)13-19-9-10-22-23(11-19)33-16-32-22/h6-11,17-18,24,30H,12-16H2,1-5H3/t17-,18+,24+/m1/s1	MTQIGCHWPBYMPN-YTZAWJCFSA-N	469.25767125							111702
BRD-K55874407	LSM-23117		44490039	InChI=1S/C30H41F3N4O4/c1-20-16-37(21(2)19-38)29(40)25-15-24(34-28(39)7-6-14-35(3)4)12-13-26(25)41-27(20)18-36(5)17-22-8-10-23(11-9-22)30(31,32)33/h8-13,15,20-21,27,38H,6-7,14,16-19H2,1-5H3,(H,34,39)/t20-,21-,27+/m0/s1	DDFOXWCTSAMXEO-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K55874407	BRD-K55874407-001-01-4	Broad Institute of MIT and Harvard	BRD-K55874407			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C30H41F3N4O4/c1-20-16-37(21(2)19-38)29(40)25-15-24(34-28(39)7-6-14-35(3)4)12-13-26(25)41-27(20)18-36(5)17-22-8-10-23(11-9-22)30(31,32)33/h8-13,15,20-21,27,38H,6-7,14,16-19H2,1-5H3,(H,34,39)/t20-,21-,27+/m0/s1	DDFOXWCTSAMXEO-NOMHHCBYSA-N	578.307990432							111703
BRD-K21132903	LSM-23118		44496140	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16-,20+/m0/s1	DJIXJENXBPUHIX-TWOQFEAHSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K21132903	BRD-K21132903-001-01-7	Broad Institute of MIT and Harvard	BRD-K21132903			CC(C)NC(=O)N(C)C[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16-,20+/m0/s1	DJIXJENXBPUHIX-TWOQFEAHSA-N	460.268570292							111704
BRD-K02828278	LSM-23119		44501624	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28-/m1/s1	WWNAWZZZIRHUSD-UMQWNRPGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)Nc4ccccc4)cc3CC1=O	BroadT	BRD-K02828278	BRD-K02828278-001-01-0	Broad Institute of MIT and Harvard	BRD-K02828278			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28-/m1/s1	WWNAWZZZIRHUSD-UMQWNRPGSA-N	598.22613377							111705
BRD-K12048660	LSM-23120		44490030	InChI=1S/C21H33N3O5S/c1-14-10-24(15(2)13-25)21(26)18-9-17(22-30(4,27)28)7-8-19(18)29-20(14)12-23(3)11-16-5-6-16/h7-9,14-16,20,22,25H,5-6,10-13H2,1-4H3/t14-,15-,20+/m0/s1	BGZVNGLBILQJCV-AUSJPIAWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K12048660	BRD-K12048660-001-01-9	Broad Institute of MIT and Harvard	BRD-K12048660			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C21H33N3O5S/c1-14-10-24(15(2)13-25)21(26)18-9-17(22-30(4,27)28)7-8-19(18)29-20(14)12-23(3)11-16-5-6-16/h7-9,14-16,20,22,25H,5-6,10-13H2,1-4H3/t14-,15-,20+/m0/s1	BGZVNGLBILQJCV-AUSJPIAWSA-N	439.214091876							111706
BRD-K67399222	LSM-23121		44484716	InChI=1S/C30H35N3O7S/c1-20-15-33(21(2)18-34)30(35)25-14-23(31-41(36,37)24-7-5-4-6-8-24)10-12-26(25)40-29(20)17-32(3)16-22-9-11-27-28(13-22)39-19-38-27/h4-14,20-21,29,31,34H,15-19H2,1-3H3/t20-,21-,29+/m0/s1	YPROYXXRHQGNKF-LRZFZUCMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NS(=O)(=O)c5ccccc5)cc4C1=O	BroadT	BRD-K67399222	BRD-K67399222-001-01-1	Broad Institute of MIT and Harvard	BRD-K67399222			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H35N3O7S/c1-20-15-33(21(2)18-34)30(35)25-14-23(31-41(36,37)24-7-5-4-6-8-24)10-12-26(25)40-29(20)17-32(3)16-22-9-11-27-28(13-22)39-19-38-27/h4-14,20-21,29,31,34H,15-19H2,1-3H3/t20-,21-,29+/m0/s1	YPROYXXRHQGNKF-LRZFZUCMSA-N	581.21957118							111707
CHEMBL2355221	LSM-23122	BRD-K76175734, SID85792697	44486236	InChI=1S/C30H39N3O7/c1-19-14-33(20(2)17-34)30(36)23-5-4-6-24(31-29(35)22-9-11-37-12-10-22)28(23)40-27(19)16-32(3)15-21-7-8-25-26(13-21)39-18-38-25/h4-8,13,19-20,22,27,34H,9-12,14-18H2,1-3H3,(H,31,35)/t19-,20+,27-/m0/s1	NQBSYXGUJZNUSC-VKIDHGPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K76175734	BRD-K76175734-001-01-5	Broad Institute of MIT and Harvard	BRD-K76175734			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C30H39N3O7/c1-19-14-33(20(2)17-34)30(36)23-5-4-6-24(31-29(35)22-9-11-37-12-10-22)28(23)40-27(19)16-32(3)15-21-7-8-25-26(13-21)39-18-38-25/h4-8,13,19-20,22,27,34H,9-12,14-18H2,1-3H3,(H,31,35)/t19-,20+,27-/m0/s1	NQBSYXGUJZNUSC-VKIDHGPPSA-N	553.278800618							111708
BRD-K39489370	LSM-23123		44493990	InChI=1S/C21H31N7O4/c1-14-9-28(15(2)12-29)21(31)8-16-7-17(23-20(30)11-27-13-22-24-25-27)5-6-18(16)32-19(14)10-26(3)4/h5-7,13-15,19,29H,8-12H2,1-4H3,(H,23,30)/t14-,15+,19-/m1/s1	FEGVFSOLSHLDDV-ZRGWGRIASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	BroadT	BRD-K39489370	BRD-K39489370-001-01-5	Broad Institute of MIT and Harvard	BRD-K39489370			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	InChI=1S/C21H31N7O4/c1-14-9-28(15(2)12-29)21(31)8-16-7-17(23-20(30)11-27-13-22-24-25-27)5-6-18(16)32-19(14)10-26(3)4/h5-7,13-15,19,29H,8-12H2,1-4H3,(H,23,30)/t14-,15+,19-/m1/s1	FEGVFSOLSHLDDV-ZRGWGRIASA-N	445.243752542							111709
BRD-K02251932	LSM-23124		44486219	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-41(38,39)23-14-12-21(30)13-15-23)27(24)40-26(19)17-33(3)29(37)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,26,32,35H,4-6,8-9,16-18H2,1-3H3,(H,31,37)/t19-,20+,26-/m0/s1	PZASEUVCJBPSCE-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3c(NS(=O)(=O)c4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K02251932	BRD-K02251932-001-01-3	Broad Institute of MIT and Harvard	BRD-K02251932			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C1=O	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-41(38,39)23-14-12-21(30)13-15-23)27(24)40-26(19)17-33(3)29(37)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,26,32,35H,4-6,8-9,16-18H2,1-3H3,(H,31,37)/t19-,20+,26-/m0/s1	PZASEUVCJBPSCE-UNVFRBQDSA-N	590.257433898							111710
BRD-K22875065	LSM-23125		44484876	InChI=1S/C23H30N4O6S/c1-15-12-27(16(2)14-28)23(30)19-11-18(25-22(29)17-7-9-24-10-8-17)5-6-20(19)33-21(15)13-26(3)34(4,31)32/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21-/m0/s1	WMAXTMTUHGJOAC-QYWGDWMGSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K22875065	BRD-K22875065-001-01-4	Broad Institute of MIT and Harvard	BRD-K22875065			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C23H30N4O6S/c1-15-12-27(16(2)14-28)23(30)19-11-18(25-22(29)17-7-9-24-10-8-17)5-6-20(19)33-21(15)13-26(3)34(4,31)32/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21-/m0/s1	WMAXTMTUHGJOAC-QYWGDWMGSA-N	490.18860541							111711
BRD-K97128200	LSM-23126		54613821	InChI=1S/C29H33ClN4O6S/c1-19-16-34(20(2)18-35)28(36)25-15-23(32-41(38,39)24-12-9-21(30)10-13-24)11-14-26(25)40-27(19)17-33(3)29(37)31-22-7-5-4-6-8-22/h4-15,19-20,27,32,35H,16-18H2,1-3H3,(H,31,37)/t19-,20-,27+/m0/s1	JEFIXRBRGXHONI-OWOAZTCBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K97128200	BRD-K97128200-001-01-4	Broad Institute of MIT and Harvard	BRD-K97128200			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H33ClN4O6S/c1-19-16-34(20(2)18-35)28(36)25-15-23(32-41(38,39)24-12-9-21(30)10-13-24)11-14-26(25)40-27(19)17-33(3)29(37)31-22-7-5-4-6-8-22/h4-15,19-20,27,32,35H,16-18H2,1-3H3,(H,31,37)/t19-,20-,27+/m0/s1	JEFIXRBRGXHONI-OWOAZTCBSA-N	600.180933216							111712
BRD-K27680690	LSM-23127		44492452	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17+,22+/m1/s1	FXDXYRRSNQUVQL-JLHGSKIFSA-N	CNC[C@@H]1Oc2c(NC(=O)c3ccc(cc3)c4nccs4)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K27680690	BRD-K27680690-001-01-6	Broad Institute of MIT and Harvard	BRD-K27680690			CNC[C@@H]1Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17+,22+/m1/s1	FXDXYRRSNQUVQL-JLHGSKIFSA-N	494.19877617							111713
CHEMBL2136991	LSM-23128	BRD-K47783463, SID85792153	44485701	InChI=1S/C30H42ClN3O5S/c1-21-17-34(22(2)20-35)30(36)16-24-15-26(32-40(37,38)27-12-9-25(31)10-13-27)11-14-28(24)39-29(21)19-33(3)18-23-7-5-4-6-8-23/h9-15,21-23,29,32,35H,4-8,16-20H2,1-3H3/t21-,22-,29+/m0/s1	YELAEPJECDEDIZ-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3CC1=O	BroadT	BRD-K47783463	BRD-K47783463-001-01-9	Broad Institute of MIT and Harvard	BRD-K47783463			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2CC1=O	InChI=1S/C30H42ClN3O5S/c1-21-17-34(22(2)20-35)30(36)16-24-15-26(32-40(37,38)27-12-9-25(31)10-13-27)11-14-28(24)39-29(21)19-33(3)18-23-7-5-4-6-8-23/h9-15,21-23,29,32,35H,4-8,16-20H2,1-3H3/t21-,22-,29+/m0/s1	YELAEPJECDEDIZ-IHMCZWCLSA-N	591.253369874							111714
BRD-K07770425	LSM-23129		44484777	InChI=1S/C28H33ClN4O5S/c1-19-15-33(20(2)18-34)28(35)25-14-23(31-39(36,37)24-7-4-22(29)5-8-24)6-9-26(25)38-27(19)17-32(3)16-21-10-12-30-13-11-21/h4-14,19-20,27,31,34H,15-18H2,1-3H3/t19-,20+,27-/m0/s1	RTDBYDGQKCGXQZ-VKIDHGPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K07770425	BRD-K07770425-001-01-1	Broad Institute of MIT and Harvard	BRD-K07770425			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C28H33ClN4O5S/c1-19-15-33(20(2)18-34)28(35)25-14-23(31-39(36,37)24-7-4-22(29)5-8-24)6-9-26(25)38-27(19)17-32(3)16-21-10-12-30-13-11-21/h4-14,19-20,27,31,34H,15-18H2,1-3H3/t19-,20+,27-/m0/s1	RTDBYDGQKCGXQZ-VKIDHGPPSA-N	572.186018596							111715
MLS002473752	LSM-23130	BRD-K85218343, SID85201291	44202375	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18+,24+/m0/s1	JIVQHRCMRGEILI-HOOSLVGPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3c(NC(=O)C4CC4)cccc3C1=O	BroadT	BRD-K85218343	BRD-K85218343-001-02-3	Broad Institute of MIT and Harvard	BRD-K85218343			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2c(NC(=O)C3CC3)cccc2C1=O	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18+,24+/m0/s1	JIVQHRCMRGEILI-HOOSLVGPSA-N	509.25258587							111716
BRD-K35959379	LSM-23131		44496806	InChI=1S/C34H37N5O5/c1-22-19-39(23(2)21-40)32(41)18-26-17-27(36-33(42)25-13-15-35-16-14-25)11-12-30(26)44-31(22)20-38(3)34(43)37-29-10-6-8-24-7-4-5-9-28(24)29/h4-17,22-23,31,40H,18-21H2,1-3H3,(H,36,42)(H,37,43)/t22-,23+,31-/m1/s1	LDEMJBAJJXLTPL-IKBQMQIHSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)c5ccncc5)cc4CC1=O	BroadT	BRD-K35959379	BRD-K35959379-001-01-2	Broad Institute of MIT and Harvard	BRD-K35959379			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C34H37N5O5/c1-22-19-39(23(2)21-40)32(41)18-26-17-27(36-33(42)25-13-15-35-16-14-25)11-12-30(26)44-31(22)20-38(3)34(43)37-29-10-6-8-24-7-4-5-9-28(24)29/h4-17,22-23,31,40H,18-21H2,1-3H3,(H,36,42)(H,37,43)/t22-,23+,31-/m1/s1	LDEMJBAJJXLTPL-IKBQMQIHSA-N	595.279469334							111717
BRD-K98529522	LSM-23132		44496070	InChI=1S/C30H35N5O6/c1-19-16-35(20(2)18-36)29(38)24-6-5-7-25(33-28(37)21-12-14-31-15-13-21)27(24)41-26(19)17-34(3)30(39)32-22-8-10-23(40-4)11-9-22/h5-15,19-20,26,36H,16-18H2,1-4H3,(H,32,39)(H,33,37)/t19-,20+,26+/m1/s1	YPMOLAXPZMKSMS-GOHWNWGWSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3c(NC(=O)c4ccncc4)cccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K98529522	BRD-K98529522-001-01-3	Broad Institute of MIT and Harvard	BRD-K98529522			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3c(NC(=O)c4ccncc4)cccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C30H35N5O6/c1-19-16-35(20(2)18-36)29(38)24-6-5-7-25(33-28(37)21-12-14-31-15-13-21)27(24)41-26(19)17-34(3)30(39)32-22-8-10-23(40-4)11-9-22/h5-15,19-20,26,36H,16-18H2,1-4H3,(H,32,39)(H,33,37)/t19-,20+,26+/m1/s1	YPMOLAXPZMKSMS-GOHWNWGWSA-N	561.25873389							111718
BRD-K61457932	LSM-23133		44484083	InChI=1S/C30H48N4O5/c1-22-18-34(23(2)21-35)30(37)26-17-25(31-29(36)11-12-33-13-15-38-16-14-33)9-10-27(26)39-28(22)20-32(3)19-24-7-5-4-6-8-24/h9-10,17,22-24,28,35H,4-8,11-16,18-21H2,1-3H3,(H,31,36)/t22-,23-,28+/m0/s1	ICTRKSOOJQUIHO-UXWDXCIHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)CCN4CCOCC4)cc3C1=O	BroadT	BRD-K61457932	BRD-K61457932-001-01-4	Broad Institute of MIT and Harvard	BRD-K61457932			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2C1=O	InChI=1S/C30H48N4O5/c1-22-18-34(23(2)21-35)30(37)26-17-25(31-29(36)11-12-33-13-15-38-16-14-33)9-10-27(26)39-28(22)20-32(3)19-24-7-5-4-6-8-24/h9-10,17,22-24,28,35H,4-8,11-16,18-21H2,1-3H3,(H,31,36)/t22-,23-,28+/m0/s1	ICTRKSOOJQUIHO-UXWDXCIHSA-N	544.362470676							111719
BRD-K61943321	LSM-23134		44483546	InChI=1S/C29H39FN4O7S/c1-20-17-34(21(2)19-35)29(37)25-16-23(31-28(36)10-11-33-12-14-40-15-13-33)6-9-26(25)41-27(20)18-32(3)42(38,39)24-7-4-22(30)5-8-24/h4-9,16,20-21,27,35H,10-15,17-19H2,1-3H3,(H,31,36)/t20-,21+,27-/m0/s1	NKFYFMCKJSWXRC-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)CCN4CCOCC4)cc3C1=O	BroadT	BRD-K61943321	BRD-K61943321-001-01-2	Broad Institute of MIT and Harvard	BRD-K61943321			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2C1=O	InChI=1S/C29H39FN4O7S/c1-20-17-34(21(2)19-35)29(37)25-16-23(31-28(36)10-11-33-12-14-40-15-13-33)6-9-26(25)41-27(20)18-32(3)42(38,39)24-7-4-22(30)5-8-24/h4-9,16,20-21,27,35H,10-15,17-19H2,1-3H3,(H,31,36)/t20-,21+,27-/m0/s1	NKFYFMCKJSWXRC-ISCCLHIJSA-N	606.252348518							111720
BRD-K80298065	LSM-23135		44486686	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)30(6)15-25-19(4)14-31(20(5)16-32)26(33)23-13-21(9-12-24(23)37-25)29-38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,29,32H,14-16H2,1-6H3,(H,28,34)/t19-,20+,25-/m1/s1	HJQIIGSKSQOFKI-OHUGHZGNSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K80298065	BRD-K80298065-001-01-8	Broad Institute of MIT and Harvard	BRD-K80298065			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)30(6)15-25-19(4)14-31(20(5)16-32)26(33)23-13-21(9-12-24(23)37-25)29-38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,29,32H,14-16H2,1-6H3,(H,28,34)/t19-,20+,25-/m1/s1	HJQIIGSKSQOFKI-OHUGHZGNSA-N	546.251205666							111721
CHEMBL2133140	LSM-23136	BRD-K42349777, SID85795059	44488547	InChI=1S/C30H33F3N4O4/c1-19-15-37(20(2)18-38)29(40)24-5-4-6-25(35-28(39)22-11-13-34-14-12-22)27(24)41-26(19)17-36(3)16-21-7-9-23(10-8-21)30(31,32)33/h4-14,19-20,26,38H,15-18H2,1-3H3,(H,35,39)/t19-,20+,26+/m0/s1	KEFKPOALKIRQIF-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K42349777	BRD-K42349777-001-01-5	Broad Institute of MIT and Harvard	BRD-K42349777			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C30H33F3N4O4/c1-19-15-37(20(2)18-38)29(40)24-5-4-6-25(35-28(39)22-11-13-34-14-12-22)27(24)41-26(19)17-36(3)16-21-7-9-23(10-8-21)30(31,32)33/h4-14,19-20,26,38H,15-18H2,1-3H3,(H,35,39)/t19-,20+,26+/m0/s1	KEFKPOALKIRQIF-OUDXUNEISA-N	570.245390176							111722
BRD-K58457304	LSM-23137		44498998	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23-,29-/m1/s1	ZVHZCYJHGRNXGN-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)c4ccc(cc4)c5nccs5)cccc3C1=O	BroadT	BRD-K58457304	BRD-K58457304-001-01-9	Broad Institute of MIT and Harvard	BRD-K58457304			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C1=O	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23-,29-/m1/s1	ZVHZCYJHGRNXGN-VDWGHMIBSA-N	590.292676554							111723
BRD-K72060858	LSM-23138		44493001	InChI=1S/C30H41ClN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h9-15,20-21,24,28,36H,4-8,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28-/m0/s1	XMVMBOAJKPBQKX-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3ccc(NC(=O)NC4CCCCC4)cc3CC1=O	BroadT	BRD-K72060858	BRD-K72060858-001-01-3	Broad Institute of MIT and Harvard	BRD-K72060858			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)NC3CCCCC3)cc2CC1=O	InChI=1S/C30H41ClN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h9-15,20-21,24,28,36H,4-8,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28-/m0/s1	XMVMBOAJKPBQKX-GTNJKRJXSA-N	620.243533472							111724
BRD-K65768622	LSM-23139		44485887	InChI=1S/C31H44N4O6/c1-22-18-35(23(2)21-36)31(38)27-17-25(32-30(37)11-12-34-13-15-40-16-14-34)7-10-28(27)41-29(22)20-33(3)19-24-5-8-26(39-4)9-6-24/h5-10,17,22-23,29,36H,11-16,18-21H2,1-4H3,(H,32,37)/t22-,23-,29+/m0/s1	WZMFZVAQVUXYGZ-SBZVUBOMSA-N	COc1ccc(CN(C)C[C@H]2Oc3ccc(NC(=O)CCN4CCOCC4)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K65768622	BRD-K65768622-001-01-5	Broad Institute of MIT and Harvard	BRD-K65768622			COc1ccc(CN(C)C[C@H]2Oc3ccc(NC(=O)CCN4CCOCC4)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H44N4O6/c1-22-18-35(23(2)21-36)31(38)27-17-25(32-30(37)11-12-34-13-15-40-16-14-34)7-10-28(27)41-29(22)20-33(3)19-24-5-8-26(39-4)9-6-24/h5-10,17,22-23,29,36H,11-16,18-21H2,1-4H3,(H,32,37)/t22-,23-,29+/m0/s1	WZMFZVAQVUXYGZ-SBZVUBOMSA-N	568.326085168							111725
MLS002473915	LSM-23140	BRD-K06168695, SID85201442	44202526	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13+,17+/m0/s1	COTDYGDWXSSLGS-OGHNNQOOSA-N	CNC[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K06168695	BRD-K06168695-001-02-0	Broad Institute of MIT and Harvard	BRD-K06168695			CNC[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13+,17+/m0/s1	COTDYGDWXSSLGS-OGHNNQOOSA-N	375.215806438							111726
BRD-K48339818	LSM-23141		44486195	InChI=1S/C23H34N4O6S/c1-14-11-27(15(2)13-28)23(29)18-9-8-10-19(25(5)6)21(18)32-20(14)12-26(7)34(30,31)22-16(3)24-33-17(22)4/h8-10,14-15,20,28H,11-13H2,1-7H3/t14-,15-,20+/m0/s1	NGTZGERAXWJDKM-AUSJPIAWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)onc2C)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K48339818	BRD-K48339818-001-01-1	Broad Institute of MIT and Harvard	BRD-K48339818			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C23H34N4O6S/c1-14-11-27(15(2)13-28)23(29)18-9-8-10-19(25(5)6)21(18)32-20(14)12-26(7)34(30,31)22-16(3)24-33-17(22)4/h8-10,14-15,20,28H,11-13H2,1-7H3/t14-,15-,20+/m0/s1	NGTZGERAXWJDKM-AUSJPIAWSA-N	494.219905538							111727
BRD-K88964321	LSM-23142		44491431	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14-,18+/m0/s1	WYKJOBISBUCKND-SUNYJGFJSA-N	CNC[C@H]1Oc2ccc(cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K88964321	BRD-K88964321-001-01-7	Broad Institute of MIT and Harvard	BRD-K88964321			CNC[C@H]1Oc2ccc(cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14-,18+/m0/s1	WYKJOBISBUCKND-SUNYJGFJSA-N	349.236541882							111728
BRD-K64902463	LSM-23143		44483803	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)27-16-10-18-29(36-33(42)35-25-13-5-4-6-14-25)31(27)44-30(22)20-38(3)34(43)37-28-17-9-12-24-11-7-8-15-26(24)28/h7-12,15-18,22-23,25,30,40H,4-6,13-14,19-21H2,1-3H3,(H,37,43)(H2,35,36,42)/t22-,23+,30-/m0/s1	DNNIAXRFSGYFCB-BURCIIJTSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)NC5CCCCC5)cccc4C1=O	BroadT	BRD-K64902463	BRD-K64902463-001-01-3	Broad Institute of MIT and Harvard	BRD-K64902463			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)27-16-10-18-29(36-33(42)35-25-13-5-4-6-14-25)31(27)44-30(22)20-38(3)34(43)37-28-17-9-12-24-11-7-8-15-26(24)28/h7-12,15-18,22-23,25,30,40H,4-6,13-14,19-21H2,1-3H3,(H,37,43)(H2,35,36,42)/t22-,23+,30-/m0/s1	DNNIAXRFSGYFCB-BURCIIJTSA-N	601.326419526							111729
BRD-K17675814	LSM-23144		44499643	InChI=1S/C28H31Cl2N5O4/c1-17-13-35(18(2)16-36)28(38)20-5-4-6-23(33-27(37)24-12-31-9-10-32-24)26(20)39-25(17)15-34(3)14-19-7-8-21(29)22(30)11-19/h4-12,17-18,25,36H,13-16H2,1-3H3,(H,33,37)/t17-,18+,25+/m0/s1	KGMOSJADCSKDLW-YYULODDRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K17675814	BRD-K17675814-001-01-9	Broad Institute of MIT and Harvard	BRD-K17675814			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H31Cl2N5O4/c1-17-13-35(18(2)16-36)28(38)20-5-4-6-23(33-27(37)24-12-31-9-10-32-24)26(20)39-25(17)15-34(3)14-19-7-8-21(29)22(30)11-19/h4-12,17-18,25,36H,13-16H2,1-3H3,(H,33,37)/t17-,18+,25+/m0/s1	KGMOSJADCSKDLW-YYULODDRSA-N	571.175309942							111730
BRD-K02471501	LSM-23145		44491375	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)19-7-6-8-22(28(3)4)24(19)33-23(16)14-29(5)13-18-9-10-20(26)21(27)11-18/h6-11,16-17,23,31H,12-15H2,1-5H3/t16-,17-,23-/m1/s1	VYDAAMPIABWJJO-SEPYTNNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K02471501	BRD-K02471501-001-01-8	Broad Institute of MIT and Harvard	BRD-K02471501			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)19-7-6-8-22(28(3)4)24(19)33-23(16)14-29(5)13-18-9-10-20(26)21(27)11-18/h6-11,16-17,23,31H,12-15H2,1-5H3/t16-,17-,23-/m1/s1	VYDAAMPIABWJJO-SEPYTNNBSA-N	493.189897366							111731
BRD-K16147474	LSM-23146		44498493	InChI=1S/C22H36N4O6S/c1-14(2)23-22(29)24-18-7-8-19-17(9-18)10-21(28)26(16(4)13-27)11-15(3)20(32-19)12-25(5)33(6,30)31/h7-9,14-16,20,27H,10-13H2,1-6H3,(H2,23,24,29)/t15-,16+,20-/m0/s1	IDOMJCFPTXQKSJ-YRNRMSPPSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)S(=O)(=O)C)[C@@H](C)CN([C@H](C)CO)C(=O)Cc2c1	BroadT	BRD-K16147474	BRD-K16147474-001-01-1	Broad Institute of MIT and Harvard	BRD-K16147474			CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)S(C)(=O)=O)[C@@H](C)CN([C@H](C)CO)C(=O)Cc2c1	InChI=1S/C22H36N4O6S/c1-14(2)23-22(29)24-18-7-8-19-17(9-18)10-21(28)26(16(4)13-27)11-15(3)20(32-19)12-25(5)33(6,30)31/h7-9,14-16,20,27H,10-13H2,1-6H3,(H2,23,24,29)/t15-,16+,20-/m0/s1	IDOMJCFPTXQKSJ-YRNRMSPPSA-N	484.235555602							111732
BRD-K22093396	LSM-23147		44498983	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)24-10-7-11-25(33-31(38)32-23-8-5-4-6-9-23)29(24)41-28(20)17-34(3)16-22-12-13-26-27(14-22)40-19-39-26/h7,10-14,20-21,23,28,36H,4-6,8-9,15-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28-/m1/s1	QXBUWZYZXJXLTK-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)NC5CCCCC5)cccc4C1=O	BroadT	BRD-K22093396	BRD-K22093396-001-01-4	Broad Institute of MIT and Harvard	BRD-K22093396			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)24-10-7-11-25(33-31(38)32-23-8-5-4-6-9-23)29(24)41-28(20)17-34(3)16-22-12-13-26-27(14-22)40-19-39-26/h7,10-14,20-21,23,28,36H,4-6,8-9,15-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28-/m1/s1	QXBUWZYZXJXLTK-PHVLTXCSSA-N	566.310435104							111733
BRD-K33405962	LSM-23148		44499484	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15-,20+/m0/s1	RAWZADNKXQBMBA-AUSJPIAWSA-N	CNC[C@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K33405962	BRD-K33405962-001-01-1	Broad Institute of MIT and Harvard	BRD-K33405962			CNC[C@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15-,20+/m0/s1	RAWZADNKXQBMBA-AUSJPIAWSA-N	465.173369916							111734
BRD-K49317766	LSM-23149		44493708	InChI=1S/C17H27N3O5S/c1-11-9-20(12(2)10-21)17(22)14-7-13(19-26(4,23)24)5-6-15(14)25-16(11)8-18-3/h5-7,11-12,16,18-19,21H,8-10H2,1-4H3/t11-,12+,16+/m1/s1	HMGKWXPABBQPJW-WQGACYEGSA-N	CNC[C@@H]1Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K49317766	BRD-K49317766-001-01-8	Broad Institute of MIT and Harvard	BRD-K49317766			CNC[C@@H]1Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C17H27N3O5S/c1-11-9-20(12(2)10-21)17(22)14-7-13(19-26(4,23)24)5-6-15(14)25-16(11)8-18-3/h5-7,11-12,16,18-19,21H,8-10H2,1-4H3/t11-,12+,16+/m1/s1	HMGKWXPABBQPJW-WQGACYEGSA-N	385.167141684							111735
BRD-K44260904	LSM-23150		44485732	InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18-,22+/m0/s1	QKNVOCCOOAXREN-NPPFBWRTSA-N	CNC[C@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K44260904	BRD-K44260904-001-01-8	Broad Institute of MIT and Harvard	BRD-K44260904			CNC[C@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18-,22+/m0/s1	QKNVOCCOOAXREN-NPPFBWRTSA-N	462.284220356							111736
BRD-K11008696	LSM-23151		44619357	InChI=1S/C27H39F3N4O5/c1-17-14-34(18(2)16-35)25(37)21-13-20(31-24(36)11-12-27(28,29)30)9-10-22(21)39-23(17)15-33(3)26(38)32-19-7-5-4-6-8-19/h9-10,13,17-19,23,35H,4-8,11-12,14-16H2,1-3H3,(H,31,36)(H,32,38)/t17-,18+,23-/m1/s1	TZWYYOCTWDTYLD-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K11008696	BRD-K11008696-001-01-2	Broad Institute of MIT and Harvard	BRD-K11008696			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H39F3N4O5/c1-17-14-34(18(2)16-35)25(37)21-13-20(31-24(36)11-12-27(28,29)30)9-10-22(21)39-23(17)15-33(3)26(38)32-19-7-5-4-6-8-19/h9-10,13,17-19,23,35H,4-8,11-12,14-16H2,1-3H3,(H,31,36)(H,32,38)/t17-,18+,23-/m1/s1	TZWYYOCTWDTYLD-IEGUWTFLSA-N	556.287254988							111737
CHEMBL2359459	LSM-6810	SID85815169, BRD-K61105081	44507712	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)26-16-25(35(3)4)14-15-29(26)41-30(21)19-36(5)18-23-10-12-24(13-11-23)31(39)34-28-9-7-6-8-27(28)33/h6-16,21-22,30,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,30+/m1/s1	QVMJLFZOFFUGMH-WOGZVKCMSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K61105081	BRD-K61105081-001-01-8	Broad Institute of MIT and Harvard	BRD-K61105081			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H41N5O4/c1-21-17-37(22(2)20-38)32(40)26-16-25(35(3)4)14-15-29(26)41-30(21)19-36(5)18-23-10-12-24(13-11-23)31(39)34-28-9-7-6-8-27(28)33/h6-16,21-22,30,38H,17-20,33H2,1-5H3,(H,34,39)/t21-,22-,30+/m1/s1	QVMJLFZOFFUGMH-WOGZVKCMSA-N	559.315854842							95431
BRD-K46649423	LSM-23152		44486828	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-41(38,39)23-14-12-21(30)13-15-23)27(24)40-26(19)17-33(3)29(37)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,26,32,35H,4-6,8-9,16-18H2,1-3H3,(H,31,37)/t19-,20-,26+/m0/s1	PZASEUVCJBPSCE-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3c(NS(=O)(=O)c4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K46649423	BRD-K46649423-001-01-2	Broad Institute of MIT and Harvard	BRD-K46649423			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C1=O	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-41(38,39)23-14-12-21(30)13-15-23)27(24)40-26(19)17-33(3)29(37)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,26,32,35H,4-6,8-9,16-18H2,1-3H3,(H,31,37)/t19-,20-,26+/m0/s1	PZASEUVCJBPSCE-CUVVAGTFSA-N	590.257433898							111738
BRD-K74600921	LSM-23153		44494834	InChI=1S/C24H37N3O4/c1-16-13-27(17(2)15-28)24(30)19-11-8-12-20(22(19)31-21(16)14-26(3)4)25-23(29)18-9-6-5-7-10-18/h8,11-12,16-18,21,28H,5-7,9-10,13-15H2,1-4H3,(H,25,29)/t16-,17-,21-/m0/s1	ROULRCQEBOLPNZ-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2c(NC(=O)C3CCCCC3)cccc2C1=O	BroadT	BRD-K74600921	BRD-K74600921-001-01-7	Broad Institute of MIT and Harvard	BRD-K74600921			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2c(NC(=O)C3CCCCC3)cccc2C1=O	InChI=1S/C24H37N3O4/c1-16-13-27(17(2)15-28)24(30)19-11-8-12-20(22(19)31-21(16)14-26(3)4)25-23(29)18-9-6-5-7-10-18/h8,11-12,16-18,21,28H,5-7,9-10,13-15H2,1-4H3,(H,25,29)/t16-,17-,21-/m0/s1	ROULRCQEBOLPNZ-FIKGOQFSSA-N	431.278406694							111739
BRD-K78315404	LSM-23154		44487930	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)29-21-11-12-23-22(13-21)25(34)32(19(4)16-33)14-18(3)24(37-23)15-31(5)27(36)30-20-9-7-6-8-10-20/h6-13,17-19,24,33H,14-16H2,1-5H3,(H,30,36)(H2,28,29,35)/t18-,19-,24-/m0/s1	YWOLVGYTMULQAH-JXQFQVJHSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K78315404	BRD-K78315404-001-01-4	Broad Institute of MIT and Harvard	BRD-K78315404			CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)29-21-11-12-23-22(13-21)25(34)32(19(4)16-33)14-18(3)24(37-23)15-31(5)27(36)30-20-9-7-6-8-10-20/h6-13,17-19,24,33H,14-16H2,1-5H3,(H,30,36)(H2,28,29,35)/t18-,19-,24-/m0/s1	YWOLVGYTMULQAH-JXQFQVJHSA-N	511.279469334							111740
BRD-K84483737	LSM-23155		44492038	InChI=1S/C26H36N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h6-13,18-19,24,31H,14-17H2,1-5H3,(H,27,33)/t18-,19-,24+/m0/s1	QJWSWWKQIHLYJD-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K84483737	BRD-K84483737-001-01-0	Broad Institute of MIT and Harvard	BRD-K84483737			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C26H36N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h6-13,18-19,24,31H,14-17H2,1-5H3,(H,27,33)/t18-,19-,24+/m0/s1	QJWSWWKQIHLYJD-AXHZCLLHSA-N	468.273655672							111741
BRD-K36809718	LSM-23156		44501931	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)31(38)17-25-16-27(34-32(39)33-26-10-13-28(40-4)14-11-26)12-15-29(25)41-30(22)20-35(3)19-24-8-6-5-7-9-24/h10-16,22-24,30,37H,5-9,17-21H2,1-4H3,(H2,33,34,39)/t22-,23-,30+/m0/s1	QTHBIZIZCLMCFV-ZTNZZFSWSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)CC4CCCCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)Cc3c2)cc1	BroadT	BRD-K36809718	BRD-K36809718-001-01-8	Broad Institute of MIT and Harvard	BRD-K36809718			COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)CC4CCCCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)Cc3c2)cc1	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)31(38)17-25-16-27(34-32(39)33-26-10-13-28(40-4)14-11-26)12-15-29(25)41-30(22)20-35(3)19-24-8-6-5-7-9-24/h10-16,22-24,30,37H,5-9,17-21H2,1-4H3,(H2,33,34,39)/t22-,23-,30+/m0/s1	QTHBIZIZCLMCFV-ZTNZZFSWSA-N	566.346820612							111742
BRD-K68074655	LSM-23157		44493199	InChI=1S/C29H39FN4O7S/c1-20-17-34(21(2)19-35)29(37)25-16-23(31-28(36)10-11-33-12-14-40-15-13-33)6-9-26(25)41-27(20)18-32(3)42(38,39)24-7-4-22(30)5-8-24/h4-9,16,20-21,27,35H,10-15,17-19H2,1-3H3,(H,31,36)/t20-,21+,27+/m1/s1	NKFYFMCKJSWXRC-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)CCN4CCOCC4)cc3C1=O	BroadT	BRD-K68074655	BRD-K68074655-001-01-5	Broad Institute of MIT and Harvard	BRD-K68074655			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2C1=O	InChI=1S/C29H39FN4O7S/c1-20-17-34(21(2)19-35)29(37)25-16-23(31-28(36)10-11-33-12-14-40-15-13-33)6-9-26(25)41-27(20)18-32(3)42(38,39)24-7-4-22(30)5-8-24/h4-9,16,20-21,27,35H,10-15,17-19H2,1-3H3,(H,31,36)/t20-,21+,27+/m1/s1	NKFYFMCKJSWXRC-BUEREQSYSA-N	606.252348518							111743
BRD-K61796560	LSM-23158		44484997	InChI=1S/C30H39N3O7/c1-19-14-33(20(2)17-34)30(36)23-5-4-6-24(31-29(35)22-9-11-37-12-10-22)28(23)40-27(19)16-32(3)15-21-7-8-25-26(13-21)39-18-38-25/h4-8,13,19-20,22,27,34H,9-12,14-18H2,1-3H3,(H,31,35)/t19-,20-,27-/m1/s1	NQBSYXGUJZNUSC-SEXOINJZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K61796560	BRD-K61796560-001-01-4	Broad Institute of MIT and Harvard	BRD-K61796560			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C30H39N3O7/c1-19-14-33(20(2)17-34)30(36)23-5-4-6-24(31-29(35)22-9-11-37-12-10-22)28(23)40-27(19)16-32(3)15-21-7-8-25-26(13-21)39-18-38-25/h4-8,13,19-20,22,27,34H,9-12,14-18H2,1-3H3,(H,31,35)/t19-,20-,27-/m1/s1	NQBSYXGUJZNUSC-SEXOINJZSA-N	553.278800618							111744
BRD-K73706189	LSM-23159		44485604	InChI=1S/C23H34N4O6S/c1-14-11-27(15(2)13-28)23(29)18-9-8-10-19(25(5)6)21(18)32-20(14)12-26(7)34(30,31)22-16(3)24-33-17(22)4/h8-10,14-15,20,28H,11-13H2,1-7H3/t14-,15+,20-/m1/s1	NGTZGERAXWJDKM-QEEYODRMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)onc2C)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K73706189	BRD-K73706189-001-01-0	Broad Institute of MIT and Harvard	BRD-K73706189			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C23H34N4O6S/c1-14-11-27(15(2)13-28)23(29)18-9-8-10-19(25(5)6)21(18)32-20(14)12-26(7)34(30,31)22-16(3)24-33-17(22)4/h8-10,14-15,20,28H,11-13H2,1-7H3/t14-,15+,20-/m1/s1	NGTZGERAXWJDKM-QEEYODRMSA-N	494.219905538							111745
BRD-K28560109	LSM-23160		44487181	InChI=1S/C23H30N4O6S/c1-15-12-27(16(2)14-28)23(30)19-11-18(25-22(29)17-7-9-24-10-8-17)5-6-20(19)33-21(15)13-26(3)34(4,31)32/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21+/m0/s1	WMAXTMTUHGJOAC-CKJXQJPGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K28560109	BRD-K28560109-001-01-4	Broad Institute of MIT and Harvard	BRD-K28560109			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C23H30N4O6S/c1-15-12-27(16(2)14-28)23(30)19-11-18(25-22(29)17-7-9-24-10-8-17)5-6-20(19)33-21(15)13-26(3)34(4,31)32/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21+/m0/s1	WMAXTMTUHGJOAC-CKJXQJPGSA-N	490.18860541							111746
BRD-K48042736	LSM-23161		44497522	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23+,29-/m1/s1	ZVHZCYJHGRNXGN-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)c4ccc(cc4)c5nccs5)cccc3C1=O	BroadT	BRD-K48042736	BRD-K48042736-001-01-0	Broad Institute of MIT and Harvard	BRD-K48042736			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C1=O	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23+,29-/m1/s1	ZVHZCYJHGRNXGN-RLPNJSHFSA-N	590.292676554							111747
MLS002474059	LSM-23162	BRD-K86089999, SID85201570	44202654	InChI=1S/C29H39N5O5/c1-19-16-34(20(2)18-35)28(37)23-10-7-11-24(32-27(36)21-12-14-30-15-13-21)26(23)39-25(19)17-33(3)29(38)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,25,35H,4-6,8-9,16-18H2,1-3H3,(H,31,38)(H,32,36)/t19-,20+,25+/m0/s1	KKCRHGGATFNVQS-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K86089999	BRD-K86089999-001-02-4	Broad Institute of MIT and Harvard	BRD-K86089999			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C29H39N5O5/c1-19-16-34(20(2)18-35)28(37)23-10-7-11-24(32-27(36)21-12-14-30-15-13-21)26(23)39-25(19)17-33(3)29(38)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,25,35H,4-6,8-9,16-18H2,1-3H3,(H,31,38)(H,32,36)/t19-,20+,25+/m0/s1	KKCRHGGATFNVQS-WZOHSFFVSA-N	537.295119398							111748
BRD-K22014725	LSM-23163		44619613	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)30(6)15-25-19(4)14-31(20(5)16-32)26(33)23-13-21(9-12-24(23)37-25)29-38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,29,32H,14-16H2,1-6H3,(H,28,34)/t19-,20-,25-/m0/s1	HJQIIGSKSQOFKI-RLSLOFABSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K22014725	BRD-K22014725-001-01-2	Broad Institute of MIT and Harvard	BRD-K22014725			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)30(6)15-25-19(4)14-31(20(5)16-32)26(33)23-13-21(9-12-24(23)37-25)29-38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,29,32H,14-16H2,1-6H3,(H,28,34)/t19-,20-,25-/m0/s1	HJQIIGSKSQOFKI-RLSLOFABSA-N	546.251205666							111749
BRD-K98687112	LSM-23164		44493398	InChI=1S/C29H40FN5O5/c1-19-16-35(20(2)18-36)28(38)24-15-23(31-27(37)7-6-14-33(3)4)12-13-25(24)40-26(19)17-34(5)29(39)32-22-10-8-21(30)9-11-22/h8-13,15,19-20,26,36H,6-7,14,16-18H2,1-5H3,(H,31,37)(H,32,39)/t19-,20-,26-/m0/s1	UQFLYQXQOZGCNB-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K98687112	BRD-K98687112-001-01-5	Broad Institute of MIT and Harvard	BRD-K98687112			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H40FN5O5/c1-19-16-35(20(2)18-36)28(38)24-15-23(31-27(37)7-6-14-33(3)4)12-13-25(24)40-26(19)17-34(5)29(39)32-22-10-8-21(30)9-11-22/h8-13,15,19-20,26,36H,6-7,14,16-18H2,1-5H3,(H,31,37)(H,32,39)/t19-,20-,26-/m0/s1	UQFLYQXQOZGCNB-DYLHXGEVSA-N	557.30134763							111750
BRD-K22764346	LSM-23165		44499299	InChI=1S/C30H43N3O6S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-40(36,37)25-15-13-24(38-4)14-16-25)29(26)39-28(21)19-32(3)18-23-9-6-5-7-10-23/h8,11-16,21-23,28,31,34H,5-7,9-10,17-20H2,1-4H3/t21-,22+,28+/m1/s1	VVRSDBHKTRDHNY-WENCSYSZSA-N	COc1ccc(cc1)S(=O)(=O)Nc2cccc3C(=O)N(C[C@@H](C)[C@H](CN(C)CC4CCCCC4)Oc23)[C@@H](C)CO	BroadT	BRD-K22764346	BRD-K22764346-001-01-1	Broad Institute of MIT and Harvard	BRD-K22764346			COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1O[C@@H](CN(C)CC1CCCCC1)[C@H](C)CN([C@@H](C)CO)C2=O	InChI=1S/C30H43N3O6S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-40(36,37)25-15-13-24(38-4)14-16-25)29(26)39-28(21)19-32(3)18-23-9-6-5-7-10-23/h8,11-16,21-23,28,31,34H,5-7,9-10,17-20H2,1-4H3/t21-,22+,28+/m1/s1	VVRSDBHKTRDHNY-WENCSYSZSA-N	573.287256816							111751
BRD-K17097147	LSM-23166		44503902	InChI=1S/C29H35F3N4O7/c1-17-13-36(18(2)15-37)27(39)11-19-10-20(33-26(38)8-9-29(30,31)32)4-6-22(19)43-25(17)14-35(3)28(40)34-21-5-7-23-24(12-21)42-16-41-23/h4-7,10,12,17-18,25,37H,8-9,11,13-16H2,1-3H3,(H,33,38)(H,34,40)/t17-,18+,25-/m0/s1	PUSPJJJYURZHGK-ATLLOTDBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCC(F)(F)F)cc4CC1=O	BroadT	BRD-K17097147	BRD-K17097147-001-01-4	Broad Institute of MIT and Harvard	BRD-K17097147			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C29H35F3N4O7/c1-17-13-36(18(2)15-37)27(39)11-19-10-20(33-26(38)8-9-29(30,31)32)4-6-22(19)43-25(17)14-35(3)28(40)34-21-5-7-23-24(12-21)42-16-41-23/h4-7,10,12,17-18,25,37H,8-9,11,13-16H2,1-3H3,(H,33,38)(H,34,40)/t17-,18+,25-/m0/s1	PUSPJJJYURZHGK-ATLLOTDBSA-N	608.2457841							111752
BRD-K79625345	LSM-23167		44495642	InChI=1S/C31H42N4O6/c1-20-17-35(21(2)19-36)30(38)25-11-8-12-26(33-29(37)22-9-6-5-7-10-22)28(25)41-27(20)18-34(3)31(39)32-23-13-15-24(40-4)16-14-23/h8,11-16,20-22,27,36H,5-7,9-10,17-19H2,1-4H3,(H,32,39)(H,33,37)/t20-,21-,27+/m1/s1	LSKFJJLXCXBANC-GNMOFYLKSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3c(NC(=O)C4CCCCC4)cccc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K79625345	BRD-K79625345-001-01-7	Broad Institute of MIT and Harvard	BRD-K79625345			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3c(NC(=O)C4CCCCC4)cccc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H42N4O6/c1-20-17-35(21(2)19-36)30(38)25-11-8-12-26(33-29(37)22-9-6-5-7-10-22)28(25)41-27(20)18-34(3)31(39)32-23-13-15-24(40-4)16-14-23/h8,11-16,20-22,27,36H,5-7,9-10,17-19H2,1-4H3,(H,32,39)(H,33,37)/t20-,21-,27+/m1/s1	LSKFJJLXCXBANC-GNMOFYLKSA-N	566.310435104							111753
BRD-K42312004	LSM-23168		44499513	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15+,20-/m0/s1	RAWZADNKXQBMBA-MDOVXXIYSA-N	CNC[C@@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K42312004	BRD-K42312004-001-01-8	Broad Institute of MIT and Harvard	BRD-K42312004			CNC[C@@H]1Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)18-5-4-6-19(21(18)31-20(14)11-24-3)25-32(29,30)17-9-7-16(23)8-10-17/h4-10,14-15,20,24-25,27H,11-13H2,1-3H3/t14-,15+,20-/m0/s1	RAWZADNKXQBMBA-MDOVXXIYSA-N	465.173369916							111754
BRD-K96804923	LSM-23169		44493264	InChI=1S/C30H35N3O7S/c1-20-15-33(21(2)18-34)30(35)25-14-23(31-41(36,37)24-7-5-4-6-8-24)10-12-26(25)40-29(20)17-32(3)16-22-9-11-27-28(13-22)39-19-38-27/h4-14,20-21,29,31,34H,15-19H2,1-3H3/t20-,21+,29-/m0/s1	YPROYXXRHQGNKF-FONBTEPMSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NS(=O)(=O)c5ccccc5)cc4C1=O	BroadT	BRD-K96804923	BRD-K96804923-001-01-7	Broad Institute of MIT and Harvard	BRD-K96804923			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H35N3O7S/c1-20-15-33(21(2)18-34)30(35)25-14-23(31-41(36,37)24-7-5-4-6-8-24)10-12-26(25)40-29(20)17-32(3)16-22-9-11-27-28(13-22)39-19-38-27/h4-14,20-21,29,31,34H,15-19H2,1-3H3/t20-,21+,29-/m0/s1	YPROYXXRHQGNKF-FONBTEPMSA-N	581.21957118							111755
BRD-K79053598	LSM-23170		44498980	InChI=1S/C24H37N3O4/c1-16-13-27(17(2)15-28)24(30)19-11-8-12-20(22(19)31-21(16)14-26(3)4)25-23(29)18-9-6-5-7-10-18/h8,11-12,16-18,21,28H,5-7,9-10,13-15H2,1-4H3,(H,25,29)/t16-,17+,21-/m1/s1	ROULRCQEBOLPNZ-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)C3CCCCC3)cccc2C1=O	BroadT	BRD-K79053598	BRD-K79053598-001-01-6	Broad Institute of MIT and Harvard	BRD-K79053598			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)C3CCCCC3)cccc2C1=O	InChI=1S/C24H37N3O4/c1-16-13-27(17(2)15-28)24(30)19-11-8-12-20(22(19)31-21(16)14-26(3)4)25-23(29)18-9-6-5-7-10-18/h8,11-12,16-18,21,28H,5-7,9-10,13-15H2,1-4H3,(H,25,29)/t16-,17+,21-/m1/s1	ROULRCQEBOLPNZ-LLGFUMIMSA-N	431.278406694							111756
BRD-K45503385-001-01-8	LSM-23171	BRD-K45503385	44489111	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)19-7-6-8-22(28(3)4)24(19)33-23(16)14-29(5)13-18-9-10-20(26)21(27)11-18/h6-11,16-17,23,31H,12-15H2,1-5H3/t16-,17+,23+/m0/s1	VYDAAMPIABWJJO-YGKZAACZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K45503385	BRD-K45503385-001-02-6	Broad Institute of MIT and Harvard	BRD-K45503385			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)19-7-6-8-22(28(3)4)24(19)33-23(16)14-29(5)13-18-9-10-20(26)21(27)11-18/h6-11,16-17,23,31H,12-15H2,1-5H3/t16-,17+,23+/m0/s1	VYDAAMPIABWJJO-YGKZAACZSA-N	493.189897366							111757
BRD-K68585948	LSM-23172		44499740	InChI=1S/C28H31Cl2N5O4/c1-17-13-35(18(2)16-36)28(38)20-5-4-6-23(33-27(37)24-12-31-9-10-32-24)26(20)39-25(17)15-34(3)14-19-7-8-21(29)22(30)11-19/h4-12,17-18,25,36H,13-16H2,1-3H3,(H,33,37)/t17-,18+,25-/m1/s1	KGMOSJADCSKDLW-FUMQJTLXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K68585948	BRD-K68585948-001-01-7	Broad Institute of MIT and Harvard	BRD-K68585948			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H31Cl2N5O4/c1-17-13-35(18(2)16-36)28(38)20-5-4-6-23(33-27(37)24-12-31-9-10-32-24)26(20)39-25(17)15-34(3)14-19-7-8-21(29)22(30)11-19/h4-12,17-18,25,36H,13-16H2,1-3H3,(H,33,37)/t17-,18+,25-/m1/s1	KGMOSJADCSKDLW-FUMQJTLXSA-N	571.175309942							111758
BRD-K28665420	LSM-23173		44488577	InChI=1S/C30H39N3O7/c1-19-14-33(20(2)17-34)30(36)23-5-4-6-24(31-29(35)22-9-11-37-12-10-22)28(23)40-27(19)16-32(3)15-21-7-8-25-26(13-21)39-18-38-25/h4-8,13,19-20,22,27,34H,9-12,14-18H2,1-3H3,(H,31,35)/t19-,20+,27+/m1/s1	NQBSYXGUJZNUSC-JVAFGIKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K28665420	BRD-K28665420-001-01-3	Broad Institute of MIT and Harvard	BRD-K28665420			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C30H39N3O7/c1-19-14-33(20(2)17-34)30(36)23-5-4-6-24(31-29(35)22-9-11-37-12-10-22)28(23)40-27(19)16-32(3)15-21-7-8-25-26(13-21)39-18-38-25/h4-8,13,19-20,22,27,34H,9-12,14-18H2,1-3H3,(H,31,35)/t19-,20+,27+/m1/s1	NQBSYXGUJZNUSC-JVAFGIKQSA-N	553.278800618							111759
BRD-K92161160	LSM-23174		44492030	InChI=1S/C32H37F3N4O5/c1-20-17-39(21(2)19-40)30(42)16-23-15-24(36-29(41)13-14-32(33,34)35)11-12-27(23)44-28(20)18-38(3)31(43)37-26-10-6-8-22-7-4-5-9-25(22)26/h4-12,15,20-21,28,40H,13-14,16-19H2,1-3H3,(H,36,41)(H,37,43)/t20-,21-,28+/m0/s1	QFRXUVVOSLWYNG-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)CCC(F)(F)F)cc4CC1=O	BroadT	BRD-K92161160	BRD-K92161160-001-01-8	Broad Institute of MIT and Harvard	BRD-K92161160			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C32H37F3N4O5/c1-20-17-39(21(2)19-40)30(42)16-23-15-24(36-29(41)13-14-32(33,34)35)11-12-27(23)44-28(20)18-38(3)31(43)37-26-10-6-8-22-7-4-5-9-25(22)26/h4-12,15,20-21,28,40H,13-14,16-19H2,1-3H3,(H,36,41)(H,37,43)/t20-,21-,28+/m0/s1	QFRXUVVOSLWYNG-YHGPEZAFSA-N	614.271604924							111760
BRD-K02747732	LSM-23175		44495267	InChI=1S/C30H37N3O5S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-39(4,36)37)29(26)38-28(21)19-32(3)18-23-13-15-25(16-14-23)24-9-6-5-7-10-24/h5-16,21-22,28,31,34H,17-20H2,1-4H3/t21-,22+,28-/m1/s1	YVBCCXLDGZBBDC-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)c3ccccc3)Oc4c(NS(=O)(=O)C)cccc4C1=O	BroadT	BRD-K02747732	BRD-K02747732-001-01-2	Broad Institute of MIT and Harvard	BRD-K02747732			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)-c2ccccc2)Oc2c(NS(C)(=O)=O)cccc2C1=O	InChI=1S/C30H37N3O5S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-39(4,36)37)29(26)38-28(21)19-32(3)18-23-13-15-25(16-14-23)24-9-6-5-7-10-24/h5-16,21-22,28,31,34H,17-20H2,1-4H3/t21-,22+,28-/m1/s1	YVBCCXLDGZBBDC-RZIGYZOXSA-N	551.245392004							111761
BRD-K78816149	LSM-23176		44490732	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16-,20-/m0/s1	GIKJWVQVMSIYNX-FTRWYGJKSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K78816149	BRD-K78816149-001-01-1	Broad Institute of MIT and Harvard	BRD-K78816149			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16-,20-/m0/s1	GIKJWVQVMSIYNX-FTRWYGJKSA-N	420.273655672							131263
BRD-K63716942	LSM-23177		44620367	InChI=1S/C31H38F3N5O5/c1-18-14-39(19(2)17-40)28(41)13-23-12-25(35-30(42)36-29-20(3)37-44-21(29)4)10-11-26(23)43-27(18)16-38(5)15-22-6-8-24(9-7-22)31(32,33)34/h6-12,18-19,27,40H,13-17H2,1-5H3,(H2,35,36,42)/t18-,19+,27+/m0/s1	XNWPWURMKBHVTJ-DSNGTPCMSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3CC1=O	BroadT	BRD-K63716942	BRD-K63716942-001-01-9	Broad Institute of MIT and Harvard	BRD-K63716942			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2CC1=O	InChI=1S/C31H38F3N5O5/c1-18-14-39(19(2)17-40)28(41)13-23-12-25(35-30(42)36-29-20(3)37-44-21(29)4)10-11-26(23)43-27(18)16-38(5)15-22-6-8-24(9-7-22)31(32,33)34/h6-12,18-19,27,40H,13-17H2,1-5H3,(H2,35,36,42)/t18-,19+,27+/m0/s1	XNWPWURMKBHVTJ-DSNGTPCMSA-N	617.282503966							111764
BRD-K31896779	LSM-23178		44484011	InChI=1S/C34H43N5O6/c1-23-20-39(24(2)22-40)33(42)28-19-26(35-32(41)13-14-38-15-17-44-18-16-38)11-12-30(28)45-31(23)21-37(3)34(43)36-29-10-6-8-25-7-4-5-9-27(25)29/h4-12,19,23-24,31,40H,13-18,20-22H2,1-3H3,(H,35,41)(H,36,43)/t23-,24-,31+/m1/s1	NJKSMJYTSLFNSQ-GQIGMWPISA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)CCN5CCOCC5)cc4C1=O	BroadT	BRD-K31896779	BRD-K31896779-001-01-6	Broad Institute of MIT and Harvard	BRD-K31896779			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)CCN3CCOCC3)cc2C1=O	InChI=1S/C34H43N5O6/c1-23-20-39(24(2)22-40)33(42)28-19-26(35-32(41)13-14-38-15-17-44-18-16-38)11-12-30(28)45-31(23)21-37(3)34(43)36-29-10-6-8-25-7-4-5-9-27(25)29/h4-12,19,23-24,31,40H,13-18,20-22H2,1-3H3,(H,35,41)(H,36,43)/t23-,24-,31+/m1/s1	NJKSMJYTSLFNSQ-GQIGMWPISA-N	617.321334146							111765
BRD-K29218077	LSM-23179		44485966	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16-,20+/m0/s1	GIKJWVQVMSIYNX-TWOQFEAHSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K29218077	BRD-K29218077-001-01-6	Broad Institute of MIT and Harvard	BRD-K29218077			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16-,20+/m0/s1	GIKJWVQVMSIYNX-TWOQFEAHSA-N	420.273655672							111766
BRD-K92368853	LSM-23180		44497974	InChI=1S/C24H33N3O5S2/c1-16-12-27(17(2)15-28)24(29)19-6-4-7-20(25-34(30,31)22-8-5-11-33-22)23(19)32-21(16)14-26(3)13-18-9-10-18/h4-8,11,16-18,21,25,28H,9-10,12-15H2,1-3H3/t16-,17-,21-/m1/s1	JSDMQXJTQZGOQF-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3c(NS(=O)(=O)c4cccs4)cccc3C1=O	BroadT	BRD-K92368853	BRD-K92368853-001-01-1	Broad Institute of MIT and Harvard	BRD-K92368853			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2c(NS(=O)(=O)c3cccs3)cccc2C1=O	InChI=1S/C24H33N3O5S2/c1-16-12-27(17(2)15-28)24(29)19-6-4-7-20(25-34(30,31)22-8-5-11-33-22)23(19)32-21(16)14-26(3)13-18-9-10-18/h4-8,11,16-18,21,25,28H,9-10,12-15H2,1-3H3/t16-,17-,21-/m1/s1	JSDMQXJTQZGOQF-CBGDNZLLSA-N	507.186162566							111767
BRD-K40809590	LSM-23181		44497416	InChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20+,26+/m0/s1	ODSKXFDDLKDNDM-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3c(NC(=O)C4CCCCC4)cccc3C1=O	BroadT	BRD-K40809590	BRD-K40809590-001-01-5	Broad Institute of MIT and Harvard	BRD-K40809590			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2c(NC(=O)C3CCCCC3)cccc2C1=O	InChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20+,26+/m0/s1	ODSKXFDDLKDNDM-OUDXUNEISA-N	591.216984366							111768
BRD-K12120179	LSM-23182		44619225	InChI=1S/C31H36FN3O7S/c1-20-15-35(21(2)18-36)31(37)14-23-13-25(33-43(38,39)26-8-5-24(32)6-9-26)7-11-27(23)42-30(20)17-34(3)16-22-4-10-28-29(12-22)41-19-40-28/h4-13,20-21,30,33,36H,14-19H2,1-3H3/t20-,21+,30+/m1/s1	ZVLYFKSMWJQSMB-QPPRZBLKSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc4CC1=O	BroadT	BRD-K12120179	BRD-K12120179-001-01-0	Broad Institute of MIT and Harvard	BRD-K12120179			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2CC1=O	InChI=1S/C31H36FN3O7S/c1-20-15-35(21(2)18-36)31(37)14-23-13-25(33-43(38,39)26-8-5-24(32)6-9-26)7-11-27(23)42-30(20)17-34(3)16-22-4-10-28-29(12-22)41-19-40-28/h4-13,20-21,30,33,36H,14-19H2,1-3H3/t20-,21+,30+/m1/s1	ZVLYFKSMWJQSMB-QPPRZBLKSA-N	613.225799412							111769
BRD-K43341506	LSM-23183		44498832	InChI=1S/C25H35N3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(6)15-23-18(2)14-28(19(3)16-29)25(30)21-8-7-9-22(26(4)5)24(21)33-23/h7-13,18-19,23,29H,14-16H2,1-6H3/t18-,19-,23-/m1/s1	ANXKOFDVDMSSFK-DNVFCKCGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K43341506	BRD-K43341506-001-01-9	Broad Institute of MIT and Harvard	BRD-K43341506			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C25H35N3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(6)15-23-18(2)14-28(19(3)16-29)25(30)21-8-7-9-22(26(4)5)24(21)33-23/h7-13,18-19,23,29H,14-16H2,1-6H3/t18-,19-,23-/m1/s1	ANXKOFDVDMSSFK-DNVFCKCGSA-N	489.22974194							111770
BRD-K18902375	LSM-23184		44484663	InChI=1S/C28H35F3N4O6/c1-17-14-35(18(2)16-36)26(38)22-13-20(32-25(37)11-12-28(29,30)31)7-10-23(22)41-24(17)15-34(3)27(39)33-19-5-8-21(40-4)9-6-19/h5-10,13,17-18,24,36H,11-12,14-16H2,1-4H3,(H,32,37)(H,33,39)/t17-,18-,24+/m0/s1	RKPQTFDXIVHBLJ-LLJLJFOGSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K18902375	BRD-K18902375-001-01-7	Broad Institute of MIT and Harvard	BRD-K18902375			COc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C28H35F3N4O6/c1-17-14-35(18(2)16-36)26(38)22-13-20(32-25(37)11-12-28(29,30)31)7-10-23(22)41-24(17)15-34(3)27(39)33-19-5-8-21(40-4)9-6-19/h5-10,13,17-18,24,36H,11-12,14-16H2,1-4H3,(H,32,37)(H,33,39)/t17-,18-,24+/m0/s1	RKPQTFDXIVHBLJ-LLJLJFOGSA-N	580.25086948							111771
BRD-K25305749	LSM-23185		44484958	InChI=1S/C31H44N4O6/c1-22-18-35(23(2)21-36)31(38)27-17-25(32-30(37)11-12-34-13-15-40-16-14-34)7-10-28(27)41-29(22)20-33(3)19-24-5-8-26(39-4)9-6-24/h5-10,17,22-23,29,36H,11-16,18-21H2,1-4H3,(H,32,37)/t22-,23-,29-/m0/s1	WZMFZVAQVUXYGZ-BOSRLCDASA-N	COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)CCN4CCOCC4)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K25305749	BRD-K25305749-001-01-3	Broad Institute of MIT and Harvard	BRD-K25305749			COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)CCN4CCOCC4)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H44N4O6/c1-22-18-35(23(2)21-36)31(38)27-17-25(32-30(37)11-12-34-13-15-40-16-14-34)7-10-28(27)41-29(22)20-33(3)19-24-5-8-26(39-4)9-6-24/h5-10,17,22-23,29,36H,11-16,18-21H2,1-4H3,(H,32,37)/t22-,23-,29-/m0/s1	WZMFZVAQVUXYGZ-BOSRLCDASA-N	568.326085168							111772
BRD-K58458479-001-01-6	LSM-23186	BRD-K58458479	44496112	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13-,17+/m1/s1	COTDYGDWXSSLGS-XNJGSVPQSA-N	CNC[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K58458479	BRD-K58458479-001-01-6	Broad Institute of MIT and Harvard	BRD-K58458479			CNC[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13-,17+/m1/s1	COTDYGDWXSSLGS-XNJGSVPQSA-N	375.215806438							111773
BRD-K41648464	LSM-23187		44484732	InChI=1S/C28H36F3N5O5/c1-16(2)32-27(40)35(5)14-24-17(3)13-36(18(4)15-37)25(38)22-12-21(10-11-23(22)41-24)34-26(39)33-20-8-6-19(7-9-20)28(29,30)31/h6-12,16-18,24,37H,13-15H2,1-5H3,(H,32,40)(H2,33,34,39)/t17-,18-,24+/m0/s1	GUUFQQDCAZBWHX-LLJLJFOGSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K41648464	BRD-K41648464-001-01-9	Broad Institute of MIT and Harvard	BRD-K41648464			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H36F3N5O5/c1-16(2)32-27(40)35(5)14-24-17(3)13-36(18(4)15-37)25(38)22-12-21(10-11-23(22)41-24)34-26(39)33-20-8-6-19(7-9-20)28(29,30)31/h6-12,16-18,24,37H,13-15H2,1-5H3,(H,32,40)(H2,33,34,39)/t17-,18-,24+/m0/s1	GUUFQQDCAZBWHX-LLJLJFOGSA-N	579.266853902							111774
MLS002473881	LSM-23188	BRD-K24686166, SID85201408	44202492	InChI=1S/C23H34N4O6S/c1-14-11-27(15(2)13-28)23(29)18-9-8-10-19(25(5)6)21(18)32-20(14)12-26(7)34(30,31)22-16(3)24-33-17(22)4/h8-10,14-15,20,28H,11-13H2,1-7H3/t14-,15+,20+/m0/s1	NGTZGERAXWJDKM-BXTJHSDWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)onc2C)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K24686166	BRD-K24686166-001-02-9	Broad Institute of MIT and Harvard	BRD-K24686166			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C23H34N4O6S/c1-14-11-27(15(2)13-28)23(29)18-9-8-10-19(25(5)6)21(18)32-20(14)12-26(7)34(30,31)22-16(3)24-33-17(22)4/h8-10,14-15,20,28H,11-13H2,1-7H3/t14-,15+,20+/m0/s1	NGTZGERAXWJDKM-BXTJHSDWSA-N	494.219905538							111775
BRD-K79299080	LSM-23189		44483775	InChI=1S/C33H35N5O5/c1-21-18-38(22(2)20-39)32(41)26-11-7-13-28(35-31(40)24-14-16-34-17-15-24)30(26)43-29(21)19-37(3)33(42)36-27-12-6-9-23-8-4-5-10-25(23)27/h4-17,21-22,29,39H,18-20H2,1-3H3,(H,35,40)(H,36,42)/t21-,22-,29+/m1/s1	UCPVSNSDYZNCRX-QLVXXPONSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)c5ccncc5)cccc4C1=O	BroadT	BRD-K79299080	BRD-K79299080-001-01-0	Broad Institute of MIT and Harvard	BRD-K79299080			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C33H35N5O5/c1-21-18-38(22(2)20-39)32(41)26-11-7-13-28(35-31(40)24-14-16-34-17-15-24)30(26)43-29(21)19-37(3)33(42)36-27-12-6-9-23-8-4-5-10-25(23)27/h4-17,21-22,29,39H,18-20H2,1-3H3,(H,35,40)(H,36,42)/t21-,22-,29+/m1/s1	UCPVSNSDYZNCRX-QLVXXPONSA-N	581.26381927							111776
BRD-K17395396	LSM-23190		44490047	InChI=1S/C21H33N3O5S/c1-14-10-24(15(2)13-25)21(26)18-9-17(22-30(4,27)28)7-8-19(18)29-20(14)12-23(3)11-16-5-6-16/h7-9,14-16,20,22,25H,5-6,10-13H2,1-4H3/t14-,15+,20-/m0/s1	BGZVNGLBILQJCV-MDOVXXIYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K17395396	BRD-K17395396-001-01-0	Broad Institute of MIT and Harvard	BRD-K17395396			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C21H33N3O5S/c1-14-10-24(15(2)13-25)21(26)18-9-17(22-30(4,27)28)7-8-19(18)29-20(14)12-23(3)11-16-5-6-16/h7-9,14-16,20,22,25H,5-6,10-13H2,1-4H3/t14-,15+,20-/m0/s1	BGZVNGLBILQJCV-MDOVXXIYSA-N	439.214091876							111777
BRD-K36204097	LSM-23191		44493977	InChI=1S/C27H38N4O4/c1-18(2)28-27(34)29-23-13-9-12-22-25(23)35-24(16-30(5)15-21-10-7-6-8-11-21)19(3)14-31(26(22)33)20(4)17-32/h6-13,18-20,24,32H,14-17H2,1-5H3,(H2,28,29,34)/t19-,20+,24-/m0/s1	NCIZYGIVVKAPIW-ROKPMTFOSA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@H](C)[C@H](CN(C)Cc3ccccc3)Oc12)[C@H](C)CO	BroadT	BRD-K36204097	BRD-K36204097-001-01-3	Broad Institute of MIT and Harvard	BRD-K36204097			CC(C)NC(=O)Nc1cccc2c1O[C@@H](CN(C)Cc1ccccc1)[C@@H](C)CN([C@H](C)CO)C2=O	InChI=1S/C27H38N4O4/c1-18(2)28-27(34)29-23-13-9-12-22-25(23)35-24(16-30(5)15-21-10-7-6-8-11-21)19(3)14-31(26(22)33)20(4)17-32/h6-13,18-20,24,32H,14-17H2,1-5H3,(H2,28,29,34)/t19-,20+,24-/m0/s1	NCIZYGIVVKAPIW-ROKPMTFOSA-N	482.289305736							111778
BRD-K23203419	LSM-23192		44486096	InChI=1S/C29H40N4O4/c1-20-16-33(21(2)19-34)29(36)25-15-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)37-27(20)18-32(3)17-22-7-5-4-6-8-22/h9-15,20-22,27,34H,4-8,16-19H2,1-3H3,(H,31,35)/t20-,21-,27-/m0/s1	FYESYKULLQIDLV-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K23203419	BRD-K23203419-001-01-1	Broad Institute of MIT and Harvard	BRD-K23203419			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H40N4O4/c1-20-16-33(21(2)19-34)29(36)25-15-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)37-27(20)18-32(3)17-22-7-5-4-6-8-22/h9-15,20-22,27,34H,4-8,16-19H2,1-3H3,(H,31,35)/t20-,21-,27-/m0/s1	FYESYKULLQIDLV-IZVMNLJQSA-N	508.3049558							111779
CHEMBL2134381	LSM-23193	BRD-K52340217, SID85793393	44486923	InChI=1S/C30H42ClN3O5S/c1-21-17-34(22(2)20-35)30(36)16-24-15-26(32-40(37,38)27-12-9-25(31)10-13-27)11-14-28(24)39-29(21)19-33(3)18-23-7-5-4-6-8-23/h9-15,21-23,29,32,35H,4-8,16-20H2,1-3H3/t21-,22-,29-/m0/s1	YELAEPJECDEDIZ-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3CC1=O	BroadT	BRD-K52340217	BRD-K52340217-001-01-9	Broad Institute of MIT and Harvard	BRD-K52340217			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2CC1=O	InChI=1S/C30H42ClN3O5S/c1-21-17-34(22(2)20-35)30(36)16-24-15-26(32-40(37,38)27-12-9-25(31)10-13-27)11-14-28(24)39-29(21)19-33(3)18-23-7-5-4-6-8-23/h9-15,21-23,29,32,35H,4-8,16-20H2,1-3H3/t21-,22-,29-/m0/s1	YELAEPJECDEDIZ-SYZUXVNWSA-N	591.253369874							111780
BRD-K59015528	LSM-23194		44498951	InChI=1S/C26H35N3O5/c1-17-12-29(18(2)15-30)26(31)20-7-6-8-21(27(3)4)25(20)34-24(17)14-28(5)13-19-9-10-22-23(11-19)33-16-32-22/h6-11,17-18,24,30H,12-16H2,1-5H3/t17-,18+,24-/m0/s1	MTQIGCHWPBYMPN-RHGYRFJNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K59015528	BRD-K59015528-001-01-4	Broad Institute of MIT and Harvard	BRD-K59015528			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H35N3O5/c1-17-12-29(18(2)15-30)26(31)20-7-6-8-21(27(3)4)25(20)34-24(17)14-28(5)13-19-9-10-22-23(11-19)33-16-32-22/h6-11,17-18,24,30H,12-16H2,1-5H3/t17-,18+,24-/m0/s1	MTQIGCHWPBYMPN-RHGYRFJNSA-N	469.25767125							111781
BRD-K27109474	LSM-23195		44489129	InChI=1S/C24H29F3N4O4/c1-14-12-31(15(2)13-32)22(33)18-5-4-6-19(21(18)35-20(14)11-28-3)30-23(34)29-17-9-7-16(8-10-17)24(25,26)27/h4-10,14-15,20,28,32H,11-13H2,1-3H3,(H2,29,30,34)/t14-,15+,20+/m1/s1	KNPSDLIHJHZPLR-SIFCLUCFSA-N	CNC[C@@H]1Oc2c(NC(=O)Nc3ccc(cc3)C(F)(F)F)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K27109474	BRD-K27109474-001-01-8	Broad Institute of MIT and Harvard	BRD-K27109474			CNC[C@@H]1Oc2c(NC(=O)Nc3ccc(cc3)C(F)(F)F)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H29F3N4O4/c1-14-12-31(15(2)13-32)22(33)18-5-4-6-19(21(18)35-20(14)11-28-3)30-23(34)29-17-9-7-16(8-10-17)24(25,26)27/h4-10,14-15,20,28,32H,11-13H2,1-3H3,(H2,29,30,34)/t14-,15+,20+/m1/s1	KNPSDLIHJHZPLR-SIFCLUCFSA-N	494.214090048							111782
BRD-K75413392	LSM-23196		44494159	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13+,17+/m1/s1	COTDYGDWXSSLGS-IGCXYCKISA-N	CNC[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K75413392	BRD-K75413392-001-01-4	Broad Institute of MIT and Harvard	BRD-K75413392			CNC[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13+,17+/m1/s1	COTDYGDWXSSLGS-IGCXYCKISA-N	375.215806438							111783
BRD-K13402684	LSM-23197		44491442	InChI=1S/C29H37N3O6/c1-18-13-32(19(2)16-33)28(34)12-22-11-23(30-29(35)21-5-6-21)7-9-24(22)38-27(18)15-31(3)14-20-4-8-25-26(10-20)37-17-36-25/h4,7-11,18-19,21,27,33H,5-6,12-17H2,1-3H3,(H,30,35)/t18-,19-,27+/m0/s1	WXJCYEGRNWVSCE-RWYJCYHVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)C5CC5)cc4CC1=O	BroadT	BRD-K13402684	BRD-K13402684-001-01-9	Broad Institute of MIT and Harvard	BRD-K13402684			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)C3CC3)cc2CC1=O	InChI=1S/C29H37N3O6/c1-18-13-32(19(2)16-33)28(34)12-22-11-23(30-29(35)21-5-6-21)7-9-24(22)38-27(18)15-31(3)14-20-4-8-25-26(10-20)37-17-36-25/h4,7-11,18-19,21,27,33H,5-6,12-17H2,1-3H3,(H,30,35)/t18-,19-,27+/m0/s1	WXJCYEGRNWVSCE-RWYJCYHVSA-N	523.268235934							111784
BRD-K08868574	LSM-23198		44495954	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23-,29+/m0/s1	JWXWRTLQHUTWJR-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K08868574	BRD-K08868574-001-01-1	Broad Institute of MIT and Harvard	BRD-K08868574			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C32H44N4O5/c1-22-19-36(23(2)21-37)31(39)18-25-17-27(33-30(38)16-24-10-6-4-7-11-24)14-15-28(25)41-29(22)20-35(3)32(40)34-26-12-8-5-9-13-26/h4,6-7,10-11,14-15,17,22-23,26,29,37H,5,8-9,12-13,16,18-21H2,1-3H3,(H,33,38)(H,34,40)/t22-,23-,29+/m0/s1	JWXWRTLQHUTWJR-SBZVUBOMSA-N	564.331170548							111785
BRD-K54148510	LSM-23199		44484187	InChI=1S/C28H34F3N3O6/c1-17-12-34(18(2)15-35)27(37)21-11-20(32-26(36)8-9-28(29,30)31)5-7-22(21)40-25(17)14-33(3)13-19-4-6-23-24(10-19)39-16-38-23/h4-7,10-11,17-18,25,35H,8-9,12-16H2,1-3H3,(H,32,36)/t17-,18-,25-/m0/s1	IMDFAXAHWGRKQV-RPPIVITFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCC(F)(F)F)cc4C1=O	BroadT	BRD-K54148510	BRD-K54148510-001-01-8	Broad Institute of MIT and Harvard	BRD-K54148510			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C28H34F3N3O6/c1-17-12-34(18(2)15-35)27(37)21-11-20(32-26(36)8-9-28(29,30)31)5-7-22(21)40-25(17)14-33(3)13-19-4-6-23-24(10-19)39-16-38-23/h4-7,10-11,17-18,25,35H,8-9,12-16H2,1-3H3,(H,32,36)/t17-,18-,25-/m0/s1	IMDFAXAHWGRKQV-RPPIVITFSA-N	565.239970438							111786
BRD-K84529299	LSM-23200		44491861	InChI=1S/C24H38N4O4/c1-16-13-28(17(2)15-29)23(30)20-12-19(10-11-21(20)32-22(16)14-27(3)4)26-24(31)25-18-8-6-5-7-9-18/h10-12,16-18,22,29H,5-9,13-15H2,1-4H3,(H2,25,26,31)/t16-,17+,22-/m0/s1	VXFJIZOVTNBNAE-JKSBSHDWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	BroadT	BRD-K84529299	BRD-K84529299-001-01-0	Broad Institute of MIT and Harvard	BRD-K84529299			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C24H38N4O4/c1-16-13-28(17(2)15-29)23(30)20-12-19(10-11-21(20)32-22(16)14-27(3)4)26-24(31)25-18-8-6-5-7-9-18/h10-12,16-18,22,29H,5-9,13-15H2,1-4H3,(H2,25,26,31)/t16-,17+,22-/m0/s1	VXFJIZOVTNBNAE-JKSBSHDWSA-N	446.289305736							111787
CHEMBL2356904	LSM-23201	BRD-K51278788, SID85796812	44490205	InChI=1S/C30H37F3N4O6/c1-18-15-37(19(2)17-38)28(40)23-5-4-6-24(35-27(39)20-11-13-42-14-12-20)26(23)43-25(18)16-36(3)29(41)34-22-9-7-21(8-10-22)30(31,32)33/h4-10,18-20,25,38H,11-17H2,1-3H3,(H,34,41)(H,35,39)/t18-,19+,25+/m0/s1	TZPMNVZBAPWBQT-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)C4CCOCC4)cccc3C1=O	BroadT	BRD-K51278788	BRD-K51278788-001-01-1	Broad Institute of MIT and Harvard	BRD-K51278788			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C30H37F3N4O6/c1-18-15-37(19(2)17-38)28(40)23-5-4-6-24(35-27(39)20-11-13-42-14-12-20)26(23)43-25(18)16-36(3)29(41)34-22-9-7-21(8-10-22)30(31,32)33/h4-10,18-20,25,38H,11-17H2,1-3H3,(H,34,41)(H,35,39)/t18-,19+,25+/m0/s1	TZPMNVZBAPWBQT-OSWQYVSFSA-N	606.266519544							111788
BRD-K27616520	LSM-23202		44498982	InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)17-8-7-9-18(24(3)4)21(17)32-19(15)11-26(6)33(30,31)20-12-25(5)14-23-20/h7-9,12,14-16,19,28H,10-11,13H2,1-6H3/t15-,16+,19-/m1/s1	NFFRJINEVFDSRM-JTDSTZFVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K27616520	BRD-K27616520-001-01-6	Broad Institute of MIT and Harvard	BRD-K27616520			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)17-8-7-9-18(24(3)4)21(17)32-19(15)11-26(6)33(30,31)20-12-25(5)14-23-20/h7-9,12,14-16,19,28H,10-11,13H2,1-6H3/t15-,16+,19-/m1/s1	NFFRJINEVFDSRM-JTDSTZFVSA-N	479.220239896							111789
BRD-K75738352	LSM-23203		44500938	InChI=1S/C20H33N3O5S/c1-14-11-23(15(2)13-24)20(25)10-16-9-17(21(3)4)7-8-18(16)28-19(14)12-22(5)29(6,26)27/h7-9,14-15,19,24H,10-13H2,1-6H3/t14-,15+,19-/m1/s1	GJNVPSGZCJMKRU-ZRGWGRIASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ccc(cc2CC1=O)N(C)C	BroadT	BRD-K75738352	BRD-K75738352-001-01-2	Broad Institute of MIT and Harvard	BRD-K75738352			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C20H33N3O5S/c1-14-11-23(15(2)13-24)20(25)10-16-9-17(21(3)4)7-8-18(16)28-19(14)12-22(5)29(6,26)27/h7-9,14-15,19,24H,10-13H2,1-6H3/t14-,15+,19-/m1/s1	GJNVPSGZCJMKRU-ZRGWGRIASA-N	427.214091876							111790
BRD-K12089436	LSM-23204		44499630	InChI=1S/C28H32N4O6S/c1-19-16-32(20(2)18-33)28(35)23-10-7-11-24(30-27(34)21-12-14-29-15-13-21)26(23)38-25(19)17-31(3)39(36,37)22-8-5-4-6-9-22/h4-15,19-20,25,33H,16-18H2,1-3H3,(H,30,34)/t19-,20-,25-/m0/s1	LXJZSYGAJCUBQM-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K12089436	BRD-K12089436-001-01-6	Broad Institute of MIT and Harvard	BRD-K12089436			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C28H32N4O6S/c1-19-16-32(20(2)18-33)28(35)23-10-7-11-24(30-27(34)21-12-14-29-15-13-21)26(23)38-25(19)17-31(3)39(36,37)22-8-5-4-6-9-22/h4-15,19-20,25,33H,16-18H2,1-3H3,(H,30,34)/t19-,20-,25-/m0/s1	LXJZSYGAJCUBQM-RLSLOFABSA-N	552.204255474							111791
BRD-K92372829	LSM-23205		44486157	InChI=1S/C24H32N4O5/c1-15-13-28(16(2)14-29)23(30)20-11-18(7-10-21(20)33-22(15)12-25-3)27-24(31)26-17-5-8-19(32-4)9-6-17/h5-11,15-16,22,25,29H,12-14H2,1-4H3,(H2,26,27,31)/t15-,16+,22-/m0/s1	SBTJRJPUBKNDRG-DMPWYTOCSA-N	CNC[C@@H]1Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K92372829	BRD-K92372829-001-01-4	Broad Institute of MIT and Harvard	BRD-K92372829			CNC[C@@H]1Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H32N4O5/c1-15-13-28(16(2)14-29)23(30)20-11-18(7-10-21(20)33-22(15)12-25-3)27-24(31)26-17-5-8-19(32-4)9-6-17/h5-11,15-16,22,25,29H,12-14H2,1-4H3,(H2,26,27,31)/t15-,16+,22-/m0/s1	SBTJRJPUBKNDRG-DMPWYTOCSA-N	456.237270164							111792
BRD-K64023176	LSM-23206		44489682	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)27-16-10-18-29(36-33(42)35-25-13-5-4-6-14-25)31(27)44-30(22)20-38(3)34(43)37-28-17-9-12-24-11-7-8-15-26(24)28/h7-12,15-18,22-23,25,30,40H,4-6,13-14,19-21H2,1-3H3,(H,37,43)(H2,35,36,42)/t22-,23-,30+/m1/s1	DNNIAXRFSGYFCB-JWUQWVJQSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)NC5CCCCC5)cccc4C1=O	BroadT	BRD-K64023176	BRD-K64023176-001-01-6	Broad Institute of MIT and Harvard	BRD-K64023176			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)27-16-10-18-29(36-33(42)35-25-13-5-4-6-14-25)31(27)44-30(22)20-38(3)34(43)37-28-17-9-12-24-11-7-8-15-26(24)28/h7-12,15-18,22-23,25,30,40H,4-6,13-14,19-21H2,1-3H3,(H,37,43)(H2,35,36,42)/t22-,23-,30+/m1/s1	DNNIAXRFSGYFCB-JWUQWVJQSA-N	601.326419526							111793
BRD-K28057105	LSM-23207		44487360	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18-,23-/m0/s1	BMWRPMHXUFNAQO-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K28057105	BRD-K28057105-001-01-5	Broad Institute of MIT and Harvard	BRD-K28057105			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18-,23-/m0/s1	BMWRPMHXUFNAQO-BSRJHKFKSA-N	466.258005608							111794
BRD-K90403149	LSM-23208		44501576	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20+,27-/m1/s1	FITMUQCJUCLPTO-IOKPGSKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4c(C)onc4C)cc3CC1=O	BroadT	BRD-K90403149	BRD-K90403149-001-01-2	Broad Institute of MIT and Harvard	BRD-K90403149			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3c(C)noc3C)cc2CC1=O	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20+,27-/m1/s1	FITMUQCJUCLPTO-IOKPGSKQSA-N	576.298155858							111795
BRD-K83297764	LSM-23209		44485344	InChI=1S/C17H27N3O5S/c1-11-9-20(12(2)10-21)17(22)14-7-13(19-26(4,23)24)5-6-15(14)25-16(11)8-18-3/h5-7,11-12,16,18-19,21H,8-10H2,1-4H3/t11-,12-,16+/m0/s1	HMGKWXPABBQPJW-MQIPJXDCSA-N	CNC[C@H]1Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K83297764	BRD-K83297764-001-01-1	Broad Institute of MIT and Harvard	BRD-K83297764			CNC[C@H]1Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C17H27N3O5S/c1-11-9-20(12(2)10-21)17(22)14-7-13(19-26(4,23)24)5-6-15(14)25-16(11)8-18-3/h5-7,11-12,16,18-19,21H,8-10H2,1-4H3/t11-,12-,16+/m0/s1	HMGKWXPABBQPJW-MQIPJXDCSA-N	385.167141684							111796
BRD-K61441533	LSM-23210		44494199	InChI=1S/C29H34FN5O4/c1-19-15-35(20(2)18-36)28(37)24-5-4-6-25(33-29(38)32-23-9-7-22(30)8-10-23)27(24)39-26(19)17-34(3)16-21-11-13-31-14-12-21/h4-14,19-20,26,36H,15-18H2,1-3H3,(H2,32,33,38)/t19-,20-,26+/m1/s1	VBGZKSFWINXWAF-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc3c(NC(=O)Nc4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K61441533	BRD-K61441533-001-01-1	Broad Institute of MIT and Harvard	BRD-K61441533			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc2c(NC(=O)Nc3ccc(F)cc3)cccc2C1=O	InChI=1S/C29H34FN5O4/c1-19-15-35(20(2)18-36)28(37)24-5-4-6-25(33-29(38)32-23-9-7-22(30)8-10-23)27(24)39-26(19)17-34(3)16-21-11-13-31-14-12-21/h4-14,19-20,26,36H,15-18H2,1-3H3,(H2,32,33,38)/t19-,20-,26+/m1/s1	VBGZKSFWINXWAF-KYTVRQNUSA-N	535.259482818							111797
BRD-K11804865	LSM-23211		44491962	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)16-7-6-8-17(20(16)31-18(12)9-23-5)24-22(30)25-19-14(3)26-32-15(19)4/h6-8,12-13,18,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13-,18-/m1/s1	MPDMLCBONFVZSW-SNUQEOBHSA-N	CNC[C@H]1Oc2c(NC(=O)Nc3c(C)onc3C)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K11804865	BRD-K11804865-001-01-9	Broad Institute of MIT and Harvard	BRD-K11804865			CNC[C@H]1Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)16-7-6-8-17(20(16)31-18(12)9-23-5)24-22(30)25-19-14(3)26-32-15(19)4/h6-8,12-13,18,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13-,18-/m1/s1	MPDMLCBONFVZSW-SNUQEOBHSA-N	445.232519142							111798
BRD-K65139123	LSM-23212		44487753	InChI=1S/C31H39F3N4O5/c1-19-16-38(20(2)18-39)29(41)25-15-24(35-28(40)21-7-5-4-6-8-21)13-14-26(25)43-27(19)17-37(3)30(42)36-23-11-9-22(10-12-23)31(32,33)34/h9-15,19-21,27,39H,4-8,16-18H2,1-3H3,(H,35,40)(H,36,42)/t19-,20-,27+/m0/s1	AZWNSNCWAAAZSD-OWOAZTCBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K65139123	BRD-K65139123-001-01-3	Broad Institute of MIT and Harvard	BRD-K65139123			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C31H39F3N4O5/c1-19-16-38(20(2)18-39)29(41)25-15-24(35-28(40)21-7-5-4-6-8-21)13-14-26(25)43-27(19)17-37(3)30(42)36-23-11-9-22(10-12-23)31(32,33)34/h9-15,19-21,27,39H,4-8,16-18H2,1-3H3,(H,35,40)(H,36,42)/t19-,20-,27+/m0/s1	AZWNSNCWAAAZSD-OWOAZTCBSA-N	604.287254988							111799
BRD-K28640166	LSM-23213		44504000	InChI=1S/C27H33ClF3N3O6S/c1-17-14-34(18(2)16-35)26(37)13-19-12-21(32-25(36)10-11-27(29,30)31)6-9-23(19)40-24(17)15-33(3)41(38,39)22-7-4-20(28)5-8-22/h4-9,12,17-18,24,35H,10-11,13-16H2,1-3H3,(H,32,36)/t17-,18-,24+/m1/s1	BTSOZOCIIHDJJX-GGUMNFRJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC1=O	BroadT	BRD-K28640166	BRD-K28640166-001-01-4	Broad Institute of MIT and Harvard	BRD-K28640166			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C27H33ClF3N3O6S/c1-17-14-34(18(2)16-35)26(37)13-19-12-21(32-25(36)10-11-27(29,30)31)6-9-23(19)40-24(17)15-33(3)41(38,39)22-7-4-20(28)5-8-22/h4-9,12,17-18,24,35H,10-11,13-16H2,1-3H3,(H,32,36)/t17-,18-,24+/m1/s1	BTSOZOCIIHDJJX-GGUMNFRJSA-N	619.173068806							111800
BRD-K57304954	LSM-23214		44495672	InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)17-8-7-9-18(24(3)4)21(17)32-19(15)11-26(6)33(30,31)20-12-25(5)14-23-20/h7-9,12,14-16,19,28H,10-11,13H2,1-6H3/t15-,16-,19+/m1/s1	NFFRJINEVFDSRM-MDZRGWNJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K57304954	BRD-K57304954-001-01-7	Broad Institute of MIT and Harvard	BRD-K57304954			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)17-8-7-9-18(24(3)4)21(17)32-19(15)11-26(6)33(30,31)20-12-25(5)14-23-20/h7-9,12,14-16,19,28H,10-11,13H2,1-6H3/t15-,16-,19+/m1/s1	NFFRJINEVFDSRM-MDZRGWNJSA-N	479.220239896							111801
MLS002474243	LSM-23215	BRD-K58751650, SID85201820	44202899	InChI=1S/C26H33F3N4O4/c1-16-13-33(17(2)15-34)24(35)20-7-6-8-21(31(3)4)23(20)37-22(16)14-32(5)25(36)30-19-11-9-18(10-12-19)26(27,28)29/h6-12,16-17,22,34H,13-15H2,1-5H3,(H,30,36)/t16-,17+,22+/m0/s1	UASMVRRVZNRGSL-GSHUGGBRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K58751650	BRD-K58751650-001-02-3	Broad Institute of MIT and Harvard	BRD-K58751650			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H33F3N4O4/c1-16-13-33(17(2)15-34)24(35)20-7-6-8-21(31(3)4)23(20)37-22(16)14-32(5)25(36)30-19-11-9-18(10-12-19)26(27,28)29/h6-12,16-17,22,34H,13-15H2,1-5H3,(H,30,36)/t16-,17+,22+/m0/s1	UASMVRRVZNRGSL-GSHUGGBRSA-N	522.245390176							111802
BRD-K53549406	LSM-23216		44497482	InChI=1S/C25H35N3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(6)15-23-18(2)14-28(19(3)16-29)25(30)21-8-7-9-22(26(4)5)24(21)33-23/h7-13,18-19,23,29H,14-16H2,1-6H3/t18-,19+,23-/m0/s1	ANXKOFDVDMSSFK-YYDVJCTNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K53549406	BRD-K53549406-001-01-5	Broad Institute of MIT and Harvard	BRD-K53549406			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C25H35N3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(6)15-23-18(2)14-28(19(3)16-29)25(30)21-8-7-9-22(26(4)5)24(21)33-23/h7-13,18-19,23,29H,14-16H2,1-6H3/t18-,19+,23-/m0/s1	ANXKOFDVDMSSFK-YYDVJCTNSA-N	489.22974194							111803
BRD-K99000561	LSM-23217		44494643	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)27-12-9-13-28(32(3)4)30(27)38-29(22)20-33(5)19-24-14-16-26(17-15-24)37-25-10-7-6-8-11-25/h6-17,22-23,29,35H,18-21H2,1-5H3/t22-,23+,29+/m1/s1	KBWKSVZPOQKHGN-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K99000561	BRD-K99000561-001-01-6	Broad Institute of MIT and Harvard	BRD-K99000561			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)27-12-9-13-28(32(3)4)30(27)38-29(22)20-33(5)19-24-14-16-26(17-15-24)37-25-10-7-6-8-11-25/h6-17,22-23,29,35H,18-21H2,1-5H3/t22-,23+,29+/m1/s1	KBWKSVZPOQKHGN-AFKLWXAFSA-N	517.294056758							111804
BRD-K68008192	LSM-23218		44485921	InChI=1S/C30H32F3N5O5/c1-18-15-38(19(2)17-39)28(41)24-14-23(35-27(40)20-10-12-34-13-11-20)8-9-25(24)43-26(18)16-37(3)29(42)36-22-6-4-21(5-7-22)30(31,32)33/h4-14,18-19,26,39H,15-17H2,1-3H3,(H,35,40)(H,36,42)/t18-,19-,26+/m0/s1	CEYHIDAYCYBVJJ-LZJCXSABSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K68008192	BRD-K68008192-001-01-3	Broad Institute of MIT and Harvard	BRD-K68008192			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C30H32F3N5O5/c1-18-15-38(19(2)17-39)28(41)24-14-23(35-27(40)20-10-12-34-13-11-20)8-9-25(24)43-26(18)16-37(3)29(42)36-22-6-4-21(5-7-22)30(31,32)33/h4-14,18-19,26,39H,15-17H2,1-3H3,(H,35,40)(H,36,42)/t18-,19-,26+/m0/s1	CEYHIDAYCYBVJJ-LZJCXSABSA-N	599.235553774							111805
BRD-K84054400	LSM-23219		44485354	InChI=1S/C24H32N4O5/c1-15-13-28(16(2)14-29)23(30)20-11-18(7-10-21(20)33-22(15)12-25-3)27-24(31)26-17-5-8-19(32-4)9-6-17/h5-11,15-16,22,25,29H,12-14H2,1-4H3,(H2,26,27,31)/t15-,16-,22+/m0/s1	SBTJRJPUBKNDRG-PONJGIIJSA-N	CNC[C@H]1Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K84054400	BRD-K84054400-001-01-5	Broad Institute of MIT and Harvard	BRD-K84054400			CNC[C@H]1Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H32N4O5/c1-15-13-28(16(2)14-29)23(30)20-11-18(7-10-21(20)33-22(15)12-25-3)27-24(31)26-17-5-8-19(32-4)9-6-17/h5-11,15-16,22,25,29H,12-14H2,1-4H3,(H2,26,27,31)/t15-,16-,22+/m0/s1	SBTJRJPUBKNDRG-PONJGIIJSA-N	456.237270164							111806
BRD-K97258641	LSM-23220		44486152	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-21-15(3)11-28(16(4)13-29)23(31)19-10-18(8-9-20(19)33-21)26-22(30)17-6-7-17/h8-10,14-17,21,29H,6-7,11-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16-,21+/m0/s1	NEXLFLQFCDOFIH-CKJXQJPGSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)C3CC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K97258641	BRD-K97258641-001-01-6	Broad Institute of MIT and Harvard	BRD-K97258641			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)C3CC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-21-15(3)11-28(16(4)13-29)23(31)19-10-18(8-9-20(19)33-21)26-22(30)17-6-7-17/h8-10,14-17,21,29H,6-7,11-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16-,21+/m0/s1	NEXLFLQFCDOFIH-CKJXQJPGSA-N	460.268570292							111807
BRD-K99250186	LSM-23221		44490842	InChI=1S/C28H34F3N5O5S/c1-18-12-36(19(2)16-37)27(38)22-6-5-7-23(33-42(39,40)25-15-35(4)17-32-25)26(22)41-24(18)14-34(3)13-20-8-10-21(11-9-20)28(29,30)31/h5-11,15,17-19,24,33,37H,12-14,16H2,1-4H3/t18-,19-,24-/m0/s1	DXKOHZBEBBERNQ-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3c(NS(=O)(=O)c4cn(C)cn4)cccc3C1=O	BroadT	BRD-K99250186	BRD-K99250186-001-01-2	Broad Institute of MIT and Harvard	BRD-K99250186			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C1=O	InChI=1S/C28H34F3N5O5S/c1-18-12-36(19(2)16-37)27(38)22-6-5-7-23(33-42(39,40)25-15-35(4)17-32-25)26(22)41-24(18)14-34(3)13-20-8-10-21(11-9-20)28(29,30)31/h5-11,15,17-19,24,33,37H,12-14,16H2,1-4H3/t18-,19-,24-/m0/s1	DXKOHZBEBBERNQ-JXQFQVJHSA-N	609.223274528							111808
BRD-K77797589	LSM-23222		44495939	InChI=1S/C21H31N5O5S/c1-14-10-26(15(2)12-27)21(28)8-16-7-17(5-6-18(16)31-19(14)9-22-3)24-32(29,30)20-11-25(4)13-23-20/h5-7,11,13-15,19,22,24,27H,8-10,12H2,1-4H3/t14-,15-,19+/m0/s1	CHBVISFKEYYRMC-YZVOILCLSA-N	CNC[C@H]1Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K77797589	BRD-K77797589-001-01-1	Broad Institute of MIT and Harvard	BRD-K77797589			CNC[C@H]1Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C21H31N5O5S/c1-14-10-26(15(2)12-27)21(28)8-16-7-17(5-6-18(16)31-19(14)9-22-3)24-32(29,30)20-11-25(4)13-23-20/h5-7,11,13-15,19,22,24,27H,8-10,12H2,1-4H3/t14-,15-,19+/m0/s1	CHBVISFKEYYRMC-YZVOILCLSA-N	465.204589832							111809
BRD-K65320638	LSM-23223		44499782	InChI=1S/C31H42N4O6/c1-20-17-35(21(2)19-36)30(38)25-11-8-12-26(33-29(37)22-9-6-5-7-10-22)28(25)41-27(20)18-34(3)31(39)32-23-13-15-24(40-4)16-14-23/h8,11-16,20-22,27,36H,5-7,9-10,17-19H2,1-4H3,(H,32,39)(H,33,37)/t20-,21-,27-/m1/s1	LSKFJJLXCXBANC-LGVUCKNBSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3c(NC(=O)C4CCCCC4)cccc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K65320638	BRD-K65320638-001-01-7	Broad Institute of MIT and Harvard	BRD-K65320638			COc1ccc(NC(=O)N(C)C[C@H]2Oc3c(NC(=O)C4CCCCC4)cccc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H42N4O6/c1-20-17-35(21(2)19-36)30(38)25-11-8-12-26(33-29(37)22-9-6-5-7-10-22)28(25)41-27(20)18-34(3)31(39)32-23-13-15-24(40-4)16-14-23/h8,11-16,20-22,27,36H,5-7,9-10,17-19H2,1-4H3,(H,32,39)(H,33,37)/t20-,21-,27-/m1/s1	LSKFJJLXCXBANC-LGVUCKNBSA-N	566.310435104							111810
BRD-K52047843	LSM-23224		44499096	InChI=1S/C28H32N4O6S/c1-19-16-32(20(2)18-33)28(35)23-10-7-11-24(30-27(34)21-12-14-29-15-13-21)26(23)38-25(19)17-31(3)39(36,37)22-8-5-4-6-9-22/h4-15,19-20,25,33H,16-18H2,1-3H3,(H,30,34)/t19-,20-,25+/m0/s1	LXJZSYGAJCUBQM-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K52047843	BRD-K52047843-001-01-2	Broad Institute of MIT and Harvard	BRD-K52047843			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C28H32N4O6S/c1-19-16-32(20(2)18-33)28(35)23-10-7-11-24(30-27(34)21-12-14-29-15-13-21)26(23)38-25(19)17-31(3)39(36,37)22-8-5-4-6-9-22/h4-15,19-20,25,33H,16-18H2,1-3H3,(H,30,34)/t19-,20-,25+/m0/s1	LXJZSYGAJCUBQM-ZYLNGJIFSA-N	552.204255474							111811
BRD-K02385540	LSM-23225		54613822	InChI=1S/C25H34N4O4/c1-17-14-29(18(2)16-30)24(31)13-19-12-21(10-11-22(19)33-23(17)15-28(3)4)27-25(32)26-20-8-6-5-7-9-20/h5-12,17-18,23,30H,13-16H2,1-4H3,(H2,26,27,32)/t17-,18+,23+/m1/s1	VPMPLFBICILMPX-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	BroadT	BRD-K02385540	BRD-K02385540-001-01-3	Broad Institute of MIT and Harvard	BRD-K02385540			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	InChI=1S/C25H34N4O4/c1-17-14-29(18(2)16-30)24(31)13-19-12-21(10-11-22(19)33-23(17)15-28(3)4)27-25(32)26-20-8-6-5-7-9-20/h5-12,17-18,23,30H,13-16H2,1-4H3,(H2,26,27,32)/t17-,18+,23+/m1/s1	VPMPLFBICILMPX-STSQHVNTSA-N	454.258005608							111812
BRD-K78333516	LSM-23226		44485332	InChI=1S/C24H33N3O6S/c1-16-13-27(17(2)15-28)24(29)21-12-18(6-11-22(21)33-23(16)14-26(3)4)25-34(30,31)20-9-7-19(32-5)8-10-20/h6-12,16-17,23,25,28H,13-15H2,1-5H3/t16-,17-,23+/m0/s1	IFPHIOSYEQPMRT-HKARXFIJSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K78333516	BRD-K78333516-001-01-2	Broad Institute of MIT and Harvard	BRD-K78333516			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H33N3O6S/c1-16-13-27(17(2)15-28)24(29)21-12-18(6-11-22(21)33-23(16)14-26(3)4)25-34(30,31)20-9-7-19(32-5)8-10-20/h6-12,16-17,23,25,28H,13-15H2,1-5H3/t16-,17-,23+/m0/s1	IFPHIOSYEQPMRT-HKARXFIJSA-N	491.209006496							111813
BRD-K89532826	LSM-23227		44483420	InChI=1S/C24H33N3O6S/c1-16-13-27(17(2)15-28)24(29)21-12-18(6-11-22(21)33-23(16)14-26(3)4)25-34(30,31)20-9-7-19(32-5)8-10-20/h6-12,16-17,23,25,28H,13-15H2,1-5H3/t16-,17-,23+/m1/s1	IFPHIOSYEQPMRT-QZMQVMSPSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K89532826	BRD-K89532826-001-01-1	Broad Institute of MIT and Harvard	BRD-K89532826			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H](CN(C)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H33N3O6S/c1-16-13-27(17(2)15-28)24(29)21-12-18(6-11-22(21)33-23(16)14-26(3)4)25-34(30,31)20-9-7-19(32-5)8-10-20/h6-12,16-17,23,25,28H,13-15H2,1-5H3/t16-,17-,23+/m1/s1	IFPHIOSYEQPMRT-QZMQVMSPSA-N	491.209006496							111814
BRD-K16737653	LSM-23228		44490206	InChI=1S/C30H37N5O7/c1-17-12-35(18(2)15-36)29(37)22-7-6-8-23(31-30(38)32-27-19(3)33-42-20(27)4)28(22)41-26(17)14-34(5)13-21-9-10-24-25(11-21)40-16-39-24/h6-11,17-18,26,36H,12-16H2,1-5H3,(H2,31,32,38)/t17-,18+,26+/m0/s1	ROWKUSIEMFYXMA-CUAXAMRHSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)Nc5c(C)onc5C)cccc4C1=O	BroadT	BRD-K16737653	BRD-K16737653-001-01-2	Broad Institute of MIT and Harvard	BRD-K16737653			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C1=O	InChI=1S/C30H37N5O7/c1-17-12-35(18(2)15-36)29(37)22-7-6-8-23(31-30(38)32-27-19(3)33-42-20(27)4)28(22)41-26(17)14-34(5)13-21-9-10-24-25(11-21)40-16-39-24/h6-11,17-18,26,36H,12-16H2,1-5H3,(H2,31,32,38)/t17-,18+,26+/m0/s1	ROWKUSIEMFYXMA-CUAXAMRHSA-N	579.269298574							111815
BRD-K09081347	LSM-23229		44502884	InChI=1S/C26H42N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h11-13,18-19,21,24,31H,6-10,14-17H2,1-5H3,(H,27,33)/t18-,19-,24-/m0/s1	NUQLUNTVVQHOLK-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K09081347	BRD-K09081347-001-01-6	Broad Institute of MIT and Harvard	BRD-K09081347			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C26H42N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h11-13,18-19,21,24,31H,6-10,14-17H2,1-5H3,(H,27,33)/t18-,19-,24-/m0/s1	NUQLUNTVVQHOLK-JXQFQVJHSA-N	474.320605864							111816
BRD-K98441254	LSM-23230		44484145	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)30(6)15-25-19(4)14-31(20(5)16-32)26(33)23-13-21(9-12-24(23)37-25)29-38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,29,32H,14-16H2,1-6H3,(H,28,34)/t19-,20+,25-/m0/s1	HJQIIGSKSQOFKI-DFIYOIEZSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K98441254	BRD-K98441254-001-01-5	Broad Institute of MIT and Harvard	BRD-K98441254			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)30(6)15-25-19(4)14-31(20(5)16-32)26(33)23-13-21(9-12-24(23)37-25)29-38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,29,32H,14-16H2,1-6H3,(H,28,34)/t19-,20+,25-/m0/s1	HJQIIGSKSQOFKI-DFIYOIEZSA-N	546.251205666							111817
BRD-K72957838	LSM-23231		44495809	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)22-12-21(28-25(32)20-4-5-20)6-7-23(22)34-24(17)15-29(3)14-19-8-10-27-11-9-19/h6-12,17-18,20,24,31H,4-5,13-16H2,1-3H3,(H,28,32)/t17-,18-,24+/m0/s1	QDSHHCHLIAQNJH-LLJLJFOGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3ccc(NC(=O)C4CC4)cc3C1=O	BroadT	BRD-K72957838	BRD-K72957838-001-01-5	Broad Institute of MIT and Harvard	BRD-K72957838			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2ccc(NC(=O)C3CC3)cc2C1=O	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)22-12-21(28-25(32)20-4-5-20)6-7-23(22)34-24(17)15-29(3)14-19-8-10-27-11-9-19/h6-12,17-18,20,24,31H,4-5,13-16H2,1-3H3,(H,28,32)/t17-,18-,24+/m0/s1	QDSHHCHLIAQNJH-LLJLJFOGSA-N	466.258005608							111818
BRD-K76586223	LSM-23232		44496754	InChI=1S/C34H36FN5O5/c1-21-18-40(22(2)20-41)32(42)27-11-7-13-29(38-33(43)37-28-12-6-9-23-8-4-5-10-26(23)28)31(27)45-30(21)19-39(3)34(44)36-25-16-14-24(35)15-17-25/h4-17,21-22,30,41H,18-20H2,1-3H3,(H,36,44)(H2,37,38,43)/t21-,22-,30-/m0/s1	INJMWLLCIWTMDU-PWWNZBMUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3c(NC(=O)Nc4cccc5ccccc45)cccc3C1=O	BroadT	BRD-K76586223	BRD-K76586223-001-01-1	Broad Institute of MIT and Harvard	BRD-K76586223			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C1=O	InChI=1S/C34H36FN5O5/c1-21-18-40(22(2)20-41)32(42)27-11-7-13-29(38-33(43)37-28-12-6-9-23-8-4-5-10-26(23)28)31(27)45-30(21)19-39(3)34(44)36-25-16-14-24(35)15-17-25/h4-17,21-22,30,41H,18-20H2,1-3H3,(H,36,44)(H2,37,38,43)/t21-,22-,30-/m0/s1	INJMWLLCIWTMDU-PWWNZBMUSA-N	613.270047502							111819
BRD-K07928699	LSM-23233		44486769	InChI=1S/C26H31Cl2N7O4/c1-16-10-35(17(2)14-36)26(38)20-9-19(30-25(37)13-34-15-29-31-32-34)5-7-23(20)39-24(16)12-33(3)11-18-4-6-21(27)22(28)8-18/h4-9,15-17,24,36H,10-14H2,1-3H3,(H,30,37)/t16-,17-,24+/m0/s1	MIRHJXKFLNBQHA-WOGXIUBCSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NC(=O)Cn4cnnn4)cc3C1=O	BroadT	BRD-K07928699	BRD-K07928699-001-01-4	Broad Institute of MIT and Harvard	BRD-K07928699			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NC(=O)Cn3cnnn3)cc2C1=O	InChI=1S/C26H31Cl2N7O4/c1-16-10-35(17(2)14-36)26(38)20-9-19(30-25(37)13-34-15-29-31-32-34)5-7-23(20)39-24(16)12-33(3)11-18-4-6-21(27)22(28)8-18/h4-9,15-17,24,36H,10-14H2,1-3H3,(H,30,37)/t16-,17-,24+/m0/s1	MIRHJXKFLNBQHA-WOGXIUBCSA-N	575.181457962							111820
BRD-K02793474	LSM-23234		44485639	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18+,23-/m1/s1	BMWRPMHXUFNAQO-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K02793474	BRD-K02793474-001-01-8	Broad Institute of MIT and Harvard	BRD-K02793474			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18+,23-/m1/s1	BMWRPMHXUFNAQO-IEGUWTFLSA-N	466.258005608							111821
BRD-K05154886	LSM-23235		44486810	InChI=1S/C29H39N5O5/c1-19-16-34(20(2)18-35)28(37)23-10-7-11-24(32-27(36)21-12-14-30-15-13-21)26(23)39-25(19)17-33(3)29(38)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,25,35H,4-6,8-9,16-18H2,1-3H3,(H,31,38)(H,32,36)/t19-,20-,25+/m1/s1	KKCRHGGATFNVQS-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K05154886	BRD-K05154886-001-01-2	Broad Institute of MIT and Harvard	BRD-K05154886			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C29H39N5O5/c1-19-16-34(20(2)18-35)28(37)23-10-7-11-24(32-27(36)21-12-14-30-15-13-21)26(23)39-25(19)17-33(3)29(38)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,25,35H,4-6,8-9,16-18H2,1-3H3,(H,31,38)(H,32,36)/t19-,20-,25+/m1/s1	KKCRHGGATFNVQS-FHAGJXEFSA-N	537.295119398							111822
BRD-K63010510	LSM-23236		44486523	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)17-8-16(6-7-18(17)31-19(12)9-23-5)24-22(30)25-20-14(3)26-32-15(20)4/h6-8,12-13,19,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13-,19+/m0/s1	HGTBFUICODGLJG-WTOJCKNJSA-N	CNC[C@H]1Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K63010510	BRD-K63010510-001-01-9	Broad Institute of MIT and Harvard	BRD-K63010510			CNC[C@H]1Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C22H31N5O5/c1-12-10-27(13(2)11-28)21(29)17-8-16(6-7-18(17)31-19(12)9-23-5)24-22(30)25-20-14(3)26-32-15(20)4/h6-8,12-13,19,23,28H,9-11H2,1-5H3,(H2,24,25,30)/t12-,13-,19+/m0/s1	HGTBFUICODGLJG-WTOJCKNJSA-N	445.232519142							111823
BRD-K28351377	LSM-23237		44487179	InChI=1S/C27H41N3O4/c1-18-14-30(19(2)17-31)27(33)23-13-22(28-26(32)21-9-10-21)11-12-24(23)34-25(18)16-29(3)15-20-7-5-4-6-8-20/h11-13,18-21,25,31H,4-10,14-17H2,1-3H3,(H,28,32)/t18-,19-,25+/m0/s1	RZKDUVXCVDUJNN-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)C4CC4)cc3C1=O	BroadT	BRD-K28351377	BRD-K28351377-001-01-3	Broad Institute of MIT and Harvard	BRD-K28351377			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)C3CC3)cc2C1=O	InChI=1S/C27H41N3O4/c1-18-14-30(19(2)17-31)27(33)23-13-22(28-26(32)21-9-10-21)11-12-24(23)34-25(18)16-29(3)15-20-7-5-4-6-8-20/h11-13,18-21,25,31H,4-10,14-17H2,1-3H3,(H,28,32)/t18-,19-,25+/m0/s1	RZKDUVXCVDUJNN-XHNVNVPESA-N	471.309706822							111824
BRD-K21284411	LSM-23238		44493200	InChI=1S/C22H28N4O4/c1-14-12-26(15(2)13-27)22(29)18-10-17(4-5-19(18)30-20(14)11-23-3)25-21(28)16-6-8-24-9-7-16/h4-10,14-15,20,23,27H,11-13H2,1-3H3,(H,25,28)/t14-,15+,20+/m1/s1	ZXKRGMHNDBNPIZ-SIFCLUCFSA-N	CNC[C@@H]1Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K21284411	BRD-K21284411-001-01-1	Broad Institute of MIT and Harvard	BRD-K21284411			CNC[C@@H]1Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C22H28N4O4/c1-14-12-26(15(2)13-27)22(29)18-10-17(4-5-19(18)30-20(14)11-23-3)25-21(28)16-6-8-24-9-7-16/h4-10,14-15,20,23,27H,11-13H2,1-3H3,(H,25,28)/t14-,15+,20+/m1/s1	ZXKRGMHNDBNPIZ-SIFCLUCFSA-N	412.211055416							111825
BRD-K86978618	LSM-23239		44484853	InChI=1S/C24H32N4O5/c1-15-13-28(16(2)14-29)23(30)20-11-18(7-10-21(20)33-22(15)12-25-3)27-24(31)26-17-5-8-19(32-4)9-6-17/h5-11,15-16,22,25,29H,12-14H2,1-4H3,(H2,26,27,31)/t15-,16-,22-/m0/s1	SBTJRJPUBKNDRG-WCJKSRRJSA-N	CNC[C@@H]1Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K86978618	BRD-K86978618-001-01-1	Broad Institute of MIT and Harvard	BRD-K86978618			CNC[C@@H]1Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H32N4O5/c1-15-13-28(16(2)14-29)23(30)20-11-18(7-10-21(20)33-22(15)12-25-3)27-24(31)26-17-5-8-19(32-4)9-6-17/h5-11,15-16,22,25,29H,12-14H2,1-4H3,(H2,26,27,31)/t15-,16-,22-/m0/s1	SBTJRJPUBKNDRG-WCJKSRRJSA-N	456.237270164							111826
BRD-K06217925	LSM-8791		54657828	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23-,24+,25-/m0/s1	XKLJDQDBSRSGED-JBXUNAHCSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]2N(Cc5nccs5)C1	BroadT	BRD-K06217925	BRD-K06217925-001-01-9	Broad Institute of MIT and Harvard	BRD-K06217925			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]2N(Cc2nccs2)C1	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23-,24+,25-/m0/s1	XKLJDQDBSRSGED-JBXUNAHCSA-N	499.250477384							97412
BRD-K14385562	LSM-9298		54657862	InChI=1S/C20H29FN2O7S/c1-28-9-8-22-20(25)10-15-6-7-17-18(30-15)13-29-12-14(24)11-23(17)31(26,27)19-5-3-2-4-16(19)21/h2-5,14-15,17-18,24H,6-13H2,1H3,(H,22,25)/t14-,15+,17+,18-/m1/s1	ZIIKQONHXRNGRF-MXSMSXNCSA-N	COCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2S(=O)(=O)c3ccccc3F)O1	BroadT	BRD-K14385562	BRD-K14385562-001-01-2	Broad Institute of MIT and Harvard	BRD-K14385562			COCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2S(=O)(=O)c2ccccc2F)O1	InChI=1S/C20H29FN2O7S/c1-28-9-8-22-20(25)10-15-6-7-17-18(30-15)13-29-12-14(24)11-23(17)31(26,27)19-5-3-2-4-16(19)21/h2-5,14-15,17-18,24H,6-13H2,1H3,(H,22,25)/t14-,15+,17+,18-/m1/s1	ZIIKQONHXRNGRF-MXSMSXNCSA-N	460.167950178							97919
BRD-K83391808	LSM-13525		54657937	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17-,20-,21+/m0/s1	JLPSQBARJGYMKN-IDPBPBMLSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3C(=O)c4ccccc4F)O2	BroadT	BRD-K83391808	BRD-K83391808-001-01-0	Broad Institute of MIT and Harvard	BRD-K83391808			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c2ccccc2F)O1	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17-,20-,21+/m0/s1	JLPSQBARJGYMKN-IDPBPBMLSA-N	449.232599354							131219
BRD-K75639577	LSM-13055		54658013	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18-,19-,20+/m0/s1	PSOMVEOYXZFBLO-LWYYNNOASA-N	Cn1cnc(c1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)NCc4cccc(F)c4)CC[C@H]23	BroadT	BRD-K75639577	BRD-K75639577-001-01-1	Broad Institute of MIT and Harvard	BRD-K75639577			Cn1cnc(c1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)NCc3cccc(F)c3)CC[C@H]12	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18-,19-,20+/m0/s1	PSOMVEOYXZFBLO-LWYYNNOASA-N	496.179183578							101692
BRD-K21904592	LSM-9755		54658034	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17+,18-,19+/m1/s1	VINMFOKKSKWMTO-HCXYKTFWSA-N	O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COC1	BroadT	BRD-K21904592	BRD-K21904592-001-01-5	Broad Institute of MIT and Harvard	BRD-K21904592			O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17+,18-,19+/m1/s1	VINMFOKKSKWMTO-HCXYKTFWSA-N	360.204907396							98376
BRD-K58679238	LSM-11972		54657971	InChI=1S/C22H28FN3O5/c23-16-3-1-2-15(6-16)8-24-22(28)7-19-4-5-20-21(31-19)13-29-12-18(27)10-26(20)9-17-11-30-14-25-17/h1-3,6,11,14,18-21,27H,4-5,7-10,12-13H2,(H,24,28)/t18-,19-,20+,21-/m1/s1	ZRFCXMMZEGBTOS-MXEMCNAFSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]2N(Cc4cocn4)C1	BroadT	BRD-K58679238	BRD-K58679238-001-01-9	Broad Institute of MIT and Harvard	BRD-K58679238			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]2N(Cc2cocn2)C1	InChI=1S/C22H28FN3O5/c23-16-3-1-2-15(6-16)8-24-22(28)7-19-4-5-20-21(31-19)13-29-12-18(27)10-26(20)9-17-11-30-14-25-17/h1-3,6,11,14,18-21,27H,4-5,7-10,12-13H2,(H,24,28)/t18-,19-,20+,21-/m1/s1	ZRFCXMMZEGBTOS-MXEMCNAFSA-N	433.201299226							100598
BRD-K72109199	LSM-12847		54657866	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18+,19+,20-/m0/s1	IDLNHXHJUITYBI-NMLBUPMWSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@H]2N(C1)C(=O)Nc4cc(Cl)cc(Cl)c4	BroadT	BRD-K72109199	BRD-K72109199-001-01-6	Broad Institute of MIT and Harvard	BRD-K72109199			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@H]2N(C1)C(=O)Nc1cc(Cl)cc(Cl)c1	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18+,19+,20-/m0/s1	IDLNHXHJUITYBI-NMLBUPMWSA-N	501.143341098							101484
BRD-K86265052	LSM-13712		54657884	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21+,23-,24+/m1/s1	KOAYSPOFMXWQDS-MHHVOYGZSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)NCCCN4CCOCC4)CC[C@@H]23	BroadT	BRD-K86265052	BRD-K86265052-001-01-6	Broad Institute of MIT and Harvard	BRD-K86265052			COc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)NCCCN3CCOCC3)CC[C@@H]12	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21+,23-,24+/m1/s1	KOAYSPOFMXWQDS-MHHVOYGZSA-N	541.245785928							102360
BRD-K19190776	LSM-9581		54657925	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16+,19+,20-/m1/s1	KPSAIAGNOOFEEI-GIYDNNGJSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NC3CCC3)CC[C@@H]2N(C1)C(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K19190776	BRD-K19190776-001-01-3	Broad Institute of MIT and Harvard	BRD-K19190776			O[C@H]1COC[C@H]2O[C@H](CC(=O)NC3CCC3)CC[C@@H]2N(C1)C(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16+,19+,20-/m1/s1	KPSAIAGNOOFEEI-GIYDNNGJSA-N	485.148426478							98202
BRD-K41354272	LSM-10941		54657852	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25+,27+,28-/m0/s1	IXXIZSABFJAVRH-FMMIPFRLSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@@H]23	BroadT	BRD-K41354272	BRD-K41354272-001-01-6	Broad Institute of MIT and Harvard	BRD-K41354272			COc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25+,27+,28-/m0/s1	IXXIZSABFJAVRH-FMMIPFRLSA-N	573.250871308							99562
BRD-K38405570	LSM-10753		54657915	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15+,16-,17+/m0/s1	MWTQFHHONBVRQP-VVLHAWIVSA-N	CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)C3CCOCC3)O1	BroadT	BRD-K38405570	BRD-K38405570-001-01-0	Broad Institute of MIT and Harvard	BRD-K38405570			CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)C2CCOCC2)O1	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15+,16-,17+/m0/s1	MWTQFHHONBVRQP-VVLHAWIVSA-N	384.226036764							99374
BRD-K79490177	LSM-13283		54657845	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25+,27+,28-/m0/s1	IXXIZSABFJAVRH-WYKYZISXSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@@H]23	BroadT	BRD-K79490177	BRD-K79490177-001-01-9	Broad Institute of MIT and Harvard	BRD-K79490177			COc1ccc(cc1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25+,27+,28-/m0/s1	IXXIZSABFJAVRH-WYKYZISXSA-N	573.250871308							101922
BRD-K76637414	LSM-13117		54657873	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18+,20-,21+/m0/s1	AVCDQRNGDYLZTC-IZZBFERCSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(C1)C(=O)c4cnccn4	BroadT	BRD-K76637414	BRD-K76637414-001-01-1	Broad Institute of MIT and Harvard	BRD-K76637414			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18+,20-,21+/m0/s1	AVCDQRNGDYLZTC-IZZBFERCSA-N	458.196548204							101755
BRD-K00411687	LSM-8452		54657885	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21+,23+,24-/m0/s1	KOAYSPOFMXWQDS-VSYWRSJOSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)NCCCN4CCOCC4)CC[C@@H]23	BroadT	BRD-K00411687	BRD-K00411687-001-01-2	Broad Institute of MIT and Harvard	BRD-K00411687			COc1cccc(c1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)NCCCN3CCOCC3)CC[C@@H]12	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21+,23+,24-/m0/s1	KOAYSPOFMXWQDS-VSYWRSJOSA-N	541.245785928							97073
BRD-K25963301	LSM-10001		54657882	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21-,23-,24+/m1/s1	KOAYSPOFMXWQDS-LPHRJVMESA-N	COc1cccc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)NCCCN4CCOCC4)CC[C@@H]23	BroadT	BRD-K25963301	BRD-K25963301-001-01-9	Broad Institute of MIT and Harvard	BRD-K25963301			COc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)NCCCN3CCOCC3)CC[C@@H]12	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21-,23-,24+/m1/s1	KOAYSPOFMXWQDS-LPHRJVMESA-N	541.245785928							98622
BRD-K96047861	LSM-14322		54657900	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23-,24-,25+/m0/s1	HZAABOSBDYXUMN-WAABAYLZSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K96047861	BRD-K96047861-001-01-7	Broad Institute of MIT and Harvard	BRD-K96047861			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@@H]2N(CCC(F)(F)F)C1	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23-,24-,25+/m0/s1	HZAABOSBDYXUMN-WAABAYLZSA-N	522.234156776							102976
BRD-K03601317	LSM-8654		54657980	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27+,28-,30+/m1/s1	IQZRHVPMCXNVFS-UONLKORASA-N	COc1ccccc1CNC(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3Cc4cccc(c4)c5ccncc5)O2	BroadT	BRD-K03601317	BRD-K03601317-001-01-3	Broad Institute of MIT and Harvard	BRD-K03601317			COc1ccccc1CNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc2cccc(c2)-c2ccncc2)O1	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27+,28-,30+/m1/s1	IQZRHVPMCXNVFS-UONLKORASA-N	531.273321314							97275
BRD-K56805970	LSM-11862		54657880	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18-,20+,21-/m1/s1	AVCDQRNGDYLZTC-RMVXJAJNSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(C1)C(=O)c4cnccn4	BroadT	BRD-K56805970	BRD-K56805970-001-01-4	Broad Institute of MIT and Harvard	BRD-K56805970			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18-,20+,21-/m1/s1	AVCDQRNGDYLZTC-RMVXJAJNSA-N	458.196548204							100488
BRD-K43862194	LSM-11107		54657893	InChI=1S/C23H29N5O5/c29-18-12-28(23(31)27-16-4-2-1-3-5-16)20-7-6-19(33-21(20)14-32-13-18)10-22(30)25-11-17-8-9-24-15-26-17/h1-5,8-9,15,18-21,29H,6-7,10-14H2,(H,25,30)(H,27,31)/t18-,19+,20+,21-/m1/s1	DCLGJFWUMIZFMI-IVAOSVALSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccncn3)CC[C@@H]2N(C1)C(=O)Nc4ccccc4	BroadT	BRD-K43862194	BRD-K43862194-001-01-1	Broad Institute of MIT and Harvard	BRD-K43862194			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccncn3)CC[C@@H]2N(C1)C(=O)Nc1ccccc1	InChI=1S/C23H29N5O5/c29-18-12-28(23(31)27-16-4-2-1-3-5-16)20-7-6-19(33-21(20)14-32-13-18)10-22(30)25-11-17-8-9-24-15-26-17/h1-5,8-9,15,18-21,29H,6-7,10-14H2,(H,25,30)(H,27,31)/t18-,19+,20+,21-/m1/s1	DCLGJFWUMIZFMI-IVAOSVALSA-N	455.216869078							99728
BRD-K66775134	LSM-12498		54658058	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16-,17+,18-/m1/s1	MKIQWJGRPCGZSV-ZJPYXAASSA-N	CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc3ccncc3)O1	BroadT	BRD-K66775134	BRD-K66775134-001-01-0	Broad Institute of MIT and Harvard	BRD-K66775134			CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc2ccncc2)O1	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16-,17+,18-/m1/s1	MKIQWJGRPCGZSV-ZJPYXAASSA-N	363.215806438							101129
BRD-K44787412	LSM-11154		54658061	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16+,17+,18-/m1/s1	MKIQWJGRPCGZSV-VSZNYVQBSA-N	CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc3ccncc3)O1	BroadT	BRD-K44787412	BRD-K44787412-001-01-5	Broad Institute of MIT and Harvard	BRD-K44787412			CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc2ccncc2)O1	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16+,17+,18-/m1/s1	MKIQWJGRPCGZSV-VSZNYVQBSA-N	363.215806438							99775
BRD-K90680884	LSM-14015		54658024	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20+,22+,23-/m0/s1	BTHNBOLPOQRYCE-JVSAHFFESA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCCN3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c4ccccc4	BroadT	BRD-K90680884	BRD-K90680884-001-01-4	Broad Institute of MIT and Harvard	BRD-K90680884			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCCN3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c1ccccc1	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20+,22+,23-/m0/s1	BTHNBOLPOQRYCE-JVSAHFFESA-N	495.240306624							102668
BRD-K89491100	LSM-13943		54657819	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15-,16+,17-/m0/s1	RNNHPDFMCSWFHC-NXOAAHMSSA-N	O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COC1	BroadT	BRD-K89491100	BRD-K89491100-001-01-7	Broad Institute of MIT and Harvard	BRD-K89491100			O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COC1	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15-,16+,17-/m0/s1	RNNHPDFMCSWFHC-NXOAAHMSSA-N	349.200156374							102596
BRD-K90305015	LSM-13995		54657902	InChI=1S/C27H30Cl2N2O5/c28-20-9-19(10-21(29)11-20)27(34)31-14-22(32)15-35-16-25-24(31)6-5-23(36-25)12-26(33)30-8-7-17-3-1-2-4-18(17)13-30/h1-4,9-11,22-25,32H,5-8,12-16H2/t22-,23+,24-,25+/m1/s1	RFSVTUPSJXWLCE-RCTAOEEJSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCc4ccccc4C3)CC[C@H]2N(C1)C(=O)c5cc(Cl)cc(Cl)c5	BroadT	BRD-K90305015	BRD-K90305015-001-01-0	Broad Institute of MIT and Harvard	BRD-K90305015			O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCc4ccccc4C3)CC[C@H]2N(C1)C(=O)c1cc(Cl)cc(Cl)c1	InChI=1S/C27H30Cl2N2O5/c28-20-9-19(10-21(29)11-20)27(34)31-14-22(32)15-35-16-25-24(31)6-5-23(36-25)12-26(33)30-8-7-17-3-1-2-4-18(17)13-30/h1-4,9-11,22-25,32H,5-8,12-16H2/t22-,23+,24-,25+/m1/s1	RFSVTUPSJXWLCE-RCTAOEEJSA-N	532.1531775							102648
BRD-K50120786	LSM-11476		54657837	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20-,22-,23+/m1/s1	CDWYTZLAFHIRLQ-PRTQVNTJSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K50120786	BRD-K50120786-001-01-8	Broad Institute of MIT and Harvard	BRD-K50120786			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20-,22-,23+/m1/s1	CDWYTZLAFHIRLQ-PRTQVNTJSA-N	498.21998575							100097
BRD-K96707310	LSM-14368		54658035	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17+,18-,19+/m0/s1	VINMFOKKSKWMTO-ZSYWTGECSA-N	O[C@H]1CN[C@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COC1	BroadT	BRD-K96707310	BRD-K96707310-001-01-3	Broad Institute of MIT and Harvard	BRD-K96707310			O[C@H]1CN[C@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17+,18-,19+/m0/s1	VINMFOKKSKWMTO-ZSYWTGECSA-N	360.204907396							103022
BRD-K15535200	LSM-9360		54657875	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18+,20+,21-/m1/s1	AVCDQRNGDYLZTC-YXYSEUPNSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(C1)C(=O)c4cnccn4	BroadT	BRD-K15535200	BRD-K15535200-001-01-9	Broad Institute of MIT and Harvard	BRD-K15535200			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18+,20+,21-/m1/s1	AVCDQRNGDYLZTC-YXYSEUPNSA-N	458.196548204							97981
BRD-K42140123	LSM-10985		54658067	InChI=1S/C25H37FN2O4/c26-20-8-6-18(7-9-20)13-27-25(30)12-22-10-11-23-24(32-22)17-31-16-21(29)15-28(23)14-19-4-2-1-3-5-19/h6-9,19,21-24,29H,1-5,10-17H2,(H,27,30)/t21-,22-,23-,24+/m1/s1	CEWCLCSAKAWIOS-YCAMKHIRSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@H]2N(CC4CCCCC4)C1	BroadT	BRD-K42140123	BRD-K42140123-001-01-9	Broad Institute of MIT and Harvard	BRD-K42140123			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@H]2N(CC2CCCCC2)C1	InChI=1S/C25H37FN2O4/c26-20-8-6-18(7-9-20)13-27-25(30)12-22-10-11-23-24(32-22)17-31-16-21(29)15-28(23)14-19-4-2-1-3-5-19/h6-9,19,21-24,29H,1-5,10-17H2,(H,27,30)/t21-,22-,23-,24+/m1/s1	CEWCLCSAKAWIOS-YCAMKHIRSA-N	448.273735884							99606
BRD-K43108514	LSM-11048		54657818	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15+,16-,17+/m1/s1	RNNHPDFMCSWFHC-TWMKSMIVSA-N	O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COC1	BroadT	BRD-K43108514	BRD-K43108514-001-01-2	Broad Institute of MIT and Harvard	BRD-K43108514			O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COC1	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15+,16-,17+/m1/s1	RNNHPDFMCSWFHC-TWMKSMIVSA-N	349.200156374							99669
BRD-K49634971	LSM-11447		54658025	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20-,22-,23+/m0/s1	BTHNBOLPOQRYCE-BAMDZGJYSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCCN3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c4ccccc4	BroadT	BRD-K49634971	BRD-K49634971-001-01-7	Broad Institute of MIT and Harvard	BRD-K49634971			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCCN3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c1ccccc1	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20-,22-,23+/m0/s1	BTHNBOLPOQRYCE-BAMDZGJYSA-N	495.240306624							100068
BRD-K25940840	LSM-9999		54657946	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15-,16+,17-/m0/s1	JDHZCDHPHAWVKT-NXOAAHMSSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)c3ccncc3)O1	BroadT	BRD-K25940840	BRD-K25940840-001-01-5	Broad Institute of MIT and Harvard	BRD-K25940840			CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)c2ccncc2)O1	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15-,16+,17-/m0/s1	JDHZCDHPHAWVKT-NXOAAHMSSA-N	377.195070994							98620
BRD-K95204731	LSM-14262		54657956	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20+,22+,24-/m1/s1	YKBSBMDVZJDWJN-CETSDDCJSA-N	COc1ccccc1NC(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)NCCc4ccncc4)CC[C@H]23	BroadT	BRD-K95204731	BRD-K95204731-001-01-3	Broad Institute of MIT and Harvard	BRD-K95204731			COc1ccccc1NC(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)NCCc3ccncc3)CC[C@H]12	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20+,22+,24-/m1/s1	YKBSBMDVZJDWJN-CETSDDCJSA-N	498.247834848							102916
BRD-K86162390	LSM-13707		54658048	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11-,12-,13+/m1/s1	NGKDTDLAKVOKMV-LPWJVIDDSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2CCC(F)(F)F)O1	BroadT	BRD-K86162390	BRD-K86162390-001-01-6	Broad Institute of MIT and Harvard	BRD-K86162390			COC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2CCC(F)(F)F)O1	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11-,12-,13+/m1/s1	NGKDTDLAKVOKMV-LPWJVIDDSA-N	355.160657478							102355
BRD-K93487374	LSM-14161		54657996	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19+,20+,21-/m0/s1	AEYAMMVRWLJFNH-BQJUDKOJSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3S(=O)(=O)c4ccccc4C)O2	BroadT	BRD-K93487374	BRD-K93487374-001-01-8	Broad Institute of MIT and Harvard	BRD-K93487374			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2S(=O)(=O)c2ccccc2C)O1	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19+,20+,21-/m0/s1	AEYAMMVRWLJFNH-BQJUDKOJSA-N	481.22465656							102815
BRD-K90546933	LSM-14004		54658106	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20-,21-,22+/m1/s1	VWRSVZSWDSMGOW-YSFYHYPLSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@H]2N(C1)C(=O)c4ccncc4	BroadT	BRD-K90546933	BRD-K90546933-001-01-8	Broad Institute of MIT and Harvard	BRD-K90546933			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@H]2N(C1)C(=O)c1ccncc1	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20-,21-,22+/m1/s1	VWRSVZSWDSMGOW-YSFYHYPLSA-N	457.201299226							102657
BRD-K89631978	LSM-13957		54658070	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23+,24+,25-/m1/s1	CXJRMLHIKXWLHJ-WSOYEBOPSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCCc3ccccc3)CC[C@@H]2N(Cc4ccc(Cl)cc4)C1	BroadT	BRD-K89631978	BRD-K89631978-001-01-7	Broad Institute of MIT and Harvard	BRD-K89631978			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCCc3ccccc3)CC[C@@H]2N(Cc2ccc(Cl)cc2)C1	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23+,24+,25-/m1/s1	CXJRMLHIKXWLHJ-WSOYEBOPSA-N	472.212885266							102610
BRD-K22494201-001-01-9	LSM-23240	BRD-K22494201	54657791	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19-,20-,21+/m1/s1	QGGFARYSPQJNIH-NCYKPQTJSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2CC3CCCC3)O1	BroadT	BRD-K22494201	BRD-K22494201-001-01-9	Broad Institute of MIT and Harvard	BRD-K22494201			CN(C)CCCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2CC2CCCC2)O1	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19-,20-,21+/m1/s1	QGGFARYSPQJNIH-NCYKPQTJSA-N	411.309706822							111827
BRD-K49512493	LSM-11438		54658040	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20-,22-,23+/m0/s1	JLFHHDVKVXKGLO-BAMDZGJYSA-N	Cc1ccccc1S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)NCc4ccccc4Cl)CC[C@H]23	BroadT	BRD-K49512493	BRD-K49512493-001-01-4	Broad Institute of MIT and Harvard	BRD-K49512493			Cc1ccccc1S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)NCc3ccccc3Cl)CC[C@H]12	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20-,22-,23+/m0/s1	JLFHHDVKVXKGLO-BAMDZGJYSA-N	522.159135132							100059
BRD-K14395166	LSM-9299		54658029	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20+,22-,23+/m1/s1	BTHNBOLPOQRYCE-SKWRMQMOSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCCN3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c4ccccc4	BroadT	BRD-K14395166	BRD-K14395166-001-01-1	Broad Institute of MIT and Harvard	BRD-K14395166			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCCN3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c1ccccc1	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20+,22-,23+/m1/s1	BTHNBOLPOQRYCE-SKWRMQMOSA-N	495.240306624							97920
BRD-K02058097	LSM-8558		54657797	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17+,18-,19+/m0/s1	SSPYWNJKRFMGCQ-WZGPROSRSA-N	COc1cccc(NC(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)N(C)C)CC[C@H]23)c1	BroadT	BRD-K02058097	BRD-K02058097-001-01-3	Broad Institute of MIT and Harvard	BRD-K02058097			COc1cccc(NC(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)N(C)C)CC[C@H]23)c1	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17+,18-,19+/m0/s1	SSPYWNJKRFMGCQ-WZGPROSRSA-N	421.221285742							97179
BRD-K08247301	LSM-8927		54657844	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20+,22-,23+/m0/s1	CDWYTZLAFHIRLQ-PABCKOPISA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K08247301	BRD-K08247301-001-01-8	Broad Institute of MIT and Harvard	BRD-K08247301			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20+,22-,23+/m0/s1	CDWYTZLAFHIRLQ-PABCKOPISA-N	498.21998575							97548
BRD-K62455331	LSM-12221		54657869	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18-,19-,20+/m1/s1	IDLNHXHJUITYBI-WTGUMLROSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@H]2N(C1)C(=O)Nc4cc(Cl)cc(Cl)c4	BroadT	BRD-K62455331	BRD-K62455331-001-01-4	Broad Institute of MIT and Harvard	BRD-K62455331			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@H]2N(C1)C(=O)Nc1cc(Cl)cc(Cl)c1	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18-,19-,20+/m1/s1	IDLNHXHJUITYBI-WTGUMLROSA-N	501.143341098							100847
BRD-K51322285	LSM-11567		54657804	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17+,18+,19-/m1/s1	SSPYWNJKRFMGCQ-XGXHKWSGSA-N	COc1cccc(NC(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)N(C)C)CC[C@H]23)c1	BroadT	BRD-K51322285	BRD-K51322285-001-01-5	Broad Institute of MIT and Harvard	BRD-K51322285			COc1cccc(NC(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)N(C)C)CC[C@H]23)c1	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17+,18+,19-/m1/s1	SSPYWNJKRFMGCQ-XGXHKWSGSA-N	421.221285742							100190
BRD-K67697926	LSM-12552		54658043	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20+,22+,23-/m1/s1	JLFHHDVKVXKGLO-DWQJTFDBSA-N	Cc1ccccc1S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)NCc4ccccc4Cl)CC[C@H]23	BroadT	BRD-K67697926	BRD-K67697926-001-01-7	Broad Institute of MIT and Harvard	BRD-K67697926			Cc1ccccc1S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)NCc3ccccc3Cl)CC[C@H]12	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20+,22+,23-/m1/s1	JLFHHDVKVXKGLO-DWQJTFDBSA-N	522.159135132							101183
BRD-K72780683	LSM-12884		54658018	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24-,26-,27+/m0/s1	JIBJCGLYXNSLDN-DAANFHMWSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)N4CCN(CC4)c5ccccc5)CC[C@H]23	BroadT	BRD-K72780683	BRD-K72780683-001-01-7	Broad Institute of MIT and Harvard	BRD-K72780683			COc1cccc(c1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@H]12	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24-,26-,27+/m0/s1	JIBJCGLYXNSLDN-DAANFHMWSA-N	559.235221244							101521
BRD-K20763692	LSM-9691		54658093	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19-,20-,23+/m1/s1	TYHBJRPCTKOJBR-URFJDIBFSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@H]2N(Cc4ccc5OCOc5c4)C1	BroadT	BRD-K20763692	BRD-K20763692-001-01-5	Broad Institute of MIT and Harvard	BRD-K20763692			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19-,20-,23+/m1/s1	TYHBJRPCTKOJBR-URFJDIBFSA-N	446.241686828							98312
BRD-K13626871	LSM-9248		54658086	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22-,23+,24-/m0/s1	WWAGOAOIMIOBRQ-NLPWIYRPSA-N	CCCNC(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	BroadT	BRD-K13626871	BRD-K13626871-001-01-6	Broad Institute of MIT and Harvard	BRD-K13626871			CCCNC(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22-,23+,24-/m0/s1	WWAGOAOIMIOBRQ-NLPWIYRPSA-N	488.29987042							97869
BRD-K64391475	LSM-12358		54658007	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18+,19+,20-/m1/s1	NCINSYYDRJCYKJ-FUMNGEBKSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCC3CC3)CC[C@@H]2N(CC4CCOCC4)C1	BroadT	BRD-K64391475	BRD-K64391475-001-01-5	Broad Institute of MIT and Harvard	BRD-K64391475			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCC3CC3)CC[C@@H]2N(CC2CCOCC2)C1	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18+,19+,20-/m1/s1	NCINSYYDRJCYKJ-FUMNGEBKSA-N	396.262422272							100985
BRD-K35400569-001-01-7	LSM-10551	BRD-K35400569	54657906	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10+,11-,12+/m0/s1	LPUMVFGYOYFXDR-WHOHXGKFSA-N	O[C@H]1CN[C@H]2CC[C@H](CC(=O)Nc3nccs3)O[C@@H]2COC1	BroadT	BRD-K35400569	BRD-K35400569-001-01-7	Broad Institute of MIT and Harvard	BRD-K35400569			O[C@H]1CN[C@H]2CC[C@H](CC(=O)Nc3nccs3)O[C@@H]2COC1	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10+,11-,12+/m0/s1	LPUMVFGYOYFXDR-WHOHXGKFSA-N	327.125276872							99172
BRD-K59725859	LSM-12037		54657934	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17-,20-,21+/m1/s1	JLPSQBARJGYMKN-DGQTTZFYSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3C(=O)c4ccccc4F)O2	BroadT	BRD-K59725859	BRD-K59725859-001-01-7	Broad Institute of MIT and Harvard	BRD-K59725859			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c2ccccc2F)O1	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17-,20-,21+/m1/s1	JLPSQBARJGYMKN-DGQTTZFYSA-N	449.232599354							100663
BRD-K22508185	LSM-9793		54657975	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14+,15-,17+/m0/s1	WAKYUTRBASZCGN-QSJFSLAZSA-N	COC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c3ccccc3OC)O1	BroadT	BRD-K22508185	BRD-K22508185-001-01-6	Broad Institute of MIT and Harvard	BRD-K22508185			COC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c2ccccc2OC)O1	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14+,15-,17+/m0/s1	WAKYUTRBASZCGN-QSJFSLAZSA-N	429.145737524							98414
BRD-K18351060	LSM-9533		54658049	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11+,12-,13+/m0/s1	NGKDTDLAKVOKMV-QNWHQSFQSA-N	COC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2CCC(F)(F)F)O1	BroadT	BRD-K18351060	BRD-K18351060-001-01-7	Broad Institute of MIT and Harvard	BRD-K18351060			COC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2CCC(F)(F)F)O1	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11+,12-,13+/m0/s1	NGKDTDLAKVOKMV-QNWHQSFQSA-N	355.160657478							98154
BRD-K46065939	LSM-11235		54657982	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27+,28-,30+/m0/s1	IQZRHVPMCXNVFS-WPJHEWCLSA-N	COc1ccccc1CNC(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3Cc4cccc(c4)c5ccncc5)O2	BroadT	BRD-K46065939	BRD-K46065939-001-01-8	Broad Institute of MIT and Harvard	BRD-K46065939			COc1ccccc1CNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc2cccc(c2)-c2ccncc2)O1	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27+,28-,30+/m0/s1	IQZRHVPMCXNVFS-WPJHEWCLSA-N	531.273321314							99856
BRD-K12279187	LSM-9160		54657995	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19-,20-,21+/m0/s1	AEYAMMVRWLJFNH-XSDIEEQYSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3S(=O)(=O)c4ccccc4C)O2	BroadT	BRD-K12279187	BRD-K12279187-001-01-4	Broad Institute of MIT and Harvard	BRD-K12279187			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c2ccccc2C)O1	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19-,20-,21+/m0/s1	AEYAMMVRWLJFNH-XSDIEEQYSA-N	481.22465656							97781
BRD-K43982847	LSM-11114		54657878	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18+,20+,21-/m0/s1	AVCDQRNGDYLZTC-ZSXPUABSSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@H]2N(C1)C(=O)c4cnccn4	BroadT	BRD-K43982847	BRD-K43982847-001-01-8	Broad Institute of MIT and Harvard	BRD-K43982847			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18+,20+,21-/m0/s1	AVCDQRNGDYLZTC-ZSXPUABSSA-N	458.196548204							99735
BRD-K58945843	LSM-11988		54658041	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20-,22+,23-/m1/s1	JLFHHDVKVXKGLO-YXPKMTABSA-N	Cc1ccccc1S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)NCc4ccccc4Cl)CC[C@H]23	BroadT	BRD-K58945843	BRD-K58945843-001-01-1	Broad Institute of MIT and Harvard	BRD-K58945843			Cc1ccccc1S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@H]12	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20-,22+,23-/m1/s1	JLFHHDVKVXKGLO-YXPKMTABSA-N	522.159135132							100614
BRD-K30737452	LSM-10278		54657876	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18-,20+,21-/m0/s1	AVCDQRNGDYLZTC-MMKMLUHNSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@H]2N(C1)C(=O)c4cnccn4	BroadT	BRD-K30737452	BRD-K30737452-001-01-7	Broad Institute of MIT and Harvard	BRD-K30737452			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18-,20+,21-/m0/s1	AVCDQRNGDYLZTC-MMKMLUHNSA-N	458.196548204							98899
BRD-K65418120	LSM-12418		54658085	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22-,23+,24-/m1/s1	WWAGOAOIMIOBRQ-ZSXJVMONSA-N	CCCNC(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	BroadT	BRD-K65418120	BRD-K65418120-001-01-4	Broad Institute of MIT and Harvard	BRD-K65418120			CCCNC(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22-,23+,24-/m1/s1	WWAGOAOIMIOBRQ-ZSXJVMONSA-N	488.29987042							101045
BRD-K07522124	LSM-8875		54657994	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19-,20-,21+/m1/s1	AEYAMMVRWLJFNH-NCYKPQTJSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3S(=O)(=O)c4ccccc4C)O2	BroadT	BRD-K07522124	BRD-K07522124-001-01-0	Broad Institute of MIT and Harvard	BRD-K07522124			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c2ccccc2C)O1	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19-,20-,21+/m1/s1	AEYAMMVRWLJFNH-NCYKPQTJSA-N	481.22465656							97496
BRD-K00224166	LSM-8438		54657932	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17-,20+,21-/m1/s1	JLPSQBARJGYMKN-SGLNWRHMSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3C(=O)c4ccccc4F)O2	BroadT	BRD-K00224166	BRD-K00224166-001-01-9	Broad Institute of MIT and Harvard	BRD-K00224166			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c2ccccc2F)O1	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17-,20+,21-/m1/s1	JLPSQBARJGYMKN-SGLNWRHMSA-N	449.232599354							97059
BRD-K89692527	LSM-13962		54658036	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17-,18-,19+/m0/s1	VINMFOKKSKWMTO-CADBVGFASA-N	O[C@H]1CN[C@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COC1	BroadT	BRD-K89692527	BRD-K89692527-001-01-5	Broad Institute of MIT and Harvard	BRD-K89692527			O[C@H]1CN[C@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17-,18-,19+/m0/s1	VINMFOKKSKWMTO-CADBVGFASA-N	360.204907396							102615
BRD-K66033125	LSM-12456		54657801	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17+,18-,19+/m1/s1	SSPYWNJKRFMGCQ-LULLPPNCSA-N	COc1cccc(NC(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)N(C)C)CC[C@@H]23)c1	BroadT	BRD-K66033125	BRD-K66033125-001-01-5	Broad Institute of MIT and Harvard	BRD-K66033125			COc1cccc(NC(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)N(C)C)CC[C@@H]23)c1	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17+,18-,19+/m1/s1	SSPYWNJKRFMGCQ-LULLPPNCSA-N	421.221285742							101084
BRD-K23680395	LSM-9853		54658023	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24+,26+,27-/m1/s1	JIBJCGLYXNSLDN-PPKJMBTNSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)N4CCN(CC4)c5ccccc5)CC[C@H]23	BroadT	BRD-K23680395	BRD-K23680395-001-01-8	Broad Institute of MIT and Harvard	BRD-K23680395			COc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@H]12	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24+,26+,27-/m1/s1	JIBJCGLYXNSLDN-PPKJMBTNSA-N	559.235221244							98474
BRD-K24578841	LSM-9921		54657964	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16-,17+,18-/m1/s1	XOXZVIQHUYDNGA-ZJPYXAASSA-N	Cc1onc(C)c1NC(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)NCC4CC4)CC[C@H]23	BroadT	BRD-K24578841	BRD-K24578841-001-01-3	Broad Institute of MIT and Harvard	BRD-K24578841			Cc1noc(C)c1NC(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)NCC3CC3)CC[C@H]12	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16-,17+,18-/m1/s1	XOXZVIQHUYDNGA-ZJPYXAASSA-N	436.232184784							98542
BRD-K80741006	LSM-13367		54657993	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19+,20+,21-/m1/s1	AEYAMMVRWLJFNH-IVAOSVALSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3S(=O)(=O)c4ccccc4C)O2	BroadT	BRD-K80741006	BRD-K80741006-001-01-9	Broad Institute of MIT and Harvard	BRD-K80741006			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2S(=O)(=O)c2ccccc2C)O1	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19+,20+,21-/m1/s1	AEYAMMVRWLJFNH-IVAOSVALSA-N	481.22465656							102006
BRD-K48710616	LSM-11395		54658056	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16+,17-,18+/m1/s1	MKIQWJGRPCGZSV-XDNAFOTISA-N	CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc3ccncc3)O1	BroadT	BRD-K48710616	BRD-K48710616-001-01-7	Broad Institute of MIT and Harvard	BRD-K48710616			CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc2ccncc2)O1	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16+,17-,18+/m1/s1	MKIQWJGRPCGZSV-XDNAFOTISA-N	363.215806438							100016
BRD-K16782389	LSM-9444		54657812	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20+,22+,25-/m1/s1	HNAQDDNENYJUKU-QIRSKFFZSA-N	Cc1ccc(cc1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)NCc4ccc5OCOc5c4)CC[C@H]23	BroadT	BRD-K16782389	BRD-K16782389-001-01-9	Broad Institute of MIT and Harvard	BRD-K16782389			Cc1ccc(cc1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)NCc3ccc4OCOc4c3)CC[C@H]12	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20+,22+,25-/m1/s1	HNAQDDNENYJUKU-QIRSKFFZSA-N	532.187936694							98065
BRD-K39988373	LSM-10867		54657922	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16-,19+,20-/m0/s1	KPSAIAGNOOFEEI-FEHORTKBSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NC3CCC3)CC[C@H]2N(C1)C(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K39988373	BRD-K39988373-001-01-3	Broad Institute of MIT and Harvard	BRD-K39988373			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NC3CCC3)CC[C@H]2N(C1)C(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16-,19+,20-/m0/s1	KPSAIAGNOOFEEI-FEHORTKBSA-N	485.148426478							99488
BRD-K45595662	LSM-11212		54658071	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23-,24+,25-/m0/s1	CXJRMLHIKXWLHJ-JBXUNAHCSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCCc3ccccc3)CC[C@H]2N(Cc4ccc(Cl)cc4)C1	BroadT	BRD-K45595662	BRD-K45595662-001-01-8	Broad Institute of MIT and Harvard	BRD-K45595662			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCCc3ccccc3)CC[C@H]2N(Cc2ccc(Cl)cc2)C1	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23-,24+,25-/m0/s1	CXJRMLHIKXWLHJ-JBXUNAHCSA-N	472.212885266							99833
BRD-K88607897	LSM-13873		54657889	InChI=1S/C23H29N5O5/c29-18-12-28(23(31)27-16-4-2-1-3-5-16)20-7-6-19(33-21(20)14-32-13-18)10-22(30)25-11-17-8-9-24-15-26-17/h1-5,8-9,15,18-21,29H,6-7,10-14H2,(H,25,30)(H,27,31)/t18-,19-,20+,21-/m0/s1	DCLGJFWUMIZFMI-BURNTYAHSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccncn3)CC[C@H]2N(C1)C(=O)Nc4ccccc4	BroadT	BRD-K88607897	BRD-K88607897-001-01-6	Broad Institute of MIT and Harvard	BRD-K88607897			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccncn3)CC[C@H]2N(C1)C(=O)Nc1ccccc1	InChI=1S/C23H29N5O5/c29-18-12-28(23(31)27-16-4-2-1-3-5-16)20-7-6-19(33-21(20)14-32-13-18)10-22(30)25-11-17-8-9-24-15-26-17/h1-5,8-9,15,18-21,29H,6-7,10-14H2,(H,25,30)(H,27,31)/t18-,19-,20+,21-/m0/s1	DCLGJFWUMIZFMI-BURNTYAHSA-N	455.216869078							102526
BRD-K26862321-001-01-8	LSM-10058	BRD-K26862321	54657910	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10+,11+,12-/m1/s1	LPUMVFGYOYFXDR-NOOOWODRSA-N	O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)Nc3nccs3)O[C@@H]2COC1	BroadT	BRD-K26862321	BRD-K26862321-001-01-8	Broad Institute of MIT and Harvard	BRD-K26862321			O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)Nc3nccs3)O[C@@H]2COC1	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10+,11+,12-/m1/s1	LPUMVFGYOYFXDR-NOOOWODRSA-N	327.125276872							98679
MLS003650132	LSM-9187	SID125305425, BRD-K12805559	53382781	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23+,24+,25-/m0/s1	CXJRMLHIKXWLHJ-LIONHTAISA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCCc3ccccc3)CC[C@H]2N(Cc4ccc(Cl)cc4)C1	BroadT	BRD-K12805559	BRD-K12805559-001-01-6	Broad Institute of MIT and Harvard	BRD-K12805559			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCCc3ccccc3)CC[C@H]2N(Cc2ccc(Cl)cc2)C1	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23+,24+,25-/m0/s1	CXJRMLHIKXWLHJ-LIONHTAISA-N	472.212885266							97808
BRD-K39447340	LSM-10825		54658019	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24+,26-,27+/m0/s1	JIBJCGLYXNSLDN-UICHKGEESA-N	COc1cccc(c1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)N4CCN(CC4)c5ccccc5)CC[C@H]23	BroadT	BRD-K39447340	BRD-K39447340-001-01-0	Broad Institute of MIT and Harvard	BRD-K39447340			COc1cccc(c1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@H]12	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24+,26-,27+/m0/s1	JIBJCGLYXNSLDN-UICHKGEESA-N	559.235221244							99446
BRD-K71540580	LSM-12805		54657832	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18+,20+,21-/m0/s1	LTCDBOWOUBSGLM-ZSXPUABSSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@H]2N(Cc4ccccc4F)C1	BroadT	BRD-K71540580	BRD-K71540580-001-01-0	Broad Institute of MIT and Harvard	BRD-K71540580			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@H]2N(Cc2ccccc2F)C1	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18+,20+,21-/m0/s1	LTCDBOWOUBSGLM-ZSXPUABSSA-N	406.226785692							101442
BRD-K70166659	LSM-12710		54657799	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17-,18-,19+/m0/s1	SSPYWNJKRFMGCQ-DSLXNQLJSA-N	COc1cccc(NC(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)N(C)C)CC[C@H]23)c1	BroadT	BRD-K70166659	BRD-K70166659-001-01-1	Broad Institute of MIT and Harvard	BRD-K70166659			COc1cccc(NC(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)N(C)C)CC[C@H]23)c1	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17-,18-,19+/m0/s1	SSPYWNJKRFMGCQ-DSLXNQLJSA-N	421.221285742							101345
BRD-K68780601-001-01-2	LSM-12626	BRD-K68780601	54657950	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15-,16-,17+/m1/s1	JDHZCDHPHAWVKT-VQHPVUNQSA-N	CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c3ccncc3)O1	BroadT	BRD-K68780601	BRD-K68780601-001-01-2	Broad Institute of MIT and Harvard	BRD-K68780601			CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c2ccncc2)O1	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15-,16-,17+/m1/s1	JDHZCDHPHAWVKT-VQHPVUNQSA-N	377.195070994							101259
BRD-K80806285	LSM-13370		54657842	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20-,22+,23-/m1/s1	CDWYTZLAFHIRLQ-YXPKMTABSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K80806285	BRD-K80806285-001-01-2	Broad Institute of MIT and Harvard	BRD-K80806285			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20-,22+,23-/m1/s1	CDWYTZLAFHIRLQ-YXPKMTABSA-N	498.21998575							102009
BRD-K61415682	LSM-12149		54657888	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21+,23+,24-/m1/s1	KOAYSPOFMXWQDS-BKXMBWNOSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)NCCCN4CCOCC4)CC[C@H]23	BroadT	BRD-K61415682	BRD-K61415682-001-01-4	Broad Institute of MIT and Harvard	BRD-K61415682			COc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)NCCCN3CCOCC3)CC[C@H]12	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21+,23+,24-/m1/s1	KOAYSPOFMXWQDS-BKXMBWNOSA-N	541.245785928							100775
BRD-K23589333	LSM-9847		54657970	InChI=1S/C22H28FN3O5/c23-16-3-1-2-15(6-16)8-24-22(28)7-19-4-5-20-21(31-19)13-29-12-18(27)10-26(20)9-17-11-30-14-25-17/h1-3,6,11,14,18-21,27H,4-5,7-10,12-13H2,(H,24,28)/t18-,19-,20-,21+/m1/s1	ZRFCXMMZEGBTOS-NCYKPQTJSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@H]2N(Cc4cocn4)C1	BroadT	BRD-K23589333	BRD-K23589333-001-01-6	Broad Institute of MIT and Harvard	BRD-K23589333			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@H]2N(Cc2cocn2)C1	InChI=1S/C22H28FN3O5/c23-16-3-1-2-15(6-16)8-24-22(28)7-19-4-5-20-21(31-19)13-29-12-18(27)10-26(20)9-17-11-30-14-25-17/h1-3,6,11,14,18-21,27H,4-5,7-10,12-13H2,(H,24,28)/t18-,19-,20-,21+/m1/s1	ZRFCXMMZEGBTOS-NCYKPQTJSA-N	433.201299226							98468
BRD-K52203672	LSM-11621		54658084	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22-,23-,24+/m0/s1	WWAGOAOIMIOBRQ-VHJOFQCFSA-N	CCCNC(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	BroadT	BRD-K52203672	BRD-K52203672-001-01-7	Broad Institute of MIT and Harvard	BRD-K52203672			CCCNC(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22-,23-,24+/m0/s1	WWAGOAOIMIOBRQ-VHJOFQCFSA-N	488.29987042							100245
BRD-K02322717	LSM-8579		54657840	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20+,22+,23-/m1/s1	CDWYTZLAFHIRLQ-DWQJTFDBSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K02322717	BRD-K02322717-001-01-3	Broad Institute of MIT and Harvard	BRD-K02322717			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20+,22+,23-/m1/s1	CDWYTZLAFHIRLQ-DWQJTFDBSA-N	498.21998575							97200
BRD-K97048125	LSM-14391		54657848	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25+,27+,28-/m1/s1	IXXIZSABFJAVRH-DXTQFLITSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@H]23	BroadT	BRD-K97048125	BRD-K97048125-001-01-6	Broad Institute of MIT and Harvard	BRD-K97048125			COc1ccc(cc1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25+,27+,28-/m1/s1	IXXIZSABFJAVRH-DXTQFLITSA-N	573.250871308							103045
MLS003650139	LSM-9842	BRD-K23557133	53382788	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22-,23+,24-/m1/s1	WWAGOAOIMIOBRQ-QWQGWLCTSA-N	CCCNC(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	BroadT	BRD-K23557133	BRD-K23557133-001-01-5	Broad Institute of MIT and Harvard	BRD-K23557133			CCCNC(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22-,23+,24-/m1/s1	WWAGOAOIMIOBRQ-QWQGWLCTSA-N	488.29987042							98463
BRD-K06418154	LSM-8802		54658100	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20+,21+,22-/m1/s1	VWRSVZSWDSMGOW-CLAROIROSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]2N(C1)C(=O)c4ccncc4	BroadT	BRD-K06418154	BRD-K06418154-001-01-5	Broad Institute of MIT and Harvard	BRD-K06418154			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]2N(C1)C(=O)c1ccncc1	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20+,21+,22-/m1/s1	VWRSVZSWDSMGOW-CLAROIROSA-N	457.201299226							97423
BRD-K63270290	LSM-12277		54658005	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18+,19-,20+/m0/s1	NCINSYYDRJCYKJ-ZGXWSNOMSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CC3)CC[C@@H]2N(CC4CCOCC4)C1	BroadT	BRD-K63270290	BRD-K63270290-001-01-5	Broad Institute of MIT and Harvard	BRD-K63270290			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CC3)CC[C@@H]2N(CC2CCOCC2)C1	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18+,19-,20+/m0/s1	NCINSYYDRJCYKJ-ZGXWSNOMSA-N	396.262422272							100903
BRD-K76436920	LSM-13103		54658102	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20-,21+,22-/m1/s1	VWRSVZSWDSMGOW-YUMYIRISSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]2N(C1)C(=O)c4ccncc4	BroadT	BRD-K76436920	BRD-K76436920-001-01-5	Broad Institute of MIT and Harvard	BRD-K76436920			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]2N(C1)C(=O)c1ccncc1	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20-,21+,22-/m1/s1	VWRSVZSWDSMGOW-YUMYIRISSA-N	457.201299226							101741
BRD-K99149118	LSM-14518		54657898	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23-,24+,25-/m1/s1	HZAABOSBDYXUMN-ZBCONREDSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K99149118	BRD-K99149118-001-01-9	Broad Institute of MIT and Harvard	BRD-K99149118			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@@H]2N(CCC(F)(F)F)C1	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23-,24+,25-/m1/s1	HZAABOSBDYXUMN-ZBCONREDSA-N	522.234156776							103173
BRD-K31920348	LSM-10365		54657989	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20+,21+,22-/m1/s1	UZQWVSGPDQQYNK-CLAROIROSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3Cc4cccc(F)c4)O2	BroadT	BRD-K31920348	BRD-K31920348-001-01-6	Broad Institute of MIT and Harvard	BRD-K31920348			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc2cccc(F)c2)O1	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20+,21+,22-/m1/s1	UZQWVSGPDQQYNK-CLAROIROSA-N	435.253334798							98986
BRD-K34392222	LSM-10503		54658088	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22-,23+,24-/m0/s1	WWAGOAOIMIOBRQ-QOXFPCGXSA-N	CCCNC(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	BroadT	BRD-K34392222	BRD-K34392222-001-01-6	Broad Institute of MIT and Harvard	BRD-K34392222			CCCNC(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22-,23+,24-/m0/s1	WWAGOAOIMIOBRQ-QOXFPCGXSA-N	488.29987042							99124
BRD-K64619734	LSM-12375		54657861	InChI=1S/C20H29FN2O7S/c1-28-9-8-22-20(25)10-15-6-7-17-18(30-15)13-29-12-14(24)11-23(17)31(26,27)19-5-3-2-4-16(19)21/h2-5,14-15,17-18,24H,6-13H2,1H3,(H,22,25)/t14-,15-,17-,18+/m0/s1	ZIIKQONHXRNGRF-UOVPBQLFSA-N	COCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c3ccccc3F)O1	BroadT	BRD-K64619734	BRD-K64619734-001-01-6	Broad Institute of MIT and Harvard	BRD-K64619734			COCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c2ccccc2F)O1	InChI=1S/C20H29FN2O7S/c1-28-9-8-22-20(25)10-15-6-7-17-18(30-15)13-29-12-14(24)11-23(17)31(26,27)19-5-3-2-4-16(19)21/h2-5,14-15,17-18,24H,6-13H2,1H3,(H,22,25)/t14-,15-,17-,18+/m0/s1	ZIIKQONHXRNGRF-UOVPBQLFSA-N	460.167950178							101002
BRD-K32882027	LSM-10424		54657851	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25+,27-,28+/m0/s1	IXXIZSABFJAVRH-CGCVZMNNSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@H]23	BroadT	BRD-K32882027	BRD-K32882027-001-01-5	Broad Institute of MIT and Harvard	BRD-K32882027			COc1ccc(cc1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25+,27-,28+/m0/s1	IXXIZSABFJAVRH-CGCVZMNNSA-N	573.250871308							99045
BRD-K96569047	LSM-14353		54657954	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20-,22-,24+/m1/s1	YKBSBMDVZJDWJN-RKONGDRVSA-N	COc1ccccc1NC(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)NCCc4ccncc4)CC[C@@H]23	BroadT	BRD-K96569047	BRD-K96569047-001-01-7	Broad Institute of MIT and Harvard	BRD-K96569047			COc1ccccc1NC(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)NCCc3ccncc3)CC[C@@H]12	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20-,22-,24+/m1/s1	YKBSBMDVZJDWJN-RKONGDRVSA-N	498.247834848							103007
BRD-K80408519	LSM-13345		54657968	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16-,17-,18+/m0/s1	XOXZVIQHUYDNGA-XLAORIBOSA-N	Cc1onc(C)c1NC(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)NCC4CC4)CC[C@H]23	BroadT	BRD-K80408519	BRD-K80408519-001-01-5	Broad Institute of MIT and Harvard	BRD-K80408519			Cc1noc(C)c1NC(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)NCC3CC3)CC[C@H]12	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16-,17-,18+/m0/s1	XOXZVIQHUYDNGA-XLAORIBOSA-N	436.232184784							101984
BRD-K76624532	LSM-14930		54657807	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20+,22-,25+/m0/s1	HNAQDDNENYJUKU-FOTFPPMPSA-N	Cc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)NCc4ccc5OCOc5c4)CC[C@H]23	BroadT	BRD-K76624532	BRD-K76624532-001-01-6	Broad Institute of MIT and Harvard	BRD-K76624532			Cc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3ccc4OCOc4c3)CC[C@H]12	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20+,22-,25+/m0/s1	HNAQDDNENYJUKU-FOTFPPMPSA-N	532.187936694							103586
BRD-K13448237	LSM-9234		54658032	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17-,18+,19-/m0/s1	VINMFOKKSKWMTO-OKYOBFRVSA-N	O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COC1	BroadT	BRD-K13448237	BRD-K13448237-001-01-4	Broad Institute of MIT and Harvard	BRD-K13448237			O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17-,18+,19-/m0/s1	VINMFOKKSKWMTO-OKYOBFRVSA-N	360.204907396							97855
BRD-K19405573	LSM-9598		54657823	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23+,24+,25-/m1/s1	XKLJDQDBSRSGED-WSOYEBOPSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]2N(Cc5nccs5)C1	BroadT	BRD-K19405573	BRD-K19405573-001-01-0	Broad Institute of MIT and Harvard	BRD-K19405573			O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]2N(Cc2nccs2)C1	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23+,24+,25-/m1/s1	XKLJDQDBSRSGED-WSOYEBOPSA-N	499.250477384							98219
BRD-K06714535	LSM-8821		54657850	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25-,27-,28+/m0/s1	IXXIZSABFJAVRH-GPBMDOCHSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@H]23	BroadT	BRD-K06714535	BRD-K06714535-001-01-7	Broad Institute of MIT and Harvard	BRD-K06714535			COc1ccc(cc1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25-,27-,28+/m0/s1	IXXIZSABFJAVRH-GPBMDOCHSA-N	573.250871308							97442
BRD-K07572455	LSM-8881		54657847	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25-,27-,28+/m1/s1	IXXIZSABFJAVRH-GGPXUCSVSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@@H]23	BroadT	BRD-K07572455	BRD-K07572455-001-01-4	Broad Institute of MIT and Harvard	BRD-K07572455			COc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25-,27-,28+/m1/s1	IXXIZSABFJAVRH-GGPXUCSVSA-N	573.250871308							97502
BRD-K29642180	LSM-10227		54657943	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22-,23+,24-/m0/s1	UWGYAIIPASVTSB-XQUALCHDSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(Cc4cccc(Cl)c4)C1	BroadT	BRD-K29642180	BRD-K29642180-001-01-1	Broad Institute of MIT and Harvard	BRD-K29642180			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(Cc2cccc(Cl)c2)C1	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22-,23+,24-/m0/s1	UWGYAIIPASVTSB-XQUALCHDSA-N	464.244185394							98848
BRD-K69548259	LSM-12671		54657857	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25+,27-,28+/m1/s1	IXXIZSABFJAVRH-LXKKXDFRSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@@H]23	BroadT	BRD-K69548259	BRD-K69548259-001-01-7	Broad Institute of MIT and Harvard	BRD-K69548259			COc1ccc(cc1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25+,27-,28+/m1/s1	IXXIZSABFJAVRH-LXKKXDFRSA-N	573.250871308							101305
BRD-K98668154	LSM-14485		54657822	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23-,24-,25+/m1/s1	XKLJDQDBSRSGED-VPBXCIAMSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]2N(Cc5nccs5)C1	BroadT	BRD-K98668154	BRD-K98668154-001-01-4	Broad Institute of MIT and Harvard	BRD-K98668154			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]2N(Cc2nccs2)C1	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23-,24-,25+/m1/s1	XKLJDQDBSRSGED-VPBXCIAMSA-N	499.250477384							103140
BRD-K07790303	LSM-8897		54657858	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25-,27+,28-/m1/s1	IXXIZSABFJAVRH-SJIMBTIBSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@H]23	BroadT	BRD-K07790303	BRD-K07790303-001-01-6	Broad Institute of MIT and Harvard	BRD-K07790303			COc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25-,27+,28-/m1/s1	IXXIZSABFJAVRH-SJIMBTIBSA-N	573.250871308							97518
BRD-K52831370	LSM-11651		54657808	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20-,22-,25+/m1/s1	HNAQDDNENYJUKU-SMISUXHESA-N	Cc1ccc(cc1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)NCc4ccc5OCOc5c4)CC[C@@H]23	BroadT	BRD-K52831370	BRD-K52831370-001-01-0	Broad Institute of MIT and Harvard	BRD-K52831370			Cc1ccc(cc1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)NCc3ccc4OCOc4c3)CC[C@@H]12	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20-,22-,25+/m1/s1	HNAQDDNENYJUKU-SMISUXHESA-N	532.187936694							100276
BRD-K44482328	LSM-11136		54657938	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22-,23-,24+/m1/s1	UWGYAIIPASVTSB-YCAMKHIRSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(Cc4cccc(Cl)c4)C1	BroadT	BRD-K44482328	BRD-K44482328-001-01-6	Broad Institute of MIT and Harvard	BRD-K44482328			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(Cc2cccc(Cl)c2)C1	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22-,23-,24+/m1/s1	UWGYAIIPASVTSB-YCAMKHIRSA-N	464.244185394							99757
BRD-K42207609	LSM-10991		54657960	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20+,22+,24-/m0/s1	YKBSBMDVZJDWJN-IKJKNFHUSA-N	COc1ccccc1NC(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)NCCc4ccncc4)CC[C@@H]23	BroadT	BRD-K42207609	BRD-K42207609-001-01-9	Broad Institute of MIT and Harvard	BRD-K42207609			COc1ccccc1NC(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)NCCc3ccncc3)CC[C@@H]12	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20+,22+,24-/m0/s1	YKBSBMDVZJDWJN-IKJKNFHUSA-N	498.247834848							99612
BRD-K88361133	LSM-13861		54657891	InChI=1S/C23H29N5O5/c29-18-12-28(23(31)27-16-4-2-1-3-5-16)20-7-6-19(33-21(20)14-32-13-18)10-22(30)25-11-17-8-9-24-15-26-17/h1-5,8-9,15,18-21,29H,6-7,10-14H2,(H,25,30)(H,27,31)/t18-,19+,20+,21-/m0/s1	DCLGJFWUMIZFMI-BQJUDKOJSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccncn3)CC[C@H]2N(C1)C(=O)Nc4ccccc4	BroadT	BRD-K88361133	BRD-K88361133-001-01-4	Broad Institute of MIT and Harvard	BRD-K88361133			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccncn3)CC[C@H]2N(C1)C(=O)Nc1ccccc1	InChI=1S/C23H29N5O5/c29-18-12-28(23(31)27-16-4-2-1-3-5-16)20-7-6-19(33-21(20)14-32-13-18)10-22(30)25-11-17-8-9-24-15-26-17/h1-5,8-9,15,18-21,29H,6-7,10-14H2,(H,25,30)(H,27,31)/t18-,19+,20+,21-/m0/s1	DCLGJFWUMIZFMI-BQJUDKOJSA-N	455.216869078							102512
BRD-K88786596	LSM-13884		54657986	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20-,21-,22+/m1/s1	UZQWVSGPDQQYNK-YSFYHYPLSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3Cc4cccc(F)c4)O2	BroadT	BRD-K88786596	BRD-K88786596-001-01-2	Broad Institute of MIT and Harvard	BRD-K88786596			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc2cccc(F)c2)O1	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20-,21-,22+/m1/s1	UZQWVSGPDQQYNK-YSFYHYPLSA-N	435.253334798							102537
BRD-K56535275	LSM-11846		54658096	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19-,20+,23-/m1/s1	TYHBJRPCTKOJBR-ISHFTEKXSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@@H]2N(Cc4ccc5OCOc5c4)C1	BroadT	BRD-K56535275	BRD-K56535275-001-01-9	Broad Institute of MIT and Harvard	BRD-K56535275			O[C@H]1COC[C@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19-,20+,23-/m1/s1	TYHBJRPCTKOJBR-ISHFTEKXSA-N	446.241686828							100472
BRD-K03222452	LSM-8632		54658060	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16+,17+,18-/m0/s1	MKIQWJGRPCGZSV-MLHJIOFPSA-N	CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc3ccncc3)O1	BroadT	BRD-K03222452	BRD-K03222452-001-01-3	Broad Institute of MIT and Harvard	BRD-K03222452			CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc2ccncc2)O1	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16+,17+,18-/m0/s1	MKIQWJGRPCGZSV-MLHJIOFPSA-N	363.215806438							97253
BRD-K30270755	LSM-10256		54658014	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18+,19-,20+/m0/s1	PSOMVEOYXZFBLO-ZGXWSNOMSA-N	Cn1cnc(c1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)NCc4cccc(F)c4)CC[C@H]23	BroadT	BRD-K30270755	BRD-K30270755-001-01-3	Broad Institute of MIT and Harvard	BRD-K30270755			Cn1cnc(c1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@H]12	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18+,19-,20+/m0/s1	PSOMVEOYXZFBLO-ZGXWSNOMSA-N	496.179183578							98877
BRD-K33610498	LSM-10465		54657839	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20-,22+,23-/m0/s1	CDWYTZLAFHIRLQ-RLBLXZPPSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K33610498	BRD-K33610498-001-01-9	Broad Institute of MIT and Harvard	BRD-K33610498			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20-,22+,23-/m0/s1	CDWYTZLAFHIRLQ-RLBLXZPPSA-N	498.21998575							99086
BRD-K82154894	LSM-13449		54658082	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22+,23-,24+/m1/s1	WWAGOAOIMIOBRQ-BAHGYDIPSA-N	CCCNC(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	BroadT	BRD-K82154894	BRD-K82154894-001-01-8	Broad Institute of MIT and Harvard	BRD-K82154894			CCCNC(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22+,23-,24+/m1/s1	WWAGOAOIMIOBRQ-BAHGYDIPSA-N	488.29987042							102089
BRD-K56763965	LSM-11860		54657972	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14+,15-,17+/m1/s1	WAKYUTRBASZCGN-DLTWYDFYSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c3ccccc3OC)O1	BroadT	BRD-K56763965	BRD-K56763965-001-01-2	Broad Institute of MIT and Harvard	BRD-K56763965			COC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c2ccccc2OC)O1	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14+,15-,17+/m1/s1	WAKYUTRBASZCGN-DLTWYDFYSA-N	429.145737524							100486
BRD-K51774400	LSM-11594		54657942	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22+,23-,24+/m0/s1	UWGYAIIPASVTSB-UARRHKHWSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(Cc4cccc(Cl)c4)C1	BroadT	BRD-K51774400	BRD-K51774400-001-01-7	Broad Institute of MIT and Harvard	BRD-K51774400			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(Cc2cccc(Cl)c2)C1	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22+,23-,24+/m0/s1	UWGYAIIPASVTSB-UARRHKHWSA-N	464.244185394							100217
BRD-K70617194	LSM-12734		54657834	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18+,20+,21-/m1/s1	LTCDBOWOUBSGLM-YXYSEUPNSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NC3CCC3)CC[C@@H]2N(Cc4ccccc4F)C1	BroadT	BRD-K70617194	BRD-K70617194-001-01-5	Broad Institute of MIT and Harvard	BRD-K70617194			O[C@H]1COC[C@H]2O[C@H](CC(=O)NC3CCC3)CC[C@@H]2N(Cc2ccccc2F)C1	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18+,20+,21-/m1/s1	LTCDBOWOUBSGLM-YXYSEUPNSA-N	406.226785692							101370
BRD-K70653194	LSM-12738		54658065	InChI=1S/C25H37FN2O4/c26-20-8-6-18(7-9-20)13-27-25(30)12-22-10-11-23-24(32-22)17-31-16-21(29)15-28(23)14-19-4-2-1-3-5-19/h6-9,19,21-24,29H,1-5,10-17H2,(H,27,30)/t21-,22-,23-,24+/m0/s1	CEWCLCSAKAWIOS-NEWJYFPISA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(CC4CCCCC4)C1	BroadT	BRD-K70653194	BRD-K70653194-001-01-0	Broad Institute of MIT and Harvard	BRD-K70653194			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(CC2CCCCC2)C1	InChI=1S/C25H37FN2O4/c26-20-8-6-18(7-9-20)13-27-25(30)12-22-10-11-23-24(32-22)17-31-16-21(29)15-28(23)14-19-4-2-1-3-5-19/h6-9,19,21-24,29H,1-5,10-17H2,(H,27,30)/t21-,22-,23-,24+/m0/s1	CEWCLCSAKAWIOS-NEWJYFPISA-N	448.273735884							101374
BRD-K63987424	LSM-12335		54657959	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20-,22-,24+/m0/s1	YKBSBMDVZJDWJN-CGCKEFBRSA-N	COc1ccccc1NC(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)NCCc4ccncc4)CC[C@H]23	BroadT	BRD-K63987424	BRD-K63987424-001-01-3	Broad Institute of MIT and Harvard	BRD-K63987424			COc1ccccc1NC(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)NCCc3ccncc3)CC[C@H]12	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20-,22-,24+/m0/s1	YKBSBMDVZJDWJN-CGCKEFBRSA-N	498.247834848							100962
BRD-K04025047	LSM-8676		54657913	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10+,11+,12-/m0/s1	LPUMVFGYOYFXDR-QCNOEVLYSA-N	O[C@H]1CN[C@@H]2CC[C@H](CC(=O)Nc3nccs3)O[C@H]2COC1	BroadT	BRD-K04025047	BRD-K04025047-001-01-1	Broad Institute of MIT and Harvard	BRD-K04025047			O[C@H]1CN[C@@H]2CC[C@H](CC(=O)Nc3nccs3)O[C@H]2COC1	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10+,11+,12-/m0/s1	LPUMVFGYOYFXDR-QCNOEVLYSA-N	327.125276872							97297
BRD-K83341069	LSM-13521		54658099	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20+,21+,22-/m0/s1	VWRSVZSWDSMGOW-CBPXPLCBSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@H]2N(C1)C(=O)c4ccncc4	BroadT	BRD-K83341069	BRD-K83341069-001-01-9	Broad Institute of MIT and Harvard	BRD-K83341069			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@H]2N(C1)C(=O)c1ccncc1	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20+,21+,22-/m0/s1	VWRSVZSWDSMGOW-CBPXPLCBSA-N	457.201299226							102162
BRD-K78023266	LSM-13203		54657890	InChI=1S/C23H29N5O5/c29-18-12-28(23(31)27-16-4-2-1-3-5-16)20-7-6-19(33-21(20)14-32-13-18)10-22(30)25-11-17-8-9-24-15-26-17/h1-5,8-9,15,18-21,29H,6-7,10-14H2,(H,25,30)(H,27,31)/t18-,19+,20-,21+/m1/s1	DCLGJFWUMIZFMI-MHTWAQMVSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccncn3)CC[C@H]2N(C1)C(=O)Nc4ccccc4	BroadT	BRD-K78023266	BRD-K78023266-001-01-1	Broad Institute of MIT and Harvard	BRD-K78023266			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccncn3)CC[C@H]2N(C1)C(=O)Nc1ccccc1	InChI=1S/C23H29N5O5/c29-18-12-28(23(31)27-16-4-2-1-3-5-16)20-7-6-19(33-21(20)14-32-13-18)10-22(30)25-11-17-8-9-24-15-26-17/h1-5,8-9,15,18-21,29H,6-7,10-14H2,(H,25,30)(H,27,31)/t18-,19+,20-,21+/m1/s1	DCLGJFWUMIZFMI-MHTWAQMVSA-N	455.216869078							101841
BRD-K41579429	LSM-10954		54658094	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19-,20+,23-/m0/s1	TYHBJRPCTKOJBR-GJPOJAMWSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@H]2N(Cc4ccc5OCOc5c4)C1	BroadT	BRD-K41579429	BRD-K41579429-001-01-0	Broad Institute of MIT and Harvard	BRD-K41579429			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19-,20+,23-/m0/s1	TYHBJRPCTKOJBR-GJPOJAMWSA-N	446.241686828							99575
BRD-K56864693	LSM-11864		54657967	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16+,17-,18+/m0/s1	XOXZVIQHUYDNGA-XWTMOSNGSA-N	Cc1onc(C)c1NC(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)NCC4CC4)CC[C@H]23	BroadT	BRD-K56864693	BRD-K56864693-001-01-7	Broad Institute of MIT and Harvard	BRD-K56864693			Cc1noc(C)c1NC(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NCC3CC3)CC[C@H]12	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16+,17-,18+/m0/s1	XOXZVIQHUYDNGA-XWTMOSNGSA-N	436.232184784							100490
BRD-K71100175	LSM-12770		54657939	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22-,23+,24-/m1/s1	UWGYAIIPASVTSB-JLLPCOHGSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(Cc4cccc(Cl)c4)C1	BroadT	BRD-K71100175	BRD-K71100175-001-01-4	Broad Institute of MIT and Harvard	BRD-K71100175			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(Cc2cccc(Cl)c2)C1	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22-,23+,24-/m1/s1	UWGYAIIPASVTSB-JLLPCOHGSA-N	464.244185394							101407
BRD-K01202062	LSM-8504		54657817	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15-,16-,17+/m0/s1	RNNHPDFMCSWFHC-LUKYLMHMSA-N	O[C@H]1CN[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COC1	BroadT	BRD-K01202062	BRD-K01202062-001-01-9	Broad Institute of MIT and Harvard	BRD-K01202062			O[C@H]1CN[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COC1	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15-,16-,17+/m0/s1	RNNHPDFMCSWFHC-LUKYLMHMSA-N	349.200156374							97125
BRD-K02189204	LSM-8567		54657816	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15+,16+,17-/m1/s1	RNNHPDFMCSWFHC-LTIDMASMSA-N	O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COC1	BroadT	BRD-K02189204	BRD-K02189204-001-01-6	Broad Institute of MIT and Harvard	BRD-K02189204			O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COC1	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15+,16+,17-/m1/s1	RNNHPDFMCSWFHC-LTIDMASMSA-N	349.200156374							97188
BRD-K00918977	LSM-8489		54658079	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22+,23+,24-/m1/s1	WWAGOAOIMIOBRQ-URYYLNOGSA-N	CCCNC(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	BroadT	BRD-K00918977	BRD-K00918977-001-01-5	Broad Institute of MIT and Harvard	BRD-K00918977			CCCNC(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22+,23+,24-/m1/s1	WWAGOAOIMIOBRQ-URYYLNOGSA-N	488.29987042							97110
BRD-K30199293	LSM-10251		54658003	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18-,19-,20+/m0/s1	NCINSYYDRJCYKJ-LWYYNNOASA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCC3CC3)CC[C@@H]2N(CC4CCOCC4)C1	BroadT	BRD-K30199293	BRD-K30199293-001-01-3	Broad Institute of MIT and Harvard	BRD-K30199293			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCC3CC3)CC[C@@H]2N(CC2CCOCC2)C1	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18-,19-,20+/m0/s1	NCINSYYDRJCYKJ-LWYYNNOASA-N	396.262422272							98872
BRD-K38290133	LSM-10746		54657829	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18-,20-,21+/m1/s1	LTCDBOWOUBSGLM-UKAVVXHISA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@H]2N(Cc4ccccc4F)C1	BroadT	BRD-K38290133	BRD-K38290133-001-01-6	Broad Institute of MIT and Harvard	BRD-K38290133			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@H]2N(Cc2ccccc2F)C1	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18-,20-,21+/m1/s1	LTCDBOWOUBSGLM-UKAVVXHISA-N	406.226785692							99367
BRD-K23154136	LSM-9831		54657919	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15-,16+,17-/m0/s1	MWTQFHHONBVRQP-NXOAAHMSSA-N	CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)C3CCOCC3)O1	BroadT	BRD-K23154136	BRD-K23154136-001-01-8	Broad Institute of MIT and Harvard	BRD-K23154136			CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)C2CCOCC2)O1	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15-,16+,17-/m0/s1	MWTQFHHONBVRQP-NXOAAHMSSA-N	384.226036764							98452
BRD-K76358141	LSM-13098		54657798	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17-,18+,19-/m1/s1	SSPYWNJKRFMGCQ-OQIJWPOYSA-N	COc1cccc(NC(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)N(C)C)CC[C@H]23)c1	BroadT	BRD-K76358141	BRD-K76358141-001-01-4	Broad Institute of MIT and Harvard	BRD-K76358141			COc1cccc(NC(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)N(C)C)CC[C@H]23)c1	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17-,18+,19-/m1/s1	SSPYWNJKRFMGCQ-OQIJWPOYSA-N	421.221285742							101736
BRD-K15230829	LSM-9342		54657936	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17+,20-,21+/m0/s1	JLPSQBARJGYMKN-KJNZLNQQSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3C(=O)c4ccccc4F)O2	BroadT	BRD-K15230829	BRD-K15230829-001-01-8	Broad Institute of MIT and Harvard	BRD-K15230829			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c2ccccc2F)O1	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17+,20-,21+/m0/s1	JLPSQBARJGYMKN-KJNZLNQQSA-N	449.232599354							97963
BRD-K16034108	LSM-9392		54658105	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20-,21+,22-/m0/s1	VWRSVZSWDSMGOW-KJJMTIBFSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3cccc(F)c3)CC[C@H]2N(C1)C(=O)c4ccncc4	BroadT	BRD-K16034108	BRD-K16034108-001-01-5	Broad Institute of MIT and Harvard	BRD-K16034108			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3cccc(F)c3)CC[C@H]2N(C1)C(=O)c1ccncc1	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20-,21+,22-/m0/s1	VWRSVZSWDSMGOW-KJJMTIBFSA-N	457.201299226							98013
BRD-K26041656	LSM-10008		54657924	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16+,19+,20-/m0/s1	KPSAIAGNOOFEEI-FIYPYCPBSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@H]2N(C1)C(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K26041656	BRD-K26041656-001-01-4	Broad Institute of MIT and Harvard	BRD-K26041656			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@H]2N(C1)C(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16+,19+,20-/m0/s1	KPSAIAGNOOFEEI-FIYPYCPBSA-N	485.148426478							98629
BRD-K70003473	LSM-12702		54658020	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24-,26+,27-/m0/s1	JIBJCGLYXNSLDN-IGSOQLKZSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)N4CCN(CC4)c5ccccc5)CC[C@@H]23	BroadT	BRD-K70003473	BRD-K70003473-001-01-0	Broad Institute of MIT and Harvard	BRD-K70003473			COc1cccc(c1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@@H]12	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24-,26+,27-/m0/s1	JIBJCGLYXNSLDN-IGSOQLKZSA-N	559.235221244							101337
BRD-K45077070	LSM-11169		54657872	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18+,19-,20+/m0/s1	IDLNHXHJUITYBI-ZGXWSNOMSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@@H]2N(C1)C(=O)Nc4cc(Cl)cc(Cl)c4	BroadT	BRD-K45077070	BRD-K45077070-001-01-3	Broad Institute of MIT and Harvard	BRD-K45077070			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@@H]2N(C1)C(=O)Nc1cc(Cl)cc(Cl)c1	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18+,19-,20+/m0/s1	IDLNHXHJUITYBI-ZGXWSNOMSA-N	501.143341098							99790
BRD-K07625901	LSM-8888		54657803	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17-,18+,19-/m0/s1	SSPYWNJKRFMGCQ-KANFNMMFSA-N	COc1cccc(NC(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)N(C)C)CC[C@@H]23)c1	BroadT	BRD-K07625901	BRD-K07625901-001-01-0	Broad Institute of MIT and Harvard	BRD-K07625901			COc1cccc(NC(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)N(C)C)CC[C@@H]23)c1	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17-,18+,19-/m0/s1	SSPYWNJKRFMGCQ-KANFNMMFSA-N	421.221285742							97509
BRD-K95650611	LSM-14295		54657966	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16-,17+,18-/m0/s1	XOXZVIQHUYDNGA-FJIDUMEYSA-N	Cc1onc(C)c1NC(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)NCC4CC4)CC[C@@H]23	BroadT	BRD-K95650611	BRD-K95650611-001-01-2	Broad Institute of MIT and Harvard	BRD-K95650611			Cc1noc(C)c1NC(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)NCC3CC3)CC[C@@H]12	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16-,17+,18-/m0/s1	XOXZVIQHUYDNGA-FJIDUMEYSA-N	436.232184784							102949
BRD-K58439833	LSM-11953		54657824	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23-,24+,25-/m1/s1	XKLJDQDBSRSGED-ZKGSSEMHSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]2N(Cc5nccs5)C1	BroadT	BRD-K58439833	BRD-K58439833-001-01-7	Broad Institute of MIT and Harvard	BRD-K58439833			O[C@H]1COC[C@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]2N(Cc2nccs2)C1	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23-,24+,25-/m1/s1	XKLJDQDBSRSGED-ZKGSSEMHSA-N	499.250477384							100579
BRD-K27798440	LSM-10104		54657883	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21-,23+,24-/m1/s1	KOAYSPOFMXWQDS-HFGNEKBZSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)NCCCN4CCOCC4)CC[C@H]23	BroadT	BRD-K27798440	BRD-K27798440-001-01-9	Broad Institute of MIT and Harvard	BRD-K27798440			COc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)NCCCN3CCOCC3)CC[C@H]12	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21-,23+,24-/m1/s1	KOAYSPOFMXWQDS-HFGNEKBZSA-N	541.245785928							98725
BRD-K31369513	LSM-10326		54657901	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23+,24+,25-/m0/s1	HZAABOSBDYXUMN-KTJVCJKDSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K31369513	BRD-K31369513-001-01-5	Broad Institute of MIT and Harvard	BRD-K31369513			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@H]2N(CCC(F)(F)F)C1	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23+,24+,25-/m0/s1	HZAABOSBDYXUMN-KTJVCJKDSA-N	522.234156776							98947
BRD-K58514045	LSM-11960		54657846	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25-,27-,28+/m1/s1	IXXIZSABFJAVRH-JGCYXCAYSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@@H]23	BroadT	BRD-K58514045	BRD-K58514045-001-01-1	Broad Institute of MIT and Harvard	BRD-K58514045			COc1ccc(cc1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25-,27-,28+/m1/s1	IXXIZSABFJAVRH-JGCYXCAYSA-N	573.250871308							100586
BRD-K19995388	LSM-9643		54657947	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15-,16+,17-/m1/s1	JDHZCDHPHAWVKT-WCXIOVBPSA-N	CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c3ccncc3)O1	BroadT	BRD-K19995388	BRD-K19995388-001-01-5	Broad Institute of MIT and Harvard	BRD-K19995388			CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c2ccncc2)O1	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15-,16+,17-/m1/s1	JDHZCDHPHAWVKT-WCXIOVBPSA-N	377.195070994							98264
BRD-K90141430	LSM-13990		54658026	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20-,22+,23-/m0/s1	BTHNBOLPOQRYCE-RLBLXZPPSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCCN3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c4ccccc4	BroadT	BRD-K90141430	BRD-K90141430-001-01-6	Broad Institute of MIT and Harvard	BRD-K90141430			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCCN3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c1ccccc1	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20-,22+,23-/m0/s1	BTHNBOLPOQRYCE-RLBLXZPPSA-N	495.240306624							102643
BRD-K40219191	LSM-10882		54657957	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20+,22-,24+/m0/s1	YKBSBMDVZJDWJN-JXKFMYIUSA-N	COc1ccccc1NC(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)NCCc4ccncc4)CC[C@H]23	BroadT	BRD-K40219191	BRD-K40219191-001-01-0	Broad Institute of MIT and Harvard	BRD-K40219191			COc1ccccc1NC(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NCCc3ccncc3)CC[C@H]12	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20+,22-,24+/m0/s1	YKBSBMDVZJDWJN-JXKFMYIUSA-N	498.247834848							99503
BRD-K33778189	LSM-10477		54658074	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23+,24-,25+/m1/s1	CXJRMLHIKXWLHJ-RCTAOEEJSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCCc3ccccc3)CC[C@H]2N(Cc4ccc(Cl)cc4)C1	BroadT	BRD-K33778189	BRD-K33778189-001-01-8	Broad Institute of MIT and Harvard	BRD-K33778189			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCCc3ccccc3)CC[C@H]2N(Cc2ccc(Cl)cc2)C1	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23+,24-,25+/m1/s1	CXJRMLHIKXWLHJ-RCTAOEEJSA-N	472.212885266							99098
BRD-K00549983	LSM-8468		54657999	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19-,20+,21-/m1/s1	AEYAMMVRWLJFNH-MXEMCNAFSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3S(=O)(=O)c4ccccc4C)O2	BroadT	BRD-K00549983	BRD-K00549983-001-01-0	Broad Institute of MIT and Harvard	BRD-K00549983			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2S(=O)(=O)c2ccccc2C)O1	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19-,20+,21-/m1/s1	AEYAMMVRWLJFNH-MXEMCNAFSA-N	481.22465656							97089
BRD-K50887310	LSM-11534		54657935	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17+,20+,21-/m0/s1	JLPSQBARJGYMKN-NLEAXPPASA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3C(=O)c4ccccc4F)O2	BroadT	BRD-K50887310	BRD-K50887310-001-01-7	Broad Institute of MIT and Harvard	BRD-K50887310			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)c2ccccc2F)O1	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17+,20+,21-/m0/s1	JLPSQBARJGYMKN-NLEAXPPASA-N	449.232599354							100157
BRD-K57502578	LSM-11909		54657997	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19+,20-,21+/m1/s1	AEYAMMVRWLJFNH-MHTWAQMVSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3S(=O)(=O)c4ccccc4C)O2	BroadT	BRD-K57502578	BRD-K57502578-001-01-2	Broad Institute of MIT and Harvard	BRD-K57502578			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c2ccccc2C)O1	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19+,20-,21+/m1/s1	AEYAMMVRWLJFNH-MHTWAQMVSA-N	481.22465656							100535
BRD-K73166612	LSM-12910		54658030	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20-,22+,23-/m1/s1	BTHNBOLPOQRYCE-YXPKMTABSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCCN3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c4ccccc4	BroadT	BRD-K73166612	BRD-K73166612-001-01-4	Broad Institute of MIT and Harvard	BRD-K73166612			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCCN3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c1ccccc1	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20-,22+,23-/m1/s1	BTHNBOLPOQRYCE-YXPKMTABSA-N	495.240306624							101547
BRD-K50131741	LSM-11477		54658044	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20-,22-,23+/m1/s1	JLFHHDVKVXKGLO-PRTQVNTJSA-N	Cc1ccccc1S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)NCc4ccccc4Cl)CC[C@@H]23	BroadT	BRD-K50131741	BRD-K50131741-001-01-9	Broad Institute of MIT and Harvard	BRD-K50131741			Cc1ccccc1S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@@H]12	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20-,22-,23+/m1/s1	JLFHHDVKVXKGLO-PRTQVNTJSA-N	522.159135132							100098
BRD-K56130969	LSM-11821		54658087	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22-,23-,24+/m1/s1	WWAGOAOIMIOBRQ-RMRNXIRCSA-N	CCCNC(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	BroadT	BRD-K56130969	BRD-K56130969-001-01-0	Broad Institute of MIT and Harvard	BRD-K56130969			CCCNC(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22-,23-,24+/m1/s1	WWAGOAOIMIOBRQ-RMRNXIRCSA-N	488.29987042							100446
BRD-K80852934	LSM-13376		54657951	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15+,16+,17-/m0/s1	JDHZCDHPHAWVKT-HZMVEIRTSA-N	CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)c3ccncc3)O1	BroadT	BRD-K80852934	BRD-K80852934-001-01-1	Broad Institute of MIT and Harvard	BRD-K80852934			CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)c2ccncc2)O1	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15+,16+,17-/m0/s1	JDHZCDHPHAWVKT-HZMVEIRTSA-N	377.195070994							102015
BRD-K96044609	LSM-14321		54657831	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18-,20-,21+/m0/s1	LTCDBOWOUBSGLM-JYAXBFRTSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NC3CCC3)CC[C@@H]2N(Cc4ccccc4F)C1	BroadT	BRD-K96044609	BRD-K96044609-001-01-1	Broad Institute of MIT and Harvard	BRD-K96044609			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NC3CCC3)CC[C@@H]2N(Cc2ccccc2F)C1	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18-,20-,21+/m0/s1	LTCDBOWOUBSGLM-JYAXBFRTSA-N	406.226785692							102975
BRD-K01383339	LSM-8522		54658051	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11-,12+,13-/m1/s1	NGKDTDLAKVOKMV-FVCCEPFGSA-N	COC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2CCC(F)(F)F)O1	BroadT	BRD-K01383339	BRD-K01383339-001-01-4	Broad Institute of MIT and Harvard	BRD-K01383339			COC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2CCC(F)(F)F)O1	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11-,12+,13-/m1/s1	NGKDTDLAKVOKMV-FVCCEPFGSA-N	355.160657478							97143
BRD-K24058148	LSM-9881		54657931	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17-,20+,21-/m0/s1	JLPSQBARJGYMKN-PZBISTMVSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3C(=O)c4ccccc4F)O2	BroadT	BRD-K24058148	BRD-K24058148-001-01-6	Broad Institute of MIT and Harvard	BRD-K24058148			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)c2ccccc2F)O1	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17-,20+,21-/m0/s1	JLPSQBARJGYMKN-PZBISTMVSA-N	449.232599354							98502
BRD-K15966733	LSM-9384		54657918	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15-,16+,17-/m1/s1	MWTQFHHONBVRQP-WCXIOVBPSA-N	CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)C3CCOCC3)O1	BroadT	BRD-K15966733	BRD-K15966733-001-01-2	Broad Institute of MIT and Harvard	BRD-K15966733			CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)C2CCOCC2)O1	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15-,16+,17-/m1/s1	MWTQFHHONBVRQP-WCXIOVBPSA-N	384.226036764							98005
BRD-K89644093	LSM-13959		54658095	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19+,20+,23-/m1/s1	TYHBJRPCTKOJBR-QTDGGUCWSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@@H]2N(Cc4ccc5OCOc5c4)C1	BroadT	BRD-K89644093	BRD-K89644093-001-01-0	Broad Institute of MIT and Harvard	BRD-K89644093			O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19+,20+,23-/m1/s1	TYHBJRPCTKOJBR-QTDGGUCWSA-N	446.241686828							102612
BRD-K79437423	LSM-13282		54657983	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27-,28+,30-/m1/s1	IQZRHVPMCXNVFS-PJCXANEISA-N	COc1ccccc1CNC(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3Cc4cccc(c4)c5ccncc5)O2	BroadT	BRD-K79437423	BRD-K79437423-001-01-2	Broad Institute of MIT and Harvard	BRD-K79437423			COc1ccccc1CNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc2cccc(c2)-c2ccncc2)O1	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27-,28+,30-/m1/s1	IQZRHVPMCXNVFS-PJCXANEISA-N	531.273321314							101921
MLS003650129	LSM-13613	BRD-K84853311	53382778	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20+,21-,22+/m0/s1	UZQWVSGPDQQYNK-LNRXMEIDSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3Cc4cccc(F)c4)O2	BroadT	BRD-K84853311	BRD-K84853311-001-01-8	Broad Institute of MIT and Harvard	BRD-K84853311			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc2cccc(F)c2)O1	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20+,21-,22+/m0/s1	UZQWVSGPDQQYNK-LNRXMEIDSA-N	435.253334798							102259
BRD-K08078340	LSM-8915		54657800	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17-,18-,19+/m1/s1	SSPYWNJKRFMGCQ-OWYHZJEWSA-N	COc1cccc(NC(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)N(C)C)CC[C@@H]23)c1	BroadT	BRD-K08078340	BRD-K08078340-001-01-0	Broad Institute of MIT and Harvard	BRD-K08078340			COc1cccc(NC(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)N(C)C)CC[C@@H]23)c1	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17-,18-,19+/m1/s1	SSPYWNJKRFMGCQ-OWYHZJEWSA-N	421.221285742							97536
BRD-K56865671	LSM-11865		54658022	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24-,26-,27+/m1/s1	JIBJCGLYXNSLDN-KQPVPGJTSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)N4CCN(CC4)c5ccccc5)CC[C@@H]23	BroadT	BRD-K56865671	BRD-K56865671-001-01-0	Broad Institute of MIT and Harvard	BRD-K56865671			COc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@@H]12	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24-,26-,27+/m1/s1	JIBJCGLYXNSLDN-KQPVPGJTSA-N	559.235221244							100491
BRD-K85932041	LSM-13694		54657963	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16+,17-,18+/m1/s1	XOXZVIQHUYDNGA-XDNAFOTISA-N	Cc1onc(C)c1NC(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)NCC4CC4)CC[C@@H]23	BroadT	BRD-K85932041	BRD-K85932041-001-01-6	Broad Institute of MIT and Harvard	BRD-K85932041			Cc1noc(C)c1NC(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)NCC3CC3)CC[C@@H]12	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16+,17-,18+/m1/s1	XOXZVIQHUYDNGA-XDNAFOTISA-N	436.232184784							102342
BRD-K95021846	LSM-14252		54657990	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20+,21-,22+/m1/s1	UZQWVSGPDQQYNK-MBDNFAEBSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3Cc4cccc(F)c4)O2	BroadT	BRD-K95021846	BRD-K95021846-001-01-3	Broad Institute of MIT and Harvard	BRD-K95021846			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc2cccc(F)c2)O1	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20+,21-,22+/m1/s1	UZQWVSGPDQQYNK-MBDNFAEBSA-N	435.253334798							102906
BRD-K43851624	LSM-11105		54658057	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16+,17-,18+/m0/s1	MKIQWJGRPCGZSV-XWTMOSNGSA-N	CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc3ccncc3)O1	BroadT	BRD-K43851624	BRD-K43851624-001-01-4	Broad Institute of MIT and Harvard	BRD-K43851624			CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc2ccncc2)O1	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16+,17-,18+/m0/s1	MKIQWJGRPCGZSV-XWTMOSNGSA-N	363.215806438							99726
BRD-K93301765	LSM-14150		54658068	InChI=1S/C25H37FN2O4/c26-20-8-6-18(7-9-20)13-27-25(30)12-22-10-11-23-24(32-22)17-31-16-21(29)15-28(23)14-19-4-2-1-3-5-19/h6-9,19,21-24,29H,1-5,10-17H2,(H,27,30)/t21-,22-,23+,24-/m1/s1	CEWCLCSAKAWIOS-JLLPCOHGSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(CC4CCCCC4)C1	BroadT	BRD-K93301765	BRD-K93301765-001-01-8	Broad Institute of MIT and Harvard	BRD-K93301765			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(CC2CCCCC2)C1	InChI=1S/C25H37FN2O4/c26-20-8-6-18(7-9-20)13-27-25(30)12-22-10-11-23-24(32-22)17-31-16-21(29)15-28(23)14-19-4-2-1-3-5-19/h6-9,19,21-24,29H,1-5,10-17H2,(H,27,30)/t21-,22-,23+,24-/m1/s1	CEWCLCSAKAWIOS-JLLPCOHGSA-N	448.273735884							102804
BRD-K54652275	LSM-11748		54658054	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11-,12-,13+/m0/s1	NGKDTDLAKVOKMV-ZDEQEGDKSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2CCC(F)(F)F)O1	BroadT	BRD-K54652275	BRD-K54652275-001-01-4	Broad Institute of MIT and Harvard	BRD-K54652275			COC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2CCC(F)(F)F)O1	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11-,12-,13+/m0/s1	NGKDTDLAKVOKMV-ZDEQEGDKSA-N	355.160657478							100373
BRD-K03445781	LSM-8648		54658078	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22+,23+,24-/m1/s1	WWAGOAOIMIOBRQ-LYCSZFELSA-N	CCCNC(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	BroadT	BRD-K03445781	BRD-K03445781-001-01-2	Broad Institute of MIT and Harvard	BRD-K03445781			CCCNC(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22+,23+,24-/m1/s1	WWAGOAOIMIOBRQ-LYCSZFELSA-N	488.29987042							97269
BRD-K74428993	LSM-12985		54657833	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18-,20+,21-/m1/s1	LTCDBOWOUBSGLM-RMVXJAJNSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@@H]2N(Cc4ccccc4F)C1	BroadT	BRD-K74428993	BRD-K74428993-001-01-6	Broad Institute of MIT and Harvard	BRD-K74428993			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@@H]2N(Cc2ccccc2F)C1	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18-,20+,21-/m1/s1	LTCDBOWOUBSGLM-RMVXJAJNSA-N	406.226785692							101622
BRD-K87838487	LSM-13814		54657916	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15-,16-,17+/m1/s1	MWTQFHHONBVRQP-VQHPVUNQSA-N	CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)C3CCOCC3)O1	BroadT	BRD-K87838487	BRD-K87838487-001-01-4	Broad Institute of MIT and Harvard	BRD-K87838487			CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)C2CCOCC2)O1	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15-,16-,17+/m1/s1	MWTQFHHONBVRQP-VQHPVUNQSA-N	384.226036764							102463
BRD-K16422757	LSM-9421		54658075	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23+,24-,25+/m0/s1	CXJRMLHIKXWLHJ-FQUZAXHOSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCCc3ccccc3)CC[C@@H]2N(Cc4ccc(Cl)cc4)C1	BroadT	BRD-K16422757	BRD-K16422757-001-01-6	Broad Institute of MIT and Harvard	BRD-K16422757			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCCc3ccccc3)CC[C@@H]2N(Cc2ccc(Cl)cc2)C1	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23+,24-,25+/m0/s1	CXJRMLHIKXWLHJ-FQUZAXHOSA-N	472.212885266							98042
BRD-K88967430	LSM-13899		54657825	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23-,24-,25+/m0/s1	XKLJDQDBSRSGED-OJJQZRKESA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]2N(Cc5nccs5)C1	BroadT	BRD-K88967430	BRD-K88967430-001-01-8	Broad Institute of MIT and Harvard	BRD-K88967430			O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]2N(Cc2nccs2)C1	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23-,24-,25+/m0/s1	XKLJDQDBSRSGED-OJJQZRKESA-N	499.250477384							102552
BRD-K07157902	LSM-8849		54657976	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14-,15+,17-/m1/s1	WAKYUTRBASZCGN-PNBKFKSVSA-N	COC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2S(=O)(=O)c3ccccc3OC)O1	BroadT	BRD-K07157902	BRD-K07157902-001-01-3	Broad Institute of MIT and Harvard	BRD-K07157902			COC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2S(=O)(=O)c2ccccc2OC)O1	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14-,15+,17-/m1/s1	WAKYUTRBASZCGN-PNBKFKSVSA-N	429.145737524							97470
BRD-K41723088	LSM-10965		54658098	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19+,20+,23-/m0/s1	TYHBJRPCTKOJBR-VAWZGJIGSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@H]2N(Cc4ccc5OCOc5c4)C1	BroadT	BRD-K41723088	BRD-K41723088-001-01-6	Broad Institute of MIT and Harvard	BRD-K41723088			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19+,20+,23-/m0/s1	TYHBJRPCTKOJBR-VAWZGJIGSA-N	446.241686828							99586
BRD-K13782405	LSM-9263		54658000	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19-,20+,21-/m0/s1	AEYAMMVRWLJFNH-BURNTYAHSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3S(=O)(=O)c4ccccc4C)O2	BroadT	BRD-K13782405	BRD-K13782405-001-01-2	Broad Institute of MIT and Harvard	BRD-K13782405			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2S(=O)(=O)c2ccccc2C)O1	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19-,20+,21-/m0/s1	AEYAMMVRWLJFNH-BURNTYAHSA-N	481.22465656							97884
BRD-K07323881-001-01-6	LSM-8858	BRD-K07323881	54657841	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20+,22+,23-/m0/s1	CDWYTZLAFHIRLQ-JVSAHFFESA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K07323881	BRD-K07323881-001-01-6	Broad Institute of MIT and Harvard	BRD-K07323881			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20+,22+,23-/m0/s1	CDWYTZLAFHIRLQ-JVSAHFFESA-N	498.21998575							97479
BRD-K62734359	LSM-12238		54657979	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27-,28+,30-/m0/s1	IQZRHVPMCXNVFS-XPMOVWHWSA-N	COc1ccccc1CNC(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3Cc4cccc(c4)c5ccncc5)O2	BroadT	BRD-K62734359	BRD-K62734359-001-01-9	Broad Institute of MIT and Harvard	BRD-K62734359			COc1ccccc1CNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc2cccc(c2)-c2ccncc2)O1	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27-,28+,30-/m0/s1	IQZRHVPMCXNVFS-XPMOVWHWSA-N	531.273321314							100864
BRD-K33490627	LSM-10458		54657952	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15+,16+,17-/m1/s1	JDHZCDHPHAWVKT-LTIDMASMSA-N	CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c3ccncc3)O1	BroadT	BRD-K33490627	BRD-K33490627-001-01-0	Broad Institute of MIT and Harvard	BRD-K33490627			CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c2ccncc2)O1	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15+,16+,17-/m1/s1	JDHZCDHPHAWVKT-LTIDMASMSA-N	377.195070994							99079
BRD-K33909884	LSM-10482		54657912	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10-,11-,12+/m0/s1	LPUMVFGYOYFXDR-FIQHERPVSA-N	O[C@H]1CN[C@H]2CC[C@@H](CC(=O)Nc3nccs3)O[C@@H]2COC1	BroadT	BRD-K33909884	BRD-K33909884-001-01-7	Broad Institute of MIT and Harvard	BRD-K33909884			O[C@H]1CN[C@H]2CC[C@@H](CC(=O)Nc3nccs3)O[C@@H]2COC1	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10-,11-,12+/m0/s1	LPUMVFGYOYFXDR-FIQHERPVSA-N	327.125276872							99103
BRD-K65909937	LSM-12447		54658006	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18-,19-,20+/m1/s1	NCINSYYDRJCYKJ-WTGUMLROSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CC3)CC[C@H]2N(CC4CCOCC4)C1	BroadT	BRD-K65909937	BRD-K65909937-001-01-5	Broad Institute of MIT and Harvard	BRD-K65909937			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CC3)CC[C@H]2N(CC2CCOCC2)C1	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18-,19-,20+/m1/s1	NCINSYYDRJCYKJ-WTGUMLROSA-N	396.262422272							101075
BRD-K63532493	LSM-12299		54657944	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22+,23+,24-/m0/s1	UWGYAIIPASVTSB-KEZOAJOQSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(Cc4cccc(Cl)c4)C1	BroadT	BRD-K63532493	BRD-K63532493-001-01-3	Broad Institute of MIT and Harvard	BRD-K63532493			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(Cc2cccc(Cl)c2)C1	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22+,23+,24-/m0/s1	UWGYAIIPASVTSB-KEZOAJOQSA-N	464.244185394							100926
BRD-K84391460	LSM-13588		54657836	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18-,20+,21-/m0/s1	LTCDBOWOUBSGLM-MMKMLUHNSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NC3CCC3)CC[C@H]2N(Cc4ccccc4F)C1	BroadT	BRD-K84391460	BRD-K84391460-001-01-8	Broad Institute of MIT and Harvard	BRD-K84391460			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NC3CCC3)CC[C@H]2N(Cc2ccccc2F)C1	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18-,20+,21-/m0/s1	LTCDBOWOUBSGLM-MMKMLUHNSA-N	406.226785692							102232
BRD-K72217541	LSM-12853		54657897	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23+,24+,25-/m1/s1	HZAABOSBDYXUMN-AKAGGGOCSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K72217541	BRD-K72217541-001-01-2	Broad Institute of MIT and Harvard	BRD-K72217541			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@@H]2N(CCC(F)(F)F)C1	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23+,24+,25-/m1/s1	HZAABOSBDYXUMN-AKAGGGOCSA-N	522.234156776							101490
BRD-K46965430	LSM-11291		54658059	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16-,17-,18+/m1/s1	MKIQWJGRPCGZSV-TVFCKZIOSA-N	CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc3ccncc3)O1	BroadT	BRD-K46965430	BRD-K46965430-001-01-3	Broad Institute of MIT and Harvard	BRD-K46965430			CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc2ccncc2)O1	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16-,17-,18+/m1/s1	MKIQWJGRPCGZSV-TVFCKZIOSA-N	363.215806438							99912
BRD-K55313038	LSM-11781		54657927	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16-,19-,20+/m0/s1	KPSAIAGNOOFEEI-CPLUKWAASA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NC3CCC3)CC[C@@H]2N(C1)C(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K55313038	BRD-K55313038-001-01-0	Broad Institute of MIT and Harvard	BRD-K55313038			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NC3CCC3)CC[C@@H]2N(C1)C(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16-,19-,20+/m0/s1	KPSAIAGNOOFEEI-CPLUKWAASA-N	485.148426478							100406
BRD-K08936794	LSM-8966		54657860	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25-,27-,28+/m0/s1	IXXIZSABFJAVRH-XSKYRTITSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@H]23	BroadT	BRD-K08936794	BRD-K08936794-001-01-0	Broad Institute of MIT and Harvard	BRD-K08936794			COc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25-,27-,28+/m0/s1	IXXIZSABFJAVRH-XSKYRTITSA-N	573.250871308							97587
BRD-K44029733	LSM-11118		54657806	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20-,22+,25-/m1/s1	HNAQDDNENYJUKU-ICQAOKEUSA-N	Cc1ccc(cc1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)NCc4ccc5OCOc5c4)CC[C@H]23	BroadT	BRD-K44029733	BRD-K44029733-001-01-4	Broad Institute of MIT and Harvard	BRD-K44029733			Cc1ccc(cc1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3ccc4OCOc4c3)CC[C@H]12	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20-,22+,25-/m1/s1	HNAQDDNENYJUKU-ICQAOKEUSA-N	532.187936694							99739
BRD-K05050883	LSM-8734		54657794	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19-,20-,21+/m0/s1	QGGFARYSPQJNIH-XSDIEEQYSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2CC3CCCC3)O1	BroadT	BRD-K05050883	BRD-K05050883-001-01-5	Broad Institute of MIT and Harvard	BRD-K05050883			CN(C)CCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2CC2CCCC2)O1	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19-,20-,21+/m0/s1	QGGFARYSPQJNIH-XSDIEEQYSA-N	411.309706822							97355
BRD-K94509791	LSM-14220		54657940	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22+,23+,24-/m1/s1	UWGYAIIPASVTSB-NAVOZUGXSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(Cc4cccc(Cl)c4)C1	BroadT	BRD-K94509791	BRD-K94509791-001-01-3	Broad Institute of MIT and Harvard	BRD-K94509791			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(Cc2cccc(Cl)c2)C1	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22+,23+,24-/m1/s1	UWGYAIIPASVTSB-NAVOZUGXSA-N	464.244185394							102874
BRD-K92754298	LSM-14112		54657903	InChI=1S/C27H30Cl2N2O5/c28-20-9-19(10-21(29)11-20)27(34)31-14-22(32)15-35-16-25-24(31)6-5-23(36-25)12-26(33)30-8-7-17-3-1-2-4-18(17)13-30/h1-4,9-11,22-25,32H,5-8,12-16H2/t22-,23-,24-,25+/m0/s1	RFSVTUPSJXWLCE-OJJQZRKESA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]2N(C1)C(=O)c5cc(Cl)cc(Cl)c5	BroadT	BRD-K92754298	BRD-K92754298-001-01-5	Broad Institute of MIT and Harvard	BRD-K92754298			O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]2N(C1)C(=O)c1cc(Cl)cc(Cl)c1	InChI=1S/C27H30Cl2N2O5/c28-20-9-19(10-21(29)11-20)27(34)31-14-22(32)15-35-16-25-24(31)6-5-23(36-25)12-26(33)30-8-7-17-3-1-2-4-18(17)13-30/h1-4,9-11,22-25,32H,5-8,12-16H2/t22-,23-,24-,25+/m0/s1	RFSVTUPSJXWLCE-OJJQZRKESA-N	532.1531775							102766
BRD-K72980353	LSM-12896		54658031	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17+,18+,19-/m0/s1	VINMFOKKSKWMTO-MANSERQUSA-N	O[C@H]1CN[C@@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COC1	BroadT	BRD-K72980353	BRD-K72980353-001-01-2	Broad Institute of MIT and Harvard	BRD-K72980353			O[C@H]1CN[C@@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17+,18+,19-/m0/s1	VINMFOKKSKWMTO-MANSERQUSA-N	360.204907396							101533
BRD-K70797508	LSM-12747		54658097	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19-,20-,23+/m0/s1	TYHBJRPCTKOJBR-IHFIDZABSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@@H]2N(Cc4ccc5OCOc5c4)C1	BroadT	BRD-K70797508	BRD-K70797508-001-01-6	Broad Institute of MIT and Harvard	BRD-K70797508			O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19-,20-,23+/m0/s1	TYHBJRPCTKOJBR-IHFIDZABSA-N	446.241686828							101384
BRD-K42709418	LSM-11023		54658015	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18-,19+,20-/m1/s1	PSOMVEOYXZFBLO-YSTOQKLRSA-N	Cn1cnc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)NCc4cccc(F)c4)CC[C@H]23	BroadT	BRD-K42709418	BRD-K42709418-001-01-5	Broad Institute of MIT and Harvard	BRD-K42709418			Cn1cnc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@H]12	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18-,19+,20-/m1/s1	PSOMVEOYXZFBLO-YSTOQKLRSA-N	496.179183578							99644
BRD-K99615821	LSM-14546		54657853	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25-,27+,28-/m1/s1	IXXIZSABFJAVRH-GLXJXMGJSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@H]23	BroadT	BRD-K99615821	BRD-K99615821-001-01-7	Broad Institute of MIT and Harvard	BRD-K99615821			COc1ccc(cc1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25-,27+,28-/m1/s1	IXXIZSABFJAVRH-GLXJXMGJSA-N	573.250871308							103201
BRD-K86619642	LSM-13733		54657911	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10-,11+,12-/m1/s1	LPUMVFGYOYFXDR-WISYIIOYSA-N	O[C@@H]1CN[C@H]2CC[C@H](CC(=O)Nc3nccs3)O[C@@H]2COC1	BroadT	BRD-K86619642	BRD-K86619642-001-01-1	Broad Institute of MIT and Harvard	BRD-K86619642			O[C@@H]1CN[C@H]2CC[C@H](CC(=O)Nc3nccs3)O[C@@H]2COC1	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10-,11+,12-/m1/s1	LPUMVFGYOYFXDR-WISYIIOYSA-N	327.125276872							102382
CHEMBL2140305	LSM-14121	BRD-K92860459, SID131454248	54657802	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17+,18+,19-/m0/s1	SSPYWNJKRFMGCQ-AITUJVMLSA-N	COc1cccc(NC(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)N(C)C)CC[C@@H]23)c1	BroadT	BRD-K92860459	BRD-K92860459-001-01-5	Broad Institute of MIT and Harvard	BRD-K92860459			COc1cccc(NC(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)N(C)C)CC[C@@H]23)c1	InChI=1S/C21H31N3O6/c1-23(2)20(26)10-17-7-8-18-19(30-17)13-29-12-15(25)11-24(18)21(27)22-14-5-4-6-16(9-14)28-3/h4-6,9,15,17-19,25H,7-8,10-13H2,1-3H3,(H,22,27)/t15-,17+,18+,19-/m0/s1	SSPYWNJKRFMGCQ-AITUJVMLSA-N	421.221285742							102775
BRD-K02522894	LSM-8592		54657941	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22-,23-,24+/m0/s1	UWGYAIIPASVTSB-NEWJYFPISA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(Cc4cccc(Cl)c4)C1	BroadT	BRD-K02522894	BRD-K02522894-001-01-3	Broad Institute of MIT and Harvard	BRD-K02522894			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(Cc2cccc(Cl)c2)C1	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22-,23-,24+/m0/s1	UWGYAIIPASVTSB-NEWJYFPISA-N	464.244185394							97213
BRD-K86671899	LSM-13737		54657923	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16-,19+,20-/m1/s1	KPSAIAGNOOFEEI-YAJHFMINSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@@H]2N(C1)C(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K86671899	BRD-K86671899-001-01-2	Broad Institute of MIT and Harvard	BRD-K86671899			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@@H]2N(C1)C(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16-,19+,20-/m1/s1	KPSAIAGNOOFEEI-YAJHFMINSA-N	485.148426478							102386
BRD-K81666293	LSM-13415		54657874	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18+,20-,21+/m1/s1	AVCDQRNGDYLZTC-JYRKZWEQSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@H]2N(C1)C(=O)c4cnccn4	BroadT	BRD-K81666293	BRD-K81666293-001-01-9	Broad Institute of MIT and Harvard	BRD-K81666293			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18+,20-,21+/m1/s1	AVCDQRNGDYLZTC-JYRKZWEQSA-N	458.196548204							102055
BRD-K26125024-001-01-0	LSM-23241	BRD-K26125024	54657814	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15-,16+,17-/m1/s1	RNNHPDFMCSWFHC-WCXIOVBPSA-N	O[C@@H]1CN[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COC1	BroadT	BRD-K26125024	BRD-K26125024-001-01-0	Broad Institute of MIT and Harvard	BRD-K26125024			O[C@@H]1CN[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COC1	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15-,16+,17-/m1/s1	RNNHPDFMCSWFHC-WCXIOVBPSA-N	349.200156374							111828
BRD-K47284302	LSM-11317		54658046	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20-,22+,23-/m0/s1	JLFHHDVKVXKGLO-RLBLXZPPSA-N	Cc1ccccc1S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)NCc4ccccc4Cl)CC[C@@H]23	BroadT	BRD-K47284302	BRD-K47284302-001-01-3	Broad Institute of MIT and Harvard	BRD-K47284302			Cc1ccccc1S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)NCc3ccccc3Cl)CC[C@@H]12	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20-,22+,23-/m0/s1	JLFHHDVKVXKGLO-RLBLXZPPSA-N	522.159135132							99938
BRD-K72620090	LSM-12879		54657988	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20-,21+,22-/m0/s1	UZQWVSGPDQQYNK-KJJMTIBFSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3Cc4cccc(F)c4)O2	BroadT	BRD-K72620090	BRD-K72620090-001-01-2	Broad Institute of MIT and Harvard	BRD-K72620090			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc2cccc(F)c2)O1	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20-,21+,22-/m0/s1	UZQWVSGPDQQYNK-KJJMTIBFSA-N	435.253334798							101516
BRD-K54327934	LSM-11729		54657921	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15+,16+,17-/m0/s1	MWTQFHHONBVRQP-HZMVEIRTSA-N	CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)C3CCOCC3)O1	BroadT	BRD-K54327934	BRD-K54327934-001-01-6	Broad Institute of MIT and Harvard	BRD-K54327934			CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)C2CCOCC2)O1	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15+,16+,17-/m0/s1	MWTQFHHONBVRQP-HZMVEIRTSA-N	384.226036764							100354
BRD-K58958454	LSM-11989		54658069	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23-,24-,25+/m1/s1	CXJRMLHIKXWLHJ-VPBXCIAMSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCCc3ccccc3)CC[C@H]2N(Cc4ccc(Cl)cc4)C1	BroadT	BRD-K58958454	BRD-K58958454-001-01-4	Broad Institute of MIT and Harvard	BRD-K58958454			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCCc3ccccc3)CC[C@H]2N(Cc2ccc(Cl)cc2)C1	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23-,24-,25+/m1/s1	CXJRMLHIKXWLHJ-VPBXCIAMSA-N	472.212885266							100615
BRD-K10844902	LSM-9091		54657867	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18+,19+,20-/m1/s1	IDLNHXHJUITYBI-FUMNGEBKSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@@H]2N(C1)C(=O)Nc4cc(Cl)cc(Cl)c4	BroadT	BRD-K10844902	BRD-K10844902-001-01-1	Broad Institute of MIT and Harvard	BRD-K10844902			O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@@H]2N(C1)C(=O)Nc1cc(Cl)cc(Cl)c1	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18+,19+,20-/m1/s1	IDLNHXHJUITYBI-FUMNGEBKSA-N	501.143341098							97712
BRD-K38232832	LSM-10744		54658016	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24-,26+,27-/m1/s1	JIBJCGLYXNSLDN-STAKNXPZSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)N4CCN(CC4)c5ccccc5)CC[C@H]23	BroadT	BRD-K38232832	BRD-K38232832-001-01-2	Broad Institute of MIT and Harvard	BRD-K38232832			COc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@H]12	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24-,26+,27-/m1/s1	JIBJCGLYXNSLDN-STAKNXPZSA-N	559.235221244							99365
BRD-K99647384	LSM-14552		54658072	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23-,24-,25+/m0/s1	CXJRMLHIKXWLHJ-OJJQZRKESA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCCc3ccccc3)CC[C@@H]2N(Cc4ccc(Cl)cc4)C1	BroadT	BRD-K99647384	BRD-K99647384-001-01-9	Broad Institute of MIT and Harvard	BRD-K99647384			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCCc3ccccc3)CC[C@@H]2N(Cc2ccc(Cl)cc2)C1	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23-,24-,25+/m0/s1	CXJRMLHIKXWLHJ-OJJQZRKESA-N	472.212885266							103207
BRD-K76665741	LSM-13121		54657811	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20-,22-,25+/m0/s1	HNAQDDNENYJUKU-VCWGXOKSSA-N	Cc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)NCc4ccc5OCOc5c4)CC[C@H]23	BroadT	BRD-K76665741	BRD-K76665741-001-01-6	Broad Institute of MIT and Harvard	BRD-K76665741			Cc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)NCc3ccc4OCOc4c3)CC[C@H]12	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20-,22-,25+/m0/s1	HNAQDDNENYJUKU-VCWGXOKSSA-N	532.187936694							101759
BRD-K65927786	LSM-12450		54658104	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20-,21-,22+/m0/s1	VWRSVZSWDSMGOW-MYGLTJDJSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]2N(C1)C(=O)c4ccncc4	BroadT	BRD-K65927786	BRD-K65927786-001-01-9	Broad Institute of MIT and Harvard	BRD-K65927786			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]2N(C1)C(=O)c1ccncc1	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20-,21-,22+/m0/s1	VWRSVZSWDSMGOW-MYGLTJDJSA-N	457.201299226							101078
BRD-K67983441	LSM-12571		54657886	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21-,23+,24-/m0/s1	KOAYSPOFMXWQDS-SJROBZAFSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)NCCCN4CCOCC4)CC[C@@H]23	BroadT	BRD-K67983441	BRD-K67983441-001-01-7	Broad Institute of MIT and Harvard	BRD-K67983441			COc1cccc(c1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)NCCCN3CCOCC3)CC[C@@H]12	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21-,23+,24-/m0/s1	KOAYSPOFMXWQDS-SJROBZAFSA-N	541.245785928							101202
BRD-K15793745	LSM-9375		54658021	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24+,26+,27-/m0/s1	JIBJCGLYXNSLDN-BJDRNOHOSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)N4CCN(CC4)c5ccccc5)CC[C@@H]23	BroadT	BRD-K15793745	BRD-K15793745-001-01-6	Broad Institute of MIT and Harvard	BRD-K15793745			COc1cccc(c1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@@H]12	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24+,26+,27-/m0/s1	JIBJCGLYXNSLDN-BJDRNOHOSA-N	559.235221244							97996
BRD-K27744061	LSM-10100		54657917	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15+,16-,17+/m1/s1	MWTQFHHONBVRQP-TWMKSMIVSA-N	CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)C3CCOCC3)O1	BroadT	BRD-K27744061	BRD-K27744061-001-01-1	Broad Institute of MIT and Harvard	BRD-K27744061			CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)C2CCOCC2)O1	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15+,16-,17+/m1/s1	MWTQFHHONBVRQP-TWMKSMIVSA-N	384.226036764							98721
BRD-K73627655	LSM-12939		54658047	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11+,12+,13-/m0/s1	NGKDTDLAKVOKMV-LOWDOPEQSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2CCC(F)(F)F)O1	BroadT	BRD-K73627655	BRD-K73627655-001-01-3	Broad Institute of MIT and Harvard	BRD-K73627655			COC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2CCC(F)(F)F)O1	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11+,12+,13-/m0/s1	NGKDTDLAKVOKMV-LOWDOPEQSA-N	355.160657478							101576
BRD-K69178842	LSM-12647		54657871	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18-,19-,20+/m0/s1	IDLNHXHJUITYBI-LWYYNNOASA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@@H]2N(C1)C(=O)Nc4cc(Cl)cc(Cl)c4	BroadT	BRD-K69178842	BRD-K69178842-001-01-7	Broad Institute of MIT and Harvard	BRD-K69178842			O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@@H]2N(C1)C(=O)Nc1cc(Cl)cc(Cl)c1	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18-,19-,20+/m0/s1	IDLNHXHJUITYBI-LWYYNNOASA-N	501.143341098							101281
BRD-K88797027	LSM-13885		54657977	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14-,15-,17+/m0/s1	WAKYUTRBASZCGN-QBYUYEEZSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c3ccccc3OC)O1	BroadT	BRD-K88797027	BRD-K88797027-001-01-8	Broad Institute of MIT and Harvard	BRD-K88797027			COC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c2ccccc2OC)O1	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14-,15-,17+/m0/s1	WAKYUTRBASZCGN-QBYUYEEZSA-N	429.145737524							102538
BRD-K07634536	LSM-8889		54657863	InChI=1S/C20H29FN2O7S/c1-28-9-8-22-20(25)10-15-6-7-17-18(30-15)13-29-12-14(24)11-23(17)31(26,27)19-5-3-2-4-16(19)21/h2-5,14-15,17-18,24H,6-13H2,1H3,(H,22,25)/t14-,15+,17-,18+/m1/s1	ZIIKQONHXRNGRF-ATLSCFEFSA-N	COCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c3ccccc3F)O1	BroadT	BRD-K07634536	BRD-K07634536-001-01-5	Broad Institute of MIT and Harvard	BRD-K07634536			COCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c2ccccc2F)O1	InChI=1S/C20H29FN2O7S/c1-28-9-8-22-20(25)10-15-6-7-17-18(30-15)13-29-12-14(24)11-23(17)31(26,27)19-5-3-2-4-16(19)21/h2-5,14-15,17-18,24H,6-13H2,1H3,(H,22,25)/t14-,15+,17-,18+/m1/s1	ZIIKQONHXRNGRF-ATLSCFEFSA-N	460.167950178							97510
BRD-K00113100	LSM-8430		54657981	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27+,28+,30-/m1/s1	IQZRHVPMCXNVFS-GPRIDDLASA-N	COc1ccccc1CNC(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3Cc4cccc(c4)c5ccncc5)O2	BroadT	BRD-K00113100	BRD-K00113100-001-01-3	Broad Institute of MIT and Harvard	BRD-K00113100			COc1ccccc1CNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc2cccc(c2)-c2ccncc2)O1	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27+,28+,30-/m1/s1	IQZRHVPMCXNVFS-GPRIDDLASA-N	531.273321314							97051
BRD-K63164430	LSM-12270		54658063	InChI=1S/C25H37FN2O4/c26-20-8-6-18(7-9-20)13-27-25(30)12-22-10-11-23-24(32-22)17-31-16-21(29)15-28(23)14-19-4-2-1-3-5-19/h6-9,19,21-24,29H,1-5,10-17H2,(H,27,30)/t21-,22+,23+,24-/m1/s1	CEWCLCSAKAWIOS-NAVOZUGXSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(CC4CCCCC4)C1	BroadT	BRD-K63164430	BRD-K63164430-001-01-1	Broad Institute of MIT and Harvard	BRD-K63164430			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(CC2CCCCC2)C1	InChI=1S/C25H37FN2O4/c26-20-8-6-18(7-9-20)13-27-25(30)12-22-10-11-23-24(32-22)17-31-16-21(29)15-28(23)14-19-4-2-1-3-5-19/h6-9,19,21-24,29H,1-5,10-17H2,(H,27,30)/t21-,22+,23+,24-/m1/s1	CEWCLCSAKAWIOS-NAVOZUGXSA-N	448.273735884							100896
BRD-K61881697	LSM-12180		54658055	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16-,17+,18-/m0/s1	MKIQWJGRPCGZSV-FJIDUMEYSA-N	CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc3ccncc3)O1	BroadT	BRD-K61881697	BRD-K61881697-001-01-0	Broad Institute of MIT and Harvard	BRD-K61881697			CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc2ccncc2)O1	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16-,17+,18-/m0/s1	MKIQWJGRPCGZSV-FJIDUMEYSA-N	363.215806438							100806
BRD-K63827443	LSM-12316		54657854	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25+,27-,28+/m0/s1	IXXIZSABFJAVRH-UNYYBDMVSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@H]23	BroadT	BRD-K63827443	BRD-K63827443-001-01-8	Broad Institute of MIT and Harvard	BRD-K63827443			COc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25+,27-,28+/m0/s1	IXXIZSABFJAVRH-UNYYBDMVSA-N	573.250871308							100943
BRD-K55009937	LSM-11762		54657881	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21+,23-,24+/m0/s1	KOAYSPOFMXWQDS-FPVCRCAZSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)NCCCN4CCOCC4)CC[C@H]23	BroadT	BRD-K55009937	BRD-K55009937-001-01-6	Broad Institute of MIT and Harvard	BRD-K55009937			COc1cccc(c1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NCCCN3CCOCC3)CC[C@H]12	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21+,23-,24+/m0/s1	KOAYSPOFMXWQDS-FPVCRCAZSA-N	541.245785928							100387
CHEMBL3182917	LSM-8934	BRD-K08377525	54657904	InChI=1S/C27H30Cl2N2O5/c28-20-9-19(10-21(29)11-20)27(34)31-14-22(32)15-35-16-25-24(31)6-5-23(36-25)12-26(33)30-8-7-17-3-1-2-4-18(17)13-30/h1-4,9-11,22-25,32H,5-8,12-16H2/t22-,23+,24-,25+/m0/s1	RFSVTUPSJXWLCE-FQUZAXHOSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]2N(C1)C(=O)c5cc(Cl)cc(Cl)c5	BroadT	BRD-K08377525	BRD-K08377525-001-01-3	Broad Institute of MIT and Harvard	BRD-K08377525			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]2N(C1)C(=O)c1cc(Cl)cc(Cl)c1	InChI=1S/C27H30Cl2N2O5/c28-20-9-19(10-21(29)11-20)27(34)31-14-22(32)15-35-16-25-24(31)6-5-23(36-25)12-26(33)30-8-7-17-3-1-2-4-18(17)13-30/h1-4,9-11,22-25,32H,5-8,12-16H2/t22-,23+,24-,25+/m0/s1	RFSVTUPSJXWLCE-FQUZAXHOSA-N	532.1531775							97555
BRD-K50171542	LSM-11480		54657835	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18+,20-,21+/m0/s1	LTCDBOWOUBSGLM-IZZBFERCSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@@H]2N(Cc4ccccc4F)C1	BroadT	BRD-K50171542	BRD-K50171542-001-01-6	Broad Institute of MIT and Harvard	BRD-K50171542			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@@H]2N(Cc2ccccc2F)C1	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18+,20-,21+/m0/s1	LTCDBOWOUBSGLM-IZZBFERCSA-N	406.226785692							100101
BRD-K32345392	LSM-10391		54658037	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17-,18+,19-/m1/s1	VINMFOKKSKWMTO-AKHDSKFASA-N	O[C@@H]1CN[C@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COC1	BroadT	BRD-K32345392	BRD-K32345392-001-01-0	Broad Institute of MIT and Harvard	BRD-K32345392			O[C@@H]1CN[C@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17-,18+,19-/m1/s1	VINMFOKKSKWMTO-AKHDSKFASA-N	360.204907396							99012
BRD-K09936924	LSM-9041		54657877	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18-,20-,21+/m1/s1	AVCDQRNGDYLZTC-UKAVVXHISA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@H]2N(C1)C(=O)c4cnccn4	BroadT	BRD-K09936924	BRD-K09936924-001-01-2	Broad Institute of MIT and Harvard	BRD-K09936924			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18-,20-,21+/m1/s1	AVCDQRNGDYLZTC-UKAVVXHISA-N	458.196548204							97662
BRD-K41389876	LSM-10942		54658027	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20+,22-,23+/m0/s1	BTHNBOLPOQRYCE-PABCKOPISA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCCN3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c4ccccc4	BroadT	BRD-K41389876	BRD-K41389876-001-01-2	Broad Institute of MIT and Harvard	BRD-K41389876			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCCN3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c1ccccc1	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20+,22-,23+/m0/s1	BTHNBOLPOQRYCE-PABCKOPISA-N	495.240306624							99563
BRD-K94646939	LSM-14225		54657926	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16-,19-,20+/m1/s1	KPSAIAGNOOFEEI-SMOSDQRPSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@H]2N(C1)C(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K94646939	BRD-K94646939-001-01-6	Broad Institute of MIT and Harvard	BRD-K94646939			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@H]2N(C1)C(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16-,19-,20+/m1/s1	KPSAIAGNOOFEEI-SMOSDQRPSA-N	485.148426478							102879
BRD-K20978396	LSM-9707		54657870	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18+,19-,20+/m1/s1	IDLNHXHJUITYBI-WCIQWLHISA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@H]2N(C1)C(=O)Nc4cc(Cl)cc(Cl)c4	BroadT	BRD-K20978396	BRD-K20978396-001-01-8	Broad Institute of MIT and Harvard	BRD-K20978396			O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@H]2N(C1)C(=O)Nc1cc(Cl)cc(Cl)c1	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18+,19-,20+/m1/s1	IDLNHXHJUITYBI-WCIQWLHISA-N	501.143341098							98328
BRD-K75732649	LSM-13059		54657998	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19+,20-,21+/m0/s1	AEYAMMVRWLJFNH-JSXRDJHFSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3S(=O)(=O)c4ccccc4C)O2	BroadT	BRD-K75732649	BRD-K75732649-001-01-8	Broad Institute of MIT and Harvard	BRD-K75732649			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c2ccccc2C)O1	InChI=1S/C23H35N3O6S/c1-17-5-3-4-6-22(17)33(29,30)26-14-18(27)15-31-16-21-20(26)8-7-19(32-21)13-23(28)25-11-9-24(2)10-12-25/h3-6,18-21,27H,7-16H2,1-2H3/t18-,19+,20-,21+/m0/s1	AEYAMMVRWLJFNH-JSXRDJHFSA-N	481.22465656							101696
SCHEMBL16980376	LSM-6842	BRD-K60298771	54657895	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23-,24+,25-/m0/s1	HZAABOSBDYXUMN-OXCBMLQPSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K60298771	BRD-K60298771-001-01-7	Broad Institute of MIT and Harvard	BRD-K60298771			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@H]2N(CCC(F)(F)F)C1	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23-,24+,25-/m0/s1	HZAABOSBDYXUMN-OXCBMLQPSA-N	522.234156776							95463
BRD-K98956791	LSM-14503		54657969	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16+,17+,18-/m0/s1	XOXZVIQHUYDNGA-MLHJIOFPSA-N	Cc1onc(C)c1NC(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)NCC4CC4)CC[C@@H]23	BroadT	BRD-K98956791	BRD-K98956791-001-01-2	Broad Institute of MIT and Harvard	BRD-K98956791			Cc1noc(C)c1NC(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)NCC3CC3)CC[C@@H]12	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16+,17+,18-/m0/s1	XOXZVIQHUYDNGA-MLHJIOFPSA-N	436.232184784							103158
BRD-K29528387	LSM-10218		54657933	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17+,20-,21+/m1/s1	JLPSQBARJGYMKN-OVQGTLEDSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3C(=O)c4ccccc4F)O2	BroadT	BRD-K29528387	BRD-K29528387-001-01-3	Broad Institute of MIT and Harvard	BRD-K29528387			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c2ccccc2F)O1	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17+,20-,21+/m1/s1	JLPSQBARJGYMKN-OVQGTLEDSA-N	449.232599354							98839
BRD-K19933506	LSM-9636		54657793	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19+,20+,21-/m1/s1	QGGFARYSPQJNIH-IVAOSVALSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2CC3CCCC3)O1	BroadT	BRD-K19933506	BRD-K19933506-001-01-3	Broad Institute of MIT and Harvard	BRD-K19933506			CN(C)CCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2CC2CCCC2)O1	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19+,20+,21-/m1/s1	QGGFARYSPQJNIH-IVAOSVALSA-N	411.309706822							98257
BRD-K32322802-001-01-3	LSM-23242	BRD-K32322802	54657792	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19+,20+,21-/m0/s1	QGGFARYSPQJNIH-BQJUDKOJSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2CC3CCCC3)O1	BroadT	BRD-K32322802	BRD-K32322802-001-01-3	Broad Institute of MIT and Harvard	BRD-K32322802			CN(C)CCCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2CC2CCCC2)O1	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19+,20+,21-/m0/s1	QGGFARYSPQJNIH-BQJUDKOJSA-N	411.309706822							111829
BRD-K03077507	LSM-8624		54657843	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20-,22-,23+/m0/s1	CDWYTZLAFHIRLQ-BAMDZGJYSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K03077507	BRD-K03077507-001-01-6	Broad Institute of MIT and Harvard	BRD-K03077507			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20-,22-,23+/m0/s1	CDWYTZLAFHIRLQ-BAMDZGJYSA-N	498.21998575							97245
BRD-K29957577	LSM-10243		54658009	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18+,19+,20-/m0/s1	PSOMVEOYXZFBLO-NMLBUPMWSA-N	Cn1cnc(c1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)NCc4cccc(F)c4)CC[C@@H]23	BroadT	BRD-K29957577	BRD-K29957577-001-01-4	Broad Institute of MIT and Harvard	BRD-K29957577			Cn1cnc(c1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]12	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18+,19+,20-/m0/s1	PSOMVEOYXZFBLO-NMLBUPMWSA-N	496.179183578							98864
BRD-K15377376	LSM-9346		54657908	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10-,11+,12-/m0/s1	LPUMVFGYOYFXDR-YFKTTZPYSA-N	O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)Nc3nccs3)O[C@H]2COC1	BroadT	BRD-K15377376	BRD-K15377376-001-01-4	Broad Institute of MIT and Harvard	BRD-K15377376			O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)Nc3nccs3)O[C@H]2COC1	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10-,11+,12-/m0/s1	LPUMVFGYOYFXDR-YFKTTZPYSA-N	327.125276872							97967
BRD-K02222982	LSM-8570		54657830	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18+,20-,21+/m1/s1	LTCDBOWOUBSGLM-JYRKZWEQSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NC3CCC3)CC[C@H]2N(Cc4ccccc4F)C1	BroadT	BRD-K02222982	BRD-K02222982-001-01-3	Broad Institute of MIT and Harvard	BRD-K02222982			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NC3CCC3)CC[C@H]2N(Cc2ccccc2F)C1	InChI=1S/C22H31FN2O4/c23-19-7-2-1-4-15(19)11-25-12-17(26)13-28-14-21-20(25)9-8-18(29-21)10-22(27)24-16-5-3-6-16/h1-2,4,7,16-18,20-21,26H,3,5-6,8-14H2,(H,24,27)/t17-,18+,20-,21+/m1/s1	LTCDBOWOUBSGLM-JYRKZWEQSA-N	406.226785692							97191
BRD-K98036459	LSM-14454		54658050	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11-,12+,13-/m0/s1	NGKDTDLAKVOKMV-RVMXOQNASA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2CCC(F)(F)F)O1	BroadT	BRD-K98036459	BRD-K98036459-001-01-6	Broad Institute of MIT and Harvard	BRD-K98036459			COC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2CCC(F)(F)F)O1	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11-,12+,13-/m0/s1	NGKDTDLAKVOKMV-RVMXOQNASA-N	355.160657478							103109
BRD-K76665419	LSM-13120		54658092	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19+,20-,23+/m1/s1	TYHBJRPCTKOJBR-AWWSKVOZSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@H]2N(Cc4ccc5OCOc5c4)C1	BroadT	BRD-K76665419	BRD-K76665419-001-01-7	Broad Institute of MIT and Harvard	BRD-K76665419			O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19+,20-,23+/m1/s1	TYHBJRPCTKOJBR-AWWSKVOZSA-N	446.241686828							101758
BRD-K17139153	LSM-9463		54657849	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25-,27+,28-/m0/s1	IXXIZSABFJAVRH-FVWWXAAGSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@@H]23	BroadT	BRD-K17139153	BRD-K17139153-001-01-5	Broad Institute of MIT and Harvard	BRD-K17139153			COc1ccc(cc1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25-,27+,28-/m0/s1	IXXIZSABFJAVRH-FVWWXAAGSA-N	573.250871308							98084
BRD-K72150200	LSM-12849		54658039	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20+,22-,23+/m1/s1	JLFHHDVKVXKGLO-SKWRMQMOSA-N	Cc1ccccc1S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)NCc4ccccc4Cl)CC[C@@H]23	BroadT	BRD-K72150200	BRD-K72150200-001-01-7	Broad Institute of MIT and Harvard	BRD-K72150200			Cc1ccccc1S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)NCc3ccccc3Cl)CC[C@@H]12	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20+,22-,23+/m1/s1	JLFHHDVKVXKGLO-SKWRMQMOSA-N	522.159135132							101486
BRD-K13983359	LSM-9273		54657984	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27+,28+,30-/m0/s1	IQZRHVPMCXNVFS-CIXDGQAGSA-N	COc1ccccc1CNC(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3Cc4cccc(c4)c5ccncc5)O2	BroadT	BRD-K13983359	BRD-K13983359-001-01-2	Broad Institute of MIT and Harvard	BRD-K13983359			COc1ccccc1CNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc2cccc(c2)-c2ccncc2)O1	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27+,28+,30-/m0/s1	IQZRHVPMCXNVFS-CIXDGQAGSA-N	531.273321314							97894
BRD-K24133356	LSM-9887		54657855	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25+,27+,28-/m1/s1	IXXIZSABFJAVRH-CJYKMDJTSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@H]23	BroadT	BRD-K24133356	BRD-K24133356-001-01-4	Broad Institute of MIT and Harvard	BRD-K24133356			COc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25+,27+,28-/m1/s1	IXXIZSABFJAVRH-CJYKMDJTSA-N	573.250871308							98508
BRD-K75425370	LSM-13046		54658008	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18+,19+,20-/m1/s1	PSOMVEOYXZFBLO-FUMNGEBKSA-N	Cn1cnc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)NCc4cccc(F)c4)CC[C@H]23	BroadT	BRD-K75425370	BRD-K75425370-001-01-4	Broad Institute of MIT and Harvard	BRD-K75425370			Cn1cnc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)NCc3cccc(F)c3)CC[C@H]12	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18+,19+,20-/m1/s1	PSOMVEOYXZFBLO-FUMNGEBKSA-N	496.179183578							101683
BRD-K68445037	LSM-12605		54657805	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20+,22-,25+/m1/s1	HNAQDDNENYJUKU-GFMPLVLUSA-N	Cc1ccc(cc1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)NCc4ccc5OCOc5c4)CC[C@@H]23	BroadT	BRD-K68445037	BRD-K68445037-001-01-6	Broad Institute of MIT and Harvard	BRD-K68445037			Cc1ccc(cc1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)NCc3ccc4OCOc4c3)CC[C@@H]12	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20+,22-,25+/m1/s1	HNAQDDNENYJUKU-GFMPLVLUSA-N	532.187936694							101237
BRD-K85616320	LSM-13663		54657962	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16-,17-,18+/m1/s1	XOXZVIQHUYDNGA-TVFCKZIOSA-N	Cc1onc(C)c1NC(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)NCC4CC4)CC[C@@H]23	BroadT	BRD-K85616320	BRD-K85616320-001-01-7	Broad Institute of MIT and Harvard	BRD-K85616320			Cc1noc(C)c1NC(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)NCC3CC3)CC[C@@H]12	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16-,17-,18+/m1/s1	XOXZVIQHUYDNGA-TVFCKZIOSA-N	436.232184784							102310
BRD-K67058688	LSM-12511		54657991	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20-,21+,22-/m1/s1	UZQWVSGPDQQYNK-YUMYIRISSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3Cc4cccc(F)c4)O2	BroadT	BRD-K67058688	BRD-K67058688-001-01-0	Broad Institute of MIT and Harvard	BRD-K67058688			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc2cccc(F)c2)O1	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20-,21+,22-/m1/s1	UZQWVSGPDQQYNK-YUMYIRISSA-N	435.253334798							101142
BRD-K85930698	LSM-13693		54657810	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20+,22+,25-/m0/s1	HNAQDDNENYJUKU-SJHHWCTQSA-N	Cc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)NCc4ccc5OCOc5c4)CC[C@@H]23	BroadT	BRD-K85930698	BRD-K85930698-001-01-6	Broad Institute of MIT and Harvard	BRD-K85930698			Cc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)NCc3ccc4OCOc4c3)CC[C@@H]12	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20+,22+,25-/m0/s1	HNAQDDNENYJUKU-SJHHWCTQSA-N	532.187936694							102341
BRD-K56328447	LSM-11837		54657905	InChI=1S/C27H30Cl2N2O5/c28-20-9-19(10-21(29)11-20)27(34)31-14-22(32)15-35-16-25-24(31)6-5-23(36-25)12-26(33)30-8-7-17-3-1-2-4-18(17)13-30/h1-4,9-11,22-25,32H,5-8,12-16H2/t22-,23-,24-,25+/m1/s1	RFSVTUPSJXWLCE-VPBXCIAMSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@H]2N(C1)C(=O)c5cc(Cl)cc(Cl)c5	BroadT	BRD-K56328447	BRD-K56328447-001-01-2	Broad Institute of MIT and Harvard	BRD-K56328447			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@H]2N(C1)C(=O)c1cc(Cl)cc(Cl)c1	InChI=1S/C27H30Cl2N2O5/c28-20-9-19(10-21(29)11-20)27(34)31-14-22(32)15-35-16-25-24(31)6-5-23(36-25)12-26(33)30-8-7-17-3-1-2-4-18(17)13-30/h1-4,9-11,22-25,32H,5-8,12-16H2/t22-,23-,24-,25+/m1/s1	RFSVTUPSJXWLCE-VPBXCIAMSA-N	532.1531775							100463
BRD-K70861166	LSM-12753		54657809	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20-,22+,25-/m0/s1	HNAQDDNENYJUKU-JBAWTIAASA-N	Cc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)NCc4ccc5OCOc5c4)CC[C@@H]23	BroadT	BRD-K70861166	BRD-K70861166-001-01-3	Broad Institute of MIT and Harvard	BRD-K70861166			Cc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)NCc3ccc4OCOc4c3)CC[C@@H]12	InChI=1S/C26H32N2O8S/c1-17-2-6-21(7-3-17)37(31,32)28-13-19(29)14-33-15-25-22(28)8-5-20(36-25)11-26(30)27-12-18-4-9-23-24(10-18)35-16-34-23/h2-4,6-7,9-10,19-20,22,25,29H,5,8,11-16H2,1H3,(H,27,30)/t19-,20-,22+,25-/m0/s1	HNAQDDNENYJUKU-JBAWTIAASA-N	532.187936694							101390
BRD-K97585006	LSM-14423		54657961	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20+,22-,24+/m1/s1	YKBSBMDVZJDWJN-ADGBJGEGSA-N	COc1ccccc1NC(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)NCCc4ccncc4)CC[C@@H]23	BroadT	BRD-K97585006	BRD-K97585006-001-01-1	Broad Institute of MIT and Harvard	BRD-K97585006			COc1ccccc1NC(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)NCCc3ccncc3)CC[C@@H]12	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20+,22-,24+/m1/s1	YKBSBMDVZJDWJN-ADGBJGEGSA-N	498.247834848							103078
BRD-K57754556	LSM-11922		54658017	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24+,26-,27+/m1/s1	JIBJCGLYXNSLDN-QHGFWFBMSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)N4CCN(CC4)c5ccccc5)CC[C@@H]23	BroadT	BRD-K57754556	BRD-K57754556-001-01-5	Broad Institute of MIT and Harvard	BRD-K57754556			COc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@@H]12	InChI=1S/C28H37N3O7S/c1-36-23-8-5-9-25(16-23)39(34,35)31-18-22(32)19-37-20-27-26(31)11-10-24(38-27)17-28(33)30-14-12-29(13-15-30)21-6-3-2-4-7-21/h2-9,16,22,24,26-27,32H,10-15,17-20H2,1H3/t22-,24+,26-,27+/m1/s1	JIBJCGLYXNSLDN-QHGFWFBMSA-N	559.235221244							100548
BRD-K41404328	LSM-10943		54658077	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22+,23+,24-/m0/s1	WWAGOAOIMIOBRQ-FCUGFLGKSA-N	CCCNC(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	BroadT	BRD-K41404328	BRD-K41404328-001-01-3	Broad Institute of MIT and Harvard	BRD-K41404328			CCCNC(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22+,23+,24-/m0/s1	WWAGOAOIMIOBRQ-FCUGFLGKSA-N	488.29987042							99564
BRD-K76729250	LSM-13125		54657868	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18-,19+,20-/m1/s1	IDLNHXHJUITYBI-YSTOQKLRSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@@H]2N(C1)C(=O)Nc4cc(Cl)cc(Cl)c4	BroadT	BRD-K76729250	BRD-K76729250-001-01-3	Broad Institute of MIT and Harvard	BRD-K76729250			O[C@H]1COC[C@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@@H]2N(C1)C(=O)Nc1cc(Cl)cc(Cl)c1	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18-,19+,20-/m1/s1	IDLNHXHJUITYBI-YSTOQKLRSA-N	501.143341098							101763
BRD-K53912655	LSM-11703		54658001	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18-,19+,20-/m1/s1	NCINSYYDRJCYKJ-YSTOQKLRSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CC3)CC[C@@H]2N(CC4CCOCC4)C1	BroadT	BRD-K53912655	BRD-K53912655-001-01-3	Broad Institute of MIT and Harvard	BRD-K53912655			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CC3)CC[C@@H]2N(CC2CCOCC2)C1	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18-,19+,20-/m1/s1	NCINSYYDRJCYKJ-YSTOQKLRSA-N	396.262422272							100328
BRD-K38210246	LSM-10743		54657838	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20+,22-,23+/m1/s1	CDWYTZLAFHIRLQ-SKWRMQMOSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K38210246	BRD-K38210246-001-01-8	Broad Institute of MIT and Harvard	BRD-K38210246			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H35FN2O6S/c25-18-6-9-21(10-7-18)34(30,31)27-14-19(28)15-32-16-23-22(27)11-8-20(33-23)12-24(29)26-13-17-4-2-1-3-5-17/h6-7,9-10,17,19-20,22-23,28H,1-5,8,11-16H2,(H,26,29)/t19-,20+,22-,23+/m1/s1	CDWYTZLAFHIRLQ-SKWRMQMOSA-N	498.21998575							99364
BRD-K89412540	LSM-13936		54657827	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23+,24-,25+/m0/s1	XKLJDQDBSRSGED-FQUZAXHOSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]2N(Cc5nccs5)C1	BroadT	BRD-K89412540	BRD-K89412540-001-01-1	Broad Institute of MIT and Harvard	BRD-K89412540			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]2N(Cc2nccs2)C1	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23+,24-,25+/m0/s1	XKLJDQDBSRSGED-FQUZAXHOSA-N	499.250477384							102589
BRD-K70200040	LSM-12712		54658033	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17+,18+,19-/m1/s1	VINMFOKKSKWMTO-YDZRNGNQSA-N	O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COC1	BroadT	BRD-K70200040	BRD-K70200040-001-01-6	Broad Institute of MIT and Harvard	BRD-K70200040			O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17+,18+,19-/m1/s1	VINMFOKKSKWMTO-YDZRNGNQSA-N	360.204907396							101347
BRD-K71650306	LSM-12814		54658101	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20+,21-,22+/m0/s1	VWRSVZSWDSMGOW-LNRXMEIDSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]2N(C1)C(=O)c4ccncc4	BroadT	BRD-K71650306	BRD-K71650306-001-01-0	Broad Institute of MIT and Harvard	BRD-K71650306			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]2N(C1)C(=O)c1ccncc1	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20+,21-,22+/m0/s1	VWRSVZSWDSMGOW-LNRXMEIDSA-N	457.201299226							101451
BRD-K37551767	LSM-10698		54657945	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22+,23-,24+/m1/s1	UWGYAIIPASVTSB-QPXUXIHVSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(Cc4cccc(Cl)c4)C1	BroadT	BRD-K37551767	BRD-K37551767-001-01-5	Broad Institute of MIT and Harvard	BRD-K37551767			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(Cc2cccc(Cl)c2)C1	InChI=1S/C25H37ClN2O4/c26-20-8-4-7-19(11-20)14-28-15-21(29)16-31-17-24-23(28)10-9-22(32-24)12-25(30)27-13-18-5-2-1-3-6-18/h4,7-8,11,18,21-24,29H,1-3,5-6,9-10,12-17H2,(H,27,30)/t21-,22+,23-,24+/m1/s1	UWGYAIIPASVTSB-QPXUXIHVSA-N	464.244185394							99319
BRD-K32655366	LSM-10410		54658091	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19+,20-,23+/m0/s1	TYHBJRPCTKOJBR-FAKFISEUSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@@H]2N(Cc4ccc5OCOc5c4)C1	BroadT	BRD-K32655366	BRD-K32655366-001-01-4	Broad Institute of MIT and Harvard	BRD-K32655366			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C24H34N2O6/c27-18-13-26(12-17-4-7-21-22(10-17)31-16-30-21)20-6-5-19(32-23(20)15-29-14-18)11-24(28)25-8-2-1-3-9-25/h4,7,10,18-20,23,27H,1-3,5-6,8-9,11-16H2/t18-,19+,20-,23+/m0/s1	TYHBJRPCTKOJBR-FAKFISEUSA-N	446.241686828							99031
BRD-K53181055	LSM-11670		54657928	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16+,19-,20+/m0/s1	KPSAIAGNOOFEEI-ACZWYYKOSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@@H]2N(C1)C(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K53181055	BRD-K53181055-001-01-1	Broad Institute of MIT and Harvard	BRD-K53181055			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@@H]2N(C1)C(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16+,19-,20+/m0/s1	KPSAIAGNOOFEEI-ACZWYYKOSA-N	485.148426478							100295
BRD-K12858756	LSM-9191		54657859	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25+,27-,28+/m1/s1	IXXIZSABFJAVRH-RYRJUEDQSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@@H]23	BroadT	BRD-K12858756	BRD-K12858756-001-01-6	Broad Institute of MIT and Harvard	BRD-K12858756			COc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23+,25+,27-,28+/m1/s1	IXXIZSABFJAVRH-RYRJUEDQSA-N	573.250871308							97812
BRD-K38870294	LSM-10783		54658012	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18-,19+,20-/m0/s1	PSOMVEOYXZFBLO-HAGHYFMRSA-N	Cn1cnc(c1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)NCc4cccc(F)c4)CC[C@@H]23	BroadT	BRD-K38870294	BRD-K38870294-001-01-0	Broad Institute of MIT and Harvard	BRD-K38870294			Cn1cnc(c1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]12	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18-,19+,20-/m0/s1	PSOMVEOYXZFBLO-HAGHYFMRSA-N	496.179183578							99404
BRD-K91758467	LSM-14067		54657826	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23+,24-,25+/m1/s1	XKLJDQDBSRSGED-RCTAOEEJSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]2N(Cc5nccs5)C1	BroadT	BRD-K91758467	BRD-K91758467-001-01-2	Broad Institute of MIT and Harvard	BRD-K91758467			O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]2N(Cc2nccs2)C1	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23+,24-,25+/m1/s1	XKLJDQDBSRSGED-RCTAOEEJSA-N	499.250477384							102721
SCHEMBL16980381	LSM-6849	BRD-K74548617	54657899	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23+,24-,25+/m1/s1	HZAABOSBDYXUMN-YFJHUXEUSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K74548617	BRD-K74548617-001-01-7	Broad Institute of MIT and Harvard	BRD-K74548617			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@H]2N(CCC(F)(F)F)C1	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23+,24-,25+/m1/s1	HZAABOSBDYXUMN-YFJHUXEUSA-N	522.234156776							95470
BRD-K83016905	LSM-13501		54657973	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14+,15+,17-/m0/s1	WAKYUTRBASZCGN-HWMZRRJGSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2S(=O)(=O)c3ccccc3OC)O1	BroadT	BRD-K83016905	BRD-K83016905-001-01-5	Broad Institute of MIT and Harvard	BRD-K83016905			COC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2S(=O)(=O)c2ccccc2OC)O1	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14+,15+,17-/m0/s1	WAKYUTRBASZCGN-HWMZRRJGSA-N	429.145737524							102142
BRD-K73082254	LSM-12901		54658090	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22+,23-,24+/m0/s1	WWAGOAOIMIOBRQ-UDIRQSBCSA-N	CCCNC(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	BroadT	BRD-K73082254	BRD-K73082254-001-01-6	Broad Institute of MIT and Harvard	BRD-K73082254			CCCNC(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22+,23-,24+/m0/s1	WWAGOAOIMIOBRQ-UDIRQSBCSA-N	488.29987042							101538
BRD-K47303556	LSM-11318		54658062	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16-,17-,18+/m0/s1	MKIQWJGRPCGZSV-XLAORIBOSA-N	CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc3ccncc3)O1	BroadT	BRD-K47303556	BRD-K47303556-001-01-4	Broad Institute of MIT and Harvard	BRD-K47303556			CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc2ccncc2)O1	InChI=1S/C19H29N3O4/c1-2-21-19(24)9-16-3-4-17-18(26-16)13-25-12-15(23)11-22(17)10-14-5-7-20-8-6-14/h5-8,15-18,23H,2-4,9-13H2,1H3,(H,21,24)/t15-,16-,17-,18+/m0/s1	MKIQWJGRPCGZSV-XLAORIBOSA-N	363.215806438							99939
BRD-K49283005	LSM-11424		54657864	InChI=1S/C20H29FN2O7S/c1-28-9-8-22-20(25)10-15-6-7-17-18(30-15)13-29-12-14(24)11-23(17)31(26,27)19-5-3-2-4-16(19)21/h2-5,14-15,17-18,24H,6-13H2,1H3,(H,22,25)/t14-,15+,17-,18+/m0/s1	ZIIKQONHXRNGRF-CIRFHOKZSA-N	COCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c3ccccc3F)O1	BroadT	BRD-K49283005	BRD-K49283005-001-01-3	Broad Institute of MIT and Harvard	BRD-K49283005			COCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c2ccccc2F)O1	InChI=1S/C20H29FN2O7S/c1-28-9-8-22-20(25)10-15-6-7-17-18(30-15)13-29-12-14(24)11-23(17)31(26,27)19-5-3-2-4-16(19)21/h2-5,14-15,17-18,24H,6-13H2,1H3,(H,22,25)/t14-,15+,17-,18+/m0/s1	ZIIKQONHXRNGRF-CIRFHOKZSA-N	460.167950178							100045
BRD-K16724492	LSM-9438		54657985	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27-,28-,30+/m1/s1	IQZRHVPMCXNVFS-KMPDWKOJSA-N	COc1ccccc1CNC(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3Cc4cccc(c4)c5ccncc5)O2	BroadT	BRD-K16724492	BRD-K16724492-001-01-5	Broad Institute of MIT and Harvard	BRD-K16724492			COc1ccccc1CNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc2cccc(c2)-c2ccncc2)O1	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27-,28-,30+/m1/s1	IQZRHVPMCXNVFS-KMPDWKOJSA-N	531.273321314							98059
BRD-K23033683	LSM-9824		54657955	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20-,22+,24-/m0/s1	YKBSBMDVZJDWJN-QRVLJTFESA-N	COc1ccccc1NC(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)NCCc4ccncc4)CC[C@@H]23	BroadT	BRD-K23033683	BRD-K23033683-001-01-1	Broad Institute of MIT and Harvard	BRD-K23033683			COc1ccccc1NC(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)NCCc3ccncc3)CC[C@@H]12	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20-,22+,24-/m0/s1	YKBSBMDVZJDWJN-QRVLJTFESA-N	498.247834848							98445
BRD-K70663894	LSM-12740		54657914	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15-,16-,17+/m0/s1	MWTQFHHONBVRQP-LUKYLMHMSA-N	CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)C3CCOCC3)O1	BroadT	BRD-K70663894	BRD-K70663894-001-01-2	Broad Institute of MIT and Harvard	BRD-K70663894			CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)C2CCOCC2)O1	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15-,16-,17+/m0/s1	MWTQFHHONBVRQP-LUKYLMHMSA-N	384.226036764							101376
BRD-K44080306	LSM-11120		54657879	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18-,20-,21+/m0/s1	AVCDQRNGDYLZTC-JYAXBFRTSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(C1)C(=O)c4cnccn4	BroadT	BRD-K44080306	BRD-K44080306-001-01-4	Broad Institute of MIT and Harvard	BRD-K44080306			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C23H27FN4O5/c24-16-3-1-15(2-4-16)10-27-22(30)9-18-5-6-20-21(33-18)14-32-13-17(29)12-28(20)23(31)19-11-25-7-8-26-19/h1-4,7-8,11,17-18,20-21,29H,5-6,9-10,12-14H2,(H,27,30)/t17-,18-,20-,21+/m0/s1	AVCDQRNGDYLZTC-JYAXBFRTSA-N	458.196548204							99741
BRD-K99547414	LSM-14543		54657965	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16+,17+,18-/m1/s1	XOXZVIQHUYDNGA-VSZNYVQBSA-N	Cc1onc(C)c1NC(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)NCC4CC4)CC[C@H]23	BroadT	BRD-K99547414	BRD-K99547414-001-01-5	Broad Institute of MIT and Harvard	BRD-K99547414			Cc1noc(C)c1NC(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)NCC3CC3)CC[C@H]12	InChI=1S/C21H32N4O6/c1-12-20(13(2)31-24-12)23-21(28)25-9-15(26)10-29-11-18-17(25)6-5-16(30-18)7-19(27)22-8-14-3-4-14/h14-18,26H,3-11H2,1-2H3,(H,22,27)(H,23,28)/t15-,16+,17+,18-/m1/s1	XOXZVIQHUYDNGA-VSZNYVQBSA-N	436.232184784							103198
BRD-K71278614	LSM-12784		54657896	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23+,24-,25+/m0/s1	HZAABOSBDYXUMN-WQDFSMHNSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K71278614	BRD-K71278614-001-01-7	Broad Institute of MIT and Harvard	BRD-K71278614			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@@H]2N(CCC(F)(F)F)C1	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23+,24-,25+/m0/s1	HZAABOSBDYXUMN-WQDFSMHNSA-N	522.234156776							101421
BRD-K94708051	LSM-14233		54657815	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15+,16-,17+/m0/s1	RNNHPDFMCSWFHC-VVLHAWIVSA-N	O[C@H]1CN[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COC1	BroadT	BRD-K94708051	BRD-K94708051-001-01-6	Broad Institute of MIT and Harvard	BRD-K94708051			O[C@H]1CN[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COC1	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15+,16-,17+/m0/s1	RNNHPDFMCSWFHC-VVLHAWIVSA-N	349.200156374							102887
BRD-K66299073	LSM-12468		54658083	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22+,23-,24+/m0/s1	WWAGOAOIMIOBRQ-OSFFKXSWSA-N	CCCNC(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	BroadT	BRD-K66299073	BRD-K66299073-001-01-4	Broad Institute of MIT and Harvard	BRD-K66299073			CCCNC(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22+,23-,24+/m0/s1	WWAGOAOIMIOBRQ-OSFFKXSWSA-N	488.29987042							101099
BRD-K36962815	LSM-10664		54657974	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14+,15+,17-/m1/s1	WAKYUTRBASZCGN-WBTNSWJXSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2S(=O)(=O)c3ccccc3OC)O1	BroadT	BRD-K36962815	BRD-K36962815-001-01-7	Broad Institute of MIT and Harvard	BRD-K36962815			COC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2S(=O)(=O)c2ccccc2OC)O1	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14+,15+,17-/m1/s1	WAKYUTRBASZCGN-WBTNSWJXSA-N	429.145737524							99285
BRD-K62836482	LSM-12247		54657920	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15+,16+,17-/m1/s1	MWTQFHHONBVRQP-LTIDMASMSA-N	CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)C3CCOCC3)O1	BroadT	BRD-K62836482	BRD-K62836482-001-01-2	Broad Institute of MIT and Harvard	BRD-K62836482			CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)C2CCOCC2)O1	InChI=1S/C19H32N2O6/c1-2-20-18(23)9-15-3-4-16-17(27-15)12-26-11-14(22)10-21(16)19(24)13-5-7-25-8-6-13/h13-17,22H,2-12H2,1H3,(H,20,23)/t14-,15+,16+,17-/m1/s1	MWTQFHHONBVRQP-LTIDMASMSA-N	384.226036764							100873
BRD-K24781398	LSM-9936		54658089	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22+,23-,24+/m1/s1	WWAGOAOIMIOBRQ-SJSRKZJXSA-N	CCCNC(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	BroadT	BRD-K24781398	BRD-K24781398-001-01-0	Broad Institute of MIT and Harvard	BRD-K24781398			CCCNC(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22+,23-,24+/m1/s1	WWAGOAOIMIOBRQ-SJSRKZJXSA-N	488.29987042							98557
BRD-K41540007	LSM-10951		54657949	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15+,16-,17+/m0/s1	JDHZCDHPHAWVKT-VVLHAWIVSA-N	CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c3ccncc3)O1	BroadT	BRD-K41540007	BRD-K41540007-001-01-2	Broad Institute of MIT and Harvard	BRD-K41540007			CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c2ccncc2)O1	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15+,16-,17+/m0/s1	JDHZCDHPHAWVKT-VVLHAWIVSA-N	377.195070994							99572
BRD-K60595380	LSM-12089		54658045	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20+,22+,23-/m0/s1	JLFHHDVKVXKGLO-JVSAHFFESA-N	Cc1ccccc1S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)NCc4ccccc4Cl)CC[C@@H]23	BroadT	BRD-K60595380	BRD-K60595380-001-01-9	Broad Institute of MIT and Harvard	BRD-K60595380			Cc1ccccc1S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@@H]12	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20+,22+,23-/m0/s1	JLFHHDVKVXKGLO-JVSAHFFESA-N	522.159135132							100715
BRD-K04630954	LSM-8712		54658103	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20+,21-,22+/m1/s1	VWRSVZSWDSMGOW-MBDNFAEBSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3cccc(F)c3)CC[C@H]2N(C1)C(=O)c4ccncc4	BroadT	BRD-K04630954	BRD-K04630954-001-01-9	Broad Institute of MIT and Harvard	BRD-K04630954			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3cccc(F)c3)CC[C@H]2N(C1)C(=O)c1ccncc1	InChI=1S/C24H28FN3O5/c25-18-3-1-2-16(10-18)12-27-23(30)11-20-4-5-21-22(33-20)15-32-14-19(29)13-28(21)24(31)17-6-8-26-9-7-17/h1-3,6-10,19-22,29H,4-5,11-15H2,(H,27,30)/t19-,20+,21-,22+/m1/s1	VWRSVZSWDSMGOW-MBDNFAEBSA-N	457.201299226							97333
BRD-K97196700	LSM-14403		54657909	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10+,11-,12+/m1/s1	LPUMVFGYOYFXDR-KXNHARMFSA-N	O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)Nc3nccs3)O[C@H]2COC1	BroadT	BRD-K97196700	BRD-K97196700-001-01-6	Broad Institute of MIT and Harvard	BRD-K97196700			O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)Nc3nccs3)O[C@H]2COC1	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10+,11-,12+/m1/s1	LPUMVFGYOYFXDR-KXNHARMFSA-N	327.125276872							103057
BRD-K17906992	LSM-9506		54657987	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20-,21-,22+/m0/s1	UZQWVSGPDQQYNK-MYGLTJDJSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3Cc4cccc(F)c4)O2	BroadT	BRD-K17906992	BRD-K17906992-001-01-2	Broad Institute of MIT and Harvard	BRD-K17906992			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc2cccc(F)c2)O1	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20-,21-,22+/m0/s1	UZQWVSGPDQQYNK-MYGLTJDJSA-N	435.253334798							98127
BRD-K61997144	LSM-12189		54658011	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18-,19-,20+/m1/s1	PSOMVEOYXZFBLO-WTGUMLROSA-N	Cn1cnc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)NCc4cccc(F)c4)CC[C@@H]23	BroadT	BRD-K61997144	BRD-K61997144-001-01-3	Broad Institute of MIT and Harvard	BRD-K61997144			Cn1cnc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]12	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18-,19-,20+/m1/s1	PSOMVEOYXZFBLO-WTGUMLROSA-N	496.179183578							100815
BRD-K24123159	LSM-9886		54658028	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20-,22-,23+/m1/s1	BTHNBOLPOQRYCE-PRTQVNTJSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCCN3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c4ccccc4	BroadT	BRD-K24123159	BRD-K24123159-001-01-4	Broad Institute of MIT and Harvard	BRD-K24123159			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCCN3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c1ccccc1	InChI=1S/C24H37N3O6S/c28-19-16-27(34(30,31)21-7-3-1-4-8-21)22-10-9-20(33-23(22)18-32-17-19)15-24(29)25-11-14-26-12-5-2-6-13-26/h1,3-4,7-8,19-20,22-23,28H,2,5-6,9-18H2,(H,25,29)/t19-,20-,22-,23+/m1/s1	BTHNBOLPOQRYCE-PRTQVNTJSA-N	495.240306624							98507
BRD-K40358966	LSM-10889		54657821	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23+,24+,25-/m0/s1	XKLJDQDBSRSGED-LIONHTAISA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]2N(Cc5nccs5)C1	BroadT	BRD-K40358966	BRD-K40358966-001-01-9	Broad Institute of MIT and Harvard	BRD-K40358966			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]2N(Cc2nccs2)C1	InChI=1S/C27H37N3O4S/c31-22-16-30(17-26-28-10-13-35-26)24-7-6-23(34-25(24)19-33-18-22)15-27(32)29-11-8-21(9-12-29)14-20-4-2-1-3-5-20/h1-5,10,13,21-25,31H,6-9,11-12,14-19H2/t22-,23+,24+,25-/m0/s1	XKLJDQDBSRSGED-LIONHTAISA-N	499.250477384							99510
BRD-K74702716	LSM-13006		54658066	InChI=1S/C25H37FN2O4/c26-20-8-6-18(7-9-20)13-27-25(30)12-22-10-11-23-24(32-22)17-31-16-21(29)15-28(23)14-19-4-2-1-3-5-19/h6-9,19,21-24,29H,1-5,10-17H2,(H,27,30)/t21-,22+,23-,24+/m1/s1	CEWCLCSAKAWIOS-QPXUXIHVSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@H]2N(CC4CCCCC4)C1	BroadT	BRD-K74702716	BRD-K74702716-001-01-0	Broad Institute of MIT and Harvard	BRD-K74702716			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(F)cc3)CC[C@H]2N(CC2CCCCC2)C1	InChI=1S/C25H37FN2O4/c26-20-8-6-18(7-9-20)13-27-25(30)12-22-10-11-23-24(32-22)17-31-16-21(29)15-28(23)14-19-4-2-1-3-5-19/h6-9,19,21-24,29H,1-5,10-17H2,(H,27,30)/t21-,22+,23-,24+/m1/s1	CEWCLCSAKAWIOS-QPXUXIHVSA-N	448.273735884							101643
BRD-K94243176	LSM-14208		54658081	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22-,23-,24+/m0/s1	WWAGOAOIMIOBRQ-QCCYXRBGSA-N	CCCNC(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	BroadT	BRD-K94243176	BRD-K94243176-001-01-4	Broad Institute of MIT and Harvard	BRD-K94243176			CCCNC(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21-,22-,23-,24+/m0/s1	WWAGOAOIMIOBRQ-QCCYXRBGSA-N	488.29987042							102862
BRD-K72352929	LSM-12865		54657865	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18-,19+,20-/m0/s1	IDLNHXHJUITYBI-HAGHYFMRSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@H]2N(C1)C(=O)Nc4cc(Cl)cc(Cl)c4	BroadT	BRD-K72352929	BRD-K72352929-001-01-9	Broad Institute of MIT and Harvard	BRD-K72352929			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@H]2N(C1)C(=O)Nc1cc(Cl)cc(Cl)c1	InChI=1S/C22H29Cl2N3O6/c23-14-7-15(24)9-16(8-14)25-22(30)27-11-17(28)12-32-13-20-19(27)2-1-18(33-20)10-21(29)26-3-5-31-6-4-26/h7-9,17-20,28H,1-6,10-13H2,(H,25,30)/t17-,18-,19+,20-/m0/s1	IDLNHXHJUITYBI-HAGHYFMRSA-N	501.143341098							101502
BRD-K72772617	LSM-12883		54658010	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18+,19-,20+/m1/s1	PSOMVEOYXZFBLO-WCIQWLHISA-N	Cn1cnc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)NCc4cccc(F)c4)CC[C@@H]23	BroadT	BRD-K72772617	BRD-K72772617-001-01-5	Broad Institute of MIT and Harvard	BRD-K72772617			Cn1cnc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)NCc3cccc(F)c3)CC[C@@H]12	InChI=1S/C22H29FN4O6S/c1-26-11-22(25-14-26)34(30,31)27-10-17(28)12-32-13-20-19(27)6-5-18(33-20)8-21(29)24-9-15-3-2-4-16(23)7-15/h2-4,7,11,14,17-20,28H,5-6,8-10,12-13H2,1H3,(H,24,29)/t17-,18+,19-,20+/m1/s1	PSOMVEOYXZFBLO-WCIQWLHISA-N	496.179183578							101520
BRD-K68749296	LSM-12623		54657953	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15+,16-,17+/m1/s1	JDHZCDHPHAWVKT-TWMKSMIVSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c3ccncc3)O1	BroadT	BRD-K68749296	BRD-K68749296-001-01-7	Broad Institute of MIT and Harvard	BRD-K68749296			CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c2ccncc2)O1	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15+,16-,17+/m1/s1	JDHZCDHPHAWVKT-TWMKSMIVSA-N	377.195070994							101255
BRD-K89266502	LSM-13923		54658038	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17-,18-,19+/m1/s1	VINMFOKKSKWMTO-MKXGPGLRSA-N	O[C@@H]1CN[C@@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COC1	BroadT	BRD-K89266502	BRD-K89266502-001-01-7	Broad Institute of MIT and Harvard	BRD-K89266502			O[C@@H]1CN[C@@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)12-25-11-16)9-20(24)22-15-7-13-3-1-2-4-14(13)8-15/h1-4,15-19,21,23H,5-12H2,(H,22,24)/t16-,17-,18-,19+/m1/s1	VINMFOKKSKWMTO-MKXGPGLRSA-N	360.204907396							102576
BRD-K95328825	LSM-14271		54657992	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20+,21+,22-/m0/s1	UZQWVSGPDQQYNK-CBPXPLCBSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3Cc4cccc(F)c4)O2	BroadT	BRD-K95328825	BRD-K95328825-001-01-7	Broad Institute of MIT and Harvard	BRD-K95328825			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc2cccc(F)c2)O1	InChI=1S/C23H34FN3O4/c1-25-7-9-26(10-8-25)23(29)12-20-5-6-21-22(31-20)16-30-15-19(28)14-27(21)13-17-3-2-4-18(24)11-17/h2-4,11,19-22,28H,5-10,12-16H2,1H3/t19-,20+,21+,22-/m0/s1	UZQWVSGPDQQYNK-CBPXPLCBSA-N	435.253334798							102925
BRD-K88602713	LSM-13872		54657887	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21-,23-,24+/m0/s1	KOAYSPOFMXWQDS-RXOYHEDQSA-N	COc1cccc(c1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)NCCCN4CCOCC4)CC[C@H]23	BroadT	BRD-K88602713	BRD-K88602713-001-01-9	Broad Institute of MIT and Harvard	BRD-K88602713			COc1cccc(c1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)NCCCN3CCOCC3)CC[C@H]12	InChI=1S/C25H39N3O8S/c1-33-20-4-2-5-22(14-20)37(31,32)28-16-19(29)17-35-18-24-23(28)7-6-21(36-24)15-25(30)26-8-3-9-27-10-12-34-13-11-27/h2,4-5,14,19,21,23-24,29H,3,6-13,15-18H2,1H3,(H,26,30)/t19-,21-,23-,24+/m0/s1	KOAYSPOFMXWQDS-RXOYHEDQSA-N	541.245785928							131229
BRD-K27343142	LSM-10079		54657796	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19-,20+,21-/m1/s1	QGGFARYSPQJNIH-MXEMCNAFSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2CC3CCCC3)O1	BroadT	BRD-K27343142	BRD-K27343142-001-01-5	Broad Institute of MIT and Harvard	BRD-K27343142			CN(C)CCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2CC2CCCC2)O1	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19-,20+,21-/m1/s1	QGGFARYSPQJNIH-MXEMCNAFSA-N	411.309706822							98700
BRD-K70631162	LSM-12736		54658080	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22-,23-,24+/m1/s1	WWAGOAOIMIOBRQ-HUUMMWPTSA-N	CCCNC(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	BroadT	BRD-K70631162	BRD-K70631162-001-01-4	Broad Institute of MIT and Harvard	BRD-K70631162			CCCNC(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22-,23-,24+/m1/s1	WWAGOAOIMIOBRQ-HUUMMWPTSA-N	488.29987042							101372
BRD-K18456137	LSM-9541		54658053	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11+,12-,13+/m1/s1	NGKDTDLAKVOKMV-XQHKEYJVSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2CCC(F)(F)F)O1	BroadT	BRD-K18456137	BRD-K18456137-001-01-3	Broad Institute of MIT and Harvard	BRD-K18456137			COC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2CCC(F)(F)F)O1	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11+,12-,13+/m1/s1	NGKDTDLAKVOKMV-XQHKEYJVSA-N	355.160657478							98162
BRD-K29785053	LSM-10235		54657892	InChI=1S/C23H29N5O5/c29-18-12-28(23(31)27-16-4-2-1-3-5-16)20-7-6-19(33-21(20)14-32-13-18)10-22(30)25-11-17-8-9-24-15-26-17/h1-5,8-9,15,18-21,29H,6-7,10-14H2,(H,25,30)(H,27,31)/t18-,19-,20+,21-/m1/s1	DCLGJFWUMIZFMI-MXEMCNAFSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccncn3)CC[C@@H]2N(C1)C(=O)Nc4ccccc4	BroadT	BRD-K29785053	BRD-K29785053-001-01-2	Broad Institute of MIT and Harvard	BRD-K29785053			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccncn3)CC[C@@H]2N(C1)C(=O)Nc1ccccc1	InChI=1S/C23H29N5O5/c29-18-12-28(23(31)27-16-4-2-1-3-5-16)20-7-6-19(33-21(20)14-32-13-18)10-22(30)25-11-17-8-9-24-15-26-17/h1-5,8-9,15,18-21,29H,6-7,10-14H2,(H,25,30)(H,27,31)/t18-,19-,20+,21-/m1/s1	DCLGJFWUMIZFMI-MXEMCNAFSA-N	455.216869078							98856
BRD-K59867372	LSM-12045		54657907	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10-,11-,12+/m1/s1	LPUMVFGYOYFXDR-KKOKHZNYSA-N	O[C@@H]1CN[C@@H]2CC[C@H](CC(=O)Nc3nccs3)O[C@H]2COC1	BroadT	BRD-K59867372	BRD-K59867372-001-01-5	Broad Institute of MIT and Harvard	BRD-K59867372			O[C@@H]1CN[C@@H]2CC[C@H](CC(=O)Nc3nccs3)O[C@H]2COC1	InChI=1S/C14H21N3O4S/c18-9-6-16-11-2-1-10(21-12(11)8-20-7-9)5-13(19)17-14-15-3-4-22-14/h3-4,9-12,16,18H,1-2,5-8H2,(H,15,17,19)/t9-,10-,11-,12+/m1/s1	LPUMVFGYOYFXDR-KKOKHZNYSA-N	327.125276872							100671
BRD-K51164971-001-01-0	LSM-23243	BRD-K51164971	54657813	InChI=1S/C27H34N2O6S/c1-19-6-9-24(10-7-19)36(32,33)29-16-22(30)17-34-18-26-25(29)11-8-23(35-26)14-27(31)28-13-12-20-4-2-3-5-21(20)15-28/h2-7,9-10,22-23,25-26,30H,8,11-18H2,1H3/t22-,23+,25-,26+/m0/s1	FLEYPJQSSYMTAJ-ALNDXVPUSA-N	Cc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)N4CCc5ccccc5C4)CC[C@H]23	BroadT	BRD-K51164971	BRD-K51164971-001-01-0	Broad Institute of MIT and Harvard	BRD-K51164971			Cc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@H]12	InChI=1S/C27H34N2O6S/c1-19-6-9-24(10-7-19)36(32,33)29-16-22(30)17-34-18-26-25(29)11-8-23(35-26)14-27(31)28-13-12-20-4-2-3-5-21(20)15-28/h2-7,9-10,22-23,25-26,30H,8,11-18H2,1H3/t22-,23+,25-,26+/m0/s1	FLEYPJQSSYMTAJ-ALNDXVPUSA-N	514.213757518							111830
BRD-K25471349	LSM-9975		54658076	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22+,23+,24-/m0/s1	WWAGOAOIMIOBRQ-LSDVVMKASA-N	CCCNC(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	BroadT	BRD-K25471349	BRD-K25471349-001-01-7	Broad Institute of MIT and Harvard	BRD-K25471349			CCCNC(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C26H40N4O5/c1-2-11-27-26(33)30-16-21(31)17-34-18-24-23(30)9-8-22(35-24)13-25(32)28-20-10-12-29(15-20)14-19-6-4-3-5-7-19/h3-7,20-24,31H,2,8-18H2,1H3,(H,27,33)(H,28,32)/t20-,21+,22+,23+,24-/m0/s1	WWAGOAOIMIOBRQ-LSDVVMKASA-N	488.29987042							98596
CHEMBL2357204	LSM-12431	BRD-K65657366, SID131454490	54658042	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20+,22-,23+/m0/s1	JLFHHDVKVXKGLO-PABCKOPISA-N	Cc1ccccc1S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)NCc4ccccc4Cl)CC[C@H]23	BroadT	BRD-K65657366	BRD-K65657366-001-01-0	Broad Institute of MIT and Harvard	BRD-K65657366			Cc1ccccc1S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@H]12	InChI=1S/C25H31ClN2O6S/c1-17-6-2-5-9-24(17)35(31,32)28-14-19(29)15-33-16-23-22(28)11-10-20(34-23)12-25(30)27-13-18-7-3-4-8-21(18)26/h2-9,19-20,22-23,29H,10-16H2,1H3,(H,27,30)/t19-,20+,22-,23+/m0/s1	JLFHHDVKVXKGLO-PABCKOPISA-N	522.159135132							101058
BRD-K43939579	LSM-11110		54657820	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15+,16+,17-/m0/s1	RNNHPDFMCSWFHC-HZMVEIRTSA-N	O[C@H]1CN[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COC1	BroadT	BRD-K43939579	BRD-K43939579-001-01-2	Broad Institute of MIT and Harvard	BRD-K43939579			O[C@H]1CN[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COC1	InChI=1S/C18H27N3O4/c22-14-10-21-16-2-1-15(25-17(16)12-24-11-14)9-18(23)20-8-5-13-3-6-19-7-4-13/h3-4,6-7,14-17,21-22H,1-2,5,8-12H2,(H,20,23)/t14-,15+,16+,17-/m0/s1	RNNHPDFMCSWFHC-HZMVEIRTSA-N	349.200156374							99731
BRD-K95917977	LSM-14311		54657929	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16+,19-,20+/m1/s1	KPSAIAGNOOFEEI-GJJHYRHESA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NC3CCC3)CC[C@H]2N(C1)C(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K95917977	BRD-K95917977-001-01-3	Broad Institute of MIT and Harvard	BRD-K95917977			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NC3CCC3)CC[C@H]2N(C1)C(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H29Cl2N3O5/c23-17-6-4-14(8-18(17)24)26-22(30)27-10-15(28)11-31-12-20-19(27)7-5-16(32-20)9-21(29)25-13-2-1-3-13/h4,6,8,13,15-16,19-20,28H,1-3,5,7,9-12H2,(H,25,29)(H,26,30)/t15-,16+,19-,20+/m1/s1	KPSAIAGNOOFEEI-GJJHYRHESA-N	485.148426478							102965
BRD-K28738449	LSM-10171		54658073	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23-,24+,25-/m1/s1	CXJRMLHIKXWLHJ-ZKGSSEMHSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCCc3ccccc3)CC[C@@H]2N(Cc4ccc(Cl)cc4)C1	BroadT	BRD-K28738449	BRD-K28738449-001-01-5	Broad Institute of MIT and Harvard	BRD-K28738449			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCCc3ccccc3)CC[C@@H]2N(Cc2ccc(Cl)cc2)C1	InChI=1S/C26H33ClN2O4/c27-21-8-6-20(7-9-21)15-29-16-22(30)17-32-18-25-24(29)11-10-23(33-25)14-26(31)28-13-12-19-4-2-1-3-5-19/h1-9,22-25,30H,10-18H2,(H,28,31)/t22-,23-,24+,25-/m1/s1	CXJRMLHIKXWLHJ-ZKGSSEMHSA-N	472.212885266							98792
BRD-K18767302	LSM-9555		54657795	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19+,20-,21+/m0/s1	QGGFARYSPQJNIH-JSXRDJHFSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2CC3CCCC3)O1	BroadT	BRD-K18767302	BRD-K18767302-001-01-2	Broad Institute of MIT and Harvard	BRD-K18767302			CN(C)CCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2CC2CCCC2)O1	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19+,20-,21+/m0/s1	QGGFARYSPQJNIH-JSXRDJHFSA-N	411.309706822							98176
BRD-K14854082	LSM-9322		54657948	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15-,16-,17+/m0/s1	JDHZCDHPHAWVKT-LUKYLMHMSA-N	CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c3ccncc3)O1	BroadT	BRD-K14854082	BRD-K14854082-001-01-8	Broad Institute of MIT and Harvard	BRD-K14854082			CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c2ccncc2)O1	InChI=1S/C19H27N3O5/c1-21(2)18(24)9-15-3-4-16-17(27-15)12-26-11-14(23)10-22(16)19(25)13-5-7-20-8-6-13/h5-8,14-17,23H,3-4,9-12H2,1-2H3/t14-,15-,16-,17+/m0/s1	JDHZCDHPHAWVKT-LUKYLMHMSA-N	377.195070994							97943
BRD-K10578928	LSM-9065		54657978	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27-,28-,30+/m0/s1	IQZRHVPMCXNVFS-VNDOHOEKSA-N	COc1ccccc1CNC(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3Cc4cccc(c4)c5ccncc5)O2	BroadT	BRD-K10578928	BRD-K10578928-001-01-5	Broad Institute of MIT and Harvard	BRD-K10578928			COc1ccccc1CNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc2cccc(c2)-c2ccncc2)O1	InChI=1S/C31H37N3O5/c1-37-29-8-3-2-6-25(29)17-33-31(36)16-27-9-10-28-30(39-27)21-38-20-26(35)19-34(28)18-22-5-4-7-24(15-22)23-11-13-32-14-12-23/h2-8,11-15,26-28,30,35H,9-10,16-21H2,1H3,(H,33,36)/t26-,27-,28-,30+/m0/s1	IQZRHVPMCXNVFS-VNDOHOEKSA-N	531.273321314							97686
BRD-K01607762	LSM-8537		54658004	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18-,19+,20-/m0/s1	NCINSYYDRJCYKJ-HAGHYFMRSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CC3)CC[C@H]2N(CC4CCOCC4)C1	BroadT	BRD-K01607762	BRD-K01607762-001-01-2	Broad Institute of MIT and Harvard	BRD-K01607762			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CC3)CC[C@H]2N(CC2CCOCC2)C1	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18-,19+,20-/m0/s1	NCINSYYDRJCYKJ-HAGHYFMRSA-N	396.262422272							97158
BRD-K80559952	LSM-13354		54657958	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20-,22+,24-/m1/s1	YKBSBMDVZJDWJN-ZBJYJBBSSA-N	COc1ccccc1NC(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)NCCc4ccncc4)CC[C@H]23	BroadT	BRD-K80559952	BRD-K80559952-001-01-9	Broad Institute of MIT and Harvard	BRD-K80559952			COc1ccccc1NC(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)NCCc3ccncc3)CC[C@H]12	InChI=1S/C26H34N4O6/c1-34-23-5-3-2-4-21(23)29-26(33)30-15-19(31)16-35-17-24-22(30)7-6-20(36-24)14-25(32)28-13-10-18-8-11-27-12-9-18/h2-5,8-9,11-12,19-20,22,24,31H,6-7,10,13-17H2,1H3,(H,28,32)(H,29,33)/t19-,20-,22+,24-/m1/s1	YKBSBMDVZJDWJN-ZBJYJBBSSA-N	498.247834848							101993
BRD-K08371414	LSM-8932		54658052	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11+,12+,13-/m1/s1	NGKDTDLAKVOKMV-MROQNXINSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2CCC(F)(F)F)O1	BroadT	BRD-K08371414	BRD-K08371414-001-01-0	Broad Institute of MIT and Harvard	BRD-K08371414			COC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2CCC(F)(F)F)O1	InChI=1S/C15H24F3NO5/c1-22-14(21)6-11-2-3-12-13(24-11)9-23-8-10(20)7-19(12)5-4-15(16,17)18/h10-13,20H,2-9H2,1H3/t10-,11+,12+,13-/m1/s1	NGKDTDLAKVOKMV-MROQNXINSA-N	355.160657478							97553
BRD-K43283393	LSM-11061		54658064	InChI=1S/C25H37FN2O4/c26-20-8-6-18(7-9-20)13-27-25(30)12-22-10-11-23-24(32-22)17-31-16-21(29)15-28(23)14-19-4-2-1-3-5-19/h6-9,19,21-24,29H,1-5,10-17H2,(H,27,30)/t21-,22+,23-,24+/m0/s1	CEWCLCSAKAWIOS-UARRHKHWSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(CC4CCCCC4)C1	BroadT	BRD-K43283393	BRD-K43283393-001-01-9	Broad Institute of MIT and Harvard	BRD-K43283393			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(F)cc3)CC[C@@H]2N(CC2CCCCC2)C1	InChI=1S/C25H37FN2O4/c26-20-8-6-18(7-9-20)13-27-25(30)12-22-10-11-23-24(32-22)17-31-16-21(29)15-28(23)14-19-4-2-1-3-5-19/h6-9,19,21-24,29H,1-5,10-17H2,(H,27,30)/t21-,22+,23-,24+/m0/s1	CEWCLCSAKAWIOS-UARRHKHWSA-N	448.273735884							99682
CHEMBL2136166	LSM-11439	BRD-K49525301, SID131454340	54657894	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23-,24-,25+/m1/s1	HZAABOSBDYXUMN-HVHOJJEHSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K49525301	BRD-K49525301-001-01-8	Broad Institute of MIT and Harvard	BRD-K49525301			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(Oc4ccccc4)cc3)CC[C@H]2N(CCC(F)(F)F)C1	InChI=1S/C27H33F3N2O5/c28-27(29,30)12-13-32-16-20(33)17-35-18-25-24(32)11-10-23(37-25)14-26(34)31-15-19-6-8-22(9-7-19)36-21-4-2-1-3-5-21/h1-9,20,23-25,33H,10-18H2,(H,31,34)/t20-,23-,24-,25+/m1/s1	HZAABOSBDYXUMN-HVHOJJEHSA-N	522.234156776							100060
BRD-K83600073	LSM-13541		54657930	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17+,20+,21-/m1/s1	JLPSQBARJGYMKN-SQBLYHGDSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3C(=O)c4ccccc4F)O2	BroadT	BRD-K83600073	BRD-K83600073-001-01-2	Broad Institute of MIT and Harvard	BRD-K83600073			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c2ccccc2F)O1	InChI=1S/C23H32FN3O5/c1-25-8-10-26(11-9-25)22(29)12-17-6-7-20-21(32-17)15-31-14-16(28)13-27(20)23(30)18-4-2-3-5-19(18)24/h2-5,16-17,20-21,28H,6-15H2,1H3/t16-,17+,20+,21-/m1/s1	JLPSQBARJGYMKN-SQBLYHGDSA-N	449.232599354							102183
BRD-K36424197	LSM-10627		54657856	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25-,27+,28-/m0/s1	IXXIZSABFJAVRH-MHSKHUKVSA-N	COc1ccc(cc1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@@H]23	BroadT	BRD-K36424197	BRD-K36424197-001-01-6	Broad Institute of MIT and Harvard	BRD-K36424197			COc1ccc(cc1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC[C@@H]12	InChI=1S/C29H39N3O7S/c1-37-24-7-10-26(11-8-24)40(35,36)32-18-23(33)19-38-20-28-27(32)12-9-25(39-28)15-29(34)30-22-13-14-31(17-22)16-21-5-3-2-4-6-21/h2-8,10-11,22-23,25,27-28,33H,9,12-20H2,1H3,(H,30,34)/t22-,23-,25-,27+,28-/m0/s1	IXXIZSABFJAVRH-MHSKHUKVSA-N	573.250871308							99248
MLS003650140	LSM-10549	BRD-K35243934	53382789	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14-,15-,17+/m1/s1	WAKYUTRBASZCGN-ANQUJSFKSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c3ccccc3OC)O1	BroadT	BRD-K35243934	BRD-K35243934-001-01-9	Broad Institute of MIT and Harvard	BRD-K35243934			COC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c2ccccc2OC)O1	InChI=1S/C19H27NO8S/c1-25-16-5-3-4-6-18(16)29(23,24)20-10-13(21)11-27-12-17-15(20)8-7-14(28-17)9-19(22)26-2/h3-6,13-15,17,21H,7-12H2,1-2H3/t13-,14-,15-,17+/m1/s1	WAKYUTRBASZCGN-ANQUJSFKSA-N	429.145737524							99170
BRD-K02217114	LSM-8569		54658002	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18+,19+,20-/m0/s1	NCINSYYDRJCYKJ-NMLBUPMWSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CC3)CC[C@H]2N(CC4CCOCC4)C1	BroadT	BRD-K02217114	BRD-K02217114-001-01-4	Broad Institute of MIT and Harvard	BRD-K02217114			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CC3)CC[C@H]2N(CC2CCOCC2)C1	InChI=1S/C21H36N2O5/c24-17-12-23(11-16-5-7-26-8-6-16)19-4-3-18(28-20(19)14-27-13-17)9-21(25)22-10-15-1-2-15/h15-20,24H,1-14H2,(H,22,25)/t17-,18+,19+,20-/m0/s1	NCINSYYDRJCYKJ-NMLBUPMWSA-N	396.262422272							97190
BRD-K38052671	LSM-10733		54654524	InChI=1S/C24H25FN2O6/c1-27-19-9-8-15(12-22(28)31-2)33-21(19)13-32-20-10-7-14(11-17(20)24(27)30)26-23(29)16-5-3-4-6-18(16)25/h3-7,10-11,15,19,21H,8-9,12-13H2,1-2H3,(H,26,29)/t15-,19-,21+/m0/s1	QVBIDJFZXMTPPC-PAXLWEDBSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4ccccc4F)cc3C(=O)N2C)O1	BroadT	BRD-K38052671	BRD-K38052671-001-01-8	Broad Institute of MIT and Harvard	BRD-K38052671			COC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4ccccc4F)cc3C(=O)N2C)O1	InChI=1S/C24H25FN2O6/c1-27-19-9-8-15(12-22(28)31-2)33-21(19)13-32-20-10-7-14(11-17(20)24(27)30)26-23(29)16-5-3-4-6-18(16)25/h3-7,10-11,15,19,21H,8-9,12-13H2,1-2H3,(H,26,29)/t15-,19-,21+/m0/s1	QVBIDJFZXMTPPC-PAXLWEDBSA-N	456.16966474							99354
BRD-K16775575	LSM-9442		54654425	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25+,27+/m1/s1	IJWLFSVDDGQQHF-USUFHLAHSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K16775575	BRD-K16775575-001-01-7	Broad Institute of MIT and Harvard	BRD-K16775575			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25+,27+/m1/s1	IJWLFSVDDGQQHF-USUFHLAHSA-N	570.251205666							98063
BRD-K94557542	LSM-14223		54654481	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18+,20+/m0/s1	HJRBVKTVNLVVPO-ILZDJORESA-N	CN1[C@@H]2CC[C@@H](CC(=O)O)O[C@@H]2COc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K94557542	BRD-K94557542-001-01-4	Broad Institute of MIT and Harvard	BRD-K94557542			CN1[C@@H]2CC[C@@H](CC(O)=O)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18+,20+/m0/s1	HJRBVKTVNLVVPO-ILZDJORESA-N	439.17433555							102877
BRD-K97251260	LSM-14405		54654500	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22-,24+/m1/s1	KFDLRFOLOVMTJG-CKUXNOBLSA-N	CN1[C@@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K97251260	BRD-K97251260-001-01-1	Broad Institute of MIT and Harvard	BRD-K97251260			CN1[C@@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22-,24+/m1/s1	KFDLRFOLOVMTJG-CKUXNOBLSA-N	525.25873389							103059
BRD-K85205404	LSM-13637		54654455	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19-,21+/m0/s1	KEGRQPVLAXHQPZ-PAXLWEDBSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc3ccc(NC(=O)c4ccccc4Cl)cc3C1=O	BroadT	BRD-K85205404	BRD-K85205404-001-01-8	Broad Institute of MIT and Harvard	BRD-K85205404			CN1[C@H]2CC[C@@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc2ccc(NC(=O)c3ccccc3Cl)cc2C1=O	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19-,21+/m0/s1	KEGRQPVLAXHQPZ-PAXLWEDBSA-N	539.14348324							102284
BRD-K34466966	LSM-10511		54654409	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24+,26+/m0/s1	XUZKWORPTAYLRR-GGBSJPMNSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K34466966	BRD-K34466966-001-01-8	Broad Institute of MIT and Harvard	BRD-K34466966			CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24+,26+/m0/s1	XUZKWORPTAYLRR-GGBSJPMNSA-N	536.263484912							99132
BRD-K88282487	LSM-13853		54654598	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,27-/m1/s1	JZWHDUCFLDKMHA-MRCUYLHHSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc5ccc(NC(=O)C6CCOCC6)cc5C1=O	BroadT	BRD-K88282487	BRD-K88282487-001-02-2	Broad Institute of MIT and Harvard	BRD-K88282487			CN1[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,27-/m1/s1	JZWHDUCFLDKMHA-MRCUYLHHSA-N	565.24241511							102504
BRD-K86086755	LSM-13700		54654511	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19+,21-/m1/s1	VOOHCFNIWPJMMM-SLYNCCJLSA-N	CN1[C@H]2CC[C@H](CC(=O)NC3CCCCC3)O[C@@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K86086755	BRD-K86086755-001-02-4	Broad Institute of MIT and Harvard	BRD-K86086755			CN1[C@H]2CC[C@H](CC(=O)NC3CCCCC3)O[C@@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19+,21-/m1/s1	VOOHCFNIWPJMMM-SLYNCCJLSA-N	479.209006496							102348
BRD-K68166950	LSM-12582		54654436	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28-,30+/m1/s1	YIAMBQQGWRAZTQ-ZQTJCAEQSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K68166950	BRD-K68166950-001-01-1	Broad Institute of MIT and Harvard	BRD-K68166950			CN1[C@@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28-,30+/m1/s1	YIAMBQQGWRAZTQ-ZQTJCAEQSA-N	602.256291046							101213
BRD-K09059658	LSM-8978		54654501	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22+,24-/m0/s1	KFDLRFOLOVMTJG-KWOQKUFVSA-N	CN1[C@@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K09059658	BRD-K09059658-001-01-5	Broad Institute of MIT and Harvard	BRD-K09059658			CN1[C@@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22+,24-/m0/s1	KFDLRFOLOVMTJG-KWOQKUFVSA-N	525.25873389							97599
BRD-K83757561	LSM-13550		54654606	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24+,26-/m1/s1	OJLJDVMGKDSXAU-LJGDZFJRSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K83757561	BRD-K83757561-001-02-7	Broad Institute of MIT and Harvard	BRD-K83757561			CN1[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24+,26-/m1/s1	OJLJDVMGKDSXAU-LJGDZFJRSA-N	548.209340854							102192
BRD-K58649267	LSM-11969		54654489	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23+,25-/m0/s1	VDMGESCZGFUZFC-PWWKTKHKSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)cc3)O[C@H]2COc4ccc(NC(=O)Nc5c(C)onc5C)cc4C1=O	BroadT	BRD-K58649267	BRD-K58649267-001-01-6	Broad Institute of MIT and Harvard	BRD-K58649267			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)cc3)O[C@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23+,25-/m0/s1	VDMGESCZGFUZFC-PWWKTKHKSA-N	581.204111504							100595
BRD-K35440818	LSM-10554		54654575	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17+,19-/m1/s1	VPEDYPFQYJVQKE-HHXXYDBFSA-N	CN1[C@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K35440818	BRD-K35440818-001-01-2	Broad Institute of MIT and Harvard	BRD-K35440818			CN1[C@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17+,19-/m1/s1	VPEDYPFQYJVQKE-HHXXYDBFSA-N	467.172620988							99175
BRD-K25277218	LSM-9965		54654394	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17+,19-/m0/s1	RVSYYJUWHXUHRD-WDYCEAGBSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCCOC)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K25277218	BRD-K25277218-001-01-6	Broad Institute of MIT and Harvard	BRD-K25277218			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCCOC)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17+,19-/m0/s1	RVSYYJUWHXUHRD-WDYCEAGBSA-N	469.188271052							98586
BRD-K73680494	LSM-12944		54654443	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18-,20+/m1/s1	QTFAPORQFWHYLC-ZTNFWEORSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	BroadT	BRD-K73680494	BRD-K73680494-001-01-7	Broad Institute of MIT and Harvard	BRD-K73680494			COC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18-,20+/m1/s1	QTFAPORQFWHYLC-ZTNFWEORSA-N	508.10709956							101581
BRD-K34106732	LSM-10490		54654427	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25+,27-/m1/s1	IJWLFSVDDGQQHF-MRWFPNEWSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K34106732	BRD-K34106732-001-02-1	Broad Institute of MIT and Harvard	BRD-K34106732			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25+,27-/m1/s1	IJWLFSVDDGQQHF-MRWFPNEWSA-N	570.251205666							99111
BRD-K63337793	LSM-12282		54654395	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17+,19+/m0/s1	RVSYYJUWHXUHRD-KVSKMBFKSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCCOC)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K63337793	BRD-K63337793-001-01-4	Broad Institute of MIT and Harvard	BRD-K63337793			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCCOC)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17+,19+/m0/s1	RVSYYJUWHXUHRD-KVSKMBFKSA-N	469.188271052							100908
BRD-K25991217	LSM-10003		54654605	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24+,26+/m1/s1	OJLJDVMGKDSXAU-DSBYRVASSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K25991217	BRD-K25991217-001-01-3	Broad Institute of MIT and Harvard	BRD-K25991217			CN1[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24+,26+/m1/s1	OJLJDVMGKDSXAU-DSBYRVASSA-N	548.209340854							98624
BRD-K05025838	LSM-8732		54654583	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28+/m0/s1	ADKYEMYUARXISC-GYGTVUFYSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@H]4O[C@H](CC(=O)NCCCN5CCOCC5)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K05025838	BRD-K05025838-001-01-3	Broad Institute of MIT and Harvard	BRD-K05025838			COc1cccc(c1)C(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCCCN4CCOCC4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28+/m0/s1	ADKYEMYUARXISC-GYGTVUFYSA-N	580.28969966							97353
BRD-K42626894	LSM-11015		54654421	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23+,25-,27-/m1/s1	IJWLFSVDDGQQHF-VJPXLHPWSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K42626894	BRD-K42626894-001-01-4	Broad Institute of MIT and Harvard	BRD-K42626894			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23+,25-,27-/m1/s1	IJWLFSVDDGQQHF-VJPXLHPWSA-N	570.251205666							99636
CHEMBL3188244	LSM-12857	BRD-K72267874	54654354	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19+,21-/m0/s1	PZXWXIAUASIELU-DSKINZAPSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	BroadT	BRD-K72267874	BRD-K72267874-001-01-4	Broad Institute of MIT and Harvard	BRD-K72267874			COC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19+,21-/m0/s1	PZXWXIAUASIELU-DSKINZAPSA-N	472.14011425							101494
BRD-K12678780	LSM-9181		54654412	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24-,26-/m0/s1	XUZKWORPTAYLRR-GVUKDKGQSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K12678780	BRD-K12678780-001-01-8	Broad Institute of MIT and Harvard	BRD-K12678780			CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24-,26-/m0/s1	XUZKWORPTAYLRR-GVUKDKGQSA-N	536.263484912							97802
BRD-K02750843	LSM-8608		54654399	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23-,25+/m1/s1	IGRBOWQNYYEHHT-PFATUAPWSA-N	COc1ccc(cc1)C(=O)Nc2ccc3OC[C@@H]4O[C@@H](CC(=O)NCC5CC5)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K02750843	BRD-K02750843-001-01-2	Broad Institute of MIT and Harvard	BRD-K02750843			COc1ccc(cc1)C(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCC4CC4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23-,25+/m1/s1	IGRBOWQNYYEHHT-PFATUAPWSA-N	507.236935806							97229
BRD-K94373667	LSM-14214		54654397	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23-,25+/m0/s1	IGRBOWQNYYEHHT-UMXIMWEHSA-N	COc1ccc(cc1)C(=O)Nc2ccc3OC[C@H]4O[C@H](CC(=O)NCC5CC5)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K94373667	BRD-K94373667-001-01-5	Broad Institute of MIT and Harvard	BRD-K94373667			COc1ccc(cc1)C(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCC4CC4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23-,25+/m0/s1	IGRBOWQNYYEHHT-UMXIMWEHSA-N	507.236935806							102868
BRD-K96663038	LSM-14365		54654342	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27-,29+/m1/s1	UEIQSFPBDLFQGU-NLFWHDTNSA-N	COc1cccc(NC(=O)Nc2ccc3OC[C@@H]4O[C@@H](CC(=O)NCCc5ccccc5)CC[C@H]4N(C)C(=O)c3c2)c1	BroadT	BRD-K96663038	BRD-K96663038-001-01-9	Broad Institute of MIT and Harvard	BRD-K96663038			COc1cccc(NC(=O)Nc2ccc3OC[C@@H]4O[C@@H](CC(=O)NCCc5ccccc5)CC[C@H]4N(C)C(=O)c3c2)c1	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27-,29+/m1/s1	UEIQSFPBDLFQGU-NLFWHDTNSA-N	572.263484912							103019
BRD-K79917113	LSM-13304		54654457	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26+,28+/m0/s1	IPBHQWGLWRAHKP-DKRHUIDYSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@@H]2COc5ccc(NS(=O)(=O)C)cc5C1=O	BroadT	BRD-K79917113	BRD-K79917113-001-01-8	Broad Institute of MIT and Harvard	BRD-K79917113			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26+,28+/m0/s1	IPBHQWGLWRAHKP-DKRHUIDYSA-N	563.209006496							101943
BRD-K36159233	LSM-10612		54654315	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22+,24-/m0/s1	YBRLGVDHYMUGPQ-ZUAOHOGDSA-N	CCNC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K36159233	BRD-K36159233-001-01-4	Broad Institute of MIT and Harvard	BRD-K36159233			CCNC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22+,24-/m0/s1	YBRLGVDHYMUGPQ-ZUAOHOGDSA-N	494.252920228							99233
BRD-K26350615	LSM-10026		54654380	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22+,24+/m0/s1	CMDXATVLXHEPLP-BGWNEDDSSA-N	CC(C)NC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCc4ccc(F)cc4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K26350615	BRD-K26350615-001-01-9	Broad Institute of MIT and Harvard	BRD-K26350615			CC(C)NC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCc4ccc(F)cc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22+,24+/m0/s1	CMDXATVLXHEPLP-BGWNEDDSSA-N	512.243498396							98647
BRD-K43225681	LSM-11057		54654593	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23-,27+/m1/s1	JZWHDUCFLDKMHA-CIXCFARBSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc5ccc(NC(=O)C6CCOCC6)cc5C1=O	BroadT	BRD-K43225681	BRD-K43225681-001-01-1	Broad Institute of MIT and Harvard	BRD-K43225681			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23-,27+/m1/s1	JZWHDUCFLDKMHA-CIXCFARBSA-N	565.24241511							99678
BRD-K98403755	LSM-14475		54654371	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22-,24-/m0/s1	HKYXYLDUIXPRSO-SSPYTLHUSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2	BroadT	BRD-K98403755	BRD-K98403755-001-01-9	Broad Institute of MIT and Harvard	BRD-K98403755			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)C4CCOCC4)cc3C(=O)N2C)O1	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22-,24-/m0/s1	HKYXYLDUIXPRSO-SSPYTLHUSA-N	514.279134976							103130
BRD-K36138091	LSM-10608		54654414	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23+,25+,27+/m0/s1	IJWLFSVDDGQQHF-CXQACEEJSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K36138091	BRD-K36138091-001-01-9	Broad Institute of MIT and Harvard	BRD-K36138091			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23+,25+,27+/m0/s1	IJWLFSVDDGQQHF-CXQACEEJSA-N	570.251205666							99229
BRD-K69951274	LSM-12698		54654385	InChI=1S/C26H29F3N4O5/c1-15-3-5-16(6-4-15)31-25(36)32-17-7-10-21-19(11-17)24(35)33(2)20-9-8-18(38-22(20)13-37-21)12-23(34)30-14-26(27,28)29/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,30,34)(H2,31,32,36)/t18-,20-,22-/m1/s1	PPTVZYJXLGYDRY-SYYKKAFVSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc3ccc(NC(=O)Nc4ccc(C)cc4)cc3C1=O	BroadT	BRD-K69951274	BRD-K69951274-001-01-4	Broad Institute of MIT and Harvard	BRD-K69951274			CN1[C@@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc2ccc(NC(=O)Nc3ccc(C)cc3)cc2C1=O	InChI=1S/C26H29F3N4O5/c1-15-3-5-16(6-4-15)31-25(36)32-17-7-10-21-19(11-17)24(35)33(2)20-9-8-18(38-22(20)13-37-21)12-23(34)30-14-26(27,28)29/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,30,34)(H2,31,32,36)/t18-,20-,22-/m1/s1	PPTVZYJXLGYDRY-SYYKKAFVSA-N	534.209004668							131212
BRD-K42361978	LSM-10995		54654601	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24-,26-/m1/s1	OJLJDVMGKDSXAU-YMVVMYQSSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K42361978	BRD-K42361978-001-01-7	Broad Institute of MIT and Harvard	BRD-K42361978			CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24-,26-/m1/s1	OJLJDVMGKDSXAU-YMVVMYQSSA-N	548.209340854							99616
BRD-K80193146	LSM-13324		54654532	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18-,20+/m0/s1	MPULVBUDJGIXBK-XKGZKEIXSA-N	CN1[C@H]2CC[C@@H](CC(=O)O)O[C@@H]2COc3ccc(NC(=O)c4cccc(c4)C(F)(F)F)cc3C1=O	BroadT	BRD-K80193146	BRD-K80193146-001-01-4	Broad Institute of MIT and Harvard	BRD-K80193146			CN1[C@H]2CC[C@@H](CC(O)=O)O[C@@H]2COc2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2C1=O	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18-,20+/m0/s1	MPULVBUDJGIXBK-XKGZKEIXSA-N	492.150821076							101963
BRD-K76765843	LSM-13128		54654559	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18-,20+/m0/s1	VIAXYKVUXVILCJ-ZAAXVRCTSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	BroadT	BRD-K76765843	BRD-K76765843-001-01-1	Broad Institute of MIT and Harvard	BRD-K76765843			COC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18-,20+/m0/s1	VIAXYKVUXVILCJ-ZAAXVRCTSA-N	458.151157262							101766
BRD-K30794866	LSM-10284		54654597	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,27-/m0/s1	JZWHDUCFLDKMHA-AIUHUKMKSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc5ccc(NC(=O)C6CCOCC6)cc5C1=O	BroadT	BRD-K30794866	BRD-K30794866-001-01-8	Broad Institute of MIT and Harvard	BRD-K30794866			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,27-/m0/s1	JZWHDUCFLDKMHA-AIUHUKMKSA-N	565.24241511							98905
BRD-K07125273	LSM-8848		54654560	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18-,20-/m0/s1	VIAXYKVUXVILCJ-QSFXBCCZSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	BroadT	BRD-K07125273	BRD-K07125273-001-01-1	Broad Institute of MIT and Harvard	BRD-K07125273			COC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18-,20-/m0/s1	VIAXYKVUXVILCJ-QSFXBCCZSA-N	458.151157262							97469
BRD-K50974880	LSM-11538		54654389	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17-,19-/m0/s1	RVSYYJUWHXUHRD-IEZWGBDMSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCCOC)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K50974880	BRD-K50974880-001-01-3	Broad Institute of MIT and Harvard	BRD-K50974880			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCCOC)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17-,19-/m0/s1	RVSYYJUWHXUHRD-IEZWGBDMSA-N	469.188271052							100161
BRD-K48076585	LSM-11357		54654423	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23+,25+,27-/m1/s1	IJWLFSVDDGQQHF-LNIWHUFPSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K48076585	BRD-K48076585-001-01-0	Broad Institute of MIT and Harvard	BRD-K48076585			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23+,25+,27-/m1/s1	IJWLFSVDDGQQHF-LNIWHUFPSA-N	570.251205666							99978
BRD-K55437057	LSM-11789		54654493	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23+,25+/m1/s1	VDMGESCZGFUZFC-VTZPFEBOSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(Cl)cc3)O[C@H]2COc4ccc(NC(=O)Nc5c(C)onc5C)cc4C1=O	BroadT	BRD-K55437057	BRD-K55437057-001-01-3	Broad Institute of MIT and Harvard	BRD-K55437057			CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(Cl)cc3)O[C@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23+,25+/m1/s1	VDMGESCZGFUZFC-VTZPFEBOSA-N	581.204111504							100414
BRD-K01245760	LSM-8509		54654450	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19-,21-/m1/s1	KEGRQPVLAXHQPZ-QFIXIFRTSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc3ccc(NC(=O)c4ccccc4Cl)cc3C1=O	BroadT	BRD-K01245760	BRD-K01245760-001-01-3	Broad Institute of MIT and Harvard	BRD-K01245760			CN1[C@@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc2ccc(NC(=O)c3ccccc3Cl)cc2C1=O	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19-,21-/m1/s1	KEGRQPVLAXHQPZ-QFIXIFRTSA-N	539.14348324							97130
BRD-K00422823	LSM-8453		54654350	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19-,21-/m0/s1	PZXWXIAUASIELU-CUWPLCDZSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	BroadT	BRD-K00422823	BRD-K00422823-001-01-4	Broad Institute of MIT and Harvard	BRD-K00422823			COC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19-,21-/m0/s1	PZXWXIAUASIELU-CUWPLCDZSA-N	472.14011425							97074
BRD-K98123586	LSM-14461		54654592	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,27+/m1/s1	JZWHDUCFLDKMHA-ZYVVXELTSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc5ccc(NC(=O)C6CCOCC6)cc5C1=O	BroadT	BRD-K98123586	BRD-K98123586-001-01-8	Broad Institute of MIT and Harvard	BRD-K98123586			CN1[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,27+/m1/s1	JZWHDUCFLDKMHA-ZYVVXELTSA-N	565.24241511							103116
BRD-K57696989	LSM-11921		54654570	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17-,19-/m0/s1	VPEDYPFQYJVQKE-IEZWGBDMSA-N	CN1[C@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K57696989	BRD-K57696989-001-01-5	Broad Institute of MIT and Harvard	BRD-K57696989			CN1[C@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17-,19-/m0/s1	VPEDYPFQYJVQKE-IEZWGBDMSA-N	467.172620988							100547
BRD-K18401446	LSM-9537		54654376	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22-,24+/m0/s1	CMDXATVLXHEPLP-ODGPQVTHSA-N	CC(C)NC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCc4ccc(F)cc4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K18401446	BRD-K18401446-001-01-5	Broad Institute of MIT and Harvard	BRD-K18401446			CC(C)NC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCc4ccc(F)cc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22-,24+/m0/s1	CMDXATVLXHEPLP-ODGPQVTHSA-N	512.243498396							98158
BRD-K35637774	LSM-10567		54654494	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23-,25+/m0/s1	VDMGESCZGFUZFC-UMXIMWEHSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)cc3)O[C@@H]2COc4ccc(NC(=O)Nc5c(C)onc5C)cc4C1=O	BroadT	BRD-K35637774	BRD-K35637774-001-01-5	Broad Institute of MIT and Harvard	BRD-K35637774			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)cc3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23-,25+/m0/s1	VDMGESCZGFUZFC-UMXIMWEHSA-N	581.204111504							99188
BRD-K39613698	LSM-10834		54654567	InChI=1S/C33H37N3O6/c1-20(2)21-8-7-9-22(16-21)34-31(37)18-24-13-14-27-30(42-24)19-41-29-15-12-23(17-26(29)33(39)36(27)3)35-32(38)25-10-5-6-11-28(25)40-4/h5-12,15-17,20,24,27,30H,13-14,18-19H2,1-4H3,(H,34,37)(H,35,38)/t24-,27+,30-/m1/s1	CZPFECWBXJGFTP-PZZFJYTRSA-N	COc1ccccc1C(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)Nc5cccc(c5)C(C)C)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K39613698	BRD-K39613698-001-02-3	Broad Institute of MIT and Harvard	BRD-K39613698			COc1ccccc1C(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4cccc(c4)C(C)C)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C33H37N3O6/c1-20(2)21-8-7-9-22(16-21)34-31(37)18-24-13-14-27-30(42-24)19-41-29-15-12-23(17-26(29)33(39)36(27)3)35-32(38)25-10-5-6-11-28(25)40-4/h5-12,15-17,20,24,27,30H,13-14,18-19H2,1-4H3,(H,34,37)(H,35,38)/t24-,27+,30-/m1/s1	CZPFECWBXJGFTP-PZZFJYTRSA-N	571.268235934							99455
BRD-K47812430	LSM-11339		54654440	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28+,30+/m1/s1	YIAMBQQGWRAZTQ-WVWXGCDFSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K47812430	BRD-K47812430-001-01-6	Broad Institute of MIT and Harvard	BRD-K47812430			CN1[C@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28+,30+/m1/s1	YIAMBQQGWRAZTQ-WVWXGCDFSA-N	602.256291046							99960
BRD-K88842895	LSM-13888		54654468	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21+,23+/m1/s1	MAZJZTZSELFTOO-JZWVFAODSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCc4ccccc4F)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K88842895	BRD-K88842895-001-01-1	Broad Institute of MIT and Harvard	BRD-K88842895			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCc4ccccc4F)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21+,23+/m1/s1	MAZJZTZSELFTOO-JZWVFAODSA-N	519.1839346							102541
BRD-K12405591	LSM-9167		54654464	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21+,23-/m0/s1	MAZJZTZSELFTOO-ZEYPLWLESA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCc4ccccc4F)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K12405591	BRD-K12405591-001-01-5	Broad Institute of MIT and Harvard	BRD-K12405591			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCc4ccccc4F)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21+,23-/m0/s1	MAZJZTZSELFTOO-ZEYPLWLESA-N	519.1839346							97788
BRD-K03716420	LSM-8660		54654520	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24+,26+/m0/s1	JZXYXAGICCVVHG-GGBSJPMNSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K03716420	BRD-K03716420-001-01-3	Broad Institute of MIT and Harvard	BRD-K03716420			CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24+,26+/m0/s1	JZXYXAGICCVVHG-GGBSJPMNSA-N	527.299536062							97281
BRD-K09503339	LSM-9005		54654574	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17-,19+/m1/s1	VPEDYPFQYJVQKE-SUMDDJOVSA-N	CN1[C@@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K09503339	BRD-K09503339-001-01-9	Broad Institute of MIT and Harvard	BRD-K09503339			CN1[C@@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17-,19+/m1/s1	VPEDYPFQYJVQKE-SUMDDJOVSA-N	467.172620988							97626
BRD-K28117690	LSM-10134		54654308	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22+,24+/m1/s1	YBRLGVDHYMUGPQ-OITMPTDNSA-N	CCNC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K28117690	BRD-K28117690-001-01-8	Broad Institute of MIT and Harvard	BRD-K28117690			CCNC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22+,24+/m1/s1	YBRLGVDHYMUGPQ-OITMPTDNSA-N	494.252920228							98755
BRD-K51579715	LSM-11582		54654322	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21-,23+/m0/s1	ANPNCKARMDTJMY-IEIRFRATSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	BroadT	BRD-K51579715	BRD-K51579715-001-01-0	Broad Institute of MIT and Harvard	BRD-K51579715			COC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21-,23+/m0/s1	ANPNCKARMDTJMY-IEIRFRATSA-N	481.221285742							100205
BRD-K41660807	LSM-10959		54654442	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28+,30-/m1/s1	YIAMBQQGWRAZTQ-YPMKZHJPSA-N	CN1[C@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K41660807	BRD-K41660807-001-02-8	Broad Institute of MIT and Harvard	BRD-K41660807			CN1[C@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28+,30-/m1/s1	YIAMBQQGWRAZTQ-YPMKZHJPSA-N	602.256291046							99580
CHEMBL2362432	LSM-8497	BRD-K00967758, SID131450748	54654319	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21-,23-/m0/s1	ANPNCKARMDTJMY-RRPUWOKSSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	BroadT	BRD-K00967758	BRD-K00967758-001-01-7	Broad Institute of MIT and Harvard	BRD-K00967758			COC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21-,23-/m0/s1	ANPNCKARMDTJMY-RRPUWOKSSA-N	481.221285742							97118
BRD-K66142238	LSM-12461		54654580	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25+,28+/m1/s1	PQVOHAVDCPBJEV-ATILKMQGSA-N	COc1ccccc1C(=O)Nc2ccc3OC[C@@H]4O[C@@H](CC(=O)NCCc5ccncc5)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K66142238	BRD-K66142238-001-01-8	Broad Institute of MIT and Harvard	BRD-K66142238			COc1ccccc1C(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCCc4ccncc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25+,28+/m1/s1	PQVOHAVDCPBJEV-ATILKMQGSA-N	558.247834848							101091
BRD-K14357170	LSM-9296		54654333	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29-,31-/m1/s1	UWMJOJNRDSZDAZ-ZJSFRRNISA-N	CN1[C@@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K14357170	BRD-K14357170-001-01-5	Broad Institute of MIT and Harvard	BRD-K14357170			CN1[C@@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29-,31-/m1/s1	UWMJOJNRDSZDAZ-ZJSFRRNISA-N	618.265376692							97917
BRD-K16939073	LSM-9452		54654539	InChI=1S/C28H35N5O5/c1-33-23-9-8-20(14-26(34)31-15-18-5-3-2-4-6-18)38-25(23)17-37-24-10-7-19(13-21(24)28(33)36)32-27(35)22-16-29-11-12-30-22/h7,10-13,16,18,20,23,25H,2-6,8-9,14-15,17H2,1H3,(H,31,34)(H,32,35)/t20-,23-,25+/m0/s1	KUAQBUHJEIVZQC-GRYUFTJMSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cnccn5)cc4C1=O	BroadT	BRD-K16939073	BRD-K16939073-001-01-6	Broad Institute of MIT and Harvard	BRD-K16939073			CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cnccn3)cc2C1=O	InChI=1S/C28H35N5O5/c1-33-23-9-8-20(14-26(34)31-15-18-5-3-2-4-6-18)38-25(23)17-37-24-10-7-19(13-21(24)28(33)36)32-27(35)22-16-29-11-12-30-22/h7,10-13,16,18,20,23,25H,2-6,8-9,14-15,17H2,1H3,(H,31,34)(H,32,35)/t20-,23-,25+/m0/s1	KUAQBUHJEIVZQC-GRYUFTJMSA-N	521.26381927							98073
BRD-K85237791	LSM-13640		54654387	InChI=1S/C26H29F3N4O5/c1-15-3-5-16(6-4-15)31-25(36)32-17-7-10-21-19(11-17)24(35)33(2)20-9-8-18(38-22(20)13-37-21)12-23(34)30-14-26(27,28)29/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,30,34)(H2,31,32,36)/t18-,20+,22+/m0/s1	PPTVZYJXLGYDRY-CZTZKLFOSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc3ccc(NC(=O)Nc4ccc(C)cc4)cc3C1=O	BroadT	BRD-K85237791	BRD-K85237791-001-01-2	Broad Institute of MIT and Harvard	BRD-K85237791			CN1[C@@H]2CC[C@@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc2ccc(NC(=O)Nc3ccc(C)cc3)cc2C1=O	InChI=1S/C26H29F3N4O5/c1-15-3-5-16(6-4-15)31-25(36)32-17-7-10-21-19(11-17)24(35)33(2)20-9-8-18(38-22(20)13-37-21)12-23(34)30-14-26(27,28)29/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,30,34)(H2,31,32,36)/t18-,20+,22+/m0/s1	PPTVZYJXLGYDRY-CZTZKLFOSA-N	534.209004668							102287
BRD-K12980773	LSM-9201		54654607	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28+,30-/m0/s1	YIAMBQQGWRAZTQ-QFSTWRFZSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K12980773	BRD-K12980773-001-01-7	Broad Institute of MIT and Harvard	BRD-K12980773			CN1[C@@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28+,30-/m0/s1	YIAMBQQGWRAZTQ-QFSTWRFZSA-N	602.256291046							97822
BRD-K65824347	LSM-12442		54654364	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26+,28-/m1/s1	WCNQFBRPFNRKRV-RXWNPYQGSA-N	CN1[C@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc5ccc(NS(=O)(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K65824347	BRD-K65824347-001-02-8	Broad Institute of MIT and Harvard	BRD-K65824347			CN1[C@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26+,28-/m1/s1	WCNQFBRPFNRKRV-RXWNPYQGSA-N	593.199584664							101070
BRD-K72174974	LSM-12850		54654433	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28+,30-/m0/s1	YIAMBQQGWRAZTQ-SQBQITNPSA-N	CN1[C@@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K72174974	BRD-K72174974-001-01-1	Broad Institute of MIT and Harvard	BRD-K72174974			CN1[C@@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28+,30-/m0/s1	YIAMBQQGWRAZTQ-SQBQITNPSA-N	602.256291046							101487
BRD-K05833481	LSM-8772		54654309	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22-,24-/m0/s1	YBRLGVDHYMUGPQ-ZGNDKOQWSA-N	CCNC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K05833481	BRD-K05833481-001-01-0	Broad Institute of MIT and Harvard	BRD-K05833481			CCNC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22-,24-/m0/s1	YBRLGVDHYMUGPQ-ZGNDKOQWSA-N	494.252920228							97393
BRD-K95698191	LSM-14297		54654438	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28-,30-/m1/s1	YIAMBQQGWRAZTQ-MFTQKCFDSA-N	CN1[C@@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K95698191	BRD-K95698191-001-01-9	Broad Institute of MIT and Harvard	BRD-K95698191			CN1[C@@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28-,30-/m1/s1	YIAMBQQGWRAZTQ-MFTQKCFDSA-N	602.256291046							102951
BRD-K96543798-001-02-1	LSM-14350	BRD-K96543798	54654301	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27-/m1/s1	BSKZHQCAOYVBFU-NRRYGQPISA-N	CN1[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K96543798	BRD-K96543798-001-02-1	Broad Institute of MIT and Harvard	BRD-K96543798			CN1[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27-/m1/s1	BSKZHQCAOYVBFU-NRRYGQPISA-N	537.263899482							103004
BRD-K85906476	LSM-13692		54654355	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19-,21-/m1/s1	PZXWXIAUASIELU-YFVAEKQCSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	BroadT	BRD-K85906476	BRD-K85906476-001-01-4	Broad Institute of MIT and Harvard	BRD-K85906476			COC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19-,21-/m1/s1	PZXWXIAUASIELU-YFVAEKQCSA-N	472.14011425							102340
BRD-K35738777	LSM-10573		54654424	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23+,25-,27+/m1/s1	IJWLFSVDDGQQHF-JQHZVFBJSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K35738777	BRD-K35738777-001-01-8	Broad Institute of MIT and Harvard	BRD-K35738777			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23+,25-,27+/m1/s1	IJWLFSVDDGQQHF-JQHZVFBJSA-N	570.251205666							99194
BRD-K28582709	LSM-10159		54654585	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28+/m1/s1	ADKYEMYUARXISC-XDIPAPSNSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@@H]4O[C@@H](CC(=O)NCCCN5CCOCC5)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K28582709	BRD-K28582709-001-01-2	Broad Institute of MIT and Harvard	BRD-K28582709			COc1cccc(c1)C(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCCCN4CCOCC4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28+/m1/s1	ADKYEMYUARXISC-XDIPAPSNSA-N	580.28969966							98780
BRD-K00513921	LSM-8463		54654386	InChI=1S/C26H29F3N4O5/c1-15-3-5-16(6-4-15)31-25(36)32-17-7-10-21-19(11-17)24(35)33(2)20-9-8-18(38-22(20)13-37-21)12-23(34)30-14-26(27,28)29/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,30,34)(H2,31,32,36)/t18-,20+,22-/m0/s1	PPTVZYJXLGYDRY-DWLFOUALSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC(F)(F)F)O[C@H]2COc3ccc(NC(=O)Nc4ccc(C)cc4)cc3C1=O	BroadT	BRD-K00513921	BRD-K00513921-001-01-1	Broad Institute of MIT and Harvard	BRD-K00513921			CN1[C@@H]2CC[C@@H](CC(=O)NCC(F)(F)F)O[C@H]2COc2ccc(NC(=O)Nc3ccc(C)cc3)cc2C1=O	InChI=1S/C26H29F3N4O5/c1-15-3-5-16(6-4-15)31-25(36)32-17-7-10-21-19(11-17)24(35)33(2)20-9-8-18(38-22(20)13-37-21)12-23(34)30-14-26(27,28)29/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,30,34)(H2,31,32,36)/t18-,20+,22-/m0/s1	PPTVZYJXLGYDRY-DWLFOUALSA-N	534.209004668							97084
BRD-K33328711	LSM-10452		54654514	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24+,26-/m1/s1	JZXYXAGICCVVHG-KTIWRFAQSA-N	CN1[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K33328711	BRD-K33328711-001-01-9	Broad Institute of MIT and Harvard	BRD-K33328711			CN1[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24+,26-/m1/s1	JZXYXAGICCVVHG-KTIWRFAQSA-N	527.299536062							99073
BRD-K05722694	LSM-8766		54654359	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26-,28+/m0/s1	WCNQFBRPFNRKRV-PAUTXSKSSA-N	CN1[C@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc5ccc(NS(=O)(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K05722694	BRD-K05722694-001-01-8	Broad Institute of MIT and Harvard	BRD-K05722694			CN1[C@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26-,28+/m0/s1	WCNQFBRPFNRKRV-PAUTXSKSSA-N	593.199584664							97387
BRD-K81331655	LSM-13394		54654472	InChI=1S/C32H30N4O7/c1-36-25-9-8-23(14-30(37)34-16-20-4-10-27-28(12-20)42-18-41-27)43-29(25)17-40-26-11-7-22(13-24(26)32(36)39)35-31(38)21-5-2-19(15-33)3-6-21/h2-7,10-13,23,25,29H,8-9,14,16-18H2,1H3,(H,34,37)(H,35,38)/t23-,25+,29-/m1/s1	XHIYWAJDGXOPCH-OBZNHSRCSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc5ccc(NC(=O)c6ccc(cc6)C#N)cc5C1=O	BroadT	BRD-K81331655	BRD-K81331655-001-02-0	Broad Institute of MIT and Harvard	BRD-K81331655			CN1[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc2ccc(NC(=O)c3ccc(cc3)C#N)cc2C1=O	InChI=1S/C32H30N4O7/c1-36-25-9-8-23(14-30(37)34-16-20-4-10-27-28(12-20)42-18-41-27)43-29(25)17-40-26-11-7-22(13-24(26)32(36)39)35-31(38)21-5-2-19(15-33)3-6-21/h2-7,10-13,23,25,29H,8-9,14,16-18H2,1H3,(H,34,37)(H,35,38)/t23-,25+,29-/m1/s1	XHIYWAJDGXOPCH-OBZNHSRCSA-N	582.21144934							102034
BRD-K33616265	LSM-10466		54654343	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27-,29-/m0/s1	UEIQSFPBDLFQGU-RWPDHJIBSA-N	COc1cccc(NC(=O)Nc2ccc3OC[C@@H]4O[C@H](CC(=O)NCCc5ccccc5)CC[C@@H]4N(C)C(=O)c3c2)c1	BroadT	BRD-K33616265	BRD-K33616265-001-01-7	Broad Institute of MIT and Harvard	BRD-K33616265			COc1cccc(NC(=O)Nc2ccc3OC[C@@H]4O[C@H](CC(=O)NCCc5ccccc5)CC[C@@H]4N(C)C(=O)c3c2)c1	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27-,29-/m0/s1	UEIQSFPBDLFQGU-RWPDHJIBSA-N	572.263484912							99087
BRD-K71571889	LSM-12809		54654328	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29+,31-/m0/s1	UWMJOJNRDSZDAZ-BANSWPFGSA-N	CN1[C@@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K71571889	BRD-K71571889-001-01-3	Broad Institute of MIT and Harvard	BRD-K71571889			CN1[C@@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29+,31-/m0/s1	UWMJOJNRDSZDAZ-BANSWPFGSA-N	618.265376692							101446
BRD-K73522157	LSM-12934		54654471	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21+,23-/m1/s1	MAZJZTZSELFTOO-RZFNWQHOSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCc4ccccc4F)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K73522157	BRD-K73522157-001-02-7	Broad Institute of MIT and Harvard	BRD-K73522157			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCc4ccccc4F)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21+,23-/m1/s1	MAZJZTZSELFTOO-RZFNWQHOSA-N	519.1839346							101571
BRD-K10810699	LSM-9083		54654566	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18+,20-/m1/s1	VIAXYKVUXVILCJ-MOXGXCLJSA-N	COC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	BroadT	BRD-K10810699	BRD-K10810699-001-02-7	Broad Institute of MIT and Harvard	BRD-K10810699			COC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18+,20-/m1/s1	VIAXYKVUXVILCJ-MOXGXCLJSA-N	458.151157262							97704
BRD-K56731825	LSM-11857		54654552	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20-,22+/m0/s1	VIDGDBZXEWMIQL-RCZSKKKRSA-N	CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K56731825	BRD-K56731825-001-01-9	Broad Institute of MIT and Harvard	BRD-K56731825			CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20-,22+/m0/s1	VIDGDBZXEWMIQL-RCZSKKKRSA-N	469.201299226							100483
BRD-K56950192	LSM-11875		54654446	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18-,20+/m0/s1	QTFAPORQFWHYLC-ZAAXVRCTSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	BroadT	BRD-K56950192	BRD-K56950192-001-01-0	Broad Institute of MIT and Harvard	BRD-K56950192			COC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18-,20+/m0/s1	QTFAPORQFWHYLC-ZAAXVRCTSA-N	508.10709956							100501
BRD-K69014051	LSM-12641		54654530	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18+,20+/m0/s1	MPULVBUDJGIXBK-ILZDJORESA-N	CN1[C@@H]2CC[C@@H](CC(=O)O)O[C@@H]2COc3ccc(NC(=O)c4cccc(c4)C(F)(F)F)cc3C1=O	BroadT	BRD-K69014051	BRD-K69014051-001-01-0	Broad Institute of MIT and Harvard	BRD-K69014051			CN1[C@@H]2CC[C@@H](CC(O)=O)O[C@@H]2COc2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2C1=O	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18+,20+/m0/s1	MPULVBUDJGIXBK-ILZDJORESA-N	492.150821076							101274
BRD-K97337381	LSM-14409		54654462	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26-,28+/m0/s1	IPBHQWGLWRAHKP-GYGTVUFYSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@@H]2COc5ccc(NS(=O)(=O)C)cc5C1=O	BroadT	BRD-K97337381	BRD-K97337381-001-01-2	Broad Institute of MIT and Harvard	BRD-K97337381			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26-,28+/m0/s1	IPBHQWGLWRAHKP-GYGTVUFYSA-N	563.209006496							103063
BRD-K43266948	LSM-11059		54654363	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26+,28+/m1/s1	WCNQFBRPFNRKRV-KHGZIGHDSA-N	CN1[C@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc5ccc(NS(=O)(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K43266948	BRD-K43266948-001-01-4	Broad Institute of MIT and Harvard	BRD-K43266948			CN1[C@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc2ccc(NS(=O)(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26+,28+/m1/s1	WCNQFBRPFNRKRV-KHGZIGHDSA-N	593.199584664							99680
BRD-K33994902	LSM-10485		54654591	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23-,27+/m0/s1	JZWHDUCFLDKMHA-JEYPMZLKSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc5ccc(NC(=O)C6CCOCC6)cc5C1=O	BroadT	BRD-K33994902	BRD-K33994902-001-01-7	Broad Institute of MIT and Harvard	BRD-K33994902			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23-,27+/m0/s1	JZWHDUCFLDKMHA-JEYPMZLKSA-N	565.24241511							99106
BRD-K13807179	LSM-9264		54654589	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28-/m0/s1	ADKYEMYUARXISC-MPYJOUPCSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@@H]4O[C@H](CC(=O)NCCCN5CCOCC5)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K13807179	BRD-K13807179-001-01-1	Broad Institute of MIT and Harvard	BRD-K13807179			COc1cccc(c1)C(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCCCN4CCOCC4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28-/m0/s1	ADKYEMYUARXISC-MPYJOUPCSA-N	580.28969966							97885
BRD-K81826010	LSM-6854		54654538	InChI=1S/C28H35N5O5/c1-33-23-9-8-20(14-26(34)31-15-18-5-3-2-4-6-18)38-25(23)17-37-24-10-7-19(13-21(24)28(33)36)32-27(35)22-16-29-11-12-30-22/h7,10-13,16,18,20,23,25H,2-6,8-9,14-15,17H2,1H3,(H,31,34)(H,32,35)/t20-,23-,25-/m0/s1	KUAQBUHJEIVZQC-OPHFCASCSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cnccn5)cc4C1=O	BroadT	BRD-K81826010	BRD-K81826010-001-01-1	Broad Institute of MIT and Harvard	BRD-K81826010			CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cnccn3)cc2C1=O	InChI=1S/C28H35N5O5/c1-33-23-9-8-20(14-26(34)31-15-18-5-3-2-4-6-18)38-25(23)17-37-24-10-7-19(13-21(24)28(33)36)32-27(35)22-16-29-11-12-30-22/h7,10-13,16,18,20,23,25H,2-6,8-9,14-15,17H2,1H3,(H,31,34)(H,32,35)/t20-,23-,25-/m0/s1	KUAQBUHJEIVZQC-OPHFCASCSA-N	521.26381927							95475
BRD-K41014695	LSM-10924		54654547	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25-,27-/m1/s1	MRBZRZGKCPBOJB-FZBZCGEPSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc4ccc(NC(=O)Nc5ccccc5Cl)cc4C1=O	BroadT	BRD-K41014695	BRD-K41014695-001-01-5	Broad Institute of MIT and Harvard	BRD-K41014695			CN1[C@@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3Cl)cc2C1=O	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25-,27-/m1/s1	MRBZRZGKCPBOJB-FZBZCGEPSA-N	599.251061696							99545
BRD-K72199653	LSM-12851		54654503	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22+,24-/m1/s1	KFDLRFOLOVMTJG-WNOPAQSVSA-N	CN1[C@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K72199653	BRD-K72199653-001-02-4	Broad Institute of MIT and Harvard	BRD-K72199653			CN1[C@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22+,24-/m1/s1	KFDLRFOLOVMTJG-WNOPAQSVSA-N	525.25873389							101488
BRD-K56482508	LSM-11844		54654545	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25-,27+/m0/s1	MRBZRZGKCPBOJB-IDNYDCHQSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc4ccc(NC(=O)Nc5ccccc5Cl)cc4C1=O	BroadT	BRD-K56482508	BRD-K56482508-001-01-3	Broad Institute of MIT and Harvard	BRD-K56482508			CN1[C@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3Cl)cc2C1=O	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25-,27+/m0/s1	MRBZRZGKCPBOJB-IDNYDCHQSA-N	599.251061696							100470
BRD-K94676520	LSM-14228		54654604	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24+,26+/m0/s1	OJLJDVMGKDSXAU-BBVWWWHTSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K94676520	BRD-K94676520-001-01-8	Broad Institute of MIT and Harvard	BRD-K94676520			CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24+,26+/m0/s1	OJLJDVMGKDSXAU-BBVWWWHTSA-N	548.209340854							102882
BRD-K55297678	LSM-11780		54654324	InChI=1S/C25H27F2N3O5/c1-3-22(31)28-14-7-10-20-16(11-14)25(33)30(2)19-9-8-15(35-21(19)13-34-20)12-23(32)29-24-17(26)5-4-6-18(24)27/h4-7,10-11,15,19,21H,3,8-9,12-13H2,1-2H3,(H,28,31)(H,29,32)/t15-,19+,21-/m1/s1	HLFXQWPRBSRVAN-MFMILTCTSA-N	CCC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4c(F)cccc4F)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K55297678	BRD-K55297678-001-02-8	Broad Institute of MIT and Harvard	BRD-K55297678			CCC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4c(F)cccc4F)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C25H27F2N3O5/c1-3-22(31)28-14-7-10-20-16(11-14)25(33)30(2)19-9-8-15(35-21(19)13-34-20)12-23(32)29-24-17(26)5-4-6-18(24)27/h4-7,10-11,15,19,21H,3,8-9,12-13H2,1-2H3,(H,28,31)(H,29,32)/t15-,19+,21-/m1/s1	HLFXQWPRBSRVAN-MFMILTCTSA-N	487.191877394							100405
BRD-K38796873	LSM-10779		54654557	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20-,22+/m1/s1	VIDGDBZXEWMIQL-UZKOGDIHSA-N	CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K38796873	BRD-K38796873-001-01-6	Broad Institute of MIT and Harvard	BRD-K38796873			CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20-,22+/m1/s1	VIDGDBZXEWMIQL-UZKOGDIHSA-N	469.201299226							99400
BRD-K48457318-001-01-6	LSM-11376	BRD-K48457318	54654298	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27+/m0/s1	BSKZHQCAOYVBFU-SCTDOJESSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K48457318	BRD-K48457318-001-01-6	Broad Institute of MIT and Harvard	BRD-K48457318			CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27+/m0/s1	BSKZHQCAOYVBFU-SCTDOJESSA-N	537.263899482							99997
BRD-K46989099	LSM-11293		54654402	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23-,25-/m0/s1	IGRBOWQNYYEHHT-RSEQLOHWSA-N	COc1ccc(cc1)C(=O)Nc2ccc3OC[C@@H]4O[C@H](CC(=O)NCC5CC5)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K46989099	BRD-K46989099-001-01-5	Broad Institute of MIT and Harvard	BRD-K46989099			COc1ccc(cc1)C(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCC4CC4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23-,25-/m0/s1	IGRBOWQNYYEHHT-RSEQLOHWSA-N	507.236935806							99914
BRD-K46276961	LSM-11252		54654448	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18-,20-/m0/s1	QTFAPORQFWHYLC-QSFXBCCZSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	BroadT	BRD-K46276961	BRD-K46276961-001-01-2	Broad Institute of MIT and Harvard	BRD-K46276961			COC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18-,20-/m0/s1	QTFAPORQFWHYLC-QSFXBCCZSA-N	508.10709956							99873
MLS004342517	LSM-14414	BRD-K97424427	54654495	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23+,25-/m1/s1	VDMGESCZGFUZFC-NMVJMZGASA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(Cl)cc3)O[C@@H]2COc4ccc(NC(=O)Nc5c(C)onc5C)cc4C1=O	BroadT	BRD-K97424427	BRD-K97424427-001-02-2	Broad Institute of MIT and Harvard	BRD-K97424427			CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(Cl)cc3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23+,25-/m1/s1	VDMGESCZGFUZFC-NMVJMZGASA-N	581.204111504							103069
BRD-K32755775	LSM-10414		54654594	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23-,27-/m1/s1	JZWHDUCFLDKMHA-WHCXKFMVSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc5ccc(NC(=O)C6CCOCC6)cc5C1=O	BroadT	BRD-K32755775	BRD-K32755775-001-01-7	Broad Institute of MIT and Harvard	BRD-K32755775			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23-,27-/m1/s1	JZWHDUCFLDKMHA-WHCXKFMVSA-N	565.24241511							99035
BRD-K86375847	LSM-13719		54654365	InChI=1S/C30H30ClN3O7S/c1-34-26-10-7-23(14-29(35)32-21-5-2-18-15-39-16-19(18)12-21)41-28(26)17-40-27-11-6-22(13-25(27)30(34)36)33-42(37,38)24-8-3-20(31)4-9-24/h2-6,8-9,11-13,23,26,28,33H,7,10,14-17H2,1H3,(H,32,35)/t23-,26+,28-/m1/s1	QXDICPGBMSBLQM-RXWNPYQGSA-N	CN1[C@H]2CC[C@H](CC(=O)Nc3ccc4COCc4c3)O[C@@H]2COc5ccc(NS(=O)(=O)c6ccc(Cl)cc6)cc5C1=O	BroadT	BRD-K86375847	BRD-K86375847-001-02-1	Broad Institute of MIT and Harvard	BRD-K86375847			CN1[C@H]2CC[C@H](CC(=O)Nc3ccc4COCc4c3)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C30H30ClN3O7S/c1-34-26-10-7-23(14-29(35)32-21-5-2-18-15-39-16-19(18)12-21)41-28(26)17-40-27-11-6-22(13-25(27)30(34)36)33-42(37,38)24-8-3-20(31)4-9-24/h2-6,8-9,11-13,23,26,28,33H,7,10,14-17H2,1H3,(H,32,35)/t23-,26+,28-/m1/s1	QXDICPGBMSBLQM-RXWNPYQGSA-N	611.14929873							131225
BRD-K78449133	LSM-13224		54654460	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26+,28+/m1/s1	IPBHQWGLWRAHKP-XDIPAPSNSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@H]2COc5ccc(NS(=O)(=O)C)cc5C1=O	BroadT	BRD-K78449133	BRD-K78449133-001-01-9	Broad Institute of MIT and Harvard	BRD-K78449133			CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26+,28+/m1/s1	IPBHQWGLWRAHKP-XDIPAPSNSA-N	563.209006496							101863
BRD-K53342443	LSM-11680		54654510	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19+,21+/m0/s1	VOOHCFNIWPJMMM-FBBABVLZSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NC3CCCCC3)O[C@@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K53342443	BRD-K53342443-001-01-0	Broad Institute of MIT and Harvard	BRD-K53342443			CN1[C@@H]2CC[C@@H](CC(=O)NC3CCCCC3)O[C@@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19+,21+/m0/s1	VOOHCFNIWPJMMM-FBBABVLZSA-N	479.209006496							100305
BRD-K14862006	LSM-9323		54654506	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19+,21+/m1/s1	VOOHCFNIWPJMMM-LMNJBCLMSA-N	CN1[C@H]2CC[C@H](CC(=O)NC3CCCCC3)O[C@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K14862006	BRD-K14862006-001-01-4	Broad Institute of MIT and Harvard	BRD-K14862006			CN1[C@H]2CC[C@H](CC(=O)NC3CCCCC3)O[C@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19+,21+/m1/s1	VOOHCFNIWPJMMM-LMNJBCLMSA-N	479.209006496							97944
BRD-K92659956	LSM-14108		54654513	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24-,26-/m1/s1	JZXYXAGICCVVHG-QIGHUWCUSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K92659956	BRD-K92659956-001-01-9	Broad Institute of MIT and Harvard	BRD-K92659956			CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24-,26-/m1/s1	JZXYXAGICCVVHG-QIGHUWCUSA-N	527.299536062							102762
BRD-K88541752	LSM-13870		54654544	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25+,27+/m1/s1	MRBZRZGKCPBOJB-UDZXTKBFSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc4ccc(NC(=O)Nc5ccccc5Cl)cc4C1=O	BroadT	BRD-K88541752	BRD-K88541752-001-01-1	Broad Institute of MIT and Harvard	BRD-K88541752			CN1[C@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc2ccc(NC(=O)Nc3ccccc3Cl)cc2C1=O	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25+,27+/m1/s1	MRBZRZGKCPBOJB-UDZXTKBFSA-N	599.251061696							102522
CHEMBL2361748	LSM-6831	BRD-K41878610, SID131450725	54654300	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27-/m1/s1	BSKZHQCAOYVBFU-DFZDUAMZSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K41878610	BRD-K41878610-001-01-5	Broad Institute of MIT and Harvard	BRD-K41878610			CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27-/m1/s1	BSKZHQCAOYVBFU-DFZDUAMZSA-N	537.263899482							95452
BRD-K84022666	LSM-13562		54654430	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28-,30+/m0/s1	YIAMBQQGWRAZTQ-FCJWUBJXSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K84022666	BRD-K84022666-001-01-1	Broad Institute of MIT and Harvard	BRD-K84022666			CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28-,30+/m0/s1	YIAMBQQGWRAZTQ-FCJWUBJXSA-N	602.256291046							102204
BRD-K45230579	LSM-11181		54654317	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21+,23+/m0/s1	ANPNCKARMDTJMY-XKCSPQBFSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	BroadT	BRD-K45230579	BRD-K45230579-001-01-4	Broad Institute of MIT and Harvard	BRD-K45230579			COC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21+,23+/m0/s1	ANPNCKARMDTJMY-XKCSPQBFSA-N	481.221285742							99802
BRD-K71718338	LSM-12817		54654603	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24+,26-/m0/s1	OJLJDVMGKDSXAU-NZJKTDFXSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K71718338	BRD-K71718338-001-01-7	Broad Institute of MIT and Harvard	BRD-K71718338			CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24+,26-/m0/s1	OJLJDVMGKDSXAU-NZJKTDFXSA-N	548.209340854							101454
CHEMBL2362244	LSM-12946	BRD-K73701691, SID131450786	54654357	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26-,28-/m0/s1	WCNQFBRPFNRKRV-WSHBGFIESA-N	CN1[C@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc5ccc(NS(=O)(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K73701691	BRD-K73701691-001-01-2	Broad Institute of MIT and Harvard	BRD-K73701691			CN1[C@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc2ccc(NS(=O)(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26-,28-/m0/s1	WCNQFBRPFNRKRV-WSHBGFIESA-N	593.199584664							101583
BRD-K12241427	LSM-9158		54654515	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24+,26+/m1/s1	JZXYXAGICCVVHG-CWDLOFLHSA-N	CN1[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K12241427	BRD-K12241427-001-01-4	Broad Institute of MIT and Harvard	BRD-K12241427			CN1[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24+,26+/m1/s1	JZXYXAGICCVVHG-CWDLOFLHSA-N	527.299536062							97779
BRD-K16472441	LSM-9425		54654488	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23-,25-/m0/s1	VDMGESCZGFUZFC-RSEQLOHWSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)cc3)O[C@H]2COc4ccc(NC(=O)Nc5c(C)onc5C)cc4C1=O	BroadT	BRD-K16472441	BRD-K16472441-001-01-3	Broad Institute of MIT and Harvard	BRD-K16472441			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)cc3)O[C@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23-,25-/m0/s1	VDMGESCZGFUZFC-RSEQLOHWSA-N	581.204111504							98046
BRD-K07852637	LSM-8902		54654558	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20+,22-/m1/s1	VIDGDBZXEWMIQL-KAGYGMCKSA-N	CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K07852637	BRD-K07852637-001-01-1	Broad Institute of MIT and Harvard	BRD-K07852637			CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20+,22-/m1/s1	VIDGDBZXEWMIQL-KAGYGMCKSA-N	469.201299226							97523
BRD-K22033393	LSM-6826		54654536	InChI=1S/C28H35N5O5/c1-33-23-9-8-20(14-26(34)31-15-18-5-3-2-4-6-18)38-25(23)17-37-24-10-7-19(13-21(24)28(33)36)32-27(35)22-16-29-11-12-30-22/h7,10-13,16,18,20,23,25H,2-6,8-9,14-15,17H2,1H3,(H,31,34)(H,32,35)/t20-,23-,25-/m1/s1	KUAQBUHJEIVZQC-QFZRFWILSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cnccn5)cc4C1=O	BroadT	BRD-K22033393	BRD-K22033393-001-01-3	Broad Institute of MIT and Harvard	BRD-K22033393			CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cnccn3)cc2C1=O	InChI=1S/C28H35N5O5/c1-33-23-9-8-20(14-26(34)31-15-18-5-3-2-4-6-18)38-25(23)17-37-24-10-7-19(13-21(24)28(33)36)32-27(35)22-16-29-11-12-30-22/h7,10-13,16,18,20,23,25H,2-6,8-9,14-15,17H2,1H3,(H,31,34)(H,32,35)/t20-,23-,25-/m1/s1	KUAQBUHJEIVZQC-QFZRFWILSA-N	521.26381927							95447
BRD-K03845749	LSM-8668		54654572	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17+,19+/m1/s1	VPEDYPFQYJVQKE-AYBZRNKSSA-N	CN1[C@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K03845749	BRD-K03845749-001-01-4	Broad Institute of MIT and Harvard	BRD-K03845749			CN1[C@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17+,19+/m1/s1	VPEDYPFQYJVQKE-AYBZRNKSSA-N	467.172620988							97289
BRD-K95762279	LSM-14300		54654541	InChI=1S/C30H26F2N4O5/c1-36-25-10-8-21(14-28(37)35-24-12-19(31)6-9-23(24)32)41-27(25)16-40-26-11-7-20(13-22(26)30(36)39)34-29(38)18-4-2-17(15-33)3-5-18/h2-7,9,11-13,21,25,27H,8,10,14,16H2,1H3,(H,34,38)(H,35,37)/t21-,25+,27-/m1/s1	HZZMILAACSDJOI-NKPLSRDGSA-N	CN1[C@H]2CC[C@H](CC(=O)Nc3cc(F)ccc3F)O[C@@H]2COc4ccc(NC(=O)c5ccc(cc5)C#N)cc4C1=O	BroadT	BRD-K95762279	BRD-K95762279-001-02-6	Broad Institute of MIT and Harvard	BRD-K95762279			CN1[C@H]2CC[C@H](CC(=O)Nc3cc(F)ccc3F)O[C@@H]2COc2ccc(NC(=O)c3ccc(cc3)C#N)cc2C1=O	InChI=1S/C30H26F2N4O5/c1-36-25-10-8-21(14-28(37)35-24-12-19(31)6-9-23(24)32)41-27(25)16-40-26-11-7-20(13-22(26)30(36)39)34-29(38)18-4-2-17(15-33)3-5-18/h2-7,9,11-13,21,25,27H,8,10,14,16H2,1H3,(H,34,38)(H,35,37)/t21-,25+,27-/m1/s1	HZZMILAACSDJOI-NKPLSRDGSA-N	560.187126372							102954
BRD-K89489862	LSM-13942		54654408	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24+,26+/m1/s1	XUZKWORPTAYLRR-CWDLOFLHSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K89489862	BRD-K89489862-001-01-9	Broad Institute of MIT and Harvard	BRD-K89489862			CN1[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24+,26+/m1/s1	XUZKWORPTAYLRR-CWDLOFLHSA-N	536.263484912							102595
MLS004342480	LSM-10014	BRD-K26160077	54654351	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19-,21+/m1/s1	PZXWXIAUASIELU-QFUCXCTJSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	BroadT	BRD-K26160077	BRD-K26160077-001-01-3	Broad Institute of MIT and Harvard	BRD-K26160077			COC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19-,21+/m1/s1	PZXWXIAUASIELU-QFUCXCTJSA-N	472.14011425							98635
MLS004342535	LSM-13806	BRD-K87707378	54654404	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23+,25-/m1/s1	IGRBOWQNYYEHHT-NMVJMZGASA-N	COc1ccc(cc1)C(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)NCC5CC5)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K87707378	BRD-K87707378-001-02-1	Broad Institute of MIT and Harvard	BRD-K87707378			COc1ccc(cc1)C(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCC4CC4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23+,25-/m1/s1	IGRBOWQNYYEHHT-NMVJMZGASA-N	507.236935806							102455
BRD-K13199470	LSM-9222		54654367	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22+,24-/m1/s1	HKYXYLDUIXPRSO-JCTONOIOSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2	BroadT	BRD-K13199470	BRD-K13199470-001-01-9	Broad Institute of MIT and Harvard	BRD-K13199470			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)C4CCOCC4)cc3C(=O)N2C)O1	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22+,24-/m1/s1	HKYXYLDUIXPRSO-JCTONOIOSA-N	514.279134976							97843
BRD-K39622686	LSM-10835		54654562	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18-,20-/m1/s1	VIAXYKVUXVILCJ-XFQXTVEOSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	BroadT	BRD-K39622686	BRD-K39622686-001-01-0	Broad Institute of MIT and Harvard	BRD-K39622686			COC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18-,20-/m1/s1	VIAXYKVUXVILCJ-XFQXTVEOSA-N	458.151157262							99456
BRD-K72271119	LSM-12858		54654340	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29+,31-/m1/s1	UWMJOJNRDSZDAZ-HZBLSIGESA-N	CN1[C@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K72271119	BRD-K72271119-001-02-9	Broad Institute of MIT and Harvard	BRD-K72271119			CN1[C@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29+,31-/m1/s1	UWMJOJNRDSZDAZ-HZBLSIGESA-N	618.265376692							101495
BRD-K96543798-001-02-1	LSM-14350	BRD-K96543798	54654301	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27-/m1/s1	BSKZHQCAOYVBFU-NRRYGQPISA-N	CN1[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K96543798	BRD-K96543798-001-03-9	Broad Institute of MIT and Harvard	BRD-K96543798			CN1[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27-/m1/s1	BSKZHQCAOYVBFU-NRRYGQPISA-N	537.263899482							103004
BRD-K14215828	LSM-9285		54654305	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22+,24+/m1/s1	YBRLGVDHYMUGPQ-MFHCRVQTSA-N	CCNC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K14215828	BRD-K14215828-001-01-1	Broad Institute of MIT and Harvard	BRD-K14215828			CCNC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22+,24+/m1/s1	YBRLGVDHYMUGPQ-MFHCRVQTSA-N	494.252920228							97906
BRD-K23723926	LSM-9857		54654508	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19-,21+/m0/s1	VOOHCFNIWPJMMM-HFSMHLIXSA-N	CN1[C@H]2CC[C@@H](CC(=O)NC3CCCCC3)O[C@@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K23723926	BRD-K23723926-001-01-4	Broad Institute of MIT and Harvard	BRD-K23723926			CN1[C@H]2CC[C@@H](CC(=O)NC3CCCCC3)O[C@@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19-,21+/m0/s1	VOOHCFNIWPJMMM-HFSMHLIXSA-N	479.209006496							98478
BRD-K49909254	LSM-11461		54654384	InChI=1S/C26H29F3N4O5/c1-15-3-5-16(6-4-15)31-25(36)32-17-7-10-21-19(11-17)24(35)33(2)20-9-8-18(38-22(20)13-37-21)12-23(34)30-14-26(27,28)29/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,30,34)(H2,31,32,36)/t18-,20+,22+/m1/s1	PPTVZYJXLGYDRY-CBQOVEMMSA-N	CN1[C@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@H]2COc3ccc(NC(=O)Nc4ccc(C)cc4)cc3C1=O	BroadT	BRD-K49909254	BRD-K49909254-001-01-1	Broad Institute of MIT and Harvard	BRD-K49909254			CN1[C@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@H]2COc2ccc(NC(=O)Nc3ccc(C)cc3)cc2C1=O	InChI=1S/C26H29F3N4O5/c1-15-3-5-16(6-4-15)31-25(36)32-17-7-10-21-19(11-17)24(35)33(2)20-9-8-18(38-22(20)13-37-21)12-23(34)30-14-26(27,28)29/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,30,34)(H2,31,32,36)/t18-,20+,22+/m1/s1	PPTVZYJXLGYDRY-CBQOVEMMSA-N	534.209004668							100082
BRD-K60581054	LSM-12088		54654418	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25-,27+/m0/s1	IJWLFSVDDGQQHF-LYPIBBCQSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K60581054	BRD-K60581054-001-01-4	Broad Institute of MIT and Harvard	BRD-K60581054			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25-,27+/m0/s1	IJWLFSVDDGQQHF-LYPIBBCQSA-N	570.251205666							100714
BRD-K00248931	LSM-8439		54654596	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23-,27-/m0/s1	JZWHDUCFLDKMHA-MYIHVTGJSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc5ccc(NC(=O)C6CCOCC6)cc5C1=O	BroadT	BRD-K00248931	BRD-K00248931-001-01-2	Broad Institute of MIT and Harvard	BRD-K00248931			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23-,27-/m0/s1	JZWHDUCFLDKMHA-MYIHVTGJSA-N	565.24241511							97060
BRD-K96957785	LSM-14382		54654452	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19-,21+/m1/s1	KEGRQPVLAXHQPZ-VMRPVKRXSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@H]2COc3ccc(NC(=O)c4ccccc4Cl)cc3C1=O	BroadT	BRD-K96957785	BRD-K96957785-001-01-0	Broad Institute of MIT and Harvard	BRD-K96957785			CN1[C@@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@H]2COc2ccc(NC(=O)c3ccccc3Cl)cc2C1=O	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19-,21+/m1/s1	KEGRQPVLAXHQPZ-VMRPVKRXSA-N	539.14348324							103036
BRD-K88180879	LSM-13845		54654502	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22+,24+/m1/s1	KFDLRFOLOVMTJG-UCFCWBNQSA-N	CN1[C@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K88180879	BRD-K88180879-001-01-6	Broad Institute of MIT and Harvard	BRD-K88180879			CN1[C@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22+,24+/m1/s1	KFDLRFOLOVMTJG-UCFCWBNQSA-N	525.25873389							102496
BRD-K48047846	LSM-11354		54654348	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27+,29-/m0/s1	UEIQSFPBDLFQGU-BUAQGSAMSA-N	COc1cccc(NC(=O)Nc2ccc3OC[C@@H]4O[C@H](CC(=O)NCCc5ccccc5)CC[C@H]4N(C)C(=O)c3c2)c1	BroadT	BRD-K48047846	BRD-K48047846-001-01-6	Broad Institute of MIT and Harvard	BRD-K48047846			COc1cccc(NC(=O)Nc2ccc3OC[C@@H]4O[C@H](CC(=O)NCCc5ccccc5)CC[C@H]4N(C)C(=O)c3c2)c1	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27+,29-/m0/s1	UEIQSFPBDLFQGU-BUAQGSAMSA-N	572.263484912							99975
BRD-K14091022	LSM-9278		54654435	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28+,30-/m1/s1	YIAMBQQGWRAZTQ-SNMYBPINSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K14091022	BRD-K14091022-001-01-0	Broad Institute of MIT and Harvard	BRD-K14091022			CN1[C@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28+,30-/m1/s1	YIAMBQQGWRAZTQ-SNMYBPINSA-N	602.256291046							97899
CHEMBL2357503	LSM-6845	BRD-K66383562, SID131450906	54654477	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29-,31-/m0/s1	COTLGVLRTBZUTQ-CRFLUJQRSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@H]2COc5ccc(NC(=O)c6cc(C)on6)cc5C1=O	BroadT	BRD-K66383562	BRD-K66383562-001-01-4	Broad Institute of MIT and Harvard	BRD-K66383562			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29-,31-/m0/s1	COTLGVLRTBZUTQ-CRFLUJQRSA-N	594.247834848							95466
BRD-K24427624	LSM-9907		54654465	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21-,23+/m0/s1	MAZJZTZSELFTOO-AVCGJXAMSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCc4ccccc4F)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K24427624	BRD-K24427624-001-01-6	Broad Institute of MIT and Harvard	BRD-K24427624			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCc4ccccc4F)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21-,23+/m0/s1	MAZJZTZSELFTOO-AVCGJXAMSA-N	519.1839346							98528
BRD-K71361566	LSM-12792		54654492	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23+,25+/m0/s1	VDMGESCZGFUZFC-QQKQFIJSSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)cc3)O[C@@H]2COc4ccc(NC(=O)Nc5c(C)onc5C)cc4C1=O	BroadT	BRD-K71361566	BRD-K71361566-001-01-9	Broad Institute of MIT and Harvard	BRD-K71361566			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)cc3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23+,25+/m0/s1	VDMGESCZGFUZFC-QQKQFIJSSA-N	581.204111504							101429
BRD-K68522303	LSM-12608		54654523	InChI=1S/C24H25FN2O6/c1-27-19-9-8-15(12-22(28)31-2)33-21(19)13-32-20-10-7-14(11-17(20)24(27)30)26-23(29)16-5-3-4-6-18(16)25/h3-7,10-11,15,19,21H,8-9,12-13H2,1-2H3,(H,26,29)/t15-,19-,21+/m1/s1	QVBIDJFZXMTPPC-VMRPVKRXSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4ccccc4F)cc3C(=O)N2C)O1	BroadT	BRD-K68522303	BRD-K68522303-001-01-9	Broad Institute of MIT and Harvard	BRD-K68522303			COC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4ccccc4F)cc3C(=O)N2C)O1	InChI=1S/C24H25FN2O6/c1-27-19-9-8-15(12-22(28)31-2)33-21(19)13-32-20-10-7-14(11-17(20)24(27)30)26-23(29)16-5-3-4-6-18(16)25/h3-7,10-11,15,19,21H,8-9,12-13H2,1-2H3,(H,26,29)/t15-,19-,21+/m1/s1	QVBIDJFZXMTPPC-VMRPVKRXSA-N	456.16966474							101240
BRD-K77640397	LSM-13175		54654482	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18-,20-/m1/s1	HJRBVKTVNLVVPO-YVWKXTFCSA-N	CN1[C@@H]2CC[C@H](CC(=O)O)O[C@@H]2COc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K77640397	BRD-K77640397-001-01-5	Broad Institute of MIT and Harvard	BRD-K77640397			CN1[C@@H]2CC[C@H](CC(O)=O)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18-,20-/m1/s1	HJRBVKTVNLVVPO-YVWKXTFCSA-N	439.17433555							101813
BRD-K81112982	LSM-13389		54654499	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22-,24-/m0/s1	KFDLRFOLOVMTJG-APTRMMRNSA-N	CN1[C@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K81112982	BRD-K81112982-001-01-0	Broad Institute of MIT and Harvard	BRD-K81112982			CN1[C@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22-,24-/m0/s1	KFDLRFOLOVMTJG-APTRMMRNSA-N	525.25873389							102028
BRD-K97993646	LSM-14452		54654587	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28+/m1/s1	ADKYEMYUARXISC-INOCPDNRSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@@H]4O[C@@H](CC(=O)NCCCN5CCOCC5)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K97993646	BRD-K97993646-001-01-3	Broad Institute of MIT and Harvard	BRD-K97993646			COc1cccc(c1)C(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCCCN4CCOCC4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28+/m1/s1	ADKYEMYUARXISC-INOCPDNRSA-N	580.28969966							103107
CHEMBL2361748	LSM-6831	BRD-K41878610, SID131450725	54654300	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27-/m1/s1	BSKZHQCAOYVBFU-DFZDUAMZSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K41878610	BRD-K41878610-001-02-3	Broad Institute of MIT and Harvard	BRD-K41878610			CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27-/m1/s1	BSKZHQCAOYVBFU-DFZDUAMZSA-N	537.263899482							95452
BRD-K18918854	LSM-9561		54654325	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29-,31-/m0/s1	UWMJOJNRDSZDAZ-YZOHHVQUSA-N	CN1[C@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K18918854	BRD-K18918854-001-01-3	Broad Institute of MIT and Harvard	BRD-K18918854			CN1[C@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29-,31-/m0/s1	UWMJOJNRDSZDAZ-YZOHHVQUSA-N	618.265376692							98182
CHEMBL2355396	LSM-14318	BRD-K96020117, SID131451011	54654582	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25-,28+/m1/s1	PQVOHAVDCPBJEV-OKEQGEBHSA-N	COc1ccccc1C(=O)Nc2ccc3OC[C@@H]4O[C@@H](CC(=O)NCCc5ccncc5)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K96020117	BRD-K96020117-001-01-6	Broad Institute of MIT and Harvard	BRD-K96020117			COc1ccccc1C(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCCc4ccncc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25-,28+/m1/s1	PQVOHAVDCPBJEV-OKEQGEBHSA-N	558.247834848							102972
BRD-K99198153	LSM-14524		54654422	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25-,27-/m1/s1	IJWLFSVDDGQQHF-JTOATPROSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K99198153	BRD-K99198153-001-01-2	Broad Institute of MIT and Harvard	BRD-K99198153			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25-,27-/m1/s1	IJWLFSVDDGQQHF-JTOATPROSA-N	570.251205666							103179
BRD-K96952717	LSM-14381		54654534	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18+,20+/m1/s1	MPULVBUDJGIXBK-KPFFTGBYSA-N	CN1[C@H]2CC[C@H](CC(=O)O)O[C@H]2COc3ccc(NC(=O)c4cccc(c4)C(F)(F)F)cc3C1=O	BroadT	BRD-K96952717	BRD-K96952717-001-01-4	Broad Institute of MIT and Harvard	BRD-K96952717			CN1[C@H]2CC[C@H](CC(O)=O)O[C@H]2COc2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2C1=O	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18+,20+/m1/s1	MPULVBUDJGIXBK-KPFFTGBYSA-N	492.150821076							103035
BRD-K21913257	LSM-9756		54654599	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24-,26+/m0/s1	OJLJDVMGKDSXAU-PMWMKWCKSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K21913257	BRD-K21913257-001-01-2	Broad Institute of MIT and Harvard	BRD-K21913257			CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24-,26+/m0/s1	OJLJDVMGKDSXAU-PMWMKWCKSA-N	548.209340854							98377
SCHEMBL16984312	LSM-6840	BRD-K55851396	54654475	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29-,31+/m0/s1	COTLGVLRTBZUTQ-VTRIWSNPSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@@H]2COc5ccc(NC(=O)c6cc(C)on6)cc5C1=O	BroadT	BRD-K55851396	BRD-K55851396-001-01-5	Broad Institute of MIT and Harvard	BRD-K55851396			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29-,31+/m0/s1	COTLGVLRTBZUTQ-VTRIWSNPSA-N	594.247834848							95461
BRD-K06280926	LSM-8795		54654551	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20-,22-/m0/s1	VIDGDBZXEWMIQL-VCOUNFBDSA-N	CN(C)C(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K06280926	BRD-K06280926-001-01-6	Broad Institute of MIT and Harvard	BRD-K06280926			CN(C)C(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20-,22-/m0/s1	VIDGDBZXEWMIQL-VCOUNFBDSA-N	469.201299226							97416
BRD-K04230416	LSM-8687		54654398	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23+,25-/m0/s1	IGRBOWQNYYEHHT-PWWKTKHKSA-N	COc1ccc(cc1)C(=O)Nc2ccc3OC[C@@H]4O[C@H](CC(=O)NCC5CC5)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K04230416	BRD-K04230416-001-01-0	Broad Institute of MIT and Harvard	BRD-K04230416			COc1ccc(cc1)C(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCC4CC4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23+,25-/m0/s1	IGRBOWQNYYEHHT-PWWKTKHKSA-N	507.236935806							97308
BRD-K95422182	LSM-14277		54654341	InChI=1S/C28H33N3O5/c1-17-6-8-19(9-7-17)29-26(32)15-21-11-12-23-25(36-21)16-35-24-13-10-20(14-22(24)28(34)31(23)2)30-27(33)18-4-3-5-18/h6-10,13-14,18,21,23,25H,3-5,11-12,15-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23+,25-/m1/s1	MDXGSMRIHHEMMK-NMVJMZGASA-N	CN1[C@H]2CC[C@H](CC(=O)Nc3ccc(C)cc3)O[C@@H]2COc4ccc(NC(=O)C5CCC5)cc4C1=O	BroadT	BRD-K95422182	BRD-K95422182-001-02-3	Broad Institute of MIT and Harvard	BRD-K95422182			CN1[C@H]2CC[C@H](CC(=O)Nc3ccc(C)cc3)O[C@@H]2COc2ccc(NC(=O)C3CCC3)cc2C1=O	InChI=1S/C28H33N3O5/c1-17-6-8-19(9-7-17)29-26(32)15-21-11-12-23-25(36-21)16-35-24-13-10-20(14-22(24)28(34)31(23)2)30-27(33)18-4-3-5-18/h6-10,13-14,18,21,23,25H,3-5,11-12,15-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23+,25-/m1/s1	MDXGSMRIHHEMMK-NMVJMZGASA-N	491.242021186							102931
BRD-K17627845	LSM-9487		54654458	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26-,28-/m1/s1	IPBHQWGLWRAHKP-OROMBRFGSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@@H]2COc5ccc(NS(=O)(=O)C)cc5C1=O	BroadT	BRD-K17627845	BRD-K17627845-001-01-3	Broad Institute of MIT and Harvard	BRD-K17627845			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26-,28-/m1/s1	IPBHQWGLWRAHKP-OROMBRFGSA-N	563.209006496							98108
BRD-K79090110	LSM-13259		54654316	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21+,23-/m0/s1	ANPNCKARMDTJMY-WPYKKVEZSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	BroadT	BRD-K79090110	BRD-K79090110-001-01-7	Broad Institute of MIT and Harvard	BRD-K79090110			COC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21+,23-/m0/s1	ANPNCKARMDTJMY-WPYKKVEZSA-N	481.221285742							101898
BRD-K56812045	LSM-11863		54654411	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24-,26-/m1/s1	XUZKWORPTAYLRR-QIGHUWCUSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K56812045	BRD-K56812045-001-01-1	Broad Institute of MIT and Harvard	BRD-K56812045			CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24-,26-/m1/s1	XUZKWORPTAYLRR-QIGHUWCUSA-N	536.263484912							100489
BRD-K49378999	LSM-11429		54654486	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18-,20-/m0/s1	HJRBVKTVNLVVPO-QRFRQXIXSA-N	CN1[C@H]2CC[C@@H](CC(=O)O)O[C@H]2COc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K49378999	BRD-K49378999-001-01-9	Broad Institute of MIT and Harvard	BRD-K49378999			CN1[C@H]2CC[C@@H](CC(O)=O)O[C@H]2COc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18-,20-/m0/s1	HJRBVKTVNLVVPO-QRFRQXIXSA-N	439.17433555							100050
BRD-K24050458	LSM-9880		54654372	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22-,24+/m1/s1	HKYXYLDUIXPRSO-BKULYWANSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2	BroadT	BRD-K24050458	BRD-K24050458-001-01-7	Broad Institute of MIT and Harvard	BRD-K24050458			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)C4CCOCC4)cc3C(=O)N2C)O1	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22-,24+/m1/s1	HKYXYLDUIXPRSO-BKULYWANSA-N	514.279134976							98501
BRD-K52846581	LSM-11653		54654479	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29+,31-/m1/s1	COTLGVLRTBZUTQ-YHHKDRGWSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@@H]2COc5ccc(NC(=O)c6cc(C)on6)cc5C1=O	BroadT	BRD-K52846581	BRD-K52846581-001-02-1	Broad Institute of MIT and Harvard	BRD-K52846581			CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29+,31-/m1/s1	COTLGVLRTBZUTQ-YHHKDRGWSA-N	594.247834848							100278
BRD-K20051162	LSM-9647		54654379	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22-,24-/m1/s1	CMDXATVLXHEPLP-KIFXHHALSA-N	CC(C)NC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCc4ccc(F)cc4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K20051162	BRD-K20051162-001-01-6	Broad Institute of MIT and Harvard	BRD-K20051162			CC(C)NC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCc4ccc(F)cc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22-,24-/m1/s1	CMDXATVLXHEPLP-KIFXHHALSA-N	512.243498396							98268
BRD-K87730884	LSM-13808		54654600	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24-,26-/m0/s1	OJLJDVMGKDSXAU-CVJWPJSTSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K87730884	BRD-K87730884-001-01-2	Broad Institute of MIT and Harvard	BRD-K87730884			CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24-,26-/m0/s1	OJLJDVMGKDSXAU-CVJWPJSTSA-N	548.209340854							102457
BRD-K73408523	LSM-12925		54654330	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29-,31-/m0/s1	UWMJOJNRDSZDAZ-GQUBXBKDSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K73408523	BRD-K73408523-001-01-8	Broad Institute of MIT and Harvard	BRD-K73408523			CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29-,31-/m0/s1	UWMJOJNRDSZDAZ-GQUBXBKDSA-N	618.265376692							101562
MLS004342455	LSM-12444	BRD-K65851733	54654561	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18+,20+/m1/s1	VIAXYKVUXVILCJ-BPAFIMBUSA-N	COC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	BroadT	BRD-K65851733	BRD-K65851733-001-01-5	Broad Institute of MIT and Harvard	BRD-K65851733			COC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18+,20+/m1/s1	VIAXYKVUXVILCJ-BPAFIMBUSA-N	458.151157262							101072
BRD-K86728331	LSM-13741		54654390	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17+,19+/m1/s1	RVSYYJUWHXUHRD-AYBZRNKSSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCCOC)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K86728331	BRD-K86728331-001-01-6	Broad Institute of MIT and Harvard	BRD-K86728331			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCCOC)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17+,19+/m1/s1	RVSYYJUWHXUHRD-AYBZRNKSSA-N	469.188271052							102390
BRD-K25789307	LSM-9994		54654304	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22-,24-/m1/s1	YBRLGVDHYMUGPQ-PWFRSZSWSA-N	CCNC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K25789307	BRD-K25789307-001-01-2	Broad Institute of MIT and Harvard	BRD-K25789307			CCNC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22-,24-/m1/s1	YBRLGVDHYMUGPQ-PWFRSZSWSA-N	494.252920228							98615
BRD-K60753740	LSM-12101		54654451	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19+,21+/m0/s1	KEGRQPVLAXHQPZ-NYSBEXSLSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc3ccc(NC(=O)c4ccccc4Cl)cc3C1=O	BroadT	BRD-K60753740	BRD-K60753740-001-01-9	Broad Institute of MIT and Harvard	BRD-K60753740			CN1[C@@H]2CC[C@@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc2ccc(NC(=O)c3ccccc3Cl)cc2C1=O	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19+,21+/m0/s1	KEGRQPVLAXHQPZ-NYSBEXSLSA-N	539.14348324							100727
BRD-K72118202	LSM-12848		54654347	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27+,29+/m0/s1	UEIQSFPBDLFQGU-BOSLPAGOSA-N	COc1cccc(NC(=O)Nc2ccc3OC[C@H]4O[C@H](CC(=O)NCCc5ccccc5)CC[C@H]4N(C)C(=O)c3c2)c1	BroadT	BRD-K72118202	BRD-K72118202-001-01-2	Broad Institute of MIT and Harvard	BRD-K72118202			COc1cccc(NC(=O)Nc2ccc3OC[C@H]4O[C@H](CC(=O)NCCc5ccccc5)CC[C@H]4N(C)C(=O)c3c2)c1	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27+,29+/m0/s1	UEIQSFPBDLFQGU-BOSLPAGOSA-N	572.263484912							101485
BRD-K48005755	LSM-11348		54654374	InChI=1S/C24H29N3O7S/c1-27-19-10-9-16(13-23(28)25-18-6-4-5-7-21(18)32-2)34-22(19)14-33-20-11-8-15(26-35(3,30)31)12-17(20)24(27)29/h4-8,11-12,16,19,22,26H,9-10,13-14H2,1-3H3,(H,25,28)/t16-,19+,22-/m1/s1	XMFATHMNUBILAV-GTCCEBARSA-N	COc1ccccc1NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NS(=O)(=O)C)cc4C(=O)N3C)O2	BroadT	BRD-K48005755	BRD-K48005755-001-02-1	Broad Institute of MIT and Harvard	BRD-K48005755			COc1ccccc1NC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NS(C)(=O)=O)cc3C(=O)N2C)O1	InChI=1S/C24H29N3O7S/c1-27-19-10-9-16(13-23(28)25-18-6-4-5-7-21(18)32-2)34-22(19)14-33-20-11-8-15(26-35(3,30)31)12-17(20)24(27)29/h4-8,11-12,16,19,22,26H,9-10,13-14H2,1-3H3,(H,25,28)/t16-,19+,22-/m1/s1	XMFATHMNUBILAV-GTCCEBARSA-N	503.172620988							99969
BRD-K55641492	LSM-11798		54654518	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24-,26+/m1/s1	JZXYXAGICCVVHG-NOOIUNMQSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K55641492	BRD-K55641492-001-01-3	Broad Institute of MIT and Harvard	BRD-K55641492			CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24-,26+/m1/s1	JZXYXAGICCVVHG-NOOIUNMQSA-N	527.299536062							100423
BRD-K02317159	LSM-8578		54654375	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22-,24-/m0/s1	CMDXATVLXHEPLP-SSPYTLHUSA-N	CC(C)NC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCc4ccc(F)cc4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K02317159	BRD-K02317159-001-01-8	Broad Institute of MIT and Harvard	BRD-K02317159			CC(C)NC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCc4ccc(F)cc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22-,24-/m0/s1	CMDXATVLXHEPLP-SSPYTLHUSA-N	512.243498396							97199
BRD-K69719681	LSM-12684		54654439	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28-,30-/m1/s1	YIAMBQQGWRAZTQ-DZRWVVDBSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K69719681	BRD-K69719681-001-01-2	Broad Institute of MIT and Harvard	BRD-K69719681			CN1[C@@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28-,30-/m1/s1	YIAMBQQGWRAZTQ-DZRWVVDBSA-N	602.256291046							101318
BRD-K40098720	LSM-10875		54654542	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25+,27-/m0/s1	MRBZRZGKCPBOJB-BBVXACFBSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc4ccc(NC(=O)Nc5ccccc5Cl)cc4C1=O	BroadT	BRD-K40098720	BRD-K40098720-001-01-8	Broad Institute of MIT and Harvard	BRD-K40098720			CN1[C@@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc2ccc(NC(=O)Nc3ccccc3Cl)cc2C1=O	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25+,27-/m0/s1	MRBZRZGKCPBOJB-BBVXACFBSA-N	599.251061696							99496
BRD-K57037989	LSM-11883		54654485	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18-,20+/m1/s1	HJRBVKTVNLVVPO-POAQFYNOSA-N	CN1[C@@H]2CC[C@H](CC(=O)O)O[C@H]2COc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K57037989	BRD-K57037989-001-01-2	Broad Institute of MIT and Harvard	BRD-K57037989			CN1[C@@H]2CC[C@H](CC(O)=O)O[C@H]2COc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18-,20+/m1/s1	HJRBVKTVNLVVPO-POAQFYNOSA-N	439.17433555							100509
BRD-K49452151	LSM-11435		54654441	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28-,30+/m0/s1	YIAMBQQGWRAZTQ-OZBGYUHNSA-N	CN1[C@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K49452151	BRD-K49452151-001-02-4	Broad Institute of MIT and Harvard	BRD-K49452151			CN1[C@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28-,30+/m0/s1	YIAMBQQGWRAZTQ-OZBGYUHNSA-N	602.256291046							100056
BRD-K20182751	LSM-9658		54654318	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21+,23+/m1/s1	ANPNCKARMDTJMY-NWSQWKLXSA-N	COC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	BroadT	BRD-K20182751	BRD-K20182751-001-01-6	Broad Institute of MIT and Harvard	BRD-K20182751			COC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21+,23+/m1/s1	ANPNCKARMDTJMY-NWSQWKLXSA-N	481.221285742							98279
BRD-K20758354	LSM-9690		54654456	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19-,21-/m0/s1	KEGRQPVLAXHQPZ-ZRCAFCQKSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCC(F)(F)F)O[C@H]2COc3ccc(NC(=O)c4ccccc4Cl)cc3C1=O	BroadT	BRD-K20758354	BRD-K20758354-001-01-4	Broad Institute of MIT and Harvard	BRD-K20758354			CN1[C@H]2CC[C@@H](CC(=O)NCC(F)(F)F)O[C@H]2COc2ccc(NC(=O)c3ccccc3Cl)cc2C1=O	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19-,21-/m0/s1	KEGRQPVLAXHQPZ-ZRCAFCQKSA-N	539.14348324							98311
BRD-K08760804	LSM-8960		54654498	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22+,24+/m0/s1	KFDLRFOLOVMTJG-BPUDTRNYSA-N	CN1[C@@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K08760804	BRD-K08760804-001-01-2	Broad Institute of MIT and Harvard	BRD-K08760804			CN1[C@@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22+,24+/m0/s1	KFDLRFOLOVMTJG-BPUDTRNYSA-N	525.25873389							97581
BRD-K16401691	LSM-9419		54654540	InChI=1S/C28H35N5O5/c1-33-23-9-8-20(14-26(34)31-15-18-5-3-2-4-6-18)38-25(23)17-37-24-10-7-19(13-21(24)28(33)36)32-27(35)22-16-29-11-12-30-22/h7,10-13,16,18,20,23,25H,2-6,8-9,14-15,17H2,1H3,(H,31,34)(H,32,35)/t20-,23+,25+/m0/s1	KUAQBUHJEIVZQC-QUURXOELSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cnccn5)cc4C1=O	BroadT	BRD-K16401691	BRD-K16401691-001-01-9	Broad Institute of MIT and Harvard	BRD-K16401691			CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cnccn3)cc2C1=O	InChI=1S/C28H35N5O5/c1-33-23-9-8-20(14-26(34)31-15-18-5-3-2-4-6-18)38-25(23)17-37-24-10-7-19(13-21(24)28(33)36)32-27(35)22-16-29-11-12-30-22/h7,10-13,16,18,20,23,25H,2-6,8-9,14-15,17H2,1H3,(H,31,34)(H,32,35)/t20-,23+,25+/m0/s1	KUAQBUHJEIVZQC-QUURXOELSA-N	521.26381927							98040
CHEMBL2359019	LSM-6852	BRD-K80045183, SID131450728	54654296	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27-/m0/s1	BSKZHQCAOYVBFU-RMDSEJHCSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K80045183	BRD-K80045183-001-02-8	Broad Institute of MIT and Harvard	BRD-K80045183			CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27-/m0/s1	BSKZHQCAOYVBFU-RMDSEJHCSA-N	537.263899482							95473
BRD-K99452176	LSM-14535		54654358	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26+,28-/m0/s1	WCNQFBRPFNRKRV-AQHOXQCLSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc5ccc(NS(=O)(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K99452176	BRD-K99452176-001-01-6	Broad Institute of MIT and Harvard	BRD-K99452176			CN1[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc2ccc(NS(=O)(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26+,28-/m0/s1	WCNQFBRPFNRKRV-AQHOXQCLSA-N	593.199584664							103190
BRD-K97373677	LSM-14412		54654521	InChI=1S/C26H30ClN3O5/c1-15(2)25(32)29-18-8-11-22-20(12-18)26(33)30(3)21-10-9-19(35-23(21)14-34-22)13-24(31)28-17-6-4-16(27)5-7-17/h4-8,11-12,15,19,21,23H,9-10,13-14H2,1-3H3,(H,28,31)(H,29,32)/t19-,21+,23-/m1/s1	BJKJBDLJWILHTF-UNWVZKJWSA-N	CC(C)C(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4ccc(Cl)cc4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K97373677	BRD-K97373677-001-02-8	Broad Institute of MIT and Harvard	BRD-K97373677			CC(C)C(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4ccc(Cl)cc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C26H30ClN3O5/c1-15(2)25(32)29-18-8-11-22-20(12-18)26(33)30(3)21-10-9-19(35-23(21)14-34-22)13-24(31)28-17-6-4-16(27)5-7-17/h4-8,11-12,15,19,21,23H,9-10,13-14H2,1-3H3,(H,28,31)(H,29,32)/t19-,21+,23-/m1/s1	BJKJBDLJWILHTF-UNWVZKJWSA-N	499.1873988							131231
BRD-K58991610	LSM-11992		54654360	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26-,28+/m1/s1	WCNQFBRPFNRKRV-RJRADHEHSA-N	CN1[C@@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc5ccc(NS(=O)(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K58991610	BRD-K58991610-001-01-6	Broad Institute of MIT and Harvard	BRD-K58991610			CN1[C@@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc2ccc(NS(=O)(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26-,28+/m1/s1	WCNQFBRPFNRKRV-RJRADHEHSA-N	593.199584664							100618
BRD-K09068728	LSM-8979		54654453	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19+,21-/m0/s1	KEGRQPVLAXHQPZ-DLVCFXQMSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC(F)(F)F)O[C@H]2COc3ccc(NC(=O)c4ccccc4Cl)cc3C1=O	BroadT	BRD-K09068728	BRD-K09068728-001-01-2	Broad Institute of MIT and Harvard	BRD-K09068728			CN1[C@@H]2CC[C@@H](CC(=O)NCC(F)(F)F)O[C@H]2COc2ccc(NC(=O)c3ccccc3Cl)cc2C1=O	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19+,21-/m0/s1	KEGRQPVLAXHQPZ-DLVCFXQMSA-N	539.14348324							97600
BRD-K07244661	LSM-8853		54654553	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20+,22-/m0/s1	VIDGDBZXEWMIQL-DWLFOUALSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K07244661	BRD-K07244661-001-01-0	Broad Institute of MIT and Harvard	BRD-K07244661			CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20+,22-/m0/s1	VIDGDBZXEWMIQL-DWLFOUALSA-N	469.201299226							97474
BRD-K36681355	LSM-10647		54654388	InChI=1S/C26H29F3N4O5/c1-15-3-5-16(6-4-15)31-25(36)32-17-7-10-21-19(11-17)24(35)33(2)20-9-8-18(38-22(20)13-37-21)12-23(34)30-14-26(27,28)29/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,30,34)(H2,31,32,36)/t18-,20+,22-/m1/s1	PPTVZYJXLGYDRY-KAGYGMCKSA-N	CN1[C@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc3ccc(NC(=O)Nc4ccc(C)cc4)cc3C1=O	BroadT	BRD-K36681355	BRD-K36681355-001-02-7	Broad Institute of MIT and Harvard	BRD-K36681355			CN1[C@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc2ccc(NC(=O)Nc3ccc(C)cc3)cc2C1=O	InChI=1S/C26H29F3N4O5/c1-15-3-5-16(6-4-15)31-25(36)32-17-7-10-21-19(11-17)24(35)33(2)20-9-8-18(38-22(20)13-37-21)12-23(34)30-14-26(27,28)29/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,30,34)(H2,31,32,36)/t18-,20+,22-/m1/s1	PPTVZYJXLGYDRY-KAGYGMCKSA-N	534.209004668							99268
BRD-K36057770	LSM-10600		54654445	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18+,20+/m0/s1	QTFAPORQFWHYLC-QKYXUNIQSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	BroadT	BRD-K36057770	BRD-K36057770-001-01-9	Broad Institute of MIT and Harvard	BRD-K36057770			COC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18+,20+/m0/s1	QTFAPORQFWHYLC-QKYXUNIQSA-N	508.10709956							99221
BRD-K90132168	LSM-13988		54654349	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27+,29-/m1/s1	UEIQSFPBDLFQGU-WGHVJBFBSA-N	COc1cccc(NC(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)NCCc5ccccc5)CC[C@@H]4N(C)C(=O)c3c2)c1	BroadT	BRD-K90132168	BRD-K90132168-001-02-1	Broad Institute of MIT and Harvard	BRD-K90132168			COc1cccc(NC(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)NCCc5ccccc5)CC[C@@H]4N(C)C(=O)c3c2)c1	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27+,29-/m1/s1	UEIQSFPBDLFQGU-WGHVJBFBSA-N	572.263484912							102641
BRD-K47024121	LSM-11297		54654577	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25-,28-/m0/s1	PQVOHAVDCPBJEV-ULNCZQIZSA-N	COc1ccccc1C(=O)Nc2ccc3OC[C@@H]4O[C@H](CC(=O)NCCc5ccncc5)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K47024121	BRD-K47024121-001-01-2	Broad Institute of MIT and Harvard	BRD-K47024121			COc1ccccc1C(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCCc4ccncc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25-,28-/m0/s1	PQVOHAVDCPBJEV-ULNCZQIZSA-N	558.247834848							99918
BRD-K71761811	LSM-12822		54654504	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19-,21-/m0/s1	VOOHCFNIWPJMMM-CUWPLCDZSA-N	CN1[C@H]2CC[C@@H](CC(=O)NC3CCCCC3)O[C@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K71761811	BRD-K71761811-001-01-3	Broad Institute of MIT and Harvard	BRD-K71761811			CN1[C@H]2CC[C@@H](CC(=O)NC3CCCCC3)O[C@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19-,21-/m0/s1	VOOHCFNIWPJMMM-CUWPLCDZSA-N	479.209006496							101459
BRD-K32803351	LSM-10419		54654406	InChI=1S/C33H33N5O5/c1-38-28-12-11-26(17-31(39)35-24-9-8-21-5-3-6-22(21)15-24)43-30(28)19-42-29-13-10-25(16-27(29)32(38)40)37-33(41)36-23-7-2-4-20(14-23)18-34/h2,4,7-10,13-16,26,28,30H,3,5-6,11-12,17,19H2,1H3,(H,35,39)(H2,36,37,41)/t26-,28+,30-/m1/s1	IIDSWEGAQVAXHO-JNQIMCCTSA-N	CN1[C@H]2CC[C@H](CC(=O)Nc3ccc4CCCc4c3)O[C@@H]2COc5ccc(NC(=O)Nc6cccc(c6)C#N)cc5C1=O	BroadT	BRD-K32803351	BRD-K32803351-001-02-5	Broad Institute of MIT and Harvard	BRD-K32803351			CN1[C@H]2CC[C@H](CC(=O)Nc3ccc4CCCc4c3)O[C@@H]2COc2ccc(NC(=O)Nc3cccc(c3)C#N)cc2C1=O	InChI=1S/C33H33N5O5/c1-38-28-12-11-26(17-31(39)35-24-9-8-21-5-3-6-22(21)15-24)43-30(28)19-42-29-13-10-25(16-27(29)32(38)40)37-33(41)36-23-7-2-4-20(14-23)18-34/h2,4,7-10,13-16,26,28,30H,3,5-6,11-12,17,19H2,1H3,(H,35,39)(H2,36,37,41)/t26-,28+,30-/m1/s1	IIDSWEGAQVAXHO-JNQIMCCTSA-N	579.248169206							99040
CHEMBL2359019	LSM-6852	BRD-K80045183, SID131450728	54654296	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27-/m0/s1	BSKZHQCAOYVBFU-RMDSEJHCSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K80045183	BRD-K80045183-001-01-0	Broad Institute of MIT and Harvard	BRD-K80045183			CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27-/m0/s1	BSKZHQCAOYVBFU-RMDSEJHCSA-N	537.263899482							95473
BRD-K37088230	LSM-10671		54654556	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20+,22+/m0/s1	VIDGDBZXEWMIQL-CZTZKLFOSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K37088230	BRD-K37088230-001-01-7	Broad Institute of MIT and Harvard	BRD-K37088230			CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20+,22+/m0/s1	VIDGDBZXEWMIQL-CZTZKLFOSA-N	469.201299226							99292
BRD-K67242881	LSM-12522		54654403	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23-,25-/m1/s1	IGRBOWQNYYEHHT-GZGNHOFSSA-N	COc1ccc(cc1)C(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)NCC5CC5)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K67242881	BRD-K67242881-001-01-5	Broad Institute of MIT and Harvard	BRD-K67242881			COc1ccc(cc1)C(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCC4CC4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23-,25-/m1/s1	IGRBOWQNYYEHHT-GZGNHOFSSA-N	507.236935806							101153
MLS004342471	LSM-9236	BRD-K13499761	54654447	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18-,20-/m1/s1	QTFAPORQFWHYLC-XFQXTVEOSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	BroadT	BRD-K13499761	BRD-K13499761-001-01-1	Broad Institute of MIT and Harvard	BRD-K13499761			COC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18-,20-/m1/s1	QTFAPORQFWHYLC-XFQXTVEOSA-N	508.10709956							97857
BRD-K94293090	LSM-14209		54654496	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22-,24+/m0/s1	KFDLRFOLOVMTJG-NGYIFUPDSA-N	CN1[C@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K94293090	BRD-K94293090-001-01-2	Broad Institute of MIT and Harvard	BRD-K94293090			CN1[C@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22-,24+/m0/s1	KFDLRFOLOVMTJG-NGYIFUPDSA-N	525.25873389							102863
BRD-K17973355	LSM-9508		54654548	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25-,27-/m0/s1	MRBZRZGKCPBOJB-NOOLENRPSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc4ccc(NC(=O)Nc5ccccc5Cl)cc4C1=O	BroadT	BRD-K17973355	BRD-K17973355-001-01-3	Broad Institute of MIT and Harvard	BRD-K17973355			CN1[C@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc2ccc(NC(=O)Nc3ccccc3Cl)cc2C1=O	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25-,27-/m0/s1	MRBZRZGKCPBOJB-NOOLENRPSA-N	599.251061696							98129
BRD-K78451750	LSM-13225		54654543	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25-,27+/m1/s1	MRBZRZGKCPBOJB-RMXYQJDTSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc4ccc(NC(=O)Nc5ccccc5Cl)cc4C1=O	BroadT	BRD-K78451750	BRD-K78451750-001-01-7	Broad Institute of MIT and Harvard	BRD-K78451750			CN1[C@@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc2ccc(NC(=O)Nc3ccccc3Cl)cc2C1=O	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25-,27+/m1/s1	MRBZRZGKCPBOJB-RMXYQJDTSA-N	599.251061696							101864
BRD-K79929772	LSM-13306		54654459	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26+,28-/m0/s1	IPBHQWGLWRAHKP-YIOBJHAYSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@H]2COc5ccc(NS(=O)(=O)C)cc5C1=O	BroadT	BRD-K79929772	BRD-K79929772-001-01-5	Broad Institute of MIT and Harvard	BRD-K79929772			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26+,28-/m0/s1	IPBHQWGLWRAHKP-YIOBJHAYSA-N	563.209006496							101945
BRD-K67190692	LSM-12517		54654528	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18-,20-/m0/s1	MPULVBUDJGIXBK-QRFRQXIXSA-N	CN1[C@H]2CC[C@@H](CC(=O)O)O[C@H]2COc3ccc(NC(=O)c4cccc(c4)C(F)(F)F)cc3C1=O	BroadT	BRD-K67190692	BRD-K67190692-001-01-5	Broad Institute of MIT and Harvard	BRD-K67190692			CN1[C@H]2CC[C@@H](CC(O)=O)O[C@H]2COc2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2C1=O	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18-,20-/m0/s1	MPULVBUDJGIXBK-QRFRQXIXSA-N	492.150821076							101148
BRD-K29626061	LSM-10224		54654537	InChI=1S/C28H35N5O5/c1-33-23-9-8-20(14-26(34)31-15-18-5-3-2-4-6-18)38-25(23)17-37-24-10-7-19(13-21(24)28(33)36)32-27(35)22-16-29-11-12-30-22/h7,10-13,16,18,20,23,25H,2-6,8-9,14-15,17H2,1H3,(H,31,34)(H,32,35)/t20-,23+,25-/m0/s1	KUAQBUHJEIVZQC-ZWSUVBHBSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cnccn5)cc4C1=O	BroadT	BRD-K29626061	BRD-K29626061-001-01-8	Broad Institute of MIT and Harvard	BRD-K29626061			CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cnccn3)cc2C1=O	InChI=1S/C28H35N5O5/c1-33-23-9-8-20(14-26(34)31-15-18-5-3-2-4-6-18)38-25(23)17-37-24-10-7-19(13-21(24)28(33)36)32-27(35)22-16-29-11-12-30-22/h7,10-13,16,18,20,23,25H,2-6,8-9,14-15,17H2,1H3,(H,31,34)(H,32,35)/t20-,23+,25-/m0/s1	KUAQBUHJEIVZQC-ZWSUVBHBSA-N	521.26381927							98845
BRD-K85099724	LSM-13628		54654505	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19-,21+/m1/s1	VOOHCFNIWPJMMM-QFUCXCTJSA-N	CN1[C@@H]2CC[C@H](CC(=O)NC3CCCCC3)O[C@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K85099724	BRD-K85099724-001-01-8	Broad Institute of MIT and Harvard	BRD-K85099724			CN1[C@@H]2CC[C@H](CC(=O)NC3CCCCC3)O[C@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19-,21+/m1/s1	VOOHCFNIWPJMMM-QFUCXCTJSA-N	479.209006496							102275
BRD-K53410660	LSM-11687		54654449	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18+,20-/m0/s1	QTFAPORQFWHYLC-CVAIRZPRSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	BroadT	BRD-K53410660	BRD-K53410660-001-01-1	Broad Institute of MIT and Harvard	BRD-K53410660			COC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18+,20-/m0/s1	QTFAPORQFWHYLC-CVAIRZPRSA-N	508.10709956							100312
BRD-K48457318-001-01-6	LSM-11376	BRD-K48457318	54654298	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27+/m0/s1	BSKZHQCAOYVBFU-SCTDOJESSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K48457318	BRD-K48457318-001-02-4	Broad Institute of MIT and Harvard	BRD-K48457318			CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27+/m0/s1	BSKZHQCAOYVBFU-SCTDOJESSA-N	537.263899482							99997
BRD-K96329791	LSM-14338		54654533	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18-,20-/m1/s1	MPULVBUDJGIXBK-YVWKXTFCSA-N	CN1[C@@H]2CC[C@H](CC(=O)O)O[C@@H]2COc3ccc(NC(=O)c4cccc(c4)C(F)(F)F)cc3C1=O	BroadT	BRD-K96329791	BRD-K96329791-001-01-4	Broad Institute of MIT and Harvard	BRD-K96329791			CN1[C@@H]2CC[C@H](CC(O)=O)O[C@@H]2COc2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2C1=O	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18-,20-/m1/s1	MPULVBUDJGIXBK-YVWKXTFCSA-N	492.150821076							102992
BRD-K77411261	LSM-13161		54654525	InChI=1S/C24H25FN2O6/c1-27-19-9-8-15(12-22(28)31-2)33-21(19)13-32-20-10-7-14(11-17(20)24(27)30)26-23(29)16-5-3-4-6-18(16)25/h3-7,10-11,15,19,21H,8-9,12-13H2,1-2H3,(H,26,29)/t15-,19-,21-/m1/s1	QVBIDJFZXMTPPC-QFIXIFRTSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4ccccc4F)cc3C(=O)N2C)O1	BroadT	BRD-K77411261	BRD-K77411261-001-01-4	Broad Institute of MIT and Harvard	BRD-K77411261			COC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4ccccc4F)cc3C(=O)N2C)O1	InChI=1S/C24H25FN2O6/c1-27-19-9-8-15(12-22(28)31-2)33-21(19)13-32-20-10-7-14(11-17(20)24(27)30)26-23(29)16-5-3-4-6-18(16)25/h3-7,10-11,15,19,21H,8-9,12-13H2,1-2H3,(H,26,29)/t15-,19-,21-/m1/s1	QVBIDJFZXMTPPC-QFIXIFRTSA-N	456.16966474							101799
BRD-K07760433	LSM-8896		54654550	InChI=1S/C32H30FN3O6S/c1-36-28-15-12-23(18-31(37)34-27-8-4-6-20-5-2-3-7-25(20)27)42-30(28)19-41-29-16-11-22(17-26(29)32(36)38)35-43(39,40)24-13-9-21(33)10-14-24/h2-11,13-14,16-17,23,28,30,35H,12,15,18-19H2,1H3,(H,34,37)/t23-,28+,30-/m1/s1	SDHHLQUBHWDCOR-ACHDSSIZSA-N	CN1[C@H]2CC[C@H](CC(=O)Nc3cccc4ccccc34)O[C@@H]2COc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc5C1=O	BroadT	BRD-K07760433	BRD-K07760433-001-02-0	Broad Institute of MIT and Harvard	BRD-K07760433			CN1[C@H]2CC[C@H](CC(=O)Nc3cccc4ccccc34)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C32H30FN3O6S/c1-36-28-15-12-23(18-31(37)34-27-8-4-6-20-5-2-3-7-25(20)27)42-30(28)19-41-29-16-11-22(17-26(29)32(36)38)35-43(39,40)24-13-9-21(33)10-14-24/h2-11,13-14,16-17,23,28,30,35H,12,15,18-19H2,1H3,(H,34,37)/t23-,28+,30-/m1/s1	SDHHLQUBHWDCOR-ACHDSSIZSA-N	603.1839346							97517
BRD-K92947165	LSM-14127		54654334	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29+,31+/m1/s1	UWMJOJNRDSZDAZ-JUTMGGSISA-N	CN1[C@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K92947165	BRD-K92947165-001-01-5	Broad Institute of MIT and Harvard	BRD-K92947165			CN1[C@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29+,31+/m1/s1	UWMJOJNRDSZDAZ-JUTMGGSISA-N	618.265376692							102781
BRD-K87865140	LSM-13821		54654584	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28-/m0/s1	ADKYEMYUARXISC-YIOBJHAYSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@@H]4O[C@H](CC(=O)NCCCN5CCOCC5)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K87865140	BRD-K87865140-001-01-6	Broad Institute of MIT and Harvard	BRD-K87865140			COc1cccc(c1)C(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCCCN4CCOCC4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28-/m0/s1	ADKYEMYUARXISC-YIOBJHAYSA-N	580.28969966							102471
BRD-K43484121	LSM-11075		54654529	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18-,20+/m1/s1	MPULVBUDJGIXBK-POAQFYNOSA-N	CN1[C@@H]2CC[C@H](CC(=O)O)O[C@H]2COc3ccc(NC(=O)c4cccc(c4)C(F)(F)F)cc3C1=O	BroadT	BRD-K43484121	BRD-K43484121-001-01-2	Broad Institute of MIT and Harvard	BRD-K43484121			CN1[C@@H]2CC[C@H](CC(O)=O)O[C@H]2COc2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2C1=O	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18-,20+/m1/s1	MPULVBUDJGIXBK-POAQFYNOSA-N	492.150821076							99696
BRD-K12738359	LSM-9183		54654581	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25-,28-/m1/s1	PQVOHAVDCPBJEV-WSOLHVCVSA-N	COc1ccccc1C(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)NCCc5ccncc5)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K12738359	BRD-K12738359-001-01-1	Broad Institute of MIT and Harvard	BRD-K12738359			COc1ccccc1C(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCCc4ccncc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25-,28-/m1/s1	PQVOHAVDCPBJEV-WSOLHVCVSA-N	558.247834848							97804
BRD-K19036853	LSM-9569		54654519	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24-,26+/m0/s1	JZXYXAGICCVVHG-LLZJGCNPSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K19036853	BRD-K19036853-001-01-4	Broad Institute of MIT and Harvard	BRD-K19036853			CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24-,26+/m0/s1	JZXYXAGICCVVHG-LLZJGCNPSA-N	527.299536062							98190
CHEMBL2361739	LSM-8809	SID131450858, BRD-K06499413	54654429	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29+,31-/m0/s1	COTLGVLRTBZUTQ-RSGWKFRKSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@H]2COc5ccc(NC(=O)c6cc(C)on6)cc5C1=O	BroadT	BRD-K06499413	BRD-K06499413-001-01-2	Broad Institute of MIT and Harvard	BRD-K06499413			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29+,31-/m0/s1	COTLGVLRTBZUTQ-RSGWKFRKSA-N	594.247834848							97430
BRD-K68018568	LSM-12573		54654392	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17-,19+/m0/s1	RVSYYJUWHXUHRD-VDZJLULYSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCCOC)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K68018568	BRD-K68018568-001-01-8	Broad Institute of MIT and Harvard	BRD-K68018568			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCCOC)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17-,19+/m0/s1	RVSYYJUWHXUHRD-VDZJLULYSA-N	469.188271052							101204
BRD-K66740714	LSM-12494		54654569	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17+,19-/m0/s1	VPEDYPFQYJVQKE-WDYCEAGBSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K66740714	BRD-K66740714-001-01-2	Broad Institute of MIT and Harvard	BRD-K66740714			CN1[C@@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17+,19-/m0/s1	VPEDYPFQYJVQKE-WDYCEAGBSA-N	467.172620988							101125
BRD-K70551857	LSM-12732		54654487	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18+,20-/m1/s1	HJRBVKTVNLVVPO-IMFGXOCKSA-N	CN1[C@H]2CC[C@H](CC(=O)O)O[C@@H]2COc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K70551857	BRD-K70551857-001-02-2	Broad Institute of MIT and Harvard	BRD-K70551857			CN1[C@H]2CC[C@H](CC(O)=O)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18+,20-/m1/s1	HJRBVKTVNLVVPO-IMFGXOCKSA-N	439.17433555							101368
BRD-K16910145	LSM-9449		54654393	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17-,19-/m1/s1	RVSYYJUWHXUHRD-SZVBFZGTSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCCOC)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K16910145	BRD-K16910145-001-01-1	Broad Institute of MIT and Harvard	BRD-K16910145			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCCOC)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17-,19-/m1/s1	RVSYYJUWHXUHRD-SZVBFZGTSA-N	469.188271052							98070
BRD-K99808872	LSM-14562		54654356	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19-,21+/m0/s1	PZXWXIAUASIELU-HFSMHLIXSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	BroadT	BRD-K99808872	BRD-K99808872-001-01-6	Broad Institute of MIT and Harvard	BRD-K99808872			COC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19-,21+/m0/s1	PZXWXIAUASIELU-HFSMHLIXSA-N	472.14011425							103218
BRD-K16255194	LSM-9406		54654401	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23+,25+/m1/s1	IGRBOWQNYYEHHT-VTZPFEBOSA-N	COc1ccc(cc1)C(=O)Nc2ccc3OC[C@@H]4O[C@@H](CC(=O)NCC5CC5)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K16255194	BRD-K16255194-001-01-1	Broad Institute of MIT and Harvard	BRD-K16255194			COc1ccc(cc1)C(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCC4CC4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23+,25+/m1/s1	IGRBOWQNYYEHHT-VTZPFEBOSA-N	507.236935806							98027
BRD-K38123135	LSM-10737		54654310	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22+,24+/m0/s1	YBRLGVDHYMUGPQ-RAHFMFPQSA-N	CCNC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K38123135	BRD-K38123135-001-01-7	Broad Institute of MIT and Harvard	BRD-K38123135			CCNC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22+,24+/m0/s1	YBRLGVDHYMUGPQ-RAHFMFPQSA-N	494.252920228							99358
BRD-K33780441	LSM-10478		54654437	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28-,30+/m1/s1	YIAMBQQGWRAZTQ-MATKXYFRSA-N	CN1[C@@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K33780441	BRD-K33780441-001-01-8	Broad Institute of MIT and Harvard	BRD-K33780441			CN1[C@@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28-,30+/m1/s1	YIAMBQQGWRAZTQ-MATKXYFRSA-N	602.256291046							99099
BRD-K62307953	LSM-12212		54654405	InChI=1S/C24H25F4N3O6S/c1-31-19-7-6-17(11-22(32)29-15-4-2-3-14(25)9-15)37-21(19)12-36-20-8-5-16(10-18(20)23(31)33)30-38(34,35)13-24(26,27)28/h2-5,8-10,17,19,21,30H,6-7,11-13H2,1H3,(H,29,32)/t17-,19+,21-/m1/s1	JANDXLXOJLINPI-SLYNCCJLSA-N	CN1[C@H]2CC[C@H](CC(=O)Nc3cccc(F)c3)O[C@@H]2COc4ccc(NS(=O)(=O)CC(F)(F)F)cc4C1=O	BroadT	BRD-K62307953	BRD-K62307953-001-02-2	Broad Institute of MIT and Harvard	BRD-K62307953			CN1[C@H]2CC[C@H](CC(=O)Nc3cccc(F)c3)O[C@@H]2COc2ccc(NS(=O)(=O)CC(F)(F)F)cc2C1=O	InChI=1S/C24H25F4N3O6S/c1-31-19-7-6-17(11-22(32)29-15-4-2-3-14(25)9-15)37-21(19)12-36-20-8-5-16(10-18(20)23(31)33)30-38(34,35)13-24(26,27)28/h2-5,8-10,17,19,21,30H,6-7,11-13H2,1H3,(H,29,32)/t17-,19+,21-/m1/s1	JANDXLXOJLINPI-SLYNCCJLSA-N	559.14001904							100838
BRD-K56635255	LSM-11853		54654352	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19+,21+/m1/s1	PZXWXIAUASIELU-LMNJBCLMSA-N	COC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	BroadT	BRD-K56635255	BRD-K56635255-001-01-1	Broad Institute of MIT and Harvard	BRD-K56635255			COC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19+,21+/m1/s1	PZXWXIAUASIELU-LMNJBCLMSA-N	472.14011425							100479
BRD-K87445406	LSM-13793		54654366	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22-,24+/m0/s1	HKYXYLDUIXPRSO-ODGPQVTHSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2	BroadT	BRD-K87445406	BRD-K87445406-001-01-6	Broad Institute of MIT and Harvard	BRD-K87445406			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)C4CCOCC4)cc3C(=O)N2C)O1	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22-,24+/m0/s1	HKYXYLDUIXPRSO-ODGPQVTHSA-N	514.279134976							102442
BRD-K19399946	LSM-9597		54654339	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29-,31+/m0/s1	UWMJOJNRDSZDAZ-XQBUTSBISA-N	CN1[C@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K19399946	BRD-K19399946-001-02-3	Broad Institute of MIT and Harvard	BRD-K19399946			CN1[C@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29-,31+/m0/s1	UWMJOJNRDSZDAZ-XQBUTSBISA-N	618.265376692							98218
BRD-K06039860-001-01-4	LSM-8779	BRD-K06039860	54654211	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27-/m0/s1	BSKZHQCAOYVBFU-RELGLDOUSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K06039860	BRD-K06039860-001-01-4	Broad Institute of MIT and Harvard	BRD-K06039860			CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27-/m0/s1	BSKZHQCAOYVBFU-RELGLDOUSA-N	537.263899482							97400
BRD-K65936221-001-01-3	LSM-23244	BRD-K65936221	54654313	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22+,24-/m0/s1	YBRLGVDHYMUGPQ-OMQCEKBZSA-N	CCNC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K65936221	BRD-K65936221-001-01-3	Broad Institute of MIT and Harvard	BRD-K65936221			CCNC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22+,24-/m0/s1	YBRLGVDHYMUGPQ-OMQCEKBZSA-N	494.252920228							111831
BRD-K88058683	LSM-13835		54654595	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,27+/m0/s1	JZWHDUCFLDKMHA-VBANMALSSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc5ccc(NC(=O)C6CCOCC6)cc5C1=O	BroadT	BRD-K88058683	BRD-K88058683-001-01-0	Broad Institute of MIT and Harvard	BRD-K88058683			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C30H35N3O8/c1-33-23-5-4-21(14-28(34)31-15-18-2-6-25-26(12-18)40-17-39-25)41-27(23)16-38-24-7-3-20(13-22(24)30(33)36)32-29(35)19-8-10-37-11-9-19/h2-3,6-7,12-13,19,21,23,27H,4-5,8-11,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,27+/m0/s1	JZWHDUCFLDKMHA-VBANMALSSA-N	565.24241511							102486
BRD-K55743249	LSM-11804		54654469	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21-,23-/m0/s1	MAZJZTZSELFTOO-HARLFGEKSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCc4ccccc4F)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K55743249	BRD-K55743249-001-01-3	Broad Institute of MIT and Harvard	BRD-K55743249			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCc4ccccc4F)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21-,23-/m0/s1	MAZJZTZSELFTOO-HARLFGEKSA-N	519.1839346							100429
BRD-K52123998	LSM-11616		54654417	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23+,25-,27-/m0/s1	IJWLFSVDDGQQHF-STMVPXLDSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K52123998	BRD-K52123998-001-01-4	Broad Institute of MIT and Harvard	BRD-K52123998			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23+,25-,27-/m0/s1	IJWLFSVDDGQQHF-STMVPXLDSA-N	570.251205666							100239
CHEMBL2362635	LSM-10581	BRD-K35841161, SID131450907	54654478	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29-,31-/m1/s1	COTLGVLRTBZUTQ-XOPMNVLASA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@@H]2COc5ccc(NC(=O)c6cc(C)on6)cc5C1=O	BroadT	BRD-K35841161	BRD-K35841161-001-01-4	Broad Institute of MIT and Harvard	BRD-K35841161			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29-,31-/m1/s1	COTLGVLRTBZUTQ-XOPMNVLASA-N	594.247834848							99202
BRD-K87159745	LSM-13773		54654576	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25-,28+/m0/s1	PQVOHAVDCPBJEV-NAYZPBBASA-N	COc1ccccc1C(=O)Nc2ccc3OC[C@H]4O[C@H](CC(=O)NCCc5ccncc5)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K87159745	BRD-K87159745-001-01-3	Broad Institute of MIT and Harvard	BRD-K87159745			COc1ccccc1C(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCCc4ccncc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25-,28+/m0/s1	PQVOHAVDCPBJEV-NAYZPBBASA-N	558.247834848							102422
BRD-K33071234	LSM-10443		54654444	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18+,20+/m1/s1	QTFAPORQFWHYLC-BPAFIMBUSA-N	COC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	BroadT	BRD-K33071234	BRD-K33071234-001-01-3	Broad Institute of MIT and Harvard	BRD-K33071234			COC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccccc4Cl)cc3C(=O)N2C)O1	InChI=1S/C23H25ClN2O7S/c1-26-18-9-8-15(12-22(27)31-2)33-20(18)13-32-19-10-7-14(11-16(19)23(26)28)25-34(29,30)21-6-4-3-5-17(21)24/h3-7,10-11,15,18,20,25H,8-9,12-13H2,1-2H3/t15-,18+,20+/m1/s1	QTFAPORQFWHYLC-BPAFIMBUSA-N	508.10709956							99064
BRD-K03250561	LSM-8635		54654491	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23-,25-/m1/s1	VDMGESCZGFUZFC-GZGNHOFSSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(Cl)cc3)O[C@@H]2COc4ccc(NC(=O)Nc5c(C)onc5C)cc4C1=O	BroadT	BRD-K03250561	BRD-K03250561-001-01-2	Broad Institute of MIT and Harvard	BRD-K03250561			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(Cl)cc3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23-,25-/m1/s1	VDMGESCZGFUZFC-GZGNHOFSSA-N	581.204111504							97256
BRD-K63731274	LSM-12310		54654522	InChI=1S/C24H25FN2O6/c1-27-19-9-8-15(12-22(28)31-2)33-21(19)13-32-20-10-7-14(11-17(20)24(27)30)26-23(29)16-5-3-4-6-18(16)25/h3-7,10-11,15,19,21H,8-9,12-13H2,1-2H3,(H,26,29)/t15-,19+,21-/m0/s1	QVBIDJFZXMTPPC-DLVCFXQMSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4ccccc4F)cc3C(=O)N2C)O1	BroadT	BRD-K63731274	BRD-K63731274-001-01-6	Broad Institute of MIT and Harvard	BRD-K63731274			COC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4ccccc4F)cc3C(=O)N2C)O1	InChI=1S/C24H25FN2O6/c1-27-19-9-8-15(12-22(28)31-2)33-21(19)13-32-20-10-7-14(11-17(20)24(27)30)26-23(29)16-5-3-4-6-18(16)25/h3-7,10-11,15,19,21H,8-9,12-13H2,1-2H3,(H,26,29)/t15-,19+,21-/m0/s1	QVBIDJFZXMTPPC-DLVCFXQMSA-N	456.16966474							100937
BRD-K62628154	LSM-12230		54654483	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18+,20+/m1/s1	HJRBVKTVNLVVPO-KPFFTGBYSA-N	CN1[C@H]2CC[C@H](CC(=O)O)O[C@H]2COc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K62628154	BRD-K62628154-001-01-0	Broad Institute of MIT and Harvard	BRD-K62628154			CN1[C@H]2CC[C@H](CC(O)=O)O[C@H]2COc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18+,20+/m1/s1	HJRBVKTVNLVVPO-KPFFTGBYSA-N	439.17433555							100856
BRD-K35769695	LSM-10575		54654578	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25+,28+/m0/s1	PQVOHAVDCPBJEV-UTOLSJPLSA-N	COc1ccccc1C(=O)Nc2ccc3OC[C@H]4O[C@H](CC(=O)NCCc5ccncc5)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K35769695	BRD-K35769695-001-01-2	Broad Institute of MIT and Harvard	BRD-K35769695			COc1ccccc1C(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCCc4ccncc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25+,28+/m0/s1	PQVOHAVDCPBJEV-UTOLSJPLSA-N	558.247834848							99196
BRD-K10835142	LSM-9087		54654302	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22-,24-/m1/s1	YBRLGVDHYMUGPQ-LWSJSWBQSA-N	CCNC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K10835142	BRD-K10835142-001-01-9	Broad Institute of MIT and Harvard	BRD-K10835142			CCNC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22-,24-/m1/s1	YBRLGVDHYMUGPQ-LWSJSWBQSA-N	494.252920228							97708
BRD-K81882789	LSM-13426		54654326	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29-,31+/m0/s1	UWMJOJNRDSZDAZ-BALKIKAKSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K81882789	BRD-K81882789-001-01-3	Broad Institute of MIT and Harvard	BRD-K81882789			CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29-,31+/m0/s1	UWMJOJNRDSZDAZ-BALKIKAKSA-N	618.265376692							102066
BRD-K42173890	LSM-10989		54654568	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17-,19-/m1/s1	VPEDYPFQYJVQKE-SZVBFZGTSA-N	CN1[C@@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K42173890	BRD-K42173890-001-01-1	Broad Institute of MIT and Harvard	BRD-K42173890			CN1[C@@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17-,19-/m1/s1	VPEDYPFQYJVQKE-SZVBFZGTSA-N	467.172620988							99610
BRD-K95062171	LSM-14257		54654431	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28+,30+/m0/s1	YIAMBQQGWRAZTQ-ZTPXPFPDSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K95062171	BRD-K95062171-001-01-2	Broad Institute of MIT and Harvard	BRD-K95062171			CN1[C@@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28+,30+/m0/s1	YIAMBQQGWRAZTQ-ZTPXPFPDSA-N	602.256291046							102911
BRD-K46255436	LSM-11248		54654609	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28-,30-/m0/s1	YIAMBQQGWRAZTQ-TVGCTAMQSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K46255436	BRD-K46255436-001-01-3	Broad Institute of MIT and Harvard	BRD-K46255436			CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28-,30-/m0/s1	YIAMBQQGWRAZTQ-TVGCTAMQSA-N	602.256291046							99869
BRD-K27006579	LSM-10066		54654368	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22-,24-/m1/s1	HKYXYLDUIXPRSO-KIFXHHALSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2	BroadT	BRD-K27006579	BRD-K27006579-001-01-0	Broad Institute of MIT and Harvard	BRD-K27006579			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)C4CCOCC4)cc3C(=O)N2C)O1	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22-,24-/m1/s1	HKYXYLDUIXPRSO-KIFXHHALSA-N	514.279134976							98687
BRD-K97062166	LSM-14392		54654507	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19+,21-/m0/s1	VOOHCFNIWPJMMM-DSKINZAPSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NC3CCCCC3)O[C@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K97062166	BRD-K97062166-001-01-7	Broad Institute of MIT and Harvard	BRD-K97062166			CN1[C@@H]2CC[C@@H](CC(=O)NC3CCCCC3)O[C@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19+,21-/m0/s1	VOOHCFNIWPJMMM-DSKINZAPSA-N	479.209006496							103046
BRD-K92707657	LSM-14110		54654373	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22+,24-/m0/s1	HKYXYLDUIXPRSO-FJIJXJHWSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2	BroadT	BRD-K92707657	BRD-K92707657-001-01-8	Broad Institute of MIT and Harvard	BRD-K92707657			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)C4CCOCC4)cc3C(=O)N2C)O1	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22+,24-/m0/s1	HKYXYLDUIXPRSO-FJIJXJHWSA-N	514.279134976							102764
BRD-K62638625	LSM-12231		54654480	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18-,20+/m0/s1	HJRBVKTVNLVVPO-XKGZKEIXSA-N	CN1[C@H]2CC[C@@H](CC(=O)O)O[C@@H]2COc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K62638625	BRD-K62638625-001-01-0	Broad Institute of MIT and Harvard	BRD-K62638625			CN1[C@H]2CC[C@@H](CC(O)=O)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18-,20+/m0/s1	HJRBVKTVNLVVPO-XKGZKEIXSA-N	439.17433555							100857
BRD-K57759735	LSM-11923		54654361	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26+,28+/m0/s1	WCNQFBRPFNRKRV-DANFDKMISA-N	CN1[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc5ccc(NS(=O)(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K57759735	BRD-K57759735-001-01-8	Broad Institute of MIT and Harvard	BRD-K57759735			CN1[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26+,28+/m0/s1	WCNQFBRPFNRKRV-DANFDKMISA-N	593.199584664							100549
BRD-K09722997	LSM-9021		54654329	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29+,31+/m0/s1	UWMJOJNRDSZDAZ-HIVSAEHPSA-N	CN1[C@@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K09722997	BRD-K09722997-001-01-8	Broad Institute of MIT and Harvard	BRD-K09722997			CN1[C@@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29+,31+/m0/s1	UWMJOJNRDSZDAZ-HIVSAEHPSA-N	618.265376692							97642
BRD-K50266413	LSM-11488		54654555	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20-,22-/m1/s1	VIDGDBZXEWMIQL-SYYKKAFVSA-N	CN(C)C(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K50266413	BRD-K50266413-001-01-0	Broad Institute of MIT and Harvard	BRD-K50266413			CN(C)C(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20-,22-/m1/s1	VIDGDBZXEWMIQL-SYYKKAFVSA-N	469.201299226							100109
BRD-K34462945	LSM-10510		54654346	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27+,29+/m1/s1	UEIQSFPBDLFQGU-WBJKNQCFSA-N	COc1cccc(NC(=O)Nc2ccc3OC[C@@H]4O[C@@H](CC(=O)NCCc5ccccc5)CC[C@@H]4N(C)C(=O)c3c2)c1	BroadT	BRD-K34462945	BRD-K34462945-001-01-3	Broad Institute of MIT and Harvard	BRD-K34462945			COc1cccc(NC(=O)Nc2ccc3OC[C@@H]4O[C@@H](CC(=O)NCCc5ccccc5)CC[C@@H]4N(C)C(=O)c3c2)c1	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27+,29+/m1/s1	UEIQSFPBDLFQGU-WBJKNQCFSA-N	572.263484912							99131
BRD-K26053980	LSM-14773		54654306	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22+,24-/m1/s1	YBRLGVDHYMUGPQ-HLPIXKIESA-N	CCNC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K26053980	BRD-K26053980-001-01-6	Broad Institute of MIT and Harvard	BRD-K26053980			CCNC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22+,24-/m1/s1	YBRLGVDHYMUGPQ-HLPIXKIESA-N	494.252920228							103429
BRD-K27175304	LSM-10073		54654517	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24-,26-/m0/s1	JZXYXAGICCVVHG-GVUKDKGQSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K27175304	BRD-K27175304-001-01-5	Broad Institute of MIT and Harvard	BRD-K27175304			CN1[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24-,26-/m0/s1	JZXYXAGICCVVHG-GVUKDKGQSA-N	527.299536062							98694
BRD-K37010295	LSM-10667		54654327	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29+,31-/m0/s1	UWMJOJNRDSZDAZ-YMUYJTCNSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K37010295	BRD-K37010295-001-01-3	Broad Institute of MIT and Harvard	BRD-K37010295			CN1[C@@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29+,31-/m0/s1	UWMJOJNRDSZDAZ-YMUYJTCNSA-N	618.265376692							99288
BRD-K89953543	LSM-13975		54654563	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18+,20-/m0/s1	VIAXYKVUXVILCJ-CVAIRZPRSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	BroadT	BRD-K89953543	BRD-K89953543-001-01-1	Broad Institute of MIT and Harvard	BRD-K89953543			COC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18+,20-/m0/s1	VIAXYKVUXVILCJ-CVAIRZPRSA-N	458.151157262							102628
BRD-K35002913	LSM-10533		54654602	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24-,26+/m1/s1	OJLJDVMGKDSXAU-QQSVUBKYSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K35002913	BRD-K35002913-001-01-4	Broad Institute of MIT and Harvard	BRD-K35002913			CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H32N4O5S/c1-33-24-6-5-21(16-27(34)31-13-10-19-8-11-30-12-9-19)38-26(24)18-37-25-7-4-20(15-23(25)29(33)36)32-28(35)17-22-3-2-14-39-22/h2-4,7-9,11-12,14-15,21,24,26H,5-6,10,13,16-18H2,1H3,(H,31,34)(H,32,35)/t21-,24-,26+/m1/s1	OJLJDVMGKDSXAU-QQSVUBKYSA-N	548.209340854							99154
BRD-K69276764	LSM-12650		54654307	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22-,24+/m1/s1	YBRLGVDHYMUGPQ-NKXAJQEDSA-N	CCNC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K69276764	BRD-K69276764-001-01-3	Broad Institute of MIT and Harvard	BRD-K69276764			CCNC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22-,24+/m1/s1	YBRLGVDHYMUGPQ-NKXAJQEDSA-N	494.252920228							101284
BRD-K40454949	LSM-10896		54654474	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29+,31+/m0/s1	COTLGVLRTBZUTQ-QRLJAKNQSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@@H]2COc5ccc(NC(=O)c6cc(C)on6)cc5C1=O	BroadT	BRD-K40454949	BRD-K40454949-001-01-8	Broad Institute of MIT and Harvard	BRD-K40454949			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29+,31+/m0/s1	COTLGVLRTBZUTQ-QRLJAKNQSA-N	594.247834848							99517
BRD-K45924279	LSM-11227		54654516	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24+,26-/m0/s1	JZXYXAGICCVVHG-FBILRYNDSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K45924279	BRD-K45924279-001-01-5	Broad Institute of MIT and Harvard	BRD-K45924279			CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H41N3O6/c1-32-24-9-8-22(16-27(33)30-17-19-5-3-2-4-6-19)38-26(24)18-37-25-10-7-21(15-23(25)29(32)35)31-28(34)20-11-13-36-14-12-20/h7,10,15,19-20,22,24,26H,2-6,8-9,11-14,16-18H2,1H3,(H,30,33)(H,31,34)/t22-,24+,26-/m0/s1	JZXYXAGICCVVHG-FBILRYNDSA-N	527.299536062							99848
BRD-K95608631	LSM-14290		54654470	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21-,23+/m1/s1	MAZJZTZSELFTOO-AAIMPIBUSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCc4ccccc4F)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K95608631	BRD-K95608631-001-01-6	Broad Institute of MIT and Harvard	BRD-K95608631			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCc4ccccc4F)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21-,23+/m1/s1	MAZJZTZSELFTOO-AAIMPIBUSA-N	519.1839346							102944
BRD-K14415573	LSM-9301		54654554	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20+,22+/m1/s1	VIDGDBZXEWMIQL-CBQOVEMMSA-N	CN(C)C(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K14415573	BRD-K14415573-001-01-4	Broad Institute of MIT and Harvard	BRD-K14415573			CN(C)C(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C25H28FN3O5/c1-28(2)23(30)13-18-9-10-20-22(34-18)14-33-21-11-8-17(12-19(21)25(32)29(20)3)27-24(31)15-4-6-16(26)7-5-15/h4-8,11-12,18,20,22H,9-10,13-14H2,1-3H3,(H,27,31)/t18-,20+,22+/m1/s1	VIDGDBZXEWMIQL-CBQOVEMMSA-N	469.201299226							97922
MLS004342460	LSM-12409	BRD-K65310032	54654426	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25-,27+/m1/s1	IJWLFSVDDGQQHF-LADVCJOISA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K65310032	BRD-K65310032-001-01-0	Broad Institute of MIT and Harvard	BRD-K65310032			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25-,27+/m1/s1	IJWLFSVDDGQQHF-LADVCJOISA-N	570.251205666							101036
BRD-K18152229	LSM-9516		54654546	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25+,27+/m0/s1	MRBZRZGKCPBOJB-MAFNXUKGSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc4ccc(NC(=O)Nc5ccccc5Cl)cc4C1=O	BroadT	BRD-K18152229	BRD-K18152229-001-01-7	Broad Institute of MIT and Harvard	BRD-K18152229			CN1[C@@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3Cl)cc2C1=O	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25+,27+/m0/s1	MRBZRZGKCPBOJB-MAFNXUKGSA-N	599.251061696							98137
BRD-K53833823	LSM-11700		54654321	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21-,23-/m1/s1	ANPNCKARMDTJMY-KJXAQDMKSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	BroadT	BRD-K53833823	BRD-K53833823-001-01-8	Broad Institute of MIT and Harvard	BRD-K53833823			COC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21-,23-/m1/s1	ANPNCKARMDTJMY-KJXAQDMKSA-N	481.221285742							100325
BRD-K11749439	LSM-9141		54654509	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19-,21-/m1/s1	VOOHCFNIWPJMMM-YFVAEKQCSA-N	CN1[C@@H]2CC[C@H](CC(=O)NC3CCCCC3)O[C@@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K11749439	BRD-K11749439-001-01-3	Broad Institute of MIT and Harvard	BRD-K11749439			CN1[C@@H]2CC[C@H](CC(=O)NC3CCCCC3)O[C@@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C23H33N3O6S/c1-26-19-10-9-17(13-22(27)24-15-6-4-3-5-7-15)32-21(19)14-31-20-11-8-16(25-33(2,29)30)12-18(20)23(26)28/h8,11-12,15,17,19,21,25H,3-7,9-10,13-14H2,1-2H3,(H,24,27)/t17-,19-,21-/m1/s1	VOOHCFNIWPJMMM-YFVAEKQCSA-N	479.209006496							97762
BRD-K16434151-001-01-3	LSM-9423	BRD-K16434151	54654297	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27+/m1/s1	BSKZHQCAOYVBFU-HYZYYIOASA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K16434151	BRD-K16434151-001-01-3	Broad Institute of MIT and Harvard	BRD-K16434151			CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27+/m1/s1	BSKZHQCAOYVBFU-HYZYYIOASA-N	537.263899482							98044
BRD-K07516181	LSM-8874		54654454	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19+,21+/m1/s1	KEGRQPVLAXHQPZ-JJXUHFIVSA-N	CN1[C@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@H]2COc3ccc(NC(=O)c4ccccc4Cl)cc3C1=O	BroadT	BRD-K07516181	BRD-K07516181-001-01-2	Broad Institute of MIT and Harvard	BRD-K07516181			CN1[C@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@H]2COc2ccc(NC(=O)c3ccccc3Cl)cc2C1=O	InChI=1S/C25H25ClF3N3O5/c1-32-19-8-7-15(11-22(33)30-13-25(27,28)29)37-21(19)12-36-20-9-6-14(10-17(20)24(32)35)31-23(34)16-4-2-3-5-18(16)26/h2-6,9-10,15,19,21H,7-8,11-13H2,1H3,(H,30,33)(H,31,34)/t15-,19+,21+/m1/s1	KEGRQPVLAXHQPZ-JJXUHFIVSA-N	539.14348324							97495
BRD-K06772064	LSM-8829		54654473	InChI=1S/C32H36N6O5/c1-37-27-9-8-24(16-30(39)35-23-11-14-38(19-23)18-21-5-3-2-4-6-21)43-29(27)20-42-28-10-7-22(15-25(28)32(37)41)36-31(40)26-17-33-12-13-34-26/h2-7,10,12-13,15,17,23-24,27,29H,8-9,11,14,16,18-20H2,1H3,(H,35,39)(H,36,40)/t23-,24-,27-,29+/m0/s1	HJSUWZUIIQDZFE-AECHJOTKSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)c6cnccn6)cc5C1=O	BroadT	BRD-K06772064	BRD-K06772064-001-01-4	Broad Institute of MIT and Harvard	BRD-K06772064			CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)c3cnccn3)cc2C1=O	InChI=1S/C32H36N6O5/c1-37-27-9-8-24(16-30(39)35-23-11-14-38(19-23)18-21-5-3-2-4-6-21)43-29(27)20-42-28-10-7-22(15-25(28)32(37)41)36-31(40)26-17-33-12-13-34-26/h2-7,10,12-13,15,17,23-24,27,29H,8-9,11,14,16,18-20H2,1H3,(H,35,39)(H,36,40)/t23-,24-,27-,29+/m0/s1	HJSUWZUIIQDZFE-AECHJOTKSA-N	584.274718312							97450
BRD-K93653328	LSM-14168		54654382	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22+,24-/m1/s1	CMDXATVLXHEPLP-JCTONOIOSA-N	CC(C)NC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCc4ccc(F)cc4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K93653328	BRD-K93653328-001-02-0	Broad Institute of MIT and Harvard	BRD-K93653328			CC(C)NC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCc4ccc(F)cc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22+,24-/m1/s1	CMDXATVLXHEPLP-JCTONOIOSA-N	512.243498396							102822
MLS004342440	LSM-10133	BRD-K28112059	54654527	InChI=1S/C24H25FN2O6/c1-27-19-9-8-15(12-22(28)31-2)33-21(19)13-32-20-10-7-14(11-17(20)24(27)30)26-23(29)16-5-3-4-6-18(16)25/h3-7,10-11,15,19,21H,8-9,12-13H2,1-2H3,(H,26,29)/t15-,19+,21+/m1/s1	QVBIDJFZXMTPPC-JJXUHFIVSA-N	COC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4ccccc4F)cc3C(=O)N2C)O1	BroadT	BRD-K28112059	BRD-K28112059-001-01-4	Broad Institute of MIT and Harvard	BRD-K28112059			COC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4ccccc4F)cc3C(=O)N2C)O1	InChI=1S/C24H25FN2O6/c1-27-19-9-8-15(12-22(28)31-2)33-21(19)13-32-20-10-7-14(11-17(20)24(27)30)26-23(29)16-5-3-4-6-18(16)25/h3-7,10-11,15,19,21H,8-9,12-13H2,1-2H3,(H,26,29)/t15-,19+,21+/m1/s1	QVBIDJFZXMTPPC-JJXUHFIVSA-N	456.16966474							98754
BRD-K17884417	LSM-9503		54654299	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27+/m1/s1	BSKZHQCAOYVBFU-NIYJGHKDSA-N	CN1[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K17884417	BRD-K17884417-001-01-8	Broad Institute of MIT and Harvard	BRD-K17884417			CN1[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27+/m1/s1	BSKZHQCAOYVBFU-NIYJGHKDSA-N	537.263899482							98124
MLS004342525	LSM-10841	BRD-K39669696	54654432	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28-,30-/m0/s1	YIAMBQQGWRAZTQ-MKMJGFKVSA-N	CN1[C@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K39669696	BRD-K39669696-001-01-9	Broad Institute of MIT and Harvard	BRD-K39669696			CN1[C@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28-,30-/m0/s1	YIAMBQQGWRAZTQ-MKMJGFKVSA-N	602.256291046							99462
BRD-K46734661	LSM-11282		54654526	InChI=1S/C24H25FN2O6/c1-27-19-9-8-15(12-22(28)31-2)33-21(19)13-32-20-10-7-14(11-17(20)24(27)30)26-23(29)16-5-3-4-6-18(16)25/h3-7,10-11,15,19,21H,8-9,12-13H2,1-2H3,(H,26,29)/t15-,19-,21-/m0/s1	QVBIDJFZXMTPPC-ZRCAFCQKSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4ccccc4F)cc3C(=O)N2C)O1	BroadT	BRD-K46734661	BRD-K46734661-001-01-3	Broad Institute of MIT and Harvard	BRD-K46734661			COC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4ccccc4F)cc3C(=O)N2C)O1	InChI=1S/C24H25FN2O6/c1-27-19-9-8-15(12-22(28)31-2)33-21(19)13-32-20-10-7-14(11-17(20)24(27)30)26-23(29)16-5-3-4-6-18(16)25/h3-7,10-11,15,19,21H,8-9,12-13H2,1-2H3,(H,26,29)/t15-,19-,21-/m0/s1	QVBIDJFZXMTPPC-ZRCAFCQKSA-N	456.16966474							99903
BRD-K84195635	LSM-13574		54654531	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18+,20-/m0/s1	MPULVBUDJGIXBK-HQRMLTQVSA-N	CN1[C@@H]2CC[C@@H](CC(=O)O)O[C@H]2COc3ccc(NC(=O)c4cccc(c4)C(F)(F)F)cc3C1=O	BroadT	BRD-K84195635	BRD-K84195635-001-01-3	Broad Institute of MIT and Harvard	BRD-K84195635			CN1[C@@H]2CC[C@@H](CC(O)=O)O[C@H]2COc2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2C1=O	InChI=1S/C24H23F3N2O6/c1-29-18-7-6-16(11-21(30)31)35-20(18)12-34-19-8-5-15(10-17(19)23(29)33)28-22(32)13-3-2-4-14(9-13)24(25,26)27/h2-5,8-10,16,18,20H,6-7,11-12H2,1H3,(H,28,32)(H,30,31)/t16-,18+,20-/m0/s1	MPULVBUDJGIXBK-HQRMLTQVSA-N	492.150821076							131220
BRD-K57950796	LSM-11929		54654344	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27-,29-/m1/s1	UEIQSFPBDLFQGU-ONDZYYNLSA-N	COc1cccc(NC(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)NCCc5ccccc5)CC[C@H]4N(C)C(=O)c3c2)c1	BroadT	BRD-K57950796	BRD-K57950796-001-01-9	Broad Institute of MIT and Harvard	BRD-K57950796			COc1cccc(NC(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)NCCc5ccccc5)CC[C@H]4N(C)C(=O)c3c2)c1	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27-,29-/m1/s1	UEIQSFPBDLFQGU-ONDZYYNLSA-N	572.263484912							100555
BRD-K45431864	LSM-11196		54654588	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28+/m0/s1	ADKYEMYUARXISC-DKRHUIDYSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@H]4O[C@H](CC(=O)NCCCN5CCOCC5)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K45431864	BRD-K45431864-001-01-2	Broad Institute of MIT and Harvard	BRD-K45431864			COc1cccc(c1)C(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCCCN4CCOCC4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28+/m0/s1	ADKYEMYUARXISC-DKRHUIDYSA-N	580.28969966							99817
BRD-K95488738	LSM-14281		54654311	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22-,24-/m0/s1	YBRLGVDHYMUGPQ-ZDUIBRFZSA-N	CCNC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K95488738	BRD-K95488738-001-01-5	Broad Institute of MIT and Harvard	BRD-K95488738			CCNC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20+,22-,24-/m0/s1	YBRLGVDHYMUGPQ-ZDUIBRFZSA-N	494.252920228							102935
BRD-K06731779	LSM-8826		54654400	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23+,25+/m0/s1	IGRBOWQNYYEHHT-QQKQFIJSSA-N	COc1ccc(cc1)C(=O)Nc2ccc3OC[C@H]4O[C@H](CC(=O)NCC5CC5)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K06731779	BRD-K06731779-001-01-6	Broad Institute of MIT and Harvard	BRD-K06731779			COc1ccc(cc1)C(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCC4CC4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-31-23-11-10-21(14-26(32)29-15-17-3-4-17)37-25(23)16-36-24-12-7-19(13-22(24)28(31)34)30-27(33)18-5-8-20(35-2)9-6-18/h5-9,12-13,17,21,23,25H,3-4,10-11,14-16H2,1-2H3,(H,29,32)(H,30,33)/t21-,23+,25+/m0/s1	IGRBOWQNYYEHHT-QQKQFIJSSA-N	507.236935806							97447
BRD-K48659337	LSM-11392		54654314	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22+,24+/m0/s1	YBRLGVDHYMUGPQ-HYWXBTQMSA-N	CCNC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K48659337	BRD-K48659337-001-01-4	Broad Institute of MIT and Harvard	BRD-K48659337			CCNC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22+,24+/m0/s1	YBRLGVDHYMUGPQ-HYWXBTQMSA-N	494.252920228							100013
BRD-K49896210	LSM-11458		54654416	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25+,27-/m0/s1	IJWLFSVDDGQQHF-CWWSAELMSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K49896210	BRD-K49896210-001-01-3	Broad Institute of MIT and Harvard	BRD-K49896210			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25+,27-/m0/s1	IJWLFSVDDGQQHF-CWWSAELMSA-N	570.251205666							100079
BRD-K03430401	LSM-8646		54654420	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25+,27+/m0/s1	IJWLFSVDDGQQHF-CFFRGQMRSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K03430401	BRD-K03430401-001-01-4	Broad Institute of MIT and Harvard	BRD-K03430401			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25+,27+/m0/s1	IJWLFSVDDGQQHF-CFFRGQMRSA-N	570.251205666							97267
BRD-K12382140	LSM-9164		54654565	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18-,20+/m1/s1	VIAXYKVUXVILCJ-ZTNFWEORSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	BroadT	BRD-K12382140	BRD-K12382140-001-01-2	Broad Institute of MIT and Harvard	BRD-K12382140			COC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18-,20+/m1/s1	VIAXYKVUXVILCJ-ZTNFWEORSA-N	458.151157262							97785
MLS004342434	LSM-14283	BRD-K95498999	54654463	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26-,28+/m1/s1	IPBHQWGLWRAHKP-INOCPDNRSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@H]2COc5ccc(NS(=O)(=O)C)cc5C1=O	BroadT	BRD-K95498999	BRD-K95498999-001-01-8	Broad Institute of MIT and Harvard	BRD-K95498999			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26-,28+/m1/s1	IPBHQWGLWRAHKP-INOCPDNRSA-N	563.209006496							102937
BRD-K48654093	LSM-11391		54654535	InChI=1S/C28H35N5O5/c1-33-23-9-8-20(14-26(34)31-15-18-5-3-2-4-6-18)38-25(23)17-37-24-10-7-19(13-21(24)28(33)36)32-27(35)22-16-29-11-12-30-22/h7,10-13,16,18,20,23,25H,2-6,8-9,14-15,17H2,1H3,(H,31,34)(H,32,35)/t20-,23-,25+/m1/s1	KUAQBUHJEIVZQC-XRODADMRSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cnccn5)cc4C1=O	BroadT	BRD-K48654093	BRD-K48654093-001-01-9	Broad Institute of MIT and Harvard	BRD-K48654093			CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cnccn3)cc2C1=O	InChI=1S/C28H35N5O5/c1-33-23-9-8-20(14-26(34)31-15-18-5-3-2-4-6-18)38-25(23)17-37-24-10-7-19(13-21(24)28(33)36)32-27(35)22-16-29-11-12-30-22/h7,10-13,16,18,20,23,25H,2-6,8-9,14-15,17H2,1H3,(H,31,34)(H,32,35)/t20-,23-,25+/m1/s1	KUAQBUHJEIVZQC-XRODADMRSA-N	521.26381927							100012
BRD-K23149749	LSM-9830		54654484	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18+,20-/m0/s1	HJRBVKTVNLVVPO-HQRMLTQVSA-N	CN1[C@@H]2CC[C@@H](CC(=O)O)O[C@H]2COc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K23149749	BRD-K23149749-001-01-7	Broad Institute of MIT and Harvard	BRD-K23149749			CN1[C@@H]2CC[C@@H](CC(O)=O)O[C@H]2COc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C23H25N3O6/c1-26-18-9-8-16(12-21(27)28)32-20(18)13-31-19-10-7-15(11-17(19)22(26)29)25-23(30)24-14-5-3-2-4-6-14/h2-7,10-11,16,18,20H,8-9,12-13H2,1H3,(H,27,28)(H2,24,25,30)/t16-,18+,20-/m0/s1	HJRBVKTVNLVVPO-HQRMLTQVSA-N	439.17433555							98451
BRD-K40034561	LSM-10868		54654467	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21-,23-/m1/s1	MAZJZTZSELFTOO-JMUQELJHSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCc4ccccc4F)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K40034561	BRD-K40034561-001-01-5	Broad Institute of MIT and Harvard	BRD-K40034561			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCc4ccccc4F)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21-,23-/m1/s1	MAZJZTZSELFTOO-JMUQELJHSA-N	519.1839346							99489
BRD-K58788895	LSM-11982		54654608	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28+,30+/m0/s1	YIAMBQQGWRAZTQ-JQIAXLDCSA-N	CN1[C@@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K58788895	BRD-K58788895-001-01-2	Broad Institute of MIT and Harvard	BRD-K58788895			CN1[C@@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25+,28+,30+/m0/s1	YIAMBQQGWRAZTQ-JQIAXLDCSA-N	602.256291046							100608
BRD-K59130924	LSM-12001		54654549	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25+,27-/m1/s1	MRBZRZGKCPBOJB-NKPLSRDGSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc4ccc(NC(=O)Nc5ccccc5Cl)cc4C1=O	BroadT	BRD-K59130924	BRD-K59130924-001-02-9	Broad Institute of MIT and Harvard	BRD-K59130924			CN1[C@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3Cl)cc2C1=O	InChI=1S/C30H38ClN5O6/c1-35-25-9-8-21(18-28(37)32-11-4-12-36-13-15-40-16-14-36)42-27(25)19-41-26-10-7-20(17-22(26)29(35)38)33-30(39)34-24-6-3-2-5-23(24)31/h2-3,5-7,10,17,21,25,27H,4,8-9,11-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t21-,25+,27-/m1/s1	MRBZRZGKCPBOJB-NKPLSRDGSA-N	599.251061696							100627
BRD-K99169187	LSM-14522		54654345	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27-,29+/m0/s1	UEIQSFPBDLFQGU-MDZVADFISA-N	COc1cccc(NC(=O)Nc2ccc3OC[C@H]4O[C@H](CC(=O)NCCc5ccccc5)CC[C@@H]4N(C)C(=O)c3c2)c1	BroadT	BRD-K99169187	BRD-K99169187-001-01-3	Broad Institute of MIT and Harvard	BRD-K99169187			COc1cccc(NC(=O)Nc2ccc3OC[C@H]4O[C@H](CC(=O)NCCc5ccccc5)CC[C@@H]4N(C)C(=O)c3c2)c1	InChI=1S/C32H36N4O6/c1-36-27-13-12-25(19-30(37)33-16-15-21-7-4-3-5-8-21)42-29(27)20-41-28-14-11-23(18-26(28)31(36)38)35-32(39)34-22-9-6-10-24(17-22)40-2/h3-11,14,17-18,25,27,29H,12-13,15-16,19-20H2,1-2H3,(H,33,37)(H2,34,35,39)/t25-,27-,29+/m0/s1	UEIQSFPBDLFQGU-MDZVADFISA-N	572.263484912							103177
BRD-K92334440	LSM-14095		54654396	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17+,19-/m1/s1	RVSYYJUWHXUHRD-HHXXYDBFSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCCOC)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K92334440	BRD-K92334440-001-02-1	Broad Institute of MIT and Harvard	BRD-K92334440			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCCOC)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17+,19-/m1/s1	RVSYYJUWHXUHRD-HHXXYDBFSA-N	469.188271052							102749
BRD-K85724483	LSM-13676		54654590	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28-/m1/s1	ADKYEMYUARXISC-MAARLIENSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)NCCCN5CCOCC5)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K85724483	BRD-K85724483-001-02-0	Broad Institute of MIT and Harvard	BRD-K85724483			COc1cccc(c1)C(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCCCN4CCOCC4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28-/m1/s1	ADKYEMYUARXISC-MAARLIENSA-N	580.28969966							102323
BRD-K34238482	LSM-10493		54654362	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26-,28-/m1/s1	WCNQFBRPFNRKRV-KODFZCBSSA-N	CN1[C@@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc5ccc(NS(=O)(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K34238482	BRD-K34238482-001-01-6	Broad Institute of MIT and Harvard	BRD-K34238482			CN1[C@@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-35-26-12-11-23(17-30(36)33-22-14-19-6-2-3-7-20(19)15-22)41-28(26)18-40-27-13-10-21(16-24(27)31(35)37)34-42(38,39)29-9-5-4-8-25(29)32/h2-10,13,16,22-23,26,28,34H,11-12,14-15,17-18H2,1H3,(H,33,36)/t23-,26-,28-/m1/s1	WCNQFBRPFNRKRV-KODFZCBSSA-N	593.199584664							99114
SCHEMBL16984306	LSM-6820	BRD-K09701578	54654332	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29+,31+/m1/s1	UWMJOJNRDSZDAZ-ZREQJXQJSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K09701578	BRD-K09701578-001-01-9	Broad Institute of MIT and Harvard	BRD-K09701578			CN1[C@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29+,31+/m1/s1	UWMJOJNRDSZDAZ-ZREQJXQJSA-N	618.265376692							95441
BRD-K88327759	LSM-13856		54654303	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22-,24+/m1/s1	YBRLGVDHYMUGPQ-QSOCRCLWSA-N	CCNC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K88327759	BRD-K88327759-001-01-8	Broad Institute of MIT and Harvard	BRD-K88327759			CCNC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@H](C)c4ccccc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22-,24+/m1/s1	YBRLGVDHYMUGPQ-QSOCRCLWSA-N	494.252920228							102507
BRD-K36796217	LSM-10655		54654353	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19+,21+/m0/s1	PZXWXIAUASIELU-FBBABVLZSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	BroadT	BRD-K36796217	BRD-K36796217-001-01-3	Broad Institute of MIT and Harvard	BRD-K36796217			COC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4cccc(Cl)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25ClN2O6/c1-27-19-8-7-17(12-22(28)31-2)33-21(19)13-32-20-9-6-16(11-18(20)24(27)30)26-23(29)14-4-3-5-15(25)10-14/h3-6,9-11,17,19,21H,7-8,12-13H2,1-2H3,(H,26,29)/t17-,19+,21+/m0/s1	PZXWXIAUASIELU-FBBABVLZSA-N	472.14011425							99276
BRD-K88897538	LSM-13891		54654415	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23+,25+,27-/m0/s1	IJWLFSVDDGQQHF-UUNMANHLSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K88897538	BRD-K88897538-001-01-8	Broad Institute of MIT and Harvard	BRD-K88897538			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23+,25+,27-/m0/s1	IJWLFSVDDGQQHF-UUNMANHLSA-N	570.251205666							102544
BRD-K79153888	LSM-13265		54654461	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26-,28-/m0/s1	IPBHQWGLWRAHKP-MPYJOUPCSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@H]2COc5ccc(NS(=O)(=O)C)cc5C1=O	BroadT	BRD-K79153888	BRD-K79153888-001-01-3	Broad Institute of MIT and Harvard	BRD-K79153888			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H33N3O6S/c1-33-26-14-13-24(17-29(34)31-18-20-8-10-22(11-9-20)21-6-4-3-5-7-21)39-28(26)19-38-27-15-12-23(32-40(2,36)37)16-25(27)30(33)35/h3-12,15-16,24,26,28,32H,13-14,17-19H2,1-2H3,(H,31,34)/t24-,26-,28-/m0/s1	IPBHQWGLWRAHKP-MPYJOUPCSA-N	563.209006496							101904
BRD-K72064822	LSM-12842		54654369	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22+,24+/m1/s1	HKYXYLDUIXPRSO-SFLYRZDNSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2	BroadT	BRD-K72064822	BRD-K72064822-001-01-8	Broad Institute of MIT and Harvard	BRD-K72064822			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)C4CCOCC4)cc3C(=O)N2C)O1	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22+,24+/m1/s1	HKYXYLDUIXPRSO-SFLYRZDNSA-N	514.279134976							101479
BRD-K16434151-001-01-3	LSM-9423	BRD-K16434151	54654297	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27+/m1/s1	BSKZHQCAOYVBFU-HYZYYIOASA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K16434151	BRD-K16434151-001-02-1	Broad Institute of MIT and Harvard	BRD-K16434151			CN1[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25-,27+/m1/s1	BSKZHQCAOYVBFU-HYZYYIOASA-N	537.263899482							98044
BRD-K86156277	LSM-13706		54654381	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22+,24-/m0/s1	CMDXATVLXHEPLP-FJIJXJHWSA-N	CC(C)NC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCc4ccc(F)cc4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K86156277	BRD-K86156277-001-01-6	Broad Institute of MIT and Harvard	BRD-K86156277			CC(C)NC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCc4ccc(F)cc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22+,24-/m0/s1	CMDXATVLXHEPLP-FJIJXJHWSA-N	512.243498396							102354
BRD-K60354118	LSM-12076		54654413	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24-,26+/m1/s1	XUZKWORPTAYLRR-NOOIUNMQSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K60354118	BRD-K60354118-001-01-0	Broad Institute of MIT and Harvard	BRD-K60354118			CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24-,26+/m1/s1	XUZKWORPTAYLRR-NOOIUNMQSA-N	536.263484912							100702
BRD-K97633445	LSM-14427		54654320	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21-,23+/m1/s1	ANPNCKARMDTJMY-LSWJPFSZSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	BroadT	BRD-K97633445	BRD-K97633445-001-01-8	Broad Institute of MIT and Harvard	BRD-K97633445			COC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21-,23+/m1/s1	ANPNCKARMDTJMY-LSWJPFSZSA-N	481.221285742							103082
BRD-K48923155	LSM-11406		54654323	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21+,23-/m1/s1	ANPNCKARMDTJMY-UNWVZKJWSA-N	COC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	BroadT	BRD-K48923155	BRD-K48923155-001-02-1	Broad Institute of MIT and Harvard	BRD-K48923155			COC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Nc4cc(C)cc(C)c4)cc3C(=O)N2C)O1	InChI=1S/C26H31N3O6/c1-15-9-16(2)11-18(10-15)28-26(32)27-17-5-8-22-20(12-17)25(31)29(3)21-7-6-19(13-24(30)33-4)35-23(21)14-34-22/h5,8-12,19,21,23H,6-7,13-14H2,1-4H3,(H2,27,28,32)/t19-,21+,23-/m1/s1	ANPNCKARMDTJMY-UNWVZKJWSA-N	481.221285742							100027
BRD-K43774268	LSM-11099		54654512	InChI=1S/C29H32N4O6/c1-17(2)18-4-6-19(7-5-18)31-27(34)15-21-9-10-23-26(38-21)16-37-24-11-8-20(14-22(24)29(36)33(23)3)32-28(35)25-12-13-30-39-25/h4-8,11-14,17,21,23,26H,9-10,15-16H2,1-3H3,(H,31,34)(H,32,35)/t21-,23+,26-/m1/s1	QUODLJKPGOERNA-VIICAESSSA-N	CC(C)c1ccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5oncc5)cc4C(=O)N3C)O2)cc1	BroadT	BRD-K43774268	BRD-K43774268-001-02-7	Broad Institute of MIT and Harvard	BRD-K43774268			CC(C)c1ccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5ccno5)cc4C(=O)N3C)O2)cc1	InChI=1S/C29H32N4O6/c1-17(2)18-4-6-19(7-5-18)31-27(34)15-21-9-10-23-26(38-21)16-37-24-11-8-20(14-22(24)29(36)33(23)3)32-28(35)25-12-13-30-39-25/h4-8,11-14,17,21,23,26H,9-10,15-16H2,1-3H3,(H,31,34)(H,32,35)/t21-,23+,26-/m1/s1	QUODLJKPGOERNA-VIICAESSSA-N	532.232184784							99720
BRD-K45543414	LSM-11209		54654338	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29+,31-/m1/s1	UWMJOJNRDSZDAZ-KAPWWEBQSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K45543414	BRD-K45543414-001-01-9	Broad Institute of MIT and Harvard	BRD-K45543414			CN1[C@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29+,31-/m1/s1	UWMJOJNRDSZDAZ-KAPWWEBQSA-N	618.265376692							99830
BRD-K53923750	LSM-11706		54654490	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23-,25+/m1/s1	VDMGESCZGFUZFC-PFATUAPWSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(Cl)cc3)O[C@H]2COc4ccc(NC(=O)Nc5c(C)onc5C)cc4C1=O	BroadT	BRD-K53923750	BRD-K53923750-001-01-4	Broad Institute of MIT and Harvard	BRD-K53923750			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(Cl)cc3)O[C@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H32ClN5O6/c1-16-27(17(2)41-34-16)33-29(38)32-20-8-11-24-22(12-20)28(37)35(3)23-10-9-21(40-25(23)15-39-24)13-26(36)31-14-18-4-6-19(30)7-5-18/h4-8,11-12,21,23,25H,9-10,13-15H2,1-3H3,(H,31,36)(H2,32,33,38)/t21-,23-,25+/m1/s1	VDMGESCZGFUZFC-PFATUAPWSA-N	581.204111504							100331
BRD-K27049144	LSM-10067		54654419	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25-,27-/m0/s1	IJWLFSVDDGQQHF-QNWDWTFCSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K27049144	BRD-K27049144-001-01-6	Broad Institute of MIT and Harvard	BRD-K27049144			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N[C@H]4CCN(Cc5ccccc5)C4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C29H38N4O6S/c1-3-40(36,37)31-21-9-12-26-24(15-21)29(35)32(2)25-11-10-23(39-27(25)19-38-26)16-28(34)30-22-13-14-33(18-22)17-20-7-5-4-6-8-20/h4-9,12,15,22-23,25,27,31H,3,10-11,13-14,16-19H2,1-2H3,(H,30,34)/t22-,23-,25-,27-/m0/s1	IJWLFSVDDGQQHF-QNWDWTFCSA-N	570.251205666							98688
BRD-K25866514	LSM-9997		54654434	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28+,30+/m1/s1	YIAMBQQGWRAZTQ-GIMWIYDJSA-N	CN1[C@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K25866514	BRD-K25866514-001-01-7	Broad Institute of MIT and Harvard	BRD-K25866514			CN1[C@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C33H38N4O5S/c1-36-28-11-10-25(17-31(38)35-24-13-14-37(20-24)19-22-6-3-2-4-7-22)42-30(28)21-41-29-12-9-23(16-27(29)33(36)40)34-32(39)18-26-8-5-15-43-26/h2-9,12,15-16,24-25,28,30H,10-11,13-14,17-21H2,1H3,(H,34,39)(H,35,38)/t24-,25-,28+,30+/m1/s1	YIAMBQQGWRAZTQ-GIMWIYDJSA-N	602.256291046							98618
BRD-K82602524	LSM-13474		54654377	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22+,24+/m1/s1	CMDXATVLXHEPLP-SFLYRZDNSA-N	CC(C)NC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCc4ccc(F)cc4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K82602524	BRD-K82602524-001-01-4	Broad Institute of MIT and Harvard	BRD-K82602524			CC(C)NC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCc4ccc(F)cc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22+,24+/m1/s1	CMDXATVLXHEPLP-SFLYRZDNSA-N	512.243498396							102114
BRD-K24192521	LSM-9892		54654571	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17+,19+/m0/s1	VPEDYPFQYJVQKE-KVSKMBFKSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K24192521	BRD-K24192521-001-01-0	Broad Institute of MIT and Harvard	BRD-K24192521			CN1[C@@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17+,19+/m0/s1	VPEDYPFQYJVQKE-KVSKMBFKSA-N	467.172620988							98513
MLS004342442	LSM-8555	BRD-K02010139	54654391	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17-,19+/m1/s1	RVSYYJUWHXUHRD-SUMDDJOVSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCCOC)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K02010139	BRD-K02010139-001-01-4	Broad Institute of MIT and Harvard	BRD-K02010139			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCCOC)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C21H31N3O7S/c1-4-32(27,28)23-14-5-8-18-16(11-14)21(26)24(2)17-7-6-15(31-19(17)13-30-18)12-20(25)22-9-10-29-3/h5,8,11,15,17,19,23H,4,6-7,9-10,12-13H2,1-3H3,(H,22,25)/t15-,17-,19+/m1/s1	RVSYYJUWHXUHRD-SUMDDJOVSA-N	469.188271052							97176
BRD-K57953517	LSM-11930		54654410	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24-,26+/m0/s1	XUZKWORPTAYLRR-LLZJGCNPSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K57953517	BRD-K57953517-001-01-1	Broad Institute of MIT and Harvard	BRD-K57953517			CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24-,26+/m0/s1	XUZKWORPTAYLRR-LLZJGCNPSA-N	536.263484912							100556
BRD-K57552429	LSM-11911		54654331	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29+,31+/m0/s1	UWMJOJNRDSZDAZ-KRDKWYSMSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K57552429	BRD-K57552429-001-01-8	Broad Institute of MIT and Harvard	BRD-K57552429			CN1[C@@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29+,31+/m0/s1	UWMJOJNRDSZDAZ-KRDKWYSMSA-N	618.265376692							100537
BRD-K17535604	LSM-9482		54654337	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29-,31+/m1/s1	UWMJOJNRDSZDAZ-ZDLWVMCGSA-N	CN1[C@@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K17535604	BRD-K17535604-001-01-9	Broad Institute of MIT and Harvard	BRD-K17535604			CN1[C@@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29-,31+/m1/s1	UWMJOJNRDSZDAZ-ZDLWVMCGSA-N	618.265376692							98103
BRD-K17839088	LSM-9500		54654466	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21+,23+/m0/s1	MAZJZTZSELFTOO-QTGUNEKASA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCc4ccccc4F)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K17839088	BRD-K17839088-001-01-0	Broad Institute of MIT and Harvard	BRD-K17839088			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCc4ccccc4F)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C25H30FN3O6S/c1-3-36(32,33)28-17-8-11-22-19(12-17)25(31)29(2)21-10-9-18(35-23(21)15-34-22)13-24(30)27-14-16-6-4-5-7-20(16)26/h4-8,11-12,18,21,23,28H,3,9-10,13-15H2,1-2H3,(H,27,30)/t18-,21+,23+/m0/s1	MAZJZTZSELFTOO-QTGUNEKASA-N	519.1839346							98121
CHEMBL2359871	LSM-10199	BRD-K29269418, SID131450857	54654428	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29+,31+/m1/s1	COTLGVLRTBZUTQ-ZVAUBVARSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@H]2COc5ccc(NC(=O)c6cc(C)on6)cc5C1=O	BroadT	BRD-K29269418	BRD-K29269418-001-01-7	Broad Institute of MIT and Harvard	BRD-K29269418			CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C34H34N4O6/c1-21-16-28(37-44-21)33(40)36-25-12-15-30-27(17-25)34(41)38(2)29-14-13-26(43-31(29)20-42-30)18-32(39)35-19-22-8-10-24(11-9-22)23-6-4-3-5-7-23/h3-12,15-17,26,29,31H,13-14,18-20H2,1-2H3,(H,35,39)(H,36,40)/t26-,29+,31+/m1/s1	COTLGVLRTBZUTQ-ZVAUBVARSA-N	594.247834848							98820
CHEMBL3188678	LSM-12676	BRD-K69616553	54654564	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18+,20+/m0/s1	VIAXYKVUXVILCJ-QKYXUNIQSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	BroadT	BRD-K69616553	BRD-K69616553-001-01-5	Broad Institute of MIT and Harvard	BRD-K69616553			COC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)Cc4cccs4)cc3C(=O)N2C)O1	InChI=1S/C23H26N2O6S/c1-25-18-7-6-15(11-22(27)29-2)31-20(18)13-30-19-8-5-14(10-17(19)23(25)28)24-21(26)12-16-4-3-9-32-16/h3-5,8-10,15,18,20H,6-7,11-13H2,1-2H3,(H,24,26)/t15-,18+,20+/m0/s1	VIAXYKVUXVILCJ-QKYXUNIQSA-N	458.151157262							101310
BRD-K14971087	LSM-9327		54654336	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29-,31+/m1/s1	UWMJOJNRDSZDAZ-MFOYMVSRSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K14971087	BRD-K14971087-001-01-5	Broad Institute of MIT and Harvard	BRD-K14971087			CN1[C@@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25+,29-,31+/m1/s1	UWMJOJNRDSZDAZ-MFOYMVSRSA-N	618.265376692							97948
BRD-K29813250-001-01-3	LSM-23245	BRD-K29813250	54654312	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22-,24+/m0/s1	YBRLGVDHYMUGPQ-LGCHTUQSSA-N	CCNC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K29813250	BRD-K29813250-001-01-3	Broad Institute of MIT and Harvard	BRD-K29813250			CCNC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N[C@@H](C)c4ccccc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-28-27(34)30-19-10-13-23-21(14-19)26(33)31(3)22-12-11-20(36-24(22)16-35-23)15-25(32)29-17(2)18-8-6-5-7-9-18/h5-10,13-14,17,20,22,24H,4,11-12,15-16H2,1-3H3,(H,29,32)(H2,28,30,34)/t17-,20-,22-,24+/m0/s1	YBRLGVDHYMUGPQ-LGCHTUQSSA-N	494.252920228							111832
BRD-K07056593	LSM-8845		54654383	InChI=1S/C33H34N4O5/c1-20(2)23-5-4-6-24(15-23)35-31(38)17-26-12-13-28-30(42-26)19-41-29-14-11-25(16-27(29)33(40)37(28)3)36-32(39)22-9-7-21(18-34)8-10-22/h4-11,14-16,20,26,28,30H,12-13,17,19H2,1-3H3,(H,35,38)(H,36,39)/t26-,28+,30-/m1/s1	BQLGAUXSBOMGNX-JNQIMCCTSA-N	CC(C)c1cccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5ccc(cc5)C#N)cc4C(=O)N3C)O2)c1	BroadT	BRD-K07056593	BRD-K07056593-001-02-9	Broad Institute of MIT and Harvard	BRD-K07056593			CC(C)c1cccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5ccc(cc5)C#N)cc4C(=O)N3C)O2)c1	InChI=1S/C33H34N4O5/c1-20(2)23-5-4-6-24(15-23)35-31(38)17-26-12-13-28-30(42-26)19-41-29-14-11-25(16-27(29)33(40)37(28)3)36-32(39)22-9-7-21(18-34)8-10-22/h4-11,14-16,20,26,28,30H,12-13,17,19H2,1-3H3,(H,35,38)(H,36,39)/t26-,28+,30-/m1/s1	BQLGAUXSBOMGNX-JNQIMCCTSA-N	566.252920228							97466
BRD-K18309912	LSM-9526		54654573	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17-,19+/m0/s1	VPEDYPFQYJVQKE-VDZJLULYSA-N	CN1[C@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@@H]2COc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K18309912	BRD-K18309912-001-01-5	Broad Institute of MIT and Harvard	BRD-K18309912			CN1[C@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@@H]2COc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C21H29N3O7S/c1-23-17-5-4-15(12-20(25)24-7-9-29-10-8-24)31-19(17)13-30-18-6-3-14(22-32(2,27)28)11-16(18)21(23)26/h3,6,11,15,17,19,22H,4-5,7-10,12-13H2,1-2H3/t15-,17-,19+/m0/s1	VPEDYPFQYJVQKE-VDZJLULYSA-N	467.172620988							98147
BRD-K95518555	LSM-14284		54654378	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22-,24+/m1/s1	CMDXATVLXHEPLP-BKULYWANSA-N	CC(C)NC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCc4ccc(F)cc4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K95518555	BRD-K95518555-001-01-9	Broad Institute of MIT and Harvard	BRD-K95518555			CC(C)NC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCc4ccc(F)cc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H33FN4O5/c1-16(2)30-27(35)31-19-8-11-23-21(12-19)26(34)32(3)22-10-9-20(37-24(22)15-36-23)13-25(33)29-14-17-4-6-18(28)7-5-17/h4-8,11-12,16,20,22,24H,9-10,13-15H2,1-3H3,(H,29,33)(H2,30,31,35)/t20-,22-,24+/m1/s1	CMDXATVLXHEPLP-BKULYWANSA-N	512.243498396							102938
BRD-K83001027	LSM-13500		54654497	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22-,24-/m1/s1	KFDLRFOLOVMTJG-ZFJSRUIDSA-N	CN1[C@@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K83001027	BRD-K83001027-001-01-0	Broad Institute of MIT and Harvard	BRD-K83001027			CN1[C@@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C27H35N5O6/c1-16-21(14-31(2)30-16)29-25(33)13-19-5-6-22-24(38-19)15-37-23-7-4-18(12-20(23)27(35)32(22)3)28-26(34)17-8-10-36-11-9-17/h4,7,12,14,17,19,22,24H,5-6,8-11,13,15H2,1-3H3,(H,28,34)(H,29,33)/t19-,22-,24-/m1/s1	KFDLRFOLOVMTJG-ZFJSRUIDSA-N	525.25873389							102141
BRD-K43279914	LSM-11060		54654370	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22+,24+/m0/s1	HKYXYLDUIXPRSO-BGWNEDDSSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2	BroadT	BRD-K43279914	BRD-K43279914-001-01-7	Broad Institute of MIT and Harvard	BRD-K43279914			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)C4CCOCC4)cc3C(=O)N2C)O1	InChI=1S/C27H38N4O6/c1-29-9-11-31(12-10-29)25(32)16-20-4-5-22-24(37-20)17-36-23-6-3-19(15-21(23)27(34)30(22)2)28-26(33)18-7-13-35-14-8-18/h3,6,15,18,20,22,24H,4-5,7-14,16-17H2,1-2H3,(H,28,33)/t20-,22+,24+/m0/s1	HKYXYLDUIXPRSO-BGWNEDDSSA-N	514.279134976							99681
BRD-K51181663	LSM-11558		54654579	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25+,28-/m0/s1	PQVOHAVDCPBJEV-DLNIMUOOSA-N	COc1ccccc1C(=O)Nc2ccc3OC[C@@H]4O[C@H](CC(=O)NCCc5ccncc5)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K51181663	BRD-K51181663-001-01-7	Broad Institute of MIT and Harvard	BRD-K51181663			COc1ccccc1C(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCCc4ccncc4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C31H34N4O6/c1-35-25-9-8-22(18-29(36)33-16-13-20-11-14-32-15-12-20)41-28(25)19-40-27-10-7-21(17-24(27)31(35)38)34-30(37)23-5-3-4-6-26(23)39-2/h3-7,10-12,14-15,17,22,25,28H,8-9,13,16,18-19H2,1-2H3,(H,33,36)(H,34,37)/t22-,25+,28-/m0/s1	PQVOHAVDCPBJEV-DLNIMUOOSA-N	558.247834848							100181
BRD-K00663349	LSM-8476		54654407	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24+,26-/m0/s1	XUZKWORPTAYLRR-FBILRYNDSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NC(=O)C5CCOCC5)cc4C1=O	BroadT	BRD-K00663349	BRD-K00663349-001-01-8	Broad Institute of MIT and Harvard	BRD-K00663349			CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NC(=O)C3CCOCC3)cc2C1=O	InChI=1S/C29H36N4O6/c1-33-24-4-3-22(17-27(34)31-13-8-19-6-11-30-12-7-19)39-26(24)18-38-25-5-2-21(16-23(25)29(33)36)32-28(35)20-9-14-37-15-10-20/h2,5-7,11-12,16,20,22,24,26H,3-4,8-10,13-15,17-18H2,1H3,(H,31,34)(H,32,35)/t22-,24+,26-/m0/s1	XUZKWORPTAYLRR-FBILRYNDSA-N	536.263484912							97097
BRD-K16466792	LSM-9424		54654586	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28-/m1/s1	ADKYEMYUARXISC-OROMBRFGSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)NCCCN5CCOCC5)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K16466792	BRD-K16466792-001-01-0	Broad Institute of MIT and Harvard	BRD-K16466792			COc1cccc(c1)C(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCCCN4CCOCC4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C31H40N4O7/c1-34-26-9-8-24(19-29(36)32-11-4-12-35-13-15-40-16-14-35)42-28(26)20-41-27-10-7-22(18-25(27)31(34)38)33-30(37)21-5-3-6-23(17-21)39-2/h3,5-7,10,17-18,24,26,28H,4,8-9,11-16,19-20H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28-/m1/s1	ADKYEMYUARXISC-OROMBRFGSA-N	580.28969966							98045
BRD-K03113036-001-01-9	LSM-6817	BRD-K03113036	54654335	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29-,31-/m1/s1	UWMJOJNRDSZDAZ-SZIVOMCLSA-N	CN1[C@@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)c6ccc(F)c(F)c6)cc5C1=O	BroadT	BRD-K03113036	BRD-K03113036-001-01-9	Broad Institute of MIT and Harvard	BRD-K03113036			CN1[C@@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C34H36F2N4O5/c1-39-29-11-9-25(17-32(41)37-24-13-14-40(19-24)18-21-5-3-2-4-6-21)45-31(29)20-44-30-12-8-23(16-26(30)34(39)43)38-33(42)22-7-10-27(35)28(36)15-22/h2-8,10,12,15-16,24-25,29,31H,9,11,13-14,17-20H2,1H3,(H,37,41)(H,38,42)/t24-,25-,29-,31-/m1/s1	UWMJOJNRDSZDAZ-SZIVOMCLSA-N	618.265376692							95438
BRD-K29111485	LSM-23246		54632290	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-18(27-24(29)19-8-6-7-9-21(19)31-4)10-11-20(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23+/m1/s1	QTTOBGDGRJHAMA-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K29111485	BRD-K29111485-001-01-9	Broad Institute of MIT and Harvard	BRD-K29111485			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-18(27-24(29)19-8-6-7-9-21(19)31-4)10-11-20(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23+/m1/s1	QTTOBGDGRJHAMA-DGGJZMOXSA-N	455.242021186							111833
BRD-K26314798	LSM-23247		54632280	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17+,22-/m1/s1	LUHNOTAECPFVLC-HYFFOGBASA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3cnccn3	BroadT	BRD-K26314798	BRD-K26314798-001-01-4	Broad Institute of MIT and Harvard	BRD-K26314798			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2cnccn2)c1	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17+,22-/m1/s1	LUHNOTAECPFVLC-HYFFOGBASA-N	483.248169206							111834
BRD-K16268355	LSM-23248		54632439	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m1/s1	GLJKQBVQGMWNRJ-IMWIBFENSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K16268355	BRD-K16268355-001-01-9	Broad Institute of MIT and Harvard	BRD-K16268355			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m1/s1	GLJKQBVQGMWNRJ-IMWIBFENSA-N	453.26275663							111835
BRD-K97493608	LSM-23249		54632236	InChI=1S/C25H39N3O6S/c1-17-14-28(24(29)19-9-7-6-8-10-19)18(2)16-34-22-13-20(26-35(5,31)32)11-12-21(22)25(30)27(3)15-23(17)33-4/h11-13,17-19,23,26H,6-10,14-16H2,1-5H3/t17-,18-,23-/m1/s1	JGDPUHQSCGHVAS-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CCCCC3	BroadT	BRD-K97493608	BRD-K97493608-001-01-0	Broad Institute of MIT and Harvard	BRD-K97493608			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCCCC1	InChI=1S/C25H39N3O6S/c1-17-14-28(24(29)19-9-7-6-8-10-19)18(2)16-34-22-13-20(26-35(5,31)32)11-12-21(22)25(30)27(3)15-23(17)33-4/h11-13,17-19,23,26H,6-10,14-16H2,1-5H3/t17-,18-,23-/m1/s1	JGDPUHQSCGHVAS-PMAPCBKXSA-N	509.255956688							111836
BRD-K08607520	LSM-23250		54632470	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18-,23-/m1/s1	PYPATSURXBWVGX-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(CC3CCOCC3)C[C@H]1C	BroadT	BRD-K08607520	BRD-K08607520-001-01-8	Broad Institute of MIT and Harvard	BRD-K08607520			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18-,23-/m1/s1	PYPATSURXBWVGX-PMAPCBKXSA-N	497.255956688							111837
BRD-K82244940	LSM-23251		54632547	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16+,21+/m1/s1	VDBLZQGQIDKANX-XFQAVAEZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CC3CC3	BroadT	BRD-K82244940	BRD-K82244940-001-01-1	Broad Institute of MIT and Harvard	BRD-K82244940			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16+,21+/m1/s1	VDBLZQGQIDKANX-XFQAVAEZSA-N	481.22465656							111838
BRD-K79995507	LSM-23252		54632517	InChI=1S/C24H40N4O4/c1-7-11-25-24(30)26-19-9-10-21-20(13-19)23(29)27(5)15-22(31-6)17(3)14-28(12-8-2)18(4)16-32-21/h9-10,13,17-18,22H,7-8,11-12,14-16H2,1-6H3,(H2,25,26,30)/t17-,18+,22+/m1/s1	RPQYAYCERJLDHX-FGSXEWAUSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(CCC)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K79995507	BRD-K79995507-001-01-8	Broad Institute of MIT and Harvard	BRD-K79995507			CCCNC(=O)Nc1ccc2OC[C@H](C)N(CCC)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H40N4O4/c1-7-11-25-24(30)26-19-9-10-21-20(13-19)23(29)27(5)15-22(31-6)17(3)14-28(12-8-2)18(4)16-32-21/h9-10,13,17-18,22H,7-8,11-12,14-16H2,1-6H3,(H2,25,26,30)/t17-,18+,22+/m1/s1	RPQYAYCERJLDHX-FGSXEWAUSA-N	448.3049558							111839
BRD-K34004579	LSM-23253		54632250	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25-/m0/s1	AQYOFVQGYZLVTG-RPPIVITFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3cccc(F)c3)C[C@@H]1C	BroadT	BRD-K34004579	BRD-K34004579-001-01-6	Broad Institute of MIT and Harvard	BRD-K34004579			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2cccc(F)c2)C[C@@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25-/m0/s1	AQYOFVQGYZLVTG-RPPIVITFSA-N	471.253334798							111840
CHEMBL2355906	LSM-23254	BRD-K93677460, SID131428620	54632371	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-8-7-16(22-20(25)13-27-5)9-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19+/m0/s1	GMHRVVGQOPSCBZ-QMTMVMCOSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K93677460	BRD-K93677460-001-01-9	Broad Institute of MIT and Harvard	BRD-K93677460			COCC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-8-7-16(22-20(25)13-27-5)9-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19+/m0/s1	GMHRVVGQOPSCBZ-QMTMVMCOSA-N	407.242021186							111841
BRD-K47083242	LSM-23255		54632412	InChI=1S/C24H34N4O5/c1-6-11-28-13-16(2)22(31-5)14-27(4)24(30)19-12-18(7-8-20(19)32-15-17(28)3)26-23(29)21-9-10-25-33-21/h7-10,12,16-17,22H,6,11,13-15H2,1-5H3,(H,26,29)/t16-,17+,22+/m0/s1	UNFXJBAXVUFMAS-GSHUGGBRSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3oncc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K47083242	BRD-K47083242-001-01-2	Broad Institute of MIT and Harvard	BRD-K47083242			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccno3)ccc2OC[C@H]1C)OC	InChI=1S/C24H34N4O5/c1-6-11-28-13-16(2)22(31-5)14-27(4)24(30)19-12-18(7-8-20(19)32-15-17(28)3)26-23(29)21-9-10-25-33-21/h7-10,12,16-17,22H,6,11,13-15H2,1-5H3,(H,26,29)/t16-,17+,22+/m0/s1	UNFXJBAXVUFMAS-GSHUGGBRSA-N	458.252920228							111842
BRD-K67602895	LSM-23256		54632511	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18+,23-/m0/s1	ZWOJFBYNCHARNU-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K67602895	BRD-K67602895-001-01-4	Broad Institute of MIT and Harvard	BRD-K67602895			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18+,23-/m0/s1	ZWOJFBYNCHARNU-IXFSTUDKSA-N	460.3049558							111843
BRD-K66690073	LSM-23257		54632454	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	PXVIPBIFKVRXRA-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K66690073	BRD-K66690073-001-01-4	Broad Institute of MIT and Harvard	BRD-K66690073			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	PXVIPBIFKVRXRA-SAHWJRBASA-N	457.237684734							111844
BRD-K76659518-001-01-0	LSM-23258	BRD-K76659518	54632390	InChI=1S/C33H38N4O5S/c1-21-17-37(18-23-10-13-25(40-4)14-11-23)22(2)20-42-28-16-24(12-15-26(28)33(39)36(3)19-29(21)41-5)34-31(38)32-35-27-8-6-7-9-30(27)43-32/h6-16,21-22,29H,17-20H2,1-5H3,(H,34,38)/t21-,22+,29-/m1/s1	AXRPYCYFPRGHTO-UETOGOEVSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)N(Cc5ccc(OC)cc5)C[C@H]1C	BroadT	BRD-K76659518	BRD-K76659518-001-01-0	Broad Institute of MIT and Harvard	BRD-K76659518			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)N(Cc2ccc(OC)cc2)C[C@H]1C	InChI=1S/C33H38N4O5S/c1-21-17-37(18-23-10-13-25(40-4)14-11-23)22(2)20-42-28-16-24(12-15-26(28)33(39)36(3)19-29(21)41-5)34-31(38)32-35-27-8-6-7-9-30(27)43-32/h6-16,21-22,29H,17-20H2,1-5H3,(H,34,38)/t21-,22+,29-/m1/s1	AXRPYCYFPRGHTO-UETOGOEVSA-N	602.256291046							111845
BRD-K02024244	LSM-23259		54632245	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m0/s1	GLJKQBVQGMWNRJ-AXHZCLLHSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K02024244	BRD-K02024244-001-01-7	Broad Institute of MIT and Harvard	BRD-K02024244			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m0/s1	GLJKQBVQGMWNRJ-AXHZCLLHSA-N	453.26275663							111846
BRD-K27172015-001-01-2	LSM-23260	BRD-K27172015	54632256	InChI=1S/C27H36N4O6/c1-18-14-31(25(32)17-35-4)19(2)16-37-23-13-21(29-27(34)28-20-9-7-6-8-10-20)11-12-22(23)26(33)30(3)15-24(18)36-5/h6-13,18-19,24H,14-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24-/m1/s1	HLIQDYQETVADJC-KHCICDEESA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K27172015	BRD-K27172015-001-01-2	Broad Institute of MIT and Harvard	BRD-K27172015			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H36N4O6/c1-18-14-31(25(32)17-35-4)19(2)16-37-23-13-21(29-27(34)28-20-9-7-6-8-10-20)11-12-22(23)26(33)30(3)15-24(18)36-5/h6-13,18-19,24H,14-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24-/m1/s1	HLIQDYQETVADJC-KHCICDEESA-N	512.263484912							111847
CHEMBL2142430	LSM-23261	BRD-K17199106, SID131428749	54632500	InChI=1S/C25H32N4O6/c1-15-11-26-16(2)13-33-21-9-17(5-7-19(21)24(30)29(3)12-23(15)32-4)27-25(31)28-18-6-8-20-22(10-18)35-14-34-20/h5-10,15-16,23,26H,11-14H2,1-4H3,(H2,27,28,31)/t15-,16-,23+/m0/s1	SLXXNDOTBOUXJA-PBPSECFOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K17199106	BRD-K17199106-001-01-7	Broad Institute of MIT and Harvard	BRD-K17199106			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H32N4O6/c1-15-11-26-16(2)13-33-21-9-17(5-7-19(21)24(30)29(3)12-23(15)32-4)27-25(31)28-18-6-8-20-22(10-18)35-14-34-20/h5-10,15-16,23,26H,11-14H2,1-4H3,(H2,27,28,31)/t15-,16-,23+/m0/s1	SLXXNDOTBOUXJA-PBPSECFOSA-N	484.232184784							111848
BRD-K54364215	LSM-23262		54632522	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18+,23+/m1/s1	PYPATSURXBWVGX-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(CC3CCOCC3)C[C@H]1C	BroadT	BRD-K54364215	BRD-K54364215-001-01-9	Broad Institute of MIT and Harvard	BRD-K54364215			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18+,23+/m1/s1	PYPATSURXBWVGX-STSQHVNTSA-N	497.255956688							111849
BRD-K66754362	LSM-23263		54632356	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25+/m0/s1	AQYOFVQGYZLVTG-YYULODDRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3cccc(F)c3)C[C@@H]1C	BroadT	BRD-K66754362	BRD-K66754362-001-01-8	Broad Institute of MIT and Harvard	BRD-K66754362			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2cccc(F)c2)C[C@@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25+/m0/s1	AQYOFVQGYZLVTG-YYULODDRSA-N	471.253334798							111850
BRD-K90092568	LSM-23264		54632448	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-18(27-24(29)19-8-6-7-9-21(19)31-4)10-11-20(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23-/m1/s1	QTTOBGDGRJHAMA-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K90092568	BRD-K90092568-001-01-5	Broad Institute of MIT and Harvard	BRD-K90092568			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-18(27-24(29)19-8-6-7-9-21(19)31-4)10-11-20(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23-/m1/s1	QTTOBGDGRJHAMA-SAHWJRBASA-N	455.242021186							111851
BRD-K66708851	LSM-23265		54632389	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17+,22-/m0/s1	WWIWLTDSUPVNED-JKSBSHDWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K66708851	BRD-K66708851-001-01-2	Broad Institute of MIT and Harvard	BRD-K66708851			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17+,22-/m0/s1	WWIWLTDSUPVNED-JKSBSHDWSA-N	431.278406694							111852
BRD-K52520268	LSM-23266		54632496	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16+,20-/m1/s1	KMNKNOWYKUKVAH-GQIGUUNPSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(CCC(F)(F)F)[C@@H](C)COc2c1	BroadT	BRD-K52520268	BRD-K52520268-001-01-4	Broad Institute of MIT and Harvard	BRD-K52520268			COCC(=O)Nc1ccc2c(OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16+,20-/m1/s1	KMNKNOWYKUKVAH-GQIGUUNPSA-N	489.245055818							111853
BRD-K95007662	LSM-23267		54632462	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16-,20+/m0/s1	KMNKNOWYKUKVAH-TWOQFEAHSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CCC(F)(F)F)[C@@H](C)COc2c1	BroadT	BRD-K95007662	BRD-K95007662-001-01-3	Broad Institute of MIT and Harvard	BRD-K95007662			COCC(=O)Nc1ccc2c(OC[C@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16-,20+/m0/s1	KMNKNOWYKUKVAH-TWOQFEAHSA-N	489.245055818							111854
BRD-K00933790	LSM-23268		54632457	InChI=1S/C25H39N3O6S/c1-17-14-28(24(29)19-9-7-6-8-10-19)18(2)16-34-22-13-20(26-35(5,31)32)11-12-21(22)25(30)27(3)15-23(17)33-4/h11-13,17-19,23,26H,6-10,14-16H2,1-5H3/t17-,18+,23-/m1/s1	JGDPUHQSCGHVAS-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C3CCCCC3	BroadT	BRD-K00933790	BRD-K00933790-001-01-9	Broad Institute of MIT and Harvard	BRD-K00933790			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CCCCC1	InChI=1S/C25H39N3O6S/c1-17-14-28(24(29)19-9-7-6-8-10-19)18(2)16-34-22-13-20(26-35(5,31)32)11-12-21(22)25(30)27(3)15-23(17)33-4/h11-13,17-19,23,26H,6-10,14-16H2,1-5H3/t17-,18+,23-/m1/s1	JGDPUHQSCGHVAS-IEGUWTFLSA-N	509.255956688							111855
BRD-K01296372	LSM-23269		54632499	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19+,25-/m0/s1	HCZWFODQKFSZHJ-CEYNDMKZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc4ccccn4	BroadT	BRD-K01296372	BRD-K01296372-001-01-6	Broad Institute of MIT and Harvard	BRD-K01296372			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc1ccccn1	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19+,25-/m0/s1	HCZWFODQKFSZHJ-CEYNDMKZSA-N	508.268570292							111856
BRD-K81544427	LSM-23270		54632532	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18-,23-/m0/s1	PYPATSURXBWVGX-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(CC3CCOCC3)C[C@@H]1C	BroadT	BRD-K81544427	BRD-K81544427-001-01-7	Broad Institute of MIT and Harvard	BRD-K81544427			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(CC2CCOCC2)C[C@@H]1C	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18-,23-/m0/s1	PYPATSURXBWVGX-BSRJHKFKSA-N	497.255956688							111857
BRD-K88960810	LSM-23271		54632277	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25-/m1/s1	AQYOFVQGYZLVTG-QJMRKGMQSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3cccc(F)c3)C[C@H]1C	BroadT	BRD-K88960810	BRD-K88960810-001-01-3	Broad Institute of MIT and Harvard	BRD-K88960810			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2cccc(F)c2)C[C@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25-/m1/s1	AQYOFVQGYZLVTG-QJMRKGMQSA-N	471.253334798							111858
BRD-K52354895	LSM-23272		54632333	InChI=1S/C33H38N4O5S/c1-21-17-37(18-23-10-13-25(40-4)14-11-23)22(2)20-42-28-16-24(12-15-26(28)33(39)36(3)19-29(21)41-5)34-31(38)32-35-27-8-6-7-9-30(27)43-32/h6-16,21-22,29H,17-20H2,1-5H3,(H,34,38)/t21-,22+,29-/m0/s1	AXRPYCYFPRGHTO-KERYWQKISA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)N(Cc5ccc(OC)cc5)C[C@@H]1C	BroadT	BRD-K52354895	BRD-K52354895-001-01-9	Broad Institute of MIT and Harvard	BRD-K52354895			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)N(Cc2ccc(OC)cc2)C[C@@H]1C	InChI=1S/C33H38N4O5S/c1-21-17-37(18-23-10-13-25(40-4)14-11-23)22(2)20-42-28-16-24(12-15-26(28)33(39)36(3)19-29(21)41-5)34-31(38)32-35-27-8-6-7-9-30(27)43-32/h6-16,21-22,29H,17-20H2,1-5H3,(H,34,38)/t21-,22+,29-/m0/s1	AXRPYCYFPRGHTO-KERYWQKISA-N	602.256291046							111859
BRD-K12399715	LSM-23273		54632347	InChI=1S/C25H39N3O6S/c1-17-14-28(24(29)19-9-7-6-8-10-19)18(2)16-34-22-13-20(26-35(5,31)32)11-12-21(22)25(30)27(3)15-23(17)33-4/h11-13,17-19,23,26H,6-10,14-16H2,1-5H3/t17-,18-,23-/m0/s1	JGDPUHQSCGHVAS-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C3CCCCC3	BroadT	BRD-K12399715	BRD-K12399715-001-01-1	Broad Institute of MIT and Harvard	BRD-K12399715			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CCCCC1	InChI=1S/C25H39N3O6S/c1-17-14-28(24(29)19-9-7-6-8-10-19)18(2)16-34-22-13-20(26-35(5,31)32)11-12-21(22)25(30)27(3)15-23(17)33-4/h11-13,17-19,23,26H,6-10,14-16H2,1-5H3/t17-,18-,23-/m0/s1	JGDPUHQSCGHVAS-BSRJHKFKSA-N	509.255956688							111860
BRD-K40558736	LSM-23274		54632473	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18+,22-/m0/s1	AWYPCRXSVTZAPT-SVMVAKDDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K40558736	BRD-K40558736-001-01-3	Broad Institute of MIT and Harvard	BRD-K40558736			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18+,22-/m0/s1	AWYPCRXSVTZAPT-SVMVAKDDSA-N	491.310769462							111861
BRD-K86903429	LSM-23275		54632381	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22-,28-/m0/s1	PQUKNIWUQFCXJV-VPYPWEPUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4ccccc4	BroadT	BRD-K86903429	BRD-K86903429-001-01-8	Broad Institute of MIT and Harvard	BRD-K86903429			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccc1	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22-,28-/m0/s1	PQUKNIWUQFCXJV-VPYPWEPUSA-N	535.304621442							111862
BRD-K29838935	LSM-23276		54632421	InChI=1S/C27H44N4O4/c1-6-13-28-27(33)29-22-11-12-23-24(14-22)35-18-20(3)31(16-21-9-7-8-10-21)15-19(2)25(34-5)17-30(4)26(23)32/h11-12,14,19-21,25H,6-10,13,15-18H2,1-5H3,(H2,28,29,33)/t19-,20-,25+/m0/s1	MRCAHRJZOZLPQK-ZYLNGJIFSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CC3CCCC3)[C@@H](C)COc2c1	BroadT	BRD-K29838935	BRD-K29838935-001-01-3	Broad Institute of MIT and Harvard	BRD-K29838935			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CCCC3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H44N4O4/c1-6-13-28-27(33)29-22-11-12-23-24(14-22)35-18-20(3)31(16-21-9-7-8-10-21)15-19(2)25(34-5)17-30(4)26(23)32/h11-12,14,19-21,25H,6-10,13,15-18H2,1-5H3,(H2,28,29,33)/t19-,20-,25+/m0/s1	MRCAHRJZOZLPQK-ZYLNGJIFSA-N	488.336255928							111863
BRD-K45762887	LSM-23277		54632248	InChI=1S/C24H34N4O5/c1-6-11-28-13-16(2)22(31-5)14-27(4)24(30)19-12-18(7-8-20(19)32-15-17(28)3)26-23(29)21-9-10-25-33-21/h7-10,12,16-17,22H,6,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m1/s1	UNFXJBAXVUFMAS-YVHKJVDXSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3oncc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K45762887	BRD-K45762887-001-01-3	Broad Institute of MIT and Harvard	BRD-K45762887			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccno3)ccc2OC[C@H]1C)OC	InChI=1S/C24H34N4O5/c1-6-11-28-13-16(2)22(31-5)14-27(4)24(30)19-12-18(7-8-20(19)32-15-17(28)3)26-23(29)21-9-10-25-33-21/h7-10,12,16-17,22H,6,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m1/s1	UNFXJBAXVUFMAS-YVHKJVDXSA-N	458.252920228							111864
BRD-K61522760	LSM-23278		54632537	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m0/s1	UTSKQZKBDSTIJA-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K61522760	BRD-K61522760-001-01-2	Broad Institute of MIT and Harvard	BRD-K61522760			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m0/s1	UTSKQZKBDSTIJA-MFEFFIJZSA-N	488.219033286							111865
BRD-K42679620	LSM-23279		54632312	InChI=1S/C24H40N4O4/c1-7-11-25-24(30)26-19-9-10-21-20(13-19)23(29)27(5)15-22(31-6)17(3)14-28(12-8-2)18(4)16-32-21/h9-10,13,17-18,22H,7-8,11-12,14-16H2,1-6H3,(H2,25,26,30)/t17-,18-,22+/m0/s1	RPQYAYCERJLDHX-NPPFBWRTSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(CCC)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K42679620	BRD-K42679620-001-01-4	Broad Institute of MIT and Harvard	BRD-K42679620			CCCNC(=O)Nc1ccc2OC[C@H](C)N(CCC)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H40N4O4/c1-7-11-25-24(30)26-19-9-10-21-20(13-19)23(29)27(5)15-22(31-6)17(3)14-28(12-8-2)18(4)16-32-21/h9-10,13,17-18,22H,7-8,11-12,14-16H2,1-6H3,(H2,25,26,30)/t17-,18-,22+/m0/s1	RPQYAYCERJLDHX-NPPFBWRTSA-N	448.3049558							111866
BRD-K95656102	LSM-23280		54632328	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,24-/m1/s1	WEHQYIDEIBHSFW-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc3cccnc3	BroadT	BRD-K95656102	BRD-K95656102-001-01-5	Broad Institute of MIT and Harvard	BRD-K95656102			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,24-/m1/s1	WEHQYIDEIBHSFW-NXMSCROESA-N	482.252920228							111867
BRD-K32943057	LSM-23281		54632490	InChI=1S/C25H39N3O6S/c1-17-14-28(24(29)19-9-7-6-8-10-19)18(2)16-34-22-13-20(26-35(5,31)32)11-12-21(22)25(30)27(3)15-23(17)33-4/h11-13,17-19,23,26H,6-10,14-16H2,1-5H3/t17-,18-,23+/m1/s1	JGDPUHQSCGHVAS-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CCCCC3	BroadT	BRD-K32943057	BRD-K32943057-001-01-8	Broad Institute of MIT and Harvard	BRD-K32943057			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCCCC1	InChI=1S/C25H39N3O6S/c1-17-14-28(24(29)19-9-7-6-8-10-19)18(2)16-34-22-13-20(26-35(5,31)32)11-12-21(22)25(30)27(3)15-23(17)33-4/h11-13,17-19,23,26H,6-10,14-16H2,1-5H3/t17-,18-,23+/m1/s1	JGDPUHQSCGHVAS-PNCHPQGNSA-N	509.255956688							111868
BRD-K34232791	LSM-23282		54632424	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17+,23+/m0/s1	PRLREIFIMPFNBP-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K34232791	BRD-K34232791-001-01-5	Broad Institute of MIT and Harvard	BRD-K34232791			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17+,23+/m0/s1	PRLREIFIMPFNBP-YGKZAACZSA-N	509.175119554							111869
BRD-K37277666	LSM-23283		54632413	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21-,27+/m1/s1	CVHVMLMNHJNHLJ-GNMOFYLKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K37277666	BRD-K37277666-001-01-9	Broad Institute of MIT and Harvard	BRD-K37277666			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21-,27+/m1/s1	CVHVMLMNHJNHLJ-GNMOFYLKSA-N	493.294056758							111870
BRD-K47821225	LSM-23284		54632528	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17+,23+/m1/s1	XITJMNWLTPOVPR-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K47821225	BRD-K47821225-001-01-6	Broad Institute of MIT and Harvard	BRD-K47821225			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17+,23+/m1/s1	XITJMNWLTPOVPR-DGGJZMOXSA-N	495.248169206							111871
BRD-K34456337	LSM-23285		54632480	InChI=1S/C27H44N4O4/c1-6-13-28-27(33)29-22-11-12-23-24(14-22)35-18-20(3)31(16-21-9-7-8-10-21)15-19(2)25(34-5)17-30(4)26(23)32/h11-12,14,19-21,25H,6-10,13,15-18H2,1-5H3,(H2,28,29,33)/t19-,20-,25+/m1/s1	MRCAHRJZOZLPQK-FHAGJXEFSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CC3CCCC3)[C@H](C)COc2c1	BroadT	BRD-K34456337	BRD-K34456337-001-01-1	Broad Institute of MIT and Harvard	BRD-K34456337			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CCCC3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H44N4O4/c1-6-13-28-27(33)29-22-11-12-23-24(14-22)35-18-20(3)31(16-21-9-7-8-10-21)15-19(2)25(34-5)17-30(4)26(23)32/h11-12,14,19-21,25H,6-10,13,15-18H2,1-5H3,(H2,28,29,33)/t19-,20-,25+/m1/s1	MRCAHRJZOZLPQK-FHAGJXEFSA-N	488.336255928							111872
BRD-K92776249	LSM-23286		54632531	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,22+/m1/s1	CAPXFCIRSRTCCK-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C3CCC3	BroadT	BRD-K92776249	BRD-K92776249-001-01-8	Broad Institute of MIT and Harvard	BRD-K92776249			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CCC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,22+/m1/s1	CAPXFCIRSRTCCK-VVBPWWLESA-N	445.25767125							111873
BRD-K74300740	LSM-23287		54632507	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20+,27-/m1/s1	QPDXZJGVGOHLSD-IOKPGSKQSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K74300740	BRD-K74300740-001-01-3	Broad Institute of MIT and Harvard	BRD-K74300740			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20+,27-/m1/s1	QPDXZJGVGOHLSD-IOKPGSKQSA-N	509.288971378							111874
BRD-K59194147	LSM-23288		54632307	InChI=1S/C28H36ClN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-10-9-23(31-40(36,37)27-16-32(3)18-30-27)12-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20-,26-/m1/s1	WOBGHNQXJOLRMR-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(Cc4cccc(Cl)c4)C[C@H]1C	BroadT	BRD-K59194147	BRD-K59194147-001-01-8	Broad Institute of MIT and Harvard	BRD-K59194147			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(Cc2cccc(Cl)c2)C[C@H]1C	InChI=1S/C28H36ClN5O5S/c1-19-13-34(14-21-7-6-8-22(29)11-21)20(2)17-39-25-10-9-23(31-40(36,37)27-16-32(3)18-30-27)12-24(25)28(35)33(4)15-26(19)38-5/h6-12,16,18-20,26,31H,13-15,17H2,1-5H3/t19-,20-,26-/m1/s1	WOBGHNQXJOLRMR-XMERXJNXSA-N	589.212567702							111875
BRD-K95678449	LSM-23289		54632407	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-8-7-16(22-20(25)13-27-5)9-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15-,19-/m0/s1	GMHRVVGQOPSCBZ-DOXZYTNZSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K95678449	BRD-K95678449-001-01-1	Broad Institute of MIT and Harvard	BRD-K95678449			COCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-8-7-16(22-20(25)13-27-5)9-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15-,19-/m0/s1	GMHRVVGQOPSCBZ-DOXZYTNZSA-N	407.242021186							111876
BRD-K19327124	LSM-23290		54632300	InChI=1S/C27H44N4O4/c1-6-13-28-27(33)29-22-11-12-23-24(14-22)35-18-20(3)31(16-21-9-7-8-10-21)15-19(2)25(34-5)17-30(4)26(23)32/h11-12,14,19-21,25H,6-10,13,15-18H2,1-5H3,(H2,28,29,33)/t19-,20+,25+/m1/s1	MRCAHRJZOZLPQK-RNHFSVANSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CC3CCCC3)[C@@H](C)COc2c1	BroadT	BRD-K19327124	BRD-K19327124-001-01-0	Broad Institute of MIT and Harvard	BRD-K19327124			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CCCC3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H44N4O4/c1-6-13-28-27(33)29-22-11-12-23-24(14-22)35-18-20(3)31(16-21-9-7-8-10-21)15-19(2)25(34-5)17-30(4)26(23)32/h11-12,14,19-21,25H,6-10,13,15-18H2,1-5H3,(H2,28,29,33)/t19-,20+,25+/m1/s1	MRCAHRJZOZLPQK-RNHFSVANSA-N	488.336255928							111877
BRD-K71817857	LSM-23291		54632374	InChI=1S/C24H34N4O5/c1-6-11-28-13-16(2)22(31-5)14-27(4)24(30)19-12-18(7-8-20(19)32-15-17(28)3)26-23(29)21-9-10-25-33-21/h7-10,12,16-17,22H,6,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m0/s1	UNFXJBAXVUFMAS-PNLZDCPESA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3oncc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K71817857	BRD-K71817857-001-01-8	Broad Institute of MIT and Harvard	BRD-K71817857			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccno3)ccc2OC[C@@H]1C)OC	InChI=1S/C24H34N4O5/c1-6-11-28-13-16(2)22(31-5)14-27(4)24(30)19-12-18(7-8-20(19)32-15-17(28)3)26-23(29)21-9-10-25-33-21/h7-10,12,16-17,22H,6,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m0/s1	UNFXJBAXVUFMAS-PNLZDCPESA-N	458.252920228							111878
BRD-K42400613	LSM-23292		54632468	InChI=1S/C26H33ClN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-19(28-26(34)29-22-9-7-6-8-21(22)27)10-11-20(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24-/m1/s1	VXDVHPQBGXHDCU-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K42400613	BRD-K42400613-001-01-4	Broad Institute of MIT and Harvard	BRD-K42400613			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3Cl)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33ClN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-12-19(28-26(34)29-22-9-7-6-8-21(22)27)10-11-20(23)25(33)30(4)14-24(16)35-5/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24-/m1/s1	VXDVHPQBGXHDCU-HOZJOUCCSA-N	516.213947906							111879
BRD-K44309337	LSM-23293		54632338	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19-,24+/m0/s1	XOGLRDBIQQOPTC-AXHZCLLHSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K44309337	BRD-K44309337-001-01-0	Broad Institute of MIT and Harvard	BRD-K44309337			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19-,24+/m0/s1	XOGLRDBIQQOPTC-AXHZCLLHSA-N	483.284554714							111880
BRD-K69987634	LSM-23294		54632461	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17+,22+/m1/s1	LUHNOTAECPFVLC-JLHGSKIFSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3cnccn3	BroadT	BRD-K69987634	BRD-K69987634-001-01-3	Broad Institute of MIT and Harvard	BRD-K69987634			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2cnccn2)c1	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17+,22+/m1/s1	LUHNOTAECPFVLC-JLHGSKIFSA-N	483.248169206							111881
BRD-K10423475	LSM-23295		54632319	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-18(27-24(29)19-8-6-7-9-21(19)31-4)10-11-20(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23+/m1/s1	QTTOBGDGRJHAMA-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K10423475	BRD-K10423475-001-01-1	Broad Institute of MIT and Harvard	BRD-K10423475			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-18(27-24(29)19-8-6-7-9-21(19)31-4)10-11-20(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23+/m1/s1	QTTOBGDGRJHAMA-QZMQVMSPSA-N	455.242021186							111882
BRD-K85668200	LSM-23296		54632330	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17-,22+/m1/s1	LUHNOTAECPFVLC-YVHKJVDXSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3cnccn3	BroadT	BRD-K85668200	BRD-K85668200-001-01-3	Broad Institute of MIT and Harvard	BRD-K85668200			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2cnccn2)c1	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17-,22+/m1/s1	LUHNOTAECPFVLC-YVHKJVDXSA-N	483.248169206							111883
BRD-K71007902	LSM-23297		54632527	InChI=1S/C25H33F3N4O5S/c1-17-12-32(13-20-7-5-6-10-29-20)18(2)15-37-22-11-19(30-38(34,35)16-25(26,27)28)8-9-21(22)24(33)31(3)14-23(17)36-4/h5-11,17-18,23,30H,12-16H2,1-4H3/t17-,18-,23-/m1/s1	LYNCQHBDOFOCAR-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(Cc3ccccn3)C[C@H]1C	BroadT	BRD-K71007902	BRD-K71007902-001-01-1	Broad Institute of MIT and Harvard	BRD-K71007902			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C25H33F3N4O5S/c1-17-12-32(13-20-7-5-6-10-29-20)18(2)15-37-22-11-19(30-38(34,35)16-25(26,27)28)8-9-21(22)24(33)31(3)14-23(17)36-4/h5-11,17-18,23,30H,12-16H2,1-4H3/t17-,18-,23-/m1/s1	LYNCQHBDOFOCAR-PMAPCBKXSA-N	558.212375486							111884
BRD-K59250830	LSM-23298		54632387	InChI=1S/C27H32F3N3O8S/c1-16-11-33(25(34)18-5-8-21-23(9-18)41-15-40-21)17(2)13-39-22-10-19(31-42(36,37)14-27(28,29)30)6-7-20(22)26(35)32(3)12-24(16)38-4/h5-10,16-17,24,31H,11-15H2,1-4H3/t16-,17-,24-/m0/s1	IFTYRDLVJFCQIR-UAVUOLJFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K59250830	BRD-K59250830-001-01-0	Broad Institute of MIT and Harvard	BRD-K59250830			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H32F3N3O8S/c1-16-11-33(25(34)18-5-8-21-23(9-18)41-15-40-21)17(2)13-39-22-10-19(31-42(36,37)14-27(28,29)30)6-7-20(22)26(35)32(3)12-24(16)38-4/h5-10,16-17,24,31H,11-15H2,1-4H3/t16-,17-,24-/m0/s1	IFTYRDLVJFCQIR-UAVUOLJFSA-N	615.186220304							111885
BRD-K02137331	LSM-23299		54632283	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17+,23+/m1/s1	PRLREIFIMPFNBP-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K02137331	BRD-K02137331-001-01-1	Broad Institute of MIT and Harvard	BRD-K02137331			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17+,23+/m1/s1	PRLREIFIMPFNBP-DGGJZMOXSA-N	509.175119554							111886
BRD-K97343426	LSM-23300		54632399	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20+,27+/m1/s1	QPDXZJGVGOHLSD-JVAFGIKQSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K97343426	BRD-K97343426-001-01-7	Broad Institute of MIT and Harvard	BRD-K97343426			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20+,27+/m1/s1	QPDXZJGVGOHLSD-JVAFGIKQSA-N	509.288971378							111887
BRD-K47584662	LSM-23301		54632475	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18+,23+/m1/s1	ZWOJFBYNCHARNU-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K47584662	BRD-K47584662-001-01-0	Broad Institute of MIT and Harvard	BRD-K47584662			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18+,23+/m1/s1	ZWOJFBYNCHARNU-STSQHVNTSA-N	460.3049558							111888
BRD-K29328556	LSM-23302		54632285	InChI=1S/C26H41N3O5/c1-6-11-29-15-18(2)24(32-5)16-28(4)26(31)22-8-7-21(14-23(22)34-17-19(29)3)27-25(30)20-9-12-33-13-10-20/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m0/s1	YETRFLOTOCCFGD-AXHZCLLHSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H]1C)OC	BroadT	BRD-K29328556	BRD-K29328556-001-01-3	Broad Institute of MIT and Harvard	BRD-K29328556			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H]1C)OC	InChI=1S/C26H41N3O5/c1-6-11-29-15-18(2)24(32-5)16-28(4)26(31)22-8-7-21(14-23(22)34-17-19(29)3)27-25(30)20-9-12-33-13-10-20/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m0/s1	YETRFLOTOCCFGD-AXHZCLLHSA-N	475.304621442							111889
BRD-K46951445	LSM-23303		54632393	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17-,23+/m1/s1	ZTWKONBDQSNZML-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K46951445	BRD-K46951445-001-01-6	Broad Institute of MIT and Harvard	BRD-K46951445			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17-,23+/m1/s1	ZTWKONBDQSNZML-QZMQVMSPSA-N	491.209006496							111890
BRD-K63462027	LSM-23304		54632273	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18-,23+/m1/s1	PYPATSURXBWVGX-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(CC3CCOCC3)C[C@H]1C	BroadT	BRD-K63462027	BRD-K63462027-001-01-8	Broad Institute of MIT and Harvard	BRD-K63462027			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18-,23+/m1/s1	PYPATSURXBWVGX-PNCHPQGNSA-N	497.255956688							111891
BRD-K95839423	LSM-23305		54632239	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17+,23+/m0/s1	XITJMNWLTPOVPR-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K95839423	BRD-K95839423-001-01-9	Broad Institute of MIT and Harvard	BRD-K95839423			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17+,23+/m0/s1	XITJMNWLTPOVPR-YGKZAACZSA-N	495.248169206							111892
BRD-K71486446	LSM-23306		54632359	InChI=1S/C27H32F3N3O8S/c1-16-11-33(25(34)18-5-8-21-23(9-18)41-15-40-21)17(2)13-39-22-10-19(31-42(36,37)14-27(28,29)30)6-7-20(22)26(35)32(3)12-24(16)38-4/h5-10,16-17,24,31H,11-15H2,1-4H3/t16-,17+,24+/m1/s1	IFTYRDLVJFCQIR-KCYKTTMJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K71486446	BRD-K71486446-001-01-0	Broad Institute of MIT and Harvard	BRD-K71486446			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H32F3N3O8S/c1-16-11-33(25(34)18-5-8-21-23(9-18)41-15-40-21)17(2)13-39-22-10-19(31-42(36,37)14-27(28,29)30)6-7-20(22)26(35)32(3)12-24(16)38-4/h5-10,16-17,24,31H,11-15H2,1-4H3/t16-,17+,24+/m1/s1	IFTYRDLVJFCQIR-KCYKTTMJSA-N	615.186220304							111893
BRD-K63757821	LSM-23307		54632255	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15-,19-/m1/s1	ICXHXZJPFKZHMO-SPYBWZPUSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K63757821	BRD-K63757821-001-01-9	Broad Institute of MIT and Harvard	BRD-K63757821			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15-,19-/m1/s1	ICXHXZJPFKZHMO-SPYBWZPUSA-N	495.201476444							111894
BRD-K97157596	LSM-23308		54632460	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23-/m1/s1	ZTWKONBDQSNZML-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K97157596	BRD-K97157596-001-01-5	Broad Institute of MIT and Harvard	BRD-K97157596			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23-/m1/s1	ZTWKONBDQSNZML-SAHWJRBASA-N	491.209006496							111895
BRD-K45904306	LSM-23309		54632513	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18-,22+/m0/s1	AWYPCRXSVTZAPT-NPPFBWRTSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K45904306	BRD-K45904306-001-01-4	Broad Institute of MIT and Harvard	BRD-K45904306			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18-,22+/m0/s1	AWYPCRXSVTZAPT-NPPFBWRTSA-N	491.310769462							111896
BRD-K52868251	LSM-23310		54632432	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-8-7-16(22-20(25)13-27-5)9-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19-/m1/s1	GMHRVVGQOPSCBZ-ZRGWGRIASA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K52868251	BRD-K52868251-001-01-6	Broad Institute of MIT and Harvard	BRD-K52868251			COCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-8-7-16(22-20(25)13-27-5)9-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19-/m1/s1	GMHRVVGQOPSCBZ-ZRGWGRIASA-N	407.242021186							111897
BRD-K73730918	LSM-23311		54632452	InChI=1S/C26H41N3O5/c1-6-11-29-15-18(2)24(32-5)16-28(4)26(31)22-8-7-21(14-23(22)34-17-19(29)3)27-25(30)20-9-12-33-13-10-20/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m1/s1	YETRFLOTOCCFGD-YDIMBITNSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H]1C)OC	BroadT	BRD-K73730918	BRD-K73730918-001-01-8	Broad Institute of MIT and Harvard	BRD-K73730918			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H]1C)OC	InChI=1S/C26H41N3O5/c1-6-11-29-15-18(2)24(32-5)16-28(4)26(31)22-8-7-21(14-23(22)34-17-19(29)3)27-25(30)20-9-12-33-13-10-20/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m1/s1	YETRFLOTOCCFGD-YDIMBITNSA-N	475.304621442							111898
BRD-K33461572	LSM-23312		54632484	InChI=1S/C25H38N4O5/c1-16-12-29(24(31)18-7-8-18)17(2)15-34-21-10-9-19(26-23(30)14-27(3)4)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,30)/t16-,17-,22-/m1/s1	FWVBYTIYRLKGMC-DRSNIGMVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)CN(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CC3	BroadT	BRD-K33461572	BRD-K33461572-001-01-6	Broad Institute of MIT and Harvard	BRD-K33461572			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)CN(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C25H38N4O5/c1-16-12-29(24(31)18-7-8-18)17(2)15-34-21-10-9-19(26-23(30)14-27(3)4)11-20(21)25(32)28(5)13-22(16)33-6/h9-11,16-18,22H,7-8,12-15H2,1-6H3,(H,26,30)/t16-,17-,22-/m1/s1	FWVBYTIYRLKGMC-DRSNIGMVSA-N	474.284220356							111899
BRD-K44856541	LSM-23313		54632431	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25+/m1/s1	AQYOFVQGYZLVTG-UZEJHQAJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3cccc(F)c3)C[C@H]1C	BroadT	BRD-K44856541	BRD-K44856541-001-01-2	Broad Institute of MIT and Harvard	BRD-K44856541			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2cccc(F)c2)C[C@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25+/m1/s1	AQYOFVQGYZLVTG-UZEJHQAJSA-N	471.253334798							111900
BRD-K87044635	LSM-23314		54632433	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18-,23+/m0/s1	ZWOJFBYNCHARNU-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K87044635	BRD-K87044635-001-01-0	Broad Institute of MIT and Harvard	BRD-K87044635			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18-,23+/m0/s1	ZWOJFBYNCHARNU-IUKKYPGJSA-N	460.3049558							111901
BRD-K92444813	LSM-23315		54632284	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16-,20+/m0/s1	KQGPOQXVBLOFLH-TWOQFEAHSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K92444813	BRD-K92444813-001-01-9	Broad Institute of MIT and Harvard	BRD-K92444813			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16-,20+/m0/s1	KQGPOQXVBLOFLH-TWOQFEAHSA-N	485.21957118							111902
BRD-K27618188	LSM-23316		54632268	InChI=1S/C33H38N4O5S/c1-21-17-37(18-23-10-13-25(40-4)14-11-23)22(2)20-42-28-16-24(12-15-26(28)33(39)36(3)19-29(21)41-5)34-31(38)32-35-27-8-6-7-9-30(27)43-32/h6-16,21-22,29H,17-20H2,1-5H3,(H,34,38)/t21-,22-,29-/m1/s1	AXRPYCYFPRGHTO-IEOSBIPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)N(Cc5ccc(OC)cc5)C[C@H]1C	BroadT	BRD-K27618188	BRD-K27618188-001-01-5	Broad Institute of MIT and Harvard	BRD-K27618188			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@@H](C)N(Cc2ccc(OC)cc2)C[C@H]1C	InChI=1S/C33H38N4O5S/c1-21-17-37(18-23-10-13-25(40-4)14-11-23)22(2)20-42-28-16-24(12-15-26(28)33(39)36(3)19-29(21)41-5)34-31(38)32-35-27-8-6-7-9-30(27)43-32/h6-16,21-22,29H,17-20H2,1-5H3,(H,34,38)/t21-,22-,29-/m1/s1	AXRPYCYFPRGHTO-IEOSBIPESA-N	602.256291046							111903
BRD-K07384081	LSM-23317		54632301	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17+,22+/m0/s1	KQYPWNZZGCEQSB-GSHUGGBRSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K07384081	BRD-K07384081-001-01-6	Broad Institute of MIT and Harvard	BRD-K07384081			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17+,22+/m0/s1	KQYPWNZZGCEQSB-GSHUGGBRSA-N	495.240306624							111904
BRD-K36368568	LSM-23318		54632238	InChI=1S/C24H34N4O5/c1-6-11-28-13-16(2)22(31-5)14-27(4)24(30)19-12-18(7-8-20(19)32-15-17(28)3)26-23(29)21-9-10-25-33-21/h7-10,12,16-17,22H,6,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22-/m0/s1	UNFXJBAXVUFMAS-HOIFWPIMSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3oncc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K36368568	BRD-K36368568-001-01-6	Broad Institute of MIT and Harvard	BRD-K36368568			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccno3)ccc2OC[C@@H]1C)OC	InChI=1S/C24H34N4O5/c1-6-11-28-13-16(2)22(31-5)14-27(4)24(30)19-12-18(7-8-20(19)32-15-17(28)3)26-23(29)21-9-10-25-33-21/h7-10,12,16-17,22H,6,11,13-15H2,1-5H3,(H,26,29)/t16-,17-,22-/m0/s1	UNFXJBAXVUFMAS-HOIFWPIMSA-N	458.252920228							111905
BRD-K88274759	LSM-23319		54632303	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m1/s1	VOXXDJJXVVGJRQ-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K88274759	BRD-K88274759-001-01-2	Broad Institute of MIT and Harvard	BRD-K88274759			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m1/s1	VOXXDJJXVVGJRQ-NXMSCROESA-N	469.25767125							111906
BRD-K27597444	LSM-23320		54632344	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18+,23-/m0/s1	PYPATSURXBWVGX-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(CC3CCOCC3)C[C@@H]1C	BroadT	BRD-K27597444	BRD-K27597444-001-01-1	Broad Institute of MIT and Harvard	BRD-K27597444			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(CC2CCOCC2)C[C@@H]1C	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18+,23-/m0/s1	PYPATSURXBWVGX-IXFSTUDKSA-N	497.255956688							111907
BRD-K13526697	LSM-23321		54632357	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16-,23-/m0/s1	WNEJENAGGFCDCH-KXNSMUHISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K13526697	BRD-K13526697-001-01-0	Broad Institute of MIT and Harvard	BRD-K13526697			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16-,23-/m0/s1	WNEJENAGGFCDCH-KXNSMUHISA-N	469.221285742							111908
BRD-K69668687	LSM-23322		54632321	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	SWHZQECMUFTZAT-DFIYOIEZSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K69668687	BRD-K69668687-001-01-5	Broad Institute of MIT and Harvard	BRD-K69668687			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H]1C)OC	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	SWHZQECMUFTZAT-DFIYOIEZSA-N	467.278406694							111909
BRD-K14778436	LSM-23323		54632309	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20-,27-/m1/s1	QPDXZJGVGOHLSD-SEXOINJZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K14778436	BRD-K14778436-001-01-2	Broad Institute of MIT and Harvard	BRD-K14778436			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20-,27-/m1/s1	QPDXZJGVGOHLSD-SEXOINJZSA-N	509.288971378							111910
BRD-K95048194	LSM-23324		54632533	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19+,25+/m0/s1	HCZWFODQKFSZHJ-OSWQYVSFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc4ccccn4	BroadT	BRD-K95048194	BRD-K95048194-001-01-4	Broad Institute of MIT and Harvard	BRD-K95048194			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc1ccccn1	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19+,25+/m0/s1	HCZWFODQKFSZHJ-OSWQYVSFSA-N	508.268570292							111911
BRD-K18070214	LSM-23325		54632233	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23-/m0/s1	XITJMNWLTPOVPR-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K18070214	BRD-K18070214-001-01-8	Broad Institute of MIT and Harvard	BRD-K18070214			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23-/m0/s1	XITJMNWLTPOVPR-QQMNAOGKSA-N	495.248169206							111912
BRD-K03214579	LSM-23326		54632342	InChI=1S/C26H41N3O5/c1-6-11-29-15-18(2)24(32-5)16-28(4)26(31)22-8-7-21(14-23(22)34-17-19(29)3)27-25(30)20-9-12-33-13-10-20/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m0/s1	YETRFLOTOCCFGD-GLDPYIMESA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K03214579	BRD-K03214579-001-01-8	Broad Institute of MIT and Harvard	BRD-K03214579			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	InChI=1S/C26H41N3O5/c1-6-11-29-15-18(2)24(32-5)16-28(4)26(31)22-8-7-21(14-23(22)34-17-19(29)3)27-25(30)20-9-12-33-13-10-20/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m0/s1	YETRFLOTOCCFGD-GLDPYIMESA-N	475.304621442							111913
BRD-K95460104	LSM-23327		54632417	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21+,27+/m1/s1	CVHVMLMNHJNHLJ-BUEREQSYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K95460104	BRD-K95460104-001-01-0	Broad Institute of MIT and Harvard	BRD-K95460104			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21+,27+/m1/s1	CVHVMLMNHJNHLJ-BUEREQSYSA-N	493.294056758							111914
BRD-K42061172	LSM-23328		54632246	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17-,22+/m1/s1	KQYPWNZZGCEQSB-YVHKJVDXSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K42061172	BRD-K42061172-001-01-7	Broad Institute of MIT and Harvard	BRD-K42061172			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17-,22+/m1/s1	KQYPWNZZGCEQSB-YVHKJVDXSA-N	495.240306624							111915
BRD-K51577639	LSM-23329		54632335	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15+,19+/m0/s1	ICXHXZJPFKZHMO-QMTMVMCOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K51577639	BRD-K51577639-001-01-7	Broad Institute of MIT and Harvard	BRD-K51577639			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15+,19+/m0/s1	ICXHXZJPFKZHMO-QMTMVMCOSA-N	495.201476444							111916
BRD-K57184137	LSM-23330		54632404	InChI=1S/C27H36N4O6/c1-18-14-31(25(32)17-35-4)19(2)16-37-23-13-21(29-27(34)28-20-9-7-6-8-10-20)11-12-22(23)26(33)30(3)15-24(18)36-5/h6-13,18-19,24H,14-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24-/m0/s1	HLIQDYQETVADJC-GLDPYIMESA-N	COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K57184137	BRD-K57184137-001-01-3	Broad Institute of MIT and Harvard	BRD-K57184137			COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H36N4O6/c1-18-14-31(25(32)17-35-4)19(2)16-37-23-13-21(29-27(34)28-20-9-7-6-8-10-20)11-12-22(23)26(33)30(3)15-24(18)36-5/h6-13,18-19,24H,14-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24-/m0/s1	HLIQDYQETVADJC-GLDPYIMESA-N	512.263484912							111917
BRD-K81916372	LSM-23331		54632486	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16-,23+/m1/s1	WNEJENAGGFCDCH-LNPFQXMTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K81916372	BRD-K81916372-001-01-2	Broad Institute of MIT and Harvard	BRD-K81916372			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16-,23+/m1/s1	WNEJENAGGFCDCH-LNPFQXMTSA-N	469.221285742							111918
BRD-K95294904	LSM-23332		54632313	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,22-/m1/s1	CAPXFCIRSRTCCK-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C3CCC3	BroadT	BRD-K95294904	BRD-K95294904-001-01-5	Broad Institute of MIT and Harvard	BRD-K95294904			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CCC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,22-/m1/s1	CAPXFCIRSRTCCK-ZMPRRUGASA-N	445.25767125							111919
BRD-K23436510-001-01-5	LSM-23333	BRD-K23436510	54632253	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17-,23-/m1/s1	PRLREIFIMPFNBP-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K23436510	BRD-K23436510-001-01-5	Broad Institute of MIT and Harvard	BRD-K23436510			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17-,23-/m1/s1	PRLREIFIMPFNBP-SEPYTNNBSA-N	509.175119554							111920
BRD-K72807299	LSM-23334		54632518	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22+,28-/m0/s1	PQUKNIWUQFCXJV-TYPXCFOJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccccc4	BroadT	BRD-K72807299	BRD-K72807299-001-01-4	Broad Institute of MIT and Harvard	BRD-K72807299			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22+,28-/m0/s1	PQUKNIWUQFCXJV-TYPXCFOJSA-N	535.304621442							111921
BRD-K14702616	LSM-23335		54632260	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16+,23-/m1/s1	WNEJENAGGFCDCH-VBURHUQHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K14702616	BRD-K14702616-001-01-4	Broad Institute of MIT and Harvard	BRD-K14702616			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16+,23-/m1/s1	WNEJENAGGFCDCH-VBURHUQHSA-N	469.221285742							111922
BRD-K82930531	LSM-23336		54632377	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17-,22-/m0/s1	KQYPWNZZGCEQSB-HOIFWPIMSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K82930531	BRD-K82930531-001-01-0	Broad Institute of MIT and Harvard	BRD-K82930531			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17-,22-/m0/s1	KQYPWNZZGCEQSB-HOIFWPIMSA-N	495.240306624							111923
BRD-K18657361	LSM-23337		54632299	InChI=1S/C27H44N4O4/c1-6-13-28-27(33)29-22-11-12-23-24(14-22)35-18-20(3)31(16-21-9-7-8-10-21)15-19(2)25(34-5)17-30(4)26(23)32/h11-12,14,19-21,25H,6-10,13,15-18H2,1-5H3,(H2,28,29,33)/t19-,20-,25-/m1/s1	MRCAHRJZOZLPQK-UMEGOILYSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(CC3CCCC3)[C@H](C)COc2c1	BroadT	BRD-K18657361	BRD-K18657361-001-01-3	Broad Institute of MIT and Harvard	BRD-K18657361			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CCCC3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H44N4O4/c1-6-13-28-27(33)29-22-11-12-23-24(14-22)35-18-20(3)31(16-21-9-7-8-10-21)15-19(2)25(34-5)17-30(4)26(23)32/h11-12,14,19-21,25H,6-10,13,15-18H2,1-5H3,(H2,28,29,33)/t19-,20-,25-/m1/s1	MRCAHRJZOZLPQK-UMEGOILYSA-N	488.336255928							111924
BRD-K38706080	LSM-23338		54632411	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17-,23+/m0/s1	PRLREIFIMPFNBP-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K38706080	BRD-K38706080-001-01-4	Broad Institute of MIT and Harvard	BRD-K38706080			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17-,23+/m0/s1	PRLREIFIMPFNBP-HKARXFIJSA-N	509.175119554							111925
BRD-K29543978	LSM-23339		54632367	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	SWHZQECMUFTZAT-ZYLNGJIFSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K29543978	BRD-K29543978-001-01-7	Broad Institute of MIT and Harvard	BRD-K29543978			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	SWHZQECMUFTZAT-ZYLNGJIFSA-N	467.278406694							111926
BRD-K73427605	LSM-23340		54632297	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22-,28+/m1/s1	PQUKNIWUQFCXJV-XJGOYTCSSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccccc4	BroadT	BRD-K73427605	BRD-K73427605-001-01-9	Broad Institute of MIT and Harvard	BRD-K73427605			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22-,28+/m1/s1	PQUKNIWUQFCXJV-XJGOYTCSSA-N	535.304621442							111927
BRD-K19106745	LSM-23341		54632505	InChI=1S/C28H37N3O7/c1-18-13-31(14-20-8-6-7-9-22(20)28(34)35)19(2)16-38-24-12-21(29-26(32)17-36-4)10-11-23(24)27(33)30(3)15-25(18)37-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)(H,34,35)/t18-,19-,25-/m1/s1	UNFSHZIULPNSJS-MPCDZSKCSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccc3C(=O)O)[C@H](C)COc2c1	BroadT	BRD-K19106745	BRD-K19106745-001-01-7	Broad Institute of MIT and Harvard	BRD-K19106745			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3C(O)=O)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C28H37N3O7/c1-18-13-31(14-20-8-6-7-9-22(20)28(34)35)19(2)16-38-24-12-21(29-26(32)17-36-4)10-11-23(24)27(33)30(3)15-25(18)37-5/h6-12,18-19,25H,13-17H2,1-5H3,(H,29,32)(H,34,35)/t18-,19-,25-/m1/s1	UNFSHZIULPNSJS-MPCDZSKCSA-N	527.263150554							111928
BRD-K54025526	LSM-23342		54632310	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m0/s1	PWNDPCFAFIGLCA-JXQFQVJHSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K54025526	BRD-K54025526-001-01-0	Broad Institute of MIT and Harvard	BRD-K54025526			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m0/s1	PWNDPCFAFIGLCA-JXQFQVJHSA-N	496.268570292							111929
BRD-K25081075	LSM-23343		54632489	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19-,27-/m0/s1	BPZWTLHMBRUMNW-BATDWUPUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4ccccn4	BroadT	BRD-K25081075	BRD-K25081075-001-01-4	Broad Institute of MIT and Harvard	BRD-K25081075			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccn1	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19-,27-/m0/s1	BPZWTLHMBRUMNW-BATDWUPUSA-N	581.244975606							111930
BRD-K85722200	LSM-23344		54632465	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17-,23+/m1/s1	PRLREIFIMPFNBP-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K85722200	BRD-K85722200-001-01-8	Broad Institute of MIT and Harvard	BRD-K85722200			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17-,23+/m1/s1	PRLREIFIMPFNBP-QZMQVMSPSA-N	509.175119554							111931
BRD-K13309366	LSM-23345		54632420	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,22+/m1/s1	CAPXFCIRSRTCCK-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CCC3	BroadT	BRD-K13309366	BRD-K13309366-001-01-1	Broad Institute of MIT and Harvard	BRD-K13309366			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,22+/m1/s1	CAPXFCIRSRTCCK-MCFFVMPBSA-N	445.25767125							111932
BRD-K41643612	LSM-23346		54632267	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18-,23+/m0/s1	PYPATSURXBWVGX-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(CC3CCOCC3)C[C@@H]1C	BroadT	BRD-K41643612	BRD-K41643612-001-01-1	Broad Institute of MIT and Harvard	BRD-K41643612			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(CC2CCOCC2)C[C@@H]1C	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18-,23+/m0/s1	PYPATSURXBWVGX-IUKKYPGJSA-N	497.255956688							111933
BRD-K82170468	LSM-23347		54632286	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16+,21-/m0/s1	VDBLZQGQIDKANX-MRUHUIDDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC3CC3	BroadT	BRD-K82170468	BRD-K82170468-001-01-0	Broad Institute of MIT and Harvard	BRD-K82170468			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16+,21-/m0/s1	VDBLZQGQIDKANX-MRUHUIDDSA-N	481.22465656							111934
BRD-K56179613	LSM-23348		54632263	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16+,20-/m0/s1	KMNKNOWYKUKVAH-YRNRMSPPSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(CCC(F)(F)F)[C@H](C)COc2c1	BroadT	BRD-K56179613	BRD-K56179613-001-01-7	Broad Institute of MIT and Harvard	BRD-K56179613			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(CCC(F)(F)F)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16+,20-/m0/s1	KMNKNOWYKUKVAH-YRNRMSPPSA-N	489.245055818							111935
BRD-K21927299	LSM-23349		54632469	InChI=1S/C24H40N4O4/c1-7-11-25-24(30)26-19-9-10-21-20(13-19)23(29)27(5)15-22(31-6)17(3)14-28(12-8-2)18(4)16-32-21/h9-10,13,17-18,22H,7-8,11-12,14-16H2,1-6H3,(H2,25,26,30)/t17-,18+,22-/m0/s1	RPQYAYCERJLDHX-SVMVAKDDSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(CCC)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K21927299	BRD-K21927299-001-01-2	Broad Institute of MIT and Harvard	BRD-K21927299			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(CCC)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H40N4O4/c1-7-11-25-24(30)26-19-9-10-21-20(13-19)23(29)27(5)15-22(31-6)17(3)14-28(12-8-2)18(4)16-32-21/h9-10,13,17-18,22H,7-8,11-12,14-16H2,1-6H3,(H2,25,26,30)/t17-,18+,22-/m0/s1	RPQYAYCERJLDHX-SVMVAKDDSA-N	448.3049558							111936
BRD-K51626376	LSM-15146		54632493	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22+,28+/m1/s1	PQUKNIWUQFCXJV-WENCSYSZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccccc4	BroadT	BRD-K51626376	BRD-K51626376-001-01-9	Broad Institute of MIT and Harvard	BRD-K51626376			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22+,28+/m1/s1	PQUKNIWUQFCXJV-WENCSYSZSA-N	535.304621442							103802
BRD-K03467766	LSM-23350		54632276	InChI=1S/C25H35N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h6-13,18-19,24,26H,14-17H2,1-5H3/t18-,19-,24+/m1/s1	BSRUCCSBFZPCQT-IECBHUPTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3ccccc3)C[C@H]1C	BroadT	BRD-K03467766	BRD-K03467766-001-01-5	Broad Institute of MIT and Harvard	BRD-K03467766			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2ccccc2)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h6-13,18-19,24,26H,14-17H2,1-5H3/t18-,19-,24+/m1/s1	BSRUCCSBFZPCQT-IECBHUPTSA-N	489.22974194							111937
BRD-K74211805	LSM-23351		54632544	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19+,25+/m1/s1	JWVSYBUNCRQTID-WYEJZRMESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K74211805	BRD-K74211805-001-01-4	Broad Institute of MIT and Harvard	BRD-K74211805			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19+,25+/m1/s1	JWVSYBUNCRQTID-WYEJZRMESA-N	528.274798524							111938
BRD-K15201964	LSM-23352		54632438	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21-,26-/m0/s1	PEPLWFCUXOTHLS-WOVHNISZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K15201964	BRD-K15201964-001-01-4	Broad Institute of MIT and Harvard	BRD-K15201964			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21-,26-/m0/s1	PEPLWFCUXOTHLS-WOVHNISZSA-N	572.212711672							111939
BRD-K69291887	LSM-23353		54632262	InChI=1S/C24H40N4O4/c1-7-11-25-24(30)26-19-9-10-21-20(13-19)23(29)27(5)15-22(31-6)17(3)14-28(12-8-2)18(4)16-32-21/h9-10,13,17-18,22H,7-8,11-12,14-16H2,1-6H3,(H2,25,26,30)/t17-,18+,22-/m1/s1	RPQYAYCERJLDHX-KGVIQGDOSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(CCC)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K69291887	BRD-K69291887-001-01-4	Broad Institute of MIT and Harvard	BRD-K69291887			CCCNC(=O)Nc1ccc2OC[C@H](C)N(CCC)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H40N4O4/c1-7-11-25-24(30)26-19-9-10-21-20(13-19)23(29)27(5)15-22(31-6)17(3)14-28(12-8-2)18(4)16-32-21/h9-10,13,17-18,22H,7-8,11-12,14-16H2,1-6H3,(H2,25,26,30)/t17-,18+,22-/m1/s1	RPQYAYCERJLDHX-KGVIQGDOSA-N	448.3049558							111940
BRD-K91585756	LSM-23354		54632516	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-18(27-24(29)19-8-6-7-9-21(19)31-4)10-11-20(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23+/m0/s1	QTTOBGDGRJHAMA-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K91585756	BRD-K91585756-001-01-9	Broad Institute of MIT and Harvard	BRD-K91585756			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-18(27-24(29)19-8-6-7-9-21(19)31-4)10-11-20(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23+/m0/s1	QTTOBGDGRJHAMA-YGKZAACZSA-N	455.242021186							111941
BRD-K64732418	LSM-23355		54632364	InChI=1S/C23H33N3O5/c1-14-11-26(16(3)27)15(2)13-31-20-10-18(24-22(28)17-6-7-17)8-9-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,28)/t14-,15+,21-/m0/s1	NHANBWHFHPMELO-ZSDSOXJFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K64732418	BRD-K64732418-001-01-0	Broad Institute of MIT and Harvard	BRD-K64732418			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C23H33N3O5/c1-14-11-26(16(3)27)15(2)13-31-20-10-18(24-22(28)17-6-7-17)8-9-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,28)/t14-,15+,21-/m0/s1	NHANBWHFHPMELO-ZSDSOXJFSA-N	431.242021186							111942
BRD-K61651560	LSM-23356		54632318	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m0/s1	PWNDPCFAFIGLCA-GLDPYIMESA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K61651560	BRD-K61651560-001-01-1	Broad Institute of MIT and Harvard	BRD-K61651560			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m0/s1	PWNDPCFAFIGLCA-GLDPYIMESA-N	496.268570292							111943
BRD-K32170456	LSM-23357		54632281	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17-,22-/m0/s1	WWIWLTDSUPVNED-HOIFWPIMSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K32170456	BRD-K32170456-001-01-5	Broad Institute of MIT and Harvard	BRD-K32170456			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17-,22-/m0/s1	WWIWLTDSUPVNED-HOIFWPIMSA-N	431.278406694							111944
BRD-K07551625	LSM-23358		54632476	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21+,26+/m0/s1	YLSSHOUFIJNTGO-LZCXECNNSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K07551625	BRD-K07551625-001-01-3	Broad Institute of MIT and Harvard	BRD-K07551625			COCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21+,26+/m0/s1	YLSSHOUFIJNTGO-LZCXECNNSA-N	497.288971378							111945
BRD-K46619710	LSM-23359		54632451	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m1/s1	PWNDPCFAFIGLCA-IMWIBFENSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K46619710	BRD-K46619710-001-01-7	Broad Institute of MIT and Harvard	BRD-K46619710			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m1/s1	PWNDPCFAFIGLCA-IMWIBFENSA-N	496.268570292							111946
BRD-K46560430	LSM-23360		54632425	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21-,27+/m0/s1	CVHVMLMNHJNHLJ-NOMHHCBYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K46560430	BRD-K46560430-001-01-2	Broad Institute of MIT and Harvard	BRD-K46560430			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21-,27+/m0/s1	CVHVMLMNHJNHLJ-NOMHHCBYSA-N	493.294056758							111947
MLS003650061	LSM-23361	SID125305358, BRD-K89432538	53382714	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19-,27+/m0/s1	BPZWTLHMBRUMNW-RWYJCYHVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4ccccn4	BroadT	BRD-K89432538	BRD-K89432538-001-01-3	Broad Institute of MIT and Harvard	BRD-K89432538			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccn1	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19-,27+/m0/s1	BPZWTLHMBRUMNW-RWYJCYHVSA-N	581.244975606							111948
BRD-K62236460	LSM-23362		54632243	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22+,28-/m1/s1	PQUKNIWUQFCXJV-RZIGYZOXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccccc4	BroadT	BRD-K62236460	BRD-K62236460-001-01-1	Broad Institute of MIT and Harvard	BRD-K62236460			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22+,28-/m1/s1	PQUKNIWUQFCXJV-RZIGYZOXSA-N	535.304621442							111949
BRD-K63813316	LSM-23363		54632323	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	PXVIPBIFKVRXRA-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K63813316	BRD-K63813316-001-01-2	Broad Institute of MIT and Harvard	BRD-K63813316			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	PXVIPBIFKVRXRA-QZMQVMSPSA-N	457.237684734							111950
BRD-K44891204-001-01-7	LSM-23364	BRD-K44891204	54632252	InChI=1S/C27H42N4O5/c1-6-25(32)28-21-12-13-23-22(14-21)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)29-20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)(H,29,34)/t18-,19-,24-/m1/s1	KWFMKHSERJFFJF-KHCICDEESA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)NC3CCCCC3	BroadT	BRD-K44891204	BRD-K44891204-001-01-7	Broad Institute of MIT and Harvard	BRD-K44891204			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)NC1CCCCC1	InChI=1S/C27H42N4O5/c1-6-25(32)28-21-12-13-23-22(14-21)26(33)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)27(34)29-20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)(H,29,34)/t18-,19-,24-/m1/s1	KWFMKHSERJFFJF-KHCICDEESA-N	502.315520484							111951
BRD-K20810649	LSM-23365		54632271	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	SWHZQECMUFTZAT-WZOHSFFVSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K20810649	BRD-K20810649-001-01-8	Broad Institute of MIT and Harvard	BRD-K20810649			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H]1C)OC	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	SWHZQECMUFTZAT-WZOHSFFVSA-N	467.278406694							111952
BRD-K14019014	LSM-23366		54632258	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	PXVIPBIFKVRXRA-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K14019014	BRD-K14019014-001-01-1	Broad Institute of MIT and Harvard	BRD-K14019014			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	PXVIPBIFKVRXRA-DGGJZMOXSA-N	457.237684734							111953
BRD-K11502669	LSM-23367		54632360	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19+,27-/m0/s1	BPZWTLHMBRUMNW-CUMRGQLISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccccn4	BroadT	BRD-K11502669	BRD-K11502669-001-01-7	Broad Institute of MIT and Harvard	BRD-K11502669			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccn1	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19+,27-/m0/s1	BPZWTLHMBRUMNW-CUMRGQLISA-N	581.244975606							111954
MLS003650057	LSM-23368	SID125305357, BRD-K73182084	53382713	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21+,26-/m1/s1	PEPLWFCUXOTHLS-YZIHRLCOSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K73182084	BRD-K73182084-001-01-0	Broad Institute of MIT and Harvard	BRD-K73182084			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21+,26-/m1/s1	PEPLWFCUXOTHLS-YZIHRLCOSA-N	572.212711672							111955
BRD-K74676765	LSM-23369		54632402	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m0/s1	UTSKQZKBDSTIJA-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K74676765	BRD-K74676765-001-01-6	Broad Institute of MIT and Harvard	BRD-K74676765			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m0/s1	UTSKQZKBDSTIJA-QQMNAOGKSA-N	488.219033286							111956
BRD-K70870890	LSM-23370		54632453	InChI=1S/C27H32F3N3O8S/c1-16-11-33(25(34)18-5-8-21-23(9-18)41-15-40-21)17(2)13-39-22-10-19(31-42(36,37)14-27(28,29)30)6-7-20(22)26(35)32(3)12-24(16)38-4/h5-10,16-17,24,31H,11-15H2,1-4H3/t16-,17+,24+/m0/s1	IFTYRDLVJFCQIR-OBWXTZQISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K70870890	BRD-K70870890-001-01-7	Broad Institute of MIT and Harvard	BRD-K70870890			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H32F3N3O8S/c1-16-11-33(25(34)18-5-8-21-23(9-18)41-15-40-21)17(2)13-39-22-10-19(31-42(36,37)14-27(28,29)30)6-7-20(22)26(35)32(3)12-24(16)38-4/h5-10,16-17,24,31H,11-15H2,1-4H3/t16-,17+,24+/m0/s1	IFTYRDLVJFCQIR-OBWXTZQISA-N	615.186220304							111957
BRD-K18783332	LSM-23371		54632365	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19-,25+/m1/s1	JWVSYBUNCRQTID-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K18783332	BRD-K18783332-001-01-3	Broad Institute of MIT and Harvard	BRD-K18783332			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19-,25+/m1/s1	JWVSYBUNCRQTID-RRQZXNHTSA-N	528.274798524							111958
BRD-K90316899	LSM-23372		54632487	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21+,27+/m0/s1	CVHVMLMNHJNHLJ-FYQCMVGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K90316899	BRD-K90316899-001-01-8	Broad Institute of MIT and Harvard	BRD-K90316899			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21+,27+/m0/s1	CVHVMLMNHJNHLJ-FYQCMVGJSA-N	493.294056758							111959
BRD-K98224452	LSM-23373		54632455	InChI=1S/C27H32F3N3O8S/c1-16-11-33(25(34)18-5-8-21-23(9-18)41-15-40-21)17(2)13-39-22-10-19(31-42(36,37)14-27(28,29)30)6-7-20(22)26(35)32(3)12-24(16)38-4/h5-10,16-17,24,31H,11-15H2,1-4H3/t16-,17+,24-/m0/s1	IFTYRDLVJFCQIR-SRGWNRLKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K98224452	BRD-K98224452-001-01-5	Broad Institute of MIT and Harvard	BRD-K98224452			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H32F3N3O8S/c1-16-11-33(25(34)18-5-8-21-23(9-18)41-15-40-21)17(2)13-39-22-10-19(31-42(36,37)14-27(28,29)30)6-7-20(22)26(35)32(3)12-24(16)38-4/h5-10,16-17,24,31H,11-15H2,1-4H3/t16-,17+,24-/m0/s1	IFTYRDLVJFCQIR-SRGWNRLKSA-N	615.186220304							111960
BRD-K57226184	LSM-23374		54632293	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16+,20-/m0/s1	KQGPOQXVBLOFLH-YRNRMSPPSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K57226184	BRD-K57226184-001-01-4	Broad Institute of MIT and Harvard	BRD-K57226184			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16+,20-/m0/s1	KQGPOQXVBLOFLH-YRNRMSPPSA-N	485.21957118							111961
BRD-K73357010	LSM-23375		54632234	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-5-7-24(31)8-6-22)21(2)19-39-27-15-25(32-29(35)23-11-13-38-14-12-23)9-10-26(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-21,23,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21-,28-/m1/s1	FAQVKCFIOGZCCT-UMQWNRPGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(Cc4ccc(F)cc4)C[C@H]1C	BroadT	BRD-K73357010	BRD-K73357010-001-01-7	Broad Institute of MIT and Harvard	BRD-K73357010			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(Cc2ccc(F)cc2)C[C@H]1C	InChI=1S/C30H40FN3O5/c1-20-16-34(17-22-5-7-24(31)8-6-22)21(2)19-39-27-15-25(32-29(35)23-11-13-38-14-12-23)9-10-26(27)30(36)33(3)18-28(20)37-4/h5-10,15,20-21,23,28H,11-14,16-19H2,1-4H3,(H,32,35)/t20-,21-,28-/m1/s1	FAQVKCFIOGZCCT-UMQWNRPGSA-N	541.29519961							111962
BRD-K93737936	LSM-23376		54632337	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16+,20+/m0/s1	KQGPOQXVBLOFLH-RZQQEMMASA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K93737936	BRD-K93737936-001-01-7	Broad Institute of MIT and Harvard	BRD-K93737936			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16+,20+/m0/s1	KQGPOQXVBLOFLH-RZQQEMMASA-N	485.21957118							111963
BRD-K29903367	LSM-23377		54632355	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16-,20+/m1/s1	KQGPOQXVBLOFLH-QINHECLXSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K29903367	BRD-K29903367-001-01-2	Broad Institute of MIT and Harvard	BRD-K29903367			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16-,20+/m1/s1	KQGPOQXVBLOFLH-QINHECLXSA-N	485.21957118							111964
BRD-K61551386	LSM-23378		54632456	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16-,21+/m1/s1	VDBLZQGQIDKANX-ZOCZFRKYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC3CC3	BroadT	BRD-K61551386	BRD-K61551386-001-01-5	Broad Institute of MIT and Harvard	BRD-K61551386			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16-,21+/m1/s1	VDBLZQGQIDKANX-ZOCZFRKYSA-N	481.22465656							111965
BRD-K63401627	LSM-23379		54632325	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,22-/m1/s1	CAPXFCIRSRTCCK-XCGNWRKASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CCC3	BroadT	BRD-K63401627	BRD-K63401627-001-01-0	Broad Institute of MIT and Harvard	BRD-K63401627			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,22-/m1/s1	CAPXFCIRSRTCCK-XCGNWRKASA-N	445.25767125							111966
BRD-K79631534	LSM-23380		54632466	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17+,22+/m1/s1	KQYPWNZZGCEQSB-JLHGSKIFSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K79631534	BRD-K79631534-001-01-6	Broad Institute of MIT and Harvard	BRD-K79631534			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17+,22+/m1/s1	KQYPWNZZGCEQSB-JLHGSKIFSA-N	495.240306624							111967
BRD-K98088240	LSM-23381		54632237	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-18(27-24(29)19-8-6-7-9-21(19)31-4)10-11-20(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23-/m0/s1	QTTOBGDGRJHAMA-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K98088240	BRD-K98088240-001-01-1	Broad Institute of MIT and Harvard	BRD-K98088240			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-18(27-24(29)19-8-6-7-9-21(19)31-4)10-11-20(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23-/m0/s1	QTTOBGDGRJHAMA-MFEFFIJZSA-N	455.242021186							111968
BRD-K06480376	LSM-23382		54632380	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,24+/m0/s1	WEHQYIDEIBHSFW-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc3cccnc3	BroadT	BRD-K06480376	BRD-K06480376-001-01-7	Broad Institute of MIT and Harvard	BRD-K06480376			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc1cccnc1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,24+/m0/s1	WEHQYIDEIBHSFW-HOOSLVGPSA-N	482.252920228							111969
BRD-K10862230	LSM-23383		54632352	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	PXVIPBIFKVRXRA-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K10862230	BRD-K10862230-001-01-6	Broad Institute of MIT and Harvard	BRD-K10862230			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	PXVIPBIFKVRXRA-HKARXFIJSA-N	457.237684734							111970
BRD-K77250455	LSM-23384		54632247	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,22-/m0/s1	CAPXFCIRSRTCCK-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C3CCC3	BroadT	BRD-K77250455	BRD-K77250455-001-01-2	Broad Institute of MIT and Harvard	BRD-K77250455			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CCC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,22-/m0/s1	CAPXFCIRSRTCCK-DMPWYTOCSA-N	445.25767125							111971
BRD-K32208085	LSM-23385		54632492	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16-,21-/m0/s1	VDBLZQGQIDKANX-QYWGDWMGSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC3CC3	BroadT	BRD-K32208085	BRD-K32208085-001-01-2	Broad Institute of MIT and Harvard	BRD-K32208085			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16-,21-/m0/s1	VDBLZQGQIDKANX-QYWGDWMGSA-N	481.22465656							111972
BRD-K91426044	LSM-23386		54632503	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18+,22+/m0/s1	AWYPCRXSVTZAPT-NJNPRVFISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K91426044	BRD-K91426044-001-01-8	Broad Institute of MIT and Harvard	BRD-K91426044			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18+,22+/m0/s1	AWYPCRXSVTZAPT-NJNPRVFISA-N	491.310769462							111973
BRD-K60509482	LSM-23387		54632538	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16+,20+/m0/s1	KMNKNOWYKUKVAH-RZQQEMMASA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CCC(F)(F)F)[C@H](C)COc2c1	BroadT	BRD-K60509482	BRD-K60509482-001-01-7	Broad Institute of MIT and Harvard	BRD-K60509482			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16+,20+/m0/s1	KMNKNOWYKUKVAH-RZQQEMMASA-N	489.245055818							111974
BRD-K47784262	LSM-23388		54632520	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20+,27-/m0/s1	QPDXZJGVGOHLSD-VKIDHGPPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K47784262	BRD-K47784262-001-01-0	Broad Institute of MIT and Harvard	BRD-K47784262			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20+,27-/m0/s1	QPDXZJGVGOHLSD-VKIDHGPPSA-N	509.288971378							111975
BRD-K23664196	LSM-23389		54632327	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17+,23-/m0/s1	XITJMNWLTPOVPR-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K23664196	BRD-K23664196-001-01-3	Broad Institute of MIT and Harvard	BRD-K23664196			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17+,23-/m0/s1	XITJMNWLTPOVPR-MFEFFIJZSA-N	495.248169206							111976
BRD-K17405621	LSM-23390		54632491	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m1/s1	PWNDPCFAFIGLCA-YDIMBITNSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K17405621	BRD-K17405621-001-01-4	Broad Institute of MIT and Harvard	BRD-K17405621			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19+,24-/m1/s1	PWNDPCFAFIGLCA-YDIMBITNSA-N	496.268570292							111977
BRD-K40630044	LSM-23391		54632467	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-8-7-16(22-20(25)13-27-5)9-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15-,19+/m0/s1	GMHRVVGQOPSCBZ-YZVOILCLSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K40630044	BRD-K40630044-001-01-7	Broad Institute of MIT and Harvard	BRD-K40630044			COCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-8-7-16(22-20(25)13-27-5)9-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15-,19+/m0/s1	GMHRVVGQOPSCBZ-YZVOILCLSA-N	407.242021186							111978
BRD-K14187559	LSM-15112		54632474	InChI=1S/C27H32F3N3O8S/c1-16-11-33(25(34)18-5-8-21-23(9-18)41-15-40-21)17(2)13-39-22-10-19(31-42(36,37)14-27(28,29)30)6-7-20(22)26(35)32(3)12-24(16)38-4/h5-10,16-17,24,31H,11-15H2,1-4H3/t16-,17-,24-/m1/s1	IFTYRDLVJFCQIR-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K14187559	BRD-K14187559-001-01-7	Broad Institute of MIT and Harvard	BRD-K14187559			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H32F3N3O8S/c1-16-11-33(25(34)18-5-8-21-23(9-18)41-15-40-21)17(2)13-39-22-10-19(31-42(36,37)14-27(28,29)30)6-7-20(22)26(35)32(3)12-24(16)38-4/h5-10,16-17,24,31H,11-15H2,1-4H3/t16-,17-,24-/m1/s1	IFTYRDLVJFCQIR-HOZJOUCCSA-N	615.186220304							103768
BRD-K24700188	LSM-23392		54632483	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19+,25-/m1/s1	HCZWFODQKFSZHJ-HHJKRLRDSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc4ccccn4	BroadT	BRD-K24700188	BRD-K24700188-001-01-4	Broad Institute of MIT and Harvard	BRD-K24700188			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc1ccccn1	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19+,25-/m1/s1	HCZWFODQKFSZHJ-HHJKRLRDSA-N	508.268570292							111979
BRD-K29628583	LSM-23393		54632482	InChI=1S/C30H40N4O5/c1-20-17-34(29(36)22-10-6-5-7-11-22)21(2)19-39-26-16-23(32-28(35)25-12-8-9-15-31-25)13-14-24(26)30(37)33(3)18-27(20)38-4/h8-9,12-16,20-22,27H,5-7,10-11,17-19H2,1-4H3,(H,32,35)/t20-,21-,27-/m1/s1	YTWLCSLRNCVYEM-LGVUCKNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CCCCC4	BroadT	BRD-K29628583	BRD-K29628583-001-01-3	Broad Institute of MIT and Harvard	BRD-K29628583			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCCCC1	InChI=1S/C30H40N4O5/c1-20-17-34(29(36)22-10-6-5-7-11-22)21(2)19-39-26-16-23(32-28(35)25-12-8-9-15-31-25)13-14-24(26)30(37)33(3)18-27(20)38-4/h8-9,12-16,20-22,27H,5-7,10-11,17-19H2,1-4H3,(H,32,35)/t20-,21-,27-/m1/s1	YTWLCSLRNCVYEM-LGVUCKNBSA-N	536.29987042							111980
BRD-K33128056	LSM-23394		54632508	InChI=1S/C25H35N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h6-13,18-19,24,26H,14-17H2,1-5H3/t18-,19+,24+/m1/s1	BSRUCCSBFZPCQT-IMWIBFENSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(Cc3ccccc3)C[C@H]1C	BroadT	BRD-K33128056	BRD-K33128056-001-01-6	Broad Institute of MIT and Harvard	BRD-K33128056			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(Cc2ccccc2)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h6-13,18-19,24,26H,14-17H2,1-5H3/t18-,19+,24+/m1/s1	BSRUCCSBFZPCQT-IMWIBFENSA-N	489.22974194							111981
BRD-K64073423	LSM-23395		54632308	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18-,23+/m1/s1	ZWOJFBYNCHARNU-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K64073423	BRD-K64073423-001-01-2	Broad Institute of MIT and Harvard	BRD-K64073423			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18-,23+/m1/s1	ZWOJFBYNCHARNU-PNCHPQGNSA-N	460.3049558							111982
BRD-K67337799	LSM-23396		54632343	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16+,21+/m0/s1	VDBLZQGQIDKANX-GCKMJXCFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC3CC3	BroadT	BRD-K67337799	BRD-K67337799-001-01-4	Broad Institute of MIT and Harvard	BRD-K67337799			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16+,21+/m0/s1	VDBLZQGQIDKANX-GCKMJXCFSA-N	481.22465656							111983
BRD-K72751147-001-01-8	LSM-23397	BRD-K72751147	54632232	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21-,26+/m1/s1	PEPLWFCUXOTHLS-YPCDYVTLSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K72751147	BRD-K72751147-001-01-8	Broad Institute of MIT and Harvard	BRD-K72751147			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21-,26+/m1/s1	PEPLWFCUXOTHLS-YPCDYVTLSA-N	572.212711672							111984
BRD-K67531128	LSM-23398		54632311	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19-,25-/m1/s1	JWVSYBUNCRQTID-MPCDZSKCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K67531128	BRD-K67531128-001-01-4	Broad Institute of MIT and Harvard	BRD-K67531128			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19-,25-/m1/s1	JWVSYBUNCRQTID-MPCDZSKCSA-N	528.274798524							111985
BRD-K47143916	LSM-23399		54632257	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16-,21-/m1/s1	VDBLZQGQIDKANX-WHSLLNHNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC3CC3	BroadT	BRD-K47143916	BRD-K47143916-001-01-9	Broad Institute of MIT and Harvard	BRD-K47143916			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16-,21-/m1/s1	VDBLZQGQIDKANX-WHSLLNHNSA-N	481.22465656							111986
BRD-K40674409	LSM-23400		54632526	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23+/m1/s1	ZTWKONBDQSNZML-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K40674409	BRD-K40674409-001-01-4	Broad Institute of MIT and Harvard	BRD-K40674409			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23+/m1/s1	ZTWKONBDQSNZML-DGGJZMOXSA-N	491.209006496							111987
BRD-K43496057	LSM-23401		54632514	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16+,23-/m0/s1	WNEJENAGGFCDCH-PXAQALGRSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K43496057	BRD-K43496057-001-01-4	Broad Institute of MIT and Harvard	BRD-K43496057			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16+,23-/m0/s1	WNEJENAGGFCDCH-PXAQALGRSA-N	469.221285742							111988
BRD-K34851865	LSM-23402		54632506	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m1/s1	VOXXDJJXVVGJRQ-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K34851865	BRD-K34851865-001-01-3	Broad Institute of MIT and Harvard	BRD-K34851865			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m1/s1	VOXXDJJXVVGJRQ-GGUMNFRJSA-N	469.25767125							111989
BRD-K78904317	LSM-23403		54632445	InChI=1S/C24H40N4O4/c1-7-11-25-24(30)26-19-9-10-21-20(13-19)23(29)27(5)15-22(31-6)17(3)14-28(12-8-2)18(4)16-32-21/h9-10,13,17-18,22H,7-8,11-12,14-16H2,1-6H3,(H2,25,26,30)/t17-,18+,22+/m0/s1	RPQYAYCERJLDHX-NJNPRVFISA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(CCC)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K78904317	BRD-K78904317-001-01-1	Broad Institute of MIT and Harvard	BRD-K78904317			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(CCC)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H40N4O4/c1-7-11-25-24(30)26-19-9-10-21-20(13-19)23(29)27(5)15-22(31-6)17(3)14-28(12-8-2)18(4)16-32-21/h9-10,13,17-18,22H,7-8,11-12,14-16H2,1-6H3,(H2,25,26,30)/t17-,18+,22+/m0/s1	RPQYAYCERJLDHX-NJNPRVFISA-N	448.3049558							111990
BRD-K94913575	LSM-23404		54632334	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18+,23+/m0/s1	PYPATSURXBWVGX-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(CC3CCOCC3)C[C@@H]1C	BroadT	BRD-K94913575	BRD-K94913575-001-01-9	Broad Institute of MIT and Harvard	BRD-K94913575			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(CC2CCOCC2)C[C@@H]1C	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18+,23+/m0/s1	PYPATSURXBWVGX-YZZKKUAISA-N	497.255956688							111991
BRD-K97368902	LSM-23405		54632459	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17+,22-/m0/s1	KQYPWNZZGCEQSB-JKSBSHDWSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K97368902	BRD-K97368902-001-01-7	Broad Institute of MIT and Harvard	BRD-K97368902			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17+,22-/m0/s1	KQYPWNZZGCEQSB-JKSBSHDWSA-N	495.240306624							111992
BRD-K67406305	LSM-23406		54632329	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	PXVIPBIFKVRXRA-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K67406305	BRD-K67406305-001-01-4	Broad Institute of MIT and Harvard	BRD-K67406305			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	PXVIPBIFKVRXRA-SEPYTNNBSA-N	457.237684734							111993
BRD-K47865468	LSM-23407		54632331	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	SWHZQECMUFTZAT-FHAGJXEFSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H]1C)OC	BroadT	BRD-K47865468	BRD-K47865468-001-01-9	Broad Institute of MIT and Harvard	BRD-K47865468			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@H]1C)OC	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	SWHZQECMUFTZAT-FHAGJXEFSA-N	467.278406694							111994
BRD-K34747076	LSM-23408		54632242	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19-,27-/m1/s1	BPZWTLHMBRUMNW-DRGJWEBESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccccn4	BroadT	BRD-K34747076	BRD-K34747076-001-01-8	Broad Institute of MIT and Harvard	BRD-K34747076			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccn1	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19-,27-/m1/s1	BPZWTLHMBRUMNW-DRGJWEBESA-N	581.244975606							111995
BRD-K44779507	LSM-23409		54632235	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21-,26-/m1/s1	PEPLWFCUXOTHLS-IPVFLDMMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K44779507	BRD-K44779507-001-01-8	Broad Institute of MIT and Harvard	BRD-K44779507			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21-,26-/m1/s1	PEPLWFCUXOTHLS-IPVFLDMMSA-N	572.212711672							111996
BRD-K96831907	LSM-23410		54632521	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	PXVIPBIFKVRXRA-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K96831907	BRD-K96831907-001-01-0	Broad Institute of MIT and Harvard	BRD-K96831907			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	PXVIPBIFKVRXRA-MFEFFIJZSA-N	457.237684734							111997
BRD-K72073851	LSM-23411		54632336	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16-,23+/m0/s1	WNEJENAGGFCDCH-PBPSECFOSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K72073851	BRD-K72073851-001-01-3	Broad Institute of MIT and Harvard	BRD-K72073851			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16-,23+/m0/s1	WNEJENAGGFCDCH-PBPSECFOSA-N	469.221285742							111998
BRD-K64055457	LSM-23412		54632406	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21+,27-/m1/s1	CVHVMLMNHJNHLJ-PBDKAQRYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K64055457	BRD-K64055457-001-01-8	Broad Institute of MIT and Harvard	BRD-K64055457			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21+,27-/m1/s1	CVHVMLMNHJNHLJ-PBDKAQRYSA-N	493.294056758							111999
BRD-K59847773	LSM-23413		54632369	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21-,26+/m0/s1	PEPLWFCUXOTHLS-ISJBWFOZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K59847773	BRD-K59847773-001-01-2	Broad Institute of MIT and Harvard	BRD-K59847773			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21-,26+/m0/s1	PEPLWFCUXOTHLS-ISJBWFOZSA-N	572.212711672							112000
BRD-K96068766	LSM-23414		54632382	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17+,22-/m0/s1	LUHNOTAECPFVLC-JKSBSHDWSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3cnccn3	BroadT	BRD-K96068766	BRD-K96068766-001-01-9	Broad Institute of MIT and Harvard	BRD-K96068766			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2cnccn2)c1	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17+,22-/m0/s1	LUHNOTAECPFVLC-JKSBSHDWSA-N	483.248169206							112001
BRD-K40057256	LSM-23415		54632322	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19+,25+/m1/s1	HCZWFODQKFSZHJ-WYEJZRMESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc4ccccn4	BroadT	BRD-K40057256	BRD-K40057256-001-01-6	Broad Institute of MIT and Harvard	BRD-K40057256			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc1ccccn1	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19+,25+/m1/s1	HCZWFODQKFSZHJ-WYEJZRMESA-N	508.268570292							112002
BRD-K67390084	LSM-23416		54632497	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,24+/m0/s1	WEHQYIDEIBHSFW-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc3cccnc3	BroadT	BRD-K67390084	BRD-K67390084-001-01-7	Broad Institute of MIT and Harvard	BRD-K67390084			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc1cccnc1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,24+/m0/s1	WEHQYIDEIBHSFW-LLJLJFOGSA-N	482.252920228							112003
BRD-K77727343	LSM-23417		54632472	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21-,26-/m1/s1	YLSSHOUFIJNTGO-IPVFLDMMSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K77727343	BRD-K77727343-001-01-5	Broad Institute of MIT and Harvard	BRD-K77727343			COCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21-,26-/m1/s1	YLSSHOUFIJNTGO-IPVFLDMMSA-N	497.288971378							112004
BRD-K14763154	LSM-23418		54632385	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m1/s1	GLJKQBVQGMWNRJ-YDIMBITNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K14763154	BRD-K14763154-001-01-4	Broad Institute of MIT and Harvard	BRD-K14763154			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m1/s1	GLJKQBVQGMWNRJ-YDIMBITNSA-N	453.26275663							112005
BRD-K01237277	LSM-23419		54632386	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21+,27-/m0/s1	CVHVMLMNHJNHLJ-ISCCLHIJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K01237277	BRD-K01237277-001-01-6	Broad Institute of MIT and Harvard	BRD-K01237277			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21+,27-/m0/s1	CVHVMLMNHJNHLJ-ISCCLHIJSA-N	493.294056758							112006
BRD-K87193132	LSM-23420		54632353	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18-,23-/m1/s1	ZWOJFBYNCHARNU-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K87193132	BRD-K87193132-001-01-3	Broad Institute of MIT and Harvard	BRD-K87193132			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18-,23-/m1/s1	ZWOJFBYNCHARNU-PMAPCBKXSA-N	460.3049558							112007
BRD-K61209548	LSM-23421		54632249	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17+,23-/m1/s1	XITJMNWLTPOVPR-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K61209548	BRD-K61209548-001-01-5	Broad Institute of MIT and Harvard	BRD-K61209548			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17+,23-/m1/s1	XITJMNWLTPOVPR-SAHWJRBASA-N	495.248169206							112008
BRD-K12120581	LSM-23422		54632443	InChI=1S/C25H35N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h6-13,18-19,24,26H,14-17H2,1-5H3/t18-,19+,24-/m1/s1	BSRUCCSBFZPCQT-YDIMBITNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(Cc3ccccc3)C[C@H]1C	BroadT	BRD-K12120581	BRD-K12120581-001-01-2	Broad Institute of MIT and Harvard	BRD-K12120581			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(Cc2ccccc2)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h6-13,18-19,24,26H,14-17H2,1-5H3/t18-,19+,24-/m1/s1	BSRUCCSBFZPCQT-YDIMBITNSA-N	489.22974194							112009
BRD-K38853406	LSM-23423		54632388	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25-/m0/s1	AQYOFVQGYZLVTG-ATLLOTDBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3cccc(F)c3)C[C@@H]1C	BroadT	BRD-K38853406	BRD-K38853406-001-01-1	Broad Institute of MIT and Harvard	BRD-K38853406			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2cccc(F)c2)C[C@@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25-/m0/s1	AQYOFVQGYZLVTG-ATLLOTDBSA-N	471.253334798							112010
BRD-K43384508	LSM-23424		54632332	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m0/s1	SWHZQECMUFTZAT-RLSLOFABSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K43384508	BRD-K43384508-001-01-7	Broad Institute of MIT and Harvard	BRD-K43384508			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20-,25-/m0/s1	SWHZQECMUFTZAT-RLSLOFABSA-N	467.278406694							112011
BRD-K00667983	LSM-23425		54632485	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15-,19+/m1/s1	ICXHXZJPFKZHMO-CLCXKQKWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K00667983	BRD-K00667983-001-01-0	Broad Institute of MIT and Harvard	BRD-K00667983			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15-,19+/m1/s1	ICXHXZJPFKZHMO-CLCXKQKWSA-N	495.201476444							112012
BRD-K06049932	LSM-23426		54632363	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	SWHZQECMUFTZAT-OHUGHZGNSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K06049932	BRD-K06049932-001-01-7	Broad Institute of MIT and Harvard	BRD-K06049932			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	SWHZQECMUFTZAT-OHUGHZGNSA-N	467.278406694							112013
BRD-K74107343	LSM-23427		54632426	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16+,20+/m1/s1	KQGPOQXVBLOFLH-GUXCAODWSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K74107343	BRD-K74107343-001-01-3	Broad Institute of MIT and Harvard	BRD-K74107343			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16+,20+/m1/s1	KQGPOQXVBLOFLH-GUXCAODWSA-N	485.21957118							112014
BRD-K22800340	LSM-23428		54632341	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17-,22+/m0/s1	LUHNOTAECPFVLC-PNLZDCPESA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)c3cnccn3	BroadT	BRD-K22800340	BRD-K22800340-001-01-9	Broad Institute of MIT and Harvard	BRD-K22800340			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2cnccn2)c1	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17-,22+/m0/s1	LUHNOTAECPFVLC-PNLZDCPESA-N	483.248169206							112015
BRD-K13271778	LSM-23429		54632398	InChI=1S/C27H32F3N3O8S/c1-16-11-33(25(34)18-5-8-21-23(9-18)41-15-40-21)17(2)13-39-22-10-19(31-42(36,37)14-27(28,29)30)6-7-20(22)26(35)32(3)12-24(16)38-4/h5-10,16-17,24,31H,11-15H2,1-4H3/t16-,17+,24-/m1/s1	IFTYRDLVJFCQIR-XVTZWQNCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccc4OCOc4c3	BroadT	BRD-K13271778	BRD-K13271778-001-01-5	Broad Institute of MIT and Harvard	BRD-K13271778			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccc2OCOc2c1	InChI=1S/C27H32F3N3O8S/c1-16-11-33(25(34)18-5-8-21-23(9-18)41-15-40-21)17(2)13-39-22-10-19(31-42(36,37)14-27(28,29)30)6-7-20(22)26(35)32(3)12-24(16)38-4/h5-10,16-17,24,31H,11-15H2,1-4H3/t16-,17+,24-/m1/s1	IFTYRDLVJFCQIR-XVTZWQNCSA-N	615.186220304							112016
BRD-K50511447	LSM-23430		54632351	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24-/m1/s1	GLJKQBVQGMWNRJ-KHCICDEESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K50511447	BRD-K50511447-001-01-9	Broad Institute of MIT and Harvard	BRD-K50511447			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24-/m1/s1	GLJKQBVQGMWNRJ-KHCICDEESA-N	453.26275663							112017
BRD-K22725588	LSM-23431		54632416	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17+,22+/m0/s1	LUHNOTAECPFVLC-GSHUGGBRSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3cnccn3	BroadT	BRD-K22725588	BRD-K22725588-001-01-9	Broad Institute of MIT and Harvard	BRD-K22725588			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2cnccn2)c1	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17+,22+/m0/s1	LUHNOTAECPFVLC-GSHUGGBRSA-N	483.248169206							112018
BRD-K61704278	LSM-23432		54632304	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,24+/m1/s1	WEHQYIDEIBHSFW-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc3cccnc3	BroadT	BRD-K61704278	BRD-K61704278-001-01-1	Broad Institute of MIT and Harvard	BRD-K61704278			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,24+/m1/s1	WEHQYIDEIBHSFW-YTZAWJCFSA-N	482.252920228							112019
BRD-K60337516	LSM-23433		54632392	InChI=1S/C23H33N3O5/c1-14-11-26(16(3)27)15(2)13-31-20-10-18(24-22(28)17-6-7-17)8-9-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,28)/t14-,15-,21+/m1/s1	NHANBWHFHPMELO-PZPWOCDFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K60337516	BRD-K60337516-001-01-3	Broad Institute of MIT and Harvard	BRD-K60337516			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C23H33N3O5/c1-14-11-26(16(3)27)15(2)13-31-20-10-18(24-22(28)17-6-7-17)8-9-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,28)/t14-,15-,21+/m1/s1	NHANBWHFHPMELO-PZPWOCDFSA-N	431.242021186							112020
BRD-K50884475	LSM-23434		54632361	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18+,23-/m1/s1	PYPATSURXBWVGX-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(CC3CCOCC3)C[C@H]1C	BroadT	BRD-K50884475	BRD-K50884475-001-01-5	Broad Institute of MIT and Harvard	BRD-K50884475			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C24H39N3O6S/c1-17-13-27(14-19-8-10-32-11-9-19)18(2)16-33-22-7-6-20(25-34(5,29)30)12-21(22)24(28)26(3)15-23(17)31-4/h6-7,12,17-19,23,25H,8-11,13-16H2,1-5H3/t17-,18+,23-/m1/s1	PYPATSURXBWVGX-IEGUWTFLSA-N	497.255956688							112021
BRD-K25484053	LSM-23435		54632519	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15-,19-/m0/s1	ICXHXZJPFKZHMO-DOXZYTNZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K25484053	BRD-K25484053-001-01-6	Broad Institute of MIT and Harvard	BRD-K25484053			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15-,19-/m0/s1	ICXHXZJPFKZHMO-DOXZYTNZSA-N	495.201476444							112022
BRD-K84401063	LSM-23436		54632259	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19+,24+/m1/s1	XOGLRDBIQQOPTC-IMWIBFENSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K84401063	BRD-K84401063-001-01-6	Broad Institute of MIT and Harvard	BRD-K84401063			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19+,24+/m1/s1	XOGLRDBIQQOPTC-IMWIBFENSA-N	483.284554714							112023
BRD-K78902613	LSM-23437		54632291	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20-,27+/m1/s1	QPDXZJGVGOHLSD-DVHCVUMVSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K78902613	BRD-K78902613-001-01-6	Broad Institute of MIT and Harvard	BRD-K78902613			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20-,27+/m1/s1	QPDXZJGVGOHLSD-DVHCVUMVSA-N	509.288971378							112024
BRD-K59778279	LSM-23438		54632349	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15+,19-/m1/s1	ICXHXZJPFKZHMO-ZRGWGRIASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K59778279	BRD-K59778279-001-01-8	Broad Institute of MIT and Harvard	BRD-K59778279			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15+,19-/m1/s1	ICXHXZJPFKZHMO-ZRGWGRIASA-N	495.201476444							112025
CHEMBL2358649	LSM-23439	BRD-K60456515, SID131428499	54632251	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,24-/m1/s1	WEHQYIDEIBHSFW-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc3cccnc3	BroadT	BRD-K60456515	BRD-K60456515-001-01-2	Broad Institute of MIT and Harvard	BRD-K60456515			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,24-/m1/s1	WEHQYIDEIBHSFW-QZTZHPFYSA-N	482.252920228							112026
BRD-K20110031	LSM-23440		54632298	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,24+/m1/s1	WEHQYIDEIBHSFW-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc3cccnc3	BroadT	BRD-K20110031	BRD-K20110031-001-01-9	Broad Institute of MIT and Harvard	BRD-K20110031			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18-,24+/m1/s1	WEHQYIDEIBHSFW-GGUMNFRJSA-N	482.252920228							112027
BRD-K13330525	LSM-23441		54632272	InChI=1S/C26H32F4N4O6S/c1-16-12-34(41(37,38)15-26(28,29)30)17(2)14-40-22-11-18(31-25(36)32-21-8-6-5-7-20(21)27)9-10-19(22)24(35)33(3)13-23(16)39-4/h5-11,16-17,23H,12-15H2,1-4H3,(H2,31,32,36)/t16-,17-,23-/m1/s1	LKPAJBWDPUXZFP-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)CC(F)(F)F	BroadT	BRD-K13330525	BRD-K13330525-001-01-5	Broad Institute of MIT and Harvard	BRD-K13330525			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)CC(F)(F)F	InChI=1S/C26H32F4N4O6S/c1-16-12-34(41(37,38)15-26(28,29)30)17(2)14-40-22-11-18(31-25(36)32-21-8-6-5-7-20(21)27)9-10-19(22)24(35)33(3)13-23(16)39-4/h5-11,16-17,23H,12-15H2,1-4H3,(H2,31,32,36)/t16-,17-,23-/m1/s1	LKPAJBWDPUXZFP-SEPYTNNBSA-N	604.197868274							112028
BRD-K57833824	LSM-23442		54632368	InChI=1S/C29H36N4O6/c1-19-13-33(14-23-17-38-18-30-23)20(2)16-39-26-12-22(31-28(34)21-6-9-24(36-4)10-7-21)8-11-25(26)29(35)32(3)15-27(19)37-5/h6-12,17-20,27H,13-16H2,1-5H3,(H,31,34)/t19-,20-,27+/m1/s1	VPSAOOSUXPIBJQ-DVHCVUMVSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(Cc4cocn4)C[C@H]1C	BroadT	BRD-K57833824	BRD-K57833824-001-01-3	Broad Institute of MIT and Harvard	BRD-K57833824			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(Cc2cocn2)C[C@H]1C	InChI=1S/C29H36N4O6/c1-19-13-33(14-23-17-38-18-30-23)20(2)16-39-26-12-22(31-28(34)21-6-9-24(36-4)10-7-21)8-11-25(26)29(35)32(3)15-27(19)37-5/h6-12,17-20,27H,13-16H2,1-5H3,(H,31,34)/t19-,20-,27+/m1/s1	VPSAOOSUXPIBJQ-DVHCVUMVSA-N	536.263484912							112029
BRD-K37596331	LSM-23443		54632320	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21+,26-/m0/s1	PEPLWFCUXOTHLS-UZINWLIJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K37596331	BRD-K37596331-001-01-7	Broad Institute of MIT and Harvard	BRD-K37596331			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21+,26-/m0/s1	PEPLWFCUXOTHLS-UZINWLIJSA-N	572.212711672							112030
BRD-K70566686	LSM-23444		54632274	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19+,27+/m0/s1	BPZWTLHMBRUMNW-DSNGTPCMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccccn4	BroadT	BRD-K70566686	BRD-K70566686-001-01-9	Broad Institute of MIT and Harvard	BRD-K70566686			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccn1	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19+,27+/m0/s1	BPZWTLHMBRUMNW-DSNGTPCMSA-N	581.244975606							112031
BRD-K88542817	LSM-23445		54632261	InChI=1S/C25H35N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h6-13,18-19,24,26H,14-17H2,1-5H3/t18-,19+,24-/m0/s1	BSRUCCSBFZPCQT-GLDPYIMESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3ccccc3)C[C@@H]1C	BroadT	BRD-K88542817	BRD-K88542817-001-01-2	Broad Institute of MIT and Harvard	BRD-K88542817			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2ccccc2)C[C@@H]1C	InChI=1S/C25H35N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h6-13,18-19,24,26H,14-17H2,1-5H3/t18-,19+,24-/m0/s1	BSRUCCSBFZPCQT-GLDPYIMESA-N	489.22974194							112032
BRD-K13803936	LSM-23446		54632441	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17-,22+/m0/s1	KQYPWNZZGCEQSB-PNLZDCPESA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K13803936	BRD-K13803936-001-01-4	Broad Institute of MIT and Harvard	BRD-K13803936			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17-,22+/m0/s1	KQYPWNZZGCEQSB-PNLZDCPESA-N	495.240306624							112033
BRD-K79965790	LSM-23447		54632515	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m0/s1	PWNDPCFAFIGLCA-AXHZCLLHSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K79965790	BRD-K79965790-001-01-7	Broad Institute of MIT and Harvard	BRD-K79965790			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m0/s1	PWNDPCFAFIGLCA-AXHZCLLHSA-N	496.268570292							112034
BRD-K47849061	LSM-23448		54632435	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m0/s1	VOXXDJJXVVGJRQ-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K47849061	BRD-K47849061-001-01-4	Broad Institute of MIT and Harvard	BRD-K47849061			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m0/s1	VOXXDJJXVVGJRQ-LLJLJFOGSA-N	469.25767125							112035
BRD-K39016838	LSM-23449		54632428	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m0/s1	PWNDPCFAFIGLCA-XLNZFTOWSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K39016838	BRD-K39016838-001-01-2	Broad Institute of MIT and Harvard	BRD-K39016838			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19+,24+/m0/s1	PWNDPCFAFIGLCA-XLNZFTOWSA-N	496.268570292							112036
BRD-K87821938	LSM-23450		54632264	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16+,20+/m1/s1	KMNKNOWYKUKVAH-GUXCAODWSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CCC(F)(F)F)[C@@H](C)COc2c1	BroadT	BRD-K87821938	BRD-K87821938-001-01-5	Broad Institute of MIT and Harvard	BRD-K87821938			COCC(=O)Nc1ccc2c(OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16+,20+/m1/s1	KMNKNOWYKUKVAH-GUXCAODWSA-N	489.245055818							112037
BRD-K32722078	LSM-23451		54632279	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18-,23-/m0/s1	ZWOJFBYNCHARNU-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K32722078	BRD-K32722078-001-01-1	Broad Institute of MIT and Harvard	BRD-K32722078			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18-,23-/m0/s1	ZWOJFBYNCHARNU-BSRJHKFKSA-N	460.3049558							112038
BRD-K75497233	LSM-23452		54632437	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19+,27-/m1/s1	BPZWTLHMBRUMNW-VXLXPWSCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccccn4	BroadT	BRD-K75497233	BRD-K75497233-001-01-0	Broad Institute of MIT and Harvard	BRD-K75497233			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccn1	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19+,27-/m1/s1	BPZWTLHMBRUMNW-VXLXPWSCSA-N	581.244975606							112039
BRD-K98519785	LSM-23453		54632354	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21+,26-/m1/s1	YLSSHOUFIJNTGO-YZIHRLCOSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K98519785	BRD-K98519785-001-01-6	Broad Institute of MIT and Harvard	BRD-K98519785			COCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21+,26-/m1/s1	YLSSHOUFIJNTGO-YZIHRLCOSA-N	497.288971378							112040
BRD-K78124620	LSM-23454		54632278	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17-,22-/m1/s1	KQYPWNZZGCEQSB-DRSNIGMVSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K78124620	BRD-K78124620-001-01-8	Broad Institute of MIT and Harvard	BRD-K78124620			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17-,22-/m1/s1	KQYPWNZZGCEQSB-DRSNIGMVSA-N	495.240306624							112041
BRD-K32018176	LSM-23455		54632477	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m1/s1	VOXXDJJXVVGJRQ-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K32018176	BRD-K32018176-001-01-5	Broad Institute of MIT and Harvard	BRD-K32018176			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m1/s1	VOXXDJJXVVGJRQ-YTZAWJCFSA-N	469.25767125							112042
BRD-K06356885	LSM-23456		54632345	InChI=1S/C25H39N3O6S/c1-17-14-28(24(29)19-9-7-6-8-10-19)18(2)16-34-22-13-20(26-35(5,31)32)11-12-21(22)25(30)27(3)15-23(17)33-4/h11-13,17-19,23,26H,6-10,14-16H2,1-5H3/t17-,18+,23-/m0/s1	JGDPUHQSCGHVAS-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C3CCCCC3	BroadT	BRD-K06356885	BRD-K06356885-001-01-3	Broad Institute of MIT and Harvard	BRD-K06356885			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CCCCC1	InChI=1S/C25H39N3O6S/c1-17-14-28(24(29)19-9-7-6-8-10-19)18(2)16-34-22-13-20(26-35(5,31)32)11-12-21(22)25(30)27(3)15-23(17)33-4/h11-13,17-19,23,26H,6-10,14-16H2,1-5H3/t17-,18+,23-/m0/s1	JGDPUHQSCGHVAS-IXFSTUDKSA-N	509.255956688							112043
BRD-K85525164	LSM-23457		54632464	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21+,26-/m0/s1	YLSSHOUFIJNTGO-UZINWLIJSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K85525164	BRD-K85525164-001-01-9	Broad Institute of MIT and Harvard	BRD-K85525164			COCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21+,26-/m0/s1	YLSSHOUFIJNTGO-UZINWLIJSA-N	497.288971378							112044
BRD-K90686617	LSM-23458		54632512	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15+,19+/m1/s1	ICXHXZJPFKZHMO-VCBZYWHSSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K90686617	BRD-K90686617-001-01-5	Broad Institute of MIT and Harvard	BRD-K90686617			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15+,19+/m1/s1	ICXHXZJPFKZHMO-VCBZYWHSSA-N	495.201476444							112045
BRD-K36764343	LSM-23459		54632450	InChI=1S/C26H41N3O5/c1-6-11-29-15-18(2)24(32-5)16-28(4)26(31)22-8-7-21(14-23(22)34-17-19(29)3)27-25(30)20-9-12-33-13-10-20/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m0/s1	YETRFLOTOCCFGD-XLNZFTOWSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K36764343	BRD-K36764343-001-01-8	Broad Institute of MIT and Harvard	BRD-K36764343			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	InChI=1S/C26H41N3O5/c1-6-11-29-15-18(2)24(32-5)16-28(4)26(31)22-8-7-21(14-23(22)34-17-19(29)3)27-25(30)20-9-12-33-13-10-20/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m0/s1	YETRFLOTOCCFGD-XLNZFTOWSA-N	475.304621442							112046
BRD-K03154735	LSM-23460		54632346	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19-,25-/m0/s1	JWVSYBUNCRQTID-MHPIHPPYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K03154735	BRD-K03154735-001-01-7	Broad Institute of MIT and Harvard	BRD-K03154735			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19-,25-/m0/s1	JWVSYBUNCRQTID-MHPIHPPYSA-N	528.274798524							112047
BRD-K00882360	LSM-23461		54632240	InChI=1S/C28H40N4O7S/c1-18(2)29-28(34)32-15-19(3)26(38-7)16-31(5)27(33)24-13-8-21(14-25(24)39-17-20(32)4)30-40(35,36)23-11-9-22(37-6)10-12-23/h8-14,18-20,26,30H,15-17H2,1-7H3,(H,29,34)/t19-,20-,26-/m1/s1	PFWSECJJNHUURC-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K00882360	BRD-K00882360-001-01-8	Broad Institute of MIT and Harvard	BRD-K00882360			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C28H40N4O7S/c1-18(2)29-28(34)32-15-19(3)26(38-7)16-31(5)27(33)24-13-8-21(14-25(24)39-17-20(32)4)30-40(35,36)23-11-9-22(37-6)10-12-23/h8-14,18-20,26,30H,15-17H2,1-7H3,(H,29,34)/t19-,20-,26-/m1/s1	PFWSECJJNHUURC-XMERXJNXSA-N	576.26177035							112048
BRD-K66222602	LSM-23462		54632488	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,22+/m0/s1	CAPXFCIRSRTCCK-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C3CCC3	BroadT	BRD-K66222602	BRD-K66222602-001-01-6	Broad Institute of MIT and Harvard	BRD-K66222602			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CCC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,22+/m0/s1	CAPXFCIRSRTCCK-PONJGIIJSA-N	445.25767125							112049
BRD-K15128331	LSM-23463		54632244	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19-,24-/m0/s1	XOGLRDBIQQOPTC-JXQFQVJHSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K15128331	BRD-K15128331-001-01-5	Broad Institute of MIT and Harvard	BRD-K15128331			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19-,24-/m0/s1	XOGLRDBIQQOPTC-JXQFQVJHSA-N	483.284554714							112050
BRD-K76114475	LSM-23464		54632296	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m0/s1	UTSKQZKBDSTIJA-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K76114475	BRD-K76114475-001-01-7	Broad Institute of MIT and Harvard	BRD-K76114475			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m0/s1	UTSKQZKBDSTIJA-HKARXFIJSA-N	488.219033286							112051
BRD-K48255349	LSM-23465		54632409	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,22+/m0/s1	CAPXFCIRSRTCCK-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C3CCC3	BroadT	BRD-K48255349	BRD-K48255349-001-01-7	Broad Institute of MIT and Harvard	BRD-K48255349			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CCC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)18-7-6-8-18)16(2)14-32-21-11-19(25-17(3)28)9-10-20(21)24(30)26(4)13-22(15)31-5/h9-11,15-16,18,22H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,22+/m0/s1	CAPXFCIRSRTCCK-WJONJSRFSA-N	445.25767125							112052
BRD-K60932633	LSM-23466		54632403	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19-,25-/m0/s1	HCZWFODQKFSZHJ-MHPIHPPYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc4ccccn4	BroadT	BRD-K60932633	BRD-K60932633-001-01-9	Broad Institute of MIT and Harvard	BRD-K60932633			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc1ccccn1	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19-,25-/m0/s1	HCZWFODQKFSZHJ-MHPIHPPYSA-N	508.268570292							112053
BRD-K56729241	LSM-23467		54632545	InChI=1S/C27H44N4O4/c1-6-13-28-27(33)29-22-11-12-23-24(14-22)35-18-20(3)31(16-21-9-7-8-10-21)15-19(2)25(34-5)17-30(4)26(23)32/h11-12,14,19-21,25H,6-10,13,15-18H2,1-5H3,(H2,28,29,33)/t19-,20+,25-/m1/s1	MRCAHRJZOZLPQK-OHUGHZGNSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(CC3CCCC3)[C@@H](C)COc2c1	BroadT	BRD-K56729241	BRD-K56729241-001-01-9	Broad Institute of MIT and Harvard	BRD-K56729241			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CCCC3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H44N4O4/c1-6-13-28-27(33)29-22-11-12-23-24(14-22)35-18-20(3)31(16-21-9-7-8-10-21)15-19(2)25(34-5)17-30(4)26(23)32/h11-12,14,19-21,25H,6-10,13,15-18H2,1-5H3,(H2,28,29,33)/t19-,20+,25-/m1/s1	MRCAHRJZOZLPQK-OHUGHZGNSA-N	488.336255928							112054
BRD-K90526956	LSM-23468		54632306	InChI=1S/C24H40N4O4/c1-7-11-25-24(30)26-19-9-10-21-20(13-19)23(29)27(5)15-22(31-6)17(3)14-28(12-8-2)18(4)16-32-21/h9-10,13,17-18,22H,7-8,11-12,14-16H2,1-6H3,(H2,25,26,30)/t17-,18-,22+/m1/s1	RPQYAYCERJLDHX-HMFYCAOWSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(CCC)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K90526956	BRD-K90526956-001-01-2	Broad Institute of MIT and Harvard	BRD-K90526956			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(CCC)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H40N4O4/c1-7-11-25-24(30)26-19-9-10-21-20(13-19)23(29)27(5)15-22(31-6)17(3)14-28(12-8-2)18(4)16-32-21/h9-10,13,17-18,22H,7-8,11-12,14-16H2,1-6H3,(H2,25,26,30)/t17-,18-,22+/m1/s1	RPQYAYCERJLDHX-HMFYCAOWSA-N	448.3049558							112055
BRD-K19381111	LSM-23469		54632530	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25+/m0/s1	AQYOFVQGYZLVTG-DPOKWSEZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3cccc(F)c3)C[C@@H]1C	BroadT	BRD-K19381111	BRD-K19381111-001-01-2	Broad Institute of MIT and Harvard	BRD-K19381111			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2cccc(F)c2)C[C@@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25+/m0/s1	AQYOFVQGYZLVTG-DPOKWSEZSA-N	471.253334798							112056
BRD-K64182862	LSM-23470		54632326	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18+,23+/m0/s1	ZWOJFBYNCHARNU-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K64182862	BRD-K64182862-001-01-9	Broad Institute of MIT and Harvard	BRD-K64182862			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18+,23+/m0/s1	ZWOJFBYNCHARNU-YZZKKUAISA-N	460.3049558							112057
BRD-K60389305	LSM-23471		54632383	InChI=1S/C25H39N3O6S/c1-17-14-28(24(29)19-9-7-6-8-10-19)18(2)16-34-22-13-20(26-35(5,31)32)11-12-21(22)25(30)27(3)15-23(17)33-4/h11-13,17-19,23,26H,6-10,14-16H2,1-5H3/t17-,18-,23+/m0/s1	JGDPUHQSCGHVAS-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C3CCCCC3	BroadT	BRD-K60389305	BRD-K60389305-001-01-9	Broad Institute of MIT and Harvard	BRD-K60389305			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CCCCC1	InChI=1S/C25H39N3O6S/c1-17-14-28(24(29)19-9-7-6-8-10-19)18(2)16-34-22-13-20(26-35(5,31)32)11-12-21(22)25(30)27(3)15-23(17)33-4/h11-13,17-19,23,26H,6-10,14-16H2,1-5H3/t17-,18-,23+/m0/s1	JGDPUHQSCGHVAS-IUKKYPGJSA-N	509.255956688							112058
BRD-K90474764	LSM-23472		54632397	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m0/s1	VOXXDJJXVVGJRQ-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K90474764	BRD-K90474764-001-01-7	Broad Institute of MIT and Harvard	BRD-K90474764			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m0/s1	VOXXDJJXVVGJRQ-HOOSLVGPSA-N	469.25767125							112059
BRD-K10590495	LSM-23473		54632510	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15+,19-/m0/s1	ICXHXZJPFKZHMO-KHYOSLBOSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K10590495	BRD-K10590495-001-01-3	Broad Institute of MIT and Harvard	BRD-K10590495			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C21H32F3N3O5S/c1-14-11-27(9-8-21(22,23)24)15(2)13-32-18-10-16(25-33(5,29)30)6-7-17(18)20(28)26(3)12-19(14)31-4/h6-7,10,14-15,19,25H,8-9,11-13H2,1-5H3/t14-,15+,19-/m0/s1	ICXHXZJPFKZHMO-KHYOSLBOSA-N	495.201476444							112060
BRD-K14707716	LSM-23474		54632543	InChI=1S/C29H36N4O6/c1-19-13-33(14-23-17-38-18-30-23)20(2)16-39-26-12-22(31-28(34)21-6-9-24(36-4)10-7-21)8-11-25(26)29(35)32(3)15-27(19)37-5/h6-12,17-20,27H,13-16H2,1-5H3,(H,31,34)/t19-,20+,27+/m0/s1	VPSAOOSUXPIBJQ-ASHZAFPQSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(Cc4cocn4)C[C@@H]1C	BroadT	BRD-K14707716	BRD-K14707716-001-01-2	Broad Institute of MIT and Harvard	BRD-K14707716			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(Cc2cocn2)C[C@@H]1C	InChI=1S/C29H36N4O6/c1-19-13-33(14-23-17-38-18-30-23)20(2)16-39-26-12-22(31-28(34)21-6-9-24(36-4)10-7-21)8-11-25(26)29(35)32(3)15-27(19)37-5/h6-12,17-20,27H,13-16H2,1-5H3,(H,31,34)/t19-,20+,27+/m0/s1	VPSAOOSUXPIBJQ-ASHZAFPQSA-N	536.263484912							112061
BRD-K02517738	LSM-23475		54632539	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-8-7-16(22-20(25)13-27-5)9-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15-,19-/m1/s1	GMHRVVGQOPSCBZ-SPYBWZPUSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K02517738	BRD-K02517738-001-01-3	Broad Institute of MIT and Harvard	BRD-K02517738			COCC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-8-7-16(22-20(25)13-27-5)9-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15-,19-/m1/s1	GMHRVVGQOPSCBZ-SPYBWZPUSA-N	407.242021186							112062
BRD-K43000271	LSM-23476		54632446	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19+,25+/m0/s1	JWVSYBUNCRQTID-OSWQYVSFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K43000271	BRD-K43000271-001-01-4	Broad Institute of MIT and Harvard	BRD-K43000271			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19+,25+/m0/s1	JWVSYBUNCRQTID-OSWQYVSFSA-N	528.274798524							112063
BRD-K11674021	LSM-23477		54632534	InChI=1S/C25H32N4O6/c1-15-11-26-16(2)13-33-21-9-17(5-7-19(21)24(30)29(3)12-23(15)32-4)27-25(31)28-18-6-8-20-22(10-18)35-14-34-20/h5-10,15-16,23,26H,11-14H2,1-4H3,(H2,27,28,31)/t15-,16+,23+/m1/s1	SLXXNDOTBOUXJA-SYJLOODJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K11674021	BRD-K11674021-001-01-7	Broad Institute of MIT and Harvard	BRD-K11674021			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H32N4O6/c1-15-11-26-16(2)13-33-21-9-17(5-7-19(21)24(30)29(3)12-23(15)32-4)27-25(31)28-18-6-8-20-22(10-18)35-14-34-20/h5-10,15-16,23,26H,11-14H2,1-4H3,(H2,27,28,31)/t15-,16+,23+/m1/s1	SLXXNDOTBOUXJA-SYJLOODJSA-N	484.232184784							112064
BRD-K27356753	LSM-23478		54632540	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16-,20-/m0/s1	KMNKNOWYKUKVAH-FTRWYGJKSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(CCC(F)(F)F)[C@@H](C)COc2c1	BroadT	BRD-K27356753	BRD-K27356753-001-01-7	Broad Institute of MIT and Harvard	BRD-K27356753			COCC(=O)Nc1ccc2c(OC[C@H](C)N(CCC(F)(F)F)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16-,20-/m0/s1	KMNKNOWYKUKVAH-FTRWYGJKSA-N	489.245055818							112065
BRD-K32269272	LSM-23479		54632509	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21+,26+/m1/s1	PEPLWFCUXOTHLS-SWYRRKHMSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K32269272	BRD-K32269272-001-01-7	Broad Institute of MIT and Harvard	BRD-K32269272			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21+,26+/m1/s1	PEPLWFCUXOTHLS-SWYRRKHMSA-N	572.212711672							112066
BRD-K98505253	LSM-23480		54632396	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16-,20-/m1/s1	KMNKNOWYKUKVAH-JXXFODFXSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(CCC(F)(F)F)[C@H](C)COc2c1	BroadT	BRD-K98505253	BRD-K98505253-001-01-8	Broad Institute of MIT and Harvard	BRD-K98505253			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16-,20-/m1/s1	KMNKNOWYKUKVAH-JXXFODFXSA-N	489.245055818							112067
BRD-K58237252	LSM-23481		54632414	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24-/m1/s1	VOXXDJJXVVGJRQ-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K58237252	BRD-K58237252-001-01-7	Broad Institute of MIT and Harvard	BRD-K58237252			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24-/m1/s1	VOXXDJJXVVGJRQ-QZTZHPFYSA-N	469.25767125							112068
BRD-K12607407	LSM-23482		54632316	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19+,27+/m1/s1	BPZWTLHMBRUMNW-RYTUXRKISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccccn4	BroadT	BRD-K12607407	BRD-K12607407-001-01-0	Broad Institute of MIT and Harvard	BRD-K12607407			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccn1	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19+,27+/m1/s1	BPZWTLHMBRUMNW-RYTUXRKISA-N	581.244975606							112069
BRD-K18179332	LSM-23483		54632436	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19+,25-/m0/s1	JWVSYBUNCRQTID-CEYNDMKZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K18179332	BRD-K18179332-001-01-4	Broad Institute of MIT and Harvard	BRD-K18179332			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19+,25-/m0/s1	JWVSYBUNCRQTID-CEYNDMKZSA-N	528.274798524							112070
CHEMBL2135487	LSM-23484	SID131428785, BRD-K00378498	54632536	InChI=1S/C25H32N4O6/c1-15-11-26-16(2)13-33-21-9-17(5-7-19(21)24(30)29(3)12-23(15)32-4)27-25(31)28-18-6-8-20-22(10-18)35-14-34-20/h5-10,15-16,23,26H,11-14H2,1-4H3,(H2,27,28,31)/t15-,16-,23+/m1/s1	SLXXNDOTBOUXJA-LNPFQXMTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K00378498	BRD-K00378498-001-01-2	Broad Institute of MIT and Harvard	BRD-K00378498			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H32N4O6/c1-15-11-26-16(2)13-33-21-9-17(5-7-19(21)24(30)29(3)12-23(15)32-4)27-25(31)28-18-6-8-20-22(10-18)35-14-34-20/h5-10,15-16,23,26H,11-14H2,1-4H3,(H2,27,28,31)/t15-,16-,23+/m1/s1	SLXXNDOTBOUXJA-LNPFQXMTSA-N	484.232184784							112071
BRD-K41323747	LSM-23485		54632401	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17-,23-/m0/s1	ZTWKONBDQSNZML-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K41323747	BRD-K41323747-001-01-8	Broad Institute of MIT and Harvard	BRD-K41323747			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17-,23-/m0/s1	ZTWKONBDQSNZML-QQMNAOGKSA-N	491.209006496							112072
BRD-K88746179	LSM-23486		54632375	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	PXVIPBIFKVRXRA-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K88746179	BRD-K88746179-001-01-1	Broad Institute of MIT and Harvard	BRD-K88746179			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-12-20(27-24(30)18-6-8-19(26)9-7-18)10-11-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	PXVIPBIFKVRXRA-YGKZAACZSA-N	457.237684734							112073
BRD-K57014223	LSM-23487		54632384	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21-,27-/m1/s1	CVHVMLMNHJNHLJ-LGVUCKNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K57014223	BRD-K57014223-001-01-7	Broad Institute of MIT and Harvard	BRD-K57014223			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21-,27-/m1/s1	CVHVMLMNHJNHLJ-LGVUCKNBSA-N	493.294056758							112074
BRD-K86986621	LSM-23488		54632287	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18-,22+/m1/s1	AWYPCRXSVTZAPT-HMFYCAOWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K86986621	BRD-K86986621-001-01-9	Broad Institute of MIT and Harvard	BRD-K86986621			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18-,22+/m1/s1	AWYPCRXSVTZAPT-HMFYCAOWSA-N	491.310769462							112075
BRD-K75037209	LSM-23489		54632498	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17+,22-/m1/s1	WWIWLTDSUPVNED-HYFFOGBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K75037209	BRD-K75037209-001-01-4	Broad Institute of MIT and Harvard	BRD-K75037209			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H37N3O4/c1-16-13-25-17(2)15-31-21-11-10-19(26-23(28)18-8-6-5-7-9-18)12-20(21)24(29)27(3)14-22(16)30-4/h10-12,16-18,22,25H,5-9,13-15H2,1-4H3,(H,26,28)/t16-,17+,22-/m1/s1	WWIWLTDSUPVNED-HYFFOGBASA-N	431.278406694							112076
CHEMBL2357894	LSM-23490	BRD-K46171140, SID131428679	54632430	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20-,27-/m0/s1	QPDXZJGVGOHLSD-OSOCVKALSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K46171140	BRD-K46171140-001-01-9	Broad Institute of MIT and Harvard	BRD-K46171140			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20-,27-/m0/s1	QPDXZJGVGOHLSD-OSOCVKALSA-N	509.288971378							112077
BRD-K43594798	LSM-23491		54632542	InChI=1S/C23H33N3O5/c1-14-11-26(16(3)27)15(2)13-31-20-10-18(24-22(28)17-6-7-17)8-9-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,28)/t14-,15+,21+/m1/s1	NHANBWHFHPMELO-WIEQDCTASA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K43594798	BRD-K43594798-001-01-0	Broad Institute of MIT and Harvard	BRD-K43594798			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C23H33N3O5/c1-14-11-26(16(3)27)15(2)13-31-20-10-18(24-22(28)17-6-7-17)8-9-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,28)/t14-,15+,21+/m1/s1	NHANBWHFHPMELO-WIEQDCTASA-N	431.242021186							112078
BRD-K76522065	LSM-23492		54632415	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m0/s1	GLJKQBVQGMWNRJ-GLDPYIMESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K76522065	BRD-K76522065-001-01-7	Broad Institute of MIT and Harvard	BRD-K76522065			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m0/s1	GLJKQBVQGMWNRJ-GLDPYIMESA-N	453.26275663							112079
BRD-K74506898	LSM-23493		54632370	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17+,22-/m1/s1	KQYPWNZZGCEQSB-HYFFOGBASA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCC3	BroadT	BRD-K74506898	BRD-K74506898-001-01-5	Broad Institute of MIT and Harvard	BRD-K74506898			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCC1	InChI=1S/C24H37N3O6S/c1-6-34(30,31)25-19-10-11-21-20(12-19)24(29)26(4)14-22(32-5)16(2)13-27(17(3)15-33-21)23(28)18-8-7-9-18/h10-12,16-18,22,25H,6-9,13-15H2,1-5H3/t16-,17+,22-/m1/s1	KQYPWNZZGCEQSB-HYFFOGBASA-N	495.240306624							112080
BRD-K01212001	LSM-23494		54632292	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16+,23+/m1/s1	WNEJENAGGFCDCH-SYJLOODJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K01212001	BRD-K01212001-001-01-2	Broad Institute of MIT and Harvard	BRD-K01212001			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16+,23+/m1/s1	WNEJENAGGFCDCH-SYJLOODJSA-N	469.221285742							112081
BRD-K37506332	LSM-23495		54632442	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m1/s1	GLJKQBVQGMWNRJ-IECBHUPTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K37506332	BRD-K37506332-001-01-5	Broad Institute of MIT and Harvard	BRD-K37506332			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m1/s1	GLJKQBVQGMWNRJ-IECBHUPTSA-N	453.26275663							112082
BRD-K16715205	LSM-23496		54632427	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21+,26+/m0/s1	PEPLWFCUXOTHLS-LZCXECNNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K16715205	BRD-K16715205-001-01-1	Broad Institute of MIT and Harvard	BRD-K16715205			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C28H36N4O5S2/c1-19-6-9-23(10-7-19)39(34,35)30-22-8-11-25-24(14-22)28(33)31(4)16-26(36-5)20(2)15-32(21(3)18-37-25)17-27-29-12-13-38-27/h6-14,20-21,26,30H,15-18H2,1-5H3/t20-,21+,26+/m0/s1	PEPLWFCUXOTHLS-LZCXECNNSA-N	572.212711672							112083
BRD-K69350885	LSM-23497		54632362	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17+,23-/m0/s1	PRLREIFIMPFNBP-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K69350885	BRD-K69350885-001-01-0	Broad Institute of MIT and Harvard	BRD-K69350885			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17+,23-/m0/s1	PRLREIFIMPFNBP-MFEFFIJZSA-N	509.175119554							112084
BRD-K45737761-001-01-6	LSM-23498	BRD-K45737761	54632231	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16-,20-/m1/s1	KQGPOQXVBLOFLH-JXXFODFXSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K45737761	BRD-K45737761-001-01-6	Broad Institute of MIT and Harvard	BRD-K45737761			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16-,20-/m1/s1	KQGPOQXVBLOFLH-JXXFODFXSA-N	485.21957118							112085
BRD-K34425773	LSM-23499		54632548	InChI=1S/C26H41N3O5/c1-6-11-29-15-18(2)24(32-5)16-28(4)26(31)22-8-7-21(14-23(22)34-17-19(29)3)27-25(30)20-9-12-33-13-10-20/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m1/s1	YETRFLOTOCCFGD-IECBHUPTSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K34425773	BRD-K34425773-001-01-7	Broad Institute of MIT and Harvard	BRD-K34425773			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@H]1C)OC	InChI=1S/C26H41N3O5/c1-6-11-29-15-18(2)24(32-5)16-28(4)26(31)22-8-7-21(14-23(22)34-17-19(29)3)27-25(30)20-9-12-33-13-10-20/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m1/s1	YETRFLOTOCCFGD-IECBHUPTSA-N	475.304621442							112086
BRD-K31851055	LSM-23500		54632315	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-18(27-24(29)19-8-6-7-9-21(19)31-4)10-11-20(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23+/m0/s1	QTTOBGDGRJHAMA-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K31851055	BRD-K31851055-001-01-6	Broad Institute of MIT and Harvard	BRD-K31851055			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3OC)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-18(27-24(29)19-8-6-7-9-21(19)31-4)10-11-20(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23+/m0/s1	QTTOBGDGRJHAMA-HKARXFIJSA-N	455.242021186							112087
BRD-K58971526	LSM-23501		54632419	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16-,21+/m0/s1	VDBLZQGQIDKANX-CKJXQJPGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC3CC3	BroadT	BRD-K58971526	BRD-K58971526-001-01-1	Broad Institute of MIT and Harvard	BRD-K58971526			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16-,21+/m0/s1	VDBLZQGQIDKANX-CKJXQJPGSA-N	481.22465656							112088
BRD-K10847374	LSM-23502		54632463	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22+,28+/m0/s1	PQUKNIWUQFCXJV-PFPZSTESSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccccc4	BroadT	BRD-K10847374	BRD-K10847374-001-01-3	Broad Institute of MIT and Harvard	BRD-K10847374			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22+,28+/m0/s1	PQUKNIWUQFCXJV-PFPZSTESSA-N	535.304621442							112089
BRD-K82446079	LSM-23503		54632324	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18-,22-/m1/s1	AWYPCRXSVTZAPT-JBYIUTFZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K82446079	BRD-K82446079-001-01-5	Broad Institute of MIT and Harvard	BRD-K82446079			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18-,22-/m1/s1	AWYPCRXSVTZAPT-JBYIUTFZSA-N	491.310769462							112090
BRD-K87419143	LSM-23504		54632379	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19-,24+/m1/s1	XOGLRDBIQQOPTC-IECBHUPTSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K87419143	BRD-K87419143-001-01-9	Broad Institute of MIT and Harvard	BRD-K87419143			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19-,24+/m1/s1	XOGLRDBIQQOPTC-IECBHUPTSA-N	483.284554714							112091
BRD-K80880605	LSM-23505		54632348	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21-,26+/m1/s1	YLSSHOUFIJNTGO-YPCDYVTLSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K80880605	BRD-K80880605-001-01-0	Broad Institute of MIT and Harvard	BRD-K80880605			COCC(=O)Nc1ccc2OC[C@@H](C)N(CCc3ccccc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21-,26+/m1/s1	YLSSHOUFIJNTGO-YPCDYVTLSA-N	497.288971378							112092
BRD-K55508908	LSM-23506		54632394	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16+,21-/m1/s1	VDBLZQGQIDKANX-VWKPWSFCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CC3CC3	BroadT	BRD-K55508908	BRD-K55508908-001-01-2	Broad Institute of MIT and Harvard	BRD-K55508908			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C23H35N3O6S/c1-15-12-26(22(27)10-17-6-7-17)16(2)14-32-20-9-8-18(24-33(5,29)30)11-19(20)23(28)25(3)13-21(15)31-4/h8-9,11,15-17,21,24H,6-7,10,12-14H2,1-5H3/t15-,16+,21-/m1/s1	VDBLZQGQIDKANX-VWKPWSFCSA-N	481.22465656							112093
BRD-K37956279	LSM-23507		54632275	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19-,25-/m1/s1	HCZWFODQKFSZHJ-MPCDZSKCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc4ccccn4	BroadT	BRD-K37956279	BRD-K37956279-001-01-7	Broad Institute of MIT and Harvard	BRD-K37956279			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1ccccn1	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19-,25-/m1/s1	HCZWFODQKFSZHJ-MPCDZSKCSA-N	508.268570292							112094
BRD-K98249237	LSM-23508		54632546	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19-,25+/m1/s1	HCZWFODQKFSZHJ-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc4ccccn4	BroadT	BRD-K98249237	BRD-K98249237-001-01-4	Broad Institute of MIT and Harvard	BRD-K98249237			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1ccccn1	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19-,25+/m1/s1	HCZWFODQKFSZHJ-RRQZXNHTSA-N	508.268570292							112095
BRD-K52186107	LSM-23509		54632289	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23-/m0/s1	ZTWKONBDQSNZML-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K52186107	BRD-K52186107-001-01-9	Broad Institute of MIT and Harvard	BRD-K52186107			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23-/m0/s1	ZTWKONBDQSNZML-MFEFFIJZSA-N	491.209006496							112096
BRD-K40282027	LSM-23510		54632317	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m0/s1	GLJKQBVQGMWNRJ-XLNZFTOWSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K40282027	BRD-K40282027-001-01-8	Broad Institute of MIT and Harvard	BRD-K40282027			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-14-21(27-25(30)13-20-9-7-6-8-10-20)11-12-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m0/s1	GLJKQBVQGMWNRJ-XLNZFTOWSA-N	453.26275663							112097
BRD-K45058172	LSM-23511		54632288	InChI=1S/C23H33N3O5/c1-14-11-26(16(3)27)15(2)13-31-20-10-18(24-22(28)17-6-7-17)8-9-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,28)/t14-,15-,21+/m0/s1	NHANBWHFHPMELO-VFCRVFHLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K45058172	BRD-K45058172-001-01-0	Broad Institute of MIT and Harvard	BRD-K45058172			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C23H33N3O5/c1-14-11-26(16(3)27)15(2)13-31-20-10-18(24-22(28)17-6-7-17)8-9-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,28)/t14-,15-,21+/m0/s1	NHANBWHFHPMELO-VFCRVFHLSA-N	431.242021186							112098
BRD-K54604127	LSM-23512		54632305	InChI=1S/C32H37ClN4O6/c1-20-16-37(17-22-9-5-6-10-24(22)31(39)40)21(2)19-43-28-14-13-23(15-25(28)30(38)36(3)18-29(20)42-4)34-32(41)35-27-12-8-7-11-26(27)33/h5-15,20-21,29H,16-19H2,1-4H3,(H,39,40)(H2,34,35,41)/t20-,21-,29-/m1/s1	TYXRNDSRDIONSX-GVNDJSPXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3Cl)ccc2OC[C@@H](C)N(Cc4ccccc4C(=O)O)C[C@H]1C	BroadT	BRD-K54604127	BRD-K54604127-001-01-5	Broad Institute of MIT and Harvard	BRD-K54604127			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3Cl)ccc2OC[C@@H](C)N(Cc2ccccc2C(O)=O)C[C@H]1C	InChI=1S/C32H37ClN4O6/c1-20-16-37(17-22-9-5-6-10-24(22)31(39)40)21(2)19-43-28-14-13-23(15-25(28)30(38)36(3)18-29(20)42-4)34-32(41)35-27-12-8-7-11-26(27)33/h5-15,20-21,29H,16-19H2,1-4H3,(H,39,40)(H2,34,35,41)/t20-,21-,29-/m1/s1	TYXRNDSRDIONSX-GVNDJSPXSA-N	608.240162654							112099
BRD-K00263786	LSM-23513		54632449	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23+/m0/s1	XITJMNWLTPOVPR-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C4CC4	BroadT	BRD-K00263786	BRD-K00263786-001-01-7	Broad Institute of MIT and Harvard	BRD-K00263786			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23+/m0/s1	XITJMNWLTPOVPR-HKARXFIJSA-N	495.248169206							112100
BRD-K24946605	LSM-23514		54632523	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21-,26-/m0/s1	YLSSHOUFIJNTGO-WOVHNISZSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K24946605	BRD-K24946605-001-01-8	Broad Institute of MIT and Harvard	BRD-K24946605			COCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21-,26-/m0/s1	YLSSHOUFIJNTGO-WOVHNISZSA-N	497.288971378							112101
BRD-K66659401	LSM-23515		54632400	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17+,23-/m1/s1	PRLREIFIMPFNBP-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K66659401	BRD-K66659401-001-01-2	Broad Institute of MIT and Harvard	BRD-K66659401			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17+,23-/m1/s1	PRLREIFIMPFNBP-SAHWJRBASA-N	509.175119554							112102
BRD-K20435953	LSM-23516		54632254	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m1/s1	PWNDPCFAFIGLCA-KHCICDEESA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K20435953	BRD-K20435953-001-01-4	Broad Institute of MIT and Harvard	BRD-K20435953			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19-,24-/m1/s1	PWNDPCFAFIGLCA-KHCICDEESA-N	496.268570292							112103
BRD-K72351789	LSM-23517		54632502	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21-,26+/m0/s1	YLSSHOUFIJNTGO-ISJBWFOZSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K72351789	BRD-K72351789-001-01-0	Broad Institute of MIT and Harvard	BRD-K72351789			COCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21-,26+/m0/s1	YLSSHOUFIJNTGO-ISJBWFOZSA-N	497.288971378							112104
BRD-K99452971	LSM-23518		54632408	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m1/s1	PWNDPCFAFIGLCA-IECBHUPTSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccncc3	BroadT	BRD-K99452971	BRD-K99452971-001-01-3	Broad Institute of MIT and Harvard	BRD-K99452971			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccncc1	InChI=1S/C27H36N4O5/c1-6-7-25(32)29-21-8-9-23-22(14-21)27(34)30(4)16-24(35-5)18(2)15-31(19(3)17-36-23)26(33)20-10-12-28-13-11-20/h8-14,18-19,24H,6-7,15-17H2,1-5H3,(H,29,32)/t18-,19-,24+/m1/s1	PWNDPCFAFIGLCA-IECBHUPTSA-N	496.268570292							131264
BRD-K31354456	LSM-23519		54632524	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21+,26+/m1/s1	YLSSHOUFIJNTGO-SWYRRKHMSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K31354456	BRD-K31354456-001-01-6	Broad Institute of MIT and Harvard	BRD-K31354456			COCC(=O)Nc1ccc2OC[C@H](C)N(CCc3ccccc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-20-16-31(14-13-22-9-7-6-8-10-22)21(2)18-36-25-12-11-23(29-27(32)19-34-4)15-24(25)28(33)30(3)17-26(20)35-5/h6-12,15,20-21,26H,13-14,16-19H2,1-5H3,(H,29,32)/t20-,21+,26+/m1/s1	YLSSHOUFIJNTGO-SWYRRKHMSA-N	497.288971378							112107
BRD-K98625375	LSM-23520		54632376	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16+,20-/m1/s1	KQGPOQXVBLOFLH-GQIGUUNPSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K98625375	BRD-K98625375-001-01-7	Broad Institute of MIT and Harvard	BRD-K98625375			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16+,20-/m1/s1	KQGPOQXVBLOFLH-GQIGUUNPSA-N	485.21957118							112108
BRD-K58140298	LSM-23521		54632529	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22-,28-/m1/s1	PQUKNIWUQFCXJV-DQCZWYHMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccccc4	BroadT	BRD-K58140298	BRD-K58140298-001-01-9	Broad Institute of MIT and Harvard	BRD-K58140298			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C31H41N3O5/c1-21-18-34(30(36)24-13-9-6-10-14-24)22(2)20-39-27-16-15-25(32-29(35)23-11-7-5-8-12-23)17-26(27)31(37)33(3)19-28(21)38-4/h6,9-10,13-17,21-23,28H,5,7-8,11-12,18-20H2,1-4H3,(H,32,35)/t21-,22-,28-/m1/s1	PQUKNIWUQFCXJV-DQCZWYHMSA-N	535.304621442							112109
BRD-K05549579	LSM-23522		54632422	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19+,24-/m1/s1	XOGLRDBIQQOPTC-YDIMBITNSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K05549579	BRD-K05549579-001-01-5	Broad Institute of MIT and Harvard	BRD-K05549579			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3cncnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19+,24-/m1/s1	XOGLRDBIQQOPTC-YDIMBITNSA-N	483.284554714							112110
BRD-K23241743	LSM-23523		54632444	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19+,25-/m1/s1	JWVSYBUNCRQTID-HHJKRLRDSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K23241743	BRD-K23241743-001-01-8	Broad Institute of MIT and Harvard	BRD-K23241743			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19+,25-/m1/s1	JWVSYBUNCRQTID-HHJKRLRDSA-N	528.274798524							112111
BRD-K82538319	LSM-23524		54632447	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m0/s1	UTSKQZKBDSTIJA-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K82538319	BRD-K82538319-001-01-9	Broad Institute of MIT and Harvard	BRD-K82538319			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m0/s1	UTSKQZKBDSTIJA-YGKZAACZSA-N	488.219033286							112112
BRD-K85622666	LSM-23525		54632481	InChI=1S/C27H44N4O4/c1-6-13-28-27(33)29-22-11-12-23-24(14-22)35-18-20(3)31(16-21-9-7-8-10-21)15-19(2)25(34-5)17-30(4)26(23)32/h11-12,14,19-21,25H,6-10,13,15-18H2,1-5H3,(H2,28,29,33)/t19-,20+,25-/m0/s1	MRCAHRJZOZLPQK-DFIYOIEZSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(CC3CCCC3)[C@H](C)COc2c1	BroadT	BRD-K85622666	BRD-K85622666-001-01-7	Broad Institute of MIT and Harvard	BRD-K85622666			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CCCC3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H44N4O4/c1-6-13-28-27(33)29-22-11-12-23-24(14-22)35-18-20(3)31(16-21-9-7-8-10-21)15-19(2)25(34-5)17-30(4)26(23)32/h11-12,14,19-21,25H,6-10,13,15-18H2,1-5H3,(H2,28,29,33)/t19-,20+,25-/m0/s1	MRCAHRJZOZLPQK-DFIYOIEZSA-N	488.336255928							112113
BRD-K86109840	LSM-23526		54632434	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20+,27+/m0/s1	QPDXZJGVGOHLSD-ASHZAFPQSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K86109840	BRD-K86109840-001-01-3	Broad Institute of MIT and Harvard	BRD-K86109840			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20+,27+/m0/s1	QPDXZJGVGOHLSD-ASHZAFPQSA-N	509.288971378							112114
BRD-K41089262	LSM-23527		54632410	InChI=1S/C25H35N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h6-13,18-19,24,26H,14-17H2,1-5H3/t18-,19+,24+/m0/s1	BSRUCCSBFZPCQT-XLNZFTOWSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(Cc3ccccc3)C[C@@H]1C	BroadT	BRD-K41089262	BRD-K41089262-001-01-0	Broad Institute of MIT and Harvard	BRD-K41089262			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(Cc2ccccc2)C[C@@H]1C	InChI=1S/C25H35N3O5S/c1-18-14-28(15-20-9-7-6-8-10-20)19(2)17-33-23-13-21(26-34(5,30)31)11-12-22(23)25(29)27(3)16-24(18)32-4/h6-13,18-19,24,26H,14-17H2,1-5H3/t18-,19+,24+/m0/s1	BSRUCCSBFZPCQT-XLNZFTOWSA-N	489.22974194							112115
BRD-K47261271	LSM-23528		54632535	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20-,27+/m0/s1	QPDXZJGVGOHLSD-OWOAZTCBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K47261271	BRD-K47261271-001-01-8	Broad Institute of MIT and Harvard	BRD-K47261271			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H39N3O5/c1-19-15-32(16-21-10-11-21)20(2)18-37-26-13-12-22(14-24(26)29(34)31(3)17-27(19)36-5)30-28(33)23-8-6-7-9-25(23)35-4/h6-9,12-14,19-21,27H,10-11,15-18H2,1-5H3,(H,30,33)/t19-,20-,27+/m0/s1	QPDXZJGVGOHLSD-OWOAZTCBSA-N	509.288971378							112116
BRD-K46561246	LSM-23529		54632372	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25-/m1/s1	AQYOFVQGYZLVTG-FUMQJTLXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3cccc(F)c3)C[C@H]1C	BroadT	BRD-K46561246	BRD-K46561246-001-01-4	Broad Institute of MIT and Harvard	BRD-K46561246			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2cccc(F)c2)C[C@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18+,25-/m1/s1	AQYOFVQGYZLVTG-FUMQJTLXSA-N	471.253334798							112117
BRD-K07996284	LSM-23530		54632294	InChI=1S/C23H33N3O5/c1-14-11-26(16(3)27)15(2)13-31-20-10-18(24-22(28)17-6-7-17)8-9-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,28)/t14-,15+,21+/m0/s1	NHANBWHFHPMELO-PDSXEYIOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K07996284	BRD-K07996284-001-01-2	Broad Institute of MIT and Harvard	BRD-K07996284			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C23H33N3O5/c1-14-11-26(16(3)27)15(2)13-31-20-10-18(24-22(28)17-6-7-17)8-9-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,28)/t14-,15+,21+/m0/s1	NHANBWHFHPMELO-PDSXEYIOSA-N	431.242021186							112118
BRD-K06678077	LSM-23531		54632314	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18-,22-/m0/s1	AWYPCRXSVTZAPT-SPEDKVCISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K06678077	BRD-K06678077-001-01-8	Broad Institute of MIT and Harvard	BRD-K06678077			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18-,22-/m0/s1	AWYPCRXSVTZAPT-SPEDKVCISA-N	491.310769462							112119
BRD-K92913380	LSM-23532		54632418	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21-,27-/m0/s1	CVHVMLMNHJNHLJ-IZVMNLJQSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K92913380	BRD-K92913380-001-01-6	Broad Institute of MIT and Harvard	BRD-K92913380			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C29H39N3O4/c1-20-16-32(17-23-10-11-23)21(2)19-36-26-13-12-24(30-28(33)14-22-8-6-5-7-9-22)15-25(26)29(34)31(3)18-27(20)35-4/h5-9,12-13,15,20-21,23,27H,10-11,14,16-19H2,1-4H3,(H,30,33)/t20-,21-,27-/m0/s1	CVHVMLMNHJNHLJ-IZVMNLJQSA-N	493.294056758							112120
BRD-K45394633	LSM-23533		54632373	InChI=1S/C27H36N4O6/c1-18-14-31(25(32)17-35-4)19(2)16-37-23-13-21(29-27(34)28-20-9-7-6-8-10-20)11-12-22(23)26(33)30(3)15-24(18)36-5/h6-13,18-19,24H,14-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m0/s1	HLIQDYQETVADJC-AXHZCLLHSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K45394633	BRD-K45394633-001-01-2	Broad Institute of MIT and Harvard	BRD-K45394633			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H36N4O6/c1-18-14-31(25(32)17-35-4)19(2)16-37-23-13-21(29-27(34)28-20-9-7-6-8-10-20)11-12-22(23)26(33)30(3)15-24(18)36-5/h6-13,18-19,24H,14-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m0/s1	HLIQDYQETVADJC-AXHZCLLHSA-N	512.263484912							112121
BRD-K42799692	LSM-23534		54632478	InChI=1S/C26H41N3O5/c1-6-11-29-15-18(2)24(32-5)16-28(4)26(31)22-8-7-21(14-23(22)34-17-19(29)3)27-25(30)20-9-12-33-13-10-20/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m1/s1	YETRFLOTOCCFGD-IMWIBFENSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H]1C)OC	BroadT	BRD-K42799692	BRD-K42799692-001-01-3	Broad Institute of MIT and Harvard	BRD-K42799692			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H]1C)OC	InChI=1S/C26H41N3O5/c1-6-11-29-15-18(2)24(32-5)16-28(4)26(31)22-8-7-21(14-23(22)34-17-19(29)3)27-25(30)20-9-12-33-13-10-20/h7-8,14,18-20,24H,6,9-13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m1/s1	YETRFLOTOCCFGD-IMWIBFENSA-N	475.304621442							112122
BRD-K05939258	LSM-23535		54632282	InChI=1S/C33H38N4O5S/c1-21-17-37(18-23-10-13-25(40-4)14-11-23)22(2)20-42-28-16-24(12-15-26(28)33(39)36(3)19-29(21)41-5)34-31(38)32-35-27-8-6-7-9-30(27)43-32/h6-16,21-22,29H,17-20H2,1-5H3,(H,34,38)/t21-,22-,29-/m0/s1	AXRPYCYFPRGHTO-SYZUXVNWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)N(Cc5ccc(OC)cc5)C[C@@H]1C	BroadT	BRD-K05939258	BRD-K05939258-001-01-6	Broad Institute of MIT and Harvard	BRD-K05939258			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)N(Cc2ccc(OC)cc2)C[C@@H]1C	InChI=1S/C33H38N4O5S/c1-21-17-37(18-23-10-13-25(40-4)14-11-23)22(2)20-42-28-16-24(12-15-26(28)33(39)36(3)19-29(21)41-5)34-31(38)32-35-27-8-6-7-9-30(27)43-32/h6-16,21-22,29H,17-20H2,1-5H3,(H,34,38)/t21-,22-,29-/m0/s1	AXRPYCYFPRGHTO-SYZUXVNWSA-N	602.256291046							112123
BRD-K49659981	LSM-23536		54632429	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	SWHZQECMUFTZAT-RNHFSVANSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K49659981	BRD-K49659981-001-01-2	Broad Institute of MIT and Harvard	BRD-K49659981			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3ccccc3)ccc2OC[C@@H]1C)OC	InChI=1S/C27H37N3O4/c1-6-14-30-16-19(2)25(33-5)17-29(4)27(32)23-15-22(12-13-24(23)34-18-20(30)3)28-26(31)21-10-8-7-9-11-21/h7-13,15,19-20,25H,6,14,16-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	SWHZQECMUFTZAT-RNHFSVANSA-N	467.278406694							112124
BRD-K27543887	LSM-23537		54632494	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19+,24-/m0/s1	XOGLRDBIQQOPTC-GLDPYIMESA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K27543887	BRD-K27543887-001-01-9	Broad Institute of MIT and Harvard	BRD-K27543887			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19+,24-/m0/s1	XOGLRDBIQQOPTC-GLDPYIMESA-N	483.284554714							112125
BRD-K28983467	LSM-23538		54632495	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19+,24+/m0/s1	XOGLRDBIQQOPTC-XLNZFTOWSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K28983467	BRD-K28983467-001-01-4	Broad Institute of MIT and Harvard	BRD-K28983467			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cncnc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C26H37N5O4/c1-6-7-25(32)29-21-8-9-23-22(10-21)26(33)30(4)15-24(34-5)18(2)13-31(19(3)16-35-23)14-20-11-27-17-28-12-20/h8-12,17-19,24H,6-7,13-16H2,1-5H3,(H,29,32)/t18-,19+,24+/m0/s1	XOGLRDBIQQOPTC-XLNZFTOWSA-N	483.284554714							112126
BRD-K03479638	LSM-23539		54632395	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17-,23+/m0/s1	ZTWKONBDQSNZML-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K03479638	BRD-K03479638-001-01-6	Broad Institute of MIT and Harvard	BRD-K03479638			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17-,23+/m0/s1	ZTWKONBDQSNZML-HKARXFIJSA-N	491.209006496							112127
BRD-K26402831	LSM-23540		54632525	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23+/m1/s1	XITJMNWLTPOVPR-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CC4	BroadT	BRD-K26402831	BRD-K26402831-001-01-6	Broad Institute of MIT and Harvard	BRD-K26402831			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C26H33N5O5/c1-16-13-31(25(33)18-5-6-18)17(2)15-36-22-8-7-19(29-24(32)21-12-27-9-10-28-21)11-20(22)26(34)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23+/m1/s1	XITJMNWLTPOVPR-QZMQVMSPSA-N	495.248169206							112128
BRD-K56106571	LSM-23541		54632458	InChI=1S/C27H36N4O6/c1-18-14-31(25(32)17-35-4)19(2)16-37-23-13-21(29-27(34)28-20-9-7-6-8-10-20)11-12-22(23)26(33)30(3)15-24(18)36-5/h6-13,18-19,24H,14-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24+/m1/s1	HLIQDYQETVADJC-IMWIBFENSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C)OC	BroadT	BRD-K56106571	BRD-K56106571-001-01-0	Broad Institute of MIT and Harvard	BRD-K56106571			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H]1C)OC	InChI=1S/C27H36N4O6/c1-18-14-31(25(32)17-35-4)19(2)16-37-23-13-21(29-27(34)28-20-9-7-6-8-10-20)11-12-22(23)26(33)30(3)15-24(18)36-5/h6-13,18-19,24H,14-17H2,1-5H3,(H2,28,29,34)/t18-,19+,24+/m1/s1	HLIQDYQETVADJC-IMWIBFENSA-N	512.263484912							112129
BRD-K51934291	LSM-23542		54632471	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m1/s1	UTSKQZKBDSTIJA-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K51934291	BRD-K51934291-001-01-9	Broad Institute of MIT and Harvard	BRD-K51934291			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m1/s1	UTSKQZKBDSTIJA-QZMQVMSPSA-N	488.219033286							112130
BRD-K63436213	LSM-23543		54632405	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m1/s1	UTSKQZKBDSTIJA-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K63436213	BRD-K63436213-001-01-6	Broad Institute of MIT and Harvard	BRD-K63436213			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m1/s1	UTSKQZKBDSTIJA-DGGJZMOXSA-N	488.219033286							112131
BRD-K00586442	LSM-23544		54632265	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18+,23-/m1/s1	ZWOJFBYNCHARNU-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K00586442	BRD-K00586442-001-01-7	Broad Institute of MIT and Harvard	BRD-K00586442			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18+,23-/m1/s1	ZWOJFBYNCHARNU-IEGUWTFLSA-N	460.3049558							112132
BRD-K68853384	LSM-23545		54632266	InChI=1S/C31H37F2N3O5S/c1-20-7-6-8-26(13-20)42(38,39)34-25-10-11-27-29(15-25)41-19-22(3)36(17-23-14-24(32)9-12-28(23)33)16-21(2)30(40-5)18-35(4)31(27)37/h6-15,21-22,30,34H,16-19H2,1-5H3/t21-,22-,30-/m1/s1	ISBXBHMWWTXXGE-NPKFRGRUSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(C)c3)cc2OC[C@@H](C)N(Cc4cc(F)ccc4F)C[C@H]1C	BroadT	BRD-K68853384	BRD-K68853384-001-01-0	Broad Institute of MIT and Harvard	BRD-K68853384			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(C)c3)cc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C31H37F2N3O5S/c1-20-7-6-8-26(13-20)42(38,39)34-25-10-11-27-29(15-25)41-19-22(3)36(17-23-14-24(32)9-12-28(23)33)16-21(2)30(40-5)18-35(4)31(27)37/h6-15,21-22,30,34H,16-19H2,1-5H3/t21-,22-,30-/m1/s1	ISBXBHMWWTXXGE-NPKFRGRUSA-N	601.242198404							112133
BRD-K77119472	LSM-23546		54632541	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19-,25+/m0/s1	HCZWFODQKFSZHJ-XHNVNVPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc4ccccn4	BroadT	BRD-K77119472	BRD-K77119472-001-01-8	Broad Institute of MIT and Harvard	BRD-K77119472			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)Cc1ccccn1	InChI=1S/C28H36N4O5/c1-18-15-32(26(33)14-21-7-5-6-12-29-21)19(2)17-37-24-11-10-22(30-27(34)20-8-9-20)13-23(24)28(35)31(3)16-25(18)36-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,30,34)/t18-,19-,25+/m0/s1	HCZWFODQKFSZHJ-XHNVNVPESA-N	508.268570292							112134
BRD-K60557007	LSM-23547		54632504	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,24-/m0/s1	WEHQYIDEIBHSFW-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc3cccnc3	BroadT	BRD-K60557007	BRD-K60557007-001-01-2	Broad Institute of MIT and Harvard	BRD-K60557007			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)Cc1cccnc1	InChI=1S/C26H34N4O5/c1-17-14-30(25(32)11-20-7-6-10-27-13-20)18(2)16-35-23-12-21(28-19(3)31)8-9-22(23)26(33)29(4)15-24(17)34-5/h6-10,12-13,17-18,24H,11,14-16H2,1-5H3,(H,28,31)/t17-,18+,24-/m0/s1	WEHQYIDEIBHSFW-RHGYRFJNSA-N	482.252920228							112135
BRD-K57389835	LSM-23548		54632479	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16+,23+/m0/s1	WNEJENAGGFCDCH-NXHTTZLHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K57389835	BRD-K57389835-001-01-3	Broad Institute of MIT and Harvard	BRD-K57389835			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc4OCOc4c3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H31N3O6/c1-15-11-26-16(2)13-32-20-8-6-18(10-19(20)25(30)28(3)12-23(15)31-4)27-24(29)17-5-7-21-22(9-17)34-14-33-21/h5-10,15-16,23,26H,11-14H2,1-4H3,(H,27,29)/t15-,16+,23+/m0/s1	WNEJENAGGFCDCH-NXHTTZLHSA-N	469.221285742							112136
BRD-K50924315	LSM-23549		54632241	InChI=1S/C25H33F3N4O5S/c1-17-12-32(13-20-7-5-6-10-29-20)18(2)15-37-22-11-19(30-38(34,35)16-25(26,27)28)8-9-21(22)24(33)31(3)14-23(17)36-4/h5-11,17-18,23,30H,12-16H2,1-4H3/t17-,18-,23-/m0/s1	LYNCQHBDOFOCAR-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(Cc3ccccn3)C[C@@H]1C	BroadT	BRD-K50924315	BRD-K50924315-001-01-3	Broad Institute of MIT and Harvard	BRD-K50924315			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C25H33F3N4O5S/c1-17-12-32(13-20-7-5-6-10-29-20)18(2)15-37-22-11-19(30-38(34,35)16-25(26,27)28)8-9-21(22)24(33)31(3)14-23(17)36-4/h5-11,17-18,23,30H,12-16H2,1-4H3/t17-,18-,23-/m0/s1	LYNCQHBDOFOCAR-BSRJHKFKSA-N	558.212375486							112137
BRD-K02934881	LSM-23550		54632391	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23+/m0/s1	ZTWKONBDQSNZML-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K02934881	BRD-K02934881-001-01-5	Broad Institute of MIT and Harvard	BRD-K02934881			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-6-18(12-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-9-7-19(31-4)8-10-20/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23+/m0/s1	ZTWKONBDQSNZML-YGKZAACZSA-N	491.209006496							112138
BRD-K62150807	LSM-23551		54632378	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25+/m1/s1	AQYOFVQGYZLVTG-GAKIBJFNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3cccc(F)c3)C[C@H]1C	BroadT	BRD-K62150807	BRD-K62150807-001-01-6	Broad Institute of MIT and Harvard	BRD-K62150807			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2cccc(F)c2)C[C@H]1C	InChI=1S/C26H34FN3O4/c1-17-13-30(14-20-7-6-8-21(27)11-20)18(2)16-34-24-10-9-22(28-19(3)31)12-23(24)26(32)29(4)15-25(17)33-5/h6-12,17-18,25H,13-16H2,1-5H3,(H,28,31)/t17-,18-,25+/m1/s1	AQYOFVQGYZLVTG-GAKIBJFNSA-N	471.253334798							112139
BRD-K95792127	LSM-23552		54632366	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16-,20+/m1/s1	KMNKNOWYKUKVAH-QINHECLXSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CCC(F)(F)F)[C@H](C)COc2c1	BroadT	BRD-K95792127	BRD-K95792127-001-01-9	Broad Institute of MIT and Harvard	BRD-K95792127			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O5/c1-15-11-29(9-8-23(24,25)26)16(2)13-34-19-10-17(27-21(30)14-32-4)6-7-18(19)22(31)28(3)12-20(15)33-5/h6-7,10,15-16,20H,8-9,11-14H2,1-5H3,(H,27,30)/t15-,16-,20+/m1/s1	KMNKNOWYKUKVAH-QINHECLXSA-N	489.245055818							112140
BRD-K13572796	LSM-23553		54632302	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18+,22+/m1/s1	AWYPCRXSVTZAPT-FGSXEWAUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K13572796	BRD-K13572796-001-01-4	Broad Institute of MIT and Harvard	BRD-K13572796			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C25H41N5O5/c1-16(2)26-25(33)27-19-9-10-21-20(11-19)24(32)29(7)13-22(34-8)17(3)12-30(18(4)15-35-21)23(31)14-28(5)6/h9-11,16-18,22H,12-15H2,1-8H3,(H2,26,27,33)/t17-,18+,22+/m1/s1	AWYPCRXSVTZAPT-FGSXEWAUSA-N	491.310769462							112141
BRD-K03461876	LSM-23554		54632423	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19-,25+/m0/s1	JWVSYBUNCRQTID-XHNVNVPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K03461876	BRD-K03461876-001-01-5	Broad Institute of MIT and Harvard	BRD-K03461876			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C28H37FN4O5/c1-18-14-33(26(34)16-31(3)4)19(2)17-38-24-12-11-22(30-27(35)20-7-9-21(29)10-8-20)13-23(24)28(36)32(5)15-25(18)37-6/h7-13,18-19,25H,14-17H2,1-6H3,(H,30,35)/t18-,19-,25+/m0/s1	JWVSYBUNCRQTID-XHNVNVPESA-N	528.274798524							112142
BRD-K34282646	LSM-23555		54632295	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17-,23-/m0/s1	PRLREIFIMPFNBP-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K34282646	BRD-K34282646-001-01-7	Broad Institute of MIT and Harvard	BRD-K34282646			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C24H32ClN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17-,23-/m0/s1	PRLREIFIMPFNBP-QQMNAOGKSA-N	509.175119554							112143
BRD-K76588894	LSM-23556		54632358	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m0/s1	VOXXDJJXVVGJRQ-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K76588894	BRD-K76588894-001-01-5	Broad Institute of MIT and Harvard	BRD-K76588894			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-8-7-9-21(12-19)32-5)10-11-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m0/s1	VOXXDJJXVVGJRQ-RHGYRFJNSA-N	469.25767125							112144
BRD-K39546571	LSM-23557		54632339	InChI=1S/C27H36N4O6/c1-18-14-31(25(32)17-35-4)19(2)16-37-23-13-21(29-27(34)28-20-9-7-6-8-10-20)11-12-22(23)26(33)30(3)15-24(18)36-5/h6-13,18-19,24H,14-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m1/s1	HLIQDYQETVADJC-IECBHUPTSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	BroadT	BRD-K39546571	BRD-K39546571-001-01-9	Broad Institute of MIT and Harvard	BRD-K39546571			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H]1C)OC	InChI=1S/C27H36N4O6/c1-18-14-31(25(32)17-35-4)19(2)16-37-23-13-21(29-27(34)28-20-9-7-6-8-10-20)11-12-22(23)26(33)30(3)15-24(18)36-5/h6-13,18-19,24H,14-17H2,1-5H3,(H2,28,29,34)/t18-,19-,24+/m1/s1	HLIQDYQETVADJC-IECBHUPTSA-N	512.263484912							112145
BRD-K67448189	LSM-23558		54632269	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-8-7-16(22-20(25)13-27-5)9-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19+/m1/s1	GMHRVVGQOPSCBZ-VCBZYWHSSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K67448189	BRD-K67448189-001-01-7	Broad Institute of MIT and Harvard	BRD-K67448189			COCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O5/c1-14-10-23(3)15(2)12-29-18-8-7-16(22-20(25)13-27-5)9-17(18)21(26)24(4)11-19(14)28-6/h7-9,14-15,19H,10-13H2,1-6H3,(H,22,25)/t14-,15+,19+/m1/s1	GMHRVVGQOPSCBZ-VCBZYWHSSA-N	407.242021186							112146
BRD-K32988853	LSM-23559		54632350	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16-,20-/m0/s1	KQGPOQXVBLOFLH-FTRWYGJKSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K32988853	BRD-K32988853-001-01-9	Broad Institute of MIT and Harvard	BRD-K32988853			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16-,20-/m0/s1	KQGPOQXVBLOFLH-FTRWYGJKSA-N	485.21957118							112147
BRD-K26809097	LSM-23560		54632340	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m1/s1	UTSKQZKBDSTIJA-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K26809097	BRD-K26809097-001-01-1	Broad Institute of MIT and Harvard	BRD-K26809097			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-18(26)7-9-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m1/s1	UTSKQZKBDSTIJA-SAHWJRBASA-N	488.219033286							112148
BRD-K11859767	LSM-23561		54632501	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17-,22-/m1/s1	LUHNOTAECPFVLC-DRSNIGMVSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3cnccn3	BroadT	BRD-K11859767	BRD-K11859767-001-01-2	Broad Institute of MIT and Harvard	BRD-K11859767			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2cnccn2)c1	InChI=1S/C25H33N5O5/c1-6-23(31)28-18-7-8-19-21(11-18)35-15-17(3)30(25(33)20-12-26-9-10-27-20)13-16(2)22(34-5)14-29(4)24(19)32/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,31)/t16-,17-,22-/m1/s1	LUHNOTAECPFVLC-DRSNIGMVSA-N	483.248169206							112149
BRD-K95014616	LSM-23562		54632270	InChI=1S/C29H36N4O5/c1-19-15-33(16-24-14-27(38-31-24)22-9-7-6-8-10-22)20(2)18-37-26-12-11-23(30-21(3)34)13-25(26)29(35)32(4)17-28(19)36-5/h6-14,19-20,28H,15-18H2,1-5H3,(H,30,34)/t19-,20-,28-/m1/s1	ALGROYFZYPFPRJ-NCXSOUSFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3cc(on3)c4ccccc4)C[C@H]1C	BroadT	BRD-K95014616	BRD-K95014616-001-01-6	Broad Institute of MIT and Harvard	BRD-K95014616			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2cc(on2)-c2ccccc2)C[C@H]1C	InChI=1S/C29H36N4O5/c1-19-15-33(16-24-14-27(38-31-24)22-9-7-6-8-10-22)20(2)18-37-26-12-11-23(30-21(3)34)13-25(26)29(35)32(4)17-28(19)36-5/h6-14,19-20,28H,15-18H2,1-5H3,(H,30,34)/t19-,20-,28-/m1/s1	ALGROYFZYPFPRJ-NCXSOUSFSA-N	520.268570292							112150
BRD-K18435317	LSM-23563		54632440	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19-,27+/m1/s1	BPZWTLHMBRUMNW-KFDHSVMUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccccn4	BroadT	BRD-K18435317	BRD-K18435317-001-01-9	Broad Institute of MIT and Harvard	BRD-K18435317			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cc(F)ccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccn1	InChI=1S/C30H33F2N5O5/c1-18-15-37(29(39)24-7-5-6-12-33-24)19(2)17-42-26-11-9-21(14-22(26)28(38)36(3)16-27(18)41-4)34-30(40)35-25-13-20(31)8-10-23(25)32/h5-14,18-19,27H,15-17H2,1-4H3,(H2,34,35,40)/t18-,19-,27+/m1/s1	BPZWTLHMBRUMNW-KFDHSVMUSA-N	581.244975606							112151
SMR000142934	LSM-23564	SID14736159, BRD-K56872287	976058	InChI=1S/C20H14N2O/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)20-21-19(22-23-20)16-11-5-2-6-12-16/h1-14H	NBYSMABLVSMRAW-UHFFFAOYSA-N	o1nc(nc1c2ccccc2c3ccccc3)c4ccccc4	BroadT	BRD-K56872287	BRD-K56872287-001-06-1	ChemBridge Corporation	7705414			c1ccc(cc1)-c1noc(n1)-c1ccccc1-c1ccccc1	InChI=1S/C20H14N2O/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)20-21-19(22-23-20)16-11-5-2-6-12-16/h1-14H	NBYSMABLVSMRAW-UHFFFAOYSA-N	298.110613088							112152
MLS000071758	LSM-23565	SID842828, BRD-K78599916	54682383	InChI=1S/C20H18N2O3/c23-18-15-8-4-7-14-10-12-22(17(14)15)20(25)16(18)19(24)21-11-9-13-5-2-1-3-6-13/h1-8,23H,9-12H2,(H,21,24)	SNJUCAVBVLXDLD-UHFFFAOYSA-N	OC1=C(C(=O)NCCc2ccccc2)C(=O)N3CCc4cccc1c34	BroadT	BRD-K78599916	BRD-K78599916-001-06-3	Asinex Ltd.	BAS 03848087			Oc1c(C(=O)NCCc2ccccc2)c(=O)n2CCc3cccc1c23	InChI=1S/C20H18N2O3/c23-18-15-8-4-7-14-10-12-22(17(14)15)20(25)16(18)19(24)21-11-9-13-5-2-1-3-6-13/h1-8,23H,9-12H2,(H,21,24)	SNJUCAVBVLXDLD-UHFFFAOYSA-N	334.131742456							112153
2,4-Dichloro-benzoic acid n'-(2,6-di-morpholin-4-yl-pyrimidin-4-yl)-hydrazide	LSM-23566	SID17507567, BRD-K34885859	1109403	InChI=1S/C19H22Cl2N6O3/c20-13-1-2-14(15(21)11-13)18(28)25-24-16-12-17(26-3-7-29-8-4-26)23-19(22-16)27-5-9-30-10-6-27/h1-2,11-12H,3-10H2,(H,25,28)(H,22,23,24)	PFPGGKKUMSCXOR-UHFFFAOYSA-N	Clc1ccc(C(=O)NNc2cc(nc(n2)N3CCOCC3)N4CCOCC4)c(Cl)c1	BroadT	BRD-K34885859	BRD-K34885859-001-05-0	Asinex Ltd.	BAS 00880425			Clc1ccc(C(=O)NNc2cc(nc(n2)N2CCOCC2)N2CCOCC2)c(Cl)c1	InChI=1S/C19H22Cl2N6O3/c20-13-1-2-14(15(21)11-13)18(28)25-24-16-12-17(26-3-7-29-8-4-26)23-19(22-16)27-5-9-30-10-6-27/h1-2,11-12H,3-10H2,(H,25,28)(H,22,23,24)	PFPGGKKUMSCXOR-UHFFFAOYSA-N	452.113044044							112154
AJ-292/41694460	LSM-43995	SID17433338, BRD-K58455347	1213420	InChI=1S/C22H27N3O2S/c1-26-20-15-19(16-21(17-20)27-2)23-22(28)25-13-11-24(12-14-25)10-6-9-18-7-4-3-5-8-18/h3-9,15-17H,10-14H2,1-2H3,(H,23,28)/b9-6+	JAFQAOSQKDLMQS-RMKNXTFCSA-N	COc1cc(NC(=S)N2CCN(C\C=C\c3ccccc3)CC2)cc(OC)c1	BroadT	BRD-K58455347	BRD-K58455347-001-06-1	ChemBridge Corporation	7552614			COc1cc(NC(=S)N2CCN(C\C=C\c3ccccc3)CC2)cc(OC)c1	InChI=1S/C22H27N3O2S/c1-26-20-15-19(16-21(17-20)27-2)23-22(28)25-13-11-24(12-14-25)10-6-9-18-7-4-3-5-8-18/h3-9,15-17H,10-14H2,1-2H3,(H,23,28)/b9-6+	JAFQAOSQKDLMQS-RMKNXTFCSA-N	397.182397824							
SMR000150125	LSM-23568	SID14746727, BRD-K03373655	2363156	InChI=1S/C17H17ClN2O5S/c1-20(26(23,24)15-9-7-13(18)8-10-15)11-17(22)25-12-16(21)19-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,19,21)	UPNKRERTQUBBIN-UHFFFAOYSA-N	CN(CC(=O)OCC(=O)Nc1ccccc1)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K03373655	BRD-K03373655-001-06-8	Enamine Ltd.	T0512-2596			CN(CC(=O)OCC(=O)Nc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C17H17ClN2O5S/c1-20(26(23,24)15-9-7-13(18)8-10-15)11-17(22)25-12-16(21)19-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,19,21)	UPNKRERTQUBBIN-UHFFFAOYSA-N	396.054670064							112156
AC1MWR4E	LSM-23569	BRD-A33642205	3778637	InChI=1S/C26H21N3O5/c1-33-19-14-8-6-12-17(19)28-25(31)21-22(24(30)16-10-4-3-5-11-16)27-29(23(21)26(28)32)18-13-7-9-15-20(18)34-2/h3-15,26,32H,1-2H3	YAVYDRZHTYXBIQ-UHFFFAOYSA-N	COc1ccccc1N1C(O)c2c(C1=O)c(nn2-c1ccccc1OC)C(=O)c1ccccc1	BroadT	BRD-A33642205	BRD-A33642205-001-06-7	InterBioScreen Ltd.	STOCK3S-50967			COc1ccccc1N1N=C(C2C1C(=O)N(C2=O)c1ccccc1OC)C(=O)c1ccccc1	InChI=1S/C26H21N3O5/c1-33-19-14-8-6-12-17(19)28-25(31)21-22(24(30)16-10-4-3-5-11-16)27-29(23(21)26(28)32)18-13-7-9-15-20(18)34-2/h3-15,21,23H,1-2H3	ZUZQEZAJBSNUGJ-UHFFFAOYSA-N	455.148120802							
T5460040	LSM-23570	SID26670498, BRD-K84108405	2522630	InChI=1S/C15H10N4O2S/c20-13-7-10(18-15-19(13)5-6-22-15)8-21-14-11-3-1-2-4-12(11)16-9-17-14/h1-7,9H,8H2	YTXIFHZCLNEEHO-UHFFFAOYSA-N	O=C1C=C(COc2ncnc3ccccc23)N=C4SC=CN14	BroadT	BRD-K84108405	BRD-K84108405-001-06-3	Enamine Ltd.	T5315591			O=c1cc(COc2ncnc3ccccc23)nc2sccn12	InChI=1S/C15H10N4O2S/c20-13-7-10(18-15-19(13)5-6-22-15)8-21-14-11-3-1-2-4-12(11)16-9-17-14/h1-7,9H,8H2	YTXIFHZCLNEEHO-UHFFFAOYSA-N	310.05244629							112158
BAS 09620536	LSM-23571	SID4261160, BRD-K61780473	1094906	InChI=1S/C17H13N3O3S/c1-20-13-8-9-14(11-5-4-6-12(16(11)13)17(20)21)24(22,23)19-15-7-2-3-10-18-15/h2-10H,1H3,(H,18,19)	APPXCMLRVQQRNG-UHFFFAOYSA-N	CN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)Nc4ccccn4	BroadT	BRD-K61780473	BRD-K61780473-001-05-5	ChemBridge Corporation	7917673			CN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)Nc1ccccn1	InChI=1S/C17H13N3O3S/c1-20-13-8-9-14(11-5-4-6-12(16(11)13)17(20)21)24(22,23)19-15-7-2-3-10-18-15/h2-10H,1H3,(H,18,19)	APPXCMLRVQQRNG-UHFFFAOYSA-N	339.067761996							112159
MLS000081936	LSM-23572	SID3713319, BRD-K22397749	2998367	InChI=1S/C15H16N2O4S/c1-11(18)16-12-3-9-15(10-4-12)22(20,21)17(2)13-5-7-14(19)8-6-13/h3-10,19H,1-2H3,(H,16,18)	QNUMCSUIAGXGGL-UHFFFAOYSA-N	CN(c1ccc(O)cc1)S(=O)(=O)c2ccc(NC(=O)C)cc2	BroadT	BRD-K22397749	BRD-K22397749-001-05-4	Enamine Ltd.	T0516-8871			CN(c1ccc(O)cc1)S(=O)(=O)c1ccc(NC(C)=O)cc1	InChI=1S/C15H16N2O4S/c1-11(18)16-12-3-9-15(10-4-12)22(20,21)17(2)13-5-7-14(19)8-6-13/h3-10,19H,1-2H3,(H,16,18)	QNUMCSUIAGXGGL-UHFFFAOYSA-N	320.083077702							112160
3-(4-Methoxyphenyl)-2,5-dimethyl-7-phenylpyrazolo[1,5-a]pyrimidine	LSM-23573	SID24819137, BRD-K28740088	744062	InChI=1S/C21H19N3O/c1-14-13-19(16-7-5-4-6-8-16)24-21(22-14)20(15(2)23-24)17-9-11-18(25-3)12-10-17/h4-13H,1-3H3	MHMXZDIZADPLOU-UHFFFAOYSA-N	COc1ccc(cc1)c2c(C)nn3c(cc(C)nc23)c4ccccc4	BroadT	BRD-K28740088	BRD-K28740088-001-05-8	ChemDiv Inc.	D015-0195			COc1ccc(cc1)-c1c(C)nn2c(cc(C)nc12)-c1ccccc1	InChI=1S/C21H19N3O/c1-14-13-19(16-7-5-4-6-8-16)24-21(22-14)20(15(2)23-24)17-9-11-18(25-3)12-10-17/h4-13H,1-3H3	MHMXZDIZADPLOU-UHFFFAOYSA-N	329.152812258							112161
SMR000019723	LSM-23574	SID4246398, BRD-K97558524	2927070	InChI=1S/C16H18N6OS/c1-3-7-12(8-4-1)15-17-14(23-19-15)11-24-16-18-20-21-22(16)13-9-5-2-6-10-13/h1,3-4,7-8,13H,2,5-6,9-11H2	WPENLLOICBPYIE-UHFFFAOYSA-N	C(Sc1nnnn1C2CCCCC2)c3onc(n3)c4ccccc4	BroadT	BRD-K97558524	BRD-K97558524-001-05-2	ChemDiv Inc.	5371-4673			C(Sc1nnnn1C1CCCCC1)c1nc(no1)-c1ccccc1	InChI=1S/C16H18N6OS/c1-3-7-12(8-4-1)15-17-14(23-19-15)11-24-16-18-20-21-22(16)13-9-5-2-6-10-13/h1,3-4,7-8,13H,2,5-6,9-11H2	WPENLLOICBPYIE-UHFFFAOYSA-N	342.126279946							112162
MLS000533449	LSM-23575	SID14731098, SID78167, BRD-K06329530	224935	InChI=1S/C10H12N2O3S/c1-15-8-5-3-2-4-7(8)12-9(13)6-16-10(11)14/h2-5H,6H2,1H3,(H2,11,14)(H,12,13)	WZDOMPZYPBKCOE-UHFFFAOYSA-N	COc1ccccc1NC(=O)CSC(=O)N	BroadT	BRD-K06329530	BRD-K06329530-001-06-8	ChemBridge Corporation	5947535			COc1ccccc1NC(=O)CSC(N)=O	InChI=1S/C10H12N2O3S/c1-15-8-5-3-2-4-7(8)12-9(13)6-16-10(11)14/h2-5H,6H2,1H3,(H2,11,14)(H,12,13)	WZDOMPZYPBKCOE-UHFFFAOYSA-N	240.056862954							112163
STK022500	LSM-23576	SID24805191, BRD-K65985499	762095	InChI=1S/C16H15N3O/c1-11-3-6-14(7-4-11)19-10-17-15-9-13(18-12(2)20)5-8-16(15)19/h3-10H,1-2H3,(H,18,20)	QBTHFKPSCQLJKV-UHFFFAOYSA-N	CC(=O)Nc1ccc2c(c1)ncn2c3ccc(C)cc3	BroadT	BRD-K65985499	BRD-K65985499-001-06-4	Asinex Ltd.	BAS 01403634			CC(=O)Nc1ccc2n(cnc2c1)-c1ccc(C)cc1	InChI=1S/C16H15N3O/c1-11-3-6-14(7-4-11)19-10-17-15-9-13(18-12(2)20)5-8-16(15)19/h3-10H,1-2H3,(H,18,20)	QBTHFKPSCQLJKV-UHFFFAOYSA-N	265.12151213							112164
NSC661161	LSM-23577	SID4254759, SID509618, BRD-K04847028	378526	InChI=1S/C13H13N5O2/c1-17-10-9(11(19)18(2)13(17)20)15-12(16-10)14-8-6-4-3-5-7-8/h3-7H,1-2H3,(H2,14,15,16)	RXCJTNUAETXUOY-UHFFFAOYSA-N	CN1C(=O)N(C)c2[nH]c(Nc3ccccc3)nc2C1=O	BroadT	BRD-K04847028	BRD-K04847028-001-06-0	ChemBridge Corporation	7745998			Cn1c2[nH]c(Nc3ccccc3)nc2c(=O)n(C)c1=O	InChI=1S/C13H13N5O2/c1-17-10-9(11(19)18(2)13(17)20)15-12(16-10)14-8-6-4-3-5-7-8/h3-7H,1-2H3,(H2,14,15,16)	RXCJTNUAETXUOY-UHFFFAOYSA-N	271.106924706							112165
N-(1-Ethyl-2-oxo-1,2-dihydro-benzo[cd]indol-6-yl)-benzamide	LSM-23578	SID14725456, BRD-K06110588	830293	InChI=1S/C20H16N2O2/c1-2-22-17-12-11-16(21-19(23)13-7-4-3-5-8-13)14-9-6-10-15(18(14)17)20(22)24/h3-12H,2H2,1H3,(H,21,23)	WMFSFQHOPQOZTF-UHFFFAOYSA-N	CCN1C(=O)c2cccc3c(NC(=O)c4ccccc4)ccc1c23	BroadT	BRD-K06110588	BRD-K06110588-001-05-5	Asinex Ltd.	BAS 00157043			CCN1C(=O)c2cccc3c(NC(=O)c4ccccc4)ccc1c23	InChI=1S/C20H16N2O2/c1-2-22-17-12-11-16(21-19(23)13-7-4-3-5-8-13)14-9-6-10-15(18(14)17)20(22)24/h3-12H,2H2,1H3,(H,21,23)	WMFSFQHOPQOZTF-UHFFFAOYSA-N	316.121177772							112166
AC1LSBEQ	LSM-23579	SID24802090, BRD-K51215204	1462215	InChI=1S/C19H21ClN4O2S/c1-2-24-18-6-4-3-5-17(18)21-19(24)22-11-13-23(14-12-22)27(25,26)16-9-7-15(20)8-10-16/h3-10H,2,11-14H2,1H3	WAWROLBZXUSKFC-UHFFFAOYSA-N	CCn1c(nc2ccccc12)N3CCN(CC3)S(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K51215204	BRD-K51215204-001-06-8	Asinex Ltd.	ASN 06354474			CCn1c(nc2ccccc12)N1CCN(CC1)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C19H21ClN4O2S/c1-2-24-18-6-4-3-5-17(18)21-19(24)22-11-13-23(14-12-22)27(25,26)16-9-7-15(20)8-10-16/h3-10H,2,11-14H2,1H3	WAWROLBZXUSKFC-UHFFFAOYSA-N	404.107374352							112167
AC1OAQEJ	LSM-23580	SID14743373, BRD-A01283587	6833748	InChI=1S/C27H24ClN3O5S/c1-35-23-11-7-10-18(26(23)36-2)22-15-21(30-31(22)37(3,33)34)25-24(16-8-5-4-6-9-16)19-14-17(28)12-13-20(19)29-27(25)32/h4-14,22H,15H2,1-3H3,(H,29,32)	UJXSFYFASSWSEQ-UHFFFAOYSA-N	COc1cccc(C2CC(=NN2S(=O)(=O)C)c3c(O)nc4ccc(Cl)cc4c3c5ccccc5)c1OC	BroadT	BRD-A01283587	BRD-A01283587-001-06-6	InterBioScreen Ltd.	STOCK2S-82783			COc1cccc(C2CC(=NN2S(C)(=O)=O)c2c(O)nc3ccc(Cl)cc3c2-c2ccccc2)c1OC	InChI=1S/C27H24ClN3O5S/c1-35-23-11-7-10-18(26(23)36-2)22-15-21(30-31(22)37(3,33)34)25-24(16-8-5-4-6-9-16)19-14-17(28)12-13-20(19)29-27(25)32/h4-14,22H,15H2,1-3H3,(H,29,32)	UJXSFYFASSWSEQ-UHFFFAOYSA-N	537.112519298							
AC1MGRG7	LSM-23581	SID24783927, BRD-A96470865	2940367	InChI=1S/C18H16N2O3S/c1-10(21)15-16(11-5-3-2-4-6-11)19-18(24)20-17(15)12-7-8-13(22)14(23)9-12/h2-9,17,22-23H,1H3,(H2,19,20,24)	WVYIAAZJUCFFLU-UHFFFAOYSA-N	CC(=O)C1=C(N=C(S)NC1c2ccc(O)c(O)c2)c3ccccc3	BroadT	BRD-A96470865	BRD-A96470865-001-05-0	ChemBridge Corporation	7467076			CC(=O)C1=C(N=C(S)NC1c1ccc(O)c(O)c1)c1ccccc1	InChI=1S/C18H16N2O3S/c1-10(21)15-16(11-5-3-2-4-6-11)19-18(24)20-17(15)12-7-8-13(22)14(23)9-12/h2-9,17,22-23H,1H3,(H2,19,20,24)	WVYIAAZJUCFFLU-UHFFFAOYSA-N	340.088163082							112169
AC1NWW72	LSM-43626	BRD-A62750882	5737391	InChI=1S/C21H33NO2/c1-5-8-19-9-10-20(21(14-19)23-4)24-12-7-6-11-22-15-17(2)13-18(3)16-22/h5,8-10,14,17-18H,6-7,11-13,15-16H2,1-4H3/b8-5+	XJPDXOUEONEOAM-VMPITWQZSA-N	COc1cc(\C=C\C)ccc1OCCCCN2CC(C)CC(C)C2	BroadT	BRD-A62750882	BRD-A62750882-034-11-3	ChemBridge Corporation	7346974		OC(=O)C(=O)O	COc1cc(ccc1OCCCCN1CC(C)CC(C)C1)\C=C\C.OC(=O)C(=O)O	InChI=1S/C21H33NO2.C2H2O4/c1-5-8-19-9-10-20(21(14-19)23-4)24-12-7-6-11-22-15-17(2)13-18(3)16-22;3-1(4)2(5)6/h5,8-10,14,17-18H,6-7,11-13,15-16H2,1-4H3;(H,3,4)(H,5,6)/b8-5+;	OPMLPYAYMBJHLW-HAAWTFQLSA-N	331.251129306							, 
T5850092	LSM-23582	SID17505525, BRD-K34901837	12004609	InChI=1S/C21H15FN2O2/c22-14-6-5-7-15(12-14)23-20(25)13-24-18-10-3-1-8-16(18)21(26)17-9-2-4-11-19(17)24/h1-12H,13H2,(H,23,25)	WUBVOKGXZIFEJZ-UHFFFAOYSA-N	Fc1cccc(NC(=O)CN2c3ccccc3C(=O)c4ccccc24)c1	BroadT	BRD-K34901837	BRD-K34901837-001-06-0	ChemDiv Inc.	3562-5798			Fc1cccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc23)c1	InChI=1S/C21H15FN2O2/c22-14-6-5-7-15(12-14)23-20(25)13-24-18-10-3-1-8-16(18)21(26)17-9-2-4-11-19(17)24/h1-12H,13H2,(H,23,25)	WUBVOKGXZIFEJZ-UHFFFAOYSA-N	346.11175594							112170
AC1MIVWD	LSM-23583	SID17408908, BRD-K97532930	3127356	InChI=1S/C15H15N3O5/c1-9-5-6-11(22-2)10(8-9)16-14(20)15(21)18-17-13(19)12-4-3-7-23-12/h3-8H,1-2H3,(H,16,20)(H,17,19)(H,18,21)	TUDPHOXMLPYINP-UHFFFAOYSA-N	COc1ccc(C)cc1NC(=O)C(=O)NNC(=O)c2occc2	BroadT	BRD-K97532930	BRD-K97532930-001-05-5	Asinex Ltd.	BAS 01189354			COc1ccc(C)cc1NC(=O)C(=O)NNC(=O)c1ccco1	InChI=1S/C15H15N3O5/c1-9-5-6-11(22-2)10(8-9)16-14(20)15(21)18-17-13(19)12-4-3-7-23-12/h3-8H,1-2H3,(H,16,20)(H,17,19)(H,18,21)	TUDPHOXMLPYINP-UHFFFAOYSA-N	317.10117061							112171
AC1O6Y9U	LSM-43997	SID26662084, BRD-K26303018	6538476	InChI=1S/C20H17N3O/c1-14-18(20(24)23(21-14)16-8-4-3-5-9-16)12-15-13-22(2)19-11-7-6-10-17(15)19/h3-13H,1-2H3/b18-12+	LDXSNVKQYCIAAK-LDADJPATSA-N	CC1=NN(C(=O)/C/1=C/c2cn(C)c3ccccc23)c4ccccc4	BroadT	BRD-K26303018	BRD-K26303018-001-06-0	InterBioScreen Ltd.	STOCK3S-29612			CC1=NN(C(=O)C\1=C\c1cn(C)c2ccccc12)c1ccccc1	InChI=1S/C20H17N3O/c1-14-18(20(24)23(21-14)16-8-4-3-5-9-16)12-15-13-22(2)19-11-7-6-10-17(15)19/h3-13H,1-2H3/b18-12+	LDXSNVKQYCIAAK-LDADJPATSA-N	315.137162194							
MLS000037195	LSM-23585	SID859999, SID50103021, BRD-K06442596	661309	InChI=1S/C18H18N2O/c1-13(2)12-20-17-7-5-4-6-16(17)19-18(20)14-8-10-15(21-3)11-9-14/h4-11H,1,12H2,2-3H3	LGDGDFSCRBKMNA-UHFFFAOYSA-N	COc1ccc(cc1)c2nc3ccccc3n2CC(=C)C	BroadT	BRD-K06442596	BRD-K06442596-001-05-2	InterBioScreen Ltd.	STOCK3S-48665			COc1ccc(cc1)-c1nc2ccccc2n1CC(C)=C	InChI=1S/C18H18N2O/c1-13(2)12-20-17-7-5-4-6-16(17)19-18(20)14-8-10-15(21-3)11-9-14/h4-11H,1,12H2,2-3H3	LGDGDFSCRBKMNA-UHFFFAOYSA-N	278.141913216							112173
4-Fluoro-n-(5-methylpyridin-2-yl)benzamide	LSM-23586	SID24805703, BRD-K61947206	836018	InChI=1S/C13H11FN2O/c1-9-2-7-12(15-8-9)16-13(17)10-3-5-11(14)6-4-10/h2-8H,1H3,(H,15,16,17)	FVOHJIYCTRVAMA-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2ccc(F)cc2)nc1	BroadT	BRD-K61947206	BRD-K61947206-001-05-4	Asinex Ltd.	BAS 01936483			Cc1ccc(NC(=O)c2ccc(F)cc2)nc1	InChI=1S/C13H11FN2O/c1-9-2-7-12(15-8-9)16-13(17)10-3-5-11(14)6-4-10/h2-8H,1H3,(H,15,16,17)	FVOHJIYCTRVAMA-UHFFFAOYSA-N	230.085541192							112174
N-[2-(Naphthalen-1-ylcarbamoyl)-1-phenyl-ethyl]-benzamide	LSM-23587	SID17509095, BRD-A14133515	2893685	InChI=1S/C26H22N2O2/c29-25(27-23-17-9-15-19-10-7-8-16-22(19)23)18-24(20-11-3-1-4-12-20)28-26(30)21-13-5-2-6-14-21/h1-17,24H,18H2,(H,27,29)(H,28,30)	YVURXVPYSKPAOK-UHFFFAOYSA-N	O=C(CC(NC(=O)c1ccccc1)c2ccccc2)Nc3cccc4ccccc34	BroadT	BRD-A14133515	BRD-A14133515-001-05-7	Asinex Ltd.	BAS 02729797			O=C(CC(NC(=O)c1ccccc1)c1ccccc1)Nc1cccc2ccccc12	InChI=1S/C26H22N2O2/c29-25(27-23-17-9-15-19-10-7-8-16-22(19)23)18-24(20-11-3-1-4-12-20)28-26(30)21-13-5-2-6-14-21/h1-17,24H,18H2,(H,27,29)(H,28,30)	YVURXVPYSKPAOK-UHFFFAOYSA-N	394.168127964							112175
AC1MSXRF	LSM-23588	SID7967471, BRD-A27762595	3591778	InChI=1S/C16H14ClN3O2S/c1-22-14-3-2-11(17)8-12(14)19-15(21)13-9-23-16(20-13)10-4-6-18-7-5-10/h2-8,13H,9H2,1H3,(H,19,21)	ZVYQJRGMKAGQOG-UHFFFAOYSA-N	COc1ccc(Cl)cc1NC(=O)C2CSC(=N2)c3ccncc3	BroadT	BRD-A27762595	BRD-A27762595-001-04-4	ChemDiv Inc.	K783-6326			COc1ccc(Cl)cc1NC(=O)C1CSC(=N1)c1ccncc1	InChI=1S/C16H14ClN3O2S/c1-22-14-3-2-11(17)8-12(14)19-15(21)13-9-23-16(20-13)10-4-6-18-7-5-10/h2-8,13H,9H2,1H3,(H,19,21)	ZVYQJRGMKAGQOG-UHFFFAOYSA-N	347.049525118							112176
F0818-0045	LSM-23589	SID14726324, BRD-K44973649	2891734	InChI=1S/C25H22N2O3/c28-22(26-15-13-17-6-1-2-7-19(17)16-26)12-5-14-27-24(29)20-10-3-8-18-9-4-11-21(23(18)20)25(27)30/h1-4,6-11H,5,12-16H2	OFLUEWCNSWBQMJ-UHFFFAOYSA-N	O=C(CCCN1C(=O)c2cccc3cccc(C1=O)c23)N4CCc5ccccc5C4	BroadT	BRD-K44973649	BRD-K44973649-001-05-7	Asinex Ltd.	BAS 03353052			O=C(CCCN1C(=O)c2cccc3cccc(C1=O)c23)N1CCc2ccccc2C1	InChI=1S/C25H22N2O3/c28-22(26-15-13-17-6-1-2-7-19(17)16-26)12-5-14-27-24(29)20-10-3-8-18-9-4-11-21(23(18)20)25(27)30/h1-4,6-11H,5,12-16H2	OFLUEWCNSWBQMJ-UHFFFAOYSA-N	398.163042584							112177
MLS000034684	LSM-23590	SID847243, BRD-K98617141	649642	InChI=1S/C20H18ClFN4O2/c21-15-3-7-17(8-4-15)23-20(27)26-11-9-14(10-12-26)19-24-18(25-28-19)13-1-5-16(22)6-2-13/h1-8,14H,9-12H2,(H,23,27)	BRBNNTPMPPOLCQ-UHFFFAOYSA-N	Fc1ccc(cc1)c2noc(n2)C3CCN(CC3)C(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K98617141	BRD-K98617141-001-06-6	Asinex Ltd.	ASN 06926483			Fc1ccc(cc1)-c1noc(n1)C1CCN(CC1)C(=O)Nc1ccc(Cl)cc1	InChI=1S/C20H18ClFN4O2/c21-15-3-7-17(8-4-15)23-20(27)26-11-9-14(10-12-26)19-24-18(25-28-19)13-1-5-16(22)6-2-13/h1-8,14H,9-12H2,(H,23,27)	BRBNNTPMPPOLCQ-UHFFFAOYSA-N	400.110231766							112178
ST4109819	LSM-23591	SID24795163, BRD-K21693855	935207	InChI=1S/C9H7FN4O3/c1-13-9(11-8(12-13)14(15)16)17-7-5-3-2-4-6(7)10/h2-5H,1H3	HZUOUSAGAHJDRC-UHFFFAOYSA-N	Cn1nc(nc1Oc2ccccc2F)[N+](=O)[O-]	BroadT	BRD-K21693855	BRD-K21693855-001-06-5	ChemBridge Corporation	7936126			Cn1nc(nc1Oc1ccccc1F)[N+]([O-])=O	InChI=1S/C9H7FN4O3/c1-13-9(11-8(12-13)14(15)16)17-7-5-3-2-4-6(7)10/h2-5H,1H3	HZUOUSAGAHJDRC-UHFFFAOYSA-N	238.050218324							112179
AC1O98VG	LSM-23592	SID848656, BRD-K55621929	6750825	InChI=1S/C14H13N3OS/c1-17-13(15-16-14(17)19-2)11-7-9-5-3-4-6-10(9)8-12(11)18/h3-8,18H,1-2H3	DHFMOEGTWJWYCY-UHFFFAOYSA-N	CSc1nnc(c2cc3ccccc3cc2O)n1C	BroadT	BRD-K55621929	BRD-K55621929-001-06-7	Asinex Ltd.	BAS 04839889			CSc1nnc(-c2cc3ccccc3cc2O)n1C	InChI=1S/C14H13N3OS/c1-17-13(15-16-14(17)19-2)11-7-9-5-3-4-6-10(9)8-12(11)18/h3-8,18H,1-2H3	DHFMOEGTWJWYCY-UHFFFAOYSA-N	271.077932756							
STK259453	LSM-15351	BRD-K65532249	958523	InChI=1S/C20H25N3O/c1-15-4-5-17(14-16(15)2)20(24)21-18-6-8-19(9-7-18)23-12-10-22(3)11-13-23/h4-9,14H,10-13H2,1-3H3,(H,21,24)	IDYDMROROFLLRI-UHFFFAOYSA-N	CN1CCN(CC1)c2ccc(NC(=O)c3ccc(C)c(C)c3)cc2	BroadT	BRD-K65532249	BRD-K65532249-003-05-5	Asinex Ltd.	BAS 06858312		Cl	CN1CCN(CC1)c1ccc(NC(=O)c2ccc(C)c(C)c2)cc1.Cl	InChI=1S/C20H25N3O.ClH/c1-15-4-5-17(14-16(15)2)20(24)21-18-6-8-19(9-7-18)23-12-10-22(3)11-13-23;/h4-9,14H,10-13H2,1-3H3,(H,21,24);1H	ZFVPBYVJKUXROG-UHFFFAOYSA-N	323.19976245							103997, 103997
MLS000583463	LSM-43998	SID17510055, BRD-K53315710	6264314	InChI=1S/C16H10ClNO3/c17-12-6-3-11(4-7-12)5-8-15-18-14(16(19)21-15)10-13-2-1-9-20-13/h1-10H/b8-5+,14-10+	PVZQZNZPIBPPTG-HNTZWPLZSA-N	Clc1ccc(\C=C\C2=N\C(=C\c3occc3)\C(=O)O2)cc1	BroadT	BRD-K53315710	BRD-K53315710-001-05-3	ChemDiv Inc.	K088-1638			Clc1ccc(\C=C\C2=N\C(=C\c3ccco3)C(=O)O2)cc1	InChI=1S/C16H10ClNO3/c17-12-6-3-11(4-7-12)5-8-15-18-14(16(19)21-15)10-13-2-1-9-20-13/h1-10H/b8-5+,14-10+	PVZQZNZPIBPPTG-HNTZWPLZSA-N	299.0349209							
SMR000113263	LSM-23594	SID14727558, BRD-K43684360	4089957	InChI=1S/C22H18O4/c1-13-11-15(23)7-9-18(13)22(19-10-8-16(24)12-14(19)2)20-6-4-3-5-17(20)21(25)26-22/h3-12,23-24H,1-2H3	DAJCDIIIZOFNEG-UHFFFAOYSA-N	Cc1cc(O)ccc1C2(OC(=O)c3ccccc23)c4ccc(O)cc4C	BroadT	BRD-K43684360	BRD-K43684360-001-05-8	Specs	AE-562/12222249			Cc1cc(O)ccc1C1(OC(=O)c2ccccc12)c1ccc(O)cc1C	InChI=1S/C22H18O4/c1-13-11-15(23)7-9-18(13)22(19-10-8-16(24)12-14(19)2)20-6-4-3-5-17(20)21(25)26-22/h3-12,23-24H,1-2H3	DAJCDIIIZOFNEG-UHFFFAOYSA-N	346.120509056							112182
AG-690/37071025	LSM-43999	SID24797659, BRD-K55131074	6167384	InChI=1S/C20H16ClN5O4S2/c1-2-18-24-25-20(31-18)26-32(28,29)15-6-4-14(5-7-15)22-10-12(11-27)19-23-16-9-13(21)3-8-17(16)30-19/h3-11,22H,2H2,1H3,(H,25,26)/b12-10+	SKJVFUIUEWSROH-ZRDIBKRKSA-N	CCc1nnc(NS(=O)(=O)c2ccc(N\C=C(/C=O)\c3oc4ccc(Cl)cc4n3)cc2)s1	BroadT	BRD-K55131074	BRD-K55131074-001-06-0	Specs	AG-690/37071025			CCc1nnc(NS(=O)(=O)c2ccc(N\C=C(/C=O)c3nc4cc(Cl)ccc4o3)cc2)s1	InChI=1S/C20H16ClN5O4S2/c1-2-18-24-25-20(31-18)26-32(28,29)15-6-4-14(5-7-15)22-10-12(11-27)19-23-16-9-13(21)3-8-17(16)30-19/h3-11,22H,2H2,1H3,(H,25,26)/b12-10+	SKJVFUIUEWSROH-ZRDIBKRKSA-N	489.033223132							
MLS000393398	LSM-23596	SID22406719, BRD-K87805974	3595670	InChI=1S/C23H21ClN2O5S/c1-31-20-11-9-18(10-12-20)26-32(29,30)21-4-2-3-19(15-21)25-23(28)14-13-22(27)16-5-7-17(24)8-6-16/h2-12,15,26H,13-14H2,1H3,(H,25,28)	WZCXEFULUCPVRB-UHFFFAOYSA-N	COc1ccc(NS(=O)(=O)c2cccc(NC(=O)CCC(=O)c3ccc(Cl)cc3)c2)cc1	BroadT	BRD-K87805974	BRD-K87805974-001-06-2	Enamine Ltd.	T5225575			COc1ccc(NS(=O)(=O)c2cccc(NC(=O)CCC(=O)c3ccc(Cl)cc3)c2)cc1	InChI=1S/C23H21ClN2O5S/c1-31-20-11-9-18(10-12-20)26-32(29,30)21-4-2-3-19(15-21)25-23(28)14-13-22(27)16-5-7-17(24)8-6-16/h2-12,15,26H,13-14H2,1H3,(H,25,28)	WZCXEFULUCPVRB-UHFFFAOYSA-N	472.085970192							112184
AC1N65YP	LSM-23597	BRD-K12782798	4210314	InChI=1S/C16H15ClN2O3/c1-21-14-4-2-3-12(10-14)16(20)22-19-15(18)9-11-5-7-13(17)8-6-11/h2-8,10H,9H2,1H3,(H2,18,19)	KIXXRBVAOHCCES-UHFFFAOYSA-N	COc1cccc(c1)C(=O)ONC(=N)Cc2ccc(Cl)cc2	BroadT	BRD-K12782798	BRD-K12782798-001-05-9	ChemDiv Inc.	4335-0244			COc1cccc(c1)C(=O)ONC(=N)Cc1ccc(Cl)cc1	InChI=1S/C16H15ClN2O3/c1-21-14-4-2-3-12(10-14)16(20)22-19-15(18)9-11-5-7-13(17)8-6-11/h2-8,10H,9H2,1H3,(H2,18,19)	KIXXRBVAOHCCES-UHFFFAOYSA-N	318.07712007							112185
ASN 05114013	LSM-23598	SID50086625, SID844323, BRD-K47863178	646643	InChI=1S/C26H30N4O5/c31-25-20(15-19-16-23-24(17-22(19)28-25)35-14-13-34-23)18-30(8-4-7-29-9-11-33-12-10-29)26(32)27-21-5-2-1-3-6-21/h1-3,5-6,15-17H,4,7-14,18H2,(H,27,32)(H,28,31)	ONFMABKKKNQESI-UHFFFAOYSA-N	Oc1nc2cc3OCCOc3cc2cc1CN(CCCN4CCOCC4)C(=O)Nc5ccccc5	BroadT	BRD-K47863178	BRD-K47863178-001-05-6	Asinex Ltd.	ASN 05114013			Oc1nc2cc3OCCOc3cc2cc1CN(CCCN1CCOCC1)C(=O)Nc1ccccc1	InChI=1S/C26H30N4O5/c31-25-20(15-19-16-23-24(17-22(19)28-25)35-14-13-34-23)18-30(8-4-7-29-9-11-33-12-10-29)26(32)27-21-5-2-1-3-6-21/h1-3,5-6,15-17H,4,7-14,18H2,(H,27,32)(H,28,31)	ONFMABKKKNQESI-UHFFFAOYSA-N	478.2216201							112186
MLS000101173	LSM-23599	SID7970512, BRD-A92289882	5049897	InChI=1S/C18H25N7O2S2/c1-11-6-5-7-24(10-11)16-19-14-13(15(26)23(4)18(27)22(14)3)25(16)8-9-28-17-21-20-12(2)29-17/h11H,5-10H2,1-4H3	VXJNXUCRGATLNC-UHFFFAOYSA-N	CC1CCCN(C1)c2nc3N(C)C(=O)N(C)C(=O)c3n2CCSc4nnc(C)s4	BroadT	BRD-A92289882	BRD-A92289882-001-05-7	Life Chemicals Inc.	F0570-0327			CC1CCCN(C1)c1nc2n(C)c(=O)n(C)c(=O)c2n1CCSc1nnc(C)s1	InChI=1S/C18H25N7O2S2/c1-11-6-5-7-24(10-11)16-19-14-13(15(26)23(4)18(27)22(14)3)25(16)8-9-28-17-21-20-12(2)29-17/h11H,5-10H2,1-4H3	VXJNXUCRGATLNC-UHFFFAOYSA-N	435.15111449							112187
SMR000076635	LSM-23600	SID4265342, BRD-K08836529	826934	InChI=1S/C17H20N2O/c1-17(2,3)15-11-14(9-10-18-15)16(20)19-12-13-7-5-4-6-8-13/h4-11H,12H2,1-3H3,(H,19,20)	VABBBUJUGHBTCN-UHFFFAOYSA-N	CC(C)(C)c1cc(ccn1)C(=O)NCc2ccccc2	BroadT	BRD-K08836529	BRD-K08836529-001-05-5	ChemBridge Corporation	7795168			CC(C)(C)c1cc(ccn1)C(=O)NCc1ccccc1	InChI=1S/C17H20N2O/c1-17(2,3)15-11-14(9-10-18-15)16(20)19-12-13-7-5-4-6-8-13/h4-11H,12H2,1-3H3,(H,19,20)	VABBBUJUGHBTCN-UHFFFAOYSA-N	268.15756328							112188
ZINC04868140	LSM-23601	SID22406787, BRD-K58985014	4597419	InChI=1S/C18H21N5O3S/c1-11-6-8-22(9-7-11)14-5-4-13(10-15(14)23(25)26)16(24)19-18-21-20-17(27-18)12-2-3-12/h4-5,10-12H,2-3,6-9H2,1H3,(H,19,21,24)	ZZCCRPWAWNJPJW-UHFFFAOYSA-N	CC1CCN(CC1)c2ccc(cc2[N+](=O)[O-])C(=O)Nc3nnc(s3)C4CC4	BroadT	BRD-K58985014	BRD-K58985014-001-05-1	Enamine Ltd.	T0508-1521			CC1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(=O)Nc1nnc(s1)C1CC1	InChI=1S/C18H21N5O3S/c1-11-6-8-22(9-7-11)14-5-4-13(10-15(14)23(25)26)16(24)19-18-21-20-17(27-18)12-2-3-12/h4-5,10-12H,2-3,6-9H2,1H3,(H,19,21,24)	ZZCCRPWAWNJPJW-UHFFFAOYSA-N	387.136510272							112189
SMR000044268	LSM-23602	SID862217, BRD-K39939258	663440	InChI=1S/C25H25N5O2/c1-4-32-15-7-14-29-17(3)26-23-21(25(29)31)22-24(28-20-9-6-5-8-19(20)27-22)30(23)18-12-10-16(2)11-13-18/h5-6,8-13H,4,7,14-15H2,1-3H3	RVSHAXBUAZBZIX-UHFFFAOYSA-N	CCOCCCN1C(=Nc2c(C1=O)c3nc4ccccc4nc3n2c5ccc(C)cc5)C	BroadT	BRD-K39939258	BRD-K39939258-001-05-7	InterBioScreen Ltd.	STOCK4S-35996			CCOCCCn1c(C)nc2n(-c3ccc(C)cc3)c3nc4ccccc4nc3c2c1=O	InChI=1S/C25H25N5O2/c1-4-32-15-7-14-29-17(3)26-23-21(25(29)31)22-24(28-20-9-6-5-8-19(20)27-22)30(23)18-12-10-16(2)11-13-18/h5-6,8-13H,4,7,14-15H2,1-3H3	RVSHAXBUAZBZIX-UHFFFAOYSA-N	427.20082509							112190
SMR000037561	LSM-23603	SID858735, BRD-K43454581	660042	InChI=1S/C21H18N4O4/c1-2-29-21(28)12-7-9-13(10-8-12)25-11-16(26)17(18(25)22)19-23-15-6-4-3-5-14(15)20(27)24-19/h3-10H,2,11,22H2,1H3,(H,23,24,27)	KWBFCIXYDGLRJK-UHFFFAOYSA-N	CCOC(=O)c1ccc(cc1)N2CC(=O)C(=C2N)c3nc(O)c4ccccc4n3	BroadT	BRD-K43454581	BRD-K43454581-001-05-9	InterBioScreen Ltd.	STOCK2S-63376			CCOC(=O)c1ccc(cc1)N1CC(=O)C(=C1N)c1nc(O)c2ccccc2n1	InChI=1S/C21H18N4O4/c1-2-29-21(28)12-7-9-13(10-8-12)25-11-16(26)17(18(25)22)19-23-15-6-4-3-5-14(15)20(27)24-19/h3-10H,2,11,22H2,1H3,(H,23,24,27)	KWBFCIXYDGLRJK-UHFFFAOYSA-N	390.132805096							112191
SMR000096478	LSM-23604	SID24838888, SID7965057, BRD-A25056678	5307392	InChI=1S/C22H30N4O4S/c1-3-29-17-7-8-18-19(14-17)31-21(23-18)26-9-5-6-16(15-26)20(27)24-10-12-25(13-11-24)22(28)30-4-2/h7-8,14,16H,3-6,9-13,15H2,1-2H3	YWECOAAGZKQGCT-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)C2CCCN(C2)c3nc4ccc(OCC)cc4s3	BroadT	BRD-A25056678	BRD-A25056678-001-04-3	ChemDiv Inc.	C782-0494			CCOC(=O)N1CCN(CC1)C(=O)C1CCCN(C1)c1nc2ccc(OCC)cc2s1	InChI=1S/C22H30N4O4S/c1-3-29-17-7-8-18-19(14-17)31-21(23-18)26-9-5-6-16(15-26)20(27)24-10-12-25(13-11-24)22(28)30-4-2/h7-8,14,16H,3-6,9-13,15H2,1-2H3	YWECOAAGZKQGCT-UHFFFAOYSA-N	446.19877617							112192
SMR000025916	LSM-23605	SID4241109, BRD-K67122145	3236129	InChI=1S/C24H21N3O5S/c1-15-14-20(25-22-18-6-2-3-7-19(18)32-24(29)21(15)22)26-23(28)16-8-10-17(11-9-16)33(30,31)27-12-4-5-13-27/h2-3,6-11,14H,4-5,12-13H2,1H3,(H,25,26,28)	JWGJCINPUPMGIM-UHFFFAOYSA-N	Cc1cc(NC(=O)c2ccc(cc2)S(=O)(=O)N3CCCC3)nc4c5ccccc5OC(=O)c14	BroadT	BRD-K67122145	BRD-K67122145-001-04-5	ChemDiv Inc.	C319-0098			Cc1cc(NC(=O)c2ccc(cc2)S(=O)(=O)N2CCCC2)nc2c3ccccc3oc(=O)c12	InChI=1S/C24H21N3O5S/c1-15-14-20(25-22-18-6-2-3-7-19(18)32-24(29)21(15)22)26-23(28)16-8-10-17(11-9-16)33(30,31)27-12-4-5-13-27/h2-3,6-11,14H,4-5,12-13H2,1H3,(H,25,26,28)	JWGJCINPUPMGIM-UHFFFAOYSA-N	463.120191492							112193
STK228555	LSM-23606	SID24814425, BRD-K94469430	7338267	InChI=1S/C19H16N4O/c1-13-4-2-5-15(12-13)21-18-17(14-6-8-16(24)9-7-14)22-19-20-10-3-11-23(18)19/h2-12,21,24H,1H3	TZUHTYIMCNBSJD-UHFFFAOYSA-N	Cc1cccc(Nc2c(nc3ncccn23)c4ccc(O)cc4)c1	BroadT	BRD-K94469430	BRD-K94469430-001-05-8	ChemDiv Inc.	C325-0305			Cc1cccc(Nc2c(nc3ncccn23)-c2ccc(O)cc2)c1	InChI=1S/C19H16N4O/c1-13-4-2-5-15(12-13)21-18-17(14-6-8-16(24)9-7-14)22-19-20-10-3-11-23(18)19/h2-12,21,24H,1H3	TZUHTYIMCNBSJD-UHFFFAOYSA-N	316.132411172							112194
T0505-8475	LSM-23607	SID22410521, BRD-K74016717	2336361	InChI=1S/C25H23N5O5S2/c1-17-8-9-18(2)23(16-17)37(34,35)29-22-7-4-3-6-21(22)24(31)28-19-10-12-20(13-11-19)36(32,33)30-25-26-14-5-15-27-25/h3-16,29H,1-2H3,(H,28,31)(H,26,27,30)	QGTXBBCMOHMTQW-UHFFFAOYSA-N	Cc1ccc(C)c(c1)S(=O)(=O)Nc2ccccc2C(=O)Nc3ccc(cc3)S(=O)(=O)Nc4ncccn4	BroadT	BRD-K74016717	BRD-K74016717-001-05-5	Enamine Ltd.	T0505-8475			Cc1ccc(C)c(c1)S(=O)(=O)Nc1ccccc1C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1	InChI=1S/C25H23N5O5S2/c1-17-8-9-18(2)23(16-17)37(34,35)29-22-7-4-3-6-21(22)24(31)28-19-10-12-20(13-11-19)36(32,33)30-25-26-14-5-15-27-25/h3-16,29H,1-2H3,(H,28,31)(H,26,27,30)	QGTXBBCMOHMTQW-UHFFFAOYSA-N	537.114060266							112195
ASN 05581825	LSM-23608	SID24788771, BRD-A30356435	3211116	InChI=1S/C23H30N4O3S/c1-2-3-14-27(20(28)16-25-22(29)19-9-6-15-31-19)21(17-10-12-24-13-11-17)23(30)26-18-7-4-5-8-18/h6,9-13,15,18,21H,2-5,7-8,14,16H2,1H3,(H,25,29)(H,26,30)	CCCDBLMUQKDERP-UHFFFAOYSA-N	CCCCN(C(C(=O)NC1CCCC1)c2ccncc2)C(=O)CNC(=O)c3cccs3	BroadT	BRD-A30356435	BRD-A30356435-001-05-1	Asinex Ltd.	ASN 05581825			CCCCN(C(C(=O)NC1CCCC1)c1ccncc1)C(=O)CNC(=O)c1cccs1	InChI=1S/C23H30N4O3S/c1-2-3-14-27(20(28)16-25-22(29)19-9-6-15-31-19)21(17-10-12-24-13-11-17)23(30)26-18-7-4-5-8-18/h6,9-13,15,18,21H,2-5,7-8,14,16H2,1H3,(H,25,29)(H,26,30)	CCCDBLMUQKDERP-UHFFFAOYSA-N	442.20386155							112196
F1245-0304	LSM-23609	SID7964596, SID26724629, BRD-A27546103	5307114	InChI=1S/C25H28FN5O5/c1-14-21(24(33)28-17-9-7-16(26)8-10-17)22(31-25(27-14)29-20(30-31)6-5-11-32)15-12-18(34-2)23(36-4)19(13-15)35-3/h7-10,12-13,22,32H,5-6,11H2,1-4H3,(H,28,33)(H,27,29,30)	XEHOXCRHZVFGAN-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C2C(=C(C)Nc3nc(CCCO)nn23)C(=O)Nc4ccc(F)cc4	BroadT	BRD-A27546103	BRD-A27546103-001-04-6	ChemDiv Inc.	5223-8262			COc1cc(cc(OC)c1OC)C1C(C(=O)Nc2ccc(F)cc2)=C(C)Nc2nc(CCCO)nn12	InChI=1S/C25H28FN5O5/c1-14-21(24(33)28-17-9-7-16(26)8-10-17)22(31-25(27-14)29-20(30-31)6-5-11-32)15-12-18(34-2)23(36-4)19(13-15)35-3/h7-10,12-13,22,32H,5-6,11H2,1-4H3,(H,28,33)(H,27,29,30)	XEHOXCRHZVFGAN-UHFFFAOYSA-N	497.207447246							112197
AC1LZJBT	LSM-23610	SID24807311, BRD-K14856054	1950636	InChI=1S/C15H21N3OS/c1-3-4-5-10-19-14-8-6-13(7-9-14)11-20-15-16-12(2)17-18-15/h6-9H,3-5,10-11H2,1-2H3,(H,16,17,18)	OBWLWVWUWCTMNJ-UHFFFAOYSA-N	CCCCCOc1ccc(CSc2n[nH]c(C)n2)cc1	BroadT	BRD-K14856054	BRD-K14856054-001-06-6	Asinex Ltd.	BAS 00609145			CCCCCOc1ccc(CSc2n[nH]c(C)n2)cc1	InChI=1S/C15H21N3OS/c1-3-4-5-10-19-14-8-6-13(7-9-14)11-20-15-16-12(2)17-18-15/h6-9H,3-5,10-11H2,1-2H3,(H,16,17,18)	OBWLWVWUWCTMNJ-UHFFFAOYSA-N	291.140533012							112198
MLS000099123	LSM-23611	SID4260264, BRD-K80516501	713311	InChI=1S/C17H15NO5/c1-21-17(20)12-4-2-3-5-13(12)18-16(19)11-6-7-14-15(10-11)23-9-8-22-14/h2-7,10H,8-9H2,1H3,(H,18,19)	AWFOICWLUXROFE-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)c2ccc3OCCOc3c2	BroadT	BRD-K80516501	BRD-K80516501-001-05-6	ChemBridge Corporation	6018730			COC(=O)c1ccccc1NC(=O)c1ccc2OCCOc2c1	InChI=1S/C17H15NO5/c1-21-17(20)12-4-2-3-5-13(12)18-16(19)11-6-7-14-15(10-11)23-9-8-22-14/h2-7,10H,8-9H2,1H3,(H,18,19)	AWFOICWLUXROFE-UHFFFAOYSA-N	313.09502259							112199
MLS000096471	LSM-23612	SID3713344, BRD-K46341768	2998377	InChI=1S/C15H14N2OS/c1-9-4-5-10(2)12(8-9)14(18)13-11(3)16-15-17(13)6-7-19-15/h4-8H,1-3H3	PNAXPGYGWMLYGP-UHFFFAOYSA-N	Cc1ccc(C)c(c1)C(=O)c2c(C)nc3sccn23	BroadT	BRD-K46341768	BRD-K46341768-001-05-0	Enamine Ltd.	T0513-2867			Cc1nc2sccn2c1C(=O)c1cc(C)ccc1C	InChI=1S/C15H14N2OS/c1-9-4-5-10(2)12(8-9)14(18)13-11(3)16-15-17(13)6-7-19-15/h4-8H,1-3H3	PNAXPGYGWMLYGP-UHFFFAOYSA-N	270.082683778							112200
5-(3,5-Dimethoxyphenyl)-3-(2-methoxyphenyl)-1,2,4-oxadiazole	LSM-23613	SID865131, BRD-K88734556	666381	InChI=1S/C17H16N2O4/c1-20-12-8-11(9-13(10-12)21-2)17-18-16(19-23-17)14-6-4-5-7-15(14)22-3/h4-10H,1-3H3	XEQABDMFHRFHNU-UHFFFAOYSA-N	COc1cc(OC)cc(c1)c2onc(n2)c3ccccc3OC	BroadT	BRD-K88734556	BRD-K88734556-001-05-1	InterBioScreen Ltd.	STOCK5S-37211			COc1cc(OC)cc(c1)-c1nc(no1)-c1ccccc1OC	InChI=1S/C17H16N2O4/c1-20-12-8-11(9-13(10-12)21-2)17-18-16(19-23-17)14-6-4-5-7-15(14)22-3/h4-10H,1-3H3	XEQABDMFHRFHNU-UHFFFAOYSA-N	312.111007012							112201
N-[5-(3-Methoxyphenyl)-1,3,4-thiadiazol-2-yl]thiophene-2-carboxamide	LSM-23614	SID24785732, BRD-K39927438	2201266	InChI=1S/C14H11N3O2S2/c1-19-10-5-2-4-9(8-10)13-16-17-14(21-13)15-12(18)11-6-3-7-20-11/h2-8H,1H3,(H,15,17,18)	OWXZRUFVULZXMD-UHFFFAOYSA-N	COc1cccc(c1)c2nnc(NC(=O)c3cccs3)s2	BroadT	BRD-K39927438	BRD-K39927438-001-06-3	ChemBridge Corporation	7748216			COc1cccc(c1)-c1nnc(NC(=O)c2cccs2)s1	InChI=1S/C14H11N3O2S2/c1-19-10-5-2-4-9(8-10)13-16-17-14(21-13)15-12(18)11-6-3-7-20-11/h2-8H,1H3,(H,15,17,18)	OWXZRUFVULZXMD-UHFFFAOYSA-N	317.029268002							112202
SMR000206556	LSM-23615	SID17509916, BRD-K36551994	12005045	InChI=1S/C17H21N3O3S2/c1-4-19(5-2)13-6-7-14(12(3)10-13)18-16(21)11-25-15-8-9-24-17(15)20(22)23/h6-10H,4-5,11H2,1-3H3,(H,18,21)	IZPWPOGCARDTMP-UHFFFAOYSA-N	CCN(CC)c1ccc(NC(=O)CSc2ccsc2[N+](=O)[O-])c(C)c1	BroadT	BRD-K36551994	BRD-K36551994-001-05-2	ChemDiv Inc.	C797-0035			CCN(CC)c1ccc(NC(=O)CSc2ccsc2[N+]([O-])=O)c(C)c1	InChI=1S/C17H21N3O3S2/c1-4-19(5-2)13-6-7-14(12(3)10-13)18-16(21)11-25-15-8-9-24-17(15)20(22)23/h6-10H,4-5,11H2,1-3H3,(H,18,21)	IZPWPOGCARDTMP-UHFFFAOYSA-N	379.102432942							112203
AC1NVVSQ	LSM-44000	SID22400569, BRD-K88272724	5604515	InChI=1S/C20H18N4O5/c1-29-15-9-7-13(8-10-15)12-24-19(27)16(18(26)22-20(24)28)11-21-23-17(25)14-5-3-2-4-6-14/h2-11,21H,12H2,1H3,(H,23,25)(H,22,26,28)/b16-11+	SOEBPBOJTDXZLN-LFIBNONCSA-N	COc1ccc(CN2C(=O)NC(=O)\C(=C/NNC(=O)c3ccccc3)\C2=O)cc1	BroadT	BRD-K88272724	BRD-K88272724-001-06-7	InterBioScreen Ltd.	STOCK2S-55767			COc1ccc(CN2C(=O)NC(=O)\C(=C/NNC(=O)c3ccccc3)C2=O)cc1	InChI=1S/C20H18N4O5/c1-29-15-9-7-13(8-10-15)12-24-19(27)16(18(26)22-20(24)28)11-21-23-17(25)14-5-3-2-4-6-14/h2-11,21H,12H2,1H3,(H,23,25)(H,22,26,28)/b16-11+	SOEBPBOJTDXZLN-LFIBNONCSA-N	394.127719716							
ST50599474	LSM-23617	SID22415427, BRD-K91660991	2171210	InChI=1S/C18H22N2S2/c1-13-4-7-16(8-5-13)22-11-10-19-18(21)20-17-9-6-14(2)12-15(17)3/h4-9,12H,10-11H2,1-3H3,(H2,19,20,21)	MOJMVAYTMNIPLN-UHFFFAOYSA-N	Cc1ccc(SCCN=C(S)Nc2ccc(C)cc2C)cc1	BroadT	BRD-K91660991	BRD-K91660991-001-06-4	ChemBridge Corporation	6931480			Cc1ccc(SCCN=C(S)Nc2ccc(C)cc2C)cc1	InChI=1S/C18H22N2S2/c1-13-4-7-16(8-5-13)22-11-10-19-18(21)20-17-9-6-14(2)12-15(17)3/h4-9,12H,10-11H2,1-3H3,(H2,19,20,21)	MOJMVAYTMNIPLN-UHFFFAOYSA-N	330.122440104							112205
AC1MTVZD	LSM-23618	SID17509377, BRD-K22541765	3656403	InChI=1S/C22H16N4O4S/c27-20(16-8-2-1-3-9-16)24-25-21(28)18-11-4-5-12-19(18)23-22(25)31-14-15-7-6-10-17(13-15)26(29)30/h1-13H,14H2,(H,24,27)	JXLUURJTLOFYNX-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(CSC2=Nc3ccccc3C(=O)N2NC(=O)c4ccccc4)c1	BroadT	BRD-K22541765	BRD-K22541765-001-05-6	ChemDiv Inc.	K284-2444			[O-][N+](=O)c1cccc(CSc2nc3ccccc3c(=O)n2NC(=O)c2ccccc2)c1	InChI=1S/C22H16N4O4S/c27-20(16-8-2-1-3-9-16)24-25-21(28)18-11-4-5-12-19(18)23-22(25)31-14-15-7-6-10-17(13-15)26(29)30/h1-13H,14H2,(H,24,27)	JXLUURJTLOFYNX-UHFFFAOYSA-N	432.089225722							112206
(2Z)-(Hydroxyimino)(4-Methyl-1,3-thiazol-2-yl)acetonitrile	LSM-23619	BRD-K09287266	6747843	InChI=1S/C6H5N3OS/c1-4-3-11-6(8-4)5(2-7)9-10/h3,10H,1H3	CHOVGJJHNHSEPT-UHFFFAOYSA-N	Cc1csc(n1)C(=NO)C#N	BroadT	BRD-K09287266	BRD-K09287266-001-05-7	Enamine Ltd.	T0501-5984			Cc1csc(n1)C(=NO)C#N	InChI=1S/C6H5N3OS/c1-4-3-11-6(8-4)5(2-7)9-10/h3,10H,1H3	CHOVGJJHNHSEPT-UHFFFAOYSA-N	167.0153325							
ZINC03284187	LSM-23620	SID24834906, BRD-K63088676	2399726	InChI=1S/C17H13NO3S/c19-15-8-6-13(7-9-15)17(20)21-10-14-11-22-16(18-14)12-4-2-1-3-5-12/h1-9,11,19H,10H2	FIPLQUYFEHPFMF-UHFFFAOYSA-N	Oc1ccc(cc1)C(=O)OCc2csc(n2)c3ccccc3	BroadT	BRD-K63088676	BRD-K63088676-001-05-6	Enamine Ltd.	T0514-8474			Oc1ccc(cc1)C(=O)OCc1csc(n1)-c1ccccc1	InChI=1S/C17H13NO3S/c19-15-8-6-13(7-9-15)17(20)21-10-14-11-22-16(18-14)12-4-2-1-3-5-12/h1-9,11,19H,10H2	FIPLQUYFEHPFMF-UHFFFAOYSA-N	311.061613976							112208
SMR000046793	LSM-23621	SID864451, BRD-K85900774	665698	InChI=1S/C24H24N4O4S/c1-24(2)11-17-18(14-32-24)33-22-20(17)21(25)27(12-16-9-6-10-31-16)23(30)28(22)13-19(29)26-15-7-4-3-5-8-15/h3-10,25H,11-14H2,1-2H3,(H,26,29)	GHVVXYUMOHKPEU-UHFFFAOYSA-N	CC1(C)Cc2c(CO1)sc3N(CC(=O)Nc4ccccc4)C(=O)N(Cc5occc5)C(=N)c23	BroadT	BRD-K85900774	BRD-K85900774-001-05-7	InterBioScreen Ltd.	STOCK5S-14293			CC1(C)Cc2c(CO1)sc1n(CC(=O)Nc3ccccc3)c(=O)n(Cc3ccco3)c(=N)c21	InChI=1S/C24H24N4O4S/c1-24(2)11-17-18(14-32-24)33-22-20(17)21(25)27(12-16-9-6-10-31-16)23(30)28(22)13-19(29)26-15-7-4-3-5-8-15/h3-10,25H,11-14H2,1-2H3,(H,26,29)	GHVVXYUMOHKPEU-UHFFFAOYSA-N	464.151825978							112209
AC1N4RLE	LSM-23622	BRD-K45835784	4133447	InChI=1S/C16H14ClN3O4/c1-2-24-14-6-3-11(4-7-14)16(21)19-18-10-12-9-13(17)5-8-15(12)20(22)23/h3-10H,2H2,1H3,(H,19,21)	FSEOZQMTYQTNMA-UHFFFAOYSA-N	CCOc1ccc(cc1)C(=O)NN=Cc2cc(Cl)ccc2[N+](=O)[O-]	BroadT	BRD-K45835784	BRD-K45835784-001-05-2	Specs	AK-968/40641236			CCOc1ccc(cc1)C(=O)NN=Cc1cc(Cl)ccc1[N+]([O-])=O	InChI=1S/C16H14ClN3O4/c1-2-24-14-6-3-11(4-7-14)16(21)19-18-10-12-9-13(17)5-8-15(12)20(22)23/h3-10H,2H2,1H3,(H,19,21)	FSEOZQMTYQTNMA-UHFFFAOYSA-N	347.067283668							112210
STK223420	LSM-23623	SID24789665, BRD-K93254057	804339	InChI=1S/C17H15NO6/c1-10(19)24-14-8-5-12(9-15(14)23-2)16(20)18-13-6-3-11(4-7-13)17(21)22/h3-9H,1-2H3,(H,18,20)(H,21,22)	JQGFAXIHUAJDDX-UHFFFAOYSA-N	COc1cc(ccc1OC(=O)C)C(=O)Nc2ccc(cc2)C(=O)O	BroadT	BRD-K93254057	BRD-K93254057-001-05-7	Asinex Ltd.	BAS 02225040			COc1cc(ccc1OC(C)=O)C(=O)Nc1ccc(cc1)C(O)=O	InChI=1S/C17H15NO6/c1-10(19)24-14-8-5-12(9-15(14)23-2)16(20)18-13-6-3-11(4-7-13)17(21)22/h3-9H,1-2H3,(H,18,20)(H,21,22)	JQGFAXIHUAJDDX-UHFFFAOYSA-N	329.08993721							112211
SMR000036612	LSM-23624	SID865243, BRD-K71688948	666497	InChI=1S/C17H15NO7/c1-9(19)25-14-6-3-10(7-15(14)24-2)16(21)18-13-5-4-11(20)8-12(13)17(22)23/h3-8,20H,1-2H3,(H,18,21)(H,22,23)	CPZAYBBKCUHCEH-UHFFFAOYSA-N	COc1cc(ccc1OC(=O)C)C(=O)Nc2ccc(O)cc2C(=O)O	BroadT	BRD-K71688948	BRD-K71688948-001-05-5	InterBioScreen Ltd.	STOCK5S-40134			COc1cc(ccc1OC(C)=O)C(=O)Nc1ccc(O)cc1C(O)=O	InChI=1S/C17H15NO7/c1-9(19)25-14-6-3-10(7-15(14)24-2)16(21)18-13-5-4-11(20)8-12(13)17(22)23/h3-8,20H,1-2H3,(H,18,21)(H,22,23)	CPZAYBBKCUHCEH-UHFFFAOYSA-N	345.08485183							112212
AC1M63TS	LSM-23625	BRD-K29955010	2341283	InChI=1S/C13H17N3S/c1-4-7-14-13(17)16-15-9-12-6-5-10(2)8-11(12)3/h4-6,8-9H,1,7H2,2-3H3,(H2,14,16,17)	ASEBMZBBCNIBHY-UHFFFAOYSA-N	Cc1ccc(C=NN=C(S)NCC=C)c(C)c1	BroadT	BRD-K29955010	BRD-K29955010-001-05-4	Enamine Ltd.	T0511-2848			Cc1ccc(C=NN=C(S)NCC=C)c(C)c1	InChI=1S/C13H17N3S/c1-4-7-14-13(17)16-15-9-12-6-5-10(2)8-11(12)3/h4-6,8-9H,1,7H2,2-3H3,(H2,14,16,17)	ASEBMZBBCNIBHY-UHFFFAOYSA-N	247.114318264							112213
SMR000000950	LSM-23626	SID26726089, SID847664, BRD-K39796608	650074	InChI=1S/C24H21ClN8O2/c25-18-5-1-4-16(11-18)14-33-22-20(30-31-33)23(34)29-21(28-22)17-7-9-32(10-8-17)24(35)27-19-6-2-3-15(12-19)13-26/h1-6,11-12,17H,7-10,14H2,(H,27,35)(H,28,29,34)	CWLCGYHWRMXEEF-UHFFFAOYSA-N	Oc1nc(nc2c1nnn2Cc3cccc(Cl)c3)C4CCN(CC4)C(=O)Nc5cccc(c5)C#N	BroadT	BRD-K39796608	BRD-K39796608-001-05-8	Asinex Ltd.	ASN 10813858			Oc1nc(nc2n(Cc3cccc(Cl)c3)nnc12)C1CCN(CC1)C(=O)Nc1cccc(c1)C#N	InChI=1S/C24H21ClN8O2/c25-18-5-1-4-16(11-18)14-33-22-20(30-31-33)23(34)29-21(28-22)17-7-9-32(10-8-17)24(35)27-19-6-2-3-15(12-19)13-26/h1-6,11-12,17H,7-10,14H2,(H,27,35)(H,28,29,34)	CWLCGYHWRMXEEF-UHFFFAOYSA-N	488.147599702							
AC1O9W1Z	LSM-23627	SID24789748, BRD-K93702178	6738437	InChI=1S/C16H13N3O3/c1-19-12-8-4-2-6-10(12)14(16(19)22)17-18-15(21)11-7-3-5-9-13(11)20/h2-9,20,22H,1H3	OSXHKFVQWBRTLX-UHFFFAOYSA-N	Cn1c(O)c(N=NC(=O)c2ccccc2O)c3ccccc13	BroadT	BRD-K93702178	BRD-K93702178-001-05-9	Asinex Ltd.	BAS 00474020			Cn1c(O)c(N=NC(=O)c2ccccc2O)c2ccccc12	InChI=1S/C16H13N3O3/c1-19-12-8-4-2-6-10(12)14(16(19)22)17-18-15(21)11-7-3-5-9-13(11)20/h2-9,20,22H,1H3	OSXHKFVQWBRTLX-UHFFFAOYSA-N	295.095691306							
MLS000664771	LSM-23628	SID24795134, BRD-K96447304	2974583	InChI=1S/C15H26N2OS/c18-14(16-12-8-4-1-2-5-9-12)15(19)17-13-10-6-3-7-11-13/h12-13H,1-11H2,(H,16,18)(H,17,19)	FCRHAILQRHDOBX-UHFFFAOYSA-N	O=C(NC1CCCCCC1)C(=S)NC2CCCCC2	BroadT	BRD-K96447304	BRD-K96447304-001-05-5	ChemBridge Corporation	7960047			O=C(NC1CCCCCC1)C(=S)NC1CCCCC1	InChI=1S/C15H26N2OS/c18-14(16-12-8-4-1-2-5-9-12)15(19)17-13-10-6-3-7-11-13/h12-13H,1-11H2,(H,16,18)(H,17,19)	FCRHAILQRHDOBX-UHFFFAOYSA-N	282.176584162							112216
MLS000065818	LSM-23629	SID4256641, BRD-K11233651	1246159	InChI=1S/C14H12N4O3S/c1-8-7-11(18-21-8)12(19)15-14-17-16-13(22-14)9-3-5-10(20-2)6-4-9/h3-7H,1-2H3,(H,15,17,19)	HBAKYYPAFFDXGL-UHFFFAOYSA-N	COc1ccc(cc1)c2nnc(NC(=O)c3cc(C)on3)s2	BroadT	BRD-K11233651	BRD-K11233651-001-05-0	ChemBridge Corporation	7946465			COc1ccc(cc1)-c1nnc(NC(=O)c2cc(C)on2)s1	InChI=1S/C14H12N4O3S/c1-8-7-11(18-21-8)12(19)15-14-17-16-13(22-14)9-3-5-10(20-2)6-4-9/h3-7H,1-2H3,(H,15,17,19)	HBAKYYPAFFDXGL-UHFFFAOYSA-N	316.063010974							112217
AQ-750/42209067	LSM-23630	SID17386354, BRD-K62878219	984191	InChI=1S/C25H25N3O3S2/c1-25(2,3)18-10-14-20(15-11-18)33(30,31)26-16-23(29)27-19-12-8-17(9-13-19)24-28-21-6-4-5-7-22(21)32-24/h4-15,26H,16H2,1-3H3,(H,27,29)	HHDBLIDNWXQHFD-UHFFFAOYSA-N	CC(C)(C)c1ccc(cc1)S(=O)(=O)NCC(=O)Nc2ccc(cc2)c3nc4ccccc4s3	BroadT	BRD-K62878219	BRD-K62878219-001-05-5	Specs	AQ-750/42209067			CC(C)(C)c1ccc(cc1)S(=O)(=O)NCC(=O)Nc1ccc(cc1)-c1nc2ccccc2s1	InChI=1S/C25H25N3O3S2/c1-25(2,3)18-10-14-20(15-11-18)33(30,31)26-16-23(29)27-19-12-8-17(9-13-19)24-28-21-6-4-5-7-22(21)32-24/h4-15,26H,16H2,1-3H3,(H,27,29)	HHDBLIDNWXQHFD-UHFFFAOYSA-N	479.13373307							112218
MLS000578301	LSM-23631	SID17433812, BRD-K35038394	1328171	InChI=1S/C23H19N3O2S/c1-26(2)23(28)16-11-13-18(14-12-16)25-22(27)19-8-4-6-10-21(19)29-20-9-5-3-7-17(20)15-24/h3-14H,1-2H3,(H,25,27)	IPRLTBMDYPESOB-UHFFFAOYSA-N	CN(C)C(=O)c1ccc(NC(=O)c2ccccc2Sc3ccccc3C#N)cc1	BroadT	BRD-K35038394	BRD-K35038394-001-05-7	ChemBridge Corporation	7002471			CN(C)C(=O)c1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1	InChI=1S/C23H19N3O2S/c1-26(2)23(28)16-11-13-18(14-12-16)25-22(27)19-8-4-6-10-21(19)29-20-9-5-3-7-17(20)15-24/h3-14H,1-2H3,(H,25,27)	IPRLTBMDYPESOB-UHFFFAOYSA-N	401.119797568							112219
STK576022	LSM-44001	SID861021, BRD-K80727510	5389489	InChI=1S/C20H25N3O5/c1-12(21-15-10-9-14(27-2)11-16(15)28-3)17-18(24)22-20(26)23(19(17)25)13-7-5-4-6-8-13/h9-11,13,21H,4-8H2,1-3H3,(H,22,24,26)/b17-12-	XQCPVTZZYRSLIM-ATVHPVEESA-N	COc1ccc(N\C(=C/2\C(=O)NC(=O)N(C3CCCCC3)C2=O)\C)c(OC)c1	BroadT	BRD-K80727510	BRD-K80727510-001-05-8	InterBioScreen Ltd.	STOCK3S-96328			COc1ccc(N\C(C)=C2\C(=O)NC(=O)N(C3CCCCC3)C2=O)c(OC)c1	InChI=1S/C20H25N3O5/c1-12(21-15-10-9-14(27-2)11-16(15)28-3)17-18(24)22-20(26)23(19(17)25)13-7-5-4-6-8-13/h9-11,13,21H,4-8H2,1-3H3,(H,22,24,26)/b17-12-	XQCPVTZZYRSLIM-ATVHPVEESA-N	387.17942093							
AC1N3DRT	LSM-23633	SID24816910, BRD-K75728245	4085830	InChI=1S/C19H21N3S/c1-14-10-17-11-16(8-9-18(17)22(14)2)13-21-19(23)20-12-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3,(H2,20,21,23)	LEQLIZOPUUBOQK-UHFFFAOYSA-N	Cc1cc2cc(CN=C(S)NCc3ccccc3)ccc2n1C	BroadT	BRD-K75728245	BRD-K75728245-001-05-5	Life Chemicals Inc.	F0651-0460			Cc1cc2cc(CN=C(S)NCc3ccccc3)ccc2n1C	InChI=1S/C19H21N3S/c1-14-10-17-11-16(8-9-18(17)22(14)2)13-21-19(23)20-12-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3,(H2,20,21,23)	LEQLIZOPUUBOQK-UHFFFAOYSA-N	323.145618392							112221
MFCD00115244	LSM-44002	SID17433011, BRD-K91188267	5346492	InChI=1S/C18H17NO6/c1-23-16-9-12(10-17(24-2)18(16)25-3)7-8-15(20)13-5-4-6-14(11-13)19(21)22/h4-11H,1-3H3/b8-7+	OYCXONLNNCKOQR-BQYQJAHWSA-N	COc1cc(\C=C\C(=O)c2cccc(c2)[N+](=O)[O-])cc(OC)c1OC	BroadT	BRD-K91188267	BRD-K91188267-001-05-5	ChemBridge Corporation	6029057			COc1cc(\C=C\C(=O)c2cccc(c2)[N+]([O-])=O)cc(OC)c1OC	InChI=1S/C18H17NO6/c1-23-16-9-12(10-17(24-2)18(16)25-3)7-8-15(20)13-5-4-6-14(11-13)19(21)22/h4-11H,1-3H3/b8-7+	OYCXONLNNCKOQR-BQYQJAHWSA-N	343.105587274							
AC1NQSVK	LSM-23635	BRD-K22844799	5228168	InChI=1S/C16H19N3O4S/c1-20-13-7-11(8-14(21-2)15(13)22-3)9-18-19-16(24)17-10-12-5-4-6-23-12/h4-9H,10H2,1-3H3,(H2,17,19,24)	BBGXSCIKASXCPD-UHFFFAOYSA-N	COc1cc(C=NN=C(S)NCc2occc2)cc(OC)c1OC	BroadT	BRD-K22844799	BRD-K22844799-001-06-2	Life Chemicals Inc.	F1098-0099			COc1cc(C=NN=C(S)NCc2ccco2)cc(OC)c1OC	InChI=1S/C16H19N3O4S/c1-20-13-7-11(8-14(21-2)15(13)22-3)9-18-19-16(24)17-10-12-5-4-6-23-12/h4-9H,10H2,1-3H3,(H2,17,19,24)	BBGXSCIKASXCPD-UHFFFAOYSA-N	349.109626808							112223
SMR000062195	LSM-23636	SID3711437, BRD-K87005324	2997638	InChI=1S/C14H14N2OS/c1-11-4-2-6-14-15-12(8-16(11)14)9-18-10-13-5-3-7-17-13/h2-8H,9-10H2,1H3	CYWMXGBFAQKKHN-UHFFFAOYSA-N	Cc1cccc2nc(CSCc3occc3)cn12	BroadT	BRD-K87005324	BRD-K87005324-001-05-8	Enamine Ltd.	T0513-3061			Cc1cccc2nc(CSCc3ccco3)cn12	InChI=1S/C14H14N2OS/c1-11-4-2-6-14-15-12(8-16(11)14)9-18-10-13-5-3-7-17-13/h2-8H,9-10H2,1H3	CYWMXGBFAQKKHN-UHFFFAOYSA-N	258.082683778							112224
4-Bromo-n'-(3,4-dihydro-2H-pyrrol-5-yl)benzohydrazide	LSM-23637	SID16952586, BRD-K92944586	1212491	InChI=1S/C11H12BrN3O/c12-9-5-3-8(4-6-9)11(16)15-14-10-2-1-7-13-10/h3-6H,1-2,7H2,(H,13,14)(H,15,16)	QKAHAXIACNFPOK-UHFFFAOYSA-N	Brc1ccc(cc1)C(=O)NNC2=NCCC2	BroadT	BRD-K92944586	BRD-K92944586-001-05-4	Enamine Ltd.	T0501-8988			Brc1ccc(cc1)C(=O)NNC1=NCCC1	InChI=1S/C11H12BrN3O/c12-9-5-3-8(4-6-9)11(16)15-14-10-2-1-7-13-10/h3-6H,1-2,7H2,(H,13,14)(H,15,16)	QKAHAXIACNFPOK-UHFFFAOYSA-N	281.016374634							112225
F0679-0582	LSM-23638	SID24788787, BRD-K92378369	7118692	InChI=1S/C16H23N5O2/c1-16(2,3)21-14-12(9-18-21)15(23)20(11-17-14)10-13(22)19-7-5-4-6-8-19/h9,11H,4-8,10H2,1-3H3	CTVCVOSDXGRRAC-UHFFFAOYSA-N	CC(C)(C)n1ncc2C(=O)N(CC(=O)N3CCCCC3)C=Nc12	BroadT	BRD-K92378369	BRD-K92378369-001-05-8	Life Chemicals Inc.	F0679-0582			CC(C)(C)n1ncc2c1ncn(CC(=O)N1CCCCC1)c2=O	InChI=1S/C16H23N5O2/c1-16(2,3)21-14-12(9-18-21)15(23)20(11-17-14)10-13(22)19-7-5-4-6-8-19/h9,11H,4-8,10H2,1-3H3	CTVCVOSDXGRRAC-UHFFFAOYSA-N	317.185175026							112226
MLS000584489	LSM-23639	SID17510623, BRD-K53088149	4219375	InChI=1S/C15H20ClNOS/c16-13-5-3-4-12(10-13)11-19-9-8-15(18)17-14-6-1-2-7-14/h3-5,10,14H,1-2,6-9,11H2,(H,17,18)	YMRPNZRCECZSGT-UHFFFAOYSA-N	Clc1cccc(CSCCC(=O)NC2CCCC2)c1	BroadT	BRD-K53088149	BRD-K53088149-001-05-7	ChemDiv Inc.	K786-6822			Clc1cccc(CSCCC(=O)NC2CCCC2)c1	InChI=1S/C15H20ClNOS/c16-13-5-3-4-12(10-13)11-19-9-8-15(18)17-14-6-1-2-7-14/h3-5,10,14H,1-2,6-9,11H2,(H,17,18)	YMRPNZRCECZSGT-UHFFFAOYSA-N	297.09541267							112227
3-Phenyl-2H-1,4-benzoxazine	LSM-23640	SID14729818, BRD-K02628096	1481783	InChI=1S/C14H11NO/c1-2-6-11(7-3-1)13-10-16-14-9-5-4-8-12(14)15-13/h1-9H,10H2	YTRPWVZGQUCPKT-UHFFFAOYSA-N	C1Oc2ccccc2N=C1c3ccccc3	BroadT	BRD-K02628096	BRD-K02628096-001-05-5	Key Organics Ltd.	6T-0861			C1Oc2ccccc2N=C1c1ccccc1	InChI=1S/C14H11NO/c1-2-6-11(7-3-1)13-10-16-14-9-5-4-8-12(14)15-13/h1-9H,10H2	YTRPWVZGQUCPKT-UHFFFAOYSA-N	209.084063982							112228
SMR000044210	LSM-23641	SID862162, BRD-K61802148	663387	InChI=1S/C18H23ClN4O4/c1-27-18(26)17-16(15-12(19)3-2-4-13(15)20-17)21-14(25)11-23-7-5-22(6-8-23)9-10-24/h2-4,20,24H,5-11H2,1H3,(H,21,25)	UVBVXUHABUKTAY-UHFFFAOYSA-N	COC(=O)c1[nH]c2cccc(Cl)c2c1NC(=O)CN3CCN(CCO)CC3	BroadT	BRD-K61802148	BRD-K61802148-001-05-2	InterBioScreen Ltd.	STOCK4S-33700			COC(=O)c1[nH]c2cccc(Cl)c2c1NC(=O)CN1CCN(CCO)CC1	InChI=1S/C18H23ClN4O4/c1-27-18(26)17-16(15-12(19)3-2-4-13(15)20-17)21-14(25)11-23-7-5-22(6-8-23)9-10-24/h2-4,20,24H,5-11H2,1H3,(H,21,25)	UVBVXUHABUKTAY-UHFFFAOYSA-N	394.140782966							112229
N-[4-Cyano-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl]cyclopropanecarboxamide	LSM-23642	SID4259487, BRD-A21346136	2966558	InChI=1S/C11H10F3N3O2/c1-5-7(4-15)10(9(19)16-5,11(12,13)14)17-8(18)6-2-3-6/h6H,2-3H2,1H3,(H,16,19)(H,17,18)	BPAVCFHQKIHUDI-UHFFFAOYSA-N	CC1=C(C#N)C(NC(=O)C2CC2)(C(=O)N1)C(F)(F)F	BroadT	BRD-A21346136	BRD-A21346136-001-05-5	ChemBridge Corporation	7927338			CC1=C(C#N)C(NC(=O)C2CC2)(C(=O)N1)C(F)(F)F	InChI=1S/C11H10F3N3O2/c1-5-7(4-15)10(9(19)16-5,11(12,13)14)17-8(18)6-2-3-6/h6H,2-3H2,1H3,(H,16,19)(H,17,18)	BPAVCFHQKIHUDI-UHFFFAOYSA-N	273.07251119							112230
T5231807	LSM-23643	SID14747057, BRD-K81254093	2099103	InChI=1S/C16H13ClN2O4S2/c17-14-7-8-15(24-14)25(21,22)19-13-6-2-1-5-12(13)16(20)18-10-11-4-3-9-23-11/h1-9,19H,10H2,(H,18,20)	XGGVLWHXNJQLBM-UHFFFAOYSA-N	Clc1ccc(s1)S(=O)(=O)Nc2ccccc2C(=O)NCc3occc3	BroadT	BRD-K81254093	BRD-K81254093-001-06-5	Enamine Ltd.	T5231807			Clc1ccc(s1)S(=O)(=O)Nc1ccccc1C(=O)NCc1ccco1	InChI=1S/C16H13ClN2O4S2/c17-14-7-8-15(24-14)25(21,22)19-13-6-2-1-5-12(13)16(20)18-10-11-4-3-9-23-11/h1-9,19H,10H2,(H,18,20)	XGGVLWHXNJQLBM-UHFFFAOYSA-N	396.000526006							112231
AC1M23KB	LSM-23644	SID24833843, BRD-K12535899	2161460	InChI=1S/C20H22N4O2S/c1-3-24(13-19(25)22-16-10-6-7-11-17(16)27-2)12-18-21-15-9-5-4-8-14(15)20(26)23-18/h4-11H,3,12-13H2,1-2H3,(H,22,25)(H,21,23,26)	HLUWVTNAQCFBSF-UHFFFAOYSA-N	CCN(CC(=O)Nc1ccccc1SC)Cc2nc(O)c3ccccc3n2	BroadT	BRD-K12535899	BRD-K12535899-001-05-9	Enamine Ltd.	T5267455			CCN(CC(=O)Nc1ccccc1SC)Cc1nc(O)c2ccccc2n1	InChI=1S/C20H22N4O2S/c1-3-24(13-19(25)22-16-10-6-7-11-17(16)27-2)12-18-21-15-9-5-4-8-14(15)20(26)23-18/h4-11H,3,12-13H2,1-2H3,(H,22,25)(H,21,23,26)	HLUWVTNAQCFBSF-UHFFFAOYSA-N	382.146346674							112232
BRD-A82602065	LSM-23645			InChI=1S/C23H21N5O3S/c1-3-28-19-10-9-14(22(30)31-4-2)11-18(19)27-23(28)32-13-20(29)15(12-24)21-25-16-7-5-6-8-17(16)26-21/h5-11,15H,3-4,13H2,1-2H3,(H,25,26)	ZGCHXKGYNHECBU-UHFFFAOYSA-N	CCOC(=O)c1ccc2c(c1)nc(SCC(=O)C(C#N)c3nc4ccccc4[nH]3)n2CC	BroadT	BRD-A82602065	BRD-A82602065-001-05-2	Enamine Ltd.	T0515-1457			CCOC(=O)c1ccc2n(CC)c(SCC(=O)C(C#N)c3nc4ccccc4[nH]3)nc2c1	InChI=1S/C23H21N5O3S/c1-3-28-19-10-9-14(22(30)31-4-2)11-18(19)27-23(28)32-13-20(29)15(12-24)21-25-16-7-5-6-8-17(16)26-21/h5-11,15H,3-4,13H2,1-2H3,(H,25,26)	ZGCHXKGYNHECBU-UHFFFAOYSA-N	447.136510272							112233
MLS000375298	LSM-44003	SID22401569, BRD-K02247990	2467974	InChI=1S/C27H18ClF6N3O4/c1-40-23-10-15(9-16(13-35)25(39)37-21-12-18(27(32,33)34)6-7-20(21)28)5-8-22(23)41-14-24(38)36-19-4-2-3-17(11-19)26(29,30)31/h2-12H,14H2,1H3,(H,36,38)(H,37,39)/b16-9+	RZNOUJVZRGPNED-CXUHLZMHSA-N	COc1cc(\C=C(/C#N)\C(=O)Nc2cc(ccc2Cl)C(F)(F)F)ccc1OCC(=O)Nc3cccc(c3)C(F)(F)F	BroadT	BRD-K02247990	BRD-K02247990-001-05-1	Enamine Ltd.	T0518-7530			COc1cc(ccc1OCC(=O)Nc1cccc(c1)C(F)(F)F)\C=C(/C#N)C(=O)Nc1cc(ccc1Cl)C(F)(F)F	InChI=1S/C27H18ClF6N3O4/c1-40-23-10-15(9-16(13-35)25(39)37-21-12-18(27(32,33)34)6-7-20(21)28)5-8-22(23)41-14-24(38)36-19-4-2-3-17(11-19)26(29,30)31/h2-12H,14H2,1H3,(H,36,38)(H,37,39)/b16-9+	RZNOUJVZRGPNED-CXUHLZMHSA-N	597.089002996							
AC1O9MLS	LSM-23647	SID26667940, SID842972, BRD-K18700174	6762293	InChI=1S/C26H20N4O2S/c31-24(30-22-11-5-1-7-17(22)13-14-18-8-2-6-12-23(18)30)16-33-26-29-28-25(32-26)20-15-27-21-10-4-3-9-19(20)21/h1-12,15,27H,13-14,16H2	DIPLADCLJYNRDD-UHFFFAOYSA-N	O=C(CSc1oc(nn1)c2c[nH]c3ccccc23)N4c5ccccc5CCc6ccccc46	BroadT	BRD-K18700174	BRD-K18700174-001-05-9	Asinex Ltd.	ASN 04889194			O=C(CSc1nnc(o1)-c1c[nH]c2ccccc12)N1c2ccccc2CCc2ccccc12	InChI=1S/C26H20N4O2S/c31-24(30-22-11-5-1-7-17(22)13-14-18-8-2-6-12-23(18)30)16-33-26-29-28-25(32-26)20-15-27-21-10-4-3-9-19(20)21/h1-12,15,27H,13-14,16H2	DIPLADCLJYNRDD-UHFFFAOYSA-N	452.13069661							
ST064634	LSM-23648	SID24808644, BRD-K83271024	5295551	InChI=1S/C20H22N2O3/c1-20(2,3)15-7-4-13(5-8-15)11-21-19(24)14-6-9-17-16(10-14)22-18(23)12-25-17/h4-10H,11-12H2,1-3H3,(H,21,24)(H,22,23)	LTEMSSPLCZTGSU-UHFFFAOYSA-N	CC(C)(C)c1ccc(CNC(=O)c2ccc3OCC(=O)Nc3c2)cc1	BroadT	BRD-K83271024	BRD-K83271024-001-05-3	Asinex Ltd.	BAS 14051260			CC(C)(C)c1ccc(CNC(=O)c2ccc3OCC(=O)Nc3c2)cc1	InChI=1S/C20H22N2O3/c1-20(2,3)15-7-4-13(5-8-15)11-21-19(24)14-6-9-17-16(10-14)22-18(23)12-25-17/h4-10H,11-12H2,1-3H3,(H,21,24)(H,22,23)	LTEMSSPLCZTGSU-UHFFFAOYSA-N	338.163042584							112236
5840-11-9	LSM-23649	SID24829703, BRD-K65584944	2369091	InChI=1S/C13H14N2O/c1-16-13-5-3-2-4-12(13)15-11-8-6-10(14)7-9-11/h2-9,15H,14H2,1H3	COFNCRYAMLLPRB-UHFFFAOYSA-N	COc1ccccc1Nc2ccc(N)cc2	BroadT	BRD-K65584944	BRD-K65584944-001-05-8	Enamine Ltd.	T0507-2884			COc1ccccc1Nc1ccc(N)cc1	InChI=1S/C13H14N2O/c1-16-13-5-3-2-4-12(13)15-11-8-6-10(14)7-9-11/h2-9,15H,14H2,1H3	COFNCRYAMLLPRB-UHFFFAOYSA-N	214.110613088							112237
AC1NJAC9	LSM-23650	BRD-K40636143	4869168	InChI=1S/C19H18N4O2/c1-25-16-9-7-15(8-10-16)19(24)23-22-17(13-18-20-11-12-21-18)14-5-3-2-4-6-14/h2-12H,13H2,1H3,(H,20,21)(H,23,24)	HGRLOELHPCRQNR-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NN=C(Cc2ncc[nH]2)c3ccccc3	BroadT	BRD-K40636143	BRD-K40636143-001-08-9	Enamine Ltd.	T5322429			COc1ccc(cc1)C(=O)NN=C(Cc1ncc[nH]1)c1ccccc1	InChI=1S/C19H18N4O2/c1-25-16-9-7-15(8-10-16)19(24)23-22-17(13-18-20-11-12-21-18)14-5-3-2-4-6-14/h2-12H,13H2,1H3,(H,20,21)(H,23,24)	HGRLOELHPCRQNR-UHFFFAOYSA-N	334.142975856							112238
MLS000704335	LSM-23651	4-{([(4'-Chlorophenyl)Amino]Carbonylamino)}Benzenesulfonamide, BRD-K76023535	730672	InChI=1S/C13H12ClN3O3S/c14-9-1-3-10(4-2-9)16-13(18)17-11-5-7-12(8-6-11)21(15,19)20/h1-8H,(H2,15,19,20)(H2,16,17,18)	HACQCGHVZICZSC-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1	BroadT	BRD-K76023535	BRD-K76023535-001-05-9	Specs	AI-204/31750036			NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1	InChI=1S/C13H12ClN3O3S/c14-9-1-3-10(4-2-9)16-13(18)17-11-5-7-12(8-6-11)21(15,19)20/h1-8H,(H2,15,19,20)(H2,16,17,18)	HACQCGHVZICZSC-UHFFFAOYSA-N	325.028789674							112239
STK177265	LSM-23652	BRD-K67619511	3118972	InChI=1S/C11H16N4O3/c1-15-10(16)8(14-18)9(13-11(15)17)12-7-5-3-2-4-6-7/h7,18H,2-6H2,1H3,(H,12,13,17)	FSOSCEUFQFGEDE-UHFFFAOYSA-N	CN1C(=O)N=C(NC2CCCCC2)C(=NO)C1=O	BroadT	BRD-K67619511	BRD-K67619511-001-05-3	Asinex Ltd.	BAS 00792950			CN1C(=O)N=C(NC2CCCCC2)C(=NO)C1=O	InChI=1S/C11H16N4O3/c1-15-10(16)8(14-18)9(13-11(15)17)12-7-5-3-2-4-6-7/h7,18H,2-6H2,1H3,(H,12,13,17)	FSOSCEUFQFGEDE-UHFFFAOYSA-N	252.122240412							
AC1MLULA	LSM-23653	SID14740923, BRD-A71097331	3275785	InChI=1S/C24H29NO3/c1-18(2)21(23-11-7-15-28-23)12-13-25-24(26)17-20(22-10-6-14-27-22)16-19-8-4-3-5-9-19/h3-11,14-15,18,20-21H,12-13,16-17H2,1-2H3,(H,25,26)	WOVQBAKDGWRITN-UHFFFAOYSA-N	CC(C)C(CCNC(=O)CC(Cc1ccccc1)c2occc2)c3occc3	BroadT	BRD-A71097331	BRD-A71097331-001-05-6	InterBioScreen Ltd.	STOCK5S-38446			CC(C)C(CCNC(=O)CC(Cc1ccccc1)c1ccco1)c1ccco1	InChI=1S/C24H29NO3/c1-18(2)21(23-11-7-15-28-23)12-13-25-24(26)17-20(22-10-6-14-27-22)16-19-8-4-3-5-9-19/h3-11,14-15,18,20-21H,12-13,16-17H2,1-2H3,(H,25,26)	WOVQBAKDGWRITN-UHFFFAOYSA-N	379.214743798							112241
SMR000074540	LSM-23654	SID4263872, BRD-K60163230	975176	InChI=1S/C12H12N4O3/c1-2-19-12(18)10-9(14-7-15-10)11(17)16-8-3-5-13-6-4-8/h3-7H,2H2,1H3,(H,14,15)(H,13,16,17)	LWPBFRIHRVOUNK-UHFFFAOYSA-N	CCOC(=O)c1[nH]cnc1C(=O)Nc2ccncc2	BroadT	BRD-K60163230	BRD-K60163230-001-06-7	ChemBridge Corporation	7671429			CCOC(=O)c1[nH]cnc1C(=O)Nc1ccncc1	InChI=1S/C12H12N4O3/c1-2-19-12(18)10-9(14-7-15-10)11(17)16-8-3-5-13-6-4-8/h3-7H,2H2,1H3,(H,14,15)(H,13,16,17)	LWPBFRIHRVOUNK-UHFFFAOYSA-N	260.090940284							112242
AC1LJWYB	LSM-23655	BRD-K09018805	1008007	InChI=1S/C19H20N4O2S/c1-14-9-11-18(12-10-14)26(24,25)22-20-13-19-15(2)21-23(16(19)3)17-7-5-4-6-8-17/h4-13,22H,1-3H3	RTXNHCBWVATSOB-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NN=Cc2c(C)nn(c2C)c3ccccc3	BroadT	BRD-K09018805	BRD-K09018805-001-06-2	Specs	AK-968/15604159			Cc1nn(c(C)c1C=NNS(=O)(=O)c1ccc(C)cc1)-c1ccccc1	InChI=1S/C19H20N4O2S/c1-14-9-11-18(12-10-14)26(24,25)22-20-13-19-15(2)21-23(16(19)3)17-7-5-4-6-8-17/h4-13,22H,1-3H3	RTXNHCBWVATSOB-UHFFFAOYSA-N	368.13069661							112243
T5244810	LSM-23656	SID16953512, BRD-K09718177	2116304	InChI=1S/C21H24N2O5/c24-19(22-13-15-7-2-1-3-8-15)14-28-21(26)16-9-4-5-10-17(16)23-20(25)18-11-6-12-27-18/h4-6,9-12,15H,1-3,7-8,13-14H2,(H,22,24)(H,23,25)	RDEPIHDPHLEJDT-UHFFFAOYSA-N	O=C(COC(=O)c1ccccc1NC(=O)c2occc2)NCC3CCCCC3	BroadT	BRD-K09718177	BRD-K09718177-001-05-9	Enamine Ltd.	T5244810			O=C(COC(=O)c1ccccc1NC(=O)c1ccco1)NCC1CCCCC1	InChI=1S/C21H24N2O5/c24-19(22-13-15-7-2-1-3-8-15)14-28-21(26)16-9-4-5-10-17(16)23-20(25)18-11-6-12-27-18/h4-6,9-12,15H,1-3,7-8,13-14H2,(H,22,24)(H,23,25)	RDEPIHDPHLEJDT-UHFFFAOYSA-N	384.168521888							112244
ST50851024	LSM-23657	SID14739463, SID85267421, BRD-K31350933	971034	InChI=1S/C14H14BrN3O2/c1-9-3-5-12(20-2)11(7-9)17-14(19)18-13-6-4-10(15)8-16-13/h3-8H,1-2H3,(H2,16,17,18,19)	YQLUTFOWIIIASF-UHFFFAOYSA-N	COc1ccc(C)cc1NC(=O)Nc2ccc(Br)cn2	BroadT	BRD-K31350933	BRD-K31350933-001-05-8	ChemBridge Corporation	7812017			COc1ccc(C)cc1NC(=O)Nc1ccc(Br)cn1	InChI=1S/C14H14BrN3O2/c1-9-3-5-12(20-2)11(7-9)17-14(19)18-13-6-4-10(15)8-16-13/h3-8H,1-2H3,(H2,16,17,18,19)	YQLUTFOWIIIASF-UHFFFAOYSA-N	335.026939318							112245
AC1OB2UW	LSM-23658	SID24831595, BRD-K99185324	6839239	InChI=1S/C18H20N4OS/c1-11-16(13(3)23)12(2)20-17(11)15-10-24-18(22-21-15)19-9-14-7-5-4-6-8-14/h4-8,20H,9-10H2,1-3H3,(H,19,22)	UFYGXJCLGUAZDO-UHFFFAOYSA-N	CC(=O)c1c(C)[nH]c(C2=NN=C(NCc3ccccc3)SC2)c1C	BroadT	BRD-K99185324	BRD-K99185324-001-05-4	Enamine Ltd.	T5305900			CC(=O)c1c(C)[nH]c(c1C)C1=NN=C(NCc2ccccc2)SC1	InChI=1S/C18H20N4OS/c1-11-16(13(3)23)12(2)20-17(11)15-10-24-18(22-21-15)19-9-14-7-5-4-6-8-14/h4-8,20H,9-10H2,1-3H3,(H,19,22)	UFYGXJCLGUAZDO-UHFFFAOYSA-N	340.13578199							
N-[4-(Morpholin-4-yldiazenyl)phenyl]acetamide	LSM-23659	SID24809761, BRD-K59799058	799944	InChI=1S/C12H16N4O2/c1-10(17)13-11-2-4-12(5-3-11)14-15-16-6-8-18-9-7-16/h2-5H,6-9H2,1H3,(H,13,17)	PSPJJIFJGYSIOL-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)N=NN2CCOCC2	BroadT	BRD-K59799058	BRD-K59799058-001-05-2	Asinex Ltd.	BAS 00608479			CC(=O)Nc1ccc(cc1)N=NN1CCOCC1	InChI=1S/C12H16N4O2/c1-10(17)13-11-2-4-12(5-3-11)14-15-16-6-8-18-9-7-16/h2-5H,6-9H2,1H3,(H,13,17)	PSPJJIFJGYSIOL-UHFFFAOYSA-N	248.127325792							112247
MLS000039961	LSM-23660	SID50101916, SID860722, BRD-K11219527	661998	InChI=1S/C14H14N2O6S/c1-20-11(17)7-22-16-13(19)9-5-3-4-6-10(9)15-14(16)23-8-12(18)21-2/h3-6H,7-8H2,1-2H3	AFILFYYGFRBRIA-UHFFFAOYSA-N	COC(=O)CON1C(=Nc2ccccc2C1=O)SCC(=O)OC	BroadT	BRD-K11219527	BRD-K11219527-001-05-1	InterBioScreen Ltd.	STOCK3S-91326			COC(=O)COn1c(SCC(=O)OC)nc2ccccc2c1=O	InChI=1S/C14H14N2O6S/c1-20-11(17)7-22-16-13(19)9-5-3-4-6-10(9)15-14(16)23-8-12(18)21-2/h3-6H,7-8H2,1-2H3	AFILFYYGFRBRIA-UHFFFAOYSA-N	338.057256878							112248
AC1LGLPN	LSM-23661	BRD-K53418960	823512	InChI=1S/C14H19N7O2/c1-3-21(4-2)11-7-5-10(6-8-11)9-16-18-14(22)17-13-12(15)19-23-20-13/h5-9H,3-4H2,1-2H3,(H2,15,19)(H2,17,18,20,22)	CWTWQRUUBOIIFY-UHFFFAOYSA-N	CCN(CC)c1ccc(C=NNC(=O)Nc2nonc2N)cc1	BroadT	BRD-K53418960	BRD-K53418960-001-07-8	Specs	AG-670/31511016			CCN(CC)c1ccc(C=NNC(=O)Nc2nonc2N)cc1	InChI=1S/C14H19N7O2/c1-3-21(4-2)11-7-5-10(6-8-11)9-16-18-14(22)17-13-12(15)19-23-20-13/h5-9H,3-4H2,1-2H3,(H2,15,19)(H2,17,18,20,22)	CWTWQRUUBOIIFY-UHFFFAOYSA-N	317.160022918							112249
T5254260	LSM-23662	SID24827902, BRD-K39875859	2126566	InChI=1S/C21H24N4O4/c1-12(2)18(20(27)25-21-22-16-7-5-6-8-17(16)23-21)24-19(26)13-9-14(28-3)11-15(10-13)29-4/h5-12,18H,1-4H3,(H,24,26)(H2,22,23,25,27)/t18-/m0/s1	HJGDTFGCXILSEZ-SFHVURJKSA-N	COc1cc(OC)cc(c1)C(=O)N[C@@H](C(C)C)C(=O)Nc2nc3ccccc3[nH]2	BroadT	BRD-K39875859	BRD-K39875859-001-07-2	Enamine Ltd.	T5254260			COc1cc(OC)cc(c1)C(=O)N[C@@H](C(C)C)C(=O)Nc1nc2ccccc2[nH]1	InChI=1S/C21H24N4O4/c1-12(2)18(20(27)25-21-22-16-7-5-6-8-17(16)23-21)24-19(26)13-9-14(28-3)11-15(10-13)29-4/h5-12,18H,1-4H3,(H,24,26)(H2,22,23,25,27)/t18-/m0/s1	HJGDTFGCXILSEZ-SFHVURJKSA-N	396.179755288							112250
4-(4-Methylpiperazino)-2,6-diphenyl-5-pyrimidinecarbonitrile	LSM-23663	SID24818271, BRD-K51219376	1480493	InChI=1S/C22H21N5/c1-26-12-14-27(15-13-26)22-19(16-23)20(17-8-4-2-5-9-17)24-21(25-22)18-10-6-3-7-11-18/h2-11H,12-15H2,1H3	PVSSXSWACOFACA-UHFFFAOYSA-N	CN1CCN(CC1)c2nc(nc(c3ccccc3)c2C#N)c4ccccc4	BroadT	BRD-K51219376	BRD-K51219376-001-07-0	Key Organics Ltd.	1E-136S			CN1CCN(CC1)c1nc(nc(-c2ccccc2)c1C#N)-c1ccccc1	InChI=1S/C22H21N5/c1-26-12-14-27(15-13-26)22-19(16-23)20(17-8-4-2-5-9-17)24-21(25-22)18-10-6-3-7-11-18/h2-11H,12-15H2,1H3	PVSSXSWACOFACA-UHFFFAOYSA-N	355.179695722							112251
MLS000516962	LSM-44004	SID24827031, BRD-K02671913	6086529	InChI=1S/C17H17NO2S/c19-17(8-7-16-2-1-13-21-16)14-3-5-15(6-4-14)18-9-11-20-12-10-18/h1-8,13H,9-12H2/b8-7+	QNPRTWJYMWDUSR-BQYQJAHWSA-N	O=C(\C=C\c1cccs1)c2ccc(cc2)N3CCOCC3	BroadT	BRD-K02671913	BRD-K02671913-001-05-6	Enamine Ltd.	T5283461			O=C(\C=C\c1cccs1)c1ccc(cc1)N1CCOCC1	InChI=1S/C17H17NO2S/c19-17(8-7-16-2-1-13-21-16)14-3-5-15(6-4-14)18-9-11-20-12-10-18/h1-8,13H,9-12H2/b8-7+	QNPRTWJYMWDUSR-BQYQJAHWSA-N	299.097999484							
SMR000146826	LSM-23665	SID14731552, BRD-K74480682	3693058	InChI=1S/C17H27N3O2/c1-2-3-4-5-6-7-8-10-14-19-16(21)17(22)20-15-12-9-11-13-18-15/h9,11-13H,2-8,10,14H2,1H3,(H,19,21)(H,18,20,22)	FIXUWYIAHRZSKG-UHFFFAOYSA-N	CCCCCCCCCCNC(=O)C(=O)Nc1ccccn1	BroadT	BRD-K74480682	BRD-K74480682-001-05-4	InterBioScreen Ltd.	STOCK1S-64959			CCCCCCCCCCNC(=O)C(=O)Nc1ccccn1	InChI=1S/C17H27N3O2/c1-2-3-4-5-6-7-8-10-14-19-16(21)17(22)20-15-12-9-11-13-18-15/h9,11-13H,2-8,10,14H2,1H3,(H,19,21)(H,18,20,22)	FIXUWYIAHRZSKG-UHFFFAOYSA-N	305.210327134							112253
F1873-1168	LSM-23666	SID24409566, SID51090457, BRD-K54453195	16030737	InChI=1S/C21H20N6O4S/c1-11-5-7-13(8-6-11)17-23-18-16(20(29)27(4)21(30)26(18)3)19(24-17)32-10-15(28)22-14-9-12(2)31-25-14/h5-9H,10H2,1-4H3,(H,22,25,28)	BMLWQDLTWDMAKH-UHFFFAOYSA-N	CN1C(=O)N(C)c2nc(nc(SCC(=O)Nc3cc(C)on3)c2C1=O)c4ccc(C)cc4	BroadT	BRD-K54453195	BRD-K54453195-001-05-5	Life Chemicals Inc.	F1873-1168			Cc1cc(NC(=O)CSc2nc(nc3n(C)c(=O)n(C)c(=O)c23)-c2ccc(C)cc2)no1	InChI=1S/C21H20N6O4S/c1-11-5-7-13(8-6-11)17-23-18-16(20(29)27(4)21(30)26(18)3)19(24-17)32-10-15(28)22-14-9-12(2)31-25-14/h5-9H,10H2,1-4H3,(H,22,25,28)	BMLWQDLTWDMAKH-UHFFFAOYSA-N	452.12667387							112254
SMR000038019	LSM-23667	SID862232, BRD-K01149656	663455	InChI=1S/C22H20N6O/c1-4-8-18-15(5-1)20-21(29-18)22(24-14-23-20)28-11-9-27(10-12-28)13-19-25-16-6-2-3-7-17(16)26-19/h1-8,14H,9-13H2,(H,25,26)	YJOVISWECAGURX-UHFFFAOYSA-N	C(N1CCN(CC1)c2ncnc3c2oc4ccccc34)c5nc6ccccc6[nH]5	BroadT	BRD-K01149656	BRD-K01149656-001-04-8	InterBioScreen Ltd.	STOCK4S-34096			C(N1CCN(CC1)c1ncnc2c3ccccc3oc12)c1nc2ccccc2[nH]1	InChI=1S/C22H20N6O/c1-4-8-18-15(5-1)20-21(29-18)22(24-14-23-20)28-11-9-27(10-12-28)13-19-25-16-6-2-3-7-17(16)26-19/h1-8,14H,9-13H2,(H,25,26)	YJOVISWECAGURX-UHFFFAOYSA-N	384.16985932							112255
SMR000028804	LSM-23668	SID4249839, SID87344272, BRD-A19908948	3243731	InChI=1S/C17H19ClN4O2/c1-3-22-11(2)14(10-20-22)15-8-16(24-21-15)17(23)19-9-12-4-6-13(18)7-5-12/h4-7,10,16H,3,8-9H2,1-2H3,(H,19,23)	WZMCSBFEYYHNKX-UHFFFAOYSA-N	CCn1ncc(C2=NOC(C2)C(=O)NCc3ccc(Cl)cc3)c1C	BroadT	BRD-A19908948	BRD-A19908948-001-07-0	ChemDiv Inc.	C715-0341			CCn1ncc(C2=NOC(C2)C(=O)NCc2ccc(Cl)cc2)c1C	InChI=1S/C17H19ClN4O2/c1-3-22-11(2)14(10-20-22)15-8-16(24-21-15)17(23)19-9-12-4-6-13(18)7-5-12/h4-7,10,16H,3,8-9H2,1-2H3,(H,19,23)	WZMCSBFEYYHNKX-UHFFFAOYSA-N	346.119653598							112256
AC1LRSOU	LSM-23669	BRD-K41024230	1476849	InChI=1S/C17H18N4O3/c1-12(19-20-14-8-10-15(24-2)11-9-14)16(21-23)17(22)18-13-6-4-3-5-7-13/h3-11,20,23H,1-2H3,(H,18,22)	BPGGDJJSBCFUIK-UHFFFAOYSA-N	COc1ccc(NN=C(C)C(=NO)C(=O)Nc2ccccc2)cc1	BroadT	BRD-K41024230	BRD-K41024230-001-05-7	Key Organics Ltd.	4M-737			COc1ccc(NN=C(C)C(=NO)C(=O)Nc2ccccc2)cc1	InChI=1S/C17H18N4O3/c1-12(19-20-14-8-10-15(24-2)11-9-14)16(21-23)17(22)18-13-6-4-3-5-7-13/h3-11,20,23H,1-2H3,(H,18,22)	BPGGDJJSBCFUIK-UHFFFAOYSA-N	326.137890476							
SMR000154416	LSM-23670	SID14744711, BRD-K26244720	3958112	InChI=1S/C19H21FN4O2/c20-15-7-5-14(6-8-15)9-10-21-18(26)13-24-17-4-2-1-3-16(17)23-19(24)22-11-12-25/h1-8,25H,9-13H2,(H,21,26)(H,22,23)	FHRUHFWPCWVBQQ-UHFFFAOYSA-N	OCCNc1nc2ccccc2n1CC(=O)NCCc3ccc(F)cc3	BroadT	BRD-K26244720	BRD-K26244720-001-05-7	Enamine Ltd.	T5260932			OCCNc1nc2ccccc2n1CC(=O)NCCc1ccc(F)cc1	InChI=1S/C19H21FN4O2/c20-15-7-5-14(6-8-15)9-10-21-18(26)13-24-17-4-2-1-3-16(17)23-19(24)22-11-12-25/h1-8,25H,9-13H2,(H,21,26)(H,22,23)	FHRUHFWPCWVBQQ-UHFFFAOYSA-N	356.164854152							112258
SMR000105131	LSM-23671	SID7974889, BRD-K79252316	1101757	InChI=1S/C15H16ClN3O3S2/c16-12-5-4-11(14(20)18-15-17-6-9-23-15)10-13(12)24(21,22)19-7-2-1-3-8-19/h4-6,9-10H,1-3,7-8H2,(H,17,18,20)	YBDJXIBCMORRIJ-UHFFFAOYSA-N	Clc1ccc(cc1S(=O)(=O)N2CCCCC2)C(=O)Nc3nccs3	BroadT	BRD-K79252316	BRD-K79252316-001-05-6	ChemBridge Corporation	5914929			Clc1ccc(cc1S(=O)(=O)N1CCCCC1)C(=O)Nc1nccs1	InChI=1S/C15H16ClN3O3S2/c16-12-5-4-11(14(20)18-15-17-6-9-23-15)10-13(12)24(21,22)19-7-2-1-3-8-19/h4-6,9-10H,1-3,7-8H2,(H,17,18,20)	YBDJXIBCMORRIJ-UHFFFAOYSA-N	385.032160492							112259
MLS000334846	LSM-23672	SID22408568, BRD-K04667280	2446553	InChI=1S/C16H16ClNOS/c1-11-3-6-15(9-12(11)2)20-14-7-4-13(5-8-14)18-16(19)10-17/h3-9H,10H2,1-2H3,(H,18,19)	ORXIIDGKDCBEGL-UHFFFAOYSA-N	Cc1ccc(Sc2ccc(NC(=O)CCl)cc2)cc1C	BroadT	BRD-K04667280	BRD-K04667280-001-07-3	Enamine Ltd.	T5308460			Cc1ccc(Sc2ccc(NC(=O)CCl)cc2)cc1C	InChI=1S/C16H16ClNOS/c1-11-3-6-15(9-12(11)2)20-14-7-4-13(5-8-14)18-16(19)10-17/h3-9H,10H2,1-2H3,(H,18,19)	ORXIIDGKDCBEGL-UHFFFAOYSA-N	305.064112542							112260
MLS000834618	LSM-23673	SID24841497, BRD-K71600228	16196996	InChI=1S/C28H33N3O4/c32-17-19-10-12-20(13-11-19)18-34-27-15-22(21-6-2-1-3-7-21)14-25(35-27)28(33)29-16-26-30-23-8-4-5-9-24(23)31-26/h4-5,8-14,21-22,27,32H,1-3,6-7,15-18H2,(H,29,33)(H,30,31)/t22-,27+/m1/s1	PSPNTUAIJKUCIA-AMGIVPHBSA-N	OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)NCc3nc4ccccc4[nH]3)C5CCCCC5)cc1	BroadT	BRD-K71600228	BRD-K71600228-001-07-7	Harvard University	DHPC11_000466			OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)NCc2nc3ccccc3[nH]2)C2CCCCC2)cc1	InChI=1S/C28H33N3O4/c32-17-19-10-12-20(13-11-19)18-34-27-15-22(21-6-2-1-3-7-21)14-25(35-27)28(33)29-16-26-30-23-8-4-5-9-24(23)31-26/h4-5,8-14,21-22,27,32H,1-3,6-7,15-18H2,(H,29,33)(H,30,31)/t22-,27+/m1/s1	PSPNTUAIJKUCIA-AMGIVPHBSA-N	475.247106566							112261
MLS000572607	LSM-1576	BRD-A45657137, SID17416086, SID48410002, SID99495586	2885102	InChI=1S/C29H26N2O6S2/c1-5-37-28(33)23-24(18-10-7-6-8-11-18)30-29-31(25(23)21-12-9-13-38-21)27(32)22(39-29)16-17-14-19(34-2)26(36-4)20(15-17)35-3/h6-16,25H,5H2,1-4H3	MQTMDDXRQIEIKY-UHFFFAOYSA-N	CCOC(=O)C1=C(N=C2SC(=Cc3cc(OC)c(OC)c(OC)c3)C(=O)N2C1c4cccs4)c5ccccc5	BroadT	BRD-A45657137	BRD-A45657137-001-06-4	ChemBridge Corporation	6080611			CCOC(=O)C1=C(N=c2sc(=Cc3cc(OC)c(OC)c(OC)c3)c(=O)n2C1c1cccs1)c1ccccc1	InChI=1S/C29H26N2O6S2/c1-5-37-28(33)23-24(18-10-7-6-8-11-18)30-29-31(25(23)21-12-9-13-38-21)27(32)22(39-29)16-17-14-19(34-2)26(36-4)20(15-17)35-3/h6-16,25H,5H2,1-4H3	MQTMDDXRQIEIKY-UHFFFAOYSA-N	562.123227952							91721
SMR000113993	LSM-23674	SID14728384, BRD-K04130483	9549753	InChI=1S/C24H23N5/c1-2-28-17-26-21-14-19(12-13-22(21)28)25-15-24-27-20-10-6-7-11-23(20)29(24)16-18-8-4-3-5-9-18/h3-14,17,25H,2,15-16H2,1H3	GUXLBBVVAYGJQD-UHFFFAOYSA-N	CCn1cnc2cc(NCc3nc4ccccc4n3Cc5ccccc5)ccc12	BroadT	BRD-K04130483	BRD-K04130483-001-05-1	Specs	AE-848/41078289			CCn1cnc2cc(NCc3nc4ccccc4n3Cc3ccccc3)ccc12	InChI=1S/C24H23N5/c1-2-28-17-26-21-14-19(12-13-22(21)28)25-15-24-27-20-10-6-7-11-23(20)29(24)16-18-8-4-3-5-9-18/h3-14,17,25H,2,15-16H2,1H3	GUXLBBVVAYGJQD-UHFFFAOYSA-N	381.195345786							112262
ZINC03247957	LSM-23675	SID24835388, BRD-K72469029	2365164	InChI=1S/C14H17NO4S/c1-18-12-7-10(20-2)5-6-11(12)14(17)19-8-13(16)15-9-3-4-9/h5-7,9H,3-4,8H2,1-2H3,(H,15,16)	RBOVDKHZWMXSQO-UHFFFAOYSA-N	COc1cc(SC)ccc1C(=O)OCC(=O)NC2CC2	BroadT	BRD-K72469029	BRD-K72469029-001-06-9	Enamine Ltd.	T0509-7692			COc1cc(SC)ccc1C(=O)OCC(=O)NC1CC1	InChI=1S/C14H17NO4S/c1-18-12-7-10(20-2)5-6-11(12)14(17)19-8-13(16)15-9-3-4-9/h5-7,9H,3-4,8H2,1-2H3,(H,15,16)	RBOVDKHZWMXSQO-UHFFFAOYSA-N	295.087828724							112263
3-(4-Methoxyphenyl)-1-phenyl-3-(phenylsulfonyl)propan-1-one	LSM-23676	SID17513653, BRD-A33095017	3135155	InChI=1S/C22H20O4S/c1-26-19-14-12-18(13-15-19)22(16-21(23)17-8-4-2-5-9-17)27(24,25)20-10-6-3-7-11-20/h2-15,22H,16H2,1H3	UKAUPWVVVABNBV-UHFFFAOYSA-N	COc1ccc(cc1)C(CC(=O)c2ccccc2)S(=O)(=O)c3ccccc3	BroadT	BRD-A33095017	BRD-A33095017-001-05-8	InterBioScreen Ltd.	STOCK2S-88844			COc1ccc(cc1)C(CC(=O)c1ccccc1)S(=O)(=O)c1ccccc1	InChI=1S/C22H20O4S/c1-26-19-14-12-18(13-15-19)22(16-21(23)17-8-4-2-5-9-17)27(24,25)20-10-6-3-7-11-20/h2-15,22H,16H2,1H3	UKAUPWVVVABNBV-UHFFFAOYSA-N	380.10822981							112264
8-(Tosylamino)quinoline	LSM-23677	SID87241449, SID14734290, SID103061991, BRD-K19576518	82533	InChI=1S/C16H14N2O2S/c1-12-7-9-14(10-8-12)21(19,20)18-15-6-2-4-13-5-3-11-17-16(13)15/h2-11,18H,1H3	ZSMKPYXVUIWTCT-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)Nc2cccc3cccnc23	BroadT	BRD-K19576518	BRD-K19576518-001-09-9	ChemBridge Corporation	5137109			Cc1ccc(cc1)S(=O)(=O)Nc1cccc2cccnc12	InChI=1S/C16H14N2O2S/c1-12-7-9-14(10-8-12)21(19,20)18-15-6-2-4-13-5-3-11-17-16(13)15/h2-11,18H,1H3	ZSMKPYXVUIWTCT-UHFFFAOYSA-N	298.077598398							112265
MLS000417875	LSM-23678	SID22410015, BRD-K48788686	2116235	InChI=1S/C27H24N2O6S/c1-3-15-29(24-13-6-7-14-26(24)34-2)36(32,33)20-10-8-9-19(16-20)27(31)35-18-25(30)22-17-28-23-12-5-4-11-21(22)23/h3-14,16-17,28H,1,15,18H2,2H3	FALPZHDUKBLXOH-UHFFFAOYSA-N	COc1ccccc1N(CC=C)S(=O)(=O)c2cccc(c2)C(=O)OCC(=O)c3c[nH]c4ccccc34	BroadT	BRD-K48788686	BRD-K48788686-001-05-9	Enamine Ltd.	T5244739			COc1ccccc1N(CC=C)S(=O)(=O)c1cccc(c1)C(=O)OCC(=O)c1c[nH]c2ccccc12	InChI=1S/C27H24N2O6S/c1-3-15-29(24-13-6-7-14-26(24)34-2)36(32,33)20-10-8-9-19(16-20)27(31)35-18-25(30)22-17-28-23-12-5-4-11-21(22)23/h3-14,16-17,28H,1,15,18H2,2H3	FALPZHDUKBLXOH-UHFFFAOYSA-N	504.135507198							112266
AG-205/40649864	LSM-23679	SID17431808, BRD-K34526507	686451	InChI=1S/C16H16N2O2S/c1-11-2-5-13(6-3-11)18-16(21)17-9-12-4-7-14-15(8-12)20-10-19-14/h2-8H,9-10H2,1H3,(H2,17,18,21)	YHPFMNQEQIJIQS-UHFFFAOYSA-N	Cc1ccc(NC(=NCc2ccc3OCOc3c2)S)cc1	BroadT	BRD-K34526507	BRD-K34526507-001-05-6	ChemBridge Corporation	6426124			Cc1ccc(NC(S)=NCc2ccc3OCOc3c2)cc1	InChI=1S/C16H16N2O2S/c1-11-2-5-13(6-3-11)18-16(21)17-9-12-4-7-14-15(8-12)20-10-19-14/h2-8H,9-10H2,1H3,(H2,17,18,21)	YHPFMNQEQIJIQS-UHFFFAOYSA-N	300.093248462							112267
10F-358S	LSM-44005	SID24819628, BRD-K05835964	5706991	InChI=1S/C15H16Cl2N2S/c1-15(2)9-10(18-14(19-15)20-3)7-8-11-12(16)5-4-6-13(11)17/h4-9H,1-3H3,(H,18,19)/b8-7+	FGDDFWOYMWOYQE-BQYQJAHWSA-N	CSC1=NC(=CC(C)(C)N1)\C=C\c2c(Cl)cccc2Cl	BroadT	BRD-K05835964	BRD-K05835964-001-05-2	Key Organics Ltd.	10F-358S			CSC1=NC(\C=C\c2c(Cl)cccc2Cl)=CC(C)(C)N1	InChI=1S/C15H16Cl2N2S/c1-15(2)9-10(18-14(19-15)20-3)7-8-11-12(16)5-4-6-13(11)17/h4-9H,1-3H3,(H,18,19)/b8-7+	FGDDFWOYMWOYQE-BQYQJAHWSA-N	326.041124642							
AC1M3OX1	LSM-23681	SID24792751, BRD-K72684508	2194101	InChI=1S/C16H16N2O2S/c1-12-7-9-13(10-8-12)16(17)18-20-15(19)11-21-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H2,17,18)	VBFTXXHPIFTWFK-UHFFFAOYSA-N	Cc1ccc(cc1)C(=N)NOC(=O)CSc2ccccc2	BroadT	BRD-K72684508	BRD-K72684508-001-06-3	ChemBridge Corporation	7587622			Cc1ccc(cc1)C(=N)NOC(=O)CSc1ccccc1	InChI=1S/C16H16N2O2S/c1-12-7-9-13(10-8-12)16(17)18-20-15(19)11-21-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H2,17,18)	VBFTXXHPIFTWFK-UHFFFAOYSA-N	300.093248462							112269
MLS000419139	LSM-23682	SID24816849, BRD-K49683533	326670	InChI=1S/C16H15NS/c1-12-16(14-9-5-6-10-15(14)17-12)18-11-13-7-3-2-4-8-13/h2-10,17H,11H2,1H3	LONJHSQLGJHHKK-UHFFFAOYSA-N	Cc1[nH]c2ccccc2c1SCc3ccccc3	BroadT	BRD-K49683533	BRD-K49683533-001-05-6	Life Chemicals Inc.	F0575-0054			Cc1[nH]c2ccccc2c1SCc1ccccc1	InChI=1S/C16H15NS/c1-12-16(14-9-5-6-10-15(14)17-12)18-11-13-7-3-2-4-8-13/h2-10,17H,11H2,1H3	LONJHSQLGJHHKK-UHFFFAOYSA-N	253.09252018							112270
F1016-0640	LSM-23683	SID17514710, BRD-A98886817	3615459	InChI=1S/C21H23FN2O3S2/c1-2-3-10-27-21(26)14-28-13-20(25)24-18(15-6-8-16(22)9-7-15)12-17(23-24)19-5-4-11-29-19/h4-9,11,18H,2-3,10,12-14H2,1H3	OVVJEAXJBXVSEO-UHFFFAOYSA-N	CCCCOC(=O)CSCC(=O)N1N=C(CC1c2ccc(F)cc2)c3cccs3	BroadT	BRD-A98886817	BRD-A98886817-001-05-4	Life Chemicals Inc.	F1016-0640			CCCCOC(=O)CSCC(=O)N1N=C(CC1c1ccc(F)cc1)c1cccs1	InChI=1S/C21H23FN2O3S2/c1-2-3-10-27-21(26)14-28-13-20(25)24-18(15-6-8-16(22)9-7-15)12-17(23-24)19-5-4-11-29-19/h4-9,11,18H,2-3,10,12-14H2,1H3	OVVJEAXJBXVSEO-UHFFFAOYSA-N	434.113412196							112271
ZINC00065798	LSM-23684	SID26663820, BRD-K84115730	693660	InChI=1S/C17H12FN3O2/c1-22-14-8-6-13(7-9-14)20-17-15(10-19)21-16(23-17)11-2-4-12(18)5-3-11/h2-9,20H,1H3	LUSOSEJHURWLPR-UHFFFAOYSA-N	COc1ccc(Nc2oc(nc2C#N)c3ccc(F)cc3)cc1	BroadT	BRD-K84115730	BRD-K84115730-001-05-6	InterBioScreen Ltd.	STOCK3S-41185			COc1ccc(Nc2oc(nc2C#N)-c2ccc(F)cc2)cc1	InChI=1S/C17H12FN3O2/c1-22-14-8-6-13(7-9-14)20-17-15(10-19)21-16(23-17)11-2-4-12(18)5-3-11/h2-9,20H,1H3	LUSOSEJHURWLPR-UHFFFAOYSA-N	309.091354854							112272
AC1LDCYU	LSM-23685	SID863803, BRD-K48696144	665057	InChI=1S/C15H24N4O2S/c20-14(12-4-2-1-3-5-12)16-15-18-17-13(22-15)6-7-19-8-10-21-11-9-19/h12H,1-11H2,(H,16,18,20)	PYPJIIUVKAJBGL-UHFFFAOYSA-N	O=C(Nc1nnc(CCN2CCOCC2)s1)C3CCCCC3	BroadT	BRD-K48696144	BRD-K48696144-001-05-0	InterBioScreen Ltd.	STOCK4S-90249			O=C(Nc1nnc(CCN2CCOCC2)s1)C1CCCCC1	InChI=1S/C15H24N4O2S/c20-14(12-4-2-1-3-5-12)16-15-18-17-13(22-15)6-7-19-8-10-21-11-9-19/h12H,1-11H2,(H,16,18,20)	PYPJIIUVKAJBGL-UHFFFAOYSA-N	324.161996738							112273
MLS000777408	LSM-23686	SID26670885, BRD-K11875614	1973659	InChI=1S/C15H14ClN7O3S/c1-9(2)18-14-19-13(16)20-15(21-14)22(7-17)8-23-12(24)10-5-3-4-6-11(10)27(23,25)26/h3-6,9H,8H2,1-2H3,(H,18,19,20,21)	TZYLZLJCFUDOTG-UHFFFAOYSA-N	CC(C)Nc1nc(Cl)nc(n1)N(CN2C(=O)c3ccccc3S2(=O)=O)C#N	BroadT	BRD-K11875614	BRD-K11875614-001-05-4	InterBioScreen Ltd.	STOCK1S-24038			CC(C)Nc1nc(Cl)nc(n1)N(CN1C(=O)c2ccccc2S1(=O)=O)C#N	InChI=1S/C15H14ClN7O3S/c1-9(2)18-14-19-13(16)20-15(21-14)22(7-17)8-23-12(24)10-5-3-4-6-11(10)27(23,25)26/h3-6,9H,8H2,1-2H3,(H,18,19,20,21)	TZYLZLJCFUDOTG-UHFFFAOYSA-N	407.056735778							112274
SMR000150501	LSM-23687	SID16953404, BRD-K35066423	4877971	InChI=1S/C26H38N2O4/c1-3-31-23-13-22(28-5-7-30-8-6-28)24(32-4-2)12-21(23)27-25(29)17-26-14-18-9-19(15-26)11-20(10-18)16-26/h12-13,18-20H,3-11,14-17H2,1-2H3,(H,27,29)	DOIYDADRICFCFL-UHFFFAOYSA-N	CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)CC34CC5CC(CC(C5)C3)C4	BroadT	BRD-K35066423	BRD-K35066423-001-05-3	Enamine Ltd.	T5307730			CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)CC12CC3CC(CC(C3)C1)C2	InChI=1S/C26H38N2O4/c1-3-31-23-13-22(28-5-7-30-8-6-28)24(32-4-2)12-21(23)27-25(29)17-26-14-18-9-19(15-26)11-20(10-18)16-26/h12-13,18-20H,3-11,14-17H2,1-2H3,(H,27,29)	DOIYDADRICFCFL-UHFFFAOYSA-N	442.283157716							112275
ZINC04899167	LSM-23688	SID26663284, BRD-K66650250	3848646	InChI=1S/C13H10FN3O3S/c14-9-5-3-8(4-6-9)11(18)16-17-13(21)15-12(19)10-2-1-7-20-10/h1-7H,(H,16,18)(H2,15,17,19,21)	OHSHOWVQMFXDNB-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)NNC(=S)NC(=O)c2occc2	BroadT	BRD-K66650250	BRD-K66650250-001-05-4	InterBioScreen Ltd.	STOCK2S-93539			Fc1ccc(cc1)C(=O)NNC(=S)NC(=O)c1ccco1	InChI=1S/C13H10FN3O3S/c14-9-5-3-8(4-6-9)11(18)16-17-13(21)15-12(19)10-2-1-7-20-10/h1-7H,(H,16,18)(H2,15,17,19,21)	OHSHOWVQMFXDNB-UHFFFAOYSA-N	307.0426901							112276
SMR000033109	LSM-23689	SID24839534, SID4245647, BRD-A09409207	3240094	InChI=1S/C19H21BrN6O2S/c1-11-16-17(21)26(13-6-4-12(20)5-7-13)19(23-18(16)25-24-11)29-10-15(27)22-9-14-3-2-8-28-14/h4-7,14H,2-3,8-10,21H2,1H3,(H,22,27)	SRVMPDDAKJVLGU-UHFFFAOYSA-N	Cc1nnc2nc(SCC(=O)NCC3CCCO3)n(c(N)c12)c4ccc(Br)cc4	BroadT	BRD-A09409207	BRD-A09409207-001-05-1	ChemDiv Inc.	K898-0340			Cc1nnc2nc(SCC(=O)NCC3CCCO3)n(-c3ccc(Br)cc3)c(N)c12	InChI=1S/C19H21BrN6O2S/c1-11-16-17(21)26(13-6-4-12(20)5-7-13)19(23-18(16)25-24-11)29-10-15(27)22-9-14-3-2-8-28-14/h4-7,14H,2-3,8-10,21H2,1H3,(H,22,27)	SRVMPDDAKJVLGU-UHFFFAOYSA-N	476.063007262							112277
AC1M9GUE	LSM-15554	BRD-K42379819	2582774	InChI=1S/C20H25NO2/c1-2-14-21-15-6-7-16-22-19-10-12-20(13-11-19)23-17-18-8-4-3-5-9-18/h2-5,8-13,21H,1,6-7,14-17H2	JAHBWDHQRCNRKB-UHFFFAOYSA-N	C=CCNCCCCOc1ccc(OCc2ccccc2)cc1	BroadT	BRD-K42379819	BRD-K42379819-034-05-4	ChemBridge Corporation	7021919		OC(=O)C(=O)O	C=CCNCCCCOc1ccc(OCc2ccccc2)cc1.OC(=O)C(=O)O	InChI=1S/C20H25NO2.C2H2O4/c1-2-14-21-15-6-7-16-22-19-10-12-20(13-11-19)23-17-18-8-4-3-5-9-18;3-1(4)2(5)6/h2-5,8-13,21H,1,6-7,14-17H2;(H,3,4)(H,5,6)	TVNLGPSJSIOPSJ-UHFFFAOYSA-N	311.18852905							104190, 104190
ZINC03231596	LSM-44006	SID26724338, BRD-K07689019	2349764	InChI=1S/C23H26FN3O4S/c24-20-4-6-21(7-5-20)25-11-13-26(14-12-25)23(28)10-3-19-1-8-22(9-2-19)32(29,30)27-15-17-31-18-16-27/h1-10H,11-18H2/b10-3+	IPPOKPFIFNQJJW-XCVCLJGOSA-N	Fc1ccc(cc1)N2CCN(CC2)C(=O)\C=C\c3ccc(cc3)S(=O)(=O)N4CCOCC4	BroadT	BRD-K07689019	BRD-K07689019-001-05-6	Enamine Ltd.	T0507-0182			Fc1ccc(cc1)N1CCN(CC1)C(=O)\C=C\c1ccc(cc1)S(=O)(=O)N1CCOCC1	InChI=1S/C23H26FN3O4S/c24-20-4-6-21(7-5-20)25-11-13-26(14-12-25)23(28)10-3-19-1-8-22(9-2-19)32(29,30)27-15-17-31-18-16-27/h1-10H,11-18H2/b10-3+	IPPOKPFIFNQJJW-XCVCLJGOSA-N	459.162805232							
MLS000772460	LSM-23691	SID24835136, BRD-K53014614	2472289	InChI=1S/C18H19N3O2/c1-13-6-4-7-14(12-13)23-11-5-10-17(22)21-18-19-15-8-2-3-9-16(15)20-18/h2-4,6-9,12H,5,10-11H2,1H3,(H2,19,20,21,22)	VHGXCKSMHQNBME-UHFFFAOYSA-N	Cc1cccc(OCCCC(=O)Nc2nc3ccccc3[nH]2)c1	BroadT	BRD-K53014614	BRD-K53014614-001-05-9	Enamine Ltd.	T5327875			Cc1cccc(OCCCC(=O)Nc2nc3ccccc3[nH]2)c1	InChI=1S/C18H19N3O2/c1-13-6-4-7-14(12-13)23-11-5-10-17(22)21-18-19-15-8-2-3-9-16(15)20-18/h2-4,6-9,12H,5,10-11H2,1H3,(H2,19,20,21,22)	VHGXCKSMHQNBME-UHFFFAOYSA-N	309.147726878							112279
MLS000082959	LSM-23692	SID24841141, SID864434, BRD-K22293207	665681	InChI=1S/C21H22N6O2S3/c1-11-7-12(2)27(26-11)19-24-17(31-10-15(28)23-20-22-5-6-30-20)16-13-8-21(3,4)29-9-14(13)32-18(16)25-19/h5-7H,8-10H2,1-4H3,(H,22,23,28)	AXPCQQONFZSGSW-UHFFFAOYSA-N	Cc1cc(C)n(n1)c2nc(SCC(=O)Nc3nccs3)c4c5CC(C)(C)OCc5sc4n2	BroadT	BRD-K22293207	BRD-K22293207-001-05-0	InterBioScreen Ltd.	STOCK5S-15997			Cc1cc(C)n(n1)-c1nc(SCC(=O)Nc2nccs2)c2c3CC(C)(C)OCc3sc2n1	InChI=1S/C21H22N6O2S3/c1-11-7-12(2)27(26-11)19-24-17(31-10-15(28)23-20-22-5-6-30-20)16-13-8-21(3,4)29-9-14(13)32-18(16)25-19/h5-7H,8-10H2,1-4H3,(H,22,23,28)	AXPCQQONFZSGSW-UHFFFAOYSA-N	486.096636074							112280
STK224087	LSM-23693	SID24802936, BRD-K02057599	1314386	InChI=1S/C23H19N3O7/c1-14-11-15(22(28)25-20-8-3-2-7-18(20)23(29)30)9-10-19(14)24-21(27)13-33-17-6-4-5-16(12-17)26(31)32/h2-12H,13H2,1H3,(H,24,27)(H,25,28)(H,29,30)	ZKJZCLQHBLMFOZ-UHFFFAOYSA-N	Cc1cc(ccc1NC(=O)COc2cccc(c2)[N+](=O)[O-])C(=O)Nc3ccccc3C(=O)O	BroadT	BRD-K02057599	BRD-K02057599-001-06-7	ChemBridge Corporation	7595791			Cc1cc(ccc1NC(=O)COc1cccc(c1)[N+]([O-])=O)C(=O)Nc1ccccc1C(O)=O	InChI=1S/C23H19N3O7/c1-14-11-15(22(28)25-20-8-3-2-7-18(20)23(29)30)9-10-19(14)24-21(27)13-33-17-6-4-5-16(12-17)26(31)32/h2-12H,13H2,1H3,(H,24,27)(H,25,28)(H,29,30)	ZKJZCLQHBLMFOZ-UHFFFAOYSA-N	449.122299978							112281
SMR000060796	LSM-3581	BRD-K70831943, SID24840413, SID3716671, SID56373866	2327953	InChI=1S/C19H20N2O3S2/c1-14-9-10-15(21-19(22)16-7-3-4-8-17(16)25-21)13-18(14)26(23,24)20-11-5-2-6-12-20/h3-4,7-10,13H,2,5-6,11-12H2,1H3	NKPYARCADGOZKH-UHFFFAOYSA-N	Cc1ccc(cc1S(=O)(=O)N2CCCCC2)N3Sc4ccccc4C3=O	BroadT	BRD-K70831943	BRD-K70831943-001-07-3	Sanford-Burnham Medical Research Institute	MLS-0022297			Cc1ccc(cc1S(=O)(=O)N1CCCCC1)-n1sc2ccccc2c1=O	InChI=1S/C19H20N2O3S2/c1-14-9-10-15(21-19(22)16-7-3-4-8-17(16)25-21)13-18(14)26(23,24)20-11-5-2-6-12-20/h3-4,7-10,13H,2,5-6,11-12H2,1H3	NKPYARCADGOZKH-UHFFFAOYSA-N	388.0915339							93241
SMR000206698	LSM-23694	SID17509964, BRD-K31040683	4110825	InChI=1S/C19H20N2O2S/c1-4-23-17-9-5-14(6-10-17)18-13-21(19(20-18)24-3)15-7-11-16(22-2)12-8-15/h5-13H,4H2,1-3H3	WYIKAJASMFPOTN-UHFFFAOYSA-N	CCOc1ccc(cc1)c2cn(c(SC)n2)c3ccc(OC)cc3	BroadT	BRD-K31040683	BRD-K31040683-001-06-5	ChemDiv Inc.	K242-0469			CCOc1ccc(cc1)-c1cn(c(SC)n1)-c1ccc(OC)cc1	InChI=1S/C19H20N2O2S/c1-4-23-17-9-5-14(6-10-17)18-13-21(19(20-18)24-3)15-7-11-16(22-2)12-8-15/h5-13H,4H2,1-3H3	WYIKAJASMFPOTN-UHFFFAOYSA-N	340.12454859							112282
ST50942021	LSM-23695	SID24780297, BRD-K46758233	1245738	InChI=1S/C14H15N3O4/c1-14(2,3)11-8-12(16-21-11)15-13(18)9-5-4-6-10(7-9)17(19)20/h4-8H,1-3H3,(H,15,16,18)	WQPXBACBBSRAAI-UHFFFAOYSA-N	CC(C)(C)c1onc(NC(=O)c2cccc(c2)[N+](=O)[O-])c1	BroadT	BRD-K46758233	BRD-K46758233-001-05-2	ChemBridge Corporation	7945704			CC(C)(C)c1cc(NC(=O)c2cccc(c2)[N+]([O-])=O)no1	InChI=1S/C14H15N3O4/c1-14(2,3)11-8-12(16-21-11)15-13(18)9-5-4-6-10(7-9)17(19)20/h4-8H,1-3H3,(H,15,16,18)	WQPXBACBBSRAAI-UHFFFAOYSA-N	289.10625599							112283
Ethyl 5-amino-3-(4-methoxyphenyl)-4-oxo-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate	LSM-23696	SID4259887, SID57288364, SID57288365, BRD-K84447645	719449	InChI=1S/C16H15N3O4S/c1-3-23-16(21)13-11-8-24-14(17)12(11)15(20)19(18-13)9-4-6-10(22-2)7-5-9/h4-8H,3,17H2,1-2H3	ZHOXCPCRQLGLIL-UHFFFAOYSA-N	CCOC(=O)C1=NN(C(=O)c2c(N)scc12)c3ccc(OC)cc3	BroadT	BRD-K84447645	BRD-K84447645-001-07-3	ChemBridge Corporation	7523775			CCOC(=O)c1nn(-c2ccc(OC)cc2)c(=O)c2c(N)scc12	InChI=1S/C16H15N3O4S/c1-3-23-16(21)13-11-8-24-14(17)12(11)15(20)19(18-13)9-4-6-10(22-2)7-5-9/h4-8H,3,17H2,1-2H3	ZHOXCPCRQLGLIL-UHFFFAOYSA-N	345.07832668							112284
AC1MSZEO	LSM-23697	BRD-K02648154	3542510	InChI=1S/C16H11N5O4/c22-15-12-6-1-2-7-13(12)18-14(19-15)16(23)20-17-9-10-4-3-5-11(8-10)21(24)25/h1-9H,(H,20,23)(H,18,19,22)	IFPCDJLGQZGKKE-UHFFFAOYSA-N	Oc1nc(nc2ccccc12)C(=O)NN=Cc3cccc(c3)[N+](=O)[O-]	BroadT	BRD-K02648154	BRD-K02648154-001-05-2	Enamine Ltd.	T0512-3495			Oc1nc(nc2ccccc12)C(=O)NN=Cc1cccc(c1)[N+]([O-])=O	InChI=1S/C16H11N5O4/c22-15-12-6-1-2-7-13(12)18-14(19-15)16(23)20-17-9-10-4-3-5-11(8-10)21(24)25/h1-9H,(H,20,23)(H,18,19,22)	IFPCDJLGQZGKKE-UHFFFAOYSA-N	337.081103882							112285
(2,5-Dioxopyrrolidin-3-yl) n'-[(4-methoxyphenyl)methyl]-n-phenylcarbamimidothioate	LSM-23698	SID24805896, BRD-A05907206	2867306	InChI=1S/C19H19N3O3S/c1-25-15-9-7-13(8-10-15)12-20-19(21-14-5-3-2-4-6-14)26-16-11-17(23)22-18(16)24/h2-10,16H,11-12H2,1H3,(H,20,21)(H,22,23,24)	DXCHRTPJBRKGQE-UHFFFAOYSA-N	COc1ccc(CN=C(Nc2ccccc2)SC3CC(=O)NC3=O)cc1	BroadT	BRD-A05907206	BRD-A05907206-001-04-2	Asinex Ltd.	BAS 01157414			COc1ccc(CN\C(SC2CC(=O)NC2=O)=N/c2ccccc2)cc1	InChI=1S/C19H19N3O3S/c1-25-15-9-7-13(8-10-15)12-20-19(21-14-5-3-2-4-6-14)26-16-11-17(23)22-18(16)24/h2-10,16H,11-12H2,1H3,(H,20,21)(H,22,23,24)	DXCHRTPJBRKGQE-UHFFFAOYSA-N	369.114712188							112286
AC1MGJ7S	LSM-23699	BRD-A17724553	2961870	InChI=1S/C14H14N4O2/c1-7(2)12-11-10(9-4-3-5-19-9)8(6-15)13(16)20-14(11)18-17-12/h3-5,7-8,10,16H,1-2H3,(H,17,18)	OXBJCKDYIRVBIV-UHFFFAOYSA-N	CC(C)c1[nH]nc2OC(=N)C(C#N)C(c3ccco3)c12	BroadT	BRD-A17724553	BRD-A17724553-001-08-7	Asinex Ltd.	BAS 06900695			CC(C)c1n[nH]c2OC(N)=C(C#N)C(c3ccco3)c12	InChI=1S/C14H14N4O2/c1-7(2)12-11-10(9-4-3-5-19-9)8(6-15)13(16)20-14(11)18-17-12/h3-5,7,10H,16H2,1-2H3,(H,17,18)	ISFYSJSSJKNRSS-UHFFFAOYSA-N	270.111675728							
AC1MDI50	LSM-23700	BRD-A93998311	2837244	InChI=1S/C20H15N3O6/c24-20(19-12-27-17-7-3-4-8-18(17)29-19)22-21-11-13-9-10-16(28-13)14-5-1-2-6-15(14)23(25)26/h1-11,19H,12H2,(H,22,24)	WRKGUVAXLIASQU-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1c2oc(C=NNC(=O)C3COc4ccccc4O3)cc2	BroadT	BRD-A93998311	BRD-A93998311-001-06-1	ChemBridge Corporation	5249856			[O-][N+](=O)c1ccccc1-c1ccc(C=NNC(=O)C2COc3ccccc3O2)o1	InChI=1S/C20H15N3O6/c24-20(19-12-27-17-7-3-4-8-18(17)29-19)22-21-11-13-9-10-16(28-13)14-5-1-2-6-15(14)23(25)26/h1-11,19H,12H2,(H,22,24)	WRKGUVAXLIASQU-UHFFFAOYSA-N	393.09608523							112288
MLS000064874	LSM-23701	SID4257649, BRD-K32930883	2215784	InChI=1S/C13H10N4S/c1-3-10(7-14-5-1)12-9-18-13(17-12)16-11-4-2-6-15-8-11/h1-9H,(H,16,17)	XYSYDZGXMGECOQ-UHFFFAOYSA-N	N(c1cccnc1)c2nc(cs2)c3cccnc3	BroadT	BRD-K32930883	BRD-K32930883-001-06-4	ChemBridge Corporation	7884250			N(c1nc(cs1)-c1cccnc1)c1cccnc1	InChI=1S/C13H10N4S/c1-3-10(7-14-5-1)12-9-18-13(17-12)16-11-4-2-6-15-8-11/h1-9H,(H,16,17)	XYSYDZGXMGECOQ-UHFFFAOYSA-N	254.06261705							112289
SMR000176912	LSM-23702	SID17431634, BRD-K70982665	1122641	InChI=1S/C25H20N4O2S2/c1-16-14-27-25(33-16)29-23(30)15-32-24-21(13-26)20(17-6-4-3-5-7-17)12-22(28-24)18-8-10-19(31-2)11-9-18/h3-12,14H,15H2,1-2H3,(H,27,29,30)	OELVQMYGEQHUAE-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(c3ccccc3)c(C#N)c(SCC(=O)Nc4ncc(C)s4)n2	BroadT	BRD-K70982665	BRD-K70982665-001-06-2	Asinex Ltd.	BAS 01377612			COc1ccc(cc1)-c1nc(SCC(=O)Nc2ncc(C)s2)c(C#N)c(c1)-c1ccccc1	InChI=1S/C25H20N4O2S2/c1-16-14-27-25(33-16)29-23(30)15-32-24-21(13-26)20(17-6-4-3-5-7-17)12-22(28-24)18-8-10-19(31-2)11-9-18/h3-12,14H,15H2,1-2H3,(H,27,29,30)	OELVQMYGEQHUAE-UHFFFAOYSA-N	472.1027673							112290
MLS000806970	LSM-44007	SID26664070, BRD-A85713941	5344075	InChI=1S/C20H17NO5S2/c1-26-16-10-13(7-8-15(16)22)11-17-18(23)21(20(27)28-17)14(19(24)25)9-12-5-3-2-4-6-12/h2-8,10-11,14,22H,9H2,1H3,(H,24,25)/b17-11-	SXGGEIQEHFCTTO-BOPFTXTBSA-N	COc1cc(\C=C\2/SC(=S)N(C(Cc3ccccc3)C(=O)O)C2=O)ccc1O	BroadT	BRD-A85713941	BRD-A85713941-001-05-4	InterBioScreen Ltd.	STOCK3S-53222			COc1cc(ccc1O)\C=C1/SC(=S)N(C(Cc2ccccc2)C(O)=O)C1=O	InChI=1S/C20H17NO5S2/c1-26-16-10-13(7-8-15(16)22)11-17-18(23)21(20(27)28-17)14(19(24)25)9-12-5-3-2-4-6-12/h2-8,10-11,14,22H,9H2,1H3,(H,24,25)/b17-11-	SXGGEIQEHFCTTO-BOPFTXTBSA-N	415.054814034							
ST069078	LSM-15352	BRD-K96052120	645833	InChI=1S/C18H23NO2/c1-2-16-18(14-8-4-5-9-17(14)21-16)15(20)10-13-19-11-6-3-7-12-19/h4-5,8-9H,2-3,6-7,10-13H2,1H3	RWTINHUYFIZICV-UHFFFAOYSA-N	CCc1oc2ccccc2c1C(=O)CCN3CCCCC3	BroadT	BRD-K96052120	BRD-K96052120-003-07-7	Asinex Ltd.	BAS 01530343		Cl	CCc1oc2ccccc2c1C(=O)CCN1CCCCC1.Cl	InChI=1S/C18H23NO2.ClH/c1-2-16-18(14-8-4-5-9-17(14)21-16)15(20)10-13-19-11-6-3-7-12-19;/h4-5,8-9H,2-3,6-7,10-13H2,1H3;1H	RMWHLDJPEVHXRW-UHFFFAOYSA-N	285.172878986							103998, 103998
AC1LQLLR	LSM-23704	SID26665959, BRD-K97455960	1403046	InChI=1S/C21H16ClN2O2PS/c22-15-11-12-18-19(13-15)28-21(23-18)24-20(25)14-27(26,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-13H,14H2,(H,23,24,25)	DHFRQLMZNKEENT-UHFFFAOYSA-N	Clc1ccc2nc(NC(=O)CP(=O)(c3ccccc3)c4ccccc4)sc2c1	BroadT	BRD-K97455960	BRD-K97455960-001-05-2	InterBioScreen Ltd.	STOCK5S-24996			Clc1ccc2nc(NC(=O)CP(=O)(c3ccccc3)c3ccccc3)sc2c1	InChI=1S/C21H16ClN2O2PS/c22-15-11-12-18-19(13-15)28-21(23-18)24-20(25)14-27(26,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-13H,14H2,(H,23,24,25)	DHFRQLMZNKEENT-UHFFFAOYSA-N	426.035862682							112292
ASN 03776401	LSM-23705	SID17507807, BRD-K31469986	3176093	InChI=1S/C20H21N3O4S/c1-2-21-20(28)23(12-15-4-3-5-25-15)11-14-8-13-9-17-18(27-7-6-26-17)10-16(13)22-19(14)24/h3-5,8-10H,2,6-7,11-12H2,1H3,(H,21,28)(H,22,24)	POGDIIFPZYLQSV-UHFFFAOYSA-N	CCN=C(S)N(Cc1occc1)Cc2cc3cc4OCCOc4cc3nc2O	BroadT	BRD-K31469986	BRD-K31469986-001-05-2	Asinex Ltd.	ASN 03776401			CCN=C(S)N(Cc1ccco1)Cc1cc2cc3OCCOc3cc2nc1O	InChI=1S/C20H21N3O4S/c1-2-21-20(28)23(12-15-4-3-5-25-15)11-14-8-13-9-17-18(27-7-6-26-17)10-16(13)22-19(14)24/h3-5,8-10H,2,6-7,11-12H2,1H3,(H,21,28)(H,22,24)	POGDIIFPZYLQSV-UHFFFAOYSA-N	399.125276872							112293
SMR000036808	LSM-23706	SID858565, BRD-K78443863	659874	InChI=1S/C18H22N2O6S/c1-24-15-10-13(11-16(25-2)17(15)26-3)18(21)20-9-8-12-4-6-14(7-5-12)27(19,22)23/h4-7,10-11H,8-9H2,1-3H3,(H,20,21)(H2,19,22,23)	SFSOKXWFHGEPTC-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)NCCc2ccc(cc2)S(=O)(=O)N	BroadT	BRD-K78443863	BRD-K78443863-001-05-9	InterBioScreen Ltd.	STOCK2S-56748			COc1cc(cc(OC)c1OC)C(=O)NCCc1ccc(cc1)S(N)(=O)=O	InChI=1S/C18H22N2O6S/c1-24-15-10-13(11-16(25-2)17(15)26-3)18(21)20-9-8-12-4-6-14(7-5-12)27(19,22)23/h4-7,10-11H,8-9H2,1-3H3,(H,20,21)(H2,19,22,23)	SFSOKXWFHGEPTC-UHFFFAOYSA-N	394.119857134							112294
T0513-1779	LSM-23707	BRD-A44748053	5110827	InChI=1S/C24H23N3O5S/c1-30-17-11-9-16(10-12-17)25-24-27(15-18-6-5-13-32-18)23(29)21(33-24)14-22(28)26-19-7-3-4-8-20(19)31-2/h3-13,21H,14-15H2,1-2H3,(H,26,28)	TWOCKINRHLWUPA-UHFFFAOYSA-N	COc1ccc(cc1)N=C2SC(CC(=O)Nc3ccccc3OC)C(=O)N2Cc4occc4	BroadT	BRD-A44748053	BRD-A44748053-001-05-4	Enamine Ltd.	T0513-1779			COc1ccc(cc1)N=C1SC(CC(=O)Nc2ccccc2OC)C(=O)N1Cc1ccco1	InChI=1S/C24H23N3O5S/c1-30-17-11-9-16(10-12-17)25-24-27(15-18-6-5-13-32-18)23(29)21(33-24)14-22(28)26-19-7-3-4-8-20(19)31-2/h3-13,21H,14-15H2,1-2H3,(H,26,28)	TWOCKINRHLWUPA-UHFFFAOYSA-N	465.135841556							112295
AC1O9DN8	LSM-23708	SID24791825, BRD-K83251175	6782766	InChI=1S/C19H14N2O2S2/c1-11-8-9-24-17(11)18(23)20-12-6-7-15(22)13(10-12)19-21-14-4-2-3-5-16(14)25-19/h2-10,22H,1H3,(H,20,23)	WGYDGVPXPLIPIR-UHFFFAOYSA-N	Cc1ccsc1C(=O)Nc2ccc(O)c(c2)c3nc4ccccc4s3	BroadT	BRD-K83251175	BRD-K83251175-001-05-2	Enamine Ltd.	T5308931			Cc1ccsc1C(=O)Nc1ccc(O)c(c1)-c1nc2ccccc2s1	InChI=1S/C19H14N2O2S2/c1-11-8-9-24-17(11)18(23)20-12-6-7-15(22)13(10-12)19-21-14-4-2-3-5-16(14)25-19/h2-10,22H,1H3,(H,20,23)	WGYDGVPXPLIPIR-UHFFFAOYSA-N	366.049669088							
T5422077	LSM-44008	SID24834767, BRD-K37794655	2688863	InChI=1S/C14H15ClN2O3/c1-8(2)17-14(19)10(7-16)4-9-5-11(15)13(18)12(6-9)20-3/h4-6,8,18H,1-3H3,(H,17,19)/b10-4+	CBFUBOALPHKYAS-ONNFQVAWSA-N	COc1cc(\C=C(/C#N)\C(=O)NC(C)C)cc(Cl)c1O	BroadT	BRD-K37794655	BRD-K37794655-001-05-7	Enamine Ltd.	ZU-1247373			COc1cc(cc(Cl)c1O)\C=C(/C#N)C(=O)NC(C)C	InChI=1S/C14H15ClN2O3/c1-8(2)17-14(19)10(7-16)4-9-5-11(15)13(18)12(6-9)20-3/h4-6,8,18H,1-3H3,(H,17,19)/b10-4+	CBFUBOALPHKYAS-ONNFQVAWSA-N	294.07712007							
3-[(2,4-Dichlorobenzyl)thio]-1,2,4-thiadiazol-5-amine	LSM-23710	SID14718892, BRD-K12837934	712941	InChI=1S/C9H7Cl2N3S2/c10-6-2-1-5(7(11)3-6)4-15-9-13-8(12)16-14-9/h1-3H,4H2,(H2,12,13,14)	DZDOIHXEUPFBLX-UHFFFAOYSA-N	Nc1nc(SCc2ccc(Cl)cc2Cl)ns1	BroadT	BRD-K12837934	BRD-K12837934-001-05-6	Specs	AO-080/42479799			Nc1nc(SCc2ccc(Cl)cc2Cl)ns1	InChI=1S/C9H7Cl2N3S2/c10-6-2-1-5(7(11)3-6)4-15-9-13-8(12)16-14-9/h1-3H,4H2,(H2,12,13,14)	DZDOIHXEUPFBLX-UHFFFAOYSA-N	290.945844054							112298
MLS-0004183.0001	LSM-3299	SID865021, BRD-K58679021, SID87544812, SID89650217	666267	InChI=1S/C22H29ClN6O2/c1-4-5-9-29-18(24-20-19(29)21(30)26(3)22(31)25(20)2)15-27-10-12-28(13-11-27)17-8-6-7-16(23)14-17/h6-8,14H,4-5,9-13,15H2,1-3H3	CYKISVYTUCOJRU-UHFFFAOYSA-N	CCCCn1c(CN2CCN(CC2)c3cccc(Cl)c3)nc4N(C)C(=O)N(C)C(=O)c14	BroadT	BRD-K58679021	BRD-K58679021-001-05-1	InterBioScreen Ltd.	STOCK5S-33982			CCCCn1c(CN2CCN(CC2)c2cccc(Cl)c2)nc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C22H29ClN6O2/c1-4-5-9-29-18(24-20-19(29)21(30)26(3)22(31)25(20)2)15-27-10-12-28(13-11-27)17-8-6-7-16(23)14-17/h6-8,14H,4-5,9-13,15H2,1-3H3	CYKISVYTUCOJRU-UHFFFAOYSA-N	444.204051938							93024
ST50249630	LSM-23711	SID49644091, BRD-K64472183	1117867	InChI=1S/C16H14BrN3OS/c1-11-2-8-14(9-3-11)21-10-15-18-19-16(22)20(15)13-6-4-12(17)5-7-13/h2-9H,10H2,1H3,(H,19,22)	MURJKRIXESYAJG-UHFFFAOYSA-N	Cc1ccc(OCc2nnc(S)n2c3ccc(Br)cc3)cc1	BroadT	BRD-K64472183	BRD-K64472183-001-05-7	Asinex Ltd.	BAS 01256979			Cc1ccc(OCc2nnc(S)n2-c2ccc(Br)cc2)cc1	InChI=1S/C16H14BrN3OS/c1-11-2-8-14(9-3-11)21-10-15-18-19-16(22)20(15)13-6-4-12(17)5-7-13/h2-9H,10H2,1H3,(H,19,22)	MURJKRIXESYAJG-UHFFFAOYSA-N	375.004095388							112299
SMR000152407	LSM-23712	SID17388452, BRD-K56679803	4432181	InChI=1S/C21H18N2O2S/c1-13-6-5-7-14(10-13)22-21(26)23-17-12-19-16(11-20(17)24-2)15-8-3-4-9-18(15)25-19/h3-12H,1-2H3,(H2,22,23,26)	YNKWSOWJVFVFSC-UHFFFAOYSA-N	COc1cc2c(oc3ccccc23)cc1N=C(S)Nc4cccc(C)c4	BroadT	BRD-K56679803	BRD-K56679803-001-05-7	Enamine Ltd.	T0519-2095			COc1cc2c(cc1N=C(S)Nc1cccc(C)c1)oc1ccccc21	InChI=1S/C21H18N2O2S/c1-13-6-5-7-14(10-13)22-21(26)23-17-12-19-16(11-20(17)24-2)15-8-3-4-9-18(15)25-19/h3-12H,1-2H3,(H2,22,23,26)	YNKWSOWJVFVFSC-UHFFFAOYSA-N	362.108898526							112300
ZINC03227464	LSM-23713	SID26657556, BRD-K92005363	2345659	InChI=1S/C18H17N3O3S/c1-23-13-8-9-14(15(11-13)24-2)17-20-21-18(25-17)19-16(22)10-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3,(H,19,21,22)	ATFLVBASRFUFAE-UHFFFAOYSA-N	COc1ccc(c(OC)c1)c2nnc(NC(=O)Cc3ccccc3)s2	BroadT	BRD-K92005363	BRD-K92005363-001-05-3	Enamine Ltd.	T0507-9208			COc1ccc(-c2nnc(NC(=O)Cc3ccccc3)s2)c(OC)c1	InChI=1S/C18H17N3O3S/c1-23-13-8-9-14(15(11-13)24-2)17-20-21-18(25-17)19-16(22)10-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3,(H,19,21,22)	ATFLVBASRFUFAE-UHFFFAOYSA-N	355.099062124							112301
MLS000520192	LSM-23714	SID14740516, BRD-K11533282	9551600	InChI=1S/C23H27N3O/c1-17-7-6-10-21(18(17)2)25-11-13-26(14-12-25)23(27)15-19-16-24(3)22-9-5-4-8-20(19)22/h4-10,16H,11-15H2,1-3H3	MHUJEWLSKBMXEZ-UHFFFAOYSA-N	Cc1cccc(N2CCN(CC2)C(=O)Cc3cn(C)c4ccccc34)c1C	BroadT	BRD-K11533282	BRD-K11533282-001-05-0	ChemDiv Inc.	C320-0410			Cc1cccc(N2CCN(CC2)C(=O)Cc2cn(C)c3ccccc23)c1C	InChI=1S/C23H27N3O/c1-17-7-6-10-21(18(17)2)25-11-13-26(14-12-25)23(27)15-19-16-24(3)22-9-5-4-8-20(19)22/h4-10,16H,11-15H2,1-3H3	MHUJEWLSKBMXEZ-UHFFFAOYSA-N	361.215412514							112302
AC1NIGNT	LSM-23715	BRD-A75439785	4830790	InChI=1S/C17H19N3OS/c1-11-3-4-15-14(9-11)10-16(22-15)17(21)20-19-12(2)13-5-7-18-8-6-13/h5-8,10-11H,3-4,9H2,1-2H3,(H,20,21)	QWZNPXXZKFNQEG-UHFFFAOYSA-N	CC1CCc2sc(cc2C1)C(=O)NN=C(C)c3ccncc3	BroadT	BRD-A75439785	BRD-A75439785-001-05-7	Enamine Ltd.	T5288304			CC1CCc2sc(cc2C1)C(=O)NN=C(C)c1ccncc1	InChI=1S/C17H19N3OS/c1-11-3-4-15-14(9-11)10-16(22-15)17(21)20-19-12(2)13-5-7-18-8-6-13/h5-8,10-11H,3-4,9H2,1-2H3,(H,20,21)	QWZNPXXZKFNQEG-UHFFFAOYSA-N	313.124882948							112303
MLS000389271	LSM-44009	SID22408751, BRD-K87163849	15945279	InChI=1S/C24H16O4/c25-20(23-16-19-11-5-7-13-22(19)27-23)15-14-17-8-4-6-12-21(17)28-24(26)18-9-2-1-3-10-18/h1-16H/b15-14-	CLDRRCVYIHWHOC-PFONDFGASA-N	O=C(Oc1ccccc1\C=C/C(=O)c2oc3ccccc3c2)c4ccccc4	BroadT	BRD-K87163849	BRD-K87163849-001-05-1	Enamine Ltd.	ZT-8277996			O=C(\C=C/c1ccccc1OC(=O)c1ccccc1)c1cc2ccccc2o1	InChI=1S/C24H16O4/c25-20(23-16-19-11-5-7-13-22(19)27-23)15-14-17-8-4-6-12-21(17)28-24(26)18-9-2-1-3-10-18/h1-16H/b15-14-	CLDRRCVYIHWHOC-PFONDFGASA-N	368.104858992							
HMS2819G15	LSM-23717	BRD-K08295340	1149090	InChI=1S/C19H17N3S2/c1-13(21-22-19(20)23)17-12-16(14-8-4-2-5-9-14)18(24-17)15-10-6-3-7-11-15/h2-12H,1H3,(H3,20,22,23)	KSUUNRFHOPONSZ-UHFFFAOYSA-N	CC(=NN=C(N)S)c1cc(c2ccccc2)c(s1)c3ccccc3	BroadT	BRD-K08295340	BRD-K08295340-001-06-9	Asinex Ltd.	BAS 00287156			CC(=NN=C(N)S)c1cc(c(s1)-c1ccccc1)-c1ccccc1	InChI=1S/C19H17N3S2/c1-13(21-22-19(20)23)17-12-16(14-8-4-2-5-9-14)18(24-17)15-10-6-3-7-11-15/h2-12H,1H3,(H3,20,22,23)	KSUUNRFHOPONSZ-UHFFFAOYSA-N	351.086388954							112305
MLS000565883	LSM-44010	SID16952548, BRD-K19668300	5972079	InChI=1S/C21H16ClN3O2S/c1-13-16(20(22)25(24-13)15-7-3-2-4-8-15)11-14(12-19(26)27)21-23-17-9-5-6-10-18(17)28-21/h2-11H,12H2,1H3,(H,26,27)/b14-11+	ZVDIXTJKCNITLU-SDNWHVSQSA-N	Cc1nn(c(Cl)c1\C=C(/CC(=O)O)\c2nc3ccccc3s2)c4ccccc4	BroadT	BRD-K19668300	BRD-K19668300-001-06-2	Enamine Ltd.	T5240048			Cc1nn(c(Cl)c1\C=C(/CC(O)=O)c1nc2ccccc2s1)-c1ccccc1	InChI=1S/C21H16ClN3O2S/c1-13-16(20(22)25(24-13)15-7-3-2-4-8-15)11-14(12-19(26)27)21-23-17-9-5-6-10-18(17)28-21/h2-11H,12H2,1H3,(H,26,27)/b14-11+	ZVDIXTJKCNITLU-SDNWHVSQSA-N	409.065175182							
MLS000775032	LSM-23719	SID24837800, BRD-K76210886	4884049	InChI=1S/C18H23BrN4O3S/c1-4-20-16-10-9-13(27(25,26)23(2)3)11-17(16)21-12-18(24)22-15-8-6-5-7-14(15)19/h5-11,20-21H,4,12H2,1-3H3,(H,22,24)	FJQOFAPRFVRUND-UHFFFAOYSA-N	CCNc1ccc(cc1NCC(=O)Nc2ccccc2Br)S(=O)(=O)N(C)C	BroadT	BRD-K76210886	BRD-K76210886-001-07-3	Enamine Ltd.	T5333122			CCNc1ccc(cc1NCC(=O)Nc1ccccc1Br)S(=O)(=O)N(C)C	InChI=1S/C18H23BrN4O3S/c1-4-20-16-10-9-13(27(25,26)23(2)3)11-17(16)21-12-18(24)22-15-8-6-5-7-14(15)19/h5-11,20-21H,4,12H2,1-3H3,(H,22,24)	FJQOFAPRFVRUND-UHFFFAOYSA-N	454.067423926							112307
AC1OBFMR	LSM-23720	SID22405606, BRD-A45839063	6846508	InChI=1S/C15H18N4OS/c1-10(8-20-2)17-15-19-18-14(9-21-15)12-7-16-13-6-4-3-5-11(12)13/h3-7,10,16H,8-9H2,1-2H3,(H,17,19)	PPMUCCOJGIQBCN-UHFFFAOYSA-N	COCC(C)NC1=NN=C(CS1)c2c[nH]c3ccccc23	BroadT	BRD-A45839063	BRD-A45839063-001-05-8	Enamine Ltd.	T5223533			COCC(C)NC1=NN=C(CS1)c1c[nH]c2ccccc12	InChI=1S/C15H18N4OS/c1-10(8-20-2)17-15-19-18-14(9-21-15)12-7-16-13-6-4-3-5-11(12)13/h3-7,10,16H,8-9H2,1-2H3,(H,17,19)	PPMUCCOJGIQBCN-UHFFFAOYSA-N	302.120131926							
MLS000521092	LSM-23721	SID14734126, BRD-K93659802	3568842	InChI=1S/C23H27N3O3/c27-22(11-15-26-20-8-3-4-9-21(20)29-17-23(26)28)24-12-5-13-25-14-10-18-6-1-2-7-19(18)16-25/h1-4,6-9H,5,10-17H2,(H,24,27)	PZDKYNYLZQONQS-UHFFFAOYSA-N	O=C(CCN1C(=O)COc2ccccc12)NCCCN3CCc4ccccc4C3	BroadT	BRD-K93659802	BRD-K93659802-001-05-5	ChemDiv Inc.	K786-6153			O=C(CCN1C(=O)COc2ccccc12)NCCCN1CCc2ccccc2C1	InChI=1S/C23H27N3O3/c27-22(11-15-26-20-8-3-4-9-21(20)29-17-23(26)28)24-12-5-13-25-14-10-18-6-1-2-7-19(18)16-25/h1-4,6-9H,5,10-17H2,(H,24,27)	PZDKYNYLZQONQS-UHFFFAOYSA-N	393.205241754							112309
SMR000072613	LSM-23722	SID4262988, BRD-K91912994	866382	InChI=1S/C11H10N2O2S2/c1-15-10(14)8-9(12)13(11(16)17-8)7-5-3-2-4-6-7/h2-6H,12H2,1H3	TVSSQEDFFUGSOL-UHFFFAOYSA-N	COC(=O)C1=C(N)N(C(=S)S1)c2ccccc2	BroadT	BRD-K91912994	BRD-K91912994-001-05-8	ChemBridge Corporation	7429339			COC(=O)c1sc(=S)n(c1N)-c1ccccc1	InChI=1S/C11H10N2O2S2/c1-15-10(14)8-9(12)13(11(16)17-8)7-5-3-2-4-6-7/h2-6H,12H2,1H3	TVSSQEDFFUGSOL-UHFFFAOYSA-N	266.01836896							112310
STK849099	LSM-23723	SID4265874, BRD-K33855136	1942295	InChI=1S/C17H14N4O2/c1-11-13(10-12-6-3-2-4-7-12)16(22)21-17(18-11)19-15(20-21)14-8-5-9-23-14/h2-9,22H,10H2,1H3	ODEWIVCYRRLYGA-UHFFFAOYSA-N	Cc1nc2nc(nn2c(O)c1Cc3ccccc3)c4occc4	BroadT	BRD-K33855136	BRD-K33855136-001-05-9	ChemBridge Corporation	7927077			Cc1nc2nc(nn2c(O)c1Cc1ccccc1)-c1ccco1	InChI=1S/C17H14N4O2/c1-11-13(10-12-6-3-2-4-7-12)16(22)21-17(18-11)19-15(20-21)14-8-5-9-23-14/h2-9,22H,10H2,1H3	ODEWIVCYRRLYGA-UHFFFAOYSA-N	306.111675728							
SMR000041942	LSM-23724	SID860068, BRD-K58481857	661372	InChI=1S/C18H22BrN3O4/c1-3-25-18(24)17-16(13-10-12(19)4-5-14(13)26-17)20-15(23)11-22-8-6-21(2)7-9-22/h4-5,10H,3,6-9,11H2,1-2H3,(H,20,23)	WGXCYXOTZCPXPU-UHFFFAOYSA-N	CCOC(=O)c1oc2ccc(Br)cc2c1NC(=O)CN3CCN(C)CC3	BroadT	BRD-K58481857	BRD-K58481857-001-04-4	InterBioScreen Ltd.	STOCK3S-45532			CCOC(=O)c1oc2ccc(Br)cc2c1NC(=O)CN1CCN(C)CC1	InChI=1S/C18H22BrN3O4/c1-3-25-18(24)17-16(13-10-12(19)4-5-14(13)26-17)20-15(23)11-22-8-6-21(2)7-9-22/h4-5,10H,3,6-9,11H2,1-2H3,(H,20,23)	WGXCYXOTZCPXPU-UHFFFAOYSA-N	423.079368814							112312
SMR000048070	LSM-23725	SID865415, BRD-K97931214	666670	InChI=1S/C22H20N4O3/c1-26-18-10-9-16(24-22(28)19-8-5-13-29-19)14-17(18)25-20(26)11-12-23-21(27)15-6-3-2-4-7-15/h2-10,13-14H,11-12H2,1H3,(H,23,27)(H,24,28)	FKQWQGLKQBUXGW-UHFFFAOYSA-N	Cn1c(CCNC(=O)c2ccccc2)nc3cc(NC(=O)c4occc4)ccc13	BroadT	BRD-K97931214	BRD-K97931214-001-05-6	InterBioScreen Ltd.	STOCK5S-45458			Cn1c(CCNC(=O)c2ccccc2)nc2cc(NC(=O)c3ccco3)ccc12	InChI=1S/C22H20N4O3/c1-26-18-10-9-16(24-22(28)19-8-5-13-29-19)14-17(18)25-20(26)11-12-23-21(27)15-6-3-2-4-7-15/h2-10,13-14H,11-12H2,1H3,(H,23,27)(H,24,28)	FKQWQGLKQBUXGW-UHFFFAOYSA-N	388.15354054							112313
MLS000766429	LSM-23726	SID24824679, BRD-K73883424	16195740	InChI=1S/C31H33BrN2O4/c32-28-12-10-26(11-13-28)27-18-29(38-30(19-27)37-22-25-8-6-24(21-35)7-9-25)31(36)34-16-14-33(15-17-34)20-23-4-2-1-3-5-23/h1-13,18,27,30,35H,14-17,19-22H2/t27-,30+/m1/s1	VXJGPQPIHWCJNM-OFSOJUDTSA-N	OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccc(Br)cc5)cc1	BroadT	BRD-K73883424	BRD-K73883424-001-07-9	Harvard University	(4-benzylpiperazin-1-yl)((2S,4S)-4-(4-bromophenyl)-2-(4-(hydroxymethyl)benzyloxy)-3,4-dihydro-2H-pyran-6-yl)methanone DHPC11_001341			OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N2CCN(Cc3ccccc3)CC2)c2ccc(Br)cc2)cc1	InChI=1S/C31H33BrN2O4/c32-28-12-10-26(11-13-28)27-18-29(38-30(19-27)37-22-25-8-6-24(21-35)7-9-25)31(36)34-16-14-33(15-17-34)20-23-4-2-1-3-5-23/h1-13,18,27,30,35H,14-17,19-22H2/t27-,30+/m1/s1	VXJGPQPIHWCJNM-OFSOJUDTSA-N	576.162370156							112314
9-Chloro-6-methyl-6H-indolo[2,3-b]quinoxaline	LSM-23727	SID7964632, BRD-K93651844	3155707	InChI=1S/C15H10ClN3/c1-19-13-7-6-9(16)8-10(13)14-15(19)18-12-5-3-2-4-11(12)17-14/h2-8H,1H3	NXJNINUNSFIGJN-UHFFFAOYSA-N	Cn1c2ccc(Cl)cc2c3nc4ccccc4nc13	BroadT	BRD-K93651844	BRD-K93651844-001-05-2	ChemDiv Inc.	5575-0052			Cn1c2ccc(Cl)cc2c2nc3ccccc3nc12	InChI=1S/C15H10ClN3/c1-19-13-7-6-9(16)8-10(13)14-15(19)18-12-5-3-2-4-11(12)17-14/h2-8H,1H3	NXJNINUNSFIGJN-UHFFFAOYSA-N	267.05632506							112315
MLS000528002	LSM-23728	SID14726077, BRD-A35506209	3229320	InChI=1S/C25H26F3N5O/c1-24(2,3)33-23(29-30-31-33)22(19-11-13-20(14-12-19)25(26,27)28)32(17-21-10-7-15-34-21)16-18-8-5-4-6-9-18/h4-15,22H,16-17H2,1-3H3	GJCKFQOJOGUGHY-UHFFFAOYSA-N	CC(C)(C)n1nnnc1C(N(Cc2occc2)Cc3ccccc3)c4ccc(cc4)C(F)(F)F	BroadT	BRD-A35506209	BRD-A35506209-001-05-0	Asinex Ltd.	ASN 07884510			CC(C)(C)n1nnnc1C(N(Cc1ccco1)Cc1ccccc1)c1ccc(cc1)C(F)(F)F	InChI=1S/C25H26F3N5O/c1-24(2,3)33-23(29-30-31-33)22(19-11-13-20(14-12-19)25(26,27)28)32(17-21-10-7-15-34-21)16-18-8-5-4-6-9-18/h4-15,22H,16-17H2,1-3H3	GJCKFQOJOGUGHY-UHFFFAOYSA-N	469.208945102							112316
STK851271	LSM-23729	SID4261038, BRD-K96711684	934512	InChI=1S/C18H14FN5O/c1-10-13-4-2-3-5-14(13)25-15(10)16-22-17(20)24-18(23-16)21-12-8-6-11(19)7-9-12/h2-9H,1H3,(H3,20,21,22,23,24)	UXYJKRZHUCDGEH-UHFFFAOYSA-N	Cc1c(oc2ccccc12)c3nc(N)nc(Nc4ccc(F)cc4)n3	BroadT	BRD-K96711684	BRD-K96711684-001-07-0	ChemBridge Corporation	7926857			Cc1c(oc2ccccc12)-c1nc(N)nc(Nc2ccc(F)cc2)n1	InChI=1S/C18H14FN5O/c1-10-13-4-2-3-5-14(13)25-15(10)16-22-17(20)24-18(23-16)21-12-8-6-11(19)7-9-12/h2-9H,1H3,(H3,20,21,22,23,24)	UXYJKRZHUCDGEH-UHFFFAOYSA-N	335.118238318							112317
SMR000065354	LSM-23730	SID3716394, BRD-A73802569	2999588	InChI=1S/C20H24ClN7O3S/c1-11(25(2)3)17-23-24-19(28(17)13-8-6-12(21)7-9-13)32-10-14(29)15-16(22)26(4)20(31)27(5)18(15)30/h6-9,11H,10,22H2,1-5H3	BFRZYEZJNARVEP-UHFFFAOYSA-N	CC(N(C)C)c1nnc(SCC(=O)C2=C(N)N(C)C(=O)N(C)C2=O)n1c3ccc(Cl)cc3	BroadT	BRD-A73802569	BRD-A73802569-001-05-0	Enamine Ltd.	ZU-2775506			CC(N(C)C)c1nnc(SCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)n1-c1ccc(Cl)cc1	InChI=1S/C20H24ClN7O3S/c1-11(25(2)3)17-23-24-19(28(17)13-8-6-12(21)7-9-13)32-10-14(29)15-16(22)26(4)20(31)27(5)18(15)30/h6-9,11H,10,22H2,1-5H3	BFRZYEZJNARVEP-UHFFFAOYSA-N	477.134986098							112318
SMR000061696	LSM-23731	SID3716154, BRD-A40336966	2999495	InChI=1S/C20H26FNO4/c1-14-11-22(12-15(2)26-14)18(23)13-25-19(24)20(9-3-4-10-20)16-5-7-17(21)8-6-16/h5-8,14-15H,3-4,9-13H2,1-2H3	JJRUHHJHWXKCHL-UHFFFAOYSA-N	CC1CN(CC(C)O1)C(=O)COC(=O)C2(CCCC2)c3ccc(F)cc3	BroadT	BRD-A40336966	BRD-A40336966-001-05-8	Enamine Ltd.	T0509-9935			CC1CN(CC(C)O1)C(=O)COC(=O)C1(CCCC1)c1ccc(F)cc1	InChI=1S/C20H26FNO4/c1-14-11-22(12-15(2)26-14)18(23)13-25-19(24)20(9-3-4-10-20)16-5-7-17(21)8-6-16/h5-8,14-15H,3-4,9-13H2,1-2H3	JJRUHHJHWXKCHL-UHFFFAOYSA-N	363.184586522							112319
2-(4-Fluorophenyl)-2-oxoethyl 2-(methylamino)benzoate	LSM-23732	SID24832674, BRD-K34333932	902750	InChI=1S/C16H14FNO3/c1-18-14-5-3-2-4-13(14)16(20)21-10-15(19)11-6-8-12(17)9-7-11/h2-9,18H,10H2,1H3	XRNPOSZWZPHRSJ-UHFFFAOYSA-N	CNc1ccccc1C(=O)OCC(=O)c2ccc(F)cc2	BroadT	BRD-K34333932	BRD-K34333932-001-05-2	Enamine Ltd.	T5237951			CNc1ccccc1C(=O)OCC(=O)c1ccc(F)cc1	InChI=1S/C16H14FNO3/c1-18-14-5-3-2-4-13(14)16(20)21-10-15(19)11-6-8-12(17)9-7-11/h2-9,18H,10H2,1H3	XRNPOSZWZPHRSJ-UHFFFAOYSA-N	287.095771518							112320
N-(2-Ethylphenyl)-2-methoxy-5-methylbenzenesulfonamide	LSM-23733	SID4256586, BRD-K09906118	935199	InChI=1S/C16H19NO3S/c1-4-13-7-5-6-8-14(13)17-21(18,19)16-11-12(2)9-10-15(16)20-3/h5-11,17H,4H2,1-3H3	XOPCFHWIZXGNSU-UHFFFAOYSA-N	CCc1ccccc1NS(=O)(=O)c2cc(C)ccc2OC	BroadT	BRD-K09906118	BRD-K09906118-001-05-2	ChemBridge Corporation	7935971			CCc1ccccc1NS(=O)(=O)c1cc(C)ccc1OC	InChI=1S/C16H19NO3S/c1-4-13-7-5-6-8-14(13)17-21(18,19)16-11-12(2)9-10-15(16)20-3/h5-11,17H,4H2,1-3H3	XOPCFHWIZXGNSU-UHFFFAOYSA-N	305.108564168							112321
BRD-K05011543-001-04-3	LSM-44011	SID24793616, SID85281127, BRD-K05011543	5736624	InChI=1S/C22H19BrN2O3/c1-15-2-4-17(5-3-15)22-18(14-25(24-22)13-12-21(27)28)8-11-20(26)16-6-9-19(23)10-7-16/h2-11,14H,12-13H2,1H3,(H,27,28)/b11-8-	ODPJFPAJUAAVPL-FLIBITNWSA-N	Cc1ccc(cc1)c2nn(CCC(=O)O)cc2\C=C/C(=O)c3ccc(Br)cc3	BroadT	BRD-K05011543	BRD-K05011543-001-08-4	ChemBridge Corporation	7196111			Cc1ccc(cc1)-c1nn(CCC(O)=O)cc1\C=C/C(=O)c1ccc(Br)cc1	InChI=1S/C22H19BrN2O3/c1-15-2-4-17(5-3-15)22-18(14-25(24-22)13-12-21(27)28)8-11-20(26)16-6-9-19(23)10-7-16/h2-11,14H,12-13H2,1H3,(H,27,28)/b11-8-	ODPJFPAJUAAVPL-FLIBITNWSA-N	438.057905088							
AC1NAO9P	LSM-23735	BRD-K24253116	4430062	InChI=1S/C15H13N3O2/c19-18(20)15-8-4-3-7-14(15)17-16-13-10-9-11-5-1-2-6-12(11)13/h1-8,17H,9-10H2	YHFOOEZWVLLHPT-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1NN=C2CCc3ccccc23	BroadT	BRD-K24253116	BRD-K24253116-001-06-0	Enamine Ltd.	T0513-2780			[O-][N+](=O)c1ccccc1NN=C1CCc2ccccc12	InChI=1S/C15H13N3O2/c19-18(20)15-8-4-3-7-14(15)17-16-13-10-9-11-5-1-2-6-12(11)13/h1-8,17H,9-10H2	YHFOOEZWVLLHPT-UHFFFAOYSA-N	267.100776686							112323
MLS000697862	LSM-23736	SID26724130, BRD-K70512109	16745333	InChI=1S/C30H33BrN4O2/c1-21-8-11-24(18-28(21)31)29(36)32-14-15-34-26(17-23-9-12-27(37-2)13-10-23)20-35-25(19-33-30(34)35)16-22-6-4-3-5-7-22/h3-13,18,25-26H,14-17,19-20H2,1-2H3,(H,32,36)/t25-,26+/m1/s1	HQCFZNPEJFNWGY-FTJBHMTQSA-N	COc1ccc(C[C@H]2CN3[C@H](Cc4ccccc4)CN=C3N2CCNC(=O)c5ccc(C)c(Br)c5)cc1	BroadT	BRD-K70512109	BRD-K70512109-001-05-3	Torrey Pines Institute for Molecular Studies	1138-70			COc1ccc(C[C@H]2CN3[C@H](Cc4ccccc4)CN=C3N2CCNC(=O)c2ccc(C)c(Br)c2)cc1	InChI=1S/C30H33BrN4O2/c1-21-8-11-24(18-28(21)31)29(36)32-14-15-34-26(17-23-9-12-27(37-2)13-10-23)20-35-25(19-33-30(34)35)16-22-6-4-3-5-7-22/h3-13,18,25-26H,14-17,19-20H2,1-2H3,(H,32,36)/t25-,26+/m1/s1	HQCFZNPEJFNWGY-FTJBHMTQSA-N	560.178688936							112324
MLS000772468	LSM-23737	SID26657865, BRD-A54878426	4883195	InChI=1S/C18H26N2O3/c1-12-9-13(2)11-20(10-12)18(22)14(3)23-17-8-6-5-7-16(17)19-15(4)21/h5-8,12-14H,9-11H2,1-4H3,(H,19,21)	CQKUXIHJJBNVMQ-UHFFFAOYSA-N	CC(Oc1ccccc1NC(=O)C)C(=O)N2CC(C)CC(C)C2	BroadT	BRD-A54878426	BRD-A54878426-001-06-4	Enamine Ltd.	T5329449			CC(Oc1ccccc1NC(C)=O)C(=O)N1CC(C)CC(C)C1	InChI=1S/C18H26N2O3/c1-12-9-13(2)11-20(10-12)18(22)14(3)23-17-8-6-5-7-16(17)19-15(4)21/h5-8,12-14H,9-11H2,1-4H3,(H,19,21)	CQKUXIHJJBNVMQ-UHFFFAOYSA-N	318.194342712							112325
ST50836179	LSM-23738	SID4265570, BRD-K29697209	2225132	InChI=1S/C13H18N2O2/c1-10-9-12(15-17-10)13(16)14-8-7-11-5-3-2-4-6-11/h5,9H,2-4,6-8H2,1H3,(H,14,16)	AAXJCMUPNOBCPU-UHFFFAOYSA-N	Cc1onc(c1)C(=O)NCCC2=CCCCC2	BroadT	BRD-K29697209	BRD-K29697209-001-05-3	ChemBridge Corporation	7944662			Cc1cc(no1)C(=O)NCCC1=CCCCC1	InChI=1S/C13H18N2O2/c1-10-9-12(15-17-10)13(16)14-8-7-11-5-3-2-4-6-11/h5,9H,2-4,6-8H2,1H3,(H,14,16)	AAXJCMUPNOBCPU-UHFFFAOYSA-N	234.136827836							112326
SMR000142629	LSM-23739	SID14736706, BRD-A74927609	2938449	InChI=1S/C17H21N3O3S2/c1-2-22-12-7-5-11(6-8-12)20-15(18)14(25-17(20)24)16(21)19-10-13-4-3-9-23-13/h5-8,13H,2-4,9-10,18H2,1H3,(H,19,21)	SJAIZBBQKZMZCM-UHFFFAOYSA-N	CCOc1ccc(cc1)N2C(=S)SC(=C2N)C(=O)NCC3CCCO3	BroadT	BRD-A74927609	BRD-A74927609-001-05-6	ChemBridge Corporation	7401542			CCOc1ccc(cc1)-n1c(N)c(sc1=S)C(=O)NCC1CCCO1	InChI=1S/C17H21N3O3S2/c1-2-22-12-7-5-11(6-8-12)20-15(18)14(25-17(20)24)16(21)19-10-13-4-3-9-23-13/h5-8,13H,2-4,9-10,18H2,1H3,(H,19,21)	SJAIZBBQKZMZCM-UHFFFAOYSA-N	379.102432942							112327
3F-310S	LSM-23740	SID24819230, BRD-K43909184	4309985	InChI=1S/C16H18N2O5S/c1-18(2)24(20,21)23-15-6-4-5-12(11-15)16(19)17-13-7-9-14(22-3)10-8-13/h4-11H,1-3H3,(H,17,19)	LUXUEXDAQBVPHW-UHFFFAOYSA-N	COc1ccc(NC(=O)c2cccc(OS(=O)(=O)N(C)C)c2)cc1	BroadT	BRD-K43909184	BRD-K43909184-001-05-3	Key Organics Ltd.	3F-310S			COc1ccc(NC(=O)c2cccc(OS(=O)(=O)N(C)C)c2)cc1	InChI=1S/C16H18N2O5S/c1-18(2)24(20,21)23-15-6-4-5-12(11-15)16(19)17-13-7-9-14(22-3)10-8-13/h4-11H,1-3H3,(H,17,19)	LUXUEXDAQBVPHW-UHFFFAOYSA-N	350.093642386							112328
N-[(2-Chloro-phenyl)-(2-hydroxy-naphthalen-1-yl)-methyl]-butyramide	LSM-23741	SID17505257, BRD-A62606688	2877094	InChI=1S/C21H20ClNO2/c1-2-7-19(25)23-21(16-10-5-6-11-17(16)22)20-15-9-4-3-8-14(15)12-13-18(20)24/h3-6,8-13,21,24H,2,7H2,1H3,(H,23,25)	ZNZNMOOJUMIKCL-UHFFFAOYSA-N	CCCC(=O)NC(c1ccccc1Cl)c2c(O)ccc3ccccc23	BroadT	BRD-A62606688	BRD-A62606688-001-05-4	Asinex Ltd.	BAS 01277948			CCCC(=O)NC(c1ccccc1Cl)c1c(O)ccc2ccccc12	InChI=1S/C21H20ClNO2/c1-2-7-19(25)23-21(16-10-5-6-11-17(16)22)20-15-9-4-3-8-14(15)12-13-18(20)24/h3-6,8-13,21,24H,2,7H2,1H3,(H,23,25)	ZNZNMOOJUMIKCL-UHFFFAOYSA-N	353.1182566							112329
SMR000031125	LSM-23742	SID4248927, BRD-K99995088	3242940	InChI=1S/C22H22N4O5S2/c1-13-10-18(25-31-13)24-19(27)12-33-22-23-15-7-9-32-20(15)21(28)26(22)8-6-14-4-5-16(29-2)17(11-14)30-3/h4-5,7,9-11H,6,8,12H2,1-3H3,(H,24,25,27)	MZIAIURGYCSNAG-UHFFFAOYSA-N	COc1ccc(CCN2C(=O)c3sccc3N=C2SCC(=O)Nc4cc(C)on4)cc1OC	BroadT	BRD-K99995088	BRD-K99995088-001-05-2	ChemDiv Inc.	K292-0739			COc1ccc(CCn2c(SCC(=O)Nc3cc(C)on3)nc3ccsc3c2=O)cc1OC	InChI=1S/C22H22N4O5S2/c1-13-10-18(25-31-13)24-19(27)12-33-22-23-15-7-9-32-20(15)21(28)26(22)8-6-14-4-5-16(29-2)17(11-14)30-3/h4-5,7,9-11H,6,8,12H2,1-3H3,(H,24,25,27)	MZIAIURGYCSNAG-UHFFFAOYSA-N	486.103161224							112330
SMR000023840	LSM-23743	SID24839088, SID4245509, BRD-K66708529	3239974	InChI=1S/C22H23ClN2O4S/c1-16(26)17-2-6-19(7-3-17)24-12-14-25(15-13-24)21(27)22(10-11-22)30(28,29)20-8-4-18(23)5-9-20/h2-9H,10-15H2,1H3	MZUHVPWGQTUABI-UHFFFAOYSA-N	CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)C3(CC3)S(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K66708529	BRD-K66708529-001-05-5	ChemDiv Inc.	C256-1520			CC(=O)c1ccc(cc1)N1CCN(CC1)C(=O)C1(CC1)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H23ClN2O4S/c1-16(26)17-2-6-19(7-3-17)24-12-14-25(15-13-24)21(27)22(10-11-22)30(28,29)20-8-4-18(23)5-9-20/h2-9H,10-15H2,1H3	MZUHVPWGQTUABI-UHFFFAOYSA-N	446.106705636							112331
AC1OAED8	LSM-23744	BRD-A45997690	6803389	InChI=1S/C16H13N3O6/c20-15-10(4-3-5-11(15)19(22)23)8-17-18-16(21)14-9-24-12-6-1-2-7-13(12)25-14/h1-8,14,20H,9H2,(H,18,21)	FTHRCKNDVXGPHI-UHFFFAOYSA-N	Oc1c(C=NNC(=O)C2COc3ccccc3O2)cccc1[N+](=O)[O-]	BroadT	BRD-A45997690	BRD-A45997690-001-05-5	ChemBridge Corporation	5249728			Oc1c(C=NNC(=O)C2COc3ccccc3O2)cccc1[N+]([O-])=O	InChI=1S/C16H13N3O6/c20-15-10(4-3-5-11(15)19(22)23)8-17-18-16(21)14-9-24-12-6-1-2-7-13(12)25-14/h1-8,14,20H,9H2,(H,18,21)	FTHRCKNDVXGPHI-UHFFFAOYSA-N	343.080435166							
ASN 04757089	LSM-23745	SID17505127, BRD-K48125437	1432356	InChI=1S/C24H29N3O3S/c1-15-10-16(2)19-13-18(23(28)26-20(19)11-15)14-27(24(31)25-3)9-8-17-6-7-21(29-4)22(12-17)30-5/h6-7,10-13H,8-9,14H2,1-5H3,(H,25,31)(H,26,28)	PUMAZULXMANVGK-UHFFFAOYSA-N	CNC(=S)N(CCc1ccc(OC)c(OC)c1)Cc2cc3c(C)cc(C)cc3nc2O	BroadT	BRD-K48125437	BRD-K48125437-001-05-6	Asinex Ltd.	ASN 04757089			CNC(=S)N(CCc1ccc(OC)c(OC)c1)Cc1cc2c(C)cc(C)cc2nc1O	InChI=1S/C24H29N3O3S/c1-15-10-16(2)19-13-18(23(28)26-20(19)11-15)14-27(24(31)25-3)9-8-17-6-7-21(29-4)22(12-17)30-5/h6-7,10-13H,8-9,14H2,1-5H3,(H,25,31)(H,26,28)	PUMAZULXMANVGK-UHFFFAOYSA-N	439.192962508							112333
ASN 05818908	LSM-23746	SID26669130, SID843962, BRD-K65118526	646268	InChI=1S/C27H27N5O2/c1-19-29-23-16-25(31-13-6-3-7-14-31)24(30-26(33)21-11-8-12-28-17-21)15-22(23)27(34)32(19)18-20-9-4-2-5-10-20/h2,4-5,8-12,15-17H,3,6-7,13-14,18H2,1H3,(H,30,33)	MTVKCPKOKLLYCE-UHFFFAOYSA-N	CC1=Nc2cc(N3CCCCC3)c(NC(=O)c4cccnc4)cc2C(=O)N1Cc5ccccc5	BroadT	BRD-K65118526	BRD-K65118526-001-05-1	Asinex Ltd.	ASN 05818908			Cc1nc2cc(N3CCCCC3)c(NC(=O)c3cccnc3)cc2c(=O)n1Cc1ccccc1	InChI=1S/C27H27N5O2/c1-19-29-23-16-25(31-13-6-3-7-14-31)24(30-26(33)21-11-8-12-28-17-21)15-22(23)27(34)32(19)18-20-9-4-2-5-10-20/h2,4-5,8-12,15-17H,3,6-7,13-14,18H2,1H3,(H,30,33)	MTVKCPKOKLLYCE-UHFFFAOYSA-N	453.216475154							112334
ZINC02064499	LSM-23747	SID24780044, BRD-K49713996	1728325	InChI=1S/C15H15N3O3S2/c1-11-7-9-12(10-8-11)14(19)16-15(22)17-18-23(20,21)13-5-3-2-4-6-13/h2-10,18H,1H3,(H2,16,17,19,22)	CFBLQGYTXNKODL-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)NC(=S)NNS(=O)(=O)c2ccccc2	BroadT	BRD-K49713996	BRD-K49713996-001-05-1	Asinex Ltd.	BAS 02136821			Cc1ccc(cc1)C(=O)NC(=S)NNS(=O)(=O)c1ccccc1	InChI=1S/C15H15N3O3S2/c1-11-7-9-12(10-8-11)14(19)16-15(22)17-18-23(20,21)13-5-3-2-4-6-13/h2-10,18H,1H3,(H2,16,17,19,22)	CFBLQGYTXNKODL-UHFFFAOYSA-N	349.05548275							112335
MLS000074218	LSM-23748	SID853135, BRD-K56947701	655787	InChI=1S/C18H19N3O2S2/c1-12-6-4-7-15(13(12)2)23-10-17-19-20-18(21(17)3)25-11-14(22)16-8-5-9-24-16/h4-9H,10-11H2,1-3H3	MRJMHSWLHWVYNV-UHFFFAOYSA-N	Cc1cccc(OCc2nnc(SCC(=O)c3cccs3)n2C)c1C	BroadT	BRD-K56947701	BRD-K56947701-001-05-1	Asinex Ltd.	ASN 03799269			Cc1cccc(OCc2nnc(SCC(=O)c3cccs3)n2C)c1C	InChI=1S/C18H19N3O2S2/c1-12-6-4-7-15(13(12)2)23-10-17-19-20-18(21(17)3)25-11-14(22)16-8-5-9-24-16/h4-9H,10-11H2,1-3H3	MRJMHSWLHWVYNV-UHFFFAOYSA-N	373.091868258							112336
AG-670/11901080	LSM-23749	SID7977035, BRD-K46982937	589406	InChI=1S/C16H13BrN4S/c1-21-14-5-3-2-4-12(14)18-15(21)9-22-16-19-11-7-6-10(17)8-13(11)20-16/h2-8H,9H2,1H3,(H,19,20)	WUNJIISHOMYHOP-UHFFFAOYSA-N	Cn1c(CSc2nc3cc(Br)ccc3[nH]2)nc4ccccc14	BroadT	BRD-K46982937	BRD-K46982937-001-05-7	ChemBridge Corporation	6739667			Cn1c(CSc2nc3cc(Br)ccc3[nH]2)nc2ccccc12	InChI=1S/C16H13BrN4S/c1-21-14-5-3-2-4-12(14)18-15(21)9-22-16-19-11-7-6-10(17)8-13(11)20-16/h2-8H,9H2,1H3,(H,19,20)	WUNJIISHOMYHOP-UHFFFAOYSA-N	372.004429746							112337
F3225-6409	LSM-23750	SID866036, BRD-K33742819	667297	InChI=1S/C21H18N2O4/c1-3-17-22-20-18(19(24)15-6-4-5-7-16(15)27-20)21(25)23(17)12-13-8-10-14(26-2)11-9-13/h4-11H,3,12H2,1-2H3	OUDFIOVNIWPUCQ-UHFFFAOYSA-N	CCC1=NC2=C(C(=O)N1Cc3ccc(OC)cc3)C(=O)c4ccccc4O2	BroadT	BRD-K33742819	BRD-K33742819-001-05-3	InterBioScreen Ltd.	STOCK5S-58660			CCc1nc2oc3ccccc3c(=O)c2c(=O)n1Cc1ccc(OC)cc1	InChI=1S/C21H18N2O4/c1-3-17-22-20-18(19(24)15-6-4-5-7-16(15)27-20)21(25)23(17)12-13-8-10-14(26-2)11-9-13/h4-11H,3,12H2,1-2H3	OUDFIOVNIWPUCQ-UHFFFAOYSA-N	362.126657076							112338
AC1M078L	LSM-23751	BRD-K24355197	1991915	InChI=1S/C21H20N8O4/c1-3-32-16-10-6-14(7-11-16)18-17(24-28-29(18)20-19(22)26-33-27-20)21(30)25-23-12-13-4-8-15(31-2)9-5-13/h4-12H,3H2,1-2H3,(H2,22,26)(H,25,30)	NKWPBRYGMGISJO-UHFFFAOYSA-N	CCOc1ccc(cc1)c2c(nnn2c3nonc3N)C(=O)NN=Cc4ccc(OC)cc4	BroadT	BRD-K24355197	BRD-K24355197-001-05-7	InterBioScreen Ltd.	STOCK4S-26240			CCOc1ccc(cc1)-c1c(nnn1-c1nonc1N)C(=O)NN=Cc1ccc(OC)cc1	InChI=1S/C21H20N8O4/c1-3-32-16-10-6-14(7-11-16)18-17(24-28-29(18)20-19(22)26-33-27-20)21(30)25-23-12-13-4-8-15(31-2)9-5-13/h4-12H,3H2,1-2H3,(H2,22,26)(H,25,30)	NKWPBRYGMGISJO-UHFFFAOYSA-N	448.1607512							112339
SMR000010235	LSM-23752	SID853693, BRD-K44146005	576797	InChI=1S/C11H11N3OS/c1-8-2-4-9(5-3-8)10(15)6-16-11-12-7-13-14-11/h2-5,7H,6H2,1H3,(H,12,13,14)	MUVSMNVNXKMPGC-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)CSc2nc[nH]n2	BroadT	BRD-K44146005	BRD-K44146005-001-05-8	Asinex Ltd.	BAS 01247559			Cc1ccc(cc1)C(=O)CSc1nc[nH]n1	InChI=1S/C11H11N3OS/c1-8-2-4-9(5-3-8)10(15)6-16-11-12-7-13-14-11/h2-5,7H,6H2,1H3,(H,12,13,14)	MUVSMNVNXKMPGC-UHFFFAOYSA-N	233.062282692							112340
MLS001030740	LSM-23753	SID49717032, SID24415789, BRD-K46369268	16034298	InChI=1S/C25H28N2O4S/c1-18-7-10-22(11-8-18)32(29,30)17-21-9-12-24(31-21)25(28)27-15-13-26(14-16-27)23-6-4-5-19(2)20(23)3/h4-12H,13-17H2,1-3H3	WKFVIGSICNRZHL-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)Cc2oc(cc2)C(=O)N3CCN(CC3)c4cccc(C)c4C	BroadT	BRD-K46369268	BRD-K46369268-001-07-2	ChemDiv Inc.	K788-6921			Cc1ccc(cc1)S(=O)(=O)Cc1ccc(o1)C(=O)N1CCN(CC1)c1cccc(C)c1C	InChI=1S/C25H28N2O4S/c1-18-7-10-22(11-8-18)32(29,30)17-21-9-12-24(31-21)25(28)27-15-13-26(14-16-27)23-6-4-5-19(2)20(23)3/h4-12H,13-17H2,1-3H3	WKFVIGSICNRZHL-UHFFFAOYSA-N	452.176978086							112341
BDBM38041	LSM-23754	BRD-A63464390	53455147	InChI=1S/C20H20N2O7S/c1-3-29-20(25)16-17(12-4-8-14(28-2)9-5-12)22(19(24)18(16)23)13-6-10-15(11-7-13)30(21,26)27/h4-11,16-17H,3H2,1-2H3,(H2,21,26,27)	ZZRBRAQBJIZHDC-UHFFFAOYSA-N	CCOC(=O)C1C(N(C(=O)C1=O)c2ccc(cc2)S(=O)(=O)N)c3ccc(OC)cc3	BroadT	BRD-A63464390	BRD-A63464390-001-05-6	InterBioScreen Ltd.	STOCK4S-47932			CCOC(=O)C1C(N(C(=O)C1=O)c1ccc(cc1)S(N)(=O)=O)c1ccc(OC)cc1	InChI=1S/C20H20N2O7S/c1-3-29-20(25)16-17(12-4-8-14(28-2)9-5-12)22(19(24)18(16)23)13-6-10-15(11-7-13)30(21,26)27/h4-11,16-17H,3H2,1-2H3,(H2,21,26,27)	ZZRBRAQBJIZHDC-UHFFFAOYSA-N	432.09912169							112342
F0748-0176	LSM-23755	SID24788518, BRD-K91229509	5053625	InChI=1S/C9H12N4OS4/c1-2-15-9-13-12-7(18-9)11-6(14)5-17-8-10-3-4-16-8/h2-5H2,1H3,(H,11,12,14)	GTFLXCAXPLCIGA-UHFFFAOYSA-N	CCSc1nnc(NC(=O)CSC2=NCCS2)s1	BroadT	BRD-K91229509	BRD-K91229509-001-06-3	Life Chemicals Inc.	F0748-0176			CCSc1nnc(NC(=O)CSC2=NCCS2)s1	InChI=1S/C9H12N4OS4/c1-2-15-9-13-12-7(18-9)11-6(14)5-17-8-10-3-4-16-8/h2-5H2,1H3,(H,11,12,14)	GTFLXCAXPLCIGA-UHFFFAOYSA-N	319.989393804							112343
ASN 09378802	LSM-23756	SID17508551, BRD-K08309090	3231104	InChI=1S/C19H17N5OS2/c1-11-3-5-14-15(7-11)23-18(22-14)13-4-6-17(20-8-13)26-10-16(25)24-19-21-12(2)9-27-19/h3-9H,10H2,1-2H3,(H,22,23)(H,21,24,25)	VCCOMOCJKDPJCU-UHFFFAOYSA-N	Cc1ccc2[nH]c(nc2c1)c3ccc(SCC(=O)Nc4nc(C)cs4)nc3	BroadT	BRD-K08309090	BRD-K08309090-001-06-0	Asinex Ltd.	ASN 09378802			Cc1csc(NC(=O)CSc2ccc(cn2)-c2nc3cc(C)ccc3[nH]2)n1	InChI=1S/C19H17N5OS2/c1-11-3-5-14-15(7-11)23-18(22-14)13-4-6-17(20-8-13)26-10-16(25)24-19-21-12(2)9-27-19/h3-9H,10H2,1-2H3,(H,22,23)(H,21,24,25)	VCCOMOCJKDPJCU-UHFFFAOYSA-N	395.087451594							112344
1-(4-Fluorophenyl)-n-methyl-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide	LSM-23757	SID24814236, BRD-A72713024	3370799	InChI=1S/C15H16FN3S/c1-17-15(20)19-10-9-18-8-2-3-13(18)14(19)11-4-6-12(16)7-5-11/h2-8,14H,9-10H2,1H3,(H,17,20)	SRMOWRGHSFUUDT-UHFFFAOYSA-N	CN=C(S)N1CCn2cccc2C1c3ccc(F)cc3	BroadT	BRD-A72713024	BRD-A72713024-001-05-9	ChemDiv Inc.	K416-0001			CN=C(S)N1CCn2cccc2C1c1ccc(F)cc1	InChI=1S/C15H16FN3S/c1-17-15(20)19-10-9-18-8-2-3-13(18)14(19)11-4-6-12(16)7-5-11/h2-8,14H,9-10H2,1H3,(H,17,20)	SRMOWRGHSFUUDT-UHFFFAOYSA-N	289.104896432							112345
2-Methyl-1,4-bis(2-thienylcarbonyl)piperazine	LSM-23758	SID4265205, BRD-A55734193	2896965	InChI=1S/C15H16N2O2S2/c1-11-10-16(14(18)12-4-2-8-20-12)6-7-17(11)15(19)13-5-3-9-21-13/h2-5,8-9,11H,6-7,10H2,1H3	UGLJUNYHYBZBAO-UHFFFAOYSA-N	CC1CN(CCN1C(=O)c2cccs2)C(=O)c3cccs3	BroadT	BRD-A55734193	BRD-A55734193-001-05-1	ChemBridge Corporation	6401114			CC1CN(CCN1C(=O)c1cccs1)C(=O)c1cccs1	InChI=1S/C15H16N2O2S2/c1-11-10-16(14(18)12-4-2-8-20-12)6-7-17(11)15(19)13-5-3-9-21-13/h2-5,8-9,11H,6-7,10H2,1H3	UGLJUNYHYBZBAO-UHFFFAOYSA-N	320.065319152							112346
ASN 03365103	LSM-23759	SID24801680, BRD-K35666708	1136804	InChI=1S/C20H27N3OS/c1-4-21-20(25)23(16-7-5-6-8-16)12-15-11-17-13(2)9-10-14(3)18(17)22-19(15)24/h9-11,16H,4-8,12H2,1-3H3,(H,21,25)(H,22,24)	PUZKXPUPMZWDLM-UHFFFAOYSA-N	CCN=C(S)N(Cc1cc2c(C)ccc(C)c2nc1O)C3CCCC3	BroadT	BRD-K35666708	BRD-K35666708-001-05-6	Asinex Ltd.	ASN 03365103			CCN=C(S)N(Cc1cc2c(C)ccc(C)c2nc1O)C1CCCC1	InChI=1S/C20H27N3OS/c1-4-21-20(25)23(16-7-5-6-8-16)12-15-11-17-13(2)9-10-14(3)18(17)22-19(15)24/h9-11,16H,4-8,12H2,1-3H3,(H,21,25)(H,22,24)	PUZKXPUPMZWDLM-UHFFFAOYSA-N	357.187483204							112347
4-(4-Fluorophenyl)-1,3-thiazole-2-thiol	LSM-23760	SID24827915, BRD-K83061778	716719	InChI=1S/C9H6FNS2/c10-7-3-1-6(2-4-7)8-5-13-9(12)11-8/h1-5H,(H,11,12)	MWMWTZPSWBGHNI-UHFFFAOYSA-N	Fc1ccc(cc1)c2csc(S)n2	BroadT	BRD-K83061778	BRD-K83061778-001-05-6	Enamine Ltd.	T0520-6494			Fc1ccc(cc1)-c1csc(S)n1	InChI=1S/C9H6FNS2/c10-7-3-1-6(2-4-7)8-5-13-9(12)11-8/h1-5H,(H,11,12)	MWMWTZPSWBGHNI-UHFFFAOYSA-N	210.992568782							112348
T5288585	LSM-23761	SID16953699, BRD-K46432246	2500305	InChI=1S/C22H27N3O5S/c1-16-3-4-17(2)21(13-16)31(27,28)25-9-7-24(8-10-25)15-22(26)23-18-5-6-19-20(14-18)30-12-11-29-19/h3-6,13-14H,7-12,15H2,1-2H3,(H,23,26)	LKZBZSWEFWYORE-UHFFFAOYSA-N	Cc1ccc(C)c(c1)S(=O)(=O)N2CCN(CC(=O)Nc3ccc4OCCOc4c3)CC2	BroadT	BRD-K46432246	BRD-K46432246-001-05-9	Enamine Ltd.	T5288585			Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC(=O)Nc2ccc3OCCOc3c2)CC1	InChI=1S/C22H27N3O5S/c1-16-3-4-17(2)21(13-16)31(27,28)25-9-7-24(8-10-25)15-22(26)23-18-5-6-19-20(14-18)30-12-11-29-19/h3-6,13-14H,7-12,15H2,1-2H3,(H,23,26)	LKZBZSWEFWYORE-UHFFFAOYSA-N	445.167141684							112349
AC1LUTZW	LSM-23762	BRD-K42388113	1617457	InChI=1S/C29H26N6O2S/c1-19-7-11-21(12-8-19)17-35-18-23(24-5-3-4-6-25(24)35)16-30-32-26(36)15-27-33-34-29(38-27)31-28(37)22-13-9-20(2)10-14-22/h3-14,16,18H,15,17H2,1-2H3,(H,32,36)(H,31,34,37)	FCFIMGYJKSFKSJ-UHFFFAOYSA-N	Cc1ccc(Cn2cc(C=NNC(=O)Cc3nnc(NC(=O)c4ccc(C)cc4)s3)c5ccccc25)cc1	BroadT	BRD-K42388113	BRD-K42388113-001-06-5	InterBioScreen Ltd.	STOCK2S-49709			Cc1ccc(Cn2cc(C=NNC(=O)Cc3nnc(NC(=O)c4ccc(C)cc4)s3)c3ccccc23)cc1	InChI=1S/C29H26N6O2S/c1-19-7-11-21(12-8-19)17-35-18-23(24-5-3-4-6-25(24)35)16-30-32-26(36)15-27-33-34-29(38-27)31-28(37)22-13-9-20(2)10-14-22/h3-14,16,18H,15,17H2,1-2H3,(H,32,36)(H,31,34,37)	FCFIMGYJKSFKSJ-UHFFFAOYSA-N	522.183794822							112350
Ambunol	LSM-23763	Ambunol	612906	InChI=1S/C19H33NO3/c1-18(2,3)15-11-14(13-20(7-9-21)8-10-22)12-16(17(15)23)19(4,5)6/h11-12,21-23H,7-10,13H2,1-6H3	WUXCIWVRVOPALZ-UHFFFAOYSA-N	CC(C)(C)c1cc(CN(CCO)CCO)cc(c1O)C(C)(C)C	BroadT	BRD-K35601142	BRD-K35601142-001-06-5	ChemBridge Corporation	5243661			CC(C)(C)c1cc(CN(CCO)CCO)cc(c1O)C(C)(C)C	InChI=1S/C19H33NO3/c1-18(2,3)15-11-14(13-20(7-9-21)8-10-22)12-16(17(15)23)19(4,5)6/h11-12,21-23H,7-10,13H2,1-6H3	WUXCIWVRVOPALZ-UHFFFAOYSA-N	323.246043926							112351
T0509-9462	LSM-23764	SID3715107, BRD-K69556030	2369627	InChI=1S/C18H19FN2O3S2/c1-3-21(4-2)26(22,23)15-9-10-17-16(11-15)20-18(24-17)25-12-13-5-7-14(19)8-6-13/h5-11H,3-4,12H2,1-2H3	NDZYDBLDEGHKTQ-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc2oc(SCc3ccc(F)cc3)nc2c1	BroadT	BRD-K69556030	BRD-K69556030-001-05-7	Enamine Ltd.	T0509-9462			CCN(CC)S(=O)(=O)c1ccc2oc(SCc3ccc(F)cc3)nc2c1	InChI=1S/C18H19FN2O3S2/c1-3-21(4-2)26(22,23)15-9-10-17-16(11-15)20-18(24-17)25-12-13-5-7-14(19)8-6-13/h5-11H,3-4,12H2,1-2H3	NDZYDBLDEGHKTQ-UHFFFAOYSA-N	394.082112068							112352
STK058932	LSM-23765	SID22415664, BRD-K00891298	881509	InChI=1S/C16H13ClN2O2S/c1-10(20)11-4-3-7-14(9-11)18-16(22)19-15(21)12-5-2-6-13(17)8-12/h2-9H,1H3,(H2,18,19,21,22)	BXNQHLNGPJLMLN-UHFFFAOYSA-N	CC(=O)c1cccc(NC(=S)NC(=O)c2cccc(Cl)c2)c1	BroadT	BRD-K00891298	BRD-K00891298-001-05-7	ChemBridge Corporation	6397281			CC(=O)c1cccc(NC(=S)NC(=O)c2cccc(Cl)c2)c1	InChI=1S/C16H13ClN2O2S/c1-10(20)11-4-3-7-14(9-11)18-16(22)19-15(21)12-5-2-6-13(17)8-12/h2-9H,1H3,(H2,18,19,21,22)	BXNQHLNGPJLMLN-UHFFFAOYSA-N	332.038626076							112353
T0508-7191	LSM-23766	SID3716582, BRD-K50229096	2353746	InChI=1S/C15H11NO4S2/c17-14-10-5-1-2-7-13(10)22(19,20)16(14)15(18)12-8-9-4-3-6-11(9)21-12/h1-2,5,7-8H,3-4,6H2	FVIFHSHIDLMOJH-UHFFFAOYSA-N	O=C(N1C(=O)c2ccccc2S1(=O)=O)c3cc4CCCc4s3	BroadT	BRD-K50229096	BRD-K50229096-001-06-1	Enamine Ltd.	T0508-7191			O=C(N1C(=O)c2ccccc2S1(=O)=O)c1cc2CCCc2s1	InChI=1S/C15H11NO4S2/c17-14-10-5-1-2-7-13(10)22(19,20)16(14)15(18)12-8-9-4-3-6-11(9)21-12/h1-2,5,7-8H,3-4,6H2	FVIFHSHIDLMOJH-UHFFFAOYSA-N	333.012949222							112354
AC1LD9Z3	LSM-15353	BRD-A02126215	663669	InChI=1S/C18H21N3O/c1-3-15-19-16-13-8-4-5-9-14(13)22-17(16)18(20-15)21-10-6-7-12(2)11-21/h4-5,8-9,12H,3,6-7,10-11H2,1-2H3	KKDYLHGEMMJKFV-UHFFFAOYSA-N	CCc1nc(N2CCCC(C)C2)c3oc4ccccc4c3n1	BroadT	BRD-A02126215	BRD-A02126215-003-05-4	InterBioScreen Ltd.	STOCK4S-43709		Cl	CCc1nc(N2CCCC(C)C2)c2oc3ccccc3c2n1.Cl	InChI=1S/C18H21N3O.ClH/c1-3-15-19-16-13-8-4-5-9-14(13)22-17(16)18(20-15)21-10-6-7-12(2)11-21;/h4-5,8-9,12H,3,6-7,10-11H2,1-2H3;1H	CLNPXYYRYVXBDU-UHFFFAOYSA-N	295.168462322							103999, 103999
ZINC03313997	LSM-23767	SID24837082, BRD-K85779937	2429767	InChI=1S/C21H23N3O2/c25-18-8-6-17(7-9-18)23-11-13-24(14-12-23)21(26)10-5-16-15-22-20-4-2-1-3-19(16)20/h1-4,6-9,15,22,25H,5,10-14H2	SQOASKBWAGOZIY-UHFFFAOYSA-N	Oc1ccc(cc1)N2CCN(CC2)C(=O)CCc3c[nH]c4ccccc34	BroadT	BRD-K85779937	BRD-K85779937-001-05-9	Enamine Ltd.	T0516-0323			Oc1ccc(cc1)N1CCN(CC1)C(=O)CCc1c[nH]c2ccccc12	InChI=1S/C21H23N3O2/c25-18-8-6-17(7-9-18)23-11-13-24(14-12-23)21(26)10-5-16-15-22-20-4-2-1-3-19(16)20/h1-4,6-9,15,22,25H,5,10-14H2	SQOASKBWAGOZIY-UHFFFAOYSA-N	349.179027006							112355
AC1O9TCR	LSM-23768	SID17505634, BRD-K13111496	6771676	InChI=1S/C23H22N6O4S/c1-13-4-9-21(30)18(10-13)19-12-20(28-27-19)22(31)26-16-5-7-17(8-6-16)34(32,33)29-23-24-14(2)11-15(3)25-23/h4-12,30H,1-3H3,(H,26,31)(H,27,28)(H,24,25,29)	VHKNTWVPKWHNTB-UHFFFAOYSA-N	Cc1ccc(O)c(c1)c2cc([nH]n2)C(=O)Nc3ccc(cc3)S(=O)(=O)Nc4nc(C)cc(C)n4	BroadT	BRD-K13111496	BRD-K13111496-001-06-3	InterBioScreen Ltd.	STOCK5S-38316			Cc1ccc(O)c(c1)-c1cc([nH]n1)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(C)n1	InChI=1S/C23H22N6O4S/c1-13-4-9-21(30)18(10-13)19-12-20(28-27-19)22(31)26-16-5-7-17(8-6-16)34(32,33)29-23-24-14(2)11-15(3)25-23/h4-12,30H,1-3H3,(H,26,31)(H,27,28)(H,24,25,29)	VHKNTWVPKWHNTB-UHFFFAOYSA-N	478.142323934							
SMR000236229	LSM-23769	SID17514919, BRD-K82641815	6622210	InChI=1S/C16H16N2O3S2/c1-4-21-15(19)14-9(2)7-13(23-14)18-16-17-11-6-5-10(20-3)8-12(11)22-16/h5-8H,4H2,1-3H3,(H,17,18)	MDPIEEVCGADTQR-UHFFFAOYSA-N	CCOC(=O)c1sc(Nc2nc3ccc(OC)cc3s2)cc1C	BroadT	BRD-K82641815	BRD-K82641815-001-08-5	Life Chemicals Inc.	F0646-3529			CCOC(=O)c1sc(Nc2nc3ccc(OC)cc3s2)cc1C	InChI=1S/C16H16N2O3S2/c1-4-21-15(19)14-9(2)7-13(23-14)18-16-17-11-6-5-10(20-3)8-12(11)22-16/h5-8H,4H2,1-3H3,(H,17,18)	MDPIEEVCGADTQR-UHFFFAOYSA-N	348.060233772							112357
3,4,5-Trimethoxy-n-{[2-(morpholin-4-yl)phenyl]carbamothioyl}benzamide	LSM-23770	SID49825403, BRD-K66655179	1963075	InChI=1S/C21H25N3O5S/c1-26-17-12-14(13-18(27-2)19(17)28-3)20(25)23-21(30)22-15-6-4-5-7-16(15)24-8-10-29-11-9-24/h4-7,12-13H,8-11H2,1-3H3,(H2,22,23,25,30)	OYOIKXDDLOHQJX-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)NC(=S)Nc2ccccc2N3CCOCC3	BroadT	BRD-K66655179	BRD-K66655179-001-05-1	ChemBridge Corporation	7981362			COc1cc(cc(OC)c1OC)C(=O)NC(=S)Nc1ccccc1N1CCOCC1	InChI=1S/C21H25N3O5S/c1-26-17-12-14(13-18(27-2)19(17)28-3)20(25)23-21(30)22-15-6-4-5-7-16(15)24-8-10-29-11-9-24/h4-7,12-13H,8-11H2,1-3H3,(H2,22,23,25,30)	OYOIKXDDLOHQJX-UHFFFAOYSA-N	431.15149162							112358
SMR000620919	LSM-23771	SID49735120, BRD-K47933790	24793638	InChI=1S/C30H31N5O6/c1-39-20-12-13-24(26(18-20)41-3)35-30(38)22-9-5-4-8-21(22)28(32-35)29(37)31-19-27(36)34-16-14-33(15-17-34)23-10-6-7-11-25(23)40-2/h4-13,18H,14-17,19H2,1-3H3,(H,31,37)	ONFHAGVOCAIGTK-UHFFFAOYSA-N	COc1ccc(N2N=C(C(=O)NCC(=O)N3CCN(CC3)c4ccccc4OC)c5ccccc5C2=O)c(OC)c1	BroadT	BRD-K47933790	BRD-K47933790-001-05-5	ChemDiv Inc.	C066-0127			COc1ccc(c(OC)c1)-n1nc(C(=O)NCC(=O)N2CCN(CC2)c2ccccc2OC)c2ccccc2c1=O	InChI=1S/C30H31N5O6/c1-39-20-12-13-24(26(18-20)41-3)35-30(38)22-9-5-4-8-21(22)28(32-35)29(37)31-19-27(36)34-16-14-33(15-17-34)23-10-6-7-11-25(23)40-2/h4-13,18H,14-17,19H2,1-3H3,(H,31,37)	ONFHAGVOCAIGTK-UHFFFAOYSA-N	557.227433762							112359
AC1M2C4V	LSM-23772	SID22409749, BRD-K44849349	2114516	InChI=1S/C22H20N4O4S2/c1-4-8-26-20(28)15-10-13(5-2)32-19(15)25-22(26)31-11-17-23-16-9-12(21(29)30-3)6-7-14(16)18(27)24-17/h4,6-7,9-10H,1,5,8,11H2,2-3H3,(H,23,24,27)	HKQJIGWKJAKGMB-UHFFFAOYSA-N	CCc1cc2C(=O)N(CC=C)C(=Nc2s1)SCc3nc(O)c4ccc(cc4n3)C(=O)OC	BroadT	BRD-K44849349	BRD-K44849349-001-05-2	Enamine Ltd.	T5271908			CCc1cc2c(nc(SCc3nc(O)c4ccc(cc4n3)C(=O)OC)n(CC=C)c2=O)s1	InChI=1S/C22H20N4O4S2/c1-4-8-26-20(28)15-10-13(5-2)32-19(15)25-22(26)31-11-17-23-16-9-12(21(29)30-3)6-7-14(16)18(27)24-17/h4,6-7,9-10H,1,5,8,11H2,2-3H3,(H,23,24,27)	HKQJIGWKJAKGMB-UHFFFAOYSA-N	468.09259654							112360
STK362875	LSM-23773	SID848442, SID4258296, BRD-K66837299	650884	InChI=1S/C17H17N5OS/c1-11-3-4-14(9-12(11)2)19-15(23)10-24-17-20-16(21-22-17)13-5-7-18-8-6-13/h3-9H,10H2,1-2H3,(H,19,23)(H,20,21,22)	MLSGAEHCRDQLAR-UHFFFAOYSA-N	Cc1ccc(NC(=O)CSc2n[nH]c(n2)c3ccncc3)cc1C	BroadT	BRD-K66837299	BRD-K66837299-001-04-3	ChemBridge Corporation	7696646			Cc1ccc(NC(=O)CSc2nnc([nH]2)-c2ccncc2)cc1C	InChI=1S/C17H17N5OS/c1-11-3-4-14(9-12(11)2)19-15(23)10-24-17-20-16(21-22-17)13-5-7-18-8-6-13/h3-9H,10H2,1-2H3,(H,19,23)(H,20,21,22)	MLSGAEHCRDQLAR-UHFFFAOYSA-N	339.115380904							112361
MLS000559855	LSM-23774	SID26663995, BRD-K72294294	848267	InChI=1S/C19H22N2OS/c22-15-14-20-10-12-21(13-11-20)19(23)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,22H,10-15H2	BIMYXEOPJWEXBJ-UHFFFAOYSA-N	OCCN1CCN(CC1)C(=S)c2ccc(cc2)c3ccccc3	BroadT	BRD-K72294294	BRD-K72294294-001-06-9	InterBioScreen Ltd.	STOCK4S-02262			OCCN1CCN(CC1)C(=S)c1ccc(cc1)-c1ccccc1	InChI=1S/C19H22N2OS/c22-15-14-20-10-12-21(13-11-20)19(23)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,22H,10-15H2	BIMYXEOPJWEXBJ-UHFFFAOYSA-N	326.145284034							112362
SMR000042541	LSM-23775	SID860698, BRD-A26616161	661975	InChI=1S/C24H23N3O4/c1-15-13-18-20(23(28)27(15)12-10-16-7-4-3-5-8-16)19(17-9-6-11-26-14-17)21(22(25)31-18)24(29)30-2/h3-9,11,13-14,19H,10,12,25H2,1-2H3	ZXWPSQHMWUTNIF-UHFFFAOYSA-N	COC(=O)C1=C(N)OC2=C(C1c3cccnc3)C(=O)N(CCc4ccccc4)C(=C2)C	BroadT	BRD-A26616161	BRD-A26616161-001-05-4	InterBioScreen Ltd.	STOCK3S-85332			COC(=O)C1=C(N)Oc2cc(C)n(CCc3ccccc3)c(=O)c2C1c1cccnc1	InChI=1S/C24H23N3O4/c1-15-13-18-20(23(28)27(15)12-10-16-7-4-3-5-8-16)19(17-9-6-11-26-14-17)21(22(25)31-18)24(29)30-2/h3-9,11,13-14,19H,10,12,25H2,1-2H3	ZXWPSQHMWUTNIF-UHFFFAOYSA-N	417.168856246							112363
AC1MEWDI	LSM-23776	BRD-A17970083	2885283	InChI=1S/C26H20N2O4S2/c1-2-32-25(31)21-22(17-7-4-3-5-8-17)27-26-28(23(21)19-9-6-14-33-19)24(30)20(34-26)15-16-10-12-18(29)13-11-16/h3-15,23,29H,2H2,1H3	GHLKYWPBYZWXMD-UHFFFAOYSA-N	CCOC(=O)C1=C(N=C2SC(=Cc3ccc(O)cc3)C(=O)N2C1c4cccs4)c5ccccc5	BroadT	BRD-A17970083	BRD-A17970083-001-05-1	ChemBridge Corporation	6085121			CCOC(=O)C1=C(N=c2sc(=Cc3ccc(O)cc3)c(=O)n2C1c1cccs1)c1ccccc1	InChI=1S/C26H20N2O4S2/c1-2-32-25(31)21-22(17-7-4-3-5-8-17)27-26-28(23(21)19-9-6-14-33-19)24(30)20(34-26)15-16-10-12-18(29)13-11-16/h3-15,23,29H,2H2,1H3	GHLKYWPBYZWXMD-UHFFFAOYSA-N	488.08644852							112364
AN-979/41971079	LSM-44012	SID17387029, BRD-K63298572	6284238	InChI=1S/C19H18BrNO3/c1-3-19(23)21-16-6-4-5-13(12-16)17(22)9-7-14-11-15(20)8-10-18(14)24-2/h4-12H,3H2,1-2H3,(H,21,23)/b9-7+	WZRZUAQHORWSBK-VQHVLOKHSA-N	CCC(=O)Nc1cccc(c1)C(=O)\C=C\c2cc(Br)ccc2OC	BroadT	BRD-K63298572	BRD-K63298572-001-05-6	Specs	AN-979/41971079			CCC(=O)Nc1cccc(c1)C(=O)\C=C\c1cc(Br)ccc1OC	InChI=1S/C19H18BrNO3/c1-3-19(23)21-16-6-4-5-13(12-16)17(22)9-7-14-11-15(20)8-10-18(14)24-2/h4-12H,3H2,1-2H3,(H,21,23)/b9-7+	WZRZUAQHORWSBK-VQHVLOKHSA-N	387.047006046							
SMR000075577	LSM-23778	SID104219209, SID4260666, BRD-K44122401	2200557	InChI=1S/C18H19N3O2S2/c22-15(19-9-12-5-4-8-23-12)10-24-17-16-13-6-2-1-3-7-14(13)25-18(16)21-11-20-17/h4-5,8,11H,1-3,6-7,9-10H2,(H,19,22)	PINMPMJWIPJTKZ-UHFFFAOYSA-N	O=C(CSc1ncnc2sc3CCCCCc3c12)NCc4occc4	BroadT	BRD-K44122401	BRD-K44122401-001-06-7	ChemBridge Corporation	7734858			O=C(CSc1ncnc2sc3CCCCCc3c12)NCc1ccco1	InChI=1S/C18H19N3O2S2/c22-15(19-9-12-5-4-8-23-12)10-24-17-16-13-6-2-1-3-7-14(13)25-18(16)21-11-20-17/h4-5,8,11H,1-3,6-7,9-10H2,(H,19,22)	PINMPMJWIPJTKZ-UHFFFAOYSA-N	373.091868258							112366
ASN 06532832	LSM-23779	SID17408010, BRD-K39458989	1442646	InChI=1S/C22H23N3OS/c1-2-7-20-23-19-11-6-5-10-18(19)22(24-20)27-15-21(26)25-13-12-16-8-3-4-9-17(16)14-25/h3-6,8-11H,2,7,12-15H2,1H3	FIIBZXMENRGGGM-UHFFFAOYSA-N	CCCc1nc(SCC(=O)N2CCc3ccccc3C2)c4ccccc4n1	BroadT	BRD-K39458989	BRD-K39458989-001-06-2	Asinex Ltd.	ASN 06532832			CCCc1nc(SCC(=O)N2CCc3ccccc3C2)c2ccccc2n1	InChI=1S/C22H23N3OS/c1-2-7-20-23-19-11-6-5-10-18(19)22(24-20)27-15-21(26)25-13-12-16-8-3-4-9-17(16)14-25/h3-6,8-11H,2,7,12-15H2,1H3	FIIBZXMENRGGGM-UHFFFAOYSA-N	377.156183076							112367
MLS000545779	LSM-44013	SID17387646, BRD-K65489619	903944	InChI=1S/C16H20N2OS/c1-16(2,3)13-7-4-12(5-8-13)6-9-14(19)18-15-17-10-11-20-15/h4-9H,10-11H2,1-3H3,(H,17,18,19)/b9-6+	MKBNQMCQEMJHFS-RMKNXTFCSA-N	CC(C)(C)c1ccc(\C=C\C(=O)NC2=NCCS2)cc1	BroadT	BRD-K65489619	BRD-K65489619-001-06-2	Specs	AK-968/15254537			CC(C)(C)c1ccc(cc1)\C=C\C(=O)NC1=NCCS1	InChI=1S/C16H20N2OS/c1-16(2,3)13-7-4-12(5-8-13)6-9-14(19)18-15-17-10-11-20-15/h4-9H,10-11H2,1-3H3,(H,17,18,19)/b9-6+	MKBNQMCQEMJHFS-RMKNXTFCSA-N	288.12963397							
ASN 05553140	LSM-15354	BRD-A87909953	648513	InChI=1S/C26H36N6O3/c1-7-26(2,3)32-25(27-28-29-32)24(19-8-13-22(34-5)23(18-19)35-6)31-16-14-30(15-17-31)20-9-11-21(33-4)12-10-20/h8-13,18,24H,7,14-17H2,1-6H3	RXFIUWUHIJWINV-UHFFFAOYSA-N	CCC(C)(C)n1nnnc1C(N2CCN(CC2)c3ccc(OC)cc3)c4ccc(OC)c(OC)c4	BroadT	BRD-A87909953	BRD-A87909953-003-05-7	Asinex Ltd.	ASN 05553140		Cl	CCC(C)(C)n1nnnc1C(N1CCN(CC1)c1ccc(OC)cc1)c1ccc(OC)c(OC)c1.Cl	InChI=1S/C26H36N6O3.ClH/c1-7-26(2,3)32-25(27-28-29-32)24(19-8-13-22(34-5)23(18-19)35-6)31-16-14-30(15-17-31)20-9-11-21(33-4)12-10-20;/h8-13,18,24H,7,14-17H2,1-6H3;1H	LGCVGTBSFLMVTJ-UHFFFAOYSA-N	480.284889072							104000, 104000
MLS000420247	LSM-23781	BRD-K83897129	4050208	InChI=1S/C17H16N2O3S/c1-19-12-6-4-5-7-15(12)23-17(19)18-16(20)11-8-9-13(21-2)14(10-11)22-3/h4-10H,1-3H3	NGGPXBKSMWABFK-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)N=C2Sc3ccccc3N2C	BroadT	BRD-K83897129	BRD-K83897129-001-05-9	Life Chemicals Inc.	F0174-0180			COc1ccc(cc1OC)C(=O)N=c1sc2ccccc2n1C	InChI=1S/C17H16N2O3S/c1-19-12-6-4-5-7-15(12)23-17(19)18-16(20)11-8-9-13(21-2)14(10-11)22-3/h4-10H,1-3H3	NGGPXBKSMWABFK-UHFFFAOYSA-N	328.088163082							112369
AK-968/41025062	LSM-23782	SID17401452, BRD-A31650268	4153503	InChI=1S/C22H23ClN4O4S2/c1-3-30-21(29)18-15-6-4-12(2)8-17(15)33-20(18)26-22(32)25-19(28)16-7-5-14(31-16)11-27-10-13(23)9-24-27/h5,7,9-10,12H,3-4,6,8,11H2,1-2H3,(H2,25,26,28,32)	UBMMPWIYJFDHNY-UHFFFAOYSA-N	CCOC(=O)c1c2CCC(C)Cc2sc1NC(=S)NC(=O)c3oc(Cn4cc(Cl)cn4)cc3	BroadT	BRD-A31650268	BRD-A31650268-001-05-8	Specs	AK-968/41025062			CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(Cn3cc(Cl)cn3)o2)sc2CC(C)CCc12	InChI=1S/C22H23ClN4O4S2/c1-3-30-21(29)18-15-6-4-12(2)8-17(15)33-20(18)26-22(32)25-19(28)16-7-5-14(31-16)11-27-10-13(23)9-24-27/h5,7,9-10,12H,3-4,6,8,11H2,1-2H3,(H2,25,26,28,32)	UBMMPWIYJFDHNY-UHFFFAOYSA-N	506.084924346							112370
F0608-0428	LSM-23783	SID24788825, BRD-K75175199	5083850	InChI=1S/C15H14N4O5S/c1-19(2)25(21,22)11-7-5-10(6-8-11)13(20)16-15-18-17-14(24-15)12-4-3-9-23-12/h3-9H,1-2H3,(H,16,18,20)	FVZYVMXFUJYLAW-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc2oc(nn2)c3occc3	BroadT	BRD-K75175199	BRD-K75175199-001-05-5	Life Chemicals Inc.	F0608-0428			CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(o1)-c1ccco1	InChI=1S/C15H14N4O5S/c1-19(2)25(21,22)11-7-5-10(6-8-11)13(20)16-15-18-17-14(24-15)12-4-3-9-23-12/h3-9H,1-2H3,(H,16,18,20)	FVZYVMXFUJYLAW-UHFFFAOYSA-N	362.068490278							112371
STK177262	LSM-23784	SID844266, BRD-K64531535	621946	InChI=1S/C12H16N4O3/c1-15-9-8(10(17)16(2)11(15)18)14-19-12(13-9)6-4-3-5-7-12/h3-7H2,1-2H3	GXETZCPEKGYDMN-UHFFFAOYSA-N	CN1C(=O)N(C)C2=NC3(CCCCC3)ON=C2C1=O	BroadT	BRD-K64531535	BRD-K64531535-001-05-5	Asinex Ltd.	BAS 00792908			Cn1c(=O)n(C)c2=NC3(CCCCC3)ON=c2c1=O	InChI=1S/C12H16N4O3/c1-15-9-8(10(17)16(2)11(15)18)14-19-12(13-9)6-4-3-5-7-12/h3-7H2,1-2H3	GXETZCPEKGYDMN-UHFFFAOYSA-N	264.122240412							112372
ST50837294	LSM-23785	SID24792984, BRD-K46915789	970899	InChI=1S/C16H17N3O6/c1-23-13-7-5-11(19(21)22)9-12(13)18-16(20)17-10-4-6-14(24-2)15(8-10)25-3/h4-9H,1-3H3,(H2,17,18,20)	DQPSJZHROBMDGZ-UHFFFAOYSA-N	COc1ccc(cc1NC(=O)Nc2ccc(OC)c(OC)c2)[N+](=O)[O-]	BroadT	BRD-K46915789	BRD-K46915789-001-05-6	ChemBridge Corporation	7808263			COc1ccc(cc1NC(=O)Nc1ccc(OC)c(OC)c1)[N+]([O-])=O	InChI=1S/C16H17N3O6/c1-23-13-7-5-11(19(21)22)9-12(13)18-16(20)17-10-4-6-14(24-2)15(8-10)25-3/h4-9H,1-3H3,(H2,17,18,20)	DQPSJZHROBMDGZ-UHFFFAOYSA-N	347.111735294							112373
AC1N3V1J	LSM-23786	BRD-K63586469	4118671	InChI=1S/C16H13ClN2O4/c1-9(10-2-5-14-15(6-10)23-8-22-14)18-19-11-3-4-13(17)12(7-11)16(20)21/h2-7,19H,8H2,1H3,(H,20,21)	IHSBQUNDZINXHS-UHFFFAOYSA-N	CC(=NNc1ccc(Cl)c(c1)C(=O)O)c2ccc3OCOc3c2	BroadT	BRD-K63586469	BRD-K63586469-001-05-0	Enamine Ltd.	T0506-8129			CC(=NNc1ccc(Cl)c(c1)C(O)=O)c1ccc2OCOc2c1	InChI=1S/C16H13ClN2O4/c1-9(10-2-5-14-15(6-10)23-8-22-14)18-19-11-3-4-13(17)12(7-11)16(20)21/h2-7,19H,8H2,1H3,(H,20,21)	IHSBQUNDZINXHS-UHFFFAOYSA-N	332.056384626							112374
MLS000709699	LSM-23787	SID24819079, BRD-A79846938	3224048	InChI=1S/C22H32N4OS/c1-15-12-19-20(13-16(15)2)25-21(24-19)9-10-26(17-6-3-4-7-17)22(28)23-14-18-8-5-11-27-18/h12-13,17-18H,3-11,14H2,1-2H3,(H,23,28)(H,24,25)	NKMVYFQPPRRHFR-UHFFFAOYSA-N	Cc1cc2nc(CCN(C3CCCC3)C(=NCC4CCCO4)S)[nH]c2cc1C	BroadT	BRD-A79846938	BRD-A79846938-001-06-3	Asinex Ltd.	ASN 06610405			Cc1cc2nc(CCN(C3CCCC3)C(S)=NCC3CCCO3)[nH]c2cc1C	InChI=1S/C22H32N4OS/c1-15-12-19-20(13-16(15)2)25-21(24-19)9-10-26(17-6-3-4-7-17)22(28)23-14-18-8-5-11-27-18/h12-13,17-18H,3-11,14H2,1-2H3,(H,23,28)(H,24,25)	NKMVYFQPPRRHFR-UHFFFAOYSA-N	400.229682374							112375
MLS000096057	LSM-23788	SID4243466, BRD-K45418850	3238185	InChI=1S/C16H22N2O/c1-12(2)17-16(19)10-6-7-13-11-18(3)15-9-5-4-8-14(13)15/h4-5,8-9,11-12H,6-7,10H2,1-3H3,(H,17,19)	KBGBJGTYOSDAFM-UHFFFAOYSA-N	CC(C)NC(=O)CCCc1cn(C)c2ccccc12	BroadT	BRD-K45418850	BRD-K45418850-001-06-4	ChemDiv Inc.	K786-3435			CC(C)NC(=O)CCCc1cn(C)c2ccccc12	InChI=1S/C16H22N2O/c1-12(2)17-16(19)10-6-7-13-11-18(3)15-9-5-4-8-14(13)15/h4-5,8-9,11-12H,6-7,10H2,1-3H3,(H,17,19)	KBGBJGTYOSDAFM-UHFFFAOYSA-N	258.173213344							112376
1,2-Benzenediamine, n-(5-phenyl-1H-pyrazol-3-yl)-	LSM-23789	SID24829604, BRD-K63259048	2423957	InChI=1S/C15H14N4/c16-12-8-4-5-9-13(12)17-15-10-14(18-19-15)11-6-2-1-3-7-11/h1-10H,16H2,(H2,17,18,19)	UMKOVSRCLBSSTA-UHFFFAOYSA-N	Nc1ccccc1Nc2cc([nH]n2)c3ccccc3	BroadT	BRD-K63259048	BRD-K63259048-001-06-2	Enamine Ltd.	T5220365			Nc1ccccc1Nc1cc([nH]n1)-c1ccccc1	InChI=1S/C15H14N4/c16-12-8-4-5-9-13(12)17-15-10-14(18-19-15)11-6-2-1-3-7-11/h1-10H,16H2,(H2,17,18,19)	UMKOVSRCLBSSTA-UHFFFAOYSA-N	250.121846488							112377
ZINC02351055	LSM-23790	SID14740799, BRD-K96069363	1963914	InChI=1S/C15H18ClN2O3PS2/c1-3-20-22(19,21-4-2)14(9-17)15-23-10-18(11-24-15)13-7-5-12(16)6-8-13/h5-8H,3-4,10-11H2,1-2H3	ZALVDCZZODGNLH-UHFFFAOYSA-N	CCOP(=O)(OCC)C(=C1SCN(CS1)c2ccc(Cl)cc2)C#N	BroadT	BRD-K96069363	BRD-K96069363-001-05-5	InterBioScreen Ltd.	STOCK1S-23669			CCOP(=O)(OCC)C(C#N)=C1SCN(CS1)c1ccc(Cl)cc1	InChI=1S/C15H18ClN2O3PS2/c1-3-20-22(19,21-4-2)14(9-17)15-23-10-18(11-24-15)13-7-5-12(16)6-8-13/h5-8H,3-4,10-11H2,1-2H3	ZALVDCZZODGNLH-UHFFFAOYSA-N	404.018498056							112378
3-Ethoxy-n-thiazol-2-yl-benzamide	LSM-23791	SID14721063, BRD-K32577024	792393	InChI=1S/C12H12N2O2S/c1-2-16-10-5-3-4-9(8-10)11(15)14-12-13-6-7-17-12/h3-8H,2H2,1H3,(H,13,14,15)	FSVDGFBFHIAZHT-UHFFFAOYSA-N	CCOc1cccc(c1)C(=O)Nc2nccs2	BroadT	BRD-K32577024	BRD-K32577024-001-05-5	Asinex Ltd.	BAS 00735527			CCOc1cccc(c1)C(=O)Nc1nccs1	InChI=1S/C12H12N2O2S/c1-2-16-10-5-3-4-9(8-10)11(15)14-12-13-6-7-17-12/h3-8H,2H2,1H3,(H,13,14,15)	FSVDGFBFHIAZHT-UHFFFAOYSA-N	248.061948334							112379
MLS000888826	LSM-23792	SID26670061, BRD-K86168888	16682617	InChI=1S/C17H21F6N3/c1-2-3-4-14-10-25-15(24)26(14)6-5-11-7-12(16(18,19)20)9-13(8-11)17(21,22)23/h7-9,14H,2-6,10H2,1H3,(H2,24,25)/t14-/m1/s1	OJDAJFVUJSNUHG-CQSZACIVSA-N	CCCC[C@@H]1CN=C(N)N1CCc2cc(cc(c2)C(F)(F)F)C(F)(F)F	BroadT	BRD-K86168888	BRD-K86168888-001-05-3	Torrey Pines Institute for Molecular Studies	1656-63			CCCC[C@@H]1CN=C(N)N1CCc1cc(cc(c1)C(F)(F)F)C(F)(F)F	InChI=1S/C17H21F6N3/c1-2-3-4-14-10-25-15(24)26(14)6-5-11-7-12(16(18,19)20)9-13(8-11)17(21,22)23/h7-9,14H,2-6,10H2,1H3,(H2,24,25)/t14-/m1/s1	OJDAJFVUJSNUHG-CQSZACIVSA-N	381.163966902							112380
3-Ethyl-2-mercapto-5-thien-2-ylthieno[2,3-d]pyrimidin-4(3H)-one	LSM-23793	SID24829627, BRD-K98217168	3715206	InChI=1S/C12H10N2OS3/c1-2-14-11(15)9-7(8-4-3-5-17-8)6-18-10(9)13-12(14)16/h3-6H,2H2,1H3,(H,13,16)	NRUIJZZBQQZHSB-UHFFFAOYSA-N	CCN1C(=S)Nc2scc(c3cccs3)c2C1=O	BroadT	BRD-K98217168	BRD-K98217168-001-05-5	Enamine Ltd.	T5225557			CCn1c(=S)[nH]c2scc(-c3cccs3)c2c1=O	InChI=1S/C12H10N2OS3/c1-2-14-11(15)9-7(8-4-3-5-17-8)6-18-10(9)13-12(14)16/h3-6H,2H2,1H3,(H,13,16)	NRUIJZZBQQZHSB-UHFFFAOYSA-N	293.99552503							112381
AC1N2MOV	LSM-23794	BRD-M58554218	4049166	InChI=1S/C20H14N2O3/c23-18(17-14-9-3-4-10-16(14)21-19(17)24)20(25)22-15-11-5-7-12-6-1-2-8-13(12)15/h1-11,17H,(H,21,24)(H,22,25)	GLVCHIDHYYMASI-UHFFFAOYSA-N	O=C(Nc1cccc2ccccc12)C(=O)C3C(=O)Nc4ccccc34	BroadT	BRD-M58554218	BRD-M58554218-001-05-7	Enamine Ltd.	T0501-2067		C1COCCO1.O=C(Nc1cccc2ccccc12)C(=O)C1C(=O)Nc2ccccc12	C1COCCO1.O=C(Nc1cccc2ccccc12)C(=O)C1C(=O)Nc2ccccc12	InChI=1S/C20H14N2O3.C4H8O2/c23-18(17-14-9-3-4-10-16(14)21-19(17)24)20(25)22-15-11-5-7-12-6-1-2-8-13(12)15;1-2-6-4-3-5-1/h1-11,17H,(H,21,24)(H,22,25);1-4H2	DQSZMHDHWDSZQV-UHFFFAOYSA-N	330.100442328							112382
AC1LR9IM	LSM-23795	BRD-K75874680	1420263	InChI=1S/C19H22N4O3S/c1-14(2)13-26-18-9-5-15(6-10-18)11-20-19(27)22-21-12-16-3-7-17(8-4-16)23(24)25/h3-10,12,14H,11,13H2,1-2H3,(H2,20,22,27)	JNCKNSXNGDOGFE-UHFFFAOYSA-N	CC(C)COc1ccc(CN=C(S)NN=Cc2ccc(cc2)[N+](=O)[O-])cc1	BroadT	BRD-K75874680	BRD-K75874680-001-05-9	InterBioScreen Ltd.	STOCK1S-54600			CC(C)COc1ccc(CN=C(S)NN=Cc2ccc(cc2)[N+]([O-])=O)cc1	InChI=1S/C19H22N4O3S/c1-14(2)13-26-18-9-5-15(6-10-18)11-20-19(27)22-21-12-16-3-7-17(8-4-16)23(24)25/h3-10,12,14H,11,13H2,1-2H3,(H2,20,22,27)	JNCKNSXNGDOGFE-UHFFFAOYSA-N	386.141261294							112383
SMR000013142	LSM-23796	SID847743, BRD-K09411557	650152	InChI=1S/C20H17N3O3S/c1-26-20-10-6-5-9-19(20)23-14-21-17-13-15(11-12-18(17)23)22-27(24,25)16-7-3-2-4-8-16/h2-14,22H,1H3	MAXKXFCAXVTFOH-UHFFFAOYSA-N	COc1ccccc1n2cnc3cc(NS(=O)(=O)c4ccccc4)ccc23	BroadT	BRD-K09411557	BRD-K09411557-001-05-1	Asinex Ltd.	BAS 05022382			COc1ccccc1-n1cnc2cc(NS(=O)(=O)c3ccccc3)ccc12	InChI=1S/C20H17N3O3S/c1-26-20-10-6-5-9-19(20)23-14-21-17-13-15(11-12-18(17)23)22-27(24,25)16-7-3-2-4-8-16/h2-14,22H,1H3	MAXKXFCAXVTFOH-UHFFFAOYSA-N	379.099062124							112384
SMR000185278	LSM-44014	SID17416364, BRD-K99727583	5512458	InChI=1S/C22H17N3O6/c1-30-13-9-7-12(8-10-13)25-20(27)16(19(26)24-22(25)29)11-15-14-5-3-4-6-17(14)23-18(15)21(28)31-2/h3-11,23H,1-2H3,(H,24,26,29)/b16-11+	GRGGCAJTHAXZHH-LFIBNONCSA-N	COC(=O)c1[nH]c2ccccc2c1\C=C\3/C(=O)NC(=O)N(C3=O)c4ccc(OC)cc4	BroadT	BRD-K99727583	BRD-K99727583-001-05-9	ChemBridge Corporation	5307635			COC(=O)c1[nH]c2ccccc2c1\C=C1/C(=O)NC(=O)N(C1=O)c1ccc(OC)cc1	InChI=1S/C22H17N3O6/c1-30-13-9-7-12(8-10-13)25-20(27)16(19(26)24-22(25)29)11-15-14-5-3-4-6-17(14)23-18(15)21(28)31-2/h3-11,23H,1-2H3,(H,24,26,29)/b16-11+	GRGGCAJTHAXZHH-LFIBNONCSA-N	419.111735294							
SMR000028797	LSM-23798	SID26670724, SID4242576, BRD-A30570056	3237410	InChI=1S/C17H18N4O4/c1-3-21-10(2)12(8-18-21)13-7-16(25-20-13)17(22)19-11-4-5-14-15(6-11)24-9-23-14/h4-6,8,16H,3,7,9H2,1-2H3,(H,19,22)	DURVLQNUNLKPFW-UHFFFAOYSA-N	CCn1ncc(C2=NOC(C2)C(=O)Nc3ccc4OCOc4c3)c1C	BroadT	BRD-A30570056	BRD-A30570056-001-06-3	ChemDiv Inc.	C715-0304			CCn1ncc(C2=NOC(C2)C(=O)Nc2ccc3OCOc3c2)c1C	InChI=1S/C17H18N4O4/c1-3-21-10(2)12(8-18-21)13-7-16(25-20-13)17(22)19-11-4-5-14-15(6-11)24-9-23-14/h4-6,8,16H,3,7,9H2,1-2H3,(H,19,22)	DURVLQNUNLKPFW-UHFFFAOYSA-N	342.132805096							112386
ST50939890	LSM-23799	SID24825110, BRD-K02581454	2161595	InChI=1S/C14H11ClN2O3/c15-13-10(2-1-5-16-13)14(18)17-7-9-3-4-11-12(6-9)20-8-19-11/h1-6H,7-8H2,(H,17,18)	LTGZXNNLHRHJJD-UHFFFAOYSA-N	Clc1ncccc1C(=O)NCc2ccc3OCOc3c2	BroadT	BRD-K02581454	BRD-K02581454-001-05-2	Enamine Ltd.	T5267741			Clc1ncccc1C(=O)NCc1ccc2OCOc2c1	InChI=1S/C14H11ClN2O3/c15-13-10(2-1-5-16-13)14(18)17-7-9-3-4-11-12(6-9)20-8-19-11/h1-6H,7-8H2,(H,17,18)	LTGZXNNLHRHJJD-UHFFFAOYSA-N	290.045819942							112387
59826-53-8	LSM-3066	BRD-K48576794, SID24804165	566661	InChI=1S/C6H7ClN2O2/c1-4-2-5(9-11-4)8-6(10)3-7/h2H,3H2,1H3,(H,8,9,10)	DXJICGSIRAJIDN-UHFFFAOYSA-N	Cc1onc(NC(=O)CCl)c1	BroadT	BRD-K48576794	BRD-K48576794-001-07-3	Asinex Ltd.	BAS 10738766			Cc1cc(NC(=O)CCl)no1	InChI=1S/C6H7ClN2O2/c1-4-2-5(9-11-4)8-6(10)3-7/h2H,3H2,1H3,(H,8,9,10)	DXJICGSIRAJIDN-UHFFFAOYSA-N	174.019605194							92840
STK361559	LSM-23800	BRD-A54950948	25250417	InChI=1S/C14H15NOS/c1-14(2)7-10-13(11(16)8-14)17-12-6-4-3-5-9(12)15-10/h3-6,13H,7-8H2,1-2H3	OADPHFIKCARYPP-UHFFFAOYSA-N	CC1(C)CC(=O)C2Sc3ccccc3N=C2C1	BroadT	BRD-A54950948	BRD-A54950948-001-06-0	InterBioScreen Ltd.	STOCK1S-38107			CC1(C)CC(=O)C2Sc3ccccc3N=C2C1	InChI=1S/C14H15NOS/c1-14(2)7-10-13(11(16)8-14)17-12-6-4-3-5-9(12)15-10/h3-6,13H,7-8H2,1-2H3	OADPHFIKCARYPP-UHFFFAOYSA-N	245.0874348							112388
ZINC00678562	LSM-23801	SID47196875, BRD-K47119189	1016582	InChI=1S/C15H12BrN3O2S/c1-9(20)10-3-2-4-13(6-10)18-15(22)19-14(21)11-5-12(16)8-17-7-11/h2-8H,1H3,(H2,18,19,21,22)	VMVAQKZYRKXDJB-UHFFFAOYSA-N	CC(=O)c1cccc(NC(=S)NC(=O)c2cncc(Br)c2)c1	BroadT	BRD-K47119189	BRD-K47119189-001-05-0	ChemBridge Corporation	6708849			CC(=O)c1cccc(NC(=S)NC(=O)c2cncc(Br)c2)c1	InChI=1S/C15H12BrN3O2S/c1-9(20)10-3-2-4-13(6-10)18-15(22)19-14(21)11-5-12(16)8-17-7-11/h2-8H,1H3,(H2,18,19,21,22)	VMVAQKZYRKXDJB-UHFFFAOYSA-N	376.983359944							112389
REGID860937	LSM-23802	SID860937, BRD-A49197143	662210	InChI=1S/C20H20N4O4/c1-3-26-14-7-6-12(8-15(14)27-20(25)11-4-5-11)17-13(9-21)18(22)28-19-16(17)10(2)23-24-19/h6-8,11,17H,3-5,22H2,1-2H3,(H,23,24)	GYGQYYUWPUQNBB-UHFFFAOYSA-N	CCOc1ccc(cc1OC(=O)C2CC2)C3C(=C(N)Oc4[nH]nc(C)c34)C#N	BroadT	BRD-A49197143	BRD-A49197143-001-06-9	InterBioScreen Ltd.	STOCK3S-93177			CCOc1ccc(cc1OC(=O)C1CC1)C1c2c(C)n[nH]c2OC(N)=C1C#N	InChI=1S/C20H20N4O4/c1-3-26-14-7-6-12(8-15(14)27-20(25)11-4-5-11)17-13(9-21)18(22)28-19-16(17)10(2)23-24-19/h6-8,11,17H,3-5,22H2,1-2H3,(H,23,24)	GYGQYYUWPUQNBB-UHFFFAOYSA-N	380.14845516							112390
14346-25-9	LSM-23803	SID26660582, BRD-K85027801	203420	InChI=1S/C9H8N2OS/c12-8-7-5-2-1-3-6(5)13-9(7)11-4-10-8/h4H,1-3H2,(H,10,11,12)	MZAZSAHKQBGEMA-UHFFFAOYSA-N	Oc1ncnc2sc3CCCc3c12	BroadT	BRD-K85027801	BRD-K85027801-001-06-4	InterBioScreen Ltd.	STOCK1S-24101			Oc1ncnc2sc3CCCc3c12	InChI=1S/C9H8N2OS/c12-8-7-5-2-1-3-6(5)13-9(7)11-4-10-8/h4H,1-3H2,(H,10,11,12)	MZAZSAHKQBGEMA-UHFFFAOYSA-N	192.035733586							112391
MLS000063506	LSM-23804	SID4265229, BRD-K76506856	750584	InChI=1S/C16H13FN2OS/c1-11-4-2-3-5-14(11)15-18-19-16(20-15)21-10-12-6-8-13(17)9-7-12/h2-9H,10H2,1H3	OYUKMLIKYHZZBC-UHFFFAOYSA-N	Cc1ccccc1c2oc(SCc3ccc(F)cc3)nn2	BroadT	BRD-K76506856	BRD-K76506856-001-08-8	ChemBridge Corporation	7382593			Cc1ccccc1-c1nnc(SCc2ccc(F)cc2)o1	InChI=1S/C16H13FN2OS/c1-11-4-2-3-5-14(11)15-18-19-16(20-15)21-10-12-6-8-13(17)9-7-12/h2-9H,10H2,1H3	OYUKMLIKYHZZBC-UHFFFAOYSA-N	300.073261946							112392
MLS000394335	LSM-44015	SID22410528, BRD-K67882163	15945355	InChI=1S/C19H21N3O5S/c1-3-21(4-2)28(26,27)18-10-6-8-16(14-18)20-19(23)12-11-15-7-5-9-17(13-15)22(24)25/h5-14H,3-4H2,1-2H3,(H,20,23)/b12-11+	VMORIEVVOUHSNW-VAWYXSNFSA-N	CCN(CC)S(=O)(=O)c1cccc(NC(=O)\C=C\c2cccc(c2)[N+](=O)[O-])c1	BroadT	BRD-K67882163	BRD-K67882163-001-05-8	Enamine Ltd.	Z31799975			CCN(CC)S(=O)(=O)c1cccc(NC(=O)\C=C\c2cccc(c2)[N+]([O-])=O)c1	InChI=1S/C19H21N3O5S/c1-3-21(4-2)28(26,27)18-10-6-8-16(14-18)20-19(23)12-11-15-7-5-9-17(13-15)22(24)25/h5-14H,3-4H2,1-2H3,(H,20,23)/b12-11+	VMORIEVVOUHSNW-VAWYXSNFSA-N	403.120191492							
2-(2-Chlorophenyl)-5-(methylamino)-1,3-oxazole-4-carbonitrile	LSM-23806	SID859776, BRD-K16737809	661078	InChI=1S/C11H8ClN3O/c1-14-11-9(6-13)15-10(16-11)7-4-2-3-5-8(7)12/h2-5,14H,1H3	XDZDENBDOGWINS-UHFFFAOYSA-N	CNc1oc(nc1C#N)c2ccccc2Cl	BroadT	BRD-K16737809	BRD-K16737809-001-05-6	InterBioScreen Ltd.	STOCK3S-35831			CNc1oc(nc1C#N)-c1ccccc1Cl	InChI=1S/C11H8ClN3O/c1-14-11-9(6-13)15-10(16-11)7-4-2-3-5-8(7)12/h2-5,14H,1H3	XDZDENBDOGWINS-UHFFFAOYSA-N	233.035589616							112394
4,6-Distyryl-pyrimidine	LSM-44016	SID14724114, BRD-K02387605	5331193	InChI=1S/C20H16N2/c1-3-7-17(8-4-1)11-13-19-15-20(22-16-21-19)14-12-18-9-5-2-6-10-18/h1-16H/b13-11+,14-12+	VIWSLCCWPMJBQT-PHEQNACWSA-N	C(=C\c1cc(\C=C\c2ccccc2)ncn1)/c3ccccc3	BroadT	BRD-K02387605	BRD-K02387605-001-05-2	Asinex Ltd.	BAS 00087270			c1ccc(cc1)\C=C\c1cc(ncn1)\C=C\c1ccccc1	InChI=1S/C20H16N2/c1-3-7-17(8-4-1)11-13-19-15-20(22-16-21-19)14-12-18-9-5-2-6-10-18/h1-16H/b13-11+,14-12+	VIWSLCCWPMJBQT-PHEQNACWSA-N	284.131348532							
SMR000030852	LSM-23808	SID4246770, SID26724782, BRD-K05105053	3241069	InChI=1S/C27H32N4O3S/c1-34-24-9-5-4-8-23(24)29-14-16-30(17-15-29)25(32)20-12-10-19(11-13-20)18-31-26(33)21-6-2-3-7-22(21)28-27(31)35/h2-9,19-20H,10-18H2,1H3,(H,28,35)	JPBWSFGLZWQGEZ-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)C(=O)C3CCC(CN4C(=S)Nc5ccccc5C4=O)CC3	BroadT	BRD-K05105053	BRD-K05105053-001-05-2	ChemDiv Inc.	K284-3189			COc1ccccc1N1CCN(CC1)C(=O)C1CCC(Cn2c(=S)[nH]c3ccccc3c2=O)CC1	InChI=1S/C27H32N4O3S/c1-34-24-9-5-4-8-23(24)29-14-16-30(17-15-29)25(32)20-12-10-19(11-13-20)18-31-26(33)21-6-2-3-7-22(21)28-27(31)35/h2-9,19-20H,10-18H2,1H3,(H,28,35)	JPBWSFGLZWQGEZ-UHFFFAOYSA-N	492.219511614							112396
AJ-030/14523410	LSM-44017	SID22402303, BRD-K19137242	5583866	InChI=1S/C19H22Cl2N4O3/c20-9-5-11-24-17(26)14(12-23-15-8-4-10-22-16(15)21)18(27)25(19(24)28)13-6-2-1-3-7-13/h4,8,10,12-13,23H,1-3,5-7,9,11H2/b14-12-	NIYWMWBAIRZCEJ-OWBHPGMISA-N	ClCCCN1C(=O)N(C2CCCCC2)C(=O)\C(=C/Nc3cccnc3Cl)\C1=O	BroadT	BRD-K19137242	BRD-K19137242-001-05-1	Specs	AJ-030/14523410			ClCCCN1C(=O)N(C2CCCCC2)C(=O)\C(=C/Nc2cccnc2Cl)C1=O	InChI=1S/C19H22Cl2N4O3/c20-9-5-11-24-17(26)14(12-23-15-8-4-10-22-16(15)21)18(27)25(19(24)28)13-6-2-1-3-7-13/h4,8,10,12-13,23H,1-3,5-7,9,11H2/b14-12-	NIYWMWBAIRZCEJ-OWBHPGMISA-N	424.106896024							
F0039-0201	LSM-15211	BRD-K03795998	979070	InChI=1S/C21H22ClN2O/c1-25-19-12-10-18(11-13-19)24-20(16-6-8-17(22)9-7-16)15-23-14-4-2-3-5-21(23)24/h6-13,15H,2-5,14H2,1H3/q+1	CJTUEBYSLRDGIV-UHFFFAOYSA-N	COc1ccc(cc1)[n+]2c3CCCCCn3cc2c4ccc(Cl)cc4	BroadT	BRD-K03795998	BRD-K03795998-004-06-2	InterBioScreen Ltd.	STOCK1S-18180		Br	COc1ccc(cc1)-[n+]1c(cn2CCCCCc12)-c1ccc(Cl)cc1.Br	InChI=1S/C21H22ClN2O.BrH/c1-25-19-12-10-18(11-13-19)24-20(16-6-8-17(22)9-7-16)15-23-14-4-2-3-5-21(23)24;/h6-13,15H,2-5,14H2,1H3;1H/q+1;	SKNCCFGTNSUDBA-UHFFFAOYSA-N	353.142066054							103860, 103860
MLS000565610	LSM-23810	SID14747133, BRD-K79246618	3985135	InChI=1S/C17H17ClN4O2S/c1-24-9-8-22-14-5-3-2-4-13(14)20-17(22)25-11-16(23)21-15-7-6-12(18)10-19-15/h2-7,10H,8-9,11H2,1H3,(H,19,21,23)	KWPKXCGWULQECF-UHFFFAOYSA-N	COCCn1c(SCC(=O)Nc2ccc(Cl)cn2)nc3ccccc13	BroadT	BRD-K79246618	BRD-K79246618-001-09-5	Enamine Ltd.	T5222969			COCCn1c(SCC(=O)Nc2ccc(Cl)cn2)nc2ccccc12	InChI=1S/C17H17ClN4O2S/c1-24-9-8-22-14-5-3-2-4-13(14)20-17(22)25-11-16(23)21-15-7-6-12(18)10-19-15/h2-7,10H,8-9,11H2,1H3,(H,19,21,23)	KWPKXCGWULQECF-UHFFFAOYSA-N	376.076074224							112398
ZINC03248009	LSM-23811	SID14747178, BRD-K64182643	2365213	InChI=1S/C17H13Cl2NO5/c18-11-2-3-12(19)13(8-11)20-16(21)9-25-17(22)10-1-4-14-15(7-10)24-6-5-23-14/h1-4,7-8H,5-6,9H2,(H,20,21)	DMMMUUYYPDBVBP-UHFFFAOYSA-N	Clc1ccc(Cl)c(NC(=O)COC(=O)c2ccc3OCCOc3c2)c1	BroadT	BRD-K64182643	BRD-K64182643-001-05-6	Enamine Ltd.	T0509-7717			Clc1ccc(Cl)c(NC(=O)COC(=O)c2ccc3OCCOc3c2)c1	InChI=1S/C17H13Cl2NO5/c18-11-2-3-12(19)13(8-11)20-16(21)9-25-17(22)10-1-4-14-15(7-10)24-6-5-23-14/h1-4,7-8H,5-6,9H2,(H,20,21)	DMMMUUYYPDBVBP-UHFFFAOYSA-N	381.017077946							112399
MLS000334407	LSM-23812	SID22402842, SID85098866, BRD-K98782887	2482957	InChI=1S/C25H19F2N3O2S/c26-17-9-11-22(20(27)13-17)30-24(32)19-6-1-2-7-21(19)29-25(30)33-14-23(31)28-18-10-8-15-4-3-5-16(15)12-18/h1-2,6-13H,3-5,14H2,(H,28,31)	XDHLOZVUUYVELM-UHFFFAOYSA-N	Fc1ccc(N2C(=Nc3ccccc3C2=O)SCC(=O)Nc4ccc5CCCc5c4)c(F)c1	BroadT	BRD-K98782887	BRD-K98782887-001-05-8	Enamine Ltd.	T5285148			Fc1ccc(c(F)c1)-n1c(SCC(=O)Nc2ccc3CCCc3c2)nc2ccccc2c1=O	InChI=1S/C25H19F2N3O2S/c26-17-9-11-22(20(27)13-17)30-24(32)19-6-1-2-7-21(19)29-25(30)33-14-23(31)28-18-10-8-15-4-3-5-16(15)12-18/h1-2,6-13H,3-5,14H2,(H,28,31)	XDHLOZVUUYVELM-UHFFFAOYSA-N	463.116603968							112400
Concentramide	LSM-44018	SID17432399, BRD-K49257800	2288424	InChI=1S/C19H22N2O/c1-2-3-4-5-16-8-12-18(21-14-16)17-10-6-15(7-11-17)9-13-19(20)22/h6-14H,2-5H2,1H3,(H2,20,22)/b13-9+	YALIPMYQZOWTDL-UKTHLTGXSA-N	CCCCCc1ccc(nc1)c2ccc(\C=C\C(=O)N)cc2	BroadT	BRD-K49257800	BRD-K49257800-001-05-5	ChemBridge Corporation	5243294			CCCCCc1ccc(nc1)-c1ccc(cc1)\C=C\C(N)=O	InChI=1S/C19H22N2O/c1-2-3-4-5-16-8-12-18(21-14-16)17-10-6-15(7-11-17)9-13-19(20)22/h6-14H,2-5H2,1H3,(H2,20,22)/b13-9+	YALIPMYQZOWTDL-UKTHLTGXSA-N	294.173213344							
ST50834807	LSM-23814	SID24796696, BRD-K99955175	971608	InChI=1S/C14H13N3O3/c18-14(16-8-10-2-1-5-15-7-10)17-11-3-4-12-13(6-11)20-9-19-12/h1-7H,8-9H2,(H2,16,17,18)	LKCPHXVUBWSZRD-UHFFFAOYSA-N	O=C(NCc1cccnc1)Nc2ccc3OCOc3c2	BroadT	BRD-K99955175	BRD-K99955175-001-05-0	ChemBridge Corporation	7825726			O=C(NCc1cccnc1)Nc1ccc2OCOc2c1	InChI=1S/C14H13N3O3/c18-14(16-8-10-2-1-5-15-7-10)17-11-3-4-12-13(6-11)20-9-19-12/h1-7H,8-9H2,(H2,16,17,18)	LKCPHXVUBWSZRD-UHFFFAOYSA-N	271.095691306							112402
Isopropyl 2-[4-(3-chlorophenyl)piperazino]nicotinate	LSM-23815	SID24819198, BRD-K00052649	3783311	InChI=1S/C19H22ClN3O2/c1-14(2)25-19(24)17-7-4-8-21-18(17)23-11-9-22(10-12-23)16-6-3-5-15(20)13-16/h3-8,13-14H,9-12H2,1-2H3	AEBHMQALVKZIOJ-UHFFFAOYSA-N	CC(C)OC(=O)c1cccnc1N2CCN(CC2)c3cccc(Cl)c3	BroadT	BRD-K00052649	BRD-K00052649-001-06-0	Key Organics Ltd.	6G-472S			CC(C)OC(=O)c1cccnc1N1CCN(CC1)c1cccc(Cl)c1	InChI=1S/C19H22ClN3O2/c1-14(2)25-19(24)17-7-4-8-21-18(17)23-11-9-22(10-12-23)16-6-3-5-15(20)13-16/h3-8,13-14H,9-12H2,1-2H3	AEBHMQALVKZIOJ-UHFFFAOYSA-N	359.140054684							112403
3-(4-Bromo-phenoxymethyl)-benzoic acid hydrazide	LSM-23816	SID17504094, BRD-K07509832	4327012	InChI=1S/C14H13BrN2O2/c15-12-4-6-13(7-5-12)19-9-10-2-1-3-11(8-10)14(18)17-16/h1-8H,9,16H2,(H,17,18)	IMRIYDAFYNLOEZ-UHFFFAOYSA-N	NNC(=O)c1cccc(COc2ccc(Br)cc2)c1	BroadT	BRD-K07509832	BRD-K07509832-001-05-1	InterBioScreen Ltd.	STOCK3S-01254			NNC(=O)c1cccc(COc2ccc(Br)cc2)c1	InChI=1S/C14H13BrN2O2/c15-12-4-6-13(7-5-12)19-9-10-2-1-3-11(8-10)14(18)17-16/h1-8H,9,16H2,(H,17,18)	IMRIYDAFYNLOEZ-UHFFFAOYSA-N	320.016040276							112404
MLS000591142	LSM-23817	SID17504151, BRD-K98146210	1385045	InChI=1S/C23H20N4O2/c1-29-18-12-8-16(9-13-18)22-19-4-2-3-5-20(19)23(27-26-22)25-17-10-6-15(7-11-17)14-21(24)28/h2-13H,14H2,1H3,(H2,24,28)(H,25,27)	MAECILYKCQUQAF-UHFFFAOYSA-N	COc1ccc(cc1)c2nnc(Nc3ccc(CC(=O)N)cc3)c4ccccc24	BroadT	BRD-K98146210	BRD-K98146210-001-07-0	InterBioScreen Ltd.	STOCK3S-05560			COc1ccc(cc1)-c1nnc(Nc2ccc(CC(N)=O)cc2)c2ccccc12	InChI=1S/C23H20N4O2/c1-29-18-12-8-16(9-13-18)22-19-4-2-3-5-20(19)23(27-26-22)25-17-10-6-15(7-11-17)14-21(24)28/h2-13H,14H2,1H3,(H2,24,28)(H,25,27)	MAECILYKCQUQAF-UHFFFAOYSA-N	384.15862592							112405
SMR000042331	LSM-23818	SID860496, BRD-A32325811	661783	InChI=1S/C21H23N5O3/c1-28-10-5-9-26-19-17(18-20(26)24-16-8-3-2-7-15(16)23-18)21(27)25(13-22-19)12-14-6-4-11-29-14/h2-3,7-8,13-14H,4-6,9-12H2,1H3	ZRCUMJIFJVLKFW-UHFFFAOYSA-N	COCCCn1c2N=CN(CC3CCCO3)C(=O)c2c4nc5ccccc5nc14	BroadT	BRD-A32325811	BRD-A32325811-001-05-8	InterBioScreen Ltd.	STOCK3S-75077			COCCCn1c2ncn(CC3CCCO3)c(=O)c2c2nc3ccccc3nc12	InChI=1S/C21H23N5O3/c1-28-10-5-9-26-19-17(18-20(26)24-16-8-3-2-7-15(16)23-18)21(27)25(13-22-19)12-14-6-4-11-29-14/h2-3,7-8,13-14H,4-6,9-12H2,1H3	ZRCUMJIFJVLKFW-UHFFFAOYSA-N	393.180089646							112406
MLS000564126	LSM-23819	SID14745503, BRD-K18074447	2384284	InChI=1S/C12H15N3/c1-2-3-9-4-6-10(7-5-9)11-8-12(13)15-14-11/h4-8H,2-3H2,1H3,(H3,13,14,15)	ZKXPZJHRBDVHIA-UHFFFAOYSA-N	CCCc1ccc(cc1)c2cc(N)[nH]n2	BroadT	BRD-K18074447	BRD-K18074447-001-07-6	Enamine Ltd.	T0514-0175			CCCc1ccc(cc1)-c1cc(N)[nH]n1	InChI=1S/C12H15N3/c1-2-3-9-4-6-10(7-5-9)11-8-12(13)15-14-11/h4-8H,2-3H2,1H3,(H3,13,14,15)	ZKXPZJHRBDVHIA-UHFFFAOYSA-N	201.12659751							112407
CHEMBL428909	LSM-23820	SID4255577, BRD-K74009522	1208332	InChI=1S/C18H16N4O2S/c1-21(2)13-8-9-19-17-14(13)15-16(25-17)18(23)22(10-20-15)11-4-6-12(24-3)7-5-11/h4-10H,1-3H3	COQPVKMATNFNLG-UHFFFAOYSA-N	COc1ccc(cc1)N2C=Nc3c(sc4nccc(N(C)C)c34)C2=O	BroadT	BRD-K74009522	BRD-K74009522-001-05-5	ChemBridge Corporation	6043941			COc1ccc(cc1)-n1cnc2c(sc3nccc(N(C)C)c23)c1=O	InChI=1S/C18H16N4O2S/c1-21(2)13-8-9-19-17-14(13)15-16(25-17)18(23)22(10-20-15)11-4-6-12(24-3)7-5-11/h4-10H,1-3H3	COQPVKMATNFNLG-UHFFFAOYSA-N	352.099396482							112408, 112408
STK155493	LSM-23821	SID4258276, BRD-K11184599	724614	InChI=1S/C12H12N2OS2/c15-12(14-5-7-16-8-6-14)11-13-9-3-1-2-4-10(9)17-11/h1-4H,5-8H2	YYYFKIZNFDJABQ-UHFFFAOYSA-N	O=C(N1CCSCC1)c2nc3ccccc3s2	BroadT	BRD-K11184599	BRD-K11184599-001-05-0	ChemBridge Corporation	7734499			O=C(N1CCSCC1)c1nc2ccccc2s1	InChI=1S/C12H12N2OS2/c15-12(14-5-7-16-8-6-14)11-13-9-3-1-2-4-10(9)17-11/h1-4H,5-8H2	YYYFKIZNFDJABQ-UHFFFAOYSA-N	264.039104404							112409
AF-399/42177334	LSM-23822	SID22412440, BRD-A96155639	3659969	InChI=1S/C16H19Br3N2O/c1-9-5-4-6-10(20-9)21-13(22)16-8-7-15(11(16)17,12(18)19)14(16,2)3/h4-6,11-12H,7-8H2,1-3H3,(H,20,21,22)	SQFGIESILRVDDD-UHFFFAOYSA-N	Cc1cccc(NC(=O)C23CCC(C(Br)Br)(C2Br)C3(C)C)n1	BroadT	BRD-A96155639	BRD-A96155639-001-05-2	Specs	AF-399/42177334			Cc1cccc(NC(=O)C23CCC(C(Br)Br)(C2Br)C3(C)C)n1	InChI=1S/C16H19Br3N2O/c1-9-5-4-6-10(20-9)21-13(22)16-8-7-15(11(16)17,12(18)19)14(16,2)3/h4-6,11-12H,7-8H2,1-3H3,(H,20,21,22)	SQFGIESILRVDDD-UHFFFAOYSA-N	491.904751048							112410
SMR000030178	LSM-23823	BRD-K41727577	3245204	InChI=1S/C23H18N2O6/c1-29-17-9-6-15-11-19(21(26)24-13-18-3-2-10-30-18)22(31-20(15)12-17)25-16-7-4-14(5-8-16)23(27)28/h2-12H,13H2,1H3,(H,24,26)(H,27,28)	SWKMLAVOUUFJOP-UHFFFAOYSA-N	COc1ccc2C=C(C(=O)NCc3occc3)C(=Nc4ccc(cc4)C(=O)O)Oc2c1	BroadT	BRD-K41727577	BRD-K41727577-001-05-6	ChemDiv Inc.	K220-04057			COc1ccc2cc(C(=O)NCc3ccco3)c(=Nc3ccc(cc3)C(O)=O)oc2c1	InChI=1S/C23H18N2O6/c1-29-17-9-6-15-11-19(21(26)24-13-18-3-2-10-30-18)22(31-20(15)12-17)25-16-7-4-14(5-8-16)23(27)28/h2-12H,13H2,1H3,(H,24,26)(H,27,28)	SWKMLAVOUUFJOP-UHFFFAOYSA-N	418.116486316							112411
AC1NLMGS	LSM-23824	SID24811584, BRD-K94342340	4985032	InChI=1S/C24H23ClFN3OS/c25-21-12-10-18(11-13-21)14-27-23(30)15-28-24(31)29(16-19-6-2-1-3-7-19)17-20-8-4-5-9-22(20)26/h1-13H,14-17H2,(H,27,30)(H,28,31)	MLNGECYUAVZHCM-UHFFFAOYSA-N	Fc1ccccc1CN(Cc2ccccc2)C(=NCC(=O)NCc3ccc(Cl)cc3)S	BroadT	BRD-K94342340	BRD-K94342340-001-04-9	ChemDiv Inc.	K784-5771			Fc1ccccc1CN(Cc1ccccc1)C(S)=NCC(=O)NCc1ccc(Cl)cc1	InChI=1S/C24H23ClFN3OS/c25-21-12-10-18(11-13-21)14-27-23(30)15-28-24(31)29(16-19-6-2-1-3-7-19)17-20-8-4-5-9-22(20)26/h1-13H,14-17H2,(H,27,30)(H,28,31)	MLNGECYUAVZHCM-UHFFFAOYSA-N	455.123438986							112412
STK006204	LSM-23825	SID17504587, BRD-K18353242	2178309	InChI=1S/C26H19N3OS2/c1-16-13-14-18(25-27-21-11-4-5-12-23(21)32-25)15-22(16)28-26(31)29-24(30)20-10-6-8-17-7-2-3-9-19(17)20/h2-15H,1H3,(H2,28,29,30,31)	QVLIYNSQQGNFMG-UHFFFAOYSA-N	Cc1ccc(cc1NC(=S)NC(=O)c2cccc3ccccc23)c4nc5ccccc5s4	BroadT	BRD-K18353242	BRD-K18353242-001-06-3	ChemBridge Corporation	6565360			Cc1ccc(cc1NC(=S)NC(=O)c1cccc2ccccc12)-c1nc2ccccc2s1	InChI=1S/C26H19N3OS2/c1-16-13-14-18(25-27-21-11-4-5-12-23(21)32-25)15-22(16)28-26(31)29-24(30)20-10-6-8-17-7-2-3-9-19(17)20/h2-15H,1H3,(H2,28,29,30,31)	QVLIYNSQQGNFMG-UHFFFAOYSA-N	453.096953638							112413
STK063357	LSM-23826	SID4264836, BRD-K01025623	697312	InChI=1S/C16H14N4OS/c1-11-15(20-7-3-2-6-14(20)18-11)13-10-22-16(19-13)17-9-12-5-4-8-21-12/h2-8,10H,9H2,1H3,(H,17,19)	IRTWPKFNFCJFGX-UHFFFAOYSA-N	Cc1nc2ccccn2c1c3csc(NCc4occc4)n3	BroadT	BRD-K01025623	BRD-K01025623-001-06-5	ChemBridge Corporation	6570141			Cc1nc2ccccn2c1-c1csc(NCc2ccco2)n1	InChI=1S/C16H14N4OS/c1-11-15(20-7-3-2-6-14(20)18-11)13-10-22-16(19-13)17-9-12-5-4-8-21-12/h2-8,10H,9H2,1H3,(H,17,19)	IRTWPKFNFCJFGX-UHFFFAOYSA-N	310.088831798							112414
ST50638206	LSM-23827	SID4252382, SID87218896, SID87344552, BRD-A96824985	3245942	InChI=1S/C19H19NO4/c1-2-7-22-16-6-4-3-5-12(16)13-9-19(21)20-15-10-18-17(8-14(13)15)23-11-24-18/h3-6,8,10,13H,2,7,9,11H2,1H3,(H,20,21)	FKOKOJREXZYLQF-UHFFFAOYSA-N	CCCOc1ccccc1C2CC(=O)Nc3cc4OCOc4cc23	BroadT	BRD-A96824985	BRD-A96824985-001-08-7	ChemDiv Inc.	C276-0503			CCCOc1ccccc1C1CC(=O)Nc2cc3OCOc3cc12	InChI=1S/C19H19NO4/c1-2-7-22-16-6-4-3-5-12(16)13-9-19(21)20-15-10-18-17(8-14(13)15)23-11-24-18/h3-6,8,10,13H,2,7,9,11H2,1H3,(H,20,21)	FKOKOJREXZYLQF-UHFFFAOYSA-N	325.131408098							112415
AC1MM5K9	LSM-23828	SID24810796, BRD-K54265631	3280700	InChI=1S/C20H21N5OS/c26-19-16-11-15(23-20(27)22-13-14-5-4-9-21-12-14)7-8-17(16)24-18-6-2-1-3-10-25(18)19/h4-5,7-9,11-12H,1-3,6,10,13H2,(H2,22,23,27)	COVXQURWHYHDMN-UHFFFAOYSA-N	O=C1N2CCCCCC2=Nc3ccc(NC(=S)NCc4cccnc4)cc13	BroadT	BRD-K54265631	BRD-K54265631-001-05-5	ChemDiv Inc.	C066-3488			O=c1n2CCCCCc2nc2ccc(NC(=S)NCc3cccnc3)cc12	InChI=1S/C20H21N5OS/c26-19-16-11-15(23-20(27)22-13-14-5-4-9-21-12-14)7-8-17(16)24-18-6-2-1-3-10-25(18)19/h4-5,7-9,11-12H,1-3,6,10,13H2,(H2,22,23,27)	COVXQURWHYHDMN-UHFFFAOYSA-N	379.146681032							112416
AC1LGN3Q	LSM-23829	BRD-K30049194	824188	InChI=1S/C15H12N4O2/c20-15(19-16-10-12-7-4-8-21-12)14-9-13(17-18-14)11-5-2-1-3-6-11/h1-10H,(H,17,18)(H,19,20)	OPUHZCUNJBCESL-UHFFFAOYSA-N	O=C(NN=Cc1occc1)c2cc([nH]n2)c3ccccc3	BroadT	BRD-K30049194	BRD-K30049194-001-05-1	Asinex Ltd.	BAS 00334843			O=C(NN=Cc1ccco1)c1cc([nH]n1)-c1ccccc1	InChI=1S/C15H12N4O2/c20-15(19-16-10-12-7-4-8-21-12)14-9-13(17-18-14)11-5-2-1-3-6-11/h1-10H,(H,17,18)(H,19,20)	OPUHZCUNJBCESL-UHFFFAOYSA-N	280.096025664							112417
SMR000152774	LSM-23830	SID14745989, BRD-A05083276	3918052	InChI=1S/C20H23N3O2S/c1-13-10-16(14(2)23(13)11-15-6-5-9-25-15)19(24)12-26-20-21-17-7-3-4-8-18(17)22-20/h3-4,7-8,10,15H,5-6,9,11-12H2,1-2H3,(H,21,22)	WFOQUMSMZJAUFC-UHFFFAOYSA-N	Cc1cc(C(=O)CSc2nc3ccccc3[nH]2)c(C)n1CC4CCCO4	BroadT	BRD-A05083276	BRD-A05083276-001-06-2	Enamine Ltd.	T5212378			Cc1cc(C(=O)CSc2nc3ccccc3[nH]2)c(C)n1CC1CCCO1	InChI=1S/C20H23N3O2S/c1-13-10-16(14(2)23(13)11-15-6-5-9-25-15)19(24)12-26-20-21-17-7-3-4-8-18(17)22-20/h3-4,7-8,10,15H,5-6,9,11-12H2,1-2H3,(H,21,22)	WFOQUMSMZJAUFC-UHFFFAOYSA-N	369.151097696							112418
AC1MJQK0	LSM-23831	BRD-K00663527	3141532	InChI=1S/C16H15N3O2/c1-11-9-14(19-17-10-12-5-4-8-21-12)13-6-3-7-15(20-2)16(13)18-11/h3-10H,1-2H3,(H,18,19)	UIDRWIIEELIULI-UHFFFAOYSA-N	COc1cccc2c(NN=Cc3occc3)cc(C)nc12	BroadT	BRD-K00663527	BRD-K00663527-001-05-3	Asinex Ltd.	BAS 02379973			COc1cccc2c(NN=Cc3ccco3)cc(C)nc12	InChI=1S/C16H15N3O2/c1-11-9-14(19-17-10-12-5-4-8-21-12)13-6-3-7-15(20-2)16(13)18-11/h3-10H,1-2H3,(H,18,19)	UIDRWIIEELIULI-UHFFFAOYSA-N	281.11642675							112419
SS-0447	LSM-23832	SID14721967, BRD-K65889891	1086432	InChI=1S/C17H16F3N3O2S/c1-3-23(4-2)15(24)10-26-16-11(9-21)12(17(18,19)20)8-13(22-16)14-6-5-7-25-14/h5-8H,3-4,10H2,1-2H3	ILECOIDDBKYPMO-UHFFFAOYSA-N	CCN(CC)C(=O)CSc1nc(cc(c1C#N)C(F)(F)F)c2occc2	BroadT	BRD-K65889891	BRD-K65889891-001-05-4	Asinex Ltd.	BAS 06901010			CCN(CC)C(=O)CSc1nc(cc(c1C#N)C(F)(F)F)-c1ccco1	InChI=1S/C17H16F3N3O2S/c1-3-23(4-2)15(24)10-26-16-11(9-21)12(17(18,19)20)8-13(22-16)14-6-5-7-25-14/h5-8H,3-4,10H2,1-2H3	ILECOIDDBKYPMO-UHFFFAOYSA-N	383.091532072							112420
MLS-0425618.0001	LSM-3954	BRD-K87657228, SID85248364, SID87544840, SID99495609	44229067	InChI=1S/C16H17N3O2S/c1-10-4-6-13(7-5-10)22(20,21)19-15-9-12(3)11(2)8-14(15)18-16(19)17/h4-9H,1-3H3,(H2,17,18)	XLIIDMLPBLNVLH-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)n2c(N)nc3cc(C)c(C)cc23	BroadT	BRD-K87657228	BRD-K87657228-001-01-2	Sanford-Burnham Medical Research Institute	MLS-0425618			Cc1ccc(cc1)S(=O)(=O)n1c(N)nc2cc(C)c(C)cc12	InChI=1S/C16H17N3O2S/c1-10-4-6-13(7-5-10)22(20,21)19-15-9-12(3)11(2)8-14(15)18-16(19)17/h4-9H,1-3H3,(H2,17,18)	XLIIDMLPBLNVLH-UHFFFAOYSA-N	315.104147504							93527
AC1OB4MD	LSM-23833	SID26660300, BRD-A06221803	6840017	InChI=1S/C23H19N3O4/c1-29-15-7-4-6-14(12-15)22-19-20(17-9-2-3-10-18(17)27)24-25-21(19)23(28)26(22)13-16-8-5-11-30-16/h2-12,22,27H,13H2,1H3,(H,24,25)	XFGRNAQIBWXZHW-UHFFFAOYSA-N	COc1cccc(c1)C2N(Cc3occc3)C(=O)c4[nH]nc(c5ccccc5O)c24	BroadT	BRD-A06221803	BRD-A06221803-001-05-1	InterBioScreen Ltd.	STOCK5S-52578			COc1cccc(c1)C1N(Cc2ccco2)C(=O)c2[nH]nc(c12)-c1ccccc1O	InChI=1S/C23H19N3O4/c1-29-15-7-4-6-14(12-15)22-19-20(17-9-2-3-10-18(17)27)24-25-21(19)23(28)26(22)13-16-8-5-11-30-16/h2-12,22,27H,13H2,1H3,(H,24,25)	XFGRNAQIBWXZHW-UHFFFAOYSA-N	401.137556118							
AC1MDVYN	LSM-15212	BRD-K63632273	2843816	InChI=1S/C26H24NO/c1-2-9-23(10-3-1)11-7-17-27(19-21-28-22-20-27)18-8-15-25-14-6-13-24-12-4-5-16-26(24)25/h1-6,9-10,12-14,16H,17-22H2/q+1	CUICAVLQGXKHLF-UHFFFAOYSA-N	C(C#Cc1ccccc1)[N+]2(CC#Cc3cccc4ccccc34)CCOCC2	BroadT	BRD-K63632273	BRD-K63632273-004-04-5	Asinex Ltd.	BAS 00338460		Br	C(C#Cc1ccccc1)[N+]1(CC#Cc2cccc3ccccc23)CCOCC1.Br	InChI=1S/C26H24NO.BrH/c1-2-9-23(10-3-1)11-7-17-27(19-21-28-22-20-27)18-8-15-25-14-6-13-24-12-4-5-16-26(24)25;/h1-6,9-10,12-14,16H,17-22H2;1H/q+1;	MEIRHKVHUIAZRA-UHFFFAOYSA-N	366.185789398							103861, 103861
F1510-0062	LSM-23834	SID24821978, BRD-K42634295	6485059	InChI=1S/C19H15N3OS/c1-13-7-8-22-12-16(21-18(22)10-13)14-4-2-5-15(11-14)20-19(23)17-6-3-9-24-17/h2-12H,1H3,(H,20,23)	AKDCLHAYVVMHFB-UHFFFAOYSA-N	Cc1ccn2cc(nc2c1)c3cccc(NC(=O)c4cccs4)c3	BroadT	BRD-K42634295	BRD-K42634295-001-05-4	Asinex Ltd.	BAS 13034604			Cc1ccn2cc(nc2c1)-c1cccc(NC(=O)c2cccs2)c1	InChI=1S/C19H15N3OS/c1-13-7-8-22-12-16(21-18(22)10-13)14-4-2-5-15(11-14)20-19(23)17-6-3-9-24-17/h2-12H,1H3,(H,20,23)	AKDCLHAYVVMHFB-UHFFFAOYSA-N	333.09358282							112422
3-(3,5-Dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoic acid	LSM-23835	SID24792374, BRD-K90676269	906031	InChI=1S/C16H14O5/c1-8-7-20-13-6-14-12(5-11(8)13)9(2)10(16(19)21-14)3-4-15(17)18/h5-7H,3-4H2,1-2H3,(H,17,18)	GPVASUMRUOWISE-UHFFFAOYSA-N	CC1=C(CCC(=O)O)C(=O)Oc2cc3occ(C)c3cc12	BroadT	BRD-K90676269	BRD-K90676269-001-11-6	ChemBridge Corporation	9000619			Cc1coc2cc3oc(=O)c(CCC(O)=O)c(C)c3cc12	InChI=1S/C16H14O5/c1-8-7-20-13-6-14-12(5-11(8)13)9(2)10(16(19)21-14)3-4-15(17)18/h5-7H,3-4H2,1-2H3,(H,17,18)	GPVASUMRUOWISE-UHFFFAOYSA-N	286.084123548							112423
MLS000756633	LSM-23836	SID26664937, BRD-K82484613	322919	InChI=1S/C16H21N3O2S/c1-2-21-16(20)17-12-7-8-13-14(11-12)22-15(18-13)19-9-5-3-4-6-10-19/h7-8,11H,2-6,9-10H2,1H3,(H,17,20)	ULJXJASKIKRWKU-UHFFFAOYSA-N	CCOC(=O)Nc1ccc2nc(sc2c1)N3CCCCCC3	BroadT	BRD-K82484613	BRD-K82484613-001-08-4	National Cancer Institute Chemotherapeutic Agents Repository	281383			CCOC(=O)Nc1ccc2nc(sc2c1)N1CCCCCC1	InChI=1S/C16H21N3O2S/c1-2-21-16(20)17-12-7-8-13-14(11-12)22-15(18-13)19-9-5-3-4-6-10-19/h7-8,11H,2-6,9-10H2,1H3,(H,17,20)	ULJXJASKIKRWKU-UHFFFAOYSA-N	319.135447632							112424
SMR000039528	LSM-23837	SID857269, BRD-K16568308	115936	InChI=1S/C17H25NO2/c1-14(2)20-16-8-6-15(7-9-16)17(19)10-13-18-11-4-3-5-12-18/h6-9,14H,3-5,10-13H2,1-2H3	ZHTPWMDZZZQREU-UHFFFAOYSA-N	CC(C)Oc1ccc(cc1)C(=O)CCN2CCCCC2	BroadT	BRD-K16568308	BRD-K16568308-001-05-1	InterBioScreen Ltd.	STOCK1S-59060			CC(C)Oc1ccc(cc1)C(=O)CCN1CCCCC1	InChI=1S/C17H25NO2/c1-14(2)20-16-8-6-15(7-9-16)17(19)10-13-18-11-4-3-5-12-18/h6-9,14H,3-5,10-13H2,1-2H3	ZHTPWMDZZZQREU-UHFFFAOYSA-N	275.18852905							112425
MLS000419296	LSM-23838	SID24815462, BRD-K43184094	4058359	InChI=1S/C19H22ClN3OS/c1-3-21-19(25)23(12-15-5-4-10-24-15)9-8-16-13(2)22-18-7-6-14(20)11-17(16)18/h4-7,10-11,22H,3,8-9,12H2,1-2H3,(H,21,25)	RVGPAIIWLNQLEN-UHFFFAOYSA-N	CCN=C(S)N(CCc1c(C)[nH]c2ccc(Cl)cc12)Cc3occc3	BroadT	BRD-K43184094	BRD-K43184094-001-06-0	Life Chemicals Inc.	F0633-0071			CCN=C(S)N(CCc1c(C)[nH]c2ccc(Cl)cc12)Cc1ccco1	InChI=1S/C19H22ClN3OS/c1-3-21-19(25)23(12-15-5-4-10-24-15)9-8-16-13(2)22-18-7-6-14(20)11-17(16)18/h4-7,10-11,22H,3,8-9,12H2,1-2H3,(H,21,25)	RVGPAIIWLNQLEN-UHFFFAOYSA-N	375.117210754							112426
AC1O9UCK	LSM-23839	BRD-K76203848	6772724	InChI=1S/C23H20N4O3/c1-27-22(23(29)26-18-9-5-6-10-21(18)30-2)19(14-25-27)24-13-17-16-8-4-3-7-15(16)11-12-20(17)28/h3-14,28H,1-2H3,(H,26,29)	FPVBAVVATBTESR-UHFFFAOYSA-N	COc1ccccc1NC(=O)c2c(cnn2C)N=Cc3c(O)ccc4ccccc34	BroadT	BRD-K76203848	BRD-K76203848-001-05-9	InterBioScreen Ltd.	STOCK1S-03738			COc1ccccc1NC(=O)c1c(cnn1C)N=Cc1c(O)ccc2ccccc12	InChI=1S/C23H20N4O3/c1-27-22(23(29)26-18-9-5-6-10-21(18)30-2)19(14-25-27)24-13-17-16-8-4-3-7-15(16)11-12-20(17)28/h3-14,28H,1-2H3,(H,26,29)	FPVBAVVATBTESR-UHFFFAOYSA-N	400.15354054							
MLS000419442	LSM-23840	SID24815336, BRD-K58486677	4223919	InChI=1S/C23H30N2O4S/c1-13(2)29-15-10-8-14(9-11-15)19(26)24-20-17(21(27)28-7)16-12-22(3,4)25-23(5,6)18(16)30-20/h8-11,13,25H,12H2,1-7H3,(H,24,26)	RGCGPFQSEOUBKU-UHFFFAOYSA-N	COC(=O)c1c(NC(=O)c2ccc(OC(C)C)cc2)sc3c1CC(C)(C)NC3(C)C	BroadT	BRD-K58486677	BRD-K58486677-001-05-8	Life Chemicals Inc.	F1299-0183			COC(=O)c1c(NC(=O)c2ccc(OC(C)C)cc2)sc2c1CC(C)(C)NC2(C)C	InChI=1S/C23H30N2O4S/c1-13(2)29-15-10-8-14(9-11-15)19(26)24-20-17(21(27)28-7)16-12-22(3,4)25-23(5,6)18(16)30-20/h8-11,13,25H,12H2,1-7H3,(H,24,26)	RGCGPFQSEOUBKU-UHFFFAOYSA-N	430.19262815							112428
ST50922779	LSM-23841	SID3712523, BRD-K92291012	2611430	InChI=1S/C19H19NO2/c21-19(20-11-10-15-4-1-2-7-18(15)20)13-22-17-9-8-14-5-3-6-16(14)12-17/h1-2,4,7-9,12H,3,5-6,10-11,13H2	HZDUGBHIIHKUQT-UHFFFAOYSA-N	O=C(COc1ccc2CCCc2c1)N3CCc4ccccc34	BroadT	BRD-K92291012	BRD-K92291012-001-06-2	Enamine Ltd.	ZT-3111008			O=C(COc1ccc2CCCc2c1)N1CCc2ccccc12	InChI=1S/C19H19NO2/c21-19(20-11-10-15-4-1-2-7-18(15)20)13-22-17-9-8-14-5-3-6-16(14)12-17/h1-2,4,7-9,12H,3,5-6,10-11,13H2	HZDUGBHIIHKUQT-UHFFFAOYSA-N	293.141578858							112429
SMR000146711	LSM-23842	SID14730543, BRD-K34009558	1948481	InChI=1S/C19H18N4OS/c20-10-14-17(22)23-18(15(11-21)19(14)8-4-5-9-19)25-12-16(24)13-6-2-1-3-7-13/h1-3,6-7,23H,4-5,8-9,12,22H2	VURXCZVXMSCVOT-UHFFFAOYSA-N	NC1=C(C#N)C2(CCCC2)C(=C(N1)SCC(=O)c3ccccc3)C#N	BroadT	BRD-K34009558	BRD-K34009558-001-05-1	InterBioScreen Ltd.	STOCK1S-19886			NC1=C(C#N)C2(CCCC2)C(C#N)=C(N1)SCC(=O)c1ccccc1	InChI=1S/C19H18N4OS/c20-10-14-17(22)23-18(15(11-21)19(14)8-4-5-9-19)25-12-16(24)13-6-2-1-3-7-13/h1-3,6-7,23H,4-5,8-9,12,22H2	VURXCZVXMSCVOT-UHFFFAOYSA-N	350.120131926							112430
Methyl 5-({[5-(2-chlorophenyl)-2-(trifluoromethyl)-3-furyl]carbonyl}amino)-2-morpholinobenzoate	LSM-23843	SID26728744, BRD-K18915563	2810077	InChI=1S/C24H20ClF3N2O5/c1-33-23(32)16-12-14(6-7-19(16)30-8-10-34-11-9-30)29-22(31)17-13-20(35-21(17)24(26,27)28)15-4-2-3-5-18(15)25/h2-7,12-13H,8-11H2,1H3,(H,29,31)	IXELHXKSQJPUNJ-UHFFFAOYSA-N	COC(=O)c1cc(NC(=O)c2cc(oc2C(F)(F)F)c3ccccc3Cl)ccc1N4CCOCC4	BroadT	BRD-K18915563	BRD-K18915563-001-06-0	Maybridge	HTS 01353			COC(=O)c1cc(NC(=O)c2cc(oc2C(F)(F)F)-c2ccccc2Cl)ccc1N1CCOCC1	InChI=1S/C24H20ClF3N2O5/c1-33-23(32)16-12-14(6-7-19(16)30-8-10-34-11-9-30)29-22(31)17-13-20(35-21(17)24(26,27)28)15-4-2-3-5-18(15)25/h2-7,12-13H,8-11H2,1H3,(H,29,31)	IXELHXKSQJPUNJ-UHFFFAOYSA-N	508.10128407							112431
SMR000095647	LSM-23844	SID24838409, SID7965694, BRD-K21283872	5307773	InChI=1S/C24H24FN5O2S/c1-29-13-3-4-20(29)14-22-27-28-24(30(22)19-9-11-21(32-2)12-10-19)33-16-23(31)26-15-17-5-7-18(25)8-6-17/h3-13H,14-16H2,1-2H3,(H,26,31)	NYSQHXXOVTVIEE-UHFFFAOYSA-N	COc1ccc(cc1)n2c(Cc3cccn3C)nnc2SCC(=O)NCc4ccc(F)cc4	BroadT	BRD-K21283872	BRD-K21283872-001-05-6	ChemDiv Inc.	C677-0208			COc1ccc(cc1)-n1c(Cc2cccn2C)nnc1SCC(=O)NCc1ccc(F)cc1	InChI=1S/C24H24FN5O2S/c1-29-13-3-4-20(29)14-22-27-28-24(30(22)19-9-11-21(32-2)12-10-19)33-16-23(31)26-15-17-5-7-18(25)8-6-17/h3-13H,14-16H2,1-2H3,(H,26,31)	NYSQHXXOVTVIEE-UHFFFAOYSA-N	465.163473948							112432
5A,6,7,8,9,10-Hexahydroazepino[2,1-b]quinazolin-12(5H)-one	LSM-23845	SID4244914, BRD-A89697488	3239451	InChI=1S/C13H16N2O/c16-13-10-6-3-4-7-11(10)14-12-8-2-1-5-9-15(12)13/h3-4,6-7,12,14H,1-2,5,8-9H2	KNPFCIQCLDTMEY-UHFFFAOYSA-N	O=C1N2CCCCCC2Nc3ccccc13	BroadT	BRD-A89697488	BRD-A89697488-001-05-4	ChemDiv Inc.	C066-3291			O=C1N2CCCCCC2Nc2ccccc12	InChI=1S/C13H16N2O/c16-13-10-6-3-4-7-11(10)14-12-8-2-1-5-9-15(12)13/h3-4,6-7,12,14H,1-2,5,8-9H2	KNPFCIQCLDTMEY-UHFFFAOYSA-N	216.126263152							112433
AC1N8D3G	LSM-23846	BRD-K04262424	4316878	InChI=1S/C18H16Cl2N4O3S/c1-12(23-24-18-17(20)9-14(19)10-21-18)13-4-6-16(7-5-13)28(25,26)22-11-15-3-2-8-27-15/h2-10,22H,11H2,1H3,(H,21,24)	WMVOYUMBLZZIIS-UHFFFAOYSA-N	CC(=NNc1ncc(Cl)cc1Cl)c2ccc(cc2)S(=O)(=O)NCc3occc3	BroadT	BRD-K04262424	BRD-K04262424-001-05-4	Enamine Ltd.	T5251242			CC(=NNc1ncc(Cl)cc1Cl)c1ccc(cc1)S(=O)(=O)NCc1ccco1	InChI=1S/C18H16Cl2N4O3S/c1-12(23-24-18-17(20)9-14(19)10-21-18)13-4-6-16(7-5-13)28(25,26)22-11-15-3-2-8-27-15/h2-10,22H,11H2,1H3,(H,21,24)	WMVOYUMBLZZIIS-UHFFFAOYSA-N	438.032016522							112434
AC1O9QF7	LSM-23847	BRD-K45171984	6790337	InChI=1S/C19H24N6O2/c26-15-6-5-14(11-16(15)27)13-20-23-17-12-18(24-7-1-2-8-24)22-19(21-17)25-9-3-4-10-25/h5-6,11-13,26-27H,1-4,7-10H2,(H,21,22,23)	NTXCGRMMYZSAGT-UHFFFAOYSA-N	Oc1ccc(C=NNc2cc(nc(n2)N3CCCC3)N4CCCC4)cc1O	BroadT	BRD-K45171984	BRD-K45171984-001-05-0	Asinex Ltd.	BAS 03845573			Oc1ccc(C=NNc2cc(nc(n2)N2CCCC2)N2CCCC2)cc1O	InChI=1S/C19H24N6O2/c26-15-6-5-14(11-16(15)27)13-20-23-17-12-18(24-7-1-2-8-24)22-19(21-17)25-9-3-4-10-25/h5-6,11-13,26-27H,1-4,7-10H2,(H,21,22,23)	NTXCGRMMYZSAGT-UHFFFAOYSA-N	368.196074068							
SMR000061627	LSM-23848	SID3711993, BRD-K04905134	2364789	InChI=1S/C16H14BrNO4/c17-14-8-7-13(22-14)16(20)21-10-15(19)18-9-3-5-11-4-1-2-6-12(11)18/h1-2,4,6-8H,3,5,9-10H2	NXBJIYZVKAMOMC-UHFFFAOYSA-N	Brc1oc(cc1)C(=O)OCC(=O)N2CCCc3ccccc23	BroadT	BRD-K04905134	BRD-K04905134-001-05-9	Enamine Ltd.	T0509-7423			Brc1ccc(o1)C(=O)OCC(=O)N1CCCc2ccccc12	InChI=1S/C16H14BrNO4/c17-14-8-7-13(22-14)16(20)21-10-15(19)18-9-3-5-11-4-1-2-6-12(11)18/h1-2,4,6-8H,3,5,9-10H2	NXBJIYZVKAMOMC-UHFFFAOYSA-N	363.010620538							112436
5,7-Dimethyl[1,2,4]triazolo[4,3-a]pyrimidine	LSM-23849	SID26665801, BRD-K25945985	1971110	InChI=1S/C7H8N4/c1-5-3-6(2)11-4-8-10-7(11)9-5/h3-4H,1-2H3	NDQNAVGOMKWUFE-UHFFFAOYSA-N	Cc1cc(C)n2cnnc2n1	BroadT	BRD-K25945985	BRD-K25945985-001-04-3	InterBioScreen Ltd.	STOCK5S-58167			Cc1cc(C)n2cnnc2n1	InChI=1S/C7H8N4/c1-5-3-6(2)11-4-8-10-7(11)9-5/h3-4H,1-2H3	NDQNAVGOMKWUFE-UHFFFAOYSA-N	148.074896296							112437
MLS001242596	LSM-23850	SID49729249, BRD-K49394549	24792589	InChI=1S/C22H45N3/c1-5-7-8-20(16-25-21(17-23-4)18(3)6-2)24-14-13-22-11-9-19(15-22)10-12-22/h18-21,23-25H,5-17H2,1-4H3/t18-,19?,20-,21+,22?/m1/s1	HXWVJOJFQXWXFE-CAQIQVKASA-N	CCCC[C@H](CN[C@@H](CNC)[C@H](C)CC)NCCC12CCC(CC1)C2	BroadT	BRD-K49394549	BRD-K49394549-001-05-2	Torrey Pines Institute for Molecular Studies	1665-192			CCCC[C@H](CN[C@@H](CNC)[C@H](C)CC)NCCC12CCC(CC1)C2	InChI=1S/C22H45N3/c1-5-7-8-20(16-25-21(17-23-4)18(3)6-2)24-14-13-22-11-9-19(15-22)10-12-22/h18-21,23-25H,5-17H2,1-4H3/t18-,19?,20-,21+,22?/m1/s1	HXWVJOJFQXWXFE-CAQIQVKASA-N	351.36134847							112438
MLS000566200	LSM-23851	SID14745130, SID56373834, BRD-K54566838	2123742	InChI=1S/C17H16N2O2/c1-11-7-12(2)9-13(8-11)17(21)19-10-16(20)18-14-5-3-4-6-15(14)19/h3-9H,10H2,1-2H3,(H,18,20)	HZVVNFUIEIANJX-UHFFFAOYSA-N	Cc1cc(C)cc(c1)C(=O)N2CC(=O)Nc3ccccc23	BroadT	BRD-K54566838	BRD-K54566838-001-09-9	Enamine Ltd.	T5250538			Cc1cc(C)cc(c1)C(=O)N1CC(=O)Nc2ccccc12	InChI=1S/C17H16N2O2/c1-11-7-12(2)9-13(8-11)17(21)19-10-16(20)18-14-5-3-4-6-15(14)19/h3-9H,10H2,1-2H3,(H,18,20)	HZVVNFUIEIANJX-UHFFFAOYSA-N	280.121177772							112439
MLS000575708	LSM-23852	SID17412507, BRD-A34384930	2919681	InChI=1S/C24H29N3O3S/c1-3-30-18-5-4-17(9-19(18)29-2)20-10-21(28)27-23(31-20)25-22(26-27)24-11-14-6-15(12-24)8-16(7-14)13-24/h4-5,9,14-16,20H,3,6-8,10-13H2,1-2H3	HXURILCBOQNDPH-UHFFFAOYSA-N	CCOc1ccc(cc1OC)C2CC(=O)n3nc(nc3S2)C45CC6CC(CC(C6)C4)C5	BroadT	BRD-A34384930	BRD-A34384930-001-05-9	ChemBridge Corporation	6943127			CCOc1ccc(cc1OC)C1CC(=O)n2nc(nc2S1)C12CC3CC(CC(C3)C1)C2	InChI=1S/C24H29N3O3S/c1-3-30-18-5-4-17(9-19(18)29-2)20-10-21(28)27-23(31-20)25-22(26-27)24-11-14-6-15(12-24)8-16(7-14)13-24/h4-5,9,14-16,20H,3,6-8,10-13H2,1-2H3	HXURILCBOQNDPH-UHFFFAOYSA-N	439.192962508							112440
F0745-0950	LSM-23853	SID24825931, BRD-K21686355	1182720	InChI=1S/C17H20N2O6S/c1-4-24-16(22)12-9(3)14(17(23)25-5-2)26-15(12)19-18-13-10(20)7-6-8-11(13)21/h19H,4-8H2,1-3H3	LGSVJSPEAHMKHC-UHFFFAOYSA-N	CCOC(=O)c1sc(NN=C2C(=O)CCCC2=O)c(C(=O)OCC)c1C	BroadT	BRD-K21686355	BRD-K21686355-001-05-6	Enamine Ltd.	T0513-9988			CCOC(=O)c1sc(NN=C2C(=O)CCCC2=O)c(C(=O)OCC)c1C	InChI=1S/C17H20N2O6S/c1-4-24-16(22)12-9(3)14(17(23)25-5-2)26-15(12)19-18-13-10(20)7-6-8-11(13)21/h19H,4-8H2,1-3H3	LGSVJSPEAHMKHC-UHFFFAOYSA-N	380.10420707							112441
MLS000705806	LSM-15355	BRD-K39597613	826773	InChI=1S/C15H14Cl2FNS/c1-19(2)9-10-3-5-12(18)8-14(10)20-15-7-11(16)4-6-13(15)17/h3-8H,9H2,1-2H3	UNAWHUIPJQHFOG-UHFFFAOYSA-N	CN(C)Cc1ccc(F)cc1Sc2cc(Cl)ccc2Cl	BroadT	BRD-K39597613	BRD-K39597613-003-05-9	Specs	AE-641/05538041		Cl	CN(C)Cc1ccc(F)cc1Sc1cc(Cl)ccc1Cl.Cl	InChI=1S/C15H14Cl2FNS.ClH/c1-19(2)9-10-3-5-12(18)8-14(10)20-15-7-11(16)4-6-13(15)17;/h3-8H,9H2,1-2H3;1H	KRHLYFSVUSQLRN-UHFFFAOYSA-N	329.020803768							104001, 104001
ST086179	LSM-44019	SID14725461, BRD-K58462572	685070	InChI=1S/C17H12N4OS/c22-14(13-6-5-11-3-1-2-4-12(11)7-13)8-23-17-15-16(19-9-18-15)20-10-21-17/h1-7,9-10H,8H2,(H,18,19,20,21)	VQMJJOYQKCIYGO-UHFFFAOYSA-N	O=C(CSc1[nH]cnc2ncnc12)c3ccc4ccccc4c3	BroadT	BRD-K58462572	BRD-K58462572-001-05-5	Asinex Ltd.	BAS 03655999			O=C(CSc1ncnc2[nH]cnc12)c1ccc2ccccc2c1	InChI=1S/C17H12N4OS/c22-14(13-6-5-11-3-1-2-4-12(11)7-13)8-23-17-15-16(19-9-18-15)20-10-21-17/h1-7,9-10H,8H2,(H,18,19,20,21)	VQMJJOYQKCIYGO-UHFFFAOYSA-N	320.073181734							
MLS000375049	LSM-23855	SID22405834, BRD-K99978353	2320375	InChI=1S/C19H14F4N2O2S2/c20-17(21)27-13-5-3-12(4-6-13)16(26)25-19-24-10-15(29-19)9-11-1-7-14(8-2-11)28-18(22)23/h1-8,10,17-18H,9H2,(H,24,25,26)	BRKGVCZDLBFEPZ-UHFFFAOYSA-N	FC(F)Oc1ccc(cc1)C(=O)Nc2ncc(Cc3ccc(SC(F)F)cc3)s2	BroadT	BRD-K99978353	BRD-K99978353-001-06-4	Enamine Ltd.	T0503-7590			FC(F)Oc1ccc(cc1)C(=O)Nc1ncc(Cc2ccc(SC(F)F)cc2)s1	InChI=1S/C19H14F4N2O2S2/c20-17(21)27-13-5-3-12(4-6-13)16(26)25-19-24-10-15(29-19)9-11-1-7-14(8-2-11)28-18(22)23/h1-8,10,17-18H,9H2,(H,24,25,26)	BRKGVCZDLBFEPZ-UHFFFAOYSA-N	442.043281888							112443
AC1M6ZKN	LSM-23856	BRD-K70698180	2433070	InChI=1S/C22H25N5O2S/c1-15(2)24-22(30)25-23-13-17-14-27(18-8-6-5-7-9-18)26-21(17)16-10-11-19(28-3)20(12-16)29-4/h5-15H,1-4H3,(H2,24,25,30)	ZVFFIDHMEKYLRE-UHFFFAOYSA-N	COc1ccc(cc1OC)c2nn(cc2C=NN=C(S)NC(C)C)c3ccccc3	BroadT	BRD-K70698180	BRD-K70698180-001-08-6	Enamine Ltd.	T0516-2199			COc1ccc(cc1OC)-c1nn(cc1C=NN=C(S)NC(C)C)-c1ccccc1	InChI=1S/C22H25N5O2S/c1-15(2)24-22(30)25-23-13-17-14-27(18-8-6-5-7-9-18)26-21(17)16-10-11-19(28-3)20(12-16)29-4/h5-15H,1-4H3,(H2,24,25,30)	ZVFFIDHMEKYLRE-UHFFFAOYSA-N	423.17289578							112444
SMR000000762	LSM-23857	SID842468, BRD-K04948770	644732	InChI=1S/C15H22N6/c1-2-6-11(7-3-1)10-16-14-12-8-4-5-9-13(12)17-15-18-19-20-21(14)15/h11,16H,1-10H2	GSSZIRDJOKLGGZ-UHFFFAOYSA-N	C(Nc1c2CCCCc2nc3nnnn13)C4CCCCC4	BroadT	BRD-K04948770	BRD-K04948770-001-06-6	Asinex Ltd.	ASN 09858173			C(Nc1c2CCCCc2nc2nnnn12)C1CCCCC1	InChI=1S/C15H22N6/c1-2-6-11(7-3-1)10-16-14-12-8-4-5-9-13(12)17-15-18-19-20-21(14)15/h11,16H,1-10H2	GSSZIRDJOKLGGZ-UHFFFAOYSA-N	286.190594764							112445
SMR000195249	LSM-23858	SID17415902, BRD-K12745086	1000713	InChI=1S/C24H23ClN2O3S/c1-18-9-11-23(12-10-18)31(29,30)27(22-8-4-7-21(25)15-22)17-24(28)26-14-13-19-5-2-3-6-20(19)16-26/h2-12,15H,13-14,16-17H2,1H3	CEMGKLPXDFYUBU-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N(CC(=O)N2CCc3ccccc3C2)c4cccc(Cl)c4	BroadT	BRD-K12745086	BRD-K12745086-001-05-7	ChemBridge Corporation	6491886			Cc1ccc(cc1)S(=O)(=O)N(CC(=O)N1CCc2ccccc2C1)c1cccc(Cl)c1	InChI=1S/C24H23ClN2O3S/c1-18-9-11-23(12-10-18)31(29,30)27(22-8-4-7-21(25)15-22)17-24(28)26-14-13-19-5-2-3-6-20(19)16-26/h2-12,15H,13-14,16-17H2,1H3	CEMGKLPXDFYUBU-UHFFFAOYSA-N	454.111791016							112446
AC1LHQH1	LSM-23859	BRD-K31169178	842264	InChI=1S/C18H22N2O2S/c1-12(2)10-22-16-7-5-15(6-8-16)9-19-20-18(21)17-11-23-14(4)13(17)3/h5-9,11-12H,10H2,1-4H3,(H,20,21)	BLBYAGQBGLGYMY-UHFFFAOYSA-N	CC(C)COc1ccc(C=NNC(=O)c2csc(C)c2C)cc1	BroadT	BRD-K31169178	BRD-K31169178-001-05-6	Specs	AK-968/41025906			CC(C)COc1ccc(C=NNC(=O)c2csc(C)c2C)cc1	InChI=1S/C18H22N2O2S/c1-12(2)10-22-16-7-5-15(6-8-16)9-19-20-18(21)17-11-23-14(4)13(17)3/h5-9,11-12H,10H2,1-4H3,(H,20,21)	BLBYAGQBGLGYMY-UHFFFAOYSA-N	330.140198654							112447
4(1H)-Quinazolinethione, 2-phenyl-	LSM-23860	SID24821356, BRD-K65130752	838258	InChI=1S/C14H10N2S/c17-14-11-8-4-5-9-12(11)15-13(16-14)10-6-2-1-3-7-10/h1-9H,(H,15,16,17)	GJELWRJKAIJFJN-UHFFFAOYSA-N	Sc1nc(nc2ccccc12)c3ccccc3	BroadT	BRD-K65130752	BRD-K65130752-001-05-1	Asinex Ltd.	BAS 01357671			Sc1nc(nc2ccccc12)-c1ccccc1	InChI=1S/C14H10N2S/c17-14-11-8-4-5-9-12(11)15-13(16-14)10-6-2-1-3-7-10/h1-9H,(H,15,16,17)	GJELWRJKAIJFJN-UHFFFAOYSA-N	238.05646903							112448
ZINC00506400	LSM-23861	SID26660318, BRD-K61456580	919099	InChI=1S/C23H18O3/c1-25-16-12-11-15(22(14-16)26-2)13-21-17-7-3-5-9-19(17)23(24)20-10-6-4-8-18(20)21/h3-14H,1-2H3	AYGPZQNRASPMIC-UHFFFAOYSA-N	COc1ccc(C=C2c3ccccc3C(=O)c4ccccc24)c(OC)c1	BroadT	BRD-K61456580	BRD-K61456580-001-06-0	InterBioScreen Ltd.	STOCK2S-02090			COc1ccc(C=C2c3ccccc3C(=O)c3ccccc23)c(OC)c1	InChI=1S/C23H18O3/c1-25-16-12-11-15(22(14-16)26-2)13-21-17-7-3-5-9-19(17)23(24)20-10-6-4-8-18(20)21/h3-14H,1-2H3	AYGPZQNRASPMIC-UHFFFAOYSA-N	342.125594436							112449
MLS000778913	LSM-44020	SID26671077, BRD-K08604406	1840499	InChI=1S/C18H15N3O4S/c1-10(22)12-3-5-13(6-4-12)15-8-7-14(25-15)9-16(17(23)24)26-18-19-11(2)20-21-18/h3-9H,1-2H3,(H,23,24)(H,19,20,21)/b16-9+	ZJTDNRKDJAKASB-CXUHLZMHSA-N	CC(=O)c1ccc(cc1)c2oc(\C=C(\Sc3n[nH]c(C)n3)/C(=O)O)cc2	BroadT	BRD-K08604406	BRD-K08604406-001-07-1	InterBioScreen Ltd.	STOCK5S-35034			CC(=O)c1ccc(cc1)-c1ccc(\C=C(\Sc2n[nH]c(C)n2)C(O)=O)o1	InChI=1S/C18H15N3O4S/c1-10(22)12-3-5-13(6-4-12)15-8-7-14(25-15)9-16(17(23)24)26-18-19-11(2)20-21-18/h3-9H,1-2H3,(H,23,24)(H,19,20,21)/b16-9+	ZJTDNRKDJAKASB-CXUHLZMHSA-N	369.07832668							
MLS000393156	LSM-44021	SID24791334, BRD-K52033610	6217510	InChI=1S/C20H16N2O6/c1-27-18-11-13(6-10-17(18)28-12-19(23)24)5-8-15-9-7-14-3-2-4-16(22(25)26)20(14)21-15/h2-11H,12H2,1H3,(H,23,24)/b8-5+	PTOFYNLLKNLRKG-VMPITWQZSA-N	COc1cc(\C=C\c2ccc3cccc(c3n2)[N+](=O)[O-])ccc1OCC(=O)O	BroadT	BRD-K52033610	BRD-K52033610-001-05-4	Enamine Ltd.	T5337876			COc1cc(\C=C\c2ccc3cccc([N+]([O-])=O)c3n2)ccc1OCC(O)=O	InChI=1S/C20H16N2O6/c1-27-18-11-13(6-10-17(18)28-12-19(23)24)5-8-15-9-7-14-3-2-4-16(22(25)26)20(14)21-15/h2-11H,12H2,1H3,(H,23,24)/b8-5+	PTOFYNLLKNLRKG-VMPITWQZSA-N	380.100836252							
AC1M6ZX4	LSM-23864	BRD-K54842031	2408608	InChI=1S/C13H11FN4S/c14-11-5-3-10(4-6-11)8-16-18-13(19)17-12-2-1-7-15-9-12/h1-9H,(H2,17,18,19)	HQOQIUZLQCWHRZ-UHFFFAOYSA-N	Fc1ccc(C=NN=C(S)Nc2cccnc2)cc1	BroadT	BRD-K54842031	BRD-K54842031-001-05-7	Enamine Ltd.	T0520-5540			Fc1ccc(C=NN=C(S)Nc2cccnc2)cc1	InChI=1S/C13H11FN4S/c14-11-5-3-10(4-6-11)8-16-18-13(19)17-12-2-1-7-15-9-12/h1-9H,(H2,17,18,19)	HQOQIUZLQCWHRZ-UHFFFAOYSA-N	274.068845282							112452
AE-406/41056481	LSM-23865	SID22412571, BRD-A59804189	54678639	InChI=1S/C14H11N5O3/c1-6-5-7-3-2-4-8-10(7)19(6)14(22)9(11(8)20)12(21)13-15-17-18-16-13/h2-4,6,20H,5H2,1H3,(H,15,16,17,18)	BJSPTAWUYPPUFC-UHFFFAOYSA-N	CC1Cc2cccc3C(=C(C(=O)c4nn[nH]n4)C(=O)N1c23)O	BroadT	BRD-A59804189	BRD-A59804189-001-05-4	Specs	AE-406/41056481			CC1Cc2cccc3c(O)c(C(=O)c4nn[nH]n4)c(=O)n1c23	InChI=1S/C14H11N5O3/c1-6-5-7-3-2-4-8-10(7)19(6)14(22)9(11(8)20)12(21)13-15-17-18-16-13/h2-4,6,20H,5H2,1H3,(H,15,16,17,18)	BJSPTAWUYPPUFC-UHFFFAOYSA-N	297.086189262							112453
SMR000070182	LSM-23866	SID4258336, BRD-A15615781	2867068	InChI=1S/C18H20O5/c1-10-8-14(22-11(2)17(19)21-3)16-12-6-4-5-7-13(12)18(20)23-15(16)9-10/h8-9,11H,4-7H2,1-3H3	ZWNAXHWQBFOLGY-UHFFFAOYSA-N	COC(=O)C(C)Oc1cc(C)cc2OC(=O)C3=C(CCCC3)c12	BroadT	BRD-A15615781	BRD-A15615781-001-06-7	ChemBridge Corporation	5761558			COC(=O)C(C)Oc1cc(C)cc2oc(=O)c3CCCCc3c12	InChI=1S/C18H20O5/c1-10-8-14(22-11(2)17(19)21-3)16-12-6-4-5-7-13(12)18(20)23-15(16)9-10/h8-9,11H,4-7H2,1-3H3	ZWNAXHWQBFOLGY-UHFFFAOYSA-N	316.13107374							112454
AG-690/11667002	LSM-23867	SID47200762, BRD-K97249368	1106398	InChI=1S/C23H24N2O5S/c1-3-30-19-15-13-18(14-16-19)25(31(27,28)20-9-5-4-6-10-20)17-23(26)24-21-11-7-8-12-22(21)29-2/h4-16H,3,17H2,1-2H3,(H,24,26)	JEOZUGALQXPVFS-UHFFFAOYSA-N	CCOc1ccc(cc1)N(CC(=O)Nc2ccccc2OC)S(=O)(=O)c3ccccc3	BroadT	BRD-K97249368	BRD-K97249368-001-07-3	Asinex Ltd.	BAS 00795001			CCOc1ccc(cc1)N(CC(=O)Nc1ccccc1OC)S(=O)(=O)c1ccccc1	InChI=1S/C23H24N2O5S/c1-3-30-19-15-13-18(14-16-19)25(31(27,28)20-9-5-4-6-10-20)17-23(26)24-21-11-7-8-12-22(21)29-2/h4-16H,3,17H2,1-2H3,(H,24,26)	JEOZUGALQXPVFS-UHFFFAOYSA-N	440.140592578							112455
MLS003130328	LSM-23868	BRD-K83527041, SID99359225	44490867	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m1/s1	DTQFALQSFDATTM-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K83527041	BRD-K83527041-001-01-6	Broad Institute of MIT and Harvard	BRD-K83527041			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m1/s1	DTQFALQSFDATTM-LZJOCLMNSA-N	526.251538196							112456
BRD-K87511271-001-01-7	LSM-23869	BRD-K87511271	44505434	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18-,23-/m1/s1	BYLZCNPQXPGOCE-PMAPCBKXSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)c(OC)c1	BroadT	BRD-K87511271	BRD-K87511271-001-01-7	Broad Institute of MIT and Harvard	BRD-K87511271			COc1ccc(NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)c(OC)c1	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18-,23-/m1/s1	BYLZCNPQXPGOCE-PMAPCBKXSA-N	518.285282996							112457
MLS003130220	LSM-6892	BRD-K02420864, SID99359015	44493079	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28+/m0/s1	CUSMSBFNEHNGNQ-SXDGJLEOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K02420864	BRD-K02420864-001-01-6	Broad Institute of MIT and Harvard	BRD-K02420864			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28+/m0/s1	CUSMSBFNEHNGNQ-SXDGJLEOSA-N	521.300204778							95513
MLS003129493	LSM-8117	BRD-K03155021, SID99357826	44505339	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22+/m0/s1	AWVASGRLDZTAAI-NJNPRVFISA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K03155021	BRD-K03155021-001-01-7	Broad Institute of MIT and Harvard	BRD-K03155021			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22+/m0/s1	AWVASGRLDZTAAI-NJNPRVFISA-N	509.23080458							96738
BRD-K34831527-001-01-5	LSM-23870	BRD-K34831527	44506033	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17+,21+/m0/s1	IQZUEXURVFCKFC-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K34831527	BRD-K34831527-001-01-5	Broad Institute of MIT and Harvard	BRD-K34831527			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17+,21+/m0/s1	IQZUEXURVFCKFC-CSODHUTKSA-N	526.251538196							112458
MLS003129176	LSM-7839	BRD-K76703685	44505597	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m1/s1	APDMZOWNVCUUKT-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K76703685	BRD-K76703685-001-01-3	Broad Institute of MIT and Harvard	BRD-K76703685			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m1/s1	APDMZOWNVCUUKT-OPYAIIAOSA-N	464.31110382							96460
BRD-K07165915-001-01-1	LSM-23871	BRD-K07165915	44506028	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15-,19+/m1/s1	RMZGJSLXUIRDMP-CLCXKQKWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K07165915	BRD-K07165915-001-01-1	Broad Institute of MIT and Harvard	BRD-K07165915			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cnnn2CCCC1=O	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15-,19+/m1/s1	RMZGJSLXUIRDMP-CLCXKQKWSA-N	477.26996729							112459
MLS003129777	LSM-23872	BRD-K31834448	44504953	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22+/m1/s1	IZYFSJYDPLTURU-HMFYCAOWSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K31834448	BRD-K31834448-001-01-8	Broad Institute of MIT and Harvard	BRD-K31834448			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22+/m1/s1	IZYFSJYDPLTURU-HMFYCAOWSA-N	509.23080458							112460
BRD-K86465519-001-01-9	LSM-23873	BRD-K86465519	54631264	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22-,28+/m1/s1	UVZKFWVLTKDOOG-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K86465519	BRD-K86465519-001-01-9	Broad Institute of MIT and Harvard	BRD-K86465519			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cn(CCCC1=O)nn2	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22-,28+/m1/s1	UVZKFWVLTKDOOG-XJGOYTCSSA-N	563.322002862							112461
MLS003129099	LSM-23874	BRD-K92943330	44486350	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19-,24+/m0/s1	BWTMYHAPSQQINJ-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K92943330	BRD-K92943330-001-01-4	Broad Institute of MIT and Harvard	BRD-K92943330			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19-,24+/m0/s1	BWTMYHAPSQQINJ-AXHZCLLHSA-N	496.279803692							112462
BRD-K83637839-001-01-9	LSM-23875	BRD-K83637839	44505467	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18-,23-/m1/s1	NYFKVVDOCVTYTM-PMAPCBKXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K83637839	BRD-K83637839-001-01-9	Broad Institute of MIT and Harvard	BRD-K83637839			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18-,23-/m1/s1	NYFKVVDOCVTYTM-PMAPCBKXSA-N	516.269632932							112463
MLS003130352	LSM-23876	BRD-K49755501, SID99359240	44498137	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20+/m1/s1	IGJDKOMBBXSAPT-UWVAXJGDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K49755501	BRD-K49755501-001-01-9	Broad Institute of MIT and Harvard	BRD-K49755501			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20+/m1/s1	IGJDKOMBBXSAPT-UWVAXJGDSA-N	444.248503564							112464
MLS003129705	LSM-7262	BRD-K31788208	44486354	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21+,25+/m0/s1	WYPGSQIBOYUSAK-BPYKYCOYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K31788208	BRD-K31788208-001-01-6	Broad Institute of MIT and Harvard	BRD-K31788208			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21+,25+/m0/s1	WYPGSQIBOYUSAK-BPYKYCOYSA-N	551.285617354							95883
BRD-K39502340-001-01-2	LSM-23877	BRD-K39502340	44505845	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17-,21+/m0/s1	IQZUEXURVFCKFC-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K39502340	BRD-K39502340-001-01-2	Broad Institute of MIT and Harvard	BRD-K39502340			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17-,21+/m0/s1	IQZUEXURVFCKFC-XGHQBKJUSA-N	526.251538196							112465
MLS003129645	LSM-23878	BRD-K21987714	44505890	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20-,25+/m0/s1	OLIWWUKSUJJEPA-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K21987714	BRD-K21987714-001-01-3	Broad Institute of MIT and Harvard	BRD-K21987714			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20-,25+/m0/s1	OLIWWUKSUJJEPA-ZYLNGJIFSA-N	480.284889072							112466
MLS003129627	LSM-23879	SID99358037, BRD-K43637663	44494082	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28+/m1/s1	CUSMSBFNEHNGNQ-IWHLBADBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K43637663	BRD-K43637663-001-01-9	Broad Institute of MIT and Harvard	BRD-K43637663			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28+/m1/s1	CUSMSBFNEHNGNQ-IWHLBADBSA-N	521.300204778							112467
MLS003129637	LSM-8312	BRD-K64560329	44505623	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15+,19+/m1/s1	RMZGJSLXUIRDMP-VCBZYWHSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K64560329	BRD-K64560329-001-01-3	Broad Institute of MIT and Harvard	BRD-K64560329			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cnnn2CCCC1=O	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15+,19+/m1/s1	RMZGJSLXUIRDMP-VCBZYWHSSA-N	477.26996729							96933
MLS003129709	LSM-7076	BRD-K17360472	44485743	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22+,26+/m1/s1	OIASBGFOQSUHIL-UFPGJGBJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K17360472	BRD-K17360472-001-01-1	Broad Institute of MIT and Harvard	BRD-K17360472			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22+,26+/m1/s1	OIASBGFOQSUHIL-UFPGJGBJSA-N	541.337652926							95697
MLS003129408	LSM-23880	SID99357708, BRD-K34444942	44495969	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28+/m0/s1	CUSMSBFNEHNGNQ-UXWDXCIHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K34444942	BRD-K34444942-001-01-4	Broad Institute of MIT and Harvard	BRD-K34444942			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28+/m0/s1	CUSMSBFNEHNGNQ-UXWDXCIHSA-N	521.300204778							112468
MLS003129327	LSM-23881	SID99357586, BRD-K17136044	44505559	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20+,25+/m1/s1	SUQKGVARFDJMIR-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K17136044	BRD-K17136044-001-01-4	Broad Institute of MIT and Harvard	BRD-K17136044			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20+,25+/m1/s1	SUQKGVARFDJMIR-RNHFSVANSA-N	509.26381927							112469
MLS003129377	LSM-8129	BRD-K07833219	44505136	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22+/m1/s1	AWVASGRLDZTAAI-HMFYCAOWSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K07833219	BRD-K07833219-001-01-7	Broad Institute of MIT and Harvard	BRD-K07833219			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22+/m1/s1	AWVASGRLDZTAAI-HMFYCAOWSA-N	509.23080458							96750
MLS003130251	LSM-7018	BRD-K12682252, SID99359041	44505424	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20-,23-/m1/s1	RIHXBZGHHXCGPP-TXTKFYIRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K12682252	BRD-K12682252-001-01-9	Broad Institute of MIT and Harvard	BRD-K12682252			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20-,23-/m1/s1	RIHXBZGHHXCGPP-TXTKFYIRSA-N	544.31216646							95639
MLS003129742	LSM-8287	BRD-K58310742, SID99358185	44505966	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22-/m1/s1	IZYFSJYDPLTURU-JBYIUTFZSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K58310742	BRD-K58310742-001-01-0	Broad Institute of MIT and Harvard	BRD-K58310742			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22-/m1/s1	IZYFSJYDPLTURU-JBYIUTFZSA-N	509.23080458							96908
MLS003129210	LSM-7775	BRD-K69431670	44505762	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17-,19+/m0/s1	UOJDQXZVAPFQKD-JENIJYKNSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K69431670	BRD-K69431670-001-01-7	Broad Institute of MIT and Harvard	BRD-K69431670			CC(C)COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17-,19+/m0/s1	UOJDQXZVAPFQKD-JENIJYKNSA-N	439.279469334							96396
MLS003129332	LSM-8305	BRD-K63017817, SID99357590	44485739	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25-/m1/s1	KFMYUMLTCHBBFY-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K63017817	BRD-K63017817-001-01-4	Broad Institute of MIT and Harvard	BRD-K63017817			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25-/m1/s1	KFMYUMLTCHBBFY-OHUGHZGNSA-N	529.23588996							96926
BRD-K71367226-001-01-8	LSM-23882	BRD-K71367226	44505989	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15-,17+/m0/s1	SUQCROIYCBRRRP-YQQAZPJKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K71367226	BRD-K71367226-001-01-8	Broad Institute of MIT and Harvard	BRD-K71367226			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15-,17+/m0/s1	SUQCROIYCBRRRP-YQQAZPJKSA-N	463.240639154							112470
MLS003129450	LSM-8365	BRD-K78395012	44505978	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,20+/m1/s1	NSEOCVGIAYKUAZ-UWVAXJGDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K78395012	BRD-K78395012-001-01-0	Broad Institute of MIT and Harvard	BRD-K78395012			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,20+/m1/s1	NSEOCVGIAYKUAZ-UWVAXJGDSA-N	444.248503564							96986
MLS003129473	LSM-23883	BRD-K85772236	44483909	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m0/s1	DTQFALQSFDATTM-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K85772236	BRD-K85772236-001-01-1	Broad Institute of MIT and Harvard	BRD-K85772236			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m0/s1	DTQFALQSFDATTM-CSODHUTKSA-N	526.251538196							112471
MLS003129436	LSM-7074	SID99357779, BRD-K17266676	44505189	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24+/m1/s1	KMYKLRXROVKHNJ-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K17266676	BRD-K17266676-001-01-4	Broad Institute of MIT and Harvard	BRD-K17266676			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24+/m1/s1	KMYKLRXROVKHNJ-IECBHUPTSA-N	496.279803692							95695
MLS003129615	LSM-23884	BRD-K57084585	44506014	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21-/m1/s1	WMEBRZUCENJNIY-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K57084585	BRD-K57084585-001-01-2	Broad Institute of MIT and Harvard	BRD-K57084585			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21-/m1/s1	WMEBRZUCENJNIY-LVCYWYKZSA-N	464.31110382							112472
MLS003129787	LSM-23885	BRD-K99216703	44486361	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17+,22+/m1/s1	DEGZSTUNWMGQCY-JLHGSKIFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K99216703	BRD-K99216703-001-01-7	Broad Institute of MIT and Harvard	BRD-K99216703			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17+,22+/m1/s1	DEGZSTUNWMGQCY-JLHGSKIFSA-N	502.253982868							112473
MLS003129743	LSM-7388	BRD-K42420111, SID99358186	44486956	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19+,24+/m0/s1	BWTMYHAPSQQINJ-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K42420111	BRD-K42420111-001-01-9	Broad Institute of MIT and Harvard	BRD-K42420111			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19+,24+/m0/s1	BWTMYHAPSQQINJ-XLNZFTOWSA-N	496.279803692							96009
BRD-K76713771-001-01-7	LSM-23886	BRD-K76713771	44505432	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18-,23-/m0/s1	BYLZCNPQXPGOCE-BSRJHKFKSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)c(OC)c1	BroadT	BRD-K76713771	BRD-K76713771-001-01-7	Broad Institute of MIT and Harvard	BRD-K76713771			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)c(OC)c1	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18-,23-/m0/s1	BYLZCNPQXPGOCE-BSRJHKFKSA-N	518.285282996							112474
MLS003129765	LSM-8330	BRD-K68741898	44505553	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19+/m0/s1	MNAJUJYQFCFYAB-YQVWRLOYSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K68741898	BRD-K68741898-001-01-6	Broad Institute of MIT and Harvard	BRD-K68741898			CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19+/m0/s1	MNAJUJYQFCFYAB-YQVWRLOYSA-N	439.279469334							96951
BRD-K75023015	LSM-15161		44498562	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22+,28+/m0/s1	UVZKFWVLTKDOOG-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K75023015	BRD-K75023015-001-01-8	Broad Institute of MIT and Harvard	BRD-K75023015			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cn(CCCC1=O)nn2	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22+,28+/m0/s1	UVZKFWVLTKDOOG-PFPZSTESSA-N	563.322002862							103817
MLS003129325	LSM-7978	SID99357584, BRD-K87904079	44496392	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18+,21+/m0/s1	QLGFDRXFQQZFKX-WAOWUJCRSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K87904079	BRD-K87904079-001-01-8	Broad Institute of MIT and Harvard	BRD-K87904079			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18+,21+/m0/s1	QLGFDRXFQQZFKX-WAOWUJCRSA-N	509.23080458							96599
MLS003129250	LSM-23887	BRD-K57026098	44505746	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26+/m0/s1	MSGDIDWYZNYHQU-VVZHRXSXSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K57026098	BRD-K57026098-001-01-3	Broad Institute of MIT and Harvard	BRD-K57026098			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26+/m0/s1	MSGDIDWYZNYHQU-VVZHRXSXSA-N	541.337652926							112475
BRD-K78922936-001-01-4	LSM-23888	BRD-K78922936	44494081	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20+,25-/m1/s1	OKVDUKBBVHEMKE-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K78922936	BRD-K78922936-001-01-4	Broad Institute of MIT and Harvard	BRD-K78922936			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20+,25-/m1/s1	OKVDUKBBVHEMKE-OHUGHZGNSA-N	500.31110382							112476
MLS003129644	LSM-23889	BRD-K08867654	44505431	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m1/s1	HYHIJLYQTCYSKX-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K08867654	BRD-K08867654-001-01-6	Broad Institute of MIT and Harvard	BRD-K08867654			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m1/s1	HYHIJLYQTCYSKX-OPYAIIAOSA-N	458.264153628							112477
MLS003129788	LSM-23890	BRD-K07213247	44498540	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22+/m0/s1	IZYFSJYDPLTURU-NPPFBWRTSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K07213247	BRD-K07213247-001-01-8	Broad Institute of MIT and Harvard	BRD-K07213247			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22+/m0/s1	IZYFSJYDPLTURU-NPPFBWRTSA-N	509.23080458							112478
MLS003129767	LSM-23891	SID99358252, BRD-K38969544	44492054	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19-,22-/m0/s1	YRBTUIBMTXMQGX-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K38969544	BRD-K38969544-001-01-8	Broad Institute of MIT and Harvard	BRD-K38969544			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19-,22-/m0/s1	YRBTUIBMTXMQGX-IPJJNNNSSA-N	473.26381927							112479
MLS003129478	LSM-8363	BRD-K77873562, SID99357813	44505414	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26+/m1/s1	WJAIMBKFVIKGAD-UFPGJGBJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K77873562	BRD-K77873562-001-01-1	Broad Institute of MIT and Harvard	BRD-K77873562			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26+/m1/s1	WJAIMBKFVIKGAD-UFPGJGBJSA-N	541.337652926							96984
MLS003130341	LSM-23892	BRD-K98028441	44505174	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16+/m0/s1	PUHFBKBPROGAIN-SQWLQELKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K98028441	BRD-K98028441-001-01-4	Broad Institute of MIT and Harvard	BRD-K98028441			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16+/m0/s1	PUHFBKBPROGAIN-SQWLQELKSA-N	417.204589832							112480
MLS003129804	LSM-23893	BRD-K22710112	44504993	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15-,17+/m1/s1	SUQCROIYCBRRRP-INMHGKMJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K22710112	BRD-K22710112-001-01-6	Broad Institute of MIT and Harvard	BRD-K22710112			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15-,17+/m1/s1	SUQCROIYCBRRRP-INMHGKMJSA-N	463.240639154							112481
MLS003129287	LSM-23894	BRD-K20256688	44504972	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17-,20-/m1/s1	IGJDKOMBBXSAPT-MBOZVWFJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K20256688	BRD-K20256688-001-01-6	Broad Institute of MIT and Harvard	BRD-K20256688			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17-,20-/m1/s1	IGJDKOMBBXSAPT-MBOZVWFJSA-N	444.248503564							112482
MLS003129405	LSM-15119	BRD-K19969618, SID99357705	44505586	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21-,25-/m0/s1	GHLJLHKVBJDFKH-WATLYSKOSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K19969618	BRD-K19969618-001-01-2	Broad Institute of MIT and Harvard	BRD-K19969618			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21-,25-/m0/s1	GHLJLHKVBJDFKH-WATLYSKOSA-N	551.285617354							103775
MLS003129503	LSM-23895	BRD-K87472370, SID99357835	44484508	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25+/m1/s1	KFMYUMLTCHBBFY-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K87472370	BRD-K87472370-001-01-2	Broad Institute of MIT and Harvard	BRD-K87472370			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25+/m1/s1	KFMYUMLTCHBBFY-FHAGJXEFSA-N	529.23588996							112483
BRD-K25865221-001-01-3	LSM-23896	BRD-K25865221	54631263	InChI=1S/C22H39N5O3/c1-17-12-26(18(2)15-28)22(29)9-6-10-27-20(11-23-24-27)16-30-21(17)14-25(3)13-19-7-4-5-8-19/h11,17-19,21,28H,4-10,12-16H2,1-3H3/t17-,18+,21-/m0/s1	KPNJMWZAUKOQSY-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K25865221	BRD-K25865221-001-01-3	Broad Institute of MIT and Harvard	BRD-K25865221			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C22H39N5O3/c1-17-12-26(18(2)15-28)22(29)9-6-10-27-20(11-23-24-27)16-30-21(17)14-25(3)13-19-7-4-5-8-19/h11,17-19,21,28H,4-10,12-16H2,1-3H3/t17-,18+,21-/m0/s1	KPNJMWZAUKOQSY-UEXGIBASSA-N	421.305290158							112484
MLS003130213	LSM-7426	BRD-K45663104	44485061	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21-,25+/m0/s1	WYPGSQIBOYUSAK-STWLZBDKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K45663104	BRD-K45663104-001-01-0	Broad Institute of MIT and Harvard	BRD-K45663104			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21-,25+/m0/s1	WYPGSQIBOYUSAK-STWLZBDKSA-N	551.285617354							96047
BRD-K38405403-001-01-3	LSM-23897	BRD-K38405403	44483918	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20-,25-/m1/s1	VRVGAAPGNIASDT-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K38405403	BRD-K38405403-001-01-3	Broad Institute of MIT and Harvard	BRD-K38405403			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20-,25-/m1/s1	VRVGAAPGNIASDT-UMEGOILYSA-N	500.31110382							112485
MLS003129151	LSM-23898	BRD-K05229696, SID85812902, SID99357490	44505797	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23+/m0/s1	RIHXBZGHHXCGPP-MIZPHKNDSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K05229696	BRD-K05229696-001-01-2	Broad Institute of MIT and Harvard	BRD-K05229696			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23+/m0/s1	RIHXBZGHHXCGPP-MIZPHKNDSA-N	544.31216646							112486
BRD-K15885089-001-01-4	LSM-23899	BRD-K15885089	44496403	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18+,23+/m1/s1	NYFKVVDOCVTYTM-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K15885089	BRD-K15885089-001-01-4	Broad Institute of MIT and Harvard	BRD-K15885089			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18+,23+/m1/s1	NYFKVVDOCVTYTM-STSQHVNTSA-N	516.269632932							112487
MLS003129180	LSM-23900	BRD-K16670438	44497716	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20+,25+/m0/s1	OLIWWUKSUJJEPA-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K16670438	BRD-K16670438-001-01-7	Broad Institute of MIT and Harvard	BRD-K16670438			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20+,25+/m0/s1	OLIWWUKSUJJEPA-WZOHSFFVSA-N	480.284889072							112488
MLS003129809	LSM-23901	BRD-K51406003	44505377	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16+/m1/s1	KPZGSTQZFNZEDR-FMKPAKJESA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K51406003	BRD-K51406003-001-01-7	Broad Institute of MIT and Harvard	BRD-K51406003			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16+/m1/s1	KPZGSTQZFNZEDR-FMKPAKJESA-N	417.204589832							112489
BRD-K39169716-001-01-6	LSM-23902	BRD-K39169716	44485084	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19-,23+/m0/s1	AIDUMHXRFRBIIP-SFYKDHMMSA-N	COc1ccccc1CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K39169716	BRD-K39169716-001-01-6	Broad Institute of MIT and Harvard	BRD-K39169716			COc1ccccc1CN(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19-,23+/m0/s1	AIDUMHXRFRBIIP-SFYKDHMMSA-N	459.284554714							112490
MLS003129292	LSM-7586	BRD-K55775078	44505608	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21+/m0/s1	HYHIJLYQTCYSKX-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K55775078	BRD-K55775078-001-01-1	Broad Institute of MIT and Harvard	BRD-K55775078			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21+/m0/s1	HYHIJLYQTCYSKX-WAOWUJCRSA-N	458.264153628							96207
MLS003129255	LSM-7454	BRD-K47380281, SID121282475	44485746	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19-,24+/m1/s1	BWTMYHAPSQQINJ-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K47380281	BRD-K47380281-001-01-4	Broad Institute of MIT and Harvard	BRD-K47380281			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19-,24+/m1/s1	BWTMYHAPSQQINJ-IECBHUPTSA-N	496.279803692							96075
MLS003129729	LSM-23903	SID99358172, BRD-K57335415	44505741	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16-/m1/s1	KPZGSTQZFNZEDR-IIAWOOMASA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K57335415	BRD-K57335415-001-01-4	Broad Institute of MIT and Harvard	BRD-K57335415			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16-/m1/s1	KPZGSTQZFNZEDR-IIAWOOMASA-N	417.204589832							112491
MLS003129552	LSM-8256	BRD-K48336086, SID99357927	44504950	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16+/m1/s1	KPZGSTQZFNZEDR-YCPHGPKFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K48336086	BRD-K48336086-001-01-2	Broad Institute of MIT and Harvard	BRD-K48336086			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16+/m1/s1	KPZGSTQZFNZEDR-YCPHGPKFSA-N	417.204589832							96877
MLS003130244	LSM-23904	BRD-K01250897, SID99359034	44505197	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25-/m0/s1	WIMCLPXWPPGBKL-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K01250897	BRD-K01250897-001-01-9	Broad Institute of MIT and Harvard	BRD-K01250897			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25-/m0/s1	WIMCLPXWPPGBKL-RLSLOFABSA-N	509.26381927							112492
MLS003129548	LSM-7246	BRD-K30653168, SID99357923	44505961	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16+/m0/s1	PUHFBKBPROGAIN-OFQRWUPVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K30653168	BRD-K30653168-001-01-1	Broad Institute of MIT and Harvard	BRD-K30653168			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16+/m0/s1	PUHFBKBPROGAIN-OFQRWUPVSA-N	417.204589832							95867
MLS003130348	LSM-7729	BRD-K66035321	44485060	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19+,22+/m1/s1	GMDADKPJAYHJFG-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K66035321	BRD-K66035321-001-01-2	Broad Institute of MIT and Harvard	BRD-K66035321			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19+,22+/m1/s1	GMDADKPJAYHJFG-DXIQSLLYSA-N	457.26890465							96350
MLS003129890	LSM-7910	BRD-K81858438, SID99358392	44505902	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18-,22+/m1/s1	QZCZRKJJOTUXQW-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K81858438	BRD-K81858438-001-01-8	Broad Institute of MIT and Harvard	BRD-K81858438			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18-,22+/m1/s1	QZCZRKJJOTUXQW-HMFYCAOWSA-N	497.261374598							96531
MLS003129422	LSM-8244	BRD-K45028867	44485056	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26+/m1/s1	OIASBGFOQSUHIL-DRLORSAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K45028867	BRD-K45028867-001-01-3	Broad Institute of MIT and Harvard	BRD-K45028867			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26+/m1/s1	OIASBGFOQSUHIL-DRLORSAXSA-N	541.337652926							96865
MLS003129667	LSM-23905	BRD-K62894593	44505837	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17+,21+/m1/s1	IQZUEXURVFCKFC-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K62894593	BRD-K62894593-001-01-7	Broad Institute of MIT and Harvard	BRD-K62894593			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17+,21+/m1/s1	IQZUEXURVFCKFC-WWMYMODYSA-N	526.251538196							112493
MLS003129366	LSM-7416	BRD-K44890352	44486345	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15+,18+/m1/s1	HEIBNMHSSNMFIU-VKJFTORMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K44890352	BRD-K44890352-001-01-9	Broad Institute of MIT and Harvard	BRD-K44890352			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15+,18+/m1/s1	HEIBNMHSSNMFIU-VKJFTORMSA-N	407.253254586							96037
MLS003129360	LSM-23906	SID99357668, BRD-K88255477	44506021	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18+,23+/m1/s1	BYLZCNPQXPGOCE-STSQHVNTSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)c(OC)c1	BroadT	BRD-K88255477	BRD-K88255477-001-01-2	Broad Institute of MIT and Harvard	BRD-K88255477			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)c(OC)c1	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18+,23+/m1/s1	BYLZCNPQXPGOCE-STSQHVNTSA-N	518.285282996							112494
MLS003130339	LSM-23907	SID99359231, BRD-K63628981	44488157	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19-,22+/m1/s1	YRBTUIBMTXMQGX-KNKQGSTJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K63628981	BRD-K63628981-001-01-8	Broad Institute of MIT and Harvard	BRD-K63628981			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19-,22+/m1/s1	YRBTUIBMTXMQGX-KNKQGSTJSA-N	473.26381927							112495
BRD-K38074284-001-01-1	LSM-23908	BRD-K38074284	44494937	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17-,21+/m1/s1	HYXYHDZNHQRBPW-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K38074284	BRD-K38074284-001-01-1	Broad Institute of MIT and Harvard	BRD-K38074284			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17-,21+/m1/s1	HYXYHDZNHQRBPW-LZJOCLMNSA-N	476.254731796							112496
MLS003129189	LSM-7086	BRD-K18273607	44496391	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18-,21+/m1/s1	QLGFDRXFQQZFKX-OPYAIIAOSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K18273607	BRD-K18273607-001-01-3	Broad Institute of MIT and Harvard	BRD-K18273607			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18-,21+/m1/s1	QLGFDRXFQQZFKX-OPYAIIAOSA-N	509.23080458							95707
MLS003129291	LSM-23909	SID99357553, BRD-K85901248	44505499	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20-,24+/m0/s1	XBPVHNZVBFLVIV-MZLICYQSSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K85901248	BRD-K85901248-001-01-2	Broad Institute of MIT and Harvard	BRD-K85901248			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc2cnnn2CCCC1=O	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20-,24+/m0/s1	XBPVHNZVBFLVIV-MZLICYQSSA-N	501.295119398							112497
BRD-K81485190-001-01-8	LSM-23910	BRD-K81485190	44496402	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18+,23-/m1/s1	NYFKVVDOCVTYTM-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K81485190	BRD-K81485190-001-01-8	Broad Institute of MIT and Harvard	BRD-K81485190			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18+,23-/m1/s1	NYFKVVDOCVTYTM-IEGUWTFLSA-N	516.269632932							112498
MLS003129139	LSM-8143	BRD-K13879491, SID99357480	44486342	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25+/m1/s1	KFMYUMLTCHBBFY-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K13879491	BRD-K13879491-001-01-1	Broad Institute of MIT and Harvard	BRD-K13879491			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25+/m1/s1	KFMYUMLTCHBBFY-RNHFSVANSA-N	529.23588996							96764
MLS003129403	LSM-23911	SID99357703, BRD-K84179294	44484529	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15-,19+/m1/s1	ZMFVFBQYBHAIKE-CLCXKQKWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K84179294	BRD-K84179294-001-01-9	Broad Institute of MIT and Harvard	BRD-K84179294			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15-,19+/m1/s1	ZMFVFBQYBHAIKE-CLCXKQKWSA-N	477.26996729							112499
BRD-K65084374-001-01-7	LSM-23912	BRD-K65084374	54631265	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22-,28+/m0/s1	UVZKFWVLTKDOOG-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K65084374	BRD-K65084374-001-01-7	Broad Institute of MIT and Harvard	BRD-K65084374			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cn(CCCC1=O)nn2	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22-,28+/m0/s1	UVZKFWVLTKDOOG-RXYILKCJSA-N	563.322002862							112500
MLS003129747	LSM-8113	BRD-K02419152	44505747	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,20+/m0/s1	NSEOCVGIAYKUAZ-SQGPQFPESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K02419152	BRD-K02419152-001-01-9	Broad Institute of MIT and Harvard	BRD-K02419152			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,20+/m0/s1	NSEOCVGIAYKUAZ-SQGPQFPESA-N	444.248503564							96734
BRD-K90355462-001-01-3	LSM-23913	BRD-K90355462	54631260	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22-,28+/m0/s1	DAHNEQAICFEUKA-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cnnn4CCCC1=O	BroadT	BRD-K90355462	BRD-K90355462-001-01-3	Broad Institute of MIT and Harvard	BRD-K90355462			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cnnn2CCCC1=O	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22-,28+/m0/s1	DAHNEQAICFEUKA-RXYILKCJSA-N	563.322002862							112501
BRD-K87587780-001-01-1	LSM-23914	BRD-K87587780	54631266	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22+,28-/m1/s1	UVZKFWVLTKDOOG-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K87587780	BRD-K87587780-001-01-1	Broad Institute of MIT and Harvard	BRD-K87587780			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cn(CCCC1=O)nn2	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22+,28-/m1/s1	UVZKFWVLTKDOOG-RZIGYZOXSA-N	563.322002862							112502
MLS003129230	LSM-23915	SID99357433, BRD-K27682976	44491466	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19-,23+/m0/s1	QHTRHHVBBSPOHC-SFYKDHMMSA-N	COc1ccccc1CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K27682976	BRD-K27682976-001-01-7	Broad Institute of MIT and Harvard	BRD-K27682976			COc1ccccc1CN(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19-,23+/m0/s1	QHTRHHVBBSPOHC-SFYKDHMMSA-N	459.284554714							112503
MLS003129402	LSM-23916	SID99357702, BRD-K70468179	44491449	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15-,17+/m1/s1	CMMUKIKJYLMGMW-INMHGKMJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K70468179	BRD-K70468179-001-01-2	Broad Institute of MIT and Harvard	BRD-K70468179			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15-,17+/m1/s1	CMMUKIKJYLMGMW-INMHGKMJSA-N	463.240639154							131265
MLS003129593	LSM-23917	BRD-K56272400, SID99358008	44505067	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18+,22+/m1/s1	QZCZRKJJOTUXQW-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K56272400	BRD-K56272400-001-01-7	Broad Institute of MIT and Harvard	BRD-K56272400			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18+,22+/m1/s1	QZCZRKJJOTUXQW-FGSXEWAUSA-N	497.261374598							131266
BRD-K19635653-001-01-5	LSM-23918	BRD-K19635653	54631267	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22+,28+/m1/s1	UVZKFWVLTKDOOG-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K19635653	BRD-K19635653-001-01-5	Broad Institute of MIT and Harvard	BRD-K19635653			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cn(CCCC1=O)nn2	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22+,28+/m1/s1	UVZKFWVLTKDOOG-WENCSYSZSA-N	563.322002862							112508
MLS003129676	LSM-8251	BRD-K48005659	44505171	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20+/m0/s1	JYOVEVCXPRGJRX-SQGPQFPESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K48005659	BRD-K48005659-001-01-0	Broad Institute of MIT and Harvard	BRD-K48005659			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20+/m0/s1	JYOVEVCXPRGJRX-SQGPQFPESA-N	497.210818064							96872
MLS003129137	LSM-8337	BRD-K69565703, SID99357478	44505995	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24-/m0/s1	KMYKLRXROVKHNJ-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K69565703	BRD-K69565703-001-01-3	Broad Institute of MIT and Harvard	BRD-K69565703			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24-/m0/s1	KMYKLRXROVKHNJ-JXQFQVJHSA-N	496.279803692							96958
MLS003129603	LSM-23919	BRD-K02490470	44491454	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19-,22+/m0/s1	YRBTUIBMTXMQGX-CNNODRBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K02490470	BRD-K02490470-001-01-5	Broad Institute of MIT and Harvard	BRD-K02490470			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19-,22+/m0/s1	YRBTUIBMTXMQGX-CNNODRBYSA-N	473.26381927							112509
MLS003129338	LSM-7014	BRD-K12584650	44484513	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19+,24+/m1/s1	XYWPMUCHOREPKK-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K12584650	BRD-K12584650-001-01-5	Broad Institute of MIT and Harvard	BRD-K12584650			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19+,24+/m1/s1	XYWPMUCHOREPKK-IMWIBFENSA-N	510.259068248							95635
MLS003129393	LSM-23920	SID99357696, BRD-K19812920	44505427	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20-,23-/m0/s1	RIHXBZGHHXCGPP-JTAQYXEDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K19812920	BRD-K19812920-001-01-7	Broad Institute of MIT and Harvard	BRD-K19812920			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20-,23-/m0/s1	RIHXBZGHHXCGPP-JTAQYXEDSA-N	544.31216646							112510
MLS003130358	LSM-23921	SID99359245, BRD-K13642674	44506026	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17+,21-/m1/s1	IQZUEXURVFCKFC-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K13642674	BRD-K13642674-001-01-2	Broad Institute of MIT and Harvard	BRD-K13642674			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17+,21-/m1/s1	IQZUEXURVFCKFC-LLGFUMIMSA-N	526.251538196							112511
MLS003129745	LSM-8062	BRD-K94834134	44505401	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25+/m1/s1	WIMCLPXWPPGBKL-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K94834134	BRD-K94834134-001-01-1	Broad Institute of MIT and Harvard	BRD-K94834134			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25+/m1/s1	WIMCLPXWPPGBKL-FHAGJXEFSA-N	509.26381927							96683
MLS003129309	LSM-23922	SID99357569, BRD-K02828624	44488692	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19-,22+/m1/s1	GMDADKPJAYHJFG-KNKQGSTJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K02828624	BRD-K02828624-001-01-1	Broad Institute of MIT and Harvard	BRD-K02828624			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19-,22+/m1/s1	GMDADKPJAYHJFG-KNKQGSTJSA-N	457.26890465							112512
MLS003130331	LSM-8193	BRD-K31866446, SID99359227	44505379	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20+/m1/s1	JYOVEVCXPRGJRX-UWVAXJGDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K31866446	BRD-K31866446-001-01-2	Broad Institute of MIT and Harvard	BRD-K31866446			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20+/m1/s1	JYOVEVCXPRGJRX-UWVAXJGDSA-N	497.210818064							96814
MLS003129652	LSM-23923	BRD-K62706744	44484510	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15+,18+/m0/s1	HEIBNMHSSNMFIU-HDMKZQKVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K62706744	BRD-K62706744-001-01-1	Broad Institute of MIT and Harvard	BRD-K62706744			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15+,18+/m0/s1	HEIBNMHSSNMFIU-HDMKZQKVSA-N	407.253254586							112513
MLS003129482	LSM-8212	BRD-K36674158, SID99357817	44504971	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26-/m1/s1	MSGDIDWYZNYHQU-TVZXLZGTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K36674158	BRD-K36674158-001-01-3	Broad Institute of MIT and Harvard	BRD-K36674158			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26-/m1/s1	MSGDIDWYZNYHQU-TVZXLZGTSA-N	541.337652926							96833
MLS003129352	LSM-23924	SID99357662, BRD-K85705844	44494480	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15+,18+/m1/s1	WXHQIOUFBAEATF-VKJFTORMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K85705844	BRD-K85705844-001-01-5	Broad Institute of MIT and Harvard	BRD-K85705844			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2cnnn2CCCC1=O	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15+,18+/m1/s1	WXHQIOUFBAEATF-VKJFTORMSA-N	407.253254586							112514
BRD-K95689688-001-01-8	LSM-23925	BRD-K95689688	54631261	InChI=1S/C22H39N5O3/c1-17-12-26(18(2)15-28)22(29)9-6-10-27-20(11-23-24-27)16-30-21(17)14-25(3)13-19-7-4-5-8-19/h11,17-19,21,28H,4-10,12-16H2,1-3H3/t17-,18-,21-/m1/s1	KPNJMWZAUKOQSY-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K95689688	BRD-K95689688-001-01-8	Broad Institute of MIT and Harvard	BRD-K95689688			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C22H39N5O3/c1-17-12-26(18(2)15-28)22(29)9-6-10-27-20(11-23-24-27)16-30-21(17)14-25(3)13-19-7-4-5-8-19/h11,17-19,21,28H,4-10,12-16H2,1-3H3/t17-,18-,21-/m1/s1	KPNJMWZAUKOQSY-DBXWQHBBSA-N	421.305290158							112515
MLS003129744	LSM-23926	BRD-K71029709	44504981	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15+,18-/m1/s1	WXHQIOUFBAEATF-RVKKMQEKSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K71029709	BRD-K71029709-001-01-0	Broad Institute of MIT and Harvard	BRD-K71029709			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2cnnn2CCCC1=O	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15+,18-/m1/s1	WXHQIOUFBAEATF-RVKKMQEKSA-N	407.253254586							112516
MLS003129715	LSM-23927	SID99358158, BRD-K41424015	44494479	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18-,21-/m0/s1	QLGFDRXFQQZFKX-WFXMLNOXSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K41424015	BRD-K41424015-001-01-9	Broad Institute of MIT and Harvard	BRD-K41424015			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18-,21-/m0/s1	QLGFDRXFQQZFKX-WFXMLNOXSA-N	509.23080458							112517
MLS003129326	LSM-8247	BRD-K45937204, SID99357585	44504988	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m1/s1	MESWQEBVROHANN-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K45937204	BRD-K45937204-001-01-7	Broad Institute of MIT and Harvard	BRD-K45937204			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m1/s1	MESWQEBVROHANN-WOIUINJBSA-N	457.26890465							96868
MLS003129664	LSM-23928	BRD-K04237818	44505808	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18-,23+/m1/s1	BYLZCNPQXPGOCE-PNCHPQGNSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)c(OC)c1	BroadT	BRD-K04237818	BRD-K04237818-001-01-9	Broad Institute of MIT and Harvard	BRD-K04237818			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)c(OC)c1	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18-,23+/m1/s1	BYLZCNPQXPGOCE-PNCHPQGNSA-N	518.285282996							112518
MLS003129793	LSM-23929	BRD-K11571815, SID99358273	44505984	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15+,18+/m0/s1	WXHQIOUFBAEATF-HDMKZQKVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K11571815	BRD-K11571815-001-01-5	Broad Institute of MIT and Harvard	BRD-K11571815			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2cnnn2CCCC1=O	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15+,18+/m0/s1	WXHQIOUFBAEATF-HDMKZQKVSA-N	407.253254586							112519
MLS003129673	LSM-23930	BRD-K36882679	44504970	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17-,20+/m1/s1	IGJDKOMBBXSAPT-HLIPFELVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K36882679	BRD-K36882679-001-01-2	Broad Institute of MIT and Harvard	BRD-K36882679			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17-,20+/m1/s1	IGJDKOMBBXSAPT-HLIPFELVSA-N	444.248503564							112520
MLS003130355	LSM-8116	BRD-K02811477	44484511	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26+/m0/s1	OIASBGFOQSUHIL-AOJNWGRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K02811477	BRD-K02811477-001-01-5	Broad Institute of MIT and Harvard	BRD-K02811477			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26+/m0/s1	OIASBGFOQSUHIL-AOJNWGRGSA-N	541.337652926							96737
MLS003129231	LSM-7209	BRD-K28179362	44506094	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20+,24+/m0/s1	XBPVHNZVBFLVIV-DCLXLUIPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K28179362	BRD-K28179362-001-01-5	Broad Institute of MIT and Harvard	BRD-K28179362			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc2cnnn2CCCC1=O	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20+,24+/m0/s1	XBPVHNZVBFLVIV-DCLXLUIPSA-N	501.295119398							95830
MLS003129655	LSM-8402	BRD-K89595887, SID99358056	44505974	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,20+/m0/s1	NSEOCVGIAYKUAZ-ABSDTBQOSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K89595887	BRD-K89595887-001-01-4	Broad Institute of MIT and Harvard	BRD-K89595887			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,20+/m0/s1	NSEOCVGIAYKUAZ-ABSDTBQOSA-N	444.248503564							97023
MLS003129350	LSM-23931	BRD-K06431655	44505044	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20+,25+/m1/s1	OLIWWUKSUJJEPA-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K06431655	BRD-K06431655-001-01-2	Broad Institute of MIT and Harvard	BRD-K06431655			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20+,25+/m1/s1	OLIWWUKSUJJEPA-RNHFSVANSA-N	480.284889072							112521
MLS003129523	LSM-23932	BRD-K75499899	44505819	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21+/m1/s1	HYHIJLYQTCYSKX-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K75499899	BRD-K75499899-001-01-1	Broad Institute of MIT and Harvard	BRD-K75499899			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21+/m1/s1	HYHIJLYQTCYSKX-LQWHRVPQSA-N	458.264153628							112522
MLS003129485	LSM-8328	BRD-K68458302, SID99357819	44505421	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26+/m0/s1	WJAIMBKFVIKGAD-AOJNWGRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K68458302	BRD-K68458302-001-01-7	Broad Institute of MIT and Harvard	BRD-K68458302			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26+/m0/s1	WJAIMBKFVIKGAD-AOJNWGRGSA-N	541.337652926							96949
BRD-K11457033-001-01-3	LSM-23933	BRD-K11457033	44505451	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15-,19+/m0/s1	RMZGJSLXUIRDMP-YZVOILCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K11457033	BRD-K11457033-001-01-3	Broad Institute of MIT and Harvard	BRD-K11457033			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cnnn2CCCC1=O	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15-,19+/m0/s1	RMZGJSLXUIRDMP-YZVOILCLSA-N	477.26996729							112523
MLS003129370	LSM-7093	BRD-K19016577, SID85812511, SID99357676	44505406	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25+/m1/s1	WIMCLPXWPPGBKL-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K19016577	BRD-K19016577-001-01-1	Broad Institute of MIT and Harvard	BRD-K19016577			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25+/m1/s1	WIMCLPXWPPGBKL-RNHFSVANSA-N	509.26381927							95714
MLS003129399	LSM-23934	BRD-K91976771	44505960	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16+/m1/s1	PUHFBKBPROGAIN-YCPHGPKFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K91976771	BRD-K91976771-001-01-1	Broad Institute of MIT and Harvard	BRD-K91976771			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16+/m1/s1	PUHFBKBPROGAIN-YCPHGPKFSA-N	417.204589832							112524
MLS003130336	LSM-23935	BRD-K98427581	44486965	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20+,23+/m1/s1	PUSZFNDBKFADMS-QTEQDKRBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K98427581	BRD-K98427581-001-01-8	Broad Institute of MIT and Harvard	BRD-K98427581			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20+,23+/m1/s1	PUSZFNDBKFADMS-QTEQDKRBSA-N	544.31216646							112525
MLS003129458	LSM-23936	BRD-K08498948	44504976	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20-/m0/s1	IGJDKOMBBXSAPT-QKLQHJQFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K08498948	BRD-K08498948-001-01-6	Broad Institute of MIT and Harvard	BRD-K08498948			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20-/m0/s1	IGJDKOMBBXSAPT-QKLQHJQFSA-N	444.248503564							112526
MLS003129119	LSM-8354	BRD-K75090853	44505965	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17-,20+/m0/s1	JYOVEVCXPRGJRX-ABSDTBQOSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K75090853	BRD-K75090853-001-01-2	Broad Institute of MIT and Harvard	BRD-K75090853			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17-,20+/m0/s1	JYOVEVCXPRGJRX-ABSDTBQOSA-N	497.210818064							96975
MLS003130238	LSM-23937	BRD-K73562260, SID99359029	44484527	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15-,19+/m0/s1	ZMFVFBQYBHAIKE-YZVOILCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K73562260	BRD-K73562260-001-01-9	Broad Institute of MIT and Harvard	BRD-K73562260			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15-,19+/m0/s1	ZMFVFBQYBHAIKE-YZVOILCLSA-N	477.26996729							112527
MLS003129181	LSM-23938	BRD-K55916310	44505185	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24-/m1/s1	KMYKLRXROVKHNJ-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K55916310	BRD-K55916310-001-01-9	Broad Institute of MIT and Harvard	BRD-K55916310			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24-/m1/s1	KMYKLRXROVKHNJ-YDIMBITNSA-N	496.279803692							112528
MLS003129711	LSM-8111	BRD-K02257023, SID99358155	44504994	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22-/m1/s1	MESWQEBVROHANN-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K02257023	BRD-K02257023-001-01-0	Broad Institute of MIT and Harvard	BRD-K02257023			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22-/m1/s1	MESWQEBVROHANN-XQBPLPMBSA-N	457.26890465							96732
MLS003129192	LSM-23939	SID99357403, BRD-K26560172	44505179	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15-,18+/m1/s1	WXHQIOUFBAEATF-RKVPGOIHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K26560172	BRD-K26560172-001-01-8	Broad Institute of MIT and Harvard	BRD-K26560172			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2cnnn2CCCC1=O	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15-,18+/m1/s1	WXHQIOUFBAEATF-RKVPGOIHSA-N	407.253254586							112529
MLS003129690	LSM-23940	BRD-K04409515, SID99358139	44505752	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	SUQKGVARFDJMIR-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K04409515	BRD-K04409515-001-01-0	Broad Institute of MIT and Harvard	BRD-K04409515			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	SUQKGVARFDJMIR-WZOHSFFVSA-N	509.26381927							112530
MLS003129297	LSM-23941	BRD-K77548697	44505992	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m0/s1	MESWQEBVROHANN-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K77548697	BRD-K77548697-001-01-7	Broad Institute of MIT and Harvard	BRD-K77548697			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m0/s1	MESWQEBVROHANN-IPJJNNNSSA-N	457.26890465							112531
MLS003129407	LSM-23942	SID99357707, BRD-K84161093	44505468	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18-,23+/m0/s1	GOEWTOAFXZXQCM-IUKKYPGJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K84161093	BRD-K84161093-001-01-0	Broad Institute of MIT and Harvard	BRD-K84161093			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18-,23+/m0/s1	GOEWTOAFXZXQCM-IUKKYPGJSA-N	473.26381927							112532
MLS003129351	LSM-23943	BRD-K96845170, SID99357661	44498552	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18-,23+/m1/s1	GOEWTOAFXZXQCM-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K96845170	BRD-K96845170-001-01-0	Broad Institute of MIT and Harvard	BRD-K96845170			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18-,23+/m1/s1	GOEWTOAFXZXQCM-PNCHPQGNSA-N	473.26381927							112533
MLS003130330	LSM-23944	BRD-K48784442	44484524	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20+,23+/m0/s1	PUSZFNDBKFADMS-MIZPHKNDSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K48784442	BRD-K48784442-001-01-2	Broad Institute of MIT and Harvard	BRD-K48784442			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20+,23+/m0/s1	PUSZFNDBKFADMS-MIZPHKNDSA-N	544.31216646							112534
MLS003130345	LSM-23945	BRD-K79576342, SID99359234	44505402	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	JATGFWCPGFHVCF-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K79576342	BRD-K79576342-001-01-5	Broad Institute of MIT and Harvard	BRD-K79576342			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	JATGFWCPGFHVCF-WZOHSFFVSA-N	509.26381927							112535
MLS003129138	LSM-8417	BRD-K96218183, SID99357479	44488158	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22-/m0/s1	YRBTUIBMTXMQGX-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K96218183	BRD-K96218183-001-01-5	Broad Institute of MIT and Harvard	BRD-K96218183			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22-/m0/s1	YRBTUIBMTXMQGX-JQVVWYNYSA-N	473.26381927							97038
MLS003129227	LSM-23946	BRD-K18290923, SID99357430	44497712	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19-/m0/s1	MNAJUJYQFCFYAB-SCTDSRPQSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K18290923	BRD-K18290923-001-01-4	Broad Institute of MIT and Harvard	BRD-K18290923			CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19-/m0/s1	MNAJUJYQFCFYAB-SCTDSRPQSA-N	439.279469334							112536
MLS003129748	LSM-23947	BRD-K21906179	44494488	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13-,15+/m0/s1	FOLOUAULJSJVDY-KCQAQPDRSA-N	CNC[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K21906179	BRD-K21906179-001-01-1	Broad Institute of MIT and Harvard	BRD-K21906179			CNC[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13-,15+/m0/s1	FOLOUAULJSJVDY-KCQAQPDRSA-N	339.227039838							112537
MLS003129716	LSM-7780	SID99358159, BRD-K69792860	44506093	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20-,24+/m1/s1	XBPVHNZVBFLVIV-REHUZNOOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K69792860	BRD-K69792860-001-01-2	Broad Institute of MIT and Harvard	BRD-K69792860			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc2cnnn2CCCC1=O	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20-,24+/m1/s1	XBPVHNZVBFLVIV-REHUZNOOSA-N	501.295119398							96401
MLS003129476	LSM-23948	SID99357811, BRD-K38638827	44505450	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15-,19-/m0/s1	RMZGJSLXUIRDMP-DOXZYTNZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K38638827	BRD-K38638827-001-01-7	Broad Institute of MIT and Harvard	BRD-K38638827			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cnnn2CCCC1=O	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15-,19-/m0/s1	RMZGJSLXUIRDMP-DOXZYTNZSA-N	477.26996729							112538
MLS003129773	LSM-23949	BRD-K72157761	44505939	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22+/m0/s1	AWVASGRLDZTAAI-NPPFBWRTSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K72157761	BRD-K72157761-001-01-3	Broad Institute of MIT and Harvard	BRD-K72157761			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22+/m0/s1	AWVASGRLDZTAAI-NPPFBWRTSA-N	509.23080458							112539
MLS003129205	LSM-23950	BRD-K65135171, SID99357415	44505162	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16+/m0/s1	KPZGSTQZFNZEDR-SQWLQELKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K65135171	BRD-K65135171-001-01-2	Broad Institute of MIT and Harvard	BRD-K65135171			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16+/m0/s1	KPZGSTQZFNZEDR-SQWLQELKSA-N	417.204589832							112540
MLS003129363	LSM-7944	BRD-K85398522, SID99357670	44486959	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19-,22+/m0/s1	GMDADKPJAYHJFG-CNNODRBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K85398522	BRD-K85398522-001-01-8	Broad Institute of MIT and Harvard	BRD-K85398522			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19-,22+/m0/s1	GMDADKPJAYHJFG-CNNODRBYSA-N	457.26890465							96565
MLS003129537	LSM-7547	BRD-K53839527, SID99357915	44505415	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23-/m0/s1	RIHXBZGHHXCGPP-MZKRTTBSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K53839527	BRD-K53839527-001-01-4	Broad Institute of MIT and Harvard	BRD-K53839527			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23-/m0/s1	RIHXBZGHHXCGPP-MZKRTTBSSA-N	544.31216646							96168
MLS003129525	LSM-8016	BRD-K92125320, SID99357905	44496834	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18-,22+/m1/s1	DMKVVNQLOZTLAB-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K92125320	BRD-K92125320-001-01-0	Broad Institute of MIT and Harvard	BRD-K92125320			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18-,22+/m1/s1	DMKVVNQLOZTLAB-HMFYCAOWSA-N	497.261374598							96637
MLS003129239	LSM-8156	BRD-K18699770	44488153	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15+,17+/m0/s1	CMMUKIKJYLMGMW-ZMSDIMECSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K18699770	BRD-K18699770-001-01-0	Broad Institute of MIT and Harvard	BRD-K18699770			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15+,17+/m0/s1	CMMUKIKJYLMGMW-ZMSDIMECSA-N	463.240639154							96777
MLS003129619	LSM-23951	SID99358029, BRD-K77616885	44493584	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18+,22+/m0/s1	DMKVVNQLOZTLAB-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K77616885	BRD-K77616885-001-01-4	Broad Institute of MIT and Harvard	BRD-K77616885			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18+,22+/m0/s1	DMKVVNQLOZTLAB-NJNPRVFISA-N	497.261374598							112541
MLS003129601	LSM-7829	BRD-K75707803, SID99358012	44485754	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20-,23+/m1/s1	PUSZFNDBKFADMS-VIZSFHNOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K75707803	BRD-K75707803-001-01-2	Broad Institute of MIT and Harvard	BRD-K75707803			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20-,23+/m1/s1	PUSZFNDBKFADMS-VIZSFHNOSA-N	544.31216646							96450
MLS003129487	LSM-23952	SID99357821, BRD-K80236424	44495437	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17+,21-/m1/s1	HYXYHDZNHQRBPW-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K80236424	BRD-K80236424-001-01-4	Broad Institute of MIT and Harvard	BRD-K80236424			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17+,21-/m1/s1	HYXYHDZNHQRBPW-LLGFUMIMSA-N	476.254731796							112542
MLS003129589	LSM-8378	BRD-K82494568, SID99357957	44489806	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22+/m0/s1	YRBTUIBMTXMQGX-NNMXDRDESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K82494568	BRD-K82494568-001-01-3	Broad Institute of MIT and Harvard	BRD-K82494568			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22+/m0/s1	YRBTUIBMTXMQGX-NNMXDRDESA-N	473.26381927							96999
MLS003129333	LSM-23953	BRD-K45338937	44486353	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19+,22+/m0/s1	GMDADKPJAYHJFG-NNMXDRDESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K45338937	BRD-K45338937-001-01-2	Broad Institute of MIT and Harvard	BRD-K45338937			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O4/c1-18-13-29(19(2)16-30)23(31)10-7-11-28-14-21(25-26-28)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,30H,7,10-13,15-17H2,1-3H3/t18-,19+,22+/m0/s1	GMDADKPJAYHJFG-NNMXDRDESA-N	457.26890465							112543
BRD-K14262987-001-01-0	LSM-23954	BRD-K14262987	44505464	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18-,23-/m0/s1	NYFKVVDOCVTYTM-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K14262987	BRD-K14262987-001-01-0	Broad Institute of MIT and Harvard	BRD-K14262987			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18-,23-/m0/s1	NYFKVVDOCVTYTM-BSRJHKFKSA-N	516.269632932							112544
MLS003129558	LSM-23955	SID99357933, BRD-K38144989	44505582	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19-/m1/s1	MNAJUJYQFCFYAB-ZIFCJYIRSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K38144989	BRD-K38144989-001-01-0	Broad Institute of MIT and Harvard	BRD-K38144989			CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19-/m1/s1	MNAJUJYQFCFYAB-ZIFCJYIRSA-N	439.279469334							112545
MLS003129731	LSM-23956	BRD-K48832780	44506027	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17+,21-/m0/s1	IQZUEXURVFCKFC-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K48832780	BRD-K48832780-001-01-9	Broad Institute of MIT and Harvard	BRD-K48832780			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17+,21-/m0/s1	IQZUEXURVFCKFC-FVJLSDCUSA-N	526.251538196							112546
MLS003129519	LSM-8279	BRD-K56349799, SID99357901	44505555	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25-/m1/s1	WIMCLPXWPPGBKL-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K56349799	BRD-K56349799-001-01-2	Broad Institute of MIT and Harvard	BRD-K56349799			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25-/m1/s1	WIMCLPXWPPGBKL-OHUGHZGNSA-N	509.26381927							96900
BRD-K02687261-001-01-9	LSM-23957	BRD-K02687261	44485083	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19-,23+/m1/s1	AIDUMHXRFRBIIP-PWHSHALESA-N	COc1ccccc1CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K02687261	BRD-K02687261-001-01-9	Broad Institute of MIT and Harvard	BRD-K02687261			COc1ccccc1CN(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19-,23+/m1/s1	AIDUMHXRFRBIIP-PWHSHALESA-N	459.284554714							112547
MLS003129800	LSM-23958	SID99358280, BRD-K95895516	44505749	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17-/m1/s1	SUQCROIYCBRRRP-HLLBOEOZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K95895516	BRD-K95895516-001-01-9	Broad Institute of MIT and Harvard	BRD-K95895516			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17-/m1/s1	SUQCROIYCBRRRP-HLLBOEOZSA-N	463.240639154							112548
MLS003129724	LSM-23959	SID99358167, BRD-K38691724	44505346	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18-,21+/m0/s1	QLGFDRXFQQZFKX-BBTUJRGHSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K38691724	BRD-K38691724-001-01-0	Broad Institute of MIT and Harvard	BRD-K38691724			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18-,21+/m0/s1	QLGFDRXFQQZFKX-BBTUJRGHSA-N	509.23080458							112549
MLS003129148	LSM-7437	BRD-K46370825, SID99357488	44505383	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24+/m0/s1	DZRIWTKXHLXUTO-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K46370825	BRD-K46370825-001-01-9	Broad Institute of MIT and Harvard	BRD-K46370825			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24+/m0/s1	DZRIWTKXHLXUTO-XLNZFTOWSA-N	510.259068248							96058
MLS003129379	LSM-23960	BRD-K58696904	44505793	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18-,21-/m1/s1	WMEBRZUCENJNIY-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K58696904	BRD-K58696904-001-01-6	Broad Institute of MIT and Harvard	BRD-K58696904			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18-,21-/m1/s1	WMEBRZUCENJNIY-DBXWQHBBSA-N	464.31110382							112550
BRD-K11992628-001-01-0	LSM-23961	BRD-K11992628	44505772	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25+/m0/s1	WIMCLPXWPPGBKL-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K11992628	BRD-K11992628-001-01-0	Broad Institute of MIT and Harvard	BRD-K11992628			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25+/m0/s1	WIMCLPXWPPGBKL-ZYLNGJIFSA-N	509.26381927							112551
MLS003129328	LSM-23962	SID121282481, BRD-K90491189	44504975	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,20+/m1/s1	NSEOCVGIAYKUAZ-HLIPFELVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K90491189	BRD-K90491189-001-01-8	Broad Institute of MIT and Harvard	BRD-K90491189			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,20+/m1/s1	NSEOCVGIAYKUAZ-HLIPFELVSA-N	444.248503564							112552
MLS003129571	LSM-23963	BRD-K93784417	44498547	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18+,23+/m0/s1	BYLZCNPQXPGOCE-YZZKKUAISA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)c(OC)c1	BroadT	BRD-K93784417	BRD-K93784417-001-01-7	Broad Institute of MIT and Harvard	BRD-K93784417			COc1ccc(NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)c(OC)c1	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18+,23+/m0/s1	BYLZCNPQXPGOCE-YZZKKUAISA-N	518.285282996							112553
MLS003129732	LSM-23964	SID99358175, BRD-K63778487	44506002	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19-/m0/s1	MNAJUJYQFCFYAB-LNLFQRSKSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K63778487	BRD-K63778487-001-01-0	Broad Institute of MIT and Harvard	BRD-K63778487			CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19-/m0/s1	MNAJUJYQFCFYAB-LNLFQRSKSA-N	439.279469334							112554
MLS003129242	LSM-23965	SID99357441, BRD-K46726368	44505591	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25+/m1/s1	GHLJLHKVBJDFKH-CZSZKKDXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K46726368	BRD-K46726368-001-01-5	Broad Institute of MIT and Harvard	BRD-K46726368			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25+/m1/s1	GHLJLHKVBJDFKH-CZSZKKDXSA-N	551.285617354							112555
MLS003129173	LSM-23966	BRD-K08031329	44505601	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m0/s1	APDMZOWNVCUUKT-BBTUJRGHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K08031329	BRD-K08031329-001-01-4	Broad Institute of MIT and Harvard	BRD-K08031329			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m0/s1	APDMZOWNVCUUKT-BBTUJRGHSA-N	464.31110382							112556
MLS003129620	LSM-8285	BRD-K57882732, SID99358030	44489805	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15-,17+/m0/s1	CMMUKIKJYLMGMW-YQQAZPJKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K57882732	BRD-K57882732-001-01-1	Broad Institute of MIT and Harvard	BRD-K57882732			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15-,17+/m0/s1	CMMUKIKJYLMGMW-YQQAZPJKSA-N	463.240639154							96906
MLS003129440	LSM-8373	BRD-K80819715, SID99357781	44485047	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25-/m0/s1	KFMYUMLTCHBBFY-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K80819715	BRD-K80819715-001-01-5	Broad Institute of MIT and Harvard	BRD-K80819715			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25-/m0/s1	KFMYUMLTCHBBFY-DFIYOIEZSA-N	529.23588996							96994
MLS003129104	LSM-6922	BRD-K04749191	44486960	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21+,25+/m1/s1	WYPGSQIBOYUSAK-CZSZKKDXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K04749191	BRD-K04749191-001-01-0	Broad Institute of MIT and Harvard	BRD-K04749191			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21+,25+/m1/s1	WYPGSQIBOYUSAK-CZSZKKDXSA-N	551.285617354							95543
MLS003129437	LSM-8065	BRD-K95044179, SID85799282, SID99357780	44492583	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28+/m1/s1	CUSMSBFNEHNGNQ-MRJKTFCFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K95044179	BRD-K95044179-001-01-2	Broad Institute of MIT and Harvard	BRD-K95044179			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28+/m1/s1	CUSMSBFNEHNGNQ-MRJKTFCFSA-N	521.300204778							96686
MLS003129383	LSM-8226	BRD-K40060703, SID99357686	44505727	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22+/m1/s1	AWVASGRLDZTAAI-FGSXEWAUSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K40060703	BRD-K40060703-001-01-9	Broad Institute of MIT and Harvard	BRD-K40060703			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22+/m1/s1	AWVASGRLDZTAAI-FGSXEWAUSA-N	509.23080458							96847
MLS003129324	LSM-23967	SID99357583, BRD-K12768218	44505967	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18+,22-/m0/s1	IZYFSJYDPLTURU-SVMVAKDDSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K12768218	BRD-K12768218-001-01-9	Broad Institute of MIT and Harvard	BRD-K12768218			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18+,22-/m0/s1	IZYFSJYDPLTURU-SVMVAKDDSA-N	509.23080458							112557
MLS003129712	LSM-8329	BRD-K68665543, SID99358156	44505980	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24-/m1/s1	DZRIWTKXHLXUTO-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K68665543	BRD-K68665543-001-01-6	Broad Institute of MIT and Harvard	BRD-K68665543			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24-/m1/s1	DZRIWTKXHLXUTO-YDIMBITNSA-N	510.259068248							96950
MLS003130247	LSM-23968	SID99359037, BRD-K11613508	44505172	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18+,22+/m1/s1	IZYFSJYDPLTURU-FGSXEWAUSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K11613508	BRD-K11613508-001-01-7	Broad Institute of MIT and Harvard	BRD-K11613508			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18+,22+/m1/s1	IZYFSJYDPLTURU-FGSXEWAUSA-N	509.23080458							112558
BRD-K49594309-001-01-6	LSM-7489	BRD-K49594309	44505756	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17-,19+/m1/s1	UOJDQXZVAPFQKD-LMMKCTJWSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K49594309	BRD-K49594309-001-01-6	Broad Institute of MIT and Harvard	BRD-K49594309			CC(C)COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17-,19+/m1/s1	UOJDQXZVAPFQKD-LMMKCTJWSA-N	439.279469334							96110
MLS003129568	LSM-23969	BRD-K77120024	44491453	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m1/s1	DTQFALQSFDATTM-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K77120024	BRD-K77120024-001-01-9	Broad Institute of MIT and Harvard	BRD-K77120024			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m1/s1	DTQFALQSFDATTM-WWMYMODYSA-N	526.251538196							112559
MLS003129166	LSM-23970	SID99357502, BRD-K91229058	44505433	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18+,23-/m0/s1	BYLZCNPQXPGOCE-IXFSTUDKSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)c(OC)c1	BroadT	BRD-K91229058	BRD-K91229058-001-01-9	Broad Institute of MIT and Harvard	BRD-K91229058			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)c(OC)c1	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18+,23-/m0/s1	BYLZCNPQXPGOCE-IXFSTUDKSA-N	518.285282996							112560
MLS003129629	LSM-8185	BRD-K28055782, SID99358038	44505394	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26-/m0/s1	MSGDIDWYZNYHQU-VRUMLPLGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K28055782	BRD-K28055782-001-01-9	Broad Institute of MIT and Harvard	BRD-K28055782			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26-/m0/s1	MSGDIDWYZNYHQU-VRUMLPLGSA-N	541.337652926							96806
MLS003129286	LSM-8407	BRD-K92541860, SID99357549	44505973	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17-,20-/m0/s1	IGJDKOMBBXSAPT-ZWOKBUDYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K92541860	BRD-K92541860-001-01-4	Broad Institute of MIT and Harvard	BRD-K92541860			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17-,20-/m0/s1	IGJDKOMBBXSAPT-ZWOKBUDYSA-N	444.248503564							97028
MLS003129574	LSM-8309	BRD-K64100337	44505203	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26-/m0/s1	WJAIMBKFVIKGAD-VRUMLPLGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K64100337	BRD-K64100337-001-01-8	Broad Institute of MIT and Harvard	BRD-K64100337			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26-/m0/s1	WJAIMBKFVIKGAD-VRUMLPLGSA-N	541.337652926							96930
MLS003129391	LSM-7645	BRD-K60129749, SID99357694	44487409	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19-,24+/m0/s1	XYWPMUCHOREPKK-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K60129749	BRD-K60129749-001-01-3	Broad Institute of MIT and Harvard	BRD-K60129749			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19-,24+/m0/s1	XYWPMUCHOREPKK-AXHZCLLHSA-N	510.259068248							96266
MLS003129246	LSM-7128	BRD-K21153751	44505142	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18-,21-/m1/s1	QLGFDRXFQQZFKX-DBXWQHBBSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K21153751	BRD-K21153751-001-01-6	Broad Institute of MIT and Harvard	BRD-K21153751			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18-,21-/m1/s1	QLGFDRXFQQZFKX-DBXWQHBBSA-N	509.23080458							95749
BRD-K19049358-001-01-7	LSM-23971	BRD-K19049358	44506005	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21-,25+/m0/s1	GHLJLHKVBJDFKH-STWLZBDKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K19049358	BRD-K19049358-001-01-7	Broad Institute of MIT and Harvard	BRD-K19049358			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21-,25+/m0/s1	GHLJLHKVBJDFKH-STWLZBDKSA-N	551.285617354							112561
BRD-K90170141-001-01-5	LSM-23972	BRD-K90170141	54631268	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)10-24(16(3)13-25)19(26)7-6-9-23-11-17(14-27-18)20-21-23/h11,15-16,18,25H,5-10,12-14H2,1-4H3/t15-,16-,18-/m1/s1	UYQIVECMKYOLNY-JFIYKMOQSA-N	CCCN(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K90170141	BRD-K90170141-001-01-5	Broad Institute of MIT and Harvard	BRD-K90170141			CCCN(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)10-24(16(3)13-25)19(26)7-6-9-23-11-17(14-27-18)20-21-23/h11,15-16,18,25H,5-10,12-14H2,1-4H3/t15-,16-,18-/m1/s1	UYQIVECMKYOLNY-JFIYKMOQSA-N	381.27399003							112562
MLS003129564	LSM-23973	BRD-K56727152	44504995	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17-/m0/s1	SUQCROIYCBRRRP-UXLLHSPISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K56727152	BRD-K56727152-001-01-0	Broad Institute of MIT and Harvard	BRD-K56727152			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17-/m0/s1	SUQCROIYCBRRRP-UXLLHSPISA-N	463.240639154							112563
MLS003130215	LSM-8324	BRD-K67217705, SID99359010	44505603	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26-/m1/s1	WJAIMBKFVIKGAD-XLGIIRLISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K67217705	BRD-K67217705-001-01-1	Broad Institute of MIT and Harvard	BRD-K67217705			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26-/m1/s1	WJAIMBKFVIKGAD-XLGIIRLISA-N	541.337652926							96945
MLS003129146	LSM-23974	BRD-K76611906	44484509	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25+/m0/s1	KFMYUMLTCHBBFY-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K76611906	BRD-K76611906-001-01-1	Broad Institute of MIT and Harvard	BRD-K76611906			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25+/m0/s1	KFMYUMLTCHBBFY-WZOHSFFVSA-N	529.23588996							112564
BRD-K38770265-001-01-7	LSM-23975	BRD-K38770265	54631262	InChI=1S/C22H39N5O3/c1-17-12-26(18(2)15-28)22(29)9-6-10-27-20(11-23-24-27)16-30-21(17)14-25(3)13-19-7-4-5-8-19/h11,17-19,21,28H,4-10,12-16H2,1-3H3/t17-,18+,21+/m0/s1	KPNJMWZAUKOQSY-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K38770265	BRD-K38770265-001-01-7	Broad Institute of MIT and Harvard	BRD-K38770265			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C22H39N5O3/c1-17-12-26(18(2)15-28)22(29)9-6-10-27-20(11-23-24-27)16-30-21(17)14-25(3)13-19-7-4-5-8-19/h11,17-19,21,28H,4-10,12-16H2,1-3H3/t17-,18+,21+/m0/s1	KPNJMWZAUKOQSY-WAOWUJCRSA-N	421.305290158							112565
MLS003129177	LSM-23976	BRD-K88362460	44505014	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18+,21+/m0/s1	BVMGYWBUQYFDAA-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K88362460	BRD-K88362460-001-01-5	Broad Institute of MIT and Harvard	BRD-K88362460			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18+,21+/m0/s1	BVMGYWBUQYFDAA-WAOWUJCRSA-N	430.269239008							112566
MLS003129178	LSM-8424	BRD-K98758861	44497248	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22-/m0/s1	IZYFSJYDPLTURU-SPEDKVCISA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K98758861	BRD-K98758861-001-01-7	Broad Institute of MIT and Harvard	BRD-K98758861			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22-/m0/s1	IZYFSJYDPLTURU-SPEDKVCISA-N	509.23080458							97045
MLS003129544	LSM-7425	SID99357919, BRD-K45656768	44505750	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24+/m0/s1	KMYKLRXROVKHNJ-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K45656768	BRD-K45656768-001-01-1	Broad Institute of MIT and Harvard	BRD-K45656768			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24+/m0/s1	KMYKLRXROVKHNJ-XLNZFTOWSA-N	496.279803692							96046
BRD-K24288459-001-01-2	LSM-23977	BRD-K24288459	44489815	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20-,25+/m1/s1	VRVGAAPGNIASDT-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K24288459	BRD-K24288459-001-01-2	Broad Institute of MIT and Harvard	BRD-K24288459			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20-,25+/m1/s1	VRVGAAPGNIASDT-FHAGJXEFSA-N	500.31110382							112567
MLS003129758	LSM-7230	BRD-K29555302	44505790	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23+/m1/s1	RIHXBZGHHXCGPP-QTEQDKRBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K29555302	BRD-K29555302-001-01-8	Broad Institute of MIT and Harvard	BRD-K29555302			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23+/m1/s1	RIHXBZGHHXCGPP-QTEQDKRBSA-N	544.31216646							95851
MLS003129710	LSM-7185	BRD-K26581628	44505004	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m0/s1	HYHIJLYQTCYSKX-BBTUJRGHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K26581628	BRD-K26581628-001-01-4	Broad Institute of MIT and Harvard	BRD-K26581628			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m0/s1	HYHIJLYQTCYSKX-BBTUJRGHSA-N	458.264153628							95806
MLS003129707	LSM-8192	BRD-K31147195, SID99358153	44505834	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15+,19+/m0/s1	RMZGJSLXUIRDMP-QMTMVMCOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K31147195	BRD-K31147195-001-01-0	Broad Institute of MIT and Harvard	BRD-K31147195			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cnnn2CCCC1=O	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15+,19+/m0/s1	RMZGJSLXUIRDMP-QMTMVMCOSA-N	477.26996729							96813
MLS003129541	LSM-23978	BRD-K59371134	44505648	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20-,25+/m1/s1	OLIWWUKSUJJEPA-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K59371134	BRD-K59371134-001-01-7	Broad Institute of MIT and Harvard	BRD-K59371134			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20-,25+/m1/s1	OLIWWUKSUJJEPA-FHAGJXEFSA-N	480.284889072							112568
BRD-K00474715-001-01-6	LSM-23979	BRD-K00474715	44619610	InChI=1S/C22H39N5O3/c1-17-12-26(18(2)15-28)22(29)9-6-10-27-20(11-23-24-27)16-30-21(17)14-25(3)13-19-7-4-5-8-19/h11,17-19,21,28H,4-10,12-16H2,1-3H3/t17-,18+,21-/m1/s1	KPNJMWZAUKOQSY-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K00474715	BRD-K00474715-001-01-6	Broad Institute of MIT and Harvard	BRD-K00474715			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C22H39N5O3/c1-17-12-26(18(2)15-28)22(29)9-6-10-27-20(11-23-24-27)16-30-21(17)14-25(3)13-19-7-4-5-8-19/h11,17-19,21,28H,4-10,12-16H2,1-3H3/t17-,18+,21-/m1/s1	KPNJMWZAUKOQSY-LVCYWYKZSA-N	421.305290158							112569
MLS003129428	LSM-23980	SID99357774, BRD-K65952656	44497715	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23-/m1/s1	RIHXBZGHHXCGPP-ZRCGQRJVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K65952656	BRD-K65952656-001-01-4	Broad Institute of MIT and Harvard	BRD-K65952656			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23-/m1/s1	RIHXBZGHHXCGPP-ZRCGQRJVSA-N	544.31216646							112570
MLS003129247	LSM-7830	BRD-K75755028, SID99357444	44505387	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19-,24+/m1/s1	DZRIWTKXHLXUTO-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K75755028	BRD-K75755028-001-01-0	Broad Institute of MIT and Harvard	BRD-K75755028			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19-,24+/m1/s1	DZRIWTKXHLXUTO-IECBHUPTSA-N	510.259068248							96451
MLS003129891	LSM-23981	SID99358393, BRD-K25933460	44483911	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22-/m1/s1	YRBTUIBMTXMQGX-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K25933460	BRD-K25933460-001-01-9	Broad Institute of MIT and Harvard	BRD-K25933460			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22-/m1/s1	YRBTUIBMTXMQGX-XQBPLPMBSA-N	473.26381927							112571
MLS003129685	LSM-23982	BRD-K18065225	44505141	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18+,21-/m1/s1	QLGFDRXFQQZFKX-LVCYWYKZSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K18065225	BRD-K18065225-001-01-5	Broad Institute of MIT and Harvard	BRD-K18065225			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18+,21-/m1/s1	QLGFDRXFQQZFKX-LVCYWYKZSA-N	509.23080458							112572
BRD-K75720765-001-01-1	LSM-23983	BRD-K75720765	44618361	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22+,28-/m0/s1	DAHNEQAICFEUKA-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cnnn4CCCC1=O	BroadT	BRD-K75720765	BRD-K75720765-001-01-1	Broad Institute of MIT and Harvard	BRD-K75720765			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cnnn2CCCC1=O	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22+,28-/m0/s1	DAHNEQAICFEUKA-TYPXCFOJSA-N	563.322002862							112573
MLS003129367	LSM-23984	BRD-K68391904	44496829	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18+,23-/m0/s1	NYFKVVDOCVTYTM-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K68391904	BRD-K68391904-001-01-2	Broad Institute of MIT and Harvard	BRD-K68391904			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18+,23-/m0/s1	NYFKVVDOCVTYTM-IXFSTUDKSA-N	516.269632932							112574
MLS003129109	LSM-23985	BRD-K67980010	44505774	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19+/m1/s1	MNAJUJYQFCFYAB-AOIWGVFYSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K67980010	BRD-K67980010-001-01-4	Broad Institute of MIT and Harvard	BRD-K67980010			CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19+/m1/s1	MNAJUJYQFCFYAB-AOIWGVFYSA-N	439.279469334							112575
MLS003129134	LSM-8404	BRD-K90534988, SID99357475	44505975	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19-,24-/m1/s1	DZRIWTKXHLXUTO-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K90534988	BRD-K90534988-001-01-8	Broad Institute of MIT and Harvard	BRD-K90534988			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19-,24-/m1/s1	DZRIWTKXHLXUTO-KHCICDEESA-N	510.259068248							97025
MLS003129805	LSM-8388	SID99358285, BRD-K86033856	44489268	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22+/m1/s1	YRBTUIBMTXMQGX-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K86033856	BRD-K86033856-001-01-6	Broad Institute of MIT and Harvard	BRD-K86033856			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22+/m1/s1	YRBTUIBMTXMQGX-DXIQSLLYSA-N	473.26381927							97009
MLS003130223	LSM-8318	BRD-K65548588	44504944	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	QVHCTLOUCAXGOY-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K65548588	BRD-K65548588-001-01-3	Broad Institute of MIT and Harvard	BRD-K65548588			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	QVHCTLOUCAXGOY-WZOHSFFVSA-N	529.23588996							96939
MLS003129237	LSM-23986	BRD-K27248268	44505595	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21-/m0/s1	WMEBRZUCENJNIY-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K27248268	BRD-K27248268-001-01-4	Broad Institute of MIT and Harvard	BRD-K27248268			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21-/m0/s1	WMEBRZUCENJNIY-UEXGIBASSA-N	464.31110382							112576
MLS003129661	LSM-23987	BRD-K30382953, SID99358061	44505194	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24+/m1/s1	KMYKLRXROVKHNJ-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K30382953	BRD-K30382953-001-01-6	Broad Institute of MIT and Harvard	BRD-K30382953			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24+/m1/s1	KMYKLRXROVKHNJ-IMWIBFENSA-N	496.279803692							112577
MLS003129193	LSM-8157	BRD-K18942395	44505202	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26-/m0/s1	WJAIMBKFVIKGAD-MCEYFSPLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K18942395	BRD-K18942395-001-01-9	Broad Institute of MIT and Harvard	BRD-K18942395			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26-/m0/s1	WJAIMBKFVIKGAD-MCEYFSPLSA-N	541.337652926							96778
MLS003129103	LSM-23988	BRD-K01718511	44505429	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20-,23+/m1/s1	RIHXBZGHHXCGPP-VIZSFHNOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K01718511	BRD-K01718511-001-01-1	Broad Institute of MIT and Harvard	BRD-K01718511			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20-,23+/m1/s1	RIHXBZGHHXCGPP-VIZSFHNOSA-N	544.31216646							112578
MLS003129342	LSM-23989	BRD-K94049419	44505972	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26+/m1/s1	MSGDIDWYZNYHQU-UFPGJGBJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K94049419	BRD-K94049419-001-01-2	Broad Institute of MIT and Harvard	BRD-K94049419			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26+/m1/s1	MSGDIDWYZNYHQU-UFPGJGBJSA-N	541.337652926							112579
MLS003129157	LSM-8105	BRD-K00977230, SID99357495	44504982	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26-/m0/s1	MSGDIDWYZNYHQU-MCEYFSPLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K00977230	BRD-K00977230-001-01-4	Broad Institute of MIT and Harvard	BRD-K00977230			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26-/m0/s1	MSGDIDWYZNYHQU-MCEYFSPLSA-N	541.337652926							96726
MLS003129315	LSM-23990	BRD-K61310138	44489266	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m0/s1	DTQFALQSFDATTM-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K61310138	BRD-K61310138-001-01-7	Broad Institute of MIT and Harvard	BRD-K61310138			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m0/s1	DTQFALQSFDATTM-XGHQBKJUSA-N	526.251538196							112580
MLS003129654	LSM-7850	BRD-K77229048, SID99358055	44498543	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22+/m1/s1	MESWQEBVROHANN-KNKQGSTJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K77229048	BRD-K77229048-001-01-0	Broad Institute of MIT and Harvard	BRD-K77229048			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22+/m1/s1	MESWQEBVROHANN-KNKQGSTJSA-N	457.26890465							96471
MLS003129527	LSM-23991	BRD-K44189028	44505753	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20-,25+/m0/s1	SUQKGVARFDJMIR-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K44189028	BRD-K44189028-001-01-0	Broad Institute of MIT and Harvard	BRD-K44189028			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20-,25+/m0/s1	SUQKGVARFDJMIR-ZYLNGJIFSA-N	509.26381927							112581
BRD-K14998923-001-01-6	LSM-23992	BRD-K14998923	44619743	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22-,28-/m1/s1	DAHNEQAICFEUKA-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cnnn4CCCC1=O	BroadT	BRD-K14998923	BRD-K14998923-001-01-6	Broad Institute of MIT and Harvard	BRD-K14998923			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cnnn2CCCC1=O	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22-,28-/m1/s1	DAHNEQAICFEUKA-DQCZWYHMSA-N	563.322002862							112582
BRD-K17321630-001-01-2	LSM-23993	BRD-K17321630	44505767	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17-,19-/m1/s1	UOJDQXZVAPFQKD-ZHALLVOQSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K17321630	BRD-K17321630-001-01-2	Broad Institute of MIT and Harvard	BRD-K17321630			CC(C)COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17-,19-/m1/s1	UOJDQXZVAPFQKD-ZHALLVOQSA-N	439.279469334							112583
BRD-K98538413-001-01-6	LSM-23994	BRD-K98538413	44494077	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17-,21-/m1/s1	HYXYHDZNHQRBPW-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K98538413	BRD-K98538413-001-01-6	Broad Institute of MIT and Harvard	BRD-K98538413			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17-,21-/m1/s1	HYXYHDZNHQRBPW-CBGDNZLLSA-N	476.254731796							112584
MLS003129426	LSM-7591	BRD-K56304906, SID99357773	44486349	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19+,24+/m0/s1	XYWPMUCHOREPKK-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K56304906	BRD-K56304906-001-01-7	Broad Institute of MIT and Harvard	BRD-K56304906			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19+,24+/m0/s1	XYWPMUCHOREPKK-XLNZFTOWSA-N	510.259068248							96212
MLS003129432	LSM-23995	BRD-K15098674	44504974	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24-/m0/s1	DZRIWTKXHLXUTO-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K15098674	BRD-K15098674-001-01-5	Broad Institute of MIT and Harvard	BRD-K15098674			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24-/m0/s1	DZRIWTKXHLXUTO-GLDPYIMESA-N	510.259068248							112585
MLS003129515	LSM-23996	SID99357897, BRD-K22771400	44505788	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18-,21+/m1/s1	WMEBRZUCENJNIY-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K22771400	BRD-K22771400-001-01-9	Broad Institute of MIT and Harvard	BRD-K22771400			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18-,21+/m1/s1	WMEBRZUCENJNIY-OPYAIIAOSA-N	464.31110382							112586
MLS003129718	LSM-8174	BRD-K25595086	44505356	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	QVHCTLOUCAXGOY-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K25595086	BRD-K25595086-001-01-0	Broad Institute of MIT and Harvard	BRD-K25595086			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	QVHCTLOUCAXGOY-FHAGJXEFSA-N	529.23588996							96795
MLS003129188	LSM-23997	BRD-K20722478, SID99357517	44506049	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23+/m1/s1	GOEWTOAFXZXQCM-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K20722478	BRD-K20722478-001-01-1	Broad Institute of MIT and Harvard	BRD-K20722478			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23+/m1/s1	GOEWTOAFXZXQCM-STSQHVNTSA-N	473.26381927							112587
MLS003129706	LSM-23998	SID99358152, BRD-K38810059	44505842	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15+,19-/m1/s1	RMZGJSLXUIRDMP-ZRGWGRIASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K38810059	BRD-K38810059-001-01-1	Broad Institute of MIT and Harvard	BRD-K38810059			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cnnn2CCCC1=O	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15+,19-/m1/s1	RMZGJSLXUIRDMP-ZRGWGRIASA-N	477.26996729							112588
MLS003129443	LSM-23999	BRD-K27121064, SID99357784	44505561	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19-/m1/s1	MNAJUJYQFCFYAB-ZHALLVOQSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K27121064	BRD-K27121064-001-01-9	Broad Institute of MIT and Harvard	BRD-K27121064			CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19-/m1/s1	MNAJUJYQFCFYAB-ZHALLVOQSA-N	439.279469334							112589
MLS003130344	LSM-7879	BRD-K78824440	44505071	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13+,15+/m0/s1	FOLOUAULJSJVDY-GZBFAFLISA-N	CNC[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K78824440	BRD-K78824440-001-01-1	Broad Institute of MIT and Harvard	BRD-K78824440			CNC[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13+,15+/m0/s1	FOLOUAULJSJVDY-GZBFAFLISA-N	339.227039838							96500
MLS003129421	LSM-8389	SID121282490, BRD-K86466947	44504955	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17-,20+/m1/s1	JYOVEVCXPRGJRX-HLIPFELVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K86466947	BRD-K86466947-001-01-9	Broad Institute of MIT and Harvard	BRD-K86466947			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17-,20+/m1/s1	JYOVEVCXPRGJRX-HLIPFELVSA-N	497.210818064							97010
MLS003129577	LSM-8228	BRD-K40294449	44505602	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21+/m1/s1	APDMZOWNVCUUKT-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K40294449	BRD-K40294449-001-01-3	Broad Institute of MIT and Harvard	BRD-K40294449			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21+/m1/s1	APDMZOWNVCUUKT-LQWHRVPQSA-N	464.31110382							96849
MLS003129720	LSM-24000	BRD-K50260295, SID99358163	44505744	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16-/m0/s1	KPZGSTQZFNZEDR-DZKIICNBSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K50260295	BRD-K50260295-001-01-6	Broad Institute of MIT and Harvard	BRD-K50260295			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16-/m0/s1	KPZGSTQZFNZEDR-DZKIICNBSA-N	417.204589832							112590
MLS003129390	LSM-8153	BRD-K16769896, SID99357693	44504984	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26-/m1/s1	MSGDIDWYZNYHQU-XLGIIRLISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K16769896	BRD-K16769896-001-01-2	Broad Institute of MIT and Harvard	BRD-K16769896			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26-/m1/s1	MSGDIDWYZNYHQU-XLGIIRLISA-N	541.337652926							96774
MLS003129539	LSM-8392	BRD-K86956630	44491448	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15+,17+/m1/s1	CMMUKIKJYLMGMW-VYDXJSESSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K86956630	BRD-K86956630-001-01-1	Broad Institute of MIT and Harvard	BRD-K86956630			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15+,17+/m1/s1	CMMUKIKJYLMGMW-VYDXJSESSA-N	463.240639154							97013
MLS003129236	LSM-24001	BRD-K70193997	44505417	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26-/m1/s1	WJAIMBKFVIKGAD-TVZXLZGTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K70193997	BRD-K70193997-001-01-6	Broad Institute of MIT and Harvard	BRD-K70193997			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26-/m1/s1	WJAIMBKFVIKGAD-TVZXLZGTSA-N	541.337652926							112591
MLS003129201	LSM-6875	BRD-K01187795	44505798	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18-,21-/m0/s1	WMEBRZUCENJNIY-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K01187795	BRD-K01187795-001-01-6	Broad Institute of MIT and Harvard	BRD-K01187795			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18-,21-/m0/s1	WMEBRZUCENJNIY-WFXMLNOXSA-N	464.31110382							95496
MLS003129241	LSM-24002	BRD-K38621585	44504951	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18+,22-/m1/s1	IZYFSJYDPLTURU-KGVIQGDOSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K38621585	BRD-K38621585-001-01-5	Broad Institute of MIT and Harvard	BRD-K38621585			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18+,22-/m1/s1	IZYFSJYDPLTURU-KGVIQGDOSA-N	509.23080458							112592
MLS003129631	LSM-24003	SID99358039, BRD-K49039223	44505598	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21+/m1/s1	WMEBRZUCENJNIY-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K49039223	BRD-K49039223-001-01-5	Broad Institute of MIT and Harvard	BRD-K49039223			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21+/m1/s1	WMEBRZUCENJNIY-LQWHRVPQSA-N	464.31110382							112593
BRD-K75623165-001-01-3	LSM-24004	BRD-K75623165	54631259	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22+,28+/m0/s1	DAHNEQAICFEUKA-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cnnn4CCCC1=O	BroadT	BRD-K75623165	BRD-K75623165-001-01-3	Broad Institute of MIT and Harvard	BRD-K75623165			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cnnn2CCCC1=O	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22+,28+/m0/s1	DAHNEQAICFEUKA-PFPZSTESSA-N	563.322002862							112594
MLS003129499	LSM-8059	BRD-K94672699	44485050	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15-,18+/m0/s1	HEIBNMHSSNMFIU-RLFYNMQTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K94672699	BRD-K94672699-001-01-2	Broad Institute of MIT and Harvard	BRD-K94672699			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15-,18+/m0/s1	HEIBNMHSSNMFIU-RLFYNMQTSA-N	407.253254586							96680
MLS003129348	LSM-8413	BRD-K95105171, SID99357658	44505581	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25-/m1/s1	WIMCLPXWPPGBKL-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K95105171	BRD-K95105171-001-01-9	Broad Institute of MIT and Harvard	BRD-K95105171			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25-/m1/s1	WIMCLPXWPPGBKL-UMEGOILYSA-N	509.26381927							97034
MLS003129774	LSM-24005	SID99358257, BRD-K19662956	44505979	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20-/m1/s1	IGJDKOMBBXSAPT-FUHIMQAGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K19662956	BRD-K19662956-001-01-3	Broad Institute of MIT and Harvard	BRD-K19662956			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20-/m1/s1	IGJDKOMBBXSAPT-FUHIMQAGSA-N	444.248503564							112595
MLS003129688	LSM-24006	SID99358138, BRD-K50170404	44505821	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18+,23-/m1/s1	BYLZCNPQXPGOCE-IEGUWTFLSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)c(OC)c1	BroadT	BRD-K50170404	BRD-K50170404-001-01-5	Broad Institute of MIT and Harvard	BRD-K50170404			COc1ccc(NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)c(OC)c1	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18+,23-/m1/s1	BYLZCNPQXPGOCE-IEGUWTFLSA-N	518.285282996							112596
MLS003129733	LSM-7789	SID99358176, BRD-K70102743	44505755	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19+/m1/s1	MNAJUJYQFCFYAB-LMMKCTJWSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K70102743	BRD-K70102743-001-01-4	Broad Institute of MIT and Harvard	BRD-K70102743			CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19+/m1/s1	MNAJUJYQFCFYAB-LMMKCTJWSA-N	439.279469334							96410
MLS003129915	LSM-24007	BRD-K98108103	44496395	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15+,18-/m0/s1	WXHQIOUFBAEATF-DAYGRLMNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K98108103	BRD-K98108103-001-01-3	Broad Institute of MIT and Harvard	BRD-K98108103			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2cnnn2CCCC1=O	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15+,18-/m0/s1	WXHQIOUFBAEATF-DAYGRLMNSA-N	407.253254586							112597
MLS003129931	LSM-8115	BRD-K02707544, SID99358423	44487411	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19+,24+/m1/s1	BWTMYHAPSQQINJ-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K02707544	BRD-K02707544-001-01-4	Broad Institute of MIT and Harvard	BRD-K02707544			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19+,24+/m1/s1	BWTMYHAPSQQINJ-IMWIBFENSA-N	496.279803692							96736
MLS003129542	LSM-24008	SID99357918, BRD-K75073374	44505745	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16+/m1/s1	PUHFBKBPROGAIN-FMKPAKJESA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K75073374	BRD-K75073374-001-01-8	Broad Institute of MIT and Harvard	BRD-K75073374			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16+/m1/s1	PUHFBKBPROGAIN-FMKPAKJESA-N	417.204589832							112598
MLS003129349	LSM-24009	SID99357659, BRD-K59062269	44505463	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18+,23+/m0/s1	NYFKVVDOCVTYTM-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K59062269	BRD-K59062269-001-01-9	Broad Institute of MIT and Harvard	BRD-K59062269			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18+,23+/m0/s1	NYFKVVDOCVTYTM-YZZKKUAISA-N	516.269632932							112599
MLS003129768	LSM-24010	SID99358253, BRD-K83190598	44505565	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17+,19+/m1/s1	UOJDQXZVAPFQKD-AOIWGVFYSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K83190598	BRD-K83190598-001-01-0	Broad Institute of MIT and Harvard	BRD-K83190598			CC(C)COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17+,19+/m1/s1	UOJDQXZVAPFQKD-AOIWGVFYSA-N	439.279469334							112600
MLS003129681	LSM-24011	BRD-K54042651	44488695	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21-,25+/m1/s1	WYPGSQIBOYUSAK-OTPAQWSUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K54042651	BRD-K54042651-001-01-2	Broad Institute of MIT and Harvard	BRD-K54042651			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21-,25+/m1/s1	WYPGSQIBOYUSAK-OTPAQWSUSA-N	551.285617354							112601
MLS003129171	LSM-15097	SID99357504, BRD-K01591707	44494083	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18+,22+/m1/s1	DMKVVNQLOZTLAB-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K01591707	BRD-K01591707-001-01-6	Broad Institute of MIT and Harvard	BRD-K01591707			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18+,22+/m1/s1	DMKVVNQLOZTLAB-FGSXEWAUSA-N	497.261374598							103753
MLS003129893	LSM-6978	BRD-K09757845	44489280	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19+,23+/m0/s1	QHTRHHVBBSPOHC-YCRNBWNJSA-N	COc1ccccc1CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K09757845	BRD-K09757845-001-01-8	Broad Institute of MIT and Harvard	BRD-K09757845			COc1ccccc1CN(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19+,23+/m0/s1	QHTRHHVBBSPOHC-YCRNBWNJSA-N	459.284554714							95599
MLS003129187	LSM-24012	BRD-K82760645	44493579	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17-,21+/m0/s1	HYXYHDZNHQRBPW-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K82760645	BRD-K82760645-001-01-4	Broad Institute of MIT and Harvard	BRD-K82760645			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17-,21+/m0/s1	HYXYHDZNHQRBPW-XGHQBKJUSA-N	476.254731796							112602
MLS003129649	LSM-24013	BRD-K59041191	44505986	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15-,17-/m1/s1	SUQCROIYCBRRRP-BFYDXBDKSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K59041191	BRD-K59041191-001-01-6	Broad Institute of MIT and Harvard	BRD-K59041191			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15-,17-/m1/s1	SUQCROIYCBRRRP-BFYDXBDKSA-N	463.240639154							112603
BRD-K18965840-001-01-1	LSM-24014	BRD-K18965840	44505847	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17-,21-/m1/s1	IQZUEXURVFCKFC-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K18965840	BRD-K18965840-001-01-1	Broad Institute of MIT and Harvard	BRD-K18965840			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17-,21-/m1/s1	IQZUEXURVFCKFC-CBGDNZLLSA-N	526.251538196							112604
BRD-K10206035-001-01-3	LSM-24015	BRD-K10206035	44505838	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17-,21+/m1/s1	IQZUEXURVFCKFC-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K10206035	BRD-K10206035-001-01-3	Broad Institute of MIT and Harvard	BRD-K10206035			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17-,21+/m1/s1	IQZUEXURVFCKFC-LZJOCLMNSA-N	526.251538196							112605
MLS003129238	LSM-24016	BRD-K31605712	44505396	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22+/m0/s1	MESWQEBVROHANN-CNNODRBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K31605712	BRD-K31605712-001-01-1	Broad Institute of MIT and Harvard	BRD-K31605712			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22+/m0/s1	MESWQEBVROHANN-CNNODRBYSA-N	457.26890465							112606
MLS003129582	LSM-24017	SID99357950, BRD-K77351681	44505748	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24+/m0/s1	KMYKLRXROVKHNJ-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K77351681	BRD-K77351681-001-01-4	Broad Institute of MIT and Harvard	BRD-K77351681			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24+/m0/s1	KMYKLRXROVKHNJ-AXHZCLLHSA-N	496.279803692							112607
MLS003129721	LSM-7639	SID99358164, BRD-K59870400	44485055	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19-,24+/m1/s1	XYWPMUCHOREPKK-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K59870400	BRD-K59870400-001-01-5	Broad Institute of MIT and Harvard	BRD-K59870400			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H34N6O5/c1-18-13-32(19(2)16-33)25(34)10-7-11-31-14-21(27-29-31)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12,14,18-19,24,33H,7,10-11,13,15-17H2,1-3H3/t18-,19-,24+/m1/s1	XYWPMUCHOREPKK-IECBHUPTSA-N	510.259068248							96260
BRD-K17405724-001-01-0	LSM-24018	BRD-K17405724	44618360	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)10-24(16(3)13-25)19(26)7-6-9-23-11-17(14-27-18)20-21-23/h11,15-16,18,25H,5-10,12-14H2,1-4H3/t15-,16+,18-/m1/s1	UYQIVECMKYOLNY-SOLBZPMBSA-N	CCCN(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K17405724	BRD-K17405724-001-01-0	Broad Institute of MIT and Harvard	BRD-K17405724			CCCN(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)10-24(16(3)13-25)19(26)7-6-9-23-11-17(14-27-18)20-21-23/h11,15-16,18,25H,5-10,12-14H2,1-4H3/t15-,16+,18-/m1/s1	UYQIVECMKYOLNY-SOLBZPMBSA-N	381.27399003							112608
MLS003130227	LSM-6901	BRD-K02960110, SID99359022	44505177	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26+/m1/s1	MSGDIDWYZNYHQU-DRLORSAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K02960110	BRD-K02960110-001-01-3	Broad Institute of MIT and Harvard	BRD-K02960110			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26+/m1/s1	MSGDIDWYZNYHQU-DRLORSAXSA-N	541.337652926							95522
MLS003129735	LSM-24019	SID99358178, BRD-K58735085	44504966	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16-/m0/s1	KPZGSTQZFNZEDR-LZWOXQAQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K58735085	BRD-K58735085-001-01-3	Broad Institute of MIT and Harvard	BRD-K58735085			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16-/m0/s1	KPZGSTQZFNZEDR-LZWOXQAQSA-N	417.204589832							112609
MLS003129477	LSM-8421	BRD-K96743424	44505000	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25-/m0/s1	WIMCLPXWPPGBKL-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K96743424	BRD-K96743424-001-01-1	Broad Institute of MIT and Harvard	BRD-K96743424			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25-/m0/s1	WIMCLPXWPPGBKL-DFIYOIEZSA-N	509.26381927							97042
MLS003130256	LSM-8371	BRD-K80185984, SID99359045	44505588	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25-/m1/s1	GHLJLHKVBJDFKH-TYBLODHISA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K80185984	BRD-K80185984-001-01-5	Broad Institute of MIT and Harvard	BRD-K80185984			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25-/m1/s1	GHLJLHKVBJDFKH-TYBLODHISA-N	551.285617354							96992
MLS003129618	LSM-24020	BRD-K70737214	44505140	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18+,21+/m1/s1	QLGFDRXFQQZFKX-LQWHRVPQSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K70737214	BRD-K70737214-001-01-7	Broad Institute of MIT and Harvard	BRD-K70737214			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18+,21+/m1/s1	QLGFDRXFQQZFKX-LQWHRVPQSA-N	509.23080458							112610
MLS003129129	LSM-8269	BRD-K52862624, SID99357470	44505181	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22+/m1/s1	MESWQEBVROHANN-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K52862624	BRD-K52862624-001-01-9	Broad Institute of MIT and Harvard	BRD-K52862624			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22+/m1/s1	MESWQEBVROHANN-DXIQSLLYSA-N	457.26890465							96890
MLS003129318	LSM-24021	SID99357577, BRD-K84521261	44492582	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20+,25+/m0/s1	OKVDUKBBVHEMKE-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K84521261	BRD-K84521261-001-01-1	Broad Institute of MIT and Harvard	BRD-K84521261			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20+,25+/m0/s1	OKVDUKBBVHEMKE-WZOHSFFVSA-N	500.31110382							112611
BRD-K87186563-001-01-5	LSM-24022	BRD-K87186563	44506000	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24-/m1/s1	KMYKLRXROVKHNJ-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K87186563	BRD-K87186563-001-01-5	Broad Institute of MIT and Harvard	BRD-K87186563			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24-/m1/s1	KMYKLRXROVKHNJ-KHCICDEESA-N	496.279803692							112612
MLS003129211	LSM-8325	BRD-K67314051, SID99357419	44484526	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17-,22+/m1/s1	DEGZSTUNWMGQCY-YVHKJVDXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K67314051	BRD-K67314051-001-01-6	Broad Institute of MIT and Harvard	BRD-K67314051			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17-,22+/m1/s1	DEGZSTUNWMGQCY-YVHKJVDXSA-N	502.253982868							96946
BRD-K84521540-001-01-4	LSM-24023	BRD-K84521540	44505395	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15-,18+/m0/s1	WXHQIOUFBAEATF-RLFYNMQTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K84521540	BRD-K84521540-001-01-4	Broad Institute of MIT and Harvard	BRD-K84521540			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2cnnn2CCCC1=O	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15-,18+/m0/s1	WXHQIOUFBAEATF-RLFYNMQTSA-N	407.253254586							112613
MLS003129164	LSM-24024	SID99357500, BRD-K53647853	44505192	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22+/m0/s1	MESWQEBVROHANN-NNMXDRDESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K53647853	BRD-K53647853-001-01-5	Broad Institute of MIT and Harvard	BRD-K53647853			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22+/m0/s1	MESWQEBVROHANN-NNMXDRDESA-N	457.26890465							112614
BRD-K55974666-001-01-8	LSM-24025	BRD-K55974666	44506030	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17-,21-/m0/s1	IQZUEXURVFCKFC-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K55974666	BRD-K55974666-001-01-8	Broad Institute of MIT and Harvard	BRD-K55974666			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)8-5-9-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10-11,16-17,21,34H,5,8-9,12-15H2,1-3H3,(H,29,36)/t16-,17-,21-/m0/s1	IQZUEXURVFCKFC-FIKGOQFSSA-N	526.251538196							112615
MLS003129253	LSM-24026	SID99357522, BRD-K49366794	44485067	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20-,23+/m0/s1	PUSZFNDBKFADMS-SXWKCWPCSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K49366794	BRD-K49366794-001-01-1	Broad Institute of MIT and Harvard	BRD-K49366794			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20-,23+/m0/s1	PUSZFNDBKFADMS-SXWKCWPCSA-N	544.31216646							112616
MLS003129643	LSM-7421	BRD-K45307499	44493077	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20+,25+/m1/s1	OKVDUKBBVHEMKE-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K45307499	BRD-K45307499-001-01-7	Broad Institute of MIT and Harvard	BRD-K45307499			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20+,25+/m1/s1	OKVDUKBBVHEMKE-RNHFSVANSA-N	500.31110382							96042
MLS003129658	LSM-24027	SID99358059, BRD-K48407262	44505791	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21+/m0/s1	WMEBRZUCENJNIY-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K48407262	BRD-K48407262-001-01-7	Broad Institute of MIT and Harvard	BRD-K48407262			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21+/m0/s1	WMEBRZUCENJNIY-WAOWUJCRSA-N	464.31110382							112617
MLS003129290	LSM-24028	BRD-K29259755	44493081	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18-,22+/m0/s1	DMKVVNQLOZTLAB-NPPFBWRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K29259755	BRD-K29259755-001-01-9	Broad Institute of MIT and Harvard	BRD-K29259755			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18-,22+/m0/s1	DMKVVNQLOZTLAB-NPPFBWRTSA-N	497.261374598							112618
MLS003129491	LSM-7378	BRD-K41880142, SID99357824	44505163	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18+,22+/m0/s1	IZYFSJYDPLTURU-NJNPRVFISA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K41880142	BRD-K41880142-001-01-8	Broad Institute of MIT and Harvard	BRD-K41880142			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18+,22+/m0/s1	IZYFSJYDPLTURU-NJNPRVFISA-N	509.23080458							95999
MLS003129378	LSM-24029	SID99357683, BRD-K78400597	44504996	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15-,17-/m0/s1	SUQCROIYCBRRRP-ZOBUZTSGSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K78400597	BRD-K78400597-001-01-1	Broad Institute of MIT and Harvard	BRD-K78400597			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15-,17-/m0/s1	SUQCROIYCBRRRP-ZOBUZTSGSA-N	463.240639154							112619
MLS003129532	LSM-24030	SID99357911, BRD-K71719006	44505419	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20-,23+/m0/s1	RIHXBZGHHXCGPP-SXWKCWPCSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K71719006	BRD-K71719006-001-01-6	Broad Institute of MIT and Harvard	BRD-K71719006			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20-,23+/m0/s1	RIHXBZGHHXCGPP-SXWKCWPCSA-N	544.31216646							112620
MLS003129243	LSM-6951	BRD-K07417570	44505210	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23+/m0/s1	GOEWTOAFXZXQCM-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K07417570	BRD-K07417570-001-01-2	Broad Institute of MIT and Harvard	BRD-K07417570			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23+/m0/s1	GOEWTOAFXZXQCM-YZZKKUAISA-N	473.26381927							95572
MLS003129263	LSM-24031	BRD-K68202226	44505182	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17+/m1/s1	SUQCROIYCBRRRP-VYDXJSESSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K68202226	BRD-K68202226-001-01-2	Broad Institute of MIT and Harvard	BRD-K68202226			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17+/m1/s1	SUQCROIYCBRRRP-VYDXJSESSA-N	463.240639154							112621
MLS003129384	LSM-8259	BRD-K49676673, SID99357687	44505428	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26+/m1/s1	WJAIMBKFVIKGAD-DRLORSAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K49676673	BRD-K49676673-001-01-9	Broad Institute of MIT and Harvard	BRD-K49676673			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26+/m1/s1	WJAIMBKFVIKGAD-DRLORSAXSA-N	541.337652926							96880
MLS003129244	LSM-7100	BRD-K19471718	44488699	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17+,22+/m0/s1	DEGZSTUNWMGQCY-GSHUGGBRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K19471718	BRD-K19471718-001-01-8	Broad Institute of MIT and Harvard	BRD-K19471718			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17+,22+/m0/s1	DEGZSTUNWMGQCY-GSHUGGBRSA-N	502.253982868							95721
MLS003129900	LSM-24032	SID99358398, BRD-K04328060	44485741	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15-,18+/m1/s1	HEIBNMHSSNMFIU-RKVPGOIHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K04328060	BRD-K04328060-001-01-1	Broad Institute of MIT and Harvard	BRD-K04328060			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15-,18+/m1/s1	HEIBNMHSSNMFIU-RKVPGOIHSA-N	407.253254586							112622
BRD-K19466937-001-01-3	LSM-24033	BRD-K19466937	54631258	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22+,28+/m1/s1	DAHNEQAICFEUKA-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cnnn4CCCC1=O	BroadT	BRD-K19466937	BRD-K19466937-001-01-3	Broad Institute of MIT and Harvard	BRD-K19466937			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cnnn2CCCC1=O	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22+,28+/m1/s1	DAHNEQAICFEUKA-WENCSYSZSA-N	563.322002862							112623
MLS003129778	LSM-8338	BRD-K69930474, SID99358261	44486341	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25-/m1/s1	KFMYUMLTCHBBFY-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K69930474	BRD-K69930474-001-01-6	Broad Institute of MIT and Harvard	BRD-K69930474			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25-/m1/s1	KFMYUMLTCHBBFY-UMEGOILYSA-N	529.23588996							96959
MLS003129612	LSM-8106	BRD-K01594666, SID99358022	44505773	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	SUQKGVARFDJMIR-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K01594666	BRD-K01594666-001-01-9	Broad Institute of MIT and Harvard	BRD-K01594666			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	SUQKGVARFDJMIR-FHAGJXEFSA-N	509.26381927							96727
MLS003129278	LSM-24034	BRD-K03903153	44492580	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17+,21-/m0/s1	HYXYHDZNHQRBPW-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K03903153	BRD-K03903153-001-01-0	Broad Institute of MIT and Harvard	BRD-K03903153			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17+,21-/m0/s1	HYXYHDZNHQRBPW-FVJLSDCUSA-N	476.254731796							112624
MLS003129686	LSM-24035	SID99358137, BRD-K33481868	44504980	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15-,18-/m1/s1	WXHQIOUFBAEATF-IIDMSEBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K33481868	BRD-K33481868-001-01-7	Broad Institute of MIT and Harvard	BRD-K33481868			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2cnnn2CCCC1=O	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15-,18-/m1/s1	WXHQIOUFBAEATF-IIDMSEBBSA-N	407.253254586							112625
MLS003129429	LSM-24036	SID99357775, BRD-K03350311	44505910	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18-,22+/m0/s1	QZCZRKJJOTUXQW-NPPFBWRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K03350311	BRD-K03350311-001-01-3	Broad Institute of MIT and Harvard	BRD-K03350311			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18-,22+/m0/s1	QZCZRKJJOTUXQW-NPPFBWRTSA-N	497.261374598							112626
MLS003129208	LSM-8374	BRD-K80995081	44505072	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13+,15+/m1/s1	FOLOUAULJSJVDY-IPYPFGDCSA-N	CNC[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K80995081	BRD-K80995081-001-01-9	Broad Institute of MIT and Harvard	BRD-K80995081			CNC[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13+,15+/m1/s1	FOLOUAULJSJVDY-IPYPFGDCSA-N	339.227039838							96995
MLS003129120	LSM-24037	SID99357462, BRD-K79080370	44505389	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26+/m0/s1	MSGDIDWYZNYHQU-AOJNWGRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K79080370	BRD-K79080370-001-01-3	Broad Institute of MIT and Harvard	BRD-K79080370			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26+/m0/s1	MSGDIDWYZNYHQU-AOJNWGRGSA-N	541.337652926							112627
MLS003129471	LSM-24038	SID99357807, BRD-K35407043	44505029	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18+,21+/m1/s1	BVMGYWBUQYFDAA-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K35407043	BRD-K35407043-001-01-8	Broad Institute of MIT and Harvard	BRD-K35407043			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18+,21+/m1/s1	BVMGYWBUQYFDAA-LQWHRVPQSA-N	430.269239008							112628
BRD-K86345884-001-01-0	LSM-24039	BRD-K86345884	44505981	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19-,24+/m0/s1	DZRIWTKXHLXUTO-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K86345884	BRD-K86345884-001-01-0	Broad Institute of MIT and Harvard	BRD-K86345884			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19-,24+/m0/s1	DZRIWTKXHLXUTO-AXHZCLLHSA-N	510.259068248							112629
MLS003129556	LSM-7716	SID99357931, BRD-K65067638	44505365	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m1/s1	QVHCTLOUCAXGOY-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K65067638	BRD-K65067638-001-01-4	Broad Institute of MIT and Harvard	BRD-K65067638			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m1/s1	QVHCTLOUCAXGOY-RNHFSVANSA-N	529.23588996							96337
MLS003129411	LSM-24040	SID121282489, BRD-K49896017	44505449	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15-,19-/m1/s1	RMZGJSLXUIRDMP-SPYBWZPUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K49896017	BRD-K49896017-001-01-8	Broad Institute of MIT and Harvard	BRD-K49896017			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cnnn2CCCC1=O	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15-,19-/m1/s1	RMZGJSLXUIRDMP-SPYBWZPUSA-N	477.26996729							112630
MLS003129319	LSM-24041	SID99357578, BRD-K89844894	44504961	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16-/m1/s1	KPZGSTQZFNZEDR-IJEWVQPXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K89844894	BRD-K89844894-001-01-7	Broad Institute of MIT and Harvard	BRD-K89844894			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16-/m1/s1	KPZGSTQZFNZEDR-IJEWVQPXSA-N	417.204589832							112631
MLS003129932	LSM-24042	SID99358424, BRD-K74781135	44505574	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17+,19+/m0/s1	UOJDQXZVAPFQKD-YQVWRLOYSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K74781135	BRD-K74781135-001-01-7	Broad Institute of MIT and Harvard	BRD-K74781135			CC(C)COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17+,19+/m0/s1	UOJDQXZVAPFQKD-YQVWRLOYSA-N	439.279469334							112632
MLS003129127	LSM-24043	SID99357468, BRD-K60850524	44494481	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m1/s1	JATGFWCPGFHVCF-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K60850524	BRD-K60850524-001-01-5	Broad Institute of MIT and Harvard	BRD-K60850524			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m1/s1	JATGFWCPGFHVCF-RNHFSVANSA-N	509.26381927							112633
BRD-K88035364-001-01-4	LSM-24044	BRD-K88035364	44493070	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17-,21-/m0/s1	HYXYHDZNHQRBPW-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K88035364	BRD-K88035364-001-01-4	Broad Institute of MIT and Harvard	BRD-K88035364			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17-,21-/m0/s1	HYXYHDZNHQRBPW-FIKGOQFSSA-N	476.254731796							112634
MLS003129110	LSM-24045	SID99357454, BRD-K60159710	44505786	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21-,25+/m1/s1	GHLJLHKVBJDFKH-OTPAQWSUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K60159710	BRD-K60159710-001-01-5	Broad Institute of MIT and Harvard	BRD-K60159710			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21-,25+/m1/s1	GHLJLHKVBJDFKH-OTPAQWSUSA-N	551.285617354							112635
MLS003129600	LSM-24046	SID99358011, BRD-K35332070	44505600	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18-,21+/m0/s1	WMEBRZUCENJNIY-BBTUJRGHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K35332070	BRD-K35332070-001-01-4	Broad Institute of MIT and Harvard	BRD-K35332070			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18-,21+/m0/s1	WMEBRZUCENJNIY-BBTUJRGHSA-N	464.31110382							112636
MLS003129791	LSM-24047	BRD-K14470344, SID99358271	44496396	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	JATGFWCPGFHVCF-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K14470344	BRD-K14470344-001-01-7	Broad Institute of MIT and Harvard	BRD-K14470344			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	JATGFWCPGFHVCF-FHAGJXEFSA-N	509.26381927							112637
MLS003129796	LSM-24048	BRD-K75008101	44505583	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25-/m0/s1	GHLJLHKVBJDFKH-BKSPAHHJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K75008101	BRD-K75008101-001-01-4	Broad Institute of MIT and Harvard	BRD-K75008101			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25-/m0/s1	GHLJLHKVBJDFKH-BKSPAHHJSA-N	551.285617354							112638
MLS003129345	LSM-6943	BRD-K06568278, SID99357655	44486968	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17-,22+/m0/s1	DEGZSTUNWMGQCY-PNLZDCPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K06568278	BRD-K06568278-001-01-8	Broad Institute of MIT and Harvard	BRD-K06568278			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17-,22+/m0/s1	DEGZSTUNWMGQCY-PNLZDCPESA-N	502.253982868							95564
MLS003129305	LSM-7854	BRD-K77323800	44505133	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18+,21-/m0/s1	QLGFDRXFQQZFKX-UEXGIBASSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K77323800	BRD-K77323800-001-01-9	Broad Institute of MIT and Harvard	BRD-K77323800			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)10-7-11-28-19(12-24-25-28)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-4H3/t17-,18+,21-/m0/s1	QLGFDRXFQQZFKX-UEXGIBASSA-N	509.23080458							96475
MLS003129226	LSM-24049	SID99357429, BRD-K22897367	44504977	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24+/m1/s1	DZRIWTKXHLXUTO-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K22897367	BRD-K22897367-001-01-3	Broad Institute of MIT and Harvard	BRD-K22897367			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24+/m1/s1	DZRIWTKXHLXUTO-IMWIBFENSA-N	510.259068248							112639
MLS003130210	LSM-24050	BRD-K56183302	44505386	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20+/m0/s1	IGJDKOMBBXSAPT-SQGPQFPESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K56183302	BRD-K56183302-001-01-5	Broad Institute of MIT and Harvard	BRD-K56183302			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20+/m0/s1	IGJDKOMBBXSAPT-SQGPQFPESA-N	444.248503564							112640
BRD-K37366844-001-01-5	LSM-24051	BRD-K37366844	44620121	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)10-24(16(3)13-25)19(26)7-6-9-23-11-17(14-27-18)20-21-23/h11,15-16,18,25H,5-10,12-14H2,1-4H3/t15-,16+,18-/m0/s1	UYQIVECMKYOLNY-JZXOWHBKSA-N	CCCN(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K37366844	BRD-K37366844-001-01-5	Broad Institute of MIT and Harvard	BRD-K37366844			CCCN(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)10-24(16(3)13-25)19(26)7-6-9-23-11-17(14-27-18)20-21-23/h11,15-16,18,25H,5-10,12-14H2,1-4H3/t15-,16+,18-/m0/s1	UYQIVECMKYOLNY-JZXOWHBKSA-N	381.27399003							112641
MLS003129380	LSM-6911	BRD-K03817886	44486954	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22+,26+/m0/s1	OIASBGFOQSUHIL-VVZHRXSXSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K03817886	BRD-K03817886-001-01-6	Broad Institute of MIT and Harvard	BRD-K03817886			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22+,26+/m0/s1	OIASBGFOQSUHIL-VVZHRXSXSA-N	541.337652926							95532
MLS003129277	LSM-8155	SID99357541, BRD-K18391257	44487405	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25-/m0/s1	KFMYUMLTCHBBFY-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K18391257	BRD-K18391257-001-01-6	Broad Institute of MIT and Harvard	BRD-K18391257			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25-/m0/s1	KFMYUMLTCHBBFY-RLSLOFABSA-N	529.23588996							96776
MLS003130240	LSM-7650	BRD-K60520051	44485761	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15+,19+/m1/s1	ZMFVFBQYBHAIKE-VCBZYWHSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K60520051	BRD-K60520051-001-01-5	Broad Institute of MIT and Harvard	BRD-K60520051			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15+,19+/m1/s1	ZMFVFBQYBHAIKE-VCBZYWHSSA-N	477.26996729							96271
MLS003129446	LSM-24052	SID99357787, BRD-K98110717	44504938	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25+/m0/s1	QVHCTLOUCAXGOY-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K98110717	BRD-K98110717-001-01-7	Broad Institute of MIT and Harvard	BRD-K98110717			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25+/m0/s1	QVHCTLOUCAXGOY-ZYLNGJIFSA-N	529.23588996							112642
MLS003130225	LSM-24053	SID99359020, BRD-K12663531	44505193	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24-/m0/s1	KMYKLRXROVKHNJ-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K12663531	BRD-K12663531-001-01-2	Broad Institute of MIT and Harvard	BRD-K12663531			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24-/m0/s1	KMYKLRXROVKHNJ-GLDPYIMESA-N	496.279803692							112643
MLS003129588	LSM-7434	BRD-K45882653	44506095	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13-,15+/m1/s1	FOLOUAULJSJVDY-NFAWXSAZSA-N	CNC[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K45882653	BRD-K45882653-001-01-1	Broad Institute of MIT and Harvard	BRD-K45882653			CNC[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13-,15+/m1/s1	FOLOUAULJSJVDY-NFAWXSAZSA-N	339.227039838							96055
MLS003129311	LSM-24054	BRD-K32289761	44504969	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19-,24-/m0/s1	DZRIWTKXHLXUTO-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K32289761	BRD-K32289761-001-01-3	Broad Institute of MIT and Harvard	BRD-K32289761			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19-,24-/m0/s1	DZRIWTKXHLXUTO-JXQFQVJHSA-N	510.259068248							112644
MLS003130335	LSM-24055	BRD-K09825696	44505453	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15+,19-/m0/s1	RMZGJSLXUIRDMP-KHYOSLBOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K09825696	BRD-K09825696-001-01-3	Broad Institute of MIT and Harvard	BRD-K09825696			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cnnn2CCCC1=O	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15+,19-/m0/s1	RMZGJSLXUIRDMP-KHYOSLBOSA-N	477.26996729							112645
MLS003130217	LSM-24056	BRD-K56261053	44506092	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20+,24+/m1/s1	XBPVHNZVBFLVIV-NMMYMHLASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K56261053	BRD-K56261053-001-01-0	Broad Institute of MIT and Harvard	BRD-K56261053			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc2cnnn2CCCC1=O	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20+,24+/m1/s1	XBPVHNZVBFLVIV-NMMYMHLASA-N	501.295119398							112646
MLS003129549	LSM-24057	SID99357924, BRD-K17119330	44486947	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25+/m0/s1	KFMYUMLTCHBBFY-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K17119330	BRD-K17119330-001-01-3	Broad Institute of MIT and Harvard	BRD-K17119330			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25+/m0/s1	KFMYUMLTCHBBFY-ZYLNGJIFSA-N	529.23588996							112647
MLS003130221	LSM-24058	SID99359016, BRD-K50137122	44504978	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17-,20+/m0/s1	IGJDKOMBBXSAPT-ABSDTBQOSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K50137122	BRD-K50137122-001-01-5	Broad Institute of MIT and Harvard	BRD-K50137122			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17-,20+/m0/s1	IGJDKOMBBXSAPT-ABSDTBQOSA-N	444.248503564							112648
MLS003130234	LSM-24059	BRD-K55717791	44506035	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18-,23+/m1/s1	NYFKVVDOCVTYTM-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K55717791	BRD-K55717791-001-01-9	Broad Institute of MIT and Harvard	BRD-K55717791			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18-,23+/m1/s1	NYFKVVDOCVTYTM-PNCHPQGNSA-N	516.269632932							112649
MLS003129108	LSM-24060	SID99357452, BRD-K63257717	44496825	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15-,18-/m0/s1	WXHQIOUFBAEATF-MPGHIAIKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K63257717	BRD-K63257717-001-01-7	Broad Institute of MIT and Harvard	BRD-K63257717			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2cnnn2CCCC1=O	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15-,18-/m0/s1	WXHQIOUFBAEATF-MPGHIAIKSA-N	407.253254586							112650
MLS003129602	LSM-8148	BRD-K15489726, SID99358013	44506006	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25+/m0/s1	GHLJLHKVBJDFKH-BPYKYCOYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K15489726	BRD-K15489726-001-01-4	Broad Institute of MIT and Harvard	BRD-K15489726			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25+/m0/s1	GHLJLHKVBJDFKH-BPYKYCOYSA-N	551.285617354							96769
MLS003129194	LSM-24061	BRD-K01051931	44491452	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19-,22-/m1/s1	YRBTUIBMTXMQGX-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K01051931	BRD-K01051931-001-01-9	Broad Institute of MIT and Harvard	BRD-K01051931			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19-,22-/m1/s1	YRBTUIBMTXMQGX-WOIUINJBSA-N	473.26381927							112651
MLS003129488	LSM-7267	BRD-K32162364, SID99357822	44488171	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19-,23+/m1/s1	QHTRHHVBBSPOHC-PWHSHALESA-N	COc1ccccc1CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K32162364	BRD-K32162364-001-01-3	Broad Institute of MIT and Harvard	BRD-K32162364			COc1ccccc1CN(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19-,23+/m1/s1	QHTRHHVBBSPOHC-PWHSHALESA-N	459.284554714							95888
MLS003129540	LSM-24062	BRD-K33635343	44505789	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21+/m0/s1	APDMZOWNVCUUKT-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K33635343	BRD-K33635343-001-01-3	Broad Institute of MIT and Harvard	BRD-K33635343			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21+/m0/s1	APDMZOWNVCUUKT-WAOWUJCRSA-N	464.31110382							112652
BRD-K60063821-001-01-5	LSM-24063	BRD-K60063821	44505632	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19+,22-/m1/s1	ZIMKOTFORJXDIC-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K60063821	BRD-K60063821-001-01-5	Broad Institute of MIT and Harvard	BRD-K60063821			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19+,22-/m1/s1	ZIMKOTFORJXDIC-XQBPLPMBSA-N	435.320940222							112653
MLS003130329	LSM-8029	BRD-K92803302	44488170	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19+,23+/m1/s1	QHTRHHVBBSPOHC-MSYCTHLASA-N	COc1ccccc1CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K92803302	BRD-K92803302-001-01-4	Broad Institute of MIT and Harvard	BRD-K92803302			COc1ccccc1CN(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19+,23+/m1/s1	QHTRHHVBBSPOHC-MSYCTHLASA-N	459.284554714							96650
MLS003129337	LSM-24064	BRD-K06507315, SID99357647	44493071	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17+,21+/m0/s1	HYXYHDZNHQRBPW-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K06507315	BRD-K06507315-001-01-1	Broad Institute of MIT and Harvard	BRD-K06507315			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17+,21+/m0/s1	HYXYHDZNHQRBPW-CSODHUTKSA-N	476.254731796							112654
MLS003129169	LSM-24065	BRD-K01752094	44486971	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15+,19+/m0/s1	ZMFVFBQYBHAIKE-QMTMVMCOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K01752094	BRD-K01752094-001-01-5	Broad Institute of MIT and Harvard	BRD-K01752094			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15+,19+/m0/s1	ZMFVFBQYBHAIKE-QMTMVMCOSA-N	477.26996729							112655
MLS003129358	LSM-8198	BRD-K33480200	44505881	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18-,21+/m1/s1	BVMGYWBUQYFDAA-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K33480200	BRD-K33480200-001-01-6	Broad Institute of MIT and Harvard	BRD-K33480200			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18-,21+/m1/s1	BVMGYWBUQYFDAA-OPYAIIAOSA-N	430.269239008							96819
MLS003129614	LSM-24066	BRD-K18405763	44495962	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17+,21+/m1/s1	HYXYHDZNHQRBPW-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K18405763	BRD-K18405763-001-01-1	Broad Institute of MIT and Harvard	BRD-K18405763			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17+,21+/m1/s1	HYXYHDZNHQRBPW-WWMYMODYSA-N	476.254731796							112656
MLS003129142	LSM-8151	BRD-K16079243, SID99357482	44504986	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22-/m0/s1	MESWQEBVROHANN-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K16079243	BRD-K16079243-001-01-6	Broad Institute of MIT and Harvard	BRD-K16079243			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22-/m0/s1	MESWQEBVROHANN-JQVVWYNYSA-N	457.26890465							96772
MLS003129756	LSM-24067	BRD-K54332480	44505187	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17+/m0/s1	SUQCROIYCBRRRP-ZMSDIMECSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K54332480	BRD-K54332480-001-01-4	Broad Institute of MIT and Harvard	BRD-K54332480			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17+/m0/s1	SUQCROIYCBRRRP-ZMSDIMECSA-N	463.240639154							112657
N'-(3-chloro-4-methylphenyl)-5-isoxazolecarbohydrazide	LSM-24068	SID26727967, BRD-K02448821	2811332	InChI=1S/C11H10ClN3O2/c1-7-2-3-8(6-9(7)12)14-15-11(16)10-4-5-13-17-10/h2-6,14H,1H3,(H,15,16)	SXGOUNMLGQODFL-UHFFFAOYSA-N	Cc1ccc(NNC(=O)c2oncc2)cc1Cl	BroadT	BRD-K02448821	BRD-K02448821-001-08-4	Maybridge	HTS 03643			Cc1ccc(NNC(=O)c2ccno2)cc1Cl	InChI=1S/C11H10ClN3O2/c1-7-2-3-8(6-9(7)12)14-15-11(16)10-4-5-13-17-10/h2-6,14H,1H3,(H,15,16)	SXGOUNMLGQODFL-UHFFFAOYSA-N	251.0461543							112658
AC1LXRVC	LSM-24069	BRD-K42958872	1835693	InChI=1S/C23H21BrN6O3/c1-2-31-19-11-14(12-27-28-22(25)20-23(26)30-33-29-20)10-18(24)21(19)32-13-16-8-5-7-15-6-3-4-9-17(15)16/h3-12H,2,13H2,1H3,(H2,25,28)(H2,26,30)	TVXDYAQKPKQXHU-UHFFFAOYSA-N	CCOc1cc(C=NN=C(N)c2nonc2N)cc(Br)c1OCc3cccc4ccccc34	BroadT	BRD-K42958872	BRD-K42958872-001-08-2	InterBioScreen Ltd.	STOCK3S-48125			CCOc1cc(C=NN=C(N)c2nonc2N)cc(Br)c1OCc1cccc2ccccc12	InChI=1S/C23H21BrN6O3/c1-2-31-19-11-14(12-27-28-22(25)20-23(26)30-33-29-20)10-18(24)21(19)32-13-16-8-5-7-15-6-3-4-9-17(15)16/h3-12H,2,13H2,1H3,(H2,25,28)(H2,26,30)	TVXDYAQKPKQXHU-UHFFFAOYSA-N	508.085851192							112659
MLS000057148	LSM-24070	SID26514032, SID3714227, BRD-K34987414	2080432	InChI=1S/C19H24N2O3S/c1-13-11-18(14(2)21(13)9-10-24-4)19(23)12-25-17-7-5-16(6-8-17)20-15(3)22/h5-8,11H,9-10,12H2,1-4H3,(H,20,22)	WQBKGTJPOPZNAU-UHFFFAOYSA-N	COCCn1c(C)cc(C(=O)CSc2ccc(NC(=O)C)cc2)c1C	BroadT	BRD-K34987414	BRD-K34987414-001-05-2	Enamine Ltd.	T5258024			COCCn1c(C)cc(C(=O)CSc2ccc(NC(C)=O)cc2)c1C	InChI=1S/C19H24N2O3S/c1-13-11-18(14(2)21(13)9-10-24-4)19(23)12-25-17-7-5-16(6-8-17)20-15(3)22/h5-8,11H,9-10,12H2,1-4H3,(H,20,22)	WQBKGTJPOPZNAU-UHFFFAOYSA-N	360.150763338							112660
SMR000015674	LSM-44022	SID7971300, BRD-K60605940	756683	InChI=1S/C15H17N5O2/c1-21-11-4-3-10(7-12(11)22-2)5-6-16-14-13-15(18-8-17-13)20-9-19-14/h3-4,7-9H,5-6H2,1-2H3,(H2,16,17,18,19,20)	LIUUGIOJOWHONS-UHFFFAOYSA-N	COc1ccc(CCNc2[nH]cnc3ncnc23)cc1OC	BroadT	BRD-K60605940	BRD-K60605940-001-03-5	Life Chemicals Inc.	F0578-0078			COc1ccc(CCNc2ncnc3[nH]cnc23)cc1OC	InChI=1S/C15H17N5O2/c1-21-11-4-3-10(7-12(11)22-2)5-6-16-14-13-15(18-8-17-13)20-9-19-14/h3-4,7-9H,5-6H2,1-2H3,(H2,16,17,18,19,20)	LIUUGIOJOWHONS-UHFFFAOYSA-N	299.138224834							
5-(4-Methylphenyl)-1-phenyl-1H-imidazole-2-thiol	LSM-24072	SID24828776, BRD-K71642092	4962103	InChI=1S/C16H14N2S/c1-12-7-9-13(10-8-12)15-11-17-16(19)18(15)14-5-3-2-4-6-14/h2-11H,1H3,(H,17,19)	GVSVUBISEJFHJQ-UHFFFAOYSA-N	Cc1ccc(cc1)c2cnc(S)n2c3ccccc3	BroadT	BRD-K71642092	BRD-K71642092-001-05-6	Enamine Ltd.	T5343028			Cc1ccc(cc1)-c1cnc(S)n1-c1ccccc1	InChI=1S/C16H14N2S/c1-12-7-9-13(10-8-12)15-11-17-16(19)18(15)14-5-3-2-4-6-14/h2-11H,1H3,(H,17,19)	GVSVUBISEJFHJQ-UHFFFAOYSA-N	266.087769158							112662
AK-968/41924400	LSM-24073	SID22412924, BRD-K43872124	843841	InChI=1S/C16H19N3OS2/c1-3-5-14-9-12(10-22-14)15(20)18-19-16(21)17-13-7-4-6-11(2)8-13/h4,6-10H,3,5H2,1-2H3,(H,18,20)(H2,17,19,21)	LAWMTNHANIOMNE-UHFFFAOYSA-N	CCCc1cc(cs1)C(=O)NN=C(S)Nc2cccc(C)c2	BroadT	BRD-K43872124	BRD-K43872124-001-05-6	Specs	AK-968/41924400			CCCc1cc(cs1)C(=O)NN=C(S)Nc1cccc(C)c1	InChI=1S/C16H19N3OS2/c1-3-5-14-9-12(10-22-14)15(20)18-19-16(21)17-13-7-4-6-11(2)8-13/h4,6-10H,3,5H2,1-2H3,(H,18,20)(H2,17,19,21)	LAWMTNHANIOMNE-UHFFFAOYSA-N	333.096953638							112663
ASN 05113850	LSM-24074	SID850750, SID26668708, BRD-K98326311	653290	InChI=1S/C26H26N4O4/c1-33-23-12-20-11-21(25(31)29-22(20)13-24(23)34-2)17-30(16-19-9-6-10-27-14-19)26(32)28-15-18-7-4-3-5-8-18/h3-14H,15-17H2,1-2H3,(H,28,32)(H,29,31)	MBENVHPUZJYPSD-UHFFFAOYSA-N	COc1cc2cc(CN(Cc3cccnc3)C(=O)NCc4ccccc4)c(O)nc2cc1OC	BroadT	BRD-K98326311	BRD-K98326311-001-05-0	Asinex Ltd.	ASN 05113850			COc1cc2cc(CN(Cc3cccnc3)C(=O)NCc3ccccc3)c(O)nc2cc1OC	InChI=1S/C26H26N4O4/c1-33-23-12-20-11-21(25(31)29-22(20)13-24(23)34-2)17-30(16-19-9-6-10-27-14-19)26(32)28-15-18-7-4-3-5-8-18/h3-14H,15-17H2,1-2H3,(H,28,32)(H,29,31)	MBENVHPUZJYPSD-UHFFFAOYSA-N	458.195405352							112664
SMR000156094	LSM-24075	SID17407117, BRD-K88922023	11958428	InChI=1S/C18H16Cl2N4OS2/c1-3-4-5-15(25)24-18-21-10(2)16(27-18)14-9-26-17(23-14)22-13-7-6-11(19)8-12(13)20/h3,6-9H,1,4-5H2,2H3,(H,22,23)(H,21,24,25)	XFWWFORAGHXJTI-UHFFFAOYSA-N	Cc1nc(NC(=O)CCC=C)sc1c2csc(Nc3ccc(Cl)cc3Cl)n2	BroadT	BRD-K88922023	BRD-K88922023-001-05-7	University of California at Davis	CLY_Corr_E03			Cc1nc(NC(=O)CCC=C)sc1-c1csc(Nc2ccc(Cl)cc2Cl)n1	InChI=1S/C18H16Cl2N4OS2/c1-3-4-5-15(25)24-18-21-10(2)16(27-18)14-9-26-17(23-14)22-13-7-6-11(19)8-12(13)20/h3,6-9H,1,4-5H2,2H3,(H,22,23)(H,21,24,25)	XFWWFORAGHXJTI-UHFFFAOYSA-N	438.014257972							112665
MLS001004790	LSM-24076	SID26657490, BRD-K31425478	2321599	InChI=1S/C25H22N4O2/c30-25(27-19-5-7-20(8-6-19)29-13-15-31-16-14-29)22-17-24(18-9-11-26-12-10-18)28-23-4-2-1-3-21(22)23/h1-12,17H,13-16H2,(H,27,30)	XJUNZAIMQIPYHL-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)N2CCOCC2)c3cc(nc4ccccc34)c5ccncc5	BroadT	BRD-K31425478	BRD-K31425478-001-06-7	Enamine Ltd.	T0503-9481			O=C(Nc1ccc(cc1)N1CCOCC1)c1cc(nc2ccccc12)-c1ccncc1	InChI=1S/C25H22N4O2/c30-25(27-19-5-7-20(8-6-19)29-13-15-31-16-14-29)22-17-24(18-9-11-26-12-10-18)28-23-4-2-1-3-21(22)23/h1-12,17H,13-16H2,(H,27,30)	XJUNZAIMQIPYHL-UHFFFAOYSA-N	410.174275984							112666
SMR000195250	LSM-24077	SID17415923, BRD-K01804537	1339511	InChI=1S/C23H19ClN4O2S/c1-13-7-8-14(21-25-17-5-3-4-6-18(17)26-21)11-19(13)27-23(31)28-22(29)16-12-15(24)9-10-20(16)30-2/h3-12H,1-2H3,(H,25,26)(H2,27,28,29,31)	JPBYRMUCCOLYTQ-UHFFFAOYSA-N	COc1ccc(Cl)cc1C(=O)NC(=S)Nc2cc(ccc2C)c3nc4ccccc4[nH]3	BroadT	BRD-K01804537	BRD-K01804537-001-06-8	ChemBridge Corporation	6492168			COc1ccc(Cl)cc1C(=O)NC(=S)Nc1cc(ccc1C)-c1nc2ccccc2[nH]1	InChI=1S/C23H19ClN4O2S/c1-13-7-8-14(21-25-17-5-3-4-6-18(17)26-21)11-19(13)27-23(31)28-22(29)16-12-15(24)9-10-20(16)30-2/h3-12H,1-2H3,(H,25,26)(H2,27,28,29,31)	JPBYRMUCCOLYTQ-UHFFFAOYSA-N	450.091724288							112667
MLS001110838	LSM-24078	SID49720738, BRD-K20777727	20886483	InChI=1S/C18H19BrN2O2S/c1-21-7-8-24-17-6-3-12(10-15(17)21)18(22)20-11-13-9-14(19)4-5-16(13)23-2/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,22)	LUDFMDONZJCSHW-UHFFFAOYSA-N	COc1ccc(Br)cc1CNC(=O)c2ccc3SCCN(C)c3c2	BroadT	BRD-K20777727	BRD-K20777727-001-06-3	ChemDiv Inc.	C796-0402			COc1ccc(Br)cc1CNC(=O)c1ccc2SCCN(C)c2c1	InChI=1S/C18H19BrN2O2S/c1-21-7-8-24-17-6-3-12(10-15(17)21)18(22)20-11-13-9-14(19)4-5-16(13)23-2/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,22)	LUDFMDONZJCSHW-UHFFFAOYSA-N	406.035061158							112668
MLS000402395	LSM-24079	SID24780021, SID89853188, BRD-K63360033	2305102	InChI=1S/C16H11Cl3N4S/c17-9-2-4-14(12(19)7-9)21-16(24)23-22-13-5-6-20-15-8-10(18)1-3-11(13)15/h1-8H,(H,20,22)(H2,21,23,24)	GIFWBZAODHSSMV-UHFFFAOYSA-N	Clc1ccc(NC(=S)NNc2ccnc3cc(Cl)ccc23)c(Cl)c1	BroadT	BRD-K63360033	BRD-K63360033-001-05-7	Enamine Ltd.	T0505-0126			Clc1ccc(NC(=S)NNc2ccnc3cc(Cl)ccc23)c(Cl)c1	InChI=1S/C16H11Cl3N4S/c17-9-2-4-14(12(19)7-9)21-16(24)23-22-13-5-6-20-15-8-10(18)1-3-11(13)15/h1-8H,(H,20,22)(H2,21,23,24)	GIFWBZAODHSSMV-UHFFFAOYSA-N	395.977000212							112669
MLS000761234	LSM-24080	SID24833957, SID89853399, BRD-K63912744	2119551	InChI=1S/C21H21ClN4O5S2/c1-26(16-10-15(22)17(30-2)11-18(16)31-3)33(28,29)14-6-4-5-13(9-14)19(27)23-21-25-24-20(32-21)12-7-8-12/h4-6,9-12H,7-8H2,1-3H3,(H,23,25,27)	CFFQVBNJLIOUEN-UHFFFAOYSA-N	COc1cc(OC)c(cc1Cl)N(C)S(=O)(=O)c2cccc(c2)C(=O)Nc3nnc(s3)C4CC4	BroadT	BRD-K63912744	BRD-K63912744-001-07-1	Enamine Ltd.	T5247387			COc1cc(OC)c(cc1Cl)N(C)S(=O)(=O)c1cccc(c1)C(=O)Nc1nnc(s1)C1CC1	InChI=1S/C21H21ClN4O5S2/c1-26(16-10-15(22)17(30-2)11-18(16)31-3)33(28,29)14-6-4-5-13(9-14)19(27)23-21-25-24-20(32-21)12-7-8-12/h4-6,9-12H,7-8H2,1-3H3,(H,23,25,27)	CFFQVBNJLIOUEN-UHFFFAOYSA-N	508.064188902							112670
ST078211	LSM-24081	SID14738233, BRD-K66701278	1263570	InChI=1S/C17H19N3O/c18-11-13-16(19-8-4-1-5-9-19)15-10-12-6-2-3-7-14(12)20(15)17(13)21/h10H,1-9H2	ZPYOXTGXNWDWLA-UHFFFAOYSA-N	O=C1C(=C(N2CCCCC2)c3cc4CCCCc4n13)C#N	BroadT	BRD-K66701278	BRD-K66701278-001-06-1	ChemDiv Inc.	8014-2058			O=C1C(C#N)=C(N2CCCCC2)c2cc3CCCCc3n12	InChI=1S/C17H19N3O/c18-11-13-16(19-8-4-1-5-9-19)15-10-12-6-2-3-7-14(12)20(15)17(13)21/h10H,1-9H2	ZPYOXTGXNWDWLA-UHFFFAOYSA-N	281.152812258							112671
MLS000764510	LSM-24082	SID24817328, BRD-K36341910	3096139	InChI=1S/C22H28N6/c23-15-9-11-17-19(13-15)27-21(25-17)7-5-3-1-2-4-6-8-22-26-18-12-10-16(24)14-20(18)28-22/h9-14H,1-8,23-24H2,(H,25,27)(H,26,28)	GTGKXQBMUAAJPI-UHFFFAOYSA-N	Nc1ccc2[nH]c(CCCCCCCCc3nc4cc(N)ccc4[nH]3)nc2c1	BroadT	BRD-K36341910	BRD-K36341910-001-05-9	Asinex Ltd.	BAS 00255348			Nc1ccc2[nH]c(CCCCCCCCc3nc4cc(N)ccc4[nH]3)nc2c1	InChI=1S/C22H28N6/c23-15-9-11-17-19(13-15)27-21(25-17)7-5-3-1-2-4-6-8-22-26-18-12-10-16(24)14-20(18)28-22/h9-14H,1-8,23-24H2,(H,25,27)(H,26,28)	GTGKXQBMUAAJPI-UHFFFAOYSA-N	376.237544956							112672
4-Amino-3-cyclohexylcarbamoyl-isothiazole-5-carboxylic acid ethyl ester	LSM-24083	SID842928, BRD-K79860574	645199	InChI=1S/C13H19N3O3S/c1-2-19-13(18)11-9(14)10(16-20-11)12(17)15-8-6-4-3-5-7-8/h8H,2-7,14H2,1H3,(H,15,17)	FBUJSKXPEAGQDF-UHFFFAOYSA-N	CCOC(=O)c1snc(C(=O)NC2CCCCC2)c1N	BroadT	BRD-K79860574	BRD-K79860574-001-05-3	Asinex Ltd.	ASN 04061403			CCOC(=O)c1snc(C(=O)NC2CCCCC2)c1N	InChI=1S/C13H19N3O3S/c1-2-19-13(18)11-9(14)10(16-20-11)12(17)15-8-6-4-3-5-7-8/h8H,2-7,14H2,1H3,(H,15,17)	FBUJSKXPEAGQDF-UHFFFAOYSA-N	297.114712188							112673
AC1LH7NN	LSM-24084	BRD-K46729987	883032	InChI=1S/C16H17N3O3S/c1-12(14-8-10-15(11-9-14)17-13(2)20)18-19-23(21,22)16-6-4-3-5-7-16/h3-11,19H,1-2H3,(H,17,20)	PRXZGLNQUFDJFZ-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)C(=NNS(=O)(=O)c2ccccc2)C	BroadT	BRD-K46729987	BRD-K46729987-001-05-1	ChemBridge Corporation	6467808			CC(=O)Nc1ccc(cc1)C(C)=NNS(=O)(=O)c1ccccc1	InChI=1S/C16H17N3O3S/c1-12(14-8-10-15(11-9-14)17-13(2)20)18-19-23(21,22)16-6-4-3-5-7-16/h3-11,19H,1-2H3,(H,17,20)	PRXZGLNQUFDJFZ-UHFFFAOYSA-N	331.099062124							112674
ASN 05550767	LSM-15356	BRD-A04599535	646553	InChI=1S/C20H36N6/c1-2-8-19(20-21-22-23-26(20)18-11-4-3-5-12-18)25-15-13-24(14-16-25)17-9-6-7-10-17/h17-19H,2-16H2,1H3	NOMZDXQKBZKFOS-UHFFFAOYSA-N	CCCC(N1CCN(CC1)C2CCCC2)c3nnnn3C4CCCCC4	BroadT	BRD-A04599535	BRD-A04599535-003-05-3	Asinex Ltd.	ASN 05550767		Cl	CCCC(N1CCN(CC1)C1CCCC1)c1nnnn1C1CCCCC1.Cl	InChI=1S/C20H36N6.ClH/c1-2-8-19(20-21-22-23-26(20)18-11-4-3-5-12-18)25-15-13-24(14-16-25)17-9-6-7-10-17;/h17-19H,2-16H2,1H3;1H	GRFZRRHTLYAEGR-UHFFFAOYSA-N	360.300145212							104002, 104002
2GG3	LSM-24085	SID24821335, BRD-K81137269	5287184	InChI=1S/C9H9FN6/c10-5-1-3-6(4-2-5)13-14-7-8(11)15-16-9(7)12/h1-4H,(H5,11,12,15,16)	PRKNLQAUWYHUKA-UHFFFAOYSA-N	Nc1n[nH]c(N)c1N=Nc2ccc(F)cc2	BroadT	BRD-K81137269	BRD-K81137269-001-06-0	ChemDiv Inc.	8008-3829			Nc1n[nH]c(N)c1N=Nc1ccc(F)cc1	InChI=1S/C9H9FN6/c10-5-1-3-6(4-2-5)13-14-7-8(11)15-16-9(7)12/h1-4H,(H5,11,12,15,16)	PRKNLQAUWYHUKA-UHFFFAOYSA-N	220.087272548							
MLS000775763	LSM-24086	SID24831641, BRD-K27567700	2432552	InChI=1S/C21H16F2N2O5S/c1-29-13-4-7-17(26)15(9-13)18(27)11-8-16(19(24)30-10-11)20(28)25-12-2-5-14(6-3-12)31-21(22)23/h2-10,21,24,26H,1H3,(H,25,28)	JOLCWSYBUSOJKF-UHFFFAOYSA-N	COc1ccc(O)c(c1)C(=O)C2=COC(=N)C(=C2)C(=O)Nc3ccc(SC(F)F)cc3	BroadT	BRD-K27567700	BRD-K27567700-001-06-2	Enamine Ltd.	T0517-5134			COc1ccc(O)c(c1)C(=O)c1coc(=N)c(c1)C(=O)Nc1ccc(SC(F)F)cc1	InChI=1S/C21H16F2N2O5S/c1-29-13-4-7-17(26)15(9-13)18(27)11-8-16(19(24)30-10-11)20(28)25-12-2-5-14(6-3-12)31-21(22)23/h2-10,21,24,26H,1H3,(H,25,28)	JOLCWSYBUSOJKF-UHFFFAOYSA-N	446.074798722							112676
F3394-0798	LSM-24087	SID14727491, BRD-K22627745	984111	InChI=1S/C18H20N2O2S2/c1-10-8-11(2)13(4)18(12(10)3)24(21,22)20-15-6-7-17-16(9-15)19-14(5)23-17/h6-9,20H,1-5H3	JUZLMBVWPRSVEE-UHFFFAOYSA-N	Cc1cc(C)c(C)c(c1C)S(=O)(=O)Nc2ccc3sc(C)nc3c2	BroadT	BRD-K22627745	BRD-K22627745-001-05-8	Specs	AQ-750/42051323			Cc1nc2cc(NS(=O)(=O)c3c(C)c(C)cc(C)c3C)ccc2s1	InChI=1S/C18H20N2O2S2/c1-10-8-11(2)13(4)18(12(10)3)24(21,22)20-15-6-7-17-16(9-15)19-14(5)23-17/h6-9,20H,1-5H3	JUZLMBVWPRSVEE-UHFFFAOYSA-N	360.09661928							112677
T5331546	LSM-24088	SID22407138, BRD-A08297471	4883657	InChI=1S/C23H37N3O4/c1-5-29-21-16-20(25-11-13-28-14-12-25)22(30-6-2)15-19(21)24-18(4)23(27)26-9-7-17(3)8-10-26/h15-18,24H,5-14H2,1-4H3	DFCOTVQVNTXONE-UHFFFAOYSA-N	CCOc1cc(N2CCOCC2)c(OCC)cc1NC(C)C(=O)N3CCC(C)CC3	BroadT	BRD-A08297471	BRD-A08297471-001-06-8	Enamine Ltd.	T5331546			CCOc1cc(N2CCOCC2)c(OCC)cc1NC(C)C(=O)N1CCC(C)CC1	InChI=1S/C23H37N3O4/c1-5-29-21-16-20(25-11-13-28-14-12-25)22(30-6-2)15-19(21)24-18(4)23(27)26-9-7-17(3)8-10-26/h15-18,24H,5-14H2,1-4H3	DFCOTVQVNTXONE-UHFFFAOYSA-N	419.278406694							112678
AC1NE7YD	LSM-24089	SID17514213, BRD-A47235740	4638016	InChI=1S/C12H11ClN2O2/c13-8-3-1-7(2-4-8)9-5-14-15-11(9)12(16)10-6-17-10/h1-4,9-10,14H,5-6H2	SZDKEIKBDDMERI-UHFFFAOYSA-N	Clc1ccc(cc1)C2CNN=C2C(=O)C3CO3	BroadT	BRD-A47235740	BRD-A47235740-001-04-1	InterBioScreen Ltd.	STOCK2S-06790			Clc1ccc(cc1)C1CNN=C1C(=O)C1CO1	InChI=1S/C12H11ClN2O2/c13-8-3-1-7(2-4-8)9-5-14-15-11(9)12(16)10-6-17-10/h1-4,9-10,14H,5-6H2	SZDKEIKBDDMERI-UHFFFAOYSA-N	250.050905322							112679
113858-90-5	LSM-24090	SID24826122, BRD-K29241100	721260	InChI=1S/C10H10N2O2S/c1-3-14-10(13)8-4-7(5-11)9(15)12-6(8)2/h4H,3H2,1-2H3,(H,12,15)	YMUNSRSFLNLDAF-UHFFFAOYSA-N	CCOC(=O)c1cc(C#N)c(S)nc1C	BroadT	BRD-K29241100	BRD-K29241100-001-05-0	Enamine Ltd.	T5305323			CCOC(=O)c1cc(C#N)c(S)nc1C	InChI=1S/C10H10N2O2S/c1-3-14-10(13)8-4-7(5-11)9(15)12-6(8)2/h4H,3H2,1-2H3,(H,12,15)	YMUNSRSFLNLDAF-UHFFFAOYSA-N	222.04629827							112680
MLS000699471	LSM-24091	SID22412120, BRD-K90586879	822962	InChI=1S/C14H12ClNO2/c1-9-12(14(17)18-2)7-8-13(16-9)10-3-5-11(15)6-4-10/h3-8H,1-2H3	OOEFUVBZCSVRNB-UHFFFAOYSA-N	COC(=O)c1ccc(nc1C)c2ccc(Cl)cc2	BroadT	BRD-K90586879	BRD-K90586879-001-05-1	Specs	AG-401/42873868			COC(=O)c1ccc(nc1C)-c1ccc(Cl)cc1	InChI=1S/C14H12ClNO2/c1-9-12(14(17)18-2)7-8-13(16-9)10-3-5-11(15)6-4-10/h3-8H,1-2H3	OOEFUVBZCSVRNB-UHFFFAOYSA-N	261.055656344							112681
MLS000591681	LSM-24092	SID17503774, BRD-K62375146	1840247	InChI=1S/C18H16O4S/c1-2-21-18(20)17-14-10-12(19)8-9-15(14)22-16(17)11-23-13-6-4-3-5-7-13/h3-10,19H,2,11H2,1H3	QOMJXOZGZZSHKH-UHFFFAOYSA-N	CCOC(=O)c1c(CSc2ccccc2)oc3ccc(O)cc13	BroadT	BRD-K62375146	BRD-K62375146-001-05-0	InterBioScreen Ltd.	STOCK3S-51992			CCOC(=O)c1c(CSc2ccccc2)oc2ccc(O)cc12	InChI=1S/C18H16O4S/c1-2-21-18(20)17-14-10-12(19)8-9-15(14)22-16(17)11-23-13-6-4-3-5-7-13/h3-10,19H,2,11H2,1H3	QOMJXOZGZZSHKH-UHFFFAOYSA-N	328.076929682							112682
AC1MMHQ4	LSM-24093	SID24810332, BRD-K36492142	3261208	InChI=1S/C16H20N4O5S/c1-2-25-16(24)19-8-6-18(7-9-19)12(21)3-5-20-14(22)13-11(4-10-26-13)17-15(20)23/h4,10H,2-3,5-9H2,1H3,(H,17,23)	WBONBWCZIDQLCB-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)CCN2C(=O)Nc3ccsc3C2=O	BroadT	BRD-K36492142	BRD-K36492142-001-05-0	ChemDiv Inc.	C172-0457			CCOC(=O)N1CCN(CC1)C(=O)CCn1c(=O)[nH]c2ccsc2c1=O	InChI=1S/C16H20N4O5S/c1-2-25-16(24)19-8-6-18(7-9-19)12(21)3-5-20-14(22)13-11(4-10-26-13)17-15(20)23/h4,10H,2-3,5-9H2,1H3,(H,17,23)	WBONBWCZIDQLCB-UHFFFAOYSA-N	380.11544047							112683
AC1MMTYF	LSM-24094	SID4250587, BRD-K35478761	3244380	InChI=1S/C12H11N3O4/c1-7-3-8-10(19-7)4-9-12(17)15(5-11(16)18-2)13-6-14(8)9/h3-4,6H,5H2,1-2H3	GEQJPZNCKUASDY-UHFFFAOYSA-N	COC(=O)CN1N=Cn2c(cc3oc(C)cc23)C1=O	BroadT	BRD-K35478761	BRD-K35478761-001-06-8	ChemDiv Inc.	C794-0004			COC(=O)Cn1ncn2c3cc(C)oc3cc2c1=O	InChI=1S/C12H11N3O4/c1-7-3-8-10(19-7)4-9-12(17)15(5-11(16)18-2)13-6-14(8)9/h3-4,6H,5H2,1-2H3	GEQJPZNCKUASDY-UHFFFAOYSA-N	261.074955862							112684
ST50274698	LSM-24095	BRD-A76506127	655159	InChI=1S/C16H19N3O4S/c1-4-23-15(22)10-7-5-6-8-11(10)18-13(20)9-12-14(21)19(3)16(17-2)24-12/h5-8,12H,4,9H2,1-3H3,(H,18,20)	DWOQEDLNZSBFHQ-UHFFFAOYSA-N	CCOC(=O)c1ccccc1NC(=O)CC2SC(=NC)N(C)C2=O	BroadT	BRD-A76506127	BRD-A76506127-001-05-9	Asinex Ltd.	BAS 04357921			CCOC(=O)c1ccccc1NC(=O)CC1SC(=NC)N(C)C1=O	InChI=1S/C16H19N3O4S/c1-4-23-15(22)10-7-5-6-8-11(10)18-13(20)9-12-14(21)19(3)16(17-2)24-12/h5-8,12H,4,9H2,1-3H3,(H,18,20)	DWOQEDLNZSBFHQ-UHFFFAOYSA-N	349.109626808							112685
5-(3,4-Dimethoxyphenyl)-4H-1,2,4-triazol-3-amine	LSM-24096	SID849878, BRD-K13865730	652386	InChI=1S/C10H12N4O2/c1-15-7-4-3-6(5-8(7)16-2)9-12-10(11)14-13-9/h3-5H,1-2H3,(H3,11,12,13,14)	AHCGZNXGBCOYSI-UHFFFAOYSA-N	COc1ccc(cc1OC)c2n[nH]c(N)n2	BroadT	BRD-K13865730	BRD-K13865730-001-05-2	Asinex Ltd.	BAS 00671128			COc1ccc(cc1OC)-c1n[nH]c(N)n1	InChI=1S/C10H12N4O2/c1-15-7-4-3-6(5-8(7)16-2)9-12-10(11)14-13-9/h3-5H,1-2H3,(H3,11,12,13,14)	AHCGZNXGBCOYSI-UHFFFAOYSA-N	220.096025664							112686
MLS000672080	LSM-24097	SID24788577, BRD-K17956278	1288098	InChI=1S/C23H20FN3/c24-21-13-11-19(12-14-21)23-20(16-25-15-18-7-3-1-4-8-18)17-27(26-23)22-9-5-2-6-10-22/h1-14,17,25H,15-16H2	RRZJGAZTGINHFZ-UHFFFAOYSA-N	Fc1ccc(cc1)c2nn(cc2CNCc3ccccc3)c4ccccc4	BroadT	BRD-K17956278	BRD-K17956278-001-05-3	ChemBridge Corporation	7727295			Fc1ccc(cc1)-c1nn(cc1CNCc1ccccc1)-c1ccccc1	InChI=1S/C23H20FN3/c24-21-13-11-19(12-14-21)23-20(16-25-15-18-7-3-1-4-8-18)17-27(26-23)22-9-5-2-6-10-22/h1-14,17,25H,15-16H2	RRZJGAZTGINHFZ-UHFFFAOYSA-N	357.16412587							112687
2-Amino-9-pentyl-9H-purin-6-yl hydrosulfide	LSM-24098	SID26665113, BRD-K80088492	3003779	InChI=1S/C10H15N5S/c1-2-3-4-5-15-6-12-7-8(15)13-10(11)14-9(7)16/h6H,2-5H2,1H3,(H3,11,13,14,16)	GKBUGVWFLBNNPA-UHFFFAOYSA-N	CCCCCn1cnc2c(S)nc(N)nc12	BroadT	BRD-K80088492	BRD-K80088492-001-04-0	National Cancer Institute Chemotherapeutic Agents Repository	58907			CCCCCn1cnc2c(S)nc(N)nc12	InChI=1S/C10H15N5S/c1-2-3-4-5-15-6-12-7-8(15)13-10(11)14-9(7)16/h6H,2-5H2,1H3,(H3,11,13,14,16)	GKBUGVWFLBNNPA-UHFFFAOYSA-N	237.10481622							112688
HMS2301M22	LSM-44023	BRD-K94538718	11958899	InChI=1S/C15H14N4O3/c1-10-7-12(18-17-10)15(20)19-16-6-2-3-11-4-5-13-14(8-11)22-9-21-13/h2-8H,9H2,1H3,(H,17,18)(H,19,20)/b3-2+,16-6?	NJRPPCUYLXVFAW-XVBVOHTKSA-N	Cc1cc([nH]n1)C(=O)NN=C\C=C\c2ccc3OCOc3c2	BroadT	BRD-K94538718	BRD-K94538718-001-05-3	ChemBridge Corporation	5759153			Cc1cc([nH]n1)C(=O)NN=C\C=C\c1ccc2OCOc2c1	InChI=1S/C15H14N4O3/c1-10-7-12(18-17-10)15(20)19-16-6-2-3-11-4-5-13-14(8-11)22-9-21-13/h2-8H,9H2,1H3,(H,17,18)(H,19,20)/b3-2+,16-6?	NJRPPCUYLXVFAW-XVBVOHTKSA-N	298.106590348							
T5833730	LSM-24100	SID24838127, BRD-K12380975	5221119	InChI=1S/C18H21N5O4S/c19-28(26,27)16-6-7-17(18(12-16)23(24)25)21-20-15-8-10-22(11-9-15)13-14-4-2-1-3-5-14/h1-7,12,21H,8-11,13H2,(H2,19,26,27)	FLXSMIQOKWFYOA-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(NN=C2CCN(Cc3ccccc3)CC2)c(c1)[N+](=O)[O-]	BroadT	BRD-K12380975	BRD-K12380975-001-05-7	Enamine Ltd.	T0507-8047			NS(=O)(=O)c1ccc(NN=C2CCN(Cc3ccccc3)CC2)c(c1)[N+]([O-])=O	InChI=1S/C18H21N5O4S/c19-28(26,27)16-6-7-17(18(12-16)23(24)25)21-20-15-8-10-22(11-9-15)13-14-4-2-1-3-5-14/h1-7,12,21H,8-11,13H2,(H2,19,26,27)	FLXSMIQOKWFYOA-UHFFFAOYSA-N	403.131424892							112690
MS-3063	LSM-44024	SID17402108, BRD-K64231918	5786980	InChI=1S/C18H24N4O2/c1-20(2)15(13-22-11-9-21(3)10-12-22)16-18(23)24-17(19-16)14-7-5-4-6-8-14/h4-8H,9-13H2,1-3H3/b16-15-	IESPXOJBGIZSPC-NXVVXOECSA-N	CN(C)\C(=C\1/N=C(OC1=O)c2ccccc2)\CN3CCN(C)CC3	BroadT	BRD-K64231918	BRD-K64231918-001-05-9	Key Organics Ltd.	MS-3063			CN(C)C(\CN1CCN(C)CC1)=C1/N=C(OC1=O)c1ccccc1	InChI=1S/C18H24N4O2/c1-20(2)15(13-22-11-9-21(3)10-12-22)16-18(23)24-17(19-16)14-7-5-4-6-8-14/h4-8H,9-13H2,1-3H3/b16-15-	IESPXOJBGIZSPC-NXVVXOECSA-N	328.189926048							
AC1MJYTX	LSM-24102	SID49643066, BRD-K54768399	3145514	InChI=1S/C18H20O5/c1-3-11-8-14-12-6-4-5-7-13(12)18(20)23-16(14)9-15(11)22-10-17(19)21-2/h8-9H,3-7,10H2,1-2H3	DBNAWMAKYUQELH-UHFFFAOYSA-N	CCc1cc2C3=C(CCCC3)C(=O)Oc2cc1OCC(=O)OC	BroadT	BRD-K54768399	BRD-K54768399-001-05-0	Asinex Ltd.	BAS 03150481			CCc1cc2c3CCCCc3c(=O)oc2cc1OCC(=O)OC	InChI=1S/C18H20O5/c1-3-11-8-14-12-6-4-5-7-13(12)18(20)23-16(14)9-15(11)22-10-17(19)21-2/h8-9H,3-7,10H2,1-2H3	DBNAWMAKYUQELH-UHFFFAOYSA-N	316.13107374							112692
SMR000030535	LSM-24103	SID26724548, SID4242568, BRD-K46368891	3237403	InChI=1S/C28H27N5O4/c1-37-24-11-5-4-10-23(24)33-19-22(20-8-2-3-9-21(20)28(33)36)27(35)30-18-26(34)32-16-14-31(15-17-32)25-12-6-7-13-29-25/h2-13,19H,14-18H2,1H3,(H,30,35)	MDYNVKNLFNKQJO-UHFFFAOYSA-N	COc1ccccc1N2C=C(C(=O)NCC(=O)N3CCN(CC3)c4ccccn4)c5ccccc5C2=O	BroadT	BRD-K46368891	BRD-K46368891-001-05-3	ChemDiv Inc.	C033-0505			COc1ccccc1-n1cc(C(=O)NCC(=O)N2CCN(CC2)c2ccccn2)c2ccccc2c1=O	InChI=1S/C28H27N5O4/c1-37-24-11-5-4-10-23(24)33-19-22(20-8-2-3-9-21(20)28(33)36)27(35)30-18-26(34)32-16-14-31(15-17-32)25-12-6-7-13-29-25/h2-13,19H,14-18H2,1H3,(H,30,35)	MDYNVKNLFNKQJO-UHFFFAOYSA-N	497.206304394							112693
SMR000092515	LSM-24104	SID7967466, BRD-K88718068	1088996	InChI=1S/C23H18N2O4S/c26-22(24-11-15-7-8-19-20(10-15)29-14-28-19)13-25-12-17(16-4-1-2-5-18(16)25)23(27)21-6-3-9-30-21/h1-10,12H,11,13-14H2,(H,24,26)	UCDCNUGIXHXJMX-UHFFFAOYSA-N	O=C(Cn1cc(C(=O)c2cccs2)c3ccccc13)NCc4ccc5OCOc5c4	BroadT	BRD-K88718068	BRD-K88718068-001-04-8	ChemDiv Inc.	6655-0495			O=C(Cn1cc(C(=O)c2cccs2)c2ccccc12)NCc1ccc2OCOc2c1	InChI=1S/C23H18N2O4S/c26-22(24-11-15-7-8-19-20(10-15)29-14-28-19)13-25-12-17(16-4-1-2-5-18(16)25)23(27)21-6-3-9-30-21/h1-10,12H,11,13-14H2,(H,24,26)	UCDCNUGIXHXJMX-UHFFFAOYSA-N	418.098727766							112694
6,6-Dimethyl-5,8-dihydro-6H-7-oxa-9-thia-1,3-diaza-fluoren-4-ylamine	LSM-24105	SID848359, BRD-K85542667	650805	InChI=1S/C11H13N3OS/c1-11(2)3-6-7(4-15-11)16-10-8(6)9(12)13-5-14-10/h5H,3-4H2,1-2H3,(H2,12,13,14)	IPQMQCWBHBHOLZ-UHFFFAOYSA-N	CC1(C)Cc2c(CO1)sc3ncnc(N)c23	BroadT	BRD-K85542667	BRD-K85542667-001-05-7	Asinex Ltd.	BAS 01909678			CC1(C)Cc2c(CO1)sc1ncnc(N)c21	InChI=1S/C11H13N3OS/c1-11(2)3-6-7(4-15-11)16-10-8(6)9(12)13-5-14-10/h5H,3-4H2,1-2H3,(H2,12,13,14)	IPQMQCWBHBHOLZ-UHFFFAOYSA-N	235.077932756							112695
ZINC02979330	LSM-24106	BRD-K20716813	6807574	InChI=1S/C14H15N3O4/c1-9-12(13(18)17-14(19)16-9)7-15-21-8-10-3-5-11(20-2)6-4-10/h3-7H,8H2,1-2H3,(H2,16,17,18,19)	AACUVVMEFJMWSX-UHFFFAOYSA-N	COc1ccc(CON=Cc2c(C)nc(O)nc2O)cc1	BroadT	BRD-K20716813	BRD-K20716813-001-06-6	ChemBridge Corporation	6394098			COc1ccc(CON=Cc2c(C)nc(O)nc2O)cc1	InChI=1S/C14H15N3O4/c1-9-12(13(18)17-14(19)16-9)7-15-21-8-10-3-5-11(20-2)6-4-10/h3-7H,8H2,1-2H3,(H2,16,17,18,19)	AACUVVMEFJMWSX-UHFFFAOYSA-N	289.10625599							
MLS000660556	LSM-24107	SID24813089, BRD-K22479739	16193912	InChI=1S/C25H34FN5OS/c1-3-5-13-30(4-2)14-7-12-27-25(32)18-10-15-31(16-11-18)24-23-22(28-17-29-24)21-19(26)8-6-9-20(21)33-23/h6,8-9,17-18H,3-5,7,10-16H2,1-2H3,(H,27,32)	IWTJJTJNJCWHLK-UHFFFAOYSA-N	CCCCN(CC)CCCNC(=O)C1CCN(CC1)c2ncnc3c2sc4cccc(F)c34	BroadT	BRD-K22479739	BRD-K22479739-001-07-8	ChemDiv Inc.	C860-0877			CCCCN(CC)CCCNC(=O)C1CCN(CC1)c1ncnc2c1sc1cccc(F)c21	InChI=1S/C25H34FN5OS/c1-3-5-13-30(4-2)14-7-12-27-25(32)18-10-15-31(16-11-18)24-23-22(28-17-29-24)21-19(26)8-6-9-20(21)33-23/h6,8-9,17-18H,3-5,7,10-16H2,1-2H3,(H,27,32)	IWTJJTJNJCWHLK-UHFFFAOYSA-N	471.246809648							112697
SMR000207607	LSM-24108	SID17503927, BRD-K83426826	6176152	InChI=1S/C24H22N4O4S/c1-16-10-12-19(13-11-16)33(31,32)28(18-7-5-6-17(2)14-18)15-22(29)26-27-23-20-8-3-4-9-21(20)25-24(23)30/h3-14,25,30H,15H2,1-2H3	DIGHKHOTMPXOFV-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N(CC(=O)N=Nc2c(O)[nH]c3ccccc23)c4cccc(C)c4	BroadT	BRD-K83426826	BRD-K83426826-001-06-1	ChemDiv Inc.	5408-1605			Cc1ccc(cc1)S(=O)(=O)N(CC(=O)N=Nc1c(O)[nH]c2ccccc12)c1cccc(C)c1	InChI=1S/C24H22N4O4S/c1-16-10-12-19(13-11-16)33(31,32)28(18-7-5-6-17(2)14-18)15-22(29)26-27-23-20-8-3-4-9-21(20)25-24(23)30/h3-14,25,30H,15H2,1-2H3	DIGHKHOTMPXOFV-UHFFFAOYSA-N	462.136175914							
AC1NN2W5	LSM-24109	SID24834118, BRD-K55056716	5020196	InChI=1S/C20H20FN5O4S2/c1-2-10-26-18(12-30-16-8-6-14(21)7-9-16)24-25-20(26)31-13-19(27)23-15-4-3-5-17(11-15)32(22,28)29/h2-9,11H,1,10,12-13H2,(H,23,27)(H2,22,28,29)	WFNAQRYHERHQCN-UHFFFAOYSA-N	NS(=O)(=O)c1cccc(NC(=O)CSc2nnc(COc3ccc(F)cc3)n2CC=C)c1	BroadT	BRD-K55056716	BRD-K55056716-001-06-3	Enamine Ltd.	T5239037			C=CCn1c(COc2ccc(F)cc2)nnc1SCC(=O)Nc1cccc(c1)S(N)(=O)=O	InChI=1S/C20H20FN5O4S2/c1-2-10-26-18(12-30-16-8-6-14(21)7-9-16)24-25-20(26)31-13-19(27)23-15-4-3-5-17(11-15)32(22,28)29/h2-9,11H,1,10,12-13H2,(H,23,27)(H2,22,28,29)	WFNAQRYHERHQCN-UHFFFAOYSA-N	477.09407375							112699
MLS001239478	LSM-15357	BRD-K48321232	24892627	InChI=1S/C29H32N4O3S2/c1-21-9-14-26-27(19-21)37-29(30-26)33(17-6-16-31(2)3)28(34)23-10-12-25(13-11-23)38(35,36)32-18-15-22-7-4-5-8-24(22)20-32/h4-5,7-14,19H,6,15-18,20H2,1-3H3	AVOROEGEYAGDGQ-UHFFFAOYSA-N	CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N2CCc3ccccc3C2)c4nc5ccc(C)cc5s4	BroadT	BRD-K48321232	BRD-K48321232-003-08-8	Life Chemicals Inc.	F2019-0067		Cl	CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1)c1nc2ccc(C)cc2s1.Cl	InChI=1S/C29H32N4O3S2.ClH/c1-21-9-14-26-27(19-21)37-29(30-26)33(17-6-16-31(2)3)28(34)23-10-12-25(13-11-23)38(35,36)32-18-15-22-7-4-5-8-24(22)20-32;/h4-5,7-14,19H,6,15-18,20H2,1-3H3;1H	KCBOUHQOBPIIQM-UHFFFAOYSA-N	548.191582304							104003, 104003
F0656-0007	LSM-24110	SID7970433, BRD-K13769714	5310216	InChI=1S/C23H23N7O2/c31-20(28-13-11-27(12-14-28)19-9-5-2-6-10-19)16-29-17-24-22-21(23(29)32)25-26-30(22)15-18-7-3-1-4-8-18/h1-10,17H,11-16H2	YQSLURYHZBEEKS-UHFFFAOYSA-N	O=C(CN1C=Nc2c(nnn2Cc3ccccc3)C1=O)N4CCN(CC4)c5ccccc5	BroadT	BRD-K13769714	BRD-K13769714-001-05-6	Life Chemicals Inc.	F0656-0007			O=C(Cn1cnc2n(Cc3ccccc3)nnc2c1=O)N1CCN(CC1)c1ccccc1	InChI=1S/C23H23N7O2/c31-20(28-13-11-27(12-14-28)19-9-5-2-6-10-19)16-29-17-24-22-21(23(29)32)25-26-30(22)15-18-7-3-1-4-8-18/h1-10,17H,11-16H2	YQSLURYHZBEEKS-UHFFFAOYSA-N	429.191323046							112700
4-Ethyl-5-[2-(4-methylphenyl)quinolin-4-yl]-4H-1,2,4-triazole-3-thiol	LSM-24111	SID24831725, BRD-K53660761	2474291	InChI=1S/C20H18N4S/c1-3-24-19(22-23-20(24)25)16-12-18(14-10-8-13(2)9-11-14)21-17-7-5-4-6-15(16)17/h4-12H,3H2,1-2H3,(H,23,25)	DCJXKVOVXLZDTP-UHFFFAOYSA-N	CCn1c(S)nnc1c2cc(nc3ccccc23)c4ccc(C)cc4	BroadT	BRD-K53660761	BRD-K53660761-001-05-0	Enamine Ltd.	T5328410			CCn1c(S)nnc1-c1cc(nc2ccccc12)-c1ccc(C)cc1	InChI=1S/C20H18N4S/c1-3-24-19(22-23-20(24)25)16-12-18(14-10-8-13(2)9-11-14)21-17-7-5-4-6-15(16)17/h4-12H,3H2,1-2H3,(H,23,25)	DCJXKVOVXLZDTP-UHFFFAOYSA-N	346.125217306							112701
N-(4-Chloro-3-methyl-phenyl)-2-phenoxy-acetamide	LSM-24112	SID49644079, BRD-K53247518	838338	InChI=1S/C15H14ClNO2/c1-11-9-12(7-8-14(11)16)17-15(18)10-19-13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H,17,18)	SQPJBSLHMMVFBW-UHFFFAOYSA-N	Cc1cc(NC(=O)COc2ccccc2)ccc1Cl	BroadT	BRD-K53247518	BRD-K53247518-001-05-2	Asinex Ltd.	BAS 00164200			Cc1cc(NC(=O)COc2ccccc2)ccc1Cl	InChI=1S/C15H14ClNO2/c1-11-9-12(7-8-14(11)16)17-15(18)10-19-13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H,17,18)	SQPJBSLHMMVFBW-UHFFFAOYSA-N	275.071306408							112702
AC1MNLZO	LSM-24113	SID24788480, BRD-A90037676	3354871	InChI=1S/C16H23N3OS/c1-2-3-5-10-15(20)18-19-16-17-12-14(21-16)11-13-8-6-4-7-9-13/h4,6-9,14H,2-3,5,10-12H2,1H3,(H,17,19)(H,18,20)	UEYAQMAUEDKHPQ-UHFFFAOYSA-N	CCCCCC(=O)NNC1=NCC(Cc2ccccc2)S1	BroadT	BRD-A90037676	BRD-A90037676-001-05-2	Life Chemicals Inc.	F0762-0511			CCCCCC(=O)NNC1=NCC(Cc2ccccc2)S1	InChI=1S/C16H23N3OS/c1-2-3-5-10-15(20)18-19-16-17-12-14(21-16)11-13-8-6-4-7-9-13/h4,6-9,14H,2-3,5,10-12H2,1H3,(H,17,19)(H,18,20)	UEYAQMAUEDKHPQ-UHFFFAOYSA-N	305.156183076							112703
F0417-0480	LSM-24114	SID22400814, BRD-K41603412	4625223	InChI=1S/C23H25N5O5S3/c1-15-4-3-5-19(16(15)2)24-20(29)14-34-23-27-26-22(35-23)25-21(30)17-6-8-18(9-7-17)36(31,32)28-10-12-33-13-11-28/h3-9H,10-14H2,1-2H3,(H,24,29)(H,25,26,30)	RCNCYXSNBIHEOC-UHFFFAOYSA-N	Cc1cccc(NC(=O)CSc2nnc(NC(=O)c3ccc(cc3)S(=O)(=O)N4CCOCC4)s2)c1C	BroadT	BRD-K41603412	BRD-K41603412-001-03-3	Life Chemicals Inc.	F0417-0480			Cc1cccc(NC(=O)CSc2nnc(NC(=O)c3ccc(cc3)S(=O)(=O)N3CCOCC3)s2)c1C	InChI=1S/C23H25N5O5S3/c1-15-4-3-5-19(16(15)2)24-20(29)14-34-23-27-26-22(35-23)25-21(30)17-6-8-18(9-7-17)36(31,32)28-10-12-33-13-11-28/h3-9H,10-14H2,1-2H3,(H,24,29)(H,25,26,30)	RCNCYXSNBIHEOC-UHFFFAOYSA-N	547.10178102							112704
N,5-Bis(4-methoxyphenyl)-2-thiophenecarboxamide	LSM-24115	SID24824533, BRD-K23930887	1483381	InChI=1S/C19H17NO3S/c1-22-15-7-3-13(4-8-15)17-11-12-18(24-17)19(21)20-14-5-9-16(23-2)10-6-14/h3-12H,1-2H3,(H,20,21)	WEGBGFQXNMBMLL-UHFFFAOYSA-N	COc1ccc(NC(=O)c2ccc(s2)c3ccc(OC)cc3)cc1	BroadT	BRD-K23930887	BRD-K23930887-001-06-1	Key Organics Ltd.	7H-306S			COc1ccc(NC(=O)c2ccc(s2)-c2ccc(OC)cc2)cc1	InChI=1S/C19H17NO3S/c1-22-15-7-3-13(4-8-15)17-11-12-18(24-17)19(21)20-14-5-9-16(23-2)10-6-14/h3-12H,1-2H3,(H,20,21)	WEGBGFQXNMBMLL-UHFFFAOYSA-N	339.092914104							112705
MLS000682994	LSM-24116	SID24823565, BRD-K89517490	3875592	InChI=1S/C24H22BrFN4O4S/c1-2-28-13-17(23(33)34)21(31)16-11-18(26)20(12-19(16)28)29-7-9-30(10-8-29)24(35)27-22(32)14-3-5-15(25)6-4-14/h3-6,11-13H,2,7-10H2,1H3,(H,33,34)(H,27,32,35)	GSFVYQNRFITLTB-UHFFFAOYSA-N	CCN1C=C(C(=O)O)C(=O)c2cc(F)c(cc12)N3CCN(CC3)C(=S)NC(=O)c4ccc(Br)cc4	BroadT	BRD-K89517490	BRD-K89517490-001-05-8	ChemDiv Inc.	5182-2226			CCn1cc(C(O)=O)c(=O)c2cc(F)c(cc12)N1CCN(CC1)C(=S)NC(=O)c1ccc(Br)cc1	InChI=1S/C24H22BrFN4O4S/c1-2-28-13-17(23(33)34)21(31)16-11-18(26)20(12-19(16)28)29-7-9-30(10-8-29)24(35)27-22(32)14-3-5-15(25)6-4-14/h3-6,11-13H,2,7-10H2,1H3,(H,33,34)(H,27,32,35)	GSFVYQNRFITLTB-UHFFFAOYSA-N	560.052916714							112706
AC1MN8F5	LSM-24117	SID22407096, BRD-K37589964	3273794	InChI=1S/C19H12BrN3O/c20-13-7-5-12(6-8-13)19(24)21-14-9-10-17-18(11-14)23-16-4-2-1-3-15(16)22-17/h1-11H,(H,21,24)	UFWHQAPYEZNGQU-UHFFFAOYSA-N	Brc1ccc(cc1)C(=O)Nc2ccc3nc4ccccc4nc3c2	BroadT	BRD-K37589964	BRD-K37589964-001-06-5	Enamine Ltd.	T0500-6120			Brc1ccc(cc1)C(=O)Nc1ccc2nc3ccccc3nc2c1	InChI=1S/C19H12BrN3O/c20-13-7-5-12(6-8-13)19(24)21-14-9-10-17-18(11-14)23-16-4-2-1-3-15(16)22-17/h1-11H,(H,21,24)	UFWHQAPYEZNGQU-UHFFFAOYSA-N	377.016374634							112707
SMR000095779	LSM-24118	SID24838255, SID7965938, BRD-A94552094	5307921	InChI=1S/C23H25N3O4S/c1-2-30-20-12-4-3-11-19(20)25-23(27)18-10-7-15-26(16-18)31(28,29)21-13-5-8-17-9-6-14-24-22(17)21/h3-6,8-9,11-14,18H,2,7,10,15-16H2,1H3,(H,25,27)	FFQIPGOEJJARCC-UHFFFAOYSA-N	CCOc1ccccc1NC(=O)C2CCCN(C2)S(=O)(=O)c3cccc4cccnc34	BroadT	BRD-A94552094	BRD-A94552094-001-04-3	ChemDiv Inc.	C697-0785			CCOc1ccccc1NC(=O)C1CCCN(C1)S(=O)(=O)c1cccc2cccnc12	InChI=1S/C23H25N3O4S/c1-2-30-20-12-4-3-11-19(20)25-23(27)18-10-7-15-26(16-18)31(28,29)21-13-5-8-17-9-6-14-24-22(17)21/h3-6,8-9,11-14,18H,2,7,10,15-16H2,1H3,(H,25,27)	FFQIPGOEJJARCC-UHFFFAOYSA-N	439.156577							112708
ST51025861	LSM-24119	SID17408231, BRD-K17013498	1172870	InChI=1S/C24H25N3O3S/c1-3-29-21-16-20(27-24(31)25-18-13-9-6-10-14-18)22(30-4-2)15-19(21)26-23(28)17-11-7-5-8-12-17/h5-16H,3-4H2,1-2H3,(H,26,28)(H2,25,27,31)	WABWYBYEMDVSRE-UHFFFAOYSA-N	CCOc1cc(N=C(S)Nc2ccccc2)c(OCC)cc1NC(=O)c3ccccc3	BroadT	BRD-K17013498	BRD-K17013498-001-05-7	Asinex Ltd.	ASN 03271100			CCOc1cc(N=C(S)Nc2ccccc2)c(OCC)cc1NC(=O)c1ccccc1	InChI=1S/C24H25N3O3S/c1-3-29-21-16-20(27-24(31)25-18-13-9-6-10-14-18)22(30-4-2)15-19(21)26-23(28)17-11-7-5-8-12-17/h5-16H,3-4H2,1-2H3,(H,26,28)(H2,25,27,31)	WABWYBYEMDVSRE-UHFFFAOYSA-N	435.16166238							112709
3-(3,4-Dimethoxyphenyl)imidazo[1,5-a]pyridine	LSM-15555	BRD-K29994411	703215	InChI=1S/C15H14N2O2/c1-18-13-7-6-11(9-14(13)19-2)15-16-10-12-5-3-4-8-17(12)15/h3-10H,1-2H3	GIEOZVRKDSXXBP-UHFFFAOYSA-N	COc1ccc(cc1OC)c2ncc3ccccn23	BroadT	BRD-K29994411	BRD-K29994411-034-05-9	Asinex Ltd.	BAS 07529498		OC(=O)C(=O)O	COc1ccc(cc1OC)-c1ncc2ccccn12.OC(=O)C(=O)O	InChI=1S/C15H14N2O2.C2H2O4/c1-18-13-7-6-11(9-14(13)19-2)15-16-10-12-5-3-4-8-17(12)15;3-1(4)2(5)6/h3-10H,1-2H3;(H,3,4)(H,5,6)	WFPIMVIAEWNUKX-UHFFFAOYSA-N	254.105527708							104191, 104191
MLS000583915	LSM-24120	SID17510737, BRD-K52871910	4187953	InChI=1S/C18H22N2O4S/c1-4-24-17(21)12-20(11-16-13(2)8-9-25-16)18(22)19-14-6-5-7-15(10-14)23-3/h5-10H,4,11-12H2,1-3H3,(H,19,22)	GHYGOOADYJZDTK-UHFFFAOYSA-N	CCOC(=O)CN(Cc1sccc1C)C(=O)Nc2cccc(OC)c2	BroadT	BRD-K52871910	BRD-K52871910-001-05-4	ChemDiv Inc.	K783-3965			CCOC(=O)CN(Cc1sccc1C)C(=O)Nc1cccc(OC)c1	InChI=1S/C18H22N2O4S/c1-4-24-17(21)12-20(11-16-13(2)8-9-25-16)18(22)19-14-6-5-7-15(10-14)23-3/h5-10H,4,11-12H2,1-3H3,(H,19,22)	GHYGOOADYJZDTK-UHFFFAOYSA-N	362.130027894							112710
MLS000756927	LSM-24121	BRD-K78887888	5384874	InChI=1S/C14H9N3O3S/c18-16-14-13(9-4-3-5-10(8-9)17(19)20)15-11-6-1-2-7-12(11)21-14/h1-8,18H	DLGICIKRBTUOMV-UHFFFAOYSA-N	ON=C1Sc2ccccc2N=C1c3cccc(c3)[N+](=O)[O-]	BroadT	BRD-K78887888	BRD-K78887888-001-05-8	National Cancer Institute Chemotherapeutic Agents Repository	369070			ON=c1sc2ccccc2nc1-c1cccc(c1)[N+]([O-])=O	InChI=1S/C14H9N3O3S/c18-16-14-13(9-4-3-5-10(8-9)17(19)20)15-11-6-1-2-7-12(11)21-14/h1-8,18H	DLGICIKRBTUOMV-UHFFFAOYSA-N	299.036461868							
MLS000047398	LSM-24122	SID24271777, SID4247595, BRD-K58726840	3241786	InChI=1S/C20H22ClN3O3/c1-27-20(26)15-2-6-17(7-3-15)22-19(25)14-23-10-12-24(13-11-23)18-8-4-16(21)5-9-18/h2-9H,10-14H2,1H3,(H,22,25)	WLIODTVOCGVXFW-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=O)CN2CCN(CC2)c3ccc(Cl)cc3)cc1	BroadT	BRD-K58726840	BRD-K58726840-001-05-9	ChemDiv Inc.	K940-1157			COC(=O)c1ccc(NC(=O)CN2CCN(CC2)c2ccc(Cl)cc2)cc1	InChI=1S/C20H22ClN3O3/c1-27-20(26)15-2-6-17(7-3-15)22-19(25)14-23-10-12-24(13-11-23)18-8-4-16(21)5-9-18/h2-9H,10-14H2,1H3,(H,22,25)	WLIODTVOCGVXFW-UHFFFAOYSA-N	387.134969304							112712
3-(4-Methylphenyl)-1-[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium	LSM-15358	BRD-K84099045	1398290	InChI=1S/C27H24N3OS/c1-19-12-14-20(15-13-19)23-17-28(26-11-6-16-29(23)26)18-27(31)30-21-7-2-4-9-24(21)32-25-10-5-3-8-22(25)30/h2-5,7-10,12-15,17H,6,11,16,18H2,1H3/q+1	RPGOXHQIGQMAPM-UHFFFAOYSA-N	Cc1ccc(cc1)c2c[n+](CC(=O)N3c4ccccc4Sc5ccccc35)c6CCCn26	BroadT	BRD-K84099045	BRD-K84099045-003-06-6	InterBioScreen Ltd.	STOCK4S-48509		Cl	Cc1ccc(cc1)-c1c[n+](CC(=O)N2c3ccccc3Sc3ccccc23)c2CCCn12.Cl	InChI=1S/C27H24N3OS.ClH/c1-19-12-14-20(15-13-19)23-17-28(26-11-6-16-29(23)26)18-27(31)30-21-7-2-4-9-24(21)32-25-10-5-3-8-22(25)30;/h2-5,7-10,12-15,17H,6,11,16,18H2,1H3;1H/q+1;	GPDVBVOJPMIQMG-UHFFFAOYSA-N	438.164008108							104004, 104004
ST50882567	LSM-24123	SID24795152, BRD-K10324323	1261604	InChI=1S/C23H17N3O3/c1-14-5-7-18-16(10-14)17(12-20(26-18)19-4-2-3-9-24-19)23(27)25-15-6-8-21-22(11-15)29-13-28-21/h2-12H,13H2,1H3,(H,25,27)	SJBFKBQILMSIGJ-UHFFFAOYSA-N	Cc1ccc2nc(cc(C(=O)Nc3ccc4OCOc4c3)c2c1)c5ccccn5	BroadT	BRD-K10324323	BRD-K10324323-001-06-4	ChemBridge Corporation	7923623			Cc1ccc2nc(cc(C(=O)Nc3ccc4OCOc4c3)c2c1)-c1ccccn1	InChI=1S/C23H17N3O3/c1-14-5-7-18-16(10-14)17(12-20(26-18)19-4-2-3-9-24-19)23(27)25-15-6-8-21-22(11-15)29-13-28-21/h2-12H,13H2,1H3,(H,25,27)	SJBFKBQILMSIGJ-UHFFFAOYSA-N	383.126991434							112713
AC1NU9R7	LSM-24124	SID26658548, BRD-K02683081	5422324	InChI=1S/C17H17NO3/c1-10-15(19)11(9-18(2)3)8-14-12-6-4-5-7-13(12)17(20)21-16(10)14/h4-8,19H,9H2,1-3H3	MOGCSGUMZOTCPB-UHFFFAOYSA-N	CN(C)Cc1cc2c(OC(=O)c3ccccc23)c(C)c1O	BroadT	BRD-K02683081	BRD-K02683081-001-05-7	InterBioScreen Ltd.	STOCK4S-10793			CN(C)Cc1cc2c(oc(=O)c3ccccc23)c(C)c1O	InChI=1S/C17H17NO3/c1-10-15(19)11(9-18(2)3)8-14-12-6-4-5-7-13(12)17(20)21-16(10)14/h4-8,19H,9H2,1-3H3	MOGCSGUMZOTCPB-UHFFFAOYSA-N	283.120843414							112714
AK-968/41924636	LSM-24125	SID22412274, BRD-K88117586	843914	InChI=1S/C15H15N3S2/c1-9-6-4-5-7-13(9)18-14(16-17-15(18)19)12-8-20-11(3)10(12)2/h4-8H,1-3H3,(H,17,19)	INFUDCDYHPXJEN-UHFFFAOYSA-N	Cc1ccccc1n2c(S)nnc2c3csc(C)c3C	BroadT	BRD-K88117586	BRD-K88117586-001-05-3	Specs	AK-968/41924636			Cc1scc(c1C)-c1nnc(S)n1-c1ccccc1C	InChI=1S/C15H15N3S2/c1-9-6-4-5-7-13(9)18-14(16-17-15(18)19)12-8-20-11(3)10(12)2/h4-8H,1-3H3,(H,17,19)	INFUDCDYHPXJEN-UHFFFAOYSA-N	301.07073889							112715
2-[(2-Cyanophenyl)sulfinyl]-n-methylbenzenecarboxamide	LSM-24126	BRD-A32792984	3726662	InChI=1S/C15H12N2O2S/c1-17-15(18)12-7-3-5-9-14(12)20(19)13-8-4-2-6-11(13)10-16/h2-9H,1H3,(H,17,18)	UDBPAUXJOZLTKP-UHFFFAOYSA-N	CNC(=O)c1ccccc1S(=O)c2ccccc2C#N	BroadT	BRD-A32792984	BRD-A32792984-001-05-0	Key Organics Ltd.	2L-351S			CNC(=O)c1ccccc1S(=O)c1ccccc1C#N	InChI=1S/C15H12N2O2S/c1-17-15(18)12-7-3-5-9-14(12)20(19)13-8-4-2-6-11(13)10-16/h2-9H,1H3,(H,17,18)	UDBPAUXJOZLTKP-UHFFFAOYSA-N	284.061948334							112716
MLS000711692	LSM-24127	SID24801212, BRD-K19202848	761947	InChI=1S/C15H15N3/c1-10-4-6-13(7-5-10)14-9-15-16-11(2)8-12(3)18(15)17-14/h4-9H,1-3H3	UVVMCIKINUABHH-UHFFFAOYSA-N	Cc1ccc(cc1)c2cc3nc(C)cc(C)n3n2	BroadT	BRD-K19202848	BRD-K19202848-001-05-1	Asinex Ltd.	BAS 00393323			Cc1ccc(cc1)-c1cc2nc(C)cc(C)n2n1	InChI=1S/C15H15N3/c1-10-4-6-13(7-5-10)14-9-15-16-11(2)8-12(3)18(15)17-14/h4-9H,1-3H3	UVVMCIKINUABHH-UHFFFAOYSA-N	237.12659751							112717
SMR000023108	LSM-24128	SID26724928, SID4243470, BRD-K38205896	3238189	InChI=1S/C24H31N3O7/c1-3-32-23(31)27-12-10-26(11-13-27)22(30)16-33-18-4-5-21-19(14-18)20(29)15-24(34-21)6-8-25(9-7-24)17(2)28/h4-5,14H,3,6-13,15-16H2,1-2H3	ZYELQBWNTCMLJF-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)COc2ccc3OC4(CCN(CC4)C(=O)C)CC(=O)c3c2	BroadT	BRD-K38205896	BRD-K38205896-001-05-2	ChemDiv Inc.	C214-0598			CCOC(=O)N1CCN(CC1)C(=O)COc1ccc2OC3(CCN(CC3)C(C)=O)CC(=O)c2c1	InChI=1S/C24H31N3O7/c1-3-32-23(31)27-12-10-26(11-13-27)22(30)16-33-18-4-5-21-19(14-18)20(29)15-24(34-21)6-8-25(9-7-24)17(2)28/h4-5,14H,3,6-13,15-16H2,1-2H3	ZYELQBWNTCMLJF-UHFFFAOYSA-N	473.216200362							112718
MLS001005827	LSM-24129	SID24827983, BRD-K62776744	5680364	InChI=1S/C14H12N2O4/c1-2-20-14(19)9-7-11(17)16-10-6-4-3-5-8(10)13(18)15-12(9)16/h3-6H,2,7H2,1H3,(H,15,18)	GPSSHZBXZDTIGY-UHFFFAOYSA-N	CCOC(=O)C1=C2NC(=O)c3ccccc3N2C(=O)C1	BroadT	BRD-K62776744	BRD-K62776744-001-06-3	Enamine Ltd.	T0514-3275			CCOC(=O)C1=C2NC(=O)c3ccccc3N2C(=O)C1	InChI=1S/C14H12N2O4/c1-2-20-14(19)9-7-11(17)16-10-6-4-3-5-8(10)13(18)15-12(9)16/h3-6H,2,7H2,1H3,(H,15,18)	GPSSHZBXZDTIGY-UHFFFAOYSA-N	272.079706884							112719
MLS000762893	LSM-24130	SID26664257, BRD-K27496085	1838594	InChI=1S/C22H22ClN5/c1-22(2,3)19-12-20(25-13-17-6-4-5-11-24-17)28-21(27-19)18(14-26-28)15-7-9-16(23)10-8-15/h4-12,14,25H,13H2,1-3H3	SWXVTPFMCSJUME-UHFFFAOYSA-N	CC(C)(C)c1cc(NCc2ccccn2)n3ncc(c4ccc(Cl)cc4)c3n1	BroadT	BRD-K27496085	BRD-K27496085-001-06-9	InterBioScreen Ltd.	STOCK5S-34210			CC(C)(C)c1cc(NCc2ccccn2)n2ncc(-c3ccc(Cl)cc3)c2n1	InChI=1S/C22H22ClN5/c1-22(2,3)19-12-20(25-13-17-6-4-5-11-24-17)28-21(27-19)18(14-26-28)15-7-9-16(23)10-8-15/h4-12,14,25H,13H2,1-3H3	SWXVTPFMCSJUME-UHFFFAOYSA-N	391.156373464							112720
SMR000026324	LSM-24131	SID4248144, SID24838813, BRD-K89467820	3242258	InChI=1S/C22H26N4O5S2/c1-30-18-7-6-15(14-19(18)31-2)8-11-23-22(27)16-9-12-26(13-10-16)33(28,29)20-5-3-4-17-21(20)25-32-24-17/h3-7,14,16H,8-13H2,1-2H3,(H,23,27)	RILWIHZZVLHXNW-UHFFFAOYSA-N	COc1ccc(CCNC(=O)C2CCN(CC2)S(=O)(=O)c3cccc4nsnc34)cc1OC	BroadT	BRD-K89467820	BRD-K89467820-001-05-7	ChemDiv Inc.	C361-2352			COc1ccc(CCNC(=O)C2CCN(CC2)S(=O)(=O)c2cccc3nsnc23)cc1OC	InChI=1S/C22H26N4O5S2/c1-30-18-7-6-15(14-19(18)31-2)8-11-23-22(27)16-9-12-26(13-10-16)33(28,29)20-5-3-4-17-21(20)25-32-24-17/h3-7,14,16H,8-13H2,1-2H3,(H,23,27)	RILWIHZZVLHXNW-UHFFFAOYSA-N	490.134461352							112721
4-[3-(2-M-tolyl-ethyl)-thioureido]-benzoic acid methyl ester	LSM-24132	SID17407788, BRD-K52531428	858824	InChI=1S/C18H20N2O2S/c1-13-4-3-5-14(12-13)10-11-19-18(23)20-16-8-6-15(7-9-16)17(21)22-2/h3-9,12H,10-11H2,1-2H3,(H2,19,20,23)	FJPXNNYOMPXQFR-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=NCCc2cccc(C)c2)S)cc1	BroadT	BRD-K52531428	BRD-K52531428-001-05-9	Asinex Ltd.	ASN 04935809			COC(=O)c1ccc(NC(S)=NCCc2cccc(C)c2)cc1	InChI=1S/C18H20N2O2S/c1-13-4-3-5-14(12-13)10-11-19-18(23)20-16-8-6-15(7-9-16)17(21)22-2/h3-9,12H,10-11H2,1-2H3,(H2,19,20,23)	FJPXNNYOMPXQFR-UHFFFAOYSA-N	328.12454859							112722
ZINC01748812	LSM-24133	SID17431589, BRD-K28901743	1555494	InChI=1S/C24H21NO6/c1-15-13-22(27)31-20-14-16(10-11-17(15)20)30-21(26)9-3-2-6-12-25-23(28)18-7-4-5-8-19(18)24(25)29/h4-5,7-8,10-11,13-14H,2-3,6,9,12H2,1H3	PKHXZCADQSXUCF-UHFFFAOYSA-N	CC1=CC(=O)Oc2cc(OC(=O)CCCCCN3C(=O)c4ccccc4C3=O)ccc12	BroadT	BRD-K28901743	BRD-K28901743-001-05-3	Asinex Ltd.	BAS 00558059			Cc1cc(=O)oc2cc(OC(=O)CCCCCN3C(=O)c4ccccc4C3=O)ccc12	InChI=1S/C24H21NO6/c1-15-13-22(27)31-20-14-16(10-11-17(15)20)30-21(26)9-3-2-6-12-25-23(28)18-7-4-5-8-19(18)24(25)29/h4-5,7-8,10-11,13-14H,2-3,6,9,12H2,1H3	PKHXZCADQSXUCF-UHFFFAOYSA-N	419.136887402							112723
116324-89-1	LSM-24134	BRD-K60943112	6813982	InChI=1S/C16H17N3O4/c1-10-15(21)14(12(9-20)7-17-10)8-18-19-16(22)11-3-5-13(23-2)6-4-11/h3-8,20-21H,9H2,1-2H3,(H,19,22)	CLGBVQWRRPVQPL-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NN=Cc2c(O)c(C)ncc2CO	BroadT	BRD-K60943112	BRD-K60943112-001-06-5	ChemDiv Inc.	K087-0072			COc1ccc(cc1)C(=O)NN=Cc1c(CO)cnc(C)c1O	InChI=1S/C16H17N3O4/c1-10-15(21)14(12(9-20)7-17-10)8-18-19-16(22)11-3-5-13(23-2)6-4-11/h3-8,20-21H,9H2,1-2H3,(H,19,22)	CLGBVQWRRPVQPL-UHFFFAOYSA-N	315.121906054							
2-(4-Carboxy-butyrylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester	LSM-24135	SID24801292, BRD-K25156109	2927337	InChI=1S/C15H19NO5S/c1-2-21-15(20)13-9-5-3-6-10(9)22-14(13)16-11(17)7-4-8-12(18)19/h2-8H2,1H3,(H,16,17)(H,18,19)	NFCKGJWRKAJUIC-UHFFFAOYSA-N	CCOC(=O)c1c2CCCc2sc1NC(=O)CCCC(=O)O	BroadT	BRD-K25156109	BRD-K25156109-001-05-5	Asinex Ltd.	BAS 06105103			CCOC(=O)c1c(NC(=O)CCCC(O)=O)sc2CCCc12	InChI=1S/C15H19NO5S/c1-2-21-15(20)13-9-5-3-6-10(9)22-14(13)16-11(17)7-4-8-12(18)19/h2-8H2,1H3,(H,16,17)(H,18,19)	NFCKGJWRKAJUIC-UHFFFAOYSA-N	325.098393408							112725
N1-Phenyl-2-{[5-(1-hexynyl)-2-furyl]carbonyl}-1-hydrazinecarboxamide	LSM-24136	SID26730393, BRD-K93364770	600239	InChI=1S/C18H19N3O3/c1-2-3-4-8-11-15-12-13-16(24-15)17(22)20-21-18(23)19-14-9-6-5-7-10-14/h5-7,9-10,12-13H,2-4H2,1H3,(H,20,22)(H2,19,21,23)	VZMYQQFTTDQZAS-UHFFFAOYSA-N	CCCCC#Cc1oc(cc1)C(=O)NNC(=O)Nc2ccccc2	BroadT	BRD-K93364770	BRD-K93364770-001-05-0	Maybridge	KM 09530			CCCCC#Cc1ccc(o1)C(=O)NNC(=O)Nc1ccccc1	InChI=1S/C18H19N3O3/c1-2-3-4-8-11-15-12-13-16(24-15)17(22)20-21-18(23)19-14-9-6-5-7-10-14/h5-7,9-10,12-13H,2-4H2,1H3,(H,20,22)(H2,19,21,23)	VZMYQQFTTDQZAS-UHFFFAOYSA-N	325.142641498							112726
MLS000085454	LSM-24137	BRD-K97505583	1279932	InChI=1S/C10H10N2O2/c1-7-6-10(14)12(11-7)8-2-4-9(13)5-3-8/h2-6,13-14H,1H3	MNCHVPRJHLOQTH-UHFFFAOYSA-N	Cc1cc(O)n(n1)c2ccc(O)cc2	BroadT	BRD-K97505583	BRD-K97505583-001-06-9	ChemDiv Inc.	6220-7902			Cc1cc(O)n(n1)-c1ccc(O)cc1	InChI=1S/C10H10N2O2/c1-7-6-10(14)12(11-7)8-2-4-9(13)5-3-8/h2-6,13-14H,1H3	MNCHVPRJHLOQTH-UHFFFAOYSA-N	190.07422758							
MLS000672046	LSM-15359	BRD-K20428666	1287483	InChI=1S/C24H23N3/c1-19-12-14-21(15-13-19)24-22(17-25-16-20-8-4-2-5-9-20)18-27(26-24)23-10-6-3-7-11-23/h2-15,18,25H,16-17H2,1H3	YGWSMQFKFPYRRP-UHFFFAOYSA-N	Cc1ccc(cc1)c2nn(cc2CNCc3ccccc3)c4ccccc4	BroadT	BRD-K20428666	BRD-K20428666-003-06-2	ChemBridge Corporation	7723211		Cl	Cc1ccc(cc1)-c1nn(cc1CNCc1ccccc1)-c1ccccc1.Cl	InChI=1S/C24H23N3.ClH/c1-19-12-14-21(15-13-19)24-22(17-25-16-20-8-4-2-5-9-20)18-27(26-24)23-10-6-3-7-11-23;/h2-15,18,25H,16-17H2,1H3;1H	ACLHNNWVVBUDME-UHFFFAOYSA-N	353.189197766							104005, 104005
MLS000766751	LSM-24138	SID24824916, BRD-K60951729	741311	InChI=1S/C10H12O5/c11-3-6-1-7(4-12)9(14)10(15)8(2-6)5-13/h1-2,11-13H,3-5H2,(H,14,15)	QMVFVYSXZNMEBK-UHFFFAOYSA-N	OCC1=CC(=C(O)C(=O)C(=C1)CO)CO	BroadT	BRD-K60951729	BRD-K60951729-001-05-5	ChemDiv Inc.	4293-0001			OCc1cc(CO)c(O)c(=O)c(CO)c1	InChI=1S/C10H12O5/c11-3-6-1-7(4-12)9(14)10(15)8(2-6)5-13/h1-2,11-13H,3-5H2,(H,14,15)	QMVFVYSXZNMEBK-UHFFFAOYSA-N	212.068473484							112728
F1105-0370	LSM-24139	BRD-K97099341	4128025	InChI=1S/C17H16N2O4S2/c1-19-14-8-7-13(25(3,21)22)10-15(14)24-17(19)18-16(20)11-5-4-6-12(9-11)23-2/h4-10H,1-3H3	VKQILKSNTNAHMH-UHFFFAOYSA-N	COc1cccc(c1)C(=O)N=C2Sc3cc(ccc3N2C)S(=O)(=O)C	BroadT	BRD-K97099341	BRD-K97099341-001-06-6	ChemDiv Inc.	4553-0767			COc1cccc(c1)C(=O)N=c1sc2cc(ccc2n1C)S(C)(=O)=O	InChI=1S/C17H16N2O4S2/c1-19-14-8-7-13(25(3,21)22)10-15(14)24-17(19)18-16(20)11-5-4-6-12(9-11)23-2/h4-10H,1-3H3	VKQILKSNTNAHMH-UHFFFAOYSA-N	376.055148392							112729
UPCMLD00WMAL1-271	LSM-24140	SID24707921, BRD-A23173246	5461551	InChI=1S/C23H22Cl2N2O5/c1-14-20(22(30)32-13-15-6-3-2-4-7-15)21(17-10-9-16(24)12-18(17)25)26-23(31)27(14)11-5-8-19(28)29/h2-4,6-7,9-10,12,21H,5,8,11,13H2,1H3,(H,26,31)(H,28,29)	UHBVLBSCOSTTAV-UHFFFAOYSA-N	CC1=C(C(NC(=O)N1CCCC(=O)O)c2ccc(Cl)cc2Cl)C(=O)OCc3ccccc3	BroadT	BRD-A23173246	BRD-A23173246-001-05-8	University of Pittsburgh CMLD	UPCMLD00WMAL1-271			CC1=C(C(NC(=O)N1CCCC(O)=O)c1ccc(Cl)cc1Cl)C(=O)OCc1ccccc1	InChI=1S/C23H22Cl2N2O5/c1-14-20(22(30)32-13-15-6-3-2-4-7-15)21(17-10-9-16(24)12-18(17)25)26-23(31)27(14)11-5-8-19(28)29/h2-4,6-7,9-10,12,21H,5,8,11,13H2,1H3,(H,26,31)(H,28,29)	UHBVLBSCOSTTAV-UHFFFAOYSA-N	476.090577244							112730
ST070527	LSM-24141	SID87544491, SID14723684, BRD-K26813487	865615	InChI=1S/C14H11N3O2/c1-18-12-6-4-10(5-7-12)13-16-17-14(19-13)11-3-2-8-15-9-11/h2-9H,1H3	WMIQKYZPVJCIPR-UHFFFAOYSA-N	COc1ccc(cc1)c2oc(nn2)c3cccnc3	BroadT	BRD-K26813487	BRD-K26813487-001-05-2	Asinex Ltd.	ASN 02223491			COc1ccc(cc1)-c1nnc(o1)-c1cccnc1	InChI=1S/C14H11N3O2/c1-18-12-6-4-10(5-7-12)13-16-17-14(19-13)11-3-2-8-15-9-11/h2-9H,1H3	WMIQKYZPVJCIPR-UHFFFAOYSA-N	253.085126622							112731
MLS-0106036.0001	LSM-24142	SID56373695, SID17385651, BRD-K68936031	2359007	InChI=1S/C15H18ClN5O3S/c16-12-6-5-11(14(22)19-15-17-10-18-20-15)9-13(12)25(23,24)21-7-3-1-2-4-8-21/h5-6,9-10H,1-4,7-8H2,(H2,17,18,19,20,22)	VHYZTYARFPXAMM-UHFFFAOYSA-N	Clc1ccc(cc1S(=O)(=O)N2CCCCCC2)C(=O)Nc3nc[nH]n3	BroadT	BRD-K68936031	BRD-K68936031-001-05-1	Enamine Ltd.	T0509-3682			Clc1ccc(cc1S(=O)(=O)N1CCCCCC1)C(=O)Nc1nc[nH]n1	InChI=1S/C15H18ClN5O3S/c16-12-6-5-11(14(22)19-15-17-10-18-20-15)9-13(12)25(23,24)21-7-3-1-2-4-8-21/h5-6,9-10H,1-4,7-8H2,(H2,17,18,19,20,22)	VHYZTYARFPXAMM-UHFFFAOYSA-N	383.081887886							112732
SMR000026442	LSM-24143	SID4248243, BRD-K79189600	3242345	InChI=1S/C25H23N3O5/c1-30-19-4-3-17-11-18-12-23(33-24(18)26-20(17)13-19)25(29)28-8-6-27(7-9-28)14-16-2-5-21-22(10-16)32-15-31-21/h2-5,10-13H,6-9,14-15H2,1H3	XTOZKKUNDNLAQO-UHFFFAOYSA-N	COc1ccc2cc3cc(oc3nc2c1)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4	BroadT	BRD-K79189600	BRD-K79189600-001-05-5	ChemDiv Inc.	C369-0322			COc1ccc2cc3cc(oc3nc2c1)C(=O)N1CCN(Cc2ccc3OCOc3c2)CC1	InChI=1S/C25H23N3O5/c1-30-19-4-3-17-11-18-12-23(33-24(18)26-20(17)13-19)25(29)28-8-6-27(7-9-28)14-16-2-5-21-22(10-16)32-15-31-21/h2-5,10-13H,6-9,14-15H2,1H3	XTOZKKUNDNLAQO-UHFFFAOYSA-N	445.163770866							112733
AC1LGZCF	LSM-24144	BRD-K36118155	829559	InChI=1S/C20H23N3O2/c1-16-2-4-18(5-3-16)15-22-10-12-23(13-11-22)21-14-17-6-8-19(9-7-17)20(24)25/h2-9,14H,10-13,15H2,1H3,(H,24,25)	CXDBXMSOGOSCJY-UHFFFAOYSA-N	Cc1ccc(CN2CCN(CC2)N=Cc3ccc(cc3)C(=O)O)cc1	BroadT	BRD-K36118155	BRD-K36118155-001-05-5	Asinex Ltd.	BAS 01809698			Cc1ccc(CN2CCN(CC2)N=Cc2ccc(cc2)C(O)=O)cc1	InChI=1S/C20H23N3O2/c1-16-2-4-18(5-3-16)15-22-10-12-23(13-11-22)21-14-17-6-8-19(9-7-17)20(24)25/h2-9,14H,10-13,15H2,1H3,(H,24,25)	CXDBXMSOGOSCJY-UHFFFAOYSA-N	337.179027006							112734
MLS000775623	LSM-24145	SID24833649, BRD-K10146059	5134691	InChI=1S/C16H16ClN3O3/c17-12-5-6-13(15(11-12)20(22)23)18-7-9-19(10-8-18)14-3-1-2-4-16(14)21/h1-6,11,21H,7-10H2	QSFBNMBEIQKORM-UHFFFAOYSA-N	Oc1ccccc1N2CCN(CC2)c3ccc(Cl)cc3[N+](=O)[O-]	BroadT	BRD-K10146059	BRD-K10146059-001-05-3	Enamine Ltd.	T0516-7321			Oc1ccccc1N1CCN(CC1)c1ccc(Cl)cc1[N+]([O-])=O	InChI=1S/C16H16ClN3O3/c17-12-5-6-13(15(11-12)20(22)23)18-7-9-19(10-8-18)14-3-1-2-4-16(14)21/h1-6,11,21H,7-10H2	QSFBNMBEIQKORM-UHFFFAOYSA-N	333.088019112							112735
MLS-0271670.0001	LSM-24146	SID56373793, SID24791570, BRD-K01475509	4880047	InChI=1S/C17H12ClN5OS/c18-14-7-3-12(4-8-14)10-25-17-21-16(22-23-17)20-15(24)13-5-1-11(9-19)2-6-13/h1-8H,10H2,(H2,20,21,22,23,24)	XENLBTASNXDTDF-UHFFFAOYSA-N	Clc1ccc(CSc2n[nH]c(NC(=O)c3ccc(cc3)C#N)n2)cc1	BroadT	BRD-K01475509	BRD-K01475509-001-06-1	Enamine Ltd.	T5317884			Clc1ccc(CSc2n[nH]c(NC(=O)c3ccc(cc3)C#N)n2)cc1	InChI=1S/C17H12ClN5OS/c18-14-7-3-12(4-8-14)10-25-17-21-16(22-23-17)20-15(24)13-5-1-11(9-19)2-6-13/h1-8H,10H2,(H2,20,21,22,23,24)	XENLBTASNXDTDF-UHFFFAOYSA-N	369.045108454							112736
AC1LEEJB	LSM-4830	BRD-K39687892, SID103023247, SID17512875	710962	InChI=1S/C19H13FN4/c20-14-4-3-5-15(12-14)22-19-16-6-1-2-7-17(16)23-18(24-19)13-8-10-21-11-9-13/h1-12H,(H,22,23,24)	WEUMWAVTQBJRNN-UHFFFAOYSA-N	Fc1cccc(Nc2nc(nc3ccccc23)c4ccncc4)c1	BroadT	BRD-K39687892	BRD-K39687892-001-08-8	InterBioScreen Ltd.	STOCK2S-40009			Fc1cccc(Nc2nc(nc3ccccc23)-c2ccncc2)c1	InChI=1S/C19H13FN4/c20-14-4-3-5-15(12-14)22-19-16-6-1-2-7-17(16)23-18(24-19)13-8-10-21-11-9-13/h1-12H,(H,22,23,24)	WEUMWAVTQBJRNN-UHFFFAOYSA-N	316.112424656							94208
SMR000154968	LSM-24147	SID16952813, BRD-K32732553	2306986	InChI=1S/C13H9BrN2O2S2/c1-18-7-3-2-4-8-11(7)15-13(20-8)16-12(17)9-5-6-10(14)19-9/h2-6H,1H3,(H,15,16,17)	WZOVEIOCKHJDIW-UHFFFAOYSA-N	COc1cccc2sc(NC(=O)c3ccc(Br)s3)nc12	BroadT	BRD-K32732553	BRD-K32732553-001-05-5	Enamine Ltd.	T0501-9654			COc1cccc2sc(NC(=O)c3ccc(Br)s3)nc12	InChI=1S/C13H9BrN2O2S2/c1-18-7-3-2-4-8-11(7)15-13(20-8)16-12(17)9-5-6-10(14)19-9/h2-6H,1H3,(H,15,16,17)	WZOVEIOCKHJDIW-UHFFFAOYSA-N	367.928881528							112737
BAS 03135098	LSM-24148	SID49645074, BRD-K16508644	1150217	InChI=1S/C22H22ClNO5/c1-29-18-9-8-12(10-13(18)23)20-21-14(4-2-6-16(21)25)24(11-19(27)28)15-5-3-7-17(26)22(15)20/h8-10,20H,2-7,11H2,1H3,(H,27,28)	HFNNLFWKEJULIK-UHFFFAOYSA-N	COc1ccc(cc1Cl)C2C3=C(CCCC3=O)N(CC(=O)O)C4=C2C(=O)CCC4	BroadT	BRD-K16508644	BRD-K16508644-001-06-8	Asinex Ltd.	BAS 03135098			COc1ccc(cc1Cl)C1C2=C(CCCC2=O)N(CC(O)=O)C2=C1C(=O)CCC2	InChI=1S/C22H22ClNO5/c1-29-18-9-8-12(10-13(18)23)20-21-14(4-2-6-16(21)25)24(11-19(27)28)15-5-3-7-17(26)22(15)20/h8-10,20H,2-7,11H2,1H3,(H,27,28)	HFNNLFWKEJULIK-UHFFFAOYSA-N	415.118650524							112738
F0660-2061	LSM-24149	SID7970519, BRD-A37872319	4754223	InChI=1S/C21H23N3O/c1-4-23-19-8-6-5-7-18(19)22-21(23)16-12-20(25)24(13-16)17-10-14(2)9-15(3)11-17/h5-11,16H,4,12-13H2,1-3H3	UGAKFONVINDLDV-UHFFFAOYSA-N	CCn1c(nc2ccccc12)C3CN(C(=O)C3)c4cc(C)cc(C)c4	BroadT	BRD-A37872319	BRD-A37872319-001-05-1	Life Chemicals Inc.	F0660-2061			CCn1c(nc2ccccc12)C1CN(C(=O)C1)c1cc(C)cc(C)c1	InChI=1S/C21H23N3O/c1-4-23-19-8-6-5-7-18(19)22-21(23)16-12-20(25)24(13-16)17-10-14(2)9-15(3)11-17/h5-11,16H,4,12-13H2,1-3H3	UGAKFONVINDLDV-UHFFFAOYSA-N	333.184112386							112739
MLS000567535	LSM-24150	SID17403339, BRD-K29515366	3138347	InChI=1S/C13H16N4O4S/c1-2-3-7-11(18)15-16-13(22)14-12(19)9-5-4-6-10(8-9)17(20)21/h4-6,8H,2-3,7H2,1H3,(H,15,18)(H2,14,16,19,22)	FAJDETCVQBTNNR-UHFFFAOYSA-N	CCCCC(=O)NNC(=S)NC(=O)c1cccc(c1)[N+](=O)[O-]	BroadT	BRD-K29515366	BRD-K29515366-001-05-6	Asinex Ltd.	BAS 02136415			CCCCC(=O)NNC(=S)NC(=O)c1cccc(c1)[N+]([O-])=O	InChI=1S/C13H16N4O4S/c1-2-3-7-11(18)15-16-13(22)14-12(19)9-5-4-6-10(8-9)17(20)21/h4-6,8H,2-3,7H2,1H3,(H,15,18)(H2,14,16,19,22)	FAJDETCVQBTNNR-UHFFFAOYSA-N	324.089225722							112740
MLS000098299	LSM-24151	SID3714238, BRD-A19701734	2998718	InChI=1S/C18H17N3O3S2/c1-25-18-20-14-5-4-12(8-15(14)26-18)19-17(23)11-7-16(22)21(9-11)10-13-3-2-6-24-13/h2-6,8,11H,7,9-10H2,1H3,(H,19,23)	NMEKSKJYUMLFBG-UHFFFAOYSA-N	CSc1nc2ccc(NC(=O)C3CN(Cc4occc4)C(=O)C3)cc2s1	BroadT	BRD-A19701734	BRD-A19701734-001-05-1	Enamine Ltd.	T5246831			CSc1nc2ccc(NC(=O)C3CN(Cc4ccco4)C(=O)C3)cc2s1	InChI=1S/C18H17N3O3S2/c1-25-18-20-14-5-4-12(8-15(14)26-18)19-17(23)11-7-16(22)21(9-11)10-13-3-2-6-24-13/h2-6,8,11H,7,9-10H2,1H3,(H,19,23)	NMEKSKJYUMLFBG-UHFFFAOYSA-N	387.071132814							112741
SMR000014788	LSM-24152	SID843979, BRD-K75832601	646285	InChI=1S/C22H25N5O/c23-15-18-16-5-1-2-6-17(16)21(24-9-10-26-11-13-28-14-12-26)27-20-8-4-3-7-19(20)25-22(18)27/h3-4,7-8,24H,1-2,5-6,9-14H2	JBUXEBPUQKICEF-UHFFFAOYSA-N	N#Cc1c2CCCCc2c(NCCN3CCOCC3)n4c5ccccc5nc14	BroadT	BRD-K75832601	BRD-K75832601-001-05-3	Asinex Ltd.	BAS 08139007			N#Cc1c2CCCCc2c(NCCN2CCOCC2)n2c3ccccc3nc12	InChI=1S/C22H25N5O/c23-15-18-16-5-1-2-6-17(16)21(24-9-10-26-11-13-28-14-12-26)27-20-8-4-3-7-19(20)25-22(18)27/h3-4,7-8,24H,1-2,5-6,9-14H2	JBUXEBPUQKICEF-UHFFFAOYSA-N	375.20591047							112742
MLS000730302	LSM-24153	SID24785461, BRD-A20185529	15996185	InChI=1S/C25H36N4O2/c1-6-19(5)26-24(30)9-10-25(31)27-20-7-8-22-21(13-20)18(4)12-23(28-22)29-14-16(2)11-17(3)15-29/h7-8,12-13,16-17,19H,6,9-11,14-15H2,1-5H3,(H,26,30)(H,27,31)	YSXMEJABVQDFFB-UHFFFAOYSA-N	CCC(C)NC(=O)CCC(=O)Nc1ccc2nc(cc(C)c2c1)N3CC(C)CC(C)C3	BroadT	BRD-A20185529	BRD-A20185529-001-05-3	ChemDiv Inc.	C237-0207			CCC(C)NC(=O)CCC(=O)Nc1ccc2nc(cc(C)c2c1)N1CC(C)CC(C)C1	InChI=1S/C25H36N4O2/c1-6-19(5)26-24(30)9-10-25(31)27-20-7-8-22-21(13-20)18(4)12-23(28-22)29-14-16(2)11-17(3)15-29/h7-8,12-13,16-17,19H,6,9-11,14-15H2,1-5H3,(H,26,30)(H,27,31)	YSXMEJABVQDFFB-UHFFFAOYSA-N	424.283826432							112743
MLS000715840	LSM-24154	SID24787008, BRD-A68429445	3154268	InChI=1S/C16H18N2O4S2/c1-21-14-7-6-11(9-15(14)22-2)12-10-13(16-5-4-8-23-16)18(17-12)24(3,19)20/h4-9,13H,10H2,1-3H3	AYJHACKOWMKGLK-UHFFFAOYSA-N	COc1ccc(cc1OC)C2=NN(C(C2)c3cccs3)S(=O)(=O)C	BroadT	BRD-A68429445	BRD-A68429445-001-06-7	Asinex Ltd.	BAS 06591433			COc1ccc(cc1OC)C1=NN(C(C1)c1cccs1)S(C)(=O)=O	InChI=1S/C16H18N2O4S2/c1-21-14-7-6-11(9-15(14)22-2)12-10-13(16-5-4-8-23-16)18(17-12)24(3,19)20/h4-9,13H,10H2,1-3H3	AYJHACKOWMKGLK-UHFFFAOYSA-N	366.070798456							112744
TCMDC-125625	LSM-24155	MMV666105, TCMDC-125625, BRD-A09252483	3210926	InChI=1S/C28H34N2O4S/c1-20(2)22-9-11-23(12-10-22)27(28(32)29-19-21-7-13-24(34-4)14-8-21)30(15-16-33-3)26(31)18-25-6-5-17-35-25/h5-14,17,20,27H,15-16,18-19H2,1-4H3,(H,29,32)	YGUJXWRSBKIISC-UHFFFAOYSA-N	COCCN(C(C(=O)NCc1ccc(OC)cc1)c2ccc(cc2)C(C)C)C(=O)Cc3cccs3	BroadT	BRD-A09252483	BRD-A09252483-001-05-0	Asinex Ltd.	ASN 05580082			COCCN(C(C(=O)NCc1ccc(OC)cc1)c1ccc(cc1)C(C)C)C(=O)Cc1cccs1	InChI=1S/C28H34N2O4S/c1-20(2)22-9-11-23(12-10-22)27(28(32)29-19-21-7-13-24(34-4)14-8-21)30(15-16-33-3)26(31)18-25-6-5-17-35-25/h5-14,17,20,27H,15-16,18-19H2,1-4H3,(H,29,32)	YGUJXWRSBKIISC-UHFFFAOYSA-N	494.223928278							112745
STK568230	LSM-44025	SID17513254, BRD-K47550819	938079	InChI=1S/C18H23N3O2S/c1-11-9-13(12(2)21(11)14-7-5-4-6-8-14)10-15-16(22)19-18(24)20(3)17(15)23/h9-10,14H,4-8H2,1-3H3,(H,19,22,24)/b15-10+	YBBPQSODVBZFET-XNTDXEJSSA-N	CN1C(=S)NC(=O)\C(=C/c2cc(C)n(C3CCCCC3)c2C)\C1=O	BroadT	BRD-K47550819	BRD-K47550819-001-05-4	InterBioScreen Ltd.	STOCK4S-28143			CN1C(=S)NC(=O)\C(=C/c2cc(C)n(C3CCCCC3)c2C)C1=O	InChI=1S/C18H23N3O2S/c1-11-9-13(12(2)21(11)14-7-5-4-6-8-14)10-15-16(22)19-18(24)20(3)17(15)23/h9-10,14H,4-8H2,1-3H3,(H,19,22,24)/b15-10+	YBBPQSODVBZFET-XNTDXEJSSA-N	345.151097696							
CID 25813842	LSM-24157	BRD-A02302336	25813842	InChI=1S/C14H14N2O4/c1-8-4-3-5-10(13(8)18)14(19)20-7-12(17)11(6-15)9(2)16/h3-5,11,16,18H,7H2,1-2H3	UKUMTRNTAMVXJX-UHFFFAOYSA-N	CC(=N)C(C#N)C(=O)COC(=O)c1cccc(C)c1O	BroadT	BRD-A02302336	BRD-A02302336-001-05-9	Enamine Ltd.	T5228533			CC(=N)C(C#N)C(=O)COC(=O)c1cccc(C)c1O	InChI=1S/C14H14N2O4/c1-8-4-3-5-10(13(8)18)14(19)20-7-12(17)11(6-15)9(2)16/h3-5,11,16,18H,7H2,1-2H3	UKUMTRNTAMVXJX-UHFFFAOYSA-N	274.095356948							112747
STK252741	LSM-24158	SID17412540, BRD-K88942836	1217718	InChI=1S/C22H14ClNO4/c23-15-11-9-14(10-12-15)19(25)13-28-20-8-4-3-7-18(20)24-21(26)16-5-1-2-6-17(16)22(24)27/h1-12H,13H2	UPRRHVQGUIXWEW-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)COc2ccccc2N3C(=O)c4ccccc4C3=O	BroadT	BRD-K88942836	BRD-K88942836-001-05-2	ChemBridge Corporation	6937696			Clc1ccc(cc1)C(=O)COc1ccccc1N1C(=O)c2ccccc2C1=O	InChI=1S/C22H14ClNO4/c23-15-11-9-14(10-12-15)19(25)13-28-20-8-4-3-7-18(20)24-21(26)16-5-1-2-6-17(16)22(24)27/h1-12H,13H2	UPRRHVQGUIXWEW-UHFFFAOYSA-N	391.061135648							112748
N-Butyl-n-[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]acetamide	LSM-24159	SID26659316, BRD-A68434635	3757709	InChI=1S/C19H26N2O4/c1-4-6-11-20(14(3)22)17-13-18(23)21(19(17)24)15-7-9-16(10-8-15)25-12-5-2/h7-10,17H,4-6,11-13H2,1-3H3	ODPAZIIQONOQMX-UHFFFAOYSA-N	CCCCN(C1CC(=O)N(C1=O)c2ccc(OCCC)cc2)C(=O)C	BroadT	BRD-A68434635	BRD-A68434635-001-05-9	InterBioScreen Ltd.	STOCK2S-93116			CCCCN(C1CC(=O)N(C1=O)c1ccc(OCCC)cc1)C(C)=O	InChI=1S/C19H26N2O4/c1-4-6-11-20(14(3)22)17-13-18(23)21(19(17)24)15-7-9-16(10-8-15)25-12-5-2/h7-10,17H,4-6,11-13H2,1-3H3	ODPAZIIQONOQMX-UHFFFAOYSA-N	346.189257332							112749
AC1LT6WR	LSM-44026	BRD-K09579906	1552499	InChI=1S/C14H16N4O/c1-11-16-17-12(2)18(11)15-10-6-8-13-7-4-5-9-14(13)19-3/h4-10H,1-3H3/b8-6+,15-10?	LXQFYNXTJMCJFF-RMHCUIICSA-N	COc1ccccc1\C=C\C=Nn2c(C)nnc2C	BroadT	BRD-K09579906	BRD-K09579906-001-05-3	Asinex Ltd.	BAS 00921730			COc1ccccc1\C=C\C=Nn1c(C)nnc1C	InChI=1S/C14H16N4O/c1-11-16-17-12(2)18(11)15-10-6-8-13-7-4-5-9-14(13)19-3/h4-10H,1-3H3/b8-6+,15-10?	LXQFYNXTJMCJFF-RMHCUIICSA-N	256.132411172							
SMR000173191	LSM-24161	SID17504742, BRD-A39243583	3212431	InChI=1S/C21H20FN3OS/c1-14-11-16-5-3-4-6-18(16)25(14)20(26)13-27-21-23-12-19(24(21)2)15-7-9-17(22)10-8-15/h3-10,12,14H,11,13H2,1-2H3	SCAWTQXZQYFPQG-UHFFFAOYSA-N	CC1Cc2ccccc2N1C(=O)CSc3ncc(c4ccc(F)cc4)n3C	BroadT	BRD-A39243583	BRD-A39243583-001-05-2	Asinex Ltd.	ASN 05627688			CC1Cc2ccccc2N1C(=O)CSc1ncc(-c2ccc(F)cc2)n1C	InChI=1S/C21H20FN3OS/c1-14-11-16-5-3-4-6-18(16)25(14)20(26)13-27-21-23-12-19(24(21)2)15-7-9-17(22)10-8-15/h3-10,12,14H,11,13H2,1-2H3	SCAWTQXZQYFPQG-UHFFFAOYSA-N	381.13111118							112751
MLS000522778	LSM-24162	SID14738117, BRD-K17466510	9551280	InChI=1S/C26H28N4O/c1-17-10-12-22(13-11-17)30-26-25(20(4)29-30)18(2)23(19(3)28-26)14-15-24(31)27-16-21-8-6-5-7-9-21/h5-13H,14-16H2,1-4H3,(H,27,31)	SMHMPWZUUFMKOJ-UHFFFAOYSA-N	Cc1ccc(cc1)n2nc(C)c3c(C)c(CCC(=O)NCc4ccccc4)c(C)nc23	BroadT	BRD-K17466510	BRD-K17466510-001-04-4	ChemDiv Inc.	C987-0023			Cc1nn(-c2ccc(C)cc2)c2nc(C)c(CCC(=O)NCc3ccccc3)c(C)c12	InChI=1S/C26H28N4O/c1-17-10-12-22(13-11-17)30-26-25(20(4)29-30)18(2)23(19(3)28-26)14-15-24(31)27-16-21-8-6-5-7-9-21/h5-13H,14-16H2,1-4H3,(H,27,31)	SMHMPWZUUFMKOJ-UHFFFAOYSA-N	412.226311556							112752
MLS000054999	LSM-24163	SID3713724, BRD-A23658885	2998527	InChI=1S/C17H18N2O7/c1-9-7-19(17(24)18-14(9)22)15-13(21)12(20)11(26-15)8-25-16(23)10-5-3-2-4-6-10/h2-7,11-13,15,20-21H,8H2,1H3,(H,18,22,24)	MBXHULDEJNNQLN-UHFFFAOYSA-N	CC1=CN(C2OC(COC(=O)c3ccccc3)C(O)C2O)C(=O)NC1=O	BroadT	BRD-A23658885	BRD-A23658885-001-06-2	Enamine Ltd.	T0503-5790			Cc1cn(C2OC(COC(=O)c3ccccc3)C(O)C2O)c(=O)[nH]c1=O	InChI=1S/C17H18N2O7/c1-9-7-19(17(24)18-14(9)22)15-13(21)12(20)11(26-15)8-25-16(23)10-5-3-2-4-6-10/h2-7,11-13,15,20-21H,8H2,1H3,(H,18,22,24)	MBXHULDEJNNQLN-UHFFFAOYSA-N	362.111400936							112753
BDBM49343	LSM-24164	BRD-K25642624	91896794	InChI=1S/C15H14N2O2/c1-11(17-13-4-2-3-5-14(13)18)10-15(19)12-6-8-16-9-7-12/h2-9,18H,10H2,1H3	LONYDIZSYDJLFQ-UHFFFAOYSA-N	CC(=Nc1ccccc1O)CC(=O)c2ccncc2	BroadT	BRD-K25642624	BRD-K25642624-001-05-0	ChemBridge Corporation	6039465			CC(CC(=O)c1ccncc1)=Nc1ccccc1O	InChI=1S/C15H14N2O2/c1-11(17-13-4-2-3-5-14(13)18)10-15(19)12-6-8-16-9-7-12/h2-9,18H,10H2,1H3	LONYDIZSYDJLFQ-UHFFFAOYSA-N	254.105527708							112754
MLS000724314	LSM-44027	SID24810911, BRD-A78052791	6019211	InChI=1S/C8H9Cl3N2O3/c1-2-4-3-16-8(12-4)6(13(14)15)5(9)7(10)11/h4,12H,2-3H2,1H3/b8-6+	XKDCHFULABXDBT-SOFGYWHQSA-N	CCC1CO\C(=C(/C(=C(Cl)Cl)Cl)\[N+](=O)[O-])\N1	BroadT	BRD-A78052791	BRD-A78052791-001-05-7	ChemDiv Inc.	4872-0300			CCC1CO\C(N1)=C(/C(Cl)=C(Cl)Cl)[N+]([O-])=O	InChI=1S/C8H9Cl3N2O3/c1-2-4-3-16-8(12-4)6(13(14)15)5(9)7(10)11/h4,12H,2-3H2,1H3/b8-6+	XKDCHFULABXDBT-SOFGYWHQSA-N	285.967875298							
MLS000580695	LSM-24166	SID17509344, BRD-K03065379	6621186	InChI=1S/C17H13N3O/c1-2-7-13(8-3-1)18-17-16(14-9-6-12-21-14)19-15-10-4-5-11-20(15)17/h1-12,18H	SLWCTSPVYONLNO-UHFFFAOYSA-N	N(c1ccccc1)c2c(nc3ccccn23)c4occc4	BroadT	BRD-K03065379	BRD-K03065379-001-08-1	ChemDiv Inc.	C177-0111			N(c1c(nc2ccccn12)-c1ccco1)c1ccccc1	InChI=1S/C17H13N3O/c1-2-7-13(8-3-1)18-17-16(14-9-6-12-21-14)19-15-10-4-5-11-20(15)17/h1-12,18H	SLWCTSPVYONLNO-UHFFFAOYSA-N	275.105862066							112756
AC1MJWPU	LSM-24167	SID7977280, BRD-K68253392	3144344	InChI=1S/C16H17N3O2S2/c1-9-15(23-10(2)17-9)13-8-22-16(19-13)18-12-7-11(20-3)5-6-14(12)21-4/h5-8H,1-4H3,(H,18,19)	UZPBLLFTUZJQMD-UHFFFAOYSA-N	COc1ccc(OC)c(Nc2nc(cs2)c3sc(C)nc3C)c1	BroadT	BRD-K68253392	BRD-K68253392-001-05-4	ChemBridge Corporation	6503641			COc1ccc(OC)c(Nc2nc(cs2)-c2sc(C)nc2C)c1	InChI=1S/C16H17N3O2S2/c1-9-15(23-10(2)17-9)13-8-22-16(19-13)18-12-7-11(20-3)5-6-14(12)21-4/h5-8H,1-4H3,(H,18,19)	UZPBLLFTUZJQMD-UHFFFAOYSA-N	347.076218194							112757
ZINC00815361	LSM-24168	SID7966633, BRD-K99447049	1094029	InChI=1S/C19H15F2N5O2/c1-10-3-5-12(6-4-10)14-8-15(17(20)21)26-18(23-14)13(9-22-26)19(27)24-16-7-11(2)28-25-16/h3-9,17H,1-2H3,(H,24,25,27)	OGKNMSDIMTWQFP-UHFFFAOYSA-N	Cc1onc(NC(=O)c2cnn3c(cc(nc23)c4ccc(C)cc4)C(F)F)c1	BroadT	BRD-K99447049	BRD-K99447049-001-04-5	ChemDiv Inc.	6466-1682			Cc1cc(NC(=O)c2cnn3c(cc(nc23)-c2ccc(C)cc2)C(F)F)no1	InChI=1S/C19H15F2N5O2/c1-10-3-5-12(6-4-10)14-8-15(17(20)21)26-18(23-14)13(9-22-26)19(27)24-16-7-11(2)28-25-16/h3-9,17H,1-2H3,(H,24,25,27)	OGKNMSDIMTWQFP-UHFFFAOYSA-N	383.11938117							112758
AC1NE01V	LSM-24169	BRD-K00484742	4609645	InChI=1S/C23H27N5O3S2/c1-27-16-17(15-24-26-23(32)25-20-8-4-5-9-22(20)31-2)19-14-18(10-11-21(19)27)33(29,30)28-12-6-3-7-13-28/h4-5,8-11,14-16H,3,6-7,12-13H2,1-2H3,(H2,25,26,32)	CIFDXSAYRDRSGU-UHFFFAOYSA-N	COc1ccccc1N=C(S)NN=Cc2cn(C)c3ccc(cc23)S(=O)(=O)N4CCCCC4	BroadT	BRD-K00484742	BRD-K00484742-001-05-3	ChemDiv Inc.	C348-0329			COc1ccccc1N=C(S)NN=Cc1cn(C)c2ccc(cc12)S(=O)(=O)N1CCCCC1	InChI=1S/C23H27N5O3S2/c1-27-16-17(15-24-26-23(32)25-20-8-4-5-9-22(20)31-2)19-14-18(10-11-21(19)27)33(29,30)28-12-6-3-7-13-28/h4-5,8-11,14-16H,3,6-7,12-13H2,1-2H3,(H2,25,26,32)	CIFDXSAYRDRSGU-UHFFFAOYSA-N	485.155531154							112759
AC1LENZO	LSM-24170	BRD-K39503257	689372	InChI=1S/C18H21N3O2/c1-14-5-4-6-17(11-14)23-13-18(22)20-19-12-15-7-9-16(10-8-15)21(2)3/h4-12H,13H2,1-3H3,(H,20,22)	PFVRSUIRLIOBGD-UHFFFAOYSA-N	CN(C)c1ccc(C=NNC(=O)COc2cccc(C)c2)cc1	BroadT	BRD-K39503257	BRD-K39503257-001-05-2	Asinex Ltd.	BAS 00209853			CN(C)c1ccc(C=NNC(=O)COc2cccc(C)c2)cc1	InChI=1S/C18H21N3O2/c1-14-5-4-6-17(11-14)23-13-18(22)20-19-12-15-7-9-16(10-8-15)21(2)3/h4-12H,13H2,1-3H3,(H,20,22)	PFVRSUIRLIOBGD-UHFFFAOYSA-N	311.163376942							112760
BAS 02788895	LSM-24171	SID24801931, BRD-K31528665	817048	InChI=1S/C16H18N2O4S/c1-8(2)22-13-5-4-10(9(3)19)6-11(13)7-12-14(20)17-16(23)18-15(12)21/h4-6,8H,7H2,1-3H3,(H3,17,18,20,21,23)	DCIDOXBJPJVTFZ-UHFFFAOYSA-N	CC(C)Oc1ccc(cc1Cc2c(O)nc(S)nc2O)C(=O)C	BroadT	BRD-K31528665	BRD-K31528665-001-05-3	Asinex Ltd.	BAS 02788895			CC(C)Oc1ccc(cc1Cc1c(O)nc(S)nc1O)C(C)=O	InChI=1S/C16H18N2O4S/c1-8(2)22-13-5-4-10(9(3)19)6-11(13)7-12-14(20)17-16(23)18-15(12)21/h4-6,8H,7H2,1-3H3,(H3,17,18,20,21,23)	DCIDOXBJPJVTFZ-UHFFFAOYSA-N	334.098727766							112761
MLS000578450	LSM-44028	SID17503907, BRD-K36643110	2190942	InChI=1S/C14H13N3O2S/c1-16-13(19)10(12(18)15-14(16)20)8-17-7-6-9-4-2-3-5-11(9)17/h2-5,8H,6-7H2,1H3,(H,15,18,20)/b10-8-	LNLLWFFXFPKOOV-NTMALXAHSA-N	CN1C(=S)NC(=O)\C(=C\N2CCc3ccccc23)\C1=O	BroadT	BRD-K36643110	BRD-K36643110-001-05-6	ChemBridge Corporation	7473118			CN1C(=S)NC(=O)\C(=C\N2CCc3ccccc23)C1=O	InChI=1S/C14H13N3O2S/c1-16-13(19)10(12(18)15-14(16)20)8-17-7-6-9-4-2-3-5-11(9)17/h2-5,8H,6-7H2,1H3,(H,15,18,20)/b10-8-	LNLLWFFXFPKOOV-NTMALXAHSA-N	287.072847376							
HMS2702B15	LSM-24173	BRD-K24842996	16193081	InChI=1S/C26H31N7O2/c1-17-23(25(34)30-27-15-19-7-11-21(12-8-19)32(3)4)18(2)29-24(17)26(35)31-28-16-20-9-13-22(14-10-20)33(5)6/h7-16,29H,1-6H3,(H,30,34)(H,31,35)	JIQSYFKUSACYLV-UHFFFAOYSA-N	CN(C)c1ccc(C=NNC(=O)c2[nH]c(C)c(C(=O)NN=Cc3ccc(cc3)N(C)C)c2C)cc1	BroadT	BRD-K24842996	BRD-K24842996-001-05-7	ChemDiv Inc.	5617-0927			CN(C)c1ccc(C=NNC(=O)c2[nH]c(C)c(C(=O)NN=Cc3ccc(cc3)N(C)C)c2C)cc1	InChI=1S/C26H31N7O2/c1-17-23(25(34)30-27-15-19-7-11-21(12-8-19)32(3)4)18(2)29-24(17)26(35)31-28-16-20-9-13-22(14-10-20)33(5)6/h7-16,29H,1-6H3,(H,30,34)(H,31,35)	JIQSYFKUSACYLV-UHFFFAOYSA-N	473.253923302							112763
AC1LCN7L	LSM-15360	BRD-A04171102	652894	InChI=1S/C15H16N4O4/c1-9(19-15(23)11-3-13(21)8-17-6-11)4-18-14(22)10-2-12(20)7-16-5-10/h2-3,5-9,20-21H,4H2,1H3,(H,18,22)(H,19,23)	LMMZHPWDSHTAMF-UHFFFAOYSA-N	CC(CNC(=O)c1cncc(O)c1)NC(=O)c2cncc(O)c2	BroadT	BRD-A04171102	BRD-A04171102-003-05-4	Asinex Ltd.	BAS 00434324		Cl	CC(CNC(=O)c1cncc(O)c1)NC(=O)c1cncc(O)c1.Cl	InChI=1S/C15H16N4O4.ClH/c1-9(19-15(23)11-3-13(21)8-17-6-11)4-18-14(22)10-2-12(20)7-16-5-10;/h2-3,5-9,20-21H,4H2,1H3,(H,18,22)(H,19,23);1H	TZDUFWMWIMLUTN-UHFFFAOYSA-N	316.117155032							104006, 104006
MLS000030931	LSM-24174	SID844519, BRD-A89170710	646846	InChI=1S/C18H30N2O2/c1-17(2)14-18(21,10-12-22-17)9-11-19-13-15-5-7-16(8-6-15)20(3)4/h5-8,19,21H,9-14H2,1-4H3	VKVFYAGMEATUGN-UHFFFAOYSA-N	CN(C)c1ccc(CNCCC2(O)CCOC(C)(C)C2)cc1	BroadT	BRD-A89170710	BRD-A89170710-001-04-5	Asinex Ltd.	BAS 02141790			CN(C)c1ccc(CNCCC2(O)CCOC(C)(C)C2)cc1	InChI=1S/C18H30N2O2/c1-17(2)14-18(21,10-12-22-17)9-11-19-13-15-5-7-16(8-6-15)20(3)4/h5-8,19,21H,9-14H2,1-4H3	VKVFYAGMEATUGN-UHFFFAOYSA-N	306.23072822							112764
4-Methyl-6-methylsulfanyl-1H-quinolin-2-one	LSM-24175	SID851100, BRD-K90692821	653661	InChI=1S/C11H11NOS/c1-7-5-11(13)12-10-4-3-8(14-2)6-9(7)10/h3-6H,1-2H3,(H,12,13)	SDTDDKCWIYAIOT-UHFFFAOYSA-N	CSc1ccc2nc(O)cc(C)c2c1	BroadT	BRD-K90692821	BRD-K90692821-001-05-6	Asinex Ltd.	BAS 00898395			CSc1ccc2nc(O)cc(C)c2c1	InChI=1S/C11H11NOS/c1-7-5-11(13)12-10-4-3-8(14-2)6-9(7)10/h3-6H,1-2H3,(H,12,13)	SDTDDKCWIYAIOT-UHFFFAOYSA-N	205.056134672							112765
N6-Phenyladenosine	LSM-24176	N6-Phenyladenosine	101430	InChI=1S/C16H17N5O4/c22-6-10-12(23)13(24)16(25-10)21-8-19-11-14(17-7-18-15(11)21)20-9-4-2-1-3-5-9/h1-5,7-8,10,12-13,16,22-24H,6H2,(H,17,18,20)/t10-,12-,13-,16-/m1/s1	QVUUUSJUORLECR-XNIJJKJLSA-N	OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(Nc4ccccc4)ncnc23	BroadT	BRD-K89526504	BRD-K89526504-001-11-1	Sigma-Aldrich	P108			OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccccc3)ncnc12	InChI=1S/C16H17N5O4/c22-6-10-12(23)13(24)16(25-10)21-8-19-11-14(17-7-18-15(11)21)20-9-4-2-1-3-5-9/h1-5,7-8,10,12-13,16,22-24H,6H2,(H,17,18,20)/t10-,12-,13-,16-/m1/s1	QVUUUSJUORLECR-XNIJJKJLSA-N	343.128054074							112766
(3S)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide	LSM-24177	SID49822845, BRD-K83074203	8027854	InChI=1S/C20H21N3O4/c24-19(23-15-5-6-17-18(10-15)27-8-7-26-17)12-22-20(25)16-9-13-3-1-2-4-14(13)11-21-16/h1-6,10,16,21H,7-9,11-12H2,(H,22,25)(H,23,24)/t16-/m0/s1	GFBFEDLXWFBXLW-INIZCTEOSA-N	O=C(CNC(=O)[C@@H]1Cc2ccccc2CN1)Nc3ccc4OCCOc4c3	BroadT	BRD-K83074203	BRD-K83074203-001-05-4	InterBioScreen Ltd.	STOCK5S-62725			O=C(CNC(=O)[C@@H]1Cc2ccccc2CN1)Nc1ccc2OCCOc2c1	InChI=1S/C20H21N3O4/c24-19(23-15-5-6-17-18(10-15)27-8-7-26-17)12-22-20(25)16-9-13-3-1-2-4-14(13)11-21-16/h1-6,10,16,21H,7-9,11-12H2,(H,22,25)(H,23,24)/t16-/m0/s1	GFBFEDLXWFBXLW-INIZCTEOSA-N	367.153206182							112767
ZINC04842737	LSM-24178	SID47199506, BRD-K66770982	2996252	InChI=1S/C18H21N3OS/c1-18(2,3)16(22)21-17(23)20-15-6-4-13(5-7-15)12-14-8-10-19-11-9-14/h4-11H,12H2,1-3H3,(H2,20,21,22,23)	JTAITUFLRFKVAU-UHFFFAOYSA-N	CC(C)(C)C(=O)NC(=S)Nc1ccc(Cc2ccncc2)cc1	BroadT	BRD-K66770982	BRD-K66770982-001-05-5	ChemBridge Corporation	9013812			CC(C)(C)C(=O)NC(=S)Nc1ccc(Cc2ccncc2)cc1	InChI=1S/C18H21N3OS/c1-18(2,3)16(22)21-17(23)20-15-6-4-13(5-7-15)12-14-8-10-19-11-9-14/h4-11H,12H2,1-3H3,(H2,20,21,22,23)	JTAITUFLRFKVAU-UHFFFAOYSA-N	327.140533012							112768
10K-421S	LSM-44029	SID17402433, BRD-K95401717	5707078	InChI=1S/C16H16N2O3/c1-2-21-16(20)12-18-15(19)11-10-14(17-18)9-8-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3/b9-8+	YXLIKPYHIMEPBQ-CMDGGOBGSA-N	CCOC(=O)CN1N=C(\C=C\c2ccccc2)C=CC1=O	BroadT	BRD-K95401717	BRD-K95401717-001-05-4	Key Organics Ltd.	10K-421S			CCOC(=O)Cn1nc(\C=C\c2ccccc2)ccc1=O	InChI=1S/C16H16N2O3/c1-2-21-16(20)12-18-15(19)11-10-14(17-18)9-8-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3/b9-8+	YXLIKPYHIMEPBQ-CMDGGOBGSA-N	284.116092392							
MLS001002419	LSM-24180	SID24837754, BRD-K86720882	2114308	InChI=1S/C18H15Br2F2N3O2/c1-25(8-10-2-4-12(5-3-10)27-18(21)22)9-15-23-16-13(17(26)24-15)6-11(19)7-14(16)20/h2-7,18H,8-9H2,1H3,(H,23,24,26)	OGLVYALPLFPIMI-UHFFFAOYSA-N	CN(Cc1ccc(OC(F)F)cc1)Cc2nc(O)c3cc(Br)cc(Br)c3n2	BroadT	BRD-K86720882	BRD-K86720882-001-06-5	Enamine Ltd.	T5243391			CN(Cc1ccc(OC(F)F)cc1)Cc1nc(O)c2cc(Br)cc(Br)c2n1	InChI=1S/C18H15Br2F2N3O2/c1-25(8-10-2-4-12(5-3-10)27-18(21)22)9-15-23-16-13(17(26)24-15)6-11(19)7-14(16)20/h2-7,18H,8-9H2,1H3,(H,23,24,26)	OGLVYALPLFPIMI-UHFFFAOYSA-N	500.94990835							112770
AC1M4GDS	LSM-24181	BRD-K47479852	2307261	InChI=1S/C16H14N6S/c17-16(23)20-19-10-13-11-22(14-6-2-1-3-7-14)21-15(13)12-5-4-8-18-9-12/h1-11H,(H3,17,20,23)	WYJCBSDNIANXRY-UHFFFAOYSA-N	NC(=NN=Cc1cn(nc1c2cccnc2)c3ccccc3)S	BroadT	BRD-K47479852	BRD-K47479852-001-05-4	Enamine Ltd.	T0502-0158			NC(S)=NN=Cc1cn(nc1-c1cccnc1)-c1ccccc1	InChI=1S/C16H14N6S/c17-16(23)20-19-10-13-11-22(14-6-2-1-3-7-14)21-15(13)12-5-4-8-18-9-12/h1-11H,(H3,17,20,23)	WYJCBSDNIANXRY-UHFFFAOYSA-N	322.100065198							112771
AG-690/11450337	LSM-24182	SID17507737, BRD-K44642119	1049989	InChI=1S/C24H21NO3/c1-3-28-23(26)15-18-14-22(17-8-11-19(27-2)12-9-17)25-21-13-10-16-6-4-5-7-20(16)24(18)21/h4-14H,3,15H2,1-2H3	MPSVZSZPZTUWDP-UHFFFAOYSA-N	CCOC(=O)Cc1cc(nc2ccc3ccccc3c12)c4ccc(OC)cc4	BroadT	BRD-K44642119	BRD-K44642119-001-06-7	Asinex Ltd.	BAS 00549667			CCOC(=O)Cc1cc(nc2ccc3ccccc3c12)-c1ccc(OC)cc1	InChI=1S/C24H21NO3/c1-3-28-23(26)15-18-14-22(17-8-11-19(27-2)12-9-17)25-21-13-10-16-6-4-5-7-20(16)24(18)21/h4-14H,3,15H2,1-2H3	MPSVZSZPZTUWDP-UHFFFAOYSA-N	371.152143542							112772
T5244705	LSM-24183	SID22410475, BRD-K47271938	2116208	InChI=1S/C20H18N2O5/c1-12-4-6-16(23)15(8-12)19(24)14-10-21-22(11-14)20(25)13-5-7-17(26-2)18(9-13)27-3/h4-11,23H,1-3H3	MPMQKZNBYNBNSF-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)n2cc(cn2)C(=O)c3cc(C)ccc3O	BroadT	BRD-K47271938	BRD-K47271938-001-06-1	Enamine Ltd.	T5244705			COc1ccc(cc1OC)C(=O)n1cc(cn1)C(=O)c1cc(C)ccc1O	InChI=1S/C20H18N2O5/c1-12-4-6-16(23)15(8-12)19(24)14-10-21-22(11-14)20(25)13-5-7-17(26-2)18(9-13)27-3/h4-11,23H,1-3H3	MPMQKZNBYNBNSF-UHFFFAOYSA-N	366.121571696							112773
MLS000577047	LSM-44030	SID17414303, BRD-K64962867	1953653	InChI=1S/C15H19N3O2S/c1-3-17-6-8-18(9-7-17)15-16-14(19)13(21-15)10-12-5-4-11(2)20-12/h4-5,10H,3,6-9H2,1-2H3/b13-10-	AYAXXJNQSVDCMI-RAXLEYEMSA-N	CCN1CCN(CC1)C2=NC(=O)\C(=C\c3oc(C)cc3)\S2	BroadT	BRD-K64962867	BRD-K64962867-001-05-0	ChemBridge Corporation	7361147			CCN1CCN(CC1)C1=NC(=O)\C(S1)=C\c1ccc(C)o1	InChI=1S/C15H19N3O2S/c1-3-17-6-8-18(9-7-17)15-16-14(19)13(21-15)10-12-5-4-11(2)20-12/h4-5,10H,3,6-9H2,1-2H3/b13-10-	AYAXXJNQSVDCMI-RAXLEYEMSA-N	305.119797568							
MLS001160371	LSM-24185	SID49822884, BRD-K14759365	16406697	InChI=1S/C26H26N2O5/c29-24-7-3-6-22-17-10-16(13-28(22)24)12-27(14-17)25(30)15-32-18-8-9-20-19-4-1-2-5-21(19)26(31)33-23(20)11-18/h3,6-9,11,16-17H,1-2,4-5,10,12-15H2/t16-,17+/m1/s1	HKBYEHNTKISRIN-SJORKVTESA-N	O=C(COc1ccc2C3=C(CCCC3)C(=O)Oc2c1)N4C[C@H]5C[C@@H](C4)C6=CC=CC(=O)N6C5	BroadT	BRD-K14759365	BRD-K14759365-001-04-1	InterBioScreen Ltd.	STOCK1N-67125			O=C(COc1ccc2c3CCCCc3c(=O)oc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2	InChI=1S/C26H26N2O5/c29-24-7-3-6-22-17-10-16(13-28(22)24)12-27(14-17)25(30)15-32-18-8-9-20-19-4-1-2-5-21(19)26(31)33-23(20)11-18/h3,6-9,11,16-17H,1-2,4-5,10,12-15H2/t16-,17+/m1/s1	HKBYEHNTKISRIN-SJORKVTESA-N	446.184171952							112775
2-Chloro-n-[(5-chlorothien-2-yl)methyl]-n-methylacetamide	LSM-24186	SID24827565, BRD-K18667904	2465947	InChI=1S/C8H9Cl2NOS/c1-11(8(12)4-9)5-6-2-3-7(10)13-6/h2-3H,4-5H2,1H3	XTMBJEKDTRNUDZ-UHFFFAOYSA-N	CN(Cc1ccc(Cl)s1)C(=O)CCl	BroadT	BRD-K18667904	BRD-K18667904-001-07-3	Enamine Ltd.	T5320461			CN(Cc1ccc(Cl)s1)C(=O)CCl	InChI=1S/C8H9Cl2NOS/c1-11(8(12)4-9)5-6-2-3-7(10)13-6/h2-3H,4-5H2,1H3	XTMBJEKDTRNUDZ-UHFFFAOYSA-N	236.978190028							112776
AC1LXT8Q	LSM-24187	BRD-K05789358	1836644	InChI=1S/C21H20N8O3/c1-13-4-3-5-16(10-13)12-31-17-8-6-15(7-9-17)11-23-25-21(30)18-14(2)29(28-24-18)20-19(22)26-32-27-20/h3-11H,12H2,1-2H3,(H2,22,26)(H,25,30)	YDUKNIBEXGVDSV-UHFFFAOYSA-N	Cc1cccc(COc2ccc(C=NNC(=O)c3nnn(c3C)c4nonc4N)cc2)c1	BroadT	BRD-K05789358	BRD-K05789358-001-05-5	InterBioScreen Ltd.	STOCK3S-49069			Cc1c(nnn1-c1nonc1N)C(=O)NN=Cc1ccc(OCc2cccc(C)c2)cc1	InChI=1S/C21H20N8O3/c1-13-4-3-5-16(10-13)12-31-17-8-6-15(7-9-17)11-23-25-21(30)18-14(2)29(28-24-18)20-19(22)26-32-27-20/h3-11H,12H2,1-2H3,(H2,22,26)(H,25,30)	YDUKNIBEXGVDSV-UHFFFAOYSA-N	432.16583658							112777
MLS000529852	LSM-24188	SID14732798, BRD-K41696776	4656755	InChI=1S/C21H16N2O4/c1-12-11-17(23-20(24)13-7-9-14(26-2)10-8-13)22-19-15-5-3-4-6-16(15)27-21(25)18(12)19/h3-11H,1-2H3,(H,22,23,24)	GZJBSCBHENRIDX-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)Nc2cc(C)c3C(=O)Oc4ccccc4c3n2	BroadT	BRD-K41696776	BRD-K41696776-001-04-5	Life Chemicals Inc.	F0614-0001			COc1ccc(cc1)C(=O)Nc1cc(C)c2c(n1)c1ccccc1oc2=O	InChI=1S/C21H16N2O4/c1-12-11-17(23-20(24)13-7-9-14(26-2)10-8-13)22-19-15-5-3-4-6-16(15)27-21(25)18(12)19/h3-11H,1-2H3,(H,22,23,24)	GZJBSCBHENRIDX-UHFFFAOYSA-N	360.111007012							112778
ST51029427	LSM-24189	SID24803887, BRD-K87091170	2909240	InChI=1S/C17H17FN4O2S/c18-13-1-3-14(4-2-13)19-17(25)21-11-9-20(10-12-21)15-5-7-16(8-6-15)22(23)24/h1-8H,9-12H2,(H,19,25)	SEQFNVVRDBYZSZ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=Nc3ccc(F)cc3)S	BroadT	BRD-K87091170	BRD-K87091170-001-06-1	ChemBridge Corporation	6664842			[O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(S)=Nc1ccc(F)cc1	InChI=1S/C17H17FN4O2S/c18-13-1-3-14(4-2-13)19-17(25)21-11-9-20(10-12-21)15-5-7-16(8-6-15)22(23)24/h1-8H,9-12H2,(H,19,25)	SEQFNVVRDBYZSZ-UHFFFAOYSA-N	360.105624714							112779
BAS 03020362	LSM-24190	SID24822508, BRD-K78881103	787426	InChI=1S/C16H17N3O2/c1-19-14-6-4-3-5-13(14)18-16(19)17-10-11-7-8-12(21-2)9-15(11)20/h3-9,20H,10H2,1-2H3,(H,17,18)	RSTMPUDLQGLADR-UHFFFAOYSA-N	COc1ccc(CNc2nc3ccccc3n2C)c(O)c1	BroadT	BRD-K78881103	BRD-K78881103-001-06-8	Asinex Ltd.	BAS 03020362			COc1ccc(CNc2nc3ccccc3n2C)c(O)c1	InChI=1S/C16H17N3O2/c1-19-14-6-4-3-5-13(14)18-16(19)17-10-11-7-8-12(21-2)9-15(11)20/h3-9,20H,10H2,1-2H3,(H,17,18)	RSTMPUDLQGLADR-UHFFFAOYSA-N	283.132076814							112780
MLS000677323	LSM-24191	SID24803991, BRD-K90579328	1076541	InChI=1S/C20H25N3OS/c1-15-11-16(2)13-17(12-15)21-20(25)23-9-7-22(8-10-23)18-5-4-6-19(14-18)24-3/h4-6,11-14H,7-10H2,1-3H3,(H,21,25)	QKZLPIJCCJKBPE-UHFFFAOYSA-N	COc1cccc(c1)N2CCN(CC2)C(=Nc3cc(C)cc(C)c3)S	BroadT	BRD-K90579328	BRD-K90579328-001-06-1	Asinex Ltd.	BAS 04935871			COc1cccc(c1)N1CCN(CC1)C(S)=Nc1cc(C)cc(C)c1	InChI=1S/C20H25N3OS/c1-15-11-16(2)13-17(12-15)21-20(25)23-9-7-22(8-10-23)18-5-4-6-19(14-18)24-3/h4-6,11-14H,7-10H2,1-3H3,(H,21,25)	QKZLPIJCCJKBPE-UHFFFAOYSA-N	355.17183314							112781
MLS000106692	LSM-24192	SID7975463, BRD-K19009762	871915	InChI=1S/C14H13NO2S/c1-10(16)11-4-2-5-12(8-11)15-14(17)9-13-6-3-7-18-13/h2-8H,9H2,1H3,(H,15,17)	RTOCXMYDWNDHFW-UHFFFAOYSA-N	CC(=O)c1cccc(NC(=O)Cc2cccs2)c1	BroadT	BRD-K19009762	BRD-K19009762-001-05-2	ChemBridge Corporation	5557641			CC(=O)c1cccc(NC(=O)Cc2cccs2)c1	InChI=1S/C14H13NO2S/c1-10(16)11-4-2-5-12(8-11)15-14(17)9-13-6-3-7-18-13/h2-8H,9H2,1H3,(H,15,17)	RTOCXMYDWNDHFW-UHFFFAOYSA-N	259.066699356							112782
AC1M68IT	LSM-24193	BRD-K34215013	2368397	InChI=1S/C16H12BrN3S/c17-14-9-5-4-8-13(14)10-18-20-11-15(19-16(20)21)12-6-2-1-3-7-12/h1-11H,(H,19,21)	POPWRJLTVYJUGG-UHFFFAOYSA-N	Sc1nc(cn1N=Cc2ccccc2Br)c3ccccc3	BroadT	BRD-K34215013	BRD-K34215013-001-05-3	Enamine Ltd.	T0516-8182			Sc1nc(cn1N=Cc1ccccc1Br)-c1ccccc1	InChI=1S/C16H12BrN3S/c17-14-9-5-4-8-13(14)10-18-20-11-15(19-16(20)21)12-6-2-1-3-7-12/h1-11H,(H,19,21)	POPWRJLTVYJUGG-UHFFFAOYSA-N	356.993530704							112783
SMR000061613	LSM-24194	SID24839976, SID3716384, BRD-K16245752	2363621	InChI=1S/C22H19N5O5/c1-13-18(21(30)27(25(13)2)14-8-4-3-5-9-14)23-17(28)12-26-20(29)16-11-7-6-10-15(16)19(24-26)22(31)32/h3-11H,12H2,1-2H3,(H,23,28)(H,31,32)	PMSLMKMMVHGGQE-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)NC(=O)CN2N=C(C(=O)O)c3ccccc3C2=O)c4ccccc4	BroadT	BRD-K16245752	BRD-K16245752-001-05-7	Enamine Ltd.	T0509-6845			Cc1c(NC(=O)Cn2nc(C(O)=O)c3ccccc3c2=O)c(=O)n(-c2ccccc2)n1C	InChI=1S/C22H19N5O5/c1-13-18(21(30)27(25(13)2)14-8-4-3-5-9-14)23-17(28)12-26-20(29)16-11-7-6-10-15(16)19(24-26)22(31)32/h3-11H,12H2,1-2H3,(H,23,28)(H,31,32)	PMSLMKMMVHGGQE-UHFFFAOYSA-N	433.138618758							112784
ZINC00816378	LSM-24195	SID851613, BRD-K93020827	654198	InChI=1S/C17H10ClFN4O2S/c1-8-13(16(21-25-8)14-9(18)4-2-5-10(14)19)17(24)20-11-6-3-7-12-15(11)23-26-22-12/h2-7H,1H3,(H,20,24)	PGCUSUQHJOCJEK-UHFFFAOYSA-N	Cc1onc(c1C(=O)Nc2cccc3nsnc23)c4c(F)cccc4Cl	BroadT	BRD-K93020827	BRD-K93020827-001-05-1	Asinex Ltd.	BAS 09615699			Cc1onc(c1C(=O)Nc1cccc2nsnc12)-c1c(F)cccc1Cl	InChI=1S/C17H10ClFN4O2S/c1-8-13(16(21-25-8)14-9(18)4-2-5-10(14)19)17(24)20-11-6-3-7-12-15(11)23-26-22-12/h2-7H,1H3,(H,20,24)	PGCUSUQHJOCJEK-UHFFFAOYSA-N	388.0197022							112785
SMR000006487	LSM-24196	SID26667566, SID850278, BRD-K14526444	652795	InChI=1S/C22H23F3N8/c1-15-2-4-16(5-3-15)13-32-21(27-28-30-32)14-31-10-8-18(9-11-31)33-20-7-6-17(22(23,24)25)12-19(20)26-29-33/h2-7,12,18H,8-11,13-14H2,1H3	HUAUEZQIBAMCFR-UHFFFAOYSA-N	Cc1ccc(Cn2nnnc2CN3CCC(CC3)n4nnc5cc(ccc45)C(F)(F)F)cc1	BroadT	BRD-K14526444	BRD-K14526444-001-05-6	Asinex Ltd.	ASN 06365453			Cc1ccc(Cn2nnnc2CN2CCC(CC2)n2nnc3cc(ccc23)C(F)(F)F)cc1	InChI=1S/C22H23F3N8/c1-15-2-4-16(5-3-15)13-32-21(27-28-30-32)14-31-10-8-18(9-11-31)33-20-7-6-17(22(23,24)25)12-19(20)26-29-33/h2-7,12,18H,8-11,13-14H2,1H3	HUAUEZQIBAMCFR-UHFFFAOYSA-N	456.199777416							112786
AC1LU2AE	LSM-24197	BRD-K10334902	1544957	InChI=1S/C19H22ClN5O/c20-18-3-1-17(2-4-18)14-24-9-11-25(12-10-24)15-19(26)23-22-13-16-5-7-21-8-6-16/h1-8,13H,9-12,14-15H2,(H,23,26)	QVILEVSFHKRABE-UHFFFAOYSA-N	Clc1ccc(CN2CCN(CC(=O)NN=Cc3ccncc3)CC2)cc1	BroadT	BRD-K10334902	BRD-K10334902-001-06-2	InterBioScreen Ltd.	STOCK3S-27571			Clc1ccc(CN2CCN(CC(=O)NN=Cc3ccncc3)CC2)cc1	InChI=1S/C19H22ClN5O/c20-18-3-1-17(2-4-18)14-24-9-11-25(12-10-24)15-19(26)23-22-13-16-5-7-21-8-6-16/h1-8,13H,9-12,14-15H2,(H,23,26)	QVILEVSFHKRABE-UHFFFAOYSA-N	371.151288084							112787
ZINC06053916	LSM-24198	SID24832704, BRD-K35103690	4875690	InChI=1S/C17H15ClN2O2S/c18-14-7-3-1-5-12(14)11-22-15-8-4-2-6-13(15)16(21)20-17-19-9-10-23-17/h1-8H,9-11H2,(H,19,20,21)	OEVSYCFZIAVZAY-UHFFFAOYSA-N	Clc1ccccc1COc2ccccc2C(=O)NC3=NCCS3	BroadT	BRD-K35103690	BRD-K35103690-001-05-0	Enamine Ltd.	T5295618			Clc1ccccc1COc1ccccc1C(=O)NC1=NCCS1	InChI=1S/C17H15ClN2O2S/c18-14-7-3-1-5-12(14)11-22-15-8-4-2-6-13(15)16(21)20-17-19-9-10-23-17/h1-8H,9-11H2,(H,19,20,21)	OEVSYCFZIAVZAY-UHFFFAOYSA-N	346.05427614							112788
MLS000547582	LSM-24199	SID14728446, BRD-A26660658	3913718	InChI=1S/C14H9ClN2O2S/c15-13-12-8(6-20-14(12)17-7-16-13)11-5-18-9-3-1-2-4-10(9)19-11/h1-4,6-7,11H,5H2	BYXYOOUBQILWGZ-UHFFFAOYSA-N	Clc1ncnc2scc(C3COc4ccccc4O3)c12	BroadT	BRD-A26660658	BRD-A26660658-001-07-8	Specs	AL-281/40891120			Clc1ncnc2scc(C3COc4ccccc4O3)c12	InChI=1S/C14H9ClN2O2S/c15-13-12-8(6-20-14(12)17-7-16-13)11-5-18-9-3-1-2-4-10(9)19-11/h1-4,6-7,11H,5H2	BYXYOOUBQILWGZ-UHFFFAOYSA-N	304.007325948							112789
ZINC03416368	LSM-24200	SID24833452, BRD-K06736360	2535434	InChI=1S/C21H18FNO4/c1-13-11-17(14(2)23(13)19-6-4-3-5-18(19)22)20(25)12-27-21(26)15-7-9-16(24)10-8-15/h3-11,24H,12H2,1-2H3	KAYGDFANXAFOFY-UHFFFAOYSA-N	Cc1cc(C(=O)COC(=O)c2ccc(O)cc2)c(C)n1c3ccccc3F	BroadT	BRD-K06736360	BRD-K06736360-001-05-1	Enamine Ltd.	T5315952			Cc1cc(C(=O)COC(=O)c2ccc(O)cc2)c(C)n1-c1ccccc1F	InChI=1S/C21H18FNO4/c1-13-11-17(14(2)23(13)19-6-4-3-5-18(19)22)20(25)12-27-21(26)15-7-9-16(24)10-8-15/h3-11,24H,12H2,1-2H3	KAYGDFANXAFOFY-UHFFFAOYSA-N	367.121986266							112790
MLS000041325	LSM-44031	SID863714, BRD-A18319977	664966	InChI=1S/C15H16N4O/c1-2-6-12-11(5-1)13-14(19-12)15(18-9-17-13)16-8-10-4-3-7-20-10/h1-2,5-6,9-10,16H,3-4,7-8H2,(H,17,18)	XTAJUMNZGXRSSK-UHFFFAOYSA-N	C(Nc1[nH]cnc2c3ccccc3nc12)C4CCCO4	BroadT	BRD-A18319977	BRD-A18319977-001-05-9	InterBioScreen Ltd.	STOCK4S-81845			C(Nc1[nH]cnc2c3ccccc3nc12)C1CCCO1	InChI=1S/C15H16N4O/c1-2-6-12-11(5-1)13-14(19-12)15(18-9-17-13)16-8-10-4-3-7-20-10/h1-2,5-6,9-10,16H,3-4,7-8H2,(H,17,18)	XTAJUMNZGXRSSK-UHFFFAOYSA-N	268.132411172							
ST50072665	LSM-24202	SID14746490, BRD-K96098741	1192821	InChI=1S/C19H17N3O3S/c1-2-22-16-9-10-17(14-7-5-8-15(18(14)16)19(22)23)26(24,25)21-12-13-6-3-4-11-20-13/h3-11,21H,2,12H2,1H3	IIKQWKDJPZHRJE-UHFFFAOYSA-N	CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)NCc4ccccn4	BroadT	BRD-K96098741	BRD-K96098741-001-05-7	Enamine Ltd.	T0509-3942			CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)NCc1ccccn1	InChI=1S/C19H17N3O3S/c1-2-22-16-9-10-17(14-7-5-8-15(18(14)16)19(22)23)26(24,25)21-12-13-6-3-4-11-20-13/h3-11,21H,2,12H2,1H3	IIKQWKDJPZHRJE-UHFFFAOYSA-N	367.099062124							112792
SMR000004135	LSM-24203	SID846631, BRD-A93334282	649027	InChI=1S/C24H27N3O5/c1-30-19-7-5-18(6-8-19)25-24(29)27(15-21-4-3-11-32-21)14-17-12-16-13-20(31-2)9-10-22(16)26-23(17)28/h5-10,12-13,21H,3-4,11,14-15H2,1-2H3,(H,25,29)(H,26,28)	MPGZBWQAZCJJJT-UHFFFAOYSA-N	COc1ccc(NC(=O)N(CC2CCCO2)Cc3cc4cc(OC)ccc4nc3O)cc1	BroadT	BRD-A93334282	BRD-A93334282-001-05-6	Asinex Ltd.	ASN 05112882			COc1ccc(NC(=O)N(CC2CCCO2)Cc2cc3cc(OC)ccc3nc2O)cc1	InChI=1S/C24H27N3O5/c1-30-19-7-5-18(6-8-19)25-24(29)27(15-21-4-3-11-32-21)14-17-12-16-13-20(31-2)9-10-22(16)26-23(17)28/h5-10,12-13,21H,3-4,11,14-15H2,1-2H3,(H,25,29)(H,26,28)	MPGZBWQAZCJJJT-UHFFFAOYSA-N	437.195070994							112793
MLS000766251	LSM-24204	SID26732581, BRD-K64536584	323282	InChI=1S/C12H9FN2O3/c13-8-3-5-9(6-4-8)15-12(17)18-10-2-1-7-14-11(10)16/h1-7H,(H,14,16)(H,15,17)	CFKRYYYJFGYXSH-UHFFFAOYSA-N	Oc1ncccc1OC(=O)Nc2ccc(F)cc2	BroadT	BRD-K64536584	BRD-K64536584-001-05-4	National Cancer Institute Chemotherapeutic Agents Repository	Carbamic acid, (4-fluorophenyl)-, 1,2-dihydro-2-oxo-3-pyridinyl ester 282187			Oc1ncccc1OC(=O)Nc1ccc(F)cc1	InChI=1S/C12H9FN2O3/c13-8-3-5-9(6-4-8)15-12(17)18-10-2-1-7-14-11(10)16/h1-7H,(H,14,16)(H,15,17)	CFKRYYYJFGYXSH-UHFFFAOYSA-N	248.059720368							112794
SMR000118767	LSM-24205	SID14721253, BRD-A08917095	3210440	InChI=1S/C24H32N6O2S/c1-19(2)17-23(29-15-13-28(14-16-29)21-7-5-4-6-8-21)24-25-26-27-30(24)18-33(31,32)22-11-9-20(3)10-12-22/h4-12,19,23H,13-18H2,1-3H3	YKMICNZALZAKQP-UHFFFAOYSA-N	CC(C)CC(N1CCN(CC1)c2ccccc2)c3nnnn3CS(=O)(=O)c4ccc(C)cc4	BroadT	BRD-A08917095	BRD-A08917095-001-05-9	Asinex Ltd.	ASN 05560082			CC(C)CC(N1CCN(CC1)c1ccccc1)c1nnnn1CS(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H32N6O2S/c1-19(2)17-23(29-15-13-28(14-16-29)21-7-5-4-6-8-21)24-25-26-27-30(24)18-33(31,32)22-11-9-20(3)10-12-22/h4-12,19,23H,13-18H2,1-3H3	YKMICNZALZAKQP-UHFFFAOYSA-N	468.230745014							112795
AC1NWJTO	LSM-44032	SID24793467, BRD-K97673946	5730603	InChI=1S/C20H18FN3O4S/c1-13-14(2)23-28-20(13)24-29(26,27)18-9-7-17(8-10-18)22-12-11-19(25)15-3-5-16(21)6-4-15/h3-12,22,24H,1-2H3/b12-11-	YVTROUKQHMBWRO-QXMHVHEDSA-N	Cc1noc(NS(=O)(=O)c2ccc(N\C=C/C(=O)c3ccc(F)cc3)cc2)c1C	BroadT	BRD-K97673946	BRD-K97673946-001-05-9	ChemBridge Corporation	6511979			Cc1noc(NS(=O)(=O)c2ccc(N\C=C/C(=O)c3ccc(F)cc3)cc2)c1C	InChI=1S/C20H18FN3O4S/c1-13-14(2)23-28-20(13)24-29(26,27)18-9-7-17(8-10-18)22-12-11-19(25)15-3-5-16(21)6-4-15/h3-12,22,24H,1-2H3/b12-11-	YVTROUKQHMBWRO-QXMHVHEDSA-N	415.100204976							
SMR000130841	LSM-44033	SID14738628, BRD-K14559724	9551507	InChI=1S/C18H14N4O2S2/c1-11-21-22-16(19)14(17(23)20-18(22)26-11)9-13-7-8-15(24-13)25-10-12-5-3-2-4-6-12/h2-9,19H,10H2,1H3/b14-9+,19-16?	YFZYUFLNTPSUHR-OGJKRULYSA-N	CC1=NN2C(=NC(=O)\C(=C\c3oc(SCc4ccccc4)cc3)\C2=N)S1	BroadT	BRD-K14559724	BRD-K14559724-001-06-6	ChemDiv Inc.	C639-0322			CC1=NN2C(S1)=NC(=O)\C(=C\c1ccc(SCc3ccccc3)o1)C2=N	InChI=1S/C18H14N4O2S2/c1-11-21-22-16(19)14(17(23)20-18(22)26-11)9-13-7-8-15(24-13)25-10-12-5-3-2-4-6-12/h2-9,19H,10H2,1H3/b14-9+,19-16?	YFZYUFLNTPSUHR-OGJKRULYSA-N	382.055817108							
SMR000063787	LSM-24208	SID3711882, BRD-K93535842	2161110	InChI=1S/C16H19N3O3S3/c1-13-11-23-16(17-13)24-12-15(20)18-7-9-19(10-8-18)25(21,22)14-5-3-2-4-6-14/h2-6,11H,7-10,12H2,1H3	UOWRRFTZKHJUDU-UHFFFAOYSA-N	Cc1csc(SCC(=O)N2CCN(CC2)S(=O)(=O)c3ccccc3)n1	BroadT	BRD-K93535842	BRD-K93535842-001-05-9	Enamine Ltd.	T5252259			Cc1csc(SCC(=O)N2CCN(CC2)S(=O)(=O)c2ccccc2)n1	InChI=1S/C16H19N3O3S3/c1-13-11-23-16(17-13)24-12-15(20)18-7-9-19(10-8-18)25(21,22)14-5-3-2-4-6-14/h2-6,11H,7-10,12H2,1H3	UOWRRFTZKHJUDU-UHFFFAOYSA-N	397.058853568							112798
MLS000095649	LSM-24209	SID4241295, BRD-K66678262	3236291	InChI=1S/C21H19N3O3S/c1-12-3-5-17(13(2)7-12)24-20(15-9-28-10-16(15)23-24)22-21(25)14-4-6-18-19(8-14)27-11-26-18/h3-8H,9-11H2,1-2H3,(H,22,25)	BCHAKAQIAKWFAO-UHFFFAOYSA-N	Cc1ccc(c(C)c1)n2nc3CSCc3c2NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K66678262	BRD-K66678262-001-06-9	ChemDiv Inc.	K409-0018			Cc1ccc(c(C)c1)-n1nc2CSCc2c1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H19N3O3S/c1-12-3-5-17(13(2)7-12)24-20(15-9-28-10-16(15)23-24)22-21(25)14-4-6-18-19(8-14)27-11-26-18/h3-8H,9-11H2,1-2H3,(H,22,25)	BCHAKAQIAKWFAO-UHFFFAOYSA-N	393.114712188							112799
BRD-A06868307	LSM-24210			InChI=1S/C22H23NO5/c1-13-8-10-15(11-9-13)20(25)18-19(16-6-4-5-7-17(16)28-3)23(12-14(2)24)22(27)21(18)26/h4-11,14,18-19,24H,12H2,1-3H3	LGLSTRTUTJRBKI-UHFFFAOYSA-N	COc1ccccc1C2C(C(=O)c3ccc(C)cc3)C(=O)C(=O)N2CC(C)O	BroadT	BRD-A06868307	BRD-A06868307-001-05-0	Asinex Ltd.	BAS 03842055			COc1ccccc1C1C(C(=O)c2ccc(C)cc2)C(=O)C(=O)N1CC(C)O	InChI=1S/C22H23NO5/c1-13-8-10-15(11-9-13)20(25)18-19(16-6-4-5-7-17(16)28-3)23(12-14(2)24)22(27)21(18)26/h4-11,14,18-19,24H,12H2,1-3H3	LGLSTRTUTJRBKI-UHFFFAOYSA-N	381.157622846							112800
AP-064/41684748	LSM-24211	SID843456, BRD-K87643564	645752	InChI=1S/C20H17ClN2O5/c1-26-13-6-8-16(18(11-13)27-2)23-19(24)14-10-12(21)5-7-15(14)22-20(25)17-4-3-9-28-17/h3-11H,1-2H3,(H,22,25)(H,23,24)	JVRULJDJPNCHCE-UHFFFAOYSA-N	COc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c3occc3)c(OC)c1	BroadT	BRD-K87643564	BRD-K87643564-001-05-5	Asinex Ltd.	BAS 06021780			COc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccco2)c(OC)c1	InChI=1S/C20H17ClN2O5/c1-26-13-6-8-16(18(11-13)27-2)23-19(24)14-10-12(21)5-7-15(14)22-20(25)17-4-3-9-28-17/h3-11H,1-2H3,(H,22,25)(H,23,24)	JVRULJDJPNCHCE-UHFFFAOYSA-N	400.082599374							112801
MLS001002135	LSM-24212	SID26670139, BRD-K79410675	3430334	InChI=1S/C19H18N2O7S/c1-21(2)29(25,26)14-6-3-12(4-7-14)19(24)28-10-16(22)13-5-8-17-15(9-13)20-18(23)11-27-17/h3-9H,10-11H2,1-2H3,(H,20,23)	JYTPKLIVMPOFST-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(cc1)C(=O)OCC(=O)c2ccc3OCC(=O)Nc3c2	BroadT	BRD-K79410675	BRD-K79410675-001-07-1	Enamine Ltd.	T0519-2658			CN(C)S(=O)(=O)c1ccc(cc1)C(=O)OCC(=O)c1ccc2OCC(=O)Nc2c1	InChI=1S/C19H18N2O7S/c1-21(2)29(25,26)14-6-3-12(4-7-14)19(24)28-10-16(22)13-5-8-17-15(9-13)20-18(23)11-27-17/h3-9H,10-11H2,1-2H3,(H,20,23)	JYTPKLIVMPOFST-UHFFFAOYSA-N	418.083471626							112802
AC1NTN2Z	LSM-24213	BRD-K16861497	5384385	InChI=1S/C13H19N3O3S/c1-18-8-4-7-14-13(20)16-15-9-10-5-3-6-11(19-2)12(10)17/h3,5-6,9,17H,4,7-8H2,1-2H3,(H2,14,16,20)	PZMKXOPUYSOXMX-UHFFFAOYSA-N	COCCCN=C(S)NN=Cc1cccc(OC)c1O	BroadT	BRD-K16861497	BRD-K16861497-001-05-1	Maybridge	CD 02862			COCCCN=C(S)NN=Cc1cccc(OC)c1O	InChI=1S/C13H19N3O3S/c1-18-8-4-7-14-13(20)16-15-9-10-5-3-6-11(19-2)12(10)17/h3,5-6,9,17H,4,7-8H2,1-2H3,(H2,14,16,20)	PZMKXOPUYSOXMX-UHFFFAOYSA-N	297.114712188							
MLS001018621	LSM-44034	SID24826587, BRD-K27845439	6246448	InChI=1S/C12H17N3OS/c1-13-8-4-5-9(13)6-7-10-11(16)15(3)12(17)14(10)2/h6-7H,4-5,8H2,1-3H3/b9-6+,10-7+	SXRPCRZFBUCPSR-KZZDLZNXSA-N	CN1CCC/C/1=C\C=C/2\N(C)C(=S)N(C)C2=O	BroadT	BRD-K27845439	BRD-K27845439-001-05-2	Enamine Ltd.	T0500-9160			CN1CCC\C1=C/C=C1/N(C)C(=S)N(C)C1=O	InChI=1S/C12H17N3OS/c1-13-8-4-5-9(13)6-7-10-11(16)15(3)12(17)14(10)2/h6-7H,4-5,8H2,1-3H3/b9-6+,10-7+	SXRPCRZFBUCPSR-KZZDLZNXSA-N	251.109232884							
AC1LB7JD	LSM-24215	BRD-K52450848	577779	InChI=1S/C10H8BrN5O/c11-8-6-14-15-9(8)10(17)16-13-5-7-2-1-3-12-4-7/h1-6H,(H,14,15)(H,16,17)	QQBZAPFTTITRFK-UHFFFAOYSA-N	Brc1c[nH]nc1C(=O)NN=Cc2cccnc2	BroadT	BRD-K52450848	BRD-K52450848-001-05-4	Specs	AG-690/33775051			Brc1c[nH]nc1C(=O)NN=Cc1cccnc1	InChI=1S/C10H8BrN5O/c11-8-6-14-15-9(8)10(17)16-13-5-7-2-1-3-12-4-7/h1-6H,(H,14,15)(H,16,17)	QQBZAPFTTITRFK-UHFFFAOYSA-N	292.991222526							112805
AC1NJUPJ	LSM-24216	SID24839400, BRD-K13937727	4877981	InChI=1S/C16H17ClN4S/c1-10-8-14(15-9-22-16(18-3)20-19-15)11(2)21(10)13-6-4-12(17)5-7-13/h4-8H,9H2,1-3H3,(H,18,20)	GKGQQMGABWPFEZ-UHFFFAOYSA-N	CNC1=NN=C(CS1)c2cc(C)n(c2C)c3ccc(Cl)cc3	BroadT	BRD-K13937727	BRD-K13937727-001-05-4	Enamine Ltd.	T5307833			CNC1=NN=C(CS1)c1cc(C)n(c1C)-c1ccc(Cl)cc1	InChI=1S/C16H17ClN4S/c1-10-8-14(15-9-22-16(18-3)20-19-15)11(2)21(10)13-6-4-12(17)5-7-13/h4-8H,9H2,1-3H3,(H,18,20)	GKGQQMGABWPFEZ-UHFFFAOYSA-N	332.086244984							112806
SMR000011210	LSM-24217	BRD-A01811599	644392	InChI=1S/C19H18FN3O3S/c1-23-17(24)11-16(18(25)22-15-9-4-3-8-14(15)20)27-19(23)21-12-6-5-7-13(10-12)26-2/h3-10,16H,11H2,1-2H3,(H,22,25)	WGWDBMPSDCGWMQ-UHFFFAOYSA-N	COc1cccc(c1)N=C2SC(CC(=O)N2C)C(=O)Nc3ccccc3F	BroadT	BRD-A01811599	BRD-A01811599-001-05-2	Asinex Ltd.	BAS 02239439			COc1cccc(c1)N=C1SC(CC(=O)N1C)C(=O)Nc1ccccc1F	InChI=1S/C19H18FN3O3S/c1-23-17(24)11-16(18(25)22-15-9-4-3-8-14(15)20)27-19(23)21-12-6-5-7-13(10-12)26-2/h3-10,16H,11H2,1-2H3,(H,22,25)	WGWDBMPSDCGWMQ-UHFFFAOYSA-N	387.105290356							112807
T0518-9025	LSM-24218	SID24826084, BRD-K85854244	2470509	InChI=1S/C15H14F2N4OS/c1-9-4-3-5-10-6-18-7-11(13(9)10)22-8-12-19-20-15(21(12)2)23-14(16)17/h3-7,14H,8H2,1-2H3	LTTNTPOYRNRKKM-UHFFFAOYSA-N	Cc1cccc2cncc(OCc3nnc(SC(F)F)n3C)c12	BroadT	BRD-K85854244	BRD-K85854244-001-05-8	Enamine Ltd.	T0518-9025			Cc1cccc2cncc(OCc3nnc(SC(F)F)n3C)c12	InChI=1S/C15H14F2N4OS/c1-9-4-3-5-10-6-18-7-11(13(9)10)22-8-12-19-20-15(21(12)2)23-14(16)17/h3-7,14H,8H2,1-2H3	LTTNTPOYRNRKKM-UHFFFAOYSA-N	336.085638198							112808
MLS000698921	LSM-24219	SID24783233, BRD-K31454979	1233014	InChI=1S/C12H10N4OS2/c1-8-2-3-9(6-13)11(15-8)19-7-10(17)16-12-14-4-5-18-12/h2-5H,7H2,1H3,(H,14,16,17)	YTTUOCXSEPPONX-UHFFFAOYSA-N	Cc1ccc(C#N)c(SCC(=O)Nc2nccs2)n1	BroadT	BRD-K31454979	BRD-K31454979-001-06-1	Specs	AO-081/15386725			Cc1ccc(C#N)c(SCC(=O)Nc2nccs2)n1	InChI=1S/C12H10N4OS2/c1-8-2-3-9(6-13)11(15-8)19-7-10(17)16-12-14-4-5-18-12/h2-5H,7H2,1H3,(H,14,16,17)	YTTUOCXSEPPONX-UHFFFAOYSA-N	290.02960236							112809
MLS000536594	LSM-24220	SID16953396, BRD-K13618623	2632862	InChI=1S/C18H20F3N3O3S/c1-3-24(4-2)28(26,27)16-10-8-14(9-11-16)22-17(25)23-15-7-5-6-13(12-15)18(19,20)21/h5-12H,3-4H2,1-2H3,(H2,22,23,25)	CZUSITLIFNHQMO-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1	BroadT	BRD-K13618623	BRD-K13618623-001-09-7	Enamine Ltd.	T0506-1634			CCN(CC)S(=O)(=O)c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1	InChI=1S/C18H20F3N3O3S/c1-3-24(4-2)28(26,27)16-10-8-14(9-11-16)22-17(25)23-15-7-5-6-13(12-15)18(19,20)21/h5-12H,3-4H2,1-2H3,(H2,22,23,25)	CZUSITLIFNHQMO-UHFFFAOYSA-N	415.11774682							112810
SMR000008290	LSM-24221	SID845755, BRD-K59496950	648117	InChI=1S/C22H26N4O3/c1-3-29-22(28)20-15-19-18(9-10-23(19)2)26(20)16-21(27)25-13-11-24(12-14-25)17-7-5-4-6-8-17/h4-10,15H,3,11-14,16H2,1-2H3	IVJLCDDHHVISLL-UHFFFAOYSA-N	CCOC(=O)c1cc2c(ccn2C)n1CC(=O)N3CCN(CC3)c4ccccc4	BroadT	BRD-K59496950	BRD-K59496950-001-06-2	Asinex Ltd.	ASN 08222509			CCOC(=O)c1cc2n(C)ccc2n1CC(=O)N1CCN(CC1)c1ccccc1	InChI=1S/C22H26N4O3/c1-3-29-22(28)20-15-19-18(9-10-23(19)2)26(20)16-21(27)25-13-11-24(12-14-25)17-7-5-4-6-8-17/h4-10,15H,3,11-14,16H2,1-2H3	IVJLCDDHHVISLL-UHFFFAOYSA-N	394.200490732							112811
MLS000708452	LSM-24222	SID24822638, BRD-K39789065	3147178	InChI=1S/C15H11ClN4O3/c1-8(21)17-10-4-2-9(3-5-10)15-18-12-6-11(16)14(20(22)23)7-13(12)19-15/h2-7H,1H3,(H,17,21)(H,18,19)	QGFAAZRVTUPHHG-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)c2nc3cc(Cl)c(cc3[nH]2)[N+](=O)[O-]	BroadT	BRD-K39789065	BRD-K39789065-001-06-7	Asinex Ltd.	BAS 03420940			CC(=O)Nc1ccc(cc1)-c1nc2cc(Cl)c(cc2[nH]1)[N+]([O-])=O	InChI=1S/C15H11ClN4O3/c1-8(21)17-10-4-2-9(3-5-10)15-18-12-6-11(16)14(20(22)23)7-13(12)19-15/h2-7H,1H3,(H,17,21)(H,18,19)	QGFAAZRVTUPHHG-UHFFFAOYSA-N	330.051967962							112812
AC1NRQEQ	LSM-24223	SID865378, BRD-K23467433	5296619	InChI=1S/C17H16N4O2/c1-2-4-14-13(3-1)19-17-18-9-20(10-21(14)17)8-12-5-6-15-16(7-12)23-11-22-15/h1-7H,8-11H2,(H,18,19)	MYYGAAPIGHKPGV-UHFFFAOYSA-N	C(N1CNc2nc3ccccc3n2C1)c4ccc5OCOc5c4	BroadT	BRD-K23467433	BRD-K23467433-001-05-5	InterBioScreen Ltd.	STOCK5S-45389			C(N1CNc2nc3ccccc3n2C1)c1ccc2OCOc2c1	InChI=1S/C17H16N4O2/c1-2-4-14-13(3-1)19-17-18-9-20(10-21(14)17)8-12-5-6-15-16(7-12)23-11-22-15/h1-7H,8-11H2,(H,18,19)	MYYGAAPIGHKPGV-UHFFFAOYSA-N	308.127325792							112813
MLS000771305	LSM-24224	SID24830577, BRD-K23946230	4832471	InChI=1S/C10H14N2O2S3/c1-4-14-10(15)16-5-8(13)12-9-11-6(2)7(3)17-9/h4-5H2,1-3H3,(H,11,12,13)	KLXPSPAVOPNDDU-UHFFFAOYSA-N	CCOC(=S)SCC(=O)Nc1nc(C)c(C)s1	BroadT	BRD-K23946230	BRD-K23946230-001-07-9	Enamine Ltd.	T5296760			CCOC(=S)SCC(=O)Nc1nc(C)c(C)s1	InChI=1S/C10H14N2O2S3/c1-4-14-10(15)16-5-8(13)12-9-11-6(2)7(3)17-9/h4-5H2,1-3H3,(H,11,12,13)	KLXPSPAVOPNDDU-UHFFFAOYSA-N	290.021739778							112814
ASN 05380861	LSM-24225	SID26667530, SID853041, BRD-K50963323	655682	InChI=1S/C26H31N3O5S/c1-18-7-8-19(2)25-23(18)16-20(26(31)27-25)17-29(15-5-14-28-13-4-6-24(28)30)35(32,33)22-11-9-21(34-3)10-12-22/h7-12,16H,4-6,13-15,17H2,1-3H3,(H,27,31)	DTZMXLJFFPUVDH-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)N(CCCN2CCCC2=O)Cc3cc4c(C)ccc(C)c4nc3O	BroadT	BRD-K50963323	BRD-K50963323-001-05-2	Asinex Ltd.	ASN 05380861			COc1ccc(cc1)S(=O)(=O)N(CCCN1CCCC1=O)Cc1cc2c(C)ccc(C)c2nc1O	InChI=1S/C26H31N3O5S/c1-18-7-8-19(2)25-23(18)16-20(26(31)27-25)17-29(15-5-14-28-13-4-6-24(28)30)35(32,33)22-11-9-21(34-3)10-12-22/h7-12,16H,4-6,13-15,17H2,1-3H3,(H,27,31)	DTZMXLJFFPUVDH-UHFFFAOYSA-N	497.198441812							112815
MLS000558692	LSM-24226	SID17407943, BRD-K60350936	748920	InChI=1S/C11H23N7/c1-10(2,3)16-7-13-8(17-11(4,5)6)15-9(14-7)18-12/h12H2,1-6H3,(H3,13,14,15,16,17,18)	YWVAFGKAVNYSSZ-UHFFFAOYSA-N	CC(C)(C)Nc1nc(NN)nc(NC(C)(C)C)n1	BroadT	BRD-K60350936	BRD-K60350936-001-05-9	Asinex Ltd.	BAS 00209779			CC(C)(C)Nc1nc(NN)nc(NC(C)(C)C)n1	InChI=1S/C11H23N7/c1-10(2,3)16-7-13-8(17-11(4,5)6)15-9(14-7)18-12/h12H2,1-6H3,(H3,13,14,15,16,17,18)	YWVAFGKAVNYSSZ-UHFFFAOYSA-N	253.201493806							112816
MLS000687086	LSM-24227	SID24805488, BRD-K67209890	1047584	InChI=1S/C16H16ClN3O2S2/c17-12-10-11(3-4-13(12)20-5-7-22-8-6-20)18-16(23)19-15(21)14-2-1-9-24-14/h1-4,9-10H,5-8H2,(H2,18,19,21,23)	BMABBSQVCNNHIU-UHFFFAOYSA-N	Clc1cc(NC(=S)NC(=O)c2cccs2)ccc1N3CCOCC3	BroadT	BRD-K67209890	BRD-K67209890-001-06-2	Asinex Ltd.	BAS 02722605			Clc1cc(NC(=S)NC(=O)c2cccs2)ccc1N1CCOCC1	InChI=1S/C16H16ClN3O2S2/c17-12-10-11(3-4-13(12)20-5-7-22-8-6-20)18-16(23)19-15(21)14-2-1-9-24-14/h1-4,9-10H,5-8H2,(H2,18,19,21,23)	BMABBSQVCNNHIU-UHFFFAOYSA-N	381.037245872							112817
MLS000756489	LSM-24228	SID26666149, BRD-K75977772	4007404	InChI=1S/C12H10N2O3S/c15-9-4-1-3-8(7-9)13-12(18)14-11(16)10-5-2-6-17-10/h1-7,15H,(H2,13,14,16,18)	RMDOBGURCUPDKG-UHFFFAOYSA-N	Oc1cccc(NC(=S)NC(=O)c2occc2)c1	BroadT	BRD-K75977772	BRD-K75977772-001-05-9	National Cancer Institute Chemotherapeutic Agents Repository	205913			Oc1cccc(NC(=S)NC(=O)c2ccco2)c1	InChI=1S/C12H10N2O3S/c15-9-4-1-3-8(7-9)13-12(18)14-11(16)10-5-2-6-17-10/h1-7,15H,(H2,13,14,16,18)	RMDOBGURCUPDKG-UHFFFAOYSA-N	262.04121289							112818
T5250099	LSM-24229	SID24829215, BRD-K15827540	2123280	InChI=1S/C12H12N4O/c1-2-5-9(6-3-1)11-15-16-12(17-11)14-10-7-4-8-13-10/h1-3,5-6H,4,7-8H2,(H,13,14,16)	WUYSOFHLTPJEGK-UHFFFAOYSA-N	C1CN=C(C1)Nc2oc(nn2)c3ccccc3	BroadT	BRD-K15827540	BRD-K15827540-001-05-0	Enamine Ltd.	T5250099			C1CN=C(C1)Nc1nnc(o1)-c1ccccc1	InChI=1S/C12H12N4O/c1-2-5-9(6-3-1)11-15-16-12(17-11)14-10-7-4-8-13-10/h1-3,5-6H,4,7-8H2,(H,13,14,16)	WUYSOFHLTPJEGK-UHFFFAOYSA-N	228.101111044							112819
1-(4-Cyano-phenyl)-3-[1-(4-methoxy-benzyl)-2-oxo-1,2-dihydro-pyridin-3-yl]-urea	LSM-24230	SID850946, BRD-K97097354	653490	InChI=1S/C21H18N4O3/c1-28-18-10-6-16(7-11-18)14-25-12-2-3-19(20(25)26)24-21(27)23-17-8-4-15(13-22)5-9-17/h2-12H,14H2,1H3,(H2,23,24,27)	ZENMHPOTIGKQQQ-UHFFFAOYSA-N	COc1ccc(CN2C=CC=C(NC(=O)Nc3ccc(cc3)C#N)C2=O)cc1	BroadT	BRD-K97097354	BRD-K97097354-001-05-6	Asinex Ltd.	ASN 10013985			COc1ccc(Cn2cccc(NC(=O)Nc3ccc(cc3)C#N)c2=O)cc1	InChI=1S/C21H18N4O3/c1-28-18-10-6-16(7-11-18)14-25-12-2-3-19(20(25)26)24-21(27)23-17-8-4-15(13-22)5-9-17/h2-12H,14H2,1H3,(H2,23,24,27)	ZENMHPOTIGKQQQ-UHFFFAOYSA-N	374.137890476							112820
ASN 05991593	LSM-24231	SID842994, BRD-K72134582	645272	InChI=1S/C23H30N4O4/c1-17-15-20(26-31-17)25-21(28)13-8-14-23(30)27(19-11-6-3-7-12-19)16-22(29)24-18-9-4-2-5-10-18/h3,6-7,11-12,15,18H,2,4-5,8-10,13-14,16H2,1H3,(H,24,29)(H,25,26,28)	POBXOYYHICNQJV-UHFFFAOYSA-N	Cc1onc(NC(=O)CCCC(=O)N(CC(=O)NC2CCCCC2)c3ccccc3)c1	BroadT	BRD-K72134582	BRD-K72134582-001-05-0	Asinex Ltd.	ASN 05991593			Cc1onc(NC(=O)CCCC(=O)N(CC(=O)NC2CCCCC2)c2ccccc2)c1	InChI=1S/C23H30N4O4/c1-17-15-20(26-31-17)25-21(28)13-8-14-23(30)27(19-11-6-3-7-12-19)16-22(29)24-18-9-4-2-5-10-18/h3,6-7,11-12,15,18H,2,4-5,8-10,13-14,16H2,1H3,(H,24,29)(H,25,26,28)	POBXOYYHICNQJV-UHFFFAOYSA-N	426.22670548							112821
ZINC04338445	LSM-24232	SID24815897, BRD-K57239091	7197007	InChI=1S/C12H12N2O5S/c1-13-8-10(11(15)14(2)12(13)16)20(17,18)19-9-6-4-3-5-7-9/h3-8H,1-2H3	QJDFIELPDVVWKB-UHFFFAOYSA-N	CN1C=C(C(=O)N(C)C1=O)S(=O)(=O)Oc2ccccc2	BroadT	BRD-K57239091	BRD-K57239091-001-05-0	Life Chemicals Inc.	F1850-0005			Cn1cc(c(=O)n(C)c1=O)S(=O)(=O)Oc1ccccc1	InChI=1S/C12H12N2O5S/c1-13-8-10(11(15)14(2)12(13)16)20(17,18)19-9-6-4-3-5-7-9/h3-8H,1-2H3	QJDFIELPDVVWKB-UHFFFAOYSA-N	296.046692194							112822
SMR000091922	LSM-24233	SID7967647, BRD-A77086619	2937983	InChI=1S/C24H25N3O2/c1-15-10-11-21-19(12-15)18-6-5-9-23(29)24(18)27(21)14-17(28)13-26-16(2)25-20-7-3-4-8-22(20)26/h3-4,7-8,10-12,17,28H,5-6,9,13-14H2,1-2H3	ZGHPSPZDXBQRMT-UHFFFAOYSA-N	Cc1ccc2c(c1)c3CCCC(=O)c3n2CC(O)Cn4c(C)nc5ccccc45	BroadT	BRD-A77086619	BRD-A77086619-001-04-9	ChemDiv Inc.	5926-0079			Cc1nc2ccccc2n1CC(O)Cn1c2c(CCCC2=O)c2cc(C)ccc12	InChI=1S/C24H25N3O2/c1-15-10-11-21-19(12-15)18-6-5-9-23(29)24(18)27(21)14-17(28)13-26-16(2)25-20-7-3-4-8-22(20)26/h3-4,7-8,10-12,17,28H,5-6,9,13-14H2,1-2H3	ZGHPSPZDXBQRMT-UHFFFAOYSA-N	387.19467707							112823
SMR000014825	LSM-24234	SID845149, BRD-K14448866	647483	InChI=1S/C24H30N4O3/c29-23(17-27-13-1-2-14-27)25-19-5-9-21(10-6-19)31-22-11-7-20(8-12-22)26-24(30)18-28-15-3-4-16-28/h5-12H,1-4,13-18H2,(H,25,29)(H,26,30)	TYFPXMFXJNYUAA-UHFFFAOYSA-N	O=C(CN1CCCC1)Nc2ccc(Oc3ccc(NC(=O)CN4CCCC4)cc3)cc2	BroadT	BRD-K14448866	BRD-K14448866-001-05-2	Asinex Ltd.	BAS 08205593			O=C(CN1CCCC1)Nc1ccc(Oc2ccc(NC(=O)CN3CCCC3)cc2)cc1	InChI=1S/C24H30N4O3/c29-23(17-27-13-1-2-14-27)25-19-5-9-21(10-6-19)31-22-11-7-20(8-12-22)26-24(30)18-28-15-3-4-16-28/h5-12H,1-4,13-18H2,(H,25,29)(H,26,30)	TYFPXMFXJNYUAA-UHFFFAOYSA-N	422.23179086							112824
AC1OBJ05	LSM-24235	BRD-K23765452	6823871	InChI=1S/C23H19N3O2/c27-19-12-13-20(23(28)15-19)22(26-25-17-7-2-1-3-8-17)14-18-11-10-16-6-4-5-9-21(16)24-18/h1-13,15,25,27-28H,14H2	DXRYKMNCIXCBDS-UHFFFAOYSA-N	Oc1ccc(C(=NNc2ccccc2)Cc3ccc4ccccc4n3)c(O)c1	BroadT	BRD-K23765452	BRD-K23765452-001-06-6	Enamine Ltd.	T0509-9928			Oc1ccc(C(Cc2ccc3ccccc3n2)=NNc2ccccc2)c(O)c1	InChI=1S/C23H19N3O2/c27-19-12-13-20(23(28)15-19)22(26-25-17-7-2-1-3-8-17)14-18-11-10-16-6-4-5-9-21(16)24-18/h1-13,15,25,27-28H,14H2	DXRYKMNCIXCBDS-UHFFFAOYSA-N	369.147726878							
4-(1,3-Dioxobenzo[de]isoquinolin-2-yl)-n-(1,1-dioxothiolan-3-yl)butanamide	LSM-24236	SID24784669, BRD-A01645361	2888346	InChI=1S/C20H20N2O5S/c23-17(21-14-9-11-28(26,27)12-14)8-3-10-22-19(24)15-6-1-4-13-5-2-7-16(18(13)15)20(22)25/h1-2,4-7,14H,3,8-12H2,(H,21,23)	TYXUHCSEWITPJD-UHFFFAOYSA-N	O=C(CCCN1C(=O)c2cccc3cccc(C1=O)c23)NC4CCS(=O)(=O)C4	BroadT	BRD-A01645361	BRD-A01645361-001-05-0	Asinex Ltd.	BAS 01259519			O=C(CCCN1C(=O)c2cccc3cccc(C1=O)c23)NC1CCS(=O)(=O)C1	InChI=1S/C20H20N2O5S/c23-17(21-14-9-11-28(26,27)12-14)8-3-10-22-19(24)15-6-1-4-13-5-2-7-16(18(13)15)20(22)25/h1-2,4-7,14H,3,8-12H2,(H,21,23)	TYXUHCSEWITPJD-UHFFFAOYSA-N	400.10929245							112826
ZINC02316656	LSM-24237	SID49817164, BRD-K27265892	1933244	InChI=1S/C13H10BrN3O3S/c14-9-5-3-8(4-6-9)11(18)15-13(21)17-16-12(19)10-2-1-7-20-10/h1-7H,(H,16,19)(H2,15,17,18,21)	XENIXRYNSKYFDO-UHFFFAOYSA-N	Brc1ccc(cc1)C(=O)NC(=S)NNC(=O)c2occc2	BroadT	BRD-K27265892	BRD-K27265892-001-06-1	InterBioScreen Ltd.	STOCK2S-75915			Brc1ccc(cc1)C(=O)NC(=S)NNC(=O)c1ccco1	InChI=1S/C13H10BrN3O3S/c14-9-5-3-8(4-6-9)11(18)15-13(21)17-16-12(19)10-2-1-7-20-10/h1-7H,(H,16,19)(H2,15,17,18,21)	XENIXRYNSKYFDO-UHFFFAOYSA-N	366.9626245							112827
AC1MQJII	LSM-24238	BRD-K09380392	3452773	InChI=1S/C18H20N4O4S/c1-11-8-12(2)14-4-3-5-16(15(14)9-11)20-21-17-7-6-13(27(19,25)26)10-18(17)22(23)24/h6-10,21H,3-5H2,1-2H3,(H2,19,25,26)	PMZBGUZHBSTEOQ-UHFFFAOYSA-N	Cc1cc(C)c2CCCC(=NNc3ccc(cc3[N+](=O)[O-])S(=O)(=O)N)c2c1	BroadT	BRD-K09380392	BRD-K09380392-001-05-7	Enamine Ltd.	T0509-7063			Cc1cc(C)c2CCCC(=NNc3ccc(cc3[N+]([O-])=O)S(N)(=O)=O)c2c1	InChI=1S/C18H20N4O4S/c1-11-8-12(2)14-4-3-5-16(15(14)9-11)20-21-17-7-6-13(27(19,25)26)10-18(17)22(23)24/h6-10,21H,3-5H2,1-2H3,(H2,19,25,26)	PMZBGUZHBSTEOQ-UHFFFAOYSA-N	388.12052585							112828
AC1NQAHP	LSM-24239	BRD-K06409014	5192927	InChI=1S/C14H19N3S/c1-10(2)15-14(18)17-16-13-9-5-7-11-6-3-4-8-12(11)13/h3-4,6,8,10H,5,7,9H2,1-2H3,(H2,15,17,18)	HBGKGHZTNYTFMD-UHFFFAOYSA-N	CC(C)N=C(S)NN=C1CCCc2ccccc12	BroadT	BRD-K06409014	BRD-K06409014-001-05-5	Enamine Ltd.	T0520-1842			CC(C)N=C(S)NN=C1CCCc2ccccc12	InChI=1S/C14H19N3S/c1-10(2)15-14(18)17-16-13-9-5-7-11-6-3-4-8-12(11)13/h3-4,6,8,10H,5,7,9H2,1-2H3,(H2,15,17,18)	HBGKGHZTNYTFMD-UHFFFAOYSA-N	261.129968328							112829
4-Methyl-n-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide	LSM-24240	SID24790149, BRD-K88901233	676913	InChI=1S/C11H11N3OS/c1-7-3-5-9(6-4-7)10(15)12-11-14-13-8(2)16-11/h3-6H,1-2H3,(H,12,14,15)	IKAJSLFVCPMOCD-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)Nc2nnc(C)s2	BroadT	BRD-K88901233	BRD-K88901233-001-06-5	Asinex Ltd.	BAS 00337532			Cc1nnc(NC(=O)c2ccc(C)cc2)s1	InChI=1S/C11H11N3OS/c1-7-3-5-9(6-4-7)10(15)12-11-14-13-8(2)16-11/h3-6H,1-2H3,(H,12,14,15)	IKAJSLFVCPMOCD-UHFFFAOYSA-N	233.062282692							112830
AC1NL38M	LSM-24241	BRD-K69022741	4898557	InChI=1S/C17H16N4O2/c1-11-7-8-12(2)13(9-11)10-18-20-17-19-15-6-4-3-5-14(15)16(22)21(17)23/h3-10,23H,1-2H3,(H,19,20)	IUDQGBJMAKMHPJ-UHFFFAOYSA-N	Cc1ccc(C)c(C=NNC2=Nc3ccccc3C(=O)N2O)c1	BroadT	BRD-K69022741	BRD-K69022741-001-04-3	InterBioScreen Ltd.	STOCK5S-56064			Cc1ccc(C)c(C=NNc2nc3ccccc3c(=O)n2O)c1	InChI=1S/C17H16N4O2/c1-11-7-8-12(2)13(9-11)10-18-20-17-19-15-6-4-3-5-14(15)16(22)21(17)23/h3-10,23H,1-2H3,(H,19,20)	IUDQGBJMAKMHPJ-UHFFFAOYSA-N	308.127325792							112831
HMS2573P12	LSM-24242	BRD-A86863764	12004608	InChI=1S/C20H18ClN3O5S/c1-28-15-7-6-12(8-16(15)29-11-13-4-2-3-5-14(13)21)10-22-24-20-23-19(27)17(30-20)9-18(25)26/h2-8,10,17H,9,11H2,1H3,(H,25,26)(H,23,24,27)	UDKPBBQVEDZQNJ-UHFFFAOYSA-N	COc1ccc(C=NNC2=NC(=O)C(CC(=O)O)S2)cc1OCc3ccccc3Cl	BroadT	BRD-A86863764	BRD-A86863764-001-05-0	ChemDiv Inc.	4405-0806			COc1ccc(C=NNC2=NC(=O)C(CC(O)=O)S2)cc1OCc1ccccc1Cl	InChI=1S/C20H18ClN3O5S/c1-28-15-7-6-12(8-16(15)29-11-13-4-2-3-5-14(13)21)10-22-24-20-23-19(27)17(30-20)9-18(25)26/h2-8,10,17H,9,11H2,1H3,(H,25,26)(H,23,24,27)	UDKPBBQVEDZQNJ-UHFFFAOYSA-N	447.065569106							112832
ASN 05115081	LSM-24243	SID14721243, BRD-K27473490	3195163	InChI=1S/C18H20N6O3S2/c1-4-27-16(26)8-13-9-28-17(19-13)20-15(25)10-29-18-21-22-23-24(18)14-6-5-11(2)7-12(14)3/h5-7,9H,4,8,10H2,1-3H3,(H,19,20,25)	GZVMDVGWBCXIBT-UHFFFAOYSA-N	CCOC(=O)Cc1csc(NC(=O)CSc2nnnn2c3ccc(C)cc3C)n1	BroadT	BRD-K27473490	BRD-K27473490-001-05-9	Asinex Ltd.	ASN 05115081			CCOC(=O)Cc1csc(NC(=O)CSc2nnnn2-c2ccc(C)cc2C)n1	InChI=1S/C18H20N6O3S2/c1-4-27-16(26)8-13-9-28-17(19-13)20-15(25)10-29-18-21-22-23-24(18)14-6-5-11(2)7-12(14)3/h5-7,9H,4,8,10H2,1-3H3,(H,19,20,25)	GZVMDVGWBCXIBT-UHFFFAOYSA-N	432.10382994							112833
STK580675	LSM-24244	SID17505874, BRD-K08134664	1952606	InChI=1S/C17H15N3O3S/c1-21-13-5-2-11(3-6-13)16-18-19-17(24)20(16)12-4-7-14-15(10-12)23-9-8-22-14/h2-7,10H,8-9H2,1H3,(H,19,24)	XRILWMTYPAJTEF-UHFFFAOYSA-N	COc1ccc(cc1)c2nnc(S)n2c3ccc4OCCOc4c3	BroadT	BRD-K08134664	BRD-K08134664-001-05-0	InterBioScreen Ltd.	STOCK5S-51394			COc1ccc(cc1)-c1nnc(S)n1-c1ccc2OCCOc2c1	InChI=1S/C17H15N3O3S/c1-21-13-5-2-11(3-6-13)16-18-19-17(24)20(16)12-4-7-14-15(10-12)23-9-8-22-14/h2-7,10H,8-9H2,1H3,(H,19,24)	XRILWMTYPAJTEF-UHFFFAOYSA-N	341.08341206							112834
ST046865	LSM-24245	SID24788034, BRD-K12731292	671729	InChI=1S/C19H12N2O3S/c22-17(16-7-4-10-25-16)20-12-8-9-14-15(11-12)19(24)21(18(14)23)13-5-2-1-3-6-13/h1-11H,(H,20,22)	ODKFYEBYGOSHQC-UHFFFAOYSA-N	O=C(Nc1ccc2C(=O)N(C(=O)c2c1)c3ccccc3)c4cccs4	BroadT	BRD-K12731292	BRD-K12731292-001-05-7	Specs	AG-205/10702043			O=C(Nc1ccc2C(=O)N(C(=O)c2c1)c1ccccc1)c1cccs1	InChI=1S/C19H12N2O3S/c22-17(16-7-4-10-25-16)20-12-8-9-14-15(11-12)19(24)21(18(14)23)13-5-2-1-3-6-13/h1-11H,(H,20,22)	ODKFYEBYGOSHQC-UHFFFAOYSA-N	348.056862954							112835
4-(2-Amino ethyl)benzene sulfonamide	LSM-6551	4-(2-Amino-Ethyl)-Benzenesulfonamide, 4-(2-Aminoethyl)Benzenesulfonamide, BRD-K14643723	169682	InChI=1S/C8H12N2O2S/c9-6-5-7-1-3-8(4-2-7)13(10,11)12/h1-4H,5-6,9H2,(H2,10,11,12)	FXNSVEQMUYPYJS-UHFFFAOYSA-N	NCCc1ccc(cc1)S(=O)(=O)N	BroadT	BRD-K14643723	BRD-K14643723-001-06-9	Enamine Ltd.	T0400-1594			NCCc1ccc(cc1)S(N)(=O)=O	InChI=1S/C8H12N2O2S/c9-6-5-7-1-3-8(4-2-7)13(10,11)12/h1-4H,5-6,9H2,(H2,10,11,12)	FXNSVEQMUYPYJS-UHFFFAOYSA-N	200.061948334							
STK236466	LSM-24246	SID14738539, BRD-K63811550	6041430	InChI=1S/C18H16BrN3O3/c1-10-4-3-5-11(2)17(10)25-9-15(23)21-22-16-13-8-12(19)6-7-14(13)20-18(16)24/h3-8,20,24H,9H2,1-2H3	LMQLBFGGBUCAPF-UHFFFAOYSA-N	Cc1cccc(C)c1OCC(=O)N=Nc2c(O)[nH]c3ccc(Br)cc23	BroadT	BRD-K63811550	BRD-K63811550-001-06-0	ChemDiv Inc.	3235-0102			Cc1cccc(C)c1OCC(=O)N=Nc1c(O)[nH]c2ccc(Br)cc12	InChI=1S/C18H16BrN3O3/c1-10-4-3-5-11(2)17(10)25-9-15(23)21-22-16-13-8-12(19)6-7-14(13)20-18(16)24/h3-8,20,24H,9H2,1-2H3	LMQLBFGGBUCAPF-UHFFFAOYSA-N	401.037504002							
MLS-0247663.0001	LSM-15361	BRD-K75725569	2371441	InChI=1S/C20H23N3O2/c1-3-23(4-2)12-11-21-20(24)16-14-18(19-10-7-13-25-19)22-17-9-6-5-8-15(16)17/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,21,24)	RZITUCUOASIYJR-UHFFFAOYSA-N	CCN(CC)CCNC(=O)c1cc(nc2ccccc12)c3occc3	BroadT	BRD-K75725569	BRD-K75725569-003-05-5	Enamine Ltd.	T0506-7926		Cl	CCN(CC)CCNC(=O)c1cc(nc2ccccc12)-c1ccco1.Cl	InChI=1S/C20H23N3O2.ClH/c1-3-23(4-2)12-11-21-20(24)16-14-18(19-10-7-13-25-19)22-17-9-6-5-8-15(16)17;/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,21,24);1H	ISMSASIBTXZSRX-UHFFFAOYSA-N	337.179027006							104007, 104007
F0655-1147	LSM-24247	SID14736227, BRD-A82563482	9550850	InChI=1S/C25H36N4OS/c1-20(26-25(30)27-22-11-6-3-7-12-22)24(23-13-8-18-31-23)29-16-14-28(15-17-29)19-21-9-4-2-5-10-21/h2,4-5,8-10,13,18,20,22,24H,3,6-7,11-12,14-17,19H2,1H3,(H2,26,27,30)	ZVJFLTLRDFVZJN-UHFFFAOYSA-N	CC(NC(=O)NC1CCCCC1)C(N2CCN(Cc3ccccc3)CC2)c4cccs4	BroadT	BRD-A82563482	BRD-A82563482-001-05-1	Life Chemicals Inc.	F0655-1147			CC(NC(=O)NC1CCCCC1)C(N1CCN(Cc2ccccc2)CC1)c1cccs1	InChI=1S/C25H36N4OS/c1-20(26-25(30)27-22-11-6-3-7-12-22)24(23-13-8-18-31-23)29-16-14-28(15-17-29)19-21-9-4-2-5-10-21/h2,4-5,8-10,13,18,20,22,24H,3,6-7,11-12,14-17,19H2,1H3,(H2,26,27,30)	ZVJFLTLRDFVZJN-UHFFFAOYSA-N	440.260982502							112837
MLS000730554	LSM-24248	SID24810587, BRD-K04419523	16193157	InChI=1S/C18H20N4O3/c23-18(20-16-5-7-17(8-6-16)22(24)25)19-10-12-21-11-9-14-3-1-2-4-15(14)13-21/h1-8H,9-13H2,(H2,19,20,23)	NCSSTRALCUMWTF-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NC(=O)NCCN2CCc3ccccc3C2)cc1	BroadT	BRD-K04419523	BRD-K04419523-001-05-0	ChemDiv Inc.	C270-0251			[O-][N+](=O)c1ccc(NC(=O)NCCN2CCc3ccccc3C2)cc1	InChI=1S/C18H20N4O3/c23-18(20-16-5-7-17(8-6-16)22(24)25)19-10-12-21-11-9-14-3-1-2-4-15(14)13-21/h1-8H,9-13H2,(H2,19,20,23)	NCSSTRALCUMWTF-UHFFFAOYSA-N	340.15354054							112838
ST50169543	LSM-24249	SID24788520, BRD-K62243466	1258313	InChI=1S/C20H15N3O6/c1-28-16-11-14(23(26)27)9-13-10-15(20(25)29-17(13)16)19(24)22-8-7-21-18(22)12-5-3-2-4-6-12/h2-6,9-11H,7-8H2,1H3	OOHNVEGKWVEJGY-UHFFFAOYSA-N	COc1cc(cc2C=C(C(=O)N3CCN=C3c4ccccc4)C(=O)Oc12)[N+](=O)[O-]	BroadT	BRD-K62243466	BRD-K62243466-001-05-2	ChemBridge Corporation	7985856			COc1cc(cc2cc(C(=O)N3CCN=C3c3ccccc3)c(=O)oc12)[N+]([O-])=O	InChI=1S/C20H15N3O6/c1-28-16-11-14(23(26)27)9-13-10-15(20(25)29-17(13)16)19(24)22-8-7-21-18(22)12-5-3-2-4-6-12/h2-6,9-11H,7-8H2,1H3	OOHNVEGKWVEJGY-UHFFFAOYSA-N	393.09608523							112839
MLS000122473	LSM-24250	SID14722123, BRD-K38995169	1084667	InChI=1S/C19H13FN4O/c20-15-6-2-1-5-14(15)19(25)22-13-7-8-16-17(10-13)24-18(23-16)12-4-3-9-21-11-12/h1-11H,(H,22,25)(H,23,24)	RCXGQDPHZKTBKW-UHFFFAOYSA-N	Fc1ccccc1C(=O)Nc2ccc3[nH]c(nc3c2)c4cccnc4	BroadT	BRD-K38995169	BRD-K38995169-001-06-6	Asinex Ltd.	BAS 06347342			Fc1ccccc1C(=O)Nc1ccc2[nH]c(nc2c1)-c1cccnc1	InChI=1S/C19H13FN4O/c20-15-6-2-1-5-14(15)19(25)22-13-7-8-16-17(10-13)24-18(23-16)12-4-3-9-21-11-12/h1-11H,(H,22,25)(H,23,24)	RCXGQDPHZKTBKW-UHFFFAOYSA-N	332.107339276							112840
MLS000042515	LSM-24251	SID865635, BRD-K08944434	666894	InChI=1S/C10H11ClN4O2/c11-6-5-7(15-1-3-16-4-2-15)8(12)10-9(6)13-17-14-10/h5H,1-4,12H2	JRWLTKVLNIYLIT-UHFFFAOYSA-N	Nc1c(cc(Cl)c2nonc12)N3CCOCC3	BroadT	BRD-K08944434	BRD-K08944434-001-05-1	InterBioScreen Ltd.	STOCK5S-48643			Nc1c(cc(Cl)c2nonc12)N1CCOCC1	InChI=1S/C10H11ClN4O2/c11-6-5-7(15-1-3-16-4-2-15)8(12)10-9(6)13-17-14-10/h5H,1-4,12H2	JRWLTKVLNIYLIT-UHFFFAOYSA-N	254.057053342							112841
CID_644922	LSM-24252	BRD-A27401261	74756946	InChI=1S/C22H23NO4S2/c1-13-19(22(25)27-7-6-26-2)20(14-5-9-28-12-14)21-16(23-13)10-15(11-17(21)24)18-4-3-8-29-18/h3-5,8-9,12,15,19-20H,6-7,10-11H2,1-2H3	FPCYLUGIMOLHKM-UHFFFAOYSA-N	COCCOC(=O)C1C(C2=C(CC(CC2=O)c3cccs3)N=C1C)c4ccsc4	BroadT	BRD-A27401261	BRD-A27401261-001-05-9	Asinex Ltd.	BAS 04379439			COCCOC(=O)C1C(c2ccsc2)C2=C(CC(CC2=O)c2cccs2)N=C1C	InChI=1S/C22H23NO4S2/c1-13-19(22(25)27-7-6-26-2)20(14-5-9-28-12-14)21-16(23-13)10-15(11-17(21)24)18-4-3-8-29-18/h3-5,8-9,12,15,19-20H,6-7,10-11H2,1-2H3	FPCYLUGIMOLHKM-UHFFFAOYSA-N	429.106849606							112842
2-Hydroxy-2-pentyl-n'-phenylheptanehydrazide	LSM-24253	SID14742309, BRD-K51988167	3799671	InChI=1S/C18H30N2O2/c1-3-5-10-14-18(22,15-11-6-4-2)17(21)20-19-16-12-8-7-9-13-16/h7-9,12-13,19,22H,3-6,10-11,14-15H2,1-2H3,(H,20,21)	WZVCYCPXUQPZCM-UHFFFAOYSA-N	CCCCCC(O)(CCCCC)C(=O)NNc1ccccc1	BroadT	BRD-K51988167	BRD-K51988167-001-05-7	InterBioScreen Ltd.	STOCK2S-41000			CCCCCC(O)(CCCCC)C(=O)NNc1ccccc1	InChI=1S/C18H30N2O2/c1-3-5-10-14-18(22,15-11-6-4-2)17(21)20-19-16-12-8-7-9-13-16/h7-9,12-13,19,22H,3-6,10-11,14-15H2,1-2H3,(H,20,21)	WZVCYCPXUQPZCM-UHFFFAOYSA-N	306.23072822							112843
MLS000391760	LSM-44035	SID22408622, BRD-K72545968	6162602	InChI=1S/C19H20N4O/c1-13-5-6-14-10-15(11-16(12-20)18(21)24)19(22-17(14)9-13)23-7-3-2-4-8-23/h5-6,9-11H,2-4,7-8H2,1H3,(H2,21,24)/b16-11+	AAISUDVSXFOHOW-LFIBNONCSA-N	Cc1ccc2cc(\C=C(/C#N)\C(=O)N)c(nc2c1)N3CCCCC3	BroadT	BRD-K72545968	BRD-K72545968-001-06-9	Enamine Ltd.	T0505-4729			Cc1ccc2cc(\C=C(/C#N)C(N)=O)c(nc2c1)N1CCCCC1	InChI=1S/C19H20N4O/c1-13-5-6-14-10-15(11-16(12-20)18(21)24)19(22-17(14)9-13)23-7-3-2-4-8-23/h5-6,9-11H,2-4,7-8H2,1H3,(H2,21,24)/b16-11+	AAISUDVSXFOHOW-LFIBNONCSA-N	320.1637113							
SMR000017895	LSM-24255	SID7971001, BRD-A31907989	4569772	InChI=1S/C19H19N5OS2/c25-18-17(27-19-20-13-21-24(18)19)16(15-7-4-12-26-15)23-10-8-22(9-11-23)14-5-2-1-3-6-14/h1-7,12-13,16,25H,8-11H2	CYRXMHKMPVFLBA-UHFFFAOYSA-N	Oc1c(sc2ncnn12)C(N3CCN(CC3)c4ccccc4)c5cccs5	BroadT	BRD-A31907989	BRD-A31907989-001-05-0	Life Chemicals Inc.	F1805-0315			Oc1c(sc2ncnn12)C(N1CCN(CC1)c1ccccc1)c1cccs1	InChI=1S/C19H19N5OS2/c25-18-17(27-19-20-13-21-24(18)19)16(15-7-4-12-26-15)23-10-8-22(9-11-23)14-5-2-1-3-6-14/h1-7,12-13,16,25H,8-11H2	CYRXMHKMPVFLBA-UHFFFAOYSA-N	397.103101658							112845
MLS000331587	LSM-44036	SID17513727, BRD-A28936006	6145722	InChI=1S/C12H12N2O3S2/c1-7(11(16)17)14-10(15)9(19-12(14)18)6-8-4-3-5-13(8)2/h3-7H,1-2H3,(H,16,17)/b9-6-	FKAZWCQRSJHSCC-TWGQIWQCSA-N	CC(N1C(=S)S\C(=C/c2cccn2C)\C1=O)C(=O)O	BroadT	BRD-A28936006	BRD-A28936006-001-04-6	InterBioScreen Ltd.	STOCK4S-98679			CC(N1C(=S)S\C(=C/c2cccn2C)C1=O)C(O)=O	InChI=1S/C12H12N2O3S2/c1-7(11(16)17)14-10(15)9(19-12(14)18)6-8-4-3-5-13(8)2/h3-7H,1-2H3,(H,16,17)/b9-6-	FKAZWCQRSJHSCC-TWGQIWQCSA-N	296.028933644							
SMR000248777	LSM-24257	SID17516008, BRD-K51456536	4530657	InChI=1S/C26H20FN5O6/c27-18-7-9-19(10-8-18)38-21-11-6-17(14-20(21)32(36)37)23-28-24-22(30(23)12-13-33)25(34)29-26(35)31(24)15-16-4-2-1-3-5-16/h1-11,14,33H,12-13,15H2,(H,29,34,35)	KYFFKLBLUZKIOW-UHFFFAOYSA-N	OCCn1c(nc2N(Cc3ccccc3)C(=O)NC(=O)c12)c4ccc(Oc5ccc(F)cc5)c(c4)[N+](=O)[O-]	BroadT	BRD-K51456536	BRD-K51456536-001-05-9	Enamine Ltd.	T5239599			OCCn1c(nc2n(Cc3ccccc3)c(=O)[nH]c(=O)c12)-c1ccc(Oc2ccc(F)cc2)c(c1)[N+]([O-])=O	InChI=1S/C26H20FN5O6/c27-18-7-9-19(10-8-18)38-21-11-6-17(14-20(21)32(36)37)23-28-24-22(30(23)12-13-33)25(34)29-26(35)31(24)15-16-4-2-1-3-5-16/h1-11,14,33H,12-13,15H2,(H,29,34,35)	KYFFKLBLUZKIOW-UHFFFAOYSA-N	517.13976161							112847
SMR000180654	LSM-24258	SID17402848, BRD-K39715175	1474967	InChI=1S/C16H15N5/c17-10-12-11-18-21-14-7-3-2-6-13(14)16(19-15(12)21)20-8-4-1-5-9-20/h2-3,6-7,11H,1,4-5,8-9H2	GGAOILGQGKKKOA-UHFFFAOYSA-N	N#Cc1cnn2c3ccccc3c(nc12)N4CCCCC4	BroadT	BRD-K39715175	BRD-K39715175-001-06-9	Key Organics Ltd.	11N-519S			N#Cc1cnn2c1nc(N1CCCCC1)c1ccccc21	InChI=1S/C16H15N5/c17-10-12-11-18-21-14-7-3-2-6-13(14)16(19-15(12)21)20-8-4-1-5-9-20/h2-3,6-7,11H,1,4-5,8-9H2	GGAOILGQGKKKOA-UHFFFAOYSA-N	277.13274553							112848
F0656-0591	LSM-24259	SID7971106, BRD-A71838263	5310383	InChI=1S/C17H18N6O3/c24-14(18-9-13-7-4-8-26-13)10-22-11-19-16-15(17(22)25)20-21-23(16)12-5-2-1-3-6-12/h1-3,5-6,11,13H,4,7-10H2,(H,18,24)	NEDWIKFMEFVLJK-UHFFFAOYSA-N	O=C(CN1C=Nc2c(nnn2c3ccccc3)C1=O)NCC4CCCO4	BroadT	BRD-A71838263	BRD-A71838263-001-05-5	Life Chemicals Inc.	F0656-0591			O=C(Cn1cnc2n(nnc2c1=O)-c1ccccc1)NCC1CCCO1	InChI=1S/C17H18N6O3/c24-14(18-9-13-7-4-8-26-13)10-22-11-19-16-15(17(22)25)20-21-23(16)12-5-2-1-3-6-12/h1-3,5-6,11,13H,4,7-10H2,(H,18,24)	NEDWIKFMEFVLJK-UHFFFAOYSA-N	354.144038496							112849
BAS 05115494	LSM-24260	SID49646730, BRD-K53698438	1078044	InChI=1S/C19H20N6O2S/c1-3-14-4-10-17(11-5-14)25-19(22-23-24-25)28-12-18(27)21-16-8-6-15(7-9-16)20-13(2)26/h4-11H,3,12H2,1-2H3,(H,20,26)(H,21,27)	UFQMMFCIGWSKDO-UHFFFAOYSA-N	CCc1ccc(cc1)n2nnnc2SCC(=O)Nc3ccc(NC(=O)C)cc3	BroadT	BRD-K53698438	BRD-K53698438-001-07-9	Asinex Ltd.	BAS 05115494			CCc1ccc(cc1)-n1nnnc1SCC(=O)Nc1ccc(NC(C)=O)cc1	InChI=1S/C19H20N6O2S/c1-3-14-4-10-17(11-5-14)25-19(22-23-24-25)28-12-18(27)21-16-8-6-15(7-9-16)20-13(2)26/h4-11H,3,12H2,1-2H3,(H,20,26)(H,21,27)	UFQMMFCIGWSKDO-UHFFFAOYSA-N	396.13684463							112850
MLS000720337	LSM-24261	SID22401555, BRD-K30625361	7109977	InChI=1S/C14H7F2N3S2/c15-7-3-1-5-9-11(7)17-13(20-9)19-14-18-12-8(16)4-2-6-10(12)21-14/h1-6H,(H,17,18,19)	XWIBJZAZVONZEX-UHFFFAOYSA-N	Fc1cccc2sc(Nc3nc4c(F)cccc4s3)nc12	BroadT	BRD-K30625361	BRD-K30625361-001-05-5	Life Chemicals Inc.	F0646-1827			Fc1cccc2sc(Nc3nc4c(F)cccc4s3)nc12	InChI=1S/C14H7F2N3S2/c15-7-3-1-5-9-11(7)17-13(20-9)19-14-18-12-8(16)4-2-6-10(12)21-14/h1-6H,(H,17,18,19)	XWIBJZAZVONZEX-UHFFFAOYSA-N	319.004945034							112851
AC1LDASP	LSM-24262	BRD-A94698726, SID26514052, SID862810	664043	InChI=1S/C16H15N5O2/c17-15-18-16(19-21(15)10-6-2-1-3-7-10)20-13(22)11-8-4-5-9-12(11)14(20)23/h1-7,11-12H,8-9H2,(H2,17,18,19)	BRQJUXMVCVVPRO-UHFFFAOYSA-N	Nc1nc(nn1c2ccccc2)N3C(=O)C4CC=CCC4C3=O	BroadT	BRD-A94698726	BRD-A94698726-001-05-7	InterBioScreen Ltd.	STOCK4S-56194			Nc1nc(nn1-c1ccccc1)N1C(=O)C2CC=CCC2C1=O	InChI=1S/C16H15N5O2/c17-15-18-16(19-21(15)10-6-2-1-3-7-10)20-13(22)11-8-4-5-9-12(11)14(20)23/h1-7,11-12H,8-9H2,(H2,17,18,19)	BRQJUXMVCVVPRO-UHFFFAOYSA-N	309.12257477							112852
S-(4-Methylphenyl) 2-Methyl-4-(Trifluoromethyl)-1,3-Thiazole-5-Carbothioate	LSM-24263	SID26729816, BRD-K58548575	2746835	InChI=1S/C13H10F3NOS2/c1-7-3-5-9(6-4-7)20-12(18)10-11(13(14,15)16)17-8(2)19-10/h3-6H,1-2H3	YSFAXDHDPRZXTB-UHFFFAOYSA-N	Cc1ccc(SC(=O)c2sc(C)nc2C(F)(F)F)cc1	BroadT	BRD-K58548575	BRD-K58548575-001-07-4	Maybridge	SPB 07343			Cc1nc(c(s1)C(=O)Sc1ccc(C)cc1)C(F)(F)F	InChI=1S/C13H10F3NOS2/c1-7-3-5-9(6-4-7)20-12(18)10-11(13(14,15)16)17-8(2)19-10/h3-6H,1-2H3	YSFAXDHDPRZXTB-UHFFFAOYSA-N	317.01558993							112853
MLS000325821	LSM-24264	SID17402139, BRD-K60616450	3846667	InChI=1S/C16H12ClN3O2/c1-21-14-10-19-15(12-7-4-5-9-18-12)20-16(14)22-13-8-3-2-6-11(13)17/h2-10H,1H3	QFEGXSKDDPDKHS-UHFFFAOYSA-N	COc1cnc(nc1Oc2ccccc2Cl)c3ccccn3	BroadT	BRD-K60616450	BRD-K60616450-001-06-7	Key Organics Ltd.	2J-326S			COc1cnc(nc1Oc1ccccc1Cl)-c1ccccn1	InChI=1S/C16H12ClN3O2/c1-21-14-10-19-15(12-7-4-5-9-18-12)20-16(14)22-13-8-3-2-6-11(13)17/h2-10H,1H3	QFEGXSKDDPDKHS-UHFFFAOYSA-N	313.061804364							112854
T0517-0847	LSM-24265	SID24833077, BRD-K56809119	4145119	InChI=1S/C22H20N2O2/c25-21-14-8-7-13-20(21)22(26)24-23-19(15-17-9-3-1-4-10-17)16-18-11-5-2-6-12-18/h1-14,25H,15-16H2,(H,24,26)	QFVJHYPEYPPEOO-UHFFFAOYSA-N	Oc1ccccc1C(=O)NN=C(Cc2ccccc2)Cc3ccccc3	BroadT	BRD-K56809119	BRD-K56809119-001-05-9	Enamine Ltd.	T0517-0847			Oc1ccccc1C(=O)NN=C(Cc1ccccc1)Cc1ccccc1	InChI=1S/C22H20N2O2/c25-21-14-8-7-13-20(21)22(26)24-23-19(15-17-9-3-1-4-10-17)16-18-11-5-2-6-12-18/h1-14,25H,15-16H2,(H,24,26)	QFVJHYPEYPPEOO-UHFFFAOYSA-N	344.1524779							112855
SMR000023412	LSM-24266	SID4245912, BRD-K18880161	3240323	InChI=1S/C23H21ClN4O4/c1-14-10-22(26-28(14)13-15-4-6-16(24)7-5-15)25-23(29)19-12-21(32-27-19)18-11-17(30-2)8-9-20(18)31-3/h4-12H,13H2,1-3H3,(H,25,26,29)	NOUHCOWSAORKNW-UHFFFAOYSA-N	COc1ccc(OC)c(c1)c2onc(c2)C(=O)Nc3cc(C)n(Cc4ccc(Cl)cc4)n3	BroadT	BRD-K18880161	BRD-K18880161-001-05-4	ChemDiv Inc.	C226-1703			COc1ccc(OC)c(c1)-c1cc(no1)C(=O)Nc1cc(C)n(Cc2ccc(Cl)cc2)n1	InChI=1S/C23H21ClN4O4/c1-14-10-22(26-28(14)13-15-4-6-16(24)7-5-15)25-23(29)19-12-21(32-27-19)18-11-17(30-2)8-9-20(18)31-3/h4-12H,13H2,1-3H3,(H,25,26,29)	NOUHCOWSAORKNW-UHFFFAOYSA-N	452.125132902							112856
AC1LJBMI	LSM-24267	BRD-K13987706	920434	InChI=1S/C12H11N5O3/c1-16-11(6-7-14-16)12(18)15-13-8-9-4-2-3-5-10(9)17(19)20/h2-8H,1H3,(H,15,18)	NQTWYHFMDIQHNF-UHFFFAOYSA-N	Cn1nccc1C(=O)NN=Cc2ccccc2[N+](=O)[O-]	BroadT	BRD-K13987706	BRD-K13987706-001-05-4	InterBioScreen Ltd.	STOCK2S-23221			Cn1nccc1C(=O)NN=Cc1ccccc1[N+]([O-])=O	InChI=1S/C12H11N5O3/c1-16-11(6-7-14-16)12(18)15-13-8-9-4-2-3-5-10(9)17(19)20/h2-8H,1H3,(H,15,18)	NQTWYHFMDIQHNF-UHFFFAOYSA-N	273.086189262							112857
MLS000040829	LSM-24268	SID863603, BRD-K73732735	664852	InChI=1S/C18H16N4O2/c1-3-22-17-13(10-12-7-6-11(2)9-14(12)19-17)16(21-22)20-18(23)15-5-4-8-24-15/h4-10H,3H2,1-2H3,(H,20,21,23)	OPWCPOLKIVKSBG-UHFFFAOYSA-N	CCn1nc(NC(=O)c2occc2)c3cc4ccc(C)cc4nc13	BroadT	BRD-K73732735	BRD-K73732735-001-05-6	InterBioScreen Ltd.	STOCK4S-77178			CCn1nc(NC(=O)c2ccco2)c2cc3ccc(C)cc3nc12	InChI=1S/C18H16N4O2/c1-3-22-17-13(10-12-7-6-11(2)9-14(12)19-17)16(21-22)20-18(23)15-5-4-8-24-15/h4-10H,3H2,1-2H3,(H,20,21,23)	OPWCPOLKIVKSBG-UHFFFAOYSA-N	320.127325792							112858
SMR000004347	LSM-24269	SID843917, BRD-K10175503	646225	InChI=1S/C26H26N6O2/c1-2-19-10-11-24-21(13-19)14-22(26(33)27-24)16-31(15-20-7-4-3-5-8-20)18-25-28-29-30-32(25)17-23-9-6-12-34-23/h3-14H,2,15-18H2,1H3,(H,27,33)	JINCUPVACKAPQS-UHFFFAOYSA-N	CCc1ccc2nc(O)c(CN(Cc3ccccc3)Cc4nnnn4Cc5occc5)cc2c1	BroadT	BRD-K10175503	BRD-K10175503-001-05-4	Asinex Ltd.	ASN 05297992			CCc1ccc2nc(O)c(CN(Cc3nnnn3Cc3ccco3)Cc3ccccc3)cc2c1	InChI=1S/C26H26N6O2/c1-2-19-10-11-24-21(13-19)14-22(26(33)27-24)16-31(15-20-7-4-3-5-8-20)18-25-28-29-30-32(25)17-23-9-6-12-34-23/h3-14H,2,15-18H2,1H3,(H,27,33)	JINCUPVACKAPQS-UHFFFAOYSA-N	454.211724132							112859
BAS 04380256	LSM-24270	SID24805752, BRD-K59180040	804732	InChI=1S/C17H16N2O4/c1-10(2)9-19-16(21)12-6-5-11(8-13(12)17(19)22)18-15(20)14-4-3-7-23-14/h3-8,10H,9H2,1-2H3,(H,18,20)	XNNCLZGGVOMKIW-UHFFFAOYSA-N	CC(C)CN1C(=O)c2ccc(NC(=O)c3occc3)cc2C1=O	BroadT	BRD-K59180040	BRD-K59180040-001-05-6	Asinex Ltd.	BAS 04380256			CC(C)CN1C(=O)c2ccc(NC(=O)c3ccco3)cc2C1=O	InChI=1S/C17H16N2O4/c1-10(2)9-19-16(21)12-6-5-11(8-13(12)17(19)22)18-15(20)14-4-3-7-23-14/h3-8,10H,9H2,1-2H3,(H,18,20)	XNNCLZGGVOMKIW-UHFFFAOYSA-N	312.111007012							112860
STK521162	LSM-24271	SID4240740, BRD-K06188726	3235810	InChI=1S/C14H16N4O2S/c1-3-11(19)15-10-8-6-5-7-9(10)12-13(20)16-14(18-17-12)21-4-2/h5-8H,3-4H2,1-2H3,(H,15,19)(H,16,18,20)	QNPNLHPXSNEMBO-UHFFFAOYSA-N	CCSc1nnc(c(O)n1)c2ccccc2NC(=O)CC	BroadT	BRD-K06188726	BRD-K06188726-001-06-2	ChemDiv Inc.	4896-4951			CCSc1nnc(c(O)n1)-c1ccccc1NC(=O)CC	InChI=1S/C14H16N4O2S/c1-3-11(19)15-10-8-6-5-7-9(10)12-13(20)16-14(18-17-12)21-4-2/h5-8H,3-4H2,1-2H3,(H,15,19)(H,16,18,20)	QNPNLHPXSNEMBO-UHFFFAOYSA-N	304.099396482							112861
BAS 06347369	LSM-24272	SID7965205, BRD-K57934161	1084671	InChI=1S/C17H12N4O2/c22-17(15-4-2-8-23-15)19-12-5-6-13-14(9-12)21-16(20-13)11-3-1-7-18-10-11/h1-10H,(H,19,22)(H,20,21)	JDZNTGMSMHYYCY-UHFFFAOYSA-N	O=C(Nc1ccc2[nH]c(nc2c1)c3cccnc3)c4occc4	BroadT	BRD-K57934161	BRD-K57934161-001-04-4	ChemDiv Inc.	6331-2987			O=C(Nc1ccc2[nH]c(nc2c1)-c1cccnc1)c1ccco1	InChI=1S/C17H12N4O2/c22-17(15-4-2-8-23-15)19-12-5-6-13-14(9-12)21-16(20-13)11-3-1-7-18-10-11/h1-10H,(H,19,22)(H,20,21)	JDZNTGMSMHYYCY-UHFFFAOYSA-N	304.096025664							112862
OPREA1_468775	LSM-44037	BRD-A85364257	11957307	InChI=1S/C29H28N2O6S/c1-5-35-24-16-21(13-15-23(24)37-19(4)32)17-25-27(33)31-22(14-12-20-10-8-7-9-11-20)26(28(34)36-6-2)18(3)30-29(31)38-25/h7-17,22H,5-6H2,1-4H3/b14-12+,25-17?	OJXJFHGWKNZSAB-CCRNXWHESA-N	CCOC(=O)C1=C(C)N=C2SC(=Cc3ccc(OC(=O)C)c(OCC)c3)C(=O)N2C1\C=C\c4ccccc4	BroadT	BRD-A85364257	BRD-A85364257-001-05-4	Asinex Ltd.	BAS 00778578			CCOC(=O)C1=C(C)N=c2sc(=Cc3ccc(OC(C)=O)c(OCC)c3)c(=O)n2C1\C=C\c1ccccc1	InChI=1S/C29H28N2O6S/c1-5-35-24-16-21(13-15-23(24)37-19(4)32)17-25-27(33)31-22(14-12-20-10-8-7-9-11-20)26(28(34)36-6-2)18(3)30-29(31)38-25/h7-17,22H,5-6H2,1-4H3/b14-12+,25-17?	OJXJFHGWKNZSAB-CCRNXWHESA-N	532.166807326							
ST50843211	LSM-24274	SID49816587, BRD-A50921700	2954221	InChI=1S/C15H19F2N3O3S/c1-9(23-13-5-4-10(16)7-12(13)17)14(21)19-20-15(24)18-8-11-3-2-6-22-11/h4-5,7,9,11H,2-3,6,8H2,1H3,(H,19,21)(H2,18,20,24)	WJKOSFMUFKSVNQ-UHFFFAOYSA-N	CC(Oc1ccc(F)cc1F)C(=O)NN=C(S)NCC2CCCO2	BroadT	BRD-A50921700	BRD-A50921700-001-05-5	ChemBridge Corporation	7784300			CC(Oc1ccc(F)cc1F)C(=O)NN=C(S)NCC1CCCO1	InChI=1S/C15H19F2N3O3S/c1-9(23-13-5-4-10(16)7-12(13)17)14(21)19-20-15(24)18-8-11-3-2-6-22-11/h4-5,7,9,11H,2-3,6,8H2,1H3,(H,19,21)(H2,18,20,24)	WJKOSFMUFKSVNQ-UHFFFAOYSA-N	359.111518588							112864
ZINC03304438	LSM-24275	SID26657519, BRD-K59776248	2420069	InChI=1S/C15H8Cl2N2O3/c16-7-4-5-10(17)9(6-7)14(21)19-13(20)8-2-1-3-11(18)12(8)15(19)22/h1-6H,18H2	ZOQLHFDIDRKDNM-UHFFFAOYSA-N	Nc1cccc2C(=O)N(C(=O)c3cc(Cl)ccc3Cl)C(=O)c12	BroadT	BRD-K59776248	BRD-K59776248-001-05-1	Enamine Ltd.	T0515-6851			Nc1cccc2C(=O)N(C(=O)c3cc(Cl)ccc3Cl)C(=O)c12	InChI=1S/C15H8Cl2N2O3/c16-7-4-5-10(17)9(6-7)14(21)19-13(20)8-2-1-3-11(18)12(8)15(19)22/h1-6H,18H2	ZOQLHFDIDRKDNM-UHFFFAOYSA-N	333.991197556							112865
T0515-3791	LSM-24276	SID22404588, BRD-K58610785	2411948	InChI=1S/C20H17FN2O4S2/c1-3-26-19(25)16-14(15-9-4-11(2)27-15)10-29-18(16)23-20(28)22-17(24)12-5-7-13(21)8-6-12/h4-10H,3H2,1-2H3,(H2,22,23,24,28)	MZEOTZUKMDFVAD-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(F)cc2)scc1c3oc(C)cc3	BroadT	BRD-K58610785	BRD-K58610785-001-05-2	Enamine Ltd.	T0515-3791			CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(F)cc2)scc1-c1ccc(C)o1	InChI=1S/C20H17FN2O4S2/c1-3-26-19(25)16-14(15-9-4-11(2)27-15)10-29-18(16)23-20(28)22-17(24)12-5-7-13(21)8-6-12/h4-10H,3H2,1-2H3,(H2,22,23,24,28)	MZEOTZUKMDFVAD-UHFFFAOYSA-N	432.061376624							112866
SMR000262223	LSM-44038	SID17516362, BRD-K52529335	2328634	InChI=1S/C27H28N4O3/c1-18(2)33-22-13-11-20(12-14-22)25-28-24(27(32)34-25)17-23-19(3)29-31(21-9-5-4-6-10-21)26(23)30-15-7-8-16-30/h4-6,9-14,17-18H,7-8,15-16H2,1-3H3/b24-17-	AECDMGQTJIORMB-ULJHMMPZSA-N	CC(C)Oc1ccc(cc1)C2=N\C(=C/c3c(C)nn(c4ccccc4)c3N5CCCC5)\C(=O)O2	BroadT	BRD-K52529335	BRD-K52529335-001-05-5	Enamine Ltd.	T0504-9094			CC(C)Oc1ccc(cc1)C1=N\C(=C/c2c(C)nn(c2N2CCCC2)-c2ccccc2)C(=O)O1	InChI=1S/C27H28N4O3/c1-18(2)33-22-13-11-20(12-14-22)25-28-24(27(32)34-25)17-23-19(3)29-31(21-9-5-4-6-10-21)26(23)30-15-7-8-16-30/h4-6,9-14,17-18H,7-8,15-16H2,1-3H3/b24-17-	AECDMGQTJIORMB-ULJHMMPZSA-N	456.216140796							
5-(2,3-Dihydro-1-benzofuran-5-yl)-3-(4-fluorophenyl)-1,2,4-oxadiazole	LSM-24278	SID26726764, BRD-K53930633	2810520	InChI=1S/C16H11FN2O2/c17-13-4-1-10(2-5-13)15-18-16(21-19-15)12-3-6-14-11(9-12)7-8-20-14/h1-6,9H,7-8H2	HQQNMHKTCREMRF-UHFFFAOYSA-N	Fc1ccc(cc1)c2noc(n2)c3ccc4OCCc4c3	BroadT	BRD-K53930633	BRD-K53930633-001-06-1	Maybridge	HTS 02105			Fc1ccc(cc1)-c1noc(n1)-c1ccc2OCCc2c1	InChI=1S/C16H11FN2O2/c17-13-4-1-10(2-5-13)15-18-16(21-19-15)12-3-6-14-11(9-12)7-8-20-14/h1-6,9H,7-8H2	HQQNMHKTCREMRF-UHFFFAOYSA-N	282.080455812							112868
3-Phenyl-5-[(phenylsulfanyl)methyl]isoxazole	LSM-24279	SID24820420, BRD-K35549037	1479588	InChI=1S/C16H13NOS/c1-3-7-13(8-4-1)16-11-14(18-17-16)12-19-15-9-5-2-6-10-15/h1-11H,12H2	ALOSNTJZINUQLV-UHFFFAOYSA-N	C(Sc1ccccc1)c2onc(c2)c3ccccc3	BroadT	BRD-K35549037	BRD-K35549037-001-06-4	Key Organics Ltd.	5M-335S			C(Sc1ccccc1)c1cc(no1)-c1ccccc1	InChI=1S/C16H13NOS/c1-3-7-13(8-4-1)16-11-14(18-17-16)12-19-15-9-5-2-6-10-15/h1-11H,12H2	ALOSNTJZINUQLV-UHFFFAOYSA-N	267.071784736							112869
AC1N09HY	LSM-24280	BRD-K27972424	3959352	InChI=1S/C15H12N4O2/c20-14(21)11-7-5-10(6-8-11)9-16-19-15-17-12-3-1-2-4-13(12)18-15/h1-9H,(H,20,21)(H2,17,18,19)	FRDPRSVGUKUCQI-UHFFFAOYSA-N	OC(=O)c1ccc(C=NNc2nc3ccccc3[nH]2)cc1	BroadT	BRD-K27972424	BRD-K27972424-001-06-9	Enamine Ltd.	T0512-4369			OC(=O)c1ccc(C=NNc2nc3ccccc3[nH]2)cc1	InChI=1S/C15H12N4O2/c20-14(21)11-7-5-10(6-8-11)9-16-19-15-17-12-3-1-2-4-13(12)18-15/h1-9H,(H,20,21)(H2,17,18,19)	FRDPRSVGUKUCQI-UHFFFAOYSA-N	280.096025664							112870
AC1MLKH7	LSM-24281	SID24809140, BRD-A60443603	3221230	InChI=1S/C15H25N3O2/c19-14(16-12-8-9-12)13-7-4-10-18(13)15(20)17-11-5-2-1-3-6-11/h11-13H,1-10H2,(H,16,19)(H,17,20)	UESJQIUZGYHHIC-UHFFFAOYSA-N	O=C(NC1CC1)C2CCCN2C(=O)NC3CCCCC3	BroadT	BRD-A60443603	BRD-A60443603-001-05-6	Asinex Ltd.	ASN 06482055			O=C(NC1CC1)C1CCCN1C(=O)NC1CCCCC1	InChI=1S/C15H25N3O2/c19-14(16-12-8-9-12)13-7-4-10-18(13)15(20)17-11-5-2-1-3-6-11/h11-13H,1-10H2,(H,16,19)(H,17,20)	UESJQIUZGYHHIC-UHFFFAOYSA-N	279.19467707							112871
2-[4-(4-Benzhydryl-piperazin-1-yl)-but-2-ynyl]-isoindole-1,3-dione	LSM-15362	BRD-K93973759	1714734	InChI=1S/C29H27N3O2/c33-28-25-15-7-8-16-26(25)29(34)32(28)18-10-9-17-30-19-21-31(22-20-30)27(23-11-3-1-4-12-23)24-13-5-2-6-14-24/h1-8,11-16,27H,17-22H2	ZKPJKSHEVMZRLW-UHFFFAOYSA-N	O=C1N(CC#CCN2CCN(CC2)C(c3ccccc3)c4ccccc4)C(=O)c5ccccc15	BroadT	BRD-K93973759	BRD-K93973759-003-06-7	Asinex Ltd.	BAS 00280457		Cl	O=C1N(CC#CCN2CCN(CC2)C(c2ccccc2)c2ccccc2)C(=O)c2ccccc12.Cl	InChI=1S/C29H27N3O2.ClH/c33-28-25-15-7-8-16-26(25)29(34)32(28)18-10-9-17-30-19-21-31(22-20-30)27(23-11-3-1-4-12-23)24-13-5-2-6-14-24;/h1-8,11-16,27H,17-22H2;1H	DPRPBCFTPBXFRT-UHFFFAOYSA-N	449.210327134							104008, 104008
T5254972	LSM-24282	SID3715247, BRD-A62985810	2999135	InChI=1S/C19H24N6O2S/c1-13-10-16(23-27-13)20-17(26)12-28-19-22-21-18(14(2)24(3)4)25(19)11-15-8-6-5-7-9-15/h5-10,14H,11-12H2,1-4H3,(H,20,23,26)	IOWSCODSLOWXSF-UHFFFAOYSA-N	CC(N(C)C)c1nnc(SCC(=O)Nc2cc(C)on2)n1Cc3ccccc3	BroadT	BRD-A62985810	BRD-A62985810-001-05-3	Enamine Ltd.	T5254972			CC(N(C)C)c1nnc(SCC(=O)Nc2cc(C)on2)n1Cc1ccccc1	InChI=1S/C19H24N6O2S/c1-13-10-16(23-27-13)20-17(26)12-28-19-22-21-18(14(2)24(3)4)25(19)11-15-8-6-5-7-9-15/h5-10,14H,11-12H2,1-4H3,(H,20,23,26)	IOWSCODSLOWXSF-UHFFFAOYSA-N	400.168144758							112872
MLS000395044	LSM-24283	SID17517277, BRD-K36215805	2353548	InChI=1S/C27H27N3O5S2/c1-4-30(5-2)37(33,34)22-13-9-20(10-14-22)27(32)35-17-25(31)28-21-11-7-19(8-12-21)26-29-23-15-6-18(3)16-24(23)36-26/h6-16H,4-5,17H2,1-3H3,(H,28,31)	PGGQXUGPYJVIRG-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)OCC(=O)Nc2ccc(cc2)c3nc4ccc(C)cc4s3	BroadT	BRD-K36215805	BRD-K36215805-001-05-3	Enamine Ltd.	T0506-0668			CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)OCC(=O)Nc1ccc(cc1)-c1nc2ccc(C)cc2s1	InChI=1S/C27H27N3O5S2/c1-4-30(5-2)37(33,34)22-13-9-20(10-14-22)27(32)35-17-25(31)28-21-11-7-19(8-12-21)26-29-23-15-6-18(3)16-24(23)36-26/h6-16H,4-5,17H2,1-3H3,(H,28,31)	PGGQXUGPYJVIRG-UHFFFAOYSA-N	537.139212374							112873
ZINC03217226	LSM-24284	SID14743865, BRD-K50700495	2335893	InChI=1S/C18H16F3N5O/c1-25(2)14-6-3-12(4-7-14)17(27)24-15-9-13(18(19,20)21)5-8-16(15)26-11-22-10-23-26/h3-11H,1-2H3,(H,24,27)	UPNQBCUWBKQRGE-UHFFFAOYSA-N	CN(C)c1ccc(cc1)C(=O)Nc2cc(ccc2n3cncn3)C(F)(F)F	BroadT	BRD-K50700495	BRD-K50700495-001-05-0	Enamine Ltd.	T0505-7968			CN(C)c1ccc(cc1)C(=O)Nc1cc(ccc1-n1cncn1)C(F)(F)F	InChI=1S/C18H16F3N5O/c1-25(2)14-6-3-12(4-7-14)17(27)24-15-9-13(18(19,20)21)5-8-16(15)26-11-22-10-23-26/h3-11H,1-2H3,(H,24,27)	UPNQBCUWBKQRGE-UHFFFAOYSA-N	375.130694782							112874
MLS000735352	LSM-24285	SID24800045, BRD-K09639531	16191714	InChI=1S/C17H20FN5O/c1-11-6-13(22-23(11)2)10-19-8-12-9-20-21-17(12)15-5-4-14(24-3)7-16(15)18/h4-7,9,19H,8,10H2,1-3H3,(H,20,21)	CWLGSQYVYJTBPN-UHFFFAOYSA-N	COc1ccc(c(F)c1)c2[nH]ncc2CNCc3cc(C)n(C)n3	BroadT	BRD-K09639531	BRD-K09639531-001-05-8	ChemBridge Corporation	13894243			COc1ccc(-c2[nH]ncc2CNCc2cc(C)n(C)n2)c(F)c1	InChI=1S/C17H20FN5O/c1-11-6-13(22-23(11)2)10-19-8-12-9-20-21-17(12)15-5-4-14(24-3)7-16(15)18/h4-7,9,19H,8,10H2,1-3H3,(H,20,21)	CWLGSQYVYJTBPN-UHFFFAOYSA-N	329.16518851							112875
MLS000325367	LSM-24286	SID17387450, BRD-K42394406	823976	InChI=1S/C11H9N3O4/c1-7-3-2-4-9(12-7)13-11(15)8-5-6-10(18-8)14(16)17/h2-6H,1H3,(H,12,13,15)	VBXGZWUYNBXRNM-UHFFFAOYSA-N	Cc1cccc(NC(=O)c2oc(cc2)[N+](=O)[O-])n1	BroadT	BRD-K42394406	BRD-K42394406-001-05-1	Specs	AG-690/09161015			Cc1cccc(NC(=O)c2ccc(o2)[N+]([O-])=O)n1	InChI=1S/C11H9N3O4/c1-7-3-2-4-9(12-7)13-11(15)8-5-6-10(18-8)14(16)17/h2-6H,1H3,(H,12,13,15)	VBXGZWUYNBXRNM-UHFFFAOYSA-N	247.059305798							112876
ST50775975	LSM-44039	SID17506384, BRD-K06605621	2263920	InChI=1S/C17H18N2O3S3/c1-4-22-16(21)14-10(2)11(3)25-15(14)19-17(23)18-13(20)8-7-12-6-5-9-24-12/h5-9H,4H2,1-3H3,(H2,18,19,20,23)/b8-7+	BPYSVVWTKRDOGG-BQYQJAHWSA-N	CCOC(=O)c1c(C)c(C)sc1NC(=S)NC(=O)\C=C\c2cccs2	BroadT	BRD-K06605621	BRD-K06605621-001-05-3	ChemBridge Corporation	6027953			CCOC(=O)c1c(NC(=S)NC(=O)\C=C\c2cccs2)sc(C)c1C	InChI=1S/C17H18N2O3S3/c1-4-22-16(21)14-10(2)11(3)25-15(14)19-17(23)18-13(20)8-7-12-6-5-9-24-12/h5-9H,4H2,1-3H3,(H2,18,19,20,23)/b8-7+	BPYSVVWTKRDOGG-BQYQJAHWSA-N	394.047954526							
MLS001004875	LSM-24288	SID24828640, BRD-A23271867	3771607	InChI=1S/C14H18N4S/c1-10-5-2-3-7-12(10)18-13(16-17-14(18)19)11-6-4-8-15-9-11/h4,6,8-10,12H,2-3,5,7H2,1H3,(H,17,19)	PUJQPRBCIATNGV-UHFFFAOYSA-N	CC1CCCCC1n2c(S)nnc2c3cccnc3	BroadT	BRD-A23271867	BRD-A23271867-001-06-6	Enamine Ltd.	T0512-0170			CC1CCCCC1n1c(S)nnc1-c1cccnc1	InChI=1S/C14H18N4S/c1-10-5-2-3-7-12(10)18-13(16-17-14(18)19)11-6-4-8-15-9-11/h4,6,8-10,12H,2-3,5,7H2,1H3,(H,17,19)	PUJQPRBCIATNGV-UHFFFAOYSA-N	274.125217306							112878
AC1MJ8KI	LSM-24289	BRD-A95716420	3133080	InChI=1S/C15H12N4O4S/c20-14-13(8-10-4-1-2-6-12(10)19(21)22)24-15(17-14)18-16-9-11-5-3-7-23-11/h1-7,9,13H,8H2,(H,17,18,20)	CNUNJKAIWILZCZ-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1CC2SC(=NC2=O)NN=Cc3occc3	BroadT	BRD-A95716420	BRD-A95716420-001-05-5	Asinex Ltd.	BAS 01812002			[O-][N+](=O)c1ccccc1CC1SC(NN=Cc2ccco2)=NC1=O	InChI=1S/C15H12N4O4S/c20-14-13(8-10-4-1-2-6-12(10)19(21)22)24-15(17-14)18-16-9-11-5-3-7-23-11/h1-7,9,13H,8H2,(H,17,18,20)	CNUNJKAIWILZCZ-UHFFFAOYSA-N	344.057925594							112879
3-(4-Chlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-ol	LSM-24290	SID7976978, BRD-K17195274	753150	InChI=1S/C14H12ClN3O/c1-8-7-12(19)18-14(16-8)13(9(2)17-18)10-3-5-11(15)6-4-10/h3-7,19H,1-2H3	FBKSVTFVOOTWPK-UHFFFAOYSA-N	Cc1cc(O)n2nc(C)c(c3ccc(Cl)cc3)c2n1	BroadT	BRD-K17195274	BRD-K17195274-001-05-2	ChemBridge Corporation	5679643			Cc1nn2c(O)cc(C)nc2c1-c1ccc(Cl)cc1	InChI=1S/C14H12ClN3O/c1-8-7-12(19)18-14(16-8)13(9(2)17-18)10-3-5-11(15)6-4-10/h3-7,19H,1-2H3	FBKSVTFVOOTWPK-UHFFFAOYSA-N	273.066889744							
AC1O1EEM	LSM-24291	SID24791442, BRD-A62087421	6094844	InChI=1S/C19H18N4O2/c1-11-7-8-13(9-12(11)2)20-18(25)15-10-17(24)23-16-6-4-3-5-14(16)21-19(23)22-15/h3-9,15H,10H2,1-2H3,(H,20,25)(H,21,22)	PVRGOCGZDQMNHB-UHFFFAOYSA-N	Cc1ccc(NC(=O)C2CC(=O)n3c(N2)nc4ccccc34)cc1C	BroadT	BRD-A62087421	BRD-A62087421-001-06-7	InterBioScreen Ltd.	STOCK5S-55070			Cc1ccc(NC(=O)C2CC(=O)n3c(N2)nc2ccccc32)cc1C	InChI=1S/C19H18N4O2/c1-11-7-8-13(9-12(11)2)20-18(25)15-10-17(24)23-16-6-4-3-5-14(16)21-19(23)22-15/h3-9,15H,10H2,1-2H3,(H,20,25)(H,21,22)	PVRGOCGZDQMNHB-UHFFFAOYSA-N	334.142975856							112881
1-Pyridin-2-yl-heptan-1-one oxime	LSM-24292	BRD-K59069616	6804015	InChI=1S/C12H18N2O/c1-2-3-4-5-9-12(14-15)11-8-6-7-10-13-11/h6-8,10,15H,2-5,9H2,1H3	IMBPTFHRKCPHPX-UHFFFAOYSA-N	CCCCCCC(=NO)c1ccccn1	BroadT	BRD-K59069616	BRD-K59069616-001-06-3	InterBioScreen Ltd.	STOCK1S-52446			CCCCCCC(=NO)c1ccccn1	InChI=1S/C12H18N2O/c1-2-3-4-5-9-12(14-15)11-8-6-7-10-13-11/h6-8,10,15H,2-5,9H2,1H3	IMBPTFHRKCPHPX-UHFFFAOYSA-N	206.141913216							
SMR000217157	LSM-24293	SID17512692, BRD-K40633937	4669392	InChI=1S/C25H24BrN3O4S/c1-5-7-8-17-10-9-16(13-27)24(28-17)34-14-21-23(25(31)32-6-2)18-11-22(33-15(3)30)19(26)12-20(18)29(21)4/h5,9-12H,1,6-8,14H2,2-4H3	WTCPGENTHGBTOT-UHFFFAOYSA-N	CCOC(=O)c1c(CSc2nc(CCC=C)ccc2C#N)n(C)c3cc(Br)c(OC(=O)C)cc13	BroadT	BRD-K40633937	BRD-K40633937-001-06-0	InterBioScreen Ltd.	STOCK1S-30462			CCOC(=O)c1c(CSc2nc(CCC=C)ccc2C#N)n(C)c2cc(Br)c(OC(C)=O)cc12	InChI=1S/C25H24BrN3O4S/c1-5-7-8-17-10-9-16(13-27)24(28-17)34-14-21-23(25(31)32-6-2)18-11-22(33-15(3)30)19(26)12-20(18)29(21)4/h5,9-12H,1,6-8,14H2,2-4H3	WTCPGENTHGBTOT-UHFFFAOYSA-N	541.067089568							112883
ENAMINE_001242	LSM-15363	BRD-K22408883	2322038	InChI=1S/C17H15BrN4S/c18-14-8-6-12(7-9-14)16-13(11-23-17(19)20)10-22(21-16)15-4-2-1-3-5-15/h1-10H,11H2,(H3,19,20)	HWMASQCYVGFFIE-UHFFFAOYSA-N	NC(=N)SCc1cn(nc1c2ccc(Br)cc2)c3ccccc3	BroadT	BRD-K22408883	BRD-K22408883-003-06-9	Enamine Ltd.	T0504-0290		Cl	NC(=N)SCc1cn(nc1-c1ccc(Br)cc1)-c1ccccc1.Cl	InChI=1S/C17H15BrN4S.ClH/c18-14-8-6-12(7-9-14)16-13(11-23-17(19)20)10-22(21-16)15-4-2-1-3-5-15;/h1-10H,11H2,(H3,19,20);1H	SMGRDJXTNJRDFV-UHFFFAOYSA-N	386.02007981							104009, 104009
MLS001117355	LSM-24294	SID49721783, BRD-K76140946	22519050	InChI=1S/C18H22ClN3O6S/c1-21-11-12(29(24,25)22-4-6-28-7-5-22)8-15(21)18(23)20-14-9-13(19)16(26-2)10-17(14)27-3/h8-11H,4-7H2,1-3H3,(H,20,23)	VLPRMMGHNKGZLN-UHFFFAOYSA-N	COc1cc(OC)c(NC(=O)c2cc(cn2C)S(=O)(=O)N3CCOCC3)cc1Cl	BroadT	BRD-K76140946	BRD-K76140946-001-06-2	ChemDiv Inc.	E203-0569			COc1cc(OC)c(NC(=O)c2cc(cn2C)S(=O)(=O)N2CCOCC2)cc1Cl	InChI=1S/C18H22ClN3O6S/c1-21-11-12(29(24,25)22-4-6-28-7-5-22)8-15(21)18(23)20-14-9-13(19)16(26-2)10-17(14)27-3/h8-11H,4-7H2,1-3H3,(H,20,23)	VLPRMMGHNKGZLN-UHFFFAOYSA-N	443.091783854							112884
ZINC00612832	LSM-24295	SID4263341, BRD-K82907505	972560	InChI=1S/C17H25NO3/c1-12(2)18-16(19)17(9-5-6-10-17)13-7-8-14(20-3)15(11-13)21-4/h7-8,11-12H,5-6,9-10H2,1-4H3,(H,18,19)	WRRAZMNKERJOCO-UHFFFAOYSA-N	COc1ccc(cc1OC)C2(CCCC2)C(=O)NC(C)C	BroadT	BRD-K82907505	BRD-K82907505-001-05-1	ChemBridge Corporation	7854103			COc1ccc(cc1OC)C1(CCCC1)C(=O)NC(C)C	InChI=1S/C17H25NO3/c1-12(2)18-16(19)17(9-5-6-10-17)13-7-8-14(20-3)15(11-13)21-4/h7-8,11-12H,5-6,9-10H2,1-4H3,(H,18,19)	WRRAZMNKERJOCO-UHFFFAOYSA-N	291.18344367							112885
3-Methyl-n-[(2,4,6-trimethylpyridin-3-yl)carbamoyl]benzamide	LSM-24296	SID24781015, BRD-K15342451	1503254	InChI=1S/C17H19N3O2/c1-10-6-5-7-14(8-10)16(21)20-17(22)19-15-11(2)9-12(3)18-13(15)4/h5-9H,1-4H3,(H2,19,20,21,22)	JVAKZRCTQPKWMX-UHFFFAOYSA-N	Cc1cccc(c1)C(=O)NC(=O)Nc2c(C)cc(C)nc2C	BroadT	BRD-K15342451	BRD-K15342451-001-05-7	ChemDiv Inc.	8015-6978			Cc1cccc(c1)C(=O)NC(=O)Nc1c(C)cc(C)nc1C	InChI=1S/C17H19N3O2/c1-10-6-5-7-14(8-10)16(21)20-17(22)19-15-11(2)9-12(3)18-13(15)4/h5-9H,1-4H3,(H2,19,20,21,22)	JVAKZRCTQPKWMX-UHFFFAOYSA-N	297.147726878							112886
BAS 08138951	LSM-24297	SID24809732, BRD-K57719285	830177	InChI=1S/C21H19N5/c1-2-7-15-12-20(24-14-16-8-5-6-11-23-16)26-19-10-4-3-9-18(19)25-21(26)17(15)13-22/h3-6,8-12,24H,2,7,14H2,1H3	HHAMABPQWJFFMA-UHFFFAOYSA-N	CCCc1cc(NCc2ccccn2)n3c4ccccc4nc3c1C#N	BroadT	BRD-K57719285	BRD-K57719285-001-06-5	Asinex Ltd.	BAS 08138951			CCCc1cc(NCc2ccccn2)n2c(nc3ccccc23)c1C#N	InChI=1S/C21H19N5/c1-2-7-15-12-20(24-14-16-8-5-6-11-23-16)26-19-10-4-3-9-18(19)25-21(26)17(15)13-22/h3-6,8-12,24H,2,7,14H2,1H3	HHAMABPQWJFFMA-UHFFFAOYSA-N	341.164045658							112887
AJ-333/25006003	LSM-24298	SID17388608, BRD-K84512386	1825804	InChI=1S/C15H15Cl2N3O3S2/c1-2-6-19-15(21)20-25(22,23)14-9-18-7-5-13(14)24-10-3-4-11(16)12(17)8-10/h3-5,7-9H,2,6H2,1H3,(H2,19,20,21)	GGSAANBFYTYUOT-UHFFFAOYSA-N	CCCNC(=O)NS(=O)(=O)c1cnccc1Sc2ccc(Cl)c(Cl)c2	BroadT	BRD-K84512386	BRD-K84512386-001-05-1	Specs	AJ-333/25006003			CCCNC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)c(Cl)c1	InChI=1S/C15H15Cl2N3O3S2/c1-2-6-19-15(21)20-25(22,23)14-9-18-7-5-13(14)24-10-3-4-11(16)12(17)8-10/h3-5,7-9H,2,6H2,1H3,(H2,19,20,21)	GGSAANBFYTYUOT-UHFFFAOYSA-N	418.99318817							112888
MLS-0261668.0001	LSM-24299	SID24817978, SID56373782, BRD-K23252094	888323	InChI=1S/C15H20N4O4/c1-4-21-11-7-10(14(20)18-15-16-9-17-19-15)8-12(22-5-2)13(11)23-6-3/h7-9H,4-6H2,1-3H3,(H2,16,17,18,19,20)	OQFGCQYOXRUGLU-UHFFFAOYSA-N	CCOc1cc(cc(OCC)c1OCC)C(=O)Nc2nc[nH]n2	BroadT	BRD-K23252094	BRD-K23252094-001-05-1	Asinex Ltd.	BAS 06290231			CCOc1cc(cc(OCC)c1OCC)C(=O)Nc1nc[nH]n1	InChI=1S/C15H20N4O4/c1-4-21-11-7-10(14(20)18-15-16-9-17-19-15)8-12(22-5-2)13(11)23-6-3/h7-9H,4-6H2,1-3H3,(H2,16,17,18,19,20)	OQFGCQYOXRUGLU-UHFFFAOYSA-N	320.14845516							112889
AC1LVU5R	LSM-44040	BRD-K21352171	1711870	InChI=1S/C15H17N5/c1-15(2)12-6-4-5-7-13(12)19(3)14(15)8-9-18-20-10-16-17-11-20/h4-11H,1-3H3/b14-8+,18-9?	OJQDNCSKUPMUTC-RJZJQNJASA-N	CN1\C(=C\C=Nn2cnnc2)\C(C)(C)c3ccccc13	BroadT	BRD-K21352171	BRD-K21352171-001-06-5	Enamine Ltd.	T0503-3279			CN1c2ccccc2C(C)(C)\C1=C/C=Nn1cnnc1	InChI=1S/C15H17N5/c1-15(2)12-6-4-5-7-13(12)19(3)14(15)8-9-18-20-10-16-17-11-20/h4-11H,1-3H3/b14-8+,18-9?	OJQDNCSKUPMUTC-RJZJQNJASA-N	267.148395594							
MLS002232305	LSM-4515	MW-STK33-22, SID74374085, BRD-K05323277	42601363	InChI=1S/C28H39N7O4/c1-33-13-10-19(11-14-33)30-27(38)18-4-9-22(24(16-18)39-3)31-28-29-17-23-26(32-28)35(15-12-25(37)34(23)2)20-5-7-21(36)8-6-20/h4,9,16-17,19-21,36H,5-8,10-15H2,1-3H3,(H,30,38)(H,29,31,32)	BRHMWNJLFOQRIN-UHFFFAOYSA-N	COc1cc(ccc1Nc2ncc3N(C)C(=O)CCN(C4CCC(O)CC4)c3n2)C(=O)NC5CCN(C)CC5	BroadT	BRD-K05323277	BRD-K05323277-001-07-7	Dana Farber Cancer Institute	AMY001-204			COc1cc(ccc1Nc1ncc2N(C)C(=O)CCN(C3CCC(O)CC3)c2n1)C(=O)NC1CCN(C)CC1	InChI=1S/C28H39N7O4/c1-33-13-10-19(11-14-33)30-27(38)18-4-9-22(24(16-18)39-3)31-28-29-17-23-26(32-28)35(15-12-25(37)34(23)2)20-5-7-21(36)8-6-20/h4,9,16-17,19-21,36H,5-8,10-15H2,1-3H3,(H,30,38)(H,29,31,32)	BRHMWNJLFOQRIN-UHFFFAOYSA-N	537.306352798							93936
ST51031129	LSM-24301	SID24833385, BRD-K25743539	2105702	InChI=1S/C18H21N3OS/c22-17-8-6-16(7-9-17)20-10-12-21(13-11-20)18(23)19-14-15-4-2-1-3-5-15/h1-9,22H,10-14H2,(H,19,23)	ILQJOZHUJMFHCU-UHFFFAOYSA-N	Oc1ccc(cc1)N2CCN(CC2)C(=NCc3ccccc3)S	BroadT	BRD-K25743539	BRD-K25743539-001-06-8	Enamine Ltd.	T5237694			Oc1ccc(cc1)N1CCN(CC1)C(S)=NCc1ccccc1	InChI=1S/C18H21N3OS/c22-17-8-6-16(7-9-17)20-10-12-21(13-11-20)18(23)19-14-15-4-2-1-3-5-15/h1-9,22H,10-14H2,(H,19,23)	ILQJOZHUJMFHCU-UHFFFAOYSA-N	327.140533012							112891
AC1LH7NV	LSM-24302	BRD-K39440398	833597	InChI=1S/C18H13N3O4/c22-17(15-4-1-2-10-19-15)21-20-12-13-6-8-14(9-7-13)25-18(23)16-5-3-11-24-16/h1-12H,(H,21,22)	WHGZGSVMCJFTBI-UHFFFAOYSA-N	O=C(NN=Cc1ccc(OC(=O)c2occc2)cc1)c3ccccn3	BroadT	BRD-K39440398	BRD-K39440398-001-05-7	Asinex Ltd.	BAS 00493465			O=C(Oc1ccc(C=NNC(=O)c2ccccn2)cc1)c1ccco1	InChI=1S/C18H13N3O4/c22-17(15-4-1-2-10-19-15)21-20-12-13-6-8-14(9-7-13)25-18(23)16-5-3-11-24-16/h1-12H,(H,21,22)	WHGZGSVMCJFTBI-UHFFFAOYSA-N	335.090605926							112892
F0688-0070	LSM-24303	TDR78026, BRD-A84109971	4073130	InChI=1S/C22H26N4O3S2/c1-29-21-8-3-2-7-19(21)25-11-13-26(14-12-25)20(18-6-4-10-23-16-18)17-24-31(27,28)22-9-5-15-30-22/h2-10,15-16,20,24H,11-14,17H2,1H3	WWGQVTLXWGTPSN-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)C(CNS(=O)(=O)c3cccs3)c4cccnc4	BroadT	BRD-A84109971	BRD-A84109971-001-04-2	Life Chemicals Inc.	F0688-0070			COc1ccccc1N1CCN(CC1)C(CNS(=O)(=O)c1cccs1)c1cccnc1	InChI=1S/C22H26N4O3S2/c1-29-21-8-3-2-7-19(21)25-11-13-26(14-12-25)20(18-6-4-10-23-16-18)17-24-31(27,28)22-9-5-15-30-22/h2-10,15-16,20,24H,11-14,17H2,1H3	WWGQVTLXWGTPSN-UHFFFAOYSA-N	458.144632112							112893
ZINC04163189	LSM-24304	SID47201834, BRD-K07278565	6797085	InChI=1S/C22H16N2O3/c25-19-12-10-15(14-20(19)26)11-13-21-23-18-9-5-4-8-17(18)22(27)24(21)16-6-2-1-3-7-16/h1-14,25-26H/b13-11+	PHPLMVDSUMFPES-ACCUITESSA-N	Oc1ccc(\C=C\C2=Nc3ccccc3C(=O)N2c4ccccc4)cc1O	BroadT	BRD-K07278565	BRD-K07278565-001-05-6	Asinex Ltd.	BAS 01578940			Oc1ccc(\C=C\c2nc3ccccc3c(=O)n2-c2ccccc2)cc1O	InChI=1S/C22H16N2O3/c25-19-12-10-15(14-20(19)26)11-13-21-23-18-9-5-4-8-17(18)22(27)24(21)16-6-2-1-3-7-16/h1-14,25-26H/b13-11+	PHPLMVDSUMFPES-ACCUITESSA-N	356.116092392							
AC1NLS1P	LSM-15556	BRD-A98200806	4963393	InChI=1S/C19H22N2O4/c1-13(20-12-14-4-3-5-16(10-14)23-2)19(22)21-15-6-7-17-18(11-15)25-9-8-24-17/h3-7,10-11,13,20H,8-9,12H2,1-2H3,(H,21,22)	VSSLYQHBQWDGDA-UHFFFAOYSA-N	COc1cccc(CNC(C)C(=O)Nc2ccc3OCCOc3c2)c1	BroadT	BRD-A98200806	BRD-A98200806-034-05-2	Enamine Ltd.	T5223637		OC(=O)C(=O)O	COc1cccc(CNC(C)C(=O)Nc2ccc3OCCOc3c2)c1.OC(=O)C(=O)O	InChI=1S/C19H22N2O4.C2H2O4/c1-13(20-12-14-4-3-5-16(10-14)23-2)19(22)21-15-6-7-17-18(11-15)25-9-8-24-17;3-1(4)2(5)6/h3-7,10-11,13,20H,8-9,12H2,1-2H3,(H,21,22);(H,3,4)(H,5,6)	RPOOZJYNHXCCSS-UHFFFAOYSA-N	342.157957204							104192, 104192
SMR000136843	LSM-24305	SID14732267, BRD-A45879474	2982776	InChI=1S/C18H20FNO3/c19-14-5-3-13(4-6-14)17-9-7-15(8-10-18(21)22)20(17)12-16-2-1-11-23-16/h3-7,9,16H,1-2,8,10-12H2,(H,21,22)	HBTVQKCDNKPOJC-UHFFFAOYSA-N	OC(=O)CCc1ccc(c2ccc(F)cc2)n1CC3CCCO3	BroadT	BRD-A45879474	BRD-A45879474-001-06-5	ChemBridge Corporation	7985242			OC(=O)CCc1ccc(-c2ccc(F)cc2)n1CC1CCCO1	InChI=1S/C18H20FNO3/c19-14-5-3-13(4-6-14)17-9-7-15(8-10-18(21)22)20(17)12-16-2-1-11-23-16/h3-7,9,16H,1-2,8,10-12H2,(H,21,22)	HBTVQKCDNKPOJC-UHFFFAOYSA-N	317.14272171							112895
6-Chloroacetyl-2-benzoxazolinone	LSM-24306	SID26669801, BRD-K70074810	1988981	InChI=1S/C9H6ClNO3/c10-4-7(12)5-1-2-6-8(3-5)14-9(13)11-6/h1-3H,4H2,(H,11,13)	KOOWFDRPKXUCRF-UHFFFAOYSA-N	Oc1oc2cc(ccc2n1)C(=O)CCl	BroadT	BRD-K70074810	BRD-K70074810-001-05-4	Enamine Ltd.	T5342909			Oc1nc2ccc(cc2o1)C(=O)CCl	InChI=1S/C9H6ClNO3/c10-4-7(12)5-1-2-6-8(3-5)14-9(13)11-6/h1-3H,4H2,(H,11,13)	KOOWFDRPKXUCRF-UHFFFAOYSA-N	211.003620772							112896
5-(Pyridin-3-ylmethyl)-1,3,5-triazinane-2-thione	LSM-24307	SID26663715, BRD-K57280285	738555	InChI=1S/C9H12N4S/c14-9-11-6-13(7-12-9)5-8-2-1-3-10-4-8/h1-4H,5-7H2,(H2,11,12,14)	ZVEWRJVFPKRKHG-UHFFFAOYSA-N	SC1=NCN(Cc2cccnc2)CN1	BroadT	BRD-K57280285	BRD-K57280285-001-04-3	InterBioScreen Ltd.	STOCK3S-57769			SC1=NCN(Cc2cccnc2)CN1	InChI=1S/C9H12N4S/c14-9-11-6-13(7-12-9)5-8-2-1-3-10-4-8/h1-4H,5-7H2,(H2,11,12,14)	ZVEWRJVFPKRKHG-UHFFFAOYSA-N	208.078267114							112897
F1853-0117	LSM-24308	SID17515612, BRD-K62204280	7202446	InChI=1S/C13H12N4OS2/c1-8-4-3-5-10(6-8)7-19-13-16-17-11(18)9(2)14-15-12(17)20-13/h3-6H,7H2,1-2H3	BLQALIGCXVHCBE-UHFFFAOYSA-N	CC1=NN=C2SC(=NN2C1=O)SCc3cccc(C)c3	BroadT	BRD-K62204280	BRD-K62204280-001-06-6	Life Chemicals Inc.	F1853-0117			Cc1cccc(CSc2nn3c(nnc(C)c3=O)s2)c1	InChI=1S/C13H12N4OS2/c1-8-4-3-5-10(6-8)7-19-13-16-17-11(18)9(2)14-15-12(17)20-13/h3-6H,7H2,1-2H3	BLQALIGCXVHCBE-UHFFFAOYSA-N	304.045252424							112898
2-[4-(2-Fluorophenyl)piperazino]quinoxaline	LSM-24309	SID14729101, BRD-K50015854	4295181	InChI=1S/C18H17FN4/c19-14-5-1-4-8-17(14)22-9-11-23(12-10-22)18-13-20-15-6-2-3-7-16(15)21-18/h1-8,13H,9-12H2	VXVGANJCDDDWQK-UHFFFAOYSA-N	Fc1ccccc1N2CCN(CC2)c3cnc4ccccc4n3	BroadT	BRD-K50015854	BRD-K50015854-001-05-8	Key Organics Ltd.	9G-377S			Fc1ccccc1N1CCN(CC1)c1cnc2ccccc2n1	InChI=1S/C18H17FN4/c19-14-5-1-4-8-17(14)22-9-11-23(12-10-22)18-13-20-15-6-2-3-7-16(15)21-18/h1-8,13H,9-12H2	VXVGANJCDDDWQK-UHFFFAOYSA-N	308.143724784							112899
2-[(5-Methyl-4-phenyl-1,3-thiazol-2-yl)methyl]-1,3-thiazol-4-ol	LSM-24310	SID24824487, BRD-K98829835	4318310	InChI=1S/C14H12N2OS2/c1-9-14(10-5-3-2-4-6-10)16-13(19-9)7-12-15-11(17)8-18-12/h2-6,8,17H,7H2,1H3	RJEADPAJVSGAAR-UHFFFAOYSA-N	Cc1sc(Cc2nc(O)cs2)nc1c3ccccc3	BroadT	BRD-K98829835	BRD-K98829835-001-05-0	Key Organics Ltd.	1X-0221			Cc1sc(Cc2nc(O)cs2)nc1-c1ccccc1	InChI=1S/C14H12N2OS2/c1-9-14(10-5-3-2-4-6-10)16-13(19-9)7-12-15-11(17)8-18-12/h2-6,8,17H,7H2,1H3	RJEADPAJVSGAAR-UHFFFAOYSA-N	288.039104404							112900
MLS000571962	LSM-44041	SID17432733, BRD-K10555986	1184649	InChI=1S/C19H18ClNO5/c1-24-13-7-4-12(5-8-13)6-9-18(22)21-16-11-17(25-2)14(10-15(16)20)19(23)26-3/h4-11H,1-3H3,(H,21,22)/b9-6+	IBCNBIILVKCJJN-RMKNXTFCSA-N	COC(=O)c1cc(Cl)c(NC(=O)\C=C\c2ccc(OC)cc2)cc1OC	BroadT	BRD-K10555986	BRD-K10555986-001-05-3	ChemBridge Corporation	6050932			COC(=O)c1cc(Cl)c(NC(=O)\C=C\c2ccc(OC)cc2)cc1OC	InChI=1S/C19H18ClNO5/c1-24-13-7-4-12(5-8-13)6-9-18(22)21-16-11-17(25-2)14(10-15(16)20)19(23)26-3/h4-11H,1-3H3,(H,21,22)/b9-6+	IBCNBIILVKCJJN-RMKNXTFCSA-N	375.087350396							
AC1OBEWV	LSM-24312	BRD-K09724703	6846025	InChI=1S/C16H16BrN3OS/c17-14-6-7-15(21)13(10-14)11-19-20-16(22)18-9-8-12-4-2-1-3-5-12/h1-7,10-11,21H,8-9H2,(H2,18,20,22)	JYCYRYJMCPZDOO-UHFFFAOYSA-N	Oc1ccc(Br)cc1C=NN=C(S)NCCc2ccccc2	BroadT	BRD-K09724703	BRD-K09724703-001-07-6	Enamine Ltd.	T0509-1827			Oc1ccc(Br)cc1C=NN=C(S)NCCc1ccccc1	InChI=1S/C16H16BrN3OS/c17-14-6-7-15(21)13(10-14)11-19-20-16(22)18-9-8-12-4-2-1-3-5-12/h1-7,10-11,21H,8-9H2,(H2,18,20,22)	JYCYRYJMCPZDOO-UHFFFAOYSA-N	377.019745452							
Nikkomycin Z	LSM-24313	SID8139977, BRD-K76218980	5458181	InChI=1S/C20H25N5O10/c1-7(13(28)9-3-2-8(26)6-22-9)11(21)17(31)24-12(19(32)33)16-14(29)15(30)18(35-16)25-5-4-10(27)23-20(25)34/h2-7,11-16,18,26,28-30H,21H2,1H3,(H,24,31)(H,32,33)(H,23,27,34)/t7-,11-,12-,13-,14-,15+,16+,18+/m1/s1	WWJFFVUVFNBJTN-MLOKMKBISA-N	C[C@H]([C@@H](N)C(=O)N[C@H]([C@@H]1O[C@@H]([C@@H](O)[C@H]1O)N2C=CC(=O)NC2=O)C(=O)O)[C@@H](O)c3ccc(O)cn3	BroadT	BRD-K76218980	BRD-K76218980-001-11-3	Sigma-Aldrich	N8028			C[C@H]([C@@H](N)C(=O)N[C@H]([C@@H]1O[C@@H]([C@@H](O)[C@H]1O)n1ccc(=O)[nH]c1=O)C(O)=O)[C@@H](O)c1ccc(O)cn1	InChI=1S/C20H25N5O10/c1-7(13(28)9-3-2-8(26)6-22-9)11(21)17(31)24-12(19(32)33)16-14(29)15(30)18(35-16)25-5-4-10(27)23-20(25)34/h2-7,11-16,18,26,28-30H,21H2,1H3,(H,24,31)(H,32,33)(H,23,27,34)/t7-,11-,12-,13-,14-,15+,16+,18+/m1/s1	WWJFFVUVFNBJTN-MLOKMKBISA-N	495.16014205							112903
MLS001121487	LSM-24314	SID24395223, SID49723020, BRD-K19608696	16017323	InChI=1S/C15H14N4O4S2/c1-2-19(11-7-4-3-5-8-11)25(21,22)15-18-17-14(24-15)16-13(20)12-9-6-10-23-12/h3-10H,2H2,1H3,(H,16,17,20)	VNANCZJRYAGLQV-UHFFFAOYSA-N	CCN(c1ccccc1)S(=O)(=O)c2nnc(NC(=O)c3occc3)s2	BroadT	BRD-K19608696	BRD-K19608696-001-04-5	ChemDiv Inc.	E157-5383			CCN(c1ccccc1)S(=O)(=O)c1nnc(NC(=O)c2ccco2)s1	InChI=1S/C15H14N4O4S2/c1-2-19(11-7-4-3-5-8-11)25(21,22)15-18-17-14(24-15)16-13(20)12-9-6-10-23-12/h3-10H,2H2,1H3,(H,16,17,20)	VNANCZJRYAGLQV-UHFFFAOYSA-N	378.045646348							112904
4-(2-Methylphenoxy)-6-phenylfuro[2,3-d]pyrimidine	LSM-24315	SID17411765, BRD-K38333122	3825639	InChI=1S/C19H14N2O2/c1-13-7-5-6-10-16(13)22-18-15-11-17(14-8-3-2-4-9-14)23-19(15)21-12-20-18/h2-12H,1H3	ATKPLDDGMIKJMB-UHFFFAOYSA-N	Cc1ccccc1Oc2ncnc3oc(cc23)c4ccccc4	BroadT	BRD-K38333122	BRD-K38333122-001-05-8	Key Organics Ltd.	5P-577S			Cc1ccccc1Oc1ncnc2oc(cc12)-c1ccccc1	InChI=1S/C19H14N2O2/c1-13-7-5-6-10-16(13)22-18-15-11-17(14-8-3-2-4-9-14)23-19(15)21-12-20-18/h2-12H,1H3	ATKPLDDGMIKJMB-UHFFFAOYSA-N	302.105527708							112905
4N-819	LSM-44042	SID24819940, BRD-K11237957	5914808	InChI=1S/C14H16N2O6S/c1-4-22-14(20)16-11(18)10(8(2)17)7-15-12-9(5-6-23-12)13(19)21-3/h5-7,15H,4H2,1-3H3,(H,16,18,20)/b10-7+	AYOZRXOYDTUEAA-JXMROGBWSA-N	CCOC(=O)NC(=O)\C(=C\Nc1sccc1C(=O)OC)\C(=O)C	BroadT	BRD-K11237957	BRD-K11237957-001-05-2	Key Organics Ltd.	4N-819			CCOC(=O)NC(=O)C(=C\Nc1sccc1C(=O)OC)\C(C)=O	InChI=1S/C14H16N2O6S/c1-4-22-14(20)16-11(18)10(8(2)17)7-15-12-9(5-6-23-12)13(19)21-3/h5-7,15H,4H2,1-3H3,(H,16,18,20)/b10-7+	AYOZRXOYDTUEAA-JXMROGBWSA-N	340.072906942							
1-Ethyl-n'-heptanoyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbohydrazide	LSM-24317	SID24784348, BRD-K79652695	54683110	InChI=1S/C19H25N3O4/c1-3-5-6-7-12-15(23)20-21-18(25)16-17(24)13-10-8-9-11-14(13)22(4-2)19(16)26/h8-11,24H,3-7,12H2,1-2H3,(H,20,23)(H,21,25)	DIMSHHWRCPMNPU-UHFFFAOYSA-N	CCCCCCC(=O)NNC(=O)C1=C(O)c2ccccc2N(CC)C1=O	BroadT	BRD-K79652695	BRD-K79652695-001-05-8	Asinex Ltd.	BAS 00693287			CCCCCCC(=O)NNC(=O)c1c(O)c2ccccc2n(CC)c1=O	InChI=1S/C19H25N3O4/c1-3-5-6-7-12-15(23)20-21-18(25)16-17(24)13-10-8-9-11-14(13)22(4-2)19(16)26/h8-11,24H,3-7,12H2,1-2H3,(H,20,23)(H,21,25)	DIMSHHWRCPMNPU-UHFFFAOYSA-N	359.18450631							112907
ST50011315	LSM-24318	SID852398, BRD-K03155670	655021	InChI=1S/C17H18F3N3O2/c1-25-12-7-5-11(6-8-12)9-21-15(24)10-23-14-4-2-3-13(14)16(22-23)17(18,19)20/h5-8H,2-4,9-10H2,1H3,(H,21,24)	MZSMOOKBLTVFCX-UHFFFAOYSA-N	COc1ccc(CNC(=O)Cn2nc(c3CCCc23)C(F)(F)F)cc1	BroadT	BRD-K03155670	BRD-K03155670-001-05-2	Asinex Ltd.	BAS 01939669			COc1ccc(CNC(=O)Cn2nc(c3CCCc23)C(F)(F)F)cc1	InChI=1S/C17H18F3N3O2/c1-25-12-7-5-11(6-8-12)9-21-15(24)10-23-14-4-2-3-13(14)16(22-23)17(18,19)20/h5-8H,2-4,9-10H2,1H3,(H,21,24)	MZSMOOKBLTVFCX-UHFFFAOYSA-N	353.135111446							112908
MLS000082139	LSM-24319	SID3714109, BRD-A18540526	2998669	InChI=1S/C14H11NO4/c16-13(19-12-7-8-18-14(12)17)11-6-5-9-3-1-2-4-10(9)15-11/h1-6,12H,7-8H2	LJCDNZIDROVEPH-UHFFFAOYSA-N	O=C(OC1CCOC1=O)c2ccc3ccccc3n2	BroadT	BRD-A18540526	BRD-A18540526-001-05-6	Enamine Ltd.	T0508-8964			O=C(OC1CCOC1=O)c1ccc2ccccc2n1	InChI=1S/C14H11NO4/c16-13(19-12-7-8-18-14(12)17)11-6-5-9-3-1-2-4-10(9)15-11/h1-6,12H,7-8H2	LJCDNZIDROVEPH-UHFFFAOYSA-N	257.068807842							112909
MLS000757021	LSM-24320	BRD-K07079807	329164	InChI=1S/C25H22Cl2N2OS2/c1-15-9-8-11-18(26)21(15)28-24-29(25(16(2)31-24)13-6-3-7-14-25)23(30)22-20(27)17-10-4-5-12-19(17)32-22/h4-5,8-12H,2-3,6-7,13-14H2,1H3	WVXRLXIHTFSYSM-UHFFFAOYSA-N	Cc1cccc(Cl)c1N=C2SC(=C)C3(CCCCC3)N2C(=O)c4sc5ccccc5c4Cl	BroadT	BRD-K07079807	BRD-K07079807-001-05-6	National Cancer Institute Chemotherapeutic Agents Repository	310325			Cc1cccc(Cl)c1N=C1SC(=C)C2(CCCCC2)N1C(=O)c1sc2ccccc2c1Cl	InChI=1S/C25H22Cl2N2OS2/c1-15-9-8-11-18(26)21(15)28-24-29(25(16(2)31-24)13-6-3-7-14-25)23(30)22-20(27)17-10-4-5-12-19(17)32-22/h4-5,8-12H,2-3,6-7,13-14H2,1H3	WVXRLXIHTFSYSM-UHFFFAOYSA-N	500.055060144							112910
SMR000129781	LSM-24321	SID14738516, BRD-K50647727	3442010	InChI=1S/C25H29N3O3/c1-18(2)31-20-9-7-19(8-10-20)24-17-22(21-5-3-4-6-23(21)27-24)25(29)26-11-12-28-13-15-30-16-14-28/h3-10,17-18H,11-16H2,1-2H3,(H,26,29)	ZJVCYHHMPUWDCV-UHFFFAOYSA-N	CC(C)Oc1ccc(cc1)c2cc(C(=O)NCCN3CCOCC3)c4ccccc4n2	BroadT	BRD-K50647727	BRD-K50647727-001-05-3	ChemDiv Inc.	6049-2238			CC(C)Oc1ccc(cc1)-c1cc(C(=O)NCCN2CCOCC2)c2ccccc2n1	InChI=1S/C25H29N3O3/c1-18(2)31-20-9-7-19(8-10-20)24-17-22(21-5-3-4-6-23(21)27-24)25(29)26-11-12-28-13-15-30-16-14-28/h3-10,17-18H,11-16H2,1-2H3,(H,26,29)	ZJVCYHHMPUWDCV-UHFFFAOYSA-N	419.220891818							112911
N-[2-(2,4,6-Trinitrophenyl)ethyl]aniline	LSM-24322	SID24791589, BRD-K05266324	4326795	InChI=1S/C14H12N4O6/c19-16(20)11-8-13(17(21)22)12(14(9-11)18(23)24)6-7-15-10-4-2-1-3-5-10/h1-5,8-9,15H,6-7H2	WPDUWQVPOYWUIS-UHFFFAOYSA-N	[O-][N+](=O)c1cc(c(CCNc2ccccc2)c(c1)[N+](=O)[O-])[N+](=O)[O-]	BroadT	BRD-K05266324	BRD-K05266324-001-05-5	InterBioScreen Ltd.	STOCK1S-08438			[O-][N+](=O)c1cc(c(CCNc2ccccc2)c(c1)[N+]([O-])=O)[N+]([O-])=O	InChI=1S/C14H12N4O6/c19-16(20)11-8-13(17(21)22)12(14(9-11)18(23)24)6-7-15-10-4-2-1-3-5-10/h1-5,8-9,15H,6-7H2	WPDUWQVPOYWUIS-UHFFFAOYSA-N	332.075684144							112912
MLS000575889	LSM-24323	SID17415280, BRD-K22477651	1581712	InChI=1S/C14H12N2O3S/c17-11(10-5-2-1-3-6-10)9-15-14(20)16-13(18)12-7-4-8-19-12/h1-8H,9H2,(H2,15,16,18,20)	RTHUAJRQVCXFAY-UHFFFAOYSA-N	O=C(CNC(=S)NC(=O)c1occc1)c2ccccc2	BroadT	BRD-K22477651	BRD-K22477651-001-05-0	ChemBridge Corporation	6991137			O=C(NC(=S)NCC(=O)c1ccccc1)c1ccco1	InChI=1S/C14H12N2O3S/c17-11(10-5-2-1-3-6-10)9-15-14(20)16-13(18)12-7-4-8-19-12/h1-8H,9H2,(H2,15,16,18,20)	RTHUAJRQVCXFAY-UHFFFAOYSA-N	288.056862954							112913
AC1O99UD	LSM-24324	BRD-K31380228	6752627	InChI=1S/C20H19N3O4S/c1-12-8-18(15-4-3-5-17(27-2)20(15)22-12)28-11-19(26)23-21-10-13-6-7-14(24)9-16(13)25/h3-10,24-25H,11H2,1-2H3,(H,23,26)	WQLDNMHYVFKMMU-UHFFFAOYSA-N	COc1cccc2c(SCC(=O)NN=Cc3ccc(O)cc3O)cc(C)nc12	BroadT	BRD-K31380228	BRD-K31380228-001-05-9	Asinex Ltd.	BAS 02380021			COc1cccc2c(SCC(=O)NN=Cc3ccc(O)cc3O)cc(C)nc12	InChI=1S/C20H19N3O4S/c1-12-8-18(15-4-3-5-17(27-2)20(15)22-12)28-11-19(26)23-21-10-13-6-7-14(24)9-16(13)25/h3-10,24-25H,11H2,1-2H3,(H,23,26)	WQLDNMHYVFKMMU-UHFFFAOYSA-N	397.109626808							
MLS000624991	LSM-15364	BRD-A41883104	2952440	InChI=1S/C23H32N4O2/c1-4-25(5-2)13-14-26-21-11-6-7-12-22(21)27(23(26)24)16-19(28)17-29-20-10-8-9-18(3)15-20/h6-12,15,19,24,28H,4-5,13-14,16-17H2,1-3H3	IJGSXXQMYBXCHB-UHFFFAOYSA-N	CCN(CC)CCN1C(=N)N(CC(O)COc2cccc(C)c2)c3ccccc13	BroadT	BRD-A41883104	BRD-A41883104-003-06-5	ChemBridge Corporation	7758049		Cl	CCN(CC)CCn1c2ccccc2n(CC(O)COc2cccc(C)c2)c1=N.Cl	InChI=1S/C23H32N4O2.ClH/c1-4-25(5-2)13-14-26-21-11-6-7-12-22(21)27(23(26)24)16-19(28)17-29-20-10-8-9-18(3)15-20;/h6-12,15,19,24,28H,4-5,13-14,16-17H2,1-3H3;1H	FEOXOAFGXVOCBM-UHFFFAOYSA-N	396.252526304							104010, 104010
N1-(Tert-butyl)-2-[(4-methylphenyl)sulfonyl]hydrazine-1-carbothioamide	LSM-24325	SID26727195, BRD-K01342581	2825776	InChI=1S/C12H19N3O2S2/c1-9-5-7-10(8-6-9)19(16,17)15-14-11(18)13-12(2,3)4/h5-8,15H,1-4H3,(H2,13,14,18)	HFUMYSBDWSPAGF-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NN=C(S)NC(C)(C)C	BroadT	BRD-K01342581	BRD-K01342581-001-04-9	Maybridge	NRB 04573			Cc1ccc(cc1)S(=O)(=O)NN=C(S)NC(C)(C)C	InChI=1S/C12H19N3O2S2/c1-9-5-7-10(8-6-9)19(16,17)15-14-11(18)13-12(2,3)4/h5-8,15H,1-4H3,(H2,13,14,18)	HFUMYSBDWSPAGF-UHFFFAOYSA-N	301.091868258							112915
BDBM53349	LSM-24326	BRD-A54114329	91897119	InChI=1S/C26H20N2O6/c1-3-11-32-18-9-6-8-17(13-18)23-22(24(29)20-14-16-7-4-5-10-19(16)33-20)25(30)26(31)28(23)21-12-15(2)34-27-21/h3-10,12-14,22-23H,1,11H2,2H3	IYZKJDOLAQHVSV-UHFFFAOYSA-N	Cc1onc(c1)N2C(C(C(=O)c3oc4ccccc4c3)C(=O)C2=O)c5cccc(OCC=C)c5	BroadT	BRD-A54114329	BRD-A54114329-001-06-2	InterBioScreen Ltd.	STOCK3S-78094			Cc1cc(no1)N1C(C(C(=O)c2cc3ccccc3o2)C(=O)C1=O)c1cccc(OCC=C)c1	InChI=1S/C26H20N2O6/c1-3-11-32-18-9-6-8-17(13-18)23-22(24(29)20-14-16-7-4-5-10-19(16)33-20)25(30)26(31)28(23)21-12-15(2)34-27-21/h3-10,12-14,22-23H,1,11H2,2H3	IYZKJDOLAQHVSV-UHFFFAOYSA-N	456.13213638							112916
SBB040363	LSM-24327	SID24780395, BRD-K94641083	769933	InChI=1S/C16H15N3OS/c1-12-7-9-14(10-8-12)20-11-15-17-18-16(21)19(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,21)	LNWUGGPDGVUHOY-UHFFFAOYSA-N	Cc1ccc(OCc2nnc(S)n2c3ccccc3)cc1	BroadT	BRD-K94641083	BRD-K94641083-001-05-2	Asinex Ltd.	BAS 02070609			Cc1ccc(OCc2nnc(S)n2-c2ccccc2)cc1	InChI=1S/C16H15N3OS/c1-12-7-9-14(10-8-12)20-11-15-17-18-16(21)19(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,21)	LNWUGGPDGVUHOY-UHFFFAOYSA-N	297.09358282							112917
MLS000859064	LSM-24328	SID26728777, BRD-K25169499	2818820	InChI=1S/C17H19ClN2O3S/c1-2-20(17(21)19-15-6-4-3-5-7-15)12-13-24(22,23)16-10-8-14(18)9-11-16/h3-11H,2,12-13H2,1H3,(H,19,21)	FUQQYRCZSKTHAY-UHFFFAOYSA-N	CCN(CCS(=O)(=O)c1ccc(Cl)cc1)C(=O)Nc2ccccc2	BroadT	BRD-K25169499	BRD-K25169499-001-05-6	Maybridge	KM 00106			CCN(CCS(=O)(=O)c1ccc(Cl)cc1)C(=O)Nc1ccccc1	InChI=1S/C17H19ClN2O3S/c1-2-20(17(21)19-15-6-4-3-5-7-15)12-13-24(22,23)16-10-8-14(18)9-11-16/h3-11H,2,12-13H2,1H3,(H,19,21)	FUQQYRCZSKTHAY-UHFFFAOYSA-N	366.080490888							112918
AC1LDI1R	LSM-24329	SID866155, BRD-A37484068	667414	InChI=1S/C20H27NO3/c1-23-18-9-15-5-6-21(12-17(15)10-19(18)24-2)20(22)11-16-8-13-3-4-14(16)7-13/h9-10,13-14,16H,3-8,11-12H2,1-2H3	MESVHWNKLKGEMS-UHFFFAOYSA-N	COc1cc2CCN(Cc2cc1OC)C(=O)CC3CC4CCC3C4	BroadT	BRD-A37484068	BRD-A37484068-001-05-8	InterBioScreen Ltd.	STOCK5S-59638			COc1cc2CCN(Cc2cc1OC)C(=O)CC1CC2CCC1C2	InChI=1S/C20H27NO3/c1-23-18-9-15-5-6-21(12-17(15)10-19(18)24-2)20(22)11-16-8-13-3-4-14(16)7-13/h9-10,13-14,16H,3-8,11-12H2,1-2H3	MESVHWNKLKGEMS-UHFFFAOYSA-N	329.199093734							112919
MLS000756481	LSM-24330	NSC-205827, BRD-K49119404	307712	InChI=1S/C15H15N3O2S/c1-21-11-8-6-10(7-9-11)17-15(20)18-13-5-3-2-4-12(13)14(16)19/h2-9H,1H3,(H2,16,19)(H2,17,18,20)	QMVVQYKXNNYVJQ-UHFFFAOYSA-N	CSc1ccc(NC(=O)Nc2ccccc2C(=O)N)cc1	BroadT	BRD-K49119404	BRD-K49119404-001-05-7	National Cancer Institute Chemotherapeutic Agents Repository	205827			CSc1ccc(NC(=O)Nc2ccccc2C(N)=O)cc1	InChI=1S/C15H15N3O2S/c1-21-11-8-6-10(7-9-11)17-15(20)18-13-5-3-2-4-12(13)14(16)19/h2-9H,1H3,(H2,16,19)(H2,17,18,20)	QMVVQYKXNNYVJQ-UHFFFAOYSA-N	301.08849744							112920
AC1MGD34	LSM-24331	SID24794649, BRD-K96485081	2984270	InChI=1S/C22H28ClN3O3/c1-28-20-6-7-21(29-2)17(12-20)15-26-10-8-16(9-11-26)14-24-22(27)25-19-5-3-4-18(23)13-19/h3-7,12-13,16H,8-11,14-15H2,1-2H3,(H2,24,25,27)	REICQRPQROQVNW-UHFFFAOYSA-N	COc1ccc(OC)c(CN2CCC(CNC(=O)Nc3cccc(Cl)c3)CC2)c1	BroadT	BRD-K96485081	BRD-K96485081-001-05-4	ChemBridge Corporation	7990237			COc1ccc(OC)c(CN2CCC(CNC(=O)Nc3cccc(Cl)c3)CC2)c1	InChI=1S/C22H28ClN3O3/c1-28-20-6-7-21(29-2)17(12-20)15-26-10-8-16(9-11-26)14-24-22(27)25-19-5-3-4-18(23)13-19/h3-7,12-13,16H,8-11,14-15H2,1-2H3,(H2,24,25,27)	REICQRPQROQVNW-UHFFFAOYSA-N	417.181919496							112921
9-Cyclopentyl-6-mercaptopurine	LSM-24332	SID26665800, BRD-K49111789	3034494	InChI=1S/C10H12N4S/c15-10-8-9(11-5-12-10)14(6-13-8)7-3-1-2-4-7/h5-7H,1-4H2,(H,11,12,15)	AMLJKGIHHITBDS-UHFFFAOYSA-N	Sc1ncnc2c1ncn2C3CCCC3	BroadT	BRD-K49111789	BRD-K49111789-001-05-9	National Cancer Institute Chemotherapeutic Agents Repository	9-Cyclopentyl-6-mercaptopurine 19487			Sc1ncnc2n(cnc12)C1CCCC1	InChI=1S/C10H12N4S/c15-10-8-9(11-5-12-10)14(6-13-8)7-3-1-2-4-7/h5-7H,1-4H2,(H,11,12,15)	AMLJKGIHHITBDS-UHFFFAOYSA-N	220.078267114							112922
SMR000063049	LSM-24333	SID3714945, BRD-K42731527	2999022	InChI=1S/C20H20N4O3S2/c1-4-24-13-9-7-6-8-12(13)21-20(24)28-10-14-22-17(25)15-11(3)16(19(26)27-5-2)29-18(15)23-14/h6-9H,4-5,10H2,1-3H3,(H,22,23,25)	KULSEJLQFGPWIP-UHFFFAOYSA-N	CCOC(=O)c1sc2nc(CSc3nc4ccccc4n3CC)nc(O)c2c1C	BroadT	BRD-K42731527	BRD-K42731527-001-05-8	Enamine Ltd.	T5223402			CCOC(=O)c1sc2nc(CSc3nc4ccccc4n3CC)nc(O)c2c1C	InChI=1S/C20H20N4O3S2/c1-4-24-13-9-7-6-8-12(13)21-20(24)28-10-14-22-17(25)15-11(3)16(19(26)27-5-2)29-18(15)23-14/h6-9H,4-5,10H2,1-3H3,(H,22,23,25)	KULSEJLQFGPWIP-UHFFFAOYSA-N	428.09768192							112923
SMR000002409	LSM-24334	SID26668178, SID852321, BRD-K99488837	654936	InChI=1S/C22H25N5O4S2/c1-16-3-7-18(8-4-16)23-20(28)15-32-22-25-24-21(26(22)2)17-5-9-19(10-6-17)33(29,30)27-11-13-31-14-12-27/h3-10H,11-15H2,1-2H3,(H,23,28)	APNFYXCQUWJYBP-UHFFFAOYSA-N	Cc1ccc(NC(=O)CSc2nnc(c3ccc(cc3)S(=O)(=O)N4CCOCC4)n2C)cc1	BroadT	BRD-K99488837	BRD-K99488837-001-05-2	Asinex Ltd.	ASN 03578328			Cc1ccc(NC(=O)CSc2nnc(-c3ccc(cc3)S(=O)(=O)N3CCOCC3)n2C)cc1	InChI=1S/C22H25N5O4S2/c1-16-3-7-18(8-4-16)23-20(28)15-32-22-25-24-21(26(22)2)17-5-9-19(10-6-17)33(29,30)27-11-13-31-14-12-27/h3-10H,11-15H2,1-2H3,(H,23,28)	APNFYXCQUWJYBP-UHFFFAOYSA-N	487.13479571							112924
N-(2,4-Dichlorophenyl)piperidine-1-carbothioamide	LSM-24335	SID22404489, BRD-K75328969	882668	InChI=1S/C12H14Cl2N2S/c13-9-4-5-11(10(14)8-9)15-12(17)16-6-2-1-3-7-16/h4-5,8H,1-3,6-7H2,(H,15,17)	WFWNEUHFWIIRIP-UHFFFAOYSA-N	Clc1ccc(NC(=S)N2CCCCC2)c(Cl)c1	BroadT	BRD-K75328969	BRD-K75328969-001-05-8	ChemBridge Corporation	6522626			Clc1ccc(NC(=S)N2CCCCC2)c(Cl)c1	InChI=1S/C12H14Cl2N2S/c13-9-4-5-11(10(14)8-9)15-12(17)16-6-2-1-3-7-16/h4-5,8H,1-3,6-7H2,(H,15,17)	WFWNEUHFWIIRIP-UHFFFAOYSA-N	288.025474578							112925
MLS000535047	LSM-24336	SID14734028, BRD-K03678940	895604	InChI=1S/C21H19N3O2/c25-20(22-15-16-9-3-1-4-10-16)18-13-7-8-14-19(18)24-21(26)23-17-11-5-2-6-12-17/h1-14H,15H2,(H,22,25)(H2,23,24,26)	NENBBJMKGNIMAB-UHFFFAOYSA-N	O=C(Nc1ccccc1)Nc2ccccc2C(=O)NCc3ccccc3	BroadT	BRD-K03678940	BRD-K03678940-001-05-7	ChemBridge Corporation	7192416			O=C(Nc1ccccc1)Nc1ccccc1C(=O)NCc1ccccc1	InChI=1S/C21H19N3O2/c25-20(22-15-16-9-3-1-4-10-16)18-13-7-8-14-19(18)24-21(26)23-17-11-5-2-6-12-17/h1-14H,15H2,(H,22,25)(H2,23,24,26)	NENBBJMKGNIMAB-UHFFFAOYSA-N	345.147726878							112926
ST50715897	LSM-24337	SID17506350, BRD-K14388439	1291751	InChI=1S/C23H19N3OS/c27-22(26-23-25-19-12-6-7-13-21(19)28-23)17-14-20(15-8-2-1-3-9-15)24-18-11-5-4-10-16(17)18/h1-5,8-11,14H,6-7,12-13H2,(H,25,26,27)	XMWLVEYNTBHDOP-UHFFFAOYSA-N	O=C(Nc1nc2CCCCc2s1)c3cc(nc4ccccc34)c5ccccc5	BroadT	BRD-K14388439	BRD-K14388439-001-05-8	ChemBridge Corporation	7258783			O=C(Nc1nc2CCCCc2s1)c1cc(nc2ccccc12)-c1ccccc1	InChI=1S/C23H19N3OS/c27-22(26-23-25-19-12-6-7-13-21(19)28-23)17-14-20(15-8-2-1-3-9-15)24-18-11-5-4-10-16(17)18/h1-5,8-11,14H,6-7,12-13H2,(H,25,26,27)	XMWLVEYNTBHDOP-UHFFFAOYSA-N	385.124882948							112927
ST039328	LSM-24338	SID7977546, BRD-K28173112	706621	InChI=1S/C9H7N7/c1-2-4-7(5-3-1)16-10-6-8(13-16)9-11-14-15-12-9/h1-6H,(H,11,12,14,15)	SGEBOFZTVYARIF-UHFFFAOYSA-N	c1ccc(cc1)n2ncc(n2)c3nn[nH]n3	BroadT	BRD-K28173112	BRD-K28173112-001-05-2	ChemBridge Corporation	7094725			c1nn(nc1-c1nn[nH]n1)-c1ccccc1	InChI=1S/C9H7N7/c1-2-4-7(5-3-1)16-10-6-8(13-16)9-11-14-15-12-9/h1-6H,(H,11,12,14,15)	SGEBOFZTVYARIF-UHFFFAOYSA-N	213.076293294							112928
MLS000678056	LSM-24339	SID24791081, BRD-K43512273	1601742	InChI=1S/C16H15N5O4S2/c1-2-24-13(23)7-11-8-26-15(18-11)19-12(22)9-27-16-21-20-14(25-16)10-3-5-17-6-4-10/h3-6,8H,2,7,9H2,1H3,(H,18,19,22)	YEVDZZSSVACMAI-UHFFFAOYSA-N	CCOC(=O)Cc1csc(NC(=O)CSc2oc(nn2)c3ccncc3)n1	BroadT	BRD-K43512273	BRD-K43512273-001-07-3	Asinex Ltd.	BAS 05228497			CCOC(=O)Cc1csc(NC(=O)CSc2nnc(o2)-c2ccncc2)n1	InChI=1S/C16H15N5O4S2/c1-2-24-13(23)7-11-8-26-15(18-11)19-12(22)9-27-16-21-20-14(25-16)10-3-5-17-6-4-10/h3-6,8H,2,7,9H2,1H3,(H,18,19,22)	YEVDZZSSVACMAI-UHFFFAOYSA-N	405.05654539							112929
AC1O9A34	LSM-24340	SID843293, BRD-K85382133	6752885	InChI=1S/C20H24N4O2S/c1-4-23(5-2)18(26)13-27-20-22-21-19(24(20)6-3)16-11-14-9-7-8-10-15(14)12-17(16)25/h7-12,25H,4-6,13H2,1-3H3	VVRVXVFZSWROHR-UHFFFAOYSA-N	CCN(CC)C(=O)CSc1nnc(c2cc3ccccc3cc2O)n1CC	BroadT	BRD-K85382133	BRD-K85382133-001-05-4	Asinex Ltd.	ASN 03792177			CCN(CC)C(=O)CSc1nnc(-c2cc3ccccc3cc2O)n1CC	InChI=1S/C20H24N4O2S/c1-4-23(5-2)18(26)13-27-20-22-21-19(24(20)6-3)16-11-14-9-7-8-10-15(14)12-17(16)25/h7-12,25H,4-6,13H2,1-3H3	VVRVXVFZSWROHR-UHFFFAOYSA-N	384.161996738							
4-[3-(2-Chloro-acetyl)-2,5-dimethyl-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-1,2-dihydro-pyrazol-3-one	LSM-24341	SID24829045, BRD-K91857925	5150932	InChI=1S/C19H20ClN3O2/c1-12-10-16(17(24)11-20)13(2)22(12)18-14(3)21(4)23(19(18)25)15-8-6-5-7-9-15/h5-10H,11H2,1-4H3	RGVJYHXOUGSGIM-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)n2c(C)cc(C(=O)CCl)c2C)c3ccccc3	BroadT	BRD-K91857925	BRD-K91857925-001-05-9	Enamine Ltd.	T0514-7149			Cc1cc(C(=O)CCl)c(C)n1-c1c(C)n(C)n(-c2ccccc2)c1=O	InChI=1S/C19H20ClN3O2/c1-12-10-16(17(24)11-20)13(2)22(12)18-14(3)21(4)23(19(18)25)15-8-6-5-7-9-15/h5-10H,11H2,1-4H3	RGVJYHXOUGSGIM-UHFFFAOYSA-N	357.12440462							112931
ZINC05886339	LSM-24342	SID26658106, BRD-K13651102	3265879	InChI=1S/C19H19N3O3S/c1-13-8-10-15(26(24,25)22(2)3)12-18(13)21-19(23)17-11-9-14-6-4-5-7-16(14)20-17/h4-12H,1-3H3,(H,21,23)	UBTSHEROONDURQ-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)c2ccc3ccccc3n2)c1	BroadT	BRD-K13651102	BRD-K13651102-001-05-6	Enamine Ltd.	T5277954			CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)c2ccc3ccccc3n2)c1	InChI=1S/C19H19N3O3S/c1-13-8-10-15(26(24,25)22(2)3)12-18(13)21-19(23)17-11-9-14-6-4-5-7-16(14)20-17/h4-12H,1-3H3,(H,21,23)	UBTSHEROONDURQ-UHFFFAOYSA-N	369.114712188							112932
ZINC03329975	LSM-24343	SID49673576, BRD-K69560621	2445991	InChI=1S/C12H5F3N2O2S/c13-5-4-7-10(9(15)8(5)14)16-12(20-7)17-11(18)6-2-1-3-19-6/h1-4H,(H,16,17,18)	ZKQCCNKYYIXCEG-UHFFFAOYSA-N	Fc1cc2sc(NC(=O)c3occc3)nc2c(F)c1F	BroadT	BRD-K69560621	BRD-K69560621-001-06-2	Enamine Ltd.	T0517-9937			Fc1cc2sc(NC(=O)c3ccco3)nc2c(F)c1F	InChI=1S/C12H5F3N2O2S/c13-5-4-7-10(9(15)8(5)14)16-12(20-7)17-11(18)6-2-1-3-19-6/h1-4H,(H,16,17,18)	ZKQCCNKYYIXCEG-UHFFFAOYSA-N	298.00238271							112933
F1830-0065	LSM-24344	SID24824212, BRD-K20428530	7475011	InChI=1S/C20H19N3O4S/c1-21-19(27)17-13-6-3-7-14(13)28-20(17)22-18(26)11-4-2-5-12(10-11)23-15(24)8-9-16(23)25/h2,4-5,10H,3,6-9H2,1H3,(H,21,27)(H,22,26)	ZCUCCDVVNGGAQN-UHFFFAOYSA-N	CNC(=O)c1c2CCCc2sc1NC(=O)c3cccc(c3)N4C(=O)CCC4=O	BroadT	BRD-K20428530	BRD-K20428530-001-05-2	Life Chemicals Inc.	F1830-0065			CNC(=O)c1c(NC(=O)c2cccc(c2)N2C(=O)CCC2=O)sc2CCCc12	InChI=1S/C20H19N3O4S/c1-21-19(27)17-13-6-3-7-14(13)28-20(17)22-18(26)11-4-2-5-12(10-11)23-15(24)8-9-16(23)25/h2,4-5,10H,3,6-9H2,1H3,(H,21,27)(H,22,26)	ZCUCCDVVNGGAQN-UHFFFAOYSA-N	397.109626808							112934
AC1LDC9H	LSM-24345	BRD-K65677104	645799	InChI=1S/C13H11NO3S/c15-14-10-11-6-4-5-9-13(11)18(16,17)12-7-2-1-3-8-12/h1-10,15H	JNCUWKUUGNHOQU-UHFFFAOYSA-N	ON=Cc1ccccc1S(=O)(=O)c2ccccc2	BroadT	BRD-K65677104	BRD-K65677104-001-05-6	Asinex Ltd.	BAS 00529614			ON=Cc1ccccc1S(=O)(=O)c1ccccc1	InChI=1S/C13H11NO3S/c15-14-10-11-6-4-5-9-13(11)18(16,17)12-7-2-1-3-8-12/h1-10,15H	JNCUWKUUGNHOQU-UHFFFAOYSA-N	261.045963912							112935
[4-(3-Bromo-benzyl)-piperazin-1-yl]-pyridin-3-yl-methanone	LSM-15557	BRD-K65841363	1112864	InChI=1S/C17H18BrN3O/c18-16-5-1-3-14(11-16)13-20-7-9-21(10-8-20)17(22)15-4-2-6-19-12-15/h1-6,11-12H,7-10,13H2	BMBJRLGGSKOAPR-UHFFFAOYSA-N	Brc1cccc(CN2CCN(CC2)C(=O)c3cccnc3)c1	BroadT	BRD-K65841363	BRD-K65841363-034-05-5	Asinex Ltd.	BAS 01042054		OC(=O)C(=O)O	Brc1cccc(CN2CCN(CC2)C(=O)c2cccnc2)c1.OC(=O)C(=O)O	InChI=1S/C17H18BrN3O.C2H2O4/c18-16-5-1-3-14(11-16)13-20-7-9-21(10-8-20)17(22)15-4-2-6-19-12-15;3-1(4)2(5)6/h1-6,11-12H,7-10,13H2;(H,3,4)(H,5,6)	WWGBTJWMKFBPOR-UHFFFAOYSA-N	359.063324826							104193, 104193
SMR000241302	LSM-24346	SID22410548, BRD-A32677088	3505573	InChI=1S/C24H28ClN3O4S/c25-20-8-6-18(7-9-20)24(30)27-14-4-5-19(17-27)23(29)26-21-10-12-22(13-11-21)33(31,32)28-15-2-1-3-16-28/h6-13,19H,1-5,14-17H2,(H,26,29)	BDQMSTOKANDUKD-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)N2CCCC(C2)C(=O)Nc3ccc(cc3)S(=O)(=O)N4CCCCC4	BroadT	BRD-A32677088	BRD-A32677088-001-05-8	Enamine Ltd.	T5246115			Clc1ccc(cc1)C(=O)N1CCCC(C1)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCCC1	InChI=1S/C24H28ClN3O4S/c25-20-8-6-18(7-9-20)24(30)27-14-4-5-19(17-27)23(29)26-21-10-12-22(13-11-21)33(31,32)28-15-2-1-3-16-28/h6-13,19H,1-5,14-17H2,(H,26,29)	BDQMSTOKANDUKD-UHFFFAOYSA-N	489.148904806							112936
Methyl 4-chloro-3-[(2-methyl-3-nitrobenzoyl)amino]benzoate	LSM-24347	SID24793120, BRD-K76448177	956292	InChI=1S/C16H13ClN2O5/c1-9-11(4-3-5-14(9)19(22)23)15(20)18-13-8-10(16(21)24-2)6-7-12(13)17/h3-8H,1-2H3,(H,18,20)	MDLHXDJFBNRUMM-UHFFFAOYSA-N	COC(=O)c1ccc(Cl)c(NC(=O)c2cccc(c2C)[N+](=O)[O-])c1	BroadT	BRD-K76448177	BRD-K76448177-001-05-1	ChemBridge Corporation	7816817			COC(=O)c1ccc(Cl)c(NC(=O)c2cccc(c2C)[N+]([O-])=O)c1	InChI=1S/C16H13ClN2O5/c1-9-11(4-3-5-14(9)19(22)23)15(20)18-13-8-10(16(21)24-2)6-7-12(13)17/h3-8H,1-2H3,(H,18,20)	MDLHXDJFBNRUMM-UHFFFAOYSA-N	348.051299246							112937
2-(2-Acetylamino-acetylamino)-3-phenyl-propionic acid ethyl ester	LSM-24348	SID853323, BRD-A21476289	655982	InChI=1S/C15H20N2O4/c1-3-21-15(20)13(9-12-7-5-4-6-8-12)17-14(19)10-16-11(2)18/h4-8,13H,3,9-10H2,1-2H3,(H,16,18)(H,17,19)	QOEKXHGEAZMFRR-UHFFFAOYSA-N	CCOC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)C	BroadT	BRD-A21476289	BRD-A21476289-001-05-5	Asinex Ltd.	BAS 01247744			CCOC(=O)C(Cc1ccccc1)NC(=O)CNC(C)=O	InChI=1S/C15H20N2O4/c1-3-21-15(20)13(9-12-7-5-4-6-8-12)17-14(19)10-16-11(2)18/h4-8,13H,3,9-10H2,1-2H3,(H,16,18)(H,17,19)	QOEKXHGEAZMFRR-UHFFFAOYSA-N	292.14230714							112938
AC1MJLBL	LSM-24349	BRD-A64030276	3114297	InChI=1S/C13H14N2O2/c1-9(15-17)8-13(16)12-7-6-10-4-2-3-5-11(10)14-12/h2-7,13,16-17H,8H2,1H3	BRHKOJCUSVQRPC-UHFFFAOYSA-N	CC(=NO)CC(O)c1ccc2ccccc2n1	BroadT	BRD-A64030276	BRD-A64030276-001-05-3	ChemBridge Corporation	5562086			CC(CC(O)c1ccc2ccccc2n1)=NO	InChI=1S/C13H14N2O2/c1-9(15-17)8-13(16)12-7-6-10-4-2-3-5-11(10)14-12/h2-7,13,16-17H,8H2,1H3	BRHKOJCUSVQRPC-UHFFFAOYSA-N	230.105527708							112939
AC1MHBSZ	LSM-24350	SID3716045, BRD-A60074443	2999451	InChI=1S/C13H15N5O2/c19-13(14-8-12-5-2-6-20-12)10-3-1-4-11(7-10)18-9-15-16-17-18/h1,3-4,7,9,12H,2,5-6,8H2,(H,14,19)	DMPFAPRHPKXLTG-UHFFFAOYSA-N	O=C(NCC1CCCO1)c2cccc(c2)n3cnnn3	BroadT	BRD-A60074443	BRD-A60074443-001-05-3	Enamine Ltd.	T5332162			O=C(NCC1CCCO1)c1cccc(c1)-n1cnnn1	InChI=1S/C13H15N5O2/c19-13(14-8-12-5-2-6-20-12)10-3-1-4-11(7-10)18-9-15-16-17-18/h1,3-4,7,9,12H,2,5-6,8H2,(H,14,19)	DMPFAPRHPKXLTG-UHFFFAOYSA-N	273.12257477							112940
AC1NQ6IH	LSM-24351	SID26666271, BRD-K16700055	5216126	InChI=1S/C10H9N3O2S/c14-8-6-16-10(11-8)13-12-9(15)7-4-2-1-3-5-7/h1-5H,6H2,(H,12,15)(H,11,13,14)	VDINZYAYFSSBNF-UHFFFAOYSA-N	O=C(NNC1=NC(=O)CS1)c2ccccc2	BroadT	BRD-K16700055	BRD-K16700055-001-05-5	InterBioScreen Ltd.	STOCK3S-12211			O=C(NNC1=NC(=O)CS1)c1ccccc1	InChI=1S/C10H9N3O2S/c14-8-6-16-10(11-8)13-12-9(15)7-4-2-1-3-5-7/h1-5H,6H2,(H,12,15)(H,11,13,14)	VDINZYAYFSSBNF-UHFFFAOYSA-N	235.041547248							112941
HMS2896B05	LSM-24352	BRD-K47929197	24762092	InChI=1S/C17H14N4O3/c1-24-12-8-6-11(7-9-12)15(17(22)23)20-21-16-13-4-2-3-5-14(13)18-10-19-16/h2-10H,1H3,(H,22,23)(H,18,19,21)	KZEPPMVJOZODEK-UHFFFAOYSA-N	COc1ccc(cc1)C(=NNc2ncnc3ccccc23)C(=O)O	BroadT	BRD-K47929197	BRD-K47929197-001-05-2	Enamine Ltd.	T5581570			COc1ccc(cc1)C(=NNc1ncnc2ccccc12)C(O)=O	InChI=1S/C17H14N4O3/c1-24-12-8-6-11(7-9-12)15(17(22)23)20-21-16-13-4-2-3-5-14(13)18-10-19-16/h2-10H,1H3,(H,22,23)(H,18,19,21)	KZEPPMVJOZODEK-UHFFFAOYSA-N	322.106590348							112942
MLS000665871	LSM-24353	SID24803762, BRD-A62658112	2957716	InChI=1S/C20H34N2OS/c1-2-4-18(22-19(24)21-13-17-5-3-6-23-17)20-10-14-7-15(11-20)9-16(8-14)12-20/h14-18H,2-13H2,1H3,(H2,21,22,24)	HXGHHMVEEJLYLB-UHFFFAOYSA-N	CCCC(N=C(S)NCC1CCCO1)C23CC4CC(CC(C4)C2)C3	BroadT	BRD-A62658112	BRD-A62658112-001-06-9	ChemBridge Corporation	7836487			CCCC(N=C(S)NCC1CCCO1)C12CC3CC(CC(C3)C1)C2	InChI=1S/C20H34N2OS/c1-2-4-18(22-19(24)21-13-17-5-3-6-23-17)20-10-14-7-15(11-20)9-16(8-14)12-20/h14-18H,2-13H2,1H3,(H2,21,22,24)	HXGHHMVEEJLYLB-UHFFFAOYSA-N	350.239184418							112943
BAS 07778938	LSM-24354	SID14726041, BRD-K13145947	1090776	InChI=1S/C17H13N5O2S/c1-10(23)11-4-6-12(7-5-11)22-16(20-21-17(22)25)14-9-13(18-19-14)15-3-2-8-24-15/h2-9H,1H3,(H,18,19)(H,21,25)	YIVILBJKJXYRIP-UHFFFAOYSA-N	CC(=O)c1ccc(cc1)n2c(S)nnc2c3cc([nH]n3)c4occc4	BroadT	BRD-K13145947	BRD-K13145947-001-05-8	Asinex Ltd.	BAS 07778938			CC(=O)c1ccc(cc1)-n1c(S)nnc1-c1cc([nH]n1)-c1ccco1	InChI=1S/C17H13N5O2S/c1-10(23)11-4-6-12(7-5-11)22-16(20-21-17(22)25)14-9-13(18-19-14)15-3-2-8-24-15/h2-9H,1H3,(H,18,19)(H,21,25)	YIVILBJKJXYRIP-UHFFFAOYSA-N	351.078995396							112944
STK130670	LSM-24355	SID24806821, BRD-K84429103	1333464	InChI=1S/C18H13N3O5/c22-17(12-6-8-15(9-7-12)21(24)25)19-13-3-1-4-14(11-13)20-18(23)16-5-2-10-26-16/h1-11H,(H,19,22)(H,20,23)	GZNCMWBKSPZEFS-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)C(=O)Nc2cccc(NC(=O)c3occc3)c2	BroadT	BRD-K84429103	BRD-K84429103-001-06-8	ChemBridge Corporation	6698761			[O-][N+](=O)c1ccc(cc1)C(=O)Nc1cccc(NC(=O)c2ccco2)c1	InChI=1S/C18H13N3O5/c22-17(12-6-8-15(9-7-12)21(24)25)19-13-3-1-4-14(11-13)20-18(23)16-5-2-10-26-16/h1-11H,(H,19,22)(H,20,23)	GZNCMWBKSPZEFS-UHFFFAOYSA-N	351.085520546							112945
2-(2,5-Dimethoxy-phenyl)-5-(5-methyl-furan-2-yl)-[1,3,4]oxadiazole	LSM-24356	SID842315, BRD-K36559317	644574	InChI=1S/C15H14N2O4/c1-9-4-6-13(20-9)15-17-16-14(21-15)11-8-10(18-2)5-7-12(11)19-3/h4-8H,1-3H3	OKEQHMGHHFSGJW-UHFFFAOYSA-N	COc1ccc(OC)c(c1)c2oc(nn2)c3oc(C)cc3	BroadT	BRD-K36559317	BRD-K36559317-001-05-5	Asinex Ltd.	ASN 03157167			COc1ccc(OC)c(c1)-c1nnc(o1)-c1ccc(C)o1	InChI=1S/C15H14N2O4/c1-9-4-6-13(20-9)15-17-16-14(21-15)11-8-10(18-2)5-7-12(11)19-3/h4-8H,1-3H3	OKEQHMGHHFSGJW-UHFFFAOYSA-N	286.095356948							112946
ASN 03067318	LSM-24357	SID24802155, BRD-K48929882	3169072	InChI=1S/C17H20N4O5S2/c22-16(19-20-17(27)18-12-14-2-1-9-26-14)13-3-5-15(6-4-13)28(23,24)21-7-10-25-11-8-21/h1-6,9H,7-8,10-12H2,(H,19,22)(H2,18,20,27)	SCLBTDFQKJNYEE-UHFFFAOYSA-N	O=C(NNC(=S)NCc1occc1)c2ccc(cc2)S(=O)(=O)N3CCOCC3	BroadT	BRD-K48929882	BRD-K48929882-001-05-1	Asinex Ltd.	ASN 03067318			O=C(NNC(=S)NCc1ccco1)c1ccc(cc1)S(=O)(=O)N1CCOCC1	InChI=1S/C17H20N4O5S2/c22-16(19-20-17(27)18-12-14-2-1-9-26-14)13-3-5-15(6-4-13)28(23,24)21-7-10-25-11-8-21/h1-6,9H,7-8,10-12H2,(H,19,22)(H2,18,20,27)	SCLBTDFQKJNYEE-UHFFFAOYSA-N	424.08751116							112947
MLS001116266	LSM-24358	SID24391039, SID49737033, BRD-K03709743	16013706	InChI=1S/C16H17N3O3/c1-5-12-15(19-22-18-12)17-16(20)14-10(4)11-6-8(2)9(3)7-13(11)21-14/h6-7H,5H2,1-4H3,(H,17,19,20)	ORDJNQPBZKWWFR-UHFFFAOYSA-N	CCc1nonc1NC(=O)c2oc3cc(C)c(C)cc3c2C	BroadT	BRD-K03709743	BRD-K03709743-001-05-9	ChemDiv Inc.	D160-0088			CCc1nonc1NC(=O)c1oc2cc(C)c(C)cc2c1C	InChI=1S/C16H17N3O3/c1-5-12-15(19-22-18-12)17-16(20)14-10(4)11-6-8(2)9(3)7-13(11)21-14/h6-7H,5H2,1-4H3,(H,17,19,20)	ORDJNQPBZKWWFR-UHFFFAOYSA-N	299.126991434							112948
F1602-0395	LSM-24359	SID22402343, BRD-K08564028	2135408	InChI=1S/C25H18ClFN2O4/c1-33-19-10-11-22-20(12-19)25(32)21(24(31)15-2-4-16(26)5-3-15)13-29(22)14-23(30)28-18-8-6-17(27)7-9-18/h2-13H,14H2,1H3,(H,28,30)	YGCBSIWMODDUCX-UHFFFAOYSA-N	COc1ccc2N(CC(=O)Nc3ccc(F)cc3)C=C(C(=O)c4ccc(Cl)cc4)C(=O)c2c1	BroadT	BRD-K08564028	BRD-K08564028-001-04-2	Life Chemicals Inc.	F1602-0395			COc1ccc2n(CC(=O)Nc3ccc(F)cc3)cc(C(=O)c3ccc(Cl)cc3)c(=O)c2c1	InChI=1S/C25H18ClFN2O4/c1-33-19-10-11-22-20(12-19)25(32)21(24(31)15-2-4-16(26)5-3-15)13-29(22)14-23(30)28-18-8-6-17(27)7-9-18/h2-13H,14H2,1H3,(H,28,30)	YGCBSIWMODDUCX-UHFFFAOYSA-N	464.093912986							112949
AC1NTWC1	LSM-15365	BRD-A56325018	5389695	InChI=1S/C14H18FN3OS/c1-3-9(2)12(16)13-17-18-14(19-13)20-8-10-5-4-6-11(15)7-10/h4-7,9,12H,3,8,16H2,1-2H3/t9?,12-/m0/s1	GALYNSRAFSHBLM-ACGXKRRESA-N	CCC(C)[C@H](N)c1oc(SCc2cccc(F)c2)nn1	BroadT	BRD-A56325018	BRD-A56325018-003-05-6	InterBioScreen Ltd.	STOCK4S-31952		Cl	CCC(C)[C@H](N)c1nnc(SCc2cccc(F)c2)o1.Cl	InChI=1S/C14H18FN3OS.ClH/c1-3-9(2)12(16)13-17-18-14(19-13)20-8-10-5-4-6-11(15)7-10;/h4-7,9,12H,3,8,16H2,1-2H3;1H/t9?,12-;/m0./s1	DUQHFQIKYFIHLU-RLOOEAFISA-N	295.115461116							131234, 131234
STOCK3S-45580	LSM-24360	BRD-M29610145	5923095	InChI=1S/C18H13ClN6OS/c19-10-4-2-1-3-7(10)8-5-11(26)24-18-12(8)15-13(17(23)27-18)14(21)9(6-20)16(22)25-15/h1-4,8,23H,5H2,(H,24,26)(H4,21,22,25)	IABMISNOPMLJAR-UHFFFAOYSA-N	Nc1nc2C3=C(NC(=O)CC3c4ccccc4Cl)SC(=N)c2c(N)c1C#N	BroadT	BRD-M29610145	BRD-M29610145-001-06-9	InterBioScreen Ltd.	STOCK3S-45580		CN(C)C=O.Nc1nc2c3C(CC(=O)Nc3sc(=N)c2c(N)c1C#N)c1ccccc1Cl	CN(C)C=O.Nc1nc2c3C(CC(=O)Nc3sc(=N)c2c(N)c1C#N)c1ccccc1Cl	InChI=1S/C18H13ClN6OS.C3H7NO/c19-10-4-2-1-3-7(10)8-5-11(26)24-18-12(8)15-13(17(23)27-18)14(21)9(6-20)16(22)25-15;1-4(2)3-5/h1-4,8,23H,5H2,(H,24,26)(H4,21,22,25);3H,1-2H3	YUOLTVMXCXONDF-UHFFFAOYSA-N	396.056007496							
AC1MCDYW	LSM-24361	BRD-K04007157	2767281	InChI=1S/C11H10ClF3N6/c1-20(2)5-17-10-18-6-21(19-10)9-8(12)3-7(4-16-9)11(13,14)15/h3-6H,1-2H3	IKXKJIHLPZXBCM-UHFFFAOYSA-N	CN(C)C=Nc1ncn(n1)c2ncc(cc2Cl)C(F)(F)F	BroadT	BRD-K04007157	BRD-K04007157-001-05-6	Key Organics Ltd.	11J-028			CN(C)C=Nc1ncn(n1)-c1ncc(cc1Cl)C(F)(F)F	InChI=1S/C11H10ClF3N6/c1-20(2)5-17-10-18-6-21(19-10)9-8(12)3-7(4-16-9)11(13,14)15/h3-6H,1-2H3	IKXKJIHLPZXBCM-UHFFFAOYSA-N	318.06075669							112951
MLS000116363	LSM-24362	SID124360642, SID7965344, BRD-K51509019	5307570	InChI=1S/C13H20N2O2/c1-2-6-11-9-12(15-17-11)13(16)14-10-7-4-3-5-8-10/h9-10H,2-8H2,1H3,(H,14,16)	UWYFUCDLJDTNBA-UHFFFAOYSA-N	CCCc1onc(c1)C(=O)NC2CCCCC2	BroadT	BRD-K51509019	BRD-K51509019-001-05-1	ChemDiv Inc.	C226-2975			CCCc1cc(no1)C(=O)NC1CCCCC1	InChI=1S/C13H20N2O2/c1-2-6-11-9-12(15-17-11)13(16)14-10-7-4-3-5-8-10/h9-10H,2-8H2,1H3,(H,14,16)	UWYFUCDLJDTNBA-UHFFFAOYSA-N	236.1524779							112952
AC1M1ACJ	LSM-24363	BRD-K83885658	2091630	InChI=1S/C18H21N3O2/c1-14-4-8-16(9-5-14)20-18(22)13-23-19-12-15-6-10-17(11-7-15)21(2)3/h4-12H,13H2,1-3H3,(H,20,22)	YONMVYHOCRREDG-UHFFFAOYSA-N	CN(C)c1ccc(C=NOCC(=O)Nc2ccc(C)cc2)cc1	BroadT	BRD-K83885658	BRD-K83885658-001-05-3	Enamine Ltd.	T5270762			CN(C)c1ccc(C=NOCC(=O)Nc2ccc(C)cc2)cc1	InChI=1S/C18H21N3O2/c1-14-4-8-16(9-5-14)20-18(22)13-23-19-12-15-6-10-17(11-7-15)21(2)3/h4-12H,13H2,1-3H3,(H,20,22)	YONMVYHOCRREDG-UHFFFAOYSA-N	311.163376942							112953
ZINC02999987	LSM-24364	SID22415658, BRD-K18141685	2296181	InChI=1S/C16H20N2O2S/c19-14(12-7-3-1-4-8-12)11-17-16(21)18-15(20)13-9-5-2-6-10-13/h1,3-4,7-8,13H,2,5-6,9-11H2,(H2,17,18,20,21)	KZVIPIXFHCEYGJ-UHFFFAOYSA-N	O=C(CNC(=S)NC(=O)C1CCCCC1)c2ccccc2	BroadT	BRD-K18141685	BRD-K18141685-001-05-8	ChemBridge Corporation	6993473			O=C(CNC(=S)NC(=O)C1CCCCC1)c1ccccc1	InChI=1S/C16H20N2O2S/c19-14(12-7-3-1-4-8-12)11-17-16(21)18-15(20)13-9-5-2-6-10-13/h1,3-4,7-8,13H,2,5-6,9-11H2,(H2,17,18,20,21)	KZVIPIXFHCEYGJ-UHFFFAOYSA-N	304.12454859							112954
N-[(1-Adamantylamino)carbonyl]-2-chloroacetamide	LSM-24365	SID22402056, BRD-K66760553	2378425	InChI=1S/C13H19ClN2O2/c14-7-11(17)15-12(18)16-13-4-8-1-9(5-13)3-10(2-8)6-13/h8-10H,1-7H2,(H2,15,16,17,18)	OBLFEICGDWLKQF-UHFFFAOYSA-N	ClCC(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	BroadT	BRD-K66760553	BRD-K66760553-001-06-3	Enamine Ltd.	T0513-1152			ClCC(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	InChI=1S/C13H19ClN2O2/c14-7-11(17)15-12(18)16-13-4-8-1-9(5-13)3-10(2-8)6-13/h8-10H,1-7H2,(H2,15,16,17,18)	OBLFEICGDWLKQF-UHFFFAOYSA-N	270.113505578							112955
SMR000022344	LSM-24366	SID4246314, BRD-K31384616	3240678	InChI=1S/C15H11F3N4O/c16-15(17,18)13-7-11(12-4-2-6-23-12)21-14(22-13)20-9-10-3-1-5-19-8-10/h1-8H,9H2,(H,20,21,22)	RXTRJDSQWVCBET-UHFFFAOYSA-N	FC(F)(F)c1cc(nc(NCc2cccnc2)n1)c3occc3	BroadT	BRD-K31384616	BRD-K31384616-001-05-1	ChemDiv Inc.	C130-0488			FC(F)(F)c1cc(nc(NCc2cccnc2)n1)-c1ccco1	InChI=1S/C15H11F3N4O/c16-15(17,18)13-7-11(12-4-2-6-23-12)21-14(22-13)20-9-10-3-1-5-19-8-10/h1-8H,9H2,(H,20,21,22)	RXTRJDSQWVCBET-UHFFFAOYSA-N	320.088495612							112956
ST50852444	LSM-24367	SID49819218, BRD-K41273072	2211231	InChI=1S/C19H20F2N4O2S/c1-11-3-5-14(9-12(11)2)22-17(26)7-8-18(27)24-25-19(28)23-16-6-4-13(20)10-15(16)21/h3-6,9-10H,7-8H2,1-2H3,(H,22,26)(H,24,27)(H2,23,25,28)	ISEJNKGTTUGAIX-UHFFFAOYSA-N	Cc1ccc(NC(=O)CCC(=O)NN=C(S)Nc2ccc(F)cc2F)cc1C	BroadT	BRD-K41273072	BRD-K41273072-001-05-1	ChemBridge Corporation	7831296			Cc1ccc(NC(=O)CCC(=O)NN=C(S)Nc2ccc(F)cc2F)cc1C	InChI=1S/C19H20F2N4O2S/c1-11-3-5-14(9-12(11)2)22-17(26)7-8-18(27)24-25-19(28)23-16-6-4-13(20)10-15(16)21/h3-6,9-10H,7-8H2,1-2H3,(H,22,26)(H,24,27)(H2,23,25,28)	ISEJNKGTTUGAIX-UHFFFAOYSA-N	406.12750301							112957
Propyl 4-[(2-nitrobenzoyl)amino]benzoate	LSM-24368	SID24804765, BRD-K47972240	2164898	InChI=1S/C17H16N2O5/c1-2-11-24-17(21)12-7-9-13(10-8-12)18-16(20)14-5-3-4-6-15(14)19(22)23/h3-10H,2,11H2,1H3,(H,18,20)	ZABJJVACMOYEEP-UHFFFAOYSA-N	CCCOC(=O)c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1	BroadT	BRD-K47972240	BRD-K47972240-001-05-9	Asinex Ltd.	BAS 00623732			CCCOC(=O)c1ccc(NC(=O)c2ccccc2[N+]([O-])=O)cc1	InChI=1S/C17H16N2O5/c1-2-11-24-17(21)12-7-9-13(10-8-12)18-16(20)14-5-3-4-6-15(14)19(22)23/h3-10H,2,11H2,1H3,(H,18,20)	ZABJJVACMOYEEP-UHFFFAOYSA-N	328.105921632							112958
MLS000736974	LSM-24369	NSC-95909, BRD-K28342012	262424	InChI=1S/C15H10N2O3/c18-13-12(14(19)17-15(20)16-13)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-8H,(H2,16,17,18,19,20)	FDEWNHZLVHMLEY-UHFFFAOYSA-N	O=C1NC(=O)C(=Cc2ccc3ccccc3c2)C(=O)N1	BroadT	BRD-K28342012	BRD-K28342012-001-05-4	National Cancer Institute Chemotherapeutic Agents Repository	95909			O=C1NC(=O)C(=Cc2ccc3ccccc3c2)C(=O)N1	InChI=1S/C15H10N2O3/c18-13-12(14(19)17-15(20)16-13)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-8H,(H2,16,17,18,19,20)	FDEWNHZLVHMLEY-UHFFFAOYSA-N	266.0691422							112959
ST50133582	LSM-24370	SID24803856, BRD-K70783599	1322062	InChI=1S/C18H14F3N3O2S/c1-10-7-12(14-15(25)22-17(27)23-16(14)26)8-13(18(19,20)21)24(10)9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H2,22,23,25,26,27)	MNGXUGSTRXRLNI-UHFFFAOYSA-N	CC1=CC(=C2C(=O)NC(=S)NC2=O)C=C(N1Cc3ccccc3)C(F)(F)F	BroadT	BRD-K70783599	BRD-K70783599-001-06-5	ChemBridge Corporation	6662748			CC1=CC(C=C(N1Cc1ccccc1)C(F)(F)F)=C1C(=O)NC(=S)NC1=O	InChI=1S/C18H14F3N3O2S/c1-10-7-12(14-15(25)22-17(27)23-16(14)26)8-13(18(19,20)21)24(10)9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H2,22,23,25,26,27)	MNGXUGSTRXRLNI-UHFFFAOYSA-N	393.075882008							112960
STK592480	LSM-24371	SID26666728, BRD-K08194153	1833583	InChI=1S/C16H12BrN5OS/c1-9-4-5-13(10(17)7-9)22-15(20-21-16(22)24)12-8-11(18-19-12)14-3-2-6-23-14/h2-8H,1H3,(H,18,19)(H,21,24)	ZPOMFEHBKFPZBT-UHFFFAOYSA-N	Cc1ccc(c(Br)c1)n2c(S)nnc2c3cc([nH]n3)c4occc4	BroadT	BRD-K08194153	BRD-K08194153-001-06-0	InterBioScreen Ltd.	STOCK3S-45817			Cc1ccc(c(Br)c1)-n1c(S)nnc1-c1cc([nH]n1)-c1ccco1	InChI=1S/C16H12BrN5OS/c1-9-4-5-13(10(17)7-9)22-15(20-21-16(22)24)12-8-11(18-19-12)14-3-2-6-23-14/h2-8H,1H3,(H,18,19)(H,21,24)	ZPOMFEHBKFPZBT-UHFFFAOYSA-N	400.994593344							112961
BRD-K14487280	LSM-9306		54649045	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17+,21-/m1/s1	OIIKGOKDOCINHJ-LLGFUMIMSA-N	CO[C@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K14487280	BRD-K14487280-001-01-7	Broad Institute of MIT and Harvard	BRD-K14487280			CO[C@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17+,21-/m1/s1	OIIKGOKDOCINHJ-LLGFUMIMSA-N	453.263899482							97927
BRD-K44225498	LSM-11127		54649252	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18+,21-/m0/s1	SBBAPVWHPDIFCH-UEXGIBASSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K44225498	BRD-K44225498-001-01-3	Broad Institute of MIT and Harvard	BRD-K44225498			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18+,21-/m0/s1	SBBAPVWHPDIFCH-UEXGIBASSA-N	464.209340854							99748
BRD-K93490141	LSM-14162		54649043	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17+,21+/m0/s1	OIIKGOKDOCINHJ-CSODHUTKSA-N	CO[C@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K93490141	BRD-K93490141-001-01-4	Broad Institute of MIT and Harvard	BRD-K93490141			CO[C@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17+,21+/m0/s1	OIIKGOKDOCINHJ-CSODHUTKSA-N	453.263899482							102816
BRD-K00223956	LSM-8437		54649178	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19+,23+/m1/s1	NDGBDPWBOPYDPZ-MSYCTHLASA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K00223956	BRD-K00223956-001-01-5	Broad Institute of MIT and Harvard	BRD-K00223956			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19+,23+/m1/s1	NDGBDPWBOPYDPZ-MSYCTHLASA-N	480.209421066							97058
BRD-K43963447	LSM-11111		54649018	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18-,24-/m0/s1	DMFJOGMIMQDBLX-XFAGBWLFSA-N	CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K43963447	BRD-K43963447-001-01-2	Broad Institute of MIT and Harvard	BRD-K43963447			CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18-,24-/m0/s1	DMFJOGMIMQDBLX-XFAGBWLFSA-N	475.248249418							99732
BRD-K53813421	LSM-11699		54649105	InChI=1S/C23H31ClF2N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23-/m0/s1	UIWWHFNWICLZIF-MFEFFIJZSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K53813421	BRD-K53813421-001-01-6	Broad Institute of MIT and Harvard	BRD-K53813421			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H31ClF2N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23-/m0/s1	UIWWHFNWICLZIF-MFEFFIJZSA-N	504.166112292							100324
BRD-K32563579	LSM-10405		54649139	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19+,24+/m1/s1	XFQUVXMASIHRAZ-IMWIBFENSA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K32563579	BRD-K32563579-001-01-3	Broad Institute of MIT and Harvard	BRD-K32563579			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19+,24+/m1/s1	XFQUVXMASIHRAZ-IMWIBFENSA-N	506.208672138							99026
BRD-K63279176	LSM-12278		54649223	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m1/s1	KNLROJRONDBMAV-YVHKJVDXSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K63279176	BRD-K63279176-001-01-5	Broad Institute of MIT and Harvard	BRD-K63279176			CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m1/s1	KNLROJRONDBMAV-YVHKJVDXSA-N	536.12178399							100904
BRD-K60860515	LSM-12113		54649186	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18-,22-/m1/s1	PETXHQBGDUFNPW-JBYIUTFZSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K60860515	BRD-K60860515-001-01-5	Broad Institute of MIT and Harvard	BRD-K60860515			CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18-,22-/m1/s1	PETXHQBGDUFNPW-JBYIUTFZSA-N	481.204670044							100739
BRD-K02132857	LSM-8565		54649127	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20+/m0/s1	FDINZZIDFRBVPX-TWOQFEAHSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K02132857	BRD-K02132857-001-01-6	Broad Institute of MIT and Harvard	BRD-K02132857			CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20+/m0/s1	FDINZZIDFRBVPX-TWOQFEAHSA-N	484.154718468							97186
BRD-K62761144	LSM-12241		54649244	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23-/m0/s1	REZGKQRSIIUNQT-IXFSTUDKSA-N	CO[C@@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K62761144	BRD-K62761144-001-01-2	Broad Institute of MIT and Harvard	BRD-K62761144			CO[C@@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23-/m0/s1	REZGKQRSIIUNQT-IXFSTUDKSA-N	481.189897366							100867
BRD-K87123346	LSM-13771		54649150	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22+/m0/s1	FWFBMTYWKZBKQZ-PNLZDCPESA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K87123346	BRD-K87123346-001-01-2	Broad Institute of MIT and Harvard	BRD-K87123346			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22+/m0/s1	FWFBMTYWKZBKQZ-PNLZDCPESA-N	500.15479868							102420
BRD-K58835910	LSM-11984		54649181	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19+,23-/m0/s1	NDGBDPWBOPYDPZ-YYDVJCTNSA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K58835910	BRD-K58835910-001-01-2	Broad Institute of MIT and Harvard	BRD-K58835910			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19+,23-/m0/s1	NDGBDPWBOPYDPZ-YYDVJCTNSA-N	480.209421066							100610
BRD-K24986598	LSM-9946		54649145	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	FWFBMTYWKZBKQZ-HOIFWPIMSA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K24986598	BRD-K24986598-001-01-3	Broad Institute of MIT and Harvard	BRD-K24986598			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	FWFBMTYWKZBKQZ-HOIFWPIMSA-N	500.15479868							98567
BRD-K16344244	LSM-9414		54649071	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	IVUAVXPBXQRVFC-BSRJHKFKSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K16344244	BRD-K16344244-001-01-3	Broad Institute of MIT and Harvard	BRD-K16344244			CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	IVUAVXPBXQRVFC-BSRJHKFKSA-N	486.175534124							98035
BRD-K59633080	LSM-12033		54648995	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	PIEMZAFCKVBYBS-HOIFWPIMSA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K59633080	BRD-K59633080-001-01-4	Broad Institute of MIT and Harvard	BRD-K59633080			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	PIEMZAFCKVBYBS-HOIFWPIMSA-N	484.18434917							100659
BRD-K29636459	LSM-10226		54649036	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18+,23+/m1/s1	NINYSMYJRLQSCV-STSQHVNTSA-N	CO[C@@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K29636459	BRD-K29636459-001-01-7	Broad Institute of MIT and Harvard	BRD-K29636459			CO[C@@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18+,23+/m1/s1	NINYSMYJRLQSCV-STSQHVNTSA-N	515.216254256							98847
BRD-K35440877	LSM-10555		54649026	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22-/m1/s1	QUGGTUJVTWBVOW-DRSNIGMVSA-N	CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K35440877	BRD-K35440877-001-01-0	Broad Institute of MIT and Harvard	BRD-K35440877			CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22-/m1/s1	QUGGTUJVTWBVOW-DRSNIGMVSA-N	515.165697722							99176
BRD-K25498394	LSM-9978		54649062	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	ADONDIFMYIEKMI-BSRJHKFKSA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccccc3	BroadT	BRD-K25498394	BRD-K25498394-001-01-4	Broad Institute of MIT and Harvard	BRD-K25498394			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	ADONDIFMYIEKMI-BSRJHKFKSA-N	492.193022074							98599
BRD-K55380358	LSM-11786		54649082	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18+,20+/m0/s1	APKXKRHWPGHKNH-NLWGTHIKSA-N	CO[C@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K55380358	BRD-K55380358-001-01-1	Broad Institute of MIT and Harvard	BRD-K55380358			CO[C@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18+,20+/m0/s1	APKXKRHWPGHKNH-NLWGTHIKSA-N	455.191247946							100411
BRD-K25090764	LSM-9953		54649054	InChI=1S/C20H30FN3O4S2/c1-15(19(28-4)12-23(3)13-20-22-9-10-29-20)11-24(16(2)14-25)30(26,27)18-7-5-17(21)6-8-18/h5-10,15-16,19,25H,11-14H2,1-4H3/t15-,16+,19-/m0/s1	HDBUQVYPKWOJFH-FCEWJHQRSA-N	CO[C@@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K25090764	BRD-K25090764-001-01-1	Broad Institute of MIT and Harvard	BRD-K25090764			CO[C@@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O4S2/c1-15(19(28-4)12-23(3)13-20-22-9-10-29-20)11-24(16(2)14-25)30(26,27)18-7-5-17(21)6-8-18/h5-10,15-16,19,25H,11-14H2,1-4H3/t15-,16+,19-/m0/s1	HDBUQVYPKWOJFH-FCEWJHQRSA-N	459.16617605							98574
BRD-K69954048	LSM-12699		54649242	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23-/m1/s1	REZGKQRSIIUNQT-IEGUWTFLSA-N	CO[C@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K69954048	BRD-K69954048-001-01-3	Broad Institute of MIT and Harvard	BRD-K69954048			CO[C@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23-/m1/s1	REZGKQRSIIUNQT-IEGUWTFLSA-N	481.189897366							101334
BRD-K40543019	LSM-10905		54649000	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	PIEMZAFCKVBYBS-JKSBSHDWSA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K40543019	BRD-K40543019-001-01-3	Broad Institute of MIT and Harvard	BRD-K40543019			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	PIEMZAFCKVBYBS-JKSBSHDWSA-N	484.18434917							99526
BRD-K85498716	LSM-13655		54649140	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19+,24+/m0/s1	XFQUVXMASIHRAZ-XLNZFTOWSA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K85498716	BRD-K85498716-001-01-2	Broad Institute of MIT and Harvard	BRD-K85498716			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19+,24+/m0/s1	XFQUVXMASIHRAZ-XLNZFTOWSA-N	506.208672138							102302
CHEMBL2356000	LSM-14306	BRD-K95877457, SID131445592	54649193	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	WFGAJOALFFTPKS-HOIFWPIMSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K95877457	BRD-K95877457-001-01-8	Broad Institute of MIT and Harvard	BRD-K95877457			CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	WFGAJOALFFTPKS-HOIFWPIMSA-N	552.0922335							102960
BRD-K89146275	LSM-13917		54649138	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19-,24-/m1/s1	XFQUVXMASIHRAZ-KHCICDEESA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K89146275	BRD-K89146275-001-01-6	Broad Institute of MIT and Harvard	BRD-K89146275			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19-,24-/m1/s1	XFQUVXMASIHRAZ-KHCICDEESA-N	506.208672138							102570
BRD-K90140894	LSM-13989		54649158	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23+/m0/s1	OEVRCWMHWGKQED-IUKKYPGJSA-N	CO[C@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K90140894	BRD-K90140894-001-01-7	Broad Institute of MIT and Harvard	BRD-K90140894			CO[C@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23+/m0/s1	OEVRCWMHWGKQED-IUKKYPGJSA-N	465.219447856							102642
BRD-K03643699	LSM-8655		54649172	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19+,23-/m1/s1	BNYRIOADMGPGIR-SELNLUPBSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K03643699	BRD-K03643699-001-01-3	Broad Institute of MIT and Harvard	BRD-K03643699			CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19+,23-/m1/s1	BNYRIOADMGPGIR-SELNLUPBSA-N	468.184955956							97276
BRD-K45147071	LSM-11176		54649092	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19-,23+/m0/s1	FYUSSFRUYFLLAK-SFYKDHMMSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K45147071	BRD-K45147071-001-01-3	Broad Institute of MIT and Harvard	BRD-K45147071			CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19-,23+/m0/s1	FYUSSFRUYFLLAK-SFYKDHMMSA-N	532.146855886							99797
BRD-K99100793	LSM-14512		54649279	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16+,22+/m0/s1	IBBRHRMMLVXSHB-WJONJSRFSA-N	CO[C@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K99100793	BRD-K99100793-001-01-4	Broad Institute of MIT and Harvard	BRD-K99100793			CO[C@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16+,22+/m0/s1	IBBRHRMMLVXSHB-WJONJSRFSA-N	513.15974009							103167
BRD-K38991762	LSM-10789		54649137	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19-,24-/m0/s1	XFQUVXMASIHRAZ-JXQFQVJHSA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K38991762	BRD-K38991762-001-01-7	Broad Institute of MIT and Harvard	BRD-K38991762			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19-,24-/m0/s1	XFQUVXMASIHRAZ-JXQFQVJHSA-N	506.208672138							99410
BRD-K22041611	LSM-9762		54649282	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16-,22+/m1/s1	IBBRHRMMLVXSHB-MCFFVMPBSA-N	CO[C@@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K22041611	BRD-K22041611-001-01-2	Broad Institute of MIT and Harvard	BRD-K22041611			CO[C@@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16-,22+/m1/s1	IBBRHRMMLVXSHB-MCFFVMPBSA-N	513.15974009							98383
BRD-K55193076	LSM-11772		54649133	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22+/m0/s1	PIYRLUCWZXVSBU-GSHUGGBRSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K55193076	BRD-K55193076-001-01-9	Broad Institute of MIT and Harvard	BRD-K55193076			CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22+/m0/s1	PIYRLUCWZXVSBU-GSHUGGBRSA-N	515.165697722							100397
BRD-K27610514	LSM-10091		54648978	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19-,24+/m1/s1	VKCFDPYGFDYBIC-IECBHUPTSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K27610514	BRD-K27610514-001-01-7	Broad Institute of MIT and Harvard	BRD-K27610514			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19-,24+/m1/s1	VKCFDPYGFDYBIC-IECBHUPTSA-N	484.220734678							98712
BRD-K95434109	LSM-14278		54648973	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19+,24+/m0/s1	VKCFDPYGFDYBIC-XLNZFTOWSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K95434109	BRD-K95434109-001-01-0	Broad Institute of MIT and Harvard	BRD-K95434109			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19+,24+/m0/s1	VKCFDPYGFDYBIC-XLNZFTOWSA-N	484.220734678							102932
BRD-K23628394	LSM-9850		54648983	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16+,19-/m1/s1	APPCZAALLCDYNG-JTDSTZFVSA-N	CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K23628394	BRD-K23628394-001-01-8	Broad Institute of MIT and Harvard	BRD-K23628394			CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16+,19-/m1/s1	APPCZAALLCDYNG-JTDSTZFVSA-N	485.210818064							98471
CHEMBL3188201	LSM-9760	BRD-K22010555	54649093	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19-,23+/m1/s1	FYUSSFRUYFLLAK-PWHSHALESA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K22010555	BRD-K22010555-001-01-5	Broad Institute of MIT and Harvard	BRD-K22010555			CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19-,23+/m1/s1	FYUSSFRUYFLLAK-PWHSHALESA-N	532.146855886							98381
BRD-K86250735	LSM-13711		54649285	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18+,21+/m0/s1	SLHJHGLJXJFOQY-WAOWUJCRSA-N	CO[C@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K86250735	BRD-K86250735-001-01-3	Broad Institute of MIT and Harvard	BRD-K86250735			CO[C@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18+,21+/m0/s1	SLHJHGLJXJFOQY-WAOWUJCRSA-N	456.229407582							102359
BRD-K37920059	LSM-10723		54649097	InChI=1S/C24H31FN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23+/m0/s1	QPCRGZWITIZHEP-YGKZAACZSA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K37920059	BRD-K37920059-001-01-9	Broad Institute of MIT and Harvard	BRD-K37920059			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H31FN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23+/m0/s1	QPCRGZWITIZHEP-YGKZAACZSA-N	510.183600242							99344
BRD-K88943141	LSM-13897		54649008	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17+,23-/m0/s1	JTIGHJUHEGWKGG-MFEFFIJZSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K88943141	BRD-K88943141-001-01-9	Broad Institute of MIT and Harvard	BRD-K88943141			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17+,23-/m0/s1	JTIGHJUHEGWKGG-MFEFFIJZSA-N	517.236382914							102550
BRD-K21386069	LSM-9727		54649129	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22-/m0/s1	PIYRLUCWZXVSBU-HOIFWPIMSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K21386069	BRD-K21386069-001-01-9	Broad Institute of MIT and Harvard	BRD-K21386069			CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22-/m0/s1	PIYRLUCWZXVSBU-HOIFWPIMSA-N	515.165697722							98348
BRD-K97163189	LSM-14398		54649038	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18+,23-/m1/s1	NINYSMYJRLQSCV-IEGUWTFLSA-N	CO[C@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K97163189	BRD-K97163189-001-01-6	Broad Institute of MIT and Harvard	BRD-K97163189			CO[C@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18+,23-/m1/s1	NINYSMYJRLQSCV-IEGUWTFLSA-N	515.216254256							103052
BRD-K56398628	LSM-11841		54649113	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17-,20+/m1/s1	RULZJLKRRRCHIA-HLIPFELVSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K56398628	BRD-K56398628-001-01-6	Broad Institute of MIT and Harvard	BRD-K56398628			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17-,20+/m1/s1	RULZJLKRRRCHIA-HLIPFELVSA-N	450.19369079							100467
BRD-K90613621	LSM-14010		54649121	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20+/m1/s1	DJBLUNZOFTWTAE-QINHECLXSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K90613621	BRD-K90613621-001-01-3	Broad Institute of MIT and Harvard	BRD-K90613621			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20+/m1/s1	DJBLUNZOFTWTAE-QINHECLXSA-N	468.184268958							102663
BRD-K28276103	LSM-10140		54649187	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18+,22+/m0/s1	PETXHQBGDUFNPW-NJNPRVFISA-N	CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K28276103	BRD-K28276103-001-01-3	Broad Institute of MIT and Harvard	BRD-K28276103			CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18+,22+/m0/s1	PETXHQBGDUFNPW-NJNPRVFISA-N	481.204670044							98761
BRD-K16514883	LSM-9429		54649245	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23+/m0/s1	REZGKQRSIIUNQT-IUKKYPGJSA-N	CO[C@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K16514883	BRD-K16514883-001-01-7	Broad Institute of MIT and Harvard	BRD-K16514883			CO[C@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23+/m0/s1	REZGKQRSIIUNQT-IUKKYPGJSA-N	481.189897366							98050
BRD-K51844455	LSM-11602		54649063	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	ADONDIFMYIEKMI-STSQHVNTSA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccccc3	BroadT	BRD-K51844455	BRD-K51844455-001-01-2	Broad Institute of MIT and Harvard	BRD-K51844455			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	ADONDIFMYIEKMI-STSQHVNTSA-N	492.193022074							100225
BRD-K74078391	LSM-12962		54648997	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	PIEMZAFCKVBYBS-DRSNIGMVSA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K74078391	BRD-K74078391-001-01-7	Broad Institute of MIT and Harvard	BRD-K74078391			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	PIEMZAFCKVBYBS-DRSNIGMVSA-N	484.18434917							101599
BRD-K67933714	LSM-12569		54649076	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	IVUAVXPBXQRVFC-IXFSTUDKSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K67933714	BRD-K67933714-001-01-2	Broad Institute of MIT and Harvard	BRD-K67933714			CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	IVUAVXPBXQRVFC-IXFSTUDKSA-N	486.175534124							101200
BRD-K68361061	LSM-12598		54649022	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18+,24-/m1/s1	DMFJOGMIMQDBLX-NXMSCROESA-N	CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K68361061	BRD-K68361061-001-01-4	Broad Institute of MIT and Harvard	BRD-K68361061			CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18+,24-/m1/s1	DMFJOGMIMQDBLX-NXMSCROESA-N	475.248249418							101230
BRD-K50832163	LSM-11530		54649101	InChI=1S/C23H31ClF2N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17-,23-/m0/s1	UIWWHFNWICLZIF-QQMNAOGKSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K50832163	BRD-K50832163-001-01-1	Broad Institute of MIT and Harvard	BRD-K50832163			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H31ClF2N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17-,23-/m0/s1	UIWWHFNWICLZIF-QQMNAOGKSA-N	504.166112292							100153
BRD-K05078233	LSM-8736		54649176	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19-,23-/m0/s1	NDGBDPWBOPYDPZ-YDHSSHFGSA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K05078233	BRD-K05078233-001-01-3	Broad Institute of MIT and Harvard	BRD-K05078233			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19-,23-/m0/s1	NDGBDPWBOPYDPZ-YDHSSHFGSA-N	480.209421066							97357
BRD-K87373784	LSM-13788		54649208	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22-/m0/s1	CZAUCXDPQANXEN-SPEDKVCISA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K87373784	BRD-K87373784-001-01-2	Broad Institute of MIT and Harvard	BRD-K87373784			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22-/m0/s1	CZAUCXDPQANXEN-SPEDKVCISA-N	466.193771002							102437
BRD-K96752633	LSM-14373		54649204	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	JYNGQINEBKOLSY-IEGUWTFLSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K96752633	BRD-K96752633-001-01-9	Broad Institute of MIT and Harvard	BRD-K96752633			CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	JYNGQINEBKOLSY-IEGUWTFLSA-N	502.145983634							103027
BRD-K23233872	LSM-9833		54648987	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20-,24-/m1/s1	OWPXWWCVMFAFIQ-YOSAUDMPSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K23233872	BRD-K23233872-001-01-8	Broad Institute of MIT and Harvard	BRD-K23233872			CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20-,24-/m1/s1	OWPXWWCVMFAFIQ-YOSAUDMPSA-N	482.20060602							98454
BRD-K47926873	LSM-11344		54649225	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17-,21-/m1/s1	NYUANTAUILYKHE-CBGDNZLLSA-N	CO[C@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K47926873	BRD-K47926873-001-01-8	Broad Institute of MIT and Harvard	BRD-K47926873			CO[C@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17-,21-/m1/s1	NYUANTAUILYKHE-CBGDNZLLSA-N	503.260705882							99965
BRD-K48040318	LSM-11352		54649180	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19+,23+/m0/s1	NDGBDPWBOPYDPZ-YCRNBWNJSA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K48040318	BRD-K48040318-001-01-0	Broad Institute of MIT and Harvard	BRD-K48040318			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19+,23+/m0/s1	NDGBDPWBOPYDPZ-YCRNBWNJSA-N	480.209421066							99973
BRD-K56601439	LSM-11851		54649130	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22-/m1/s1	PIYRLUCWZXVSBU-DRSNIGMVSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K56601439	BRD-K56601439-001-01-2	Broad Institute of MIT and Harvard	BRD-K56601439			CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22-/m1/s1	PIYRLUCWZXVSBU-DRSNIGMVSA-N	515.165697722							100477
BRD-K63865470	LSM-12323		54649084	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18-,20+/m1/s1	APKXKRHWPGHKNH-GGPKGHCWSA-N	CO[C@@H](CN(C)Cc1nccs1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K63865470	BRD-K63865470-001-01-4	Broad Institute of MIT and Harvard	BRD-K63865470			CO[C@@H](CN(C)Cc1nccs1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18-,20+/m1/s1	APKXKRHWPGHKNH-GGPKGHCWSA-N	455.191247946							100950
BRD-K44478610	LSM-11134		54649148	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22+/m1/s1	FWFBMTYWKZBKQZ-JLHGSKIFSA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K44478610	BRD-K44478610-001-01-1	Broad Institute of MIT and Harvard	BRD-K44478610			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22+/m1/s1	FWFBMTYWKZBKQZ-JLHGSKIFSA-N	500.15479868							99755
BRD-K56747890	LSM-11858		54648976	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19+,24-/m0/s1	VKCFDPYGFDYBIC-GLDPYIMESA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K56747890	BRD-K56747890-001-01-5	Broad Institute of MIT and Harvard	BRD-K56747890			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19+,24-/m0/s1	VKCFDPYGFDYBIC-GLDPYIMESA-N	484.220734678							100484
BRD-K55624132	LSM-11796		54649141	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19+,24-/m1/s1	XFQUVXMASIHRAZ-YDIMBITNSA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K55624132	BRD-K55624132-001-01-5	Broad Institute of MIT and Harvard	BRD-K55624132			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19+,24-/m1/s1	XFQUVXMASIHRAZ-YDIMBITNSA-N	506.208672138							100421
BRD-K80253007	LSM-13333		54649066	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	ADONDIFMYIEKMI-IEGUWTFLSA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccccc3	BroadT	BRD-K80253007	BRD-K80253007-001-01-4	Broad Institute of MIT and Harvard	BRD-K80253007			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	ADONDIFMYIEKMI-IEGUWTFLSA-N	492.193022074							101972
BRD-K14061746	LSM-9277		54649070	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	IVUAVXPBXQRVFC-PMAPCBKXSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K14061746	BRD-K14061746-001-01-8	Broad Institute of MIT and Harvard	BRD-K14061746			CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	IVUAVXPBXQRVFC-PMAPCBKXSA-N	486.175534124							97898
BRD-K76732672	LSM-13126		54649259	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22+,28-/m1/s1	XSSRKRLNCLGOQF-RZIGYZOXSA-N	CO[C@H](CN(C)Cc1ccc(cc1)c2ccccn2)[C@H](C)CN([C@@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K76732672	BRD-K76732672-001-01-7	Broad Institute of MIT and Harvard	BRD-K76732672			CO[C@H](CN(C)Cc1ccc(cc1)-c1ccccn1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22+,28-/m1/s1	XSSRKRLNCLGOQF-RZIGYZOXSA-N	508.284969284							101764
BRD-K97722965	LSM-14432		54649099	InChI=1S/C24H31FN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23-/m0/s1	QPCRGZWITIZHEP-MFEFFIJZSA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K97722965	BRD-K97722965-001-01-9	Broad Institute of MIT and Harvard	BRD-K97722965			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H31FN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23-/m0/s1	QPCRGZWITIZHEP-MFEFFIJZSA-N	510.183600242							103087
BRD-K64860117	LSM-12389		54649265	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19+,23+/m1/s1	IMMALVOVYMCCKV-MSYCTHLASA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K64860117	BRD-K64860117-001-01-3	Broad Institute of MIT and Harvard	BRD-K64860117			CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19+,23+/m1/s1	IMMALVOVYMCCKV-MSYCTHLASA-N	495.220320108							101016
BRD-K67798781	LSM-12563		54649074	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	IVUAVXPBXQRVFC-IEGUWTFLSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K67798781	BRD-K67798781-001-01-7	Broad Institute of MIT and Harvard	BRD-K67798781			CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	IVUAVXPBXQRVFC-IEGUWTFLSA-N	486.175534124							101194
BRD-K02442093	LSM-8584		54649218	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m1/s1	KNLROJRONDBMAV-JLHGSKIFSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K02442093	BRD-K02442093-001-01-3	Broad Institute of MIT and Harvard	BRD-K02442093			CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m1/s1	KNLROJRONDBMAV-JLHGSKIFSA-N	536.12178399							97205
BRD-K48307191	LSM-11369		54648974	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19+,24+/m1/s1	VKCFDPYGFDYBIC-IMWIBFENSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K48307191	BRD-K48307191-001-01-5	Broad Institute of MIT and Harvard	BRD-K48307191			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19+,24+/m1/s1	VKCFDPYGFDYBIC-IMWIBFENSA-N	484.220734678							99990
BRD-K19616315	LSM-9613		54649190	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18+,22-/m0/s1	PETXHQBGDUFNPW-SVMVAKDDSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K19616315	BRD-K19616315-001-01-5	Broad Institute of MIT and Harvard	BRD-K19616315			CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18+,22-/m0/s1	PETXHQBGDUFNPW-SVMVAKDDSA-N	481.204670044							98234
BRD-K30446755	LSM-10264		54649001	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22+/m0/s1	PIEMZAFCKVBYBS-PNLZDCPESA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K30446755	BRD-K30446755-001-01-9	Broad Institute of MIT and Harvard	BRD-K30446755			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22+/m0/s1	PIEMZAFCKVBYBS-PNLZDCPESA-N	484.18434917							98885
BRD-K18144986	LSM-9515		54649154	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23-/m1/s1	OEVRCWMHWGKQED-PMAPCBKXSA-N	CO[C@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K18144986	BRD-K18144986-001-01-7	Broad Institute of MIT and Harvard	BRD-K18144986			CO[C@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23-/m1/s1	OEVRCWMHWGKQED-PMAPCBKXSA-N	465.219447856							98136
BRD-K12767001	LSM-9184		54649035	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18-,23-/m0/s1	NINYSMYJRLQSCV-BSRJHKFKSA-N	CO[C@@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K12767001	BRD-K12767001-001-01-2	Broad Institute of MIT and Harvard	BRD-K12767001			CO[C@@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18-,23-/m0/s1	NINYSMYJRLQSCV-BSRJHKFKSA-N	515.216254256							97805
BRD-K67480908	LSM-12535		54649203	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23+/m0/s1	JYNGQINEBKOLSY-YZZKKUAISA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K67480908	BRD-K67480908-001-01-0	Broad Institute of MIT and Harvard	BRD-K67480908			CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23+/m0/s1	JYNGQINEBKOLSY-YZZKKUAISA-N	502.145983634							101166
BRD-K89427926	LSM-13938		54649050	InChI=1S/C20H30FN3O4S2/c1-15(19(28-4)12-23(3)13-20-22-9-10-29-20)11-24(16(2)14-25)30(26,27)18-7-5-17(21)6-8-18/h5-10,15-16,19,25H,11-14H2,1-4H3/t15-,16-,19-/m0/s1	HDBUQVYPKWOJFH-BXWFABGCSA-N	CO[C@@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K89427926	BRD-K89427926-001-01-3	Broad Institute of MIT and Harvard	BRD-K89427926			CO[C@@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O4S2/c1-15(19(28-4)12-23(3)13-20-22-9-10-29-20)11-24(16(2)14-25)30(26,27)18-7-5-17(21)6-8-18/h5-10,15-16,19,25H,11-14H2,1-4H3/t15-,16-,19-/m0/s1	HDBUQVYPKWOJFH-BXWFABGCSA-N	459.16617605							102591
BRD-K36516410	LSM-10635		54648982	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16+,19+/m1/s1	APPCZAALLCDYNG-GJYPPUQNSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K36516410	BRD-K36516410-001-01-0	Broad Institute of MIT and Harvard	BRD-K36516410			CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16+,19+/m1/s1	APPCZAALLCDYNG-GJYPPUQNSA-N	485.210818064							99256
BRD-K55659732	LSM-11799		54649171	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19+,23+/m0/s1	BNYRIOADMGPGIR-YCRNBWNJSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K55659732	BRD-K55659732-001-01-5	Broad Institute of MIT and Harvard	BRD-K55659732			CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19+,23+/m0/s1	BNYRIOADMGPGIR-YCRNBWNJSA-N	468.184955956							100424
BRD-K99763083	LSM-14557		54649199	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m1/s1	WFGAJOALFFTPKS-YVHKJVDXSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K99763083	BRD-K99763083-001-01-8	Broad Institute of MIT and Harvard	BRD-K99763083			CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m1/s1	WFGAJOALFFTPKS-YVHKJVDXSA-N	552.0922335							103213
CHEMBL3184100	LSM-10935	BRD-K41190238	54649088	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19+,23+/m1/s1	FYUSSFRUYFLLAK-MSYCTHLASA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K41190238	BRD-K41190238-001-01-7	Broad Institute of MIT and Harvard	BRD-K41190238			CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19+,23+/m1/s1	FYUSSFRUYFLLAK-MSYCTHLASA-N	532.146855886							99556
BRD-K13400061	LSM-9230		54649230	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17+,21-/m0/s1	NYUANTAUILYKHE-FVJLSDCUSA-N	CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K13400061	BRD-K13400061-001-01-6	Broad Institute of MIT and Harvard	BRD-K13400061			CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17+,21-/m0/s1	NYUANTAUILYKHE-FVJLSDCUSA-N	503.260705882							97851
BRD-K19613760	LSM-9612		54649046	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17+,21-/m0/s1	OIIKGOKDOCINHJ-FVJLSDCUSA-N	CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K19613760	BRD-K19613760-001-01-2	Broad Institute of MIT and Harvard	BRD-K19613760			CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17+,21-/m0/s1	OIIKGOKDOCINHJ-FVJLSDCUSA-N	453.263899482							98233
BRD-K74257705	LSM-12973		54649015	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18-,22+/m0/s1	IUSZJOKEOVUDOA-NPPFBWRTSA-N	CO[C@H](CN(C)CC1CCOCC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K74257705	BRD-K74257705-001-01-8	Broad Institute of MIT and Harvard	BRD-K74257705			CO[C@H](CN(C)CC1CCOCC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18-,22+/m0/s1	IUSZJOKEOVUDOA-NPPFBWRTSA-N	439.284634926							101610
BRD-K53931115	LSM-11708		54649271	InChI=1S/C24H31ClN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23+/m1/s1	KWUJCNXGEDOTIS-DGGJZMOXSA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccc(Cl)cc3	BroadT	BRD-K53931115	BRD-K53931115-001-01-7	Broad Institute of MIT and Harvard	BRD-K53931115			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C24H31ClN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23+/m1/s1	KWUJCNXGEDOTIS-DGGJZMOXSA-N	526.154049752							100333
BRD-K02732091	LSM-8606		54649270	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19-,23+/m1/s1	IMMALVOVYMCCKV-PWHSHALESA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K02732091	BRD-K02732091-001-01-9	Broad Institute of MIT and Harvard	BRD-K02732091			CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19-,23+/m1/s1	IMMALVOVYMCCKV-PWHSHALESA-N	495.220320108							97227
BRD-K85773425	LSM-13681		54649169	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19-,23-/m0/s1	BNYRIOADMGPGIR-YDHSSHFGSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K85773425	BRD-K85773425-001-01-0	Broad Institute of MIT and Harvard	BRD-K85773425			CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19-,23-/m0/s1	BNYRIOADMGPGIR-YDHSSHFGSA-N	468.184955956							102329
BRD-K21139275	LSM-9715		54649112	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17+,20-/m0/s1	RULZJLKRRRCHIA-QKLQHJQFSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K21139275	BRD-K21139275-001-01-2	Broad Institute of MIT and Harvard	BRD-K21139275			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17+,20-/m0/s1	RULZJLKRRRCHIA-QKLQHJQFSA-N	450.19369079							98336
BRD-K73255556	LSM-12913		54649021	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18+,24+/m0/s1	DMFJOGMIMQDBLX-HOOSLVGPSA-N	CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K73255556	BRD-K73255556-001-01-3	Broad Institute of MIT and Harvard	BRD-K73255556			CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18+,24+/m0/s1	DMFJOGMIMQDBLX-HOOSLVGPSA-N	475.248249418							101550
BRD-K76084102	LSM-13080		54649247	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18-,21-/m0/s1	SBBAPVWHPDIFCH-WFXMLNOXSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K76084102	BRD-K76084102-001-01-3	Broad Institute of MIT and Harvard	BRD-K76084102			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18-,21-/m0/s1	SBBAPVWHPDIFCH-WFXMLNOXSA-N	464.209340854							101718
BRD-K41844882	LSM-10969		54648975	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19+,24-/m1/s1	VKCFDPYGFDYBIC-YDIMBITNSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K41844882	BRD-K41844882-001-01-8	Broad Institute of MIT and Harvard	BRD-K41844882			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19+,24-/m1/s1	VKCFDPYGFDYBIC-YDIMBITNSA-N	484.220734678							99590
BRD-K89109315	LSM-13912		54649119	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20-/m0/s1	DJBLUNZOFTWTAE-YRNRMSPPSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K89109315	BRD-K89109315-001-01-6	Broad Institute of MIT and Harvard	BRD-K89109315			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20-/m0/s1	DJBLUNZOFTWTAE-YRNRMSPPSA-N	468.184268958							102565
BRD-K10814161	LSM-9085		54649085	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18-,20+/m0/s1	APKXKRHWPGHKNH-CMKODMSKSA-N	CO[C@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K10814161	BRD-K10814161-001-01-0	Broad Institute of MIT and Harvard	BRD-K10814161			CO[C@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18-,20+/m0/s1	APKXKRHWPGHKNH-CMKODMSKSA-N	455.191247946							97706
BRD-K32894756	LSM-10426		54649089	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19+,23+/m0/s1	FYUSSFRUYFLLAK-YCRNBWNJSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K32894756	BRD-K32894756-001-01-7	Broad Institute of MIT and Harvard	BRD-K32894756			CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19+,23+/m0/s1	FYUSSFRUYFLLAK-YCRNBWNJSA-N	532.146855886							99047
BRD-K23901007	LSM-9872		54649016	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18+,22-/m0/s1	IUSZJOKEOVUDOA-SVMVAKDDSA-N	CO[C@@H](CN(C)CC1CCOCC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K23901007	BRD-K23901007-001-01-8	Broad Institute of MIT and Harvard	BRD-K23901007			CO[C@@H](CN(C)CC1CCOCC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18+,22-/m0/s1	IUSZJOKEOVUDOA-SVMVAKDDSA-N	439.284634926							98493
BRD-K23770948	LSM-9863		54649263	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19-,23-/m1/s1	IMMALVOVYMCCKV-DNVFCKCGSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K23770948	BRD-K23770948-001-01-9	Broad Institute of MIT and Harvard	BRD-K23770948			CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19-,23-/m1/s1	IMMALVOVYMCCKV-DNVFCKCGSA-N	495.220320108							98484
BRD-K18009761	LSM-9510		54649009	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17-,23+/m1/s1	JTIGHJUHEGWKGG-QZMQVMSPSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K18009761	BRD-K18009761-001-01-3	Broad Institute of MIT and Harvard	BRD-K18009761			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17-,23+/m1/s1	JTIGHJUHEGWKGG-QZMQVMSPSA-N	517.236382914							98131
BRD-K03346868	LSM-8642		54649042	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17-,21-/m1/s1	OIIKGOKDOCINHJ-CBGDNZLLSA-N	CO[C@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K03346868	BRD-K03346868-001-01-8	Broad Institute of MIT and Harvard	BRD-K03346868			CO[C@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17-,21-/m1/s1	OIIKGOKDOCINHJ-CBGDNZLLSA-N	453.263899482							97263
BRD-K68312364	LSM-12593		54649182	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19-,23+/m0/s1	NDGBDPWBOPYDPZ-SFYKDHMMSA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K68312364	BRD-K68312364-001-01-1	Broad Institute of MIT and Harvard	BRD-K68312364			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19-,23+/m0/s1	NDGBDPWBOPYDPZ-SFYKDHMMSA-N	480.209421066							101225
BRD-K49183852	LSM-11420		54649231	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19-,24-/m1/s1	RDQYWFNTQPCNSM-KHCICDEESA-N	CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)C(=O)c3ccccc3	BroadT	BRD-K49183852	BRD-K49183852-001-01-9	Broad Institute of MIT and Harvard	BRD-K49183852			CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)C(=O)c1ccccc1	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19-,24-/m1/s1	RDQYWFNTQPCNSM-KHCICDEESA-N	442.246772208							100041
BRD-K64266734	LSM-12349		54649143	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19-,24+/m0/s1	XFQUVXMASIHRAZ-AXHZCLLHSA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K64266734	BRD-K64266734-001-01-6	Broad Institute of MIT and Harvard	BRD-K64266734			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19-,24+/m0/s1	XFQUVXMASIHRAZ-AXHZCLLHSA-N	506.208672138							100976
BRD-K03016409	LSM-8621		54649165	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17+,23-/m0/s1	FEKMHVLVYAIVTJ-MFEFFIJZSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K03016409	BRD-K03016409-001-01-3	Broad Institute of MIT and Harvard	BRD-K03016409			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17+,23-/m0/s1	FEKMHVLVYAIVTJ-MFEFFIJZSA-N	467.239576514							97242
BRD-K21498250	LSM-9733		54649273	InChI=1S/C24H31ClN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23-/m1/s1	KWUJCNXGEDOTIS-SAHWJRBASA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccc(Cl)cc3	BroadT	BRD-K21498250	BRD-K21498250-001-01-1	Broad Institute of MIT and Harvard	BRD-K21498250			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C24H31ClN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23-/m1/s1	KWUJCNXGEDOTIS-SAHWJRBASA-N	526.154049752							98354
BRD-K88676137	LSM-13880		54649288	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18-,21+/m0/s1	SLHJHGLJXJFOQY-BBTUJRGHSA-N	CO[C@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K88676137	BRD-K88676137-001-01-1	Broad Institute of MIT and Harvard	BRD-K88676137			CO[C@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18-,21+/m0/s1	SLHJHGLJXJFOQY-BBTUJRGHSA-N	456.229407582							102533
BRD-K45853775	LSM-11222		54649032	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22+/m0/s1	QUGGTUJVTWBVOW-PNLZDCPESA-N	CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K45853775	BRD-K45853775-001-01-5	Broad Institute of MIT and Harvard	BRD-K45853775			CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22+/m0/s1	QUGGTUJVTWBVOW-PNLZDCPESA-N	515.165697722							99843
BRD-K79255795	LSM-13271		54649106	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17-,20-/m0/s1	RULZJLKRRRCHIA-ZWOKBUDYSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K79255795	BRD-K79255795-001-01-8	Broad Institute of MIT and Harvard	BRD-K79255795			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17-,20-/m0/s1	RULZJLKRRRCHIA-ZWOKBUDYSA-N	450.19369079							101910
BRD-K00445923	LSM-8456		54649283	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18-,21-/m0/s1	SLHJHGLJXJFOQY-WFXMLNOXSA-N	CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K00445923	BRD-K00445923-001-01-4	Broad Institute of MIT and Harvard	BRD-K00445923			CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18-,21-/m0/s1	SLHJHGLJXJFOQY-WFXMLNOXSA-N	456.229407582							97077
BRD-K79828436	LSM-13300		54649017	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18-,22+/m1/s1	IUSZJOKEOVUDOA-HMFYCAOWSA-N	CO[C@@H](CN(C)CC1CCOCC1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K79828436	BRD-K79828436-001-01-7	Broad Institute of MIT and Harvard	BRD-K79828436			CO[C@@H](CN(C)CC1CCOCC1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18-,22+/m1/s1	IUSZJOKEOVUDOA-HMFYCAOWSA-N	439.284634926							101939
BRD-K22595386	LSM-9798		54649132	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m1/s1	PIYRLUCWZXVSBU-HYFFOGBASA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K22595386	BRD-K22595386-001-01-0	Broad Institute of MIT and Harvard	BRD-K22595386			CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m1/s1	PIYRLUCWZXVSBU-HYFFOGBASA-N	515.165697722							98419
BRD-K58042174	LSM-11934		54649024	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18+,24-/m0/s1	DMFJOGMIMQDBLX-RHGYRFJNSA-N	CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K58042174	BRD-K58042174-001-01-6	Broad Institute of MIT and Harvard	BRD-K58042174			CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18+,24-/m0/s1	DMFJOGMIMQDBLX-RHGYRFJNSA-N	475.248249418							100560
BRD-K82155738	LSM-13450		54649058	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16+,19-/m1/s1	DUWNSMSZAPHBFZ-JTDSTZFVSA-N	CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K82155738	BRD-K82155738-001-01-5	Broad Institute of MIT and Harvard	BRD-K82155738			CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16+,19-/m1/s1	DUWNSMSZAPHBFZ-JTDSTZFVSA-N	535.207624464							102090
BRD-K99161484	LSM-14521		54649006	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17+,23+/m0/s1	JTIGHJUHEGWKGG-YGKZAACZSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K99161484	BRD-K99161484-001-01-0	Broad Institute of MIT and Harvard	BRD-K99161484			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17+,23+/m0/s1	JTIGHJUHEGWKGG-YGKZAACZSA-N	517.236382914							103176
BRD-K32434708	LSM-10397		54649281	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16+,22-/m0/s1	IBBRHRMMLVXSHB-DMPWYTOCSA-N	CO[C@@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K32434708	BRD-K32434708-001-01-1	Broad Institute of MIT and Harvard	BRD-K32434708			CO[C@@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16+,22-/m0/s1	IBBRHRMMLVXSHB-DMPWYTOCSA-N	513.15974009							99018
BRD-K09761560	LSM-9023		54649209	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22-/m1/s1	CZAUCXDPQANXEN-JBYIUTFZSA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K09761560	BRD-K09761560-001-01-3	Broad Institute of MIT and Harvard	BRD-K09761560			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22-/m1/s1	CZAUCXDPQANXEN-JBYIUTFZSA-N	466.193771002							97644
BRD-K85739307	LSM-13678		54649147	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22+/m0/s1	FWFBMTYWKZBKQZ-GSHUGGBRSA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K85739307	BRD-K85739307-001-01-4	Broad Institute of MIT and Harvard	BRD-K85739307			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22+/m0/s1	FWFBMTYWKZBKQZ-GSHUGGBRSA-N	500.15479868							102325
BRD-K49919280	LSM-11463		54649041	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17-,21-/m0/s1	OIIKGOKDOCINHJ-FIKGOQFSSA-N	CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K49919280	BRD-K49919280-001-01-8	Broad Institute of MIT and Harvard	BRD-K49919280			CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17-,21-/m0/s1	OIIKGOKDOCINHJ-FIKGOQFSSA-N	453.263899482							100084
BRD-K36201355-001-01-6	LSM-24372	BRD-K36201355	54649239	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23-/m0/s1	REZGKQRSIIUNQT-BSRJHKFKSA-N	CO[C@@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K36201355	BRD-K36201355-001-01-6	Broad Institute of MIT and Harvard	BRD-K36201355			CO[C@@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23-/m0/s1	REZGKQRSIIUNQT-BSRJHKFKSA-N	481.189897366							112962
BRD-K83620070	LSM-13542		54649029	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m1/s1	QUGGTUJVTWBVOW-HYFFOGBASA-N	CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K83620070	BRD-K83620070-001-01-3	Broad Institute of MIT and Harvard	BRD-K83620070			CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m1/s1	QUGGTUJVTWBVOW-HYFFOGBASA-N	515.165697722							102184
BRD-K53345186	LSM-11681		54649064	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23+/m0/s1	ADONDIFMYIEKMI-YZZKKUAISA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccccc3	BroadT	BRD-K53345186	BRD-K53345186-001-01-4	Broad Institute of MIT and Harvard	BRD-K53345186			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23+/m0/s1	ADONDIFMYIEKMI-YZZKKUAISA-N	492.193022074							100306
BRD-K73083114	LSM-12902		54649214	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22-/m0/s1	CZAUCXDPQANXEN-SVMVAKDDSA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K73083114	BRD-K73083114-001-01-4	Broad Institute of MIT and Harvard	BRD-K73083114			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22-/m0/s1	CZAUCXDPQANXEN-SVMVAKDDSA-N	466.193771002							101539
BRD-K45184415	LSM-11179		54649073	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	IVUAVXPBXQRVFC-STSQHVNTSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K45184415	BRD-K45184415-001-01-1	Broad Institute of MIT and Harvard	BRD-K45184415			CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	IVUAVXPBXQRVFC-STSQHVNTSA-N	486.175534124							99800
BRD-K85229892	LSM-13639		54649286	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18+,21+/m1/s1	SLHJHGLJXJFOQY-LQWHRVPQSA-N	CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K85229892	BRD-K85229892-001-01-7	Broad Institute of MIT and Harvard	BRD-K85229892			CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18+,21+/m1/s1	SLHJHGLJXJFOQY-LQWHRVPQSA-N	456.229407582							102286
BRD-K30403168	LSM-10261		54649094	InChI=1S/C24H31FN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17-,23-/m0/s1	QPCRGZWITIZHEP-QQMNAOGKSA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K30403168	BRD-K30403168-001-01-1	Broad Institute of MIT and Harvard	BRD-K30403168			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H31FN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17-,23-/m0/s1	QPCRGZWITIZHEP-QQMNAOGKSA-N	510.183600242							98882
BRD-K04922291	LSM-8729		54649206	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23+/m0/s1	JYNGQINEBKOLSY-IUKKYPGJSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K04922291	BRD-K04922291-001-01-2	Broad Institute of MIT and Harvard	BRD-K04922291			CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23+/m0/s1	JYNGQINEBKOLSY-IUKKYPGJSA-N	502.145983634							97350
BRD-K06877934	LSM-8836		54649202	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	JYNGQINEBKOLSY-STSQHVNTSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K06877934	BRD-K06877934-001-01-9	Broad Institute of MIT and Harvard	BRD-K06877934			CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	JYNGQINEBKOLSY-STSQHVNTSA-N	502.145983634							97457
BRD-K94365199	LSM-14213		54649136	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22+/m1/s1	PIYRLUCWZXVSBU-YVHKJVDXSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K94365199	BRD-K94365199-001-01-8	Broad Institute of MIT and Harvard	BRD-K94365199			CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22+/m1/s1	PIYRLUCWZXVSBU-YVHKJVDXSA-N	515.165697722							102867
BRD-K75684970-001-01-0	LSM-24373	BRD-K75684970	54649217	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	KNLROJRONDBMAV-HOIFWPIMSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K75684970	BRD-K75684970-001-01-0	Broad Institute of MIT and Harvard	BRD-K75684970			CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	KNLROJRONDBMAV-HOIFWPIMSA-N	536.12178399							112963
BRD-K71197999	LSM-12776		54649028	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22+/m1/s1	QUGGTUJVTWBVOW-JLHGSKIFSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K71197999	BRD-K71197999-001-01-4	Broad Institute of MIT and Harvard	BRD-K71197999			CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22+/m1/s1	QUGGTUJVTWBVOW-JLHGSKIFSA-N	515.165697722							101413
BRD-K45339826	LSM-11188		54649276	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16-,22-/m0/s1	IBBRHRMMLVXSHB-WCJKSRRJSA-N	CO[C@@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K45339826	BRD-K45339826-001-01-4	Broad Institute of MIT and Harvard	BRD-K45339826			CO[C@@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16-,22-/m0/s1	IBBRHRMMLVXSHB-WCJKSRRJSA-N	513.15974009							99809
BRD-K80394569	LSM-13341		54649201	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	JYNGQINEBKOLSY-PMAPCBKXSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K80394569	BRD-K80394569-001-01-6	Broad Institute of MIT and Harvard	BRD-K80394569			CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	JYNGQINEBKOLSY-PMAPCBKXSA-N	502.145983634							101980
BRD-K94521200	LSM-14221		54649269	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19-,23+/m0/s1	IMMALVOVYMCCKV-SFYKDHMMSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K94521200	BRD-K94521200-001-01-3	Broad Institute of MIT and Harvard	BRD-K94521200			CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19-,23+/m0/s1	IMMALVOVYMCCKV-SFYKDHMMSA-N	495.220320108							102875
BRD-K91581849	LSM-14053		54648981	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16+,19+/m0/s1	APPCZAALLCDYNG-FRQCXROJSA-N	CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K91581849	BRD-K91581849-001-01-7	Broad Institute of MIT and Harvard	BRD-K91581849			CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16+,19+/m0/s1	APPCZAALLCDYNG-FRQCXROJSA-N	485.210818064							102706
BRD-K37993296	LSM-10730		54649044	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17+,21+/m1/s1	OIIKGOKDOCINHJ-WWMYMODYSA-N	CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K37993296	BRD-K37993296-001-01-9	Broad Institute of MIT and Harvard	BRD-K37993296			CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17+,21+/m1/s1	OIIKGOKDOCINHJ-WWMYMODYSA-N	453.263899482							99351
BRD-K97717522	LSM-14430		54649219	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	KNLROJRONDBMAV-HYFFOGBASA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K97717522	BRD-K97717522-001-01-5	Broad Institute of MIT and Harvard	BRD-K97717522			CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	KNLROJRONDBMAV-HYFFOGBASA-N	536.12178399							103085
BRD-K08472586	LSM-8939		54649224	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17-,21-/m0/s1	NYUANTAUILYKHE-FIKGOQFSSA-N	CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K08472586	BRD-K08472586-001-01-8	Broad Institute of MIT and Harvard	BRD-K08472586			CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17-,21-/m0/s1	NYUANTAUILYKHE-FIKGOQFSSA-N	503.260705882							97560
BRD-K15418616	LSM-9351		54649185	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18+,22+/m1/s1	PETXHQBGDUFNPW-FGSXEWAUSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K15418616	BRD-K15418616-001-01-6	Broad Institute of MIT and Harvard	BRD-K15418616			CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18+,22+/m1/s1	PETXHQBGDUFNPW-FGSXEWAUSA-N	481.204670044							97972
BRD-K75092094	LSM-13027		54649128	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20-/m0/s1	FDINZZIDFRBVPX-YRNRMSPPSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K75092094	BRD-K75092094-001-01-7	Broad Institute of MIT and Harvard	BRD-K75092094			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20-/m0/s1	FDINZZIDFRBVPX-YRNRMSPPSA-N	484.154718468							101664
BRD-K99155518	LSM-14519		54649243	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23+/m0/s1	REZGKQRSIIUNQT-YZZKKUAISA-N	CO[C@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K99155518	BRD-K99155518-001-01-2	Broad Institute of MIT and Harvard	BRD-K99155518			CO[C@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23+/m0/s1	REZGKQRSIIUNQT-YZZKKUAISA-N	481.189897366							103174
BRD-K79258593	LSM-13272		54649149	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	FWFBMTYWKZBKQZ-HYFFOGBASA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K79258593	BRD-K79258593-001-01-6	Broad Institute of MIT and Harvard	BRD-K79258593			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	FWFBMTYWKZBKQZ-HYFFOGBASA-N	500.15479868							101911
BRD-K65354878	LSM-12412		54649072	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23+/m0/s1	IVUAVXPBXQRVFC-YZZKKUAISA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K65354878	BRD-K65354878-001-01-5	Broad Institute of MIT and Harvard	BRD-K65354878			CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23+/m0/s1	IVUAVXPBXQRVFC-YZZKKUAISA-N	486.175534124							101039
BRD-K27962962	LSM-10121		54648996	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22+/m0/s1	PIEMZAFCKVBYBS-GSHUGGBRSA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K27962962	BRD-K27962962-001-01-9	Broad Institute of MIT and Harvard	BRD-K27962962			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22+/m0/s1	PIEMZAFCKVBYBS-GSHUGGBRSA-N	484.18434917							98742
BRD-K68219508	LSM-12587		54649025	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18-,24+/m1/s1	DMFJOGMIMQDBLX-GGUMNFRJSA-N	CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K68219508	BRD-K68219508-001-01-5	Broad Institute of MIT and Harvard	BRD-K68219508			CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18-,24+/m1/s1	DMFJOGMIMQDBLX-GGUMNFRJSA-N	475.248249418							101218
BRD-K73109344	LSM-12905		54649081	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18+,20-/m1/s1	APKXKRHWPGHKNH-WSTZPKSXSA-N	CO[C@H](CN(C)Cc1nccs1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K73109344	BRD-K73109344-001-01-9	Broad Institute of MIT and Harvard	BRD-K73109344			CO[C@H](CN(C)Cc1nccs1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18+,20-/m1/s1	APKXKRHWPGHKNH-WSTZPKSXSA-N	455.191247946							101542
BRD-K67241457	LSM-12521		54649053	InChI=1S/C20H30FN3O4S2/c1-15(19(28-4)12-23(3)13-20-22-9-10-29-20)11-24(16(2)14-25)30(26,27)18-7-5-17(21)6-8-18/h5-10,15-16,19,25H,11-14H2,1-4H3/t15-,16+,19-/m1/s1	HDBUQVYPKWOJFH-JTDSTZFVSA-N	CO[C@H](CN(C)Cc1nccs1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K67241457	BRD-K67241457-001-01-1	Broad Institute of MIT and Harvard	BRD-K67241457			CO[C@H](CN(C)Cc1nccs1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O4S2/c1-15(19(28-4)12-23(3)13-20-22-9-10-29-20)11-24(16(2)14-25)30(26,27)18-7-5-17(21)6-8-18/h5-10,15-16,19,25H,11-14H2,1-4H3/t15-,16+,19-/m1/s1	HDBUQVYPKWOJFH-JTDSTZFVSA-N	459.16617605							101152
BRD-K76931353	LSM-13137		54649228	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17+,21-/m1/s1	NYUANTAUILYKHE-LLGFUMIMSA-N	CO[C@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K76931353	BRD-K76931353-001-01-1	Broad Institute of MIT and Harvard	BRD-K76931353			CO[C@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17+,21-/m1/s1	NYUANTAUILYKHE-LLGFUMIMSA-N	503.260705882							101775
BRD-K73196232	LSM-12912		54649010	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18-,22-/m1/s1	IUSZJOKEOVUDOA-JBYIUTFZSA-N	CO[C@H](CN(C)CC1CCOCC1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K73196232	BRD-K73196232-001-01-1	Broad Institute of MIT and Harvard	BRD-K73196232			CO[C@H](CN(C)CC1CCOCC1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18-,22-/m1/s1	IUSZJOKEOVUDOA-JBYIUTFZSA-N	439.284634926							101549
BRD-K86985145	LSM-13764		54649205	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	JYNGQINEBKOLSY-IXFSTUDKSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K86985145	BRD-K86985145-001-01-8	Broad Institute of MIT and Harvard	BRD-K86985145			CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	JYNGQINEBKOLSY-IXFSTUDKSA-N	502.145983634							102413
BRD-K36261261	LSM-10620		54649266	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19+,23+/m0/s1	IMMALVOVYMCCKV-YCRNBWNJSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K36261261	BRD-K36261261-001-01-3	Broad Institute of MIT and Harvard	BRD-K36261261			CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19+,23+/m0/s1	IMMALVOVYMCCKV-YCRNBWNJSA-N	495.220320108							99241
BRD-K10275859	LSM-9052		54649019	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18-,24-/m1/s1	DMFJOGMIMQDBLX-QZTZHPFYSA-N	CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K10275859	BRD-K10275859-001-01-1	Broad Institute of MIT and Harvard	BRD-K10275859			CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18-,24-/m1/s1	DMFJOGMIMQDBLX-QZTZHPFYSA-N	475.248249418							97673
BRD-K06550805	LSM-8812		54649157	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23-/m0/s1	OEVRCWMHWGKQED-IXFSTUDKSA-N	CO[C@@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K06550805	BRD-K06550805-001-01-8	Broad Institute of MIT and Harvard	BRD-K06550805			CO[C@@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23-/m0/s1	OEVRCWMHWGKQED-IXFSTUDKSA-N	465.219447856							97433
BRD-K42553302	LSM-11007		54649222	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m0/s1	KNLROJRONDBMAV-PNLZDCPESA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K42553302	BRD-K42553302-001-01-6	Broad Institute of MIT and Harvard	BRD-K42553302			CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m0/s1	KNLROJRONDBMAV-PNLZDCPESA-N	536.12178399							99628
BRD-K67689741	LSM-12550		54649142	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19+,24-/m0/s1	XFQUVXMASIHRAZ-GLDPYIMESA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K67689741	BRD-K67689741-001-01-7	Broad Institute of MIT and Harvard	BRD-K67689741			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19+,24-/m0/s1	XFQUVXMASIHRAZ-GLDPYIMESA-N	506.208672138							101181
BRD-K94685656	LSM-14229		54649161	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17-,23-/m0/s1	FEKMHVLVYAIVTJ-QQMNAOGKSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K94685656	BRD-K94685656-001-01-5	Broad Institute of MIT and Harvard	BRD-K94685656			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17-,23-/m0/s1	FEKMHVLVYAIVTJ-QQMNAOGKSA-N	467.239576514							102883
BRD-K28709114	LSM-10170		54649013	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18+,22+/m0/s1	IUSZJOKEOVUDOA-NJNPRVFISA-N	CO[C@H](CN(C)CC1CCOCC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K28709114	BRD-K28709114-001-01-0	Broad Institute of MIT and Harvard	BRD-K28709114			CO[C@H](CN(C)CC1CCOCC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18+,22+/m0/s1	IUSZJOKEOVUDOA-NJNPRVFISA-N	439.284634926							98791
BRD-K17863985	LSM-9501		54649159	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23+/m1/s1	OEVRCWMHWGKQED-PNCHPQGNSA-N	CO[C@@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K17863985	BRD-K17863985-001-01-4	Broad Institute of MIT and Harvard	BRD-K17863985			CO[C@@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23+/m1/s1	OEVRCWMHWGKQED-PNCHPQGNSA-N	465.219447856							98122
BRD-K07357513	LSM-8859		54649237	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19+,24-/m0/s1	RDQYWFNTQPCNSM-GLDPYIMESA-N	CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)C(=O)c3ccccc3	BroadT	BRD-K07357513	BRD-K07357513-001-01-0	Broad Institute of MIT and Harvard	BRD-K07357513			CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)C(=O)c1ccccc1	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19+,24-/m0/s1	RDQYWFNTQPCNSM-GLDPYIMESA-N	442.246772208							97480
BRD-K76261045	LSM-13091		54648999	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	PIEMZAFCKVBYBS-HYFFOGBASA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K76261045	BRD-K76261045-001-01-7	Broad Institute of MIT and Harvard	BRD-K76261045			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	PIEMZAFCKVBYBS-HYFFOGBASA-N	484.18434917							101729
BRD-K71892893	LSM-12834		54649039	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18-,23+/m0/s1	NINYSMYJRLQSCV-IUKKYPGJSA-N	CO[C@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K71892893	BRD-K71892893-001-01-7	Broad Institute of MIT and Harvard	BRD-K71892893			CO[C@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18-,23+/m0/s1	NINYSMYJRLQSCV-IUKKYPGJSA-N	515.216254256							101471
BRD-K10813758	LSM-9084		54649284	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18-,21-/m1/s1	SLHJHGLJXJFOQY-DBXWQHBBSA-N	CO[C@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K10813758	BRD-K10813758-001-01-1	Broad Institute of MIT and Harvard	BRD-K10813758			CO[C@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18-,21-/m1/s1	SLHJHGLJXJFOQY-DBXWQHBBSA-N	456.229407582							97705
BRD-K65350890	LSM-12411		54649098	InChI=1S/C24H31FN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23-/m1/s1	QPCRGZWITIZHEP-SAHWJRBASA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K65350890	BRD-K65350890-001-01-7	Broad Institute of MIT and Harvard	BRD-K65350890			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H31FN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23-/m1/s1	QPCRGZWITIZHEP-SAHWJRBASA-N	510.183600242							101038
BRD-K50648023	LSM-11510		54649005	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17+,23+/m1/s1	JTIGHJUHEGWKGG-DGGJZMOXSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K50648023	BRD-K50648023-001-01-1	Broad Institute of MIT and Harvard	BRD-K50648023			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17+,23+/m1/s1	JTIGHJUHEGWKGG-DGGJZMOXSA-N	517.236382914							100131
BRD-K61960033	LSM-12185		54649014	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18+,22-/m1/s1	IUSZJOKEOVUDOA-KGVIQGDOSA-N	CO[C@H](CN(C)CC1CCOCC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K61960033	BRD-K61960033-001-01-5	Broad Institute of MIT and Harvard	BRD-K61960033			CO[C@H](CN(C)CC1CCOCC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18+,22-/m1/s1	IUSZJOKEOVUDOA-KGVIQGDOSA-N	439.284634926							100811
BRD-K07003080	LSM-8842		54649123	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20-/m1/s1	FDINZZIDFRBVPX-JXXFODFXSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K07003080	BRD-K07003080-001-01-3	Broad Institute of MIT and Harvard	BRD-K07003080			CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20-/m1/s1	FDINZZIDFRBVPX-JXXFODFXSA-N	484.154718468							97463
BRD-K80194399-001-01-6	LSM-24374	BRD-K80194399	54649216	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	KNLROJRONDBMAV-DRSNIGMVSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K80194399	BRD-K80194399-001-01-6	Broad Institute of MIT and Harvard	BRD-K80194399			CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	KNLROJRONDBMAV-DRSNIGMVSA-N	536.12178399							112964
BRD-K05640282	LSM-8758		54649122	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20-/m0/s1	FDINZZIDFRBVPX-FTRWYGJKSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K05640282	BRD-K05640282-001-01-0	Broad Institute of MIT and Harvard	BRD-K05640282			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20-/m0/s1	FDINZZIDFRBVPX-FTRWYGJKSA-N	484.154718468							97379
BRD-K08993600	LSM-8971		54649031	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m0/s1	QUGGTUJVTWBVOW-JKSBSHDWSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K08993600	BRD-K08993600-001-01-5	Broad Institute of MIT and Harvard	BRD-K08993600			CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m0/s1	QUGGTUJVTWBVOW-JKSBSHDWSA-N	515.165697722							97592
BRD-K71095875	LSM-12769		54649114	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20-/m0/s1	DJBLUNZOFTWTAE-FTRWYGJKSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K71095875	BRD-K71095875-001-01-9	Broad Institute of MIT and Harvard	BRD-K71095875			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20-/m0/s1	DJBLUNZOFTWTAE-FTRWYGJKSA-N	468.184268958							101406
BRD-K16004461	LSM-9389		54649175	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19-,23+/m1/s1	BNYRIOADMGPGIR-PWHSHALESA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K16004461	BRD-K16004461-001-01-9	Broad Institute of MIT and Harvard	BRD-K16004461			CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19-,23+/m1/s1	BNYRIOADMGPGIR-PWHSHALESA-N	468.184955956							98010
BRD-K57766599	LSM-11924		54649004	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17-,23-/m1/s1	JTIGHJUHEGWKGG-SEPYTNNBSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K57766599	BRD-K57766599-001-01-8	Broad Institute of MIT and Harvard	BRD-K57766599			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17-,23-/m1/s1	JTIGHJUHEGWKGG-SEPYTNNBSA-N	517.236382914							100550
BRD-K53803963	LSM-11697		54649183	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19-,23+/m1/s1	NDGBDPWBOPYDPZ-PWHSHALESA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K53803963	BRD-K53803963-001-01-1	Broad Institute of MIT and Harvard	BRD-K53803963			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19-,23+/m1/s1	NDGBDPWBOPYDPZ-PWHSHALESA-N	480.209421066							100322
BRD-K92864945	LSM-14122		54649160	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17-,23-/m1/s1	FEKMHVLVYAIVTJ-SEPYTNNBSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K92864945	BRD-K92864945-001-01-9	Broad Institute of MIT and Harvard	BRD-K92864945			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17-,23-/m1/s1	FEKMHVLVYAIVTJ-SEPYTNNBSA-N	467.239576514							102776
BRD-K59392211	LSM-12019		54649065	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	ADONDIFMYIEKMI-PMAPCBKXSA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccccc3	BroadT	BRD-K59392211	BRD-K59392211-001-01-9	Broad Institute of MIT and Harvard	BRD-K59392211			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	ADONDIFMYIEKMI-PMAPCBKXSA-N	492.193022074							100645
BRD-K04073989	LSM-8679		54649069	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23+/m1/s1	ADONDIFMYIEKMI-PNCHPQGNSA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccccc3	BroadT	BRD-K04073989	BRD-K04073989-001-01-1	Broad Institute of MIT and Harvard	BRD-K04073989			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23+/m1/s1	ADONDIFMYIEKMI-PNCHPQGNSA-N	492.193022074							97300
BRD-K25323340	LSM-9967		54649059	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16+,19+/m0/s1	DUWNSMSZAPHBFZ-FRQCXROJSA-N	CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K25323340	BRD-K25323340-001-01-9	Broad Institute of MIT and Harvard	BRD-K25323340			CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16+,19+/m0/s1	DUWNSMSZAPHBFZ-FRQCXROJSA-N	535.207624464							98588
BRD-K62820230	LSM-12246		54649258	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22+,28+/m0/s1	XSSRKRLNCLGOQF-PFPZSTESSA-N	CO[C@H](CN(C)Cc1ccc(cc1)c2ccccn2)[C@@H](C)CN([C@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K62820230	BRD-K62820230-001-01-1	Broad Institute of MIT and Harvard	BRD-K62820230			CO[C@H](CN(C)Cc1ccc(cc1)-c1ccccn1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22+,28+/m0/s1	XSSRKRLNCLGOQF-PFPZSTESSA-N	508.284969284							100872
BRD-K63216438	LSM-12274		54649100	InChI=1S/C23H31ClF2N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17-,23-/m1/s1	UIWWHFNWICLZIF-SEPYTNNBSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K63216438	BRD-K63216438-001-01-1	Broad Institute of MIT and Harvard	BRD-K63216438			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H31ClF2N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17-,23-/m1/s1	UIWWHFNWICLZIF-SEPYTNNBSA-N	504.166112292							100900
BRD-K56261447	LSM-11832		54649188	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18+,22-/m1/s1	PETXHQBGDUFNPW-KGVIQGDOSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K56261447	BRD-K56261447-001-01-5	Broad Institute of MIT and Harvard	BRD-K56261447			CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18+,22-/m1/s1	PETXHQBGDUFNPW-KGVIQGDOSA-N	481.204670044							100457
BRD-K82993704	LSM-13499		54649256	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22-,28-/m1/s1	XSSRKRLNCLGOQF-DQCZWYHMSA-N	CO[C@H](CN(C)Cc1ccc(cc1)c2ccccn2)[C@H](C)CN([C@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K82993704	BRD-K82993704-001-01-9	Broad Institute of MIT and Harvard	BRD-K82993704			CO[C@H](CN(C)Cc1ccc(cc1)-c1ccccn1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22-,28-/m1/s1	XSSRKRLNCLGOQF-DQCZWYHMSA-N	508.284969284							102140
BRD-K86879226	LSM-13757		54648992	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20+,24-/m0/s1	OWPXWWCVMFAFIQ-ROKPMTFOSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K86879226	BRD-K86879226-001-01-5	Broad Institute of MIT and Harvard	BRD-K86879226			CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20+,24-/m0/s1	OWPXWWCVMFAFIQ-ROKPMTFOSA-N	482.20060602							102406
BRD-K11019021	LSM-9099		54649007	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17+,23-/m1/s1	JTIGHJUHEGWKGG-SAHWJRBASA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K11019021	BRD-K11019021-001-01-5	Broad Institute of MIT and Harvard	BRD-K11019021			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17+,23-/m1/s1	JTIGHJUHEGWKGG-SAHWJRBASA-N	517.236382914							97720
BRD-K60705848	LSM-12099		54649278	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16+,22-/m1/s1	IBBRHRMMLVXSHB-ZMPRRUGASA-N	CO[C@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K60705848	BRD-K60705848-001-01-0	Broad Institute of MIT and Harvard	BRD-K60705848			CO[C@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16+,22-/m1/s1	IBBRHRMMLVXSHB-ZMPRRUGASA-N	513.15974009							100725
BRD-K50085158	LSM-11474		54649047	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17-,21+/m0/s1	OIIKGOKDOCINHJ-XGHQBKJUSA-N	CO[C@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K50085158	BRD-K50085158-001-01-3	Broad Institute of MIT and Harvard	BRD-K50085158			CO[C@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17-,21+/m0/s1	OIIKGOKDOCINHJ-XGHQBKJUSA-N	453.263899482							100095
BRD-K74546480	LSM-12993		54649144	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19-,24+/m1/s1	XFQUVXMASIHRAZ-IECBHUPTSA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K74546480	BRD-K74546480-001-01-5	Broad Institute of MIT and Harvard	BRD-K74546480			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C25H34N2O7S/c1-17-6-9-21(10-7-17)35(30,31)27(19(3)15-28)13-18(2)24(32-5)14-26(4)25(29)20-8-11-22-23(12-20)34-16-33-22/h6-12,18-19,24,28H,13-16H2,1-5H3/t18-,19-,24+/m1/s1	XFQUVXMASIHRAZ-IECBHUPTSA-N	506.208672138							101630
BRD-K85805864	LSM-13687		54649179	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19+,23-/m1/s1	NDGBDPWBOPYDPZ-SELNLUPBSA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K85805864	BRD-K85805864-001-01-8	Broad Institute of MIT and Harvard	BRD-K85805864			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19+,23-/m1/s1	NDGBDPWBOPYDPZ-SELNLUPBSA-N	480.209421066							102335
BRD-K73096266	LSM-12903		54649200	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	JYNGQINEBKOLSY-BSRJHKFKSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K73096266	BRD-K73096266-001-01-2	Broad Institute of MIT and Harvard	BRD-K73096266			CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	JYNGQINEBKOLSY-BSRJHKFKSA-N	502.145983634							101540
BRD-K11667974	LSM-9138		54649108	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17+,20+/m1/s1	RULZJLKRRRCHIA-UWVAXJGDSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K11667974	BRD-K11667974-001-01-8	Broad Institute of MIT and Harvard	BRD-K11667974			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17+,20+/m1/s1	RULZJLKRRRCHIA-UWVAXJGDSA-N	450.19369079							97759
BRD-K12272248	LSM-9159		54649272	InChI=1S/C24H31ClN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23+/m0/s1	KWUJCNXGEDOTIS-YGKZAACZSA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccc(Cl)cc3	BroadT	BRD-K12272248	BRD-K12272248-001-01-6	Broad Institute of MIT and Harvard	BRD-K12272248			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C24H31ClN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23+/m0/s1	KWUJCNXGEDOTIS-YGKZAACZSA-N	526.154049752							97780
BRD-K85827194	LSM-13689		54649212	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22+/m0/s1	CZAUCXDPQANXEN-NJNPRVFISA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K85827194	BRD-K85827194-001-01-3	Broad Institute of MIT and Harvard	BRD-K85827194			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22+/m0/s1	CZAUCXDPQANXEN-NJNPRVFISA-N	466.193771002							102337
BRD-K56211108	LSM-11827		54649020	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18+,24+/m1/s1	DMFJOGMIMQDBLX-YTZAWJCFSA-N	CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K56211108	BRD-K56211108-001-01-0	Broad Institute of MIT and Harvard	BRD-K56211108			CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18+,24+/m1/s1	DMFJOGMIMQDBLX-YTZAWJCFSA-N	475.248249418							100452
BRD-K65470727	LSM-12422		54649248	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18-,21-/m1/s1	SBBAPVWHPDIFCH-DBXWQHBBSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K65470727	BRD-K65470727-001-01-2	Broad Institute of MIT and Harvard	BRD-K65470727			CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18-,21-/m1/s1	SBBAPVWHPDIFCH-DBXWQHBBSA-N	464.209340854							101049
BRD-K86757617	LSM-13744		54649118	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20+/m0/s1	DJBLUNZOFTWTAE-RZQQEMMASA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K86757617	BRD-K86757617-001-01-0	Broad Institute of MIT and Harvard	BRD-K86757617			CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20+/m0/s1	DJBLUNZOFTWTAE-RZQQEMMASA-N	468.184268958							102393
BRD-K87893855	LSM-13825		54649095	InChI=1S/C24H31FN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17-,23-/m1/s1	QPCRGZWITIZHEP-SEPYTNNBSA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K87893855	BRD-K87893855-001-01-3	Broad Institute of MIT and Harvard	BRD-K87893855			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H31FN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17-,23-/m1/s1	QPCRGZWITIZHEP-SEPYTNNBSA-N	510.183600242							102475
BRD-K97327508	LSM-14408		54649086	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19-,23-/m1/s1	FYUSSFRUYFLLAK-DNVFCKCGSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K97327508	BRD-K97327508-001-01-1	Broad Institute of MIT and Harvard	BRD-K97327508			CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19-,23-/m1/s1	FYUSSFRUYFLLAK-DNVFCKCGSA-N	532.146855886							103062
BRD-K96005107	LSM-14316		54649170	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19+,23+/m1/s1	BNYRIOADMGPGIR-MSYCTHLASA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K96005107	BRD-K96005107-001-01-9	Broad Institute of MIT and Harvard	BRD-K96005107			CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19+,23+/m1/s1	BNYRIOADMGPGIR-MSYCTHLASA-N	468.184955956							102970
BRD-K67540261	LSM-12540		54649126	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20+/m0/s1	FDINZZIDFRBVPX-RZQQEMMASA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K67540261	BRD-K67540261-001-01-2	Broad Institute of MIT and Harvard	BRD-K67540261			CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20+/m0/s1	FDINZZIDFRBVPX-RZQQEMMASA-N	484.154718468							101171
BRD-K86986995	LSM-13765		54649057	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16+,19+/m1/s1	DUWNSMSZAPHBFZ-GJYPPUQNSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K86986995	BRD-K86986995-001-01-7	Broad Institute of MIT and Harvard	BRD-K86986995			CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16+,19+/m1/s1	DUWNSMSZAPHBFZ-GJYPPUQNSA-N	535.207624464							102414
BRD-K94940283	LSM-14250		54648994	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20-,24+/m1/s1	OWPXWWCVMFAFIQ-REHUZNOOSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K94940283	BRD-K94940283-001-01-5	Broad Institute of MIT and Harvard	BRD-K94940283			CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20-,24+/m1/s1	OWPXWWCVMFAFIQ-REHUZNOOSA-N	482.20060602							102904
BRD-K72451078	LSM-12874		54649196	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	WFGAJOALFFTPKS-HYFFOGBASA-N	CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K72451078	BRD-K72451078-001-01-8	Broad Institute of MIT and Harvard	BRD-K72451078			CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	WFGAJOALFFTPKS-HYFFOGBASA-N	552.0922335							101511
BRD-K67335820	LSM-12528		54649033	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22+/m1/s1	QUGGTUJVTWBVOW-YVHKJVDXSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K67335820	BRD-K67335820-001-01-1	Broad Institute of MIT and Harvard	BRD-K67335820			CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22+/m1/s1	QUGGTUJVTWBVOW-YVHKJVDXSA-N	515.165697722							101159
BRD-K69556935	LSM-12672		54649051	InChI=1S/C20H30FN3O4S2/c1-15(19(28-4)12-23(3)13-20-22-9-10-29-20)11-24(16(2)14-25)30(26,27)18-7-5-17(21)6-8-18/h5-10,15-16,19,25H,11-14H2,1-4H3/t15-,16+,19+/m1/s1	HDBUQVYPKWOJFH-GJYPPUQNSA-N	CO[C@@H](CN(C)Cc1nccs1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K69556935	BRD-K69556935-001-01-2	Broad Institute of MIT and Harvard	BRD-K69556935			CO[C@@H](CN(C)Cc1nccs1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O4S2/c1-15(19(28-4)12-23(3)13-20-22-9-10-29-20)11-24(16(2)14-25)30(26,27)18-7-5-17(21)6-8-18/h5-10,15-16,19,25H,11-14H2,1-4H3/t15-,16+,19+/m1/s1	HDBUQVYPKWOJFH-GJYPPUQNSA-N	459.16617605							101306
BRD-K51141297	LSM-11553		54648986	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16-,19+/m1/s1	APPCZAALLCDYNG-MDZRGWNJSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K51141297	BRD-K51141297-001-01-5	Broad Institute of MIT and Harvard	BRD-K51141297			CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16-,19+/m1/s1	APPCZAALLCDYNG-MDZRGWNJSA-N	485.210818064							100176
BRD-K98742259	LSM-14489		54649107	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17-,20-/m1/s1	RULZJLKRRRCHIA-MBOZVWFJSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K98742259	BRD-K98742259-001-01-1	Broad Institute of MIT and Harvard	BRD-K98742259			CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17-,20-/m1/s1	RULZJLKRRRCHIA-MBOZVWFJSA-N	450.19369079							103144
BRD-K07020505	LSM-8844		54649012	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18+,22+/m1/s1	IUSZJOKEOVUDOA-FGSXEWAUSA-N	CO[C@@H](CN(C)CC1CCOCC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K07020505	BRD-K07020505-001-01-4	Broad Institute of MIT and Harvard	BRD-K07020505			CO[C@@H](CN(C)CC1CCOCC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18+,22+/m1/s1	IUSZJOKEOVUDOA-FGSXEWAUSA-N	439.284634926							97465
BRD-K49545421	LSM-11440		54649146	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	FWFBMTYWKZBKQZ-DRSNIGMVSA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K49545421	BRD-K49545421-001-01-1	Broad Institute of MIT and Harvard	BRD-K49545421			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	FWFBMTYWKZBKQZ-DRSNIGMVSA-N	500.15479868							100061
BRD-K29276696	LSM-10200		54649253	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18-,21+/m0/s1	SBBAPVWHPDIFCH-BBTUJRGHSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K29276696	BRD-K29276696-001-01-5	Broad Institute of MIT and Harvard	BRD-K29276696			CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18-,21+/m0/s1	SBBAPVWHPDIFCH-BBTUJRGHSA-N	464.209340854							98821
BRD-K00636532	LSM-8475		54649240	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23-/m1/s1	REZGKQRSIIUNQT-PMAPCBKXSA-N	CO[C@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K00636532	BRD-K00636532-001-01-1	Broad Institute of MIT and Harvard	BRD-K00636532			CO[C@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23-/m1/s1	REZGKQRSIIUNQT-PMAPCBKXSA-N	481.189897366							97096
BRD-K15222491	LSM-9340		54649030	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22+/m0/s1	QUGGTUJVTWBVOW-GSHUGGBRSA-N	CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K15222491	BRD-K15222491-001-01-2	Broad Institute of MIT and Harvard	BRD-K15222491			CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22+/m0/s1	QUGGTUJVTWBVOW-GSHUGGBRSA-N	515.165697722							97961
BRD-K38177488	LSM-10739		54649213	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22+/m0/s1	CZAUCXDPQANXEN-NPPFBWRTSA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K38177488	BRD-K38177488-001-01-6	Broad Institute of MIT and Harvard	BRD-K38177488			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22+/m0/s1	CZAUCXDPQANXEN-NPPFBWRTSA-N	466.193771002							99360
BRD-K23931095	LSM-9874		54649061	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16-,19+/m0/s1	DUWNSMSZAPHBFZ-TXPKVOOTSA-N	CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K23931095	BRD-K23931095-001-01-8	Broad Institute of MIT and Harvard	BRD-K23931095			CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16-,19+/m0/s1	DUWNSMSZAPHBFZ-TXPKVOOTSA-N	535.207624464							98495
BRD-K45494661	LSM-11204		54648977	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19-,24+/m0/s1	VKCFDPYGFDYBIC-AXHZCLLHSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K45494661	BRD-K45494661-001-01-5	Broad Institute of MIT and Harvard	BRD-K45494661			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19-,24+/m0/s1	VKCFDPYGFDYBIC-AXHZCLLHSA-N	484.220734678							99825
BRD-K47885451	LSM-11342		54649254	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18-,21+/m1/s1	SBBAPVWHPDIFCH-OPYAIIAOSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K47885451	BRD-K47885451-001-01-6	Broad Institute of MIT and Harvard	BRD-K47885451			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18-,21+/m1/s1	SBBAPVWHPDIFCH-OPYAIIAOSA-N	464.209340854							99963
BRD-K77588167	LSM-13167		54649198	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m0/s1	WFGAJOALFFTPKS-PNLZDCPESA-N	CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K77588167	BRD-K77588167-001-01-4	Broad Institute of MIT and Harvard	BRD-K77588167			CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m0/s1	WFGAJOALFFTPKS-PNLZDCPESA-N	552.0922335							101805
BRD-K30218805	LSM-10253		54648984	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16+,19-/m0/s1	APPCZAALLCDYNG-FCEWJHQRSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K30218805	BRD-K30218805-001-01-2	Broad Institute of MIT and Harvard	BRD-K30218805			CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16+,19-/m0/s1	APPCZAALLCDYNG-FCEWJHQRSA-N	485.210818064							98874
BRD-K06794322	LSM-8832		54649267	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19+,23-/m0/s1	IMMALVOVYMCCKV-YYDVJCTNSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K06794322	BRD-K06794322-001-01-6	Broad Institute of MIT and Harvard	BRD-K06794322			CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19+,23-/m0/s1	IMMALVOVYMCCKV-YYDVJCTNSA-N	495.220320108							97453
BRD-K52457887	LSM-11635		54649131	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22+/m1/s1	PIYRLUCWZXVSBU-JLHGSKIFSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K52457887	BRD-K52457887-001-01-0	Broad Institute of MIT and Harvard	BRD-K52457887			CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22+/m1/s1	PIYRLUCWZXVSBU-JLHGSKIFSA-N	515.165697722							100260
BRD-K09725203	LSM-9022		54649226	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17+,21+/m0/s1	NYUANTAUILYKHE-CSODHUTKSA-N	CO[C@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K09725203	BRD-K09725203-001-01-1	Broad Institute of MIT and Harvard	BRD-K09725203			CO[C@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17+,21+/m0/s1	NYUANTAUILYKHE-CSODHUTKSA-N	503.260705882							97643
BRD-K33039006	LSM-10437		54649275	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16-,22-/m1/s1	IBBRHRMMLVXSHB-XCGNWRKASA-N	CO[C@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K33039006	BRD-K33039006-001-01-6	Broad Institute of MIT and Harvard	BRD-K33039006			CO[C@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16-,22-/m1/s1	IBBRHRMMLVXSHB-XCGNWRKASA-N	513.15974009							99058
BRD-K67921699	LSM-12568		54649135	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m0/s1	PIYRLUCWZXVSBU-JKSBSHDWSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K67921699	BRD-K67921699-001-01-6	Broad Institute of MIT and Harvard	BRD-K67921699			CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m0/s1	PIYRLUCWZXVSBU-JKSBSHDWSA-N	515.165697722							101199
BRD-K93177490	LSM-14144		54649079	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18-,20-/m0/s1	APKXKRHWPGHKNH-BJLQDIEVSA-N	CO[C@@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K93177490	BRD-K93177490-001-01-4	Broad Institute of MIT and Harvard	BRD-K93177490			CO[C@@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18-,20-/m0/s1	APKXKRHWPGHKNH-BJLQDIEVSA-N	455.191247946							102798
BRD-K08002976	LSM-8910		54649264	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19-,23-/m0/s1	IMMALVOVYMCCKV-YDHSSHFGSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K08002976	BRD-K08002976-001-01-1	Broad Institute of MIT and Harvard	BRD-K08002976			CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19-,23-/m0/s1	IMMALVOVYMCCKV-YDHSSHFGSA-N	495.220320108							97531
BRD-K04575404	LSM-8707		54649250	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18+,21-/m1/s1	SBBAPVWHPDIFCH-LVCYWYKZSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K04575404	BRD-K04575404-001-01-2	Broad Institute of MIT and Harvard	BRD-K04575404			CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18+,21-/m1/s1	SBBAPVWHPDIFCH-LVCYWYKZSA-N	464.209340854							97328
BRD-K17566112	LSM-9486		54649215	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22+/m1/s1	CZAUCXDPQANXEN-HMFYCAOWSA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K17566112	BRD-K17566112-001-01-9	Broad Institute of MIT and Harvard	BRD-K17566112			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18-,22+/m1/s1	CZAUCXDPQANXEN-HMFYCAOWSA-N	466.193771002							98107
BRD-K65763571	LSM-12438		54649221	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	KNLROJRONDBMAV-JKSBSHDWSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K65763571	BRD-K65763571-001-01-7	Broad Institute of MIT and Harvard	BRD-K65763571			CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	KNLROJRONDBMAV-JKSBSHDWSA-N	536.12178399							101066
BRD-K41125638	LSM-10931		54649184	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18-,22-/m0/s1	PETXHQBGDUFNPW-SPEDKVCISA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K41125638	BRD-K41125638-001-01-9	Broad Institute of MIT and Harvard	BRD-K41125638			CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18-,22-/m0/s1	PETXHQBGDUFNPW-SPEDKVCISA-N	481.204670044							99552
BRD-K77003912	LSM-13140		54649274	InChI=1S/C24H31ClN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23-/m0/s1	KWUJCNXGEDOTIS-MFEFFIJZSA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccc(Cl)cc3	BroadT	BRD-K77003912	BRD-K77003912-001-01-2	Broad Institute of MIT and Harvard	BRD-K77003912			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C24H31ClN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23-/m0/s1	KWUJCNXGEDOTIS-MFEFFIJZSA-N	526.154049752							101778
BRD-K72867209	LSM-12889		54649060	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16+,19-/m0/s1	DUWNSMSZAPHBFZ-FCEWJHQRSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K72867209	BRD-K72867209-001-01-7	Broad Institute of MIT and Harvard	BRD-K72867209			CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16+,19-/m0/s1	DUWNSMSZAPHBFZ-FCEWJHQRSA-N	535.207624464							101526
BRD-K70871724	LSM-12756		54649052	InChI=1S/C20H30FN3O4S2/c1-15(19(28-4)12-23(3)13-20-22-9-10-29-20)11-24(16(2)14-25)30(26,27)18-7-5-17(21)6-8-18/h5-10,15-16,19,25H,11-14H2,1-4H3/t15-,16+,19+/m0/s1	HDBUQVYPKWOJFH-FRQCXROJSA-N	CO[C@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K70871724	BRD-K70871724-001-01-7	Broad Institute of MIT and Harvard	BRD-K70871724			CO[C@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O4S2/c1-15(19(28-4)12-23(3)13-20-22-9-10-29-20)11-24(16(2)14-25)30(26,27)18-7-5-17(21)6-8-18/h5-10,15-16,19,25H,11-14H2,1-4H3/t15-,16+,19+/m0/s1	HDBUQVYPKWOJFH-FRQCXROJSA-N	459.16617605							101393
BRD-K96267517	LSM-14335		54649163	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17+,23+/m0/s1	FEKMHVLVYAIVTJ-YGKZAACZSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K96267517	BRD-K96267517-001-01-9	Broad Institute of MIT and Harvard	BRD-K96267517			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17+,23+/m0/s1	FEKMHVLVYAIVTJ-YGKZAACZSA-N	467.239576514							102989
BRD-K47240178	LSM-11315		54649153	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23+/m1/s1	OEVRCWMHWGKQED-STSQHVNTSA-N	CO[C@@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K47240178	BRD-K47240178-001-01-6	Broad Institute of MIT and Harvard	BRD-K47240178			CO[C@@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23+/m1/s1	OEVRCWMHWGKQED-STSQHVNTSA-N	465.219447856							99936
BRD-K15579005	LSM-9361		54648989	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20+,24+/m1/s1	OWPXWWCVMFAFIQ-NMMYMHLASA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K15579005	BRD-K15579005-001-01-4	Broad Institute of MIT and Harvard	BRD-K15579005			CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20+,24+/m1/s1	OWPXWWCVMFAFIQ-NMMYMHLASA-N	482.20060602							97982
BRD-K00256608	LSM-8440		54649152	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23-/m0/s1	OEVRCWMHWGKQED-BSRJHKFKSA-N	CO[C@@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K00256608	BRD-K00256608-001-01-7	Broad Institute of MIT and Harvard	BRD-K00256608			CO[C@@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23-/m0/s1	OEVRCWMHWGKQED-BSRJHKFKSA-N	465.219447856							97061
BRD-K64478813	LSM-12364		54649090	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19+,23-/m1/s1	FYUSSFRUYFLLAK-SELNLUPBSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K64478813	BRD-K64478813-001-01-1	Broad Institute of MIT and Harvard	BRD-K64478813			CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19+,23-/m1/s1	FYUSSFRUYFLLAK-SELNLUPBSA-N	532.146855886							100991
BRD-K98938228	LSM-14500		54649162	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17+,23+/m1/s1	FEKMHVLVYAIVTJ-DGGJZMOXSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K98938228	BRD-K98938228-001-01-3	Broad Institute of MIT and Harvard	BRD-K98938228			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17+,23+/m1/s1	FEKMHVLVYAIVTJ-DGGJZMOXSA-N	467.239576514							103155
BRD-K30752405	LSM-10280		54648972	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19-,24-/m0/s1	VKCFDPYGFDYBIC-JXQFQVJHSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K30752405	BRD-K30752405-001-01-4	Broad Institute of MIT and Harvard	BRD-K30752405			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19-,24-/m0/s1	VKCFDPYGFDYBIC-JXQFQVJHSA-N	484.220734678							98901
BRD-K57667228	LSM-11920		54649167	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17-,23+/m1/s1	FEKMHVLVYAIVTJ-QZMQVMSPSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K57667228	BRD-K57667228-001-01-7	Broad Institute of MIT and Harvard	BRD-K57667228			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17-,23+/m1/s1	FEKMHVLVYAIVTJ-QZMQVMSPSA-N	467.239576514							100546
BRD-K74211371	LSM-12971		54649151	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	FWFBMTYWKZBKQZ-JKSBSHDWSA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K74211371	BRD-K74211371-001-01-8	Broad Institute of MIT and Harvard	BRD-K74211371			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H30ClFN2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	FWFBMTYWKZBKQZ-JKSBSHDWSA-N	500.15479868							101608
BRD-K89388769	LSM-13934		54649002	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22+/m1/s1	PIEMZAFCKVBYBS-YVHKJVDXSA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K89388769	BRD-K89388769-001-01-7	Broad Institute of MIT and Harvard	BRD-K89388769			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17-,22+/m1/s1	PIEMZAFCKVBYBS-YVHKJVDXSA-N	484.18434917							102587
BRD-K06022983	LSM-8778		54649168	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19-,23-/m1/s1	BNYRIOADMGPGIR-DNVFCKCGSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K06022983	BRD-K06022983-001-01-2	Broad Institute of MIT and Harvard	BRD-K06022983			CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19-,23-/m1/s1	BNYRIOADMGPGIR-DNVFCKCGSA-N	468.184955956							97399
BRD-K16372954	LSM-9417		54649290	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18-,21+/m1/s1	SLHJHGLJXJFOQY-OPYAIIAOSA-N	CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K16372954	BRD-K16372954-001-01-4	Broad Institute of MIT and Harvard	BRD-K16372954			CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18-,21+/m1/s1	SLHJHGLJXJFOQY-OPYAIIAOSA-N	456.229407582							98038
BRD-K30113303	LSM-10247		54649040	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18-,23+/m1/s1	NINYSMYJRLQSCV-PNCHPQGNSA-N	CO[C@@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K30113303	BRD-K30113303-001-01-2	Broad Institute of MIT and Harvard	BRD-K30113303			CO[C@@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18-,23+/m1/s1	NINYSMYJRLQSCV-PNCHPQGNSA-N	515.216254256							98868
BRD-K52898544	LSM-11656		54649124	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20+/m1/s1	FDINZZIDFRBVPX-GUXCAODWSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K52898544	BRD-K52898544-001-01-0	Broad Institute of MIT and Harvard	BRD-K52898544			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20+/m1/s1	FDINZZIDFRBVPX-GUXCAODWSA-N	484.154718468							100281
BRD-K93291781	LSM-14149		54649191	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18-,22+/m1/s1	PETXHQBGDUFNPW-HMFYCAOWSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K93291781	BRD-K93291781-001-01-1	Broad Institute of MIT and Harvard	BRD-K93291781			CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18-,22+/m1/s1	PETXHQBGDUFNPW-HMFYCAOWSA-N	481.204670044							102803
CHEMBL3183303	LSM-10596	BRD-K36014883	54649091	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19+,23-/m0/s1	FYUSSFRUYFLLAK-YYDVJCTNSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K36014883	BRD-K36014883-001-01-4	Broad Institute of MIT and Harvard	BRD-K36014883			CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19+,23-/m0/s1	FYUSSFRUYFLLAK-YYDVJCTNSA-N	532.146855886							99217
BRD-K32162437	LSM-10377		54649078	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18-,20-/m1/s1	APKXKRHWPGHKNH-QWFCFKBJSA-N	CO[C@H](CN(C)Cc1nccs1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K32162437	BRD-K32162437-001-01-6	Broad Institute of MIT and Harvard	BRD-K32162437			CO[C@H](CN(C)Cc1nccs1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18-,20-/m1/s1	APKXKRHWPGHKNH-QWFCFKBJSA-N	455.191247946							98998
BRD-K74750574	LSM-13010		54649174	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19+,23-/m0/s1	BNYRIOADMGPGIR-YYDVJCTNSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K74750574	BRD-K74750574-001-01-0	Broad Institute of MIT and Harvard	BRD-K74750574			CO[C@@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19+,23-/m0/s1	BNYRIOADMGPGIR-YYDVJCTNSA-N	468.184955956							101647
BRD-K44549295	LSM-11139		54649210	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22+/m1/s1	CZAUCXDPQANXEN-FGSXEWAUSA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K44549295	BRD-K44549295-001-01-1	Broad Institute of MIT and Harvard	BRD-K44549295			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22+/m1/s1	CZAUCXDPQANXEN-FGSXEWAUSA-N	466.193771002							99760
BRD-K68380056	LSM-12601		54649110	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17+,20+/m0/s1	RULZJLKRRRCHIA-SQGPQFPESA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K68380056	BRD-K68380056-001-01-1	Broad Institute of MIT and Harvard	BRD-K68380056			CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17+,20+/m0/s1	RULZJLKRRRCHIA-SQGPQFPESA-N	450.19369079							101233
BRD-K60624482	LSM-12091		54649257	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22+,28+/m1/s1	XSSRKRLNCLGOQF-WENCSYSZSA-N	CO[C@@H](CN(C)Cc1ccc(cc1)c2ccccn2)[C@H](C)CN([C@@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K60624482	BRD-K60624482-001-01-4	Broad Institute of MIT and Harvard	BRD-K60624482			CO[C@@H](CN(C)Cc1ccc(cc1)-c1ccccn1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22+,28+/m1/s1	XSSRKRLNCLGOQF-WENCSYSZSA-N	508.284969284							100717
BRD-K92623591-001-01-6	LSM-24375	BRD-K92623591	54649238	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19-,24+/m1/s1	RDQYWFNTQPCNSM-IECBHUPTSA-N	CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)C(=O)c3ccccc3	BroadT	BRD-K92623591	BRD-K92623591-001-01-6	Broad Institute of MIT and Harvard	BRD-K92623591			CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@H](C)CO)C(=O)c1ccccc1	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19-,24+/m1/s1	RDQYWFNTQPCNSM-IECBHUPTSA-N	442.246772208							112965
BRD-K69091193	LSM-12644		54649103	InChI=1S/C23H31ClF2N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23+/m1/s1	UIWWHFNWICLZIF-DGGJZMOXSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K69091193	BRD-K69091193-001-01-7	Broad Institute of MIT and Harvard	BRD-K69091193			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H31ClF2N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23+/m1/s1	UIWWHFNWICLZIF-DGGJZMOXSA-N	504.166112292							101277
BRD-K68423398	LSM-12603		54649003	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17-,23-/m0/s1	JTIGHJUHEGWKGG-QQMNAOGKSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K68423398	BRD-K68423398-001-01-6	Broad Institute of MIT and Harvard	BRD-K68423398			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C25H32F5N3O3/c1-16(23(36-4)14-32(3)13-18-11-20(26)7-10-22(18)27)12-33(17(2)15-34)24(35)31-21-8-5-19(6-9-21)25(28,29)30/h5-11,16-17,23,34H,12-15H2,1-4H3,(H,31,35)/t16-,17-,23-/m0/s1	JTIGHJUHEGWKGG-QQMNAOGKSA-N	517.236382914							101235
BRD-K13141487	LSM-9218		54649207	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23+/m1/s1	JYNGQINEBKOLSY-PNCHPQGNSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K13141487	BRD-K13141487-001-01-2	Broad Institute of MIT and Harvard	BRD-K13141487			CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C23H32Cl2N2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)25)23(31-4)15-26(3)32(29,30)21-11-9-20(24)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23+/m1/s1	JYNGQINEBKOLSY-PNCHPQGNSA-N	502.145983634							97839
BRD-K50929556	LSM-11535		54649166	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17-,23+/m0/s1	FEKMHVLVYAIVTJ-HKARXFIJSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K50929556	BRD-K50929556-001-01-0	Broad Institute of MIT and Harvard	BRD-K50929556			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17-,23+/m0/s1	FEKMHVLVYAIVTJ-HKARXFIJSA-N	467.239576514							100158
BRD-K12936425	LSM-9198		54649048	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17-,21+/m1/s1	OIIKGOKDOCINHJ-LZJOCLMNSA-N	CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K12936425	BRD-K12936425-001-01-1	Broad Institute of MIT and Harvard	BRD-K12936425			CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H36FN3O5/c1-16(21(31-4)14-26(3)22(29)18-9-11-32-12-10-18)13-27(17(2)15-28)23(30)25-20-7-5-19(24)6-8-20/h5-8,16-18,21,28H,9-15H2,1-4H3,(H,25,30)/t16-,17-,21+/m1/s1	OIIKGOKDOCINHJ-LZJOCLMNSA-N	453.263899482							97819
BRD-K68300134	LSM-12590		54649287	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18+,21-/m1/s1	SLHJHGLJXJFOQY-LVCYWYKZSA-N	CO[C@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K68300134	BRD-K68300134-001-01-5	Broad Institute of MIT and Harvard	BRD-K68300134			CO[C@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18+,21-/m1/s1	SLHJHGLJXJFOQY-LVCYWYKZSA-N	456.229407582							101221
BRD-K29388838	LSM-10211		54649236	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19-,24+/m0/s1	RDQYWFNTQPCNSM-AXHZCLLHSA-N	CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)C(=O)c3ccccc3	BroadT	BRD-K29388838	BRD-K29388838-001-01-7	Broad Institute of MIT and Harvard	BRD-K29388838			CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)C(=O)c1ccccc1	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19-,24+/m0/s1	RDQYWFNTQPCNSM-AXHZCLLHSA-N	442.246772208							98832
BRD-K96855280	LSM-14376		54649211	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22-/m1/s1	CZAUCXDPQANXEN-KGVIQGDOSA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K96855280	BRD-K96855280-001-01-6	Broad Institute of MIT and Harvard	BRD-K96855280			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C23H31FN2O5S/c1-17(14-26(18(2)16-27)32(29,30)19-10-6-5-7-11-19)22(31-4)15-25(3)23(28)20-12-8-9-13-21(20)24/h5-13,17-18,22,27H,14-16H2,1-4H3/t17-,18+,22-/m1/s1	CZAUCXDPQANXEN-KGVIQGDOSA-N	466.193771002							103030
BRD-K57408604	LSM-11904		54648998	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22+/m1/s1	PIEMZAFCKVBYBS-JLHGSKIFSA-N	CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K57408604	BRD-K57408604-001-01-0	Broad Institute of MIT and Harvard	BRD-K57408604			CO[C@@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H30F2N2O5S/c1-16(22(32-4)14-26(3)23(29)20-7-5-6-8-21(20)25)13-27(17(2)15-28)33(30,31)19-11-9-18(24)10-12-19/h5-12,16-17,22,28H,13-15H2,1-4H3/t16-,17+,22+/m1/s1	PIEMZAFCKVBYBS-JLHGSKIFSA-N	484.18434917							100530
BRD-K35554380	LSM-10561		54649189	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18-,22+/m0/s1	PETXHQBGDUFNPW-NPPFBWRTSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K35554380	BRD-K35554380-001-01-8	Broad Institute of MIT and Harvard	BRD-K35554380			CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H32FN3O5S/c1-17(22(32-4)15-26(3)33(30,31)19-10-6-5-7-11-19)14-27(18(2)16-28)23(29)25-21-13-9-8-12-20(21)24/h5-13,17-18,22,28H,14-16H2,1-4H3,(H,25,29)/t17-,18-,22+/m0/s1	PETXHQBGDUFNPW-NPPFBWRTSA-N	481.204670044							99182
BRD-K34122000	LSM-10491		54649249	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18+,21+/m1/s1	SBBAPVWHPDIFCH-LQWHRVPQSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K34122000	BRD-K34122000-001-01-5	Broad Institute of MIT and Harvard	BRD-K34122000			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18+,21+/m1/s1	SBBAPVWHPDIFCH-LQWHRVPQSA-N	464.209340854							99112
BRD-K08813275	LSM-8962		54649117	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20-/m1/s1	DJBLUNZOFTWTAE-GQIGUUNPSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K08813275	BRD-K08813275-001-01-9	Broad Institute of MIT and Harvard	BRD-K08813275			CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20-/m1/s1	DJBLUNZOFTWTAE-GQIGUUNPSA-N	468.184268958							97583
BRD-K42558476	LSM-11008		54649083	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18+,20-/m0/s1	APKXKRHWPGHKNH-NSHGMRRFSA-N	CO[C@@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K42558476	BRD-K42558476-001-01-5	Broad Institute of MIT and Harvard	BRD-K42558476			CO[C@@H](CN(C)Cc1nccs1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18+,20-/m0/s1	APKXKRHWPGHKNH-NSHGMRRFSA-N	455.191247946							99629
BRD-K55522920	LSM-11791		54648993	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20-,24+/m0/s1	OWPXWWCVMFAFIQ-MZLICYQSSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K55522920	BRD-K55522920-001-01-7	Broad Institute of MIT and Harvard	BRD-K55522920			CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20-,24+/m0/s1	OWPXWWCVMFAFIQ-MZLICYQSSA-N	482.20060602							100416
BRD-K35829399	LSM-10580		54649195	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m1/s1	WFGAJOALFFTPKS-JLHGSKIFSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K35829399	BRD-K35829399-001-01-3	Broad Institute of MIT and Harvard	BRD-K35829399			CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m1/s1	WFGAJOALFFTPKS-JLHGSKIFSA-N	552.0922335							99201
BRD-K97737065	LSM-14434		54649080	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18+,20+/m1/s1	APKXKRHWPGHKNH-HBFSDRIKSA-N	CO[C@@H](CN(C)Cc1nccs1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K97737065	BRD-K97737065-001-01-6	Broad Institute of MIT and Harvard	BRD-K97737065			CO[C@@H](CN(C)Cc1nccs1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C21H33N3O4S2/c1-16-6-8-19(9-7-16)30(26,27)24(18(3)15-25)12-17(2)20(28-5)13-23(4)14-21-22-10-11-29-21/h6-11,17-18,20,25H,12-15H2,1-5H3/t17-,18+,20+/m1/s1	APKXKRHWPGHKNH-HBFSDRIKSA-N	455.191247946							103089
BRD-K15811513	LSM-9377		54649034	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18-,23-/m1/s1	NINYSMYJRLQSCV-PMAPCBKXSA-N	CO[C@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K15811513	BRD-K15811513-001-01-6	Broad Institute of MIT and Harvard	BRD-K15811513			CO[C@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18-,23-/m1/s1	NINYSMYJRLQSCV-PMAPCBKXSA-N	515.216254256							97998
BRD-K05803357	LSM-8771		54649251	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18+,21+/m0/s1	SBBAPVWHPDIFCH-WAOWUJCRSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K05803357	BRD-K05803357-001-01-4	Broad Institute of MIT and Harvard	BRD-K05803357			CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C22H32N4O5S/c1-16-6-8-19(9-7-16)32(29,30)26(18(3)15-27)13-17(2)21(31-5)14-25(4)22(28)20-12-23-10-11-24-20/h6-12,17-18,21,27H,13-15H2,1-5H3/t17-,18+,21+/m0/s1	SBBAPVWHPDIFCH-WAOWUJCRSA-N	464.209340854							97392
BRD-K02341205	LSM-8580		54649173	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19-,23+/m0/s1	BNYRIOADMGPGIR-SFYKDHMMSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K02341205	BRD-K02341205-001-01-2	Broad Institute of MIT and Harvard	BRD-K02341205			CO[C@H](CN(C)S(=O)(=O)c1ccccc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C23H33ClN2O4S/c1-18(14-26(19(2)17-27)15-20-10-8-9-13-22(20)24)23(30-4)16-25(3)31(28,29)21-11-6-5-7-12-21/h5-13,18-19,23,27H,14-17H2,1-4H3/t18-,19-,23+/m0/s1	BNYRIOADMGPGIR-SFYKDHMMSA-N	468.184955956							97201
BRD-K92986986	LSM-14134		54649246	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23+/m1/s1	REZGKQRSIIUNQT-PNCHPQGNSA-N	CO[C@@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K92986986	BRD-K92986986-001-01-0	Broad Institute of MIT and Harvard	BRD-K92986986			CO[C@@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18-,23+/m1/s1	REZGKQRSIIUNQT-PNCHPQGNSA-N	481.189897366							102788
BRD-K96425583	LSM-14342		54648991	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20+,24+/m0/s1	OWPXWWCVMFAFIQ-DCLXLUIPSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K96425583	BRD-K96425583-001-01-2	Broad Institute of MIT and Harvard	BRD-K96425583			CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20+,24+/m0/s1	OWPXWWCVMFAFIQ-DCLXLUIPSA-N	482.20060602							102996
BRD-K38678832	LSM-10774		54649109	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17+,20-/m1/s1	RULZJLKRRRCHIA-FUHIMQAGSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K38678832	BRD-K38678832-001-01-6	Broad Institute of MIT and Harvard	BRD-K38678832			CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17+,20-/m1/s1	RULZJLKRRRCHIA-FUHIMQAGSA-N	450.19369079							99395
BRD-K00671069	LSM-8477		54649156	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23-/m1/s1	OEVRCWMHWGKQED-IEGUWTFLSA-N	CO[C@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K00671069	BRD-K00671069-001-01-9	Broad Institute of MIT and Harvard	BRD-K00671069			CO[C@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23-/m1/s1	OEVRCWMHWGKQED-IEGUWTFLSA-N	465.219447856							97098
BRD-K58023987	LSM-11932		54649023	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18-,24+/m0/s1	DMFJOGMIMQDBLX-LLJLJFOGSA-N	CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K58023987	BRD-K58023987-001-01-3	Broad Institute of MIT and Harvard	BRD-K58023987			CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C25H34FN3O5/c1-17(12-29(18(2)15-30)25(31)27-21-8-6-20(26)7-9-21)24(32-4)14-28(3)13-19-5-10-22-23(11-19)34-16-33-22/h5-11,17-18,24,30H,12-16H2,1-4H3,(H,27,31)/t17-,18-,24+/m0/s1	DMFJOGMIMQDBLX-LLJLJFOGSA-N	475.248249418							100558
CHEMBL2354888	LSM-8702	BRD-K04521490, SID131445596	54649197	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	WFGAJOALFFTPKS-JKSBSHDWSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K04521490	BRD-K04521490-001-01-1	Broad Institute of MIT and Harvard	BRD-K04521490			CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	WFGAJOALFFTPKS-JKSBSHDWSA-N	552.0922335							97323
BRD-K77265816	LSM-13152		54649268	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19+,23-/m1/s1	IMMALVOVYMCCKV-SELNLUPBSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K77265816	BRD-K77265816-001-01-4	Broad Institute of MIT and Harvard	BRD-K77265816			CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C24H34FN3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(4)15-23(33-5)18(2)14-28(19(3)16-29)24(30)26-22-9-7-6-8-21(22)25/h6-13,18-19,23,29H,14-16H2,1-5H3,(H,26,30)/t18-,19+,23-/m1/s1	IMMALVOVYMCCKV-SELNLUPBSA-N	495.220320108							101790
BRD-K09555199	LSM-9011		54649229	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17-,21+/m0/s1	NYUANTAUILYKHE-XGHQBKJUSA-N	CO[C@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K09555199	BRD-K09555199-001-01-8	Broad Institute of MIT and Harvard	BRD-K09555199			CO[C@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17-,21+/m0/s1	NYUANTAUILYKHE-XGHQBKJUSA-N	503.260705882							97632
BRD-K35930698	LSM-10587		54649261	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22+,28-/m0/s1	XSSRKRLNCLGOQF-TYPXCFOJSA-N	CO[C@@H](CN(C)Cc1ccc(cc1)c2ccccn2)[C@@H](C)CN([C@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K35930698	BRD-K35930698-001-01-7	Broad Institute of MIT and Harvard	BRD-K35930698			CO[C@@H](CN(C)Cc1ccc(cc1)-c1ccccn1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22+,28-/m0/s1	XSSRKRLNCLGOQF-TYPXCFOJSA-N	508.284969284							99208
BRD-K90552071	LSM-14005		54649233	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19+,24+/m0/s1	RDQYWFNTQPCNSM-XLNZFTOWSA-N	CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)C(=O)c3ccccc3	BroadT	BRD-K90552071	BRD-K90552071-001-01-8	Broad Institute of MIT and Harvard	BRD-K90552071			CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)C(=O)c1ccccc1	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19+,24+/m0/s1	RDQYWFNTQPCNSM-XLNZFTOWSA-N	442.246772208							102658
BRD-K42605934	LSM-11010		54649241	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23+/m1/s1	REZGKQRSIIUNQT-STSQHVNTSA-N	CO[C@@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K42605934	BRD-K42605934-001-01-0	Broad Institute of MIT and Harvard	BRD-K42605934			CO[C@@H](CN(C)C(=O)Nc1ccc(Cl)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C24H33Cl2N3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)26)23(32-4)15-28(3)24(31)27-21-11-9-20(25)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23+/m1/s1	REZGKQRSIIUNQT-STSQHVNTSA-N	481.189897366							99631
BRD-K12425451	LSM-9170		54649049	InChI=1S/C20H30FN3O4S2/c1-15(19(28-4)12-23(3)13-20-22-9-10-29-20)11-24(16(2)14-25)30(26,27)18-7-5-17(21)6-8-18/h5-10,15-16,19,25H,11-14H2,1-4H3/t15-,16-,19-/m1/s1	HDBUQVYPKWOJFH-GPMSIDNRSA-N	CO[C@H](CN(C)Cc1nccs1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K12425451	BRD-K12425451-001-01-2	Broad Institute of MIT and Harvard	BRD-K12425451			CO[C@H](CN(C)Cc1nccs1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O4S2/c1-15(19(28-4)12-23(3)13-20-22-9-10-29-20)11-24(16(2)14-25)30(26,27)18-7-5-17(21)6-8-18/h5-10,15-16,19,25H,11-14H2,1-4H3/t15-,16-,19-/m1/s1	HDBUQVYPKWOJFH-GPMSIDNRSA-N	459.16617605							97791
BRD-K57490754	LSM-11907		54649087	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19-,23-/m0/s1	FYUSSFRUYFLLAK-YDHSSHFGSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K57490754	BRD-K57490754-001-01-6	Broad Institute of MIT and Harvard	BRD-K57490754			CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C23H33ClN2O6S2/c1-17-9-11-21(12-10-17)33(28,29)25(4)15-23(32-5)18(2)14-26(19(3)16-27)34(30,31)22-8-6-7-20(24)13-22/h6-13,18-19,23,27H,14-16H2,1-5H3/t18-,19-,23-/m0/s1	FYUSSFRUYFLLAK-YDHSSHFGSA-N	532.146855886							100533
BRD-K30151357	LSM-10249		54649260	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22-,28+/m0/s1	XSSRKRLNCLGOQF-RXYILKCJSA-N	CO[C@H](CN(C)Cc1ccc(cc1)c2ccccn2)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K30151357	BRD-K30151357-001-01-7	Broad Institute of MIT and Harvard	BRD-K30151357			CO[C@H](CN(C)Cc1ccc(cc1)-c1ccccn1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22-,28+/m0/s1	XSSRKRLNCLGOQF-RXYILKCJSA-N	508.284969284							98870
BRD-K22629238	LSM-9800		54649291	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19-,24-/m1/s1	VKCFDPYGFDYBIC-KHCICDEESA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K22629238	BRD-K22629238-001-01-7	Broad Institute of MIT and Harvard	BRD-K22629238			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H34F2N2O4S/c1-17-6-9-22(10-7-17)33(30,31)28(19(3)16-29)13-18(2)24(32-5)15-27(4)14-20-12-21(25)8-11-23(20)26/h6-12,18-19,24,29H,13-16H2,1-5H3/t18-,19-,24-/m1/s1	VKCFDPYGFDYBIC-KHCICDEESA-N	484.220734678							98421
BRD-K78386654	LSM-13220		54649235	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19+,24-/m1/s1	RDQYWFNTQPCNSM-YDIMBITNSA-N	CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)C(=O)c3ccccc3	BroadT	BRD-K78386654	BRD-K78386654-001-01-2	Broad Institute of MIT and Harvard	BRD-K78386654			CO[C@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)C(=O)c1ccccc1	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19+,24-/m1/s1	RDQYWFNTQPCNSM-YDIMBITNSA-N	442.246772208							101859
BRD-K86571176	LSM-13730		54649277	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16+,22+/m1/s1	IBBRHRMMLVXSHB-VVBPWWLESA-N	CO[C@@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K86571176	BRD-K86571176-001-01-8	Broad Institute of MIT and Harvard	BRD-K86571176			CO[C@@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16+,22+/m1/s1	IBBRHRMMLVXSHB-VVBPWWLESA-N	513.15974009							102379
BRD-K39107373	LSM-10799		54649280	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16-,22+/m0/s1	IBBRHRMMLVXSHB-PONJGIIJSA-N	CO[C@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K39107373	BRD-K39107373-001-01-0	Broad Institute of MIT and Harvard	BRD-K39107373			CO[C@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16-,22+/m0/s1	IBBRHRMMLVXSHB-PONJGIIJSA-N	513.15974009							99420
BRD-K84739463	LSM-13609		54649194	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m0/s1	WFGAJOALFFTPKS-GSHUGGBRSA-N	CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K84739463	BRD-K84739463-001-01-5	Broad Institute of MIT and Harvard	BRD-K84739463			CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m0/s1	WFGAJOALFFTPKS-GSHUGGBRSA-N	552.0922335							102254
BRD-K21547311	LSM-9736		54649096	InChI=1S/C24H31FN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23+/m1/s1	QPCRGZWITIZHEP-DGGJZMOXSA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K21547311	BRD-K21547311-001-01-2	Broad Institute of MIT and Harvard	BRD-K21547311			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H31FN2O7S/c1-16(12-27(17(2)14-28)35(30,31)20-8-6-19(25)7-9-20)23(32-4)13-26(3)24(29)18-5-10-21-22(11-18)34-15-33-21/h5-11,16-17,23,28H,12-15H2,1-4H3/t16-,17+,23+/m1/s1	QPCRGZWITIZHEP-DGGJZMOXSA-N	510.183600242							98357
CHEMBL2360663	LSM-12351	BRD-K64290134, SID131445591	54649192	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	WFGAJOALFFTPKS-DRSNIGMVSA-N	CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K64290134	BRD-K64290134-001-01-2	Broad Institute of MIT and Harvard	BRD-K64290134			CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-10-6-8-19(24)12-21)22(32-4)14-25(3)33(28,29)20-9-5-7-18(23)11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	WFGAJOALFFTPKS-DRSNIGMVSA-N	552.0922335							100978
BRD-K23744058	LSM-9862		54649120	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20+/m0/s1	DJBLUNZOFTWTAE-TWOQFEAHSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K23744058	BRD-K23744058-001-01-0	Broad Institute of MIT and Harvard	BRD-K23744058			CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20+/m0/s1	DJBLUNZOFTWTAE-TWOQFEAHSA-N	468.184268958							98483
BRD-K61873333	LSM-12179		54649116	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20+/m1/s1	DJBLUNZOFTWTAE-GUXCAODWSA-N	CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K61873333	BRD-K61873333-001-01-7	Broad Institute of MIT and Harvard	BRD-K61873333			CO[C@@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20+/m1/s1	DJBLUNZOFTWTAE-GUXCAODWSA-N	468.184268958							100805
BRD-K53272350	LSM-11675		54649055	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16-,19-/m0/s1	DUWNSMSZAPHBFZ-BXWFABGCSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K53272350	BRD-K53272350-001-01-0	Broad Institute of MIT and Harvard	BRD-K53272350			CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16-,19-/m0/s1	DUWNSMSZAPHBFZ-BXWFABGCSA-N	535.207624464							100300
BRD-K64178462	LSM-12348		54649077	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23+/m1/s1	IVUAVXPBXQRVFC-PNCHPQGNSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K64178462	BRD-K64178462-001-01-1	Broad Institute of MIT and Harvard	BRD-K64178462			CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23+/m1/s1	IVUAVXPBXQRVFC-PNCHPQGNSA-N	486.175534124							100975
BRD-K06457057	LSM-8805		54649056	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16-,19-/m1/s1	DUWNSMSZAPHBFZ-GPMSIDNRSA-N	CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K06457057	BRD-K06457057-001-01-1	Broad Institute of MIT and Harvard	BRD-K06457057			CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N5O5S/c1-15(19(35-5)11-29(4)36(33,34)20-12-28(3)14-26-20)10-30(16(2)13-31)21(32)27-18-8-6-17(7-9-18)22(23,24)25/h6-9,12,14-16,19,31H,10-11,13H2,1-5H3,(H,27,32)/t15-,16-,19-/m1/s1	DUWNSMSZAPHBFZ-GPMSIDNRSA-N	535.207624464							97426
BRD-K04718515	LSM-8721		54649067	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23+/m0/s1	ADONDIFMYIEKMI-IUKKYPGJSA-N	CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c3ccccc3	BroadT	BRD-K04718515	BRD-K04718515-001-01-4	Broad Institute of MIT and Harvard	BRD-K04718515			CO[C@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23+/m0/s1	ADONDIFMYIEKMI-IUKKYPGJSA-N	492.193022074							97342
BRD-K17381515	LSM-9473		54648985	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16-,19+/m0/s1	APPCZAALLCDYNG-TXPKVOOTSA-N	CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K17381515	BRD-K17381515-001-01-6	Broad Institute of MIT and Harvard	BRD-K17381515			CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16-,19+/m0/s1	APPCZAALLCDYNG-TXPKVOOTSA-N	485.210818064							98094
BRD-K87728132	LSM-13807		54649104	InChI=1S/C23H31ClF2N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23-/m1/s1	UIWWHFNWICLZIF-SAHWJRBASA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K87728132	BRD-K87728132-001-01-6	Broad Institute of MIT and Harvard	BRD-K87728132			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H31ClF2N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23-/m1/s1	UIWWHFNWICLZIF-SAHWJRBASA-N	504.166112292							102456
BRD-K31147434	LSM-10310		54649102	InChI=1S/C23H31ClF2N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23+/m0/s1	UIWWHFNWICLZIF-YGKZAACZSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K31147434	BRD-K31147434-001-01-1	Broad Institute of MIT and Harvard	BRD-K31147434			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C23H31ClF2N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23+/m0/s1	UIWWHFNWICLZIF-YGKZAACZSA-N	504.166112292							98931
BRD-K16068142	LSM-9395		54649227	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17+,21+/m1/s1	NYUANTAUILYKHE-WWMYMODYSA-N	CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K16068142	BRD-K16068142-001-01-1	Broad Institute of MIT and Harvard	BRD-K16068142			CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C24H36F3N3O5/c1-16(21(34-4)14-29(3)22(32)18-9-11-35-12-10-18)13-30(17(2)15-31)23(33)28-20-7-5-19(6-8-20)24(25,26)27/h5-8,16-18,21,31H,9-15H2,1-4H3,(H,28,33)/t16-,17+,21+/m1/s1	NYUANTAUILYKHE-WWMYMODYSA-N	503.260705882							98016
BRD-K23727664	LSM-9859		54649011	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18-,22-/m0/s1	IUSZJOKEOVUDOA-SPEDKVCISA-N	CO[C@@H](CN(C)CC1CCOCC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K23727664	BRD-K23727664-001-01-1	Broad Institute of MIT and Harvard	BRD-K23727664			CO[C@@H](CN(C)CC1CCOCC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C23H38FN3O4/c1-17(22(30-4)15-26(3)14-19-9-11-31-12-10-19)13-27(18(2)16-28)23(29)25-21-7-5-20(24)6-8-21/h5-8,17-19,22,28H,9-16H2,1-4H3,(H,25,29)/t17-,18-,22-/m0/s1	IUSZJOKEOVUDOA-SPEDKVCISA-N	439.284634926							98480
BRD-K99737029	LSM-14556		54649220	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m0/s1	KNLROJRONDBMAV-GSHUGGBRSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K99737029	BRD-K99737029-001-01-9	Broad Institute of MIT and Harvard	BRD-K99737029			CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30ClFN2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-18(23)12-21)22(32-4)14-25(3)33(28,29)20-10-8-19(24)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m0/s1	KNLROJRONDBMAV-GSHUGGBRSA-N	536.12178399							103212
BRD-K81899744	LSM-13427		54649037	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18+,23+/m0/s1	NINYSMYJRLQSCV-YZZKKUAISA-N	CO[C@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K81899744	BRD-K81899744-001-01-1	Broad Institute of MIT and Harvard	BRD-K81899744			CO[C@H](CN(C)C(=O)Nc1ccc(cc1)C(F)(F)F)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C25H33ClF3N3O3/c1-17(13-32(18(2)16-33)14-19-7-5-6-8-22(19)26)23(35-4)15-31(3)24(34)30-21-11-9-20(10-12-21)25(27,28)29/h5-12,17-18,23,33H,13-16H2,1-4H3,(H,30,34)/t17-,18+,23+/m0/s1	NINYSMYJRLQSCV-YZZKKUAISA-N	515.216254256							102067
BRD-K72787581	LSM-12886		54649027	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22-/m0/s1	QUGGTUJVTWBVOW-HOIFWPIMSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K72787581	BRD-K72787581-001-01-5	Broad Institute of MIT and Harvard	BRD-K72787581			CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-11-6-5-10-20(21)25)22(33-4)14-27(3)34(31,32)19-9-7-8-18(24)12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22-/m0/s1	QUGGTUJVTWBVOW-HOIFWPIMSA-N	515.165697722							101523
BRD-K01435720	LSM-8524		54649155	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23+/m0/s1	OEVRCWMHWGKQED-YZZKKUAISA-N	CO[C@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@H](C)CO	BroadT	BRD-K01435720	BRD-K01435720-001-01-9	Broad Institute of MIT and Harvard	BRD-K01435720			CO[C@H](CN(C)C(=O)Nc1ccc(F)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@H](C)CO	InChI=1S/C24H33ClFN3O3/c1-17(13-29(18(2)16-30)14-19-7-5-6-8-22(19)25)23(32-4)15-28(3)24(31)27-21-11-9-20(26)10-12-21/h5-12,17-18,23,30H,13-16H2,1-4H3,(H,27,31)/t17-,18+,23+/m0/s1	OEVRCWMHWGKQED-YZZKKUAISA-N	465.219447856							97145
BRD-K32277249	LSM-10385		54649134	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22+/m0/s1	PIYRLUCWZXVSBU-PNLZDCPESA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K32277249	BRD-K32277249-001-01-0	Broad Institute of MIT and Harvard	BRD-K32277249			CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31ClFN3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22+/m0/s1	PIYRLUCWZXVSBU-PNLZDCPESA-N	515.165697722							99006
BRD-K42620042	LSM-11014		54649164	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17+,23-/m1/s1	FEKMHVLVYAIVTJ-SAHWJRBASA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K42620042	BRD-K42620042-001-01-8	Broad Institute of MIT and Harvard	BRD-K42620042			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C24H32F3N3O3/c1-16(23(33-4)14-29(3)13-18-11-20(26)7-10-22(18)27)12-30(17(2)15-31)24(32)28-21-8-5-19(25)6-9-21/h5-11,16-17,23,31H,12-15H2,1-4H3,(H,28,32)/t16-,17+,23-/m1/s1	FEKMHVLVYAIVTJ-SAHWJRBASA-N	467.239576514							99635
BRD-K61620767	LSM-12164		54649232	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19-,24-/m0/s1	RDQYWFNTQPCNSM-JXQFQVJHSA-N	CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)C(=O)c3ccccc3	BroadT	BRD-K61620767	BRD-K61620767-001-01-7	Broad Institute of MIT and Harvard	BRD-K61620767			CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@@H](C)CN([C@@H](C)CO)C(=O)c1ccccc1	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19-,24-/m0/s1	RDQYWFNTQPCNSM-JXQFQVJHSA-N	442.246772208							100790
BRD-K67555693	LSM-12541		54649262	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22-,28+/m1/s1	XSSRKRLNCLGOQF-XJGOYTCSSA-N	CO[C@@H](CN(C)Cc1ccc(cc1)c2ccccn2)[C@H](C)CN([C@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K67555693	BRD-K67555693-001-01-8	Broad Institute of MIT and Harvard	BRD-K67555693			CO[C@@H](CN(C)Cc1ccc(cc1)-c1ccccn1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22-,28+/m1/s1	XSSRKRLNCLGOQF-XJGOYTCSSA-N	508.284969284							101172
BRD-K98303739	LSM-14468		54649234	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19+,24+/m1/s1	RDQYWFNTQPCNSM-IMWIBFENSA-N	CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)C(=O)c3ccccc3	BroadT	BRD-K98303739	BRD-K98303739-001-01-2	Broad Institute of MIT and Harvard	BRD-K98303739			CO[C@@H](CN(C)Cc1ccc2OCOc2c1)[C@H](C)CN([C@@H](C)CO)C(=O)c1ccccc1	InChI=1S/C25H34N2O5/c1-18(13-27(19(2)16-28)25(29)21-8-6-5-7-9-21)24(30-4)15-26(3)14-20-10-11-22-23(12-20)32-17-31-22/h5-12,18-19,24,28H,13-17H2,1-4H3/t18-,19+,24+/m1/s1	RDQYWFNTQPCNSM-IMWIBFENSA-N	442.246772208							103123
BRD-K87804315	LSM-13812		54648990	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20+,24-/m1/s1	OWPXWWCVMFAFIQ-JXALWOEJSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K87804315	BRD-K87804315-001-01-4	Broad Institute of MIT and Harvard	BRD-K87804315			CO[C@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20+,24-/m1/s1	OWPXWWCVMFAFIQ-JXALWOEJSA-N	482.20060602							102461
BRD-K78011385	LSM-13202		54649125	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20-/m1/s1	FDINZZIDFRBVPX-GQIGUUNPSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K78011385	BRD-K78011385-001-01-2	Broad Institute of MIT and Harvard	BRD-K78011385			CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16+,20-/m1/s1	FDINZZIDFRBVPX-GQIGUUNPSA-N	484.154718468							101840
BRD-K76251313	LSM-13087		54648979	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16-,19-/m0/s1	APPCZAALLCDYNG-BXWFABGCSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K76251313	BRD-K76251313-001-01-3	Broad Institute of MIT and Harvard	BRD-K76251313			CO[C@@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16-,19-/m0/s1	APPCZAALLCDYNG-BXWFABGCSA-N	485.210818064							101725
BRD-K46178029	LSM-11241		54649115	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20-/m1/s1	DJBLUNZOFTWTAE-JXXFODFXSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K46178029	BRD-K46178029-001-01-0	Broad Institute of MIT and Harvard	BRD-K46178029			CO[C@H](CN(C)C(=O)c1cnccn1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H29FN4O5S/c1-15(20(31-4)13-25(3)21(28)19-11-23-9-10-24-19)12-26(16(2)14-27)32(29,30)18-7-5-17(22)6-8-18/h5-11,15-16,20,27H,12-14H2,1-4H3/t15-,16-,20-/m1/s1	DJBLUNZOFTWTAE-JXXFODFXSA-N	468.184268958							99862
BRD-K86059888	LSM-13698		54649255	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22-,28-/m0/s1	XSSRKRLNCLGOQF-VPYPWEPUSA-N	CO[C@@H](CN(C)Cc1ccc(cc1)c2ccccn2)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K86059888	BRD-K86059888-001-01-3	Broad Institute of MIT and Harvard	BRD-K86059888			CO[C@@H](CN(C)Cc1ccc(cc1)-c1ccccn1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C29H37FN4O3/c1-21(17-34(22(2)20-35)29(36)32-26-14-12-25(30)13-15-26)28(37-4)19-33(3)18-23-8-10-24(11-9-23)27-7-5-6-16-31-27/h5-16,21-22,28,35H,17-20H2,1-4H3,(H,32,36)/t21-,22-,28-/m0/s1	XSSRKRLNCLGOQF-VPYPWEPUSA-N	508.284969284							102346
BRD-K88179544	LSM-13844		54649075	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23+/m0/s1	IVUAVXPBXQRVFC-IUKKYPGJSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K88179544	BRD-K88179544-001-01-3	Broad Institute of MIT and Harvard	BRD-K88179544			CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C23H32ClFN2O4S/c1-17(13-27(18(2)16-28)14-19-7-5-6-8-22(19)24)23(31-4)15-26(3)32(29,30)21-11-9-20(25)10-12-21/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23+/m0/s1	IVUAVXPBXQRVFC-IUKKYPGJSA-N	486.175534124							102495
BRD-K77596635	LSM-13169		54649068	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	ADONDIFMYIEKMI-IXFSTUDKSA-N	CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c3ccccc3	BroadT	BRD-K77596635	BRD-K77596635-001-01-1	Broad Institute of MIT and Harvard	BRD-K77596635			CO[C@@H](CN(C)C(=O)c1ccc2OCOc2c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C24H32N2O7S/c1-17(13-26(18(2)15-27)34(29,30)20-8-6-5-7-9-20)23(31-4)14-25(3)24(28)19-10-11-21-22(12-19)33-16-32-21/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	ADONDIFMYIEKMI-IXFSTUDKSA-N	492.193022074							101807
BRD-K40597283	LSM-10908		54649111	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17-,20+/m0/s1	RULZJLKRRRCHIA-ABSDTBQOSA-N	CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K40597283	BRD-K40597283-001-01-8	Broad Institute of MIT and Harvard	BRD-K40597283			CO[C@H](CN(C)C(=O)c1cnccn1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C21H30N4O5S/c1-16(20(30-4)14-24(3)21(27)19-12-22-10-11-23-19)13-25(17(2)15-26)31(28,29)18-8-6-5-7-9-18/h5-12,16-17,20,26H,13-15H2,1-4H3/t16-,17-,20+/m0/s1	RULZJLKRRRCHIA-ABSDTBQOSA-N	450.19369079							99529
BRD-K86097224	LSM-13701		54648980	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16-,19-/m1/s1	APPCZAALLCDYNG-GPMSIDNRSA-N	CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K86097224	BRD-K86097224-001-01-6	Broad Institute of MIT and Harvard	BRD-K86097224			CO[C@H](CN(C)S(=O)(=O)c1cn(C)cn1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(F)cc1	InChI=1S/C21H32FN5O5S/c1-15(19(32-5)11-26(4)33(30,31)20-12-25(3)14-23-20)10-27(16(2)13-28)21(29)24-18-8-6-17(22)7-9-18/h6-9,12,14-16,19,28H,10-11,13H2,1-5H3,(H,24,29)/t15-,16-,19-/m1/s1	APPCZAALLCDYNG-GPMSIDNRSA-N	485.210818064							102349
BRD-K63968737	LSM-12334		54648988	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20-,24-/m0/s1	OWPXWWCVMFAFIQ-SKPFHBQLSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN(Cc2ccccc2Cl)[C@@H](C)CO	BroadT	BRD-K63968737	BRD-K63968737-001-01-5	Broad Institute of MIT and Harvard	BRD-K63968737			CO[C@@H](CN(C)S(=O)(=O)c1ccc(C)cc1)[C@@H](C)CN(Cc1ccccc1Cl)[C@@H](C)CO	InChI=1S/C24H35ClN2O4S/c1-18-10-12-22(13-11-18)32(29,30)26(4)16-24(31-5)19(2)14-27(20(3)17-28)15-21-8-6-7-9-23(21)25/h6-13,19-20,24,28H,14-17H2,1-5H3/t19-,20-,24-/m0/s1	OWPXWWCVMFAFIQ-SKPFHBQLSA-N	482.20060602							100961
BRD-K43857354	LSM-11106		54649177	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19-,23-/m1/s1	NDGBDPWBOPYDPZ-DNVFCKCGSA-N	CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K43857354	BRD-K43857354-001-01-7	Broad Institute of MIT and Harvard	BRD-K43857354			CO[C@H](CN(C)C(=O)c1ccccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H33FN2O5S/c1-17-10-12-20(13-11-17)33(30,31)27(19(3)16-28)14-18(2)23(32-5)15-26(4)24(29)21-8-6-7-9-22(21)25/h6-13,18-19,23,28H,14-16H2,1-5H3/t18-,19-,23-/m1/s1	NDGBDPWBOPYDPZ-DNVFCKCGSA-N	480.209421066							99727
BRD-K08703292	LSM-8954		54649289	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18+,21-/m0/s1	SLHJHGLJXJFOQY-UEXGIBASSA-N	CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccccc2	BroadT	BRD-K08703292	BRD-K08703292-001-01-1	Broad Institute of MIT and Harvard	BRD-K08703292			CO[C@@H](CN(C)C(=O)C1CCOCC1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccccc1	InChI=1S/C22H36N2O6S/c1-17(21(29-4)15-23(3)22(26)19-10-12-30-13-11-19)14-24(18(2)16-25)31(27,28)20-8-6-5-7-9-20/h5-9,17-19,21,25H,10-16H2,1-4H3/t17-,18+,21-/m0/s1	SLHJHGLJXJFOQY-UEXGIBASSA-N	456.229407582							97575
N-(Furan-2-ylmethyl)-1-benzofuran-2-carboxamide	LSM-24376	SID7975380, BRD-K37506474	675184	InChI=1S/C14H11NO3/c16-14(15-9-11-5-3-7-17-11)13-8-10-4-1-2-6-12(10)18-13/h1-8H,9H2,(H,15,16)	KHXYMKAYAUKIKZ-UHFFFAOYSA-N	O=C(NCc1occc1)c2oc3ccccc3c2	BroadT	BRD-K37506474	BRD-K37506474-001-05-4	ChemBridge Corporation	5925026			O=C(NCc1ccco1)c1cc2ccccc2o1	InChI=1S/C14H11NO3/c16-14(15-9-11-5-3-7-17-11)13-8-10-4-1-2-6-12(10)18-13/h1-8H,9H2,(H,15,16)	KHXYMKAYAUKIKZ-UHFFFAOYSA-N	241.073893222							112966
SMR000204572	LSM-24377	SID17510698, BRD-K28691049	4250273	InChI=1S/C25H23N3O4S/c1-31-18-9-11-22(32-2)21(15-18)26-23(29)17-8-10-19-20(14-17)27-25(33)28(24(19)30)13-12-16-6-4-3-5-7-16/h3-11,14-15H,12-13H2,1-2H3,(H,26,29)(H,27,33)	ZNNXJUGQMBBINU-UHFFFAOYSA-N	COc1ccc(OC)c(NC(=O)c2ccc3C(=O)N(CCc4ccccc4)C(=S)Nc3c2)c1	BroadT	BRD-K28691049	BRD-K28691049-001-05-1	ChemDiv Inc.	A0061406			COc1ccc(OC)c(NC(=O)c2ccc3c(c2)[nH]c(=S)n(CCc2ccccc2)c3=O)c1	InChI=1S/C25H23N3O4S/c1-31-18-9-11-22(32-2)21(15-18)26-23(29)17-8-10-19-20(14-17)27-25(33)28(24(19)30)13-12-16-6-4-3-5-7-16/h3-11,14-15H,12-13H2,1-2H3,(H,26,29)(H,27,33)	ZNNXJUGQMBBINU-UHFFFAOYSA-N	461.140926936							112967
AC1MMWET	LSM-24378	SID4251843, BRD-A07129075	3245481	InChI=1S/C23H33N3O2S2/c1-25-19-10-14-30-21(19)15-20(25)23(28)26-12-5-7-17(16-26)22(27)24-11-6-13-29-18-8-3-2-4-9-18/h10,14-15,17-18H,2-9,11-13,16H2,1H3,(H,24,27)	YAQLJXYAOXJXGI-UHFFFAOYSA-N	Cn1c(cc2sccc12)C(=O)N3CCCC(C3)C(=O)NCCCSC4CCCCC4	BroadT	BRD-A07129075	BRD-A07129075-001-06-4	ChemDiv Inc.	C779-0196			Cn1c(cc2sccc12)C(=O)N1CCCC(C1)C(=O)NCCCSC1CCCCC1	InChI=1S/C23H33N3O2S2/c1-25-19-10-14-30-21(19)15-20(25)23(28)26-12-5-7-17(16-26)22(27)24-11-6-13-29-18-8-3-2-4-9-18/h10,14-15,17-18H,2-9,11-13,16H2,1H3,(H,24,27)	YAQLJXYAOXJXGI-UHFFFAOYSA-N	447.201418706							112968
SMR000132534	LSM-24379	SID14733237, SID87343635, BRD-K51420828	3677232	InChI=1S/C24H28N4O4S/c1-17(2)5-10-26-24(29)21-16-23(18-6-8-25-9-7-18)27-22-4-3-19(15-20(21)22)33(30,31)28-11-13-32-14-12-28/h3-4,6-9,15-17H,5,10-14H2,1-2H3,(H,26,29)	GBMKCXVVOWPVLC-UHFFFAOYSA-N	CC(C)CCNC(=O)c1cc(nc2ccc(cc12)S(=O)(=O)N3CCOCC3)c4ccncc4	BroadT	BRD-K51420828	BRD-K51420828-001-06-0	ChemDiv Inc.	K788-7046			CC(C)CCNC(=O)c1cc(nc2ccc(cc12)S(=O)(=O)N1CCOCC1)-c1ccncc1	InChI=1S/C24H28N4O4S/c1-17(2)5-10-26-24(29)21-16-23(18-6-8-25-9-7-18)27-22-4-3-19(15-20(21)22)33(30,31)28-11-13-32-14-12-28/h3-4,6-9,15-17H,5,10-14H2,1-2H3,(H,26,29)	GBMKCXVVOWPVLC-UHFFFAOYSA-N	468.183126106							112969
AC1M6MDK	LSM-24380	SID22407583, BRD-K63173062	2451213	InChI=1S/C19H14N6O2S/c26-17(13-7-3-1-4-8-13)22-19(28)23-24-12-20-16-15(18(24)27)11-21-25(16)14-9-5-2-6-10-14/h1-12H,(H2,22,23,26,28)	DPZPUAUTPMFTAC-UHFFFAOYSA-N	O=C(NC(=S)NN1C=Nc2c(cnn2c3ccccc3)C1=O)c4ccccc4	BroadT	BRD-K63173062	BRD-K63173062-001-05-8	Enamine Ltd.	T0518-2688			O=C(NC(=S)Nn1cnc2n(ncc2c1=O)-c1ccccc1)c1ccccc1	InChI=1S/C19H14N6O2S/c26-17(13-7-3-1-4-8-13)22-19(28)23-24-12-20-16-15(18(24)27)11-21-25(16)14-9-5-2-6-10-14/h1-12H,(H2,22,23,26,28)	DPZPUAUTPMFTAC-UHFFFAOYSA-N	390.089894438							112970
T5343639	LSM-24381	SID22409379, BRD-A17987463	4780122	InChI=1S/C26H25N3O3S/c1-3-16-29-25(31)21-14-7-8-15-22(21)28-26(29)33-23(18-10-5-4-6-11-18)24(30)27-19-12-9-13-20(17-19)32-2/h4-15,17,23H,3,16H2,1-2H3,(H,27,30)	CBPVTSAIGCANEC-UHFFFAOYSA-N	CCCN1C(=Nc2ccccc2C1=O)SC(C(=O)Nc3cccc(OC)c3)c4ccccc4	BroadT	BRD-A17987463	BRD-A17987463-001-05-5	Enamine Ltd.	T5343639			CCCn1c(SC(C(=O)Nc2cccc(OC)c2)c2ccccc2)nc2ccccc2c1=O	InChI=1S/C26H25N3O3S/c1-3-16-29-25(31)21-14-7-8-15-22(21)28-26(29)33-23(18-10-5-4-6-11-18)24(30)27-19-12-9-13-20(17-19)32-2/h4-15,17,23H,3,16H2,1-2H3,(H,27,30)	CBPVTSAIGCANEC-UHFFFAOYSA-N	459.16166238							112971
AC1O78ZN	LSM-24382	SID26665493, BRD-K05369726	6578542	InChI=1S/C21H23N3O5S/c1-27-16-9-13(10-17(28-2)18(16)29-3)19(25)22-21(30)24-23-20(26)15-11-14(15)12-7-5-4-6-8-12/h4-10,14-15H,11H2,1-3H3,(H,23,26)(H2,22,24,25,30)/t14-,15+/m1/s1	QHSOQFZJNNJVSY-CABCVRRESA-N	COc1cc(cc(OC)c1OC)C(=O)NC(=S)NNC(=O)[C@H]2C[C@@H]2c3ccccc3	BroadT	BRD-K05369726	BRD-K05369726-001-05-1	InterBioScreen Ltd.	STOCK3S-60056			COc1cc(cc(OC)c1OC)C(=O)NC(=S)NNC(=O)[C@H]1C[C@@H]1c1ccccc1	InChI=1S/C21H23N3O5S/c1-27-16-9-13(10-17(28-2)18(16)29-3)19(25)22-21(30)24-23-20(26)15-11-14(15)12-7-5-4-6-8-12/h4-10,14-15H,11H2,1-3H3,(H,23,26)(H2,22,24,25,30)/t14-,15+/m1/s1	QHSOQFZJNNJVSY-CABCVRRESA-N	429.135841556							112972
MLS000101835	LSM-24383	SID7971169, BRD-K98271860	3382936	InChI=1S/C22H27FN6O4/c1-4-33-22(32)28-11-9-27(10-12-28)14-17-24-19-18(20(30)26(3)21(31)25(19)2)29(17)13-15-5-7-16(23)8-6-15/h5-8H,4,9-14H2,1-3H3	OXCMSADYSGMAJI-UHFFFAOYSA-N	CCOC(=O)N1CCN(Cc2nc3N(C)C(=O)N(C)C(=O)c3n2Cc4ccc(F)cc4)CC1	BroadT	BRD-K98271860	BRD-K98271860-001-05-3	Life Chemicals Inc.	F0634-0135			CCOC(=O)N1CCN(Cc2nc3n(C)c(=O)n(C)c(=O)c3n2Cc2ccc(F)cc2)CC1	InChI=1S/C22H27FN6O4/c1-4-33-22(32)28-11-9-27(10-12-28)14-17-24-19-18(20(30)26(3)21(31)25(19)2)29(17)13-15-5-7-16(23)8-6-15/h5-8H,4,9-14H2,1-3H3	OXCMSADYSGMAJI-UHFFFAOYSA-N	458.207781604							112973
BAS 00486818	LSM-24384	SID7975895, BRD-K67737633	673766	InChI=1S/C17H19NO4S/c1-2-21-17(20)14-11-7-4-3-5-9-13(11)23-16(14)18-15(19)12-8-6-10-22-12/h6,8,10H,2-5,7,9H2,1H3,(H,18,19)	SCIMXCMXGZZKTB-UHFFFAOYSA-N	CCOC(=O)c1c2CCCCCc2sc1NC(=O)c3occc3	BroadT	BRD-K67737633	BRD-K67737633-001-05-6	ChemBridge Corporation	5583416			CCOC(=O)c1c(NC(=O)c2ccco2)sc2CCCCCc12	InChI=1S/C17H19NO4S/c1-2-21-17(20)14-11-7-4-3-5-9-13(11)23-16(14)18-15(19)12-8-6-10-22-12/h6,8,10H,2-5,7,9H2,1H3,(H,18,19)	SCIMXCMXGZZKTB-UHFFFAOYSA-N	333.103478788							112974
2-(4-Phenylpiperazino)quinoxaline	LSM-24385	SID14729442, BRD-K60779521	3812356	InChI=1S/C18H18N4/c1-2-6-15(7-3-1)21-10-12-22(13-11-21)18-14-19-16-8-4-5-9-17(16)20-18/h1-9,14H,10-13H2	QGSFDXOMOOGDSK-UHFFFAOYSA-N	C1CN(CCN1c2ccccc2)c3cnc4ccccc4n3	BroadT	BRD-K60779521	BRD-K60779521-001-06-8	Key Organics Ltd.	9.00E-50			C1CN(CCN1c1ccccc1)c1cnc2ccccc2n1	InChI=1S/C18H18N4/c1-2-6-15(7-3-1)21-10-12-22(13-11-21)18-14-19-16-8-4-5-9-17(16)20-18/h1-9,14H,10-13H2	QGSFDXOMOOGDSK-UHFFFAOYSA-N	290.153146616							112975
MLS000696567	LSM-24386	SID17515835, BRD-K91984555	3528812	InChI=1S/C18H18N2O2S/c1-11-8-14-10-13(17(21)20-15(14)9-12(11)2)5-6-19-18(22)16-4-3-7-23-16/h3-4,7-10H,5-6H2,1-2H3,(H,19,22)(H,20,21)	UGPXTGBCBIMAAQ-UHFFFAOYSA-N	Cc1cc2cc(CCNC(=O)c3cccs3)c(O)nc2cc1C	BroadT	BRD-K91984555	BRD-K91984555-001-04-1	Life Chemicals Inc.	F0611-0041			Cc1cc2cc(CCNC(=O)c3cccs3)c(O)nc2cc1C	InChI=1S/C18H18N2O2S/c1-11-8-14-10-13(17(21)20-15(14)9-12(11)2)5-6-19-18(22)16-4-3-7-23-16/h3-4,7-10H,5-6H2,1-2H3,(H,19,22)(H,20,21)	UGPXTGBCBIMAAQ-UHFFFAOYSA-N	326.108898526							112976
MLS000583504	LSM-24387	SID22401396, BRD-K27531162	4105278	InChI=1S/C17H16N2O2S/c1-20-14-7-3-12(4-8-14)16-11-19(17(22)18-16)13-5-9-15(21-2)10-6-13/h3-11H,1-2H3,(H,18,22)	ODKDXITYOHYPBY-UHFFFAOYSA-N	COc1ccc(cc1)c2cn(c(S)n2)c3ccc(OC)cc3	BroadT	BRD-K27531162	BRD-K27531162-001-05-1	ChemDiv Inc.	K241-0142			COc1ccc(cc1)-c1cn(c(S)n1)-c1ccc(OC)cc1	InChI=1S/C17H16N2O2S/c1-20-14-7-3-12(4-8-14)16-11-19(17(22)18-16)13-5-9-15(21-2)10-6-13/h3-11H,1-2H3,(H,18,22)	ODKDXITYOHYPBY-UHFFFAOYSA-N	312.093248462							112977
ST061538	LSM-24388	SID4258847, BRD-K37211721	803077	InChI=1S/C13H12FNOS/c14-11-5-3-10(4-6-11)9-15-13(16)8-12-2-1-7-17-12/h1-7H,8-9H2,(H,15,16)	MDMWKXBMIDPICX-UHFFFAOYSA-N	Fc1ccc(CNC(=O)Cc2cccs2)cc1	BroadT	BRD-K37211721	BRD-K37211721-001-05-2	ChemBridge Corporation	7004241			Fc1ccc(CNC(=O)Cc2cccs2)cc1	InChI=1S/C13H12FNOS/c14-11-5-3-10(4-6-11)9-15-13(16)8-12-2-1-7-17-12/h1-7H,8-9H2,(H,15,16)	MDMWKXBMIDPICX-UHFFFAOYSA-N	249.062362904							112978
MLS000676426	LSM-24389	SID24786403, BRD-K46715633	1017047	InChI=1S/C21H16N2O3S/c24-19(16-8-6-15(7-9-16)14-4-2-1-3-5-14)23-21(27)22-18-12-10-17(11-13-18)20(25)26/h1-13H,(H,25,26)(H2,22,23,24,27)	RBKZPYOUFIPFPA-UHFFFAOYSA-N	OC(=O)c1ccc(NC(=S)NC(=O)c2ccc(cc2)c3ccccc3)cc1	BroadT	BRD-K46715633	BRD-K46715633-001-06-6	ChemBridge Corporation	7004800			OC(=O)c1ccc(NC(=S)NC(=O)c2ccc(cc2)-c2ccccc2)cc1	InChI=1S/C21H16N2O3S/c24-19(16-8-6-15(7-9-16)14-4-2-1-3-5-14)23-21(27)22-18-12-10-17(11-13-18)20(25)26/h1-13H,(H,25,26)(H2,22,23,24,27)	RBKZPYOUFIPFPA-UHFFFAOYSA-N	376.088163082							112979
1-(2,6-Dimethylphenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]thiourea	LSM-24390	SID22403030, BRD-K55063619	2373826	InChI=1S/C16H23N3OS/c1-12-6-3-7-13(2)15(12)18-16(21)17-9-5-11-19-10-4-8-14(19)20/h3,6-7H,4-5,8-11H2,1-2H3,(H2,17,18,21)	CYMBSIAOCBGUTO-UHFFFAOYSA-N	Cc1cccc(C)c1N=C(S)NCCCN2CCCC2=O	BroadT	BRD-K55063619	BRD-K55063619-001-05-9	Enamine Ltd.	T0512-9360			Cc1cccc(C)c1N=C(S)NCCCN1CCCC1=O	InChI=1S/C16H23N3OS/c1-12-6-3-7-13(2)15(12)18-16(21)17-9-5-11-19-10-4-8-14(19)20/h3,6-7H,4-5,8-11H2,1-2H3,(H2,17,18,21)	CYMBSIAOCBGUTO-UHFFFAOYSA-N	305.156183076							112980
MLS000547890	LSM-44043	SID14727904, BRD-K41570285	6045577	InChI=1S/C21H21N3O5/c1-3-29-18-11-14(7-8-17(18)25)10-16-20(27)24(21(28)23-16)12-19(26)22-15-6-4-5-13(2)9-15/h4-11,25H,3,12H2,1-2H3,(H,22,26)(H,23,28)/b16-10+	KVQYKZAGHFWBBH-MHWRWJLKSA-N	CCOc1cc(\C=C/2\NC(=O)N(CC(=O)Nc3cccc(C)c3)C2=O)ccc1O	BroadT	BRD-K41570285	BRD-K41570285-001-06-1	Specs	AN-648/41667200			CCOc1cc(\C=C2\NC(=O)N(CC(=O)Nc3cccc(C)c3)C2=O)ccc1O	InChI=1S/C21H21N3O5/c1-3-29-18-11-14(7-8-17(18)25)10-16-20(27)24(21(28)23-16)12-19(26)22-15-6-4-5-13(2)9-15/h4-11,25H,3,12H2,1-2H3,(H,22,26)(H,23,28)/b16-10+	KVQYKZAGHFWBBH-MHWRWJLKSA-N	395.148120802							
BAS 03183031	LSM-44044	SID49645783, BRD-K51389667	5767456	InChI=1S/C22H18N2O5/c1-4-10-29-19-9-8-15(12-20(19)28-3)11-18-14(2)23-24(21(18)25)17-7-5-6-16(13-17)22(26)27/h1,5-9,11-13H,10H2,2-3H3,(H,26,27)/b18-11+	NJWUHLOOLLYOSU-WOJGMQOQSA-N	COc1cc(\C=C\2/C(=NN(C2=O)c3cccc(c3)C(=O)O)C)ccc1OCC#C	BroadT	BRD-K51389667	BRD-K51389667-001-07-9	Asinex Ltd.	BAS 03183031			COc1cc(\C=C2C(=O)N(N=C\2C)c2cccc(c2)C(O)=O)ccc1OCC#C	InChI=1S/C22H18N2O5/c1-4-10-29-19-9-8-15(12-20(19)28-3)11-18-14(2)23-24(21(18)25)17-7-5-6-16(13-17)22(26)27/h1,5-9,11-13H,10H2,2-3H3,(H,26,27)/b18-11+	NJWUHLOOLLYOSU-WOJGMQOQSA-N	390.121571696							
MLS000097484	LSM-44045	SID3716913, BRD-K72342856	2090114	InChI=1S/C10H8ClNO3S2/c11-7-1-3-8(4-2-7)17(14,15)6-10-12-9(13)5-16-10/h1-4,6H,5H2,(H,12,13)/b10-6-	KXUWWMFEWAJUGE-POHAHGRESA-N	Clc1ccc(cc1)S(=O)(=O)\C=C/2\NC(=O)CS2	BroadT	BRD-K72342856	BRD-K72342856-001-05-8	Enamine Ltd.	T5269441			Clc1ccc(cc1)S(=O)(=O)\C=C1\NC(=O)CS1	InChI=1S/C10H8ClNO3S2/c11-7-1-3-8(4-2-7)17(14,15)6-10-12-9(13)5-16-10/h1-4,6H,5H2,(H,12,13)/b10-6-	KXUWWMFEWAJUGE-POHAHGRESA-N	288.963412216							
STK277105	LSM-24394	SID14734482, BRD-K39966149	2232250	InChI=1S/C19H17FN2O3/c1-11(2)10-22-18(24)13-8-7-12(9-15(13)19(22)25)21-17(23)14-5-3-4-6-16(14)20/h3-9,11H,10H2,1-2H3,(H,21,23)	CTIUPHADXOXJFH-UHFFFAOYSA-N	CC(C)CN1C(=O)c2ccc(NC(=O)c3ccccc3F)cc2C1=O	BroadT	BRD-K39966149	BRD-K39966149-001-05-3	ChemBridge Corporation	7967864			CC(C)CN1C(=O)c2ccc(NC(=O)c3ccccc3F)cc2C1=O	InChI=1S/C19H17FN2O3/c1-11(2)10-22-18(24)13-8-7-12(9-15(13)19(22)25)21-17(23)14-5-3-4-6-16(14)20/h3-9,11H,10H2,1-2H3,(H,21,23)	CTIUPHADXOXJFH-UHFFFAOYSA-N	340.122320624							112984
AC1MTW48	LSM-24395	BRD-K57743985	3608796	InChI=1S/C20H18N8O2S/c1-13-7-9-15(10-8-13)31-12-16-17(23-27-28(16)19-18(21)25-30-26-19)20(29)24-22-11-14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H2,21,25)(H,24,29)	QERPLXGPAAXKLD-UHFFFAOYSA-N	Cc1ccc(SCc2c(nnn2c3nonc3N)C(=O)NN=Cc4ccccc4)cc1	BroadT	BRD-K57743985	BRD-K57743985-001-08-4	InterBioScreen Ltd.	STOCK4S-96635			Cc1ccc(SCc2c(nnn2-c2nonc2N)C(=O)NN=Cc2ccccc2)cc1	InChI=1S/C20H18N8O2S/c1-13-7-9-15(10-8-13)31-12-16-17(23-27-28(16)19-18(21)25-30-26-19)20(29)24-22-11-14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H2,21,25)(H,24,29)	QERPLXGPAAXKLD-UHFFFAOYSA-N	434.127342586							112985
T0517-7108	LSM-44046	SID17516541, BRD-K89291444	2437146	InChI=1S/C26H25NO4/c1-18-13-14-19(2)23(15-18)27-25(28)17-31-26(29)22(20-9-5-4-6-10-20)16-21-11-7-8-12-24(21)30-3/h4-16H,17H2,1-3H3,(H,27,28)/b22-16+	NEEGVWAAPDHIGY-CJLVFECKSA-N	COc1ccccc1\C=C(\C(=O)OCC(=O)Nc2cc(C)ccc2C)/c3ccccc3	BroadT	BRD-K89291444	BRD-K89291444-001-05-7	Enamine Ltd.	T0517-7108			COc1ccccc1\C=C(\C(=O)OCC(=O)Nc1cc(C)ccc1C)c1ccccc1	InChI=1S/C26H25NO4/c1-18-13-14-19(2)23(15-18)27-25(28)17-31-26(29)22(20-9-5-4-6-10-20)16-21-11-7-8-12-24(21)30-3/h4-16H,17H2,1-3H3,(H,27,28)/b22-16+	NEEGVWAAPDHIGY-CJLVFECKSA-N	415.17835829							
CHEMDIV1_013785	LSM-15244	BRD-K70888550	5191112	InChI=1S/C19H15N3O2S3/c1-11-7-3-4-8-12(11)21-16-15(27-19(21)26)17(23)22(18(25)20-16)13-9-5-6-10-14(13)24-2/h3-10H,1-2H3,(H,20,25)	MJVUHJPNTJMSAN-UHFFFAOYSA-N	COc1ccccc1N2C(=S)NC3=C(SC(=S)N3c4ccccc4C)C2=O	BroadT	BRD-K70888550	BRD-K70888550-226-05-4	ChemDiv Inc.	K286-3292		CCN(CC)CC	COc1ccccc1-n1c(=S)[nH]c2n(-c3ccccc3C)c(=S)sc2c1=O.CCN(CC)CC	InChI=1S/C19H15N3O2S3.C6H15N/c1-11-7-3-4-8-12(11)21-16-15(27-19(21)26)17(23)22(18(25)20-16)13-9-5-6-10-14(13)24-2;1-4-7(5-2)6-3/h3-10H,1-2H3,(H,20,25);4-6H2,1-3H3	DLBIIVHJRWWFNC-UHFFFAOYSA-N	413.03263882							103891, 103891
MLS000541534	LSM-24397	SID14729970, BRD-K65703787	3740446	InChI=1S/C18H23NO3S/c1-5-6-11-19-15(4)12-14(3)17(18(19)20)23(21,22)16-10-8-7-9-13(16)2/h7-10,12H,5-6,11H2,1-4H3	RVNMUGNFFPMVOU-UHFFFAOYSA-N	CCCCN1C(=CC(=C(C1=O)S(=O)(=O)c2ccccc2C)C)C	BroadT	BRD-K65703787	BRD-K65703787-001-06-2	Key Organics Ltd.	7J-341S			CCCCn1c(C)cc(C)c(c1=O)S(=O)(=O)c1ccccc1C	InChI=1S/C18H23NO3S/c1-5-6-11-19-15(4)12-14(3)17(18(19)20)23(21,22)16-10-8-7-9-13(16)2/h7-10,12H,5-6,11H2,1-4H3	RVNMUGNFFPMVOU-UHFFFAOYSA-N	333.139864296							112987
2-Phenoxyethyl n-phenylcarbamate	LSM-24398	SID7974653, BRD-K63456002	346767	InChI=1S/C15H15NO3/c17-15(16-13-7-3-1-4-8-13)19-12-11-18-14-9-5-2-6-10-14/h1-10H,11-12H2,(H,16,17)	UQBMHYREWDMIHR-UHFFFAOYSA-N	O=C(Nc1ccccc1)OCCOc2ccccc2	BroadT	BRD-K63456002	BRD-K63456002-001-07-6	ChemBridge Corporation	5406572			O=C(Nc1ccccc1)OCCOc1ccccc1	InChI=1S/C15H15NO3/c17-15(16-13-7-3-1-4-8-13)19-12-11-18-14-9-5-2-6-10-14/h1-10H,11-12H2,(H,16,17)	UQBMHYREWDMIHR-UHFFFAOYSA-N	257.10519335							112988
6D-078	LSM-44047	SID14732546, BRD-K89630816	5918495	InChI=1S/C10H8Cl2N2O/c11-8-2-1-7(5-9(8)12)6-14-4-3-10(15)13-14/h1-2,5-6H,3-4H2/b14-6+	LMPZWYJEHZUASK-MKMNVTDBSA-N	Clc1ccc(\C=[N+]\2/CCC(=O)[N-]2)cc1Cl	BroadT	BRD-K89630816	BRD-K89630816-001-06-4	Key Organics Ltd.	6D-078			Clc1ccc(\C=[N+]2/CCC(=O)[N-]2)cc1Cl	InChI=1S/C10H8Cl2N2O/c11-8-2-1-7(5-9(8)12)6-14-4-3-10(15)13-14/h1-2,5-6H,3-4H2/b14-6+	LMPZWYJEHZUASK-MKMNVTDBSA-N	242.001368316							
AC1MCFAG	LSM-24400	BRD-K02670915	2768222	InChI=1S/C19H18Cl2N4O4/c1-29-22-12-13-2-5-17(18(10-13)25(27)28)23-6-8-24(9-7-23)19(26)15-4-3-14(20)11-16(15)21/h2-5,10-12H,6-9H2,1H3	NAZXPGOWNUINLU-UHFFFAOYSA-N	CON=Cc1ccc(N2CCN(CC2)C(=O)c3ccc(Cl)cc3Cl)c(c1)[N+](=O)[O-]	BroadT	BRD-K02670915	BRD-K02670915-001-05-6	Key Organics Ltd.	11R-1140			CON=Cc1ccc(N2CCN(CC2)C(=O)c2ccc(Cl)cc2Cl)c(c1)[N+]([O-])=O	InChI=1S/C19H18Cl2N4O4/c1-29-22-12-13-2-5-17(18(10-13)25(27)28)23-6-8-24(9-7-23)19(26)15-4-3-14(20)11-16(15)21/h2-5,10-12H,6-9H2,1H3	NAZXPGOWNUINLU-UHFFFAOYSA-N	436.070510516							112990
1-(Chloroacetyl)-4-(3-methylbenzyl)piperazine	LSM-24401	SID17517478, BRD-K92465114	2454965	InChI=1S/C14H19ClN2O/c1-12-3-2-4-13(9-12)11-16-5-7-17(8-6-16)14(18)10-15/h2-4,9H,5-8,10-11H2,1H3	DVBSBXBABNLMIS-UHFFFAOYSA-N	Cc1cccc(CN2CCN(CC2)C(=O)CCl)c1	BroadT	BRD-K92465114	BRD-K92465114-001-07-7	Enamine Ltd.	T5311465			Cc1cccc(CN2CCN(CC2)C(=O)CCl)c1	InChI=1S/C14H19ClN2O/c1-12-3-2-4-13(9-12)11-16-5-7-17(8-6-16)14(18)10-15/h2-4,9H,5-8,10-11H2,1H3	DVBSBXBABNLMIS-UHFFFAOYSA-N	266.118590958							112991
5-{[(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl]amino}-2-hydroxybenzoic acid	LSM-24402	SID14734905, BRD-K92974800	1287305	InChI=1S/C19H23NO5S/c1-11-8-13(19(3,4)5)9-17(12(11)2)26(24,25)20-14-6-7-16(21)15(10-14)18(22)23/h6-10,20-21H,1-5H3,(H,22,23)	UTLSNXSHWQOXQS-UHFFFAOYSA-N	Cc1cc(cc(c1C)S(=O)(=O)Nc2ccc(O)c(c2)C(=O)O)C(C)(C)C	BroadT	BRD-K92974800	BRD-K92974800-001-05-1	ChemBridge Corporation	7659588			Cc1cc(cc(c1C)S(=O)(=O)Nc1ccc(O)c(c1)C(O)=O)C(C)(C)C	InChI=1S/C19H23NO5S/c1-11-8-13(19(3,4)5)9-17(12(11)2)26(24,25)20-14-6-7-16(21)15(10-14)18(22)23/h6-10,20-21H,1-5H3,(H,22,23)	UTLSNXSHWQOXQS-UHFFFAOYSA-N	377.129693536							112992
STK201477	LSM-44048	SID17432076, BRD-K04930381	974309	InChI=1S/C18H14FN3O/c1-21-16-8-7-12(10-17(16)22(2)18(21)23)9-13(11-20)14-5-3-4-6-15(14)19/h3-10H,1-2H3/b13-9-	JVNWNXCBLKEJCZ-LCYFTJDESA-N	CN1C(=O)N(C)c2cc(\C=C(\C#N)/c3ccccc3F)ccc12	BroadT	BRD-K04930381	BRD-K04930381-001-05-7	ChemBridge Corporation	7913658			Cn1c2ccc(\C=C(\C#N)c3ccccc3F)cc2n(C)c1=O	InChI=1S/C18H14FN3O/c1-21-16-8-7-12(10-17(16)22(2)18(21)23)9-13(11-20)14-5-3-4-6-15(14)19/h3-10H,1-2H3/b13-9-	JVNWNXCBLKEJCZ-LCYFTJDESA-N	307.112090298							
F0539-0093	LSM-24404	SID51085199, BRD-K00758260	3649318	InChI=1S/C20H24N4O4S2/c1-23-11-8-15-16(12-23)29-20(17(15)18(21)25)22-19(26)13-4-6-14(7-5-13)30(27,28)24-9-2-3-10-24/h4-7H,2-3,8-12H2,1H3,(H2,21,25)(H,22,26)	MRJHEYUFJPRHES-UHFFFAOYSA-N	CN1CCc2c(C1)sc(NC(=O)c3ccc(cc3)S(=O)(=O)N4CCCC4)c2C(=O)N	BroadT	BRD-K00758260	BRD-K00758260-001-06-0	Life Chemicals Inc.	F0539-0093			CN1CCc2c(C1)sc(NC(=O)c1ccc(cc1)S(=O)(=O)N1CCCC1)c2C(N)=O	InChI=1S/C20H24N4O4S2/c1-23-11-8-15-16(12-23)29-20(17(15)18(21)25)22-19(26)13-4-6-14(7-5-13)30(27,28)24-9-2-3-10-24/h4-7H,2-3,8-12H2,1H3,(H2,21,25)(H,22,26)	MRJHEYUFJPRHES-UHFFFAOYSA-N	448.123896668							112994
AC1NBYS6	LSM-24405	BRD-K06455802	4525502	InChI=1S/C23H27N7O2/c1-31-19-12-11-17(15-20(19)32-2)16-24-29-22-26-21(25-18-9-5-3-6-10-18)27-23(28-22)30-13-7-4-8-14-30/h3,5-6,9-12,15-16H,4,7-8,13-14H2,1-2H3,(H2,25,26,27,28,29)	IZOFUPNVUOGQTP-UHFFFAOYSA-N	COc1ccc(C=NNc2nc(Nc3ccccc3)nc(n2)N4CCCCC4)cc1OC	BroadT	BRD-K06455802	BRD-K06455802-001-07-0	Specs	AG-205/33155056			COc1ccc(C=NNc2nc(Nc3ccccc3)nc(n2)N2CCCCC2)cc1OC	InChI=1S/C23H27N7O2/c1-31-19-12-11-17(15-20(19)32-2)16-24-29-22-26-21(25-18-9-5-3-6-10-18)27-23(28-22)30-13-7-4-8-14-30/h3,5-6,9-12,15-16H,4,7-8,13-14H2,1-2H3,(H2,25,26,27,28,29)	IZOFUPNVUOGQTP-UHFFFAOYSA-N	433.222623174							112995
CID 7595552	LSM-24406	BRD-A52316346	7595552	InChI=1S/C19H15FN4O2S2/c1-10(22)13(7-21)15(25)9-28-19-23-17-16(18(26)24(19)2)14(8-27-17)11-3-5-12(20)6-4-11/h3-6,8,13,22H,9H2,1-2H3	PZPKYIAWACKNBG-UHFFFAOYSA-N	CN1C(=Nc2scc(c3ccc(F)cc3)c2C1=O)SCC(=O)C(C#N)C(=N)C	BroadT	BRD-A52316346	BRD-A52316346-001-06-4	Enamine Ltd.	T5340573			CC(=N)C(C#N)C(=O)CSc1nc2scc(-c3ccc(F)cc3)c2c(=O)n1C	InChI=1S/C19H15FN4O2S2/c1-10(22)13(7-21)15(25)9-28-19-23-17-16(18(26)24(19)2)14(8-27-17)11-3-5-12(20)6-4-11/h3-6,8,13,22H,9H2,1-2H3	PZPKYIAWACKNBG-UHFFFAOYSA-N	414.06204534							112996
SMR000036143	LSM-24407	SID860237, BRD-K22729678	661541	InChI=1S/C17H14N2S/c1-19-16-10-6-5-9-14(16)15(11-18)17(19)12-20-13-7-3-2-4-8-13/h2-10H,12H2,1H3	XUTSPRNFWFULEQ-UHFFFAOYSA-N	Cn1c(CSc2ccccc2)c(C#N)c3ccccc13	BroadT	BRD-K22729678	BRD-K22729678-001-05-3	InterBioScreen Ltd.	STOCK3S-50595			Cn1c(CSc2ccccc2)c(C#N)c2ccccc12	InChI=1S/C17H14N2S/c1-19-16-10-6-5-9-14(16)15(11-18)17(19)12-20-13-7-3-2-4-8-13/h2-10H,12H2,1H3	XUTSPRNFWFULEQ-UHFFFAOYSA-N	278.087769158							112997
MLS000911312	LSM-24408	SID49714442, BRD-K67184967	24789497	InChI=1S/C24H26N4O4/c1-24(2,3)32-18(29)14-25-22(30)20-21(27-15-26-20)23(31)28-19(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,15,19H,14H2,1-3H3,(H,25,30)(H,26,27)(H,28,31)	GDHJLWFFELBOHM-UHFFFAOYSA-N	CC(C)(C)OC(=O)CNC(=O)c1[nH]cnc1C(=O)NC(c2ccccc2)c3ccccc3	BroadT	BRD-K67184967	BRD-K67184967-001-05-7	University of Tulsa	ILP-II-116 AE05_PA03			CC(C)(C)OC(=O)CNC(=O)c1[nH]cnc1C(=O)NC(c1ccccc1)c1ccccc1	InChI=1S/C24H26N4O4/c1-24(2,3)32-18(29)14-25-22(30)20-21(27-15-26-20)23(31)28-19(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,15,19H,14H2,1-3H3,(H,25,30)(H,26,27)(H,28,31)	GDHJLWFFELBOHM-UHFFFAOYSA-N	434.195405352							112998
AC1NDVT4	LSM-24409	BRD-K18263631	4607759	InChI=1S/C18H17N3OS/c1-12-7-3-5-9-15(12)19-18(23)21-20-13(2)17-11-14-8-4-6-10-16(14)22-17/h3-11H,1-2H3,(H2,19,21,23)	GRIGWBIWQDASMQ-UHFFFAOYSA-N	CC(=NN=C(S)Nc1ccccc1C)c2oc3ccccc3c2	BroadT	BRD-K18263631	BRD-K18263631-001-06-3	Enamine Ltd.	T0510-6391			CC(=NN=C(S)Nc1ccccc1C)c1cc2ccccc2o1	InChI=1S/C18H17N3OS/c1-12-7-3-5-9-15(12)19-18(23)21-20-13(2)17-11-14-8-4-6-10-16(14)22-17/h3-11H,1-2H3,(H2,19,21,23)	GRIGWBIWQDASMQ-UHFFFAOYSA-N	323.109232884							112999
Ethyl 5-[(2-chlorophenyl)sulfanyl]-3-(4-methylphenyl)-1,2,4-triazine-6-carboxylate	LSM-24410	SID14729224, BRD-K42466672	6413078	InChI=1S/C19H16ClN3O2S/c1-3-25-19(24)16-18(26-15-7-5-4-6-14(15)20)21-17(23-22-16)13-10-8-12(2)9-11-13/h4-11H,3H2,1-2H3	XPSUDEBHSZFILW-UHFFFAOYSA-N	CCOC(=O)c1nnc(nc1Sc2ccccc2Cl)c3ccc(C)cc3	BroadT	BRD-K42466672	BRD-K42466672-001-05-4	Key Organics Ltd.	6K-528S			CCOC(=O)c1nnc(nc1Sc1ccccc1Cl)-c1ccc(C)cc1	InChI=1S/C19H16ClN3O2S/c1-3-25-19(24)16-18(26-15-7-5-4-6-14(15)20)21-17(23-22-16)13-10-8-12(2)9-11-13/h4-11H,3H2,1-2H3	XPSUDEBHSZFILW-UHFFFAOYSA-N	385.065175182							113000
MLS000061371	LSM-24411	SID4262897, BRD-K28133160	701063	InChI=1S/C9H7ClN2O2S/c1-13-7-3-2-5(10)4-6(7)8-11-12-9(15)14-8/h2-4H,1H3,(H,12,15)	FOBNNSSNVSMNMG-UHFFFAOYSA-N	COc1ccc(Cl)cc1c2oc(S)nn2	BroadT	BRD-K28133160	BRD-K28133160-001-05-7	ChemBridge Corporation	6079501			COc1ccc(Cl)cc1-c1nnc(S)o1	InChI=1S/C9H7ClN2O2S/c1-13-7-3-2-5(10)4-6(7)8-11-12-9(15)14-8/h2-4H,1H3,(H,12,15)	FOBNNSSNVSMNMG-UHFFFAOYSA-N	241.991675884							113001
MLS000535174	LSM-24412	SID14736934, BRD-K06769522	1314305	InChI=1S/C20H22N4O3S2/c1-26-14(25)10-28-20-17-16(21-11-22-20)15-12-4-2-3-5-13(12)18(23-19(15)29-17)24-6-8-27-9-7-24/h11H,2-10H2,1H3	MBIKWKCJOBYLIT-UHFFFAOYSA-N	COC(=O)CSc1ncnc2c1sc3nc(N4CCOCC4)c5CCCCc5c23	BroadT	BRD-K06769522	BRD-K06769522-001-06-5	ChemBridge Corporation	7380389			COC(=O)CSc1ncnc2c1sc1nc(N3CCOCC3)c3CCCCc3c21	InChI=1S/C20H22N4O3S2/c1-26-14(25)10-28-20-17-16(21-11-22-20)15-12-4-2-3-5-13(12)18(23-19(15)29-17)24-6-8-27-9-7-24/h11H,2-10H2,1H3	MBIKWKCJOBYLIT-UHFFFAOYSA-N	430.113331984							113002
MLS000058898	LSM-24413	SID4262771, BRD-A27475667	2842565	InChI=1S/C13H22N2O2S/c1-5-8-18-13-14-11(16)10(7-3)12(17)15(13)9(4)6-2/h9,16H,5-8H2,1-4H3	BKSVBBOOWFNSIG-UHFFFAOYSA-N	CCCSC1=NC(=C(CC)C(=O)N1C(C)CC)O	BroadT	BRD-A27475667	BRD-A27475667-001-05-3	ChemBridge Corporation	5344703			CCCSc1nc(O)c(CC)c(=O)n1C(C)CC	InChI=1S/C13H22N2O2S/c1-5-8-18-13-14-11(16)10(7-3)12(17)15(13)9(4)6-2/h9,16H,5-8H2,1-4H3	BKSVBBOOWFNSIG-UHFFFAOYSA-N	270.140198654							
AC1NKXH8	LSM-24414	BRD-K34475753	4920691	InChI=1S/C17H14N8O3S/c1-9(10-4-2-5-11(26)8-10)19-21-17(27)13-14(12-6-3-7-29-12)25(24-20-13)16-15(18)22-28-23-16/h2-8,26H,1H3,(H2,18,22)(H,21,27)	RTCJTAUAMXFRDT-UHFFFAOYSA-N	CC(=NNC(=O)c1nnn(c2nonc2N)c1c3cccs3)c4cccc(O)c4	BroadT	BRD-K34475753	BRD-K34475753-001-07-3	InterBioScreen Ltd.	STOCK4S-96277			CC(=NNC(=O)c1nnn(-c2nonc2N)c1-c1cccs1)c1cccc(O)c1	InChI=1S/C17H14N8O3S/c1-9(10-4-2-5-11(26)8-10)19-21-17(27)13-14(12-6-3-7-29-12)25(24-20-13)16-15(18)22-28-23-16/h2-8,26H,1H3,(H2,18,22)(H,21,27)	RTCJTAUAMXFRDT-UHFFFAOYSA-N	410.090957078							113004
MLS000576285	LSM-24415	SID17414647, BRD-A96875824	2933627	InChI=1S/C22H18ClNO4S/c23-16-9-4-5-10-17(16)24-18(13-19(25)15-7-2-1-3-8-15)22(27)28-14-20(26)21-11-6-12-29-21/h1-12,18,24H,13-14H2	XUEJLVAMACFDKR-UHFFFAOYSA-N	Clc1ccccc1NC(CC(=O)c2ccccc2)C(=O)OCC(=O)c3cccs3	BroadT	BRD-A96875824	BRD-A96875824-001-06-8	ChemBridge Corporation	7303014			Clc1ccccc1NC(CC(=O)c1ccccc1)C(=O)OCC(=O)c1cccs1	InChI=1S/C22H18ClNO4S/c23-16-9-4-5-10-17(16)24-18(13-19(25)15-7-2-1-3-8-15)22(27)28-14-20(26)21-11-6-12-29-21/h1-12,18,24H,13-14H2	XUEJLVAMACFDKR-UHFFFAOYSA-N	427.064506466							113005
AC1MEH86	LSM-24416	BRD-A70742512	2878326	InChI=1S/C17H20BrN3O5S/c1-11(17(22)20-19-10-15-9-16(18)12(2)26-15)21(27(4,23)24)13-5-7-14(25-3)8-6-13/h5-11H,1-4H3,(H,20,22)	QCQFERNMXWDZJF-UHFFFAOYSA-N	COc1ccc(cc1)N(C(C)C(=O)NN=Cc2oc(C)c(Br)c2)S(=O)(=O)C	BroadT	BRD-A70742512	BRD-A70742512-001-05-9	ChemBridge Corporation	5951774			COc1ccc(cc1)N(C(C)C(=O)NN=Cc1cc(Br)c(C)o1)S(C)(=O)=O	InChI=1S/C17H20BrN3O5S/c1-11(17(22)20-19-10-15-9-16(18)12(2)26-15)21(27(4,23)24)13-5-7-14(25-3)8-6-13/h5-11H,1-4H3,(H,20,22)	QCQFERNMXWDZJF-UHFFFAOYSA-N	457.03070406							113006
MLS000101429	LSM-24417	SID7970593, BRD-K86587269	2053031	InChI=1S/C14H10BrNO4S2/c1-21-14-13(16-12(20-14)11-3-2-8-19-11)22(17,18)10-6-4-9(15)5-7-10/h2-8H,1H3	QHKYLHMRWORFQS-UHFFFAOYSA-N	CSc1oc(nc1S(=O)(=O)c2ccc(Br)cc2)c3occc3	BroadT	BRD-K86587269	BRD-K86587269-001-04-6	Life Chemicals Inc.	F0586-0561			CSc1oc(nc1S(=O)(=O)c1ccc(Br)cc1)-c1ccco1	InChI=1S/C14H10BrNO4S2/c1-21-14-13(16-12(20-14)11-3-2-8-19-11)22(17,18)10-6-4-9(15)5-7-10/h2-8H,1H3	QHKYLHMRWORFQS-UHFFFAOYSA-N	398.92346179							113007
AC1M64IU	LSM-24418	BRD-K19518999	2391103	InChI=1S/C14H14Cl2N4O2/c1-3-22-14(21)18-17-8-10-9(2)19-20(13(10)16)12-7-5-4-6-11(12)15/h4-8H,3H2,1-2H3,(H,18,21)	WMDJBMOPWXYAEA-UHFFFAOYSA-N	CCOC(=O)NN=Cc1c(C)nn(c1Cl)c2ccccc2Cl	BroadT	BRD-K19518999	BRD-K19518999-001-05-7	Enamine Ltd.	T0506-4877			CCOC(=O)NN=Cc1c(C)nn(c1Cl)-c1ccccc1Cl	InChI=1S/C14H14Cl2N4O2/c1-3-22-14(21)18-17-8-10-9(2)19-20(13(10)16)12-7-5-4-6-11(12)15/h4-8H,3H2,1-2H3,(H,18,21)	WMDJBMOPWXYAEA-UHFFFAOYSA-N	340.049381148							113008
AC1N62D1	LSM-24419	BRD-A73965025	4208651	InChI=1S/C19H23N3O3/c1-19(2,3)13-7-8-15-16(10-13)25-17(12-24-15)18(23)21-20-11-14-6-5-9-22(14)4/h5-11,17H,12H2,1-4H3,(H,21,23)	SYDRAPDZDBQQQL-UHFFFAOYSA-N	Cn1cccc1C=NNC(=O)C2COc3ccc(cc3O2)C(C)(C)C	BroadT	BRD-A73965025	BRD-A73965025-001-05-3	InterBioScreen Ltd.	STOCK2S-59450			Cn1cccc1C=NNC(=O)C1COc2ccc(cc2O1)C(C)(C)C	InChI=1S/C19H23N3O3/c1-19(2,3)13-7-8-15-16(10-13)25-17(12-24-15)18(23)21-20-11-14-6-5-9-22(14)4/h5-11,17H,12H2,1-4H3,(H,21,23)	SYDRAPDZDBQQQL-UHFFFAOYSA-N	341.173941626							113009
AC1LA4TS	LSM-24420	BRD-K36804162	507227	InChI=1S/C18H14N2O4/c1-11-6-7-16-14(8-11)17(22)12(10-24-16)9-19-20-18(23)13-4-2-3-5-15(13)21/h2-10,21H,1H3,(H,20,23)	UJQOMSYTZCOFPH-UHFFFAOYSA-N	Cc1ccc2OC=C(C=NNC(=O)c3ccccc3O)C(=O)c2c1	BroadT	BRD-K36804162	BRD-K36804162-001-06-9	Chemical Technologies & Investigations	DBZA-060511			Cc1ccc2occ(C=NNC(=O)c3ccccc3O)c(=O)c2c1	InChI=1S/C18H14N2O4/c1-11-6-7-16-14(8-11)17(22)12(10-24-16)9-19-20-18(23)13-4-2-3-5-15(13)21/h2-10,21H,1H3,(H,20,23)	UJQOMSYTZCOFPH-UHFFFAOYSA-N	322.095356948							113010
ASN 06918578	LSM-24421	SID26668565, SID842827, BRD-A41658231	645099	InChI=1S/C25H32N6O2/c1-16-10-11-17(2)20(13-16)15-31-23-21(28-29-31)24(32)27-22(26-23)19-9-6-12-30(14-19)25(33)18-7-4-3-5-8-18/h10-11,13,18-19H,3-9,12,14-15H2,1-2H3,(H,26,27,32)	BPELOIYCNAWXDY-UHFFFAOYSA-N	Cc1ccc(C)c(Cn2nnc3c(O)nc(nc23)C4CCCN(C4)C(=O)C5CCCCC5)c1	BroadT	BRD-A41658231	BRD-A41658231-001-05-3	Asinex Ltd.	ASN 06918578			Cc1ccc(C)c(Cn2nnc3c(O)nc(nc23)C2CCCN(C2)C(=O)C2CCCCC2)c1	InChI=1S/C25H32N6O2/c1-16-10-11-17(2)20(13-16)15-31-23-21(28-29-31)24(32)27-22(26-23)19-9-6-12-30(14-19)25(33)18-7-4-3-5-8-18/h10-11,13,18-19H,3-9,12,14-15H2,1-2H3,(H,26,27,32)	BPELOIYCNAWXDY-UHFFFAOYSA-N	448.258674324							
MLS000666216	LSM-44049	SID22415244, BRD-K14784369	5663357	InChI=1S/C23H24N4O3S/c1-15-11-16(2)13-19(12-15)27-22(29)20(21(28)25-23(27)31)14-24-17-3-5-18(6-4-17)26-7-9-30-10-8-26/h3-6,11-14,24H,7-10H2,1-2H3,(H,25,28,31)/b20-14+	WWGDTBSUCNQLMS-XSFVSMFZSA-N	Cc1cc(C)cc(c1)N2C(=S)NC(=O)\C(=C/Nc3ccc(cc3)N4CCOCC4)\C2=O	BroadT	BRD-K14784369	BRD-K14784369-001-06-0	ChemBridge Corporation	7066919			Cc1cc(C)cc(c1)N1C(=S)NC(=O)\C(=C/Nc2ccc(cc2)N2CCOCC2)C1=O	InChI=1S/C23H24N4O3S/c1-15-11-16(2)13-19(12-15)27-22(29)20(21(28)25-23(27)31)14-24-17-3-5-18(6-4-17)26-7-9-30-10-8-26/h3-6,11-14,24H,7-10H2,1-2H3,(H,25,28,31)/b20-14+	WWGDTBSUCNQLMS-XSFVSMFZSA-N	436.156911358							
MLS000722083	LSM-24423	SID17515614, BRD-K31071925	2141277	InChI=1S/C24H18FNO5S/c1-15-2-8-18(9-3-15)32(28,29)23-13-26(12-16-4-6-17(25)7-5-16)20-11-22-21(30-14-31-22)10-19(20)24(23)27/h2-11,13H,12,14H2,1H3	MSEQKMPIPAPCAU-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)C2=CN(Cc3ccc(F)cc3)c4cc5OCOc5cc4C2=O	BroadT	BRD-K31071925	BRD-K31071925-001-05-0	Life Chemicals Inc.	F1606-0072			Cc1ccc(cc1)S(=O)(=O)c1cn(Cc2ccc(F)cc2)c2cc3OCOc3cc2c1=O	InChI=1S/C24H18FNO5S/c1-15-2-8-18(9-3-15)32(28,29)23-13-26(12-16-4-6-17(25)7-5-16)20-11-22-21(30-14-31-22)10-19(20)24(23)27/h2-11,13H,12,14H2,1H3	MSEQKMPIPAPCAU-UHFFFAOYSA-N	451.088971576							113013
SMR000137128	LSM-44050	SID14732094, SID50122270, BRD-A91431966	5290861	InChI=1S/C18H15F3O2/c19-18(20,21)17(23,15-9-5-2-6-10-15)13-16(22)12-11-14-7-3-1-4-8-14/h1-12,23H,13H2/b12-11+	JHXCGMNQFVYVCX-VAWYXSNFSA-N	OC(CC(=O)\C=C\c1ccccc1)(c2ccccc2)C(F)(F)F	BroadT	BRD-A91431966	BRD-A91431966-001-06-3	ChemBridge Corporation	5192681			OC(CC(=O)\C=C\c1ccccc1)(c1ccccc1)C(F)(F)F	InChI=1S/C18H15F3O2/c19-18(20,21)17(23,15-9-5-2-6-10-15)13-16(22)12-11-14-7-3-1-4-8-14/h1-12,23H,13H2/b12-11+	JHXCGMNQFVYVCX-VAWYXSNFSA-N	320.10241432							
MLS000911291	LSM-24425	SID49714428, BRD-K45593020	24789483	InChI=1S/C28H33N5O4/c1-28(2,3)37-27(36)22(18-20-10-6-4-7-11-20)31-25(34)23-24(30-19-29-23)26(35)33-16-14-32(15-17-33)21-12-8-5-9-13-21/h4-13,19,22H,14-18H2,1-3H3,(H,29,30)(H,31,34)/t22-/m0/s1	LEDSKCIDPIEJLN-QFIPXVFZSA-N	CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)c2[nH]cnc2C(=O)N3CCN(CC3)c4ccccc4	BroadT	BRD-K45593020	BRD-K45593020-001-05-1	University of Tulsa	ILP-I-66 AE07_SA02			CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)c1[nH]cnc1C(=O)N1CCN(CC1)c1ccccc1	InChI=1S/C28H33N5O4/c1-28(2,3)37-27(36)22(18-20-10-6-4-7-11-20)31-25(34)23-24(30-19-29-23)26(35)33-16-14-32(15-17-33)21-12-8-5-9-13-21/h4-13,19,22H,14-18H2,1-3H3,(H,29,30)(H,31,34)/t22-/m0/s1	LEDSKCIDPIEJLN-QFIPXVFZSA-N	503.253254586							113015
ST50903263	LSM-24426	SID24794671, BRD-K70709178	6464249	InChI=1S/C19H22ClN3O/c20-17-6-2-3-7-18(17)22-19(24)21-16-10-8-15(9-11-16)14-23-12-4-1-5-13-23/h2-3,6-11H,1,4-5,12-14H2,(H2,21,22,24)	UBABFXTUUWDKDL-UHFFFAOYSA-N	Clc1ccccc1NC(=O)Nc2ccc(CN3CCCCC3)cc2	BroadT	BRD-K70709178	BRD-K70709178-001-05-1	ChemBridge Corporation	9042043			Clc1ccccc1NC(=O)Nc1ccc(CN2CCCCC2)cc1	InChI=1S/C19H22ClN3O/c20-17-6-2-3-7-18(17)22-19(24)21-16-10-8-15(9-11-16)14-23-12-4-1-5-13-23/h2-3,6-11H,1,4-5,12-14H2,(H2,21,22,24)	UBABFXTUUWDKDL-UHFFFAOYSA-N	343.145140064							113016
MLS000074986	LSM-24427	SID848749, BRD-K37768620	651205	InChI=1S/C11H12N4O/c1-4-8-6(2)13-10-9(5-12)7(3)14-15(10)11(8)16/h16H,4H2,1-3H3	KMUIIAQSGDHUBP-UHFFFAOYSA-N	CCc1c(C)nc2c(C#N)c(C)nn2c1O	BroadT	BRD-K37768620	BRD-K37768620-001-06-1	Asinex Ltd.	BAS 05427565			CCc1c(C)nc2c(C#N)c(C)nn2c1O	InChI=1S/C11H12N4O/c1-4-8-6(2)13-10-9(5-12)7(3)14-15(10)11(8)16/h16H,4H2,1-3H3	KMUIIAQSGDHUBP-UHFFFAOYSA-N	216.101111044							
6-(2-Fluorobenzyl)-2,4-dimethyl-4,6-dihydro-5H-thieno[2',3':4,5]pyrrolo[2,3-d]pyridazin-5-one	LSM-3830	SID851783, SID57646208, SID57646207, BRD-K81538844	654376	InChI=1S/C17H14FN3OS/c1-10-7-14-16(23-10)12-8-19-21(17(22)15(12)20(14)2)9-11-5-3-4-6-13(11)18/h3-8H,9H2,1-2H3	IEWYEWDDQWYJLU-UHFFFAOYSA-N	Cc1cc2c(s1)c3C=NN(Cc4ccccc4F)C(=O)c3n2C	BroadT	BRD-K81538844	BRD-K81538844-001-05-5	Asinex Ltd.	ASN 09857966			Cc1cc2n(C)c3c(cnn(Cc4ccccc4F)c3=O)c2s1	InChI=1S/C17H14FN3OS/c1-10-7-14-16(23-10)12-8-19-21(17(22)15(12)20(14)2)9-11-5-3-4-6-13(11)18/h3-8H,9H2,1-2H3	IEWYEWDDQWYJLU-UHFFFAOYSA-N	327.084160988							93430
MLS000554302	LSM-24428	SID14742386, BRD-K62153387	1871516	InChI=1S/C12H17N5O/c1-8-7-11(13-4-5-18)15-12(14-8)17-10(3)6-9(2)16-17/h6-7,18H,4-5H2,1-3H3,(H,13,14,15)	ZQONPFLBSYILMM-UHFFFAOYSA-N	Cc1cc(NCCO)nc(n1)n2nc(C)cc2C	BroadT	BRD-K62153387	BRD-K62153387-001-05-9	InterBioScreen Ltd.	STOCK2S-26799			Cc1cc(C)n(n1)-c1nc(C)cc(NCCO)n1	InChI=1S/C12H17N5O/c1-8-7-11(13-4-5-18)15-12(14-8)17-10(3)6-9(2)16-17/h6-7,18H,4-5H2,1-3H3,(H,13,14,15)	ZQONPFLBSYILMM-UHFFFAOYSA-N	247.143310214							113018
F1873-2635	LSM-24429	SID51086804, BRD-K83691254	24892134	InChI=1S/C22H17F2N5O3S/c1-28-19-17(21(31)29(2)22(28)32)20(27-18(26-19)12-7-3-4-8-13(12)23)33-11-16(30)25-15-10-6-5-9-14(15)24/h3-10H,11H2,1-2H3,(H,25,30)	FYPQJYNLIRLFPZ-UHFFFAOYSA-N	CN1C(=O)N(C)c2nc(nc(SCC(=O)Nc3ccccc3F)c2C1=O)c4ccccc4F	BroadT	BRD-K83691254	BRD-K83691254-001-05-3	Life Chemicals Inc.	F1873-2635			Cn1c2nc(nc(SCC(=O)Nc3ccccc3F)c2c(=O)n(C)c1=O)-c1ccccc1F	InChI=1S/C22H17F2N5O3S/c1-28-19-17(21(31)29(2)22(28)32)20(27-18(26-19)12-7-3-4-8-13(12)23)33-11-16(30)25-15-10-6-5-9-14(15)24/h3-10H,11H2,1-2H3,(H,25,30)	FYPQJYNLIRLFPZ-UHFFFAOYSA-N	469.102016544							113019
SMR000144552	LSM-24430	SID14729119, BRD-K05155873	2231188	InChI=1S/C13H8BrNO3/c1-7-2-3-9-8(6-7)13(16)18-12(15-9)10-4-5-11(14)17-10/h2-6H,1H3	HREQOUGNQJNFMP-UHFFFAOYSA-N	Cc1ccc2N=C(OC(=O)c2c1)c3oc(Br)cc3	BroadT	BRD-K05155873	BRD-K05155873-001-05-5	ChemBridge Corporation	7964909			Cc1ccc2nc(oc(=O)c2c1)-c1ccc(Br)o1	InChI=1S/C13H8BrNO3/c1-7-2-3-9-8(6-7)13(16)18-12(15-9)10-4-5-11(14)17-10/h2-6H,1H3	HREQOUGNQJNFMP-UHFFFAOYSA-N	304.968755726							113020
STK093549	LSM-24431	SID17414981, BRD-K22059733	1328539	InChI=1S/C17H15ClN2O5S/c1-24-11-5-9(6-12(8-11)25-2)15(21)20-17(26)19-10-3-4-14(18)13(7-10)16(22)23/h3-8H,1-2H3,(H,22,23)(H2,19,20,21,26)	BDWJQTNJPVRXKT-UHFFFAOYSA-N	COc1cc(OC)cc(c1)C(=O)NC(=S)Nc2ccc(Cl)c(c2)C(=O)O	BroadT	BRD-K22059733	BRD-K22059733-001-05-8	ChemBridge Corporation	7007497			COc1cc(OC)cc(c1)C(=O)NC(=S)Nc1ccc(Cl)c(c1)C(O)=O	InChI=1S/C17H15ClN2O5S/c1-24-11-5-9(6-12(8-11)25-2)15(21)20-17(26)19-10-3-4-14(18)13(7-10)16(22)23/h3-8H,1-2H3,(H,22,23)(H2,19,20,21,26)	BDWJQTNJPVRXKT-UHFFFAOYSA-N	394.03902							113021
F0466-0093	LSM-24432	SID24824318, BRD-K17511700	5220580	InChI=1S/C14H12Cl2N2O3S/c1-7-13(8(2)19)22-14(17-7)18-12(20)6-21-11-4-3-9(15)5-10(11)16/h3-5H,6H2,1-2H3,(H,17,18,20)	ZUWLDPJBSZWFOH-UHFFFAOYSA-N	CC(=O)c1sc(NC(=O)COc2ccc(Cl)cc2Cl)nc1C	BroadT	BRD-K17511700	BRD-K17511700-001-05-4	Life Chemicals Inc.	F0466-0093			CC(=O)c1sc(NC(=O)COc2ccc(Cl)cc2Cl)nc1C	InChI=1S/C14H12Cl2N2O3S/c1-7-13(8(2)19)22-14(17-7)18-12(20)6-21-11-4-3-9(15)5-10(11)16/h3-5H,6H2,1-2H3,(H,17,18,20)	ZUWLDPJBSZWFOH-UHFFFAOYSA-N	357.994568374							113022
AK-968/41170129	LSM-24433	SID4252376, BRD-A37077777	3245937	InChI=1S/C15H14N2O4/c1-21-12-8-4-6-10(13(12)18)14-16-11-7-3-2-5-9(11)15(19)17(14)20/h2-8,14,16,18,20H,1H3	ALSPBPOXXIUURS-UHFFFAOYSA-N	COc1cccc(C2Nc3ccccc3C(=O)N2O)c1O	BroadT	BRD-A37077777	BRD-A37077777-001-05-2	ChemDiv Inc.	6049-0187			COc1cccc(C2Nc3ccccc3C(=O)N2O)c1O	InChI=1S/C15H14N2O4/c1-21-12-8-4-6-10(13(12)18)14-16-11-7-3-2-5-9(11)15(19)17(14)20/h2-8,14,16,18,20H,1H3	ALSPBPOXXIUURS-UHFFFAOYSA-N	286.095356948							113023
AC1MJWSR	LSM-24434	BRD-K93356348	3144379	InChI=1S/C14H17NO3S/c1-11-4-5-13-12(2)6-8-15(14(13)10-11)7-3-9-19(16,17)18/h4-6,8,10H,3,7,9H2,1-2H3/p+1	KXQUCGNMIIJFLD-UHFFFAOYSA-O	Cc1ccc2c(C)cc[n+](CCCS(=O)(=O)O)c2c1	BroadT	BRD-K93356348	BRD-K93356348-001-05-9	Asinex Ltd.	BAS 02943050			Cc1ccc2c(C)cc[n+](CCCS(O)(=O)=O)c2c1	InChI=1S/C14H17NO3S/c1-11-4-5-13-12(2)6-8-15(14(13)10-11)7-3-9-19(16,17)18/h4-6,8,10H,3,7,9H2,1-2H3/p+1	KXQUCGNMIIJFLD-UHFFFAOYSA-O	280.100739136							113024
MLS000063220	LSM-24435	SID4256356, BRD-K85438812	936105	InChI=1S/C10H9BrN2O2S2/c11-9-1-2-10(16-9)17(14,15)13-7-8-3-5-12-6-4-8/h1-6,13H,7H2	QSMVBOULCKMAMR-UHFFFAOYSA-N	Brc1ccc(s1)S(=O)(=O)NCc2ccncc2	BroadT	BRD-K85438812	BRD-K85438812-001-06-0	ChemBridge Corporation	7684273			Brc1ccc(s1)S(=O)(=O)NCc1ccncc1	InChI=1S/C10H9BrN2O2S2/c11-9-1-2-10(16-9)17(14,15)13-7-8-3-5-12-6-4-8/h1-6,13H,7H2	QSMVBOULCKMAMR-UHFFFAOYSA-N	331.928881528							113025
ASN 05682411	LSM-24436	SID849686, BRD-K04638378	652193	InChI=1S/C12H23N5OS/c1-6-7-16-12(13-14-15-16)19-8-11(18)17(9(2)3)10(4)5/h9-10H,6-8H2,1-5H3	QPTDBWSBYPTZIJ-UHFFFAOYSA-N	CCCn1nnnc1SCC(=O)N(C(C)C)C(C)C	BroadT	BRD-K04638378	BRD-K04638378-001-05-1	Asinex Ltd.	ASN 05682411			CCCn1nnnc1SCC(=O)N(C(C)C)C(C)C	InChI=1S/C12H23N5OS/c1-6-7-16-12(13-14-15-16)19-8-11(18)17(9(2)3)10(4)5/h9-10H,6-8H2,1-5H3	QPTDBWSBYPTZIJ-UHFFFAOYSA-N	285.162331096							113026
6-[[(5-Bromo-3-phenyl-1H-indole-2-carbonyl)hydrazinylidene]methyl]-2,3-dimethoxybenzoic acid	LSM-24437	BRD-K37570785	1548350	InChI=1S/C25H20BrN3O5/c1-33-19-11-8-15(21(25(31)32)23(19)34-2)13-27-29-24(30)22-20(14-6-4-3-5-7-14)17-12-16(26)9-10-18(17)28-22/h3-13,28H,1-2H3,(H,29,30)(H,31,32)	JJRUBNNGACEDKE-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)c2[nH]c3ccc(Br)cc3c2c4ccccc4)c(C(=O)O)c1OC	BroadT	BRD-K37570785	BRD-K37570785-001-05-4	InterBioScreen Ltd.	STOCK3S-52630			COc1ccc(C=NNC(=O)c2[nH]c3ccc(Br)cc3c2-c2ccccc2)c(C(O)=O)c1OC	InChI=1S/C25H20BrN3O5/c1-33-19-11-8-15(21(25(31)32)23(19)34-2)13-27-29-24(30)22-20(14-6-4-3-5-7-14)17-12-16(26)9-10-18(17)28-22/h3-13,28H,1-2H3,(H,29,30)(H,31,32)	JJRUBNNGACEDKE-UHFFFAOYSA-N	521.05863337							113027
MLS001146592	LSM-44051	SID49821997, BRD-K11260474	1846312	InChI=1S/C22H24BrN3O3S/c1-28-20-8-5-18(23)14-17(20)4-9-21(27)25-22(30)24-19-6-2-16(3-7-19)15-26-10-12-29-13-11-26/h2-9,14H,10-13,15H2,1H3,(H2,24,25,27,30)/b9-4+	CVCSOOLOPJVYPU-RUDMXATFSA-N	COc1ccc(Br)cc1\C=C\C(=O)NC(=S)Nc2ccc(CN3CCOCC3)cc2	BroadT	BRD-K11260474	BRD-K11260474-001-07-4	InterBioScreen Ltd.	STOCK3S-56319			COc1ccc(Br)cc1\C=C\C(=O)NC(=S)Nc1ccc(CN2CCOCC2)cc1	InChI=1S/C22H24BrN3O3S/c1-28-20-8-5-18(23)14-17(20)4-9-21(27)25-22(30)24-19-6-2-16(3-7-19)15-26-10-12-29-13-11-26/h2-9,14H,10-13,15H2,1H3,(H2,24,25,27,30)/b9-4+	CVCSOOLOPJVYPU-RUDMXATFSA-N	489.072174948							
MLS000082016	LSM-24439	SID3712135, BRD-K53703263	2354370	InChI=1S/C14H17NO4/c1-17-12-4-2-11(3-5-12)6-7-15-14(16)13-10-18-8-9-19-13/h2-5,10H,6-9H2,1H3,(H,15,16)	VTJYCOVVGVZHRG-UHFFFAOYSA-N	COc1ccc(CCNC(=O)C2=COCCO2)cc1	BroadT	BRD-K53703263	BRD-K53703263-001-06-9	Enamine Ltd.	T0508-7897			COc1ccc(CCNC(=O)C2=COCCO2)cc1	InChI=1S/C14H17NO4/c1-17-12-4-2-11(3-5-12)6-7-15-14(16)13-10-18-8-9-19-13/h2-5,10H,6-9H2,1H3,(H,15,16)	VTJYCOVVGVZHRG-UHFFFAOYSA-N	263.115758034							113029
4-(2,4-Dichlorophenoxy)-n-pyridin-3-ylbutanamide	LSM-24440	SID17388118, BRD-K23986181	1928491	InChI=1S/C15H14Cl2N2O2/c16-11-5-6-14(13(17)9-11)21-8-2-4-15(20)19-12-3-1-7-18-10-12/h1,3,5-7,9-10H,2,4,8H2,(H,19,20)	UYOUQYPPTLVSTN-UHFFFAOYSA-N	Clc1ccc(OCCCC(=O)Nc2cccnc2)c(Cl)c1	BroadT	BRD-K23986181	BRD-K23986181-001-05-8	Asinex Ltd.	BAS 00627066			Clc1ccc(OCCCC(=O)Nc2cccnc2)c(Cl)c1	InChI=1S/C15H14Cl2N2O2/c16-11-5-6-14(13(17)9-11)21-8-2-4-15(20)19-12-3-1-7-18-10-12/h1,3,5-7,9-10H,2,4,8H2,(H,19,20)	UYOUQYPPTLVSTN-UHFFFAOYSA-N	324.043233128							113030
SMR000620419	LSM-44052	SID49714909, BRD-A97294101	5925524	InChI=1S/C22H17FN4O5S/c23-17-5-1-2-6-18(17)32-21-16(22(29)27-9-4-3-7-19(27)26-21)11-14(12-24)20(28)25-15-8-10-33(30,31)13-15/h1-7,9,11,15H,8,10,13H2,(H,25,28)/b14-11+	BSFQJKYETXNHQK-SDNWHVSQSA-N	Fc1ccccc1OC2=C(\C=C(/C#N)\C(=O)NC3CCS(=O)(=O)C3)C(=O)N4C=CC=CC4=N2	BroadT	BRD-A97294101	BRD-A97294101-001-05-7	ChemDiv Inc.	6392-0327			Fc1ccccc1Oc1nc2ccccn2c(=O)c1\C=C(/C#N)C(=O)NC1CCS(=O)(=O)C1	InChI=1S/C22H17FN4O5S/c23-17-5-1-2-6-18(17)32-21-16(22(29)27-9-4-3-7-19(27)26-21)11-14(12-24)20(28)25-15-8-10-33(30,31)13-15/h1-7,9,11,15H,8,10,13H2,(H,25,28)/b14-11+	BSFQJKYETXNHQK-SDNWHVSQSA-N	468.090368574							
ASN 05917585	LSM-24442	SID843179, BRD-K93608743	645457	InChI=1S/C20H20N6O2S2/c1-11-5-6-12(2)16(9-11)26-18(15-7-8-28-13(15)3)23-25-20(26)29-10-17(27)21-19-24-22-14(4)30-19/h5-9H,10H2,1-4H3,(H,21,24,27)	RQOHWYYMMAZHPG-UHFFFAOYSA-N	Cc1ccc(C)c(c1)n2c(SCC(=O)Nc3nnc(C)s3)nnc2c4ccoc4C	BroadT	BRD-K93608743	BRD-K93608743-001-05-4	Asinex Ltd.	ASN 05917585			Cc1nnc(NC(=O)CSc2nnc(-c3ccoc3C)n2-c2cc(C)ccc2C)s1	InChI=1S/C20H20N6O2S2/c1-11-5-6-12(2)16(9-11)26-18(15-7-8-28-13(15)3)23-25-20(26)29-10-17(27)21-19-24-22-14(4)30-19/h5-9H,10H2,1-4H3,(H,21,24,27)	RQOHWYYMMAZHPG-UHFFFAOYSA-N	440.10891532							113032
ST50936160	LSM-24443	SID49818973, BRD-K48343267	4653584	InChI=1S/C13H15N3O3S/c1-7-5-6-9(19-7)11(17)15-13-14-8(2)10(20-13)12(18)16(3)4/h5-6H,1-4H3,(H,14,15,17)	UMAYKDKVZMIMIQ-UHFFFAOYSA-N	CN(C)C(=O)c1sc(NC(=O)c2oc(C)cc2)nc1C	BroadT	BRD-K48343267	BRD-K48343267-001-05-0	ChemBridge Corporation	7266056			CN(C)C(=O)c1sc(NC(=O)c2ccc(C)o2)nc1C	InChI=1S/C13H15N3O3S/c1-7-5-6-9(19-7)11(17)15-13-14-8(2)10(20-13)12(18)16(3)4/h5-6H,1-4H3,(H,14,15,17)	UMAYKDKVZMIMIQ-UHFFFAOYSA-N	293.08341206							113033
MLS000393625	LSM-24444	SID22402045, BRD-K70584304	2126544	InChI=1S/C22H20N4O3S/c1-15-10-12-17(13-11-15)26(2)30(28,29)18-7-5-6-16(14-18)21(27)25-22-23-19-8-3-4-9-20(19)24-22/h3-14H,1-2H3,(H2,23,24,25,27)	HRQSEAGYSZHRRG-UHFFFAOYSA-N	CN(c1ccc(C)cc1)S(=O)(=O)c2cccc(c2)C(=O)Nc3nc4ccccc4[nH]3	BroadT	BRD-K70584304	BRD-K70584304-001-07-1	Enamine Ltd.	T5254241			CN(c1ccc(C)cc1)S(=O)(=O)c1cccc(c1)C(=O)Nc1nc2ccccc2[nH]1	InChI=1S/C22H20N4O3S/c1-15-10-12-17(13-11-15)26(2)30(28,29)18-7-5-6-16(14-18)21(27)25-22-23-19-8-3-4-9-20(19)24-22/h3-14H,1-2H3,(H2,23,24,25,27)	HRQSEAGYSZHRRG-UHFFFAOYSA-N	420.12561123							113034
Benzalphthalide	LSM-44053	SID17509542, BRD-K04897017	642371	InChI=1S/C15H10O2/c16-15-13-9-5-4-8-12(13)14(17-15)10-11-6-2-1-3-7-11/h1-10H/b14-10-	YRTPZXMEBGTPLM-UVTDQMKNSA-N	O=C1O\C(=C/c2ccccc2)\c3ccccc13	BroadT	BRD-K04897017	BRD-K04897017-001-05-0	ChemDiv Inc.	3232-1209			O=C1O\C(=C/c2ccccc2)c2ccccc12	InChI=1S/C15H10O2/c16-15-13-9-5-4-8-12(13)14(17-15)10-11-6-2-1-3-7-11/h1-10H/b14-10-	YRTPZXMEBGTPLM-UVTDQMKNSA-N	222.06807956							
ZINC04772897	LSM-44054	SID24779865, BRD-K87511565	5908361	InChI=1S/C17H16ClNO3/c1-10-15(17(21)22-3)11(2)19-16(10)14(20)9-8-12-6-4-5-7-13(12)18/h4-9,19H,1-3H3/b9-8+	FRCYQWPLOQLUQC-CMDGGOBGSA-N	COC(=O)c1c(C)[nH]c(C(=O)\C=C\c2ccccc2Cl)c1C	BroadT	BRD-K87511565	BRD-K87511565-001-05-3	InterBioScreen Ltd.	STOCK1S-18977			COC(=O)c1c(C)[nH]c(C(=O)\C=C\c2ccccc2Cl)c1C	InChI=1S/C17H16ClNO3/c1-10-15(17(21)22-3)11(2)19-16(10)14(20)9-8-12-6-4-5-7-13(12)18/h4-9,19H,1-3H3/b9-8+	FRCYQWPLOQLUQC-CMDGGOBGSA-N	317.081871092							
MLS000879485	LSM-24447	SID26732118, BRD-A71213657	16746302	InChI=1S/C33H35NO6/c1-21-9-8-16-34(20-21)29(35)17-25(23-12-14-24(37-2)15-13-23)31-27(38-3)19-28(39-4)32-26(18-30(36)40-33(31)32)22-10-6-5-7-11-22/h5-7,10-15,18-19,21,25H,8-9,16-17,20H2,1-4H3	YPJKYBSCZLMZHS-UHFFFAOYSA-N	COc1ccc(cc1)C(CC(=O)N2CCCC(C)C2)c3c(OC)cc(OC)c4C(=CC(=O)Oc34)c5ccccc5	BroadT	BRD-A71213657	BRD-A71213657-001-06-3	University of Kansas CMLD	KUC101373N			COc1ccc(cc1)C(CC(=O)N1CCCC(C)C1)c1c(OC)cc(OC)c2c(cc(=O)oc12)-c1ccccc1	InChI=1S/C33H35NO6/c1-21-9-8-16-34(20-21)29(35)17-25(23-12-14-24(37-2)15-13-23)31-27(38-3)19-28(39-4)32-26(18-30(36)40-33(31)32)22-10-6-5-7-11-22/h5-7,10-15,18-19,21,25H,8-9,16-17,20H2,1-4H3	YPJKYBSCZLMZHS-UHFFFAOYSA-N	541.24643785							113037
MLS000106957	LSM-24448	SID7973771, BRD-K01770318	760116	InChI=1S/C14H12F3NO2/c1-7-5-9-10(14(15,16)17)6-11(19)20-13(9)8-3-2-4-18-12(7)8/h5-6,18H,2-4H2,1H3	YEVSVVJFZFNNOU-UHFFFAOYSA-N	Cc1cc2C(=CC(=O)Oc2c3CCCNc13)C(F)(F)F	BroadT	BRD-K01770318	BRD-K01770318-001-05-8	ChemBridge Corporation	5480751			Cc1cc2c(cc(=O)oc2c2CCCNc12)C(F)(F)F	InChI=1S/C14H12F3NO2/c1-7-5-9-10(14(15,16)17)6-11(19)20-13(9)8-3-2-4-18-12(7)8/h5-6,18H,2-4H2,1H3	YEVSVVJFZFNNOU-UHFFFAOYSA-N	283.082013234							113038
AMBCB51272836	LSM-24449	SID24791864, BRD-K97060202	16189678	InChI=1S/C23H25FN2O2/c1-16-22(25-23(28-16)20-14-19(27-2)8-9-21(20)24)15-26-12-10-18(11-13-26)17-6-4-3-5-7-17/h3-9,14,18H,10-13,15H2,1-2H3	PKERYBJUABFQEJ-UHFFFAOYSA-N	COc1ccc(F)c(c1)c2oc(C)c(CN3CCC(CC3)c4ccccc4)n2	BroadT	BRD-K97060202	BRD-K97060202-001-05-8	ChemBridge Corporation	51272836			COc1ccc(F)c(c1)-c1nc(CN2CCC(CC2)c2ccccc2)c(C)o1	InChI=1S/C23H25FN2O2/c1-16-22(25-23(28-16)20-14-19(27-2)8-9-21(20)24)15-26-12-10-18(11-13-26)17-6-4-3-5-7-17/h3-9,14,18H,10-13,15H2,1-2H3	PKERYBJUABFQEJ-UHFFFAOYSA-N	380.19000626							113039
BAS 06761112	LSM-24450	SID7968982, SID843841, BRD-K89334599	646146	InChI=1S/C16H15N3O2S2/c20-14(18-15-17-10-5-1-3-7-12(10)22-15)9-19-11-6-2-4-8-13(11)23-16(19)21/h2,4,6,8H,1,3,5,7,9H2,(H,17,18,20)	XKJHWGYQEGZTMG-UHFFFAOYSA-N	O=C(CN1C(=O)Sc2ccccc12)Nc3nc4CCCCc4s3	BroadT	BRD-K89334599	BRD-K89334599-001-05-8	Asinex Ltd.	BAS 06761112			O=C(Cn1c2ccccc2sc1=O)Nc1nc2CCCCc2s1	InChI=1S/C16H15N3O2S2/c20-14(18-15-17-10-5-1-3-7-12(10)22-15)9-19-11-6-2-4-8-13(11)23-16(19)21/h2,4,6,8H,1,3,5,7,9H2,(H,17,18,20)	XKJHWGYQEGZTMG-UHFFFAOYSA-N	345.06056813							113040
AC1LH1HN	LSM-24451	BRD-K72304887	830566	InChI=1S/C15H10ClN3O/c16-12-6-8-13(9-7-12)18-19-14(10-17)15(20)11-4-2-1-3-5-11/h1-9,18H	XUVHXSZZCICDTF-UHFFFAOYSA-N	Clc1ccc(NN=C(C#N)C(=O)c2ccccc2)cc1	BroadT	BRD-K72304887	BRD-K72304887-001-06-9	Specs	AF-886/30569029			Clc1ccc(NN=C(C#N)C(=O)c2ccccc2)cc1	InChI=1S/C15H10ClN3O/c16-12-6-8-13(9-7-12)18-19-14(10-17)15(20)11-4-2-1-3-5-11/h1-9,18H	XUVHXSZZCICDTF-UHFFFAOYSA-N	283.05123968							113041
N-Isopropyl-3-(trifluoromethyl)benzenecarboxamide	LSM-24452	SID17409685, BRD-K84443196	1490149	InChI=1S/C11H12F3NO/c1-7(2)15-10(16)8-4-3-5-9(6-8)11(12,13)14/h3-7H,1-2H3,(H,15,16)	SBYDPANTRXQTOZ-UHFFFAOYSA-N	CC(C)NC(=O)c1cccc(c1)C(F)(F)F	BroadT	BRD-K84443196	BRD-K84443196-001-05-9	Key Organics Ltd.	11J-337S			CC(C)NC(=O)c1cccc(c1)C(F)(F)F	InChI=1S/C11H12F3NO/c1-7(2)15-10(16)8-4-3-5-9(6-8)11(12,13)14/h3-7H,1-2H3,(H,15,16)	SBYDPANTRXQTOZ-UHFFFAOYSA-N	231.087098614							113042
4-CMTB	LSM-24453	SID24829854, BRD-A54139254	4307629	InChI=1S/C14H15ClN2OS/c1-9(2)12(10-3-5-11(15)6-4-10)13(18)17-14-16-7-8-19-14/h3-9,12H,1-2H3,(H,16,17,18)	AZYDQCGCBQYFSE-UHFFFAOYSA-N	CC(C)C(C(=O)Nc1nccs1)c2ccc(Cl)cc2	BroadT	BRD-A54139254	BRD-A54139254-001-06-8	Enamine Ltd.	T0500-4198			CC(C)C(C(=O)Nc1nccs1)c1ccc(Cl)cc1	InChI=1S/C14H15ClN2OS/c1-9(2)12(10-3-5-11(15)6-4-10)13(18)17-14-16-7-8-19-14/h3-9,12H,1-2H3,(H,16,17,18)	AZYDQCGCBQYFSE-UHFFFAOYSA-N	294.05936152							113043
AC1OAPY9	LSM-24454	BRD-A34924211	6808496	InChI=1S/C19H17N3O/c23-19(17-10-16(17)13-6-2-1-3-7-13)22-21-12-14-11-20-18-9-5-4-8-15(14)18/h1-9,11-12,16-17,20H,10H2,(H,22,23)	ACZSIIISWBUGAE-UHFFFAOYSA-N	O=C(NN=Cc1c[nH]c2ccccc12)C3CC3c4ccccc4	BroadT	BRD-A34924211	BRD-A34924211-001-05-2	ChemBridge Corporation	5114813			O=C(NN=Cc1c[nH]c2ccccc12)C1CC1c1ccccc1	InChI=1S/C19H17N3O/c23-19(17-10-16(17)13-6-2-1-3-7-13)22-21-12-14-11-20-18-9-5-4-8-15(14)18/h1-9,11-12,16-17,20H,10H2,(H,22,23)	ACZSIIISWBUGAE-UHFFFAOYSA-N	303.137162194							
[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]methyl 4-nitrobenzoate	LSM-24455	SID26727295, BRD-K27868325	2726309	InChI=1S/C18H12Cl2N2O5/c1-10-13(17(21-27-10)16-14(19)3-2-4-15(16)20)9-26-18(23)11-5-7-12(8-6-11)22(24)25/h2-8H,9H2,1H3	JJGMDNJHMGALRK-UHFFFAOYSA-N	Cc1onc(c1COC(=O)c2ccc(cc2)[N+](=O)[O-])c3c(Cl)cccc3Cl	BroadT	BRD-K27868325	BRD-K27868325-001-05-1	Maybridge	RF 01303			Cc1onc(c1COC(=O)c1ccc(cc1)[N+]([O-])=O)-c1c(Cl)cccc1Cl	InChI=1S/C18H12Cl2N2O5/c1-10-13(17(21-27-10)16-14(19)3-2-4-15(16)20)9-26-18(23)11-5-7-12(8-6-11)22(24)25/h2-8H,9H2,1H3	JJGMDNJHMGALRK-UHFFFAOYSA-N	406.012326924							113045
AE-848/37236038	LSM-44055	SID26660920, BRD-K54532962	687498	InChI=1S/C14H13NO4S/c1-8-9(2)20-13(12(8)14(17)18)15-11(16)6-5-10-4-3-7-19-10/h3-7H,1-2H3,(H,15,16)(H,17,18)/b6-5+	DADCHQVUJPVOMW-AATRIKPKSA-N	Cc1sc(NC(=O)\C=C\c2occc2)c(C(=O)O)c1C	BroadT	BRD-K54532962	BRD-K54532962-001-05-7	InterBioScreen Ltd.	STOCK1S-79940			Cc1sc(NC(=O)\C=C\c2ccco2)c(C(O)=O)c1C	InChI=1S/C14H13NO4S/c1-8-9(2)20-13(12(8)14(17)18)15-11(16)6-5-10-4-3-7-19-10/h3-7H,1-2H3,(H,15,16)(H,17,18)/b6-5+	DADCHQVUJPVOMW-AATRIKPKSA-N	291.056528596							
AC1M6U23	LSM-24457	BRD-K87264130	2430235	InChI=1S/C20H18Cl2FN5O/c1-13-16(20(22)28(27-13)12-14-6-8-15(21)9-7-14)10-25-26-19(29)11-24-18-5-3-2-4-17(18)23/h2-10,24H,11-12H2,1H3,(H,26,29)	LOXAKXFPJUGMEY-UHFFFAOYSA-N	Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=NNC(=O)CNc3ccccc3F	BroadT	BRD-K87264130	BRD-K87264130-001-07-1	Enamine Ltd.	T5222609			Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=NNC(=O)CNc1ccccc1F	InChI=1S/C20H18Cl2FN5O/c1-13-16(20(22)28(27-13)12-14-6-8-15(21)9-7-14)10-25-26-19(29)11-24-18-5-3-2-4-17(18)23/h2-10,24H,11-12H2,1H3,(H,26,29)	LOXAKXFPJUGMEY-UHFFFAOYSA-N	433.087243866							113047
SMR000108189	LSM-24458	SID7978279, BRD-A33836957	2913510	InChI=1S/C16H16N2O5/c1-3-22-16(21)15(11(2)19)23-13-9-10-14(20)18(17-13)12-7-5-4-6-8-12/h4-10,15H,3H2,1-2H3	GCXUTYCABPTIIE-UHFFFAOYSA-N	CCOC(=O)C(OC1=NN(C(=O)C=C1)c2ccccc2)C(=O)C	BroadT	BRD-A33836957	BRD-A33836957-001-05-7	ChemBridge Corporation	6772230			CCOC(=O)C(Oc1ccc(=O)n(n1)-c1ccccc1)C(C)=O	InChI=1S/C16H16N2O5/c1-3-22-16(21)15(11(2)19)23-13-9-10-14(20)18(17-13)12-7-5-4-6-8-12/h4-10,15H,3H2,1-2H3	GCXUTYCABPTIIE-UHFFFAOYSA-N	316.105921632							113048
ST089542	LSM-24459	SID17507386, BRD-K33375279	781927	InChI=1S/C14H17NS/c16-13-12-7-3-2-6-11(12)10-14(15-13)8-4-1-5-9-14/h2-3,6-7H,1,4-5,8-10H2,(H,15,16)	QYYVLDGAEAKTDX-UHFFFAOYSA-N	SC1=NC2(CCCCC2)Cc3ccccc13	BroadT	BRD-K33375279	BRD-K33375279-001-05-5	Asinex Ltd.	BAS 00899332			SC1=NC2(CCCCC2)Cc2ccccc12	InChI=1S/C14H17NS/c16-13-12-7-3-2-6-11(12)10-14(15-13)8-4-1-5-9-14/h2-3,6-7H,1,4-5,8-10H2,(H,15,16)	QYYVLDGAEAKTDX-UHFFFAOYSA-N	231.108170244							113049
MLS000564017	LSM-24460	SID17508877, BRD-A28182755	3115676	InChI=1S/C18H16Br2N2O2/c1-2-16-11-18(24,13-6-8-14(19)9-7-13)22(21-16)17(23)12-4-3-5-15(20)10-12/h3-10,24H,2,11H2,1H3	OHNDUBYZFBHKOY-UHFFFAOYSA-N	CCC1=NN(C(=O)c2cccc(Br)c2)C(O)(C1)c3ccc(Br)cc3	BroadT	BRD-A28182755	BRD-A28182755-001-07-3	Asinex Ltd.	BAS 00687515			CCC1=NN(C(=O)c2cccc(Br)c2)C(O)(C1)c1ccc(Br)cc1	InChI=1S/C18H16Br2N2O2/c1-2-16-11-18(24,13-6-8-14(19)9-7-13)22(21-16)17(23)12-4-3-5-15(20)10-12/h3-10,24H,2,11H2,1H3	OHNDUBYZFBHKOY-UHFFFAOYSA-N	449.957852972							113050
6,8-Dibromo-2-(2-thienyl)quinoline	LSM-24461	SID14729939, BRD-K90537228	3652194	InChI=1S/C13H7Br2NS/c14-9-6-8-3-4-11(12-2-1-5-17-12)16-13(8)10(15)7-9/h1-7H	PTYRKABTXKOOKE-UHFFFAOYSA-N	Brc1cc(Br)c2nc(ccc2c1)c3cccs3	BroadT	BRD-K90537228	BRD-K90537228-001-05-2	Key Organics Ltd.	1W-0810			Brc1cc(Br)c2nc(ccc2c1)-c1cccs1	InChI=1S/C13H7Br2NS/c14-9-6-8-3-4-11(12-2-1-5-17-12)16-13(8)10(15)7-9/h1-7H	PTYRKABTXKOOKE-UHFFFAOYSA-N	366.866595124							113051
T5766237	LSM-2561	BRD-K25774147, SID87556804, SID99495775	17425317	InChI=1S/C15H19N9OS/c1-9-5-6-11(25-4)10(7-9)24-15(20-21-22-24)26-8-12-17-13(16)19-14(18-12)23(2)3/h5-7H,8H2,1-4H3,(H2,16,17,18,19)	FMDRCKLGDXLGKP-UHFFFAOYSA-N	COc1ccc(C)cc1n2nnnc2SCc3nc(N)nc(n3)N(C)C	BroadT	BRD-K25774147	BRD-K25774147-001-02-6	Broad Institute of MIT and Harvard	BRD-K25774147			COc1ccc(C)cc1-n1nnnc1SCc1nc(N)nc(n1)N(C)C	InChI=1S/C15H19N9OS/c1-9-5-6-11(25-4)10(7-9)24-15(20-21-22-24)26-8-12-17-13(16)19-14(18-12)23(2)3/h5-7H,8H2,1-4H3,(H2,16,17,18,19)	FMDRCKLGDXLGKP-UHFFFAOYSA-N	373.143327008							92451
MLS000048164	LSM-24462	SID4255892, BRD-K64247542	1002641	InChI=1S/C18H12BrClN4O2/c19-14-4-5-15(17-13(14)2-1-7-21-17)23-18(25)16-6-3-12(26-16)10-24-9-11(20)8-22-24/h1-9H,10H2,(H,23,25)	CPKYQFBAOTXYCM-UHFFFAOYSA-N	Clc1cnn(Cc2oc(cc2)C(=O)Nc3ccc(Br)c4cccnc34)c1	BroadT	BRD-K64247542	BRD-K64247542-001-06-7	ChemBridge Corporation	7560986			Clc1cnn(Cc2ccc(o2)C(=O)Nc2ccc(Br)c3cccnc23)c1	InChI=1S/C18H12BrClN4O2/c19-14-4-5-15(17-13(14)2-1-7-21-17)23-18(25)16-6-3-12(26-16)10-24-9-11(20)8-22-24/h1-9H,10H2,(H,23,25)	CPKYQFBAOTXYCM-UHFFFAOYSA-N	429.983215974							113052
NSC695052	LSM-24463	SID22402854, SID524656, BRD-K64236351	706957	InChI=1S/C13H13N3OS/c1-17-11-7-3-2-6-10(11)15-13(18)16-12-8-4-5-9-14-12/h2-9H,1H3,(H2,14,15,16,18)	BHHLCPFNFSARSO-UHFFFAOYSA-N	COc1ccccc1N=C(S)Nc2ccccn2	BroadT	BRD-K64236351	BRD-K64236351-001-05-2	InterBioScreen Ltd.	STOCK4S-38929			COc1ccccc1N=C(S)Nc1ccccn1	InChI=1S/C13H13N3OS/c1-17-11-7-3-2-6-10(11)15-13(18)16-12-8-4-5-9-14-12/h2-9H,1H3,(H2,14,15,16,18)	BHHLCPFNFSARSO-UHFFFAOYSA-N	259.077932756							113053
SMR000200880	LSM-44056	SID17415796, BRD-K72206430	5740731	InChI=1S/C24H19N3O5/c1-2-30-22-12-15(7-9-20(22)31-14-17-8-10-21(32-17)24(28)29)11-16(13-25)23-26-18-5-3-4-6-19(18)27-23/h3-12H,2,14H2,1H3,(H,26,27)(H,28,29)/b16-11-	BMCGMJYOCVEJAB-WJDWOHSUSA-N	CCOc1cc(\C=C(\C#N)/c2nc3ccccc3[nH]2)ccc1OCc4oc(cc4)C(=O)O	BroadT	BRD-K72206430	BRD-K72206430-001-05-0	ChemBridge Corporation	7932645			CCOc1cc(\C=C(\C#N)c2nc3ccccc3[nH]2)ccc1OCc1ccc(o1)C(O)=O	InChI=1S/C24H19N3O5/c1-2-30-22-12-15(7-9-20(22)31-14-17-8-10-21(32-17)24(28)29)11-16(13-25)23-26-18-5-3-4-6-19(18)27-23/h3-12H,2,14H2,1H3,(H,26,27)(H,28,29)/b16-11-	BMCGMJYOCVEJAB-WJDWOHSUSA-N	429.132470738							
T0519-9564	LSM-24465	SID24829060, BRD-K90412405	3888071	InChI=1S/C15H18F3N3S/c16-15(17,18)12-9-5-6-10-13(12)19-14(22)21-20-11-7-3-1-2-4-8-11/h5-6,9-10H,1-4,7-8H2,(H2,19,21,22)	HICDIXCPXTXYDT-UHFFFAOYSA-N	FC(F)(F)c1ccccc1N=C(S)NN=C2CCCCCC2	BroadT	BRD-K90412405	BRD-K90412405-001-05-3	Enamine Ltd.	T0519-9564			FC(F)(F)c1ccccc1N=C(S)NN=C1CCCCCC1	InChI=1S/C15H18F3N3S/c16-15(17,18)12-9-5-6-10-13(12)19-14(22)21-20-11-7-3-1-2-4-8-11/h5-6,9-10H,1-4,7-8H2,(H2,19,21,22)	HICDIXCPXTXYDT-UHFFFAOYSA-N	329.117352896							113055
MLS000106650	LSM-24466	SID7973088, BRD-A10124716	2846520	InChI=1S/C19H25NO/c1-16(8-9-18-10-12-19(21)13-11-18)20(2)15-14-17-6-4-3-5-7-17/h3-7,10-13,16,21H,8-9,14-15H2,1-2H3	KJAVDHZFEIJNMJ-UHFFFAOYSA-N	CC(CCc1ccc(O)cc1)N(C)CCc2ccccc2	BroadT	BRD-A10124716	BRD-A10124716-001-05-7	ChemBridge Corporation	5460539			CC(CCc1ccc(O)cc1)N(C)CCc1ccccc1	InChI=1S/C19H25NO/c1-16(8-9-18-10-12-19(21)13-11-18)20(2)15-14-17-6-4-3-5-7-17/h3-7,10-13,16,21H,8-9,14-15H2,1-2H3	KJAVDHZFEIJNMJ-UHFFFAOYSA-N	283.19361443							113056
T5217987	LSM-24467	SID24826907, BRD-A31106325	16195979	InChI=1S/C19H20N4O5/c1-11(23-17(25)12-6-2-3-7-13(12)18(23)26)19(27)28-10-22-16(24)14-8-4-5-9-15(14)20-21-22/h4-5,8-9,11-13H,2-3,6-7,10H2,1H3/t11-,12?,13?/m0/s1	IWVSPGRPNPWQGN-HIFPTAJRSA-N	C[C@H](N1C(=O)C2CCCCC2C1=O)C(=O)OCN3N=Nc4ccccc4C3=O	BroadT	BRD-A31106325	BRD-A31106325-001-05-2	Enamine Ltd.	T5217987			C[C@H](N1C(=O)C2CCCCC2C1=O)C(=O)OCn1nnc2ccccc2c1=O	InChI=1S/C19H20N4O5/c1-11(23-17(25)12-6-2-3-7-13(12)18(23)26)19(27)28-10-22-16(24)14-8-4-5-9-15(14)20-21-22/h4-5,8-9,11-13H,2-3,6-7,10H2,1H3/t11-,12?,13?/m0/s1	IWVSPGRPNPWQGN-HIFPTAJRSA-N	384.14336978							113057
N-(1-Acetyl-2-chloro-1H-indol-3-yl)-2-chloroacetamide	LSM-24468	SID14739494, BRD-K30267495	788167	InChI=1S/C12H10Cl2N2O2/c1-7(17)16-9-5-3-2-4-8(9)11(12(16)14)15-10(18)6-13/h2-5H,6H2,1H3,(H,15,18)	XHRPFARAFYNEMH-UHFFFAOYSA-N	CC(=O)n1c(Cl)c(NC(=O)CCl)c2ccccc12	BroadT	BRD-K30267495	BRD-K30267495-001-06-3	ChemBridge Corporation	5219812			CC(=O)n1c(Cl)c(NC(=O)CCl)c2ccccc12	InChI=1S/C12H10Cl2N2O2/c1-7(17)16-9-5-3-2-4-8(9)11(12(16)14)15-10(18)6-13/h2-5H,6H2,1H3,(H,15,18)	XHRPFARAFYNEMH-UHFFFAOYSA-N	284.011933							113058
SMR000178969	LSM-24469	SID17410688, BRD-K89886039	3797802	InChI=1S/C14H15N3O3S/c1-9(2)8-11(18)17-14(20)16-13(21-17)15-12(19)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,15,16,19,20)	BBJHCWYVJLCXTK-UHFFFAOYSA-N	CC(C)CC(=O)N1SC(=NC1=O)NC(=O)c2ccccc2	BroadT	BRD-K89886039	BRD-K89886039-001-05-5	Key Organics Ltd.	3M-531S			CC(C)CC(=O)n1sc(NC(=O)c2ccccc2)nc1=O	InChI=1S/C14H15N3O3S/c1-9(2)8-11(18)17-14(20)16-13(21-17)15-12(19)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,15,16,19,20)	BBJHCWYVJLCXTK-UHFFFAOYSA-N	305.08341206							113059
AC1M3NUT	LSM-15558	BRD-K43392542	2215930	InChI=1S/C17H23NO2/c1-19-16-10-4-5-11-17(16)20-15-9-8-14-18-12-6-2-3-7-13-18/h4-5,10-11H,2-3,6-7,12-15H2,1H3	YWSBLRVYERODQE-UHFFFAOYSA-N	COc1ccccc1OCC#CCN2CCCCCC2	BroadT	BRD-K43392542	BRD-K43392542-034-05-0	ChemBridge Corporation	7887359		OC(=O)C(=O)O	COc1ccccc1OCC#CCN1CCCCCC1.OC(=O)C(=O)O	InChI=1S/C17H23NO2.C2H2O4/c1-19-16-10-4-5-11-17(16)20-15-9-8-14-18-12-6-2-3-7-13-18;3-1(4)2(5)6/h4-5,10-11H,2-3,6-7,12-15H2,1H3;(H,3,4)(H,5,6)	SLFCPZWYRFXYRG-UHFFFAOYSA-N	273.172878986							104194, 104194
3-Methoxy-n-[2-(3-methoxyphenoxy)ethyl]benzamide	LSM-24470	SID4263288, BRD-K72209243	2195599	InChI=1S/C17H19NO4/c1-20-14-6-3-5-13(11-14)17(19)18-9-10-22-16-8-4-7-15(12-16)21-2/h3-8,11-12H,9-10H2,1-2H3,(H,18,19)	HVPCPKGXUAQMIB-UHFFFAOYSA-N	COc1cccc(OCCNC(=O)c2cccc(OC)c2)c1	BroadT	BRD-K72209243	BRD-K72209243-001-06-9	ChemBridge Corporation	7639873			COc1cccc(OCCNC(=O)c2cccc(OC)c2)c1	InChI=1S/C17H19NO4/c1-20-14-6-3-5-13(11-14)17(19)18-9-10-22-16-8-4-7-15(12-16)21-2/h3-8,11-12H,9-10H2,1-2H3,(H,18,19)	HVPCPKGXUAQMIB-UHFFFAOYSA-N	301.131408098							113060
MLS000683584	LSM-24471	SID24790863, BRD-K54882013	16189596	InChI=1S/C26H36N4OS/c1-3-29-12-6-8-23-19-22(10-11-25(23)29)20-30(14-13-28-15-17-31-18-16-28)26(32)27-24-9-5-4-7-21(24)2/h4-5,7,9-11,19H,3,6,8,12-18,20H2,1-2H3,(H,27,32)	WTAXWHKRKCFMDY-UHFFFAOYSA-N	CCN1CCCc2cc(CN(CCN3CCOCC3)C(=Nc4ccccc4C)S)ccc12	BroadT	BRD-K54882013	BRD-K54882013-001-05-5	ChemDiv Inc.	K788-3592			CCN1CCCc2cc(CN(CCN3CCOCC3)C(S)=Nc3ccccc3C)ccc12	InChI=1S/C26H36N4OS/c1-3-29-12-6-8-23-19-22(10-11-25(23)29)20-30(14-13-28-15-17-31-18-16-28)26(32)27-24-9-5-4-7-21(24)2/h4-5,7,9-11,19H,3,6,8,12-18,20H2,1-2H3,(H,27,32)	WTAXWHKRKCFMDY-UHFFFAOYSA-N	452.260982502							113061
2-[1-(2-Methoxy-ethyl)-1H-tetrazol-5-ylsulfanyl]-1-phenyl-ethanone	LSM-24472	SID846431, BRD-K01512500	648820	InChI=1S/C12H14N4O2S/c1-18-8-7-16-12(13-14-15-16)19-9-11(17)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3	MTGZYYXSGZDLSZ-UHFFFAOYSA-N	COCCn1nnnc1SCC(=O)c2ccccc2	BroadT	BRD-K01512500	BRD-K01512500-001-05-2	Asinex Ltd.	ASN 05683373			COCCn1nnnc1SCC(=O)c1ccccc1	InChI=1S/C12H14N4O2S/c1-18-8-7-16-12(13-14-15-16)19-9-11(17)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3	MTGZYYXSGZDLSZ-UHFFFAOYSA-N	278.083746418							113062
MLS001007082	LSM-24473	SID24828737, BRD-K97045260	2549745	InChI=1S/C22H18N4O/c1-15(27)23-17-10-7-11-18(14-17)24-22-19-12-5-6-13-20(19)25-21(26-22)16-8-3-2-4-9-16/h2-14H,1H3,(H,23,27)(H,24,25,26)	IBCJHQBSQYNQJM-UHFFFAOYSA-N	CC(=O)Nc1cccc(Nc2nc(nc3ccccc23)c4ccccc4)c1	BroadT	BRD-K97045260	BRD-K97045260-001-06-6	Enamine Ltd.	T5340552			CC(=O)Nc1cccc(Nc2nc(nc3ccccc23)-c2ccccc2)c1	InChI=1S/C22H18N4O/c1-15(27)23-17-10-7-11-18(14-17)24-22-19-12-5-6-13-20(19)25-21(26-22)16-8-3-2-4-9-16/h2-14H,1H3,(H,23,27)(H,24,25,26)	IBCJHQBSQYNQJM-UHFFFAOYSA-N	354.148061236							113063
MLS000090534	LSM-24474	SID4242304, BRD-K83751480	3237178	InChI=1S/C18H16N2O6S/c1-26-16-5-3-2-4-11(16)9-20-27(24,25)12-6-7-15-13(8-12)17(21)14(10-19-15)18(22)23/h2-8,10,20H,9H2,1H3,(H,19,21)(H,22,23)	VTWBDWZBNSLYDN-UHFFFAOYSA-N	COc1ccccc1CNS(=O)(=O)c2ccc3ncc(C(=O)O)c(O)c3c2	BroadT	BRD-K83751480	BRD-K83751480-001-05-1	ChemDiv Inc.	C213-0035			COc1ccccc1CNS(=O)(=O)c1ccc2ncc(C(O)=O)c(O)c2c1	InChI=1S/C18H16N2O6S/c1-26-16-5-3-2-4-11(16)9-20-27(24,25)12-6-7-15-13(8-12)17(21)14(10-19-15)18(22)23/h2-8,10,20H,9H2,1H3,(H,19,21)(H,22,23)	VTWBDWZBNSLYDN-UHFFFAOYSA-N	388.072906942							113064
AC1O1NDE	LSM-44057	SID17510313, BRD-K26663554	6150155	InChI=1S/C20H15NO2/c22-20-18(13-7-12-16-8-3-1-4-9-16)21-19(23-20)15-14-17-10-5-2-6-11-17/h1-15H/b12-7+,15-14+,18-13+	CQLPNSSOUAVJOB-LTCJSSOGSA-N	O=C1OC(=N/C/1=C/C=C/c2ccccc2)\C=C\c3ccccc3	BroadT	BRD-K26663554	BRD-K26663554-001-05-9	ChemDiv Inc.	K088-1160			O=C1OC(\C=C\c2ccccc2)=N/C1=C/C=C/c1ccccc1	InChI=1S/C20H15NO2/c22-20-18(13-7-12-16-8-3-1-4-9-16)21-19(23-20)15-14-17-10-5-2-6-11-17/h1-15H/b12-7+,15-14+,18-13+	CQLPNSSOUAVJOB-LTCJSSOGSA-N	301.11027873							
BDBM163	LSM-24476	BRD-A45910872	5178518	InChI=1S/C30H24N2O5S/c1-36-24-12-5-4-11-22(24)28-23-14-13-19-8-2-3-10-21(19)27(23)31-30-32(28)29(35)25(38-30)16-18-7-6-9-20(15-18)37-17-26(33)34/h2-12,15-16,28H,13-14,17H2,1H3,(H,33,34)	XCPQKGPAGJNOBL-UHFFFAOYSA-N	COc1ccccc1C2N3C(=NC4=C2CCc5ccccc45)SC(=Cc6cccc(OCC(=O)O)c6)C3=O	BroadT	BRD-A45910872	BRD-A45910872-001-04-1	Specs	AM-879/15326043			COc1ccccc1C1C2=C(N=c3sc(=Cc4cccc(OCC(O)=O)c4)c(=O)n13)c1ccccc1CC2	InChI=1S/C30H24N2O5S/c1-36-24-12-5-4-11-22(24)28-23-14-13-19-8-2-3-10-21(19)27(23)31-30-32(28)29(35)25(38-30)16-18-7-6-9-20(15-18)37-17-26(33)34/h2-12,15-16,28H,13-14,17H2,1H3,(H,33,34)	XCPQKGPAGJNOBL-UHFFFAOYSA-N	524.140592578							113066
SMR000453577	LSM-24477	SID26725566, BRD-K94828699	16745787	InChI=1S/C23H15ClF3N3OS/c24-17-7-9-18(10-8-17)29-22-30-20(13-32-22)14-3-2-6-19(12-14)28-21(31)15-4-1-5-16(11-15)23(25,26)27/h1-13H,(H,28,31)(H,29,30)	UUHURNAMUZNCIW-UHFFFAOYSA-N	FC(F)(F)c1cccc(c1)C(=O)Nc2cccc(c2)c3csc(Nc4ccc(Cl)cc4)n3	BroadT	BRD-K94828699	BRD-K94828699-001-06-9	Dana Farber Cancer Institute	AMY001-081			FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1csc(Nc2ccc(Cl)cc2)n1	InChI=1S/C23H15ClF3N3OS/c24-17-7-9-18(10-8-17)29-22-30-20(13-32-22)14-3-2-6-19(12-14)28-21(31)15-4-1-5-16(11-15)23(25,26)27/h1-13H,(H,28,31)(H,29,30)	UUHURNAMUZNCIW-UHFFFAOYSA-N	473.05764513							113067
ZINC01194302	LSM-15213	BRD-K65299797	1354451	InChI=1S/C15H13BrN2O2S2/c1-18-11-4-3-9(20-2)7-10(11)17-15(18)21-8-12(19)13-5-6-14(16)22-13/h3-7H,8H2,1-2H3	KYWBSXBSDBEGKE-UHFFFAOYSA-N	COc1ccc2c(c1)nc(SCC(=O)c3ccc(Br)s3)n2C	BroadT	BRD-K65299797	BRD-K65299797-004-05-5	ChemBridge Corporation	5650662		Br	COc1ccc2n(C)c(SCC(=O)c3ccc(Br)s3)nc2c1.Br	InChI=1S/C15H13BrN2O2S2.BrH/c1-18-11-4-3-9(20-2)7-10(11)17-15(18)21-8-12(19)13-5-6-14(16)22-13;/h3-7H,8H2,1-2H3;1H	LCCYJQBZXDJHKP-UHFFFAOYSA-N	395.960181656							103862, 103862
CID 40578212	LSM-24478	BRD-A72103572	40578212	InChI=1S/C23H22N4O6S/c1-15-6-7-16(12-21(15)34(30,31)27-8-10-32-11-9-27)23(29)33-14-20(28)17(13-24)22-25-18-4-2-3-5-19(18)26-22/h2-7,12,17H,8-11,14H2,1H3,(H,25,26)	ZOPPPGUCZLOTJV-UHFFFAOYSA-N	Cc1ccc(cc1S(=O)(=O)N2CCOCC2)C(=O)OCC(=O)C(C#N)c3nc4ccccc4[nH]3	BroadT	BRD-A72103572	BRD-A72103572-001-05-9	Enamine Ltd.	T0510-4956			Cc1ccc(cc1S(=O)(=O)N1CCOCC1)C(=O)OCC(=O)C(C#N)c1nc2ccccc2[nH]1	InChI=1S/C23H22N4O6S/c1-15-6-7-16(12-21(15)34(30,31)27-8-10-32-11-9-27)23(29)33-14-20(28)17(13-24)22-25-18-4-2-3-5-19(18)26-22/h2-7,12,17H,8-11,14H2,1H3,(H,25,26)	ZOPPPGUCZLOTJV-UHFFFAOYSA-N	482.126005154							113068
MLS000708356	LSM-24479	SID104219496, SID24804422, BRD-K20477369	921149	InChI=1S/C14H10ClN3O3S/c15-9-3-5-10(6-4-9)21-8-12-17-18-14(22-12)16-13(19)11-2-1-7-20-11/h1-7H,8H2,(H,16,18,19)	SUNWRFCJTJOSRY-UHFFFAOYSA-N	Clc1ccc(OCc2nnc(NC(=O)c3occc3)s2)cc1	BroadT	BRD-K20477369	BRD-K20477369-001-05-5	Asinex Ltd.	BAS 06980378			Clc1ccc(OCc2nnc(NC(=O)c3ccco3)s2)cc1	InChI=1S/C14H10ClN3O3S/c15-9-3-5-10(6-4-9)21-8-12-17-18-14(22-12)16-13(19)11-2-1-7-20-11/h1-7H,8H2,(H,16,18,19)	SUNWRFCJTJOSRY-UHFFFAOYSA-N	335.01313961							113069
MLS000043927	LSM-24480	SID4248393, BRD-K94106078	1044226	InChI=1S/C14H12F4N4O3/c1-7-5-10(22-21-7)19-13(24)20-11(23)8-3-2-4-9(6-8)25-14(17,18)12(15)16/h2-6,12H,1H3,(H3,19,20,21,22,23,24)	XWJGHYGODJVHOT-UHFFFAOYSA-N	Cc1cc(NC(=O)NC(=O)c2cccc(OC(F)(F)C(F)F)c2)[nH]n1	BroadT	BRD-K94106078	BRD-K94106078-001-05-3	ChemDiv Inc.	8012-9292			Cc1cc(NC(=O)NC(=O)c2cccc(OC(F)(F)C(F)F)c2)[nH]n1	InChI=1S/C14H12F4N4O3/c1-7-5-10(22-21-7)19-13(24)20-11(23)8-3-2-4-9(6-8)25-14(17,18)12(15)16/h2-6,12H,1H3,(H3,19,20,21,22,23,24)	XWJGHYGODJVHOT-UHFFFAOYSA-N	360.084553084							113070
5-Bromo-6-chloro-n-(4-methylpyridin-2-yl)pyridine-3-sulfonamide	LSM-24481	SID22403063, BRD-K33349942	1034221	InChI=1S/C11H9BrClN3O2S/c1-7-2-3-14-10(4-7)16-19(17,18)8-5-9(12)11(13)15-6-8/h2-6H,1H3,(H,14,16)	RNRILTCDKAMZEO-UHFFFAOYSA-N	Cc1ccnc(NS(=O)(=O)c2cnc(Cl)c(Br)c2)c1	BroadT	BRD-K33349942	BRD-K33349942-001-05-7	InterBioScreen Ltd.	STOCK4S-51445			Cc1ccnc(NS(=O)(=O)c2cnc(Cl)c(Br)c2)c1	InChI=1S/C11H9BrClN3O2S/c1-7-2-3-14-10(4-7)16-19(17,18)8-5-9(12)11(13)15-6-8/h2-6H,1H3,(H,14,16)	RNRILTCDKAMZEO-UHFFFAOYSA-N	360.928737558							113071
STK848350	LSM-44058	SID17414103, BRD-K56050328	1299088	InChI=1S/C18H15N3O2S2/c1-12-4-6-13(7-5-12)15-11-25-18(19-15)21-17(24)20-16(22)9-8-14-3-2-10-23-14/h2-11H,1H3,(H2,19,20,21,22,24)/b9-8+	OOGGYCGJQCQIRD-CMDGGOBGSA-N	Cc1ccc(cc1)c2csc(NC(=S)NC(=O)\C=C\c3occc3)n2	BroadT	BRD-K56050328	BRD-K56050328-001-05-7	ChemBridge Corporation	7347685			Cc1ccc(cc1)-c1csc(NC(=S)NC(=O)\C=C\c2ccco2)n1	InChI=1S/C18H15N3O2S2/c1-12-4-6-13(7-5-12)15-11-25-18(19-15)21-17(24)20-16(22)9-8-14-3-2-10-23-14/h2-11H,1H3,(H2,19,20,21,22,24)/b9-8+	OOGGYCGJQCQIRD-CMDGGOBGSA-N	369.06056813							
ASN 04370248	LSM-24483	SID26669200, SID852616, BRD-A99356071	655253	InChI=1S/C26H30N6O3/c1-34-22-9-10-24-20(15-22)14-21(26(33)27-24)16-31(12-11-19-6-3-2-4-7-19)18-25-28-29-30-32(25)17-23-8-5-13-35-23/h2-4,6-7,9-10,14-15,23H,5,8,11-13,16-18H2,1H3,(H,27,33)	WTTQSPAZSJEXCU-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(CCc3ccccc3)Cc4nnnn4CC5CCCO5)cc2c1	BroadT	BRD-A99356071	BRD-A99356071-001-05-8	Asinex Ltd.	ASN 04370248			COc1ccc2nc(O)c(CN(CCc3ccccc3)Cc3nnnn3CC3CCCO3)cc2c1	InChI=1S/C26H30N6O3/c1-34-22-9-10-24-20(15-22)14-21(26(33)27-24)16-31(12-11-19-6-3-2-4-7-19)18-25-28-29-30-32(25)17-23-8-5-13-35-23/h2-4,6-7,9-10,14-15,23H,5,8,11-13,16-18H2,1H3,(H,27,33)	WTTQSPAZSJEXCU-UHFFFAOYSA-N	474.23793888							113073
AC1M5UTI	LSM-24484	BRD-K42557763, SID24836648	2361115	InChI=1S/C19H20N4O3S/c24-19(20-13-18-21-16-5-1-2-6-17(16)22-18)14-7-9-15(10-8-14)27(25,26)23-11-3-4-12-23/h1-2,5-10H,3-4,11-13H2,(H,20,24)(H,21,22)	RGEJEBFSAUMZKZ-UHFFFAOYSA-N	O=C(NCc1nc2ccccc2[nH]1)c3ccc(cc3)S(=O)(=O)N4CCCC4	BroadT	BRD-K42557763	BRD-K42557763-001-05-0	Enamine Ltd.	T0506-7042			O=C(NCc1nc2ccccc2[nH]1)c1ccc(cc1)S(=O)(=O)N1CCCC1	InChI=1S/C19H20N4O3S/c24-19(20-13-18-21-16-5-1-2-6-17(16)22-18)14-7-9-15(10-8-14)27(25,26)23-11-3-4-12-23/h1-2,5-10H,3-4,11-13H2,(H,20,24)(H,21,22)	RGEJEBFSAUMZKZ-UHFFFAOYSA-N	384.12561123							113074
BAS 07162071	LSM-2175	BRD-K08799912, SID85248349, SID85256232, SID99495605	1088439	InChI=1S/C13H10ClN3O2S/c14-9-5-7-10(8-6-9)20(18,19)17-12-4-2-1-3-11(12)16-13(17)15/h1-8H,(H2,15,16)	WICYGIZRSNWVJD-UHFFFAOYSA-N	Nc1nc2ccccc2n1S(=O)(=O)c3ccc(Cl)cc3	BroadT	BRD-K08799912	BRD-K08799912-001-01-9	Sanford-Burnham Medical Research Institute	799264-48-5 MLS-0425609			Nc1nc2ccccc2n1S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C13H10ClN3O2S/c14-9-5-7-10(8-6-9)20(18,19)17-12-4-2-1-3-11(12)16-13(17)15/h1-8H,(H2,15,16)	WICYGIZRSNWVJD-UHFFFAOYSA-N	307.01822499							92152
SMR000131614	LSM-24485	SID14738030, BRD-K06075676	9551256	InChI=1S/C21H29ClFN3O2/c22-19-13-17(23)10-9-16(19)14-25-11-6-12-26(21(25)28)15-20(27)24-18-7-4-2-1-3-5-8-18/h9-10,13,18H,1-8,11-12,14-15H2,(H,24,27)	YFDIWTRTLQONPY-UHFFFAOYSA-N	Fc1ccc(CN2CCCN(CC(=O)NC3CCCCCCC3)C2=O)c(Cl)c1	BroadT	BRD-K06075676	BRD-K06075676-001-05-3	ChemDiv Inc.	K788-6004			Fc1ccc(CN2CCCN(CC(=O)NC3CCCCCCC3)C2=O)c(Cl)c1	InChI=1S/C21H29ClFN3O2/c22-19-13-17(23)10-9-16(19)14-25-11-6-12-26(21(25)28)15-20(27)24-18-7-4-2-1-3-5-8-18/h9-10,13,18H,1-8,11-12,14-15H2,(H,24,27)	YFDIWTRTLQONPY-UHFFFAOYSA-N	409.193233108							113075
MLS000112148	LSM-24486	SID7974369, BRD-K80905852	772865	InChI=1S/C15H15ClN2O2/c16-12-10-11(17-15(19)14-4-3-9-20-14)5-6-13(12)18-7-1-2-8-18/h3-6,9-10H,1-2,7-8H2,(H,17,19)	UHINWAUZILGLLU-UHFFFAOYSA-N	Clc1cc(NC(=O)c2occc2)ccc1N3CCCC3	BroadT	BRD-K80905852	BRD-K80905852-001-05-6	ChemBridge Corporation	6706477			Clc1cc(NC(=O)c2ccco2)ccc1N1CCCC1	InChI=1S/C15H15ClN2O2/c16-12-10-11(17-15(19)14-4-3-9-20-14)5-6-13(12)18-7-1-2-8-18/h3-6,9-10H,1-2,7-8H2,(H,17,19)	UHINWAUZILGLLU-UHFFFAOYSA-N	290.08220545							113076
AN-329/40487184	LSM-24487	SID22414631, BRD-K94711205	832947	InChI=1S/C13H13N5O2S/c14-9-12(10-15)17-16-11-3-5-13(6-4-11)21(19,20)18-7-1-2-8-18/h3-6,16H,1-2,7-8H2	WYXJIZQQZBKFTN-UHFFFAOYSA-N	O=S(=O)(N1CCCC1)c2ccc(NN=C(C#N)C#N)cc2	BroadT	BRD-K94711205	BRD-K94711205-001-06-4	Specs	AN-329/40487184			O=S(=O)(N1CCCC1)c1ccc(NN=C(C#N)C#N)cc1	InChI=1S/C13H13N5O2S/c14-9-12(10-15)17-16-11-3-5-13(6-4-11)21(19,20)18-7-1-2-8-18/h3-6,16H,1-2,7-8H2	WYXJIZQQZBKFTN-UHFFFAOYSA-N	303.078995396							113077
2-[(2-Phenylethyl)thio]nicotinic acid	LSM-3378	Niacin, SID4257303, BRD-K61993165	888706	InChI=1S/C14H13NO2S/c16-14(17)12-7-4-9-15-13(12)18-10-8-11-5-2-1-3-6-11/h1-7,9H,8,10H2,(H,16,17)	UZERZZRWECLIKE-UHFFFAOYSA-N	OC(=O)c1cccnc1SCCc2ccccc2	BroadT	BRD-K61993165	BRD-K61993165-001-05-7	ChemBridge Corporation	7360080			OC(=O)c1cccnc1SCCc1ccccc1	InChI=1S/C14H13NO2S/c16-14(17)12-7-4-9-15-13(12)18-10-8-11-5-2-1-3-6-11/h1-7,9H,8,10H2,(H,16,17)	UZERZZRWECLIKE-UHFFFAOYSA-N	259.066699356							93083
MLS000763292	LSM-24488	SID26662804, BRD-K24871347	4886931	InChI=1S/C23H18N6O2S/c32-23-27-26-21(29(23)15-8-9-19-20(13-15)31-12-11-30-19)14-28-18-7-2-1-5-16(18)25-22(28)17-6-3-4-10-24-17/h1-10,13H,11-12,14H2,(H,27,32)	FALMRISDPCTNLZ-UHFFFAOYSA-N	Sc1nnc(Cn2c(nc3ccccc23)c4ccccn4)n1c5ccc6OCCOc6c5	BroadT	BRD-K24871347	BRD-K24871347-001-06-0	InterBioScreen Ltd.	STOCK5S-33747			Sc1nnc(Cn2c(nc3ccccc23)-c2ccccn2)n1-c1ccc2OCCOc2c1	InChI=1S/C23H18N6O2S/c32-23-27-26-21(29(23)15-8-9-19-20(13-15)31-12-11-30-19)14-28-18-7-2-1-5-16(18)25-22(28)17-6-3-4-10-24-17/h1-10,13H,11-12,14H2,(H,27,32)	FALMRISDPCTNLZ-UHFFFAOYSA-N	442.121194566							113078
SMR000032258	LSM-24489	SID4245344, BRD-K07543801	3239824	InChI=1S/C17H24N2O3S/c1-2-23(21,22)19-11-8-15(9-12-19)17(20)18-10-7-14-5-3-4-6-16(14)13-18/h3-6,15H,2,7-13H2,1H3	LUECMNNNXOJWOU-UHFFFAOYSA-N	CCS(=O)(=O)N1CCC(CC1)C(=O)N2CCc3ccccc3C2	BroadT	BRD-K07543801	BRD-K07543801-001-07-3	ChemDiv Inc.	K786-6544			CCS(=O)(=O)N1CCC(CC1)C(=O)N1CCc2ccccc2C1	InChI=1S/C17H24N2O3S/c1-2-23(21,22)19-11-8-15(9-12-19)17(20)18-10-7-14-5-3-4-6-16(14)13-18/h3-6,15H,2,7-13H2,1H3	LUECMNNNXOJWOU-UHFFFAOYSA-N	336.150763338							113079
MLS000519548	LSM-24490	SID17402100, BRD-K58908981	3982636	InChI=1S/C26H19N3O5/c1-14-15(16-6-4-5-9-21(16)28-14)12-13-27-26(32)20-11-10-19-22(23(20)29(33)34)25(31)18-8-3-2-7-17(18)24(19)30/h2-11,28H,12-13H2,1H3,(H,27,32)	KCGSIUAAEXGOFA-UHFFFAOYSA-N	Cc1[nH]c2ccccc2c1CCNC(=O)c3ccc4C(=O)c5ccccc5C(=O)c4c3[N+](=O)[O-]	BroadT	BRD-K58908981	BRD-K58908981-001-06-0	ChemDiv Inc.	8013-1778			Cc1[nH]c2ccccc2c1CCNC(=O)c1ccc2C(=O)c3ccccc3C(=O)c2c1[N+]([O-])=O	InChI=1S/C26H19N3O5/c1-14-15(16-6-4-5-9-21(16)28-14)12-13-27-26(32)20-11-10-19-22(23(20)29(33)34)25(31)18-8-3-2-7-17(18)24(19)30/h2-11,28H,12-13H2,1H3,(H,27,32)	KCGSIUAAEXGOFA-UHFFFAOYSA-N	453.132470738							113080
MLS000689129	LSM-24491	SID24805293, BRD-K87157409	683963	InChI=1S/C14H9N3O4/c18-13-11-3-1-2-4-12(11)14(19)16(15-13)9-5-7-10(8-6-9)17(20)21/h1-8H,(H,15,18)	POOVNRMVMWCFKK-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)N2NC(=O)c3ccccc3C2=O	BroadT	BRD-K87157409	BRD-K87157409-001-05-5	Asinex Ltd.	BAS 00125550			[O-][N+](=O)c1ccc(cc1)-n1[nH]c(=O)c2ccccc2c1=O	InChI=1S/C14H9N3O4/c18-13-11-3-1-2-4-12(11)14(19)16(15-13)9-5-7-10(8-6-9)17(20)21/h1-8H,(H,15,18)	POOVNRMVMWCFKK-UHFFFAOYSA-N	283.059305798							113081
MLS000770866	LSM-24492	SID24830114, BRD-K31316016	2111233	InChI=1S/C21H25N5OS/c28-21(22-10-3-11-26-12-14-27-15-13-26)23-17-8-6-16(7-9-17)20-24-18-4-1-2-5-19(18)25-20/h1-2,4-9H,3,10-15H2,(H,24,25)(H2,22,23,28)	CEGPLYZCVFIDPM-UHFFFAOYSA-N	S=C(NCCCN1CCOCC1)Nc2ccc(cc2)c3nc4ccccc4[nH]3	BroadT	BRD-K31316016	BRD-K31316016-001-05-9	Enamine Ltd.	T5241279			S=C(NCCCN1CCOCC1)Nc1ccc(cc1)-c1nc2ccccc2[nH]1	InChI=1S/C21H25N5OS/c28-21(22-10-3-11-26-12-14-27-15-13-26)23-17-8-6-16(7-9-17)20-24-18-4-1-2-5-19(18)25-20/h1-2,4-9H,3,10-15H2,(H,24,25)(H2,22,23,28)	CEGPLYZCVFIDPM-UHFFFAOYSA-N	395.17798116							113082
T5280104	LSM-24493	SID22401061, BRD-K83306930	4830607	InChI=1S/C19H23N3O3S2/c1-25-17-10-8-15(9-11-17)20-19(26)21-16-6-5-7-18(14-16)27(23,24)22-12-3-2-4-13-22/h5-11,14H,2-4,12-13H2,1H3,(H2,20,21,26)	KORBBBCIBHEEED-UHFFFAOYSA-N	COc1ccc(NC(=Nc2cccc(c2)S(=O)(=O)N3CCCCC3)S)cc1	BroadT	BRD-K83306930	BRD-K83306930-001-05-0	Enamine Ltd.	T5280104			COc1ccc(NC(S)=Nc2cccc(c2)S(=O)(=O)N2CCCCC2)cc1	InChI=1S/C19H23N3O3S2/c1-25-17-10-8-15(9-11-17)20-19(26)21-16-6-5-7-18(14-16)27(23,24)22-12-3-2-4-13-22/h5-11,14H,2-4,12-13H2,1H3,(H2,20,21,26)	KORBBBCIBHEEED-UHFFFAOYSA-N	405.118083006							113083
MLS002703076	LSM-2886	BRD-K40094191, SID87556806, SID99495778	17452347	InChI=1S/C15H19N9S/c1-9-6-5-7-10(2)12(9)24-15(20-21-22-24)25-8-11-17-13(16)19-14(18-11)23(3)4/h5-7H,8H2,1-4H3,(H2,16,17,18,19)	SAIPSYFILFBTPK-UHFFFAOYSA-N	CN(C)c1nc(N)nc(CSc2nnnn2c3c(C)cccc3C)n1	BroadT	BRD-K40094191	BRD-K40094191-001-02-5	Broad Institute of MIT and Harvard	BRD-K40094191			CN(C)c1nc(N)nc(CSc2nnnn2-c2c(C)cccc2C)n1	InChI=1S/C15H19N9S/c1-9-6-5-7-10(2)12(9)24-15(20-21-22-24)25-8-11-17-13(16)19-14(18-11)23(3)4/h5-7H,8H2,1-4H3,(H2,16,17,18,19)	SAIPSYFILFBTPK-UHFFFAOYSA-N	357.148412388							92703
F1018-1818	LSM-24494	SID7975236, BRD-K93290704	1076575	InChI=1S/C17H19ClN2O3S/c1-23-17-13-15(7-8-16(17)18)24(21,22)20-11-9-19(10-12-20)14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3	CCFFINUYBWCFRH-UHFFFAOYSA-N	COc1cc(ccc1Cl)S(=O)(=O)N2CCN(CC2)c3ccccc3	BroadT	BRD-K93290704	BRD-K93290704-001-05-8	ChemBridge Corporation	6980586			COc1cc(ccc1Cl)S(=O)(=O)N1CCN(CC1)c1ccccc1	InChI=1S/C17H19ClN2O3S/c1-23-17-13-15(7-8-16(17)18)24(21,22)20-11-9-19(10-12-20)14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3	CCFFINUYBWCFRH-UHFFFAOYSA-N	366.080490888							113084
MLS000849678	LSM-24495	SID26725559, BRD-K89225094	16745780	InChI=1S/C20H18N2O/c1-2-3-4-5-8-15-11-12-19-16(13-15)14-23-20-17-9-6-7-10-18(17)21-22(19)20/h6-7,9-13H,2-4,14H2,1H3	PMRYXVLUXDPVDQ-UHFFFAOYSA-N	CCCCC#Cc1ccc2c(COc3c4ccccc4nn23)c1	BroadT	BRD-K89225094	BRD-K89225094-001-05-8	University of California at Davis	3-(1-hexynyl)-5H-indazolo[3,2-b]benzo[d][1,3]oxazine DS-IZB-204			CCCCC#Cc1ccc-2c(COc3n-2nc2ccccc32)c1	InChI=1S/C20H18N2O/c1-2-3-4-5-8-15-11-12-19-16(13-15)14-23-20-17-9-6-7-10-18(17)21-22(19)20/h6-7,9-13H,2-4,14H2,1H3	PMRYXVLUXDPVDQ-UHFFFAOYSA-N	302.141913216							113085
1-(3-Chloro-phenyl)-3-(9-cyclopentyl-9-aza-bicyclo[3.3.1]non-3-yl)-thiourea	LSM-24496	SID17431707, BRD-A95183133	3218012	InChI=1S/C20H28ClN3S/c21-14-5-3-6-15(11-14)22-20(25)23-16-12-18-9-4-10-19(13-16)24(18)17-7-1-2-8-17/h3,5-6,11,16-19H,1-2,4,7-10,12-13H2,(H2,22,23,25)	BREACPWXLAMJQV-UHFFFAOYSA-N	Clc1cccc(NC(=S)NC2CC3CCCC(C2)N3C4CCCC4)c1	BroadT	BRD-A95183133	BRD-A95183133-001-05-6	Asinex Ltd.	ASN 06222909			Clc1cccc(NC(=S)NC2CC3CCCC(C2)N3C2CCCC2)c1	InChI=1S/C20H28ClN3S/c21-14-5-3-6-15(11-14)22-20(25)23-16-12-18-9-4-10-19(13-16)24(18)17-7-1-2-8-17/h3,5-6,11,16-19H,1-2,4,7-10,12-13H2,(H2,22,23,25)	BREACPWXLAMJQV-UHFFFAOYSA-N	377.169246326							113086
1W-0800	LSM-24497	SID14729908, BRD-K34259741	3652185	InChI=1S/C16H12ClF3N4O/c1-9-3-5-12(6-4-9)23-10(2)22-24(15(23)25)14-13(17)7-11(8-21-14)16(18,19)20/h3-8H,1-2H3	YAJPGRLCOCGMDL-UHFFFAOYSA-N	CC1=NN(C(=O)N1c2ccc(C)cc2)c3ncc(cc3Cl)C(F)(F)F	BroadT	BRD-K34259741	BRD-K34259741-001-05-0	Key Organics Ltd.	1W-0800			Cc1nn(-c2ncc(cc2Cl)C(F)(F)F)c(=O)n1-c1ccc(C)cc1	InChI=1S/C16H12ClF3N4O/c1-9-3-5-12(6-4-9)23-10(2)22-24(15(23)25)14-13(17)7-11(8-21-14)16(18,19)20/h3-8H,1-2H3	YAJPGRLCOCGMDL-UHFFFAOYSA-N	368.065173354							113087
BAS 05170279	LSM-24498	BRD-K36612931	725146	InChI=1S/C17H13N3OS/c18-16-15(17-19-12-8-4-5-9-14(12)22-17)13(21)10-20(16)11-6-2-1-3-7-11/h1-9H,10,18H2	VNPXKXSKKUVBEM-UHFFFAOYSA-N	NC1=C(C(=O)CN1c2ccccc2)c3nc4ccccc4s3	BroadT	BRD-K36612931	BRD-K36612931-001-06-6	Asinex Ltd.	BAS 05170279			NC1=C(C(=O)CN1c1ccccc1)c1nc2ccccc2s1	InChI=1S/C17H13N3OS/c18-16-15(17-19-12-8-4-5-9-14(12)22-17)13(21)10-20(16)11-6-2-1-3-7-11/h1-9H,10,18H2	VNPXKXSKKUVBEM-UHFFFAOYSA-N	307.077932756							113088
T5740316	LSM-24499	SID7974168, BRD-K29356312	881514	InChI=1S/C19H20N2O4/c22-19(20-16-5-6-17-18(11-16)25-13-24-17)15-3-1-14(2-4-15)12-21-7-9-23-10-8-21/h1-6,11H,7-10,12-13H2,(H,20,22)	PUOGDXPWFUYYGN-UHFFFAOYSA-N	O=C(Nc1ccc2OCOc2c1)c3ccc(CN4CCOCC4)cc3	BroadT	BRD-K29356312	BRD-K29356312-001-05-0	ChemBridge Corporation	6397390			O=C(Nc1ccc2OCOc2c1)c1ccc(CN2CCOCC2)cc1	InChI=1S/C19H20N2O4/c22-19(20-16-5-6-17-18(11-16)25-13-24-17)15-3-1-14(2-4-15)12-21-7-9-23-10-8-21/h1-6,11H,7-10,12-13H2,(H,20,22)	PUOGDXPWFUYYGN-UHFFFAOYSA-N	340.14230714							113089
N-[2,5-Dimethoxy-4-(2-morpholin-4-yl-acetylamino)-phenyl]-benzamide	LSM-24500	SID852227, BRD-K69889991	654839	InChI=1S/C21H25N3O5/c1-27-18-13-17(23-21(26)15-6-4-3-5-7-15)19(28-2)12-16(18)22-20(25)14-24-8-10-29-11-9-24/h3-7,12-13H,8-11,14H2,1-2H3,(H,22,25)(H,23,26)	SAPNDXAWFRWBHK-UHFFFAOYSA-N	COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)CN3CCOCC3	BroadT	BRD-K69889991	BRD-K69889991-001-05-9	Asinex Ltd.	ASN 05211792			COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)CN1CCOCC1	InChI=1S/C21H25N3O5/c1-27-18-13-17(23-21(26)15-6-4-3-5-7-15)19(28-2)12-16(18)22-20(25)14-24-8-10-29-11-9-24/h3-7,12-13H,8-11,14H2,1-2H3,(H,22,25)(H,23,26)	SAPNDXAWFRWBHK-UHFFFAOYSA-N	399.17942093							113090
SMR000034827	LSM-24501	SID859771, BRD-A18780086	661073	InChI=1S/C16H17N5O/c1-2-5-12(6-3-1)21-16-14(10-20-21)15(18-11-19-16)17-9-13-7-4-8-22-13/h1-3,5-6,10-11,13H,4,7-9H2,(H,17,18,19)	TVPJXDKGYSDAKK-UHFFFAOYSA-N	C(Nc1ncnc2c1cnn2c3ccccc3)C4CCCO4	BroadT	BRD-A18780086	BRD-A18780086-001-06-8	InterBioScreen Ltd.	STOCK3S-31038			C(Nc1ncnc2n(ncc12)-c1ccccc1)C1CCCO1	InChI=1S/C16H17N5O/c1-2-5-12(6-3-1)21-16-14(10-20-21)15(18-11-19-16)17-9-13-7-4-8-22-13/h1-3,5-6,10-11,13H,4,7-9H2,(H,17,18,19)	TVPJXDKGYSDAKK-UHFFFAOYSA-N	295.143310214							113091
SMR000003369	LSM-24502	SID26667938, SID843671, BRD-A07517316	645974	InChI=1S/C26H32N6O4/c1-26(2,3)32-24(28-29-30-32)23(21-14-17-13-18(34-4)9-10-22(17)27-25(21)33)31(15-19-7-5-11-35-19)16-20-8-6-12-36-20/h5,7,9-11,13-14,20,23H,6,8,12,15-16H2,1-4H3,(H,27,33)	VWLAIDWVJVSANK-UHFFFAOYSA-N	COc1ccc2nc(O)c(cc2c1)C(N(CC3CCCO3)Cc4occc4)c5nnnn5C(C)(C)C	BroadT	BRD-A07517316	BRD-A07517316-001-05-1	Asinex Ltd.	ASN 04422102			COc1ccc2nc(O)c(cc2c1)C(N(CC1CCCO1)Cc1ccco1)c1nnnn1C(C)(C)C	InChI=1S/C26H32N6O4/c1-26(2,3)32-24(28-29-30-32)23(21-14-17-13-18(34-4)9-10-22(17)27-25(21)33)31(15-19-7-5-11-35-19)16-20-8-6-12-36-20/h5,7,9-11,13-14,20,23H,6,8,12,15-16H2,1-4H3,(H,27,33)	VWLAIDWVJVSANK-UHFFFAOYSA-N	492.248503564							113092
F0816-0056	LSM-24503	SID22402384, BRD-K45855024	4245991	InChI=1S/C24H18N4O3/c29-21-12-13-22(30)28(21)18-5-3-4-16(14-18)24(31)25-17-10-8-15(9-11-17)23-26-19-6-1-2-7-20(19)27-23/h1-11,14H,12-13H2,(H,25,31)(H,26,27)	CYQXTOLGRVVWPJ-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)c2nc3ccccc3[nH]2)c4cccc(c4)N5C(=O)CCC5=O	BroadT	BRD-K45855024	BRD-K45855024-001-06-8	Life Chemicals Inc.	F0816-0056			O=C(Nc1ccc(cc1)-c1nc2ccccc2[nH]1)c1cccc(c1)N1C(=O)CCC1=O	InChI=1S/C24H18N4O3/c29-21-12-13-22(30)28(21)18-5-3-4-16(14-18)24(31)25-17-10-8-15(9-11-17)23-26-19-6-1-2-7-20(19)27-23/h1-11,14H,12-13H2,(H,25,31)(H,26,27)	CYQXTOLGRVVWPJ-UHFFFAOYSA-N	410.137890476							113093
BRD-A80957562	LSM-44059			InChI=1S/C23H26N2O6/c1-30-18-11-9-16(14-19(18)31-2)8-10-17(26)20-21(27)24-23(29)25(22(20)28)13-12-15-6-4-3-5-7-15/h6,8-11,14,20H,3-5,7,12-13H2,1-2H3,(H,24,27,29)/b10-8+	HAZSPZWIQCPUHC-CSKARUKUSA-N	COc1ccc(\C=C\C(=O)C2C(=O)NC(=O)N(CCC3=CCCCC3)C2=O)cc1OC	BroadT	BRD-A80957562	BRD-A80957562-001-06-8	InterBioScreen Ltd.	STOCK5S-27352			COc1ccc(\C=C\C(=O)C2C(=O)NC(=O)N(CCC3=CCCCC3)C2=O)cc1OC	InChI=1S/C23H26N2O6/c1-30-18-11-9-16(14-19(18)31-2)8-10-17(26)20-21(27)24-23(29)25(22(20)28)13-12-15-6-4-3-5-7-15/h6,8-11,14,20H,3-5,7,12-13H2,1-2H3,(H,24,27,29)/b10-8+	HAZSPZWIQCPUHC-CSKARUKUSA-N	426.179086572							
ZINC05161849	LSM-24505	SID26725725, BRD-K80403200	3566959	InChI=1S/C16H16N6O4/c1-25-11-5-2-4-10(8-11)19-16-20-14(17)13(22(23)24)15(21-16)18-9-12-6-3-7-26-12/h2-8H,9H2,1H3,(H4,17,18,19,20,21)	UHBLKYYIRALZHO-UHFFFAOYSA-N	COc1cccc(Nc2nc(N)c(c(NCc3occc3)n2)[N+](=O)[O-])c1	BroadT	BRD-K80403200	BRD-K80403200-001-05-1	InterBioScreen Ltd.	STOCK4S-39342			COc1cccc(Nc2nc(N)c(c(NCc3ccco3)n2)[N+]([O-])=O)c1	InChI=1S/C16H16N6O4/c1-25-11-5-2-4-10(8-11)19-16-20-14(17)13(22(23)24)15(21-16)18-9-12-6-3-7-26-12/h2-8H,9H2,1H3,(H4,17,18,19,20,21)	UHBLKYYIRALZHO-UHFFFAOYSA-N	356.123303052							113095
N'-decanoyl-1-ethyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbohydrazide	LSM-24506	SID24803146, BRD-K28339848	54687080	InChI=1S/C22H31N3O4/c1-3-5-6-7-8-9-10-15-18(26)23-24-21(28)19-20(27)16-13-11-12-14-17(16)25(4-2)22(19)29/h11-14,27H,3-10,15H2,1-2H3,(H,23,26)(H,24,28)	STZGSXKOCPMQFV-UHFFFAOYSA-N	CCCCCCCCCC(=O)NNC(=O)C1=C(O)c2ccccc2N(CC)C1=O	BroadT	BRD-K28339848	BRD-K28339848-001-06-8	Asinex Ltd.	BAS 00693296			CCCCCCCCCC(=O)NNC(=O)c1c(O)c2ccccc2n(CC)c1=O	InChI=1S/C22H31N3O4/c1-3-5-6-7-8-9-10-15-18(26)23-24-21(28)19-20(27)16-13-11-12-14-17(16)25(4-2)22(19)29/h11-14,27H,3-10,15H2,1-2H3,(H,23,26)(H,24,28)	STZGSXKOCPMQFV-UHFFFAOYSA-N	401.231456502							113096
F1808-0062	LSM-24507	SID24815323, BRD-K97353194	2149373	InChI=1S/C20H24N2O5/c1-2-26-19(24)14-27-17-8-6-7-16-15(17)9-12-22(20(16)25)13-18(23)21-10-4-3-5-11-21/h6-9,12H,2-5,10-11,13-14H2,1H3	JKVGORVIWSKTIM-UHFFFAOYSA-N	CCOC(=O)COc1cccc2C(=O)N(CC(=O)N3CCCCC3)C=Cc12	BroadT	BRD-K97353194	BRD-K97353194-001-05-7	Life Chemicals Inc.	F1808-0062			CCOC(=O)COc1cccc2c1ccn(CC(=O)N1CCCCC1)c2=O	InChI=1S/C20H24N2O5/c1-2-26-19(24)14-27-17-8-6-7-16-15(17)9-12-22(20(16)25)13-18(23)21-10-4-3-5-11-21/h6-9,12H,2-5,10-11,13-14H2,1H3	JKVGORVIWSKTIM-UHFFFAOYSA-N	372.168521888							113097
F1358-0094	LSM-24508	SID49677739, BRD-K11295823	3332875	InChI=1S/C15H15NO3S/c1-19-15(18)12-9-10-20-14(12)16-13(17)8-7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H,16,17)	MTQVMVKSXBFESI-UHFFFAOYSA-N	COC(=O)c1ccsc1NC(=O)CCc2ccccc2	BroadT	BRD-K11295823	BRD-K11295823-001-05-2	Life Chemicals Inc.	F1358-0094			COC(=O)c1ccsc1NC(=O)CCc1ccccc1	InChI=1S/C15H15NO3S/c1-19-15(18)12-9-10-20-14(12)16-13(17)8-7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H,16,17)	MTQVMVKSXBFESI-UHFFFAOYSA-N	289.07726404							113098
1-(3-Chlorophenyl)-3-(thiophen-2-ylmethyl)thiourea	LSM-24509	SID17412369, BRD-K31669900	2059105	InChI=1S/C12H11ClN2S2/c13-9-3-1-4-10(7-9)15-12(16)14-8-11-5-2-6-17-11/h1-7H,8H2,(H2,14,15,16)	HUQUGVIUYLNXEX-UHFFFAOYSA-N	Clc1cccc(NC(=S)NCc2cccs2)c1	BroadT	BRD-K31669900	BRD-K31669900-001-05-0	ChemBridge Corporation	5876518			Clc1cccc(NC(=S)NCc2cccs2)c1	InChI=1S/C12H11ClN2S2/c13-9-3-1-4-10(7-9)15-12(16)14-8-11-5-2-6-17-11/h1-7H,8H2,(H2,14,15,16)	HUQUGVIUYLNXEX-UHFFFAOYSA-N	282.005217462							113099
MLS000325322	LSM-24510	SID17386583, BRD-K53499485	1234240	InChI=1S/C13H11ClN4S/c1-7-11-8(2)18(10-5-3-4-9(14)6-10)17-12(11)13(19)16-15-7/h3-6H,1-2H3,(H,16,19)	JWGNZMYQNRMNMN-UHFFFAOYSA-N	Cc1nnc(S)c2nn(c(C)c12)c3cccc(Cl)c3	BroadT	BRD-K53499485	BRD-K53499485-001-03-3	Specs	AO-476/43249964			Cc1n(nc2c(S)nnc(C)c12)-c1cccc(Cl)c1	InChI=1S/C13H11ClN4S/c1-7-11-8(2)18(10-5-3-4-9(14)6-10)17-12(11)13(19)16-15-7/h3-6H,1-2H3,(H,16,19)	JWGNZMYQNRMNMN-UHFFFAOYSA-N	290.039294792							113100
MLS000052773	LSM-24511	SID4263461, BRD-K74006591	1258402	InChI=1S/C14H9BrN4O3/c15-8-5-16-13-4-10(18-19(13)6-8)14(20)17-9-1-2-11-12(3-9)22-7-21-11/h1-6H,7H2,(H,17,20)	OFOQRUGUYSEKGB-UHFFFAOYSA-N	Brc1cnc2cc(nn2c1)C(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K74006591	BRD-K74006591-001-04-0	ChemBridge Corporation	7986333			Brc1cnc2cc(nn2c1)C(=O)Nc1ccc2OCOc2c1	InChI=1S/C14H9BrN4O3/c15-8-5-16-13-4-10(18-19(13)6-8)14(20)17-9-1-2-11-12(3-9)22-7-21-11/h1-6H,7H2,(H,17,20)	OFOQRUGUYSEKGB-UHFFFAOYSA-N	359.985802788							113101
MLS000031093	LSM-15366	BRD-A84245072	647897	InChI=1S/C21H25N5O3/c1-28-12-11-26-21(22-23-24-26)20(16-7-8-18(27)19(13-16)29-2)25-10-9-15-5-3-4-6-17(15)14-25/h3-8,13,20,27H,9-12,14H2,1-2H3	WZLUAEIXQLABNE-UHFFFAOYSA-N	COCCn1nnnc1C(N2CCc3ccccc3C2)c4ccc(O)c(OC)c4	BroadT	BRD-A84245072	BRD-A84245072-003-05-5	Asinex Ltd.	ASN 05346383		Cl	COCCn1nnnc1C(N1CCc2ccccc2C1)c1ccc(O)c(OC)c1.Cl	InChI=1S/C21H25N5O3.ClH/c1-28-12-11-26-21(22-23-24-26)20(16-7-8-18(27)19(13-16)29-2)25-10-9-15-5-3-4-6-17(15)14-25;/h3-8,13,20,27H,9-12,14H2,1-2H3;1H	HCQCYNXSLFIDMO-UHFFFAOYSA-N	395.19573971							104013, 104013
N-(3,4-Dimethoxyphenyl)-4-methoxybenzamide	LSM-24512	SID4264178, BRD-K36807975	755237	InChI=1S/C16H17NO4/c1-19-13-7-4-11(5-8-13)16(18)17-12-6-9-14(20-2)15(10-12)21-3/h4-10H,1-3H3,(H,17,18)	DZLDMWHRLSFSIJ-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)Nc2ccc(OC)c(OC)c2	BroadT	BRD-K36807975	BRD-K36807975-001-05-1	ChemBridge Corporation	5337648			COc1ccc(cc1)C(=O)Nc1ccc(OC)c(OC)c1	InChI=1S/C16H17NO4/c1-19-13-7-4-11(5-8-13)16(18)17-12-6-9-14(20-2)15(10-12)21-3/h4-10H,1-3H3,(H,17,18)	DZLDMWHRLSFSIJ-UHFFFAOYSA-N	287.115758034							113102
SMR000093892	LSM-24513	SID24838233, SID7967047, BRD-A26633881	5308592	InChI=1S/C26H27N3O5/c1-3-33-26(32)28-12-10-18(11-13-28)29-24(20-6-4-5-7-21(20)25(29)31)27-17-8-9-19-16(2)14-23(30)34-22(19)15-17/h4-9,14-15,18,24,27H,3,10-13H2,1-2H3	NVDWZMNKWRPAMJ-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)N2C(Nc3ccc4C(=CC(=O)Oc4c3)C)c5ccccc5C2=O	BroadT	BRD-A26633881	BRD-A26633881-001-05-8	ChemDiv Inc.	C429-0363			CCOC(=O)N1CCC(CC1)N1C(Nc2ccc3c(C)cc(=O)oc3c2)c2ccccc2C1=O	InChI=1S/C26H27N3O5/c1-3-33-26(32)28-12-10-18(11-13-28)29-24(20-6-4-5-7-21(20)25(29)31)27-17-8-9-19-16(2)14-23(30)34-22(19)15-17/h4-9,14-15,18,24,27H,3,10-13H2,1-2H3	NVDWZMNKWRPAMJ-UHFFFAOYSA-N	461.195070994							113103
MLS001043228	LSM-44060	SID26667079, BRD-K25975823	1716445	InChI=1S/C16H13NO3/c1-10-3-6-12(7-4-10)15-14(16(18)20-17-15)9-13-8-5-11(2)19-13/h3-9H,1-2H3/b14-9-	UCAWQQVUBVYQQD-ZROIWOOFSA-N	Cc1oc(\C=C\2/C(=O)ON=C2c3ccc(C)cc3)cc1	BroadT	BRD-K25975823	BRD-K25975823-001-05-3	InterBioScreen Ltd.	STOCK1S-92531			Cc1ccc(o1)\C=C1C(=O)ON=C/1c1ccc(C)cc1	InChI=1S/C16H13NO3/c1-10-3-6-12(7-4-10)15-14(16(18)20-17-15)9-13-8-5-11(2)19-13/h3-9H,1-2H3/b14-9-	UCAWQQVUBVYQQD-ZROIWOOFSA-N	267.089543286							
2-(3,3-Dimethyl-2-oxobutylidene)-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-1,3-thiazolidin-4-one	LSM-24515	BRD-K03032824	4794224	InChI=1S/C17H19NO4S/c1-17(2,3)14(20)9-15-18-16(21)13(23-15)8-10-5-6-12(22-4)11(19)7-10/h5-9,19H,1-4H3,(H,18,21)	QGGLCGBRBYFWPB-UHFFFAOYSA-N	COc1ccc(C=C2SC(=CC(=O)C(C)(C)C)NC2=O)cc1O	BroadT	BRD-K03032824	BRD-K03032824-001-08-2	Enamine Ltd.	ZT-7780324			COc1ccc(C=c2sc(=CC(=O)C(C)(C)C)[nH]c2=O)cc1O	InChI=1S/C17H19NO4S/c1-17(2,3)14(20)9-15-18-16(21)13(23-15)8-10-5-6-12(22-4)11(19)7-10/h5-9,19H,1-4H3,(H,18,21)	QGGLCGBRBYFWPB-UHFFFAOYSA-N	333.103478788							113105
AC1NIPJ9	LSM-24516	SID124876827, SID26725718, BRD-K97069765	4859726	InChI=1S/C23H24ClN5O2S/c1-12-16-11-31-23(2,3)10-15(16)17-18-19(32-20(17)27-12)21(30)29(22(28-18)26-8-7-25)14-6-4-5-13(24)9-14/h4-6,9H,7-8,10-11,25H2,1-3H3,(H,26,28)	KCAANTLEXQECNW-UHFFFAOYSA-N	Cc1nc2sc3C(=O)N(C(=Nc3c2c4CC(C)(C)OCc14)NCCN)c5cccc(Cl)c5	BroadT	BRD-K97069765	BRD-K97069765-001-06-6	InterBioScreen Ltd.	STOCK5S-27919			Cc1nc2sc3c(nc(NCCN)n(-c4cccc(Cl)c4)c3=O)c2c2CC(C)(C)OCc12	InChI=1S/C23H24ClN5O2S/c1-12-16-11-31-23(2,3)10-15(16)17-18-19(32-20(17)27-12)21(30)29(22(28-18)26-8-7-25)14-6-4-5-13(24)9-14/h4-6,9H,7-8,10-11,25H2,1-3H3,(H,26,28)	KCAANTLEXQECNW-UHFFFAOYSA-N	469.133923458							113106
MLS001174340	LSM-24517	SID49676307, BRD-K09495525	4841980	InChI=1S/C19H17F3N2O/c1-12-8-18(16-10-15(25-2)6-7-17(16)24-12)23-11-13-4-3-5-14(9-13)19(20,21)22/h3-10H,11H2,1-2H3,(H,23,24)	SGDQPSJNELHSAJ-UHFFFAOYSA-N	COc1ccc2nc(C)cc(NCc3cccc(c3)C(F)(F)F)c2c1	BroadT	BRD-K09495525	BRD-K09495525-001-06-1	Enamine Ltd.	T5348073			COc1ccc2nc(C)cc(NCc3cccc(c3)C(F)(F)F)c2c1	InChI=1S/C19H17F3N2O/c1-12-8-18(16-10-15(25-2)6-7-17(16)24-12)23-11-13-4-3-5-14(9-13)19(20,21)22/h3-10H,11H2,1-2H3,(H,23,24)	SGDQPSJNELHSAJ-UHFFFAOYSA-N	346.129297784							113107
ST50577416	LSM-24518	SID4264656, BRD-K20519399	2218468	InChI=1S/C13H15N3O2S2/c1-9-15-16-13(20-9)14-12(17)10-5-3-4-6-11(10)19-8-7-18-2/h3-6H,7-8H2,1-2H3,(H,14,16,17)	YRNRMTXPKCSCRY-UHFFFAOYSA-N	COCCSc1ccccc1C(=O)Nc2nnc(C)s2	BroadT	BRD-K20519399	BRD-K20519399-001-05-8	ChemBridge Corporation	7908375			COCCSc1ccccc1C(=O)Nc1nnc(C)s1	InChI=1S/C13H15N3O2S2/c1-9-15-16-13(20-9)14-12(17)10-5-3-4-6-11(10)19-8-7-18-2/h3-6H,7-8H2,1-2H3,(H,14,16,17)	YRNRMTXPKCSCRY-UHFFFAOYSA-N	309.06056813							113108
MLS000082037	LSM-24519	SID3715297, BRD-K42774283	2421595	InChI=1S/C24H23N3O4/c1-16-12-20(17(2)27(16)18-8-10-19(30-3)11-9-18)23(28)14-31-24(29)13-26-15-25-21-6-4-5-7-22(21)26/h4-12,15H,13-14H2,1-3H3	DMMIKXQNMAPFBA-UHFFFAOYSA-N	COc1ccc(cc1)n2c(C)cc(C(=O)COC(=O)Cn3cnc4ccccc34)c2C	BroadT	BRD-K42774283	BRD-K42774283-001-05-2	Enamine Ltd.	T0515-7300			COc1ccc(cc1)-n1c(C)cc(C(=O)COC(=O)Cn2cnc3ccccc23)c1C	InChI=1S/C24H23N3O4/c1-16-12-20(17(2)27(16)18-8-10-19(30-3)11-9-18)23(28)14-31-24(29)13-26-15-25-21-6-4-5-7-22(21)26/h4-12,15H,13-14H2,1-3H3	DMMIKXQNMAPFBA-UHFFFAOYSA-N	417.168856246							113109
T5338936	LSM-24520	SID24826284, BRD-K25699701	4885071	InChI=1S/C20H16N2O6/c21-8-7-19(24)22-15-4-1-13(2-5-15)20(25)28-12-16(23)14-3-6-17-18(11-14)27-10-9-26-17/h1-6,11H,7,9-10,12H2,(H,22,24)	JJEUNASOOJLQCS-UHFFFAOYSA-N	O=C(CC#N)Nc1ccc(cc1)C(=O)OCC(=O)c2ccc3OCCOc3c2	BroadT	BRD-K25699701	BRD-K25699701-001-05-6	Enamine Ltd.	T5338936			O=C(CC#N)Nc1ccc(cc1)C(=O)OCC(=O)c1ccc2OCCOc2c1	InChI=1S/C20H16N2O6/c21-8-7-19(24)22-15-4-1-13(2-5-15)20(25)28-12-16(23)14-3-6-17-18(11-14)27-10-9-26-17/h1-6,11H,7,9-10,12H2,(H,22,24)	JJEUNASOOJLQCS-UHFFFAOYSA-N	380.100836252							113110
AC1OBJ8H	LSM-24521	BRD-K44056493	6824027	InChI=1S/C21H21N9O3/c1-13(15-10-6-7-11-17(15)31)23-25-21(32)18-16(12-29(2)14-8-4-3-5-9-14)30(28-24-18)20-19(22)26-33-27-20/h3-11,31H,12H2,1-2H3,(H2,22,26)(H,25,32)	QPDAZSCVOUSMJN-UHFFFAOYSA-N	CN(Cc1c(nnn1c2nonc2N)C(=O)NN=C(C)c3ccccc3O)c4ccccc4	BroadT	BRD-K44056493	BRD-K44056493-001-08-2	InterBioScreen Ltd.	STOCK5S-23049			CN(Cc1c(nnn1-c1nonc1N)C(=O)NN=C(C)c1ccccc1O)c1ccccc1	InChI=1S/C21H21N9O3/c1-13(15-10-6-7-11-17(15)31)23-25-21(32)18-16(12-29(2)14-8-4-3-5-9-14)30(28-24-18)20-19(22)26-33-27-20/h3-11,31H,12H2,1-2H3,(H2,22,26)(H,25,32)	QPDAZSCVOUSMJN-UHFFFAOYSA-N	447.176735622							
4,5-Dimethoxy-1-indanone	LSM-24522	SID14728401, BRD-K50080712	240446	InChI=1S/C11H12O3/c1-13-10-6-4-7-8(11(10)14-2)3-5-9(7)12/h4,6H,3,5H2,1-2H3	XQODIRIVQXQUFN-UHFFFAOYSA-N	COc1ccc2C(=O)CCc2c1OC	BroadT	BRD-K50080712	BRD-K50080712-001-05-4	Specs	AG-205/33132027			COc1ccc2C(=O)CCc2c1OC	InChI=1S/C11H12O3/c1-13-10-6-4-7-8(11(10)14-2)3-5-9(7)12/h4,6H,3,5H2,1-2H3	XQODIRIVQXQUFN-UHFFFAOYSA-N	192.078644244							113112
SMR000244144	LSM-24523	SID22411040, BRD-K93816050	3425678	InChI=1S/C21H19ClN2O5S2/c1-29-18-10-8-14(23-21(26)11-9-17(25)19-7-4-12-30-19)13-20(18)31(27,28)24-16-6-3-2-5-15(16)22/h2-8,10,12-13,24H,9,11H2,1H3,(H,23,26)	QCGPRAFFLKMLQO-UHFFFAOYSA-N	COc1ccc(NC(=O)CCC(=O)c2cccs2)cc1S(=O)(=O)Nc3ccccc3Cl	BroadT	BRD-K93816050	BRD-K93816050-001-05-0	Enamine Ltd.	T0518-3094			COc1ccc(NC(=O)CCC(=O)c2cccs2)cc1S(=O)(=O)Nc1ccccc1Cl	InChI=1S/C21H19ClN2O5S2/c1-29-18-10-8-14(23-21(26)11-9-17(25)19-7-4-12-30-19)13-20(18)31(27,28)24-16-6-3-2-5-15(16)22/h2-8,10,12-13,24H,9,11H2,1H3,(H,23,26)	QCGPRAFFLKMLQO-UHFFFAOYSA-N	478.042390818							113113
ZINC15935202	LSM-24524	BRD-K59556628	73628831	InChI=1S/C21H19N3O3/c1-12(15-9-8-14(25)10-20(15)26)23-24-21(27)17-11-19(13-6-7-13)22-18-5-3-2-4-16(17)18/h2-5,8-11,13,25-26H,6-7H2,1H3,(H,24,27)	JQXUPGQHWCPLBO-UHFFFAOYSA-N	CC(=NNC(=O)c1cc(nc2ccccc12)C3CC3)c4ccc(O)cc4O	BroadT	BRD-K59556628	BRD-K59556628-001-09-9	ChemDiv Inc.	3857-0450			CC(=NNC(=O)c1cc(nc2ccccc12)C1CC1)c1ccc(O)cc1O	InChI=1S/C21H19N3O3/c1-12(15-9-8-14(25)10-20(15)26)23-24-21(27)17-11-19(13-6-7-13)22-18-5-3-2-4-16(17)18/h2-5,8-11,13,25-26H,6-7H2,1H3,(H,24,27)	JQXUPGQHWCPLBO-UHFFFAOYSA-N	361.142641498							
Thiophene-2-carboxylic acid [2,5-diethoxy-4-(3-ethyl-thioureido)-phenyl]-amide	LSM-24525	SID17508280, BRD-K12426884	1172884	InChI=1S/C18H23N3O3S2/c1-4-19-18(25)21-13-11-14(23-5-2)12(10-15(13)24-6-3)20-17(22)16-8-7-9-26-16/h7-11H,4-6H2,1-3H3,(H,20,22)(H2,19,21,25)	LFCOEQGAPUUBFT-UHFFFAOYSA-N	CCNC(=Nc1cc(OCC)c(NC(=O)c2cccs2)cc1OCC)S	BroadT	BRD-K12426884	BRD-K12426884-001-05-8	Asinex Ltd.	ASN 03271148			CCNC(S)=Nc1cc(OCC)c(NC(=O)c2cccs2)cc1OCC	InChI=1S/C18H23N3O3S2/c1-4-19-18(25)21-13-11-14(23-5-2)12(10-15(13)24-6-3)20-17(22)16-8-7-9-26-16/h7-11H,4-6H2,1-3H3,(H,20,22)(H2,19,21,25)	LFCOEQGAPUUBFT-UHFFFAOYSA-N	393.118083006							113115
SMR000005541	LSM-24526	SID851427, BRD-K83018207	653996	InChI=1S/C15H16N4OS3/c1-3-19(4-2)11(20)8-22-15-14-13(16-9-17-15)12(18-23-14)10-6-5-7-21-10/h5-7,9H,3-4,8H2,1-2H3	CJWPVUGGJZFAAF-UHFFFAOYSA-N	CCN(CC)C(=O)CSc1ncnc2c(nsc12)c3cccs3	BroadT	BRD-K83018207	BRD-K83018207-001-04-0	Asinex Ltd.	ASN 05805166			CCN(CC)C(=O)CSc1ncnc2c(nsc12)-c1cccs1	InChI=1S/C15H16N4OS3/c1-3-19(4-2)11(20)8-22-15-14-13(16-9-17-15)12(18-23-14)10-6-5-7-21-10/h5-7,9H,3-4,8H2,1-2H3	CJWPVUGGJZFAAF-UHFFFAOYSA-N	364.048623242							113116
SMR000220388	LSM-24527	SID17505846, BRD-K64479593	1423773	InChI=1S/C17H14BrN5O3/c18-16-20-17(23(25)26)21-22(16)11-14(24)19-15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H,19,24)	VKACHKKCPNPLIZ-UHFFFAOYSA-N	[O-][N+](=O)c1nc(Br)n(CC(=O)NC(c2ccccc2)c3ccccc3)n1	BroadT	BRD-K64479593	BRD-K64479593-001-05-6	InterBioScreen Ltd.	STOCK4S-56153			[O-][N+](=O)c1nc(Br)n(CC(=O)NC(c2ccccc2)c2ccccc2)n1	InChI=1S/C17H14BrN5O3/c18-16-20-17(23(25)26)21-22(16)11-14(24)19-15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H,19,24)	VKACHKKCPNPLIZ-UHFFFAOYSA-N	415.028001958							113117
AC1OHAHK	LSM-24528	BRD-A82384318	7233177	InChI=1S/C14H14ClNO3/c1-19-8-4-7-16-12-11(15)13(17)9-5-2-3-6-10(9)14(12)18/h2-3,5-6,11H,4,7-8H2,1H3	TVWWZEZFEFMTNC-UHFFFAOYSA-N	COCCCN=C1C(Cl)C(=O)c2ccccc2C1=O	BroadT	BRD-A82384318	BRD-A82384318-001-05-2	InterBioScreen Ltd.	STOCK2S-11829			COCCCN=C1C(Cl)C(=O)c2ccccc2C1=O	InChI=1S/C14H14ClNO3/c1-19-8-4-7-16-12-11(15)13(17)9-5-2-3-6-10(9)14(12)18/h2-3,5-6,11H,4,7-8H2,1H3	TVWWZEZFEFMTNC-UHFFFAOYSA-N	279.066221028							113118
SMR000111165	LSM-24529	SID7974705, BRD-K74277640	870240	InChI=1S/C17H19NO3S2/c1-10(2)21-17(20)14-11-6-3-4-7-12(11)23-16(14)18-15(19)13-8-5-9-22-13/h5,8-10H,3-4,6-7H2,1-2H3,(H,18,19)	XPFCNMQJNPXHKD-UHFFFAOYSA-N	CC(C)OC(=O)c1c2CCCCc2sc1NC(=O)c3cccs3	BroadT	BRD-K74277640	BRD-K74277640-001-05-5	ChemBridge Corporation	5570156			CC(C)OC(=O)c1c(NC(=O)c2cccs2)sc2CCCCc12	InChI=1S/C17H19NO3S2/c1-10(2)21-17(20)14-11-6-3-4-7-12(11)23-16(14)18-15(19)13-8-5-9-22-13/h5,8-10H,3-4,6-7H2,1-2H3,(H,18,19)	XPFCNMQJNPXHKD-UHFFFAOYSA-N	349.080634858							113119
T0520-6226	LSM-24530	SID22408002, BRD-A64402082	3383797	InChI=1S/C27H34N4O3S/c1-17-4-5-20-23(12-17)35-27-25(20)26(28-24(29-27)16-30-8-10-34-11-9-30)31-7-6-18-13-21(32-2)22(33-3)14-19(18)15-31/h13-14,17H,4-12,15-16H2,1-3H3	BKWQTARJNMLXOC-UHFFFAOYSA-N	COc1cc2CCN(Cc2cc1OC)c3nc(CN4CCOCC4)nc5sc6CC(C)CCc6c35	BroadT	BRD-A64402082	BRD-A64402082-001-05-8	Enamine Ltd.	T0520-6226			COc1cc2CCN(Cc2cc1OC)c1nc(CN2CCOCC2)nc2sc3CC(C)CCc3c12	InChI=1S/C27H34N4O3S/c1-17-4-5-20-23(12-17)35-27-25(20)26(28-24(29-27)16-30-8-10-34-11-9-30)31-7-6-18-13-21(32-2)22(33-3)14-19(18)15-31/h13-14,17H,4-12,15-16H2,1-3H3	BKWQTARJNMLXOC-UHFFFAOYSA-N	494.235161678							113120
2-(3-Acetyl-indol-1-yl)-n-(2,4-dimethyl-phenyl)-acetamide	LSM-24531	SID14726285, BRD-K77614806	1088499	InChI=1S/C20H20N2O2/c1-13-8-9-18(14(2)10-13)21-20(24)12-22-11-17(15(3)23)16-6-4-5-7-19(16)22/h4-11H,12H2,1-3H3,(H,21,24)	AHJRAELVJNWEIP-UHFFFAOYSA-N	CC(=O)c1cn(CC(=O)Nc2ccc(C)cc2C)c3ccccc13	BroadT	BRD-K77614806	BRD-K77614806-001-06-4	Asinex Ltd.	BAS 07203285			CC(=O)c1cn(CC(=O)Nc2ccc(C)cc2C)c2ccccc12	InChI=1S/C20H20N2O2/c1-13-8-9-18(14(2)10-13)21-20(24)12-22-11-17(15(3)23)16-6-4-5-7-19(16)22/h4-11H,12H2,1-3H3,(H,21,24)	AHJRAELVJNWEIP-UHFFFAOYSA-N	320.1524779							113121
AC1LIQYS	LSM-24532	BRD-K14201981	909731	InChI=1S/C14H18N2O2/c1-10-4-6-11(7-5-10)15-16-12-9-18-14(2,3)8-13(12)17/h4-7,15H,8-9H2,1-3H3	NJKOKKQZGZQPAS-UHFFFAOYSA-N	Cc1ccc(NN=C2COC(C)(C)CC2=O)cc1	BroadT	BRD-K14201981	BRD-K14201981-001-06-3	InterBioScreen Ltd.	STOCK1S-01008			Cc1ccc(NN=C2COC(C)(C)CC2=O)cc1	InChI=1S/C14H18N2O2/c1-10-4-6-11(7-5-10)15-16-12-9-18-14(2,3)8-13(12)17/h4-7,15H,8-9H2,1-3H3	NJKOKKQZGZQPAS-UHFFFAOYSA-N	246.136827836							113122
SMR000221005	LSM-44061	SID24791215, BRD-K36726628	2040126	InChI=1S/C20H19N3O4S3/c1-14-7-9-15(10-8-14)13-17-19(25)23(20(28)29-17)12-11-18(24)21-22-30(26,27)16-5-3-2-4-6-16/h2-10,13,22H,11-12H2,1H3,(H,21,24)/b17-13-	QTWLGPMQGKOXPQ-LGMDPLHJSA-N	Cc1ccc(\C=C\2/SC(=S)N(CCC(=O)NNS(=O)(=O)c3ccccc3)C2=O)cc1	BroadT	BRD-K36726628	BRD-K36726628-001-05-4	InterBioScreen Ltd.	STOCK5S-26729			Cc1ccc(cc1)\C=C1/SC(=S)N(CCC(=O)NNS(=O)(=O)c2ccccc2)C1=O	InChI=1S/C20H19N3O4S3/c1-14-7-9-15(10-8-14)13-17-19(25)23(20(28)29-17)12-11-18(24)21-22-30(26,27)16-5-3-2-4-6-16/h2-10,13,22H,11-12H2,1H3,(H,21,24)/b17-13-	QTWLGPMQGKOXPQ-LGMDPLHJSA-N	461.053768188							
F1105-0173	LSM-24534	SID24824220, BRD-K40361425	3612019	InChI=1S/C13H7ClN2O3S/c14-10-4-3-9(20-10)13(19)15-6-1-2-7-8(5-6)12(18)16-11(7)17/h1-5H,(H,15,19)(H,16,17,18)	PIPQIFNHBHQVEK-UHFFFAOYSA-N	Clc1ccc(s1)C(=O)Nc2ccc3C(=O)NC(=O)c3c2	BroadT	BRD-K40361425	BRD-K40361425-001-05-9	Life Chemicals Inc.	F1105-0173			Clc1ccc(s1)C(=O)Nc1ccc2C(=O)NC(=O)c2c1	InChI=1S/C13H7ClN2O3S/c14-10-4-3-9(20-10)13(19)15-6-1-2-7-8(5-6)12(18)16-11(7)17/h1-5H,(H,15,19)(H,16,17,18)	PIPQIFNHBHQVEK-UHFFFAOYSA-N	305.986590504							113124
MLS000072521	LSM-24535	SID842405, BRD-K42284896	644672	InChI=1S/C23H28N4O3/c1-26(2)12-7-13-27(23(29)24-19-8-5-4-6-9-19)16-18-14-17-15-20(30-3)10-11-21(17)25-22(18)28/h4-6,8-11,14-15H,7,12-13,16H2,1-3H3,(H,24,29)(H,25,28)	LOIMLXAZXSZWCV-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(CCCN(C)C)C(=O)Nc3ccccc3)cc2c1	BroadT	BRD-K42284896	BRD-K42284896-001-05-1	Asinex Ltd.	ASN 05112823			COc1ccc2nc(O)c(CN(CCCN(C)C)C(=O)Nc3ccccc3)cc2c1	InChI=1S/C23H28N4O3/c1-26(2)12-7-13-27(23(29)24-19-8-5-4-6-9-19)16-18-14-17-15-20(30-3)10-11-21(17)25-22(18)28/h4-6,8-11,14-15H,7,12-13,16H2,1-3H3,(H,24,29)(H,25,28)	LOIMLXAZXSZWCV-UHFFFAOYSA-N	408.216140796							113125
AC1METB4	LSM-24536	SID24810966, BRD-K21978680	2883704	InChI=1S/C14H14N2O5/c1-18-10-6-5-9(8-12(10)19-2)13(15)16-21-14(17)11-4-3-7-20-11/h3-8H,1-2H3,(H2,15,16)	OILWHTSKENRXNL-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=N)NOC(=O)c2occc2	BroadT	BRD-K21978680	BRD-K21978680-001-05-3	ChemDiv Inc.	4335-1224			COc1ccc(cc1OC)C(=N)NOC(=O)c1ccco1	InChI=1S/C14H14N2O5/c1-18-10-6-5-9(8-12(10)19-2)13(15)16-21-14(17)11-4-3-7-20-11/h3-8H,1-2H3,(H2,15,16)	OILWHTSKENRXNL-UHFFFAOYSA-N	290.090271568							113126
3-Ethoxy-n-(pyridin-3-ylcarbamothioyl)benzamide	LSM-24537	SID17506931, BRD-K70123912	835033	InChI=1S/C15H15N3O2S/c1-2-20-13-7-3-5-11(9-13)14(19)18-15(21)17-12-6-4-8-16-10-12/h3-10H,2H2,1H3,(H2,17,18,19,21)	YYINQBNHSBGTBR-UHFFFAOYSA-N	CCOc1cccc(c1)C(=O)NC(=S)Nc2cccnc2	BroadT	BRD-K70123912	BRD-K70123912-001-05-6	ChemBridge Corporation	6550821			CCOc1cccc(c1)C(=O)NC(=S)Nc1cccnc1	InChI=1S/C15H15N3O2S/c1-2-20-13-7-3-5-11(9-13)14(19)18-15(21)17-12-6-4-8-16-10-12/h3-10H,2H2,1H3,(H2,17,18,19,21)	YYINQBNHSBGTBR-UHFFFAOYSA-N	301.08849744							113127
AC1MITDB	LSM-24538	BRD-K57737143	3101276	InChI=1S/C17H18N4O2/c1-12-6-8-14(9-7-12)17(23)21-20-13(2)11-16(22)19-15-5-3-4-10-18-15/h3-10H,11H2,1-2H3,(H,21,23)(H,18,19,22)	VJUWYHDXCCBIJU-UHFFFAOYSA-N	CC(=NNC(=O)c1ccc(C)cc1)CC(=O)Nc2ccccn2	BroadT	BRD-K57737143	BRD-K57737143-001-06-9	Asinex Ltd.	BAS 00341968			CC(CC(=O)Nc1ccccn1)=NNC(=O)c1ccc(C)cc1	InChI=1S/C17H18N4O2/c1-12-6-8-14(9-7-12)17(23)21-20-13(2)11-16(22)19-15-5-3-4-10-18-15/h3-10H,11H2,1-2H3,(H,21,23)(H,18,19,22)	VJUWYHDXCCBIJU-UHFFFAOYSA-N	310.142975856							113128
MLS000532428	LSM-44062	SID14740318, BRD-K28167567	5338999	InChI=1S/C14H18N2O/c1-14(2)9-10-6-4-5-7-11(10)12(16-14)8-13(17)15-3/h4-8,16H,9H2,1-3H3,(H,15,17)/b12-8-	JOHLXSYQNOBEBL-WQLSENKSSA-N	CNC(=O)\C=C\1/NC(C)(C)Cc2ccccc12	BroadT	BRD-K28167567	BRD-K28167567-001-05-4	ChemBridge Corporation	5349804			CNC(=O)\C=C1/NC(C)(C)Cc2ccccc12	InChI=1S/C14H18N2O/c1-14(2)9-10-6-4-5-7-11(10)12(16-14)8-13(17)15-3/h4-8,16H,9H2,1-3H3,(H,15,17)/b12-8-	JOHLXSYQNOBEBL-WQLSENKSSA-N	230.141913216							
MLS001175659	LSM-24540	SID49680840, BRD-K40339156	4799115	InChI=1S/C15H10F2N4OS/c16-9-4-5-11(10(17)7-9)19-14(22)21-15-20-13(8-23-15)12-3-1-2-6-18-12/h1-8H,(H2,19,20,21,22)	LGGVJHCTAUPYSX-UHFFFAOYSA-N	Fc1ccc(NC(=O)Nc2nc(cs2)c3ccccn3)c(F)c1	BroadT	BRD-K40339156	BRD-K40339156-001-08-4	Enamine Ltd.	T5392618			Fc1ccc(NC(=O)Nc2nc(cs2)-c2ccccn2)c(F)c1	InChI=1S/C15H10F2N4OS/c16-9-4-5-11(10(17)7-9)19-14(22)21-15-20-13(8-23-15)12-3-1-2-6-18-12/h1-8H,(H2,19,20,21,22)	LGGVJHCTAUPYSX-UHFFFAOYSA-N	332.05433807							113130
AC1LHUTB	LSM-24541	BRD-K02298257	869580	InChI=1S/C15H12ClN3OS/c1-19-8-4-5-10(19)9-17-18-15(20)14-13(16)11-6-2-3-7-12(11)21-14/h2-9H,1H3,(H,18,20)	NTDQXUAJFQMTIU-UHFFFAOYSA-N	Cn1cccc1C=NNC(=O)c2sc3ccccc3c2Cl	BroadT	BRD-K02298257	BRD-K02298257-001-05-2	ChemBridge Corporation	5745672			Cn1cccc1C=NNC(=O)c1sc2ccccc2c1Cl	InChI=1S/C15H12ClN3OS/c1-19-8-4-5-10(19)9-17-18-15(20)14-13(16)11-6-2-3-7-12(11)21-14/h2-9H,1H3,(H,18,20)	NTDQXUAJFQMTIU-UHFFFAOYSA-N	317.038960434							113131
1-(Phenylsulfonyl)-1H-benzimidazol-2-amine	LSM-3335	BRD-K59840856, SID85248361, SID99495606	3025920	InChI=1S/C13H11N3O2S/c14-13-15-11-8-4-5-9-12(11)16(13)19(17,18)10-6-2-1-3-7-10/h1-9H,(H2,14,15)	KNZWBHGWTXXRTB-UHFFFAOYSA-N	Nc1nc2ccccc2n1S(=O)(=O)c3ccccc3	BroadT	BRD-K59840856	BRD-K59840856-001-01-7	Sanford-Burnham Medical Research Institute	173374-91-9 MLS-0425615			Nc1nc2ccccc2n1S(=O)(=O)c1ccccc1	InChI=1S/C13H11N3O2S/c14-13-15-11-8-4-5-9-12(11)16(13)19(17,18)10-6-2-1-3-7-10/h1-9H,(H2,14,15)	KNZWBHGWTXXRTB-UHFFFAOYSA-N	273.057197312							93052
MLS000882751	LSM-24542	SID26732356, BRD-K90252855	16060491	InChI=1S/C31H34N2O2/c1-31-19-9-8-12-27(31)29(33(30(31)34)21-22-10-6-5-7-11-22)26-20-24(15-18-28(26)35-4)23-13-16-25(17-14-23)32(2)3/h5-8,10-18,20,27,29H,9,19,21H2,1-4H3/t27-,29-,31+/m0/s1	ZWRXWRJMTZOPCG-DEDOGFMKSA-N	COc1ccc(cc1[C@H]2[C@@H]3C=CCC[C@@]3(C)C(=O)N2Cc4ccccc4)c5ccc(cc5)N(C)C	BroadT	BRD-K90252855	BRD-K90252855-001-05-8	University of Kansas CMLD	KUC101261N			COc1ccc(cc1[C@H]1[C@@H]2C=CCC[C@@]2(C)C(=O)N1Cc1ccccc1)-c1ccc(cc1)N(C)C	InChI=1S/C31H34N2O2/c1-31-19-9-8-12-27(31)29(33(30(31)34)21-22-10-6-5-7-11-22)26-20-24(15-18-28(26)35-4)23-13-16-25(17-14-23)32(2)3/h5-8,10-18,20,27,29H,9,19,21H2,1-4H3/t27-,29-,31+/m0/s1	ZWRXWRJMTZOPCG-DEDOGFMKSA-N	466.262028348							
OPREA1_573610	LSM-24543	BRD-A06605029	5195100	InChI=1S/C29H24N2O4S/c1-34-20-11-13-24(35-2)23(16-20)27-22-12-10-18-7-3-4-9-21(18)26(22)30-29-31(27)28(33)25(36-29)15-17-6-5-8-19(32)14-17/h3-9,11,13-16,27,32H,10,12H2,1-2H3	CLHCQUDCQDMFRG-UHFFFAOYSA-N	COc1ccc(OC)c(c1)C2N3C(=NC4=C2CCc5ccccc45)SC(=Cc6cccc(O)c6)C3=O	BroadT	BRD-A06605029	BRD-A06605029-001-05-3	InterBioScreen Ltd.	STOCK4S-53905			COc1ccc(OC)c(c1)C1C2=C(N=c3sc(=Cc4cccc(O)c4)c(=O)n13)c1ccccc1CC2	InChI=1S/C29H24N2O4S/c1-34-20-11-13-24(35-2)23(16-20)27-22-12-10-18-7-3-4-9-21(18)26(22)30-29-31(27)28(33)25(36-29)15-17-6-5-8-19(32)14-17/h3-9,11,13-16,27,32H,10,12H2,1-2H3	CLHCQUDCQDMFRG-UHFFFAOYSA-N	496.145677958							113132
AC1LOLQS	LSM-24544	SID17415918, BRD-K33893860	1242397	InChI=1S/C18H20N2O3S/c1-22-15-10-14(11-16(12-15)23-2)17(21)20-18(24)19-9-8-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3,(H2,19,20,21,24)	HOFANOOJUWSYHI-UHFFFAOYSA-N	COc1cc(OC)cc(c1)C(=O)NC(=S)NCCc2ccccc2	BroadT	BRD-K33893860	BRD-K33893860-001-05-2	ChemBridge Corporation	7910251			COc1cc(OC)cc(c1)C(=O)NC(=S)NCCc1ccccc1	InChI=1S/C18H20N2O3S/c1-22-15-10-14(11-16(12-15)23-2)17(21)20-18(24)19-9-8-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3,(H2,19,20,21,24)	HOFANOOJUWSYHI-UHFFFAOYSA-N	344.11946321							113133
AC1LNRVW	LSM-24545	BRD-K12028308	1226467	InChI=1S/C24H21N3O4/c1-15(22-9-6-12-31-22)26-27-24(28)19-14-21(25-20-8-5-4-7-17(19)20)18-11-10-16(29-2)13-23(18)30-3/h4-14H,1-3H3,(H,27,28)	OZFXSCQWJJTUKH-UHFFFAOYSA-N	COc1ccc(c(OC)c1)c2cc(C(=O)NN=C(C)c3occc3)c4ccccc4n2	BroadT	BRD-K12028308	BRD-K12028308-001-07-6	Specs	AK-968/41025709			COc1ccc(c(OC)c1)-c1cc(C(=O)NN=C(C)c2ccco2)c2ccccc2n1	InChI=1S/C24H21N3O4/c1-15(22-9-6-12-31-22)26-27-24(28)19-14-21(25-20-8-5-4-7-17(19)20)18-11-10-16(29-2)13-23(18)30-3/h4-14H,1-3H3,(H,27,28)	OZFXSCQWJJTUKH-UHFFFAOYSA-N	415.153206182							113134
2-Oxo-4,6-di(2-thienyl)-1,2-dihydro-3-pyridinecarbonitrile	LSM-24546	SID26731499, BRD-K58364829	2816326	InChI=1S/C14H8N2OS2/c15-8-10-9(12-3-1-5-18-12)7-11(16-14(10)17)13-4-2-6-19-13/h1-7H,(H,16,17)	PZUIIRHHOWQYKG-UHFFFAOYSA-N	Oc1nc(cc(c2cccs2)c1C#N)c3cccs3	BroadT	BRD-K58364829	BRD-K58364829-001-05-4	Maybridge	HTS 12392			Oc1nc(cc(-c2cccs2)c1C#N)-c1cccs1	InChI=1S/C14H8N2OS2/c15-8-10-9(12-3-1-5-18-12)7-11(16-14(10)17)13-4-2-6-19-13/h1-7H,(H,16,17)	PZUIIRHHOWQYKG-UHFFFAOYSA-N	284.007804276							113135
MLS000678229	LSM-24547	SID24817501, BRD-K42532308	1454354	InChI=1S/C23H22N4O2/c1-16-5-3-4-6-20(16)23(28)27-11-9-26(10-12-27)22-18(15-24)13-17-7-8-19(29-2)14-21(17)25-22/h3-8,13-14H,9-12H2,1-2H3	ACCCNIRLLPIOTR-UHFFFAOYSA-N	COc1ccc2cc(C#N)c(nc2c1)N3CCN(CC3)C(=O)c4ccccc4C	BroadT	BRD-K42532308	BRD-K42532308-001-07-1	Asinex Ltd.	ASN 05815380			COc1ccc2cc(C#N)c(nc2c1)N1CCN(CC1)C(=O)c1ccccc1C	InChI=1S/C23H22N4O2/c1-16-5-3-4-6-20(16)23(28)27-11-9-26(10-12-27)22-18(15-24)13-17-7-8-19(29-2)14-21(17)25-22/h3-8,13-14H,9-12H2,1-2H3	ACCCNIRLLPIOTR-UHFFFAOYSA-N	386.174275984							113136
3-Chloro-n-(2-methyl-3-oxo-2,3-dihydro-1,2,4-thiadiazol-5-yl)benzenecarboxamide	LSM-24548	SID17410260, BRD-K25592587	1486941	InChI=1S/C10H8ClN3O2S/c1-14-10(16)13-9(17-14)12-8(15)6-3-2-4-7(11)5-6/h2-5H,1H3,(H,12,13,15,16)	QSVODSMJXQAITH-UHFFFAOYSA-N	CN1SC(=NC1=O)NC(=O)c2cccc(Cl)c2	BroadT	BRD-K25592587	BRD-K25592587-001-06-0	Key Organics Ltd.	12F-949			Cn1sc(NC(=O)c2cccc(Cl)c2)nc1=O	InChI=1S/C10H8ClN3O2S/c1-14-10(16)13-9(17-14)12-8(15)6-3-2-4-7(11)5-6/h2-5H,1H3,(H,12,13,15,16)	QSVODSMJXQAITH-UHFFFAOYSA-N	269.002574926							113137
MLS001105899	LSM-24549	SID49721114, BRD-A94710920	24791616	InChI=1S/C22H26N4O2/c1-16-23-13-20(25(16)2)15-26-11-3-5-18(14-26)22(27)24-19-9-7-17(8-10-19)21-6-4-12-28-21/h4,6-10,12-13,18H,3,5,11,14-15H2,1-2H3,(H,24,27)	DGDWQPIGZFEVLM-UHFFFAOYSA-N	Cc1ncc(CN2CCCC(C2)C(=O)Nc3ccc(cc3)c4occc4)n1C	BroadT	BRD-A94710920	BRD-A94710920-001-05-4	ChemBridge Corporation	37540128			Cc1ncc(CN2CCCC(C2)C(=O)Nc2ccc(cc2)-c2ccco2)n1C	InChI=1S/C22H26N4O2/c1-16-23-13-20(25(16)2)15-26-11-3-5-18(14-26)22(27)24-19-9-7-17(8-10-19)21-6-4-12-28-21/h4,6-10,12-13,18H,3,5,11,14-15H2,1-2H3,(H,24,27)	DGDWQPIGZFEVLM-UHFFFAOYSA-N	378.205576112							113138
AC1LDMC1	LSM-24550	BRD-K62804744	621316	InChI=1S/C13H12N2O2S/c1-9(12-7-4-8-18-12)14-15-11-6-3-2-5-10(11)13(16)17/h2-8,15H,1H3,(H,16,17)	PVYNOWWRJCXAPI-UHFFFAOYSA-N	CC(=NNc1ccccc1C(=O)O)c2cccs2	BroadT	BRD-K62804744	BRD-K62804744-001-06-3	ChemBridge Corporation	5476924			CC(=NNc1ccccc1C(O)=O)c1cccs1	InChI=1S/C13H12N2O2S/c1-9(12-7-4-8-18-12)14-15-11-6-3-2-5-10(11)13(16)17/h2-8,15H,1H3,(H,16,17)	PVYNOWWRJCXAPI-UHFFFAOYSA-N	260.061948334							113139
T5323082	LSM-24551	BRD-K13164804, SID14744321	2558673	InChI=1S/C22H26N4O3S/c1-15(2)20(21-23-18-10-3-4-11-19(18)24-21)25-22(27)16-8-7-9-17(14-16)30(28,29)26-12-5-6-13-26/h3-4,7-11,14-15,20H,5-6,12-13H2,1-2H3,(H,23,24)(H,25,27)/t20-/m0/s1	LINSNJWZVMEBRR-FQEVSTJZSA-N	CC(C)[C@H](NC(=O)c1cccc(c1)S(=O)(=O)N2CCCC2)c3nc4ccccc4[nH]3	BroadT	BRD-K13164804	BRD-K13164804-001-05-1	Enamine Ltd.	T5323082			CC(C)[C@H](NC(=O)c1cccc(c1)S(=O)(=O)N1CCCC1)c1nc2ccccc2[nH]1	InChI=1S/C22H26N4O3S/c1-15(2)20(21-23-18-10-3-4-11-19(18)24-21)25-22(27)16-8-7-9-17(14-16)30(28,29)26-12-5-6-13-26/h3-4,7-11,14-15,20H,5-6,12-13H2,1-2H3,(H,23,24)(H,25,27)/t20-/m0/s1	LINSNJWZVMEBRR-FQEVSTJZSA-N	426.172561422							113140
MLS-0237142.0001	LSM-24552	SID24812145, SID87544806, BRD-K71651669	4112347	InChI=1S/C18H16FN3OS2/c1-10-7-8-12(9-11(10)2)22-16(20)15(25-18(22)24)17(23)21-14-6-4-3-5-13(14)19/h3-9H,20H2,1-2H3,(H,21,23)	VNEBZIGPFRXJHY-UHFFFAOYSA-N	Cc1ccc(cc1C)N2C(=S)SC(=C2N)C(=O)Nc3ccccc3F	BroadT	BRD-K71651669	BRD-K71651669-001-05-0	ChemDiv Inc.	K286-3257			Cc1ccc(cc1C)-n1c(N)c(sc1=S)C(=O)Nc1ccccc1F	InChI=1S/C18H16FN3OS2/c1-10-7-8-12(9-11(10)2)22-16(20)15(25-18(22)24)17(23)21-14-6-4-3-5-13(14)19/h3-9H,20H2,1-2H3,(H,21,23)	VNEBZIGPFRXJHY-UHFFFAOYSA-N	373.071881742							113141
AC1NCLYY	LSM-24553	BRD-K51169535	4561015	InChI=1S/C19H14N2O2/c1-22-17-9-7-14(8-10-17)13-21-19-16(12-20)11-18(23-19)15-5-3-2-4-6-15/h2-11,13H,1H3	OMFMROYPCSSRPV-UHFFFAOYSA-N	COc1ccc(C=Nc2oc(cc2C#N)c3ccccc3)cc1	BroadT	BRD-K51169535	BRD-K51169535-001-05-9	Key Organics Ltd.	3P-584S			COc1ccc(C=Nc2oc(cc2C#N)-c2ccccc2)cc1	InChI=1S/C19H14N2O2/c1-22-17-9-7-14(8-10-17)13-21-19-16(12-20)11-18(23-19)15-5-3-2-4-6-15/h2-11,13H,1H3	OMFMROYPCSSRPV-UHFFFAOYSA-N	302.105527708							113142
SMR000061116	LSM-24554	SID3716234, BRD-A74920896	2999527	InChI=1S/C12H15FN2O2S/c13-9-5-6-10-11(8-9)18(16,17)14-12-4-2-1-3-7-15(10)12/h5-6,8,12,14H,1-4,7H2	YUXMECOUFJYJTQ-UHFFFAOYSA-N	Fc1ccc2N3CCCCCC3NS(=O)(=O)c2c1	BroadT	BRD-A74920896	BRD-A74920896-001-05-3	Enamine Ltd.	T0507-8454			Fc1ccc2N3CCCCCC3NS(=O)(=O)c2c1	InChI=1S/C12H15FN2O2S/c13-9-5-6-10-11(8-9)18(16,17)14-12-4-2-1-3-7-15(10)12/h5-6,8,12,14H,1-4,7H2	YUXMECOUFJYJTQ-UHFFFAOYSA-N	270.08382663							113143
MLS000100934	LSM-24555	SID7970530, BRD-K11295210	5128077	InChI=1S/C21H23N3OS/c1-22-15-20(18-9-5-6-10-19(18)22)26-16-21(25)24-13-11-23(12-14-24)17-7-3-2-4-8-17/h2-10,15H,11-14,16H2,1H3	UWICPNUYLJPKJF-UHFFFAOYSA-N	Cn1cc(SCC(=O)N2CCN(CC2)c3ccccc3)c4ccccc14	BroadT	BRD-K11295210	BRD-K11295210-001-05-3	Life Chemicals Inc.	F0545-0777			Cn1cc(SCC(=O)N2CCN(CC2)c2ccccc2)c2ccccc12	InChI=1S/C21H23N3OS/c1-22-15-20(18-9-5-6-10-19(18)22)26-16-21(25)24-13-11-23(12-14-24)17-7-3-2-4-8-17/h2-10,15H,11-14,16H2,1H3	UWICPNUYLJPKJF-UHFFFAOYSA-N	365.156183076							113144
2-Amino-4-(5-bromothiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile	LSM-24556	SID22401858, BRD-K62412099	3771272	InChI=1S/C14H12BrN3S/c15-12-6-5-11(19-12)13-8-3-1-2-4-10(8)18-14(17)9(13)7-16/h5-6H,1-4H2,(H2,17,18)	NNOXETWBPUKXET-UHFFFAOYSA-N	Nc1nc2CCCCc2c(c3ccc(Br)s3)c1C#N	BroadT	BRD-K62412099	BRD-K62412099-001-06-6	InterBioScreen Ltd.	STOCK5S-13583			Nc1nc2CCCCc2c(-c2ccc(Br)s2)c1C#N	InChI=1S/C14H12BrN3S/c15-12-6-5-11(19-12)13-8-3-1-2-4-10(8)18-14(17)9(13)7-16/h5-6H,1-4H2,(H2,17,18)	NNOXETWBPUKXET-UHFFFAOYSA-N	332.993530704							113145
MLS001003993	LSM-24557	SID24828284, BRD-A30875003	3685837	InChI=1S/C19H29N3OS/c1-5-16-9-11-17(12-10-16)23-13-18-20-21-19(24)22(18)15(4)8-6-7-14(2)3/h9-12,14-15H,5-8,13H2,1-4H3,(H,21,24)	GCWFBJNERWTBLJ-UHFFFAOYSA-N	CCc1ccc(OCc2nnc(S)n2C(C)CCCC(C)C)cc1	BroadT	BRD-A30875003	BRD-A30875003-001-05-2	Enamine Ltd.	T0510-3429			CCc1ccc(OCc2nnc(S)n2C(C)CCCC(C)C)cc1	InChI=1S/C19H29N3OS/c1-5-16-9-11-17(12-10-16)23-13-18-20-21-19(24)22(18)15(4)8-6-7-14(2)3/h9-12,14-15H,5-8,13H2,1-4H3,(H,21,24)	GCWFBJNERWTBLJ-UHFFFAOYSA-N	347.203133268							113146
2-(3-Benzyl-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl)-n-(5-methylisoxazol-3-yl)acetamide	LSM-24558	SID4251110, BRD-K83247518	3244838	InChI=1S/C21H18N4O4/c1-14-11-18(23-29-14)22-19(26)13-24-17-10-6-5-9-16(17)20(27)25(21(24)28)12-15-7-3-2-4-8-15/h2-11H,12-13H2,1H3,(H,22,23,26)	HSYYMTSXZFJKBQ-UHFFFAOYSA-N	Cc1onc(NC(=O)CN2C(=O)N(Cc3ccccc3)C(=O)c4ccccc24)c1	BroadT	BRD-K83247518	BRD-K83247518-001-06-4	ChemDiv Inc.	C200-0641			Cc1cc(NC(=O)Cn2c3ccccc3c(=O)n(Cc3ccccc3)c2=O)no1	InChI=1S/C21H18N4O4/c1-14-11-18(23-29-14)22-19(26)13-24-17-10-6-5-9-16(17)20(27)25(21(24)28)12-15-7-3-2-4-8-15/h2-11H,12-13H2,1H3,(H,22,23,26)	HSYYMTSXZFJKBQ-UHFFFAOYSA-N	390.132805096							113147
MLS000673370	LSM-24559	SID24823713, BRD-K61523169	4601866	InChI=1S/C22H25BrN4O4S2/c23-16-7-10-19-18(14-16)21(29)27(22(32)26-19)13-3-1-2-4-20(28)25-12-11-15-5-8-17(9-6-15)33(24,30)31/h5-10,14H,1-4,11-13H2,(H,25,28)(H,26,32)(H2,24,30,31)	SUMKOABHQLFZSE-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(CCNC(=O)CCCCCN2C(=S)Nc3ccc(Br)cc3C2=O)cc1	BroadT	BRD-K61523169	BRD-K61523169-001-06-6	ChemDiv Inc.	K284-4141			NS(=O)(=O)c1ccc(CCNC(=O)CCCCCn2c(=S)[nH]c3ccc(Br)cc3c2=O)cc1	InChI=1S/C22H25BrN4O4S2/c23-16-7-10-19-18(14-16)21(29)27(22(32)26-19)13-3-1-2-4-20(28)25-12-11-15-5-8-17(9-6-15)33(24,30)31/h5-10,14H,1-4,11-13H2,(H,25,28)(H,26,32)(H2,24,30,31)	SUMKOABHQLFZSE-UHFFFAOYSA-N	552.0500593							113148
MLS000711038	LSM-24560	SID24780759, BRD-K18470715	767069	InChI=1S/C11H10N2O3/c1-6(14)13-10-9(12)7-4-2-3-5-8(7)16-11(10)15/h2-5H,12H2,1H3,(H,13,14)	UIABPEUVYSIEAK-UHFFFAOYSA-N	CC(=O)NC1=C(N)c2ccccc2OC1=O	BroadT	BRD-K18470715	BRD-K18470715-001-08-9	Asinex Ltd.	BAS 01052344			CC(=O)Nc1c(N)c2ccccc2oc1=O	InChI=1S/C11H10N2O3/c1-6(14)13-10-9(12)7-4-2-3-5-8(7)16-11(10)15/h2-5H,12H2,1H3,(H,13,14)	UIABPEUVYSIEAK-UHFFFAOYSA-N	218.0691422							113149
STK285715	LSM-44063	SID22405910, BRD-K37749794	5786987	InChI=1S/C26H21N3O2/c1-17(2)28-23-15-9-7-12-19(23)21(26(28)31)16-24-27-22-14-8-6-13-20(22)25(30)29(24)18-10-4-3-5-11-18/h3-17H,1-2H3/b21-16-	JQVDKZGPMNGDQC-PGMHBOJBSA-N	CC(C)N1C(=O)\C(=C/C2=Nc3ccccc3C(=O)N2c4ccccc4)\c5ccccc15	BroadT	BRD-K37749794	BRD-K37749794-001-07-9	ChemDiv Inc.	4649-0146			CC(C)N1C(=O)\C(=C/c2nc3ccccc3c(=O)n2-c2ccccc2)c2ccccc12	InChI=1S/C26H21N3O2/c1-17(2)28-23-15-9-7-12-19(23)21(26(28)31)16-24-27-22-14-8-6-13-20(22)25(30)29(24)18-10-4-3-5-11-18/h3-17H,1-2H3/b21-16-	JQVDKZGPMNGDQC-PGMHBOJBSA-N	407.163376942							
MLS000697082	LSM-24562	BRD-K51528467	4625720	InChI=1S/C20H16ClN3O5S3/c1-2-29-16(25)10-24-13-8-7-11(32(22,27)28)9-15(13)31-20(24)23-19(26)18-17(21)12-5-3-4-6-14(12)30-18/h3-9H,2,10H2,1H3,(H2,22,27,28)	PFUIZHAZQWAOBU-UHFFFAOYSA-N	CCOC(=O)CN1C(=NC(=O)c2sc3ccccc3c2Cl)Sc4cc(ccc14)S(=O)(=O)N	BroadT	BRD-K51528467	BRD-K51528467-001-07-4	Life Chemicals Inc.	F1366-2956			CCOC(=O)Cn1c2ccc(cc2sc1=NC(=O)c1sc2ccccc2c1Cl)S(N)(=O)=O	InChI=1S/C20H16ClN3O5S3/c1-2-29-16(25)10-24-13-8-7-11(32(22,27)28)9-15(13)31-20(24)23-19(26)18-17(21)12-5-3-4-6-14(12)30-18/h3-9H,2,10H2,1H3,(H2,22,27,28)	PFUIZHAZQWAOBU-UHFFFAOYSA-N	508.994060422							113151
MLS000762841	LSM-44064	SID26725655, BRD-K87636957	6356364	InChI=1S/C24H21N3O4/c1-15-7-6-10-22(26-15)27-23(28)18-9-5-4-8-17(18)19(24(27)29)14-25-20-12-11-16(30-2)13-21(20)31-3/h4-14,25H,1-3H3/b19-14+	BBEMKVFAEGRKLG-XMHGGMMESA-N	COc1ccc(N\C=C/2\C(=O)N(C(=O)c3ccccc23)c4cccc(C)n4)c(OC)c1	BroadT	BRD-K87636957	BRD-K87636957-001-07-0	InterBioScreen Ltd.	STOCK5S-48577			COc1ccc(N\C=C2\C(=O)N(C(=O)c3ccccc23)c2cccc(C)n2)c(OC)c1	InChI=1S/C24H21N3O4/c1-15-7-6-10-22(26-15)27-23(28)18-9-5-4-8-17(18)19(24(27)29)14-25-20-12-11-16(30-2)13-21(20)31-3/h4-14,25H,1-3H3/b19-14+	BBEMKVFAEGRKLG-XMHGGMMESA-N	415.153206182							
N-(3-Hydroxyphenyl)-5-methylfuran-3-carboxamide	LSM-24564	SID7978023, BRD-K04592097	877422	InChI=1S/C12H11NO3/c1-8-5-9(7-16-8)12(15)13-10-3-2-4-11(14)6-10/h2-7,14H,1H3,(H,13,15)	KOHYRMHFQJXHDI-UHFFFAOYSA-N	Cc1occ(c1)C(=O)Nc2cccc(O)c2	BroadT	BRD-K04592097	BRD-K04592097-001-05-0	ChemBridge Corporation	5927591			Cc1cc(co1)C(=O)Nc1cccc(O)c1	InChI=1S/C12H11NO3/c1-8-5-9(7-16-8)12(15)13-10-3-2-4-11(14)6-10/h2-7,14H,1H3,(H,13,15)	KOHYRMHFQJXHDI-UHFFFAOYSA-N	217.073893222							113153
AC1NDNIQ	LSM-24565	BRD-K15893783	4604045	InChI=1S/C16H17N3O/c1-12(13-8-9-13)17-18-16(20)14-6-2-3-7-15(14)19-10-4-5-11-19/h2-7,10-11,13H,8-9H2,1H3,(H,18,20)	YXEVSBWBJAPPMZ-UHFFFAOYSA-N	CC(=NNC(=O)c1ccccc1n2cccc2)C3CC3	BroadT	BRD-K15893783	BRD-K15893783-001-05-8	Enamine Ltd.	T0506-7343			CC(=NNC(=O)c1ccccc1-n1cccc1)C1CC1	InChI=1S/C16H17N3O/c1-12(13-8-9-13)17-18-16(20)14-6-2-3-7-15(14)19-10-4-5-11-19/h2-7,10-11,13H,8-9H2,1H3,(H,18,20)	YXEVSBWBJAPPMZ-UHFFFAOYSA-N	267.137162194							113154
N-(2,4-Difluorophenyl)-n'-[(5-methyl-3-phenyl-4-isoxazolyl)methyl]urea	LSM-24566	SID26730849, BRD-K89917778	2738198	InChI=1S/C18H15F2N3O2/c1-11-14(17(23-25-11)12-5-3-2-4-6-12)10-21-18(24)22-16-8-7-13(19)9-15(16)20/h2-9H,10H2,1H3,(H2,21,22,24)	FTWYUWCJVZUUIE-UHFFFAOYSA-N	Cc1onc(c1CNC(=O)Nc2ccc(F)cc2F)c3ccccc3	BroadT	BRD-K89917778	BRD-K89917778-001-05-3	Maybridge	SCR 00089			Cc1onc(c1CNC(=O)Nc1ccc(F)cc1F)-c1ccccc1	InChI=1S/C18H15F2N3O2/c1-11-14(17(23-25-11)12-5-3-2-4-6-12)10-21-18(24)22-16-8-7-13(19)9-15(16)20/h2-9H,10H2,1H3,(H2,21,22,24)	FTWYUWCJVZUUIE-UHFFFAOYSA-N	343.11323315							113155
AC1LQJYX	LSM-24567	BRD-K82532719	1402088	InChI=1S/C26H22N6O5/c1-30-22-21(23(33)31(2)26(30)35)32(16-18-7-4-3-5-8-18)25(28-22)29-27-15-17-10-12-19(13-11-17)37-24(34)20-9-6-14-36-20/h3-15H,16H2,1-2H3,(H,28,29)	GSRCZINUQSKFQB-UHFFFAOYSA-N	CN1C(=O)N(C)c2nc(NN=Cc3ccc(OC(=O)c4occc4)cc3)n(Cc5ccccc5)c2C1=O	BroadT	BRD-K82532719	BRD-K82532719-001-05-9	InterBioScreen Ltd.	STOCK4S-10486			Cn1c2nc(NN=Cc3ccc(OC(=O)c4ccco4)cc3)n(Cc3ccccc3)c2c(=O)n(C)c1=O	InChI=1S/C26H22N6O5/c1-30-22-21(23(33)31(2)26(30)35)32(16-18-7-4-3-5-8-18)25(28-22)29-27-15-17-10-12-19(13-11-17)37-24(34)20-9-6-14-36-20/h3-15H,16H2,1-2H3,(H,28,29)	GSRCZINUQSKFQB-UHFFFAOYSA-N	498.165167864							113156
2-(4-Methylpiperazin-1-yl)aniline	LSM-24568	SID14726863, BRD-K30128259	286547	InChI=1S/C11H17N3/c1-13-6-8-14(9-7-13)11-5-3-2-4-10(11)12/h2-5H,6-9,12H2,1H3	INWHDRNGZMHXEZ-UHFFFAOYSA-N	CN1CCN(CC1)c2ccccc2N	BroadT	BRD-K30128259	BRD-K30128259-001-05-5	Asinex Ltd.	BAS 09114112			CN1CCN(CC1)c1ccccc1N	InChI=1S/C11H17N3/c1-13-6-8-14(9-7-13)11-5-3-2-4-10(11)12/h2-5H,6-9,12H2,1H3	INWHDRNGZMHXEZ-UHFFFAOYSA-N	191.142247574							113157
[2-(4-Methoxy-phenoxy)-ethyl]-(5-morpholin-4-yl-2-nitro-phenyl)-amine	LSM-24569	SID17408804, BRD-K56414388	2854832	InChI=1S/C19H23N3O5/c1-25-16-3-5-17(6-4-16)27-11-8-20-18-14-15(2-7-19(18)22(23)24)21-9-12-26-13-10-21/h2-7,14,20H,8-13H2,1H3	YYYJTRHICSBNKZ-UHFFFAOYSA-N	COc1ccc(OCCNc2cc(ccc2[N+](=O)[O-])N3CCOCC3)cc1	BroadT	BRD-K56414388	BRD-K56414388-001-05-2	Asinex Ltd.	BAS 00547030			COc1ccc(OCCNc2cc(ccc2[N+]([O-])=O)N2CCOCC2)cc1	InChI=1S/C19H23N3O5/c1-25-16-3-5-17(6-4-16)27-11-8-20-18-14-15(2-7-19(18)22(23)24)21-9-12-26-13-10-21/h2-7,14,20H,8-13H2,1H3	YYYJTRHICSBNKZ-UHFFFAOYSA-N	373.163770866							113158
MLS000889870	LSM-24570	SID124897965, SID49734233, BRD-K70583488	24793509	InChI=1S/C26H35NOS/c1-20-10-13-23(14-11-20)29-24(21-8-6-5-7-9-21)17-19-27-18-16-22(26(2,3)4)12-15-25(27)28/h5-11,13-14,22,24H,12,15-19H2,1-4H3/t22-,24+/m1/s1	ZIWLVNLLFFCICD-VWNXMTODSA-N	Cc1ccc(S[C@@H](CCN2CC[C@@H](CCC2=O)C(C)(C)C)c3ccccc3)cc1	BroadT	BRD-K70583488	BRD-K70583488-001-06-3	University of Kansas	KUC102876N			Cc1ccc(S[C@@H](CCN2CC[C@@H](CCC2=O)C(C)(C)C)c2ccccc2)cc1	InChI=1S/C26H35NOS/c1-20-10-13-23(14-11-20)29-24(21-8-6-5-7-9-21)17-19-27-18-16-22(26(2,3)4)12-15-25(27)28/h5-11,13-14,22,24H,12,15-19H2,1-4H3/t22-,24+/m1/s1	ZIWLVNLLFFCICD-VWNXMTODSA-N	409.24393544							113159
F0682-1185	LSM-24571	SID4252215, BRD-A16491374	3245797	InChI=1S/C18H20N6O3S/c1-26-13-6-4-12(5-7-13)24-17-16(22-23-24)18(21-11-20-17)28-10-15(25)19-9-14-3-2-8-27-14/h4-7,11,14H,2-3,8-10H2,1H3,(H,19,25)	SDNGSRUNPKYHRP-UHFFFAOYSA-N	COc1ccc(cc1)n2nnc3c(SCC(=O)NCC4CCCO4)ncnc23	BroadT	BRD-A16491374	BRD-A16491374-001-04-0	ChemDiv Inc.	C910-1184			COc1ccc(cc1)-n1nnc2c(SCC(=O)NCC3CCCO3)ncnc12	InChI=1S/C18H20N6O3S/c1-26-13-6-4-12(5-7-13)24-17-16(22-23-24)18(21-11-20-17)28-10-15(25)19-9-14-3-2-8-27-14/h4-7,11,14H,2-3,8-10H2,1H3,(H,19,25)	SDNGSRUNPKYHRP-UHFFFAOYSA-N	400.13175925							113160
AC1NNY9J	LSM-24572	BRD-K76671338	5079148	InChI=1S/C15H14Cl2N6/c16-10-6-11(17)8-12(7-10)19-20-13(9-18)15-22-21-14-4-2-1-3-5-23(14)15/h6-8,19H,1-5H2	KTRRUWMJMNXPMQ-UHFFFAOYSA-N	Clc1cc(Cl)cc(NN=C(C#N)c2nnc3CCCCCn23)c1	BroadT	BRD-K76671338	BRD-K76671338-001-05-4	Enamine Ltd.	T0502-2606			Clc1cc(Cl)cc(NN=C(C#N)c2nnc3CCCCCn23)c1	InChI=1S/C15H14Cl2N6/c16-10-6-11(17)8-12(7-10)19-20-13(9-18)15-22-21-14-4-2-1-3-5-23(14)15/h6-8,19H,1-5H2	KTRRUWMJMNXPMQ-UHFFFAOYSA-N	348.065699928							113161
AC1M33RP	LSM-44065	SID7975963, BRD-K25864174	2230978	InChI=1S/C14H17NO3/c1-17-13-4-2-12(3-5-13)14(16)6-7-15-8-10-18-11-9-15/h2-7H,8-11H2,1H3/b7-6-	UBJDFKYEOFOQTO-SREVYHEPSA-N	COc1ccc(cc1)C(=O)\C=C/N2CCOCC2	BroadT	BRD-K25864174	BRD-K25864174-001-05-4	ChemBridge Corporation	5938404			COc1ccc(cc1)C(=O)\C=C/N1CCOCC1	InChI=1S/C14H17NO3/c1-17-13-4-2-12(3-5-13)14(16)6-7-15-8-10-18-11-9-15/h2-7H,8-11H2,1H3/b7-6-	UBJDFKYEOFOQTO-SREVYHEPSA-N	247.120843414							
AC1MG41Z	LSM-24574	SID24794801, BRD-A50454755	2980220	InChI=1S/C17H16ClN3O4S2/c1-25-12(22)8-10-15(23)19-6-7-21(10)17(26)20-16(24)14-13(18)9-4-2-3-5-11(9)27-14/h2-5,10H,6-8H2,1H3,(H,19,23)(H,20,24,26)	ADOLTVMTEATKJU-UHFFFAOYSA-N	COC(=O)CC1N(CCNC1=O)C(=S)NC(=O)c2sc3ccccc3c2Cl	BroadT	BRD-A50454755	BRD-A50454755-001-05-1	ChemBridge Corporation	7977923			COC(=O)CC1N(CCNC1=O)C(=S)NC(=O)c1sc2ccccc2c1Cl	InChI=1S/C17H16ClN3O4S2/c1-25-12(22)8-10-15(23)19-6-7-21(10)17(26)20-16(24)14-13(18)9-4-2-3-5-11(9)27-14/h2-5,10H,6-8H2,1H3,(H,19,23)(H,20,24,26)	ADOLTVMTEATKJU-UHFFFAOYSA-N	425.027075112							113163
MLS000577401	LSM-24575	SID17433744, BRD-K83171799	2929846	InChI=1S/C24H21Cl2N5O2/c1-12-20(23(32)29-27-12)22(21-13(2)28-30-24(21)33)16-11-31(19-6-4-3-5-15(16)19)10-14-7-8-17(25)18(26)9-14/h3-9,11,22H,10H2,1-2H3,(H2,27,29,32)(H2,28,30,33)	BFNOZDAIYYYRGE-UHFFFAOYSA-N	Cc1n[nH]c(O)c1C(c2cn(Cc3ccc(Cl)c(Cl)c3)c4ccccc24)c5c(C)n[nH]c5O	BroadT	BRD-K83171799	BRD-K83171799-001-08-2	ChemBridge Corporation	7190131			Cc1n[nH]c(O)c1C(c1cn(Cc2ccc(Cl)c(Cl)c2)c2ccccc12)c1c(C)n[nH]c1O	InChI=1S/C24H21Cl2N5O2/c1-12-20(23(32)29-27-12)22(21-13(2)28-30-24(21)33)16-11-31(19-6-4-3-5-15(16)19)10-14-7-8-17(25)18(26)9-14/h3-9,11,22H,10H2,1-2H3,(H2,27,29,32)(H2,28,30,33)	BFNOZDAIYYYRGE-UHFFFAOYSA-N	481.107230382							113164
N1-(3-Chlorophenyl)-2-{[5-(2-pyridyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]thio}acetamide	LSM-24576	SID26731697, BRD-A74200370	2746662	InChI=1S/C15H13ClN4OS2/c16-10-4-3-5-11(8-10)18-13(21)9-22-15-20-19-14(23-15)12-6-1-2-7-17-12/h1-8,14,19H,9H2,(H,18,21)	UTCYFHPJTTXHSE-UHFFFAOYSA-N	Clc1cccc(NC(=O)CSC2=NNC(S2)c3ccccn3)c1	BroadT	BRD-A74200370	BRD-A74200370-001-06-3	Maybridge	SPB 06990			Clc1cccc(NC(=O)CSC2=NNC(S2)c2ccccn2)c1	InChI=1S/C15H13ClN4OS2/c16-10-4-3-5-11(8-10)18-13(21)9-22-15-20-19-14(23-15)12-6-1-2-7-17-12/h1-8,14,19H,9H2,(H,18,21)	UTCYFHPJTTXHSE-UHFFFAOYSA-N	364.021930166							113165
SMR000243921	LSM-24577	SID104219493, SID22404852, BRD-K63368620	2503577	InChI=1S/C26H24N2O5S/c1-18-14-24(19(2)28(18)22-10-4-3-5-11-22)25(29)17-33-26(30)16-27-34(31,32)23-13-12-20-8-6-7-9-21(20)15-23/h3-15,27H,16-17H2,1-2H3	AQBKYYYBJIOSNU-UHFFFAOYSA-N	Cc1cc(C(=O)COC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c(C)n1c4ccccc4	BroadT	BRD-K63368620	BRD-K63368620-001-05-9	Enamine Ltd.	T5289410			Cc1cc(C(=O)COC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c(C)n1-c1ccccc1	InChI=1S/C26H24N2O5S/c1-18-14-24(19(2)28(18)22-10-4-3-5-11-22)25(29)17-33-26(30)16-27-34(31,32)23-13-12-20-8-6-7-9-21(20)15-23/h3-15,27H,16-17H2,1-2H3	AQBKYYYBJIOSNU-UHFFFAOYSA-N	476.140592578							113166
MLS000120949	LSM-24578	SID17388254, BRD-K34219302	1175547	InChI=1S/C19H19N5O4S/c1-12(25)13-4-6-14(7-5-13)20-18(26)11-29-19-21-22-23-24(19)15-8-16(27-2)10-17(9-15)28-3/h4-10H,11H2,1-3H3,(H,20,26)	FDHIYGUPIPFKIF-UHFFFAOYSA-N	COc1cc(OC)cc(c1)n2nnnc2SCC(=O)Nc3ccc(cc3)C(=O)C	BroadT	BRD-K34219302	BRD-K34219302-001-06-3	Asinex Ltd.	ASN 04455466			COc1cc(OC)cc(c1)-n1nnnc1SCC(=O)Nc1ccc(cc1)C(C)=O	InChI=1S/C19H19N5O4S/c1-12(25)13-4-6-14(7-5-13)20-18(26)11-29-19-21-22-23-24(19)15-8-16(27-2)10-17(9-15)28-3/h4-10H,11H2,1-3H3,(H,20,26)	FDHIYGUPIPFKIF-UHFFFAOYSA-N	413.115774828							113167
MLS000590299	LSM-44066	SID24791554, BRD-K00582136	729707	InChI=1S/C19H14N4O3/c1-22-12-14(17-7-2-3-8-18(17)22)9-13(11-20)19(24)21-15-5-4-6-16(10-15)23(25)26/h2-10,12H,1H3,(H,21,24)/b13-9+	ILSSADQSBXYQOB-UKTHLTGXSA-N	Cn1cc(\C=C(/C#N)\C(=O)Nc2cccc(c2)[N+](=O)[O-])c3ccccc13	BroadT	BRD-K00582136	BRD-K00582136-001-07-4	InterBioScreen Ltd.	STOCK1S-88787			Cn1cc(\C=C(/C#N)C(=O)Nc2cccc(c2)[N+]([O-])=O)c2ccccc12	InChI=1S/C19H14N4O3/c1-22-12-14(17-7-2-3-8-18(17)22)9-13(11-20)19(24)21-15-5-4-6-16(10-15)23(25)26/h2-10,12H,1H3,(H,21,24)/b13-9+	ILSSADQSBXYQOB-UKTHLTGXSA-N	346.106590348							
BAS 04995680	LSM-24580	SID49728539, BRD-K96372127	1077467	InChI=1S/C24H30N6O3/c25-21-18(23(31)26-17-6-1-2-7-17)16-19-22(27-20-8-3-4-10-29(20)24(19)32)30(21)11-5-9-28-12-14-33-15-13-28/h3-4,8,10,16-17,25H,1-2,5-7,9,11-15H2,(H,26,31)	FGSZILDPBBWYSU-UHFFFAOYSA-N	N=C1N(CCCN2CCOCC2)C3=C(C=C1C(=O)NC4CCCC4)C(=O)N5C=CC=CC5=N3	BroadT	BRD-K96372127	BRD-K96372127-001-05-0	Asinex Ltd.	BAS 04995680			N=c1c(cc2c(nc3ccccn3c2=O)n1CCCN1CCOCC1)C(=O)NC1CCCC1	InChI=1S/C24H30N6O3/c25-21-18(23(31)26-17-6-1-2-7-17)16-19-22(27-20-8-3-4-10-29(20)24(19)32)30(21)11-5-9-28-12-14-33-15-13-28/h3-4,8,10,16-17,25H,1-2,5-7,9,11-15H2,(H,26,31)	FGSZILDPBBWYSU-UHFFFAOYSA-N	450.23793888							113169
MLS000589313	LSM-24581	SID17504042, BRD-A86322787	3750586	InChI=1S/C16H18N4O2/c1-2-5-12-15(10-19)13(20)22-16(21-12)7-4-3-6-11(16)14(15,8-17)9-18/h11-12,20H,2-7H2,1H3	GXTWAXDCKTXFAL-UHFFFAOYSA-N	CCCC1OC23CCCCC2C(C#N)(C#N)C1(C#N)C(=N)O3	BroadT	BRD-A86322787	BRD-A86322787-001-06-8	InterBioScreen Ltd.	STOCK1S-78223			CCCC1OC23CCCCC2C(C#N)(C#N)C1(C#N)C(=N)O3	InChI=1S/C16H18N4O2/c1-2-5-12-15(10-19)13(20)22-16(21-12)7-4-3-6-11(16)14(15,8-17)9-18/h11-12,20H,2-7H2,1H3	GXTWAXDCKTXFAL-UHFFFAOYSA-N	298.142975856							113170
AC1MBK9W	LSM-24582	SID50085532, BRD-K34016617	2726916	InChI=1S/C13H10ClF3N4O2/c1-21-6-9(14)10(19-21)11(18)20-23-12(22)7-4-2-3-5-8(7)13(15,16)17/h2-6H,1H3,(H2,18,20)	GNDYSBAGESYCAI-UHFFFAOYSA-N	Cn1cc(Cl)c(n1)C(=N)NOC(=O)c2ccccc2C(F)(F)F	BroadT	BRD-K34016617	BRD-K34016617-001-05-5	Maybridge	RF 04176			Cn1cc(Cl)c(n1)C(=N)NOC(=O)c1ccccc1C(F)(F)F	InChI=1S/C13H10ClF3N4O2/c1-21-6-9(14)10(19-21)11(18)20-23-12(22)7-4-2-3-5-8(7)13(15,16)17/h2-6H,1H3,(H2,18,20)	GNDYSBAGESYCAI-UHFFFAOYSA-N	346.04443791							113171
AK-968/12514147	LSM-24583	SID4240660, BRD-A93140036	5771269	InChI=1S/C15H16N4OS/c1-15(2,3)12-11-10(9-5-4-6-21-9)8(7-16)13(17)18-14(11)20-19-12/h4-6,10,18H,17H2,1-3H3	UPCQNBINKKGCHK-UHFFFAOYSA-N	CC(C)(C)c1noc2NC(=C(C#N)C(c3cccs3)c12)N	BroadT	BRD-A93140036	BRD-A93140036-001-06-4	ChemDiv Inc.	6049-1508			CC(C)(C)c1noc2NC(N)=C(C#N)C(c3cccs3)c12	InChI=1S/C15H16N4OS/c1-15(2,3)12-11-10(9-5-4-6-21-9)8(7-16)13(17)18-14(11)20-19-12/h4-6,10,18H,17H2,1-3H3	UPCQNBINKKGCHK-UHFFFAOYSA-N	300.104481862							
T0517-1961	LSM-24584	BRD-A83862484	3466207	InChI=1S/C23H25NO4/c1-14(2)11-20(23(25)26)24-19-13-22(16-6-8-17(27-4)9-7-16)28-21-10-5-15(3)12-18(19)21/h5-10,12-14,20H,11H2,1-4H3,(H,25,26)	DCMJHVDYYQLBFE-UHFFFAOYSA-N	COc1ccc(cc1)C2=CC(=NC(CC(C)C)C(=O)O)c3cc(C)ccc3O2	BroadT	BRD-A83862484	BRD-A83862484-001-06-2	Enamine Ltd.	T0517-1961			COc1ccc(cc1)-c1cc(=NC(CC(C)C)C(O)=O)c2cc(C)ccc2o1	InChI=1S/C23H25NO4/c1-14(2)11-20(23(25)26)24-19-13-22(16-6-8-17(27-4)9-7-16)28-21-10-5-15(3)12-18(19)21/h5-10,12-14,20H,11H2,1-4H3,(H,25,26)	DCMJHVDYYQLBFE-UHFFFAOYSA-N	379.17835829							113173
SMR000045370	LSM-24585	SID863251, BRD-K25575233	664497	InChI=1S/C15H16N4O/c1-4-12(20)16-14-11-8-10-7-5-6-9(2)13(10)17-15(11)19(3)18-14/h5-8H,4H2,1-3H3,(H,16,18,20)	XRGUCZQJNYDYCA-UHFFFAOYSA-N	CCC(=O)Nc1nn(C)c2nc3c(C)cccc3cc12	BroadT	BRD-K25575233	BRD-K25575233-001-05-5	InterBioScreen Ltd.	STOCK4S-67150			CCC(=O)Nc1nn(C)c2nc3c(C)cccc3cc12	InChI=1S/C15H16N4O/c1-4-12(20)16-14-11-8-10-7-5-6-9(2)13(10)17-15(11)19(3)18-14/h5-8H,4H2,1-3H3,(H,16,18,20)	XRGUCZQJNYDYCA-UHFFFAOYSA-N	268.132411172							113174
ZINC01117960	LSM-24586	SID22416394, BRD-K38685680	1295242	InChI=1S/C18H18BrNO3/c1-13-3-2-4-16(11-13)20-17(21)9-10-18(22)23-12-14-5-7-15(19)8-6-14/h2-8,11H,9-10,12H2,1H3,(H,20,21)	KAGHTNIGBARZLK-UHFFFAOYSA-N	Cc1cccc(NC(=O)CCC(=O)OCc2ccc(Br)cc2)c1	BroadT	BRD-K38685680	BRD-K38685680-001-05-5	ChemBridge Corporation	7319215			Cc1cccc(NC(=O)CCC(=O)OCc2ccc(Br)cc2)c1	InChI=1S/C18H18BrNO3/c1-13-3-2-4-16(11-13)20-17(21)9-10-18(22)23-12-14-5-7-15(19)8-6-14/h2-8,11H,9-10,12H2,1H3,(H,20,21)	KAGHTNIGBARZLK-UHFFFAOYSA-N	375.047006046							113175
SMR000200867	LSM-24587	SID17413941, BRD-K48238904	2223419	InChI=1S/C23H30N2O3S2/c1-17-8-12-20(13-9-17)25-30(27,28)22-16-19(11-10-18(22)2)23(26)24-14-15-29-21-6-4-3-5-7-21/h8-13,16,21,25H,3-7,14-15H2,1-2H3,(H,24,26)	XZRAPRHDIBCXOT-UHFFFAOYSA-N	Cc1ccc(NS(=O)(=O)c2cc(ccc2C)C(=O)NCCSC3CCCCC3)cc1	BroadT	BRD-K48238904	BRD-K48238904-001-05-1	ChemBridge Corporation	7931722			Cc1ccc(NS(=O)(=O)c2cc(ccc2C)C(=O)NCCSC2CCCCC2)cc1	InChI=1S/C23H30N2O3S2/c1-17-8-12-20(13-9-17)25-30(27,28)22-16-19(11-10-18(22)2)23(26)24-14-15-29-21-6-4-3-5-7-21/h8-13,16,21,25H,3-7,14-15H2,1-2H3,(H,24,26)	XZRAPRHDIBCXOT-UHFFFAOYSA-N	446.16978422							113176
AC1OA5JN	LSM-24588	BRD-K37322834	6799281	InChI=1S/C17H15BrN4O5/c18-12-1-3-13(4-2-12)20-16(24)7-8-17(25)21-19-10-11-9-14(22(26)27)5-6-15(11)23/h1-6,9-10,23H,7-8H2,(H,20,24)(H,21,25)	JQKWFGRLOQRPKF-UHFFFAOYSA-N	Oc1ccc(cc1C=NNC(=O)CCC(=O)Nc2ccc(Br)cc2)[N+](=O)[O-]	BroadT	BRD-K37322834	BRD-K37322834-001-05-1	ChemDiv Inc.	1761-0623			Oc1ccc(cc1C=NNC(=O)CCC(=O)Nc1ccc(Br)cc1)[N+]([O-])=O	InChI=1S/C17H15BrN4O5/c18-12-1-3-13(4-2-12)20-16(24)7-8-17(25)21-19-10-11-9-14(22(26)27)5-6-15(11)23/h1-6,9-10,23H,7-8H2,(H,20,24)(H,21,25)	JQKWFGRLOQRPKF-UHFFFAOYSA-N	434.02258222							
SMR000025309	LSM-24589	SID24839215, SID4251296, BRD-K63788871	3245000	InChI=1S/C23H19BrN2O6/c1-30-20-10-17-18(11-21(20)31-2)25(13-19(27)14-5-7-15(24)8-6-14)23(29)26(22(17)28)12-16-4-3-9-32-16/h3-11H,12-13H2,1-2H3	URALDBVFJRJZEU-UHFFFAOYSA-N	COc1cc2N(CC(=O)c3ccc(Br)cc3)C(=O)N(Cc4occc4)C(=O)c2cc1OC	BroadT	BRD-K63788871	BRD-K63788871-001-05-4	ChemDiv Inc.	C260-2615			COc1cc2n(CC(=O)c3ccc(Br)cc3)c(=O)n(Cc3ccco3)c(=O)c2cc1OC	InChI=1S/C23H19BrN2O6/c1-30-20-10-17-18(11-21(20)31-2)25(13-19(27)14-5-7-15(24)8-6-14)23(29)26(22(17)28)12-16-4-3-9-32-16/h3-11H,12-13H2,1-2H3	URALDBVFJRJZEU-UHFFFAOYSA-N	498.042648948							113178
5-[(2,3-Dihydro-1H-inden-5-yloxy)methyl]-2-furohydrazide	LSM-24590	SID17504092, BRD-K52503835	717040	InChI=1S/C15H16N2O3/c16-17-15(18)14-7-6-13(20-14)9-19-12-5-4-10-2-1-3-11(10)8-12/h4-8H,1-3,9,16H2,(H,17,18)	ZJKZHHPRIDEAQW-UHFFFAOYSA-N	NNC(=O)c1oc(COc2ccc3CCCc3c2)cc1	BroadT	BRD-K52503835	BRD-K52503835-001-05-5	InterBioScreen Ltd.	STOCK3S-19576			NNC(=O)c1ccc(COc2ccc3CCCc3c2)o1	InChI=1S/C15H16N2O3/c16-17-15(18)14-7-6-13(20-14)9-19-12-5-4-10-2-1-3-11(10)8-12/h4-8H,1-3,9,16H2,(H,17,18)	ZJKZHHPRIDEAQW-UHFFFAOYSA-N	272.116092392							113179
MLS000054998	LSM-24591	SID3715053, BRD-A98572061	2999063	InChI=1S/C24H20FN5O5/c25-17-16(11-34-24(33)15-9-5-2-6-10-15)35-23(19(17)31)30-13-28-18-20(26-12-27-21(18)30)29-22(32)14-7-3-1-4-8-14/h1-10,12-13,16-17,19,23,31H,11H2,(H,26,27,29,32)	GWEDRNOEFWYKJH-UHFFFAOYSA-N	OC1C(F)C(COC(=O)c2ccccc2)OC1n3cnc4c(NC(=O)c5ccccc5)ncnc34	BroadT	BRD-A98572061	BRD-A98572061-001-05-3	Enamine Ltd.	T0503-5787			OC1C(F)C(COC(=O)c2ccccc2)OC1n1cnc2c(NC(=O)c3ccccc3)ncnc12	InChI=1S/C24H20FN5O5/c25-17-16(11-34-24(33)15-9-5-2-6-10-15)35-23(19(17)31)30-13-28-18-20(26-12-27-21(18)30)29-22(32)14-7-3-1-4-8-14/h1-10,12-13,16-17,19,23,31H,11H2,(H,26,27,29,32)	GWEDRNOEFWYKJH-UHFFFAOYSA-N	477.14484699							113180
3-Acetamidophthalimide	LSM-24592	SID3713000, BRD-K55664883	138666	InChI=1S/C10H8N2O3/c1-5(13)11-7-4-2-3-6-8(7)10(15)12-9(6)14/h2-4H,1H3,(H,11,13)(H,12,14,15)	SJRJIOQDTLOAQV-UHFFFAOYSA-N	CC(=O)Nc1cccc2C(=O)NC(=O)c12	BroadT	BRD-K55664883	BRD-K55664883-001-06-1	Enamine Ltd.	T0514-6292			CC(=O)Nc1cccc2C(=O)NC(=O)c12	InChI=1S/C10H8N2O3/c1-5(13)11-7-4-2-3-6-8(7)10(15)12-9(6)14/h2-4H,1H3,(H,11,13)(H,12,14,15)	SJRJIOQDTLOAQV-UHFFFAOYSA-N	204.053492136							113181
AC1LR8ZK	LSM-24593	BRD-K12340493	1364544	InChI=1S/C19H16N8O3/c1-29-14-10-6-5-9-13(14)11-21-23-19(28)15-16(12-7-3-2-4-8-12)27(26-22-15)18-17(20)24-30-25-18/h2-11H,1H3,(H2,20,24)(H,23,28)	ZJBRFDOLQRVSHM-UHFFFAOYSA-N	COc1ccccc1C=NNC(=O)c2nnn(c2c3ccccc3)c4nonc4N	BroadT	BRD-K12340493	BRD-K12340493-001-05-4	ChemBridge Corporation	5753335			COc1ccccc1C=NNC(=O)c1nnn(-c2nonc2N)c1-c1ccccc1	InChI=1S/C19H16N8O3/c1-29-14-10-6-5-9-13(14)11-21-23-19(28)15-16(12-7-3-2-4-8-12)27(26-22-15)18-17(20)24-30-25-18/h2-11H,1H3,(H2,20,24)(H,23,28)	ZJBRFDOLQRVSHM-UHFFFAOYSA-N	404.134536452							113182
MLS000665384	LSM-15367	BRD-K00095823	727478	InChI=1S/C18H15ClN2O2/c1-11-8-16(14-9-12(19)2-4-15(14)20-11)21-13-3-5-17-18(10-13)23-7-6-22-17/h2-5,8-10H,6-7H2,1H3,(H,20,21)	GMBAOUBLIFVPAH-UHFFFAOYSA-N	Cc1cc(Nc2ccc3OCCOc3c2)c4cc(Cl)ccc4n1	BroadT	BRD-K00095823	BRD-K00095823-003-07-1	ChemBridge Corporation	6859251		Cl	Cc1cc(Nc2ccc3OCCOc3c2)c2cc(Cl)ccc2n1.Cl	InChI=1S/C18H15ClN2O2.ClH/c1-11-8-16(14-9-12(19)2-4-15(14)20-11)21-13-3-5-17-18(10-13)23-7-6-22-17;/h2-5,8-10H,6-7H2,1H3,(H,20,21);1H	YTOTULBJKNEFAD-UHFFFAOYSA-N	326.08220545							104014, 104014
AK-968/40940208	LSM-24594	SID22416477, BRD-K50731883	841647	InChI=1S/C15H11ClN2OS/c1-9-4-5-11-12(7-9)20-14(13(11)16)15(19)18-10-3-2-6-17-8-10/h2-8H,1H3,(H,18,19)	ANXUAMWXFVTWBE-UHFFFAOYSA-N	Cc1ccc2c(Cl)c(sc2c1)C(=O)Nc3cccnc3	BroadT	BRD-K50731883	BRD-K50731883-001-05-5	ChemBridge Corporation	7239935			Cc1ccc2c(Cl)c(sc2c1)C(=O)Nc1cccnc1	InChI=1S/C15H11ClN2OS/c1-9-4-5-11-12(7-9)20-14(13(11)16)15(19)18-10-3-2-6-17-8-10/h2-8H,1H3,(H,18,19)	ANXUAMWXFVTWBE-UHFFFAOYSA-N	302.028061392							113183
SMR000149518	LSM-24595	SID14743241, BRD-A91937838	4891389	InChI=1S/C25H21N3O3S2/c1-27-15-19(16-8-3-2-4-9-16)25(24(27)18-11-5-6-12-20(18)26-21(24)29)22(30)28(23(32)33-25)14-17-10-7-13-31-17/h2-13,19H,14-15H2,1H3,(H,26,29)	WNNPRGGVTYMKOL-UHFFFAOYSA-N	CN1CC(c2ccccc2)C3(SC(=S)N(Cc4occc4)C3=O)C15C(=O)Nc6ccccc56	BroadT	BRD-A91937838	BRD-A91937838-001-06-5	InterBioScreen Ltd.	STOCK5S-46920			CN1CC(c2ccccc2)C2(SC(=S)N(Cc3ccco3)C2=O)C11C(=O)Nc2ccccc12	InChI=1S/C25H21N3O3S2/c1-27-15-19(16-8-3-2-4-9-16)25(24(27)18-11-5-6-12-20(18)26-21(24)29)22(30)28(23(32)33-25)14-17-10-7-13-31-17/h2-13,19H,14-15H2,1H3,(H,26,29)	WNNPRGGVTYMKOL-UHFFFAOYSA-N	475.102432942							113184
MLS000537839	LSM-44067	SID14736067, BRD-K17350502	2207202	InChI=1S/C15H14ClN5O2S/c1-9-8-12(19-18-9)14(23)20-21-15(24)17-13(22)7-6-10-4-2-3-5-11(10)16/h2-8H,1H3,(H,18,19)(H,20,23)(H2,17,21,22,24)/b7-6+	JJWPYPQVFPQHBU-VOTSOKGWSA-N	Cc1cc([nH]n1)C(=O)NNC(=S)NC(=O)\C=C\c2ccccc2Cl	BroadT	BRD-K17350502	BRD-K17350502-001-05-7	ChemBridge Corporation	7797623			Cc1cc([nH]n1)C(=O)NNC(=S)NC(=O)\C=C\c1ccccc1Cl	InChI=1S/C15H14ClN5O2S/c1-9-8-12(19-18-9)14(23)20-21-15(24)17-13(22)7-6-10-4-2-3-5-11(10)16/h2-8H,1H3,(H,18,19)(H,20,23)(H2,17,21,22,24)/b7-6+	JJWPYPQVFPQHBU-VOTSOKGWSA-N	363.055673138							
BRD-A89590566	LSM-24597			InChI=1S/C20H14N4O2/c21-20-23-18-15(19(26)24-20)13(10-6-2-1-3-7-10)14-16(22-18)11-8-4-5-9-12(11)17(14)25/h1-9,13-14H,(H3,21,23,24,26)	JYMAOXONWFCTJQ-UHFFFAOYSA-N	Nc1nc(O)c2C(C3C(=O)c4ccccc4C3=Nc2n1)c5ccccc5	BroadT	BRD-A89590566	BRD-A89590566-001-05-6	InterBioScreen Ltd.	STOCK5S-40882			Nc1nc(O)c2C(C3C(=O)c4ccccc4C3=Nc2n1)c1ccccc1	InChI=1S/C20H14N4O2/c21-20-23-18-15(19(26)24-20)13(10-6-2-1-3-7-10)14-16(22-18)11-8-4-5-9-12(11)17(14)25/h1-9,13-14H,(H3,21,23,24,26)	JYMAOXONWFCTJQ-UHFFFAOYSA-N	342.111675728							113186
SMR000023876	LSM-24598	SID4241128, BRD-K48296139	3236147	InChI=1S/C15H9Br2N3O4/c16-10-6-4-8(23-10)14(21)19-12-2-1-3-13(18-12)20-15(22)9-5-7-11(17)24-9/h1-7H,(H2,18,19,20,21,22)	KMMMDHBBWZTACE-UHFFFAOYSA-N	Brc1oc(cc1)C(=O)Nc2cccc(NC(=O)c3oc(Br)cc3)n2	BroadT	BRD-K48296139	BRD-K48296139-001-06-4	ChemDiv Inc.	0606-6029			Brc1ccc(o1)C(=O)Nc1cccc(NC(=O)c2ccc(Br)o2)n1	InChI=1S/C15H9Br2N3O4/c16-10-6-4-8(23-10)14(21)19-12-2-1-3-13(18-12)20-15(22)9-5-7-11(17)24-9/h1-7H,(H2,18,19,20,21,22)	KMMMDHBBWZTACE-UHFFFAOYSA-N	452.895980998							113187
STK379071	LSM-44068	SID14724674, BRD-K99205029	3115304	InChI=1S/C13H16N2OS2/c1-3-4-9-15-12(16)11(18-13(15)17)10-7-5-6-8-14(10)2/h5-8H,3-4,9H2,1-2H3/b11-10+	OOMBSJIHVPLNSK-ZHACJKMWSA-N	CCCCN1C(=S)S\C(=C\2/C=CC=CN2C)\C1=O	BroadT	BRD-K99205029	BRD-K99205029-001-05-8	Asinex Ltd.	BAS 00674176			CCCCN1C(=S)S\C(C1=O)=C1/C=CC=CN1C	InChI=1S/C13H16N2OS2/c1-3-4-9-15-12(16)11(18-13(15)17)10-7-5-6-8-14(10)2/h5-8H,3-4,9H2,1-2H3/b11-10+	OOMBSJIHVPLNSK-ZHACJKMWSA-N	280.070404532							
MLS000729078	LSM-24600	SID24811600, BRD-A18609450	4917700	InChI=1S/C24H19F4N5O/c25-17-8-6-15(7-9-17)18-12-21(24(26,27)28)33-22(30-18)13-19(31-33)23(34)32-11-2-1-5-20(32)16-4-3-10-29-14-16/h3-4,6-10,12-14,20H,1-2,5,11H2	QMNWXSUUWIKMAI-UHFFFAOYSA-N	Fc1ccc(cc1)c2cc(n3nc(cc3n2)C(=O)N4CCCCC4c5cccnc5)C(F)(F)F	BroadT	BRD-A18609450	BRD-A18609450-001-07-5	ChemDiv Inc.	8015-9300			Fc1ccc(cc1)-c1cc(n2nc(cc2n1)C(=O)N1CCCCC1c1cccnc1)C(F)(F)F	InChI=1S/C24H19F4N5O/c25-17-8-6-15(7-9-17)18-12-21(24(26,27)28)33-22(30-18)13-19(31-33)23(34)32-11-2-1-5-20(32)16-4-3-10-29-14-16/h3-4,6-10,12-14,20H,1-2,5,11H2	QMNWXSUUWIKMAI-UHFFFAOYSA-N	469.152573078							113189
MLS000583293	LSM-24601	SID17506497, BRD-K64646658	2226419	InChI=1S/C16H15BrN2OS/c17-13-7-4-8-14(11-13)18-16(21)19-15(20)10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2,(H2,18,19,20,21)	FYSIDAKRJLWCQF-UHFFFAOYSA-N	Brc1cccc(NC(=S)NC(=O)CCc2ccccc2)c1	BroadT	BRD-K64646658	BRD-K64646658-001-05-2	ChemBridge Corporation	7951324			Brc1cccc(NC(=S)NC(=O)CCc2ccccc2)c1	InChI=1S/C16H15BrN2OS/c17-13-7-4-8-14(11-13)18-16(21)19-15(20)10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2,(H2,18,19,20,21)	FYSIDAKRJLWCQF-UHFFFAOYSA-N	362.00884641							113190
MLS000722284	LSM-44069	BRD-K74823502	7090639	InChI=1S/C12H12N2S/c1-2-9-3-5-10(6-4-9)7-11(8-13)12(14)15/h3-7H,2H2,1H3,(H2,14,15)/b11-7-	SGVLLSTVURBKHH-XFFZJAGNSA-N	CCc1ccc(\C=C(\C#N)/C(=N)S)cc1	BroadT	BRD-K74823502	BRD-K74823502-001-05-3	Life Chemicals Inc.	F0192-0764			CCc1ccc(cc1)\C=C(\C#N)C(S)=N	InChI=1S/C12H12N2S/c1-2-9-3-5-10(6-4-9)7-11(8-13)12(14)15/h3-7H,2H2,1H3,(H2,14,15)/b11-7-	SGVLLSTVURBKHH-XFFZJAGNSA-N	216.072119094							
SMR000152052	LSM-24603	SID16953492, BRD-K81586711	2390608	InChI=1S/C21H22N4O3S2/c1-24-10-12-25(13-11-24)30(27,28)18-9-5-8-17(14-18)20(26)23-21-22-19(15-29-21)16-6-3-2-4-7-16/h2-9,14-15H,10-13H2,1H3,(H,22,23,26)	BEEMRKUWENENAP-UHFFFAOYSA-N	CN1CCN(CC1)S(=O)(=O)c2cccc(c2)C(=O)Nc3nc(cs3)c4ccccc4	BroadT	BRD-K81586711	BRD-K81586711-001-06-2	Enamine Ltd.	T0510-9658			CN1CCN(CC1)S(=O)(=O)c1cccc(c1)C(=O)Nc1nc(cs1)-c1ccccc1	InChI=1S/C21H22N4O3S2/c1-24-10-12-25(13-11-24)30(27,28)18-9-5-8-17(14-18)20(26)23-21-22-19(15-29-21)16-6-3-2-4-7-16/h2-9,14-15H,10-13H2,1H3,(H,22,23,26)	BEEMRKUWENENAP-UHFFFAOYSA-N	442.113331984							113192
AC1O9KLQ	LSM-24604	BRD-K96987983	6787739	InChI=1S/C15H18FN5/c16-12-6-5-7-13(10-12)19-20-14(11-17)15(18)21-8-3-1-2-4-9-21/h5-7,10,18-19H,1-4,8-9H2	TXVKMIKESSPRPB-UHFFFAOYSA-N	Fc1cccc(NN=C(C#N)C(=N)N2CCCCCC2)c1	BroadT	BRD-K96987983	BRD-K96987983-001-06-6	ChemDiv Inc.	8009-3327			Fc1cccc(NN=C(C#N)C(=N)N2CCCCCC2)c1	InChI=1S/C15H18FN5/c16-12-6-5-7-13(10-12)19-20-14(11-17)15(18)21-8-3-1-2-4-9-21/h5-7,10,18-19H,1-4,8-9H2	TXVKMIKESSPRPB-UHFFFAOYSA-N	287.154623826							113193
BAS 06100459	LSM-15368	BRD-K92348496	54675908	InChI=1S/C20H27N3O5/c1-27-15-11-13-14(12-16(15)28-2)22-20(26)17(18(13)24)19(25)21-7-6-10-23-8-4-3-5-9-23/h11-12H,3-10H2,1-2H3,(H,21,25)(H2,22,24,26)	JDPVYDLXGCBZID-UHFFFAOYSA-N	COc1cc2nc(O)c(C(=O)NCCCN3CCCCC3)c(O)c2cc1OC	BroadT	BRD-K92348496	BRD-K92348496-003-06-1	Asinex Ltd.	BAS 06100459		Cl	COc1cc2nc(O)c(C(=O)NCCCN3CCCCC3)c(O)c2cc1OC.Cl	InChI=1S/C20H27N3O5.ClH/c1-27-15-11-13-14(12-16(15)28-2)22-20(26)17(18(13)24)19(25)21-7-6-10-23-8-4-3-5-9-23;/h11-12H,3-10H2,1-2H3,(H,21,25)(H2,22,24,26);1H	XKOWIJCMQWQRQY-UHFFFAOYSA-N	389.195070994							104015, 104015
N-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-5-bromofuran-2-carboxamide	LSM-24605	SID49826569, BRD-K85317166	896250	InChI=1S/C11H9BrN2O3S/c1-5-9(6(2)15)18-11(13-5)14-10(16)7-3-4-8(12)17-7/h3-4H,1-2H3,(H,13,14,16)	SEDOUZDXUVBHBG-UHFFFAOYSA-N	CC(=O)c1sc(NC(=O)c2oc(Br)cc2)nc1C	BroadT	BRD-K85317166	BRD-K85317166-001-05-0	ChemBridge Corporation	7225833			CC(=O)c1sc(NC(=O)c2ccc(Br)o2)nc1C	InChI=1S/C11H9BrN2O3S/c1-5-9(6(2)15)18-11(13-5)14-10(16)7-3-4-8(12)17-7/h3-4H,1-2H3,(H,13,14,16)	SEDOUZDXUVBHBG-UHFFFAOYSA-N	327.951725458							113194
AC1OBI1P	LSM-24606	SID26669289, BRD-K47923186	6823235	InChI=1S/C22H16N2O3/c25-16-12-9-15(10-13-16)11-14-21-23-18-6-2-1-5-17(18)22(27)24(21)19-7-3-4-8-20(19)26/h1-14,25-26H/b14-11+	IMXQUFPGBUCBBA-SDNWHVSQSA-N	Oc1ccc(\C=C\C2=Nc3ccccc3C(=O)N2c4ccccc4O)cc1	BroadT	BRD-K47923186	BRD-K47923186-001-05-8	InterBioScreen Ltd.	STOCK1S-47659			Oc1ccc(\C=C\c2nc3ccccc3c(=O)n2-c2ccccc2O)cc1	InChI=1S/C22H16N2O3/c25-16-12-9-15(10-13-16)11-14-21-23-18-6-2-1-5-17(18)22(27)24(21)19-7-3-4-8-20(19)26/h1-14,25-26H/b14-11+	IMXQUFPGBUCBBA-SDNWHVSQSA-N	356.116092392							
Ethyl 2-methyl-4-phenylquinoline-3-carboxylate	LSM-15369	BRD-K66036237	710825	InChI=1S/C19H17NO2/c1-3-22-19(21)17-13(2)20-16-12-8-7-11-15(16)18(17)14-9-5-4-6-10-14/h4-12H,3H2,1-2H3	NKTJXKSVVDCPJP-UHFFFAOYSA-N	CCOC(=O)c1c(C)nc2ccccc2c1c3ccccc3	BroadT	BRD-K66036237	BRD-K66036237-003-05-0	Enamine Ltd.	T5311545		Cl	CCOC(=O)c1c(C)nc2ccccc2c1-c1ccccc1.Cl	InChI=1S/C19H17NO2.ClH/c1-3-22-19(21)17-13(2)20-16-12-8-7-11-15(16)18(17)14-9-5-4-6-10-14;/h4-12H,3H2,1-2H3;1H	UFKAZZDNVNYYJH-UHFFFAOYSA-N	291.125928794							104016, 104016
MLS000037648	LSM-24607	SID859714, BRD-A74094281	661019	InChI=1S/C16H27NO5/c1-3-5-6-16(14(18)21-4-2)11-13(22-15(16)19)12-17-7-9-20-10-8-17/h13H,3-12H2,1-2H3	HHJCITZXPVTSHY-UHFFFAOYSA-N	CCCCC1(CC(CN2CCOCC2)OC1=O)C(=O)OCC	BroadT	BRD-A74094281	BRD-A74094281-001-05-0	InterBioScreen Ltd.	STOCK3S-32276			CCCCC1(CC(CN2CCOCC2)OC1=O)C(=O)OCC	InChI=1S/C16H27NO5/c1-3-5-6-16(14(18)21-4-2)11-13(22-15(16)19)12-17-7-9-20-10-8-17/h13H,3-12H2,1-2H3	HHJCITZXPVTSHY-UHFFFAOYSA-N	313.188922974							113196
MLS000777367	LSM-24608	SID26671530, BRD-K47032027	5357223	InChI=1S/C16H14N4O2S/c1-22-11-8-6-10(7-9-11)17-16(23)20-19-14-12-4-2-3-5-13(12)18-15(14)21/h2-9,18,21H,1H3,(H,17,23)	RRCQAXBOKBNIDS-UHFFFAOYSA-N	COc1ccc(NC(=S)N=Nc2c(O)[nH]c3ccccc23)cc1	BroadT	BRD-K47032027	BRD-K47032027-001-06-9	InterBioScreen Ltd.	STOCK2S-72062			COc1ccc(NC(=S)N=Nc2c(O)[nH]c3ccccc23)cc1	InChI=1S/C16H14N4O2S/c1-22-11-8-6-10(7-9-11)17-16(23)20-19-14-12-4-2-3-5-13(12)18-15(14)21/h2-9,18,21H,1H3,(H,17,23)	RRCQAXBOKBNIDS-UHFFFAOYSA-N	326.083746418							
STK228016	LSM-24609	SID24810539, BRD-K89259468	15991975	InChI=1S/C24H23N5O3/c1-4-19(28-9-11-30-12-10-28)5-2-17(1)23-24(29-8-7-25-16-22(29)27-23)26-18-3-6-20-21(15-18)32-14-13-31-20/h1-8,15-16,26H,9-14H2	BPTOHTYWLVJMPK-UHFFFAOYSA-N	C1COc2cc(Nc3c(nc4cnccn34)c5ccc(cc5)N6CCOCC6)ccc2O1	BroadT	BRD-K89259468	BRD-K89259468-001-05-5	ChemDiv Inc.	C169-0216			C1CN(CCO1)c1ccc(cc1)-c1nc2cnccn2c1Nc1ccc2OCCOc2c1	InChI=1S/C24H23N5O3/c1-4-19(28-9-11-30-12-10-28)5-2-17(1)23-24(29-8-7-25-16-22(29)27-23)26-18-3-6-20-21(15-18)32-14-13-31-20/h1-8,15-16,26H,9-14H2	BPTOHTYWLVJMPK-UHFFFAOYSA-N	429.180089646							113198
F1365-1343	LSM-24610	BRD-K66685194	3588669	InChI=1S/C17H15N3O2S2/c1-3-8-20-13-7-6-12(18-11(2)21)10-15(13)24-17(20)19-16(22)14-5-4-9-23-14/h3-7,9-10H,1,8H2,2H3,(H,18,21)	UVJOIPJQPIWRCD-UHFFFAOYSA-N	CC(=O)Nc1ccc2N(CC=C)C(=NC(=O)c3cccs3)Sc2c1	BroadT	BRD-K66685194	BRD-K66685194-001-04-2	Life Chemicals Inc.	F1365-1343			CC(=O)Nc1ccc2n(CC=C)c(=NC(=O)c3cccs3)sc2c1	InChI=1S/C17H15N3O2S2/c1-3-8-20-13-7-6-12(18-11(2)21)10-15(13)24-17(20)19-16(22)14-5-4-9-23-14/h3-7,9-10H,1,8H2,2H3,(H,18,21)	UVJOIPJQPIWRCD-UHFFFAOYSA-N	357.06056813							113199
MLS000088245	LSM-24611	SID4258231, BRD-K33277793	758295	InChI=1S/C12H10N4OS/c18-12-15-14-11(9-3-5-13-6-4-9)16(12)8-10-2-1-7-17-10/h1-7H,8H2,(H,15,18)	PRWBCAUIHYTNSI-UHFFFAOYSA-N	Sc1nnc(c2ccncc2)n1Cc3occc3	BroadT	BRD-K33277793	BRD-K33277793-001-07-6	ChemBridge Corporation	7407398			Sc1nnc(-c2ccncc2)n1Cc1ccco1	InChI=1S/C12H10N4OS/c18-12-15-14-11(9-3-5-13-6-4-9)16(12)8-10-2-1-7-17-10/h1-7H,8H2,(H,15,18)	PRWBCAUIHYTNSI-UHFFFAOYSA-N	258.05753167							113200
SMR000162386	LSM-24612	SID17385758, BRD-K13351665	1017033	InChI=1S/C16H13ClN2O4S/c1-23-11-4-2-3-9(7-11)14(20)19-16(24)18-10-5-6-13(17)12(8-10)15(21)22/h2-8H,1H3,(H,21,22)(H2,18,19,20,24)	YJOGCPFPWBFJHJ-UHFFFAOYSA-N	COc1cccc(c1)C(=O)NC(=S)Nc2ccc(Cl)c(c2)C(=O)O	BroadT	BRD-K13351665	BRD-K13351665-001-06-0	Specs	AN-465/41522332			COc1cccc(c1)C(=O)NC(=S)Nc1ccc(Cl)c(c1)C(O)=O	InChI=1S/C16H13ClN2O4S/c1-23-11-4-2-3-9(7-11)14(20)19-16(24)18-10-5-6-13(17)12(8-10)15(21)22/h2-8H,1H3,(H,21,22)(H2,18,19,20,24)	YJOGCPFPWBFJHJ-UHFFFAOYSA-N	364.028455316							113201
AC1NJ1ZM	LSM-24613	BRD-K13675934	4840372	InChI=1S/C23H25F3N4O4S/c1-2-33-20-13-16(7-8-19(20)34-15-21(31)30-9-11-32-12-10-30)14-27-29-22(35)28-18-6-4-3-5-17(18)23(24,25)26/h3-8,13-14H,2,9-12,15H2,1H3,(H2,28,29,35)	LCNQEXURBMKXNL-UHFFFAOYSA-N	CCOc1cc(C=NN=C(S)Nc2ccccc2C(F)(F)F)ccc1OCC(=O)N3CCOCC3	BroadT	BRD-K13675934	BRD-K13675934-001-05-9	Enamine Ltd.	T5338898			CCOc1cc(C=NN=C(S)Nc2ccccc2C(F)(F)F)ccc1OCC(=O)N1CCOCC1	InChI=1S/C23H25F3N4O4S/c1-2-33-20-13-16(7-8-19(20)34-15-21(31)30-9-11-32-12-10-30)14-27-29-22(35)28-18-6-4-3-5-17(18)23(24,25)26/h3-8,13-14H,2,9-12,15H2,1H3,(H2,28,29,35)	LCNQEXURBMKXNL-UHFFFAOYSA-N	510.15486061							113202
STK576409	LSM-24614	SID7974815, BRD-K44868978	804632	InChI=1S/C16H15N3O/c20-16-12-8-4-5-9-14(12)18-15-13(10-17-19(15)16)11-6-2-1-3-7-11/h1-3,6-7,10,20H,4-5,8-9H2	OKDCZBAWXVAYKJ-UHFFFAOYSA-N	Oc1c2CCCCc2nc3c(cnn13)c4ccccc4	BroadT	BRD-K44868978	BRD-K44868978-001-05-0	ChemBridge Corporation	7065731			Oc1c2CCCCc2nc2c(cnn12)-c1ccccc1	InChI=1S/C16H15N3O/c20-16-12-8-4-5-9-14(12)18-15-13(10-17-19(15)16)11-6-2-1-3-7-11/h1-3,6-7,10,20H,4-5,8-9H2	OKDCZBAWXVAYKJ-UHFFFAOYSA-N	265.12151213							
SMR000194276	LSM-24615	SID17506436, BRD-A51705537	2887414	InChI=1S/C19H20Cl3N3OS/c1-11-9-12(2)15(13(3)10-11)23-18(27)25-17(19(20,21)22)24-16(26)14-7-5-4-6-8-14/h4-10,17H,1-3H3,(H,24,26)(H2,23,25,27)	GMUWTCFDEBOQKF-UHFFFAOYSA-N	Cc1cc(C)c(N=C(S)NC(NC(=O)c2ccccc2)C(Cl)(Cl)Cl)c(C)c1	BroadT	BRD-A51705537	BRD-A51705537-001-05-0	ChemBridge Corporation	6132228			Cc1cc(C)c(N=C(S)NC(NC(=O)c2ccccc2)C(Cl)(Cl)Cl)c(C)c1	InChI=1S/C19H20Cl3N3OS/c1-11-9-12(2)15(13(3)10-11)23-18(27)25-17(19(20,21)22)24-16(26)14-7-5-4-6-8-14/h4-10,17H,1-3H3,(H,24,26)(H2,23,25,27)	GMUWTCFDEBOQKF-UHFFFAOYSA-N	443.03926611							113204
ST058281	LSM-44070	SID22405886, BRD-K87194190	6529937	InChI=1S/C21H21N3O6S/c1-5-29-20(27)18-13(3)22-21(31-18)24-19(26)16(12(2)23-24)10-14-6-8-15(9-7-14)30-11-17(25)28-4/h6-10H,5,11H2,1-4H3/b16-10+	AKBGLCIGQGUMLW-MHWRWJLKSA-N	CCOC(=O)c1sc(nc1C)N2N=C(C)\C(=C/c3ccc(OCC(=O)OC)cc3)\C2=O	BroadT	BRD-K87194190	BRD-K87194190-001-05-1	ChemDiv Inc.	4823-2830			CCOC(=O)c1sc(nc1C)N1N=C(C)\C(=C/c2ccc(OCC(=O)OC)cc2)C1=O	InChI=1S/C21H21N3O6S/c1-5-29-20(27)18-13(3)22-21(31-18)24-19(26)16(12(2)23-24)10-14-6-8-15(9-7-14)30-11-17(25)28-4/h6-10H,5,11H2,1-4H3/b16-10+	AKBGLCIGQGUMLW-MHWRWJLKSA-N	443.115106112							
MLS001060544	LSM-24617	SID49732377, BRD-K13149013	2985508	InChI=1S/C20H23N3O4S/c1-15(24)16-6-5-7-18(14-16)22-28(26,27)19-10-8-17(9-11-19)21-20(25)23-12-3-2-4-13-23/h5-11,14,22H,2-4,12-13H2,1H3,(H,21,25)	MTWQYDPPWLQHAI-UHFFFAOYSA-N	CC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)N3CCCCC3)cc2)c1	BroadT	BRD-K13149013	BRD-K13149013-001-05-9	ChemBridge Corporation	7993460			CC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)N3CCCCC3)cc2)c1	InChI=1S/C20H23N3O4S/c1-15(24)16-6-5-7-18(14-16)22-28(26,27)19-10-8-17(9-11-19)21-20(25)23-12-3-2-4-13-23/h5-11,14,22H,2-4,12-13H2,1H3,(H,21,25)	MTWQYDPPWLQHAI-UHFFFAOYSA-N	401.140926936							113206
MLS000774435	LSM-24618	SID24835499, BRD-K11797433	3676567	InChI=1S/C31H32N4O6S/c1-39-23-8-6-22(7-9-23)28-21-26(25-4-2-3-5-27(25)32-28)31(36)33-29-20-24(42(37,38)35-14-18-41-19-15-35)10-11-30(29)34-12-16-40-17-13-34/h2-11,20-21H,12-19H2,1H3,(H,33,36)	LTNKTZLUELXRHA-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(C(=O)Nc3cc(ccc3N4CCOCC4)S(=O)(=O)N5CCOCC5)c6ccccc6n2	BroadT	BRD-K11797433	BRD-K11797433-001-06-7	Enamine Ltd.	T0505-3594			COc1ccc(cc1)-c1cc(C(=O)Nc2cc(ccc2N2CCOCC2)S(=O)(=O)N2CCOCC2)c2ccccc2n1	InChI=1S/C31H32N4O6S/c1-39-23-8-6-22(7-9-23)28-21-26(25-4-2-3-5-27(25)32-28)31(36)33-29-20-24(42(37,38)35-14-18-41-19-15-35)10-11-30(29)34-12-16-40-17-13-34/h2-11,20-21H,12-19H2,1H3,(H,33,36)	LTNKTZLUELXRHA-UHFFFAOYSA-N	588.204255474							113207
MLS000044985	LSM-24619	SID4246299, BRD-K78273693	3240668	InChI=1S/C14H16ClN3O2/c1-2-20-14(19)7-8-18-13(16)9-12(17-18)10-3-5-11(15)6-4-10/h3-6,9H,2,7-8,16H2,1H3	VEUBUUBOAJQCEE-UHFFFAOYSA-N	CCOC(=O)CCn1nc(cc1N)c2ccc(Cl)cc2	BroadT	BRD-K78273693	BRD-K78273693-001-05-6	ChemDiv Inc.	C430-0474			CCOC(=O)CCn1nc(cc1N)-c1ccc(Cl)cc1	InChI=1S/C14H16ClN3O2/c1-2-20-14(19)7-8-18-13(16)9-12(17-18)10-3-5-11(15)6-4-10/h3-6,9H,2,7-8,16H2,1H3	VEUBUUBOAJQCEE-UHFFFAOYSA-N	293.093104492							113208
AC1N7GLF	LSM-24620	SID26666949, BRD-A93644091	4302188	InChI=1S/C21H22N2O4/c1-4-27-20(25)21(2)14-18(22-15-9-8-12-17(13-15)26-3)19(24)23(21)16-10-6-5-7-11-16/h5-14,22H,4H2,1-3H3	JOSGEYKJFIHQHI-UHFFFAOYSA-N	CCOC(=O)C1(C)C=C(Nc2cccc(OC)c2)C(=O)N1c3ccccc3	BroadT	BRD-A93644091	BRD-A93644091-001-05-9	InterBioScreen Ltd.	STOCK2S-86409			CCOC(=O)C1(C)C=C(Nc2cccc(OC)c2)C(=O)N1c1ccccc1	InChI=1S/C21H22N2O4/c1-4-27-20(25)21(2)14-18(22-15-9-8-12-17(13-15)26-3)19(24)23(21)16-10-6-5-7-11-16/h5-14,22H,4H2,1-3H3	JOSGEYKJFIHQHI-UHFFFAOYSA-N	366.157957204							113209
MLS000029929	LSM-24621	SID846221, BRD-K24670833	648602	InChI=1S/C20H18N4OS/c1-14-4-5-17-15(11-14)12-16(13-21)19(22-17)23-6-8-24(9-7-23)20(25)18-3-2-10-26-18/h2-5,10-12H,6-9H2,1H3	PKMXGACTKAQYKU-UHFFFAOYSA-N	Cc1ccc2nc(N3CCN(CC3)C(=O)c4cccs4)c(cc2c1)C#N	BroadT	BRD-K24670833	BRD-K24670833-001-06-7	Asinex Ltd.	ASN 05813527			Cc1ccc2nc(N3CCN(CC3)C(=O)c3cccs3)c(cc2c1)C#N	InChI=1S/C20H18N4OS/c1-14-4-5-17-15(11-14)12-16(13-21)19(22-17)23-6-8-24(9-7-23)20(25)18-3-2-10-26-18/h2-5,10-12H,6-9H2,1H3	PKMXGACTKAQYKU-UHFFFAOYSA-N	362.120131926							113210
SMR000007416	LSM-24622	SID26668000, SID845554, BRD-A44957030	647911	InChI=1S/C22H21ClN6O2S/c23-17-8-2-1-5-14(17)13-29-21-19(26-27-29)22(31)25-20(24-21)15-6-3-9-28(12-15)18(30)11-16-7-4-10-32-16/h1-2,4-5,7-8,10,15H,3,6,9,11-13H2,(H,24,25,31)	FOVKLWYIDJLBDW-UHFFFAOYSA-N	Oc1nc(nc2c1nnn2Cc3ccccc3Cl)C4CCCN(C4)C(=O)Cc5cccs5	BroadT	BRD-A44957030	BRD-A44957030-001-05-9	Asinex Ltd.	ASN 06919401			Oc1nc(nc2n(Cc3ccccc3Cl)nnc12)C1CCCN(C1)C(=O)Cc1cccs1	InChI=1S/C22H21ClN6O2S/c23-17-8-2-1-5-14(17)13-29-21-19(26-27-29)22(31)25-20(24-21)15-6-3-9-28(12-15)18(30)11-16-7-4-10-32-16/h1-2,4-5,7-8,10,15H,3,6,9,11-13H2,(H,24,25,31)	FOVKLWYIDJLBDW-UHFFFAOYSA-N	468.113522372							
2-[(2,4-Dichlorobenzyl)sulfanyl]-6,7-dimethoxy-3-(2-thienylmethyl)-4(3H)-quinazolinimine	LSM-24623	SID17409951, BRD-K88263434	1489238	InChI=1S/C22H19Cl2N3O2S2/c1-28-19-9-16-18(10-20(19)29-2)26-22(27(21(16)25)11-15-4-3-7-30-15)31-12-13-5-6-14(23)8-17(13)24/h3-10,25H,11-12H2,1-2H3	SHVHJSCNQWOBBI-UHFFFAOYSA-N	COc1cc2N=C(SCc3ccc(Cl)cc3Cl)N(Cc4cccs4)C(=N)c2cc1OC	BroadT	BRD-K88263434	BRD-K88263434-001-07-5	Key Organics Ltd.	9R-0338			COc1cc2nc(SCc3ccc(Cl)cc3Cl)n(Cc3cccs3)c(=N)c2cc1OC	InChI=1S/C22H19Cl2N3O2S2/c1-28-19-9-16-18(10-20(19)29-2)26-22(27(21(16)25)11-15-4-3-7-30-15)31-12-13-5-6-14(23)8-17(13)24/h3-10,25H,11-12H2,1-2H3	SHVHJSCNQWOBBI-UHFFFAOYSA-N	491.029573678							113212
5-[(4-Bromo-3-nitropyrazol-1-yl)methyl]-n-[(3-chlorophenyl)methylideneamino]furan-2-carboxamide	LSM-24624	BRD-K51549846	1757402	InChI=1S/C16H11BrClN5O4/c17-13-9-22(21-15(13)23(25)26)8-12-4-5-14(27-12)16(24)20-19-7-10-2-1-3-11(18)6-10/h1-7,9H,8H2,(H,20,24)	DQXWDPYRUBCXJN-UHFFFAOYSA-N	[O-][N+](=O)c1nn(Cc2oc(cc2)C(=O)NN=Cc3cccc(Cl)c3)cc1Br	BroadT	BRD-K51549846	BRD-K51549846-001-06-4	Specs	AK-968/40707654			[O-][N+](=O)c1nn(Cc2ccc(o2)C(=O)NN=Cc2cccc(Cl)c2)cc1Br	InChI=1S/C16H11BrClN5O4/c17-13-9-22(21-15(13)23(25)26)8-12-4-5-14(27-12)16(24)20-19-7-10-2-1-3-11(18)6-10/h1-7,9H,8H2,(H,20,24)	DQXWDPYRUBCXJN-UHFFFAOYSA-N	450.968294192							113213
MLS000590001	LSM-24625	SID17512812, BRD-K81653418	5127947	InChI=1S/C21H28N2OS2/c1-2-3-7-15-24-20-12-10-18(11-13-20)17-26-16-14-22-21(25)23-19-8-5-4-6-9-19/h4-6,8-13H,2-3,7,14-17H2,1H3,(H2,22,23,25)	HNLHVUNAGKSCKK-UHFFFAOYSA-N	CCCCCOc1ccc(CSCCN=C(S)Nc2ccccc2)cc1	BroadT	BRD-K81653418	BRD-K81653418-001-05-8	InterBioScreen Ltd.	STOCK1S-83537			CCCCCOc1ccc(CSCCN=C(S)Nc2ccccc2)cc1	InChI=1S/C21H28N2OS2/c1-2-3-7-15-24-20-12-10-18(11-13-20)17-26-16-14-22-21(25)23-19-8-5-4-6-9-19/h4-6,8-13H,2-3,7,14-17H2,1H3,(H2,22,23,25)	HNLHVUNAGKSCKK-UHFFFAOYSA-N	388.164304916							113214
T5820451	LSM-2682	BRD-K31553917, SID87556807, SID99495776	17562110	InChI=1S/C14H17N9S/c1-8(2)9-3-5-10(6-4-9)23-14(20-21-22-23)24-7-11-17-12(15)19-13(16)18-11/h3-6,8H,7H2,1-2H3,(H4,15,16,17,18,19)	HIXFBQMTPPZSPM-UHFFFAOYSA-N	CC(C)c1ccc(cc1)n2nnnc2SCc3nc(N)nc(N)n3	BroadT	BRD-K31553917	BRD-K31553917-001-02-4	Broad Institute of MIT and Harvard	BRD-K31553917			CC(C)c1ccc(cc1)-n1nnnc1SCc1nc(N)nc(N)n1	InChI=1S/C14H17N9S/c1-8(2)9-3-5-10(6-4-9)23-14(20-21-22-23)24-7-11-17-12(15)19-13(16)18-11/h3-6,8H,7H2,1-2H3,(H4,15,16,17,18,19)	HIXFBQMTPPZSPM-UHFFFAOYSA-N	343.132762324							92546
MLS001065380	LSM-24626	SID46500959, SID4251291, BRD-K70815861	3244996	InChI=1S/C22H29N3O4S/c1-16-8-12-25(13-9-16)30(28,29)17-6-7-20-18(14-17)21(26)19(15-23(20)2)22(27)24-10-4-3-5-11-24/h6-7,14-16H,3-5,8-13H2,1-2H3	MVMQEGNWCVYQOW-UHFFFAOYSA-N	CC1CCN(CC1)S(=O)(=O)c2ccc3N(C)C=C(C(=O)N4CCCCC4)C(=O)c3c2	BroadT	BRD-K70815861	BRD-K70815861-001-05-8	ChemDiv Inc.	C519-0767			CC1CCN(CC1)S(=O)(=O)c1ccc2n(C)cc(C(=O)N3CCCCC3)c(=O)c2c1	InChI=1S/C22H29N3O4S/c1-16-8-12-25(13-9-16)30(28,29)17-6-7-20-18(14-17)21(26)19(15-23(20)2)22(27)24-10-4-3-5-11-24/h6-7,14-16H,3-5,8-13H2,1-2H3	MVMQEGNWCVYQOW-UHFFFAOYSA-N	431.187877128							113215
AC1MEPS0	LSM-24627	SID17507700, BRD-A17358086	2882119	InChI=1S/C24H20ClNO/c1-15(27)26-23-13-12-17(25)14-22(23)19-9-5-11-21(19)24(26)20-10-4-7-16-6-2-3-8-18(16)20/h2-10,12-14,19,21,24H,11H2,1H3	MGIXZCJBXIHKQQ-UHFFFAOYSA-N	CC(=O)N1C(C2CC=CC2c3cc(Cl)ccc13)c4cccc5ccccc45	BroadT	BRD-A17358086	BRD-A17358086-001-05-6	Asinex Ltd.	BAS 00670105			CC(=O)N1C(C2CC=CC2c2cc(Cl)ccc12)c1cccc2ccccc12	InChI=1S/C24H20ClNO/c1-15(27)26-23-13-12-17(25)14-22(23)19-9-5-11-21(19)24(26)20-10-4-7-16-6-2-3-8-18(16)20/h2-10,12-14,19,21,24H,11H2,1H3	MGIXZCJBXIHKQQ-UHFFFAOYSA-N	373.12334198							113216
ST50973918	LSM-24628	SID24814478, BRD-K13821213	6115977	InChI=1S/C16H10N2O5/c19-13-6-4-10(5-7-13)8-14-15(17-23-16(14)20)11-2-1-3-12(9-11)18(21)22/h1-9,19H/b14-8-	DELXDGQGKHWAPA-ZSOIEALJSA-N	Oc1ccc(\C=C\2/C(=O)ON=C2c3cccc(c3)[N+](=O)[O-])cc1	BroadT	BRD-K13821213	BRD-K13821213-001-05-1	ChemDiv Inc.	5408-0017			Oc1ccc(cc1)\C=C1C(=O)ON=C/1c1cccc(c1)[N+]([O-])=O	InChI=1S/C16H10N2O5/c19-13-6-4-10(5-7-13)8-14-15(17-23-16(14)20)11-2-1-3-12(9-11)18(21)22/h1-9,19H/b14-8-	DELXDGQGKHWAPA-ZSOIEALJSA-N	310.05897144							
4-Amino-n-furan-2-yl-benzamide	LSM-24629	SID14721724, BRD-K13668671	774475	InChI=1S/C11H10N2O2/c12-9-5-3-8(4-6-9)11(14)13-10-2-1-7-15-10/h1-7H,12H2,(H,13,14)	OPUZLTHGCQFFAG-UHFFFAOYSA-N	Nc1ccc(cc1)C(=O)Nc2occc2	BroadT	BRD-K13668671	BRD-K13668671-001-05-1	Asinex Ltd.	BAS 01170401			Nc1ccc(cc1)C(=O)Nc1ccco1	InChI=1S/C11H10N2O2/c12-9-5-3-8(4-6-9)11(14)13-10-2-1-7-15-10/h1-7H,12H2,(H,13,14)	OPUZLTHGCQFFAG-UHFFFAOYSA-N	202.07422758							113218
N-[1-Benzyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2,4-dichlorobenzamide	LSM-24630	SID14739945, BRD-A25052569	2969333	InChI=1S/C21H13Cl2F3N4O4/c22-11-6-7-12(13(23)8-11)16(31)29-20(21(24,25)26)14-15(27-18(20)33)30(19(34)28-17(14)32)9-10-4-2-1-3-5-10/h1-8H,9H2,(H,27,33)(H,29,31)(H,28,32,34)	OHLMTMVIJJPTHW-UHFFFAOYSA-N	FC(F)(F)C1(NC(=O)c2ccc(Cl)cc2Cl)C(=O)NC3=C1C(=O)NC(=O)N3Cc4ccccc4	BroadT	BRD-A25052569	BRD-A25052569-001-05-1	ChemBridge Corporation	7939197			FC(F)(F)C1(NC(=O)c2ccc(Cl)cc2Cl)C(=O)Nc2c1c(=O)[nH]c(=O)n2Cc1ccccc1	InChI=1S/C21H13Cl2F3N4O4/c22-11-6-7-12(13(23)8-11)16(31)29-20(21(24,25)26)14-15(27-18(20)33)30(19(34)28-17(14)32)9-10-4-2-1-3-5-10/h1-8H,9H2,(H,27,33)(H,29,31)(H,28,32,34)	OHLMTMVIJJPTHW-UHFFFAOYSA-N	512.026594956							113219
AC1MMD1Y	LSM-24631	SID24825993, BRD-K82159479	3259084	InChI=1S/C26H25N5O/c1-20-10-12-21(13-11-20)25-23(19-31(28-25)22-7-3-2-4-8-22)26(32)30-17-15-29(16-18-30)24-9-5-6-14-27-24/h2-14,19H,15-18H2,1H3	IMWVJDCOIKUSOQ-UHFFFAOYSA-N	Cc1ccc(cc1)c2nn(cc2C(=O)N3CCN(CC3)c4ccccn4)c5ccccc5	BroadT	BRD-K82159479	BRD-K82159479-001-06-9	Enamine Ltd.	T5214870			Cc1ccc(cc1)-c1nn(cc1C(=O)N1CCN(CC1)c1ccccn1)-c1ccccc1	InChI=1S/C26H25N5O/c1-20-10-12-21(13-11-20)25-23(19-31(28-25)22-7-3-2-4-8-22)26(32)30-17-15-29(16-18-30)24-9-5-6-14-27-24/h2-14,19H,15-18H2,1H3	IMWVJDCOIKUSOQ-UHFFFAOYSA-N	423.20591047							113220
ZINC00441232	LSM-44071	SID49679866, BRD-K65708956	2235987	InChI=1S/C17H20N2O3S/c1-11-5-7-19(8-6-11)17-18-16(21)15(23-17)10-12-3-4-13(20)14(9-12)22-2/h3-4,9-11,20H,5-8H2,1-2H3/b15-10-	MYJYNGIQDJFHMW-GDNBJRDFSA-N	COc1cc(\C=C\2/SC(=NC2=O)N3CCC(C)CC3)ccc1O	BroadT	BRD-K65708956	BRD-K65708956-001-07-4	ChemDiv Inc.	4719-0060			COc1cc(ccc1O)\C=C1/SC(=NC1=O)N1CCC(C)CC1	InChI=1S/C17H20N2O3S/c1-11-5-7-19(8-6-11)17-18-16(21)15(23-17)10-12-3-4-13(20)14(9-12)22-2/h3-4,9-11,20H,5-8H2,1-2H3/b15-10-	MYJYNGIQDJFHMW-GDNBJRDFSA-N	332.11946321							
MLS000035675	LSM-24633	SID842339, BRD-K64991675	644597	InChI=1S/C18H20N6O3S3/c25-15(20-17-19-8-11-28-17)12-29-18-21-16(22-23-18)13-4-6-14(7-5-13)30(26,27)24-9-2-1-3-10-24/h4-8,11H,1-3,9-10,12H2,(H,19,20,25)(H,21,22,23)	STBDGRDQNSSTBD-UHFFFAOYSA-N	O=C(CSc1n[nH]c(n1)c2ccc(cc2)S(=O)(=O)N3CCCCC3)Nc4nccs4	BroadT	BRD-K64991675	BRD-K64991675-001-07-7	Asinex Ltd.	ASN 04886761			O=C(CSc1n[nH]c(n1)-c1ccc(cc1)S(=O)(=O)N1CCCCC1)Nc1nccs1	InChI=1S/C18H20N6O3S3/c25-15(20-17-19-8-11-28-17)12-29-18-21-16(22-23-18)13-4-6-14(7-5-13)30(26,27)24-9-2-1-3-10-24/h4-8,11H,1-3,9-10,12H2,(H,19,20,25)(H,21,22,23)	STBDGRDQNSSTBD-UHFFFAOYSA-N	464.07590063							113222
T0515-1220	LSM-24634	SID22411230, BRD-K56471541	4993758	InChI=1S/C20H33N3O3S2/c1-17(2)7-5-3-4-6-12-21-20(27)22-18-8-10-19(11-9-18)28(24,25)23-13-15-26-16-14-23/h8-11,17H,3-7,12-16H2,1-2H3,(H2,21,22,27)	OVIAQMLMUCTBFS-UHFFFAOYSA-N	CC(C)CCCCCCN=C(S)Nc1ccc(cc1)S(=O)(=O)N2CCOCC2	BroadT	BRD-K56471541	BRD-K56471541-001-06-4	Enamine Ltd.	T0515-1220			CC(C)CCCCCCN=C(S)Nc1ccc(cc1)S(=O)(=O)N1CCOCC1	InChI=1S/C20H33N3O3S2/c1-17(2)7-5-3-4-6-12-21-20(27)22-18-8-10-19(11-9-18)28(24,25)23-13-15-26-16-14-23/h8-11,17H,3-7,12-16H2,1-2H3,(H2,21,22,27)	OVIAQMLMUCTBFS-UHFFFAOYSA-N	427.196333326							113223
T0518-5636	LSM-24635	SID22408258, BRD-K97835021	4449863	InChI=1S/C26H22N2O6/c1-16(29)18-9-2-3-12-21(18)27-22(30)15-34-23(31)13-6-14-28-25(32)19-10-4-7-17-8-5-11-20(24(17)19)26(28)33/h2-5,7-12H,6,13-15H2,1H3,(H,27,30)	GFWQGEIRHRWBLE-UHFFFAOYSA-N	CC(=O)c1ccccc1NC(=O)COC(=O)CCCN2C(=O)c3cccc4cccc(C2=O)c34	BroadT	BRD-K97835021	BRD-K97835021-001-05-2	Enamine Ltd.	T0518-5636			CC(=O)c1ccccc1NC(=O)COC(=O)CCCN1C(=O)c2cccc3cccc(C1=O)c23	InChI=1S/C26H22N2O6/c1-16(29)18-9-2-3-12-21(18)27-22(30)15-34-23(31)13-6-14-28-25(32)19-10-4-7-17-8-5-11-20(24(17)19)26(28)33/h2-5,7-12H,6,13-15H2,1H3,(H,27,30)	GFWQGEIRHRWBLE-UHFFFAOYSA-N	458.147786444							113224
(3R)-1-(Anthracen-9-Ylmethyl)piperidin-3-ol	LSM-24636	SID14732385, BRD-A08000649	2845863	InChI=1S/C20H21NO/c22-17-8-5-11-21(13-17)14-20-18-9-3-1-6-15(18)12-16-7-2-4-10-19(16)20/h1-4,6-7,9-10,12,17,22H,5,8,11,13-14H2	KEEPUOQJKDMRFV-UHFFFAOYSA-N	OC1CCCN(Cc2c3ccccc3cc4ccccc24)C1	BroadT	BRD-A08000649	BRD-A08000649-001-05-5	ChemBridge Corporation	5426292			OC1CCCN(Cc2c3ccccc3cc3ccccc23)C1	InChI=1S/C20H21NO/c22-17-8-5-11-21(13-17)14-20-18-9-3-1-6-15(18)12-16-7-2-4-10-19(16)20/h1-4,6-7,9-10,12,17,22H,5,8,11,13-14H2	KEEPUOQJKDMRFV-UHFFFAOYSA-N	291.162314302							113225
MLS000564790	LSM-24637	BRD-K51897295	3509844	InChI=1S/C20H24N4O2S/c1-2-3-10-21-20-24(23-15-6-4-5-7-15)17(13-27-20)14-8-9-18-16(11-14)22-19(25)12-26-18/h8-9,11,13H,2-7,10,12H2,1H3,(H,22,25)	OBBFYFVKKMVSJX-UHFFFAOYSA-N	CCCCN=C1SC=C(N1N=C2CCCC2)c3ccc4OCC(=O)Nc4c3	BroadT	BRD-K51897295	BRD-K51897295-001-05-5	Enamine Ltd.	T0509-9532			CCCCN=c1scc(-c2ccc3OCC(=O)Nc3c2)n1N=C1CCCC1	InChI=1S/C20H24N4O2S/c1-2-3-10-21-20-24(23-15-6-4-5-7-15)17(13-27-20)14-8-9-18-16(11-14)22-19(25)12-26-18/h8-9,11,13H,2-7,10,12H2,1H3,(H,22,25)	OBBFYFVKKMVSJX-UHFFFAOYSA-N	384.161996738							113226
SMR000030985	LSM-24638	SID4248522, SID46500899, BRD-K80393588	3242589	InChI=1S/C26H32N4O3S/c1-2-3-12-27-24(31)19-34-26-28-23-10-9-21(29-14-16-33-17-15-29)18-22(23)25(32)30(26)13-11-20-7-5-4-6-8-20/h4-10,18H,2-3,11-17,19H2,1H3,(H,27,31)	FAHIGMPLTGSOSF-UHFFFAOYSA-N	CCCCNC(=O)CSC1=Nc2ccc(cc2C(=O)N1CCc3ccccc3)N4CCOCC4	BroadT	BRD-K80393588	BRD-K80393588-001-05-6	ChemDiv Inc.	K284-6964			CCCCNC(=O)CSc1nc2ccc(cc2c(=O)n1CCc1ccccc1)N1CCOCC1	InChI=1S/C26H32N4O3S/c1-2-3-12-27-24(31)19-34-26-28-23-10-9-21(29-14-16-33-17-15-29)18-22(23)25(32)30(26)13-11-20-7-5-4-6-8-20/h4-10,18H,2-3,11-17,19H2,1H3,(H,27,31)	FAHIGMPLTGSOSF-UHFFFAOYSA-N	480.219511614							113227
MLS001201693	LSM-24639	SID51085352, BRD-K11635304	2141381	InChI=1S/C13H11N3O2S2/c17-11(9-5-2-1-3-6-9)14-13(19)16-15-12(18)10-7-4-8-20-10/h1-8H,(H,15,18)(H2,14,16,17,19)	MLMDSAPNHYWIIW-UHFFFAOYSA-N	O=C(NNC(=S)NC(=O)c1ccccc1)c2cccs2	BroadT	BRD-K11635304	BRD-K11635304-001-06-5	Life Chemicals Inc.	F1620-0005			O=C(NNC(=S)NC(=O)c1ccccc1)c1cccs1	InChI=1S/C13H11N3O2S2/c17-11(9-5-2-1-3-6-9)14-13(19)16-15-12(18)10-7-4-8-20-10/h1-8H,(H,15,18)(H2,14,16,17,19)	MLMDSAPNHYWIIW-UHFFFAOYSA-N	305.029268002							113228
MLS000766601	LSM-44072	SID26661357, BRD-K83523806	915546	InChI=1S/C18H22N4O3/c1-24-13-3-4-15-14(11-13)16-17(20-15)18(23)22(12-19-16)6-2-5-21-7-9-25-10-8-21/h3-4,11-12,23H,2,5-10H2,1H3	YBRBGGOGALJOGM-UHFFFAOYSA-N	COc1ccc2nc3c(O)n(CCCN4CCOCC4)cnc3c2c1	BroadT	BRD-K83523806	BRD-K83523806-001-06-9	InterBioScreen Ltd.	STOCK1S-63619			COc1ccc2nc3c(O)n(CCCN4CCOCC4)cnc3c2c1	InChI=1S/C18H22N4O3/c1-24-13-3-4-15-14(11-13)16-17(20-15)18(23)22(12-19-16)6-2-5-21-7-9-25-10-8-21/h3-4,11-12,23H,2,5-10H2,1H3	YBRBGGOGALJOGM-UHFFFAOYSA-N	342.169190604							
AC1M20HG	LSM-24641	BRD-K20788788	2108455	InChI=1S/C16H12ClFN4OS/c1-10-13(9-19-20-16(23)14-3-2-8-24-14)15(17)22(21-10)12-6-4-11(18)5-7-12/h2-9H,1H3,(H,20,23)	GUSHJJVGBUVCGT-UHFFFAOYSA-N	Cc1nn(c(Cl)c1C=NNC(=O)c2cccs2)c3ccc(F)cc3	BroadT	BRD-K20788788	BRD-K20788788-001-06-6	Enamine Ltd.	T5239225			Cc1nn(c(Cl)c1C=NNC(=O)c1cccs1)-c1ccc(F)cc1	InChI=1S/C16H12ClFN4OS/c1-10-13(9-19-20-16(23)14-3-2-8-24-14)15(17)22(21-10)12-6-4-11(18)5-7-12/h2-9H,1H3,(H,20,23)	GUSHJJVGBUVCGT-UHFFFAOYSA-N	362.040437644							113230
AC1NJ24Y	LSM-24642	BRD-K77090289	4840449	InChI=1S/C14H10F3N3O2/c15-14(16,17)11-5-6-12(18-8-11)20-19-7-9-1-3-10(4-2-9)13(21)22/h1-8H,(H,18,20)(H,21,22)	FCHRLPPUNQKKMO-UHFFFAOYSA-N	OC(=O)c1ccc(C=NNc2ccc(cn2)C(F)(F)F)cc1	BroadT	BRD-K77090289	BRD-K77090289-001-07-1	Enamine Ltd.	T5339141			OC(=O)c1ccc(C=NNc2ccc(cn2)C(F)(F)F)cc1	InChI=1S/C14H10F3N3O2/c15-14(16,17)11-5-6-12(18-8-11)20-19-7-9-1-3-10(4-2-9)13(21)22/h1-8H,(H,18,20)(H,21,22)	FCHRLPPUNQKKMO-UHFFFAOYSA-N	309.07251119							113231
MLS000575881	LSM-44073	SID17415324, BRD-K08667579	2296037	InChI=1S/C18H18N2O3/c1-2-19-18(22)16(13-15-9-6-12-23-15)20-17(21)11-10-14-7-4-3-5-8-14/h3-13H,2H2,1H3,(H,19,22)(H,20,21)/b11-10+,16-13-	PAMQTYKVKCWTCF-JLEYVSIISA-N	CCNC(=O)\C(=C\c1occc1)\NC(=O)\C=C\c2ccccc2	BroadT	BRD-K08667579	BRD-K08667579-001-05-3	ChemBridge Corporation	6988853			CCNC(=O)C(\NC(=O)\C=C\c1ccccc1)=C\c1ccco1	InChI=1S/C18H18N2O3/c1-2-19-18(22)16(13-15-9-6-12-23-15)20-17(21)11-10-14-7-4-3-5-8-14/h3-13H,2H2,1H3,(H,19,22)(H,20,21)/b11-10+,16-13-	PAMQTYKVKCWTCF-JLEYVSIISA-N	310.131742456							
MLS000862468	LSM-24644	SID24792530, BRD-K35573624	713719	InChI=1S/C15H18N2O/c18-15-10-14(16-17-15)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h6-11H,1-5H2,(H2,16,17,18)	UPDLUMMMYBRYMJ-UHFFFAOYSA-N	Oc1cc([nH]n1)c2ccc(cc2)C3CCCCC3	BroadT	BRD-K35573624	BRD-K35573624-001-07-1	ChemBridge Corporation	7915385			Oc1cc([nH]n1)-c1ccc(cc1)C1CCCCC1	InChI=1S/C15H18N2O/c18-15-10-14(16-17-15)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h6-11H,1-5H2,(H2,16,17,18)	UPDLUMMMYBRYMJ-UHFFFAOYSA-N	242.141913216							113233
ST50677553	LSM-24645	SID7966658, BRD-K89176095	5308358	InChI=1S/C15H16N2O4/c1-3-6-10-9-13(17-21-10)14(18)16-12-8-5-4-7-11(12)15(19)20-2/h4-5,7-9H,3,6H2,1-2H3,(H,16,18)	UJEVLSAGHRKPSP-UHFFFAOYSA-N	CCCc1onc(c1)C(=O)Nc2ccccc2C(=O)OC	BroadT	BRD-K89176095	BRD-K89176095-001-05-2	ChemDiv Inc.	C226-3023			CCCc1cc(no1)C(=O)Nc1ccccc1C(=O)OC	InChI=1S/C15H16N2O4/c1-3-6-10-9-13(17-21-10)14(18)16-12-8-5-4-7-11(12)15(19)20-2/h4-5,7-9H,3,6H2,1-2H3,(H,16,18)	UJEVLSAGHRKPSP-UHFFFAOYSA-N	288.111007012							113234
MLS000548307	LSM-24646	SID17507017, BRD-K43750230	1176122	InChI=1S/C22H22N2O5S/c1-12-5-6-14-8-13(2)21(24-16(14)7-12)30-11-20(25)23-17-10-19(29-4)18(28-3)9-15(17)22(26)27/h5-10H,11H2,1-4H3,(H,23,25)(H,26,27)	KWCXKTAJOYKFNP-UHFFFAOYSA-N	COc1cc(NC(=O)CSc2nc3cc(C)ccc3cc2C)c(cc1OC)C(=O)O	BroadT	BRD-K43750230	BRD-K43750230-001-06-3	Asinex Ltd.	ASN 04458914			COc1cc(NC(=O)CSc2nc3cc(C)ccc3cc2C)c(cc1OC)C(O)=O	InChI=1S/C22H22N2O5S/c1-12-5-6-14-8-13(2)21(24-16(14)7-12)30-11-20(25)23-17-10-19(29-4)18(28-3)9-15(17)22(26)27/h5-10H,11H2,1-4H3,(H,23,25)(H,26,27)	KWCXKTAJOYKFNP-UHFFFAOYSA-N	426.124942514							113235
F0694-0211	LSM-24647	SID24815138, BRD-K71210192	7087637	InChI=1S/C18H11ClN4OS/c19-15-13(6-2-8-20-15)16(24)22-12-5-1-4-11(10-12)17-23-14-7-3-9-21-18(14)25-17/h1-10H,(H,22,24)	QZYAKMSAYFYZCK-UHFFFAOYSA-N	Clc1ncccc1C(=O)Nc2cccc(c2)c3nc4cccnc4s3	BroadT	BRD-K71210192	BRD-K71210192-001-07-7	Life Chemicals Inc.	F0694-0211			Clc1ncccc1C(=O)Nc1cccc(c1)-c1nc2cccnc2s1	InChI=1S/C18H11ClN4OS/c19-15-13(6-2-8-20-15)16(24)22-12-5-1-4-11(10-12)17-23-14-7-3-9-21-18(14)25-17/h1-10H,(H,22,24)	QZYAKMSAYFYZCK-UHFFFAOYSA-N	366.034209412							113236
AC1N9QV7	LSM-24648	SID24840640, BRD-K26251457	4365026	InChI=1S/C17H18N6O3S/c1-9-4-6-10(7-5-9)14-19-16(21-20-14)27-8-11(24)12-13(18)22(2)17(26)23(3)15(12)25/h4-7H,8,18H2,1-3H3,(H,19,20,21)	HVKDRLNUGSOKHE-UHFFFAOYSA-N	CN1C(=C(C(=O)CSc2n[nH]c(n2)c3ccc(C)cc3)C(=O)N(C)C1=O)N	BroadT	BRD-K26251457	BRD-K26251457-001-06-9	Enamine Ltd.	T5284714			Cc1ccc(cc1)-c1nc(SCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)n[nH]1	InChI=1S/C17H18N6O3S/c1-9-4-6-10(7-5-9)14-19-16(21-20-14)27-8-11(24)12-13(18)22(2)17(26)23(3)15(12)25/h4-7H,8,18H2,1-3H3,(H,19,20,21)	HVKDRLNUGSOKHE-UHFFFAOYSA-N	386.116109186							113237
MLS000706809	LSM-44074	SID24818605, BRD-A94736485	5821715	InChI=1S/C14H11F3N2O2S/c15-14(16,17)8-1-3-9(4-2-8)18-7-10-13(21)19-11(20)5-6-12(19)22-10/h1-4,7,12,18H,5-6H2/b10-7+	VRONHBPHCJBRMR-JXMROGBWSA-N	FC(F)(F)c1ccc(N\C=C/2\SC3CCC(=O)N3C2=O)cc1	BroadT	BRD-A94736485	BRD-A94736485-001-07-2	Key Organics Ltd.	5L-059			FC(F)(F)c1ccc(N\C=C2\SC3CCC(=O)N3C2=O)cc1	InChI=1S/C14H11F3N2O2S/c15-14(16,17)8-1-3-9(4-2-8)18-7-10-13(21)19-11(20)5-6-12(19)22-10/h1-4,7,12,18H,5-6H2/b10-7+	VRONHBPHCJBRMR-JXMROGBWSA-N	328.049332902							
MLS000676645	LSM-24650	SID24794776, BRD-K57604515	2937718	InChI=1S/C23H20N2O3/c26-16-7-4-6-15(14-16)25-22(27)18-9-5-8-17-20(24-12-2-1-3-13-24)11-10-19(21(17)18)23(25)28/h4-11,14,26H,1-3,12-13H2	UZAAGXXNSDUWGE-UHFFFAOYSA-N	Oc1cccc(c1)N2C(=O)c3cccc4c(ccc(C2=O)c34)N5CCCCC5	BroadT	BRD-K57604515	BRD-K57604515-001-07-9	ChemBridge Corporation	7376714			Oc1cccc(c1)N1C(=O)c2cccc3c(ccc(C1=O)c23)N1CCCCC1	InChI=1S/C23H20N2O3/c26-16-7-4-6-15(14-16)25-22(27)18-9-5-8-17-20(24-12-2-1-3-13-24)11-10-19(21(17)18)23(25)28/h4-11,14,26H,1-3,12-13H2	UZAAGXXNSDUWGE-UHFFFAOYSA-N	372.14739252							113239
1-(2-Methyl-1H-indol-3-yl)-2-(1,3-thiazol-2-ylamino)ethanone	LSM-24651	SID14741335, BRD-K57463842	912279	InChI=1S/C14H13N3OS/c1-9-13(10-4-2-3-5-11(10)17-9)12(18)8-16-14-15-6-7-19-14/h2-7,17H,8H2,1H3,(H,15,16)	YYPROXBGTVQYNC-UHFFFAOYSA-N	Cc1[nH]c2ccccc2c1C(=O)CNc3nccs3	BroadT	BRD-K57463842	BRD-K57463842-001-05-8	InterBioScreen Ltd.	STOCK1S-28659			Cc1[nH]c2ccccc2c1C(=O)CNc1nccs1	InChI=1S/C14H13N3OS/c1-9-13(10-4-2-3-5-11(10)17-9)12(18)8-16-14-15-6-7-19-14/h2-7,17H,8H2,1H3,(H,15,16)	YYPROXBGTVQYNC-UHFFFAOYSA-N	271.077932756							113240
ASN 07185383	LSM-24652	SID17407715, BRD-K30652426	1432744	InChI=1S/C18H16N6OS2/c1-2-15-23-24-18(27-15)22-14(25)10-26-16-8-7-11(9-19-16)17-20-12-5-3-4-6-13(12)21-17/h3-9H,2,10H2,1H3,(H,20,21)(H,22,24,25)	XNFITKQJNDDRLR-UHFFFAOYSA-N	CCc1nnc(NC(=O)CSc2ccc(cn2)c3nc4ccccc4[nH]3)s1	BroadT	BRD-K30652426	BRD-K30652426-001-06-0	Asinex Ltd.	ASN 07185383			CCc1nnc(NC(=O)CSc2ccc(cn2)-c2nc3ccccc3[nH]2)s1	InChI=1S/C18H16N6OS2/c1-2-15-23-24-18(27-15)22-14(25)10-26-16-8-7-11(9-19-16)17-20-12-5-3-4-6-13(12)21-17/h3-9H,2,10H2,1H3,(H,20,21)(H,22,24,25)	XNFITKQJNDDRLR-UHFFFAOYSA-N	396.082700572							113241
HMS2183B23	LSM-24653	BRD-K28712126	1138080	InChI=1S/C19H15BrN4O3/c1-12-9-16(23-22-12)18(25)24-21-11-14-10-15(20)7-8-17(14)27-19(26)13-5-3-2-4-6-13/h2-11H,1H3,(H,22,23)(H,24,25)	KAKKNVZHEPGZPU-UHFFFAOYSA-N	Cc1cc([nH]n1)C(=O)NN=Cc2cc(Br)ccc2OC(=O)c3ccccc3	BroadT	BRD-K28712126	BRD-K28712126-001-05-1	Asinex Ltd.	BAS 00282229			Cc1cc([nH]n1)C(=O)NN=Cc1cc(Br)ccc1OC(=O)c1ccccc1	InChI=1S/C19H15BrN4O3/c1-12-9-16(23-22-12)18(25)24-21-11-14-10-15(20)7-8-17(14)27-19(26)13-5-3-2-4-6-13/h2-11H,1H3,(H,22,23)(H,24,25)	KAKKNVZHEPGZPU-UHFFFAOYSA-N	426.03275298							113242
SMR000065536	LSM-24654	SID3711123, BRD-K69872348	732207	InChI=1S/C17H16N6/c1-11-9-12(2)22(21-11)16-15-10-18-23(14-7-5-4-6-8-14)17(15)20-13(3)19-16/h4-10H,1-3H3	SVVOJSDMHHIDDM-UHFFFAOYSA-N	Cc1cc(C)n(n1)c2nc(C)nc3c2cnn3c4ccccc4	BroadT	BRD-K69872348	BRD-K69872348-001-05-5	Enamine Ltd.	T0501-7941			Cc1cc(C)n(n1)-c1nc(C)nc2n(ncc12)-c1ccccc1	InChI=1S/C17H16N6/c1-11-9-12(2)22(21-11)16-15-10-18-23(14-7-5-4-6-8-14)17(15)20-13(3)19-16/h4-10H,1-3H3	SVVOJSDMHHIDDM-UHFFFAOYSA-N	304.143644572							113243
AC1OA6GV	LSM-24655	SID26658960, BRD-A78475860	6799889	InChI=1S/C24H18BrN3O3/c1-14(29)28-20(21-8-5-11-31-21)13-19(27-28)23-22(15-6-3-2-4-7-15)17-12-16(25)9-10-18(17)26-24(23)30/h2-12,20H,13H2,1H3,(H,26,30)	GKOJHBVVRMOYJR-UHFFFAOYSA-N	CC(=O)N1N=C(CC1c2occc2)c3c(O)nc4ccc(Br)cc4c3c5ccccc5	BroadT	BRD-A78475860	BRD-A78475860-001-05-6	InterBioScreen Ltd.	STOCK2S-02048			CC(=O)N1N=C(CC1c1ccco1)c1c(O)nc2ccc(Br)cc2c1-c1ccccc1	InChI=1S/C24H18BrN3O3/c1-14(29)28-20(21-8-5-11-31-21)13-19(27-28)23-22(15-6-3-2-4-7-15)17-12-16(25)9-10-18(17)26-24(23)30/h2-12,20H,13H2,1H3,(H,26,30)	GKOJHBVVRMOYJR-UHFFFAOYSA-N	475.053154066							
MLS000335437	LSM-24656	SID22409956, BRD-K10689430	2494828	InChI=1S/C20H17N3O2S/c1-24-16-9-8-14(10-17(16)25-2)23-19-15-11-18(13-6-4-3-5-7-13)26-20(15)22-12-21-19/h3-12H,1-2H3,(H,21,22,23)	XUXTVLKGKGXAFS-UHFFFAOYSA-N	COc1ccc(Nc2ncnc3sc(cc23)c4ccccc4)cc1OC	BroadT	BRD-K10689430	BRD-K10689430-001-06-0	Enamine Ltd.	T0519-7050			COc1ccc(Nc2ncnc3sc(cc23)-c2ccccc2)cc1OC	InChI=1S/C20H17N3O2S/c1-24-16-9-8-14(10-17(16)25-2)23-19-15-11-18(13-6-4-3-5-7-13)26-20(15)22-12-21-19/h3-12H,1-2H3,(H,21,22,23)	XUXTVLKGKGXAFS-UHFFFAOYSA-N	363.104147504							113245
MLS000675077	LSM-24657	SID24823277, BRD-K47371926	2153943	InChI=1S/C18H16N4O3/c23-17-14(10-12-4-2-1-3-5-12)21-22-18(20-17)19-13-6-7-15-16(11-13)25-9-8-24-15/h1-7,11H,8-10H2,(H2,19,20,22,23)	IXEPHBCNXPNLPS-UHFFFAOYSA-N	Oc1nc(Nc2ccc3OCCOc3c2)nnc1Cc4ccccc4	BroadT	BRD-K47371926	BRD-K47371926-001-06-3	ChemDiv Inc.	C102-0087			Oc1nc(Nc2ccc3OCCOc3c2)nnc1Cc1ccccc1	InChI=1S/C18H16N4O3/c23-17-14(10-12-4-2-1-3-5-12)21-22-18(20-17)19-13-6-7-15-16(11-13)25-9-8-24-15/h1-7,11H,8-10H2,(H2,19,20,22,23)	IXEPHBCNXPNLPS-UHFFFAOYSA-N	336.122240412							113246
4-(4-Ethyl-1-piperazinyl)-4-oxo-2-butenoic acid	LSM-44075	SID17386572, BRD-K28099217	1561995	InChI=1S/C10H16N2O3/c1-2-11-5-7-12(8-6-11)9(13)3-4-10(14)15/h3-4H,2,5-8H2,1H3,(H,14,15)/b4-3-	RZWNXLICCRVKFW-ARJAWSKDSA-N	CCN1CCN(CC1)C(=O)\C=C/C(=O)O	BroadT	BRD-K28099217	BRD-K28099217-001-06-1	Specs	AF-399/15286623			CCN1CCN(CC1)C(=O)\C=C/C(O)=O	InChI=1S/C10H16N2O3/c1-2-11-5-7-12(8-6-11)9(13)3-4-10(14)15/h3-4H,2,5-8H2,1H3,(H,14,15)/b4-3-	RZWNXLICCRVKFW-ARJAWSKDSA-N	212.116092392							
N-(5-Nitropyridin-2-yl)cyclopropanecarboxamide	LSM-24659	SID22413227, BRD-K24334642	2849565	InChI=1S/C9H9N3O3/c13-9(6-1-2-6)11-8-4-3-7(5-10-8)12(14)15/h3-6H,1-2H2,(H,10,11,13)	PXQMSCKKVCXUKO-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NC(=O)C2CC2)nc1	BroadT	BRD-K24334642	BRD-K24334642-001-07-9	Specs	AK-968/11368870			[O-][N+](=O)c1ccc(NC(=O)C2CC2)nc1	InChI=1S/C9H9N3O3/c13-9(6-1-2-6)11-8-4-3-7(5-10-8)12(14)15/h3-6H,1-2H2,(H,10,11,13)	PXQMSCKKVCXUKO-UHFFFAOYSA-N	207.064391178							113248
MLS000696309	LSM-24660	SID24820494, BRD-K52437089	2768723	InChI=1S/C10H10ClN3O2S/c1-12-9(16)14-10(17)13-8(15)6-4-2-3-5-7(6)11/h2-5H,1H3,(H3,12,13,14,15,16,17)	APLGEAWUXWPDAF-UHFFFAOYSA-N	CNC(=O)NC(=S)NC(=O)c1ccccc1Cl	BroadT	BRD-K52437089	BRD-K52437089-001-06-7	Key Organics Ltd.	12F-943			CNC(=O)NC(=S)NC(=O)c1ccccc1Cl	InChI=1S/C10H10ClN3O2S/c1-12-9(16)14-10(17)13-8(15)6-4-2-3-5-7(6)11/h2-5H,1H3,(H3,12,13,14,15,16,17)	APLGEAWUXWPDAF-UHFFFAOYSA-N	271.01822499							113249
MLS001101234	LSM-24661	SID49737600, BRD-K50051701	24794264	InChI=1S/C24H27N3O4/c1-2-30-24(29)27-15-13-26(14-16-27)23(28)19-11-12-21-20(17-19)25-22(31-21)10-6-9-18-7-4-3-5-8-18/h3-5,7-8,11-12,17H,2,6,9-10,13-16H2,1H3	CVWRUIBDKGFONX-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)c2ccc3oc(CCCc4ccccc4)nc3c2	BroadT	BRD-K50051701	BRD-K50051701-001-06-6	ChemBridge Corporation	84342050			CCOC(=O)N1CCN(CC1)C(=O)c1ccc2oc(CCCc3ccccc3)nc2c1	InChI=1S/C24H27N3O4/c1-2-30-24(29)27-15-13-26(14-16-27)23(28)19-11-12-21-20(17-19)25-22(31-21)10-6-9-18-7-4-3-5-8-18/h3-5,7-8,11-12,17H,2,6,9-10,13-16H2,1H3	CVWRUIBDKGFONX-UHFFFAOYSA-N	421.200156374							113250
MLS-0425616.0001	LSM-2145	SID99495607, BRD-K07398339, SID85248362	44229066	InChI=1S/C14H13N3O3S/c1-20-10-6-8-11(9-7-10)21(18,19)17-13-5-3-2-4-12(13)16-14(17)15/h2-9H,1H3,(H2,15,16)	HPRFQHGWMAWFQS-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)n2c(N)nc3ccccc23	BroadT	BRD-K07398339	BRD-K07398339-001-01-6	Sanford-Burnham Medical Research Institute	MLS-0425616			COc1ccc(cc1)S(=O)(=O)n1c(N)nc2ccccc12	InChI=1S/C14H13N3O3S/c1-20-10-6-8-11(9-7-10)21(18,19)17-13-5-3-2-4-12(13)16-14(17)15/h2-9H,1H3,(H2,15,16)	HPRFQHGWMAWFQS-UHFFFAOYSA-N	303.067761996							131179
BAS 11177910	LSM-24662	SID22401771, BRD-A86317787	3160914	InChI=1S/C18H13FN4OS/c1-8-12(7-20)17(21)23-15-14-11(9-2-4-10(19)5-3-9)6-13(24)22-18(14)25-16(8)15/h2-5,11H,6H2,1H3,(H2,21,23)(H,22,24)	ZCRVHSPMHWSJDQ-UHFFFAOYSA-N	Cc1c(C#N)c(N)nc2c3C(CC(=O)Nc3sc12)c4ccc(F)cc4	BroadT	BRD-A86317787	BRD-A86317787-001-06-8	InterBioScreen Ltd.	STOCK3S-51383			Cc1c(C#N)c(N)nc2c3C(CC(=O)Nc3sc12)c1ccc(F)cc1	InChI=1S/C18H13FN4OS/c1-8-12(7-20)17(21)23-15-14-11(9-2-4-10(19)5-3-9)6-13(24)22-18(14)25-16(8)15/h2-5,11H,6H2,1H3,(H2,21,23)(H,22,24)	ZCRVHSPMHWSJDQ-UHFFFAOYSA-N	352.079409966							113251
F1843-0118	LSM-24663	SID51086765, BRD-A02006716	18561410	InChI=1S/C18H19N5O7S/c24-17(20-11-13-3-1-2-8-19-13)18(25)21-12-16-22(9-10-30-16)31(28,29)15-6-4-14(5-7-15)23(26)27/h1-8,16H,9-12H2,(H,20,24)(H,21,25)	VSLPBKNLYPSHRF-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N2CCOC2CNC(=O)C(=O)NCc3ccccn3	BroadT	BRD-A02006716	BRD-A02006716-001-05-6	Life Chemicals Inc.	F1843-0118			[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N1CCOC1CNC(=O)C(=O)NCc1ccccn1	InChI=1S/C18H19N5O7S/c24-17(20-11-13-3-1-2-8-19-13)18(25)21-12-16-22(9-10-30-16)31(28,29)15-6-4-14(5-7-15)23(26)27/h1-8,16H,9-12H2,(H,20,24)(H,21,25)	VSLPBKNLYPSHRF-UHFFFAOYSA-N	449.100518688							113252
AC1O9HNE	LSM-24664	BRD-K81299105	6786424	InChI=1S/C10H9N5O3/c1-7-2-8(4-13-14-5-11-12-6-14)10(16)9(3-7)15(17)18/h2-6,16H,1H3	SMUYMBZSRSAOJA-UHFFFAOYSA-N	Cc1cc(C=Nn2cnnc2)c(O)c(c1)[N+](=O)[O-]	BroadT	BRD-K81299105	BRD-K81299105-001-05-8	ChemBridge Corporation	5302611			Cc1cc(C=Nn2cnnc2)c(O)c(c1)[N+]([O-])=O	InChI=1S/C10H9N5O3/c1-7-2-8(4-13-14-5-11-12-6-14)10(16)9(3-7)15(17)18/h2-6,16H,1H3	SMUYMBZSRSAOJA-UHFFFAOYSA-N	247.070539198							
N,2-Dimethyl-n-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]furan-3-carboxamide	LSM-24665	SID49680999, BRD-K35281316	6494711	InChI=1S/C16H15N3O3/c1-11-13(8-9-21-11)16(20)19(2)10-14-17-15(18-22-14)12-6-4-3-5-7-12/h3-9H,10H2,1-2H3	HREZQUJFLIDAIK-UHFFFAOYSA-N	CN(Cc1onc(n1)c2ccccc2)C(=O)c3ccoc3C	BroadT	BRD-K35281316	BRD-K35281316-001-05-8	Asinex Ltd.	ASN 13319517			CN(Cc1nc(no1)-c1ccccc1)C(=O)c1ccoc1C	InChI=1S/C16H15N3O3/c1-11-13(8-9-21-11)16(20)19(2)10-14-17-15(18-22-14)12-6-4-3-5-7-12/h3-9H,10H2,1-2H3	HREZQUJFLIDAIK-UHFFFAOYSA-N	297.11134137							113254
ST084279	LSM-24666	SID4263613, BRD-K71620863	1254675	InChI=1S/C20H17NO5/c1-25-15-9-7-14(8-10-15)19(22)21-12-18-16(20(23)24)11-17(26-18)13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,21,22)(H,23,24)	ZYICUUHPFRPTHO-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NCc2oc(cc2C(=O)O)c3ccccc3	BroadT	BRD-K71620863	BRD-K71620863-001-06-7	ChemBridge Corporation	7913214			COc1ccc(cc1)C(=O)NCc1oc(cc1C(O)=O)-c1ccccc1	InChI=1S/C20H17NO5/c1-25-15-9-7-14(8-10-15)19(22)21-12-18-16(20(23)24)11-17(26-18)13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,21,22)(H,23,24)	ZYICUUHPFRPTHO-UHFFFAOYSA-N	351.110672654							113255
AC1N24RM	LSM-24667	BRD-K15002752	4016059	InChI=1S/C25H21N3O2/c29-25(18-26-24-15-7-10-20-9-4-5-14-23(20)24)28-27-17-19-8-6-13-22(16-19)30-21-11-2-1-3-12-21/h1-17,26H,18H2,(H,28,29)	DXFTWWXWGYWTGV-UHFFFAOYSA-N	O=C(CNc1cccc2ccccc12)NN=Cc3cccc(Oc4ccccc4)c3	BroadT	BRD-K15002752	BRD-K15002752-001-05-3	ChemDiv Inc.	1761-0304			O=C(CNc1cccc2ccccc12)NN=Cc1cccc(Oc2ccccc2)c1	InChI=1S/C25H21N3O2/c29-25(18-26-24-15-7-10-20-9-4-5-14-23(20)24)28-27-17-19-8-6-13-22(16-19)30-21-11-2-1-3-12-21/h1-17,26H,18H2,(H,28,29)	DXFTWWXWGYWTGV-UHFFFAOYSA-N	395.163376942							113256
MLS000710868	LSM-24668	BRD-K29334892	830668	InChI=1S/C16H12N2OS/c1-2-15(19)17-16-18(12-8-4-3-5-9-12)13-10-6-7-11-14(13)20-16/h2-11H,1H2	XXHCDOHPIMQVNF-UHFFFAOYSA-N	C=CC(=O)N=C1Sc2ccccc2N1c3ccccc3	BroadT	BRD-K29334892	BRD-K29334892-001-05-5	Asinex Ltd.	BAS 00280995			C=CC(=O)N=c1sc2ccccc2n1-c1ccccc1	InChI=1S/C16H12N2OS/c1-2-15(19)17-16-18(12-8-4-3-5-9-12)13-10-6-7-11-14(13)20-16/h2-11H,1H2	XXHCDOHPIMQVNF-UHFFFAOYSA-N	280.067033714							113257
2,4-Dichloro-5-[(furan-2-ylmethyl)-sulfamoyl]-benzoic acid	LSM-24669	SID7972449, BRD-K19879736	2880064	InChI=1S/C12H9Cl2NO5S/c13-9-5-10(14)11(4-8(9)12(16)17)21(18,19)15-6-7-2-1-3-20-7/h1-5,15H,6H2,(H,16,17)	LTLCPKPWNLFQRV-UHFFFAOYSA-N	OC(=O)c1cc(c(Cl)cc1Cl)S(=O)(=O)NCc2occc2	BroadT	BRD-K19879736	BRD-K19879736-001-06-9	ChemBridge Corporation	5994785			OC(=O)c1cc(c(Cl)cc1Cl)S(=O)(=O)NCc1ccco1	InChI=1S/C12H9Cl2NO5S/c13-9-5-10(14)11(4-8(9)12(16)17)21(18,19)15-6-7-2-1-3-20-7/h1-5,15H,6H2,(H,16,17)	LTLCPKPWNLFQRV-UHFFFAOYSA-N	348.957848508							113258
BRD-A55601095	LSM-24670			InChI=1S/C27H27NO2/c1-15(2)16-9-11-17(12-10-16)22-23-20(13-27(3,4)14-21(23)29)28-25-18-7-5-6-8-19(18)26(30)24(22)25/h5-12,15,22,24H,13-14H2,1-4H3	DUTCISDEQLDGHW-UHFFFAOYSA-N	CC(C)c1ccc(cc1)C2C3C(=O)c4ccccc4C3=NC5=C2C(=O)CC(C)(C)C5	BroadT	BRD-A55601095	BRD-A55601095-001-06-9	Asinex Ltd.	BAS 03450563			CC(C)c1ccc(cc1)C1C2C(=O)c3ccccc3C2=NC2=C1C(=O)CC(C)(C)C2	InChI=1S/C27H27NO2/c1-15(2)16-9-11-17(12-10-16)22-23-20(13-27(3,4)14-21(23)29)28-25-18-7-5-6-8-19(18)26(30)24(22)25/h5-12,15,22,24H,13-14H2,1-4H3	DUTCISDEQLDGHW-UHFFFAOYSA-N	397.204179114							113259
MLS001096207	LSM-24671	SID24405410, SID49719397, BRD-K21691129	16026931	InChI=1S/C24H29FN6O/c1-16-7-8-19(15-21(16)25)26-24(32)12-9-20-17(2)29-31(18(20)3)23-11-10-22(27-28-23)30-13-5-4-6-14-30/h7-8,10-11,15H,4-6,9,12-14H2,1-3H3,(H,26,32)	YNEKBYCUXVEKOZ-UHFFFAOYSA-N	Cc1ccc(NC(=O)CCc2c(C)nn(c2C)c3ccc(nn3)N4CCCCC4)cc1F	BroadT	BRD-K21691129	BRD-K21691129-001-05-1	ChemDiv Inc.	G267-0893			Cc1nn(c(C)c1CCC(=O)Nc1ccc(C)c(F)c1)-c1ccc(nn1)N1CCCCC1	InChI=1S/C24H29FN6O/c1-16-7-8-19(15-21(16)25)26-24(32)12-9-20-17(2)29-31(18(20)3)23-11-10-22(27-28-23)30-13-5-4-6-14-30/h7-8,10-11,15H,4-6,9,12-14H2,1-3H3,(H,26,32)	YNEKBYCUXVEKOZ-UHFFFAOYSA-N	436.238687808							113260
5-(3,4-Dimethoxyphenyl)-n-(furan-2-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide	LSM-24672	SID14732686, BRD-K86743038	1110965	InChI=1S/C21H17F3N4O4/c1-30-16-6-5-12(8-17(16)31-2)14-9-18(21(22,23)24)28-19(26-14)10-15(27-28)20(29)25-11-13-4-3-7-32-13/h3-10H,11H2,1-2H3,(H,25,29)	JRGHRLVWXOQJGK-UHFFFAOYSA-N	COc1ccc(cc1OC)c2cc(n3nc(cc3n2)C(=O)NCc4occc4)C(F)(F)F	BroadT	BRD-K86743038	BRD-K86743038-001-06-0	ChemBridge Corporation	5848213			COc1ccc(cc1OC)-c1cc(n2nc(cc2n1)C(=O)NCc1ccco1)C(F)(F)F	InChI=1S/C21H17F3N4O4/c1-30-16-6-5-12(8-17(16)31-2)14-9-18(21(22,23)24)28-19(26-14)10-15(27-28)20(29)25-11-13-4-3-7-32-13/h3-10H,11H2,1-2H3,(H,25,29)	JRGHRLVWXOQJGK-UHFFFAOYSA-N	446.120189664							113261
6-Nitro-2,3,4,9-tetrahydro-1H-carbazole-1-carbonitrile	LSM-24673	SID26659540, BRD-A12692560	3569860	InChI=1S/C13H11N3O2/c14-7-8-2-1-3-10-11-6-9(16(17)18)4-5-12(11)15-13(8)10/h4-6,8,15H,1-3H2	ZQXSMKCINAMFOJ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2[nH]c3C(CCCc3c2c1)C#N	BroadT	BRD-A12692560	BRD-A12692560-001-06-6	InterBioScreen Ltd.	STOCK1S-50160			[O-][N+](=O)c1ccc2[nH]c3C(CCCc3c2c1)C#N	InChI=1S/C13H11N3O2/c14-7-8-2-1-3-10-11-6-9(16(17)18)4-5-12(11)15-13(8)10/h4-6,8,15H,1-3H2	ZQXSMKCINAMFOJ-UHFFFAOYSA-N	241.085126622							113262
2-Phenylimidazo[1,2-a]pyridine-3-carbaldehyde	LSM-24674	SID24830695, BRD-K18154038	820933	InChI=1S/C14H10N2O/c17-10-12-14(11-6-2-1-3-7-11)15-13-8-4-5-9-16(12)13/h1-10H	GDQWGRMPXASNTI-UHFFFAOYSA-N	O=Cc1c(nc2ccccn12)c3ccccc3	BroadT	BRD-K18154038	BRD-K18154038-001-06-3	Enamine Ltd.	T0505-8214			O=Cc1c(nc2ccccn12)-c1ccccc1	InChI=1S/C14H10N2O/c17-10-12-14(11-6-2-1-3-7-11)15-13-8-4-5-9-16(12)13/h1-10H	GDQWGRMPXASNTI-UHFFFAOYSA-N	222.07931296							113263
SMR000136772	LSM-24675	SID14746338, BRD-K53769830	1302358	InChI=1S/C16H13N3O2/c17-15-14(11-4-2-1-3-5-11)10-18-19(15)13-8-6-12(7-9-13)16(20)21/h1-10H,17H2,(H,20,21)	GMBHXFKGJRDYAD-UHFFFAOYSA-N	Nc1c(cnn1c2ccc(cc2)C(=O)O)c3ccccc3	BroadT	BRD-K53769830	BRD-K53769830-001-05-6	ChemBridge Corporation	7905106			Nc1c(cnn1-c1ccc(cc1)C(O)=O)-c1ccccc1	InChI=1S/C16H13N3O2/c17-15-14(11-4-2-1-3-5-11)10-18-19(15)13-8-6-12(7-9-13)16(20)21/h1-10H,17H2,(H,20,21)	GMBHXFKGJRDYAD-UHFFFAOYSA-N	279.100776686							113264
ZINC02656067	LSM-24676	SID24824688, BRD-K65809460	2119758	InChI=1S/C19H22ClN3O2/c1-3-25-18-16(5-4-8-21-18)19(24)23-11-9-22(10-12-23)17-13-15(20)7-6-14(17)2/h4-8,13H,3,9-12H2,1-2H3	CBVFPRUULJLOTQ-UHFFFAOYSA-N	CCOc1ncccc1C(=O)N2CCN(CC2)c3cc(Cl)ccc3C	BroadT	BRD-K65809460	BRD-K65809460-001-05-3	Enamine Ltd.	T5272353			CCOc1ncccc1C(=O)N1CCN(CC1)c1cc(Cl)ccc1C	InChI=1S/C19H22ClN3O2/c1-3-25-18-16(5-4-8-21-18)19(24)23-11-9-22(10-12-23)17-13-15(20)7-6-14(17)2/h4-8,13H,3,9-12H2,1-2H3	CBVFPRUULJLOTQ-UHFFFAOYSA-N	359.140054684							113265
BRD-K95385525	LSM-24677		44505332	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19-,21-/m0/s1	BGKHIKCFNCIYGU-ZJOUEHCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K95385525	BRD-K95385525-001-01-0	Broad Institute of MIT and Harvard	BRD-K95385525			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19-,21-/m0/s1	BGKHIKCFNCIYGU-ZJOUEHCJSA-N	493.23588996							113266
MLS003129224	LSM-24678	BRD-K50190949	44495959	InChI=1S/C18H31N5O5/c1-13-9-22(14(2)11-24)17(25)6-5-7-23-15(8-19-20-23)12-28-16(13)10-21(3)18(26)27-4/h8,13-14,16,24H,5-7,9-12H2,1-4H3/t13-,14+,16-/m0/s1	BOUWOFDIRQBKSW-LZWOXQAQSA-N	COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K50190949	BRD-K50190949-001-02-3	Broad Institute of MIT and Harvard	BRD-K50190949			COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C18H31N5O5/c1-13-9-22(14(2)11-24)17(25)6-5-7-23-15(8-19-20-23)12-28-16(13)10-21(3)18(26)27-4/h8,13-14,16,24H,5-7,9-12H2,1-4H3/t13-,14+,16-/m0/s1	BOUWOFDIRQBKSW-LZWOXQAQSA-N	397.232519142							113267
BRD-K46924722	LSM-24679		44485066	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20+,23-/m1/s1	PUSZFNDBKFADMS-ZRCGQRJVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K46924722	BRD-K46924722-001-01-7	Broad Institute of MIT and Harvard	BRD-K46924722			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20+,23-/m1/s1	PUSZFNDBKFADMS-ZRCGQRJVSA-N	544.31216646							113268
MLS003129186	LSM-24680	BRD-K69808609, SID99357515	44505475	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18+,22+/m1/s1	GQDZDOSXBZGUQJ-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K69808609	BRD-K69808609-001-02-0	Broad Institute of MIT and Harvard	BRD-K69808609			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18+,22+/m1/s1	GQDZDOSXBZGUQJ-FGSXEWAUSA-N	445.26890465							113269
BRD-K34720817	LSM-24681		44505629	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19-,22+/m0/s1	ZIMKOTFORJXDIC-CNNODRBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K34720817	BRD-K34720817-001-01-9	Broad Institute of MIT and Harvard	BRD-K34720817			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19-,22+/m0/s1	ZIMKOTFORJXDIC-CNNODRBYSA-N	435.320940222							113270
MLS003129417	LSM-24682	BRD-K46961295, SID99357715	44488161	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)9-6-10-29-12-18(26-27-29)15-34-21(16)13-28(3)23(33)25-20-8-5-4-7-19(20)24/h4-5,7-8,12,16-17,21,31H,6,9-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21+/m1/s1	UGDLKAPALXLDHQ-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K46961295	BRD-K46961295-001-02-4	Broad Institute of MIT and Harvard	BRD-K46961295			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)9-6-10-29-12-18(26-27-29)15-34-21(16)13-28(3)23(33)25-20-8-5-4-7-19(20)24/h4-5,7-8,12,16-17,21,31H,6,9-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21+/m1/s1	UGDLKAPALXLDHQ-LZJOCLMNSA-N	476.254731796							113271
BRD-K08009212	LSM-24683		44505055	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22-/m0/s1	YNSZNIPNNMZZOV-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K08009212	BRD-K08009212-001-01-0	Broad Institute of MIT and Harvard	BRD-K08009212			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22-/m0/s1	YNSZNIPNNMZZOV-SPEDKVCISA-N	445.26890465							113272
BRD-K48764596	LSM-24684		44505221	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20+,23-/m1/s1	UFUZIZHGCRPPRZ-ZRCGQRJVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K48764596	BRD-K48764596-001-01-8	Broad Institute of MIT and Harvard	BRD-K48764596			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20+,23-/m1/s1	UFUZIZHGCRPPRZ-ZRCGQRJVSA-N	443.289640094							113273
BRD-K44613656	LSM-24685		44494485	InChI=1S/C27H42N6O4/c1-19-14-33(20(2)17-34)25(35)8-7-13-32-15-23(29-30-32)18-37-24(19)16-31(6)26(36)28-22-11-9-21(10-12-22)27(3,4)5/h9-12,15,19-20,24,34H,7-8,13-14,16-18H2,1-6H3,(H,28,36)/t19-,20-,24-/m0/s1	APMQHRQBDHMONS-SKPFHBQLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(C)(C)C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K44613656	BRD-K44613656-001-01-8	Broad Institute of MIT and Harvard	BRD-K44613656			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(C)(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H42N6O4/c1-19-14-33(20(2)17-34)25(35)8-7-13-32-15-23(29-30-32)18-37-24(19)16-31(6)26(36)28-22-11-9-21(10-12-22)27(3,4)5/h9-12,15,19-20,24,34H,7-8,13-14,16-18H2,1-6H3,(H,28,36)/t19-,20-,24-/m0/s1	APMQHRQBDHMONS-SKPFHBQLSA-N	514.326753884							113274
BRD-K97339945	LSM-24686		44506001	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19+/m0/s1	MNAJUJYQFCFYAB-JENIJYKNSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K97339945	BRD-K97339945-001-01-7	Broad Institute of MIT and Harvard	BRD-K97339945			CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19+/m0/s1	MNAJUJYQFCFYAB-JENIJYKNSA-N	439.279469334							113275
BRD-K35324337	LSM-24687		44506057	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20-,23+/m1/s1	MEJUTVOAQGGYHA-VIZSFHNOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K35324337	BRD-K35324337-001-01-0	Broad Institute of MIT and Harvard	BRD-K35324337			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20-,23+/m1/s1	MEJUTVOAQGGYHA-VIZSFHNOSA-N	443.289640094							113276
BRD-K07798964	LSM-24688		44485767	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19+,23-/m1/s1	AIDUMHXRFRBIIP-SELNLUPBSA-N	COc1ccccc1CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K07798964	BRD-K07798964-001-01-9	Broad Institute of MIT and Harvard	BRD-K07798964			COc1ccccc1CN(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19+,23-/m1/s1	AIDUMHXRFRBIIP-SELNLUPBSA-N	459.284554714							113277
BRD-K13279882	LSM-24689		44505215	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18+,21-/m0/s1	QSHHTQCGWZKCKD-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K13279882	BRD-K13279882-001-01-1	Broad Institute of MIT and Harvard	BRD-K13279882			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18+,21-/m0/s1	QSHHTQCGWZKCKD-UEXGIBASSA-N	430.269239008							113278
MLS003129373	LSM-24690	BRD-K88662980, SID99357679	44498544	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18+,22+/m0/s1	DYYSINDAYMXOAQ-NJNPRVFISA-N	COc1ccc(OC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K88662980	BRD-K88662980-001-02-7	Broad Institute of MIT and Harvard	BRD-K88662980			COc1ccc(OC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18+,22+/m0/s1	DYYSINDAYMXOAQ-NJNPRVFISA-N	489.25873389							113279
BRD-K33272704	LSM-24691		44505462	InChI=1S/C23H41N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h12,18-20,22,29H,4-11,13-17H2,1-3H3/t18-,19-,22-/m0/s1	OPQMCYKWZYLZJV-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K33272704	BRD-K33272704-001-01-8	Broad Institute of MIT and Harvard	BRD-K33272704			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H41N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h12,18-20,22,29H,4-11,13-17H2,1-3H3/t18-,19-,22-/m0/s1	OPQMCYKWZYLZJV-IPJJNNNSSA-N	435.320940222							113280
BRD-K88072146-001-01-2	LSM-24692	BRD-K88072146	44505907	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18+,22-/m1/s1	QZCZRKJJOTUXQW-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K88072146	BRD-K88072146-001-01-2	Broad Institute of MIT and Harvard	BRD-K88072146			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18+,22-/m1/s1	QZCZRKJJOTUXQW-KGVIQGDOSA-N	497.261374598							113281
BRD-K99446825	LSM-24693		44505143	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19+,22-/m0/s1	GKHFKOWAUNRHGL-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K99446825	BRD-K99446825-001-01-3	Broad Institute of MIT and Harvard	BRD-K99446825			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19+,22-/m0/s1	GKHFKOWAUNRHGL-JQVVWYNYSA-N	493.23588996							113282
BRD-K73227539	LSM-24694		44505391	InChI=1S/C22H40N6O4/c1-17-13-27(18(2)15-29)22(31)9-7-11-28-19(12-23-24-28)16-32-20(17)14-26(5)21(30)8-6-10-25(3)4/h12,17-18,20,29H,6-11,13-16H2,1-5H3/t17-,18+,20-/m1/s1	HUEUWTADLJASSZ-WSTZPKSXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K73227539	BRD-K73227539-001-01-4	Broad Institute of MIT and Harvard	BRD-K73227539			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCc2cnnn2CCCC1=O	InChI=1S/C22H40N6O4/c1-17-13-27(18(2)15-29)22(31)9-7-11-28-19(12-23-24-28)16-32-20(17)14-26(5)21(30)8-6-10-25(3)4/h12,17-18,20,29H,6-11,13-16H2,1-5H3/t17-,18+,20-/m1/s1	HUEUWTADLJASSZ-WSTZPKSXSA-N	452.31110382							113283
BRD-K86263698	LSM-24695		44505057	InChI=1S/C22H39N5O3/c1-17-11-27(18(2)15-28)22(29)9-6-10-26-13-20(23-24-26)16-30-21(17)14-25(3)12-19-7-4-5-8-19/h13,17-19,21,28H,4-12,14-16H2,1-3H3/t17-,18+,21+/m0/s1	FRGWQMAVHSUOQI-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K86263698	BRD-K86263698-001-01-1	Broad Institute of MIT and Harvard	BRD-K86263698			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H39N5O3/c1-17-11-27(18(2)15-28)22(29)9-6-10-26-13-20(23-24-26)16-30-21(17)14-25(3)12-19-7-4-5-8-19/h13,17-19,21,28H,4-12,14-16H2,1-3H3/t17-,18+,21+/m0/s1	FRGWQMAVHSUOQI-WAOWUJCRSA-N	421.305290158							113284
BRD-K13071687	LSM-24696		44489807	InChI=1S/C18H31N5O5/c1-13-8-23(14(2)11-24)17(25)6-5-7-22-9-15(19-20-22)12-28-16(13)10-21(3)18(26)27-4/h9,13-14,16,24H,5-8,10-12H2,1-4H3/t13-,14-,16-/m1/s1	UUDITCQIVHGHRN-IIAWOOMASA-N	COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K13071687	BRD-K13071687-001-01-9	Broad Institute of MIT and Harvard	BRD-K13071687			COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C18H31N5O5/c1-13-8-23(14(2)11-24)17(25)6-5-7-22-9-15(19-20-22)12-28-16(13)10-21(3)18(26)27-4/h9,13-14,16,24H,5-8,10-12H2,1-4H3/t13-,14-,16-/m1/s1	UUDITCQIVHGHRN-IIAWOOMASA-N	397.232519142							113285
MLS003129732	LSM-23964	SID99358175, BRD-K63778487	44506002	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19-/m0/s1	MNAJUJYQFCFYAB-LNLFQRSKSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K63778487	BRD-K63778487-001-02-8	Broad Institute of MIT and Harvard	BRD-K63778487			CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19-/m0/s1	MNAJUJYQFCFYAB-LNLFQRSKSA-N	439.279469334							112554
BRD-K18562847	LSM-24697		44505254	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)6-5-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-9-22(32-4)10-8-20/h7-10,14,18-19,23,30H,5-6,11-13,15-17H2,1-4H3/t18-,19-,23-/m0/s1	DSHXGOUIOHRIOZ-YDHSSHFGSA-N	COc1ccc(CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)cc1	BroadT	BRD-K18562847	BRD-K18562847-001-01-9	Broad Institute of MIT and Harvard	BRD-K18562847			COc1ccc(CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)cc1	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)6-5-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-9-22(32-4)10-8-20/h7-10,14,18-19,23,30H,5-6,11-13,15-17H2,1-4H3/t18-,19-,23-/m0/s1	DSHXGOUIOHRIOZ-YDHSSHFGSA-N	459.284554714							113286
MLS003129260	LSM-24698	SID99357525, BRD-K73261251	44504942	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19+,22+/m0/s1	GKHFKOWAUNRHGL-NNMXDRDESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K73261251	BRD-K73261251-001-02-7	Broad Institute of MIT and Harvard	BRD-K73261251			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19+,22+/m0/s1	GKHFKOWAUNRHGL-NNMXDRDESA-N	493.23588996							113287
MLS003129233	LSM-24699	BRD-K67409155	44505059	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19+,23+/m1/s1	GEARZFJDEYGDIT-MSYCTHLASA-N	COc1cccc(CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K67409155	BRD-K67409155-001-02-7	Broad Institute of MIT and Harvard	BRD-K67409155			COc1cccc(CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)c1	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19+,23+/m1/s1	GEARZFJDEYGDIT-MSYCTHLASA-N	459.284554714							113288
BRD-K32787834	LSM-24700		44492065	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20+,25+/m0/s1	VRVGAAPGNIASDT-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K32787834	BRD-K32787834-001-01-9	Broad Institute of MIT and Harvard	BRD-K32787834			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20+,25+/m0/s1	VRVGAAPGNIASDT-WZOHSFFVSA-N	500.31110382							113289
MLS003129530	LSM-24701	BRD-K04275703, SID99357909	44505781	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18+,22+/m1/s1	DYYSINDAYMXOAQ-FGSXEWAUSA-N	COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K04275703	BRD-K04275703-001-02-5	Broad Institute of MIT and Harvard	BRD-K04275703			COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18+,22+/m1/s1	DYYSINDAYMXOAQ-FGSXEWAUSA-N	489.25873389							113290
MLS003129225	LSM-24702	BRD-K02809100, SID99357428	44505131	InChI=1S/C22H33N5O5S/c1-17-13-26(18(2)15-28)22(29)10-7-11-27-19(12-23-24-27)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,28H,7,10-11,13-16H2,1-3H3/t17-,18+,21+/m0/s1	YDFSFENEUSKTIZ-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K02809100	BRD-K02809100-001-02-2	Broad Institute of MIT and Harvard	BRD-K02809100			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H33N5O5S/c1-17-13-26(18(2)15-28)22(29)10-7-11-27-19(12-23-24-27)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,28H,7,10-11,13-16H2,1-3H3/t17-,18+,21+/m0/s1	YDFSFENEUSKTIZ-WAOWUJCRSA-N	479.220239896							113291
BRD-K11027431	LSM-24703		44504947	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19-,22-/m1/s1	GKHFKOWAUNRHGL-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K11027431	BRD-K11027431-001-01-2	Broad Institute of MIT and Harvard	BRD-K11027431			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19-,22-/m1/s1	GKHFKOWAUNRHGL-WOIUINJBSA-N	493.23588996							113292
BRD-K65203256	LSM-24704		44505049	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19-,23+/m0/s1	RQWMQWHENJCHFR-SFYKDHMMSA-N	COc1cccc(CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)c1	BroadT	BRD-K65203256	BRD-K65203256-001-01-6	Broad Institute of MIT and Harvard	BRD-K65203256			COc1cccc(CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)c1	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19-,23+/m0/s1	RQWMQWHENJCHFR-SFYKDHMMSA-N	459.284554714							113293
BRD-K12460934	LSM-24705		44505248	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18-,22-/m0/s1	QPXXSBPXMIWUTR-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K12460934	BRD-K12460934-001-01-6	Broad Institute of MIT and Harvard	BRD-K12460934			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18-,22-/m0/s1	QPXXSBPXMIWUTR-SPEDKVCISA-N	445.26890465							113294
BRD-K87666020	LSM-24706		44490875	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19+,23-/m0/s1	QHTRHHVBBSPOHC-YYDVJCTNSA-N	COc1ccccc1CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K87666020	BRD-K87666020-001-01-3	Broad Institute of MIT and Harvard	BRD-K87666020			COc1ccccc1CN(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19+,23-/m0/s1	QHTRHHVBBSPOHC-YYDVJCTNSA-N	459.284554714							113295
BRD-K67270926	LSM-24707		44505662	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18-,22+/m0/s1	ZTOSEQHRKGCZOZ-NPPFBWRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K67270926	BRD-K67270926-001-01-3	Broad Institute of MIT and Harvard	BRD-K67270926			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18-,22+/m0/s1	ZTOSEQHRKGCZOZ-NPPFBWRTSA-N	497.261374598							113296
BRD-K14436020	LSM-24708		44495440	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20-,25-/m0/s1	OKVDUKBBVHEMKE-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K14436020	BRD-K14436020-001-01-9	Broad Institute of MIT and Harvard	BRD-K14436020			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20-,25-/m0/s1	OKVDUKBBVHEMKE-RLSLOFABSA-N	500.31110382							113297
MLS003129720	LSM-24000	BRD-K50260295, SID99358163	44505744	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16-/m0/s1	KPZGSTQZFNZEDR-DZKIICNBSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K50260295	BRD-K50260295-001-02-4	Broad Institute of MIT and Harvard	BRD-K50260295			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16-/m0/s1	KPZGSTQZFNZEDR-DZKIICNBSA-N	417.204589832							112590
BRD-K90264208	LSM-24709		44505238	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20-,25-/m0/s1	OLIWWUKSUJJEPA-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K90264208	BRD-K90264208-001-01-6	Broad Institute of MIT and Harvard	BRD-K90264208			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20-,25-/m0/s1	OLIWWUKSUJJEPA-RLSLOFABSA-N	480.284889072							113298
BRD-K08927194	LSM-24710		44496404	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22-/m0/s1	ZODITPIVHHGZAH-SVMVAKDDSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K08927194	BRD-K08927194-001-01-5	Broad Institute of MIT and Harvard	BRD-K08927194			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22-/m0/s1	ZODITPIVHHGZAH-SVMVAKDDSA-N	488.274718312							113299
BRD-K84128738	LSM-24711		44505655	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20-,23+/m1/s1	XSAFYGBYABXFOO-VIZSFHNOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K84128738	BRD-K84128738-001-01-0	Broad Institute of MIT and Harvard	BRD-K84128738			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20-,23+/m1/s1	XSAFYGBYABXFOO-VIZSFHNOSA-N	443.289640094							113300
MLS003129427	LSM-15171	BRD-K93473872	44505780	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)9-25(16(4)12-26)19(27)7-6-8-24-10-17(13-29-18)21-22-24/h10,14-16,18,26H,6-9,11-13H2,1-5H3/t15-,16-,18+/m0/s1	FYUBIBUWDYYNKH-XYJFISCASA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K93473872	BRD-K93473872-001-02-3	Broad Institute of MIT and Harvard	BRD-K93473872			CC(C)OC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)9-25(16(4)12-26)19(27)7-6-8-24-10-17(13-29-18)21-22-24/h10,14-16,18,26H,6-9,11-13H2,1-5H3/t15-,16-,18+/m0/s1	FYUBIBUWDYYNKH-XYJFISCASA-N	425.26381927							103827
MLS003129146	LSM-23974	BRD-K76611906	44484509	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25+/m0/s1	KFMYUMLTCHBBFY-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K76611906	BRD-K76611906-001-02-9	Broad Institute of MIT and Harvard	BRD-K76611906			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25+/m0/s1	KFMYUMLTCHBBFY-WZOHSFFVSA-N	529.23588996							112564
BRD-K31883990	LSM-24712		54631257	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22+,28-/m1/s1	DAHNEQAICFEUKA-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cnnn4CCCC1=O	BroadT	BRD-K31883990	BRD-K31883990-001-01-7	Broad Institute of MIT and Harvard	BRD-K31883990			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cnnn2CCCC1=O	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22+,28-/m1/s1	DAHNEQAICFEUKA-RZIGYZOXSA-N	563.322002862							113301
BRD-K73831546	LSM-24713		44492064	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20+,25-/m0/s1	VRVGAAPGNIASDT-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K73831546	BRD-K73831546-001-01-4	Broad Institute of MIT and Harvard	BRD-K73831546			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20+,25-/m0/s1	VRVGAAPGNIASDT-DFIYOIEZSA-N	500.31110382							113302
MLS003129755	LSM-24714	BRD-K60837711, SID99358193	44505944	InChI=1S/C28H37N5O6S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-23(16-29-30-33)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22-,27-/m0/s1	QEXGJGRYUGYWJV-BERHBOFZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K60837711	BRD-K60837711-001-02-3	Broad Institute of MIT and Harvard	BRD-K60837711			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N5O6S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-23(16-29-30-33)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22-,27-/m0/s1	QEXGJGRYUGYWJV-BERHBOFZSA-N	571.246454644							113303
MLS003129181	LSM-23938	BRD-K55916310	44505185	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24-/m1/s1	KMYKLRXROVKHNJ-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K55916310	BRD-K55916310-001-02-7	Broad Institute of MIT and Harvard	BRD-K55916310			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24-/m1/s1	KMYKLRXROVKHNJ-YDIMBITNSA-N	496.279803692							112528
BRD-K18074484	LSM-24715		44505334	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19+,21-/m1/s1	BGKHIKCFNCIYGU-SVFBPWRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K18074484	BRD-K18074484-001-01-3	Broad Institute of MIT and Harvard	BRD-K18074484			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19+,21-/m1/s1	BGKHIKCFNCIYGU-SVFBPWRDSA-N	493.23588996							113304
BRD-K08995965	LSM-6799		44505242	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19+,24-/m1/s1	DSHPDBIZJLDJKA-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K08995965	BRD-K08995965-001-01-9	Broad Institute of MIT and Harvard	BRD-K08995965			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19+,24-/m1/s1	DSHPDBIZJLDJKA-YDIMBITNSA-N	487.279469334							95420
MLS003129785	LSM-24716	BRD-K18026442	44495434	InChI=1S/C23H33N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18+,21+/m1/s1	XQMLHVPKHCFFAW-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K18026442	BRD-K18026442-001-02-2	Broad Institute of MIT and Harvard	BRD-K18026442			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18+,21+/m1/s1	XQMLHVPKHCFFAW-LQWHRVPQSA-N	443.253254586							113305
MLS003129793	LSM-23929	BRD-K11571815, SID99358273	44505984	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15+,18+/m0/s1	WXHQIOUFBAEATF-HDMKZQKVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K11571815	BRD-K11571815-001-02-3	Broad Institute of MIT and Harvard	BRD-K11571815			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2cnnn2CCCC1=O	InChI=1S/C20H33N5O4/c1-14-10-24(15(2)12-26)19(27)5-4-8-25-17(9-21-22-25)13-29-18(14)11-23(3)20(28)16-6-7-16/h9,14-16,18,26H,4-8,10-13H2,1-3H3/t14-,15+,18+/m0/s1	WXHQIOUFBAEATF-HDMKZQKVSA-N	407.253254586							112519
BRD-K21533599	LSM-24717		44505908	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20+,24-/m1/s1	XBPVHNZVBFLVIV-JXALWOEJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K21533599	BRD-K21533599-001-01-5	Broad Institute of MIT and Harvard	BRD-K21533599			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc2cnnn2CCCC1=O	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20+,24-/m1/s1	XBPVHNZVBFLVIV-JXALWOEJSA-N	501.295119398							113306
BRD-K44086628	LSM-24718		44505638	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23-/m1/s1	GOEWTOAFXZXQCM-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K44086628	BRD-K44086628-001-01-2	Broad Institute of MIT and Harvard	BRD-K44086628			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23-/m1/s1	GOEWTOAFXZXQCM-IEGUWTFLSA-N	473.26381927							113307
BRD-K89637567	LSM-24719		44491465	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20-,25-/m0/s1	VRVGAAPGNIASDT-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K89637567	BRD-K89637567-001-01-1	Broad Institute of MIT and Harvard	BRD-K89637567			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20-,25-/m0/s1	VRVGAAPGNIASDT-RLSLOFABSA-N	500.31110382							113308
MLS003129227	LSM-23946	BRD-K18290923, SID99357430	44497712	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19-/m0/s1	MNAJUJYQFCFYAB-SCTDSRPQSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K18290923	BRD-K18290923-001-02-2	Broad Institute of MIT and Harvard	BRD-K18290923			CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19-/m0/s1	MNAJUJYQFCFYAB-SCTDSRPQSA-N	439.279469334							112536
BRD-K10144853	LSM-24720		44492066	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19-,23-/m0/s1	QHTRHHVBBSPOHC-YDHSSHFGSA-N	COc1ccccc1CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K10144853	BRD-K10144853-001-01-5	Broad Institute of MIT and Harvard	BRD-K10144853			COc1ccccc1CN(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19-,23-/m0/s1	QHTRHHVBBSPOHC-YDHSSHFGSA-N	459.284554714							113309
BRD-K65166009	LSM-24721		44487423	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16+/m0/s1	WAHUPRWPWKVPJH-OFQRWUPVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K65166009	BRD-K65166009-001-01-5	Broad Institute of MIT and Harvard	BRD-K65166009			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16+/m0/s1	WAHUPRWPWKVPJH-OFQRWUPVSA-N	353.242689902							113310
MLS003130352	LSM-23876	BRD-K49755501, SID99359240	44498137	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20+/m1/s1	IGJDKOMBBXSAPT-UWVAXJGDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K49755501	BRD-K49755501-001-02-7	Broad Institute of MIT and Harvard	BRD-K49755501			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20+/m1/s1	IGJDKOMBBXSAPT-UWVAXJGDSA-N	444.248503564							112464
BRD-K62708569	LSM-24722		44505161	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21+/m1/s1	RIYOEJIKZKGUHQ-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K62708569	BRD-K62708569-001-01-9	Broad Institute of MIT and Harvard	BRD-K62708569			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21+/m1/s1	RIYOEJIKZKGUHQ-WWMYMODYSA-N	497.210818064							113311
MLS003129375	LSM-24723	BRD-K09871160	44491461	InChI=1S/C24H36N6O5/c1-17-13-29(18(2)15-31)23(32)10-7-11-30-19(12-25-27-30)16-35-22(17)14-28(3)24(33)26-20-8-5-6-9-21(20)34-4/h5-6,8-9,12,17-18,22,31H,7,10-11,13-16H2,1-4H3,(H,26,33)/t17-,18+,22+/m0/s1	LJFLDXJAOYTNMN-NJNPRVFISA-N	COc1ccccc1NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K09871160	BRD-K09871160-001-02-2	Broad Institute of MIT and Harvard	BRD-K09871160			COc1ccccc1NC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H36N6O5/c1-17-13-29(18(2)15-31)23(32)10-7-11-30-19(12-25-27-30)16-35-22(17)14-28(3)24(33)26-20-8-5-6-9-21(20)34-4/h5-6,8-9,12,17-18,22,31H,7,10-11,13-16H2,1-4H3,(H,26,33)/t17-,18+,22+/m0/s1	LJFLDXJAOYTNMN-NJNPRVFISA-N	488.274718312							113312
MLS003129933	LSM-24724	BRD-K05400180, SID99358425	44505779	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16-,18-/m0/s1	IKLKAEKDATVYNM-BQFCYCMXSA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K05400180	BRD-K05400180-001-02-0	Broad Institute of MIT and Harvard	BRD-K05400180			CC(C)OC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16-,18-/m0/s1	IKLKAEKDATVYNM-BQFCYCMXSA-N	425.26381927							113313
MLS003130356	LSM-24725	BRD-K07348252	44505397	InChI=1S/C23H33N5O5/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-19(12-24-25-28)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18-,21+/m1/s1	VVYGNONDBDDRFX-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K07348252	BRD-K07348252-001-02-2	Broad Institute of MIT and Harvard	BRD-K07348252			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33N5O5/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-19(12-24-25-28)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18-,21+/m1/s1	VVYGNONDBDDRFX-OPYAIIAOSA-N	459.248169206							113314
BRD-K77808555	LSM-24726		44504952	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21-/m0/s1	RIYOEJIKZKGUHQ-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K77808555	BRD-K77808555-001-01-6	Broad Institute of MIT and Harvard	BRD-K77808555			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21-/m0/s1	RIYOEJIKZKGUHQ-FIKGOQFSSA-N	497.210818064							113315
MLS003129171	LSM-15097	SID99357504, BRD-K01591707	44494083	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18+,22+/m1/s1	DMKVVNQLOZTLAB-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K01591707	BRD-K01591707-001-02-4	Broad Institute of MIT and Harvard	BRD-K01591707			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18+,22+/m1/s1	DMKVVNQLOZTLAB-FGSXEWAUSA-N	497.261374598							103753
CHEMBL2360952	LSM-24727	BRD-K83845975, SID85812317	44505212	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20+,23-/m1/s1	RZJYZFKNZOCSJO-ZRCGQRJVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K83845975	BRD-K83845975-001-01-2	Broad Institute of MIT and Harvard	BRD-K83845975			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20+,23-/m1/s1	RZJYZFKNZOCSJO-ZRCGQRJVSA-N	443.289640094							113316
BRD-K14570970	LSM-24728		44495433	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21-/m1/s1	FLBHXJCYMARYBO-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K14570970	BRD-K14570970-001-01-5	Broad Institute of MIT and Harvard	BRD-K14570970			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21-/m1/s1	FLBHXJCYMARYBO-LLGFUMIMSA-N	513.181267574							113317
MLS003129237	LSM-23986	BRD-K27248268	44505595	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21-/m0/s1	WMEBRZUCENJNIY-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K27248268	BRD-K27248268-001-02-2	Broad Institute of MIT and Harvard	BRD-K27248268			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21-/m0/s1	WMEBRZUCENJNIY-UEXGIBASSA-N	464.31110382							112576
MLS003129625	LSM-24729	BRD-K34005205	44505129	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)10-7-11-27-13-19(24-25-27)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-4H3/t17-,18+,21+/m1/s1	WYMIJPVEWZCEGL-LQWHRVPQSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K34005205	BRD-K34005205-001-02-3	Broad Institute of MIT and Harvard	BRD-K34005205			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)10-7-11-27-13-19(24-25-27)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-4H3/t17-,18+,21+/m1/s1	WYMIJPVEWZCEGL-LQWHRVPQSA-N	509.23080458							113318
MLS003130345	LSM-23945	BRD-K79576342, SID99359234	44505402	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	JATGFWCPGFHVCF-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K79576342	BRD-K79576342-001-02-3	Broad Institute of MIT and Harvard	BRD-K79576342			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	JATGFWCPGFHVCF-WZOHSFFVSA-N	509.26381927							112535
MLS003130351	LSM-24730	BRD-K14865132	44505372	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)9-6-10-28-18(11-24-25-28)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,11,16-17,20,29H,6,9-10,12-15H2,1-3H3/t16-,17+,20-/m1/s1	MFABSAUNVKQXNQ-FUHIMQAGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K14865132	BRD-K14865132-001-02-2	Broad Institute of MIT and Harvard	BRD-K14865132			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)9-6-10-28-18(11-24-25-28)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,11,16-17,20,29H,6,9-10,12-15H2,1-3H3/t16-,17+,20-/m1/s1	MFABSAUNVKQXNQ-FUHIMQAGSA-N	497.210818064							113319
BRD-K84210390	LSM-24731		44494933	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21+/m0/s1	XRXVGTRBMNTJPS-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K84210390	BRD-K84210390-001-01-5	Broad Institute of MIT and Harvard	BRD-K84210390			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21+/m0/s1	XRXVGTRBMNTJPS-XGHQBKJUSA-N	513.181267574							113320
MLS003129276	LSM-24732	BRD-K67702605	44505737	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)9-6-10-28-20(16-33-22)12-24-25-28/h5,7-8,11-12,18-19,22,29H,6,9-10,13-16H2,1-4H3/t18-,19-,22-/m1/s1	GSLUEEWCAUTOBV-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K67702605	BRD-K67702605-001-02-1	Broad Institute of MIT and Harvard	BRD-K67702605			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)9-6-10-28-20(16-33-22)12-24-25-28/h5,7-8,11-12,18-19,22,29H,6,9-10,13-16H2,1-4H3/t18-,19-,22-/m1/s1	GSLUEEWCAUTOBV-WOIUINJBSA-N	493.23588996							113321
BRD-K66463856	LSM-24733		44505226	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20+,23+/m1/s1	MEJUTVOAQGGYHA-QTEQDKRBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K66463856	BRD-K66463856-001-01-9	Broad Institute of MIT and Harvard	BRD-K66463856			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20+,23+/m1/s1	MEJUTVOAQGGYHA-QTEQDKRBSA-N	443.289640094							113322
BRD-K64531971	LSM-24734		44505345	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17-,21-/m1/s1	HYLLQKBLPQWSSO-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K64531971	BRD-K64531971-001-01-5	Broad Institute of MIT and Harvard	BRD-K64531971			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17-,21-/m1/s1	HYLLQKBLPQWSSO-CBGDNZLLSA-N	497.210818064							113323
BRD-K31360506-001-01-3	LSM-24735	BRD-K31360506	44505115	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22-/m0/s1	DGDOMSZWPVXBGZ-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K31360506	BRD-K31360506-001-01-3	Broad Institute of MIT and Harvard	BRD-K31360506			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22-/m0/s1	DGDOMSZWPVXBGZ-JQVVWYNYSA-N	493.23588996							113324
BRD-K86298765	LSM-24736		44505630	InChI=1S/C23H41N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h12,18-20,22,29H,4-11,13-17H2,1-3H3/t18-,19+,22-/m0/s1	OPQMCYKWZYLZJV-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K86298765	BRD-K86298765-001-01-5	Broad Institute of MIT and Harvard	BRD-K86298765			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H41N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h12,18-20,22,29H,4-11,13-17H2,1-3H3/t18-,19+,22-/m0/s1	OPQMCYKWZYLZJV-JQVVWYNYSA-N	435.320940222							113325
BRD-K18558473	LSM-24737		44505794	InChI=1S/C22H38N6O4/c1-16-11-28(17(2)14-29)21(30)9-6-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)23-18-7-4-5-8-18/h12,16-18,20,29H,4-11,13-15H2,1-3H3,(H,23,31)/t16-,17-,20+/m0/s1	NHKODMKPZBXGEI-ABSDTBQOSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K18558473	BRD-K18558473-001-01-8	Broad Institute of MIT and Harvard	BRD-K18558473			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H38N6O4/c1-16-11-28(17(2)14-29)21(30)9-6-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)23-18-7-4-5-8-18/h12,16-18,20,29H,4-11,13-15H2,1-3H3,(H,23,31)/t16-,17-,20+/m0/s1	NHKODMKPZBXGEI-ABSDTBQOSA-N	450.295453756							113326
BRD-K34651941-001-01-5	LSM-24738	BRD-K34651941	44505884	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18-,22-/m1/s1	DXNYPMFBKGSJNE-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K34651941	BRD-K34651941-001-01-5	Broad Institute of MIT and Harvard	BRD-K34651941			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18-,22-/m1/s1	DXNYPMFBKGSJNE-JBYIUTFZSA-N	497.261374598							113327
MLS003129546	LSM-24739	BRD-K19965080, SID99357921	44505541	InChI=1S/C28H37N5O6S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-23(16-29-30-33)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22+,27-/m1/s1	QEXGJGRYUGYWJV-UMTXDNHDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K19965080	BRD-K19965080-001-02-7	Broad Institute of MIT and Harvard	BRD-K19965080			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N5O6S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-23(16-29-30-33)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22+,27-/m1/s1	QEXGJGRYUGYWJV-UMTXDNHDSA-N	571.246454644							113328
BRD-K44003352	LSM-24740		44505562	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20-,25-/m1/s1	SUQKGVARFDJMIR-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K44003352	BRD-K44003352-001-01-9	Broad Institute of MIT and Harvard	BRD-K44003352			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20-,25-/m1/s1	SUQKGVARFDJMIR-UMEGOILYSA-N	509.26381927							113329
MLS003129611	LSM-24741	BRD-K23763017	44492059	InChI=1S/C23H35N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,29H,7,10-11,13-17H2,1-3H3/t18-,19+,22+/m1/s1	AYVSZOBZIZEFEA-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K23763017	BRD-K23763017-001-02-8	Broad Institute of MIT and Harvard	BRD-K23763017			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,29H,7,10-11,13-17H2,1-3H3/t18-,19+,22+/m1/s1	AYVSZOBZIZEFEA-DXIQSLLYSA-N	429.27399003							113330
MLS003129320	LSM-24742	BRD-K04635516, SID99357579	44492579	InChI=1S/C20H36N6O4/c1-14(2)22-20(29)24(5)11-18-15(3)10-25(16(4)12-27)19(28)7-6-8-26-17(13-30-18)9-21-23-26/h9,14-16,18,27H,6-8,10-13H2,1-5H3,(H,22,29)/t15-,16+,18+/m0/s1	NAXYJFNCLMAYPS-LZLYRXPVSA-N	CC(C)NC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K04635516	BRD-K04635516-001-02-7	Broad Institute of MIT and Harvard	BRD-K04635516			CC(C)NC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C20H36N6O4/c1-14(2)22-20(29)24(5)11-18-15(3)10-25(16(4)12-27)19(28)7-6-8-26-17(13-30-18)9-21-23-26/h9,14-16,18,27H,6-8,10-13H2,1-5H3,(H,22,29)/t15-,16+,18+/m0/s1	NAXYJFNCLMAYPS-LZLYRXPVSA-N	424.279803692							113331
BRD-K49995660	LSM-24743		44505370	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17-,20-/m1/s1	JYOVEVCXPRGJRX-MBOZVWFJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K49995660	BRD-K49995660-001-01-8	Broad Institute of MIT and Harvard	BRD-K49995660			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17-,20-/m1/s1	JYOVEVCXPRGJRX-MBOZVWFJSA-N	497.210818064							113332
MLS003129471	LSM-24038	SID99357807, BRD-K35407043	44505029	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18+,21+/m1/s1	BVMGYWBUQYFDAA-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K35407043	BRD-K35407043-001-02-6	Broad Institute of MIT and Harvard	BRD-K35407043			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18+,21+/m1/s1	BVMGYWBUQYFDAA-LQWHRVPQSA-N	430.269239008							112628
BRD-K62612761	LSM-24744		44505618	InChI=1S/C27H42N6O4/c1-19-14-33(20(2)17-34)25(35)8-7-13-32-15-23(29-30-32)18-37-24(19)16-31(6)26(36)28-22-11-9-21(10-12-22)27(3,4)5/h9-12,15,19-20,24,34H,7-8,13-14,16-18H2,1-6H3,(H,28,36)/t19-,20+,24-/m0/s1	APMQHRQBDHMONS-ROKPMTFOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(C)(C)C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K62612761	BRD-K62612761-001-01-9	Broad Institute of MIT and Harvard	BRD-K62612761			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(C)(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H42N6O4/c1-19-14-33(20(2)17-34)25(35)8-7-13-32-15-23(29-30-32)18-37-24(19)16-31(6)26(36)28-22-11-9-21(10-12-22)27(3,4)5/h9-12,15,19-20,24,34H,7-8,13-14,16-18H2,1-6H3,(H,28,36)/t19-,20+,24-/m0/s1	APMQHRQBDHMONS-ROKPMTFOSA-N	514.326753884							113333
BRD-K48780709	LSM-24745		44505025	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28+/m1/s1	PZMMCWSZGDQDET-MRJKTFCFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K48780709	BRD-K48780709-001-01-8	Broad Institute of MIT and Harvard	BRD-K48780709			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28+/m1/s1	PZMMCWSZGDQDET-MRJKTFCFSA-N	505.305290158							113334
MLS003129223	LSM-24746	BRD-K35442564, SID99357426	44505117	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)6-5-11-28-20(16-33-22)12-24-25-28/h7-10,12,18-19,22,29H,5-6,11,13-16H2,1-4H3/t18-,19-,22-/m1/s1	PBQVTRJHSYIUGU-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K35442564	BRD-K35442564-001-02-2	Broad Institute of MIT and Harvard	BRD-K35442564			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)6-5-11-28-20(16-33-22)12-24-25-28/h7-10,12,18-19,22,29H,5-6,11,13-16H2,1-4H3/t18-,19-,22-/m1/s1	PBQVTRJHSYIUGU-WOIUINJBSA-N	493.23588996							113335
MLS003129162	LSM-24747	BRD-K28746174, SID99357498	44505367	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21+/m1/s1	OOPGLCWBUZVAMU-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K28746174	BRD-K28746174-001-02-7	Broad Institute of MIT and Harvard	BRD-K28746174			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21+/m1/s1	OOPGLCWBUZVAMU-WWMYMODYSA-N	497.210818064							113336
BRD-K70940767	LSM-24748		44487424	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20-,24+/m0/s1	ATOJIXFYNQCGDG-MZLICYQSSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K70940767	BRD-K70940767-001-01-8	Broad Institute of MIT and Harvard	BRD-K70940767			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20-,24+/m0/s1	ATOJIXFYNQCGDG-MZLICYQSSA-N	501.295119398							113337
MLS003129616	LSM-24749	BRD-K90965240, SID99358026	44494932	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21+/m1/s1	FLBHXJCYMARYBO-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K90965240	BRD-K90965240-001-02-6	Broad Institute of MIT and Harvard	BRD-K90965240			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21+/m1/s1	FLBHXJCYMARYBO-WWMYMODYSA-N	513.181267574							113338
BRD-K01817716	LSM-24750		44485071	InChI=1S/C20H36N6O4/c1-14(2)21-20(29)24(5)11-18-15(3)9-26(16(4)12-27)19(28)7-6-8-25-10-17(13-30-18)22-23-25/h10,14-16,18,27H,6-9,11-13H2,1-5H3,(H,21,29)/t15-,16+,18-/m0/s1	UNRRBHFUILMFRI-JZXOWHBKSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K01817716	BRD-K01817716-001-01-4	Broad Institute of MIT and Harvard	BRD-K01817716			CC(C)NC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C20H36N6O4/c1-14(2)21-20(29)24(5)11-18-15(3)9-26(16(4)12-27)19(28)7-6-8-25-10-17(13-30-18)22-23-25/h10,14-16,18,27H,6-9,11-13H2,1-5H3,(H,21,29)/t15-,16+,18-/m0/s1	UNRRBHFUILMFRI-JZXOWHBKSA-N	424.279803692							113339
BRD-K04611090	LSM-24751		44492060	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19-,22+/m0/s1	AIVZVDBTBOXKNA-CNNODRBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K04611090	BRD-K04611090-001-01-4	Broad Institute of MIT and Harvard	BRD-K04611090			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19-,22+/m0/s1	AIVZVDBTBOXKNA-CNNODRBYSA-N	429.27399003							113340
MLS003129702	LSM-24752	BRD-K94573433, SID99358149	44495956	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21+/m0/s1	FLBHXJCYMARYBO-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K94573433	BRD-K94573433-001-02-1	Broad Institute of MIT and Harvard	BRD-K94573433			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21+/m0/s1	FLBHXJCYMARYBO-XGHQBKJUSA-N	513.181267574							113341
MLS003129279	LSM-24753	SID99357543, BRD-K27671601	44505207	InChI=1S/C27H36N6O4/c1-19-15-32(20(2)17-34)26(35)12-7-13-33-22(14-28-30-33)18-37-25(19)16-31(3)27(36)29-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,34H,7,12-13,15-18H2,1-3H3,(H,29,36)/t19-,20+,25+/m1/s1	BDQCUWSGKZTQJJ-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K27671601	BRD-K27671601-001-02-1	Broad Institute of MIT and Harvard	BRD-K27671601			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H36N6O4/c1-19-15-32(20(2)17-34)26(35)12-7-13-33-22(14-28-30-33)18-37-25(19)16-31(3)27(36)29-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,34H,7,12-13,15-18H2,1-3H3,(H,29,36)/t19-,20+,25+/m1/s1	BDQCUWSGKZTQJJ-RNHFSVANSA-N	508.279803692							113342
BRD-K63909265	LSM-24754		44505236	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)10-24(16(3)13-25)19(26)7-6-9-23-11-17(14-27-18)20-21-23/h11,15-16,18,25H,5-10,12-14H2,1-4H3/t15-,16-,18-/m0/s1	UYQIVECMKYOLNY-BQFCYCMXSA-N	CCCN(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K63909265	BRD-K63909265-001-01-9	Broad Institute of MIT and Harvard	BRD-K63909265			CCCN(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)10-24(16(3)13-25)19(26)7-6-9-23-11-17(14-27-18)20-21-23/h11,15-16,18,25H,5-10,12-14H2,1-4H3/t15-,16-,18-/m0/s1	UYQIVECMKYOLNY-BQFCYCMXSA-N	381.27399003							113343
BRD-K91513229	LSM-24755		44505641	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23-/m0/s1	GOEWTOAFXZXQCM-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K91513229	BRD-K91513229-001-01-0	Broad Institute of MIT and Harvard	BRD-K91513229			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23-/m0/s1	GOEWTOAFXZXQCM-IXFSTUDKSA-N	473.26381927							113344
BRD-K62624148	LSM-24756		44505653	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28-/m0/s1	WVGLRASGSLBUCZ-JWZKTCGFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K62624148	BRD-K62624148-001-01-8	Broad Institute of MIT and Harvard	BRD-K62624148			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28-/m0/s1	WVGLRASGSLBUCZ-JWZKTCGFSA-N	521.300204778							113345
MLS003129386	LSM-24757	BRD-K97946004	44505763	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)9-24(15(3)12-25)18(26)7-6-8-23-10-16(13-29-17)20-21-23/h10,14-15,17,25H,5-9,11-13H2,1-4H3/t14-,15+,17+/m1/s1	OBJUKURLMFMQOH-VYDXJSESSA-N	CCOC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K97946004	BRD-K97946004-001-02-5	Broad Institute of MIT and Harvard	BRD-K97946004			CCOC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)9-24(15(3)12-25)18(26)7-6-8-23-10-16(13-29-17)20-21-23/h10,14-15,17,25H,5-9,11-13H2,1-4H3/t14-,15+,17+/m1/s1	OBJUKURLMFMQOH-VYDXJSESSA-N	411.248169206							113346
MLS003129351	LSM-23943	BRD-K96845170, SID99357661	44498552	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18-,23+/m1/s1	GOEWTOAFXZXQCM-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K96845170	BRD-K96845170-001-02-8	Broad Institute of MIT and Harvard	BRD-K96845170			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18-,23+/m1/s1	GOEWTOAFXZXQCM-PNCHPQGNSA-N	473.26381927							112533
BRD-K41999717	LSM-24758		44504939	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25-/m0/s1	QVHCTLOUCAXGOY-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K41999717	BRD-K41999717-001-01-1	Broad Institute of MIT and Harvard	BRD-K41999717			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25-/m0/s1	QVHCTLOUCAXGOY-RLSLOFABSA-N	529.23588996							113347
MLS003129355	LSM-24759	BRD-K84541452, SID99357665	44505064	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)6-5-11-29-22(17-32-23)12-25-26-29/h7-10,12,19-20,23,30H,5-6,11,13-17H2,1-4H3/t19-,20+,23+/m1/s1	WGPDLCVCGOLGPE-QTEQDKRBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K84541452	BRD-K84541452-001-02-6	Broad Institute of MIT and Harvard	BRD-K84541452			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)6-5-11-29-22(17-32-23)12-25-26-29/h7-10,12,19-20,23,30H,5-6,11,13-17H2,1-4H3/t19-,20+,23+/m1/s1	WGPDLCVCGOLGPE-QTEQDKRBSA-N	443.289640094							113348
BRD-K02688026	LSM-24760		44505354	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19-,22-/m0/s1	GKHFKOWAUNRHGL-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K02688026	BRD-K02688026-001-01-3	Broad Institute of MIT and Harvard	BRD-K02688026			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19-,22-/m0/s1	GKHFKOWAUNRHGL-IPJJNNNSSA-N	493.23588996							113349
MLS003129150	LSM-24761	BRD-K75263760	44505567	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18-,22+/m1/s1	DYYSINDAYMXOAQ-HMFYCAOWSA-N	COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K75263760	BRD-K75263760-001-02-5	Broad Institute of MIT and Harvard	BRD-K75263760			COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18-,22+/m1/s1	DYYSINDAYMXOAQ-HMFYCAOWSA-N	489.25873389							113350
MLS003129644	LSM-23889	BRD-K08867654	44505431	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m1/s1	HYHIJLYQTCYSKX-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K08867654	BRD-K08867654-001-02-4	Broad Institute of MIT and Harvard	BRD-K08867654			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21+/m1/s1	HYHIJLYQTCYSKX-OPYAIIAOSA-N	458.264153628							112477
BRD-K91796483	LSM-24762		44486359	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20-,23-/m1/s1	PUSZFNDBKFADMS-TXTKFYIRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K91796483	BRD-K91796483-001-01-2	Broad Institute of MIT and Harvard	BRD-K91796483			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20-,23-/m1/s1	PUSZFNDBKFADMS-TXTKFYIRSA-N	544.31216646							113351
MLS003129202	LSM-24763	BRD-K58876832	44505145	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)9-6-10-28-20(16-33-22)12-24-25-28/h5,7-8,11-12,18-19,22,29H,6,9-10,13-16H2,1-4H3/t18-,19-,22-/m0/s1	GSLUEEWCAUTOBV-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K58876832	BRD-K58876832-001-02-9	Broad Institute of MIT and Harvard	BRD-K58876832			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)9-6-10-28-20(16-33-22)12-24-25-28/h5,7-8,11-12,18-19,22,29H,6,9-10,13-16H2,1-4H3/t18-,19-,22-/m0/s1	GSLUEEWCAUTOBV-IPJJNNNSSA-N	493.23588996							113352
BRD-K77787814	LSM-24764		44505261	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18+,22-/m0/s1	ZTOSEQHRKGCZOZ-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K77787814	BRD-K77787814-001-01-9	Broad Institute of MIT and Harvard	BRD-K77787814			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18+,22-/m0/s1	ZTOSEQHRKGCZOZ-SVMVAKDDSA-N	497.261374598							113353
MLS003129350	LSM-23931	BRD-K06431655	44505044	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20+,25+/m1/s1	OLIWWUKSUJJEPA-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K06431655	BRD-K06431655-001-02-0	Broad Institute of MIT and Harvard	BRD-K06431655			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20+,25+/m1/s1	OLIWWUKSUJJEPA-RNHFSVANSA-N	480.284889072							112521
BRD-K32367331-001-01-8	LSM-24765	BRD-K32367331	44489273	InChI=1S/C23H35N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,29H,7,10-11,13-17H2,1-3H3/t18-,19-,22-/m1/s1	AYVSZOBZIZEFEA-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K32367331	BRD-K32367331-001-01-8	Broad Institute of MIT and Harvard	BRD-K32367331			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,29H,7,10-11,13-17H2,1-3H3/t18-,19-,22-/m1/s1	AYVSZOBZIZEFEA-WOIUINJBSA-N	429.27399003							113354
BRD-K14721042	LSM-6800		44505889	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19-,24+/m1/s1	DSHPDBIZJLDJKA-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K14721042	BRD-K14721042-001-01-8	Broad Institute of MIT and Harvard	BRD-K14721042			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19-,24+/m1/s1	DSHPDBIZJLDJKA-IECBHUPTSA-N	487.279469334							95421
MLS003129756	LSM-24067	BRD-K54332480	44505187	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17+/m0/s1	SUQCROIYCBRRRP-ZMSDIMECSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K54332480	BRD-K54332480-001-02-2	Broad Institute of MIT and Harvard	BRD-K54332480			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17+/m0/s1	SUQCROIYCBRRRP-ZMSDIMECSA-N	463.240639154							112657
MLS003129690	LSM-23940	BRD-K04409515, SID99358139	44505752	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	SUQKGVARFDJMIR-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K04409515	BRD-K04409515-001-02-8	Broad Institute of MIT and Harvard	BRD-K04409515			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	SUQKGVARFDJMIR-WZOHSFFVSA-N	509.26381927							112530
BRD-K87516578	LSM-24766		44505448	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21-/m0/s1	VTXUSJLMEZRIOV-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K87516578	BRD-K87516578-001-01-6	Broad Institute of MIT and Harvard	BRD-K87516578			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21-/m0/s1	VTXUSJLMEZRIOV-FVJLSDCUSA-N	476.254731796							113355
BRD-K71339292	LSM-24767		44505114	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19+,21-/m0/s1	BGKHIKCFNCIYGU-ZVDOUQERSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K71339292	BRD-K71339292-001-01-6	Broad Institute of MIT and Harvard	BRD-K71339292			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19+,21-/m0/s1	BGKHIKCFNCIYGU-ZVDOUQERSA-N	493.23588996							113356
BRD-K66655211	LSM-24768		44494939	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20-,25-/m1/s1	OKVDUKBBVHEMKE-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K66655211	BRD-K66655211-001-01-0	Broad Institute of MIT and Harvard	BRD-K66655211			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N6O4/c1-19-14-31(20(2)17-33)26(34)6-5-9-32-22(13-27-28-32)18-36-25(19)16-29(3)15-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12-13,19-20,25,33H,5-6,9-11,14-18H2,1-4H3/t19-,20-,25-/m1/s1	OKVDUKBBVHEMKE-UMEGOILYSA-N	500.31110382							113357
BRD-K63375777	LSM-24769		44505577	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22-/m0/s1	IKCPXJXAZOQLMC-SPEDKVCISA-N	COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)cc1	BroadT	BRD-K63375777	BRD-K63375777-001-01-4	Broad Institute of MIT and Harvard	BRD-K63375777			COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)cc1	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22-/m0/s1	IKCPXJXAZOQLMC-SPEDKVCISA-N	489.25873389							113358
MLS003129432	LSM-23995	BRD-K15098674	44504974	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24-/m0/s1	DZRIWTKXHLXUTO-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K15098674	BRD-K15098674-001-02-3	Broad Institute of MIT and Harvard	BRD-K15098674			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24-/m0/s1	DZRIWTKXHLXUTO-GLDPYIMESA-N	510.259068248							112585
MLS003129649	LSM-24013	BRD-K59041191	44505986	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15-,17-/m1/s1	SUQCROIYCBRRRP-BFYDXBDKSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K59041191	BRD-K59041191-001-02-4	Broad Institute of MIT and Harvard	BRD-K59041191			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15-,17-/m1/s1	SUQCROIYCBRRRP-BFYDXBDKSA-N	463.240639154							112603
MLS003129543	LSM-24770	BRD-K48813201, SID121282504	44504915	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19-,21+/m0/s1	BGKHIKCFNCIYGU-IRFCIJBXSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K48813201	BRD-K48813201-001-02-8	Broad Institute of MIT and Harvard	BRD-K48813201			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19-,21+/m0/s1	BGKHIKCFNCIYGU-IRFCIJBXSA-N	493.23588996							113359
MLS003129236	LSM-24001	BRD-K70193997	44505417	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26-/m1/s1	WJAIMBKFVIKGAD-TVZXLZGTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K70193997	BRD-K70193997-001-02-4	Broad Institute of MIT and Harvard	BRD-K70193997			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26-/m1/s1	WJAIMBKFVIKGAD-TVZXLZGTSA-N	541.337652926							112591
BRD-K12145385	LSM-24771		44488169	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20-,25+/m0/s1	VRVGAAPGNIASDT-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K12145385	BRD-K12145385-001-01-7	Broad Institute of MIT and Harvard	BRD-K12145385			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20-,25+/m0/s1	VRVGAAPGNIASDT-ZYLNGJIFSA-N	500.31110382							113360
MLS003130349	LSM-24772	BRD-K90294313, SID99359237	44485759	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20-,25+/m0/s1	XVJRXGRWNAMAGP-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K90294313	BRD-K90294313-001-02-3	Broad Institute of MIT and Harvard	BRD-K90294313			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20-,25+/m0/s1	XVJRXGRWNAMAGP-ZYLNGJIFSA-N	508.279803692							113361
BRD-K67526257	LSM-24773		44494942	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22+/m1/s1	QAXWADXATYBNKX-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K67526257	BRD-K67526257-001-01-7	Broad Institute of MIT and Harvard	BRD-K67526257			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22+/m1/s1	QAXWADXATYBNKX-FGSXEWAUSA-N	497.261374598							113362
BRD-K85722065	LSM-24774		44505218	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28-/m1/s1	YAZCQYURBLEIHO-MVOZIGHISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K85722065	BRD-K85722065-001-01-2	Broad Institute of MIT and Harvard	BRD-K85722065			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28-/m1/s1	YAZCQYURBLEIHO-MVOZIGHISA-N	505.305290158							113363
BRD-K73364700	LSM-24775		44505492	InChI=1S/C22H39N5O3/c1-17-12-26(18(2)15-28)22(29)9-6-10-27-20(11-23-24-27)16-30-21(17)14-25(3)13-19-7-4-5-8-19/h11,17-19,21,28H,4-10,12-16H2,1-3H3/t17-,18-,21-/m0/s1	KPNJMWZAUKOQSY-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K73364700	BRD-K73364700-001-01-8	Broad Institute of MIT and Harvard	BRD-K73364700			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C22H39N5O3/c1-17-12-26(18(2)15-28)22(29)9-6-10-27-20(11-23-24-27)16-30-21(17)14-25(3)13-19-7-4-5-8-19/h11,17-19,21,28H,4-10,12-16H2,1-3H3/t17-,18-,21-/m0/s1	KPNJMWZAUKOQSY-WFXMLNOXSA-N	421.305290158							113364
BRD-K45520793	LSM-24776		44505408	InChI=1S/C24H35N5O5/c1-18-13-28(19(2)15-30)23(31)10-7-11-29-21(12-25-26-29)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,30H,7,10-11,13-17H2,1-3H3/t18-,19+,22+/m0/s1	DLYGSNKXPRYVCA-NNMXDRDESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)OCc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K45520793	BRD-K45520793-001-01-8	Broad Institute of MIT and Harvard	BRD-K45520793			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)OCc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-18-13-28(19(2)15-30)23(31)10-7-11-29-21(12-25-26-29)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,30H,7,10-11,13-17H2,1-3H3/t18-,19+,22+/m0/s1	DLYGSNKXPRYVCA-NNMXDRDESA-N	473.26381927							113365
BRD-K58644442	LSM-24777		44506023	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18-,23+/m0/s1	BYLZCNPQXPGOCE-IUKKYPGJSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)c(OC)c1	BroadT	BRD-K58644442	BRD-K58644442-001-01-5	Broad Institute of MIT and Harvard	BRD-K58644442			COc1ccc(NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)c(OC)c1	InChI=1S/C25H38N6O6/c1-17-13-30(18(2)15-32)24(33)7-6-10-31-19(12-26-28-31)16-37-23(17)14-29(3)25(34)27-21-9-8-20(35-4)11-22(21)36-5/h8-9,11-12,17-18,23,32H,6-7,10,13-16H2,1-5H3,(H,27,34)/t17-,18-,23+/m0/s1	BYLZCNPQXPGOCE-IUKKYPGJSA-N	518.285282996							113366
MLS003129800	LSM-23958	SID99358280, BRD-K95895516	44505749	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17-/m1/s1	SUQCROIYCBRRRP-HLLBOEOZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K95895516	BRD-K95895516-001-02-7	Broad Institute of MIT and Harvard	BRD-K95895516			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17-/m1/s1	SUQCROIYCBRRRP-HLLBOEOZSA-N	463.240639154							112548
BRD-K05970499	LSM-24778		44505369	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17-,20-/m0/s1	JYOVEVCXPRGJRX-ZWOKBUDYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K05970499	BRD-K05970499-001-01-0	Broad Institute of MIT and Harvard	BRD-K05970499			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17-,20-/m0/s1	JYOVEVCXPRGJRX-ZWOKBUDYSA-N	497.210818064							113367
BRD-K15188108	LSM-24779		44505240	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)11-23(16(3)13-25)19(26)7-6-9-24-17(14-27-18)10-20-21-24/h10,15-16,18,25H,5-9,11-14H2,1-4H3/t15-,16-,18-/m1/s1	DWRDFVJCWRIGSC-JFIYKMOQSA-N	CCCN(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K15188108	BRD-K15188108-001-01-0	Broad Institute of MIT and Harvard	BRD-K15188108			CCCN(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)11-23(16(3)13-25)19(26)7-6-9-24-17(14-27-18)10-20-21-24/h10,15-16,18,25H,5-9,11-14H2,1-4H3/t15-,16-,18-/m1/s1	DWRDFVJCWRIGSC-JFIYKMOQSA-N	381.27399003							113368
BRD-K36445086	LSM-24780		44505358	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25-/m1/s1	QVHCTLOUCAXGOY-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K36445086	BRD-K36445086-001-01-5	Broad Institute of MIT and Harvard	BRD-K36445086			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25-/m1/s1	QVHCTLOUCAXGOY-UMEGOILYSA-N	529.23588996							113369
BRD-K28728910	LSM-24781		44505867	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19-,22-/m0/s1	ZIMKOTFORJXDIC-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K28728910	BRD-K28728910-001-01-6	Broad Institute of MIT and Harvard	BRD-K28728910			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19-,22-/m0/s1	ZIMKOTFORJXDIC-IPJJNNNSSA-N	435.320940222							113370
BRD-K48864953	LSM-24782		44494938	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18+,21+/m1/s1	QXBLKCOAOVMUQM-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K48864953	BRD-K48864953-001-01-3	Broad Institute of MIT and Harvard	BRD-K48864953			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18+,21+/m1/s1	QXBLKCOAOVMUQM-LQWHRVPQSA-N	430.269239008							113371
BRD-K78222058	LSM-24783		44505048	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28+/m1/s1	WVGLRASGSLBUCZ-MRJKTFCFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K78222058	BRD-K78222058-001-01-1	Broad Institute of MIT and Harvard	BRD-K78222058			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28+/m1/s1	WVGLRASGSLBUCZ-MRJKTFCFSA-N	521.300204778							131267
BRD-K35049668	LSM-24784		44506063	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18-,22-/m1/s1	GQDZDOSXBZGUQJ-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K35049668	BRD-K35049668-001-01-2	Broad Institute of MIT and Harvard	BRD-K35049668			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18-,22-/m1/s1	GQDZDOSXBZGUQJ-JBYIUTFZSA-N	445.26890465							113374
MLS003129283	LSM-24785	BRD-K36164005, SID99357546	44505146	InChI=1S/C28H37N5O5S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-25(29-30-32)20-38-27(21)18-31(3)39(36,37)26-13-11-24(12-14-26)23-8-5-4-6-9-23/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22-,27+/m0/s1	KKXDONJUIJKAIN-BCQCSXDESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K36164005	BRD-K36164005-001-02-8	Broad Institute of MIT and Harvard	BRD-K36164005			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N5O5S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-25(29-30-32)20-38-27(21)18-31(3)39(36,37)26-13-11-24(12-14-26)23-8-5-4-6-9-23/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22-,27+/m0/s1	KKXDONJUIJKAIN-BCQCSXDESA-N	555.251540024							113375
MLS003129385	LSM-24786	BRD-K29264158	44505568	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18+,22-/m0/s1	DYYSINDAYMXOAQ-SVMVAKDDSA-N	COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K29264158	BRD-K29264158-001-02-0	Broad Institute of MIT and Harvard	BRD-K29264158			COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18+,22-/m0/s1	DYYSINDAYMXOAQ-SVMVAKDDSA-N	489.25873389							113376
MLS003129587	LSM-24787	BRD-K48050202, SID99357955	44495965	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18+,21+/m0/s1	NJZPXWDDBMYIMJ-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K48050202	BRD-K48050202-001-02-6	Broad Institute of MIT and Harvard	BRD-K48050202			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18+,21+/m0/s1	NJZPXWDDBMYIMJ-WAOWUJCRSA-N	430.269239008							113377
MLS003129554	LSM-24788	BRD-K64296795	44505157	InChI=1S/C28H37N5O6S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-23(16-29-30-33)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22+,27+/m0/s1	QEXGJGRYUGYWJV-OREGWCPLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K64296795	BRD-K64296795-001-02-7	Broad Institute of MIT and Harvard	BRD-K64296795			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N5O6S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-23(16-29-30-33)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22+,27+/m0/s1	QEXGJGRYUGYWJV-OREGWCPLSA-N	571.246454644							113378
MLS003129631	LSM-24003	SID99358039, BRD-K49039223	44505598	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21+/m1/s1	WMEBRZUCENJNIY-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K49039223	BRD-K49039223-001-02-3	Broad Institute of MIT and Harvard	BRD-K49039223			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21+/m1/s1	WMEBRZUCENJNIY-LQWHRVPQSA-N	464.31110382							112593
BRD-K24984327	LSM-24789		44505068	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)6-5-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-9-22(32-4)10-8-20/h7-10,14,18-19,23,30H,5-6,11-13,15-17H2,1-4H3/t18-,19-,23-/m1/s1	DSHXGOUIOHRIOZ-DNVFCKCGSA-N	COc1ccc(CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)cc1	BroadT	BRD-K24984327	BRD-K24984327-001-01-6	Broad Institute of MIT and Harvard	BRD-K24984327			COc1ccc(CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)cc1	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)6-5-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-9-22(32-4)10-8-20/h7-10,14,18-19,23,30H,5-6,11-13,15-17H2,1-4H3/t18-,19-,23-/m1/s1	DSHXGOUIOHRIOZ-DNVFCKCGSA-N	459.284554714							113379
MLS003129673	LSM-23930	BRD-K36882679	44504970	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17-,20+/m1/s1	IGJDKOMBBXSAPT-HLIPFELVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K36882679	BRD-K36882679-001-02-0	Broad Institute of MIT and Harvard	BRD-K36882679			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17-,20+/m1/s1	IGJDKOMBBXSAPT-HLIPFELVSA-N	444.248503564							112520
MLS003129299	LSM-24790	BRD-K68401280	44494076	InChI=1S/C20H36N6O4/c1-14(2)22-20(29)24(5)11-18-15(3)10-25(16(4)12-27)19(28)7-6-8-26-17(13-30-18)9-21-23-26/h9,14-16,18,27H,6-8,10-13H2,1-5H3,(H,22,29)/t15-,16-,18+/m1/s1	NAXYJFNCLMAYPS-NUJGCVRESA-N	CC(C)NC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K68401280	BRD-K68401280-001-02-1	Broad Institute of MIT and Harvard	BRD-K68401280			CC(C)NC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C20H36N6O4/c1-14(2)22-20(29)24(5)11-18-15(3)10-25(16(4)12-27)19(28)7-6-8-26-17(13-30-18)9-21-23-26/h9,14-16,18,27H,6-8,10-13H2,1-5H3,(H,22,29)/t15-,16-,18+/m1/s1	NAXYJFNCLMAYPS-NUJGCVRESA-N	424.279803692							113380
BRD-K75814223	LSM-24791		44505216	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18-,23-/m1/s1	GOEWTOAFXZXQCM-PMAPCBKXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K75814223	BRD-K75814223-001-01-8	Broad Institute of MIT and Harvard	BRD-K75814223			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18-,23-/m1/s1	GOEWTOAFXZXQCM-PMAPCBKXSA-N	473.26381927							113381
MLS003129658	LSM-24027	SID99358059, BRD-K48407262	44505791	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21+/m0/s1	WMEBRZUCENJNIY-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K48407262	BRD-K48407262-001-02-5	Broad Institute of MIT and Harvard	BRD-K48407262			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21+/m0/s1	WMEBRZUCENJNIY-WAOWUJCRSA-N	464.31110382							112617
BRD-K12836153	LSM-24792		44493573	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21+/m0/s1	FLBHXJCYMARYBO-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K12836153	BRD-K12836153-001-01-1	Broad Institute of MIT and Harvard	BRD-K12836153			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21+/m0/s1	FLBHXJCYMARYBO-CSODHUTKSA-N	513.181267574							113382
MLS003129197	LSM-24793	BRD-K60460300	44505458	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22+/m0/s1	ZODITPIVHHGZAH-NPPFBWRTSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K60460300	BRD-K60460300-001-02-1	Broad Institute of MIT and Harvard	BRD-K60460300			COc1ccccc1NC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22+/m0/s1	ZODITPIVHHGZAH-NPPFBWRTSA-N	488.274718312							113383
MLS003129410	LSM-24794	BRD-K71871382, SID99357710	44505006	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22+/m1/s1	YYALKDZNPSDWDC-HMFYCAOWSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)c1	BroadT	BRD-K71871382	BRD-K71871382-001-02-7	Broad Institute of MIT and Harvard	BRD-K71871382			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)c1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22+/m1/s1	YYALKDZNPSDWDC-HMFYCAOWSA-N	488.274718312							113384
BRD-K88448214	LSM-24795		44505247	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22+/m1/s1	YNSZNIPNNMZZOV-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K88448214	BRD-K88448214-001-01-1	Broad Institute of MIT and Harvard	BRD-K88448214			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22+/m1/s1	YNSZNIPNNMZZOV-HMFYCAOWSA-N	445.26890465							113385
MLS003129337	LSM-24064	BRD-K06507315, SID99357647	44493071	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17+,21+/m0/s1	HYXYHDZNHQRBPW-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K06507315	BRD-K06507315-001-02-9	Broad Institute of MIT and Harvard	BRD-K06507315			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)9-6-10-30-18(11-25-27-30)15-34-21(16)13-28(3)23(33)26-20-8-5-4-7-19(20)24/h4-5,7-8,11,16-17,21,31H,6,9-10,12-15H2,1-3H3,(H,26,33)/t16-,17+,21+/m0/s1	HYXYHDZNHQRBPW-CSODHUTKSA-N	476.254731796							112654
MLS003129661	LSM-23987	BRD-K30382953, SID99358061	44505194	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24+/m1/s1	KMYKLRXROVKHNJ-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K30382953	BRD-K30382953-001-02-4	Broad Institute of MIT and Harvard	BRD-K30382953			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19+,24+/m1/s1	KMYKLRXROVKHNJ-IMWIBFENSA-N	496.279803692							112577
BRD-K94803981	LSM-24796		44498555	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22+/m0/s1	HYDPWGICXZADLJ-NPPFBWRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K94803981	BRD-K94803981-001-01-0	Broad Institute of MIT and Harvard	BRD-K94803981			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22+/m0/s1	HYDPWGICXZADLJ-NPPFBWRTSA-N	445.26890465							113386
BRD-K96431636	LSM-24797		44505224	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20-,23-/m0/s1	RZJYZFKNZOCSJO-JTAQYXEDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K96431636	BRD-K96431636-001-01-7	Broad Institute of MIT and Harvard	BRD-K96431636			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20-,23-/m0/s1	RZJYZFKNZOCSJO-JTAQYXEDSA-N	443.289640094							113387
MLS003129374	LSM-24798	BRD-K98272474, SID99357680	44498551	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17+,22+/m1/s1	FSJQCDSATLDVBC-JLHGSKIFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K98272474	BRD-K98272474-001-02-6	Broad Institute of MIT and Harvard	BRD-K98272474			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17+,22+/m1/s1	FSJQCDSATLDVBC-JLHGSKIFSA-N	497.196045386							113388
MLS003129229	LSM-24799	BRD-K22384464, SID99357432	44506072	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18+,22+/m1/s1	DXNYPMFBKGSJNE-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K22384464	BRD-K22384464-001-02-2	Broad Institute of MIT and Harvard	BRD-K22384464			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18+,22+/m1/s1	DXNYPMFBKGSJNE-FGSXEWAUSA-N	497.261374598							113389
BRD-K12743035	LSM-24800		44505894	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28+/m0/s1	WVGLRASGSLBUCZ-UXWDXCIHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K12743035	BRD-K12743035-001-01-3	Broad Institute of MIT and Harvard	BRD-K12743035			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28+/m0/s1	WVGLRASGSLBUCZ-UXWDXCIHSA-N	521.300204778							113390
MLS003129916	LSM-24801	BRD-K81139344, SID99358409	44505324	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19+,21-/m1/s1	PKTOTAWSKYPRKJ-SVFBPWRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K81139344	BRD-K81139344-001-02-4	Broad Institute of MIT and Harvard	BRD-K81139344			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)13-27(19(3)15-29)23(30)10-7-11-28-20(16-33-21)12-24-25-28/h5-6,8-9,12,18-19,21,29H,7,10-11,13-16H2,1-4H3/t18-,19+,21-/m1/s1	PKTOTAWSKYPRKJ-SVFBPWRDSA-N	493.23588996							113391
MLS003129621	LSM-24802	BRD-K82638914	44505232	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)9-6-10-29-22(17-32-23)12-25-26-29/h5,7-8,11-12,19-20,23,30H,6,9-10,13-17H2,1-4H3/t19-,20+,23+/m1/s1	JFBDPIUUNLHCPK-QTEQDKRBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K82638914	BRD-K82638914-001-02-4	Broad Institute of MIT and Harvard	BRD-K82638914			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)9-6-10-29-22(17-32-23)12-25-26-29/h5,7-8,11-12,19-20,23,30H,6,9-10,13-17H2,1-4H3/t19-,20+,23+/m1/s1	JFBDPIUUNLHCPK-QTEQDKRBSA-N	443.289640094							113392
BRD-K42877297	LSM-24803		54631256	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22-,28-/m0/s1	UVZKFWVLTKDOOG-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K42877297	BRD-K42877297-001-01-6	Broad Institute of MIT and Harvard	BRD-K42877297			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cn(CCCC1=O)nn2	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22-,28-/m0/s1	UVZKFWVLTKDOOG-VPYPWEPUSA-N	563.322002862							113393
BRD-K95147720	LSM-24804		44505260	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)6-5-11-29-22(17-32-23)12-25-26-29/h7-10,12,19-20,23,30H,5-6,11,13-17H2,1-4H3/t19-,20+,23-/m0/s1	WGPDLCVCGOLGPE-MZKRTTBSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K95147720	BRD-K95147720-001-01-7	Broad Institute of MIT and Harvard	BRD-K95147720			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)6-5-11-29-22(17-32-23)12-25-26-29/h7-10,12,19-20,23,30H,5-6,11,13-17H2,1-4H3/t19-,20+,23-/m0/s1	WGPDLCVCGOLGPE-MZKRTTBSSA-N	443.289640094							113394
BRD-K00590556	LSM-24805		44505874	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20+,23-/m0/s1	UFUZIZHGCRPPRZ-MZKRTTBSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K00590556	BRD-K00590556-001-01-1	Broad Institute of MIT and Harvard	BRD-K00590556			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20+,23-/m0/s1	UFUZIZHGCRPPRZ-MZKRTTBSSA-N	443.289640094							113395
BRD-K21771537	LSM-24806		44505482	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22-/m0/s1	YNSZNIPNNMZZOV-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K21771537	BRD-K21771537-001-01-6	Broad Institute of MIT and Harvard	BRD-K21771537			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22-/m0/s1	YNSZNIPNNMZZOV-SVMVAKDDSA-N	445.26890465							113396
MLS003129168	LSM-24807	BRD-K74656131, SID99357503	44505804	InChI=1S/C24H36N6O5/c1-17-13-29(18(2)15-31)23(32)6-5-11-30-20(12-25-27-30)16-35-22(17)14-28(3)24(33)26-19-7-9-21(34-4)10-8-19/h7-10,12,17-18,22,31H,5-6,11,13-16H2,1-4H3,(H,26,33)/t17-,18+,22+/m0/s1	ZHGRDCMKBHHKPV-NJNPRVFISA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K74656131	BRD-K74656131-001-02-3	Broad Institute of MIT and Harvard	BRD-K74656131			COc1ccc(NC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C24H36N6O5/c1-17-13-29(18(2)15-31)23(32)6-5-11-30-20(12-25-27-30)16-35-22(17)14-28(3)24(33)26-19-7-9-21(34-4)10-8-19/h7-10,12,17-18,22,31H,5-6,11,13-16H2,1-4H3,(H,26,33)/t17-,18+,22+/m0/s1	ZHGRDCMKBHHKPV-NJNPRVFISA-N	488.274718312							113397
MLS003129617	LSM-24808	BRD-K13425292, SID99358027	44505589	InChI=1S/C24H35N5O5/c1-18-13-28(19(2)15-30)23(31)10-7-11-29-21(12-25-26-29)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,30H,7,10-11,13-17H2,1-3H3/t18-,19-,22-/m1/s1	DLYGSNKXPRYVCA-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)OCc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K13425292	BRD-K13425292-001-02-2	Broad Institute of MIT and Harvard	BRD-K13425292			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)OCc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-18-13-28(19(2)15-30)23(31)10-7-11-29-21(12-25-26-29)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,30H,7,10-11,13-17H2,1-3H3/t18-,19-,22-/m1/s1	DLYGSNKXPRYVCA-WOIUINJBSA-N	473.26381927							113398
MLS003129790	LSM-24809	SID99358270, BRD-K23817660	44505554	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)10-23(15(3)12-25)18(26)7-6-8-24-16(13-29-17)9-20-21-24/h9,14-15,17,25H,5-8,10-13H2,1-4H3/t14-,15+,17-/m0/s1	LAJDOZVBLFDPKV-UXLLHSPISA-N	CCOC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K23817660	BRD-K23817660-001-02-2	Broad Institute of MIT and Harvard	BRD-K23817660			CCOC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)10-23(15(3)12-25)18(26)7-6-8-24-16(13-29-17)9-20-21-24/h9,14-15,17,25H,5-8,10-13H2,1-4H3/t14-,15+,17-/m0/s1	LAJDOZVBLFDPKV-UXLLHSPISA-N	411.248169206							113399
BRD-K06091213	LSM-24810		44505030	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22+/m1/s1	KWAFQNIHTBJTFB-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K06091213	BRD-K06091213-001-01-9	Broad Institute of MIT and Harvard	BRD-K06091213			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22+/m1/s1	KWAFQNIHTBJTFB-FGSXEWAUSA-N	497.261374598							113400
BRD-K90163297	LSM-24811		44498554	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22+/m1/s1	HYDPWGICXZADLJ-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K90163297	BRD-K90163297-001-01-2	Broad Institute of MIT and Harvard	BRD-K90163297			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22+/m1/s1	HYDPWGICXZADLJ-FGSXEWAUSA-N	445.26890465							113401
MLS003130238	LSM-23937	BRD-K73562260, SID99359029	44484527	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15-,19+/m0/s1	ZMFVFBQYBHAIKE-YZVOILCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K73562260	BRD-K73562260-001-02-7	Broad Institute of MIT and Harvard	BRD-K73562260			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H35N7O5/c1-14-9-29(15(2)12-30)20(31)7-6-8-28-10-18(24-26-28)13-33-19(14)11-27(5)22(32)23-21-16(3)25-34-17(21)4/h10,14-15,19,30H,6-9,11-13H2,1-5H3,(H,23,32)/t14-,15-,19+/m0/s1	ZMFVFBQYBHAIKE-YZVOILCLSA-N	477.26996729							112527
BRD-K23535862-001-01-8	LSM-24812	BRD-K23535862	44486362	InChI=1S/C20H36N6O4/c1-14(2)21-20(29)24(5)11-18-15(3)9-26(16(4)12-27)19(28)7-6-8-25-10-17(13-30-18)22-23-25/h10,14-16,18,27H,6-9,11-13H2,1-5H3,(H,21,29)/t15-,16-,18+/m0/s1	UNRRBHFUILMFRI-XYJFISCASA-N	CC(C)NC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K23535862	BRD-K23535862-001-02-6	Broad Institute of MIT and Harvard	BRD-K23535862			CC(C)NC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C20H36N6O4/c1-14(2)21-20(29)24(5)11-18-15(3)9-26(16(4)12-27)19(28)7-6-8-25-10-17(13-30-18)22-23-25/h10,14-16,18,27H,6-9,11-13H2,1-5H3,(H,21,29)/t15-,16-,18+/m0/s1	UNRRBHFUILMFRI-XYJFISCASA-N	424.279803692							113402
BRD-K14567490	LSM-24813		44497245	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19-,21-/m1/s1	BGKHIKCFNCIYGU-SFHLNBCPSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K14567490	BRD-K14567490-001-01-2	Broad Institute of MIT and Harvard	BRD-K14567490			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19-,21-/m1/s1	BGKHIKCFNCIYGU-SFHLNBCPSA-N	493.23588996							113403
MLS003129312	LSM-24814	BRD-K50140257	44496390	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)10-7-11-27-13-19(24-25-27)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-4H3/t17-,18+,21+/m0/s1	WYMIJPVEWZCEGL-WAOWUJCRSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K50140257	BRD-K50140257-001-02-4	Broad Institute of MIT and Harvard	BRD-K50140257			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)10-7-11-27-13-19(24-25-27)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-4H3/t17-,18+,21+/m0/s1	WYMIJPVEWZCEGL-WAOWUJCRSA-N	509.23080458							113404
BRD-K46082763	LSM-24815		44505223	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18-,21+/m1/s1	QSHHTQCGWZKCKD-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K46082763	BRD-K46082763-001-01-4	Broad Institute of MIT and Harvard	BRD-K46082763			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18-,21+/m1/s1	QSHHTQCGWZKCKD-OPYAIIAOSA-N	430.269239008							113405
MLS003129503	LSM-23895	BRD-K87472370, SID99357835	44484508	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25+/m1/s1	KFMYUMLTCHBBFY-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K87472370	BRD-K87472370-001-02-0	Broad Institute of MIT and Harvard	BRD-K87472370			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25+/m1/s1	KFMYUMLTCHBBFY-FHAGJXEFSA-N	529.23588996							112483
BRD-K41355409	LSM-24816		44505968	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21+/m0/s1	OOPGLCWBUZVAMU-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K41355409	BRD-K41355409-001-01-9	Broad Institute of MIT and Harvard	BRD-K41355409			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21+/m0/s1	OOPGLCWBUZVAMU-XGHQBKJUSA-N	497.210818064							113406
MLS003129269	LSM-24817	BRD-K69777784	44505959	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21-/m0/s1	OOPGLCWBUZVAMU-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K69777784	BRD-K69777784-001-02-4	Broad Institute of MIT and Harvard	BRD-K69777784			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21-/m0/s1	OOPGLCWBUZVAMU-FIKGOQFSSA-N	497.210818064							113407
MLS003129297	LSM-23941	BRD-K77548697	44505992	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m0/s1	MESWQEBVROHANN-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K77548697	BRD-K77548697-001-02-5	Broad Institute of MIT and Harvard	BRD-K77548697			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m0/s1	MESWQEBVROHANN-IPJJNNNSSA-N	457.26890465							112531
BRD-K90048234	LSM-24818		44505873	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20-,23+/m1/s1	RZJYZFKNZOCSJO-VIZSFHNOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K90048234	BRD-K90048234-001-01-1	Broad Institute of MIT and Harvard	BRD-K90048234			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20-,23+/m1/s1	RZJYZFKNZOCSJO-VIZSFHNOSA-N	443.289640094							113408
MLS003129209	LSM-24819	BRD-K13241788	44492576	InChI=1S/C28H37N5O6S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-23(29-30-32)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22+,27+/m0/s1	SYWTUHWEQAODFK-OREGWCPLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K13241788	BRD-K13241788-001-02-4	Broad Institute of MIT and Harvard	BRD-K13241788			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N5O6S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-23(29-30-32)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22+,27+/m0/s1	SYWTUHWEQAODFK-OREGWCPLSA-N	571.246454644							113409
MLS003129342	LSM-23989	BRD-K94049419	44505972	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26+/m1/s1	MSGDIDWYZNYHQU-UFPGJGBJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K94049419	BRD-K94049419-001-02-0	Broad Institute of MIT and Harvard	BRD-K94049419			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26+/m1/s1	MSGDIDWYZNYHQU-UFPGJGBJSA-N	541.337652926							112579
BRD-K58168959	LSM-24820		44505126	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22-/m1/s1	AWVASGRLDZTAAI-KGVIQGDOSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K58168959	BRD-K58168959-001-01-0	Broad Institute of MIT and Harvard	BRD-K58168959			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22-/m1/s1	AWVASGRLDZTAAI-KGVIQGDOSA-N	509.23080458							113410
BRD-K54593730	LSM-24821		44504946	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19+,22-/m1/s1	GKHFKOWAUNRHGL-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K54593730	BRD-K54593730-001-01-9	Broad Institute of MIT and Harvard	BRD-K54593730			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19+,22-/m1/s1	GKHFKOWAUNRHGL-XQBPLPMBSA-N	493.23588996							113411
MLS003129105	LSM-24822	BRD-K21285405	44487419	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20-,25+/m1/s1	XVJRXGRWNAMAGP-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K21285405	BRD-K21285405-001-02-4	Broad Institute of MIT and Harvard	BRD-K21285405			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20-,25+/m1/s1	XVJRXGRWNAMAGP-FHAGJXEFSA-N	508.279803692							113412
BRD-K90756713	LSM-24823		44505951	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)9-6-10-28-20(16-33-22)12-24-25-28/h5,7-8,11-12,18-19,22,29H,6,9-10,13-16H2,1-4H3/t18-,19-,22+/m0/s1	GSLUEEWCAUTOBV-CNNODRBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K90756713	BRD-K90756713-001-01-9	Broad Institute of MIT and Harvard	BRD-K90756713			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)9-6-10-28-20(16-33-22)12-24-25-28/h5,7-8,11-12,18-19,22,29H,6,9-10,13-16H2,1-4H3/t18-,19-,22+/m0/s1	GSLUEEWCAUTOBV-CNNODRBYSA-N	493.23588996							113413
BRD-K47536398	LSM-24824		44504968	InChI=1S/C22H40N6O4/c1-17-13-27(18(2)15-29)22(31)9-7-11-28-19(12-23-24-28)16-32-20(17)14-26(5)21(30)8-6-10-25(3)4/h12,17-18,20,29H,6-11,13-16H2,1-5H3/t17-,18-,20-/m1/s1	HUEUWTADLJASSZ-QWFCFKBJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K47536398	BRD-K47536398-001-01-1	Broad Institute of MIT and Harvard	BRD-K47536398			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCc2cnnn2CCCC1=O	InChI=1S/C22H40N6O4/c1-17-13-27(18(2)15-29)22(31)9-7-11-28-19(12-23-24-28)16-32-20(17)14-26(5)21(30)8-6-10-25(3)4/h12,17-18,20,29H,6-11,13-16H2,1-5H3/t17-,18-,20-/m1/s1	HUEUWTADLJASSZ-QWFCFKBJSA-N	452.31110382							113414
MLS003130217	LSM-24056	BRD-K56261053	44506092	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20+,24+/m1/s1	XBPVHNZVBFLVIV-NMMYMHLASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K56261053	BRD-K56261053-001-02-8	Broad Institute of MIT and Harvard	BRD-K56261053			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc2cnnn2CCCC1=O	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20+,24+/m1/s1	XBPVHNZVBFLVIV-NMMYMHLASA-N	501.295119398							112646
BRD-K89366873	LSM-24825		44505771	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20-,25+/m0/s1	PZGTZQIYRXDXGV-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K89366873	BRD-K89366873-001-01-6	Broad Institute of MIT and Harvard	BRD-K89366873			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20-,25+/m0/s1	PZGTZQIYRXDXGV-ZYLNGJIFSA-N	509.26381927							113415
BRD-K93295557	LSM-24826		44497717	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)11-23(16(3)13-25)19(26)7-6-9-24-17(14-27-18)10-20-21-24/h10,15-16,18,25H,5-9,11-14H2,1-4H3/t15-,16-,18+/m0/s1	DWRDFVJCWRIGSC-XYJFISCASA-N	CCCN(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K93295557	BRD-K93295557-001-01-4	Broad Institute of MIT and Harvard	BRD-K93295557			CCCN(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C19H35N5O3/c1-5-8-22(4)12-18-15(2)11-23(16(3)13-25)19(26)7-6-9-24-17(14-27-18)10-20-21-24/h10,15-16,18,25H,5-9,11-14H2,1-4H3/t15-,16-,18+/m0/s1	DWRDFVJCWRIGSC-XYJFISCASA-N	381.27399003							113416
BRD-K24636862	LSM-24827		44485766	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20+,24-/m1/s1	ATOJIXFYNQCGDG-JXALWOEJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K24636862	BRD-K24636862-001-01-3	Broad Institute of MIT and Harvard	BRD-K24636862			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20+,24-/m1/s1	ATOJIXFYNQCGDG-JXALWOEJSA-N	501.295119398							113417
MLS003129109	LSM-23985	BRD-K67980010	44505774	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19+/m1/s1	MNAJUJYQFCFYAB-AOIWGVFYSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K67980010	BRD-K67980010-001-02-2	Broad Institute of MIT and Harvard	BRD-K67980010			CC(C)COC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19+/m1/s1	MNAJUJYQFCFYAB-AOIWGVFYSA-N	439.279469334							112575
BRD-K33752391	LSM-24828		44486346	InChI=1S/C22H40N6O4/c1-17-12-28(18(2)15-29)22(31)9-7-11-27-13-19(23-24-27)16-32-20(17)14-26(5)21(30)8-6-10-25(3)4/h13,17-18,20,29H,6-12,14-16H2,1-5H3/t17-,18-,20+/m1/s1	FFUZSDQFZDZTHE-GGPKGHCWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K33752391	BRD-K33752391-001-01-7	Broad Institute of MIT and Harvard	BRD-K33752391			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H40N6O4/c1-17-12-28(18(2)15-29)22(31)9-7-11-27-13-19(23-24-27)16-32-20(17)14-26(5)21(30)8-6-10-25(3)4/h13,17-18,20,29H,6-12,14-16H2,1-5H3/t17-,18-,20+/m1/s1	FFUZSDQFZDZTHE-GGPKGHCWSA-N	452.31110382							113418
MLS003129263	LSM-24031	BRD-K68202226	44505182	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17+/m1/s1	SUQCROIYCBRRRP-VYDXJSESSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K68202226	BRD-K68202226-001-02-0	Broad Institute of MIT and Harvard	BRD-K68202226			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15+,17+/m1/s1	SUQCROIYCBRRRP-VYDXJSESSA-N	463.240639154							112621
MLS003129768	LSM-24010	SID99358253, BRD-K83190598	44505565	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17+,19+/m1/s1	UOJDQXZVAPFQKD-AOIWGVFYSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K83190598	BRD-K83190598-001-02-8	Broad Institute of MIT and Harvard	BRD-K83190598			CC(C)COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17+,19+/m1/s1	UOJDQXZVAPFQKD-AOIWGVFYSA-N	439.279469334							112600
BRD-K34363290	LSM-24829		44505246	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19-,23+/m1/s1	RQWMQWHENJCHFR-PWHSHALESA-N	COc1cccc(CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)c1	BroadT	BRD-K34363290	BRD-K34363290-001-01-4	Broad Institute of MIT and Harvard	BRD-K34363290			COc1cccc(CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)c1	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19-,23+/m1/s1	RQWMQWHENJCHFR-PWHSHALESA-N	459.284554714							113419
BRD-K43261169	LSM-24830		44505569	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20+,25-/m1/s1	SUQKGVARFDJMIR-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K43261169	BRD-K43261169-001-01-7	Broad Institute of MIT and Harvard	BRD-K43261169			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20+,25-/m1/s1	SUQKGVARFDJMIR-OHUGHZGNSA-N	509.26381927							113420
BRD-K88038091	LSM-24831		44484537	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20-,24+/m1/s1	ATOJIXFYNQCGDG-REHUZNOOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K88038091	BRD-K88038091-001-01-8	Broad Institute of MIT and Harvard	BRD-K88038091			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20-,24+/m1/s1	ATOJIXFYNQCGDG-REHUZNOOSA-N	501.295119398							113421
BRD-K56616847	LSM-24832		44505657	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18-,22+/m1/s1	ZTOSEQHRKGCZOZ-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K56616847	BRD-K56616847-001-01-6	Broad Institute of MIT and Harvard	BRD-K56616847			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18-,22+/m1/s1	ZTOSEQHRKGCZOZ-HMFYCAOWSA-N	497.261374598							113422
BRD-K56131419	LSM-24833		44504929	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17-,21-/m0/s1	HYLLQKBLPQWSSO-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K56131419	BRD-K56131419-001-01-4	Broad Institute of MIT and Harvard	BRD-K56131419			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17-,21-/m0/s1	HYLLQKBLPQWSSO-FIKGOQFSSA-N	497.210818064							113423
BRD-K00566460	LSM-24834		44490868	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22+,26-/m1/s1	HFDOIJULVRDPRU-TVZXLZGTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K00566460	BRD-K00566460-001-01-6	Broad Institute of MIT and Harvard	BRD-K00566460			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22+,26-/m1/s1	HFDOIJULVRDPRU-TVZXLZGTSA-N	541.337652926							113424
MLS003129100	LSM-24835	BRD-K78809123, SID99359704	44505191	InChI=1S/C23H39N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h12,17-19,21,29H,4-11,13-16H2,1-3H3/t17-,18+,21+/m0/s1	UQDZIKNGRITESQ-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K78809123	BRD-K78809123-001-02-4	Broad Institute of MIT and Harvard	BRD-K78809123			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H39N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h12,17-19,21,29H,4-11,13-16H2,1-3H3/t17-,18+,21+/m0/s1	UQDZIKNGRITESQ-WAOWUJCRSA-N	449.300204778							113425
BRD-K58743752	LSM-24836		44505013	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28-/m1/s1	PZMMCWSZGDQDET-AWVRMFGXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K58743752	BRD-K58743752-001-01-9	Broad Institute of MIT and Harvard	BRD-K58743752			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28-/m1/s1	PZMMCWSZGDQDET-AWVRMFGXSA-N	505.305290158							113426
MLS003130342	LSM-24837	BRD-K74755318	44489278	InChI=1S/C17H31N5O3/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-25-16(13)10-20(3)4/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16+/m0/s1	PFQPPSPXSKCUPO-SQWLQELKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K74755318	BRD-K74755318-001-02-8	Broad Institute of MIT and Harvard	BRD-K74755318			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O3/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-25-16(13)10-20(3)4/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16+/m0/s1	PFQPPSPXSKCUPO-SQWLQELKSA-N	353.242689902							113427
BRD-K28465224	LSM-24838		44495445	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18-,22-/m1/s1	DMKVVNQLOZTLAB-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K28465224	BRD-K28465224-001-01-6	Broad Institute of MIT and Harvard	BRD-K28465224			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18-,22-/m1/s1	DMKVVNQLOZTLAB-JBYIUTFZSA-N	497.261374598							113428
MLS003129212	LSM-24839	BRD-K31584969, SID99357420	44505201	InChI=1S/C24H35N5O5/c1-18-13-28(19(2)15-30)23(31)10-7-11-29-21(12-25-26-29)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,30H,7,10-11,13-17H2,1-3H3/t18-,19+,22-/m1/s1	DLYGSNKXPRYVCA-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)OCc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K31584969	BRD-K31584969-001-02-6	Broad Institute of MIT and Harvard	BRD-K31584969			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)OCc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-18-13-28(19(2)15-30)23(31)10-7-11-29-21(12-25-26-29)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,30H,7,10-11,13-17H2,1-3H3/t18-,19+,22-/m1/s1	DLYGSNKXPRYVCA-XQBPLPMBSA-N	473.26381927							113429
MLS003130244	LSM-23904	BRD-K01250897, SID99359034	44505197	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25-/m0/s1	WIMCLPXWPPGBKL-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K01250897	BRD-K01250897-001-02-7	Broad Institute of MIT and Harvard	BRD-K01250897			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25-/m0/s1	WIMCLPXWPPGBKL-RLSLOFABSA-N	509.26381927							112492
BRD-K10358320	LSM-24840		44498553	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20-,23-/m0/s1	UFUZIZHGCRPPRZ-JTAQYXEDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K10358320	BRD-K10358320-001-01-6	Broad Institute of MIT and Harvard	BRD-K10358320			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20-,23-/m0/s1	UFUZIZHGCRPPRZ-JTAQYXEDSA-N	443.289640094							113430
BRD-K28319429	LSM-24841		44506062	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18-,22-/m0/s1	GQDZDOSXBZGUQJ-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K28319429	BRD-K28319429-001-01-8	Broad Institute of MIT and Harvard	BRD-K28319429			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18-,22-/m0/s1	GQDZDOSXBZGUQJ-SPEDKVCISA-N	445.26890465							113431
BRD-K58944125	LSM-24842		44484535	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19+,23-/m0/s1	AIDUMHXRFRBIIP-YYDVJCTNSA-N	COc1ccccc1CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K58944125	BRD-K58944125-001-01-3	Broad Institute of MIT and Harvard	BRD-K58944125			COc1ccccc1CN(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19+,23-/m0/s1	AIDUMHXRFRBIIP-YYDVJCTNSA-N	459.284554714							113432
MLS003129767	LSM-23891	SID99358252, BRD-K38969544	44492054	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19-,22-/m0/s1	YRBTUIBMTXMQGX-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K38969544	BRD-K38969544-001-02-6	Broad Institute of MIT and Harvard	BRD-K38969544			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19-,22-/m0/s1	YRBTUIBMTXMQGX-IPJJNNNSSA-N	473.26381927							112479
BRD-K52232548	LSM-24843		44505021	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18-,21+/m0/s1	QSHHTQCGWZKCKD-BBTUJRGHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K52232548	BRD-K52232548-001-01-8	Broad Institute of MIT and Harvard	BRD-K52232548			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18-,21+/m0/s1	QSHHTQCGWZKCKD-BBTUJRGHSA-N	430.269239008							113433
BRD-K86448296	LSM-24844		44505340	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)10-7-11-27-13-19(24-25-27)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-4H3/t17-,18-,21-/m1/s1	WYMIJPVEWZCEGL-DBXWQHBBSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K86448296	BRD-K86448296-001-01-4	Broad Institute of MIT and Harvard	BRD-K86448296			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)10-7-11-27-13-19(24-25-27)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-4H3/t17-,18-,21-/m1/s1	WYMIJPVEWZCEGL-DBXWQHBBSA-N	509.23080458							113434
BRD-K14681218	LSM-24845		44505820	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)5-4-10-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-8-6-18(7-9-19)24(25,26)27/h6-9,11,16-17,21,34H,4-5,10,12-15H2,1-3H3,(H,29,36)/t16-,17-,21+/m1/s1	MHRPTBSVTMBPJG-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K14681218	BRD-K14681218-001-01-2	Broad Institute of MIT and Harvard	BRD-K14681218			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H33F3N6O4/c1-16-12-32(17(2)14-34)22(35)5-4-10-33-20(11-28-30-33)15-37-21(16)13-31(3)23(36)29-19-8-6-18(7-9-19)24(25,26)27/h6-9,11,16-17,21,34H,4-5,10,12-15H2,1-3H3,(H,29,36)/t16-,17-,21+/m1/s1	MHRPTBSVTMBPJG-LZJOCLMNSA-N	526.251538196							113435
BRD-K29549246	LSM-24846		44505484	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22-/m1/s1	YNSZNIPNNMZZOV-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K29549246	BRD-K29549246-001-01-0	Broad Institute of MIT and Harvard	BRD-K29549246			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18+,22-/m1/s1	YNSZNIPNNMZZOV-KGVIQGDOSA-N	445.26890465							113436
MLS003129205	LSM-23950	BRD-K65135171, SID99357415	44505162	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16+/m0/s1	KPZGSTQZFNZEDR-SQWLQELKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K65135171	BRD-K65135171-001-02-0	Broad Institute of MIT and Harvard	BRD-K65135171			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16+/m0/s1	KPZGSTQZFNZEDR-SQWLQELKSA-N	417.204589832							112540
BRD-K02529187	LSM-24847		44504926	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17+,21-/m1/s1	HYLLQKBLPQWSSO-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K02529187	BRD-K02529187-001-01-4	Broad Institute of MIT and Harvard	BRD-K02529187			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17+,21-/m1/s1	HYLLQKBLPQWSSO-LLGFUMIMSA-N	497.210818064							113437
BRD-K92140823	LSM-24848		44505388	InChI=1S/C22H40N6O4/c1-17-13-27(18(2)15-29)22(31)9-7-11-28-19(12-23-24-28)16-32-20(17)14-26(5)21(30)8-6-10-25(3)4/h12,17-18,20,29H,6-11,13-16H2,1-5H3/t17-,18+,20-/m0/s1	HUEUWTADLJASSZ-NSHGMRRFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K92140823	BRD-K92140823-001-01-1	Broad Institute of MIT and Harvard	BRD-K92140823			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCc2cnnn2CCCC1=O	InChI=1S/C22H40N6O4/c1-17-13-27(18(2)15-29)22(31)9-7-11-28-19(12-23-24-28)16-32-20(17)14-26(5)21(30)8-6-10-25(3)4/h12,17-18,20,29H,6-11,13-16H2,1-5H3/t17-,18+,20-/m0/s1	HUEUWTADLJASSZ-NSHGMRRFSA-N	452.31110382							113438
MLS003129112	LSM-24849	BRD-K87901124, SID99357456	44505156	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)9-6-10-28-20(16-33-22)12-24-25-28/h5,7-8,11-12,18-19,22,29H,6,9-10,13-16H2,1-4H3/t18-,19+,22-/m0/s1	GSLUEEWCAUTOBV-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K87901124	BRD-K87901124-001-02-7	Broad Institute of MIT and Harvard	BRD-K87901124			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)9-6-10-28-20(16-33-22)12-24-25-28/h5,7-8,11-12,18-19,22,29H,6,9-10,13-16H2,1-4H3/t18-,19+,22-/m0/s1	GSLUEEWCAUTOBV-JQVVWYNYSA-N	493.23588996							113439
BRD-K80602847	LSM-24850		44488682	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21-/m0/s1	FLBHXJCYMARYBO-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K80602847	BRD-K80602847-001-01-6	Broad Institute of MIT and Harvard	BRD-K80602847			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21-/m0/s1	FLBHXJCYMARYBO-FVJLSDCUSA-N	513.181267574							113440
BRD-K81199760	LSM-24851		44505241	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20-,25-/m1/s1	OLIWWUKSUJJEPA-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K81199760	BRD-K81199760-001-01-5	Broad Institute of MIT and Harvard	BRD-K81199760			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20-,25-/m1/s1	OLIWWUKSUJJEPA-UMEGOILYSA-N	480.284889072							113441
MLS003129922	LSM-15083	SA-419090, SID99358415, BRD-K59501784	44505892	InChI=1S/C25H37N5O5/c1-18-13-29(19(2)16-31)25(32)5-4-8-30-21(12-26-27-30)17-35-24(18)15-28(3)14-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11-12,18-19,24,31H,4-5,8-10,13-17H2,1-3H3/t18-,19-,24+/m1/s1	KKGFASYBCNAVFA-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K59501784	BRD-K59501784-001-02-0	Broad Institute of MIT and Harvard	BRD-K59501784			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H37N5O5/c1-18-13-29(19(2)16-31)25(32)5-4-8-30-21(12-26-27-30)17-35-24(18)15-28(3)14-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11-12,18-19,24,31H,4-5,8-10,13-17H2,1-3H3/t18-,19-,24+/m1/s1	KKGFASYBCNAVFA-IECBHUPTSA-N	487.279469334							103739
MLS003129894	LSM-24852	BRD-K38446773	44505168	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21+/m1/s1	RIYOEJIKZKGUHQ-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K38446773	BRD-K38446773-001-02-7	Broad Institute of MIT and Harvard	BRD-K38446773			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21+/m1/s1	RIYOEJIKZKGUHQ-LZJOCLMNSA-N	497.210818064							113442
BRD-K95615652	LSM-24853		44505640	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20+,23+/m0/s1	RZJYZFKNZOCSJO-MIZPHKNDSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K95615652	BRD-K95615652-001-01-5	Broad Institute of MIT and Harvard	BRD-K95615652			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20+,23+/m0/s1	RZJYZFKNZOCSJO-MIZPHKNDSA-N	443.289640094							113443
BRD-K09106444	LSM-24854		44505127	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)8-5-9-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10-11,16-17,21,29H,5,8-9,12-15H2,1-3H3/t16-,17+,21-/m0/s1	KYGBGAWZQIYPEA-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K09106444	BRD-K09106444-001-01-3	Broad Institute of MIT and Harvard	BRD-K09106444			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)8-5-9-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10-11,16-17,21,29H,5,8-9,12-15H2,1-3H3/t16-,17+,21-/m0/s1	KYGBGAWZQIYPEA-FVJLSDCUSA-N	497.210818064							113444
BRD-K10133810	LSM-24855		44505026	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20+,23+/m1/s1	RZJYZFKNZOCSJO-QTEQDKRBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K10133810	BRD-K10133810-001-01-0	Broad Institute of MIT and Harvard	BRD-K10133810			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20+,23+/m1/s1	RZJYZFKNZOCSJO-QTEQDKRBSA-N	443.289640094							113445
MLS003129379	LSM-23960	BRD-K58696904	44505793	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18-,21-/m1/s1	WMEBRZUCENJNIY-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K58696904	BRD-K58696904-001-02-4	Broad Institute of MIT and Harvard	BRD-K58696904			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18-,21-/m1/s1	WMEBRZUCENJNIY-DBXWQHBBSA-N	464.31110382							112550
BRD-K79370456	LSM-24856		44505801	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26+/m0/s1	WJAIMBKFVIKGAD-VVZHRXSXSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K79370456	BRD-K79370456-001-01-5	Broad Institute of MIT and Harvard	BRD-K79370456			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26+/m0/s1	WJAIMBKFVIKGAD-VVZHRXSXSA-N	541.337652926							113446
BRD-K69089961	LSM-24857		44489279	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19-,23-/m1/s1	QHTRHHVBBSPOHC-DNVFCKCGSA-N	COc1ccccc1CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K69089961	BRD-K69089961-001-01-1	Broad Institute of MIT and Harvard	BRD-K69089961			COc1ccccc1CN(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19-,23-/m1/s1	QHTRHHVBBSPOHC-DNVFCKCGSA-N	459.284554714							113447
BRD-K21866464	LSM-24858		44487417	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20-,23-/m0/s1	PUSZFNDBKFADMS-JTAQYXEDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K21866464	BRD-K21866464-001-01-1	Broad Institute of MIT and Harvard	BRD-K21866464			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20-,23-/m0/s1	PUSZFNDBKFADMS-JTAQYXEDSA-N	544.31216646							131268
MLS003129798	LSM-24859	SID99358278, BRD-K56536241	44505990	InChI=1S/C23H33N5O5/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-19(12-24-25-28)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18-,21-/m0/s1	VVYGNONDBDDRFX-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K56536241	BRD-K56536241-001-02-6	Broad Institute of MIT and Harvard	BRD-K56536241			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33N5O5/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-19(12-24-25-28)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18-,21-/m0/s1	VVYGNONDBDDRFX-WFXMLNOXSA-N	459.248169206							131269
MLS003129891	LSM-23981	SID99358393, BRD-K25933460	44483911	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22-/m1/s1	YRBTUIBMTXMQGX-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K25933460	BRD-K25933460-001-02-7	Broad Institute of MIT and Harvard	BRD-K25933460			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22-/m1/s1	YRBTUIBMTXMQGX-XQBPLPMBSA-N	473.26381927							112571
MLS003129615	LSM-23884	BRD-K57084585	44506014	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21-/m1/s1	WMEBRZUCENJNIY-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K57084585	BRD-K57084585-001-02-0	Broad Institute of MIT and Harvard	BRD-K57084585			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H40N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h12,17-19,21,30H,4-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21-/m1/s1	WMEBRZUCENJNIY-LVCYWYKZSA-N	464.31110382							112472
SCHEMBL17487094	LSM-24860	BRD-K23825243	44505563	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)9-25(16(4)12-26)19(27)7-6-8-24-10-17(13-29-18)21-22-24/h10,14-16,18,26H,6-9,11-13H2,1-5H3/t15-,16-,18-/m0/s1	FYUBIBUWDYYNKH-BQFCYCMXSA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K23825243	BRD-K23825243-001-01-3	Broad Institute of MIT and Harvard	BRD-K23825243			CC(C)OC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)9-25(16(4)12-26)19(27)7-6-8-24-10-17(13-29-18)21-22-24/h10,14-16,18,26H,6-9,11-13H2,1-5H3/t15-,16-,18-/m0/s1	FYUBIBUWDYYNKH-BQFCYCMXSA-N	425.26381927							113452
MLS003129135	LSM-24861	BRD-K27263328	44505783	InChI=1S/C24H35N5O5/c1-18-13-28(19(2)15-30)23(31)10-7-11-29-21(12-25-26-29)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,30H,7,10-11,13-17H2,1-3H3/t18-,19+,22-/m0/s1	DLYGSNKXPRYVCA-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)OCc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K27263328	BRD-K27263328-001-02-9	Broad Institute of MIT and Harvard	BRD-K27263328			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)OCc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-18-13-28(19(2)15-30)23(31)10-7-11-29-21(12-25-26-29)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,30H,7,10-11,13-17H2,1-3H3/t18-,19+,22-/m0/s1	DLYGSNKXPRYVCA-JQVVWYNYSA-N	473.26381927							113453
BRD-K81725246	LSM-24862		44505546	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21-/m0/s1	RIYOEJIKZKGUHQ-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K81725246	BRD-K81725246-001-01-1	Broad Institute of MIT and Harvard	BRD-K81725246			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21-/m0/s1	RIYOEJIKZKGUHQ-FVJLSDCUSA-N	497.210818064							131270
MLS003129774	LSM-24005	SID99358257, BRD-K19662956	44505979	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20-/m1/s1	IGJDKOMBBXSAPT-FUHIMQAGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K19662956	BRD-K19662956-001-02-1	Broad Institute of MIT and Harvard	BRD-K19662956			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20-/m1/s1	IGJDKOMBBXSAPT-FUHIMQAGSA-N	444.248503564							112595
BRD-K12929741	LSM-24863		44505128	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17+,21-/m0/s1	HYLLQKBLPQWSSO-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K12929741	BRD-K12929741-001-01-3	Broad Institute of MIT and Harvard	BRD-K12929741			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17+,21-/m0/s1	HYLLQKBLPQWSSO-FVJLSDCUSA-N	497.210818064							113456
BRD-K71842353	LSM-24864		44505824	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21-/m1/s1	DVUZCPZOEGBIKA-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K71842353	BRD-K71842353-001-01-5	Broad Institute of MIT and Harvard	BRD-K71842353			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21-/m1/s1	DVUZCPZOEGBIKA-LLGFUMIMSA-N	526.251538196							113457
SCHEMBL17487090	LSM-24865	BRD-K56661847	44505758	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17-,19-/m0/s1	UOJDQXZVAPFQKD-LNLFQRSKSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K56661847	BRD-K56661847-001-01-2	Broad Institute of MIT and Harvard	BRD-K56661847			CC(C)COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17-,19-/m0/s1	UOJDQXZVAPFQKD-LNLFQRSKSA-N	439.279469334							113458
BRD-K05248348	LSM-24866		44505167	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21-/m1/s1	RIYOEJIKZKGUHQ-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K05248348	BRD-K05248348-001-01-4	Broad Institute of MIT and Harvard	BRD-K05248348			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21-/m1/s1	RIYOEJIKZKGUHQ-CBGDNZLLSA-N	497.210818064							113459
BRD-K62707745-001-01-8	LSM-24867	BRD-K62707745	44505611	InChI=1S/C23H34N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h4-6,8-9,12,17-18,21,30H,7,10-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21+/m0/s1	WDZBAJDPNLQQNP-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K62707745	BRD-K62707745-001-02-6	Broad Institute of MIT and Harvard	BRD-K62707745			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H34N6O4/c1-17-13-28(18(2)15-30)22(31)10-7-11-29-20(12-24-26-29)16-33-21(17)14-27(3)23(32)25-19-8-5-4-6-9-19/h4-6,8-9,12,17-18,21,30H,7,10-11,13-16H2,1-3H3,(H,25,32)/t17-,18+,21+/m0/s1	WDZBAJDPNLQQNP-WAOWUJCRSA-N	458.264153628							113460
BRD-K25993054	LSM-24868		44498556	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20-,23+/m0/s1	MEJUTVOAQGGYHA-SXWKCWPCSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K25993054	BRD-K25993054-001-01-5	Broad Institute of MIT and Harvard	BRD-K25993054			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20-,23+/m0/s1	MEJUTVOAQGGYHA-SXWKCWPCSA-N	443.289640094							113461
MLS003129924	LSM-24869	BRD-K77272277	44505566	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16-,18+/m1/s1	IKLKAEKDATVYNM-NUJGCVRESA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K77272277	BRD-K77272277-001-02-0	Broad Institute of MIT and Harvard	BRD-K77272277			CC(C)OC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16-,18+/m1/s1	IKLKAEKDATVYNM-NUJGCVRESA-N	425.26381927							113462
MLS003129736	LSM-24870	BRD-K83393282	44504948	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)9-6-10-28-18(11-24-25-28)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,11,16-17,20,29H,6,9-10,12-15H2,1-3H3/t16-,17+,20-/m0/s1	MFABSAUNVKQXNQ-QKLQHJQFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K83393282	BRD-K83393282-001-02-9	Broad Institute of MIT and Harvard	BRD-K83393282			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)9-6-10-28-18(11-24-25-28)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,11,16-17,20,29H,6,9-10,12-15H2,1-3H3/t16-,17+,20-/m0/s1	MFABSAUNVKQXNQ-QKLQHJQFSA-N	497.210818064							113463
MLS003129180	LSM-23900	BRD-K16670438	44497716	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20+,25+/m0/s1	OLIWWUKSUJJEPA-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K16670438	BRD-K16670438-001-02-5	Broad Institute of MIT and Harvard	BRD-K16670438			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20+,25+/m0/s1	OLIWWUKSUJJEPA-WZOHSFFVSA-N	480.284889072							112488
MLS003129669	LSM-24871	BRD-K53953065, SID99358067	44505775	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18-,22-/m0/s1	DYYSINDAYMXOAQ-SPEDKVCISA-N	COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K53953065	BRD-K53953065-001-02-9	Broad Institute of MIT and Harvard	BRD-K53953065			COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18-,22-/m0/s1	DYYSINDAYMXOAQ-SPEDKVCISA-N	489.25873389							113464
MLS003129406	LSM-24872	BRD-K87213231, SID99357706	44506076	InChI=1S/C25H37N5O5/c1-18-13-29(19(2)16-31)25(32)5-4-8-30-21(12-26-27-30)17-35-24(18)15-28(3)14-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11-12,18-19,24,31H,4-5,8-10,13-17H2,1-3H3/t18-,19+,24+/m1/s1	KKGFASYBCNAVFA-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K87213231	BRD-K87213231-001-02-7	Broad Institute of MIT and Harvard	BRD-K87213231			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H37N5O5/c1-18-13-29(19(2)16-31)25(32)5-4-8-30-21(12-26-27-30)17-35-24(18)15-28(3)14-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11-12,18-19,24,31H,4-5,8-10,13-17H2,1-3H3/t18-,19+,24+/m1/s1	KKGFASYBCNAVFA-IMWIBFENSA-N	487.279469334							113465
BRD-K36198653	LSM-24873		44505403	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25-/m1/s1	JATGFWCPGFHVCF-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K36198653	BRD-K36198653-001-01-3	Broad Institute of MIT and Harvard	BRD-K36198653			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25-/m1/s1	JATGFWCPGFHVCF-UMEGOILYSA-N	509.26381927							113466
BRD-K42671829	LSM-24874		44505496	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20-,23+/m0/s1	XSAFYGBYABXFOO-SXWKCWPCSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K42671829	BRD-K42671829-001-01-0	Broad Institute of MIT and Harvard	BRD-K42671829			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20-,23+/m0/s1	XSAFYGBYABXFOO-SXWKCWPCSA-N	443.289640094							113467
MLS003129508	LSM-24875	BRD-K64345025	44505350	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)8-5-9-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10-11,16-17,21,29H,5,8-9,12-15H2,1-3H3/t16-,17-,21-/m0/s1	KYGBGAWZQIYPEA-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K64345025	BRD-K64345025-001-02-4	Broad Institute of MIT and Harvard	BRD-K64345025			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)8-5-9-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10-11,16-17,21,29H,5,8-9,12-15H2,1-3H3/t16-,17-,21-/m0/s1	KYGBGAWZQIYPEA-FIKGOQFSSA-N	497.210818064							113468
BRD-K31187110	LSM-24876		44505255	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20+,23-/m0/s1	XSAFYGBYABXFOO-MZKRTTBSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K31187110	BRD-K31187110-001-01-8	Broad Institute of MIT and Harvard	BRD-K31187110			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20+,23-/m0/s1	XSAFYGBYABXFOO-MZKRTTBSSA-N	443.289640094							113469
MLS003130328	LSM-23868	BRD-K83527041, SID99359225	44490867	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m1/s1	DTQFALQSFDATTM-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K83527041	BRD-K83527041-001-02-4	Broad Institute of MIT and Harvard	BRD-K83527041			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m1/s1	DTQFALQSFDATTM-LZJOCLMNSA-N	526.251538196							112456
MLS003129102	LSM-24877	BRD-K74663731	44494934	InChI=1S/C23H33N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18+,21+/m0/s1	XQMLHVPKHCFFAW-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K74663731	BRD-K74663731-001-02-3	Broad Institute of MIT and Harvard	BRD-K74663731			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18+,21+/m0/s1	XQMLHVPKHCFFAW-WAOWUJCRSA-N	443.253254586							113470
BRD-K85059356	LSM-24878		44483912	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22+,26+/m1/s1	HFDOIJULVRDPRU-UFPGJGBJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K85059356	BRD-K85059356-001-01-7	Broad Institute of MIT and Harvard	BRD-K85059356			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22+,26+/m1/s1	HFDOIJULVRDPRU-UFPGJGBJSA-N	541.337652926							113471
BRD-K47113219	LSM-24879		44488696	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20+,23-/m0/s1	PUSZFNDBKFADMS-MZKRTTBSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K47113219	BRD-K47113219-001-01-6	Broad Institute of MIT and Harvard	BRD-K47113219			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20+,23-/m0/s1	PUSZFNDBKFADMS-MZKRTTBSSA-N	544.31216646							113472
BRD-K07762528	LSM-24880		44505034	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22+/m0/s1	KWAFQNIHTBJTFB-NPPFBWRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K07762528	BRD-K07762528-001-01-4	Broad Institute of MIT and Harvard	BRD-K07762528			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22+/m0/s1	KWAFQNIHTBJTFB-NPPFBWRTSA-N	497.261374598							113473
BRD-K95369587	LSM-24881		44505050	InChI=1S/C22H39N5O3/c1-17-11-27(18(2)15-28)22(29)9-6-10-26-13-20(23-24-26)16-30-21(17)14-25(3)12-19-7-4-5-8-19/h13,17-19,21,28H,4-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	FRGWQMAVHSUOQI-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K95369587	BRD-K95369587-001-01-9	Broad Institute of MIT and Harvard	BRD-K95369587			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H39N5O3/c1-17-11-27(18(2)15-28)22(29)9-6-10-26-13-20(23-24-26)16-30-21(17)14-25(3)12-19-7-4-5-8-19/h13,17-19,21,28H,4-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	FRGWQMAVHSUOQI-DBXWQHBBSA-N	421.305290158							113474
BRD-K34664417	LSM-24882		44492584	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22+/m1/s1	QAXWADXATYBNKX-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K34664417	BRD-K34664417-001-01-3	Broad Institute of MIT and Harvard	BRD-K34664417			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22+/m1/s1	QAXWADXATYBNKX-HMFYCAOWSA-N	497.261374598							113475
MLS003129378	LSM-24029	SID99357683, BRD-K78400597	44504996	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15-,17-/m0/s1	SUQCROIYCBRRRP-ZOBUZTSGSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	BroadT	BRD-K78400597	BRD-K78400597-001-02-9	Broad Institute of MIT and Harvard	BRD-K78400597			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C20H32F3N5O4/c1-14-10-27(15(2)12-29)19(31)5-4-8-28-16(9-24-25-28)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h9,14-15,17,29H,4-8,10-13H2,1-3H3/t14-,15-,17-/m0/s1	SUQCROIYCBRRRP-ZOBUZTSGSA-N	463.240639154							112619
BRD-K20847739	LSM-24883		44505125	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)10-7-11-27-13-19(24-25-27)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-4H3/t17-,18+,21-/m1/s1	WYMIJPVEWZCEGL-LVCYWYKZSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K20847739	BRD-K20847739-001-01-1	Broad Institute of MIT and Harvard	BRD-K20847739			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)10-7-11-27-13-19(24-25-27)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-4H3/t17-,18+,21-/m1/s1	WYMIJPVEWZCEGL-LVCYWYKZSA-N	509.23080458							113476
MLS003129751	LSM-24884	BRD-K78438852, SID99358191	44495432	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21+/m1/s1	XRXVGTRBMNTJPS-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K78438852	BRD-K78438852-001-02-9	Broad Institute of MIT and Harvard	BRD-K78438852			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21+/m1/s1	XRXVGTRBMNTJPS-WWMYMODYSA-N	513.181267574							113477
MLS003129315	LSM-23990	BRD-K61310138	44489266	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m0/s1	DTQFALQSFDATTM-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K61310138	BRD-K61310138-001-02-5	Broad Institute of MIT and Harvard	BRD-K61310138			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m0/s1	DTQFALQSFDATTM-XGHQBKJUSA-N	526.251538196							112580
MLS003129791	LSM-24047	BRD-K14470344, SID99358271	44496396	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	JATGFWCPGFHVCF-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K14470344	BRD-K14470344-001-02-5	Broad Institute of MIT and Harvard	BRD-K14470344			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	JATGFWCPGFHVCF-FHAGJXEFSA-N	509.26381927							112637
BRD-K30674856	LSM-24885		44505626	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19-,22+/m1/s1	ZIMKOTFORJXDIC-KNKQGSTJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K30674856	BRD-K30674856-001-01-4	Broad Institute of MIT and Harvard	BRD-K30674856			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19-,22+/m1/s1	ZIMKOTFORJXDIC-KNKQGSTJSA-N	435.320940222							113478
BRD-K47063692	LSM-24886		44489276	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18-,23+/m1/s1	ZLSVBQPGKZIPOU-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K47063692	BRD-K47063692-001-01-9	Broad Institute of MIT and Harvard	BRD-K47063692			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18-,23+/m1/s1	ZLSVBQPGKZIPOU-PNCHPQGNSA-N	473.26381927							113479
BRD-K10545066	LSM-24887		44488164	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18-,23+/m0/s1	ZLSVBQPGKZIPOU-IUKKYPGJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K10545066	BRD-K10545066-001-01-6	Broad Institute of MIT and Harvard	BRD-K10545066			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18-,23+/m0/s1	ZLSVBQPGKZIPOU-IUKKYPGJSA-N	473.26381927							113480
BRD-K93601851	LSM-24888		44505400	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25+/m0/s1	JATGFWCPGFHVCF-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K93601851	BRD-K93601851-001-01-6	Broad Institute of MIT and Harvard	BRD-K93601851			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25+/m0/s1	JATGFWCPGFHVCF-ZYLNGJIFSA-N	509.26381927							113481
BRD-K69620913	LSM-24889		44505472	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18-,23-/m0/s1	GOEWTOAFXZXQCM-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K69620913	BRD-K69620913-001-01-2	Broad Institute of MIT and Harvard	BRD-K69620913			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18-,23-/m0/s1	GOEWTOAFXZXQCM-BSRJHKFKSA-N	473.26381927							113482
BRD-K81592842	LSM-24890		44505455	InChI=1S/C23H41N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h12,18-20,22,29H,4-11,13-17H2,1-3H3/t18-,19-,22-/m1/s1	OPQMCYKWZYLZJV-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K81592842	BRD-K81592842-001-01-3	Broad Institute of MIT and Harvard	BRD-K81592842			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H41N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h12,18-20,22,29H,4-11,13-17H2,1-3H3/t18-,19-,22-/m1/s1	OPQMCYKWZYLZJV-WOIUINJBSA-N	435.320940222							113483
BRD-K05465626	LSM-24891		44505069	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20-,24-/m1/s1	XBPVHNZVBFLVIV-YOSAUDMPSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K05465626	BRD-K05465626-001-01-7	Broad Institute of MIT and Harvard	BRD-K05465626			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc2cnnn2CCCC1=O	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20-,24-/m1/s1	XBPVHNZVBFLVIV-YOSAUDMPSA-N	501.295119398							113484
MLS003129542	LSM-24008	SID99357918, BRD-K75073374	44505745	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16+/m1/s1	PUHFBKBPROGAIN-FMKPAKJESA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K75073374	BRD-K75073374-001-02-6	Broad Institute of MIT and Harvard	BRD-K75073374			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16+/m1/s1	PUHFBKBPROGAIN-FMKPAKJESA-N	417.204589832							112598
MLS003129775	LSM-24892	SID99358258, BRD-K39185798	44490866	InChI=1S/C18H31N5O5/c1-13-8-23(14(2)11-24)17(25)6-5-7-22-9-15(19-20-22)12-28-16(13)10-21(3)18(26)27-4/h9,13-14,16,24H,5-8,10-12H2,1-4H3/t13-,14+,16+/m1/s1	UUDITCQIVHGHRN-YCPHGPKFSA-N	COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K39185798	BRD-K39185798-001-02-1	Broad Institute of MIT and Harvard	BRD-K39185798			COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C18H31N5O5/c1-13-8-23(14(2)11-24)17(25)6-5-7-22-9-15(19-20-22)12-28-16(13)10-21(3)18(26)27-4/h9,13-14,16,24H,5-8,10-12H2,1-4H3/t13-,14+,16+/m1/s1	UUDITCQIVHGHRN-YCPHGPKFSA-N	397.232519142							113485
BRD-K04877446	LSM-24893		44488710	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13+,15+/m1/s1	DOGJCEWMCMFHOH-IPYPFGDCSA-N	CNC[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K04877446	BRD-K04877446-001-01-2	Broad Institute of MIT and Harvard	BRD-K04877446			CNC[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13+,15+/m1/s1	DOGJCEWMCMFHOH-IPYPFGDCSA-N	339.227039838							113486
BRD-K01467488	LSM-24894		44498142	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19-,22-/m1/s1	ZIMKOTFORJXDIC-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K01467488	BRD-K01467488-001-01-4	Broad Institute of MIT and Harvard	BRD-K01467488			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19-,22-/m1/s1	ZIMKOTFORJXDIC-WOIUINJBSA-N	435.320940222							113487
BRD-K23164928	LSM-24895		44617348	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22+,28-/m0/s1	UVZKFWVLTKDOOG-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K23164928	BRD-K23164928-001-01-9	Broad Institute of MIT and Harvard	BRD-K23164928			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cn(CCCC1=O)nn2	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22+,28-/m0/s1	UVZKFWVLTKDOOG-TYPXCFOJSA-N	563.322002862							113488
BRD-K89923892	LSM-24896		44492574	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21-/m1/s1	FLBHXJCYMARYBO-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K89923892	BRD-K89923892-001-01-1	Broad Institute of MIT and Harvard	BRD-K89923892			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21-/m1/s1	FLBHXJCYMARYBO-CBGDNZLLSA-N	513.181267574							113489
BRD-K27578003	LSM-24897		44505234	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22+/m1/s1	KWAFQNIHTBJTFB-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K27578003	BRD-K27578003-001-01-4	Broad Institute of MIT and Harvard	BRD-K27578003			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22+/m1/s1	KWAFQNIHTBJTFB-HMFYCAOWSA-N	497.261374598							113490
BRD-K82667180	LSM-24898		44505217	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28-/m0/s1	YAZCQYURBLEIHO-LXWOLXCRSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K82667180	BRD-K82667180-001-01-2	Broad Institute of MIT and Harvard	BRD-K82667180			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28-/m0/s1	YAZCQYURBLEIHO-LXWOLXCRSA-N	505.305290158							113491
BRD-K52104866	LSM-24899		44504956	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21-/m1/s1	RIYOEJIKZKGUHQ-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K52104866	BRD-K52104866-001-01-3	Broad Institute of MIT and Harvard	BRD-K52104866			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,21-/m1/s1	RIYOEJIKZKGUHQ-LLGFUMIMSA-N	497.210818064							113492
MLS003130350	LSM-24900	BRD-K98695520, SID99359238	44504927	InChI=1S/C22H33N5O5S/c1-17-13-26(18(2)15-28)22(29)10-7-11-27-19(12-23-24-27)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,28H,7,10-11,13-16H2,1-3H3/t17-,18+,21+/m1/s1	YDFSFENEUSKTIZ-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K98695520	BRD-K98695520-001-02-2	Broad Institute of MIT and Harvard	BRD-K98695520			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H33N5O5S/c1-17-13-26(18(2)15-28)22(29)10-7-11-27-19(12-23-24-27)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,28H,7,10-11,13-16H2,1-3H3/t17-,18+,21+/m1/s1	YDFSFENEUSKTIZ-LQWHRVPQSA-N	479.220239896							113493
MLS003129694	LSM-24901	BRD-K77108738, SID99358143	44505954	InChI=1S/C28H37N5O6S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-23(16-29-30-33)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22-,27-/m1/s1	QEXGJGRYUGYWJV-VHFRWLAGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K77108738	BRD-K77108738-001-02-9	Broad Institute of MIT and Harvard	BRD-K77108738			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N5O6S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-23(16-29-30-33)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22-,27-/m1/s1	QEXGJGRYUGYWJV-VHFRWLAGSA-N	571.246454644							113494
MLS003129204	LSM-24902	BRD-K31510639, SID99357414	44505754	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16+,18+/m1/s1	IKLKAEKDATVYNM-RYRKJORJSA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K31510639	BRD-K31510639-001-02-1	Broad Institute of MIT and Harvard	BRD-K31510639			CC(C)OC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16+,18+/m1/s1	IKLKAEKDATVYNM-RYRKJORJSA-N	425.26381927							113495
BRD-K98339888	LSM-15084		44505490	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18-,22-/m1/s1	QPXXSBPXMIWUTR-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K98339888	BRD-K98339888-001-01-5	Broad Institute of MIT and Harvard	BRD-K98339888			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18-,22-/m1/s1	QPXXSBPXMIWUTR-JBYIUTFZSA-N	445.26890465							103740
BRD-K17152303	LSM-24903		44483919	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19+,23-/m1/s1	QHTRHHVBBSPOHC-SELNLUPBSA-N	COc1ccccc1CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K17152303	BRD-K17152303-001-01-7	Broad Institute of MIT and Harvard	BRD-K17152303			COc1ccccc1CN(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19+,23-/m1/s1	QHTRHHVBBSPOHC-SELNLUPBSA-N	459.284554714							113496
BRD-K01853388	LSM-24904		44493571	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21-/m0/s1	FLBHXJCYMARYBO-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K01853388	BRD-K01853388-001-01-6	Broad Institute of MIT and Harvard	BRD-K01853388			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32ClN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21-/m0/s1	FLBHXJCYMARYBO-FIKGOQFSSA-N	513.181267574							113497
MLS003129443	LSM-23999	BRD-K27121064, SID99357784	44505561	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19-/m1/s1	MNAJUJYQFCFYAB-ZHALLVOQSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K27121064	BRD-K27121064-001-02-7	Broad Institute of MIT and Harvard	BRD-K27121064			CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17-,19-/m1/s1	MNAJUJYQFCFYAB-ZHALLVOQSA-N	439.279469334							112589
BRD-K21423945	LSM-24905		44505220	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20+,23-/m0/s1	RZJYZFKNZOCSJO-MZKRTTBSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K21423945	BRD-K21423945-001-01-0	Broad Institute of MIT and Harvard	BRD-K21423945			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20+,23-/m0/s1	RZJYZFKNZOCSJO-MZKRTTBSSA-N	443.289640094							113498
MLS003129242	LSM-23965	SID99357441, BRD-K46726368	44505591	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25+/m1/s1	GHLJLHKVBJDFKH-CZSZKKDXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K46726368	BRD-K46726368-001-02-3	Broad Institute of MIT and Harvard	BRD-K46726368			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25+/m1/s1	GHLJLHKVBJDFKH-CZSZKKDXSA-N	551.285617354							112555
MLS003129585	LSM-24906	BRD-K21771449, SID99357953	44494070	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21-/m0/s1	XRXVGTRBMNTJPS-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K21771449	BRD-K21771449-001-02-1	Broad Institute of MIT and Harvard	BRD-K21771449			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21-/m0/s1	XRXVGTRBMNTJPS-FIKGOQFSSA-N	513.181267574							113499
MLS003129607	LSM-24907	SID99358017, BRD-K89416748	44493580	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18-,21+/m1/s1	NJZPXWDDBMYIMJ-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K89416748	BRD-K89416748-001-02-0	Broad Institute of MIT and Harvard	BRD-K89416748			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18-,21+/m1/s1	NJZPXWDDBMYIMJ-OPYAIIAOSA-N	430.269239008							113500
BRD-K52468958	LSM-24908		44505058	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18+,22-/m1/s1	QPXXSBPXMIWUTR-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K52468958	BRD-K52468958-001-01-1	Broad Institute of MIT and Harvard	BRD-K52468958			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18+,22-/m1/s1	QPXXSBPXMIWUTR-KGVIQGDOSA-N	445.26890465							113501
MLS003129792	LSM-24909	BRD-K26005379	44505610	InChI=1S/C24H34N6O6/c1-16-11-29(17(2)13-31)23(32)5-4-8-30-19(10-25-27-30)14-34-22(16)12-28(3)24(33)26-18-6-7-20-21(9-18)36-15-35-20/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3,(H,26,33)/t16-,17+,22+/m1/s1	PARFVHOUOBIHJG-JLHGSKIFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K26005379	BRD-K26005379-001-02-3	Broad Institute of MIT and Harvard	BRD-K26005379			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H34N6O6/c1-16-11-29(17(2)13-31)23(32)5-4-8-30-19(10-25-27-30)14-34-22(16)12-28(3)24(33)26-18-6-7-20-21(9-18)36-15-35-20/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3,(H,26,33)/t16-,17+,22+/m1/s1	PARFVHOUOBIHJG-JLHGSKIFSA-N	502.253982868							113502
BRD-K61029307	LSM-24910		44506029	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)8-5-9-30-20(11-25-27-30)15-34-21(16)13-28(3)23(33)26-19-7-4-6-18(24)10-19/h4,6-7,10-11,16-17,21,31H,5,8-9,12-15H2,1-3H3,(H,26,33)/t16-,17-,21+/m0/s1	XWDPBYWAFGHHCX-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K61029307	BRD-K61029307-001-01-8	Broad Institute of MIT and Harvard	BRD-K61029307			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33FN6O4/c1-16-12-29(17(2)14-31)22(32)8-5-9-30-20(11-25-27-30)15-34-21(16)13-28(3)23(33)26-19-7-4-6-18(24)10-19/h4,6-7,10-11,16-17,21,31H,5,8-9,12-15H2,1-3H3,(H,26,33)/t16-,17-,21+/m0/s1	XWDPBYWAFGHHCX-XGHQBKJUSA-N	476.254731796							113503
MLS003130210	LSM-24050	BRD-K56183302	44505386	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20+/m0/s1	IGJDKOMBBXSAPT-SQGPQFPESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K56183302	BRD-K56183302-001-02-3	Broad Institute of MIT and Harvard	BRD-K56183302			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17+,20+/m0/s1	IGJDKOMBBXSAPT-SQGPQFPESA-N	444.248503564							112640
MLS003129188	LSM-23997	BRD-K20722478, SID99357517	44506049	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23+/m1/s1	GOEWTOAFXZXQCM-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K20722478	BRD-K20722478-001-02-9	Broad Institute of MIT and Harvard	BRD-K20722478			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23+/m1/s1	GOEWTOAFXZXQCM-STSQHVNTSA-N	473.26381927							112587
BRD-K27986637	LSM-6803		44505237	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19+,24-/m0/s1	DSHPDBIZJLDJKA-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K27986637	BRD-K27986637-001-01-3	Broad Institute of MIT and Harvard	BRD-K27986637			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19+,24-/m0/s1	DSHPDBIZJLDJKA-GLDPYIMESA-N	487.279469334							95424
MLS003129151	LSM-23898	BRD-K05229696, SID85812902, SID99357490	44505797	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23+/m0/s1	RIHXBZGHHXCGPP-MIZPHKNDSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K05229696	BRD-K05229696-001-02-0	Broad Institute of MIT and Harvard	BRD-K05229696			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cnnn2CCCC1=O	InChI=1S/C26H40N8O5/c1-19-15-33(20(2)17-35)25(36)5-4-8-34-22(14-28-30-34)18-39-23(19)16-31(3)26(37)29-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13-14,19-20,23,35H,4-5,8-12,15-18H2,1-3H3,(H,27,29,37)/t19-,20+,23+/m0/s1	RIHXBZGHHXCGPP-MIZPHKNDSA-N	544.31216646							112486
MLS003130211	LSM-24911	BRD-K27612721	44506022	InChI=1S/C24H34N6O6/c1-16-11-29(17(2)13-31)23(32)5-4-8-30-19(10-25-27-30)14-34-22(16)12-28(3)24(33)26-18-6-7-20-21(9-18)36-15-35-20/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3,(H,26,33)/t16-,17+,22-/m0/s1	PARFVHOUOBIHJG-JKSBSHDWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K27612721	BRD-K27612721-001-02-0	Broad Institute of MIT and Harvard	BRD-K27612721			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H34N6O6/c1-16-11-29(17(2)13-31)23(32)5-4-8-30-19(10-25-27-30)14-34-22(16)12-28(3)24(33)26-18-6-7-20-21(9-18)36-15-35-20/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3,(H,26,33)/t16-,17+,22-/m0/s1	PARFVHOUOBIHJG-JKSBSHDWSA-N	502.253982868							113504
MLS003130336	LSM-23935	BRD-K98427581	44486965	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20+,23+/m1/s1	PUSZFNDBKFADMS-QTEQDKRBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K98427581	BRD-K98427581-001-02-6	Broad Institute of MIT and Harvard	BRD-K98427581			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N8O5/c1-19-14-34(20(2)17-35)25(36)5-4-8-33-15-22(29-30-33)18-39-23(19)16-31(3)26(37)28-21-6-7-27-24(13-21)32-9-11-38-12-10-32/h6-7,13,15,19-20,23,35H,4-5,8-12,14,16-18H2,1-3H3,(H,27,28,37)/t19-,20+,23+/m1/s1	PUSZFNDBKFADMS-QTEQDKRBSA-N	544.31216646							112525
MLS003129470	LSM-24912	BRD-K05957858, SID99357806	44489274	InChI=1S/C24H36N6O5/c1-17-13-29(18(2)15-31)23(32)10-7-11-30-19(12-25-27-30)16-35-22(17)14-28(3)24(33)26-20-8-5-6-9-21(20)34-4/h5-6,8-9,12,17-18,22,31H,7,10-11,13-16H2,1-4H3,(H,26,33)/t17-,18+,22+/m1/s1	LJFLDXJAOYTNMN-FGSXEWAUSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K05957858	BRD-K05957858-001-02-0	Broad Institute of MIT and Harvard	BRD-K05957858			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H36N6O5/c1-17-13-29(18(2)15-31)23(32)10-7-11-30-19(12-25-27-30)16-35-22(17)14-28(3)24(33)26-20-8-5-6-9-21(20)34-4/h5-6,8-9,12,17-18,22,31H,7,10-11,13-16H2,1-4H3,(H,26,33)/t17-,18+,22+/m1/s1	LJFLDXJAOYTNMN-FGSXEWAUSA-N	488.274718312							113505
BRD-K46609723	LSM-24913		44505578	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25+/m0/s1	WIMCLPXWPPGBKL-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K46609723	BRD-K46609723-001-01-3	Broad Institute of MIT and Harvard	BRD-K46609723			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25+/m0/s1	WIMCLPXWPPGBKL-WZOHSFFVSA-N	509.26381927							113506
MLS003129511	LSM-24914	BRD-K84013239, SID99357893	44505158	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21-/m0/s1	OOPGLCWBUZVAMU-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K84013239	BRD-K84013239-001-02-6	Broad Institute of MIT and Harvard	BRD-K84013239			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21-/m0/s1	OOPGLCWBUZVAMU-FVJLSDCUSA-N	497.210818064							113507
BRD-K63616423	LSM-24915		44493076	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18-,21+/m0/s1	QXBLKCOAOVMUQM-BBTUJRGHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K63616423	BRD-K63616423-001-01-9	Broad Institute of MIT and Harvard	BRD-K63616423			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18-,21+/m0/s1	QXBLKCOAOVMUQM-BBTUJRGHSA-N	430.269239008							113508
MLS003129296	LSM-24916	BRD-K85532298, SID99357557	44505466	InChI=1S/C24H36N6O5/c1-17-13-29(18(2)15-31)23(32)9-6-10-30-20(12-25-27-30)16-35-22(17)14-28(3)24(33)26-19-7-5-8-21(11-19)34-4/h5,7-8,11-12,17-18,22,31H,6,9-10,13-16H2,1-4H3,(H,26,33)/t17-,18+,22-/m0/s1	CFCAPIQLQJKCRL-SVMVAKDDSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)c1	BroadT	BRD-K85532298	BRD-K85532298-001-02-2	Broad Institute of MIT and Harvard	BRD-K85532298			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)c1	InChI=1S/C24H36N6O5/c1-17-13-29(18(2)15-31)23(32)9-6-10-30-20(12-25-27-30)16-35-22(17)14-28(3)24(33)26-19-7-5-8-21(11-19)34-4/h5,7-8,11-12,17-18,22,31H,6,9-10,13-16H2,1-4H3,(H,26,33)/t17-,18+,22-/m0/s1	CFCAPIQLQJKCRL-SVMVAKDDSA-N	488.274718312							113509
MLS003129376	LSM-24917	BRD-K52124788	44493066	InChI=1S/C23H33N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18+,21-/m0/s1	XQMLHVPKHCFFAW-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K52124788	BRD-K52124788-001-02-4	Broad Institute of MIT and Harvard	BRD-K52124788			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18+,21-/m0/s1	XQMLHVPKHCFFAW-UEXGIBASSA-N	443.253254586							113510
MLS003129394	LSM-15082	BRD-K86546828, SA-418267	44505769	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18-,22-/m1/s1	DYYSINDAYMXOAQ-JBYIUTFZSA-N	COc1ccc(OC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K86546828	BRD-K86546828-001-02-0	Broad Institute of MIT and Harvard	BRD-K86546828			COc1ccc(OC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C24H35N5O6/c1-17-13-28(18(2)15-30)23(31)6-5-11-29-19(12-25-26-29)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,30H,5-6,11,13-16H2,1-4H3/t17-,18-,22-/m1/s1	DYYSINDAYMXOAQ-JBYIUTFZSA-N	489.25873389							103738
BRD-K15508005	LSM-24918		44506051	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20-,23-/m1/s1	RZJYZFKNZOCSJO-TXTKFYIRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K15508005	BRD-K15508005-001-01-3	Broad Institute of MIT and Harvard	BRD-K15508005			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)10-7-11-28-14-22(17-32-23)25-26-28/h5-6,8-9,14,19-20,23,30H,7,10-13,15-17H2,1-4H3/t19-,20-,23-/m1/s1	RZJYZFKNZOCSJO-TXTKFYIRSA-N	443.289640094							113511
MLS003129388	LSM-24919	BRD-K44371786, SID99357691	44505576	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20-,25-/m0/s1	PZGTZQIYRXDXGV-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K44371786	BRD-K44371786-001-02-4	Broad Institute of MIT and Harvard	BRD-K44371786			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20-,25-/m0/s1	PZGTZQIYRXDXGV-RLSLOFABSA-N	509.26381927							113512
MLS003129155	LSM-24920	BRD-K50593511	44505969	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21+/m0/s1	RIYOEJIKZKGUHQ-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K50593511	BRD-K50593511-001-02-6	Broad Institute of MIT and Harvard	BRD-K50593511			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)5-4-10-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,12,16-17,21,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,21+/m0/s1	RIYOEJIKZKGUHQ-XGHQBKJUSA-N	497.210818064							113513
BRD-K16705434	LSM-24921		44505494	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20-,24-/m0/s1	XBPVHNZVBFLVIV-SKPFHBQLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K16705434	BRD-K16705434-001-01-5	Broad Institute of MIT and Harvard	BRD-K16705434			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc2cnnn2CCCC1=O	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20-,24-/m0/s1	XBPVHNZVBFLVIV-SKPFHBQLSA-N	501.295119398							113514
MLS003129722	LSM-24922	BRD-K49664555	44505551	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)10-23(15(3)12-25)18(26)7-6-8-24-16(13-29-17)9-20-21-24/h9,14-15,17,25H,5-8,10-13H2,1-4H3/t14-,15-,17-/m1/s1	LAJDOZVBLFDPKV-BFYDXBDKSA-N	CCOC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K49664555	BRD-K49664555-001-02-6	Broad Institute of MIT and Harvard	BRD-K49664555			CCOC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)10-23(15(3)12-25)18(26)7-6-8-24-16(13-29-17)9-20-21-24/h9,14-15,17,25H,5-8,10-13H2,1-4H3/t14-,15-,17-/m1/s1	LAJDOZVBLFDPKV-BFYDXBDKSA-N	411.248169206							113515
MLS003129653	LSM-24923	SID99358054, BRD-K81217407	44494073	InChI=1S/C23H33N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18+,21-/m1/s1	XQMLHVPKHCFFAW-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K81217407	BRD-K81217407-001-02-2	Broad Institute of MIT and Harvard	BRD-K81217407			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18+,21-/m1/s1	XQMLHVPKHCFFAW-LVCYWYKZSA-N	443.253254586							113516
MLS003129430	LSM-24924	BRD-K13235291	44505155	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19-,22+/m0/s1	GKHFKOWAUNRHGL-CNNODRBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K13235291	BRD-K13235291-001-02-6	Broad Institute of MIT and Harvard	BRD-K13235291			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-5-8-21(11-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)9-6-10-27-13-20(16-33-22)24-25-27/h5,7-8,11,13,18-19,22,29H,6,9-10,12,14-16H2,1-4H3/t18-,19-,22+/m0/s1	GKHFKOWAUNRHGL-CNNODRBYSA-N	493.23588996							113517
MLS003129164	LSM-24024	SID99357500, BRD-K53647853	44505192	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22+/m0/s1	MESWQEBVROHANN-NNMXDRDESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K53647853	BRD-K53647853-001-02-3	Broad Institute of MIT and Harvard	BRD-K53647853			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22+/m0/s1	MESWQEBVROHANN-NNMXDRDESA-N	457.26890465							112614
BRD-K39449072	LSM-24925		44489810	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19-,22+/m1/s1	AIVZVDBTBOXKNA-KNKQGSTJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K39449072	BRD-K39449072-001-01-0	Broad Institute of MIT and Harvard	BRD-K39449072			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19-,22+/m1/s1	AIVZVDBTBOXKNA-KNKQGSTJSA-N	429.27399003							113518
BRD-K88924787	LSM-24926		54631255	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22-,28+/m1/s1	DAHNEQAICFEUKA-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cnnn4CCCC1=O	BroadT	BRD-K88924787	BRD-K88924787-001-01-8	Broad Institute of MIT and Harvard	BRD-K88924787			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cnnn2CCCC1=O	InChI=1S/C30H41N7O4/c1-21-16-36(22(2)19-38)29(39)9-6-14-37-25(15-32-34-37)20-41-28(21)18-35(3)17-23-10-12-24(13-11-23)30(40)33-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,15,21-22,28,38H,6,9,14,16-20,31H2,1-3H3,(H,33,40)/t21-,22-,28+/m1/s1	DAHNEQAICFEUKA-XJGOYTCSSA-N	563.322002862							113519
MLS003129593	LSM-23917	BRD-K56272400, SID99358008	44505067	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18+,22+/m1/s1	QZCZRKJJOTUXQW-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K56272400	BRD-K56272400-001-02-5	Broad Institute of MIT and Harvard	BRD-K56272400			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18+,22+/m1/s1	QZCZRKJJOTUXQW-FGSXEWAUSA-N	497.261374598							131266
BRD-K46839342	LSM-24927		44505854	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22-/m1/s1	YYALKDZNPSDWDC-KGVIQGDOSA-N	COc1cccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)c1	BroadT	BRD-K46839342	BRD-K46839342-001-01-7	Broad Institute of MIT and Harvard	BRD-K46839342			COc1cccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)c1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22-/m1/s1	YYALKDZNPSDWDC-KGVIQGDOSA-N	488.274718312							113520
BRD-K83872468	LSM-24928		44491462	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18+,23-/m1/s1	ZLSVBQPGKZIPOU-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K83872468	BRD-K83872468-001-01-0	Broad Institute of MIT and Harvard	BRD-K83872468			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18+,23-/m1/s1	ZLSVBQPGKZIPOU-IEGUWTFLSA-N	473.26381927							113521
MLS003130343	LSM-24929	BRD-K51104732, SID99359233	44505570	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16-,18-/m1/s1	IKLKAEKDATVYNM-JFIYKMOQSA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K51104732	BRD-K51104732-001-02-4	Broad Institute of MIT and Harvard	BRD-K51104732			CC(C)OC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16-,18-/m1/s1	IKLKAEKDATVYNM-JFIYKMOQSA-N	425.26381927							113522
MLS003129684	LSM-24930	BRD-K41389177	44493063	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21-/m1/s1	XRXVGTRBMNTJPS-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K41389177	BRD-K41389177-001-02-6	Broad Institute of MIT and Harvard	BRD-K41389177			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21-/m1/s1	XRXVGTRBMNTJPS-CBGDNZLLSA-N	513.181267574							113523
BRD-K55311609	LSM-24931		44505663	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18-,22-/m0/s1	QZCZRKJJOTUXQW-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K55311609	BRD-K55311609-001-01-3	Broad Institute of MIT and Harvard	BRD-K55311609			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18-,22-/m0/s1	QZCZRKJJOTUXQW-SPEDKVCISA-N	497.261374598							113524
MLS003129250	LSM-23887	BRD-K57026098	44505746	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26+/m0/s1	MSGDIDWYZNYHQU-VVZHRXSXSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K57026098	BRD-K57026098-001-02-1	Broad Institute of MIT and Harvard	BRD-K57026098			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26+/m0/s1	MSGDIDWYZNYHQU-VVZHRXSXSA-N	541.337652926							112475
BRD-K59069382	LSM-24932		44496826	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25-/m1/s1	JATGFWCPGFHVCF-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K59069382	BRD-K59069382-001-01-6	Broad Institute of MIT and Harvard	BRD-K59069382			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25-/m1/s1	JATGFWCPGFHVCF-OHUGHZGNSA-N	509.26381927							113525
BRD-K96968070	LSM-24933		44505214	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20-,23-/m1/s1	UFUZIZHGCRPPRZ-TXTKFYIRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K96968070	BRD-K96968070-001-01-1	Broad Institute of MIT and Harvard	BRD-K96968070			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-8-5-6-9-21(18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)10-7-11-29-22(17-32-23)12-25-26-29/h5-6,8-9,12,19-20,23,30H,7,10-11,13-17H2,1-4H3/t19-,20-,23-/m1/s1	UFUZIZHGCRPPRZ-TXTKFYIRSA-N	443.289640094							113526
MLS003129696	LSM-24934	BRD-K86914375	44492575	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21-/m1/s1	XRXVGTRBMNTJPS-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K86914375	BRD-K86914375-001-02-7	Broad Institute of MIT and Harvard	BRD-K86914375			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32ClN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17+,21-/m1/s1	XRXVGTRBMNTJPS-LLGFUMIMSA-N	513.181267574							113527
Ronidazole	LSM-5987	Ronidazole	5094	InChI=1S/C6H8N4O4/c1-9-4(3-14-6(7)11)8-2-5(9)10(12)13/h2H,3H2,1H3,(H2,7,11)	PQFRTXSWDXZRRS-UHFFFAOYSA-N	Cn1c(COC(=O)N)ncc1[N+](=O)[O-]	BroadT	BRD-K94266545	BRD-K94266545-001-04-3	MicroSource Discovery Systems Inc.	1501154			Cn1c(COC(N)=O)ncc1[N+]([O-])=O	InChI=1S/C6H8N4O4/c1-9-4(3-14-6(7)11)8-2-5(9)10(12)13/h2H,3H2,1H3,(H2,7,11)	PQFRTXSWDXZRRS-UHFFFAOYSA-N	200.054554776							94804
NSC665366	LSM-3775	SID511135, SID26751882, SID11113690, BRD-K78844995	127898	InChI=1S/C14H19IN2O/c15-13-6-4-12(5-7-13)14(18)16-8-11-17-9-2-1-3-10-17/h4-7H,1-3,8-11H2,(H,16,18)	WCMWVYQHPUQKHW-UHFFFAOYSA-N	Ic1ccc(cc1)C(=O)NCCN2CCCCC2	BroadT	BRD-K78844995	BRD-K78844995-001-01-8	Tocris Bioscience	763	1		Ic1ccc(cc1)C(=O)NCCN1CCCCC1	InChI=1S/C14H19IN2O/c15-13-6-4-12(5-7-13)14(18)16-8-11-17-9-2-1-3-10-17/h4-7H,1-3,8-11H2,(H,16,18)	WCMWVYQHPUQKHW-UHFFFAOYSA-N	358.054206248							93391
SD 169	LSM-4054	SD-169, SID90340772	14973220	InChI=1S/C9H8N2O/c10-9(12)7-1-2-8-6(5-7)3-4-11-8/h1-5,11H,(H2,10,12)	GQMYQEAXTITUAE-UHFFFAOYSA-N	NC(=O)c1ccc2[nH]ccc2c1	BroadT	BRD-K91904471	BRD-K91904471-001-01-6	Tocris Bioscience	2938	1		NC(=O)c1ccc2[nH]ccc2c1	InChI=1S/C9H8N2O/c10-9(12)7-1-2-8-6(5-7)3-4-11-8/h1-5,11H,(H2,10,12)	GQMYQEAXTITUAE-UHFFFAOYSA-N	160.063662896							93599
9-Octadecenamide,n-[(4-hydroxy-3-methoxyphenyl)methyl]-	LSM-3941	Olvanil	42760	InChI=1S/C26H43NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(29)27-22-23-19-20-24(28)25(21-23)30-2/h10-11,19-21,28H,3-9,12-18,22H2,1-2H3,(H,27,29)	OPZKBPQVWDSATI-UHFFFAOYSA-N	CCCCCCCCC=CCCCCCCCC(=O)NCc1ccc(O)c(OC)c1	BroadT	BRD-K86958018	BRD-K86958018-001-01-9	Tocris Bioscience	934	3		CCCCCCCCC=CCCCCCCCC(=O)NCc1ccc(O)c(OC)c1	InChI=1S/C26H43NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(29)27-22-23-19-20-24(28)25(21-23)30-2/h10-11,19-21,28H,3-9,12-18,22H2,1-2H3,(H,27,29)	OPZKBPQVWDSATI-UHFFFAOYSA-N	417.324294246							93517
SC68376	LSM-3919	SC-68376	5174	InChI=1S/C15H12N2O/c1-11-17-14(12-5-3-2-4-6-12)15(18-11)13-7-9-16-10-8-13/h2-10H,1H3	BHWCZLOXTLWZAQ-UHFFFAOYSA-N	Cc1oc(c2ccncc2)c(n1)c3ccccc3	BroadT	BRD-K85871428	BRD-K85871428-001-01-9	Calbiochem	565625			Cc1nc(c(o1)-c1ccncc1)-c1ccccc1	InChI=1S/C15H12N2O/c1-11-17-14(12-5-3-2-4-6-12)15(18-11)13-7-9-16-10-8-13/h2-10H,1H3	BHWCZLOXTLWZAQ-UHFFFAOYSA-N	236.094963024							93498
Tamoxifen	LSM-42959	Nolvadex, Soltamox, Tamoxifen, ICI-46474	2733526	InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-	NKANXQFJJICGDU-QPLCGJKRSA-N	CC\C(=C(/c1ccccc1)\c2ccc(OCCN(C)C)cc2)\c3ccccc3	BroadT	BRD-K93754473	BRD-K93754473-001-02-9	Biomol International Inc.	S-650	2840(V2)-3-N1305		CC\C(c1ccccc1)=C(/c1ccccc1)c1ccc(OCCN(C)C)cc1	InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-	NKANXQFJJICGDU-QPLCGJKRSA-N	371.224914558							41774, 41774, 41774
Theophylline	LSM-6010	Aminophylline	2153	InChI=1S/C7H8N4O2/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h3H,1-2H3,(H,8,9)	ZFXYFBGIUFBOJW-UHFFFAOYSA-N	CN1C(=O)N(C)c2[nH]cnc2C1=O	BroadT	BRD-K97799481	BRD-K97799481-002-03-6	Prestwick Chemical Inc.	Prestw-873	D0701-MP04-ST03-200-	O	Cn1c2nc[nH]c2c(=O)n(C)c1=O.O	InChI=1S/C7H8N4O2.H2O/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;/h3H,1-2H3,(H,8,9);1H2	INQSMEFCAIHTJG-UHFFFAOYSA-N	180.064725536							28177, 28177, 28177, 28177, 28177, 28177
DMP-543	LSM-3999	SID26753284	9887884	InChI=1S/C26H18F2N2O/c27-23-13-17(9-11-29-23)15-26(16-18-10-12-30-24(28)14-18)21-7-3-1-5-19(21)25(31)20-6-2-4-8-22(20)26/h1-14H,15-16H2	MUJBUUDUXGDXLW-UHFFFAOYSA-N	Fc1cc(CC2(Cc3ccnc(F)c3)c4ccccc4C(=O)c5ccccc25)ccn1	BroadT	BRD-K89274813	BRD-K89274813-001-01-5	Tocris Bioscience	2330	1		Fc1cc(CC2(Cc3ccnc(F)c3)c3ccccc3C(=O)c3ccccc23)ccn1	InChI=1S/C26H18F2N2O/c27-23-13-17(9-11-29-23)15-26(16-18-10-12-30-24(28)14-18)21-7-3-1-5-19(21)25(31)20-6-2-4-8-22(20)26/h1-14H,15-16H2	MUJBUUDUXGDXLW-UHFFFAOYSA-N	412.138719616							93560
O,O'-Dimethylcaffeic acid	LSM-44076	O,O'-Dimethylcaffeic Acid	717531	InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+	HJBWJAPEBGSQPR-GQCTYLIASA-N	COc1ccc(\C=C\C(=O)O)cc1OC	BroadT	BRD-K96256403	BRD-K96256403-001-02-7	MicroSource Discovery Systems Inc.	210567			COc1ccc(\C=C\C(O)=O)cc1OC	InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+	HJBWJAPEBGSQPR-GQCTYLIASA-N	208.073558864							86549
14-Methoxy-4,4-bisnor-4,8,11,13-podocarpatetraen-3-one	LSM-24936	SID26749459	6708585	InChI=1S/C16H18O2/c1-16-9-8-12(17)10-11(16)6-7-13-14(16)4-3-5-15(13)18-2/h3-5,10H,6-9H2,1-2H3/t16-/m0/s1	VSZUGNOVOOTAQU-INIZCTEOSA-N	COc1cccc2c1CCC3=CC(=O)CC[C@]23C	BroadT	BRD-K97194310	BRD-K97194310-001-02-1	MicroSource Discovery Systems Inc.	100648			COc1cccc2c1CCC1=CC(=O)CC[C@]21C	InChI=1S/C16H18O2/c1-16-9-8-12(17)10-11(16)6-7-13-14(16)4-3-5-15(13)18-2/h3-5,10H,6-9H2,1-2H3/t16-/m0/s1	VSZUGNOVOOTAQU-INIZCTEOSA-N	242.130679816							
LY255283	LSM-4075	LY-255283	122023	InChI=1S/C19H28N4O3/c1-5-14-11-15(13(2)24)16(25)12-17(14)26-10-8-6-7-9-19(3,4)18-20-22-23-21-18/h11-12,25H,5-10H2,1-4H3,(H,20,21,22,23)	WCGXJPFHTHQNJL-UHFFFAOYSA-N	CCc1cc(C(=O)C)c(O)cc1OCCCCCC(C)(C)c2nnn[nH]2	BroadT	BRD-K92492521	BRD-K92492521-001-01-1	Tocris Bioscience	2208	1		CCc1cc(C(C)=O)c(O)cc1OCCCCCC(C)(C)c1nnn[nH]1	InChI=1S/C19H28N4O3/c1-5-14-11-15(13(2)24)16(25)12-17(14)26-10-8-6-7-9-19(3,4)18-20-22-23-21-18/h11-12,25H,5-10H2,1-4H3,(H,20,21,22,23)	WCGXJPFHTHQNJL-UHFFFAOYSA-N	360.216140796							93616, 93616
Orthothymotinic acid	LSM-4155	2-Hydroxy-3-Isopropyl-6-Methylbenzoic Acid, SID93576674, Orthothymotinic-Acid	11052	InChI=1S/C11H14O3/c1-6(2)8-5-4-7(3)9(10(8)12)11(13)14/h4-6,12H,1-3H3,(H,13,14)	FNWNGQGTFICQJU-UHFFFAOYSA-N	CC(C)c1ccc(C)c(C(=O)O)c1O	BroadT	BRD-K95788524	BRD-K95788524-001-02-4	MicroSource Discovery Systems Inc.	231017			CC(C)c1ccc(C)c(C(O)=O)c1O	InChI=1S/C11H14O3/c1-6(2)8-5-4-7(3)9(10(8)12)11(13)14/h4-6,12H,1-3H3,(H,13,14)	FNWNGQGTFICQJU-UHFFFAOYSA-N	194.094294308							93677
Paeonol	LSM-24937	Paeonol	11092	InChI=1S/C9H10O3/c1-6(10)8-4-3-7(12-2)5-9(8)11/h3-5,11H,1-2H3	UILPJVPSNHJFIK-UHFFFAOYSA-N	COc1ccc(C(=O)C)c(O)c1	BroadT	BRD-K94239562	BRD-K94239562-001-02-2	MicroSource Discovery Systems Inc.	1601021			COc1ccc(C(C)=O)c(O)c1	InChI=1S/C9H10O3/c1-6(10)8-4-3-7(12-2)5-9(8)11/h3-5,11H,1-2H3	UILPJVPSNHJFIK-UHFFFAOYSA-N	166.06299418							69581
NCGC00025158-01	LSM-15526	SID11114079, BRD-K83192048	6604866	InChI=1S/C20H24N2/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20/h4-10,12,15H,11,13-14H2,1-3H3/t15-/m1/s1	MVMQESMQSYOVGV-OAHLLOKOSA-N	C[C@@H](C1=C(CCN(C)C)Cc2ccccc12)c3ccccn3	BroadT	BRD-K83192048	BRD-K83192048-050-01-9	Tocris Bioscience	1425	1	OC(=O)/C=C\C(=O)O	C[C@@H](C1=C(CCN(C)C)Cc2ccccc12)c1ccccn1.OC(=O)/C=C\C(=O)O	InChI=1S/C20H24N2.C4H4O4/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20;5-3(6)1-2-4(7)8/h4-10,12,15H,11,13-14H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t15-;/m1./s1	SWECWXGUJQLXJF-HFNHQGOYSA-N	292.193948788							104162, 104162
Tinidazole	LSM-5948	Trimonase, Tinidazole, Tindamax, Symplotan, Fasigyn, CP-12574	5479	InChI=1S/C8H13N3O4S/c1-3-16(14,15)5-4-10-7(2)9-6-8(10)11(12)13/h6H,3-5H2,1-2H3	HJLSLZFTEKNLFI-UHFFFAOYSA-N	CCS(=O)(=O)CCn1c(C)ncc1[N+](=O)[O-]	BroadT	BRD-K89125793	BRD-K89125793-001-05-4	Prestwick Chemical Inc.	Prestw-766	D0701-MP04-ST03-200-		CCS(=O)(=O)CCn1c(C)ncc1[N+]([O-])=O	InChI=1S/C8H13N3O4S/c1-3-16(14,15)5-4-10-7(2)9-6-8(10)11(12)13/h6H,3-5H2,1-2H3	HJLSLZFTEKNLFI-UHFFFAOYSA-N	247.062676616							63627
Lobaric acid	LSM-3982	Lobaric-Acid, Lobaric Acid	73157	InChI=1S/C25H28O8/c1-4-6-8-9-15-21(24(28)29)18(27)13-20-23(15)32-19-12-14(31-3)11-16(17(26)10-7-5-2)22(19)25(30)33-20/h11-13,27H,4-10H2,1-3H3,(H,28,29)	JHEWMLHQNRHTQX-UHFFFAOYSA-N	CCCCCc1c2Oc3cc(OC)cc(C(=O)CCCC)c3C(=O)Oc2cc(O)c1C(=O)O	BroadT	BRD-K88849294	BRD-K88849294-001-02-1	MicroSource Discovery Systems Inc.	300018			CCCCCc1c2Oc3cc(OC)cc(C(=O)CCCC)c3C(=O)Oc2cc(O)c1C(O)=O	InChI=1S/C25H28O8/c1-4-6-8-9-15-21(24(28)29)18(27)13-20-23(15)32-19-12-14(31-3)11-16(17(26)10-7-5-2)22(19)25(30)33-20/h11-13,27H,4-10H2,1-3H3,(H,28,29)	JHEWMLHQNRHTQX-UHFFFAOYSA-N	456.178417856							93548
Sulfamerazine	LSM-5979	Sumedin, Sulfamethyldiazine, Sulfamerazine, Methypyrimal, Mesulfa, Sulfamerazine (Trisulfapyrimidines)	5325	InChI=1S/C11H12N4O2S/c1-8-6-7-13-11(14-8)15-18(16,17)10-4-2-9(12)3-5-10/h2-7H,12H2,1H3,(H,13,14,15)	QPPBRPIAZZHUNT-UHFFFAOYSA-N	Cc1ccnc(NS(=O)(=O)c2ccc(N)cc2)n1	BroadT	BRD-K93524252	BRD-K93524252-001-04-9	MicroSource Discovery Systems Inc.	1500547			Cc1ccnc(NS(=O)(=O)c2ccc(N)cc2)n1	InChI=1S/C11H12N4O2S/c1-8-6-7-13-11(14-8)15-18(16,17)10-4-2-9(12)3-5-10/h2-7H,12H2,1H3,(H,13,14,15)	QPPBRPIAZZHUNT-UHFFFAOYSA-N	264.068096354							102130, 102130
Citropten	LSM-24938	5,7-Dimethoxycoumarin	2775	InChI=1S/C11H10O4/c1-13-7-5-9(14-2)8-3-4-11(12)15-10(8)6-7/h3-6H,1-2H3	NXJCRELRQHZBQA-UHFFFAOYSA-N	COc1cc(OC)c2C=CC(=O)Oc2c1	BroadT	BRD-K78612426	BRD-K78612426-001-02-6	MicroSource Discovery Systems Inc.	1500707			COc1cc(OC)c2ccc(=O)oc2c1	InChI=1S/C11H10O4/c1-13-7-5-9(14-2)8-3-4-11(12)15-10(8)6-7/h3-6H,1-2H3	NXJCRELRQHZBQA-UHFFFAOYSA-N	206.0579088							113528
Cyclacillin	LSM-3987	Vasticillin, Cyclapen, Cyclacillin, Ciclacillin, WY-4508, Cyclapen-W	19003	InChI=1S/C15H23N3O4S/c1-14(2)9(12(20)21)18-10(19)8(11(18)23-14)17-13(22)15(16)6-4-3-5-7-15/h8-9,11H,3-7,16H2,1-2H3,(H,17,22)(H,20,21)/t8-,9+,11-/m1/s1	HGBLNBBNRORJKI-WCABBAIRSA-N	CC1(C)S[C@@H]2[C@H](NC(=O)C3(N)CCCCC3)C(=O)N2[C@H]1C(=O)O	BroadT	BRD-K89046952	BRD-K89046952-001-03-4	Prestwick Chemical Inc.	Prestw-1120	D0701-MP04-ST03-200-		CC1(C)S[C@@H]2[C@H](NC(=O)C3(N)CCCCC3)C(=O)N2[C@H]1C(O)=O	InChI=1S/C15H23N3O4S/c1-14(2)9(12(20)21)18-10(19)8(11(18)23-14)17-13(22)15(16)6-4-3-5-7-15/h8-9,11H,3-7,16H2,1-2H3,(H,17,22)(H,20,21)/t8-,9+,11-/m1/s1	HGBLNBBNRORJKI-WCABBAIRSA-N	341.140926936							31444
EMD-41000	LSM-3998		135179	InChI=1S/C14H13N3OS/c1-18-13-7-9(19-2)3-4-10(13)14-16-11-5-6-15-8-12(11)17-14/h3-8H,1-2H3,(H,16,17)	DNCRQPWXCICAHX-UHFFFAOYSA-N	COc1cc(SC)ccc1c2nc3ccncc3[nH]2	BroadT	BRD-K89271983	BRD-K89271983-001-01-5	Calbiochem	324663			COc1cc(SC)ccc1-c1nc2ccncc2[nH]1	InChI=1S/C14H13N3OS/c1-18-13-7-9(19-2)3-4-10(13)14-16-11-5-6-15-8-12(11)17-14/h3-8H,1-2H3,(H,16,17)	DNCRQPWXCICAHX-UHFFFAOYSA-N	271.077932756							93559
Dehydroepiandrosterone Acetate	LSM-4181	Dehydroisoandosterone, Dehydroepiandrosterone Acetate	14709	InChI=1S/C21H30O3/c1-13(22)24-15-8-10-20(2)14(12-15)4-5-16-17-6-7-19(23)21(17,3)11-9-18(16)20/h4,15-18H,5-12H2,1-3H3/t15-,16-,17-,18-,20-,21-/m0/s1	NCMZQTLCXHGLOK-ZKHIMWLXSA-N	CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C2C1	BroadT	BRD-K96527333	BRD-K96527333-001-03-4	Prestwick Chemical Inc.	Prestw-937	D0701-MP04-ST03-200-		CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C2C1	InChI=1S/C21H30O3/c1-13(22)24-15-8-10-20(2)14(12-15)4-5-16-17-6-7-19(23)21(17,3)11-9-18(16)20/h4,15-18H,5-12H2,1-3H3/t15-,16-,17-,18-,20-,21-/m0/s1	NCMZQTLCXHGLOK-ZKHIMWLXSA-N	330.21949482							
RO-154513	LSM-3861	RO-15-4513, RO-154513	5081	InChI=1S/C15H14N6O3/c1-3-24-15(23)13-12-7-20(2)14(22)10-6-9(18-19-16)4-5-11(10)21(12)8-17-13/h4-6,8H,3,7H2,1-2H3	CFSOJZTUTOQNIA-UHFFFAOYSA-N	CCOC(=O)c1ncn2c1CN(C)C(=O)c3cc(ccc23)N=[N+]=[N-]	BroadT	BRD-K82823076	BRD-K82823076-001-01-8	Tocris Bioscience	1997	2		CCOC(=O)c1ncn-2c1CN(C)C(=O)c1cc(ccc-21)N=[N+]=[N-]	InChI=1S/C15H14N6O3/c1-3-24-15(23)13-12-7-20(2)14(22)10-6-9(18-19-16)4-5-11(10)21(12)8-17-13/h4-6,8H,3,7H2,1-2H3	CFSOJZTUTOQNIA-UHFFFAOYSA-N	326.112738368							93452
Tetrabromobenzotriazole	LSM-4192	4,5,6,7-Tetrabromobenzotriazole, Tbb, CK2 Inhibitor (CASEIN Kinase II Inhibitor)	1694	InChI=1S/C6HBr4N3/c7-1-2(8)4(10)6-5(3(1)9)11-13-12-6/h(H,11,12,13)	OMZYUVOATZSGJY-UHFFFAOYSA-N	Brc1c(Br)c(Br)c2[nH]nnc2c1Br	BroadT	BRD-K97118047	BRD-K97118047-001-01-2	Calbiochem	218697			Brc1c(Br)c(Br)c2[nH]nnc2c1Br	InChI=1S/C6HBr4N3/c7-1-2(8)4(10)6-5(3(1)9)11-13-12-6/h(H,11,12,13)	OMZYUVOATZSGJY-UHFFFAOYSA-N	430.690397462							
Gliquidone	LSM-3809	Gliquidone, Ardf-26	91610	InChI=1S/C27H33N3O6S/c1-27(2)23-14-11-20(36-3)17-22(23)24(31)30(25(27)32)16-15-18-9-12-21(13-10-18)37(34,35)29-26(33)28-19-7-5-4-6-8-19/h9-14,17,19H,4-8,15-16H2,1-3H3,(H2,28,29,33)	LLJFMFZYVVLQKT-UHFFFAOYSA-N	COc1ccc2c(c1)C(=O)N(CCc3ccc(cc3)S(=O)(=O)NC(=O)NC4CCCCC4)C(=O)C2(C)C	BroadT	BRD-K80396088	BRD-K80396088-001-03-9	Prestwick Chemical Inc.	Prestw-991	D0701-MP04-ST03-200-		COc1ccc2c(c1)C(=O)N(CCc1ccc(cc1)S(=O)(=O)NC(=O)NC1CCCCC1)C(=O)C2(C)C	InChI=1S/C27H33N3O6S/c1-27(2)23-14-11-20(36-3)17-22(23)24(31)30(25(27)32)16-15-18-9-12-21(13-10-18)37(34,35)29-26(33)28-19-7-5-4-6-8-19/h9-14,17,19H,4-8,15-16H2,1-3H3,(H2,28,29,33)	LLJFMFZYVVLQKT-UHFFFAOYSA-N	527.209006496							93416
Tfmpp	LSM-24939	SID26756537	4296	InChI=1S/C11H13F3N2/c12-11(13,14)9-2-1-3-10(8-9)16-6-4-15-5-7-16/h1-3,8,15H,4-7H2	KKIMDKMETPPURN-UHFFFAOYSA-N	FC(F)(F)c1cccc(c1)N2CCNCC2	BroadT	BRD-K94887716	BRD-K94887716-001-01-5	Biomol International Inc.	AC-535	2813-N1283		FC(F)(F)c1cccc(c1)N1CCNCC1	InChI=1S/C11H13F3N2/c12-11(13,14)9-2-1-3-10(8-9)16-6-4-15-5-7-16/h1-3,8,15H,4-7H2	KKIMDKMETPPURN-UHFFFAOYSA-N	230.103083036							83536, 83536, 83536
Trimetazidine	LSM-5938	40045, Trimetazidine, Trimetazidine HCl	21109	InChI=1S/C14H22N2O3/c1-17-12-5-4-11(13(18-2)14(12)19-3)10-16-8-6-15-7-9-16/h4-5,15H,6-10H2,1-3H3	UHWVSEOVJBQKBE-UHFFFAOYSA-N	COc1ccc(CN2CCNCC2)c(OC)c1OC	BroadT	BRD-K88366685	BRD-K88366685-300-03-7	Prestwick Chemical Inc.	Prestw-549	D0701-MP04-ST03-200-	Cl.Cl	COc1ccc(CN2CCNCC2)c(OC)c1OC.Cl.Cl	InChI=1S/C14H22N2O3.2ClH/c1-17-12-5-4-11(13(18-2)14(12)19-3)10-16-8-6-15-7-9-16;;/h4-5,15H,6-10H2,1-3H3;2*1H	VYFLPFGUVGMBEP-UHFFFAOYSA-N	266.163042584							94789, 94789, 94789
Sinomenine	LSM-24940	Sinomenine	5459308	InChI=1S/C19H23NO4/c1-20-7-6-19-10-14(21)16(24-3)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,9,12-13,22H,6-8,10H2,1-3H3/t12-,13+,19-/m1/s1	INYYVPJSBIVGPH-QHRIQVFBSA-N	COC1=C[C@@H]2[C@@H]3Cc4ccc(OC)c(O)c4[C@]2(CCN3C)CC1=O	BroadT	BRD-K83459933	BRD-K83459933-001-02-1	MicroSource Discovery Systems Inc.	1505253			COC1=C[C@@H]2[C@@H]3Cc4ccc(OC)c(O)c4[C@]2(CCN3C)CC1=O	InChI=1S/C19H23NO4/c1-20-7-6-19-10-14(21)16(24-3)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,9,12-13,22H,6-8,10H2,1-3H3/t12-,13+,19-/m1/s1	INYYVPJSBIVGPH-QHRIQVFBSA-N	329.162708226							9163, 9163
Desacetoxymatricarin	LSM-4167	Leucodin, Desacetoxymatricarin, Leucomisine	167683	InChI=1S/C15H18O3/c1-7-4-5-10-9(3)15(17)18-14(10)13-8(2)6-11(16)12(7)13/h6,9-10,13-14H,4-5H2,1-3H3/t9-,10-,13-,14-/m0/s1	BJPSSVHNEGMBDQ-NUZBWSBOSA-N	C[C@H]1[C@@H]2CCC(=C3[C@@H]([C@H]2OC1=O)C(=CC3=O)C)C	BroadT	BRD-K96119599	BRD-K96119599-001-04-7	MicroSource Discovery Systems Inc.	1504149			C[C@H]1[C@@H]2CCC(C)=C3[C@@H]([C@H]2OC1=O)C(C)=CC3=O	InChI=1S/C15H18O3/c1-7-4-5-10-9(3)15(17)18-14(10)13-8(2)6-11(16)12(7)13/h6,9-10,13-14H,4-5H2,1-3H3/t9-,10-,13-,14-/m0/s1	BJPSSVHNEGMBDQ-NUZBWSBOSA-N	246.125594436							4441
Leflunomide	LSM-3771	Sulol, Leflunomide, Arava, SU-101, HWA-486	3899	InChI=1S/C12H9F3N2O2/c1-7-10(6-16-19-7)11(18)17-9-4-2-8(3-5-9)12(13,14)15/h2-6H,1H3,(H,17,18)	VHOGYURTWQBHIL-UHFFFAOYSA-N	Cc1oncc1C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K78692225	BRD-K78692225-001-11-2	Tocris Bioscience	2228	1		Cc1oncc1C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C12H9F3N2O2/c1-7-10(6-16-19-7)11(18)17-9-4-2-8(3-5-9)12(13,14)15/h2-6H,1H3,(H,17,18)	VHOGYURTWQBHIL-UHFFFAOYSA-N	270.061612148							6402
Repaglinide	LSM-3863	Repaglinide, Prandin, AGEE-623ZW, AG-EE 623 ZW, Repa-Glinide	65981	InChI=1S/C27H36N2O4/c1-4-33-25-17-20(12-13-22(25)27(31)32)18-26(30)28-23(16-19(2)3)21-10-6-7-11-24(21)29-14-8-5-9-15-29/h6-7,10-13,17,19,23H,4-5,8-9,14-16,18H2,1-3H3,(H,28,30)(H,31,32)/t23-/m0/s1	FAEKWTJYAYMJKF-QHCPKHFHSA-N	CCOc1cc(CC(=O)N[C@@H](CC(C)C)c2ccccc2N3CCCCC3)ccc1C(=O)O	BroadT	BRD-K82846253	BRD-K82846253-001-03-0	Prestwick Chemical Inc.	Prestw-1046	D0701-MP04-ST03-200-		CCOc1cc(CC(=O)N[C@@H](CC(C)C)c2ccccc2N2CCCCC2)ccc1C(O)=O	InChI=1S/C27H36N2O4/c1-4-33-25-17-20(12-13-22(25)27(31)32)18-26(30)28-23(16-19(2)3)21-10-6-7-11-24(21)29-14-8-5-9-15-29/h6-7,10-13,17,19,23H,4-5,8-9,14-16,18H2,1-3H3,(H,28,30)(H,31,32)/t23-/m0/s1	FAEKWTJYAYMJKF-QHCPKHFHSA-N	452.267507652							8805
S(-)-Pindolol	LSM-24941	BRD-K95598440, S(-)-Pindolol	688095	InChI=1S/C14H20N2O2/c1-10(2)16-8-11(17)9-18-14-5-3-4-13-12(14)6-7-15-13/h3-7,10-11,15-17H,8-9H2,1-2H3/t11-/m0/s1	JZQKKSLKJUAGIC-NSHDSACASA-N	CC(C)NC[C@H](O)COc1cccc2[nH]ccc12	BroadT	BRD-K95598440	BRD-K95598440-001-03-6	Tocris Bioscience	1060	2		CC(C)NC[C@H](O)COc1cccc2[nH]ccc12	InChI=1S/C14H20N2O2/c1-10(2)16-8-11(17)9-18-14-5-3-4-13-12(14)6-7-15-13/h3-7,10-11,15-17H,8-9H2,1-2H3/t11-/m0/s1	JZQKKSLKJUAGIC-NSHDSACASA-N	248.1524779							48281
CHEMBL1788383	LSM-3875	SID26751715, SID11113494, L-693403	4687238	InChI=1S/C20H23N/c1-2-6-17(7-3-1)16-21-14-12-20(13-15-21)11-10-18-8-4-5-9-19(18)20/h1-9H,10-16H2	GSXJSGMDWKPVBY-UHFFFAOYSA-N	C(N1CCC2(CC1)CCc3ccccc23)c4ccccc4	BroadT	BRD-K83322645	BRD-K83322645-103-01-6	Tocris Bioscience	426	1	OC(=O)C=CC(=O)O	C(N1CCC2(CCc3ccccc23)CC1)c1ccccc1.OC(=O)C=CC(=O)O	InChI=1S/C20H23N.C4H4O4/c1-2-6-17(7-3-1)16-21-14-12-20(13-15-21)11-10-18-8-4-5-9-19(18)20;5-3(6)1-2-4(7)8/h1-9H,10-16H2;1-2H,(H,5,6)(H,7,8)	WAZQVIBRRAMDNX-UHFFFAOYSA-N	277.183049746							93462, 93462
N-Ethylmaleimide	LSM-4219	BRD-K98297262	4362	InChI=1S/C6H7NO2/c1-2-7-5(8)3-4-6(7)9/h3-4H,2H2,1H3	HDFGOPSGAURCEO-UHFFFAOYSA-N	CCN1C(=O)C=CC1=O	BroadT	BRD-K98297262	BRD-K98297262-001-01-1	Calbiochem	34115			CCN1C(=O)C=CC1=O	InChI=1S/C6H7NO2/c1-2-7-5(8)3-4-6(7)9/h3-4H,2H2,1H3	HDFGOPSGAURCEO-UHFFFAOYSA-N	125.047678474							44485
Cotinine	LSM-5986	Cotinine	854019	InChI=1S/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1	UIKROCXWUNQSPJ-VIFPVBQESA-N	CN1[C@@H](CCC1=O)c2cccnc2	BroadT	BRD-K94144010	BRD-K94144010-001-05-5	Prestwick Chemical Inc.	Prestw-82	D0701-MP04-ST03-200-		CN1[C@@H](CCC1=O)c1cccnc1	InChI=1S/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1	UIKROCXWUNQSPJ-VIFPVBQESA-N	176.094963024							68641, 68641
Dibenzepin	LSM-3783	Dibenzepin	9419	InChI=1S/C18H21N3O/c1-19(2)12-13-21-17-11-7-6-10-16(17)20(3)15-9-5-4-8-14(15)18(21)22/h4-11H,12-13H2,1-3H3	QPGGEKPRGVJKQB-UHFFFAOYSA-N	CN(C)CCN1C(=O)c2ccccc2N(C)c3ccccc13	BroadT	BRD-K79145749	BRD-K79145749-001-01-8	Biomol International Inc.	NS-107	2813-N1283		CN(C)CCN1c2ccccc2N(C)c2ccccc2C1=O	InChI=1S/C18H21N3O/c1-19(2)12-13-21-17-11-7-6-10-16(17)20(3)15-9-5-4-8-14(15)18(21)22/h4-11H,12-13H2,1-3H3	QPGGEKPRGVJKQB-UHFFFAOYSA-N	295.168462322							93394, 93394
Testosterone Propionate	LSM-4025	Testosterone, Testosterone Propionate	5995	InChI=1S/C22H32O3/c1-4-20(24)25-19-8-7-17-16-6-5-14-13-15(23)9-11-21(14,2)18(16)10-12-22(17,19)3/h13,16-19H,4-12H2,1-3H3/t16-,17-,18-,19-,21-,22-/m0/s1	PDMMFKSKQVNJMI-BLQWBTBKSA-N	CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C	BroadT	BRD-K90553655	BRD-K90553655-001-03-6	Prestwick Chemical Inc.	Prestw-401	D0701-MP04-ST03-200-		CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C	InChI=1S/C22H32O3/c1-4-20(24)25-19-8-7-17-16-6-5-14-13-15(23)9-11-21(14,2)18(16)10-12-22(17,19)3/h13,16-19H,4-12H2,1-3H3/t16-,17-,18-,19-,21-,22-/m0/s1	PDMMFKSKQVNJMI-BLQWBTBKSA-N	344.235144884							9466
Propofol	LSM-3847	Rapinovet, Propofol, Disoprofol, Disoprivan, Diprivan, ICI-35868	4943	InChI=1S/C12H18O/c1-8(2)10-6-5-7-11(9(3)4)12(10)13/h5-9,13H,1-4H3	OLBCVFGFOZPWHH-UHFFFAOYSA-N	CC(C)c1cccc(C(C)C)c1O	BroadT	BRD-K82255054	BRD-K82255054-001-04-3	Prestwick Chemical Inc.	Prestw-931	D0701-MP04-ST03-200-		CC(C)c1cccc(C(C)C)c1O	InChI=1S/C12H18O/c1-8(2)10-6-5-7-11(9(3)4)12(10)13/h5-9,13H,1-4H3	OLBCVFGFOZPWHH-UHFFFAOYSA-N	178.135765196							44915, 44915, 44915
Leoidin	LSM-24942	SID26749474, SID50107598	3503223	InChI=1S/C18H14Cl2O7/c1-5-9-16(11(20)13(22)10(5)19)26-14-6(2)8(17(23)25-4)12(21)7(3)15(14)27-18(9)24/h21-22H,1-4H3	RCLFRVZNHRFQGE-UHFFFAOYSA-N	COC(=O)c1c(C)c2Oc3c(Cl)c(O)c(Cl)c(C)c3C(=O)Oc2c(C)c1O	BroadT	BRD-K96660256	BRD-K96660256-001-02-8	MicroSource Discovery Systems Inc.	200033			COC(=O)c1c(C)c2Oc3c(Cl)c(O)c(Cl)c(C)c3C(=O)Oc2c(C)c1O	InChI=1S/C18H14Cl2O7/c1-5-9-16(11(20)13(22)10(5)19)26-14-6(2)8(17(23)25-4)12(21)7(3)15(14)27-18(9)24/h21-22H,1-4H3	RCLFRVZNHRFQGE-UHFFFAOYSA-N	412.011658208							113529
Duartin, Dimethyl Ether	LSM-24943		6708574	InChI=1S/C20H24O6/c1-21-15-8-6-12-10-13(11-26-17(12)19(15)24-4)14-7-9-16(22-2)20(25-5)18(14)23-3/h6-9,13H,10-11H2,1-5H3/t13-/m0/s1	AXXBADPZGFAAHF-ZDUSSCGKSA-N	COc1ccc([C@@H]2COc3c(C2)ccc(OC)c3OC)c(OC)c1OC	BroadT	BRD-K87798455	BRD-K87798455-001-02-6	MicroSource Discovery Systems Inc.	201364			COc1ccc([C@@H]2COc3c(C2)ccc(OC)c3OC)c(OC)c1OC	InChI=1S/C20H24O6/c1-21-15-8-6-12-10-13(11-26-17(12)19(15)24-4)14-7-9-16(22-2)20(25-5)18(14)23-3/h6-9,13H,10-11H2,1-5H3/t13-/m0/s1	AXXBADPZGFAAHF-ZDUSSCGKSA-N	360.157288488							113530
Eicosadienoic acid	LSM-43028	Cis-11,14-Eicosadienoicacid, Eicosadienoic-Acid	6439848	InChI=1S/C20H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10H,2-5,8,11-19H2,1H3,(H,21,22)/b7-6-,10-9-	XSXIVVZCUAHUJO-HZJYTTRNSA-N	CCCCC\C=C/C\C=C/CCCCCCCCCC(=O)O	BroadT	BRD-K80325895	BRD-K80325895-001-02-3	Biomol International Inc.	FA007	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/CCCCCCCCCC(O)=O	InChI=1S/C20H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10H,2-5,8,11-19H2,1H3,(H,21,22)/b7-6-,10-9-	XSXIVVZCUAHUJO-HZJYTTRNSA-N	308.271530392							73731
Thiamphenicol	LSM-5858	Thiophenicol, Thiocymetin, Thiamphenicol, Dextrosulphenidol, WIN-50632, Thiamphenicol Aminoacetate HCl	27200	InChI=1S/C12H15Cl2NO5S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-16)15-12(18)11(13)14/h2-5,9-11,16-17H,6H2,1H3,(H,15,18)/t9-,10-/m1/s1	OTVAEFIXJLOWRX-NXEZZACHSA-N	CS(=O)(=O)c1ccc(cc1)[C@@H](O)[C@@H](CO)NC(=O)C(Cl)Cl	BroadT	BRD-K79711234	BRD-K79711234-001-04-3	MicroSource Discovery Systems Inc.	1503136			CS(=O)(=O)c1ccc(cc1)[C@@H](O)[C@@H](CO)NC(=O)C(Cl)Cl	InChI=1S/C12H15Cl2NO5S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-16)15-12(18)11(13)14/h2-5,9-11,16-17H,6H2,1H3,(H,15,18)/t9-,10-/m1/s1	OTVAEFIXJLOWRX-NXEZZACHSA-N	355.0047987							32215
7-Chlorokynurenic acid	LSM-24944	7-Chlorokynurenic Acid	1884	InChI=1S/C10H6ClNO3/c11-5-1-2-6-7(3-5)12-8(10(14)15)4-9(6)13/h1-4H,(H,12,13)(H,14,15)	UAWVRVFHMOSAPU-UHFFFAOYSA-N	OC(=O)c1cc(O)c2ccc(Cl)cc2n1	BroadT	BRD-K84214706	BRD-K84214706-001-02-4	MicroSource Discovery Systems Inc.	1502059			OC(=O)c1cc(O)c2ccc(Cl)cc2n1	InChI=1S/C10H6ClNO3/c11-5-1-2-6-7(3-5)12-8(10(14)15)4-9(6)13/h1-4H,(H,12,13)(H,14,15)	UAWVRVFHMOSAPU-UHFFFAOYSA-N	223.003620772							63965
4H-1-Benzopyran-4-one, 5,6,7-trimethoxy-3-(2-methoxyphenyl)-	LSM-4077	Irilin-A	6710754	InChI=1S/C19H18O6/c1-21-13-8-6-5-7-11(13)12-10-25-14-9-15(22-2)18(23-3)19(24-4)16(14)17(12)20/h5-10H,1-4H3	LMYDKXXEPYRDDD-UHFFFAOYSA-N	COc1cc2OC=C(C(=O)c2c(OC)c1OC)c3ccccc3OC	BroadT	BRD-K92678294	BRD-K92678294-001-01-0	MicroSource Discovery Systems Inc.	1401018			COc1ccccc1-c1coc2cc(OC)c(OC)c(OC)c2c1=O	InChI=1S/C19H18O6/c1-21-13-8-6-5-7-11(13)12-10-25-14-9-15(22-2)18(23-3)19(24-4)16(14)17(12)20/h5-10H,1-4H3	LMYDKXXEPYRDDD-UHFFFAOYSA-N	342.110338296							93618
MAZ51	LSM-43044	MAZ-51, SID29217583	9839842	InChI=1S/C21H18N2O/c1-23(2)20-12-11-14(15-7-3-4-9-17(15)20)13-18-16-8-5-6-10-19(16)22-21(18)24/h3-13H,1-2H3,(H,22,24)/b18-13-	VFCXONOPGCDDBQ-AQTBWJFISA-N	CN(C)c1ccc(\C=C\2/C(=O)Nc3ccccc23)c4ccccc14	BroadT	BRD-K95655893	BRD-K95655893-001-01-0	Calbiochem	676492			CN(C)c1ccc(\C=C2/C(=O)Nc3ccccc23)c2ccccc12	InChI=1S/C21H18N2O/c1-23(2)20-12-11-14(15-7-3-4-9-17(15)20)13-18-16-8-5-6-10-19(16)22-21(18)24/h3-13H,1-2H3,(H,22,24)/b18-13-	VFCXONOPGCDDBQ-AQTBWJFISA-N	314.141913216							
LY456236	LSM-3955	LY-456236, SID26755028	9926999	InChI=1S/C16H15N3O2/c1-20-12-5-3-11(4-6-12)19-16-14-9-13(21-2)7-8-15(14)17-10-18-16/h3-10H,1-2H3,(H,17,18,19)	XPJOMFBGKIABQW-UHFFFAOYSA-N	COc1ccc(Nc2ncnc3ccc(OC)cc23)cc1	BroadT	BRD-K87696786	BRD-K87696786-003-01-0	Tocris Bioscience	2390	1	Cl	COc1ccc(Nc2ncnc3ccc(OC)cc23)cc1.Cl	InChI=1S/C16H15N3O2.ClH/c1-20-12-5-3-11(4-6-12)19-16-14-9-13(21-2)7-8-15(14)17-10-18-16;/h3-10H,1-2H3,(H,17,18,19);1H	AVKFOWUSTVWZQN-UHFFFAOYSA-N	281.11642675							93528
IAA-94	LSM-3913	SID90341770, SID50106487, SID50106486	656717	InChI=1S/C17H18Cl2O4/c1-17(10-4-2-3-5-10)7-9-6-11(23-8-12(20)21)14(18)15(19)13(9)16(17)22/h6,10H,2-5,7-8H2,1H3,(H,20,21)/t17-/m0/s1	RNOJGTHBMJBOSP-KRWDZBQOSA-N	C[C@]1(Cc2cc(OCC(=O)O)c(Cl)c(Cl)c2C1=O)C3CCCC3	BroadT	BRD-K85383046	BRD-K85383046-001-02-5	Biomol International Inc.	CM-101	2840(V2)-3-N1305		C[C@]1(Cc2cc(OCC(O)=O)c(Cl)c(Cl)c2C1=O)C1CCCC1	InChI=1S/C17H18Cl2O4/c1-17(10-4-2-3-5-10)7-9-6-11(23-8-12(20)21)14(18)15(19)13(9)16(17)22/h6,10H,2-5,7-8H2,1H3,(H,20,21)/t17-/m0/s1	RNOJGTHBMJBOSP-KRWDZBQOSA-N	356.058214476							34794
SIB1757	LSM-4215	SIB-1757	6849066	InChI=1S/C12H11N3O/c1-9-7-8-11(16)12(13-9)15-14-10-5-3-2-4-6-10/h2-8,16H,1H3	LOCPVWIREQIGNQ-UHFFFAOYSA-N	Cc1ccc(O)c(N=Nc2ccccc2)n1	BroadT	BRD-K98157055	BRD-K98157055-001-04-2	Tocris Bioscience	1215	2		Cc1ccc(O)c(N=Nc2ccccc2)n1	InChI=1S/C12H11N3O/c1-9-7-8-11(16)12(13-9)15-14-10-5-3-2-4-6-10/h2-8,16H,1H3	LOCPVWIREQIGNQ-UHFFFAOYSA-N	213.090212002							
Benzamil	LSM-3945	Benzamil	108107	InChI=1S/C13H14ClN7O/c14-9-11(16)20-10(15)8(19-9)12(22)21-13(17)18-6-7-4-2-1-3-5-7/h1-5H,6H2,(H4,15,16,20)(H3,17,18,21,22)	KXDROGADUISDGY-UHFFFAOYSA-N	N\C(=N/C(=O)c1nc(Cl)c(N)nc1N)\NCc2ccccc2	BroadT	BRD-K97688263	BRD-K97688263-001-02-9	Biomol International Inc.	NA-103	2840(V2)-3-N1305		N\C(NCc1ccccc1)=N/C(=O)c1nc(Cl)c(N)nc1N	InChI=1S/C13H14ClN7O/c14-9-11(16)20-10(15)8(19-9)12(22)21-13(17)18-6-7-4-2-1-3-5-7/h1-5H,6H2,(H4,15,16,20)(H3,17,18,21,22)	KXDROGADUISDGY-UHFFFAOYSA-N	319.094835848							34558, 34558, 34558
Pargyline	LSM-3878	Pargyline, Eutron, Eutonyl	4688	InChI=1S/C11H13N/c1-3-9-12(2)10-11-7-5-4-6-8-11/h1,4-8H,9-10H2,2H3	DPWPWRLQFGFJFI-UHFFFAOYSA-N	CN(CC#C)Cc1ccccc1	BroadT	BRD-K83597974	BRD-K83597974-003-05-7	Prestwick Chemical Inc.	Prestw-183	D0701-MP04-ST03-200-	Cl	CN(CC#C)Cc1ccccc1.Cl	InChI=1S/C11H13N.ClH/c1-3-9-12(2)10-11-7-5-4-6-8-11;/h1,4-8H,9-10H2,2H3;1H	BCXCABRDBBWWGY-UHFFFAOYSA-N	159.104799426							7930, 7930
Spiramide	LSM-4124	Spiramide, Fluroxyspiramine, R-5808	68186	InChI=1S/C22H26FN3O2/c23-18-7-9-20(10-8-18)28-16-4-13-25-14-11-22(12-15-25)21(27)24-17-26(22)19-5-2-1-3-6-19/h1-3,5-10H,4,11-17H2,(H,24,27)	FJUKDAZEABGEIH-UHFFFAOYSA-N	Fc1ccc(OCCCN2CCC3(CC2)N(CNC3=O)c4ccccc4)cc1	BroadT	BRD-K94512704	BRD-K94512704-001-01-3	Biomol International Inc.	NS-104	2813-N1283		Fc1ccc(OCCCN2CCC3(CC2)N(CNC3=O)c2ccccc2)cc1	InChI=1S/C22H26FN3O2/c23-18-7-9-20(10-8-18)28-16-4-13-25-14-11-22(12-15-25)21(27)24-17-26(22)19-5-2-1-3-6-19/h1-3,5-10H,4,11-17H2,(H,24,27)	FJUKDAZEABGEIH-UHFFFAOYSA-N	383.200905302							64207
Triacetylresveratrol	LSM-44077	42206-94-0, Triacetylresveratrol, SID26749688	5962587	InChI=1S/C20H18O6/c1-13(21)24-18-8-6-16(7-9-18)4-5-17-10-19(25-14(2)22)12-20(11-17)26-15(3)23/h4-12H,1-3H3/b5-4+	PDAYUJSOJIMKIS-SNAWJCMRSA-N	CC(=O)Oc1ccc(\C=C\c2cc(OC(=O)C)cc(OC(=O)C)c2)cc1	BroadT	BRD-K80946661	BRD-K80946661-001-02-8	MicroSource Discovery Systems Inc.	1504041			CC(=O)Oc1ccc(cc1)\C=C\c1cc(OC(C)=O)cc(OC(C)=O)c1	InChI=1S/C20H18O6/c1-13(21)24-18-8-6-16(7-9-18)4-5-17-10-19(25-14(2)22)12-20(11-17)26-15(3)23/h4-12H,1-3H3/b5-4+	PDAYUJSOJIMKIS-SNAWJCMRSA-N	354.110338296							
SKF 86002	LSM-4189	SKF-86002, SK&F-86002, SK-86002	5228	InChI=1S/C16H12FN3S/c17-13-3-1-11(2-4-13)14-15(12-5-7-18-8-6-12)20-9-10-21-16(20)19-14/h1-8H,9-10H2	YOELZIQOLWZLQC-UHFFFAOYSA-N	Fc1ccc(cc1)c2nc3SCCn3c2c4ccncc4	BroadT	BRD-K96809896	BRD-K96809896-001-01-9	Calbiochem	567305			Fc1ccc(cc1)-c1nc2SCCn2c1-c1ccncc1	InChI=1S/C16H12FN3S/c17-13-3-1-11(2-4-13)14-15(12-5-7-18-8-6-12)20-9-10-21-16(20)19-14/h1-8H,9-10H2	YOELZIQOLWZLQC-UHFFFAOYSA-N	297.073596304							93705, 93705, 93705
SB239063	LSM-1036	SB-239063, SID103905255, SID11114250	5166	InChI=1S/C20H21FN4O2/c1-27-20-22-11-10-17(24-20)19-18(13-2-4-14(21)5-3-13)23-12-25(19)15-6-8-16(26)9-7-15/h2-5,10-12,15-16,26H,6-9H2,1H3	ZQUSFAUAYSEREK-UHFFFAOYSA-N	COc1nccc(n1)c2c(ncn2C3CCC(O)CC3)c4ccc(F)cc4	BroadT	BRD-K98143437	BRD-K98143437-001-01-7	Tocris Bioscience	1962	2		COc1nccc(n1)-c1c(ncn1C1CCC(O)CC1)-c1ccc(F)cc1	InChI=1S/C20H21FN4O2/c1-27-20-22-11-10-17(24-20)19-18(13-2-4-14(21)5-3-13)23-12-25(19)15-6-8-16(26)9-7-15/h2-5,10-12,15-16,26H,6-9H2,1H3	ZQUSFAUAYSEREK-UHFFFAOYSA-N	368.164854152							91347
Xaliproden	LSM-3966	Xaliproden, SR-57746	128919	InChI=1S/C24H22F3N/c25-24(26,27)23-7-3-6-22(17-23)20-11-14-28(15-12-20)13-10-18-8-9-19-4-1-2-5-21(19)16-18/h1-9,11,16-17H,10,12-15H2	WJJYZXPHLSLMGE-UHFFFAOYSA-N	FC(F)(F)c1cccc(c1)C2=CCN(CCc3ccc4ccccc4c3)CC2	BroadT	BRD-K88358234	BRD-K88358234-003-01-4	Tocris Bioscience	2491	1	Cl	FC(F)(F)c1cccc(c1)C1=CCN(CCc2ccc3ccccc3c2)CC1.Cl	InChI=1S/C24H22F3N.ClH/c25-24(26,27)23-7-3-6-22(17-23)20-11-14-28(15-12-20)13-10-18-8-9-19-4-1-2-5-21(19)16-18;/h1-9,11,16-17H,10,12-15H2;1H	WVHBEIJGAINUBW-UHFFFAOYSA-N	381.170434314							48520, 48520
Dexpropranolol	LSM-5972	Dexpropranolol, Propranolol	21138	InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3/t14-/m1/s1	AQHHHDLHHXJYJD-CQSZACIVSA-N	CC(C)NC[C@@H](O)COc1cccc2ccccc12	BroadT	BRD-K92830582	BRD-K92830582-003-04-8	Tocris Bioscience	835	1	Cl	CC(C)NC[C@@H](O)COc1cccc2ccccc12.Cl	InChI=1S/C16H21NO2.ClH/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16;/h3-9,12,14,17-18H,10-11H2,1-2H3;1H/t14-;/m1./s1	ZMRUPTIKESYGQW-PFEQFJNWSA-N	259.157228922							8736, 8736
IN1345	LSM-3976	Methyl-2,5-Dihydroxycinnamate	3248	InChI=1S/C10H10O4/c1-14-10(13)5-2-7-6-8(11)3-4-9(7)12/h2-6,11-12H,1H3	BQCNSTFWSKOWMA-UHFFFAOYSA-N	COC(=O)C=Cc1cc(O)ccc1O	BroadT	BRD-K88741031	BRD-K88741031-001-01-0	Tocris Bioscience	577	2		COC(=O)C=Cc1cc(O)ccc1O	InChI=1S/C10H10O4/c1-14-10(13)5-2-7-6-8(11)3-4-9(7)12/h2-6,11-12H,1H3	BQCNSTFWSKOWMA-UHFFFAOYSA-N	194.0579088							93543
Mefenamic acid	LSM-4085	Mefenamicacid, Ponstel, INF-3355, CN-35355, CI-473, Mefenamic Acid, Mefenamic-Acid	4044	InChI=1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)	HYYBABOKPJLUIN-UHFFFAOYSA-N	Cc1cccc(Nc2ccccc2C(=O)O)c1C	BroadT	BRD-K92778217	BRD-K92778217-001-04-6	MicroSource Discovery Systems Inc.	1501103			Cc1cccc(Nc2ccccc2C(O)=O)c1C	InChI=1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)	HYYBABOKPJLUIN-UHFFFAOYSA-N	241.11027873							6717
TCS-359	LSM-3826	SID50112926	1048845	InChI=1S/C18H20N2O4S/c1-23-12-8-7-10(9-13(12)24-2)17(22)20-18-15(16(19)21)11-5-3-4-6-14(11)25-18/h7-9H,3-6H2,1-2H3,(H2,19,21)(H,20,22)	FSPQCTGGIANIJZ-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)Nc2sc3CCCCc3c2C(=O)N	BroadT	BRD-K81376179	BRD-K81376179-001-01-4	Tocris Bioscience	2591	1		COc1ccc(cc1OC)C(=O)Nc1sc2CCCCc2c1C(N)=O	InChI=1S/C18H20N2O4S/c1-23-12-8-7-10(9-13(12)24-2)17(22)20-18-15(16(19)21)11-5-3-4-6-14(11)25-18/h7-9H,3-6H2,1-2H3,(H2,19,21)(H,20,22)	FSPQCTGGIANIJZ-UHFFFAOYSA-N	360.11437783							93427
Azacyclonol	LSM-4191	Psychosan, Frenquel, Frenoton, Calmeran, Azacyclonol, Ataractan, Gamma-Pipradol	15723	InChI=1S/C18H21NO/c20-18(15-7-3-1-4-8-15,16-9-5-2-6-10-16)17-11-13-19-14-12-17/h1-10,17,19-20H,11-14H2	ZMISODWVFHHWNR-UHFFFAOYSA-N	OC(C1CCNCC1)(c2ccccc2)c3ccccc3	BroadT	BRD-K97061094	BRD-K97061094-001-03-2	Prestwick Chemical Inc.	Prestw-93	D0701-MP04-ST03-200-		OC(C1CCNCC1)(c1ccccc1)c1ccccc1	InChI=1S/C18H21NO/c20-18(15-7-3-1-4-8-15,16-9-5-2-6-10-16)17-11-13-19-14-12-17/h1-10,17,19-20H,11-14H2	ZMISODWVFHHWNR-UHFFFAOYSA-N	267.162314302							93706, 93706
Ala-Ala-Phe-Cmk	LSM-4092	SID26756778	6610326	InChI=1S/C16H22ClN3O3/c1-10(18)15(22)19-11(2)16(23)20-13(14(21)9-17)8-12-6-4-3-5-7-12/h3-7,10-11,13H,8-9,18H2,1-2H3,(H,19,22)(H,20,23)/t10-,11-,13-/m0/s1	ONICONPPGVXITG-GVXVVHGQSA-N	C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)CCl	BroadT	BRD-K93080877	BRD-K93080877-001-02-1	Biomol International Inc.	PI-123	2840(V2)-3-N1305		C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)CCl	InChI=1S/C16H22ClN3O3/c1-10(18)15(22)19-11(2)16(23)20-13(14(21)9-17)8-12-6-4-3-5-7-12/h3-7,10-11,13H,8-9,18H2,1-2H3,(H,19,22)(H,20,23)/t10-,11-,13-/m0/s1	ONICONPPGVXITG-GVXVVHGQSA-N	339.134969304							93628
Sulfameter	LSM-6683	Ultrax, Sulphamethoxydiazine, Sulla, Sulfametoxydiazine, Sulfametin, Sulfameter, Bayrena, AHR-857	5326	InChI=1S/C11H12N4O3S/c1-18-9-6-13-11(14-7-9)15-19(16,17)10-4-2-8(12)3-5-10/h2-7H,12H2,1H3,(H,13,14,15)	GPTONYMQFTZPKC-UHFFFAOYSA-N	COc1cnc(NS(=O)(=O)c2ccc(N)cc2)nc1	BroadT	BRD-K87492696	BRD-K87492696-001-04-1	MicroSource Discovery Systems Inc.	1501155			COc1cnc(NS(=O)(=O)c2ccc(N)cc2)nc1	InChI=1S/C11H12N4O3S/c1-18-9-6-13-11(14-7-9)15-19(16,17)10-4-2-8(12)3-5-10/h2-7H,12H2,1H3,(H,13,14,15)	GPTONYMQFTZPKC-UHFFFAOYSA-N	280.063010974							53727
MFCD00671792	LSM-3890	BRD-K84421793	12668019	InChI=1S/C16H16ClNO2/c17-15-11-6-7-18-9-13(10-4-2-1-3-5-10)12(11)8-14(19)16(15)20/h1-5,8,13,18-20H,6-7,9H2/t13-/m1/s1	GHWJEDJMOVUXEC-CYBMUJFWSA-N	Oc1cc2[C@H](CNCCc2c(Cl)c1O)c3ccccc3	BroadT	BRD-K84421793	BRD-K84421793-001-01-1	Biomol International Inc.	AC-759	2812-3-N1298		Oc1cc2[C@H](CNCCc2c(Cl)c1O)c1ccccc1	InChI=1S/C16H16ClNO2/c17-15-11-6-7-18-9-13(10-4-2-1-3-5-10)12(11)8-14(19)16(15)20/h1-5,8,13,18-20H,6-7,9H2/t13-/m1/s1	GHWJEDJMOVUXEC-CYBMUJFWSA-N	289.086956472							93475, 93475
Ricinine	LSM-3851	SID11112391, SID124882315, SID24824271, SID26754175	10666	InChI=1S/C8H8N2O2/c1-10-4-3-7(12-2)6(5-9)8(10)11/h3-4H,1-2H3	PETSAYFQSGAEQY-UHFFFAOYSA-N	COC1=C(C#N)C(=O)N(C)C=C1	BroadT	BRD-K82561139	BRD-K82561139-001-01-9	TimTec LLC	ST024790			COc1ccn(C)c(=O)c1C#N	InChI=1S/C8H8N2O2/c1-10-4-3-7(12-2)6(5-9)8(10)11/h3-4H,1-2H3	PETSAYFQSGAEQY-UHFFFAOYSA-N	164.058577516							18043
Tolbutamide	LSM-3907	Tolbutamide, Orinase	5505	InChI=1S/C12H18N2O3S/c1-3-4-9-13-12(15)14-18(16,17)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3,(H2,13,14,15)	JLRGJRBPOGGCBT-UHFFFAOYSA-N	CCCCNC(=O)NS(=O)(=O)c1ccc(C)cc1	BroadT	BRD-K85119730	BRD-K85119730-001-06-5	Biomol International Inc.	AC-117	2840(V2)-3-N1305		CCCCNC(=O)NS(=O)(=O)c1ccc(C)cc1	InChI=1S/C12H18N2O3S/c1-3-4-9-13-12(15)14-18(16,17)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3,(H2,13,14,15)	JLRGJRBPOGGCBT-UHFFFAOYSA-N	270.103813146							27999, 27999
2,4,5-Trichlorophenoxyacetic acid	LSM-24946	SID26753700, SID26747737	1480	InChI=1S/C8H5Cl3O3/c9-4-1-6(11)7(2-5(4)10)14-3-8(12)13/h1-2H,3H2,(H,12,13)	SMYMJHWAQXWPDB-UHFFFAOYSA-N	OC(=O)COc1cc(Cl)c(Cl)cc1Cl	BroadT	BRD-K92860374	BRD-K92860374-001-02-5	MicroSource Discovery Systems Inc.	330042			OC(=O)COc1cc(Cl)c(Cl)cc1Cl	InChI=1S/C8H5Cl3O3/c9-4-1-6(11)7(2-5(4)10)14-3-8(12)13/h1-2H,3H2,(H,12,13)	SMYMJHWAQXWPDB-UHFFFAOYSA-N	253.93042715							27903, 27903
RS-16566	LSM-3814	RS-16566	6604794	InChI=1S/C18H23ClN4O/c1-11(2)23-10-20-17-14(7-13(19)8-16(17)23)18(24)21-15-9-22-5-3-12(15)4-6-22/h7-8,10-12,15H,3-6,9H2,1-2H3,(H,21,24)/t15-/m0/s1	OGXMGJGFLBSEJW-HNNXBMFYSA-N	CC(C)n1cnc2c(cc(Cl)cc12)C(=O)N[C@H]3CN4CCC3CC4	BroadT	BRD-K80725821	BRD-K80725821-300-01-1	Tocris Bioscience	1015	1	Cl.Cl	CC(C)n1cnc2c(cc(Cl)cc12)C(=O)N[C@H]1CN2CCC1CC2.Cl.Cl	InChI=1S/C18H23ClN4O.2ClH/c1-11(2)23-10-20-17-14(7-13(19)8-16(17)23)18(24)21-15-9-22-5-3-12(15)4-6-22;;/h7-8,10-12,15H,3-6,9H2,1-2H3,(H,21,24);2*1H/t15-;;/m0../s1	LPEOWDMQSXDYRJ-CKUXDGONSA-N	346.156039106							93420
Dihydroergocristine	LSM-4200	GNF-PF-3462	107715	InChI=1S/C35H41N5O5/c1-20(2)34(37-31(41)23-16-25-24-11-7-12-26-30(24)22(18-36-26)17-27(25)38(3)19-23)33(43)40-28(15-21-9-5-4-6-10-21)32(42)39-14-8-13-29(39)35(40,44)45-34/h4-7,9-12,18,20,23,25,27-29,36,44H,8,13-17,19H2,1-3H3,(H,37,41)/t23-,25-,27-,28+,29+,34-,35+/m1/s1	DEQITUUQPICUMR-HJPBWRTMSA-N	CC(C)[C@@]1(NC(=O)[C@@H]2C[C@H]3[C@@H](Cc4c[nH]c5cccc3c45)N(C)C2)O[C@@]6(O)[C@@H]7CCCN7C(=O)[C@H](Cc8ccccc8)N6C1=O	BroadT	BRD-K97440753	BRD-K97440753-066-03-3	Prestwick Chemical Inc.	Prestw-562	D0701-MP04-ST03-200-	CS(=O)(=O)O	CC(C)[C@@]1(NC(=O)[C@@H]2C[C@H]3[C@@H](Cc4c[nH]c5cccc3c45)N(C)C2)O[C@@]2(O)[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O.CS(=O)(=O)O	InChI=1S/C35H41N5O5.CH4O3S/c1-20(2)34(37-31(41)23-16-25-24-11-7-12-26-30(24)22(18-36-26)17-27(25)38(3)19-23)33(43)40-28(15-21-9-5-4-6-10-21)32(42)39-14-8-13-29(39)35(40,44)45-34;1-5(2,3)4/h4-7,9-12,18,20,23,25,27-29,36,44H,8,13-17,19H2,1-3H3,(H,37,41);1H3,(H,2,3,4)/t23-,25-,27-,28+,29+,34-,35+;/m1./s1	SPXACGZWWVIDGR-SPZWACKZSA-N	611.310769462							59912, 59912
Hydralazine	LSM-15370	Hydralazine	3637	InChI=1S/C8H8N4/c9-11-8-7-4-2-1-3-6(7)5-10-12-8/h1-5H,9H2,(H,11,12)	RPTUSVTUFVMDQK-UHFFFAOYSA-N	NNc1nncc2ccccc12	BroadT	BRD-K82103381	BRD-K82103381-003-03-7	MicroSource Discovery Systems Inc.	1500334		Cl	NNc1nncc2ccccc12.Cl	InChI=1S/C8H8N4.ClH/c9-11-8-7-4-2-1-3-6(7)5-10-12-8;/h1-5H,9H2,(H,11,12);1H	ZUXNZUWOTSUBMN-UHFFFAOYSA-N	160.074896296							5775, 5775
Thymoquinone	LSM-24947	Thymoquinone	10281	InChI=1S/C10H12O2/c1-6(2)8-5-9(11)7(3)4-10(8)12/h4-6H,1-3H3	KEQHJBNSCLWCAE-UHFFFAOYSA-N	CC(C)C1=CC(=O)C(=CC1=O)C	BroadT	BRD-K97566842	BRD-K97566842-001-02-7	MicroSource Discovery Systems Inc.	310299			CC(C)C1=CC(=O)C(C)=CC1=O	InChI=1S/C10H12O2/c1-6(2)8-5-9(11)7(3)4-10(8)12/h4-6H,1-3H3	KEQHJBNSCLWCAE-UHFFFAOYSA-N	164.083729624							113532
Chlorpromazine	LSM-4017	Thorazine, Sonazine, Megaphen, Largactil, Elmarin, Chlorpromazine, Chlorpromazine Tannate, Chlorpromazine Phenolphthalinate, Chlorpromazine Hibenzate	2726	InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3	ZPEIMTDSQAKGNT-UHFFFAOYSA-N	CN(C)CCCN1c2ccccc2Sc3ccc(Cl)cc13	BroadT	BRD-K89997465	BRD-K89997465-001-02-0	MicroSource Discovery Systems Inc.	1500184			CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc12	InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3	ZPEIMTDSQAKGNT-UHFFFAOYSA-N	318.095747028							3647, 3647
SCH-58261	LSM-3822	SCH-58261, SCH58261	176408	InChI=1S/C18H15N7O/c19-18-22-16-13(11-20-24(16)9-8-12-5-2-1-3-6-12)17-21-15(23-25(17)18)14-7-4-10-26-14/h1-7,10-11H,8-9H2,(H2,19,22)	UTLPKQYUXOEJIL-UHFFFAOYSA-N	Nc1nc2c(cnn2CCc3ccccc3)c4nc(nn14)c5occc5	BroadT	BRD-K81225797	BRD-K81225797-001-01-5	Tocris Bioscience	2270	2		Nc1nc2n(CCc3ccccc3)ncc2c2nc(nn12)-c1ccco1	InChI=1S/C18H15N7O/c19-18-22-16-13(11-20-24(16)9-8-12-5-2-1-3-6-12)17-21-15(23-25(17)18)14-7-4-10-26-14/h1-7,10-11H,8-9H2,(H2,19,22)	UTLPKQYUXOEJIL-UHFFFAOYSA-N	345.13380817							93424
8R-Lisuride	LSM-3984	Lisuride, SID26756522	11957615	InChI=1S/C20H26N4O/c1-4-24(5-2)20(25)22-14-10-16-15-7-6-8-17-19(15)13(11-21-17)9-18(16)23(3)12-14/h6-8,10-11,14,18,21H,4-5,9,12H2,1-3H3,(H,22,25)/t14-,18-/m1/s1	BKRGVLQUQGGVSM-RDTXWAMCSA-N	CCN(CC)C(=O)N[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34	BroadT	BRD-K88871508	BRD-K88871508-001-01-9	Biomol International Inc.	AC-754	2812-3-N1298		CCN(CC)C(=O)N[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34	InChI=1S/C20H26N4O/c1-4-24(5-2)20(25)22-14-10-16-15-7-6-8-17-19(15)13(11-21-17)9-18(16)23(3)12-14/h6-8,10-11,14,18,21H,4-5,9,12H2,1-3H3,(H,22,25)/t14-,18-/m1/s1	BKRGVLQUQGGVSM-RDTXWAMCSA-N	338.210661492							93550
Ramifenazone	LSM-5911	Ramifenazone	5037	InChI=1S/C14H19N3O/c1-10(2)15-13-11(3)16(4)17(14(13)18)12-8-6-5-7-9-12/h5-10,15H,1-4H3	XOZLRRYPUKAKMU-UHFFFAOYSA-N	CC(C)NC1=C(C)N(C)N(C1=O)c2ccccc2	BroadT	BRD-K85333151	BRD-K85333151-003-04-3	MicroSource Discovery Systems Inc.	1503822		Cl	CC(C)Nc1c(C)n(C)n(-c2ccccc2)c1=O.Cl	InChI=1S/C14H19N3O.ClH/c1-10(2)15-13-11(3)16(4)17(14(13)18)12-8-6-5-7-9-12;/h5-10,15H,1-4H3;1H	WJPVTNJDDFIBKU-UHFFFAOYSA-N	245.152812258							94776, 94776
SB258585	LSM-3812	SB-258585	3248571	InChI=1S/C18H22IN3O3S/c1-21-9-11-22(12-10-21)17-13-15(5-8-18(17)25-2)20-26(23,24)16-6-3-14(19)4-7-16/h3-8,13,20H,9-12H2,1-2H3	BDHMSYNBSBZCAF-UHFFFAOYSA-N	COc1ccc(NS(=O)(=O)c2ccc(I)cc2)cc1N3CCN(C)CC3	BroadT	BRD-K80639402	BRD-K80639402-003-01-1	Tocris Bioscience	1961	1	Cl	COc1ccc(NS(=O)(=O)c2ccc(I)cc2)cc1N1CCN(C)CC1.Cl	InChI=1S/C18H22IN3O3S.ClH/c1-21-9-11-22(12-10-21)17-13-15(5-8-18(17)25-2)20-26(23,24)16-6-3-14(19)4-7-16;/h3-8,13,20H,9-12H2,1-2H3;1H	BFGOZFXMAJBFGI-UHFFFAOYSA-N	487.042655284							93418
Mesulergine	LSM-4045	Mesulergine	68848	InChI=1S/C18H26N4O2S/c1-20(2)25(23,24)19-13-9-15-14-6-5-7-16-18(14)12(10-21(16)3)8-17(15)22(4)11-13/h5-7,10,13,15,17,19H,8-9,11H2,1-4H3/t13-,15+,17+/m0/s1	JLVHTNZNKOSCNB-YSVLISHTSA-N	CN(C)S(=O)(=O)N[C@H]1C[C@H]2[C@@H](Cc3cn(C)c4cccc2c34)N(C)C1	BroadT	BRD-K91336023	BRD-K91336023-001-01-4	Biomol International Inc.	AC-834	2812-3-N1298		CN(C)S(=O)(=O)N[C@H]1C[C@H]2[C@@H](Cc3cn(C)c4cccc2c34)N(C)C1	InChI=1S/C18H26N4O2S/c1-20(2)25(23,24)19-13-9-15-14-6-5-7-16-18(14)12(10-21(16)3)8-17(15)22(4)11-13/h5-7,10,13,15,17,19H,8-9,11H2,1-4H3/t13-,15+,17+/m0/s1	JLVHTNZNKOSCNB-YSVLISHTSA-N	362.177646802							73378, 73378
UNII-POX639L40H	LSM-15490	SID11114122, BRD-K90065682	6604876	InChI=1S/C9H11IN2O/c10-7-3-9(5-11-4-7)13-6-8-1-2-12-8/h3-5,8,12H,1-2,6H2/t8-/m0/s1	RKVRGRXOYDTUEY-QMMMGPOBSA-N	Ic1cncc(OC[C@@H]2CCN2)c1	BroadT	BRD-K90065682	BRD-K90065682-300-01-8	Tocris Bioscience	1518	2	Cl.Cl	Ic1cncc(OC[C@@H]2CCN2)c1.Cl.Cl	InChI=1S/C9H11IN2O.2ClH/c10-7-3-9(5-11-4-7)13-6-8-1-2-12-8;;/h3-5,8,12H,1-2,6H2;2*1H/t8-;;/m0../s1	ZJVVFYWEBSHGBV-JZGIKJSDSA-N	289.991605992							104132
Dienestrol	LSM-43043	Dienestrol, Estraguard	667476	InChI=1S/C18H18O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h3-12,19-20H,1-2H3/b17-3+,18-4+	NFDFQCUYFHCNBW-SCGPFSFSSA-N	C\C=C(\C(=C\C)\c1ccc(O)cc1)/c2ccc(O)cc2	BroadT	BRD-K95309561	BRD-K95309561-001-04-9	MicroSource Discovery Systems Inc.	1500241			C\C=C(c1ccc(O)cc1)\C(c1ccc(O)cc1)=C\C	InChI=1S/C18H18O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h3-12,19-20H,1-2H3/b17-3+,18-4+	NFDFQCUYFHCNBW-SCGPFSFSSA-N	266.130679816							
Pimethixene	LSM-5936	Pimetixene, Pimethixene, BP-400	4822	InChI=1S/C19H19NS/c1-20-12-10-14(11-13-20)19-15-6-2-4-8-17(15)21-18-9-5-3-7-16(18)19/h2-9H,10-13H2,1H3	NZLVRVYNQYGMAB-UHFFFAOYSA-N	CN1CCC(=C2c3ccccc3Sc4ccccc24)CC1	BroadT	BRD-K88090157	BRD-K88090157-050-03-3	MicroSource Discovery Systems Inc.	1501114		OC(=O)/C=C\C(=O)O	CN1CCC(CC1)=C1c2ccccc2Sc2ccccc12.OC(=O)/C=C\C(=O)O	InChI=1S/C19H19NS.C4H4O4/c1-20-12-10-14(11-13-20)19-15-6-2-4-8-17(15)21-18-9-5-3-7-16(18)19;5-3(6)1-2-4(7)8/h2-9H,10-13H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-	IPANUAHQWFDVAG-BTJKTKAUSA-N	293.123820308							94787, 94787
GW7647	LSM-4172	GW7647, GW-7647	3392731	InChI=1S/C29H46N2O3S/c1-29(2,27(32)33)35-26-18-16-24(17-19-26)20-22-31(28(34)30-25-14-7-4-8-15-25)21-10-9-13-23-11-5-3-6-12-23/h16-19,23,25H,3-15,20-22H2,1-2H3,(H,30,34)(H,32,33)	PKNYXWMTHFMHKD-UHFFFAOYSA-N	CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)NC3CCCCC3)cc1)C(=O)O	BroadT	BRD-K96263742	BRD-K96263742-001-02-3	Tocris Bioscience	1677	1		CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)NC2CCCCC2)cc1)C(O)=O	InChI=1S/C29H46N2O3S/c1-29(2,27(32)33)35-26-18-16-24(17-19-26)20-22-31(28(34)30-25-14-7-4-8-15-25)21-10-9-13-23-11-5-3-6-12-23/h16-19,23,25H,3-15,20-22H2,1-2H3,(H,30,34)(H,32,33)	PKNYXWMTHFMHKD-UHFFFAOYSA-N	502.322914042							70778
BDBM50127227	LSM-43025	Manumycin-A	44483259	InChI=1S/C31H38N2O7/c1-5-6-11-19(2)16-20(3)17-21(4)30(38)32-22-18-31(39,29-28(40-29)27(22)37)15-10-8-7-9-12-25(36)33-26-23(34)13-14-24(26)35/h7-10,12,15-19,26,28-29,39H,5-6,11,13-14H2,1-4H3,(H,32,38)(H,33,36)/b8-7+,12-9+,15-10+,20-16+,21-17+/t19-,28-,29-,31+/m1/s1	XIZGHTZLVCHYJN-MVTGTTCWSA-N	CCCC[C@@H](C)\C=C(/C)\C=C(/C)\C(=O)NC1=C[C@@](O)(\C=C\C=C\C=C\C(=O)NC2C(=O)CCC2=O)[C@@H]3O[C@@H]3C1=O	BroadT	BRD-K78599730	BRD-K78599730-001-02-6	Sigma-Aldrich	M6418			CCCC[C@@H](C)\C=C(C)\C=C(/C)C(=O)NC1=C[C@@](O)(\C=C\C=C\C=C\C(=O)NC2C(=O)CCC2=O)[C@@H]2O[C@@H]2C1=O	InChI=1S/C31H38N2O7/c1-5-6-11-19(2)16-20(3)17-21(4)30(38)32-22-18-31(39,29-28(40-29)27(22)37)15-10-8-7-9-12-25(36)33-26-23(34)13-14-24(26)35/h7-10,12,15-19,26,28-29,39H,5-6,11,13-14H2,1-4H3,(H,32,38)(H,33,36)/b8-7+,12-9+,15-10+,20-16+,21-17+/t19-,28-,29-,31+/m1/s1	XIZGHTZLVCHYJN-MVTGTTCWSA-N	550.267901576							
MY 5445	LSM-4024	SID11113498, SID124886914, MY-5445, SID26751719	1348	InChI=1S/C20H14ClN3/c21-15-9-6-10-16(13-15)22-20-18-12-5-4-11-17(18)19(23-24-20)14-7-2-1-3-8-14/h1-13H,(H,22,24)	CEHQLKSLMFIHBF-UHFFFAOYSA-N	Clc1cccc(Nc2nnc(c3ccccc3)c4ccccc24)c1	BroadT	BRD-K90524085	BRD-K90524085-001-05-2	Biomol International Inc.	PD-155	2840(V2)-3-N1305		Clc1cccc(Nc2nnc(-c3ccccc3)c3ccccc23)c1	InChI=1S/C20H14ClN3/c21-15-9-6-10-16(13-15)22-20-18-12-5-4-11-17(18)19(23-24-20)14-7-2-1-3-8-14/h1-13H,(H,22,24)	CEHQLKSLMFIHBF-UHFFFAOYSA-N	331.087625188							93577
CHEMBL286991	LSM-42876	GBR-13069, SID26751713	5974189	InChI=1S/C28H30F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-15,28H,16-22H2/b7-4+	DASHZBBQOARCMQ-QPJJXVBHSA-N	Fc1ccc(cc1)C(OCCN2CCN(C\C=C\c3ccccc3)CC2)c4ccc(F)cc4	BroadT	BRD-K92577649	BRD-K92577649-001-01-6	Biomol International Inc.	AC-273	2812-3-N1298		Fc1ccc(cc1)C(OCCN1CCN(C\C=C\c2ccccc2)CC1)c1ccc(F)cc1	InChI=1S/C28H30F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-15,28H,16-22H2/b7-4+	DASHZBBQOARCMQ-QPJJXVBHSA-N	448.23262							, , 
Anhydrobrazilic acid	LSM-24948		4303260	InChI=1S/C12H10O5/c1-16-8-2-3-9-10(5-8)17-6-7(12(9)15)4-11(13)14/h2-3,5-6H,4H2,1H3,(H,13,14)	KVQVEJPIQHNLTM-UHFFFAOYSA-N	COc1ccc2C(=O)C(=COc2c1)CC(=O)O	BroadT	BRD-K78414110	BRD-K78414110-001-02-8	MicroSource Discovery Systems Inc.	200457			COc1ccc2c(c1)occ(CC(O)=O)c2=O	InChI=1S/C12H10O5/c1-16-8-2-3-9-10(5-8)17-6-7(12(9)15)4-11(13)14/h2-3,5-6H,4H2,1H3,(H,13,14)	KVQVEJPIQHNLTM-UHFFFAOYSA-N	234.05282342							113533
Iproniazid	LSM-5940	Iproniazide, Iproniazid	3748	InChI=1S/C9H13N3O/c1-7(2)11-12-9(13)8-3-5-10-6-4-8/h3-7,11H,1-2H3,(H,12,13)	NYMGNSNKLVNMIA-UHFFFAOYSA-N	CC(C)NNC(=O)c1ccncc1	BroadT	BRD-K88568253	BRD-K88568253-065-02-1	MicroSource Discovery Systems Inc.	1500634		OS(=O)(=O)O	CC(C)NNC(=O)c1ccncc1.OS(=O)(=O)O	InChI=1S/C9H13N3O.H2O4S/c1-7(2)11-12-9(13)8-3-5-10-6-4-8;1-5(2,3)4/h3-7,11H,1-2H3,(H,12,13);(H2,1,2,3,4)	FYEMNIIBXSJOLP-UHFFFAOYSA-N	179.105862066							5958, 5958, 5958
GBR12783	LSM-42940	GBR-12783, SID26751750	5788723	InChI=1S/C28H32N2O/c1-4-11-25(12-5-1)13-10-18-29-19-21-30(22-20-29)23-24-31-28(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-17,28H,18-24H2/b13-10+	XFBDGHFDKJITGC-JLHYYAGUSA-N	C(CN1CCN(C\C=C\c2ccccc2)CC1)OC(c3ccccc3)c4ccccc4	BroadT	BRD-K92015269	BRD-K92015269-001-01-6	Biomol International Inc.	AC-271	2812-3-N1298		C(CN1CCN(C\C=C\c2ccccc2)CC1)OC(c1ccccc1)c1ccccc1	InChI=1S/C28H32N2O/c1-4-11-25(12-5-1)13-10-18-29-19-21-30(22-20-29)23-24-31-28(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-17,28H,18-24H2/b13-10+	XFBDGHFDKJITGC-JLHYYAGUSA-N	412.251463664							
Khellin	LSM-5863	Ammivin, Khellin, Khelloyd	3828	InChI=1S/C14H12O5/c1-7-6-9(15)10-11(16-2)8-4-5-18-12(8)14(17-3)13(10)19-7/h4-6H,1-3H3	HSMPDPBYAYSOBC-UHFFFAOYSA-N	COc1c2OC(=CC(=O)c2c(OC)c3ccoc13)C	BroadT	BRD-K80353807	BRD-K80353807-001-03-0	AnalytiCon Discovery GmbH	NP-000849			COc1c2ccoc2c(OC)c2oc(C)cc(=O)c12	InChI=1S/C14H12O5/c1-7-6-9(15)10-11(16-2)8-4-5-18-12(8)14(17-3)13(10)19-7/h4-6H,1-3H3	HSMPDPBYAYSOBC-UHFFFAOYSA-N	260.068473484							6133
Trifluoperazine	LSM-4010	Trifluoperazine	5566	InChI=1S/C21H24F3N3S/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24/h2-3,5-8,15H,4,9-14H2,1H3	ZEWQUBUPAILYHI-UHFFFAOYSA-N	CN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1	BroadT	BRD-K89732114	BRD-K89732114-001-02-6	Biomol International Inc.	CA-310	2840(V2)-3-N1305		CN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1	InChI=1S/C21H24F3N3S/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24/h2-3,5-8,15H,4,9-14H2,1H3	ZEWQUBUPAILYHI-UHFFFAOYSA-N	407.164303088							45951, 45951, 45951
Pyrimethamine	LSM-3967	Pyrimethamine, Malacide, Daraprim, Chloridin, TCMDC-125860, TCMDC-123831, GNF-PF-5586	4993	InChI=1S/C12H13ClN4/c1-2-9-10(11(14)17-12(15)16-9)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H4,14,15,16,17)	WKSAUQYGYAYLPV-UHFFFAOYSA-N	CCc1nc(N)nc(N)c1c2ccc(Cl)cc2	BroadT	BRD-K88429204	BRD-K88429204-001-04-7	MicroSource Discovery Systems Inc.	1500520			CCc1nc(N)nc(N)c1-c1ccc(Cl)cc1	InChI=1S/C12H13ClN4/c1-2-9-10(11(14)17-12(15)16-9)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H4,14,15,16,17)	WKSAUQYGYAYLPV-UHFFFAOYSA-N	248.082874166							8673
Trequinsin	LSM-3893		5537	InChI=1S/C24H27N3O3/c1-14-9-15(2)23(16(3)10-14)25-22-13-19-18-12-21(30-6)20(29-5)11-17(18)7-8-27(19)24(28)26(22)4/h9-13H,7-8H2,1-6H3	MCMSJVMUSBZUCN-UHFFFAOYSA-N	COc1cc2CCN3C(=O)N(C)C(=Nc4c(C)cc(C)cc4C)C=C3c2cc1OC	BroadT	BRD-K84663978	BRD-K84663978-001-03-1	Tocris Bioscience	2337	1	Cl.COc1cc2CCn3c(cc(=Nc4c(C)cc(C)cc4C)n(C)c3=O)-c2cc1OC	COc1cc2CCn3c(c\c(=N/c4c(C)cc(C)cc4C)n(C)c3=O)-c2cc1OC	InChI=1S/C24H27N3O3/c1-14-9-15(2)23(16(3)10-14)25-22-13-19-18-12-21(30-6)20(29-5)11-17(18)7-8-27(19)24(28)26(22)4/h9-13H,7-8H2,1-6H3/b25-22+	MCMSJVMUSBZUCN-YYDJUVGSSA-N	405.205241754							93477, 93477
3,4,5-Trimethoxycinnamaldehyde	LSM-44078	BRD-K87194840	5839209	InChI=1S/C12H14O4/c1-14-10-7-9(5-4-6-13)8-11(15-2)12(10)16-3/h4-8H,1-3H3/b5-4+	XDSHNNRBLSBDAP-SNAWJCMRSA-N	COc1cc(\C=C\C=O)cc(OC)c1OC	BroadT	BRD-K87194840	BRD-K87194840-001-03-0	Broad Institute CMLD	KB151-III-9			COc1cc(cc(OC)c1OC)\C=C\C=O	InChI=1S/C12H14O4/c1-14-10-7-9(5-4-6-13)8-11(15-2)12(10)16-3/h4-8H,1-3H3/b5-4+	XDSHNNRBLSBDAP-SNAWJCMRSA-N	222.089208928							
Tolmetin	LSM-3852	Tolmetin, Tolectin, MCN-2559	5509	InChI=1S/C15H15NO3/c1-10-3-5-11(6-4-10)15(19)13-8-7-12(16(13)2)9-14(17)18/h3-8H,9H2,1-2H3,(H,17,18)	UPSPUYADGBWSHF-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)c2ccc(CC(=O)O)n2C	BroadT	BRD-K82562631	BRD-K82562631-236-02-0	MicroSource Discovery Systems Inc.	1500582		[Na]	Cc1ccc(cc1)C(=O)c1ccc(CC(O)=O)n1C.[Na]	InChI=1S/C15H15NO3.Na.H/c1-10-3-5-11(6-4-10)15(19)13-8-7-12(16(13)2)9-14(17)18;;/h3-8H,9H2,1-2H3,(H,17,18);;	CZAMKJDMLGTCQO-UHFFFAOYSA-N	257.10519335							71941, 71941, 71941, 71941
Orsellinic Acid, Ethyl Ester	LSM-24950	SID26749468, SID93576967	75653	InChI=1S/C10H12O4/c1-3-14-10(13)9-6(2)4-7(11)5-8(9)12/h4-5,11-12H,3H2,1-2H3	UQSRXQMIXSZGLA-UHFFFAOYSA-N	CCOC(=O)c1c(C)cc(O)cc1O	BroadT	BRD-K97487499	BRD-K97487499-001-02-2	MicroSource Discovery Systems Inc.	200002			CCOC(=O)c1c(C)cc(O)cc1O	InChI=1S/C10H12O4/c1-3-14-10(13)9-6(2)4-7(11)5-8(9)12/h4-5,11-12H,3H2,1-2H3	UQSRXQMIXSZGLA-UHFFFAOYSA-N	196.073558864							113535
CHEMBL90882	LSM-24951	SID11113702, SID26751891, BRD-K92588747	32224	InChI=1S/C19H19ClN2O/c1-21-8-10-22(11-9-21)17-12-14-4-2-3-5-18(14)23-19-7-6-15(20)13-16(17)19/h2-7,12-13H,8-11H2,1H3	OTKUTGIVEREJLL-UHFFFAOYSA-N	CN1CCN(CC1)C2=Cc3ccccc3Oc4ccc(Cl)cc24	BroadT	BRD-K92588747	BRD-K92588747-001-01-4	Biomol International Inc.	AC-261	2812-3-N1298		CN1CCN(CC1)C1=Cc2ccccc2Oc2ccc(Cl)cc12	InChI=1S/C19H19ClN2O/c1-21-8-10-22(11-9-21)17-12-14-4-2-3-5-18(14)23-19-7-6-15(20)13-16(17)19/h2-7,12-13H,8-11H2,1H3	OTKUTGIVEREJLL-UHFFFAOYSA-N	326.118590958							113536
Methanandamide	LSM-44079	Methanandamide, (R)-Methanandamide	6321351	InChI=1S/C23H39NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(26)24-22(2)21-25/h7-8,10-11,13-14,16-17,22,25H,3-6,9,12,15,18-21H2,1-2H3,(H,24,26)/b8-7-,11-10-,14-13-,17-16-/t22-/m1/s1	SQKRUBZPTNJQEM-FQPARAGTSA-N	CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)N[C@H](C)CO	BroadT	BRD-K97602563	BRD-K97602563-001-02-7	Biomol International Inc.	FA021	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)N[C@H](C)CO	InChI=1S/C23H39NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(26)24-22(2)21-25/h7-8,10-11,13-14,16-17,22,25H,3-6,9,12,15,18-21H2,1-2H3,(H,24,26)/b8-7-,11-10-,14-13-,17-16-/t22-/m1/s1	SQKRUBZPTNJQEM-FQPARAGTSA-N	361.298079498							
Prednisone	LSM-24953	Sterapred, Rayos, Prednisone, Paracort, Orasone, Meticorten, Fernisone, Deltasone, Cortan, Prednisone Intensol, Prednicen-M, Liquid Pred, Delta-Dome	5865	InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1	XOFYZVNMUHMLCC-ZPOLXVRWSA-N	C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO	BroadT	BRD-K85883481	BRD-K85883481-001-02-6	AnalytiCon Discovery GmbH	NP-010062			C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO	InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1	XOFYZVNMUHMLCC-ZPOLXVRWSA-N	358.178023932							8382
Tegaserod	LSM-5375		6844184	InChI=1S/C16H23N5O/c1-3-4-5-8-18-16(17)21-20-11-12-10-19-15-7-6-13(22-2)9-14(12)15/h6-7,9-11,19H,3-5,8H2,1-2H3,(H3,17,18,21)/b20-11+	IKBKZGMPCYNSLU-RGVLZGJSSA-N	CCCCC\N=C(/N)\N\N=C\c1c[nH]c2ccc(OC)cc12	BroadT	BRD-K88743730	BRD-K88743730-001-01-0	MicroSource Discovery Systems Inc.	1505823			CCCCCNC(=N)N\N=C\c1c[nH]c2ccc(OC)cc12	InChI=1S/C16H23N5O/c1-3-4-5-8-18-16(17)21-20-11-12-10-19-15-7-6-13(22-2)9-14(12)15/h6-7,9-11,19H,3-5,8H2,1-2H3,(H3,17,18,21)/b20-11+	IKBKZGMPCYNSLU-RGVLZGJSSA-N	301.190260406							51043, 51043, 51043
FPL64176	LSM-3777	FPL-64176	3423	InChI=1S/C22H21NO3/c1-14-19(20(15(2)23-14)22(25)26-3)21(24)18-12-8-7-11-17(18)13-16-9-5-4-6-10-16/h4-12,23H,13H2,1-3H3	MDMWHKZANMNXTF-UHFFFAOYSA-N	COC(=O)c1c(C)[nH]c(C)c1C(=O)c2ccccc2Cc3ccccc3	BroadT	BRD-K78959463	BRD-K78959463-001-02-5	Biomol International Inc.	CA-245	2840(V2)-3-N1305		COC(=O)c1c(C)[nH]c(C)c1C(=O)c1ccccc1Cc1ccccc1	InChI=1S/C22H21NO3/c1-14-19(20(15(2)23-14)22(25)26-3)21(24)18-12-8-7-11-17(18)13-16-9-5-4-6-10-16/h4-12,23H,13H2,1-3H3	MDMWHKZANMNXTF-UHFFFAOYSA-N	347.152143542							249982
Cis-2-Methoxycinnamic Acid	LSM-43046	Coumaric-Acid	1622530	InChI=1S/C10H10O3/c1-13-9-5-3-2-4-8(9)6-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-6-	FEGVSPGUHMGGBO-SREVYHEPSA-N	COc1ccccc1\C=C/C(=O)O	BroadT	BRD-K96271548	BRD-K96271548-001-02-2	MicroSource Discovery Systems Inc.	210568			COc1ccccc1\C=C/C(O)=O	InChI=1S/C10H10O3/c1-13-9-5-3-2-4-8(9)6-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-6-	FEGVSPGUHMGGBO-SREVYHEPSA-N	178.06299418							
1,5-Isoquinolinediol	LSM-6689	1,5-Isoquinolinediol, BRD-K90230846	1340	InChI=1S/C9H7NO2/c11-8-3-1-2-7-6(8)4-5-10-9(7)12/h1-5,11H,(H,10,12)	LFUJIPVWTMGYDG-UHFFFAOYSA-N	Oc1cccc2c(O)nccc12	BroadT	BRD-K90230846	BRD-K90230846-001-01-5	Calbiochem	419800			Oc1cccc2c(O)nccc12	InChI=1S/C9H7NO2/c11-8-3-1-2-7-6(8)4-5-10-9(7)12/h1-5,11H,(H,10,12)	LFUJIPVWTMGYDG-UHFFFAOYSA-N	161.047678474							64044
6-Nitroquipazine	LSM-15528	6-Nitroquipazine	5012	InChI=1S/C13H14N4O2/c18-17(19)11-2-3-12-10(9-11)1-4-13(15-12)16-7-5-14-6-8-16/h1-4,9,14H,5-8H2	GGDBEAVVGFNWIA-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2nc(ccc2c1)N3CCNCC3	BroadT	BRD-K95821857	BRD-K95821857-001-01-2	Biomol International Inc.	NS-700	2813-N1283		[O-][N+](=O)c1ccc2nc(ccc2c1)N1CCNCC1	InChI=1S/C13H14N4O2/c18-17(19)11-2-3-12-10(9-11)1-4-13(15-12)16-7-5-14-6-8-16/h1-4,9,14H,5-8H2	GGDBEAVVGFNWIA-UHFFFAOYSA-N	258.111675728							104164, 104164
Damnacanthal	LSM-4099	Damnacanthal	2948	InChI=1S/C16H10O5/c1-21-16-11(7-17)12(18)6-10-13(16)15(20)9-5-3-2-4-8(9)14(10)19/h2-7,18H,1H3	IPDMWUNUULAXLU-UHFFFAOYSA-N	COc1c(C=O)c(O)cc2C(=O)c3ccccc3C(=O)c12	BroadT	BRD-K93325701	BRD-K93325701-001-03-0	Biomol International Inc.	EI-274	2840(V2)-3-N1305		COc1c(C=O)c(O)cc2C(=O)c3ccccc3C(=O)c12	InChI=1S/C16H10O5/c1-21-16-11(7-17)12(18)6-10-13(16)15(20)9-5-3-2-4-8(9)14(10)19/h2-7,18H,1H3	IPDMWUNUULAXLU-UHFFFAOYSA-N	282.05282342							93633
LY-320135	LSM-3770	LY-320135	5311257	InChI=1S/C24H17NO4/c1-27-18-9-7-17(8-10-18)24-22(20-12-11-19(28-2)13-21(20)29-24)23(26)16-5-3-15(14-25)4-6-16/h3-13H,1-2H3	RYNSGDFWBJWWSZ-UHFFFAOYSA-N	COc1ccc(cc1)c2oc3cc(OC)ccc3c2C(=O)c4ccc(cc4)C#N	BroadT	BRD-K78637815	BRD-K78637815-001-01-4	Tocris Bioscience	2387	1		COc1ccc(cc1)-c1oc2cc(OC)ccc2c1C(=O)c1ccc(cc1)C#N	InChI=1S/C24H17NO4/c1-27-18-9-7-17(8-10-18)24-22(20-12-11-19(28-2)13-21(20)29-24)23(26)16-5-3-15(14-25)4-6-16/h3-13H,1-2H3	RYNSGDFWBJWWSZ-UHFFFAOYSA-N	383.115758034							93387
Epivincamine	LSM-6687	SID56463058, BRD-K89704198	637570	InChI=1S/C21H26N2O3/c1-3-20-10-6-11-22-12-9-15-14-7-4-5-8-16(14)23(17(15)18(20)22)21(25,13-20)19(24)26-2/h4-5,7-8,18,25H,3,6,9-13H2,1-2H3/t18-,20+,21-/m1/s1	RXPRRQLKFXBCSJ-HLAWJBBLSA-N	CC[C@@]12CCCN3CCc4c([C@H]13)n(c5ccccc45)[C@@](O)(C2)C(=O)OC	BroadT	BRD-K89704198	BRD-K89704198-001-04-0	MicroSource Discovery Systems Inc.	1500647			CC[C@@]12CCCN3CCc4c([C@H]13)n(c1ccccc41)[C@@](O)(C2)C(=O)OC	InChI=1S/C21H26N2O3/c1-3-20-10-6-11-22-12-9-15-14-7-4-5-8-16(14)23(17(15)18(20)22)21(25,13-20)19(24)26-2/h4-5,7-8,18,25H,3,6,9-13H2,1-2H3/t18-,20+,21-/m1/s1	RXPRRQLKFXBCSJ-HLAWJBBLSA-N	354.194342712							70504
Dipropyldopamine	LSM-3854	SID11111017, SID90340811, Dipropyl-Dopamine	3106	InChI=1S/C14H23NO2/c1-3-8-15(9-4-2)10-7-12-5-6-13(16)14(17)11-12/h5-6,11,16-17H,3-4,7-10H2,1-2H3	LMYSNFBROWBKMB-UHFFFAOYSA-N	CCCN(CCC)CCc1ccc(O)c(O)c1	BroadT	BRD-K82577285	BRD-K82577285-001-01-7	Biomol International Inc.	AC-829	2812-3-N1298		CCCN(CCC)CCc1ccc(O)c(O)c1	InChI=1S/C14H23NO2/c1-3-8-15(9-4-2)10-7-12-5-6-13(16)14(17)11-12/h5-6,11,16-17H,3-4,7-10H2,1-2H3	LMYSNFBROWBKMB-UHFFFAOYSA-N	237.172878986							93446, 93446, 93446
Beta-Narcotine	LSM-4043	Noscapine, SID11111560, SID11112282	31411	InChI=1S/C22H23NO7/c1-23-8-7-11-9-14-20(29-10-28-14)21(27-4)15(11)17(23)18-12-5-6-13(25-2)19(26-3)16(12)22(24)30-18/h5-6,9,17-18H,7-8,10H2,1-4H3/t17-,18-/m1/s1	AKNNEGZIBPJZJG-QZTJIDSGSA-N	COc1ccc2[C@@H](OC(=O)c2c1OC)[C@@H]3N(C)CCc4cc5OCOc5c(OC)c34	BroadT	BRD-K91301684	BRD-K91301684-003-02-2	MicroSource Discovery Systems Inc.	1500443		Cl	COc1ccc2[C@@H](OC(=O)c2c1OC)[C@@H]1N(C)CCc2cc3OCOc3c(OC)c12.Cl	InChI=1S/C22H23NO7.ClH/c1-23-8-7-11-9-14-20(29-10-28-14)21(27-4)15(11)17(23)18-12-5-6-13(25-2)19(26-3)16(12)22(24)30-18;/h5-6,9,17-18H,7-8,10H2,1-4H3;1H/t17-,18-;/m1./s1	MFLVZFXCSKVCSH-JAXOOIEVSA-N	413.147452086							93592
L-Cis-Diltiazem	LSM-3819	Diltiazem, SID11112730, SID11111056	198107	InChI=1S/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3/t20-,21+/m0/s1	HSUGRBWQSSZJOP-LEWJYISDSA-N	COc1ccc(cc1)[C@H]2Sc3ccccc3N(CCN(C)C)C(=O)[C@H]2OC(=O)C	BroadT	BRD-K81029756	BRD-K81029756-001-02-8	Biomol International Inc.	CA-207	2840(V2)-3-N1305		COc1ccc(cc1)[C@H]1Sc2ccccc2N(CCN(C)C)C(=O)[C@H]1OC(C)=O	InChI=1S/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3/t20-,21+/m0/s1	HSUGRBWQSSZJOP-LEWJYISDSA-N	414.161328022							82813
CHEMBL453376	LSM-3800	SID29215132, GW-583340	5329480	InChI=1S/C28H25ClFN5O3S2/c1-40(36,37)10-9-31-14-27-35-25(16-39-27)19-5-7-24-22(12-19)28(33-17-32-24)34-21-6-8-26(23(29)13-21)38-15-18-3-2-4-20(30)11-18/h2-8,11-13,16-17,31H,9-10,14-15H2,1H3,(H,32,33,34)	MNNXRVSQOABRRP-UHFFFAOYSA-N	CS(=O)(=O)CCNCc1nc(cs1)c2ccc3ncnc(Nc4ccc(OCc5cccc(F)c5)c(Cl)c4)c3c2	BroadT	BRD-K79930101	BRD-K79930101-300-01-1	Tocris Bioscience	2239	3	Cl.Cl	CS(=O)(=O)CCNCc1nc(cs1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1.Cl.Cl	InChI=1S/C28H25ClFN5O3S2.2ClH/c1-40(36,37)10-9-31-14-27-35-25(16-39-27)19-5-7-24-22(12-19)28(33-17-32-24)34-21-6-8-26(23(29)13-21)38-15-18-3-2-4-20(30)11-18;;/h2-8,11-13,16-17,31H,9-10,14-15H2,1H3,(H,32,33,34);2*1H	WIMITXDBYLKRKB-UHFFFAOYSA-N	597.107137							93409, 93409, 93409
Prednisolone	LSM-24954	Prednisolone, Prelone, Servisone, Sterane, Tridesilon, Verdeso, Cortalone, Desowen, Hydeltra, Meticortelone, Delta-Cortef, Fernisolone-P, Hydeltra-TBA, Meti-Derm, Neo-Delta-Cortef, Poly-Pred, Pred-G	5755	InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1	OIGNJSKKLXVSLS-VWUMJDOOSA-N	C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO	BroadT	BRD-K98039984	BRD-K98039984-001-03-0	Prestwick Chemical Inc.	Prestw-274	D0701-MP04-ST03-200-		C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO	InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1	OIGNJSKKLXVSLS-VWUMJDOOSA-N	360.193673996							8378
CDK1 Inhibitor	LSM-44080	SID535284, BRD-K81836716	5472558	InChI=1S/C17H11ClN2O/c18-16-12(10-5-1-3-7-14(10)19-16)9-13-11-6-2-4-8-15(11)20-17(13)21/h1-9,19H,(H,20,21)/b13-9+	QJKBRWSJWQVKLY-UKTHLTGXSA-N	Clc1[nH]c2ccccc2c1\C=C/3\C(=O)Nc4ccccc34	BroadT	BRD-K81836716	BRD-K81836716-001-01-7	Calbiochem	217695			Clc1[nH]c2ccccc2c1\C=C1\C(=O)Nc2ccccc12	InChI=1S/C17H11ClN2O/c18-16-12(10-5-1-3-7-14(10)19-16)9-13-11-6-2-4-8-15(11)20-17(13)21/h1-9,19H,(H,20,21)/b13-9+	QJKBRWSJWQVKLY-UKTHLTGXSA-N	294.055990702							
Relcovaptan	LSM-4185	Relcovaptan, SR-49059, TDI-0134	60943	InChI=1S/C28H27Cl2N3O7S/c1-39-23-12-10-17(15-24(23)40-2)41(37,38)33-21-11-9-16(29)14-19(21)28(36,18-6-3-4-7-20(18)30)25(33)27(35)32-13-5-8-22(32)26(31)34/h3-4,6-7,9-12,14-15,22,25,36H,5,8,13H2,1-2H3,(H2,31,34)/t22-,25-,28+/m0/s1	CEBYCSRFKCEUSW-NAYZPBBASA-N	COc1ccc(cc1OC)S(=O)(=O)N2[C@@H](C(=O)N3CCC[C@H]3C(=O)N)[C@@](O)(c4ccccc4Cl)c5cc(Cl)ccc25	BroadT	BRD-K96720755	BRD-K96720755-001-01-8	Tocris Bioscience	2310	1		COc1ccc(cc1OC)S(=O)(=O)N1[C@@H](C(=O)N2CCC[C@H]2C(N)=O)[C@](O)(c2cc(Cl)ccc12)c1ccccc1Cl	InChI=1S/C28H27Cl2N3O7S/c1-39-23-12-10-17(15-24(23)40-2)41(37,38)33-21-11-9-16(29)14-19(21)28(36,18-6-3-4-7-20(18)30)25(33)27(35)32-13-5-8-22(32)26(31)34/h3-4,6-7,9-12,14-15,22,25,36H,5,8,13H2,1-2H3,(H2,31,34)/t22-,25-,28+/m0/s1	CEBYCSRFKCEUSW-NAYZPBBASA-N	619.094676344							93701
AC55649	LSM-6290	AC-55649	1714884	InChI=1S/C21H26O2/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)19-13-15-20(16-14-19)21(22)23/h9-16H,2-8H2,1H3,(H,22,23)	HXBKPYIEQLLNBK-UHFFFAOYSA-N	CCCCCCCCc1ccc(cc1)c2ccc(cc2)C(=O)O	BroadT	BRD-K93176058	BRD-K93176058-001-01-0	Tocris Bioscience	2436	1		CCCCCCCCc1ccc(cc1)-c1ccc(cc1)C(O)=O	InChI=1S/C21H26O2/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)19-13-15-20(16-14-19)21(22)23/h9-16H,2-8H2,1H3,(H,22,23)	HXBKPYIEQLLNBK-UHFFFAOYSA-N	310.193280072							95048
Betamipron	LSM-24956	Betamipron	71651	InChI=1S/C10H11NO3/c12-9(13)6-7-11-10(14)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13)	CWXYHOHYCJXYFQ-UHFFFAOYSA-N	OC(=O)CCNC(=O)c1ccccc1	BroadT	BRD-K82142815	BRD-K82142815-001-02-7	MicroSource Discovery Systems Inc.	1504244			OC(=O)CCNC(=O)c1ccccc1	InChI=1S/C10H11NO3/c12-9(13)6-7-11-10(14)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13)	CWXYHOHYCJXYFQ-UHFFFAOYSA-N	193.073893222							113539
Halcinonide	LSM-3832	Halcinonide, Halog, SO-18566, SQ-18566, Halog-E	443943	InChI=1S/C24H32ClFO5/c1-20(2)30-19-10-16-15-6-5-13-9-14(27)7-8-21(13,3)23(15,26)17(28)11-22(16,4)24(19,31-20)18(29)12-25/h9,15-17,19,28H,5-8,10-12H2,1-4H3/t15-,16-,17-,19+,21-,22-,23-,24+/m0/s1	MUQNGPZZQDCDFT-JNQJZLCISA-N	CC1(C)O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)CC[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CCl	BroadT	BRD-K81709173	BRD-K81709173-001-03-8	Prestwick Chemical Inc.	Prestw-655	D0701-MP04-ST03-200-		CC1(C)O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)CC[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CCl	InChI=1S/C24H32ClFO5/c1-20(2)30-19-10-16-15-6-5-13-9-14(27)7-8-21(13,3)23(15,26)17(28)11-22(16,4)24(19,31-20)18(29)12-25/h9,15-17,19,28H,5-8,10-12H2,1-4H3/t15-,16-,17-,19+,21-,22-,23-,24+/m0/s1	MUQNGPZZQDCDFT-JNQJZLCISA-N	454.192230034							
CGP13501	LSM-4158	CGP-13501	3519541	InChI=1S/C19H30O2/c1-17(2,3)14-9-13(11-19(7,8)12-20)10-15(16(14)21)18(4,5)6/h9-10,12,21H,11H2,1-8H3	XGWATTXMMMANFJ-UHFFFAOYSA-N	CC(C)(C)c1cc(CC(C)(C)C=O)cc(c1O)C(C)(C)C	BroadT	BRD-K95851186	BRD-K95851186-001-02-9	Tocris Bioscience	1514	1		CC(C)(Cc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C)C=O	InChI=1S/C19H30O2/c1-17(2,3)14-9-13(11-19(7,8)12-20)10-15(16(14)21)18(4,5)6/h9-10,12,21H,11H2,1-8H3	XGWATTXMMMANFJ-UHFFFAOYSA-N	290.2245802							93680
Dehydrocholic acid	LSM-5960	Dehydrocholicacid, Decholin, Dilabil, Procholon, Dehydrocholic-Acid, Dehydrocholic Acid	6674	InChI=1S/C24H34O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29)/t13-,14+,16-,17+,18+,22+,23+,24-/m1/s1	OHXPGWPVLFPUSM-KLRNGDHRSA-N	C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@]12C)[C@@]4(C)CCC(=O)C[C@H]4CC3=O	BroadT	BRD-K90976994	BRD-K90976994-001-02-1	Prestwick Chemical Inc.	Prestw-123	D0701-MP04-ST03-200-		C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@]12C)[C@@]1(C)CCC(=O)C[C@H]1CC3=O	InChI=1S/C24H34O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29)/t13-,14+,16-,17+,18+,22+,23+,24-/m1/s1	OHXPGWPVLFPUSM-KLRNGDHRSA-N	402.240624188							31459, 31459
Acetyl-Farnesyl-Cysteine	LSM-43236	SID26754859, SID26754858	6438381	InChI=1S/C20H33NO3S/c1-15(2)8-6-9-16(3)10-7-11-17(4)12-13-25-14-19(20(23)24)21-18(5)22/h8,10,12,19H,6-7,9,11,13-14H2,1-5H3,(H,21,22)(H,23,24)/b16-10+,17-12+/t19-/m0/s1	XTURYZYJYQRJDO-BNAHBJSTSA-N	CC(=CCC\C(=C\CC\C(=C\CSC[C@H](NC(=O)C)C(=O)O)\C)\C)C	BroadT	BRD-K79437791	BRD-K79437791-001-02-4	Biomol International Inc.	G-200	2840(V2)-3-N1305		CC(=O)N[C@@H](CSC\C=C(/C)CC\C=C(/C)CCC=C(C)C)C(O)=O	InChI=1S/C20H33NO3S/c1-15(2)8-6-9-16(3)10-7-11-17(4)12-13-25-14-19(20(23)24)21-18(5)22/h8,10,12,19H,6-7,9,11,13-14H2,1-5H3,(H,21,22)(H,23,24)/b16-10+,17-12+/t19-/m0/s1	XTURYZYJYQRJDO-BNAHBJSTSA-N	367.218114616							
BIO2_000751	LSM-24957	SID26756777, BRD-K79053258	6610324	InChI=1S/C17H31N3O5/c1-10(2)12(9-21)19-15(23)14(11(3)4)20-13(22)8-18-16(24)25-17(5,6)7/h9-12,14H,8H2,1-7H3,(H,18,24)(H,19,23)(H,20,22)/t12-,14+/m1/s1	XNZHJADQXXCSFV-OCCSQVGLSA-N	CC(C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)OC(C)(C)C)C(C)C)C=O	BroadT	BRD-K79053258	BRD-K79053258-001-02-5	Biomol International Inc.	PI-128	2840(V2)-3-N1305		CC(C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)OC(C)(C)C)C(C)C)C=O	InChI=1S/C17H31N3O5/c1-10(2)12(9-21)19-15(23)14(11(3)4)20-13(22)8-18-16(24)25-17(5,6)7/h9-12,14H,8H2,1-7H3,(H,18,24)(H,19,23)(H,20,22)/t12-,14+/m1/s1	XNZHJADQXXCSFV-OCCSQVGLSA-N	357.226371122							113540
Gibberellin A3	LSM-4083	Gibberellic-Acid, Gibberellic Acid, (+)-Gibberellic Acid	6466	InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10-,11+,12-,13-,16-,17+,18+,19-/m1/s1	IXORZMNAPKEEDV-OBDJNFEBSA-N	C[C@]12[C@@H](O)C=C[C@@]3(OC1=O)[C@@H]4CC[C@]5(O)C[C@]4(CC5=C)[C@H]([C@H]23)C(=O)O	BroadT	BRD-K92758126	BRD-K92758126-001-06-3	Prestwick Chemical Inc.	Prestw-965	D0701-MP04-ST03-200-		C[C@@]12[C@H]3[C@H](C(O)=O)[C@@]45CC(=C)[C@@](O)(C4)CC[C@H]5[C@]3(OC1=O)C=C[C@@H]2O	InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10-,11+,12-,13-,16-,17+,18+,19-/m1/s1	IXORZMNAPKEEDV-OBDJNFEBSA-N	346.141638424							28833
CP93129	LSM-3839	CP-93129	124007	InChI=1S/C12H13N3O/c16-11-2-1-10-12(15-11)9(7-14-10)8-3-5-13-6-4-8/h1-3,7,13-14H,4-6H2,(H,15,16)	PJYVGMRFPFNZCT-UHFFFAOYSA-N	O=C1Nc2c(C=C1)[nH]cc2C3=CCNCC3	BroadT	BRD-K81876028	BRD-K81876028-300-01-2	Tocris Bioscience	1032	2	Cl.Cl	O=c1ccc2[nH]cc(C3=CCNCC3)c2[nH]1.Cl.Cl	InChI=1S/C12H13N3O.2ClH/c16-11-2-1-10-12(15-11)9(7-14-10)8-3-5-13-6-4-8;;/h1-3,7,13-14H,4-6H2,(H,15,16);2*1H	FLVJHUZZKVJQNH-UHFFFAOYSA-N	215.105862066							93436
BMS 191011	LSM-4148	BMS-191011	10474339	InChI=1S/C16H10ClF3N2O3/c17-12-5-6-13(23)10(7-12)8-22-15(24)25-14(21-22)9-1-3-11(4-2-9)16(18,19)20/h1-7,23H,8H2	QKOWACXSXTXRKA-UHFFFAOYSA-N	Oc1ccc(Cl)cc1CN2N=C(OC2=O)c3ccc(cc3)C(F)(F)F	BroadT	BRD-K95609758	BRD-K95609758-001-01-1	Tocris Bioscience	2665	1		Oc1ccc(Cl)cc1Cn1nc(oc1=O)-c1ccc(cc1)C(F)(F)F	InChI=1S/C16H10ClF3N2O3/c17-12-5-6-13(23)10(7-12)8-22-15(24)25-14(21-22)9-1-3-11(4-2-9)16(18,19)20/h1-7,23H,8H2	QKOWACXSXTXRKA-UHFFFAOYSA-N	370.03320451							93672
ARC239	LSM-4094	ARC-239	609483	InChI=1S/C24H29N3O3/c1-24(2)19-9-5-4-8-18(19)22(28)27(23(24)29)17-14-25-12-15-26(16-13-25)20-10-6-7-11-21(20)30-3/h4-11H,12-17H2,1-3H3	JFNKXGOEOQCXDM-UHFFFAOYSA-N	COc1ccccc1N2CCN(CCN3C(=O)c4ccccc4C(C)(C)C3=O)CC2	BroadT	BRD-K93188295	BRD-K93188295-300-01-4	Tocris Bioscience	928	5	Cl.Cl	COc1ccccc1N1CCN(CCN2C(=O)c3ccccc3C(C)(C)C2=O)CC1.Cl.Cl	InChI=1S/C24H29N3O3.2ClH/c1-24(2)19-9-5-4-8-18(19)22(28)27(23(24)29)17-14-25-12-15-26(16-13-25)20-10-6-7-11-21(20)30-3;;/h4-11H,12-17H2,1-3H3;2*1H	SAJKHRHHDGSJEZ-UHFFFAOYSA-N	407.220891818							93630
Indomethacin Morpholinylamide	LSM-4119	BML 190, BML-190, Indomethacin Morpholinylamide	2415	InChI=1S/C23H23ClN2O4/c1-15-19(14-22(27)25-9-11-30-12-10-25)20-13-18(29-2)7-8-21(20)26(15)23(28)16-3-5-17(24)6-4-16/h3-8,13H,9-12,14H2,1-2H3	BJSDNVVWJYDOLK-UHFFFAOYSA-N	COc1ccc2c(c1)c(CC(=O)N3CCOCC3)c(C)n2C(=O)c4ccc(Cl)cc4	BroadT	BRD-K94379058	BRD-K94379058-001-03-5	Tocris Bioscience	1383	1		COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)N3CCOCC3)c2c1	InChI=1S/C23H23ClN2O4/c1-15-19(14-22(27)25-9-11-30-12-10-25)20-13-18(29-2)7-8-21(20)26(15)23(28)16-3-5-17(24)6-4-16/h3-8,13H,9-12,14H2,1-2H3	BJSDNVVWJYDOLK-UHFFFAOYSA-N	426.134634946							93649
Betahistine	LSM-4044	Betahistine, Beta-Histine	2366	InChI=1S/C8H12N2/c1-9-7-5-8-4-2-3-6-10-8/h2-4,6,9H,5,7H2,1H3	UUQMNUMQCIQDMZ-UHFFFAOYSA-N	CNCCc1ccccn1	BroadT	BRD-K91315211	BRD-K91315211-334-02-3	Prestwick Chemical Inc.	Prestw-543	D0701-MP04-ST03-200-	CS(=O)(=O)O.CS(=O)(=O)O	CNCCc1ccccn1.CS(=O)(=O)O.CS(=O)(=O)O	InChI=1S/C8H12N2.2CH4O3S/c1-9-7-5-8-4-2-3-6-10-8;2*1-5(2,3)4/h2-4,6,9H,5,7H2,1H3;2*1H3,(H,2,3,4)	ZBJJDYGJCNTNTH-UHFFFAOYSA-N	136.100048404							35677, 35677, 35677, 35677
Desoxycorticosterone	LSM-4222	21-Hydroxyprogesterone, Desoxycortone, Desoxycorticosterone	6166	InChI=1S/C21H30O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h11,15-18,22H,3-10,12H2,1-2H3/t15-,16-,17-,18+,20-,21-/m0/s1	ZESRJSPZRDMNHY-YFWFAHHUSA-N	C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO	BroadT	BRD-K98521173	BRD-K98521173-001-03-8	Prestwick Chemical Inc.	Prestw-957	D0701-MP04-ST03-200-		C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO	InChI=1S/C21H30O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h11,15-18,22H,3-10,12H2,1-2H3/t15-,16-,17-,18+,20-,21-/m0/s1	ZESRJSPZRDMNHY-YFWFAHHUSA-N	330.21949482							16973
Graveoline	LSM-4078	Graveoline	353825	InChI=1S/C17H13NO3/c1-18-13-5-3-2-4-12(13)15(19)9-14(18)11-6-7-16-17(8-11)21-10-20-16/h2-9H,10H2,1H3	COBBNRKBTCBWQP-UHFFFAOYSA-N	CN1C(=CC(=O)c2ccccc12)c3ccc4OCOc4c3	BroadT	BRD-K92683369	BRD-K92683369-001-03-6	Prestwick Chemical Inc.	Prestw-674	D0701-MP04-ST03-200-		Cn1c(cc(=O)c2ccccc12)-c1ccc2OCOc2c1	InChI=1S/C17H13NO3/c1-18-13-5-3-2-4-12(13)15(19)9-14(18)11-6-7-16-17(8-11)21-10-20-16/h2-9H,10H2,1H3	COBBNRKBTCBWQP-UHFFFAOYSA-N	279.089543286							5541
3-Acetamidocoumarin	LSM-6680	SID11112444, SID24811229, BRD-K85104575	136620	InChI=1S/C11H9NO3/c1-7(13)12-9-6-8-4-2-3-5-10(8)15-11(9)14/h2-6H,1H3,(H,12,13)	XJYLCCJIDYSFMB-UHFFFAOYSA-N	CC(=O)NC1=Cc2ccccc2OC1=O	BroadT	BRD-K85104575	BRD-K85104575-001-03-2	Prestwick Chemical Inc.	Prestw-969	D0701-MP04-ST03-200-		CC(=O)Nc1cc2ccccc2oc1=O	InChI=1S/C11H9NO3/c1-7(13)12-9-6-8-4-2-3-5-10(8)15-11(9)14/h2-6H,1H3,(H,12,13)	XJYLCCJIDYSFMB-UHFFFAOYSA-N	203.058243158							95324
2-Phenyl-1H-indole	LSM-24958	2-Phenylindole	13698	InChI=1S/C14H11N/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14/h1-10,15H	KLLLJCACIRKBDT-UHFFFAOYSA-N	c1ccc(cc1)c2cc3ccccc3[nH]2	BroadT	BRD-K85555482	BRD-K85555482-001-01-1	TimTec LLC	ST4020026			c1c([nH]c2ccccc12)-c1ccccc1	InChI=1S/C14H11N/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14/h1-10,15H	KLLLJCACIRKBDT-UHFFFAOYSA-N	193.089149362							113541
Olomoucine	LSM-3857	Olomoucine, Olomucine	4592	InChI=1S/C15H18N6O/c1-21-10-18-12-13(17-9-11-5-3-2-4-6-11)19-15(16-7-8-22)20-14(12)21/h2-6,10,22H,7-9H2,1H3,(H2,16,17,19,20)	GTVPOLSIJWJJNY-UHFFFAOYSA-N	Cn1cnc2c(NCc3ccccc3)nc(NCCO)nc12	BroadT	BRD-K82731415	BRD-K82731415-001-04-7	Biomol International Inc.	CC-200	2840(V2)-3-N1305		Cn1cnc2c(NCc3ccccc3)nc(NCCO)nc12	InChI=1S/C15H18N6O/c1-21-10-18-12-13(17-9-11-5-3-2-4-6-11)19-15(16-7-8-22)20-14(12)21/h2-6,10,22H,7-9H2,1H3,(H2,16,17,19,20)	GTVPOLSIJWJJNY-UHFFFAOYSA-N	298.154209256							
Picrotoxinin	LSM-24959	Picrotoxinin	442292	InChI=1S/C15H16O6/c1-5(2)7-8-11(16)19-9(7)10-13(3)14(8,18)4-6-15(13,21-6)12(17)20-10/h6-10,18H,1,4H2,2-3H3/t6-,7+,8-,9-,10-,13-,14-,15+/m1/s1	PIMZUZSSNYHVCU-YKWPQBAZSA-N	CC(=C)[C@@H]1[C@H]2OC(=O)[C@@H]1[C@]3(O)C[C@H]4O[C@]45C(=O)O[C@H]2[C@]35C	BroadT	BRD-K95554982	BRD-K95554982-001-02-5	MicroSource Discovery Systems Inc.	1501107			CC(=C)[C@@H]1[C@H]2OC(=O)[C@@H]1[C@]1(O)C[C@H]3O[C@]33C(=O)O[C@H]2[C@]13C	InChI=1S/C15H16O6/c1-5(2)7-8-11(16)19-9(7)10-13(3)14(8,18)4-6-15(13,21-6)12(17)20-10/h6-10,18H,1,4H2,2-3H3/t6-,7+,8-,9-,10-,13-,14-,15+/m1/s1	PIMZUZSSNYHVCU-YKWPQBAZSA-N	292.094688232							8206
Suxibuzone	LSM-5851	Suxibuzone	5362	InChI=1S/C24H26N2O6/c1-2-3-16-24(17-32-21(29)15-14-20(27)28)22(30)25(18-10-6-4-7-11-18)26(23(24)31)19-12-8-5-9-13-19/h4-13H,2-3,14-17H2,1H3,(H,27,28)	ONWXNHPOAGOMTG-UHFFFAOYSA-N	CCCCC1(COC(=O)CCC(=O)O)C(=O)N(N(C1=O)c2ccccc2)c3ccccc3	BroadT	BRD-K78815826	BRD-K78815826-001-04-7	MicroSource Discovery Systems Inc.	1501157			CCCCC1(COC(=O)CCC(O)=O)C(=O)N(N(C1=O)c1ccccc1)c1ccccc1	InChI=1S/C24H26N2O6/c1-2-3-16-24(17-32-21(29)15-14-20(27)28)22(30)25(18-10-6-4-7-11-18)26(23(24)31)19-12-8-5-9-13-19/h4-13H,2-3,14-17H2,1H3,(H,27,28)	ONWXNHPOAGOMTG-UHFFFAOYSA-N	438.179086572							32173
(3S,11bs)-Tetrabenazine	LSM-4151	Tetrabenazine, (3s,11bs)-Tetrabenazine	11634155	InChI=1S/C19H27NO3/c1-12(2)7-14-11-20-6-5-13-8-18(22-3)19(23-4)9-15(13)16(20)10-17(14)21/h8-9,12,14,16H,5-7,10-11H2,1-4H3/t14-,16-/m0/s1	MKJIEFSOBYUXJB-HOCLYGCPSA-N	COc1cc2CCN3C[C@H](CC(C)C)C(=O)C[C@H]3c2cc1OC	BroadT	BRD-K95739795	BRD-K95739795-001-01-1	Tocris Bioscience	2175	1		COc1cc2CCN3C[C@H](CC(C)C)C(=O)C[C@H]3c2cc1OC	InChI=1S/C19H27NO3/c1-12(2)7-14-11-20-6-5-13-8-18(22-3)19(23-4)9-15(13)16(20)10-17(14)21/h8-9,12,14,16H,5-7,10-11H2,1-4H3/t14-,16-/m0/s1	MKJIEFSOBYUXJB-HOCLYGCPSA-N	317.199093734							64030
Naltrexone	LSM-3962	Vivitrol, Trexan, Trexal, Revia, Naltrexone, Celupan, EN-1639A [AS HYDROCHLORIDE], EN-1639A	5360515	InChI=1S/C20H23NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,15,18,22,24H,1-2,5-10H2/t15-,18+,19+,20-/m1/s1	DQCKKXVULJGBQN-XFWGSAIBSA-N	Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]56[C@@H](Oc1c25)C(=O)CC[C@@]36O	BroadT	BRD-K88172511	BRD-K88172511-310-03-8	Prestwick Chemical Inc.	Prestw-116	D0701-MP04-ST03-200-	O.O.Cl	Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)C(=O)CC[C@@]35O.O.O.Cl	InChI=1S/C20H23NO4.ClH.2H2O/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11;;;/h3-4,11,15,18,22,24H,1-2,5-10H2;1H;2*1H2/t15-,18+,19+,20-;;;/m1.../s1	RMRRPHDKLROLJJ-VNANXUGNSA-N	341.162708226							7465, 7465
CL-976	LSM-6282	CI-976	122327	InChI=1S/C23H39NO4/c1-7-8-9-10-11-12-13-14-15-23(2,3)22(25)24-21-19(27-5)16-18(26-4)17-20(21)28-6/h16-17H,7-15H2,1-6H3,(H,24,25)	WAFNZAURAWBNDZ-UHFFFAOYSA-N	CCCCCCCCCCC(C)(C)C(=O)Nc1c(OC)cc(OC)cc1OC	BroadT	BRD-K88544581	BRD-K88544581-001-01-2	Tocris Bioscience	2227	1		CCCCCCCCCCC(C)(C)C(=O)Nc1c(OC)cc(OC)cc1OC	InChI=1S/C23H39NO4/c1-7-8-9-10-11-12-13-14-15-23(2,3)22(25)24-21-19(27-5)16-18(26-4)17-20(21)28-6/h16-17H,7-15H2,1-6H3,(H,24,25)	WAFNZAURAWBNDZ-UHFFFAOYSA-N	393.287908738							95040
Proparacaine	LSM-3780	Proxymetacaine, Proparacaine, Paracaine, Ophthetic, Ophthaine, Kainair, Alcaine	4935	InChI=1S/C16H26N2O3/c1-4-10-20-15-8-7-13(12-14(15)17)16(19)21-11-9-18(5-2)6-3/h7-8,12H,4-6,9-11,17H2,1-3H3	KCLANYCVBBTKTO-UHFFFAOYSA-N	CCCOc1ccc(cc1N)C(=O)OCCN(CC)CC	BroadT	BRD-K79116891	BRD-K79116891-003-03-7	Prestwick Chemical Inc.	Prestw-959	D0701-MP04-ST03-200-	Cl	CCCOc1ccc(cc1N)C(=O)OCCN(CC)CC.Cl	InChI=1S/C16H26N2O3.ClH/c1-4-10-20-15-8-7-13(12-14(15)17)16(19)21-11-9-18(5-2)6-3;/h7-8,12H,4-6,9-11,17H2,1-3H3;1H	BFUUJUGQJUTPAF-UHFFFAOYSA-N	294.194342712							8485, 8485
Lamotrigine	LSM-4104	Lamictal, Lamotrigine, BW-430C, Lamictal CD, Lamictal ODT, Lamictal XR	3878	InChI=1S/C9H7Cl2N5/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16-15-7/h1-3H,(H4,12,13,14,16)	PYZRQGJRPPTADH-UHFFFAOYSA-N	Nc1nnc(c(N)n1)c2cccc(Cl)c2Cl	BroadT	BRD-K93460210	BRD-K93460210-001-01-3	Sigma-Aldrich	L3791			Nc1nnc(c(N)n1)-c1cccc(Cl)c1Cl	InChI=1S/C9H7Cl2N5/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16-15-7/h1-3H,(H4,12,13,14,16)	PYZRQGJRPPTADH-UHFFFAOYSA-N	255.007850694							6367
3-Hydroxycoumarin	LSM-24960	3-Hydroxycoumarin	13650	InChI=1S/C9H6O3/c10-7-5-6-3-1-2-4-8(6)12-9(7)11/h1-5,10H	MJKVTPMWOKAVMS-UHFFFAOYSA-N	OC1=Cc2ccccc2OC1=O	BroadT	BRD-K92019075	BRD-K92019075-001-02-0	MicroSource Discovery Systems Inc.	211538			Oc1cc2ccccc2oc1=O	InChI=1S/C9H6O3/c10-7-5-6-3-1-2-4-8(6)12-9(7)11/h1-5,10H	MJKVTPMWOKAVMS-UHFFFAOYSA-N	162.031694052							113542
Asaraldehyde	LSM-24961	Asaraldehyde	20525	InChI=1S/C10H12O4/c1-12-8-5-10(14-3)9(13-2)4-7(8)6-11/h4-6H,1-3H3	IAJBQAYHSQIQRE-UHFFFAOYSA-N	COc1cc(OC)c(C=O)cc1OC	BroadT	BRD-K88219015	BRD-K88219015-001-02-5	MicroSource Discovery Systems Inc.	200208			COc1cc(OC)c(C=O)cc1OC	InChI=1S/C10H12O4/c1-12-8-5-10(14-3)9(13-2)4-7(8)6-11/h4-6H,1-3H3	IAJBQAYHSQIQRE-UHFFFAOYSA-N	196.073558864							113543
Kynurenic acid	LSM-24962	BRD-K85872723	3845	InChI=1S/C10H7NO3/c12-9-5-8(10(13)14)11-7-4-2-1-3-6(7)9/h1-5H,(H,11,12)(H,13,14)	HCZHHEIFKROPDY-UHFFFAOYSA-N	OC(=O)c1cc(O)c2ccccc2n1	BroadT	BRD-K85872723	BRD-K85872723-001-02-7	MicroSource Discovery Systems Inc.	1500688			OC(=O)c1cc(O)c2ccccc2n1	InChI=1S/C10H7NO3/c12-9-5-8(10(13)14)11-7-4-2-1-3-6(7)9/h1-5H,(H,11,12)(H,13,14)	HCZHHEIFKROPDY-UHFFFAOYSA-N	189.042593094							18344
Aloisine A	LSM-4110	Aloisine, Aloisine A	5326843	InChI=1S/C16H17N3O/c1-2-3-4-13-14(11-5-7-12(20)8-6-11)19-16-15(13)17-9-10-18-16/h5-10,20H,2-4H2,1H3,(H,18,19)	PRIGRJPRGZCFAS-UHFFFAOYSA-N	CCCCc1c([nH]c2nccnc12)c3ccc(O)cc3	BroadT	BRD-K93658967	BRD-K93658967-001-01-7	Calbiochem	128125			CCCCc1c([nH]c2nccnc12)-c1ccc(O)cc1	InChI=1S/C16H17N3O/c1-2-3-4-13-14(11-5-7-12(20)8-6-11)19-16-15(13)17-9-10-18-16/h5-10,20H,2-4H2,1H3,(H,18,19)	PRIGRJPRGZCFAS-UHFFFAOYSA-N	267.137162194							
RO-194603	LSM-3815	RO-19-4605, RO 19-4603, RO-194603	127382	InChI=1S/C15H17N3O3S/c1-15(2,3)21-14(20)11-10-7-17(4)13(19)12-9(5-6-22-12)18(10)8-16-11/h5-6,8H,7H2,1-4H3	ZIGMMUKDYCABPW-UHFFFAOYSA-N	CN1Cc2c(ncn2c3ccsc3C1=O)C(=O)OC(C)(C)C	BroadT	BRD-K80778372	BRD-K80778372-001-01-7	Tocris Bioscience	1995	1		CN1Cc2c(ncn2-c2ccsc2C1=O)C(=O)OC(C)(C)C	InChI=1S/C15H17N3O3S/c1-15(2,3)21-14(20)11-10-7-17(4)13(19)12-9(5-6-22-12)18(10)8-16-11/h5-6,8H,7H2,1-4H3	ZIGMMUKDYCABPW-UHFFFAOYSA-N	319.099062124							34952
Nicorandil	LSM-6009	Nicorandil, SG-75	47528	InChI=1S/C8H9N3O4/c12-8(7-2-1-3-9-6-7)10-4-5-15-11(13)14/h1-3,6H,4-5H2,(H,10,12)	LBHIOVVIQHSOQN-UHFFFAOYSA-N	[O-][N+](=O)OCCNC(=O)c1cccnc1	BroadT	BRD-K97752965	BRD-K97752965-001-01-6	Prestwick Chemical Inc.	Prestw-106	D0701-MP04-ST03-200-		[O-][N+](=O)OCCNC(=O)c1cccnc1	InChI=1S/C8H9N3O4/c12-8(7-2-1-3-9-6-7)10-4-5-15-11(13)14/h1-3,6H,4-5H2,(H,10,12)	LBHIOVVIQHSOQN-UHFFFAOYSA-N	211.059305798							31905
5-Nitro-2-phenylpropylaminobenzoic acid [nppb]	LSM-24963	SID124880885, SID11113585, SID11111539	4549	InChI=1S/C16H16N2O4/c19-16(20)14-11-13(18(21)22)8-9-15(14)17-10-4-7-12-5-2-1-3-6-12/h1-3,5-6,8-9,11,17H,4,7,10H2,(H,19,20)	WBSMIPAMAXNXFS-UHFFFAOYSA-N	OC(=O)c1cc(ccc1NCCCc2ccccc2)[N+](=O)[O-]	BroadT	BRD-K89272762	BRD-K89272762-001-04-4	Biomol International Inc.	CM-100	2840(V2)-3-N1305		OC(=O)c1cc(ccc1NCCCc1ccccc1)[N+]([O-])=O	InChI=1S/C16H16N2O4/c19-16(20)14-11-13(18(21)22)8-9-15(14)17-10-4-7-12-5-2-1-3-6-12/h1-3,5-6,8-9,11,17H,4,7,10H2,(H,19,20)	WBSMIPAMAXNXFS-UHFFFAOYSA-N	300.111007012							34457
Caffeic Acid Phenethyl Ester	LSM-43033	Phenethyl 3-(3,4-Dihydroxyphenyl)Acrylate, Caffeic-Acid-Phenethyl-Ester, Caffeic Acid Phenethylester, Caffeic Acid Phenethyl Ester, Phenethyl Caffeate, Trans-Caffeic Acid Phenethyl Ester	5281787	InChI=1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-7+	SWUARLUWKZWEBQ-VQHVLOKHSA-N	Oc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1O	BroadT	BRD-K96188950	BRD-K96188950-001-04-5	Biomol International Inc.	FR102	2840(V2)-3-N1305		Oc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1O	InChI=1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-7+	SWUARLUWKZWEBQ-VQHVLOKHSA-N	284.104858992							8062
Amiloride	LSM-4194	Midamor, Amiloride, Hydro-Ride	16231	InChI=1S/C6H8ClN7O/c7-2-4(9)13-3(8)1(12-2)5(15)14-6(10)11/h(H4,8,9,13)(H4,10,11,14,15)	XSDQTOBWRPYKKA-UHFFFAOYSA-N	NC(=N)NC(=O)c1nc(Cl)c(N)nc1N	BroadT	BRD-K97181089	BRD-K97181089-001-02-7	Biomol International Inc.	CA-200	2840(V2)-3-N1305		NC(=N)NC(=O)c1nc(Cl)c(N)nc1N	InChI=1S/C6H8ClN7O/c7-2-4(9)13-3(8)1(12-2)5(15)14-6(10)11/h(H4,8,9,13)(H4,10,11,14,15)	XSDQTOBWRPYKKA-UHFFFAOYSA-N	229.047885656							2639, 2639, 2639, 2639
Pinosylvin	LSM-44081	Pinosylvin	5280457	InChI=1S/C14H12O2/c15-13-8-12(9-14(16)10-13)7-6-11-4-2-1-3-5-11/h1-10,15-16H/b7-6+	YCVPRTHEGLPYPB-VOTSOKGWSA-N	Oc1cc(O)cc(\C=C\c2ccccc2)c1	BroadT	BRD-K94645280	BRD-K94645280-001-02-1	MicroSource Discovery Systems Inc.	201066			Oc1cc(O)cc(c1)\C=C\c1ccccc1	InChI=1S/C14H12O2/c15-13-8-12(9-14(16)10-13)7-6-11-4-2-1-3-5-11/h1-10,15-16H/b7-6+	YCVPRTHEGLPYPB-VOTSOKGWSA-N	212.083729624							17323
EXO-1	LSM-3769	Methyl 2-(4-Fluorobenzamido)Benzoate	310557	InChI=1S/C15H12FNO3/c1-20-15(19)12-4-2-3-5-13(12)17-14(18)10-6-8-11(16)9-7-10/h2-9H,1H3,(H,17,18)	KIAPWMKFHIKQOZ-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)c2ccc(F)cc2	BroadT	BRD-K78633253	BRD-K78633253-001-01-2	EMD Biosciences	341220			COC(=O)c1ccccc1NC(=O)c1ccc(F)cc1	InChI=1S/C15H12FNO3/c1-20-15(19)12-4-2-3-5-13(12)17-14(18)10-6-8-11(16)9-7-10/h2-9H,1H3,(H,17,18)	KIAPWMKFHIKQOZ-UHFFFAOYSA-N	273.080121454							93386
Obliquin	LSM-24965		6708593	InChI=1S/C14H12O4/c1-8(2)13-7-16-11-6-10-9(5-12(11)17-13)3-4-14(15)18-10/h3-6,13H,1,7H2,2H3/t13-/m1/s1	DUECABXXAMFFBH-CYBMUJFWSA-N	CC(=C)[C@H]1COc2cc3OC(=O)C=Cc3cc2O1	BroadT	BRD-K88954184	BRD-K88954184-001-02-2	MicroSource Discovery Systems Inc.	100540			CC(=C)[C@H]1COc2cc3oc(=O)ccc3cc2O1	InChI=1S/C14H12O4/c1-8(2)13-7-16-11-6-10-9(5-12(11)17-13)3-4-14(15)18-10/h3-6,13H,1,7H2,2H3/t13-/m1/s1	DUECABXXAMFFBH-CYBMUJFWSA-N	244.073558864							113544
Cuneatin Methyl Ether	LSM-3996	Cuneatin, SID470694	343083	InChI=1S/C18H14O6/c1-20-10-3-4-11-15(5-10)22-8-13(18(11)19)12-6-16-17(24-9-23-16)7-14(12)21-2/h3-8H,9H2,1-2H3	MSPWKPQQHHCXLR-UHFFFAOYSA-N	COc1ccc2C(=O)C(=COc2c1)c3cc4OCOc4cc3OC	BroadT	BRD-K89225759	BRD-K89225759-001-02-1	MicroSource Discovery Systems Inc.	210556			COc1ccc2c(c1)occ(-c1cc3OCOc3cc1OC)c2=O	InChI=1S/C18H14O6/c1-20-10-3-4-11-15(5-10)22-8-13(18(11)19)12-6-16-17(24-9-23-16)7-14(12)21-2/h3-8H,9H2,1-2H3	MSPWKPQQHHCXLR-UHFFFAOYSA-N	326.079038168							93558
Angolensin (R)	LSM-24966		821428	InChI=1S/C16H16O4/c1-10(11-3-6-13(20-2)7-4-11)16(19)14-8-5-12(17)9-15(14)18/h3-10,17-18H,1-2H3/t10-/m1/s1	CCOJFDRSZSSKOG-SNVBAGLBSA-N	COc1ccc(cc1)[C@@H](C)C(=O)c2ccc(O)cc2O	BroadT	BRD-K98281970	BRD-K98281970-001-02-6	MicroSource Discovery Systems Inc.	100616			COc1ccc(cc1)[C@@H](C)C(=O)c1ccc(O)cc1O	InChI=1S/C16H16O4/c1-10(11-3-6-13(20-2)7-4-11)16(19)14-8-5-12(17)9-15(14)18/h3-10,17-18H,1-2H3/t10-/m1/s1	CCOJFDRSZSSKOG-SNVBAGLBSA-N	272.104858992							113545
Zomepirac	LSM-6673	Zomepirac	5733	InChI=1S/C15H14ClNO3/c1-9-7-12(8-13(18)19)17(2)14(9)15(20)10-3-5-11(16)6-4-10/h3-7H,8H2,1-2H3,(H,18,19)	ZXVNMYWKKDOREA-UHFFFAOYSA-N	Cc1cc(CC(=O)O)n(C)c1C(=O)c2ccc(Cl)cc2	BroadT	BRD-K81326768	BRD-K81326768-001-02-4	MicroSource Discovery Systems Inc.	1500615			Cc1cc(CC(O)=O)n(C)c1C(=O)c1ccc(Cl)cc1	InChI=1S/C15H14ClNO3/c1-9-7-12(8-13(18)19)17(2)14(9)15(20)10-3-5-11(16)6-4-10/h3-7H,8H2,1-2H3,(H,18,19)	ZXVNMYWKKDOREA-UHFFFAOYSA-N	291.066221028							35859, 35859
Resveratrol	LSM-42917	501-36-0, 3,5,4'-Trihydroxy-Trans-Stilbene, Resveratrol, (E)-Resveratrol	445154	InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+	LUKBXSAWLPMMSZ-OWOJBTEDSA-N	Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1	BroadT	BRD-K80738081	BRD-K80738081-001-06-2	Biomol International Inc.	FR-104	2840(V2)-3-N1305		Oc1ccc(cc1)\C=C\c1cc(O)cc(O)c1	InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+	LUKBXSAWLPMMSZ-OWOJBTEDSA-N	228.078644244							45713
Zamifenacin	LSM-3811	Zamifenacin, UK-766542 [AS FUMARATE]	3086618	InChI=1S/C27H29NO3/c1-3-8-22(9-4-1)27(23-10-5-2-6-11-23)31-24-12-7-16-28(19-24)17-15-21-13-14-25-26(18-21)30-20-29-25/h1-6,8-11,13-14,18,24,27H,7,12,15-17,19-20H2/t24-/m1/s1	BDNFQGRSKSQXRI-XMMPIXPASA-N	C(Cc1ccc2OCOc2c1)N3CCC[C@H](C3)OC(c4ccccc4)c5ccccc5	BroadT	BRD-K80451230	BRD-K80451230-051-01-8	Tocris Bioscience	2579	1	OC(=O)/C=C/C(=O)O	C(Cc1ccc2OCOc2c1)N1CCC[C@H](C1)OC(c1ccccc1)c1ccccc1.OC(=O)/C=C/C(=O)O	InChI=1S/C27H29NO3.C4H4O4/c1-3-8-22(9-4-1)27(23-10-5-2-6-11-23)31-24-12-7-16-28(19-24)17-15-21-13-14-25-26(18-21)30-20-29-25;5-3(6)1-2-4(7)8/h1-6,8-11,13-14,18,24,27H,7,12,15-17,19-20H2;1-2H,(H,5,6)(H,7,8)/b;2-1+/t24-;/m1./s1	PMHKTAIGYOVZEZ-ZHWJIHCSSA-N	415.214743798							93417
Indirubin Sulfate	LSM-44082		5289419	InChI=1S/C13H11N3O2/c1-18-9-2-3-12-10(5-9)11(13(17)16-12)4-8-6-14-7-15-8/h2-7H,1H3,(H,14,15)(H,16,17)/b11-4-	QNUKRWAIZMBVCU-WCIBSUBMSA-N	COc1ccc2NC(=O)\C(=C/c3c[nH]cn3)\c2c1	BroadT	BRD-K94883909	BRD-K94883909-001-01-1	Calbiochem	572650			COc1ccc2NC(=O)\C(=C/c3c[nH]cn3)c2c1	InChI=1S/C13H11N3O2/c1-18-9-2-3-12-10(5-9)11(13(17)16-12)4-8-6-14-7-15-8/h2-7H,1H3,(H,14,15)(H,16,17)/b11-4-	QNUKRWAIZMBVCU-WCIBSUBMSA-N	241.085126622							
Haematoxylone, Tetramethyl-	LSM-3804	Tetramethyl-Haematoxylone	4309557	InChI=1S/C20H20O7/c1-23-15-6-5-13-18(22)14-9-17(25-3)16(24-2)8-11(14)7-12(21)10-27-19(13)20(15)26-4/h5-6,8-9H,7,10H2,1-4H3	OAQFLNPTAZZENS-UHFFFAOYSA-N	COc1cc2CC(=O)COc3c(OC)c(OC)ccc3C(=O)c2cc1OC	BroadT	BRD-K80307267	BRD-K80307267-001-02-1	MicroSource Discovery Systems Inc.	201133			COc1ccc2c(OCC(=O)Cc3cc(OC)c(OC)cc3C2=O)c1OC	InChI=1S/C20H20O7/c1-23-15-6-5-13-18(22)14-9-17(25-3)16(24-2)8-11(14)7-12(21)10-27-19(13)20(15)26-4/h5-6,8-9H,7,10H2,1-4H3	OAQFLNPTAZZENS-UHFFFAOYSA-N	372.12090298							93413
Alverine	LSM-3988	Alverine	3678	InChI=1S/C20H27N/c1-2-21(17-9-15-19-11-5-3-6-12-19)18-10-16-20-13-7-4-8-14-20/h3-8,11-14H,2,9-10,15-18H2,1H3	ZPFXAOWNKLFJDN-UHFFFAOYSA-N	CCN(CCCc1ccccc1)CCCc2ccccc2	BroadT	BRD-K89055274	BRD-K89055274-048-03-7	MicroSource Discovery Systems Inc.	1500109		OC(=O)CC(O)(CC(=O)O)C(=O)O	CCN(CCCc1ccccc1)CCCc1ccccc1.OC(=O)CC(O)(CC(=O)O)C(=O)O	InChI=1S/C20H27N.C6H8O7/c1-2-21(17-9-15-19-11-5-3-6-12-19)18-10-16-20-13-7-4-8-14-20;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-8,11-14H,2,9-10,15-18H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)	RYHCACJBKCOBTJ-UHFFFAOYSA-N	281.214349874							518413, 518413
FK888	LSM-3876	FK-888, SID29215537	107967	InChI=1S/C36H36N4O4/c1-38-23-30(29-14-8-9-15-32(29)38)35(43)40-22-28(41)20-33(40)34(42)37-31(36(44)39(2)21-24-10-4-3-5-11-24)19-25-16-17-26-12-6-7-13-27(26)18-25/h3-18,23,28,31,33,41H,19-22H2,1-2H3,(H,37,42)/t28-,31+,33+/m1/s1	BFNKQTIJVFGCKQ-PDJGWCFMSA-N	CN(Cc1ccccc1)C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H]4C[C@@H](O)CN4C(=O)c5cn(C)c6ccccc56	BroadT	BRD-K83508485	BRD-K83508485-001-01-9	Tocris Bioscience	2400	1		CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1cn(C)c2ccccc12	InChI=1S/C36H36N4O4/c1-38-23-30(29-14-8-9-15-32(29)38)35(43)40-22-28(41)20-33(40)34(42)37-31(36(44)39(2)21-24-10-4-3-5-11-24)19-25-16-17-26-12-6-7-13-27(26)18-25/h3-18,23,28,31,33,41H,19-22H2,1-2H3,(H,37,42)/t28-,31+,33+/m1/s1	BFNKQTIJVFGCKQ-PDJGWCFMSA-N	588.273655672							93463
BIO2_000376	LSM-4164	Cyclo-[Arg-Gly-Asp-D-Phe-Val]	6610347	InChI=1S/C26H38N8O7/c1-14(2)21-25(41)32-16(9-6-10-29-26(27)28)22(38)30-13-19(35)31-18(12-20(36)37)23(39)33-17(24(40)34-21)11-15-7-4-3-5-8-15/h3-5,7-8,14,16-18,21H,6,9-13H2,1-2H3,(H,30,38)(H,31,35)(H,32,41)(H,33,39)(H,34,40)(H,36,37)(H4,27,28,29)/t16-,17-,18+,21-/m0/s1	YYQUWEHEBOMRPH-UGNRZPKXSA-N	CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC1=O	BroadT	BRD-K95992530	BRD-K95992530-001-02-4	Biomol International Inc.	AM-100	2840(V2)-3-N1305		CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(O)=O)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC1=O	InChI=1S/C26H38N8O7/c1-14(2)21-25(41)32-16(9-6-10-29-26(27)28)22(38)30-13-19(35)31-18(12-20(36)37)23(39)33-17(24(40)34-21)11-15-7-4-3-5-8-15/h3-5,7-8,14,16-18,21H,6,9-13H2,1-2H3,(H,30,38)(H,31,35)(H,32,41)(H,33,39)(H,34,40)(H,36,37)(H4,27,28,29)/t16-,17-,18+,21-/m0/s1	YYQUWEHEBOMRPH-UGNRZPKXSA-N	574.286345636							93685
Chlorzoxazone	LSM-6011		2733	InChI=1S/C7H4ClNO2/c8-4-1-2-6-5(3-4)9-7(10)11-6/h1-3H,(H,9,10)	TZFWDZFKRBELIQ-UHFFFAOYSA-N	Oc1oc2ccc(Cl)cc2n1	BroadT	BRD-K98174813	BRD-K98174813-001-05-7	Prestwick Chemical Inc.	Prestw-163	D0701-MP04-ST03-200-		Clc1ccc2oc(=O)[nH]c2c1	InChI=1S/C7H4ClNO2/c8-4-1-2-6-5(3-4)9-7(10)11-6/h1-3H,(H,9,10)	TZFWDZFKRBELIQ-UHFFFAOYSA-N	168.993056088							3655
Metameconine	LSM-24968	SID26749593	230460	InChI=1S/C10H10O4/c1-12-8-3-6-5-14-10(11)7(6)4-9(8)13-2/h3-4H,5H2,1-2H3	UKFAWRZYFYOXEG-UHFFFAOYSA-N	COc1cc2COC(=O)c2cc1OC	BroadT	BRD-K94324294	BRD-K94324294-001-02-7	MicroSource Discovery Systems Inc.	300062			COc1cc2COC(=O)c2cc1OC	InChI=1S/C10H10O4/c1-12-8-3-6-5-14-10(11)7(6)4-9(8)13-2/h3-4H,5H2,1-2H3	UKFAWRZYFYOXEG-UHFFFAOYSA-N	194.0579088							113547
Probenecid	LSM-4140	Probenecid, Probecid, Probampicin, Probalan, Benemid	4911	InChI=1S/C13H19NO4S/c1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,16)	DBABZHXKTCFAPX-UHFFFAOYSA-N	CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O	BroadT	BRD-K95237249	BRD-K95237249-001-04-2	MicroSource Discovery Systems Inc.	1500502			CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(O)=O	InChI=1S/C13H19NO4S/c1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,16)	DBABZHXKTCFAPX-UHFFFAOYSA-N	285.103478788							8426
17-Phenyl-trinor-pge2	LSM-44083	SID26754835, BRD-K90214371	5283068	InChI=1S/C23H30O5/c24-18(13-12-17-8-4-3-5-9-17)14-15-20-19(21(25)16-22(20)26)10-6-1-2-7-11-23(27)28/h1,3-6,8-9,14-15,18-20,22,24,26H,2,7,10-13,16H2,(H,27,28)/b6-1-,15-14+/t18-,19+,20+,22+/m0/s1	FOBVMYJQWZOGGJ-XYRJXBATSA-N	O[C@@H](CCc1ccccc1)\C=C\[C@H]2[C@H](O)CC(=O)[C@@H]2C\C=C/CCCC(=O)O	BroadT	BRD-K90214371	BRD-K90214371-001-02-0	Biomol International Inc.	PG-042	2840(V2)-3-N1305		O[C@@H](CCc1ccccc1)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O	InChI=1S/C23H30O5/c24-18(13-12-17-8-4-3-5-9-17)14-15-20-19(21(25)16-22(20)26)10-6-1-2-7-11-23(27)28/h1,3-6,8-9,14-15,18-20,22,24,26H,2,7,10-13,16H2,(H,27,28)/b6-1-,15-14+/t18-,19+,20+,22+/m0/s1	FOBVMYJQWZOGGJ-XYRJXBATSA-N	386.20932406							87820
5-Carboxamidotryptamine	LSM-24970	5-Carboxamidotryptamine, BRD-K92382976	1809	InChI=1S/C11H13N3O/c12-4-3-8-6-14-10-2-1-7(11(13)15)5-9(8)10/h1-2,5-6,14H,3-4,12H2,(H2,13,15)	WKZLNEWVIAGNAW-UHFFFAOYSA-N	NCCc1c[nH]c2ccc(cc12)C(=O)N	BroadT	BRD-K92382976	BRD-K92382976-001-01-4	Biomol International Inc.	AC-527	2813-N1283		NCCc1c[nH]c2ccc(cc12)C(N)=O	InChI=1S/C11H13N3O/c12-4-3-8-6-14-10-2-1-7(11(13)15)5-9(8)10/h1-2,5-6,14H,3-4,12H2,(H2,13,15)	WKZLNEWVIAGNAW-UHFFFAOYSA-N	203.105862066							48292, 48292, 48292
Periciazine	LSM-24971	Periciazine, Pericyazine, Propericiazine, RP-8909, SKF-20716	4747	InChI=1S/C21H23N3OS/c22-15-16-6-7-21-19(14-16)24(18-4-1-2-5-20(18)26-21)11-3-10-23-12-8-17(25)9-13-23/h1-2,4-7,14,17,25H,3,8-13H2	LUALIOATIOESLM-UHFFFAOYSA-N	OC1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C#N)CC1	BroadT	BRD-K89669299	BRD-K89669299-001-02-7	MicroSource Discovery Systems Inc.	1503936			OC1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C#N)CC1	InChI=1S/C21H23N3OS/c22-15-16-6-7-21-19(14-16)24(18-4-1-2-5-20(18)26-21)11-3-10-23-12-8-17(25)9-13-23/h1-2,4-7,14,17,25H,3,8-13H2	LUALIOATIOESLM-UHFFFAOYSA-N	365.156183076							31981
RO10-5824	LSM-3796	RO-10-5824	16759175	InChI=1S/C17H20N4/c1-13-19-11-16(17(18)20-13)12-21-9-7-15(8-10-21)14-5-3-2-4-6-14/h2-7,11H,8-10,12H2,1H3,(H2,18,19,20)	KABDATZAOUSYES-UHFFFAOYSA-N	Cc1ncc(CN2CCC(=CC2)c3ccccc3)c(N)n1	BroadT	BRD-K79684402	BRD-K79684402-300-01-0	Tocris Bioscience	2329	2	Cl.Cl	Cc1ncc(CN2CCC(=CC2)c2ccccc2)c(N)n1.Cl.Cl	InChI=1S/C17H20N4.2ClH/c1-13-19-11-16(17(18)20-13)12-21-9-7-15(8-10-21)14-5-3-2-4-6-14;;/h2-7,11H,8-10,12H2,1H3,(H2,18,19,20);2*1H	UZHMRJRDYCRKIZ-UHFFFAOYSA-N	280.16879668							93407, 93407
RS504393	LSM-3952	RS-504393, SID50112894	9953769	InChI=1S/C25H27N3O3/c1-17-8-9-22-20(16-17)25(31-24(29)27-22)11-14-28(15-12-25)13-10-21-18(2)30-23(26-21)19-6-4-3-5-7-19/h3-9,16H,10-15H2,1-2H3,(H,27,29)	ODNICNWASXKNNQ-UHFFFAOYSA-N	Cc1ccc2NC(=O)OC3(CCN(CCc4nc(oc4C)c5ccccc5)CC3)c2c1	BroadT	BRD-K87510569	BRD-K87510569-001-01-0	Tocris Bioscience	2517	1		Cc1oc(nc1CCN1CCC2(CC1)OC(=O)Nc1ccc(C)cc21)-c1ccccc1	InChI=1S/C25H27N3O3/c1-17-8-9-22-20(16-17)25(31-24(29)27-22)11-14-28(15-12-25)13-10-21-18(2)30-23(26-21)19-6-4-3-5-7-19/h3-9,16H,10-15H2,1-2H3,(H,27,29)	ODNICNWASXKNNQ-UHFFFAOYSA-N	417.205241754							93525
Liothyronine	LSM-3991	Triostat, Tertroxin, Rathyronine, Liothyronine, Cytomel, Triiodothyronine (T3 Or Liothyronine, Active) (6-11%), Thyrolar-5, Thyrolar-3, Thyrolar-2, Thyrolar-1, Thyrolar-0.5, Thyrolar-0.25, T3 (LIOTRIX), Euthroid-3, Euthroid-2, Euthroid-1, Euthroid-0.5	5920	InChI=1S/C15H12I3NO4/c16-9-6-8(1-2-13(9)20)23-14-10(17)3-7(4-11(14)18)5-12(19)15(21)22/h1-4,6,12,20H,5,19H2,(H,21,22)/t12-/m0/s1	AUYYCJSJGJYCDS-LBPRGKRZSA-N	N[C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O	BroadT	BRD-K89152108	BRD-K89152108-001-03-3	Prestwick Chemical Inc.	Prestw-853	D0701-MP04-ST03-200-		N[C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(O)=O	InChI=1S/C15H12I3NO4/c16-9-6-8(1-2-13(9)20)23-14-10(17)3-7(4-11(14)18)5-12(19)15(21)22/h1-4,6,12,20H,5,19H2,(H,21,22)/t12-/m0/s1	AUYYCJSJGJYCDS-LBPRGKRZSA-N	650.790036874							18258, 18258, 18258, 533015, 533015, 533015, 533015, 533015, 18258, 18258
Etofylline	LSM-5892	Oxyphylline, Oxyethyltheophylline, Etofylline, Beta-Hydroxyethyl Theophylline	1892	InChI=1S/C9H12N4O3/c1-11-7-6(8(15)12(2)9(11)16)13(3-4-14)5-10-7/h5,14H,3-4H2,1-2H3	NWPRCRWQMGIBOT-UHFFFAOYSA-N	CN1C(=O)N(C)c2ncn(CCO)c2C1=O	BroadT	BRD-K83064458	BRD-K83064458-001-04-0	MicroSource Discovery Systems Inc.	2300357			Cn1c2ncn(CCO)c2c(=O)n(C)c1=O	InChI=1S/C9H12N4O3/c1-11-7-6(8(15)12(2)9(11)16)13(3-4-14)5-10-7/h5,14H,3-4H2,1-2H3	NWPRCRWQMGIBOT-UHFFFAOYSA-N	224.090940284							94764
Pirfenidone	LSM-4190	Pirfenidone, AMR-69	40632	InChI=1S/C12H11NO/c1-10-7-8-12(14)13(9-10)11-5-3-2-4-6-11/h2-9H,1H3	ISWRGOKTTBVCFA-UHFFFAOYSA-N	CC1=CN(C(=O)C=C1)c2ccccc2	BroadT	BRD-K96862998	BRD-K96862998-001-03-1	Tocris Bioscience	1093	2		Cc1ccc(=O)n(c1)-c1ccccc1	InChI=1S/C12H11NO/c1-10-7-8-12(14)13(9-10)11-5-3-2-4-6-11/h2-9H,1H3	ISWRGOKTTBVCFA-UHFFFAOYSA-N	185.084063982							32016
Meadacid	LSM-43045	SID26754930, Mead-Acid	5312531	InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10,12-13,15-16H,2-8,11,14,17-19H2,1H3,(H,21,22)/b10-9-,13-12-,16-15-	UNSRRHDPHVZAHH-YOILPLPUSA-N	CCCCCCCC\C=C/C\C=C/C\C=C/CCCC(=O)O	BroadT	BRD-K96144918	BRD-K96144918-001-02-3	Biomol International Inc.	FA004	2840(V2)-3-N1305		CCCCCCCC\C=C/C\C=C/C\C=C/CCCC(O)=O	InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10,12-13,15-16H,2-8,11,14,17-19H2,1H3,(H,21,22)/b10-9-,13-12-,16-15-	UNSRRHDPHVZAHH-YOILPLPUSA-N	306.255880328							72865
7,2'-Dimethoxyflavone	LSM-24972		688671	InChI=1S/C17H14O4/c1-19-11-7-8-12-14(18)10-17(21-16(12)9-11)13-5-3-4-6-15(13)20-2/h3-10H,1-2H3	WVWDHKIZBHIGJE-UHFFFAOYSA-N	COc1ccc2C(=O)C=C(Oc2c1)c3ccccc3OC	BroadT	BRD-K90574291	BRD-K90574291-001-02-4	MicroSource Discovery Systems Inc.	1500742			COc1ccc2c(c1)oc(cc2=O)-c1ccccc1OC	InChI=1S/C17H14O4/c1-19-11-7-8-12-14(18)10-17(21-16(12)9-11)13-5-3-4-6-15(13)20-2/h3-10H,1-2H3	WVWDHKIZBHIGJE-UHFFFAOYSA-N	282.089208928							113549
Protopine	LSM-3874	SID11113306, SID26754181	4970	InChI=1S/C20H19NO5/c1-21-5-4-13-7-18-19(25-10-24-18)8-14(13)16(22)6-12-2-3-17-20(15(12)9-21)26-11-23-17/h2-3,7-8H,4-6,9-11H2,1H3	GPTFURBXHJWNHR-UHFFFAOYSA-N	CN1CCc2cc3OCOc3cc2C(=O)Cc4ccc5OCOc5c4C1	BroadT	BRD-K83302049	BRD-K83302049-001-01-6	AnalytiCon Discovery GmbH	NP-014204			CN1CCc2cc3OCOc3cc2C(=O)Cc2ccc3OCOc3c2C1	InChI=1S/C20H19NO5/c1-21-5-4-13-7-18-19(25-10-24-18)8-14(13)16(22)6-12-2-3-17-20(15(12)9-21)26-11-23-17/h2-3,7-8H,4-6,9-11H2,1H3	GPTFURBXHJWNHR-UHFFFAOYSA-N	353.126322718							16415, 16415
Pifithrin MU	LSM-4188	Pifithrin-MU	327653	InChI=1S/C8H7NO2S/c9-12(10,11)7-6-8-4-2-1-3-5-8/h1-5H,(H2,9,10,11)	ZZUZYEMRHCMVTB-UHFFFAOYSA-N	NS(=O)(=O)C#Cc1ccccc1	BroadT	BRD-K96799727	BRD-K96799727-001-01-7	Tocris Bioscience	2653	1		NS(=O)(=O)C#Cc1ccccc1	InChI=1S/C8H7NO2S/c9-12(10,11)7-6-8-4-2-1-3-5-8/h1-5H,(H2,9,10,11)	ZZUZYEMRHCMVTB-UHFFFAOYSA-N	181.019749164							93704
Selegiline	LSM-5920	Zelapar, Selegiline, Eldepryl, Emsam	26757	InChI=1S/C13H17N/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13/h1,5-9,12H,10-11H2,2-3H3/t12-/m1/s1	MEZLKOACVSPNER-GFCCVEGCSA-N	C[C@H](Cc1ccccc1)N(C)CC#C	BroadT	BRD-K86434416	BRD-K86434416-001-02-7	Biomol International Inc.	EI-240	2840(V2)-3-N1305		C[C@H](Cc1ccccc1)N(C)CC#C	InChI=1S/C13H17N/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13/h1,5-9,12H,10-11H2,2-3H3/t12-/m1/s1	MEZLKOACVSPNER-GFCCVEGCSA-N	187.136099554							9086, 9086
Piretanide	LSM-3959	Piretanide, Arlix, S-734118, HOE-118	4849	InChI=1S/C17H18N2O5S/c18-25(22,23)15-11-12(17(20)21)10-14(19-8-4-5-9-19)16(15)24-13-6-2-1-3-7-13/h1-3,6-7,10-11H,4-5,8-9H2,(H,20,21)(H2,18,22,23)	UJEWTUDSLQGTOA-UHFFFAOYSA-N	NS(=O)(=O)c1cc(cc(N2CCCC2)c1Oc3ccccc3)C(=O)O	BroadT	BRD-K87990216	BRD-K87990216-001-03-7	Prestwick Chemical Inc.	Prestw-1047	D0701-MP04-ST03-200-		NS(=O)(=O)c1cc(cc(N2CCCC2)c1Oc1ccccc1)C(O)=O	InChI=1S/C17H18N2O5S/c18-25(22,23)15-11-12(17(20)21)10-14(19-8-4-5-9-19)16(15)24-13-6-2-1-3-7-13/h1-3,6-7,10-11H,4-5,8-9H2,(H,20,21)(H2,18,22,23)	UJEWTUDSLQGTOA-UHFFFAOYSA-N	362.093642386							93532
Phentolamine	LSM-4022	Phentolamine	5775	InChI=1S/C17H19N3O/c1-13-5-7-14(8-6-13)20(12-17-18-9-10-19-17)15-3-2-4-16(21)11-15/h2-8,11,21H,9-10,12H2,1H3,(H,18,19)	MRBDMNSDAVCSSF-UHFFFAOYSA-N	Cc1ccc(cc1)N(CC2=NCCN2)c3cccc(O)c3	BroadT	BRD-K90333595	BRD-K90333595-001-02-8	Biomol International Inc.	AC-121	2840(V2)-3-N1305		Cc1ccc(cc1)N(CC1=NCCN1)c1cccc(O)c1	InChI=1S/C17H19N3O/c1-13-5-7-14(8-6-13)20(12-17-18-9-10-19-17)15-3-2-4-16(21)11-15/h2-8,11,21H,9-10,12H2,1H3,(H,18,19)	MRBDMNSDAVCSSF-UHFFFAOYSA-N	281.152812258							8081, 8081, 8081
Carmoxirole	LSM-3850	Carmoxirole	57364	InChI=1S/C24H26N2O2/c27-24(28)20-9-10-23-22(16-20)21(17-25-23)8-4-5-13-26-14-11-19(12-15-26)18-6-2-1-3-7-18/h1-3,6-7,9-11,16-17,25H,4-5,8,12-15H2,(H,27,28)	AFSOIHMEOKEZJF-UHFFFAOYSA-N	OC(=O)c1ccc2[nH]cc(CCCCN3CCC(=CC3)c4ccccc4)c2c1	BroadT	BRD-K82484965	BRD-K82484965-003-02-7	Tocris Bioscience	2193	1	Cl	OC(=O)c1ccc2[nH]cc(CCCCN3CCC(=CC3)c3ccccc3)c2c1.Cl	InChI=1S/C24H26N2O2.ClH/c27-24(28)20-9-10-23-22(16-20)21(17-25-23)8-4-5-13-26-14-11-19(12-15-26)18-6-2-1-3-7-18;/h1-3,6-7,9-11,16-17,25H,4-5,8,12-15H2,(H,27,28);1H	LRJUHOBITQUXIO-UHFFFAOYSA-N	374.199428092							64200, 64200
Melperone	LSM-4090	Flubuperone, Melperone, FG-5111	15387	InChI=1S/C16H22FNO/c1-13-8-11-18(12-9-13)10-2-3-16(19)14-4-6-15(17)7-5-14/h4-7,13H,2-3,8-12H2,1H3	DKMFBWQBDIGMHM-UHFFFAOYSA-N	CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	BroadT	BRD-K92984783	BRD-K92984783-003-02-4	Tocris Bioscience	2495	1	Cl	CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1.Cl	InChI=1S/C16H22FNO.ClH/c1-13-8-11-18(12-9-13)10-2-3-16(19)14-4-6-15(17)7-5-14;/h4-7,13H,2-3,8-12H2,1H3;1H	MQHYXXIJLKFQGY-UHFFFAOYSA-N	263.168542534							93626
Chlorpropamide	LSM-6695	Glucamide, Diabinese, Chlorpropamide	2727	InChI=1S/C10H13ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3,(H2,12,13,14)	RKWGIWYCVPQPMF-UHFFFAOYSA-N	CCCNC(=O)NS(=O)(=O)c1ccc(Cl)cc1	BroadT	BRD-K97746869	BRD-K97746869-001-04-9	MicroSource Discovery Systems Inc.	1500185			CCCNC(=O)NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C10H13ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3,(H2,12,13,14)	RKWGIWYCVPQPMF-UHFFFAOYSA-N	276.033540696							3650
Aniracetam	LSM-3969	Sarpul, Memodrin, Draganon, Aniracetam, Ampamet, RO-135057	2196	InChI=1S/C12H13NO3/c1-16-10-6-4-9(5-7-10)12(15)13-8-2-3-11(13)14/h4-7H,2-3,8H2,1H3	ZXNRTKGTQJPIJK-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)N2CCCC2=O	BroadT	BRD-K88611939	BRD-K88611939-001-01-8	MicroSource Discovery Systems Inc.	1503078			COc1ccc(cc1)C(=O)N1CCCC1=O	InChI=1S/C12H13NO3/c1-16-10-6-4-9(5-7-10)12(15)13-8-2-3-11(13)14/h4-7H,2-3,8H2,1H3	ZXNRTKGTQJPIJK-UHFFFAOYSA-N	219.089543286							47943
1,3,5-Trimethoxybenzene	LSM-24973	SID26749182	69301	InChI=1S/C9H12O3/c1-10-7-4-8(11-2)6-9(5-7)12-3/h4-6H,1-3H3	LKUDPHPHKOZXCD-UHFFFAOYSA-N	COc1cc(OC)cc(OC)c1	BroadT	BRD-K81884069	BRD-K81884069-001-02-8	MicroSource Discovery Systems Inc.	231043			COc1cc(OC)cc(OC)c1	InChI=1S/C9H12O3/c1-10-7-4-8(11-2)6-9(5-7)12-3/h4-6H,1-3H3	LKUDPHPHKOZXCD-UHFFFAOYSA-N	168.078644244							31038
2-Cyano-3-(3,4-dihydroxyphenyl)-n-phenylprop-2-enamide	LSM-2755	AG-494	2055	InChI=1S/C16H12N2O3/c17-10-12(8-11-6-7-14(19)15(20)9-11)16(21)18-13-4-2-1-3-5-13/h1-9,19-20H,(H,18,21)	HKHOVJYOELRGMV-UHFFFAOYSA-N	Oc1ccc(C=C(C#N)C(=O)Nc2ccccc2)cc1O	BroadT	BRD-K81209512	BRD-K81209512-001-01-3	Tocris Bioscience	619	2		Oc1ccc(C=C(C#N)C(=O)Nc2ccccc2)cc1O	InChI=1S/C16H12N2O3/c17-10-12(8-11-6-7-14(19)15(20)9-11)16(21)18-13-4-2-1-3-5-13/h1-9,19-20H,(H,18,21)	HKHOVJYOELRGMV-UHFFFAOYSA-N	280.084792264							92604
Epiafzelechin (2R,3R)(-)	LSM-24974	(-)-Epiafzelechin	443639	InChI=1S/C15H14O5/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15/h1-6,13,15-19H,7H2/t13-,15-/m1/s1	RSYUFYQTACJFML-UKRRQHHQSA-N	O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3ccc(O)cc3	BroadT	BRD-K90607708	BRD-K90607708-001-02-9	MicroSource Discovery Systems Inc.	202178			O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1ccc(O)cc1	InChI=1S/C15H14O5/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15/h1-6,13,15-19H,7H2/t13-,15-/m1/s1	RSYUFYQTACJFML-UKRRQHHQSA-N	274.084123548							31028
Thonzylamine	LSM-15371	Thonzylamine	5457	InChI=1S/C16H22N4O/c1-19(2)11-12-20(16-17-9-4-10-18-16)13-14-5-7-15(21-3)8-6-14/h4-10H,11-13H2,1-3H3	GULNIHOSWFYMRN-UHFFFAOYSA-N	COc1ccc(CN(CCN(C)C)c2ncccn2)cc1	BroadT	BRD-K88405679	BRD-K88405679-003-01-5	MicroSource Discovery Systems Inc.	1503135		Cl	COc1ccc(CN(CCN(C)C)c2ncccn2)cc1.Cl	InChI=1S/C16H22N4O.ClH/c1-19(2)11-12-20(16-17-9-4-10-18-16)13-14-5-7-15(21-3)8-6-14;/h4-10H,11-13H2,1-3H3;1H	HRYJPHOTGFERGT-UHFFFAOYSA-N	286.179361364							104017, 104017
Trequinsin	LSM-3893		5537	InChI=1S/C24H27N3O3/c1-14-9-15(2)23(16(3)10-14)25-22-13-19-18-12-21(30-6)20(29-5)11-17(18)7-8-27(19)24(28)26(22)4/h9-13H,7-8H2,1-6H3	MCMSJVMUSBZUCN-UHFFFAOYSA-N	COc1cc2CCN3C(=O)N(C)C(=Nc4c(C)cc(C)cc4C)C=C3c2cc1OC	BroadT	BRD-K84663978	BRD-K84663978-001-02-3	Biomol International Inc.	PD-180	2840(V2)-3-N1305		COc1cc2CCn3c(c\c(=N/c4c(C)cc(C)cc4C)n(C)c3=O)-c2cc1OC	InChI=1S/C24H27N3O3/c1-14-9-15(2)23(16(3)10-14)25-22-13-19-18-12-21(30-6)20(29-5)11-17(18)7-8-27(19)24(28)26(22)4/h9-13H,7-8H2,1-6H3/b25-22+	MCMSJVMUSBZUCN-YYDJUVGSSA-N	405.205241754							93477, 93477
JAK3 Inhibitor V	LSM-4150	ZM-449829, JAK3-Inhibitor-V	3799	InChI=1S/C13H10O/c1-2-13(14)12-8-7-10-5-3-4-6-11(10)9-12/h2-9H,1H2	FOTCGZPFSUWZBN-UHFFFAOYSA-N	C=CC(=O)c1ccc2ccccc2c1	BroadT	BRD-K95676198	BRD-K95676198-001-02-6	Calbiochem	420122			C=CC(=O)c1ccc2ccccc2c1	InChI=1S/C13H10O/c1-2-13(14)12-8-7-10-5-3-4-6-11(10)9-12/h2-9H,1H2	FOTCGZPFSUWZBN-UHFFFAOYSA-N	182.07316494							93674
GW-9662	LSM-4097	GW9662	644213	InChI=1S/C13H9ClN2O3/c14-12-7-6-10(16(18)19)8-11(12)13(17)15-9-4-2-1-3-5-9/h1-8H,(H,15,17)	DNTSIBUQMRRYIU-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(Cl)c(c1)C(=O)Nc2ccccc2	BroadT	BRD-K93258693	BRD-K93258693-001-02-5	Biomol International Inc.	GR-234	2840(V2)-3-N1305		[O-][N+](=O)c1ccc(Cl)c(c1)C(=O)Nc1ccccc1	InChI=1S/C13H9ClN2O3/c14-12-7-6-10(16(18)19)8-11(12)13(17)15-9-4-2-1-3-5-9/h1-8H,(H,15,17)	DNTSIBUQMRRYIU-UHFFFAOYSA-N	276.030169878							79993
Piperacillin	LSM-5924	Piperacillin	43672	InChI=1S/C23H27N5O7S/c1-4-26-10-11-27(19(32)18(26)31)22(35)25-13(12-8-6-5-7-9-12)16(29)24-14-17(30)28-15(21(33)34)23(2,3)36-20(14)28/h5-9,13-15,20H,4,10-11H2,1-3H3,(H,24,29)(H,25,35)(H,33,34)/t13-,14-,15+,20-/m1/s1	IVBHGBMCVLDMKU-GXNBUGAJSA-N	CCN1CCN(C(=O)N[C@@H](C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O)c4ccccc4)C(=O)C1=O	BroadT	BRD-K86873305	BRD-K86873305-236-03-0	Prestwick Chemical Inc.	Prestw-755	D0701-MP04-ST03-200-	[Na]	CCN1CCN(C(=O)N[C@@H](C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(O)=O)c2ccccc2)C(=O)C1=O.[Na]	InChI=1S/C23H27N5O7S.Na.H/c1-4-26-10-11-27(19(32)18(26)31)22(35)25-13(12-8-6-5-7-9-12)16(29)24-14-17(30)28-15(21(33)34)23(2,3)36-20(14)28;;/h5-9,13-15,20H,4,10-11H2,1-3H3,(H,24,29)(H,25,35)(H,33,34);;/t13-,14-,15+,20-;;/m1../s1	GLMIVASYGREOAM-IGQLWDLSSA-N	517.163118944							8232, 8232
Sildenafil	LSM-3797	Sildenafil, UK-92480	5212	InChI=1S/C22H30N6O4S/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29)	BNRNXUUZRGQAQC-UHFFFAOYSA-N	CCCc1nn(C)c2C(=O)NC(=Nc12)c3cc(ccc3OCC)S(=O)(=O)N4CCN(C)CC4	BroadT	BRD-K79759585	BRD-K79759585-001-02-1	MicroSource Discovery Systems Inc.	1504099			CCCc1nn(C)c2c1nc([nH]c2=O)-c1cc(ccc1OCC)S(=O)(=O)N1CCN(C)CC1	InChI=1S/C22H30N6O4S/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29)	BNRNXUUZRGQAQC-UHFFFAOYSA-N	474.20492419							9139, 9139
3232-36-8	LSM-24975	Salicylaldehyde2-Hydroxybenzoylhydrazone, BRD-K78496197	5357794	InChI=1S/C14H12N2O3/c17-12-7-3-1-5-10(12)9-15-16-14(19)11-6-2-4-8-13(11)18/h1-9,17-18H,(H,16,19)/b15-9+	OMCYEZUIYGPHDJ-OQLLNIDSSA-N	Oc1ccccc1\C=N\NC(=O)c2ccccc2O	BroadT	BRD-K78496197	BRD-K78496197-001-01-3	Harvard University	355948;WT-III-101-I_XC10			Oc1ccccc1\C=N\NC(=O)c1ccccc1O	InChI=1S/C14H12N2O3/c17-12-7-3-1-5-10(12)9-15-16-14(19)11-6-2-4-8-13(11)18/h1-9,17-18H,(H,16,19)/b15-9+	OMCYEZUIYGPHDJ-OQLLNIDSSA-N	256.084792264							
Dipyridamole	LSM-3927	Persantine, Dipyridamole, RA-8, IV Persantine	3108	InChI=1S/C24H40N8O4/c33-15-11-31(12-16-34)23-26-20-19(21(27-23)29-7-3-1-4-8-29)25-24(32(13-17-35)14-18-36)28-22(20)30-9-5-2-6-10-30/h33-36H,1-18H2	IZEKFCXSFNUWAM-UHFFFAOYSA-N	OCCN(CCO)c1nc(N2CCCCC2)c3nc(nc(N4CCCCC4)c3n1)N(CCO)CCO	BroadT	BRD-K86301799	BRD-K86301799-001-14-0	Tocris Bioscience	691	3		OCCN(CCO)c1nc(N2CCCCC2)c2nc(nc(N3CCCCC3)c2n1)N(CCO)CCO	InChI=1S/C24H40N8O4/c33-15-11-31(12-16-34)23-26-20-19(21(27-23)29-7-3-1-4-8-29)25-24(32(13-17-35)14-18-36)28-22(20)30-9-5-2-6-10-30/h33-36H,1-18H2	IZEKFCXSFNUWAM-UHFFFAOYSA-N	504.31725184							4653
KN93	LSM-42804	KN-93	5312122	InChI=1S/C26H29ClN2O4S/c1-28(17-5-6-21-9-11-23(27)12-10-21)20-22-7-3-4-8-26(22)29(18-19-30)34(31,32)25-15-13-24(33-2)14-16-25/h3-16,30H,17-20H2,1-2H3/b6-5+	LLLQTDSSHZREGW-AATRIKPKSA-N	COc1ccc(cc1)S(=O)(=O)N(CCO)c2ccccc2CN(C)C\C=C\c3ccc(Cl)cc3	BroadT	BRD-K93480852	BRD-K93480852-001-02-2	Calbiochem	422708			COc1ccc(cc1)S(=O)(=O)N(CCO)c1ccccc1CN(C)C\C=C\c1ccc(Cl)cc1	InChI=1S/C26H29ClN2O4S/c1-28(17-5-6-21-9-11-23(27)12-10-21)20-22-7-3-4-8-26(22)29(18-19-30)34(31,32)25-15-13-24(33-2)14-16-25/h3-16,30H,17-20H2,1-2H3/b6-5+	LLLQTDSSHZREGW-AATRIKPKSA-N	500.153655828							91460
Anabasine	LSM-15372	SID11112368, SID11114254	205586	InChI=1S/C10H14N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h3-4,6,8,10,12H,1-2,5,7H2/t10-/m0/s1	MTXSIJUGVMTTMU-JTQLQIEISA-N	C1CC[C@H](NC1)c2cccnc2	BroadT	BRD-K94837957	BRD-K94837957-003-01-4	Tocris Bioscience	1971	1	Cl	C1CC[C@H](NC1)c1cccnc1.Cl	InChI=1S/C10H14N2.ClH/c1-2-7-12-10(5-1)9-4-3-6-11-8-9;/h3-4,6,8,10,12H,1-2,5,7H2;1H/t10-;/m0./s1	VTMZQNZVYCJLGG-PPHPATTJSA-N	162.115698468							74, 74
Pteryxin	LSM-44084		5320509	InChI=1S/C21H22O7/c1-6-11(2)20(24)27-18-16-14(28-21(4,5)19(18)25-12(3)22)9-7-13-8-10-15(23)26-17(13)16/h6-10,18-19H,1-5H3/b11-6+/t18-,19-/m1/s1	LYUZYPKZQDYMEE-CCGSVPMNSA-N	C\C=C(/C)\C(=O)O[C@H]1[C@@H](OC(=O)C)C(C)(C)Oc2ccc3C=CC(=O)Oc3c12	BroadT	BRD-K92006759	BRD-K92006759-001-02-0	MicroSource Discovery Systems Inc.	1504160			C\C=C(/C)C(=O)O[C@H]1[C@@H](OC(C)=O)C(C)(C)Oc2ccc3ccc(=O)oc3c12	InChI=1S/C21H22O7/c1-6-11(2)20(24)27-18-16-14(28-21(4,5)19(18)25-12(3)22)9-7-13-8-10-15(23)26-17(13)16/h6-10,18-19H,1-5H3/b11-6+/t18-,19-/m1/s1	LYUZYPKZQDYMEE-CCGSVPMNSA-N	386.136553044							
Chromocarb	LSM-24977	Chromocarb	2741	InChI=1S/C10H6O4/c11-7-5-9(10(12)13)14-8-4-2-1-3-6(7)8/h1-5H,(H,12,13)	RVMGXWBCQGAWBR-UHFFFAOYSA-N	OC(=O)C1=CC(=O)c2ccccc2O1	BroadT	BRD-K94720315	BRD-K94720315-001-01-3	MicroSource Discovery Systems Inc.	1503044			OC(=O)c1cc(=O)c2ccccc2o1	InChI=1S/C10H6O4/c11-7-5-9(10(12)13)14-8-4-2-1-3-6(7)8/h1-5H,(H,12,13)	RVMGXWBCQGAWBR-UHFFFAOYSA-N	190.026608672							113552
W 7	LSM-4021	W-7, SID26751692, SID50104383	5681	InChI=1S/C16H21ClN2O2S/c17-15-9-5-8-14-13(15)7-6-10-16(14)22(20,21)19-12-4-2-1-3-11-18/h5-10,19H,1-4,11-12,18H2	IDEHCMNLNCJQST-UHFFFAOYSA-N	NCCCCCCNS(=O)(=O)c1cccc2c(Cl)cccc12	BroadT	BRD-K90259198	BRD-K90259198-003-04-8	Biomol International Inc.	CA-320	2840(V2)-3-N1305	Cl	NCCCCCCNS(=O)(=O)c1cccc2c(Cl)cccc12.Cl	InChI=1S/C16H21ClN2O2S.ClH/c17-15-9-5-8-14-13(15)7-6-10-16(14)22(20,21)19-12-4-2-1-3-11-18;/h5-10,19H,1-4,11-12,18H2;1H	OMMOSRLIFSCDBL-UHFFFAOYSA-N	340.101226332							, 
NBBCC	LSM-24978	BRD-K87349602	128618	InChI=1S/C16H16N2O2/c1-2-3-8-20-16(19)14-9-12-11-6-4-5-7-13(11)18-15(12)10-17-14/h4-7,9-10,18H,2-3,8H2,1H3	WGNGIELOOKACSB-UHFFFAOYSA-N	CCCCOC(=O)c1cc2c(cn1)[nH]c3ccccc23	BroadT	BRD-K87349602	BRD-K87349602-001-01-2	Biomol International Inc.	AC-196	2819-N1292		CCCCOC(=O)c1cc2c(cn1)[nH]c1ccccc21	InChI=1S/C16H16N2O2/c1-2-3-8-20-16(19)14-9-12-11-6-4-5-7-13(11)18-15(12)10-17-14/h4-7,9-10,18H,2-3,8H2,1H3	WGNGIELOOKACSB-UHFFFAOYSA-N	268.121177772							34867
Ecopipam	LSM-4115	Ecopipam, SCH-39166	107930	InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19+/m0/s1	DMJWENQHWZZWDF-PKOBYXMFSA-N	CN1CCc2cc(Cl)c(O)cc2[C@@H]3[C@@H]1CCc4ccccc34	BroadT	BRD-K94270326	BRD-K94270326-004-01-0	Tocris Bioscience	2299	2	Br	CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1ccccc21.Br	InChI=1S/C19H20ClNO.BrH/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21;/h2-5,10-11,17,19,22H,6-9H2,1H3;1H/t17-,19+;/m0./s1	GAUWIDFICGEZKR-JUOYHRLASA-N	313.12334198							93645, 93645, 93645
EMD-66684	LSM-3977	EMD-66684	9892554	InChI=1S/C28H30N8O2/c1-4-5-10-24-29-23-15-16-35(18-25(37)34(2)3)28(38)26(23)36(24)17-19-11-13-20(14-12-19)21-8-6-7-9-22(21)27-30-32-33-31-27/h6-9,11-16H,4-5,10,17-18H2,1-3H3,(H,30,31,32,33)	CQVJTTOZTTVVBK-UHFFFAOYSA-N	CCCCc1nc2C=CN(CC(=O)N(C)C)C(=O)c2n1Cc3ccc(cc3)c4ccccc4c5nnn[nH]5	BroadT	BRD-K88759641	BRD-K88759641-003-01-0	Tocris Bioscience	1849	1	Cl	CCCCc1nc2ccn(CC(=O)N(C)C)c(=O)c2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1.Cl	InChI=1S/C28H30N8O2.ClH/c1-4-5-10-24-29-23-15-16-35(18-25(37)34(2)3)28(38)26(23)36(24)17-19-11-13-20(14-12-19)21-8-6-7-9-22(21)27-30-32-33-31-27;/h6-9,11-16H,4-5,10,17-18H2,1-3H3,(H,30,31,32,33);1H	YMFXGXGDHBXTPY-UHFFFAOYSA-N	510.24917228							93544, 93544
Carbimazole	LSM-5930	Carbimazole, Athyromazole	31072	InChI=1S/C7H10N2O2S/c1-3-11-7(10)9-5-4-8(2)6(9)12/h4-5H,3H2,1-2H3	CFOYWRHIYXMDOT-UHFFFAOYSA-N	CCOC(=O)N1C=CN(C)C1=S	BroadT	BRD-K87156652	BRD-K87156652-001-05-1	Prestwick Chemical Inc.	Prestw-439	D0701-MP04-ST03-200-		CCOC(=O)n1ccn(C)c1=S	InChI=1S/C7H10N2O2S/c1-3-11-7(10)9-5-4-8(2)6(9)12/h4-5H,3H2,1-2H3	CFOYWRHIYXMDOT-UHFFFAOYSA-N	186.04629827							617099
Pseudoephedrine	LSM-3885	Pseudoephedrine	7028	InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3/t8-,10+/m0/s1	KWGRBVOPPLSCSI-WCBMZHEXSA-N	CN[C@@H](C)[C@@H](O)c1ccccc1	BroadT	BRD-K84175871	BRD-K84175871-003-02-2	MicroSource Discovery Systems Inc.	1500516		Cl	CN[C@@H](C)[C@@H](O)c1ccccc1.Cl	InChI=1S/C10H15NO.ClH/c1-8(11-2)10(12)9-6-4-3-5-7-9;/h3-8,10-12H,1-2H3;1H/t8-,10+;/m0./s1	BALXUFOVQVENIU-KXNXZCPBSA-N	165.11536411							51209, 51209, 51209, 51209
Hydrocortisone	LSM-5980	Hytone, Hydrocortone, Hydrocortisone, Locoid, Nutracort, Ophthocort, Penecort, Proctocort, Synacort, Texacort, Cobadex, Acticort, Cetacort, Colocort, Glycort, Flexicort, Epicort, Eldecort, Dermacort, Cortril, Cortisol, Cortifoam, Cortenema, Cortef, HC #4, HC #1, Hydrocortisone In Absorbase, Hydro-RX, HI-COR, Micort-HC, Neo-Cortef, Nogenic HC, Stie-Cort, Terra-Cortril, U-Cort, Aeroseb-HC, Ala-Cort, Ala-Scalp, Anucort-HC, Anusol HC, Anusol-HC, Balneol-HC, Beta-HC, H-Cort, Cort-Dome, Cor-Oticin	5754	InChI=1S/C21H30O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-16,18,22,24,26H,3-8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1	JYGXADMDTFJGBT-VWUMJDOOSA-N	C[C@]12CCC(=O)C=C1CC[C@H]3[C@@H]4CC[C@](O)(C(=O)CO)[C@@]4(C)C[C@H](O)[C@H]23	BroadT	BRD-K93568044	BRD-K93568044-001-03-1	Prestwick Chemical Inc.	Prestw-447	D0701-MP04-ST03-200-		C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO	InChI=1S/C21H30O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-16,18,22,24,26H,3-8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1	JYGXADMDTFJGBT-VWUMJDOOSA-N	362.20932406							17650, 17650, 17650
Dihydro-Beta-Tubaic acid	LSM-4177	Tubaic-Acid	3548249	InChI=1S/C13H16O4/c1-13(2)7-6-8-10(17-13)5-4-9(12(14)15)11(8)16-3/h4-5H,6-7H2,1-3H3,(H,14,15)	LJMFGBZVIQCIAV-UHFFFAOYSA-N	COc1c2CCC(C)(C)Oc2ccc1C(=O)O	BroadT	BRD-K96362535	BRD-K96362535-001-02-4	MicroSource Discovery Systems Inc.	211531			COc1c2CCC(C)(C)Oc2ccc1C(O)=O	InChI=1S/C13H16O4/c1-13(2)7-6-8-10(17-13)5-4-9(12(14)15)11(8)16-3/h4-5H,6-7H2,1-3H3,(H,14,15)	LJMFGBZVIQCIAV-UHFFFAOYSA-N	236.104858992							93694
Bromperidol	LSM-5849	Bromperidol, R-11333	2448	InChI=1S/C21H23BrFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2	RKLNONIVDFXQRX-UHFFFAOYSA-N	OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c3ccc(Br)cc3	BroadT	BRD-K78643075	BRD-K78643075-001-03-3	Prestwick Chemical Inc.	Prestw-509	D0701-MP04-ST03-200-		OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Br)cc1	InChI=1S/C21H23BrFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2	RKLNONIVDFXQRX-UHFFFAOYSA-N	419.089619786							94747
ST50177349	LSM-3880	Sant-1	1356208	InChI=1S/C23H27N5/c1-19-23(20(2)28(25-19)22-11-7-4-8-12-22)17-24-27-15-13-26(14-16-27)18-21-9-5-3-6-10-21/h3-12,17H,13-16,18H2,1-2H3	FOORCIAZMIWALX-UHFFFAOYSA-N	Cc1nn(c(C)c1C=NN2CCN(Cc3ccccc3)CC2)c4ccccc4	BroadT	BRD-K83637872	BRD-K83637872-001-01-7	Tocris Bioscience	1974	1		Cc1nn(c(C)c1C=NN1CCN(Cc2ccccc2)CC1)-c1ccccc1	InChI=1S/C23H27N5/c1-19-23(20(2)28(25-19)22-11-7-4-8-12-22)17-24-27-15-13-26(14-16-27)18-21-9-5-3-6-10-21/h3-12,17H,13-16,18H2,1-2H3	FOORCIAZMIWALX-UHFFFAOYSA-N	373.226645914							93466
Linoleoylethanolamide	LSM-43037	Linoleoylethanolamide, Anandamide, N-(2-Hydroxyethyl)Linoleoylamide, Linoleamide MEA	5283446	InChI=1S/C20H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h6-7,9-10,22H,2-5,8,11-19H2,1H3,(H,21,23)/b7-6-,10-9-	KQXDGUVSAAQARU-HZJYTTRNSA-N	CCCCC\C=C/C\C=C/CCCCCCCC(=O)NCCO	BroadT	BRD-K87905482	BRD-K87905482-001-02-4	Biomol International Inc.	FA026	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/CCCCCCCC(=O)NCCO	InChI=1S/C20H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h6-7,9-10,22H,2-5,8,11-19H2,1H3,(H,21,23)/b7-6-,10-9-	KQXDGUVSAAQARU-HZJYTTRNSA-N	323.282429434							64032
N6-Methyladenosine	LSM-3835	6-Methylaminopurine Riboside, BRD-K81807412, N6-Methyladenosine	102175	InChI=1S/C11H15N5O4/c1-12-9-6-10(14-3-13-9)16(4-15-6)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11,17-19H,2H2,1H3,(H,12,13,14)/t5-,7-,8-,11-/m1/s1	VQAYFKKCNSOZKM-IOSLPCCCSA-N	CNc1ncnc2c1ncn2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O	BroadT	BRD-K81807412	BRD-K81807412-001-03-1	Prestwick Chemical Inc.	Prestw-338	D0701-MP04-ST03-200-		CNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	InChI=1S/C11H15N5O4/c1-12-9-6-10(14-3-13-9)16(4-15-6)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11,17-19H,2H2,1H3,(H,12,13,14)/t5-,7-,8-,11-/m1/s1	VQAYFKKCNSOZKM-IOSLPCCCSA-N	281.11240401							21891
SRC Kinase Inhibitor II	LSM-4197	SRC-Kinase-Inhibitor-II	1172104	InChI=1S/C22H20N4O3S/c1-13-9-16-11-18(29-3)7-8-19(16)26-21(13)24-25-22(26)30-12-20(28)23-17-6-4-5-15(10-17)14(2)27/h4-11H,12H2,1-3H3,(H,23,28)	YDQTWBQMVSTLRU-UHFFFAOYSA-N	COc1ccc2c(cc(C)c3nnc(SCC(=O)Nc4cccc(c4)C(=O)C)n23)c1	BroadT	BRD-K97330509	BRD-K97330509-001-01-4	Calbiochem	567806			COc1ccc2c(c1)cc(C)c1nnc(SCC(=O)Nc3cccc(c3)C(C)=O)n21	InChI=1S/C22H20N4O3S/c1-13-9-16-11-18(29-3)7-8-19(16)26-21(13)24-25-22(26)30-12-20(28)23-17-6-4-5-15(10-17)14(2)27/h4-11H,12H2,1-3H3,(H,23,28)	YDQTWBQMVSTLRU-UHFFFAOYSA-N	420.12561123							93709
Diphemanil	LSM-4102	Diphemanil, UNII-Q26TX1UD0W	6127	InChI=1S/C20H24N/c1-21(2)15-13-19(14-16-21)20(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12H,13-16H2,1-2H3/q+1	LCTZPQRFOZKZNK-UHFFFAOYSA-N	C[N+]1(C)CCC(=C(c2ccccc2)c3ccccc3)CC1	BroadT	BRD-K93441486	BRD-K93441486-067-03-7	Prestwick Chemical Inc.	Prestw-79	D0701-MP04-ST03-200-	COS(=O)(=O)O	C[N+]1(C)CCC(CC1)=C(c1ccccc1)c1ccccc1.COS(=O)(=O)O	InChI=1S/C20H24N.CH4O4S/c1-21(2)15-13-19(14-16-21)20(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-5-6(2,3)4/h3-12H,13-16H2,1-2H3;1H3,(H,2,3,4)/q+1;	BREMLQBSKCSNNH-UHFFFAOYSA-N	278.190874778							93636, 93636
Pyrrolidine Dithiocarbamate	LSM-3818	Pyrrolidinedithiocarbamate, Pyrrolidine-1-Carbodithioic Acid, Pyrrolidine-Dithiocarbamate, Pyrrolidine Dithiocarbamate	65351	InChI=1S/C5H9NS2/c7-5(8)6-3-1-2-4-6/h1-4H2,(H,7,8)	VSWDORGPIHIGNW-UHFFFAOYSA-N	SC(=S)N1CCCC1	BroadT	BRD-K80970344	BRD-K80970344-201-02-9	Tocris Bioscience	727	1	N	SC(=S)N1CCCC1.N	InChI=1S/C5H9NS2.H3N/c7-5(8)6-3-1-2-4-6;/h1-4H2,(H,7,8);1H3	MDDIUTVUBYEEEM-UHFFFAOYSA-N	147.017640678							78782, 78782, 78782
Pyrilamine	LSM-4206	Mepyramine, Pyrilamine	4992	InChI=1S/C17H23N3O/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15/h4-11H,12-14H2,1-3H3	YECBIJXISLIIDS-UHFFFAOYSA-N	COc1ccc(CN(CCN(C)C)c2ccccn2)cc1	BroadT	BRD-K97564742	BRD-K97564742-103-01-9	Tocris Bioscience	660	2	OC(=O)C=CC(=O)O	COc1ccc(cc1)CN(CCN(C)C)c1ccccn1.OC(=O)C=CC(=O)O	InChI=1S/C17H23N3O.C4H4O4/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15;5-3(6)1-2-4(7)8/h4-11H,12-14H2,1-3H3;1-2H,(H,5,6)(H,7,8)	JXYWFNAQESKDNC-UHFFFAOYSA-N	285.184112386							6762, 6762
Nefazodone	LSM-4031	Nefazodone	4449	InChI=1S/C25H32ClN5O2/c1-2-24-27-31(25(32)30(24)18-19-33-23-10-4-3-5-11-23)13-7-12-28-14-16-29(17-15-28)22-9-6-8-21(26)20-22/h3-6,8-11,20H,2,7,12-19H2,1H3	VRBKIVRKKCLPHA-UHFFFAOYSA-N	CCC1=NN(CCCN2CCN(CC2)c3cccc(Cl)c3)C(=O)N1CCOc4ccccc4	BroadT	BRD-K90789829	BRD-K90789829-003-03-3	Tocris Bioscience	2777	1	Cl	CCc1nn(CCCN2CCN(CC2)c2cccc(Cl)c2)c(=O)n1CCOc1ccccc1.Cl	InChI=1S/C25H32ClN5O2.ClH/c1-2-24-27-31(25(32)30(24)18-19-33-23-10-4-3-5-11-23)13-7-12-28-14-16-29(17-15-28)22-9-6-8-21(26)20-22;/h3-6,8-11,20H,2,7,12-19H2,1H3;1H	DYCKFEBIOUQECE-UHFFFAOYSA-N	469.224453024							7494, 7494
25983-13-5	LSM-24979	BRD-K80576679	1845	InChI=1S/C8H4Cl2N2O2/c9-3-1-5-6(2-4(3)10)12-8(14)7(13)11-5/h1-2H,(H,11,13)(H,12,14)	AVBSIKMUAFYZAV-UHFFFAOYSA-N	Clc1cc2NC(=O)C(=O)Nc2cc1Cl	BroadT	BRD-K80576679	BRD-K80576679-001-03-1	Biomol International Inc.	EA-114	2817-N1277		Oc1nc2cc(Cl)c(Cl)cc2nc1O	InChI=1S/C8H4Cl2N2O2/c9-3-1-5-6(2-4(3)10)12-8(14)7(13)11-5/h1-2H,(H,11,13)(H,12,14)	AVBSIKMUAFYZAV-UHFFFAOYSA-N	229.964982808							113553
Benperidol	LSM-3792		16363	InChI=1S/C22H24FN3O2/c23-17-9-7-16(8-10-17)21(27)6-3-13-25-14-11-18(12-15-25)26-20-5-2-1-4-19(20)24-22(26)28/h1-2,4-5,7-10,18H,3,6,11-15H2,(H,24,28)	FEBOTPHFXYHVPL-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)CCCN2CCC(CC2)N3C(=O)Nc4ccccc34	BroadT	BRD-K79425933	BRD-K79425933-001-03-6	Prestwick Chemical Inc.	Prestw-484	D0701-MP04-ST03-200-		Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)n1c2ccccc2[nH]c1=O	InChI=1S/C22H24FN3O2/c23-17-9-7-16(8-10-17)21(27)6-3-13-25-14-11-18(12-15-25)26-20-5-2-1-4-19(20)24-22(26)28/h1-2,4-5,7-10,18H,3,6,11-15H2,(H,24,28)	FEBOTPHFXYHVPL-UHFFFAOYSA-N	381.185255238							93403
Pimpinellin	LSM-24980	SID26749188	4825	InChI=1S/C13H10O5/c1-15-11-7-3-4-9(14)18-10(7)8-5-6-17-12(8)13(11)16-2/h3-6H,1-2H3	BQPRWZCEKZLBHL-UHFFFAOYSA-N	COc1c(OC)c2occc2c3OC(=O)C=Cc13	BroadT	BRD-K93197368	BRD-K93197368-001-02-9	MicroSource Discovery Systems Inc.	300013			COc1c(OC)c2ccc(=O)oc2c2ccoc12	InChI=1S/C13H10O5/c1-15-11-7-3-4-9(14)18-10(7)8-5-6-17-12(8)13(11)16-2/h3-6H,1-2H3	BQPRWZCEKZLBHL-UHFFFAOYSA-N	246.05282342							8213
SR-142948	LSM-4038		5311451	InChI=1S/C39H51N5O6/c1-23(2)29-21-26(37(46)43(5)15-9-14-42(3)4)12-13-31(29)44-32(35-33(49-6)10-8-11-34(35)50-7)22-30(41-44)36(45)40-39(38(47)48)27-17-24-16-25(19-27)20-28(39)18-24/h8,10-13,21-25,27-28H,9,14-20H2,1-7H3,(H,40,45)(H,47,48)	LWULHXVBLMWCHO-UHFFFAOYSA-N	COc1cccc(OC)c1c2cc(nn2c3ccc(cc3C(C)C)C(=O)N(C)CCCN(C)C)C(=O)NC4(C5CC6CC(CC4C6)C5)C(=O)O	BroadT	BRD-K91243525	BRD-K91243525-001-01-5	Tocris Bioscience	2309	1		COc1cccc(OC)c1-c1cc(nn1-c1ccc(cc1C(C)C)C(=O)N(C)CCCN(C)C)C(=O)NC1(C2CC3CC(C2)CC1C3)C(O)=O	InChI=1S/C39H51N5O6/c1-23(2)29-21-26(37(46)43(5)15-9-14-42(3)4)12-13-31(29)44-32(35-33(49-6)10-8-11-34(35)50-7)22-30(41-44)36(45)40-39(38(47)48)27-17-24-16-25(19-27)20-28(39)18-24/h8,10-13,21-25,27-28H,9,14-20H2,1-7H3,(H,40,45)(H,47,48)	LWULHXVBLMWCHO-UHFFFAOYSA-N	685.383934402001							93589, 93589
Fenretinide	LSM-42925	4-HPR, Fenretinide, MCN-R-1967	5288209	InChI=1S/C26H33NO2/c1-19(11-16-24-21(3)10-7-17-26(24,4)5)8-6-9-20(2)18-25(29)27-22-12-14-23(28)15-13-22/h6,8-9,11-16,18,28H,7,10,17H2,1-5H3,(H,27,29)/b9-6+,16-11+,19-8+,20-18+	AKJHMTWEGVYYSE-FXILSDISSA-N	C\C(=C/C=C/C(=C/C(=O)Nc1ccc(O)cc1)/C)\C=C\C2=C(C)CCCC2(C)C	BroadT	BRD-K89085489	BRD-K89085489-001-02-6	EMD Biosciences	390900			CC(/C=C/C1=C(C)CCCC1(C)C)=C\C=C\C(C)=C\C(=O)Nc1ccc(O)cc1	InChI=1S/C26H33NO2/c1-19(11-16-24-21(3)10-7-17-26(24,4)5)8-6-9-20(2)18-25(29)27-22-12-14-23(28)15-13-22/h6,8-9,11-16,18,28H,7,10,17H2,1-5H3,(H,27,29)/b9-6+,16-11+,19-8+,20-18+	AKJHMTWEGVYYSE-FXILSDISSA-N	391.251129306							42588
12-Hydroxy-4,4-bisnor-4,8,11,13-podocarpatetraen-3-one	LSM-24981	SID26749837	6708578	InChI=1S/C15H16O2/c1-15-7-6-13(17)8-11(15)4-2-10-3-5-12(16)9-14(10)15/h3,5,8-9,16H,2,4,6-7H2,1H3/t15-/m0/s1	NPJWANZASAIMBS-HNNXBMFYSA-N	C[C@]12CCC(=O)C=C1CCc3ccc(O)cc23	BroadT	BRD-K79231725	BRD-K79231725-001-02-2	MicroSource Discovery Systems Inc.	100620			C[C@]12CCC(=O)C=C1CCc1ccc(O)cc21	InChI=1S/C15H16O2/c1-15-7-6-13(17)8-11(15)4-2-10-3-5-12(16)9-14(10)15/h3,5,8-9,16H,2,4,6-7H2,1H3/t15-/m0/s1	NPJWANZASAIMBS-HNNXBMFYSA-N	228.115029752							
Nortriptyline	LSM-4039	Nortriptyline, Pamelor	4543	InChI=1S/C19H21N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-11,20H,6,12-14H2,1H3	PHVGLTMQBUFIQQ-UHFFFAOYSA-N	CNCCC=C1c2ccccc2CCc3ccccc13	BroadT	BRD-K91263825	BRD-K91263825-001-02-8	MicroSource Discovery Systems Inc.	1500442			CNCCC=C1c2ccccc2CCc2ccccc12	InChI=1S/C19H21N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-11,20H,6,12-14H2,1H3	PHVGLTMQBUFIQQ-UHFFFAOYSA-N	263.167399682							7640, 7640
LY-344864	LSM-4161	LY-344864	5311097	InChI=1S/C21H22FN3O/c1-25(2)16-8-10-20-18(12-16)17-11-15(7-9-19(17)24-20)23-21(26)13-3-5-14(22)6-4-13/h3-7,9,11,16,24H,8,10,12H2,1-2H3,(H,23,26)/t16-/m1/s1	GKWHICIUSVVNGX-MRXNPFEDSA-N	CN(C)[C@@H]1CCc2[nH]c3ccc(NC(=O)c4ccc(F)cc4)cc3c2C1	BroadT	BRD-K95899059	BRD-K95899059-003-01-0	Tocris Bioscience	2451	1	Cl	CN(C)[C@@H]1CCc2[nH]c3ccc(NC(=O)c4ccc(F)cc4)cc3c2C1.Cl	InChI=1S/C21H22FN3O.ClH/c1-25(2)16-8-10-20-18(12-16)17-11-15(7-9-19(17)24-20)23-21(26)13-3-5-14(22)6-4-13;/h3-7,9,11,16,24H,8,10,12H2,1-2H3,(H,23,26);1H/t16-;/m1./s1	OKUHLSYESBLBCP-PKLMIRHRSA-N	351.174690554							93683
SR-95531	LSM-4098	Gabazine	5275	InChI=1S/C15H17N3O3/c1-21-12-6-4-11(5-7-12)13-8-9-14(16)18(17-13)10-2-3-15(19)20/h4-9,16H,2-3,10H2,1H3,(H,19,20)/p+1	ACVGNKYJVGNLIL-UHFFFAOYSA-O	COc1ccc(cc1)c2ccc(N)[n+](CCCC(=O)O)n2	BroadT	BRD-K93280214	BRD-K93280214-004-02-3	Prestwick Chemical Inc.	Prestw-443	D0701-MP04-ST03-200-	Br	COc1ccc(cc1)-c1ccc(N)[n+](CCCC(O)=O)n1.Br	InChI=1S/C15H17N3O3.BrH/c1-21-12-6-4-11(5-7-12)13-8-9-14(16)18(17-13)10-2-3-15(19)20;/h4-9,16H,2-3,10H2,1H3,(H,19,20);1H/p+1	GFZHNFOGCMEYTA-UHFFFAOYSA-O	288.134816466							93632
Loratadine	LSM-5891	79794-75-5, Loratadine, Claritin, Alavert, SCH-29851, Loratadine Redidose, Claritin-D, Claritin Reditabs, Claritin Hives Relief Reditab, Claritin Hives Relief, Children'S Claritin	3957	InChI=1S/C22H23ClN2O2/c1-2-27-22(26)25-12-9-15(10-13-25)20-19-8-7-18(23)14-17(19)6-5-16-4-3-11-24-21(16)20/h3-4,7-8,11,14H,2,5-6,9-10,12-13H2,1H3	JCCNYMKQOSZNPW-UHFFFAOYSA-N	CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc4cccnc24)CC1	BroadT	BRD-K82795137	BRD-K82795137-001-02-3	MicroSource Discovery Systems Inc.	1503712			CCOC(=O)N1CCC(CC1)=C1c2ccc(Cl)cc2CCc2cccnc12	InChI=1S/C22H23ClN2O2/c1-2-27-22(26)25-12-9-15(10-13-25)20-19-8-7-18(23)14-17(19)6-5-16-4-3-11-24-21(16)20/h3-4,7-8,11,14H,2,5-6,9-10,12-13H2,1H3	JCCNYMKQOSZNPW-UHFFFAOYSA-N	382.144805706							94763
PP 2	LSM-4153	AG-1879, PP-2	4878	InChI=1S/C15H16ClN5/c1-15(2,3)21-14-11(13(17)18-8-19-14)12(20-21)9-4-6-10(16)7-5-9/h4-8H,1-3H3,(H2,17,18,19)	PBBRWFOVCUAONR-UHFFFAOYSA-N	CC(C)(C)n1nc(c2ccc(Cl)cc2)c3c(N)ncnc13	BroadT	BRD-K95785537	BRD-K95785537-001-04-1	Biomol International Inc.	EI-297	2840(V2)-3-N1305		CC(C)(C)n1nc(-c2ccc(Cl)cc2)c2c(N)ncnc12	InChI=1S/C15H16ClN5/c1-15(2,3)21-14-11(13(17)18-8-19-14)12(20-21)9-4-6-10(16)7-5-9/h4-8H,1-3H3,(H2,17,18,19)	PBBRWFOVCUAONR-UHFFFAOYSA-N	301.109423272							78331
Cyclizine	LSM-5857	Marezine, Cyclizine	6726	InChI=1S/C18H22N2/c1-19-12-14-20(15-13-19)18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18H,12-15H2,1H3	UVKZSORBKUEBAZ-UHFFFAOYSA-N	CN1CCN(CC1)C(c2ccccc2)c3ccccc3	BroadT	BRD-K79501723	BRD-K79501723-003-03-4	Prestwick Chemical Inc.	Prestw-510	D0701-MP04-ST03-200-	Cl	CN1CCN(CC1)C(c1ccccc1)c1ccccc1.Cl	InChI=1S/C18H22N2.ClH/c1-19-12-14-20(15-13-19)18(16-8-4-2-5-9-16)17-10-6-3-7-11-17;/h2-11,18H,12-15H2,1H3;1H	UKPBEPCQTDRZSE-UHFFFAOYSA-N	266.178298724							3994, 3994, 3994, 3994
Cefotaxime	LSM-5834		456256	InChI=1S/C16H17N5O7S2/c1-6(22)28-3-7-4-29-14-10(13(24)21(14)11(7)15(25)26)19-12(23)9(20-27-2)8-5-30-16(17)18-8/h5,10,14H,3-4H2,1-2H3,(H2,17,18)(H,19,23)(H,25,26)/t10-,14-/m1/s1	GPRBEKHLDVQUJE-QMTHXVAHSA-N	CON=C(C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)COC(=O)C)c3csc(N)n3	BroadT	BRD-K78364995	BRD-K78364995-236-03-5	Prestwick Chemical Inc.	Prestw-139	D0701-MP04-ST03-200-	[Na]	CO\N=C(/C(=O)N[C@H]1[C@H]2SCC(COC(C)=O)=C(N2C1=O)C(O)=O)c1csc(N)n1.[Na]	InChI=1S/C16H17N5O7S2.Na.H/c1-6(22)28-3-7-4-29-14-10(13(24)21(14)11(7)15(25)26)19-12(23)9(20-27-2)8-5-30-16(17)18-8;;/h5,10,14H,3-4H2,1-2H3,(H2,17,18)(H,19,23)(H,25,26);;/b20-9-;;/t10-,14-;;/m1../s1	ACGQSCNTUWPWNB-JTVDOKOPSA-N	455.056939314							94739
Isoolomoucine	LSM-3930	Iso-Olomoucine	512292	InChI=1S/C15H18N6O/c1-21-10-18-14-12(21)13(19-15(20-14)16-7-8-22)17-9-11-5-3-2-4-6-11/h2-6,10,22H,7-9H2,1H3,(H2,16,17,19,20)	WOQKMUDQRKXVLO-UHFFFAOYSA-N	Cn1cnc2nc(NCCO)nc(NCc3ccccc3)c12	BroadT	BRD-K86509404	BRD-K86509404-001-02-0	Calbiochem	495622			Cn1cnc2nc(NCCO)nc(NCc3ccccc3)c12	InChI=1S/C15H18N6O/c1-21-10-18-14-12(21)13(19-15(20-14)16-7-8-22)17-9-11-5-3-2-4-6-11/h2-6,10,22H,7-9H2,1H3,(H2,16,17,19,20)	WOQKMUDQRKXVLO-UHFFFAOYSA-N	298.154209256							93507
Norethynodrel	LSM-3807	Noretynodrel, Norethynodrel, SC-4642	6231	InChI=1S/C20H26O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,16-18,22H,4-12H2,2H3/t16-,17-,18+,19+,20+/m1/s1	ICTXHFFSOAJUMG-SLHNCBLASA-N	C[C@]12CC[C@H]3[C@@H](CCC4=C3CCC(=O)C4)[C@@H]1CC[C@@]2(O)C#C	BroadT	BRD-K80334323	BRD-K80334323-001-03-5	Prestwick Chemical Inc.	Prestw-24	D0701-MP04-ST03-200-		C[C@]12CC[C@H]3[C@@H](CCC4=C3CCC(=O)C4)[C@@H]1CC[C@@]2(O)C#C	InChI=1S/C20H26O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,16-18,22H,4-12H2,2H3/t16-,17-,18+,19+,20+/m1/s1	ICTXHFFSOAJUMG-SLHNCBLASA-N	298.193280072							34895
4-Cyano-3-methylisoquinoline	LSM-24982	BRD-K94217587	1733	InChI=1S/C11H8N2/c1-8-11(6-12)10-5-3-2-4-9(10)7-13-8/h2-5,7H,1H3	SZWLGBJCLZDZBY-UHFFFAOYSA-N	Cc1ncc2ccccc2c1C#N	BroadT	BRD-K94217587	BRD-K94217587-001-01-1	EMD Biosciences	238900			Cc1ncc2ccccc2c1C#N	InChI=1S/C11H8N2/c1-8-11(6-12)10-5-3-2-4-9(10)7-13-8/h2-5,7H,1H3	SZWLGBJCLZDZBY-UHFFFAOYSA-N	168.068748276							113554
SU-6656	LSM-42805	SU-6656	5312137	InChI=1S/C19H21N3O3S/c1-22(2)26(24,25)14-7-8-18-15(11-14)16(19(23)21-18)10-13-9-12-5-3-4-6-17(12)20-13/h7-11,20H,3-6H2,1-2H3,(H,21,23)/b16-10-	LOGJQOUIVKBFGH-YBEGLDIGSA-N	CN(C)S(=O)(=O)c1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)\c2c1	BroadT	BRD-K97354755	BRD-K97354755-001-01-5	Calbiochem	572635			CN(C)S(=O)(=O)c1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)c2c1	InChI=1S/C19H21N3O3S/c1-22(2)26(24,25)14-7-8-18-15(11-14)16(19(23)21-18)10-13-9-12-5-3-4-6-17(12)20-13/h7-11,20H,3-6H2,1-2H3,(H,21,23)/b16-10-	LOGJQOUIVKBFGH-YBEGLDIGSA-N	371.130362252							
Beclomethasone Dipropionate	LSM-4209	Vanceril, Vancenase, Qnasl, Beconase, Beclovent, Beclomethasone, Beclometasone, SCH-18020W, Qvar 80, Qvar 40, Vanceril Double Strength, Vancenase AQ, Beclomethasone Dipropionate Monohydrate, Beclomethasone Dipropionate, Beclometasone Dipropionate	21700	InChI=1S/C28H37ClO7/c1-6-23(33)35-15-22(32)28(36-24(34)7-2)16(3)12-20-19-9-8-17-13-18(30)10-11-25(17,4)27(19,29)21(31)14-26(20,28)5/h10-11,13,16,19-21,31H,6-9,12,14-15H2,1-5H3/t16-,19-,20-,21-,25-,26-,27-,28-/m0/s1	KUVIULQEHSCUHY-XYWKZLDCSA-N	CCC(=O)OCC(=O)[C@@]1(OC(=O)CC)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@]12C	BroadT	BRD-K97810537	BRD-K97810537-001-03-7	Prestwick Chemical Inc.	Prestw-855	D0701-MP04-ST03-200-		CCC(=O)OCC(=O)[C@@]1(OC(=O)CC)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@]12C	InChI=1S/C28H37ClO7/c1-6-23(33)35-15-22(32)28(36-24(34)7-2)16(3)12-20-19-9-8-17-13-18(30)10-11-25(17,4)27(19,29)21(31)14-26(20,28)5/h10-11,13,16,19-21,31H,6-9,12,14-15H2,1-5H3/t16-,19-,20-,21-,25-,26-,27-,28-/m0/s1	KUVIULQEHSCUHY-XYWKZLDCSA-N	520.222781234							3002
Ipsapirone	LSM-4026	Ipsapirone	56971	InChI=1S/C19H23N5O3S/c25-18-16-6-1-2-7-17(16)28(26,27)24(18)11-4-3-10-22-12-14-23(15-13-22)19-20-8-5-9-21-19/h1-2,5-9H,3-4,10-15H2	TZJUVVIWVWFLCD-UHFFFAOYSA-N	O=C1N(CCCCN2CCN(CC2)c3ncccn3)S(=O)(=O)c4ccccc14	BroadT	BRD-K90574421	BRD-K90574421-001-01-9	Tocris Bioscience	1869	1		O=C1N(CCCCN2CCN(CC2)c2ncccn2)S(=O)(=O)c2ccccc12	InChI=1S/C19H23N5O3S/c25-18-16-6-1-2-7-17(16)28(26,27)24(18)11-4-3-10-22-12-14-23(15-13-22)19-20-8-5-9-21-19/h1-2,5-9H,3-4,10-15H2	TZJUVVIWVWFLCD-UHFFFAOYSA-N	401.152160336							93578, 93578
3-Isobutyl-1-methylxanthine	LSM-24983	BRD-K94979336	3758	InChI=1S/C10H14N4O2/c1-6(2)4-14-8-7(11-5-12-8)9(15)13(3)10(14)16/h5-6H,4H2,1-3H3,(H,11,12)	APIXJSLKIYYUKG-UHFFFAOYSA-N	CC(C)CN1C(=O)N(C)C(=O)c2[nH]cnc12	BroadT	BRD-K94979336	BRD-K94979336-001-06-9	Biomol International Inc.	PD-140	2840(V2)-3-N1305		CC(C)Cn1c2[nH]cnc2c(=O)n(C)c1=O	InChI=1S/C10H14N4O2/c1-6(2)4-14-8-7(11-5-12-8)9(15)13(3)10(14)16/h5-6H,4H2,1-3H3,(H,11,12)	APIXJSLKIYYUKG-UHFFFAOYSA-N	222.111675728							34795, 43253
CHEMBL288490	LSM-24984	SID26756541, BRD-K80315422	9921349	InChI=1S/C14H16N4O/c1-17(2)9-13-15-14(16-19-13)11-8-18(3)12-7-5-4-6-10(11)12/h4-8H,9H2,1-3H3	QSJAUJMEJZCQQU-UHFFFAOYSA-N	CN(C)Cc1onc(n1)c2cn(C)c3ccccc23	BroadT	BRD-K80315422	BRD-K80315422-001-01-8	Biomol International Inc.	AC-562	2813-N1283		CN(C)Cc1nc(no1)-c1cn(C)c2ccccc12	InChI=1S/C14H16N4O/c1-17(2)9-13-15-14(16-19-13)11-8-18(3)12-7-5-4-6-10(11)12/h4-8H,9H2,1-3H3	QSJAUJMEJZCQQU-UHFFFAOYSA-N	256.132411172							113555
Tesmilifene	LSM-3805	Dppe, Tesmilifene	108092	InChI=1S/C19H25NO/c1-3-20(4-2)14-15-21-19-12-10-18(11-13-19)16-17-8-6-5-7-9-17/h5-13H,3-4,14-16H2,1-2H3	NFIXBCVWIPOYCD-UHFFFAOYSA-N	CCN(CC)CCOc1ccc(Cc2ccccc2)cc1	BroadT	BRD-K80315159	BRD-K80315159-051-01-2	Tocris Bioscience	743	2	OC(=O)/C=C/C(=O)O	CCN(CC)CCOc1ccc(Cc2ccccc2)cc1.OC(=O)/C=C/C(=O)O	InChI=1S/C19H25NO.C4H4O4/c1-3-20(4-2)14-15-21-19-12-10-18(11-13-19)16-17-8-6-5-7-9-17;5-3(6)1-2-4(7)8/h5-13H,3-4,14-16H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+	ZOOMDYHTGZSGDD-WLHGVMLRSA-N	283.19361443							93414, 93414
AQ-RA-741	LSM-3833	SID26753266, AQ-RA741	129989	InChI=1S/C27H37N5O2/c1-3-30(4-2)17-8-7-10-21-14-18-31(19-15-21)20-25(33)32-24-13-6-5-11-22(24)27(34)29-23-12-9-16-28-26(23)32/h5-6,9,11-13,16,21H,3-4,7-8,10,14-15,17-20H2,1-2H3,(H,29,34)	BCUGCHZRMKTPMU-UHFFFAOYSA-N	CCN(CC)CCCCC1CCN(CC(=O)N2c3ccccc3C(=O)Nc4cccnc24)CC1	BroadT	BRD-K81729199	BRD-K81729199-001-01-0	Tocris Bioscience	2292	1		CCN(CC)CCCCC1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1	InChI=1S/C27H37N5O2/c1-3-30(4-2)17-8-7-10-21-14-18-31(19-15-21)20-25(33)32-24-13-6-5-11-22(24)27(34)29-23-12-9-16-28-26(23)32/h5-6,9,11-13,16,21H,3-4,7-8,10,14-15,17-20H2,1-2H3,(H,29,34)	BCUGCHZRMKTPMU-UHFFFAOYSA-N	463.294725474							93432
Coumestrol	LSM-4202	Coumestrol	5281707	InChI=1S/C15H8O5/c16-7-1-3-9-11(5-7)19-14-10-4-2-8(17)6-12(10)20-15(18)13(9)14/h1-6,16-17H	ZZIALNLLNHEQPJ-UHFFFAOYSA-N	Oc1ccc2c(OC(=O)c3c2oc4cc(O)ccc34)c1	BroadT	BRD-K97509413	BRD-K97509413-001-01-8	Sigma-Aldrich	27885			Oc1ccc2c(c1)oc1c2c(=O)oc2cc(O)ccc12	InChI=1S/C15H8O5/c16-7-1-3-9-11(5-7)19-14-10-4-2-8(17)6-12(10)20-15(18)13(9)14/h1-6,16-17H	ZZIALNLLNHEQPJ-UHFFFAOYSA-N	268.037173356							3908
RS-102,221	LSM-3943	RS-102221, RS102221	3693566	InChI=1S/C27H31F3N4O7S/c1-40-22-16-23(41-2)20(33-42(38,39)18-8-6-17(7-9-18)27(28,29)30)15-19(22)21(35)5-3-4-12-34-13-10-26(11-14-34)24(36)31-25(37)32-26/h6-9,15-16,33H,3-5,10-14H2,1-2H3,(H2,31,32,36,37)	HZZZZODVDSHQRG-UHFFFAOYSA-N	COc1cc(OC)c(cc1NS(=O)(=O)c2ccc(cc2)C(F)(F)F)C(=O)CCCCN3CCC4(CC3)NC(=O)NC4=O	BroadT	BRD-K87048468	BRD-K87048468-003-01-9	Tocris Bioscience	1050	9	Cl	COc1cc(OC)c(cc1NS(=O)(=O)c1ccc(cc1)C(F)(F)F)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O.Cl	InChI=1S/C27H31F3N4O7S.ClH/c1-40-22-16-23(41-2)20(33-42(38,39)18-8-6-17(7-9-18)27(28,29)30)15-19(22)21(35)5-3-4-12-34-13-10-26(11-14-34)24(36)31-25(37)32-26;/h6-9,15-16,33H,3-5,10-14H2,1-2H3,(H2,31,32,36,37);1H	SZJZEJZLRDIHPB-UHFFFAOYSA-N	612.186554662							93519
Methylephedrine	LSM-24985	BRD-K82236108	64782	InChI=1S/C11H17NO/c1-9(12(2)3)11(13)10-7-5-4-6-8-10/h4-9,11,13H,1-3H3/t9-,11-/m0/s1	FMCGSUUBYTWNDP-ONGXEEELSA-N	C[C@@H]([C@H](O)c1ccccc1)N(C)C	BroadT	BRD-K82236108	BRD-K82236108-001-02-3	MicroSource Discovery Systems Inc.	2300220			C[C@@H]([C@H](O)c1ccccc1)N(C)C	InChI=1S/C11H17NO/c1-9(12(2)3)11(13)10-7-5-4-6-8-10/h4-9,11,13H,1-3H3/t9-,11-/m0/s1	FMCGSUUBYTWNDP-ONGXEEELSA-N	179.131014174							113556
VB 20B7	LSM-24986	SID11113671, SID26751857, BRD-K91868854	127902	InChI=1S/C19H19N3O2S/c1-2-4-18-15(3-1)20-19(25-18)22-9-7-21(8-10-22)12-14-5-6-16-17(11-14)24-13-23-16/h1-6,11H,7-10,12-13H2	BYHKGNWKJMGHGE-UHFFFAOYSA-N	C(N1CCN(CC1)c2nc3ccccc3s2)c4ccc5OCOc5c4	BroadT	BRD-K91868854	BRD-K91868854-001-01-0	Biomol International Inc.	AC-566	2813-N1283		C(N1CCN(CC1)c1nc2ccccc2s1)c1ccc2OCOc2c1	InChI=1S/C19H19N3O2S/c1-2-4-18-15(3-1)20-19(25-18)22-9-7-21(8-10-22)12-14-5-6-16-17(11-14)24-13-23-16/h1-6,11H,7-10,12-13H2	BYHKGNWKJMGHGE-UHFFFAOYSA-N	353.119797568							113557
Austricine	LSM-3773	Austricine, Spectrum_001472	6708801	InChI=1S/C15H18O4/c1-6-4-10(17)13-8(3)15(18)19-14(13)12-7(2)5-9(16)11(6)12/h5,8,10,12-14,17H,4H2,1-3H3/t8-,10-,12+,13+,14+/m0/s1	YMUOZXZDDBRJEP-HBYJKHNMSA-N	C[C@H]1[C@@H]2[C@@H](O)CC(=C3[C@H]([C@H]2OC1=O)C(=CC3=O)C)C	BroadT	BRD-K78838262	BRD-K78838262-001-02-4	MicroSource Discovery Systems Inc.	1504139			C[C@H]1[C@H]2[C@H](OC1=O)[C@@H]1C(C)=CC(=O)C1=C(C)C[C@@H]2O	InChI=1S/C15H18O4/c1-6-4-10(17)13-8(3)15(18)19-14(13)12-7(2)5-9(16)11(6)12/h5,8,10,12-14,17H,4H2,1-3H3/t8-,10-,12+,13+,14+/m0/s1	YMUOZXZDDBRJEP-HBYJKHNMSA-N	262.120509056							93389
Hydrastinine	LSM-4079	Hydrastinine, SID11113254, TNP00276, SID26754303	3397945	InChI=1S/C11H12NO2/c1-12-3-2-8-4-10-11(14-7-13-10)5-9(8)6-12/h4-6H,2-3,7H2,1H3/q+1	LGDCROILDUSHQX-UHFFFAOYSA-N	C[N+]1=Cc2cc3OCOc3cc2CC1	BroadT	BRD-K92726801	BRD-K92726801-003-02-7	Prestwick Chemical Inc.	Prestw-195	D0701-MP04-ST03-200-	Cl	C[N+]1=Cc2cc3OCOc3cc2CC1.Cl	InChI=1S/C11H12NO2.ClH/c1-12-3-2-8-4-10-11(14-7-13-10)5-9(8)6-12;/h4-6H,2-3,7H2,1H3;1H/q+1;	SPPCPQLRXRPBOE-UHFFFAOYSA-N	190.086803634							93619
RS-79948	LSM-3932		9908992	InChI=1S/C19H28N2O3S/c1-3-25(22,23)21-9-4-5-15-13-20-10-8-14-11-16(24-2)6-7-17(14)19(20)12-18(15)21/h6-7,11,15,18-19H,3-5,8-10,12-13H2,1-2H3/t15-,18+,19+/m1/s1	UMGBFFAJXFXOIL-MNEFBYGVSA-N	CCS(=O)(=O)N1CCC[C@@H]2CN3CCc4cc(OC)ccc4[C@@H]3C[C@H]12	BroadT	BRD-K86600316	BRD-K86600316-003-01-2	Tocris Bioscience	987	2	Cl	CCS(=O)(=O)N1CCC[C@@H]2CN3CCc4cc(OC)ccc4[C@@H]3C[C@H]12.Cl	InChI=1S/C19H28N2O3S.ClH/c1-3-25(22,23)21-9-4-5-15-13-20-10-8-14-11-16(24-2)6-7-17(14)19(20)12-18(15)21;/h6-7,11,15,18-19H,3-5,8-10,12-13H2,1-2H3;1H/t15-,18+,19+;/m1./s1	DZTZUOBWDBPPJQ-BQBHMPFISA-N	364.182063466							93509
Rauwolfia Serpentina	LSM-15373	Rauwolfia Serpentina Root	441975	InChI=1S/C21H24N2O3/c1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2/h3-6,11-12,15-16,19,22H,7-10H2,1-2H3/t12-,15-,16+,19-/m0/s1	GRTOGORTSDXSFK-XJTZBENFSA-N	COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12	BroadT	BRD-K83028735	BRD-K83028735-003-03-8	Prestwick Chemical Inc.	Prestw-592	D0701-MP04-ST03-200-	Cl	COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12.Cl	InChI=1S/C21H24N2O3.ClH/c1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2;/h3-6,11-12,15-16,19,22H,7-10H2,1-2H3;1H/t12-,15-,16+,19-;/m0./s1	YWPZOTNKHMBWPD-QAWKRFFXSA-N	352.178692648							2524, 2524
L 655240	LSM-4003	L-655240	122070	InChI=1S/C21H21ClFNO2/c1-13-17-10-16(23)8-9-18(17)24(12-14-4-6-15(22)7-5-14)19(13)11-21(2,3)20(25)26/h4-10H,11-12H2,1-3H3,(H,25,26)	JLPYLHLUHJOPNL-UHFFFAOYSA-N	Cc1c(CC(C)(C)C(=O)O)n(Cc2ccc(Cl)cc2)c3ccc(F)cc13	BroadT	BRD-K89402695	BRD-K89402695-001-01-5	Tocris Bioscience	1698	1		Cc1c(CC(C)(C)C(O)=O)n(Cc2ccc(Cl)cc2)c2ccc(F)cc12	InChI=1S/C21H21ClFNO2/c1-13-17-10-16(23)8-9-18(17)24(12-14-4-6-15(22)7-5-14)19(13)11-21(2,3)20(25)26/h4-10H,11-12H2,1-3H3,(H,25,26)	JLPYLHLUHJOPNL-UHFFFAOYSA-N	373.124484832							93563
Perindopril	LSM-4080	Perindopril, MCN-A-2833, S-9490	107807	InChI=1S/C19H32N2O5/c1-4-8-14(19(25)26-5-2)20-12(3)17(22)21-15-10-7-6-9-13(15)11-16(21)18(23)24/h12-16,20H,4-11H2,1-3H3,(H,23,24)/t12-,13-,14-,15-,16-/m0/s1	IPVQLZZIHOAWMC-QXKUPLGCSA-N	CCC[C@H](N[C@@H](C)C(=O)N1[C@H]2CCCC[C@H]2C[C@H]1C(=O)O)C(=O)OCC	BroadT	BRD-K92731339	BRD-K92731339-227-02-3	MicroSource Discovery Systems Inc.	1505212		CC(C)(C)N	CCC[C@H](N[C@@H](C)C(=O)N1[C@H]2CCCC[C@H]2C[C@H]1C(O)=O)C(=O)OCC.CC(C)(C)N	InChI=1S/C19H32N2O5.C4H11N/c1-4-8-14(19(25)26-5-2)20-12(3)17(22)21-15-10-7-6-9-13(15)11-16(21)18(23)24;1-4(2,3)5/h12-16,20H,4-11H2,1-3H3,(H,23,24);5H2,1-3H3/t12-,13-,14-,15-,16-;/m0./s1	IYNMDWMQHSMDDE-MHXJNQAMSA-N	368.231122144							8024
BRL50481	LSM-3887	BRL-50481	2921148	InChI=1S/C9H12N2O4S/c1-7-4-5-8(11(12)13)6-9(7)16(14,15)10(2)3/h4-6H,1-3H3	IFIUFCJFLGCQPH-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cc(ccc1C)[N+](=O)[O-]	BroadT	BRD-K84266862	BRD-K84266862-001-01-6	Tocris Bioscience	2237	1		CN(C)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O	InChI=1S/C9H12N2O4S/c1-7-4-5-8(11(12)13)6-9(7)16(14,15)10(2)3/h4-6H,1-3H3	IFIUFCJFLGCQPH-UHFFFAOYSA-N	244.051777574							93472
Chloropyramine	LSM-5896	Chloropyramine, Halopyramine	25295	InChI=1S/C16H20ClN3/c1-19(2)11-12-20(16-5-3-4-10-18-16)13-14-6-8-15(17)9-7-14/h3-10H,11-13H2,1-2H3	ICKFFNBDFNZJSX-UHFFFAOYSA-N	CN(C)CCN(Cc1ccc(Cl)cc1)c2ccccn2	BroadT	BRD-K83257731	BRD-K83257731-003-03-7	Prestwick Chemical Inc.	Prestw-807	D0701-MP04-ST03-200-	Cl	CN(C)CCN(Cc1ccc(Cl)cc1)c1ccccn1.Cl	InChI=1S/C16H20ClN3.ClH/c1-19(2)11-12-20(16-5-3-4-10-18-16)13-14-6-8-15(17)9-7-14;/h3-10H,11-13H2,1-2H3;1H	VEYWWAGBHABATA-UHFFFAOYSA-N	289.13457538							94767, 94767
Fenamic acid	LSM-6670	2-(Phenylamino)Benzoic Acid, 2-Phenylamino-Benzoic Acid, N-Phenylanthranilic Acid	4386	InChI=1S/C13H11NO2/c15-13(16)11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9,14H,(H,15,16)	ZWJINEZUASEZBH-UHFFFAOYSA-N	OC(=O)c1ccccc1Nc2ccccc2	BroadT	BRD-K80863915	BRD-K80863915-001-02-9	Biomol International Inc.	AC-132	2840(V2)-3-N1305		OC(=O)c1ccccc1Nc1ccccc1	InChI=1S/C13H11NO2/c15-13(16)11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9,14H,(H,15,16)	ZWJINEZUASEZBH-UHFFFAOYSA-N	213.078978602							34756
GR-135531	LSM-3869	SID11113768, SID26751952, SID29215031	4284525	InChI=1S/C14H17N3O3/c1-9(18)15-6-5-10-8-16-13-4-3-11(7-12(10)13)17-14(19)20-2/h3-4,7-8,16H,5-6H2,1-2H3,(H,15,18)(H,17,19)	MPZVHKLZCUEJFO-UHFFFAOYSA-N	COC(=O)Nc1ccc2[nH]cc(CCNC(=O)C)c2c1	BroadT	BRD-K83023055	BRD-K83023055-001-01-9	Tocris Bioscience	896	4		COC(=O)Nc1ccc2[nH]cc(CCNC(C)=O)c2c1	InChI=1S/C14H17N3O3/c1-9(18)15-6-5-10-8-16-13-4-3-11(7-12(10)13)17-14(19)20-2/h3-4,7-8,16H,5-6H2,1-2H3,(H,15,18)(H,17,19)	MPZVHKLZCUEJFO-UHFFFAOYSA-N	275.126991434							93457
Isocarboxazid	LSM-4101	Isocarboxazid, Marplan	3759	InChI=1S/C12H13N3O2/c1-9-7-11(15-17-9)12(16)14-13-8-10-5-3-2-4-6-10/h2-7,13H,8H2,1H3,(H,14,16)	XKFPYPQQHFEXRZ-UHFFFAOYSA-N	Cc1onc(c1)C(=O)NNCc2ccccc2	BroadT	BRD-K93332168	BRD-K93332168-001-03-2	Prestwick Chemical Inc.	Prestw-795	D0701-MP04-ST03-200-		Cc1cc(no1)C(=O)NNCc1ccccc1	InChI=1S/C12H13N3O2/c1-9-7-11(15-17-9)12(16)14-13-8-10-5-3-2-4-6-10/h2-7,13H,8H2,1H3,(H,14,16)	XKFPYPQQHFEXRZ-UHFFFAOYSA-N	231.100776686							93635
Dnqx	LSM-3911	6,7-Dinitroquinoxaline-2,3-Dione, SID29215530, SID50104334, SID90341758	3899541	InChI=1S/C8H4N4O6/c13-7-8(14)10-4-2-6(12(17)18)5(11(15)16)1-3(4)9-7/h1-2H,(H,9,13)(H,10,14)	RWVIMCIPOAXUDG-UHFFFAOYSA-N	Oc1nc2cc(c(cc2nc1O)[N+](=O)[O-])[N+](=O)[O-]	BroadT	BRD-K85266041	BRD-K85266041-304-01-7	Tocris Bioscience	2312	1	[Na].[Na]	Oc1nc2cc(c(cc2nc1O)[N+]([O-])=O)[N+]([O-])=O.[Na].[Na]	InChI=1S/C8H4N4O6.2Na.2H/c13-7-8(14)10-4-2-6(12(17)18)5(11(15)16)1-3(4)9-7;;;;/h1-2H,(H,9,13)(H,10,14);;;;	JWIGXFFFSGCUCV-UHFFFAOYSA-N	252.013083888							93492
RS102895	LSM-3870	RS-102895, SID29215126	10000456	InChI=1S/C21H21F3N2O2/c22-21(23,24)16-7-5-15(6-8-16)9-12-26-13-10-20(11-14-26)17-3-1-2-4-18(17)25-19(27)28-20/h1-8H,9-14H2,(H,25,27)	HIDWEYPGMLIQSN-UHFFFAOYSA-N	FC(F)(F)c1ccc(CCN2CCC3(CC2)OC(=O)Nc4ccccc34)cc1	BroadT	BRD-K83063356	BRD-K83063356-003-01-7	Tocris Bioscience	2089	1	Cl	FC(F)(F)c1ccc(CCN2CCC3(CC2)OC(=O)Nc2ccccc32)cc1.Cl	InChI=1S/C21H21F3N2O2.ClH/c22-21(23,24)16-7-5-15(6-8-16)9-12-26-13-10-20(11-14-26)17-3-1-2-4-18(17)25-19(27)28-20;/h1-8H,9-14H2,(H,25,27);1H	KRRISOFSWVKYBF-UHFFFAOYSA-N	390.155512532							93458, 93458
Harmaline	LSM-6691	Harmaline	5280951	InChI=1S/C13H14N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-4,7,15H,5-6H2,1-2H3	RERZNCLIYCABFS-UHFFFAOYSA-N	COc1ccc2c3CCN=C(C)c3[nH]c2c1	BroadT	BRD-K91317041	BRD-K91317041-001-02-0	AnalytiCon Discovery GmbH	NP-010656			COc1ccc2c3CCN=C(C)c3[nH]c2c1	InChI=1S/C13H14N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-4,7,15H,5-6H2,1-2H3	RERZNCLIYCABFS-UHFFFAOYSA-N	214.110613088							28172, 28172, 28172, 28172, 28172
Herniarin	LSM-3820	7-Methoxy Coumarin, 7-Methoxycoumarin, Herniarin	10748	InChI=1S/C10H8O3/c1-12-8-4-2-7-3-5-10(11)13-9(7)6-8/h2-6H,1H3	LIIALPBMIOVAHH-UHFFFAOYSA-N	COc1ccc2C=CC(=O)Oc2c1	BroadT	BRD-K81209159	BRD-K81209159-001-02-9	AnalytiCon Discovery GmbH	NP-000391			COc1ccc2ccc(=O)oc2c1	InChI=1S/C10H8O3/c1-12-8-4-2-7-3-5-10(11)13-9(7)6-8/h2-6H,1H3	LIIALPBMIOVAHH-UHFFFAOYSA-N	176.047344116							5679
(-)-Chlorpheniramine	LSM-4008	Chlorphenamine, SID50100400, SID11112256, SID11110932, SID11110931	716121	InChI=1S/C16H19ClN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3/t15-/m1/s1	SOYKEARSMXGVTM-OAHLLOKOSA-N	CN(C)CC[C@H](c1ccc(Cl)cc1)c2ccccn2	BroadT	BRD-K89595132	BRD-K89595132-050-02-2	MicroSource Discovery Systems Inc.	1500183		OC(=O)/C=C\C(=O)O	CN(C)CC[C@H](c1ccc(Cl)cc1)c1ccccn1.OC(=O)/C=C\C(=O)O	InChI=1S/C16H19ClN2.C4H4O4/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13;5-3(6)1-2-4(7)8/h3-9,11,15H,10,12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t15-;/m1./s1	DBAKFASWICGISY-HFNHQGOYSA-N	274.123676338							52013
4-Hydroxyquinazoline	LSM-24987	BRD-K91758890	63112	InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)	QMNUDYFKZYBWQX-UHFFFAOYSA-N	Oc1ncnc2ccccc12	BroadT	BRD-K91758890	BRD-K91758890-001-03-5	Tocris Bioscience	2192	1		Oc1ncnc2ccccc12	InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)	QMNUDYFKZYBWQX-UHFFFAOYSA-N	146.048012832							113558
BRD-K86727142-001-06-6	LSM-3937	Embelin	44483355	InChI=1S/C17H26O4/c1-2-3-4-5-6-7-8-9-10-11-13-16(20)14(18)12-15(19)17(13)21/h13H,2-12H2,1H3	FNQDSLSOLMXCMU-UHFFFAOYSA-N	CCCCCCCCCCCC1C(=O)C(=O)CC(=O)C1=O	BroadT	BRD-K86727142	BRD-K86727142-001-06-6	Tocris Bioscience	2156	1		CCCCCCCCCCCC1C(=O)C(=O)CC(=O)C1=O	InChI=1S/C17H26O4/c1-2-3-4-5-6-7-8-9-10-11-13-16(20)14(18)12-15(19)17(13)21/h13H,2-12H2,1H3	FNQDSLSOLMXCMU-UHFFFAOYSA-N	294.183109312							93514
Pinocembrin	LSM-4126	(2s)-Pinocembrin, NSC-43318	68071	InChI=1S/C15H12O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-7,13,16-17H,8H2/t13-/m0/s1	URFCJEUYXNAHFI-ZDUSSCGKSA-N	Oc1cc(O)c2C(=O)C[C@H](Oc2c1)c3ccccc3	BroadT	BRD-K94689771	BRD-K94689771-001-02-5	MicroSource Discovery Systems Inc.	1504154			Oc1cc(O)c2C(=O)C[C@H](Oc2c1)c1ccccc1	InChI=1S/C15H12O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-7,13,16-17H,8H2/t13-/m0/s1	URFCJEUYXNAHFI-ZDUSSCGKSA-N	256.073558864							28157
Pilocarpine	LSM-5909	Pilocarpine, Ocusert Pilo	5910	InChI=1S/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3/t8-,10-/m0/s1	QCHFTSOMWOSFHM-WPRPVWTQSA-N	CC[C@H]1[C@@H](Cc2cncn2C)COC1=O	BroadT	BRD-K85090592	BRD-K85090592-003-08-7	Tocris Bioscience	694	1	Cl	CC[C@H]1[C@@H](Cc2cncn2C)COC1=O.Cl	InChI=1S/C11H16N2O2.ClH/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2;/h5,7-8,10H,3-4,6H2,1-2H3;1H/t8-,10-;/m0./s1	RNAICSBVACLLGM-GNAZCLTHSA-N	208.121177772							8207, 8207, 8207, 8207
Olmesartan Medoxomil	LSM-3767	144689-63-4, Olmesartan	130881	InChI=1S/C29H30N6O6/c1-5-8-23-30-25(29(3,4)38)24(27(36)39-16-22-17(2)40-28(37)41-22)35(23)15-18-11-13-19(14-12-18)20-9-6-7-10-21(20)26-31-33-34-32-26/h6-7,9-14,38H,5,8,15-16H2,1-4H3,(H,31,32,33,34)	UQGKUQLKSCSZGY-UHFFFAOYSA-N	CCCc1nc(c(C(=O)OCC2=C(C)OC(=O)O2)n1Cc3ccc(cc3)c4ccccc4c5nn[nH]n5)C(C)(C)O	BroadT	BRD-K78485176	BRD-K78485176-001-02-9	MicroSource Discovery Systems Inc.	1505205			CCCc1nc(C(C)(C)O)c(C(=O)OCc2oc(=O)oc2C)n1Cc1ccc(cc1)-c1ccccc1-c1nn[nH]n1	InChI=1S/C29H30N6O6/c1-5-8-23-30-25(29(3,4)38)24(27(36)39-16-22-17(2)40-28(37)41-22)35(23)15-18-11-13-19(14-12-18)20-9-6-7-10-21(20)26-31-33-34-32-26/h6-7,9-14,38H,5,8,15-16H2,1-4H3,(H,31,32,33,34)	UQGKUQLKSCSZGY-UHFFFAOYSA-N	558.22268274							93384
Arecoline	LSM-15214	Arecoline	2230	InChI=1S/C8H13NO2/c1-9-5-3-4-7(6-9)8(10)11-2/h4H,3,5-6H2,1-2H3	HJJPJSXJAXAIPN-UHFFFAOYSA-N	COC(=O)C1=CCCN(C)C1	BroadT	BRD-K88646909	BRD-K88646909-004-03-0	AnalytiCon Discovery GmbH	NP-010714		Br	COC(=O)C1=CCCN(C)C1.Br	InChI=1S/C8H13NO2.BrH/c1-9-5-3-4-7(6-9)8(10)11-2;/h4H,3,5-6H2,1-2H3;1H	AXOJRQLKMVSHHZ-UHFFFAOYSA-N	155.094628666							2814, 2814
Ioxaglic acid	LSM-3781	P-286, Ioxaglic Acid, Ioxaglic-Acid	3742	InChI=1S/C24H21I6N5O8/c1-7(37)35(3)20-17(29)10(21(39)31-2)13(25)11(18(20)30)23(41)33-6-8(38)34-19-15(27)9(22(40)32-4-5-36)14(26)12(16(19)28)24(42)43/h36H,4-6H2,1-3H3,(H,31,39)(H,32,40)(H,33,41)(H,34,38)(H,42,43)	TYYBFXNZMFNZJT-UHFFFAOYSA-N	CNC(=O)c1c(I)c(N(C)C(=O)C)c(I)c(C(=O)NCC(=O)Nc2c(I)c(C(=O)O)c(I)c(C(=O)NCCO)c2I)c1I	BroadT	BRD-K79124250	BRD-K79124250-001-03-0	Prestwick Chemical Inc.	Prestw-1062	D0701-MP04-ST03-200-		CNC(=O)c1c(I)c(N(C)C(C)=O)c(I)c(C(=O)NCC(=O)Nc2c(I)c(C(O)=O)c(I)c(C(=O)NCCO)c2I)c1I	InChI=1S/C24H21I6N5O8/c1-7(37)35(3)20-17(29)10(21(39)31-2)13(25)11(18(20)30)23(41)33-6-8(38)34-19-15(27)9(22(40)32-4-5-36)14(26)12(16(19)28)24(42)43/h36H,4-6H2,1-3H3,(H,31,39)(H,32,40)(H,33,41)(H,34,38)(H,42,43)	TYYBFXNZMFNZJT-UHFFFAOYSA-N	1268.565820682							31718, 31718, 31718
Biotin	LSM-3994	Bioepiderm, Biotin, Biotin 100, Vitamin H	171548	InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1	YBJHBAHKTGYVGT-ZKWXMUAHSA-N	OC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12	BroadT	BRD-K89210380	BRD-K89210380-001-03-8	Prestwick Chemical Inc.	Prestw-418	D0701-MP04-ST03-200-		OC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12	InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1	YBJHBAHKTGYVGT-ZKWXMUAHSA-N	244.088163082							15956
Quercetin	LSM-4199	Xanthaurine, Sophoretin, Meletin, NSC-9219, C.I. Natural Red 1	5280343	InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H	REFJWTPEDVJJIY-UHFFFAOYSA-N	OC1=C(Oc2cc(O)cc(O)c2C1=O)c3ccc(O)c(O)c3	BroadT	BRD-K97399794	BRD-K97399794-001-07-0	Biomol International Inc.	AC1142	2840(V2)-3-N1305		Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O	InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H	REFJWTPEDVJJIY-UHFFFAOYSA-N	302.04265266							16243, 16243, 16243
1469-94-9	LSM-24988	BRD-K95432622	73849	InChI=1S/C15H12O3/c16-13-9-5-4-8-12(13)15(18)10-14(17)11-6-2-1-3-7-11/h1-9,16H,10H2	OABFIJGAEVKMJP-UHFFFAOYSA-N	Oc1ccccc1C(=O)CC(=O)c2ccccc2	BroadT	BRD-K95432622	BRD-K95432622-001-03-8	MicroSource Discovery Systems Inc.	200123			Oc1ccccc1C(=O)CC(=O)c1ccccc1	InChI=1S/C15H12O3/c16-13-9-5-4-8-12(13)15(18)10-14(17)11-6-2-1-3-7-11/h1-9,16H,10H2	OABFIJGAEVKMJP-UHFFFAOYSA-N	240.078644244							113559
Letrozole	LSM-3980	Femara, Letrozole, CGS-20267	3902	InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H	HPJKCIUCZWXJDR-UHFFFAOYSA-N	N#Cc1ccc(cc1)C(c2ccc(cc2)C#N)n3cncn3	BroadT	BRD-K88789588	BRD-K88789588-001-03-2	Prestwick Chemical Inc.	Prestw-1025	D0701-MP04-ST03-200-		N#Cc1ccc(cc1)C(c1ccc(cc1)C#N)n1cncn1	InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H	HPJKCIUCZWXJDR-UHFFFAOYSA-N	285.101445402							6413
Fusaric acid	LSM-3944	5-Butylpicolinic Acid, Fusaric-Acid, Fusaric Acid	3442	InChI=1S/C10H13NO2/c1-2-3-4-8-5-6-9(10(12)13)11-7-8/h5-7H,2-4H2,1H3,(H,12,13)	DGMPVYSXXIOGJY-UHFFFAOYSA-N	CCCCc1ccc(nc1)C(=O)O	BroadT	BRD-K87049188	BRD-K87049188-001-03-6	Prestwick Chemical Inc.	Prestw-442	D0701-MP04-ST03-200-		CCCCc1ccc(nc1)C(O)=O	InChI=1S/C10H13NO2/c1-2-3-4-8-5-6-9(10(12)13)11-7-8/h5-7H,2-4H2,1H3,(H,12,13)	DGMPVYSXXIOGJY-UHFFFAOYSA-N	179.094628666							5199
Moxisylyte	LSM-5868	Thymoxamine, Moxisylyte, Acetoxythymoxamine, Moxisylyte HCl	4260	InChI=1S/C16H25NO3/c1-11(2)14-10-15(20-13(4)18)12(3)9-16(14)19-8-7-17(5)6/h9-11H,7-8H2,1-6H3	VRYMTAVOXVTQEF-UHFFFAOYSA-N	CC(C)c1cc(OC(=O)C)c(C)cc1OCCN(C)C	BroadT	BRD-K81144366	BRD-K81144366-003-03-1	Prestwick Chemical Inc.	Prestw-42	D0701-MP04-ST03-200-	Cl	CC(C)c1cc(OC(C)=O)c(C)cc1OCCN(C)C.Cl	InChI=1S/C16H25NO3.ClH/c1-11(2)14-10-15(20-13(4)18)12(3)9-16(14)19-8-7-17(5)6;/h9-11H,7-8H2,1-6H3;1H	IPWGSXZCDPTDEH-UHFFFAOYSA-N	279.18344367							94754, 94754
Buspirone	LSM-4105	Buspar, Buspirone	2477	InChI=1S/C21H31N5O2/c27-18-16-21(6-1-2-7-21)17-19(28)26(18)11-4-3-10-24-12-14-25(15-13-24)20-22-8-5-9-23-20/h5,8-9H,1-4,6-7,10-17H2	QWCRAEMEVRGPNT-UHFFFAOYSA-N	O=C1CC2(CCCC2)CC(=O)N1CCCCN3CCN(CC3)c4ncccn4	BroadT	BRD-K93461745	BRD-K93461745-001-01-5	Biomol International Inc.	AC-526	2813-N1283		O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1ncccn1	InChI=1S/C21H31N5O2/c27-18-16-21(6-1-2-7-21)17-19(28)26(18)11-4-3-10-24-12-14-25(15-13-24)20-22-8-5-9-23-20/h5,8-9H,1-4,6-7,10-17H2	QWCRAEMEVRGPNT-UHFFFAOYSA-N	385.247775282							3223, 3223
1-(3-Chlorophenyl)-4-hexylpiperazine	LSM-4106	BRD-K93541117	610696	InChI=1S/C16H25ClN2/c1-2-3-4-5-9-18-10-12-19(13-11-18)16-8-6-7-15(17)14-16/h6-8,14H,2-5,9-13H2,1H3	QTPPYQBUYPBJIC-UHFFFAOYSA-N	CCCCCCN1CCN(CC1)c2cccc(Cl)c2	BroadT	BRD-K93541117	BRD-K93541117-001-01-4	Biomol International Inc.	NS-110	2813-N1283		CCCCCCN1CCN(CC1)c1cccc(Cl)c1	InChI=1S/C16H25ClN2/c1-2-3-4-5-9-18-10-12-19(13-11-18)16-8-6-7-15(17)14-16/h6-8,14H,2-5,9-13H2,1H3	QTPPYQBUYPBJIC-UHFFFAOYSA-N	280.17062653							93638
Prostoglandin B2	LSM-43031	Prostaglandin-B2, SID26754807	5280881	InChI=1S/C20H30O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h4,7,12,14,17,21H,2-3,5-6,8-11,13,15H2,1H3,(H,23,24)/b7-4-,14-12+/t17-/m0/s1	PRFXRIUZNKLRHM-HKVRTXJWSA-N	CCCCC[C@H](O)\C=C\C1=C(C\C=C/CCCC(=O)O)C(=O)CC1	BroadT	BRD-K82865713	BRD-K82865713-001-02-6	Biomol International Inc.	PG004	2840(V2)-3-N1305		CCCCC[C@H](O)\C=C\C1=C(C\C=C/CCCC(O)=O)C(=O)CC1	InChI=1S/C20H30O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h4,7,12,14,17,21H,2-3,5-6,8-11,13,15H2,1H3,(H,23,24)/b7-4-,14-12+/t17-/m0/s1	PRFXRIUZNKLRHM-HKVRTXJWSA-N	334.21440944							28099
BRN 0893050	LSM-4183	Lonidamine	3953	InChI=1S/C15H10Cl2N2O2/c16-11-6-5-9(7-12(11)17)8-19-13-4-2-1-3-10(13)14(18-19)15(20)21/h1-7H,8H2,(H,20,21)	DGRMEXOCSJEPGJ-UHFFFAOYSA-N	OC(=O)c1nn(Cc2ccc(Cl)c(Cl)c2)c3ccccc13	BroadT	BRD-K96670504	BRD-K96670504-001-01-9	MicroSource Discovery Systems Inc.	1503225			OC(=O)c1nn(Cc2ccc(Cl)c(Cl)c2)c2ccccc12	InChI=1S/C15H10Cl2N2O2/c16-11-6-5-9(7-12(11)17)8-19-13-4-2-1-3-10(13)14(18-19)15(20)21/h1-7H,8H2,(H,20,21)	DGRMEXOCSJEPGJ-UHFFFAOYSA-N	320.011933							93699
Melatonin	LSM-4779	Melatonin, N-(2-(5-Methoxy-1H-Indol-3-yl)Ethyl)Acetamide, N-Acetyl-5-Methoxytryptamine	896	InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)	DRLFMBDRBRZALE-UHFFFAOYSA-N	COc1ccc2[nH]cc(CCNC(=O)C)c2c1	BroadT	BRD-K97530723	BRD-K97530723-001-04-3	MicroSource Discovery Systems Inc.	1500690			COc1ccc2[nH]cc(CCNC(C)=O)c2c1	InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)	DRLFMBDRBRZALE-UHFFFAOYSA-N	232.121177772							16796
Norethindrone	LSM-4061	Norethidrone, Norethindrone, Norethisterone, Norlutate, Norlutin, Micronor, Heather, Femhrt, Errin, Combipatch, Camila, Aygestin, Activella, Nor-QD	6230	InChI=1S/C20H26O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,12,15-18,22H,4-11H2,2H3/t15-,16+,17+,18-,19-,20-/m0/s1	VIKNJXKGJWUCNN-XGXHKTLJSA-N	C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C	BroadT	BRD-K92073408	BRD-K92073408-001-03-3	Prestwick Chemical Inc.	Prestw-253	D0701-MP04-ST03-200-		C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C	InChI=1S/C20H26O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,12,15-18,22H,4-11H2,2H3/t15-,16+,17+,18-,19-,20-/m0/s1	VIKNJXKGJWUCNN-XGXHKTLJSA-N	298.193280072							7627
Umbelliferone	LSM-3960	NSC-019790	5281426	InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H	ORHBXUUXSCNDEV-UHFFFAOYSA-N	Oc1ccc2C=CC(=O)Oc2c1	BroadT	BRD-K87991767	BRD-K87991767-001-02-0	AnalytiCon Discovery GmbH	NP-002332			Oc1ccc2ccc(=O)oc2c1	InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H	ORHBXUUXSCNDEV-UHFFFAOYSA-N	162.031694052							27510
Irigenin Trimethyl Ether	LSM-24989	SID26749504	4303569	InChI=1S/C21H22O8/c1-23-14-7-11(8-15(24-2)19(14)26-4)12-10-29-13-9-16(25-3)20(27-5)21(28-6)17(13)18(12)22/h7-10H,1-6H3	NCEXCGUAXVAJMI-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C2=COc3cc(OC)c(OC)c(OC)c3C2=O	BroadT	BRD-K85880973	BRD-K85880973-001-02-7	MicroSource Discovery Systems Inc.	200873			COc1cc(cc(OC)c1OC)-c1coc2cc(OC)c(OC)c(OC)c2c1=O	InChI=1S/C21H22O8/c1-23-14-7-11(8-15(24-2)19(14)26-4)12-10-29-13-9-16(25-3)20(27-5)21(28-6)17(13)18(12)22/h7-10H,1-6H3	NCEXCGUAXVAJMI-UHFFFAOYSA-N	402.131467664							113560
SCHEMBL3363896	LSM-3789	PSB-069	13782419	InChI=1S/C20H13ClN2O5S/c21-10-5-7-11(8-6-10)23-14-9-15(29(26,27)28)18(22)17-16(14)19(24)12-3-1-2-4-13(12)20(17)25/h1-9,23H,22H2,(H,26,27,28)	MHSMKEQLFFWYOS-UHFFFAOYSA-N	Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc4ccc(Cl)cc4)cc1S(=O)(=O)O	BroadT	BRD-K79366068	BRD-K79366068-236-01-5	Tocris Bioscience	2573	1	[Na]	Nc1c(cc(Nc2ccc(Cl)cc2)c2C(=O)c3ccccc3C(=O)c12)S(O)(=O)=O.[Na]	InChI=1S/C20H13ClN2O5S.Na.H/c21-10-5-7-11(8-6-10)23-14-9-15(29(26,27)28)18(22)17-16(14)19(24)12-3-1-2-4-13(12)20(17)25;;/h1-9,23H,22H2,(H,26,27,28);;	KLRKSPLFASYAPG-UHFFFAOYSA-N	428.023369936							93400, 93400
Terconazole	LSM-3923	Triaconazole, Terconazole, Terazol, Panlomyc, Fungistat, Terazol 7, Terazol 3, R-42470, Gyno-Terazol	441383	InChI=1S/C26H31Cl2N5O3/c1-19(2)31-9-11-32(12-10-31)21-4-6-22(7-5-21)34-14-23-15-35-26(36-23,16-33-18-29-17-30-33)24-8-3-20(27)13-25(24)28/h3-8,13,17-19,23H,9-12,14-16H2,1-2H3/t23-,26-/m0/s1	BLSQLHNBWJLIBQ-OZXSUGGESA-N	CC(C)N1CCN(CC1)c2ccc(OC[C@H]3CO[C@@](Cn4cncn4)(O3)c5ccc(Cl)cc5Cl)cc2	BroadT	BRD-K86204871	BRD-K86204871-001-02-2	Prestwick Chemical Inc.	Prestw-495	D0701-MP04-ST03-200-		CC(C)N1CCN(CC1)c1ccc(OC[C@H]2CO[C@@](Cn3cncn3)(O2)c2ccc(Cl)cc2Cl)cc1	InChI=1S/C26H31Cl2N5O3/c1-19(2)31-9-11-32(12-10-31)21-4-6-22(7-5-21)34-14-23-15-35-26(36-23,16-33-18-29-17-30-33)24-8-3-20(27)13-25(24)28/h3-8,13,17-19,23H,9-12,14-16H2,1-2H3/t23-,26-/m0/s1	BLSQLHNBWJLIBQ-OZXSUGGESA-N	531.180395322							82980
Scopoletin	LSM-6694	NSC-405647	5280460	InChI=1S/C10H8O4/c1-13-9-4-6-2-3-10(12)14-8(6)5-7(9)11/h2-5,11H,1H3	RODXRVNMMDRFIK-UHFFFAOYSA-N	COc1cc2C=CC(=O)Oc2cc1O	BroadT	BRD-K96163925	BRD-K96163925-001-06-5	Prestwick Chemical Inc.	Prestw-962	D0701-MP04-ST03-200-		COc1cc2ccc(=O)oc2cc1O	InChI=1S/C10H8O4/c1-13-9-4-6-2-3-10(12)14-8(6)5-7(9)11/h2-5,11H,1H3	RODXRVNMMDRFIK-UHFFFAOYSA-N	192.042258736							17488
Chelerythrine	LSM-1187	Chelerythrine	2703	InChI=1S/C21H18NO4/c1-22-10-16-13(6-7-17(23-2)21(16)24-3)14-5-4-12-8-18-19(26-11-25-18)9-15(12)20(14)22/h4-10H,11H2,1-3H3/q+1	LLEJIEBFSOEYIV-UHFFFAOYSA-N	COc1ccc2c(c[n+](C)c3c2ccc4cc5OCOc5cc34)c1OC	BroadT	BRD-K87904882	BRD-K87904882-001-02-3	Biomol International Inc.	EI225	2840(V2)-3-N1305		COc1ccc2c(c[n+](C)c3c4cc5OCOc5cc4ccc23)c1OC	InChI=1S/C21H18NO4/c1-22-10-16-13(6-7-17(23-2)21(16)24-3)14-5-4-12-8-18-19(26-11-25-18)9-15(12)20(14)22/h4-10H,11H2,1-3H3/q+1	LLEJIEBFSOEYIV-UHFFFAOYSA-N	348.123583066							78373, 78373, 78373
Metampicillin	LSM-15186	Metampicillin	6713928	InChI=1S/C17H19N3O4S/c1-17(2)12(16(23)24)20-14(22)11(15(20)25-17)19-13(21)10(18-3)9-7-5-4-6-8-9/h4-8,10-12,15H,3H2,1-2H3,(H,19,21)(H,23,24)/t10-,11-,12+,15-/m1/s1	FZECHKJQHUVANE-MCYUEQNJSA-N	CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N=C)c3ccccc3)C(=O)N2[C@H]1C(=O)O	BroadT	BRD-K83350436	BRD-K83350436-236-03-4	Prestwick Chemical Inc.	Prestw-235	D0701-MP04-ST03-200-	[Na]	CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N=C)c3ccccc3)C(=O)N2[C@H]1C(O)=O.[Na]	InChI=1S/C17H19N3O4S.Na.H/c1-17(2)12(16(23)24)20-14(22)11(15(20)25-17)19-13(21)10(18-3)9-7-5-4-6-8-9;;/h4-8,10-12,15H,3H2,1-2H3,(H,19,21)(H,23,24);;/t10-,11-,12+,15-;;/m1../s1	LMPGRXLGFJUNKF-NJMJPTHBSA-N	361.109626808							52060, 52060
AC1NTUSE	LSM-15374	BRD-K81447180	5388973	InChI=1S/C18H34N2O6S/c1-5-6-10-7-11(20(3)8-10)17(25)19-12(9(2)21)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,21-24H,5-8H2,1-4H3,(H,19,25)/t9-,10-,11+,12-,13+,14+,15-,16-,18-/m1/s1	OJMMVQQUTAEWLP-HZUSHKNOSA-N	CCC[C@@H]1C[C@H](N(C)C1)C(=O)N[C@H]([C@@H](C)O)[C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@@H]2O	BroadT	BRD-K81447180	BRD-K81447180-003-03-2	Prestwick Chemical Inc.	Prestw-302	D0701-MP04-ST03-200-	Cl	CCC[C@@H]1C[C@H](N(C)C1)C(=O)N[C@H]([C@@H](C)O)[C@H]1O[C@H](SC)[C@H](O)[C@@H](O)[C@@H]1O.Cl	InChI=1S/C18H34N2O6S.ClH/c1-5-6-10-7-11(20(3)8-10)17(25)19-12(9(2)21)16-14(23)13(22)15(24)18(26-16)27-4;/h9-16,18,21-24H,5-8H2,1-4H3,(H,19,25);1H/t9-,10-,11+,12-,13+,14+,15-,16-,18-;/m1./s1	POUMFISTNHIPTI-DKEHCADZSA-N	406.213757518							104018, 104018
Clorsulon	LSM-6008	Clorsulon, MK-401	43231	InChI=1S/C8H8Cl3N3O4S2/c9-7(8(10)11)3-1-4(12)6(20(14,17)18)2-5(3)19(13,15)16/h1-2H,12H2,(H2,13,15,16)(H2,14,17,18)	QOVTVIYTBRHADL-UHFFFAOYSA-N	Nc1cc(C(=C(Cl)Cl)Cl)c(cc1S(=O)(=O)N)S(=O)(=O)N	BroadT	BRD-K97521363	BRD-K97521363-001-03-9	MicroSource Discovery Systems Inc.	1505115			Nc1cc(C(Cl)=C(Cl)Cl)c(cc1S(N)(=O)=O)S(N)(=O)=O	InChI=1S/C8H8Cl3N3O4S2/c9-7(8(10)11)3-1-4(12)6(20(14,17)18)2-5(3)19(13,15)16/h1-2H,12H2,(H2,13,15,16)(H2,14,17,18)	QOVTVIYTBRHADL-UHFFFAOYSA-N	378.902180276							94811
PI828	LSM-4198	PI-828	25181195	InChI=1S/C19H18N2O3/c20-14-6-4-13(5-7-14)15-2-1-3-16-17(22)12-18(24-19(15)16)21-8-10-23-11-9-21/h1-7,12H,8-11,20H2	WUKMIBOGGXMBAC-UHFFFAOYSA-N	Nc1ccc(cc1)c2cccc3C(=O)C=C(Oc23)N4CCOCC4	BroadT	BRD-K97365803	BRD-K97365803-001-01-3	Tocris Bioscience	2814	1		Nc1ccc(cc1)-c1cccc2c1oc(cc2=O)N1CCOCC1	InChI=1S/C19H18N2O3/c20-14-6-4-13(5-7-14)15-2-1-3-16-17(22)12-18(24-19(15)16)21-8-10-23-11-9-21/h1-7,12H,8-11,20H2	WUKMIBOGGXMBAC-UHFFFAOYSA-N	322.131742456							93710
2,5-Di-tert-butylhydroquinone	LSM-24990	BRD-K95603879, Di-Tert-Butylhydroquinone	2374	InChI=1S/C14H22O2/c1-13(2,3)9-7-12(16)10(8-11(9)15)14(4,5)6/h7-8,15-16H,1-6H3	JZODKRWQWUWGCD-UHFFFAOYSA-N	CC(C)(C)c1cc(O)c(cc1O)C(C)(C)C	BroadT	BRD-K95603879	BRD-K95603879-001-03-4	Biomol International Inc.	CA-420	2840(V2)-3-N1305		CC(C)(C)c1cc(O)c(cc1O)C(C)(C)C	InChI=1S/C14H22O2/c1-13(2,3)9-7-12(16)10(8-11(9)15)14(4,5)6/h7-8,15-16H,1-6H3	JZODKRWQWUWGCD-UHFFFAOYSA-N	222.161979944							41094
Methomyl	LSM-45098	BRD-K87817668	5353758	InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-	UHXUZOCRWCRNSJ-DAXSKMNVSA-N	CNC(=O)O\N=C(\C)/SC	BroadT	BRD-K87817668	BRD-K87817668-001-02-7	MicroSource Discovery Systems Inc.	330060			CNC(=O)O\N=C(\C)SC	InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4-	UHXUZOCRWCRNSJ-DAXSKMNVSA-N	162.04629827							
ML 3163	LSM-4138	ML-3163	9845197	InChI=1S/C22H18FN3OS2/c1-29(27)19-8-2-15(3-9-19)14-28-22-25-20(16-4-6-18(23)7-5-16)21(26-22)17-10-12-24-13-11-17/h2-13H,14H2,1H3,(H,25,26)	PRYUWQSCZBKGMW-UHFFFAOYSA-N	CS(=O)c1ccc(CSc2nc(c([nH]2)-c2ccncc2)-c2ccc(F)cc2)cc1	BroadT	BRD-K95202259	BRD-K95202259-001-01-9	Calbiochem	475800			C[S+](O)c1ccc(CSc2nc(c([nH]2)-c2ccc(F)cc2)-c2ccncc2)cc1	InChI=1S/C22H19FN3OS2/c1-29(27)19-8-2-15(3-9-19)14-28-22-25-20(16-4-6-18(23)7-5-16)21(26-22)17-10-12-24-13-11-17/h2-13,27H,14H2,1H3,(H,25,26)/q+1	ANMPJJNVRCURIU-UHFFFAOYSA-N	423.087531806							
Isomammeisin	LSM-4064	Isomammeisin, Mammea-A	5748555	InChI=1S/C25H26O5/c1-14(2)10-11-17-23(28)21-18(16-8-6-5-7-9-16)13-20(27)30-25(21)22(24(17)29)19(26)12-15(3)4/h5-10,13,15,28-29H,11-12H2,1-4H3	SBHOAZQBEGVQLJ-UHFFFAOYSA-N	CC(C)CC(=O)c1c(O)c(CC=C(C)C)c(O)c2C(=CC(=O)Oc12)c3ccccc3	BroadT	BRD-K92138166	BRD-K92138166-001-01-0	MicroSource Discovery Systems Inc.	211996			CC(C)CC(=O)c1c(O)c(CC=C(C)C)c(O)c2c(cc(=O)oc12)-c1ccccc1	InChI=1S/C25H26O5/c1-14(2)10-11-17-23(28)21-18(16-8-6-5-7-9-16)13-20(27)30-25(21)22(24(17)29)19(26)12-15(3)4/h5-10,13,15,28-29H,11-12H2,1-4H3	SBHOAZQBEGVQLJ-UHFFFAOYSA-N	406.178023932							69992
Dimethoate	LSM-24992	SID26747707, SID26753684, SID26753685, SID93576770	3082	InChI=1S/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)	MCWXGJITAZMZEV-UHFFFAOYSA-N	CNC(=O)CSP(=S)(OC)OC	BroadT	BRD-K94763113	BRD-K94763113-001-02-5	MicroSource Discovery Systems Inc.	330020			CNC(=O)CSP(=S)(OC)OC	InChI=1S/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)	MCWXGJITAZMZEV-UHFFFAOYSA-N	228.999621144							34714
PD-198306	LSM-3974	SID50112932	9956637	InChI=1S/C18H16F3IN2O2/c1-9-6-11(22)4-5-14(9)23-17-12(7-13(19)15(20)16(17)21)18(25)24-26-8-10-2-3-10/h4-7,10,23H,2-3,8H2,1H3,(H,24,25)	UHAXDAKQGVISBZ-UHFFFAOYSA-N	Cc1cc(I)ccc1Nc2c(F)c(F)c(F)cc2C(=O)NOCC3CC3	BroadT	BRD-K88677950	BRD-K88677950-001-01-3	Tocris Bioscience	2605	1		Cc1cc(I)ccc1Nc1c(F)c(F)c(F)cc1C(=O)NOCC1CC1	InChI=1S/C18H16F3IN2O2/c1-9-6-11(22)4-5-14(9)23-17-12(7-13(19)15(20)16(17)21)18(25)24-26-8-10-2-3-10/h4-7,10,23H,2-3,8H2,1H3,(H,24,25)	UHAXDAKQGVISBZ-UHFFFAOYSA-N	476.020855372							93541
Emodic acid	LSM-4128	Emodic-Acid, Emodic Acid	361510	InChI=1S/C15H8O7/c16-6-3-8-12(10(18)4-6)14(20)11-7(13(8)19)1-5(15(21)22)2-9(11)17/h1-4,16-18H,(H,21,22)	ZJXVNNSMRGTDBI-UHFFFAOYSA-N	OC(=O)c1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1	BroadT	BRD-K94841585	BRD-K94841585-001-02-8	AnalytiCon Discovery GmbH	NP-001571			OC(=O)c1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1	InChI=1S/C15H8O7/c16-6-3-8-12(10(18)4-6)14(20)11-7(13(8)19)1-5(15(21)22)2-9(11)17/h1-4,16-18H,(H,21,22)	ZJXVNNSMRGTDBI-UHFFFAOYSA-N	300.027002596							93655
Pirenzepine	LSM-4001	Pirenzepine	4848	InChI=1S/C19H21N5O2/c1-22-9-11-23(12-10-22)13-17(25)24-16-7-3-2-5-14(16)19(26)21-15-6-4-8-20-18(15)24/h2-8H,9-13H2,1H3,(H,21,26)	RMHMFHUVIITRHF-UHFFFAOYSA-N	CN1CCN(CC(=O)N2c3ccccc3C(=O)Nc4cccnc24)CC1	BroadT	BRD-K89375097	BRD-K89375097-300-04-7	MicroSource Discovery Systems Inc.	1501138		Cl.Cl	CN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1.Cl.Cl	InChI=1S/C19H21N5O2.2ClH/c1-22-9-11-23(12-10-22)13-17(25)24-16-7-3-2-5-14(16)19(26)21-15-6-4-8-20-18(15)24;;/h2-8H,9-13H2,1H3,(H,21,26);2*1H	FFNMBRCFFADNAO-UHFFFAOYSA-N	351.169524962							8247, 8247, 8247
Dicoumarol	LSM-5884		54676038	InChI=1S/C19H12O6/c20-16-10-5-1-3-7-14(10)24-18(22)12(16)9-13-17(21)11-6-2-4-8-15(11)25-19(13)23/h1-8,12-13H,9H2	HIZKPJUTKKJDGA-UHFFFAOYSA-N	O=C1Oc2ccccc2C(=O)C1CC1C(=O)Oc2ccccc2C1=O	BroadT	BRD-K82236179	BRD-K82236179-001-04-3	MicroSource Discovery Systems Inc.	1500239			Oc1c(Cc2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12	InChI=1S/C19H12O6/c20-16-10-5-1-3-7-14(10)24-18(22)12(16)9-13-17(21)11-6-2-4-8-15(11)25-19(13)23/h1-8,20-21H,9H2	DOBMPNYZJYQDGZ-UHFFFAOYSA-N	336.063388104							
Ethylisothiourea	LSM-15215	2-Ethyl-Isothiourea	5139	InChI=1S/C3H8N2S/c1-2-6-3(4)5/h2H2,1H3,(H3,4,5)	VFIZBHJTOHUOEK-UHFFFAOYSA-N	CCSC(=N)N	BroadT	BRD-K81623406	BRD-K81623406-004-03-4	Tocris Bioscience	873	1	Br	CCSC(N)=N.Br	InChI=1S/C3H8N2S.BrH/c1-2-6-3(4)5;/h2H2,1H3,(H3,4,5);1H	SWXXKWPYNMZFTE-UHFFFAOYSA-N	104.040818966							, 
Estrone	LSM-3837	Theelin, Oestrone, Estrone, Estrogenic Substance	5870	InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-16,19H,2,4,6-9H2,1H3/t14-,15-,16+,18+/m1/s1	DNXHEGUUPJUMQT-CBZIJGRNSA-N	C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CCC2=O	BroadT	BRD-K81839095	BRD-K81839095-001-02-0	AnalytiCon Discovery GmbH	NP-010065			C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CCC2=O	InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-16,19H,2,4,6-9H2,1H3/t14-,15-,16+,18+/m1/s1	DNXHEGUUPJUMQT-CBZIJGRNSA-N	270.161979944							17263
NNC 05-2090	LSM-3905	NNC-05-2090, SID50112984	9888030	InChI=1S/C27H30N2O2/c1-31-26-14-7-4-11-23(26)27(30)15-19-28(20-16-27)17-8-18-29-24-12-5-2-9-21(24)22-10-3-6-13-25(22)29/h2-7,9-14,30H,8,15-20H2,1H3	XZZYCJOGZYEPPW-UHFFFAOYSA-N	COc1ccccc1C2(O)CCN(CCCn3c4ccccc4c5ccccc35)CC2	BroadT	BRD-K85015012	BRD-K85015012-003-01-1	Tocris Bioscience	2747	1	Cl	COc1ccccc1C1(O)CCN(CCCn2c3ccccc3c3ccccc23)CC1.Cl	InChI=1S/C27H30N2O2.ClH/c1-31-26-14-7-4-11-23(26)27(30)15-19-28(20-16-27)17-8-18-29-24-12-5-2-9-21(24)22-10-3-6-13-25(22)29;/h2-7,9-14,30H,8,15-20H2,1H3;1H	WDFXPKKFSNMGOO-UHFFFAOYSA-N	414.23072822							93487
Triamterene	LSM-4060	Triamterene, Dyrenium, SK&F-8542, SK-8542	5546	InChI=1S/C12H11N7/c13-9-7(6-4-2-1-3-5-6)16-8-10(14)18-12(15)19-11(8)17-9/h1-5H,(H6,13,14,15,17,18,19)	FNYLWPVRPXGIIP-UHFFFAOYSA-N	Nc1nc(N)c2nc(c(N)nc2n1)c3ccccc3	BroadT	BRD-K92049597	BRD-K92049597-001-04-2	MicroSource Discovery Systems Inc.	1500589			Nc1nc(N)c2nc(-c3ccccc3)c(N)nc2n1	InChI=1S/C12H11N7/c13-9-7(6-4-2-1-3-5-6)16-8-10(14)18-12(15)19-11(8)17-9/h1-5H,(H6,13,14,15,17,18,19)	FNYLWPVRPXGIIP-UHFFFAOYSA-N	253.107593422							93604
(+)-Tranylcypromine	LSM-5943	Tranylcypromine, Trans-2-Phenylcyclopropanamine, Trans-2-Phenylcyclopropylamine, (+)-Tranylcypromine, (-)-Tranylcypromine	26070	InChI=1S/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9+/m1/s1	AELCINSCMGFISI-BDAKNGLRSA-N	N[C@H]1C[C@@H]1c2ccccc2	BroadT	BRD-K88809146	BRD-K88809146-003-02-1	Prestwick Chemical Inc.	Prestw-173	D0701-MP04-ST03-200-	Cl	N[C@H]1C[C@@H]1c1ccccc1.Cl	InChI=1S/C9H11N.ClH/c10-9-6-8(9)7-4-2-1-3-5-7;/h1-5,8-9H,6,10H2;1H/t8-,9+;/m1./s1	ZPEFMSTTZXJOTM-RJUBDTSPSA-N	133.089149362							131511, 94791, 94791, 131511, 131511, 94791
3,5-Bis(4-nitrophenoxy)benzoic acid	LSM-24993	SID50112954, BRD-K98143539	16760376	InChI=1S/C19H12N2O8/c22-19(23)12-9-17(28-15-5-1-13(2-6-15)20(24)25)11-18(10-12)29-16-7-3-14(4-8-16)21(26)27/h1-11H,(H,22,23)	JOSXKPZXMVHRKU-UHFFFAOYSA-N	OC(=O)c1cc(Oc2ccc(cc2)[N+](=O)[O-])cc(Oc3ccc(cc3)[N+](=O)[O-])c1	BroadT	BRD-K98143539	BRD-K98143539-001-01-4	Tocris Bioscience	2654	1		OC(=O)c1cc(Oc2ccc(cc2)[N+]([O-])=O)cc(Oc2ccc(cc2)[N+]([O-])=O)c1	InChI=1S/C19H12N2O8/c22-19(23)12-9-17(28-15-5-1-13(2-6-15)20(24)25)11-18(10-12)29-16-7-3-14(4-8-16)21(26)27/h1-11H,(H,22,23)	JOSXKPZXMVHRKU-UHFFFAOYSA-N	396.059365364							113561
2-Phenylethyl 3-(3,4-dihydroxyphenyl)prop-2-enoate	LSM-3894	Caffeic-Acid	108042	InChI=1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2	SWUARLUWKZWEBQ-UHFFFAOYSA-N	Oc1ccc(C=CC(=O)OCCc2ccccc2)cc1O	BroadT	BRD-K84709232	BRD-K84709232-001-02-6	Tocris Bioscience	2743	1		Oc1ccc(C=CC(=O)OCCc2ccccc2)cc1O	InChI=1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2	SWUARLUWKZWEBQ-UHFFFAOYSA-N	284.104858992							93478
Trapidil	LSM-4152	Trapymin, Trapidil, AR-12008	5531	InChI=1S/C10H15N5/c1-4-14(5-2)9-6-8(3)13-10-11-7-12-15(9)10/h6-7H,4-5H2,1-3H3	GSNOZLZNQMLSKJ-UHFFFAOYSA-N	CCN(CC)c1cc(C)nc2ncnn12	BroadT	BRD-K95763993	BRD-K95763993-001-03-7	Prestwick Chemical Inc.	Prestw-1012	D0701-MP04-ST03-200-		CCN(CC)c1cc(C)nc2ncnn12	InChI=1S/C10H15N5/c1-4-14(5-2)9-6-8(3)13-10-11-7-12-15(9)10/h6-7H,4-5H2,1-3H3	GSNOZLZNQMLSKJ-UHFFFAOYSA-N	205.13274553							93675
Cabergoline	LSM-3939	Cabergoline, Dostinex, FCE-21336	54746	InChI=1S/C26H37N5O2/c1-5-11-30-17-19(25(32)31(26(33)27-6-2)13-8-12-29(3)4)14-21-20-9-7-10-22-24(20)18(16-28-22)15-23(21)30/h5,7,9-10,16,19,21,23,28H,1,6,8,11-15,17H2,2-4H3,(H,27,33)/t19-,21-,23-/m1/s1	KORNTPPJEAJQIU-KJXAQDMKSA-N	CCNC(=O)N(CCCN(C)C)C(=O)[C@@H]1C[C@H]2[C@@H](Cc3c[nH]c4cccc2c34)N(CC=C)C1	BroadT	BRD-K86882815	BRD-K86882815-001-01-6	Biomol International Inc.	AC-1359	2812-3-N1298		CCNC(=O)N(CCCN(C)C)C(=O)[C@@H]1C[C@H]2[C@@H](Cc3c[nH]c4cccc2c34)N(CC=C)C1	InChI=1S/C26H37N5O2/c1-5-11-30-17-19(25(32)31(26(33)27-6-2)13-8-12-29(3)4)14-21-20-9-7-10-22-24(20)18(16-28-22)15-23(21)30/h5,7,9-10,16,19,21,23,28H,1,6,8,11-15,17H2,2-4H3,(H,27,33)/t19-,21-,23-/m1/s1	KORNTPPJEAJQIU-KJXAQDMKSA-N	451.294725474							3286
Farnesyl Thiotriazole	LSM-43047	Farnesylthiotriazole	5353633	InChI=1S/C17H27N3S/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-21-17-18-13-19-20-17/h7,9,11,13H,5-6,8,10,12H2,1-4H3,(H,18,19,20)/b15-9+,16-11+	QFXNCKFWHATRCH-XGGJEREUSA-N	CC(=CCC\C(=C\CC\C(=C\CSc1nc[nH]n1)\C)\C)C	BroadT	BRD-K96402602	BRD-K96402602-001-01-8	EMD Biosciences	344600			CC(C)=CCC\C(C)=C\CC\C(C)=C\CSc1nc[nH]n1	InChI=1S/C17H27N3S/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-21-17-18-13-19-20-17/h7,9,11,13H,5-6,8,10,12H2,1-4H3,(H,18,19,20)/b15-9+,16-11+	QFXNCKFWHATRCH-XGGJEREUSA-N	305.192568584							
Beta CCP	LSM-3910	Beta-CCP	123662	InChI=1S/C15H14N2O2/c1-2-7-19-15(18)13-8-11-10-5-3-4-6-12(10)17-14(11)9-16-13/h3-6,8-9,17H,2,7H2,1H3	WGRVAGIQTHEEQW-UHFFFAOYSA-N	CCCOC(=O)c1cc2c(cn1)[nH]c3ccccc23	BroadT	BRD-K85242180	BRD-K85242180-001-01-1	Biomol International Inc.	AC-197	2819-N1292		CCCOC(=O)c1cc2c(cn1)[nH]c1ccccc21	InChI=1S/C15H14N2O2/c1-2-7-19-15(18)13-8-11-10-5-3-4-6-12(10)17-14(11)9-16-13/h3-6,8-9,17H,2,7H2,1H3	WGRVAGIQTHEEQW-UHFFFAOYSA-N	254.105527708							93491
Scopolamine	LSM-4015	BRD-A93048969	3000322	InChI=1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11?,12-,13-,14+,15-,16+/m1/s1	STECJAGHUSJQJN-USLFZFAMSA-N	CN1[C@H]2CC(C[C@@H]1[C@H]3O[C@@H]23)OC(=O)[C@H](CO)c4ccccc4	BroadT	BRD-K89923877	BRD-K89923877-003-02-4	Prestwick Chemical Inc.	Prestw-877	D0701-MP04-ST03-200-	Cl	CN1[C@H]2C[C@@H](C[C@@H]1[C@H]1O[C@@H]21)OC(=O)[C@H](CO)c1ccccc1.Cl	InChI=1S/C17H21NO4.ClH/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10;/h2-6,11-16,19H,7-9H2,1H3;1H/t11-,12-,13-,14+,15-,16+;/m1./s1	KXPXJGYSEPEXMF-MOUKNHLCSA-N	303.147058162							93572, 93572
AM 251	LSM-4057	AM-251	2125	InChI=1S/C22H21Cl2IN4O/c1-14-20(22(30)27-28-11-3-2-4-12-28)26-29(19-10-7-16(23)13-18(19)24)21(14)15-5-8-17(25)9-6-15/h5-10,13H,2-4,11-12H2,1H3,(H,27,30)	BUZAJRPLUGXRAB-UHFFFAOYSA-N	Cc1c(nn(c2ccc(Cl)cc2Cl)c1c3ccc(I)cc3)C(=O)NN4CCCCC4	BroadT	BRD-K92000912	BRD-K92000912-001-06-8	Tocris Bioscience	1117	15		Cc1c(nn(c1-c1ccc(I)cc1)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1	InChI=1S/C22H21Cl2IN4O/c1-14-20(22(30)27-28-11-3-2-4-12-28)26-29(19-10-7-16(23)13-18(19)24)21(14)15-5-8-17(25)9-6-15/h5-10,13H,2-4,11-12H2,1H3,(H,27,30)	BUZAJRPLUGXRAB-UHFFFAOYSA-N	554.013709752							90724
Droperidol	LSM-4193		3168	InChI=1S/C22H22FN3O2/c23-17-9-7-16(8-10-17)21(27)6-3-13-25-14-11-18(12-15-25)26-20-5-2-1-4-19(20)24-22(26)28/h1-2,4-5,7-11H,3,6,12-15H2,(H,24,28)	RMEDXOLNCUSCGS-UHFFFAOYSA-N	Oc1nc2ccccc2n1C3=CCN(CCCC(=O)c4ccc(F)cc4)CC3	BroadT	BRD-K97158071	BRD-K97158071-001-04-1	MicroSource Discovery Systems Inc.	1501002			Fc1ccc(cc1)C(=O)CCCN1CCC(=CC1)n1c2ccccc2[nH]c1=O	InChI=1S/C22H22FN3O2/c23-17-9-7-16(8-10-17)21(27)6-3-13-25-14-11-18(12-15-25)26-20-5-2-1-4-19(20)24-22(26)28/h1-2,4-5,7-11H,3,6,12-15H2,(H,24,28)	RMEDXOLNCUSCGS-UHFFFAOYSA-N	379.169605174							4717
Chlorothiazide	LSM-5942	Diuril, Chlorthiazide, Chlorothiazide	2720	InChI=1S/C7H6ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-3H,(H,10,11)(H2,9,12,13)	JBMKAUGHUNFTOL-UHFFFAOYSA-N	NS(=O)(=O)c1cc2c(cc1Cl)N=CNS2(=O)=O	BroadT	BRD-K88682005	BRD-K88682005-001-04-2	MicroSource Discovery Systems Inc.	1500180			NS(=O)(=O)c1cc2c(cc1Cl)N=CNS2(=O)=O	InChI=1S/C7H6ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-3H,(H,10,11)(H2,9,12,13)	JBMKAUGHUNFTOL-UHFFFAOYSA-N	294.948824792							3640, 3640
Spironolactone	LSM-4018	Spironolactone, Aldactone	5833	InChI=1S/C24H32O4S/c1-14(25)29-19-13-15-12-16(26)4-8-22(15,2)17-5-9-23(3)18(21(17)19)6-10-24(23)11-7-20(27)28-24/h12,17-19,21H,4-11,13H2,1-3H3/t17-,18-,19+,21+,22-,23-,24+/m0/s1	LXMSZDCAJNLERA-ZHYRCANASA-N	CC(=O)S[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]45CCC(=O)O5)[C@H]13	BroadT	BRD-K90027355	BRD-K90027355-001-03-4	Prestwick Chemical Inc.	Prestw-128	D0701-MP04-ST03-200-		CC(=O)S[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@H]2CC[C@@]3(C)[C@@H](CC[C@@]33CCC(=O)O3)[C@H]12	InChI=1S/C24H32O4S/c1-14(25)29-19-13-15-12-16(26)4-8-22(15,2)17-5-9-23(3)18(21(17)19)6-10-24(23)11-7-20(27)28-24/h12,17-19,21H,4-11,13H2,1-3H3/t17-,18-,19+,21+,22-,23-,24+/m0/s1	LXMSZDCAJNLERA-ZHYRCANASA-N	416.202130194							9241
Doxorubicin	LSM-4062	Hydroxydaunorubicin, Rubex, Doxorubicin, Doxil, Adriblastina, Adriamycin	31703	InChI=1S/C27H29NO11/c1-10-22(31)13(28)6-17(38-10)39-15-8-27(36,16(30)9-29)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34/h3-5,10,13,15,17,22,29,31,33,35-36H,6-9,28H2,1-2H3/t10-,13-,15-,17-,22+,27-/m0/s1	AOJJSUZBOXZQNB-TZSSRYMLSA-N	COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)CO	BroadT	BRD-K92093830	BRD-K92093830-003-05-0	Prestwick Chemical Inc.	Prestw-438	D0701-MP04-ST03-200-	Cl	COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)CO.Cl	InChI=1S/C27H29NO11.ClH/c1-10-22(31)13(28)6-17(38-10)39-15-8-27(36,16(30)9-29)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34;/h3-5,10,13,15,17,22,29,31,33,35-36H,6-9,28H2,1-2H3;1H/t10-,13-,15-,17-,22+,27-;/m0./s1	MWWSFMDVAYGXBV-RUELKSSGSA-N	543.174060758							28748, 28748, 28748, 28748
PHA-665752	LSM-42793	PHA-665752, TCMDC-125885	10461815	InChI=1S/C32H34Cl2N4O4S/c1-19-29(35-20(2)30(19)32(40)38-14-6-7-21(38)17-37-12-3-4-13-37)16-24-23-15-22(10-11-28(23)36-31(24)39)43(41,42)18-25-26(33)8-5-9-27(25)34/h5,8-11,15-16,21,35H,3-4,6-7,12-14,17-18H2,1-2H3,(H,36,39)/b24-16-/t21-/m1/s1	OYONTEXKYJZFHA-SSHUPFPWSA-N	Cc1[nH]c(\C=C\2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc4c(Cl)cccc4Cl)c(C)c1C(=O)N5CCC[C@@H]5CN6CCCC6	BroadT	BRD-K95435023	BRD-K95435023-001-01-0	Tocris Bioscience	2693	2		Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1	InChI=1S/C32H34Cl2N4O4S/c1-19-29(35-20(2)30(19)32(40)38-14-6-7-21(38)17-37-12-3-4-13-37)16-24-23-15-22(10-11-28(23)36-31(24)39)43(41,42)18-25-26(33)8-5-9-27(25)34/h5,8-11,15-16,21,35H,3-4,6-7,12-14,17-18H2,1-2H3,(H,36,39)/b24-16-/t21-/m1/s1	OYONTEXKYJZFHA-SSHUPFPWSA-N	640.167781718001							90197
Mevastatin	LSM-4123	Mevastatin	64715	InChI=1S/C23H34O5/c1-4-14(2)23(26)28-20-7-5-6-16-9-8-15(3)19(22(16)20)11-10-18-12-17(24)13-21(25)27-18/h6,8-9,14-15,17-20,22,24H,4-5,7,10-13H2,1-3H3/t14-,15-,17+,18+,19-,20-,22-/m0/s1	AJLFOPYRIVGYMJ-INTXDZFKSA-N	CC[C@H](C)C(=O)O[C@H]1CCC=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12	BroadT	BRD-K94441233	BRD-K94441233-001-03-1	Tocris Bioscience	1526	1		CC[C@H](C)C(=O)O[C@H]1CCC=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12	InChI=1S/C23H34O5/c1-4-14(2)23(26)28-20-7-5-6-16-9-8-15(3)19(22(16)20)11-10-18-12-17(24)13-21(25)27-18/h6,8-9,14-15,17-20,22,24H,4-5,7,10-13H2,1-3H3/t14-,15-,17+,18+,19-,20-,22-/m0/s1	AJLFOPYRIVGYMJ-INTXDZFKSA-N	390.240624188							34848
Y-134	LSM-4127	SID50112966	11784736	InChI=1S/C28H28N2O3S/c1-18(2)29-13-15-30(16-14-29)21-7-3-19(4-8-21)27(33)26-24-12-11-23(32)17-25(24)34-28(26)20-5-9-22(31)10-6-20/h3-12,17-18,31-32H,13-16H2,1-2H3	LQEOPHGPHCWOAC-UHFFFAOYSA-N	CC(C)N1CCN(CC1)c2ccc(cc2)C(=O)c3c(sc4cc(O)ccc34)c5ccc(O)cc5	BroadT	BRD-K94832621	BRD-K94832621-001-01-5	Tocris Bioscience	2676	1		CC(C)N1CCN(CC1)c1ccc(cc1)C(=O)c1c(sc2cc(O)ccc12)-c1ccc(O)cc1	InChI=1S/C28H28N2O3S/c1-18(2)29-13-15-30(16-14-29)21-7-3-19(4-8-21)27(33)26-24-12-11-23(32)17-25(24)34-28(26)20-5-9-22(31)10-6-20/h3-12,17-18,31-32H,13-16H2,1-2H3	LQEOPHGPHCWOAC-UHFFFAOYSA-N	472.182063466							93654
NSC653260	LSM-43039	AG-592, SID505991	5467485	InChI=1S/C33H36N4O6/c34-18-24(14-22-5-11-28(38)30(40)16-22)32(42)36-26-7-1-20(2-8-26)13-21-3-9-27(10-4-21)37-33(43)25(19-35)15-23-6-12-29(39)31(41)17-23/h5-6,11-12,14-17,20-21,26-27,38-41H,1-4,7-10,13H2,(H,36,42)(H,37,43)/b24-14+,25-15+	VEPQEAOWDILSHB-KOJZRSEWSA-N	Oc1ccc(\C=C(/C#N)\C(=O)NC2CCC(CC3CCC(CC3)NC(=O)\C(=C\c4ccc(O)c(O)c4)\C#N)CC2)cc1O	BroadT	BRD-K89930444	BRD-K89930444-001-01-9	Calbiochem	658406			Oc1ccc(cc1O)\C=C(/C#N)C(=O)NC1CCC(CC2CCC(CC2)NC(=O)C(\C#N)=C\c2ccc(O)c(O)c2)CC1	InChI=1S/C33H36N4O6/c34-18-24(14-22-5-11-28(38)30(40)16-22)32(42)36-26-7-1-20(2-8-26)13-21-3-9-27(10-4-21)37-33(43)25(19-35)15-23-6-12-29(39)31(41)17-23/h5-6,11-12,14-17,20-21,26-27,38-41H,1-4,7-10,13H2,(H,36,42)(H,37,43)/b24-14+,25-15+	VEPQEAOWDILSHB-KOJZRSEWSA-N	584.263484912							
DR 2313	LSM-4130	DR-2313	10219702	InChI=1S/C8H10N2OS/c1-5-9-7-2-3-12-4-6(7)8(11)10-5/h2-4H2,1H3,(H,9,10,11)	HRYKZAKEAVZGJD-UHFFFAOYSA-N	CC1=NC(=O)C2=C(CCSC2)N1	BroadT	BRD-K94920105	BRD-K94920105-001-01-3	Tocris Bioscience	2496	1		Cc1nc(=O)c2CSCCc2[nH]1	InChI=1S/C8H10N2OS/c1-5-9-7-2-3-12-4-6(7)8(11)10-5/h2-4H2,1H3,(H,9,10,11)	HRYKZAKEAVZGJD-UHFFFAOYSA-N	182.05138365							
Rivafurazon	LSM-3779	Nitrofural, SID56463220	1839	InChI=1S/C6H6N4O4/c7-6(11)9-8-3-4-1-2-5(14-4)10(12)13/h1-3H,(H3,7,9,11)	IAIWVQXQOWNYOU-UHFFFAOYSA-N	NC(=O)NN=Cc1oc(cc1)[N+](=O)[O-]	BroadT	BRD-K79092138	BRD-K79092138-001-04-5	MicroSource Discovery Systems Inc.	1500434			NC(=O)N\N=C\c1ccc(o1)[N+]([O-])=O	InChI=1S/C6H6N4O4/c7-6(11)9-8-3-4-1-2-5(14-4)10(12)13/h1-3H,(H3,7,9,11)/b8-3+	IAIWVQXQOWNYOU-FPYGCLRLSA-N	198.038904712							44368
Dantrolene-13C3	LSM-3823	Dantrolene	2952	InChI=1S/C14H10N4O5/c19-13-8-17(14(20)16-13)15-7-11-5-6-12(23-11)9-1-3-10(4-2-9)18(21)22/h1-7H,8H2,(H,16,19,20)	OZOMQRBLCMDCEG-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)c2oc(C=NN3CC(=O)NC3=O)cc2	BroadT	BRD-K81272440	BRD-K81272440-001-02-6	Biomol International Inc.	AC-100	2840(V2)-3-N1305		[O-][N+](=O)c1ccc(cc1)-c1ccc(\C=N\N2CC(=O)NC2=O)o1	InChI=1S/C14H10N4O5/c19-13-8-17(14(20)16-13)15-7-11-5-6-12(23-11)9-1-3-10(4-2-9)18(21)22/h1-7H,8H2,(H,16,19,20)/b15-7+	OZOMQRBLCMDCEG-VIZOYTHASA-N	314.06511946							4317, 4317
WIN-552122	LSM-15494	WIN-55212-2	5311501	InChI=1S/C27H26N2O3/c1-18-25(27(30)22-9-4-7-19-6-2-3-8-21(19)22)23-10-5-11-24-26(23)29(18)20(17-32-24)16-28-12-14-31-15-13-28/h2-11,20H,12-17H2,1H3/t20-/m1/s1	HQVHOQAKMCMIIM-HXUWFJFHSA-N	Cc1c(C(=O)c2cccc3ccccc23)c4cccc5OC[C@@H](CN6CCOCC6)n1c45	BroadT	BRD-K88282786	BRD-K88282786-066-04-9	Tocris Bioscience	1038	25	CS(=O)(=O)O	Cc1c(C(=O)c2cccc3ccccc23)c2cccc3OC[C@@H](CN4CCOCC4)n1c23.CS(=O)(=O)O	InChI=1S/C27H26N2O3.CH4O3S/c1-18-25(27(30)22-9-4-7-19-6-2-3-8-21(19)22)23-10-5-11-24-26(23)29(18)20(17-32-24)16-28-12-14-31-15-13-28;1-5(2,3)4/h2-11,20H,12-17H2,1H3;1H3,(H,2,3,4)/t20-;/m1./s1	FSGCSTPOPBJYSX-VEIFNGETSA-N	426.194342712							73295, 73295
Albendazole	LSM-3782	Zental, Valbazen, Eskazole, Albenza, Albendazole, SK&F-62979, SK&F 62979	2082	InChI=1S/C12H15N3O2S/c1-3-6-18-8-4-5-9-10(7-8)14-11(13-9)15-12(16)17-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)	HXHWSAZORRCQMX-UHFFFAOYSA-N	CCCSc1ccc2nc(NC(=O)OC)[nH]c2c1	BroadT	BRD-K79131256	BRD-K79131256-001-03-9	MicroSource Discovery Systems Inc.	1503903			CCCSc1ccc2[nH]c(NC(=O)OC)nc2c1	InChI=1S/C12H15N3O2S/c1-3-6-18-8-4-5-9-10(7-8)14-11(13-9)15-12(16)17-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)	HXHWSAZORRCQMX-UHFFFAOYSA-N	265.08849744							16664
Strophanthidin	LSM-3891	SID123094, SID26754177, SID56463072	6185	InChI=1S/C23H32O6/c1-20-6-3-17-18(4-8-22(27)11-15(25)2-7-21(17,22)13-24)23(20,28)9-5-16(20)14-10-19(26)29-12-14/h10,13,15-18,25,27-28H,2-9,11-12H2,1H3/t15-,16+,17-,18+,20+,21-,22-,23-/m0/s1	ODJLBQGVINUMMR-HZXDTFASSA-N	C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34C=O)[C@@]1(O)CC[C@@H]2C5=CC(=O)OC5	BroadT	BRD-K84595254	BRD-K84595254-001-03-0	Prestwick Chemical Inc.	Prestw-710	D0701-MP04-ST03-200-		C[C@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34C=O)[C@@]1(O)CC[C@@H]2C1=CC(=O)OC1	InChI=1S/C23H32O6/c1-20-6-3-17-18(4-8-22(27)11-15(25)2-7-21(17,22)13-24)23(20,28)9-5-16(20)14-10-19(26)29-12-14/h10,13,15-18,25,27-28H,2-9,11-12H2,1H3/t15-,16+,17-,18+,20+,21-,22-,23-/m0/s1	ODJLBQGVINUMMR-HZXDTFASSA-N	404.219888744							38178
BRD-K51411441	LSM-24994		44489537	InChI=1S/C25H33FN4O4/c1-16-13-30(17(2)15-31)24(32)21-12-20(28(3)4)10-11-22(21)34-23(16)14-29(5)25(33)27-19-8-6-18(26)7-9-19/h6-12,16-17,23,31H,13-15H2,1-5H3,(H,27,33)/t16-,17-,23+/m1/s1	FXKMHYTYNRWQSP-QZMQVMSPSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K51411441	BRD-K51411441-001-01-7	Broad Institute of MIT and Harvard	BRD-K51411441			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H33FN4O4/c1-16-13-30(17(2)15-31)24(32)21-12-20(28(3)4)10-11-22(21)34-23(16)14-29(5)25(33)27-19-8-6-18(26)7-9-19/h6-12,16-17,23,31H,13-15H2,1-5H3,(H,27,33)/t16-,17-,23+/m1/s1	FXKMHYTYNRWQSP-QZMQVMSPSA-N	472.248583776							113562
BRD-K33606137	LSM-24995		44491945	InChI=1S/C18H29N3O5S/c1-12-9-21(13(2)11-22)18(23)14-7-6-8-15(19-27(5,24)25)17(14)26-16(12)10-20(3)4/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13+,16-/m1/s1	NGOQGDZIZPAXSN-DVOMOZLQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2c(NS(=O)(=O)C)cccc2C1=O	BroadT	BRD-K33606137	BRD-K33606137-001-01-4	Broad Institute of MIT and Harvard	BRD-K33606137			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2c(NS(C)(=O)=O)cccc2C1=O	InChI=1S/C18H29N3O5S/c1-12-9-21(13(2)11-22)18(23)14-7-6-8-15(19-27(5,24)25)17(14)26-16(12)10-20(3)4/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13+,16-/m1/s1	NGOQGDZIZPAXSN-DVOMOZLQSA-N	399.182791748							113563
BRD-K57556489	LSM-24996		44486197	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18-,23+/m0/s1	BMWRPMHXUFNAQO-IUKKYPGJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K57556489	BRD-K57556489-001-01-6	Broad Institute of MIT and Harvard	BRD-K57556489			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18-,23+/m0/s1	BMWRPMHXUFNAQO-IUKKYPGJSA-N	466.258005608							113564
BRD-K14383477	LSM-24997		44495556	InChI=1S/C23H35N5O5S/c1-16-11-28(17(2)14-29)23(30)10-18-9-19(25(3)4)7-8-20(18)33-21(16)12-27(6)34(31,32)22-13-26(5)15-24-22/h7-9,13,15-17,21,29H,10-12,14H2,1-6H3/t16-,17+,21+/m0/s1	XKGXVARXDYWWSM-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K14383477	BRD-K14383477-001-01-1	Broad Institute of MIT and Harvard	BRD-K14383477			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C23H35N5O5S/c1-16-11-28(17(2)14-29)23(30)10-18-9-19(25(3)4)7-8-20(18)33-21(16)12-27(6)34(31,32)22-13-26(5)15-24-22/h7-9,13,15-17,21,29H,10-12,14H2,1-6H3/t16-,17+,21+/m0/s1	XKGXVARXDYWWSM-CSODHUTKSA-N	493.23588996							113565
MLS002474430	LSM-24998	SID85201575, BRD-K05975035	44202659	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-41(38,39)23-14-12-21(30)13-15-23)27(24)40-26(19)17-33(3)29(37)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,26,32,35H,4-6,8-9,16-18H2,1-3H3,(H,31,37)/t19-,20+,26+/m1/s1	PZASEUVCJBPSCE-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3c(NS(=O)(=O)c4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K05975035	BRD-K05975035-001-01-0	Broad Institute of MIT and Harvard	BRD-K05975035			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C1=O	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-41(38,39)23-14-12-21(30)13-15-23)27(24)40-26(19)17-33(3)29(37)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,26,32,35H,4-6,8-9,16-18H2,1-3H3,(H,31,37)/t19-,20+,26+/m1/s1	PZASEUVCJBPSCE-GOHWNWGWSA-N	590.257433898							113566
BRD-K87167435	LSM-24999		44484827	InChI=1S/C28H33ClN4O5S/c1-19-15-33(20(2)18-34)28(35)25-14-23(31-39(36,37)24-7-4-22(29)5-8-24)6-9-26(25)38-27(19)17-32(3)16-21-10-12-30-13-11-21/h4-14,19-20,27,31,34H,15-18H2,1-3H3/t19-,20-,27-/m0/s1	RTDBYDGQKCGXQZ-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K87167435	BRD-K87167435-001-01-1	Broad Institute of MIT and Harvard	BRD-K87167435			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C28H33ClN4O5S/c1-19-15-33(20(2)18-34)28(35)25-14-23(31-39(36,37)24-7-4-22(29)5-8-24)6-9-26(25)38-27(19)17-32(3)16-21-10-12-30-13-11-21/h4-14,19-20,27,31,34H,15-18H2,1-3H3/t19-,20-,27-/m0/s1	RTDBYDGQKCGXQZ-OSOCVKALSA-N	572.186018596							113567
BRD-K86623758	LSM-25000		44484865	InChI=1S/C29H41N3O5S/c1-21-17-32(22(2)20-33)29(34)26-16-24(30-38(35,36)25-12-8-5-9-13-25)14-15-27(26)37-28(21)19-31(3)18-23-10-6-4-7-11-23/h5,8-9,12-16,21-23,28,30,33H,4,6-7,10-11,17-20H2,1-3H3/t21-,22-,28-/m0/s1	DAPIBIRMBOQELH-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K86623758	BRD-K86623758-001-01-3	Broad Institute of MIT and Harvard	BRD-K86623758			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H41N3O5S/c1-21-17-32(22(2)20-33)29(34)26-16-24(30-38(35,36)25-12-8-5-9-13-25)14-15-27(26)37-28(21)19-31(3)18-23-10-6-4-7-11-23/h5,8-9,12-16,21-23,28,30,33H,4,6-7,10-11,17-20H2,1-3H3/t21-,22-,28-/m0/s1	DAPIBIRMBOQELH-VPYPWEPUSA-N	543.276692132							113568
BRD-K64567246	LSM-25001		44493152	InChI=1S/C21H31N7O4/c1-14-9-28(15(2)12-29)21(31)8-16-7-17(23-20(30)11-27-13-22-24-25-27)5-6-18(16)32-19(14)10-26(3)4/h5-7,13-15,19,29H,8-12H2,1-4H3,(H,23,30)/t14-,15+,19+/m0/s1	FEGVFSOLSHLDDV-QMTMVMCOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	BroadT	BRD-K64567246	BRD-K64567246-001-01-8	Broad Institute of MIT and Harvard	BRD-K64567246			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	InChI=1S/C21H31N7O4/c1-14-9-28(15(2)12-29)21(31)8-16-7-17(23-20(30)11-27-13-22-24-25-27)5-6-18(16)32-19(14)10-26(3)4/h5-7,13-15,19,29H,8-12H2,1-4H3,(H,23,30)/t14-,15+,19+/m0/s1	FEGVFSOLSHLDDV-QMTMVMCOSA-N	445.243752542							113569
BRD-K53548223	LSM-25002		44492146	InChI=1S/C24H33N3O6S/c1-16-13-27(17(2)15-28)24(29)21-12-18(6-11-22(21)33-23(16)14-26(3)4)25-34(30,31)20-9-7-19(32-5)8-10-20/h6-12,16-17,23,25,28H,13-15H2,1-5H3/t16-,17+,23+/m0/s1	IFPHIOSYEQPMRT-YGKZAACZSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K53548223	BRD-K53548223-001-01-8	Broad Institute of MIT and Harvard	BRD-K53548223			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H33N3O6S/c1-16-13-27(17(2)15-28)24(29)21-12-18(6-11-22(21)33-23(16)14-26(3)4)25-34(30,31)20-9-7-19(32-5)8-10-20/h6-12,16-17,23,25,28H,13-15H2,1-5H3/t16-,17+,23+/m0/s1	IFPHIOSYEQPMRT-YGKZAACZSA-N	491.209006496							113570
BRD-K69154646	LSM-25003		44484721	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)25-14-24(33-31(38)32-23-7-5-4-6-8-23)10-12-26(25)41-29(20)17-34(3)16-22-9-11-27-28(13-22)40-19-39-27/h9-14,20-21,23,29,36H,4-8,15-19H2,1-3H3,(H2,32,33,38)/t20-,21-,29+/m0/s1	WHPNVWBFVYVCKA-LRZFZUCMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)NC5CCCCC5)cc4C1=O	BroadT	BRD-K69154646	BRD-K69154646-001-01-6	Broad Institute of MIT and Harvard	BRD-K69154646			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)25-14-24(33-31(38)32-23-7-5-4-6-8-23)10-12-26(25)41-29(20)17-34(3)16-22-9-11-27-28(13-22)40-19-39-27/h9-14,20-21,23,29,36H,4-8,15-19H2,1-3H3,(H2,32,33,38)/t20-,21-,29+/m0/s1	WHPNVWBFVYVCKA-LRZFZUCMSA-N	566.310435104							113571
BRD-K54576503	LSM-25004		44496171	InChI=1S/C31H42N4O6/c1-20-17-35(21(2)19-36)30(38)25-11-8-12-26(33-29(37)22-9-6-5-7-10-22)28(25)41-27(20)18-34(3)31(39)32-23-13-15-24(40-4)16-14-23/h8,11-16,20-22,27,36H,5-7,9-10,17-19H2,1-4H3,(H,32,39)(H,33,37)/t20-,21-,27+/m0/s1	LSKFJJLXCXBANC-NOMHHCBYSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3c(NC(=O)C4CCCCC4)cccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K54576503	BRD-K54576503-001-01-9	Broad Institute of MIT and Harvard	BRD-K54576503			COc1ccc(NC(=O)N(C)C[C@H]2Oc3c(NC(=O)C4CCCCC4)cccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H42N4O6/c1-20-17-35(21(2)19-36)30(38)25-11-8-12-26(33-29(37)22-9-6-5-7-10-22)28(25)41-27(20)18-34(3)31(39)32-23-13-15-24(40-4)16-14-23/h8,11-16,20-22,27,36H,5-7,9-10,17-19H2,1-4H3,(H,32,39)(H,33,37)/t20-,21-,27+/m0/s1	LSKFJJLXCXBANC-NOMHHCBYSA-N	566.310435104							113572
BRD-K09250647	LSM-25005		44487359	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14-,18-/m0/s1	TWHSADQACYCNBZ-DEYYWGMASA-N	CNC[C@@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K09250647	BRD-K09250647-001-01-4	Broad Institute of MIT and Harvard	BRD-K09250647			CNC[C@@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14-,18-/m0/s1	TWHSADQACYCNBZ-DEYYWGMASA-N	413.206304394							113573
BRD-K36289678	LSM-25006		44619985	InChI=1S/C27H37N3O5/c1-18-13-30(19(2)16-31)27(32)12-21-11-22(28(3)4)7-9-23(21)35-26(18)15-29(5)14-20-6-8-24-25(10-20)34-17-33-24/h6-11,18-19,26,31H,12-17H2,1-5H3/t18-,19+,26+/m1/s1	VAKWQMKHOINUIK-MVYHEMRASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(cc4CC1=O)N(C)C	BroadT	BRD-K36289678	BRD-K36289678-001-01-1	Broad Institute of MIT and Harvard	BRD-K36289678			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C27H37N3O5/c1-18-13-30(19(2)16-31)27(32)12-21-11-22(28(3)4)7-9-23(21)35-26(18)15-29(5)14-20-6-8-24-25(10-20)34-17-33-24/h6-11,18-19,26,31H,12-17H2,1-5H3/t18-,19+,26+/m1/s1	VAKWQMKHOINUIK-MVYHEMRASA-N	483.273321314							113574
BRD-K32362211	LSM-25007		44492682	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)24-13-23(30-29(37)31-27-20(3)32-39-21(27)4)11-12-25(24)38-26(18)16-33(5)15-22-9-7-6-8-10-22/h11-13,18-19,22,26,35H,6-10,14-17H2,1-5H3,(H2,30,31,37)/t18-,19+,26+/m1/s1	GCOOUUHDYUHFBZ-MVYHEMRASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3C1=O	BroadT	BRD-K32362211	BRD-K32362211-001-01-4	Broad Institute of MIT and Harvard	BRD-K32362211			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)24-13-23(30-29(37)31-27-20(3)32-39-21(27)4)11-12-25(24)38-26(18)16-33(5)15-22-9-7-6-8-10-22/h11-13,18-19,22,26,35H,6-10,14-17H2,1-5H3,(H2,30,31,37)/t18-,19+,26+/m1/s1	GCOOUUHDYUHFBZ-MVYHEMRASA-N	541.326419526							113575
BRD-K21367867	LSM-25008		44498716	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23+,29+/m0/s1	ZVHZCYJHGRNXGN-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)c4ccc(cc4)c5nccs5)cccc3C1=O	BroadT	BRD-K21367867	BRD-K21367867-001-01-3	Broad Institute of MIT and Harvard	BRD-K21367867			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C1=O	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23+,29+/m0/s1	ZVHZCYJHGRNXGN-QFWOEDSFSA-N	590.292676554							113576
BRD-K04317371	LSM-25009		44484077	InChI=1S/C20H28F3N3O4/c1-12-10-26(13(2)11-27)19(29)15-8-14(25-18(28)6-7-20(21,22)23)4-5-16(15)30-17(12)9-24-3/h4-5,8,12-13,17,24,27H,6-7,9-11H2,1-3H3,(H,25,28)/t12-,13-,17+/m0/s1	MJOLMSVGHZLLLZ-GDZNZVCISA-N	CNC[C@H]1Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K04317371	BRD-K04317371-001-01-8	Broad Institute of MIT and Harvard	BRD-K04317371			CNC[C@H]1Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C20H28F3N3O4/c1-12-10-26(13(2)11-27)19(29)15-8-14(25-18(28)6-7-20(21,22)23)4-5-16(15)30-17(12)9-24-3/h4-5,8,12-13,17,24,27H,6-7,9-11H2,1-3H3,(H,25,28)/t12-,13-,17+/m0/s1	MJOLMSVGHZLLLZ-GDZNZVCISA-N	431.203191006							113577
BRD-K64469421	LSM-25010		44488018	InChI=1S/C28H34F3N5O5S/c1-18-12-36(19(2)16-37)27(38)22-6-5-7-23(33-42(39,40)25-15-35(4)17-32-25)26(22)41-24(18)14-34(3)13-20-8-10-21(11-9-20)28(29,30)31/h5-11,15,17-19,24,33,37H,12-14,16H2,1-4H3/t18-,19-,24+/m0/s1	DXKOHZBEBBERNQ-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3c(NS(=O)(=O)c4cn(C)cn4)cccc3C1=O	BroadT	BRD-K64469421	BRD-K64469421-001-01-4	Broad Institute of MIT and Harvard	BRD-K64469421			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C1=O	InChI=1S/C28H34F3N5O5S/c1-18-12-36(19(2)16-37)27(38)22-6-5-7-23(33-42(39,40)25-15-35(4)17-32-25)26(22)41-24(18)14-34(3)13-20-8-10-21(11-9-20)28(29,30)31/h5-11,15,17-19,24,33,37H,12-14,16H2,1-4H3/t18-,19-,24+/m0/s1	DXKOHZBEBBERNQ-AXHZCLLHSA-N	609.223274528							113578
BRD-K51270604	LSM-25011		44620509	InChI=1S/C32H44N4O7/c1-22-17-36(23(2)20-37)32(39)16-25-15-26(33-31(38)8-9-35-10-12-40-13-11-35)5-7-27(25)43-30(22)19-34(3)18-24-4-6-28-29(14-24)42-21-41-28/h4-7,14-15,22-23,30,37H,8-13,16-21H2,1-3H3,(H,33,38)/t22-,23+,30+/m1/s1	NYPOLWMMHTZHKU-HFZPWKHCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCN5CCOCC5)cc4CC1=O	BroadT	BRD-K51270604	BRD-K51270604-001-01-0	Broad Institute of MIT and Harvard	BRD-K51270604			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC1=O	InChI=1S/C32H44N4O7/c1-22-17-36(23(2)20-37)32(39)16-25-15-26(33-31(38)8-9-35-10-12-40-13-11-35)5-7-27(25)43-30(22)19-34(3)18-24-4-6-28-29(14-24)42-21-41-28/h4-7,14-15,22-23,30,37H,8-13,16-21H2,1-3H3,(H,33,38)/t22-,23+,30+/m1/s1	NYPOLWMMHTZHKU-HFZPWKHCSA-N	596.320999788							113579
BRD-K73635724	LSM-25012		54613793	InChI=1S/C25H34N4O4/c1-17-14-29(18(2)16-30)24(31)13-19-12-21(10-11-22(19)33-23(17)15-28(3)4)27-25(32)26-20-8-6-5-7-9-20/h5-12,17-18,23,30H,13-16H2,1-4H3,(H2,26,27,32)/t17-,18+,23+/m0/s1	VPMPLFBICILMPX-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	BroadT	BRD-K73635724	BRD-K73635724-001-01-3	Broad Institute of MIT and Harvard	BRD-K73635724			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	InChI=1S/C25H34N4O4/c1-17-14-29(18(2)16-30)24(31)13-19-12-21(10-11-22(19)33-23(17)15-28(3)4)27-25(32)26-20-8-6-5-7-9-20/h5-12,17-18,23,30H,13-16H2,1-4H3,(H2,26,27,32)/t17-,18+,23+/m0/s1	VPMPLFBICILMPX-YZZKKUAISA-N	454.258005608							113580
BRD-K74632893	LSM-25013		44486264	InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18-,22-/m0/s1	QKNVOCCOOAXREN-SPEDKVCISA-N	CNC[C@@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K74632893	BRD-K74632893-001-01-4	Broad Institute of MIT and Harvard	BRD-K74632893			CNC[C@@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18-,22-/m0/s1	QKNVOCCOOAXREN-SPEDKVCISA-N	462.284220356							113581
BRD-K01660763	LSM-25014		44496303	InChI=1S/C28H31FN6O5/c1-17-14-35(18(2)16-36)27(38)21-5-4-6-22(33-26(37)23-13-30-11-12-31-23)25(21)40-24(17)15-34(3)28(39)32-20-9-7-19(29)8-10-20/h4-13,17-18,24,36H,14-16H2,1-3H3,(H,32,39)(H,33,37)/t17-,18-,24+/m1/s1	CPPFQQQOTXHNMM-GGUMNFRJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K01660763	BRD-K01660763-001-01-0	Broad Institute of MIT and Harvard	BRD-K01660763			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H31FN6O5/c1-17-14-35(18(2)16-36)27(38)21-5-4-6-22(33-26(37)23-13-30-11-12-31-23)25(21)40-24(17)15-34(3)28(39)32-20-9-7-19(29)8-10-20/h4-13,17-18,24,36H,14-16H2,1-3H3,(H,32,39)(H,33,37)/t17-,18-,24+/m1/s1	CPPFQQQOTXHNMM-GGUMNFRJSA-N	550.233996352							113582
BRD-K28317853	LSM-15127		54613802	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)31(38)17-25-16-27(34-32(39)33-26-10-13-28(40-4)14-11-26)12-15-29(25)41-30(22)20-35(3)19-24-8-6-5-7-9-24/h10-16,22-24,30,37H,5-9,17-21H2,1-4H3,(H2,33,34,39)/t22-,23+,30+/m0/s1	QTHBIZIZCLMCFV-DDFCPOBKSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)CC4CCCCC4)[C@@H](C)CN([C@H](C)CO)C(=O)Cc3c2)cc1	BroadT	BRD-K28317853	BRD-K28317853-001-01-7	Broad Institute of MIT and Harvard	BRD-K28317853			COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)CC4CCCCC4)[C@@H](C)CN([C@H](C)CO)C(=O)Cc3c2)cc1	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)31(38)17-25-16-27(34-32(39)33-26-10-13-28(40-4)14-11-26)12-15-29(25)41-30(22)20-35(3)19-24-8-6-5-7-9-24/h10-16,22-24,30,37H,5-9,17-21H2,1-4H3,(H2,33,34,39)/t22-,23+,30+/m0/s1	QTHBIZIZCLMCFV-DDFCPOBKSA-N	566.346820612							103783
BRD-K29636267	LSM-25015		44487289	InChI=1S/C34H45N5O5/c1-22-18-39(23(2)21-40)33(42)28-17-26(35-32(41)16-24-19-37(3)29-13-9-8-12-27(24)29)14-15-30(28)44-31(22)20-38(4)34(43)36-25-10-6-5-7-11-25/h8-9,12-15,17,19,22-23,25,31,40H,5-7,10-11,16,18,20-21H2,1-4H3,(H,35,41)(H,36,43)/t22-,23-,31-/m0/s1	ZSZRFUWYOKUGNE-BVXAZASISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Cc4cn(C)c5ccccc45)cc3C1=O	BroadT	BRD-K29636267	BRD-K29636267-001-01-9	Broad Institute of MIT and Harvard	BRD-K29636267			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Cc3cn(C)c4ccccc34)cc2C1=O	InChI=1S/C34H45N5O5/c1-22-18-39(23(2)21-40)33(42)28-17-26(35-32(41)16-24-19-37(3)29-13-9-8-12-27(24)29)14-15-30(28)44-31(22)20-38(4)34(43)36-25-10-6-5-7-11-25/h8-9,12-15,17,19,22-23,25,31,40H,5-7,10-11,16,18,20-21H2,1-4H3,(H,35,41)(H,36,43)/t22-,23-,31-/m0/s1	ZSZRFUWYOKUGNE-BVXAZASISA-N	603.34206959							113583
BRD-K08558441	LSM-25016		44495607	InChI=1S/C23H33N5O4/c1-14-11-28(16(3)13-29)23(31)17-8-7-9-18(21(17)32-20(14)12-26(4)5)24-22(30)19-10-15(2)25-27(19)6/h7-10,14,16,20,29H,11-13H2,1-6H3,(H,24,30)/t14-,16+,20+/m1/s1	ADWJBSWPWOPVMW-IIMJZQEZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2c(NC(=O)c3cc(C)nn3C)cccc2C1=O	BroadT	BRD-K08558441	BRD-K08558441-001-01-9	Broad Institute of MIT and Harvard	BRD-K08558441			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2c(NC(=O)c3cc(C)nn3C)cccc2C1=O	InChI=1S/C23H33N5O4/c1-14-11-28(16(3)13-29)23(31)17-8-7-9-18(21(17)32-20(14)12-26(4)5)24-22(30)19-10-15(2)25-27(19)6/h7-10,14,16,20,29H,11-13H2,1-6H3,(H,24,30)/t14-,16+,20+/m1/s1	ADWJBSWPWOPVMW-IIMJZQEZSA-N	443.253254586							113584
BRD-K10527362-001-01-5	LSM-25017	BRD-K10527362	44494234	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)27-12-9-13-28(32(3)4)30(27)38-29(22)20-33(5)19-24-14-16-26(17-15-24)37-25-10-7-6-8-11-25/h6-17,22-23,29,35H,18-21H2,1-5H3/t22-,23-,29+/m0/s1	KBWKSVZPOQKHGN-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K10527362	BRD-K10527362-001-01-5	Broad Institute of MIT and Harvard	BRD-K10527362			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)27-12-9-13-28(32(3)4)30(27)38-29(22)20-33(5)19-24-14-16-26(17-15-24)37-25-10-7-6-8-11-25/h6-17,22-23,29,35H,18-21H2,1-5H3/t22-,23-,29+/m0/s1	KBWKSVZPOQKHGN-SBZVUBOMSA-N	517.294056758							113585
BRD-K73775927	LSM-25018		44492238	InChI=1S/C35H38N4O5/c1-24-20-39(25(2)23-40)35(42)31-19-28(37-34(41)27-15-17-36-18-16-27)11-14-32(31)44-33(24)22-38(3)21-26-9-12-30(13-10-26)43-29-7-5-4-6-8-29/h4-19,24-25,33,40H,20-23H2,1-3H3,(H,37,41)/t24-,25-,33+/m0/s1	NYKHOXZKFLRULB-UTKFAANNSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(NC(=O)c5ccncc5)cc4C1=O	BroadT	BRD-K73775927	BRD-K73775927-001-01-2	Broad Institute of MIT and Harvard	BRD-K73775927			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H38N4O5/c1-24-20-39(25(2)23-40)35(42)31-19-28(37-34(41)27-15-17-36-18-16-27)11-14-32(31)44-33(24)22-38(3)21-26-9-12-30(13-10-26)43-29-7-5-4-6-8-29/h4-19,24-25,33,40H,20-23H2,1-3H3,(H,37,41)/t24-,25-,33+/m0/s1	NYKHOXZKFLRULB-UTKFAANNSA-N	594.284220356							113586
CHEMBL3400868	LSM-25019	BRD-K71243741	44488867	InChI=1S/C34H45N5O5/c1-22-18-39(23(2)21-40)33(42)28-17-26(35-32(41)16-24-19-37(3)29-13-9-8-12-27(24)29)14-15-30(28)44-31(22)20-38(4)34(43)36-25-10-6-5-7-11-25/h8-9,12-15,17,19,22-23,25,31,40H,5-7,10-11,16,18,20-21H2,1-4H3,(H,35,41)(H,36,43)/t22-,23-,31+/m1/s1	ZSZRFUWYOKUGNE-PKIAKLFDSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Cc4cn(C)c5ccccc45)cc3C1=O	BroadT	BRD-K71243741	BRD-K71243741-001-01-7	Broad Institute of MIT and Harvard	BRD-K71243741			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Cc3cn(C)c4ccccc34)cc2C1=O	InChI=1S/C34H45N5O5/c1-22-18-39(23(2)21-40)33(42)28-17-26(35-32(41)16-24-19-37(3)29-13-9-8-12-27(24)29)14-15-30(28)44-31(22)20-38(4)34(43)36-25-10-6-5-7-11-25/h8-9,12-15,17,19,22-23,25,31,40H,5-7,10-11,16,18,20-21H2,1-4H3,(H,35,41)(H,36,43)/t22-,23-,31+/m1/s1	ZSZRFUWYOKUGNE-PKIAKLFDSA-N	603.34206959							113587
BRD-K17120673	LSM-25020		44494238	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13-,17+/m0/s1	COTDYGDWXSSLGS-GDZNZVCISA-N	CNC[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K17120673	BRD-K17120673-001-01-6	Broad Institute of MIT and Harvard	BRD-K17120673			CNC[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C20H29N3O4/c1-12-10-23(13(2)11-24)20(26)15-5-4-6-16(22-19(25)14-7-8-14)18(15)27-17(12)9-21-3/h4-6,12-14,17,21,24H,7-11H2,1-3H3,(H,22,25)/t12-,13-,17+/m0/s1	COTDYGDWXSSLGS-GDZNZVCISA-N	375.215806438							113588
BRD-K80723690	LSM-15091		44484185	InChI=1S/C32H38N4O7/c1-20-15-36(21(2)18-37)31(38)26-14-24(34-32(39)33-23-6-9-25(40-4)10-7-23)8-12-27(26)43-30(20)17-35(3)16-22-5-11-28-29(13-22)42-19-41-28/h5-14,20-21,30,37H,15-19H2,1-4H3,(H2,33,34,39)/t20-,21-,30-/m1/s1	NGRSXEMLDRQNMH-URCPOSBSSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)Cc4ccc5OCOc5c4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K80723690	BRD-K80723690-001-01-8	Broad Institute of MIT and Harvard	BRD-K80723690			COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)Cc4ccc5OCOc5c4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C32H38N4O7/c1-20-15-36(21(2)18-37)31(38)26-14-24(34-32(39)33-23-6-9-25(40-4)10-7-23)8-12-27(26)43-30(20)17-35(3)16-22-5-11-28-29(13-22)42-19-41-28/h5-14,20-21,30,37H,15-19H2,1-4H3,(H2,33,34,39)/t20-,21-,30-/m1/s1	NGRSXEMLDRQNMH-URCPOSBSSA-N	590.274049596							103747
BRD-K80622681	LSM-25021		44617346	InChI=1S/C28H43N3O4/c1-19-15-31(20(2)18-32)27(33)14-23-13-24(29-28(34)22-7-5-4-6-8-22)11-12-25(23)35-26(19)17-30(3)16-21-9-10-21/h11-13,19-22,26,32H,4-10,14-18H2,1-3H3,(H,29,34)/t19-,20-,26-/m0/s1	OICFVEIUUNSOQD-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NC(=O)C4CCCCC4)cc3CC1=O	BroadT	BRD-K80622681	BRD-K80622681-001-01-3	Broad Institute of MIT and Harvard	BRD-K80622681			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NC(=O)C3CCCCC3)cc2CC1=O	InChI=1S/C28H43N3O4/c1-19-15-31(20(2)18-32)27(33)14-23-13-24(29-28(34)22-7-5-4-6-8-22)11-12-25(23)35-26(19)17-30(3)16-21-9-10-21/h11-13,19-22,26,32H,4-10,14-18H2,1-3H3,(H,29,34)/t19-,20-,26-/m0/s1	OICFVEIUUNSOQD-DYLHXGEVSA-N	485.325356886							113589
BRD-K36347292	LSM-25022		54613805	InChI=1S/C32H45N5O6/c1-21-18-37(22(2)20-38)30(39)17-23-16-26(34-31(40)33-24-8-6-5-7-9-24)12-15-28(23)43-29(21)19-36(3)32(41)35-25-10-13-27(42-4)14-11-25/h10-16,21-22,24,29,38H,5-9,17-20H2,1-4H3,(H,35,41)(H2,33,34,40)/t21-,22+,29+/m0/s1	SMGQOPDVSHJVMI-DKGMKSHISA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)NC4CCCCC4)cc3CC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K36347292	BRD-K36347292-001-01-3	Broad Institute of MIT and Harvard	BRD-K36347292			COc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)NC4CCCCC4)cc3CC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C32H45N5O6/c1-21-18-37(22(2)20-38)30(39)17-23-16-26(34-31(40)33-24-8-6-5-7-9-24)12-15-28(23)43-29(21)19-36(3)32(41)35-25-10-13-27(42-4)14-11-25/h10-16,21-22,24,29,38H,5-9,17-20H2,1-4H3,(H,35,41)(H2,33,34,40)/t21-,22+,29+/m0/s1	SMGQOPDVSHJVMI-DKGMKSHISA-N	595.33698421							113590
BRD-K44828787	LSM-25023		44618845	InChI=1S/C30H50N4O4/c1-22-18-34(23(2)21-35)30(37)17-25-16-26(31-29(36)12-9-15-32(3)4)13-14-27(25)38-28(22)20-33(5)19-24-10-7-6-8-11-24/h13-14,16,22-24,28,35H,6-12,15,17-21H2,1-5H3,(H,31,36)/t22-,23+,28+/m0/s1	XTYMFXBEGHIJAG-SXDGJLEOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)CCCN(C)C)cc3CC1=O	BroadT	BRD-K44828787	BRD-K44828787-001-01-4	Broad Institute of MIT and Harvard	BRD-K44828787			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)CCCN(C)C)cc2CC1=O	InChI=1S/C30H50N4O4/c1-22-18-34(23(2)21-35)30(37)17-25-16-26(31-29(36)12-9-15-32(3)4)13-14-27(25)38-28(22)20-33(5)19-24-10-7-6-8-11-24/h13-14,16,22-24,28,35H,6-12,15,17-21H2,1-5H3,(H,31,36)/t22-,23+,28+/m0/s1	XTYMFXBEGHIJAG-SXDGJLEOSA-N	530.38320612							113591
BRD-K41311678	LSM-25024		44619983	InChI=1S/C28H40N4O4/c1-19(2)29-28(35)30-24-11-12-25-23(13-24)14-27(34)32(21(4)18-33)15-20(3)26(36-25)17-31(5)16-22-9-7-6-8-10-22/h6-13,19-21,26,33H,14-18H2,1-5H3,(H2,29,30,35)/t20-,21+,26+/m1/s1	ZPQZMRPPCAYKJS-SWYRRKHMSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)Cc2c1	BroadT	BRD-K41311678	BRD-K41311678-001-01-6	Broad Institute of MIT and Harvard	BRD-K41311678			CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)Cc2c1	InChI=1S/C28H40N4O4/c1-19(2)29-28(35)30-24-11-12-25-23(13-24)14-27(34)32(21(4)18-33)15-20(3)26(36-25)17-31(5)16-22-9-7-6-8-10-22/h6-13,19-21,26,33H,14-18H2,1-5H3,(H2,29,30,35)/t20-,21+,26+/m1/s1	ZPQZMRPPCAYKJS-SWYRRKHMSA-N	496.3049558							113592
BRD-K78886448	LSM-25025		44483588	InChI=1S/C28H35F3N4O6/c1-17-14-35(18(2)16-36)26(38)22-13-20(32-25(37)11-12-28(29,30)31)7-10-23(22)41-24(17)15-34(3)27(39)33-19-5-8-21(40-4)9-6-19/h5-10,13,17-18,24,36H,11-12,14-16H2,1-4H3,(H,32,37)(H,33,39)/t17-,18-,24-/m0/s1	RKPQTFDXIVHBLJ-XFAGBWLFSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K78886448	BRD-K78886448-001-01-2	Broad Institute of MIT and Harvard	BRD-K78886448			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C28H35F3N4O6/c1-17-14-35(18(2)16-36)26(38)22-13-20(32-25(37)11-12-28(29,30)31)7-10-23(22)41-24(17)15-34(3)27(39)33-19-5-8-21(40-4)9-6-19/h5-10,13,17-18,24,36H,11-12,14-16H2,1-4H3,(H,32,37)(H,33,39)/t17-,18-,24-/m0/s1	RKPQTFDXIVHBLJ-XFAGBWLFSA-N	580.25086948							113593
BRD-K10704442	LSM-25026		44492151	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)28-18-26(35-33(42)37-29-15-9-11-24-10-7-8-14-27(24)29)16-17-30(28)44-31(22)20-38(3)34(43)36-25-12-5-4-6-13-25/h7-11,14-18,22-23,25,31,40H,4-6,12-13,19-21H2,1-3H3,(H,36,43)(H2,35,37,42)/t22-,23+,31+/m0/s1	QXYCJPXUIIEYFH-INEJIFKHSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Nc4cccc5ccccc45)cc3C1=O	BroadT	BRD-K10704442	BRD-K10704442-001-01-4	Broad Institute of MIT and Harvard	BRD-K10704442			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)28-18-26(35-33(42)37-29-15-9-11-24-10-7-8-14-27(24)29)16-17-30(28)44-31(22)20-38(3)34(43)36-25-12-5-4-6-13-25/h7-11,14-18,22-23,25,31,40H,4-6,12-13,19-21H2,1-3H3,(H,36,43)(H2,35,37,42)/t22-,23+,31+/m0/s1	QXYCJPXUIIEYFH-INEJIFKHSA-N	601.326419526							113594
BRD-K94766933	LSM-25027		44484179	InChI=1S/C29H33ClN4O6S/c1-19-16-34(20(2)18-35)28(36)25-15-23(32-41(38,39)24-12-9-21(30)10-13-24)11-14-26(25)40-27(19)17-33(3)29(37)31-22-7-5-4-6-8-22/h4-15,19-20,27,32,35H,16-18H2,1-3H3,(H,31,37)/t19-,20-,27-/m1/s1	JEFIXRBRGXHONI-SEXOINJZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K94766933	BRD-K94766933-001-01-8	Broad Institute of MIT and Harvard	BRD-K94766933			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H33ClN4O6S/c1-19-16-34(20(2)18-35)28(36)25-15-23(32-41(38,39)24-12-9-21(30)10-13-24)11-14-26(25)40-27(19)17-33(3)29(37)31-22-7-5-4-6-8-22/h4-15,19-20,27,32,35H,16-18H2,1-3H3,(H,31,37)/t19-,20-,27-/m1/s1	JEFIXRBRGXHONI-SEXOINJZSA-N	600.180933216							113595
BRD-K73528610	LSM-25028		44491795	InChI=1S/C32H36N4O7/c1-20-16-36(21(2)18-37)31(39)25-14-23(33-30(38)13-22-7-5-4-6-8-22)9-11-26(25)43-29(20)17-35(3)32(40)34-24-10-12-27-28(15-24)42-19-41-27/h4-12,14-15,20-21,29,37H,13,16-19H2,1-3H3,(H,33,38)(H,34,40)/t20-,21+,29-/m1/s1	UVTNCBQHXJQZIN-HNMNOHOESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ccc(NC(=O)Cc5ccccc5)cc4C1=O	BroadT	BRD-K73528610	BRD-K73528610-001-01-7	Broad Institute of MIT and Harvard	BRD-K73528610			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C32H36N4O7/c1-20-16-36(21(2)18-37)31(39)25-14-23(33-30(38)13-22-7-5-4-6-8-22)9-11-26(25)43-29(20)17-35(3)32(40)34-24-10-12-27-28(15-24)42-19-41-27/h4-12,14-15,20-21,29,37H,13,16-19H2,1-3H3,(H,33,38)(H,34,40)/t20-,21+,29-/m1/s1	UVTNCBQHXJQZIN-HNMNOHOESA-N	588.258399532							113596
BRD-K69536411	LSM-25029		44495146	InChI=1S/C28H39N5O6/c1-17(2)29-28(37)32(5)15-24-18(3)14-33(19(4)16-34)26(35)22-8-7-9-23(25(22)39-24)31-27(36)30-20-10-12-21(38-6)13-11-20/h7-13,17-19,24,34H,14-16H2,1-6H3,(H,29,37)(H2,30,31,36)/t18-,19+,24+/m1/s1	IBFNJHBZCKBINA-IMWIBFENSA-N	COc1ccc(NC(=O)Nc2cccc3C(=O)N(C[C@@H](C)[C@H](CN(C)C(=O)NC(C)C)Oc23)[C@@H](C)CO)cc1	BroadT	BRD-K69536411	BRD-K69536411-001-01-7	Broad Institute of MIT and Harvard	BRD-K69536411			COc1ccc(NC(=O)Nc2cccc3c2O[C@@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@@H](C)CO)C3=O)cc1	InChI=1S/C28H39N5O6/c1-17(2)29-28(37)32(5)15-24-18(3)14-33(19(4)16-34)26(35)22-8-7-9-23(25(22)39-24)31-27(36)30-20-10-12-21(38-6)13-11-20/h7-13,17-19,24,34H,14-16H2,1-6H3,(H,29,37)(H2,30,31,36)/t18-,19+,24+/m1/s1	IBFNJHBZCKBINA-IMWIBFENSA-N	541.290034018							113597
BRD-K00384875	LSM-25030		44491541	InChI=1S/C33H39N3O6/c1-22-18-36(23(2)21-37)32(39)17-27-16-28(34-31(38)15-24-7-5-4-6-8-24)13-14-29(27)42-30(22)20-35(3)19-25-9-11-26(12-10-25)33(40)41/h4-14,16,22-23,30,37H,15,17-21H2,1-3H3,(H,34,38)(H,40,41)/t22-,23+,30+/m0/s1	VWLXYKZHRWDJAR-DDFCPOBKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K00384875	BRD-K00384875-001-01-3	Broad Institute of MIT and Harvard	BRD-K00384875			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C33H39N3O6/c1-22-18-36(23(2)21-37)32(39)17-27-16-28(34-31(38)15-24-7-5-4-6-8-24)13-14-29(27)42-30(22)20-35(3)19-25-9-11-26(12-10-25)33(40)41/h4-14,16,22-23,30,37H,15,17-21H2,1-3H3,(H,34,38)(H,40,41)/t22-,23+,30+/m0/s1	VWLXYKZHRWDJAR-DDFCPOBKSA-N	573.283885998							113598
MLS002474151	LSM-25031	BRD-K64992851, SID85201712	44202794	InChI=1S/C30H32F3N5O5/c1-18-15-38(19(2)17-39)28(41)24-14-23(35-27(40)20-10-12-34-13-11-20)8-9-25(24)43-26(18)16-37(3)29(42)36-22-6-4-21(5-7-22)30(31,32)33/h4-14,18-19,26,39H,15-17H2,1-3H3,(H,35,40)(H,36,42)/t18-,19+,26+/m0/s1	CEYHIDAYCYBVJJ-GNBJCERTSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K64992851	BRD-K64992851-001-02-2	Broad Institute of MIT and Harvard	BRD-K64992851			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C30H32F3N5O5/c1-18-15-38(19(2)17-39)28(41)24-14-23(35-27(40)20-10-12-34-13-11-20)8-9-25(24)43-26(18)16-37(3)29(42)36-22-6-4-21(5-7-22)30(31,32)33/h4-14,18-19,26,39H,15-17H2,1-3H3,(H,35,40)(H,36,42)/t18-,19+,26+/m0/s1	CEYHIDAYCYBVJJ-GNBJCERTSA-N	599.235553774							113599
CHEMBL2141430	LSM-25032	BRD-K40221630, SID85790550	44484137	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)25-14-24(33-31(38)32-23-7-5-4-6-8-23)10-12-26(25)41-29(20)17-34(3)16-22-9-11-27-28(13-22)40-19-39-27/h9-14,20-21,23,29,36H,4-8,15-19H2,1-3H3,(H2,32,33,38)/t20-,21+,29-/m0/s1	WHPNVWBFVYVCKA-FONBTEPMSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)NC5CCCCC5)cc4C1=O	BroadT	BRD-K40221630	BRD-K40221630-001-01-5	Broad Institute of MIT and Harvard	BRD-K40221630			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)25-14-24(33-31(38)32-23-7-5-4-6-8-23)10-12-26(25)41-29(20)17-34(3)16-22-9-11-27-28(13-22)40-19-39-27/h9-14,20-21,23,29,36H,4-8,15-19H2,1-3H3,(H2,32,33,38)/t20-,21+,29-/m0/s1	WHPNVWBFVYVCKA-FONBTEPMSA-N	566.310435104							113600
BRD-K64449549	LSM-25033		44498054	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-19-15(3)11-26(16(4)13-27)21(28)17-9-8-10-18(24(5)6)20(17)30-19/h8-10,14-16,19,27H,11-13H2,1-7H3,(H,23,29)/t15-,16-,19+/m0/s1	XZXNUYDCQDAXAA-TXPKVOOTSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2c(cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K64449549	BRD-K64449549-001-01-3	Broad Institute of MIT and Harvard	BRD-K64449549			CC(C)NC(=O)N(C)C[C@H]1Oc2c(cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-19-15(3)11-26(16(4)13-27)21(28)17-9-8-10-18(24(5)6)20(17)30-19/h8-10,14-16,19,27H,11-13H2,1-7H3,(H,23,29)/t15-,16-,19+/m0/s1	XZXNUYDCQDAXAA-TXPKVOOTSA-N	420.273655672							113601
BRD-K12613826	LSM-25034		44492329	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)20-11-19(28(3)4)7-9-23(20)33-24(16)14-29(5)13-18-6-8-21(26)22(27)10-18/h6-11,16-17,24,31H,12-15H2,1-5H3/t16-,17+,24-/m1/s1	QSGCCBXTIZPHMD-XVTZWQNCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K12613826	BRD-K12613826-001-01-1	Broad Institute of MIT and Harvard	BRD-K12613826			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)20-11-19(28(3)4)7-9-23(20)33-24(16)14-29(5)13-18-6-8-21(26)22(27)10-18/h6-11,16-17,24,31H,12-15H2,1-5H3/t16-,17+,24-/m1/s1	QSGCCBXTIZPHMD-XVTZWQNCSA-N	493.189897366							113602
BRD-K44078665	LSM-25035		44498698	InChI=1S/C28H39N5O4/c1-19-15-33(20(2)18-34)28(36)22-10-7-11-23(31-27(35)24-14-29-12-13-30-24)26(22)37-25(19)17-32(3)16-21-8-5-4-6-9-21/h7,10-14,19-21,25,34H,4-6,8-9,15-18H2,1-3H3,(H,31,35)/t19-,20+,25+/m0/s1	QUBNYOYZPRCGDK-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K44078665	BRD-K44078665-001-01-3	Broad Institute of MIT and Harvard	BRD-K44078665			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H39N5O4/c1-19-15-33(20(2)18-34)28(36)22-10-7-11-23(31-27(35)24-14-29-12-13-30-24)26(22)37-25(19)17-32(3)16-21-8-5-4-6-9-21/h7,10-14,19-21,25,34H,4-6,8-9,15-18H2,1-3H3,(H,31,35)/t19-,20+,25+/m0/s1	QUBNYOYZPRCGDK-WZOHSFFVSA-N	509.300204778							113603
BRD-K13113551	LSM-25036		44493941	InChI=1S/C30H37N5O7/c1-17-12-35(18(2)15-36)29(37)22-7-6-8-23(31-30(38)32-27-19(3)33-42-20(27)4)28(22)41-26(17)14-34(5)13-21-9-10-24-25(11-21)40-16-39-24/h6-11,17-18,26,36H,12-16H2,1-5H3,(H2,31,32,38)/t17-,18-,26+/m1/s1	ROWKUSIEMFYXMA-KABRZNFWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)Nc5c(C)onc5C)cccc4C1=O	BroadT	BRD-K13113551	BRD-K13113551-001-01-2	Broad Institute of MIT and Harvard	BRD-K13113551			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)Nc3c(C)noc3C)cccc2C1=O	InChI=1S/C30H37N5O7/c1-17-12-35(18(2)15-36)29(37)22-7-6-8-23(31-30(38)32-27-19(3)33-42-20(27)4)28(22)41-26(17)14-34(5)13-21-9-10-24-25(11-21)40-16-39-24/h6-11,17-18,26,36H,12-16H2,1-5H3,(H2,31,32,38)/t17-,18-,26+/m1/s1	ROWKUSIEMFYXMA-KABRZNFWSA-N	579.269298574							113604
BRD-K87754766	LSM-25037		44484852	InChI=1S/C34H43N5O6/c1-23-20-39(24(2)22-40)33(42)28-19-26(35-32(41)13-14-38-15-17-44-18-16-38)11-12-30(28)45-31(23)21-37(3)34(43)36-29-10-6-8-25-7-4-5-9-27(25)29/h4-12,19,23-24,31,40H,13-18,20-22H2,1-3H3,(H,35,41)(H,36,43)/t23-,24-,31-/m0/s1	NJKSMJYTSLFNSQ-MKGJDZFWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)CCN5CCOCC5)cc4C1=O	BroadT	BRD-K87754766	BRD-K87754766-001-01-5	Broad Institute of MIT and Harvard	BRD-K87754766			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)CCN3CCOCC3)cc2C1=O	InChI=1S/C34H43N5O6/c1-23-20-39(24(2)22-40)33(42)28-19-26(35-32(41)13-14-38-15-17-44-18-16-38)11-12-30(28)45-31(23)21-37(3)34(43)36-29-10-6-8-25-7-4-5-9-27(25)29/h4-12,19,23-24,31,40H,13-18,20-22H2,1-3H3,(H,35,41)(H,36,43)/t23-,24-,31-/m0/s1	NJKSMJYTSLFNSQ-MKGJDZFWSA-N	617.321334146							113605
BRD-K30510226	LSM-25038		44484130	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)24-13-23(30-29(37)31-27-20(3)32-39-21(27)4)11-12-25(24)38-26(18)16-33(5)15-22-9-7-6-8-10-22/h11-13,18-19,22,26,35H,6-10,14-17H2,1-5H3,(H2,30,31,37)/t18-,19+,26-/m0/s1	GCOOUUHDYUHFBZ-ANSQWYIGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3C1=O	BroadT	BRD-K30510226	BRD-K30510226-001-01-3	Broad Institute of MIT and Harvard	BRD-K30510226			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)24-13-23(30-29(37)31-27-20(3)32-39-21(27)4)11-12-25(24)38-26(18)16-33(5)15-22-9-7-6-8-10-22/h11-13,18-19,22,26,35H,6-10,14-17H2,1-5H3,(H2,30,31,37)/t18-,19+,26-/m0/s1	GCOOUUHDYUHFBZ-ANSQWYIGSA-N	541.326419526							113606
BRD-K55053106	LSM-25039		44489548	InChI=1S/C23H35N3O4/c1-15-13-26(16(2)14-27)23(29)19-11-18(9-10-20(19)30-21(15)12-24-3)25-22(28)17-7-5-4-6-8-17/h9-11,15-17,21,24,27H,4-8,12-14H2,1-3H3,(H,25,28)/t15-,16-,21+/m1/s1	NQJCYDIBEOZMBZ-ZOCZFRKYSA-N	CNC[C@@H]1Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K55053106	BRD-K55053106-001-01-9	Broad Institute of MIT and Harvard	BRD-K55053106			CNC[C@@H]1Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H35N3O4/c1-15-13-26(16(2)14-27)23(29)19-11-18(9-10-20(19)30-21(15)12-24-3)25-22(28)17-7-5-4-6-8-17/h9-11,15-17,21,24,27H,4-8,12-14H2,1-3H3,(H,25,28)/t15-,16-,21+/m1/s1	NQJCYDIBEOZMBZ-ZOCZFRKYSA-N	417.26275663							113607
CHEMBL2354885	LSM-25040	BRD-K09432998, SID85801029	44494233	InChI=1S/C25H35N3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(6)15-23-18(2)14-28(19(3)16-29)25(30)21-8-7-9-22(26(4)5)24(21)33-23/h7-13,18-19,23,29H,14-16H2,1-6H3/t18-,19-,23+/m0/s1	ANXKOFDVDMSSFK-SFYKDHMMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K09432998	BRD-K09432998-001-01-3	Broad Institute of MIT and Harvard	BRD-K09432998			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C25H35N3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(6)15-23-18(2)14-28(19(3)16-29)25(30)21-8-7-9-22(26(4)5)24(21)33-23/h7-13,18-19,23,29H,14-16H2,1-6H3/t18-,19-,23+/m0/s1	ANXKOFDVDMSSFK-SFYKDHMMSA-N	489.22974194							113608
BRD-K15341710	LSM-25041		44497141	InChI=1S/C30H37N3O5S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-39(4,36)37)29(26)38-28(21)19-32(3)18-23-13-15-25(16-14-23)24-9-6-5-7-10-24/h5-16,21-22,28,31,34H,17-20H2,1-4H3/t21-,22-,28-/m0/s1	YVBCCXLDGZBBDC-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)Oc4c(NS(=O)(=O)C)cccc4C1=O	BroadT	BRD-K15341710	BRD-K15341710-001-01-5	Broad Institute of MIT and Harvard	BRD-K15341710			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)Oc2c(NS(C)(=O)=O)cccc2C1=O	InChI=1S/C30H37N3O5S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-39(4,36)37)29(26)38-28(21)19-32(3)18-23-13-15-25(16-14-23)24-9-6-5-7-10-24/h5-16,21-22,28,31,34H,17-20H2,1-4H3/t21-,22-,28-/m0/s1	YVBCCXLDGZBBDC-VPYPWEPUSA-N	551.245392004							113609
MLS002474021	LSM-25042	SID85201534, BRD-K68758518	44202618	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)25-15-23(32-41(38,39)24-12-9-21(30)10-13-24)11-14-26(25)40-27(19)17-33(3)29(37)31-22-7-5-4-6-8-22/h9-15,19-20,22,27,32,35H,4-8,16-18H2,1-3H3,(H,31,37)/t19-,20+,27+/m0/s1	GFSCIXLFWMXIKM-ASHZAFPQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C1=O	BroadT	BRD-K68758518	BRD-K68758518-001-01-0	Broad Institute of MIT and Harvard	BRD-K68758518			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)25-15-23(32-41(38,39)24-12-9-21(30)10-13-24)11-14-26(25)40-27(19)17-33(3)29(37)31-22-7-5-4-6-8-22/h9-15,19-20,22,27,32,35H,4-8,16-18H2,1-3H3,(H,31,37)/t19-,20+,27+/m0/s1	GFSCIXLFWMXIKM-ASHZAFPQSA-N	590.257433898							113610
BRD-K35369722	LSM-25043		44496258	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16-,20-/m0/s1	DJIXJENXBPUHIX-FTRWYGJKSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K35369722	BRD-K35369722-001-01-8	Broad Institute of MIT and Harvard	BRD-K35369722			CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16-,20-/m0/s1	DJIXJENXBPUHIX-FTRWYGJKSA-N	460.268570292							113611
BRD-K00717406	LSM-25044		44490547	InChI=1S/C24H31FN4O6S/c1-15-12-29(16(2)14-30)23(31)20-11-19(27-24(32)26-18-7-5-17(25)6-8-18)9-10-21(20)35-22(15)13-28(3)36(4,33)34/h5-11,15-16,22,30H,12-14H2,1-4H3,(H2,26,27,32)/t15-,16-,22+/m1/s1	MLGOEVOOOJSBLY-MCFFVMPBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K00717406	BRD-K00717406-001-01-2	Broad Institute of MIT and Harvard	BRD-K00717406			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C24H31FN4O6S/c1-15-12-29(16(2)14-30)23(31)20-11-19(27-24(32)26-18-7-5-17(25)6-8-18)9-10-21(20)35-22(15)13-28(3)36(4,33)34/h5-11,15-16,22,30H,12-14H2,1-4H3,(H2,26,27,32)/t15-,16-,22+/m1/s1	MLGOEVOOOJSBLY-MCFFVMPBSA-N	522.194833642							113612
BRD-K29728947	LSM-25045		44497002	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23-,29+/m1/s1	ZVHZCYJHGRNXGN-SGQNLQFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)c4ccc(cc4)c5nccs5)cccc3C1=O	BroadT	BRD-K29728947	BRD-K29728947-001-01-2	Broad Institute of MIT and Harvard	BRD-K29728947			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C1=O	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23-,29+/m1/s1	ZVHZCYJHGRNXGN-SGQNLQFHSA-N	590.292676554							113613
BRD-K93990956	LSM-25046		44503243	InChI=1S/C30H50N4O4/c1-22-18-34(23(2)21-35)30(37)17-25-16-26(31-29(36)12-9-15-32(3)4)13-14-27(25)38-28(22)20-33(5)19-24-10-7-6-8-11-24/h13-14,16,22-24,28,35H,6-12,15,17-21H2,1-5H3,(H,31,36)/t22-,23-,28-/m0/s1	XTYMFXBEGHIJAG-LXWOLXCRSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)CCCN(C)C)cc3CC1=O	BroadT	BRD-K93990956	BRD-K93990956-001-01-7	Broad Institute of MIT and Harvard	BRD-K93990956			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)CCCN(C)C)cc2CC1=O	InChI=1S/C30H50N4O4/c1-22-18-34(23(2)21-35)30(37)17-25-16-26(31-29(36)12-9-15-32(3)4)13-14-27(25)38-28(22)20-33(5)19-24-10-7-6-8-11-24/h13-14,16,22-24,28,35H,6-12,15,17-21H2,1-5H3,(H,31,36)/t22-,23-,28-/m0/s1	XTYMFXBEGHIJAG-LXWOLXCRSA-N	530.38320612							113614
BRD-K15876355	LSM-25047		44487600	InChI=1S/C30H42ClN3O5S/c1-21-17-34(22(2)20-35)30(36)16-24-15-26(32-40(37,38)27-12-9-25(31)10-13-27)11-14-28(24)39-29(21)19-33(3)18-23-7-5-4-6-8-23/h9-15,21-23,29,32,35H,4-8,16-20H2,1-3H3/t21-,22+,29+/m1/s1	YELAEPJECDEDIZ-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3CC1=O	BroadT	BRD-K15876355	BRD-K15876355-001-01-0	Broad Institute of MIT and Harvard	BRD-K15876355			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2CC1=O	InChI=1S/C30H42ClN3O5S/c1-21-17-34(22(2)20-35)30(36)16-24-15-26(32-40(37,38)27-12-9-25(31)10-13-27)11-14-28(24)39-29(21)19-33(3)18-23-7-5-4-6-8-23/h9-15,21-23,29,32,35H,4-8,16-20H2,1-3H3/t21-,22+,29+/m1/s1	YELAEPJECDEDIZ-BXOOBUKZSA-N	591.253369874							113615
BRD-K44236678	LSM-25048		44485897	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)21-12-20(26(3)4)6-7-22(21)31-23(17)15-27(5)14-19-8-10-25-11-9-19/h6-12,17-18,23,29H,13-16H2,1-5H3/t17-,18-,23+/m0/s1	VHHIAINGBKGYCV-IUKKYPGJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K44236678	BRD-K44236678-001-01-2	Broad Institute of MIT and Harvard	BRD-K44236678			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)21-12-20(26(3)4)6-7-22(21)31-23(17)15-27(5)14-19-8-10-25-11-9-19/h6-12,17-18,23,29H,13-16H2,1-5H3/t17-,18-,23+/m0/s1	VHHIAINGBKGYCV-IUKKYPGJSA-N	426.263090988							113616
BRD-K70237115	LSM-25049		44495207	InChI=1S/C28H39N5O4/c1-19-15-33(20(2)18-34)28(36)22-10-7-11-23(31-27(35)24-14-29-12-13-30-24)26(22)37-25(19)17-32(3)16-21-8-5-4-6-9-21/h7,10-14,19-21,25,34H,4-6,8-9,15-18H2,1-3H3,(H,31,35)/t19-,20-,25+/m1/s1	QUBNYOYZPRCGDK-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)c4cnccn4)cccc3C1=O	BroadT	BRD-K70237115	BRD-K70237115-001-01-8	Broad Institute of MIT and Harvard	BRD-K70237115			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)c3cnccn3)cccc2C1=O	InChI=1S/C28H39N5O4/c1-19-15-33(20(2)18-34)28(36)22-10-7-11-23(31-27(35)24-14-29-12-13-30-24)26(22)37-25(19)17-32(3)16-21-8-5-4-6-9-21/h7,10-14,19-21,25,34H,4-6,8-9,15-18H2,1-3H3,(H,31,35)/t19-,20-,25+/m1/s1	QUBNYOYZPRCGDK-FHAGJXEFSA-N	509.300204778							113617
BRD-K18523456	LSM-25050		44486808	InChI=1S/C23H34N4O6S/c1-14-11-27(15(2)13-28)23(29)18-9-8-10-19(25(5)6)21(18)32-20(14)12-26(7)34(30,31)22-16(3)24-33-17(22)4/h8-10,14-15,20,28H,11-13H2,1-7H3/t14-,15-,20+/m1/s1	NGTZGERAXWJDKM-SXGZJXTBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K18523456	BRD-K18523456-001-01-3	Broad Institute of MIT and Harvard	BRD-K18523456			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C23H34N4O6S/c1-14-11-27(15(2)13-28)23(29)18-9-8-10-19(25(5)6)21(18)32-20(14)12-26(7)34(30,31)22-16(3)24-33-17(22)4/h8-10,14-15,20,28H,11-13H2,1-7H3/t14-,15-,20+/m1/s1	NGTZGERAXWJDKM-SXGZJXTBSA-N	494.219905538							113618
MLS002473711	LSM-25051	BRD-K91952416, SID85201251	44202335	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)29-21-11-12-23-22(13-21)25(34)32(19(4)16-33)14-18(3)24(37-23)15-31(5)27(36)30-20-9-7-6-8-10-20/h6-13,17-19,24,33H,14-16H2,1-5H3,(H,30,36)(H2,28,29,35)/t18-,19+,24+/m0/s1	YWOLVGYTMULQAH-XLNZFTOWSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K91952416	BRD-K91952416-001-02-1	Broad Institute of MIT and Harvard	BRD-K91952416			CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)29-21-11-12-23-22(13-21)25(34)32(19(4)16-33)14-18(3)24(37-23)15-31(5)27(36)30-20-9-7-6-8-10-20/h6-13,17-19,24,33H,14-16H2,1-5H3,(H,30,36)(H2,28,29,35)/t18-,19+,24+/m0/s1	YWOLVGYTMULQAH-XLNZFTOWSA-N	511.279469334							113619
BRD-K14695950	LSM-25052		44495217	InChI=1S/C30H43N3O6S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-40(36,37)25-15-13-24(38-4)14-16-25)29(26)39-28(21)19-32(3)18-23-9-6-5-7-10-23/h8,11-16,21-23,28,31,34H,5-7,9-10,17-20H2,1-4H3/t21-,22-,28+/m0/s1	VVRSDBHKTRDHNY-RXYILKCJSA-N	COc1ccc(cc1)S(=O)(=O)Nc2cccc3C(=O)N(C[C@H](C)[C@@H](CN(C)CC4CCCCC4)Oc23)[C@@H](C)CO	BroadT	BRD-K14695950	BRD-K14695950-001-01-4	Broad Institute of MIT and Harvard	BRD-K14695950			COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1O[C@H](CN(C)CC1CCCCC1)[C@@H](C)CN([C@@H](C)CO)C2=O	InChI=1S/C30H43N3O6S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-40(36,37)25-15-13-24(38-4)14-16-25)29(26)39-28(21)19-32(3)18-23-9-6-5-7-10-23/h8,11-16,21-23,28,31,34H,5-7,9-10,17-20H2,1-4H3/t21-,22-,28+/m0/s1	VVRSDBHKTRDHNY-RXYILKCJSA-N	573.287256816							113620
BRD-K87268607	LSM-25053		44491572	InChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)11-18-10-19(4-5-20(18)31-21(15)12-24-3)26-23(30)17-6-8-25-9-7-17/h4-10,15-16,21,24,28H,11-14H2,1-3H3,(H,26,30)/t15-,16+,21+/m1/s1	FZIMPWDREOYZDI-XFQAVAEZSA-N	CNC[C@@H]1Oc2ccc(NC(=O)c3ccncc3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K87268607	BRD-K87268607-001-01-9	Broad Institute of MIT and Harvard	BRD-K87268607			CNC[C@@H]1Oc2ccc(NC(=O)c3ccncc3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)11-18-10-19(4-5-20(18)31-21(15)12-24-3)26-23(30)17-6-8-25-9-7-17/h4-10,15-16,21,24,28H,11-14H2,1-3H3,(H,26,30)/t15-,16+,21+/m1/s1	FZIMPWDREOYZDI-XFQAVAEZSA-N	426.22670548							113621
BRD-K91879432	LSM-25054		44488925	InChI=1S/C31H43N5O6/c1-20-17-36(21(2)19-37)29(38)26-16-24(33-30(39)32-23-10-13-25(41-4)14-11-23)12-15-27(26)42-28(20)18-35(3)31(40)34-22-8-6-5-7-9-22/h10-16,20-22,28,37H,5-9,17-19H2,1-4H3,(H,34,40)(H2,32,33,39)/t20-,21-,28+/m1/s1	RJROVUFZJIAJHT-CJYOKPGZSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H](CN(C)C(=O)NC4CCCCC4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K91879432	BRD-K91879432-001-01-8	Broad Institute of MIT and Harvard	BRD-K91879432			COc1ccc(NC(=O)Nc2ccc3O[C@@H](CN(C)C(=O)NC4CCCCC4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H43N5O6/c1-20-17-36(21(2)19-37)29(38)26-16-24(33-30(39)32-23-10-13-25(41-4)14-11-23)12-15-27(26)42-28(20)18-35(3)31(40)34-22-8-6-5-7-9-22/h10-16,20-22,28,37H,5-9,17-19H2,1-4H3,(H,34,40)(H2,32,33,39)/t20-,21-,28+/m1/s1	RJROVUFZJIAJHT-CJYOKPGZSA-N	581.321334146							113622
BRD-K28619632	LSM-25055		44490166	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)28-17-25(32(3)4)13-16-29(28)38-30(22)20-33(5)19-24-11-14-27(15-12-24)37-26-9-7-6-8-10-26/h6-17,22-23,30,35H,18-21H2,1-5H3/t22-,23-,30-/m0/s1	WHHZCPPSCKMHDQ-ZRLASMASSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K28619632	BRD-K28619632-001-01-4	Broad Institute of MIT and Harvard	BRD-K28619632			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)28-17-25(32(3)4)13-16-29(28)38-30(22)20-33(5)19-24-11-14-27(15-12-24)37-26-9-7-6-8-10-26/h6-17,22-23,30,35H,18-21H2,1-5H3/t22-,23-,30-/m0/s1	WHHZCPPSCKMHDQ-ZRLASMASSA-N	517.294056758							113623
BRD-K43295075	LSM-25056		44484249	InChI=1S/C30H34N4O6/c1-19-14-34(20(2)17-35)30(37)24-13-23(32-29(36)22-8-10-31-11-9-22)5-7-25(24)40-28(19)16-33(3)15-21-4-6-26-27(12-21)39-18-38-26/h4-13,19-20,28,35H,14-18H2,1-3H3,(H,32,36)/t19-,20-,28-/m0/s1	VPWIZKHQYUSQSD-JVAKCPTJSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)c5ccncc5)cc4C1=O	BroadT	BRD-K43295075	BRD-K43295075-001-01-8	Broad Institute of MIT and Harvard	BRD-K43295075			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C30H34N4O6/c1-19-14-34(20(2)17-35)30(37)24-13-23(32-29(36)22-8-10-31-11-9-22)5-7-25(24)40-28(19)16-33(3)15-21-4-6-26-27(12-21)39-18-38-26/h4-13,19-20,28,35H,14-18H2,1-3H3,(H,32,36)/t19-,20-,28-/m0/s1	VPWIZKHQYUSQSD-JVAKCPTJSA-N	546.247834848							113624
BRD-K78082598	LSM-25057		44488931	InChI=1S/C27H39F3N4O5/c1-17-14-34(18(2)16-35)25(37)21-13-20(31-24(36)11-12-27(28,29)30)9-10-22(21)39-23(17)15-33(3)26(38)32-19-7-5-4-6-8-19/h9-10,13,17-19,23,35H,4-8,11-12,14-16H2,1-3H3,(H,31,36)(H,32,38)/t17-,18-,23+/m1/s1	TZWYYOCTWDTYLD-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K78082598	BRD-K78082598-001-01-6	Broad Institute of MIT and Harvard	BRD-K78082598			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H39F3N4O5/c1-17-14-34(18(2)16-35)25(37)21-13-20(31-24(36)11-12-27(28,29)30)9-10-22(21)39-23(17)15-33(3)26(38)32-19-7-5-4-6-8-19/h9-10,13,17-19,23,35H,4-8,11-12,14-16H2,1-3H3,(H,31,36)(H,32,38)/t17-,18-,23+/m1/s1	TZWYYOCTWDTYLD-PNCHPQGNSA-N	556.287254988							113625
BRD-K29684372	LSM-25058		44617836	InChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20+,25+/m1/s1	LNIIROWVVFKABQ-RNHFSVANSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K29684372	BRD-K29684372-001-01-1	Broad Institute of MIT and Harvard	BRD-K29684372			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccccc3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C27H38N4O6S/c1-18(2)28-27(34)30(5)16-25-19(3)15-31(20(4)17-32)26(33)14-21-13-22(11-12-24(21)37-25)29-38(35,36)23-9-7-6-8-10-23/h6-13,18-20,25,29,32H,14-17H2,1-5H3,(H,28,34)/t19-,20+,25+/m1/s1	LNIIROWVVFKABQ-RNHFSVANSA-N	546.251205666							113626
BRD-K51535480	LSM-25059		44483992	InChI=1S/C27H31Cl2N3O5S2/c1-17-13-32(18(2)16-33)27(34)21-12-20(30-39(35,36)26-5-4-10-38-26)7-9-24(21)37-25(17)15-31(3)14-19-6-8-22(28)23(29)11-19/h4-12,17-18,25,30,33H,13-16H2,1-3H3/t17-,18+,25+/m0/s1	AATIEZKZMFDISZ-YYULODDRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NS(=O)(=O)c4cccs4)cc3C1=O	BroadT	BRD-K51535480	BRD-K51535480-001-01-5	Broad Institute of MIT and Harvard	BRD-K51535480			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NS(=O)(=O)c3cccs3)cc2C1=O	InChI=1S/C27H31Cl2N3O5S2/c1-17-13-32(18(2)16-33)27(34)21-12-20(30-39(35,36)26-5-4-10-38-26)7-9-24(21)37-25(17)15-31(3)14-19-6-8-22(28)23(29)11-19/h4-12,17-18,25,30,33H,13-16H2,1-3H3/t17-,18+,25+/m0/s1	AATIEZKZMFDISZ-YYULODDRSA-N	611.108217922							113627
BRD-K67638302	LSM-25060		44494780	InChI=1S/C26H35N3O5/c1-17-12-29(18(2)15-30)26(31)20-7-6-8-21(27(3)4)25(20)34-24(17)14-28(5)13-19-9-10-22-23(11-19)33-16-32-22/h6-11,17-18,24,30H,12-16H2,1-5H3/t17-,18+,24-/m1/s1	MTQIGCHWPBYMPN-NXMSCROESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K67638302	BRD-K67638302-001-01-5	Broad Institute of MIT and Harvard	BRD-K67638302			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H35N3O5/c1-17-12-29(18(2)15-30)26(31)20-7-6-8-21(27(3)4)25(20)34-24(17)14-28(5)13-19-9-10-22-23(11-19)33-16-32-22/h6-11,17-18,24,30H,12-16H2,1-5H3/t17-,18+,24-/m1/s1	MTQIGCHWPBYMPN-NXMSCROESA-N	469.25767125							113628
BRD-K58275986	LSM-25061		44486848	InChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16-,20+/m0/s1	HFFGMDRCIAVIES-TWOQFEAHSA-N	CNC[C@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K58275986	BRD-K58275986-001-01-0	Broad Institute of MIT and Harvard	BRD-K58275986			CNC[C@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16-,20+/m0/s1	HFFGMDRCIAVIES-TWOQFEAHSA-N	432.273655672							113629
BRD-K62351887	LSM-25062		44491961	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)27-16-10-18-29(36-33(42)35-25-13-5-4-6-14-25)31(27)44-30(22)20-38(3)34(43)37-28-17-9-12-24-11-7-8-15-26(24)28/h7-12,15-18,22-23,25,30,40H,4-6,13-14,19-21H2,1-3H3,(H,37,43)(H2,35,36,42)/t22-,23-,30-/m1/s1	DNNIAXRFSGYFCB-IQLGONJTSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)NC5CCCCC5)cccc4C1=O	BroadT	BRD-K62351887	BRD-K62351887-001-01-3	Broad Institute of MIT and Harvard	BRD-K62351887			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)27-16-10-18-29(36-33(42)35-25-13-5-4-6-14-25)31(27)44-30(22)20-38(3)34(43)37-28-17-9-12-24-11-7-8-15-26(24)28/h7-12,15-18,22-23,25,30,40H,4-6,13-14,19-21H2,1-3H3,(H,37,43)(H2,35,36,42)/t22-,23-,30-/m1/s1	DNNIAXRFSGYFCB-IQLGONJTSA-N	601.326419526							113630
BRD-K32205799	LSM-25063		44500138	InChI=1S/C24H37N3O4/c1-16-13-27(17(2)15-28)24(30)19-11-8-12-20(22(19)31-21(16)14-26(3)4)25-23(29)18-9-6-5-7-10-18/h8,11-12,16-18,21,28H,5-7,9-10,13-15H2,1-4H3,(H,25,29)/t16-,17-,21-/m1/s1	ROULRCQEBOLPNZ-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)C3CCCCC3)cccc2C1=O	BroadT	BRD-K32205799	BRD-K32205799-001-01-5	Broad Institute of MIT and Harvard	BRD-K32205799			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)C3CCCCC3)cccc2C1=O	InChI=1S/C24H37N3O4/c1-16-13-27(17(2)15-28)24(30)19-11-8-12-20(22(19)31-21(16)14-26(3)4)25-23(29)18-9-6-5-7-10-18/h8,11-12,16-18,21,28H,5-7,9-10,13-15H2,1-4H3,(H,25,29)/t16-,17-,21-/m1/s1	ROULRCQEBOLPNZ-CBGDNZLLSA-N	431.278406694							113631
BRD-K20331065	LSM-25064		44483596	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-21-15(3)11-28(16(4)13-29)23(31)19-10-18(8-9-20(19)33-21)26-22(30)17-6-7-17/h8-10,14-17,21,29H,6-7,11-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16-,21-/m0/s1	NEXLFLQFCDOFIH-QYWGDWMGSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)C3CC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K20331065	BRD-K20331065-001-01-0	Broad Institute of MIT and Harvard	BRD-K20331065			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)C3CC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-21-15(3)11-28(16(4)13-29)23(31)19-10-18(8-9-20(19)33-21)26-22(30)17-6-7-17/h8-10,14-17,21,29H,6-7,11-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16-,21-/m0/s1	NEXLFLQFCDOFIH-QYWGDWMGSA-N	460.268570292							113632
BRD-K60952519	LSM-25065		44495663	InChI=1S/C24H33N3O5S2/c1-16-12-27(17(2)15-28)24(29)19-6-4-7-20(25-34(30,31)22-8-5-11-33-22)23(19)32-21(16)14-26(3)13-18-9-10-18/h4-8,11,16-18,21,25,28H,9-10,12-15H2,1-3H3/t16-,17-,21+/m1/s1	JSDMQXJTQZGOQF-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc3c(NS(=O)(=O)c4cccs4)cccc3C1=O	BroadT	BRD-K60952519	BRD-K60952519-001-01-6	Broad Institute of MIT and Harvard	BRD-K60952519			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc2c(NS(=O)(=O)c3cccs3)cccc2C1=O	InChI=1S/C24H33N3O5S2/c1-16-12-27(17(2)15-28)24(29)19-6-4-7-20(25-34(30,31)22-8-5-11-33-22)23(19)32-21(16)14-26(3)13-18-9-10-18/h4-8,11,16-18,21,25,28H,9-10,12-15H2,1-3H3/t16-,17-,21+/m1/s1	JSDMQXJTQZGOQF-LZJOCLMNSA-N	507.186162566							113633
BRD-K94876980	LSM-25066		54613803	InChI=1S/C32H39N3O6S/c1-22-10-13-28(14-11-22)42(39,40)34(4)20-30-23(2)19-35(24(3)21-36)32(38)18-26-17-27(12-15-29(26)41-30)33-31(37)16-25-8-6-5-7-9-25/h5-15,17,23-24,30,36H,16,18-21H2,1-4H3,(H,33,37)/t23-,24+,30+/m0/s1	JFKKEIVDTMFBMW-FVBCXUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K94876980	BRD-K94876980-001-01-7	Broad Institute of MIT and Harvard	BRD-K94876980			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C32H39N3O6S/c1-22-10-13-28(14-11-22)42(39,40)34(4)20-30-23(2)19-35(24(3)21-36)32(38)18-26-17-27(12-15-29(26)41-30)33-31(37)16-25-8-6-5-7-9-25/h5-15,17,23-24,30,36H,16,18-21H2,1-4H3,(H,33,37)/t23-,24+,30+/m0/s1	JFKKEIVDTMFBMW-FVBCXUTKSA-N	593.255956688							113634
BRD-K66941670	LSM-25067		44497115	InChI=1S/C31H42N4O6/c1-20-17-35(21(2)19-36)30(38)25-11-8-12-26(33-29(37)22-9-6-5-7-10-22)28(25)41-27(20)18-34(3)31(39)32-23-13-15-24(40-4)16-14-23/h8,11-16,20-22,27,36H,5-7,9-10,17-19H2,1-4H3,(H,32,39)(H,33,37)/t20-,21+,27-/m1/s1	LSKFJJLXCXBANC-PBDKAQRYSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3c(NC(=O)C4CCCCC4)cccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K66941670	BRD-K66941670-001-01-8	Broad Institute of MIT and Harvard	BRD-K66941670			COc1ccc(NC(=O)N(C)C[C@H]2Oc3c(NC(=O)C4CCCCC4)cccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H42N4O6/c1-20-17-35(21(2)19-36)30(38)25-11-8-12-26(33-29(37)22-9-6-5-7-10-22)28(25)41-27(20)18-34(3)31(39)32-23-13-15-24(40-4)16-14-23/h8,11-16,20-22,27,36H,5-7,9-10,17-19H2,1-4H3,(H,32,39)(H,33,37)/t20-,21+,27-/m1/s1	LSKFJJLXCXBANC-PBDKAQRYSA-N	566.310435104							113635
BRD-K21167361	LSM-25068		54613794	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20+,27+/m0/s1	FITMUQCJUCLPTO-ASHZAFPQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4c(C)onc4C)cc3CC1=O	BroadT	BRD-K21167361	BRD-K21167361-001-01-8	Broad Institute of MIT and Harvard	BRD-K21167361			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3c(C)noc3C)cc2CC1=O	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20+,27+/m0/s1	FITMUQCJUCLPTO-ASHZAFPQSA-N	576.298155858							113636
BRD-K01772946	LSM-25069		44486097	InChI=1S/C28H34F3N3O6/c1-17-12-34(18(2)15-35)27(37)21-11-20(32-26(36)8-9-28(29,30)31)5-7-22(21)40-25(17)14-33(3)13-19-4-6-23-24(10-19)39-16-38-23/h4-7,10-11,17-18,25,35H,8-9,12-16H2,1-3H3,(H,32,36)/t17-,18-,25-/m1/s1	IMDFAXAHWGRKQV-QJMRKGMQSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCC(F)(F)F)cc4C1=O	BroadT	BRD-K01772946	BRD-K01772946-001-01-3	Broad Institute of MIT and Harvard	BRD-K01772946			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C28H34F3N3O6/c1-17-12-34(18(2)15-35)27(37)21-11-20(32-26(36)8-9-28(29,30)31)5-7-22(21)40-25(17)14-33(3)13-19-4-6-23-24(10-19)39-16-38-23/h4-7,10-11,17-18,25,35H,8-9,12-16H2,1-3H3,(H,32,36)/t17-,18-,25-/m1/s1	IMDFAXAHWGRKQV-QJMRKGMQSA-N	565.239970438							113637
SCHEMBL2729829	LSM-25070	BRD-K73830970	44484377	InChI=1S/C27H32N4O4/c1-17-15-31(18(2)16-32)26(33)21-11-7-13-23(25(21)35-24(17)14-28-3)30-27(34)29-22-12-6-9-19-8-4-5-10-20(19)22/h4-13,17-18,24,28,32H,14-16H2,1-3H3,(H2,29,30,34)/t17-,18+,24+/m1/s1	KUARZOKVBLHXEU-YTZAWJCFSA-N	CNC[C@@H]1Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K73830970	BRD-K73830970-001-01-1	Broad Institute of MIT and Harvard	BRD-K73830970			CNC[C@@H]1Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C27H32N4O4/c1-17-15-31(18(2)16-32)26(33)21-11-7-13-23(25(21)35-24(17)14-28-3)30-27(34)29-22-12-6-9-19-8-4-5-10-20(19)22/h4-13,17-18,24,28,32H,14-16H2,1-3H3,(H2,29,30,34)/t17-,18+,24+/m1/s1	KUARZOKVBLHXEU-YTZAWJCFSA-N	476.242355544							113638
BRD-K66032509	LSM-25071		44491239	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)29-21-11-12-23-22(13-21)25(34)32(19(4)16-33)14-18(3)24(37-23)15-31(5)27(36)30-20-9-7-6-8-10-20/h6-13,17-19,24,33H,14-16H2,1-5H3,(H,30,36)(H2,28,29,35)/t18-,19-,24-/m1/s1	YWOLVGYTMULQAH-KHCICDEESA-N	CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K66032509	BRD-K66032509-001-01-3	Broad Institute of MIT and Harvard	BRD-K66032509			CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)29-21-11-12-23-22(13-21)25(34)32(19(4)16-33)14-18(3)24(37-23)15-31(5)27(36)30-20-9-7-6-8-10-20/h6-13,17-19,24,33H,14-16H2,1-5H3,(H,30,36)(H2,28,29,35)/t18-,19-,24-/m1/s1	YWOLVGYTMULQAH-KHCICDEESA-N	511.279469334							113639
BRD-K87927290	LSM-25072		44483882	InChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)11-18-10-19(4-5-20(18)31-21(15)12-24-3)26-23(30)17-6-8-25-9-7-17/h4-10,15-16,21,24,28H,11-14H2,1-3H3,(H,26,30)/t15-,16-,21-/m1/s1	FZIMPWDREOYZDI-WHSLLNHNSA-N	CNC[C@H]1Oc2ccc(NC(=O)c3ccncc3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K87927290	BRD-K87927290-001-01-2	Broad Institute of MIT and Harvard	BRD-K87927290			CNC[C@H]1Oc2ccc(NC(=O)c3ccncc3)cc2CC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)11-18-10-19(4-5-20(18)31-21(15)12-24-3)26-23(30)17-6-8-25-9-7-17/h4-10,15-16,21,24,28H,11-14H2,1-3H3,(H,26,30)/t15-,16-,21-/m1/s1	FZIMPWDREOYZDI-WHSLLNHNSA-N	426.22670548							113640
BRD-K68823900	LSM-25073		44484402	InChI=1S/C23H34N4O6S/c1-14-11-27(15(2)13-28)23(29)18-9-8-10-19(25(5)6)21(18)32-20(14)12-26(7)34(30,31)22-16(3)24-33-17(22)4/h8-10,14-15,20,28H,11-13H2,1-7H3/t14-,15+,20+/m1/s1	NGTZGERAXWJDKM-SIFCLUCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K68823900	BRD-K68823900-001-01-8	Broad Institute of MIT and Harvard	BRD-K68823900			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C23H34N4O6S/c1-14-11-27(15(2)13-28)23(29)18-9-8-10-19(25(5)6)21(18)32-20(14)12-26(7)34(30,31)22-16(3)24-33-17(22)4/h8-10,14-15,20,28H,11-13H2,1-7H3/t14-,15+,20+/m1/s1	NGTZGERAXWJDKM-SIFCLUCFSA-N	494.219905538							113641
BRD-K39672303	LSM-25074		54613792	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20+,27+/m1/s1	FITMUQCJUCLPTO-JVAFGIKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4c(C)onc4C)cc3CC1=O	BroadT	BRD-K39672303	BRD-K39672303-001-01-8	Broad Institute of MIT and Harvard	BRD-K39672303			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3c(C)noc3C)cc2CC1=O	InChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20+,27+/m1/s1	FITMUQCJUCLPTO-JVAFGIKQSA-N	576.298155858							113642
BRD-K57650037	LSM-25075		44489518	InChI=1S/C24H33N3O5S/c1-17-14-27(18(2)16-28)24(29)21-13-19(25(3)4)11-12-22(21)32-23(17)15-26(5)33(30,31)20-9-7-6-8-10-20/h6-13,17-18,23,28H,14-16H2,1-5H3/t17-,18-,23+/m1/s1	ZRFMJOMCDWKIOJ-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K57650037	BRD-K57650037-001-01-4	Broad Institute of MIT and Harvard	BRD-K57650037			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C24H33N3O5S/c1-17-14-27(18(2)16-28)24(29)21-13-19(25(3)4)11-12-22(21)32-23(17)15-26(5)33(30,31)20-9-7-6-8-10-20/h6-13,17-18,23,28H,14-16H2,1-5H3/t17-,18-,23+/m1/s1	ZRFMJOMCDWKIOJ-PNCHPQGNSA-N	475.214091876							113643
BRD-K09842906	LSM-25076		44491566	InChI=1S/C26H36N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h6-13,18-19,24,31H,14-17H2,1-5H3,(H,27,33)/t18-,19+,24+/m1/s1	QJWSWWKQIHLYJD-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K09842906	BRD-K09842906-001-01-4	Broad Institute of MIT and Harvard	BRD-K09842906			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C26H36N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h6-13,18-19,24,31H,14-17H2,1-5H3,(H,27,33)/t18-,19+,24+/m1/s1	QJWSWWKQIHLYJD-IMWIBFENSA-N	468.273655672							113644
MLS002473955	LSM-25077	BRD-K11566982, SID85201475	44202559	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)20-7-6-8-21(26(3)4)23(20)31-22(17)15-27(5)14-19-9-11-25-12-10-19/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18+,22+/m0/s1	OVBQAIOLOOTXQW-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K11566982	BRD-K11566982-001-02-0	Broad Institute of MIT and Harvard	BRD-K11566982			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)20-7-6-8-21(26(3)4)23(20)31-22(17)15-27(5)14-19-9-11-25-12-10-19/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18+,22+/m0/s1	OVBQAIOLOOTXQW-NJNPRVFISA-N	426.263090988							113645
BRD-K53647637	LSM-25078		54613790	InChI=1S/C29H41FN4O6S/c1-20-17-34(21(2)19-35)29(37)16-22-15-24(31-28(36)7-6-14-32(3)4)10-13-26(22)40-27(20)18-33(5)41(38,39)25-11-8-23(30)9-12-25/h8-13,15,20-21,27,35H,6-7,14,16-19H2,1-5H3,(H,31,36)/t20-,21+,27-/m1/s1	QROKXOKLOVAMIJ-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)CCCN(C)C)cc3CC1=O	BroadT	BRD-K53647637	BRD-K53647637-001-01-8	Broad Institute of MIT and Harvard	BRD-K53647637			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)CCCN(C)C)cc2CC1=O	InChI=1S/C29H41FN4O6S/c1-20-17-34(21(2)19-35)29(37)16-22-15-24(31-28(36)7-6-14-32(3)4)10-13-26(22)40-27(20)18-33(5)41(38,39)25-11-8-23(30)9-12-25/h8-13,15,20-21,27,35H,6-7,14,16-19H2,1-5H3,(H,31,36)/t20-,21+,27-/m1/s1	QROKXOKLOVAMIJ-PBDKAQRYSA-N	592.273083962							113646
BRD-K34243619	LSM-25079		44491037	InChI=1S/C30H35N3O7S/c1-20-15-33(21(2)18-34)30(35)25-14-23(31-41(36,37)24-7-5-4-6-8-24)10-12-26(25)40-29(20)17-32(3)16-22-9-11-27-28(13-22)39-19-38-27/h4-14,20-21,29,31,34H,15-19H2,1-3H3/t20-,21+,29+/m0/s1	YPROYXXRHQGNKF-BNJCFXFUSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NS(=O)(=O)c5ccccc5)cc4C1=O	BroadT	BRD-K34243619	BRD-K34243619-001-01-2	Broad Institute of MIT and Harvard	BRD-K34243619			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H35N3O7S/c1-20-15-33(21(2)18-34)30(35)25-14-23(31-41(36,37)24-7-5-4-6-8-24)10-12-26(25)40-29(20)17-32(3)16-22-9-11-27-28(13-22)39-19-38-27/h4-14,20-21,29,31,34H,15-19H2,1-3H3/t20-,21+,29+/m0/s1	YPROYXXRHQGNKF-BNJCFXFUSA-N	581.21957118							113647
BRD-K33497830	LSM-25080		44492299	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)29-21-11-12-23-22(13-21)25(34)32(19(4)16-33)14-18(3)24(37-23)15-31(5)27(36)30-20-9-7-6-8-10-20/h6-13,17-19,24,33H,14-16H2,1-5H3,(H,30,36)(H2,28,29,35)/t18-,19+,24-/m0/s1	YWOLVGYTMULQAH-GLDPYIMESA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K33497830	BRD-K33497830-001-01-8	Broad Institute of MIT and Harvard	BRD-K33497830			CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)29-21-11-12-23-22(13-21)25(34)32(19(4)16-33)14-18(3)24(37-23)15-31(5)27(36)30-20-9-7-6-8-10-20/h6-13,17-19,24,33H,14-16H2,1-5H3,(H,30,36)(H2,28,29,35)/t18-,19+,24-/m0/s1	YWOLVGYTMULQAH-GLDPYIMESA-N	511.279469334							113648
BRD-K31479652	LSM-25081		44504126	InChI=1S/C24H33N3O6S/c1-16-14-27(17(2)15-28)24(29)12-18-11-19(5-10-22(18)33-23(16)13-25-3)26-34(30,31)21-8-6-20(32-4)7-9-21/h5-11,16-17,23,25-26,28H,12-15H2,1-4H3/t16-,17-,23-/m0/s1	WHSSCNZRIKSNFR-QQMNAOGKSA-N	CNC[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K31479652	BRD-K31479652-001-01-3	Broad Institute of MIT and Harvard	BRD-K31479652			CNC[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H33N3O6S/c1-16-14-27(17(2)15-28)24(29)12-18-11-19(5-10-22(18)33-23(16)13-25-3)26-34(30,31)21-8-6-20(32-4)7-9-21/h5-11,16-17,23,25-26,28H,12-15H2,1-4H3/t16-,17-,23-/m0/s1	WHSSCNZRIKSNFR-QQMNAOGKSA-N	491.209006496							113649
BRD-K43473008	LSM-25082		44489545	InChI=1S/C30H35N3O7S/c1-20-15-33(21(2)18-34)30(35)25-14-23(31-41(36,37)24-7-5-4-6-8-24)10-12-26(25)40-29(20)17-32(3)16-22-9-11-27-28(13-22)39-19-38-27/h4-14,20-21,29,31,34H,15-19H2,1-3H3/t20-,21-,29+/m1/s1	YPROYXXRHQGNKF-RLCGNTSFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NS(=O)(=O)c5ccccc5)cc4C1=O	BroadT	BRD-K43473008	BRD-K43473008-001-01-3	Broad Institute of MIT and Harvard	BRD-K43473008			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H35N3O7S/c1-20-15-33(21(2)18-34)30(35)25-14-23(31-41(36,37)24-7-5-4-6-8-24)10-12-26(25)40-29(20)17-32(3)16-22-9-11-27-28(13-22)39-19-38-27/h4-14,20-21,29,31,34H,15-19H2,1-3H3/t20-,21-,29+/m1/s1	YPROYXXRHQGNKF-RLCGNTSFSA-N	581.21957118							113650
BRD-K44956383	LSM-25083		44484381	InChI=1S/C29H39N5O5/c1-19-16-34(20(2)18-35)28(37)23-10-7-11-24(32-27(36)21-12-14-30-15-13-21)26(23)39-25(19)17-33(3)29(38)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,25,35H,4-6,8-9,16-18H2,1-3H3,(H,31,38)(H,32,36)/t19-,20+,25+/m1/s1	KKCRHGGATFNVQS-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K44956383	BRD-K44956383-001-01-1	Broad Institute of MIT and Harvard	BRD-K44956383			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C29H39N5O5/c1-19-16-34(20(2)18-35)28(37)23-10-7-11-24(32-27(36)21-12-14-30-15-13-21)26(23)39-25(19)17-33(3)29(38)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,25,35H,4-6,8-9,16-18H2,1-3H3,(H,31,38)(H,32,36)/t19-,20+,25+/m1/s1	KKCRHGGATFNVQS-RNHFSVANSA-N	537.295119398							113651
BRD-K64890664	LSM-25084		44490507	InChI=1S/C28H38N4O6/c1-17(2)29-28(37)30-22-10-11-24-23(12-22)26(34)32(19(4)16-33)13-18(3)25(38-24)15-31(5)14-20-6-8-21(9-7-20)27(35)36/h6-12,17-19,25,33H,13-16H2,1-5H3,(H,35,36)(H2,29,30,37)/t18-,19+,25+/m0/s1	IVCWXLSTMUVHLA-OSWQYVSFSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K64890664	BRD-K64890664-001-02-5	Broad Institute of MIT and Harvard	BRD-K64890664			CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H38N4O6/c1-17(2)29-28(37)30-22-10-11-24-23(12-22)26(34)32(19(4)16-33)13-18(3)25(38-24)15-31(5)14-20-6-8-21(9-7-20)27(35)36/h6-12,17-19,25,33H,13-16H2,1-5H3,(H,35,36)(H2,29,30,37)/t18-,19+,25+/m0/s1	IVCWXLSTMUVHLA-OSWQYVSFSA-N	526.279134976							113652
BRD-K28885073	LSM-25085		44484857	InChI=1S/C17H27N3O5S/c1-11-9-20(12(2)10-21)17(22)14-7-13(19-26(4,23)24)5-6-15(14)25-16(11)8-18-3/h5-7,11-12,16,18-19,21H,8-10H2,1-4H3/t11-,12-,16-/m0/s1	HMGKWXPABBQPJW-MKBNYLNASA-N	CNC[C@@H]1Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K28885073	BRD-K28885073-001-01-7	Broad Institute of MIT and Harvard	BRD-K28885073			CNC[C@@H]1Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C17H27N3O5S/c1-11-9-20(12(2)10-21)17(22)14-7-13(19-26(4,23)24)5-6-15(14)25-16(11)8-18-3/h5-7,11-12,16,18-19,21H,8-10H2,1-4H3/t11-,12-,16-/m0/s1	HMGKWXPABBQPJW-MKBNYLNASA-N	385.167141684							113653
BRD-K15521652	LSM-25086		44486019	InChI=1S/C35H38N4O5/c1-24-20-39(25(2)23-40)35(42)31-19-28(37-34(41)27-15-17-36-18-16-27)11-14-32(31)44-33(24)22-38(3)21-26-9-12-30(13-10-26)43-29-7-5-4-6-8-29/h4-19,24-25,33,40H,20-23H2,1-3H3,(H,37,41)/t24-,25+,33-/m0/s1	NYKHOXZKFLRULB-DVIHYUSWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(NC(=O)c5ccncc5)cc4C1=O	BroadT	BRD-K15521652	BRD-K15521652-001-01-2	Broad Institute of MIT and Harvard	BRD-K15521652			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H38N4O5/c1-24-20-39(25(2)23-40)35(42)31-19-28(37-34(41)27-15-17-36-18-16-27)11-14-32(31)44-33(24)22-38(3)21-26-9-12-30(13-10-26)43-29-7-5-4-6-8-29/h4-19,24-25,33,40H,20-23H2,1-3H3,(H,37,41)/t24-,25+,33-/m0/s1	NYKHOXZKFLRULB-DVIHYUSWSA-N	594.284220356							113654
CHEMBL2141055	LSM-15033	SID85792654, BRD-K38553273	44486194	InChI=1S/C30H33F3N4O4/c1-19-15-37(20(2)18-38)29(40)24-5-4-6-25(35-28(39)22-11-13-34-14-12-22)27(24)41-26(19)17-36(3)16-21-7-9-23(10-8-21)30(31,32)33/h4-14,19-20,26,38H,15-18H2,1-3H3,(H,35,39)/t19-,20-,26+/m0/s1	KEFKPOALKIRQIF-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K38553273	BRD-K38553273-001-01-7	Broad Institute of MIT and Harvard	BRD-K38553273			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C30H33F3N4O4/c1-19-15-37(20(2)18-38)29(40)24-5-4-6-25(35-28(39)22-11-13-34-14-12-22)27(24)41-26(19)17-36(3)16-21-7-9-23(10-8-21)30(31,32)33/h4-14,19-20,26,38H,15-18H2,1-3H3,(H,35,39)/t19-,20-,26+/m0/s1	KEFKPOALKIRQIF-CUVVAGTFSA-N	570.245390176							103689
BRD-K36523261	LSM-25087		44498876	InChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21+,26+/m0/s1	QPEXUVZRKHXLPB-LZCXECNNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)C4CCOCC4)cccc3C1=O	BroadT	BRD-K36523261	BRD-K36523261-001-01-6	Broad Institute of MIT and Harvard	BRD-K36523261			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21+,26+/m0/s1	QPEXUVZRKHXLPB-LZCXECNNSA-N	515.33592157							113655
BRD-K84745303	LSM-25088		44619598	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m0/s1	WWNAWZZZIRHUSD-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)Nc4ccccc4)cc3CC1=O	BroadT	BRD-K84745303	BRD-K84745303-001-01-6	Broad Institute of MIT and Harvard	BRD-K84745303			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)Nc3ccccc3)cc2CC1=O	InChI=1S/C30H35FN4O6S/c1-20-17-35(21(2)19-36)29(37)16-22-15-25(33-30(38)32-24-7-5-4-6-8-24)11-14-27(22)41-28(20)18-34(3)42(39,40)26-12-9-23(31)10-13-26/h4-15,20-21,28,36H,16-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m0/s1	WWNAWZZZIRHUSD-BALWLHIASA-N	598.22613377							113656
BRD-K78828094	LSM-25089		44483465	InChI=1S/C31H43N5O6/c1-20-17-36(21(2)19-37)29(38)26-16-24(33-30(39)32-23-10-13-25(41-4)14-11-23)12-15-27(26)42-28(20)18-35(3)31(40)34-22-8-6-5-7-9-22/h10-16,20-22,28,37H,5-9,17-19H2,1-4H3,(H,34,40)(H2,32,33,39)/t20-,21-,28+/m0/s1	RJROVUFZJIAJHT-YHGPEZAFSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)C(=O)NC4CCCCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K78828094	BRD-K78828094-001-01-1	Broad Institute of MIT and Harvard	BRD-K78828094			COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)C(=O)NC4CCCCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H43N5O6/c1-20-17-36(21(2)19-37)29(38)26-16-24(33-30(39)32-23-10-13-25(41-4)14-11-23)12-15-27(26)42-28(20)18-35(3)31(40)34-22-8-6-5-7-9-22/h10-16,20-22,28,37H,5-9,17-19H2,1-4H3,(H,34,40)(H2,32,33,39)/t20-,21-,28+/m0/s1	RJROVUFZJIAJHT-YHGPEZAFSA-N	581.321334146							113657
BRD-K26631178	LSM-25090		44483593	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)22-12-21(28-25(32)20-4-5-20)6-7-23(22)34-24(17)15-29(3)14-19-8-10-27-11-9-19/h6-12,17-18,20,24,31H,4-5,13-16H2,1-3H3,(H,28,32)/t17-,18-,24-/m0/s1	QDSHHCHLIAQNJH-XFAGBWLFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ccc(NC(=O)C4CC4)cc3C1=O	BroadT	BRD-K26631178	BRD-K26631178-001-01-1	Broad Institute of MIT and Harvard	BRD-K26631178			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(NC(=O)C3CC3)cc2C1=O	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)22-12-21(28-25(32)20-4-5-20)6-7-23(22)34-24(17)15-29(3)14-19-8-10-27-11-9-19/h6-12,17-18,20,24,31H,4-5,13-16H2,1-3H3,(H,28,32)/t17-,18-,24-/m0/s1	QDSHHCHLIAQNJH-XFAGBWLFSA-N	466.258005608							113658
BRD-K03849840	LSM-25091		44489167	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11-,14+/m1/s1	CZXYLKJVFUIZEK-GYSYKLTISA-N	CNC[C@@H]1Oc2c(N)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K03849840	BRD-K03849840-001-01-4	Broad Institute of MIT and Harvard	BRD-K03849840			CNC[C@@H]1Oc2c(N)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C16H25N3O3/c1-10-8-19(11(2)9-20)16(21)12-5-4-6-13(17)15(12)22-14(10)7-18-3/h4-6,10-11,14,18,20H,7-9,17H2,1-3H3/t10-,11-,14+/m1/s1	CZXYLKJVFUIZEK-GYSYKLTISA-N	307.18959169							113659
BRD-K33865795	LSM-25092		44489552	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16-,20+/m1/s1	GIKJWVQVMSIYNX-QINHECLXSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K33865795	BRD-K33865795-001-01-9	Broad Institute of MIT and Harvard	BRD-K33865795			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16-,20+/m1/s1	GIKJWVQVMSIYNX-QINHECLXSA-N	420.273655672							113660
BRD-K37308886	LSM-25093		44620224	InChI=1S/C27H35N3O6S/c1-18-15-30(19(2)17-31)26(32)14-21-13-22(28-27(33)20-9-10-20)11-12-24(21)36-25(18)16-29(3)37(34,35)23-7-5-4-6-8-23/h4-8,11-13,18-20,25,31H,9-10,14-17H2,1-3H3,(H,28,33)/t18-,19+,25+/m0/s1	MWSPHKIBVREWDU-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(NC(=O)C4CC4)cc3CC1=O	BroadT	BRD-K37308886	BRD-K37308886-001-01-6	Broad Institute of MIT and Harvard	BRD-K37308886			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(NC(=O)C3CC3)cc2CC1=O	InChI=1S/C27H35N3O6S/c1-18-15-30(19(2)17-31)26(32)14-21-13-22(28-27(33)20-9-10-20)11-12-24(21)36-25(18)16-29(3)37(34,35)23-7-5-4-6-8-23/h4-8,11-13,18-20,25,31H,9-10,14-17H2,1-3H3,(H,28,33)/t18-,19+,25+/m0/s1	MWSPHKIBVREWDU-OSWQYVSFSA-N	529.22465656							113661
BRD-K88936403	LSM-25094		54613799	InChI=1S/C24H38N4O4/c1-16-14-28(17(2)15-29)23(30)12-18-11-20(9-10-21(18)32-22(16)13-25-3)27-24(31)26-19-7-5-4-6-8-19/h9-11,16-17,19,22,25,29H,4-8,12-15H2,1-3H3,(H2,26,27,31)/t16-,17-,22+/m0/s1	UULCDSMPFJBLQO-PNLZDCPESA-N	CNC[C@H]1Oc2ccc(NC(=O)NC3CCCCC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K88936403	BRD-K88936403-001-01-6	Broad Institute of MIT and Harvard	BRD-K88936403			CNC[C@H]1Oc2ccc(NC(=O)NC3CCCCC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H38N4O4/c1-16-14-28(17(2)15-29)23(30)12-18-11-20(9-10-21(18)32-22(16)13-25-3)27-24(31)26-19-7-5-4-6-8-19/h9-11,16-17,19,22,25,29H,4-8,12-15H2,1-3H3,(H2,26,27,31)/t16-,17-,22+/m0/s1	UULCDSMPFJBLQO-PNLZDCPESA-N	446.289305736							113662
BRD-K34009761	LSM-25095		44486188	InChI=1S/C20H29N5O5S/c1-13-9-25(14(2)11-26)20(27)15-6-5-7-16(19(15)30-17(13)8-21-3)23-31(28,29)18-10-24(4)12-22-18/h5-7,10,12-14,17,21,23,26H,8-9,11H2,1-4H3/t13-,14-,17+/m0/s1	KOTZITAVGRXIOH-GRDNDAEWSA-N	CNC[C@H]1Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K34009761	BRD-K34009761-001-01-3	Broad Institute of MIT and Harvard	BRD-K34009761			CNC[C@H]1Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C20H29N5O5S/c1-13-9-25(14(2)11-26)20(27)15-6-5-7-16(19(15)30-17(13)8-21-3)23-31(28,29)18-10-24(4)12-22-18/h5-7,10,12-14,17,21,23,26H,8-9,11H2,1-4H3/t13-,14-,17+/m0/s1	KOTZITAVGRXIOH-GRDNDAEWSA-N	451.188939768							113663
MLS002473751	LSM-25096	SID85201290, BRD-K04704273	44202374	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)21-12-20(26(3)4)6-7-22(21)31-23(17)15-27(5)14-19-8-10-25-11-9-19/h6-12,17-18,23,29H,13-16H2,1-5H3/t17-,18+,23-/m1/s1	VHHIAINGBKGYCV-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K04704273	BRD-K04704273-001-01-6	Broad Institute of MIT and Harvard	BRD-K04704273			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)21-12-20(26(3)4)6-7-22(21)31-23(17)15-27(5)14-19-8-10-25-11-9-19/h6-12,17-18,23,29H,13-16H2,1-5H3/t17-,18+,23-/m1/s1	VHHIAINGBKGYCV-IEGUWTFLSA-N	426.263090988							113664
BRD-K52341452	LSM-25097		44484280	InChI=1S/C29H33ClN4O6S/c1-19-16-34(20(2)18-35)28(36)25-15-23(32-41(38,39)24-12-9-21(30)10-13-24)11-14-26(25)40-27(19)17-33(3)29(37)31-22-7-5-4-6-8-22/h4-15,19-20,27,32,35H,16-18H2,1-3H3,(H,31,37)/t19-,20-,27-/m0/s1	JEFIXRBRGXHONI-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K52341452	BRD-K52341452-001-01-1	Broad Institute of MIT and Harvard	BRD-K52341452			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H33ClN4O6S/c1-19-16-34(20(2)18-35)28(36)25-15-23(32-41(38,39)24-12-9-21(30)10-13-24)11-14-26(25)40-27(19)17-33(3)29(37)31-22-7-5-4-6-8-22/h4-15,19-20,27,32,35H,16-18H2,1-3H3,(H,31,37)/t19-,20-,27-/m0/s1	JEFIXRBRGXHONI-OSOCVKALSA-N	600.180933216							113665
BRD-K24396618	LSM-25098		44486760	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)21-12-20(26(3)4)6-7-22(21)31-23(17)15-27(5)14-19-8-10-25-11-9-19/h6-12,17-18,23,29H,13-16H2,1-5H3/t17-,18-,23+/m1/s1	VHHIAINGBKGYCV-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K24396618	BRD-K24396618-001-01-1	Broad Institute of MIT and Harvard	BRD-K24396618			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)21-12-20(26(3)4)6-7-22(21)31-23(17)15-27(5)14-19-8-10-25-11-9-19/h6-12,17-18,23,29H,13-16H2,1-5H3/t17-,18-,23+/m1/s1	VHHIAINGBKGYCV-PNCHPQGNSA-N	426.263090988							113666
BRD-K56223790	LSM-25099		44495790	InChI=1S/C21H34N4O6S/c1-13(2)22-21(28)23-17-9-7-8-16-19(17)31-18(11-24(5)32(6,29)30)14(3)10-25(20(16)27)15(4)12-26/h7-9,13-15,18,26H,10-12H2,1-6H3,(H2,22,23,28)/t14-,15-,18-/m0/s1	JMXMRSKNTVHTGA-MPGHIAIKSA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@H](C)[C@H](CN(C)S(=O)(=O)C)Oc12)[C@@H](C)CO	BroadT	BRD-K56223790	BRD-K56223790-001-01-8	Broad Institute of MIT and Harvard	BRD-K56223790			CC(C)NC(=O)Nc1cccc2c1O[C@@H](CN(C)S(C)(=O)=O)[C@@H](C)CN([C@@H](C)CO)C2=O	InChI=1S/C21H34N4O6S/c1-13(2)22-21(28)23-17-9-7-8-16-19(17)31-18(11-24(5)32(6,29)30)14(3)10-25(20(16)27)15(4)12-26/h7-9,13-15,18,26H,10-12H2,1-6H3,(H2,22,23,28)/t14-,15-,18-/m0/s1	JMXMRSKNTVHTGA-MPGHIAIKSA-N	470.219905538							113667
BRD-K88820027	LSM-25100		44489535	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)28-17-25(32(3)4)13-16-29(28)38-30(22)20-33(5)19-24-11-14-27(15-12-24)37-26-9-7-6-8-10-26/h6-17,22-23,30,35H,18-21H2,1-5H3/t22-,23-,30+/m1/s1	WHHZCPPSCKMHDQ-JWUQWVJQSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K88820027	BRD-K88820027-001-01-8	Broad Institute of MIT and Harvard	BRD-K88820027			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)28-17-25(32(3)4)13-16-29(28)38-30(22)20-33(5)19-24-11-14-27(15-12-24)37-26-9-7-6-8-10-26/h6-17,22-23,30,35H,18-21H2,1-5H3/t22-,23-,30+/m1/s1	WHHZCPPSCKMHDQ-JWUQWVJQSA-N	517.294056758							113668
BRD-K95334975	LSM-25101		44496669	InChI=1S/C26H35ClN4O6S/c1-16(2)28-26(34)30(5)14-23-17(3)13-31(18(4)15-32)25(33)21-7-6-8-22(24(21)37-23)29-38(35,36)20-11-9-19(27)10-12-20/h6-12,16-18,23,29,32H,13-15H2,1-5H3,(H,28,34)/t17-,18-,23-/m0/s1	ROXPMFGZZQEKHB-BSRJHKFKSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NS(=O)(=O)c3ccc(Cl)cc3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K95334975	BRD-K95334975-001-01-3	Broad Institute of MIT and Harvard	BRD-K95334975			CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NS(=O)(=O)c3ccc(Cl)cc3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H35ClN4O6S/c1-16(2)28-26(34)30(5)14-23-17(3)13-31(18(4)15-32)25(33)21-7-6-8-22(24(21)37-23)29-38(35,36)20-11-9-19(27)10-12-20/h6-12,16-18,23,29,32H,13-15H2,1-5H3,(H,28,34)/t17-,18-,23-/m0/s1	ROXPMFGZZQEKHB-BSRJHKFKSA-N	566.19658328							113669
BRD-K73075421	LSM-25102		44484905	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)29-21-9-12-24-23(13-21)26(33)31(20(5)16-32)14-19(4)25(37-24)15-30(6)38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,32H,14-16H2,1-6H3,(H2,28,29,34)/t19-,20-,25-/m0/s1	PKTRFCGFRBZOLH-RLSLOFABSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)S(=O)(=O)c3ccc(C)cc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K73075421	BRD-K73075421-001-01-8	Broad Institute of MIT and Harvard	BRD-K73075421			CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)S(=O)(=O)c3ccc(C)cc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)29-21-9-12-24-23(13-21)26(33)31(20(5)16-32)14-19(4)25(37-24)15-30(6)38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,32H,14-16H2,1-6H3,(H2,28,29,34)/t19-,20-,25-/m0/s1	PKTRFCGFRBZOLH-RLSLOFABSA-N	546.251205666							113670
BRD-K90366266	LSM-25103		44497813	InChI=1S/C28H43N3O4/c1-19-15-31(20(2)18-32)27(33)14-23-13-24(29-28(34)22-7-5-4-6-8-22)11-12-25(23)35-26(19)17-30(3)16-21-9-10-21/h11-13,19-22,26,32H,4-10,14-18H2,1-3H3,(H,29,34)/t19-,20+,26+/m0/s1	OICFVEIUUNSOQD-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NC(=O)C4CCCCC4)cc3CC1=O	BroadT	BRD-K90366266	BRD-K90366266-001-01-8	Broad Institute of MIT and Harvard	BRD-K90366266			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NC(=O)C3CCCCC3)cc2CC1=O	InChI=1S/C28H43N3O4/c1-19-15-31(20(2)18-32)27(33)14-23-13-24(29-28(34)22-7-5-4-6-8-22)11-12-25(23)35-26(19)17-30(3)16-21-9-10-21/h11-13,19-22,26,32H,4-10,14-18H2,1-3H3,(H,29,34)/t19-,20+,26+/m0/s1	OICFVEIUUNSOQD-OUDXUNEISA-N	485.325356886							113671
BRD-K55316222	LSM-25104		44492226	InChI=1S/C35H38N4O5/c1-24-20-39(25(2)23-40)35(42)31-19-28(37-34(41)27-15-17-36-18-16-27)11-14-32(31)44-33(24)22-38(3)21-26-9-12-30(13-10-26)43-29-7-5-4-6-8-29/h4-19,24-25,33,40H,20-23H2,1-3H3,(H,37,41)/t24-,25-,33+/m1/s1	NYKHOXZKFLRULB-PHLCOOFXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(NC(=O)c5ccncc5)cc4C1=O	BroadT	BRD-K55316222	BRD-K55316222-001-01-9	Broad Institute of MIT and Harvard	BRD-K55316222			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H38N4O5/c1-24-20-39(25(2)23-40)35(42)31-19-28(37-34(41)27-15-17-36-18-16-27)11-14-32(31)44-33(24)22-38(3)21-26-9-12-30(13-10-26)43-29-7-5-4-6-8-29/h4-19,24-25,33,40H,20-23H2,1-3H3,(H,37,41)/t24-,25-,33+/m1/s1	NYKHOXZKFLRULB-PHLCOOFXSA-N	594.284220356							113672
CHEMBL2361390	LSM-25105	BRD-K32019201, SID85797127	44490505	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)20-11-19(28(3)4)7-9-23(20)33-24(16)14-29(5)13-18-6-8-21(26)22(27)10-18/h6-11,16-17,24,31H,12-15H2,1-5H3/t16-,17+,24+/m0/s1	QSGCCBXTIZPHMD-OBWXTZQISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K32019201	BRD-K32019201-001-02-0	Broad Institute of MIT and Harvard	BRD-K32019201			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)20-11-19(28(3)4)7-9-23(20)33-24(16)14-29(5)13-18-6-8-21(26)22(27)10-18/h6-11,16-17,24,31H,12-15H2,1-5H3/t16-,17+,24+/m0/s1	QSGCCBXTIZPHMD-OBWXTZQISA-N	493.189897366							113673
BRD-K22449045	LSM-25106		44483474	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)25-15-23(32-41(38,39)24-12-9-21(30)10-13-24)11-14-26(25)40-27(19)17-33(3)29(37)31-22-7-5-4-6-8-22/h9-15,19-20,22,27,32,35H,4-8,16-18H2,1-3H3,(H,31,37)/t19-,20-,27+/m0/s1	GFSCIXLFWMXIKM-OWOAZTCBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C1=O	BroadT	BRD-K22449045	BRD-K22449045-001-01-3	Broad Institute of MIT and Harvard	BRD-K22449045			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)25-15-23(32-41(38,39)24-12-9-21(30)10-13-24)11-14-26(25)40-27(19)17-33(3)29(37)31-22-7-5-4-6-8-22/h9-15,19-20,22,27,32,35H,4-8,16-18H2,1-3H3,(H,31,37)/t19-,20-,27+/m0/s1	GFSCIXLFWMXIKM-OWOAZTCBSA-N	590.257433898							113674
BRD-K01717817	LSM-25107		44485631	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-41(38,39)23-14-12-21(30)13-15-23)27(24)40-26(19)17-33(3)29(37)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,26,32,35H,4-6,8-9,16-18H2,1-3H3,(H,31,37)/t19-,20+,26-/m1/s1	PZASEUVCJBPSCE-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3c(NS(=O)(=O)c4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K01717817	BRD-K01717817-001-01-4	Broad Institute of MIT and Harvard	BRD-K01717817			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C1=O	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-41(38,39)23-14-12-21(30)13-15-23)27(24)40-26(19)17-33(3)29(37)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,26,32,35H,4-6,8-9,16-18H2,1-3H3,(H,31,37)/t19-,20+,26-/m1/s1	PZASEUVCJBPSCE-BVFVYWQFSA-N	590.257433898							113675
BRD-K98005735	LSM-25108		44493783	InChI=1S/C24H31FN4O6S/c1-15-12-29(16(2)14-30)23(31)20-11-19(27-24(32)26-18-7-5-17(25)6-8-18)9-10-21(20)35-22(15)13-28(3)36(4,33)34/h5-11,15-16,22,30H,12-14H2,1-4H3,(H2,26,27,32)/t15-,16+,22-/m0/s1	MLGOEVOOOJSBLY-DMPWYTOCSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K98005735	BRD-K98005735-001-01-7	Broad Institute of MIT and Harvard	BRD-K98005735			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C24H31FN4O6S/c1-15-12-29(16(2)14-30)23(31)20-11-19(27-24(32)26-18-7-5-17(25)6-8-18)9-10-21(20)35-22(15)13-28(3)36(4,33)34/h5-11,15-16,22,30H,12-14H2,1-4H3,(H2,26,27,32)/t15-,16+,22-/m0/s1	MLGOEVOOOJSBLY-DMPWYTOCSA-N	522.194833642							113676
BRD-K08799663	LSM-25109		44488966	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)29-21-11-12-23-22(13-21)25(34)32(19(4)16-33)14-18(3)24(37-23)15-31(5)27(36)30-20-9-7-6-8-10-20/h6-13,17-19,24,33H,14-16H2,1-5H3,(H,30,36)(H2,28,29,35)/t18-,19-,24+/m1/s1	YWOLVGYTMULQAH-IECBHUPTSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K08799663	BRD-K08799663-001-01-0	Broad Institute of MIT and Harvard	BRD-K08799663			CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)C(=O)Nc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)29-21-11-12-23-22(13-21)25(34)32(19(4)16-33)14-18(3)24(37-23)15-31(5)27(36)30-20-9-7-6-8-10-20/h6-13,17-19,24,33H,14-16H2,1-5H3,(H,30,36)(H2,28,29,35)/t18-,19-,24+/m1/s1	YWOLVGYTMULQAH-IECBHUPTSA-N	511.279469334							113677
BRD-K13411423	LSM-25110		44486238	InChI=1S/C23H34N4O6S/c1-14-11-27(15(2)13-28)23(29)18-9-8-10-19(25(5)6)21(18)32-20(14)12-26(7)34(30,31)22-16(3)24-33-17(22)4/h8-10,14-15,20,28H,11-13H2,1-7H3/t14-,15+,20-/m0/s1	NGTZGERAXWJDKM-MDOVXXIYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K13411423	BRD-K13411423-001-01-6	Broad Institute of MIT and Harvard	BRD-K13411423			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C23H34N4O6S/c1-14-11-27(15(2)13-28)23(29)18-9-8-10-19(25(5)6)21(18)32-20(14)12-26(7)34(30,31)22-16(3)24-33-17(22)4/h8-10,14-15,20,28H,11-13H2,1-7H3/t14-,15+,20-/m0/s1	NGTZGERAXWJDKM-MDOVXXIYSA-N	494.219905538							113678
BRD-K46439376	LSM-25111		44495543	InChI=1S/C21H31N5O5S/c1-14-10-26(15(2)12-27)21(28)8-16-7-17(5-6-18(16)31-19(14)9-22-3)24-32(29,30)20-11-25(4)13-23-20/h5-7,11,13-15,19,22,24,27H,8-10,12H2,1-4H3/t14-,15+,19+/m0/s1	CHBVISFKEYYRMC-QMTMVMCOSA-N	CNC[C@H]1Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K46439376	BRD-K46439376-001-01-5	Broad Institute of MIT and Harvard	BRD-K46439376			CNC[C@H]1Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C21H31N5O5S/c1-14-10-26(15(2)12-27)21(28)8-16-7-17(5-6-18(16)31-19(14)9-22-3)24-32(29,30)20-11-25(4)13-23-20/h5-7,11,13-15,19,22,24,27H,8-10,12H2,1-4H3/t14-,15+,19+/m0/s1	CHBVISFKEYYRMC-QMTMVMCOSA-N	465.204589832							113679
BRD-K61087440	LSM-25112		44488574	InChI=1S/C32H36N4O5S/c1-20-16-36(21(2)19-37)32(39)24-8-7-10-26(33-30(38)31-34-25-9-5-6-11-28(25)42-31)29(24)41-27(20)18-35(3)17-22-12-14-23(40-4)15-13-22/h5-15,20-21,27,37H,16-19H2,1-4H3,(H,33,38)/t20-,21+,27+/m1/s1	MFEIQJUBWNYYTI-BUEREQSYSA-N	COc1ccc(CN(C)C[C@@H]2Oc3c(NC(=O)c4nc5ccccc5s4)cccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K61087440	BRD-K61087440-001-01-4	Broad Institute of MIT and Harvard	BRD-K61087440			COc1ccc(CN(C)C[C@@H]2Oc3c(NC(=O)c4nc5ccccc5s4)cccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C32H36N4O5S/c1-20-16-36(21(2)19-37)32(39)24-8-7-10-26(33-30(38)31-34-25-9-5-6-11-28(25)42-31)29(24)41-27(20)18-35(3)17-22-12-14-23(40-4)15-13-22/h5-15,20-21,27,37H,16-19H2,1-4H3,(H,33,38)/t20-,21+,27+/m1/s1	MFEIQJUBWNYYTI-BUEREQSYSA-N	588.240640982							113680
BRD-K84606053	LSM-25113		44490961	InChI=1S/C29H37N3O6/c1-18-13-32(19(2)16-33)28(34)12-22-11-23(30-29(35)21-5-6-21)7-9-24(22)38-27(18)15-31(3)14-20-4-8-25-26(10-20)37-17-36-25/h4,7-11,18-19,21,27,33H,5-6,12-17H2,1-3H3,(H,30,35)/t18-,19+,27+/m0/s1	WXJCYEGRNWVSCE-DSNGTPCMSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)C5CC5)cc4CC1=O	BroadT	BRD-K84606053	BRD-K84606053-001-01-2	Broad Institute of MIT and Harvard	BRD-K84606053			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)C3CC3)cc2CC1=O	InChI=1S/C29H37N3O6/c1-18-13-32(19(2)16-33)28(34)12-22-11-23(30-29(35)21-5-6-21)7-9-24(22)38-27(18)15-31(3)14-20-4-8-25-26(10-20)37-17-36-25/h4,7-11,18-19,21,27,33H,5-6,12-17H2,1-3H3,(H,30,35)/t18-,19+,27+/m0/s1	WXJCYEGRNWVSCE-DSNGTPCMSA-N	523.268235934							113681
BRD-K52115548	LSM-25114		44494682	InChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21-,26+/m1/s1	QPEXUVZRKHXLPB-YPCDYVTLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)C4CCOCC4)cccc3C1=O	BroadT	BRD-K52115548	BRD-K52115548-001-01-5	Broad Institute of MIT and Harvard	BRD-K52115548			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21-,26+/m1/s1	QPEXUVZRKHXLPB-YPCDYVTLSA-N	515.33592157							113682
BRD-K42789863	LSM-25115		44491007	InChI=1S/C21H31N3O4/c1-13-11-24(14(2)12-25)20(26)9-16-8-17(23-21(27)15-4-5-15)6-7-18(16)28-19(13)10-22-3/h6-8,13-15,19,22,25H,4-5,9-12H2,1-3H3,(H,23,27)/t13-,14+,19+/m1/s1	DLUYSMSGKJYNFL-TYILLQQXSA-N	CNC[C@@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K42789863	BRD-K42789863-001-01-7	Broad Institute of MIT and Harvard	BRD-K42789863			CNC[C@@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C21H31N3O4/c1-13-11-24(14(2)12-25)20(26)9-16-8-17(23-21(27)15-4-5-15)6-7-18(16)28-19(13)10-22-3/h6-8,13-15,19,22,25H,4-5,9-12H2,1-3H3,(H,23,27)/t13-,14+,19+/m1/s1	DLUYSMSGKJYNFL-TYILLQQXSA-N	389.231456502							113683
BRD-K01237500	LSM-25116		44484384	InChI=1S/C20H29N5O5S/c1-13-9-25(14(2)11-26)20(27)15-6-5-7-16(19(15)30-17(13)8-21-3)23-31(28,29)18-10-24(4)12-22-18/h5-7,10,12-14,17,21,23,26H,8-9,11H2,1-4H3/t13-,14+,17+/m1/s1	KOTZITAVGRXIOH-KEYYUXOJSA-N	CNC[C@@H]1Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K01237500	BRD-K01237500-001-01-5	Broad Institute of MIT and Harvard	BRD-K01237500			CNC[C@@H]1Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C20H29N5O5S/c1-13-9-25(14(2)11-26)20(27)15-6-5-7-16(19(15)30-17(13)8-21-3)23-31(28,29)18-10-24(4)12-22-18/h5-7,10,12-14,17,21,23,26H,8-9,11H2,1-4H3/t13-,14+,17+/m1/s1	KOTZITAVGRXIOH-KEYYUXOJSA-N	451.188939768							113684
BRD-K31218318	LSM-25117		44486825	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14-,18+/m1/s1	TWHSADQACYCNBZ-LBTNJELSSA-N	CNC[C@@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K31218318	BRD-K31218318-001-01-1	Broad Institute of MIT and Harvard	BRD-K31218318			CNC[C@@H]1Oc2c(NC(=O)c3cnccn3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C21H27N5O4/c1-13-11-26(14(2)12-27)21(29)15-5-4-6-16(19(15)30-18(13)10-22-3)25-20(28)17-9-23-7-8-24-17/h4-9,13-14,18,22,27H,10-12H2,1-3H3,(H,25,28)/t13-,14-,18+/m1/s1	TWHSADQACYCNBZ-LBTNJELSSA-N	413.206304394							113685
BRD-K95574976	LSM-25118		44618343	InChI=1S/C23H37N3O3/c1-16-12-26(17(2)15-27)23(28)11-19-10-20(24(3)4)8-9-21(19)29-22(16)14-25(5)13-18-6-7-18/h8-10,16-18,22,27H,6-7,11-15H2,1-5H3/t16-,17+,22+/m1/s1	DVEIBRZUURAMSY-JLHGSKIFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K95574976	BRD-K95574976-001-01-3	Broad Institute of MIT and Harvard	BRD-K95574976			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C23H37N3O3/c1-16-12-26(17(2)15-27)23(28)11-19-10-20(24(3)4)8-9-21(19)29-22(16)14-25(5)13-18-6-7-18/h8-10,16-18,22,27H,6-7,11-15H2,1-5H3/t16-,17+,22+/m1/s1	DVEIBRZUURAMSY-JLHGSKIFSA-N	403.283492074							113686
BRD-K95871937	LSM-25119		44504818	InChI=1S/C24H38N4O4/c1-16-14-28(17(2)15-29)23(30)12-18-11-20(9-10-21(18)32-22(16)13-25-3)27-24(31)26-19-7-5-4-6-8-19/h9-11,16-17,19,22,25,29H,4-8,12-15H2,1-3H3,(H2,26,27,31)/t16-,17-,22-/m0/s1	UULCDSMPFJBLQO-HOIFWPIMSA-N	CNC[C@@H]1Oc2ccc(NC(=O)NC3CCCCC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K95871937	BRD-K95871937-001-01-1	Broad Institute of MIT and Harvard	BRD-K95871937			CNC[C@@H]1Oc2ccc(NC(=O)NC3CCCCC3)cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C24H38N4O4/c1-16-14-28(17(2)15-29)23(30)12-18-11-20(9-10-21(18)32-22(16)13-25-3)27-24(31)26-19-7-5-4-6-8-19/h9-11,16-17,19,22,25,29H,4-8,12-15H2,1-3H3,(H2,26,27,31)/t16-,17-,22-/m0/s1	UULCDSMPFJBLQO-HOIFWPIMSA-N	446.289305736							113687
BRD-K20259776	LSM-25120		44489145	InChI=1S/C26H34F3N3O3/c1-17-13-32(18(2)16-33)25(34)21-7-6-8-22(30(3)4)24(21)35-23(17)15-31(5)14-19-9-11-20(12-10-19)26(27,28)29/h6-12,17-18,23,33H,13-16H2,1-5H3/t17-,18+,23+/m1/s1	UEVJVAFABFCLJH-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K20259776	BRD-K20259776-001-01-3	Broad Institute of MIT and Harvard	BRD-K20259776			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H34F3N3O3/c1-17-13-32(18(2)16-33)25(34)21-7-6-8-22(30(3)4)24(21)35-23(17)15-31(5)14-19-9-11-20(12-10-19)26(27,28)29/h6-12,17-18,23,33H,13-16H2,1-5H3/t17-,18+,23+/m1/s1	UEVJVAFABFCLJH-STSQHVNTSA-N	493.255226578							113688
BRD-K93819193	LSM-25121		44484394	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18+,23+/m1/s1	BMWRPMHXUFNAQO-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K93819193	BRD-K93819193-001-01-1	Broad Institute of MIT and Harvard	BRD-K93819193			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C26H34N4O4/c1-17-13-30(18(2)16-31)26(33)21-5-4-6-22(28-25(32)20-9-11-27-12-10-20)24(21)34-23(17)15-29(3)14-19-7-8-19/h4-6,9-12,17-19,23,31H,7-8,13-16H2,1-3H3,(H,28,32)/t17-,18+,23+/m1/s1	BMWRPMHXUFNAQO-STSQHVNTSA-N	466.258005608							113689
BRD-K93675803	LSM-25122		44491568	InChI=1S/C33H39N3O6/c1-22-18-36(23(2)21-37)32(39)17-27-16-28(34-31(38)15-24-7-5-4-6-8-24)13-14-29(27)42-30(22)20-35(3)19-25-9-11-26(12-10-25)33(40)41/h4-14,16,22-23,30,37H,15,17-21H2,1-3H3,(H,34,38)(H,40,41)/t22-,23+,30+/m1/s1	VWLXYKZHRWDJAR-HFZPWKHCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K93675803	BRD-K93675803-001-01-9	Broad Institute of MIT and Harvard	BRD-K93675803			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C33H39N3O6/c1-22-18-36(23(2)21-37)32(39)17-27-16-28(34-31(38)15-24-7-5-4-6-8-24)13-14-29(27)42-30(22)20-35(3)19-25-9-11-26(12-10-25)33(40)41/h4-14,16,22-23,30,37H,15,17-21H2,1-3H3,(H,34,38)(H,40,41)/t22-,23+,30+/m1/s1	VWLXYKZHRWDJAR-HFZPWKHCSA-N	573.283885998							113690
CHEMBL2137771	LSM-25123	BRD-K56650430, SID85793287	44486818	InChI=1S/C30H33F3N4O4/c1-19-15-37(20(2)18-38)29(40)24-5-4-6-25(35-28(39)22-11-13-34-14-12-22)27(24)41-26(19)17-36(3)16-21-7-9-23(10-8-21)30(31,32)33/h4-14,19-20,26,38H,15-18H2,1-3H3,(H,35,39)/t19-,20-,26+/m1/s1	KEFKPOALKIRQIF-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K56650430	BRD-K56650430-001-01-8	Broad Institute of MIT and Harvard	BRD-K56650430			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C30H33F3N4O4/c1-19-15-37(20(2)18-38)29(40)24-5-4-6-25(35-28(39)22-11-13-34-14-12-22)27(24)41-26(19)17-36(3)16-21-7-9-23(10-8-21)30(31,32)33/h4-14,19-20,26,38H,15-18H2,1-3H3,(H,35,39)/t19-,20-,26+/m1/s1	KEFKPOALKIRQIF-KYTVRQNUSA-N	570.245390176							113691
BRD-K95171874	LSM-25124		44496038	InChI=1S/C25H37N5O5/c1-15-12-30(16(2)14-31)23(32)11-19-10-20(28(5)6)8-9-21(19)34-22(15)13-29(7)25(33)26-24-17(3)27-35-18(24)4/h8-10,15-16,22,31H,11-14H2,1-7H3,(H,26,33)/t15-,16-,22-/m1/s1	GPPKFMUWSJEKJP-XCGNWRKASA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K95171874	BRD-K95171874-001-01-1	Broad Institute of MIT and Harvard	BRD-K95171874			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C25H37N5O5/c1-15-12-30(16(2)14-31)23(32)11-19-10-20(28(5)6)8-9-21(19)34-22(15)13-29(7)25(33)26-24-17(3)27-35-18(24)4/h8-10,15-16,22,31H,11-14H2,1-7H3,(H,26,33)/t15-,16-,22-/m1/s1	GPPKFMUWSJEKJP-XCGNWRKASA-N	487.279469334							113692
BRD-K16686330	LSM-25125		44488354	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)30(6)15-25-19(4)14-31(20(5)16-32)26(33)23-13-21(9-12-24(23)37-25)29-38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,29,32H,14-16H2,1-6H3,(H,28,34)/t19-,20-,25+/m1/s1	HJQIIGSKSQOFKI-FHAGJXEFSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K16686330	BRD-K16686330-001-01-2	Broad Institute of MIT and Harvard	BRD-K16686330			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)30(6)15-25-19(4)14-31(20(5)16-32)26(33)23-13-21(9-12-24(23)37-25)29-38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,29,32H,14-16H2,1-6H3,(H,28,34)/t19-,20-,25+/m1/s1	HJQIIGSKSQOFKI-FHAGJXEFSA-N	546.251205666							113693
BRD-K16727544	LSM-25126		44492201	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16+,20+/m1/s1	GIKJWVQVMSIYNX-GUXCAODWSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K16727544	BRD-K16727544-001-01-6	Broad Institute of MIT and Harvard	BRD-K16727544			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16+,20+/m1/s1	GIKJWVQVMSIYNX-GUXCAODWSA-N	420.273655672							113694
BRD-K98749544	LSM-25127		44486844	InChI=1S/C31H37N3O8S/c1-20-15-34(21(2)18-35)31(36)25-6-5-7-26(32-43(37,38)24-11-9-23(39-4)10-12-24)30(25)42-29(20)17-33(3)16-22-8-13-27-28(14-22)41-19-40-27/h5-14,20-21,29,32,35H,15-19H2,1-4H3/t20-,21-,29+/m0/s1	AELUQFUEWCFKFM-LRZFZUCMSA-N	COc1ccc(cc1)S(=O)(=O)Nc2cccc3C(=O)N(C[C@H](C)[C@@H](CN(C)Cc4ccc5OCOc5c4)Oc23)[C@@H](C)CO	BroadT	BRD-K98749544	BRD-K98749544-001-01-1	Broad Institute of MIT and Harvard	BRD-K98749544			COc1ccc(cc1)S(=O)(=O)Nc1cccc2c1O[C@H](CN(C)Cc1ccc3OCOc3c1)[C@@H](C)CN([C@@H](C)CO)C2=O	InChI=1S/C31H37N3O8S/c1-20-15-34(21(2)18-35)31(36)25-6-5-7-26(32-43(37,38)24-11-9-23(39-4)10-12-24)30(25)42-29(20)17-33(3)16-22-8-13-27-28(14-22)41-19-40-27/h5-14,20-21,29,32,35H,15-19H2,1-4H3/t20-,21-,29+/m0/s1	AELUQFUEWCFKFM-LRZFZUCMSA-N	611.230135864							113695
BRD-K10564128	LSM-25128		44616812	InChI=1S/C30H50N4O4/c1-22-18-34(23(2)21-35)30(37)17-25-16-26(31-29(36)12-9-15-32(3)4)13-14-27(25)38-28(22)20-33(5)19-24-10-7-6-8-11-24/h13-14,16,22-24,28,35H,6-12,15,17-21H2,1-5H3,(H,31,36)/t22-,23+,28+/m1/s1	XTYMFXBEGHIJAG-IWHLBADBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)CCCN(C)C)cc3CC1=O	BroadT	BRD-K10564128	BRD-K10564128-001-01-3	Broad Institute of MIT and Harvard	BRD-K10564128			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)CCCN(C)C)cc2CC1=O	InChI=1S/C30H50N4O4/c1-22-18-34(23(2)21-35)30(37)17-25-16-26(31-29(36)12-9-15-32(3)4)13-14-27(25)38-28(22)20-33(5)19-24-10-7-6-8-11-24/h13-14,16,22-24,28,35H,6-12,15,17-21H2,1-5H3,(H,31,36)/t22-,23+,28+/m1/s1	XTYMFXBEGHIJAG-IWHLBADBSA-N	530.38320612							113696
BRD-K91085913	LSM-25129		44485161	InChI=1S/C25H33N3O4/c1-17-15-28(18(2)16-29)25(31)13-20-12-21(9-10-22(20)32-23(17)14-26-3)27-24(30)11-19-7-5-4-6-8-19/h4-10,12,17-18,23,26,29H,11,13-16H2,1-3H3,(H,27,30)/t17-,18+,23+/m0/s1	RIHRPLOFFJCHJI-YZZKKUAISA-N	CNC[C@H]1Oc2ccc(NC(=O)Cc3ccccc3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K91085913	BRD-K91085913-001-01-0	Broad Institute of MIT and Harvard	BRD-K91085913			CNC[C@H]1Oc2ccc(NC(=O)Cc3ccccc3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C25H33N3O4/c1-17-15-28(18(2)16-29)25(31)13-20-12-21(9-10-22(20)32-23(17)14-26-3)27-24(30)11-19-7-5-4-6-8-19/h4-10,12,17-18,23,26,29H,11,13-16H2,1-3H3,(H,27,30)/t17-,18+,23+/m0/s1	RIHRPLOFFJCHJI-YZZKKUAISA-N	439.247106566							113697
BRD-K30462643	LSM-25130		44494844	InChI=1S/C30H35N5O6/c1-19-16-35(20(2)18-36)29(38)24-6-5-7-25(33-28(37)21-12-14-31-15-13-21)27(24)41-26(19)17-34(3)30(39)32-22-8-10-23(40-4)11-9-22/h5-15,19-20,26,36H,16-18H2,1-4H3,(H,32,39)(H,33,37)/t19-,20-,26-/m0/s1	YPMOLAXPZMKSMS-DYLHXGEVSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3c(NC(=O)c4ccncc4)cccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K30462643	BRD-K30462643-001-01-2	Broad Institute of MIT and Harvard	BRD-K30462643			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3c(NC(=O)c4ccncc4)cccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C30H35N5O6/c1-19-16-35(20(2)18-36)29(38)24-6-5-7-25(33-28(37)21-12-14-31-15-13-21)27(24)41-26(19)17-34(3)30(39)32-22-8-10-23(40-4)11-9-22/h5-15,19-20,26,36H,16-18H2,1-4H3,(H,32,39)(H,33,37)/t19-,20-,26-/m0/s1	YPMOLAXPZMKSMS-DYLHXGEVSA-N	561.25873389							113698
BRD-K33199242	LSM-25131		44495899	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14-,18-/m0/s1	WYKJOBISBUCKND-DEYYWGMASA-N	CNC[C@@H]1Oc2ccc(cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K33199242	BRD-K33199242-001-01-2	Broad Institute of MIT and Harvard	BRD-K33199242			CNC[C@@H]1Oc2ccc(cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14-,18-/m0/s1	WYKJOBISBUCKND-DEYYWGMASA-N	349.236541882							113699
BRD-K72707702	LSM-25132		44488961	InChI=1S/C29H39FN4O7S/c1-20-17-34(21(2)19-35)29(37)25-16-23(31-28(36)10-11-33-12-14-40-15-13-33)6-9-26(25)41-27(20)18-32(3)42(38,39)24-7-4-22(30)5-8-24/h4-9,16,20-21,27,35H,10-15,17-19H2,1-3H3,(H,31,36)/t20-,21-,27+/m1/s1	NKFYFMCKJSWXRC-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)CCN4CCOCC4)cc3C1=O	BroadT	BRD-K72707702	BRD-K72707702-001-01-7	Broad Institute of MIT and Harvard	BRD-K72707702			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2C1=O	InChI=1S/C29H39FN4O7S/c1-20-17-34(21(2)19-35)29(37)25-16-23(31-28(36)10-11-33-12-14-40-15-13-33)6-9-26(25)41-27(20)18-32(3)42(38,39)24-7-4-22(30)5-8-24/h4-9,16,20-21,27,35H,10-15,17-19H2,1-3H3,(H,31,36)/t20-,21-,27+/m1/s1	NKFYFMCKJSWXRC-GNMOFYLKSA-N	606.252348518							113700
MLS002473704	LSM-25133	SID85201245, BRD-K99377470	44202329	InChI=1S/C21H34N4O6S/c1-13(2)22-21(28)23-17-9-7-8-16-19(17)31-18(11-24(5)32(6,29)30)14(3)10-25(20(16)27)15(4)12-26/h7-9,13-15,18,26H,10-12H2,1-6H3,(H2,22,23,28)/t14-,15+,18+/m0/s1	JMXMRSKNTVHTGA-HDMKZQKVSA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc12)[C@H](C)CO	BroadT	BRD-K99377470	BRD-K99377470-001-02-6	Broad Institute of MIT and Harvard	BRD-K99377470			CC(C)NC(=O)Nc1cccc2c1O[C@H](CN(C)S(C)(=O)=O)[C@@H](C)CN([C@H](C)CO)C2=O	InChI=1S/C21H34N4O6S/c1-13(2)22-21(28)23-17-9-7-8-16-19(17)31-18(11-24(5)32(6,29)30)14(3)10-25(20(16)27)15(4)12-26/h7-9,13-15,18,26H,10-12H2,1-6H3,(H2,22,23,28)/t14-,15+,18+/m0/s1	JMXMRSKNTVHTGA-HDMKZQKVSA-N	470.219905538							113701
CHEMBL2358319	LSM-25134	BRD-K71563254, SID85798823	44492144	InChI=1S/C26H34F3N3O3/c1-17-13-32(18(2)16-33)25(34)22-12-21(30(3)4)10-11-23(22)35-24(17)15-31(5)14-19-6-8-20(9-7-19)26(27,28)29/h6-12,17-18,24,33H,13-16H2,1-5H3/t17-,18+,24+/m0/s1	MFZVISJYBZETPX-HOOSLVGPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K71563254	BRD-K71563254-001-01-7	Broad Institute of MIT and Harvard	BRD-K71563254			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C26H34F3N3O3/c1-17-13-32(18(2)16-33)25(34)22-12-21(30(3)4)10-11-23(22)35-24(17)15-31(5)14-19-6-8-20(9-7-19)26(27,28)29/h6-12,17-18,24,33H,13-16H2,1-5H3/t17-,18+,24+/m0/s1	MFZVISJYBZETPX-HOOSLVGPSA-N	493.255226578							113702
BRD-K81131499	LSM-25135		54613787	InChI=1S/C30H37N3O5S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-39(4,36)37)29(26)38-28(21)19-32(3)18-23-13-15-25(16-14-23)24-9-6-5-7-10-24/h5-16,21-22,28,31,34H,17-20H2,1-4H3/t21-,22+,28+/m1/s1	YVBCCXLDGZBBDC-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)Oc4c(NS(=O)(=O)C)cccc4C1=O	BroadT	BRD-K81131499	BRD-K81131499-001-01-6	Broad Institute of MIT and Harvard	BRD-K81131499			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)Oc2c(NS(C)(=O)=O)cccc2C1=O	InChI=1S/C30H37N3O5S/c1-21-17-33(22(2)20-34)30(35)26-11-8-12-27(31-39(4,36)37)29(26)38-28(21)19-32(3)18-23-13-15-25(16-14-23)24-9-6-5-7-10-24/h5-16,21-22,28,31,34H,17-20H2,1-4H3/t21-,22+,28+/m1/s1	YVBCCXLDGZBBDC-WENCSYSZSA-N	551.245392004							113703
BRD-K51757923	LSM-25136		44496628	InChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20+,26-/m0/s1	ODSKXFDDLKDNDM-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3c(NC(=O)C4CCCCC4)cccc3C1=O	BroadT	BRD-K51757923	BRD-K51757923-001-01-0	Broad Institute of MIT and Harvard	BRD-K51757923			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2c(NC(=O)C3CCCCC3)cccc2C1=O	InChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20+,26-/m0/s1	ODSKXFDDLKDNDM-UNVFRBQDSA-N	591.216984366							113704
BRD-K21215763	LSM-25137		44492228	InChI=1S/C28H33ClN4O5S/c1-19-15-33(20(2)18-34)28(35)25-14-23(31-39(36,37)24-7-4-22(29)5-8-24)6-9-26(25)38-27(19)17-32(3)16-21-10-12-30-13-11-21/h4-14,19-20,27,31,34H,15-18H2,1-3H3/t19-,20-,27+/m1/s1	RTDBYDGQKCGXQZ-DVHCVUMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K21215763	BRD-K21215763-001-01-9	Broad Institute of MIT and Harvard	BRD-K21215763			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C28H33ClN4O5S/c1-19-15-33(20(2)18-34)28(35)25-14-23(31-39(36,37)24-7-4-22(29)5-8-24)6-9-26(25)38-27(19)17-32(3)16-21-10-12-30-13-11-21/h4-14,19-20,27,31,34H,15-18H2,1-3H3/t19-,20-,27+/m1/s1	RTDBYDGQKCGXQZ-DVHCVUMVSA-N	572.186018596							113705
BRD-K56470219	LSM-25138		44498302	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15+,21+/m1/s1	LUEPMRNQGZCFGP-WIEQDCTASA-N	CNC[C@@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K56470219	BRD-K56470219-001-01-8	Broad Institute of MIT and Harvard	BRD-K56470219			CNC[C@@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15+,21+/m1/s1	LUEPMRNQGZCFGP-WIEQDCTASA-N	470.21653472							113706
BRD-K54931539	LSM-25139		44495536	InChI=1S/C30H41N5O5/c1-20-17-35(21(2)19-36)28(37)16-23-15-25(32-29(38)22-11-13-31-14-12-22)9-10-26(23)40-27(20)18-34(3)30(39)33-24-7-5-4-6-8-24/h9-15,20-21,24,27,36H,4-8,16-19H2,1-3H3,(H,32,38)(H,33,39)/t20-,21+,27+/m0/s1	OBYISRQTVLJVSP-FYQCMVGJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)c4ccncc4)cc3CC1=O	BroadT	BRD-K54931539	BRD-K54931539-001-01-4	Broad Institute of MIT and Harvard	BRD-K54931539			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C30H41N5O5/c1-20-17-35(21(2)19-36)28(37)16-23-15-25(32-29(38)22-11-13-31-14-12-22)9-10-26(23)40-27(20)18-34(3)30(39)33-24-7-5-4-6-8-24/h9-15,20-21,24,27,36H,4-8,16-19H2,1-3H3,(H,32,38)(H,33,39)/t20-,21+,27+/m0/s1	OBYISRQTVLJVSP-FYQCMVGJSA-N	551.310769462							113707
BRD-K76588804	LSM-25140		44490016	InChI=1S/C32H36N4O7/c1-20-16-36(21(2)18-37)31(39)25-14-23(33-30(38)13-22-7-5-4-6-8-22)9-11-26(25)43-29(20)17-35(3)32(40)34-24-10-12-27-28(15-24)42-19-41-27/h4-12,14-15,20-21,29,37H,13,16-19H2,1-3H3,(H,33,38)(H,34,40)/t20-,21-,29+/m1/s1	UVTNCBQHXJQZIN-RLCGNTSFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ccc(NC(=O)Cc5ccccc5)cc4C1=O	BroadT	BRD-K76588804	BRD-K76588804-001-01-4	Broad Institute of MIT and Harvard	BRD-K76588804			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C32H36N4O7/c1-20-16-36(21(2)18-37)31(39)25-14-23(33-30(38)13-22-7-5-4-6-8-22)9-11-26(25)43-29(20)17-35(3)32(40)34-24-10-12-27-28(15-24)42-19-41-27/h4-12,14-15,20-21,29,37H,13,16-19H2,1-3H3,(H,33,38)(H,34,40)/t20-,21-,29+/m1/s1	UVTNCBQHXJQZIN-RLCGNTSFSA-N	588.258399532							113708
BRD-K29200961	LSM-25141		44484799	InChI=1S/C24H31FN4O6S/c1-15-12-29(16(2)14-30)23(31)20-11-19(27-24(32)26-18-7-5-17(25)6-8-18)9-10-21(20)35-22(15)13-28(3)36(4,33)34/h5-11,15-16,22,30H,12-14H2,1-4H3,(H2,26,27,32)/t15-,16-,22-/m0/s1	MLGOEVOOOJSBLY-WCJKSRRJSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K29200961	BRD-K29200961-001-01-3	Broad Institute of MIT and Harvard	BRD-K29200961			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C24H31FN4O6S/c1-15-12-29(16(2)14-30)23(31)20-11-19(27-24(32)26-18-7-5-17(25)6-8-18)9-10-21(20)35-22(15)13-28(3)36(4,33)34/h5-11,15-16,22,30H,12-14H2,1-4H3,(H2,26,27,32)/t15-,16-,22-/m0/s1	MLGOEVOOOJSBLY-WCJKSRRJSA-N	522.194833642							113709
BRD-K61416283	LSM-25142		44488921	InChI=1S/C28H36F3N5O5/c1-16(2)32-27(40)35(5)14-24-17(3)13-36(18(4)15-37)25(38)22-12-21(10-11-23(22)41-24)34-26(39)33-20-8-6-19(7-9-20)28(29,30)31/h6-12,16-18,24,37H,13-15H2,1-5H3,(H,32,40)(H2,33,34,39)/t17-,18-,24+/m1/s1	GUUFQQDCAZBWHX-GGUMNFRJSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K61416283	BRD-K61416283-001-01-5	Broad Institute of MIT and Harvard	BRD-K61416283			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H36F3N5O5/c1-16(2)32-27(40)35(5)14-24-17(3)13-36(18(4)15-37)25(38)22-12-21(10-11-23(22)41-24)34-26(39)33-20-8-6-19(7-9-20)28(29,30)31/h6-12,16-18,24,37H,13-15H2,1-5H3,(H,32,40)(H2,33,34,39)/t17-,18-,24+/m1/s1	GUUFQQDCAZBWHX-GGUMNFRJSA-N	579.266853902							113710
MLS002474037	LSM-25143	BRD-K37283718, SID85201549	44202633	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-19-15(3)11-26(16(4)13-27)21(28)17-9-8-10-18(24(5)6)20(17)30-19/h8-10,14-16,19,27H,11-13H2,1-7H3,(H,23,29)/t15-,16+,19+/m0/s1	XZXNUYDCQDAXAA-FRQCXROJSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2c(cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K37283718	BRD-K37283718-001-02-3	Broad Institute of MIT and Harvard	BRD-K37283718			CC(C)NC(=O)N(C)C[C@H]1Oc2c(cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-19-15(3)11-26(16(4)13-27)21(28)17-9-8-10-18(24(5)6)20(17)30-19/h8-10,14-16,19,27H,11-13H2,1-7H3,(H,23,29)/t15-,16+,19+/m0/s1	XZXNUYDCQDAXAA-FRQCXROJSA-N	420.273655672							113711
BRD-K02061146	LSM-25144		44495086	InChI=1S/C27H36F3N3O3/c1-18-14-33(19(2)17-34)26(35)13-21-12-23(31(3)4)10-11-24(21)36-25(18)16-32(5)15-20-6-8-22(9-7-20)27(28,29)30/h6-12,18-19,25,34H,13-17H2,1-5H3/t18-,19+,25+/m1/s1	RAYQZOVLGJUDGR-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K02061146	BRD-K02061146-001-01-8	Broad Institute of MIT and Harvard	BRD-K02061146			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C27H36F3N3O3/c1-18-14-33(19(2)17-34)26(35)13-21-12-23(31(3)4)10-11-24(21)36-25(18)16-32(5)15-20-6-8-22(9-7-20)27(28,29)30/h6-12,18-19,25,34H,13-17H2,1-5H3/t18-,19+,25+/m1/s1	RAYQZOVLGJUDGR-WYEJZRMESA-N	507.270876642							113712
BRD-K53447551	LSM-25145		44489140	InChI=1S/C18H29N3O5S/c1-12-9-21(13(2)11-22)18(23)14-7-6-8-15(19-27(5,24)25)17(14)26-16(12)10-20(3)4/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13+,16+/m1/s1	NGOQGDZIZPAXSN-WWGRRREGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2c(NS(=O)(=O)C)cccc2C1=O	BroadT	BRD-K53447551	BRD-K53447551-001-01-5	Broad Institute of MIT and Harvard	BRD-K53447551			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2c(NS(C)(=O)=O)cccc2C1=O	InChI=1S/C18H29N3O5S/c1-12-9-21(13(2)11-22)18(23)14-7-6-8-15(19-27(5,24)25)17(14)26-16(12)10-20(3)4/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13+,16+/m1/s1	NGOQGDZIZPAXSN-WWGRRREGSA-N	399.182791748							113713
BRD-K13941052	LSM-25146		44487314	InChI=1S/C28H38N4O6/c1-17(2)29-28(37)30-22-10-11-24-23(12-22)26(34)32(19(4)16-33)13-18(3)25(38-24)15-31(5)14-20-6-8-21(9-7-20)27(35)36/h6-12,17-19,25,33H,13-16H2,1-5H3,(H,35,36)(H2,29,30,37)/t18-,19-,25-/m0/s1	IVCWXLSTMUVHLA-MHPIHPPYSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)Cc3ccc(cc3)C(=O)O)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K13941052	BRD-K13941052-001-01-0	Broad Institute of MIT and Harvard	BRD-K13941052			CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H38N4O6/c1-17(2)29-28(37)30-22-10-11-24-23(12-22)26(34)32(19(4)16-33)13-18(3)25(38-24)15-31(5)14-20-6-8-21(9-7-20)27(35)36/h6-12,17-19,25,33H,13-16H2,1-5H3,(H,35,36)(H2,29,30,37)/t18-,19-,25-/m0/s1	IVCWXLSTMUVHLA-MHPIHPPYSA-N	526.279134976							113714
BRD-K11180501	LSM-25147		44484182	InChI=1S/C30H36N4O4/c1-21-17-34(22(2)20-35)29(36)26-16-25(32-30(37)31-24-12-8-5-9-13-24)14-15-27(26)38-28(21)19-33(3)18-23-10-6-4-7-11-23/h4-16,21-22,28,35H,17-20H2,1-3H3,(H2,31,32,37)/t21-,22-,28-/m0/s1	HYMZOYYGWSDRHJ-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K11180501	BRD-K11180501-001-01-4	Broad Institute of MIT and Harvard	BRD-K11180501			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H36N4O4/c1-21-17-34(22(2)20-35)29(36)26-16-25(32-30(37)31-24-12-8-5-9-13-24)14-15-27(26)38-28(21)19-33(3)18-23-10-6-4-7-11-23/h4-16,21-22,28,35H,17-20H2,1-3H3,(H2,31,32,37)/t21-,22-,28-/m0/s1	HYMZOYYGWSDRHJ-VPYPWEPUSA-N	516.273655672							113715
BRD-K24838542	LSM-25148		44483999	InChI=1S/C30H34N4O6/c1-19-14-34(20(2)17-35)30(37)24-13-23(32-29(36)22-8-10-31-11-9-22)5-7-25(24)40-28(19)16-33(3)15-21-4-6-26-27(12-21)39-18-38-26/h4-13,19-20,28,35H,14-18H2,1-3H3,(H,32,36)/t19-,20+,28+/m0/s1	VPWIZKHQYUSQSD-TWUWCHPWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)c5ccncc5)cc4C1=O	BroadT	BRD-K24838542	BRD-K24838542-001-01-3	Broad Institute of MIT and Harvard	BRD-K24838542			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C30H34N4O6/c1-19-14-34(20(2)17-35)30(37)24-13-23(32-29(36)22-8-10-31-11-9-22)5-7-25(24)40-28(19)16-33(3)15-21-4-6-26-27(12-21)39-18-38-26/h4-13,19-20,28,35H,14-18H2,1-3H3,(H,32,36)/t19-,20+,28+/m0/s1	VPWIZKHQYUSQSD-TWUWCHPWSA-N	546.247834848							113716
BRD-K91399333	LSM-25149		44490007	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)28-18-26(35-33(42)37-29-15-9-11-24-10-7-8-14-27(24)29)16-17-30(28)44-31(22)20-38(3)34(43)36-25-12-5-4-6-13-25/h7-11,14-18,22-23,25,31,40H,4-6,12-13,19-21H2,1-3H3,(H,36,43)(H2,35,37,42)/t22-,23-,31+/m1/s1	QXYCJPXUIIEYFH-PKIAKLFDSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Nc4cccc5ccccc45)cc3C1=O	BroadT	BRD-K91399333	BRD-K91399333-001-01-7	Broad Institute of MIT and Harvard	BRD-K91399333			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)28-18-26(35-33(42)37-29-15-9-11-24-10-7-8-14-27(24)29)16-17-30(28)44-31(22)20-38(3)34(43)36-25-12-5-4-6-13-25/h7-11,14-18,22-23,25,31,40H,4-6,12-13,19-21H2,1-3H3,(H,36,43)(H2,35,37,42)/t22-,23-,31+/m1/s1	QXYCJPXUIIEYFH-PKIAKLFDSA-N	601.326419526							113717
BRD-K28030757	LSM-25150		44488924	InChI=1S/C31H39F3N4O5/c1-19-16-38(20(2)18-39)29(41)25-15-24(35-28(40)21-7-5-4-6-8-21)13-14-26(25)43-27(19)17-37(3)30(42)36-23-11-9-22(10-12-23)31(32,33)34/h9-15,19-21,27,39H,4-8,16-18H2,1-3H3,(H,35,40)(H,36,42)/t19-,20-,27+/m1/s1	AZWNSNCWAAAZSD-DVHCVUMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K28030757	BRD-K28030757-001-01-3	Broad Institute of MIT and Harvard	BRD-K28030757			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C31H39F3N4O5/c1-19-16-38(20(2)18-39)29(41)25-15-24(35-28(40)21-7-5-4-6-8-21)13-14-26(25)43-27(19)17-37(3)30(42)36-23-11-9-22(10-12-23)31(32,33)34/h9-15,19-21,27,39H,4-8,16-18H2,1-3H3,(H,35,40)(H,36,42)/t19-,20-,27+/m1/s1	AZWNSNCWAAAZSD-DVHCVUMVSA-N	604.287254988							113718
BRD-K85972696	LSM-25151		44506192	InChI=1S/C33H47N5O5/c1-22-18-38(23(2)21-39)33(42)26-17-25(15-16-29(26)43-30(22)20-37(3)19-24-13-14-24)35-31(40)11-5-4-6-12-32(41)36-28-10-8-7-9-27(28)34/h7-10,15-17,22-24,30,39H,4-6,11-14,18-21,34H2,1-3H3,(H,35,40)(H,36,41)/t22-,23+,30-/m0/s1	ZIBQUKGKRZNQOF-BURCIIJTSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NC(=O)CCCCCC(=O)Nc4ccccc4N)cc3C1=O	BroadT	BRD-K85972696	BRD-K85972696-001-01-0	Broad Institute of MIT and Harvard	BRD-K85972696			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NC(=O)CCCCCC(=O)Nc3ccccc3N)cc2C1=O	InChI=1S/C33H47N5O5/c1-22-18-38(23(2)21-39)33(42)26-17-25(15-16-29(26)43-30(22)20-37(3)19-24-13-14-24)35-31(40)11-5-4-6-12-32(41)36-28-10-8-7-9-27(28)34/h7-10,15-17,22-24,30,39H,4-6,11-14,18-21,34H2,1-3H3,(H,35,40)(H,36,41)/t22-,23+,30-/m0/s1	ZIBQUKGKRZNQOF-BURCIIJTSA-N	593.357719654							113719
BRD-K18462967	LSM-25152		44490814	InChI=1S/C33H40N4O6/c1-21-18-37(22(2)20-38)32(40)26-11-7-13-28(34-31(39)24-14-16-42-17-15-24)30(26)43-29(21)19-36(3)33(41)35-27-12-6-9-23-8-4-5-10-25(23)27/h4-13,21-22,24,29,38H,14-20H2,1-3H3,(H,34,39)(H,35,41)/t21-,22-,29-/m0/s1	XPBUGQRVLIPCFW-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K18462967	BRD-K18462967-001-01-6	Broad Institute of MIT and Harvard	BRD-K18462967			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C33H40N4O6/c1-21-18-37(22(2)20-38)32(40)26-11-7-13-28(34-31(39)24-14-16-42-17-15-24)30(26)43-29(21)19-36(3)33(41)35-27-12-6-9-23-8-4-5-10-25(23)27/h4-13,21-22,24,29,38H,14-20H2,1-3H3,(H,34,39)(H,35,41)/t21-,22-,29-/m0/s1	XPBUGQRVLIPCFW-SYZUXVNWSA-N	588.29478504							113720
BRD-K88812218	LSM-25153		54613795	InChI=1S/C20H33N3O5S/c1-14-11-23(15(2)13-24)20(25)10-16-9-17(21(3)4)7-8-18(16)28-19(14)12-22(5)29(6,26)27/h7-9,14-15,19,24H,10-13H2,1-6H3/t14-,15+,19+/m0/s1	GJNVPSGZCJMKRU-QMTMVMCOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ccc(cc2CC1=O)N(C)C	BroadT	BRD-K88812218	BRD-K88812218-001-01-4	Broad Institute of MIT and Harvard	BRD-K88812218			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C20H33N3O5S/c1-14-11-23(15(2)13-24)20(25)10-16-9-17(21(3)4)7-8-18(16)28-19(14)12-22(5)29(6,26)27/h7-9,14-15,19,24H,10-13H2,1-6H3/t14-,15+,19+/m0/s1	GJNVPSGZCJMKRU-QMTMVMCOSA-N	427.214091876							113721
BRD-K99727034	LSM-25154		44488040	InChI=1S/C31H40F3N5O5/c1-19-16-39(20(2)18-40)28(41)24-10-7-11-25(37-29(42)35-22-8-5-4-6-9-22)27(24)44-26(19)17-38(3)30(43)36-23-14-12-21(13-15-23)31(32,33)34/h7,10-15,19-20,22,26,40H,4-6,8-9,16-18H2,1-3H3,(H,36,43)(H2,35,37,42)/t19-,20+,26-/m0/s1	DYMIOMKCTZAAFH-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)NC4CCCCC4)cccc3C1=O	BroadT	BRD-K99727034	BRD-K99727034-001-01-3	Broad Institute of MIT and Harvard	BRD-K99727034			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C31H40F3N5O5/c1-19-16-39(20(2)18-40)28(41)24-10-7-11-25(37-29(42)35-22-8-5-4-6-9-22)27(24)44-26(19)17-38(3)30(43)36-23-14-12-21(13-15-23)31(32,33)34/h7,10-15,19-20,22,26,40H,4-6,8-9,16-18H2,1-3H3,(H,36,43)(H2,35,37,42)/t19-,20+,26-/m0/s1	DYMIOMKCTZAAFH-UNVFRBQDSA-N	619.29815403							113722
BRD-K99028283	LSM-25155		44484379	InChI=1S/C31H38N4O4/c1-20-16-35(21(2)19-36)30(37)25-11-7-13-27(29(25)39-28(20)18-34(3)17-22-14-15-22)33-31(38)32-26-12-6-9-23-8-4-5-10-24(23)26/h4-13,20-22,28,36H,14-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m1/s1	HWUHKIMOQGGKRG-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc3c(NC(=O)Nc4cccc5ccccc45)cccc3C1=O	BroadT	BRD-K99028283	BRD-K99028283-001-01-4	Broad Institute of MIT and Harvard	BRD-K99028283			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C1=O	InChI=1S/C31H38N4O4/c1-20-16-35(21(2)19-36)30(37)25-11-7-13-27(29(25)39-28(20)18-34(3)17-22-14-15-22)33-31(38)32-26-12-6-9-23-8-4-5-10-24(23)26/h4-13,20-22,28,36H,14-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m1/s1	HWUHKIMOQGGKRG-GGJMMHKRSA-N	530.289305736							113723
BRD-K07557785	LSM-25156		44484885	InChI=1S/C24H33N3O6S/c1-16-13-27(17(2)15-28)24(29)21-12-18(6-11-22(21)33-23(16)14-26(3)4)25-34(30,31)20-9-7-19(32-5)8-10-20/h6-12,16-17,23,25,28H,13-15H2,1-5H3/t16-,17-,23-/m0/s1	IFPHIOSYEQPMRT-QQMNAOGKSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K07557785	BRD-K07557785-001-01-6	Broad Institute of MIT and Harvard	BRD-K07557785			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H](CN(C)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H33N3O6S/c1-16-13-27(17(2)15-28)24(29)21-12-18(6-11-22(21)33-23(16)14-26(3)4)25-34(30,31)20-9-7-19(32-5)8-10-20/h6-12,16-17,23,25,28H,13-15H2,1-5H3/t16-,17-,23-/m0/s1	IFPHIOSYEQPMRT-QQMNAOGKSA-N	491.209006496							113724
BRD-K78639526	LSM-15085		54613797	InChI=1S/C28H43N3O4/c1-19-15-31(20(2)18-32)27(33)14-23-13-24(29-28(34)22-7-5-4-6-8-22)11-12-25(23)35-26(19)17-30(3)16-21-9-10-21/h11-13,19-22,26,32H,4-10,14-18H2,1-3H3,(H,29,34)/t19-,20+,26+/m1/s1	OICFVEIUUNSOQD-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NC(=O)C4CCCCC4)cc3CC1=O	BroadT	BRD-K78639526	BRD-K78639526-001-01-0	Broad Institute of MIT and Harvard	BRD-K78639526			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NC(=O)C3CCCCC3)cc2CC1=O	InChI=1S/C28H43N3O4/c1-19-15-31(20(2)18-32)27(33)14-23-13-24(29-28(34)22-7-5-4-6-8-22)11-12-25(23)35-26(19)17-30(3)16-21-9-10-21/h11-13,19-22,26,32H,4-10,14-18H2,1-3H3,(H,29,34)/t19-,20+,26+/m1/s1	OICFVEIUUNSOQD-GOHWNWGWSA-N	485.325356886							103741
BRD-K14863829	LSM-25157		44489174	InChI=1S/C31H40F3N5O5/c1-19-16-39(20(2)18-40)28(41)24-10-7-11-25(37-29(42)35-22-8-5-4-6-9-22)27(24)44-26(19)17-38(3)30(43)36-23-14-12-21(13-15-23)31(32,33)34/h7,10-15,19-20,22,26,40H,4-6,8-9,16-18H2,1-3H3,(H,36,43)(H2,35,37,42)/t19-,20-,26+/m1/s1	DYMIOMKCTZAAFH-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)NC4CCCCC4)cccc3C1=O	BroadT	BRD-K14863829	BRD-K14863829-001-01-7	Broad Institute of MIT and Harvard	BRD-K14863829			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C31H40F3N5O5/c1-19-16-39(20(2)18-40)28(41)24-10-7-11-25(37-29(42)35-22-8-5-4-6-9-22)27(24)44-26(19)17-38(3)30(43)36-23-14-12-21(13-15-23)31(32,33)34/h7,10-15,19-20,22,26,40H,4-6,8-9,16-18H2,1-3H3,(H,36,43)(H2,35,37,42)/t19-,20-,26+/m1/s1	DYMIOMKCTZAAFH-KYTVRQNUSA-N	619.29815403							113725
BRD-K99387963	LSM-25158		44496710	InChI=1S/C24H32N4O4/c1-16-13-28(17(2)15-29)23(30)19-11-8-12-20(22(19)32-21(16)14-27(3)4)26-24(31)25-18-9-6-5-7-10-18/h5-12,16-17,21,29H,13-15H2,1-4H3,(H2,25,26,31)/t16-,17+,21+/m0/s1	SSJJWSMGDNAKCS-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	BroadT	BRD-K99387963	BRD-K99387963-001-01-1	Broad Institute of MIT and Harvard	BRD-K99387963			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	InChI=1S/C24H32N4O4/c1-16-13-28(17(2)15-29)23(30)19-11-8-12-20(22(19)32-21(16)14-27(3)4)26-24(31)25-18-9-6-5-7-10-18/h5-12,16-17,21,29H,13-15H2,1-4H3,(H2,25,26,31)/t16-,17+,21+/m0/s1	SSJJWSMGDNAKCS-CSODHUTKSA-N	440.242355544							113726
BRD-K65506286	LSM-25159		44489522	InChI=1S/C28H40N4O6S/c1-20-17-32(21(2)19-33)28(35)24-16-22(29-27(34)12-9-15-30(3)4)13-14-25(24)38-26(20)18-31(5)39(36,37)23-10-7-6-8-11-23/h6-8,10-11,13-14,16,20-21,26,33H,9,12,15,17-19H2,1-5H3,(H,29,34)/t20-,21-,26+/m1/s1	RYGUZWJSQXSRBK-YPCDYVTLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K65506286	BRD-K65506286-001-01-6	Broad Institute of MIT and Harvard	BRD-K65506286			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C28H40N4O6S/c1-20-17-32(21(2)19-33)28(35)24-16-22(29-27(34)12-9-15-30(3)4)13-14-25(24)38-26(20)18-31(5)39(36,37)23-10-7-6-8-11-23/h6-8,10-11,13-14,16,20-21,26,33H,9,12,15,17-19H2,1-5H3,(H,29,34)/t20-,21-,26+/m1/s1	RYGUZWJSQXSRBK-YPCDYVTLSA-N	560.26685573							113727
BRD-K54549319	LSM-25160		44484376	InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)23-13-9-15-25(31(3)4)27(23)37-26(19)17-32(5)29(36)30-24-14-8-11-21-10-6-7-12-22(21)24/h6-15,19-20,26,34H,16-18H2,1-5H3,(H,30,36)/t19-,20+,26+/m1/s1	QINKYHPKCUNNMN-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K54549319	BRD-K54549319-001-01-0	Broad Institute of MIT and Harvard	BRD-K54549319			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)23-13-9-15-25(31(3)4)27(23)37-26(19)17-32(5)29(36)30-24-14-8-11-21-10-6-7-12-22(21)24/h6-15,19-20,26,34H,16-18H2,1-5H3,(H,30,36)/t19-,20+,26+/m1/s1	QINKYHPKCUNNMN-GOHWNWGWSA-N	504.273655672							113728
BRD-K42081955	LSM-25161		44496094	InChI=1S/C30H41FN4O4/c1-20-16-35(21(2)19-36)29(37)25-10-7-11-26(33-30(38)32-24-14-12-23(31)13-15-24)28(25)39-27(20)18-34(3)17-22-8-5-4-6-9-22/h7,10-15,20-22,27,36H,4-6,8-9,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,27+/m1/s1	COSGGAMFLVSIQD-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)Nc4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K42081955	BRD-K42081955-001-01-8	Broad Institute of MIT and Harvard	BRD-K42081955			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)Nc3ccc(F)cc3)cccc2C1=O	InChI=1S/C30H41FN4O4/c1-20-16-35(21(2)19-36)29(37)25-10-7-11-26(33-30(38)32-24-14-12-23(31)13-15-24)28(25)39-27(20)18-34(3)17-22-8-5-4-6-9-22/h7,10-15,20-22,27,36H,4-6,8-9,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,27+/m1/s1	COSGGAMFLVSIQD-GNMOFYLKSA-N	540.311184032							113729
BRD-K34985075-001-01-5	LSM-25162	BRD-K34985075	44483710	InChI=1S/C19H31N3O3/c1-13-10-22(14(2)12-23)19(24)16-9-15(21(5)6)7-8-17(16)25-18(13)11-20(3)4/h7-9,13-14,18,23H,10-12H2,1-6H3/t13-,14-,18+/m1/s1	WTLSFXRNHZPOMH-LBTNJELSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K34985075	BRD-K34985075-001-01-5	Broad Institute of MIT and Harvard	BRD-K34985075			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C19H31N3O3/c1-13-10-22(14(2)12-23)19(24)16-9-15(21(5)6)7-8-17(16)25-18(13)11-20(3)4/h7-9,13-14,18,23H,10-12H2,1-6H3/t13-,14-,18+/m1/s1	WTLSFXRNHZPOMH-LBTNJELSSA-N	349.236541882							113730
BRD-K90863245	LSM-25163		44492926	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17+,22+/m0/s1	FXDXYRRSNQUVQL-GSHUGGBRSA-N	CNC[C@H]1Oc2c(NC(=O)c3ccc(cc3)c4nccs4)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K90863245	BRD-K90863245-001-01-0	Broad Institute of MIT and Harvard	BRD-K90863245			CNC[C@H]1Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17+,22+/m0/s1	FXDXYRRSNQUVQL-GSHUGGBRSA-N	494.19877617							113731
BRD-K97064059	LSM-25164		44498334	InChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20+,26+/m1/s1	ODSKXFDDLKDNDM-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3c(NC(=O)C4CCCCC4)cccc3C1=O	BroadT	BRD-K97064059	BRD-K97064059-001-01-3	Broad Institute of MIT and Harvard	BRD-K97064059			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2c(NC(=O)C3CCCCC3)cccc2C1=O	InChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20+,26+/m1/s1	ODSKXFDDLKDNDM-GOHWNWGWSA-N	591.216984366							113732
BRD-K00808919	LSM-25165		44495530	InChI=1S/C27H36F3N3O3/c1-18-14-33(19(2)17-34)26(35)13-21-12-23(31(3)4)10-11-24(21)36-25(18)16-32(5)15-20-6-8-22(9-7-20)27(28,29)30/h6-12,18-19,25,34H,13-17H2,1-5H3/t18-,19+,25+/m0/s1	RAYQZOVLGJUDGR-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K00808919	BRD-K00808919-001-01-9	Broad Institute of MIT and Harvard	BRD-K00808919			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C27H36F3N3O3/c1-18-14-33(19(2)17-34)26(35)13-21-12-23(31(3)4)10-11-24(21)36-25(18)16-32(5)15-20-6-8-22(9-7-20)27(28,29)30/h6-12,18-19,25,34H,13-17H2,1-5H3/t18-,19+,25+/m0/s1	RAYQZOVLGJUDGR-OSWQYVSFSA-N	507.270876642							113733
BRD-K28932860	LSM-25166		44496697	InChI=1S/C29H34FN5O4/c1-19-15-35(20(2)18-36)28(37)24-5-4-6-25(33-29(38)32-23-9-7-22(30)8-10-23)27(24)39-26(19)17-34(3)16-21-11-13-31-14-12-21/h4-14,19-20,26,36H,15-18H2,1-3H3,(H2,32,33,38)/t19-,20-,26-/m0/s1	VBGZKSFWINXWAF-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3c(NC(=O)Nc4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K28932860	BRD-K28932860-001-01-4	Broad Institute of MIT and Harvard	BRD-K28932860			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2c(NC(=O)Nc3ccc(F)cc3)cccc2C1=O	InChI=1S/C29H34FN5O4/c1-19-15-35(20(2)18-36)28(37)24-5-4-6-25(33-29(38)32-23-9-7-22(30)8-10-23)27(24)39-26(19)17-34(3)16-21-11-13-31-14-12-21/h4-14,19-20,26,36H,15-18H2,1-3H3,(H2,32,33,38)/t19-,20-,26-/m0/s1	VBGZKSFWINXWAF-DYLHXGEVSA-N	535.259482818							113734
BRD-K35726223	LSM-25167		44488376	InChI=1S/C28H34F3N3O6/c1-17-12-34(18(2)15-35)27(37)21-11-20(32-26(36)8-9-28(29,30)31)5-7-22(21)40-25(17)14-33(3)13-19-4-6-23-24(10-19)39-16-38-23/h4-7,10-11,17-18,25,35H,8-9,12-16H2,1-3H3,(H,32,36)/t17-,18-,25+/m1/s1	IMDFAXAHWGRKQV-GAKIBJFNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCC(F)(F)F)cc4C1=O	BroadT	BRD-K35726223	BRD-K35726223-001-01-3	Broad Institute of MIT and Harvard	BRD-K35726223			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C28H34F3N3O6/c1-17-12-34(18(2)15-35)27(37)21-11-20(32-26(36)8-9-28(29,30)31)5-7-22(21)40-25(17)14-33(3)13-19-4-6-23-24(10-19)39-16-38-23/h4-7,10-11,17-18,25,35H,8-9,12-16H2,1-3H3,(H,32,36)/t17-,18-,25+/m1/s1	IMDFAXAHWGRKQV-GAKIBJFNSA-N	565.239970438							113735
BRD-K51012353	LSM-25168		44483554	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)29-21-9-12-24-23(13-21)26(33)31(20(5)16-32)14-19(4)25(37-24)15-30(6)38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,32H,14-16H2,1-6H3,(H2,28,29,34)/t19-,20+,25-/m0/s1	PKTRFCGFRBZOLH-DFIYOIEZSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)S(=O)(=O)c3ccc(C)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K51012353	BRD-K51012353-001-01-9	Broad Institute of MIT and Harvard	BRD-K51012353			CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)S(=O)(=O)c3ccc(C)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)29-21-9-12-24-23(13-21)26(33)31(20(5)16-32)14-19(4)25(37-24)15-30(6)38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,32H,14-16H2,1-6H3,(H2,28,29,34)/t19-,20+,25-/m0/s1	PKTRFCGFRBZOLH-DFIYOIEZSA-N	546.251205666							113736
BRD-K81999794	LSM-25169		44484252	InChI=1S/C25H41N3O3/c1-18-14-28(19(2)17-29)25(30)22-13-21(26(3)4)11-12-23(22)31-24(18)16-27(5)15-20-9-7-6-8-10-20/h11-13,18-20,24,29H,6-10,14-17H2,1-5H3/t18-,19-,24-/m0/s1	ISZUZFSFVMPJQK-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K81999794	BRD-K81999794-001-01-8	Broad Institute of MIT and Harvard	BRD-K81999794			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H41N3O3/c1-18-14-28(19(2)17-29)25(30)22-13-21(26(3)4)11-12-23(22)31-24(18)16-27(5)15-20-9-7-6-8-10-20/h11-13,18-20,24,29H,6-10,14-17H2,1-5H3/t18-,19-,24-/m0/s1	ISZUZFSFVMPJQK-JXQFQVJHSA-N	431.314792202							113737
BRD-K70854630	LSM-25170		44495719	InChI=1S/C26H34N4O6/c1-16-12-30(17(2)14-31)25(32)19-7-6-8-20(28(3)4)24(19)36-23(16)13-29(5)26(33)27-18-9-10-21-22(11-18)35-15-34-21/h6-11,16-17,23,31H,12-15H2,1-5H3,(H,27,33)/t16-,17-,23+/m0/s1	DFCREXDAKHJSKD-HKARXFIJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K70854630	BRD-K70854630-001-01-6	Broad Institute of MIT and Harvard	BRD-K70854630			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H34N4O6/c1-16-12-30(17(2)14-31)25(32)19-7-6-8-20(28(3)4)24(19)36-23(16)13-29(5)26(33)27-18-9-10-21-22(11-18)35-15-34-21/h6-11,16-17,23,31H,12-15H2,1-5H3,(H,27,33)/t16-,17-,23+/m0/s1	DFCREXDAKHJSKD-HKARXFIJSA-N	498.247834848							113738
CHEMBL2133917	LSM-25171	SID85806466, BRD-K45328741	44499468	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23+,29+/m1/s1	ZVHZCYJHGRNXGN-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)c4ccc(cc4)c5nccs5)cccc3C1=O	BroadT	BRD-K45328741	BRD-K45328741-001-01-9	Broad Institute of MIT and Harvard	BRD-K45328741			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C1=O	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23+,29+/m1/s1	ZVHZCYJHGRNXGN-AFKLWXAFSA-N	590.292676554							113739
BRD-K04757670	LSM-25172		44484346	InChI=1S/C31H44N4O6/c1-22-18-35(23(2)21-36)31(38)27-17-25(32-30(37)11-12-34-13-15-40-16-14-34)7-10-28(27)41-29(22)20-33(3)19-24-5-8-26(39-4)9-6-24/h5-10,17,22-23,29,36H,11-16,18-21H2,1-4H3,(H,32,37)/t22-,23-,29+/m1/s1	WZMFZVAQVUXYGZ-SGQNLQFHSA-N	COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)CCN4CCOCC4)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K04757670	BRD-K04757670-001-01-3	Broad Institute of MIT and Harvard	BRD-K04757670			COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)CCN4CCOCC4)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H44N4O6/c1-22-18-35(23(2)21-36)31(38)27-17-25(32-30(37)11-12-34-13-15-40-16-14-34)7-10-28(27)41-29(22)20-33(3)19-24-5-8-26(39-4)9-6-24/h5-10,17,22-23,29,36H,11-16,18-21H2,1-4H3,(H,32,37)/t22-,23-,29+/m1/s1	WZMFZVAQVUXYGZ-SGQNLQFHSA-N	568.326085168							113740
BRD-K32577562	LSM-25173		44618235	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)31(38)17-25-16-27(34-32(39)33-26-10-13-28(40-4)14-11-26)12-15-29(25)41-30(22)20-35(3)19-24-8-6-5-7-9-24/h10-16,22-24,30,37H,5-9,17-21H2,1-4H3,(H2,33,34,39)/t22-,23-,30+/m1/s1	QTHBIZIZCLMCFV-JWUQWVJQSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H](CN(C)CC4CCCCC4)[C@H](C)CN([C@H](C)CO)C(=O)Cc3c2)cc1	BroadT	BRD-K32577562	BRD-K32577562-001-01-2	Broad Institute of MIT and Harvard	BRD-K32577562			COc1ccc(NC(=O)Nc2ccc3O[C@@H](CN(C)CC4CCCCC4)[C@H](C)CN([C@H](C)CO)C(=O)Cc3c2)cc1	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)31(38)17-25-16-27(34-32(39)33-26-10-13-28(40-4)14-11-26)12-15-29(25)41-30(22)20-35(3)19-24-8-6-5-7-9-24/h10-16,22-24,30,37H,5-9,17-21H2,1-4H3,(H2,33,34,39)/t22-,23-,30+/m1/s1	QTHBIZIZCLMCFV-JWUQWVJQSA-N	566.346820612							113741
BRD-K47238978	LSM-25174		44487094	InChI=1S/C31H43N3O4/c1-22-18-34(23(2)21-35)31(37)27-17-26(32-30(36)16-24-10-6-4-7-11-24)14-15-28(27)38-29(22)20-33(3)19-25-12-8-5-9-13-25/h4,6-7,10-11,14-15,17,22-23,25,29,35H,5,8-9,12-13,16,18-21H2,1-3H3,(H,32,36)/t22-,23-,29+/m0/s1	WNQBBBBVHQGMNA-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K47238978	BRD-K47238978-001-01-2	Broad Institute of MIT and Harvard	BRD-K47238978			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H43N3O4/c1-22-18-34(23(2)21-35)31(37)27-17-26(32-30(36)16-24-10-6-4-7-11-24)14-15-28(27)38-29(22)20-33(3)19-25-12-8-5-9-13-25/h4,6-7,10-11,14-15,17,22-23,25,29,35H,5,8-9,12-13,16,18-21H2,1-3H3,(H,32,36)/t22-,23-,29+/m0/s1	WNQBBBBVHQGMNA-SBZVUBOMSA-N	521.325356886							113742
BRD-K60898929	LSM-25175		44483795	InChI=1S/C31H40F3N5O5/c1-19-16-39(20(2)18-40)28(41)24-10-7-11-25(37-29(42)35-22-8-5-4-6-9-22)27(24)44-26(19)17-38(3)30(43)36-23-14-12-21(13-15-23)31(32,33)34/h7,10-15,19-20,22,26,40H,4-6,8-9,16-18H2,1-3H3,(H,36,43)(H2,35,37,42)/t19-,20-,26+/m0/s1	DYMIOMKCTZAAFH-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3c(NC(=O)NC4CCCCC4)cccc3C1=O	BroadT	BRD-K60898929	BRD-K60898929-001-01-5	Broad Institute of MIT and Harvard	BRD-K60898929			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C31H40F3N5O5/c1-19-16-39(20(2)18-40)28(41)24-10-7-11-25(37-29(42)35-22-8-5-4-6-9-22)27(24)44-26(19)17-38(3)30(43)36-23-14-12-21(13-15-23)31(32,33)34/h7,10-15,19-20,22,26,40H,4-6,8-9,16-18H2,1-3H3,(H,36,43)(H2,35,37,42)/t19-,20-,26+/m0/s1	DYMIOMKCTZAAFH-CUVVAGTFSA-N	619.29815403							113743
BRD-K91866516	LSM-25176		44491683	InChI=1S/C32H36N4O7/c1-20-16-36(21(2)18-37)31(39)25-14-23(33-30(38)13-22-7-5-4-6-8-22)9-11-26(25)43-29(20)17-35(3)32(40)34-24-10-12-27-28(15-24)42-19-41-27/h4-12,14-15,20-21,29,37H,13,16-19H2,1-3H3,(H,33,38)(H,34,40)/t20-,21-,29+/m0/s1	UVTNCBQHXJQZIN-LRZFZUCMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ccc(NC(=O)Cc5ccccc5)cc4C1=O	BroadT	BRD-K91866516	BRD-K91866516-001-01-4	Broad Institute of MIT and Harvard	BRD-K91866516			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C32H36N4O7/c1-20-16-36(21(2)18-37)31(39)25-14-23(33-30(38)13-22-7-5-4-6-8-22)9-11-26(25)43-29(20)17-35(3)32(40)34-24-10-12-27-28(15-24)42-19-41-27/h4-12,14-15,20-21,29,37H,13,16-19H2,1-3H3,(H,33,38)(H,34,40)/t20-,21-,29+/m0/s1	UVTNCBQHXJQZIN-LRZFZUCMSA-N	588.258399532							113744
BRD-K33734659	LSM-25177		44491027	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14+,18+/m1/s1	WYKJOBISBUCKND-GLJUWKHASA-N	CNC[C@@H]1Oc2ccc(cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K33734659	BRD-K33734659-001-01-2	Broad Institute of MIT and Harvard	BRD-K33734659			CNC[C@@H]1Oc2ccc(cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C19H31N3O3/c1-13-11-22(14(2)12-23)19(24)9-15-8-16(21(4)5)6-7-17(15)25-18(13)10-20-3/h6-8,13-14,18,20,23H,9-12H2,1-5H3/t13-,14+,18+/m1/s1	WYKJOBISBUCKND-GLJUWKHASA-N	349.236541882							113745
BRD-K87056522	LSM-25178		44494191	InChI=1S/C24H32N4O4/c1-16-13-28(17(2)15-29)23(30)19-11-8-12-20(22(19)32-21(16)14-27(3)4)26-24(31)25-18-9-6-5-7-10-18/h5-12,16-17,21,29H,13-15H2,1-4H3,(H2,25,26,31)/t16-,17-,21+/m1/s1	SSJJWSMGDNAKCS-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	BroadT	BRD-K87056522	BRD-K87056522-001-01-0	Broad Institute of MIT and Harvard	BRD-K87056522			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	InChI=1S/C24H32N4O4/c1-16-13-28(17(2)15-29)23(30)19-11-8-12-20(22(19)32-21(16)14-27(3)4)26-24(31)25-18-9-6-5-7-10-18/h5-12,16-17,21,29H,13-15H2,1-4H3,(H2,25,26,31)/t16-,17-,21+/m1/s1	SSJJWSMGDNAKCS-LZJOCLMNSA-N	440.242355544							113746
BRD-K25330450	LSM-25179		44503205	InChI=1S/C33H39N7O5/c1-23-17-40(24(2)21-41)33(43)16-26-15-27(35-32(42)20-39-22-34-36-37-39)11-14-30(26)45-31(23)19-38(3)18-25-9-12-29(13-10-25)44-28-7-5-4-6-8-28/h4-15,22-24,31,41H,16-21H2,1-3H3,(H,35,42)/t23-,24-,31-/m1/s1	PROAVNUGSAEHPP-OVMXQCPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(NC(=O)Cn5cnnn5)cc4CC1=O	BroadT	BRD-K25330450	BRD-K25330450-001-01-0	Broad Institute of MIT and Harvard	BRD-K25330450			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	InChI=1S/C33H39N7O5/c1-23-17-40(24(2)21-41)33(43)16-26-15-27(35-32(42)20-39-22-34-36-37-39)11-14-30(26)45-31(23)19-38(3)18-25-9-12-29(13-10-25)44-28-7-5-4-6-8-28/h4-15,22-24,31,41H,16-21H2,1-3H3,(H,35,42)/t23-,24-,31-/m1/s1	PROAVNUGSAEHPP-OVMXQCPESA-N	613.301267418							113747
BRD-K14534138	LSM-25180		44489130	InChI=1S/C28H34F3N5O5S/c1-18-12-36(19(2)16-37)27(38)22-6-5-7-23(33-42(39,40)25-15-35(4)17-32-25)26(22)41-24(18)14-34(3)13-20-8-10-21(11-9-20)28(29,30)31/h5-11,15,17-19,24,33,37H,12-14,16H2,1-4H3/t18-,19+,24+/m1/s1	DXKOHZBEBBERNQ-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3c(NS(=O)(=O)c4cn(C)cn4)cccc3C1=O	BroadT	BRD-K14534138	BRD-K14534138-001-01-0	Broad Institute of MIT and Harvard	BRD-K14534138			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2c(NS(=O)(=O)c3cn(C)cn3)cccc2C1=O	InChI=1S/C28H34F3N5O5S/c1-18-12-36(19(2)16-37)27(38)22-6-5-7-23(33-42(39,40)25-15-35(4)17-32-25)26(22)41-24(18)14-34(3)13-20-8-10-21(11-9-20)28(29,30)31/h5-11,15,17-19,24,33,37H,12-14,16H2,1-4H3/t18-,19+,24+/m1/s1	DXKOHZBEBBERNQ-IMWIBFENSA-N	609.223274528							113748
BRD-K30312557	LSM-25181		44488908	InChI=1S/C17H27N3O5S/c1-11-9-20(12(2)10-21)17(22)14-7-13(19-26(4,23)24)5-6-15(14)25-16(11)8-18-3/h5-7,11-12,16,18-19,21H,8-10H2,1-4H3/t11-,12-,16+/m1/s1	HMGKWXPABBQPJW-HSMVNMDESA-N	CNC[C@@H]1Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K30312557	BRD-K30312557-001-01-3	Broad Institute of MIT and Harvard	BRD-K30312557			CNC[C@@H]1Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C17H27N3O5S/c1-11-9-20(12(2)10-21)17(22)14-7-13(19-26(4,23)24)5-6-15(14)25-16(11)8-18-3/h5-7,11-12,16,18-19,21H,8-10H2,1-4H3/t11-,12-,16+/m1/s1	HMGKWXPABBQPJW-HSMVNMDESA-N	385.167141684							113749
BRD-K19168437	LSM-25182		44489156	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15+,19+/m1/s1	YQJJHWKDDJGBPX-VCBZYWHSSA-N	CNC[C@@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K19168437	BRD-K19168437-001-01-0	Broad Institute of MIT and Harvard	BRD-K19168437			CNC[C@@H]1Oc2c(NC(=O)c3nc4ccccc4s3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H28N4O4S/c1-14-12-28(15(2)13-29)24(31)16-7-6-9-18(21(16)32-19(14)11-25-3)26-22(30)23-27-17-8-4-5-10-20(17)33-23/h4-10,14-15,19,25,29H,11-13H2,1-3H3,(H,26,30)/t14-,15+,19+/m1/s1	YQJJHWKDDJGBPX-VCBZYWHSSA-N	468.183126106							113750
BRD-K42653521	LSM-25183		54613800	InChI=1S/C26H42N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h11-13,18-19,21,24,31H,6-10,14-17H2,1-5H3,(H,27,33)/t18-,19+,24+/m1/s1	NUQLUNTVVQHOLK-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K42653521	BRD-K42653521-001-01-9	Broad Institute of MIT and Harvard	BRD-K42653521			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C26H42N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h11-13,18-19,21,24,31H,6-10,14-17H2,1-5H3,(H,27,33)/t18-,19+,24+/m1/s1	NUQLUNTVVQHOLK-IMWIBFENSA-N	474.320605864							113751
BRD-K85559506	LSM-25184		44499086	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18+,24+/m1/s1	JIVQHRCMRGEILI-YTZAWJCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3c(NC(=O)C4CC4)cccc3C1=O	BroadT	BRD-K85559506	BRD-K85559506-001-01-5	Broad Institute of MIT and Harvard	BRD-K85559506			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2c(NC(=O)C3CC3)cccc2C1=O	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18+,24+/m1/s1	JIVQHRCMRGEILI-YTZAWJCFSA-N	509.25258587							113752
BRD-K33037101	LSM-25185		44488947	InChI=1S/C31H43N3O4/c1-22-18-34(23(2)21-35)31(37)27-17-26(32-30(36)16-24-10-6-4-7-11-24)14-15-28(27)38-29(22)20-33(3)19-25-12-8-5-9-13-25/h4,6-7,10-11,14-15,17,22-23,25,29,35H,5,8-9,12-13,16,18-21H2,1-3H3,(H,32,36)/t22-,23-,29+/m1/s1	WNQBBBBVHQGMNA-SGQNLQFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K33037101	BRD-K33037101-001-01-4	Broad Institute of MIT and Harvard	BRD-K33037101			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H43N3O4/c1-22-18-34(23(2)21-35)31(37)27-17-26(32-30(36)16-24-10-6-4-7-11-24)14-15-28(27)38-29(22)20-33(3)19-25-12-8-5-9-13-25/h4,6-7,10-11,14-15,17,22-23,25,29,35H,5,8-9,12-13,16,18-21H2,1-3H3,(H,32,36)/t22-,23-,29+/m1/s1	WNQBBBBVHQGMNA-SGQNLQFHSA-N	521.325356886							113753
BRD-K36149853	LSM-25186		44492433	InChI=1S/C34H36FN5O5/c1-21-18-40(22(2)20-41)32(42)27-11-7-13-29(38-33(43)37-28-12-6-9-23-8-4-5-10-26(23)28)31(27)45-30(21)19-39(3)34(44)36-25-16-14-24(35)15-17-25/h4-17,21-22,30,41H,18-20H2,1-3H3,(H,36,44)(H2,37,38,43)/t21-,22+,30+/m1/s1	INJMWLLCIWTMDU-DGIFUFQNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3c(NC(=O)Nc4cccc5ccccc45)cccc3C1=O	BroadT	BRD-K36149853	BRD-K36149853-001-01-4	Broad Institute of MIT and Harvard	BRD-K36149853			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C1=O	InChI=1S/C34H36FN5O5/c1-21-18-40(22(2)20-41)32(42)27-11-7-13-29(38-33(43)37-28-12-6-9-23-8-4-5-10-26(23)28)31(27)45-30(21)19-39(3)34(44)36-25-16-14-24(35)15-17-25/h4-17,21-22,30,41H,18-20H2,1-3H3,(H,36,44)(H2,37,38,43)/t21-,22+,30+/m1/s1	INJMWLLCIWTMDU-DGIFUFQNSA-N	613.270047502							113754
BRD-K14907323	LSM-25187		44498756	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23+,29-/m0/s1	ZVHZCYJHGRNXGN-CTWZREHQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)c4ccc(cc4)c5nccs5)cccc3C1=O	BroadT	BRD-K14907323	BRD-K14907323-001-01-3	Broad Institute of MIT and Harvard	BRD-K14907323			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C1=O	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23+,29-/m0/s1	ZVHZCYJHGRNXGN-CTWZREHQSA-N	590.292676554							113755
BRD-K42605555	LSM-25188		44484709	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)24-13-23(30-29(37)31-27-20(3)32-39-21(27)4)11-12-25(24)38-26(18)16-33(5)15-22-9-7-6-8-10-22/h11-13,18-19,22,26,35H,6-10,14-17H2,1-5H3,(H2,30,31,37)/t18-,19-,26+/m0/s1	GCOOUUHDYUHFBZ-LZJCXSABSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3C1=O	BroadT	BRD-K42605555	BRD-K42605555-001-01-8	Broad Institute of MIT and Harvard	BRD-K42605555			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)24-13-23(30-29(37)31-27-20(3)32-39-21(27)4)11-12-25(24)38-26(18)16-33(5)15-22-9-7-6-8-10-22/h11-13,18-19,22,26,35H,6-10,14-17H2,1-5H3,(H2,30,31,37)/t18-,19-,26+/m0/s1	GCOOUUHDYUHFBZ-LZJCXSABSA-N	541.326419526							113756
BRD-K87541124	LSM-25189		44618467	InChI=1S/C32H39N3O6S/c1-22-10-13-28(14-11-22)42(39,40)34(4)20-30-23(2)19-35(24(3)21-36)32(38)18-26-17-27(12-15-29(26)41-30)33-31(37)16-25-8-6-5-7-9-25/h5-15,17,23-24,30,36H,16,18-21H2,1-4H3,(H,33,37)/t23-,24+,30+/m1/s1	JFKKEIVDTMFBMW-QEGDFHJFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3ccc(NC(=O)Cc4ccccc4)cc3CC1=O	BroadT	BRD-K87541124	BRD-K87541124-001-01-3	Broad Institute of MIT and Harvard	BRD-K87541124			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2ccc(NC(=O)Cc3ccccc3)cc2CC1=O	InChI=1S/C32H39N3O6S/c1-22-10-13-28(14-11-22)42(39,40)34(4)20-30-23(2)19-35(24(3)21-36)32(38)18-26-17-27(12-15-29(26)41-30)33-31(37)16-25-8-6-5-7-9-25/h5-15,17,23-24,30,36H,16,18-21H2,1-4H3,(H,33,37)/t23-,24+,30+/m1/s1	JFKKEIVDTMFBMW-QEGDFHJFSA-N	593.255956688							113757
BRD-K95619717-001-01-0	LSM-25190	BRD-K95619717	44494198	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15-,21+/m1/s1	LUEPMRNQGZCFGP-PZPWOCDFSA-N	CNC[C@@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K95619717	BRD-K95619717-001-01-0	Broad Institute of MIT and Harvard	BRD-K95619717			CNC[C@@H]1Oc2c(NC(=O)Nc3ccc4OCOc4c3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H30N4O6/c1-14-11-28(15(2)12-29)23(30)17-5-4-6-18(22(17)34-21(14)10-25-3)27-24(31)26-16-7-8-19-20(9-16)33-13-32-19/h4-9,14-15,21,25,29H,10-13H2,1-3H3,(H2,26,27,31)/t14-,15-,21+/m1/s1	LUEPMRNQGZCFGP-PZPWOCDFSA-N	470.21653472							113758
BRD-K74568359	LSM-25191		44619863	InChI=1S/C27H39N5O5/c1-16-12-32(17(2)15-33)25(34)11-21-10-22(28-27(35)29-26-18(3)30-37-19(26)4)8-9-23(21)36-24(16)14-31(5)13-20-6-7-20/h8-10,16-17,20,24,33H,6-7,11-15H2,1-5H3,(H2,28,29,35)/t16-,17+,24+/m1/s1	RRKRQZMEMKUNGW-KCYKTTMJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3CC1=O	BroadT	BRD-K74568359	BRD-K74568359-001-01-7	Broad Institute of MIT and Harvard	BRD-K74568359			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2CC1=O	InChI=1S/C27H39N5O5/c1-16-12-32(17(2)15-33)25(34)11-21-10-22(28-27(35)29-26-18(3)30-37-19(26)4)8-9-23(21)36-24(16)14-31(5)13-20-6-7-20/h8-10,16-17,20,24,33H,6-7,11-15H2,1-5H3,(H2,28,29,35)/t16-,17+,24+/m1/s1	RRKRQZMEMKUNGW-KCYKTTMJSA-N	513.295119398							113759
BRD-K60578515	LSM-25192		44488534	InChI=1S/C26H31Cl2N7O4/c1-16-10-35(17(2)14-36)26(38)20-9-19(30-25(37)13-34-15-29-31-32-34)5-7-23(20)39-24(16)12-33(3)11-18-4-6-21(27)22(28)8-18/h4-9,15-17,24,36H,10-14H2,1-3H3,(H,30,37)/t16-,17+,24+/m1/s1	MIRHJXKFLNBQHA-KCYKTTMJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NC(=O)Cn4cnnn4)cc3C1=O	BroadT	BRD-K60578515	BRD-K60578515-001-01-3	Broad Institute of MIT and Harvard	BRD-K60578515			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NC(=O)Cn3cnnn3)cc2C1=O	InChI=1S/C26H31Cl2N7O4/c1-16-10-35(17(2)14-36)26(38)20-9-19(30-25(37)13-34-15-29-31-32-34)5-7-23(20)39-24(16)12-33(3)11-18-4-6-21(27)22(28)8-18/h4-9,15-17,24,36H,10-14H2,1-3H3,(H,30,37)/t16-,17+,24+/m1/s1	MIRHJXKFLNBQHA-KCYKTTMJSA-N	575.181457962							113760
BRD-K65445351	LSM-25193		44484765	InChI=1S/C30H34ClN3O6S/c1-20-17-34(21(2)19-35)30(37)26-16-24(32-29(36)15-22-7-5-4-6-8-22)11-14-27(26)40-28(20)18-33(3)41(38,39)25-12-9-23(31)10-13-25/h4-14,16,20-21,28,35H,15,17-19H2,1-3H3,(H,32,36)/t20-,21+,28-/m0/s1	OPYKWGJVQMREOT-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K65445351	BRD-K65445351-001-01-7	Broad Institute of MIT and Harvard	BRD-K65445351			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C30H34ClN3O6S/c1-20-17-34(21(2)19-35)30(37)26-16-24(32-29(36)15-22-7-5-4-6-8-22)11-14-27(26)40-28(20)18-33(3)41(38,39)25-12-9-23(31)10-13-25/h4-14,16,20-21,28,35H,15,17-19H2,1-3H3,(H,32,36)/t20-,21+,28-/m0/s1	OPYKWGJVQMREOT-GTNJKRJXSA-N	599.185684238							113761
BRD-K68617666	LSM-25194		44492393	InChI=1S/C26H32FN3O6S/c1-16-13-30(17(2)15-31)26(33)22-12-20(28-25(32)18-4-5-18)8-11-23(22)36-24(16)14-29(3)37(34,35)21-9-6-19(27)7-10-21/h6-12,16-18,24,31H,4-5,13-15H2,1-3H3,(H,28,32)/t16-,17-,24-/m0/s1	AVAQDGZIUQEYTO-UAVUOLJFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ccc(NC(=O)C4CC4)cc3C1=O	BroadT	BRD-K68617666	BRD-K68617666-001-01-8	Broad Institute of MIT and Harvard	BRD-K68617666			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ccc(NC(=O)C3CC3)cc2C1=O	InChI=1S/C26H32FN3O6S/c1-16-13-30(17(2)15-31)26(33)22-12-20(28-25(32)18-4-5-18)8-11-23(22)36-24(16)14-29(3)37(34,35)21-9-6-19(27)7-10-21/h6-12,16-18,24,31H,4-5,13-15H2,1-3H3,(H,28,32)/t16-,17-,24-/m0/s1	AVAQDGZIUQEYTO-UAVUOLJFSA-N	533.199584664							113762
MLS002474079	LSM-25195	BRD-K46805838, SID85201642	44202726	InChI=1S/C26H31Cl2N7O4/c1-16-10-35(17(2)14-36)26(38)20-9-19(30-25(37)13-34-15-29-31-32-34)5-7-23(20)39-24(16)12-33(3)11-18-4-6-21(27)22(28)8-18/h4-9,15-17,24,36H,10-14H2,1-3H3,(H,30,37)/t16-,17+,24+/m0/s1	MIRHJXKFLNBQHA-OBWXTZQISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NC(=O)Cn4cnnn4)cc3C1=O	BroadT	BRD-K46805838	BRD-K46805838-001-02-7	Broad Institute of MIT and Harvard	BRD-K46805838			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NC(=O)Cn3cnnn3)cc2C1=O	InChI=1S/C26H31Cl2N7O4/c1-16-10-35(17(2)14-36)26(38)20-9-19(30-25(37)13-34-15-29-31-32-34)5-7-23(20)39-24(16)12-33(3)11-18-4-6-21(27)22(28)8-18/h4-9,15-17,24,36H,10-14H2,1-3H3,(H,30,37)/t16-,17+,24+/m0/s1	MIRHJXKFLNBQHA-OBWXTZQISA-N	575.181457962							113763
BRD-K39411863	LSM-25196		44492984	InChI=1S/C27H38N4O4/c1-18(2)28-27(34)29-23-13-9-12-22-25(23)35-24(16-30(5)15-21-10-7-6-8-11-21)19(3)14-31(26(22)33)20(4)17-32/h6-13,18-20,24,32H,14-17H2,1-5H3,(H2,28,29,34)/t19-,20-,24-/m1/s1	NCIZYGIVVKAPIW-YOSAUDMPSA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@@H](C)[C@@H](CN(C)Cc3ccccc3)Oc12)[C@H](C)CO	BroadT	BRD-K39411863	BRD-K39411863-001-01-3	Broad Institute of MIT and Harvard	BRD-K39411863			CC(C)NC(=O)Nc1cccc2c1O[C@H](CN(C)Cc1ccccc1)[C@H](C)CN([C@H](C)CO)C2=O	InChI=1S/C27H38N4O4/c1-18(2)28-27(34)29-23-13-9-12-22-25(23)35-24(16-30(5)15-21-10-7-6-8-11-21)19(3)14-31(26(22)33)20(4)17-32/h6-13,18-20,24,32H,14-17H2,1-5H3,(H2,28,29,34)/t19-,20-,24-/m1/s1	NCIZYGIVVKAPIW-YOSAUDMPSA-N	482.289305736							113764
BRD-K37386363	LSM-25197		44496276	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16+,20+/m1/s1	DJIXJENXBPUHIX-GUXCAODWSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K37386363	BRD-K37386363-001-01-4	Broad Institute of MIT and Harvard	BRD-K37386363			CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16+,20+/m1/s1	DJIXJENXBPUHIX-GUXCAODWSA-N	460.268570292							113765
BRD-K36135420	LSM-25198		44496667	InChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20-,26-/m0/s1	ODSKXFDDLKDNDM-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3c(NC(=O)C4CCCCC4)cccc3C1=O	BroadT	BRD-K36135420	BRD-K36135420-001-01-7	Broad Institute of MIT and Harvard	BRD-K36135420			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2c(NC(=O)C3CCCCC3)cccc2C1=O	InChI=1S/C29H38ClN3O6S/c1-19-16-33(20(2)18-34)29(36)24-10-7-11-25(31-28(35)21-8-5-4-6-9-21)27(24)39-26(19)17-32(3)40(37,38)23-14-12-22(30)13-15-23/h7,10-15,19-21,26,34H,4-6,8-9,16-18H2,1-3H3,(H,31,35)/t19-,20-,26-/m0/s1	ODSKXFDDLKDNDM-DYLHXGEVSA-N	591.216984366							113766
BRD-K29143088	LSM-25199		44484184	InChI=1S/C29H40N4O4/c1-20-16-33(21(2)19-34)29(36)25-15-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)37-27(20)18-32(3)17-22-7-5-4-6-8-22/h9-15,20-22,27,34H,4-8,16-19H2,1-3H3,(H,31,35)/t20-,21-,27-/m1/s1	FYESYKULLQIDLV-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K29143088	BRD-K29143088-001-01-3	Broad Institute of MIT and Harvard	BRD-K29143088			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H40N4O4/c1-20-16-33(21(2)19-34)29(36)25-15-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)37-27(20)18-32(3)17-22-7-5-4-6-8-22/h9-15,20-22,27,34H,4-8,16-19H2,1-3H3,(H,31,35)/t20-,21-,27-/m1/s1	FYESYKULLQIDLV-LGVUCKNBSA-N	508.3049558							113767
BRD-K71247208	LSM-25200		44491797	InChI=1S/C28H35F3N4O6/c1-17-14-35(18(2)16-36)26(38)22-13-20(32-25(37)11-12-28(29,30)31)7-10-23(22)41-24(17)15-34(3)27(39)33-19-5-8-21(40-4)9-6-19/h5-10,13,17-18,24,36H,11-12,14-16H2,1-4H3,(H,32,37)(H,33,39)/t17-,18+,24-/m1/s1	RKPQTFDXIVHBLJ-NXMSCROESA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K71247208	BRD-K71247208-001-01-4	Broad Institute of MIT and Harvard	BRD-K71247208			COc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C28H35F3N4O6/c1-17-14-35(18(2)16-36)26(38)22-13-20(32-25(37)11-12-28(29,30)31)7-10-23(22)41-24(17)15-34(3)27(39)33-19-5-8-21(40-4)9-6-19/h5-10,13,17-18,24,36H,11-12,14-16H2,1-4H3,(H,32,37)(H,33,39)/t17-,18+,24-/m1/s1	RKPQTFDXIVHBLJ-NXMSCROESA-N	580.25086948							113768
BRD-K04336022	LSM-25201		44498962	InChI=1S/C26H34N4O6/c1-16-12-30(17(2)14-31)25(32)19-7-6-8-20(28(3)4)24(19)36-23(16)13-29(5)26(33)27-18-9-10-21-22(11-18)35-15-34-21/h6-11,16-17,23,31H,12-15H2,1-5H3,(H,27,33)/t16-,17+,23-/m1/s1	DFCREXDAKHJSKD-SAHWJRBASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K04336022	BRD-K04336022-001-01-1	Broad Institute of MIT and Harvard	BRD-K04336022			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H34N4O6/c1-16-12-30(17(2)14-31)25(32)19-7-6-8-20(28(3)4)24(19)36-23(16)13-29(5)26(33)27-18-9-10-21-22(11-18)35-15-34-21/h6-11,16-17,23,31H,12-15H2,1-5H3,(H,27,33)/t16-,17+,23-/m1/s1	DFCREXDAKHJSKD-SAHWJRBASA-N	498.247834848							113769
BRD-K21254338	LSM-25202		44485892	InChI=1S/C24H33N3O5S/c1-17-14-27(18(2)16-28)24(29)21-13-19(25(3)4)11-12-22(21)32-23(17)15-26(5)33(30,31)20-9-7-6-8-10-20/h6-13,17-18,23,28H,14-16H2,1-5H3/t17-,18-,23+/m0/s1	ZRFMJOMCDWKIOJ-IUKKYPGJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K21254338	BRD-K21254338-001-01-4	Broad Institute of MIT and Harvard	BRD-K21254338			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C24H33N3O5S/c1-17-14-27(18(2)16-28)24(29)21-13-19(25(3)4)11-12-22(21)32-23(17)15-26(5)33(30,31)20-9-7-6-8-10-20/h6-13,17-18,23,28H,14-16H2,1-5H3/t17-,18-,23+/m0/s1	ZRFMJOMCDWKIOJ-IUKKYPGJSA-N	475.214091876							113770
BRD-K28785305	LSM-25203		44494679	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)30-22-13-9-12-21-24(22)37-23(18(3)14-32(25(21)34)19(4)16-33)15-31(5)27(36)29-20-10-7-6-8-11-20/h6-13,17-19,23,33H,14-16H2,1-5H3,(H,29,36)(H2,28,30,35)/t18-,19-,23+/m1/s1	FNAJZGJPYUNJBY-PWHSHALESA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@@H](C)[C@H](CN(C)C(=O)Nc3ccccc3)Oc12)[C@H](C)CO	BroadT	BRD-K28785305	BRD-K28785305-001-01-9	Broad Institute of MIT and Harvard	BRD-K28785305			CC(C)NC(=O)Nc1cccc2C(=O)N([C@H](C)CO)C[C@@H](C)[C@H](CN(C)C(=O)Nc3ccccc3)Oc12	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)30-22-13-9-12-21-24(22)37-23(18(3)14-32(25(21)34)19(4)16-33)15-31(5)27(36)29-20-10-7-6-8-11-20/h6-13,17-19,23,33H,14-16H2,1-5H3,(H,29,36)(H2,28,30,35)/t18-,19-,23+/m1/s1	FNAJZGJPYUNJBY-PWHSHALESA-N	511.279469334							113771
BRD-K83013052	LSM-25204		44489648	InChI=1S/C24H29F3N4O4/c1-14-12-31(15(2)13-32)22(33)18-5-4-6-19(21(18)35-20(14)11-28-3)30-23(34)29-17-9-7-16(8-10-17)24(25,26)27/h4-10,14-15,20,28,32H,11-13H2,1-3H3,(H2,29,30,34)/t14-,15+,20+/m0/s1	KNPSDLIHJHZPLR-BXTJHSDWSA-N	CNC[C@H]1Oc2c(NC(=O)Nc3ccc(cc3)C(F)(F)F)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K83013052	BRD-K83013052-001-01-3	Broad Institute of MIT and Harvard	BRD-K83013052			CNC[C@H]1Oc2c(NC(=O)Nc3ccc(cc3)C(F)(F)F)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H29F3N4O4/c1-14-12-31(15(2)13-32)22(33)18-5-4-6-19(21(18)35-20(14)11-28-3)30-23(34)29-17-9-7-16(8-10-17)24(25,26)27/h4-10,14-15,20,28,32H,11-13H2,1-3H3,(H2,29,30,34)/t14-,15+,20+/m0/s1	KNPSDLIHJHZPLR-BXTJHSDWSA-N	494.214090048							113772
BRD-K59670689	LSM-25205		54613796	InChI=1S/C28H40N4O4/c1-19(2)29-28(35)30-24-11-12-25-23(13-24)14-27(34)32(21(4)18-33)15-20(3)26(36-25)17-31(5)16-22-9-7-6-8-10-22/h6-13,19-21,26,33H,14-18H2,1-5H3,(H2,29,30,35)/t20-,21+,26+/m0/s1	ZPQZMRPPCAYKJS-LZCXECNNSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)Cc2c1	BroadT	BRD-K59670689	BRD-K59670689-001-01-1	Broad Institute of MIT and Harvard	BRD-K59670689			CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)Cc3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)Cc2c1	InChI=1S/C28H40N4O4/c1-19(2)29-28(35)30-24-11-12-25-23(13-24)14-27(34)32(21(4)18-33)15-20(3)26(36-25)17-31(5)16-22-9-7-6-8-10-22/h6-13,19-21,26,33H,14-18H2,1-5H3,(H2,29,30,35)/t20-,21+,26+/m0/s1	ZPQZMRPPCAYKJS-LZCXECNNSA-N	496.3049558							113773
BRD-K73768826	LSM-25206		44485029	InChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16-,20-/m0/s1	HFFGMDRCIAVIES-FTRWYGJKSA-N	CNC[C@@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K73768826	BRD-K73768826-001-01-9	Broad Institute of MIT and Harvard	BRD-K73768826			CNC[C@@H]1Oc2c(NC(=O)NC3CCCCC3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H36N4O4/c1-15-13-27(16(2)14-28)22(29)18-10-7-11-19(21(18)31-20(15)12-24-3)26-23(30)25-17-8-5-4-6-9-17/h7,10-11,15-17,20,24,28H,4-6,8-9,12-14H2,1-3H3,(H2,25,26,30)/t15-,16-,20-/m0/s1	HFFGMDRCIAVIES-FTRWYGJKSA-N	432.273655672							113774
BRD-K42363982	LSM-25207		44498745	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-19-15(3)11-26(16(4)13-27)21(28)17-9-8-10-18(24(5)6)20(17)30-19/h8-10,14-16,19,27H,11-13H2,1-7H3,(H,23,29)/t15-,16+,19-/m0/s1	XZXNUYDCQDAXAA-FCEWJHQRSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2c(cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K42363982	BRD-K42363982-001-01-7	Broad Institute of MIT and Harvard	BRD-K42363982			CC(C)NC(=O)N(C)C[C@@H]1Oc2c(cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-19-15(3)11-26(16(4)13-27)21(28)17-9-8-10-18(24(5)6)20(17)30-19/h8-10,14-16,19,27H,11-13H2,1-7H3,(H,23,29)/t15-,16+,19-/m0/s1	XZXNUYDCQDAXAA-FCEWJHQRSA-N	420.273655672							113775
BRD-K44307624	LSM-25208		44484125	InChI=1S/C30H36N4O4/c1-21-17-34(22(2)20-35)29(36)26-16-25(32-30(37)31-24-12-8-5-9-13-24)14-15-27(26)38-28(21)19-33(3)18-23-10-6-4-7-11-23/h4-16,21-22,28,35H,17-20H2,1-3H3,(H2,31,32,37)/t21-,22+,28-/m0/s1	HYMZOYYGWSDRHJ-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)Oc3ccc(NC(=O)Nc4ccccc4)cc3C1=O	BroadT	BRD-K44307624	BRD-K44307624-001-01-6	Broad Institute of MIT and Harvard	BRD-K44307624			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H36N4O4/c1-21-17-34(22(2)20-35)29(36)26-16-25(32-30(37)31-24-12-8-5-9-13-24)14-15-27(26)38-28(21)19-33(3)18-23-10-6-4-7-11-23/h4-16,21-22,28,35H,17-20H2,1-3H3,(H2,31,32,37)/t21-,22+,28-/m0/s1	HYMZOYYGWSDRHJ-TYPXCFOJSA-N	516.273655672							113776
BRD-K11331752	LSM-25209		44618236	InChI=1S/C31H38F3N5O5/c1-18-14-39(19(2)17-40)28(41)13-23-12-25(35-30(42)36-29-20(3)37-44-21(29)4)10-11-26(23)43-27(18)16-38(5)15-22-6-8-24(9-7-22)31(32,33)34/h6-12,18-19,27,40H,13-17H2,1-5H3,(H2,35,36,42)/t18-,19-,27+/m0/s1	XNWPWURMKBHVTJ-RWYJCYHVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3CC1=O	BroadT	BRD-K11331752	BRD-K11331752-001-01-9	Broad Institute of MIT and Harvard	BRD-K11331752			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2CC1=O	InChI=1S/C31H38F3N5O5/c1-18-14-39(19(2)17-40)28(41)13-23-12-25(35-30(42)36-29-20(3)37-44-21(29)4)10-11-26(23)43-27(18)16-38(5)15-22-6-8-24(9-7-22)31(32,33)34/h6-12,18-19,27,40H,13-17H2,1-5H3,(H2,35,36,42)/t18-,19-,27+/m0/s1	XNWPWURMKBHVTJ-RWYJCYHVSA-N	617.282503966							113777
BRD-K14732815	LSM-25210		44489060	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)28-18-26(35-33(42)37-29-15-9-11-24-10-7-8-14-27(24)29)16-17-30(28)44-31(22)20-38(3)34(43)36-25-12-5-4-6-13-25/h7-11,14-18,22-23,25,31,40H,4-6,12-13,19-21H2,1-3H3,(H,36,43)(H2,35,37,42)/t22-,23-,31-/m0/s1	QXYCJPXUIIEYFH-BVXAZASISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Nc4cccc5ccccc45)cc3C1=O	BroadT	BRD-K14732815	BRD-K14732815-001-01-0	Broad Institute of MIT and Harvard	BRD-K14732815			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)28-18-26(35-33(42)37-29-15-9-11-24-10-7-8-14-27(24)29)16-17-30(28)44-31(22)20-38(3)34(43)36-25-12-5-4-6-13-25/h7-11,14-18,22-23,25,31,40H,4-6,12-13,19-21H2,1-3H3,(H,36,43)(H2,35,37,42)/t22-,23-,31-/m0/s1	QXYCJPXUIIEYFH-BVXAZASISA-N	601.326419526							113778
CHEMBL3184019	LSM-15134	BRD-K34182570	44484793	InChI=1S/C29H41N3O5S/c1-21-17-32(22(2)20-33)29(34)26-16-24(30-38(35,36)25-12-8-5-9-13-25)14-15-27(26)37-28(21)19-31(3)18-23-10-6-4-7-11-23/h5,8-9,12-16,21-23,28,30,33H,4,6-7,10-11,17-20H2,1-3H3/t21-,22+,28-/m1/s1	DAPIBIRMBOQELH-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NS(=O)(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K34182570	BRD-K34182570-001-01-9	Broad Institute of MIT and Harvard	BRD-K34182570			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H41N3O5S/c1-21-17-32(22(2)20-33)29(34)26-16-24(30-38(35,36)25-12-8-5-9-13-25)14-15-27(26)37-28(21)19-31(3)18-23-10-6-4-7-11-23/h5,8-9,12-16,21-23,28,30,33H,4,6-7,10-11,17-20H2,1-3H3/t21-,22+,28-/m1/s1	DAPIBIRMBOQELH-RZIGYZOXSA-N	543.276692132							103790
BRD-K67442425	LSM-25211		44484413	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-41(38,39)23-14-12-21(30)13-15-23)27(24)40-26(19)17-33(3)29(37)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,26,32,35H,4-6,8-9,16-18H2,1-3H3,(H,31,37)/t19-,20-,26+/m1/s1	PZASEUVCJBPSCE-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3c(NS(=O)(=O)c4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K67442425	BRD-K67442425-001-01-4	Broad Institute of MIT and Harvard	BRD-K67442425			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C1=O	InChI=1S/C29H39FN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-41(38,39)23-14-12-21(30)13-15-23)27(24)40-26(19)17-33(3)29(37)31-22-8-5-4-6-9-22/h7,10-15,19-20,22,26,32,35H,4-6,8-9,16-18H2,1-3H3,(H,31,37)/t19-,20-,26+/m1/s1	PZASEUVCJBPSCE-KYTVRQNUSA-N	590.257433898							113779
BRD-K16884266	LSM-25212		44620108	InChI=1S/C26H42N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h11-13,18-19,21,24,31H,6-10,14-17H2,1-5H3,(H,27,33)/t18-,19+,24+/m0/s1	NUQLUNTVVQHOLK-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K16884266	BRD-K16884266-001-01-1	Broad Institute of MIT and Harvard	BRD-K16884266			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C26H42N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h11-13,18-19,21,24,31H,6-10,14-17H2,1-5H3,(H,27,33)/t18-,19+,24+/m0/s1	NUQLUNTVVQHOLK-XLNZFTOWSA-N	474.320605864							113780
BRD-K35826866	LSM-25213		44484115	InChI=1S/C27H39F3N4O5/c1-17-14-34(18(2)16-35)25(37)21-13-20(31-24(36)11-12-27(28,29)30)9-10-22(21)39-23(17)15-33(3)26(38)32-19-7-5-4-6-8-19/h9-10,13,17-19,23,35H,4-8,11-12,14-16H2,1-3H3,(H,31,36)(H,32,38)/t17-,18+,23-/m0/s1	TZWYYOCTWDTYLD-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K35826866	BRD-K35826866-001-01-3	Broad Institute of MIT and Harvard	BRD-K35826866			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H39F3N4O5/c1-17-14-34(18(2)16-35)25(37)21-13-20(31-24(36)11-12-27(28,29)30)9-10-22(21)39-23(17)15-33(3)26(38)32-19-7-5-4-6-8-19/h9-10,13,17-19,23,35H,4-8,11-12,14-16H2,1-3H3,(H,31,36)(H,32,38)/t17-,18+,23-/m0/s1	TZWYYOCTWDTYLD-IXFSTUDKSA-N	556.287254988							113781
MLS002474384	LSM-25214	BRD-K03312699, SID85200910	44202030	InChI=1S/C23H30N4O6S/c1-15-12-27(16(2)14-28)23(30)19-11-18(25-22(29)17-7-9-24-10-8-17)5-6-20(19)33-21(15)13-26(3)34(4,31)32/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16+,21+/m0/s1	WMAXTMTUHGJOAC-GCKMJXCFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K03312699	BRD-K03312699-001-02-3	Broad Institute of MIT and Harvard	BRD-K03312699			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C23H30N4O6S/c1-15-12-27(16(2)14-28)23(30)19-11-18(25-22(29)17-7-9-24-10-8-17)5-6-20(19)33-21(15)13-26(3)34(4,31)32/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16+,21+/m0/s1	WMAXTMTUHGJOAC-GCKMJXCFSA-N	490.18860541							113782
BRD-K31215362	LSM-25215		44484845	InChI=1S/C31H43N5O6/c1-20-17-36(21(2)19-37)29(38)26-16-24(33-30(39)32-23-10-13-25(41-4)14-11-23)12-15-27(26)42-28(20)18-35(3)31(40)34-22-8-6-5-7-9-22/h10-16,20-22,28,37H,5-9,17-19H2,1-4H3,(H,34,40)(H2,32,33,39)/t20-,21-,28-/m0/s1	RJROVUFZJIAJHT-CZBREUMFSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H](CN(C)C(=O)NC4CCCCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K31215362	BRD-K31215362-001-01-2	Broad Institute of MIT and Harvard	BRD-K31215362			COc1ccc(NC(=O)Nc2ccc3O[C@@H](CN(C)C(=O)NC4CCCCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H43N5O6/c1-20-17-36(21(2)19-37)29(38)26-16-24(33-30(39)32-23-10-13-25(41-4)14-11-23)12-15-27(26)42-28(20)18-35(3)31(40)34-22-8-6-5-7-9-22/h10-16,20-22,28,37H,5-9,17-19H2,1-4H3,(H,34,40)(H2,32,33,39)/t20-,21-,28-/m0/s1	RJROVUFZJIAJHT-CZBREUMFSA-N	581.321334146							113783
BRD-K87191742	LSM-25216		44492441	InChI=1S/C35H43N3O6/c1-24-20-38(25(2)23-39)35(41)30-10-7-11-31(36-34(40)27-16-18-42-19-17-27)33(30)44-32(24)22-37(3)21-26-12-14-29(15-13-26)43-28-8-5-4-6-9-28/h4-15,24-25,27,32,39H,16-23H2,1-3H3,(H,36,40)/t24-,25+,32+/m1/s1	CCYKTEMVMBOJBS-NPPPIGHJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4c(NC(=O)C5CCOCC5)cccc4C1=O	BroadT	BRD-K87191742	BRD-K87191742-001-01-9	Broad Institute of MIT and Harvard	BRD-K87191742			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C35H43N3O6/c1-24-20-38(25(2)23-39)35(41)30-10-7-11-31(36-34(40)27-16-18-42-19-17-27)33(30)44-32(24)22-37(3)21-26-12-14-29(15-13-26)43-28-8-5-4-6-9-28/h4-15,24-25,27,32,39H,16-23H2,1-3H3,(H,36,40)/t24-,25+,32+/m1/s1	CCYKTEMVMBOJBS-NPPPIGHJSA-N	601.315186126							113784
BRD-K58324650	LSM-25217		44489536	InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)24-15-22(31(3)4)13-14-26(24)37-27(19)17-32(5)29(36)30-25-12-8-10-21-9-6-7-11-23(21)25/h6-15,19-20,27,34H,16-18H2,1-5H3,(H,30,36)/t19-,20-,27+/m1/s1	FZIWMBCZXHBNOC-DVHCVUMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K58324650	BRD-K58324650-001-01-1	Broad Institute of MIT and Harvard	BRD-K58324650			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)24-15-22(31(3)4)13-14-26(24)37-27(19)17-32(5)29(36)30-25-12-8-10-21-9-6-7-11-23(21)25/h6-15,19-20,27,34H,16-18H2,1-5H3,(H,30,36)/t19-,20-,27+/m1/s1	FZIWMBCZXHBNOC-DVHCVUMVSA-N	504.273655672							113785
BRD-K41809257	LSM-25218		54613798	InChI=1S/C24H32FN3O5S/c1-16-13-28(17(2)15-29)24(30)12-18-11-20(7-10-22(18)33-23(16)14-27(3)4)26-34(31,32)21-8-5-19(25)6-9-21/h5-11,16-17,23,26,29H,12-15H2,1-4H3/t16-,17+,23+/m0/s1	VCRKNKMPQDEVAF-YGKZAACZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2CC1=O	BroadT	BRD-K41809257	BRD-K41809257-001-01-8	Broad Institute of MIT and Harvard	BRD-K41809257			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2CC1=O	InChI=1S/C24H32FN3O5S/c1-16-13-28(17(2)15-29)24(30)12-18-11-20(7-10-22(18)33-23(16)14-27(3)4)26-34(31,32)21-8-5-19(25)6-9-21/h5-11,16-17,23,26,29H,12-15H2,1-4H3/t16-,17+,23+/m0/s1	VCRKNKMPQDEVAF-YGKZAACZSA-N	493.204670044							113786
BRD-K89584810	LSM-25219		44497134	InChI=1S/C28H32N4O6S/c1-19-16-32(20(2)18-33)28(35)23-10-7-11-24(30-27(34)21-12-14-29-15-13-21)26(23)38-25(19)17-31(3)39(36,37)22-8-5-4-6-9-22/h4-15,19-20,25,33H,16-18H2,1-3H3,(H,30,34)/t19-,20-,25-/m1/s1	LXJZSYGAJCUBQM-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3c(NC(=O)c4ccncc4)cccc3C1=O	BroadT	BRD-K89584810	BRD-K89584810-001-01-0	Broad Institute of MIT and Harvard	BRD-K89584810			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O	InChI=1S/C28H32N4O6S/c1-19-16-32(20(2)18-33)28(35)23-10-7-11-24(30-27(34)21-12-14-29-15-13-21)26(23)38-25(19)17-31(3)39(36,37)22-8-5-4-6-9-22/h4-15,19-20,25,33H,16-18H2,1-3H3,(H,30,34)/t19-,20-,25-/m1/s1	LXJZSYGAJCUBQM-UMEGOILYSA-N	552.204255474							113787
BRD-K71839680	LSM-25220		44483733	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)19-7-6-8-22(28(3)4)24(19)33-23(16)14-29(5)13-18-9-10-20(26)21(27)11-18/h6-11,16-17,23,31H,12-15H2,1-5H3/t16-,17+,23+/m1/s1	VYDAAMPIABWJJO-DGGJZMOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K71839680	BRD-K71839680-001-01-5	Broad Institute of MIT and Harvard	BRD-K71839680			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C25H33Cl2N3O3/c1-16-12-30(17(2)15-31)25(32)19-7-6-8-22(28(3)4)24(19)33-23(16)14-29(5)13-18-9-10-20(26)21(27)11-18/h6-11,16-17,23,31H,12-15H2,1-5H3/t16-,17+,23+/m1/s1	VYDAAMPIABWJJO-DGGJZMOXSA-N	493.189897366							113788
BRD-K20799008	LSM-25221		44496515	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18-,24+/m1/s1	JIVQHRCMRGEILI-GGUMNFRJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3c(NC(=O)C4CC4)cccc3C1=O	BroadT	BRD-K20799008	BRD-K20799008-001-01-8	Broad Institute of MIT and Harvard	BRD-K20799008			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2c(NC(=O)C3CC3)cccc2C1=O	InChI=1S/C28H35N3O6/c1-17-13-31(18(2)16-32)27(34)22-5-4-6-23(29-26(33)20-11-12-20)25(22)37-24(17)15-30(3)14-19-7-9-21(10-8-19)28(35)36/h4-10,17-18,20,24,32H,11-16H2,1-3H3,(H,29,33)(H,35,36)/t17-,18-,24+/m1/s1	JIVQHRCMRGEILI-GGUMNFRJSA-N	509.25258587							113789
BRD-K35451051	LSM-25222		44495601	InChI=1S/C24H32N4O4/c1-16-13-28(17(2)15-29)23(30)19-11-8-12-20(22(19)32-21(16)14-27(3)4)26-24(31)25-18-9-6-5-7-10-18/h5-12,16-17,21,29H,13-15H2,1-4H3,(H2,25,26,31)/t16-,17+,21+/m1/s1	SSJJWSMGDNAKCS-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	BroadT	BRD-K35451051	BRD-K35451051-001-01-5	Broad Institute of MIT and Harvard	BRD-K35451051			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	InChI=1S/C24H32N4O4/c1-16-13-28(17(2)15-29)23(30)19-11-8-12-20(22(19)32-21(16)14-27(3)4)26-24(31)25-18-9-6-5-7-10-18/h5-12,16-17,21,29H,13-15H2,1-4H3,(H2,25,26,31)/t16-,17+,21+/m1/s1	SSJJWSMGDNAKCS-WWMYMODYSA-N	440.242355544							113790
BRD-K87180723	LSM-25223		44496598	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23-,29+/m0/s1	ZVHZCYJHGRNXGN-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)c4ccc(cc4)c5nccs5)cccc3C1=O	BroadT	BRD-K87180723	BRD-K87180723-001-01-5	Broad Institute of MIT and Harvard	BRD-K87180723			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C1=O	InChI=1S/C33H42N4O4S/c1-22-18-37(23(2)21-38)33(40)27-10-7-11-28(30(27)41-29(22)20-36(3)19-24-8-5-4-6-9-24)35-31(39)25-12-14-26(15-13-25)32-34-16-17-42-32/h7,10-17,22-24,29,38H,4-6,8-9,18-21H2,1-3H3,(H,35,39)/t22-,23-,29+/m0/s1	ZVHZCYJHGRNXGN-SBZVUBOMSA-N	590.292676554							113791
BRD-K54023716	LSM-25224		44618094	InChI=1S/C24H38N4O4/c1-16-14-28(17(2)15-29)23(30)12-18-11-20(9-10-21(18)32-22(16)13-25-3)27-24(31)26-19-7-5-4-6-8-19/h9-11,16-17,19,22,25,29H,4-8,12-15H2,1-3H3,(H2,26,27,31)/t16-,17+,22+/m1/s1	UULCDSMPFJBLQO-JLHGSKIFSA-N	CNC[C@@H]1Oc2ccc(NC(=O)NC3CCCCC3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K54023716	BRD-K54023716-001-01-5	Broad Institute of MIT and Harvard	BRD-K54023716			CNC[C@@H]1Oc2ccc(NC(=O)NC3CCCCC3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H38N4O4/c1-16-14-28(17(2)15-29)23(30)12-18-11-20(9-10-21(18)32-22(16)13-25-3)27-24(31)26-19-7-5-4-6-8-19/h9-11,16-17,19,22,25,29H,4-8,12-15H2,1-3H3,(H2,26,27,31)/t16-,17+,22+/m1/s1	UULCDSMPFJBLQO-JLHGSKIFSA-N	446.289305736							113792
BRD-K45315294	LSM-25225		44492130	InChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)11-18-10-19(4-5-20(18)31-21(15)12-24-3)26-23(30)17-6-8-25-9-7-17/h4-10,15-16,21,24,28H,11-14H2,1-3H3,(H,26,30)/t15-,16+,21+/m0/s1	FZIMPWDREOYZDI-GCKMJXCFSA-N	CNC[C@H]1Oc2ccc(NC(=O)c3ccncc3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K45315294	BRD-K45315294-001-01-7	Broad Institute of MIT and Harvard	BRD-K45315294			CNC[C@H]1Oc2ccc(NC(=O)c3ccncc3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)11-18-10-19(4-5-20(18)31-21(15)12-24-3)26-23(30)17-6-8-25-9-7-17/h4-10,15-16,21,24,28H,11-14H2,1-3H3,(H,26,30)/t15-,16+,21+/m0/s1	FZIMPWDREOYZDI-GCKMJXCFSA-N	426.22670548							113793
BRD-K02334683	LSM-25226		44484271	InChI=1S/C30H41F3N4O4/c1-20-16-37(21(2)19-38)29(40)25-15-24(34-28(39)7-6-14-35(3)4)12-13-26(25)41-27(20)18-36(5)17-22-8-10-23(11-9-22)30(31,32)33/h8-13,15,20-21,27,38H,6-7,14,16-19H2,1-5H3,(H,34,39)/t20-,21-,27-/m0/s1	DDFOXWCTSAMXEO-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K02334683	BRD-K02334683-001-01-8	Broad Institute of MIT and Harvard	BRD-K02334683			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C30H41F3N4O4/c1-20-16-37(21(2)19-38)29(40)25-15-24(34-28(39)7-6-14-35(3)4)12-13-26(25)41-27(20)18-36(5)17-22-8-10-23(11-9-22)30(31,32)33/h8-13,15,20-21,27,38H,6-7,14,16-19H2,1-5H3,(H,34,39)/t20-,21-,27-/m0/s1	DDFOXWCTSAMXEO-IZVMNLJQSA-N	578.307990432							113794
BRD-K76922696	LSM-25227		44486127	InChI=1S/C35H38N4O6/c1-22-17-39(23(2)20-40)34(41)28-16-26(36-35(42)37-29-10-6-8-25-7-4-5-9-27(25)29)12-14-30(28)45-33(22)19-38(3)18-24-11-13-31-32(15-24)44-21-43-31/h4-16,22-23,33,40H,17-21H2,1-3H3,(H2,36,37,42)/t22-,23-,33-/m0/s1	MDVGURPVGABTFV-BHWLZUDQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)Nc5cccc6ccccc56)cc4C1=O	BroadT	BRD-K76922696	BRD-K76922696-001-01-6	Broad Institute of MIT and Harvard	BRD-K76922696			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C35H38N4O6/c1-22-17-39(23(2)20-40)34(41)28-16-26(36-35(42)37-29-10-6-8-25-7-4-5-9-27(25)29)12-14-30(28)45-33(22)19-38(3)18-24-11-13-31-32(15-24)44-21-43-31/h4-16,22-23,33,40H,17-21H2,1-3H3,(H2,36,37,42)/t22-,23-,33-/m0/s1	MDVGURPVGABTFV-BHWLZUDQSA-N	610.279134976							113795
BRD-K64593260	LSM-25228		44494850	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)20-7-6-8-21(26(3)4)23(20)31-22(17)15-27(5)14-19-9-11-25-12-10-19/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18-,22-/m0/s1	OVBQAIOLOOTXQW-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K64593260	BRD-K64593260-001-01-5	Broad Institute of MIT and Harvard	BRD-K64593260			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)20-7-6-8-21(26(3)4)23(20)31-22(17)15-27(5)14-19-9-11-25-12-10-19/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18-,22-/m0/s1	OVBQAIOLOOTXQW-SPEDKVCISA-N	426.263090988							113796
BRD-K35347834	LSM-25229		44491524	InChI=1S/C25H38N4O5/c1-15(2)26-25(33)28(5)13-22-16(3)12-29(17(4)14-30)23(31)11-19-10-20(8-9-21(19)34-22)27-24(32)18-6-7-18/h8-10,15-18,22,30H,6-7,11-14H2,1-5H3,(H,26,33)(H,27,32)/t16-,17+,22+/m0/s1	DCTUMTORVFHGKV-GSHUGGBRSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K35347834	BRD-K35347834-001-01-9	Broad Institute of MIT and Harvard	BRD-K35347834			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C25H38N4O5/c1-15(2)26-25(33)28(5)13-22-16(3)12-29(17(4)14-30)23(31)11-19-10-20(8-9-21(19)34-22)27-24(32)18-6-7-18/h8-10,15-18,22,30H,6-7,11-14H2,1-5H3,(H,26,33)(H,27,32)/t16-,17+,22+/m0/s1	DCTUMTORVFHGKV-GSHUGGBRSA-N	474.284220356							113797
CHEMBL2136783	LSM-25230	BRD-K04087396, SID85810098	44503016	InChI=1S/C36H40N4O4/c1-25-21-40(26(2)24-41)35(42)20-31-19-32(38-36(43)30-15-17-37-18-16-30)13-14-33(31)44-34(25)23-39(3)22-27-9-11-29(12-10-27)28-7-5-4-6-8-28/h4-19,25-26,34,41H,20-24H2,1-3H3,(H,38,43)/t25-,26-,34-/m0/s1	IQSVNIDGIMJPQN-KTYLLXISSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)Oc4ccc(NC(=O)c5ccncc5)cc4CC1=O	BroadT	BRD-K04087396	BRD-K04087396-001-01-8	Broad Institute of MIT and Harvard	BRD-K04087396			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C36H40N4O4/c1-25-21-40(26(2)24-41)35(42)20-31-19-32(38-36(43)30-15-17-37-18-16-30)13-14-33(31)44-34(25)23-39(3)22-27-9-11-29(12-10-27)28-7-5-4-6-8-28/h4-19,25-26,34,41H,20-24H2,1-3H3,(H,38,43)/t25-,26-,34-/m0/s1	IQSVNIDGIMJPQN-KTYLLXISSA-N	592.3049558							113798
BRD-K03697080	LSM-25231		44484161	InChI=1S/C20H28F3N3O4/c1-12-10-26(13(2)11-27)19(29)15-8-14(25-18(28)6-7-20(21,22)23)4-5-16(15)30-17(12)9-24-3/h4-5,8,12-13,17,24,27H,6-7,9-11H2,1-3H3,(H,25,28)/t12-,13+,17-/m0/s1	MJOLMSVGHZLLLZ-AHIWAGSCSA-N	CNC[C@@H]1Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K03697080	BRD-K03697080-001-01-6	Broad Institute of MIT and Harvard	BRD-K03697080			CNC[C@@H]1Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C20H28F3N3O4/c1-12-10-26(13(2)11-27)19(29)15-8-14(25-18(28)6-7-20(21,22)23)4-5-16(15)30-17(12)9-24-3/h4-5,8,12-13,17,24,27H,6-7,9-11H2,1-3H3,(H,25,28)/t12-,13+,17-/m0/s1	MJOLMSVGHZLLLZ-AHIWAGSCSA-N	431.203191006							113799
BRD-K16954129	LSM-25232		44503203	InChI=1S/C30H50N4O4/c1-22-18-34(23(2)21-35)30(37)17-25-16-26(31-29(36)12-9-15-32(3)4)13-14-27(25)38-28(22)20-33(5)19-24-10-7-6-8-11-24/h13-14,16,22-24,28,35H,6-12,15,17-21H2,1-5H3,(H,31,36)/t22-,23-,28-/m1/s1	XTYMFXBEGHIJAG-MVOZIGHISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)CCCN(C)C)cc3CC1=O	BroadT	BRD-K16954129	BRD-K16954129-001-01-9	Broad Institute of MIT and Harvard	BRD-K16954129			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)CCCN(C)C)cc2CC1=O	InChI=1S/C30H50N4O4/c1-22-18-34(23(2)21-35)30(37)17-25-16-26(31-29(36)12-9-15-32(3)4)13-14-27(25)38-28(22)20-33(5)19-24-10-7-6-8-11-24/h13-14,16,22-24,28,35H,6-12,15,17-21H2,1-5H3,(H,31,36)/t22-,23-,28-/m1/s1	XTYMFXBEGHIJAG-MVOZIGHISA-N	530.38320612							113800
BRD-K51253991	LSM-25233		44484254	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)21-12-20(26(3)4)6-7-22(21)31-23(17)15-27(5)14-19-8-10-25-11-9-19/h6-12,17-18,23,29H,13-16H2,1-5H3/t17-,18-,23-/m0/s1	VHHIAINGBKGYCV-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K51253991	BRD-K51253991-001-01-7	Broad Institute of MIT and Harvard	BRD-K51253991			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)21-12-20(26(3)4)6-7-22(21)31-23(17)15-27(5)14-19-8-10-25-11-9-19/h6-12,17-18,23,29H,13-16H2,1-5H3/t17-,18-,23-/m0/s1	VHHIAINGBKGYCV-BSRJHKFKSA-N	426.263090988							113801
BRD-K58070604	LSM-25234		44492902	InChI=1S/C24H33N3O5S/c1-17-14-27(18(2)16-28)24(29)21-13-19(25(3)4)11-12-22(21)32-23(17)15-26(5)33(30,31)20-9-7-6-8-10-20/h6-13,17-18,23,28H,14-16H2,1-5H3/t17-,18+,23+/m0/s1	ZRFMJOMCDWKIOJ-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K58070604	BRD-K58070604-001-02-5	Broad Institute of MIT and Harvard	BRD-K58070604			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C24H33N3O5S/c1-17-14-27(18(2)16-28)24(29)21-13-19(25(3)4)11-12-22(21)32-23(17)15-26(5)33(30,31)20-9-7-6-8-10-20/h6-13,17-18,23,28H,14-16H2,1-5H3/t17-,18+,23+/m0/s1	ZRFMJOMCDWKIOJ-YZZKKUAISA-N	475.214091876							113802
BRD-K39668479	LSM-25235		44486134	InChI=1S/C21H33N3O5S/c1-14-10-24(15(2)13-25)21(26)18-9-17(22-30(4,27)28)7-8-19(18)29-20(14)12-23(3)11-16-5-6-16/h7-9,14-16,20,22,25H,5-6,10-13H2,1-4H3/t14-,15-,20-/m0/s1	BGZVNGLBILQJCV-AVYPCKFXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K39668479	BRD-K39668479-001-01-4	Broad Institute of MIT and Harvard	BRD-K39668479			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C21H33N3O5S/c1-14-10-24(15(2)13-25)21(26)18-9-17(22-30(4,27)28)7-8-19(18)29-20(14)12-23(3)11-16-5-6-16/h7-9,14-16,20,22,25H,5-6,10-13H2,1-4H3/t14-,15-,20-/m0/s1	BGZVNGLBILQJCV-AVYPCKFXSA-N	439.214091876							113803
BRD-K48592348	LSM-25236		44493787	InChI=1S/C24H31FN4O6S/c1-15-12-29(16(2)14-30)23(31)20-11-19(27-24(32)26-18-7-5-17(25)6-8-18)9-10-21(20)35-22(15)13-28(3)36(4,33)34/h5-11,15-16,22,30H,12-14H2,1-4H3,(H2,26,27,32)/t15-,16+,22-/m1/s1	MLGOEVOOOJSBLY-ZMPRRUGASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K48592348	BRD-K48592348-001-01-4	Broad Institute of MIT and Harvard	BRD-K48592348			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C24H31FN4O6S/c1-15-12-29(16(2)14-30)23(31)20-11-19(27-24(32)26-18-7-5-17(25)6-8-18)9-10-21(20)35-22(15)13-28(3)36(4,33)34/h5-11,15-16,22,30H,12-14H2,1-4H3,(H2,26,27,32)/t15-,16+,22-/m1/s1	MLGOEVOOOJSBLY-ZMPRRUGASA-N	522.194833642							113804
BRD-K39419290	LSM-25237		44491825	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)19-10-17(6-9-20(19)31-21(14)11-24-3)25-32(29,30)18-7-4-16(23)5-8-18/h4-10,14-15,21,24-25,27H,11-13H2,1-3H3/t14-,15-,21-/m1/s1	DERWQPYGNBVBMF-VTJXTGGHSA-N	CNC[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K39419290	BRD-K39419290-001-01-9	Broad Institute of MIT and Harvard	BRD-K39419290			CNC[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C22H28FN3O5S/c1-14-12-26(15(2)13-27)22(28)19-10-17(6-9-20(19)31-21(14)11-24-3)25-32(29,30)18-7-4-16(23)5-8-18/h4-10,14-15,21,24-25,27H,11-13H2,1-3H3/t14-,15-,21-/m1/s1	DERWQPYGNBVBMF-VTJXTGGHSA-N	465.173369916							113805
BRD-K93866368	LSM-25238		44618333	InChI=1S/C25H36F3N3O4/c1-16-12-31(17(2)15-32)24(34)11-19-10-20(29-23(33)8-9-25(26,27)28)6-7-21(19)35-22(16)14-30(3)13-18-4-5-18/h6-7,10,16-18,22,32H,4-5,8-9,11-15H2,1-3H3,(H,29,33)/t16-,17+,22+/m0/s1	OWJOIEFDHRCHNY-GSHUGGBRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC1=O	BroadT	BRD-K93866368	BRD-K93866368-001-01-1	Broad Institute of MIT and Harvard	BRD-K93866368			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C25H36F3N3O4/c1-16-12-31(17(2)15-32)24(34)11-19-10-20(29-23(33)8-9-25(26,27)28)6-7-21(19)35-22(16)14-30(3)13-18-4-5-18/h6-7,10,16-18,22,32H,4-5,8-9,11-15H2,1-3H3,(H,29,33)/t16-,17+,22+/m0/s1	OWJOIEFDHRCHNY-GSHUGGBRSA-N	499.265791262							113806
BRD-K71138333	LSM-25239		44483394	InChI=1S/C27H31Cl2N3O5S2/c1-17-13-32(18(2)16-33)27(34)21-12-20(30-39(35,36)26-5-4-10-38-26)7-9-24(21)37-25(17)15-31(3)14-19-6-8-22(28)23(29)11-19/h4-12,17-18,25,30,33H,13-16H2,1-3H3/t17-,18-,25+/m1/s1	AATIEZKZMFDISZ-GAKIBJFNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NS(=O)(=O)c4cccs4)cc3C1=O	BroadT	BRD-K71138333	BRD-K71138333-001-01-3	Broad Institute of MIT and Harvard	BRD-K71138333			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NS(=O)(=O)c3cccs3)cc2C1=O	InChI=1S/C27H31Cl2N3O5S2/c1-17-13-32(18(2)16-33)27(34)21-12-20(30-39(35,36)26-5-4-10-38-26)7-9-24(21)37-25(17)15-31(3)14-19-6-8-22(28)23(29)11-19/h4-12,17-18,25,30,33H,13-16H2,1-3H3/t17-,18-,25+/m1/s1	AATIEZKZMFDISZ-GAKIBJFNSA-N	611.108217922							113807
BRD-K54042694	LSM-25240		44496924	InChI=1S/C28H34N4O4/c1-18-16-32(19(2)17-33)27(34)14-21-13-22(11-12-25(21)36-26(18)15-29-3)30-28(35)31-24-10-6-8-20-7-4-5-9-23(20)24/h4-13,18-19,26,29,33H,14-17H2,1-3H3,(H2,30,31,35)/t18-,19+,26+/m0/s1	KOOMWTSRVMNQAA-GNBJCERTSA-N	CNC[C@H]1Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K54042694	BRD-K54042694-001-01-1	Broad Institute of MIT and Harvard	BRD-K54042694			CNC[C@H]1Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H34N4O4/c1-18-16-32(19(2)17-33)27(34)14-21-13-22(11-12-25(21)36-26(18)15-29-3)30-28(35)31-24-10-6-8-20-7-4-5-9-23(20)24/h4-13,18-19,26,29,33H,14-17H2,1-3H3,(H2,30,31,35)/t18-,19+,26+/m0/s1	KOOMWTSRVMNQAA-GNBJCERTSA-N	490.258005608							113808
BRD-K78015078	LSM-25241		44487210	InChI=1S/C34H45N5O5/c1-22-18-39(23(2)21-40)33(42)28-17-26(35-32(41)16-24-19-37(3)29-13-9-8-12-27(24)29)14-15-30(28)44-31(22)20-38(4)34(43)36-25-10-6-5-7-11-25/h8-9,12-15,17,19,22-23,25,31,40H,5-7,10-11,16,18,20-21H2,1-4H3,(H,35,41)(H,36,43)/t22-,23+,31-/m0/s1	ZSZRFUWYOKUGNE-LWPQGVMLSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Cc4cn(C)c5ccccc45)cc3C1=O	BroadT	BRD-K78015078	BRD-K78015078-001-01-5	Broad Institute of MIT and Harvard	BRD-K78015078			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Cc3cn(C)c4ccccc34)cc2C1=O	InChI=1S/C34H45N5O5/c1-22-18-39(23(2)21-40)33(42)28-17-26(35-32(41)16-24-19-37(3)29-13-9-8-12-27(24)29)14-15-30(28)44-31(22)20-38(4)34(43)36-25-10-6-5-7-11-25/h8-9,12-15,17,19,22-23,25,31,40H,5-7,10-11,16,18,20-21H2,1-4H3,(H,35,41)(H,36,43)/t22-,23+,31-/m0/s1	ZSZRFUWYOKUGNE-LWPQGVMLSA-N	603.34206959							113809
BRD-K31204557	LSM-25242		44490493	InChI=1S/C30H39N5O6/c1-18-14-35(19(2)17-36)29(37)25-13-23(31-30(38)32-28-20(3)33-41-21(28)4)9-12-26(25)40-27(18)16-34(5)15-22-7-10-24(39-6)11-8-22/h7-13,18-19,27,36H,14-17H2,1-6H3,(H2,31,32,38)/t18-,19+,27+/m0/s1	BCKUAPRXEALVIM-DSNGTPCMSA-N	COc1ccc(CN(C)C[C@H]2Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K31204557	BRD-K31204557-001-01-1	Broad Institute of MIT and Harvard	BRD-K31204557			COc1ccc(CN(C)C[C@H]2Oc3ccc(NC(=O)Nc4c(C)noc4C)cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C30H39N5O6/c1-18-14-35(19(2)17-36)29(37)25-13-23(31-30(38)32-28-20(3)33-41-21(28)4)9-12-26(25)40-27(18)16-34(5)15-22-7-10-24(39-6)11-8-22/h7-13,18-19,27,36H,14-17H2,1-6H3,(H2,31,32,38)/t18-,19+,27+/m0/s1	BCKUAPRXEALVIM-DSNGTPCMSA-N	565.290034018							113810
BRD-K76166595	LSM-25243		44491398	InChI=1S/C26H34F3N3O3/c1-17-13-32(18(2)16-33)25(34)21-7-6-8-22(30(3)4)24(21)35-23(17)15-31(5)14-19-9-11-20(12-10-19)26(27,28)29/h6-12,17-18,23,33H,13-16H2,1-5H3/t17-,18-,23-/m0/s1	UEVJVAFABFCLJH-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K76166595	BRD-K76166595-001-01-2	Broad Institute of MIT and Harvard	BRD-K76166595			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H34F3N3O3/c1-17-13-32(18(2)16-33)25(34)21-7-6-8-22(30(3)4)24(21)35-23(17)15-31(5)14-19-9-11-20(12-10-19)26(27,28)29/h6-12,17-18,23,33H,13-16H2,1-5H3/t17-,18-,23-/m0/s1	UEVJVAFABFCLJH-BSRJHKFKSA-N	493.255226578							113811
BRD-K90881556	LSM-25244		44488280	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)25-14-24(33-31(38)32-23-7-5-4-6-8-23)10-12-26(25)41-29(20)17-34(3)16-22-9-11-27-28(13-22)40-19-39-27/h9-14,20-21,23,29,36H,4-8,15-19H2,1-3H3,(H2,32,33,38)/t20-,21+,29+/m1/s1	WHPNVWBFVYVCKA-CGQTXMLISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)NC5CCCCC5)cc4C1=O	BroadT	BRD-K90881556	BRD-K90881556-001-01-5	Broad Institute of MIT and Harvard	BRD-K90881556			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)25-14-24(33-31(38)32-23-7-5-4-6-8-23)10-12-26(25)41-29(20)17-34(3)16-22-9-11-27-28(13-22)40-19-39-27/h9-14,20-21,23,29,36H,4-8,15-19H2,1-3H3,(H2,32,33,38)/t20-,21+,29+/m1/s1	WHPNVWBFVYVCKA-CGQTXMLISA-N	566.310435104							113812
BRD-K83238251	LSM-25245		44500148	InChI=1S/C22H31N3O5S2/c1-15-12-25(16(2)14-26)22(27)17-8-6-9-18(23(3)4)21(17)30-19(15)13-24(5)32(28,29)20-10-7-11-31-20/h6-11,15-16,19,26H,12-14H2,1-5H3/t15-,16-,19+/m0/s1	ITZNTWNJFRQWKT-TXPKVOOTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K83238251	BRD-K83238251-001-01-5	Broad Institute of MIT and Harvard	BRD-K83238251			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C22H31N3O5S2/c1-15-12-25(16(2)14-26)22(27)17-8-6-9-18(23(3)4)21(17)30-19(15)13-24(5)32(28,29)20-10-7-11-31-20/h6-11,15-16,19,26H,12-14H2,1-5H3/t15-,16-,19+/m0/s1	ITZNTWNJFRQWKT-TXPKVOOTSA-N	481.170512502							113813
BRD-K16746805	LSM-25246		44488507	InChI=1S/C31H43N3O4/c1-22-18-34(23(2)21-35)31(37)27-17-26(32-30(36)16-24-10-6-4-7-11-24)14-15-28(27)38-29(22)20-33(3)19-25-12-8-5-9-13-25/h4,6-7,10-11,14-15,17,22-23,25,29,35H,5,8-9,12-13,16,18-21H2,1-3H3,(H,32,36)/t22-,23-,29-/m0/s1	WNQBBBBVHQGMNA-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K16746805	BRD-K16746805-001-01-0	Broad Institute of MIT and Harvard	BRD-K16746805			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H43N3O4/c1-22-18-34(23(2)21-35)31(37)27-17-26(32-30(36)16-24-10-6-4-7-11-24)14-15-28(27)38-29(22)20-33(3)19-25-12-8-5-9-13-25/h4,6-7,10-11,14-15,17,22-23,25,29,35H,5,8-9,12-13,16,18-21H2,1-3H3,(H,32,36)/t22-,23-,29-/m0/s1	WNQBBBBVHQGMNA-BOSRLCDASA-N	521.325356886							113814
BRD-K48147099	LSM-25247		44488332	InChI=1S/C30H35N3O7S/c1-20-15-33(21(2)18-34)30(35)25-14-23(31-41(36,37)24-7-5-4-6-8-24)10-12-26(25)40-29(20)17-32(3)16-22-9-11-27-28(13-22)39-19-38-27/h4-14,20-21,29,31,34H,15-19H2,1-3H3/t20-,21+,29+/m1/s1	YPROYXXRHQGNKF-CGQTXMLISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NS(=O)(=O)c5ccccc5)cc4C1=O	BroadT	BRD-K48147099	BRD-K48147099-001-01-8	Broad Institute of MIT and Harvard	BRD-K48147099			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H35N3O7S/c1-20-15-33(21(2)18-34)30(35)25-14-23(31-41(36,37)24-7-5-4-6-8-24)10-12-26(25)40-29(20)17-32(3)16-22-9-11-27-28(13-22)39-19-38-27/h4-14,20-21,29,31,34H,15-19H2,1-3H3/t20-,21+,29+/m1/s1	YPROYXXRHQGNKF-CGQTXMLISA-N	581.21957118							113815
CHEMBL2131045	LSM-25248	BRD-K85112460, SID87540276	44617075	InChI=1S/C36H40N4O4/c1-25-21-40(26(2)24-41)35(42)20-31-19-32(38-36(43)30-15-17-37-18-16-30)13-14-33(31)44-34(25)23-39(3)22-27-9-11-29(12-10-27)28-7-5-4-6-8-28/h4-19,25-26,34,41H,20-24H2,1-3H3,(H,38,43)/t25-,26+,34+/m1/s1	IQSVNIDGIMJPQN-BCIXQDHQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)Oc4ccc(NC(=O)c5ccncc5)cc4CC1=O	BroadT	BRD-K85112460	BRD-K85112460-001-01-7	Broad Institute of MIT and Harvard	BRD-K85112460			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O	InChI=1S/C36H40N4O4/c1-25-21-40(26(2)24-41)35(42)20-31-19-32(38-36(43)30-15-17-37-18-16-30)13-14-33(31)44-34(25)23-39(3)22-27-9-11-29(12-10-27)28-7-5-4-6-8-28/h4-19,25-26,34,41H,20-24H2,1-3H3,(H,38,43)/t25-,26+,34+/m1/s1	IQSVNIDGIMJPQN-BCIXQDHQSA-N	592.3049558							113816
BRD-K63102090	LSM-25249		44500163	InChI=1S/C24H32N4O4/c1-16-13-28(17(2)15-29)23(30)19-11-8-12-20(22(19)32-21(16)14-27(3)4)26-24(31)25-18-9-6-5-7-10-18/h5-12,16-17,21,29H,13-15H2,1-4H3,(H2,25,26,31)/t16-,17-,21-/m0/s1	SSJJWSMGDNAKCS-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	BroadT	BRD-K63102090	BRD-K63102090-001-01-2	Broad Institute of MIT and Harvard	BRD-K63102090			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O	InChI=1S/C24H32N4O4/c1-16-13-28(17(2)15-29)23(30)19-11-8-12-20(22(19)32-21(16)14-27(3)4)26-24(31)25-18-9-6-5-7-10-18/h5-12,16-17,21,29H,13-15H2,1-4H3,(H2,25,26,31)/t16-,17-,21-/m0/s1	SSJJWSMGDNAKCS-FIKGOQFSSA-N	440.242355544							113817
BRD-K84090286	LSM-25250		44494846	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)30-22-13-9-12-21-24(22)37-23(18(3)14-32(25(21)34)19(4)16-33)15-31(5)27(36)29-20-10-7-6-8-11-20/h6-13,17-19,23,33H,14-16H2,1-5H3,(H,29,36)(H2,28,30,35)/t18-,19-,23-/m0/s1	FNAJZGJPYUNJBY-YDHSSHFGSA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@H](C)[C@H](CN(C)C(=O)Nc3ccccc3)Oc12)[C@@H](C)CO	BroadT	BRD-K84090286	BRD-K84090286-001-01-8	Broad Institute of MIT and Harvard	BRD-K84090286			CC(C)NC(=O)Nc1cccc2C(=O)N([C@@H](C)CO)C[C@H](C)[C@H](CN(C)C(=O)Nc3ccccc3)Oc12	InChI=1S/C27H37N5O5/c1-17(2)28-26(35)30-22-13-9-12-21-24(22)37-23(18(3)14-32(25(21)34)19(4)16-33)15-31(5)27(36)29-20-10-7-6-8-11-20/h6-13,17-19,23,33H,14-16H2,1-5H3,(H,29,36)(H2,28,30,35)/t18-,19-,23-/m0/s1	FNAJZGJPYUNJBY-YDHSSHFGSA-N	511.279469334							113818
BRD-K48113109	LSM-25251		44484731	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)28-18-26(35-33(42)37-29-15-9-11-24-10-7-8-14-27(24)29)16-17-30(28)44-31(22)20-38(3)34(43)36-25-12-5-4-6-13-25/h7-11,14-18,22-23,25,31,40H,4-6,12-13,19-21H2,1-3H3,(H,36,43)(H2,35,37,42)/t22-,23-,31+/m0/s1	QXYCJPXUIIEYFH-WDCWYOMISA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ccc(NC(=O)Nc4cccc5ccccc45)cc3C1=O	BroadT	BRD-K48113109	BRD-K48113109-001-01-8	Broad Institute of MIT and Harvard	BRD-K48113109			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)28-18-26(35-33(42)37-29-15-9-11-24-10-7-8-14-27(24)29)16-17-30(28)44-31(22)20-38(3)34(43)36-25-12-5-4-6-13-25/h7-11,14-18,22-23,25,31,40H,4-6,12-13,19-21H2,1-3H3,(H,36,43)(H2,35,37,42)/t22-,23-,31+/m0/s1	QXYCJPXUIIEYFH-WDCWYOMISA-N	601.326419526							113819
BRD-K05704547	LSM-25252		44618222	InChI=1S/C29H38F3N3O5/c1-19-15-35(20(2)18-36)28(38)14-22-13-23(33-27(37)11-12-29(30,31)32)7-10-25(22)40-26(19)17-34(3)16-21-5-8-24(39-4)9-6-21/h5-10,13,19-20,26,36H,11-12,14-18H2,1-4H3,(H,33,37)/t19-,20+,26+/m1/s1	IUJLOVQYFFXLDN-GOHWNWGWSA-N	COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K05704547	BRD-K05704547-001-01-5	Broad Institute of MIT and Harvard	BRD-K05704547			COc1ccc(CN(C)C[C@@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C29H38F3N3O5/c1-19-15-35(20(2)18-36)28(38)14-22-13-23(33-27(37)11-12-29(30,31)32)7-10-25(22)40-26(19)17-34(3)16-21-5-8-24(39-4)9-6-21/h5-10,13,19-20,26,36H,11-12,14-18H2,1-4H3,(H,33,37)/t19-,20+,26+/m1/s1	IUJLOVQYFFXLDN-GOHWNWGWSA-N	565.276355946							113820
BRD-K66577743	LSM-25253		44491690	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)29-21-9-12-24-23(13-21)26(33)31(20(5)16-32)14-19(4)25(37-24)15-30(6)38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,32H,14-16H2,1-6H3,(H2,28,29,34)/t19-,20-,25+/m0/s1	PKTRFCGFRBZOLH-ZYLNGJIFSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)S(=O)(=O)c3ccc(C)cc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K66577743	BRD-K66577743-001-01-3	Broad Institute of MIT and Harvard	BRD-K66577743			CC(C)NC(=O)Nc1ccc2O[C@H](CN(C)S(=O)(=O)c3ccc(C)cc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H38N4O6S/c1-17(2)28-27(34)29-21-9-12-24-23(13-21)26(33)31(20(5)16-32)14-19(4)25(37-24)15-30(6)38(35,36)22-10-7-18(3)8-11-22/h7-13,17,19-20,25,32H,14-16H2,1-6H3,(H2,28,29,34)/t19-,20-,25+/m0/s1	PKTRFCGFRBZOLH-ZYLNGJIFSA-N	546.251205666							113821
BRD-K25187028	LSM-25254		44495749	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)24-10-7-11-25(33-31(38)32-23-8-5-4-6-9-23)29(24)41-28(20)17-34(3)16-22-12-13-26-27(14-22)40-19-39-26/h7,10-14,20-21,23,28,36H,4-6,8-9,15-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28+/m0/s1	QXBUWZYZXJXLTK-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)NC5CCCCC5)cccc4C1=O	BroadT	BRD-K25187028	BRD-K25187028-001-01-7	Broad Institute of MIT and Harvard	BRD-K25187028			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)24-10-7-11-25(33-31(38)32-23-8-5-4-6-9-23)29(24)41-28(20)17-34(3)16-22-12-13-26-27(14-22)40-19-39-26/h7,10-14,20-21,23,28,36H,4-6,8-9,15-19H2,1-3H3,(H2,32,33,38)/t20-,21-,28+/m0/s1	QXBUWZYZXJXLTK-YHGPEZAFSA-N	566.310435104							113822
BRD-K63111122	LSM-25255		44498708	InChI=1S/C29H36N4O5S/c1-20-8-10-24(11-9-20)39(36,37)31-26-7-5-6-25-28(26)38-27(18-32(4)17-23-12-14-30-15-13-23)21(2)16-33(29(25)35)22(3)19-34/h5-15,21-22,27,31,34H,16-19H2,1-4H3/t21-,22+,27+/m0/s1	JBHIQUJYWNKFSD-OREGWCPLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3c(NS(=O)(=O)c4ccc(C)cc4)cccc3C1=O	BroadT	BRD-K63111122	BRD-K63111122-001-01-5	Broad Institute of MIT and Harvard	BRD-K63111122			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2c(NS(=O)(=O)c3ccc(C)cc3)cccc2C1=O	InChI=1S/C29H36N4O5S/c1-20-8-10-24(11-9-20)39(36,37)31-26-7-5-6-25-28(26)38-27(18-32(4)17-23-12-14-30-15-13-23)21(2)16-33(29(25)35)22(3)19-34/h5-15,21-22,27,31,34H,16-19H2,1-4H3/t21-,22+,27+/m0/s1	JBHIQUJYWNKFSD-OREGWCPLSA-N	552.240640982							113823
BRD-K16044155	LSM-25256		44486115	InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)24-15-22(31(3)4)13-14-26(24)37-27(19)17-32(5)29(36)30-25-12-8-10-21-9-6-7-11-23(21)25/h6-15,19-20,27,34H,16-18H2,1-5H3,(H,30,36)/t19-,20-,27-/m0/s1	FZIWMBCZXHBNOC-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K16044155	BRD-K16044155-001-01-6	Broad Institute of MIT and Harvard	BRD-K16044155			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)24-15-22(31(3)4)13-14-26(24)37-27(19)17-32(5)29(36)30-25-12-8-10-21-9-6-7-11-23(21)25/h6-15,19-20,27,34H,16-18H2,1-5H3,(H,30,36)/t19-,20-,27-/m0/s1	FZIWMBCZXHBNOC-OSOCVKALSA-N	504.273655672							113824
BRD-K68512873	LSM-25257		44495640	InChI=1S/C28H39N5O6/c1-17(2)29-28(37)32(5)15-24-18(3)14-33(19(4)16-34)26(35)22-8-7-9-23(25(22)39-24)31-27(36)30-20-10-12-21(38-6)13-11-20/h7-13,17-19,24,34H,14-16H2,1-6H3,(H,29,37)(H2,30,31,36)/t18-,19-,24+/m1/s1	IBFNJHBZCKBINA-IECBHUPTSA-N	COc1ccc(NC(=O)Nc2cccc3C(=O)N(C[C@@H](C)[C@H](CN(C)C(=O)NC(C)C)Oc23)[C@H](C)CO)cc1	BroadT	BRD-K68512873	BRD-K68512873-001-01-0	Broad Institute of MIT and Harvard	BRD-K68512873			COc1ccc(NC(=O)Nc2cccc3c2O[C@@H](CN(C)C(=O)NC(C)C)[C@H](C)CN([C@H](C)CO)C3=O)cc1	InChI=1S/C28H39N5O6/c1-17(2)29-28(37)32(5)15-24-18(3)14-33(19(4)16-34)26(35)22-8-7-9-23(25(22)39-24)31-27(36)30-20-10-12-21(38-6)13-11-20/h7-13,17-19,24,34H,14-16H2,1-6H3,(H,29,37)(H2,30,31,36)/t18-,19-,24+/m1/s1	IBFNJHBZCKBINA-IECBHUPTSA-N	541.290034018							113825
BRD-K23166347	LSM-25258		44484957	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)25-14-24(33-31(38)32-23-7-5-4-6-8-23)10-12-26(25)41-29(20)17-34(3)16-22-9-11-27-28(13-22)40-19-39-27/h9-14,20-21,23,29,36H,4-8,15-19H2,1-3H3,(H2,32,33,38)/t20-,21-,29-/m1/s1	WHPNVWBFVYVCKA-GVNDJSPXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)NC5CCCCC5)cc4C1=O	BroadT	BRD-K23166347	BRD-K23166347-001-01-7	Broad Institute of MIT and Harvard	BRD-K23166347			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)25-14-24(33-31(38)32-23-7-5-4-6-8-23)10-12-26(25)41-29(20)17-34(3)16-22-9-11-27-28(13-22)40-19-39-27/h9-14,20-21,23,29,36H,4-8,15-19H2,1-3H3,(H2,32,33,38)/t20-,21-,29-/m1/s1	WHPNVWBFVYVCKA-GVNDJSPXSA-N	566.310435104							113826
BRD-K08389897	LSM-25259		44500070	InChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21-,26+/m0/s1	QPEXUVZRKHXLPB-ISJBWFOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)C4CCOCC4)cccc3C1=O	BroadT	BRD-K08389897	BRD-K08389897-001-01-8	Broad Institute of MIT and Harvard	BRD-K08389897			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O	InChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21-,26+/m0/s1	QPEXUVZRKHXLPB-ISJBWFOZSA-N	515.33592157							113827
MLS002474207	LSM-25260	BRD-K63093217, SID85201766	44202848	InChI=1S/C31H39F3N4O5/c1-19-16-38(20(2)18-39)29(41)25-15-24(35-28(40)21-7-5-4-6-8-21)13-14-26(25)43-27(19)17-37(3)30(42)36-23-11-9-22(10-12-23)31(32,33)34/h9-15,19-21,27,39H,4-8,16-18H2,1-3H3,(H,35,40)(H,36,42)/t19-,20+,27+/m0/s1	AZWNSNCWAAAZSD-ASHZAFPQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K63093217	BRD-K63093217-001-02-9	Broad Institute of MIT and Harvard	BRD-K63093217			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C31H39F3N4O5/c1-19-16-38(20(2)18-39)29(41)25-15-24(35-28(40)21-7-5-4-6-8-21)13-14-26(25)43-27(19)17-37(3)30(42)36-23-11-9-22(10-12-23)31(32,33)34/h9-15,19-21,27,39H,4-8,16-18H2,1-3H3,(H,35,40)(H,36,42)/t19-,20+,27+/m0/s1	AZWNSNCWAAAZSD-ASHZAFPQSA-N	604.287254988							113828
BRD-K80546581	LSM-25261		44617697	InChI=1S/C31H36FN3O7S/c1-20-15-35(21(2)18-36)31(37)14-23-13-25(33-43(38,39)26-8-5-24(32)6-9-26)7-11-27(23)42-30(20)17-34(3)16-22-4-10-28-29(12-22)41-19-40-28/h4-13,20-21,30,33,36H,14-19H2,1-3H3/t20-,21+,30+/m0/s1	ZVLYFKSMWJQSMB-KSWJDTNCSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc4CC1=O	BroadT	BRD-K80546581	BRD-K80546581-001-01-5	Broad Institute of MIT and Harvard	BRD-K80546581			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2CC1=O	InChI=1S/C31H36FN3O7S/c1-20-15-35(21(2)18-36)31(37)14-23-13-25(33-43(38,39)26-8-5-24(32)6-9-26)7-11-27(23)42-30(20)17-34(3)16-22-4-10-28-29(12-22)41-19-40-28/h4-13,20-21,30,33,36H,14-19H2,1-3H3/t20-,21+,30+/m0/s1	ZVLYFKSMWJQSMB-KSWJDTNCSA-N	613.225799412							113829
CHEMBL2144909	LSM-25262	BRD-K72050003, SID85802532	44495684	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)27-12-9-13-28(32(3)4)30(27)38-29(22)20-33(5)19-24-14-16-26(17-15-24)37-25-10-7-6-8-11-25/h6-17,22-23,29,35H,18-21H2,1-5H3/t22-,23-,29+/m1/s1	KBWKSVZPOQKHGN-SGQNLQFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4c(cccc4C1=O)N(C)C	BroadT	BRD-K72050003	BRD-K72050003-001-01-8	Broad Institute of MIT and Harvard	BRD-K72050003			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C31H39N3O4/c1-22-18-34(23(2)21-35)31(36)27-12-9-13-28(32(3)4)30(27)38-29(22)20-33(5)19-24-14-16-26(17-15-24)37-25-10-7-6-8-11-25/h6-17,22-23,29,35H,18-21H2,1-5H3/t22-,23-,29+/m1/s1	KBWKSVZPOQKHGN-SGQNLQFHSA-N	517.294056758							113830
BRD-K94751306	LSM-25263		44490653	InChI=1S/C35H38N4O5/c1-24-20-39(25(2)23-40)35(42)31-19-28(37-34(41)27-15-17-36-18-16-27)11-14-32(31)44-33(24)22-38(3)21-26-9-12-30(13-10-26)43-29-7-5-4-6-8-29/h4-19,24-25,33,40H,20-23H2,1-3H3,(H,37,41)/t24-,25+,33-/m1/s1	NYKHOXZKFLRULB-RNDKRWLGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(NC(=O)c5ccncc5)cc4C1=O	BroadT	BRD-K94751306	BRD-K94751306-001-01-9	Broad Institute of MIT and Harvard	BRD-K94751306			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H38N4O5/c1-24-20-39(25(2)23-40)35(42)31-19-28(37-34(41)27-15-17-36-18-16-27)11-14-32(31)44-33(24)22-38(3)21-26-9-12-30(13-10-26)43-29-7-5-4-6-8-29/h4-19,24-25,33,40H,20-23H2,1-3H3,(H,37,41)/t24-,25+,33-/m1/s1	NYKHOXZKFLRULB-RNDKRWLGSA-N	594.284220356							113831
CHEMBL2354734	LSM-25264	SID85790127, BRD-K04272258	44483721	InChI=1S/C26H34F3N3O3/c1-17-13-32(18(2)16-33)25(34)21-7-6-8-22(30(3)4)24(21)35-23(17)15-31(5)14-19-9-11-20(12-10-19)26(27,28)29/h6-12,17-18,23,33H,13-16H2,1-5H3/t17-,18+,23+/m0/s1	UEVJVAFABFCLJH-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K04272258	BRD-K04272258-001-01-3	Broad Institute of MIT and Harvard	BRD-K04272258			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C26H34F3N3O3/c1-17-13-32(18(2)16-33)25(34)21-7-6-8-22(30(3)4)24(21)35-23(17)15-31(5)14-19-9-11-20(12-10-19)26(27,28)29/h6-12,17-18,23,33H,13-16H2,1-5H3/t17-,18+,23+/m0/s1	UEVJVAFABFCLJH-YZZKKUAISA-N	493.255226578							113832
BRD-K98020844	LSM-25265		44495111	InChI=1S/C32H37FN4O6/c1-20-16-37(21(2)19-38)30(39)15-24-14-27(35-32(42)34-26-10-8-25(33)9-11-26)12-13-28(24)43-29(20)18-36(3)17-22-4-6-23(7-5-22)31(40)41/h4-14,20-21,29,38H,15-19H2,1-3H3,(H,40,41)(H2,34,35,42)/t20-,21+,29+/m1/s1	KTBFUFCVUDUHMK-CGQTXMLISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc3CC1=O	BroadT	BRD-K98020844	BRD-K98020844-001-01-4	Broad Institute of MIT and Harvard	BRD-K98020844			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2CC1=O	InChI=1S/C32H37FN4O6/c1-20-16-37(21(2)19-38)30(39)15-24-14-27(35-32(42)34-26-10-8-25(33)9-11-26)12-13-28(24)43-29(20)18-36(3)17-22-4-6-23(7-5-22)31(40)41/h4-14,20-21,29,38H,15-19H2,1-3H3,(H,40,41)(H2,34,35,42)/t20-,21+,29+/m1/s1	KTBFUFCVUDUHMK-CGQTXMLISA-N	592.269713144							113833
BRD-K18031793	LSM-25266		44485149	InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18+,22+/m0/s1	QKNVOCCOOAXREN-NJNPRVFISA-N	CNC[C@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K18031793	BRD-K18031793-001-01-9	Broad Institute of MIT and Harvard	BRD-K18031793			CNC[C@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18+,22+/m0/s1	QKNVOCCOOAXREN-NJNPRVFISA-N	462.284220356							113834
BRD-K89992188	LSM-25267		44484163	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16+,20-/m1/s1	GIKJWVQVMSIYNX-GQIGUUNPSA-N	CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K89992188	BRD-K89992188-001-01-9	Broad Institute of MIT and Harvard	BRD-K89992188			CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C22H36N4O4/c1-14(2)23-22(29)25(7)12-20-15(3)11-26(16(4)13-27)21(28)18-10-17(24(5)6)8-9-19(18)30-20/h8-10,14-16,20,27H,11-13H2,1-7H3,(H,23,29)/t15-,16+,20-/m1/s1	GIKJWVQVMSIYNX-GQIGUUNPSA-N	420.273655672							113835
BRD-K28039328	LSM-25268		44490834	InChI=1S/C18H29N3O5S/c1-12-9-21(13(2)11-22)18(23)14-7-6-8-15(19-27(5,24)25)17(14)26-16(12)10-20(3)4/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13-,16-/m0/s1	NGOQGDZIZPAXSN-XEZPLFJOSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2c(NS(=O)(=O)C)cccc2C1=O	BroadT	BRD-K28039328	BRD-K28039328-001-01-4	Broad Institute of MIT and Harvard	BRD-K28039328			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2c(NS(C)(=O)=O)cccc2C1=O	InChI=1S/C18H29N3O5S/c1-12-9-21(13(2)11-22)18(23)14-7-6-8-15(19-27(5,24)25)17(14)26-16(12)10-20(3)4/h6-8,12-13,16,19,22H,9-11H2,1-5H3/t12-,13-,16-/m0/s1	NGOQGDZIZPAXSN-XEZPLFJOSA-N	399.182791748							113836
CHEMBL2358645	LSM-25269	BRD-K18533510, SID85793754	44487279	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)24-13-23(30-29(37)31-27-20(3)32-39-21(27)4)11-12-25(24)38-26(18)16-33(5)15-22-9-7-6-8-10-22/h11-13,18-19,22,26,35H,6-10,14-17H2,1-5H3,(H2,30,31,37)/t18-,19-,26-/m0/s1	GCOOUUHDYUHFBZ-DGUDUIIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)Nc4c(C)onc4C)cc3C1=O	BroadT	BRD-K18533510	BRD-K18533510-001-01-6	Broad Institute of MIT and Harvard	BRD-K18533510			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H43N5O5/c1-18-14-34(19(2)17-35)28(36)24-13-23(30-29(37)31-27-20(3)32-39-21(27)4)11-12-25(24)38-26(18)16-33(5)15-22-9-7-6-8-10-22/h11-13,18-19,22,26,35H,6-10,14-17H2,1-5H3,(H2,30,31,37)/t18-,19-,26-/m0/s1	GCOOUUHDYUHFBZ-DGUDUIIESA-N	541.326419526							113837
BRD-K86925685	LSM-25270		44491542	InChI=1S/C26H36N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h6-13,18-19,24,31H,14-17H2,1-5H3,(H,27,33)/t18-,19+,24+/m0/s1	QJWSWWKQIHLYJD-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K86925685	BRD-K86925685-001-01-0	Broad Institute of MIT and Harvard	BRD-K86925685			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C26H36N4O4/c1-18-15-30(19(2)17-31)25(32)14-20-13-22(28(3)4)11-12-23(20)34-24(18)16-29(5)26(33)27-21-9-7-6-8-10-21/h6-13,18-19,24,31H,14-17H2,1-5H3,(H,27,33)/t18-,19+,24+/m0/s1	QJWSWWKQIHLYJD-XLNZFTOWSA-N	468.273655672							113838
CHEMBL2141519	LSM-25271	BRD-K13873561, SID131408745	54613791	InChI=1S/C28H35Cl2N5O5S/c1-18-12-35(19(2)16-36)28(37)11-21-10-22(32-41(38,39)27-15-34(4)17-31-27)6-8-25(21)40-26(18)14-33(3)13-20-5-7-23(29)24(30)9-20/h5-10,15,17-19,26,32,36H,11-14,16H2,1-4H3/t18-,19+,26+/m0/s1	VWQPHETXZDMYNJ-GNBJCERTSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NS(=O)(=O)c4cn(C)cn4)cc3CC1=O	BroadT	BRD-K13873561	BRD-K13873561-001-01-9	Broad Institute of MIT and Harvard	BRD-K13873561			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2CC1=O	InChI=1S/C28H35Cl2N5O5S/c1-18-12-35(19(2)16-36)28(37)11-21-10-22(32-41(38,39)27-15-34(4)17-31-27)6-8-25(21)40-26(18)14-33(3)13-20-5-7-23(29)24(30)9-20/h5-10,15,17-19,26,32,36H,11-14,16H2,1-4H3/t18-,19+,26+/m0/s1	VWQPHETXZDMYNJ-GNBJCERTSA-N	623.17359538							113839
BRD-K93223696	LSM-25272		44487944	InChI=1S/C19H31N3O3/c1-13-10-22(14(2)12-23)19(24)16-9-15(21(5)6)7-8-17(16)25-18(13)11-20(3)4/h7-9,13-14,18,23H,10-12H2,1-6H3/t13-,14-,18+/m0/s1	WTLSFXRNHZPOMH-SUNYJGFJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K93223696	BRD-K93223696-001-01-8	Broad Institute of MIT and Harvard	BRD-K93223696			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C19H31N3O3/c1-13-10-22(14(2)12-23)19(24)16-9-15(21(5)6)7-8-17(16)25-18(13)11-20(3)4/h7-9,13-14,18,23H,10-12H2,1-6H3/t13-,14-,18+/m0/s1	WTLSFXRNHZPOMH-SUNYJGFJSA-N	349.236541882							113840
BRD-K92241728	LSM-25273		44484854	InChI=1S/C28H36F3N5O5/c1-16(2)32-27(40)35(5)14-24-17(3)13-36(18(4)15-37)25(38)22-12-21(10-11-23(22)41-24)34-26(39)33-20-8-6-19(7-9-20)28(29,30)31/h6-12,16-18,24,37H,13-15H2,1-5H3,(H,32,40)(H2,33,34,39)/t17-,18-,24-/m0/s1	GUUFQQDCAZBWHX-XFAGBWLFSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K92241728	BRD-K92241728-001-01-3	Broad Institute of MIT and Harvard	BRD-K92241728			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H36F3N5O5/c1-16(2)32-27(40)35(5)14-24-17(3)13-36(18(4)15-37)25(38)22-12-21(10-11-23(22)41-24)34-26(39)33-20-8-6-19(7-9-20)28(29,30)31/h6-12,16-18,24,37H,13-15H2,1-5H3,(H,32,40)(H2,33,34,39)/t17-,18-,24-/m0/s1	GUUFQQDCAZBWHX-XFAGBWLFSA-N	579.266853902							113841
BRD-K84514454	LSM-25274		44495611	InChI=1S/C25H35N3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(6)15-23-18(2)14-28(19(3)16-29)25(30)21-8-7-9-22(26(4)5)24(21)33-23/h7-13,18-19,23,29H,14-16H2,1-6H3/t18-,19+,23+/m1/s1	ANXKOFDVDMSSFK-MSYCTHLASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K84514454	BRD-K84514454-001-01-3	Broad Institute of MIT and Harvard	BRD-K84514454			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C25H35N3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(6)15-23-18(2)14-28(19(3)16-29)25(30)21-8-7-9-22(26(4)5)24(21)33-23/h7-13,18-19,23,29H,14-16H2,1-6H3/t18-,19+,23+/m1/s1	ANXKOFDVDMSSFK-MSYCTHLASA-N	489.22974194							113842
BRD-K99074976	LSM-25275		44492140	InChI=1S/C30H34ClN3O6S/c1-20-17-34(21(2)19-35)30(37)26-16-24(32-29(36)15-22-7-5-4-6-8-22)11-14-27(26)40-28(20)18-33(3)41(38,39)25-12-9-23(31)10-13-25/h4-14,16,20-21,28,35H,15,17-19H2,1-3H3,(H,32,36)/t20-,21+,28+/m0/s1	OPYKWGJVQMREOT-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K99074976	BRD-K99074976-001-01-0	Broad Institute of MIT and Harvard	BRD-K99074976			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C30H34ClN3O6S/c1-20-17-34(21(2)19-35)30(37)26-16-24(32-29(36)15-22-7-5-4-6-8-22)11-14-27(26)40-28(20)18-33(3)41(38,39)25-12-9-23(31)10-13-25/h4-14,16,20-21,28,35H,15,17-19H2,1-3H3,(H,32,36)/t20-,21+,28+/m0/s1	OPYKWGJVQMREOT-BALWLHIASA-N	599.185684238							113843
BRD-K44224150	LSM-25276		44487330	InChI=1S/C23H35N3O4/c1-15-13-26(16(2)14-27)23(29)19-11-18(9-10-20(19)30-21(15)12-24-3)25-22(28)17-7-5-4-6-8-17/h9-11,15-17,21,24,27H,4-8,12-14H2,1-3H3,(H,25,28)/t15-,16-,21-/m0/s1	NQJCYDIBEOZMBZ-QYWGDWMGSA-N	CNC[C@@H]1Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K44224150	BRD-K44224150-001-01-5	Broad Institute of MIT and Harvard	BRD-K44224150			CNC[C@@H]1Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H35N3O4/c1-15-13-26(16(2)14-27)23(29)19-11-18(9-10-20(19)30-21(15)12-24-3)25-22(28)17-7-5-4-6-8-17/h9-11,15-17,21,24,27H,4-8,12-14H2,1-3H3,(H,25,28)/t15-,16-,21-/m0/s1	NQJCYDIBEOZMBZ-QYWGDWMGSA-N	417.26275663							113844
BRD-K98271666	LSM-25277		44495573	InChI=1S/C23H35N5O5S/c1-16-11-28(17(2)14-29)23(30)10-18-9-19(25(3)4)7-8-20(18)33-21(16)12-27(6)34(31,32)22-13-26(5)15-24-22/h7-9,13,15-17,21,29H,10-12,14H2,1-6H3/t16-,17+,21+/m1/s1	XKGXVARXDYWWSM-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ccc(cc3CC1=O)N(C)C	BroadT	BRD-K98271666	BRD-K98271666-001-01-8	Broad Institute of MIT and Harvard	BRD-K98271666			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ccc(cc2CC1=O)N(C)C	InChI=1S/C23H35N5O5S/c1-16-11-28(17(2)14-29)23(30)10-18-9-19(25(3)4)7-8-20(18)33-21(16)12-27(6)34(31,32)22-13-26(5)15-24-22/h7-9,13,15-17,21,29H,10-12,14H2,1-6H3/t16-,17+,21+/m1/s1	XKGXVARXDYWWSM-WWMYMODYSA-N	493.23588996							113845
BRD-K06208179	LSM-25278		44488343	InChI=1S/C23H30N4O6S/c1-15-12-27(16(2)14-28)23(30)19-11-18(25-22(29)17-7-9-24-10-8-17)5-6-20(19)33-21(15)13-26(3)34(4,31)32/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21+/m1/s1	WMAXTMTUHGJOAC-ZOCZFRKYSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K06208179	BRD-K06208179-001-01-1	Broad Institute of MIT and Harvard	BRD-K06208179			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C23H30N4O6S/c1-15-12-27(16(2)14-28)23(30)19-11-18(25-22(29)17-7-9-24-10-8-17)5-6-20(19)33-21(15)13-26(3)34(4,31)32/h5-11,15-16,21,28H,12-14H2,1-4H3,(H,25,29)/t15-,16-,21+/m1/s1	WMAXTMTUHGJOAC-ZOCZFRKYSA-N	490.18860541							113846
BRD-K18763924	LSM-25279		44483495	InChI=1S/C28H34F3N3O6/c1-17-12-34(18(2)15-35)27(37)21-11-20(32-26(36)8-9-28(29,30)31)5-7-22(21)40-25(17)14-33(3)13-19-4-6-23-24(10-19)39-16-38-23/h4-7,10-11,17-18,25,35H,8-9,12-16H2,1-3H3,(H,32,36)/t17-,18-,25+/m0/s1	IMDFAXAHWGRKQV-DPOKWSEZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCC(F)(F)F)cc4C1=O	BroadT	BRD-K18763924	BRD-K18763924-001-01-9	Broad Institute of MIT and Harvard	BRD-K18763924			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C28H34F3N3O6/c1-17-12-34(18(2)15-35)27(37)21-11-20(32-26(36)8-9-28(29,30)31)5-7-22(21)40-25(17)14-33(3)13-19-4-6-23-24(10-19)39-16-38-23/h4-7,10-11,17-18,25,35H,8-9,12-16H2,1-3H3,(H,32,36)/t17-,18-,25+/m0/s1	IMDFAXAHWGRKQV-DPOKWSEZSA-N	565.239970438							113847
BRD-K89397494	LSM-25280		44617326	InChI=1S/C32H44N4O7/c1-22-17-36(23(2)20-37)32(39)16-25-15-26(33-31(38)8-9-35-10-12-40-13-11-35)5-7-27(25)43-30(22)19-34(3)18-24-4-6-28-29(14-24)42-21-41-28/h4-7,14-15,22-23,30,37H,8-13,16-21H2,1-3H3,(H,33,38)/t22-,23+,30+/m0/s1	NYPOLWMMHTZHKU-DDFCPOBKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCN5CCOCC5)cc4CC1=O	BroadT	BRD-K89397494	BRD-K89397494-001-01-0	Broad Institute of MIT and Harvard	BRD-K89397494			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC1=O	InChI=1S/C32H44N4O7/c1-22-17-36(23(2)20-37)32(39)16-25-15-26(33-31(38)8-9-35-10-12-40-13-11-35)5-7-27(25)43-30(22)19-34(3)18-24-4-6-28-29(14-24)42-21-41-28/h4-7,14-15,22-23,30,37H,8-13,16-21H2,1-3H3,(H,33,38)/t22-,23+,30+/m0/s1	NYPOLWMMHTZHKU-DDFCPOBKSA-N	596.320999788							113848
BRD-K53971345-001-01-5	LSM-25281	BRD-K53971345	44486023	InChI=1S/C19H31N3O3/c1-13-10-22(14(2)12-23)19(24)16-9-15(21(5)6)7-8-17(16)25-18(13)11-20(3)4/h7-9,13-14,18,23H,10-12H2,1-6H3/t13-,14+,18-/m0/s1	WTLSFXRNHZPOMH-IYOUNJFTSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K53971345	BRD-K53971345-001-01-5	Broad Institute of MIT and Harvard	BRD-K53971345			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C19H31N3O3/c1-13-10-22(14(2)12-23)19(24)16-9-15(21(5)6)7-8-17(16)25-18(13)11-20(3)4/h7-9,13-14,18,23H,10-12H2,1-6H3/t13-,14+,18-/m0/s1	WTLSFXRNHZPOMH-IYOUNJFTSA-N	349.236541882							113849
CHEMBL3183436	LSM-15092	BRD-K01737880	44484893	InChI=1S/C32H38N4O7/c1-20-15-36(21(2)18-37)31(38)26-14-24(34-32(39)33-23-6-9-25(40-4)10-7-23)8-12-27(26)43-30(20)17-35(3)16-22-5-11-28-29(13-22)42-19-41-28/h5-14,20-21,30,37H,15-19H2,1-4H3,(H2,33,34,39)/t20-,21-,30-/m0/s1	NGRSXEMLDRQNMH-LPBFERMMSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H](CN(C)Cc4ccc5OCOc5c4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K01737880	BRD-K01737880-001-01-4	Broad Institute of MIT and Harvard	BRD-K01737880			COc1ccc(NC(=O)Nc2ccc3O[C@@H](CN(C)Cc4ccc5OCOc5c4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C32H38N4O7/c1-20-15-36(21(2)18-37)31(38)26-14-24(34-32(39)33-23-6-9-25(40-4)10-7-23)8-12-27(26)43-30(20)17-35(3)16-22-5-11-28-29(13-22)42-19-41-28/h5-14,20-21,30,37H,15-19H2,1-4H3,(H2,33,34,39)/t20-,21-,30-/m0/s1	NGRSXEMLDRQNMH-LPBFERMMSA-N	590.274049596							103748
BRD-K28349636	LSM-25282		44489428	InChI=1S/C28H35F3N4O6/c1-17-14-35(18(2)16-36)26(38)22-13-20(32-25(37)11-12-28(29,30)31)7-10-23(22)41-24(17)15-34(3)27(39)33-19-5-8-21(40-4)9-6-19/h5-10,13,17-18,24,36H,11-12,14-16H2,1-4H3,(H,32,37)(H,33,39)/t17-,18+,24+/m1/s1	RKPQTFDXIVHBLJ-YTZAWJCFSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K28349636	BRD-K28349636-001-01-4	Broad Institute of MIT and Harvard	BRD-K28349636			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)CCC(F)(F)F)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C28H35F3N4O6/c1-17-14-35(18(2)16-36)26(38)22-13-20(32-25(37)11-12-28(29,30)31)7-10-23(22)41-24(17)15-34(3)27(39)33-19-5-8-21(40-4)9-6-19/h5-10,13,17-18,24,36H,11-12,14-16H2,1-4H3,(H,32,37)(H,33,39)/t17-,18+,24+/m1/s1	RKPQTFDXIVHBLJ-YTZAWJCFSA-N	580.25086948							113850
BRD-K64626569	LSM-25283		44494758	InChI=1S/C28H39N5O6/c1-17(2)29-28(37)32(5)15-24-18(3)14-33(19(4)16-34)26(35)22-8-7-9-23(25(22)39-24)31-27(36)30-20-10-12-21(38-6)13-11-20/h7-13,17-19,24,34H,14-16H2,1-6H3,(H,29,37)(H2,30,31,36)/t18-,19-,24+/m0/s1	IBFNJHBZCKBINA-AXHZCLLHSA-N	COc1ccc(NC(=O)Nc2cccc3C(=O)N(C[C@H](C)[C@@H](CN(C)C(=O)NC(C)C)Oc23)[C@@H](C)CO)cc1	BroadT	BRD-K64626569	BRD-K64626569-001-01-1	Broad Institute of MIT and Harvard	BRD-K64626569			COc1ccc(NC(=O)Nc2cccc3c2O[C@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@@H](C)CO)C3=O)cc1	InChI=1S/C28H39N5O6/c1-17(2)29-28(37)32(5)15-24-18(3)14-33(19(4)16-34)26(35)22-8-7-9-23(25(22)39-24)31-27(36)30-20-10-12-21(38-6)13-11-20/h7-13,17-19,24,34H,14-16H2,1-6H3,(H,29,37)(H2,30,31,36)/t18-,19-,24+/m0/s1	IBFNJHBZCKBINA-AXHZCLLHSA-N	541.290034018							113851
BRD-K02050740	LSM-25284		44617613	InChI=1S/C25H31F3N4O4/c1-15-13-32(16(2)14-33)23(34)11-17-10-20(8-9-21(17)36-22(15)12-29-3)31-24(35)30-19-6-4-18(5-7-19)25(26,27)28/h4-10,15-16,22,29,33H,11-14H2,1-3H3,(H2,30,31,35)/t15-,16+,22+/m1/s1	NMJAJKSBHFWFOJ-VVBPWWLESA-N	CNC[C@@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K02050740	BRD-K02050740-001-01-1	Broad Institute of MIT and Harvard	BRD-K02050740			CNC[C@@H]1Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C25H31F3N4O4/c1-15-13-32(16(2)14-33)23(34)11-17-10-20(8-9-21(17)36-22(15)12-29-3)31-24(35)30-19-6-4-18(5-7-19)25(26,27)28/h4-10,15-16,22,29,33H,11-14H2,1-3H3,(H2,30,31,35)/t15-,16+,22+/m1/s1	NMJAJKSBHFWFOJ-VVBPWWLESA-N	508.229740112							113852
BRD-K41498330	LSM-25285		44484244	InChI=1S/C32H36N4O7/c1-20-16-36(21(2)18-37)31(39)25-14-23(33-30(38)13-22-7-5-4-6-8-22)9-11-26(25)43-29(20)17-35(3)32(40)34-24-10-12-27-28(15-24)42-19-41-27/h4-12,14-15,20-21,29,37H,13,16-19H2,1-3H3,(H,33,38)(H,34,40)/t20-,21-,29-/m0/s1	UVTNCBQHXJQZIN-WURXVLGASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ccc(NC(=O)Cc5ccccc5)cc4C1=O	BroadT	BRD-K41498330	BRD-K41498330-001-01-1	Broad Institute of MIT and Harvard	BRD-K41498330			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C32H36N4O7/c1-20-16-36(21(2)18-37)31(39)25-14-23(33-30(38)13-22-7-5-4-6-8-22)9-11-26(25)43-29(20)17-35(3)32(40)34-24-10-12-27-28(15-24)42-19-41-27/h4-12,14-15,20-21,29,37H,13,16-19H2,1-3H3,(H,33,38)(H,34,40)/t20-,21-,29-/m0/s1	UVTNCBQHXJQZIN-WURXVLGASA-N	588.258399532							113853
BRD-K37949240	LSM-25286		44490026	InChI=1S/C22H28N4O4/c1-14-12-26(15(2)13-27)22(29)18-10-17(4-5-19(18)30-20(14)11-23-3)25-21(28)16-6-8-24-9-7-16/h4-10,14-15,20,23,27H,11-13H2,1-3H3,(H,25,28)/t14-,15-,20+/m1/s1	ZXKRGMHNDBNPIZ-SXGZJXTBSA-N	CNC[C@@H]1Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K37949240	BRD-K37949240-001-01-8	Broad Institute of MIT and Harvard	BRD-K37949240			CNC[C@@H]1Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C22H28N4O4/c1-14-12-26(15(2)13-27)22(29)18-10-17(4-5-19(18)30-20(14)11-23-3)25-21(28)16-6-8-24-9-7-16/h4-10,14-15,20,23,27H,11-13H2,1-3H3,(H,25,28)/t14-,15-,20+/m1/s1	ZXKRGMHNDBNPIZ-SXGZJXTBSA-N	412.211055416							113854
BRD-K50191826	LSM-25287		54613789	InChI=1S/C21H34N4O6S/c1-13(2)22-21(28)23-17-9-7-8-16-19(17)31-18(11-24(5)32(6,29)30)14(3)10-25(20(16)27)15(4)12-26/h7-9,13-15,18,26H,10-12H2,1-6H3,(H2,22,23,28)/t14-,15-,18+/m1/s1	JMXMRSKNTVHTGA-RKVPGOIHSA-N	CC(C)NC(=O)Nc1cccc2C(=O)N(C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)Oc12)[C@H](C)CO	BroadT	BRD-K50191826	BRD-K50191826-001-01-1	Broad Institute of MIT and Harvard	BRD-K50191826			CC(C)NC(=O)Nc1cccc2c1O[C@@H](CN(C)S(C)(=O)=O)[C@H](C)CN([C@H](C)CO)C2=O	InChI=1S/C21H34N4O6S/c1-13(2)22-21(28)23-17-9-7-8-16-19(17)31-18(11-24(5)32(6,29)30)14(3)10-25(20(16)27)15(4)12-26/h7-9,13-15,18,26H,10-12H2,1-6H3,(H2,22,23,28)/t14-,15-,18+/m1/s1	JMXMRSKNTVHTGA-RKVPGOIHSA-N	470.219905538							113855
BRD-K25312635	LSM-25288		44491016	InChI=1S/C25H38N4O5/c1-15(2)26-25(33)28(5)13-22-16(3)12-29(17(4)14-30)23(31)11-19-10-20(8-9-21(19)34-22)27-24(32)18-6-7-18/h8-10,15-18,22,30H,6-7,11-14H2,1-5H3,(H,26,33)(H,27,32)/t16-,17+,22+/m1/s1	DCTUMTORVFHGKV-JLHGSKIFSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K25312635	BRD-K25312635-001-01-6	Broad Institute of MIT and Harvard	BRD-K25312635			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)C3CC3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C25H38N4O5/c1-15(2)26-25(33)28(5)13-22-16(3)12-29(17(4)14-30)23(31)11-19-10-20(8-9-21(19)34-22)27-24(32)18-6-7-18/h8-10,15-18,22,30H,6-7,11-14H2,1-5H3,(H,26,33)(H,27,32)/t16-,17+,22+/m1/s1	DCTUMTORVFHGKV-JLHGSKIFSA-N	474.284220356							113856
BRD-K56024445	LSM-25289		44494670	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16-,20+/m1/s1	DJIXJENXBPUHIX-QINHECLXSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K56024445	BRD-K56024445-001-01-9	Broad Institute of MIT and Harvard	BRD-K56024445			CC(C)NC(=O)N(C)C[C@@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-20-15(3)11-28(16(4)13-29)23(31)18-7-6-8-19(21(18)33-20)26-22(30)17-9-10-17/h6-8,14-17,20,29H,9-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16-,20+/m1/s1	DJIXJENXBPUHIX-QINHECLXSA-N	460.268570292							113857
BRD-K41009039	LSM-25290		44484674	InChI=1S/C29H40N4O4/c1-20-16-33(21(2)19-34)29(36)25-15-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)37-27(20)18-32(3)17-22-7-5-4-6-8-22/h9-15,20-22,27,34H,4-8,16-19H2,1-3H3,(H,31,35)/t20-,21-,27+/m0/s1	FYESYKULLQIDLV-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K41009039	BRD-K41009039-001-01-0	Broad Institute of MIT and Harvard	BRD-K41009039			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H40N4O4/c1-20-16-33(21(2)19-34)29(36)25-15-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)37-27(20)18-32(3)17-22-7-5-4-6-8-22/h9-15,20-22,27,34H,4-8,16-19H2,1-3H3,(H,31,35)/t20-,21-,27+/m0/s1	FYESYKULLQIDLV-NOMHHCBYSA-N	508.3049558							113858
BRD-K31898235	LSM-25291		44486753	InChI=1S/C26H31Cl2N7O4/c1-16-10-35(17(2)14-36)26(38)20-9-19(30-25(37)13-34-15-29-31-32-34)5-7-23(20)39-24(16)12-33(3)11-18-4-6-21(27)22(28)8-18/h4-9,15-17,24,36H,10-14H2,1-3H3,(H,30,37)/t16-,17-,24+/m1/s1	MIRHJXKFLNBQHA-OJLQRUNKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc3ccc(NC(=O)Cn4cnnn4)cc3C1=O	BroadT	BRD-K31898235	BRD-K31898235-001-01-0	Broad Institute of MIT and Harvard	BRD-K31898235			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(NC(=O)Cn3cnnn3)cc2C1=O	InChI=1S/C26H31Cl2N7O4/c1-16-10-35(17(2)14-36)26(38)20-9-19(30-25(37)13-34-15-29-31-32-34)5-7-23(20)39-24(16)12-33(3)11-18-4-6-21(27)22(28)8-18/h4-9,15-17,24,36H,10-14H2,1-3H3,(H,30,37)/t16-,17-,24+/m1/s1	MIRHJXKFLNBQHA-OJLQRUNKSA-N	575.181457962							113859
BRD-K59919062	LSM-25292		44483995	InChI=1S/C34H43N5O6/c1-23-20-39(24(2)22-40)33(42)28-19-26(35-32(41)13-14-38-15-17-44-18-16-38)11-12-30(28)45-31(23)21-37(3)34(43)36-29-10-6-8-25-7-4-5-9-27(25)29/h4-12,19,23-24,31,40H,13-18,20-22H2,1-3H3,(H,35,41)(H,36,43)/t23-,24+,31+/m0/s1	NJKSMJYTSLFNSQ-BKZGZDJESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4ccc(NC(=O)CCN5CCOCC5)cc4C1=O	BroadT	BRD-K59919062	BRD-K59919062-001-01-9	Broad Institute of MIT and Harvard	BRD-K59919062			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)CCN3CCOCC3)cc2C1=O	InChI=1S/C34H43N5O6/c1-23-20-39(24(2)22-40)33(42)28-19-26(35-32(41)13-14-38-15-17-44-18-16-38)11-12-30(28)45-31(23)21-37(3)34(43)36-29-10-6-8-25-7-4-5-9-27(25)29/h4-12,19,23-24,31,40H,13-18,20-22H2,1-3H3,(H,35,41)(H,36,43)/t23-,24+,31+/m0/s1	NJKSMJYTSLFNSQ-BKZGZDJESA-N	617.321334146							113860
BRD-K69903018	LSM-25293		54613801	InChI=1S/C29H35F3N4O7/c1-17-13-36(18(2)15-37)27(39)11-19-10-20(33-26(38)8-9-29(30,31)32)4-6-22(19)43-25(17)14-35(3)28(40)34-21-5-7-23-24(12-21)42-16-41-23/h4-7,10,12,17-18,25,37H,8-9,11,13-16H2,1-3H3,(H,33,38)(H,34,40)/t17-,18+,25+/m0/s1	PUSPJJJYURZHGK-YYULODDRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ccc(NC(=O)CCC(F)(F)F)cc4CC1=O	BroadT	BRD-K69903018	BRD-K69903018-001-01-6	Broad Institute of MIT and Harvard	BRD-K69903018			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C29H35F3N4O7/c1-17-13-36(18(2)15-37)27(39)11-19-10-20(33-26(38)8-9-29(30,31)32)4-6-22(19)43-25(17)14-35(3)28(40)34-21-5-7-23-24(12-21)42-16-41-23/h4-7,10,12,17-18,25,37H,8-9,11,13-16H2,1-3H3,(H,33,38)(H,34,40)/t17-,18+,25+/m0/s1	PUSPJJJYURZHGK-YYULODDRSA-N	608.2457841							113861
BRD-K02946901	LSM-25294		44493927	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17-,22+/m1/s1	FXDXYRRSNQUVQL-YVHKJVDXSA-N	CNC[C@@H]1Oc2c(NC(=O)c3ccc(cc3)c4nccs4)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K02946901	BRD-K02946901-001-01-5	Broad Institute of MIT and Harvard	BRD-K02946901			CNC[C@@H]1Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17-,22+/m1/s1	FXDXYRRSNQUVQL-YVHKJVDXSA-N	494.19877617							113862
BRD-K10540354	LSM-25295		44486104	InChI=1S/C24H35N5O5S/c1-16-10-29(17(2)14-30)24(31)20-9-19(26-35(32,33)23-13-28(4)15-25-23)7-8-21(20)34-22(16)12-27(3)11-18-5-6-18/h7-9,13,15-18,22,26,30H,5-6,10-12,14H2,1-4H3/t16-,17-,22-/m0/s1	KTPUHGRRTQXBGV-HOIFWPIMSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NS(=O)(=O)c4cn(C)cn4)cc3C1=O	BroadT	BRD-K10540354	BRD-K10540354-001-01-8	Broad Institute of MIT and Harvard	BRD-K10540354			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O	InChI=1S/C24H35N5O5S/c1-16-10-29(17(2)14-30)24(31)20-9-19(26-35(32,33)23-13-28(4)15-25-23)7-8-21(20)34-22(16)12-27(3)11-18-5-6-18/h7-9,13,15-18,22,26,30H,5-6,10-12,14H2,1-4H3/t16-,17-,22-/m0/s1	KTPUHGRRTQXBGV-HOIFWPIMSA-N	505.23588996							113863
BRD-K83270266	LSM-25296		44496734	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)24-10-7-11-25(33-31(38)32-23-8-5-4-6-9-23)29(24)41-28(20)17-34(3)16-22-12-13-26-27(14-22)40-19-39-26/h7,10-14,20-21,23,28,36H,4-6,8-9,15-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m1/s1	QXBUWZYZXJXLTK-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4c(NC(=O)NC5CCCCC5)cccc4C1=O	BroadT	BRD-K83270266	BRD-K83270266-001-01-1	Broad Institute of MIT and Harvard	BRD-K83270266			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C31H42N4O6/c1-20-15-35(21(2)18-36)30(37)24-10-7-11-25(33-31(38)32-23-8-5-4-6-9-23)29(24)41-28(20)17-34(3)16-22-12-13-26-27(14-22)40-19-39-26/h7,10-14,20-21,23,28,36H,4-6,8-9,15-19H2,1-3H3,(H2,32,33,38)/t20-,21+,28+/m1/s1	QXBUWZYZXJXLTK-GGJMMHKRSA-N	566.310435104							113864
BRD-K61772027	LSM-25297		44499969	InChI=1S/C30H41FN4O4/c1-20-16-35(21(2)19-36)29(37)25-10-7-11-26(33-30(38)32-24-14-12-23(31)13-15-24)28(25)39-27(20)18-34(3)17-22-8-5-4-6-9-22/h7,10-15,20-22,27,36H,4-6,8-9,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,27-/m1/s1	COSGGAMFLVSIQD-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc3c(NC(=O)Nc4ccc(F)cc4)cccc3C1=O	BroadT	BRD-K61772027	BRD-K61772027-001-01-2	Broad Institute of MIT and Harvard	BRD-K61772027			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2c(NC(=O)Nc3ccc(F)cc3)cccc2C1=O	InChI=1S/C30H41FN4O4/c1-20-16-35(21(2)19-36)29(37)25-10-7-11-26(33-30(38)32-24-14-12-23(31)13-15-24)28(25)39-27(20)18-34(3)17-22-8-5-4-6-9-22/h7,10-15,20-22,27,36H,4-6,8-9,16-19H2,1-3H3,(H2,32,33,38)/t20-,21-,27-/m1/s1	COSGGAMFLVSIQD-LGVUCKNBSA-N	540.311184032							113865
BRD-K82409466	LSM-25298		44494307	InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)17-8-7-9-18(24(3)4)21(17)32-19(15)11-26(6)33(30,31)20-12-25(5)14-23-20/h7-9,12,14-16,19,28H,10-11,13H2,1-6H3/t15-,16-,19-/m0/s1	NFFRJINEVFDSRM-BXWFABGCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K82409466	BRD-K82409466-001-01-4	Broad Institute of MIT and Harvard	BRD-K82409466			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)17-8-7-9-18(24(3)4)21(17)32-19(15)11-26(6)33(30,31)20-12-25(5)14-23-20/h7-9,12,14-16,19,28H,10-11,13H2,1-6H3/t15-,16-,19-/m0/s1	NFFRJINEVFDSRM-BXWFABGCSA-N	479.220239896							113866
BRD-K47999752	LSM-25299		54613804	InChI=1S/C24H33N3O6S/c1-16-14-27(17(2)15-28)24(29)12-18-11-19(5-10-22(18)33-23(16)13-25-3)26-34(30,31)21-8-6-20(32-4)7-9-21/h5-11,16-17,23,25-26,28H,12-15H2,1-4H3/t16-,17+,23+/m1/s1	WHSSCNZRIKSNFR-DGGJZMOXSA-N	CNC[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K47999752	BRD-K47999752-001-01-1	Broad Institute of MIT and Harvard	BRD-K47999752			CNC[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C24H33N3O6S/c1-16-14-27(17(2)15-28)24(29)12-18-11-19(5-10-22(18)33-23(16)13-25-3)26-34(30,31)21-8-6-20(32-4)7-9-21/h5-11,16-17,23,25-26,28H,12-15H2,1-4H3/t16-,17+,23+/m1/s1	WHSSCNZRIKSNFR-DGGJZMOXSA-N	491.209006496							113867
MLS002474267	LSM-25300	BRD-K93248080	44202921	InChI=1S/C28H39N5O6/c1-17(2)29-28(37)32(5)15-24-18(3)14-33(19(4)16-34)26(35)22-8-7-9-23(25(22)39-24)31-27(36)30-20-10-12-21(38-6)13-11-20/h7-13,17-19,24,34H,14-16H2,1-6H3,(H,29,37)(H2,30,31,36)/t18-,19+,24+/m0/s1	IBFNJHBZCKBINA-XLNZFTOWSA-N	COc1ccc(NC(=O)Nc2cccc3C(=O)N(C[C@H](C)[C@@H](CN(C)C(=O)NC(C)C)Oc23)[C@H](C)CO)cc1	BroadT	BRD-K93248080	BRD-K93248080-001-02-7	Broad Institute of MIT and Harvard	BRD-K93248080			COc1ccc(NC(=O)Nc2cccc3c2O[C@H](CN(C)C(=O)NC(C)C)[C@@H](C)CN([C@H](C)CO)C3=O)cc1	InChI=1S/C28H39N5O6/c1-17(2)29-28(37)32(5)15-24-18(3)14-33(19(4)16-34)26(35)22-8-7-9-23(25(22)39-24)31-27(36)30-20-10-12-21(38-6)13-11-20/h7-13,17-19,24,34H,14-16H2,1-6H3,(H,29,37)(H2,30,31,36)/t18-,19+,24+/m0/s1	IBFNJHBZCKBINA-XLNZFTOWSA-N	541.290034018							113868
BRD-K18709210	LSM-25301		44486762	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-21-15(3)11-28(16(4)13-29)23(31)19-10-18(8-9-20(19)33-21)26-22(30)17-6-7-17/h8-10,14-17,21,29H,6-7,11-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16-,21+/m1/s1	NEXLFLQFCDOFIH-ZOCZFRKYSA-N	CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)C3CC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K18709210	BRD-K18709210-001-01-5	Broad Institute of MIT and Harvard	BRD-K18709210			CC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NC(=O)C3CC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C24H36N4O5/c1-14(2)25-24(32)27(5)12-21-15(3)11-28(16(4)13-29)23(31)19-10-18(8-9-20(19)33-21)26-22(30)17-6-7-17/h8-10,14-17,21,29H,6-7,11-13H2,1-5H3,(H,25,32)(H,26,30)/t15-,16-,21+/m1/s1	NEXLFLQFCDOFIH-ZOCZFRKYSA-N	460.268570292							113869
BRD-K72465479	LSM-25302		44616667	InChI=1S/C33H39N7O5/c1-23-17-40(24(2)21-41)33(43)16-26-15-27(35-32(42)20-39-22-34-36-37-39)11-14-30(26)45-31(23)19-38(3)18-25-9-12-29(13-10-25)44-28-7-5-4-6-8-28/h4-15,22-24,31,41H,16-21H2,1-3H3,(H,35,42)/t23-,24+,31+/m0/s1	PROAVNUGSAEHPP-BKZGZDJESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc4ccc(NC(=O)Cn5cnnn5)cc4CC1=O	BroadT	BRD-K72465479	BRD-K72465479-001-01-3	Broad Institute of MIT and Harvard	BRD-K72465479			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(NC(=O)Cn3cnnn3)cc2CC1=O	InChI=1S/C33H39N7O5/c1-23-17-40(24(2)21-41)33(43)16-26-15-27(35-32(42)20-39-22-34-36-37-39)11-14-30(26)45-31(23)19-38(3)18-25-9-12-29(13-10-25)44-28-7-5-4-6-8-28/h4-15,22-24,31,41H,16-21H2,1-3H3,(H,35,42)/t23-,24+,31+/m0/s1	PROAVNUGSAEHPP-BKZGZDJESA-N	613.301267418							113870
BRD-K89660028	LSM-25303		54613788	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)20-7-6-8-21(26(3)4)23(20)31-22(17)15-27(5)14-19-9-11-25-12-10-19/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18-,22-/m1/s1	OVBQAIOLOOTXQW-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3c(cccc3C1=O)N(C)C	BroadT	BRD-K89660028	BRD-K89660028-001-01-6	Broad Institute of MIT and Harvard	BRD-K89660028			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2c(cccc2C1=O)N(C)C	InChI=1S/C24H34N4O3/c1-17-13-28(18(2)16-29)24(30)20-7-6-8-21(26(3)4)23(20)31-22(17)15-27(5)14-19-9-11-25-12-10-19/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18-,22-/m1/s1	OVBQAIOLOOTXQW-JBYIUTFZSA-N	426.263090988							113871
BRD-K46562329	LSM-25304		44498265	InChI=1S/C25H36F3N3O4/c1-16-12-31(17(2)15-32)24(34)11-19-10-20(29-23(33)8-9-25(26,27)28)6-7-21(19)35-22(16)14-30(3)13-18-4-5-18/h6-7,10,16-18,22,32H,4-5,8-9,11-15H2,1-3H3,(H,29,33)/t16-,17+,22+/m1/s1	OWJOIEFDHRCHNY-JLHGSKIFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc3ccc(NC(=O)CCC(F)(F)F)cc3CC1=O	BroadT	BRD-K46562329	BRD-K46562329-001-01-2	Broad Institute of MIT and Harvard	BRD-K46562329			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O	InChI=1S/C25H36F3N3O4/c1-16-12-31(17(2)15-32)24(34)11-19-10-20(29-23(33)8-9-25(26,27)28)6-7-21(19)35-22(16)14-30(3)13-18-4-5-18/h6-7,10,16-18,22,32H,4-5,8-9,11-15H2,1-3H3,(H,29,33)/t16-,17+,22+/m1/s1	OWJOIEFDHRCHNY-JLHGSKIFSA-N	499.265791262							113872
BRD-K49103797	LSM-25305		44488060	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)27-16-10-18-29(36-33(42)35-25-13-5-4-6-14-25)31(27)44-30(22)20-38(3)34(43)37-28-17-9-12-24-11-7-8-15-26(24)28/h7-12,15-18,22-23,25,30,40H,4-6,13-14,19-21H2,1-3H3,(H,37,43)(H2,35,36,42)/t22-,23+,30-/m1/s1	DNNIAXRFSGYFCB-DUELTEGESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc4c(NC(=O)NC5CCCCC5)cccc4C1=O	BroadT	BRD-K49103797	BRD-K49103797-001-01-5	Broad Institute of MIT and Harvard	BRD-K49103797			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)NC3CCCCC3)cccc2C1=O	InChI=1S/C34H43N5O5/c1-22-19-39(23(2)21-40)32(41)27-16-10-18-29(36-33(42)35-25-13-5-4-6-14-25)31(27)44-30(22)20-38(3)34(43)37-28-17-9-12-24-11-7-8-15-26(24)28/h7-12,15-18,22-23,25,30,40H,4-6,13-14,19-21H2,1-3H3,(H,37,43)(H2,35,36,42)/t22-,23+,30-/m1/s1	DNNIAXRFSGYFCB-DUELTEGESA-N	601.326419526							113873
BRD-K77108448	LSM-25306		44489223	InChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)11-18-10-19(4-5-20(18)31-21(15)12-24-3)26-23(30)17-6-8-25-9-7-17/h4-10,15-16,21,24,28H,11-14H2,1-3H3,(H,26,30)/t15-,16+,21-/m1/s1	FZIMPWDREOYZDI-VWKPWSFCSA-N	CNC[C@H]1Oc2ccc(NC(=O)c3ccncc3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K77108448	BRD-K77108448-001-01-2	Broad Institute of MIT and Harvard	BRD-K77108448			CNC[C@H]1Oc2ccc(NC(=O)c3ccncc3)cc2CC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H30N4O4/c1-15-13-27(16(2)14-28)22(29)11-18-10-19(4-5-20(18)31-21(15)12-24-3)26-23(30)17-6-8-25-9-7-17/h4-10,15-16,21,24,28H,11-14H2,1-3H3,(H,26,30)/t15-,16+,21-/m1/s1	FZIMPWDREOYZDI-VWKPWSFCSA-N	426.22670548							113874
BRD-K63024248	LSM-25307		44494868	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17-,22-/m0/s1	FXDXYRRSNQUVQL-HOIFWPIMSA-N	CNC[C@@H]1Oc2c(NC(=O)c3ccc(cc3)c4nccs4)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K63024248	BRD-K63024248-001-01-9	Broad Institute of MIT and Harvard	BRD-K63024248			CNC[C@@H]1Oc2c(NC(=O)c3ccc(cc3)-c3nccs3)cccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H30N4O4S/c1-16-14-30(17(2)15-31)26(33)20-5-4-6-21(23(20)34-22(16)13-27-3)29-24(32)18-7-9-19(10-8-18)25-28-11-12-35-25/h4-12,16-17,22,27,31H,13-15H2,1-3H3,(H,29,32)/t16-,17-,22-/m0/s1	FXDXYRRSNQUVQL-HOIFWPIMSA-N	494.19877617							113875
BRD-K05837079	LSM-44086		54619482	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22+,27-/m1/s1	HITOKJYCRKZWGL-UBVUMUDRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K05837079	BRD-K05837079-001-01-9	Broad Institute of MIT and Harvard	BRD-K05837079			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22+,27-/m1/s1	HITOKJYCRKZWGL-UBVUMUDRSA-N	520.3049558							
BRD-K58843485	LSM-44087		54619556	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22-,27-/m0/s1	HITOKJYCRKZWGL-IALAZXIKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K58843485	BRD-K58843485-001-01-1	Broad Institute of MIT and Harvard	BRD-K58843485			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22-,27-/m0/s1	HITOKJYCRKZWGL-IALAZXIKSA-N	520.3049558							
BRD-K19435356	LSM-25310		54619526	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19+,22-/m0/s1	BYBGYSIHVXXZCT-JQVVWYNYSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CN(C)C)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K19435356	BRD-K19435356-001-01-0	Broad Institute of MIT and Harvard	BRD-K19435356			CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CN(C)C)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19+,22-/m0/s1	BYBGYSIHVXXZCT-JQVVWYNYSA-N	479.245392004							113878
BRD-K72055444	LSM-15158		54619462	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19-,26-/m0/s1	NAZKFJIDOIPBCY-DGUDUIIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K72055444	BRD-K72055444-001-01-4	Broad Institute of MIT and Harvard	BRD-K72055444			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19-,26-/m0/s1	NAZKFJIDOIPBCY-DGUDUIIESA-N	495.233348282							103814
BRD-K35935439	LSM-25311		54619413	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21-,27+/m0/s1	QMNGWUQFDFUPIZ-NOMHHCBYSA-N	COc1cccc(c1)C#Cc2cnc3O[C@H](CN(C)C(=O)C4CCOCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K35935439	BRD-K35935439-001-01-0	Broad Institute of MIT and Harvard	BRD-K35935439			COc1cccc(c1)C#Cc1cnc2O[C@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21-,27+/m0/s1	QMNGWUQFDFUPIZ-NOMHHCBYSA-N	535.268235934							113879
BRD-K53127431	LSM-25312		54619532	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20-,25+/m1/s1	HTMGNWWTKIFEMM-FHAGJXEFSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)C#CCN(C)C)cc1	BroadT	BRD-K53127431	BRD-K53127431-001-01-9	Broad Institute of MIT and Harvard	BRD-K53127431			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)C#CCN(C)C)cc1	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20-,25+/m1/s1	HTMGNWWTKIFEMM-FHAGJXEFSA-N	523.279469334							113880
BRD-K36986252-001-01-6	LSM-25313	BRD-K36986252	54619305	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24-,30+/m0/s1	KSFWKEJSKQZBOG-WUBQMYJQSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K36986252	BRD-K36986252-001-01-6	Broad Institute of MIT and Harvard	BRD-K36986252			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24-,30+/m0/s1	KSFWKEJSKQZBOG-WUBQMYJQSA-N	527.278406694							113881
BRD-K91459693	LSM-44088		54619547	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22+,26-/m1/s1	IBJZSIVAOQZUGO-SDRNYNTFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K91459693	BRD-K91459693-001-01-3	Broad Institute of MIT and Harvard	BRD-K91459693			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22+,26-/m1/s1	IBJZSIVAOQZUGO-SDRNYNTFSA-N	522.284220356							
BRD-K47886441	LSM-25315		54619438	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20-,24+/m1/s1	RFSJWOMDBGLSJS-REHUZNOOSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CC3CC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K47886441	BRD-K47886441-001-01-7	Broad Institute of MIT and Harvard	BRD-K47886441			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CC3CC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20-,24+/m1/s1	RFSJWOMDBGLSJS-REHUZNOOSA-N	490.250143026							113883
BRD-K31852848	LSM-25316		54619322	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18-,23+/m1/s1	JVFXTLNLNPGAHH-PNCHPQGNSA-N	CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K31852848	BRD-K31852848-001-01-6	Broad Institute of MIT and Harvard	BRD-K31852848			CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18-,23+/m1/s1	JVFXTLNLNPGAHH-PNCHPQGNSA-N	490.213757518							113884
BRD-K13462310-001-01-5	LSM-25317	BRD-K13462310	54619306	InChI=1S/C27H33FN2O4S/c1-19-15-30(20(2)18-31)35(32,33)27-12-11-22(8-7-21-5-4-6-24(28)13-21)14-25(27)34-26(19)17-29(3)16-23-9-10-23/h4-6,11-14,19-20,23,26,31H,9-10,15-18H2,1-3H3/t19-,20+,26-/m0/s1	RFKINOJAXDJBJC-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccc(F)c4	BroadT	BRD-K13462310	BRD-K13462310-001-01-5	Broad Institute of MIT and Harvard	BRD-K13462310			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1	InChI=1S/C27H33FN2O4S/c1-19-15-30(20(2)18-31)35(32,33)27-12-11-22(8-7-21-5-4-6-24(28)13-21)14-25(27)34-26(19)17-29(3)16-23-9-10-23/h4-6,11-14,19-20,23,26,31H,9-10,15-18H2,1-3H3/t19-,20+,26-/m0/s1	RFKINOJAXDJBJC-UNVFRBQDSA-N	500.214506446							113885
BRD-K68223954	LSM-25318		54619446	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22+,30+/m0/s1	MYWSUSXCAZFZDP-IABYTQIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5cccc(c5)C(=O)N(C)C	BroadT	BRD-K68223954	BRD-K68223954-001-01-6	Broad Institute of MIT and Harvard	BRD-K68223954			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22+,30+/m0/s1	MYWSUSXCAZFZDP-IABYTQIASA-N	609.250871308							113886
BRD-K51385533	LSM-25319		54619529	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20-,26-/m1/s1	YLZPYRGVLPKCNQ-XMERXJNXSA-N	COc1ccc(cc1)c2cnc3O[C@H](CN(C)C(=O)Cc4cccnc4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K51385533	BRD-K51385533-001-01-2	Broad Institute of MIT and Harvard	BRD-K51385533			COc1ccc(cc1)-c1cnc2O[C@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20-,26-/m1/s1	YLZPYRGVLPKCNQ-XMERXJNXSA-N	518.252920228							113887
BRD-K06261202	LSM-25320		54619584	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21+,27+/m1/s1	XVNXZMOLFFKQAU-BUEREQSYSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)CC4CCOCC4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K06261202	BRD-K06261202-001-01-1	Broad Institute of MIT and Harvard	BRD-K06261202			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21+,27+/m1/s1	XVNXZMOLFFKQAU-BUEREQSYSA-N	532.26070771							113888
MLS003130172	LSM-25321	BRD-K02827191	46903570	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17+,23+/m1/s1	XVANEVHAXZLZTM-DGGJZMOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C)Oc2ncc(cc2C1=O)C#Cc3ccc(F)cc3	BroadT	BRD-K02827191	BRD-K02827191-001-02-4	Broad Institute of MIT and Harvard	BRD-K02827191			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(C)=O)Oc2ncc(cc2C1=O)C#Cc1ccc(F)cc1	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17+,23+/m1/s1	XVANEVHAXZLZTM-DGGJZMOXSA-N	453.206384606							113889
BRD-K31001397	LSM-25322		54619327	InChI=1S/C20H27N3O4S/c1-14-12-23(15(2)13-24)28(25,26)20-7-6-16(17-5-4-8-22-10-17)9-18(20)27-19(14)11-21-3/h4-10,14-15,19,21,24H,11-13H2,1-3H3/t14-,15+,19-/m1/s1	GQINMCYFQWJTAV-ZRGWGRIASA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3cccnc3	BroadT	BRD-K31001397	BRD-K31001397-001-01-5	Broad Institute of MIT and Harvard	BRD-K31001397			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cccnc1	InChI=1S/C20H27N3O4S/c1-14-12-23(15(2)13-24)28(25,26)20-7-6-16(17-5-4-8-22-10-17)9-18(20)27-19(14)11-21-3/h4-10,14-15,19,21,24H,11-13H2,1-3H3/t14-,15+,19-/m1/s1	GQINMCYFQWJTAV-ZRGWGRIASA-N	405.172227064							113890
BRD-K28596345	LSM-25323		54619442	InChI=1S/C27H33FN2O4S/c1-19-15-30(20(2)18-31)35(32,33)27-12-11-22(8-7-21-5-4-6-24(28)13-21)14-25(27)34-26(19)17-29(3)16-23-9-10-23/h4-6,11-14,19-20,23,26,31H,9-10,15-18H2,1-3H3/t19-,20-,26-/m1/s1	RFKINOJAXDJBJC-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccc(F)c4	BroadT	BRD-K28596345	BRD-K28596345-001-01-2	Broad Institute of MIT and Harvard	BRD-K28596345			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1	InChI=1S/C27H33FN2O4S/c1-19-15-30(20(2)18-31)35(32,33)27-12-11-22(8-7-21-5-4-6-24(28)13-21)14-25(27)34-26(19)17-29(3)16-23-9-10-23/h4-6,11-14,19-20,23,26,31H,9-10,15-18H2,1-3H3/t19-,20-,26-/m1/s1	RFKINOJAXDJBJC-XMERXJNXSA-N	500.214506446							113891
BRD-K92849826	LSM-25324		54619358	InChI=1S/C19H29BrN2O4S/c1-13-9-22(14(2)12-23)27(24,25)19-7-6-16(20)8-17(19)26-18(13)11-21(3)10-15-4-5-15/h6-8,13-15,18,23H,4-5,9-12H2,1-3H3/t13-,14+,18-/m1/s1	NQKVBKPKEYEFNC-QWQRMKEZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K92849826	BRD-K92849826-001-01-4	Broad Institute of MIT and Harvard	BRD-K92849826			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C19H29BrN2O4S/c1-13-9-22(14(2)12-23)27(24,25)19-7-6-16(20)8-17(19)26-18(13)11-21(3)10-15-4-5-15/h6-8,13-15,18,23H,4-5,9-12H2,1-3H3/t13-,14+,18-/m1/s1	NQKVBKPKEYEFNC-QWQRMKEZSA-N	460.103140718							113892
BRD-K91568452	LSM-15065		54619367	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	QGQQAQHDJARTFG-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K91568452	BRD-K91568452-001-01-2	Broad Institute of MIT and Harvard	BRD-K91568452			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	QGQQAQHDJARTFG-FHAGJXEFSA-N	520.26070771							103721
BRD-K73500713	LSM-25325		54619420	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17+,22+/m1/s1	NTWQDWFFMZTMNG-JLHGSKIFSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K73500713	BRD-K73500713-001-01-2	Broad Institute of MIT and Harvard	BRD-K73500713			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17+,22+/m1/s1	NTWQDWFFMZTMNG-JLHGSKIFSA-N	466.2216201							113893
BRD-K54467766	LSM-25326		54619404	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18+,23+/m1/s1	JVFXTLNLNPGAHH-STSQHVNTSA-N	CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K54467766	BRD-K54467766-001-01-3	Broad Institute of MIT and Harvard	BRD-K54467766			CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18+,23+/m1/s1	JVFXTLNLNPGAHH-STSQHVNTSA-N	490.213757518							113894
BRD-K26351062	LSM-25327		54619397	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28+/m1/s1	YGCNTAWRLGQTMN-XJGOYTCSSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@@H](CN(C)S(=O)(=O)c4ccccc4F)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K26351062	BRD-K26351062-001-01-5	Broad Institute of MIT and Harvard	BRD-K26351062			COc1ccc(cc1)C#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28+/m1/s1	YGCNTAWRLGQTMN-XJGOYTCSSA-N	616.171320996							113895
BRD-K90821428	LSM-25328		54619329	InChI=1S/C19H28N2O5S/c1-14-12-21(15(2)13-22)27(23,24)19-8-7-16(6-5-9-25-4)10-17(19)26-18(14)11-20-3/h7-8,10,14-15,18,20,22H,9,11-13H2,1-4H3/t14-,15+,18+/m1/s1	LUVAADAAXLMVKF-VKJFTORMSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCOC	BroadT	BRD-K90821428	BRD-K90821428-001-01-7	Broad Institute of MIT and Harvard	BRD-K90821428			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCOC	InChI=1S/C19H28N2O5S/c1-14-12-21(15(2)13-22)27(23,24)19-8-7-16(6-5-9-25-4)10-17(19)26-18(14)11-20-3/h7-8,10,14-15,18,20,22H,9,11-13H2,1-4H3/t14-,15+,18+/m1/s1	LUVAADAAXLMVKF-VKJFTORMSA-N	396.171892706							113896
BRD-K68041793	LSM-25329		54619344	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20+,26+/m1/s1	VWUCQBGGJOIZNN-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K68041793	BRD-K68041793-001-01-7	Broad Institute of MIT and Harvard	BRD-K68041793			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc2cc(ccc2S1(=O)=O)-c1cccc(C#N)c1	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20+,26+/m1/s1	VWUCQBGGJOIZNN-GOHWNWGWSA-N	534.19369079							113897
BRD-K70357895	LSM-44089		54619549	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22+,26+/m0/s1	IBJZSIVAOQZUGO-XYKVUVBPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K70357895	BRD-K70357895-001-01-0	Broad Institute of MIT and Harvard	BRD-K70357895			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22+,26+/m0/s1	IBJZSIVAOQZUGO-XYKVUVBPSA-N	522.284220356							
BRD-K81654062	LSM-43609		54619536	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21+,28-/m0/s1	RSLDQNPUEWIABH-OSLPKHIKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K81654062	BRD-K81654062-001-01-4	Broad Institute of MIT and Harvard	BRD-K81654062			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21+,28-/m0/s1	RSLDQNPUEWIABH-OSLPKHIKSA-N	585.210898276							
BRD-K63410075	LSM-25331		54619595	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21-,27+/m1/s1	XVNXZMOLFFKQAU-GNMOFYLKSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)CC4CCOCC4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K63410075	BRD-K63410075-001-01-8	Broad Institute of MIT and Harvard	BRD-K63410075			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21-,27+/m1/s1	XVNXZMOLFFKQAU-GNMOFYLKSA-N	532.26070771							113899
BRD-K31994521	LSM-44090		54619594	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22+,26-/m0/s1	IBJZSIVAOQZUGO-PMDIVEKVSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K31994521	BRD-K31994521-001-01-0	Broad Institute of MIT and Harvard	BRD-K31994521			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22+,26-/m0/s1	IBJZSIVAOQZUGO-PMDIVEKVSA-N	522.284220356							
BRD-K09275191	LSM-25333		54619543	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20-,25-/m0/s1	QGQQAQHDJARTFG-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K09275191	BRD-K09275191-001-01-1	Broad Institute of MIT and Harvard	BRD-K09275191			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20-,25-/m0/s1	QGQQAQHDJARTFG-RLSLOFABSA-N	520.26070771							113901
CHEMBL2354703	LSM-25334	BRD-K32854540, SID131414440	54619320	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16-,20+/m0/s1	RBKHQDVGCDKRON-TWOQFEAHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K32854540	BRD-K32854540-001-01-2	Broad Institute of MIT and Harvard	BRD-K32854540			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16-,20+/m0/s1	RBKHQDVGCDKRON-TWOQFEAHSA-N	525.093304316							113902
BRD-K04680784	LSM-25335		54619364	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(31,32)26-13-12-22(11-10-21(3)30)14-24(26)33-25(19)17-27(4)16-23-8-6-5-7-9-23/h12-14,19-21,23,25,29-30H,5-9,15-18H2,1-4H3/t19-,20-,21+,25-/m1/s1	GRNMGBYBKFXPAP-NAZDKBRTSA-N	C[C@H](O)C#Cc1ccc2c(O[C@H](CN(C)CC3CCCCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K04680784	BRD-K04680784-001-01-0	Broad Institute of MIT and Harvard	BRD-K04680784			C[C@H](O)C#Cc1ccc2c(O[C@H](CN(C)CC3CCCCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H40N2O5S/c1-19-15-28(20(2)18-29)34(31,32)26-13-12-22(11-10-21(3)30)14-24(26)33-25(19)17-27(4)16-23-8-6-5-7-9-23/h12-14,19-21,23,25,29-30H,5-9,15-18H2,1-4H3/t19-,20-,21+,25-/m1/s1	GRNMGBYBKFXPAP-NAZDKBRTSA-N	492.26579309							113903
BRD-K92579151	LSM-25336		54619427	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20+,27+/m1/s1	OEKKMSVCCRMVHL-JVAFGIKQSA-N	COc1cccc(c1)c2cnc3O[C@@H](CN(C)Cc4ccc(cc4)C(=O)O)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K92579151	BRD-K92579151-001-01-2	Broad Institute of MIT and Harvard	BRD-K92579151			COc1cccc(c1)-c1cnc2O[C@@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20+,27+/m1/s1	OEKKMSVCCRMVHL-JVAFGIKQSA-N	533.25258587							113904
BRD-K08355771	LSM-25337		54619331	InChI=1S/C20H27N3O4S/c1-14-12-23(15(2)13-24)28(25,26)20-7-6-16(17-5-4-8-22-10-17)9-18(20)27-19(14)11-21-3/h4-10,14-15,19,21,24H,11-13H2,1-3H3/t14-,15+,19+/m0/s1	GQINMCYFQWJTAV-QMTMVMCOSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3cccnc3	BroadT	BRD-K08355771	BRD-K08355771-001-01-0	Broad Institute of MIT and Harvard	BRD-K08355771			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cccnc1	InChI=1S/C20H27N3O4S/c1-14-12-23(15(2)13-24)28(25,26)20-7-6-16(17-5-4-8-22-10-17)9-18(20)27-19(14)11-21-3/h4-10,14-15,19,21,24H,11-13H2,1-3H3/t14-,15+,19+/m0/s1	GQINMCYFQWJTAV-QMTMVMCOSA-N	405.172227064							113905
BRD-K85843964	LSM-25338		54619348	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15+,20+/m0/s1	DTSMYPYKMZUDTF-BXTJHSDWSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K85843964	BRD-K85843964-001-01-8	Broad Institute of MIT and Harvard	BRD-K85843964			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15+,20+/m0/s1	DTSMYPYKMZUDTF-BXTJHSDWSA-N	422.167556254							113906
BRD-K83312314	LSM-25339		54619501	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17+,23-/m0/s1	BTFHKXNDUYKHCV-MFEFFIJZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K83312314	BRD-K83312314-001-01-3	Broad Institute of MIT and Harvard	BRD-K83312314			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17+,23-/m0/s1	BTFHKXNDUYKHCV-MFEFFIJZSA-N	469.237684734							113907
BRD-K65987370	LSM-44091		54619449	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16-,20+/m1/s1	YMXRISRBAYOBDY-AGICPTHUSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K65987370	BRD-K65987370-001-01-5	Broad Institute of MIT and Harvard	BRD-K65987370			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16-,20+/m1/s1	YMXRISRBAYOBDY-AGICPTHUSA-N	439.221954458							
BRD-K61486072	LSM-44092		54619578	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21+,28+/m1/s1	RSLDQNPUEWIABH-AIUKAKNXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K61486072	BRD-K61486072-001-01-3	Broad Institute of MIT and Harvard	BRD-K61486072			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21+,28+/m1/s1	RSLDQNPUEWIABH-AIUKAKNXSA-N	585.210898276							
BRD-K62203376	LSM-25342		54619439	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20+,25-/m1/s1	QGQQAQHDJARTFG-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K62203376	BRD-K62203376-001-01-4	Broad Institute of MIT and Harvard	BRD-K62203376			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20+,25-/m1/s1	QGQQAQHDJARTFG-OHUGHZGNSA-N	520.26070771							113910
BRD-K58863194	LSM-25343		54619359	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20-,25+/m0/s1	HTMGNWWTKIFEMM-ZYLNGJIFSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CCN(C)C)cc1	BroadT	BRD-K58863194	BRD-K58863194-001-01-1	Broad Institute of MIT and Harvard	BRD-K58863194			COc1ccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CCN(C)C)cc1	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20-,25+/m0/s1	HTMGNWWTKIFEMM-ZYLNGJIFSA-N	523.279469334							113911
MLS003130099	LSM-44093	SID99358679, BRD-K36219645	46903458	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22-,27+/m1/s1	HITOKJYCRKZWGL-DWIXIZSHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K36219645	BRD-K36219645-001-02-6	Broad Institute of MIT and Harvard	BRD-K36219645			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22-,27+/m1/s1	HITOKJYCRKZWGL-DWIXIZSHSA-N	520.3049558							
BRD-K68497273	LSM-25345		54619405	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17-,21+/m1/s1	VRPITXDQEALDAT-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccccc3	BroadT	BRD-K68497273	BRD-K68497273-001-01-0	Broad Institute of MIT and Harvard	BRD-K68497273			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17-,21+/m1/s1	VRPITXDQEALDAT-LZJOCLMNSA-N	418.19262815							113913
BRD-K96713984	LSM-25346		54619316	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21+,27+/m0/s1	QMNGWUQFDFUPIZ-FYQCMVGJSA-N	COc1cccc(c1)C#Cc2cnc3O[C@H](CN(C)C(=O)C4CCOCC4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K96713984	BRD-K96713984-001-01-6	Broad Institute of MIT and Harvard	BRD-K96713984			COc1cccc(c1)C#Cc1cnc2O[C@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21+,27+/m0/s1	QMNGWUQFDFUPIZ-FYQCMVGJSA-N	535.268235934							113914
BRD-K71876816	LSM-25347		54619581	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20+,26-/m1/s1	VWUCQBGGJOIZNN-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K71876816	BRD-K71876816-001-01-4	Broad Institute of MIT and Harvard	BRD-K71876816			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc2cc(ccc2S1(=O)=O)-c1cccc(C#N)c1	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20+,26-/m1/s1	VWUCQBGGJOIZNN-BVFVYWQFSA-N	534.19369079							113915
BRD-K99529078	LSM-25348		54619444	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20-,26+/m0/s1	YLZPYRGVLPKCNQ-CUVVAGTFSA-N	COc1ccc(cc1)c2cnc3O[C@H](CN(C)C(=O)Cc4cccnc4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K99529078	BRD-K99529078-001-01-0	Broad Institute of MIT and Harvard	BRD-K99529078			COc1ccc(cc1)-c1cnc2O[C@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20-,26+/m0/s1	YLZPYRGVLPKCNQ-CUVVAGTFSA-N	518.252920228							113916
BRD-K53192330	LSM-25349		54619374	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17-,23-/m1/s1	XVANEVHAXZLZTM-SEPYTNNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C)Oc2ncc(cc2C1=O)C#Cc3ccc(F)cc3	BroadT	BRD-K53192330	BRD-K53192330-001-01-5	Broad Institute of MIT and Harvard	BRD-K53192330			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(C)=O)Oc2ncc(cc2C1=O)C#Cc1ccc(F)cc1	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17-,23-/m1/s1	XVANEVHAXZLZTM-SEPYTNNBSA-N	453.206384606							113917
BRD-K72842159	LSM-25350		54619557	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21+,27-/m1/s1	XVNXZMOLFFKQAU-PBDKAQRYSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)CC4CCOCC4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K72842159	BRD-K72842159-001-01-0	Broad Institute of MIT and Harvard	BRD-K72842159			COc1ccccc1-c1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21+,27-/m1/s1	XVNXZMOLFFKQAU-PBDKAQRYSA-N	532.26070771							113918
BRD-K61287439	LSM-25351		54619342	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19-,22-/m0/s1	BYBGYSIHVXXZCT-IPJJNNNSSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CN(C)C)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K61287439	BRD-K61287439-001-01-3	Broad Institute of MIT and Harvard	BRD-K61287439			CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CN(C)C)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19-,22-/m0/s1	BYBGYSIHVXXZCT-IPJJNNNSSA-N	479.245392004							113919
CHEMBL2360134	LSM-25352	BRD-K68009914, SID131414686	54619552	InChI=1S/C30H36N2O7S/c1-20-15-32(21(2)18-33)40(34,35)30-12-10-23(24-7-5-6-8-25(24)36-4)14-28(30)39-29(20)17-31(3)16-22-9-11-26-27(13-22)38-19-37-26/h5-14,20-21,29,33H,15-19H2,1-4H3/t20-,21+,29-/m1/s1	YWADXHNDBHGHLS-HNMNOHOESA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)Cc4ccc5OCOc5c4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K68009914	BRD-K68009914-001-01-8	Broad Institute of MIT and Harvard	BRD-K68009914			COc1ccccc1-c1ccc2c(O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H36N2O7S/c1-20-15-32(21(2)18-33)40(34,35)30-12-10-23(24-7-5-6-8-25(24)36-4)14-28(30)39-29(20)17-31(3)16-22-9-11-26-27(13-22)38-19-37-26/h5-14,20-21,29,33H,15-19H2,1-4H3/t20-,21+,29-/m1/s1	YWADXHNDBHGHLS-HNMNOHOESA-N	568.224322202							113920
BRD-K76487707	LSM-25353		54619338	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20-,26-/m1/s1	VWUCQBGGJOIZNN-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K76487707	BRD-K76487707-001-01-7	Broad Institute of MIT and Harvard	BRD-K76487707			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc2cc(ccc2S1(=O)=O)-c1cccc(C#N)c1	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20-,26-/m1/s1	VWUCQBGGJOIZNN-XMERXJNXSA-N	534.19369079							113921
BRD-K73795883	LSM-25354		54619472	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16+,20-/m1/s1	RBKHQDVGCDKRON-GQIGUUNPSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K73795883	BRD-K73795883-001-01-2	Broad Institute of MIT and Harvard	BRD-K73795883			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16+,20-/m1/s1	RBKHQDVGCDKRON-GQIGUUNPSA-N	525.093304316							113922
BRD-K47077178	LSM-15139		54619492	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15-,20-/m0/s1	KUOLKNDJLDMVPT-AVYPCKFXSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K47077178	BRD-K47077178-001-01-2	Broad Institute of MIT and Harvard	BRD-K47077178			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15-,20-/m0/s1	KUOLKNDJLDMVPT-AVYPCKFXSA-N	399.215806438							103795
BRD-K97335870	LSM-15070		54619402	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19-,26+/m1/s1	NAZKFJIDOIPBCY-UDCNLSRBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K97335870	BRD-K97335870-001-01-4	Broad Institute of MIT and Harvard	BRD-K97335870			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19-,26+/m1/s1	NAZKFJIDOIPBCY-UDCNLSRBSA-N	495.233348282							103726
BRD-K08416835	LSM-25355		54619515	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19+,22+/m0/s1	BYBGYSIHVXXZCT-NNMXDRDESA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)CN(C)C)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K08416835	BRD-K08416835-001-01-4	Broad Institute of MIT and Harvard	BRD-K08416835			CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)CN(C)C)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19+,22+/m0/s1	BYBGYSIHVXXZCT-NNMXDRDESA-N	479.245392004							113923
BRD-K81001899	LSM-25356		54619586	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20+,27+/m0/s1	TXBXSWUOPNBBNR-ASHZAFPQSA-N	COc1cccc(c1)c2ccc3c(O[C@H](CN(C)C(=O)c4ccccc4F)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K81001899	BRD-K81001899-001-01-7	Broad Institute of MIT and Harvard	BRD-K81001899			COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20+,27+/m0/s1	TXBXSWUOPNBBNR-ASHZAFPQSA-N	556.204335686							113924
BRD-K46599443	LSM-25357		54619555	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20+,27+/m1/s1	TXBXSWUOPNBBNR-JVAFGIKQSA-N	COc1cccc(c1)c2ccc3c(O[C@@H](CN(C)C(=O)c4ccccc4F)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K46599443	BRD-K46599443-001-01-5	Broad Institute of MIT and Harvard	BRD-K46599443			COc1cccc(c1)-c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20+,27+/m1/s1	TXBXSWUOPNBBNR-JVAFGIKQSA-N	556.204335686							113925
BRD-K52441396	LSM-44094		54619317	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17+,21+/m0/s1	HDXAYIIPFHKWCX-KMUWJVLJSA-N	C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3ccccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K52441396	BRD-K52441396-001-01-8	Broad Institute of MIT and Harvard	BRD-K52441396			C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3ccccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17+,21+/m0/s1	HDXAYIIPFHKWCX-KMUWJVLJSA-N	491.18901998							
BRD-K08212599	LSM-25359		54619456	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17+,23+/m0/s1	XVANEVHAXZLZTM-YGKZAACZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C)Oc2ncc(cc2C1=O)C#Cc3ccc(F)cc3	BroadT	BRD-K08212599	BRD-K08212599-001-01-3	Broad Institute of MIT and Harvard	BRD-K08212599			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(C)=O)Oc2ncc(cc2C1=O)C#Cc1ccc(F)cc1	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17+,23+/m0/s1	XVANEVHAXZLZTM-YGKZAACZSA-N	453.206384606							113927
BRD-K86942117	LSM-25360		54619324	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16+,20+/m1/s1	RBKHQDVGCDKRON-GUXCAODWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K86942117	BRD-K86942117-001-01-3	Broad Institute of MIT and Harvard	BRD-K86942117			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16+,20+/m1/s1	RBKHQDVGCDKRON-GUXCAODWSA-N	525.093304316							113928
BRD-K95218317	LSM-25361		54619356	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17-,23-/m1/s1	BTFHKXNDUYKHCV-SEPYTNNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K95218317	BRD-K95218317-001-01-5	Broad Institute of MIT and Harvard	BRD-K95218317			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17-,23-/m1/s1	BTFHKXNDUYKHCV-SEPYTNNBSA-N	469.237684734							113929
BRD-K90879242	LSM-25362		54619471	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21+,27+/m1/s1	QMNGWUQFDFUPIZ-BUEREQSYSA-N	COc1cccc(c1)C#Cc2cnc3O[C@@H](CN(C)C(=O)C4CCOCC4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K90879242	BRD-K90879242-001-01-9	Broad Institute of MIT and Harvard	BRD-K90879242			COc1cccc(c1)C#Cc1cnc2O[C@@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21+,27+/m1/s1	QMNGWUQFDFUPIZ-BUEREQSYSA-N	535.268235934							113930
BRD-K93785828	LSM-25363		54619312	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20-,26-/m0/s1	YLZPYRGVLPKCNQ-DYLHXGEVSA-N	COc1ccc(cc1)c2cnc3O[C@@H](CN(C)C(=O)Cc4cccnc4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K93785828	BRD-K93785828-001-01-7	Broad Institute of MIT and Harvard	BRD-K93785828			COc1ccc(cc1)-c1cnc2O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20-,26-/m0/s1	YLZPYRGVLPKCNQ-DYLHXGEVSA-N	518.252920228							113931
BRD-K05432466	LSM-25364		54619379	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17+,22-/m1/s1	NTWQDWFFMZTMNG-HYFFOGBASA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K05432466	BRD-K05432466-001-01-0	Broad Institute of MIT and Harvard	BRD-K05432466			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17+,22-/m1/s1	NTWQDWFFMZTMNG-HYFFOGBASA-N	466.2216201							113932
BRD-K19389825	LSM-25365		54619590	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20+,27-/m1/s1	TXBXSWUOPNBBNR-IOKPGSKQSA-N	COc1cccc(c1)c2ccc3c(O[C@H](CN(C)C(=O)c4ccccc4F)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K19389825	BRD-K19389825-001-01-2	Broad Institute of MIT and Harvard	BRD-K19389825			COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20+,27-/m1/s1	TXBXSWUOPNBBNR-IOKPGSKQSA-N	556.204335686							113933
BRD-K36563688	LSM-25366		54619531	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20-,27-/m0/s1	OEKKMSVCCRMVHL-OSOCVKALSA-N	COc1cccc(c1)c2cnc3O[C@@H](CN(C)Cc4ccc(cc4)C(=O)O)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K36563688	BRD-K36563688-001-01-7	Broad Institute of MIT and Harvard	BRD-K36563688			COc1cccc(c1)-c1cnc2O[C@@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20-,27-/m0/s1	OEKKMSVCCRMVHL-OSOCVKALSA-N	533.25258587							113934
BRD-K79619334	LSM-25367		44506120	InChI=1S/C27H33FN4O5/c1-17-14-32(18(2)16-33)25(34)22-12-19(10-11-27(3,4)36)13-29-24(22)37-23(17)15-31(5)26(35)30-21-8-6-20(28)7-9-21/h6-9,12-13,17-18,23,33,36H,14-16H2,1-5H3,(H,30,35)/t17-,18+,23-/m0/s1	LSQXOCNKPAEEQI-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc3ncc(cc3C1=O)C#CC(C)(C)O	BroadT	BRD-K79619334	BRD-K79619334-001-01-3	Broad Institute of MIT and Harvard	BRD-K79619334			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2ncc(cc2C1=O)C#CC(C)(C)O	InChI=1S/C27H33FN4O5/c1-17-14-32(18(2)16-33)25(34)22-12-19(10-11-27(3,4)36)13-29-24(22)37-23(17)15-31(5)26(35)30-21-8-6-20(28)7-9-21/h6-9,12-13,17-18,23,33,36H,14-16H2,1-5H3,(H,30,35)/t17-,18+,23-/m0/s1	LSQXOCNKPAEEQI-IXFSTUDKSA-N	512.243498396							113935
BRD-K26291134	LSM-25368		54619497	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17-,21-/m0/s1	MKFDRGBJPDLEFY-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K26291134	BRD-K26291134-001-01-7	Broad Institute of MIT and Harvard	BRD-K26291134			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17-,21-/m0/s1	MKFDRGBJPDLEFY-FIKGOQFSSA-N	560.065040648							113936
BRD-K98621344	LSM-15071		54619574	InChI=1S/C24H38N2O4S/c1-5-13-25(4)16-23-18(2)15-26(19(3)17-27)31(28,29)24-12-11-21(14-22(24)30-23)20-9-7-6-8-10-20/h9,11-12,14,18-19,23,27H,5-8,10,13,15-17H2,1-4H3/t18-,19-,23-/m1/s1	GQEOHDGNFBZEER-DNVFCKCGSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C3=CCCCC3	BroadT	BRD-K98621344	BRD-K98621344-001-01-4	Broad Institute of MIT and Harvard	BRD-K98621344			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C1=CCCCC1	InChI=1S/C24H38N2O4S/c1-5-13-25(4)16-23-18(2)15-26(19(3)17-27)31(28,29)24-12-11-21(14-22(24)30-23)20-9-7-6-8-10-20/h9,11-12,14,18-19,23,27H,5-8,10,13,15-17H2,1-4H3/t18-,19-,23-/m1/s1	GQEOHDGNFBZEER-DNVFCKCGSA-N	450.255228406							103727
BRD-K23427405	LSM-25369		54619550	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24+,30-/m0/s1	KSFWKEJSKQZBOG-WAHOFHFDSA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K23427405	BRD-K23427405-001-01-2	Broad Institute of MIT and Harvard	BRD-K23427405			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24+,30-/m0/s1	KSFWKEJSKQZBOG-WAHOFHFDSA-N	527.278406694							113937
BRD-K05777604	LSM-25370		54619554	InChI=1S/C19H28N2O5S/c1-14-12-21(15(2)13-22)27(23,24)19-8-7-16(6-5-9-25-4)10-17(19)26-18(14)11-20-3/h7-8,10,14-15,18,20,22H,9,11-13H2,1-4H3/t14-,15-,18+/m1/s1	LUVAADAAXLMVKF-RKVPGOIHSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CCOC	BroadT	BRD-K05777604	BRD-K05777604-001-01-1	Broad Institute of MIT and Harvard	BRD-K05777604			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CCOC	InChI=1S/C19H28N2O5S/c1-14-12-21(15(2)13-22)27(23,24)19-8-7-16(6-5-9-25-4)10-17(19)26-18(14)11-20-3/h7-8,10,14-15,18,20,22H,9,11-13H2,1-4H3/t14-,15-,18+/m1/s1	LUVAADAAXLMVKF-RKVPGOIHSA-N	396.171892706							113938
BRD-K42849858	LSM-25371		54619569	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17-,22+/m0/s1	NTWQDWFFMZTMNG-PNLZDCPESA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K42849858	BRD-K42849858-001-01-6	Broad Institute of MIT and Harvard	BRD-K42849858			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17-,22+/m0/s1	NTWQDWFFMZTMNG-PNLZDCPESA-N	466.2216201							113939
BRD-K26709432	LSM-25372		44505674	InChI=1S/C29H33FN4O5/c1-18-15-34(19(2)17-35)28(36)25-13-21(20-5-11-24(38-4)12-6-20)14-31-27(25)39-26(18)16-33(3)29(37)32-23-9-7-22(30)8-10-23/h5-14,18-19,26,35H,15-17H2,1-4H3,(H,32,37)/t18-,19+,26-/m0/s1	DGOYOBOOQCXKTC-ANSQWYIGSA-N	COc1ccc(cc1)c2cnc3O[C@@H](CN(C)C(=O)Nc4ccc(F)cc4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K26709432	BRD-K26709432-001-01-7	Broad Institute of MIT and Harvard	BRD-K26709432			COc1ccc(cc1)-c1cnc2O[C@@H](CN(C)C(=O)Nc3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H33FN4O5/c1-18-15-34(19(2)17-35)28(36)25-13-21(20-5-11-24(38-4)12-6-20)14-31-27(25)39-26(18)16-33(3)29(37)32-23-9-7-22(30)8-10-23/h5-14,18-19,26,35H,15-17H2,1-4H3,(H,32,37)/t18-,19+,26-/m0/s1	DGOYOBOOQCXKTC-ANSQWYIGSA-N	536.243498396							113940
BRD-K51697562	LSM-44095		54619337	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22-,26+/m1/s1	IBJZSIVAOQZUGO-AISGLBLJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K51697562	BRD-K51697562-001-01-4	Broad Institute of MIT and Harvard	BRD-K51697562			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22-,26+/m1/s1	IBJZSIVAOQZUGO-AISGLBLJSA-N	522.284220356							
BRD-K40252598	LSM-25374		54619447	InChI=1S/C19H28N2O5S/c1-14-12-21(15(2)13-22)27(23,24)19-8-7-16(6-5-9-25-4)10-17(19)26-18(14)11-20-3/h7-8,10,14-15,18,20,22H,9,11-13H2,1-4H3/t14-,15-,18-/m0/s1	LUVAADAAXLMVKF-MPGHIAIKSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCOC	BroadT	BRD-K40252598	BRD-K40252598-001-01-0	Broad Institute of MIT and Harvard	BRD-K40252598			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCOC	InChI=1S/C19H28N2O5S/c1-14-12-21(15(2)13-22)27(23,24)19-8-7-16(6-5-9-25-4)10-17(19)26-18(14)11-20-3/h7-8,10,14-15,18,20,22H,9,11-13H2,1-4H3/t14-,15-,18-/m0/s1	LUVAADAAXLMVKF-MPGHIAIKSA-N	396.171892706							113942
BRD-K92446632	LSM-25375		54619485	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17-,22-/m1/s1	NTWQDWFFMZTMNG-DRSNIGMVSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K92446632	BRD-K92446632-001-01-3	Broad Institute of MIT and Harvard	BRD-K92446632			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17-,22-/m1/s1	NTWQDWFFMZTMNG-DRSNIGMVSA-N	466.2216201							113943
BRD-K11168234	LSM-25376		54619334	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19-,26-/m1/s1	NAZKFJIDOIPBCY-LJKQEARRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K11168234	BRD-K11168234-001-01-3	Broad Institute of MIT and Harvard	BRD-K11168234			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19-,26-/m1/s1	NAZKFJIDOIPBCY-LJKQEARRSA-N	495.233348282							113944
BRD-K02204058	LSM-25377		54619354	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20-,27+/m1/s1	OEKKMSVCCRMVHL-DVHCVUMVSA-N	COc1cccc(c1)c2cnc3O[C@@H](CN(C)Cc4ccc(cc4)C(=O)O)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K02204058	BRD-K02204058-001-01-0	Broad Institute of MIT and Harvard	BRD-K02204058			COc1cccc(c1)-c1cnc2O[C@@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20-,27+/m1/s1	OEKKMSVCCRMVHL-DVHCVUMVSA-N	533.25258587							113945
BRD-K18545493	LSM-15024		54619494	InChI=1S/C24H38N2O4S/c1-5-13-25(4)16-23-18(2)15-26(19(3)17-27)31(28,29)24-12-11-21(14-22(24)30-23)20-9-7-6-8-10-20/h9,11-12,14,18-19,23,27H,5-8,10,13,15-17H2,1-4H3/t18-,19+,23-/m1/s1	GQEOHDGNFBZEER-SELNLUPBSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C3=CCCCC3	BroadT	BRD-K18545493	BRD-K18545493-001-01-1	Broad Institute of MIT and Harvard	BRD-K18545493			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCCC1	InChI=1S/C24H38N2O4S/c1-5-13-25(4)16-23-18(2)15-26(19(3)17-27)31(28,29)24-12-11-21(14-22(24)30-23)20-9-7-6-8-10-20/h9,11-12,14,18-19,23,27H,5-8,10,13,15-17H2,1-4H3/t18-,19+,23-/m1/s1	GQEOHDGNFBZEER-SELNLUPBSA-N	450.255228406							103680
BRD-K29242326	LSM-25378		54619468	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20+,25+/m0/s1	LQAOJDLPUWWIJF-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K29242326	BRD-K29242326-001-01-5	Broad Institute of MIT and Harvard	BRD-K29242326			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20+,25+/m0/s1	LQAOJDLPUWWIJF-WZOHSFFVSA-N	524.209340854							113946
BRD-K75331656	LSM-25379		54619551	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21+,27+/m0/s1	XVNXZMOLFFKQAU-FYQCMVGJSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)CC4CCOCC4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K75331656	BRD-K75331656-001-01-9	Broad Institute of MIT and Harvard	BRD-K75331656			COc1ccccc1-c1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21+,27+/m0/s1	XVNXZMOLFFKQAU-FYQCMVGJSA-N	532.26070771							113947
BRD-K58194737	LSM-25380		54619546	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21-,27-/m1/s1	RUWJTSGBQQPZMY-LGVUCKNBSA-N	COc1cccc(c1)c2ccc3c(O[C@H](CN(C)Cc4ccncc4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K58194737	BRD-K58194737-001-01-5	Broad Institute of MIT and Harvard	BRD-K58194737			COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21-,27-/m1/s1	RUWJTSGBQQPZMY-LGVUCKNBSA-N	525.22974194							113948
BRD-K47498351	LSM-44096		54619335	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22-,26+/m0/s1	IBJZSIVAOQZUGO-GZAVUTNISA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K47498351	BRD-K47498351-001-01-9	Broad Institute of MIT and Harvard	BRD-K47498351			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22-,26+/m0/s1	IBJZSIVAOQZUGO-GZAVUTNISA-N	522.284220356							
BRD-K27888332	LSM-25382		54619436	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17-,23+/m1/s1	XVANEVHAXZLZTM-QZMQVMSPSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C)Oc2ncc(cc2C1=O)C#Cc3ccc(F)cc3	BroadT	BRD-K27888332	BRD-K27888332-001-01-9	Broad Institute of MIT and Harvard	BRD-K27888332			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(C)=O)Oc2ncc(cc2C1=O)C#Cc1ccc(F)cc1	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17-,23+/m1/s1	XVANEVHAXZLZTM-QZMQVMSPSA-N	453.206384606							113950
BRD-K73849129	LSM-25383		54619410	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15-,20+/m0/s1	KUOLKNDJLDMVPT-AUSJPIAWSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K73849129	BRD-K73849129-001-01-1	Broad Institute of MIT and Harvard	BRD-K73849129			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15-,20+/m0/s1	KUOLKNDJLDMVPT-AUSJPIAWSA-N	399.215806438							113951
BRD-K56691168	LSM-44097		54619539	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16+,20-/m0/s1	YMXRISRBAYOBDY-HPPAQTIBSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K56691168	BRD-K56691168-001-01-0	Broad Institute of MIT and Harvard	BRD-K56691168			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16+,20-/m0/s1	YMXRISRBAYOBDY-HPPAQTIBSA-N	439.221954458							
BRD-K52665916	LSM-25385		54619368	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20+,25+/m1/s1	LQAOJDLPUWWIJF-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K52665916	BRD-K52665916-001-01-3	Broad Institute of MIT and Harvard	BRD-K52665916			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20+,25+/m1/s1	LQAOJDLPUWWIJF-RNHFSVANSA-N	524.209340854							113953
BRD-K10241968	LSM-25386		54619525	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28-/m0/s1	YGCNTAWRLGQTMN-VPYPWEPUSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@@H](CN(C)S(=O)(=O)c4ccccc4F)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K10241968	BRD-K10241968-001-01-1	Broad Institute of MIT and Harvard	BRD-K10241968			COc1ccc(cc1)C#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccccc3F)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28-/m0/s1	YGCNTAWRLGQTMN-VPYPWEPUSA-N	616.171320996							113954
BRD-K76970388	LSM-15162		54619466	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15+,20-/m1/s1	DTSMYPYKMZUDTF-QEEYODRMSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K76970388	BRD-K76970388-001-01-8	Broad Institute of MIT and Harvard	BRD-K76970388			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15+,20-/m1/s1	DTSMYPYKMZUDTF-QEEYODRMSA-N	422.167556254							103818
BRD-K24722502	LSM-44098		54619544	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22+,26+/m1/s1	IBJZSIVAOQZUGO-XNUKUIQBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K24722502	BRD-K24722502-001-01-7	Broad Institute of MIT and Harvard	BRD-K24722502			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22+,26+/m1/s1	IBJZSIVAOQZUGO-XNUKUIQBSA-N	522.284220356							
BRD-K54505405	LSM-25388		54619480	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20+,27+/m0/s1	OEKKMSVCCRMVHL-ASHZAFPQSA-N	COc1cccc(c1)c2cnc3O[C@H](CN(C)Cc4ccc(cc4)C(=O)O)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K54505405	BRD-K54505405-001-01-7	Broad Institute of MIT and Harvard	BRD-K54505405			COc1cccc(c1)-c1cnc2O[C@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20+,27+/m0/s1	OEKKMSVCCRMVHL-ASHZAFPQSA-N	533.25258587							113956
MLS003130178	LSM-25389	BRD-K50599016, SID99358827	46903576	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24+,30+/m0/s1	KSFWKEJSKQZBOG-QXFFIUSXSA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K50599016	BRD-K50599016-001-02-3	Broad Institute of MIT and Harvard	BRD-K50599016			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24+,30+/m0/s1	KSFWKEJSKQZBOG-QXFFIUSXSA-N	527.278406694							113957
BRD-K27525139	LSM-25390		54619542	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21+,25+/m1/s1	LJUASEIATGHWBE-CZSZKKDXSA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K27525139	BRD-K27525139-001-01-2	Broad Institute of MIT and Harvard	BRD-K27525139			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21+,25+/m1/s1	LJUASEIATGHWBE-CZSZKKDXSA-N	476.27087847							113958
BRD-K01048404	LSM-15015		54619475	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19+,26-/m1/s1	NAZKFJIDOIPBCY-UYXZNNOOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K01048404	BRD-K01048404-001-01-3	Broad Institute of MIT and Harvard	BRD-K01048404			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19+,26-/m1/s1	NAZKFJIDOIPBCY-UYXZNNOOSA-N	495.233348282							103671
BRD-K31801624	LSM-25391		54619377	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20+,26-/m0/s1	VWUCQBGGJOIZNN-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K31801624	BRD-K31801624-001-01-3	Broad Institute of MIT and Harvard	BRD-K31801624			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc2cc(ccc2S1(=O)=O)-c1cccc(C#N)c1	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20+,26-/m0/s1	VWUCQBGGJOIZNN-UNVFRBQDSA-N	534.19369079							113959
BRD-K68758594	LSM-25392		54619310	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20-,26-/m0/s1	VWUCQBGGJOIZNN-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K68758594	BRD-K68758594-001-01-7	Broad Institute of MIT and Harvard	BRD-K68758594			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc2cc(ccc2S1(=O)=O)-c1cccc(C#N)c1	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20-,26-/m0/s1	VWUCQBGGJOIZNN-DYLHXGEVSA-N	534.19369079							113960
BRD-K20590138	LSM-25393		54619460	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20+,24+/m0/s1	IGZSDNHYZBOXGY-DCLXLUIPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC3CCCC3	BroadT	BRD-K20590138	BRD-K20590138-001-01-4	Broad Institute of MIT and Harvard	BRD-K20590138			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20+,24+/m0/s1	IGZSDNHYZBOXGY-DCLXLUIPSA-N	484.3049558							113961
BRD-K21407905	LSM-15025		54619353	InChI=1S/C24H38N2O4S/c1-5-13-25(4)16-23-18(2)15-26(19(3)17-27)31(28,29)24-12-11-21(14-22(24)30-23)20-9-7-6-8-10-20/h9,11-12,14,18-19,23,27H,5-8,10,13,15-17H2,1-4H3/t18-,19-,23-/m0/s1	GQEOHDGNFBZEER-YDHSSHFGSA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C3=CCCCC3	BroadT	BRD-K21407905	BRD-K21407905-001-01-1	Broad Institute of MIT and Harvard	BRD-K21407905			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C1=CCCCC1	InChI=1S/C24H38N2O4S/c1-5-13-25(4)16-23-18(2)15-26(19(3)17-27)31(28,29)24-12-11-21(14-22(24)30-23)20-9-7-6-8-10-20/h9,11-12,14,18-19,23,27H,5-8,10,13,15-17H2,1-4H3/t18-,19-,23-/m0/s1	GQEOHDGNFBZEER-YDHSSHFGSA-N	450.255228406							103681
BRD-K20361257	LSM-25394		54619452	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22-,27+/m0/s1	NDPUBMYQFYUKKS-BCQCSXDESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K20361257	BRD-K20361257-001-01-5	Broad Institute of MIT and Harvard	BRD-K20361257			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22-,27+/m0/s1	NDPUBMYQFYUKKS-BCQCSXDESA-N	490.294391116							113962
BRD-K35860167	LSM-25395		54619528	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24-,30-/m1/s1	KSFWKEJSKQZBOG-NULUGNBJSA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K35860167	BRD-K35860167-001-01-8	Broad Institute of MIT and Harvard	BRD-K35860167			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24-,30-/m1/s1	KSFWKEJSKQZBOG-NULUGNBJSA-N	527.278406694							113963
BRD-K91779437	LSM-25396		54619568	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20+,24+/m1/s1	RFSJWOMDBGLSJS-NMMYMHLASA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CC3CC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K91779437	BRD-K91779437-001-01-5	Broad Institute of MIT and Harvard	BRD-K91779437			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CC3CC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20+,24+/m1/s1	RFSJWOMDBGLSJS-NMMYMHLASA-N	490.250143026							113964
CHEMBL2355447	LSM-25397	BRD-K47574423, SID131414514	54619390	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16-,20-/m0/s1	RBKHQDVGCDKRON-FTRWYGJKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K47574423	BRD-K47574423-001-01-1	Broad Institute of MIT and Harvard	BRD-K47574423			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16-,20-/m0/s1	RBKHQDVGCDKRON-FTRWYGJKSA-N	525.093304316							113965
BRD-K37848780	LSM-25398		54619484	InChI=1S/C21H26FN3O5S/c1-14-11-25(15(2)13-26)21(27)18-8-5-9-23-20(18)30-19(14)12-24(3)31(28,29)17-7-4-6-16(22)10-17/h4-10,14-15,19,26H,11-13H2,1-3H3/t14-,15+,19-/m0/s1	SJAFAYVALLBCEI-KHYOSLBOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc3ncccc3C1=O	BroadT	BRD-K37848780	BRD-K37848780-001-01-8	Broad Institute of MIT and Harvard	BRD-K37848780			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2ncccc2C1=O	InChI=1S/C21H26FN3O5S/c1-14-11-25(15(2)13-26)21(27)18-8-5-9-23-20(18)30-19(14)12-24(3)31(28,29)17-7-4-6-16(22)10-17/h4-10,14-15,19,26H,11-13H2,1-3H3/t14-,15+,19-/m0/s1	SJAFAYVALLBCEI-KHYOSLBOSA-N	451.157719852							113966
BRD-K55965167	LSM-25399		54619516	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15-,20-/m0/s1	DTSMYPYKMZUDTF-AVYPCKFXSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K55965167	BRD-K55965167-001-01-0	Broad Institute of MIT and Harvard	BRD-K55965167			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15-,20-/m0/s1	DTSMYPYKMZUDTF-AVYPCKFXSA-N	422.167556254							113967
BRD-K76193544	LSM-25400		54619585	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24+,30+/m1/s1	KSFWKEJSKQZBOG-UCTCLUAXSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K76193544	BRD-K76193544-001-01-8	Broad Institute of MIT and Harvard	BRD-K76193544			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24+,30+/m1/s1	KSFWKEJSKQZBOG-UCTCLUAXSA-N	527.278406694							113968
BRD-K43289649-001-01-8	LSM-44099	BRD-K43289649	54619325	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17-,21+/m0/s1	HDXAYIIPFHKWCX-KPYMRYSPSA-N	C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3ccccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K43289649	BRD-K43289649-001-01-8	Broad Institute of MIT and Harvard	BRD-K43289649			C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3ccccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17-,21+/m0/s1	HDXAYIIPFHKWCX-KPYMRYSPSA-N	491.18901998							
BRD-K81732150	LSM-43610		54619535	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21+,28-/m1/s1	RSLDQNPUEWIABH-GMDIBXSSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K81732150	BRD-K81732150-001-01-1	Broad Institute of MIT and Harvard	BRD-K81732150			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21+,28-/m1/s1	RSLDQNPUEWIABH-GMDIBXSSSA-N	585.210898276							
BRD-K29392777	LSM-25402		54619553	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20-,26+/m0/s1	WIHAZNHSVPJONK-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccc(C)cc4	BroadT	BRD-K29392777	BRD-K29392777-001-01-2	Broad Institute of MIT and Harvard	BRD-K29392777			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20-,26+/m0/s1	WIHAZNHSVPJONK-CUVVAGTFSA-N	505.237684734							113970
BRD-K94521090	LSM-44100		54619451	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16+,20-/m1/s1	YMXRISRBAYOBDY-KODQRZTDSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K94521090	BRD-K94521090-001-01-6	Broad Institute of MIT and Harvard	BRD-K94521090			C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16+,20-/m1/s1	YMXRISRBAYOBDY-KODQRZTDSA-N	439.221954458							
BRD-K37565594	LSM-25404		54619346	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20-,27+/m0/s1	OEKKMSVCCRMVHL-OWOAZTCBSA-N	COc1cccc(c1)c2cnc3O[C@H](CN(C)Cc4ccc(cc4)C(=O)O)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K37565594	BRD-K37565594-001-01-4	Broad Institute of MIT and Harvard	BRD-K37565594			COc1cccc(c1)-c1cnc2O[C@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20-,27+/m0/s1	OEKKMSVCCRMVHL-OWOAZTCBSA-N	533.25258587							113972
BRD-K45621617	LSM-25405		54619376	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17+,21-/m1/s1	VRPITXDQEALDAT-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccccc3	BroadT	BRD-K45621617	BRD-K45621617-001-01-8	Broad Institute of MIT and Harvard	BRD-K45621617			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17+,21-/m1/s1	VRPITXDQEALDAT-LLGFUMIMSA-N	418.19262815							113973
BRD-K66145389	LSM-25406		54619493	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20+,24+/m1/s1	IGZSDNHYZBOXGY-NMMYMHLASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC3CCCC3	BroadT	BRD-K66145389	BRD-K66145389-001-01-8	Broad Institute of MIT and Harvard	BRD-K66145389			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20+,24+/m1/s1	IGZSDNHYZBOXGY-NMMYMHLASA-N	484.3049558							113974
BRD-K79080366	LSM-15055		54619464	InChI=1S/C27H35N3O4/c1-6-13-29(4)17-25-19(2)16-30(20(3)18-31)27(32)23-14-21(15-28-26(23)34-25)11-12-22-9-7-8-10-24(22)33-5/h7-10,14-15,19-20,25,31H,6,13,16-18H2,1-5H3/t19-,20+,25-/m0/s1	CXNSNJNJSOSVDN-DFIYOIEZSA-N	CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc3ccccc3OC	BroadT	BRD-K79080366	BRD-K79080366-001-01-9	Broad Institute of MIT and Harvard	BRD-K79080366			CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc1ccccc1OC	InChI=1S/C27H35N3O4/c1-6-13-29(4)17-25-19(2)16-30(20(3)18-31)27(32)23-14-21(15-28-26(23)34-25)11-12-22-9-7-8-10-24(22)33-5/h7-10,14-15,19-20,25,31H,6,13,16-18H2,1-5H3/t19-,20+,25-/m0/s1	CXNSNJNJSOSVDN-DFIYOIEZSA-N	465.26275663							103711
MLS003130102	LSM-25407	BRD-K26180392, SID99358682	46903461	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19+,26+/m1/s1	NAZKFJIDOIPBCY-MVYHEMRASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K26180392	BRD-K26180392-001-02-7	Broad Institute of MIT and Harvard	BRD-K26180392			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19+,26+/m1/s1	NAZKFJIDOIPBCY-MVYHEMRASA-N	495.233348282							113975
CHEMBL2357344	LSM-25408	BRD-K14241686, SID131414489	54619365	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28+/m0/s1	YGCNTAWRLGQTMN-RXYILKCJSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@H](CN(C)S(=O)(=O)c4ccccc4F)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K14241686	BRD-K14241686-001-01-8	Broad Institute of MIT and Harvard	BRD-K14241686			COc1ccc(cc1)C#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccccc3F)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28+/m0/s1	YGCNTAWRLGQTMN-RXYILKCJSA-N	616.171320996							113976
BRD-K20549184	LSM-25409		54619498	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20+,24+/m0/s1	RFSJWOMDBGLSJS-DCLXLUIPSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)CC3CC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K20549184	BRD-K20549184-001-01-3	Broad Institute of MIT and Harvard	BRD-K20549184			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)CC3CC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20+,24+/m0/s1	RFSJWOMDBGLSJS-DCLXLUIPSA-N	490.250143026							113977
MLS003130073	LSM-25410	BRD-K13781734, SID121282544	51358838	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28-/m1/s1	YGCNTAWRLGQTMN-DQCZWYHMSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@H](CN(C)S(=O)(=O)c4ccccc4F)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K13781734	BRD-K13781734-001-02-4	Broad Institute of MIT and Harvard	BRD-K13781734			COc1ccc(cc1)C#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28-/m1/s1	YGCNTAWRLGQTMN-DQCZWYHMSA-N	616.171320996							113978
MLS003130198	LSM-25411	SID99358994, BRD-K18117162, SID131414634	46903687	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24+,30-/m1/s1	KSFWKEJSKQZBOG-HTWFIQDWSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K18117162	BRD-K18117162-001-02-7	Broad Institute of MIT and Harvard	BRD-K18117162			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24+,30-/m1/s1	KSFWKEJSKQZBOG-HTWFIQDWSA-N	527.278406694							113979
BRD-K08318631	LSM-15107		54619426	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21+,25-/m0/s1	LJUASEIATGHWBE-BKSPAHHJSA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K08318631	BRD-K08318631-001-01-8	Broad Institute of MIT and Harvard	BRD-K08318631			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21+,25-/m0/s1	LJUASEIATGHWBE-BKSPAHHJSA-N	476.27087847							103763
BRD-K37919122	LSM-25412		54619398	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22-,27-/m0/s1	NDPUBMYQFYUKKS-BERHBOFZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K37919122	BRD-K37919122-001-01-4	Broad Institute of MIT and Harvard	BRD-K37919122			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22-,27-/m0/s1	NDPUBMYQFYUKKS-BERHBOFZSA-N	490.294391116							113980
CHEMBL2361704	LSM-25413	SID131414603, BRD-K01334037	54619476	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17+,21+/m1/s1	MKFDRGBJPDLEFY-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K01334037	BRD-K01334037-001-01-2	Broad Institute of MIT and Harvard	BRD-K01334037			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17+,21+/m1/s1	MKFDRGBJPDLEFY-WWMYMODYSA-N	560.065040648							113981
BRD-K23333192	LSM-25414		54619396	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17+,21+/m1/s1	VRPITXDQEALDAT-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccccc3	BroadT	BRD-K23333192	BRD-K23333192-001-01-9	Broad Institute of MIT and Harvard	BRD-K23333192			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17+,21+/m1/s1	VRPITXDQEALDAT-WWMYMODYSA-N	418.19262815							113982
BRD-K29469525	LSM-25415		54619437	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20-,27+/m1/s1	TXBXSWUOPNBBNR-DVHCVUMVSA-N	COc1cccc(c1)c2ccc3c(O[C@@H](CN(C)C(=O)c4ccccc4F)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K29469525	BRD-K29469525-001-01-3	Broad Institute of MIT and Harvard	BRD-K29469525			COc1cccc(c1)-c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20-,27+/m1/s1	TXBXSWUOPNBBNR-DVHCVUMVSA-N	556.204335686							113983
BRD-K46085646	LSM-25416		54619307	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20+,25+/m1/s1	HTMGNWWTKIFEMM-RNHFSVANSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)C#CCN(C)C)cc1	BroadT	BRD-K46085646	BRD-K46085646-001-01-0	Broad Institute of MIT and Harvard	BRD-K46085646			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)C#CCN(C)C)cc1	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20+,25+/m1/s1	HTMGNWWTKIFEMM-RNHFSVANSA-N	523.279469334							113984
BRD-K18978449	LSM-25417		54619517	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18+,23-/m0/s1	JVFXTLNLNPGAHH-IXFSTUDKSA-N	CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K18978449	BRD-K18978449-001-01-9	Broad Institute of MIT and Harvard	BRD-K18978449			CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18+,23-/m0/s1	JVFXTLNLNPGAHH-IXFSTUDKSA-N	490.213757518							113985
BRD-K56258950	LSM-25418		54619467	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20+,24-/m0/s1	IGZSDNHYZBOXGY-ROKPMTFOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC3CCCC3	BroadT	BRD-K56258950	BRD-K56258950-001-01-0	Broad Institute of MIT and Harvard	BRD-K56258950			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20+,24-/m0/s1	IGZSDNHYZBOXGY-ROKPMTFOSA-N	484.3049558							113986
BRD-K79885457	LSM-44101		54619580	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22-,27-/m1/s1	HITOKJYCRKZWGL-WJIQLTTISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K79885457	BRD-K79885457-001-01-1	Broad Institute of MIT and Harvard	BRD-K79885457			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22-,27-/m1/s1	HITOKJYCRKZWGL-WJIQLTTISA-N	520.3049558							
BRD-K71357636	LSM-25420		54619511	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28-/m1/s1	YGCNTAWRLGQTMN-RZIGYZOXSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@H](CN(C)S(=O)(=O)c4ccccc4F)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K71357636	BRD-K71357636-001-01-3	Broad Institute of MIT and Harvard	BRD-K71357636			COc1ccc(cc1)C#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccccc3F)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28-/m1/s1	YGCNTAWRLGQTMN-RZIGYZOXSA-N	616.171320996							113988
BRD-K97330035	LSM-25421		54619474	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20+,26-/m0/s1	WIHAZNHSVPJONK-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccc(C)cc4	BroadT	BRD-K97330035	BRD-K97330035-001-01-7	Broad Institute of MIT and Harvard	BRD-K97330035			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20+,26-/m0/s1	WIHAZNHSVPJONK-UNVFRBQDSA-N	505.237684734							113989
BRD-K98927248	LSM-25422		54619583	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24+,30+/m0/s1	KSFWKEJSKQZBOG-GBXOJDCZSA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K98927248	BRD-K98927248-001-01-2	Broad Institute of MIT and Harvard	BRD-K98927248			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24+,30+/m0/s1	KSFWKEJSKQZBOG-GBXOJDCZSA-N	527.278406694							113990
BRD-K73523458	LSM-25423		54619328	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24+,30-/m0/s1	KSFWKEJSKQZBOG-YTNVWYNJSA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K73523458	BRD-K73523458-001-01-3	Broad Institute of MIT and Harvard	BRD-K73523458			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24+,30-/m0/s1	KSFWKEJSKQZBOG-YTNVWYNJSA-N	527.278406694							113991
BRD-K20942146	LSM-25424		54619389	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17+,22+/m0/s1	NTWQDWFFMZTMNG-GSHUGGBRSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K20942146	BRD-K20942146-001-01-7	Broad Institute of MIT and Harvard	BRD-K20942146			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17+,22+/m0/s1	NTWQDWFFMZTMNG-GSHUGGBRSA-N	466.2216201							113992
BRD-K45663146	LSM-25425		54619357	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17-,23+/m0/s1	BTFHKXNDUYKHCV-HKARXFIJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K45663146	BRD-K45663146-001-01-0	Broad Institute of MIT and Harvard	BRD-K45663146			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17-,23+/m0/s1	BTFHKXNDUYKHCV-HKARXFIJSA-N	469.237684734							113993
BRD-K29842194	LSM-25426		54619423	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22-,30-/m0/s1	MYWSUSXCAZFZDP-PWWNZBMUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5cccc(c5)C(=O)N(C)C	BroadT	BRD-K29842194	BRD-K29842194-001-01-1	Broad Institute of MIT and Harvard	BRD-K29842194			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22-,30-/m0/s1	MYWSUSXCAZFZDP-PWWNZBMUSA-N	609.250871308							113994
CHEMBL3182991	LSM-44102	BRD-K91671568	54619383	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21-,28+/m1/s1	RSLDQNPUEWIABH-AARMAHPWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K91671568	BRD-K91671568-001-01-5	Broad Institute of MIT and Harvard	BRD-K91671568			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21-,28+/m1/s1	RSLDQNPUEWIABH-AARMAHPWSA-N	585.210898276							
BRD-K20644549	LSM-44103		54619394	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22-,26-/m0/s1	IBJZSIVAOQZUGO-QTKKMDQUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K20644549	BRD-K20644549-001-01-2	Broad Institute of MIT and Harvard	BRD-K20644549			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22-,26-/m0/s1	IBJZSIVAOQZUGO-QTKKMDQUSA-N	522.284220356							
BRD-K50351738	LSM-15038		54619572	InChI=1S/C24H38N2O4S/c1-5-13-25(4)16-23-18(2)15-26(19(3)17-27)31(28,29)24-12-11-21(14-22(24)30-23)20-9-7-6-8-10-20/h9,11-12,14,18-19,23,27H,5-8,10,13,15-17H2,1-4H3/t18-,19+,23+/m1/s1	GQEOHDGNFBZEER-MSYCTHLASA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C3=CCCCC3	BroadT	BRD-K50351738	BRD-K50351738-001-01-8	Broad Institute of MIT and Harvard	BRD-K50351738			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCCC1	InChI=1S/C24H38N2O4S/c1-5-13-25(4)16-23-18(2)15-26(19(3)17-27)31(28,29)24-12-11-21(14-22(24)30-23)20-9-7-6-8-10-20/h9,11-12,14,18-19,23,27H,5-8,10,13,15-17H2,1-4H3/t18-,19+,23+/m1/s1	GQEOHDGNFBZEER-MSYCTHLASA-N	450.255228406							103694
BRD-K68364310	LSM-44104		54619343	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22+,27+/m1/s1	HITOKJYCRKZWGL-QZNGNUFOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K68364310	BRD-K68364310-001-01-7	Broad Institute of MIT and Harvard	BRD-K68364310			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22+,27+/m1/s1	HITOKJYCRKZWGL-QZNGNUFOSA-N	520.3049558							
BRD-K39978929	LSM-25430		54619314	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21-,27+/m1/s1	QMNGWUQFDFUPIZ-GNMOFYLKSA-N	COc1cccc(c1)C#Cc2cnc3O[C@@H](CN(C)C(=O)C4CCOCC4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K39978929	BRD-K39978929-001-01-3	Broad Institute of MIT and Harvard	BRD-K39978929			COc1cccc(c1)C#Cc1cnc2O[C@@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21-,27+/m1/s1	QMNGWUQFDFUPIZ-GNMOFYLKSA-N	535.268235934							113998
BRD-K03308716	LSM-25431		44505290	InChI=1S/C28H29FN4O5S/c1-18-15-33(19(2)17-34)28(35)25-12-22(21-5-4-6-23(29)11-21)14-31-27(25)38-26(18)16-32(3)39(36,37)24-9-7-20(13-30)8-10-24/h4-12,14,18-19,26,34H,15-17H2,1-3H3/t18-,19+,26-/m0/s1	VPMPMBMAXPBCKB-ANSQWYIGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K03308716	BRD-K03308716-001-01-2	Broad Institute of MIT and Harvard	BRD-K03308716			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C28H29FN4O5S/c1-18-15-33(19(2)17-34)28(35)25-12-22(21-5-4-6-23(29)11-21)14-31-27(25)38-26(18)16-32(3)39(36,37)24-9-7-20(13-30)8-10-24/h4-12,14,18-19,26,34H,15-17H2,1-3H3/t18-,19+,26-/m0/s1	VPMPMBMAXPBCKB-ANSQWYIGSA-N	552.184268958							113999
BRD-K38218737	LSM-25432		54619478	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24-,30-/m0/s1	KSFWKEJSKQZBOG-CQUCHYGKSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K38218737	BRD-K38218737-001-01-7	Broad Institute of MIT and Harvard	BRD-K38218737			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24-,30-/m0/s1	KSFWKEJSKQZBOG-CQUCHYGKSA-N	527.278406694							114000
BRD-K16991828	LSM-25433		54619596	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20-,25+/m0/s1	QGQQAQHDJARTFG-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K16991828	BRD-K16991828-001-01-5	Broad Institute of MIT and Harvard	BRD-K16991828			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20-,25+/m0/s1	QGQQAQHDJARTFG-ZYLNGJIFSA-N	520.26070771							114001
BRD-K97732674	LSM-25434		54619323	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21-,27-/m1/s1	QMNGWUQFDFUPIZ-LGVUCKNBSA-N	COc1cccc(c1)C#Cc2cnc3O[C@H](CN(C)C(=O)C4CCOCC4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K97732674	BRD-K97732674-001-01-0	Broad Institute of MIT and Harvard	BRD-K97732674			COc1cccc(c1)C#Cc1cnc2O[C@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21-,27-/m1/s1	QMNGWUQFDFUPIZ-LGVUCKNBSA-N	535.268235934							114002
BRD-K11752384	LSM-25435		54619363	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21-,25+/m0/s1	LJUASEIATGHWBE-STWLZBDKSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K11752384	BRD-K11752384-001-01-2	Broad Institute of MIT and Harvard	BRD-K11752384			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21-,25+/m0/s1	LJUASEIATGHWBE-STWLZBDKSA-N	476.27087847							114003
CHEMBL2355421	LSM-25436	BRD-K12624449, SID131414530	54619406	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17+,21-/m0/s1	MKFDRGBJPDLEFY-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K12624449	BRD-K12624449-001-01-5	Broad Institute of MIT and Harvard	BRD-K12624449			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17+,21-/m0/s1	MKFDRGBJPDLEFY-FVJLSDCUSA-N	560.065040648							114004
BRD-K92804652	LSM-25437		54619400	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22+,27+/m1/s1	NDPUBMYQFYUKKS-VHSZZVNMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K92804652	BRD-K92804652-001-01-8	Broad Institute of MIT and Harvard	BRD-K92804652			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22+,27+/m1/s1	NDPUBMYQFYUKKS-VHSZZVNMSA-N	490.294391116							114005
BRD-K39592958	LSM-25438		54619349	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22-,27-/m1/s1	NDPUBMYQFYUKKS-VHFRWLAGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K39592958	BRD-K39592958-001-01-6	Broad Institute of MIT and Harvard	BRD-K39592958			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22-,27-/m1/s1	NDPUBMYQFYUKKS-VHFRWLAGSA-N	490.294391116							114006
BRD-K89390280	LSM-15064		54619477	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19-,26+/m0/s1	NAZKFJIDOIPBCY-LZJCXSABSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K89390280	BRD-K89390280-001-01-3	Broad Institute of MIT and Harvard	BRD-K89390280			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19-,26+/m0/s1	NAZKFJIDOIPBCY-LZJCXSABSA-N	495.233348282							103720
BRD-K93561942-001-01-3	LSM-44105	BRD-K93561942	44498564	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22+,27-/m0/s1	HITOKJYCRKZWGL-BREITOETSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K93561942	BRD-K93561942-001-02-1	Broad Institute of MIT and Harvard	BRD-K93561942			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22+,27-/m0/s1	HITOKJYCRKZWGL-BREITOETSA-N	520.3049558							
BRD-K60806315	LSM-25440		54619373	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20-,24+/m0/s1	IGZSDNHYZBOXGY-MZLICYQSSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC3CCCC3	BroadT	BRD-K60806315	BRD-K60806315-001-01-0	Broad Institute of MIT and Harvard	BRD-K60806315			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20-,24+/m0/s1	IGZSDNHYZBOXGY-MZLICYQSSA-N	484.3049558							114008
BRD-K66278562	LSM-25441		54619414	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20-,26-/m1/s1	WIHAZNHSVPJONK-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccc(C)cc4	BroadT	BRD-K66278562	BRD-K66278562-001-01-6	Broad Institute of MIT and Harvard	BRD-K66278562			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20-,26-/m1/s1	WIHAZNHSVPJONK-XMERXJNXSA-N	505.237684734							114009
MLS003128985	LSM-25442	BRD-K79658624, SID99359548	46904110	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16+,20+/m0/s1	RBKHQDVGCDKRON-RZQQEMMASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K79658624	BRD-K79658624-001-02-8	Broad Institute of MIT and Harvard	BRD-K79658624			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16+,20+/m0/s1	RBKHQDVGCDKRON-RZQQEMMASA-N	525.093304316							114010
BRD-K57075511	LSM-44106		54619425	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21-,28+/m0/s1	RSLDQNPUEWIABH-UPNVNQCQSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K57075511	BRD-K57075511-001-01-9	Broad Institute of MIT and Harvard	BRD-K57075511			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21-,28+/m0/s1	RSLDQNPUEWIABH-UPNVNQCQSA-N	585.210898276							
BRD-K72872864	LSM-25444		54619506	InChI=1S/C30H38N2O6S/c1-21-17-32(22(2)20-33)39(36,37)29-15-14-24(13-12-23-8-4-5-9-23)16-27(29)38-28(21)19-31(3)18-25-10-6-7-11-26(25)30(34)35/h6-7,10-11,14-16,21-23,28,33H,4-5,8-9,17-20H2,1-3H3,(H,34,35)/t21-,22+,28-/m0/s1	SXNCWASTISCGFX-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(=O)O)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K72872864	BRD-K72872864-001-01-3	Broad Institute of MIT and Harvard	BRD-K72872864			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(O)=O)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C30H38N2O6S/c1-21-17-32(22(2)20-33)39(36,37)29-15-14-24(13-12-23-8-4-5-9-23)16-27(29)38-28(21)19-31(3)18-25-10-6-7-11-26(25)30(34)35/h6-7,10-11,14-16,21-23,28,33H,4-5,8-9,17-20H2,1-3H3,(H,34,35)/t21-,22+,28-/m0/s1	SXNCWASTISCGFX-TYPXCFOJSA-N	554.245057646							114012
BRD-K61687409	LSM-25445		54619401	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17+,21-/m1/s1	MKFDRGBJPDLEFY-LLGFUMIMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K61687409	BRD-K61687409-001-01-0	Broad Institute of MIT and Harvard	BRD-K61687409			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17+,21-/m1/s1	MKFDRGBJPDLEFY-LLGFUMIMSA-N	560.065040648							114013
BRD-K42185771	LSM-25446		54619441	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21-,27-/m0/s1	XVNXZMOLFFKQAU-IZVMNLJQSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)CC4CCOCC4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K42185771	BRD-K42185771-001-01-9	Broad Institute of MIT and Harvard	BRD-K42185771			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21-,27-/m0/s1	XVNXZMOLFFKQAU-IZVMNLJQSA-N	532.26070771							114014
BRD-K45010872	LSM-25447		54619499	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20-,27-/m0/s1	TXBXSWUOPNBBNR-OSOCVKALSA-N	COc1cccc(c1)c2ccc3c(O[C@@H](CN(C)C(=O)c4ccccc4F)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K45010872	BRD-K45010872-001-01-4	Broad Institute of MIT and Harvard	BRD-K45010872			COc1cccc(c1)-c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3F)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20-,27-/m0/s1	TXBXSWUOPNBBNR-OSOCVKALSA-N	556.204335686							114015
MLS003130141	LSM-25448	BRD-K00328666, SID99358790	46903539	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20-,27-/m1/s1	TXBXSWUOPNBBNR-SEXOINJZSA-N	COc1cccc(c1)c2ccc3c(O[C@H](CN(C)C(=O)c4ccccc4F)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K00328666	BRD-K00328666-001-02-1	Broad Institute of MIT and Harvard	BRD-K00328666			COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20-,27-/m1/s1	TXBXSWUOPNBBNR-SEXOINJZSA-N	556.204335686							114016
MLS003128982	LSM-25449	BRD-K57059449, SID99359545	46904107	InChI=1S/C22H26BrFN4O4/c1-13-10-28(14(2)12-29)21(30)16-8-15(23)9-25-20(16)32-19(13)11-27(3)22(31)26-18-7-5-4-6-17(18)24/h4-9,13-14,19,29H,10-12H2,1-3H3,(H,26,31)/t13-,14+,19+/m0/s1	FEPFVQGWSVEBSO-IQUTYRLHSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K57059449	BRD-K57059449-001-01-0	Broad Institute of MIT and Harvard	BRD-K57059449			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H26BrFN4O4/c1-13-10-28(14(2)12-29)21(30)16-8-15(23)9-25-20(16)32-19(13)11-27(3)22(31)26-18-7-5-4-6-17(18)24/h4-9,13-14,19,29H,10-12H2,1-3H3,(H,26,31)/t13-,14+,19+/m0/s1	FEPFVQGWSVEBSO-IQUTYRLHSA-N	508.112146152							114017
BRD-K67027685	LSM-25450		54619509	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28-/m0/s1	YGCNTAWRLGQTMN-TYPXCFOJSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@@H](CN(C)S(=O)(=O)c4ccccc4F)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K67027685	BRD-K67027685-001-01-8	Broad Institute of MIT and Harvard	BRD-K67027685			COc1ccc(cc1)C#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccccc3F)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28-/m0/s1	YGCNTAWRLGQTMN-TYPXCFOJSA-N	616.171320996							114018
BRD-K86773205	LSM-25451		54619417	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20-,26+/m0/s1	VWUCQBGGJOIZNN-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K86773205	BRD-K86773205-001-01-5	Broad Institute of MIT and Harvard	BRD-K86773205			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc2cc(ccc2S1(=O)=O)-c1cccc(C#N)c1	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20-,26+/m0/s1	VWUCQBGGJOIZNN-CUVVAGTFSA-N	534.19369079							114019
BRD-K12517207	LSM-44107		54619599	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17-,21-/m1/s1	HDXAYIIPFHKWCX-SULFBMQTSA-N	C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K12517207	BRD-K12517207-001-01-3	Broad Institute of MIT and Harvard	BRD-K12517207			C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17-,21-/m1/s1	HDXAYIIPFHKWCX-SULFBMQTSA-N	491.18901998							
BRD-K12492021	LSM-25453		54619321	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17-,21-/m0/s1	VRPITXDQEALDAT-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccccc3	BroadT	BRD-K12492021	BRD-K12492021-001-01-3	Broad Institute of MIT and Harvard	BRD-K12492021			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17-,21-/m0/s1	VRPITXDQEALDAT-FIKGOQFSSA-N	418.19262815							114021
BRD-K47572485	LSM-25454		54619399	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17-,22+/m1/s1	NTWQDWFFMZTMNG-YVHKJVDXSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K47572485	BRD-K47572485-001-01-0	Broad Institute of MIT and Harvard	BRD-K47572485			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17-,22+/m1/s1	NTWQDWFFMZTMNG-YVHKJVDXSA-N	466.2216201							114022
BRD-K32839286	LSM-25455		54619333	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24+,30-/m1/s1	KSFWKEJSKQZBOG-DLWGQWRRSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K32839286	BRD-K32839286-001-01-1	Broad Institute of MIT and Harvard	BRD-K32839286			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24+,30-/m1/s1	KSFWKEJSKQZBOG-DLWGQWRRSA-N	527.278406694							114023
BRD-K16154498	LSM-25456		54619455	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20+,25+/m0/s1	XPLVEXAVWRQRFN-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cncnc2)Oc3ncc(cc3C1=O)c4ccccc4C	BroadT	BRD-K16154498	BRD-K16154498-001-01-9	Broad Institute of MIT and Harvard	BRD-K16154498			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cncnc2)Oc2ncc(cc2C1=O)-c1ccccc1C	InChI=1S/C27H33N5O3/c1-18-7-5-6-8-23(18)22-9-24-26(30-12-22)35-25(15-31(4)14-21-10-28-17-29-11-21)19(2)13-32(27(24)34)20(3)16-33/h5-12,17,19-20,25,33H,13-16H2,1-4H3/t19-,20+,25+/m0/s1	XPLVEXAVWRQRFN-WZOHSFFVSA-N	475.258339966							114024
BRD-K09112411	LSM-25457		54619387	InChI=1S/C19H29BrN2O4S/c1-13-9-22(14(2)12-23)27(24,25)19-7-6-16(20)8-17(19)26-18(13)11-21(3)10-15-4-5-15/h6-8,13-15,18,23H,4-5,9-12H2,1-3H3/t13-,14-,18-/m0/s1	NQKVBKPKEYEFNC-DEYYWGMASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K09112411	BRD-K09112411-001-01-0	Broad Institute of MIT and Harvard	BRD-K09112411			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C19H29BrN2O4S/c1-13-9-22(14(2)12-23)27(24,25)19-7-6-16(20)8-17(19)26-18(13)11-21(3)10-15-4-5-15/h6-8,13-15,18,23H,4-5,9-12H2,1-3H3/t13-,14-,18-/m0/s1	NQKVBKPKEYEFNC-DEYYWGMASA-N	460.103140718							114025
BRD-K21423050	LSM-25458		54619592	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20+,25-/m0/s1	QGQQAQHDJARTFG-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K21423050	BRD-K21423050-001-01-1	Broad Institute of MIT and Harvard	BRD-K21423050			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20+,25-/m0/s1	QGQQAQHDJARTFG-DFIYOIEZSA-N	520.26070771							114026
BRD-K21433749	LSM-25459		54619579	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24+,30+/m1/s1	KSFWKEJSKQZBOG-QAAVFVPKSA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K21433749	BRD-K21433749-001-01-7	Broad Institute of MIT and Harvard	BRD-K21433749			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24+,30+/m1/s1	KSFWKEJSKQZBOG-QAAVFVPKSA-N	527.278406694							114027
BRD-K60238606	LSM-25460		54619440	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17-,23-/m0/s1	XVANEVHAXZLZTM-QQMNAOGKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C)Oc2ncc(cc2C1=O)C#Cc3ccc(F)cc3	BroadT	BRD-K60238606	BRD-K60238606-001-01-4	Broad Institute of MIT and Harvard	BRD-K60238606			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(C)=O)Oc2ncc(cc2C1=O)C#Cc1ccc(F)cc1	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17-,23-/m0/s1	XVANEVHAXZLZTM-QQMNAOGKSA-N	453.206384606							114028
BRD-K63394284	LSM-25461		54619311	InChI=1S/C19H28N2O5S/c1-14-12-21(15(2)13-22)27(23,24)19-8-7-16(6-5-9-25-4)10-17(19)26-18(14)11-20-3/h7-8,10,14-15,18,20,22H,9,11-13H2,1-4H3/t14-,15-,18+/m0/s1	LUVAADAAXLMVKF-RLFYNMQTSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCOC	BroadT	BRD-K63394284	BRD-K63394284-001-01-1	Broad Institute of MIT and Harvard	BRD-K63394284			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCOC	InChI=1S/C19H28N2O5S/c1-14-12-21(15(2)13-22)27(23,24)19-8-7-16(6-5-9-25-4)10-17(19)26-18(14)11-20-3/h7-8,10,14-15,18,20,22H,9,11-13H2,1-4H3/t14-,15-,18+/m0/s1	LUVAADAAXLMVKF-RLFYNMQTSA-N	396.171892706							114029
BRD-K36176133	LSM-25462		54619534	InChI=1S/C20H27N3O4S/c1-14-12-23(15(2)13-24)28(25,26)20-7-6-16(17-5-4-8-22-10-17)9-18(20)27-19(14)11-21-3/h4-10,14-15,19,21,24H,11-13H2,1-3H3/t14-,15-,19+/m1/s1	GQINMCYFQWJTAV-CLCXKQKWSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3cccnc3	BroadT	BRD-K36176133	BRD-K36176133-001-01-9	Broad Institute of MIT and Harvard	BRD-K36176133			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1cccnc1	InChI=1S/C20H27N3O4S/c1-14-12-23(15(2)13-24)28(25,26)20-7-6-16(17-5-4-8-22-10-17)9-18(20)27-19(14)11-21-3/h4-10,14-15,19,21,24H,11-13H2,1-3H3/t14-,15-,19+/m1/s1	GQINMCYFQWJTAV-CLCXKQKWSA-N	405.172227064							114030
BRD-K68347834	LSM-25463		54619496	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28+/m1/s1	YGCNTAWRLGQTMN-WENCSYSZSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@@H](CN(C)S(=O)(=O)c4ccccc4F)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K68347834	BRD-K68347834-001-01-9	Broad Institute of MIT and Harvard	BRD-K68347834			COc1ccc(cc1)C#Cc1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccccc3F)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28+/m1/s1	YGCNTAWRLGQTMN-WENCSYSZSA-N	616.171320996							114031
BRD-K54637865	LSM-25464		54619573	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21+,27-/m0/s1	QMNGWUQFDFUPIZ-ISCCLHIJSA-N	COc1cccc(c1)C#Cc2cnc3O[C@@H](CN(C)C(=O)C4CCOCC4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K54637865	BRD-K54637865-001-01-1	Broad Institute of MIT and Harvard	BRD-K54637865			COc1cccc(c1)C#Cc1cnc2O[C@@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21+,27-/m0/s1	QMNGWUQFDFUPIZ-ISCCLHIJSA-N	535.268235934							114032
BRD-K65423474	LSM-25465		54619403	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19+,22-/m1/s1	BYBGYSIHVXXZCT-XQBPLPMBSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)CN(C)C)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K65423474	BRD-K65423474-001-01-6	Broad Institute of MIT and Harvard	BRD-K65423474			CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)CN(C)C)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19+,22-/m1/s1	BYBGYSIHVXXZCT-XQBPLPMBSA-N	479.245392004							114033
BRD-K67626097	LSM-25466		54619407	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17+,23-/m0/s1	XVANEVHAXZLZTM-MFEFFIJZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C)Oc2ncc(cc2C1=O)C#Cc3ccc(F)cc3	BroadT	BRD-K67626097	BRD-K67626097-001-01-9	Broad Institute of MIT and Harvard	BRD-K67626097			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(C)=O)Oc2ncc(cc2C1=O)C#Cc1ccc(F)cc1	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17+,23-/m0/s1	XVANEVHAXZLZTM-MFEFFIJZSA-N	453.206384606							114034
BRD-K07437885	LSM-25467		54619386	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20-,25-/m1/s1	HTMGNWWTKIFEMM-UMEGOILYSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)C#CCN(C)C)cc1	BroadT	BRD-K07437885	BRD-K07437885-001-01-0	Broad Institute of MIT and Harvard	BRD-K07437885			COc1ccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)C#CCN(C)C)cc1	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20-,25-/m1/s1	HTMGNWWTKIFEMM-UMEGOILYSA-N	523.279469334							114035
BRD-K75909618	LSM-25468		54619512	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15-,20+/m1/s1	KUOLKNDJLDMVPT-SXGZJXTBSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K75909618	BRD-K75909618-001-01-9	Broad Institute of MIT and Harvard	BRD-K75909618			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15-,20+/m1/s1	KUOLKNDJLDMVPT-SXGZJXTBSA-N	399.215806438							114036
MLS003129081	LSM-25469	BRD-K08416880, SID99359686	46904248	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16-,20+/m1/s1	RBKHQDVGCDKRON-QINHECLXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K08416880	BRD-K08416880-001-02-6	Broad Institute of MIT and Harvard	BRD-K08416880			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16-,20+/m1/s1	RBKHQDVGCDKRON-QINHECLXSA-N	525.093304316							114037
BRD-K00177096	LSM-15093		54619430	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21+,25+/m0/s1	LJUASEIATGHWBE-BPYKYCOYSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K00177096	BRD-K00177096-001-01-4	Broad Institute of MIT and Harvard	BRD-K00177096			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21+,25+/m0/s1	LJUASEIATGHWBE-BPYKYCOYSA-N	476.27087847							103749
CHEMBL3183631	LSM-25470	BRD-K03371288	54619448	InChI=1S/C30H36N2O7S/c1-20-15-32(21(2)18-33)40(34,35)30-12-10-23(24-7-5-6-8-25(24)36-4)14-28(30)39-29(20)17-31(3)16-22-9-11-26-27(13-22)38-19-37-26/h5-14,20-21,29,33H,15-19H2,1-4H3/t20-,21-,29-/m0/s1	YWADXHNDBHGHLS-WURXVLGASA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)Cc4ccc5OCOc5c4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K03371288	BRD-K03371288-001-01-8	Broad Institute of MIT and Harvard	BRD-K03371288			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H36N2O7S/c1-20-15-32(21(2)18-33)40(34,35)30-12-10-23(24-7-5-6-8-25(24)36-4)14-28(30)39-29(20)17-31(3)16-22-9-11-26-27(13-22)38-19-37-26/h5-14,20-21,29,33H,15-19H2,1-4H3/t20-,21-,29-/m0/s1	YWADXHNDBHGHLS-WURXVLGASA-N	568.224322202							114038
BRD-K90313630	LSM-25471		54619469	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17-,21+/m1/s1	MKFDRGBJPDLEFY-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K90313630	BRD-K90313630-001-01-9	Broad Institute of MIT and Harvard	BRD-K90313630			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17-,21+/m1/s1	MKFDRGBJPDLEFY-LZJOCLMNSA-N	560.065040648							114039
BRD-K01899298	LSM-25472		54619319	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22-,30-/m1/s1	MYWSUSXCAZFZDP-NPKFRGRUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5cccc(c5)C(=O)N(C)C	BroadT	BRD-K01899298	BRD-K01899298-001-01-8	Broad Institute of MIT and Harvard	BRD-K01899298			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22-,30-/m1/s1	MYWSUSXCAZFZDP-NPKFRGRUSA-N	609.250871308							114040
BRD-K15282144	LSM-25473		54619415	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19-,22+/m1/s1	BYBGYSIHVXXZCT-KNKQGSTJSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CN(C)C)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K15282144	BRD-K15282144-001-01-7	Broad Institute of MIT and Harvard	BRD-K15282144			CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CN(C)C)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19-,22+/m1/s1	BYBGYSIHVXXZCT-KNKQGSTJSA-N	479.245392004							114041
BRD-K93884191	LSM-25474		54619524	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19-,22+/m0/s1	BYBGYSIHVXXZCT-CNNODRBYSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)CN(C)C)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K93884191	BRD-K93884191-001-01-7	Broad Institute of MIT and Harvard	BRD-K93884191			CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)CN(C)C)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19-,22+/m0/s1	BYBGYSIHVXXZCT-CNNODRBYSA-N	479.245392004							114042
BRD-K70558130	LSM-25475		54619566	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20+,25-/m1/s1	LQAOJDLPUWWIJF-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K70558130	BRD-K70558130-001-01-8	Broad Institute of MIT and Harvard	BRD-K70558130			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20+,25-/m1/s1	LQAOJDLPUWWIJF-OHUGHZGNSA-N	524.209340854							114043
BRD-K84974041	LSM-25476		54619355	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18+,23-/m1/s1	JVFXTLNLNPGAHH-IEGUWTFLSA-N	CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K84974041	BRD-K84974041-001-01-9	Broad Institute of MIT and Harvard	BRD-K84974041			CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18+,23-/m1/s1	JVFXTLNLNPGAHH-IEGUWTFLSA-N	490.213757518							114044
BRD-K87690520	LSM-25477		54619326	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24-,30+/m1/s1	KSFWKEJSKQZBOG-KJMNMTOCSA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K87690520	BRD-K87690520-001-01-8	Broad Institute of MIT and Harvard	BRD-K87690520			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24-,30+/m1/s1	KSFWKEJSKQZBOG-KJMNMTOCSA-N	527.278406694							114045
MLS003129952	LSM-25478	BRD-K62309791	46903326	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17+,21+/m0/s1	MKFDRGBJPDLEFY-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K62309791	BRD-K62309791-001-02-4	Broad Institute of MIT and Harvard	BRD-K62309791			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17+,21+/m0/s1	MKFDRGBJPDLEFY-CSODHUTKSA-N	560.065040648							114046
BRD-K44133102	LSM-25479		54619522	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21-,25+/m1/s1	LJUASEIATGHWBE-OTPAQWSUSA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K44133102	BRD-K44133102-001-01-7	Broad Institute of MIT and Harvard	BRD-K44133102			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21-,25+/m1/s1	LJUASEIATGHWBE-OTPAQWSUSA-N	476.27087847							114047
BRD-K60030763	LSM-25480		54619598	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20+,27-/m0/s1	TXBXSWUOPNBBNR-VKIDHGPPSA-N	COc1cccc(c1)c2ccc3c(O[C@@H](CN(C)C(=O)c4ccccc4F)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K60030763	BRD-K60030763-001-01-4	Broad Institute of MIT and Harvard	BRD-K60030763			COc1cccc(c1)-c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3F)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20+,27-/m0/s1	TXBXSWUOPNBBNR-VKIDHGPPSA-N	556.204335686							114048
BRD-K87742870	LSM-25481		54619352	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16-,20-/m1/s1	RBKHQDVGCDKRON-JXXFODFXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K87742870	BRD-K87742870-001-01-3	Broad Institute of MIT and Harvard	BRD-K87742870			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16-,20-/m1/s1	RBKHQDVGCDKRON-JXXFODFXSA-N	525.093304316							114049
BRD-K53199675	LSM-25482		54619502	InChI=1S/C19H29BrN2O4S/c1-13-9-22(14(2)12-23)27(24,25)19-7-6-16(20)8-17(19)26-18(13)11-21(3)10-15-4-5-15/h6-8,13-15,18,23H,4-5,9-12H2,1-3H3/t13-,14+,18-/m0/s1	NQKVBKPKEYEFNC-IYOUNJFTSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K53199675	BRD-K53199675-001-01-3	Broad Institute of MIT and Harvard	BRD-K53199675			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C19H29BrN2O4S/c1-13-9-22(14(2)12-23)27(24,25)19-7-6-16(20)8-17(19)26-18(13)11-21(3)10-15-4-5-15/h6-8,13-15,18,23H,4-5,9-12H2,1-3H3/t13-,14+,18-/m0/s1	NQKVBKPKEYEFNC-IYOUNJFTSA-N	460.103140718							114050
BRD-K48912618	LSM-25483		54619432	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17-,23+/m1/s1	BTFHKXNDUYKHCV-QZMQVMSPSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K48912618	BRD-K48912618-001-01-7	Broad Institute of MIT and Harvard	BRD-K48912618			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17-,23+/m1/s1	BTFHKXNDUYKHCV-QZMQVMSPSA-N	469.237684734							114051
BRD-K10871135	LSM-25484		54619483	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21-,27-/m0/s1	RUWJTSGBQQPZMY-IZVMNLJQSA-N	COc1cccc(c1)c2ccc3c(O[C@@H](CN(C)Cc4ccncc4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K10871135	BRD-K10871135-001-01-3	Broad Institute of MIT and Harvard	BRD-K10871135			COc1cccc(c1)-c1ccc2c(O[C@@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21-,27-/m0/s1	RUWJTSGBQQPZMY-IZVMNLJQSA-N	525.22974194							114052
BRD-K08966355	LSM-25485		54619315	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19+,22+/m1/s1	BYBGYSIHVXXZCT-DXIQSLLYSA-N	CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CN(C)C)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K08966355	BRD-K08966355-001-01-8	Broad Institute of MIT and Harvard	BRD-K08966355			CCCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CN(C)C)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19+,22+/m1/s1	BYBGYSIHVXXZCT-DXIQSLLYSA-N	479.245392004							114053
BRD-K02634083	LSM-25486		54619577	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20+,24-/m0/s1	RFSJWOMDBGLSJS-ROKPMTFOSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CC3CC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K02634083	BRD-K02634083-001-01-7	Broad Institute of MIT and Harvard	BRD-K02634083			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CC3CC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20+,24-/m0/s1	RFSJWOMDBGLSJS-ROKPMTFOSA-N	490.250143026							114054
BRD-K06958718	LSM-25487		54619541	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17+,21+/m0/s1	VRPITXDQEALDAT-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccccc3	BroadT	BRD-K06958718	BRD-K06958718-001-01-9	Broad Institute of MIT and Harvard	BRD-K06958718			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17+,21+/m0/s1	VRPITXDQEALDAT-CSODHUTKSA-N	418.19262815							114055
BRD-K64418159	LSM-25488		54619450	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20+,26+/m1/s1	YLZPYRGVLPKCNQ-GOHWNWGWSA-N	COc1ccc(cc1)c2cnc3O[C@@H](CN(C)C(=O)Cc4cccnc4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K64418159	BRD-K64418159-001-01-9	Broad Institute of MIT and Harvard	BRD-K64418159			COc1ccc(cc1)-c1cnc2O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20+,26+/m1/s1	YLZPYRGVLPKCNQ-GOHWNWGWSA-N	518.252920228							114056
BRD-K02537686	LSM-15017		54619435	InChI=1S/C24H38N2O4S/c1-5-13-25(4)16-23-18(2)15-26(19(3)17-27)31(28,29)24-12-11-21(14-22(24)30-23)20-9-7-6-8-10-20/h9,11-12,14,18-19,23,27H,5-8,10,13,15-17H2,1-4H3/t18-,19+,23+/m0/s1	GQEOHDGNFBZEER-YCRNBWNJSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C3=CCCCC3	BroadT	BRD-K02537686	BRD-K02537686-001-01-3	Broad Institute of MIT and Harvard	BRD-K02537686			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCCC1	InChI=1S/C24H38N2O4S/c1-5-13-25(4)16-23-18(2)15-26(19(3)17-27)31(28,29)24-12-11-21(14-22(24)30-23)20-9-7-6-8-10-20/h9,11-12,14,18-19,23,27H,5-8,10,13,15-17H2,1-4H3/t18-,19+,23+/m0/s1	GQEOHDGNFBZEER-YCRNBWNJSA-N	450.255228406							103673
BRD-K44265418	LSM-44108		54619593	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22-,27+/m0/s1	HITOKJYCRKZWGL-CPXBNSDLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K44265418	BRD-K44265418-001-01-6	Broad Institute of MIT and Harvard	BRD-K44265418			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22-,27+/m0/s1	HITOKJYCRKZWGL-CPXBNSDLSA-N	520.3049558							
BRD-K98793503	LSM-25490		54619418	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17+,23-/m1/s1	XVANEVHAXZLZTM-SAHWJRBASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C)Oc2ncc(cc2C1=O)C#Cc3ccc(F)cc3	BroadT	BRD-K98793503	BRD-K98793503-001-01-8	Broad Institute of MIT and Harvard	BRD-K98793503			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(C)=O)Oc2ncc(cc2C1=O)C#Cc1ccc(F)cc1	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17+,23-/m1/s1	XVANEVHAXZLZTM-SAHWJRBASA-N	453.206384606							114058
BRD-K05992469	LSM-25491		54619366	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20-,25-/m0/s1	LQAOJDLPUWWIJF-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K05992469	BRD-K05992469-001-01-0	Broad Institute of MIT and Harvard	BRD-K05992469			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20-,25-/m0/s1	LQAOJDLPUWWIJF-RLSLOFABSA-N	524.209340854							114059
BRD-K56943789	LSM-25492		54619565	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17+,23+/m1/s1	BTFHKXNDUYKHCV-DGGJZMOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K56943789	BRD-K56943789-001-01-4	Broad Institute of MIT and Harvard	BRD-K56943789			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17+,23+/m1/s1	BTFHKXNDUYKHCV-DGGJZMOXSA-N	469.237684734							114060
BRD-K26443253	LSM-44109		54619392	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17-,21+/m1/s1	HDXAYIIPFHKWCX-POXRLDJUSA-N	C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K26443253	BRD-K26443253-001-01-9	Broad Institute of MIT and Harvard	BRD-K26443253			C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17-,21+/m1/s1	HDXAYIIPFHKWCX-POXRLDJUSA-N	491.18901998							
BRD-K70791360	LSM-25494		54619545	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20-,24-/m0/s1	RFSJWOMDBGLSJS-SKPFHBQLSA-N	CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CC3CC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K70791360	BRD-K70791360-001-01-6	Broad Institute of MIT and Harvard	BRD-K70791360			CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)CC3CC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20-,24-/m0/s1	RFSJWOMDBGLSJS-SKPFHBQLSA-N	490.250143026							114062
BRD-K92985620	LSM-25495		54619504	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19-,22-/m1/s1	BYBGYSIHVXXZCT-WOIUINJBSA-N	CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)CN(C)C)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K92985620	BRD-K92985620-001-01-4	Broad Institute of MIT and Harvard	BRD-K92985620			CCCC#Cc1ccc2c(O[C@H](CN(C)C(=O)CN(C)C)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19-,22-/m1/s1	BYBGYSIHVXXZCT-WOIUINJBSA-N	479.245392004							114063
BRD-K48012250	LSM-25496		54619340	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20+,24-/m1/s1	IGZSDNHYZBOXGY-JXALWOEJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC3CCCC3	BroadT	BRD-K48012250	BRD-K48012250-001-01-9	Broad Institute of MIT and Harvard	BRD-K48012250			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20+,24-/m1/s1	IGZSDNHYZBOXGY-JXALWOEJSA-N	484.3049558							114064
BRD-K09232527	LSM-25497		54619564	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15-,20-/m1/s1	KUOLKNDJLDMVPT-STXHMFSFSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K09232527	BRD-K09232527-001-01-7	Broad Institute of MIT and Harvard	BRD-K09232527			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15-,20-/m1/s1	KUOLKNDJLDMVPT-STXHMFSFSA-N	399.215806438							114065
BRD-K37657049	LSM-25498		54619422	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15-,20-/m1/s1	DTSMYPYKMZUDTF-STXHMFSFSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K37657049	BRD-K37657049-001-01-0	Broad Institute of MIT and Harvard	BRD-K37657049			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15-,20-/m1/s1	DTSMYPYKMZUDTF-STXHMFSFSA-N	422.167556254							114066
BRD-K83815065	LSM-25499		54619558	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19+,26+/m0/s1	NAZKFJIDOIPBCY-GNBJCERTSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K83815065	BRD-K83815065-001-01-6	Broad Institute of MIT and Harvard	BRD-K83815065			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19+,26+/m0/s1	NAZKFJIDOIPBCY-GNBJCERTSA-N	495.233348282							114067
BRD-K27294633	LSM-25500		54619461	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22-,30+/m1/s1	MYWSUSXCAZFZDP-WOGZVKCMSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5cccc(c5)C(=O)N(C)C	BroadT	BRD-K27294633	BRD-K27294633-001-01-6	Broad Institute of MIT and Harvard	BRD-K27294633			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22-,30+/m1/s1	MYWSUSXCAZFZDP-WOGZVKCMSA-N	609.250871308							114068
BRD-K71817712	LSM-25501		54619372	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20-,24-/m0/s1	IGZSDNHYZBOXGY-SKPFHBQLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC3CCCC3	BroadT	BRD-K71817712	BRD-K71817712-001-01-3	Broad Institute of MIT and Harvard	BRD-K71817712			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20-,24-/m0/s1	IGZSDNHYZBOXGY-SKPFHBQLSA-N	484.3049558							114069
BRD-K22651517-001-01-3	LSM-25502	BRD-K22651517	44484548	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15+,20-/m0/s1	KUOLKNDJLDMVPT-MDOVXXIYSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K22651517	BRD-K22651517-001-02-1	Broad Institute of MIT and Harvard	BRD-K22651517			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15+,20-/m0/s1	KUOLKNDJLDMVPT-MDOVXXIYSA-N	399.215806438							114070
BRD-K41102088	LSM-25503		54619530	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20-,25-/m0/s1	HTMGNWWTKIFEMM-RLSLOFABSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CCN(C)C)cc1	BroadT	BRD-K41102088	BRD-K41102088-001-01-3	Broad Institute of MIT and Harvard	BRD-K41102088			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CCN(C)C)cc1	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20-,25-/m0/s1	HTMGNWWTKIFEMM-RLSLOFABSA-N	523.279469334							114071
BRD-K60267900	LSM-25504		54619470	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20-,25-/m1/s1	LQAOJDLPUWWIJF-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K60267900	BRD-K60267900-001-01-6	Broad Institute of MIT and Harvard	BRD-K60267900			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20-,25-/m1/s1	LQAOJDLPUWWIJF-UMEGOILYSA-N	524.209340854							114072
BRD-K88812688	LSM-25505		54619308	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20-,25+/m1/s1	LQAOJDLPUWWIJF-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K88812688	BRD-K88812688-001-01-5	Broad Institute of MIT and Harvard	BRD-K88812688			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20-,25+/m1/s1	LQAOJDLPUWWIJF-FHAGJXEFSA-N	524.209340854							114073
BRD-K00747273	LSM-25506		54619562	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21-,25-/m1/s1	LJUASEIATGHWBE-DNRQZRRGSA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K00747273	BRD-K00747273-001-01-9	Broad Institute of MIT and Harvard	BRD-K00747273			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21-,25-/m1/s1	LJUASEIATGHWBE-DNRQZRRGSA-N	476.27087847							114074
BRD-K55836749	LSM-25507		54619518	InChI=1S/C27H35N3O4/c1-6-13-29(4)17-25-19(2)16-30(20(3)18-31)27(32)23-14-21(15-28-26(23)34-25)11-12-22-9-7-8-10-24(22)33-5/h7-10,14-15,19-20,25,31H,6,13,16-18H2,1-5H3/t19-,20-,25-/m1/s1	CXNSNJNJSOSVDN-UMEGOILYSA-N	CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc3ccccc3OC	BroadT	BRD-K55836749	BRD-K55836749-001-01-0	Broad Institute of MIT and Harvard	BRD-K55836749			CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc1ccccc1OC	InChI=1S/C27H35N3O4/c1-6-13-29(4)17-25-19(2)16-30(20(3)18-31)27(32)23-14-21(15-28-26(23)34-25)11-12-22-9-7-8-10-24(22)33-5/h7-10,14-15,19-20,25,31H,6,13,16-18H2,1-5H3/t19-,20-,25-/m1/s1	CXNSNJNJSOSVDN-UMEGOILYSA-N	465.26275663							114075
BRD-K81510336	LSM-25508		54619371	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21+,27-/m0/s1	XVNXZMOLFFKQAU-ISCCLHIJSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)CC4CCOCC4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K81510336	BRD-K81510336-001-01-8	Broad Institute of MIT and Harvard	BRD-K81510336			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21+,27-/m0/s1	XVNXZMOLFFKQAU-ISCCLHIJSA-N	532.26070771							114076
BRD-K25540102	LSM-25509		54619523	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21-,27-/m1/s1	XVNXZMOLFFKQAU-LGVUCKNBSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)CC4CCOCC4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K25540102	BRD-K25540102-001-01-6	Broad Institute of MIT and Harvard	BRD-K25540102			COc1ccccc1-c1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21-,27-/m1/s1	XVNXZMOLFFKQAU-LGVUCKNBSA-N	532.26070771							114077
BRD-K81372870	LSM-25510		54619481	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20+,26+/m0/s1	WIHAZNHSVPJONK-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccc(C)cc4	BroadT	BRD-K81372870	BRD-K81372870-001-01-5	Broad Institute of MIT and Harvard	BRD-K81372870			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20+,26+/m0/s1	WIHAZNHSVPJONK-OUDXUNEISA-N	505.237684734							114078
BRD-K95023134	LSM-25511		54619421	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20+,26-/m1/s1	WIHAZNHSVPJONK-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccc(C)cc4	BroadT	BRD-K95023134	BRD-K95023134-001-01-0	Broad Institute of MIT and Harvard	BRD-K95023134			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20+,26-/m1/s1	WIHAZNHSVPJONK-BVFVYWQFSA-N	505.237684734							114079
BRD-K97784715	LSM-25512		54619313	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20+,26-/m1/s1	YLZPYRGVLPKCNQ-BVFVYWQFSA-N	COc1ccc(cc1)c2cnc3O[C@H](CN(C)C(=O)Cc4cccnc4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K97784715	BRD-K97784715-001-01-2	Broad Institute of MIT and Harvard	BRD-K97784715			COc1ccc(cc1)-c1cnc2O[C@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20+,26-/m1/s1	YLZPYRGVLPKCNQ-BVFVYWQFSA-N	518.252920228							114080
BRD-K26459891	LSM-25513		54619582	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20-,26+/m1/s1	VWUCQBGGJOIZNN-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K26459891	BRD-K26459891-001-01-3	Broad Institute of MIT and Harvard	BRD-K26459891			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)Oc2cc(ccc2S1(=O)=O)-c1cccc(C#N)c1	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20-,26+/m1/s1	VWUCQBGGJOIZNN-KYTVRQNUSA-N	534.19369079							114081
BRD-K83155387	LSM-43611		54619510	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21-,28-/m1/s1	RSLDQNPUEWIABH-WWORJOIISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K83155387	BRD-K83155387-001-01-8	Broad Institute of MIT and Harvard	BRD-K83155387			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21-,28-/m1/s1	RSLDQNPUEWIABH-WWORJOIISA-N	585.210898276							
BRD-K30935394	LSM-15130		54619491	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15-,20+/m1/s1	DTSMYPYKMZUDTF-SXGZJXTBSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K30935394	BRD-K30935394-001-01-8	Broad Institute of MIT and Harvard	BRD-K30935394			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15-,20+/m1/s1	DTSMYPYKMZUDTF-SXGZJXTBSA-N	422.167556254							103786
BRD-K59130962	LSM-25514		54619347	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18-,23-/m0/s1	JVFXTLNLNPGAHH-BSRJHKFKSA-N	CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K59130962	BRD-K59130962-001-01-4	Broad Institute of MIT and Harvard	BRD-K59130962			CCC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18-,23-/m0/s1	JVFXTLNLNPGAHH-BSRJHKFKSA-N	490.213757518							114082
BRD-K21743103	LSM-44110		54619424	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16-,20-/m1/s1	YMXRISRBAYOBDY-VWPFAFIFSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K21743103	BRD-K21743103-001-01-9	Broad Institute of MIT and Harvard	BRD-K21743103			C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16-,20-/m1/s1	YMXRISRBAYOBDY-VWPFAFIFSA-N	439.221954458							
BRD-K45136330	LSM-25516		54619395	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20-,26+/m1/s1	WIHAZNHSVPJONK-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccc(C)cc4	BroadT	BRD-K45136330	BRD-K45136330-001-01-3	Broad Institute of MIT and Harvard	BRD-K45136330			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20-,26+/m1/s1	WIHAZNHSVPJONK-KYTVRQNUSA-N	505.237684734							114084
BRD-K91202220-001-01-9	LSM-25517	BRD-K91202220	44484547	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20+,25-/m0/s1	HTMGNWWTKIFEMM-DFIYOIEZSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)C#CCN(C)C)cc1	BroadT	BRD-K91202220	BRD-K91202220-001-02-7	Broad Institute of MIT and Harvard	BRD-K91202220			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)C#CCN(C)C)cc1	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20+,25-/m0/s1	HTMGNWWTKIFEMM-DFIYOIEZSA-N	523.279469334							114085
CHEMBL3188686	LSM-25518	BRD-K94196749	54619597	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17-,22-/m0/s1	NTWQDWFFMZTMNG-HOIFWPIMSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K94196749	BRD-K94196749-001-01-2	Broad Institute of MIT and Harvard	BRD-K94196749			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17-,22-/m0/s1	NTWQDWFFMZTMNG-HOIFWPIMSA-N	466.2216201							114086
BRD-K45700898	LSM-15035		54619503	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15+,20+/m0/s1	KUOLKNDJLDMVPT-BXTJHSDWSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K45700898	BRD-K45700898-001-01-0	Broad Institute of MIT and Harvard	BRD-K45700898			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15+,20+/m0/s1	KUOLKNDJLDMVPT-BXTJHSDWSA-N	399.215806438							103691
BRD-K11652878	LSM-25519		54619350	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17-,23-/m0/s1	BTFHKXNDUYKHCV-QQMNAOGKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K11652878	BRD-K11652878-001-01-7	Broad Institute of MIT and Harvard	BRD-K11652878			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17-,23-/m0/s1	BTFHKXNDUYKHCV-QQMNAOGKSA-N	469.237684734							114087
BRD-K12750296	LSM-25520		54619537	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17+,23+/m0/s1	BTFHKXNDUYKHCV-YGKZAACZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K12750296	BRD-K12750296-001-01-2	Broad Institute of MIT and Harvard	BRD-K12750296			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17+,23+/m0/s1	BTFHKXNDUYKHCV-YGKZAACZSA-N	469.237684734							114088
BRD-K40228963	LSM-25521		54619576	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20-,25-/m1/s1	QGQQAQHDJARTFG-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K40228963	BRD-K40228963-001-01-7	Broad Institute of MIT and Harvard	BRD-K40228963			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20-,25-/m1/s1	QGQQAQHDJARTFG-UMEGOILYSA-N	520.26070771							114089
BRD-K01669916	LSM-25522		54619411	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21-,25-/m0/s1	LJUASEIATGHWBE-WATLYSKOSA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K01669916	BRD-K01669916-001-01-7	Broad Institute of MIT and Harvard	BRD-K01669916			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21-,25-/m0/s1	LJUASEIATGHWBE-WATLYSKOSA-N	476.27087847							114090
BRD-K94580242	LSM-25523		54619361	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20+,25-/m1/s1	HTMGNWWTKIFEMM-OHUGHZGNSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)C#CCN(C)C)cc1	BroadT	BRD-K94580242	BRD-K94580242-001-01-9	Broad Institute of MIT and Harvard	BRD-K94580242			COc1ccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)C#CCN(C)C)cc1	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20+,25-/m1/s1	HTMGNWWTKIFEMM-OHUGHZGNSA-N	523.279469334							114091
BRD-K80240487	LSM-25524		54619507	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21-,27-/m0/s1	QMNGWUQFDFUPIZ-IZVMNLJQSA-N	COc1cccc(c1)C#Cc2cnc3O[C@@H](CN(C)C(=O)C4CCOCC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K80240487	BRD-K80240487-001-01-0	Broad Institute of MIT and Harvard	BRD-K80240487			COc1cccc(c1)C#Cc1cnc2O[C@@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21-,27-/m0/s1	QMNGWUQFDFUPIZ-IZVMNLJQSA-N	535.268235934							114092
BRD-K49656278	LSM-44111		54619486	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16-,20-/m0/s1	YMXRISRBAYOBDY-MOLFVJAXSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K49656278	BRD-K49656278-001-01-0	Broad Institute of MIT and Harvard	BRD-K49656278			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16-,20-/m0/s1	YMXRISRBAYOBDY-MOLFVJAXSA-N	439.221954458							
BRD-K60044070	LSM-44112		54619416	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17+,21+/m1/s1	HDXAYIIPFHKWCX-QOYWWYNISA-N	C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3ccccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K60044070	BRD-K60044070-001-01-3	Broad Institute of MIT and Harvard	BRD-K60044070			C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3ccccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17+,21+/m1/s1	HDXAYIIPFHKWCX-QOYWWYNISA-N	491.18901998							
BRD-K24930745	LSM-25527		54619318	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18+,23+/m0/s1	JVFXTLNLNPGAHH-YZZKKUAISA-N	CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K24930745	BRD-K24930745-001-01-3	Broad Institute of MIT and Harvard	BRD-K24930745			CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18+,23+/m0/s1	JVFXTLNLNPGAHH-YZZKKUAISA-N	490.213757518							114095
BRD-K37770214	LSM-44113		54619332	InChI=1S/C24H37N3O3/c1-5-8-20-11-21-23(25-12-20)30-22(15-26(4)14-19-9-6-7-10-19)17(2)13-27(24(21)29)18(3)16-28/h5,8,11-12,17-19,22,28H,6-7,9-10,13-16H2,1-4H3/b8-5+/t17-,18-,22+/m0/s1	LEJJQXLHUPRDAY-ZWSDPYEUSA-N	C\C=C\c1cnc2O[C@H](CN(C)CC3CCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K37770214	BRD-K37770214-001-01-0	Broad Institute of MIT and Harvard	BRD-K37770214			C\C=C\c1cnc2O[C@H](CN(C)CC3CCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H37N3O3/c1-5-8-20-11-21-23(25-12-20)30-22(15-26(4)14-19-9-6-7-10-19)17(2)13-27(24(21)29)18(3)16-28/h5,8,11-12,17-19,22,28H,6-7,9-10,13-16H2,1-4H3/b8-5+/t17-,18-,22+/m0/s1	LEJJQXLHUPRDAY-ZWSDPYEUSA-N	415.283492074							
BRD-K01705159	LSM-25529		54619454	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18-,23+/m0/s1	JVFXTLNLNPGAHH-IUKKYPGJSA-N	CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K01705159	BRD-K01705159-001-01-5	Broad Institute of MIT and Harvard	BRD-K01705159			CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18-,23+/m0/s1	JVFXTLNLNPGAHH-IUKKYPGJSA-N	490.213757518							114097
BRD-K66401298	LSM-25530		54619465	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20-,24-/m1/s1	IGZSDNHYZBOXGY-YOSAUDMPSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC3CCCC3	BroadT	BRD-K66401298	BRD-K66401298-001-01-5	Broad Institute of MIT and Harvard	BRD-K66401298			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20-,24-/m1/s1	IGZSDNHYZBOXGY-YOSAUDMPSA-N	484.3049558							114098
BRD-K95740363	LSM-25531		54619380	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17-,21-/m1/s1	VRPITXDQEALDAT-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccccc3	BroadT	BRD-K95740363	BRD-K95740363-001-01-1	Broad Institute of MIT and Harvard	BRD-K95740363			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17-,21-/m1/s1	VRPITXDQEALDAT-CBGDNZLLSA-N	418.19262815							114099
BRD-K16207265	LSM-25532		54619527	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22+,30+/m1/s1	MYWSUSXCAZFZDP-DGIFUFQNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5cccc(c5)C(=O)N(C)C	BroadT	BRD-K16207265	BRD-K16207265-001-01-6	Broad Institute of MIT and Harvard	BRD-K16207265			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22+,30+/m1/s1	MYWSUSXCAZFZDP-DGIFUFQNSA-N	609.250871308							114100
BRD-K55800245	LSM-25533		54619330	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20-,26+/m1/s1	YLZPYRGVLPKCNQ-KYTVRQNUSA-N	COc1ccc(cc1)c2cnc3O[C@@H](CN(C)C(=O)Cc4cccnc4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K55800245	BRD-K55800245-001-01-5	Broad Institute of MIT and Harvard	BRD-K55800245			COc1ccc(cc1)-c1cnc2O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20-,26+/m1/s1	YLZPYRGVLPKCNQ-KYTVRQNUSA-N	518.252920228							114101
BRD-K87849910	LSM-25534		54619563	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17+,22-/m0/s1	NTWQDWFFMZTMNG-JKSBSHDWSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccc(cc3)C#N	BroadT	BRD-K87849910	BRD-K87849910-001-01-8	Broad Institute of MIT and Harvard	BRD-K87849910			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccc(cc1)C#N	InChI=1S/C25H30N4O5/c1-16-12-29(17(2)14-30)25(32)21-9-20(19-7-5-18(10-26)6-8-19)11-27-24(21)34-22(16)13-28(3)23(31)15-33-4/h5-9,11,16-17,22,30H,12-15H2,1-4H3/t16-,17+,22-/m0/s1	NTWQDWFFMZTMNG-JKSBSHDWSA-N	466.2216201							114102
BRD-K04251837	LSM-25535		54619473	InChI=1S/C19H29BrN2O4S/c1-13-9-22(14(2)12-23)27(24,25)19-7-6-16(20)8-17(19)26-18(13)11-21(3)10-15-4-5-15/h6-8,13-15,18,23H,4-5,9-12H2,1-3H3/t13-,14-,18-/m1/s1	NQKVBKPKEYEFNC-HBUWYVDXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K04251837	BRD-K04251837-001-01-7	Broad Institute of MIT and Harvard	BRD-K04251837			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C19H29BrN2O4S/c1-13-9-22(14(2)12-23)27(24,25)19-7-6-16(20)8-17(19)26-18(13)11-21(3)10-15-4-5-15/h6-8,13-15,18,23H,4-5,9-12H2,1-3H3/t13-,14-,18-/m1/s1	NQKVBKPKEYEFNC-HBUWYVDXSA-N	460.103140718							114103
BRD-K53379620	LSM-25536		44505110	InChI=1S/C26H33FN4O5S/c1-18-15-31(19(2)17-32)26(33)23-13-20(7-6-12-29(3)4)14-28-25(23)36-24(18)16-30(5)37(34,35)22-10-8-21(27)9-11-22/h8-11,13-14,18-19,24,32H,12,15-17H2,1-5H3/t18-,19+,24-/m0/s1	OILDSAGBLQPBNF-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K53379620	BRD-K53379620-001-01-7	Broad Institute of MIT and Harvard	BRD-K53379620			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C26H33FN4O5S/c1-18-15-31(19(2)17-32)26(33)23-13-20(7-6-12-29(3)4)14-28-25(23)36-24(18)16-30(5)37(34,35)22-10-8-21(27)9-11-22/h8-11,13-14,18-19,24,32H,12,15-17H2,1-5H3/t18-,19+,24-/m0/s1	OILDSAGBLQPBNF-GLDPYIMESA-N	532.215569086							114104
BRD-K09160804	LSM-44114		54619505	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16-,20+/m0/s1	YMXRISRBAYOBDY-QMDRAINUSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K09160804	BRD-K09160804-001-01-4	Broad Institute of MIT and Harvard	BRD-K09160804			C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16-,20+/m0/s1	YMXRISRBAYOBDY-QMDRAINUSA-N	439.221954458							
BRD-K84693638	LSM-25538		54619339	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	QGQQAQHDJARTFG-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K84693638	BRD-K84693638-001-01-4	Broad Institute of MIT and Harvard	BRD-K84693638			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20+,25+/m0/s1	QGQQAQHDJARTFG-WZOHSFFVSA-N	520.26070771							114106
BRD-K72651085	LSM-25539		54619561	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21-,27+/m0/s1	XVNXZMOLFFKQAU-NOMHHCBYSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)CC4CCOCC4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K72651085	BRD-K72651085-001-01-4	Broad Institute of MIT and Harvard	BRD-K72651085			COc1ccccc1-c1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H40N2O6S/c1-20-16-30(21(2)19-31)37(32,33)28-10-9-23(24-7-5-6-8-25(24)34-4)15-26(28)36-27(20)18-29(3)17-22-11-13-35-14-12-22/h5-10,15,20-22,27,31H,11-14,16-19H2,1-4H3/t20-,21-,27+/m0/s1	XVNXZMOLFFKQAU-NOMHHCBYSA-N	532.26070771							114107
BRD-K53241408	LSM-25540		54619567	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28+/m0/s1	YGCNTAWRLGQTMN-PFPZSTESSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@H](CN(C)S(=O)(=O)c4ccccc4F)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K53241408	BRD-K53241408-001-01-7	Broad Institute of MIT and Harvard	BRD-K53241408			COc1ccc(cc1)C#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccccc3F)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33FN2O7S2/c1-21-18-33(22(2)20-34)42(37,38)30-16-13-24(10-9-23-11-14-25(39-4)15-12-23)17-27(30)40-28(21)19-32(3)41(35,36)29-8-6-5-7-26(29)31/h5-8,11-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28+/m0/s1	YGCNTAWRLGQTMN-PFPZSTESSA-N	616.171320996							114108
BRD-K52657580	LSM-25541		54619375	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20-,25+/m0/s1	LQAOJDLPUWWIJF-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K52657580	BRD-K52657580-001-01-5	Broad Institute of MIT and Harvard	BRD-K52657580			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20-,25+/m0/s1	LQAOJDLPUWWIJF-ZYLNGJIFSA-N	524.209340854							114109
BRD-K46445956	LSM-25542		54619533	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22+,30-/m0/s1	MYWSUSXCAZFZDP-ZQLNOWDWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5cccc(c5)C(=O)N(C)C	BroadT	BRD-K46445956	BRD-K46445956-001-01-0	Broad Institute of MIT and Harvard	BRD-K46445956			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22+,30-/m0/s1	MYWSUSXCAZFZDP-ZQLNOWDWSA-N	609.250871308							114110
BRD-K03606830	LSM-25543		54619521	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20+,26+/m0/s1	YLZPYRGVLPKCNQ-OUDXUNEISA-N	COc1ccc(cc1)c2cnc3O[C@H](CN(C)C(=O)Cc4cccnc4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K03606830	BRD-K03606830-001-01-0	Broad Institute of MIT and Harvard	BRD-K03606830			COc1ccc(cc1)-c1cnc2O[C@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20+,26+/m0/s1	YLZPYRGVLPKCNQ-OUDXUNEISA-N	518.252920228							114111
BRD-K62007935	LSM-44115		54619341	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22+,27+/m0/s1	HITOKJYCRKZWGL-XKKULULISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K62007935	BRD-K62007935-001-01-3	Broad Institute of MIT and Harvard	BRD-K62007935			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H40N4O4/c1-21-18-34(22(2)20-35)29(36)26-16-24(15-14-23-10-6-4-7-11-23)17-31-28(26)38-27(21)19-33(3)30(37)32-25-12-8-5-9-13-25/h4,6-7,10-11,14-17,21-22,25,27,35H,5,8-9,12-13,18-20H2,1-3H3,(H,32,37)/b15-14+/t21-,22+,27+/m0/s1	HITOKJYCRKZWGL-XKKULULISA-N	520.3049558							
BRD-K26074237	LSM-25545		54619591	InChI=1S/C20H27N3O4S/c1-14-12-23(15(2)13-24)28(25,26)20-7-6-16(17-5-4-8-22-10-17)9-18(20)27-19(14)11-21-3/h4-10,14-15,19,21,24H,11-13H2,1-3H3/t14-,15-,19+/m0/s1	GQINMCYFQWJTAV-YZVOILCLSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3cccnc3	BroadT	BRD-K26074237	BRD-K26074237-001-01-3	Broad Institute of MIT and Harvard	BRD-K26074237			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1cccnc1	InChI=1S/C20H27N3O4S/c1-14-12-23(15(2)13-24)28(25,26)20-7-6-16(17-5-4-8-22-10-17)9-18(20)27-19(14)11-21-3/h4-10,14-15,19,21,24H,11-13H2,1-3H3/t14-,15-,19+/m0/s1	GQINMCYFQWJTAV-YZVOILCLSA-N	405.172227064							114113
BRD-K88974575	LSM-25546		54619408	InChI=1S/C30H38N2O6S/c1-21-17-32(22(2)20-33)39(36,37)29-15-14-24(13-12-23-8-4-5-9-23)16-27(29)38-28(21)19-31(3)18-25-10-6-7-11-26(25)30(34)35/h6-7,10-11,14-16,21-23,28,33H,4-5,8-9,17-20H2,1-3H3,(H,34,35)/t21-,22-,28-/m1/s1	SXNCWASTISCGFX-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(=O)O)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K88974575	BRD-K88974575-001-01-9	Broad Institute of MIT and Harvard	BRD-K88974575			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(O)=O)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C30H38N2O6S/c1-21-17-32(22(2)20-33)39(36,37)29-15-14-24(13-12-23-8-4-5-9-23)16-27(29)38-28(21)19-31(3)18-25-10-6-7-11-26(25)30(34)35/h6-7,10-11,14-16,21-23,28,33H,4-5,8-9,17-20H2,1-3H3,(H,34,35)/t21-,22-,28-/m1/s1	SXNCWASTISCGFX-DQCZWYHMSA-N	554.245057646							114114
BRD-K24191730	LSM-25547		54619588	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20+,26+/m0/s1	VWUCQBGGJOIZNN-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K24191730	BRD-K24191730-001-01-9	Broad Institute of MIT and Harvard	BRD-K24191730			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)Oc2cc(ccc2S1(=O)=O)-c1cccc(C#N)c1	InChI=1S/C28H30N4O5S/c1-19-16-32(20(2)18-33)38(35,36)27-8-7-24(23-6-4-5-21(13-23)15-29)14-25(27)37-26(19)17-31(3)28(34)22-9-11-30-12-10-22/h4-14,19-20,26,33H,16-18H2,1-3H3/t19-,20+,26+/m0/s1	VWUCQBGGJOIZNN-OUDXUNEISA-N	534.19369079							114115
BRD-K48738035	LSM-25548		54619431	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15+,20-/m1/s1	KUOLKNDJLDMVPT-QEEYODRMSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K48738035	BRD-K48738035-001-01-1	Broad Institute of MIT and Harvard	BRD-K48738035			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15+,20-/m1/s1	KUOLKNDJLDMVPT-QEEYODRMSA-N	399.215806438							114116
BRD-K63858518	LSM-25549		54619370	InChI=1S/C20H27N3O4S/c1-14-12-23(15(2)13-24)28(25,26)20-7-6-16(17-5-4-8-22-10-17)9-18(20)27-19(14)11-21-3/h4-10,14-15,19,21,24H,11-13H2,1-3H3/t14-,15+,19+/m1/s1	GQINMCYFQWJTAV-VCBZYWHSSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3cccnc3	BroadT	BRD-K63858518	BRD-K63858518-001-01-3	Broad Institute of MIT and Harvard	BRD-K63858518			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cccnc1	InChI=1S/C20H27N3O4S/c1-14-12-23(15(2)13-24)28(25,26)20-7-6-16(17-5-4-8-22-10-17)9-18(20)27-19(14)11-21-3/h4-10,14-15,19,21,24H,11-13H2,1-3H3/t14-,15+,19+/m1/s1	GQINMCYFQWJTAV-VCBZYWHSSA-N	405.172227064							114117
BRD-K65245206	LSM-25550		54619514	InChI=1S/C27H35N3O4/c1-6-13-29(4)17-25-19(2)16-30(20(3)18-31)27(32)23-14-21(15-28-26(23)34-25)11-12-22-9-7-8-10-24(22)33-5/h7-10,14-15,19-20,25,31H,6,13,16-18H2,1-5H3/t19-,20+,25-/m1/s1	CXNSNJNJSOSVDN-OHUGHZGNSA-N	CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc3ccccc3OC	BroadT	BRD-K65245206	BRD-K65245206-001-01-8	Broad Institute of MIT and Harvard	BRD-K65245206			CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc1ccccc1OC	InChI=1S/C27H35N3O4/c1-6-13-29(4)17-25-19(2)16-30(20(3)18-31)27(32)23-14-21(15-28-26(23)34-25)11-12-22-9-7-8-10-24(22)33-5/h7-10,14-15,19-20,25,31H,6,13,16-18H2,1-5H3/t19-,20+,25-/m1/s1	CXNSNJNJSOSVDN-OHUGHZGNSA-N	465.26275663							114118
BRD-K93460493	LSM-25551		54619429	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20+,25+/m1/s1	QGQQAQHDJARTFG-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K93460493	BRD-K93460493-001-01-1	Broad Institute of MIT and Harvard	BRD-K93460493			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C27H40N2O6S/c1-19-16-29(20(2)18-30)36(32,33)26-10-9-23(21-7-5-4-6-8-21)15-24(26)35-25(19)17-28(3)27(31)22-11-13-34-14-12-22/h7,9-10,15,19-20,22,25,30H,4-6,8,11-14,16-18H2,1-3H3/t19-,20+,25+/m1/s1	QGQQAQHDJARTFG-RNHFSVANSA-N	520.26070771							114119
BRD-K61505971	LSM-44116		54619345	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17+,21-/m0/s1	HDXAYIIPFHKWCX-WTYXQAJXSA-N	C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3ccccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K61505971	BRD-K61505971-001-01-2	Broad Institute of MIT and Harvard	BRD-K61505971			C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3ccccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17+,21-/m0/s1	HDXAYIIPFHKWCX-WTYXQAJXSA-N	491.18901998							
MLS003128997	LSM-25553	BRD-K98682310	46904121	InChI=1S/C22H26BrFN4O4/c1-13-10-28(14(2)12-29)21(30)16-8-15(23)9-25-20(16)32-19(13)11-27(3)22(31)26-18-7-5-4-6-17(18)24/h4-9,13-14,19,29H,10-12H2,1-3H3,(H,26,31)/t13-,14-,19+/m1/s1	FEPFVQGWSVEBSO-LPMFXHHGSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K98682310	BRD-K98682310-001-01-6	Broad Institute of MIT and Harvard	BRD-K98682310			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)Oc2ncc(Br)cc2C1=O	InChI=1S/C22H26BrFN4O4/c1-13-10-28(14(2)12-29)21(30)16-8-15(23)9-25-20(16)32-19(13)11-27(3)22(31)26-18-7-5-4-6-17(18)24/h4-9,13-14,19,29H,10-12H2,1-3H3,(H,26,31)/t13-,14-,19+/m1/s1	FEPFVQGWSVEBSO-LPMFXHHGSA-N	508.112146152							114121
BRD-K37803976	LSM-44117		54619540	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21+,28+/m0/s1	RSLDQNPUEWIABH-CXSXHMDNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K37803976	BRD-K37803976-001-01-7	Broad Institute of MIT and Harvard	BRD-K37803976			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21+,28+/m0/s1	RSLDQNPUEWIABH-CXSXHMDNSA-N	585.210898276							
BRD-K97731768	LSM-44118		54619453	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22-,26-/m1/s1	IBJZSIVAOQZUGO-WZVRSMRESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K97731768	BRD-K97731768-001-01-9	Broad Institute of MIT and Harvard	BRD-K97731768			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H38N4O5/c1-21-17-33(22(2)20-34)29(36)25-15-24(10-9-23-7-5-4-6-8-23)16-30-28(25)38-26(21)18-31(3)27(35)19-32-11-13-37-14-12-32/h4-10,15-16,21-22,26,34H,11-14,17-20H2,1-3H3/b10-9+/t21-,22-,26-/m1/s1	IBJZSIVAOQZUGO-WZVRSMRESA-N	522.284220356							
BRD-K31783246	LSM-25556		54619351	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21+,27-/m1/s1	QMNGWUQFDFUPIZ-PBDKAQRYSA-N	COc1cccc(c1)C#Cc2cnc3O[C@H](CN(C)C(=O)C4CCOCC4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K31783246	BRD-K31783246-001-01-1	Broad Institute of MIT and Harvard	BRD-K31783246			COc1cccc(c1)C#Cc1cnc2O[C@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H37N3O6/c1-20-17-33(21(2)19-34)30(36)26-15-23(9-8-22-6-5-7-25(14-22)37-4)16-31-28(26)39-27(20)18-32(3)29(35)24-10-12-38-13-11-24/h5-7,14-16,20-21,24,27,34H,10-13,17-19H2,1-4H3/t20-,21+,27-/m1/s1	QMNGWUQFDFUPIZ-PBDKAQRYSA-N	535.268235934							114124
BRD-K79065821	LSM-25557		54619378	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15+,20+/m1/s1	KUOLKNDJLDMVPT-SIFCLUCFSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K79065821	BRD-K79065821-001-01-9	Broad Institute of MIT and Harvard	BRD-K79065821			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C22H29N3O4/c1-14-12-25(15(2)13-26)22(27)19-9-17(16-5-7-18(28-4)8-6-16)10-24-21(19)29-20(14)11-23-3/h5-10,14-15,20,23,26H,11-13H2,1-4H3/t14-,15+,20+/m1/s1	KUOLKNDJLDMVPT-SIFCLUCFSA-N	399.215806438							131271
BRD-K12593465	LSM-25558		54619459	InChI=1S/C19H28N2O5S/c1-14-12-21(15(2)13-22)27(23,24)19-8-7-16(6-5-9-25-4)10-17(19)26-18(14)11-20-3/h7-8,10,14-15,18,20,22H,9,11-13H2,1-4H3/t14-,15+,18-/m1/s1	LUVAADAAXLMVKF-RVKKMQEKSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCOC	BroadT	BRD-K12593465	BRD-K12593465-001-01-1	Broad Institute of MIT and Harvard	BRD-K12593465			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCOC	InChI=1S/C19H28N2O5S/c1-14-12-21(15(2)13-22)27(23,24)19-8-7-16(6-5-9-25-4)10-17(19)26-18(14)11-20-3/h7-8,10,14-15,18,20,22H,9,11-13H2,1-4H3/t14-,15+,18-/m1/s1	LUVAADAAXLMVKF-RVKKMQEKSA-N	396.171892706							114127
BRD-K16403365	LSM-25559		54619419	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22-,30+/m0/s1	MYWSUSXCAZFZDP-MWXNICTNSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5cccc(c5)C(=O)N(C)C	BroadT	BRD-K16403365	BRD-K16403365-001-01-0	Broad Institute of MIT and Harvard	BRD-K16403365			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22-,30+/m0/s1	MYWSUSXCAZFZDP-MWXNICTNSA-N	609.250871308							114128
CHEMBL2355633	LSM-25560	BRD-K27823380, SID131414517	54619393	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24-,30-/m0/s1	KSFWKEJSKQZBOG-PUMORYBASA-N	C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K27823380	BRD-K27823380-001-01-7	Broad Institute of MIT and Harvard	BRD-K27823380			C[C@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24-,30-/m0/s1	KSFWKEJSKQZBOG-PUMORYBASA-N	527.278406694							114129
MLS003129943	LSM-25561	BRD-K15714104, SID99358489	46903317	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17-,21-/m1/s1	MKFDRGBJPDLEFY-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K15714104	BRD-K15714104-001-02-5	Broad Institute of MIT and Harvard	BRD-K15714104			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17-,21-/m1/s1	MKFDRGBJPDLEFY-CBGDNZLLSA-N	560.065040648							114130
BRD-K21732483	LSM-25562		54619382	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24-,30+/m1/s1	KSFWKEJSKQZBOG-IFVFNEAISA-N	C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K21732483	BRD-K21732483-001-01-2	Broad Institute of MIT and Harvard	BRD-K21732483			C[C@@H](O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24-,30+/m1/s1	KSFWKEJSKQZBOG-IFVFNEAISA-N	527.278406694							114131
BRD-K26852477	LSM-25563		54619388	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20-,27+/m0/s1	TXBXSWUOPNBBNR-OWOAZTCBSA-N	COc1cccc(c1)c2ccc3c(O[C@H](CN(C)C(=O)c4ccccc4F)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K26852477	BRD-K26852477-001-01-1	Broad Institute of MIT and Harvard	BRD-K26852477			COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C29H33FN2O6S/c1-19-16-32(20(2)18-33)39(35,36)28-13-12-22(21-8-7-9-23(14-21)37-4)15-26(28)38-27(19)17-31(3)29(34)24-10-5-6-11-25(24)30/h5-15,19-20,27,33H,16-18H2,1-4H3/t19-,20-,27+/m0/s1	TXBXSWUOPNBBNR-OWOAZTCBSA-N	556.204335686							114132
BRD-K21955645	LSM-25564		54619575	InChI=1S/C30H38N2O6S/c1-21-17-32(22(2)20-33)39(36,37)29-15-14-24(13-12-23-8-4-5-9-23)16-27(29)38-28(21)19-31(3)18-25-10-6-7-11-26(25)30(34)35/h6-7,10-11,14-16,21-23,28,33H,4-5,8-9,17-20H2,1-3H3,(H,34,35)/t21-,22-,28-/m0/s1	SXNCWASTISCGFX-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(=O)O)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K21955645	BRD-K21955645-001-01-4	Broad Institute of MIT and Harvard	BRD-K21955645			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(O)=O)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C30H38N2O6S/c1-21-17-32(22(2)20-33)39(36,37)29-15-14-24(13-12-23-8-4-5-9-23)16-27(29)38-28(21)19-31(3)18-25-10-6-7-11-26(25)30(34)35/h6-7,10-11,14-16,21-23,28,33H,4-5,8-9,17-20H2,1-3H3,(H,34,35)/t21-,22-,28-/m0/s1	SXNCWASTISCGFX-VPYPWEPUSA-N	554.245057646							114133
BRD-K05041765	LSM-44119		54619309	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16+,20+/m1/s1	YMXRISRBAYOBDY-UDBAPERZSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K05041765	BRD-K05041765-001-01-7	Broad Institute of MIT and Harvard	BRD-K05041765			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16+,20+/m1/s1	YMXRISRBAYOBDY-UDBAPERZSA-N	439.221954458							
BRD-K13502206	LSM-25566		54619445	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15+,20+/m1/s1	DTSMYPYKMZUDTF-SIFCLUCFSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K13502206	BRD-K13502206-001-01-5	Broad Institute of MIT and Harvard	BRD-K13502206			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15+,20+/m1/s1	DTSMYPYKMZUDTF-SIFCLUCFSA-N	422.167556254							114135
BRD-K16694974	LSM-25567		54619489	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20-,26-/m0/s1	WIHAZNHSVPJONK-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccc(C)cc4	BroadT	BRD-K16694974	BRD-K16694974-001-01-7	Broad Institute of MIT and Harvard	BRD-K16694974			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20-,26-/m0/s1	WIHAZNHSVPJONK-DYLHXGEVSA-N	505.237684734							114136
BRD-K14309706	LSM-25568		54619362	InChI=1S/C27H33FN2O4S/c1-19-15-30(20(2)18-31)35(32,33)27-12-11-22(8-7-21-5-4-6-24(28)13-21)14-25(27)34-26(19)17-29(3)16-23-9-10-23/h4-6,11-14,19-20,23,26,31H,9-10,15-18H2,1-3H3/t19-,20-,26-/m0/s1	RFKINOJAXDJBJC-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccc(F)c4	BroadT	BRD-K14309706	BRD-K14309706-001-01-9	Broad Institute of MIT and Harvard	BRD-K14309706			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1	InChI=1S/C27H33FN2O4S/c1-19-15-30(20(2)18-31)35(32,33)27-12-11-22(8-7-21-5-4-6-24(28)13-21)14-25(27)34-26(19)17-29(3)16-23-9-10-23/h4-6,11-14,19-20,23,26,31H,9-10,15-18H2,1-3H3/t19-,20-,26-/m0/s1	RFKINOJAXDJBJC-DYLHXGEVSA-N	500.214506446							114137
BRD-K26273412	LSM-25569		54619520	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24-,30+/m0/s1	KSFWKEJSKQZBOG-ZUHGBKBGSA-N	C[C@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K26273412	BRD-K26273412-001-01-8	Broad Institute of MIT and Harvard	BRD-K26273412			C[C@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23-,24-,30+/m0/s1	KSFWKEJSKQZBOG-ZUHGBKBGSA-N	527.278406694							114138
BRD-K63937112	LSM-25570		54619336	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20-,24+/m0/s1	RFSJWOMDBGLSJS-MZLICYQSSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)CC3CC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K63937112	BRD-K63937112-001-01-5	Broad Institute of MIT and Harvard	BRD-K63937112			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)CC3CC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20-,24+/m0/s1	RFSJWOMDBGLSJS-MZLICYQSSA-N	490.250143026							114139
BRD-K34498495	LSM-25571		54619571	InChI=1S/C30H36N2O7S/c1-20-15-32(21(2)18-33)40(34,35)30-12-10-23(24-7-5-6-8-25(24)36-4)14-28(30)39-29(20)17-31(3)16-22-9-11-26-27(13-22)38-19-37-26/h5-14,20-21,29,33H,15-19H2,1-4H3/t20-,21-,29-/m1/s1	YWADXHNDBHGHLS-GVNDJSPXSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)Cc4ccc5OCOc5c4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K34498495	BRD-K34498495-001-01-1	Broad Institute of MIT and Harvard	BRD-K34498495			COc1ccccc1-c1ccc2c(O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H36N2O7S/c1-20-15-32(21(2)18-33)40(34,35)30-12-10-23(24-7-5-6-8-25(24)36-4)14-28(30)39-29(20)17-31(3)16-22-9-11-26-27(13-22)38-19-37-26/h5-14,20-21,29,33H,15-19H2,1-4H3/t20-,21-,29-/m1/s1	YWADXHNDBHGHLS-GVNDJSPXSA-N	568.224322202							114140
BRD-K32853527	LSM-25572		54619570	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20+,24-/m1/s1	RFSJWOMDBGLSJS-JXALWOEJSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)CC3CC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K32853527	BRD-K32853527-001-01-1	Broad Institute of MIT and Harvard	BRD-K32853527			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)CC3CC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20+,24-/m1/s1	RFSJWOMDBGLSJS-JXALWOEJSA-N	490.250143026							114141
BRD-K79067166	LSM-25573		54619538	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20-,27-/m1/s1	OEKKMSVCCRMVHL-SEXOINJZSA-N	COc1cccc(c1)c2cnc3O[C@H](CN(C)Cc4ccc(cc4)C(=O)O)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K79067166	BRD-K79067166-001-01-8	Broad Institute of MIT and Harvard	BRD-K79067166			COc1cccc(c1)-c1cnc2O[C@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20-,27-/m1/s1	OEKKMSVCCRMVHL-SEXOINJZSA-N	533.25258587							114142
BRD-K97168035	LSM-25574		54619559	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22+,30-/m1/s1	MYWSUSXCAZFZDP-VDZJOXJSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)c5cccc(c5)C(=O)N(C)C	BroadT	BRD-K97168035	BRD-K97168035-001-01-1	Broad Institute of MIT and Harvard	BRD-K97168035			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C32H39N3O7S/c1-21-16-35(22(2)19-36)43(38,39)31-12-10-25(24-7-6-8-26(14-24)32(37)33(3)4)15-29(31)42-30(21)18-34(5)17-23-9-11-27-28(13-23)41-20-40-27/h6-15,21-22,30,36H,16-20H2,1-5H3/t21-,22+,30-/m1/s1	MYWSUSXCAZFZDP-VDZJOXJSSA-N	609.250871308							114143
BRD-K31624501	LSM-44120		54619412	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17-,21-/m0/s1	HDXAYIIPFHKWCX-HRXKBLKTSA-N	C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3ccccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K31624501	BRD-K31624501-001-01-7	Broad Institute of MIT and Harvard	BRD-K31624501			C\C=C\c1cnc2O[C@@H](CN(C)S(=O)(=O)c3ccccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17-,21-/m0/s1	HDXAYIIPFHKWCX-HRXKBLKTSA-N	491.18901998							
MLS003130170	LSM-25576	BRD-K55896279, SID99358819	46903568	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22-,27+/m1/s1	NDPUBMYQFYUKKS-LOYIFYEOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K55896279	BRD-K55896279-001-02-0	Broad Institute of MIT and Harvard	BRD-K55896279			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22-,27+/m1/s1	NDPUBMYQFYUKKS-LOYIFYEOSA-N	490.294391116							114145
BRD-K12240312	LSM-25577		54619508	InChI=1S/C30H36N2O7S/c1-20-15-32(21(2)18-33)40(34,35)30-12-10-23(24-7-5-6-8-25(24)36-4)14-28(30)39-29(20)17-31(3)16-22-9-11-26-27(13-22)38-19-37-26/h5-14,20-21,29,33H,15-19H2,1-4H3/t20-,21+,29-/m0/s1	YWADXHNDBHGHLS-FONBTEPMSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)Cc4ccc5OCOc5c4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K12240312	BRD-K12240312-001-01-4	Broad Institute of MIT and Harvard	BRD-K12240312			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H36N2O7S/c1-20-15-32(21(2)18-33)40(34,35)30-12-10-23(24-7-5-6-8-25(24)36-4)14-28(30)39-29(20)17-31(3)16-22-9-11-26-27(13-22)38-19-37-26/h5-14,20-21,29,33H,15-19H2,1-4H3/t20-,21+,29-/m0/s1	YWADXHNDBHGHLS-FONBTEPMSA-N	568.224322202							114146
BRD-K34839838	LSM-25578		54619500	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20+,25-/m0/s1	LQAOJDLPUWWIJF-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K34839838	BRD-K34839838-001-01-2	Broad Institute of MIT and Harvard	BRD-K34839838			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C27H32N4O5S/c1-19-15-31(20(2)17-32)37(34,35)26-10-9-22(23-13-28-18-29-14-23)12-24(26)36-25(19)16-30(3)27(33)11-21-7-5-4-6-8-21/h4-10,12-14,18-20,25,32H,11,15-17H2,1-3H3/t19-,20+,25-/m0/s1	LQAOJDLPUWWIJF-DFIYOIEZSA-N	524.209340854							114147
BRD-K81006490	LSM-25579		54619381	InChI=1S/C30H36N2O7S/c1-20-15-32(21(2)18-33)40(34,35)30-12-10-23(24-7-5-6-8-25(24)36-4)14-28(30)39-29(20)17-31(3)16-22-9-11-26-27(13-22)38-19-37-26/h5-14,20-21,29,33H,15-19H2,1-4H3/t20-,21+,29+/m1/s1	YWADXHNDBHGHLS-CGQTXMLISA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)Cc4ccc5OCOc5c4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K81006490	BRD-K81006490-001-01-9	Broad Institute of MIT and Harvard	BRD-K81006490			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H36N2O7S/c1-20-15-32(21(2)18-33)40(34,35)30-12-10-23(24-7-5-6-8-25(24)36-4)14-28(30)39-29(20)17-31(3)16-22-9-11-26-27(13-22)38-19-37-26/h5-14,20-21,29,33H,15-19H2,1-4H3/t20-,21+,29+/m1/s1	YWADXHNDBHGHLS-CGQTXMLISA-N	568.224322202							114148
MLS003130060	LSM-15143	BRD-K49934959, SID99358644	46903423	InChI=1S/C27H33FN2O4S/c1-19-15-30(20(2)18-31)35(32,33)27-12-11-22(8-7-21-5-4-6-24(28)13-21)14-25(27)34-26(19)17-29(3)16-23-9-10-23/h4-6,11-14,19-20,23,26,31H,9-10,15-18H2,1-3H3/t19-,20+,26-/m1/s1	RFKINOJAXDJBJC-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccc(F)c4	BroadT	BRD-K49934959	BRD-K49934959-001-02-5	Broad Institute of MIT and Harvard	BRD-K49934959			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1	InChI=1S/C27H33FN2O4S/c1-19-15-30(20(2)18-31)35(32,33)27-12-11-22(8-7-21-5-4-6-24(28)13-21)14-25(27)34-26(19)17-29(3)16-23-9-10-23/h4-6,11-14,19-20,23,26,31H,9-10,15-18H2,1-3H3/t19-,20+,26-/m1/s1	RFKINOJAXDJBJC-BVFVYWQFSA-N	500.214506446							103799
BRD-K80290360	LSM-25580		54619385	InChI=1S/C30H36N2O7S/c1-20-15-32(21(2)18-33)40(34,35)30-12-10-23(24-7-5-6-8-25(24)36-4)14-28(30)39-29(20)17-31(3)16-22-9-11-26-27(13-22)38-19-37-26/h5-14,20-21,29,33H,15-19H2,1-4H3/t20-,21+,29+/m0/s1	YWADXHNDBHGHLS-BNJCFXFUSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)Cc4ccc5OCOc5c4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K80290360	BRD-K80290360-001-01-7	Broad Institute of MIT and Harvard	BRD-K80290360			COc1ccccc1-c1ccc2c(O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H36N2O7S/c1-20-15-32(21(2)18-33)40(34,35)30-12-10-23(24-7-5-6-8-25(24)36-4)14-28(30)39-29(20)17-31(3)16-22-9-11-26-27(13-22)38-19-37-26/h5-14,20-21,29,33H,15-19H2,1-4H3/t20-,21+,29+/m0/s1	YWADXHNDBHGHLS-BNJCFXFUSA-N	568.224322202							114149
MLS003130109	LSM-25581	BRD-K16838444	46903509	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20+,26-/m0/s1	YLZPYRGVLPKCNQ-UNVFRBQDSA-N	COc1ccc(cc1)c2cnc3O[C@@H](CN(C)C(=O)Cc4cccnc4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K16838444	BRD-K16838444-001-02-0	Broad Institute of MIT and Harvard	BRD-K16838444			COc1ccc(cc1)-c1cnc2O[C@@H](CN(C)C(=O)Cc3cccnc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H34N4O5/c1-19-16-33(20(2)18-34)29(36)25-13-23(22-7-9-24(37-4)10-8-22)15-31-28(25)38-26(19)17-32(3)27(35)12-21-6-5-11-30-14-21/h5-11,13-15,19-20,26,34H,12,16-18H2,1-4H3/t19-,20+,26-/m0/s1	YLZPYRGVLPKCNQ-UNVFRBQDSA-N	518.252920228							114150
BRD-K64767126	LSM-25582		54619369	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17+,21-/m0/s1	VRPITXDQEALDAT-FVJLSDCUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccccc3	BroadT	BRD-K64767126	BRD-K64767126-001-01-9	Broad Institute of MIT and Harvard	BRD-K64767126			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17+,21-/m0/s1	VRPITXDQEALDAT-FVJLSDCUSA-N	418.19262815							114151
BRD-K22243404	LSM-25583		54619589	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15-,20+/m0/s1	DTSMYPYKMZUDTF-AUSJPIAWSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K22243404	BRD-K22243404-001-01-5	Broad Institute of MIT and Harvard	BRD-K22243404			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C21H27FN2O4S/c1-14-12-24(15(2)13-25)29(26,27)21-9-8-16(17-6-4-5-7-18(17)22)10-19(21)28-20(14)11-23-3/h4-10,14-15,20,23,25H,11-13H2,1-3H3/t14-,15-,20+/m0/s1	DTSMYPYKMZUDTF-AUSJPIAWSA-N	422.167556254							114152
BRD-K32223081	LSM-25584		44505517	InChI=1S/C26H33N5O6S/c1-17-12-31(18(2)15-32)26(33)22-10-20(19-7-6-8-21(9-19)36-5)11-27-25(22)37-23(17)13-30(4)38(34,35)24-14-29(3)16-28-24/h6-11,14,16-18,23,32H,12-13,15H2,1-5H3/t17-,18+,23-/m0/s1	USWLWRUHDOJPPR-IXFSTUDKSA-N	COc1cccc(c1)c2cnc3O[C@@H](CN(C)S(=O)(=O)c4cn(C)cn4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K32223081	BRD-K32223081-001-01-5	Broad Institute of MIT and Harvard	BRD-K32223081			COc1cccc(c1)-c1cnc2O[C@@H](CN(C)S(=O)(=O)c3cn(C)cn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H33N5O6S/c1-17-12-31(18(2)15-32)26(33)22-10-20(19-7-6-8-21(9-19)36-5)11-27-25(22)37-23(17)13-30(4)38(34,35)24-14-29(3)16-28-24/h6-11,14,16-18,23,32H,12-13,15H2,1-5H3/t17-,18+,23-/m0/s1	USWLWRUHDOJPPR-IXFSTUDKSA-N	543.215154516							114153
BRD-K46620987	LSM-25585		54619434	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20-,24-/m1/s1	RFSJWOMDBGLSJS-YOSAUDMPSA-N	CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)CC3CC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K46620987	BRD-K46620987-001-01-1	Broad Institute of MIT and Harvard	BRD-K46620987			CC(C)CC#Cc1ccc2c(O[C@H](CN(C)C(=O)CC3CC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H38N2O5S/c1-18(2)7-6-8-21-11-12-25-23(13-21)33-24(16-27(5)26(30)14-22-9-10-22)19(3)15-28(20(4)17-29)34(25,31)32/h11-13,18-20,22,24,29H,7,9-10,14-17H2,1-5H3/t19-,20-,24-/m1/s1	RFSJWOMDBGLSJS-YOSAUDMPSA-N	490.250143026							114154
BRD-K36271521	LSM-25586		54619458	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20-,24+/m1/s1	IGZSDNHYZBOXGY-REHUZNOOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC3CCCC3	BroadT	BRD-K36271521	BRD-K36271521-001-01-8	Broad Institute of MIT and Harvard	BRD-K36271521			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2ncc(cc2C1=O)C#CCC1CCCC1	InChI=1S/C27H40N4O4/c1-19-15-31(20(2)18-32)27(34)23-13-22(12-8-11-21-9-6-7-10-21)14-28-26(23)35-24(19)16-30(5)25(33)17-29(3)4/h13-14,19-21,24,32H,6-7,9-11,15-18H2,1-5H3/t19-,20-,24+/m1/s1	IGZSDNHYZBOXGY-REHUZNOOSA-N	484.3049558							114155
BRD-K42449328	LSM-25587		54619513	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20+,26+/m1/s1	WIHAZNHSVPJONK-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccc(C)cc4	BroadT	BRD-K42449328	BRD-K42449328-001-01-7	Broad Institute of MIT and Harvard	BRD-K42449328			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccc(C)cc1	InChI=1S/C29H32FN3O4/c1-18-8-10-21(11-9-18)23-13-25-27(31-14-23)37-26(19(2)15-33(29(25)36)20(3)17-34)16-32(4)28(35)22-6-5-7-24(30)12-22/h5-14,19-20,26,34H,15-17H2,1-4H3/t19-,20+,26+/m1/s1	WIHAZNHSVPJONK-GOHWNWGWSA-N	505.237684734							114156
BRD-K06994380	LSM-25588		54619384	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24-,30-/m1/s1	KSFWKEJSKQZBOG-UTSVKBTJSA-N	C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K06994380	BRD-K06994380-001-01-1	Broad Institute of MIT and Harvard	BRD-K06994380			C[C@@H](O)C#Cc1cnc2O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C32H37N3O4/c1-22-18-35(23(2)21-36)32(38)29-16-26(11-10-24(3)37)17-33-31(29)39-30(22)20-34(4)19-25-12-14-28(15-13-25)27-8-6-5-7-9-27/h5-9,12-17,22-24,30,36-37H,18-21H2,1-4H3/t22-,23+,24-,30-/m1/s1	KSFWKEJSKQZBOG-UTSVKBTJSA-N	527.278406694							114157
BRD-K52075209	LSM-44121		54619488	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17+,21-/m1/s1	HDXAYIIPFHKWCX-PJYZTNNXSA-N	C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3ccccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K52075209	BRD-K52075209-001-01-1	Broad Institute of MIT and Harvard	BRD-K52075209			C\C=C\c1cnc2O[C@H](CN(C)S(=O)(=O)c3ccccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H30FN3O5S/c1-5-8-18-11-19-23(26-12-18)33-21(16(2)13-28(24(19)30)17(3)15-29)14-27(4)34(31,32)22-10-7-6-9-20(22)25/h5-12,16-17,21,29H,13-15H2,1-4H3/b8-5+/t16-,17+,21-/m1/s1	HDXAYIIPFHKWCX-PJYZTNNXSA-N	491.18901998							
BRD-K43136464	LSM-25590		54619433	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17+,23-/m1/s1	BTFHKXNDUYKHCV-SAHWJRBASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K43136464	BRD-K43136464-001-01-3	Broad Institute of MIT and Harvard	BRD-K43136464			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C26H32FN3O4/c1-16-13-30(17(2)15-31)26(33)22-11-20(19-8-5-9-21(27)10-19)12-28-24(22)34-23(16)14-29(3)25(32)18-6-4-7-18/h5,8-12,16-18,23,31H,4,6-7,13-15H2,1-3H3/t16-,17+,23-/m1/s1	BTFHKXNDUYKHCV-SAHWJRBASA-N	469.237684734							114159
BRD-K59549646	LSM-15044		54619457	InChI=1S/C24H38N2O4S/c1-5-13-25(4)16-23-18(2)15-26(19(3)17-27)31(28,29)24-12-11-21(14-22(24)30-23)20-9-7-6-8-10-20/h9,11-12,14,18-19,23,27H,5-8,10,13,15-17H2,1-4H3/t18-,19+,23-/m0/s1	GQEOHDGNFBZEER-YYDVJCTNSA-N	CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C3=CCCCC3	BroadT	BRD-K59549646	BRD-K59549646-001-01-9	Broad Institute of MIT and Harvard	BRD-K59549646			CCCN(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCCC1	InChI=1S/C24H38N2O4S/c1-5-13-25(4)16-23-18(2)15-26(19(3)17-27)31(28,29)24-12-11-21(14-22(24)30-23)20-9-7-6-8-10-20/h9,11-12,14,18-19,23,27H,5-8,10,13,15-17H2,1-4H3/t18-,19+,23-/m0/s1	GQEOHDGNFBZEER-YYDVJCTNSA-N	450.255228406							103700
BRD-K79222179	LSM-25591		54619391	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20+,27-/m0/s1	OEKKMSVCCRMVHL-VKIDHGPPSA-N	COc1cccc(c1)c2cnc3O[C@@H](CN(C)Cc4ccc(cc4)C(=O)O)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K79222179	BRD-K79222179-001-01-4	Broad Institute of MIT and Harvard	BRD-K79222179			COc1cccc(c1)-c1cnc2O[C@@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20+,27-/m0/s1	OEKKMSVCCRMVHL-VKIDHGPPSA-N	533.25258587							114160
BRD-K68247783	LSM-25592		54619495	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22+,27-/m1/s1	NDPUBMYQFYUKKS-UMTXDNHDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K68247783	BRD-K68247783-001-01-2	Broad Institute of MIT and Harvard	BRD-K68247783			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22+,27-/m1/s1	NDPUBMYQFYUKKS-UMTXDNHDSA-N	490.294391116							114161
BRD-K66623602	LSM-25593		54619409	InChI=1S/C19H28N2O5S/c1-14-12-21(15(2)13-22)27(23,24)19-8-7-16(6-5-9-25-4)10-17(19)26-18(14)11-20-3/h7-8,10,14-15,18,20,22H,9,11-13H2,1-4H3/t14-,15+,18+/m0/s1	LUVAADAAXLMVKF-HDMKZQKVSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCOC	BroadT	BRD-K66623602	BRD-K66623602-001-01-5	Broad Institute of MIT and Harvard	BRD-K66623602			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCOC	InChI=1S/C19H28N2O5S/c1-14-12-21(15(2)13-22)27(23,24)19-8-7-16(6-5-9-25-4)10-17(19)26-18(14)11-20-3/h7-8,10,14-15,18,20,22H,9,11-13H2,1-4H3/t14-,15+,18+/m0/s1	LUVAADAAXLMVKF-HDMKZQKVSA-N	396.171892706							114162
BRD-K40126748	LSM-44122		54619519	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21-,28-/m0/s1	RSLDQNPUEWIABH-PYOORFNRSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K40126748	BRD-K40126748-001-01-5	Broad Institute of MIT and Harvard	BRD-K40126748			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H33F2N3O5S/c1-20-17-35(21(2)19-36)41(38,39)29-14-11-23(10-9-22-7-5-4-6-8-22)15-27(29)40-28(20)18-34(3)30(37)33-26-16-24(31)12-13-25(26)32/h4-16,20-21,28,36H,17-19H2,1-3H3,(H,33,37)/b10-9+/t20-,21-,28-/m0/s1	RSLDQNPUEWIABH-PYOORFNRSA-N	585.210898276							
BRD-K82509605	LSM-25595		54619560	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22+,27+/m0/s1	NDPUBMYQFYUKKS-OREGWCPLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K82509605	BRD-K82509605-001-01-3	Broad Institute of MIT and Harvard	BRD-K82509605			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22+,27+/m0/s1	NDPUBMYQFYUKKS-OREGWCPLSA-N	490.294391116							114164
BRD-K07600484	LSM-25596		54619463	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18-,23-/m1/s1	JVFXTLNLNPGAHH-PMAPCBKXSA-N	CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3ccc(OC)cc3	BroadT	BRD-K07600484	BRD-K07600484-001-01-8	Broad Institute of MIT and Harvard	BRD-K07600484			CCC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccc(OC)cc1	InChI=1S/C25H34N2O6S/c1-6-25(29)26(4)15-23-17(2)14-27(18(3)16-28)34(30,31)24-12-9-20(13-22(24)33-23)19-7-10-21(32-5)11-8-19/h7-13,17-18,23,28H,6,14-16H2,1-5H3/t17-,18-,23-/m1/s1	JVFXTLNLNPGAHH-PMAPCBKXSA-N	490.213757518							114165
BRD-K13402127	LSM-25597		54619443	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17-,23+/m0/s1	XVANEVHAXZLZTM-HKARXFIJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C)Oc2ncc(cc2C1=O)C#Cc3ccc(F)cc3	BroadT	BRD-K13402127	BRD-K13402127-001-01-4	Broad Institute of MIT and Harvard	BRD-K13402127			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(C)=O)Oc2ncc(cc2C1=O)C#Cc1ccc(F)cc1	InChI=1S/C25H28FN3O4/c1-16-13-29(17(2)15-30)25(32)22-11-20(6-5-19-7-9-21(26)10-8-19)12-27-24(22)33-23(16)14-28(4)18(3)31/h7-12,16-17,23,30H,13-15H2,1-4H3/t16-,17-,23+/m0/s1	XVANEVHAXZLZTM-HKARXFIJSA-N	453.206384606							114166
BRD-K52094743	LSM-44123		54619479	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16+,20+/m0/s1	YMXRISRBAYOBDY-YCRBQBAOSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K52094743	BRD-K52094743-001-01-5	Broad Institute of MIT and Harvard	BRD-K52094743			C\C=C\c1cnc2O[C@H](CN(C)C(=O)c3cnccn3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C23H29N5O4/c1-5-6-17-9-18-21(26-10-17)32-20(15(2)12-28(22(18)30)16(3)14-29)13-27(4)23(31)19-11-24-7-8-25-19/h5-11,15-16,20,29H,12-14H2,1-4H3/b6-5+/t15-,16+,20+/m0/s1	YMXRISRBAYOBDY-YCRBQBAOSA-N	439.221954458							
BRD-K28034484	LSM-25599		54619490	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17-,21+/m0/s1	MKFDRGBJPDLEFY-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K28034484	BRD-K28034484-001-01-5	Broad Institute of MIT and Harvard	BRD-K28034484			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C22H29BrN2O6S2/c1-15-5-8-19(9-6-15)32(27,28)24(4)13-21-16(2)12-25(17(3)14-26)33(29,30)22-10-7-18(23)11-20(22)31-21/h5-11,16-17,21,26H,12-14H2,1-4H3/t16-,17-,21+/m0/s1	MKFDRGBJPDLEFY-XGHQBKJUSA-N	560.065040648							114168
BRD-K99122228	LSM-25600		54619360	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19+,26-/m0/s1	NAZKFJIDOIPBCY-ANSQWYIGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc3ncc(cc3C1=O)c4ccccc4F	BroadT	BRD-K99122228	BRD-K99122228-001-01-3	Broad Institute of MIT and Harvard	BRD-K99122228			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc2ncc(cc2C1=O)-c1ccccc1F	InChI=1S/C28H31F2N3O3/c1-18-14-33(19(2)17-34)28(35)24-12-21(23-9-4-5-10-25(23)30)13-31-27(24)36-26(18)16-32(3)15-20-7-6-8-22(29)11-20/h4-13,18-19,26,34H,14-17H2,1-3H3/t18-,19+,26-/m0/s1	NAZKFJIDOIPBCY-ANSQWYIGSA-N	495.233348282							114169
BRD-K69109808	LSM-25601		54619587	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20+,25+/m0/s1	HTMGNWWTKIFEMM-WZOHSFFVSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)C#CCN(C)C)cc1	BroadT	BRD-K69109808	BRD-K69109808-001-01-4	Broad Institute of MIT and Harvard	BRD-K69109808			COc1ccc(NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)C#CCN(C)C)cc1	InChI=1S/C28H37N5O5/c1-19-16-33(20(2)18-34)27(35)24-14-21(8-7-13-31(3)4)15-29-26(24)38-25(19)17-32(5)28(36)30-22-9-11-23(37-6)12-10-22/h9-12,14-15,19-20,25,34H,13,16-18H2,1-6H3,(H,30,36)/t19-,20+,25+/m0/s1	HTMGNWWTKIFEMM-WZOHSFFVSA-N	523.279469334							114170
BRD-K72694472	LSM-25602		54619548	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20+,27-/m1/s1	OEKKMSVCCRMVHL-IOKPGSKQSA-N	COc1cccc(c1)c2cnc3O[C@H](CN(C)Cc4ccc(cc4)C(=O)O)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K72694472	BRD-K72694472-001-01-5	Broad Institute of MIT and Harvard	BRD-K72694472			COc1cccc(c1)-c1cnc2O[C@H](CN(C)Cc3ccc(cc3)C(O)=O)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H35N3O6/c1-19-15-33(20(2)18-34)29(35)26-13-24(23-6-5-7-25(12-23)38-4)14-31-28(26)39-27(19)17-32(3)16-21-8-10-22(11-9-21)30(36)37/h5-14,19-20,27,34H,15-18H2,1-4H3,(H,36,37)/t19-,20+,27-/m1/s1	OEKKMSVCCRMVHL-IOKPGSKQSA-N	533.25258587							114171
BRD-K75311902	LSM-25603		54619428	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21+,25-/m1/s1	LJUASEIATGHWBE-TYBLODHISA-N	CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC3CCCC3	BroadT	BRD-K75311902	BRD-K75311902-001-01-3	Broad Institute of MIT and Harvard	BRD-K75311902			CCCN(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC1CCCC1	InChI=1S/C26H40N2O4S/c1-5-15-27(4)18-25-20(2)17-28(21(3)19-29)33(30,31)26-14-13-23(16-24(26)32-25)12-8-11-22-9-6-7-10-22/h13-14,16,20-22,25,29H,5-7,9-11,15,17-19H2,1-4H3/t20-,21+,25-/m1/s1	LJUASEIATGHWBE-TYBLODHISA-N	476.27087847							114172
BRD-K91503401	LSM-25604		45480058	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22+,27-/m0/s1	NDPUBMYQFYUKKS-XXAUWVGASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K91503401	BRD-K91503401-001-01-1	Broad Institute of MIT and Harvard	BRD-K91503401			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C29H38N4O3/c1-21-17-33(22(2)20-34)29(35)26-14-24(12-11-23-8-5-4-6-9-23)16-31-28(26)36-27(21)19-32(3)18-25-10-7-13-30-15-25/h7,10,13-16,21-23,27,34H,4-6,8-9,17-20H2,1-3H3/t21-,22+,27-/m0/s1	NDPUBMYQFYUKKS-XXAUWVGASA-N	490.294391116							114173
BRD-K57688676	LSM-25605		54619487	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17-,21+/m0/s1	VRPITXDQEALDAT-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccccc3	BroadT	BRD-K57688676	BRD-K57688676-001-01-0	Broad Institute of MIT and Harvard	BRD-K57688676			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccccc1	InChI=1S/C22H30N2O4S/c1-16-13-24(17(2)15-25)29(26,27)22-11-10-19(18-8-6-5-7-9-18)12-20(22)28-21(16)14-23(3)4/h5-12,16-17,21,25H,13-15H2,1-4H3/t16-,17-,21+/m0/s1	VRPITXDQEALDAT-XGHQBKJUSA-N	418.19262815							114174
Betulin	LSM-25606	Betulin	72326	InChI=1S/C30H50O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1	FVWJYYTZTCVBKE-ROUWMTJPSA-N	CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12	BroadT	BRD-K64874225	BRD-K64874225-001-01-3	AnalytiCon Discovery GmbH	NP-009907			CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12	InChI=1S/C30H50O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1	FVWJYYTZTCVBKE-ROUWMTJPSA-N	442.38108084							3086
501925-31-1	LSM-3608	PNU-120596, BRD-K71731651	311434	InChI=1S/C13H14ClN3O4/c1-7-4-12(17-21-7)16-13(18)15-9-5-8(14)10(19-2)6-11(9)20-3/h4-6H,1-3H3,(H2,15,16,17,18)	CEIIEALEIHQDBX-UHFFFAOYSA-N	COc1cc(OC)c(NC(=O)Nc2cc(C)on2)cc1Cl	BroadT	BRD-K71731651	BRD-K71731651-001-01-9	Tocris Bioscience	2498	1		COc1cc(OC)c(NC(=O)Nc2cc(C)on2)cc1Cl	InChI=1S/C13H14ClN3O4/c1-7-4-12(17-21-7)16-13(18)15-9-5-8(14)10(19-2)6-11(9)20-3/h4-6H,1-3H3,(H2,15,16,17,18)	CEIIEALEIHQDBX-UHFFFAOYSA-N	311.067283668							93263
Todralazine	LSM-5763	Todralazine, BT-621 [AS HYDROCHLORIDE], Todralazine HCl, Ecarazine HCl, Ceph [As Hydrochloride]	5501	InChI=1S/C11H12N4O2/c1-2-17-11(16)15-14-10-9-6-4-3-5-8(9)7-12-13-10/h3-7H,2H2,1H3,(H,13,14)(H,15,16)	WGZDBVOTUVNQFP-UHFFFAOYSA-N	CCOC(=O)NNc1nncc2ccccc12	BroadT	BRD-K68553471	BRD-K68553471-003-04-0	Prestwick Chemical Inc.	Prestw-71	D0701-MP04-ST03-200-	Cl	CCOC(=O)NNc1nncc2ccccc12.Cl	InChI=1S/C11H12N4O2.ClH/c1-2-17-11(16)15-14-10-9-6-4-3-5-8(9)7-12-13-10;/h3-7H,2H2,1H3,(H,13,14)(H,15,16);1H	OMCOKCNIYWULQH-UHFFFAOYSA-N	232.096025664							94706, 94706
S-Rolipram	LSM-25607	BRD-K65856711, S-(+)-Rolipram, (S)-(+)-Rolipram	158758	InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)/t12-/m1/s1	HJORMJIFDVBMOB-GFCCVEGCSA-N	COc1ccc(cc1OC2CCCC2)[C@H]3CNC(=O)C3	BroadT	BRD-K65856711	BRD-K65856711-001-01-0	Tocris Bioscience	1350	4		COc1ccc(cc1OC1CCCC1)[C@H]1CNC(=O)C1	InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)/t12-/m1/s1	HJORMJIFDVBMOB-GFCCVEGCSA-N	275.152143542							59540
1,4-Dimethoxy-9-thio(10H)-acridone	LSM-25608	SID11114279, SID492765	3004085	InChI=1S/C15H13NO2S/c1-17-11-7-8-12(18-2)14-13(11)15(19)9-5-3-4-6-10(9)16-14/h3-8H,1-2H3,(H,16,19)	KFAKESMKRPNZTM-UHFFFAOYSA-N	COc1ccc(OC)c2C(=S)c3ccccc3Nc12	BroadT	BRD-K62949423	BRD-K62949423-001-02-3	Tocris Bioscience	2152	2		COc1ccc(OC)c2c1[nH]c1ccccc1c2=S	InChI=1S/C15H13NO2S/c1-17-11-7-8-12(18-2)14-13(11)15(19)9-5-3-4-6-10(9)16-14/h3-8H,1-2H3,(H,16,19)	KFAKESMKRPNZTM-UHFFFAOYSA-N	271.066699356							114175
GS-39783	LSM-3686	39069-52-8, GS-39783, BRD-K75478907	6604928	InChI=1S/C15H23N5O2S/c1-23-15-18-13(16-10-6-2-3-7-10)12(20(21)22)14(19-15)17-11-8-4-5-9-11/h10-11H,2-9H2,1H3,(H2,16,17,18,19)	GSGVDKOCBKBMGG-UHFFFAOYSA-N	CSc1nc(NC2CCCC2)c(c(NC3CCCC3)n1)[N+](=O)[O-]	BroadT	BRD-K75478907	BRD-K75478907-001-01-5	Tocris Bioscience	2001	1		CSc1nc(NC2CCCC2)c(c(NC2CCCC2)n1)[N+]([O-])=O	InChI=1S/C15H23N5O2S/c1-23-15-18-13(16-10-6-2-3-7-10)12(20(21)22)14(19-15)17-11-8-4-5-9-11/h10-11H,2-9H2,1H3,(H2,16,17,18,19)	GSGVDKOCBKBMGG-UHFFFAOYSA-N	337.157245716							93326
AC1L5AAF	LSM-3523	BRD-K68190965	173615	InChI=1S/C23H27N3O2/c1-26(2)13-12-19-16-24-22-10-6-17(14-21(19)22)7-11-23(27)25-15-18-4-8-20(28-3)9-5-18/h4-11,14,16,24H,12-13,15H2,1-3H3,(H,25,27)	LBVZWEWTNUDWNS-UHFFFAOYSA-N	COc1ccc(CNC(=O)C=Cc2ccc3[nH]cc(CCN(C)C)c3c2)cc1	BroadT	BRD-K68190965	BRD-K68190965-001-01-4	Tocris Bioscience	864	3		COc1ccc(CNC(=O)C=Cc2ccc3[nH]cc(CCN(C)C)c3c2)cc1	InChI=1S/C23H27N3O2/c1-26(2)13-12-19-16-24-22-10-6-17(14-21(19)22)7-11-23(27)25-15-18-4-8-20(28-3)9-5-18/h4-11,14,16,24H,12-13,15H2,1-3H3,(H,25,27)	LBVZWEWTNUDWNS-UHFFFAOYSA-N	377.210327134							93195
Thiabendazole	LSM-3741	Tiabendazole, Thiabendazole, Omnizole, Mintezol, Equizole, MK-360, E233	5430	InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)	WJCNZQLZVWNLKY-UHFFFAOYSA-N	c1ccc2[nH]c(nc2c1)c3cscn3	BroadT	BRD-K77695569	BRD-K77695569-001-04-5	MicroSource Discovery Systems Inc.	1500570			c1nc(cs1)-c1nc2ccccc2[nH]1	InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)	WJCNZQLZVWNLKY-UHFFFAOYSA-N	201.036067944							45979
Pizotyline	LSM-3695	Pizotifen, Pizotyline, Sandomigran, BC-105	27400	InChI=1S/C19H21NS/c1-20-11-8-15(9-12-20)19-16-5-3-2-4-14(16)6-7-18-17(19)10-13-21-18/h2-5,10,13H,6-9,11-12H2,1H3	FIADGNVRKBPQEU-UHFFFAOYSA-N	CN1CCC(=C2c3ccccc3CCc4sccc24)CC1	BroadT	BRD-K75958195	BRD-K75958195-001-01-7	Biomol International Inc.	NS-740	2813-N1283		CN1CCC(CC1)=C1c2ccsc2CCc2ccccc12	InChI=1S/C19H21NS/c1-20-11-8-15(9-12-20)19-16-5-3-2-4-14(16)6-7-18-17(19)10-13-21-18/h2-5,10,13H,6-9,11-12H2,1H3	FIADGNVRKBPQEU-UHFFFAOYSA-N	295.139470372							50212, 50212, 50212, 50212, 50212
Bunolol	LSM-5810	Levobunolol, Bunolol, Ixhbtmclrnmkhz-Gfccvegcsa-N	5460339	InChI=1S/C17H25NO3/c1-17(2,3)18-10-12(19)11-21-16-9-5-6-13-14(16)7-4-8-15(13)20/h5-6,9,12,18-19H,4,7-8,10-11H2,1-3H3/t12-/m1/s1	IXHBTMCLRNMKHZ-GFCCVEGCSA-N	CC(C)(C)NC[C@@H](O)COc1cccc2C(=O)CCCc12	BroadT	BRD-K73323637	BRD-K73323637-003-03-4	Prestwick Chemical Inc.	Prestw-857	D0701-MP04-ST03-200-	Cl	CC(C)(C)NC[C@@H](O)COc1cccc2C(=O)CCCc12.Cl	InChI=1S/C17H25NO3.ClH/c1-17(2,3)18-10-12(19)11-21-16-9-5-6-13-14(16)7-4-8-15(13)20;/h5-6,9,12,18-19H,4,7-8,10-11H2,1-3H3;1H/t12-;/m1./s1	DNTDOBSIBZKFCP-UTONKHPSSA-N	291.18344367							94729, 94729
ICI 162846	LSM-3484	BRD-K66782112	134778	InChI=1S/C11H17F3N6O/c12-11(13,14)7-17-10(16)18-9-4-6-20(19-9)5-2-1-3-8(15)21/h4,6H,1-3,5,7H2,(H2,15,21)(H3,16,17,18,19)	ALCSGJCIESECFD-UHFFFAOYSA-N	NC(=O)CCCCn1ccc(N=C(N)NCC(F)(F)F)n1	BroadT	BRD-K66782112	BRD-K66782112-001-01-2	Tocris Bioscience	833	1		NC(=O)CCCCn1ccc(N=C(N)NCC(F)(F)F)n1	InChI=1S/C11H17F3N6O/c12-11(13,14)7-17-10(16)18-9-4-6-20(19-9)5-2-1-3-8(15)21/h4,6H,1-3,5,7H2,(H2,15,21)(H3,16,17,18,19)	ALCSGJCIESECFD-UHFFFAOYSA-N	306.141593824							93167
UNII-MET7ZRB8Y7	LSM-3754	BRD-K78122587, SID124892342, SID26755048	9957280	InChI=1S/C30H38FN3O2/c1-20(2)28-24-13-12-23(31)19-22(24)14-15-30(28,36-29(35)21-10-11-21)16-18-34(3)17-6-9-27-32-25-7-4-5-8-26(25)33-27/h4-5,7-8,12-13,19-21,28H,6,9-11,14-18H2,1-3H3,(H,32,33)/t28-,30-/m0/s1	VHHVPDKNKPNKHY-JDXGNMNLSA-N	CC(C)[C@H]1c2ccc(F)cc2CC[C@@]1(CCN(C)CCCc3nc4ccccc4[nH]3)OC(=O)C5CC5	BroadT	BRD-K78122587	BRD-K78122587-300-01-9	Tocris Bioscience	2268	2	Cl.Cl	CC(C)[C@H]1c2ccc(F)cc2CC[C@@]1(CCN(C)CCCc1nc2ccccc2[nH]1)OC(=O)C1CC1.Cl.Cl	InChI=1S/C30H38FN3O2.2ClH/c1-20(2)28-24-13-12-23(31)19-22(24)14-15-30(28,36-29(35)21-10-11-21)16-18-34(3)17-6-9-27-32-25-7-4-5-8-26(25)33-27;;/h4-5,7-8,12-13,19-21,28H,6,9-11,14-18H2,1-3H3,(H,32,33);2*1H/t28-,30-;;/m0../s1	BCCQNBXHUMKLFW-HNQRYHMESA-N	491.294805686							93374
Daidzein	LSM-2935		5281708	InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H	ZQSIJRDFPHDXIC-UHFFFAOYSA-N	Oc1ccc(cc1)C2=COc3cc(O)ccc3C2=O	BroadT	BRD-K42095107	BRD-K42095107-001-02-3	AnalytiCon Discovery GmbH	NP-001653			Oc1ccc(cc1)-c1coc2cc(O)ccc2c1=O	InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H	ZQSIJRDFPHDXIC-UHFFFAOYSA-N	254.0579088							28197
Dihydrosamidin	LSM-3429		442128	InChI=1S/C21H24O7/c1-11(2)10-16(24)27-20-19(25-12(3)22)17-14(28-21(20,4)5)8-6-13-7-9-15(23)26-18(13)17/h6-9,11,19-20H,10H2,1-5H3/t19-,20-/m1/s1	ALKTVPFKDYZFGA-WOJBJXKFSA-N	CC(C)CC(=O)O[C@@H]1[C@H](OC(=O)C)c2c(OC1(C)C)ccc3C=CC(=O)Oc23	BroadT	BRD-K63945320	BRD-K63945320-001-02-4	AnalytiCon Discovery GmbH	NP-000855			CC(C)CC(=O)O[C@@H]1[C@H](OC(C)=O)c2c(OC1(C)C)ccc1ccc(=O)oc21	InChI=1S/C21H24O7/c1-11(2)10-16(24)27-20-19(25-12(3)22)17-14(28-21(20,4)5)8-6-13-7-9-15(23)26-18(13)17/h6-9,11,19-20H,10H2,1-5H3/t19-,20-/m1/s1	ALKTVPFKDYZFGA-WOJBJXKFSA-N	388.152203108							4583
Hippeastrine	LSM-3588	(+)-Hippeastrine	441594	InChI=1S/C17H17NO5/c1-18-3-2-8-4-11(19)16-14(15(8)18)9-5-12-13(22-7-21-12)6-10(9)17(20)23-16/h4-6,11,14-16,19H,2-3,7H2,1H3/t11-,14-,15+,16+/m0/s1	DGQPIOQRPAGNGB-DANNLKNASA-N	CN1CCC2=C[C@H](O)[C@H]3OC(=O)c4cc5OCOc5cc4[C@H]3[C@H]12	BroadT	BRD-K71003802	BRD-K71003802-001-02-9	Prestwick Chemical Inc.	Prestw-675	D0701-MP04-ST03-200-		CN1CCC2=C[C@H](O)[C@H]3OC(=O)c4cc5OCOc5cc4[C@H]3[C@H]12	InChI=1S/C17H17NO5/c1-18-3-2-8-4-11(19)16-14(15(8)18)9-5-12-13(22-7-21-12)6-10(9)17(20)23-16/h4-6,11,14-16,19H,2-3,7H2,1H3/t11-,14-,15+,16+/m0/s1	DGQPIOQRPAGNGB-DANNLKNASA-N	315.110672654							5724
Dcmu	LSM-25609	Diuron	3120	InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)	XMTQQYYKAHVGBJ-UHFFFAOYSA-N	CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1	BroadT	BRD-K75330923	BRD-K75330923-001-02-6	MicroSource Discovery Systems Inc.	330030			CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)	XMTQQYYKAHVGBJ-UHFFFAOYSA-N	232.01701838							116509
CHEMBL66323	LSM-25610	BRD-K76263570	1713	InChI=1S/C17H15N3O3/c1-21-12-3-4-14-13(7-12)17(20-9-19-14)18-8-11-2-5-15-16(6-11)23-10-22-15/h2-7,9H,8,10H2,1H3,(H,18,19,20)	GZQGUYVURISNFJ-UHFFFAOYSA-N	COc1ccc2ncnc(NCc3ccc4OCOc4c3)c2c1	BroadT	BRD-K76263570	BRD-K76263570-001-01-6	EMD Biosciences	475250			COc1ccc2ncnc(NCc3ccc4OCOc4c3)c2c1	InChI=1S/C17H15N3O3/c1-21-12-3-4-14-13(7-12)17(20-9-19-14)18-8-11-2-5-15-16(6-11)23-10-22-15/h2-7,9H,8,10H2,1H3,(H,18,19,20)	GZQGUYVURISNFJ-UHFFFAOYSA-N	309.11134137							114176
L-692585	LSM-3566	L-692585, L-692,585, BRD-K70241288	9872740	InChI=1S/C32H37N7O3/c1-21(40)19-33-32(2,3)18-29(41)34-27-17-16-24-8-4-7-11-28(24)39(31(27)42)20-22-12-14-23(15-13-22)25-9-5-6-10-26(25)30-35-37-38-36-30/h4-15,21,27,33,40H,16-20H2,1-3H3,(H,34,41)(H,35,36,37,38)/t21-,27-/m1/s1	AYBCFPXLXOLPIZ-JIPXPUAJSA-N	C[C@@H](O)CNC(C)(C)CC(=O)N[C@@H]1CCc2ccccc2N(Cc3ccc(cc3)c4ccccc4c5nn[nH]n5)C1=O	BroadT	BRD-K70241288	BRD-K70241288-001-01-1	Tocris Bioscience	2261	1		C[C@@H](O)CNC(C)(C)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(cc2)-c2ccccc2-c2nn[nH]n2)C1=O	InChI=1S/C32H37N7O3/c1-21(40)19-33-32(2,3)18-29(41)34-27-17-16-24-8-4-7-11-28(24)39(31(27)42)20-22-12-14-23(15-13-22)25-9-5-6-10-26(25)30-35-37-38-36-30/h4-15,21,27,33,40H,16-20H2,1-3H3,(H,34,41)(H,35,36,37,38)/t21-,27-/m1/s1	AYBCFPXLXOLPIZ-JIPXPUAJSA-N	567.295788114							93230
Apomorphine	LSM-25611	Apomorphine, Apomorphine Hydrochloride	6005	InChI=1S/C17H17NO2/c1-18-8-7-10-3-2-4-12-15(10)13(18)9-11-5-6-14(19)17(20)16(11)12/h2-6,13,19-20H,7-9H2,1H3/t13-/m1/s1	VMWNQDUVQKEIOC-CYBMUJFWSA-N	CN1CCc2cccc3c2[C@H]1Cc4ccc(O)c(O)c34	BroadT	BRD-K76022557	BRD-K76022557-001-01-3	Biomol International Inc.	AC-748	2812-3-N1298		CN1CCc2cccc-3c2[C@H]1Cc1ccc(O)c(O)c-31	InChI=1S/C17H17NO2/c1-18-8-7-10-3-2-4-12-15(10)13(18)9-11-5-6-14(19)17(20)16(11)12/h2-6,13,19-20H,7-9H2,1H3/t13-/m1/s1	VMWNQDUVQKEIOC-CYBMUJFWSA-N	267.125928794							48538, 48538, 48538, 48538
Sinapic Acid Methyl Ether	LSM-44124	3,4,5-Trimethoxycinnamic Acid, BRD-K63758740, SID26724201, SID26749575, SID93576732	735755	InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+	YTFVRYKNXDADBI-SNAWJCMRSA-N	COc1cc(\C=C\C(=O)O)cc(OC)c1OC	BroadT	BRD-K63758740	BRD-K63758740-001-02-3	MicroSource Discovery Systems Inc.	290032			COc1cc(cc(OC)c1OC)\C=C\C(O)=O	InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+	YTFVRYKNXDADBI-SNAWJCMRSA-N	238.084123548							
Kenpaullone	LSM-2824	Kenpaullone	3820	InChI=1S/C16H11BrN2O/c17-9-5-6-14-11(7-9)12-8-15(20)18-13-4-2-1-3-10(13)16(12)19-14/h1-7,19H,8H2,(H,18,20)	QQUXFYAWXPMDOE-UHFFFAOYSA-N	Brc1ccc2[nH]c3c(CC(=O)Nc4ccccc34)c2c1	BroadT	BRD-K37312348	BRD-K37312348-001-05-1	Biomol International Inc.	kenpaullone			Brc1ccc2[nH]c-3c(CC(=O)Nc4ccccc-34)c2c1	InChI=1S/C16H11BrN2O/c17-9-5-6-14-11(7-9)12-8-15(20)18-13-4-2-1-3-10(13)16(12)19-14/h1-7,19H,8H2,(H,18,20)	QQUXFYAWXPMDOE-UHFFFAOYSA-N	326.005475592							92658
10045-45-1	LSM-25613	BRD-K70586315, SID11113874	82320	InChI=1S/C9H10N2O/c1-2-11-8-6-4-3-5-7(8)10-9(11)12/h3-6H,2H2,1H3,(H,10,12)	CXUCKELNYMZTRT-UHFFFAOYSA-N	CCN1C(=O)Nc2ccccc12	BroadT	BRD-K70586315	BRD-K70586315-001-01-6	Tocris Bioscience	1041	5		CCn1c2ccccc2[nH]c1=O	InChI=1S/C9H10N2O/c1-2-11-8-6-4-3-5-7(8)10-9(11)12/h3-6H,2H2,1H3,(H,10,12)	CXUCKELNYMZTRT-UHFFFAOYSA-N	162.07931296							34076
STO609	LSM-3164	SID11114134, SID29215042, STO 609, STO-609	3467590	InChI=1S/C19H10N2O3/c22-18-13-5-3-4-10-11(19(23)24)8-9-12(16(10)13)17-20-14-6-1-2-7-15(14)21(17)18/h1-9H,(H,23,24)	MYKOWOGZBMOVBJ-UHFFFAOYSA-N	OC(=O)c1ccc2c3nc4ccccc4n3C(=O)c5cccc1c25	BroadT	BRD-K52620403	BRD-K52620403-001-01-8	Calbiochem	STO 609			OC(=O)c1ccc2c3nc4ccccc4n3c(=O)c3cccc1c23	InChI=1S/C19H10N2O3/c22-18-13-5-3-4-10-11(19(23)24)8-9-12(16(10)13)17-20-14-6-1-2-7-15(14)21(17)18/h1-9H,(H,23,24)	MYKOWOGZBMOVBJ-UHFFFAOYSA-N	314.0691422							92918, 92918
BSPBIO_001473	LSM-3554	Ryanodine	6610313	InChI=1S/C25H35NO9/c1-12(2)22(31)17(34-16(28)14-7-6-10-26-14)23(32)18(4)11-21(30)19(22,5)25(23,33)24(35-21)15(27)13(3)8-9-20(18,24)29/h6-7,10,12-13,15,17,26-27,29-33H,8-9,11H2,1-5H3/t13-,15+,17+,18-,19+,20-,21-,22-,23+,24+,25+/m0/s1	JJSYXNQGLHBRRK-RGPFZKLOSA-N	CC(C)[C@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]3(O)[C@@]4(C)C[C@]5(O)O[C@@]6([C@H](O)[C@@H](C)CC[C@]46O)[C@@]3(O)[C@@]15C	BroadT	BRD-K69556541	BRD-K69556541-001-02-6	Biomol International Inc.	CA-450	2840(V2)-3-N1305		CC(C)[C@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@@]14C	InChI=1S/C25H35NO9/c1-12(2)22(31)17(34-16(28)14-7-6-10-26-14)23(32)18(4)11-21(30)19(22,5)25(23,33)24(35-21)15(27)13(3)8-9-20(18,24)29/h6-7,10,12-13,15,17,26-27,29-33H,8-9,11H2,1-5H3/t13-,15+,17+,18-,19+,20-,21-,22-,23+,24+,25+/m0/s1	JJSYXNQGLHBRRK-RGPFZKLOSA-N	493.23118171							
Methylorsellinic Acid, Ethyl Ester	LSM-25614	BRD-K68438316, Ethyl 2,4-Dihydroxy-3,6-Dimethylbenzoate, SID26749810	3084545	InChI=1S/C11H14O4/c1-4-15-11(14)9-6(2)5-8(12)7(3)10(9)13/h5,12-13H,4H2,1-3H3	VJLLNFDLMWPNBN-UHFFFAOYSA-N	CCOC(=O)c1c(C)cc(O)c(C)c1O	BroadT	BRD-K68438316	BRD-K68438316-001-02-1	MicroSource Discovery Systems Inc.	210072			CCOC(=O)c1c(C)cc(O)c(C)c1O	InChI=1S/C11H14O4/c1-4-15-11(14)9-6(2)5-8(12)7(3)10(9)13/h5,12-13H,4H2,1-3H3	VJLLNFDLMWPNBN-UHFFFAOYSA-N	210.089208928							114177
Isoquercetin	LSM-5818	BRD-K73991644, NSC-407304	5280804	InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21+/m1/s1	OVSQVDMCBVZWGM-QSOFNFLRSA-N	OC[C@H]1O[C@@H](OC2=C(Oc3cc(O)cc(O)c3C2=O)c4ccc(O)c(O)c4)[C@H](O)[C@@H](O)[C@@H]1O	BroadT	BRD-K73991644	BRD-K73991644-001-01-7	AnalytiCon Discovery GmbH	NP-000212			OC[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O	InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21+/m1/s1	OVSQVDMCBVZWGM-QSOFNFLRSA-N	464.09547608							68352
Flurofamide	LSM-3502	Flurfamide, Flurofamide, BRD-K67445247, EU-4534	51173	InChI=1S/C7H9FN3O2P/c8-6-3-1-5(2-4-6)7(12)11-14(9,10)13/h1-4H,(H5,9,10,11,12,13)	QWZFVMCWPLMLTL-UHFFFAOYSA-N	NP(=O)(N)NC(=O)c1ccc(F)cc1	BroadT	BRD-K67445247	BRD-K67445247-001-01-3	Tocris Bioscience	478	1		NP(N)(=O)NC(=O)c1ccc(F)cc1	InChI=1S/C7H9FN3O2P/c8-6-3-1-5(2-4-6)7(12)11-14(9,10)13/h1-4H,(H5,9,10,11,12,13)	QWZFVMCWPLMLTL-UHFFFAOYSA-N	217.041641268							93179
Fenthion	LSM-25615	Fenthion, Spotton, Tiguvon, Pro-Spot	3346	InChI=1S/C10H15O3PS2/c1-8-7-9(5-6-10(8)16-4)13-14(15,11-2)12-3/h5-7H,1-4H3	PNVJTZOFSHSLTO-UHFFFAOYSA-N	COP(=S)(OC)Oc1ccc(SC)c(C)c1	BroadT	BRD-K67217586	BRD-K67217586-001-02-3	MicroSource Discovery Systems Inc.	330064			COP(=S)(OC)Oc1ccc(SC)c(C)c1	InChI=1S/C10H15O3PS2/c1-8-7-9(5-6-10(8)16-4)13-14(15,11-2)12-3/h5-7H,1-4H3	PNVJTZOFSHSLTO-UHFFFAOYSA-N	278.02002223							34761
SPBIO_001909	LSM-3763	Iriflophenone Trimethyl Ether	6710752	InChI=1S/C16H16O5/c1-19-12-8-13(20-2)15(14(9-12)21-3)16(18)10-4-6-11(17)7-5-10/h4-9,17H,1-3H3	ZUURCCMODYVZRR-UHFFFAOYSA-N	COc1cc(OC)c(C(=O)c2ccc(O)cc2)c(OC)c1	BroadT	BRD-K78329127	BRD-K78329127-001-02-9	MicroSource Discovery Systems Inc.	211511			COc1cc(OC)c(C(=O)c2ccc(O)cc2)c(OC)c1	InChI=1S/C16H16O5/c1-19-12-8-13(20-2)15(14(9-12)21-3)16(18)10-4-6-11(17)7-5-10/h4-9,17H,1-3H3	ZUURCCMODYVZRR-UHFFFAOYSA-N	288.099773612							93380
164178-33-0	LSM-3415	BRD-K63533170, AM-630	4302963	InChI=1S/C23H25IN2O3/c1-16-22(23(27)17-3-6-19(28-2)7-4-17)20-8-5-18(24)15-21(20)26(16)10-9-25-11-13-29-14-12-25/h3-8,15H,9-14H2,1-2H3	JHOTYHDSLIUKCJ-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)c2c(C)n(CCN3CCOCC3)c4cc(I)ccc24	BroadT	BRD-K63533170	BRD-K63533170-001-01-1	Tocris Bioscience	1120	12		COc1ccc(cc1)C(=O)c1c(C)n(CCN2CCOCC2)c2cc(I)ccc12	InChI=1S/C23H25IN2O3/c1-16-22(23(27)17-3-6-19(28-2)7-4-17)20-8-5-18(24)15-21(20)26(16)10-9-25-11-13-29-14-12-25/h3-8,15H,9-14H2,1-2H3	JHOTYHDSLIUKCJ-UHFFFAOYSA-N	504.09098568							93112
Dimethisoquin	LSM-3647	Quinisocaine, Dimethisoquin	6857	InChI=1S/C17H24N2O/c1-4-5-9-15-13-14-8-6-7-10-16(14)17(18-15)20-12-11-19(2)3/h6-8,10,13H,4-5,9,11-12H2,1-3H3	XNMYNYSCEJBRPZ-UHFFFAOYSA-N	CCCCc1cc2ccccc2c(OCCN(C)C)n1	BroadT	BRD-K73391359	BRD-K73391359-003-03-7	Prestwick Chemical Inc.	Prestw-630	D0701-MP04-ST03-200-	Cl	CCCCc1cc2ccccc2c(OCCN(C)C)n1.Cl	InChI=1S/C17H24N2O.ClH/c1-4-5-9-15-13-14-8-6-7-10-16(14)17(18-15)20-12-11-19(2)3;/h6-8,10,13H,4-5,9,11-12H2,1-3H3;1H	SEYCAKMZVYADRS-UHFFFAOYSA-N	272.188863408							93295, 93295
Furosemide	LSM-5847	Lasix, Furosemide, Frusemide, Disal, Aquamed, LB-502	3440	InChI=1S/C12H11ClN2O5S/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h1-5,15H,6H2,(H,16,17)(H2,14,18,19)	ZZUFCTLCJUWOSV-UHFFFAOYSA-N	NS(=O)(=O)c1cc(C(=O)O)c(NCc2occc2)cc1Cl	BroadT	BRD-K78010432	BRD-K78010432-001-04-1	MicroSource Discovery Systems Inc.	1500310			NS(=O)(=O)c1cc(C(O)=O)c(NCc2ccco2)cc1Cl	InChI=1S/C12H11ClN2O5S/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h1-5,15H,6H2,(H,16,17)(H2,14,18,19)	ZZUFCTLCJUWOSV-UHFFFAOYSA-N	330.007719872							47426, 47426
Methyl 7-desoxypurpurogallin-7-carboxylate trimethyl ether	LSM-3428	BRD-K63938928, SID26749531	4020695	InChI=1S/C16H16O6/c1-19-11-6-5-9-7-10(16(18)22-4)8-12(20-2)14(17)13(9)15(11)21-3/h5-8H,1-4H3	MCWFXQXXVFZOIE-UHFFFAOYSA-N	COC(=O)C1=Cc2ccc(OC)c(OC)c2C(=O)C(=C1)OC	BroadT	BRD-K63938928	BRD-K63938928-001-02-5	MicroSource Discovery Systems Inc.	210522			COC(=O)c1cc(OC)c(=O)c2c(OC)c(OC)ccc2c1	InChI=1S/C16H16O6/c1-19-11-6-5-9-7-10(16(18)22-4)8-12(20-2)14(17)13(9)15(11)21-3/h5-8H,1-4H3	MCWFXQXXVFZOIE-UHFFFAOYSA-N	304.094688232							93119
ZM323881	LSM-3513	BRD-K67831364, ZM-323881	16759369	InChI=1S/C22H18FN3O2/c1-14-9-18(23)20(11-21(14)27)26-22-17-8-7-16(10-19(17)24-13-25-22)28-12-15-5-3-2-4-6-15/h2-11,13,27H,12H2,1H3,(H,24,25,26)	NVBNDZZLJRYRPD-UHFFFAOYSA-N	Cc1cc(F)c(Nc2ncnc3cc(OCc4ccccc4)ccc23)cc1O	BroadT	BRD-K67831364	BRD-K67831364-003-01-7	Tocris Bioscience	2475	1	Cl	Cc1cc(F)c(Nc2ncnc3cc(OCc4ccccc4)ccc23)cc1O.Cl	InChI=1S/C22H18FN3O2.ClH/c1-14-9-18(23)20(11-21(14)27)26-22-17-8-7-16(10-19(17)24-13-25-22)28-12-15-5-3-2-4-6-15;/h2-11,13,27H,12H2,1H3,(H,24,25,26);1H	AVRHWGLIYGJSOD-UHFFFAOYSA-N	375.138305046							91185
Phenazopyridine	LSM-3705	Phenazopyridine, BRD-K76304753	4756	InChI=1S/C11H11N5/c12-10-7-6-9(11(13)14-10)16-15-8-4-2-1-3-5-8/h1-7H,(H4,12,13,14)	QPFYXYFORQJZEC-UHFFFAOYSA-N	Nc1ccc(N=Nc2ccccc2)c(N)n1	BroadT	BRD-K76304753	BRD-K76304753-003-04-7	MicroSource Discovery Systems Inc.	1500473		Cl	Nc1ccc(\N=N\c2ccccc2)c(N)n1.Cl	InChI=1S/C11H11N5.ClH/c12-10-7-6-9(11(13)14-10)16-15-8-4-2-1-3-5-8;/h1-7H,(H4,12,13,14);1H/b16-15+;	QQBPIHBUCMDKFG-GEEYTBSJSA-N	213.101445402							71416, 71416
CHEMBL3188521	LSM-3435	BRD-K64245000	44483281	InChI=1S/C28H22Cl3NO4/c1-16(2)27-21(26(32-36-27)25-22(29)7-4-8-23(25)30)15-35-20-12-11-18(24(31)14-20)10-9-17-5-3-6-19(13-17)28(33)34/h3-14,16H,15H2,1-2H3,(H,33,34)	BYTNEISLBIENSA-UHFFFAOYSA-N	CC(C)c1onc(c1COc2ccc(C=Cc3cccc(c3)C(=O)O)c(Cl)c2)c4c(Cl)cccc4Cl	BroadT	BRD-K64245000	BRD-K64245000-001-01-7	Tocris Bioscience	2473	1		CC(C)c1onc(c1COc1ccc(C=Cc2cccc(c2)C(O)=O)c(Cl)c1)-c1c(Cl)cccc1Cl	InChI=1S/C28H22Cl3NO4/c1-16(2)27-21(26(32-36-27)25-22(29)7-4-8-23(25)30)15-35-20-12-11-18(24(31)14-20)10-9-17-5-3-6-19(13-17)28(33)34/h3-14,16H,15H2,1-2H3,(H,33,34)	BYTNEISLBIENSA-UHFFFAOYSA-N	541.061441324							93125
Omacetaxine Mepesuccinate	LSM-3716	Synribo, Homoharringtonine, CGX-635, BRD-K76674262, Omacetaxine Mepesuccinate	285033	InChI=1S/C29H39NO9/c1-27(2,33)8-5-10-29(34,16-23(31)36-4)26(32)39-25-22(35-3)15-28-9-6-11-30(28)12-7-18-13-20-21(38-17-37-20)14-19(18)24(25)28/h13-15,24-25,33-34H,5-12,16-17H2,1-4H3/t24-,25-,28+,29-/m1/s1	HYFHYPWGAURHIV-JFIAXGOJSA-N	COC(=O)C[C@](O)(CCCC(C)(C)O)C(=O)O[C@H]1[C@H]2c3cc4OCOc4cc3CCN5CCC[C@]25C=C1OC	BroadT	BRD-K76674262	BRD-K76674262-001-01-7	Tocris Bioscience	1416	1		COC(=O)C[C@](O)(CCCC(C)(C)O)C(=O)O[C@H]1[C@H]2c3cc4OCOc4cc3CCN3CCC[C@]23C=C1OC	InChI=1S/C29H39NO9/c1-27(2,33)8-5-10-29(34,16-23(31)36-4)26(32)39-25-22(35-3)15-28-9-6-11-30(28)12-7-18-13-20-21(38-17-37-20)14-19(18)24(25)28/h13-15,24-25,33-34H,5-12,16-17H2,1-4H3/t24-,25-,28+,29-/m1/s1	HYFHYPWGAURHIV-JFIAXGOJSA-N	545.262481838							71019
Aceclofenac	LSM-5762	Aceclofenac	71771	InChI=1S/C16H13Cl2NO4/c17-11-5-3-6-12(18)16(11)19-13-7-2-1-4-10(13)8-15(22)23-9-14(20)21/h1-7,19H,8-9H2,(H,20,21)	MNIPYSSQXLZQLJ-UHFFFAOYSA-N	OC(=O)COC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl	BroadT	BRD-K68538666	BRD-K68538666-001-03-2	Prestwick Chemical Inc.	Prestw-175	D0701-MP04-ST03-200-		OC(=O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl	InChI=1S/C16H13Cl2NO4/c17-11-5-3-6-12(18)16(11)19-13-7-2-1-4-10(13)8-15(22)23-9-14(20)21/h1-7,19H,8-9H2,(H,20,21)	MNIPYSSQXLZQLJ-UHFFFAOYSA-N	353.022163326							31159
6266-99-5	LSM-3501	BRD-K67439147	235382	InChI=1S/C14H13N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-11H,1H3	SISOFUCTXZKSOQ-UHFFFAOYSA-N	Cc1cccc(C=Cc2ccccc2)n1	BroadT	BRD-K67439147	BRD-K67439147-001-01-7	Tocris Bioscience	1214	1		Cc1cccc(C=Cc2ccccc2)n1	InChI=1S/C14H13N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-11H,1H3	SISOFUCTXZKSOQ-UHFFFAOYSA-N	195.104799426							93178
JNJ-16259685	LSM-3443	BRD-K64670467	11313361	InChI=1S/C20H23NO3/c1-23-17-7-4-13(5-8-17)19(22)14-6-9-18-16(11-14)12-15-3-2-10-24-20(15)21-18/h6,9,11-13,17H,2-5,7-8,10H2,1H3	QOTAQTRFJWLFCR-UHFFFAOYSA-N	COC1CCC(CC1)C(=O)c2ccc3nc4OCCCc4cc3c2	BroadT	BRD-K64670467	BRD-K64670467-001-01-2	Tocris Bioscience	2333	2		COC1CCC(CC1)C(=O)c1ccc2nc3OCCCc3cc2c1	InChI=1S/C20H23NO3/c1-23-17-7-4-13(5-8-17)19(22)14-6-9-18-16(11-14)12-15-3-2-10-24-20(15)21-18/h6,9,11-13,17H,2-5,7-8,10H2,1H3	QOTAQTRFJWLFCR-UHFFFAOYSA-N	325.167793606							93132
Triamcinolone	LSM-3736	Triamcinolone, Kenalog, Kenacort, Fluoxiprednisolone, Aristocort, Aristocort A	31307	InChI=1S/C21H27FO6/c1-18-6-5-12(24)7-11(18)3-4-13-14-8-15(25)21(28,17(27)10-23)19(14,2)9-16(26)20(13,18)22/h5-7,13-16,23,25-26,28H,3-4,8-10H2,1-2H3/t13-,14-,15+,16-,18-,19-,20-,21-/m0/s1	GFNANZIMVAIWHM-OBYCQNJPSA-N	C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@@H](O)[C@]2(O)C(=O)CO	BroadT	BRD-K77554836	BRD-K77554836-001-03-3	Prestwick Chemical Inc.	Prestw-120	D0701-MP04-ST03-200-		C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@@H](O)[C@]2(O)C(=O)CO	InChI=1S/C21H27FO6/c1-18-6-5-12(24)7-11(18)3-4-13-14-8-15(25)21(28,17(27)10-23)19(14,2)9-16(26)20(13,18)22/h5-7,13-16,23,25-26,28H,3-4,8-10H2,1-2H3/t13-,14-,15+,16-,18-,19-,20-,21-/m0/s1	GFNANZIMVAIWHM-OBYCQNJPSA-N	394.179166784							9667
Clobenpropit	LSM-3600	Clobenpropit, BRD-K71430621	2790	InChI=1S/C14H17ClN4S/c15-12-5-3-11(4-6-12)8-18-14(16)20-7-1-2-13-9-17-10-19-13/h3-6,9-10H,1-2,7-8H2,(H2,16,18)(H,17,19)	UCAIEVHKDLMIFL-UHFFFAOYSA-N	Clc1ccc(CNC(=N)SCCCc2c[nH]cn2)cc1	BroadT	BRD-K71430621	BRD-K71430621-303-01-5	Tocris Bioscience	752	2	Br.Br	Clc1ccc(CNC(=N)SCCCc2c[nH]cn2)cc1.Br.Br	InChI=1S/C14H17ClN4S.2BrH/c15-12-5-3-11(4-6-12)8-18-14(16)20-7-1-2-13-9-17-10-19-13;;/h3-6,9-10H,1-2,7-8H2,(H2,16,18)(H,17,19);2*1H	JIJQPEZAVLJZBO-UHFFFAOYSA-N	308.086244984							64177
Milrinone	LSM-3493		4197	InChI=1S/C12H9N3O/c1-8-11(9-2-4-14-5-3-9)6-10(7-13)12(16)15-8/h2-6H,1H3,(H,15,16)	PZRHRDRVRGEVNW-UHFFFAOYSA-N	Cc1nc(O)c(cc1c2ccncc2)C#N	BroadT	BRD-K67080878	BRD-K67080878-001-05-5	Tocris Bioscience	1504	1		Cc1[nH]c(=O)c(cc1-c1ccncc1)C#N	InChI=1S/C12H9N3O/c1-8-11(9-2-4-14-5-3-9)6-10(7-13)12(16)15-8/h2-6H,1H3,(H,15,16)	PZRHRDRVRGEVNW-UHFFFAOYSA-N	211.074561938							50693, 50693
(4Ar,10br)-Rel-4-propyl-2,3,4,4a,5,10b-hexahydrochromeno[4,3-b][1,4]oxazin-9-ol	LSM-25616	PD 128907, SID11111597, SID11111598, SID11113990	5311346	InChI=1S/C14H19NO3/c1-2-5-15-6-7-17-14-11-8-10(16)3-4-13(11)18-9-12(14)15/h3-4,8,12,14,16H,2,5-7,9H2,1H3/t12-,14-/m1/s1	YOILXOMTHPUMRG-TZMCWYRMSA-N	CCCN1CCO[C@H]2[C@H]1COc3ccc(O)cc23	BroadT	BRD-K62456038	BRD-K62456038-001-01-8	Biomol International Inc.	AC-258	2812-3-N1298		CCCN1CCO[C@H]2[C@H]1COc1ccc(O)cc21	InChI=1S/C14H19NO3/c1-2-5-15-6-7-17-14-11-8-10(16)3-4-13(11)18-9-12(14)15/h3-4,8,12,14,16H,2,5-7,9H2,1H3/t12-,14-/m1/s1	YOILXOMTHPUMRG-TZMCWYRMSA-N	249.136493478							114178, 114178
Corvasal	LSM-25617	Molsidomine	4239	InChI=1S/C9H14N4O4/c1-2-16-9(14)10-8-7-13(11-17-8)12-3-5-15-6-4-12/h7H,2-6H2,1H3/p+1	XLFWDASMENKTKL-UHFFFAOYSA-O	CCOC(=O)Nc1on[n+](c1)N2CCOCC2	BroadT	BRD-K63861289	BRD-K63861289-001-03-0	MicroSource Discovery Systems Inc.	1500673			CCOC(=O)Nc1c[n+](no1)N1CCOCC1	InChI=1S/C9H14N4O4/c1-2-16-9(14)10-8-7-13(11-17-8)12-3-5-15-6-4-12/h7H,2-6H2,1H3/p+1	XLFWDASMENKTKL-UHFFFAOYSA-O	243.10933							114179
PD-169316	LSM-3731	PD169316, PD-169316	4712	InChI=1S/C20H13FN4O2/c21-16-5-1-13(2-6-16)18-19(14-9-11-22-12-10-14)24-20(23-18)15-3-7-17(8-4-15)25(26)27/h1-12H,(H,23,24)	BGIYKDUASORTBB-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)c2nc(c3ccc(F)cc3)c([nH]2)c4ccncc4	BroadT	BRD-K77133231	BRD-K77133231-001-01-1	Calbiochem	513030			[O-][N+](=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccncc1)-c1ccc(F)cc1	InChI=1S/C20H13FN4O2/c21-16-5-1-13(2-6-16)18-19(14-9-11-22-12-10-14)24-20(23-18)15-3-7-17(8-4-15)25(26)27/h1-12H,(H,23,24)	BGIYKDUASORTBB-UHFFFAOYSA-N	360.102253896							93358
F-L-Leu	LSM-1586	BRD-A47633927, SID26749936	4308	InChI=1S/C21H23NO4/c1-13(2)11-19(20(23)24)22-21(25)26-12-18-16-9-5-3-7-14(16)15-8-4-6-10-17(15)18/h3-10,13,18-19H,11-12H2,1-2H3,(H,22,25)(H,23,24)	CBPJQFCAFFNICX-UHFFFAOYSA-N	CC(C)CC(NC(=O)OCC1c2ccccc2c3ccccc13)C(=O)O	BroadT	BRD-A47633927	BRD-A47633927-001-01-8	Tocris Bioscience	675	1		CC(C)CC(NC(=O)OCC1c2ccccc2-c2ccccc12)C(O)=O	InChI=1S/C21H23NO4/c1-13(2)11-19(20(23)24)22-21(25)26-12-18-16-9-5-3-7-14(16)15-8-4-6-10-17(15)18/h3-10,13,18-19H,11-12H2,1-2H3,(H,22,25)(H,23,24)	CBPJQFCAFFNICX-UHFFFAOYSA-N	353.162708226							91726
CCT 018159	LSM-3461	BRD-K65503129	6749166	InChI=1S/C20H20N2O4/c1-3-12-8-14(16(24)10-15(12)23)20-19(11(2)21-22-20)13-4-5-17-18(9-13)26-7-6-25-17/h4-5,8-10,23-24H,3,6-7H2,1-2H3,(H,21,22)	OWPMENVYXDJDOW-UHFFFAOYSA-N	CCc1cc(c(O)cc1O)c2n[nH]c(C)c2c3ccc4OCCOc4c3	BroadT	BRD-K65503129	BRD-K65503129-001-01-4	Tocris Bioscience	2435	1		CCc1cc(-c2n[nH]c(C)c2-c2ccc3OCCOc3c2)c(O)cc1O	InChI=1S/C20H20N2O4/c1-3-12-8-14(16(24)10-15(12)23)20-19(11(2)21-22-20)13-4-5-17-18(9-13)26-7-6-25-17/h4-5,8-10,23-24H,3,6-7H2,1-2H3,(H,21,22)	OWPMENVYXDJDOW-UHFFFAOYSA-N	352.14230714							41656
VITAMIN B2	LSM-6648	83-88-5, Riboflavin, Vitamin B2	6759	InChI=1S/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)/t11-,12+,14-/m1/s1	AUNGANRZJHBGPY-MBNYWOFBSA-N	Cc1cc2N=C3C(=O)NC(=O)N=C3N(C[C@@H](O)[C@@H](O)[C@@H](O)CO)c2cc1C	BroadT	BRD-K70246307	BRD-K70246307-001-02-5	MicroSource Discovery Systems Inc.	1505347			Cc1cc2nc3c(nc(=O)[nH]c3=O)n(C[C@@H](O)[C@@H](O)[C@@H](O)CO)c2cc1C	InChI=1S/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)/t11-,12+,14-/m1/s1	AUNGANRZJHBGPY-MBNYWOFBSA-N	376.1382844							95299
N9-Isopropylolomoucine	LSM-3607	SID103905124, SID26756745, SID26756746, BRD-K71726959	6610355	InChI=1S/C17H22N6O/c1-12(2)23-11-20-14-15(19-10-13-6-4-3-5-7-13)21-17(18-8-9-24)22-16(14)23/h3-7,11-12,24H,8-10H2,1-2H3,(H2,18,19,21,22)	WHDJEAZLMYPLGL-UHFFFAOYSA-N	CC(C)n1cnc2c(NCc3ccccc3)nc(NCCO)nc12	BroadT	BRD-K71726959	BRD-K71726959-001-05-9	Biomol International Inc.	CC-202	2840(V2)-3-N1305		CC(C)n1cnc2c(NCc3ccccc3)nc(NCCO)nc12	InChI=1S/C17H22N6O/c1-12(2)23-11-20-14-15(19-10-13-6-4-3-5-7-13)21-17(18-8-9-24)22-16(14)23/h3-7,11-12,24H,8-10H2,1-2H3,(H2,18,19,21,22)	WHDJEAZLMYPLGL-UHFFFAOYSA-N	326.185509384							93262
UNII-U7RWT9J78O	LSM-44950	Cefixime	6321411	InChI=1S/C16H15N5O7S2/c1-2-6-4-29-14-10(13(25)21(14)11(6)15(26)27)19-12(24)9(20-28-3-8(22)23)7-5-30-16(17)18-7/h2,5,10,14H,1,3-4H2,(H2,17,18)(H,19,24)(H,22,23)(H,26,27)/b20-9+/t10-,14-/m1/s1	OKBVVJOGVLARMR-VINNURBNSA-N	Nc1nc(cs1)\C(=N/OCC(=O)O)\C(=O)N[C@H]2[C@H]3SCC(=C(N3C2=O)C(=O)O)C=C	BroadT	BRD-K71059170	BRD-K71059170-001-02-5	Prestwick Chemical Inc.	Prestw-462	D0701-MP04-ST03-200-		Nc1nc(cs1)C(=N\OCC(O)=O)\C(=O)N[C@H]1[C@H]2SCC(C=C)=C(N2C1=O)C(O)=O	InChI=1S/C16H15N5O7S2/c1-2-6-4-29-14-10(13(25)21(14)11(6)15(26)27)19-12(24)9(20-28-3-8(22)23)7-5-30-16(17)18-7/h2,5,10,14H,1,3-4H2,(H2,17,18)(H,19,24)(H,22,23)(H,26,27)/b20-9-/t10-,14-/m1/s1	OKBVVJOGVLARMR-QSWIMTSFSA-N	453.04128925							, 
Flupentixol	LSM-43011	Flupentixol, LC-44, N-7009	5281881	InChI=1S/C23H25F3N2OS/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29/h1-2,4-8,16,29H,3,9-15H2/b18-5-	NJMYODHXAKYRHW-DVZOWYKESA-N	OCCN1CCN(CC\C=C/2\c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1	BroadT	BRD-K70487031	BRD-K70487031-001-01-0	Biomol International Inc.	AC-750	2812-3-N1298		OCCN1CCN(CC\C=C2\c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1	InChI=1S/C23H25F3N2OS/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29/h1-2,4-8,16,29H,3,9-15H2/b18-5-	NJMYODHXAKYRHW-DVZOWYKESA-N	434.16396873							10454, 10454, 10454
Isopimpinellin	LSM-25618	5,8-Dimethoxypsoralen, Isopimpinellin	68079	InChI=1S/C13H10O5/c1-15-10-7-3-4-9(14)18-12(7)13(16-2)11-8(10)5-6-17-11/h3-6H,1-2H3	DFMAXQKDIGCMTL-UHFFFAOYSA-N	COc1c2OC(=O)C=Cc2c(OC)c3ccoc13	BroadT	BRD-K72253829	BRD-K72253829-001-02-8	AnalytiCon Discovery GmbH	NP-002015			COc1c2ccoc2c(OC)c2oc(=O)ccc12	InChI=1S/C13H10O5/c1-15-10-7-3-4-9(14)18-12(7)13(16-2)11-8(10)5-6-17-11/h3-6H,1-2H3	DFMAXQKDIGCMTL-UHFFFAOYSA-N	246.05282342							28853
251992-66-2	LSM-25619	BRD-K77627880, SID50112897	9839311	InChI=1S/C15H12N2OS2/c1-9-2-4-10(5-3-9)19-13-7-17-8-14-11(13)6-12(20-14)15(16)18/h2-8H,1H3,(H2,16,18)	QQGWEXFLMJGCAL-UHFFFAOYSA-N	Cc1ccc(Sc2cncc3sc(cc23)C(=O)N)cc1	BroadT	BRD-K77627880	BRD-K77627880-001-01-6	Tocris Bioscience	2524	1		Cc1ccc(Sc2cncc3sc(cc23)C(N)=O)cc1	InChI=1S/C15H12N2OS2/c1-9-2-4-10(5-3-9)19-13-7-17-8-14-11(13)6-12(20-14)15(16)18/h2-8H,1H3,(H2,16,18)	QQGWEXFLMJGCAL-UHFFFAOYSA-N	300.039104404							114180
Monocrotaline	LSM-6637	Monocrotaline	9415	InChI=1S/C16H23NO6/c1-9-13(18)23-11-5-7-17-6-4-10(12(11)17)8-22-14(19)16(3,21)15(9,2)20/h4,9,11-12,20-21H,5-8H2,1-3H3/t9-,11+,12+,15+,16-/m0/s1	QVCMHGGNRFRMAD-XFGHUUIASA-N	C[C@H]1C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@](C)(O)[C@]1(C)O)[C@H]23	BroadT	BRD-K65508953	BRD-K65508953-001-05-5	Prestwick Chemical Inc.	Prestw-603	D0701-MP04-ST03-200-		C[C@H]1C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@](C)(O)[C@]1(C)O)[C@H]23	InChI=1S/C16H23NO6/c1-9-13(18)23-11-5-7-17-6-4-10(12(11)17)8-22-14(19)16(3,21)15(9,2)20/h4,9,11-12,20-21H,5-8H2,1-3H3/t9-,11+,12+,15+,16-/m0/s1	QVCMHGGNRFRMAD-XFGHUUIASA-N	325.152537466							6980
Clorgiline	LSM-5808	Clorgyline, Clorgiline, M&B-9302	4380	InChI=1S/C13H15Cl2NO/c1-3-7-16(2)8-4-9-17-13-6-5-11(14)10-12(13)15/h1,5-6,10H,4,7-9H2,2H3	BTFHLQRNAMSNLC-UHFFFAOYSA-N	CN(CCCOc1ccc(Cl)cc1Cl)CC#C	BroadT	BRD-K73251053	BRD-K73251053-003-03-2	Prestwick Chemical Inc.	Prestw-344	D0701-MP04-ST03-200-	Cl	CN(CCCOc1ccc(Cl)cc1Cl)CC#C.Cl	InChI=1S/C13H15Cl2NO.ClH/c1-3-7-16(2)8-4-9-17-13-6-5-11(14)10-12(13)15;/h1,5-6,10H,4,7-9H2,2H3;1H	BBAZDLONIUABKI-UHFFFAOYSA-N	271.05306953							3763, 3763
Zoxazolamine	LSM-3476	Zoxazolamine	6103	InChI=1S/C7H5ClN2O/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3H,(H2,9,10)	YGCODSQDUUUKIV-UHFFFAOYSA-N	Nc1oc2ccc(Cl)cc2n1	BroadT	BRD-K66353228	BRD-K66353228-001-05-4	Prestwick Chemical Inc.	Prestw-328	D0701-MP04-ST03-200-		Nc1nc2cc(Cl)ccc2o1	InChI=1S/C7H5ClN2O/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3H,(H2,9,10)	YGCODSQDUUUKIV-UHFFFAOYSA-N	168.00904051							35053
Dipyrone	LSM-5839	Metamizol, Metamizole, Metamizole Sodium	3111	InChI=1S/C13H17N3O4S/c1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3,(H,18,19,20)	LVWZTYCIRDMTEY-UHFFFAOYSA-N	CN(CS(=O)(=O)O)C1=C(C)N(C)N(C1=O)c2ccccc2	BroadT	BRD-K76812510	BRD-K76812510-236-05-6	Prestwick Chemical Inc.	Prestw-713	D0701-MP04-ST03-200-	[Na]	CN(CS(O)(=O)=O)c1c(C)n(C)n(-c2ccccc2)c1=O.[Na]	InChI=1S/C13H17N3O4S.Na.H/c1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11;;/h4-8H,9H2,1-3H3,(H,18,19,20);;	UTNDKPRCMJHBSS-UHFFFAOYSA-N	311.093976744							62088, 62088
NCGC00025321-01	LSM-3669	BRD-K74430258	9604992	InChI=1S/C14H10Cl2N2/c15-12-4-1-3-11(7-12)9-17-10-18-14-6-2-5-13(16)8-14/h1-10H	IVDUVYRBLGSJAO-UHFFFAOYSA-N	Clc1cccc(C=NC=Nc2cccc(Cl)c2)c1	BroadT	BRD-K74430258	BRD-K74430258-001-01-2	Tocris Bioscience	1952	1		Clc1cccc(C=NC=Nc2cccc(Cl)c2)c1	InChI=1S/C14H10Cl2N2/c15-12-4-1-3-11(7-12)9-17-10-18-14-6-2-5-13(16)8-14/h1-10H	IVDUVYRBLGSJAO-UHFFFAOYSA-N	276.02210376							93312
Enoxacin	LSM-5848	Penetrex, Flumark, Enoxacin, PD-107779, CI-919, AT-2266	3229	InChI=1S/C15H17FN4O3/c1-2-19-8-10(15(22)23)12(21)9-7-11(16)14(18-13(9)19)20-5-3-17-4-6-20/h7-8,17H,2-6H2,1H3,(H,22,23)	IDYZIJYBMGIQMJ-UHFFFAOYSA-N	CCN1C=C(C(=O)O)C(=O)c2cc(F)c(nc12)N3CCNCC3	BroadT	BRD-K78113049	BRD-K78113049-001-04-8	MicroSource Discovery Systems Inc.	1503215			CCn1cc(C(O)=O)c(=O)c2cc(F)c(nc12)N1CCNCC1	InChI=1S/C15H17FN4O3/c1-2-19-8-10(15(22)23)12(21)9-7-11(16)14(18-13(9)19)20-5-3-17-4-6-20/h7-8,17H,2-6H2,1H3,(H,22,23)	IDYZIJYBMGIQMJ-UHFFFAOYSA-N	320.128468644							157175
DSSTOX_CID_972	LSM-6522	Nitrofurantoin, SID144204693, SID8139874	4509	InChI=1S/C8H6N4O5/c13-6-4-11(8(14)10-6)9-3-5-1-2-7(17-5)12(15)16/h1-3H,4H2,(H,10,13,14)	NXFQHRVNIOXGAQ-UHFFFAOYSA-N	[O-][N+](=O)c1oc(C=NN2CC(=O)NC2=O)cc1	BroadT	BRD-K76927775	BRD-K76927775-001-04-3	MicroSource Discovery Systems Inc.	1500433			[O-][N+](=O)c1ccc(\C=N\N2CC(=O)NC2=O)o1	InChI=1S/C8H6N4O5/c13-6-4-11(8(14)10-6)9-3-5-1-2-7(17-5)12(15)16/h1-3H,4H2,(H,10,13,14)/b9-3+	NXFQHRVNIOXGAQ-YCRREMRBSA-N	238.033819332							95222
Methoxyvone	LSM-25620	Methoxyvone	4119	InChI=1S/C17H14O3/c1-11-8-13(19-2)9-16-17(11)14(18)10-15(20-16)12-6-4-3-5-7-12/h3-10H,1-2H3	JETSDIPTVSZMLI-UHFFFAOYSA-N	COc1cc(C)c2C(=O)C=C(Oc2c1)c3ccccc3	BroadT	BRD-K56057104	BRD-K56057104-001-02-9	MicroSource Discovery Systems Inc.	1400666			COc1cc(C)c2c(c1)oc(cc2=O)-c1ccccc1	InChI=1S/C17H14O3/c1-11-8-13(19-2)9-16-17(11)14(18)10-15(20-16)12-6-4-3-5-7-12/h3-10H,1-2H3	JETSDIPTVSZMLI-UHFFFAOYSA-N	266.094294308							114181
Dapsone	LSM-5714	Diaphenylsulfone, Diaminodiphenylsulfone, Dapsone, Aczone	2955	InChI=1S/C12H12N2O2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H,13-14H2	MQJKPEGWNLWLTK-UHFFFAOYSA-N	Nc1ccc(cc1)S(=O)(=O)c2ccc(N)cc2	BroadT	BRD-K62363391	BRD-K62363391-001-04-1	MicroSource Discovery Systems Inc.	1500222			Nc1ccc(cc1)S(=O)(=O)c1ccc(N)cc1	InChI=1S/C12H12N2O2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H,13-14H2	MQJKPEGWNLWLTK-UHFFFAOYSA-N	248.061948334							4325
1446-61-3	LSM-3383	BRD-K62289640, SID93576664	62034	InChI=1S/C20H31N/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12,14,18H,5,7,9-11,13,21H2,1-4H3/t18-,19-,20+/m0/s1	JVVXZOOGOGPDRZ-SLFFLAALSA-N	CC(C)c1ccc2c(CC[C@H]3[C@](C)(CN)CCC[C@]23C)c1	BroadT	BRD-K62289640	BRD-K62289640-003-01-9	Tocris Bioscience	2139	1	Cl	CC(C)c1ccc2c(CC[C@H]3[C@](C)(CN)CCC[C@]23C)c1.Cl	InChI=1S/C20H31N.ClH/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4;/h6,8,12,14,18H,5,7,9-11,13,21H2,1-4H3;1H/t18-,19-,20+;/m0./s1	CVPQLGCAWUAYPF-WFBUOHSLSA-N	285.245650002							93086, 93086, 93086
Fraxidin Methyl Ether	LSM-3489	6,7,8,-Trimethoxycoumarin, 6,7,8-Trimethoxycoumarin	3083928	InChI=1S/C12H12O5/c1-14-8-6-7-4-5-9(13)17-10(7)12(16-3)11(8)15-2/h4-6H,1-3H3	RAYQKHLZHPFYEJ-UHFFFAOYSA-N	COc1cc2C=CC(=O)Oc2c(OC)c1OC	BroadT	BRD-K66944906	BRD-K66944906-001-02-6	MicroSource Discovery Systems Inc.	100572			COc1cc2ccc(=O)oc2c(OC)c1OC	InChI=1S/C12H12O5/c1-14-8-6-7-4-5-9(13)17-10(7)12(16-3)11(8)15-2/h4-6H,1-3H3	RAYQKHLZHPFYEJ-UHFFFAOYSA-N	236.068473484							93172
NBI 27914	LSM-3360	BRD-K61177364, SID50104904, SID85231154, SID90340601	176157	InChI=1S/C18H20Cl4N4/c1-3-6-26(9-11-4-5-11)18-15(22)17(23-10(2)24-18)25-16-13(20)7-12(19)8-14(16)21/h7-8,11H,3-6,9H2,1-2H3,(H,23,24,25)	KNADXBVKFAUMCR-UHFFFAOYSA-N	CCCN(CC1CC1)c2nc(C)nc(Nc3c(Cl)cc(Cl)cc3Cl)c2Cl	BroadT	BRD-K61177364	BRD-K61177364-003-01-1	Tocris Bioscience	1591	1	Cl	CCCN(CC1CC1)c1nc(C)nc(Nc2c(Cl)cc(Cl)cc2Cl)c1Cl.Cl	InChI=1S/C18H20Cl4N4.ClH/c1-3-6-26(9-11-4-5-11)18-15(22)17(23-10(2)24-18)25-16-13(20)7-12(19)8-14(16)21;/h7-8,11H,3-6,9H2,1-2H3,(H,23,24,25);1H	CPMGENCTAWBLNW-UHFFFAOYSA-N	432.04420752							93069
IN1048	LSM-3525	BRD-K68246049	5602	InChI=1S/C24H28O2/c1-16(14-17-6-8-18(9-7-17)22(25)26)19-10-11-20-21(15-19)24(4,5)13-12-23(20,2)3/h6-11,14-15H,12-13H2,1-5H3,(H,25,26)	FOIVPCKZDPCJJY-UHFFFAOYSA-N	CC(=Cc1ccc(cc1)C(=O)O)c2ccc3c(c2)C(C)(C)CCC3(C)C	BroadT	BRD-K68246049	BRD-K68246049-001-01-4	Tocris Bioscience	761	3		CC(=Cc1ccc(cc1)C(O)=O)c1ccc2c(c1)C(C)(C)CCC2(C)C	InChI=1S/C24H28O2/c1-16(14-17-6-8-18(9-7-17)22(25)26)19-10-11-20-21(15-19)24(4,5)13-12-23(20,2)3/h6-11,14-15H,12-13H2,1-5H3,(H,25,26)	FOIVPCKZDPCJJY-UHFFFAOYSA-N	348.208930136							93197
KBIO3_002961	LSM-15375	BRD-K68002543	6710775	InChI=1S/C8H10FNO2S/c9-13(11,12)8-4-2-1-3-7(8)5-6-10/h1-4H,5-6,10H2	TZJAEGCLMLTGRJ-UHFFFAOYSA-N	NCCc1ccccc1S(=O)(=O)F	BroadT	BRD-K68002543	BRD-K68002543-003-02-6	MicroSource Discovery Systems Inc.	1505335		Cl	NCCc1ccccc1S(F)(=O)=O.Cl	InChI=1S/C8H10FNO2S.ClH/c9-13(11,12)8-4-2-1-3-7(8)5-6-10;/h1-4H,5-6,10H2;1H	PZVMOEXKXXQZEE-UHFFFAOYSA-N	203.04162746							104019, 104019
Sulfaquinoxaline	LSM-5791	Sulfaquinoxaline	5338	InChI=1S/C14H12N4O2S/c15-10-5-7-11(8-6-10)21(19,20)18-14-9-16-12-3-1-2-4-13(12)17-14/h1-9H,15H2,(H,17,18)	NHZLNPMOSADWGC-UHFFFAOYSA-N	Nc1ccc(cc1)S(=O)(=O)Nc2cnc3ccccc3n2	BroadT	BRD-K71133585	BRD-K71133585-001-01-9	Sigma-Aldrich	S7382			Nc1ccc(cc1)S(=O)(=O)Nc1cnc2ccccc2n1	InChI=1S/C14H12N4O2S/c15-10-5-7-11(8-6-10)21(19,20)18-14-9-16-12-3-1-2-4-13(12)17-14/h1-9H,15H2,(H,17,18)	NHZLNPMOSADWGC-UHFFFAOYSA-N	300.068096354							94719, 94719
DSSTOX_CID_2640	LSM-5301	Aztreonam, SID56463610	54117	InChI=1S/C13H17N5O8S2/c1-5-7(10(20)18(5)28(23,24)25)16-9(19)8(6-4-27-12(14)15-6)17-26-13(2,3)11(21)22/h4-5,7H,1-3H3,(H2,14,15)(H,16,19)(H,21,22)(H,23,24,25)/t5-,7-/m0/s1	WZPBZJONDBGPKJ-FSPLSTOPSA-N	C[C@H]1[C@H](NC(=O)C(=NOC(C)(C)C(=O)O)c2csc(N)n2)C(=O)N1S(=O)(=O)O	BroadT	BRD-K62607865	BRD-K62607865-001-03-0	Prestwick Chemical Inc.	Prestw-185	D0701-MP04-ST03-200-		C[C@H]1[C@H](NC(=O)C(=N/OC(C)(C)C(O)=O)\c2csc(N)n2)C(=O)N1S(O)(=O)=O	InChI=1S/C13H17N5O8S2/c1-5-7(10(20)18(5)28(23,24)25)16-9(19)8(6-4-27-12(14)15-6)17-26-13(2,3)11(21)22/h4-5,7H,1-3H3,(H2,14,15)(H,16,19)(H,21,22)(H,23,24,25)/b17-8-/t5-,7-/m0/s1	WZPBZJONDBGPKJ-VEHQQRBSSA-N	435.051853934							94511
1-(2-Methoxy-phenyl) piperazine	LSM-15376	1-(2-Methoxyphenyl)Piperazine, SID90341119, SID11111755	1346	InChI=1S/C11H16N2O/c1-14-11-5-3-2-4-10(11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3	VNZLQLYBRIOLFZ-UHFFFAOYSA-N	COc1ccccc1N2CCNCC2	BroadT	BRD-K70343553	BRD-K70343553-003-02-7	MicroSource Discovery Systems Inc.	2300348		Cl	COc1ccccc1N1CCNCC1.Cl	InChI=1S/C11H16N2O.ClH/c1-14-11-5-3-2-4-10(11)13-8-6-12-7-9-13;/h2-5,12H,6-9H2,1H3;1H	DDMVHGULHRJOEC-UHFFFAOYSA-N	192.126263152							104020, 104020
Benzocaine	LSM-5830	Americaine, Benzocaine, Baby Anbesol, Ethyl Aminobenzoate	2337	InChI=1S/C9H11NO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3	BLFLLBZGZJTVJG-UHFFFAOYSA-N	CCOC(=O)c1ccc(N)cc1	BroadT	BRD-K75466013	BRD-K75466013-001-05-2	Prestwick Chemical Inc.	Prestw-712	D0701-MP04-ST03-200-		CCOC(=O)c1ccc(N)cc1	InChI=1S/C9H11NO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3	BLFLLBZGZJTVJG-UHFFFAOYSA-N	165.078978602							116735
AEG 3482	LSM-25621	BRD-K77634909	698112	InChI=1S/C10H8N4O2S2/c11-18(15,16)10-13-14-6-8(12-9(14)17-10)7-4-2-1-3-5-7/h1-6H,(H2,11,15,16)	MQUYTXDAVCOCMX-UHFFFAOYSA-N	NS(=O)(=O)c1nn2cc(nc2s1)c3ccccc3	BroadT	BRD-K77634909	BRD-K77634909-001-01-9	TimTec LLC	ST023995			NS(=O)(=O)c1nn2cc(nc2s1)-c1ccccc1	InChI=1S/C10H8N4O2S2/c11-18(15,16)10-13-14-6-8(12-9(14)17-10)7-4-2-1-3-5-7/h1-6H,(H2,11,15,16)	MQUYTXDAVCOCMX-UHFFFAOYSA-N	280.008866916							114182
282089-49-0	LSM-3400	SID29215557, BRD-K63150726	9867770	InChI=1S/C24H26N2O6/c1-3-4-5-10-30-22-19(29-2)9-7-16-12-17(24(28)26-21(16)22)23(27)25-13-15-6-8-18-20(11-15)32-14-31-18/h6-9,11-12H,3-5,10,13-14H2,1-2H3,(H,25,27)(H,26,28)	GRAJFFFXJYFVOC-UHFFFAOYSA-N	CCCCCOc1c(OC)ccc2C=C(C(=O)NCc3ccc4OCOc4c3)C(=O)Nc12	BroadT	BRD-K63150726	BRD-K63150726-001-01-3	Tocris Bioscience	2479	1		CCCCCOc1c(OC)ccc2cc(C(=O)NCc3ccc4OCOc4c3)c(=O)[nH]c12	InChI=1S/C24H26N2O6/c1-3-4-5-10-30-22-19(29-2)9-7-16-12-17(24(28)26-21(16)22)23(27)25-13-15-6-8-18-20(11-15)32-14-31-18/h6-9,11-12H,3-5,10,13-14H2,1-2H3,(H,25,27)(H,26,28)	GRAJFFFXJYFVOC-UHFFFAOYSA-N	438.179086572							93098
Brinzolamide	LSM-3677	Brinzolamide, Azopt, AL-4862	68844	InChI=1S/C12H21N3O5S3/c1-3-14-10-8-15(5-4-6-20-2)23(18,19)12-9(10)7-11(21-12)22(13,16)17/h7,10,14H,3-6,8H2,1-2H3,(H2,13,16,17)/t10-/m0/s1	HCRKCZRJWPKOAR-JTQLQIEISA-N	CCN[C@H]1CN(CCCOC)S(=O)(=O)c2sc(cc12)S(=O)(=O)N	BroadT	BRD-K74913225	BRD-K74913225-001-03-3	Prestwick Chemical Inc.	Prestw-365	D0701-MP04-ST03-200-		CCN[C@H]1CN(CCCOC)S(=O)(=O)c2sc(cc12)S(N)(=O)=O	InChI=1S/C12H21N3O5S3/c1-3-14-10-8-15(5-4-6-20-2)23(18,19)12-9(10)7-11(21-12)22(13,16)17/h7,10,14H,3-6,8H2,1-2H3,(H2,13,16,17)/t10-/m0/s1	HCRKCZRJWPKOAR-JTQLQIEISA-N	383.064332872							3176
Mapp, D-Erythro	LSM-3703	SID26754977, Mapp,D-Erythro	124735	InChI=1S/C23H39NO2/c1-3-4-5-6-7-8-9-10-11-12-16-19-22(25)24-20(2)23(26)21-17-14-13-15-18-21/h13-15,17-18,20,23,26H,3-12,16,19H2,1-2H3,(H,24,25)/t20-,23-/m1/s1	YLAZEWZHIRBZDA-NFBKMPQASA-N	CCCCCCCCCCCCCC(=O)N[C@H](C)[C@@H](O)c1ccccc1	BroadT	BRD-K76274772	BRD-K76274772-001-02-7	Biomol International Inc.	SL221	2840(V2)-3-N1305		CCCCCCCCCCCCCC(=O)N[C@H](C)[C@@H](O)c1ccccc1	InChI=1S/C23H39NO2/c1-3-4-5-6-7-8-9-10-11-12-16-19-22(25)24-20(2)23(26)21-17-14-13-15-18-21/h13-15,17-18,20,23,26H,3-12,16,19H2,1-2H3,(H,24,25)/t20-,23-/m1/s1	YLAZEWZHIRBZDA-NFBKMPQASA-N	361.298079498							93338
Isoginkgetin	LSM-25622	Isoginkgetin, Iso-Ginkgetin	5318569	InChI=1S/C32H22O10/c1-39-18-6-3-15(4-7-18)26-14-24(38)31-22(36)12-21(35)29(32(31)42-26)19-9-16(5-8-25(19)40-2)27-13-23(37)30-20(34)10-17(33)11-28(30)41-27/h3-14,33-36H,1-2H3	HUOOMAOYXQFIDQ-UHFFFAOYSA-N	COc1ccc(cc1)C2=CC(=O)c3c(O)cc(O)c(c3O2)c4cc(ccc4OC)C5=CC(=O)c6c(O)cc(O)cc6O5	BroadT	BRD-K72661036	BRD-K72661036-001-02-1	MicroSource Discovery Systems Inc.	200433			COc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)c(-c3cc(ccc3OC)-c3cc(=O)c4c(O)cc(O)cc4o3)c2o1	InChI=1S/C32H22O10/c1-39-18-6-3-15(4-7-18)26-14-24(38)31-22(36)12-21(35)29(32(31)42-26)19-9-16(5-8-25(19)40-2)27-13-23(37)30-20(34)10-17(33)11-28(30)41-27/h3-14,33-36H,1-2H3	HUOOMAOYXQFIDQ-UHFFFAOYSA-N	566.121296904							79087
Mycophenolic acid	LSM-42933	68618, Myfortic, Mycophenolicacid, RS-61443 [AS MOFETIL], Mycophenolic Acid	446541	InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+	HPNSFSBZBAHARI-RUDMXATFSA-N	COc1c(C)c2COC(=O)c2c(O)c1C\C=C(/C)\CCC(=O)O	BroadT	BRD-K63750851	BRD-K63750851-001-03-3	AnalytiCon Discovery GmbH	NP-001642			COc1c(C)c2COC(=O)c2c(O)c1C\C=C(/C)CCC(O)=O	InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+	HPNSFSBZBAHARI-RUDMXATFSA-N	320.12598836							168396, 168396
418788-90-6	LSM-15377	BRD-K61734568, SID11114275	2250975	InChI=1S/C11H15Cl2NO2/c12-9-3-1-4-10(11(9)13)16-8-2-5-14-6-7-15/h1,3-4,14-15H,2,5-8H2	QVEIRCZEBQRCTR-UHFFFAOYSA-N	OCCNCCCOc1cccc(Cl)c1Cl	BroadT	BRD-K61734568	BRD-K61734568-003-01-3	Tocris Bioscience	2137	1	Cl	OCCNCCCOc1cccc(Cl)c1Cl.Cl	InChI=1S/C11H15Cl2NO2.ClH/c12-9-3-1-4-10(11(9)13)16-8-2-5-14-6-7-15;/h1,3-4,14-15H,2,5-8H2;1H	GFCJFYSIPRIHKT-UHFFFAOYSA-N	263.04798415							104021
DSSTOX_CID_25343	LSM-5405	Nifuroxazide, SID11532872, SID144204042	13764	InChI=1S/C12H9N3O5/c16-9-3-1-8(2-4-9)12(17)14-13-7-10-5-6-11(20-10)15(18)19/h1-7,16H,(H,14,17)	YCWSUKQGVSGXJO-UHFFFAOYSA-N	Oc1ccc(cc1)C(=O)NN=Cc2oc(cc2)[N+](=O)[O-]	BroadT	BRD-K68188368	BRD-K68188368-001-03-7	Prestwick Chemical Inc.	Prestw-555	D0701-MP04-ST03-200-		Oc1ccc(cc1)C(=O)N\N=C\c1ccc(o1)[N+]([O-])=O	InChI=1S/C12H9N3O5/c16-9-3-1-8(2-4-9)12(17)14-13-7-10-5-6-11(20-10)15(18)19/h1-7,16H,(H,14,17)/b13-7+	YCWSUKQGVSGXJO-NTUHNPAUSA-N	275.054220418							94556
Kavain	LSM-42869	Kawain, Kawaih, (+)-Kavain	5281565	InChI=1S/C14H14O3/c1-16-13-9-12(17-14(15)10-13)8-7-11-5-3-2-4-6-11/h2-8,10,12H,9H2,1H3/b8-7+/t12-/m0/s1	XEAQIWGXBXCYFX-GUOLPTJISA-N	COC1=CC(=O)O[C@H](C1)\C=C\c2ccccc2	BroadT	BRD-K09497549	BRD-K09497549-001-03-6	Prestwick Chemical Inc.	Prestw-207	D0701-MP04-ST03-200-		COC1=CC(=O)O[C@H](C1)\C=C\c1ccccc1	InChI=1S/C14H14O3/c1-16-13-9-12(17-14(15)10-13)8-7-11-5-3-2-4-6-11/h2-8,10,12H,9H2,1H3/b8-7+/t12-/m0/s1	XEAQIWGXBXCYFX-GUOLPTJISA-N	230.094294308							6117
Fenobam	LSM-2917	BRD-K41160163, SID144207065, SID26753296, SID90341711	162834	InChI=1S/C11H11ClN4O2/c1-16-6-9(17)14-10(16)15-11(18)13-8-4-2-3-7(12)5-8/h2-5H,6H2,1H3,(H2,13,14,15,17,18)	DWPQODZAOSWNHB-UHFFFAOYSA-N	CN1CC(=O)N=C1NC(=O)Nc2cccc(Cl)c2	BroadT	BRD-K41160163	BRD-K41160163-001-01-9	Tocris Bioscience	2386	1		CN1CC(=O)N=C1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C11H11ClN4O2/c1-16-6-9(17)14-10(16)15-11(18)13-8-4-2-3-7(12)5-8/h2-5H,6H2,1H3,(H2,13,14,15,17,18)	DWPQODZAOSWNHB-UHFFFAOYSA-N	266.057053342							92728, 92728
131543-24-3	LSM-15495	BRD-K62085719, SID26755024	10432609	InChI=1S/C27H26N2O3/c1-18-25(27(30)22-9-4-7-19-6-2-3-8-21(19)22)23-10-5-11-24-26(23)29(18)20(17-32-24)16-28-12-14-31-15-13-28/h2-11,20H,12-17H2,1H3/t20-/m0/s1	HQVHOQAKMCMIIM-FQEVSTJZSA-N	Cc1c(C(=O)c2cccc3ccccc23)c4cccc5OC[C@H](CN6CCOCC6)n1c45	BroadT	BRD-K62085719	BRD-K62085719-066-01-4	Tocris Bioscience	2327	2	CS(=O)(=O)O	Cc1c(C(=O)c2cccc3ccccc23)c2cccc3OC[C@H](CN4CCOCC4)n1c23.CS(=O)(=O)O	InChI=1S/C27H26N2O3.CH4O3S/c1-18-25(27(30)22-9-4-7-19-6-2-3-8-21(19)22)23-10-5-11-24-26(23)29(18)20(17-32-24)16-28-12-14-31-15-13-28;1-5(2,3)4/h2-11,20H,12-17H2,1H3;1H3,(H,2,3,4)/t20-;/m0./s1	FSGCSTPOPBJYSX-BDQAORGHSA-N	426.194342712							104136
Talibegron	LSM-3433	Talibegron, BRD-K64157027	158794	InChI=1S/C18H21NO4/c20-17(15-4-2-1-3-5-15)13-19-10-11-23-16-8-6-14(7-9-16)12-18(21)22/h1-9,17,19-20H,10-13H2,(H,21,22)/t17-/m0/s1	SRBPKVWITYPHQR-KRWDZBQOSA-N	O[C@@H](CNCCOc1ccc(CC(=O)O)cc1)c2ccccc2	BroadT	BRD-K64157027	BRD-K64157027-003-01-9	Tocris Bioscience	2154	1	Cl	O[C@@H](CNCCOc1ccc(CC(O)=O)cc1)c1ccccc1.Cl	InChI=1S/C18H21NO4.ClH/c20-17(15-4-2-1-3-5-15)13-19-10-11-23-16-8-6-14(7-9-16)12-18(21)22;/h1-9,17,19-20H,10-13H2,(H,21,22);1H/t17-;/m0./s1	KCEFVYIWOQSJCH-LMOVPXPDSA-N	315.147058162							93123, 93123
2-Aminoacetophenone	LSM-15378	BRD-K61831307, SID124893583	11952	InChI=1S/C8H9NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5H,6,9H2	HEQOJEGTZCTHCF-UHFFFAOYSA-N	NCC(=O)c1ccccc1	BroadT	BRD-K61831307	BRD-K61831307-003-02-1	MicroSource Discovery Systems Inc.	501332		Cl	NCC(=O)c1ccccc1.Cl	InChI=1S/C8H9NO.ClH/c9-6-8(10)7-4-2-1-3-5-7;/h1-5H,6,9H2;1H	CVXGFPPAIUELDV-UHFFFAOYSA-N	135.068413918							104022, 104022
7,7-Dimethyleicosadienoicacid	LSM-44125	7,7-Dimethyleicosadienoic Acid, SID11111101, SID50106245, SID85231013, SID90341120	5312331	InChI=1S/C22H40O2/c1-4-5-6-7-8-9-10-11-12-13-16-19-22(2,3)20-17-14-15-18-21(23)24/h16-17,19-20H,4-15,18H2,1-3H3,(H,23,24)/b19-16-,20-17-	AGKRHAILCPYNFH-DUQSFWPASA-N	CCCCCCCCCCC\C=C/C(C)(C)\C=C/CCCC(=O)O	BroadT	BRD-K65207153	BRD-K65207153-001-02-9	Biomol International Inc.	EI-112	2840(V2)-3-N1305		CCCCCCCCCCC\C=C/C(C)(C)\C=C/CCCC(O)=O	InChI=1S/C22H40O2/c1-4-5-6-7-8-9-10-11-12-13-16-19-22(2,3)20-17-14-15-18-21(23)24/h16-17,19-20H,4-15,18H2,1-3H3,(H,23,24)/b19-16-,20-17-	AGKRHAILCPYNFH-DUQSFWPASA-N	336.30283052							
Nimesulide	LSM-3718	Nimesulide, R-805	4495	InChI=1S/C13H12N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h2-9,14H,1H3	HYWYRSMBCFDLJT-UHFFFAOYSA-N	CS(=O)(=O)Nc1ccc(cc1Oc2ccccc2)[N+](=O)[O-]	BroadT	BRD-K76775527	BRD-K76775527-001-06-2	Biomol International Inc.	EI287	2840(V2)-3-N1305		CS(=O)(=O)Nc1ccc(cc1Oc1ccccc1)[N+]([O-])=O	InChI=1S/C13H12N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h2-9,14H,1H3	HYWYRSMBCFDLJT-UHFFFAOYSA-N	308.046692194							44445
Cefoxitin	LSM-5786	Mefoxitin, Mefoxin, Cenomycin, Cefoxitin	441199	InChI=1S/C16H17N3O7S2/c1-25-16(18-10(20)5-9-3-2-4-27-9)13(23)19-11(12(21)22)8(6-26-15(17)24)7-28-14(16)19/h2-4,14H,5-7H2,1H3,(H2,17,24)(H,18,20)(H,21,22)/t14-,16+/m1/s1	WZOZEZRFJCJXNZ-ZBFHGGJFSA-N	CO[C@]1(NC(=O)Cc2cccs2)[C@H]3SCC(=C(N3C1=O)C(=O)O)COC(=O)N	BroadT	BRD-K70976396	BRD-K70976396-236-04-7	MicroSource Discovery Systems Inc.	1502031		[Na]	CO[C@]1(NC(=O)Cc2cccs2)[C@H]2SCC(COC(N)=O)=C(N2C1=O)C(O)=O.[Na]	InChI=1S/C16H17N3O7S2.Na.H/c1-25-16(18-10(20)5-9-3-2-4-27-9)13(23)19-11(12(21)22)8(6-26-15(17)24)7-28-14(16)19;;/h2-4,14H,5-7H2,1H3,(H2,17,24)(H,18,20)(H,21,22);;/t14-,16+;;/m1../s1	AMZJBXCOUBANBG-WUTOMRCLSA-N	427.050791294							209807, 209807
JNJ 10191584	LSM-2328	JNJ-10191584, BRD-K15086322	10446295	InChI=1S/C13H15ClN4O/c1-17-4-6-18(7-5-17)13(19)12-15-10-3-2-9(14)8-11(10)16-12/h2-3,8H,4-7H2,1H3,(H,15,16)	MOIWSUQWIOVGRH-UHFFFAOYSA-N	CN1CCN(CC1)C(=O)c2nc3ccc(Cl)cc3[nH]2	BroadT	BRD-K15086322	BRD-K15086322-103-01-0	Tocris Bioscience	2441	1	OC(=O)C=CC(=O)O	CN1CCN(CC1)C(=O)c1nc2ccc(Cl)cc2[nH]1.OC(=O)C=CC(=O)O	InChI=1S/C13H15ClN4O.C4H4O4/c1-17-4-6-18(7-5-17)13(19)12-15-10-3-2-9(14)8-11(10)16-12;5-3(6)1-2-4(7)8/h2-3,8H,4-7H2,1H3,(H,15,16);1-2H,(H,5,6)(H,7,8)	KOTJFAYEELTYCZ-UHFFFAOYSA-N	278.09343885							92272, 92272
Diprotin A	LSM-3546	Diprotina, Diprotin A	94701	InChI=1S/C17H31N3O4/c1-5-10(3)13(18)16(22)20-9-7-8-12(20)15(21)19-14(17(23)24)11(4)6-2/h10-14H,5-9,18H2,1-4H3,(H,19,21)(H,23,24)/t10-,11-,12-,13-,14-/m0/s1	JNTMAZFVYNDPLB-PEDHHIEDSA-N	CC[C@H](C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)O	BroadT	BRD-K69032158	BRD-K69032158-001-02-2	MicroSource Discovery Systems Inc.	1502183			CC[C@H](C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(O)=O	InChI=1S/C17H31N3O4/c1-5-10(3)13(18)16(22)20-9-7-8-12(20)15(21)19-14(17(23)24)11(4)6-2/h10-14H,5-9,18H2,1-4H3,(H,19,21)(H,23,24)/t10-,11-,12-,13-,14-/m0/s1	JNTMAZFVYNDPLB-PEDHHIEDSA-N	341.231456502							93213
Fluspirilene	LSM-3748	Redeptin, Imap, Fluspirilene, R-6218, MCN-JR-6218	3396	InChI=1S/C29H31F2N3O/c30-24-12-8-22(9-13-24)27(23-10-14-25(31)15-11-23)7-4-18-33-19-16-29(17-20-33)28(35)32-21-34(29)26-5-2-1-3-6-26/h1-3,5-6,8-15,27H,4,7,16-21H2,(H,32,35)	QOYHHIBFXOOADH-UHFFFAOYSA-N	Fc1ccc(cc1)C(CCCN2CCC3(CC2)N(CNC3=O)c4ccccc4)c5ccc(F)cc5	BroadT	BRD-K77947974	BRD-K77947974-001-04-9	Biomol International Inc.	AC-116	2840(V2)-3-N1305		Fc1ccc(cc1)C(CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccc(F)cc1	InChI=1S/C29H31F2N3O/c30-24-12-8-22(9-13-24)27(23-10-14-25(31)15-11-23)7-4-18-33-19-16-29(17-20-33)28(35)32-21-34(29)26-5-2-1-3-6-26/h1-3,5-6,8-15,27H,4,7,16-21H2,(H,32,35)	QOYHHIBFXOOADH-UHFFFAOYSA-N	475.243519042							93369
SSR 69071	LSM-3634	BRD-K72895815	9872438	InChI=1S/C27H32N4O7S/c1-18(2)20-14-19(36-3)15-22-25(20)27(33)31(39(22,34)35)17-38-23-16-24(32)30-11-7-8-21(26(30)28-23)37-13-12-29-9-5-4-6-10-29/h7-8,11,14-16,18H,4-6,9-10,12-13,17H2,1-3H3	DRZXDZYWZSKFDL-UHFFFAOYSA-N	COc1cc(C(C)C)c2C(=O)N(COC3=CC(=O)N4C=CC=C(OCCN5CCCCC5)C4=N3)S(=O)(=O)c2c1	BroadT	BRD-K72895815	BRD-K72895815-001-01-4	Tocris Bioscience	2506	1		COc1cc2c(C(=O)N(COc3cc(=O)n4cccc(OCCN5CCCCC5)c4n3)S2(=O)=O)c(c1)C(C)C	InChI=1S/C27H32N4O7S/c1-18(2)20-14-19(36-3)15-22-25(20)27(33)31(39(22,34)35)17-38-23-16-24(32)30-11-7-8-21(26(30)28-23)37-13-12-29-9-5-4-6-10-29/h7-8,11,14-16,18H,4-6,9-10,12-13,17H2,1-3H3	DRZXDZYWZSKFDL-UHFFFAOYSA-N	556.199170094							93283
Zidovudine	LSM-5806	Retrovir, Zidovudine, Azidothymidine, Azt, BWA509U, BW-A509U, BW-A-509U, Compound S	35370	InChI=1S/C10H13N5O4/c1-5-3-15(10(18)12-9(5)17)8-2-6(13-14-11)7(4-16)19-8/h3,6-8,16H,2,4H2,1H3,(H,12,17,18)/t6-,7+,8+/m0/s1	HBOMLICNUCNMMY-XLPZGREQSA-N	CC1=CN([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)C(=O)NC1=O	BroadT	BRD-K72903603	BRD-K72903603-001-03-8	MicroSource Discovery Systems Inc.	1502109			Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)c(=O)[nH]c1=O	InChI=1S/C10H13N5O4/c1-5-3-15(10(18)12-9(5)17)8-2-6(13-14-11)7(4-16)19-8/h3,6-8,16H,2,4H2,1H3,(H,12,17,18)/t6-,7+,8+/m0/s1	HBOMLICNUCNMMY-XLPZGREQSA-N	267.096753946							10110
4-[(6-Amino-4-pyrimidinyl)amino]benzenesulfonamide	LSM-3612	CDK2/5 Inhibitor	2608	InChI=1S/C10H11N5O2S/c11-9-5-10(14-6-13-9)15-7-1-3-8(4-2-7)18(12,16)17/h1-6H,(H2,12,16,17)(H3,11,13,14,15)	FVFVVRPJERUECT-UHFFFAOYSA-N	Nc1cc(Nc2ccc(cc2)S(=O)(=O)N)ncn1	BroadT	BRD-K71860425	BRD-K71860425-001-01-1	Calbiochem	219448			Nc1cc(Nc2ccc(cc2)S(N)(=O)=O)ncn1	InChI=1S/C10H11N5O2S/c11-9-5-10(14-6-13-9)15-7-1-3-8(4-2-7)18(12,16)17/h1-6H,(H2,12,16,17)(H3,11,13,14,15)	FVFVVRPJERUECT-UHFFFAOYSA-N	265.063345332							
Quinapril	LSM-3620	Quinapril, CI-906	54892	InChI=1S/C25H30N2O5/c1-3-32-25(31)21(14-13-18-9-5-4-6-10-18)26-17(2)23(28)27-16-20-12-8-7-11-19(20)15-22(27)24(29)30/h4-12,17,21-22,26H,3,13-16H2,1-2H3,(H,29,30)/t17-,21-,22-/m0/s1	JSDRRTOADPPCHY-HSQYWUDLSA-N	CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N2Cc3ccccc3C[C@H]2C(=O)O	BroadT	BRD-K72222507	BRD-K72222507-003-02-8	MicroSource Discovery Systems Inc.	1503076		Cl	CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(O)=O.Cl	InChI=1S/C25H30N2O5.ClH/c1-3-32-25(31)21(14-13-18-9-5-4-6-10-18)26-17(2)23(28)27-16-20-12-8-7-11-19(20)15-22(27)24(29)30;/h4-12,17,21-22,26H,3,13-16H2,1-2H3,(H,29,30);1H/t17-,21-,22-;/m0./s1	IBBLRJGOOANPTQ-JKVLGAQCSA-N	438.21547208							8713
CHEMBL179288	LSM-3648	BRD-K73395020	11292680	InChI=1S/C20H26N2O5S/c1-14(2)19(20(23)21-24)22(27-15(3)4)28(25,26)18-12-10-17(11-13-18)16-8-6-5-7-9-16/h5-15,19,24H,1-4H3,(H,21,23)/t19-/m1/s1	DGZZVIWCMGVHGV-LJQANCHMSA-N	CC(C)ON([C@H](C(C)C)C(=O)NO)S(=O)(=O)c1ccc(cc1)c2ccccc2	BroadT	BRD-K73395020	BRD-K73395020-001-01-5	Tocris Bioscience	2622	1		CC(C)ON([C@H](C(C)C)C(=O)NO)S(=O)(=O)c1ccc(cc1)-c1ccccc1	InChI=1S/C20H26N2O5S/c1-14(2)19(20(23)21-24)22(27-15(3)4)28(25,26)18-12-10-17(11-13-18)16-8-6-5-7-9-16/h5-15,19,24H,1-4H3,(H,21,23)/t19-/m1/s1	DGZZVIWCMGVHGV-LJQANCHMSA-N	406.156242642							93296
Fluorometholone	LSM-25624	Fluorometholone, Oxylone, Fluor-Op, FML Forte	9878	InChI=1S/C22H29FO4/c1-12-9-17-15-6-8-21(27,13(2)24)20(15,4)11-18(26)22(17,23)19(3)7-5-14(25)10-16(12)19/h5,7,10,12,15,17-18,26-27H,6,8-9,11H2,1-4H3/t12-,15-,17-,18-,19-,20-,21-,22-/m0/s1	FAOZLTXFLGPHNG-KNAQIMQKSA-N	C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)C)[C@@]3(C)C[C@H](O)[C@]2(F)[C@@]4(C)C=CC(=O)C=C14	BroadT	BRD-K64862097	BRD-K64862097-001-03-9	Prestwick Chemical Inc.	Prestw-718	D0701-MP04-ST03-200-		C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(C)=O)[C@@]3(C)C[C@H](O)[C@]2(F)[C@@]2(C)C=CC(=O)C=C12	InChI=1S/C22H29FO4/c1-12-9-17-15-6-8-21(27,13(2)24)20(15,4)11-18(26)22(17,23)19(3)7-5-14(25)10-16(12)19/h5,7,10,12,15,17-18,26-27H,6,8-9,11H2,1-4H3/t12-,15-,17-,18-,19-,20-,21-,22-/m0/s1	FAOZLTXFLGPHNG-KNAQIMQKSA-N	376.204987608							31625
Marmesin	LSM-2799	Marmesin	334704	InChI=1S/C14H14O4/c1-14(2,16)12-6-9-5-8-3-4-13(15)18-10(8)7-11(9)17-12/h3-5,7,12,16H,6H2,1-2H3/t12-/m0/s1	FWYSBEAFFPBAQU-LBPRGKRZSA-N	CC(C)(O)[C@@H]1Cc2cc3C=CC(=O)Oc3cc2O1	BroadT	BRD-K36377456	BRD-K36377456-001-02-0	MicroSource Discovery Systems Inc.	1504162			CC(C)(O)[C@@H]1Cc2cc3ccc(=O)oc3cc2O1	InChI=1S/C14H14O4/c1-14(2,16)12-6-9-5-8-3-4-13(15)18-10(8)7-11(9)17-12/h3-5,7,12,16H,6H2,1-2H3/t12-/m0/s1	FWYSBEAFFPBAQU-LBPRGKRZSA-N	246.089208928							6695
Hydroxytoluic acid	LSM-25625	3 MS, Hydroxytoluic Acid	6738	InChI=1S/C8H8O3/c1-5-3-2-4-6(7(5)9)8(10)11/h2-4,9H,1H3,(H,10,11)	WHSXTWFYRGOBGO-UHFFFAOYSA-N	Cc1cccc(C(=O)O)c1O	BroadT	BRD-K75608666	BRD-K75608666-001-02-6	MicroSource Discovery Systems Inc.	212064			Cc1cccc(C(O)=O)c1O	InChI=1S/C8H8O3/c1-5-3-2-4-6(7(5)9)8(10)11/h2-4,9H,1H3,(H,10,11)	WHSXTWFYRGOBGO-UHFFFAOYSA-N	152.047344116							20141
Peucedanin	LSM-3618	SID24823950, SID26749708	8616	InChI=1S/C15H14O4/c1-8(2)14-15(17-3)10-6-9-4-5-13(16)18-11(9)7-12(10)19-14/h4-8H,1-3H3	YQBNJPACAUPNLV-UHFFFAOYSA-N	COc1c(oc2cc3OC(=O)C=Cc3cc12)C(C)C	BroadT	BRD-K72034655	BRD-K72034655-001-02-1	MicroSource Discovery Systems Inc.	1504168			COc1c(oc2cc3oc(=O)ccc3cc12)C(C)C	InChI=1S/C15H14O4/c1-8(2)14-15(17-3)10-6-9-4-5-13(16)18-11(9)7-12(10)19-14/h4-8H,1-3H3	YQBNJPACAUPNLV-UHFFFAOYSA-N	258.089208928							8034
(Z) Fluvoxamine	LSM-3625	Fluvoxamine, BRD-K72676686	3404	InChI=1S/C15H21F3N2O2/c1-21-10-3-2-4-14(20-22-11-9-19)12-5-7-13(8-6-12)15(16,17)18/h5-8H,2-4,9-11,19H2,1H3	CJOFXWAVKWHTFT-UHFFFAOYSA-N	COCCCCC(=NOCCN)c1ccc(cc1)C(F)(F)F	BroadT	BRD-K72676686	BRD-K72676686-103-01-8	Tocris Bioscience	1033	5	OC(=O)C=CC(=O)O	COCCCCC(=NOCCN)c1ccc(cc1)C(F)(F)F.OC(=O)C=CC(=O)O	InChI=1S/C15H21F3N2O2.C4H4O4/c1-21-10-3-2-4-14(20-22-11-9-19)12-5-7-13(8-6-12)15(16,17)18;5-3(6)1-2-4(7)8/h5-8H,2-4,9-11,19H2,1H3;1-2H,(H,5,6)(H,7,8)	LFMYNZPAVPMEGP-UHFFFAOYSA-N	318.155512532							93274
3,7-Dimethoxyflavone	LSM-25626	3,7-Dimethoxyflavone, BRD-K75745696	688664	InChI=1S/C17H14O4/c1-19-12-8-9-13-14(10-12)21-16(17(20-2)15(13)18)11-6-4-3-5-7-11/h3-10H,1-2H3	CNDZOPXQZSXGSK-UHFFFAOYSA-N	COC1=C(Oc2cc(OC)ccc2C1=O)c3ccccc3	BroadT	BRD-K75745696	BRD-K75745696-001-02-0	MicroSource Discovery Systems Inc.	1500737			COc1ccc2c(c1)oc(-c1ccccc1)c(OC)c2=O	InChI=1S/C17H14O4/c1-19-12-8-9-13-14(10-12)21-16(17(20-2)15(13)18)11-6-4-3-5-7-11/h3-10H,1-2H3	CNDZOPXQZSXGSK-UHFFFAOYSA-N	282.089208928							114184
Dibenzoylmethane	LSM-2003	Dibenzoylmethane, Dibenzoyl Methane	8433	InChI=1S/C15H12O2/c16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13/h1-10H,11H2	NZZIMKJIVMHWJC-UHFFFAOYSA-N	O=C(CC(=O)c1ccccc1)c2ccccc2	BroadT	BRD-K01555864	BRD-K01555864-001-02-8	MicroSource Discovery Systems Inc.	1505311			O=C(CC(=O)c1ccccc1)c1ccccc1	InChI=1S/C15H12O2/c16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13/h1-10H,11H2	NZZIMKJIVMHWJC-UHFFFAOYSA-N	224.083729624							75417
Altretamine	LSM-3492	Altretamine, Hexalen, Hexamethylmelamine	2123	InChI=1S/C9H18N6/c1-13(2)7-10-8(14(3)4)12-9(11-7)15(5)6/h1-6H3	UUVWYPNAQBNQJQ-UHFFFAOYSA-N	CN(C)c1nc(nc(n1)N(C)C)N(C)C	BroadT	BRD-K67043667	BRD-K67043667-001-04-1	Prestwick Chemical Inc.	Prestw-946	D0701-MP04-ST03-200-		CN(C)c1nc(nc(n1)N(C)C)N(C)C	InChI=1S/C9H18N6/c1-13(2)7-10-8(14(3)4)12-9(11-7)15(5)6/h1-6H3	UUVWYPNAQBNQJQ-UHFFFAOYSA-N	210.159294636							24564
Nicergoline	LSM-3720	Nicergoline, Sermion	34040	InChI=1S/C24H26BrN3O3/c1-27-13-17-8-21-24(30-3,19-5-4-6-20(27)22(17)19)9-15(12-28(21)2)14-31-23(29)16-7-18(25)11-26-10-16/h4-7,10-11,13,15,21H,8-9,12,14H2,1-3H3/t15-,21-,24+/m1/s1	YSEXMKHXIOCEJA-FVFQAYNVSA-N	CO[C@]12C[C@@H](COC(=O)c3cncc(Br)c3)CN(C)[C@@H]1Cc4cn(C)c5cccc2c45	BroadT	BRD-K76810206	BRD-K76810206-001-05-7	Prestwick Chemical Inc.	Prestw-147	D0701-MP04-ST03-200-		CO[C@]12C[C@@H](COC(=O)c3cncc(Br)c3)CN(C)[C@@H]1Cc1cn(C)c3cccc2c13	InChI=1S/C24H26BrN3O3/c1-27-13-17-8-21-24(30-3,19-5-4-6-20(27)22(17)19)9-15(12-28(21)2)14-31-23(29)16-7-18(25)11-26-10-16/h4-7,10-11,13,15,21H,8-9,12,14H2,1-3H3/t15-,21-,24+/m1/s1	YSEXMKHXIOCEJA-FVFQAYNVSA-N	483.115754322							31902
Levamisole	LSM-6655	Levamisole, TCMDC-125847	26879	InChI=1S/C11H12N2S/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10/h1-5,10H,6-8H2/t10-/m1/s1	HLFSDGLLUJUHTE-SNVBAGLBSA-N	C1CN2C[C@@H](N=C2S1)c3ccccc3	BroadT	BRD-K73107279	BRD-K73107279-003-03-4	MicroSource Discovery Systems Inc.	1503245		Cl	C1CN2C[C@@H](N=C2S1)c1ccccc1.Cl	InChI=1S/C11H12N2S.ClH/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10;/h1-5,10H,6-8H2;1H/t10-;/m1./s1	LAZPBGZRMVRFKY-HNCPQSOCSA-N	204.072119094							6432, 6432
SR-2640	LSM-15379	BRD-K62562723, SR 2640, SR-2640	128355	InChI=1S/C23H18N2O3/c26-23(27)20-9-2-4-11-22(20)24-17-7-5-8-19(14-17)28-15-18-13-12-16-6-1-3-10-21(16)25-18/h1-14,24H,15H2,(H,26,27)	LMPZHLXYBWGGNT-UHFFFAOYSA-N	OC(=O)c1ccccc1Nc2cccc(OCc3ccc4ccccc4n3)c2	BroadT	BRD-K62562723	BRD-K62562723-003-01-9	Tocris Bioscience	1804	2	Cl	OC(=O)c1ccccc1Nc1cccc(OCc2ccc3ccccc3n2)c1.Cl	InChI=1S/C23H18N2O3.ClH/c26-23(27)20-9-2-4-11-22(20)24-17-7-5-8-19(14-17)28-15-18-13-12-16-6-1-3-10-21(16)25-18;/h1-14,24H,15H2,(H,26,27);1H	KDSYWFCTUKABKE-UHFFFAOYSA-N	370.131742456							104023
Bromopride	LSM-6656	Bromopride	2446	InChI=1S/C14H22BrN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)	GIYAQDDTCWHPPL-UHFFFAOYSA-N	CCN(CC)CCNC(=O)c1cc(Br)c(N)cc1OC	BroadT	BRD-K73642618	BRD-K73642618-001-04-2	MicroSource Discovery Systems Inc.	1503108			CCN(CC)CCNC(=O)c1cc(Br)c(N)cc1OC	InChI=1S/C14H22BrN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)	GIYAQDDTCWHPPL-UHFFFAOYSA-N	343.089539574							95304
Aminopurvalanol	LSM-2151	Aminopurvalanola, SID11114269, Aminopurvalanol A, Aminopurvalanol-A	6604931	InChI=1S/C19H26ClN7O/c1-10(2)15(8-28)24-19-25-17(23-14-6-12(20)5-13(21)7-14)16-18(26-19)27(9-22-16)11(3)4/h5-7,9-11,15,28H,8,21H2,1-4H3,(H2,23,24,25,26)/t15-/m0/s1	RAMROQQYRRQPDL-HNNXBMFYSA-N	CC(C)[C@H](CO)Nc1nc(Nc2cc(N)cc(Cl)c2)c3ncn(C(C)C)c3n1	BroadT	BRD-K07762753	BRD-K07762753-001-03-6	Calbiochem	Aminopurvalanol A			CC(C)[C@H](CO)Nc1nc(Nc2cc(N)cc(Cl)c2)c2ncn(C(C)C)c2n1	InChI=1S/C19H26ClN7O/c1-10(2)15(8-28)24-19-25-17(23-14-6-12(20)5-13(21)7-14)16-18(26-19)27(9-22-16)11(3)4/h5-7,9-11,15,28H,8,21H2,1-4H3,(H2,23,24,25,26)/t15-/m0/s1	RAMROQQYRRQPDL-HNNXBMFYSA-N	403.188736232							38937
3-Hydroxybenzylhydrazine dihydrochloride	LSM-15491	3-Hydroxybenzylhydrazine, 3-Hydroxy-Benzylhydrazine, 3-Hydrazinomethyl-Phenol	1663	InChI=1S/C7H10N2O/c8-9-5-6-2-1-3-7(10)4-6/h1-4,9-10H,5,8H2	OFKWWALNMPEOSZ-UHFFFAOYSA-N	NNCc1cccc(O)c1	BroadT	BRD-K66416915	BRD-K66416915-300-01-2	MicroSource Discovery Systems Inc.	2300336		Cl.Cl	NNCc1cccc(O)c1.Cl.Cl	InChI=1S/C7H10N2O.2ClH/c8-9-5-6-2-1-3-7(10)4-6;;/h1-4,9-10H,5,8H2;2*1H	ONOJPUDFIOEGCX-UHFFFAOYSA-N	138.07931296							104133, 104133, 104133
Deracoxib	LSM-3536	Deracoxib, SC-59046	3058754	InChI=1S/C17H14F3N3O3S/c1-26-16-7-2-10(8-13(16)18)15-9-14(17(19)20)22-23(15)11-3-5-12(6-4-11)27(21,24)25/h2-9,17H,1H3,(H2,21,24,25)	WAZQAZKAZLXFMK-UHFFFAOYSA-N	COc1ccc(cc1F)c2cc(nn2c3ccc(cc3)S(=O)(=O)N)C(F)F	BroadT	BRD-K68558722	BRD-K68558722-001-02-4	MicroSource Discovery Systems Inc.	1505222			COc1ccc(cc1F)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)F	InChI=1S/C17H14F3N3O3S/c1-26-16-7-2-10(8-13(16)18)15-9-14(17(19)20)22-23(15)11-3-5-12(6-4-11)27(21,24)25/h2-9,17H,1H3,(H2,21,24,25)	WAZQAZKAZLXFMK-UHFFFAOYSA-N	397.070796628							73032
1-(5-Isoquinolinesulfonyl)piperazine	LSM-3622	SID11113555, BRD-K72462751	3545	InChI=1S/C13H15N3O2S/c17-19(18,16-8-6-14-7-9-16)13-3-1-2-11-10-15-5-4-12(11)13/h1-5,10,14H,6-9H2	UPTYCYWTFGTCCG-UHFFFAOYSA-N	O=S(=O)(N1CCNCC1)c2cccc3cnccc23	BroadT	BRD-K72462751	BRD-K72462751-001-01-9	Tocris Bioscience	543	1		O=S(=O)(N1CCNCC1)c1cccc2cnccc12	InChI=1S/C13H15N3O2S/c17-19(18,16-8-6-14-7-9-16)13-3-1-2-11-10-15-5-4-12(11)13/h1-5,10,14H,6-9H2	UPTYCYWTFGTCCG-UHFFFAOYSA-N	277.08849744							93271, 93271
Amantadine	LSM-3571	Symmetrel, Symadine, Amantadine, TCMDC-125869	2130	InChI=1S/C10H17N/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6,11H2	DKNWSYNQZKUICI-UHFFFAOYSA-N	NC12CC3CC(CC(C3)C1)C2	BroadT	BRD-K70330367	BRD-K70330367-001-02-4	Biomol International Inc.	AC-133	2840(V2)-3-N1305		NC12CC3CC(CC(C3)C1)C2	InChI=1S/C10H17N/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6,11H2	DKNWSYNQZKUICI-UHFFFAOYSA-N	151.136099554							2618, 2618, 2618, 2618
Chlorophenylpiperazine	LSM-25627	1-(3-Chlorophenyl)Piperazine, 1-(3-Chloro-Phenyl)-Piperazine, 1-M-Chlorophenyl Piperazine Metabolite, Mcpp	1355	InChI=1S/C10H13ClN2/c11-9-2-1-3-10(8-9)13-6-4-12-5-7-13/h1-3,8,12H,4-7H2	VHFVKMTVMIZMIK-UHFFFAOYSA-N	Clc1cccc(c1)N2CCNCC2	BroadT	BRD-K75844781	BRD-K75844781-001-01-9	Biomol International Inc.	AC-547	2813-N1283		Clc1cccc(c1)N1CCNCC1	InChI=1S/C10H13ClN2/c11-9-2-1-3-10(8-9)13-6-4-12-5-7-13/h1-3,8,12H,4-7H2	VHFVKMTVMIZMIK-UHFFFAOYSA-N	196.076726146							10588, 10588, 10588
ML7	LSM-4095	ML-7, SID50111102, SID50111103, SID90341054	4216	InChI=1S/C15H17IN2O2S/c16-14-6-1-5-13-12(14)4-2-7-15(13)21(19,20)18-10-3-8-17-9-11-18/h1-2,4-7,17H,3,8-11H2	GEHJIACZUFWBTK-UHFFFAOYSA-N	Ic1cccc2c(cccc12)S(=O)(=O)N3CCCNCC3	BroadT	BRD-K93201660	BRD-K93201660-001-05-7	Broad Institute of MIT and Harvard	ML-7			Ic1cccc2c(cccc12)S(=O)(=O)N1CCCNCC1	InChI=1S/C15H17IN2O2S/c16-14-6-1-5-13-12(14)4-2-7-15(13)21(19,20)18-10-3-8-17-9-11-18/h1-2,4-7,17H,3,8-11H2	GEHJIACZUFWBTK-UHFFFAOYSA-N	416.005541494							78761, 78761
2-Naphthalenesulfonamide, n-(4-aminobutyl)-	LSM-3753	W-12	4298	InChI=1S/C14H18N2O2S/c15-9-3-4-10-16-19(17,18)14-8-7-12-5-1-2-6-13(12)11-14/h1-2,5-8,11,16H,3-4,9-10,15H2	BUGAJERDTXSWQA-UHFFFAOYSA-N	NCCCCNS(=O)(=O)c1ccc2ccccc2c1	BroadT	BRD-K78084463	BRD-K78084463-003-01-0	Calbiochem	681635		Cl	NCCCCNS(=O)(=O)c1ccc2ccccc2c1.Cl	InChI=1S/C14H18N2O2S.ClH/c15-9-3-4-10-16-19(17,18)14-8-7-12-5-1-2-6-13(12)11-14;/h1-2,5-8,11,16H,3-4,9-10,15H2;1H	WYFVKUWCEVMLOL-UHFFFAOYSA-N	278.108898526							93373
Tetrac	LSM-25628		65552	InChI=1S/C14H8I4O4/c15-8-4-7(5-9(16)13(8)21)22-14-10(17)1-6(2-11(14)18)3-12(19)20/h1-2,4-5,21H,3H2,(H,19,20)	PPJYSSNKSXAVDB-UHFFFAOYSA-N	OC(=O)Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1	BroadT	BRD-K71437774	BRD-K71437774-001-02-3	MicroSource Discovery Systems Inc.	1500775			OC(=O)Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1	InChI=1S/C14H8I4O4/c15-8-4-7(5-9(16)13(8)21)22-14-10(17)1-6(2-11(14)18)3-12(19)20/h1-2,4-5,21H,3H2,(H,19,20)	PPJYSSNKSXAVDB-UHFFFAOYSA-N	747.660130736							131194
4-Phenyl-1-(4-phenylbutyl)piperidine	LSM-15601	SID11113602, BRD-K78061844, SID26751801	3035672	InChI=1S/C21H27N/c1-3-9-19(10-4-1)11-7-8-16-22-17-14-21(15-18-22)20-12-5-2-6-13-20/h1-6,9-10,12-13,21H,7-8,11,14-18H2	HQGDPZPNAXRCSA-UHFFFAOYSA-N	C(CCc1ccccc1)CN2CCC(CC2)c3ccccc3	BroadT	BRD-K78061844	BRD-K78061844-103-01-6	Tocris Bioscience	620	2	OC(=O)C=CC(=O)O	C(CCc1ccccc1)CN1CCC(CC1)c1ccccc1.OC(=O)C=CC(=O)O	InChI=1S/C21H27N.C4H4O4/c1-3-9-19(10-4-1)11-7-8-16-22-17-14-21(15-18-22)20-12-5-2-6-13-20;5-3(6)1-2-4(7)8/h1-6,9-10,12-13,21H,7-8,11,14-18H2;1-2H,(H,5,6)(H,7,8)	OASPNIMFGJVLES-UHFFFAOYSA-N	293.214349874							104237, 104237
Irsogladine	LSM-3663	Irsogladine, BRD-K74195153, Irsogladine Maleate	3752	InChI=1S/C9H7Cl2N5/c10-4-1-2-6(11)5(3-4)7-14-8(12)16-9(13)15-7/h1-3H,(H4,12,13,14,15,16)	ATCGGEJZONJOCL-UHFFFAOYSA-N	Nc1nc(N)nc(n1)c2cc(Cl)ccc2Cl	BroadT	BRD-K74195153	BRD-K74195153-050-03-0	Tocris Bioscience	2504	1	OC(=O)/C=C\C(=O)O	Nc1nc(N)nc(n1)-c1cc(Cl)ccc1Cl.OC(=O)/C=C\C(=O)O	InChI=1S/C9H7Cl2N5.C4H4O4/c10-4-1-2-6(11)5(3-4)7-14-8(12)16-9(13)15-7;5-3(6)1-2-4(7)8/h1-3H,(H4,12,13,14,15,16);1-2H,(H,5,6)(H,7,8)/b;2-1-	PJLVTVAIERNDEQ-BTJKTKAUSA-N	255.007850694							93307, 93307, 93307
ZK-93426	LSM-3530	BRD-K68392338, ZK-93426	115210	InChI=1S/C18H20N2O3/c1-5-22-18(21)17-11(4)15-13(9-19-17)20-12-7-6-8-14(16(12)15)23-10(2)3/h6-10,20H,5H2,1-4H3	VMDUABMKBUKKPG-UHFFFAOYSA-N	CCOC(=O)c1ncc2[nH]c3cccc(OC(C)C)c3c2c1C	BroadT	BRD-K68392338	BRD-K68392338-003-01-2	Tocris Bioscience	1996	1	Cl	CCOC(=O)c1ncc2[nH]c3cccc(OC(C)C)c3c2c1C.Cl	InChI=1S/C18H20N2O3.ClH/c1-5-22-18(21)17-11(4)15-13(9-19-17)20-12-7-6-8-14(16(12)15)23-10(2)3;/h6-10,20H,5H2,1-4H3;1H	RNQJDOYVHCISJU-UHFFFAOYSA-N	312.14739252							93201
Ursolic acid	LSM-4889	NSC-4060, Ursolic-Acid	64945	InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1	WCGUUGGRBIKTOS-GPOJBZKASA-N	C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(=O)O	BroadT	BRD-K68185022	BRD-K68185022-001-02-3	Prestwick Chemical Inc.	Prestw-89	D0701-MP04-ST03-200-		C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O	InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1	WCGUUGGRBIKTOS-GPOJBZKASA-N	456.360345396							9908, 9908, 9908, 9908
Urapidil	LSM-5807	Urapidil	5639	InChI=1S/C20H29N5O3/c1-22-18(15-19(26)23(2)20(22)27)21-9-6-10-24-11-13-25(14-12-24)16-7-4-5-8-17(16)28-3/h4-5,7-8,15,21H,6,9-14H2,1-3H3	ICMGLRUYEQNHPF-UHFFFAOYSA-N	COc1ccccc1N2CCN(CCCNC3=CC(=O)N(C)C(=O)N3C)CC2	BroadT	BRD-K73196317	BRD-K73196317-003-06-4	Tocris Bioscience	1772	1	Cl	COc1ccccc1N1CCN(CCCNc2cc(=O)n(C)c(=O)n2C)CC1.Cl	InChI=1S/C20H29N5O3.ClH/c1-22-18(15-19(26)23(2)20(22)27)21-9-6-10-24-11-13-25(14-12-24)16-7-4-5-8-17(16)28-3;/h4-5,7-8,15,21H,6,9-14H2,1-3H3;1H	KTMLZVUAXJERAT-UHFFFAOYSA-N	387.227039838							94727, 94727
Genistein	LSM-5549	NSC-36586	5280961	InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H	TZBJGXHYKVUXJN-UHFFFAOYSA-N	Oc1ccc(cc1)C2=COc3cc(O)cc(O)c3C2=O	BroadT	BRD-K43797669	BRD-K43797669-001-02-3	AnalytiCon Discovery GmbH	NP-001561			Oc1ccc(cc1)-c1coc2cc(O)cc(O)c2c1=O	InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H	TZBJGXHYKVUXJN-UHFFFAOYSA-N	270.05282342							28088
Naftifine	LSM-43018	Naftifine	47641	InChI=1S/C21H21N/c1-22(16-8-11-18-9-3-2-4-10-18)17-20-14-7-13-19-12-5-6-15-21(19)20/h2-15H,16-17H2,1H3/b11-8+	OZGNYLLQHRPOBR-DHZHZOJOSA-N	CN(C\C=C\c1ccccc1)Cc2cccc3ccccc23	BroadT	BRD-K74141488	BRD-K74141488-003-03-9	Prestwick Chemical Inc.	Prestw-1063	D0701-MP04-ST03-200-	Cl	CN(C\C=C\c1ccccc1)Cc1cccc2ccccc12.Cl	InChI=1S/C21H21N.ClH/c1-22(16-8-11-18-9-3-2-4-10-18)17-20-14-7-13-19-12-5-6-15-21(19)20;/h2-15H,16-17H2,1H3;1H/b11-8+;	OLUNPKFOFGZHRT-YGCVIUNWSA-N	287.167399682							7451, 7451
Triptophenolide	LSM-25629		173273	InChI=1S/C20H24O3/c1-11(2)12-4-6-16-14(18(12)21)5-7-17-15-10-23-19(22)13(15)8-9-20(16,17)3/h4,6,11,17,21H,5,7-10H2,1-3H3/t17-,20+/m0/s1	KPXIBWGPZSPABK-FXAWDEMLSA-N	CC(C)c1ccc2c(CC[C@H]3C4=C(CC[C@]23C)C(=O)OC4)c1O	BroadT	BRD-K73210450	BRD-K73210450-001-02-3	MicroSource Discovery Systems Inc.	1504005			CC(C)c1ccc2c(CC[C@H]3C4=C(CC[C@]23C)C(=O)OC4)c1O	InChI=1S/C20H24O3/c1-11(2)12-4-6-16-14(18(12)21)5-7-17-15-10-23-19(22)13(15)8-9-20(16,17)3/h4,6,11,17,21H,5,7-10H2,1-3H3/t17-,20+/m0/s1	KPXIBWGPZSPABK-FXAWDEMLSA-N	312.172544628							114185
Palmidrol	LSM-3518	Palmidrol	4671	InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)19-16-17-20/h20H,2-17H2,1H3,(H,19,21)	HXYVTAGFYLMHSO-UHFFFAOYSA-N	CCCCCCCCCCCCCCCC(=O)NCCO	BroadT	BRD-K68095457	BRD-K68095457-001-04-4	Tocris Bioscience	879	3		CCCCCCCCCCCCCCCC(=O)NCCO	InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)19-16-17-20/h20H,2-17H2,1H3,(H,19,21)	HXYVTAGFYLMHSO-UHFFFAOYSA-N	299.282429434							71464
Oxolinic acid	LSM-5811	Utibid, W-4565, Oxolinic Acid, Oxolinic-Acid	4628	InChI=1S/C13H11NO5/c1-2-14-5-8(13(16)17)12(15)7-3-10-11(4-9(7)14)19-6-18-10/h3-5H,2,6H2,1H3,(H,16,17)	KYGZCKSPAKDVKC-UHFFFAOYSA-N	CCN1C=C(C(=O)O)C(=O)c2cc3OCOc3cc12	BroadT	BRD-K73394555	BRD-K73394555-001-04-5	MicroSource Discovery Systems Inc.	1502030			CCn1cc(C(O)=O)c(=O)c2cc3OCOc3cc12	InChI=1S/C13H11NO5/c1-2-14-5-8(13(16)17)12(15)7-3-10-11(4-9(7)14)19-6-18-10/h3-5H,2,6H2,1H3,(H,16,17)	KYGZCKSPAKDVKC-UHFFFAOYSA-N	261.063722462							138856
Loperamide	LSM-3365	Imodium, Loperamide	3955	InChI=1S/C29H33ClN2O2/c1-31(2)27(33)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)19-22-32-20-17-28(34,18-21-32)23-13-15-26(30)16-14-23/h3-16,34H,17-22H2,1-2H3	RDOIQAHITMMDAJ-UHFFFAOYSA-N	CN(C)C(=O)C(CCN1CCC(O)(CC1)c2ccc(Cl)cc2)(c3ccccc3)c4ccccc4	BroadT	BRD-K61250553	BRD-K61250553-001-02-9	Biomol International Inc.	AC-110	2840(V2)-3-N1305		CN(C)C(=O)C(CCN1CCC(O)(CC1)c1ccc(Cl)cc1)(c1ccccc1)c1ccccc1	InChI=1S/C29H33ClN2O2/c1-31(2)27(33)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)19-22-32-20-17-28(34,18-21-32)23-13-15-26(30)16-14-23/h3-16,34H,17-22H2,1-2H3	RDOIQAHITMMDAJ-UHFFFAOYSA-N	476.223056026							6532, 6532
Phenylbutanoic acid	LSM-5751	Phenylbutyrate, Sodium Phenylbutyrate, Phenylbutanoic Acid	4775	InChI=1S/C10H12O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)	OBKXEAXTFZPCHS-UHFFFAOYSA-N	OC(=O)CCCc1ccccc1	BroadT	BRD-K67102207	BRD-K67102207-236-01-0	Tocris Bioscience	2682	1	[Na]	OC(=O)CCCc1ccccc1.[Na]	InChI=1S/C10H12O2.Na.H/c11-10(12)8-4-7-9-5-2-1-3-6-9;;/h1-3,5-6H,4,7-8H2,(H,11,12);;	HBVQXECVVZYXQN-UHFFFAOYSA-N	164.083729624							41500
Etifenin	LSM-3430	Etifenin	170344	InChI=1S/C16H22N2O5/c1-3-11-6-5-7-12(4-2)16(11)17-13(19)8-18(9-14(20)21)10-15(22)23/h5-7H,3-4,8-10H2,1-2H3,(H,17,19)(H,20,21)(H,22,23)	WNIDXAKKFOKNEF-UHFFFAOYSA-N	CCc1cccc(CC)c1NC(=O)CN(CC(=O)O)CC(=O)O	BroadT	BRD-K63979671	BRD-K63979671-001-03-6	Prestwick Chemical Inc.	Prestw-504	D0701-MP04-ST03-200-		CCc1cccc(CC)c1NC(=O)CN(CC(O)=O)CC(O)=O	InChI=1S/C16H22N2O5/c1-3-11-6-5-7-12(4-2)16(11)17-13(19)8-18(9-14(20)21)10-15(22)23/h5-7H,3-4,8-10H2,1-2H3,(H,17,19)(H,20,21)(H,22,23)	WNIDXAKKFOKNEF-UHFFFAOYSA-N	322.152871824							93120
Phorbol Myristate Acetate	LSM-25630	Phorbol 12-myristate 13-acetate, Phorbol Myristate Acetate	27924	InChI=1S/C36H56O8/c1-7-8-9-10-11-12-13-14-15-16-17-18-29(39)43-32-24(3)35(42)27(30-33(5,6)36(30,32)44-25(4)38)20-26(22-37)21-34(41)28(35)19-23(2)31(34)40/h19-20,24,27-28,30,32,37,41-42H,7-18,21-22H2,1-6H3/t24-,27+,28-,30-,32-,34-,35-,36-/m1/s1	PHEDXBVPIONUQT-RGYGYFBISA-N	CCCCCCCCCCCCCC(=O)O[C@@H]1[C@@H](C)[C@@]2(O)[C@@H](C=C(CO)C[C@@]3(O)[C@H]2C=C(C)C3=O)[C@@H]4C(C)(C)[C@]14OC(=O)C	BroadT	BRD-K68552125	BRD-K68552125-001-03-8	Biomol International Inc.	PE-160	2840(V2)-3-N1305		CCCCCCCCCCCCCC(=O)O[C@@H]1[C@@H](C)[C@]2(O)[C@@H]3C=C(C)C(=O)[C@@]3(O)CC(CO)=C[C@H]2[C@@H]2C(C)(C)[C@]12OC(C)=O	InChI=1S/C36H56O8/c1-7-8-9-10-11-12-13-14-15-16-17-18-29(39)43-32-24(3)35(42)27(30-33(5,6)36(30,32)44-25(4)38)20-26(22-37)21-34(41)28(35)19-23(2)31(34)40/h19-20,24,27-28,30,32,37,41-42H,7-18,21-22H2,1-6H3/t24-,27+,28-,30-,32-,34-,35-,36-/m1/s1	PHEDXBVPIONUQT-RGYGYFBISA-N	616.397518752							37537
Diphenyleneiodonium	LSM-3467	Dibenziodolium, Diphenyleneiodonium CL	3101	InChI=1S/C12H8I/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8H/q+1	QFXKXRXFBRLLPQ-UHFFFAOYSA-N	c1ccc2c(c1)[i+]c3ccccc23	BroadT	BRD-K65814004	BRD-K65814004-001-02-3	Biomol International Inc.	CN-240	2840(V2)-3-N1305		[I+]1c2ccccc2-c2ccccc12	InChI=1S/C12H8I/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8H/q+1	QFXKXRXFBRLLPQ-UHFFFAOYSA-N	278.967068256							77986, 77986
6-Benzylaminopurine	LSM-3396	BRD-K62929068	62389	InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)	NWBJYWHLCVSVIJ-UHFFFAOYSA-N	C(Nc1ncnc2nc[nH]c12)c3ccccc3	BroadT	BRD-K62929068	BRD-K62929068-001-01-7	TimTec LLC	ST020598			N(Cc1ccccc1)c1ncnc2nc[nH]c12	InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)	NWBJYWHLCVSVIJ-UHFFFAOYSA-N	225.101445402							29022
331771-20-1	LSM-1096	ZM-447439, BRD-K72703948, TCMDC-125873	9914412	InChI=1S/C29H31N5O4/c1-36-26-18-24-25(19-27(26)38-15-5-12-34-13-16-37-17-14-34)30-20-31-28(24)32-22-8-10-23(11-9-22)33-29(35)21-6-3-2-4-7-21/h2-4,6-11,18-20H,5,12-17H2,1H3,(H,33,35)(H,30,31,32)	OGNYUTNQZVRGMN-UHFFFAOYSA-N	COc1cc2c(Nc3ccc(NC(=O)c4ccccc4)cc3)ncnc2cc1OCCCN5CCOCC5	BroadT	BRD-K72703948	BRD-K72703948-001-01-0	ChemieTek	ZM447439			COc1cc2c(Nc3ccc(NC(=O)c4ccccc4)cc3)ncnc2cc1OCCCN1CCOCC1	InChI=1S/C29H31N5O4/c1-36-26-18-24-25(19-27(26)38-15-5-12-34-13-16-37-17-14-34)30-20-31-28(24)32-22-8-10-23(11-9-22)33-29(35)21-6-3-2-4-7-21/h2-4,6-11,18-20H,5,12-17H2,1H3,(H,33,35)(H,30,31,32)	OGNYUTNQZVRGMN-UHFFFAOYSA-N	513.237604522							91376
Ponalrestat	LSM-3528	Ponalrestat, ICI-128436	5278	InChI=1S/C17H12BrFN2O3/c18-11-6-5-10(14(19)7-11)9-21-17(24)13-4-2-1-3-12(13)15(20-21)8-16(22)23/h1-7H,8-9H2,(H,22,23)	LKBFFDOJUKLQNY-UHFFFAOYSA-N	OC(=O)CC1=NN(Cc2ccc(Br)cc2F)C(=O)c3ccccc13	BroadT	BRD-K68332390	BRD-K68332390-001-03-3	Tocris Bioscience	847	1		OC(=O)Cc1nn(Cc2ccc(Br)cc2F)c(=O)c2ccccc12	InChI=1S/C17H12BrFN2O3/c18-11-6-5-10(14(19)7-11)9-21-17(24)13-4-2-1-3-12(13)15(20-21)8-16(22)23/h1-7H,8-9H2,(H,22,23)	LKBFFDOJUKLQNY-UHFFFAOYSA-N	390.001533064							93199
ANANDAMIDE (20:3,N-6)	LSM-43024	Anandamide(20, Dihomo-Gamma-Linolenoyl Ethanolamide	5282272	InChI=1S/C22H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h6-7,9-10,12-13,24H,2-5,8,11,14-21H2,1H3,(H,23,25)/b7-6-,10-9-,13-12-	ULQWKETUACYZLI-QNEBEIHSSA-N	CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(=O)NCCO	BroadT	BRD-K78280988	BRD-K78280988-001-02-2	Biomol International Inc.	FA019	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(=O)NCCO	InChI=1S/C22H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h6-7,9-10,12-13,24H,2-5,8,11,14-21H2,1H3,(H,23,25)/b7-6-,10-9-,13-12-	ULQWKETUACYZLI-QNEBEIHSSA-N	349.298079498							34488
GSK 3BETA Inhibitor VIII	LSM-3514	GSK-3BETA Inhibitor VIII, AR-A014418, AR A014418	448014	InChI=1S/C12H12N4O4S/c1-20-9-4-2-8(3-5-9)6-13-11(17)15-12-14-7-10(21-12)16(18)19/h2-5,7H,6H2,1H3,(H2,13,14,15,17)	YAEMHJKFIIIULI-UHFFFAOYSA-N	COc1ccc(CNC(=O)Nc2ncc(s2)[N+](=O)[O-])cc1	BroadT	BRD-K67860401	BRD-K67860401-001-02-3	Calbiochem	GSK-3b Inhibitor VIII			COc1ccc(CNC(=O)Nc2ncc(s2)[N+]([O-])=O)cc1	InChI=1S/C12H12N4O4S/c1-20-9-4-2-8(3-5-9)6-13-11(17)15-12-14-7-10(21-12)16(18)19/h2-5,7H,6H2,1H3,(H2,13,14,15,17)	YAEMHJKFIIIULI-UHFFFAOYSA-N	308.057925594							
VC-605	LSM-25631	SID11113632, SID26751832, BRD-K38370968	3073499	InChI=1S/C16H17N5/c1-2-7-20-8-10-21(11-9-20)16-15(12-17)18-13-5-3-4-6-14(13)19-16/h2-6H,1,7-11H2	IDOXKFDPDOIUMG-UHFFFAOYSA-N	C=CCN1CCN(CC1)c2nc3ccccc3nc2C#N	BroadT	BRD-K38370968	BRD-K38370968-001-01-6	Biomol International Inc.	NS-101	2813-N1283		C=CCN1CCN(CC1)c1nc2ccccc2nc1C#N	InChI=1S/C16H17N5/c1-2-7-20-8-10-21(11-9-20)16-15(12-17)18-13-5-3-4-6-14(13)19-16/h2-6H,1,7-11H2	IDOXKFDPDOIUMG-UHFFFAOYSA-N	279.148395594							114186
BW 373U86	LSM-25632	BRD-K74990253, BW-373U86, SNC-86	119029	InChI=1S/C27H37N3O2/c1-6-16-29-18-21(5)30(19-20(29)4)26(24-10-9-11-25(31)17-24)22-12-14-23(15-13-22)27(32)28(7-2)8-3/h6,9-15,17,20-21,26,31H,1,7-8,16,18-19H2,2-5H3/t20-,21+,26-/m1/s1	LBLDMHBSVIVJPM-YZIHRLCOSA-N	CCN(CC)C(=O)c1ccc(cc1)[C@@H](N2C[C@@H](C)N(CC=C)C[C@@H]2C)c3cccc(O)c3	BroadT	BRD-K74990253	BRD-K74990253-001-01-0	Tocris Bioscience	1663	1		CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(O)c1	InChI=1S/C27H37N3O2/c1-6-16-29-18-21(5)30(19-20(29)4)26(24-10-9-11-25(31)17-24)22-12-14-23(15-13-22)27(32)28(7-2)8-3/h6,9-15,17,20-21,26,31H,1,7-8,16,18-19H2,2-5H3/t20-,21+,26-/m1/s1	LBLDMHBSVIVJPM-YZIHRLCOSA-N	435.288577454							114187
MRS 1754	LSM-3616	MRS-1754, BRD-K72024482	6603931	InChI=1S/C26H26N6O4/c1-3-13-31-24-22(25(34)32(14-4-2)26(31)35)29-23(30-24)18-7-11-20(12-8-18)36-16-21(33)28-19-9-5-17(15-27)6-10-19/h5-12H,3-4,13-14,16H2,1-2H3,(H,28,33)(H,29,30)	AJBBEYXFRYFVNM-UHFFFAOYSA-N	CCCN1C(=O)N(CCC)c2nc([nH]c2C1=O)c3ccc(OCC(=O)Nc4ccc(cc4)C#N)cc3	BroadT	BRD-K72024482	BRD-K72024482-001-01-3	Tocris Bioscience	2752	1		CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C#N)cc1	InChI=1S/C26H26N6O4/c1-3-13-31-24-22(25(34)32(14-4-2)26(31)35)29-23(30-24)18-7-11-20(12-8-18)36-16-21(33)28-19-9-5-17(15-27)6-10-19/h5-12H,3-4,13-14,16H2,1-2H3,(H,28,33)(H,29,30)	AJBBEYXFRYFVNM-UHFFFAOYSA-N	486.201553372							93269, 93269
Dydrogesterone	LSM-3538	Isopregnenone, Gynorest, Dydrogesterone	9051	InChI=1S/C21H28O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4-5,12,16-19H,6-11H2,1-3H3/t16-,17+,18-,19+,20+,21+/m0/s1	JGMOKGBVKVMRFX-HQZYFCCVSA-N	CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C	BroadT	BRD-K68620903	BRD-K68620903-001-03-1	Prestwick Chemical Inc.	Prestw-671	D0701-MP04-ST03-200-		CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C	InChI=1S/C21H28O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4-5,12,16-19H,6-11H2,1-3H3/t16-,17+,18-,19+,20+,21+/m0/s1	JGMOKGBVKVMRFX-HQZYFCCVSA-N	312.208930136							31527
Isopilocarpine	LSM-15522	SID11113130	91468	InChI=1S/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3/t8-,10+/m0/s1	QCHFTSOMWOSFHM-WCBMZHEXSA-N	CC[C@@H]1[C@@H](Cc2cncn2C)COC1=O	BroadT	BRD-K75983763	BRD-K75983763-008-01-2	MicroSource Discovery Systems Inc.	300340		O[N+](=O)[O-]	CC[C@@H]1[C@@H](Cc2cncn2C)COC1=O.O[N+](=O)[O-]	InChI=1S/C11H16N2O2.HNO3/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2;2-1(3)4/h5,7-8,10H,3-4,6H2,1-2H3;(H,2,3,4)/t8-,10+;/m0./s1	PRZXEPJJHQYOGF-KXNXZCPBSA-N	208.121177772							39458
Hydroxycamptothecin	LSM-4685	10-Hydroxycamptothecine, 10-Hydroxycamptothecin, 10-Hydroxy-Camptothecin, 10-Hydroxy Camptothecin, 10-Hydroxycamtothecin, Hydroxycamptothecin	97226	InChI=1S/C20H16N2O5/c1-2-20(26)14-7-16-17-11(5-10-6-12(23)3-4-15(10)21-17)8-22(16)18(24)13(14)9-27-19(20)25/h3-7,23,26H,2,8-9H2,1H3/t20-/m0/s1	HAWSQZCWOQZXHI-FQEVSTJZSA-N	CC[C@@]1(O)C(=O)OCC2=C1C=C3N(Cc4cc5cc(O)ccc5nc34)C2=O	BroadT	BRD-K63784565	BRD-K63784565-001-02-1	MicroSource Discovery Systems Inc.	1504123			CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4ccc(O)cc4cc3Cn1c2=O	InChI=1S/C20H16N2O5/c1-2-20(26)14-7-16-17-11(5-10-6-12(23)3-4-15(10)21-17)8-22(16)18(24)13(14)9-27-19(20)25/h3-7,23,26H,2,8-9H2,1H3/t20-/m0/s1	HAWSQZCWOQZXHI-FQEVSTJZSA-N	364.105921632							81395
GSK-3 Inhibitor II	LSM-1030	GSK-3-Inhibitor-II	6539732	InChI=1S/C14H10IN3OS/c15-12-3-1-2-10(8-12)9-20-14-18-17-13(19-14)11-4-6-16-7-5-11/h1-8H,9H2	ZRHRPGSSSVYBRG-UHFFFAOYSA-N	Ic1cccc(CSc2oc(nn2)c3ccncc3)c1	BroadT	BRD-K09991945	BRD-K09991945-001-02-0	Calbiochem	GSK-3 Inhibitor II			Ic1cccc(CSc2nnc(o2)-c2ccncc2)c1	InChI=1S/C14H10IN3OS/c15-12-3-1-2-10(8-12)9-20-14-18-17-13(19-14)11-4-6-16-7-5-11/h1-8H,9H2	ZRHRPGSSSVYBRG-UHFFFAOYSA-N	394.95892566							91342
PNU-99194A	LSM-3568	U-99194A, CHEMBL16410, PNU-99194A, U-99194	5626	InChI=1S/C17H27NO2/c1-5-7-18(8-6-2)15-9-13-11-16(19-3)17(20-4)12-14(13)10-15/h11-12,15H,5-10H2,1-4H3	UOLJKAPABHXFRE-UHFFFAOYSA-N	CCCN(CCC)C1Cc2cc(OC)c(OC)cc2C1	BroadT	BRD-K70281171	BRD-K70281171-001-01-7	Biomol International Inc.	AC-761	2812-3-N1298		CCCN(CCC)C1Cc2cc(OC)c(OC)cc2C1	InChI=1S/C17H27NO2/c1-5-7-18(8-6-2)15-9-13-11-16(19-3)17(20-4)12-14(13)10-15/h11-12,15H,5-10H2,1-4H3	UOLJKAPABHXFRE-UHFFFAOYSA-N	277.204179114							93232, 93232, 93232
3-Hydroxymethyl-beta-carboline	LSM-25633		5353338	InChI=1S/C12H10N2O/c15-7-8-5-10-9-3-1-2-4-11(9)14-12(10)6-13-8/h1-6,14-15H,7H2	CPBYHTDUBNSBQM-UHFFFAOYSA-N	OCc1cc2c(cn1)[nH]c3ccccc23	BroadT	BRD-K69585439	BRD-K69585439-001-01-2	Biomol International Inc.	B-103	2819-N1292		OCc1cc2c(cn1)[nH]c1ccccc21	InChI=1S/C12H10N2O/c15-7-8-5-10-9-3-1-2-4-11(9)14-12(10)6-13-8/h1-6,14-15H,7H2	CPBYHTDUBNSBQM-UHFFFAOYSA-N	198.07931296							114188
Raloxifene	LSM-3425	Evista, Raloxifene	5035	InChI=1S/C28H27NO4S/c30-21-8-4-20(5-9-21)28-26(24-13-10-22(31)18-25(24)34-28)27(32)19-6-11-23(12-7-19)33-17-16-29-14-2-1-3-15-29/h4-13,18,30-31H,1-3,14-17H2	GZUITABIAKMVPG-UHFFFAOYSA-N	Oc1ccc(cc1)c2sc3cc(O)ccc3c2C(=O)c4ccc(OCCN5CCCCC5)cc4	BroadT	BRD-K63828191	BRD-K63828191-003-07-3	Tocris Bioscience	2280	1	Cl	Oc1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1.Cl	InChI=1S/C28H27NO4S.ClH/c30-21-8-4-20(5-9-21)28-26(24-13-10-22(31)18-25(24)34-28)27(32)19-6-11-23(12-7-19)33-17-16-29-14-2-1-3-15-29;/h4-13,18,30-31H,1-3,14-17H2;1H	BKXVVCILCIUCLG-UHFFFAOYSA-N	473.166079044							8772, 8772
Naloxone	LSM-3504	Naloxone, Narcan, Narcanti, Suboxone, Nalone	5284596	InChI=1S/C19H21NO4/c1-2-8-20-9-7-18-15-11-3-4-12(21)16(15)24-17(18)13(22)5-6-19(18,23)14(20)10-11/h2-4,14,17,21,23H,1,5-10H2/t14-,17+,18+,19-/m1/s1	UZHSEJADLWPNLE-GRGSLBFTSA-N	Oc1ccc2C[C@H]3N(CC=C)CC[C@@]45[C@@H](Oc1c24)C(=O)CC[C@@]35O	BroadT	BRD-K67511046	BRD-K67511046-003-03-7	Prestwick Chemical Inc.	Prestw-111	D0701-MP04-ST03-200-	Cl	Oc1ccc2C[C@H]3N(CC=C)CC[C@@]45[C@@H](Oc1c24)C(=O)CC[C@@]35O.Cl	InChI=1S/C19H21NO4.ClH/c1-2-8-20-9-7-18-15-11-3-4-12(21)16(15)24-17(18)13(22)5-6-19(18,23)14(20)10-11;/h2-4,14,17,21,23H,1,5-10H2;1H/t14-,17+,18+,19-;/m1./s1	RGPDIGOSVORSAK-STHHAXOLSA-N	327.147058162							7459, 7459, 7459, 7459
84215-10-1	LSM-3529	BRD-K68341547, SID11113469	4306	InChI=1S/C16H21ClN2O2S/c17-16-7-5-6-13-12-14(8-9-15(13)16)22(20,21)19-11-4-2-1-3-10-18/h5-9,12,19H,1-4,10-11,18H2	WAEIMOCPASQBSR-UHFFFAOYSA-N	NCCCCCCNS(=O)(=O)c1ccc2c(Cl)cccc2c1	BroadT	BRD-K68341547	BRD-K68341547-003-01-6	Tocris Bioscience	370	1	Cl	NCCCCCCNS(=O)(=O)c1ccc2c(Cl)cccc2c1.Cl	InChI=1S/C16H21ClN2O2S.ClH/c17-16-7-5-6-13-12-14(8-9-15(13)16)22(20,21)19-11-4-2-1-3-10-18;/h5-9,12,19H,1-4,10-11,18H2;1H	FGWDLQXTCSKXSK-UHFFFAOYSA-N	340.101226332							93200
Phenylephrine	LSM-15380	Cyclomydril, Phenylephrine, Duo-Medihaler	6041	InChI=1S/C9H13NO2/c1-10-6-9(12)7-3-2-4-8(11)5-7/h2-5,9-12H,6H2,1H3/t9-/m0/s1	SONNWYBIRXJNDC-VIFPVBQESA-N	CNC[C@H](O)c1cccc(O)c1	BroadT	BRD-K73381542	BRD-K73381542-003-02-8	MicroSource Discovery Systems Inc.	1500483		Cl	CNC[C@H](O)c1cccc(O)c1.Cl	InChI=1S/C9H13NO2.ClH/c1-10-6-9(12)7-3-2-4-8(11)5-7;/h2-5,9-12H,6H2,1H3;1H/t9-;/m0./s1	OCYSGIYOVXAGKQ-FVGYRXGTSA-N	167.094628666							8093, 8093, 8093
201943-63-7	LSM-3560	BRD-K69763916, LY-341495	9819927	InChI=1S/C20H19NO5/c21-20(19(24)25,15-9-13(15)18(22)23)10-14-11-5-1-3-7-16(11)26-17-8-4-2-6-12(14)17/h1-8,13-15H,9-10,21H2,(H,22,23)(H,24,25)/t13-,15-,20-/m0/s1	VLZBRVJVCCNPRJ-KPHUOKFYSA-N	N[C@@](CC1c2ccccc2Oc3ccccc13)([C@H]4C[C@@H]4C(=O)O)C(=O)O	BroadT	BRD-K69763916	BRD-K69763916-001-01-7	Tocris Bioscience	1209	10		N[C@@](CC1c2ccccc2Oc2ccccc12)([C@H]1C[C@@H]1C(O)=O)C(O)=O	InChI=1S/C20H19NO5/c21-20(19(24)25,15-9-13(15)18(22)23)10-14-11-5-1-3-7-16(11)26-17-8-4-2-6-12(14)17/h1-8,13-15H,9-10,21H2,(H,22,23)(H,24,25)/t13-,15-,20-/m0/s1	VLZBRVJVCCNPRJ-KPHUOKFYSA-N	353.126322718							93224
Haloperidol	LSM-3512	Haloperidol, Serenace, Keselen, Haldol, R-1625, MCN-JR-1625, Haldol Solutab	3559	InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2	LNEPOXFFQSENCJ-UHFFFAOYSA-N	OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c3ccc(Cl)cc3	BroadT	BRD-K67783091	BRD-K67783091-001-05-5	Biomol International Inc.	AC-250	2812-3-N1298		OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1	InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2	LNEPOXFFQSENCJ-UHFFFAOYSA-N	375.140134896							5613, 5613, 5613, 5613, 5613
Linoleoyl Glycine	LSM-43020	N-Linoleoylglycine, Linoleoyl Glycine	6433346	InChI=1S/C20H35NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(22)21-18-20(23)24/h6-7,9-10H,2-5,8,11-18H2,1H3,(H,21,22)(H,23,24)/b7-6-,10-9-	YCRHZEHWEYAHCO-HZJYTTRNSA-N	CCCCC\C=C/C\C=C/CCCCCCCC(=O)NCC(=O)O	BroadT	BRD-K76293260	BRD-K76293260-001-02-6	Biomol International Inc.	FA-030	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/CCCCCCCC(=O)NCC(O)=O	InChI=1S/C20H35NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(22)21-18-20(23)24/h6-7,9-10H,2-5,8,11-18H2,1H3,(H,21,22)(H,23,24)/b7-6-,10-9-	YCRHZEHWEYAHCO-HZJYTTRNSA-N	337.26169399							
Difucol Hexamethyl Ether	LSM-25634	BRD-K64246525	5219341	InChI=1S/C18H22O6/c1-19-11-7-13(21-3)17(14(8-11)22-4)18-15(23-5)9-12(20-2)10-16(18)24-6/h7-10H,1-6H3	PKTVMNKLPFVXBH-UHFFFAOYSA-N	COc1cc(OC)c(c(OC)c1)c2c(OC)cc(OC)cc2OC	BroadT	BRD-K64246525	BRD-K64246525-001-01-1	MicroSource Discovery Systems Inc.	300423			COc1cc(OC)c(c(OC)c1)-c1c(OC)cc(OC)cc1OC	InChI=1S/C18H22O6/c1-19-11-7-13(21-3)17(14(8-11)22-4)18-15(23-5)9-12(20-2)10-16(18)24-6/h7-10H,1-6H3	PKTVMNKLPFVXBH-UHFFFAOYSA-N	334.141638424							114189
Corticosterone	LSM-5814	17-Deoxycortisol, 11-B,21-Dihydroxypregn-3,20-Dione, Corticosteron, Corticosterone, Preg-4-Ene-3,20-Dione,11-B,21-Dihydroxy-, Reichstein'S Substance H	5753	InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,14-17,19,22,24H,3-8,10-11H2,1-2H3/t14-,15-,16+,17-,19+,20-,21-/m0/s1	OMFXVFTZEKFJBZ-HJTSIMOOSA-N	C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO	BroadT	BRD-K73589401	BRD-K73589401-001-03-8	EMD Biosciences	235135			C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO	InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,14-17,19,22,24H,3-8,10-11H2,1-2H3/t14-,15-,16+,17-,19+,20-,21-/m0/s1	OMFXVFTZEKFJBZ-HJTSIMOOSA-N	346.21440944							16827
AJ76(+)	LSM-25635	SID11113640, SID26751835	122334	InChI=1S/C15H23NO/c1-4-10-16-14-9-8-13-12(11(14)2)6-5-7-15(13)17-3/h5-7,11,14,16H,4,8-10H2,1-3H3/t11-,14+/m0/s1	YGHLYBIUVOLKCV-SMDDNHRTSA-N	CCCN[C@@H]1CCc2c(OC)cccc2[C@@H]1C	BroadT	BRD-K76677554	BRD-K76677554-001-01-7	Biomol International Inc.	D-101	2812-3-N1298		CCCN[C@@H]1CCc2c(OC)cccc2[C@@H]1C	InChI=1S/C15H23NO/c1-4-10-16-14-9-8-13-12(11(14)2)6-5-7-15(13)17-3/h5-7,11,14,16H,4,8-10H2,1-3H3/t11-,14+/m0/s1	YGHLYBIUVOLKCV-SMDDNHRTSA-N	233.177964366							64117
Athraquinones A	LSM-25636	Alizarin	6293	InChI=1S/C14H8O4/c15-10-6-5-9-11(14(10)18)13(17)8-4-2-1-3-7(8)12(9)16/h1-6,15,18H	RGCKGOZRHPZPFP-UHFFFAOYSA-N	Oc1ccc2C(=O)c3ccccc3C(=O)c2c1O	BroadT	BRD-K73191876	BRD-K73191876-001-02-1	MicroSource Discovery Systems Inc.	210850			Oc1ccc2C(=O)c3ccccc3C(=O)c2c1O	InChI=1S/C14H8O4/c15-10-6-5-9-11(14(10)18)13(17)8-4-2-1-3-7(8)12(9)16/h1-6,15,18H	RGCKGOZRHPZPFP-UHFFFAOYSA-N	240.042258736							16866
Semaxanib	LSM-42995	Semaxanib, Semaxinib, SU-5416	5329098	InChI=1S/C15H14N2O/c1-9-7-10(2)16-14(9)8-12-11-5-3-4-6-13(11)17-15(12)18/h3-8,16H,1-2H3,(H,17,18)/b12-8-	WUWDLXZGHZSWQZ-WQLSENKSSA-N	Cc1cc(C)c(\C=C\2/C(=O)Nc3ccccc23)[nH]1	BroadT	BRD-K63504947	BRD-K63504947-001-05-5	Tocris Bioscience	3037	1		Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1	InChI=1S/C15H14N2O/c1-9-7-10(2)16-14(9)8-12-11-5-3-4-6-13(11)17-15(12)18/h3-8,16H,1-2H3,(H,17,18)/b12-8-	WUWDLXZGHZSWQZ-WQLSENKSSA-N	238.110613088							91083
Phthalylsulfathiazole	LSM-5730	Phthalylsulfathiazole, Phthalylsulphathiazole, Sulfaphtalylthiazol	4806	InChI=1S/C17H13N3O5S2/c21-15(13-3-1-2-4-14(13)16(22)23)19-11-5-7-12(8-6-11)27(24,25)20-17-18-9-10-26-17/h1-10H,(H,18,20)(H,19,21)(H,22,23)	PBMSWVPMRUJMPE-UHFFFAOYSA-N	OC(=O)c1ccccc1C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nccs3	BroadT	BRD-K64659768	BRD-K64659768-001-04-5	Prestwick Chemical Inc.	Prestw-869	D0701-MP04-ST03-200-		OC(=O)c1ccccc1C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1	InChI=1S/C17H13N3O5S2/c21-15(13-3-1-2-4-14(13)16(22)23)19-11-5-7-12(8-6-11)27(24,25)20-17-18-9-10-26-17/h1-10H,(H,18,20)(H,19,21)(H,22,23)	PBMSWVPMRUJMPE-UHFFFAOYSA-N	403.029661926							9336
Rauwolscine	LSM-15381	Rauwolscine, Alpha-yohimbine	643606	InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15+,17+,18+,19+/m1/s1	BLGXFZZNTVWLAY-DIRVCLHFSA-N	COC(=O)[C@@H]1[C@@H](O)CC[C@@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12	BroadT	BRD-K77474816	BRD-K77474816-003-04-2	MicroSource Discovery Systems Inc.	1503639		Cl	COC(=O)[C@@H]1[C@@H](O)CC[C@@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12.Cl	InChI=1S/C21H26N2O3.ClH/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24;/h2-5,12,15,17-19,22,24H,6-11H2,1H3;1H/t12-,15+,17+,18+,19+;/m1./s1	PIPZGJSEDRMUAW-ZKKXXTDSSA-N	354.194342712							48562, 48562
Dichlorphenamide	LSM-3602	Diclofenamide, Dichlorphenamide, Daranide	3038	InChI=1S/C6H6Cl2N2O4S2/c7-4-1-3(15(9,11)12)2-5(6(4)8)16(10,13)14/h1-2H,(H2,9,11,12)(H2,10,13,14)	GJQPMPFPNINLKP-UHFFFAOYSA-N	NS(=O)(=O)c1cc(Cl)c(Cl)c(c1)S(=O)(=O)N	BroadT	BRD-K71499074	BRD-K71499074-001-03-8	Prestwick Chemical Inc.	Prestw-809	D0701-MP04-ST03-200-		NS(=O)(=O)c1cc(Cl)c(Cl)c(c1)S(N)(=O)=O	InChI=1S/C6H6Cl2N2O4S2/c7-4-1-3(15(9,11)12)2-5(6(4)8)16(10,13)14/h1-2H,(H2,9,11,12)(H2,10,13,14)	GJQPMPFPNINLKP-UHFFFAOYSA-N	303.914603492							101085
Liquiritigenin Dimethyl Ether	LSM-1732	SID26749751	5271544	InChI=1S/C17H16O4/c1-19-12-5-3-11(4-6-12)16-10-15(18)14-8-7-13(20-2)9-17(14)21-16/h3-9,16H,10H2,1-2H3	YAEYGSBLDUIDTP-UHFFFAOYSA-N	COc1ccc(cc1)C2CC(=O)c3ccc(OC)cc3O2	BroadT	BRD-A68039575	BRD-A68039575-001-02-5	MicroSource Discovery Systems Inc.	1600561			COc1ccc(cc1)C1CC(=O)c2ccc(OC)cc2O1	InChI=1S/C17H16O4/c1-19-12-5-3-11(4-6-12)16-10-15(18)14-8-7-13(20-2)9-17(14)21-16/h3-9,16H,10H2,1-2H3	YAEYGSBLDUIDTP-UHFFFAOYSA-N	284.104858992							91819
Dnqx	LSM-3911	6,7-Dinitroquinoxaline-2,3-Dione, SID29215530, SID50104334, SID90341758	3899541	InChI=1S/C8H4N4O6/c13-7-8(14)10-4-2-6(12(17)18)5(11(15)16)1-3(4)9-7/h1-2H,(H,9,13)(H,10,14)	RWVIMCIPOAXUDG-UHFFFAOYSA-N	Oc1nc2cc(c(cc2nc1O)[N+](=O)[O-])[N+](=O)[O-]	BroadT	BRD-K64400208	BRD-K64400208-001-01-8	Biomol International Inc.	EA-116	2817-N1277		[O-][N+](=O)c1cc2[nH]c(=O)c(=O)[nH]c2cc1[N+]([O-])=O	InChI=1S/C8H4N4O6/c13-7-8(14)10-4-2-6(12(17)18)5(11(15)16)1-3(4)9-7/h1-2H,(H,9,13)(H,10,14)	RWVIMCIPOAXUDG-UHFFFAOYSA-N	252.013083888							93492
Lecanoric acid	LSM-25637	Lecanoricacid, SID26749478, SID50107603, SID56322654, Lecanoric Acid	99613	InChI=1S/C16H14O7/c1-7-3-9(17)5-11(18)14(7)16(22)23-10-4-8(2)13(15(20)21)12(19)6-10/h3-6,17-19H,1-2H3,(H,20,21)	HEMSJKZDHNSSEW-UHFFFAOYSA-N	Cc1cc(O)cc(O)c1C(=O)Oc2cc(C)c(C(=O)O)c(O)c2	BroadT	BRD-K77578964	BRD-K77578964-001-02-8	MicroSource Discovery Systems Inc.	200070			Cc1cc(O)cc(O)c1C(=O)Oc1cc(C)c(C(O)=O)c(O)c1	InChI=1S/C16H14O7/c1-7-3-9(17)5-11(18)14(7)16(22)23-10-4-8(2)13(15(20)21)12(19)6-10/h3-6,17-19H,1-2H3,(H,20,21)	HEMSJKZDHNSSEW-UHFFFAOYSA-N	318.073952788							15871
10-DEBC	LSM-4710	SID50112909	10521421	InChI=1S/C20H25ClN2O/c1-3-22(4-2)13-7-8-14-23-17-9-5-6-10-19(17)24-20-12-11-16(21)15-18(20)23/h5-6,9-12,15H,3-4,7-8,13-14H2,1-2H3	GYBXAGDWMCJZJK-UHFFFAOYSA-N	CCN(CC)CCCCN1c2ccccc2Oc3ccc(Cl)cc13	BroadT	BRD-K70792160	BRD-K70792160-003-01-2	Tocris Bioscience	2558	1	Cl	CCN(CC)CCCCN1c2ccccc2Oc2ccc(Cl)cc12.Cl	InChI=1S/C20H25ClN2O.ClH/c1-3-22(4-2)13-7-8-14-23-17-9-5-6-10-19(17)24-20-12-11-16(21)15-18(20)23;/h5-6,9-12,15H,3-4,7-8,13-14H2,1-2H3;1H	SVKSJUIYYCQZEC-UHFFFAOYSA-N	344.16554115							94104
FG7142	LSM-3376	FG 7142, FG-7142	4375	InChI=1S/C13H11N3O/c1-14-13(17)11-6-9-8-4-2-3-5-10(8)16-12(9)7-15-11/h2-7,16H,1H3,(H,14,17)	QMCOPDWHWYSJSA-UHFFFAOYSA-N	CNC(=O)c1cc2c(cn1)[nH]c3ccccc23	BroadT	BRD-K61951118	BRD-K61951118-001-01-2	Biomol International Inc.	AC-205	2819-N1292		CNC(=O)c1cc2c(cn1)[nH]c1ccccc21	InChI=1S/C13H11N3O/c1-14-13(17)11-6-9-8-4-2-3-5-10(8)16-12(9)7-15-11/h2-7,16H,1H3,(H,14,17)	QMCOPDWHWYSJSA-UHFFFAOYSA-N	225.090212002							93081
Eicosatrienoic acid (20:3 n-3)	LSM-42997	Cis-11,14,17-Eicosatrienoicacid	5312529	InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10H,2,5,8,11-19H2,1H3,(H,21,22)/b4-3-,7-6-,10-9-	AHANXAKGNAKFSK-PDBXOOCHSA-N	CC\C=C/C\C=C/C\C=C/CCCCCCCCCC(=O)O	BroadT	BRD-K63913457	BRD-K63913457-001-02-7	Biomol International Inc.	FA008	2840(V2)-3-N1305		CC\C=C/C\C=C/C\C=C/CCCCCCCCCC(O)=O	InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10H,2,5,8,11-19H2,1H3,(H,21,22)/b4-3-,7-6-,10-9-	AHANXAKGNAKFSK-PDBXOOCHSA-N	306.255880328							53460
ICI-199,441	LSM-3643	BRD-K73290745, ICI-199441	3082718	InChI=1S/C21H24Cl2N2O/c1-24(21(26)14-16-9-10-18(22)19(23)13-16)20(15-25-11-5-6-12-25)17-7-3-2-4-8-17/h2-4,7-10,13,20H,5-6,11-12,14-15H2,1H3/t20-/m1/s1	AEJOEPSMZCEYJN-HXUWFJFHSA-N	CN([C@H](CN1CCCC1)c2ccccc2)C(=O)Cc3ccc(Cl)c(Cl)c3	BroadT	BRD-K73290745	BRD-K73290745-003-01-8	Tocris Bioscience	778	2	Cl	CN([C@H](CN1CCCC1)c1ccccc1)C(=O)Cc1ccc(Cl)c(Cl)c1.Cl	InChI=1S/C21H24Cl2N2O.ClH/c1-24(21(26)14-16-9-10-18(22)19(23)13-16)20(15-25-11-5-6-12-25)17-7-3-2-4-8-17;/h2-4,7-10,13,20H,5-6,11-12,14-15H2,1H3;1H/t20-;/m1./s1	VFLWVWZSDBTGQJ-VEIFNGETSA-N	390.126568828							93291
Nalbuphine	LSM-3477	Nalbuphine, Nubain	5311304	InChI=1S/C21H27NO4/c23-14-5-4-13-10-16-21(25)7-6-15(24)19-20(21,17(13)18(14)26-19)8-9-22(16)11-12-2-1-3-12/h4-5,12,15-16,19,23-25H,1-3,6-11H2/t15-,16+,19-,20-,21+/m0/s1	NETZHAKZCGBWSS-CEDHKZHLSA-N	O[C@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3CC6CCC6)c45	BroadT	BRD-K66404838	BRD-K66404838-003-03-8	Prestwick Chemical Inc.	Prestw-118	D0701-MP04-ST03-200-	Cl	O[C@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3CC1CCC1)c45.Cl	InChI=1S/C21H27NO4.ClH/c23-14-5-4-13-10-16-21(25)7-6-15(24)19-20(21,17(13)18(14)26-19)8-9-22(16)11-12-2-1-3-12;/h4-5,12,15-16,19,23-25H,1-3,6-11H2;1H/t15-,16+,19-,20-,21+;/m0./s1	YZLZPSJXMWGIFH-BCXQGASESA-N	357.194008354							7454, 7454, 7454
Ethylbeta-carboline-3-carboxylate	LSM-3077	Ethyl-Beta-Carboline-3-Carboxylate	105078	InChI=1S/C14H12N2O2/c1-2-18-14(17)12-7-10-9-5-3-4-6-11(9)16-13(10)8-15-12/h3-8,16H,2H2,1H3	KOVRZNUMIKACTB-UHFFFAOYSA-N	CCOC(=O)c1cc2c(cn1)[nH]c3ccccc23	BroadT	BRD-K49061529	BRD-K49061529-001-01-0	Biomol International Inc.	B-102	2819-N1292		CCOC(=O)c1cc2c(cn1)[nH]c1ccccc21	InChI=1S/C14H12N2O2/c1-2-18-14(17)12-7-10-9-5-3-4-6-11(9)16-13(10)8-15-12/h3-8,16H,2H2,1H3	KOVRZNUMIKACTB-UHFFFAOYSA-N	240.089877644							92850
IMD-0354	LSM-3667	BRD-K74305673, IMD-0354, TCMDC-125465	5081913	InChI=1S/C15H8ClF6NO2/c16-9-1-2-12(24)11(6-9)13(25)23-10-4-7(14(17,18)19)3-8(5-10)15(20,21)22/h1-6,24H,(H,23,25)	CHILCFMQWMQVAL-UHFFFAOYSA-N	Oc1ccc(Cl)cc1C(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F	BroadT	BRD-K74305673	BRD-K74305673-001-01-3	Tocris Bioscience	2611	1		Oc1ccc(Cl)cc1C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F	InChI=1S/C15H8ClF6NO2/c16-9-1-2-12(24)11(6-9)13(25)23-10-4-7(14(17,18)19)3-8(5-10)15(20,21)22/h1-6,24H,(H,23,25)	CHILCFMQWMQVAL-UHFFFAOYSA-N	383.014775416							93310
196868-63-0	LSM-3505	BRD-K67537649, TCMDC-125497	9549305	InChI=1S/C18H16ClN3O2/c1-11-9-15(13-5-3-4-6-14(13)20-11)21-18(23)22-16-10-12(19)7-8-17(16)24-2/h3-10H,1-2H3,(H2,20,21,22,23)	YBLWOZUPHDKFOT-UHFFFAOYSA-N	COc1ccc(Cl)cc1NC(=O)Nc2cc(C)nc3ccccc23	BroadT	BRD-K67537649	BRD-K67537649-001-01-1	Tocris Bioscience	2768	1		COc1ccc(Cl)cc1NC(=O)Nc1cc(C)nc2ccccc12	InChI=1S/C18H16ClN3O2/c1-11-9-15(13-5-3-4-6-14(13)20-11)21-18(23)22-16-10-12(19)7-8-17(16)24-2/h3-10H,1-2H3,(H2,20,21,22,23)	YBLWOZUPHDKFOT-UHFFFAOYSA-N	341.093104492							93181
Benzanthrone	LSM-3723	SID26749349, SID93576730	6697	InChI=1S/C17H10O/c18-17-14-8-2-1-7-12(14)13-9-3-5-11-6-4-10-15(17)16(11)13/h1-10H	HUKPVYBUJRAUAG-UHFFFAOYSA-N	O=C1c2ccccc2c3cccc4cccc1c34	BroadT	BRD-K76872913	BRD-K76872913-001-02-8	MicroSource Discovery Systems Inc.	1505272			O=C1c2ccccc2-c2cccc3cccc1c23	InChI=1S/C17H10O/c18-17-14-8-2-1-7-12(14)13-9-3-5-11-6-4-10-15(17)16(11)13/h1-10H	HUKPVYBUJRAUAG-UHFFFAOYSA-N	230.07316494							93350
(-)-Rolipram	LSM-25638	BRD-K75516118, (R)-(-)-Rolipram, (R)-Rolipram, R-Rolipram	448055	InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)/t12-/m0/s1	HJORMJIFDVBMOB-LBPRGKRZSA-N	COc1ccc(cc1OC2CCCC2)[C@@H]3CNC(=O)C3	BroadT	BRD-K75516118	BRD-K75516118-001-01-7	Tocris Bioscience	1349	12		COc1ccc(cc1OC1CCCC1)[C@@H]1CNC(=O)C1	InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)/t12-/m0/s1	HJORMJIFDVBMOB-LBPRGKRZSA-N	275.152143542							40133
SB-366791	LSM-3316	BRD-K59331372	4099413	InChI=1S/C16H14ClNO2/c1-20-15-4-2-3-14(11-15)18-16(19)10-7-12-5-8-13(17)9-6-12/h2-11H,1H3,(H,18,19)	RYAMDQKWNKKFHD-UHFFFAOYSA-N	COc1cccc(NC(=O)C=Cc2ccc(Cl)cc2)c1	BroadT	BRD-K59331372	BRD-K59331372-001-01-2	Tocris Bioscience	1615	1		COc1cccc(NC(=O)C=Cc2ccc(Cl)cc2)c1	InChI=1S/C16H14ClNO2/c1-20-15-4-2-3-14(11-15)18-16(19)10-7-12-5-8-13(17)9-6-12/h2-11H,1H3,(H,18,19)	RYAMDQKWNKKFHD-UHFFFAOYSA-N	287.071306408							93038
Mpep	LSM-4678	SID90340900, SID50104761	3025961	InChI=1S/C14H11N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-9H,1H3	NEWKHUASLBMWRE-UHFFFAOYSA-N	Cc1cccc(n1)C#Cc2ccccc2	BroadT	BRD-K60690191	BRD-K60690191-003-02-1	Tocris Bioscience	1212	10	Cl	Cc1cccc(n1)C#Cc1ccccc1.Cl	InChI=1S/C14H11N.ClH/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13;/h2-9H,1H3;1H	PKDHDJBNEKXCBI-UHFFFAOYSA-N	193.089149362							64159, 64159, 64159
4-IBP	LSM-25639	BRD-K62537556, SID11113680, SID26751865, SID512367	132995	InChI=1S/C19H21IN2O/c20-17-8-6-16(7-9-17)19(23)21-18-10-12-22(13-11-18)14-15-4-2-1-3-5-15/h1-9,18H,10-14H2,(H,21,23)	HELCSESNNDZLFM-UHFFFAOYSA-N	Ic1ccc(cc1)C(=O)NC2CCN(Cc3ccccc3)CC2	BroadT	BRD-K62537556	BRD-K62537556-001-01-7	Tocris Bioscience	748	1		Ic1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	InChI=1S/C19H21IN2O/c20-17-8-6-16(7-9-17)19(23)21-18-10-12-22(13-11-18)14-15-4-2-1-3-5-15/h1-9,18H,10-14H2,(H,21,23)	HELCSESNNDZLFM-UHFFFAOYSA-N	420.069856312							114190
Tiratricol	LSM-5706	Tiratricol, Triac	5803	InChI=1S/C14H9I3O4/c15-9-6-8(1-2-12(9)18)21-14-10(16)3-7(4-11(14)17)5-13(19)20/h1-4,6,18H,5H2,(H,19,20)	UOWZUVNAGUAEQC-UHFFFAOYSA-N	OC(=O)Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1	BroadT	BRD-K61236135	BRD-K61236135-001-03-3	Prestwick Chemical Inc.	Prestw-202	D0701-MP04-ST03-200-		OC(=O)Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1	InChI=1S/C14H9I3O4/c15-9-6-8(1-2-12(9)18)21-14-10(16)3-7(4-11(14)17)5-13(19)20/h1-4,6,18H,5H2,(H,19,20)	UOWZUVNAGUAEQC-UHFFFAOYSA-N	621.763487768							
Naphazoline	LSM-3737	Nafazair, Naphazoline	4436	InChI=1S/C14H14N2/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14/h1-7H,8-10H2,(H,15,16)	CNIIGCLFLJGOGP-UHFFFAOYSA-N	C(C1=NCCN1)c2cccc3ccccc23	BroadT	BRD-K77641333	BRD-K77641333-003-04-0	MicroSource Discovery Systems Inc.	1500424		Cl	C(C1=NCCN1)c1cccc2ccccc12.Cl	InChI=1S/C14H14N2.ClH/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14;/h1-7H,8-10H2,(H,15,16);1H	DJDFFEBSKJCGHC-UHFFFAOYSA-N	210.115698468							93363, 93363
Mnitmt	LSM-3401	BRD-K63151507, SID495270, SID50112877	364622	InChI=1S/C7H8N6O2S/c1-11-3-8-5(13(14)15)6(11)16-7-10-9-4-12(7)2/h3-4H,1-2H3	NMBDIMPYACLUDE-UHFFFAOYSA-N	Cn1cnnc1Sc2c(ncn2C)[N+](=O)[O-]	BroadT	BRD-K63151507	BRD-K63151507-001-01-6	Tocris Bioscience	2492	1		Cn1cnnc1Sc1c(ncn1C)[N+]([O-])=O	InChI=1S/C7H8N6O2S/c1-11-3-8-5(13(14)15)6(11)16-7-10-9-4-12(7)2/h3-4H,1-2H3	NMBDIMPYACLUDE-UHFFFAOYSA-N	240.042944246							93099
Kinetin	LSM-5740		3830	InChI=1S/C10H9N5O/c1-2-7(16-3-1)4-11-9-8-10(13-5-12-8)15-6-14-9/h1-3,5-6H,4H2,(H2,11,12,13,14,15)	QANMHLXAZMSUEX-UHFFFAOYSA-N	C(Nc1ncnc2[nH]cnc12)c3occc3	BroadT	BRD-K65667145	BRD-K65667145-001-04-1	MicroSource Discovery Systems Inc.	1500764			C(Nc1ncnc2[nH]cnc12)c1ccco1	InChI=1S/C10H9N5O/c1-2-7(16-3-1)4-11-9-8-10(13-5-12-8)15-6-14-9/h1-3,5-6H,4H2,(H2,11,12,13,14,15)	QANMHLXAZMSUEX-UHFFFAOYSA-N	215.080709958							27407
Hydroxyfasudil	LSM-3744	Hydroxyfasudil, Hydroxy-Fasudil	3064778	InChI=1S/C14H17N3O3S/c18-14-12-3-1-4-13(11(12)5-7-16-14)21(19,20)17-9-2-6-15-8-10-17/h1,3-5,7,15H,2,6,8-10H2,(H,16,18)	ZAVGJDAFCZAWSZ-UHFFFAOYSA-N	Oc1nccc2c(cccc12)S(=O)(=O)N3CCCNCC3	BroadT	BRD-K77793136	BRD-K77793136-003-01-4	Sigma-Aldrich	H4413		Cl	Oc1nccc2c(cccc12)S(=O)(=O)N1CCCNCC1.Cl	InChI=1S/C14H17N3O3S.ClH/c18-14-12-3-1-4-13(11(12)5-7-16-14)21(19,20)17-9-2-6-15-8-10-17;/h1,3-5,7,15H,2,6,8-10H2,(H,16,18);1H	XWWFOUVDVJGNNG-UHFFFAOYSA-N	307.099062124							
(R)-(+)-Atenolol	LSM-5757	Esatenolol, R(+)-Atenolol	180559	InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)/t12-/m1/s1	METKIMKYRPQLGS-GFCCVEGCSA-N	CC(C)NC[C@@H](O)COc1ccc(CC(=O)N)cc1	BroadT	BRD-K68075732	BRD-K68075732-001-03-5	Prestwick Chemical Inc.	Prestw-953	D0701-MP04-ST03-200-		CC(C)NC[C@@H](O)COc1ccc(CC(N)=O)cc1	InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)/t12-/m1/s1	METKIMKYRPQLGS-GFCCVEGCSA-N	266.163042584							55352
T-0156	LSM-3414	SID11114178, SID11111926	5368	InChI=1S/C31H29N5O7/c1-18-13-19(7-11-32-18)16-36-27(31(38)42-5)25(20-14-22(39-2)28(41-4)23(15-20)40-3)21-8-12-35-29(26(21)30(36)37)43-17-24-33-9-6-10-34-24/h6-15H,16-17H2,1-5H3	JEMJAABFSYOLAP-UHFFFAOYSA-N	COC(=O)C1=C(c2cc(OC)c(OC)c(OC)c2)c3ccnc(OCc4ncccn4)c3C(=O)N1Cc5ccnc(C)c5	BroadT	BRD-K63516691	BRD-K63516691-001-01-6	Calbiochem	524716			COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2ccnc(OCc3ncccn3)c2c(=O)n1Cc1ccnc(C)c1	InChI=1S/C31H29N5O7/c1-18-13-19(7-11-32-18)16-36-27(31(38)42-5)25(20-14-22(39-2)28(41-4)23(15-20)40-3)21-8-12-35-29(26(21)30(36)37)43-17-24-33-9-6-10-34-24/h6-15H,16-17H2,1-5H3	JEMJAABFSYOLAP-UHFFFAOYSA-N	583.206698318							93111, 93111
Ethacrynic acid	LSM-3420	Edecrin, MK-595, Etacrynic Acid, Ethacrynic Acid, Etacrynic-Acid	3278	InChI=1S/C13H12Cl2O4/c1-3-7(2)13(18)8-4-5-9(12(15)11(8)14)19-6-10(16)17/h4-5H,2-3,6H2,1H3,(H,16,17)	AVOLMBLBETYQHX-UHFFFAOYSA-N	CCC(=C)C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl	BroadT	BRD-K63630713	BRD-K63630713-001-04-3	MicroSource Discovery Systems Inc.	1500287			CCC(=C)C(=O)c1ccc(OCC(O)=O)c(Cl)c1Cl	InChI=1S/C13H12Cl2O4/c1-3-7(2)13(18)8-4-5-9(12(15)11(8)14)19-6-10(16)17/h4-5H,2-3,6H2,1H3,(H,16,17)	AVOLMBLBETYQHX-UHFFFAOYSA-N	302.011264284							4876, 4876
CHEMBL301707	LSM-25640	3-2-4-(2-Methoxyphenyl)Piperazin-1-ylpyrimido5,4-Bindole-2,4-Dione, SID11113578, SID26751781	4013695	InChI=1S/C23H25N5O3/c1-31-19-9-5-4-8-18(19)27-13-10-26(11-14-27)12-15-28-22(29)21-20(25-23(28)30)16-6-2-3-7-17(16)24-21/h2-9,24H,10-15H2,1H3,(H,25,30)	AQASGOHUMGAWJJ-UHFFFAOYSA-N	COc1ccccc1N2CCN(CCN3C(=O)Nc4c([nH]c5ccccc45)C3=O)CC2	BroadT	BRD-K62581435	BRD-K62581435-001-01-2	Biomol International Inc.	AC-545	2813-N1283		COc1ccccc1N1CCN(CCn2c(=O)[nH]c3c4ccccc4[nH]c3c2=O)CC1	InChI=1S/C23H25N5O3/c1-31-19-9-5-4-8-18(19)27-13-10-26(11-14-27)12-15-28-22(29)21-20(25-23(28)30)16-6-2-3-7-17(16)24-21/h2-9,24H,10-15H2,1H3,(H,25,30)	AQASGOHUMGAWJJ-UHFFFAOYSA-N	419.19573971							114191
Tyrphostin 63	LSM-25641		5613	InChI=1S/C10H8N2O/c11-6-9(7-12)5-8-1-3-10(13)4-2-8/h1-4,9,13H,5H2	PDRLQWJJFLVIRC-UHFFFAOYSA-N	Oc1ccc(CC(C#N)C#N)cc1	BroadT	BRD-K61590534	BRD-K61590534-001-01-4	Calbiochem	658450			Oc1ccc(CC(C#N)C#N)cc1	InChI=1S/C10H8N2O/c11-6-9(7-12)5-8-1-3-10(13)4-2-8/h1-4,9,13H,5H2	PDRLQWJJFLVIRC-UHFFFAOYSA-N	172.063662896							114192
Pifithrin	LSM-3485	Pifithrin-Alpha	4817	InChI=1S/C16H18N2OS/c1-11-6-8-12(9-7-11)14(19)10-18-13-4-2-3-5-15(13)20-16(18)17/h6-9,17H,2-5,10H2,1H3	OLTZHXYLLRJLST-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)CN2C(=N)SC3=C2CCCC3	BroadT	BRD-K66874953	BRD-K66874953-001-02-7	Biomol International Inc.	GR-325	2840(V2)-3-N1305		Cc1ccc(cc1)C(=O)Cn1c2CCCCc2sc1=N	InChI=1S/C16H18N2OS/c1-11-6-8-12(9-7-11)14(19)10-18-13-4-2-3-5-15(13)20-16(18)17/h6-9,17H,2-5,10H2,1H3	OLTZHXYLLRJLST-UHFFFAOYSA-N	286.113983906							93168, 93168
N-Methylquipazine	LSM-3379	Quipazine, SID11111701, SID11113567, SID124881259, SID26751774	5013	InChI=1S/C14H17N3/c1-16-8-10-17(11-9-16)14-7-6-12-4-2-3-5-13(12)15-14/h2-7H,8-11H2,1H3	HOMWNUXPSJQSSU-UHFFFAOYSA-N	CN1CCN(CC1)c2ccc3ccccc3n2	BroadT	BRD-K62056274	BRD-K62056274-001-01-9	Biomol International Inc.	NS-550	2813-N1283		CN1CCN(CC1)c1ccc2ccccc2n1	InChI=1S/C14H17N3/c1-16-8-10-17(11-9-16)14-7-6-12-4-2-3-5-13(12)15-14/h2-7H,8-11H2,1H3	HOMWNUXPSJQSSU-UHFFFAOYSA-N	227.142247574							64164, 64164, 64164
UNII-EE9FJW53Z2	LSM-3437	SID50112925, BRD-K64341947	9844347	InChI=1S/C23H28N4O3/c1-26(2)14-7-15-30-22-16-21(27(25-22)17-18-8-5-4-6-9-18)23(28)24-19-10-12-20(29-3)13-11-19/h4-6,8-13,16H,7,14-15,17H2,1-3H3,(H,24,28)	YZCSJBGQLATPMH-UHFFFAOYSA-N	COc1ccc(NC(=O)c2cc(OCCCN(C)C)nn2Cc3ccccc3)cc1	BroadT	BRD-K64341947	BRD-K64341947-003-01-6	Tocris Bioscience	2586	1	Cl	COc1ccc(NC(=O)c2cc(OCCCN(C)C)nn2Cc2ccccc2)cc1.Cl	InChI=1S/C23H28N4O3.ClH/c1-26(2)14-7-15-30-22-16-21(27(25-22)17-18-8-5-4-6-9-18)23(28)24-19-10-12-20(29-3)13-11-19;/h4-6,8-13,16H,7,14-15,17H2,1-3H3,(H,24,28);1H	DFVHCFCSCUCAPD-UHFFFAOYSA-N	408.216140796							93127
Moxonidine	LSM-3743	Nucynt, Norcynt, Moxonidine, Cynt, BE5895, BDF5896	4810	InChI=1S/C9H12ClN5O/c1-5-13-7(10)6(8(14-5)16-2)15-9-11-3-4-12-9/h3-4H2,1-2H3,(H2,11,12,15)	WPNJAUFVNXKLIM-UHFFFAOYSA-N	COc1nc(C)nc(Cl)c1NC2=NCCN2	BroadT	BRD-K77771411	BRD-K77771411-003-03-2	Tocris Bioscience	2282	1	Cl	COc1nc(C)nc(Cl)c1NC1=NCCN1.Cl	InChI=1S/C9H12ClN5O.ClH/c1-5-13-7(10)6(8(14-5)16-2)15-9-11-3-4-12-9;/h3-4H2,1-2H3,(H2,11,12,15);1H	ZZPAWQYZQVUVHX-UHFFFAOYSA-N	241.073037764							7009, 7009
Phosalone	LSM-25642	SID26747709, SID26753686	4793	InChI=1S/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3	IOUNQDKNJZEDEP-UHFFFAOYSA-N	CCOP(=S)(OCC)SCN1C(=O)Oc2cc(Cl)ccc12	BroadT	BRD-K71671197	BRD-K71671197-001-02-6	MicroSource Discovery Systems Inc.	330022			CCOP(=S)(OCC)SCn1c2ccc(Cl)cc2oc1=O	InChI=1S/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3	IOUNQDKNJZEDEP-UHFFFAOYSA-N	366.98686357							8121
Luzindole	LSM-3490	BRD-K67013324, SID11113752, SID26751931	122162	InChI=1S/C19H20N2O/c1-14(22)20-12-11-17-16-9-5-6-10-18(16)21-19(17)13-15-7-3-2-4-8-15/h2-10,21H,11-13H2,1H3,(H,20,22)	WVVXBPKOIZGVNS-UHFFFAOYSA-N	CC(=O)NCCc1c(Cc2ccccc2)[nH]c3ccccc13	BroadT	BRD-K67013324	BRD-K67013324-001-01-5	Tocris Bioscience	877	2		CC(=O)NCCc1c(Cc2ccccc2)[nH]c2ccccc12	InChI=1S/C19H20N2O/c1-14(22)20-12-11-17-16-9-5-6-10-18(16)21-19(17)13-15-7-3-2-4-8-15/h2-10,21H,11-13H2,1H3,(H,20,22)	WVVXBPKOIZGVNS-UHFFFAOYSA-N	292.15756328							93173, 131788
SB415286	LSM-3719	SB-415286	4210951	InChI=1S/C16H10ClN3O5/c17-10-7-8(5-6-12(10)21)18-14-13(15(22)19-16(14)23)9-3-1-2-4-11(9)20(24)25/h1-7,21H,(H2,18,19,22,23)	PQCXVIPXISBFPN-UHFFFAOYSA-N	Oc1ccc(NC2=C(C(=O)NC2=O)c3ccccc3[N+](=O)[O-])cc1Cl	BroadT	BRD-K76805682	BRD-K76805682-001-05-0	Tocris Bioscience	1617	4		Oc1ccc(NC2=C(C(=O)NC2=O)c2ccccc2[N+]([O-])=O)cc1Cl	InChI=1S/C16H10ClN3O5/c17-10-7-8(5-6-12(10)21)18-14-13(15(22)19-16(14)23)9-3-1-2-4-11(9)20(24)25/h1-7,21H,(H2,18,19,22,23)	PQCXVIPXISBFPN-UHFFFAOYSA-N	359.03089816							91107
Falnidamol	LSM-3584	Falnidamol, BRD-K70914287, BIBX-1382	6918508	InChI=1S/C18H19ClFN7/c1-27-6-4-11(5-7-27)25-18-21-9-15-16(26-18)17(23-10-22-15)24-12-2-3-14(20)13(19)8-12/h2-3,8-11H,4-7H2,1H3,(H,21,25,26)(H,22,23,24)	FTFRZXFNZVCRSK-UHFFFAOYSA-N	CN1CCC(CC1)Nc2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2	BroadT	BRD-K70914287	BRD-K70914287-300-01-0	Tocris Bioscience	2416	1	Cl.Cl	CN1CCC(CC1)Nc1ncc2ncnc(Nc3ccc(F)c(Cl)c3)c2n1.Cl.Cl	InChI=1S/C18H19ClFN7.2ClH/c1-27-6-4-11(5-7-27)25-18-21-9-15-16(26-18)17(23-10-22-15)24-12-2-3-14(20)13(19)8-12;;/h2-3,8-11H,4-7H2,1H3,(H,21,25,26)(H,22,23,24);2*1H	RFXGEKWBTCMDAW-UHFFFAOYSA-N	387.137449588							93243, 93243
Methazolamide	LSM-5311	SID26747005	4100	InChI=1S/C5H8N4O3S2/c1-3(10)7-4-9(2)8-5(13-4)14(6,11)12/h1-2H3,(H2,6,11,12)/b7-4-	FLOSMHQXBMRNHR-DAXSKMNVSA-N	CN1N=C(S/C/1=N\C(=O)C)S(=O)(=O)N	BroadT	BRD-K13356952	BRD-K13356952-001-11-1	MicroSource Discovery Systems Inc.	1503252			CC(=O)N=c1sc(nn1C)S(N)(=O)=O	InChI=1S/C5H8N4O3S2/c1-3(10)7-4-9(2)8-5(13-4)14(6,11)12/h1-2H3,(H2,6,11,12)	FLOSMHQXBMRNHR-UHFFFAOYSA-N	236.003781536							
Valeryl Salycilate	LSM-25643	SID26749356, SID29215180, Valerylsalicylic Acid	135269	InChI=1S/C12H14O4/c1-2-3-8-11(13)16-10-7-5-4-6-9(10)12(14)15/h4-7H,2-3,8H2,1H3,(H,14,15)	WJHZBTMHUNVIKC-UHFFFAOYSA-N	CCCCC(=O)Oc1ccccc1C(=O)O	BroadT	BRD-K66089377	BRD-K66089377-001-02-0	MicroSource Discovery Systems Inc.	1505336			CCCCC(=O)Oc1ccccc1C(O)=O	InChI=1S/C12H14O4/c1-2-3-8-11(13)16-10-7-5-4-6-9(10)12(14)15/h4-7H,2-3,8H2,1H3,(H,14,15)	WJHZBTMHUNVIKC-UHFFFAOYSA-N	222.089208928							78250
Tyrphostin AG-1296	LSM-3698	Tyrphostin-Ag-1296, AG-1296, Tyrphostin Ag 1296	2049	InChI=1S/C16H14N2O2/c1-19-15-8-12-13(9-16(15)20-2)18-14(10-17-12)11-6-4-3-5-7-11/h3-10H,1-2H3	QNOXYUNHIGOWNY-UHFFFAOYSA-N	COc1cc2ncc(nc2cc1OC)c3ccccc3	BroadT	BRD-K76064317	BRD-K76064317-001-04-0	Biomol International Inc.	EI303	2840(V2)-3-N1305		COc1cc2ncc(nc2cc1OC)-c1ccccc1	InChI=1S/C16H14N2O2/c1-19-15-8-12-13(9-16(15)20-2)18-14(10-17-12)11-6-4-3-5-7-11/h3-10H,1-2H3	QNOXYUNHIGOWNY-UHFFFAOYSA-N	266.105527708							93335
Acemetacin	LSM-5753	Acemetacin	1981	InChI=1S/C21H18ClNO6/c1-12-16(10-20(26)29-11-19(24)25)17-9-15(28-2)7-8-18(17)23(12)21(27)13-3-5-14(22)6-4-13/h3-9H,10-11H2,1-2H3,(H,24,25)	FSQKKOOTNAMONP-UHFFFAOYSA-N	COc1ccc2c(c1)c(CC(=O)OCC(=O)O)c(C)n2C(=O)c3ccc(Cl)cc3	BroadT	BRD-K67563174	BRD-K67563174-001-04-4	MicroSource Discovery Systems Inc.	1500666			COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)OCC(O)=O)c2c1	InChI=1S/C21H18ClNO6/c1-12-16(10-20(26)29-11-19(24)25)17-9-15(28-2)7-8-18(17)23(12)21(27)13-3-5-14(22)6-4-13/h3-9H,10-11H2,1-2H3,(H,24,25)	FSQKKOOTNAMONP-UHFFFAOYSA-N	415.082265016							31162
SPECTRUM_001972	LSM-25644	(1s,9r)-Beta-Hydrastine	6546945	InChI=1S/C21H21NO6/c1-22-7-6-11-8-15-16(27-10-26-15)9-13(11)18(22)19-12-4-5-14(24-2)20(25-3)17(12)21(23)28-19/h4-5,8-9,18-19H,6-7,10H2,1-3H3/t18-,19-/m0/s1	JZUTXVTYJDCMDU-OALUTQOASA-N	COc1ccc2[C@H](OC(=O)c2c1OC)[C@H]3N(C)CCc4cc5OCOc5cc34	BroadT	BRD-K61271364	BRD-K61271364-001-02-4	MicroSource Discovery Systems Inc.	1500687			COc1ccc2[C@H](OC(=O)c2c1OC)[C@H]1N(C)CCc2cc3OCOc3cc12	InChI=1S/C21H21NO6/c1-22-7-6-11-8-15-16(27-10-26-15)9-13(11)18(22)19-12-4-5-14(24-2)20(25-3)17(12)21(23)28-19/h4-5,8-9,18-19H,6-7,10H2,1-3H3/t18-,19-/m0/s1	JZUTXVTYJDCMDU-OALUTQOASA-N	383.136887402							114193
NB-Acetyltryptamine	LSM-3653	N-Acetyltryptamine3-(2-N-Acetylaminoethyl)Indole, N-Acetyltryptamine, BRD-K73700643	70547	InChI=1S/C12H14N2O/c1-9(15)13-7-6-10-8-14-12-5-3-2-4-11(10)12/h2-5,8,14H,6-7H2,1H3,(H,13,15)	NVUGEQAEQJTCIX-UHFFFAOYSA-N	CC(=O)NCCc1c[nH]c2ccccc12	BroadT	BRD-K73700643	BRD-K73700643-001-01-3	AnalytiCon Discovery GmbH	NP-003067			CC(=O)NCCc1c[nH]c2ccccc12	InChI=1S/C12H14N2O/c1-9(15)13-7-6-10-8-14-12-5-3-2-4-11(10)12/h2-5,8,14H,6-7H2,1H3,(H,13,15)	NVUGEQAEQJTCIX-UHFFFAOYSA-N	202.110613088							55515
Methoxsalen	LSM-3410	8-Methoxypsoralen, 8-MOP, Oxsoralen, Methoxsalen, Uvadex, Xanthotoxin, Oxsoralen-Ultra	4114	InChI=1S/C12H8O4/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12/h2-6H,1H3	QXKHYNVANLEOEG-UHFFFAOYSA-N	COc1c2OC(=O)C=Cc2cc3ccoc13	BroadT	BRD-K63430059	BRD-K63430059-001-03-2	AnalytiCon Discovery GmbH	NP-000271			COc1c2occc2cc2ccc(=O)oc12	InChI=1S/C12H8O4/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12/h2-6H,1H3	QXKHYNVANLEOEG-UHFFFAOYSA-N	216.042258736							18358
Staurosporine Aglycon	LSM-3627	BRD-K72726508, Arcyriaflavin A	5327723	InChI=1S/C20H11N3O2/c24-19-15-13-9-5-1-3-7-11(9)21-17(13)18-14(16(15)20(25)23-19)10-6-2-4-8-12(10)22-18/h1-8,21-22H,(H,23,24,25)	KAJXOWFGKYKMMZ-UHFFFAOYSA-N	O=C1NC(=O)c2c1c3c4ccccc4[nH]c3c5[nH]c6ccccc6c25	BroadT	BRD-K72726508	BRD-K72726508-001-01-3	Tocris Bioscience	2457	1		O=C1NC(=O)c2c1c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21	InChI=1S/C20H11N3O2/c24-19-15-13-9-5-1-3-7-11(9)21-17(13)18-14(16(15)20(25)23-19)10-6-2-4-8-12(10)22-18/h1-8,21-22H,(H,23,24,25)	KAJXOWFGKYKMMZ-UHFFFAOYSA-N	325.085126622							93276
Cilostazol	LSM-3491	Cilostazol, Pletal, OPC-13013, OPC-21	2754	InChI=1S/C20H27N5O2/c26-20-12-9-15-14-17(10-11-18(15)21-20)27-13-5-4-8-19-22-23-24-25(19)16-6-2-1-3-7-16/h10-11,14,16H,1-9,12-13H2,(H,21,26)	RRGUKTPIGVIEKM-UHFFFAOYSA-N	O=C1CCc2cc(OCCCCc3nnnn3C4CCCCC4)ccc2N1	BroadT	BRD-K67017579	BRD-K67017579-001-13-3	Tocris Bioscience	1692	1		O=C1CCc2cc(OCCCCc3nnnn3C3CCCCC3)ccc2N1	InChI=1S/C20H27N5O2/c26-20-12-9-15-14-17(10-11-18(15)21-20)27-13-5-4-8-19-22-23-24-25(19)16-6-2-1-3-7-16/h10-11,14,16H,1-9,12-13H2,(H,21,26)	RRGUKTPIGVIEKM-UHFFFAOYSA-N	369.216475154							31401
4'-Methoxyflavone	LSM-25645	4'-Methoxyflavone, 4-Methoxy Flavone, BRD-K76337122	77793	InChI=1S/C16H12O3/c1-18-12-8-6-11(7-9-12)16-10-14(17)13-4-2-3-5-15(13)19-16/h2-10H,1H3	OMICQBVLCVRFGN-UHFFFAOYSA-N	COc1ccc(cc1)C2=CC(=O)c3ccccc3O2	BroadT	BRD-K76337122	BRD-K76337122-001-02-9	AnalytiCon Discovery GmbH	NP-010655			COc1ccc(cc1)-c1cc(=O)c2ccccc2o1	InChI=1S/C16H12O3/c1-18-12-8-6-11(7-9-12)16-10-14(17)13-4-2-3-5-15(13)19-16/h2-10H,1H3	OMICQBVLCVRFGN-UHFFFAOYSA-N	252.078644244							114194
Cinchophen	LSM-25646	Cinchophen, Phenylcinchoninic Acid	8593	InChI=1S/C16H11NO2/c18-16(19)13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-10H,(H,18,19)	YTRMTPPVNRALON-UHFFFAOYSA-N	OC(=O)c1cc(nc2ccccc12)c3ccccc3	BroadT	BRD-K72915123	BRD-K72915123-001-01-7	TimTec LLC	ST013890			OC(=O)c1cc(nc2ccccc12)-c1ccccc1	InChI=1S/C16H11NO2/c18-16(19)13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-10H,(H,18,19)	YTRMTPPVNRALON-UHFFFAOYSA-N	249.078978602							114195
Imatinib	LSM-1023	Imatinib, Gleevec, STI-571	5291	InChI=1S/C29H31N7O/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34)	KTUFNOKKBVMGRW-UHFFFAOYSA-N	CN1CCN(Cc2ccc(cc2)C(=O)Nc3ccc(C)c(Nc4nccc(n4)c5cccnc5)c3)CC1	BroadT	BRD-K92723993	BRD-K92723993-066-02-9	International Laboratory USA	3524741		CS(=O)(=O)O	CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1.CS(=O)(=O)O	InChI=1S/C29H31N7O.CH4O3S/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36;1-5(2,3)4/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34);1H3,(H,2,3,4)	YLMAHDNUQAMNNX-UHFFFAOYSA-N	493.259008682							45783, 45783, 45783
Derrustone	LSM-25647	Derrustone	629853	InChI=1S/C18H14O6/c1-20-11-6-15(21-2)17-16(7-11)22-8-12(18(17)19)10-3-4-13-14(5-10)24-9-23-13/h3-8H,9H2,1-2H3	IMPPSJRGMZYGJW-UHFFFAOYSA-N	COc1cc(OC)c2C(=O)C(=COc2c1)c3ccc4OCOc4c3	BroadT	BRD-K72135530	BRD-K72135530-001-02-7	MicroSource Discovery Systems Inc.	1401419			COc1cc(OC)c2c(c1)occ(-c1ccc3OCOc3c1)c2=O	InChI=1S/C18H14O6/c1-20-11-6-15(21-2)17-16(7-11)22-8-12(18(17)19)10-3-4-13-14(5-10)24-9-23-13/h3-8H,9H2,1-2H3	IMPPSJRGMZYGJW-UHFFFAOYSA-N	326.079038168							114196
Acetosyringone	LSM-25648	Acetosyringone	17198	InChI=1S/C10H12O4/c1-6(11)7-4-8(13-2)10(12)9(5-7)14-3/h4-5,12H,1-3H3	OJOBTAOGJIWAGB-UHFFFAOYSA-N	COc1cc(cc(OC)c1O)C(=O)C	BroadT	BRD-K66643401	BRD-K66643401-001-02-4	MicroSource Discovery Systems Inc.	300610			COc1cc(cc(OC)c1O)C(C)=O	InChI=1S/C10H12O4/c1-6(11)7-4-8(13-2)10(12)9(5-7)14-3/h4-5,12H,1-3H3	OJOBTAOGJIWAGB-UHFFFAOYSA-N	196.073558864							2404
Ferulic acid	LSM-44126	Ferulic Acid	445858	InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+	KSEBMYQBYZTDHS-HWKANZROSA-N	COc1cc(\C=C\C(=O)O)ccc1O	BroadT	BRD-K66295376	BRD-K66295376-001-02-4	MicroSource Discovery Systems Inc.	1501017			COc1cc(\C=C\C(O)=O)ccc1O	InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+	KSEBMYQBYZTDHS-HWKANZROSA-N	194.0579088							17620
Tyrphostin AG-1478	LSM-1224	AG-1478, Tyrphostin-Ag-1478	2051	InChI=1S/C16H14ClN3O2/c1-21-14-7-12-13(8-15(14)22-2)18-9-19-16(12)20-11-5-3-4-10(17)6-11/h3-9H,1-2H3,(H,18,19,20)	GFNNBHLJANVSQV-UHFFFAOYSA-N	COc1cc2ncnc(Nc3cccc(Cl)c3)c2cc1OC	BroadT	BRD-K68336408	BRD-K68336408-001-03-4	Broad Institute of MIT and Harvard	AG-1478			COc1cc2ncnc(Nc3cccc(Cl)c3)c2cc1OC	InChI=1S/C16H14ClN3O2/c1-21-14-7-12-13(8-15(14)22-2)18-9-19-16(12)20-11-5-3-4-10(17)6-11/h3-9H,1-2H3,(H,18,19,20)	GFNNBHLJANVSQV-UHFFFAOYSA-N	315.077454428							75404, 75404
Acdpp	LSM-15382	BRD-K68633617	16759169	InChI=1S/C12H13ClN6O/c1-19(2)11-9(13)17-8(10(14)18-11)12(20)16-7-4-3-5-15-6-7/h3-6H,1-2H3,(H2,14,18)(H,16,20)	RNGRUHWJJPTYNR-UHFFFAOYSA-N	CN(C)c1nc(N)c(nc1Cl)C(=O)Nc2cccnc2	BroadT	BRD-K68633617	BRD-K68633617-003-01-1	Tocris Bioscience	2254	1	Cl	CN(C)c1nc(N)c(nc1Cl)C(=O)Nc1cccnc1.Cl	InChI=1S/C12H13ClN6O.ClH/c1-19(2)11-9(13)17-8(10(14)18-11)12(20)16-7-4-3-5-15-6-7;/h3-6H,1-2H3,(H2,14,18)(H,16,20);1H	CXIHLPLRTFPHKX-UHFFFAOYSA-N	292.083936806							104024, 104024
Icariin	LSM-3462	Icariin	5318997	InChI=1S/C33H40O15/c1-13(2)5-10-17-19(45-33-28(42)26(40)23(37)20(12-34)46-33)11-18(35)21-24(38)31(48-32-27(41)25(39)22(36)14(3)44-32)29(47-30(17)21)15-6-8-16(43-4)9-7-15/h5-9,11,14,20,22-23,25-28,32-37,39-42H,10,12H2,1-4H3/t14-,20+,22-,23+,25+,26-,27+,28+,32-,33+/m0/s1	TZJALUIVHRYQQB-XLRXWWTNSA-N	COc1ccc(cc1)C2=C(O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)C(=O)c4c(O)cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(CC=C(C)C)c4O2	BroadT	BRD-K65639003	BRD-K65639003-001-02-5	MicroSource Discovery Systems Inc.	1505257			COc1ccc(cc1)-c1oc2c(CC=C(C)C)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c2c(=O)c1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O	InChI=1S/C33H40O15/c1-13(2)5-10-17-19(45-33-28(42)26(40)23(37)20(12-34)46-33)11-18(35)21-24(38)31(48-32-27(41)25(39)22(36)14(3)44-32)29(47-30(17)21)15-6-8-16(43-4)9-7-15/h5-9,11,14,20,22-23,25-28,32-37,39-42H,10,12H2,1-4H3/t14-,20+,22-,23+,25+,26-,27+,28+,32-,33+/m0/s1	TZJALUIVHRYQQB-XLRXWWTNSA-N	676.23672058							78420
KBIO2_003002	LSM-3362	BRD-K61220632	3310692	InChI=1S/C20H18Cl2O7/c1-7-10-17(13(22)18(26-5)12(7)21)28-15-8(2)11(19(23)27-6)14(25-4)9(3)16(15)29-20(10)24/h1-6H3	PDTLWAZKMKQSLD-UHFFFAOYSA-N	COC(=O)c1c(C)c2Oc3c(Cl)c(OC)c(Cl)c(C)c3C(=O)Oc2c(C)c1OC	BroadT	BRD-K61220632	BRD-K61220632-001-02-7	MicroSource Discovery Systems Inc.	241150			COC(=O)c1c(C)c2Oc3c(Cl)c(OC)c(Cl)c(C)c3C(=O)Oc2c(C)c1OC	InChI=1S/C20H18Cl2O7/c1-7-10-17(13(22)18(26-5)12(7)21)28-15-8(2)11(19(23)27-6)14(25-4)9(3)16(15)29-20(10)24/h1-6H3	PDTLWAZKMKQSLD-UHFFFAOYSA-N	440.042958336							93071
Cytisine	LSM-25650		10235	InChI=1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2/t8-,9+/m0/s1	ANJTVLIZGCUXLD-DTWKUNHWSA-N	O=C1C=CC=C2[C@H]3CNC[C@H](C3)CN12	BroadT	BRD-K74186897	BRD-K74186897-001-02-5	Prestwick Chemical Inc.	Prestw-624	D0701-MP04-ST03-200-		O=c1cccc2[C@H]3CNC[C@H](C3)Cn12	InChI=1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2/t8-,9+/m0/s1	ANJTVLIZGCUXLD-DTWKUNHWSA-N	190.110613088							4055
CGS 20625	LSM-3520	SID29215553, BRD-K68103045	163844	InChI=1S/C18H19N3O2/c1-23-13-9-7-12(8-10-13)21-18(22)15-11-19-16-6-4-2-3-5-14(16)17(15)20-21/h7-11,19H,2-6H2,1H3	XRUUVUYJUULCBQ-UHFFFAOYSA-N	COc1ccc(cc1)N2N=C3C4=C(CCCCC4)NC=C3C2=O	BroadT	BRD-K68103045	BRD-K68103045-001-01-1	Tocris Bioscience	2467	1		COc1ccc(cc1)-n1nc2c3CCCCCc3[nH]cc2c1=O	InChI=1S/C18H19N3O2/c1-23-13-9-7-12(8-10-13)21-18(22)15-11-19-16-6-4-2-3-5-14(16)17(15)20-21/h7-11,19H,2-6H2,1H3	XRUUVUYJUULCBQ-UHFFFAOYSA-N	309.147726878							
Purmorphamine	LSM-3649	Purmorphamine	5284329	InChI=1S/C31H32N6O2/c1-2-9-25(10-3-1)37-21-32-28-29(33-23-13-15-24(16-14-23)36-17-19-38-20-18-36)34-31(35-30(28)37)39-27-12-6-8-22-7-4-5-11-26(22)27/h4-8,11-16,21,25H,1-3,9-10,17-20H2,(H,33,34,35)	FYBHCRQFSFYWPY-UHFFFAOYSA-N	C1CCC(CC1)n2cnc3c(Nc4ccc(cc4)N5CCOCC5)nc(Oc6cccc7ccccc67)nc23	BroadT	BRD-K73397362	BRD-K73397362-001-01-7	Calbiochem	540220			C1CCC(CC1)n1cnc2c(Nc3ccc(cc3)N3CCOCC3)nc(Oc3cccc4ccccc34)nc12	InChI=1S/C31H32N6O2/c1-2-9-25(10-3-1)37-21-32-28-29(33-23-13-15-24(16-14-23)36-17-19-38-20-18-36)34-31(35-30(28)37)39-27-12-6-8-22-7-4-5-11-26(22)27/h4-8,11-16,21,25H,1-3,9-10,17-20H2,(H,33,34,35)	FYBHCRQFSFYWPY-UHFFFAOYSA-N	520.258674324							63053
Etazolate	LSM-3446	Etazolate, SQ-20009	3277	InChI=1S/C14H19N5O2/c1-5-19-13-10(8-16-19)12(18-17-9(3)4)11(7-15-13)14(20)21-6-2/h7-8H,5-6H2,1-4H3,(H,15,18)	OPQRBXUBWHDHPQ-UHFFFAOYSA-N	CCOC(=O)c1cnc2c(cnn2CC)c1NN=C(C)C	BroadT	BRD-K64755930	BRD-K64755930-003-01-6	Calbiochem	331500		Cl	CCOC(=O)c1cnc2n(CC)ncc2c1NN=C(C)C.Cl	InChI=1S/C14H19N5O2.ClH/c1-5-19-13-10(8-16-19)12(18-17-9(3)4)11(7-15-13)14(20)21-6-2;/h7-8H,5-6H2,1-4H3,(H,15,18);1H	GQJUGJHJUZSJLZ-UHFFFAOYSA-N	289.153874898							93135, 93135
Sulfadimethoxine	LSM-5790	Madribon, Sulfadimethoxine, Sulphadimethoxine	5323	InChI=1S/C12H14N4O4S/c1-19-11-7-10(14-12(15-11)20-2)16-21(17,18)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H,14,15,16)	ZZORFUFYDOWNEF-UHFFFAOYSA-N	COc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(OC)n1	BroadT	BRD-K71125014	BRD-K71125014-001-03-2	ChemBridge Corporation	5251398			COc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(OC)n1	InChI=1S/C12H14N4O4S/c1-19-11-7-10(14-12(15-11)20-2)16-21(17,18)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H,14,15,16)	ZZORFUFYDOWNEF-UHFFFAOYSA-N	310.073575658							32161, 32161
DY131	LSM-3385	BRD-K62353524	644030	InChI=1S/C18H21N3O2/c1-3-21(4-2)16-9-5-14(6-10-16)13-19-20-18(23)15-7-11-17(22)12-8-15/h5-13,22H,3-4H2,1-2H3,(H,20,23)	WLKOCYWYAWBGKY-UHFFFAOYSA-N	CCN(CC)c1ccc(C=NNC(=O)c2ccc(O)cc2)cc1	BroadT	BRD-K62353524	BRD-K62353524-001-01-8	Tocris Bioscience	2266	1		CCN(CC)c1ccc(C=NNC(=O)c2ccc(O)cc2)cc1	InChI=1S/C18H21N3O2/c1-3-21(4-2)16-9-5-14(6-10-16)13-19-20-18(23)15-7-11-17(22)12-8-15/h5-13,22H,3-4H2,1-2H3,(H,20,23)	WLKOCYWYAWBGKY-UHFFFAOYSA-N	311.163376942							93087
Homopterocarpin	LSM-25651	3,9-Dimethoxypterocarpan	101795	InChI=1S/C17H16O4/c1-18-10-4-6-13-15(7-10)20-9-14-12-5-3-11(19-2)8-16(12)21-17(13)14/h3-8,14,17H,9H2,1-2H3/t14-,17-/m0/s1	VPGIGLKLCFOWDN-YOEHRIQHSA-N	COc1ccc2[C@@H]3Oc4cc(OC)ccc4[C@@H]3COc2c1	BroadT	BRD-K71093375	BRD-K71093375-001-02-7	MicroSource Discovery Systems Inc.	100743			COc1ccc2[C@@H]3COc4cc(OC)ccc4[C@@H]3Oc2c1	InChI=1S/C17H16O4/c1-18-10-4-6-13-15(7-10)20-9-14-12-5-3-11(19-2)8-16(12)21-17(13)14/h3-8,14,17H,9H2,1-2H3/t14-,17-/m0/s1	VPGIGLKLCFOWDN-YOEHRIQHSA-N	284.104858992							114197
PD-98059	LSM-3394	PD-98059, PD 98059, PD 98059	4713	InChI=1S/C16H13NO3/c1-19-14-8-4-6-11(16(14)17)15-9-12(18)10-5-2-3-7-13(10)20-15/h2-9H,17H2,1H3	QFWCYNPOPKQOKV-UHFFFAOYSA-N	COc1cccc(C2=CC(=O)c3ccccc3O2)c1N	BroadT	BRD-K62810658	BRD-K62810658-001-05-6	Biomol International Inc.	EI-360	2840(V2)-3-N1305		COc1cccc(-c2cc(=O)c3ccccc3o2)c1N	InChI=1S/C16H13NO3/c1-19-14-8-4-6-11(16(14)17)15-9-12(18)10-5-2-3-7-13(10)20-15/h2-9H,17H2,1H3	QFWCYNPOPKQOKV-UHFFFAOYSA-N	267.089543286							77954
Brimonidine	LSM-3526	Brimonidine, BRD-K68264559, UK-14304	2435	InChI=1S/C11H10BrN5/c12-9-7(17-11-15-5-6-16-11)1-2-8-10(9)14-4-3-13-8/h1-4H,5-6H2,(H2,15,16,17)	XYLJNLCSTIOKRM-UHFFFAOYSA-N	Brc1c(NC2=NCCN2)ccc3nccnc13	BroadT	BRD-K68264559	BRD-K68264559-001-07-6	Tocris Bioscience	425	2		Brc1c(NC2=NCCN2)ccc2nccnc12	InChI=1S/C11H10BrN5/c12-9-7(17-11-15-5-6-16-11)1-2-8-10(9)14-4-3-13-8/h1-4H,5-6H2,(H2,15,16,17)	XYLJNLCSTIOKRM-UHFFFAOYSA-N	291.01195797							3175, 3175
Phenylacetohydroxamic acid	LSM-3659	SID26749159	220184	InChI=1S/C8H9NO2/c10-8(9-11)6-7-4-2-1-3-5-7/h1-5,11H,6H2,(H,9,10)	FPOQLQZHRCEVOT-UHFFFAOYSA-N	ONC(=O)Cc1ccccc1	BroadT	BRD-K74112339	BRD-K74112339-001-02-7	MicroSource Discovery Systems Inc.	210031			ONC(=O)Cc1ccccc1	InChI=1S/C8H9NO2/c10-8(9-11)6-7-4-2-1-3-5-7/h1-5,11H,6H2,(H,9,10)	FPOQLQZHRCEVOT-UHFFFAOYSA-N	151.063328538							93303
Procainamide	LSM-3681	Pronestyl, Procapan, Procanbid, Procan, Procainamide, Pronestyl-SR	4913	InChI=1S/C13H21N3O/c1-3-16(4-2)10-9-15-13(17)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H3,(H,15,17)	REQCZEXYDRLIBE-UHFFFAOYSA-N	CCN(CC)CCNC(=O)c1ccc(N)cc1	BroadT	BRD-K75089421	BRD-K75089421-001-02-5	Biomol International Inc.	AC-127	2840(V2)-3-N1305		CCN(CC)CCNC(=O)c1ccc(N)cc1	InChI=1S/C13H21N3O/c1-3-16(4-2)10-9-15-13(17)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H3,(H,15,17)	REQCZEXYDRLIBE-UHFFFAOYSA-N	235.168462322							8428, 8428
Iodoquinol	LSM-25652	Diiodohydroxyquinoline, Diiodohydroxyquin, Iodoquinol, Ioquin, Quinadome, Yodoxin	3728	InChI=1S/C9H5I2NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H	UXZFQZANDVDGMM-UHFFFAOYSA-N	Oc1c(I)cc(I)c2cccnc12	BroadT	BRD-K75855670	BRD-K75855670-001-02-7	MicroSource Discovery Systems Inc.	1500353			Oc1c(I)cc(I)c2cccnc12	InChI=1S/C9H5I2NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H	UXZFQZANDVDGMM-UHFFFAOYSA-N	396.84604979							5950
(+)-Uh-232	LSM-25653	(+)-Uh 232, UH-232	6604756	InChI=1S/C18H29NO/c1-5-12-19(13-6-2)17-11-10-16-15(14(17)3)8-7-9-18(16)20-4/h7-9,14,17H,5-6,10-13H2,1-4H3/t14-,17+/m0/s1	BTOJYCTUJJHANF-WMLDXEAASA-N	CCCN(CCC)[C@@H]1CCc2c(OC)cccc2[C@@H]1C	BroadT	BRD-K66715657	BRD-K66715657-001-01-3	Biomol International Inc.	AC-260	2812-3-N1298		CCCN(CCC)[C@@H]1CCc2c(OC)cccc2[C@@H]1C	InChI=1S/C18H29NO/c1-5-12-19(13-6-2)17-11-10-16-15(14(17)3)8-7-9-18(16)20-4/h7-9,14,17H,5-6,10-13H2,1-4H3/t14-,17+/m0/s1	BTOJYCTUJJHANF-WMLDXEAASA-N	275.224914558							114198, 114198
Fluticasone Propionate	LSM-3384	Flovent, Fluticasone, Flonase, Cutivate, Flovent Diskus 250, Flovent Diskus 100, Flovent Diskus 50, CCI-18781, Flovent HFA, Fluticasone Propionate	444036	InChI=1S/C25H31F3O5S/c1-5-20(31)33-25(21(32)34-12-26)13(2)8-15-16-10-18(27)17-9-14(29)6-7-22(17,3)24(16,28)19(30)11-23(15,25)4/h6-7,9,13,15-16,18-19,30H,5,8,10-12H2,1-4H3/t13-,15+,16+,18+,19+,22+,23+,24+,25+/m1/s1	WMWTYOKRWGGJOA-CENSZEJFSA-N	CCC(=O)O[C@@]1([C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)SCF	BroadT	BRD-K62310379	BRD-K62310379-001-03-0	Prestwick Chemical Inc.	Prestw-997	D0701-MP04-ST03-200-		CCC(=O)O[C@@]1([C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)SCF	InChI=1S/C25H31F3O5S/c1-5-20(31)33-25(21(32)34-12-26)13(2)8-15-16-10-18(27)17-9-14(29)6-7-22(17,3)24(16,28)19(30)11-23(15,25)4/h6-7,9,13,15-16,18-19,30H,5,8,10-12H2,1-4H3/t13-,15+,16+,18+,19+,22+,23+,24+,25+/m1/s1	WMWTYOKRWGGJOA-CENSZEJFSA-N	500.184429382							31441
Quipazine	LSM-3747	Quipazine	5011	InChI=1S/C13H15N3/c1-2-4-12-11(3-1)5-6-13(15-12)16-9-7-14-8-10-16/h1-6,14H,7-10H2	XRXDAJYKGWNHTQ-UHFFFAOYSA-N	C1CN(CCN1)c2ccc3ccccc3n2	BroadT	BRD-K77925998	BRD-K77925998-001-01-3	Biomol International Inc.	NS-780	2813-N1283		C1CN(CCN1)c1ccc2ccccc2n1	InChI=1S/C13H15N3/c1-2-4-12-11(3-1)5-6-13(15-12)16-9-7-14-8-10-16/h1-6,14H,7-10H2	XRXDAJYKGWNHTQ-UHFFFAOYSA-N	213.12659751							93368, 93368, 93368
Picotamide	LSM-3497	Picotamide	4814	InChI=1S/C21H20N4O3/c1-28-19-7-6-17(20(26)24-13-15-4-2-8-22-11-15)10-18(19)21(27)25-14-16-5-3-9-23-12-16/h2-12H,13-14H2,1H3,(H,24,26)(H,25,27)	KYWCWBXGRWWINE-UHFFFAOYSA-N	COc1ccc(cc1C(=O)NCc2cccnc2)C(=O)NCc3cccnc3	BroadT	BRD-K67277431	BRD-K67277431-002-03-0	Prestwick Chemical Inc.	Prestw-119	D0701-MP04-ST03-200-	O	COc1ccc(cc1C(=O)NCc1cccnc1)C(=O)NCc1cccnc1.O	InChI=1S/C21H20N4O3.H2O/c1-28-19-7-6-17(20(26)24-13-15-4-2-8-22-11-15)10-18(19)21(27)25-14-16-5-3-9-23-12-16;/h2-12H,13-14H2,1H3,(H,24,26)(H,25,27);1H2	ICYQAMNVLLHURR-UHFFFAOYSA-N	376.15354054							93175, 93175
Tomelukast	LSM-3675	Tomelukast, LY-171833, LY-171883	3969	InChI=1S/C16H22N4O3/c1-3-6-13-14(9-8-12(11(2)21)16(13)22)23-10-5-4-7-15-17-19-20-18-15/h8-9,22H,3-7,10H2,1-2H3,(H,17,18,19,20)	MWYHLEQJTQJHSS-UHFFFAOYSA-N	CCCc1c(O)c(ccc1OCCCCc2nnn[nH]2)C(=O)C	BroadT	BRD-K74765201	BRD-K74765201-001-01-9	MicroSource Discovery Systems Inc.	1502049			CCCc1c(OCCCCc2nnn[nH]2)ccc(C(C)=O)c1O	InChI=1S/C16H22N4O3/c1-3-6-13-14(9-8-12(11(2)21)16(13)22)23-10-5-4-7-15-17-19-20-18-15/h8-9,22H,3-7,10H2,1-2H3,(H,17,18,19,20)	MWYHLEQJTQJHSS-UHFFFAOYSA-N	318.169190604							75310
Norcyclobenzaprine	LSM-3403	SID11112319, SID56463056	9918	InChI=1S/C19H19N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-13,20H,6,14H2,1H3	XECQQDXTQRYYBH-UHFFFAOYSA-N	CNCCC=C1c2ccccc2C=Cc3ccccc13	BroadT	BRD-K63165456	BRD-K63165456-001-03-3	Prestwick Chemical Inc.	Prestw-513	D0701-MP04-ST03-200-		CNCCC=C1c2ccccc2C=Cc2ccccc12	InChI=1S/C19H19N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-13,20H,6,14H2,1H3	XECQQDXTQRYYBH-UHFFFAOYSA-N	261.151749618							93101
CGP-7930	LSM-3466	BRD-K65786282, CGP-7930	5024764	InChI=1S/C19H32O2/c1-17(2,3)14-9-13(11-19(7,8)12-20)10-15(16(14)21)18(4,5)6/h9-10,20-21H,11-12H2,1-8H3	XLWJPQQFJNGUPA-UHFFFAOYSA-N	CC(C)(C)c1cc(CC(C)(C)CO)cc(c1O)C(C)(C)C	BroadT	BRD-K65786282	BRD-K65786282-001-02-6	Tocris Bioscience	1513	2		CC(C)(CO)Cc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C	InChI=1S/C19H32O2/c1-17(2,3)14-9-13(11-19(7,8)12-20)10-15(16(14)21)18(4,5)6/h9-10,20-21H,11-12H2,1-8H3	XLWJPQQFJNGUPA-UHFFFAOYSA-N	292.240230264							93152
Thioperamide	LSM-3426	BRD-K63874012	3035905	InChI=1S/C15H24N4S/c20-15(18-13-4-2-1-3-5-13)19-8-6-12(7-9-19)14-10-16-11-17-14/h10-13H,1-9H2,(H,16,17)(H,18,20)	QKDDJDBFONZGBW-UHFFFAOYSA-N	S=C(NC1CCCCC1)N2CCC(CC2)c3c[nH]cn3	BroadT	BRD-K63874012	BRD-K63874012-103-01-5	Tocris Bioscience	644	12	OC(=O)C=CC(=O)O	S=C(NC1CCCCC1)N1CCC(CC1)c1c[nH]cn1.OC(=O)C=CC(=O)O	InChI=1S/C15H24N4S.C4H4O4/c20-15(18-13-4-2-1-3-5-13)19-8-6-12(7-9-19)14-10-16-11-17-14;5-3(6)1-2-4(7)8/h10-13H,1-9H2,(H,16,17)(H,18,20);1-2H,(H,5,6)(H,7,8)	WUYMIKDBRCCYGE-UHFFFAOYSA-N	292.172167498							81391, 81391
CI-966	LSM-3509	BRD-K67680372, CI-966	198693	InChI=1S/C23H21F6NO3/c24-22(25,26)18-7-3-15(4-8-18)20(16-5-9-19(10-6-16)23(27,28)29)33-13-12-30-11-1-2-17(14-30)21(31)32/h2-10,20H,1,11-14H2,(H,31,32)	CMHQDSBIBSKHFP-UHFFFAOYSA-N	OC(=O)C1=CCCN(CCOC(c2ccc(cc2)C(F)(F)F)c3ccc(cc3)C(F)(F)F)C1	BroadT	BRD-K67680372	BRD-K67680372-003-01-8	Tocris Bioscience	1296	1	Cl	OC(=O)C1=CCCN(CCOC(c2ccc(cc2)C(F)(F)F)c2ccc(cc2)C(F)(F)F)C1.Cl	InChI=1S/C23H21F6NO3.ClH/c24-22(25,26)18-7-3-15(4-8-18)20(16-5-9-19(10-6-16)23(27,28)29)33-13-12-30-11-1-2-17(14-30)21(31)32;/h2-10,20H,1,11-14H2,(H,31,32);1H	NUQWSOWKRTZJTO-UHFFFAOYSA-N	473.142562742							93185, 93185
Fasudil	LSM-3715	Fasudil, AT-877, HA-1077, ZK-258594	3547	InChI=1S/C14H17N3O2S/c18-20(19,17-9-2-6-15-8-10-17)14-4-1-3-12-11-16-7-5-13(12)14/h1,3-5,7,11,15H,2,6,8-10H2	NGOGFTYYXHNFQH-UHFFFAOYSA-N	O=S(=O)(N1CCCNCC1)c2cccc3cnccc23	BroadT	BRD-K76617868	BRD-K76617868-001-02-2	LC Laboratories	H-2330			O=S(=O)(N1CCCNCC1)c1cccc2cnccc12	InChI=1S/C14H17N3O2S/c18-20(19,17-9-2-6-15-8-10-17)14-4-1-3-12-11-16-7-5-13(12)14/h1,3-5,7,11,15H,2,6,8-10H2	NGOGFTYYXHNFQH-UHFFFAOYSA-N	291.104147504							, 
Isotretinoin	LSM-42855		5282379	InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8+,16-14-	SHGAZHPCJJPHSC-XFYACQKRSA-N	C\C(=C/C=C/C(=C\C(=O)O)/C)\C=C\C1=C(C)CCCC1(C)C	BroadT	BRD-K76723084	BRD-K76723084-001-05-9	Biomol International Inc.	GR102	2840(V2)-3-N1305		CC(/C=C/C1=C(C)CCCC1(C)C)=C\C=C\C(C)=C/C(O)=O	InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8+,16-14-	SHGAZHPCJJPHSC-XFYACQKRSA-N	300.208930136							6067
Metoclopramide	LSM-3689	"Reglan, Metoclopramide, Maxolon, Clopra, ""Clopra-""""""""""""""""""""""""""""""""Yellow"""""""""""""""""""""""""""""""""""	4168	InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)	TTWJBBZEZQICBI-UHFFFAOYSA-N	CCN(CC)CCNC(=O)c1cc(Cl)c(N)cc1OC	BroadT	BRD-K75641298	BRD-K75641298-001-01-5	Biomol International Inc.	AC-840	2812-3-N1298		CCN(CC)CCNC(=O)c1cc(Cl)c(N)cc1OC	InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)	TTWJBBZEZQICBI-UHFFFAOYSA-N	299.140054684							107736, 107736, 107736
Ivachtin	LSM-3438	SID50112944, SID137275823, BRD-K64402243	11201705	InChI=1S/C20H21N3O7S/c1-12-17-18(20(26)23(19(17)25)7-10-30-13(2)24)15-11-14(3-4-16(15)21-12)31(27,28)22-5-8-29-9-6-22/h3-4,11H,5-10H2,1-2H3	MWXJJTMEUGWKKY-UHFFFAOYSA-N	CC(=O)OCCN1C(=O)c2c(C)nc3ccc(cc3c2C1=O)S(=O)(=O)N4CCOCC4	BroadT	BRD-K64402243	BRD-K64402243-001-01-1	Tocris Bioscience	2636	1		CC(=O)OCCN1C(=O)c2c(C1=O)c1cc(ccc1nc2C)S(=O)(=O)N1CCOCC1	InChI=1S/C20H21N3O7S/c1-12-17-18(20(26)23(19(17)25)7-10-30-13(2)24)15-11-14(3-4-16(15)21-12)31(27,28)22-5-8-29-9-6-22/h3-4,11H,5-10H2,1-2H3	MWXJJTMEUGWKKY-UHFFFAOYSA-N	447.110020732							93128
Proxyfan	LSM-3732	BRD-K77171813	6421522	InChI=1S/C13H16N2O/c1-2-5-12(6-3-1)10-16-8-4-7-13-9-14-11-15-13/h1-3,5-6,9,11H,4,7-8,10H2,(H,14,15)	WNWALBVQAAIULR-UHFFFAOYSA-N	C(COCc1ccccc1)Cc2cnc[nH]2	BroadT	BRD-K77171813	BRD-K77171813-050-01-4	Tocris Bioscience	2477	1	OC(=O)/C=C\C(=O)O	C(COCc1ccccc1)Cc1cnc[nH]1.OC(=O)/C=C\C(=O)O	InChI=1S/C13H16N2O.C4H4O4/c1-2-5-12(6-3-1)10-16-8-4-7-13-9-14-11-15-13;5-3(6)1-2-4(7)8/h1-3,5-6,9,11H,4,7-8,10H2,(H,14,15);1-2H,(H,5,6)(H,7,8)/b;2-1-	JQCZPVBHMZGGAV-BTJKTKAUSA-N	216.126263152							93359, 93359
Benzylamine	LSM-3700	Aminotoluene, Benzylamine, BRD-K76133116	7504	InChI=1S/C7H9N/c8-6-7-4-2-1-3-5-7/h1-5H,6,8H2	WGQKYBSKWIADBV-UHFFFAOYSA-N	NCc1ccccc1	BroadT	BRD-K76133116	BRD-K76133116-001-01-2	Harvard University	DHPC8_BuildingBlockC04			NCc1ccccc1	InChI=1S/C7H9N/c8-6-7-4-2-1-3-5-7/h1-5H,6,8H2	WGQKYBSKWIADBV-UHFFFAOYSA-N	107.073499298							40538, 40538
Scoulerine	LSM-3391	Aequaline, Discretamine, Scoulerine	439654	InChI=1S/C19H21NO4/c1-23-17-4-3-11-7-15-13-9-16(21)18(24-2)8-12(13)5-6-20(15)10-14(11)19(17)22/h3-4,8-9,15,21-22H,5-7,10H2,1-2H3/t15-/m0/s1	KNWVMRVOBAFFMH-HNNXBMFYSA-N	COc1cc2CCN3Cc4c(C[C@H]3c2cc1O)ccc(OC)c4O	BroadT	BRD-K62609077	BRD-K62609077-001-02-2	Prestwick Chemical Inc.	Prestw-601	D0701-MP04-ST03-200-		COc1cc2CCN3Cc4c(C[C@H]3c2cc1O)ccc(OC)c4O	InChI=1S/C19H21NO4/c1-23-17-4-3-11-7-15-13-9-16(21)18(24-2)8-12(13)5-6-20(15)10-14(11)19(17)22/h3-4,8-9,15,21-22H,5-7,10H2,1-2H3/t15-/m0/s1	KNWVMRVOBAFFMH-HNNXBMFYSA-N	327.147058162							17129
(+/-)-Kavain	LSM-42834	Kavain, (+/-)-Kavain	5369129	InChI=1S/C14H14O3/c1-16-13-9-12(17-14(15)10-13)8-7-11-5-3-2-4-6-11/h2-8,10,12H,9H2,1H3/b8-7+	XEAQIWGXBXCYFX-BQYQJAHWSA-N	COC1=CC(=O)OC(C1)\C=C\c2ccccc2	BroadT	BRD-A75455249	BRD-A75455249-001-02-0	Biomol International Inc.	NA136	2840(V2)-3-N1305		COC1=CC(=O)OC(C1)\C=C\c1ccccc1	InChI=1S/C14H14O3/c1-16-13-9-12(17-14(15)10-13)8-7-11-5-3-2-4-6-11/h2-8,10,12H,9H2,1H3/b8-7+	XEAQIWGXBXCYFX-BQYQJAHWSA-N	230.094294308							
GP 1A	LSM-3458	SID50112987, BRD-K65285700	10252734	InChI=1S/C23H22Cl2N4O/c1-14-5-7-17-15(11-14)12-18-21(23(30)27-28-9-3-2-4-10-28)26-29(22(17)18)20-8-6-16(24)13-19(20)25/h5-8,11,13H,2-4,9-10,12H2,1H3,(H,27,30)	FNOMTMVRTBHRET-UHFFFAOYSA-N	Cc1ccc2c(Cc3c(nn(c23)c4ccc(Cl)cc4Cl)C(=O)NN5CCCCC5)c1	BroadT	BRD-K65285700	BRD-K65285700-001-01-5	Tocris Bioscience	2764	1		Cc1ccc-2c(Cc3c(nn(c-23)-c2ccc(Cl)cc2Cl)C(=O)NN2CCCCC2)c1	InChI=1S/C23H22Cl2N4O/c1-14-5-7-17-15(11-14)12-18-21(23(30)27-28-9-3-2-4-10-28)26-29(22(17)18)20-8-6-16(24)13-19(20)25/h5-8,11,13H,2-4,9-10,12H2,1H3,(H,27,30)	FNOMTMVRTBHRET-UHFFFAOYSA-N	440.117066784							93145
Linoleamide	LSM-42998	SID26754671, SID26754669, BRD-K64044582	6435901	InChI=1S/C18H33NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H2,19,20)/b7-6-,10-9-	SFIHQZFZMWZOJV-HZJYTTRNSA-N	CCCCC\C=C/C\C=C/CCCCCCCC(=O)N	BroadT	BRD-K64044582	BRD-K64044582-001-02-8	Biomol International Inc.	FA023	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/CCCCCCCC(N)=O	InChI=1S/C18H33NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H2,19,20)/b7-6-,10-9-	SFIHQZFZMWZOJV-HZJYTTRNSA-N	279.256214686							82984
Phlorizin	LSM-25654	Phlorhizin, Phloridzin	6072	InChI=1S/C21H24O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-15-8-12(24)7-14(26)17(15)13(25)6-3-10-1-4-11(23)5-2-10/h1-2,4-5,7-8,16,18-24,26-29H,3,6,9H2/t16-,18-,19+,20-,21-/m1/s1	IOUVKUPGCMBWBT-QNDFHXLGSA-N	OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]1O	BroadT	BRD-K73756878	BRD-K73756878-001-02-9	MicroSource Discovery Systems Inc.	300547			OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O	InChI=1S/C21H24O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-15-8-12(24)7-14(26)17(15)13(25)6-3-10-1-4-11(23)5-2-10/h1-2,4-5,7-8,16,18-24,26-29H,3,6,9H2/t16-,18-,19+,20-,21-/m1/s1	IOUVKUPGCMBWBT-QNDFHXLGSA-N	436.136946968							8113, 8113
Deoxyrhapontin	LSM-42887	Piceid	5316606	InChI=1S/C21H24O8/c1-27-15-6-4-12(5-7-15)2-3-13-8-14(23)10-16(9-13)28-21-20(26)19(25)18(24)17(11-22)29-21/h2-10,17-26H,11H2,1H3/b3-2+/t17-,18-,19+,20-,21-/m1/s1	MFMQRDLLSRLUJY-DXKBKAGUSA-N	COc1ccc(\C=C\c2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1	BroadT	BRD-K14536225	BRD-K14536225-001-02-7	MicroSource Discovery Systems Inc.	1500827			COc1ccc(\C=C\c2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1	InChI=1S/C21H24O8/c1-27-15-6-4-12(5-7-15)2-3-13-8-14(23)10-16(9-13)28-21-20(26)19(25)18(24)17(11-22)29-21/h2-10,17-26H,11H2,1H3/b3-2+/t17-,18-,19+,20-,21-/m1/s1	MFMQRDLLSRLUJY-DXKBKAGUSA-N	404.147117728							
Meprylcaine	LSM-3460	Meprylcaine	4065	InChI=1S/C14H21NO2/c1-4-10-15-14(2,3)11-17-13(16)12-8-6-5-7-9-12/h5-9,15H,4,10-11H2,1-3H3	VXJABHHJLXLNMP-UHFFFAOYSA-N	CCCNC(C)(C)COC(=O)c1ccccc1	BroadT	BRD-K65417056	BRD-K65417056-003-03-6	Prestwick Chemical Inc.	Prestw-1064	D0701-MP04-ST03-200-	Cl	CCCNC(C)(C)COC(=O)c1ccccc1.Cl	InChI=1S/C14H21NO2.ClH/c1-4-10-15-14(2,3)11-17-13(16)12-8-6-5-7-9-12;/h5-9,15H,4,10-11H2,1-3H3;1H	LKHWKAGQNOMUFQ-UHFFFAOYSA-N	235.157228922							93147, 93147
2-Amino-4-methyl-pyridine	LSM-25655	2-Amino-4-Methylpyridine, SID11113859	1533	InChI=1S/C6H8N2/c1-5-2-3-8-6(7)4-5/h2-4H,1H3,(H2,7,8)	ORLGLBZRQYOWNA-UHFFFAOYSA-N	Cc1ccnc(N)c1	BroadT	BRD-K74039237	BRD-K74039237-001-01-7	VWR International	AAA14177-22			Cc1ccnc(N)c1	InChI=1S/C6H8N2/c1-5-2-3-8-6(7)4-5/h2-4H,1H3,(H2,7,8)	ORLGLBZRQYOWNA-UHFFFAOYSA-N	108.068748276							
NSC5112	LSM-1490	Genistin, SID17505355, SID71272	5284639	InChI=1S/C21H20O10/c22-7-15-18(26)19(27)20(28)21(31-15)30-11-5-13(24)16-14(6-11)29-8-12(17(16)25)9-1-3-10(23)4-2-9/h1-6,8,15,18-24,26-28H,7H2	ZCOLJUOHXJRHDI-UHFFFAOYSA-N	OCC1OC(Oc2cc(O)c3C(=O)C(=COc3c2)c4ccc(O)cc4)C(O)C(O)C1O	BroadT	BRD-A36151937	BRD-A36151937-001-01-2	EMD Biosciences	345836			OCC1OC(Oc2cc(O)c3c(c2)occ(-c2ccc(O)cc2)c3=O)C(O)C(O)C1O	InChI=1S/C21H20O10/c22-7-15-18(26)19(27)20(28)21(31-15)30-11-5-13(24)16-14(6-11)29-8-12(17(16)25)9-1-3-10(23)4-2-9/h1-6,8,15,18-24,26-28H,7H2	ZCOLJUOHXJRHDI-UHFFFAOYSA-N	432.10564684							91655
CHEMBL287327	LSM-3665	L-689,560, L-689560	6604749	InChI=1S/C17H15Cl2N3O3/c18-9-6-11(19)15-12(7-9)21-14(16(23)24)8-13(15)22-17(25)20-10-4-2-1-3-5-10/h1-7,13-14,21H,8H2,(H,23,24)(H2,20,22,25)/t13-,14+/m0/s1	UCKHICKHGAOGAP-UONOGXRCSA-N	OC(=O)[C@H]1C[C@H](NC(=O)Nc2ccccc2)c3c(Cl)cc(Cl)cc3N1	BroadT	BRD-K74284736	BRD-K74284736-001-01-5	Biomol International Inc.	AC-404	2817-N1277		OC(=O)[C@H]1C[C@H](NC(=O)Nc2ccccc2)c2c(Cl)cc(Cl)cc2N1	InChI=1S/C17H15Cl2N3O3/c18-9-6-11(19)15-12(7-9)21-14(16(23)24)8-13(15)22-17(25)20-10-4-2-1-3-5-10/h1-7,13-14,21H,8H2,(H,23,24)(H2,20,22,25)/t13-,14+/m0/s1	UCKHICKHGAOGAP-UONOGXRCSA-N	379.04904679							93308
Diazoxide	LSM-3639		3019	InChI=1S/C8H7ClN2O2S/c1-5-10-7-3-2-6(9)4-8(7)14(12,13)11-5/h2-4H,1H3,(H,10,11)	GDLBFKVLRPITMI-UHFFFAOYSA-N	CC1=Nc2ccc(Cl)cc2S(=O)(=O)N1	BroadT	BRD-K73109821	BRD-K73109821-001-05-2	Biomol International Inc.	KC-115	2840(V2)-3-N1305		CC1=Nc2ccc(Cl)cc2S(=O)(=O)N1	InChI=1S/C8H7ClN2O2S/c1-5-10-7-3-2-6(9)4-8(7)14(12,13)11-5/h2-4H,1H3,(H,10,11)	GDLBFKVLRPITMI-UHFFFAOYSA-N	229.991675884							4495
Idoxuridine	LSM-5836	5IUDR, Stoxil, Idoxuridine, Idu, Herplex, Dendrid, SK&F-14287, Allergan-211, Allergan 211	5905	InChI=1S/C9H11IN2O5/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7/h2,5-7,13-14H,1,3H2,(H,11,15,16)/t5-,6+,7+/m0/s1	XQFRJNBWHJMXHO-RRKCRQDMSA-N	OC[C@H]1O[C@H](C[C@@H]1O)N2C=C(I)C(=O)NC2=O	BroadT	BRD-K76634210	BRD-K76634210-001-02-2	Sigma-Aldrich	57830			OC[C@H]1O[C@H](C[C@@H]1O)n1cc(I)c(=O)[nH]c1=O	InChI=1S/C9H11IN2O5/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7/h2,5-7,13-14H,1,3H2,(H,11,15,16)/t5-,6+,7+/m0/s1	XQFRJNBWHJMXHO-RRKCRQDMSA-N	353.971264472							147675
AH 6809	LSM-6628	BRD-K59339270, SID11113635	119461	InChI=1S/C17H14O5/c1-9(2)21-11-4-5-12-15(8-11)22-14-6-3-10(17(19)20)7-13(14)16(12)18/h3-9H,1-2H3,(H,19,20)	AQFFXPQJLZFABJ-UHFFFAOYSA-N	CC(C)Oc1ccc2C(=O)c3cc(ccc3Oc2c1)C(=O)O	BroadT	BRD-K59339270	BRD-K59339270-001-01-8	Tocris Bioscience	671	3		CC(C)Oc1ccc2c(c1)oc1ccc(cc1c2=O)C(O)=O	InChI=1S/C17H14O5/c1-9(2)21-11-4-5-12-15(8-11)22-14-6-3-10(17(19)20)7-13(14)16(12)18/h3-9H,1-2H3,(H,19,20)	AQFFXPQJLZFABJ-UHFFFAOYSA-N	298.084123548							95289
Carbamazepine	LSM-3610	Teril, Tegretol, Carbamazepine, Equetro, Epitol, Carbatrol, G-32883, Tegretol-XR, Tegretol XR	2554	InChI=1S/C15H12N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-10H,(H2,16,18)	FFGPTBGBLSHEPO-UHFFFAOYSA-N	NC(=O)N1c2ccccc2C=Cc3ccccc13	BroadT	BRD-K71799949	BRD-K71799949-001-04-2	MicroSource Discovery Systems Inc.	1500159			NC(=O)N1c2ccccc2C=Cc2ccccc12	InChI=1S/C15H12N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-10H,(H2,16,18)	FFGPTBGBLSHEPO-UHFFFAOYSA-N	236.094963024							3387
Flumethasone	LSM-3369	Flumetasone, Flumethasone, U-10974	16490	InChI=1S/C22H28F2O5/c1-11-6-13-14-8-16(23)15-7-12(26)4-5-19(15,2)21(14,24)17(27)9-20(13,3)22(11,29)18(28)10-25/h4-5,7,11,13-14,16-17,25,27,29H,6,8-10H2,1-3H3/t11-,13+,14+,16+,17+,19+,20+,21+,22+/m1/s1	WXURHACBFYSXBI-GQKYHHCASA-N	C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO	BroadT	BRD-K61496577	BRD-K61496577-001-03-8	Prestwick Chemical Inc.	Prestw-734	D0701-MP04-ST03-200-		C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO	InChI=1S/C22H28F2O5/c1-11-6-13-14-8-16(23)15-7-12(26)4-5-19(15,2)21(14,24)17(27)9-20(13,3)22(11,29)18(28)10-25/h4-5,7,11,13-14,16-17,25,27,29H,6,8-10H2,1-3H3/t11-,13+,14+,16+,17+,19+,20+,21+,22+/m1/s1	WXURHACBFYSXBI-GQKYHHCASA-N	410.190480396							34764
NSC95397	LSM-3521	NSC-95397	262093	InChI=1S/C14H14O4S2/c15-5-7-19-13-11(17)9-3-1-2-4-10(9)12(18)14(13)20-8-6-16/h1-4,15-16H,5-8H2	MAASHDQFQDDECQ-UHFFFAOYSA-N	OCCSC1=C(SCCO)C(=O)c2ccccc2C1=O	BroadT	BRD-K68143200	BRD-K68143200-001-04-2	Tocris Bioscience	1547	1		OCCSC1=C(SCCO)C(=O)c2ccccc2C1=O	InChI=1S/C14H14O4S2/c15-5-7-19-13-11(17)9-3-1-2-4-10(9)12(18)14(13)20-8-6-16/h1-4,15-16H,5-8H2	MAASHDQFQDDECQ-UHFFFAOYSA-N	310.033350308							93193
Sanguinarium	LSM-6639	Sanguinarine, Sanguinarium, Sanguinarium Chloride	5154	InChI=1S/C20H14NO4/c1-21-8-15-12(4-5-16-20(15)25-10-22-16)13-3-2-11-6-17-18(24-9-23-17)7-14(11)19(13)21/h2-8H,9-10H2,1H3/q+1	INVGWHRKADIJHF-UHFFFAOYSA-N	C[n+]1cc2c3OCOc3ccc2c4ccc5cc6OCOc6cc5c14	BroadT	BRD-K66898851	BRD-K66898851-001-03-7	Prestwick Chemical Inc.	Prestw-987	D0701-MP04-ST03-200-		C[n+]1cc2c3OCOc3ccc2c2ccc3cc4OCOc4cc3c12	InChI=1S/C20H14NO4/c1-21-8-15-12(4-5-16-20(15)25-10-22-16)13-3-2-11-6-17-18(24-9-23-17)7-14(11)19(13)21/h2-8H,9-10H2,1H3/q+1	INVGWHRKADIJHF-UHFFFAOYSA-N	332.092282938							17183, 17183, 17183, 17183
Catechin Tetramethylether	LSM-25656		182659	InChI=1S/C19H22O6/c1-21-12-8-16(23-3)13-10-14(20)19(25-17(13)9-12)11-5-6-15(22-2)18(7-11)24-4/h5-9,14,19-20H,10H2,1-4H3/t14-,19+/m0/s1	GKPNPQODFXMCGO-IFXJQAMLSA-N	COc1cc(OC)c2C[C@H](O)[C@H](Oc2c1)c3ccc(OC)c(OC)c3	BroadT	BRD-K74727418	BRD-K74727418-001-02-6	MicroSource Discovery Systems Inc.	210220			COc1cc(OC)c2C[C@H](O)[C@H](Oc2c1)c1ccc(OC)c(OC)c1	InChI=1S/C19H22O6/c1-21-12-8-16(23-3)13-10-14(20)19(25-17(13)9-12)11-5-6-15(22-2)18(7-11)24-4/h5-9,14,19-20H,10H2,1-4H3/t14-,19+/m0/s1	GKPNPQODFXMCGO-IFXJQAMLSA-N	346.141638424							114199
15332-10-2	LSM-2515	BRD-K23623876	2378095	InChI=1S/C14H10F2N2/c15-13-5-1-3-11(7-13)9-17-18-10-12-4-2-6-14(16)8-12/h1-10H	YYMCVDNIIFNDJK-UHFFFAOYSA-N	Fc1cccc(C=NN=Cc2cccc(F)c2)c1	BroadT	BRD-K23623876	BRD-K23623876-001-01-6	Tocris Bioscience	1625	1		Fc1cccc(C=NN=Cc2cccc(F)c2)c1	InChI=1S/C14H10F2N2/c15-13-5-1-3-11(7-13)9-17-18-10-12-4-2-6-14(16)8-12/h1-10H	YYMCVDNIIFNDJK-UHFFFAOYSA-N	244.08120474							92414
BRD-K67016489	LSM-15383	BRD-K67016489		InChI=1S/C17H23NO4/c1-18-12-5-6-13(18)10-14(9-12)22-17(19)11-4-7-15(20-2)16(8-11)21-3/h4,7-8,12-14H,5-6,9-10H2,1-3H3/t12-,13-/m1/s1	AEFPCFUCFQBXDQ-CHWSQXEVSA-N	COc1ccc(cc1OC)C(=O)O[C@H]2C[C@H]3CC[C@H](C2)N3C	BroadT	BRD-K67016489	BRD-K67016489-003-02-3	Prestwick Chemical Inc.	Prestw-596	D0701-MP04-ST03-200-	Cl	COc1ccc(cc1OC)C(=O)O[C@H]1C[C@H]2CC[C@H](C1)N2C.Cl	InChI=1S/C17H23NO4.ClH/c1-18-12-5-6-13(18)10-14(9-12)22-17(19)11-4-7-15(20-2)16(8-11)21-3;/h4,7-8,12-14H,5-6,9-10H2,1-3H3;1H/t12-,13-;/m1./s1	BGPGVBLFHMZCNG-OJERSXHUSA-N	305.162708226							104025, 104025
Alpha-Solanine	LSM-3583	Solanine Alpha, Alpha-Solanine	9549171	InChI=1S/C45H73NO15/c1-19-6-9-27-20(2)31-28(46(27)16-19)15-26-24-8-7-22-14-23(10-12-44(22,4)25(24)11-13-45(26,31)5)57-43-40(61-41-37(54)35(52)32(49)21(3)56-41)39(34(51)30(18-48)59-43)60-42-38(55)36(53)33(50)29(17-47)58-42/h7,19-21,23-43,47-55H,6,8-18H2,1-5H3/t19-,20+,21-,23-,24+,25-,26-,27+,28-,29+,30+,31-,32-,33+,34-,35+,36-,37+,38+,39-,40+,41-,42-,43+,44-,45-/m0/s1	ZGVSETXHNHBTRK-UDJLNJFBSA-N	C[C@H]1CC[C@@H]2[C@@H](C)[C@H]3[C@H](C[C@H]4[C@@H]5CC=C6C[C@H](CC[C@]6(C)[C@H]5CC[C@]34C)O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@H]7O[C@@H]9O[C@@H](C)[C@H](O)[C@@H](O)[C@H]9O)N2C1	BroadT	BRD-K70881766	BRD-K70881766-001-02-3	Prestwick Chemical Inc.	Prestw-640	D0701-MP04-ST03-200-		C[C@@H]1[C@H]2CC[C@H](C)CN2[C@H]2C[C@H]3[C@@H]4CC=C5C[C@H](CC[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]12)O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O	InChI=1S/C45H73NO15/c1-19-6-9-27-20(2)31-28(46(27)16-19)15-26-24-8-7-22-14-23(10-12-44(22,4)25(24)11-13-45(26,31)5)57-43-40(61-41-37(54)35(52)32(49)21(3)56-41)39(34(51)30(18-48)59-43)60-42-38(55)36(53)33(50)29(17-47)58-42/h7,19-21,23-43,47-55H,6,8-18H2,1-5H3/t19-,20+,21-,23-,24+,25-,26-,27+,28-,29+,30+,31-,32-,33+,34-,35+,36-,37+,38+,39-,40+,41-,42-,43+,44-,45-/m0/s1	ZGVSETXHNHBTRK-UDJLNJFBSA-N	867.498020646001							9188
Aca	LSM-44127		5353376	InChI=1S/C21H23NO3/c1-2-3-4-7-16-10-12-17(13-11-16)14-15-20(23)22-19-9-6-5-8-18(19)21(24)25/h5-6,8-15H,2-4,7H2,1H3,(H,22,23)(H,24,25)/b15-14+	GAMRBCZMOOMBSQ-CCEZHUSRSA-N	CCCCCc1ccc(\C=C\C(=O)Nc2ccccc2C(=O)O)cc1	BroadT	BRD-K77817104	BRD-K77817104-001-01-3	EMD Biosciences	104550			CCCCCc1ccc(\C=C\C(=O)Nc2ccccc2C(O)=O)cc1	InChI=1S/C21H23NO3/c1-2-3-4-7-16-10-12-17(13-11-16)14-15-20(23)22-19-9-6-5-8-18(19)21(24)25/h5-6,8-15H,2-4,7H2,1H3,(H,22,23)(H,24,25)/b15-14+	GAMRBCZMOOMBSQ-CCEZHUSRSA-N	337.167793606							
Paclitaxel	LSM-6346	Paclitaxel, Taxol, Abraxane, BMS-181339-01	36314	InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)/t31-,32-,33+,35-,36+,37+,38-,40-,45+,46-,47+/m0/s1	RCINICONZNJXQF-MZXODVADSA-N	CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(=O)C)[C@H]2[C@H](OC(=O)c4ccccc4)[C@]5(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c6ccccc6)c7ccccc7)C(=C1C5(C)C)C	BroadT	BRD-K62008436	BRD-K62008436-001-03-1	Prestwick Chemical Inc.	Prestw-155	D0701-MP04-ST03-200-		CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1	InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)/t31-,32-,33+,35-,36+,37+,38-,40-,45+,46-,47+/m0/s1	RCINICONZNJXQF-MZXODVADSA-N	853.330955322							45863
Derrusnin	LSM-25658	Derrusnin	1715307	InChI=1S/C19H16O7/c1-21-11-7-14(22-2)17-15(8-11)26-19(20)16(18(17)23-3)10-4-5-12-13(6-10)25-9-24-12/h4-8H,9H2,1-3H3	PZYZNVLXKYMURF-UHFFFAOYSA-N	COC1=C(C(=O)Oc2cc(OC)cc(OC)c12)c3ccc4OCOc4c3	BroadT	BRD-K72066653	BRD-K72066653-001-02-5	MicroSource Discovery Systems Inc.	1401406			COc1cc(OC)c2c(OC)c(-c3ccc4OCOc4c3)c(=O)oc2c1	InChI=1S/C19H16O7/c1-21-11-7-14(22-2)17-15(8-11)26-19(20)16(18(17)23-3)10-4-5-12-13(6-10)25-9-24-12/h4-8H,9H2,1-3H3	PZYZNVLXKYMURF-UHFFFAOYSA-N	356.089602852							114201
Bufalin	LSM-3419	Bufalin	9547215	InChI=1S/C24H34O4/c1-22-10-7-17(25)13-16(22)4-5-20-19(22)8-11-23(2)18(9-12-24(20,23)27)15-3-6-21(26)28-14-15/h3,6,14,16-20,25,27H,4-5,7-13H2,1-2H3/t16-,17+,18-,19+,20-,22+,23-,24+/m1/s1	QEEBRPGZBVVINN-BMPKRDENSA-N	C[C@]12CC[C@H](O)C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4(C)[C@H](CC[C@]34O)C5=COC(=O)C=C5	BroadT	BRD-K63606607	BRD-K63606607-001-01-8	Calbiochem	203900			C[C@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@@H](O)CC[C@]34C)[C@@]1(O)CC[C@@H]2c1ccc(=O)oc1	InChI=1S/C24H34O4/c1-22-10-7-17(25)13-16(22)4-5-20-19(22)8-11-23(2)18(9-12-24(20,23)27)15-3-6-21(26)28-14-15/h3,6,14,16-20,25,27H,4-5,7-13H2,1-2H3/t16-,17+,18-,19+,20-,22+,23-,24+/m1/s1	QEEBRPGZBVVINN-BMPKRDENSA-N	386.245709568							517248
Almotriptan	LSM-25659	Almotriptan, LAS-31416	123606	InChI=1S/C17H25N3O2S/c1-19(2)10-7-15-12-18-17-6-5-14(11-16(15)17)13-23(21,22)20-8-3-4-9-20/h5-6,11-12,18H,3-4,7-10,13H2,1-2H3	WKEMJKQOLOHJLZ-UHFFFAOYSA-N	CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12	BroadT	BRD-K67601717	BRD-K67601717-001-02-0	MicroSource Discovery Systems Inc.	1505204			CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12	InChI=1S/C17H25N3O2S/c1-19(2)10-7-15-12-18-17-6-5-14(11-16(15)17)13-23(21,22)20-8-3-4-9-20/h5-6,11-12,18H,3-4,7-10,13H2,1-2H3	WKEMJKQOLOHJLZ-UHFFFAOYSA-N	335.16674776							520985, 520985
Carboxin	LSM-25660	DNDI1724944	21307	InChI=1S/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)	GYSSRZJIHXQEHQ-UHFFFAOYSA-N	CC1=C(SCCO1)C(=O)Nc2ccccc2	BroadT	BRD-K17610834	BRD-K17610834-001-01-2	TimTec LLC	ST020597			CC1=C(SCCO1)C(=O)Nc1ccccc1	InChI=1S/C12H13NO2S/c1-9-11(16-8-7-15-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)	GYSSRZJIHXQEHQ-UHFFFAOYSA-N	235.066699356							3405
Daphnetin	LSM-3366	TCMDC-125839	5280569	InChI=1S/C9H6O4/c10-6-3-1-5-2-4-7(11)13-9(5)8(6)12/h1-4,10,12H	ATEFPOUAMCWAQS-UHFFFAOYSA-N	Oc1ccc2C=CC(=O)Oc2c1O	BroadT	BRD-K61269089	BRD-K61269089-001-01-4	MicroSource Discovery Systems Inc.	1504141			Oc1ccc2ccc(=O)oc2c1O	InChI=1S/C9H6O4/c10-6-3-1-5-2-4-7(11)13-9(5)8(6)12/h1-4,10,12H	ATEFPOUAMCWAQS-UHFFFAOYSA-N	178.026608672							17313
2-Arachidonoylglycerol	LSM-44128	2-Arachidonoylglycerol, 2-Arachidonoyl Glycerol, 2-Arachidonoyl-Glycerol, 2-Oarachidonoyl Glycerol	5282280	InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)27-22(20-24)21-25/h6-7,9-10,12-13,15-16,22,24-25H,2-5,8,11,14,17-21H2,1H3/b7-6-,10-9-,13-12-,16-15-	RCRCTBLIHCHWDZ-DOFZRALJSA-N	CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OC(CO)CO	BroadT	BRD-K71198913	BRD-K71198913-001-02-3	Biomol International Inc.	FA028	2840(V2)-3-N1305		CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OC(CO)CO	InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)27-22(20-24)21-25/h6-7,9-10,12-13,15-16,22,24-25H,2-5,8,11,14,17-21H2,1H3/b7-6-,10-9-,13-12-,16-15-	RCRCTBLIHCHWDZ-DOFZRALJSA-N	378.277009696							52392
Nabumetone	LSM-3453	Nabumetone, Relafen, BRL-14777	4409	InChI=1S/C15H16O2/c1-11(16)3-4-12-5-6-14-10-15(17-2)8-7-13(14)9-12/h5-10H,3-4H2,1-2H3	BLXXJMDCKKHMKV-UHFFFAOYSA-N	COc1ccc2cc(CCC(=O)C)ccc2c1	BroadT	BRD-K65146499	BRD-K65146499-001-04-8	Prestwick Chemical Inc.	Prestw-909	D0701-MP04-ST03-200-		COc1ccc2cc(CCC(C)=O)ccc2c1	InChI=1S/C15H16O2/c1-11(16)3-4-12-5-6-14-10-15(17-2)8-7-13(14)9-12/h5-10H,3-4H2,1-2H3	BLXXJMDCKKHMKV-UHFFFAOYSA-N	228.115029752							7443
3-Methylcholanthrene	LSM-5711	3-Methylcholanthrene, 3-Methoxycholanthrene, BRD-K61463582	1674	InChI=1S/C21H16/c1-13-6-7-15-12-20-17-5-3-2-4-14(17)8-9-18(20)19-11-10-16(13)21(15)19/h2-9,12H,10-11H2,1H3	PPQNQXQZIWHJRB-UHFFFAOYSA-N	Cc1ccc2cc3c(ccc4ccccc34)c5CCc1c25	BroadT	BRD-K61463582	BRD-K61463582-001-02-3	MicroSource Discovery Systems Inc.	330007			Cc1ccc2cc3c(ccc4ccccc34)c3CCc1c23	InChI=1S/C21H16/c1-13-6-7-15-12-20-17-5-3-2-4-14(17)8-9-18(20)19-11-10-16(13)21(15)19/h2-9,12H,10-11H2,1H3	PPQNQXQZIWHJRB-UHFFFAOYSA-N	268.125200512							34342
Tyrphostin B46	LSM-3628	BRD-K72783841	2058	InChI=1S/C19H18N2O3/c20-13-16(11-15-8-9-17(22)18(23)12-15)19(24)21-10-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12,22-23H,4,7,10H2,(H,21,24)	GSQOBTOAOGXIFL-UHFFFAOYSA-N	Oc1ccc(C=C(C#N)C(=O)NCCCc2ccccc2)cc1O	BroadT	BRD-K72783841	BRD-K72783841-001-01-0	Tocris Bioscience	618	1		Oc1ccc(C=C(C#N)C(=O)NCCCc2ccccc2)cc1O	InChI=1S/C19H18N2O3/c20-13-16(11-15-8-9-17(22)18(23)12-15)19(24)21-10-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12,22-23H,4,7,10H2,(H,21,24)	GSQOBTOAOGXIFL-UHFFFAOYSA-N	322.131742456							93277
SCHEMBL6465902	LSM-3544	Phosphodiesterase V Inhibitor II	11003969	InChI=1S/C24H25N3O3/c1-3-4-13-26-23(28)20-14-18-17-7-5-6-8-19(17)25-21(18)22(27(20)24(26)29)15-9-11-16(30-2)12-10-15/h5-12,20,22,25H,3-4,13-14H2,1-2H3/t20-,22+/m1/s1	XWBJKKIHTRCECR-IRLDBZIGSA-N	CCCCN1C(=O)[C@H]2Cc3c([nH]c4ccccc34)[C@@H](N2C1=O)c5ccc(OC)cc5	BroadT	BRD-K68873215	BRD-K68873215-001-01-3	Calbiochem	524714			CCCCN1C(=O)[C@H]2Cc3c([nH]c4ccccc34)[C@@H](N2C1=O)c1ccc(OC)cc1	InChI=1S/C24H25N3O3/c1-3-4-13-26-23(28)20-14-18-17-7-5-6-8-19(17)25-21(18)22(27(20)24(26)29)15-9-11-16(30-2)12-10-15/h5-12,20,22,25H,3-4,13-14H2,1-2H3/t20-,22+/m1/s1	XWBJKKIHTRCECR-IRLDBZIGSA-N	403.18959169							93211
HE044657	LSM-3500	BRD-K67352070	44483287	InChI=1S/C12H18N2O/c1-3-15-12-8-11(9-14-10-12)6-4-5-7-13-2/h4,6,8-10,13H,3,5,7H2,1-2H3	HFZDMKMXPGRKCK-UHFFFAOYSA-N	CCOc1cncc(C=CCCNC)c1	BroadT	BRD-K67352070	BRD-K67352070-364-01-5	Tocris Bioscience	2737	1	OC(=O)/C=C/C(=O)O.OC(=O)/C=C/C(=O)O	CCOc1cncc(C=CCCNC)c1.OC(=O)/C=C/C(=O)O.OC(=O)/C=C/C(=O)O	InChI=1S/C12H18N2O.2C4H4O4/c1-3-15-12-8-11(9-14-10-12)6-4-5-7-13-2;2*5-3(6)1-2-4(7)8/h4,6,8-10,13H,3,5,7H2,1-2H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+	GEWVPSJQGJBDLM-LVEZLNDCSA-N	206.141913216							93177
SB 200646	LSM-3738	SB-200646, BRD-K77677632	126769	InChI=1S/C15H14N4O/c1-19-8-6-11-9-12(4-5-14(11)19)17-15(20)18-13-3-2-7-16-10-13/h2-10H,1H3,(H2,17,18,20)	OJZZJTLBYXHUSJ-UHFFFAOYSA-N	Cn1ccc2cc(NC(=O)Nc3cccnc3)ccc12	BroadT	BRD-K77677632	BRD-K77677632-003-01-8	Tocris Bioscience	1371	1	Cl	Cn1ccc2cc(NC(=O)Nc3cccnc3)ccc12.Cl	InChI=1S/C15H14N4O.ClH/c1-19-8-6-11-9-12(4-5-14(11)19)17-15(20)18-13-3-2-7-16-10-13;/h2-10H,1H3,(H2,17,18,20);1H	IGRYPUQJEDJLHC-UHFFFAOYSA-N	266.116761108							8976, 8976, 8976
SCHEMBL1670775	LSM-3483	Lawsone	10125107	InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-4H,5H2	SLJWCCMDGTZEGQ-UHFFFAOYSA-N	O=C1CC(=O)c2ccccc2C1=O	BroadT	BRD-K66707493	BRD-K66707493-001-02-6	MicroSource Discovery Systems Inc.	1502250			O=C1CC(=O)c2ccccc2C1=O	InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-4H,5H2	SLJWCCMDGTZEGQ-UHFFFAOYSA-N	174.031694052							93166
Quinidine	LSM-3325	SID17389531, SID56320931, SID56320932, Quinidine Gluconate	441074	InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19+,20-/m0/s1	LOUPRKONTZGTKE-LHHVKLHASA-N	COc1ccc2nccc([C@H](O)[C@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1	BroadT	BRD-K70799801	BRD-K70799801-311-02-7	Prestwick Chemical Inc.	Prestw-280	D0701-MP04-ST03-200-	O.Cl	COc1ccc2nccc([C@H](O)[C@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1.O.Cl	InChI=1S/C20H24N2O2.ClH.H2O/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;;/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;1H;1H2/t13-,14-,19+,20-;;/m0../s1	SGVZDMWHXVXUBY-KAIFKDDSSA-N	324.183778028							28593, 28593, 28593, 28593, 28593, 28593
RHO Kinase Inhibitor II	LSM-3032	RHO-Kinase-Inhibitor-II, RHO-Kinase Inhibitor II	16760634	InChI=1S/C12H8Cl3N3O/c13-7-5-9(14)11(10(15)6-7)18-12(19)17-8-1-3-16-4-2-8/h1-6H,(H2,16,17,18,19)	GBOKNHVRVRMECW-UHFFFAOYSA-N	Clc1cc(Cl)c(NC(=O)Nc2ccncc2)c(Cl)c1	BroadT	BRD-K46678324	BRD-K46678324-001-03-7	Calbiochem	Rho-Kinase Inhibitor II			Clc1cc(Cl)c(NC(=O)Nc2ccncc2)c(Cl)c1	InChI=1S/C12H8Cl3N3O/c13-7-5-9(14)11(10(15)6-7)18-12(19)17-8-1-3-16-4-2-8/h1-6H,(H2,16,17,18,19)	GBOKNHVRVRMECW-UHFFFAOYSA-N	314.973295036							92817
TRAP-101	LSM-3563	BRD-K69837166	11494970	InChI=1S/C24H35N3O2/c1-2-26-22-12-8-9-13-23(22)27(24(26)29)21-14-15-25(17-20(21)18-28)16-19-10-6-4-3-5-7-11-19/h8-9,12-13,19,28H,2-7,10-11,14-18H2,1H3	DCRGHMJXEBSRQG-UHFFFAOYSA-N	CCN1C(=O)N(C2=C(CO)CN(CC3CCCCCCC3)CC2)c4ccccc14	BroadT	BRD-K69837166	BRD-K69837166-003-01-2	Tocris Bioscience	2508	1	Cl	CCn1c2ccccc2n(C2=C(CO)CN(CC3CCCCCCC3)CC2)c1=O.Cl	InChI=1S/C24H35N3O2.ClH/c1-2-26-22-12-8-9-13-23(22)27(24(26)29)21-14-15-25(17-20(21)18-28)16-19-10-6-4-3-5-7-11-19;/h8-9,12-13,19,28H,2-7,10-11,14-18H2,1H3;1H	YEVMLMQAMCKVSC-UHFFFAOYSA-N	397.27292739							93227
CHEMBL1208118	LSM-3598	BRD-K71266197	25124826	InChI=1S/C24H16N2O5S/c25-22-19(32(29,30)31)12-18(26-17-11-5-7-13-6-1-2-8-14(13)17)20-21(22)24(28)16-10-4-3-9-15(16)23(20)27/h1-12,26H,25H2,(H,29,30,31)	ZHQRPIRGSWEALJ-UHFFFAOYSA-N	Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc4cccc5ccccc45)cc1S(=O)(=O)O	BroadT	BRD-K71266197	BRD-K71266197-236-01-9	Tocris Bioscience	2574	2	[Na]	Nc1c2C(=O)c3ccccc3C(=O)c2c(Nc2cccc3ccccc23)cc1S(O)(=O)=O.[Na]	InChI=1S/C24H16N2O5S.Na.H/c25-22-19(32(29,30)31)12-18(26-17-11-5-7-13-6-1-2-8-14(13)17)20-21(22)24(28)16-10-4-3-9-15(16)23(20)27;;/h1-12,26H,25H2,(H,29,30,31);;	WMYLENSBFBCIET-UHFFFAOYSA-N	444.077992322							93255, 93255
Fraxetin	LSM-3712	Fraxetin	5273569	InChI=1S/C10H8O5/c1-14-6-4-5-2-3-7(11)15-10(5)9(13)8(6)12/h2-4,12-13H,1H3	HAVWRBANWNTOJX-UHFFFAOYSA-N	COc1cc2C=CC(=O)Oc2c(O)c1O	BroadT	BRD-K76587808	BRD-K76587808-001-02-0	AnalytiCon Discovery GmbH	NP-001364			COc1cc2ccc(=O)oc2c(O)c1O	InChI=1S/C10H8O5/c1-14-6-4-5-2-3-7(11)15-10(5)9(13)8(6)12/h2-4,12-13H,1H3	HAVWRBANWNTOJX-UHFFFAOYSA-N	208.037173356							5169
Talipexole	LSM-3687	Talipexole, B-HT 920	5374	InChI=1S/C10H15N3S/c1-2-5-13-6-3-8-9(4-7-13)14-10(11)12-8/h2H,1,3-7H2,(H2,11,12)	DHSSDEDRBUKTQY-UHFFFAOYSA-N	Nc1nc2CCN(CC=C)CCc2s1	BroadT	BRD-K75615183	BRD-K75615183-001-01-7	Biomol International Inc.	AC-253	2812-3-N1298		Nc1nc2CCN(CC=C)CCc2s1	InChI=1S/C10H15N3S/c1-2-5-13-6-3-8-9(4-7-13)14-10(11)12-8/h2H,1,3-7H2,(H2,11,12)	DHSSDEDRBUKTQY-UHFFFAOYSA-N	209.0986682							93327, 93327
NAN-190	LSM-3548	NAN-190, NAN 190	4431	InChI=1S/C23H27N3O3/c1-29-21-11-5-4-10-20(21)25-16-14-24(15-17-25)12-6-7-13-26-22(27)18-8-2-3-9-19(18)23(26)28/h2-5,8-11H,6-7,12-17H2,1H3	SJDOMIRMMUGQQK-UHFFFAOYSA-N	COc1ccccc1N2CCN(CCCCN3C(=O)c4ccccc4C3=O)CC2	BroadT	BRD-K69195780	BRD-K69195780-001-01-5	Biomol International Inc.	NS-640	2813-N1283		COc1ccccc1N1CCN(CCCCN2C(=O)c3ccccc3C2=O)CC1	InChI=1S/C23H27N3O3/c1-29-21-11-5-4-10-20(21)25-16-14-24(15-17-25)12-6-7-13-26-22(27)18-8-2-3-9-19(18)23(26)28/h2-5,8-11H,6-7,12-17H2,1H3	SJDOMIRMMUGQQK-UHFFFAOYSA-N	393.205241754							64131, 64131, 64131
Vegf receptor 2 kinase inhibitor iv	LSM-3373		5329468	InChI=1S/C17H13N3OS/c1-21-15-4-2-12(3-5-15)14-8-18-17-16(9-19-20(17)10-14)13-6-7-22-11-13/h2-11H,1H3	HBWLNACPIFKNIP-UHFFFAOYSA-N	COc1ccc(cc1)c2cnc3c(cnn3c2)c4ccsc4	BroadT	BRD-K61737877	BRD-K61737877-001-01-6	Calbiochem	676489			COc1ccc(cc1)-c1cnc2c(cnn2c1)-c1ccsc1	InChI=1S/C17H13N3OS/c1-21-15-4-2-12(3-5-15)14-8-18-17-16(9-19-20(17)10-14)13-6-7-22-11-13/h2-11H,1H3	HBWLNACPIFKNIP-UHFFFAOYSA-N	307.077932756							93078
(-)-Lobeline	LSM-5744	Lobeline, Alpha-Lobeline HCl, Alpha-Lobeline, (-)-Lobeline	101616	InChI=1S/C22H27NO2/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18/h2-7,9-12,19-21,24H,8,13-16H2,1H3/t19-,20+,21-/m0/s1	MXYUKLILVYORSK-HBMCJLEFSA-N	CN1[C@H](C[C@H](O)c2ccccc2)CCC[C@@H]1CC(=O)c3ccccc3	BroadT	BRD-K66206289	BRD-K66206289-003-03-1	Prestwick Chemical Inc.	Prestw-585	D0701-MP04-ST03-200-	Cl	CN1[C@H](C[C@H](O)c2ccccc2)CCC[C@@H]1CC(=O)c1ccccc1.Cl	InChI=1S/C22H27NO2.ClH/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18;/h2-7,9-12,19-21,24H,8,13-16H2,1H3;1H/t19-,20+,21-;/m0./s1	MKMYPTLXLWOUSO-NFQNBQCWSA-N	337.204179114							48723, 48723
Ergocryptine	LSM-3664	Alpha-Ergocryptine	134551	InChI=1S/C32H41N5O5/c1-17(2)12-25-29(39)36-11-7-10-26(36)32(41)37(25)30(40)31(42-32,18(3)4)34-28(38)20-13-22-21-8-6-9-23-27(21)19(15-33-23)14-24(22)35(5)16-20/h6,8-9,13,15,17-18,20,24-26,33,41H,7,10-12,14,16H2,1-5H3,(H,34,38)/t20-,24-,25+,26+,31-,32+/m1/s1	YDOTUXAWKBPQJW-NSLWYYNWSA-N	CC(C)C[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)[C@@H]4Cc5c[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]7CCCN7C1=O)C(C)C	BroadT	BRD-K74212935	BRD-K74212935-001-03-1	Biomol International Inc.	AC-825	2812-3-N1298		CC(C)C[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)[C@@H]4Cc5c[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]2CCCN2C1=O)C(C)C	InChI=1S/C32H41N5O5/c1-17(2)12-25-29(39)36-11-7-10-26(36)32(41)37(25)30(40)31(42-32,18(3)4)34-28(38)20-13-22-21-8-6-9-23-27(21)19(15-33-23)14-24(22)35(5)16-20/h6,8-9,13,15,17-18,20,24-26,33,41H,7,10-12,14,16H2,1-5H3,(H,34,38)/t20-,24-,25+,26+,31-,32+/m1/s1	YDOTUXAWKBPQJW-NSLWYYNWSA-N	575.310769462							10276
ZM336372	LSM-6268	ZM-336372	5730	InChI=1S/C23H23N3O3/c1-15-7-10-18(24-23(29)17-5-4-6-19(13-17)26(2)3)14-21(15)25-22(28)16-8-11-20(27)12-9-16/h4-14,27H,1-3H3,(H,24,29)(H,25,28)	PYEFPDQFAZNXLI-UHFFFAOYSA-N	CN(C)c1cccc(c1)C(=O)Nc2ccc(C)c(NC(=O)c3ccc(O)cc3)c2	BroadT	BRD-K73789395	BRD-K73789395-001-04-0	Biomol International Inc.	EI-298	2840(V2)-3-N1305		CN(C)c1cccc(c1)C(=O)Nc1ccc(C)c(NC(=O)c2ccc(O)cc2)c1	InChI=1S/C23H23N3O3/c1-15-7-10-18(24-23(29)17-5-4-6-19(13-17)26(2)3)14-21(15)25-22(28)16-8-11-20(27)12-9-16/h4-14,27H,1-3H3,(H,24,29)(H,25,28)	PYEFPDQFAZNXLI-UHFFFAOYSA-N	389.173941626							95033
Aggc	LSM-43232	SID26754864, SID26754865, N-Aggc, Acetyl-Geranygeranyl-Cysteine	11575713	InChI=1S/C25H41NO3S/c1-19(2)10-7-11-20(3)12-8-13-21(4)14-9-15-22(5)16-17-30-18-24(25(28)29)26-23(6)27/h10,12,14,16,24H,7-9,11,13,15,17-18H2,1-6H3,(H,26,27)(H,28,29)/b20-12+,21-14+,22-16+/t24-/m0/s1	PKFBJSDMCRJYDC-GEZSXCAASA-N	CC(=CCC\C(=C\CC\C(=C\CC\C(=C\CSC[C@H](NC(=O)C)C(=O)O)\C)\C)\C)C	BroadT	BRD-K75181824	BRD-K75181824-001-02-3	Biomol International Inc.	G220	2840(V2)-3-N1305		CC(=O)N[C@@H](CSC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CCC=C(C)C)C(O)=O	InChI=1S/C25H41NO3S/c1-19(2)10-7-11-20(3)12-8-13-21(4)14-9-15-22(5)16-17-30-18-24(25(28)29)26-23(6)27/h10,12,14,16,24H,7-9,11,13,15,17-18H2,1-6H3,(H,26,27)(H,28,29)/b20-12+,21-14+,22-16+/t24-/m0/s1	PKFBJSDMCRJYDC-GEZSXCAASA-N	435.280714872							
Trazodone	LSM-3580	Trialodine, Trazodone, Desyrel	5533	InChI=1S/C19H22ClN5O/c20-16-5-3-6-17(15-16)23-13-11-22(12-14-23)8-4-10-25-19(26)24-9-2-1-7-18(24)21-25/h1-3,5-7,9,15H,4,8,10-14H2	PHLBKPHSAVXXEF-UHFFFAOYSA-N	Clc1cccc(c1)N2CCN(CCCN3N=C4C=CC=CN4C3=O)CC2	BroadT	BRD-K70778732	BRD-K70778732-003-04-4	MicroSource Discovery Systems Inc.	1503121		Cl	Clc1cccc(c1)N1CCN(CCCn2nc3ccccn3c2=O)CC1.Cl	InChI=1S/C19H22ClN5O.ClH/c20-16-5-3-6-17(15-16)23-13-11-22(12-14-23)8-4-10-25-19(26)24-9-2-1-7-18(24)21-25;/h1-3,5-7,9,15H,4,8,10-14H2;1H	OHHDIOKRWWOXMT-UHFFFAOYSA-N	371.151288084							9654, 9654
Huperzinea	LSM-43203	Huperzine A	854026	InChI=1S/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)/b11-3+/t10-,15+/m0/s1	ZRJBHWIHUMBLCN-YQEJDHNASA-N	C\C=C\1/[C@@H]2CC3=C(C=CC(=O)N3)[C@@]1(N)CC(=C2)C	BroadT	BRD-K62240499	BRD-K62240499-001-02-6	MicroSource Discovery Systems Inc.	1505255			C\C=C1/[C@@H]2Cc3[nH]c(=O)ccc3[C@@]1(N)CC(C)=C2	InChI=1S/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)/b11-3+/t10-,15+/m0/s1	ZRJBHWIHUMBLCN-YQEJDHNASA-N	242.141913216							78330
CHEMBL78498	LSM-3381	BRD-K62206109, VUF-5681	10330240	InChI=1S/C11H19N3/c1(3-11-8-13-9-14-11)2-10-4-6-12-7-5-10/h8-10,12H,1-7H2,(H,13,14)	YPGRNKJNOSUCLY-UHFFFAOYSA-N	C(CC1CCNCC1)Cc2c[nH]cn2	BroadT	BRD-K62206109	BRD-K62206109-303-01-1	Tocris Bioscience	2493	1	Br.Br	C(CC1CCNCC1)Cc1c[nH]cn1.Br.Br	InChI=1S/C11H19N3.2BrH/c1(3-11-8-13-9-14-11)2-10-4-6-12-7-5-10;;/h8-10,12H,1-7H2,(H,13,14);2*1H	YFFVIGXPKWSZHW-UHFFFAOYSA-N	193.157897638							93084
GW9508	LSM-3604	GW-9508, GW9508, BRD-K71534238	11595431	InChI=1S/C22H21NO3/c24-22(25)14-11-17-9-12-19(13-10-17)23-16-18-5-4-8-21(15-18)26-20-6-2-1-3-7-20/h1-10,12-13,15,23H,11,14,16H2,(H,24,25)	DGENZVKCTGIDRZ-UHFFFAOYSA-N	OC(=O)CCc1ccc(NCc2cccc(Oc3ccccc3)c2)cc1	BroadT	BRD-K71534238	BRD-K71534238-001-03-5	Tocris Bioscience	2649	1		OC(=O)CCc1ccc(NCc2cccc(Oc3ccccc3)c2)cc1	InChI=1S/C22H21NO3/c24-22(25)14-11-17-9-12-19(13-10-17)23-16-18-5-4-8-21(15-18)26-20-6-2-1-3-7-20/h1-10,12-13,15,23H,11,14,16H2,(H,24,25)	DGENZVKCTGIDRZ-UHFFFAOYSA-N	347.152143542							93259
SB-431542	LSM-3498	SB-431542, SB431542	4521392	InChI=1S/C22H16N4O3/c23-21(27)13-4-6-14(7-5-13)22-25-19(20(26-22)16-3-1-2-10-24-16)15-8-9-17-18(11-15)29-12-28-17/h1-11H,12H2,(H2,23,27)(H,25,26)	FHYUGAJXYORMHI-UHFFFAOYSA-N	NC(=O)c1ccc(cc1)c2nc(c3ccc4OCOc4c3)c([nH]2)c5ccccn5	BroadT	BRD-K67298865	BRD-K67298865-001-02-5	Biomol International Inc.	EI314	2840(V2)-3-N1305		NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccccn1)-c1ccc2OCOc2c1	InChI=1S/C22H16N4O3/c23-21(27)13-4-6-14(7-5-13)22-25-19(20(26-22)16-3-1-2-10-24-16)15-8-9-17-18(11-15)29-12-28-17/h1-11H,12H2,(H2,23,27)(H,25,26)	FHYUGAJXYORMHI-UHFFFAOYSA-N	384.122240412							91108, 91108
Phtpp	LSM-3711	BRD-K76568384, SID50112959	11201035	InChI=1S/C20H11F6N3O/c21-19(22,23)14-10-15(20(24,25)26)29-18(27-14)16(11-6-8-13(30)9-7-11)17(28-29)12-4-2-1-3-5-12/h1-10,30H	AEZPAUSGTAHLOQ-UHFFFAOYSA-N	Oc1ccc(cc1)c2c(nn3c(cc(nc23)C(F)(F)F)C(F)(F)F)c4ccccc4	BroadT	BRD-K76568384	BRD-K76568384-001-01-4	Tocris Bioscience	2662	1		Oc1ccc(cc1)-c1c(nn2c(cc(nc12)C(F)(F)F)C(F)(F)F)-c1ccccc1	InChI=1S/C20H11F6N3O/c21-19(22,23)14-10-15(20(24,25)26)29-18(27-14)16(11-6-8-13(30)9-7-11)17(28-29)12-4-2-1-3-5-12/h1-10,30H	AEZPAUSGTAHLOQ-UHFFFAOYSA-N	423.080631202							93344
Progesterone	LSM-3452	Progesterone, Progestasert, Progestin, Prometrium, Regumate, Syngestrone, Gesterol, Endometrin, Crinone	5994	InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3/t16-,17+,18-,19-,20-,21+/m0/s1	RJKFOVLPORLFTN-LEKSSAKUSA-N	CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C	BroadT	BRD-K64994968	BRD-K64994968-001-03-6	Prestwick Chemical Inc.	Prestw-477	D0701-MP04-ST03-200-		CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C	InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3/t16-,17+,18-,19-,20-,21+/m0/s1	RJKFOVLPORLFTN-LEKSSAKUSA-N	314.2245802							17026
2,3',4,5'-Tetramethoxystilbene	LSM-3013	BRD-K45988865	5491	InChI=1S/C18H20O4/c1-19-15-8-7-14(18(12-15)22-4)6-5-13-9-16(20-2)11-17(10-13)21-3/h5-12H,1-4H3	JDBCWSHYEQUBLW-UHFFFAOYSA-N	COc1ccc(C=Cc2cc(OC)cc(OC)c2)c(OC)c1	BroadT	BRD-K45988865	BRD-K45988865-001-01-0	Tocris Bioscience	1509	1		COc1ccc(C=Cc2cc(OC)cc(OC)c2)c(OC)c1	InChI=1S/C18H20O4/c1-19-15-8-7-14(18(12-15)22-4)6-5-13-9-16(20-2)11-17(10-13)21-3/h5-12H,1-4H3	JDBCWSHYEQUBLW-UHFFFAOYSA-N	300.13615912							92804
Triallate	LSM-25662	Triallate, SID50113137, Tri-Allate	5543	InChI=1S/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3	MWBPRDONLNQCFV-UHFFFAOYSA-N	CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl	BroadT	BRD-K64698045	BRD-K64698045-001-02-2	MicroSource Discovery Systems Inc.	330054			CC(C)N(C(C)C)C(=O)SCC(Cl)=C(Cl)Cl	InChI=1S/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3	MWBPRDONLNQCFV-UHFFFAOYSA-N	303.001817962							81978
RS-17053	LSM-3721	RS-17053, BRD-K76840893	3894573	InChI=1S/C24H29ClN2O2/c1-24(2,14-18-15-26-21-10-9-19(25)13-20(18)21)27-11-12-28-22-5-3-4-6-23(22)29-16-17-7-8-17/h3-6,9-10,13,15,17,26-27H,7-8,11-12,14,16H2,1-2H3	XLZHXAXXJVKTFM-UHFFFAOYSA-N	CC(C)(Cc1c[nH]c2ccc(Cl)cc12)NCCOc3ccccc3OCC4CC4	BroadT	BRD-K76840893	BRD-K76840893-003-01-7	Tocris Bioscience	985	1	Cl	CC(C)(Cc1c[nH]c2ccc(Cl)cc12)NCCOc1ccccc1OCC1CC1.Cl	InChI=1S/C24H29ClN2O2.ClH/c1-24(2,14-18-15-26-21-10-9-19(25)13-20(18)21)27-11-12-28-22-5-3-4-6-23(22)29-16-17-7-8-17;/h3-6,9-10,13,15,17,26-27H,7-8,11-12,14,16H2,1-2H3;1H	QFOPFGRPNPCPBX-UHFFFAOYSA-N	412.191755898							93348
Dichlorophen	LSM-25663	Dichlorophen	3037	InChI=1S/C13H10Cl2O2/c14-10-1-3-12(16)8(6-10)5-9-7-11(15)2-4-13(9)17/h1-4,6-7,16-17H,5H2	MDNWOSOZYLHTCG-UHFFFAOYSA-N	Oc1ccc(Cl)cc1Cc2cc(Cl)ccc2O	BroadT	BRD-K62326629	BRD-K62326629-001-02-6	MicroSource Discovery Systems Inc.	1500626			Oc1ccc(Cl)cc1Cc1cc(Cl)ccc1O	InChI=1S/C13H10Cl2O2/c14-10-1-3-12(16)8(6-10)5-9-7-11(15)2-4-13(9)17/h1-4,6-7,16-17H,5H2	MDNWOSOZYLHTCG-UHFFFAOYSA-N	268.00578498							34689
ML9	LSM-3531	SID90340625, SID124879577, ML-9	4217	InChI=1S/C15H17ClN2O2S/c16-14-6-1-5-13-12(14)4-2-7-15(13)21(19,20)18-10-3-8-17-9-11-18/h1-2,4-7,17H,3,8-11H2	OZSMSRIUUDGTEP-UHFFFAOYSA-N	Clc1cccc2c(cccc12)S(=O)(=O)N3CCCNCC3	BroadT	BRD-K68402494	BRD-K68402494-001-04-7	Biomol International Inc.	EI-153	2840(V2)-3-N1305		Clc1cccc2c(cccc12)S(=O)(=O)N1CCCNCC1	InChI=1S/C15H17ClN2O2S/c16-14-6-1-5-13-12(14)4-2-7-15(13)21(19,20)18-10-3-8-17-9-11-18/h1-2,4-7,17H,3,8-11H2	OZSMSRIUUDGTEP-UHFFFAOYSA-N	324.069926204							93202, 93202
Myosmine	LSM-6643	SID11112398	442649	InChI=1S/C9H10N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3,5,7H,2,4,6H2	DPNGWXJMIILTBS-UHFFFAOYSA-N	C1CN=C(C1)c2cccnc2	BroadT	BRD-K67556876	BRD-K67556876-001-03-1	Prestwick Chemical Inc.	Prestw-647	D0701-MP04-ST03-200-		C1CN=C(C1)c1cccnc1	InChI=1S/C9H10N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3,5,7H,2,4,6H2	DPNGWXJMIILTBS-UHFFFAOYSA-N	146.08439834							7051
Phenyl Aminosalicylate	LSM-25664	Fenamisal, Phenyl Aminosalicylate, Pheny-Pas-Tebamin	8609	InChI=1S/C13H11NO3/c14-9-6-7-11(12(15)8-9)13(16)17-10-4-2-1-3-5-10/h1-8,15H,14H2	DNVVZWSVACQWJE-UHFFFAOYSA-N	Nc1ccc(C(=O)Oc2ccccc2)c(O)c1	BroadT	BRD-K73157543	BRD-K73157543-001-02-5	MicroSource Discovery Systems Inc.	305025			Nc1ccc(C(=O)Oc2ccccc2)c(O)c1	InChI=1S/C13H11NO3/c14-9-6-7-11(12(15)8-9)13(16)17-10-4-2-1-3-5-10/h1-8,15H,14H2	DNVVZWSVACQWJE-UHFFFAOYSA-N	229.073893222							114203
BML-259	LSM-6266	SID26756761	16760027	InChI=1S/C14H16N2OS/c1-10(2)12-9-15-14(18-12)16-13(17)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,15,16,17)	IGRZXNLKVUEFDM-UHFFFAOYSA-N	CC(C)c1cnc(NC(=O)Cc2ccccc2)s1	BroadT	BRD-K71799778	BRD-K71799778-001-02-2	Biomol International Inc.	EI-344	2832A(V2.2)-3-N1290		CC(C)c1cnc(NC(=O)Cc2ccccc2)s1	InChI=1S/C14H16N2OS/c1-10(2)12-9-15-14(18-12)16-13(17)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,15,16,17)	IGRZXNLKVUEFDM-UHFFFAOYSA-N	260.098333842							95031
T 98475	LSM-3382	BRD-K62221994, T-98475	9874838	InChI=1S/C37H37F2N3O4S/c1-22(2)35(44)40-26-16-14-25(15-17-26)34-28(19-41(5)18-24-10-7-6-8-11-24)32-33(43)29(37(45)46-23(3)4)21-42(36(32)47-34)20-27-30(38)12-9-13-31(27)39/h6-17,21-23H,18-20H2,1-5H3,(H,40,44)	RANJJVIMTOIWIN-UHFFFAOYSA-N	CC(C)OC(=O)C1=CN(Cc2c(F)cccc2F)c3sc(c(CN(C)Cc4ccccc4)c3C1=O)c5ccc(NC(=O)C(C)C)cc5	BroadT	BRD-K62221994	BRD-K62221994-001-01-8	Tocris Bioscience	2519	1		CC(C)OC(=O)c1cn(Cc2c(F)cccc2F)c2sc(c(CN(C)Cc3ccccc3)c2c1=O)-c1ccc(NC(=O)C(C)C)cc1	InChI=1S/C37H37F2N3O4S/c1-22(2)35(44)40-26-16-14-25(15-17-26)34-28(19-41(5)18-24-10-7-6-8-11-24)32-33(43)29(37(45)46-23(3)4)21-42(36(32)47-34)20-27-30(38)12-9-13-31(27)39/h6-17,21-23H,18-20H2,1-5H3,(H,40,44)	RANJJVIMTOIWIN-UHFFFAOYSA-N	657.247283784							93085, 93085
SB-206553	LSM-2800	SB-206553	5163	InChI=1S/C17H16N4O/c1-20-7-4-12-10-16-13(9-15(12)20)5-8-21(16)17(22)19-14-3-2-6-18-11-14/h2-4,6-7,9-11H,5,8H2,1H3,(H,19,22)	QJQORSLQNXDVGE-UHFFFAOYSA-N	Cn1ccc2cc3N(CCc3cc12)C(=O)Nc4cccnc4	BroadT	BRD-K36395411	BRD-K36395411-003-01-4	Tocris Bioscience	1661	2	Cl	Cn1ccc2cc3N(CCc3cc12)C(=O)Nc1cccnc1.Cl	InChI=1S/C17H16N4O.ClH/c1-20-7-4-12-10-16-13(9-15(12)20)5-8-21(16)17(22)19-14-3-2-6-18-11-14;/h2-4,6-7,9-11H,5,8H2,1H3,(H,19,22);1H	VGEMBOFBPSNOIO-UHFFFAOYSA-N	292.132411172							8977, 8977, 8977
Dicyclomine	LSM-3534	Dicycloverine, Dicyclomine, Bentyl	3042	InChI=1S/C19H35NO2/c1-3-20(4-2)15-16-22-18(21)19(13-9-6-10-14-19)17-11-7-5-8-12-17/h17H,3-16H2,1-2H3	CURUTKGFNZGFSE-UHFFFAOYSA-N	CCN(CC)CCOC(=O)C1(CCCCC1)C2CCCCC2	BroadT	BRD-K68507560	BRD-K68507560-003-04-8	MicroSource Discovery Systems Inc.	1500240		Cl	CCN(CC)CCOC(=O)C1(CCCCC1)C1CCCCC1.Cl	InChI=1S/C19H35NO2.ClH/c1-3-20(4-2)15-16-22-18(21)19(13-9-6-10-14-19)17-11-7-5-8-12-17;/h17H,3-16H2,1-2H3;1H	GUBNMFJOJGDCEL-UHFFFAOYSA-N	309.26677937							4514, 4514
FGIN-143	LSM-3474	FGIN-1-43, SID11113626, SID26751827	3995234	InChI=1S/C28H36Cl2N2O/c1-3-5-7-9-17-32(18-10-8-6-4-2)27(33)20-25-24-19-23(30)15-16-26(24)31-28(25)21-11-13-22(29)14-12-21/h11-16,19,31H,3-10,17-18,20H2,1-2H3	XTZUPNNVXIMWAR-UHFFFAOYSA-N	CCCCCCN(CCCCCC)C(=O)Cc1c([nH]c2ccc(Cl)cc12)c3ccc(Cl)cc3	BroadT	BRD-K66093087	BRD-K66093087-001-01-5	Biomol International Inc.	AC-201	2819-N1292		CCCCCCN(CCCCCC)C(=O)Cc1c([nH]c2ccc(Cl)cc12)-c1ccc(Cl)cc1	InChI=1S/C28H36Cl2N2O/c1-3-5-7-9-17-32(18-10-8-6-4-2)27(33)20-25-24-19-23(30)15-16-26(24)31-28(25)21-11-13-22(29)14-12-21/h11-16,19,31H,3-10,17-18,20H2,1-2H3	XTZUPNNVXIMWAR-UHFFFAOYSA-N	486.220469212							93159
Sulfanitran	LSM-25665	Sulfanitran	5334	InChI=1S/C14H13N3O5S/c1-10(18)15-11-4-8-14(9-5-11)23(21,22)16-12-2-6-13(7-3-12)17(19)20/h2-9,16H,1H3,(H,15,18)	GWBPFRGXNGPPMF-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K76845197	BRD-K76845197-001-01-3	MicroSource Discovery Systems Inc.	1503339			CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)[N+]([O-])=O	InChI=1S/C14H13N3O5S/c1-10(18)15-11-4-8-14(9-5-11)23(21,22)16-12-2-6-13(7-3-12)17(19)20/h2-9,16H,1H3,(H,15,18)	GWBPFRGXNGPPMF-UHFFFAOYSA-N	335.057591236							114204
Thapsigargin	LSM-43008	Thapsigargin	446378	InChI=1S/C34H50O12/c1-9-12-13-14-15-17-24(37)43-28-26-25(20(5)27(28)44-30(38)19(4)11-3)29-34(41,33(8,40)31(39)45-29)22(42-23(36)16-10-2)18-32(26,7)46-21(6)35/h11,22,26-29,40-41H,9-10,12-18H2,1-8H3/b19-11-/t22-,26+,27-,28-,29-,32-,33+,34+/m0/s1	IXFPJGBNCFXKPI-FSIHEZPISA-N	CCCCCCCC(=O)O[C@@H]1[C@@H](OC(=O)\C(=C/C)\C)C(=C2[C@@H]3OC(=O)[C@@](C)(O)[C@@]3(O)[C@H](C[C@](C)(OC(=O)C)[C@@H]12)OC(=O)CCC)C	BroadT	BRD-K69023402	BRD-K69023402-001-02-5	Biomol International Inc.	PE-180	2840(V2)-3-N1305		CCCCCCCC(=O)O[C@@H]1[C@@H](OC(=O)C(\C)=C/C)C(C)=C2[C@@H]3OC(=O)[C@@](C)(O)[C@@]3(O)[C@H](C[C@](C)(OC(C)=O)[C@@H]12)OC(=O)CCC	InChI=1S/C34H50O12/c1-9-12-13-14-15-17-24(37)43-28-26-25(20(5)27(28)44-30(38)19(4)11-3)29-34(41,33(8,40)31(39)45-29)22(42-23(36)16-10-2)18-32(26,7)46-21(6)35/h11,22,26-29,40-41H,9-10,12-18H2,1-8H3/b19-11-/t22-,26+,27-,28-,29-,32-,33+,34+/m0/s1	IXFPJGBNCFXKPI-FSIHEZPISA-N	650.33022704							9516
N-Benzyl-p-toluenesulfonamide	LSM-25666	SID47202766, SID11114237, BRD-K64178227	95801	InChI=1S/C14H15NO2S/c1-12-7-9-14(10-8-12)18(16,17)15-11-13-5-3-2-4-6-13/h2-10,15H,11H2,1H3	WTHKAJZQYNKTCJ-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NCc2ccccc2	BroadT	BRD-K64178227	BRD-K64178227-001-01-7	TimTec LLC	ST001601			Cc1ccc(cc1)S(=O)(=O)NCc1ccccc1	InChI=1S/C14H15NO2S/c1-12-7-9-14(10-8-12)18(16,17)15-11-13-5-3-2-4-6-13/h2-10,15H,11H2,1H3	WTHKAJZQYNKTCJ-UHFFFAOYSA-N	261.08234942							114205
Farnesylthioacetic acid	LSM-42994	Fta, S-Farnesylthioacetic Acid, Farnesylthioacetic Acid	5353623	InChI=1S/C17H28O2S/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-20-13-17(18)19/h7,9,11H,5-6,8,10,12-13H2,1-4H3,(H,18,19)/b15-9+,16-11+	GNWWFEVBHYESNK-XGGJEREUSA-N	CC(=CCC\C(=C\CC\C(=C\CSCC(=O)O)\C)\C)C	BroadT	BRD-K63089472	BRD-K63089472-001-02-7	Biomol International Inc.	G222	2840(V2)-3-N1305		CC(C)=CCC\C(C)=C\CC\C(C)=C\CSCC(O)=O	InChI=1S/C17H28O2S/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-20-13-17(18)19/h7,9,11H,5-6,8,10,12-13H2,1-4H3,(H,18,19)/b15-9+,16-11+	GNWWFEVBHYESNK-XGGJEREUSA-N	296.181000826							
Arecaidine but-2-ynyl ester	LSM-3424	BRD-K63792901, AC1N6FGH, SID26756579	4214594	InChI=1S/C11H15NO2/c1-3-4-8-14-11(13)10-6-5-7-12(2)9-10/h6H,5,7-9H2,1-2H3	LBFWTPRSXIRKMZ-UHFFFAOYSA-N	CC#CCOC(=O)C1=CCCN(C)C1	BroadT	BRD-K63792901	BRD-K63792901-075-01-3	Tocris Bioscience	382	1	Cc1ccc(cc1)S(=O)(=O)O	CC#CCOC(=O)C1=CCCN(C)C1.Cc1ccc(cc1)S(=O)(=O)O	InChI=1S/C11H15NO2.C7H8O3S/c1-3-4-8-14-11(13)10-6-5-7-12(2)9-10;1-6-2-4-7(5-3-6)11(8,9)10/h6H,5,7-9H2,1-2H3;2-5H,1H3,(H,8,9,10)	GKPXMGUNTQSFGA-UHFFFAOYSA-N	193.11027873							93117, 93117
Lidoflazine	LSM-3397	Clinium, Lidoflazine, Angex, MCN-JR-7904, R-7904	3926	InChI=1S/C30H35F2N3O/c1-22-5-3-6-23(2)30(22)33-29(36)21-35-19-17-34(18-20-35)16-4-7-28(24-8-12-26(31)13-9-24)25-10-14-27(32)15-11-25/h3,5-6,8-15,28H,4,7,16-21H2,1-2H3,(H,33,36)	ZBIAKUMOEKILTF-UHFFFAOYSA-N	Cc1cccc(C)c1NC(=O)CN2CCN(CCCC(c3ccc(F)cc3)c4ccc(F)cc4)CC2	BroadT	BRD-K62996583	BRD-K62996583-001-03-8	Prestwick Chemical Inc.	Prestw-381	D0701-MP04-ST03-200-		Cc1cccc(C)c1NC(=O)CN1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1	InChI=1S/C30H35F2N3O/c1-22-5-3-6-23(2)30(22)33-29(36)21-35-19-17-34(18-20-35)16-4-7-28(24-8-12-26(31)13-9-24)25-10-14-27(32)15-11-25/h3,5-6,8-15,28H,4,7,16-21H2,1-2H3,(H,33,36)	ZBIAKUMOEKILTF-UHFFFAOYSA-N	491.27481917							93095
SPECTRUM5_001963	LSM-44129	Nagcys, SID26754867, SID26754868	10063341	InChI=1S/C15H25NO3S/c1-11(2)6-5-7-12(3)8-9-20-10-14(15(18)19)16-13(4)17/h6,8,14H,5,7,9-10H2,1-4H3,(H,16,17)(H,18,19)/b12-8+/t14-/m0/s1	YWGFJCHHZZUWCO-BCNIOPEESA-N	CC(=CCC\C(=C\CSC[C@H](NC(=O)C)C(=O)O)\C)C	BroadT	BRD-K64729807	BRD-K64729807-001-02-3	Biomol International Inc.	G221	2840(V2)-3-N1305		CC(=O)N[C@@H](CSC\C=C(/C)CCC=C(C)C)C(O)=O	InChI=1S/C15H25NO3S/c1-11(2)6-5-7-12(3)8-9-20-10-14(15(18)19)16-13(4)17/h6,8,14H,5,7,9-10H2,1-4H3,(H,16,17)(H,18,19)/b12-8+/t14-/m0/s1	YWGFJCHHZZUWCO-BCNIOPEESA-N	299.15551436							
Austricin	LSM-3434	Austricine, Austricin	6713966	InChI=1S/C15H18O4/c1-6-4-10(17)13-8(3)15(18)19-14(13)12-7(2)5-9(16)11(6)12/h5,8,10,12-14,17H,4H2,1-3H3/t8-,10-,12-,13+,14+/m0/s1	YMUOZXZDDBRJEP-XUNJKSNWSA-N	C[C@H]1[C@@H]2[C@@H](O)CC(=C3[C@@H]([C@H]2OC1=O)C(=CC3=O)C)C	BroadT	BRD-K64236792	BRD-K64236792-002-03-2	Prestwick Chemical Inc.	Prestw-681	D0701-MP04-ST03-200-	O	C[C@H]1[C@H]2[C@H](OC1=O)[C@H]1C(C)=CC(=O)C1=C(C)C[C@@H]2O.O	InChI=1S/C15H18O4.H2O/c1-6-4-10(17)13-8(3)15(18)19-14(13)12-7(2)5-9(16)11(6)12;/h5,8,10,12-14,17H,4H2,1-3H3;1H2/t8-,10-,12-,13+,14+;/m0./s1	ADUHAEBXPKBNDK-OULSSNOLSA-N	262.120509056							93124, 93124
GW843682X	LSM-1014	GW-843682X, GW843682X	9826308	InChI=1S/C22H18F3N3O4S/c1-30-16-7-14-15(8-17(16)31-2)28(11-27-14)19-9-18(20(33-19)21(26)29)32-10-12-5-3-4-6-13(12)22(23,24)25/h3-9,11H,10H2,1-2H3,(H2,26,29)	JSKUWFIZUALZLX-UHFFFAOYSA-N	COc1cc2ncn(c3cc(OCc4ccccc4C(F)(F)F)c(s3)C(=O)N)c2cc1OC	BroadT	BRD-K90382497	BRD-K90382497-001-01-6	Axon Medchem	GW-843682X			COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(s3)C(N)=O)c2cc1OC	InChI=1S/C22H18F3N3O4S/c1-30-16-7-14-15(8-17(16)31-2)28(11-27-14)19-9-18(20(33-19)21(26)29)32-10-12-5-3-4-6-13(12)22(23,24)25/h3-9,11H,10H2,1-2H3,(H2,26,29)	JSKUWFIZUALZLX-UHFFFAOYSA-N	477.097011376							91334
Iodipamide	LSM-3496	Adipiodone, Cholografin, Iodipamide	3739	InChI=1S/C20H14I6N2O6/c21-7-5-9(23)17(15(25)13(7)19(31)32)27-11(29)3-1-2-4-12(30)28-18-10(24)6-8(22)14(16(18)26)20(33)34/h5-6H,1-4H2,(H,27,29)(H,28,30)(H,31,32)(H,33,34)	FFINMCNLQNTKLU-UHFFFAOYSA-N	OC(=O)c1c(I)cc(I)c(NC(=O)CCCCC(=O)Nc2c(I)cc(I)c(C(=O)O)c2I)c1I	BroadT	BRD-K67261995	BRD-K67261995-001-03-4	Prestwick Chemical Inc.	Prestw-939	D0701-MP04-ST03-200-		OC(=O)c1c(I)cc(I)c(NC(=O)CCCCC(=O)Nc2c(I)cc(I)c(C(O)=O)c2I)c1I	InChI=1S/C20H14I6N2O6/c21-7-5-9(23)17(15(25)13(7)19(31)32)27-11(29)3-1-2-4-12(30)28-18-10(24)6-8(22)14(16(18)26)20(33)34/h5-6H,1-4H2,(H,27,29)(H,28,30)(H,31,32)(H,33,34)	FFINMCNLQNTKLU-UHFFFAOYSA-N	1139.511994188							, , , 
MLS001047162	LSM-15502	BRD-K26706039	3795476	InChI=1S/C31H48N2O3/c1-7-32(5,8-2)19-11-13-21-35-25-15-17-27-28-18-16-26(24-30(28)31(34)29(27)23-25)36-22-14-12-20-33(6,9-3)10-4/h15-18,23-24H,7-14,19-22H2,1-6H3/q+2	XXFYBCRYOMKRSF-UHFFFAOYSA-N	CC[N+](C)(CC)CCCCOc1ccc2c(c1)C(=O)c3cc(OCCCC[N+](C)(CC)CC)ccc23	BroadT	BRD-K26706039	BRD-K26706039-005-05-2	InterBioScreen Ltd.	STOCK3S-26623		I	CC[N+](C)(CC)CCCCOc1ccc2-c3ccc(OCCCC[N+](C)(CC)CC)cc3C(=O)c2c1.I	InChI=1S/C31H48N2O3.HI/c1-7-32(5,8-2)19-11-13-21-35-25-15-17-27-28-18-16-26(24-30(28)31(34)29(27)23-25)36-22-14-12-20-33(6,9-3)10-4;/h15-18,23-24H,7-14,19-22H2,1-6H3;1H/q+2;	VTDGXSAKZMOCJX-UHFFFAOYSA-N	496.366493416							104143, 104143
Methyl 5-(4-fluorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate	LSM-25668	SID849948, BRD-K73731096	652458	InChI=1S/C15H9F4N3O2/c1-24-14(23)10-7-20-22-12(15(17,18)19)6-11(21-13(10)22)8-2-4-9(16)5-3-8/h2-7H,1H3	XOEPHPISEVENKE-UHFFFAOYSA-N	COC(=O)c1cnn2c(cc(nc12)c3ccc(F)cc3)C(F)(F)F	BroadT	BRD-K73731096	BRD-K73731096-001-05-1	Asinex Ltd.	BAS 01515745			COC(=O)c1cnn2c(cc(nc12)-c1ccc(F)cc1)C(F)(F)F	InChI=1S/C15H9F4N3O2/c1-24-14(23)10-7-20-22-12(15(17,18)19)6-11(21-13(10)22)8-2-4-9(16)5-3-8/h2-7H,1H3	XOEPHPISEVENKE-UHFFFAOYSA-N	339.063089358							114207
AC1MUY82	LSM-25669	SID26749706, SID49670466, BRD-A82599961	3649024	InChI=1S/C16H16O5/c1-9(17)21-16(2,3)14-7-11-6-10-4-5-15(18)20-12(10)8-13(11)19-14/h4-6,8,14H,7H2,1-3H3	XBEFQTHUADKZEH-UHFFFAOYSA-N	CC(=O)OC(C)(C)C1Cc2cc3C=CC(=O)Oc3cc2O1	BroadT	BRD-A82599961	BRD-A82599961-001-05-5	ChemDiv Inc.	6944-0079			CC(=O)OC(C)(C)C1Cc2cc3ccc(=O)oc3cc2O1	InChI=1S/C16H16O5/c1-9(17)21-16(2,3)14-7-11-6-10-4-5-15(18)20-12(10)8-13(11)19-14/h4-6,8,14H,7H2,1-3H3	XBEFQTHUADKZEH-UHFFFAOYSA-N	288.099773612							114208
MLS000876804	LSM-44130	SID24841420, BRD-A71402194	12315418	InChI=1S/C21H23ClO5/c1-6-12(2)9-13(3)7-8-15-10-16-17(11-26-15)19(24)21(5,27-14(4)23)20(25)18(16)22/h7-12H,6H2,1-5H3/b8-7+,13-9+	SWJLTKXURNHVHE-NJHPPEEMSA-N	CCC(C)\C=C(/C)\C=C\C1=CC2=C(Cl)C(=O)C(C)(OC(=O)C)C(=O)C2=CO1	BroadT	BRD-A71402194	BRD-A71402194-001-07-0	AnalytiCon Discovery GmbH	NP-002583			CCC(C)\C=C(C)\C=C\C1=CC2=C(Cl)C(=O)C(C)(OC(C)=O)C(=O)C2=CO1	InChI=1S/C21H23ClO5/c1-6-12(2)9-13(3)7-8-15-10-16-17(11-26-15)19(24)21(5,27-14(4)23)20(25)18(16)22/h7-12H,6H2,1-5H3/b8-7+,13-9+	SWJLTKXURNHVHE-NJHPPEEMSA-N	390.123401546							
T0514-7298	LSM-25671	SID24830948, BRD-K89433368	2396810	InChI=1S/C18H20N4S/c1-3-12-6-5-7-13(4-2)17(12)21-18(23)20-15-9-8-14-11-19-22-16(14)10-15/h5-11H,3-4H2,1-2H3,(H,19,22)(H2,20,21,23)	NIRAEDMQSDEMES-UHFFFAOYSA-N	CCc1cccc(CC)c1N=C(S)Nc2ccc3c[nH]nc3c2	BroadT	BRD-K89433368	BRD-K89433368-001-05-7	Enamine Ltd.	T0514-7298			CCc1cccc(CC)c1N=C(S)Nc1ccc2c[nH]nc2c1	InChI=1S/C18H20N4S/c1-3-12-6-5-7-13(4-2)17(12)21-18(23)20-15-9-8-14-11-19-22-16(14)10-15/h5-11H,3-4H2,1-2H3,(H,19,22)(H2,20,21,23)	NIRAEDMQSDEMES-UHFFFAOYSA-N	324.14086737							114210
2-{[4-Ethyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethanone	LSM-25672	SID14741484, BRD-K85694064	1941859	InChI=1S/C18H19N3OS2/c1-3-21-17(11-15-5-4-10-23-15)19-20-18(21)24-12-16(22)14-8-6-13(2)7-9-14/h4-10H,3,11-12H2,1-2H3	OAUMKTQGRKVSHL-UHFFFAOYSA-N	CCn1c(Cc2cccs2)nnc1SCC(=O)c3ccc(C)cc3	BroadT	BRD-K85694064	BRD-K85694064-001-05-5	InterBioScreen Ltd.	STOCK5S-48338			CCn1c(Cc2cccs2)nnc1SCC(=O)c1ccc(C)cc1	InChI=1S/C18H19N3OS2/c1-3-21-17(11-15-5-4-10-23-15)19-20-18(21)24-12-16(22)14-8-6-13(2)7-9-14/h4-10H,3,11-12H2,1-2H3	OAUMKTQGRKVSHL-UHFFFAOYSA-N	357.096953638							114211
AK-968/41923600	LSM-25673	SID22414273, BRD-A69759535	5152527	InChI=1S/C16H16F3N5O5/c1-8-6-15(26,16(17,18)19)23(20-8)14(25)12-5-4-11(29-12)7-22-10(3)13(24(27)28)9(2)21-22/h4-5,26H,6-7H2,1-3H3	FUHDQGAGIQCGHN-UHFFFAOYSA-N	CC1=NN(C(=O)c2oc(Cn3nc(C)c(c3C)[N+](=O)[O-])cc2)C(O)(C1)C(F)(F)F	BroadT	BRD-A69759535	BRD-A69759535-001-05-9	Specs	AK-968/41923600			CC1=NN(C(=O)c2ccc(Cn3nc(C)c(c3C)[N+]([O-])=O)o2)C(O)(C1)C(F)(F)F	InChI=1S/C16H16F3N5O5/c1-8-6-15(26,16(17,18)19)23(20-8)14(25)12-5-4-11(29-12)7-22-10(3)13(24(27)28)9(2)21-22/h4-5,26H,6-7H2,1-3H3	FUHDQGAGIQCGHN-UHFFFAOYSA-N	415.110353262							114212
Ethyl 1-(4-chlorobenzyl)-4-[(4-chlorophenyl)sulfonyl]-4-piperidinecarboxylate	LSM-25674	SID17402532, BRD-K29125586	3770355	InChI=1S/C21H23Cl2NO4S/c1-2-28-20(25)21(29(26,27)19-9-7-18(23)8-10-19)11-13-24(14-12-21)15-16-3-5-17(22)6-4-16/h3-10H,2,11-15H2,1H3	SLDHMWQQBRXOPJ-UHFFFAOYSA-N	CCOC(=O)C1(CCN(Cc2ccc(Cl)cc2)CC1)S(=O)(=O)c3ccc(Cl)cc3	BroadT	BRD-K29125586	BRD-K29125586-001-05-8	Key Organics Ltd.	9X-0950			CCOC(=O)C1(CCN(Cc2ccc(Cl)cc2)CC1)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H23Cl2NO4S/c1-2-28-20(25)21(29(26,27)19-9-7-18(23)8-10-19)11-13-24(14-12-21)15-16-3-5-17(22)6-4-16/h3-10H,2,11-15H2,1H3	SLDHMWQQBRXOPJ-UHFFFAOYSA-N	455.072484336							114213
MLS001048918	LSM-25675	SID24824086, BRD-A10076362	16195645	InChI=1S/C20H23NO4/c1-13-16-10-19(23-3)18(22-2)9-15(16)6-7-21(13)11-14-4-5-17-20(8-14)25-12-24-17/h4-5,8-10,13H,6-7,11-12H2,1-3H3	BSDPQEFENGLTDD-UHFFFAOYSA-N	COc1cc2CCN(Cc3ccc4OCOc4c3)C(C)c2cc1OC	BroadT	BRD-A10076362	BRD-A10076362-001-04-9	InterBioScreen Ltd.	STOCK1N-66646			COc1cc2CCN(Cc3ccc4OCOc4c3)C(C)c2cc1OC	InChI=1S/C20H23NO4/c1-13-16-10-19(23-3)18(22-2)9-15(16)6-7-21(13)11-14-4-5-17-20(8-14)25-12-24-17/h4-5,8-10,13H,6-7,11-12H2,1-3H3	BSDPQEFENGLTDD-UHFFFAOYSA-N	341.162708226							114214
AC1N63AN	LSM-25676	BRD-K25018561	4253662	InChI=1S/C11H14N6O2/c1-7(15-16-11-13-4-5-14-11)8-2-3-9(12)10(6-8)17(18)19/h2-3,6H,4-5,12H2,1H3,(H2,13,14,16)	LAQRLYGYWHSSGZ-UHFFFAOYSA-N	CC(=NNC1=NCCN1)c2ccc(N)c(c2)[N+](=O)[O-]	BroadT	BRD-K25018561	BRD-K25018561-001-06-6	InterBioScreen Ltd.	STOCK3S-27747			CC(=NNC1=NCCN1)c1ccc(N)c(c1)[N+]([O-])=O	InChI=1S/C11H14N6O2/c1-7(15-16-11-13-4-5-14-11)8-2-3-9(12)10(6-8)17(18)19/h2-3,6H,4-5,12H2,1H3,(H2,13,14,16)	LAQRLYGYWHSSGZ-UHFFFAOYSA-N	262.117823748							114215
AC1ME3OW	LSM-25677	BRD-A55485536	2821091	InChI=1S/C13H13NO4S2/c1-3-17-12(15)11-8-5-4-7-6-18-14-10(7)9(8)13(19-11)20(2)16/h6H,3-5H2,1-2H3	USHCPDWUWDCEDT-UHFFFAOYSA-N	CCOC(=O)c1sc(c2c1CCc3conc23)S(=O)C	BroadT	BRD-A55485536	BRD-A55485536-001-04-9	Maybridge	KM 05465			CCOC(=O)c1sc(c-2c1CCc1conc-21)S(C)=O	InChI=1S/C13H13NO4S2/c1-3-17-12(15)11-8-5-4-7-6-18-14-10(7)9(8)13(19-11)20(2)16/h6H,3-5H2,1-2H3	USHCPDWUWDCEDT-UHFFFAOYSA-N	311.028599286							114216
SMR000029857	LSM-25678	SID4251379, SID24838526, BRD-K93489341	3245076	InChI=1S/C21H18Cl2N6O3/c22-13-3-4-15(16(23)10-13)21(31)28-7-5-12(6-8-28)18-24-19-17(20(30)25-18)26-27-29(19)11-14-2-1-9-32-14/h1-4,9-10,12H,5-8,11H2,(H,24,25,30)	HHHVTURQCNOIJO-UHFFFAOYSA-N	Oc1nc(nc2c1nnn2Cc3occc3)C4CCN(CC4)C(=O)c5ccc(Cl)cc5Cl	BroadT	BRD-K93489341	BRD-K93489341-001-05-5	ChemDiv Inc.	D023-0052			Oc1nc(nc2n(Cc3ccco3)nnc12)C1CCN(CC1)C(=O)c1ccc(Cl)cc1Cl	InChI=1S/C21H18Cl2N6O3/c22-13-3-4-15(16(23)10-13)21(31)28-7-5-12(6-8-28)18-24-19-17(20(30)25-18)26-27-29(19)11-14-2-1-9-32-14/h1-4,9-10,12H,5-8,11H2,(H,24,25,30)	HHHVTURQCNOIJO-UHFFFAOYSA-N	472.081743916							
BRD-A71195027	LSM-25679			InChI=1S/C22H23N3O2S/c1-14-19(21(26)27-15-8-3-2-4-9-15)20(18-12-7-13-28-18)25-17-11-6-5-10-16(17)24-22(25)23-14/h5-7,10-13,15,19-20H,2-4,8-9H2,1H3	QKTLZXOVUPUVFM-UHFFFAOYSA-N	CC1=Nc2nc3ccccc3n2C(C1C(=O)OC4CCCCC4)c5cccs5	BroadT	BRD-A71195027	BRD-A71195027-001-06-5	ChemDiv Inc.	C202-0123			CC1=Nc2nc3ccccc3n2C(C1C(=O)OC1CCCCC1)c1cccs1	InChI=1S/C22H23N3O2S/c1-14-19(21(26)27-15-8-3-2-4-9-15)20(18-12-7-13-28-18)25-17-11-6-5-10-16(17)24-22(25)23-14/h5-7,10-13,15,19-20H,2-4,8-9H2,1H3	QKTLZXOVUPUVFM-UHFFFAOYSA-N	393.151097696							114218
STK168457	LSM-44131	SID17414617, BRD-K16791875	2300497	InChI=1S/C20H19NO3S/c1-4-24-20(23)18-14(3)21(15-9-7-13(2)8-10-15)19(22)17(18)12-16-6-5-11-25-16/h5-12H,4H2,1-3H3/b17-12-	HQEVAWZHUQQXMP-ATVHPVEESA-N	CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c2cccs2)c3ccc(C)cc3	BroadT	BRD-K16791875	BRD-K16791875-001-05-2	ChemBridge Corporation	7033273			CCOC(=O)C1=C(C)N(C(=O)C\1=C/c1cccs1)c1ccc(C)cc1	InChI=1S/C20H19NO3S/c1-4-24-20(23)18-14(3)21(15-9-7-13(2)8-10-15)19(22)17(18)12-16-6-5-11-25-16/h5-12H,4H2,1-3H3/b17-12-	HQEVAWZHUQQXMP-ATVHPVEESA-N	353.108564168							
T5519666	LSM-25681	SID49672615, BRD-A36720314	16285083	InChI=1S/C21H16BrN3O2/c22-16-7-5-14(6-8-16)18-13-19(17-3-1-2-4-20(17)26)25(24-18)21(27)15-9-11-23-12-10-15/h1-12,19,26H,13H2	MSZXBQPIAUHVDL-UHFFFAOYSA-N	Oc1ccccc1C2CC(=NN2C(=O)c3ccncc3)c4ccc(Br)cc4	BroadT	BRD-A36720314	BRD-A36720314-001-05-8	Enamine Ltd.	T5519666			Oc1ccccc1C1CC(=NN1C(=O)c1ccncc1)c1ccc(Br)cc1	InChI=1S/C21H16BrN3O2/c22-16-7-5-14(6-8-16)18-13-19(17-3-1-2-4-20(17)26)25(24-18)21(27)15-9-11-23-12-10-15/h1-12,19,26H,13H2	MSZXBQPIAUHVDL-UHFFFAOYSA-N	421.042589382							114220
MLS000119872	LSM-25682	SID7968252, BRD-K58803272	5309307	InChI=1S/C18H20N4OS/c1-12-7-8-15-16(9-12)24-18(19-15)20-17(23)11-22-10-13-5-3-2-4-6-14(13)21-22/h7-10H,2-6,11H2,1H3,(H,19,20,23)	YFILQGOSMMYHAX-UHFFFAOYSA-N	Cc1ccc2nc(NC(=O)Cn3cc4CCCCCc4n3)sc2c1	BroadT	BRD-K58803272	BRD-K58803272-001-04-6	ChemDiv Inc.	C881-1048			Cc1ccc2nc(NC(=O)Cn3cc4CCCCCc4n3)sc2c1	InChI=1S/C18H20N4OS/c1-12-7-8-15-16(9-12)24-18(19-15)20-17(23)11-22-10-13-5-3-2-4-6-14(13)21-22/h7-10H,2-6,11H2,1H3,(H,19,20,23)	YFILQGOSMMYHAX-UHFFFAOYSA-N	340.13578199							114221
STK327710	LSM-25683	SID17434087, BRD-K06251503	1281095	InChI=1S/C25H21N3O2S/c29-23(27-15-14-18-8-4-5-9-19(18)16-27)17-31-25-26-22-13-7-6-12-21(22)24(30)28(25)20-10-2-1-3-11-20/h1-13H,14-17H2	IILKGOLIBHQGOP-UHFFFAOYSA-N	O=C(CSC1=Nc2ccccc2C(=O)N1c3ccccc3)N4CCc5ccccc5C4	BroadT	BRD-K06251503	BRD-K06251503-001-06-7	ChemBridge Corporation	7704131			O=C(CSc1nc2ccccc2c(=O)n1-c1ccccc1)N1CCc2ccccc2C1	InChI=1S/C25H21N3O2S/c29-23(27-15-14-18-8-4-5-9-19(18)16-27)17-31-25-26-22-13-7-6-12-21(22)24(30)28(25)20-10-2-1-3-11-20/h1-13H,14-17H2	IILKGOLIBHQGOP-UHFFFAOYSA-N	427.135447632							114222
MLS000088980	LSM-25684	SID4264218, SID26668757, BRD-K09382144	2193118	InChI=1S/C23H18N4O2S/c1-27-22(15-7-3-2-4-8-15)25-26-23(27)30-14-21(28)24-16-11-12-18-17-9-5-6-10-19(17)29-20(18)13-16/h2-13H,14H2,1H3,(H,24,28)	XSQXHRXJCIKADP-UHFFFAOYSA-N	Cn1c(SCC(=O)Nc2ccc3c(oc4ccccc34)c2)nnc1c5ccccc5	BroadT	BRD-K09382144	BRD-K09382144-001-06-2	ChemBridge Corporation	7540894			Cn1c(SCC(=O)Nc2ccc3c(c2)oc2ccccc32)nnc1-c1ccccc1	InChI=1S/C23H18N4O2S/c1-27-22(15-7-3-2-4-8-15)25-26-23(27)30-14-21(28)24-16-11-12-18-17-9-5-6-10-19(17)29-20(18)13-16/h2-13H,14H2,1H3,(H,24,28)	XSQXHRXJCIKADP-UHFFFAOYSA-N	414.115046546							114223
CHEMDIV1_015496	LSM-25685	SID24822761, BRD-K41914390	3639475	InChI=1S/C19H13Br2N5OS/c20-12-3-1-11(2-4-12)16(27)10-28-19-24-18-15(9-23-25-18)17(22)26(19)14-7-5-13(21)6-8-14/h1-9H,10,22H2	BDSDAYGNIWJNKN-UHFFFAOYSA-N	Nc1c2cnnc2nc(SCC(=O)c3ccc(Br)cc3)n1c4ccc(Br)cc4	BroadT	BRD-K41914390	BRD-K41914390-001-06-3	ChemDiv Inc.	K781-5849			Nc1n(-c2ccc(Br)cc2)c(SCC(=O)c2ccc(Br)cc2)nc2nncc12	InChI=1S/C19H13Br2N5OS/c20-12-3-1-11(2-4-12)16(27)10-28-19-24-18-15(9-23-25-18)17(22)26(19)14-7-5-13(21)6-8-14/h1-9H,10,22H2	BDSDAYGNIWJNKN-UHFFFAOYSA-N	516.920755976							114224
6-Methoxy-3-phenyl[1,2,4]triazolo[4,3-b]pyridazine	LSM-25686	SID7971952, BRD-K86634627	754096	InChI=1S/C12H10N4O/c1-17-11-8-7-10-13-14-12(16(10)15-11)9-5-3-2-4-6-9/h2-8H,1H3	ZKAUQAJMTRMCCA-UHFFFAOYSA-N	COc1ccc2nnc(c3ccccc3)n2n1	BroadT	BRD-K86634627	BRD-K86634627-001-05-0	ChemBridge Corporation	5269767			COc1ccc2nnc(-c3ccccc3)n2n1	InChI=1S/C12H10N4O/c1-17-11-8-7-10-13-14-12(16(10)15-11)9-5-3-2-4-6-9/h2-8H,1H3	ZKAUQAJMTRMCCA-UHFFFAOYSA-N	226.08546098							114225
ZINC13125156	LSM-44132	SID14733989, SID29217653, BRD-K46786099	54742271	InChI=1S/C17H16O7/c1-9-6-12(19)15(17(21)24-9)11(18)5-4-10-7-13(22-2)16(20)14(8-10)23-3/h4-8,19-20H,1-3H3/b5-4+	NCXJIWTVFHYSKF-SNAWJCMRSA-N	COc1cc(\C=C\C(=O)C2=C(O)C=C(C)OC2=O)cc(OC)c1O	BroadT	BRD-K46786099	BRD-K46786099-001-05-6	ChemBridge Corporation	5118575			COc1cc(cc(OC)c1O)\C=C\C(=O)c1c(O)cc(C)oc1=O	InChI=1S/C17H16O7/c1-9-6-12(19)15(17(21)24-9)11(18)5-4-10-7-13(22-2)16(20)14(8-10)23-3/h4-8,19-20H,1-3H3/b5-4+	NCXJIWTVFHYSKF-SNAWJCMRSA-N	332.089602852							
SMR000059754	LSM-25688	SID24841081, SID862100, BRD-A97481919	663322	InChI=1S/C19H16BrN3O3/c1-10-16-17(22-21-10)19(25)23(13-6-4-12(20)5-7-13)18(16)11-3-8-14(24)15(9-11)26-2/h3-9,18,24H,1-2H3,(H,21,22)	UOECAPWPCCDDCK-UHFFFAOYSA-N	COc1cc(ccc1O)C2N(C(=O)c3[nH]nc(C)c23)c4ccc(Br)cc4	BroadT	BRD-A97481919	BRD-A97481919-001-05-2	InterBioScreen Ltd.	STOCK4S-28132			COc1cc(ccc1O)C1N(C(=O)c2[nH]nc(C)c12)c1ccc(Br)cc1	InChI=1S/C19H16BrN3O3/c1-10-16-17(22-21-10)19(25)23(13-6-4-12(20)5-7-13)18(16)11-3-8-14(24)15(9-11)26-2/h3-9,18,24H,1-2H3,(H,21,22)	UOECAPWPCCDDCK-UHFFFAOYSA-N	413.037504002							114227
F0012-0470	LSM-25689	SID7971331, BRD-K99022678	2598892	InChI=1S/C16H18N2O3S/c1-12-5-4-6-14(11-12)17-16(19)13-7-9-15(10-8-13)22(20,21)18(2)3/h4-11H,1-3H3,(H,17,19)	GULOENYOTPLCJV-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc2cccc(C)c2	BroadT	BRD-K99022678	BRD-K99022678-001-04-4	Life Chemicals Inc.	F0012-0470			CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc1cccc(C)c1	InChI=1S/C16H18N2O3S/c1-12-5-4-6-14(11-12)17-16(19)13-7-9-15(10-8-13)22(20,21)18(2)3/h4-11H,1-3H3,(H,17,19)	GULOENYOTPLCJV-UHFFFAOYSA-N	318.103813146							114228
Benzamide, n-[[(4,6-dimethyl-2-pyrimidinyl)amino]thioxomethyl]-	LSM-25690	SID47197800, BRD-K57070584	797908	InChI=1S/C14H14N4OS/c1-9-8-10(2)16-13(15-9)18-14(20)17-12(19)11-6-4-3-5-7-11/h3-8H,1-2H3,(H2,15,16,17,18,19,20)	OXVLEIAERHXYHU-UHFFFAOYSA-N	Cc1cc(C)nc(NC(=S)NC(=O)c2ccccc2)n1	BroadT	BRD-K57070584	BRD-K57070584-001-05-3	ChemBridge Corporation	6842274			Cc1cc(C)nc(NC(=S)NC(=O)c2ccccc2)n1	InChI=1S/C14H14N4OS/c1-9-8-10(2)16-13(15-9)18-14(20)17-12(19)11-6-4-3-5-7-11/h3-8H,1-2H3,(H2,15,16,17,18,19,20)	OXVLEIAERHXYHU-UHFFFAOYSA-N	286.088831798							114229
MLS000584614	LSM-25691	SID17510539, BRD-A96652063	12005249	InChI=1S/C21H27N3O4/c1-13-7-9-16-17(11-13)21(26)23(20(16)25)15-8-10-18(19(12-15)24(27)28)22-14-5-3-2-4-6-14/h8,10,12-14,16-17,22H,2-7,9,11H2,1H3	LATQFWPCIRVICJ-UHFFFAOYSA-N	CC1CCC2C(C1)C(=O)N(C2=O)c3ccc(NC4CCCCC4)c(c3)[N+](=O)[O-]	BroadT	BRD-A96652063	BRD-A96652063-001-06-1	ChemDiv Inc.	K807-0673			CC1CCC2C(C1)C(=O)N(C2=O)c1ccc(NC2CCCCC2)c(c1)[N+]([O-])=O	InChI=1S/C21H27N3O4/c1-13-7-9-16-17(11-13)21(26)23(20(16)25)15-8-10-18(19(12-15)24(27)28)22-14-5-3-2-4-6-14/h8,10,12-14,16-17,22H,2-7,9,11H2,1H3	LATQFWPCIRVICJ-UHFFFAOYSA-N	385.200156374							114230
MLS000086219	LSM-25692	SID4243415, BRD-K56209150	3238140	InChI=1S/C15H10N2O3/c18-14(17-10-4-3-7-16-8-10)13-9-20-15(19)12-6-2-1-5-11(12)13/h1-9H,(H,17,18)	IWBSJWRTLHYIEW-UHFFFAOYSA-N	O=C(Nc1cccnc1)C2=COC(=O)c3ccccc23	BroadT	BRD-K56209150	BRD-K56209150-001-06-0	ChemDiv Inc.	C066-2195			O=C(Nc1cccnc1)c1coc(=O)c2ccccc12	InChI=1S/C15H10N2O3/c18-14(17-10-4-3-7-16-8-10)13-9-20-15(19)12-6-2-1-5-11(12)13/h1-9H,(H,17,18)	IWBSJWRTLHYIEW-UHFFFAOYSA-N	266.0691422							114231
BAS 05427628	LSM-25693	SID14722151, BRD-K44542386	1079884	InChI=1S/C14H14N4/c1-9-8-12(15)18-14(16-9)13(10(2)17-18)11-6-4-3-5-7-11/h3-8H,15H2,1-2H3	NTSHQXQHVLGYOP-UHFFFAOYSA-N	Cc1cc(N)n2nc(C)c(c3ccccc3)c2n1	BroadT	BRD-K44542386	BRD-K44542386-001-05-7	Asinex Ltd.	BAS 05427628			Cc1nn2c(N)cc(C)nc2c1-c1ccccc1	InChI=1S/C14H14N4/c1-9-8-12(15)18-14(16-9)13(10(2)17-18)11-6-4-3-5-7-11/h3-8H,15H2,1-2H3	NTSHQXQHVLGYOP-UHFFFAOYSA-N	238.121846488							114232
MLS000095618	LSM-25694	SID4249652, BRD-K54963811	3243577	InChI=1S/C17H14ClN3O3/c18-11-3-4-14-13(10-11)17(23)21-5-1-2-12(15(21)19-14)16(22)20-6-8-24-9-7-20/h1-5,10H,6-9H2	UHWZOIHSRIYUPN-UHFFFAOYSA-N	Clc1ccc2N=C3N(C=CC=C3C(=O)N4CCOCC4)C(=O)c2c1	BroadT	BRD-K54963811	BRD-K54963811-001-05-7	ChemDiv Inc.	K306-0203			Clc1ccc2nc3c(cccn3c(=O)c2c1)C(=O)N1CCOCC1	InChI=1S/C17H14ClN3O3/c18-11-3-4-14-13(10-11)17(23)21-5-1-2-12(15(21)19-14)16(22)20-6-8-24-9-7-20/h1-5,10H,6-9H2	UHWZOIHSRIYUPN-UHFFFAOYSA-N	343.072369048							114233
SMR000170947	LSM-25695	SID17507905, BRD-A07245571	3185254	InChI=1S/C25H32N2O6S3/c1-5-19(2)26-35(28,29)22-9-11-23(12-10-22)36(30,31)27(18-21-7-6-16-34-21)15-14-20-8-13-24(32-3)25(17-20)33-4/h6-13,16-17,19,26H,5,14-15,18H2,1-4H3	STGROPKKZNMECS-UHFFFAOYSA-N	CCC(C)NS(=O)(=O)c1ccc(cc1)S(=O)(=O)N(CCc2ccc(OC)c(OC)c2)Cc3cccs3	BroadT	BRD-A07245571	BRD-A07245571-001-06-7	Asinex Ltd.	ASN 04364230			CCC(C)NS(=O)(=O)c1ccc(cc1)S(=O)(=O)N(CCc1ccc(OC)c(OC)c1)Cc1cccs1	InChI=1S/C25H32N2O6S3/c1-5-19(2)26-35(28,29)22-9-11-23(12-10-22)36(30,31)27(18-21-7-6-16-34-21)15-14-20-8-13-24(32-3)25(17-20)33-4/h6-13,16-17,19,26H,5,14-15,18H2,1-4H3	STGROPKKZNMECS-UHFFFAOYSA-N	552.142248834							114234
MLS000044907	LSM-25696	SID4250505, BRD-K80551287	3244305	InChI=1S/C24H29N5O3/c1-17-14-22(29-11-9-28(2)10-12-29)27-21-6-5-18(15-20(17)21)26-24(31)8-7-23(30)25-16-19-4-3-13-32-19/h3-6,13-15H,7-12,16H2,1-2H3,(H,25,30)(H,26,31)	SEUNNIKTRAVCDH-UHFFFAOYSA-N	CN1CCN(CC1)c2cc(C)c3cc(NC(=O)CCC(=O)NCc4occc4)ccc3n2	BroadT	BRD-K80551287	BRD-K80551287-001-05-3	ChemDiv Inc.	C204-0233			CN1CCN(CC1)c1cc(C)c2cc(NC(=O)CCC(=O)NCc3ccco3)ccc2n1	InChI=1S/C24H29N5O3/c1-17-14-22(29-11-9-28(2)10-12-29)27-21-6-5-18(15-20(17)21)26-24(31)8-7-23(30)25-16-19-4-3-13-32-19/h3-6,13-15H,7-12,16H2,1-2H3,(H,25,30)(H,26,31)	SEUNNIKTRAVCDH-UHFFFAOYSA-N	435.227039838							114235
CHEMDIV3_007721	LSM-25697	SID24810171, BRD-K52113409	4074539	InChI=1S/C19H26N4OS/c1-3-4-11-22(2)19(25)20-14-9-10-16-15(13-14)18(24)23-12-7-5-6-8-17(23)21-16/h9-10,13H,3-8,11-12H2,1-2H3,(H,20,25)	NBSROBPIGKGLNY-UHFFFAOYSA-N	CCCCN(C)C(=Nc1ccc2N=C3CCCCCN3C(=O)c2c1)S	BroadT	BRD-K52113409	BRD-K52113409-001-05-9	ChemDiv Inc.	C066-3550			CCCCN(C)C(S)=Nc1ccc2nc3CCCCCn3c(=O)c2c1	InChI=1S/C19H26N4OS/c1-3-4-11-22(2)19(25)20-14-9-10-16-15(13-14)18(24)23-12-7-5-6-8-17(23)21-16/h9-10,13H,3-8,11-12H2,1-2H3,(H,20,25)	NBSROBPIGKGLNY-UHFFFAOYSA-N	358.182732182							114236
F0651-0354	LSM-25698	SID17515384, BRD-K50835094	3164038	InChI=1S/C22H25N3O3S/c1-25(2)29(27,28)17-10-8-16(9-11-17)22(26)23-14-15-7-12-21-19(13-15)18-5-3-4-6-20(18)24-21/h7-13,24H,3-6,14H2,1-2H3,(H,23,26)	WTHZORIKKRRNKJ-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(cc1)C(=O)NCc2ccc3[nH]c4CCCCc4c3c2	BroadT	BRD-K50835094	BRD-K50835094-001-05-9	Life Chemicals Inc.	F0651-0354			CN(C)S(=O)(=O)c1ccc(cc1)C(=O)NCc1ccc2[nH]c3CCCCc3c2c1	InChI=1S/C22H25N3O3S/c1-25(2)29(27,28)17-10-8-16(9-11-17)22(26)23-14-15-7-12-21-19(13-15)18-5-3-4-6-20(18)24-21/h7-13,24H,3-6,14H2,1-2H3,(H,23,26)	WTHZORIKKRRNKJ-UHFFFAOYSA-N	411.16166238							114237
MLS000769699	LSM-25699	SID26669322, BRD-K80232722	16682550	InChI=1S/C22H16ClFN4O3/c23-12-3-7-14(8-4-12)26-20(29)19-18-17(16-2-1-11-25-28(16)19)21(30)27(22(18)31)15-9-5-13(24)6-10-15/h1-11,16-19H,(H,26,29)/t16-,17-,18-,19+/m1/s1	FQVXJUPZAGDTDC-MKXGPGLRSA-N	Fc1ccc(cc1)N2C(=O)[C@@H]3[C@H]4C=CC=NN4[C@@H]([C@@H]3C2=O)C(=O)Nc5ccc(Cl)cc5	BroadT	BRD-K80232722	BRD-K80232722-001-04-6	InterBioScreen Ltd.	STOCK3S-94802			Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H]3C=CC=NN3[C@@H]([C@@H]2C1=O)C(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H16ClFN4O3/c23-12-3-7-14(8-4-12)26-20(29)19-18-17(16-2-1-11-25-28(16)19)21(30)27(22(18)31)15-9-5-13(24)6-10-15/h1-11,16-19H,(H,26,29)/t16-,17-,18-,19+/m1/s1	FQVXJUPZAGDTDC-MKXGPGLRSA-N	438.089496322							114238
ASN 06917421	LSM-25700	SID847676, SID26669152, BRD-K54839924	650085	InChI=1S/C22H21ClN6O2S/c23-17-6-2-1-4-15(17)13-29-21-19(26-27-29)22(31)25-20(24-21)14-7-9-28(10-8-14)18(30)12-16-5-3-11-32-16/h1-6,11,14H,7-10,12-13H2,(H,24,25,31)	MNRIXBGUJBMPDM-UHFFFAOYSA-N	Oc1nc(nc2c1nnn2Cc3ccccc3Cl)C4CCN(CC4)C(=O)Cc5cccs5	BroadT	BRD-K54839924	BRD-K54839924-001-05-3	Asinex Ltd.	ASN 06917421			Oc1nc(nc2n(Cc3ccccc3Cl)nnc12)C1CCN(CC1)C(=O)Cc1cccs1	InChI=1S/C22H21ClN6O2S/c23-17-6-2-1-4-15(17)13-29-21-19(26-27-29)22(31)25-20(24-21)14-7-9-28(10-8-14)18(30)12-16-5-3-11-32-16/h1-6,11,14H,7-10,12-13H2,(H,24,25,31)	MNRIXBGUJBMPDM-UHFFFAOYSA-N	468.113522372							
SMR000102490	LSM-25701	SID14719366, BRD-K34521600	2832013	InChI=1S/C17H21N5O/c1-3-21-8-10-22(11-9-21)16-12-14-17(19-18-16)23-15-7-5-4-6-13(15)20(14)2/h4-7,12H,3,8-11H2,1-2H3	WCZLZKLICVOKBC-UHFFFAOYSA-N	CCN1CCN(CC1)c2cc3N(C)c4ccccc4Oc3nn2	BroadT	BRD-K34521600	BRD-K34521600-001-06-1	ChemBridge Corporation	5175312			CCN1CCN(CC1)c1cc2N(C)c3ccccc3Oc2nn1	InChI=1S/C17H21N5O/c1-3-21-8-10-22(11-9-21)16-12-14-17(19-18-16)23-15-7-5-4-6-13(15)20(14)2/h4-7,12H,3,8-11H2,1-2H3	WCZLZKLICVOKBC-UHFFFAOYSA-N	311.174610342							114240
MLS000662637	LSM-25702	SID24791186, BRD-K05450596	1826808	InChI=1S/C22H26N2O3/c1-3-22(4-2)14-15-10-6-7-11-16(15)18-17(19(25)21(27)24(18)22)20(26)23-12-8-5-9-13-23/h6-7,10-11H,3-5,8-9,12-14H2,1-2H3	JYGFJAIEAMRPNW-UHFFFAOYSA-N	CCC1(CC)Cc2ccccc2C3=C(C(=O)N4CCCCC4)C(=O)C(=O)N13	BroadT	BRD-K05450596	BRD-K05450596-001-05-6	ChemBridge Corporation	7516939			CCC1(CC)Cc2ccccc2C2=C(C(=O)N3CCCCC3)C(=O)C(=O)N12	InChI=1S/C22H26N2O3/c1-3-22(4-2)14-15-10-6-7-11-16(15)18-17(19(25)21(27)24(18)22)20(26)23-12-8-5-9-13-23/h6-7,10-11H,3-5,8-9,12-14H2,1-2H3	JYGFJAIEAMRPNW-UHFFFAOYSA-N	366.194342712							114241
SMR000025716	LSM-25703	SID4251009, BRD-K83647900	3244748	InChI=1S/C23H26N4O2/c1-17-6-8-19(9-7-17)23-25-22(29-26-23)11-10-21(28)24-13-15-27-14-12-18-4-2-3-5-20(18)16-27/h2-9H,10-16H2,1H3,(H,24,28)	ZWRRCMRKCLGPSK-UHFFFAOYSA-N	Cc1ccc(cc1)c2noc(CCC(=O)NCCN3CCc4ccccc4C3)n2	BroadT	BRD-K83647900	BRD-K83647900-001-06-1	ChemDiv Inc.	C289-0688			Cc1ccc(cc1)-c1noc(CCC(=O)NCCN2CCc3ccccc3C2)n1	InChI=1S/C23H26N4O2/c1-17-6-8-19(9-7-17)23-25-22(29-26-23)11-10-21(28)24-13-15-27-14-12-18-4-2-3-5-20(18)16-27/h2-9H,10-16H2,1H3,(H,24,28)	ZWRRCMRKCLGPSK-UHFFFAOYSA-N	390.205576112							114242
AC1NZF9Q	LSM-44133	SID26667385, BRD-A22840179	5931936	InChI=1S/C18H19N5O3/c1-11-9-22(10-12(2)26-11)17-14(7-13(8-19)16(20)24)18(25)23-6-4-3-5-15(23)21-17/h3-7,11-12H,9-10H2,1-2H3,(H2,20,24)/b13-7+	JRNPIVZDDPZRMJ-NTUHNPAUSA-N	CC1CN(CC(C)O1)C2=C(\C=C(/C#N)\C(=O)N)C(=O)N3C=CC=CC3=N2	BroadT	BRD-A22840179	BRD-A22840179-001-05-4	InterBioScreen Ltd.	STOCK3S-51580			CC1CN(CC(C)O1)c1nc2ccccn2c(=O)c1\C=C(/C#N)C(N)=O	InChI=1S/C18H19N5O3/c1-11-9-22(10-12(2)26-11)17-14(7-13(8-19)16(20)24)18(25)23-6-4-3-5-15(23)21-17/h3-7,11-12H,9-10H2,1-2H3,(H2,20,24)/b13-7+	JRNPIVZDDPZRMJ-NTUHNPAUSA-N	353.148789518							
MLS000325722	LSM-25705	SID17410439, BRD-K64471376	3755889	InChI=1S/C18H17N3O4/c22-18(14-4-2-1-3-5-14)25-19-15-10-12-20(13-11-15)16-6-8-17(9-7-16)21(23)24/h1-9H,10-13H2	CQIDFIGQOYTEDL-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)N2CCC(=NOC(=O)c3ccccc3)CC2	BroadT	BRD-K64471376	BRD-K64471376-001-05-6	Key Organics Ltd.	7F-911			[O-][N+](=O)c1ccc(cc1)N1CCC(CC1)=NOC(=O)c1ccccc1	InChI=1S/C18H17N3O4/c22-18(14-4-2-1-3-5-14)25-19-15-10-12-20(13-11-15)16-6-8-17(9-7-16)21(23)24/h1-9H,10-13H2	CQIDFIGQOYTEDL-UHFFFAOYSA-N	339.121906054							114244
CID_652107	LSM-25706	BRD-A48807531	91896288	InChI=1S/C25H23NO6/c1-30-18-11-10-17(15-20(18)31-2)22-21(23(27)19-9-6-14-32-19)24(28)25(29)26(22)13-12-16-7-4-3-5-8-16/h3-11,14-15,21-22H,12-13H2,1-2H3	MLZAAXOETAHQQS-UHFFFAOYSA-N	COc1ccc(cc1OC)C2C(C(=O)c3occc3)C(=O)C(=O)N2CCc4ccccc4	BroadT	BRD-A48807531	BRD-A48807531-001-04-9	Asinex Ltd.	BAS 05885106			COc1ccc(cc1OC)C1C(C(=O)c2ccco2)C(=O)C(=O)N1CCc1ccccc1	InChI=1S/C25H23NO6/c1-30-18-11-10-17(15-20(18)31-2)22-21(23(27)19-9-6-14-32-19)24(28)25(29)26(22)13-12-16-7-4-3-5-8-16/h3-11,14-15,21-22H,12-13H2,1-2H3	MLZAAXOETAHQQS-UHFFFAOYSA-N	433.152537466							114245
AC1N0WDV	LSM-25707	SID22406289, BRD-K23327969	3923904	InChI=1S/C26H25NO5/c1-26(2,3)17-11-9-16(10-12-17)25(29)31-15-24(28)27-20-14-22-19(13-23(20)30-4)18-7-5-6-8-21(18)32-22/h5-14H,15H2,1-4H3,(H,27,28)	FUBUELHMJDMBQJ-UHFFFAOYSA-N	COc1cc2c(oc3ccccc23)cc1NC(=O)COC(=O)c4ccc(cc4)C(C)(C)C	BroadT	BRD-K23327969	BRD-K23327969-001-05-3	Enamine Ltd.	T5225597			COc1cc2c(cc1NC(=O)COC(=O)c1ccc(cc1)C(C)(C)C)oc1ccccc21	InChI=1S/C26H25NO5/c1-26(2,3)17-11-9-16(10-12-17)25(29)31-15-24(28)27-20-14-22-19(13-23(20)30-4)18-7-5-6-8-21(18)32-22/h5-14H,15H2,1-4H3,(H,27,28)	FUBUELHMJDMBQJ-UHFFFAOYSA-N	431.17327291							114246
MLS000534759	LSM-25708	SID14740110, SID56321156, BRD-K78519035	1331358	InChI=1S/C27H23N5O3S/c36-27(28-18-5-8-20(9-6-18)32-11-15-33-16-12-32)29-19-7-10-21-22(17-19)31-26(24-4-2-14-35-24)25(30-21)23-3-1-13-34-23/h1-10,13-14,17H,11-12,15-16H2,(H2,28,29,36)	KBQUGQKOZBTLIO-UHFFFAOYSA-N	S=C(Nc1ccc(cc1)N2CCOCC2)Nc3ccc4nc(c5occc5)c(nc4c3)c6occc6	BroadT	BRD-K78519035	BRD-K78519035-001-05-9	ChemBridge Corporation	7088766			S=C(Nc1ccc(cc1)N1CCOCC1)Nc1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1	InChI=1S/C27H23N5O3S/c36-27(28-18-5-8-20(9-6-18)32-11-15-33-16-12-32)29-19-7-10-21-22(17-19)31-26(24-4-2-14-35-24)25(30-21)23-3-1-13-34-23/h1-10,13-14,17H,11-12,15-16H2,(H2,28,29,36)	KBQUGQKOZBTLIO-UHFFFAOYSA-N	497.152160336							114247
STK167653	LSM-25709	SID17407903, BRD-K02059094	774420	InChI=1S/C15H11ClF3NO2/c1-22-11-4-2-3-9(7-11)14(21)20-10-5-6-13(16)12(8-10)15(17,18)19/h2-8H,1H3,(H,20,21)	UZNHUNNBLYGPBF-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Nc2ccc(Cl)c(c2)C(F)(F)F	BroadT	BRD-K02059094	BRD-K02059094-001-05-5	Asinex Ltd.	BAS 01186969			COc1cccc(c1)C(=O)Nc1ccc(Cl)c(c1)C(F)(F)F	InChI=1S/C15H11ClF3NO2/c1-22-11-4-2-3-9(7-11)14(21)20-10-5-6-13(16)12(8-10)15(17,18)19/h2-8H,1H3,(H,20,21)	UZNHUNNBLYGPBF-UHFFFAOYSA-N	329.043040912							131272
MLS000104232	LSM-25710	SID7973389, BRD-A01039955	3825881	InChI=1S/C16H17N3O/c1-16(2)14(12-7-4-3-5-8-12)18-15(19(16)20)13-9-6-10-17-11-13/h3-11,15,20H,1-2H3	ILDXDHGIXWBHLY-UHFFFAOYSA-N	CC1(C)N(O)C(N=C1c2ccccc2)c3cccnc3	BroadT	BRD-A01039955	BRD-A01039955-001-05-8	ChemBridge Corporation	5215586			CC1(C)N(O)C(N=C1c1ccccc1)c1cccnc1	InChI=1S/C16H17N3O/c1-16(2)14(12-7-4-3-5-8-12)18-15(19(16)20)13-9-6-10-17-11-13/h3-11,15,20H,1-2H3	ILDXDHGIXWBHLY-UHFFFAOYSA-N	267.137162194							114250
MLS000535279	LSM-44134	SID14739374, BRD-K69203373	2190841	InChI=1S/C17H16N2O2S2/c1-11-4-5-12(2)18(11)19-16(20)15(23-17(19)22)10-13-6-8-14(21-3)9-7-13/h4-10H,1-3H3/b15-10+	PZOXRWHIFUFFGV-XNTDXEJSSA-N	COc1ccc(\C=C/2\SC(=S)N(C2=O)n3c(C)ccc3C)cc1	BroadT	BRD-K69203373	BRD-K69203373-001-05-1	ChemBridge Corporation	7468222			COc1ccc(cc1)\C=C1\SC(=S)N(C1=O)n1c(C)ccc1C	InChI=1S/C17H16N2O2S2/c1-11-4-5-12(2)18(11)19-16(20)15(23-17(19)22)10-13-6-8-14(21-3)9-7-13/h4-10H,1-3H3/b15-10+	PZOXRWHIFUFFGV-XNTDXEJSSA-N	344.065319152							
6,7-Bis(4-aminophenyl)pteridine-2,4-diamine	LSM-25712	SID26666765, BRD-K44416900	247251	InChI=1S/C18H16N8/c19-11-5-1-9(2-6-11)13-14(10-3-7-12(20)8-4-10)24-17-15(23-13)16(21)25-18(22)26-17/h1-8H,19-20H2,(H4,21,22,24,25,26)	SAYBETLMUROXMO-UHFFFAOYSA-N	Nc1ccc(cc1)c2nc3nc(N)nc(N)c3nc2c4ccc(N)cc4	BroadT	BRD-K44416900	BRD-K44416900-001-06-9	National Cancer Institute Chemotherapeutic Agents Repository	61642			Nc1ccc(cc1)-c1nc2nc(N)nc(N)c2nc1-c1ccc(N)cc1	InChI=1S/C18H16N8/c19-11-5-1-9(2-6-11)13-14(10-3-7-12(20)8-4-10)24-17-15(23-13)16(21)25-18(22)26-17/h1-8H,19-20H2,(H4,21,22,24,25,26)	SAYBETLMUROXMO-UHFFFAOYSA-N	344.149792592							114252
4H-[1,3]thiazino[3,2-A]benzimidazol-4-ol	LSM-25713	SID4264162, BRD-A78942403	2979714	InChI=1S/C10H8N2OS/c13-9-5-6-14-10-11-7-3-1-2-4-8(7)12(9)10/h1-6,9,13H	KPQGNYZDIOWNDF-UHFFFAOYSA-N	OC1C=CSc2nc3ccccc3n12	BroadT	BRD-A78942403	BRD-A78942403-001-05-9	ChemBridge Corporation	7976360			OC1C=CSc2nc3ccccc3n12	InChI=1S/C10H8N2OS/c13-9-5-6-14-10-11-7-3-1-2-4-8(7)12(9)10/h1-6,9,13H	KPQGNYZDIOWNDF-UHFFFAOYSA-N	204.035733586							114253
MLS000548564	LSM-25714	SID14718907, BRD-K66558095	1224379	InChI=1S/C16H21N3O3/c1-11(2)3-7-16(8-4-12-5-9-17-10-6-12)13(20)18-15(22)19-14(16)21/h5-6,9-11H,3-4,7-8H2,1-2H3,(H2,18,19,20,21,22)	DYBMMAZQIXNPSW-UHFFFAOYSA-N	CC(C)CCC1(CCc2ccncc2)C(=O)NC(=O)NC1=O	BroadT	BRD-K66558095	BRD-K66558095-001-05-8	Specs	AG-670/40710975			CC(C)CCC1(CCc2ccncc2)C(=O)NC(=O)NC1=O	InChI=1S/C16H21N3O3/c1-11(2)3-7-16(8-4-12-5-9-17-10-6-12)13(20)18-15(22)19-14(16)21/h5-6,9-11H,3-4,7-8H2,1-2H3,(H2,18,19,20,21,22)	DYBMMAZQIXNPSW-UHFFFAOYSA-N	303.158291562							114254
2'-Methyl-1H,1'h-[2,5']bibenzoimidazolyl	LSM-25715	SID24806331, BRD-K78332990	831970	InChI=1S/C15H12N4/c1-9-16-13-7-6-10(8-14(13)17-9)15-18-11-4-2-3-5-12(11)19-15/h2-8H,1H3,(H,16,17)(H,18,19)	HZMWWKXPSYSLQD-UHFFFAOYSA-N	Cc1nc2cc(ccc2[nH]1)c3nc4ccccc4[nH]3	BroadT	BRD-K78332990	BRD-K78332990-001-05-0	Asinex Ltd.	BAS 03422675			Cc1nc2cc(ccc2[nH]1)-c1nc2ccccc2[nH]1	InChI=1S/C15H12N4/c1-9-16-13-7-6-10(8-14(13)17-9)15-18-11-4-2-3-5-12(11)19-15/h2-8H,1H3,(H,16,17)(H,18,19)	HZMWWKXPSYSLQD-UHFFFAOYSA-N	248.106196424							114255
ASN 09858450	LSM-25716	SID843840, BRD-K54377788	646145	InChI=1S/C20H27N3O4S2/c1-2-22-28(24,25)19-11-13-20(14-12-19)29(26,27)23(18-9-4-3-5-10-18)16-17-8-6-7-15-21-17/h6-8,11-15,18,22H,2-5,9-10,16H2,1H3	AKLBUCREYAAHGO-UHFFFAOYSA-N	CCNS(=O)(=O)c1ccc(cc1)S(=O)(=O)N(Cc2ccccn2)C3CCCCC3	BroadT	BRD-K54377788	BRD-K54377788-001-05-9	Asinex Ltd.	ASN 09858450			CCNS(=O)(=O)c1ccc(cc1)S(=O)(=O)N(Cc1ccccn1)C1CCCCC1	InChI=1S/C20H27N3O4S2/c1-2-22-28(24,25)19-11-13-20(14-12-19)29(26,27)23(18-9-4-3-5-10-18)16-17-8-6-7-15-21-17/h6-8,11-15,18,22H,2-5,9-10,16H2,1H3	AKLBUCREYAAHGO-UHFFFAOYSA-N	437.144297754							114256
MLS000075835	LSM-25717	SID849601, BRD-K15034896	652100	InChI=1S/C11H13N5O2S/c1-7-4-13-8(5-12-7)10-14-15-11(19-10)16(2)9(17)6-18-3/h4-5H,6H2,1-3H3	SWRKOIXWIFRIRS-UHFFFAOYSA-N	COCC(=O)N(C)c1nnc(s1)c2cnc(C)cn2	BroadT	BRD-K15034896	BRD-K15034896-001-05-3	Asinex Ltd.	ASN 09114462			COCC(=O)N(C)c1nnc(s1)-c1cnc(C)cn1	InChI=1S/C11H13N5O2S/c1-7-4-13-8(5-12-7)10-14-15-11(19-10)16(2)9(17)6-18-3/h4-5H,6H2,1-3H3	SWRKOIXWIFRIRS-UHFFFAOYSA-N	279.078995396							114257
T6510669	LSM-15384	BRD-A21829694	581730	InChI=1S/C16H25NO4/c1-12-8-17(9-13(2)21-12)10-14(18)11-20-16-6-4-15(19-3)5-7-16/h4-7,12-14,18H,8-11H2,1-3H3	CCGHVAGELGVBQD-UHFFFAOYSA-N	COc1ccc(OCC(O)CN2CC(C)OC(C)C2)cc1	BroadT	BRD-A21829694	BRD-A21829694-003-05-0	ChemBridge Corporation	5284210		Cl	COc1ccc(OCC(O)CN2CC(C)OC(C)C2)cc1.Cl	InChI=1S/C16H25NO4.ClH/c1-12-8-17(9-13(2)21-12)10-14(18)11-20-16-6-4-15(19-3)5-7-16;/h4-7,12-14,18H,8-11H2,1-3H3;1H	GDELMBQBDNIMJJ-UHFFFAOYSA-N	295.17835829							104026, 104026
Integrin antagonists 27	LSM-44135	SID24823545, BRD-K80164063	6148173	InChI=1S/C24H20N4O5/c1-15-7-9-17(10-8-15)25-21(29)14-28-22(30)20(26-24(28)33)13-19-6-3-11-27(19)18-5-2-4-16(12-18)23(31)32/h2-13H,14H2,1H3,(H,25,29)(H,26,33)(H,31,32)/b20-13-	BJCKKLXERBMNHP-MOSHPQCFSA-N	Cc1ccc(NC(=O)CN2C(=O)N\C(=C/c3cccn3c4cccc(c4)C(=O)O)\C2=O)cc1	BroadT	BRD-K80164063	BRD-K80164063-001-05-5	ChemDiv Inc.	5775-0166			Cc1ccc(NC(=O)CN2C(=O)N\C(=C/c3cccn3-c3cccc(c3)C(O)=O)C2=O)cc1	InChI=1S/C24H20N4O5/c1-15-7-9-17(10-8-15)25-21(29)14-28-22(30)20(26-24(28)33)13-19-6-3-11-27(19)18-5-2-4-16(12-18)23(31)32/h2-13H,14H2,1H3,(H,25,29)(H,26,33)(H,31,32)/b20-13-	BJCKKLXERBMNHP-MOSHPQCFSA-N	444.14336978							
MLS000516755	LSM-25719	SID26657626, BRD-K99932050	2492086	InChI=1S/C18H17BrN4O5/c19-11-3-4-13-20-12(7-14(24)22(13)8-11)10-28-15(25)9-23-16(26)18(21-17(23)27)5-1-2-6-18/h3-4,7-8H,1-2,5-6,9-10H2,(H,21,27)	CBQGPXLCRKCKJO-UHFFFAOYSA-N	BrC1=CN2C(=O)C=C(COC(=O)CN3C(=O)NC4(CCCC4)C3=O)N=C2C=C1	BroadT	BRD-K99932050	BRD-K99932050-001-05-9	Enamine Ltd.	T5286510			Brc1ccc2nc(COC(=O)CN3C(=O)NC4(CCCC4)C3=O)cc(=O)n2c1	InChI=1S/C18H17BrN4O5/c19-11-3-4-13-20-12(7-14(24)22(13)8-11)10-28-15(25)9-23-16(26)18(21-17(23)27)5-1-2-6-18/h3-4,7-8H,1-2,5-6,9-10H2,(H,21,27)	CBQGPXLCRKCKJO-UHFFFAOYSA-N	448.038232284							114259
MLS000684521	LSM-44136	SID24790570, BRD-K37239108	686980	InChI=1S/C15H11ClFNO/c16-14(10-11-4-2-1-3-5-11)15(19)18-13-8-6-12(17)7-9-13/h1-10H,(H,18,19)/b14-10-	PADSEXCZNDPRGR-UVTDQMKNSA-N	Fc1ccc(NC(=O)\C(=C\c2ccccc2)\Cl)cc1	BroadT	BRD-K37239108	BRD-K37239108-001-06-4	ChemBridge Corporation	6600367			Fc1ccc(NC(=O)C(\Cl)=C\c2ccccc2)cc1	InChI=1S/C15H11ClFNO/c16-14(10-11-4-2-1-3-5-11)15(19)18-13-8-6-12(17)7-9-13/h1-10H,(H,18,19)/b14-10-	PADSEXCZNDPRGR-UVTDQMKNSA-N	275.051319892							
SMR000131702	LSM-25721	SID14731189, BRD-K62978630	3425642	InChI=1S/C23H18ClN3O3/c1-29-20-12-2-15(3-13-20)14-21(28)25-19-10-6-16(7-11-19)22-26-23(30-27-22)17-4-8-18(24)9-5-17/h2-13H,14H2,1H3,(H,25,28)	HZIPOTHIRYOTIH-UHFFFAOYSA-N	COc1ccc(CC(=O)Nc2ccc(cc2)c3noc(n3)c4ccc(Cl)cc4)cc1	BroadT	BRD-K62978630	BRD-K62978630-001-06-2	ChemDiv Inc.	K907-0080			COc1ccc(CC(=O)Nc2ccc(cc2)-c2noc(n2)-c2ccc(Cl)cc2)cc1	InChI=1S/C23H18ClN3O3/c1-29-20-12-2-15(3-13-20)14-21(28)25-19-10-6-16(7-11-19)22-26-23(30-27-22)17-4-8-18(24)9-5-17/h2-13H,14H2,1H3,(H,25,28)	HZIPOTHIRYOTIH-UHFFFAOYSA-N	419.103669176							114261
ST50840552	LSM-25722	SID4258251, BRD-K27871068	1244006	InChI=1S/C14H16N2O3S2/c1-4-9-6-7-10(20-9)12(17)16-14-15-8(3)11(21-14)13(18)19-5-2/h6-7H,4-5H2,1-3H3,(H,15,16,17)	YKFSPCPAAYVRLV-UHFFFAOYSA-N	CCOC(=O)c1sc(NC(=O)c2ccc(CC)s2)nc1C	BroadT	BRD-K27871068	BRD-K27871068-001-05-6	ChemBridge Corporation	7943524			CCOC(=O)c1sc(NC(=O)c2ccc(CC)s2)nc1C	InChI=1S/C14H16N2O3S2/c1-4-9-6-7-10(20-9)12(17)16-14-15-8(3)11(21-14)13(18)19-5-2/h6-7H,4-5H2,1-3H3,(H,15,16,17)	YKFSPCPAAYVRLV-UHFFFAOYSA-N	324.060233772							114262
AK-918/37148021	LSM-25723	SID49726165, BRD-K00869355	1085327	InChI=1S/C21H24N2O4/c1-26-18-11-8-16(14-19(18)27-2)20(24)22-17-9-6-15(7-10-17)21(25)23-12-4-3-5-13-23/h6-11,14H,3-5,12-13H2,1-2H3,(H,22,24)	SWTMZKPNUWCIFW-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)Nc2ccc(cc2)C(=O)N3CCCCC3	BroadT	BRD-K00869355	BRD-K00869355-001-05-3	Asinex Ltd.	BAS 06657838			COc1ccc(cc1OC)C(=O)Nc1ccc(cc1)C(=O)N1CCCCC1	InChI=1S/C21H24N2O4/c1-26-18-11-8-16(14-19(18)27-2)20(24)22-17-9-6-15(7-10-17)21(25)23-12-4-3-5-13-23/h6-11,14H,3-5,12-13H2,1-2H3,(H,22,24)	SWTMZKPNUWCIFW-UHFFFAOYSA-N	368.173607268							114263
Ethyl 4-oxo-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate	LSM-25724	SID24780594, BRD-K11649652	611390	InChI=1S/C13H11N3O3/c1-2-19-12(18)8-7-14-13-15-9-5-3-4-6-10(9)16(13)11(8)17/h3-7,17H,2H2,1H3	IQHIYAXDFZCZGG-UHFFFAOYSA-N	CCOC(=O)c1cnc2nc3ccccc3n2c1O	BroadT	BRD-K11649652	BRD-K11649652-001-05-6	Asinex Ltd.	BAS 04850160			CCOC(=O)c1cnc2nc3ccccc3n2c1O	InChI=1S/C13H11N3O3/c1-2-19-12(18)8-7-14-13-15-9-5-3-4-6-10(9)16(13)11(8)17/h3-7,17H,2H2,1H3	IQHIYAXDFZCZGG-UHFFFAOYSA-N	257.080041242							
AC1OA4B2	LSM-25725	SID861204, BRD-K73967057	6747210	InChI=1S/C15H10BrFN2O/c16-9-5-6-15(20)11(7-9)14-8-13(18-19-14)10-3-1-2-4-12(10)17/h1-8,20H,(H,18,19)	HGLIQONJYMUJHT-UHFFFAOYSA-N	Oc1ccc(Br)cc1c2cc([nH]n2)c3ccccc3F	BroadT	BRD-K73967057	BRD-K73967057-001-05-8	InterBioScreen Ltd.	STOCK4S-01664			Oc1ccc(Br)cc1-c1cc([nH]n1)-c1ccccc1F	InChI=1S/C15H10BrFN2O/c16-9-5-6-15(20)11(7-9)14-8-13(18-19-14)10-3-1-2-4-12(10)17/h1-8,20H,(H,18,19)	HGLIQONJYMUJHT-UHFFFAOYSA-N	331.99605376							
4-Methyl-2-(4-nitrophenyl)-1,3-thiazole-5-carboxylic acid	LSM-25726	SID24818916, BRD-K56016191	1473788	InChI=1S/C11H8N2O4S/c1-6-9(11(14)15)18-10(12-6)7-2-4-8(5-3-7)13(16)17/h2-5H,1H3,(H,14,15)	IAWXKDQKIJAATO-UHFFFAOYSA-N	Cc1nc(sc1C(=O)O)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K56016191	BRD-K56016191-001-05-2	Key Organics Ltd.	3G-301S			Cc1nc(sc1C(O)=O)-c1ccc(cc1)[N+]([O-])=O	InChI=1S/C11H8N2O4S/c1-6-9(11(14)15)18-10(12-6)7-2-4-8(5-3-7)13(16)17/h2-5H,1H3,(H,14,15)	IAWXKDQKIJAATO-UHFFFAOYSA-N	264.020477446							114266
SMR000177232	LSM-25727	SID17507348, BRD-K53548934	3135909	InChI=1S/C24H23ClN4OS/c1-2-30-22-14-12-20(13-15-22)26-16-23-27-28-24(29(23)21-6-4-3-5-7-21)31-17-18-8-10-19(25)11-9-18/h3-15,26H,2,16-17H2,1H3	PZNLVEHGEFJBAF-UHFFFAOYSA-N	CCOc1ccc(NCc2nnc(SCc3ccc(Cl)cc3)n2c4ccccc4)cc1	BroadT	BRD-K53548934	BRD-K53548934-001-05-9	Asinex Ltd.	BAS 01918180			CCOc1ccc(NCc2nnc(SCc3ccc(Cl)cc3)n2-c2ccccc2)cc1	InChI=1S/C24H23ClN4OS/c1-2-30-22-14-12-20(13-15-22)26-16-23-27-28-24(29(23)21-6-4-3-5-7-21)31-17-18-8-10-19(25)11-9-18/h3-15,26H,2,16-17H2,1H3	PZNLVEHGEFJBAF-UHFFFAOYSA-N	450.128109796							114267
F0522-0002	LSM-15216	BRD-A74482850	4252615	InChI=1S/C17H16FN2OS/c18-14-8-6-13(7-9-14)17(21)12-19(15-4-2-1-3-5-15)16-20(17)10-11-22-16/h1-9,21H,10-12H2/q+1	LWQDKRRUELJQKU-UHFFFAOYSA-N	OC1(C[N+](=C2SCCN12)c3ccccc3)c4ccc(F)cc4	BroadT	BRD-A74482850	BRD-A74482850-004-05-2	Life Chemicals Inc.	F0522-0002		Br	OC1(C[N+](=C2SCCN12)c1ccccc1)c1ccc(F)cc1.Br	InChI=1S/C17H16FN2OS.BrH/c18-14-8-6-13(7-9-14)17(21)12-19(15-4-2-1-3-5-15)16-20(17)10-11-22-16;/h1-9,21H,10-12H2;1H/q+1;	RBLDDKWASISELD-UHFFFAOYSA-N	315.096737042							103863, 103863
MLS000594064	LSM-25728	SID14733702, BRD-K80717167	888451	InChI=1S/C15H16N2S/c1-11(2)10-17-13-7-4-3-6-12(13)16-15(17)14-8-5-9-18-14/h3-9,11H,10H2,1-2H3	WWVYTOAJWOLNPK-UHFFFAOYSA-N	CC(C)Cn1c(nc2ccccc12)c3cccs3	BroadT	BRD-K80717167	BRD-K80717167-001-05-5	ChemBridge Corporation	7353986			CC(C)Cn1c(nc2ccccc12)-c1cccs1	InChI=1S/C15H16N2S/c1-11(2)10-17-13-7-4-3-6-12(13)16-15(17)14-8-5-9-18-14/h3-9,11H,10H2,1-2H3	WWVYTOAJWOLNPK-UHFFFAOYSA-N	256.103419222							114268
BAS 02497604	LSM-25729	SID24806795, BRD-K08180399	829010	InChI=1S/C17H18N2O4S/c1-4-12(20)19-16-13(17(22)23-3)10(2)14(24-16)15(21)18-11-8-6-5-7-9-11/h5-9H,4H2,1-3H3,(H,18,21)(H,19,20)	XHNALLLBFKRRJO-UHFFFAOYSA-N	CCC(=O)Nc1sc(C(=O)Nc2ccccc2)c(C)c1C(=O)OC	BroadT	BRD-K08180399	BRD-K08180399-001-05-5	Asinex Ltd.	BAS 02497604			CCC(=O)Nc1sc(C(=O)Nc2ccccc2)c(C)c1C(=O)OC	InChI=1S/C17H18N2O4S/c1-4-12(20)19-16-13(17(22)23-3)10(2)14(24-16)15(21)18-11-8-6-5-7-9-11/h5-9H,4H2,1-3H3,(H,18,21)(H,19,20)	XHNALLLBFKRRJO-UHFFFAOYSA-N	346.098727766							114269
Ethyl 5-bromo-3-{[3-(3,3-dimethylpiperidin-1-yl)propanoyl]amino}-1H-indole-2-carboxylate	LSM-25730	SID14734410, BRD-K50516081	1865580	InChI=1S/C21H28BrN3O3/c1-4-28-20(27)19-18(15-12-14(22)6-7-16(15)23-19)24-17(26)8-11-25-10-5-9-21(2,3)13-25/h6-7,12,23H,4-5,8-11,13H2,1-3H3,(H,24,26)	AOWDMULDHNLFER-UHFFFAOYSA-N	CCOC(=O)c1[nH]c2ccc(Br)cc2c1NC(=O)CCN3CCCC(C)(C)C3	BroadT	BRD-K50516081	BRD-K50516081-001-05-0	InterBioScreen Ltd.	STOCK3S-06240			CCOC(=O)c1[nH]c2ccc(Br)cc2c1NC(=O)CCN1CCCC(C)(C)C1	InChI=1S/C21H28BrN3O3/c1-4-28-20(27)19-18(15-12-14(22)6-7-16(15)23-19)24-17(26)8-11-25-10-5-9-21(2,3)13-25/h6-7,12,23H,4-5,8-11,13H2,1-3H3,(H,24,26)	AOWDMULDHNLFER-UHFFFAOYSA-N	449.131404386							114270
T5274578	LSM-25731	SID24784680, BRD-K33002548	3650776	InChI=1S/C26H26N2O6/c1-3-33-23-14-10-21(11-15-23)28-26(31)19-6-8-20(9-7-19)27-24(29)17-34-25(30)16-18-4-12-22(32-2)13-5-18/h4-15H,3,16-17H2,1-2H3,(H,27,29)(H,28,31)	GNWKKMPURUDFFI-UHFFFAOYSA-N	CCOc1ccc(NC(=O)c2ccc(NC(=O)COC(=O)Cc3ccc(OC)cc3)cc2)cc1	BroadT	BRD-K33002548	BRD-K33002548-001-06-8	Enamine Ltd.	T5274578			CCOc1ccc(NC(=O)c2ccc(NC(=O)COC(=O)Cc3ccc(OC)cc3)cc2)cc1	InChI=1S/C26H26N2O6/c1-3-33-23-14-10-21(11-15-23)28-26(31)19-6-8-20(9-7-19)27-24(29)17-34-25(30)16-18-4-12-22(32-2)13-5-18/h4-15H,3,16-17H2,1-2H3,(H,27,29)(H,28,31)	GNWKKMPURUDFFI-UHFFFAOYSA-N	462.179086572							114271
MLS000730236	LSM-25732	SID24784473, BRD-K69494685	5082003	InChI=1S/C18H13FN4O3/c19-13-5-3-12(4-6-13)10-23-11-14(9-20-23)21-18(24)15-8-17(26-22-15)16-2-1-7-25-16/h1-9,11H,10H2,(H,21,24)	GELZXFQZAOXTDI-UHFFFAOYSA-N	Fc1ccc(Cn2cc(NC(=O)c3cc(on3)c4occc4)cn2)cc1	BroadT	BRD-K69494685	BRD-K69494685-001-06-7	ChemDiv Inc.	C226-1812			Fc1ccc(Cn2cc(NC(=O)c3cc(on3)-c3ccco3)cn2)cc1	InChI=1S/C18H13FN4O3/c19-13-5-3-12(4-6-13)10-23-11-14(9-20-23)21-18(24)15-8-17(26-22-15)16-2-1-7-25-16/h1-9,11H,10H2,(H,21,24)	GELZXFQZAOXTDI-UHFFFAOYSA-N	352.097168516							114272
AC1LO0FD	LSM-25733	BRD-K12080874	1231181	InChI=1S/C20H13N3O4/c24-20(22-21-12-13-4-3-6-15(10-13)23(25)26)19-11-17-16-7-2-1-5-14(16)8-9-18(17)27-19/h1-12H,(H,22,24)	HSDFDMSYAUCFSY-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(C=NNC(=O)c2oc3ccc4ccccc4c3c2)c1	BroadT	BRD-K12080874	BRD-K12080874-001-05-5	Specs	AN-988/40679788			[O-][N+](=O)c1cccc(C=NNC(=O)c2cc3c(ccc4ccccc34)o2)c1	InChI=1S/C20H13N3O4/c24-20(22-21-12-13-4-3-6-15(10-13)23(25)26)19-11-17-16-7-2-1-5-14(16)8-9-18(17)27-19/h1-12H,(H,22,24)	HSDFDMSYAUCFSY-UHFFFAOYSA-N	359.090605926							114273
(3-Amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)(2-chlorophenyl)methanone	LSM-25734	SID26727852, BRD-K49651897	2726056	InChI=1S/C16H13ClN2OS/c1-8-7-9(2)19-16-12(8)13(18)15(21-16)14(20)10-5-3-4-6-11(10)17/h3-7H,18H2,1-2H3	BNCROEXYLVDLHZ-UHFFFAOYSA-N	Cc1cc(C)c2c(N)c(sc2n1)C(=O)c3ccccc3Cl	BroadT	BRD-K49651897	BRD-K49651897-001-06-1	Maybridge	RF 00124			Cc1cc(C)c2c(N)c(sc2n1)C(=O)c1ccccc1Cl	InChI=1S/C16H13ClN2OS/c1-8-7-9(2)19-16-12(8)13(18)15(21-16)14(20)10-5-3-4-6-11(10)17/h3-7H,18H2,1-2H3	BNCROEXYLVDLHZ-UHFFFAOYSA-N	316.043711456							114274
AC1NELQY	LSM-25735	BRD-A76790334	4594242	InChI=1S/C14H15N3O4S/c1-8(9-3-5-10(21-2)6-4-9)16-17-14-15-12(18)7-11(22-14)13(19)20/h3-6,11H,7H2,1-2H3,(H,19,20)(H,15,17,18)	GGGAIFBVFDAWTG-UHFFFAOYSA-N	COc1ccc(cc1)C(=NNC2=NC(=O)CC(S2)C(=O)O)C	BroadT	BRD-A76790334	BRD-A76790334-001-05-8	InterBioScreen Ltd.	STOCK3S-57384			COc1ccc(cc1)C(C)=NNC1=NC(=O)CC(S1)C(O)=O	InChI=1S/C14H15N3O4S/c1-8(9-3-5-10(21-2)6-4-9)16-17-14-15-12(18)7-11(22-14)13(19)20/h3-6,11H,7H2,1-2H3,(H,19,20)(H,15,17,18)	GGGAIFBVFDAWTG-UHFFFAOYSA-N	321.07832668							114275
N-(4-Fluorophenyl)-n'-[2-methyl-5-(piperidinosulfonyl)-3-furyl]urea	LSM-25736	SID26728187, BRD-K46095033	2810412	InChI=1S/C17H20FN3O4S/c1-12-15(20-17(22)19-14-7-5-13(18)6-8-14)11-16(25-12)26(23,24)21-9-3-2-4-10-21/h5-8,11H,2-4,9-10H2,1H3,(H2,19,20,22)	NEYVPAWWSHFUOH-UHFFFAOYSA-N	Cc1oc(cc1NC(=O)Nc2ccc(F)cc2)S(=O)(=O)N3CCCCC3	BroadT	BRD-K46095033	BRD-K46095033-001-05-1	Maybridge	HTS 01919			Cc1oc(cc1NC(=O)Nc1ccc(F)cc1)S(=O)(=O)N1CCCCC1	InChI=1S/C17H20FN3O4S/c1-12-15(20-17(22)19-14-7-5-13(18)6-8-14)11-16(25-12)26(23,24)21-9-3-2-4-10-21/h5-8,11H,2-4,9-10H2,1H3,(H2,19,20,22)	NEYVPAWWSHFUOH-UHFFFAOYSA-N	381.11585504							114276
MLS000779692	LSM-25737	SID26661767, BRD-K06449947	1932059	InChI=1S/C22H27N5OS/c23-25-22-24-20-19(21(28)27(22)16-9-5-2-6-10-16)17-11-12-26(14-18(17)29-20)13-15-7-3-1-4-8-15/h1,3-4,7-8,16H,2,5-6,9-14,23H2,(H,24,25)	HQMCIFZYDJVKRK-UHFFFAOYSA-N	NNC1=Nc2sc3CN(Cc4ccccc4)CCc3c2C(=O)N1C5CCCCC5	BroadT	BRD-K06449947	BRD-K06449947-001-07-9	InterBioScreen Ltd.	STOCK2S-71844			NNc1nc2sc3CN(Cc4ccccc4)CCc3c2c(=O)n1C1CCCCC1	InChI=1S/C22H27N5OS/c23-25-22-24-20-19(21(28)27(22)16-9-5-2-6-10-16)17-11-12-26(14-18(17)29-20)13-15-7-3-1-4-8-15/h1,3-4,7-8,16H,2,5-6,9-14,23H2,(H,24,25)	HQMCIFZYDJVKRK-UHFFFAOYSA-N	409.193631224							114277
SMR000096002	LSM-25738	SID7964698, SID24838915, BRD-A19719704	5307180	InChI=1S/C25H29N3O4S/c29-24-11-8-19-16-20(9-10-22(19)26-24)33(31,32)28-14-12-18(13-15-28)25(30)27-23-7-3-5-17-4-1-2-6-21(17)23/h1-2,4,6,9-10,16,18,23H,3,5,7-8,11-15H2,(H,26,29)(H,27,30)	VNNCJTKVOGVWQA-UHFFFAOYSA-N	O=C(NC1CCCc2ccccc12)C3CCN(CC3)S(=O)(=O)c4ccc5NC(=O)CCc5c4	BroadT	BRD-A19719704	BRD-A19719704-001-04-2	ChemDiv Inc.	C737-1187			O=C(NC1CCCc2ccccc12)C1CCN(CC1)S(=O)(=O)c1ccc2NC(=O)CCc2c1	InChI=1S/C25H29N3O4S/c29-24-11-8-19-16-20(9-10-22(19)26-24)33(31,32)28-14-12-18(13-15-28)25(30)27-23-7-3-5-17-4-1-2-6-21(17)23/h1-2,4,6,9-10,16,18,23H,3,5,7-8,11-15H2,(H,26,29)(H,27,30)	VNNCJTKVOGVWQA-UHFFFAOYSA-N	467.187877128							114278
MLS000678488	LSM-25739	SID24779606, BRD-K32342297	7207329	InChI=1S/C17H20N4OS/c22-16(19-13-6-2-1-3-7-13)12-23-17-10-9-15(20-21-17)14-8-4-5-11-18-14/h4-5,8-11,13H,1-3,6-7,12H2,(H,19,22)	LFRYWDSEPRISBT-UHFFFAOYSA-N	O=C(CSc1ccc(nn1)c2ccccn2)NC3CCCCC3	BroadT	BRD-K32342297	BRD-K32342297-001-06-2	Life Chemicals Inc.	F2005-0025			O=C(CSc1ccc(nn1)-c1ccccn1)NC1CCCCC1	InChI=1S/C17H20N4OS/c22-16(19-13-6-2-1-3-7-13)12-23-17-10-9-15(20-21-17)14-8-4-5-11-18-14/h4-5,8-11,13H,1-3,6-7,12H2,(H,19,22)	LFRYWDSEPRISBT-UHFFFAOYSA-N	328.13578199							114279
MLS000871662	LSM-44137	SID24814462, BRD-K18483075	16194364	InChI=1S/C19H17N5O3S2/c1-3-12-6-8-13(9-7-12)23-10-4-5-14(23)11-15-16(20)24-18(21-17(15)25)28-22-19(24)29(2,26)27/h4-11,20H,3H2,1-2H3/b15-11-,20-16?	MMGDGLARAHHBQA-GQECEEOXSA-N	CCc1ccc(cc1)n2cccc2\C=C\3/C(=O)N=C4SN=C(N4C3=N)S(=O)(=O)C	BroadT	BRD-K18483075	BRD-K18483075-001-05-2	ChemDiv Inc.	C370-6101			CCc1ccc(cc1)-n1cccc1\C=C1\C(=N)N2C(SN=C2S(C)(=O)=O)=NC1=O	InChI=1S/C19H17N5O3S2/c1-3-12-6-8-13(9-7-12)23-10-4-5-14(23)11-15-16(20)24-18(21-17(15)25)28-22-19(24)29(2,26)27/h4-11,20H,3H2,1-2H3/b15-11-,20-16?	MMGDGLARAHHBQA-GQECEEOXSA-N	427.077280834							
SMR000149826	LSM-25741	SID14732157, BRD-K50534277	920321	InChI=1S/C20H14N4O/c1-13-8-10-14(11-9-13)24-19(17-7-4-12-25-17)23-18-20(24)22-16-6-3-2-5-15(16)21-18/h2-12H,1H3	ODTSUZRODNCQKC-UHFFFAOYSA-N	Cc1ccc(cc1)n2c(nc3nc4ccccc4nc23)c5occc5	BroadT	BRD-K50534277	BRD-K50534277-001-05-7	InterBioScreen Ltd.	STOCK2S-20190			Cc1ccc(cc1)-n1c(nc2nc3ccccc3nc12)-c1ccco1	InChI=1S/C20H14N4O/c1-13-8-10-14(11-9-13)24-19(17-7-4-12-25-17)23-18-20(24)22-16-6-3-2-5-15(16)21-18/h2-12H,1H3	ODTSUZRODNCQKC-UHFFFAOYSA-N	326.116761108							114281
N-(5-Methoxy-benzothiazol-2-yl)-3-methyl-butyramide	LSM-25742	SID850892, BRD-K65116911	653438	InChI=1S/C13H16N2O2S/c1-8(2)6-12(16)15-13-14-10-7-9(17-3)4-5-11(10)18-13/h4-5,7-8H,6H2,1-3H3,(H,14,15,16)	JFJCXZVYYHCHFP-UHFFFAOYSA-N	COc1ccc2sc(NC(=O)CC(C)C)nc2c1	BroadT	BRD-K65116911	BRD-K65116911-001-05-8	Asinex Ltd.	ASN 03432887			COc1ccc2sc(NC(=O)CC(C)C)nc2c1	InChI=1S/C13H16N2O2S/c1-8(2)6-12(16)15-13-14-10-7-9(17-3)4-5-11(10)18-13/h4-5,7-8H,6H2,1-3H3,(H,14,15,16)	JFJCXZVYYHCHFP-UHFFFAOYSA-N	264.093248462							114282
4-(Allylsulfanyl)-2-(4-chlorobenzyl)quinazoline	LSM-25743	SID17410254, BRD-K88339047	2766822	InChI=1S/C18H15ClN2S/c1-2-11-22-18-15-5-3-4-6-16(15)20-17(21-18)12-13-7-9-14(19)10-8-13/h2-10H,1,11-12H2	KEGKAJWCHFXPGT-UHFFFAOYSA-N	Clc1ccc(Cc2nc(SCC=C)c3ccccc3n2)cc1	BroadT	BRD-K88339047	BRD-K88339047-001-05-6	Key Organics Ltd.	11F-390S			Clc1ccc(Cc2nc(SCC=C)c3ccccc3n2)cc1	InChI=1S/C18H15ClN2S/c1-2-11-22-18-15-5-3-4-6-16(15)20-17(21-18)12-13-7-9-14(19)10-8-13/h2-10H,1,11-12H2	KEGKAJWCHFXPGT-UHFFFAOYSA-N	326.0644469							114283
T5284028	LSM-25744	SID22408115, BRD-A45894813	3548476	InChI=1S/C16H20N4O2S/c1-11(21)18-13-6-4-12(5-7-13)15-10-23-16(20-19-15)17-9-14-3-2-8-22-14/h4-7,14H,2-3,8-10H2,1H3,(H,17,20)(H,18,21)	RXUFKHRJDTWTLV-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)C2=NN=C(NCC3CCCO3)SC2	BroadT	BRD-A45894813	BRD-A45894813-001-04-9	Enamine Ltd.	T5284028			CC(=O)Nc1ccc(cc1)C1=NN=C(NCC2CCCO2)SC1	InChI=1S/C16H20N4O2S/c1-11(21)18-13-6-4-12(5-7-13)15-10-23-16(20-19-15)17-9-14-3-2-8-22-14/h4-7,14H,2-3,8-10H2,1H3,(H,17,20)(H,18,21)	RXUFKHRJDTWTLV-UHFFFAOYSA-N	332.13069661							114284
MLS000075690	LSM-25745	SID847090, BRD-K02695342	649493	InChI=1S/C20H20FN7/c1-2-17-24-19(23-12-10-15-8-5-6-11-22-15)18-20(25-17)28(27-26-18)13-14-7-3-4-9-16(14)21/h3-9,11H,2,10,12-13H2,1H3,(H,23,24,25)	OZDPLNXCDXGQRB-UHFFFAOYSA-N	CCc1nc(NCCc2ccccn2)c3nnn(Cc4ccccc4F)c3n1	BroadT	BRD-K02695342	BRD-K02695342-001-05-6	Asinex Ltd.	ASN 09124239			CCc1nc(NCCc2ccccn2)c2nnn(Cc3ccccc3F)c2n1	InChI=1S/C20H20FN7/c1-2-17-24-19(23-12-10-15-8-5-6-11-22-15)18-20(25-17)28(27-26-18)13-14-7-3-4-9-16(14)21/h3-9,11H,2,10,12-13H2,1H3,(H,23,24,25)	OZDPLNXCDXGQRB-UHFFFAOYSA-N	377.17642191							114285
AC1MFIAV	LSM-25746	BRD-A02131228	2894861	InChI=1S/C16H19NO/c18-16(17-12-8-4-3-5-9-12)15-13-10-6-1-2-7-11-14(13)15/h3-6,8-10,13-15H,1-2,7,11H2,(H,17,18)	QAUWUDWLPNVUBH-UHFFFAOYSA-N	O=C(Nc1ccccc1)C2C3CCCCC=CC23	BroadT	BRD-A02131228	BRD-A02131228-001-05-3	ChemBridge Corporation	6369814			O=C(Nc1ccccc1)C1C2CCCC\C=C/C12	InChI=1S/C16H19NO/c18-16(17-12-8-4-3-5-9-12)15-13-10-6-1-2-7-11-14(13)15/h3-6,8-10,13-15H,1-2,7,11H2,(H,17,18)/b10-6-	QAUWUDWLPNVUBH-POHAHGRESA-N	241.146664238							114286
SMR000059815	LSM-25747	SID862299, BRD-K74574168	663528	InChI=1S/C20H18N4O3S/c1-14-6-4-8-16(12-14)28(25,26)24-20-19(21-13-15-7-5-11-27-15)22-17-9-2-3-10-18(17)23-20/h2-12H,13H2,1H3,(H,21,22)(H,23,24)	MEKUCHQKXBAKLQ-UHFFFAOYSA-N	Cc1cccc(c1)S(=O)(=O)Nc2nc3ccccc3nc2NCc4occc4	BroadT	BRD-K74574168	BRD-K74574168-001-05-7	InterBioScreen Ltd.	STOCK4S-39080			Cc1cccc(c1)S(=O)(=O)Nc1nc2ccccc2nc1NCc1ccco1	InChI=1S/C20H18N4O3S/c1-14-6-4-8-16(12-14)28(25,26)24-20-19(21-13-15-7-5-11-27-15)22-17-9-2-3-10-18(17)23-20/h2-12H,13H2,1H3,(H,21,22)(H,23,24)	MEKUCHQKXBAKLQ-UHFFFAOYSA-N	394.109961166							114287
MLS000578336	LSM-25748	SID17433648, BRD-K63155091	1798172	InChI=1S/C23H22N2OS/c1-15-13-16(2)21(17(3)14-15)24-23(27)25-22(26)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-14H,1-3H3,(H2,24,25,26,27)	OGGXHGKNYGOZQJ-UHFFFAOYSA-N	Cc1cc(C)c(NC(=S)NC(=O)c2ccc(cc2)c3ccccc3)c(C)c1	BroadT	BRD-K63155091	BRD-K63155091-001-05-0	ChemBridge Corporation	7390976			Cc1cc(C)c(NC(=S)NC(=O)c2ccc(cc2)-c2ccccc2)c(C)c1	InChI=1S/C23H22N2OS/c1-15-13-16(2)21(17(3)14-15)24-23(27)25-22(26)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-14H,1-3H3,(H2,24,25,26,27)	OGGXHGKNYGOZQJ-UHFFFAOYSA-N	374.145284034							114288
4-Chloro-1-methyl-n-[1-(4-methylbenzyl)-1H-pyrazol-3-yl]-1H-pyrazole-3-carboxamide	LSM-25749	SID17401363, BRD-K19746214	1223565	InChI=1S/C16H16ClN5O/c1-11-3-5-12(6-4-11)9-22-8-7-14(19-22)18-16(23)15-13(17)10-21(2)20-15/h3-8,10H,9H2,1-2H3,(H,18,19,23)	PPBSJEOSYCPVJN-UHFFFAOYSA-N	Cc1ccc(Cn2ccc(NC(=O)c3nn(C)cc3Cl)n2)cc1	BroadT	BRD-K19746214	BRD-K19746214-001-05-3	Specs	AK-968/15360451			Cc1ccc(Cn2ccc(NC(=O)c3nn(C)cc3Cl)n2)cc1	InChI=1S/C16H16ClN5O/c1-11-3-5-12(6-4-11)9-22-8-7-14(19-22)18-16(23)15-13(17)10-21(2)20-15/h3-8,10H,9H2,1-2H3,(H,18,19,23)	PPBSJEOSYCPVJN-UHFFFAOYSA-N	329.104337892							114289
5-(3,4,5-Trimethoxyphenyl)-1,3,4-oxadiazol-2-ol	LSM-25750	SID4258576, BRD-K69295359	330197	InChI=1S/C11H12N2O5/c1-15-7-4-6(10-12-13-11(14)18-10)5-8(16-2)9(7)17-3/h4-5H,1-3H3,(H,13,14)	NOAMAHAIBKUAMA-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)c2oc(O)nn2	BroadT	BRD-K69295359	BRD-K69295359-001-05-5	ChemBridge Corporation	7936441			COc1cc(cc(OC)c1OC)-c1nnc(O)o1	InChI=1S/C11H12N2O5/c1-15-7-4-6(10-12-13-11(14)18-10)5-8(16-2)9(7)17-3/h4-5H,1-3H3,(H,13,14)	NOAMAHAIBKUAMA-UHFFFAOYSA-N	252.074621504							114290
4-Methoxy-2-[3-(4-methoxyphenyl)-5-methyl-1H-pyrazol-4-yl]phenol	LSM-25751	SID14735159, BRD-K23893493	867312	InChI=1S/C18H18N2O3/c1-11-17(15-10-14(23-3)8-9-16(15)21)18(20-19-11)12-4-6-13(22-2)7-5-12/h4-10,21H,1-3H3,(H,19,20)	AOTWTCLFGRCJOV-UHFFFAOYSA-N	COc1ccc(cc1)c2[nH]nc(C)c2c3cc(OC)ccc3O	BroadT	BRD-K23893493	BRD-K23893493-001-05-9	ChemBridge Corporation	5471624			COc1ccc(cc1)-c1[nH]nc(C)c1-c1cc(OC)ccc1O	InChI=1S/C18H18N2O3/c1-11-17(15-10-14(23-3)8-9-16(15)21)18(20-19-11)12-4-6-13(22-2)7-5-12/h4-10,21H,1-3H3,(H,19,20)	AOTWTCLFGRCJOV-UHFFFAOYSA-N	310.131742456							114291
9F-324S	LSM-25752	SID24820049, BRD-K67857808	5189790	InChI=1S/C15H11ClN2O3/c16-11-6-7-12-13(8-11)18(21-9-14(19)20)15(17-12)10-4-2-1-3-5-10/h1-8H,9H2,(H,19,20)	KWURJTBVNPJIGP-UHFFFAOYSA-N	OC(=O)COn1c(nc2ccc(Cl)cc12)c3ccccc3	BroadT	BRD-K67857808	BRD-K67857808-001-05-1	Key Organics Ltd.	9F-324S			OC(=O)COn1c(nc2ccc(Cl)cc12)-c1ccccc1	InChI=1S/C15H11ClN2O3/c16-11-6-7-12-13(8-11)18(21-9-14(19)20)15(17-12)10-4-2-1-3-5-10/h1-8H,9H2,(H,19,20)	KWURJTBVNPJIGP-UHFFFAOYSA-N	302.045819942							114292
SMR000621894	LSM-25753	SID49731177, BRD-K01145373	3640175	InChI=1S/C22H28FN3O3S2/c23-19-7-9-20(10-8-19)25-11-13-26(14-12-25)22(27)18-5-3-17(4-6-18)16-24-31(28,29)21-2-1-15-30-21/h1-2,7-10,15,17-18,24H,3-6,11-14,16H2	QKBQBZRKMWCREJ-UHFFFAOYSA-N	Fc1ccc(cc1)N2CCN(CC2)C(=O)C3CCC(CNS(=O)(=O)c4cccs4)CC3	BroadT	BRD-K01145373	BRD-K01145373-001-05-5	ChemDiv Inc.	C274-0861			Fc1ccc(cc1)N1CCN(CC1)C(=O)C1CCC(CNS(=O)(=O)c2cccs2)CC1	InChI=1S/C22H28FN3O3S2/c23-19-7-9-20(10-8-19)25-11-13-26(14-12-25)22(27)18-5-3-17(4-6-18)16-24-31(28,29)21-2-1-15-30-21/h1-2,7-10,15,17-18,24H,3-6,11-14,16H2	QKBQBZRKMWCREJ-UHFFFAOYSA-N	465.155611366							114293
CBMICRO_027167	LSM-25754	BRD-K31054869	6614624	InChI=1S/C22H22N6O3S2/c1-4-20-24-25-22(32-20)27-33(30,31)18-11-7-16(8-12-18)23-13-19-15(3)26-28(21(19)29)17-9-5-14(2)6-10-17/h5-13,29H,4H2,1-3H3,(H,25,27)	VRBPNVIHSUZYSX-UHFFFAOYSA-N	CCc1nnc(NS(=O)(=O)c2ccc(cc2)N=Cc3c(C)nn(c3O)c4ccc(C)cc4)s1	BroadT	BRD-K31054869	BRD-K31054869-001-05-4	ChemBridge Corporation	5629737			CCc1nnc(NS(=O)(=O)c2ccc(cc2)N=Cc2c(C)nn(c2O)-c2ccc(C)cc2)s1	InChI=1S/C22H22N6O3S2/c1-4-20-24-25-22(32-20)27-33(30,31)18-11-7-16(8-12-18)23-13-19-15(3)26-28(21(19)29)17-9-5-14(2)6-10-17/h5-13,29H,4H2,1-3H3,(H,25,27)	VRBPNVIHSUZYSX-UHFFFAOYSA-N	482.119480004							
MLS000702666	LSM-25755	SID22402568, BRD-K85135497	5113181	InChI=1S/C13H18BrN7/c1-8-11(14)9(2)21(20-8)13-18-16-12(17-19-13)15-10-6-4-3-5-7-10/h10H,3-7H2,1-2H3,(H,15,16,17)	VIWOUODEFPGMBW-UHFFFAOYSA-N	Cc1nn(c(C)c1Br)c2nnc(NC3CCCCC3)nn2	BroadT	BRD-K85135497	BRD-K85135497-001-05-6	Specs	AG-227/14464039			Cc1nn(c(C)c1Br)-c1nnc(NC2CCCCC2)nn1	InChI=1S/C13H18BrN7/c1-8-11(14)9(2)21(20-8)13-18-16-12(17-19-13)15-10-6-4-3-5-7-10/h10H,3-7H2,1-2H3,(H,15,16,17)	VIWOUODEFPGMBW-UHFFFAOYSA-N	351.080706246							114295
AC1NOARS	LSM-15177	BRD-K50513469	5085142	InChI=1S/C27H32N4O4S/c1-4-31(5-2)18-17-28-26(32)21-11-15-23(16-12-21)29-27(33)22-7-6-8-25(19-22)36(34,35)30-24-13-9-20(3)10-14-24/h6-16,19,30H,4-5,17-18H2,1-3H3,(H,28,32)(H,29,33)	ANFMDKLZVFZSMK-UHFFFAOYSA-N	CCN(CC)CCNC(=O)c1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3ccc(C)cc3)cc1	BroadT	BRD-K50513469	BRD-K50513469-237-05-9	Enamine Ltd.	T0505-8650		[K]	CCN(CC)CCNC(=O)c1ccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc2ccc(C)cc2)cc1.[K]	InChI=1S/C27H32N4O4S.K.H/c1-4-31(5-2)18-17-28-26(32)21-11-15-23(16-12-21)29-27(33)22-7-6-8-25(19-22)36(34,35)30-24-13-9-20(3)10-14-24;;/h6-16,19,30H,4-5,17-18H2,1-3H3,(H,28,32)(H,29,33);;	NTEAVJZRZRPPBS-UHFFFAOYSA-N	508.214426234							103832, 103832
SMR000007473	LSM-25756	SID849989, BRD-A74068007	652495	InChI=1S/C21H19F2N3O2/c1-13-4-6-14(7-5-13)19-24-20(28-25-19)15-3-2-10-26(12-15)21(27)17-9-8-16(22)11-18(17)23/h4-9,11,15H,2-3,10,12H2,1H3	VZJMGASZSZFIGN-UHFFFAOYSA-N	Cc1ccc(cc1)c2noc(n2)C3CCCN(C3)C(=O)c4ccc(F)cc4F	BroadT	BRD-A74068007	BRD-A74068007-001-05-7	Asinex Ltd.	ASN 06935568			Cc1ccc(cc1)-c1noc(n1)C1CCCN(C1)C(=O)c1ccc(F)cc1F	InChI=1S/C21H19F2N3O2/c1-13-4-6-14(7-5-13)19-24-20(28-25-19)15-3-2-10-26(12-15)21(27)17-9-8-16(22)11-18(17)23/h4-9,11,15H,2-3,10,12H2,1H3	VZJMGASZSZFIGN-UHFFFAOYSA-N	383.144533278							114296
MLS000692154	LSM-25757	SID24818361, BRD-K14038372	1482551	InChI=1S/C13H9Cl2N3OS2/c14-8-2-1-7(9(15)5-8)6-19-10-3-4-21-11(10)12-16-13(20)18-17-12/h1-5H,6H2,(H2,16,17,18,20)	ZHWRJEFPWDFZOG-UHFFFAOYSA-N	Sc1n[nH]c(n1)c2sccc2OCc3ccc(Cl)cc3Cl	BroadT	BRD-K14038372	BRD-K14038372-001-05-8	Key Organics Ltd.	7D-134			Sc1n[nH]c(n1)-c1sccc1OCc1ccc(Cl)cc1Cl	InChI=1S/C13H9Cl2N3OS2/c14-8-2-1-7(9(15)5-8)6-19-10-3-4-21-11(10)12-16-13(20)18-17-12/h1-5H,6H2,(H2,16,17,18,20)	ZHWRJEFPWDFZOG-UHFFFAOYSA-N	356.956408738							114297
SMR000204513	LSM-25758	SID17511024, BRD-A05804296	5253005	InChI=1S/C16H20N3O5/c1-19(2)11-15(17(20)21)9-8-14(16(10-15,12-19)18(22)23)24-13-6-4-3-5-7-13/h3-8H,9-12H2,1-2H3/q+1	QYMKNXONXJPRSW-UHFFFAOYSA-N	C[N+]1(C)CC2(CC=C(Oc3ccccc3)C(C2)(C1)[N+](=O)[O-])[N+](=O)[O-]	BroadT	BRD-A05804296	BRD-A05804296-001-05-9	ChemDiv Inc.	8013-7403			C[N+]1(C)CC2(CC=C(Oc3ccccc3)C(C2)(C1)[N+]([O-])=O)[N+]([O-])=O	InChI=1S/C16H20N3O5/c1-19(2)11-15(17(20)21)9-8-14(16(10-15,12-19)18(22)23)24-13-6-4-3-5-7-13/h3-8H,9-12H2,1-2H3/q+1	QYMKNXONXJPRSW-UHFFFAOYSA-N	334.14029577							114298
STK821848	LSM-25759	SID17509310, BRD-K49512803	3600709	InChI=1S/C19H21N2O5P/c1-23-27(22,24-2)18-19(21-10-12-25-13-11-21)26-17(20-18)16-9-5-7-14-6-3-4-8-15(14)16/h3-9H,10-13H2,1-2H3	DFQDOAMXEXGRJY-UHFFFAOYSA-N	COP(=O)(OC)c1nc(oc1N2CCOCC2)c3cccc4ccccc34	BroadT	BRD-K49512803	BRD-K49512803-001-05-0	ChemDiv Inc.	D055-0118			COP(=O)(OC)c1nc(oc1N1CCOCC1)-c1cccc2ccccc12	InChI=1S/C19H21N2O5P/c1-23-27(22,24-2)18-19(21-10-12-25-13-11-21)26-17(20-18)16-9-5-7-14-6-3-4-8-15(14)16/h3-9H,10-13H2,1-2H3	DFQDOAMXEXGRJY-UHFFFAOYSA-N	388.118808302							114299
MLS000035896	LSM-25760	SID852690, BRD-K23716090	655324	InChI=1S/C13H13N3O2S3/c1-18-8-2-3-9-10(6-8)21-12(15-9)16-11(17)7-20-13-14-4-5-19-13/h2-3,6H,4-5,7H2,1H3,(H,15,16,17)	IAKKIHNNOHKIJQ-UHFFFAOYSA-N	COc1ccc2nc(NC(=O)CSC3=NCCS3)sc2c1	BroadT	BRD-K23716090	BRD-K23716090-001-06-7	Asinex Ltd.	BAS 03577596			COc1ccc2nc(NC(=O)CSC3=NCCS3)sc2c1	InChI=1S/C13H13N3O2S3/c1-18-8-2-3-9-10(6-8)21-12(15-9)16-11(17)7-20-13-14-4-5-19-13/h2-3,6H,4-5,7H2,1H3,(H,15,16,17)	IAKKIHNNOHKIJQ-UHFFFAOYSA-N	339.016988756							114300
SMR000060976	LSM-25761	SID3713125, BRD-K46660150	2333994	InChI=1S/C20H20F3N3O4S/c1-31-18-14(3-2-6-24-18)19(28)30-12-17(27)25-15-11-13(20(21,22)23)4-5-16(15)26-7-9-29-10-8-26/h2-6,11H,7-10,12H2,1H3,(H,25,27)	YXUGALMTAJORPL-UHFFFAOYSA-N	CSc1ncccc1C(=O)OCC(=O)Nc2cc(ccc2N3CCOCC3)C(F)(F)F	BroadT	BRD-K46660150	BRD-K46660150-001-05-9	Enamine Ltd.	T0505-5902			CSc1ncccc1C(=O)OCC(=O)Nc1cc(ccc1N1CCOCC1)C(F)(F)F	InChI=1S/C20H20F3N3O4S/c1-31-18-14(3-2-6-24-18)19(28)30-12-17(27)25-15-11-13(20(21,22)23)4-5-16(15)26-7-9-29-10-8-26/h2-6,11H,7-10,12H2,1H3,(H,25,27)	YXUGALMTAJORPL-UHFFFAOYSA-N	455.11266144							114301
AH-262/41702239	LSM-25762	SID14719216, BRD-K11144896	998884	InChI=1S/C26H28N2O4/c29-24(17-27-13-5-2-6-14-27)28-15-7-10-21-22-16-20(31-18-19-8-3-1-4-9-19)11-12-23(22)32-26(30)25(21)28/h1,3-4,8-9,11-12,16H,2,5-7,10,13-15,17-18H2	XWDHDYOHHPDPOC-UHFFFAOYSA-N	O=C(CN1CCCCC1)N2CCCC3=C2C(=O)Oc4ccc(OCc5ccccc5)cc34	BroadT	BRD-K11144896	BRD-K11144896-001-05-4	Specs	AH-262/41702239			O=C(CN1CCCCC1)N1CCCc2c1c(=O)oc1ccc(OCc3ccccc3)cc21	InChI=1S/C26H28N2O4/c29-24(17-27-13-5-2-6-14-27)28-15-7-10-21-22-16-20(31-18-19-8-3-1-4-9-19)11-12-23(22)32-26(30)25(21)28/h1,3-4,8-9,11-12,16H,2,5-7,10,13-15,17-18H2	XWDHDYOHHPDPOC-UHFFFAOYSA-N	432.204907396							114302
[4-(2-Fluoro-benzyl)-piperazin-1-yl]-naphthalen-1-yl-methanone	LSM-15559	BRD-K79153815	831544	InChI=1S/C22H21FN2O/c23-21-11-4-2-7-18(21)16-24-12-14-25(15-13-24)22(26)20-10-5-8-17-6-1-3-9-19(17)20/h1-11H,12-16H2	WFQQWXIFGRMRIK-UHFFFAOYSA-N	Fc1ccccc1CN2CCN(CC2)C(=O)c3cccc4ccccc34	BroadT	BRD-K79153815	BRD-K79153815-034-05-3	Asinex Ltd.	BAS 04057473		OC(=O)C(=O)O	Fc1ccccc1CN1CCN(CC1)C(=O)c1cccc2ccccc12.OC(=O)C(=O)O	InChI=1S/C22H21FN2O.C2H2O4/c23-21-11-4-2-7-18(21)16-24-12-14-25(15-13-24)22(26)20-10-5-8-17-6-1-3-9-19(17)20;3-1(4)2(5)6/h1-11H,12-16H2;(H,3,4)(H,5,6)	ANCMYKYNUSWWJP-UHFFFAOYSA-N	348.163791512							104195, 104195
MLS000333195	LSM-25763	SID26671673, BRD-K78549798	4269045	InChI=1S/C13H16N6O4/c1-23-9-4-2-8(3-5-9)16-13-17-11(14)10(19(21)22)12(18-13)15-6-7-20/h2-5,20H,6-7H2,1H3,(H4,14,15,16,17,18)	MIQPRJLDVRECPY-UHFFFAOYSA-N	COc1ccc(Nc2nc(N)c(c(NCCO)n2)[N+](=O)[O-])cc1	BroadT	BRD-K78549798	BRD-K78549798-001-05-3	InterBioScreen Ltd.	STOCK4S-78951			COc1ccc(Nc2nc(N)c(c(NCCO)n2)[N+]([O-])=O)cc1	InChI=1S/C13H16N6O4/c1-23-9-4-2-8(3-5-9)16-13-17-11(14)10(19(21)22)12(18-13)15-6-7-20/h2-5,20H,6-7H2,1H3,(H4,14,15,16,17,18)	MIQPRJLDVRECPY-UHFFFAOYSA-N	320.123303052							114303
AC1MZ07P	LSM-25764	BRD-K06430644	3840349	InChI=1S/C24H24N6O2/c1-3-4-5-8-13-29-16(2)26-22-20(24(29)31)21-23(28-19-12-7-6-11-18(19)27-21)30(22)25-15-17-10-9-14-32-17/h6-7,9-12,14-15H,3-5,8,13H2,1-2H3	DTXKGGUKFLTTET-UHFFFAOYSA-N	CCCCCCN1C(=Nc2c(C1=O)c3nc4ccccc4nc3n2N=Cc5occc5)C	BroadT	BRD-K06430644	BRD-K06430644-001-05-9	InterBioScreen Ltd.	STOCK5S-15463			CCCCCCn1c(C)nc2n(N=Cc3ccco3)c3nc4ccccc4nc3c2c1=O	InChI=1S/C24H24N6O2/c1-3-4-5-8-13-29-16(2)26-22-20(24(29)31)21-23(28-19-12-7-6-11-18(19)27-21)30(22)25-15-17-10-9-14-32-17/h6-7,9-12,14-15H,3-5,8,13H2,1-2H3	DTXKGGUKFLTTET-UHFFFAOYSA-N	428.196074068							114304
T0513-0972	LSM-25765	SID24826911, BRD-K59723758	2378150	InChI=1S/C18H19N3O3S/c1-5-24-18(22)15-10(2)14-16(19-11(3)20-17(14)25-15)21-12-6-8-13(23-4)9-7-12/h6-9H,5H2,1-4H3,(H,19,20,21)	RBJVFMACBZBSHN-UHFFFAOYSA-N	CCOC(=O)c1sc2nc(C)nc(Nc3ccc(OC)cc3)c2c1C	BroadT	BRD-K59723758	BRD-K59723758-001-05-5	Enamine Ltd.	T0513-0972			CCOC(=O)c1sc2nc(C)nc(Nc3ccc(OC)cc3)c2c1C	InChI=1S/C18H19N3O3S/c1-5-24-18(22)15-10(2)14-16(19-11(3)20-17(14)25-15)21-12-6-8-13(23-4)9-7-12/h6-9H,5H2,1-4H3,(H,19,20,21)	RBJVFMACBZBSHN-UHFFFAOYSA-N	357.114712188							114305
F1814-1102	LSM-25766	BRD-K67776920	2150987	InChI=1S/C14H18N2O3S/c1-5-6-11(17)15-14-16(2)12-9(18-3)7-8-10(19-4)13(12)20-14/h7-8H,5-6H2,1-4H3	FFCMVOBNNYYRRI-UHFFFAOYSA-N	CCCC(=O)N=C1Sc2c(OC)ccc(OC)c2N1C	BroadT	BRD-K67776920	BRD-K67776920-001-05-6	Life Chemicals Inc.	F1814-1102			CCCC(=O)N=c1sc2c(OC)ccc(OC)c2n1C	InChI=1S/C14H18N2O3S/c1-5-6-11(17)15-14-16(2)12-9(18-3)7-8-10(19-4)13(12)20-14/h7-8H,5-6H2,1-4H3	FFCMVOBNNYYRRI-UHFFFAOYSA-N	294.103813146							114306
MLS000737319	LSM-25767	SID26665116, BRD-K26612210	245299	InChI=1S/C11H10N2S/c1-9-11(13-8-7-12-9)14-10-5-3-2-4-6-10/h2-8H,1H3	VTUFUZBJQBYXKY-UHFFFAOYSA-N	Cc1nccnc1Sc2ccccc2	BroadT	BRD-K26612210	BRD-K26612210-001-06-0	National Cancer Institute Chemotherapeutic Agents Repository	57165			Cc1nccnc1Sc1ccccc1	InChI=1S/C11H10N2S/c1-9-11(13-8-7-12-9)14-10-5-3-2-4-6-10/h2-8H,1H3	VTUFUZBJQBYXKY-UHFFFAOYSA-N	202.05646903							114307
3J-603S	LSM-25768	SID24820232, BRD-K05321936	1474291	InChI=1S/C15H12ClN3/c1-2-10-19-13-8-4-3-7-12(13)18-15(19)11-6-5-9-17-14(11)16/h2-9H,1,10H2	LSLATZWQNULGKH-UHFFFAOYSA-N	Clc1ncccc1c2nc3ccccc3n2CC=C	BroadT	BRD-K05321936	BRD-K05321936-001-06-6	Key Organics Ltd.	3J-603S			Clc1ncccc1-c1nc2ccccc2n1CC=C	InChI=1S/C15H12ClN3/c1-2-10-19-13-8-4-3-7-12(13)18-15(19)11-6-5-9-17-14(11)16/h2-9H,1,10H2	LSLATZWQNULGKH-UHFFFAOYSA-N	269.071975124							114308
MLS000066264	LSM-25769	SID4256748, BRD-A61567545	2971259	InChI=1S/C15H15N3O2S/c1-8-3-4-10-11(7-16)15(21-13(10)5-8)17-14(19)12-6-9(2)20-18-12/h6,8H,3-5H2,1-2H3,(H,17,19)	WRUYVPAPSGQSGG-UHFFFAOYSA-N	CC1CCc2c(C1)sc(NC(=O)c3cc(C)on3)c2C#N	BroadT	BRD-A61567545	BRD-A61567545-001-07-8	ChemBridge Corporation	7948097			CC1CCc2c(C1)sc(NC(=O)c1cc(C)on1)c2C#N	InChI=1S/C15H15N3O2S/c1-8-3-4-10-11(7-16)15(21-13(10)5-8)17-14(19)12-6-9(2)20-18-12/h6,8H,3-5H2,1-2H3,(H,17,19)	WRUYVPAPSGQSGG-UHFFFAOYSA-N	301.08849744							114309
SMR000061975	LSM-25770	SID3716048, BRD-A65898531	2999454	InChI=1S/C19H25ClN2O3/c1-18(2)7-13-8-19(3,10-18)11-22(13)16(23)9-25-17(24)14-5-4-12(20)6-15(14)21/h4-6,13H,7-11,21H2,1-3H3	XGWYJHQRZQXMAE-UHFFFAOYSA-N	CC1(C)CC2CC(C)(CN2C(=O)COC(=O)c3ccc(Cl)cc3N)C1	BroadT	BRD-A65898531	BRD-A65898531-001-05-3	Enamine Ltd.	T0512-4565			CC12CC(CC(C)(C)C1)N(C2)C(=O)COC(=O)c1ccc(Cl)cc1N	InChI=1S/C19H25ClN2O3/c1-18(2)7-13-8-19(3,10-18)11-22(13)16(23)9-25-17(24)14-5-4-12(20)6-15(14)21/h4-6,13H,7-11,21H2,1-3H3	XGWYJHQRZQXMAE-UHFFFAOYSA-N	364.15537039							114310
ZINC05959732	LSM-25771	SID22401199, BRD-K29184319	4781543	InChI=1S/C17H18Cl2N2O3S/c1-11-4-6-13(10-16(11)25(23,24)21(2)3)20-17(22)9-12-5-7-14(18)15(19)8-12/h4-8,10H,9H2,1-3H3,(H,20,22)	CIBZECAENHZALH-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cc(NC(=O)Cc2ccc(Cl)c(Cl)c2)ccc1C	BroadT	BRD-K29184319	BRD-K29184319-001-05-9	Enamine Ltd.	ZT-2213115			CN(C)S(=O)(=O)c1cc(NC(=O)Cc2ccc(Cl)c(Cl)c2)ccc1C	InChI=1S/C17H18Cl2N2O3S/c1-11-4-6-13(10-16(11)25(23,24)21(2)3)20-17(22)9-12-5-7-14(18)15(19)8-12/h4-8,10H,9H2,1-3H3,(H,20,22)	CIBZECAENHZALH-UHFFFAOYSA-N	400.041518566							114311
MLS000527215	LSM-44138	SID14725499, BRD-K85671602	1933094	InChI=1S/C16H15N3O4S/c1-22-12-7-4-11(5-8-12)6-9-14(20)17-16(24)19-18-15(21)13-3-2-10-23-13/h2-10H,1H3,(H,18,21)(H2,17,19,20,24)/b9-6+	OXJJVSUMNJBHTR-RMKNXTFCSA-N	COc1ccc(\C=C\C(=O)NC(=S)NNC(=O)c2occc2)cc1	BroadT	BRD-K85671602	BRD-K85671602-001-06-0	Asinex Ltd.	BAS 01555493			COc1ccc(\C=C\C(=O)NC(=S)NNC(=O)c2ccco2)cc1	InChI=1S/C16H15N3O4S/c1-22-12-7-4-11(5-8-12)6-9-14(20)17-16(24)19-18-15(21)13-3-2-10-23-13/h2-10H,1H3,(H,18,21)(H2,17,19,20,24)/b9-6+	OXJJVSUMNJBHTR-RMKNXTFCSA-N	345.07832668							
N-[2,5-Dioxo-6-(4-phenoxyphenyl)-5,6-dihydro-2H-pyrano[3,2-c]pyridin-3-yl]benzenecarboxamide	LSM-25773	SID24821030, BRD-K00823222	1475615	InChI=1S/C27H18N2O5/c30-25(18-7-3-1-4-8-18)28-23-17-22-24(34-27(23)32)15-16-29(26(22)31)19-11-13-21(14-12-19)33-20-9-5-2-6-10-20/h1-17H,(H,28,30)	URWMMFHJPBNEJU-UHFFFAOYSA-N	O=C(NC1=CC2=C(OC1=O)C=CN(C2=O)c3ccc(Oc4ccccc4)cc3)c5ccccc5	BroadT	BRD-K00823222	BRD-K00823222-001-05-1	Key Organics Ltd.	10L-939			O=C(Nc1cc2c(ccn(-c3ccc(Oc4ccccc4)cc3)c2=O)oc1=O)c1ccccc1	InChI=1S/C27H18N2O5/c30-25(18-7-3-1-4-8-18)28-23-17-22-24(34-27(23)32)15-16-29(26(22)31)19-11-13-21(14-12-19)33-20-9-5-2-6-10-20/h1-17H,(H,28,30)	URWMMFHJPBNEJU-UHFFFAOYSA-N	450.121571696							114313
MLS000333675	LSM-44139	SID26662917, BRD-K45481296	6974998	InChI=1S/C16H15N3OS/c1-11-6-3-4-8-13(11)17-16-18-15(20)14(21-16)10-12-7-5-9-19(12)2/h3-10H,1-2H3,(H,17,18,20)/b14-10-	MXOCRJFHQPCTNY-UVTDQMKNSA-N	Cc1ccccc1NC2=NC(=O)\C(=C\c3cccn3C)\S2	BroadT	BRD-K45481296	BRD-K45481296-001-05-6	InterBioScreen Ltd.	STOCK4S-86379			Cc1ccccc1NC1=NC(=O)\C(S1)=C\c1cccn1C	InChI=1S/C16H15N3OS/c1-11-6-3-4-8-13(11)17-16-18-15(20)14(21-16)10-12-7-5-9-19(12)2/h3-10H,1-2H3,(H,17,18,20)/b14-10-	MXOCRJFHQPCTNY-UVTDQMKNSA-N	297.09358282							
AC1NSFBG	LSM-25775	SID7967240, BRD-K03671950	5308705	InChI=1S/C18H18N2O/c1-13-8-9-16-17(10-13)20(18(21)11-14(2)19-16)12-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3	KUQWFPDSBDBWKK-UHFFFAOYSA-N	CC1=Nc2ccc(C)cc2N(Cc3ccccc3)C(=O)C1	BroadT	BRD-K03671950	BRD-K03671950-001-05-9	ChemDiv Inc.	0867-0017			Cc1ccc2N=C(C)CC(=O)N(Cc3ccccc3)c2c1	InChI=1S/C18H18N2O/c1-13-8-9-16-17(10-13)20(18(21)11-14(2)19-16)12-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3	KUQWFPDSBDBWKK-UHFFFAOYSA-N	278.141913216							114315
Madrasin	LSM-25776	SID14739167, BRD-K48905682	816255	InChI=1S/C16H17N5O2/c1-8-9(2)17-16(20-14(8)22)21-15-18-10(3)12-6-5-11(23-4)7-13(12)19-15/h5-7H,1-4H3,(H2,17,18,19,20,21,22)	QQJIYKXTEMDJFM-UHFFFAOYSA-N	COc1ccc2c(C)nc(Nc3nc(C)c(C)c(O)n3)nc2c1	BroadT	BRD-K48905682	BRD-K48905682-001-07-9	ChemBridge Corporation	6344818			COc1ccc2c(C)nc(Nc3nc(C)c(C)c(O)n3)nc2c1	InChI=1S/C16H17N5O2/c1-8-9(2)17-16(20-14(8)22)21-15-18-10(3)12-6-5-11(23-4)7-13(12)19-15/h5-7H,1-4H3,(H2,17,18,19,20,21,22)	QQJIYKXTEMDJFM-UHFFFAOYSA-N	311.138224834							114316
STK058708	LSM-25777	SID14735758, BRD-K82554000	2855584	InChI=1S/C20H20ClN5O4/c21-17-14-16(26(27)28)6-7-18(17)25-10-8-24(9-11-25)12-13-29-20-19(22-30-23-20)15-4-2-1-3-5-15/h1-7,14H,8-13H2	DXQOIUIKKLEKLP-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(N2CCN(CCOc3nonc3c4ccccc4)CC2)c(Cl)c1	BroadT	BRD-K82554000	BRD-K82554000-001-06-9	ChemBridge Corporation	5613378			[O-][N+](=O)c1ccc(N2CCN(CCOc3nonc3-c3ccccc3)CC2)c(Cl)c1	InChI=1S/C20H20ClN5O4/c21-17-14-16(26(27)28)6-7-18(17)25-10-8-24(9-11-25)12-13-29-20-19(22-30-23-20)15-4-2-1-3-5-15/h1-7,14H,8-13H2	DXQOIUIKKLEKLP-UHFFFAOYSA-N	429.12038188							114317
[(4-Amino-7-tert-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetic acid	LSM-25778	SID26661049, BRD-A76528299	3707540	InChI=1S/C16H21N3O2S2/c1-16(2,3)8-4-5-9-10(6-8)23-14-12(9)13(17)18-15(19-14)22-7-11(20)21/h8H,4-7H2,1-3H3,(H,20,21)(H2,17,18,19)	PQDXZFSCGCGOFN-UHFFFAOYSA-N	CC(C)(C)C1CCc2c(C1)sc3nc(SCC(=O)O)nc(N)c23	BroadT	BRD-A76528299	BRD-A76528299-001-05-5	InterBioScreen Ltd.	STOCK1S-81447			CC(C)(C)C1CCc2c(C1)sc1nc(SCC(O)=O)nc(N)c21	InChI=1S/C16H21N3O2S2/c1-16(2,3)8-4-5-9-10(6-8)23-14-12(9)13(17)18-15(19-14)22-7-11(20)21/h8H,4-7H2,1-3H3,(H,20,21)(H2,17,18,19)	PQDXZFSCGCGOFN-UHFFFAOYSA-N	351.107518322							114318
ZINC13865141	LSM-25779	BRD-K64353415	51529225	InChI=1S/C22H24N2O4/c1-4-24-19-10-8-7-9-16(19)17-13-15(11-12-20(17)24)23-14-18(21(25)27-5-2)22(26)28-6-3/h7-14,18H,4-6H2,1-3H3	JVSDUOTUYQAVMH-UHFFFAOYSA-N	CCOC(=O)C(C=Nc1ccc2c(c1)c3ccccc3n2CC)C(=O)OCC	BroadT	BRD-K64353415	BRD-K64353415-001-05-9	InterBioScreen Ltd.	STOCK4S-08065			CCOC(=O)C(C=Nc1ccc2n(CC)c3ccccc3c2c1)C(=O)OCC	InChI=1S/C22H24N2O4/c1-4-24-19-10-8-7-9-16(19)17-13-15(11-12-20(17)24)23-14-18(21(25)27-5-2)22(26)28-6-3/h7-14,18H,4-6H2,1-3H3	JVSDUOTUYQAVMH-UHFFFAOYSA-N	380.173607268							114319
AX 56	LSM-25780	SID26666152, SID99044, BRD-A98156784	3000792	InChI=1S/C9H10N4OS/c15-9-7-8(10-4-11-9)13(5-12-7)6-2-1-3-14-6/h4-6H,1-3H2,(H,10,11,15)	DXIBRFHEZZOPFH-UHFFFAOYSA-N	Sc1ncnc2c1ncn2C3CCCO3	BroadT	BRD-A98156784	BRD-A98156784-001-05-1	National Cancer Institute Chemotherapeutic Agents Repository	AX 56 45153			Sc1ncnc2n(cnc12)C1CCCO1	InChI=1S/C9H10N4OS/c15-9-7-8(10-4-11-9)13(5-12-7)6-2-1-3-14-6/h4-6H,1-3H2,(H,10,11,15)	DXIBRFHEZZOPFH-UHFFFAOYSA-N	222.05753167							114320
6F-320S	LSM-25781	SID17402858, BRD-K11802924	3762986	InChI=1S/C14H10ClF3N2O2/c15-10-4-2-1-3-8(10)7-20-11(14(16,17)18)6-5-9(12(19)21)13(20)22/h1-6H,7H2,(H2,19,21)	AJMWESYOQQIRSD-UHFFFAOYSA-N	NC(=O)C1=CC=C(N(Cc2ccccc2Cl)C1=O)C(F)(F)F	BroadT	BRD-K11802924	BRD-K11802924-001-05-3	Key Organics Ltd.	6F-320S			NC(=O)c1ccc(n(Cc2ccccc2Cl)c1=O)C(F)(F)F	InChI=1S/C14H10ClF3N2O2/c15-10-4-2-1-3-8(10)7-20-11(14(16,17)18)6-5-9(12(19)21)13(20)22/h1-6H,7H2,(H2,19,21)	AJMWESYOQQIRSD-UHFFFAOYSA-N	330.03828989							114321
STK521307	LSM-44140	SID14734806, BRD-K39566703	750722	InChI=1S/C13H13NO3S2/c1-16-10-5-4-8(7-11(10)17-2)6-9-12(15)19-13(14-9)18-3/h4-7H,1-3H3/b9-6-	MZRPHCAYDKHTAN-TWGQIWQCSA-N	COc1ccc(\C=C\2/N=C(SC)SC2=O)cc1OC	BroadT	BRD-K39566703	BRD-K39566703-001-05-9	ChemBridge Corporation	6637308			COc1ccc(\C=C2/N=C(SC)SC2=O)cc1OC	InChI=1S/C13H13NO3S2/c1-16-10-5-4-8(7-11(10)17-2)6-9-12(15)19-13(14-9)18-3/h4-7H,1-3H3/b9-6-	MZRPHCAYDKHTAN-TWGQIWQCSA-N	295.033684666							
Methyl 3-fluoro-7-methylimidazo[1,2-a]pyridine-2-carboxylate	LSM-25783	SID7968606, BRD-K36546935	718831	InChI=1S/C10H9FN2O2/c1-6-3-4-13-7(5-6)12-8(9(13)11)10(14)15-2/h3-5H,1-2H3	GMFKNSLVVSMOTD-UHFFFAOYSA-N	COC(=O)c1nc2cc(C)ccn2c1F	BroadT	BRD-K36546935	BRD-K36546935-001-04-7	ChemDiv Inc.	8015-3358			COC(=O)c1nc2cc(C)ccn2c1F	InChI=1S/C10H9FN2O2/c1-6-3-4-13-7(5-6)12-8(9(13)11)10(14)15-2/h3-5H,1-2H3	GMFKNSLVVSMOTD-UHFFFAOYSA-N	208.064805748							114323
N-(1-Tert-butyl-1H-benzoimidazol-5-yl)-3,4,5-trimethoxy-benzamide	LSM-25784	SID49643144, BRD-K60865828	1077764	InChI=1S/C21H25N3O4/c1-21(2,3)24-12-22-15-11-14(7-8-16(15)24)23-20(25)13-9-17(26-4)19(28-6)18(10-13)27-5/h7-12H,1-6H3,(H,23,25)	JEGCNOKVNIAQFR-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)Nc2ccc3c(c2)ncn3C(C)(C)C	BroadT	BRD-K60865828	BRD-K60865828-001-05-7	Asinex Ltd.	BAS 05022416			COc1cc(cc(OC)c1OC)C(=O)Nc1ccc2n(cnc2c1)C(C)(C)C	InChI=1S/C21H25N3O4/c1-21(2,3)24-12-22-15-11-14(7-8-16(15)24)23-20(25)13-9-17(26-4)19(28-6)18(10-13)27-5/h7-12H,1-6H3,(H,23,25)	JEGCNOKVNIAQFR-UHFFFAOYSA-N	383.18450631							114324
SMR000036909	LSM-25785	SID863040, BRD-K77992016	664281	InChI=1S/C18H19N5O/c1-2-6-14(7-3-1)10-11-23-12-19-17(20-13-23)22-18-21-15-8-4-5-9-16(15)24-18/h1-9H,10-13H2,(H2,19,20,21,22)	DWOFIMUFCYMGPZ-UHFFFAOYSA-N	C(Cc1ccccc1)N2CNC(=NC2)Nc3oc4ccccc4n3	BroadT	BRD-K77992016	BRD-K77992016-001-06-0	InterBioScreen Ltd.	STOCK4S-64986			C(Cc1ccccc1)N1CNC(Nc2nc3ccccc3o2)=NC1	InChI=1S/C18H19N5O/c1-2-6-14(7-3-1)10-11-23-12-19-17(20-13-23)22-18-21-15-8-4-5-9-16(15)24-18/h1-9H,10-13H2,(H2,19,20,21,22)	DWOFIMUFCYMGPZ-UHFFFAOYSA-N	321.158960278							114325
BAS 08977214	LSM-25786	SID14726513, BRD-K47973609	1093136	InChI=1S/C16H15NO2S/c1-12-6-8-13(9-7-12)19-11-10-17-14-4-2-3-5-15(14)20-16(17)18/h2-9H,10-11H2,1H3	HQLCSJRJXQSRID-UHFFFAOYSA-N	Cc1ccc(OCCN2C(=O)Sc3ccccc23)cc1	BroadT	BRD-K47973609	BRD-K47973609-001-05-2	Asinex Ltd.	BAS 08977214			Cc1ccc(OCCn2c3ccccc3sc2=O)cc1	InChI=1S/C16H15NO2S/c1-12-6-8-13(9-7-12)19-11-10-17-14-4-2-3-5-15(14)20-16(17)18/h2-9H,10-11H2,1H3	HQLCSJRJXQSRID-UHFFFAOYSA-N	285.08234942							114326
1H-Pyrrole-1-acetic acid, 3-(ethoxycarbonyl)-2-methyl-5-phenyl-	LSM-25787	SID4240877, BRD-K26504715	3235924	InChI=1S/C16H17NO4/c1-3-21-16(20)13-9-14(12-7-5-4-6-8-12)17(11(13)2)10-15(18)19/h4-9H,3,10H2,1-2H3,(H,18,19)	BNYIGLLVRXMHSH-UHFFFAOYSA-N	CCOC(=O)c1cc(c2ccccc2)n(CC(=O)O)c1C	BroadT	BRD-K26504715	BRD-K26504715-001-05-1	ChemDiv Inc.	R052-2678			CCOC(=O)c1cc(-c2ccccc2)n(CC(O)=O)c1C	InChI=1S/C16H17NO4/c1-3-21-16(20)13-9-14(12-7-5-4-6-8-12)17(11(13)2)10-15(18)19/h4-9H,3,10H2,1-2H3,(H,18,19)	BNYIGLLVRXMHSH-UHFFFAOYSA-N	287.115758034							114327
MLS000586310	LSM-25788	SID17510851, BRD-A49581609	3359480	InChI=1S/C23H21N3O6/c1-25(16-6-4-3-5-7-16)22(23(27)24-15-8-10-17(30-2)11-9-15)18-12-20-21(32-14-31-20)13-19(18)26(28)29/h3-13,22H,14H2,1-2H3,(H,24,27)	HYKIXFONZOPOFC-UHFFFAOYSA-N	COc1ccc(NC(=O)C(N(C)c2ccccc2)c3cc4OCOc4cc3[N+](=O)[O-])cc1	BroadT	BRD-A49581609	BRD-A49581609-001-05-3	ChemDiv Inc.	C094-0138			COc1ccc(NC(=O)C(N(C)c2ccccc2)c2cc3OCOc3cc2[N+]([O-])=O)cc1	InChI=1S/C23H21N3O6/c1-25(16-6-4-3-5-7-16)22(23(27)24-15-8-10-17(30-2)11-9-15)18-12-20-21(32-14-31-20)13-19(18)26(28)29/h3-13,22H,14H2,1-2H3,(H,24,27)	HYKIXFONZOPOFC-UHFFFAOYSA-N	435.143035422							114328
AC1NSCED	LSM-25789	SID7965012, BRD-K61748355	5307366	InChI=1S/C25H20N6O3/c32-22(17-5-2-1-3-6-17)18-8-9-19-20(15-18)31-16-26-28-24(31)23(27-19)29-10-12-30(13-11-29)25(33)21-7-4-14-34-21/h1-9,14-16H,10-13H2	XEYOWLVKDVCITP-UHFFFAOYSA-N	O=C(N1CCN(CC1)c2nc3ccc(cc3n4cnnc24)C(=O)c5ccccc5)c6occc6	BroadT	BRD-K61748355	BRD-K61748355-001-04-8	ChemDiv Inc.	C301-2331			O=C(N1CCN(CC1)c1nc2ccc(cc2n2cnnc12)C(=O)c1ccccc1)c1ccco1	InChI=1S/C25H20N6O3/c32-22(17-5-2-1-3-6-17)18-8-9-19-20(15-18)31-16-26-28-24(31)23(27-19)29-10-12-30(13-11-29)25(33)21-7-4-14-34-21/h1-9,14-16H,10-13H2	XEYOWLVKDVCITP-UHFFFAOYSA-N	452.15968856							114329
AMBCB28959694	LSM-25790	SID24800746, BRD-A70919457	16192415	InChI=1S/C16H19ClFN3O2/c1-2-6-19-15(22)9-14-16(23)20-7-8-21(14)10-11-12(17)4-3-5-13(11)18/h2-5,14H,1,6-10H2,(H,19,22)(H,20,23)	GRWZIYVVMDBSHH-UHFFFAOYSA-N	Fc1cccc(Cl)c1CN2CCNC(=O)C2CC(=O)NCC=C	BroadT	BRD-A70919457	BRD-A70919457-001-05-0	ChemBridge Corporation	28959694			Fc1cccc(Cl)c1CN1CCNC(=O)C1CC(=O)NCC=C	InChI=1S/C16H19ClFN3O2/c1-2-6-19-15(22)9-14-16(23)20-7-8-21(14)10-11-12(17)4-3-5-13(11)18/h2-5,14H,1,6-10H2,(H,19,22)(H,20,23)	GRWZIYVVMDBSHH-UHFFFAOYSA-N	339.114982788							114330
AJ-292/41812123	LSM-25791	SID24789341, BRD-K94957107	1213862	InChI=1S/C20H26N4O2S/c1-5-24-14(2)18(15(3)25)19(21-20(24)27)23-12-10-22(11-13-23)16-6-8-17(26-4)9-7-16/h6-9H,5,10-13H2,1-4H3	IYFHFGJAKKCNCZ-UHFFFAOYSA-N	CCN1C(=C(C(=O)C)C(=NC1=S)N2CCN(CC2)c3ccc(OC)cc3)C	BroadT	BRD-K94957107	BRD-K94957107-001-05-4	ChemBridge Corporation	7554040			CCn1c(C)c(C(C)=O)c(nc1=S)N1CCN(CC1)c1ccc(OC)cc1	InChI=1S/C20H26N4O2S/c1-5-24-14(2)18(15(3)25)19(21-20(24)27)23-12-10-22(11-13-23)16-6-8-17(26-4)9-7-16/h6-9H,5,10-13H2,1-4H3	IYFHFGJAKKCNCZ-UHFFFAOYSA-N	386.177646802							114331
ST080940	LSM-25792	SID24808088, BRD-K41649958	1092463	InChI=1S/C14H10FN3S/c15-11-3-5-12(6-4-11)17-14-18-13(9-19-14)10-2-1-7-16-8-10/h1-9H,(H,17,18)	ZYCLZXHOEKNHLJ-UHFFFAOYSA-N	Fc1ccc(Nc2nc(cs2)c3cccnc3)cc1	BroadT	BRD-K41649958	BRD-K41649958-001-05-1	Asinex Ltd.	BAS 08770285			Fc1ccc(cc1)Nc1scc(n1)-c1cccnc1	InChI=1S/C14H10FN3S/c15-11-3-5-12(6-4-11)17-14-18-13(9-19-14)10-2-1-7-16-8-10/h1-9H,(H,17,18)	ZYCLZXHOEKNHLJ-UHFFFAOYSA-N	271.05794624							114332
HMS2589E06	LSM-25793	BRD-K48790928	12004878	InChI=1S/C19H16BrClN4O2/c1-27-18-7-2-13(8-15(18)11-25-12-17(21)10-23-25)9-22-24-19(26)14-3-5-16(20)6-4-14/h2-10,12H,11H2,1H3,(H,24,26)	IDENMZZQOVIJOU-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)c2ccc(Br)cc2)cc1Cn3cc(Cl)cn3	BroadT	BRD-K48790928	BRD-K48790928-001-05-3	ChemDiv Inc.	2391-2380			COc1ccc(C=NNC(=O)c2ccc(Br)cc2)cc1Cn1cc(Cl)cn1	InChI=1S/C19H16BrClN4O2/c1-27-18-7-2-13(8-15(18)11-25-12-17(21)10-23-25)9-22-24-19(26)14-3-5-16(20)6-4-14/h2-10,12H,11H2,1H3,(H,24,26)	IDENMZZQOVIJOU-UHFFFAOYSA-N	446.014516102							114333
AC1NUVB2	LSM-25794	SID26665560, BRD-K42720656	5513855	InChI=1S/C13H13N5O3S/c1-17-11(20)9(12(21)18(2)13(17)22)7-15-16-10(19)8-3-5-14-6-4-8/h3-7,15H,1-2H3,(H,16,19)	VFEFQDIIVNRUPH-UHFFFAOYSA-N	CN1C(=S)N(C)C(=O)C(=CNNC(=O)c2ccncc2)C1=O	BroadT	BRD-K42720656	BRD-K42720656-001-05-4	InterBioScreen Ltd.	STOCK2S-38009			CN1C(=S)N(C)C(=O)C(=CNNC(=O)c2ccncc2)C1=O	InChI=1S/C13H13N5O3S/c1-17-11(20)9(12(21)18(2)13(17)22)7-15-16-10(19)8-3-5-14-6-4-8/h3-7,15H,1-2H3,(H,16,19)	VFEFQDIIVNRUPH-UHFFFAOYSA-N	319.073910016							114334
F1461-0038	LSM-25795	SID26668299, SID4264097, BRD-A01535438	2942058	InChI=1S/C24H34N4O2S/c1-23(2,3)16-9-11-24(12-10-16)18(13-25)21(30)28-22(19(24)14-26)31-15-20(29)27-17-7-5-4-6-8-17/h16-18H,4-12,15H2,1-3H3,(H,27,29)(H,28,30)	VEHXFZAAPHNEKX-UHFFFAOYSA-N	CC(C)(C)C1CCC2(CC1)C(C#N)C(=O)NC(=C2C#N)SCC(=O)NC3CCCCC3	BroadT	BRD-A01535438	BRD-A01535438-001-07-8	ChemBridge Corporation	7546708			CC(C)(C)C1CCC2(CC1)C(C#N)C(=O)NC(SCC(=O)NC1CCCCC1)=C2C#N	InChI=1S/C24H34N4O2S/c1-23(2,3)16-9-11-24(12-10-16)18(13-25)21(30)28-22(19(24)14-26)31-15-20(29)27-17-7-5-4-6-8-17/h16-18H,4-12,15H2,1-3H3,(H,27,29)(H,28,30)	VEHXFZAAPHNEKX-UHFFFAOYSA-N	442.240247058							114335
AC1MZSEV	LSM-25796	BRD-K97458917	3905693	InChI=1S/C14H14N6O2/c1-10(8-13(21)18-12-4-2-3-5-17-12)19-20-14(22)11-9-15-6-7-16-11/h2-7,9H,8H2,1H3,(H,20,22)(H,17,18,21)	SHJJUTOOKVCRCT-UHFFFAOYSA-N	CC(=NNC(=O)c1cnccn1)CC(=O)Nc2ccccn2	BroadT	BRD-K97458917	BRD-K97458917-001-05-0	InterBioScreen Ltd.	STOCK4S-80155			CC(CC(=O)Nc1ccccn1)=NNC(=O)c1cnccn1	InChI=1S/C14H14N6O2/c1-10(8-13(21)18-12-4-2-3-5-17-12)19-20-14(22)11-9-15-6-7-16-11/h2-7,9H,8H2,1H3,(H,20,22)(H,17,18,21)	SHJJUTOOKVCRCT-UHFFFAOYSA-N	298.117823748							114336
MLS000660500	LSM-44141	SID24812072, BRD-K88715136	16193507	InChI=1S/C22H21N3O3/c1-28-17-9-5-15(6-10-17)7-12-21(26)23-16-8-11-19-18(14-16)22(27)25-13-3-2-4-20(25)24-19/h5-12,14H,2-4,13H2,1H3,(H,23,26)/b12-7+	SJSUIEJFRUPQPF-KPKJPENVSA-N	COc1ccc(\C=C\C(=O)Nc2ccc3N=C4CCCCN4C(=O)c3c2)cc1	BroadT	BRD-K88715136	BRD-K88715136-001-06-7	ChemDiv Inc.	C803-0097			COc1ccc(\C=C\C(=O)Nc2ccc3nc4CCCCn4c(=O)c3c2)cc1	InChI=1S/C22H21N3O3/c1-28-17-9-5-15(6-10-17)7-12-21(26)23-16-8-11-19-18(14-16)22(27)25-13-3-2-4-20(25)24-19/h5-12,14H,2-4,13H2,1H3,(H,23,26)/b12-7+	SJSUIEJFRUPQPF-KPKJPENVSA-N	375.158291562							
AM-944/40948140	LSM-25798	SID24808031, BRD-A03635368	3151561	InChI=1S/C19H15NO3/c1-13(18(21)15-8-3-2-4-9-15)23-19(22)17-12-11-14-7-5-6-10-16(14)20-17/h2-13H,1H3	XBFWCUCWTYZLCK-UHFFFAOYSA-N	CC(OC(=O)c1ccc2ccccc2n1)C(=O)c3ccccc3	BroadT	BRD-A03635368	BRD-A03635368-001-06-0	Asinex Ltd.	BAS 04999727			CC(OC(=O)c1ccc2ccccc2n1)C(=O)c1ccccc1	InChI=1S/C19H15NO3/c1-13(18(21)15-8-3-2-4-9-15)23-19(22)17-12-11-14-7-5-6-10-16(14)20-17/h2-13H,1H3	XBFWCUCWTYZLCK-UHFFFAOYSA-N	305.10519335							114338
AQ-405/42300088	LSM-15503	BRD-K14448458	4093034	InChI=1S/C13H13ClN3S/c1-18-13(16-17-9-3-2-4-10-17)15-12-7-5-11(14)6-8-12/h2-10H,1H3,(H,15,16)/q+1	VGBPPDQNGDRDDL-UHFFFAOYSA-N	CSC(=N[n+]1ccccc1)Nc2ccc(Cl)cc2	BroadT	BRD-K14448458	BRD-K14448458-005-05-7	Specs	AQ-405/42300088		I	CSC(Nc1ccc(Cl)cc1)=N[n+]1ccccc1.I	InChI=1S/C13H13ClN3S.HI/c1-18-13(16-17-9-3-2-4-10-17)15-12-7-5-11(14)6-8-12;/h2-10H,1H3,(H,15,16);1H/q+1;	LZCWGKUUJKYOML-UHFFFAOYSA-N	278.051870846							104144, 104144
AC1OBHV3	LSM-25799	SID26729924, BRD-K75504177	6823113	InChI=1S/C12H11Cl2N5/c13-8-4-3-7(5-9(8)14)16-18-11-10(6-1-2-6)17-19-12(11)15/h3-6H,1-2H2,(H3,15,17,19)	XRDJBWCKWYAEOK-UHFFFAOYSA-N	Nc1[nH]nc(C2CC2)c1N=Nc3ccc(Cl)c(Cl)c3	BroadT	BRD-K75504177	BRD-K75504177-001-05-2	Maybridge	KM 00400			Nc1[nH]nc(C2CC2)c1N=Nc1ccc(Cl)c(Cl)c1	InChI=1S/C12H11Cl2N5/c13-8-4-3-7(5-9(8)14)16-18-11-10(6-1-2-6)17-19-12(11)15/h3-6H,1-2H2,(H3,15,17,19)	XRDJBWCKWYAEOK-UHFFFAOYSA-N	295.039150822							
ASN 08222438	LSM-25800	SID24790129, BRD-A89386355	3229405	InChI=1S/C19H27N3O3/c1-5-25-19(24)17-11-16-15(9-10-20(16)4)21(17)12-18(23)22-13(2)7-6-8-14(22)3/h9-11,13-14H,5-8,12H2,1-4H3	AOZWUJUIOGRPFN-UHFFFAOYSA-N	CCOC(=O)c1cc2c(ccn2C)n1CC(=O)N3C(C)CCCC3C	BroadT	BRD-A89386355	BRD-A89386355-001-05-4	Asinex Ltd.	ASN 08222438			CCOC(=O)c1cc2n(C)ccc2n1CC(=O)N1C(C)CCCC1C	InChI=1S/C19H27N3O3/c1-5-25-19(24)17-11-16-15(9-10-20(16)4)21(17)12-18(23)22-13(2)7-6-8-14(22)3/h9-11,13-14H,5-8,12H2,1-4H3	AOZWUJUIOGRPFN-UHFFFAOYSA-N	345.205241754							114340
BRD-A82360798	LSM-25801			InChI=1S/C16H15N3O4S/c1-7-10(15(22)23-2)11(8-3-5-9(20)6-4-8)12-13(17-7)18-16(24)19-14(12)21/h3-6,10-11,20H,1-2H3,(H2,18,19,21,24)	YCHAIDHGHWLUFS-UHFFFAOYSA-N	COC(=O)C1C(c2ccc(O)cc2)c3c(O)nc(S)nc3N=C1C	BroadT	BRD-A82360798	BRD-A82360798-001-06-9	Enamine Ltd.	T0505-2853			COC(=O)C1C(c2ccc(O)cc2)c2c(O)nc(S)nc2N=C1C	InChI=1S/C16H15N3O4S/c1-7-10(15(22)23-2)11(8-3-5-9(20)6-4-8)12-13(17-7)18-16(24)19-14(12)21/h3-6,10-11,20H,1-2H3,(H2,18,19,21,24)	YCHAIDHGHWLUFS-UHFFFAOYSA-N	345.07832668							114341
AC1MWD1N	LSM-25802	BRD-K24412544	3747287	InChI=1S/C25H22N2O4S/c1-25(2,3)17-13-15-27(16-14-17)22-21(26-32(30,31)18-9-5-4-6-10-18)23(28)19-11-7-8-12-20(19)24(22)29/h4-16H,1-3H3/p+1	QFLMQIMVEYAESD-UHFFFAOYSA-O	CC(C)(C)c1cc[n+](cc1)C2=C(NS(=O)(=O)c3ccccc3)C(=O)c4ccccc4C2=O	BroadT	BRD-K24412544	BRD-K24412544-001-08-0	InterBioScreen Ltd.	STOCK3S-44022			CC(C)(C)c1cc[n+](cc1)C1=C(NS(=O)(=O)c2ccccc2)C(=O)c2ccccc2C1=O	InChI=1S/C25H22N2O4S/c1-25(2,3)17-13-15-27(16-14-17)22-21(26-32(30,31)18-9-5-4-6-10-18)23(28)19-11-7-8-12-20(19)24(22)29/h4-16H,1-3H3/p+1	QFLMQIMVEYAESD-UHFFFAOYSA-O	447.137852926							114342
MLS000067203	LSM-25803	SID14723305, BRD-A40924994	3226293	InChI=1S/C22H21N3O4S/c1-15-8-11-20(28-15)21-23-22(29-24-21)18-7-4-12-25(14-18)30(26,27)19-10-9-16-5-2-3-6-17(16)13-19/h2-3,5-6,8-11,13,18H,4,7,12,14H2,1H3	ZACUERGVYHWNNU-UHFFFAOYSA-N	Cc1oc(cc1)c2noc(n2)C3CCCN(C3)S(=O)(=O)c4ccc5ccccc5c4	BroadT	BRD-A40924994	BRD-A40924994-001-06-5	Asinex Ltd.	ASN 06941566			Cc1ccc(o1)-c1noc(n1)C1CCCN(C1)S(=O)(=O)c1ccc2ccccc2c1	InChI=1S/C22H21N3O4S/c1-15-8-11-20(28-15)21-23-22(29-24-21)18-7-4-12-25(14-18)30(26,27)19-10-9-16-5-2-3-6-17(16)13-19/h2-3,5-6,8-11,13,18H,4,7,12,14H2,1H3	ZACUERGVYHWNNU-UHFFFAOYSA-N	423.125276872							114343
F1734-0091	LSM-25804	SID22400763, BRD-A81850691	4902407	InChI=1S/C23H22N2O5S2/c1-8-3-5-10(6-4-8)13-14-11-7-12(17(14)31-19-18(13)32-23(30)24-19)16-15(11)20(26)25(21(16)27)9(2)22(28)29/h3-6,9,11-17H,7H2,1-2H3,(H,24,30)(H,28,29)	PNJWLTBJBFDYNO-UHFFFAOYSA-N	CC(N1C(=O)C2C3CC(C4C3Sc5nc(O)sc5C4c6ccc(C)cc6)C2C1=O)C(=O)O	BroadT	BRD-A81850691	BRD-A81850691-001-05-0	Life Chemicals Inc.	F1734-0091			CC(N1C(=O)C2C3CC(C4C3Sc3nc(O)sc3C4c3ccc(C)cc3)C2C1=O)C(O)=O	InChI=1S/C23H22N2O5S2/c1-8-3-5-10(6-4-8)13-14-11-7-12(17(14)31-19-18(13)32-23(30)24-19)16-15(11)20(26)25(21(16)27)9(2)22(28)29/h3-6,9,11-17H,7H2,1-2H3,(H,24,30)(H,28,29)	PNJWLTBJBFDYNO-UHFFFAOYSA-N	470.097013204							114344
SMR000197890	LSM-25805	SID17433282, BRD-A30630604	2933236	InChI=1S/C22H22N2O2S/c1-11(2)16-14-9-10-15(16)18-17(14)20(25)24(21(18)26)22-23-19(12(3)27-22)13-7-5-4-6-8-13/h4-8,14-15,17-18H,9-10H2,1-3H3	ONPLRFHNPZGXQL-UHFFFAOYSA-N	CC(=C1C2CCC1C3C2C(=O)N(C3=O)c4nc(c(C)s4)c5ccccc5)C	BroadT	BRD-A30630604	BRD-A30630604-001-06-2	ChemBridge Corporation	7289126			CC(C)=C1C2CCC1C1C2C(=O)N(C1=O)c1nc(c(C)s1)-c1ccccc1	InChI=1S/C22H22N2O2S/c1-11(2)16-14-9-10-15(16)18-17(14)20(25)24(21(18)26)22-23-19(12(3)27-22)13-7-5-4-6-8-13/h4-8,14-15,17-18H,9-10H2,1-3H3	ONPLRFHNPZGXQL-UHFFFAOYSA-N	378.140198654							114345
SMR000002219	LSM-25806	BRD-A85608679	645570	InChI=1S/C22H22N2O5/c1-27-17-8-5-15(6-9-17)24-22-19(21(26)23-13-18-3-2-10-28-18)11-14-4-7-16(25)12-20(14)29-22/h4-9,11-12,18,25H,2-3,10,13H2,1H3,(H,23,26)	PZGKEAVCAIEKPC-UHFFFAOYSA-N	COc1ccc(cc1)N=C2Oc3cc(O)ccc3C=C2C(=O)NCC4CCCO4	BroadT	BRD-A85608679	BRD-A85608679-001-05-4	Asinex Ltd.	ASN 03325796			COc1ccc(cc1)N=c1oc2cc(O)ccc2cc1C(=O)NCC1CCCO1	InChI=1S/C22H22N2O5/c1-27-17-8-5-15(6-9-17)24-22-19(21(26)23-13-18-3-2-10-28-18)11-14-4-7-16(25)12-20(14)29-22/h4-9,11-12,18,25H,2-3,10,13H2,1H3,(H,23,26)	PZGKEAVCAIEKPC-UHFFFAOYSA-N	394.152871824							
ASN 10791034	LSM-43623	BRD-K17042159	6489947	InChI=1S/C20H21N2O2/c1-15-17(9-8-16-10-12-21(2)13-11-16)18-6-4-5-7-19(18)22(15)14-20(23)24-3/h4-13H,14H2,1-3H3/q+1	LRTXUKRRTLYVBH-UHFFFAOYSA-N	COC(=O)Cn1c(C)c(\C=C\c2cc[n+](C)cc2)c3ccccc13	BroadT	BRD-K17042159	BRD-K17042159-005-05-7	Asinex Ltd.	ASN 10791034		I	COC(=O)Cn1c(C)c(\C=C\c2cc[n+](C)cc2)c2ccccc12.I	InChI=1S/C20H21N2O2.HI/c1-15-17(9-8-16-10-12-21(2)13-11-16)18-6-4-5-7-19(18)22(15)14-20(23)24-3;/h4-13H,14H2,1-3H3;1H/q+1;	XYYCURUQCSAYME-UHFFFAOYSA-N	321.160302932							104145, 104145
SMR000000949	LSM-25807	SID26667989, SID847836, BRD-K64567705	650250	InChI=1S/C23H25N3O4S2/c1-16-2-4-17(5-3-16)20-15-31-23(24-20)26-10-8-18(9-11-26)25-32(27,28)19-6-7-21-22(14-19)30-13-12-29-21/h2-7,14-15,18,25H,8-13H2,1H3	IYJMSEMFSSBVGH-UHFFFAOYSA-N	Cc1ccc(cc1)c2csc(n2)N3CCC(CC3)NS(=O)(=O)c4ccc5OCCOc5c4	BroadT	BRD-K64567705	BRD-K64567705-001-06-1	Asinex Ltd.	ASN 10408518			Cc1ccc(cc1)-c1csc(n1)N1CCC(CC1)NS(=O)(=O)c1ccc2OCCOc2c1	InChI=1S/C23H25N3O4S2/c1-16-2-4-17(5-3-16)20-15-31-23(24-20)26-10-8-18(9-11-26)25-32(27,28)19-6-7-21-22(14-19)30-13-12-29-21/h2-7,14-15,18,25H,8-13H2,1H3	IYJMSEMFSSBVGH-UHFFFAOYSA-N	471.12864769							114347
NSC382694	LSM-25808	BRD-K11242933	343283	InChI=1S/C18H13N3O2/c22-15-11-14(12-7-3-1-4-8-12)19-17-16(15)18(23)21(20-17)13-9-5-2-6-10-13/h1-11,22-23H	JMTGZJZWRODKAO-UHFFFAOYSA-N	Oc1cc(nc2nn(c(O)c12)c3ccccc3)c4ccccc4	BroadT	BRD-K11242933	BRD-K11242933-001-06-9	InterBioScreen Ltd.	STOCK5S-58177			Oc1n(nc2nc(cc(O)c12)-c1ccccc1)-c1ccccc1	InChI=1S/C18H13N3O2/c22-15-11-14(12-7-3-1-4-8-12)19-17-16(15)18(23)21(20-17)13-9-5-2-6-10-13/h1-11,22-23H	JMTGZJZWRODKAO-UHFFFAOYSA-N	303.100776686							
MLS000684803	LSM-25809	SID24790459, BRD-K57352453	3316051	InChI=1S/C13H17NOS/c15-13(14-9-4-5-10-14)8-11-16-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2	HBARXHJNGNDQAS-UHFFFAOYSA-N	O=C(CCSc1ccccc1)N2CCCC2	BroadT	BRD-K57352453	BRD-K57352453-001-11-1	ChemBridge Corporation	6187103			O=C(CCSc1ccccc1)N1CCCC1	InChI=1S/C13H17NOS/c15-13(14-9-4-5-10-14)8-11-16-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2	HBARXHJNGNDQAS-UHFFFAOYSA-N	235.103084864							114349
5555-13-5	LSM-25810	SID4244817, BRD-A19202454	101181	InChI=1S/C15H14O3/c1-11(15(16)17)18-14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-11H,1H3,(H,16,17)	FUPGQEMJIGUBGO-UHFFFAOYSA-N	CC(Oc1ccc(cc1)c2ccccc2)C(=O)O	BroadT	BRD-A19202454	BRD-A19202454-001-05-8	ChemDiv Inc.	0703-6131			CC(Oc1ccc(cc1)-c1ccccc1)C(O)=O	InChI=1S/C15H14O3/c1-11(15(16)17)18-14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-11H,1H3,(H,16,17)	FUPGQEMJIGUBGO-UHFFFAOYSA-N	242.094294308							114350
STK344460	LSM-25811	SID24793035, BRD-K00788800	1018007	InChI=1S/C19H19ClN2O4/c20-14-2-1-3-15(18(14)22-6-8-24-9-7-22)21-19(23)13-4-5-16-17(12-13)26-11-10-25-16/h1-5,12H,6-11H2,(H,21,23)	VNDYUSFCHLGIQS-UHFFFAOYSA-N	Clc1cccc(NC(=O)c2ccc3OCCOc3c2)c1N4CCOCC4	BroadT	BRD-K00788800	BRD-K00788800-001-05-6	ChemBridge Corporation	7912548			Clc1cccc(NC(=O)c2ccc3OCCOc3c2)c1N1CCOCC1	InChI=1S/C19H19ClN2O4/c20-14-2-1-3-15(18(14)22-6-8-24-9-7-22)21-19(23)13-4-5-16-17(12-13)26-11-10-25-16/h1-5,12H,6-11H2,(H,21,23)	VNDYUSFCHLGIQS-UHFFFAOYSA-N	374.103334818							114351
MLS000053466	LSM-25812	SID24839733, SID3717261, BRD-A10037427	2999928	InChI=1S/C28H26N4O4/c33-26-15-19(17-32(26)20-10-11-24-25(16-20)36-13-12-35-24)28(34)31-23(14-18-6-2-1-3-7-18)27-29-21-8-4-5-9-22(21)30-27/h1-11,16,19,23H,12-15,17H2,(H,29,30)(H,31,34)	DRKIPNUDTIIJLM-UHFFFAOYSA-N	O=C(NC(Cc1ccccc1)c2nc3ccccc3[nH]2)C4CN(C(=O)C4)c5ccc6OCCOc6c5	BroadT	BRD-A10037427	BRD-A10037427-001-05-1	Enamine Ltd.	T5248323			O=C(NC(Cc1ccccc1)c1nc2ccccc2[nH]1)C1CN(C(=O)C1)c1ccc2OCCOc2c1	InChI=1S/C28H26N4O4/c33-26-15-19(17-32(26)20-10-11-24-25(16-20)36-13-12-35-24)28(34)31-23(14-18-6-2-1-3-7-18)27-29-21-8-4-5-9-22(21)30-27/h1-11,16,19,23H,12-15,17H2,(H,29,30)(H,31,34)	DRKIPNUDTIIJLM-UHFFFAOYSA-N	482.195405352							114352
2-Thiophen-2-ylmethylene-indan-1,3-dione	LSM-25813	SID17507454, BRD-K74571580	730427	InChI=1S/C14H8O2S/c15-13-10-5-1-2-6-11(10)14(16)12(13)8-9-4-3-7-17-9/h1-8H	TWXXLVDSKBCTBT-UHFFFAOYSA-N	O=C1C(=Cc2cccs2)C(=O)c3ccccc13	BroadT	BRD-K74571580	BRD-K74571580-001-05-3	Asinex Ltd.	BAS 00457689			O=C1C(=Cc2cccs2)C(=O)c2ccccc12	InChI=1S/C14H8O2S/c15-13-10-5-1-2-6-11(10)14(16)12(13)8-9-4-3-7-17-9/h1-8H	TWXXLVDSKBCTBT-UHFFFAOYSA-N	240.024500186							114353
SMR000180454	LSM-25814	SID17402697, BRD-K97895199	3749454	InChI=1S/C23H24N4O5/c1-31-18-6-3-15(4-7-18)19-14-20(25-24-19)16-9-11-26(12-10-16)21-8-5-17(23(28)32-2)13-22(21)27(29)30/h3-8,13-14,16H,9-12H2,1-2H3,(H,24,25)	ZMIRPKQRKYFMDH-UHFFFAOYSA-N	COC(=O)c1ccc(N2CCC(CC2)c3cc([nH]n3)c4ccc(OC)cc4)c(c1)[N+](=O)[O-]	BroadT	BRD-K97895199	BRD-K97895199-001-06-0	Key Organics Ltd.	9X-0016			COC(=O)c1ccc(N2CCC(CC2)c2cc([nH]n2)-c2ccc(OC)cc2)c(c1)[N+]([O-])=O	InChI=1S/C23H24N4O5/c1-31-18-6-3-15(4-7-18)19-14-20(25-24-19)16-9-11-26(12-10-16)21-8-5-17(23(28)32-2)13-22(21)27(29)30/h3-8,13-14,16H,9-12H2,1-2H3,(H,24,25)	ZMIRPKQRKYFMDH-UHFFFAOYSA-N	436.174669908							114354
N-(4-Hydroxy-2-oxo-1,2-dihydroquinolin-3-yl)pentanamide	LSM-25815	SID863755, BRD-K91994666	54687814	InChI=1S/C14H16N2O3/c1-2-3-8-11(17)16-12-13(18)9-6-4-5-7-10(9)15-14(12)19/h4-7H,2-3,8H2,1H3,(H,16,17)(H2,15,18,19)	JNYOMKSHUGWGRK-UHFFFAOYSA-N	CCCCC(=O)Nc1c(O)nc2ccccc2c1O	BroadT	BRD-K91994666	BRD-K91994666-001-05-3	InterBioScreen Ltd.	STOCK4S-86337			CCCCC(=O)Nc1c(O)nc2ccccc2c1O	InChI=1S/C14H16N2O3/c1-2-3-8-11(17)16-12-13(18)9-6-4-5-7-10(9)15-14(12)19/h4-7H,2-3,8H2,1H3,(H,16,17)(H2,15,18,19)	JNYOMKSHUGWGRK-UHFFFAOYSA-N	260.116092392							114355
MLS000686738	LSM-25816	SID24819695, BRD-K99790355	1283502	InChI=1S/C24H28N2O4S/c1-3-30-24(28)23-20(16-31-17-7-5-4-6-8-17)25(2)19-9-10-21(27)18(22(19)23)15-26-11-13-29-14-12-26/h4-10,27H,3,11-16H2,1-2H3	MOYCVQNAQRFXAY-UHFFFAOYSA-N	CCOC(=O)c1c(CSc2ccccc2)n(C)c3ccc(O)c(CN4CCOCC4)c13	BroadT	BRD-K99790355	BRD-K99790355-001-06-1	ChemDiv Inc.	4267-0029			CCOC(=O)c1c(CSc2ccccc2)n(C)c2ccc(O)c(CN3CCOCC3)c12	InChI=1S/C24H28N2O4S/c1-3-30-24(28)23-20(16-31-17-7-5-4-6-8-17)25(2)19-9-10-21(27)18(22(19)23)15-26-11-13-29-14-12-26/h4-10,27H,3,11-16H2,1-2H3	MOYCVQNAQRFXAY-UHFFFAOYSA-N	440.176978086							114356
ST50191717	LSM-25817	SID7977620, BRD-K32364382	1565331	InChI=1S/C15H20ClNO2/c16-13-6-8-14(9-7-13)19-12-4-5-15(18)17-10-2-1-3-11-17/h6-9H,1-5,10-12H2	GZCZNGWMCRHVAA-UHFFFAOYSA-N	Clc1ccc(OCCCC(=O)N2CCCCC2)cc1	BroadT	BRD-K32364382	BRD-K32364382-001-05-4	ChemBridge Corporation	6800609			Clc1ccc(OCCCC(=O)N2CCCCC2)cc1	InChI=1S/C15H20ClNO2/c16-13-6-8-14(9-7-13)19-12-4-5-15(18)17-10-2-1-3-11-17/h6-9H,1-5,10-12H2	GZCZNGWMCRHVAA-UHFFFAOYSA-N	281.1182566							114357
BDBM74791	LSM-25818	BRD-K66816205	91898111	InChI=1S/C15H9BrFN3O2/c16-9-5-11-14(18-7-9)19-12(15(22)20-11)6-13(21)8-1-3-10(17)4-2-8/h1-5,7H,6H2,(H,20,22)	RKNUKPLCLKVGKX-UHFFFAOYSA-N	Oc1nc2cc(Br)cnc2nc1CC(=O)c3ccc(F)cc3	BroadT	BRD-K66816205	BRD-K66816205-001-06-5	ChemDiv Inc.	C301-0411			Oc1nc2cc(Br)cnc2nc1CC(=O)c1ccc(F)cc1	InChI=1S/C15H9BrFN3O2/c16-9-5-11-14(18-7-9)19-12(15(22)20-11)6-13(21)8-1-3-10(17)4-2-8/h1-5,7H,6H2,(H,20,22)	RKNUKPLCLKVGKX-UHFFFAOYSA-N	360.986217358							114358
436087-23-9	LSM-25819	GNF-PF-1654, BRD-K56051118	795858	InChI=1S/C14H19ClN2O/c15-11-14(18)16-12-5-7-13(8-6-12)17-9-3-1-2-4-10-17/h5-8H,1-4,9-11H2,(H,16,18)	MGNASFRGYKAMPD-UHFFFAOYSA-N	ClCC(=O)Nc1ccc(cc1)N2CCCCCC2	BroadT	BRD-K56051118	BRD-K56051118-001-06-7	Asinex Ltd.	BAS 04881613			ClCC(=O)Nc1ccc(cc1)N1CCCCCC1	InChI=1S/C14H19ClN2O/c15-11-14(18)16-12-5-7-13(8-6-12)17-9-3-1-2-4-10-17/h5-8H,1-4,9-11H2,(H,16,18)	MGNASFRGYKAMPD-UHFFFAOYSA-N	266.118590958							114359
F0529-0529	LSM-25820	SID17515667, BRD-K07988229	4524308	InChI=1S/C16H12F3N3OS3/c17-16(18,19)11-5-3-10(4-6-11)9-25-15-22-21-14(26-15)20-13(23)8-12-2-1-7-24-12/h1-7H,8-9H2,(H,20,21,23)	HPZLLNQNMIJGDF-UHFFFAOYSA-N	FC(F)(F)c1ccc(CSc2nnc(NC(=O)Cc3cccs3)s2)cc1	BroadT	BRD-K07988229	BRD-K07988229-001-05-8	Life Chemicals Inc.	F0529-0529			FC(F)(F)c1ccc(CSc2nnc(NC(=O)Cc3cccs3)s2)cc1	InChI=1S/C16H12F3N3OS3/c17-16(18,19)11-5-3-10(4-6-11)9-25-15-22-21-14(26-15)20-13(23)8-12-2-1-7-24-12/h1-7H,8-9H2,(H,20,21,23)	HPZLLNQNMIJGDF-UHFFFAOYSA-N	415.009458704							114360
T0508-9675	LSM-25821	SID22405573, BRD-A61263491	4161409	InChI=1S/C34H28N4O4/c1-21-31(33(40)38(37(21)3)24-14-5-4-6-15-24)36-32(39)22(2)42-34(41)28-20-30(35-29-19-10-9-17-27(28)29)26-18-11-13-23-12-7-8-16-25(23)26/h4-20,22H,1-3H3,(H,36,39)	NNMCTLDKZISKFI-UHFFFAOYSA-N	CC(OC(=O)c1cc(nc2ccccc12)c3cccc4ccccc34)C(=O)NC5=C(C)N(C)N(C5=O)c6ccccc6	BroadT	BRD-A61263491	BRD-A61263491-001-05-2	Enamine Ltd.	T0508-9675			CC(OC(=O)c1cc(nc2ccccc12)-c1cccc2ccccc12)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	InChI=1S/C34H28N4O4/c1-21-31(33(40)38(37(21)3)24-14-5-4-6-15-24)36-32(39)22(2)42-34(41)28-20-30(35-29-19-10-9-17-27(28)29)26-18-11-13-23-12-7-8-16-25(23)26/h4-20,22H,1-3H3,(H,36,39)	NNMCTLDKZISKFI-UHFFFAOYSA-N	556.211055416							114361
MLS000075664	LSM-25822	SID849282, BRD-K69651984	651759	InChI=1S/C20H20FN7/c1-2-5-17-24-19(23-12-14-8-10-22-11-9-14)18-20(25-17)28(27-26-18)13-15-6-3-4-7-16(15)21/h3-4,6-11H,2,5,12-13H2,1H3,(H,23,24,25)	IKYOARDCZOPQGN-UHFFFAOYSA-N	CCCc1nc(NCc2ccncc2)c3nnn(Cc4ccccc4F)c3n1	BroadT	BRD-K69651984	BRD-K69651984-001-05-2	Asinex Ltd.	ASN 09124457			CCCc1nc(NCc2ccncc2)c2nnn(Cc3ccccc3F)c2n1	InChI=1S/C20H20FN7/c1-2-5-17-24-19(23-12-14-8-10-22-11-9-14)18-20(25-17)28(27-26-18)13-15-6-3-4-7-16(15)21/h3-4,6-11H,2,5,12-13H2,1H3,(H,23,24,25)	IKYOARDCZOPQGN-UHFFFAOYSA-N	377.17642191							114362
MLS-0095190.0001	LSM-25823	SID14723415, SID56373516, BRD-K76601901	831693	InChI=1S/C17H19N5O2/c1-4-11-5-6-14-13(7-11)10(2)18-16(20-14)22-17-19-12(9-24-3)8-15(23)21-17/h5-8H,4,9H2,1-3H3,(H2,18,19,20,21,22,23)	FOWJZSWMOQJOGI-UHFFFAOYSA-N	CCc1ccc2nc(Nc3nc(O)cc(COC)n3)nc(C)c2c1	BroadT	BRD-K76601901	BRD-K76601901-001-05-8	Asinex Ltd.	BAS 03450476			CCc1ccc2nc(Nc3nc(O)cc(COC)n3)nc(C)c2c1	InChI=1S/C17H19N5O2/c1-4-11-5-6-14-13(7-11)10(2)18-16(20-14)22-17-19-12(9-24-3)8-15(23)21-17/h5-8H,4,9H2,1-3H3,(H2,18,19,20,21,22,23)	FOWJZSWMOQJOGI-UHFFFAOYSA-N	325.153874898							114363
MLS001029767	LSM-25824	SID26670865, BRD-K08304598	7367736	InChI=1S/C17H13N5O4/c1-26-10-4-2-3-9(7-10)22-16(24)12-13(20-21-14(12)17(22)25)15(23)11-8-18-5-6-19-11/h2-8,12,14,21H,1H3/t12-,14+/m0/s1	NMOZCKQFQXCMBL-GXTWGEPZSA-N	COc1cccc(c1)N2C(=O)[C@@H]3NN=C([C@@H]3C2=O)C(=O)c4cnccn4	BroadT	BRD-K08304598	BRD-K08304598-001-10-0	InterBioScreen Ltd.	STOCK2S-17567			COc1cccc(c1)N1C(=O)[C@@H]2NN=C([C@@H]2C1=O)C(=O)c1cnccn1	InChI=1S/C17H13N5O4/c1-26-10-4-2-3-9(7-10)22-16(24)12-13(20-21-14(12)17(22)25)15(23)11-8-18-5-6-19-11/h2-8,12,14,21H,1H3/t12-,14+/m0/s1	NMOZCKQFQXCMBL-GXTWGEPZSA-N	351.096753946							114364
AC1LHR4E	LSM-25825	BRD-K70946285	842567	InChI=1S/C12H12N2OS2/c1-8-9(2)17-7-11(8)12(15)14-13-5-10-3-4-16-6-10/h3-7H,1-2H3,(H,14,15)	SEFLPDGXFQMXCS-UHFFFAOYSA-N	Cc1scc(C(=O)NN=Cc2ccsc2)c1C	BroadT	BRD-K70946285	BRD-K70946285-001-05-9	Specs	AK-968/41026851			Cc1scc(C(=O)NN=Cc2ccsc2)c1C	InChI=1S/C12H12N2OS2/c1-8-9(2)17-7-11(8)12(15)14-13-5-10-3-4-16-6-10/h3-7H,1-2H3,(H,14,15)	SEFLPDGXFQMXCS-UHFFFAOYSA-N	264.039104404							114365
T5563824	LSM-25826	SID49673820, BRD-K37398898	2483195	InChI=1S/C17H18FNO4/c1-4-22-16(20)14-10(2)15(19-11(14)3)17(21)23-9-12-7-5-6-8-13(12)18/h5-8,19H,4,9H2,1-3H3	XECCJSKVKMPDOS-UHFFFAOYSA-N	CCOC(=O)c1c(C)[nH]c(C(=O)OCc2ccccc2F)c1C	BroadT	BRD-K37398898	BRD-K37398898-001-06-2	Enamine Ltd.	T5563824			CCOC(=O)c1c(C)[nH]c(C(=O)OCc2ccccc2F)c1C	InChI=1S/C17H18FNO4/c1-4-22-16(20)14-10(2)15(19-11(14)3)17(21)23-9-12-7-5-6-8-13(12)18/h5-8,19H,4,9H2,1-3H3	XECCJSKVKMPDOS-UHFFFAOYSA-N	319.121986266							114366
SMR000022226	LSM-25827	SID4241047, SID87342970, BRD-A28535779	3236070	InChI=1S/C27H29N3O6/c1-15-8-7-9-23(28-15)29-26(31)24-17-13-21(35-5)22(36-6)14-18(17)27(32)30(2)25(24)16-10-11-19(33-3)20(12-16)34-4/h7-14,24-25H,1-6H3,(H,28,29,31)	AMDHZXXQDIWVNQ-UHFFFAOYSA-N	COc1ccc(cc1OC)C2C(C(=O)Nc3cccc(C)n3)c4cc(OC)c(OC)cc4C(=O)N2C	BroadT	BRD-A28535779	BRD-A28535779-001-05-8	ChemDiv Inc.	C115-0277			COc1ccc(cc1OC)C1C(C(=O)Nc2cccc(C)n2)c2cc(OC)c(OC)cc2C(=O)N1C	InChI=1S/C27H29N3O6/c1-15-8-7-9-23(28-15)29-26(31)24-17-13-21(35-5)22(36-6)14-18(17)27(32)30(2)25(24)16-10-11-19(33-3)20(12-16)34-4/h7-14,24-25H,1-6H3,(H,28,29,31)	AMDHZXXQDIWVNQ-UHFFFAOYSA-N	491.205635678							114367
SMR000022047	LSM-25828	SID24839071, SID4244557, BRD-K72154771	2160633	InChI=1S/C17H15F3N2O5/c1-24-10-7-8-12(25-2)11(9-10)21-15(23)22-17(16(18,19)20)26-13-5-3-4-6-14(13)27-17/h3-9H,1-2H3,(H2,21,22,23)	GESUEFWZCPKEMI-UHFFFAOYSA-N	COc1ccc(OC)c(NC(=O)NC2(Oc3ccccc3O2)C(F)(F)F)c1	BroadT	BRD-K72154771	BRD-K72154771-001-05-9	ChemDiv Inc.	C097-0064			COc1ccc(OC)c(NC(=O)NC2(Oc3ccccc3O2)C(F)(F)F)c1	InChI=1S/C17H15F3N2O5/c1-24-10-7-8-12(25-2)11(9-10)21-15(23)22-17(16(18,19)20)26-13-5-3-4-6-14(13)27-17/h3-9H,1-2H3,(H2,21,22,23)	GESUEFWZCPKEMI-UHFFFAOYSA-N	384.0933062							114368
MLS000763694	LSM-25829	BRD-A13250557	3718446	InChI=1S/C16H17ClN6O/c1-11(24-13-6-4-5-12(17)9-13)14-7-8-18-16-20-15(21-23(14)16)19-10-22(2)3/h4-11H,1-3H3	QCIDABMIGABSSL-UHFFFAOYSA-N	CC(Oc1cccc(Cl)c1)c2ccnc3nc(N=CN(C)C)nn23	BroadT	BRD-A13250557	BRD-A13250557-001-06-7	Key Organics Ltd.	2L-003			CC(Oc1cccc(Cl)c1)c1ccnc2nc(N=CN(C)C)nn12	InChI=1S/C16H17ClN6O/c1-11(24-13-6-4-5-12(17)9-13)14-7-8-18-16-20-15(21-23(14)16)19-10-22(2)3/h4-11H,1-3H3	QCIDABMIGABSSL-UHFFFAOYSA-N	344.115236934							114369
SMR000025229	LSM-25830	SID4242407, SID87344483, BRD-K09701277	3237267	InChI=1S/C25H21N5O5/c31-22(26-15-18-6-5-13-35-18)10-12-29-24(33)19-7-1-2-8-20(19)30(25(29)34)16-17-14-23(32)28-11-4-3-9-21(28)27-17/h1-9,11,13-14H,10,12,15-16H2,(H,26,31)	ZDJYRFMZJIEMPW-UHFFFAOYSA-N	O=C(CCN1C(=O)N(CC2=CC(=O)N3C=CC=CC3=N2)c4ccccc4C1=O)NCc5occc5	BroadT	BRD-K09701277	BRD-K09701277-001-05-4	ChemDiv Inc.	C260-1054			O=C(CCn1c(=O)n(Cc2cc(=O)n3ccccc3n2)c2ccccc2c1=O)NCc1ccco1	InChI=1S/C25H21N5O5/c31-22(26-15-18-6-5-13-35-18)10-12-29-24(33)19-7-1-2-8-20(19)30(25(29)34)16-17-14-23(32)28-11-4-3-9-21(28)27-17/h1-9,11,13-14H,10,12,15-16H2,(H,26,31)	ZDJYRFMZJIEMPW-UHFFFAOYSA-N	471.154268822							114370
4-(5-Methoxy-1,2-dimethyl-1H-indol-3-yl)thiazol-2-ylamine	LSM-25831	SID49644923, BRD-K84005816	804956	InChI=1S/C14H15N3OS/c1-8-13(11-7-19-14(15)16-11)10-6-9(18-3)4-5-12(10)17(8)2/h4-7H,1-3H3,(H2,15,16)	VPDSGUDJGGDJMS-UHFFFAOYSA-N	COc1ccc2c(c1)c(c(C)n2C)c3csc(N)n3	BroadT	BRD-K84005816	BRD-K84005816-001-06-4	Asinex Ltd.	BAS 00519386			COc1ccc2n(C)c(C)c(-c3csc(N)n3)c2c1	InChI=1S/C14H15N3OS/c1-8-13(11-7-19-14(15)16-11)10-6-9(18-3)4-5-12(10)17(8)2/h4-7H,1-3H3,(H2,15,16)	VPDSGUDJGGDJMS-UHFFFAOYSA-N	273.09358282							114371
AC1O9NJY	LSM-25832	SID22412394, BRD-K05880304	6762880	InChI=1S/C15H13FN6/c16-11-8-4-5-9-12(11)19-20-13-14(17)21-22(15(13)18)10-6-2-1-3-7-10/h1-9H,18H2,(H2,17,21)	WERYBLQJNJVGPJ-UHFFFAOYSA-N	Nc1nn(c(N)c1N=Nc2ccccc2F)c3ccccc3	BroadT	BRD-K05880304	BRD-K05880304-001-05-7	Specs	AO-476/14739225			Nc1nn(c(N)c1N=Nc1ccccc1F)-c1ccccc1	InChI=1S/C15H13FN6/c16-11-8-4-5-9-12(11)19-20-13-14(17)21-22(15(13)18)10-6-2-1-3-7-10/h1-9H,18H2,(H2,17,21)	WERYBLQJNJVGPJ-UHFFFAOYSA-N	296.118572676							
MLS000116289	LSM-25833	SID7967077, BRD-K55762076	5308609	InChI=1S/C18H16N2O3/c1-2-12-6-3-4-9-15(12)19-18(22)16-11-17(23-20-16)13-7-5-8-14(21)10-13/h3-11,21H,2H2,1H3,(H,19,22)	VGQGTNVENAUVGJ-UHFFFAOYSA-N	CCc1ccccc1NC(=O)c2cc(on2)c3cccc(O)c3	BroadT	BRD-K55762076	BRD-K55762076-001-04-5	ChemDiv Inc.	C226-1537			CCc1ccccc1NC(=O)c1cc(on1)-c1cccc(O)c1	InChI=1S/C18H16N2O3/c1-2-12-6-3-4-9-15(12)19-18(22)16-11-17(23-20-16)13-7-5-8-14(21)10-13/h3-11,21H,2H2,1H3,(H,19,22)	VGQGTNVENAUVGJ-UHFFFAOYSA-N	308.116092392							114373
BDBM57195	LSM-25834	BRD-A63865611	40547860	InChI=1S/C24H19N3O2/c28-21-14-15-27-20-9-5-4-8-19(20)26-23(27)22(21)24(29)25-18-12-10-17(11-13-18)16-6-2-1-3-7-16/h1-13,22H,14-15H2,(H,25,29)	XRWGYQMLQJIEFL-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)c2ccccc2)C3C(=O)CCn4c3nc5ccccc45	BroadT	BRD-A63865611	BRD-A63865611-001-06-5	InterBioScreen Ltd.	STOCK4S-74711			O=C(Nc1ccc(cc1)-c1ccccc1)C1c2nc3ccccc3n2CCC1=O	InChI=1S/C24H19N3O2/c28-21-14-15-27-20-9-5-4-8-19(20)26-23(27)22(21)24(29)25-18-12-10-17(11-13-18)16-6-2-1-3-7-16/h1-13,22H,14-15H2,(H,25,29)	XRWGYQMLQJIEFL-UHFFFAOYSA-N	381.147726878							114374
SMR000064808	LSM-25835	SID3715612, BRD-A83799988	2999285	InChI=1S/C19H20N2O8S/c1-26-18(24)14-12(15(19(25)27-2)30-16(14)20)9-29-17(23)10-6-13(22)21(7-10)8-11-4-3-5-28-11/h3-5,10H,6-9,20H2,1-2H3	DMANTVHHICZKIV-UHFFFAOYSA-N	COC(=O)c1sc(N)c(C(=O)OC)c1COC(=O)C2CN(Cc3occc3)C(=O)C2	BroadT	BRD-A83799988	BRD-A83799988-001-05-9	Enamine Ltd.	T5347066			COC(=O)c1sc(N)c(C(=O)OC)c1COC(=O)C1CN(Cc2ccco2)C(=O)C1	InChI=1S/C19H20N2O8S/c1-26-18(24)14-12(15(19(25)27-2)30-16(14)20)9-29-17(23)10-6-13(22)21(7-10)8-11-4-3-5-28-11/h3-5,10H,6-9,20H2,1-2H3	DMANTVHHICZKIV-UHFFFAOYSA-N	436.09403631							114375
F1142-6995	LSM-25836	SID14731705, BRD-K33825574	2056177	InChI=1S/C18H13N3O2S/c1-2-4-14-13(3-1)6-8-17-19-20-18(21(14)17)24-10-12-5-7-15-16(9-12)23-11-22-15/h1-9H,10-11H2	QZQACWNROHCLSE-UHFFFAOYSA-N	C(Sc1nnc2ccc3ccccc3n12)c4ccc5OCOc5c4	BroadT	BRD-K33825574	BRD-K33825574-001-05-1	ChemDiv Inc.	6481-7305			C(Sc1nnc2ccc3ccccc3n12)c1ccc2OCOc2c1	InChI=1S/C18H13N3O2S/c1-2-4-14-13(3-1)6-8-17-19-20-18(21(14)17)24-10-12-5-7-15-16(9-12)23-11-22-15/h1-9H,10-11H2	QZQACWNROHCLSE-UHFFFAOYSA-N	335.072847376							114376
ST50618567	LSM-44142	SID17433363, BRD-A17756301	5737792	InChI=1S/C22H25NO/c1-17-13-18(2)16-23(15-17)22(24)21(20-11-7-4-8-12-20)14-19-9-5-3-6-10-19/h3-12,14,17-18H,13,15-16H2,1-2H3/b21-14-	JOJVYEUWFFQKCZ-STZFKDTASA-N	CC1CC(C)CN(C1)C(=O)\C(=C/c2ccccc2)\c3ccccc3	BroadT	BRD-A17756301	BRD-A17756301-001-05-0	ChemBridge Corporation	7405784			CC1CC(C)CN(C1)C(=O)C(=C/c1ccccc1)\c1ccccc1	InChI=1S/C22H25NO/c1-17-13-18(2)16-23(15-17)22(24)21(20-11-7-4-8-12-20)14-19-9-5-3-6-10-19/h3-12,14,17-18H,13,15-16H2,1-2H3/b21-14-	JOJVYEUWFFQKCZ-STZFKDTASA-N	319.19361443							
7-Ethyl 2-methyl 6-(4-methoxyphenyl)-8-methyl-4-oxo-4H,6H-pyrimido[2,1-b][1,3]thiazine-2,7-dicarboxylate	LSM-25838	SID24785604, BRD-A00037023	4918332	InChI=1S/C20H20N2O6S/c1-5-28-19(25)16-11(2)21-20-22(15(23)10-14(29-20)18(24)27-4)17(16)12-6-8-13(26-3)9-7-12/h6-10,17H,5H2,1-4H3	MBBXYEPIGVZHCE-UHFFFAOYSA-N	CCOC(=O)C1=C(C)N=C2SC(=CC(=O)N2C1c3ccc(OC)cc3)C(=O)OC	BroadT	BRD-A00037023	BRD-A00037023-001-05-1	ChemDiv Inc.	8016-0939			CCOC(=O)C1=C(C)N=C2SC(=CC(=O)N2C1c1ccc(OC)cc1)C(=O)OC	InChI=1S/C20H20N2O6S/c1-5-28-19(25)16-11(2)21-20-22(15(23)10-14(29-20)18(24)27-4)17(16)12-6-8-13(26-3)9-7-12/h6-10,17H,5H2,1-4H3	MBBXYEPIGVZHCE-UHFFFAOYSA-N	416.10420707							114378
ZINC00716094	LSM-25839	SID17505036, BRD-K06081918	1042999	InChI=1S/C21H16N2O3S/c24-21(15-9-3-1-4-10-15)20-19(22-16-11-5-2-6-12-16)17-13-7-8-14-18(17)27(25,26)23-20/h1-14,22-23H	SKIUFFVGBXNDNP-UHFFFAOYSA-N	O=C(C1=C(Nc2ccccc2)c3ccccc3S(=O)(=O)N1)c4ccccc4	BroadT	BRD-K06081918	BRD-K06081918-001-05-9	Asinex Ltd.	BAS 02785835			O=C(c1ccccc1)C1=C(Nc2ccccc2)c2ccccc2S(=O)(=O)N1	InChI=1S/C21H16N2O3S/c24-21(15-9-3-1-4-10-15)20-19(22-16-11-5-2-6-12-16)17-13-7-8-14-18(17)27(25,26)23-20/h1-14,22-23H	SKIUFFVGBXNDNP-UHFFFAOYSA-N	376.088163082							114379
MLS000068838	LSM-25840	SID858356, BRD-K71626576	659684	InChI=1S/C14H16N2OS2/c17-13-8-2-1-5-9-16(13)10-18-14-15-11-6-3-4-7-12(11)19-14/h3-4,6-7H,1-2,5,8-10H2	KRMYPFNABQFRFT-UHFFFAOYSA-N	O=C1CCCCCN1CSc2nc3ccccc3s2	BroadT	BRD-K71626576	BRD-K71626576-001-05-4	InterBioScreen Ltd.	STOCK2S-34819			O=C1CCCCCN1CSc1nc2ccccc2s1	InChI=1S/C14H16N2OS2/c17-13-8-2-1-5-9-16(13)10-18-14-15-11-6-3-4-7-12(11)19-14/h3-4,6-7H,1-2,5,8-10H2	KRMYPFNABQFRFT-UHFFFAOYSA-N	292.070404532							114380
SMR000221009	LSM-44143	SID17505669, BRD-K36511139	5568741	InChI=1S/C17H10FN3OS2/c18-10-5-7-11(8-6-10)21-16(22)14(24-17(21)23)9-15-19-12-3-1-2-4-13(12)20-15/h1-9H,(H,19,20)/b14-9-	RHCANUFDCKJCRQ-ZROIWOOFSA-N	Fc1ccc(cc1)N2C(=S)S\C(=C/c3nc4ccccc4[nH]3)\C2=O	BroadT	BRD-K36511139	BRD-K36511139-001-05-2	InterBioScreen Ltd.	STOCK5S-30495			Fc1ccc(cc1)N1C(=S)S\C(=C/c2nc3ccccc3[nH]2)C1=O	InChI=1S/C17H10FN3OS2/c18-10-5-7-11(8-6-10)21-16(22)14(24-17(21)23)9-15-19-12-3-1-2-4-13(12)20-15/h1-9H,(H,19,20)/b14-9-	RHCANUFDCKJCRQ-ZROIWOOFSA-N	355.02493155							
AC1N6HQH	LSM-25842	BRD-A17482646	4215636	InChI=1S/C18H25N3OS/c1-17(2)12-8-9-18(17,3)15(10-12)20-21-16(23)19-13-6-5-7-14(11-13)22-4/h5-7,11-12H,8-10H2,1-4H3,(H2,19,21,23)	UHLHPOAKYMBUPI-UHFFFAOYSA-N	COc1cccc(NC(=NN=C2CC3CCC2(C)C3(C)C)S)c1	BroadT	BRD-A17482646	BRD-A17482646-001-05-7	Enamine Ltd.	T0515-2178			COc1cccc(NC(S)=NN=C2CC3CCC2(C)C3(C)C)c1	InChI=1S/C18H25N3OS/c1-17(2)12-8-9-18(17,3)15(10-12)20-21-16(23)19-13-6-5-7-14(11-13)22-4/h5-7,11-12H,8-10H2,1-4H3,(H2,19,21,23)	UHLHPOAKYMBUPI-UHFFFAOYSA-N	331.17183314							114382
T0510-8508	LSM-25843	SID26657591, BRD-A13640438	4582778	InChI=1S/C19H16Cl2N4O3S/c1-28-12-8-3-2-6-10(12)25-19-13(17(23)26)15(22)16(29-19)18(27)24-11-7-4-5-9(20)14(11)21/h2-8,16,22,25H,1H3,(H2,23,26)(H,24,27)	KTGQXHGUDQLWQK-UHFFFAOYSA-N	COc1ccccc1NC2=C(C(=O)N)C(=N)C(S2)C(=O)Nc3cccc(Cl)c3Cl	BroadT	BRD-A13640438	BRD-A13640438-001-06-4	Enamine Ltd.	T0510-8508			COc1ccccc1NC1=C(C(N)=O)C(=N)C(S1)C(=O)Nc1cccc(Cl)c1Cl	InChI=1S/C19H16Cl2N4O3S/c1-28-12-8-3-2-6-10(12)25-19-13(17(23)26)15(22)16(29-19)18(27)24-11-7-4-5-9(20)14(11)21/h2-8,16,22,25H,1H3,(H2,23,26)(H,24,27)	KTGQXHGUDQLWQK-UHFFFAOYSA-N	450.032016522							
2-Butyl-3-(3-chloro-benzyl)-5-methyl-3H-imidazo[4,5-b]pyridin-6-ylamine	LSM-25844	SID17431668, BRD-K42046390	3205861	InChI=1S/C18H21ClN4/c1-3-4-8-17-22-16-10-15(20)12(2)21-18(16)23(17)11-13-6-5-7-14(19)9-13/h5-7,9-10H,3-4,8,11,20H2,1-2H3	IGSBEMDBQWKBHQ-UHFFFAOYSA-N	CCCCc1nc2cc(N)c(C)nc2n1Cc3cccc(Cl)c3	BroadT	BRD-K42046390	BRD-K42046390-001-05-5	Asinex Ltd.	ASN 05438651			CCCCc1nc2cc(N)c(C)nc2n1Cc1cccc(Cl)c1	InChI=1S/C18H21ClN4/c1-3-4-8-17-22-16-10-15(20)12(2)21-18(16)23(17)11-13-6-5-7-14(19)9-13/h5-7,9-10H,3-4,8,11,20H2,1-2H3	IGSBEMDBQWKBHQ-UHFFFAOYSA-N	328.145474422							114384
AH-487/15582373	LSM-25845	SID22404474, BRD-K90940383	883022	InChI=1S/C20H23NOS/c22-20(21-14-6-1-2-7-15-21)18-12-10-17(11-13-18)16-23-19-8-4-3-5-9-19/h3-5,8-13H,1-2,6-7,14-16H2	NNLHCQFFYNKDGS-UHFFFAOYSA-N	O=C(N1CCCCCC1)c2ccc(CSc3ccccc3)cc2	BroadT	BRD-K90940383	BRD-K90940383-001-05-9	ChemBridge Corporation	6466406			O=C(N1CCCCCC1)c1ccc(CSc2ccccc2)cc1	InChI=1S/C20H23NOS/c22-20(21-14-6-1-2-7-15-21)18-12-10-17(11-13-18)16-23-19-8-4-3-5-9-19/h3-5,8-13H,1-2,6-7,14-16H2	NNLHCQFFYNKDGS-UHFFFAOYSA-N	325.150035056							114385
MLS000561599	LSM-25846	SID17407382, BRD-K91814273	11958605	InChI=1S/C19H22N4O2S2/c1-4-5-10-16(24)23-19-20-12(2)17(27-19)14-11-26-18(22-14)21-13-8-6-7-9-15(13)25-3/h6-9,11H,4-5,10H2,1-3H3,(H,21,22)(H,20,23,24)	QMGOKDBVXKRKLG-UHFFFAOYSA-N	CCCCC(=O)Nc1nc(C)c(s1)c2csc(Nc3ccccc3OC)n2	BroadT	BRD-K91814273	BRD-K91814273-001-05-8	University of California at Davis	CLY_Corr_H02			CCCCC(=O)Nc1nc(C)c(s1)-c1csc(Nc2ccccc2OC)n1	InChI=1S/C19H22N4O2S2/c1-4-5-10-16(24)23-19-20-12(2)17(27-19)14-11-26-18(22-14)21-13-8-6-7-9-15(13)25-3/h6-9,11H,4-5,10H2,1-3H3,(H,21,22)(H,20,23,24)	QMGOKDBVXKRKLG-UHFFFAOYSA-N	402.118417364							114386
HMS2453I06	LSM-25847	BRD-K18493561	11948855	InChI=1S/C18H17ClN2O3/c1-12-5-4-6-13-15(9-10-23-18(12)13)20-21-17(22)11-24-16-8-3-2-7-14(16)19/h2-8H,9-11H2,1H3,(H,21,22)	CXJXCEMGMLZVRW-UHFFFAOYSA-N	Cc1cccc2C(=NNC(=O)COc3ccccc3Cl)CCOc12	BroadT	BRD-K18493561	BRD-K18493561-001-05-2	Specs	AL-182/15347006			Cc1cccc2C(CCOc12)=NNC(=O)COc1ccccc1Cl	InChI=1S/C18H17ClN2O3/c1-12-5-4-6-13-15(9-10-23-18(12)13)20-21-17(22)11-24-16-8-3-2-7-14(16)19/h2-8H,9-11H2,1H3,(H,21,22)	CXJXCEMGMLZVRW-UHFFFAOYSA-N	344.092770134							114387
MLS000732248	LSM-25848	SID24798923, BRD-K75309766	16190594	InChI=1S/C24H29ClN2O2/c1-18-20-8-5-9-21(25)23(20)26-22(18)16-27-13-10-24(17-28,11-14-27)12-15-29-19-6-3-2-4-7-19/h2-9,26,28H,10-17H2,1H3	BOBHPMQFFUSAAV-UHFFFAOYSA-N	Cc1c(CN2CCC(CO)(CCOc3ccccc3)CC2)[nH]c4c(Cl)cccc14	BroadT	BRD-K75309766	BRD-K75309766-001-06-1	ChemBridge Corporation	39194601			Cc1c(CN2CCC(CO)(CCOc3ccccc3)CC2)[nH]c2c(Cl)cccc12	InChI=1S/C24H29ClN2O2/c1-18-20-8-5-9-21(25)23(20)26-22(18)16-27-13-10-24(17-28,11-14-27)12-15-29-19-6-3-2-4-7-19/h2-9,26,28H,10-17H2,1H3	BOBHPMQFFUSAAV-UHFFFAOYSA-N	412.191755898							114388
MLS000850394	LSM-25849	SID26731279, BRD-K00605115	2814221	InChI=1S/C17H19FN2O2S/c18-14-8-10-15(11-9-14)23(21,22)19-16-6-2-3-7-17(16)20-12-4-1-5-13-20/h2-3,6-11,19H,1,4-5,12-13H2	NHMFOMAFQOAROG-UHFFFAOYSA-N	Fc1ccc(cc1)S(=O)(=O)Nc2ccccc2N3CCCCC3	BroadT	BRD-K00605115	BRD-K00605115-001-05-2	Maybridge	HTS 08432			Fc1ccc(cc1)S(=O)(=O)Nc1ccccc1N1CCCCC1	InChI=1S/C17H19FN2O2S/c18-14-8-10-15(11-9-14)23(21,22)19-16-6-2-3-7-17(16)20-12-4-1-5-13-20/h2-3,6-11,19H,1,4-5,12-13H2	NHMFOMAFQOAROG-UHFFFAOYSA-N	334.115126758							114389
MLS000568920	LSM-25850	SID17385669, BRD-K67659633	2564703	InChI=1S/C14H11ClN4OS/c15-9-3-1-2-4-10(9)19-14(21)16-8-5-6-11-12(7-8)18-13(20)17-11/h1-7H,(H2,16,19,21)(H2,17,18,20)	ZFWDGFZLOZTDMO-UHFFFAOYSA-N	Oc1nc2cc(NC(=Nc3ccccc3Cl)S)ccc2[nH]1	BroadT	BRD-K67659633	BRD-K67659633-001-06-0	Enamine Ltd.	T5316498			Oc1nc2cc(NC(S)=Nc3ccccc3Cl)ccc2[nH]1	InChI=1S/C14H11ClN4OS/c15-9-3-1-2-4-10(9)19-14(21)16-8-5-6-11-12(7-8)18-13(20)17-11/h1-7H,(H2,16,19,21)(H2,17,18,20)	ZFWDGFZLOZTDMO-UHFFFAOYSA-N	318.034209412							114390
SMR000206847	LSM-25851	SID17509602, BRD-K85540497	4293949	InChI=1S/C20H21ClN2O5S/c1-22(16-7-3-2-4-8-16)20(24)14-10-11-19(18(12-14)23(25)26)29(27,28)17-9-5-6-15(21)13-17/h5-6,9-13,16H,2-4,7-8H2,1H3	YQBQRLSOGADWQO-UHFFFAOYSA-N	CN(C1CCCCC1)C(=O)c2ccc(c(c2)[N+](=O)[O-])S(=O)(=O)c3cccc(Cl)c3	BroadT	BRD-K85540497	BRD-K85540497-001-06-5	ChemDiv Inc.	K781-2529			CN(C1CCCCC1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C20H21ClN2O5S/c1-22(16-7-3-2-4-8-16)20(24)14-10-11-19(18(12-14)23(25)26)29(27,28)17-9-5-6-15(21)13-17/h5-6,9-13,16H,2-4,7-8H2,1H3	YQBQRLSOGADWQO-UHFFFAOYSA-N	436.085970192							114391
MLS000552970	LSM-25852	SID17431649, BRD-K15857477	791428	InChI=1S/C16H16N2O4/c19-16(17-10-2-1-3-11-17)15-9-8-14(22-15)12-4-6-13(7-5-12)18(20)21/h4-9H,1-3,10-11H2	PSBGZWFDRJNMOX-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)c2oc(cc2)C(=O)N3CCCCC3	BroadT	BRD-K15857477	BRD-K15857477-001-05-4	Asinex Ltd.	BAS 00717700			[O-][N+](=O)c1ccc(cc1)-c1ccc(o1)C(=O)N1CCCCC1	InChI=1S/C16H16N2O4/c19-16(17-10-2-1-3-11-17)15-9-8-14(22-15)12-4-6-13(7-5-12)18(20)21/h4-9H,1-3,10-11H2	PSBGZWFDRJNMOX-UHFFFAOYSA-N	300.111007012							114392
MLS000087878	LSM-25853	BRD-A74968392	3238028	InChI=1S/C21H27N3O6S2/c1-6-29-20(26)18-15(4)23(5)21(31-18)22-19(25)16-7-9-17(10-8-16)32(27,28)24-11-13(2)30-14(3)12-24/h7-10,13-14H,6,11-12H2,1-5H3	AQQCXDMXFHJVGK-UHFFFAOYSA-N	CCOC(=O)C1=C(C)N(C)C(=NC(=O)c2ccc(cc2)S(=O)(=O)N3CC(C)OC(C)C3)S1	BroadT	BRD-A74968392	BRD-A74968392-001-05-1	ChemDiv Inc.	3339-1825			CCOC(=O)c1sc(=NC(=O)c2ccc(cc2)S(=O)(=O)N2CC(C)OC(C)C2)n(C)c1C	InChI=1S/C21H27N3O6S2/c1-6-29-20(26)18-15(4)23(5)21(31-18)22-19(25)16-7-9-17(10-8-16)32(27,28)24-11-13(2)30-14(3)12-24/h7-10,13-14H,6,11-12H2,1-5H3	AQQCXDMXFHJVGK-UHFFFAOYSA-N	481.134126994							114393
SMR000149742	LSM-25854	SID14743269, BRD-K00354297	741790	InChI=1S/C15H12N6S/c1-2-5-13(6-3-1)21-11-17-19-15(21)22-10-12-9-20-8-4-7-16-14(20)18-12/h1-9,11H,10H2	LVENVUHBIDYWKR-UHFFFAOYSA-N	C(Sc1nncn1c2ccccc2)c3cn4cccnc4n3	BroadT	BRD-K00354297	BRD-K00354297-001-08-1	InterBioScreen Ltd.	STOCK1S-69474			C(Sc1nncn1-c1ccccc1)c1cn2cccnc2n1	InChI=1S/C15H12N6S/c1-2-5-13(6-3-1)21-11-17-19-15(21)22-10-12-9-20-8-4-7-16-14(20)18-12/h1-9,11H,10H2	LVENVUHBIDYWKR-UHFFFAOYSA-N	308.084415134							114394
Benzyl 9-oxo-9H-fluorene-3-carboxylate	LSM-25855	SID17412677, BRD-K83728430	801955	InChI=1S/C21H14O3/c22-20-17-9-5-4-8-16(17)19-12-15(10-11-18(19)20)21(23)24-13-14-6-2-1-3-7-14/h1-12H,13H2	NCIFBRHXIDGDDR-UHFFFAOYSA-N	O=C(OCc1ccccc1)c2ccc3C(=O)c4ccccc4c3c2	BroadT	BRD-K83728430	BRD-K83728430-001-06-8	ChemBridge Corporation	6967085			O=C(OCc1ccccc1)c1ccc2C(=O)c3ccccc3-c2c1	InChI=1S/C21H14O3/c22-20-17-9-5-4-8-16(17)19-12-15(10-11-18(19)20)21(23)24-13-14-6-2-1-3-7-14/h1-12H,13H2	NCIFBRHXIDGDDR-UHFFFAOYSA-N	314.094294308							114395
AN-988/15131156	LSM-25856	BRD-K41923942	1027088	InChI=1S/C15H15BrN2O3/c16-14-9-13(10-17-11-1-3-12(19)4-2-11)21-15(14)18-5-7-20-8-6-18/h1-4,9-10,19H,5-8H2	UTIOCIIPXALBEQ-UHFFFAOYSA-N	Oc1ccc(cc1)N=Cc2oc(N3CCOCC3)c(Br)c2	BroadT	BRD-K41923942	BRD-K41923942-001-05-9	Specs	AN-988/15131156			Oc1ccc(cc1)N=Cc1cc(Br)c(o1)N1CCOCC1	InChI=1S/C15H15BrN2O3/c16-14-9-13(10-17-11-1-3-12(19)4-2-11)21-15(14)18-5-7-20-8-6-18/h1-4,9-10,19H,5-8H2	UTIOCIIPXALBEQ-UHFFFAOYSA-N	350.02660496							114396
T5286915	LSM-25857	SID16953627, BRD-K81153510	2493526	InChI=1S/C19H23N3O5S/c1-2-3-12-21-17-7-5-4-6-16(17)19(24)27-13-18(23)22-14-8-10-15(11-9-14)28(20,25)26/h4-11,21H,2-3,12-13H2,1H3,(H,22,23)(H2,20,25,26)	WAXJJLGDUQLEAV-UHFFFAOYSA-N	CCCCNc1ccccc1C(=O)OCC(=O)Nc2ccc(cc2)S(=O)(=O)N	BroadT	BRD-K81153510	BRD-K81153510-001-05-6	Enamine Ltd.	T5286915			CCCCNc1ccccc1C(=O)OCC(=O)Nc1ccc(cc1)S(N)(=O)=O	InChI=1S/C19H23N3O5S/c1-2-3-12-21-17-7-5-4-6-16(17)19(24)27-13-18(23)22-14-8-10-15(11-9-14)28(20,25)26/h4-11,21H,2-3,12-13H2,1H3,(H,22,23)(H2,20,25,26)	WAXJJLGDUQLEAV-UHFFFAOYSA-N	405.135841556							114397
ST50036807	LSM-25858	SID17513992, BRD-A11287070	3583297	InChI=1S/C17H21N3O4/c1-15(2)16(3)8-9-17(15,10-13(16)21)14(22)19-18-11-4-6-12(7-5-11)20(23)24/h4-7,18H,8-10H2,1-3H3,(H,19,22)	QIMGWNHCXOHOAH-UHFFFAOYSA-N	CC1(C)C2(C)CCC1(CC2=O)C(=O)NNc3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-A11287070	BRD-A11287070-001-06-9	InterBioScreen Ltd.	STOCK3S-35870			CC12CCC(CC1=O)(C(=O)NNc1ccc(cc1)[N+]([O-])=O)C2(C)C	InChI=1S/C17H21N3O4/c1-15(2)16(3)8-9-17(15,10-13(16)21)14(22)19-18-11-4-6-12(7-5-11)20(23)24/h4-7,18H,8-10H2,1-3H3,(H,19,22)	QIMGWNHCXOHOAH-UHFFFAOYSA-N	331.153206182							114398
ZINC00299099	LSM-25859	SID17507560, BRD-K30018352	795446	InChI=1S/C15H11FO4/c1-19-14(17)10-6-8-11(9-7-10)20-15(18)12-4-2-3-5-13(12)16/h2-9H,1H3	BNRUUYWMOMILPF-UHFFFAOYSA-N	COC(=O)c1ccc(OC(=O)c2ccccc2F)cc1	BroadT	BRD-K30018352	BRD-K30018352-001-03-9	Asinex Ltd.	BAS 00418238			COC(=O)c1ccc(OC(=O)c2ccccc2F)cc1	InChI=1S/C15H11FO4/c1-19-14(17)10-6-8-11(9-7-10)20-15(18)12-4-2-3-5-13(12)16/h2-9H,1H3	BNRUUYWMOMILPF-UHFFFAOYSA-N	274.064137032							114399
MLS000768237	LSM-25860	SID26671668, BRD-K18917286	919235	InChI=1S/C14H11N3O2/c18-13(10-6-2-1-3-7-10)16-17-14-15-11-8-4-5-9-12(11)19-14/h1-9H,(H,15,17)(H,16,18)	XSCYPIMTGGCJGO-UHFFFAOYSA-N	O=C(NNc1oc2ccccc2n1)c3ccccc3	BroadT	BRD-K18917286	BRD-K18917286-001-04-7	InterBioScreen Ltd.	STOCK2S-04291			O=C(NNc1nc2ccccc2o1)c1ccccc1	InChI=1S/C14H11N3O2/c18-13(10-6-2-1-3-7-10)16-17-14-15-11-8-4-5-9-12(11)19-14/h1-9H,(H,15,17)(H,16,18)	XSCYPIMTGGCJGO-UHFFFAOYSA-N	253.085126622							114400
MLS000078784	LSM-25861	SID860065, BRD-K81545621	661369	InChI=1S/C17H12BrNO4/c1-22-17(21)15-14(12-9-11(18)7-8-13(12)23-15)19-16(20)10-5-3-2-4-6-10/h2-9H,1H3,(H,19,20)	HLAVQVUESAMUEE-UHFFFAOYSA-N	COC(=O)c1oc2ccc(Br)cc2c1NC(=O)c3ccccc3	BroadT	BRD-K81545621	BRD-K81545621-001-06-7	InterBioScreen Ltd.	STOCK3S-45251			COC(=O)c1oc2ccc(Br)cc2c1NC(=O)c1ccccc1	InChI=1S/C17H12BrNO4/c1-22-17(21)15-14(12-9-11(18)7-8-13(12)23-15)19-16(20)10-5-3-2-4-6-10/h2-9H,1H3,(H,19,20)	HLAVQVUESAMUEE-UHFFFAOYSA-N	372.994970474							114401
BAS 06901401	LSM-25862	SID848508, BRD-A53769312	650957	InChI=1S/C22H21N5O/c1-15(28)27-10-9-17-18(11-23)21(26)22(13-24,14-25)20(19(17)12-27)8-7-16-5-3-2-4-6-16/h2-6,9,19-20H,7-8,10,12,26H2,1H3	AUYWZVBGWIZYPZ-UHFFFAOYSA-N	CC(=O)N1CC=C2C(C1)C(CCc3ccccc3)C(C#N)(C#N)C(=C2C#N)N	BroadT	BRD-A53769312	BRD-A53769312-001-05-5	Asinex Ltd.	BAS 06901401			CC(=O)N1CC=C2C(C1)C(CCc1ccccc1)C(C#N)(C#N)C(N)=C2C#N	InChI=1S/C22H21N5O/c1-15(28)27-10-9-17-18(11-23)21(26)22(13-24,14-25)20(19(17)12-27)8-7-16-5-3-2-4-6-16/h2-6,9,19-20H,7-8,10,12,26H2,1H3	AUYWZVBGWIZYPZ-UHFFFAOYSA-N	371.174610342							114402
SMR000243332	LSM-25863	SID22410986, BRD-K30896793	4995974	InChI=1S/C16H18BrClN2O5S2/c1-4-25-14-8-5-11(17)9-16(14)26(21,22)19-12-6-7-13(18)15(10-12)27(23,24)20(2)3/h5-10,19H,4H2,1-3H3	HXCIFDQWZQOMLL-UHFFFAOYSA-N	CCOc1ccc(Br)cc1S(=O)(=O)Nc2ccc(Cl)c(c2)S(=O)(=O)N(C)C	BroadT	BRD-K30896793	BRD-K30896793-001-05-0	Enamine Ltd.	T5240938			CCOc1ccc(Br)cc1S(=O)(=O)Nc1ccc(Cl)c(c1)S(=O)(=O)N(C)C	InChI=1S/C16H18BrClN2O5S2/c1-4-25-14-8-5-11(17)9-16(14)26(21,22)19-12-6-7-13(18)15(10-12)27(23,24)20(2)3/h5-10,19H,4H2,1-3H3	HXCIFDQWZQOMLL-UHFFFAOYSA-N	495.952903386							114403
T0504-0895	LSM-25864	SID22411214, BRD-K71865996	2322183	InChI=1S/C17H14ClN3O3S2/c18-12-5-3-6-13(11-12)19-17(22)20-14-7-1-2-8-15(14)21-26(23,24)16-9-4-10-25-16/h1-11,21H,(H2,19,20,22)	ASLMSVLPUIFLIY-UHFFFAOYSA-N	Clc1cccc(NC(=O)Nc2ccccc2NS(=O)(=O)c3cccs3)c1	BroadT	BRD-K71865996	BRD-K71865996-001-05-0	Enamine Ltd.	T0504-0895			Clc1cccc(NC(=O)Nc2ccccc2NS(=O)(=O)c2cccs2)c1	InChI=1S/C17H14ClN3O3S2/c18-12-5-3-6-13(11-12)19-17(22)20-14-7-1-2-8-15(14)21-26(23,24)16-9-4-10-25-16/h1-11,21H,(H2,19,20,22)	ASLMSVLPUIFLIY-UHFFFAOYSA-N	407.016510428							114404
MLS000331928	LSM-25865	SID22403047, BRD-K87099627	1839039	InChI=1S/C15H9ClFN3O2S/c16-10-6-9(2-3-11(10)17)20-14(18-19-15(20)23)8-1-4-12-13(5-8)22-7-21-12/h1-6H,7H2,(H,19,23)	IGZOLLJZGUWMHI-UHFFFAOYSA-N	Fc1ccc(cc1Cl)n2c(S)nnc2c3ccc4OCOc4c3	BroadT	BRD-K87099627	BRD-K87099627-001-06-3	InterBioScreen Ltd.	STOCK5S-34400			Fc1ccc(cc1Cl)-n1c(S)nnc1-c1ccc2OCOc2c1	InChI=1S/C15H9ClFN3O2S/c16-10-6-9(2-3-11(10)17)20-14(18-19-15(20)23)8-1-4-12-13(5-8)22-7-21-12/h1-6H,7H2,(H,19,23)	IGZOLLJZGUWMHI-UHFFFAOYSA-N	349.008803158							114405
SMR000065211	LSM-25866	SID3712453, BRD-K10217029	2673184	InChI=1S/C19H17N3O4/c1-12-7-8-13(19(25)26-2)9-16(12)21-17(23)10-22-11-20-15-6-4-3-5-14(15)18(22)24/h3-9,11H,10H2,1-2H3,(H,21,23)	DQHBGBDEYQPZPP-UHFFFAOYSA-N	COC(=O)c1ccc(C)c(NC(=O)CN2C=Nc3ccccc3C2=O)c1	BroadT	BRD-K10217029	BRD-K10217029-001-06-7	Enamine Ltd.	ZT-7476879			COC(=O)c1ccc(C)c(NC(=O)Cn2cnc3ccccc3c2=O)c1	InChI=1S/C19H17N3O4/c1-12-7-8-13(19(25)26-2)9-16(12)21-17(23)10-22-11-20-15-6-4-3-5-14(15)18(22)24/h3-9,11H,10H2,1-2H3,(H,21,23)	DQHBGBDEYQPZPP-UHFFFAOYSA-N	351.121906054							114406
(3-Isopropoxyphenyl)(1-((5-methyl-1-propyl-1H-pyrazol-4-yl)methyl)piperidin-3-yl)methanone	LSM-1323	BRD-A12083771, SID24799196, SID87219036	16190867	InChI=1S/C23H33N3O2/c1-5-11-26-18(4)21(14-24-26)16-25-12-7-9-20(15-25)23(27)19-8-6-10-22(13-19)28-17(2)3/h6,8,10,13-14,17,20H,5,7,9,11-12,15-16H2,1-4H3	TXMPMEQLXDHGQS-UHFFFAOYSA-N	CCCn1ncc(CN2CCCC(C2)C(=O)c3cccc(OC(C)C)c3)c1C	BroadT	BRD-A12083771	BRD-A12083771-001-09-7	ChemBridge Corporation	93789579			CCCn1ncc(CN2CCCC(C2)C(=O)c2cccc(OC(C)C)c2)c1C	InChI=1S/C23H33N3O2/c1-5-11-26-18(4)21(14-24-26)16-25-12-7-9-20(15-25)23(27)19-8-6-10-22(13-19)28-17(2)3/h6,8,10,13-14,17,20H,5,7,9,11-12,15-16H2,1-4H3	TXMPMEQLXDHGQS-UHFFFAOYSA-N	383.257277326							91536
F1641-0024	LSM-25867	SID842267, BRD-K57718988	644526	InChI=1S/C15H13NO2S/c17-15-16(13-8-4-5-9-14(13)19-15)10-11-18-12-6-2-1-3-7-12/h1-9H,10-11H2	PWFRUVAXYCWKLC-UHFFFAOYSA-N	O=C1Sc2ccccc2N1CCOc3ccccc3	BroadT	BRD-K57718988	BRD-K57718988-001-06-7	Asinex Ltd.	BAS 08977211			O=c1sc2ccccc2n1CCOc1ccccc1	InChI=1S/C15H13NO2S/c17-15-16(13-8-4-5-9-14(13)19-15)10-11-18-12-6-2-1-3-7-12/h1-9H,10-11H2	PWFRUVAXYCWKLC-UHFFFAOYSA-N	271.066699356							114407
MLS000086396	LSM-25868	SID4248668, BRD-A74743671	3242720	InChI=1S/C10H14BrNO2S2/c1-8-3-2-6-12(7-8)16(13,14)10-5-4-9(11)15-10/h4-5,8H,2-3,6-7H2,1H3	OPUFOLPIZQHECB-UHFFFAOYSA-N	CC1CCCN(C1)S(=O)(=O)c2ccc(Br)s2	BroadT	BRD-A74743671	BRD-A74743671-001-07-6	ChemDiv Inc.	C085-1658			CC1CCCN(C1)S(=O)(=O)c1ccc(Br)s1	InChI=1S/C10H14BrNO2S2/c1-8-3-2-6-12(7-8)16(13,14)10-5-4-9(11)15-10/h4-5,8H,2-3,6-7H2,1H3	OPUFOLPIZQHECB-UHFFFAOYSA-N	322.964932678							114408
AC1NPX9V	LSM-25869	BRD-K34595206	5186644	InChI=1S/C21H27N9O3/c1-3-32-16-6-4-15(5-7-16)12-23-25-21(31)18-17(13-29-10-8-14(2)9-11-29)30(28-24-18)20-19(22)26-33-27-20/h4-7,12,14H,3,8-11,13H2,1-2H3,(H2,22,26)(H,25,31)	ZOKKOJUPHQSNTJ-UHFFFAOYSA-N	CCOc1ccc(C=NNC(=O)c2nnn(c2CN3CCC(C)CC3)c4nonc4N)cc1	BroadT	BRD-K34595206	BRD-K34595206-001-06-3	ChemDiv Inc.	6011-0831			CCOc1ccc(C=NNC(=O)c2nnn(c2CN2CCC(C)CC2)-c2nonc2N)cc1	InChI=1S/C21H27N9O3/c1-3-32-16-6-4-15(5-7-16)12-23-25-21(31)18-17(13-29-10-8-14(2)9-11-29)30(28-24-18)20-19(22)26-33-27-20/h4-7,12,14H,3,8-11,13H2,1-2H3,(H2,22,26)(H,25,31)	ZOKKOJUPHQSNTJ-UHFFFAOYSA-N	453.223685814							114409
BAS 07244996	LSM-25870	SID843856, BRD-K32701113	646161	InChI=1S/C23H31N3O3S/c1-17-12-18(2)23(19(3)13-17)30(28,29)26(21-9-5-4-6-10-21)16-22(27)25-15-20-8-7-11-24-14-20/h7-8,11-14,21H,4-6,9-10,15-16H2,1-3H3,(H,25,27)	WVVDBXVFBSGXAG-UHFFFAOYSA-N	Cc1cc(C)c(c(C)c1)S(=O)(=O)N(CC(=O)NCc2cccnc2)C3CCCCC3	BroadT	BRD-K32701113	BRD-K32701113-001-05-3	Asinex Ltd.	BAS 07244996			Cc1cc(C)c(c(C)c1)S(=O)(=O)N(CC(=O)NCc1cccnc1)C1CCCCC1	InChI=1S/C23H31N3O3S/c1-17-12-18(2)23(19(3)13-17)30(28,29)26(21-9-5-4-6-10-21)16-22(27)25-15-20-8-7-11-24-14-20/h7-8,11-14,21H,4-6,9-10,15-16H2,1-3H3,(H,25,27)	WVVDBXVFBSGXAG-UHFFFAOYSA-N	429.208612572							114410
5-(4-Chlorophenyl)thieno[2,3-d]pyrimidine-4-thiol	LSM-25871	SID26665914, BRD-K81691462	703723	InChI=1S/C12H7ClN2S2/c13-8-3-1-7(2-4-8)9-5-17-12-10(9)11(16)14-6-15-12/h1-6H,(H,14,15,16)	OBZFUUIPSWALDY-UHFFFAOYSA-N	Sc1ncnc2scc(c3ccc(Cl)cc3)c12	BroadT	BRD-K81691462	BRD-K81691462-001-03-8	InterBioScreen Ltd.	STOCK3S-10787			Clc1ccc(cc1)-c1csc2nc[nH]c(=S)c12	InChI=1S/C12H7ClN2S2/c13-8-3-1-7(2-4-8)9-5-17-12-10(9)11(16)14-6-15-12/h1-6H,(H,14,15,16)	OBZFUUIPSWALDY-UHFFFAOYSA-N	277.973917334							114411
4756-01-8	LSM-25872	SID26731255, BRD-K67181191	2814701	InChI=1S/C18H19NO5S/c1-3-13-10-14(17(23)11-4-6-12(24-2)7-5-11)18(25-13)19-15(20)8-9-16(21)22/h4-7,10H,3,8-9H2,1-2H3,(H,19,20)(H,21,22)	NBNGRSKDTGQTBE-UHFFFAOYSA-N	CCc1cc(C(=O)c2ccc(OC)cc2)c(NC(=O)CCC(=O)O)s1	BroadT	BRD-K67181191	BRD-K67181191-001-04-4	Maybridge	HTS 09245			CCc1cc(C(=O)c2ccc(OC)cc2)c(NC(=O)CCC(O)=O)s1	InChI=1S/C18H19NO5S/c1-3-13-10-14(17(23)11-4-6-12(24-2)7-5-11)18(25-13)19-15(20)8-9-16(21)22/h4-7,10H,3,8-9H2,1-2H3,(H,19,20)(H,21,22)	NBNGRSKDTGQTBE-UHFFFAOYSA-N	361.098393408							114412
Visnagin	LSM-25873	Visnagin	6716	InChI=1S/C13H10O4/c1-7-5-9(14)12-11(17-7)6-10-8(3-4-16-10)13(12)15-2/h3-6H,1-2H3	NZVQLVGOZRELTG-UHFFFAOYSA-N	COc1c2C(=O)C=C(C)Oc2cc3occc13	BroadT	BRD-K68995359	BRD-K68995359-001-07-7	University of North Carolina at Chapel Hill	Visnagin FUK-724			COc1c2ccoc2cc2oc(C)cc(=O)c12	InChI=1S/C13H10O4/c1-7-5-9(14)12-11(17-7)6-10-8(3-4-16-10)13(12)15-2/h3-6H,1-2H3	NZVQLVGOZRELTG-UHFFFAOYSA-N	230.0579088							10002
T5290571	LSM-25874	SID22402525, BRD-A75588258	4874826	InChI=1S/C23H23NO5/c1-4-27-20-13-9-8-12-19(20)24-22(25)21(17-10-6-5-7-11-17)29-23(26)18-14-15(2)28-16(18)3/h5-14,21H,4H2,1-3H3,(H,24,25)	ARFQPWBTZDLRGW-UHFFFAOYSA-N	CCOc1ccccc1NC(=O)C(OC(=O)c2cc(C)oc2C)c3ccccc3	BroadT	BRD-A75588258	BRD-A75588258-001-05-9	Enamine Ltd.	T5290571			CCOc1ccccc1NC(=O)C(OC(=O)c1cc(C)oc1C)c1ccccc1	InChI=1S/C23H23NO5/c1-4-27-20-13-9-8-12-19(20)24-22(25)21(17-10-6-5-7-11-17)29-23(26)18-14-15(2)28-16(18)3/h5-14,21H,4H2,1-3H3,(H,24,25)	ARFQPWBTZDLRGW-UHFFFAOYSA-N	393.157622846							114413
4,5-Dimethoxy-2-(2-phenoxypropanoylamino)benzoic acid	LSM-25875	SID4263995, BRD-A77134384	2914913	InChI=1S/C18H19NO6/c1-11(25-12-7-5-4-6-8-12)17(20)19-14-10-16(24-3)15(23-2)9-13(14)18(21)22/h4-11H,1-3H3,(H,19,20)(H,21,22)	LKEPKOUIYQXLDG-UHFFFAOYSA-N	COc1cc(NC(=O)C(C)Oc2ccccc2)c(cc1OC)C(=O)O	BroadT	BRD-A77134384	BRD-A77134384-001-05-7	ChemBridge Corporation	6813008			COc1cc(NC(=O)C(C)Oc2ccccc2)c(cc1OC)C(O)=O	InChI=1S/C18H19NO6/c1-11(25-12-7-5-4-6-8-12)17(20)19-14-10-16(24-3)15(23-2)9-13(14)18(21)22/h4-11H,1-3H3,(H,19,20)(H,21,22)	LKEPKOUIYQXLDG-UHFFFAOYSA-N	345.121237338							114414
AC1LDFSL	LSM-25876	SID845058, BRD-A30366854	647394	InChI=1S/C26H26N4O6/c31-23(15-28-25(32)21-6-3-13-34-21)30(19-7-8-20-22(14-19)36-16-35-20)24(17-9-11-27-12-10-17)26(33)29-18-4-1-2-5-18/h3,6-14,18,24H,1-2,4-5,15-16H2,(H,28,32)(H,29,33)	WYZOOOZKCRZWBU-UHFFFAOYSA-N	O=C(CNC(=O)c1occc1)N(C(C(=O)NC2CCCC2)c3ccncc3)c4ccc5OCOc5c4	BroadT	BRD-A30366854	BRD-A30366854-001-05-2	Asinex Ltd.	ASN 05584584			O=C(NC1CCCC1)C(N(C(=O)CNC(=O)c1ccco1)c1ccc2OCOc2c1)c1ccncc1	InChI=1S/C26H26N4O6/c31-23(15-28-25(32)21-6-3-13-34-21)30(19-7-8-20-22(14-19)36-16-35-20)24(17-9-11-27-12-10-17)26(33)29-18-4-1-2-5-18/h3,6-14,18,24H,1-2,4-5,15-16H2,(H,28,32)(H,29,33)	WYZOOOZKCRZWBU-UHFFFAOYSA-N	490.185234592							114415
SMR000005863	LSM-25877	SID26668324, SID849087, BRD-K64467849	651558	InChI=1S/C20H19N7OS2/c1-2-12-27-17(15-10-6-7-11-21-15)23-26-20(27)29-13-16(28)22-19-25-24-18(30-19)14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H,22,25,28)	AEINRCKWDKCKJY-UHFFFAOYSA-N	CCCn1c(SCC(=O)Nc2nnc(s2)c3ccccc3)nnc1c4ccccn4	BroadT	BRD-K64467849	BRD-K64467849-001-05-3	Asinex Ltd.	ASN 05944601			CCCn1c(SCC(=O)Nc2nnc(s2)-c2ccccc2)nnc1-c1ccccn1	InChI=1S/C20H19N7OS2/c1-2-12-27-17(15-10-6-7-11-21-15)23-26-20(27)29-13-16(28)22-19-25-24-18(30-19)14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H,22,25,28)	AEINRCKWDKCKJY-UHFFFAOYSA-N	437.109249678							114416
SMR000161540	LSM-43023	SID17408930, BRD-K53856942	1819618	InChI=1S/C17H15N3O4/c1-11-4-6-12(7-5-11)18-15(21)10-20-16(22)14(19-17(20)23)9-13-3-2-8-24-13/h2-9H,10H2,1H3,(H,18,21)(H,19,23)/b14-9+	MVFGYEGISABJBI-NTEUORMPSA-N	Cc1ccc(NC(=O)CN2C(=O)N\C(=C\c3occc3)\C2=O)cc1	BroadT	BRD-K53856942	BRD-K53856942-001-05-6	Specs	AP-828/41100207			Cc1ccc(NC(=O)CN2C(=O)N\C(=C\c3ccco3)C2=O)cc1	InChI=1S/C17H15N3O4/c1-11-4-6-12(7-5-11)18-15(21)10-20-16(22)14(19-17(20)23)9-13-3-2-8-24-13/h2-9H,10H2,1H3,(H,18,21)(H,19,23)/b14-9+	MVFGYEGISABJBI-NTEUORMPSA-N	325.10625599							
6-(2,4-Dichlorophenyl)-1,5-diazabicyclo[3.1.0]hexane	LSM-25878	SID14735064, BRD-K27431305	686657	InChI=1S/C10H10Cl2N2/c11-7-2-3-8(9(12)6-7)10-13-4-1-5-14(10)13/h2-3,6,10H,1,4-5H2	MHSDNZOIEHWIIL-UHFFFAOYSA-N	Clc1ccc(C2N3CCCN23)c(Cl)c1	BroadT	BRD-K27431305	BRD-K27431305-001-05-2	ChemBridge Corporation	7197594			Clc1ccc(C2N3CCCN23)c(Cl)c1	InChI=1S/C10H10Cl2N2/c11-7-2-3-8(9(12)6-7)10-13-4-1-5-14(10)13/h2-3,6,10H,1,4-5H2	MHSDNZOIEHWIIL-UHFFFAOYSA-N	228.02210376							114417
BDBM72537	LSM-25879	BRD-A94935229	91898027	InChI=1S/C24H22N2O2/c1-2-28-16-10-8-15(9-11-16)22-23-17-5-4-14-25-18(17)12-13-20(23)26-19-6-3-7-21(27)24(19)22/h4-5,8-14,22,24H,2-3,6-7H2,1H3	XYTRLGRKPXOCIJ-UHFFFAOYSA-N	CCOc1ccc(cc1)C2C3C(=O)CCCC3=Nc4ccc5ncccc5c24	BroadT	BRD-A94935229	BRD-A94935229-001-07-1	ChemDiv Inc.	8012-4765			CCOc1ccc(cc1)C1C2C(=O)CCCC2=Nc2ccc3ncccc3c12	InChI=1S/C24H22N2O2/c1-2-28-16-10-8-15(9-11-16)22-23-17-5-4-14-25-18(17)12-13-20(23)26-19-6-3-7-21(27)24(19)22/h4-5,8-14,22,24H,2-3,6-7H2,1H3	XYTRLGRKPXOCIJ-UHFFFAOYSA-N	370.168127964							114418
Ethyl 6-(4-methoxyphenoxy)imidazo[1,2-b]pyridazine-2-carboxylate	LSM-25880	SID26729233, BRD-K88459478	2815679	InChI=1S/C16H15N3O4/c1-3-22-16(20)13-10-19-14(17-13)8-9-15(18-19)23-12-6-4-11(21-2)5-7-12/h4-10H,3H2,1-2H3	FJHHOYYOUAKNQS-UHFFFAOYSA-N	CCOC(=O)c1cn2nc(Oc3ccc(OC)cc3)ccc2n1	BroadT	BRD-K88459478	BRD-K88459478-001-05-0	Maybridge	HTS 10957			CCOC(=O)c1cn2nc(Oc3ccc(OC)cc3)ccc2n1	InChI=1S/C16H15N3O4/c1-3-22-16(20)13-10-19-14(17-13)8-9-15(18-19)23-12-6-4-11(21-2)5-7-12/h4-10H,3H2,1-2H3	FJHHOYYOUAKNQS-UHFFFAOYSA-N	313.10625599							114419
AC1LKM3V	LSM-25881	SID22409402, BRD-K68385893	993506	InChI=1S/C19H14N6OS/c26-18-13-10-20-25(12-6-2-1-3-7-12)17(13)23-16(24-18)11-27-19-21-14-8-4-5-9-15(14)22-19/h1-10H,11H2,(H,21,22)(H,23,24,26)	BZMUPRDSDRGONW-UHFFFAOYSA-N	Oc1nc(CSc2nc3ccccc3[nH]2)nc4c1cnn4c5ccccc5	BroadT	BRD-K68385893	BRD-K68385893-001-05-8	Enamine Ltd.	T5235952			Oc1nc(CSc2nc3ccccc3[nH]2)nc2n(ncc12)-c1ccccc1	InChI=1S/C19H14N6OS/c26-18-13-10-20-25(12-6-2-1-3-7-12)17(13)23-16(24-18)11-27-19-21-14-8-4-5-9-15(14)22-19/h1-10H,11H2,(H,21,22)(H,23,24,26)	BZMUPRDSDRGONW-UHFFFAOYSA-N	374.094979818							
MLS001143019	LSM-25882	SID49820543, BRD-K27345350	9522863	InChI=1S/C15H13Cl2N3O2/c1-20(15(22)10-5-7-18-8-6-10)9-13(21)19-14-11(16)3-2-4-12(14)17/h2-8H,9H2,1H3,(H,19,21)	SCXIMUGWZFUFJZ-UHFFFAOYSA-N	CN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c2ccncc2	BroadT	BRD-K27345350	BRD-K27345350-001-06-6	UkrOrgSynthesis Ltd.	PB68899813			CN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccncc1	InChI=1S/C15H13Cl2N3O2/c1-20(15(22)10-5-7-18-8-6-10)9-13(21)19-14-11(16)3-2-4-12(14)17/h2-8H,9H2,1H3,(H,19,21)	SCXIMUGWZFUFJZ-UHFFFAOYSA-N	337.038482106							114421
STK103195	LSM-15560	BRD-K92764098	2903542	InChI=1S/C30H36N2O/c33-30(29-19-22-31(23-20-29)21-10-17-26-11-4-1-5-12-26)32(25-28-15-8-3-9-16-28)24-18-27-13-6-2-7-14-27/h1-9,11-16,29H,10,17-25H2	BJEUNDABMRVMTC-UHFFFAOYSA-N	O=C(C1CCN(CCCc2ccccc2)CC1)N(CCc3ccccc3)Cc4ccccc4	BroadT	BRD-K92764098	BRD-K92764098-034-05-8	ChemBridge Corporation	6578807		OC(=O)C(=O)O	O=C(C1CCN(CCCc2ccccc2)CC1)N(CCc1ccccc1)Cc1ccccc1.OC(=O)C(=O)O	InChI=1S/C30H36N2O.C2H2O4/c33-30(29-19-22-31(23-20-29)21-10-17-26-11-4-1-5-12-26)32(25-28-15-8-3-9-16-28)24-18-27-13-6-2-7-14-27;3-1(4)2(5)6/h1-9,11-16,29H,10,17-25H2;(H,3,4)(H,5,6)	KGCHUBLWRIHHNR-UHFFFAOYSA-N	440.282763792							104196, 104196
CID 40785551	LSM-25883	BRD-A33167617	40785551	InChI=1S/C21H19N3O4/c1-13-7-14(2)9-15(8-13)27-12-20(26)28-11-19(25)16(10-22)21-23-17-5-3-4-6-18(17)24-21/h3-9,16H,11-12H2,1-2H3,(H,23,24)	RALSDBNHMUYRDW-UHFFFAOYSA-N	Cc1cc(C)cc(OCC(=O)OCC(=O)C(C#N)c2nc3ccccc3[nH]2)c1	BroadT	BRD-A33167617	BRD-A33167617-001-05-9	Enamine Ltd.	T5234447			Cc1cc(C)cc(OCC(=O)OCC(=O)C(C#N)c2nc3ccccc3[nH]2)c1	InChI=1S/C21H19N3O4/c1-13-7-14(2)9-15(8-13)27-12-20(26)28-11-19(25)16(10-22)21-23-17-5-3-4-6-18(17)24-21/h3-9,16H,11-12H2,1-2H3,(H,23,24)	RALSDBNHMUYRDW-UHFFFAOYSA-N	377.137556118							114422
N-Cyclopropyl-4-methylbenzenesulfonamide	LSM-25884	SID47200470, BRD-K75738997	4190095	InChI=1S/C10H13NO2S/c1-8-2-6-10(7-3-8)14(12,13)11-9-4-5-9/h2-3,6-7,9,11H,4-5H2,1H3	PFGWZABBMVYDBP-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NC2CC2	BroadT	BRD-K75738997	BRD-K75738997-001-05-4	Vitas-M Laboratory Ltd.	STK187826			Cc1ccc(cc1)S(=O)(=O)NC1CC1	InChI=1S/C10H13NO2S/c1-8-2-6-10(7-3-8)14(12,13)11-9-4-5-9/h2-3,6-7,9,11H,4-5H2,1H3	PFGWZABBMVYDBP-UHFFFAOYSA-N	211.066699356							114423
SMR000236677	LSM-44144	SID17514753, BRD-K67649668	2134372	InChI=1S/C16H14ClNO3S/c1-12-7-9-14(10-8-12)22(20,21)15(11-17)18-16(19)13-5-3-2-4-6-13/h2-11H,1H3,(H,18,19)/b15-11+	HEHYAHMUZJUXCA-RVDMUPIBSA-N	Cc1ccc(cc1)S(=O)(=O)\C(=C\Cl)\NC(=O)c2ccccc2	BroadT	BRD-K67649668	BRD-K67649668-001-05-1	Life Chemicals Inc.	F1430-0120			Cc1ccc(cc1)S(=O)(=O)C(\NC(=O)c1ccccc1)=C\Cl	InChI=1S/C16H14ClNO3S/c1-12-7-9-14(10-8-12)22(20,21)15(11-17)18-16(19)13-5-3-2-4-6-13/h2-11H,1H3,(H,18,19)/b15-11+	HEHYAHMUZJUXCA-RVDMUPIBSA-N	335.038291718							
ZINC02349718	LSM-25886	SID26660274, BRD-K61302363	1962620	InChI=1S/C11H9Cl3N2O/c12-8-1-3-9(4-2-8)17-6-5-16-7-15-10(13)11(16)14/h1-4,7H,5-6H2	ZSPABGAMDMXDMB-UHFFFAOYSA-N	Clc1ccc(OCCn2cnc(Cl)c2Cl)cc1	BroadT	BRD-K61302363	BRD-K61302363-001-06-9	InterBioScreen Ltd.	STOCK5S-54821			Clc1ncn(CCOc2ccc(Cl)cc2)c1Cl	InChI=1S/C11H9Cl3N2O/c12-8-1-3-9(4-2-8)17-6-5-16-7-15-10(13)11(16)14/h1-4,7H,5-6H2	ZSPABGAMDMXDMB-UHFFFAOYSA-N	289.978046058							114425
AC1MP4LW	LSM-25887	BRD-K34937366	3379492	InChI=1S/C14H12N4OS2/c1-19-11-5-2-4-10(8-11)9-15-18-13(16-17-14(18)20)12-6-3-7-21-12/h2-9H,1H3,(H,17,20)	JLIGEMBNADNKAK-UHFFFAOYSA-N	COc1cccc(C=Nn2c(S)nnc2c3cccs3)c1	BroadT	BRD-K34937366	BRD-K34937366-001-05-5	Key Organics Ltd.	12P-318S			COc1cccc(C=Nn2c(S)nnc2-c2cccs2)c1	InChI=1S/C14H12N4OS2/c1-19-11-5-2-4-10(8-11)9-15-18-13(16-17-14(18)20)12-6-3-7-21-12/h2-9H,1H3,(H,17,20)	JLIGEMBNADNKAK-UHFFFAOYSA-N	316.045252424							114426
SMR000011572	LSM-25888	SID26667417, SID851465, BRD-A17718913	5767131	InChI=1S/C21H23BrF3N5O/c22-14-5-3-13(4-6-14)17-10-18(21(23,24)25)30-19(27-17)16(11-26-30)20(31)29-9-8-28-7-1-2-15(28)12-29/h3-6,11,15,17-18,27H,1-2,7-10,12H2	CDPOFXVLELFQGF-UHFFFAOYSA-N	FC(F)(F)C1CC(Nc2c(cnn12)C(=O)N3CCN4CCCC4C3)c5ccc(Br)cc5	BroadT	BRD-A17718913	BRD-A17718913-001-06-8	Asinex Ltd.	BAS 02868489			FC(F)(F)C1CC(Nc2c(cnn12)C(=O)N1CCN2CCCC2C1)c1ccc(Br)cc1	InChI=1S/C21H23BrF3N5O/c22-14-5-3-13(4-6-14)17-10-18(21(23,24)25)30-19(27-17)16(11-26-30)20(31)29-9-8-28-7-1-2-15(28)12-29/h3-6,11,15,17-18,27H,1-2,7-10,12H2	CDPOFXVLELFQGF-UHFFFAOYSA-N	497.103807606							
AC1MT3TW	LSM-25889	SID24813865, BRD-K72244395	3544515	InChI=1S/C18H14N4O4S2/c23-14-9-11(19-13-3-1-2-6-21(13)14)10-28-18-20-12-5-8-27-16(12)17(26)22(18)7-4-15(24)25/h1-3,5-6,8-9H,4,7,10H2,(H,24,25)	VBIWUOXQQBXFOI-UHFFFAOYSA-N	OC(=O)CCN1C(=Nc2ccsc2C1=O)SCC3=CC(=O)N4C=CC=CC4=N3	BroadT	BRD-K72244395	BRD-K72244395-001-05-4	ChemDiv Inc.	K292-1800			OC(=O)CCn1c(SCc2cc(=O)n3ccccc3n2)nc2ccsc2c1=O	InChI=1S/C18H14N4O4S2/c23-14-9-11(19-13-3-1-2-6-21(13)14)10-28-18-20-12-5-8-27-16(12)17(26)22(18)7-4-15(24)25/h1-3,5-6,8-9H,4,7,10H2,(H,24,25)	VBIWUOXQQBXFOI-UHFFFAOYSA-N	414.045646348							114428
AC1LQYPB	LSM-15217	BRD-K82122338	1385054	InChI=1S/C22H23F2N2O/c1-16-6-8-17(9-7-16)20-15-26(21-5-3-2-4-14-25(20)21)18-10-12-19(13-11-18)27-22(23)24/h6-13,15,22H,2-5,14H2,1H3/q+1	XVVQRDYLCFKZMM-UHFFFAOYSA-N	Cc1ccc(cc1)c2c[n+](c3CCCCCn23)c4ccc(OC(F)F)cc4	BroadT	BRD-K82122338	BRD-K82122338-004-07-0	InterBioScreen Ltd.	STOCK2S-41876		Br	Cc1ccc(cc1)-c1c[n+](c2CCCCCn12)-c1ccc(OC(F)F)cc1.Br	InChI=1S/C22H23F2N2O.BrH/c1-16-6-8-17(9-7-16)20-15-26(21-5-3-2-4-14-25(20)21)18-10-12-19(13-11-18)27-22(23)24;/h6-13,15,22H,2-5,14H2,1H3;1H/q+1;	KPCXPNHPWPCHKL-UHFFFAOYSA-N	369.177844776							103864, 103864
MLS001018130	LSM-25890	SID24841169, BRD-K90608119	5949707	InChI=1S/C11H7N5O6S/c17-9-8(10(18)13-11(23)12-9)15-14-4-1-6-7(22-3-21-6)2-5(4)16(19)20/h1-2,14H,3H2,(H2,12,13,17,18,23)	CHSPZGXRMZCTKO-UHFFFAOYSA-N	[O-][N+](=O)c1cc2OCOc2cc1NN=C3C(=O)NC(=S)NC3=O	BroadT	BRD-K90608119	BRD-K90608119-001-05-3	Enamine Ltd.	T0500-4511			[O-][N+](=O)c1cc2OCOc2cc1NN=C1C(=O)NC(=S)NC1=O	InChI=1S/C11H7N5O6S/c17-9-8(10(18)13-11(23)12-9)15-14-4-1-6-7(22-3-21-6)2-5(4)16(19)20/h1-2,14H,3H2,(H2,12,13,17,18,23)	CHSPZGXRMZCTKO-UHFFFAOYSA-N	337.011703684							114429
STK233306	LSM-25891	SID17434128, BRD-A78031612	2948092	InChI=1S/C20H25NO3S/c1-14-5-8-17(9-6-14)25-15(2)20(22)21-12-11-16-7-10-18(23-3)19(13-16)24-4/h5-10,13,15H,11-12H2,1-4H3,(H,21,22)	HTOWLYWHZWNCJR-UHFFFAOYSA-N	COc1ccc(CCNC(=O)C(C)Sc2ccc(C)cc2)cc1OC	BroadT	BRD-A78031612	BRD-A78031612-001-05-8	ChemBridge Corporation	7692057			COc1ccc(CCNC(=O)C(C)Sc2ccc(C)cc2)cc1OC	InChI=1S/C20H25NO3S/c1-14-5-8-17(9-6-14)25-15(2)20(22)21-12-11-16-7-10-18(23-3)19(13-16)24-4/h5-10,13,15H,11-12H2,1-4H3,(H,21,22)	HTOWLYWHZWNCJR-UHFFFAOYSA-N	359.15551436							114430
AC1O9TW5	LSM-25892	SID864312, BRD-K39125958	6772164	InChI=1S/C21H21N3O4/c1-13(2)12-27-16-8-9-17(18(25)10-16)20-19(11-23-21(22)24-20)28-15-6-4-14(26-3)5-7-15/h4-11,25H,1,12H2,2-3H3,(H2,22,23,24)	DCWVJNHRWVAOOD-UHFFFAOYSA-N	COc1ccc(Oc2cnc(N)nc2c3ccc(OCC(=C)C)cc3O)cc1	BroadT	BRD-K39125958	BRD-K39125958-001-06-4	InterBioScreen Ltd.	STOCK5S-06740			COc1ccc(Oc2cnc(N)nc2-c2ccc(OCC(C)=C)cc2O)cc1	InChI=1S/C21H21N3O4/c1-13(2)12-27-16-8-9-17(18(25)10-16)20-19(11-23-21(22)24-20)28-15-6-4-14(26-3)5-7-15/h4-11,25H,1,12H2,2-3H3,(H2,22,23,24)	DCWVJNHRWVAOOD-UHFFFAOYSA-N	379.153206182							
AK-968/41926334	LSM-25893	SID17413923, BRD-K77597038	844572	InChI=1S/C13H13N3O2S/c1-9-4-2-5-10(8-9)14-13(19)16-15-12(17)11-6-3-7-18-11/h2-8H,1H3,(H,15,17)(H2,14,16,19)	SDNXXGICTKOJSY-UHFFFAOYSA-N	Cc1cccc(NC(=NNC(=O)c2occc2)S)c1	BroadT	BRD-K77597038	BRD-K77597038-001-05-3	ChemBridge Corporation	7931773			Cc1cccc(NC(S)=NNC(=O)c2ccco2)c1	InChI=1S/C13H13N3O2S/c1-9-4-2-5-10(8-9)14-13(19)16-15-12(17)11-6-3-7-18-11/h2-8H,1H3,(H,15,17)(H2,14,16,19)	SDNXXGICTKOJSY-UHFFFAOYSA-N	275.072847376							114432
4-Methylbenzyl 2-[5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-3-thienyl ether	LSM-25894	SID17402975, BRD-K46766754	1485914	InChI=1S/C15H15N3OS2/c1-10-3-5-11(6-4-10)9-19-12-7-8-21-13(12)14-16-15(20-2)18-17-14/h3-8H,9H2,1-2H3,(H,16,17,18)	AYCPBZQNSMAHNW-UHFFFAOYSA-N	CSc1n[nH]c(n1)c2sccc2OCc3ccc(C)cc3	BroadT	BRD-K46766754	BRD-K46766754-001-05-4	Key Organics Ltd.	8D-041			CSc1n[nH]c(n1)-c1sccc1OCc1ccc(C)cc1	InChI=1S/C15H15N3OS2/c1-10-3-5-11(6-4-10)9-19-12-7-8-21-13(12)14-16-15(20-2)18-17-14/h3-8H,9H2,1-2H3,(H,16,17,18)	AYCPBZQNSMAHNW-UHFFFAOYSA-N	317.06565351							114433
Ethyl 3-methyl-4-oxo-4H-chromen-2-ylcarbamate	LSM-25895	SID14719264, BRD-K10105887	900079	InChI=1S/C13H13NO4/c1-3-17-13(16)14-12-8(2)11(15)9-6-4-5-7-10(9)18-12/h4-7H,3H2,1-2H3,(H,14,16)	NFVDDCUFERAWFA-UHFFFAOYSA-N	CCOC(=O)NC1=C(C)C(=O)c2ccccc2O1	BroadT	BRD-K10105887	BRD-K10105887-001-05-7	Specs	AH-262/34870018			CCOC(=O)Nc1oc2ccccc2c(=O)c1C	InChI=1S/C13H13NO4/c1-3-17-13(16)14-12-8(2)11(15)9-6-4-5-7-10(9)18-12/h4-7H,3H2,1-2H3,(H,14,16)	NFVDDCUFERAWFA-UHFFFAOYSA-N	247.084457906							114434
ASN 03366275	LSM-25896	SID847643, BRD-K09658832	650045	InChI=1S/C14H12N4O2S/c1-20-11-6-4-10(5-7-11)12(19)9-18-16-14(15-17-18)13-3-2-8-21-13/h2-8H,9H2,1H3	AAGGUCRASUJPPN-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)Cn2nnc(n2)c3cccs3	BroadT	BRD-K09658832	BRD-K09658832-001-06-2	Asinex Ltd.	ASN 03366275			COc1ccc(cc1)C(=O)Cn1nnc(n1)-c1cccs1	InChI=1S/C14H12N4O2S/c1-20-11-6-4-10(5-7-11)12(19)9-18-16-14(15-17-18)13-3-2-8-21-13/h2-8H,9H2,1H3	AAGGUCRASUJPPN-UHFFFAOYSA-N	300.068096354							114435
AMBCB6339304	LSM-44145	SID24803886, BRD-K77315003	2276050	InChI=1S/C15H9BrN2O3S/c16-10-2-1-3-11(7-10)18-14(20)12(13(19)17-15(18)21)6-9-4-5-22-8-9/h1-8H,(H,17,19,21)/b12-6+	RJGKMSIQAPIBBF-WUXMJOGZSA-N	Brc1cccc(c1)N2C(=O)NC(=O)\C(=C/c3ccsc3)\C2=O	BroadT	BRD-K77315003	BRD-K77315003-001-05-1	ChemBridge Corporation	6339304			Brc1cccc(c1)N1C(=O)NC(=O)\C(=C/c2ccsc2)C1=O	InChI=1S/C15H9BrN2O3S/c16-10-2-1-3-11(7-10)18-14(20)12(13(19)17-15(18)21)6-9-4-5-22-8-9/h1-8H,(H,17,19,21)/b12-6+	RJGKMSIQAPIBBF-WUXMJOGZSA-N	375.951725458							
SMR000067675	LSM-25898	SID3713204, BRD-K73941824	2093024	InChI=1S/C20H20N4O4S/c1-22-19(25)17-10-6-5-9-16(17)18(21-22)20(26)23-11-13-24(14-12-23)29(27,28)15-7-3-2-4-8-15/h2-10H,11-14H2,1H3	TVLBYOMAXPTPPQ-UHFFFAOYSA-N	CN1N=C(C(=O)N2CCN(CC2)S(=O)(=O)c3ccccc3)c4ccccc4C1=O	BroadT	BRD-K73941824	BRD-K73941824-001-05-5	Enamine Ltd.	T5275907			Cn1nc(C(=O)N2CCN(CC2)S(=O)(=O)c2ccccc2)c2ccccc2c1=O	InChI=1S/C20H20N4O4S/c1-22-19(25)17-10-6-5-9-16(17)18(21-22)20(26)23-11-13-24(14-12-23)29(27,28)15-7-3-2-4-8-15/h2-10H,11-14H2,1H3	TVLBYOMAXPTPPQ-UHFFFAOYSA-N	412.12052585							114437
T0519-1921	LSM-25899	SID14744545, BRD-K24484078	2479525	InChI=1S/C17H20N2O6/c1-4-22-13-7-6-12(9-14(13)23-5-2)17(21)24-10-16(20)18-15-8-11(3)25-19-15/h6-9H,4-5,10H2,1-3H3,(H,18,19,20)	DGIXGIISUHFSPW-UHFFFAOYSA-N	CCOc1ccc(cc1OCC)C(=O)OCC(=O)Nc2cc(C)on2	BroadT	BRD-K24484078	BRD-K24484078-001-05-9	Enamine Ltd.	T0519-1921			CCOc1ccc(cc1OCC)C(=O)OCC(=O)Nc1cc(C)on1	InChI=1S/C17H20N2O6/c1-4-22-13-7-6-12(9-14(13)23-5-2)17(21)24-10-16(20)18-15-8-11(3)25-19-15/h6-9H,4-5,10H2,1-3H3,(H,18,19,20)	DGIXGIISUHFSPW-UHFFFAOYSA-N	348.13213638							114438
BAS 08315424	LSM-25900	SID26752269, SID851697, BRD-K19274991	654290	InChI=1S/C20H16N4O2/c1-13-5-7-14(8-6-13)17-10-9-16(20(22-17)25-2)18-23-19(26-24-18)15-4-3-11-21-12-15/h3-12H,1-2H3	YAZZRSRSFPKDSY-UHFFFAOYSA-N	COc1nc(ccc1c2noc(n2)c3cccnc3)c4ccc(C)cc4	BroadT	BRD-K19274991	BRD-K19274991-001-05-5	Asinex Ltd.	BAS 08315424			COc1nc(ccc1-c1noc(n1)-c1cccnc1)-c1ccc(C)cc1	InChI=1S/C20H16N4O2/c1-13-5-7-14(8-6-13)17-10-9-16(20(22-17)25-2)18-23-19(26-24-18)15-4-3-11-21-12-15/h3-12H,1-2H3	YAZZRSRSFPKDSY-UHFFFAOYSA-N	344.127325792							114439
T5236014	LSM-25901	SID22409368, BRD-K90117425	3514770	InChI=1S/C21H20ClN3O5S/c1-29-18-9-5-3-7-16(18)24-21(26)23-14-11-12-15(22)20(13-14)31(27,28)25-17-8-4-6-10-19(17)30-2/h3-13,25H,1-2H3,(H2,23,24,26)	ORYPYYCMNHQXGU-UHFFFAOYSA-N	COc1ccccc1NC(=O)Nc2ccc(Cl)c(c2)S(=O)(=O)Nc3ccccc3OC	BroadT	BRD-K90117425	BRD-K90117425-001-06-2	Enamine Ltd.	T5236014			COc1ccccc1NC(=O)Nc1ccc(Cl)c(c1)S(=O)(=O)Nc1ccccc1OC	InChI=1S/C21H20ClN3O5S/c1-29-18-9-5-3-7-16(18)24-21(26)23-14-11-12-15(22)20(13-14)31(27,28)25-17-8-4-6-10-19(17)30-2/h3-13,25H,1-2H3,(H2,23,24,26)	ORYPYYCMNHQXGU-UHFFFAOYSA-N	461.08121917							114440
SMR000026424	LSM-25902	SID4251277, BRD-K45576576	3244985	InChI=1S/C21H22N2O5/c1-3-27-21(25)13-6-8-23(9-7-13)20(24)18-12-15-10-14-11-16(26-2)4-5-17(14)22-19(15)28-18/h4-5,10-13H,3,6-9H2,1-2H3	KTMOBSCJDWIGPW-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC1)C(=O)c2oc3nc4ccc(OC)cc4cc3c2	BroadT	BRD-K45576576	BRD-K45576576-001-05-4	ChemDiv Inc.	C369-0033			CCOC(=O)C1CCN(CC1)C(=O)c1cc2cc3cc(OC)ccc3nc2o1	InChI=1S/C21H22N2O5/c1-3-27-21(25)13-6-8-23(9-7-13)20(24)18-12-15-10-14-11-16(26-2)4-5-17(14)22-19(15)28-18/h4-5,10-13H,3,6-9H2,1-2H3	KTMOBSCJDWIGPW-UHFFFAOYSA-N	382.152871824							114441
AC1OA29S	LSM-25903	SID14722485, BRD-K53101923	6744899	InChI=1S/C14H13N3OS/c1-2-17-13(15-16-14(17)19)11-7-9-5-3-4-6-10(9)8-12(11)18/h3-8,18H,2H2,1H3,(H,16,19)	MGJTUWIRWFUWOF-UHFFFAOYSA-N	CCn1c(S)nnc1c2cc3ccccc3cc2O	BroadT	BRD-K53101923	BRD-K53101923-001-05-0	Asinex Ltd.	ASN 03792078			CCn1c(S)nnc1-c1cc2ccccc2cc1O	InChI=1S/C14H13N3OS/c1-2-17-13(15-16-14(17)19)11-7-9-5-3-4-6-10(9)8-12(11)18/h3-8,18H,2H2,1H3,(H,16,19)	MGJTUWIRWFUWOF-UHFFFAOYSA-N	271.077932756							
MLS000724395	LSM-44146	SJ000033254, BRD-K84707708	5509882	InChI=1S/C24H20N2O4/c1-29-18-11-7-16(8-12-18)25-15-22-20-5-3-4-6-21(20)23(27)26(24(22)28)17-9-13-19(30-2)14-10-17/h3-15,25H,1-2H3/b22-15+	YSHXPAHICFEZLB-PXLXIMEGSA-N	COc1ccc(N\C=C/2\C(=O)N(C(=O)c3ccccc23)c4ccc(OC)cc4)cc1	BroadT	BRD-K84707708	BRD-K84707708-001-05-8	ChemDiv Inc.	5122-2918			COc1ccc(N\C=C2\C(=O)N(C(=O)c3ccccc23)c2ccc(OC)cc2)cc1	InChI=1S/C24H20N2O4/c1-29-18-11-7-16(8-12-18)25-15-22-20-5-3-4-6-21(20)23(27)26(24(22)28)17-9-13-19(30-2)14-10-17/h3-15,25H,1-2H3/b22-15+	YSHXPAHICFEZLB-PXLXIMEGSA-N	400.14230714							
20513-71-7	LSM-25905	SID14741696, BRD-K70466982	5374442	InChI=1S/C10H9NO2/c1-6-4-10(13)11-9-5-7(12)2-3-8(6)9/h2-5,12H,1H3,(H,11,13)	MYEVEFULPUKTSZ-UHFFFAOYSA-N	Cc1cc(O)nc2cc(O)ccc12	BroadT	BRD-K70466982	BRD-K70466982-001-06-2	InterBioScreen Ltd.	STOCK2S-03382			Cc1cc(O)nc2cc(O)ccc12	InChI=1S/C10H9NO2/c1-6-4-10(13)11-9-5-7(12)2-3-8(6)9/h2-5,12H,1H3,(H,11,13)	MYEVEFULPUKTSZ-UHFFFAOYSA-N	175.063328538							114444
ZINC00416869	LSM-25906	SID24802123, BRD-K36022879	6744901	InChI=1S/C17H13N3O2S/c21-15-9-12-5-2-1-4-11(12)8-14(15)16-18-19-17(23)20(16)10-13-6-3-7-22-13/h1-9,21H,10H2,(H,19,23)	UHTWFKVVFKCPHS-UHFFFAOYSA-N	Oc1cc2ccccc2cc1c3nnc(S)n3Cc4occc4	BroadT	BRD-K36022879	BRD-K36022879-001-05-4	Asinex Ltd.	ASN 03792413			Oc1cc2ccccc2cc1-c1nnc(S)n1Cc1ccco1	InChI=1S/C17H13N3O2S/c21-15-9-12-5-2-1-4-11(12)8-14(15)16-18-19-17(23)20(16)10-13-6-3-7-22-13/h1-9,21H,10H2,(H,19,23)	UHTWFKVVFKCPHS-UHFFFAOYSA-N	323.072847376							
MLS000118070	LSM-25907	SID7966507, BRD-K75713800	5308277	InChI=1S/C20H21N3O3/c1-25-18-10-8-15(9-11-18)19-13-16(23-26-19)6-4-7-20(24)22-14-17-5-2-3-12-21-17/h2-3,5,8-13H,4,6-7,14H2,1H3,(H,22,24)	MWUVTCYCKYJPLA-UHFFFAOYSA-N	COc1ccc(cc1)c2onc(CCCC(=O)NCc3ccccn3)c2	BroadT	BRD-K75713800	BRD-K75713800-001-05-4	ChemDiv Inc.	C591-0399			COc1ccc(cc1)-c1cc(CCCC(=O)NCc2ccccn2)no1	InChI=1S/C20H21N3O3/c1-25-18-10-8-15(9-11-18)19-13-16(23-26-19)6-4-7-20(24)22-14-17-5-2-3-12-21-17/h2-3,5,8-13H,4,6-7,14H2,1H3,(H,22,24)	MWUVTCYCKYJPLA-UHFFFAOYSA-N	351.158291562							114446
N'1-[4-(trifluoromethyl)pyrimidin-2-yl]-2,3-dichlorobenzene-1-sulfonohydrazide	LSM-25908	SID26728441, BRD-K89468109	2809292	InChI=1S/C11H7Cl2F3N4O2S/c12-6-2-1-3-7(9(6)13)23(21,22)20-19-10-17-5-4-8(18-10)11(14,15)16/h1-5,20H,(H,17,18,19)	YHJVDKQEGUEPTC-UHFFFAOYSA-N	FC(F)(F)c1ccnc(NNS(=O)(=O)c2cccc(Cl)c2Cl)n1	BroadT	BRD-K89468109	BRD-K89468109-001-05-7	Maybridge	HAN 00411			FC(F)(F)c1ccnc(NNS(=O)(=O)c2cccc(Cl)c2Cl)n1	InChI=1S/C11H7Cl2F3N4O2S/c12-6-2-1-3-7(9(6)13)23(21,22)20-19-10-17-5-4-8(18-10)11(14,15)16/h1-5,20H,(H,17,18,19)	YHJVDKQEGUEPTC-UHFFFAOYSA-N	385.961886214							114447
MLS000910982	LSM-25909	SID26668747, SID4259266, BRD-K19155347	2940774	InChI=1S/C25H31N3O5S/c1-18-11-12-19(17-23(18)34(31,32)28-13-15-33-16-14-28)24(29)27-22-10-6-5-9-21(22)25(30)26-20-7-3-2-4-8-20/h5-6,9-12,17,20H,2-4,7-8,13-16H2,1H3,(H,26,30)(H,27,29)	FENKNZGZAAZQMF-UHFFFAOYSA-N	Cc1ccc(cc1S(=O)(=O)N2CCOCC2)C(=O)Nc3ccccc3C(=O)NC4CCCCC4	BroadT	BRD-K19155347	BRD-K19155347-001-05-7	ChemBridge Corporation	7485736			Cc1ccc(cc1S(=O)(=O)N1CCOCC1)C(=O)Nc1ccccc1C(=O)NC1CCCCC1	InChI=1S/C25H31N3O5S/c1-18-11-12-19(17-23(18)34(31,32)28-13-15-33-16-14-28)24(29)27-22-10-6-5-9-21(22)25(30)26-20-7-3-2-4-8-20/h5-6,9-12,17,20H,2-4,7-8,13-16H2,1H3,(H,26,30)(H,27,29)	FENKNZGZAAZQMF-UHFFFAOYSA-N	485.198441812							114448
MLS000889589	LSM-25910	SID845308, SID26726047, BRD-K33100391	647652	InChI=1S/C23H24N4O4S2/c28-22(15-26-10-12-31-13-11-26)25-23-24-20(16-32-23)17-6-7-21-18(14-17)8-9-27(21)33(29,30)19-4-2-1-3-5-19/h1-7,14,16H,8-13,15H2,(H,24,25,28)	IDFNVQVQVLHAEK-UHFFFAOYSA-N	O=C(CN1CCOCC1)Nc2nc(cs2)c3ccc4N(CCc4c3)S(=O)(=O)c5ccccc5	BroadT	BRD-K33100391	BRD-K33100391-001-07-6	Asinex Ltd.	ASN 10295793			O=C(CN1CCOCC1)Nc1nc(cs1)-c1ccc2N(CCc2c1)S(=O)(=O)c1ccccc1	InChI=1S/C23H24N4O4S2/c28-22(15-26-10-12-31-13-11-26)25-23-24-20(16-32-23)17-6-7-21-18(14-17)8-9-27(21)33(29,30)19-4-2-1-3-5-19/h1-7,14,16H,8-13,15H2,(H,24,25,28)	IDFNVQVQVLHAEK-UHFFFAOYSA-N	484.123896668							114449
ST50594631	LSM-25911	SID17412541, BRD-K78992216	800668	InChI=1S/C17H18N2O2S/c1-11-3-4-12(2)14(7-11)19-17(22)18-9-13-5-6-15-16(8-13)21-10-20-15/h3-8H,9-10H2,1-2H3,(H2,18,19,22)	MVVKCVKGFBKBRI-UHFFFAOYSA-N	Cc1ccc(C)c(NC(=NCc2ccc3OCOc3c2)S)c1	BroadT	BRD-K78992216	BRD-K78992216-001-05-9	ChemBridge Corporation	6937619			Cc1ccc(C)c(NC(S)=NCc2ccc3OCOc3c2)c1	InChI=1S/C17H18N2O2S/c1-11-3-4-12(2)14(7-11)19-17(22)18-9-13-5-6-15-16(8-13)21-10-20-15/h3-8H,9-10H2,1-2H3,(H2,18,19,22)	MVVKCVKGFBKBRI-UHFFFAOYSA-N	314.108898526							114450
AC1M6QKZ	LSM-25912	BRD-K40552468	2453423	InChI=1S/C15H10N6O4S/c22-21(23)11-6-13-12(24-8-25-13)5-9(11)7-17-20-14(18-19-15(20)26)10-3-1-2-4-16-10/h1-7H,8H2,(H,19,26)	HHUIEVIKOSGJDI-UHFFFAOYSA-N	[O-][N+](=O)c1cc2OCOc2cc1C=Nn3c(S)nnc3c4ccccn4	BroadT	BRD-K40552468	BRD-K40552468-001-06-9	Enamine Ltd.	T5215476			[O-][N+](=O)c1cc2OCOc2cc1C=Nn1c(S)nnc1-c1ccccn1	InChI=1S/C15H10N6O4S/c22-21(23)11-6-13-12(24-8-25-13)5-9(11)7-17-20-14(18-19-15(20)26)10-3-1-2-4-16-10/h1-7H,8H2,(H,19,26)	HHUIEVIKOSGJDI-UHFFFAOYSA-N	370.04842355							114451
SMR000034314	LSM-25913	SID50103364, SID856353, BRD-K57074520	657720	InChI=1S/C17H21N3/c18-16-13-8-4-5-9-15(13)19-17-14(16)10-11-20(17)12-6-2-1-3-7-12/h4-5,8-9,12H,1-3,6-7,10-11H2,(H2,18,19)	IVZOSCLDRXLTLK-UHFFFAOYSA-N	Nc1c2CCN(C3CCCCC3)c2nc4ccccc14	BroadT	BRD-K57074520	BRD-K57074520-001-05-2	InterBioScreen Ltd.	STOCK1S-09329			Nc1c2CCN(C3CCCCC3)c2nc2ccccc12	InChI=1S/C17H21N3/c18-16-13-8-4-5-9-15(13)19-17-14(16)10-11-20(17)12-6-2-1-3-7-12/h4-5,8-9,12H,1-3,6-7,10-11H2,(H2,18,19)	IVZOSCLDRXLTLK-UHFFFAOYSA-N	267.173547702							114452
MLS000078521	LSM-25914	SID859329, BRD-A59700631	5389258	InChI=1S/C14H12Cl2N4O/c1-7-12(8(2)21)13(20-14(19-7)17-6-18-20)10-4-3-9(15)5-11(10)16/h3-6,13H,1-2H3,(H,17,18,19)	RXIMEUOKWLCFEK-UHFFFAOYSA-N	CC(=O)C1=C(C)Nc2ncnn2C1c3ccc(Cl)cc3Cl	BroadT	BRD-A59700631	BRD-A59700631-001-05-8	InterBioScreen Ltd.	STOCK3S-05655			CC(=O)C1=C(C)Nc2ncnn2C1c1ccc(Cl)cc1Cl	InChI=1S/C14H12Cl2N4O/c1-7-12(8(2)21)13(20-14(19-7)17-6-18-20)10-4-3-9(15)5-11(10)16/h3-6,13H,1-2H3,(H,17,18,19)	RXIMEUOKWLCFEK-UHFFFAOYSA-N	322.038816464							114453
AC1LCWRY	LSM-25915	SID856161, BRD-K70710663	657540	InChI=1S/C18H22N4O4/c23-17(15-3-1-5-19-13-15)21-7-9-25-11-12-26-10-8-22-18(24)16-4-2-6-20-14-16/h1-6,13-14H,7-12H2,(H,21,23)(H,22,24)	AZWILAJDMRRBPV-UHFFFAOYSA-N	O=C(NCCOCCOCCNC(=O)c1cccnc1)c2cccnc2	BroadT	BRD-K70710663	BRD-K70710663-001-06-9	InterBioScreen Ltd.	STOCK1S-03976			O=C(NCCOCCOCCNC(=O)c1cccnc1)c1cccnc1	InChI=1S/C18H22N4O4/c23-17(15-3-1-5-19-13-15)21-7-9-25-11-12-26-10-8-22-18(24)16-4-2-6-20-14-16/h1-6,13-14H,7-12H2,(H,21,23)(H,22,24)	AZWILAJDMRRBPV-UHFFFAOYSA-N	358.164105224							114454
ST50113790	LSM-15218	BRD-K29832021	2368939	InChI=1S/C22H24BrN2S/c1-22(2,3)17-7-5-16(6-8-17)20-15-25(19-11-9-18(23)10-12-19)21-24(20)13-4-14-26-21/h5-12,15H,4,13-14H2,1-3H3/q+1	YBXZOFGBMWVTIK-UHFFFAOYSA-N	CC(C)(C)c1ccc(cc1)c2c[n+](c3SCCCn23)c4ccc(Br)cc4	BroadT	BRD-K29832021	BRD-K29832021-004-06-4	Enamine Ltd.	T0507-2633		Br	CC(C)(C)c1ccc(cc1)-c1c[n+](c2SCCCn12)-c1ccc(Br)cc1.Br	InChI=1S/C22H24BrN2S.BrH/c1-22(2,3)17-7-5-16(6-8-17)20-15-25(19-11-9-18(23)10-12-19)21-24(20)13-4-14-26-21;/h5-12,15H,4,13-14H2,1-3H3;1H/q+1;	MVNMFEQDIZUTGN-UHFFFAOYSA-N	427.084357078							103865, 103865
AC1MWC8S	LSM-25916	SID26670811, BRD-K34632925	3697209	InChI=1S/C18H20N2S/c1-12-19-16-14-8-4-3-7-13(14)11-18(9-5-2-6-10-18)15(16)17(21)20-12/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,19,20,21)	GFVQCHYKKITWKQ-UHFFFAOYSA-N	Cc1nc(S)c2c(n1)c3ccccc3CC24CCCCC4	BroadT	BRD-K34632925	BRD-K34632925-001-06-4	InterBioScreen Ltd.	STOCK1S-24019			Cc1nc(S)c2c(n1)-c1ccccc1CC21CCCCC1	InChI=1S/C18H20N2S/c1-12-19-16-14-8-4-3-7-13(14)11-18(9-5-2-6-10-18)15(16)17(21)20-12/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,19,20,21)	GFVQCHYKKITWKQ-UHFFFAOYSA-N	296.13471935							114455
CHEMBL1076619	LSM-25917	SID26731091, BRD-K95956887	5371485	InChI=1S/C10H9ClN4O/c1-6-9(10(16)15-12-6)14-13-8-5-3-2-4-7(8)11/h2-5H,1H3,(H2,12,15,16)	HKLNITPOCBNQOD-UHFFFAOYSA-N	Cc1n[nH]c(O)c1N=Nc2ccccc2Cl	BroadT	BRD-K95956887	BRD-K95956887-001-06-9	Maybridge	RJC 02940			Cc1n[nH]c(O)c1N=Nc1ccccc1Cl	InChI=1S/C10H9ClN4O/c1-6-9(10(16)15-12-6)14-13-8-5-3-2-4-7(8)11/h2-5H,1H3,(H2,12,15,16)	HKLNITPOCBNQOD-UHFFFAOYSA-N	236.046488658							
T5849798	LSM-25918	SID22402496, BRD-A45498171	4878041	InChI=1S/C25H25N3O4S/c1-15-13-19(16(2)28(15)17-6-8-18(32-3)9-7-17)21(29)14-27-23(30)25(26-24(27)31)11-4-5-22-20(25)10-12-33-22/h6-10,12-13H,4-5,11,14H2,1-3H3,(H,26,31)	BOOAAVBIPNGXKJ-UHFFFAOYSA-N	COc1ccc(cc1)n2c(C)cc(C(=O)CN3C(=O)NC4(CCCc5sccc45)C3=O)c2C	BroadT	BRD-A45498171	BRD-A45498171-001-06-0	Enamine Ltd.	T5308173			COc1ccc(cc1)-n1c(C)cc(C(=O)CN2C(=O)NC3(CCCc4sccc34)C2=O)c1C	InChI=1S/C25H25N3O4S/c1-15-13-19(16(2)28(15)17-6-8-18(32-3)9-7-17)21(29)14-27-23(30)25(26-24(27)31)11-4-5-22-20(25)10-12-33-22/h6-10,12-13H,4-5,11,14H2,1-3H3,(H,26,31)	BOOAAVBIPNGXKJ-UHFFFAOYSA-N	463.156577							114457
SMR000031097	LSM-25919	SID26724722, SID4241523, BRD-K59868063	3236485	InChI=1S/C24H23N3O6S/c28-21(26-7-5-24(6-8-26)32-9-10-33-24)16-2-3-17-18(12-16)25-23(34)27(22(17)29)13-15-1-4-19-20(11-15)31-14-30-19/h1-4,11-12H,5-10,13-14H2,(H,25,34)	WPTFCTBFOOQKHH-UHFFFAOYSA-N	O=C(N1CCC2(CC1)OCCO2)c3ccc4C(=O)N(Cc5ccc6OCOc6c5)C(=S)Nc4c3	BroadT	BRD-K59868063	BRD-K59868063-001-06-6	ChemDiv Inc.	K288-0808			O=C(N1CCC2(CC1)OCCO2)c1ccc2c(c1)[nH]c(=S)n(Cc1ccc3OCOc3c1)c2=O	InChI=1S/C24H23N3O6S/c28-21(26-7-5-24(6-8-26)32-9-10-33-24)16-2-3-17-18(12-16)25-23(34)27(22(17)29)13-15-1-4-19-20(11-15)31-14-30-19/h1-4,11-12H,5-10,13-14H2,(H,25,34)	WPTFCTBFOOQKHH-UHFFFAOYSA-N	481.130756176							114458
AE-848/34090092	LSM-25920	SID24804800, BRD-K62089705	806205	InChI=1S/C15H13NO3S/c17-15-12-9-5-2-1-3-7-11(9)20-14(12)16-13(19-15)10-6-4-8-18-10/h4,6,8H,1-3,5,7H2	CYSBQOZDMJMKOX-UHFFFAOYSA-N	O=C1OC(=Nc2sc3CCCCCc3c12)c4occc4	BroadT	BRD-K62089705	BRD-K62089705-001-05-0	Asinex Ltd.	BAS 00486778			O=c1oc(nc2sc3CCCCCc3c12)-c1ccco1	InChI=1S/C15H13NO3S/c17-15-12-9-5-2-1-3-7-11(9)20-14(12)16-13(19-15)10-6-4-8-18-10/h4,6,8H,1-3,5,7H2	CYSBQOZDMJMKOX-UHFFFAOYSA-N	287.061613976							114459
AC1M1NUE	LSM-25921	BRD-K23871803	2127161	InChI=1S/C23H21N5O3S2/c1-16-20(17(2)28(26-16)18-9-4-3-5-10-18)15-24-25-23(29)19-11-6-7-12-21(19)27-33(30,31)22-13-8-14-32-22/h3-15,27H,1-2H3,(H,25,29)	XUTSBRXEULOVTP-UHFFFAOYSA-N	Cc1nn(c(C)c1C=NNC(=O)c2ccccc2NS(=O)(=O)c3cccs3)c4ccccc4	BroadT	BRD-K23871803	BRD-K23871803-001-05-0	Enamine Ltd.	T5254740			Cc1nn(c(C)c1C=NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)-c1ccccc1	InChI=1S/C23H21N5O3S2/c1-16-20(17(2)28(26-16)18-9-4-3-5-10-18)15-24-25-23(29)19-11-6-7-12-21(19)27-33(30,31)22-13-8-14-32-22/h3-15,27H,1-2H3,(H,25,29)	XUTSBRXEULOVTP-UHFFFAOYSA-N	479.108580962							114460
AC1OA0DU	LSM-25922	BRD-K47430271	6742924	InChI=1S/C12H10N4O3/c17-12(15-14-8-10-4-2-6-13-10)9-3-1-5-11(7-9)16(18)19/h1-8,13H,(H,15,17)	FUPAWSGZKUYSQL-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C(=O)NN=Cc2ccc[nH]2	BroadT	BRD-K47430271	BRD-K47430271-001-05-0	ChemBridge Corporation	5227425			[O-][N+](=O)c1cccc(c1)C(=O)NN=Cc1ccc[nH]1	InChI=1S/C12H10N4O3/c17-12(15-14-8-10-4-2-6-13-10)9-3-1-5-11(7-9)16(18)19/h1-8,13H,(H,15,17)	FUPAWSGZKUYSQL-UHFFFAOYSA-N	258.07529022							
N-(3,4-Dimethoxyphenyl)-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine	LSM-25923	SID26670158, SID7971612, BRD-K99154245	1420592	InChI=1S/C20H19N5O2/c1-13-5-4-6-15(9-13)25-20-16(11-23-25)19(21-12-22-20)24-14-7-8-17(26-2)18(10-14)27-3/h4-12H,1-3H3,(H,21,22,24)	NDHVYEPEGSUFQM-UHFFFAOYSA-N	COc1ccc(Nc2ncnc3c2cnn3c4cccc(C)c4)cc1OC	BroadT	BRD-K99154245	BRD-K99154245-001-03-1	Life Chemicals Inc.	F0517-0419			COc1ccc(Nc2ncnc3n(ncc23)-c2cccc(C)c2)cc1OC	InChI=1S/C20H19N5O2/c1-13-5-4-6-15(9-13)25-20-16(11-23-25)19(21-12-22-20)24-14-7-8-17(26-2)18(10-14)27-3/h4-12H,1-3H3,(H,21,22,24)	NDHVYEPEGSUFQM-UHFFFAOYSA-N	361.153874898							114462
AC1LM1C4	LSM-25924	BRD-K13185608	1120498	InChI=1S/C19H21Cl2N3O3/c1-12-8-14(11-22-23-18(25)10-19(3)26-6-7-27-19)13(2)24(12)15-4-5-16(20)17(21)9-15/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,23,25)	GMAQWFNOXAPALG-UHFFFAOYSA-N	Cc1cc(C=NNC(=O)CC2(C)OCCO2)c(C)n1c3ccc(Cl)c(Cl)c3	BroadT	BRD-K13185608	BRD-K13185608-001-06-2	Asinex Ltd.	BAS 01358275			Cc1cc(C=NNC(=O)CC2(C)OCCO2)c(C)n1-c1ccc(Cl)c(Cl)c1	InChI=1S/C19H21Cl2N3O3/c1-12-8-14(11-22-23-18(25)10-19(3)26-6-7-27-19)13(2)24(12)15-4-5-16(20)17(21)9-15/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,23,25)	GMAQWFNOXAPALG-UHFFFAOYSA-N	409.095996982							114463
N-(4-Dimethylamino-phenyl)-n'-propyl-oxalamide	LSM-25925	SID14725629, BRD-K86468448	3105218	InChI=1S/C13H19N3O2/c1-4-9-14-12(17)13(18)15-10-5-7-11(8-6-10)16(2)3/h5-8H,4,9H2,1-3H3,(H,14,17)(H,15,18)	CKCNMQMVCAITIF-UHFFFAOYSA-N	CCCNC(=O)C(=O)Nc1ccc(cc1)N(C)C	BroadT	BRD-K86468448	BRD-K86468448-001-05-0	Asinex Ltd.	BAS 00403001			CCCNC(=O)C(=O)Nc1ccc(cc1)N(C)C	InChI=1S/C13H19N3O2/c1-4-9-14-12(17)13(18)15-10-5-7-11(8-6-10)16(2)3/h5-8H,4,9H2,1-3H3,(H,14,17)(H,15,18)	CKCNMQMVCAITIF-UHFFFAOYSA-N	249.147726878							114464
5-Methyl-4-(1-methylethylidene)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one	LSM-25926	SID24813239, BRD-K89304620	4998861	InChI=1S/C13H14N2O/c1-9(2)12-10(3)14-15(13(12)16)11-7-5-4-6-8-11/h4-8H,1-3H3	ZSQBZSXNYJOIQD-UHFFFAOYSA-N	CC(=C1C(=NN(C1=O)c2ccccc2)C)C	BroadT	BRD-K89304620	BRD-K89304620-001-07-0	ChemDiv Inc.	1577-0005			CC(C)=C1C(C)=NN(C1=O)c1ccccc1	InChI=1S/C13H14N2O/c1-9(2)12-10(3)14-15(13(12)16)11-7-5-4-6-8-11/h4-8H,1-3H3	ZSQBZSXNYJOIQD-UHFFFAOYSA-N	214.110613088							114465
MLS000332788	LSM-44147	SID26662443, BRD-K07254242	1808828	InChI=1S/C17H20N2O4S/c1-18-16(20)15(24-17(18)21)9-11-8-14(23-3)12(10-13(11)22-2)19-6-4-5-7-19/h8-10H,4-7H2,1-3H3/b15-9-	XXLXNBVPIJNYMH-DHDCSXOGSA-N	COc1cc(N2CCCC2)c(OC)cc1\C=C\3/SC(=O)N(C)C3=O	BroadT	BRD-K07254242	BRD-K07254242-001-05-8	InterBioScreen Ltd.	STOCK4S-04836			COc1cc(N2CCCC2)c(OC)cc1\C=C1/SC(=O)N(C)C1=O	InChI=1S/C17H20N2O4S/c1-18-16(20)15(24-17(18)21)9-11-8-14(23-3)12(10-13(11)22-2)19-6-4-5-7-19/h8-10H,4-7H2,1-3H3/b15-9-	XXLXNBVPIJNYMH-DHDCSXOGSA-N	348.11437783							
(3,5-Diphenyl-4,5-dihydro-1H-pyrazol-1-yl)(4-hydroxy-3-methoxyphenyl)acetonitrile	LSM-25928	SID17414765, BRD-A84954848	2925826	InChI=1S/C24H21N3O2/c1-29-24-14-19(12-13-23(24)28)22(16-25)27-21(18-10-6-3-7-11-18)15-20(26-27)17-8-4-2-5-9-17/h2-14,21-22,28H,15H2,1H3	LDPSJDUBOPDQBV-UHFFFAOYSA-N	COc1cc(ccc1O)C(C#N)N2N=C(CC2c3ccccc3)c4ccccc4	BroadT	BRD-A84954848	BRD-A84954848-001-05-9	ChemBridge Corporation	7094832			COc1cc(ccc1O)C(C#N)N1N=C(CC1c1ccccc1)c1ccccc1	InChI=1S/C24H21N3O2/c1-29-24-14-19(12-13-23(24)28)22(16-25)27-21(18-10-6-3-7-11-18)15-20(26-27)17-8-4-2-5-9-17/h2-14,21-22,28H,15H2,1H3	LDPSJDUBOPDQBV-UHFFFAOYSA-N	383.163376942							114467
10E-302S	LSM-25929	SID24818492, BRD-K59561846	2764842	InChI=1S/C16H14N4O2/c1-11-4-2-5-12(8-11)15-10-18-19(16(15)17)13-6-3-7-14(9-13)20(21)22/h2-10H,17H2,1H3	WVDQHXSZISXARL-UHFFFAOYSA-N	Cc1cccc(c1)c2cnn(c2N)c3cccc(c3)[N+](=O)[O-]	BroadT	BRD-K59561846	BRD-K59561846-001-06-1	Key Organics Ltd.	10E-302S			Cc1cccc(c1)-c1cnn(c1N)-c1cccc(c1)[N+]([O-])=O	InChI=1S/C16H14N4O2/c1-11-4-2-5-12(8-11)15-10-18-19(16(15)17)13-6-3-7-14(9-13)20(21)22/h2-10H,17H2,1H3	WVDQHXSZISXARL-UHFFFAOYSA-N	294.111675728							114468
ST50197946	LSM-25930	SID24802585, BRD-K90314108	1192507	InChI=1S/C21H21N3O4S/c1-2-16-6-5-7-18(14-16)28-15-21(25)23-17-9-11-19(12-10-17)29(26,27)24-20-8-3-4-13-22-20/h3-14H,2,15H2,1H3,(H,22,24)(H,23,25)	MBUXEGUOLZAIGI-UHFFFAOYSA-N	CCc1cccc(OCC(=O)Nc2ccc(cc2)S(=O)(=O)Nc3ccccn3)c1	BroadT	BRD-K90314108	BRD-K90314108-001-05-1	ChemBridge Corporation	7490554			CCc1cccc(OCC(=O)Nc2ccc(cc2)S(=O)(=O)Nc2ccccn2)c1	InChI=1S/C21H21N3O4S/c1-2-16-6-5-7-18(14-16)28-15-21(25)23-17-9-11-19(12-10-17)29(26,27)24-20-8-3-4-13-22-20/h3-14H,2,15H2,1H3,(H,22,24)(H,23,25)	MBUXEGUOLZAIGI-UHFFFAOYSA-N	411.125276872							114469
8K-420S	LSM-25931	SID14729998, BRD-K76826745	3776081	InChI=1S/C15H11ClN2O/c1-10-6-7-18-13(9-17-14(18)8-10)15(19)11-2-4-12(16)5-3-11/h2-9H,1H3	CKXLDTVCXCLZQJ-UHFFFAOYSA-N	Cc1ccn2c(cnc2c1)C(=O)c3ccc(Cl)cc3	BroadT	BRD-K76826745	BRD-K76826745-001-05-1	Key Organics Ltd.	8K-420S			Cc1ccn2c(cnc2c1)C(=O)c1ccc(Cl)cc1	InChI=1S/C15H11ClN2O/c1-10-6-7-18-13(9-17-14(18)8-10)15(19)11-2-4-12(16)5-3-11/h2-9H,1H3	CKXLDTVCXCLZQJ-UHFFFAOYSA-N	270.055990702							114470
CHEMBL422471	LSM-25932	SID14723989, BRD-K63916899	744368	InChI=1S/C12H18N2/c1-13(2)9-10-14-8-7-11-5-3-4-6-12(11)14/h3-6H,7-10H2,1-2H3	BNAWSOWKSSIPGW-UHFFFAOYSA-N	CN(C)CCN1CCc2ccccc12	BroadT	BRD-K63916899	BRD-K63916899-001-05-9	Asinex Ltd.	BAS 02077966			CN(C)CCN1CCc2ccccc12	InChI=1S/C12H18N2/c1-13(2)9-10-14-8-7-11-5-3-4-6-12(11)14/h3-6H,7-10H2,1-2H3	BNAWSOWKSSIPGW-UHFFFAOYSA-N	190.146998596							114471
MLS000564604	LSM-25933	SID17508952, BRD-K22907015	829294	InChI=1S/C18H15NOS/c1-13-16(18(20)19-15-10-6-3-7-11-15)12-21-17(13)14-8-4-2-5-9-14/h2-12H,1H3,(H,19,20)	PRNOOINXYPYYPJ-UHFFFAOYSA-N	Cc1c(csc1c2ccccc2)C(=O)Nc3ccccc3	BroadT	BRD-K22907015	BRD-K22907015-001-06-5	Asinex Ltd.	BAS 01843286			Cc1c(csc1-c1ccccc1)C(=O)Nc1ccccc1	InChI=1S/C18H15NOS/c1-13-16(18(20)19-15-10-6-3-7-11-15)12-21-17(13)14-8-4-2-5-9-14/h2-12H,1H3,(H,19,20)	PRNOOINXYPYYPJ-UHFFFAOYSA-N	293.0874348							114472
T5424275	LSM-25934	SID3716347, BRD-A26257412	2999570	InChI=1S/C20H18N4O3/c1-2-20(15-8-4-3-5-9-15)18(26)24(19(27)23-20)13-17(25)22-16-10-6-7-14(11-16)12-21/h3-11H,2,13H2,1H3,(H,22,25)(H,23,27)	PTCRTFWZHXBYBR-UHFFFAOYSA-N	CCC1(NC(=O)N(CC(=O)Nc2cccc(c2)C#N)C1=O)c3ccccc3	BroadT	BRD-A26257412	BRD-A26257412-001-06-2	Enamine Ltd.	Z14071276			CCC1(NC(=O)N(CC(=O)Nc2cccc(c2)C#N)C1=O)c1ccccc1	InChI=1S/C20H18N4O3/c1-2-20(15-8-4-3-5-9-15)18(26)24(19(27)23-20)13-17(25)22-16-10-6-7-14(11-16)12-21/h3-11H,2,13H2,1H3,(H,22,25)(H,23,27)	PTCRTFWZHXBYBR-UHFFFAOYSA-N	362.137890476							114473
MLS000727636	LSM-15505	BRD-K98155297	6620919	InChI=1S/C19H36NO2/c1-20(15-11-12-16-20)17-19(21)22-18-13-9-7-5-3-2-4-6-8-10-14-18/h18H,2-17H2,1H3/q+1	AKGQWHSLZGLQQQ-UHFFFAOYSA-N	C[N+]1(CC(=O)OC2CCCCCCCCCCC2)CCCC1	BroadT	BRD-K98155297	BRD-K98155297-005-07-8	ChemDiv Inc.	6228-1207		I	C[N+]1(CC(=O)OC2CCCCCCCCCCC2)CCCC1.I	InChI=1S/C19H36NO2.HI/c1-20(15-11-12-16-20)17-19(21)22-18-13-9-7-5-3-2-4-6-8-10-14-18;/h18H,2-17H2,1H3;1H/q+1;	CIXAWHMSQKFPLZ-UHFFFAOYSA-N	310.274604402							104146, 104146
MLS000036761	LSM-25935	SID50102623, SID859778, BRD-K40032296	661080	InChI=1S/C17H21N5O/c1-13(2)23-10-6-9-18-16-15-11-21-22(17(15)20-12-19-16)14-7-4-3-5-8-14/h3-5,7-8,11-13H,6,9-10H2,1-2H3,(H,18,19,20)	MOSZDNKNHYZIFJ-UHFFFAOYSA-N	CC(C)OCCCNc1ncnc2c1cnn2c3ccccc3	BroadT	BRD-K40032296	BRD-K40032296-001-05-2	InterBioScreen Ltd.	STOCK3S-33572			CC(C)OCCCNc1ncnc2n(ncc12)-c1ccccc1	InChI=1S/C17H21N5O/c1-13(2)23-10-6-9-18-16-15-11-21-22(17(15)20-12-19-16)14-7-4-3-5-8-14/h3-5,7-8,11-13H,6,9-10H2,1-2H3,(H,18,19,20)	MOSZDNKNHYZIFJ-UHFFFAOYSA-N	311.174610342							114474
AC1MJJLZ	LSM-25936	SID47202451, BRD-K82867190	54684115	InChI=1S/C21H23N3O3/c1-2-3-8-13-24-17-12-7-4-9-14(17)19(25)18(21(24)27)20(26)23-16-11-6-5-10-15(16)22/h4-7,9-12,25H,2-3,8,13,22H2,1H3,(H,23,26)	IXSBSIHHWMKKLI-UHFFFAOYSA-N	CCCCCN1C(=O)C(=C(O)c2ccccc12)C(=O)Nc3ccccc3N	BroadT	BRD-K82867190	BRD-K82867190-001-05-7	Asinex Ltd.	BAS 00141358			CCCCCn1c2ccccc2c(O)c(C(=O)Nc2ccccc2N)c1=O	InChI=1S/C21H23N3O3/c1-2-3-8-13-24-17-12-7-4-9-14(17)19(25)18(21(24)27)20(26)23-16-11-6-5-10-15(16)22/h4-7,9-12,25H,2-3,8,13,22H2,1H3,(H,23,26)	IXSBSIHHWMKKLI-UHFFFAOYSA-N	365.173941626							114475
MLS000559005	LSM-25937	SID14742641, BRD-K19429700	1966581	InChI=1S/C22H21N3O2S/c1-24-16-11-6-5-10-15(16)19(26)18-21(24)23-20(17-12-7-13-28-17)25(22(18)27)14-8-3-2-4-9-14/h5-7,10-14H,2-4,8-9H2,1H3	XDHZYRUJBAUNQU-UHFFFAOYSA-N	CN1C2=C(C(=O)N(C3CCCCC3)C(=N2)c4cccs4)C(=O)c5ccccc15	BroadT	BRD-K19429700	BRD-K19429700-001-06-5	InterBioScreen Ltd.	STOCK5S-56462			Cn1c2ccccc2c(=O)c2c1nc(-c1cccs1)n(C1CCCCC1)c2=O	InChI=1S/C22H21N3O2S/c1-24-16-11-6-5-10-15(16)19(26)18-21(24)23-20(17-12-7-13-28-17)25(22(18)27)14-8-3-2-4-9-14/h5-7,10-14H,2-4,8-9H2,1H3	XDHZYRUJBAUNQU-UHFFFAOYSA-N	391.135447632							114476
MLS000683580	LSM-25938	SID24780508, BRD-K98983552	16187390	InChI=1S/C26H36N4OS/c1-3-29-11-5-7-23-19-22(9-10-25(23)29)20-30(13-12-28-14-16-31-17-15-28)26(32)27-24-8-4-6-21(2)18-24/h4,6,8-10,18-19H,3,5,7,11-17,20H2,1-2H3,(H,27,32)	RRENLRDKBVITHW-UHFFFAOYSA-N	CCN1CCCc2cc(CN(CCN3CCOCC3)C(=Nc4cccc(C)c4)S)ccc12	BroadT	BRD-K98983552	BRD-K98983552-001-06-4	ChemDiv Inc.	K788-3581			CCN1CCCc2cc(CN(CCN3CCOCC3)C(S)=Nc3cccc(C)c3)ccc12	InChI=1S/C26H36N4OS/c1-3-29-11-5-7-23-19-22(9-10-25(23)29)20-30(13-12-28-14-16-31-17-15-28)26(32)27-24-8-4-6-21(2)18-24/h4,6,8-10,18-19H,3,5,7,11-17,20H2,1-2H3,(H,27,32)	RRENLRDKBVITHW-UHFFFAOYSA-N	452.260982502							114477
SMR000021670	LSM-25939	SID24839248, SID4244123, BRD-K42873364	3238765	InChI=1S/C24H33N3O4/c1-4-25-16-20(18-14-21(30-2)22(31-3)15-19(18)23(25)28)24(29)27-12-10-26(11-13-27)17-8-6-5-7-9-17/h14-17H,4-13H2,1-3H3	WCADNCMCYOUSPD-UHFFFAOYSA-N	CCN1C=C(C(=O)N2CCN(CC2)C3CCCCC3)c4cc(OC)c(OC)cc4C1=O	BroadT	BRD-K42873364	BRD-K42873364-001-05-4	ChemDiv Inc.	C066-1353			CCn1cc(C(=O)N2CCN(CC2)C2CCCCC2)c2cc(OC)c(OC)cc2c1=O	InChI=1S/C24H33N3O4/c1-4-25-16-20(18-14-21(30-2)22(31-3)15-19(18)23(25)28)24(29)27-12-10-26(11-13-27)17-8-6-5-7-9-17/h14-17H,4-13H2,1-3H3	WCADNCMCYOUSPD-UHFFFAOYSA-N	427.247106566							114478
STK226209	LSM-25940	SID24781894, BRD-K21775175	1289618	InChI=1S/C13H14N2OS2/c1-8-4-5-9(2)11(6-8)12(16)7-17-13-15-14-10(3)18-13/h4-6H,7H2,1-3H3	QSDZQYFLMUTYCK-UHFFFAOYSA-N	Cc1ccc(C)c(c1)C(=O)CSc2nnc(C)s2	BroadT	BRD-K21775175	BRD-K21775175-001-05-5	ChemBridge Corporation	7907195			Cc1nnc(SCC(=O)c2cc(C)ccc2C)s1	InChI=1S/C13H14N2OS2/c1-8-4-5-9(2)11(6-8)12(16)7-17-13-15-14-10(3)18-13/h4-6H,7H2,1-3H3	QSDZQYFLMUTYCK-UHFFFAOYSA-N	278.054754468							114479
6-(4-Hydroxyphenyl)-5-(4-methoxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione	LSM-25941	SID26663248, BRD-K30138610	2011795	InChI=1S/C21H19N3O4/c1-22-17-12-24(14-6-8-15(25)9-7-14)19(13-4-10-16(28-3)11-5-13)18(17)20(26)23(2)21(22)27/h4-12,25H,1-3H3	HBUWUGZQHJWVFA-UHFFFAOYSA-N	COc1ccc(cc1)c2c3C(=O)N(C)C(=O)N(C)c3cn2c4ccc(O)cc4	BroadT	BRD-K30138610	BRD-K30138610-001-06-6	InterBioScreen Ltd.	STOCK4S-47589			COc1ccc(cc1)-c1n(cc2n(C)c(=O)n(C)c(=O)c12)-c1ccc(O)cc1	InChI=1S/C21H19N3O4/c1-22-17-12-24(14-6-8-15(25)9-7-14)19(13-4-10-16(28-3)11-5-13)18(17)20(26)23(2)21(22)27/h4-12,25H,1-3H3	HBUWUGZQHJWVFA-UHFFFAOYSA-N	377.137556118							114480
T5511207	LSM-25942	SID49673087, BRD-K57769329	16280550	InChI=1S/C11H10Cl2N2S/c1-15-5-4-14-11(15)16-7-8-2-3-9(12)6-10(8)13/h2-6H,7H2,1H3	KJQJXALEDMTJBP-UHFFFAOYSA-N	Cn1ccnc1SCc2ccc(Cl)cc2Cl	BroadT	BRD-K57769329	BRD-K57769329-001-05-0	Enamine Ltd.	T5511207			Cn1ccnc1SCc1ccc(Cl)cc1Cl	InChI=1S/C11H10Cl2N2S/c1-15-5-4-14-11(15)16-7-8-2-3-9(12)6-10(8)13/h2-6H,7H2,1H3	KJQJXALEDMTJBP-UHFFFAOYSA-N	271.99417445							114481
MLS000332851	LSM-25943	SID26659857, BRD-K94025172	4315907	InChI=1S/C17H24N6O4/c1-10(2)7-8-19-17-21-15(18)14(23(24)25)16(22-17)20-12-9-11(26-3)5-6-13(12)27-4/h5-6,9-10H,7-8H2,1-4H3,(H4,18,19,20,21,22)	HTXRVZKYSPGFDM-UHFFFAOYSA-N	COc1ccc(OC)c(Nc2nc(NCCC(C)C)nc(N)c2[N+](=O)[O-])c1	BroadT	BRD-K94025172	BRD-K94025172-001-07-6	InterBioScreen Ltd.	STOCK4S-65380			COc1ccc(OC)c(Nc2nc(NCCC(C)C)nc(N)c2[N+]([O-])=O)c1	InChI=1S/C17H24N6O4/c1-10(2)7-8-19-17-21-15(18)14(23(24)25)16(22-17)20-12-9-11(26-3)5-6-13(12)27-4/h5-6,9-10H,7-8H2,1-4H3,(H4,18,19,20,21,22)	HTXRVZKYSPGFDM-UHFFFAOYSA-N	376.185903308							114482
T5291606	LSM-44148	SID22409366, BRD-K52527039	6216128	InChI=1S/C23H21ClFN3O6S2/c24-17-4-1-15(2-5-17)13-19-22(30)28(23(31)35-19)8-7-26-21(29)16-3-6-18(25)20(14-16)36(32,33)27-9-11-34-12-10-27/h1-6,13-14H,7-12H2,(H,26,29)/b19-13-	PQZUCIXTZWKEEW-UYRXBGFRSA-N	Fc1ccc(cc1S(=O)(=O)N2CCOCC2)C(=O)NCCN3C(=O)S\C(=C/c4ccc(Cl)cc4)\C3=O	BroadT	BRD-K52527039	BRD-K52527039-001-05-8	Enamine Ltd.	T5291606			Fc1ccc(cc1S(=O)(=O)N1CCOCC1)C(=O)NCCN1C(=O)S\C(=C/c2ccc(Cl)cc2)C1=O	InChI=1S/C23H21ClFN3O6S2/c24-17-4-1-15(2-5-17)13-19-22(30)28(23(31)35-19)8-7-26-21(29)16-3-6-18(25)20(14-16)36(32,33)27-9-11-34-12-10-27/h1-6,13-14H,7-12H2,(H,26,29)/b19-13-	PQZUCIXTZWKEEW-UYRXBGFRSA-N	553.054432712							
SMR000314439	LSM-25945	SID24790018, BRD-A11930354	4311300	InChI=1S/C18H19ClN6O4S3/c1-7-12(19)8(2)24(23-7)4-11(26)20-13-15(27)25-14(17(28)29)10(5-30-16(13)25)6-31-18-22-21-9(3)32-18/h13,16H,4-6H2,1-3H3,(H,20,26)(H,28,29)	UYNAOHKTVNWMQR-UHFFFAOYSA-N	Cc1nnc(SCC2=C(N3C(SC2)C(NC(=O)Cn4nc(C)c(Cl)c4C)C3=O)C(=O)O)s1	BroadT	BRD-A11930354	BRD-A11930354-001-06-1	ChemDiv Inc.	D052-0025			Cc1nnc(SCC2=C(N3C(SC2)C(NC(=O)Cn2nc(C)c(Cl)c2C)C3=O)C(O)=O)s1	InChI=1S/C18H19ClN6O4S3/c1-7-12(19)8(2)24(23-7)4-11(26)20-13-15(27)25-14(17(28)29)10(5-30-16(13)25)6-31-18-22-21-9(3)32-18/h13,16H,4-6H2,1-3H3,(H,20,26)(H,28,29)	UYNAOHKTVNWMQR-UHFFFAOYSA-N	514.031842928							114484
F2532-0342	LSM-25946	SID17515533, BRD-K34265805	12006065	InChI=1S/C20H17N3O5S2/c1-11-2-4-13(5-3-11)18(26)28-16-9-27-14(8-15(16)24)10-29-20-23-22-19(30-20)21-17(25)12-6-7-12/h2-5,8-9,12H,6-7,10H2,1H3,(H,21,22,25)	NHDDLLUQIKTIAC-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)OC2=COC(=CC2=O)CSc3nnc(NC(=O)C4CC4)s3	BroadT	BRD-K34265805	BRD-K34265805-001-05-0	Life Chemicals Inc.	F2532-0342			Cc1ccc(cc1)C(=O)Oc1coc(CSc2nnc(NC(=O)C3CC3)s2)cc1=O	InChI=1S/C20H17N3O5S2/c1-11-2-4-13(5-3-11)18(26)28-16-9-27-14(8-15(16)24)10-29-20-23-22-19(30-20)21-17(25)12-6-7-12/h2-5,8-9,12H,6-7,10H2,1H3,(H,21,22,25)	NHDDLLUQIKTIAC-UHFFFAOYSA-N	443.060962054							114485
AK-968/41923171	LSM-25947	SID847566, BRD-K63560610	649971	InChI=1S/C8H8N4S/c1-9-8-12-11-7(13-8)6-2-4-10-5-3-6/h2-5H,1H3,(H,9,12)	WGYVCDAYEBIDET-UHFFFAOYSA-N	CNc1nnc(s1)c2ccncc2	BroadT	BRD-K63560610	BRD-K63560610-001-05-3	Asinex Ltd.	BAS 09627175			CNc1nnc(s1)-c1ccncc1	InChI=1S/C8H8N4S/c1-9-8-12-11-7(13-8)6-2-4-10-5-3-6/h2-5H,1H3,(H,9,12)	WGYVCDAYEBIDET-UHFFFAOYSA-N	192.046966986							114486
F2507-0056	LSM-25948	SID24815999, BRD-K36610285	16194808	InChI=1S/C15H11N5OS/c1-2-8-16-11(4-1)10-22-15-18-17-14-7-6-12(19-20(14)15)13-5-3-9-21-13/h1-9H,10H2	KPOMJXQJKJLSIZ-UHFFFAOYSA-N	C(Sc1nnc2ccc(nn12)c3occc3)c4ccccn4	BroadT	BRD-K36610285	BRD-K36610285-001-05-4	Life Chemicals Inc.	F2507-0056			C(Sc1nnc2ccc(nn12)-c1ccco1)c1ccccn1	InChI=1S/C15H11N5OS/c1-2-8-16-11(4-1)10-22-15-18-17-14-7-6-12(19-20(14)15)13-5-3-9-21-13/h1-9H,10H2	KPOMJXQJKJLSIZ-UHFFFAOYSA-N	309.068430712							114487
AK-968/41924597	LSM-25949	SID17387273, BRD-K52885700	843897	InChI=1S/C16H17N3S2/c1-10(2)14-8-12(9-21-14)15-17-18-16(20)19(15)13-6-4-5-11(3)7-13/h4-10H,1-3H3,(H,18,20)	JMYWQTYBHNGTSJ-UHFFFAOYSA-N	CC(C)c1cc(cs1)c2nnc(S)n2c3cccc(C)c3	BroadT	BRD-K52885700	BRD-K52885700-001-05-8	Specs	AK-968/41924597			CC(C)c1cc(cs1)-c1nnc(S)n1-c1cccc(C)c1	InChI=1S/C16H17N3S2/c1-10(2)14-8-12(9-21-14)15-17-18-16(20)19(15)13-6-4-5-11(3)7-13/h4-10H,1-3H3,(H,18,20)	JMYWQTYBHNGTSJ-UHFFFAOYSA-N	315.086388954							114488
N-(2-Chloropyridin-3-yl)-3-oxo-3-phenylpropanamide	LSM-25950	SID17509291, BRD-K27802570	3435083	InChI=1S/C14H11ClN2O2/c15-14-11(7-4-8-16-14)17-13(19)9-12(18)10-5-2-1-3-6-10/h1-8H,9H2,(H,17,19)	ICWPONHJHUMSHE-UHFFFAOYSA-N	Clc1ncccc1NC(=O)CC(=O)c2ccccc2	BroadT	BRD-K27802570	BRD-K27802570-001-06-0	ChemDiv Inc.	K040-0025			Clc1ncccc1NC(=O)CC(=O)c1ccccc1	InChI=1S/C14H11ClN2O2/c15-14-11(7-4-8-16-14)17-13(19)9-12(18)10-5-2-1-3-6-10/h1-8H,9H2,(H,17,19)	ICWPONHJHUMSHE-UHFFFAOYSA-N	274.050905322							114489
MLS000535934	LSM-25951	SID16953202, BRD-A95363369	4832639	InChI=1S/C23H24N4O3S/c1-2-3-14-30-22(29)16-8-10-17(11-9-16)25-21(28)15-31-23-26-19-7-5-4-6-18(19)20-12-13-24-27(20)23/h4-11,13,20H,2-3,12,14-15H2,1H3,(H,25,28)	LIUBRVKLSBHUPW-UHFFFAOYSA-N	CCCCOC(=O)c1ccc(NC(=O)CSC2=Nc3ccccc3C4CC=NN24)cc1	BroadT	BRD-A95363369	BRD-A95363369-001-05-9	Enamine Ltd.	T5297412			CCCCOC(=O)c1ccc(NC(=O)CSC2=Nc3ccccc3C3CC=NN23)cc1	InChI=1S/C23H24N4O3S/c1-2-3-14-30-22(29)16-8-10-17(11-9-16)25-21(28)15-31-23-26-19-7-5-4-6-18(19)20-12-13-24-27(20)23/h4-11,13,20H,2-3,12,14-15H2,1H3,(H,25,28)	LIUBRVKLSBHUPW-UHFFFAOYSA-N	436.156911358							114490
F1011-1375	LSM-25952	SID7969871, BRD-A56159527	3254253	InChI=1S/C19H19N3O2/c1-12-8-6-7-11-15(12)21-18(23)16-13(2)20-19(24)22-17(16)14-9-4-3-5-10-14/h3-11,17H,1-2H3,(H,21,23)(H2,20,22,24)	YAWCLLSUJNYNCX-UHFFFAOYSA-N	CC1=C(C(NC(=O)N1)c2ccccc2)C(=O)Nc3ccccc3C	BroadT	BRD-A56159527	BRD-A56159527-001-04-0	Life Chemicals Inc.	F1011-1375			Cc1ccccc1NC(=O)C1=C(C)NC(=O)NC1c1ccccc1	InChI=1S/C19H19N3O2/c1-12-8-6-7-11-15(12)21-18(23)16-13(2)20-19(24)22-17(16)14-9-4-3-5-10-14/h3-11,17H,1-2H3,(H,21,23)(H2,20,22,24)	YAWCLLSUJNYNCX-UHFFFAOYSA-N	321.147726878							114491
MLS000532893	LSM-44149	SID14731854, BRD-K85470517	868964	InChI=1S/C13H12N2O2/c1-10-9-12(15-17-10)14-13(16)8-7-11-5-3-2-4-6-11/h2-9H,1H3,(H,14,15,16)/b8-7+	HKHMRZZOMKKLQF-BQYQJAHWSA-N	Cc1onc(NC(=O)\C=C\c2ccccc2)c1	BroadT	BRD-K85470517	BRD-K85470517-001-05-3	ChemBridge Corporation	5703178			Cc1cc(NC(=O)\C=C\c2ccccc2)no1	InChI=1S/C13H12N2O2/c1-10-9-12(15-17-10)14-13(16)8-7-11-5-3-2-4-6-11/h2-9H,1H3,(H,14,15,16)/b8-7+	HKHMRZZOMKKLQF-BQYQJAHWSA-N	228.089877644							
BRD-A33738668	LSM-25954			InChI=1S/C27H30N4O5/c1-17-20(16-28-31(17)18-10-7-6-8-11-18)24(32)22-23(19-12-9-13-21(35-4)26(19)36-5)30(15-14-29(2)3)27(34)25(22)33/h6-13,16,22-23H,14-15H2,1-5H3	AHYRKIWIZBGYHX-UHFFFAOYSA-N	COc1cccc(C2C(C(=O)c3cnn(c3C)c4ccccc4)C(=O)C(=O)N2CCN(C)C)c1OC	BroadT	BRD-A33738668	BRD-A33738668-001-05-5	InterBioScreen Ltd.	STOCK3S-36152			COc1cccc(C2C(C(=O)c3cnn(c3C)-c3ccccc3)C(=O)C(=O)N2CCN(C)C)c1OC	InChI=1S/C27H30N4O5/c1-17-20(16-28-31(17)18-10-7-6-8-11-18)24(32)22-23(19-12-9-13-21(35-4)26(19)36-5)30(15-14-29(2)3)27(34)25(22)33/h6-13,16,22-23H,14-15H2,1-5H3	AHYRKIWIZBGYHX-UHFFFAOYSA-N	490.2216201							114493
F3275-0051	LSM-15561	BRD-A22060346	4547473	InChI=1S/C21H30N2O/c1-15-10-11-21-19(12-15)18-8-4-5-9-20(18)23(21)14-17(24)13-22-16-6-2-3-7-16/h10-12,16-17,22,24H,2-9,13-14H2,1H3	YHFMRGNKMZMGKL-UHFFFAOYSA-N	Cc1ccc2c(c1)c3CCCCc3n2CC(O)CNC4CCCC4	BroadT	BRD-A22060346	BRD-A22060346-034-05-8	ChemDiv Inc.	6658-0035		OC(=O)C(=O)O	Cc1ccc2n(CC(O)CNC3CCCC3)c3CCCCc3c2c1.OC(=O)C(=O)O	InChI=1S/C21H30N2O.C2H2O4/c1-15-10-11-21-19(12-15)18-8-4-5-9-20(18)23(21)14-17(24)13-22-16-6-2-3-7-16;3-1(4)2(5)6/h10-12,16-17,22,24H,2-9,13-14H2,1H3;(H,3,4)(H,5,6)	STHKERSTWXSVOX-UHFFFAOYSA-N	326.2358136							104197, 104197
MLS000087801	LSM-25955	SID4245122, BRD-A61141482	3239626	InChI=1S/C21H24N2O/c1-3-13-22(14-4-2)15-17(24)16-23-20-11-7-5-9-18(20)19-10-6-8-12-21(19)23/h3-12,17,24H,1-2,13-16H2	ZGXCULSRUGPOMX-UHFFFAOYSA-N	OC(CN(CC=C)CC=C)Cn1c2ccccc2c3ccccc13	BroadT	BRD-A61141482	BRD-A61141482-001-06-9	ChemDiv Inc.	2839-0024			OC(CN(CC=C)CC=C)Cn1c2ccccc2c2ccccc12	InChI=1S/C21H24N2O/c1-3-13-22(14-4-2)15-17(24)16-23-20-11-7-5-9-18(20)19-10-6-8-12-21(19)23/h3-12,17,24H,1-2,13-16H2	ZGXCULSRUGPOMX-UHFFFAOYSA-N	320.188863408							114494
AC1OA5UL	LSM-25956	BRD-K86948160	6799482	InChI=1S/C16H11BrClFN2O/c17-11-5-6-12-14(15(11)18)16(22)13(21-12)8-20-7-9-1-3-10(19)4-2-9/h1-6,8,21-22H,7H2	KEKAYJQYDICWPA-UHFFFAOYSA-N	Oc1c(C=NCc2ccc(F)cc2)[nH]c3ccc(Br)c(Cl)c13	BroadT	BRD-K86948160	BRD-K86948160-001-04-0	ChemBridge Corporation	5483545			Oc1c(C=NCc2ccc(F)cc2)[nH]c2ccc(Br)c(Cl)c12	InChI=1S/C16H11BrClFN2O/c17-11-5-6-12-14(15(11)18)16(22)13(21-12)8-20-7-9-1-3-10(19)4-2-9/h1-6,8,21-22H,7H2	KEKAYJQYDICWPA-UHFFFAOYSA-N	379.972731502							
AC1MWOPN	LSM-25957	SID24819237, BRD-K28338890	3777570	InChI=1S/C16H13Cl2N5O3S/c17-11-6-7-14(13(18)8-11)27(24,25)22-15(19)9-26-16-20-10-23(21-16)12-4-2-1-3-5-12/h1-8,10H,9H2,(H2,19,22)	ITQAUMPSDDREDA-UHFFFAOYSA-N	Clc1ccc(c(Cl)c1)S(=O)(=O)NC(=N)COc2ncn(n2)c3ccccc3	BroadT	BRD-K28338890	BRD-K28338890-001-05-9	Key Organics Ltd.	3F-052			Clc1ccc(c(Cl)c1)S(=O)(=O)NC(=N)COc1ncn(n1)-c1ccccc1	InChI=1S/C16H13Cl2N5O3S/c17-11-6-7-14(13(18)8-11)27(24,25)22-15(19)9-26-16-20-10-23(21-16)12-4-2-1-3-5-12/h1-8,10H,9H2,(H2,19,22)	ITQAUMPSDDREDA-UHFFFAOYSA-N	425.011615436							114496
AC1O9U68	LSM-25958	SID860687, BRD-K71138416	6772464	InChI=1S/C25H24N4O/c30-23-13-7-5-11-21(23)24-26-22-12-6-4-10-20(22)25(27-24)29-16-14-28(15-17-29)18-19-8-2-1-3-9-19/h1-13,30H,14-18H2	XVVUHZORNXTAFG-UHFFFAOYSA-N	Oc1ccccc1c2nc(N3CCN(Cc4ccccc4)CC3)c5ccccc5n2	BroadT	BRD-K71138416	BRD-K71138416-001-05-4	InterBioScreen Ltd.	STOCK3S-88529			Oc1ccccc1-c1nc(N2CCN(Cc3ccccc3)CC2)c2ccccc2n1	InChI=1S/C25H24N4O/c30-23-13-7-5-11-21(23)24-26-22-12-6-4-10-20(22)25(27-24)29-16-14-28(15-17-29)18-19-8-2-1-3-9-19/h1-13,30H,14-18H2	XVVUHZORNXTAFG-UHFFFAOYSA-N	396.195011428							
BAS 09530051	LSM-25959	SID14727233, BRD-K40158731	1093845	InChI=1S/C19H15Cl2N3O4/c20-12-3-4-13(14(21)10-12)17-11-15(22-28-17)18(25)23-5-7-24(8-6-23)19(26)16-2-1-9-27-16/h1-4,9-11H,5-8H2	SZROVVQEPDFVPN-UHFFFAOYSA-N	Clc1ccc(c(Cl)c1)c2onc(c2)C(=O)N3CCN(CC3)C(=O)c4occc4	BroadT	BRD-K40158731	BRD-K40158731-001-05-8	Asinex Ltd.	BAS 09530051			Clc1ccc(-c2cc(no2)C(=O)N2CCN(CC2)C(=O)c2ccco2)c(Cl)c1	InChI=1S/C19H15Cl2N3O4/c20-12-3-4-13(14(21)10-12)17-11-15(22-28-17)18(25)23-5-7-24(8-6-23)19(26)16-2-1-9-27-16/h1-4,9-11H,5-8H2	SZROVVQEPDFVPN-UHFFFAOYSA-N	419.04396141							114498
F1174-1718	LSM-25960	SID3713981, BRD-K83659333	704116	InChI=1S/C15H15N3OS/c1-9-17-14(16-8-10-4-3-7-19-10)13-11-5-2-6-12(11)20-15(13)18-9/h3-4,7H,2,5-6,8H2,1H3,(H,16,17,18)	VWSFKHFDPRSPLA-UHFFFAOYSA-N	Cc1nc(NCc2occc2)c3c4CCCc4sc3n1	BroadT	BRD-K83659333	BRD-K83659333-001-05-5	Enamine Ltd.	T0512-6477			Cc1nc(NCc2ccco2)c2c3CCCc3sc2n1	InChI=1S/C15H15N3OS/c1-9-17-14(16-8-10-4-3-7-19-10)13-11-5-2-6-12(11)20-15(13)18-9/h3-4,7H,2,5-6,8H2,1H3,(H,16,17,18)	VWSFKHFDPRSPLA-UHFFFAOYSA-N	285.09358282							114499
MLS000046797	LSM-25961	SID4248524, BRD-K85658753	3242591	InChI=1S/C20H24FN3O/c1-15-4-9-19(12-16(15)2)22-20(25)24-11-3-10-23(14-24)13-17-5-7-18(21)8-6-17/h4-9,12H,3,10-11,13-14H2,1-2H3,(H,22,25)	BNDNQOBIHDSIDO-UHFFFAOYSA-N	Cc1ccc(NC(=O)N2CCCN(Cc3ccc(F)cc3)C2)cc1C	BroadT	BRD-K85658753	BRD-K85658753-001-05-6	ChemDiv Inc.	K788-5108			Cc1ccc(NC(=O)N2CCCN(Cc3ccc(F)cc3)C2)cc1C	InChI=1S/C20H24FN3O/c1-15-4-9-19(12-16(15)2)22-20(25)24-11-3-10-23(14-24)13-17-5-7-18(21)8-6-17/h4-9,12H,3,10-11,13-14H2,1-2H3,(H,22,25)	BNDNQOBIHDSIDO-UHFFFAOYSA-N	341.190340618							114500
HMS2543C24	LSM-25962	BRD-K90658144	15944734	InChI=1S/C19H18N4O2/c1-13(14-8-10-16(25-2)11-9-14)22-23-19-20-17(12-18(24)21-19)15-6-4-3-5-7-15/h3-12H,1-2H3,(H2,20,21,23,24)	VPCMZQHQQJKAHI-UHFFFAOYSA-N	COc1ccc(cc1)C(=NNc2nc(O)cc(n2)c3ccccc3)C	BroadT	BRD-K90658144	BRD-K90658144-001-05-7	Specs	AE-848/32727018			COc1ccc(cc1)C(C)=NNc1nc(O)cc(n1)-c1ccccc1	InChI=1S/C19H18N4O2/c1-13(14-8-10-16(25-2)11-9-14)22-23-19-20-17(12-18(24)21-19)15-6-4-3-5-7-15/h3-12H,1-2H3,(H2,20,21,23,24)	VPCMZQHQQJKAHI-UHFFFAOYSA-N	334.142975856							114501
Rutarensin	LSM-25963	SID24841418, SID17413073, BRD-A60657908	11958880	InChI=1S/C31H30O16/c1-31(40,11-23(32)33)12-25(35)42-13-22-26(36)27(37)28(38)30(47-22)46-20-10-18-15(7-19(20)41-2)8-21(29(39)45-18)43-16-5-3-14-4-6-24(34)44-17(14)9-16/h3-10,22,26-28,30,36-38,40H,11-13H2,1-2H3,(H,32,33)	ZTLZGWDERZVHNS-UHFFFAOYSA-N	COc1cc2C=C(Oc3ccc4C=CC(=O)Oc4c3)C(=O)Oc2cc1OC5OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C5O	BroadT	BRD-A60657908	BRD-A60657908-001-05-3	AnalytiCon Discovery GmbH	NP-002398			COc1cc2cc(Oc3ccc4ccc(=O)oc4c3)c(=O)oc2cc1OC1OC(COC(=O)CC(C)(O)CC(O)=O)C(O)C(O)C1O	InChI=1S/C31H30O16/c1-31(40,11-23(32)33)12-25(35)42-13-22-26(36)27(37)28(38)30(47-22)46-20-10-18-15(7-19(20)41-2)8-21(29(39)45-18)43-16-5-3-14-4-6-24(34)44-17(14)9-16/h3-10,22,26-28,30,36-38,40H,11-13H2,1-2H3,(H,32,33)	ZTLZGWDERZVHNS-UHFFFAOYSA-N	658.15338488							114502
MLS000762436	LSM-25964	SID26663124, BRD-A68777930	5022919	InChI=1S/C26H25N3O4/c1-31-20-11-9-17(14-21(20)32-2)22-19-10-8-16-6-3-4-7-18(16)24(19)33-26-23(22)25(27)29(15-28-26)12-5-13-30/h3-4,6-11,14-15,22,27,30H,5,12-13H2,1-2H3	KBSZBAOBMABSQV-UHFFFAOYSA-N	COc1ccc(cc1OC)C2C3=C(Oc4c2ccc5ccccc45)N=CN(CCCO)C3=N	BroadT	BRD-A68777930	BRD-A68777930-001-05-3	InterBioScreen Ltd.	STOCK4S-78696			COc1ccc(cc1OC)C1c2ccc3ccccc3c2Oc2ncn(CCCO)c(=N)c12	InChI=1S/C26H25N3O4/c1-31-20-11-9-17(14-21(20)32-2)22-19-10-8-16-6-3-4-7-18(16)24(19)33-26-23(22)25(27)29(15-28-26)12-5-13-30/h3-4,6-11,14-15,22,27,30H,5,12-13H2,1-2H3	KBSZBAOBMABSQV-UHFFFAOYSA-N	443.18450631							114503
MLS000757167	LSM-25965	SID26664981, BRD-K08654649	344075	InChI=1S/C19H14O2/c20-18-12-10-15(11-13-18)14-6-8-17(9-7-14)19(21)16-4-2-1-3-5-16/h1-13,20H	IURCXIQRULDEEY-UHFFFAOYSA-N	Oc1ccc(cc1)c2ccc(cc2)C(=O)c3ccccc3	BroadT	BRD-K08654649	BRD-K08654649-001-05-7	National Cancer Institute Chemotherapeutic Agents Repository	400770			Oc1ccc(cc1)-c1ccc(cc1)C(=O)c1ccccc1	InChI=1S/C19H14O2/c20-18-12-10-15(11-13-18)14-6-8-17(9-7-14)19(21)16-4-2-1-3-5-16/h1-13,20H	IURCXIQRULDEEY-UHFFFAOYSA-N	274.099379688							114504
ZINC02645027	LSM-25966	SID24832817, BRD-K80680312	2108008	InChI=1S/C14H10ClFN4O2/c15-9-1-6-12-13(7-9)20(19-18-12)22-8-14(21)17-11-4-2-10(16)3-5-11/h1-7H,8H2,(H,17,21)	VTLWDCDAVLVOHR-UHFFFAOYSA-N	Fc1ccc(NC(=O)COn2nnc3ccc(Cl)cc23)cc1	BroadT	BRD-K80680312	BRD-K80680312-001-05-9	Enamine Ltd.	T5238846			Fc1ccc(NC(=O)COn2nnc3ccc(Cl)cc23)cc1	InChI=1S/C14H10ClFN4O2/c15-9-1-6-12-13(7-9)20(19-18-12)22-8-14(21)17-11-4-2-10(16)3-5-11/h1-7H,8H2,(H,17,21)	VTLWDCDAVLVOHR-UHFFFAOYSA-N	320.04763151							114505
MLS000675733	LSM-25967	SID24796758, BRD-K65829502	848081	InChI=1S/C18H17NO2/c1-4-19-11(2)9-13(12(19)3)10-16-17(20)14-7-5-6-8-15(14)18(16)21/h5-10H,4H2,1-3H3	UMIPDSYINQNGJY-UHFFFAOYSA-N	CCn1c(C)cc(C=C2C(=O)c3ccccc3C2=O)c1C	BroadT	BRD-K65829502	BRD-K65829502-001-04-4	ChemBridge Corporation	7384807			CCn1c(C)cc(C=C2C(=O)c3ccccc3C2=O)c1C	InChI=1S/C18H17NO2/c1-4-19-11(2)9-13(12(19)3)10-16-17(20)14-7-5-6-8-15(14)18(16)21/h5-10H,4H2,1-3H3	UMIPDSYINQNGJY-UHFFFAOYSA-N	279.125928794							114506
Graveoline	LSM-4078	Graveoline	353825	InChI=1S/C17H13NO3/c1-18-13-5-3-2-4-12(13)15(19)9-14(18)11-6-7-16-17(8-11)21-10-20-16/h2-9H,10H2,1H3	COBBNRKBTCBWQP-UHFFFAOYSA-N	CN1C(=CC(=O)c2ccccc12)c3ccc4OCOc4c3	BroadT	BRD-K92683369	BRD-K92683369-001-07-7	InterBioScreen Ltd.	STOCK1N-10299			Cn1c(cc(=O)c2ccccc12)-c1ccc2OCOc2c1	InChI=1S/C17H13NO3/c1-18-13-5-3-2-4-12(13)15(19)9-14(18)11-6-7-16-17(8-11)21-10-20-16/h2-9H,10H2,1H3	COBBNRKBTCBWQP-UHFFFAOYSA-N	279.089543286							5541
AC1LLNBT	LSM-25968	BRD-K87605280	1087297	InChI=1S/C20H22N2O6/c1-20(26-10-3-11-27-20)12-18(23)22-21-13-16-8-9-17(28-16)14-4-6-15(7-5-14)19(24)25-2/h4-9,13H,3,10-12H2,1-2H3,(H,22,23)	NHSRIEYOJMTMAL-UHFFFAOYSA-N	COC(=O)c1ccc(cc1)c2oc(C=NNC(=O)CC3(C)OCCCO3)cc2	BroadT	BRD-K87605280	BRD-K87605280-001-05-7	Asinex Ltd.	BAS 00622594			COC(=O)c1ccc(cc1)-c1ccc(C=NNC(=O)CC2(C)OCCCO2)o1	InChI=1S/C20H22N2O6/c1-20(26-10-3-11-27-20)12-18(23)22-21-13-16-8-9-17(28-16)14-4-6-15(7-5-14)19(24)25-2/h4-9,13H,3,10-12H2,1-2H3,(H,22,23)	NHSRIEYOJMTMAL-UHFFFAOYSA-N	386.147786444							114507
CBMICRO_035353	LSM-15385	BRD-A36627915	2873517	InChI=1S/C17H29NO2/c1-16(2,3)14-9-7-8-10-15(14)20-12-13(19)11-18-17(4,5)6/h7-10,13,18-19H,11-12H2,1-6H3	UHWJPVZFBUZSSG-UHFFFAOYSA-N	CC(C)(C)NCC(O)COc1ccccc1C(C)(C)C	BroadT	BRD-A36627915	BRD-A36627915-003-06-2	Enamine Ltd.	T0505-3400		Cl	CC(C)(C)NCC(O)COc1ccccc1C(C)(C)C.Cl	InChI=1S/C17H29NO2.ClH/c1-16(2,3)14-9-7-8-10-15(14)20-12-13(19)11-18-17(4,5)6;/h7-10,13,18-19H,11-12H2,1-6H3;1H	NUTCZUZGVLIJHJ-UHFFFAOYSA-N	279.219829178							104027, 104027
SMR000310591	LSM-25969	SID24823729, BRD-K13847800	16195555	InChI=1S/C28H28N6O2S/c1-36-21-9-7-20(8-10-21)33-16-14-32(15-17-33)13-12-29-27(35)19-6-11-22-24(18-19)31-28(37)34-25-5-3-2-4-23(25)30-26(22)34/h2-11,18H,12-17H2,1H3,(H,29,35)(H,31,37)	QAYSPUVJEQXMDJ-UHFFFAOYSA-N	COc1ccc(cc1)N2CCN(CCNC(=O)c3ccc4c(c3)nc(S)n5c6ccccc6nc45)CC2	BroadT	BRD-K13847800	BRD-K13847800-001-05-5	ChemDiv Inc.	K250-0353			COc1ccc(cc1)N1CCN(CCNC(=O)c2ccc3c4nc5ccccc5n4c(S)nc3c2)CC1	InChI=1S/C28H28N6O2S/c1-36-21-9-7-20(8-10-21)33-16-14-32(15-17-33)13-12-29-27(35)19-6-11-22-24(18-19)31-28(37)34-25-5-3-2-4-23(25)30-26(22)34/h2-11,18H,12-17H2,1H3,(H,29,35)(H,31,37)	QAYSPUVJEQXMDJ-UHFFFAOYSA-N	512.199444886							114508
AC1MQU57	LSM-25970	BRD-K83583123	3482515	InChI=1S/C14H12ClN3O2/c1-9(13-4-2-3-7-16-13)17-18-10-5-6-12(15)11(8-10)14(19)20/h2-8,18H,1H3,(H,19,20)	KZRTWLMCNWJAEY-UHFFFAOYSA-N	CC(=NNc1ccc(Cl)c(c1)C(=O)O)c2ccccn2	BroadT	BRD-K83583123	BRD-K83583123-001-05-1	Enamine Ltd.	T0507-7250			CC(=NNc1ccc(Cl)c(c1)C(O)=O)c1ccccn1	InChI=1S/C14H12ClN3O2/c1-9(13-4-2-3-7-16-13)17-18-10-5-6-12(15)11(8-10)14(19)20/h2-8,18H,1H3,(H,19,20)	KZRTWLMCNWJAEY-UHFFFAOYSA-N	289.061804364							114509
SMR000094255	LSM-25971	SID7965546, BRD-K42411129	5307685	InChI=1S/C16H14ClN3OS/c1-20-16-12(8-13(22-16)15(21)18-11-6-7-11)14(19-20)9-2-4-10(17)5-3-9/h2-5,8,11H,6-7H2,1H3,(H,18,21)	OVFFUPYXBPPPPB-UHFFFAOYSA-N	Cn1nc(c2ccc(Cl)cc2)c3cc(sc13)C(=O)NC4CC4	BroadT	BRD-K42411129	BRD-K42411129-001-05-9	ChemDiv Inc.	C509-0195			Cn1nc(-c2ccc(Cl)cc2)c2cc(sc12)C(=O)NC1CC1	InChI=1S/C16H14ClN3OS/c1-20-16-12(8-13(22-16)15(21)18-11-6-7-11)14(19-20)9-2-4-10(17)5-3-9/h2-5,8,11H,6-7H2,1H3,(H,18,21)	OVFFUPYXBPPPPB-UHFFFAOYSA-N	331.054610498							114510
MLS000700382	LSM-44150	SID22412513, BRD-K29326308	1803351	InChI=1S/C12H12N2OS/c1-2-16-12-13-10(11(15)14-12)8-9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,13,14,15)/b10-8-	NOBLHNZMOKWDBT-NTMALXAHSA-N	CCSC1=N\C(=C/c2ccccc2)\C(=O)N1	BroadT	BRD-K29326308	BRD-K29326308-001-06-7	Specs	AN-940/41040475			CCSC1=N\C(C(=O)N1)=C/c1ccccc1	InChI=1S/C12H12N2OS/c1-2-16-12-13-10(11(15)14-12)8-9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,13,14,15)/b10-8-	NOBLHNZMOKWDBT-NTMALXAHSA-N	232.067033714							
SMR000026488	LSM-25973	SID4247738, SID46500869, BRD-K43401718	3241902	InChI=1S/C23H21N3O5S/c1-2-15-6-3-4-8-20(15)26-32(29,30)17-9-10-21-18(12-17)22(27)19(14-24-21)23(28)25-13-16-7-5-11-31-16/h3-12,14,26H,2,13H2,1H3,(H,24,27)(H,25,28)	AGDUKHOZICPDPX-UHFFFAOYSA-N	CCc1ccccc1NS(=O)(=O)c2ccc3ncc(C(=O)NCc4occc4)c(O)c3c2	BroadT	BRD-K43401718	BRD-K43401718-001-05-6	ChemDiv Inc.	C385-0237			CCc1ccccc1NS(=O)(=O)c1ccc2ncc(C(=O)NCc3ccco3)c(O)c2c1	InChI=1S/C23H21N3O5S/c1-2-15-6-3-4-8-20(15)26-32(29,30)17-9-10-21-18(12-17)22(27)19(14-24-21)23(28)25-13-16-7-5-11-31-16/h3-12,14,26H,2,13H2,1H3,(H,24,27)(H,25,28)	AGDUKHOZICPDPX-UHFFFAOYSA-N	451.120191492							114512
MLS000122309	LSM-25974	SID17388200, BRD-K89380698	900602	InChI=1S/C15H15N7S/c1-10-3-5-11(6-4-10)19-14-21-12(20-13(16)22-14)9-23-15-17-7-2-8-18-15/h2-8H,9H2,1H3,(H3,16,19,20,21,22)	SZOPRAYQMXOLOM-UHFFFAOYSA-N	Cc1ccc(Nc2nc(N)nc(CSc3ncccn3)n2)cc1	BroadT	BRD-K89380698	BRD-K89380698-001-07-7	Asinex Ltd.	BAS 07100069			Cc1ccc(Nc2nc(N)nc(CSc3ncccn3)n2)cc1	InChI=1S/C15H15N7S/c1-10-3-5-11(6-4-10)19-14-21-12(20-13(16)22-14)9-23-15-17-7-2-8-18-15/h2-8H,9H2,1H3,(H3,16,19,20,21,22)	SZOPRAYQMXOLOM-UHFFFAOYSA-N	325.11096424							114513
AC1MRPBV	LSM-25975	BRD-K13510101	3521675	InChI=1S/C25H21ClN4O3S/c1-18-10-12-22(13-11-18)34(32,33)30(23-9-3-6-20-7-4-14-27-25(20)23)17-24(31)29-28-16-19-5-2-8-21(26)15-19/h2-16H,17H2,1H3,(H,29,31)	MCZIUYZVJFBHFL-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N(CC(=O)NN=Cc2cccc(Cl)c2)c3cccc4cccnc34	BroadT	BRD-K13510101	BRD-K13510101-001-05-5	Specs	AN-698/40748254			Cc1ccc(cc1)S(=O)(=O)N(CC(=O)NN=Cc1cccc(Cl)c1)c1cccc2cccnc12	InChI=1S/C25H21ClN4O3S/c1-18-10-12-22(13-11-18)34(32,33)30(23-9-3-6-20-7-4-14-27-25(20)23)17-24(31)29-28-16-19-5-2-8-21(26)15-19/h2-16H,17H2,1H3,(H,29,31)	MCZIUYZVJFBHFL-UHFFFAOYSA-N	492.102288972							114514
MLS000562696	LSM-25976	SID17403628, BRD-A57961536	3101965	InChI=1S/C16H21Cl3N2O3S/c1-15(2,3)14(23)21-13(16(17,18)19)20-11-10(12(22)24-4)8-6-5-7-9(8)25-11/h13,20H,5-7H2,1-4H3,(H,21,23)	GDPJAJLALUWQKQ-UHFFFAOYSA-N	COC(=O)c1c(NC(NC(=O)C(C)(C)C)C(Cl)(Cl)Cl)sc2CCCc12	BroadT	BRD-A57961536	BRD-A57961536-001-06-2	Asinex Ltd.	BAS 00354928			COC(=O)c1c(NC(NC(=O)C(C)(C)C)C(Cl)(Cl)Cl)sc2CCCc12	InChI=1S/C16H21Cl3N2O3S/c1-15(2,3)14(23)21-13(16(17,18)19)20-11-10(12(22)24-4)8-6-5-7-9(8)25-11/h13,20H,5-7H2,1-4H3,(H,21,23)	GDPJAJLALUWQKQ-UHFFFAOYSA-N	426.033846372							114515
ZINC03340095	LSM-25977	SID24825213, BRD-K38588507	4878712	InChI=1S/C16H15N3OS/c1-12-5-7-13(8-6-12)18-15(20)11-21-16-17-10-14-4-2-3-9-19(14)16/h2-10H,11H2,1H3,(H,18,20)	OASRABFRIFANFK-UHFFFAOYSA-N	Cc1ccc(NC(=O)CSc2ncc3ccccn23)cc1	BroadT	BRD-K38588507	BRD-K38588507-001-06-0	Enamine Ltd.	T5312201			Cc1ccc(NC(=O)CSc2ncc3ccccn23)cc1	InChI=1S/C16H15N3OS/c1-12-5-7-13(8-6-12)18-15(20)11-21-16-17-10-14-4-2-3-9-19(14)16/h2-10H,11H2,1H3,(H,18,20)	OASRABFRIFANFK-UHFFFAOYSA-N	297.09358282							114516
2-(Anilinomethylene)-5-(3-chlorophenyl)cyclohexane-1,3-dione	LSM-25978	SID17506955, BRD-K24503088	874491	InChI=1S/C19H16ClNO2/c20-15-6-4-5-13(9-15)14-10-18(22)17(19(23)11-14)12-21-16-7-2-1-3-8-16/h1-9,12,14,21H,10-11H2	PYTFLCMNFGRFDT-UHFFFAOYSA-N	Clc1cccc(c1)C2CC(=O)C(=CNc3ccccc3)C(=O)C2	BroadT	BRD-K24503088	BRD-K24503088-001-05-4	ChemBridge Corporation	6125402			Clc1cccc(c1)C1CC(=O)C(=CNc2ccccc2)C(=O)C1	InChI=1S/C19H16ClNO2/c20-15-6-4-5-13(9-15)14-10-18(22)17(19(23)11-14)12-21-16-7-2-1-3-8-16/h1-9,12,14,21H,10-11H2	PYTFLCMNFGRFDT-UHFFFAOYSA-N	325.086956472							
N-(2,4-Difluorophenyl)-6-(propylsulfanyl)nicotinamide	LSM-25979	SID24817520, BRD-K39109183	4558225	InChI=1S/C15H14F2N2OS/c1-2-7-21-14-6-3-10(9-18-14)15(20)19-13-5-4-11(16)8-12(13)17/h3-6,8-9H,2,7H2,1H3,(H,19,20)	ZNWDKYDPMXRWST-UHFFFAOYSA-N	CCCSc1ccc(cn1)C(=O)Nc2ccc(F)cc2F	BroadT	BRD-K39109183	BRD-K39109183-001-05-7	Key Organics Ltd.	8G-308S			CCCSc1ccc(cn1)C(=O)Nc1ccc(F)cc1F	InChI=1S/C15H14F2N2OS/c1-2-7-21-14-6-3-10(9-18-14)15(20)19-13-5-4-11(16)8-12(13)17/h3-6,8-9H,2,7H2,1H3,(H,19,20)	ZNWDKYDPMXRWST-UHFFFAOYSA-N	308.079490178							114518
SMR000015990	LSM-25980	SID4243742, BRD-K87985355	3238428	InChI=1S/C19H19N5O3S4/c1-3-28-19-23-22-17(31-19)21-14(25)10-30-18-20-11-8-9-29-15(11)16(26)24(18)12-6-4-5-7-13(12)27-2/h4-7H,3,8-10H2,1-2H3,(H,21,22,25)	GJFOFDOUFIECBT-UHFFFAOYSA-N	CCSc1nnc(NC(=O)CSC2=NC3=C(SCC3)C(=O)N2c4ccccc4OC)s1	BroadT	BRD-K87985355	BRD-K87985355-001-05-3	Life Chemicals Inc.	F0513-0320			CCSc1nnc(NC(=O)CSc2nc3CCSc3c(=O)n2-c2ccccc2OC)s1	InChI=1S/C19H19N5O3S4/c1-3-28-19-23-22-17(31-19)21-14(25)10-30-18-20-11-8-9-29-15(11)16(26)24(18)12-6-4-5-7-13(12)27-2/h4-7H,3,8-10H2,1-2H3,(H,21,22,25)	GJFOFDOUFIECBT-UHFFFAOYSA-N	493.037072278							114519
AC1LDXKT	LSM-25981	BRD-K23826019	726953	InChI=1S/C16H17N5O2/c22-21(23)15-6-2-1-5-14(15)13-18-20-11-9-19(10-12-20)16-7-3-4-8-17-16/h1-8,13H,9-12H2	PURCLPLAJBDPSN-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1C=NN2CCN(CC2)c3ccccn3	BroadT	BRD-K23826019	BRD-K23826019-001-05-4	Asinex Ltd.	BAS 00922004			[O-][N+](=O)c1ccccc1C=NN1CCN(CC1)c1ccccn1	InChI=1S/C16H17N5O2/c22-21(23)15-6-2-1-5-14(15)13-18-20-11-9-19(10-12-20)16-7-3-4-8-17-16/h1-8,13H,9-12H2	PURCLPLAJBDPSN-UHFFFAOYSA-N	311.138224834							114520
MLS000543251	LSM-44151	SID17402911, BRD-K31350144	1475738	InChI=1S/C19H17F3N2O4/c1-11(25)14-10-15(18(27)28-16(14)7-8-24(2)3)23-17(26)12-5-4-6-13(9-12)19(20,21)22/h4-10H,1-3H3,(H,23,26)/b8-7+	UQFKNUUKMYSGSY-BQYQJAHWSA-N	CN(C)\C=C\C1=C(C=C(NC(=O)c2cccc(c2)C(F)(F)F)C(=O)O1)C(=O)C	BroadT	BRD-K31350144	BRD-K31350144-001-06-1	Key Organics Ltd.	4E-915			CN(C)\C=C\c1oc(=O)c(NC(=O)c2cccc(c2)C(F)(F)F)cc1C(C)=O	InChI=1S/C19H17F3N2O4/c1-11(25)14-10-15(18(27)28-16(14)7-8-24(2)3)23-17(26)12-5-4-6-13(9-12)19(20,21)22/h4-10H,1-3H3,(H,23,26)/b8-7+	UQFKNUUKMYSGSY-BQYQJAHWSA-N	394.114041644							
MLS000065151	LSM-44152	SID4260946, SID87218768, BRD-K53667631	1982054	InChI=1S/C21H18N4OS/c1-2-8-17(9-3-1)10-7-15-27-21-24-23-20(19-12-4-5-13-22-19)25(21)16-18-11-6-14-26-18/h1-14H,15-16H2/b10-7+	GVPGVDUUNVVLND-JXMROGBWSA-N	C(Sc1nnc(c2ccccn2)n1Cc3occc3)\C=C\c4ccccc4	BroadT	BRD-K53667631	BRD-K53667631-001-05-3	ChemBridge Corporation	7911220			C(Sc1nnc(-c2ccccn2)n1Cc1ccco1)\C=C\c1ccccc1	InChI=1S/C21H18N4OS/c1-2-8-17(9-3-1)10-7-15-27-21-24-23-20(19-12-4-5-13-22-19)25(21)16-18-11-6-14-26-18/h1-14H,15-16H2/b10-7+	GVPGVDUUNVVLND-JXMROGBWSA-N	374.120131926							
AC1LRZX6	LSM-25984	BRD-K42941887	1480170	InChI=1S/C15H13NO4S2/c1-10-4-2-3-5-11(10)14(17)20-16-13-7-9-22(18,19)15-12(13)6-8-21-15/h2-6,8H,7,9H2,1H3	BPJAUPJAHPJOEU-UHFFFAOYSA-N	Cc1ccccc1C(=O)ON=C2CCS(=O)(=O)c3sccc23	BroadT	BRD-K42941887	BRD-K42941887-001-06-5	Key Organics Ltd.	5N-349S			Cc1ccccc1C(=O)ON=C1CCS(=O)(=O)c2sccc12	InChI=1S/C15H13NO4S2/c1-10-4-2-3-5-11(10)14(17)20-16-13-7-9-22(18,19)15-12(13)6-8-21-15/h2-6,8H,7,9H2,1H3	BPJAUPJAHPJOEU-UHFFFAOYSA-N	335.028599286							114523
({4-[(2-Ethoxyphenyl)amino]-6-[(4-ethoxyphenyl)amino]pyrimidin-2-yl}methylidene)propanedinitrile	LSM-25985	SID26659329, BRD-K64015442	1932424	InChI=1S/C24H22N6O2/c1-3-31-19-11-9-18(10-12-19)27-23-14-24(30-22(29-23)13-17(15-25)16-26)28-20-7-5-6-8-21(20)32-4-2/h5-14H,3-4H2,1-2H3,(H2,27,28,29,30)	YYNPQDDPVCUVSH-UHFFFAOYSA-N	CCOc1ccc(Nc2cc(Nc3ccccc3OCC)nc(C=C(C#N)C#N)n2)cc1	BroadT	BRD-K64015442	BRD-K64015442-001-05-1	InterBioScreen Ltd.	STOCK2S-73410			CCOc1ccc(Nc2cc(Nc3ccccc3OCC)nc(C=C(C#N)C#N)n2)cc1	InChI=1S/C24H22N6O2/c1-3-31-19-11-9-18(10-12-19)27-23-14-24(30-22(29-23)13-17(15-25)16-26)28-20-7-5-6-8-21(20)32-4-2/h5-14H,3-4H2,1-2H3,(H2,27,28,29,30)	YYNPQDDPVCUVSH-UHFFFAOYSA-N	426.180424004							114524
Ethyl 1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-1-phenylethyl]piperidine-4-carboxylate	LSM-25986	SID4245782, BRD-A04935495	3240212	InChI=1S/C24H28N2O5/c1-2-29-24(28)18-10-12-26(13-11-18)22(17-6-4-3-5-7-17)23(27)25-19-8-9-20-21(16-19)31-15-14-30-20/h3-9,16,18,22H,2,10-15H2,1H3,(H,25,27)	GDEZDNSKRQZLLN-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC1)C(C(=O)Nc2ccc3OCCOc3c2)c4ccccc4	BroadT	BRD-A04935495	BRD-A04935495-001-05-1	ChemDiv Inc.	C094-0009			CCOC(=O)C1CCN(CC1)C(C(=O)Nc1ccc2OCCOc2c1)c1ccccc1	InChI=1S/C24H28N2O5/c1-2-29-24(28)18-10-12-26(13-11-18)22(17-6-4-3-5-7-17)23(27)25-19-8-9-20-21(16-19)31-15-14-30-20/h3-9,16,18,22H,2,10-15H2,1H3,(H,25,27)	GDEZDNSKRQZLLN-UHFFFAOYSA-N	424.199822016							114525
AC1M38KL	LSM-25987	SID24793513, BRD-K52241838	2208380	InChI=1S/C17H18N4O2S/c1-22-14-4-3-12(11-15(14)23-2)7-10-21-16(19-20-17(21)24)13-5-8-18-9-6-13/h3-6,8-9,11H,7,10H2,1-2H3,(H,20,24)	ZIZZNZDGXGANHZ-UHFFFAOYSA-N	COc1ccc(CCn2c(S)nnc2c3ccncc3)cc1OC	BroadT	BRD-K52241838	BRD-K52241838-001-05-9	ChemBridge Corporation	7805018			COc1ccc(CCn2c(S)nnc2-c2ccncc2)cc1OC	InChI=1S/C17H18N4O2S/c1-22-14-4-3-12(11-15(14)23-2)7-10-21-16(19-20-17(21)24)13-5-8-18-9-6-13/h3-6,8-9,11H,7,10H2,1-2H3,(H,20,24)	ZIZZNZDGXGANHZ-UHFFFAOYSA-N	342.115046546							114526
CBMICRO_014773	LSM-25988	SID26662635, BRD-K91686435	789538	InChI=1S/C12H10N4/c1-7-8(2)11(6-15)12(16-9(7)3)10(4-13)5-14/h16H,1-3H3	KDIQWDOHXRBUBC-UHFFFAOYSA-N	CC1=C(C)C(=C(C#N)C(=C(C#N)C#N)N1)C	BroadT	BRD-K91686435	BRD-K91686435-001-06-3	InterBioScreen Ltd.	STOCK1S-00835			CC1=C(C)C(C)=C(C#N)C(N1)=C(C#N)C#N	InChI=1S/C12H10N4/c1-7-8(2)11(6-15)12(16-9(7)3)10(4-13)5-14/h16H,1-3H3	KDIQWDOHXRBUBC-UHFFFAOYSA-N	210.09054636							114527
5G-403S	LSM-25989	SID14729139, BRD-K18197487	1478815	InChI=1S/C13H11ClN4S2/c1-2-18-11(16-17-13(18)19)10-7-20-12(15-10)8-3-5-9(14)6-4-8/h3-7H,2H2,1H3,(H,17,19)	GAVRWJHZBWTYKE-UHFFFAOYSA-N	CCn1c(S)nnc1c2csc(n2)c3ccc(Cl)cc3	BroadT	BRD-K18197487	BRD-K18197487-001-05-0	Key Organics Ltd.	5G-403S			CCn1c(S)nnc1-c1csc(n1)-c1ccc(Cl)cc1	InChI=1S/C13H11ClN4S2/c1-2-18-11(16-17-13(18)19)10-7-20-12(15-10)8-3-5-9(14)6-4-8/h3-7H,2H2,1H3,(H,17,19)	GAVRWJHZBWTYKE-UHFFFAOYSA-N	322.011365482							114528
AC1OA4RH	LSM-25990	SID852526, BRD-K17378892	6747709	InChI=1S/C16H17N3O2/c1-9-5-6-10-8-11(14(20)17-12(10)7-9)13-18-15(21-19-13)16(2,3)4/h5-8H,1-4H3,(H,17,20)	HYQVRKGPKNLMCR-UHFFFAOYSA-N	Cc1ccc2cc(c(O)nc2c1)c3noc(n3)C(C)(C)C	BroadT	BRD-K17378892	BRD-K17378892-001-05-6	Asinex Ltd.	BAS 08978215			Cc1ccc2cc(c(O)nc2c1)-c1noc(C(C)(C)C)n1	InChI=1S/C16H17N3O2/c1-9-5-6-10-8-11(14(20)17-12(10)7-9)13-18-15(21-19-13)16(2,3)4/h5-8H,1-4H3,(H,17,20)	HYQVRKGPKNLMCR-UHFFFAOYSA-N	283.132076814							
N-[2-(Methylsulfanyl)-1,3-benzothiazol-6-yl]furan-2-carboxamide	LSM-25991	SID22406549, BRD-K66549663	2161628	InChI=1S/C13H10N2O2S2/c1-18-13-15-9-5-4-8(7-11(9)19-13)14-12(16)10-3-2-6-17-10/h2-7H,1H3,(H,14,16)	NTDRTSAQTBRJNC-UHFFFAOYSA-N	CSc1nc2ccc(NC(=O)c3occc3)cc2s1	BroadT	BRD-K66549663	BRD-K66549663-001-05-9	Enamine Ltd.	T5267773			CSc1nc2ccc(NC(=O)c3ccco3)cc2s1	InChI=1S/C13H10N2O2S2/c1-18-13-15-9-5-4-8(7-11(9)19-13)14-12(16)10-3-2-6-17-10/h2-7H,1H3,(H,14,16)	NTDRTSAQTBRJNC-UHFFFAOYSA-N	290.01836896							114530
AC1LE0M1	LSM-25992	BRD-K52886246	728372	InChI=1S/C9H7ClN4S/c10-6-1-3-7(4-2-6)13-14-8(5-11)9(12)15/h1-4,13H,(H2,12,15)	RBXSHTPRUGKWLA-UHFFFAOYSA-N	NC(=S)C(=NNc1ccc(Cl)cc1)C#N	BroadT	BRD-K52886246	BRD-K52886246-001-08-1	Maybridge	CD 04975			NC(=S)C(=NNc1ccc(Cl)cc1)C#N	InChI=1S/C9H7ClN4S/c10-6-1-3-7(4-2-6)13-14-8(5-11)9(12)15/h1-4,13H,(H2,12,15)	RBXSHTPRUGKWLA-UHFFFAOYSA-N	238.007994664							114531
SMR000076296	LSM-25993	SID4254882, BRD-K93401341	1093251	InChI=1S/C17H17N3O3S2/c1-12-7-9-13(10-8-12)25(22,23)20(2)11-16(21)19-17-18-14-5-3-4-6-15(14)24-17/h3-10H,11H2,1-2H3,(H,18,19,21)	LGKLNUZYFCCZFX-UHFFFAOYSA-N	CN(CC(=O)Nc1nc2ccccc2s1)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K93401341	BRD-K93401341-001-05-0	ChemBridge Corporation	7777258			CN(CC(=O)Nc1nc2ccccc2s1)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C17H17N3O3S2/c1-12-7-9-13(10-8-12)25(22,23)20(2)11-16(21)19-17-18-14-5-3-4-6-15(14)24-17/h3-10H,11H2,1-2H3,(H,18,19,21)	LGKLNUZYFCCZFX-UHFFFAOYSA-N	375.071132814							114532
MLS000544186	LSM-25994	SID17407356, BRD-K11914247	997043	InChI=1S/C22H16Cl2FN3O3/c23-15-5-7-19(17(24)11-15)30-13-16-6-8-20(31-16)22(29)26-21-9-10-28(27-21)12-14-3-1-2-4-18(14)25/h1-11H,12-13H2,(H,26,27,29)	QIOIROGUXYVJQS-UHFFFAOYSA-N	Fc1ccccc1Cn2ccc(NC(=O)c3oc(COc4ccc(Cl)cc4Cl)cc3)n2	BroadT	BRD-K11914247	BRD-K11914247-001-07-2	Specs	AK-968/41170541			Fc1ccccc1Cn1ccc(NC(=O)c2ccc(COc3ccc(Cl)cc3Cl)o2)n1	InChI=1S/C22H16Cl2FN3O3/c23-15-5-7-19(17(24)11-15)30-13-16-6-8-20(31-16)22(29)26-21-9-10-28(27-21)12-14-3-1-2-4-18(14)25/h1-11H,12-13H2,(H,26,27,29)	QIOIROGUXYVJQS-UHFFFAOYSA-N	459.055275022							114533
4-(2-Furylmethyl)-5-(3-methoxybenzyl)-4H-1,2,4-triazole-3-thiol	LSM-25995	SID26730158, BRD-K38087085	2815828	InChI=1S/C15H15N3O2S/c1-19-12-5-2-4-11(8-12)9-14-16-17-15(21)18(14)10-13-6-3-7-20-13/h2-8H,9-10H2,1H3,(H,17,21)	NVOGKKGHHLWPPY-UHFFFAOYSA-N	COc1cccc(Cc2nnc(S)n2Cc3occc3)c1	BroadT	BRD-K38087085	BRD-K38087085-001-05-5	Maybridge	HTS 11295			COc1cccc(Cc2nnc(S)n2Cc2ccco2)c1	InChI=1S/C15H15N3O2S/c1-19-12-5-2-4-11(8-12)9-14-16-17-15(21)18(14)10-13-6-3-7-20-13/h2-8H,9-10H2,1H3,(H,17,21)	NVOGKKGHHLWPPY-UHFFFAOYSA-N	301.08849744							114534
MLS000572419	LSM-25996	SID17416157, BRD-K26567371	2270409	InChI=1S/C27H30O8/c1-26(2,3)34-23(29)15-31-18-12-21(32-16-24(30)35-27(4,5)6)25-19(28)14-20(33-22(25)13-18)17-10-8-7-9-11-17/h7-14H,15-16H2,1-6H3	IRTDEDTUPFTRPS-UHFFFAOYSA-N	CC(C)(C)OC(=O)COc1cc(OCC(=O)OC(C)(C)C)c2C(=O)C=C(Oc2c1)c3ccccc3	BroadT	BRD-K26567371	BRD-K26567371-001-10-3	ChemBridge Corporation	6153484			CC(C)(C)OC(=O)COc1cc(OCC(=O)OC(C)(C)C)c2c(c1)oc(cc2=O)-c1ccccc1	InChI=1S/C27H30O8/c1-26(2,3)34-23(29)15-31-18-12-21(32-16-24(30)35-27(4,5)6)25-19(28)14-20(33-22(25)13-18)17-10-8-7-9-11-17/h7-14H,15-16H2,1-6H3	IRTDEDTUPFTRPS-UHFFFAOYSA-N	482.19406792							114535
1-(9-Hydroxy-bicyclo[3.3.1]non-2-yl)-1-methyl-pyrrolidinium	LSM-15506	BRD-A74368234	3148891	InChI=1S/C14H26NO/c1-15(9-2-3-10-15)13-8-7-11-5-4-6-12(13)14(11)16/h11-14,16H,2-10H2,1H3/q+1	XPLDIPBUNDHFNG-UHFFFAOYSA-N	C[N+]1(CCCC1)C2CCC3CCCC2C3O	BroadT	BRD-A74368234	BRD-A74368234-005-05-7	Asinex Ltd.	BAS 03837993		I	C[N+]1(CCCC1)C1CCC2CCCC1C2O.I	InChI=1S/C14H26NO.HI/c1-15(9-2-3-10-15)13-8-7-11-5-4-6-12(13)14(11)16;/h11-14,16H,2-10H2,1H3;1H/q+1;	KBQOPTNGASKEMJ-UHFFFAOYSA-N	224.201439462							104147, 104147
AC1NOAHZ	LSM-25997	BRD-K87460837	5135001	InChI=1S/C19H13N5O2/c25-18-14-5-1-2-6-15(14)22-17(23-18)19(26)24-21-11-12-7-8-13-4-3-9-20-16(13)10-12/h1-11H,(H,24,26)(H,22,23,25)	ZCCCURVFSCDMQQ-UHFFFAOYSA-N	Oc1nc(nc2ccccc12)C(=O)NN=Cc3ccc4cccnc4c3	BroadT	BRD-K87460837	BRD-K87460837-001-05-5	Enamine Ltd.	T0512-3529			Oc1nc(nc2ccccc12)C(=O)NN=Cc1ccc2cccnc2c1	InChI=1S/C19H13N5O2/c25-18-14-5-1-2-6-15(14)22-17(23-18)19(26)24-21-11-12-7-8-13-4-3-9-20-16(13)10-12/h1-11H,(H,24,26)(H,22,23,25)	ZCCCURVFSCDMQQ-UHFFFAOYSA-N	343.106924706							114536
SMR000212062	LSM-44153	SID17511434, BRD-K66028208	6037227	InChI=1S/C20H26N2O6S4/c1-3-5-11-27-13(23)7-9-21-17(25)15(31-19(21)29)16-18(26)22(20(30)32-16)10-8-14(24)28-12-6-4-2/h3-12H2,1-2H3/b16-15+	SPIRDYZRVYNZQQ-FOCLMDBBSA-N	CCCCOC(=O)CCN1C(=S)S\C(=C/2\SC(=S)N(CCC(=O)OCCCC)C2=O)\C1=O	BroadT	BRD-K66028208	BRD-K66028208-001-05-6	InterBioScreen Ltd.	STOCK1S-68556			CCCCOC(=O)CCN1C(=S)S\C(C1=O)=C1\SC(=S)N(CCC(=O)OCCCC)C1=O	InChI=1S/C20H26N2O6S4/c1-3-5-11-27-13(23)7-9-21-17(25)15(31-19(21)29)16-18(26)22(20(30)32-16)10-8-14(24)28-12-6-4-2/h3-12H2,1-2H3/b16-15+	SPIRDYZRVYNZQQ-FOCLMDBBSA-N	518.067369332							
SMR000054620	LSM-25999	SID7976754, BRD-K93863961	1068898	InChI=1S/C11H8Br2O4/c1-4-5-3-6(12)10(16-2)7(13)9(5)17-8(4)11(14)15/h3H,1-2H3,(H,14,15)	KCROCFSAZNEFKQ-UHFFFAOYSA-N	COc1c(Br)cc2c(C)c(oc2c1Br)C(=O)O	BroadT	BRD-K93863961	BRD-K93863961-001-05-0	ChemBridge Corporation	5110036			COc1c(Br)cc2c(C)c(oc2c1Br)C(O)=O	InChI=1S/C11H8Br2O4/c1-4-5-3-6(12)10(16-2)7(13)9(5)17-8(4)11(14)15/h3H,1-2H3,(H,14,15)	KCROCFSAZNEFKQ-UHFFFAOYSA-N	361.878933936							114538
MLS000050869	LSM-26000	SID4256493, BRD-K57765549	937133	InChI=1S/C15H13ClFN3OS/c1-2-20-14(13-7-4-8-21-13)18-19-15(20)22-9-10-11(16)5-3-6-12(10)17/h3-8H,2,9H2,1H3	KXOCFNLXACBBKO-UHFFFAOYSA-N	CCn1c(SCc2c(F)cccc2Cl)nnc1c3occc3	BroadT	BRD-K57765549	BRD-K57765549-001-06-0	ChemBridge Corporation	7909798			CCn1c(SCc2c(F)cccc2Cl)nnc1-c1ccco1	InChI=1S/C15H13ClFN3OS/c1-2-20-14(13-7-4-8-21-13)18-19-15(20)22-9-10-11(16)5-3-6-12(10)17/h3-8H,2,9H2,1H3	KXOCFNLXACBBKO-UHFFFAOYSA-N	337.045188666							114539
Methyl 2-({[(1-cyclohexyl-1H-tetrazol-5-yl)sulfanyl]acetyl}amino)benzoate	LSM-26001	SID4258774, BRD-K31611708	2018646	InChI=1S/C17H21N5O3S/c1-25-16(24)13-9-5-6-10-14(13)18-15(23)11-26-17-19-20-21-22(17)12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8,11H2,1H3,(H,18,23)	CJHKMXYUYCYVEF-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)CSc2nnnn2C3CCCCC3	BroadT	BRD-K31611708	BRD-K31611708-001-06-4	ChemBridge Corporation	7766046			COC(=O)c1ccccc1NC(=O)CSc1nnnn1C1CCCCC1	InChI=1S/C17H21N5O3S/c1-25-16(24)13-9-5-6-10-14(13)18-15(23)11-26-17-19-20-21-22(17)12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8,11H2,1H3,(H,18,23)	CJHKMXYUYCYVEF-UHFFFAOYSA-N	375.136510272							114540
MLS000094175	LSM-26002	SID4244718, SID7971419, BRD-K28657502	3239280	InChI=1S/C17H18N2O2S3/c1-2-15-8-9-16(23-15)24(20,21)18-11-10-14-12-22-17(19-14)13-6-4-3-5-7-13/h3-9,12,18H,2,10-11H2,1H3	AIJBMSNYDXEQQX-UHFFFAOYSA-N	CCc1ccc(s1)S(=O)(=O)NCCc2csc(n2)c3ccccc3	BroadT	BRD-K28657502	BRD-K28657502-001-05-2	Life Chemicals Inc.	F0685-0089			CCc1ccc(s1)S(=O)(=O)NCCc1csc(n1)-c1ccccc1	InChI=1S/C17H18N2O2S3/c1-2-15-8-9-16(23-15)24(20,21)18-11-10-14-12-22-17(19-14)13-6-4-3-5-7-13/h3-9,12,18H,2,10-11H2,1H3	AIJBMSNYDXEQQX-UHFFFAOYSA-N	378.053039906							114541
4-Chloro-n-{2-[4-(methylsulfonyl)piperazino]phenyl}benzenecarboxamide	LSM-26003	SID4262499, BRD-K78817124	1254419	InChI=1S/C18H20ClN3O3S/c1-26(24,25)22-12-10-21(11-13-22)17-5-3-2-4-16(17)20-18(23)14-6-8-15(19)9-7-14/h2-9H,10-13H2,1H3,(H,20,23)	ZRYZIAVMCILNBY-UHFFFAOYSA-N	CS(=O)(=O)N1CCN(CC1)c2ccccc2NC(=O)c3ccc(Cl)cc3	BroadT	BRD-K78817124	BRD-K78817124-001-05-9	ChemBridge Corporation	7912452			CS(=O)(=O)N1CCN(CC1)c1ccccc1NC(=O)c1ccc(Cl)cc1	InChI=1S/C18H20ClN3O3S/c1-26(24,25)22-12-10-21(11-13-22)17-5-3-2-4-16(17)20-18(23)14-6-8-15(19)9-7-14/h2-9H,10-13H2,1H3,(H,20,23)	ZRYZIAVMCILNBY-UHFFFAOYSA-N	393.09138993							114542
SMR000003663	LSM-26004	SID842786, BRD-K98197259	645060	InChI=1S/C19H19N3O4S/c1-13-6-8-15(9-7-13)26-11-17-20-21-19(27-12-18(23)24)22(17)14-4-3-5-16(10-14)25-2/h3-10H,11-12H2,1-2H3,(H,23,24)	OVPNHOVNAFZNBK-UHFFFAOYSA-N	COc1cccc(c1)n2c(COc3ccc(C)cc3)nnc2SCC(=O)O	BroadT	BRD-K98197259	BRD-K98197259-001-05-9	Asinex Ltd.	ASN 04790531			COc1cccc(c1)-n1c(COc2ccc(C)cc2)nnc1SCC(O)=O	InChI=1S/C19H19N3O4S/c1-13-6-8-15(9-7-13)26-11-17-20-21-19(27-12-18(23)24)22(17)14-4-3-5-16(10-14)25-2/h3-10H,11-12H2,1-2H3,(H,23,24)	OVPNHOVNAFZNBK-UHFFFAOYSA-N	385.109626808							114543
AC1MDJ63	LSM-26005	BRD-K86726862	2837756	InChI=1S/C22H17N5/c1-3-9-18(10-4-1)20-14-21(19-11-5-2-6-12-19)26-22(25-20)27-24-16-17-8-7-13-23-15-17/h1-16H,(H,25,26,27)	QYRFUAMRNAKEET-UHFFFAOYSA-N	N(N=Cc1cccnc1)c2nc(cc(n2)c3ccccc3)c4ccccc4	BroadT	BRD-K86726862	BRD-K86726862-001-05-8	ChemBridge Corporation	5256425			N(N=Cc1cccnc1)c1nc(cc(n1)-c1ccccc1)-c1ccccc1	InChI=1S/C22H17N5/c1-3-9-18(10-4-1)20-14-21(19-11-5-2-6-12-19)26-22(25-20)27-24-16-17-8-7-13-23-15-17/h1-16H,(H,25,26,27)	QYRFUAMRNAKEET-UHFFFAOYSA-N	351.148395594							114544
MLS000110803	LSM-26006	SID7975896, BRD-K61046611	1129477	InChI=1S/C18H13ClF2N2O2/c1-9-6-7-11(8-14(9)21)22-18(24)15-10(2)25-23-17(15)16-12(19)4-3-5-13(16)20/h3-8H,1-2H3,(H,22,24)	SQTJRHRZARGCIW-UHFFFAOYSA-N	Cc1onc(c1C(=O)Nc2ccc(C)c(F)c2)c3c(F)cccc3Cl	BroadT	BRD-K61046611	BRD-K61046611-001-06-2	ChemBridge Corporation	6576027			Cc1onc(c1C(=O)Nc1ccc(C)c(F)c1)-c1c(F)cccc1Cl	InChI=1S/C18H13ClF2N2O2/c1-9-6-7-11(8-14(9)21)22-18(24)15-10(2)25-23-17(15)16-12(19)4-3-5-13(16)20/h3-8H,1-2H3,(H,22,24)	SQTJRHRZARGCIW-UHFFFAOYSA-N	362.063361786							114545
ST50851618	LSM-26007	SID17434023, BRD-K49808825	2957492	InChI=1S/C20H21N3O7S/c1-4-29-18(24)12-6-8-14(19(25)30-5-2)16(10-12)22-20(31)21-15-9-7-13(23(26)27)11-17(15)28-3/h6-11H,4-5H2,1-3H3,(H2,21,22,31)	BHYAPMHXMSCJNS-UHFFFAOYSA-N	CCOC(=O)c1ccc(C(=O)OCC)c(NC(=Nc2ccc(cc2OC)[N+](=O)[O-])S)c1	BroadT	BRD-K49808825	BRD-K49808825-001-05-6	ChemBridge Corporation	7831196			CCOC(=O)c1ccc(C(=O)OCC)c(NC(S)=Nc2ccc(cc2OC)[N+]([O-])=O)c1	InChI=1S/C20H21N3O7S/c1-4-29-18(24)12-6-8-14(19(25)30-5-2)16(10-12)22-20(31)21-15-9-7-13(23(26)27)11-17(15)28-3/h6-11H,4-5H2,1-3H3,(H2,21,22,31)	BHYAPMHXMSCJNS-UHFFFAOYSA-N	447.110020732							114546
1-(5-Methoxy-1H-indol-3-yl)-2-[(4-methyl-1,3-thiazol-2-yl)amino]ethanone	LSM-15507	BRD-K85382097	3811191	InChI=1S/C15H15N3O2S/c1-9-8-21-15(18-9)17-7-14(19)12-6-16-13-4-3-10(20-2)5-11(12)13/h3-6,8,16H,7H2,1-2H3,(H,17,18)	RQNGOUSHTRNNBP-UHFFFAOYSA-N	COc1ccc2[nH]cc(C(=O)CNc3nc(C)cs3)c2c1	BroadT	BRD-K85382097	BRD-K85382097-005-05-9	InterBioScreen Ltd.	STOCK2S-65002		I	COc1ccc2[nH]cc(C(=O)CNc3nc(C)cs3)c2c1.I	InChI=1S/C15H15N3O2S.HI/c1-9-8-21-15(18-9)17-7-14(19)12-6-16-13-4-3-10(20-2)5-11(12)13;/h3-6,8,16H,7H2,1-2H3,(H,17,18);1H	CQAKEDOHZODDEZ-UHFFFAOYSA-N	301.08849744							104148, 104148
SMR000212358	LSM-26008	BRD-K07723978	3838798	InChI=1S/C27H23N5O5/c1-16-22(26(34)30(28-16)18-10-5-3-6-11-18)24(20-14-9-15-21(25(20)33)32(36)37)23-17(2)29-31(27(23)35)19-12-7-4-8-13-19/h3-15,24,33-35H,1-2H3	WRRFXZYQZFHEOL-UHFFFAOYSA-N	Cc1nn(c(O)c1C(c2cccc(c2O)[N+](=O)[O-])c3c(C)nn(c3O)c4ccccc4)c5ccccc5	BroadT	BRD-K07723978	BRD-K07723978-001-06-0	InterBioScreen Ltd.	STOCK1S-67370			Cc1nn(c(O)c1C(c1c(C)nn(c1O)-c1ccccc1)c1cccc(c1O)[N+]([O-])=O)-c1ccccc1	InChI=1S/C27H23N5O5/c1-16-22(26(34)30(28-16)18-10-5-3-6-11-18)24(20-14-9-15-21(25(20)33)32(36)37)23-17(2)29-31(27(23)35)19-12-7-4-8-13-19/h3-15,24,33-35H,1-2H3	WRRFXZYQZFHEOL-UHFFFAOYSA-N	497.169918886							
AK-968/15611271	LSM-26009	SID22402574, BRD-K52435917	832064	InChI=1S/C13H14ClN3O/c1-3-17-9(2)12(8-15-17)13(18)16-11-6-4-5-10(14)7-11/h4-8H,3H2,1-2H3,(H,16,18)	RBROYMGARYVJQW-UHFFFAOYSA-N	CCn1ncc(C(=O)Nc2cccc(Cl)c2)c1C	BroadT	BRD-K52435917	BRD-K52435917-001-06-9	Specs	AK-968/15611271			CCn1ncc(C(=O)Nc2cccc(Cl)c2)c1C	InChI=1S/C13H14ClN3O/c1-3-17-9(2)12(8-15-17)13(18)16-11-6-4-5-10(14)7-11/h4-8H,3H2,1-2H3,(H,16,18)	RBROYMGARYVJQW-UHFFFAOYSA-N	263.082539808							114548
SMR000154691	LSM-26010	SID17386031, BRD-K45202051	2597985	InChI=1S/C19H18N4O4S/c1-27-16-7-3-14(4-8-16)13-18(24)22-15-5-9-17(10-6-15)28(25,26)23-19-20-11-2-12-21-19/h2-12H,13H2,1H3,(H,22,24)(H,20,21,23)	HMAYPDNKDDHMAZ-UHFFFAOYSA-N	COc1ccc(CC(=O)Nc2ccc(cc2)S(=O)(=O)Nc3ncccn3)cc1	BroadT	BRD-K45202051	BRD-K45202051-001-06-9	Enamine Ltd.	ZT-2572289			COc1ccc(CC(=O)Nc2ccc(cc2)S(=O)(=O)Nc2ncccn2)cc1	InChI=1S/C19H18N4O4S/c1-27-16-7-3-14(4-8-16)13-18(24)22-15-5-9-17(10-6-15)28(25,26)23-19-20-11-2-12-21-19/h2-12H,13H2,1H3,(H,22,24)(H,20,21,23)	HMAYPDNKDDHMAZ-UHFFFAOYSA-N	398.104875786							114549
MLS000558529	LSM-26011	SID14741033, SID50113217, BRD-K94592778	942803	InChI=1S/C16H14N4O2/c1-21-10-4-5-13-12(7-10)14-15(20-13)16(19-9-18-14)17-8-11-3-2-6-22-11/h2-7,9,20H,8H2,1H3,(H,17,18,19)	NBVXPAQAUTYTPT-UHFFFAOYSA-N	COc1ccc2[nH]c3c(NCc4occc4)ncnc3c2c1	BroadT	BRD-K94592778	BRD-K94592778-001-03-2	InterBioScreen Ltd.	STOCK4S-56142			COc1ccc2[nH]c3c(NCc4ccco4)ncnc3c2c1	InChI=1S/C16H14N4O2/c1-21-10-4-5-13-12(7-10)14-15(20-13)16(19-9-18-14)17-8-11-3-2-6-22-11/h2-7,9,20H,8H2,1H3,(H,17,18,19)	NBVXPAQAUTYTPT-UHFFFAOYSA-N	294.111675728							114550
AC1MMV3T	LSM-26012	BRD-K77958737	3292126	InChI=1S/C24H21N3O4S/c28-20-7-3-6-19(14-20)25-26-24(29)18-12-10-16(11-13-18)15-27-21-8-1-4-17-5-2-9-22(23(17)21)32(27,30)31/h1-2,4-5,8-13H,3,6-7,14-15H2,(H,26,29)	ISDNZHWIUCSBKJ-UHFFFAOYSA-N	O=C(NN=C1CCCC(=O)C1)c2ccc(CN3c4cccc5cccc(c45)S3(=O)=O)cc2	BroadT	BRD-K77958737	BRD-K77958737-001-05-1	Enamine Ltd.	T0515-7156			O=C(NN=C1CCCC(=O)C1)c1ccc(CN2c3cccc4cccc(c34)S2(=O)=O)cc1	InChI=1S/C24H21N3O4S/c28-20-7-3-6-19(14-20)25-26-24(29)18-12-10-16(11-13-18)15-27-21-8-1-4-17-5-2-9-22(23(17)21)32(27,30)31/h1-2,4-5,8-13H,3,6-7,14-15H2,(H,26,29)	ISDNZHWIUCSBKJ-UHFFFAOYSA-N	447.125276872							114551
N-[5-(4-Methoxyphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-yl]-4-methylbenzamide	LSM-26013	SID17415445, BRD-K09331333	2279983	InChI=1S/C24H19N3O4S/c1-15-3-5-18(6-4-15)23(28)26-24-25-21(16-7-11-19(12-8-16)27(29)30)22(32-24)17-9-13-20(31-2)14-10-17/h3-14H,1-2H3,(H,25,26,28)	DTPSWEPQHXSUHM-UHFFFAOYSA-N	COc1ccc(cc1)c2sc(NC(=O)c3ccc(C)cc3)nc2c4ccc(cc4)[N+](=O)[O-]	BroadT	BRD-K09331333	BRD-K09331333-001-05-2	ChemBridge Corporation	6400599			COc1ccc(cc1)-c1sc(NC(=O)c2ccc(C)cc2)nc1-c1ccc(cc1)[N+]([O-])=O	InChI=1S/C24H19N3O4S/c1-15-3-5-18(6-4-15)23(28)26-24-25-21(16-7-11-19(12-8-16)27(29)30)22(32-24)17-9-13-20(31-2)14-10-17/h3-14H,1-2H3,(H,25,26,28)	DTPSWEPQHXSUHM-UHFFFAOYSA-N	445.109626808							114552
SMR000206479	LSM-26014	SID17509850, SID24385319, BRD-K14289056	12005008	InChI=1S/C19H25N7O2/c1-4-5-12-25(3)17(28)11-10-16(27)22-23-19-21-15-9-7-6-8-14(15)18-20-13(2)24-26(18)19/h6-9H,4-5,10-12H2,1-3H3,(H,21,23)(H,22,27)	OPKDBXYZIGYRJI-UHFFFAOYSA-N	CCCCN(C)C(=O)CCC(=O)NNc1nc2ccccc2c3nc(C)nn13	BroadT	BRD-K14289056	BRD-K14289056-001-08-4	ChemDiv Inc.	C600-0013			CCCCN(C)C(=O)CCC(=O)NNc1nc2ccccc2c2nc(C)nn12	InChI=1S/C19H25N7O2/c1-4-5-12-25(3)17(28)11-10-16(27)22-23-19-21-15-9-7-6-8-14(15)18-20-13(2)24-26(18)19/h6-9H,4-5,10-12H2,1-3H3,(H,21,23)(H,22,27)	OPKDBXYZIGYRJI-UHFFFAOYSA-N	383.20697311							114553
ST004885	LSM-26015	SID7976577, BRD-K78200415	1219339	InChI=1S/C23H28N2O4/c1-3-28-20-10-6-18(7-11-20)22(26)24-14-5-15-25(17-16-24)23(27)19-8-12-21(13-9-19)29-4-2/h6-13H,3-5,14-17H2,1-2H3	LBEADUIZJVSPSH-UHFFFAOYSA-N	CCOc1ccc(cc1)C(=O)N2CCCN(CC2)C(=O)c3ccc(OCC)cc3	BroadT	BRD-K78200415	BRD-K78200415-001-05-6	ChemBridge Corporation	5529981			CCOc1ccc(cc1)C(=O)N1CCCN(CC1)C(=O)c1ccc(OCC)cc1	InChI=1S/C23H28N2O4/c1-3-28-20-10-6-18(7-11-20)22(26)24-14-5-15-25(17-16-24)23(27)19-8-12-21(13-9-19)29-4-2/h6-13H,3-5,14-17H2,1-2H3	LBEADUIZJVSPSH-UHFFFAOYSA-N	396.204907396							114554
CHEMDIV3_007555	LSM-26016	SID22411802, BRD-A04956113	4384031	InChI=1S/C25H25N3O2/c1-17(2)18-12-14-20(15-13-18)26-25(30)24(19-8-4-3-5-9-19)28-16-23(29)27-21-10-6-7-11-22(21)28/h3-15,17,24H,16H2,1-2H3,(H,26,30)(H,27,29)	CBOBFTJZIOZMDZ-UHFFFAOYSA-N	CC(C)c1ccc(NC(=O)C(N2CC(=O)Nc3ccccc23)c4ccccc4)cc1	BroadT	BRD-A04956113	BRD-A04956113-001-05-9	ChemDiv Inc.	C094-0480			CC(C)c1ccc(NC(=O)C(N2CC(=O)Nc3ccccc23)c2ccccc2)cc1	InChI=1S/C25H25N3O2/c1-17(2)18-12-14-20(15-13-18)26-25(30)24(19-8-4-3-5-9-19)28-16-23(29)27-21-10-6-7-11-22(21)28/h3-15,17,24H,16H2,1-2H3,(H,26,30)(H,27,29)	CBOBFTJZIOZMDZ-UHFFFAOYSA-N	399.19467707							114555
MLS000768840	LSM-44154	SID26671188, BRD-K98065297	887844	InChI=1S/C17H14FN5O/c18-13-9-6-12(7-10-13)8-11-15(24)20-17-21-16(19)23(22-17)14-4-2-1-3-5-14/h1-11H,(H3,19,20,21,22,24)/b11-8+	IKMJGJDDBOKWMY-DHZHZOJOSA-N	Nc1nc(NC(=O)\C=C\c2ccc(F)cc2)nn1c3ccccc3	BroadT	BRD-K98065297	BRD-K98065297-001-06-0	InterBioScreen Ltd.	STOCK3S-24839			Nc1nc(NC(=O)\C=C\c2ccc(F)cc2)nn1-c1ccccc1	InChI=1S/C17H14FN5O/c18-13-9-6-12(7-10-13)8-11-15(24)20-17-21-16(19)23(22-17)14-4-2-1-3-5-14/h1-11H,(H3,19,20,21,22,24)/b11-8+	IKMJGJDDBOKWMY-DHZHZOJOSA-N	323.118238318							
SMR000002300	LSM-2089	BRD-K05326558, SID89650204, SID87544794, SID851115	653676	InChI=1S/C19H24N6O3S2/c1-4-9-25-14-15(23(2)19(28)24(3)16(14)27)22-18(25)29-10-13(26)21-17-20-11-7-5-6-8-12(11)30-17/h4-10H2,1-3H3,(H,20,21,26)	YMNZFBJWBJYYHG-UHFFFAOYSA-N	CCCn1c(SCC(=O)Nc2nc3CCCCc3s2)nc4N(C)C(=O)N(C)C(=O)c14	BroadT	BRD-K05326558	BRD-K05326558-001-05-4	Asinex Ltd.	ASN 03430765			CCCn1c(SCC(=O)Nc2nc3CCCCc3s2)nc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C19H24N6O3S2/c1-4-9-25-14-15(23(2)19(28)24(3)16(14)27)22-18(25)29-10-13(26)21-17-20-11-7-5-6-8-12(11)30-17/h4-10H2,1-3H3,(H,20,21,26)	YMNZFBJWBJYYHG-UHFFFAOYSA-N	448.135130068							92091
N-(3-(1H-Imidazol-1-yl)propyl)-2-methyl-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidin-7-amine	LSM-26018	SID26663648, BRD-K65927155	4888039	InChI=1S/C22H26N6/c1-3-8-19-15-20(24-11-7-13-27-14-12-23-16-27)28-22(25-19)21(17(2)26-28)18-9-5-4-6-10-18/h4-6,9-10,12,14-16,24H,3,7-8,11,13H2,1-2H3	DGRPYNIHNJXTIL-UHFFFAOYSA-N	CCCc1cc(NCCCn2ccnc2)n3nc(C)c(c4ccccc4)c3n1	BroadT	BRD-K65927155	BRD-K65927155-001-05-3	InterBioScreen Ltd.	STOCK5S-37099			CCCc1cc(NCCCn2ccnc2)n2nc(C)c(-c3ccccc3)c2n1	InChI=1S/C22H26N6/c1-3-8-19-15-20(24-11-7-13-27-14-12-23-16-27)28-22(25-19)21(17(2)26-28)18-9-5-4-6-10-18/h4-6,9-10,12,14-16,24H,3,7-8,11,13H2,1-2H3	DGRPYNIHNJXTIL-UHFFFAOYSA-N	374.221894892							114557
AG-690/34036064	LSM-44155	SID17432222, BRD-K94540066	818642	InChI=1S/C17H13N3O2/c1-11-8-13(21)6-7-14(11)19-10-12(9-18)17-20-15-4-2-3-5-16(15)22-17/h2-8,10,19,21H,1H3/b12-10+	WHSLKNWOKZYCRQ-ZRDIBKRKSA-N	Cc1cc(O)ccc1N\C=C(/C#N)\c2oc3ccccc3n2	BroadT	BRD-K94540066	BRD-K94540066-001-05-7	ChemBridge Corporation	5527393			Cc1cc(O)ccc1N\C=C(/C#N)c1nc2ccccc2o1	InChI=1S/C17H13N3O2/c1-11-8-13(21)6-7-14(11)19-10-12(9-18)17-20-15-4-2-3-5-16(15)22-17/h2-8,10,19,21H,1H3/b12-10+	WHSLKNWOKZYCRQ-ZRDIBKRKSA-N	291.100776686							
MLS000077465	LSM-26020	SID859808, SID87345666, BRD-K15038311	661110	InChI=1S/C15H16ClN5O2/c16-11-1-3-12(4-2-11)21-15-13(9-20-21)14(18-10-19-15)17-5-7-23-8-6-22/h1-4,9-10,22H,5-8H2,(H,17,18,19)	UTNKSHGKBYJRQW-UHFFFAOYSA-N	OCCOCCNc1ncnc2c1cnn2c3ccc(Cl)cc3	BroadT	BRD-K15038311	BRD-K15038311-001-05-1	InterBioScreen Ltd.	STOCK3S-32720			OCCOCCNc1ncnc2n(ncc12)-c1ccc(Cl)cc1	InChI=1S/C15H16ClN5O2/c16-11-1-3-12(4-2-11)21-15-13(9-20-21)14(18-10-19-15)17-5-7-23-8-6-22/h1-4,9-10,22H,5-8H2,(H,17,18,19)	UTNKSHGKBYJRQW-UHFFFAOYSA-N	333.099252512							114559
MLS000530767	LSM-26021	BRD-K05139097	2913459	InChI=1S/C23H23N5O6/c1-12-19(22(29)26-24-12)21(20-13(2)25-27-23(20)30)15-6-9-17(18(10-15)33-3)34-11-14-4-7-16(8-5-14)28(31)32/h4-10,21H,11H2,1-3H3,(H2,24,26,29)(H2,25,27,30)	HTQOWHRTTYNVEV-UHFFFAOYSA-N	COc1cc(ccc1OCc2ccc(cc2)[N+](=O)[O-])C(c3c(C)n[nH]c3O)c4c(C)n[nH]c4O	BroadT	BRD-K05139097	BRD-K05139097-001-06-7	ChemBridge Corporation	6770317			COc1cc(ccc1OCc1ccc(cc1)[N+]([O-])=O)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O	InChI=1S/C23H23N5O6/c1-12-19(22(29)26-24-12)21(20-13(2)25-27-23(20)30)15-6-9-17(18(10-15)33-3)34-11-14-4-7-16(8-5-14)28(31)32/h4-10,21H,11H2,1-3H3,(H2,24,26,29)(H2,25,27,30)	HTQOWHRTTYNVEV-UHFFFAOYSA-N	465.164833506							114560
MLS001236039	LSM-26022	SID51085442, BRD-K58387147	7151143	InChI=1S/C19H23N5O3S/c1-12-7-9-24(10-8-12)14(25)11-28-19-22-16(20)15(18(27)23-19)21-17(26)13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H,21,26)(H3,20,22,23,27)	QMTQSRKDUJCMMI-UHFFFAOYSA-N	CC1CCN(CC1)C(=O)CSc2nc(N)c(NC(=O)c3ccccc3)c(O)n2	BroadT	BRD-K58387147	BRD-K58387147-001-06-8	Life Chemicals Inc.	F1880-0027			CC1CCN(CC1)C(=O)CSc1nc(N)c(NC(=O)c2ccccc2)c(O)n1	InChI=1S/C19H23N5O3S/c1-12-7-9-24(10-8-12)14(25)11-28-19-22-16(20)15(18(27)23-19)21-17(26)13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H,21,26)(H3,20,22,23,27)	QMTQSRKDUJCMMI-UHFFFAOYSA-N	401.152160336							114561
SMR000041368	LSM-26023	SID859176, BRD-K50104180	660483	InChI=1S/C8H13N3O2S/c1-5(2)4-13-8(12)9-7-6(3)10-11-14-7/h5H,4H2,1-3H3,(H,9,12)	XPCMWGLXXBNAAY-UHFFFAOYSA-N	CC(C)COC(=O)Nc1snnc1C	BroadT	BRD-K50104180	BRD-K50104180-001-05-5	InterBioScreen Ltd.	STOCK3S-01734			CC(C)COC(=O)Nc1snnc1C	InChI=1S/C8H13N3O2S/c1-5(2)4-13-8(12)9-7-6(3)10-11-14-7/h5H,4H2,1-3H3,(H,9,12)	XPCMWGLXXBNAAY-UHFFFAOYSA-N	215.072847376							114562
2-(5-Ethylthiophene-2-carbonyl)benzoic acid	LSM-26024	SID14739878, BRD-K50682746	5153038	InChI=1S/C14H12O3S/c1-2-9-7-8-12(18-9)13(15)10-5-3-4-6-11(10)14(16)17/h3-8H,2H2,1H3,(H,16,17)	CRVNPJNPROPZAD-UHFFFAOYSA-N	CCc1ccc(s1)C(=O)c2ccccc2C(=O)O	BroadT	BRD-K50682746	BRD-K50682746-001-05-7	Key Organics Ltd.	MS-1295			CCc1ccc(s1)C(=O)c1ccccc1C(O)=O	InChI=1S/C14H12O3S/c1-2-9-7-8-12(18-9)13(15)10-5-3-4-6-11(10)14(16)17/h3-8H,2H2,1H3,(H,16,17)	CRVNPJNPROPZAD-UHFFFAOYSA-N	260.050714934							114563
N-[(2z)-3-(2-Chlorophenyl)-4-oxo-1,3-thiazolidin-2-ylidene]benzamide	LSM-26025	BRD-K56024096	1352303	InChI=1S/C16H11ClN2O2S/c17-12-8-4-5-9-13(12)19-14(20)10-22-16(19)18-15(21)11-6-2-1-3-7-11/h1-9H,10H2	OTHWTCCOPJDHAU-UHFFFAOYSA-N	Clc1ccccc1N2C(=O)CSC2=NC(=O)c3ccccc3	BroadT	BRD-K56024096	BRD-K56024096-001-06-0	ChemDiv Inc.	3771-3129			Clc1ccccc1N1C(=O)CSC1=NC(=O)c1ccccc1	InChI=1S/C16H11ClN2O2S/c17-12-8-4-5-9-13(12)19-14(20)10-22-16(19)18-15(21)11-6-2-1-3-7-11/h1-9H,10H2	OTHWTCCOPJDHAU-UHFFFAOYSA-N	330.022976012							114564
6-Benzooxazol-2-yl-benzothiazol-2-ylamine	LSM-26026	SID14725850, BRD-K91427846	810326	InChI=1S/C14H9N3OS/c15-14-17-10-6-5-8(7-12(10)19-14)13-16-9-3-1-2-4-11(9)18-13/h1-7H,(H2,15,17)	MDRFRNBHBAVMDP-UHFFFAOYSA-N	Nc1nc2ccc(cc2s1)c3oc4ccccc4n3	BroadT	BRD-K91427846	BRD-K91427846-001-07-3	Asinex Ltd.	BAS 03421626			Nc1nc2ccc(cc2s1)-c1nc2ccccc2o1	InChI=1S/C14H9N3OS/c15-14-17-10-6-5-8(7-12(10)19-14)13-16-9-3-1-2-4-11(9)18-13/h1-7H,(H2,15,17)	MDRFRNBHBAVMDP-UHFFFAOYSA-N	267.046632628							114565
BAS 05509261	LSM-26027	SID842278, BRD-K32086160	644537	InChI=1S/C17H19N5O2/c1-9(2)22-14(18)11(16(23)19-4)7-12-15(22)20-13-6-5-10(3)8-21(13)17(12)24/h5-9,18H,1-4H3,(H,19,23)	YJQZLBVSABEZBW-UHFFFAOYSA-N	CNC(=O)C1=CC2=C(N=C3C=CC(=CN3C2=O)C)N(C(C)C)C1=N	BroadT	BRD-K32086160	BRD-K32086160-001-05-1	Asinex Ltd.	BAS 05509261			CNC(=O)c1cc2c(nc3ccc(C)cn3c2=O)n(C(C)C)c1=N	InChI=1S/C17H19N5O2/c1-9(2)22-14(18)11(16(23)19-4)7-12-15(22)20-13-6-5-10(3)8-21(13)17(12)24/h5-9,18H,1-4H3,(H,19,23)	YJQZLBVSABEZBW-UHFFFAOYSA-N	325.153874898							114566
4-[2-(2,4-Dioxopentan-3-ylidene)hydrazinyl]benzoic acid	LSM-26028	SID26659502, BRD-K82063557	948799	InChI=1S/C12H12N2O4/c1-7(15)11(8(2)16)14-13-10-5-3-9(4-6-10)12(17)18/h3-6,13H,1-2H3,(H,17,18)	QEOWQGBNFSVKIJ-UHFFFAOYSA-N	CC(=O)C(=NNc1ccc(cc1)C(=O)O)C(=O)C	BroadT	BRD-K82063557	BRD-K82063557-001-05-0	InterBioScreen Ltd.	STOCK3S-11256			CC(=O)C(=NNc1ccc(cc1)C(O)=O)C(C)=O	InChI=1S/C12H12N2O4/c1-7(15)11(8(2)16)14-13-10-5-3-9(4-6-10)12(17)18/h3-6,13H,1-2H3,(H,17,18)	QEOWQGBNFSVKIJ-UHFFFAOYSA-N	248.079706884							114567
MLS000057790	LSM-26029	SID3714621, BRD-K30639617	2998880	InChI=1S/C18H13N3O3/c1-2-4-13-12(3-1)16-17(24-13)18(21-9-20-16)19-8-11-5-6-14-15(7-11)23-10-22-14/h1-7,9H,8,10H2,(H,19,20,21)	ACBAKVVEGJKNPL-UHFFFAOYSA-N	C(Nc1ncnc2c1oc3ccccc23)c4ccc5OCOc5c4	BroadT	BRD-K30639617	BRD-K30639617-001-06-6	Enamine Ltd.	T0511-4615			C(Nc1ncnc2c3ccccc3oc12)c1ccc2OCOc2c1	InChI=1S/C18H13N3O3/c1-2-4-13-12(3-1)16-17(24-13)18(21-9-20-16)19-8-11-5-6-14-15(7-11)23-10-22-14/h1-7,9H,8,10H2,(H,19,20,21)	ACBAKVVEGJKNPL-UHFFFAOYSA-N	319.095691306							114568
ST50052593	LSM-26030	SID24808471, BRD-K61105570	750092	InChI=1S/C19H14N2O/c1-13-17-8-4-5-9-18(17)19(22)21(20-13)16-11-10-14-6-2-3-7-15(14)12-16/h2-12H,1H3	OULBKRDDQDGHCP-UHFFFAOYSA-N	CC1=NN(C(=O)c2ccccc12)c3ccc4ccccc4c3	BroadT	BRD-K61105570	BRD-K61105570-001-06-5	Asinex Ltd.	BAS 00659591			Cc1nn(-c2ccc3ccccc3c2)c(=O)c2ccccc12	InChI=1S/C19H14N2O/c1-13-17-8-4-5-9-18(17)19(22)21(20-13)16-11-10-14-6-2-3-7-15(14)12-16/h2-12H,1H3	OULBKRDDQDGHCP-UHFFFAOYSA-N	286.110613088							114569
AC1LD28J	LSM-26031	SID858771, BRD-A08075568	660075	InChI=1S/C21H21N3O6/c1-29-21(28)14-4-6-15(7-5-14)24-18(25)13-16(19(24)26)22-8-10-23(11-9-22)20(27)17-3-2-12-30-17/h2-7,12,16H,8-11,13H2,1H3	PSNFIVWDVFPSSZ-UHFFFAOYSA-N	COC(=O)c1ccc(cc1)N2C(=O)CC(N3CCN(CC3)C(=O)c4occc4)C2=O	BroadT	BRD-A08075568	BRD-A08075568-001-06-2	InterBioScreen Ltd.	STOCK2S-61406			COC(=O)c1ccc(cc1)N1C(=O)CC(N2CCN(CC2)C(=O)c2ccco2)C1=O	InChI=1S/C21H21N3O6/c1-29-21(28)14-4-6-15(7-5-14)24-18(25)13-16(19(24)26)22-8-10-23(11-9-22)20(27)17-3-2-12-30-17/h2-7,12,16H,8-11,13H2,1H3	PSNFIVWDVFPSSZ-UHFFFAOYSA-N	411.143035422							114570
ZINC01133327	LSM-26032	SID17433906, BRD-K05522035	1307962	InChI=1S/C22H21NO4/c1-25-19-14-21(27-3)20(26-2)13-17(19)22(24)23-18-12-8-7-11-16(18)15-9-5-4-6-10-15/h4-14H,1-3H3,(H,23,24)	DBNZOKIKMUQSOU-UHFFFAOYSA-N	COc1cc(OC)c(cc1OC)C(=O)Nc2ccccc2c3ccccc3	BroadT	BRD-K05522035	BRD-K05522035-001-05-1	ChemBridge Corporation	7722396			COc1cc(OC)c(cc1OC)C(=O)Nc1ccccc1-c1ccccc1	InChI=1S/C22H21NO4/c1-25-19-14-21(27-3)20(26-2)13-17(19)22(24)23-18-12-8-7-11-16(18)15-9-5-4-6-10-15/h4-14H,1-3H3,(H,23,24)	DBNZOKIKMUQSOU-UHFFFAOYSA-N	363.147058162							114571
SMR000002476	LSM-26033	SID26668722, SID842273, BRD-A80220789	644532	InChI=1S/C26H28N6O2/c1-34-21-11-10-18-14-22(26(33)27-23(18)15-21)24(25-28-29-30-32(25)20-8-4-5-9-20)31-13-12-17-6-2-3-7-19(17)16-31/h2-3,6-7,10-11,14-15,20,24H,4-5,8-9,12-13,16H2,1H3,(H,27,33)	FRLDXENFROMZGP-UHFFFAOYSA-N	COc1ccc2cc(C(N3CCc4ccccc4C3)c5nnnn5C6CCCC6)c(O)nc2c1	BroadT	BRD-A80220789	BRD-A80220789-001-05-0	Asinex Ltd.	ASN 03775715			COc1ccc2cc(C(N3CCc4ccccc4C3)c3nnnn3C3CCCC3)c(O)nc2c1	InChI=1S/C26H28N6O2/c1-34-21-11-10-18-14-22(26(33)27-23(18)15-21)24(25-28-29-30-32(25)20-8-4-5-9-20)31-13-12-17-6-2-3-7-19(17)16-31/h2-3,6-7,10-11,14-15,20,24H,4-5,8-9,12-13,16H2,1H3,(H,27,33)	FRLDXENFROMZGP-UHFFFAOYSA-N	456.227374196							114572
SMR000122995	LSM-26034	SID14720518, BRD-K80616260	2915028	InChI=1S/C23H24N4O6S/c1-12-5-8-16(9-6-12)34(30,31)33-17-10-7-15(11-18(17)32-4)21(19-13(2)24-26-22(19)28)20-14(3)25-27-23(20)29/h5-11,21H,1-4H3,(H2,24,26,28)(H2,25,27,29)	KEURXGXXXHDSIW-UHFFFAOYSA-N	COc1cc(ccc1OS(=O)(=O)c2ccc(C)cc2)C(c3c(C)n[nH]c3O)c4c(C)n[nH]c4O	BroadT	BRD-K80616260	BRD-K80616260-001-06-3	Asinex Ltd.	BAS 03602764			COc1cc(ccc1OS(=O)(=O)c1ccc(C)cc1)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O	InChI=1S/C23H24N4O6S/c1-12-5-8-16(9-6-12)34(30,31)33-17-10-7-15(11-18(17)32-4)21(19-13(2)24-26-22(19)28)20-14(3)25-27-23(20)29/h5-11,21H,1-4H3,(H2,24,26,28)(H2,25,27,29)	KEURXGXXXHDSIW-UHFFFAOYSA-N	484.141655218							114573
3-(4-Methoxyphenyl)imidazo[1,5-a]pyridine	LSM-26035	SID4258101, BRD-K40049195	740407	InChI=1S/C14H12N2O/c1-17-13-7-5-11(6-8-13)14-15-10-12-4-2-3-9-16(12)14/h2-10H,1H3	GSTBFHPYOPODDI-UHFFFAOYSA-N	COc1ccc(cc1)c2ncc3ccccn23	BroadT	BRD-K40049195	BRD-K40049195-001-06-6	ChemBridge Corporation	7934055			COc1ccc(cc1)-c1ncc2ccccn12	InChI=1S/C14H12N2O/c1-17-13-7-5-11(6-8-13)14-15-10-12-4-2-3-9-16(12)14/h2-10H,1H3	GSTBFHPYOPODDI-UHFFFAOYSA-N	224.094963024							114574
MLS000684093	LSM-26036	SID24794896, BRD-K14442800	2301863	InChI=1S/C15H21N3O2S/c1-2-3-9-13(19)16-15(21)18-17-14(20)11-10-12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3,(H,17,20)(H2,16,18,19,21)	RGQPLEIRYJPSCG-UHFFFAOYSA-N	CCCCC(=O)NC(=S)NNC(=O)CCc1ccccc1	BroadT	BRD-K14442800	BRD-K14442800-001-06-2	ChemBridge Corporation	7938072			CCCCC(=O)NC(=S)NNC(=O)CCc1ccccc1	InChI=1S/C15H21N3O2S/c1-2-3-9-13(19)16-15(21)18-17-14(20)11-10-12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3,(H,17,20)(H2,16,18,19,21)	RGQPLEIRYJPSCG-UHFFFAOYSA-N	307.135447632							114575
SMR000002807	LSM-26037	SID842214, BRD-K22390355	644469	InChI=1S/C23H27N5O3S/c1-4-28-20(14-24-18-11-9-16(3)10-12-18)26-27-23(28)32-15-21(29)25-19-8-6-7-17(13-19)22(30)31-5-2/h6-13,24H,4-5,14-15H2,1-3H3,(H,25,29)	CBPOCTCIOXDJFV-UHFFFAOYSA-N	CCOC(=O)c1cccc(NC(=O)CSc2nnc(CNc3ccc(C)cc3)n2CC)c1	BroadT	BRD-K22390355	BRD-K22390355-001-05-4	Asinex Ltd.	ASN 04011358			CCOC(=O)c1cccc(NC(=O)CSc2nnc(CNc3ccc(C)cc3)n2CC)c1	InChI=1S/C23H27N5O3S/c1-4-28-20(14-24-18-11-9-16(3)10-12-18)26-27-23(28)32-15-21(29)25-19-8-6-7-17(13-19)22(30)31-5-2/h6-13,24H,4-5,14-15H2,1-3H3,(H,25,29)	CBPOCTCIOXDJFV-UHFFFAOYSA-N	453.183460464							114576
STK398575	LSM-26038	SID22412820, BRD-K44111592	844673	InChI=1S/C13H13N3O/c1-15-9-11(8-14-15)13(17)16-7-6-10-4-2-3-5-12(10)16/h2-5,8-9H,6-7H2,1H3	PQLLCYOGQUSCOU-UHFFFAOYSA-N	Cn1cc(cn1)C(=O)N2CCc3ccccc23	BroadT	BRD-K44111592	BRD-K44111592-001-05-1	Specs	AK-968/41926596			Cn1cc(cn1)C(=O)N1CCc2ccccc12	InChI=1S/C13H13N3O/c1-15-9-11(8-14-15)13(17)16-7-6-10-4-2-3-5-12(10)16/h2-5,8-9H,6-7H2,1H3	PQLLCYOGQUSCOU-UHFFFAOYSA-N	227.105862066							114577
Evoxine	LSM-26039	SID26747198, SID399762, SID50105212, SID7972624	73416	InChI=1S/C18H21NO6/c1-18(2,21)13(20)9-25-12-6-5-10-14(16(12)23-4)19-17-11(7-8-24-17)15(10)22-3/h5-8,13,20-21H,9H2,1-4H3	FGANMDNHTVJAHL-UHFFFAOYSA-N	COc1c(OCC(O)C(C)(C)O)ccc2c(OC)c3ccoc3nc12	BroadT	BRD-A99268498	BRD-A99268498-001-08-4	ChemBridge Corporation	5255766			COc1c(OCC(O)C(C)(C)O)ccc2c(OC)c3ccoc3nc12	InChI=1S/C18H21NO6/c1-18(2,21)13(20)9-25-12-6-5-10-14(16(12)23-4)19-17-11(7-8-24-17)15(10)22-3/h5-8,13,20-21H,9H2,1-4H3	FGANMDNHTVJAHL-UHFFFAOYSA-N	347.136887402							4952
AC1MW3QV	LSM-26040	BRD-K71120545	3743038	InChI=1S/C11H8N4S3/c16-11-14-13-10(9-4-2-6-18-9)15(11)12-7-8-3-1-5-17-8/h1-7H,(H,14,16)	BBSKPRBMKRPTOV-UHFFFAOYSA-N	Sc1nnc(c2cccs2)n1N=Cc3cccs3	BroadT	BRD-K71120545	BRD-K71120545-001-06-4	Key Organics Ltd.	12P-307S			Sc1nnc(-c2cccs2)n1N=Cc1cccs1	InChI=1S/C11H8N4S3/c16-11-14-13-10(9-4-2-6-18-9)15(11)12-7-8-3-1-5-17-8/h1-7H,(H,14,16)	BBSKPRBMKRPTOV-UHFFFAOYSA-N	291.991108366							114578
ZINC04063574	LSM-26041	SID24816055, BRD-K65452667	5093257	InChI=1S/C14H13N3O2/c1-10-6-5-9-12(15-10)16-14(19)17-13(18)11-7-3-2-4-8-11/h2-9H,1H3,(H2,15,16,17,18,19)	BCLLGYXPSYLYTG-UHFFFAOYSA-N	Cc1cccc(NC(=O)NC(=O)c2ccccc2)n1	BroadT	BRD-K65452667	BRD-K65452667-001-05-3	Life Chemicals Inc.	F0746-0009			Cc1cccc(NC(=O)NC(=O)c2ccccc2)n1	InChI=1S/C14H13N3O2/c1-10-6-5-9-12(15-10)16-14(19)17-13(18)11-7-3-2-4-8-11/h2-9H,1H3,(H2,15,16,17,18,19)	BCLLGYXPSYLYTG-UHFFFAOYSA-N	255.100776686							114579
1-[(1-Benzyl-1H-tetrazol-5-yl)-pyridin-3-yl-methyl]-4-phenyl-piperazine	LSM-26042	SID851989, BRD-A23340311	654593	InChI=1S/C24H25N7/c1-3-8-20(9-4-1)19-31-24(26-27-28-31)23(21-10-7-13-25-18-21)30-16-14-29(15-17-30)22-11-5-2-6-12-22/h1-13,18,23H,14-17,19H2	LNWCSHCCFJYCEZ-UHFFFAOYSA-N	C(c1ccccc1)n2nnnc2C(N3CCN(CC3)c4ccccc4)c5cccnc5	BroadT	BRD-A23340311	BRD-A23340311-001-06-1	Asinex Ltd.	ASN 07882633			C(c1ccccc1)n1nnnc1C(N1CCN(CC1)c1ccccc1)c1cccnc1	InChI=1S/C24H25N7/c1-3-8-20(9-4-1)19-31-24(26-27-28-31)23(21-10-7-13-25-18-21)30-16-14-29(15-17-30)22-11-5-2-6-12-22/h1-13,18,23H,14-17,19H2	LNWCSHCCFJYCEZ-UHFFFAOYSA-N	411.21714387							114580
Methyl 5-(4-chlorobenzoyl)-2-(dimethylaminomethylidene)-3-oxopyrrolo[2,1-b][1,3]thiazole-7-carboxylate	LSM-26043	BRD-K65709100	4047313	InChI=1S/C18H15ClN2O4S/c1-20(2)9-14-16(23)21-13(8-12(17(21)26-14)18(24)25-3)15(22)10-4-6-11(19)7-5-10/h4-9H,1-3H3	IJFUBADKLMNNRE-UHFFFAOYSA-N	COC(=O)c1cc(C(=O)c2ccc(Cl)cc2)n3C(=O)C(=CN(C)C)Sc13	BroadT	BRD-K65709100	BRD-K65709100-001-05-1	Enamine Ltd.	T0512-3766			COC(=O)c1cc(C(=O)c2ccc(Cl)cc2)n2c1sc(=CN(C)C)c2=O	InChI=1S/C18H15ClN2O4S/c1-20(2)9-14-16(23)21-13(8-12(17(21)26-14)18(24)25-3)15(22)10-4-6-11(19)7-5-10/h4-9H,1-3H3	IJFUBADKLMNNRE-UHFFFAOYSA-N	390.04410538							114581
SMR000207783	LSM-26044	SID17511357, BRD-A08986082	12005507	InChI=1S/C17H19BrN2O3S2/c18-14-10-11-15(24-14)25(22,23)20-16(12-6-2-1-3-7-12)17(21)19-13-8-4-5-9-13/h1-3,6-7,10-11,13,16,20H,4-5,8-9H2,(H,19,21)	VRHJVDKHOWVPCI-UHFFFAOYSA-N	Brc1ccc(s1)S(=O)(=O)NC(C(=O)NC2CCCC2)c3ccccc3	BroadT	BRD-A08986082	BRD-A08986082-001-05-9	ChemDiv Inc.	C274-0060			Brc1ccc(s1)S(=O)(=O)NC(C(=O)NC1CCCC1)c1ccccc1	InChI=1S/C17H19BrN2O3S2/c18-14-10-11-15(24-14)25(22,23)20-16(12-6-2-1-3-7-12)17(21)19-13-8-4-5-9-13/h1-3,6-7,10-11,13,16,20H,4-5,8-9H2,(H,19,21)	VRHJVDKHOWVPCI-UHFFFAOYSA-N	442.002046468							114582
AC1MXGX3	LSM-26045	BRD-K52586039	3790241	InChI=1S/C18H18N4O4/c1-11(21-22-18(24)13-4-2-3-5-14(13)19)8-17(23)20-12-6-7-15-16(9-12)26-10-25-15/h2-7,9H,8,10,19H2,1H3,(H,20,23)(H,22,24)	MGBSYVGOLVTBCY-UHFFFAOYSA-N	CC(=NNC(=O)c1ccccc1N)CC(=O)Nc2ccc3OCOc3c2	BroadT	BRD-K52586039	BRD-K52586039-001-05-4	InterBioScreen Ltd.	STOCK2S-28131			CC(CC(=O)Nc1ccc2OCOc2c1)=NNC(=O)c1ccccc1N	InChI=1S/C18H18N4O4/c1-11(21-22-18(24)13-4-2-3-5-14(13)19)8-17(23)20-12-6-7-15-16(9-12)26-10-25-15/h2-7,9H,8,10,19H2,1H3,(H,20,23)(H,22,24)	MGBSYVGOLVTBCY-UHFFFAOYSA-N	354.132805096							114583
ZINC00611805	LSM-26046	SID24796325, BRD-K41920118	971857	InChI=1S/C13H12N4OS2/c1-17-7-6-14-13(17)19-8-11(18)16-12-15-9-4-2-3-5-10(9)20-12/h2-7H,8H2,1H3,(H,15,16,18)	STNJLOFRUPHKGE-UHFFFAOYSA-N	Cn1ccnc1SCC(=O)Nc2nc3ccccc3s2	BroadT	BRD-K41920118	BRD-K41920118-001-05-3	ChemBridge Corporation	7832791			Cn1ccnc1SCC(=O)Nc1nc2ccccc2s1	InChI=1S/C13H12N4OS2/c1-17-7-6-14-13(17)19-8-11(18)16-12-15-9-4-2-3-5-10(9)20-12/h2-7H,8H2,1H3,(H,15,16,18)	STNJLOFRUPHKGE-UHFFFAOYSA-N	304.045252424							114584
3-[(2,5-Dichlorophenoxy)methyl]-n-(2,6-dimethylphenyl)benzamide	LSM-26047	SID17506311, BRD-K89523629	1760585	InChI=1S/C22H19Cl2NO2/c1-14-5-3-6-15(2)21(14)25-22(26)17-8-4-7-16(11-17)13-27-20-12-18(23)9-10-19(20)24/h3-12H,13H2,1-2H3,(H,25,26)	WTTRLOIGJMCHRO-UHFFFAOYSA-N	Cc1cccc(C)c1NC(=O)c2cccc(COc3cc(Cl)ccc3Cl)c2	BroadT	BRD-K89523629	BRD-K89523629-001-05-0	ChemBridge Corporation	7533202			Cc1cccc(C)c1NC(=O)c1cccc(COc2cc(Cl)ccc2Cl)c1	InChI=1S/C22H19Cl2NO2/c1-14-5-3-6-15(2)21(14)25-22(26)17-8-4-7-16(11-17)13-27-20-12-18(23)9-10-19(20)24/h3-12H,13H2,1-2H3,(H,25,26)	WTTRLOIGJMCHRO-UHFFFAOYSA-N	399.079284278							114585
MLS000562053	LSM-26048	SID26659617, BRD-A99845239	16681900	InChI=1S/C42H36N4O5/c43-40(49)37-26-42(27-46(37)41(50)34-22-11-10-21-33(34)39(48)30-17-8-3-9-18-30)25-36(45-51-42)31-19-12-20-32(23-31)44-38(47)24-35(28-13-4-1-5-14-28)29-15-6-2-7-16-29/h1-23,35,37H,24-27H2,(H2,43,49)(H,44,47)/t37-,42?/m1/s1	CHVGRSKBLXRBHR-SZUYGLCUSA-N	NC(=O)[C@H]1CC2(CN1C(=O)c3ccccc3C(=O)c4ccccc4)CC(=NO2)c5cccc(NC(=O)CC(c6ccccc6)c7ccccc7)c5	BroadT	BRD-A99845239	BRD-A99845239-001-05-9	University of California at Davis	UCD_SMD_1-112			NC(=O)[C@H]1CC2(CN1C(=O)c1ccccc1C(=O)c1ccccc1)CC(=NO2)c1cccc(NC(=O)CC(c2ccccc2)c2ccccc2)c1	InChI=1S/C42H36N4O5/c43-40(49)37-26-42(27-46(37)41(50)34-22-11-10-21-33(34)39(48)30-17-8-3-9-18-30)25-36(45-51-42)31-19-12-20-32(23-31)44-38(47)24-35(28-13-4-1-5-14-28)29-15-6-2-7-16-29/h1-23,35,37H,24-27H2,(H2,43,49)(H,44,47)/t37-,42?/m1/s1	CHVGRSKBLXRBHR-SZUYGLCUSA-N	676.268570292001							114586
T5260115	LSM-26049	SID3715190, BRD-A68579503	2999112	InChI=1S/C24H24N4O5S/c1-14-21(24(32)28(27(14)3)16-9-5-4-6-10-16)26-22(30)15(2)33-20(29)13-19-23(31)25-17-11-7-8-12-18(17)34-19/h4-12,15,19H,13H2,1-3H3,(H,25,31)(H,26,30)	YQZBDSLRIRIKPW-UHFFFAOYSA-N	CC(OC(=O)CC1Sc2ccccc2NC1=O)C(=O)NC3=C(C)N(C)N(C3=O)c4ccccc4	BroadT	BRD-A68579503	BRD-A68579503-001-05-0	Enamine Ltd.	T5260115			CC(OC(=O)CC1Sc2ccccc2NC1=O)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	InChI=1S/C24H24N4O5S/c1-14-21(24(32)28(27(14)3)16-9-5-4-6-10-16)26-22(30)15(2)33-20(29)13-19-23(31)25-17-11-7-8-12-18(17)34-19/h4-12,15,19H,13H2,1-3H3,(H,25,31)(H,26,30)	YQZBDSLRIRIKPW-UHFFFAOYSA-N	480.146740598							114587
4-{2-[(2,4-Dichlorobenzyl)sulfanyl]-6-methyl-4-pyrimidinyl}morpholine	LSM-26050	SID17402542, BRD-K84812831	1484540	InChI=1S/C16H17Cl2N3OS/c1-11-8-15(21-4-6-22-7-5-21)20-16(19-11)23-10-12-2-3-13(17)9-14(12)18/h2-3,8-9H,4-7,10H2,1H3	AGCSFEMNYLPWSY-UHFFFAOYSA-N	Cc1cc(nc(SCc2ccc(Cl)cc2Cl)n1)N3CCOCC3	BroadT	BRD-K84812831	BRD-K84812831-001-05-6	Key Organics Ltd.	7M-826			Cc1cc(nc(SCc2ccc(Cl)cc2Cl)n1)N1CCOCC1	InChI=1S/C16H17Cl2N3OS/c1-11-8-15(21-4-6-22-7-5-21)20-16(19-11)23-10-12-2-3-13(17)9-14(12)18/h2-3,8-9H,4-7,10H2,1H3	AGCSFEMNYLPWSY-UHFFFAOYSA-N	369.046938304							114588
T0519-0807	LSM-26051	SID24826869, BRD-K89041560	2476191	InChI=1S/C17H15N3O2S2/c21-11-19-7-9-20(10-8-19)17(22)15-6-5-14(23-15)16-18-12-3-1-2-4-13(12)24-16/h1-6,11H,7-10H2	TYLOIXLQVUJDOS-UHFFFAOYSA-N	O=CN1CCN(CC1)C(=O)c2ccc(s2)c3nc4ccccc4s3	BroadT	BRD-K89041560	BRD-K89041560-001-05-4	Enamine Ltd.	T0519-0807			O=CN1CCN(CC1)C(=O)c1ccc(s1)-c1nc2ccccc2s1	InChI=1S/C17H15N3O2S2/c21-11-19-7-9-20(10-8-19)17(22)15-6-5-14(23-15)16-18-12-3-1-2-4-13(12)24-16/h1-6,11H,7-10H2	TYLOIXLQVUJDOS-UHFFFAOYSA-N	357.06056813							114589
SMR000274208	LSM-26052	SID24801076, BRD-K09581323	1146426	InChI=1S/C27H32N4O5S/c1-2-34-22-5-3-21(4-6-22)28-27(37)31(8-7-30-9-11-33-12-10-30)18-20-15-19-16-24-25(36-14-13-35-24)17-23(19)29-26(20)32/h3-6,15-17H,2,7-14,18H2,1H3,(H,28,37)(H,29,32)	TWBOIEJZLRDSDV-UHFFFAOYSA-N	CCOc1ccc(NC(=S)N(CCN2CCOCC2)Cc3cc4cc5OCCOc5cc4nc3O)cc1	BroadT	BRD-K09581323	BRD-K09581323-001-05-4	Asinex Ltd.	ASN 03776565			CCOc1ccc(NC(=S)N(CCN2CCOCC2)Cc2cc3cc4OCCOc4cc3nc2O)cc1	InChI=1S/C27H32N4O5S/c1-2-34-22-5-3-21(4-6-22)28-27(37)31(8-7-30-9-11-33-12-10-30)18-20-15-19-16-24-25(36-14-13-35-24)17-23(19)29-26(20)32/h3-6,15-17H,2,7-14,18H2,1H3,(H,28,37)(H,29,32)	TWBOIEJZLRDSDV-UHFFFAOYSA-N	524.209340854							114590
AK-968/15612531	LSM-26053	SID22413512, BRD-A45390777	4061915	InChI=1S/C25H26N4O3/c1-25(2)11-18-23(19(30)12-25)22(15-7-8-20(31-3)21(10-15)32-4)17(13-26)24(27)29(18)16-6-5-9-28-14-16/h5-10,14,22H,11-12,27H2,1-4H3	WBTPQXGYWHGJID-UHFFFAOYSA-N	COc1ccc(cc1OC)C2C(=C(N)N(C3=C2C(=O)CC(C)(C)C3)c4cccnc4)C#N	BroadT	BRD-A45390777	BRD-A45390777-001-05-9	Specs	AK-968/15612531			COc1ccc(cc1OC)C1C(C#N)=C(N)N(c2cccnc2)C2=C1C(=O)CC(C)(C)C2	InChI=1S/C25H26N4O3/c1-25(2)11-18-23(19(30)12-25)22(15-7-8-20(31-3)21(10-15)32-4)17(13-26)24(27)29(18)16-6-5-9-28-14-16/h5-10,14,22H,11-12,27H2,1-4H3	WBTPQXGYWHGJID-UHFFFAOYSA-N	430.200490732							114591
SMR000078623	LSM-26054	SID4255575, BRD-K62800580	993469	InChI=1S/C16H13NO5S2/c1-21-13-8-6-12(7-9-13)17(16(18)14-4-2-10-22-14)24(19,20)15-5-3-11-23-15/h2-11H,1H3	JZGXMDLRKYMDRH-UHFFFAOYSA-N	COc1ccc(cc1)N(C(=O)c2occc2)S(=O)(=O)c3cccs3	BroadT	BRD-K62800580	BRD-K62800580-001-06-8	ChemBridge Corporation	7910711			COc1ccc(cc1)N(C(=O)c1ccco1)S(=O)(=O)c1cccs1	InChI=1S/C16H13NO5S2/c1-21-13-8-6-12(7-9-13)17(16(18)14-4-2-10-22-14)24(19,20)15-5-3-11-23-15/h2-11H,1H3	JZGXMDLRKYMDRH-UHFFFAOYSA-N	363.023513906							114592
T0514-7124	LSM-26055	SID3714176, BRD-K70816752	2998692	InChI=1S/C20H17N3O3/c1-3-25-20(24)15-12-16(17-10-7-11-26-17)21-19-18(15)13(2)22-23(19)14-8-5-4-6-9-14/h4-12H,3H2,1-2H3	NIKOGSHEFBGJHR-UHFFFAOYSA-N	CCOC(=O)c1cc(nc2c1c(C)nn2c3ccccc3)c4occc4	BroadT	BRD-K70816752	BRD-K70816752-001-05-8	Enamine Ltd.	T0514-7124			CCOC(=O)c1cc(nc2n(nc(C)c12)-c1ccccc1)-c1ccco1	InChI=1S/C20H17N3O3/c1-3-25-20(24)15-12-16(17-10-7-11-26-17)21-19-18(15)13(2)22-23(19)14-8-5-4-6-9-14/h4-12H,3H2,1-2H3	NIKOGSHEFBGJHR-UHFFFAOYSA-N	347.126991434							114593
NSC700248	LSM-26056	SID26661218, BRD-K44144588	346140	InChI=1S/C17H24O4/c1-16(2)6-12(18)10(13(19)7-16)5-11-14(20)8-17(3,4)9-15(11)21/h10-11H,5-9H2,1-4H3	JSCUZLUQVFQIII-UHFFFAOYSA-N	CC1(C)CC(=O)C(CC2C(=O)CC(C)(C)CC2=O)C(=O)C1	BroadT	BRD-K44144588	BRD-K44144588-001-16-5	InterBioScreen Ltd.	STOCK2S-16882			CC1(C)CC(=O)C(CC2C(=O)CC(C)(C)CC2=O)C(=O)C1	InChI=1S/C17H24O4/c1-16(2)6-12(18)10(13(19)7-16)5-11-14(20)8-17(3,4)9-15(11)21/h10-11H,5-9H2,1-4H3	JSCUZLUQVFQIII-UHFFFAOYSA-N	292.167459248							114594
MLS000045833	LSM-26057	SID4245892, BRD-K83152417	3240308	InChI=1S/C25H30N4O5/c1-5-33-18-8-6-16(7-9-18)20-14-21-26-22(19(23(30)31)15-29(21)27-20)17-10-12-28(13-11-17)24(32)34-25(2,3)4/h6-9,14-15,17H,5,10-13H2,1-4H3,(H,30,31)	ZFQFJBZVTBQNFP-UHFFFAOYSA-N	CCOc1ccc(cc1)c2cc3nc(C4CCN(CC4)C(=O)OC(C)(C)C)c(cn3n2)C(=O)O	BroadT	BRD-K83152417	BRD-K83152417-001-05-0	ChemDiv Inc.	C614-5472			CCOc1ccc(cc1)-c1cc2nc(C3CCN(CC3)C(=O)OC(C)(C)C)c(cn2n1)C(O)=O	InChI=1S/C25H30N4O5/c1-5-33-18-8-6-16(7-9-18)20-14-21-26-22(19(23(30)31)15-29(21)27-20)17-10-12-28(13-11-17)24(32)34-25(2,3)4/h6-9,14-15,17H,5,10-13H2,1-4H3,(H,30,31)	ZFQFJBZVTBQNFP-UHFFFAOYSA-N	466.2216201							114595
AC1OH18Y	LSM-26058	BRD-A32930744	7203959	InChI=1S/C16H16N2O4S2/c1-9-10(2)23-16-12(9)13(19)14(24(21,22)18(16)3)15(20)17-11-7-5-4-6-8-11/h4-8,14H,1-3H3,(H,17,20)	QUMIRJUBNASFDK-UHFFFAOYSA-N	CN1c2sc(C)c(C)c2C(=O)C(C(=O)Nc3ccccc3)S1(=O)=O	BroadT	BRD-A32930744	BRD-A32930744-001-05-7	Maybridge	KM 04707			CN1c2sc(C)c(C)c2C(=O)C(C(=O)Nc2ccccc2)S1(=O)=O	InChI=1S/C16H16N2O4S2/c1-9-10(2)23-16-12(9)13(19)14(24(21,22)18(16)3)15(20)17-11-7-5-4-6-8-11/h4-8,14H,1-3H3,(H,17,20)	QUMIRJUBNASFDK-UHFFFAOYSA-N	364.055148392							114596
STK091964	LSM-26059	SID7975039, BRD-K78754138	740886	InChI=1S/C15H15BrN2O2/c1-11-5-6-14(13(16)8-11)20-10-15(19)18-9-12-4-2-3-7-17-12/h2-8H,9-10H2,1H3,(H,18,19)	VEZCYEMCCGWUJM-UHFFFAOYSA-N	Cc1ccc(OCC(=O)NCc2ccccn2)c(Br)c1	BroadT	BRD-K78754138	BRD-K78754138-001-05-8	ChemBridge Corporation	6095313			Cc1ccc(OCC(=O)NCc2ccccn2)c(Br)c1	InChI=1S/C15H15BrN2O2/c1-11-5-6-14(13(16)8-11)20-10-15(19)18-9-12-4-2-3-7-17-12/h2-8H,9-10H2,1H3,(H,18,19)	VEZCYEMCCGWUJM-UHFFFAOYSA-N	334.03169034							114597
CHEMDIV1_009184	LSM-26060	SID26665647, BRD-A39089577	3611383	InChI=1S/C27H29N3O3/c1-32-25-12-11-21(17-22(25)19-29-13-15-33-16-14-29)26-28-24-10-6-5-9-23(24)27(31)30(26)18-20-7-3-2-4-8-20/h2-12,17,26,28H,13-16,18-19H2,1H3	UBJVSEFSDIKCAH-UHFFFAOYSA-N	COc1ccc(cc1CN2CCOCC2)C3Nc4ccccc4C(=O)N3Cc5ccccc5	BroadT	BRD-A39089577	BRD-A39089577-001-05-7	InterBioScreen Ltd.	STOCK3S-60681			COc1ccc(cc1CN1CCOCC1)C1Nc2ccccc2C(=O)N1Cc1ccccc1	InChI=1S/C27H29N3O3/c1-32-25-12-11-21(17-22(25)19-29-13-15-33-16-14-29)26-28-24-10-6-5-9-23(24)27(31)30(26)18-20-7-3-2-4-8-20/h2-12,17,26,28H,13-16,18-19H2,1H3	UBJVSEFSDIKCAH-UHFFFAOYSA-N	443.220891818							114598
ST50132484	LSM-44156	SID4261748, BRD-K64483217	2218985	InChI=1S/C21H18N4OS/c1-2-6-17(7-3-1)8-5-15-27-21-24-23-20(18-10-12-22-13-11-18)25(21)16-19-9-4-14-26-19/h1-14H,15-16H2/b8-5+	RVJUHENLPLOUPV-VMPITWQZSA-N	C(Sc1nnc(c2ccncc2)n1Cc3occc3)\C=C\c4ccccc4	BroadT	BRD-K64483217	BRD-K64483217-001-05-4	ChemBridge Corporation	7911649			C(Sc1nnc(-c2ccncc2)n1Cc1ccco1)\C=C\c1ccccc1	InChI=1S/C21H18N4OS/c1-2-6-17(7-3-1)8-5-15-27-21-24-23-20(18-10-12-22-13-11-18)25(21)16-19-9-4-14-26-19/h1-14H,15-16H2/b8-5+	RVJUHENLPLOUPV-VMPITWQZSA-N	374.120131926							
SMR000005176	LSM-26062	SID26668986, SID844641, BRD-A08703841	646973	InChI=1S/C24H26N4O4S/c29-21(15-26-23(30)20-8-3-13-32-20)28(16-19-7-4-14-33-19)22(17-9-11-25-12-10-17)24(31)27-18-5-1-2-6-18/h3-4,7-14,18,22H,1-2,5-6,15-16H2,(H,26,30)(H,27,31)	UJEGVGXAONEETB-UHFFFAOYSA-N	O=C(CNC(=O)c1occc1)N(Cc2cccs2)C(C(=O)NC3CCCC3)c4ccncc4	BroadT	BRD-A08703841	BRD-A08703841-001-05-0	Asinex Ltd.	ASN 05584556			O=C(NC1CCCC1)C(N(Cc1cccs1)C(=O)CNC(=O)c1ccco1)c1ccncc1	InChI=1S/C24H26N4O4S/c29-21(15-26-23(30)20-8-3-13-32-20)28(16-19-7-4-14-33-19)22(17-9-11-25-12-10-17)24(31)27-18-5-1-2-6-18/h3-4,7-14,18,22H,1-2,5-6,15-16H2,(H,26,30)(H,27,31)	UJEGVGXAONEETB-UHFFFAOYSA-N	466.167476042							114600
MLS000595065	LSM-26063	SID17505793, BRD-K55078657	584988	InChI=1S/C16H15N3O4/c1-22-15(20)11-3-7-13(8-4-11)17-19-18-14-9-5-12(6-10-14)16(21)23-2/h3-10H,1-2H3,(H,17,18)	DFOAQDYVNHMJTD-UHFFFAOYSA-N	COC(=O)c1ccc(NN=Nc2ccc(cc2)C(=O)OC)cc1	BroadT	BRD-K55078657	BRD-K55078657-001-06-8	ChemBridge Corporation	5122224			COC(=O)c1ccc(NN=Nc2ccc(cc2)C(=O)OC)cc1	InChI=1S/C16H15N3O4/c1-22-15(20)11-3-7-13(8-4-11)17-19-18-14-9-5-12(6-10-14)16(21)23-2/h3-10H,1-2H3,(H,17,18)	DFOAQDYVNHMJTD-UHFFFAOYSA-N	313.10625599							114601
5-Bromo-n-(pyridin-2-ylmethyl)thiophene-2-sulfonamide	LSM-26064	SID861245, BRD-K13741983	662505	InChI=1S/C10H9BrN2O2S2/c11-9-4-5-10(16-9)17(14,15)13-7-8-3-1-2-6-12-8/h1-6,13H,7H2	KDGCJEMYUMZBIU-UHFFFAOYSA-N	Brc1ccc(s1)S(=O)(=O)NCc2ccccn2	BroadT	BRD-K13741983	BRD-K13741983-001-05-9	InterBioScreen Ltd.	STOCK4S-07618			Brc1ccc(s1)S(=O)(=O)NCc1ccccn1	InChI=1S/C10H9BrN2O2S2/c11-9-4-5-10(16-9)17(14,15)13-7-8-3-1-2-6-12-8/h1-6,13H,7H2	KDGCJEMYUMZBIU-UHFFFAOYSA-N	331.928881528							114602
AC1MH0E4	LSM-26065	SID4261113, BRD-A64180536	2969510	InChI=1S/C15H13ClF2N2O3/c16-10-3-1-4-11(17)9(10)7-20-14(21)12(18)8-19(15(20)22)13-5-2-6-23-13/h1,3-4,8,13H,2,5-7H2	SALKRGIQFMMYBW-UHFFFAOYSA-N	FC1=CN(C2CCCO2)C(=O)N(Cc3c(F)cccc3Cl)C1=O	BroadT	BRD-A64180536	BRD-A64180536-001-06-0	ChemBridge Corporation	7940027			Fc1cccc(Cl)c1Cn1c(=O)c(F)cn(C2CCCO2)c1=O	InChI=1S/C15H13ClF2N2O3/c16-10-3-1-4-11(17)9(10)7-20-14(21)12(18)8-19(15(20)22)13-5-2-6-23-13/h1,3-4,8,13H,2,5-7H2	SALKRGIQFMMYBW-UHFFFAOYSA-N	342.058276406							114603
SMR000076363	LSM-26066	SID4256900, BRD-A51205214	2953732	InChI=1S/C22H19N3O4/c1-2-18(28-17-7-4-3-5-8-17)20(26)23-16-12-10-15(11-13-16)21-24-25-22(29-21)19-9-6-14-27-19/h3-14,18H,2H2,1H3,(H,23,26)	IKIHJVJWZYYSGE-UHFFFAOYSA-N	CCC(Oc1ccccc1)C(=O)Nc2ccc(cc2)c3oc(nn3)c4occc4	BroadT	BRD-A51205214	BRD-A51205214-001-05-1	ChemBridge Corporation	7780060			CCC(Oc1ccccc1)C(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccco1	InChI=1S/C22H19N3O4/c1-2-18(28-17-7-4-3-5-8-17)20(26)23-16-12-10-15(11-13-16)21-24-25-22(29-21)19-9-6-14-27-19/h3-14,18H,2H2,1H3,(H,23,26)	IKIHJVJWZYYSGE-UHFFFAOYSA-N	389.137556118							114604
AC1LZQCN	LSM-26067	SID26663770, BRD-K09285442	2005759	InChI=1S/C22H31N3OS/c1-6-24(7-2)12-13-25-19-14-22(4,5)26-15-18(19)21(27)23-20(25)17-10-8-16(3)9-11-17/h8-11H,6-7,12-15H2,1-5H3	BOEFQIDOUBHAGI-UHFFFAOYSA-N	CCN(CC)CCN1C2=C(COC(C)(C)C2)C(=S)N=C1c3ccc(C)cc3	BroadT	BRD-K09285442	BRD-K09285442-001-05-8	InterBioScreen Ltd.	STOCK4S-03659			CCN(CC)CCn1c2CC(C)(C)OCc2c(=S)nc1-c1ccc(C)cc1	InChI=1S/C22H31N3OS/c1-6-24(7-2)12-13-25-19-14-22(4,5)26-15-18(19)21(27)23-20(25)17-10-8-16(3)9-11-17/h8-11H,6-7,12-15H2,1-5H3	BOEFQIDOUBHAGI-UHFFFAOYSA-N	385.218783332							114605
SMR000023437	LSM-26068	SID4250756, BRD-K13283010	3244522	InChI=1S/C16H14N2O3/c1-10-5-6-12(8-11(10)2)17-16(19)13-9-15(21-18-13)14-4-3-7-20-14/h3-9H,1-2H3,(H,17,19)	VETPWJIYZLGEPA-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2cc(on2)c3occc3)cc1C	BroadT	BRD-K13283010	BRD-K13283010-001-05-9	ChemDiv Inc.	C226-1775			Cc1ccc(NC(=O)c2cc(on2)-c2ccco2)cc1C	InChI=1S/C16H14N2O3/c1-10-5-6-12(8-11(10)2)17-16(19)13-9-15(21-18-13)14-4-3-7-20-14/h3-9H,1-2H3,(H,17,19)	VETPWJIYZLGEPA-UHFFFAOYSA-N	282.100442328							114606
AC1MPG9I	LSM-26069	SID14729336, BRD-A87973172	3384741	InChI=1S/C7H12N4OS/c1-10-4-5(11(2)7(10)12)9-6(8-4)13-3/h4-5H,1-3H3,(H,8,9)	LGAGNAHUEANJLO-UHFFFAOYSA-N	CSC1=NC2C(N1)N(C)C(=O)N2C	BroadT	BRD-A87973172	BRD-A87973172-001-05-2	InterBioScreen Ltd.	STOCK1S-22470			CSC1=NC2C(N1)N(C)C(=O)N2C	InChI=1S/C7H12N4OS/c1-10-4-5(11(2)7(10)12)9-6(8-4)13-3/h4-5H,1-3H3,(H,8,9)	LGAGNAHUEANJLO-UHFFFAOYSA-N	200.073181734							114607
MLS000093549	LSM-26070	SID4251118, BRD-K08265891	3244843	InChI=1S/C20H19N5O2/c1-23(2)16-9-7-15(8-10-16)22-19(26)12-25-20(27)18-11-14-5-3-4-6-17(14)24(18)13-21-25/h3-11,13H,12H2,1-2H3,(H,22,26)	PNCFCEUAEBGJQO-UHFFFAOYSA-N	CN(C)c1ccc(NC(=O)CN2N=Cn3c(cc4ccccc34)C2=O)cc1	BroadT	BRD-K08265891	BRD-K08265891-001-05-7	ChemDiv Inc.	C786-0151			CN(C)c1ccc(NC(=O)Cn2ncn3c4ccccc4cc3c2=O)cc1	InChI=1S/C20H19N5O2/c1-23(2)16-9-7-15(8-10-16)22-19(26)12-25-20(27)18-11-14-5-3-4-6-17(14)24(18)13-21-25/h3-11,13H,12H2,1-2H3,(H,22,26)	PNCFCEUAEBGJQO-UHFFFAOYSA-N	361.153874898							114608
BDBM62582	LSM-26071	BRD-K02234826	91897507	InChI=1S/C15H16N2O4/c1-10-8-15(17-21-10)16-7-6-13(18)12-5-4-11(19-2)9-14(12)20-3/h4-5,7-9H,6H2,1-3H3	WWZPLNFTFYRWFF-UHFFFAOYSA-N	COc1ccc(C(=O)CC=Nc2cc(C)on2)c(OC)c1	BroadT	BRD-K02234826	BRD-K02234826-001-06-7	Asinex Ltd.	BAS 01157756			COc1ccc(C(=O)CC=Nc2cc(C)on2)c(OC)c1	InChI=1S/C15H16N2O4/c1-10-8-15(17-21-10)16-7-6-13(18)12-5-4-11(19-2)9-14(12)20-3/h4-5,7-9H,6H2,1-3H3	WWZPLNFTFYRWFF-UHFFFAOYSA-N	288.111007012							114609
T0512-6917	LSM-26072	SID3713911, BRD-K44240812	2998596	InChI=1S/C13H15ClN2O3/c14-10-4-3-9(7-11(10)15)13(18)19-8-12(17)16-5-1-2-6-16/h3-4,7H,1-2,5-6,8,15H2	JFRRAZGNKRCJKY-UHFFFAOYSA-N	Nc1cc(ccc1Cl)C(=O)OCC(=O)N2CCCC2	BroadT	BRD-K44240812	BRD-K44240812-001-05-2	Enamine Ltd.	T0512-6917			Nc1cc(ccc1Cl)C(=O)OCC(=O)N1CCCC1	InChI=1S/C13H15ClN2O3/c14-10-4-3-9(7-11(10)15)13(18)19-8-12(17)16-5-1-2-6-16/h3-4,7H,1-2,5-6,8,15H2	JFRRAZGNKRCJKY-UHFFFAOYSA-N	282.07712007							114610
BDBM53834	LSM-26073	BRD-A73243731	91897154	InChI=1S/C28H22ClN3O4/c1-17-23(27(35)32(30(17)2)21-11-7-4-8-12-21)31-24(18-9-5-3-6-10-18)22(26(34)28(31)36)25(33)19-13-15-20(29)16-14-19/h3-16,22,24H,1-2H3	WYMAWXMGBPVKFH-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)N2C(C(C(=O)c3ccc(Cl)cc3)C(=O)C2=O)c4ccccc4)c5ccccc5	BroadT	BRD-A73243731	BRD-A73243731-001-05-0	InterBioScreen Ltd.	STOCK4S-94672			Cc1c(N2C(C(C(=O)c3ccc(Cl)cc3)C(=O)C2=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C	InChI=1S/C28H22ClN3O4/c1-17-23(27(35)32(30(17)2)21-11-7-4-8-12-21)31-24(18-9-5-3-6-10-18)22(26(34)28(31)36)25(33)19-13-15-20(29)16-14-19/h3-16,22,24H,1-2H3	WYMAWXMGBPVKFH-UHFFFAOYSA-N	499.129883924							114611
ZINC00455185	LSM-26074	BRD-K32329727	6846869	InChI=1S/C16H13N3O3/c1-10-18-14-5-3-2-4-13(14)16(22)19(10)17-9-11-6-7-12(20)8-15(11)21/h2-9,20-21H,1H3	VWILNSRDEYQMBQ-UHFFFAOYSA-N	CC1=Nc2ccccc2C(=O)N1N=Cc3ccc(O)cc3O	BroadT	BRD-K32329727	BRD-K32329727-001-05-1	ChemBridge Corporation	6572392			Cc1nc2ccccc2c(=O)n1N=Cc1ccc(O)cc1O	InChI=1S/C16H13N3O3/c1-10-18-14-5-3-2-4-13(14)16(22)19(10)17-9-11-6-7-12(20)8-15(11)21/h2-9,20-21H,1H3	VWILNSRDEYQMBQ-UHFFFAOYSA-N	295.095691306							
ZINC00549919	LSM-26075	SID7974439, BRD-K55224251	949151	InChI=1S/C16H15N5OS/c1-21-16(18-19-20-21)23-11-15(22)17-14-10-6-5-9-13(14)12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,17,22)	NLPJCTBGVLOWSX-UHFFFAOYSA-N	Cn1nnnc1SCC(=O)Nc2ccccc2c3ccccc3	BroadT	BRD-K55224251	BRD-K55224251-001-05-0	ChemBridge Corporation	6046830			Cn1nnnc1SCC(=O)Nc1ccccc1-c1ccccc1	InChI=1S/C16H15N5OS/c1-21-16(18-19-20-21)23-11-15(22)17-14-10-6-5-9-13(14)12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,17,22)	NLPJCTBGVLOWSX-UHFFFAOYSA-N	325.09973084							114613
STK386650	LSM-26076	SID845457, BRD-K34842511	647808	InChI=1S/C21H24N2O5/c1-25-17-4-3-5-18(26-2)20(17)21(24)23-10-8-22(9-11-23)13-15-6-7-16-19(12-15)28-14-27-16/h3-7,12H,8-11,13-14H2,1-2H3	LEYFAHXUUFDOGS-UHFFFAOYSA-N	COc1cccc(OC)c1C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2	BroadT	BRD-K34842511	BRD-K34842511-001-05-1	Asinex Ltd.	BAS 01042220			COc1cccc(OC)c1C(=O)N1CCN(Cc2ccc3OCOc3c2)CC1	InChI=1S/C21H24N2O5/c1-25-17-4-3-5-18(26-2)20(17)21(24)23-10-8-22(9-11-23)13-15-6-7-16-19(12-15)28-14-27-16/h3-7,12H,8-11,13-14H2,1-2H3	LEYFAHXUUFDOGS-UHFFFAOYSA-N	384.168521888							114614
BRD-A35991484	LSM-26077			InChI=1S/C31H31FN2O3/c1-37-27-17-13-24(14-18-27)28-8-5-19-33(30(35)25-11-12-25)29(20-22-6-3-2-4-7-22)31(36)34(28)21-23-9-15-26(32)16-10-23/h2-10,13-18,25,28-29H,11-12,19-21H2,1H3/t28?,29-/m1/s1	FGEYVMWKHSUPNE-YPJJGMIRSA-N	COc1ccc(cc1)C2C=CCN([C@H](Cc3ccccc3)C(=O)N2Cc4ccc(F)cc4)C(=O)C5CC5	BroadT	BRD-A35991484	BRD-A35991484-001-06-8	University of Kansas CMLD	KUC101609N			COc1ccc(cc1)C1C=CCN([C@H](Cc2ccccc2)C(=O)N1Cc1ccc(F)cc1)C(=O)C1CC1	InChI=1S/C31H31FN2O3/c1-37-27-17-13-24(14-18-27)28-8-5-19-33(30(35)25-11-12-25)29(20-22-6-3-2-4-7-22)31(36)34(28)21-23-9-15-26(32)16-10-23/h2-10,13-18,25,28-29H,11-12,19-21H2,1H3/t28?,29-/m1/s1	FGEYVMWKHSUPNE-YPJJGMIRSA-N	498.231871072							114615
MLS000683470	LSM-26078	SID22403368, BRD-K93001141	724237	InChI=1S/C15H30N2S/c1-12(2)10-17(11-13(3)4)15(18)16-14-8-6-5-7-9-14/h12-14H,5-11H2,1-4H3,(H,16,18)	RQQYMIYZTDXXRP-UHFFFAOYSA-N	CC(C)CN(CC(C)C)C(=NC1CCCCC1)S	BroadT	BRD-K93001141	BRD-K93001141-001-06-8	ChemBridge Corporation	6045206			CC(C)CN(CC(C)C)C(S)=NC1CCCCC1	InChI=1S/C15H30N2S/c1-12(2)10-17(11-13(3)4)15(18)16-14-8-6-5-7-9-14/h12-14H,5-11H2,1-4H3,(H,16,18)	RQQYMIYZTDXXRP-UHFFFAOYSA-N	270.21296967							114616
F1899-0639	LSM-26079	SID51087461, BRD-K55697397	7205933	InChI=1S/C20H25N3O2S/c1-2-25-17-10-8-15(9-11-17)18-12-13-20(23-22-18)26-14-19(24)21-16-6-4-3-5-7-16/h8-13,16H,2-7,14H2,1H3,(H,21,24)	MYUMGRCPXLLNIV-UHFFFAOYSA-N	CCOc1ccc(cc1)c2ccc(SCC(=O)NC3CCCCC3)nn2	BroadT	BRD-K55697397	BRD-K55697397-001-05-2	Life Chemicals Inc.	F1899-0639			CCOc1ccc(cc1)-c1ccc(SCC(=O)NC2CCCCC2)nn1	InChI=1S/C20H25N3O2S/c1-2-25-17-10-8-15(9-11-17)18-12-13-20(23-22-18)26-14-19(24)21-16-6-4-3-5-7-16/h8-13,16H,2-7,14H2,1H3,(H,21,24)	MYUMGRCPXLLNIV-UHFFFAOYSA-N	371.16674776							114617
SMR000219544	LSM-44157	SID17505891, BRD-K23568283	5587079	InChI=1S/C27H23N5O2/c1-29-26(33)22(17-28)16-23-25(30-24-14-8-9-15-32(24)27(23)34)31(18-20-10-4-2-5-11-20)19-21-12-6-3-7-13-21/h2-16H,18-19H2,1H3,(H,29,33)/b22-16+	LYMGYWLJIICTTO-CJLVFECKSA-N	CNC(=O)\C(=C\C1=C(N=C2C=CC=CN2C1=O)N(Cc3ccccc3)Cc4ccccc4)\C#N	BroadT	BRD-K23568283	BRD-K23568283-001-06-9	InterBioScreen Ltd.	STOCK3S-49500			CNC(=O)C(=C\c1c(nc2ccccn2c1=O)N(Cc1ccccc1)Cc1ccccc1)\C#N	InChI=1S/C27H23N5O2/c1-29-26(33)22(17-28)16-23-25(30-24-14-8-9-15-32(24)27(23)34)31(18-20-10-4-2-5-11-20)19-21-12-6-3-7-13-21/h2-16H,18-19H2,1H3,(H,29,33)/b22-16+	LYMGYWLJIICTTO-CJLVFECKSA-N	449.185175026							
F2004-0004	LSM-26081	SID24815685, BRD-K08050560	7207091	InChI=1S/C10H10N2OS/c1-2-14-10-6-5-8(11-12-10)9-4-3-7-13-9/h3-7H,2H2,1H3	HFNCCYWPVYMNGA-UHFFFAOYSA-N	CCSc1ccc(nn1)c2occc2	BroadT	BRD-K08050560	BRD-K08050560-001-05-3	Life Chemicals Inc.	F2004-0004			CCSc1ccc(nn1)-c1ccco1	InChI=1S/C10H10N2OS/c1-2-14-10-6-5-8(11-12-10)9-4-3-7-13-9/h3-7H,2H2,1H3	HFNCCYWPVYMNGA-UHFFFAOYSA-N	206.05138365							114619
ST50852559	LSM-26082	SID24797794, BRD-K57324894	970042	InChI=1S/C15H14N2O4S/c1-9(18)10-4-3-5-11(8-10)16-15(20)17-12-6-7-22-13(12)14(19)21-2/h3-8H,1-2H3,(H2,16,17,20)	RPYXURSFMWLPAE-UHFFFAOYSA-N	COC(=O)c1sccc1NC(=O)Nc2cccc(c2)C(=O)C	BroadT	BRD-K57324894	BRD-K57324894-001-05-9	ChemBridge Corporation	7792114			COC(=O)c1sccc1NC(=O)Nc1cccc(c1)C(C)=O	InChI=1S/C15H14N2O4S/c1-9(18)10-4-3-5-11(8-10)16-15(20)17-12-6-7-22-13(12)14(19)21-2/h3-8H,1-2H3,(H2,16,17,20)	RPYXURSFMWLPAE-UHFFFAOYSA-N	318.067427638							114620
ST50111554	LSM-26083	SID24794136, BRD-K10098695	972821	InChI=1S/C17H19N3O2S/c1-22-13-7-5-12(6-8-13)20-16(23)14(11-18)15(21)19-17(20)9-3-2-4-10-17/h5-8,23H,2-4,9-10H2,1H3,(H,19,21)	ZBNBGBHHMXWEFC-UHFFFAOYSA-N	COc1ccc(cc1)N2C(=C(C#N)C(=O)NC23CCCCC3)S	BroadT	BRD-K10098695	BRD-K10098695-001-05-6	ChemBridge Corporation	7866368			COc1ccc(cc1)N1C(S)=C(C#N)C(=O)NC11CCCCC1	InChI=1S/C17H19N3O2S/c1-22-13-7-5-12(6-8-13)20-16(23)14(11-18)15(21)19-17(20)9-3-2-4-10-17/h5-8,23H,2-4,9-10H2,1H3,(H,19,21)	ZBNBGBHHMXWEFC-UHFFFAOYSA-N	329.119797568							114621
AK-968/41926813	LSM-26084	SID14728099, BRD-K78479643	844747	InChI=1S/C12H8ClF4N3O/c1-20-10(7(13)5-18-20)11(21)19-9-4-6(12(15,16)17)2-3-8(9)14/h2-5H,1H3,(H,19,21)	FDZQQPMIHMLKKM-UHFFFAOYSA-N	Cn1ncc(Cl)c1C(=O)Nc2cc(ccc2F)C(F)(F)F	BroadT	BRD-K78479643	BRD-K78479643-001-05-0	Specs	AK-968/41926813			Cn1ncc(Cl)c1C(=O)Nc1cc(ccc1F)C(F)(F)F	InChI=1S/C12H8ClF4N3O/c1-20-10(7(13)5-18-20)11(21)19-9-4-6(12(15,16)17)2-3-8(9)14/h2-5H,1H3,(H,19,21)	FDZQQPMIHMLKKM-UHFFFAOYSA-N	321.029202416							114622
AK-968/40940885	LSM-26085	SID17387173, BRD-K21240553	1225832	InChI=1S/C12H12ClN5O3/c1-7-12(18(20)21)8(2)17(16-7)6-11(19)15-10-4-3-9(13)5-14-10/h3-5H,6H2,1-2H3,(H,14,15,19)	WVYVUDBLFBLFJK-UHFFFAOYSA-N	Cc1nn(CC(=O)Nc2ccc(Cl)cn2)c(C)c1[N+](=O)[O-]	BroadT	BRD-K21240553	BRD-K21240553-001-05-2	Specs	AK-968/40940885			Cc1nn(CC(=O)Nc2ccc(Cl)cn2)c(C)c1[N+]([O-])=O	InChI=1S/C12H12ClN5O3/c1-7-12(18(20)21)8(2)17(16-7)6-11(19)15-10-4-3-9(13)5-14-10/h3-5H,6H2,1-2H3,(H,14,15,19)	WVYVUDBLFBLFJK-UHFFFAOYSA-N	309.062867004							114623
MLS000717952	LSM-44158	SID24780459, BRD-K04781025	5750590	InChI=1S/C15H14Cl2N2O/c1-9-12(10(2)19(3)18-9)6-7-15(20)13-5-4-11(16)8-14(13)17/h4-8H,1-3H3/b7-6+	ZTGHPXIQAQTMOD-VOTSOKGWSA-N	Cc1nn(C)c(C)c1\C=C\C(=O)c2ccc(Cl)cc2Cl	BroadT	BRD-K04781025	BRD-K04781025-001-06-4	Asinex Ltd.	BAS 00212570			Cc1nn(C)c(C)c1\C=C\C(=O)c1ccc(Cl)cc1Cl	InChI=1S/C15H14Cl2N2O/c1-9-12(10(2)19(3)18-9)6-7-15(20)13-5-4-11(16)8-14(13)17/h4-8H,1-3H3/b7-6+	ZTGHPXIQAQTMOD-VOTSOKGWSA-N	308.048318508							
ZINC00811122	LSM-26087	SID847169, BRD-K36095190	649567	InChI=1S/C17H16ClN3O2/c1-12(22)19-17-20-14-7-3-4-8-15(14)21(17)10-11-23-16-9-5-2-6-13(16)18/h2-9H,10-11H2,1H3,(H,19,20,22)	APRMNRPQKUTJHA-UHFFFAOYSA-N	CC(=O)Nc1nc2ccccc2n1CCOc3ccccc3Cl	BroadT	BRD-K36095190	BRD-K36095190-001-07-8	Asinex Ltd.	BAS 07806071			CC(=O)Nc1nc2ccccc2n1CCOc1ccccc1Cl	InChI=1S/C17H16ClN3O2/c1-12(22)19-17-20-14-7-3-4-8-15(14)21(17)10-11-23-16-9-5-2-6-13(16)18/h2-9H,10-11H2,1H3,(H,19,20,22)	APRMNRPQKUTJHA-UHFFFAOYSA-N	329.093104492							114625
5-(4-Fluoro-phenyl)-oxazole-4-carboxylic acid (2-piperidin-1-yl-phenyl)-amide	LSM-26088	SID843694, BRD-K45845354	645997	InChI=1S/C21H20FN3O2/c22-16-10-8-15(9-11-16)20-19(23-14-27-20)21(26)24-17-6-2-3-7-18(17)25-12-4-1-5-13-25/h2-3,6-11,14H,1,4-5,12-13H2,(H,24,26)	KIRMGLGMDDHLCV-UHFFFAOYSA-N	Fc1ccc(cc1)c2ocnc2C(=O)Nc3ccccc3N4CCCCC4	BroadT	BRD-K45845354	BRD-K45845354-001-05-1	Asinex Ltd.	ASN 10398171			Fc1ccc(cc1)-c1ocnc1C(=O)Nc1ccccc1N1CCCCC1	InChI=1S/C21H20FN3O2/c22-16-10-8-15(9-11-16)20-19(23-14-27-20)21(26)24-17-6-2-3-7-18(17)25-12-4-1-5-13-25/h2-3,6-11,14H,1,4-5,12-13H2,(H,24,26)	KIRMGLGMDDHLCV-UHFFFAOYSA-N	365.15395511							114626
MLS000663846	LSM-44159	SID24788197, BRD-K60277684	5504784	InChI=1S/C14H12N2O2S/c1-2-16-13(17)12(19-14(16)18)7-9-8-15-11-6-4-3-5-10(9)11/h3-8,15H,2H2,1H3/b12-7+	WHLQDPQWTKIGLW-KPKJPENVSA-N	CCN1C(=O)S\C(=C\c2c[nH]c3ccccc23)\C1=O	BroadT	BRD-K60277684	BRD-K60277684-001-12-4	ChemBridge Corporation	7470008			CCN1C(=O)S\C(=C\c2c[nH]c3ccccc23)C1=O	InChI=1S/C14H12N2O2S/c1-2-16-13(17)12(19-14(16)18)7-9-8-15-11-6-4-3-5-10(9)11/h3-8,15H,2H2,1H3/b12-7+	WHLQDPQWTKIGLW-KPKJPENVSA-N	272.061948334							
MLS000583048	LSM-26090	SID17510366, BRD-K23550710	12005192	InChI=1S/C23H23N5O6/c1-13-8-20(26-25-13)24-21(29)12-27-17-11-19(34-4)18(33-3)10-16(17)22(30)28(23(27)31)14-6-5-7-15(9-14)32-2/h5-11H,12H2,1-4H3,(H2,24,25,26,29)	CSJPKRLBZNAWAB-UHFFFAOYSA-N	COc1cccc(c1)N2C(=O)N(CC(=O)Nc3cc(C)[nH]n3)c4cc(OC)c(OC)cc4C2=O	BroadT	BRD-K23550710	BRD-K23550710-001-05-2	ChemDiv Inc.	C260-3014			COc1cccc(c1)-n1c(=O)n(CC(=O)Nc2cc(C)[nH]n2)c2cc(OC)c(OC)cc2c1=O	InChI=1S/C23H23N5O6/c1-13-8-20(26-25-13)24-21(29)12-27-17-11-19(34-4)18(33-3)10-16(17)22(30)28(23(27)31)14-6-5-7-15(9-14)32-2/h5-11H,12H2,1-4H3,(H2,24,25,26,29)	CSJPKRLBZNAWAB-UHFFFAOYSA-N	465.164833506							114628
SMR000105429	LSM-26091	SID7977259, BRD-K74055156	1364199	InChI=1S/C21H16N4O3/c26-21(14-6-9-19-20(12-14)28-11-10-27-19)22-15-7-8-17-18(13-15)24-25(23-17)16-4-2-1-3-5-16/h1-9,12-13H,10-11H2,(H,22,26)	LMGWAOOAXAUGMU-UHFFFAOYSA-N	O=C(Nc1ccc2nn(nc2c1)c3ccccc3)c4ccc5OCCOc5c4	BroadT	BRD-K74055156	BRD-K74055156-001-05-1	ChemBridge Corporation	6026505			O=C(Nc1ccc2nn(nc2c1)-c1ccccc1)c1ccc2OCCOc2c1	InChI=1S/C21H16N4O3/c26-21(14-6-9-19-20(12-14)28-11-10-27-19)22-15-7-8-17-18(13-15)24-25(23-17)16-4-2-1-3-5-16/h1-9,12-13H,10-11H2,(H,22,26)	LMGWAOOAXAUGMU-UHFFFAOYSA-N	372.122240412							114629
ASN 09378846	LSM-26092	SID848927, BRD-K73766778	651389	InChI=1S/C19H17N5O2S/c1-11-3-5-14-15(7-11)22-19(21-14)13-4-6-18(20-9-13)27-10-17(25)23-16-8-12(2)26-24-16/h3-9H,10H2,1-2H3,(H,21,22)(H,23,24,25)	VJVIPZICOYQWJL-UHFFFAOYSA-N	Cc1onc(NC(=O)CSc2ccc(cn2)c3nc4cc(C)ccc4[nH]3)c1	BroadT	BRD-K73766778	BRD-K73766778-001-05-2	Asinex Ltd.	ASN 09378846			Cc1cc(NC(=O)CSc2ccc(cn2)-c2nc3cc(C)ccc3[nH]2)no1	InChI=1S/C19H17N5O2S/c1-11-3-5-14-15(7-11)22-19(21-14)13-4-6-18(20-9-13)27-10-17(25)23-16-8-12(2)26-24-16/h3-9H,10H2,1-2H3,(H,21,22)(H,23,24,25)	VJVIPZICOYQWJL-UHFFFAOYSA-N	379.110295524							114630
9B-120	LSM-26093	BRD-K21413586	6789369	InChI=1S/C16H11F2N3O/c17-11-6-7-14(13(18)8-11)19-9-12-15(20-21-16(12)22)10-4-2-1-3-5-10/h1-9H,(H2,20,21,22)	VYBHBUBYVYGEAG-UHFFFAOYSA-N	Oc1[nH]nc(c1C=Nc2ccc(F)cc2F)c3ccccc3	BroadT	BRD-K21413586	BRD-K21413586-001-05-6	Key Organics Ltd.	9B-120			Oc1[nH]nc(c1C=Nc1ccc(F)cc1F)-c1ccccc1	InChI=1S/C16H11F2N3O/c17-11-6-7-14(13(18)8-11)19-9-12-15(20-21-16(12)22)10-4-2-1-3-5-10/h1-9H,(H2,20,21,22)	VYBHBUBYVYGEAG-UHFFFAOYSA-N	299.087018402							
AC1NBFV9	LSM-26094	BRD-K90006227	4467445	InChI=1S/C21H21N3OS/c1-3-7-18(8-4-1)24(19-9-5-2-6-10-19)22-17-20-11-12-21(26-20)23-13-15-25-16-14-23/h1-12,17H,13-16H2	LKKAEMXPPQJMQQ-UHFFFAOYSA-N	C1CN(CCO1)c2ccc(C=NN(c3ccccc3)c4ccccc4)s2	BroadT	BRD-K90006227	BRD-K90006227-001-05-9	Enamine Ltd.	T0506-6388			C1CN(CCO1)c1ccc(C=NN(c2ccccc2)c2ccccc2)s1	InChI=1S/C21H21N3OS/c1-3-7-18(8-4-1)24(19-9-5-2-6-10-19)22-17-20-11-12-21(26-20)23-13-15-25-16-14-23/h1-12,17H,13-16H2	LKKAEMXPPQJMQQ-UHFFFAOYSA-N	363.140533012							114632
SMR000121348	LSM-26095	SID14726793, BRD-K85147224	1036292	InChI=1S/C19H23NO6S/c1-6-12-10-13(19(22)26-7-2)18(27-12)20-17(21)11-8-14(23-3)16(25-5)15(9-11)24-4/h8-10H,6-7H2,1-5H3,(H,20,21)	NJAUWUHPIUZCDO-UHFFFAOYSA-N	CCOC(=O)c1cc(CC)sc1NC(=O)c2cc(OC)c(OC)c(OC)c2	BroadT	BRD-K85147224	BRD-K85147224-001-05-1	Asinex Ltd.	BAS 06105100			CCOC(=O)c1cc(CC)sc1NC(=O)c1cc(OC)c(OC)c(OC)c1	InChI=1S/C19H23NO6S/c1-6-12-10-13(19(22)26-7-2)18(27-12)20-17(21)11-8-14(23-3)16(25-5)15(9-11)24-4/h8-10H,6-7H2,1-5H3,(H,20,21)	NJAUWUHPIUZCDO-UHFFFAOYSA-N	393.124608156							114633
SMR000014801	LSM-26096	SID845624, BRD-K01997760	647979	InChI=1S/C18H19NO6/c1-3-22-17(20)10-19-18(21)13-9-15(25-11(13)2)12-4-5-14-16(8-12)24-7-6-23-14/h4-5,8-9H,3,6-7,10H2,1-2H3,(H,19,21)	HOSWDHAYFAMUHG-UHFFFAOYSA-N	CCOC(=O)CNC(=O)c1cc(oc1C)c2ccc3OCCOc3c2	BroadT	BRD-K01997760	BRD-K01997760-001-05-0	Asinex Ltd.	BAS 08186962			CCOC(=O)CNC(=O)c1cc(oc1C)-c1ccc2OCCOc2c1	InChI=1S/C18H19NO6/c1-3-22-17(20)10-19-18(21)13-9-15(25-11(13)2)12-4-5-14-16(8-12)24-7-6-23-14/h4-5,8-9H,3,6-7,10H2,1-2H3,(H,19,21)	HOSWDHAYFAMUHG-UHFFFAOYSA-N	345.121237338							114634
99991-93-2	LSM-26097	SID24834795, BRD-K20406181	2398074	InChI=1S/C11H20N4O2/c1-3-5-6-13-8-9(12)15(7-4-2)11(17)14-10(8)16/h13H,3-7,12H2,1-2H3,(H,14,16,17)	NRFSRNQYQZSBOL-UHFFFAOYSA-N	CCCCNC1=C(N)N(CCC)C(=O)NC1=O	BroadT	BRD-K20406181	BRD-K20406181-001-05-0	Enamine Ltd.	T0520-0498			CCCCNc1c(N)n(CCC)c(=O)[nH]c1=O	InChI=1S/C11H20N4O2/c1-3-5-6-13-8-9(12)15(7-4-2)11(17)14-10(8)16/h13H,3-7,12H2,1-2H3,(H,14,16,17)	NRFSRNQYQZSBOL-UHFFFAOYSA-N	240.15862592							114635
MLS000834524	LSM-26098	SID24779791, BRD-K20856604	16187186	InChI=1S/C31H36N2O6S/c1-2-36-31-23(7-5-15-34)24(25-19-40-29-8-4-3-6-22(25)29)17-28(39-31)30(35)33-13-11-32(12-14-33)18-21-9-10-26-27(16-21)38-20-37-26/h3-4,6,8-10,16-17,19,23-24,31,34H,2,5,7,11-15,18,20H2,1H3/t23-,24+,31-/m1/s1	HMWUPEBWYBVNQB-ULPIOCOXSA-N	CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2csc3ccccc23)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4	BroadT	BRD-K20856604	BRD-K20856604-001-07-1	Harvard University	((2R,3R,4S)-4-(benzo[b]thiophen-3-yl)-2-ethoxy-3-(3-hydroxypropyl)-3,4-dihydro-2H-pyran-6-yl)(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)methanone DHPC11_001266			CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c1csc2ccccc12)C(=O)N1CCN(Cc2ccc3OCOc3c2)CC1	InChI=1S/C31H36N2O6S/c1-2-36-31-23(7-5-15-34)24(25-19-40-29-8-4-3-6-22(25)29)17-28(39-31)30(35)33-13-11-32(12-14-33)18-21-9-10-26-27(16-21)38-20-37-26/h3-4,6,8-10,16-17,19,23-24,31,34H,2,5,7,11-15,18,20H2,1H3/t23-,24+,31-/m1/s1	HMWUPEBWYBVNQB-ULPIOCOXSA-N	564.229407582							114636
CID 75651707	LSM-26099	BRD-A93967003	75651707	InChI=1S/C20H24F3NO7/c1-5-29-16(25)14(17(26)30-6-2)11-24-15-9-8-13(10-12(15)4)19(28,20(21,22)23)18(27)31-7-3/h8-11,14,28H,5-7H2,1-4H3	VCWSVXNNABRGLP-UHFFFAOYSA-N	CCOC(=O)C(C=Nc1ccc(cc1C)C(O)(C(=O)OCC)C(F)(F)F)C(=O)OCC	BroadT	BRD-A93967003	BRD-A93967003-001-06-9	Specs	AG-389/33007050			CCOC(=O)C(C=Nc1ccc(cc1C)C(O)(C(=O)OCC)C(F)(F)F)C(=O)OCC	InChI=1S/C20H24F3NO7/c1-5-29-16(25)14(17(26)30-6-2)11-24-15-9-8-13(10-12(15)4)19(28,20(21,22)23)18(27)31-7-3/h8-11,14,28H,5-7H2,1-4H3	VCWSVXNNABRGLP-UHFFFAOYSA-N	447.150486718							114637
MLS000732756	LSM-26100	SID24798427, BRD-A78995875	16190098	InChI=1S/C25H26N2O/c1-17-5-2-8-21(26-17)16-27-14-4-7-20(15-27)25(28)23-13-12-19-11-10-18-6-3-9-22(23)24(18)19/h2-3,5-6,8-9,12-13,20H,4,7,10-11,14-16H2,1H3	DESFKVDNHFKWMY-UHFFFAOYSA-N	Cc1cccc(CN2CCCC(C2)C(=O)c3ccc4CCc5cccc3c45)n1	BroadT	BRD-A78995875	BRD-A78995875-001-06-4	ChemBridge Corporation	14454444			Cc1cccc(CN2CCCC(C2)C(=O)c2ccc3CCc4cccc2c34)n1	InChI=1S/C25H26N2O/c1-17-5-2-8-21(26-17)16-27-14-4-7-20(15-27)25(28)23-13-12-19-11-10-18-6-3-9-22(23)24(18)19/h2-3,5-6,8-9,12-13,20H,4,7,10-11,14-16H2,1H3	DESFKVDNHFKWMY-UHFFFAOYSA-N	370.204513472							114638
AC1O03UV	LSM-44160	SID24828851, BRD-A09839523	6002691	InChI=1S/C15H13NO5/c1-19-12-4-2-10(3-5-12)8-11(9-16)14(17)21-13-6-7-20-15(13)18/h2-5,8,13H,6-7H2,1H3/b11-8+	BEFGYGOCZDNARV-DHZHZOJOSA-N	COc1ccc(\C=C(/C#N)\C(=O)OC2CCOC2=O)cc1	BroadT	BRD-A09839523	BRD-A09839523-001-05-6	Enamine Ltd.	T0512-1364			COc1ccc(cc1)\C=C(/C#N)C(=O)OC1CCOC1=O	InChI=1S/C15H13NO5/c1-19-12-4-2-10(3-5-12)8-11(9-16)14(17)21-13-6-7-20-15(13)18/h2-5,8,13H,6-7H2,1H3/b11-8+	BEFGYGOCZDNARV-DHZHZOJOSA-N	287.079372526							
AC1NI8KA	LSM-26102	SID22410591, BRD-K09963346	4802105	InChI=1S/C17H22ClN5O3S2/c1-22-12-19-21-17(22)27-11-16(24)20-15-10-13(6-7-14(15)18)28(25,26)23-8-4-2-3-5-9-23/h6-7,10,12H,2-5,8-9,11H2,1H3,(H,20,24)	XFNCTCYYVGIOJU-UHFFFAOYSA-N	Cn1cnnc1SCC(=O)Nc2cc(ccc2Cl)S(=O)(=O)N3CCCCCC3	BroadT	BRD-K09963346	BRD-K09963346-001-05-7	Enamine Ltd.	ZT-0197701			Cn1cnnc1SCC(=O)Nc1cc(ccc1Cl)S(=O)(=O)N1CCCCCC1	InChI=1S/C17H22ClN5O3S2/c1-22-12-19-21-17(22)27-11-16(24)20-15-10-13(6-7-14(15)18)28(25,26)23-8-4-2-3-5-9-23/h6-7,10,12H,2-5,8-9,11H2,1H3,(H,20,24)	XFNCTCYYVGIOJU-UHFFFAOYSA-N	443.085258704							114640
BAS 08315483	LSM-26103	SID7968519, BRD-K79516550	913778	InChI=1S/C17H17N3O4/c1-21-10-15-19-16(20-24-15)13-8-9-14(18-17(13)23-3)11-4-6-12(22-2)7-5-11/h4-9H,10H2,1-3H3	YFVSYSMVVCKJCH-UHFFFAOYSA-N	COCc1onc(n1)c2ccc(nc2OC)c3ccc(OC)cc3	BroadT	BRD-K79516550	BRD-K79516550-001-04-2	ChemDiv Inc.	6917-0151			COCc1nc(no1)-c1ccc(nc1OC)-c1ccc(OC)cc1	InChI=1S/C17H17N3O4/c1-21-10-15-19-16(20-24-15)13-8-9-14(18-17(13)23-3)11-4-6-12(22-2)7-5-11/h4-9H,10H2,1-3H3	YFVSYSMVVCKJCH-UHFFFAOYSA-N	327.121906054							114641
MLS000390308	LSM-26104	SID22404288, BRD-K61807159	3304841	InChI=1S/C10H9BrN6O3S/c11-6-3-5(17(19)20)1-2-7(6)13-8(18)4-21-10-14-9(12)15-16-10/h1-3H,4H2,(H,13,18)(H3,12,14,15,16)	CUPCYHDBGNZNNE-UHFFFAOYSA-N	Nc1n[nH]c(SCC(=O)Nc2ccc(cc2Br)[N+](=O)[O-])n1	BroadT	BRD-K61807159	BRD-K61807159-001-06-5	Enamine Ltd.	T0511-3116			Nc1n[nH]c(SCC(=O)Nc2ccc(cc2Br)[N+]([O-])=O)n1	InChI=1S/C10H9BrN6O3S/c11-6-3-5(17(19)20)1-2-7(6)13-8(18)4-21-10-14-9(12)15-16-10/h1-3H,4H2,(H,13,18)(H3,12,14,15,16)	CUPCYHDBGNZNNE-UHFFFAOYSA-N	371.964021498							114642
MLS000539207	LSM-26105	SID17385792, BRD-K39399785	901289	InChI=1S/C11H7Cl3N2S/c12-6-4-8(14)10(5-7(6)13)17-11-9(15)2-1-3-16-11/h1-5H,15H2	YAOQBIXSQAUGGK-UHFFFAOYSA-N	Nc1cccnc1Sc2cc(Cl)c(Cl)cc2Cl	BroadT	BRD-K39399785	BRD-K39399785-001-05-6	Specs	AJ-333/09216012			Nc1cccnc1Sc1cc(Cl)c(Cl)cc1Cl	InChI=1S/C11H7Cl3N2S/c12-6-4-8(14)10(5-7(6)13)17-11-9(15)2-1-3-16-11/h1-5H,15H2	YAOQBIXSQAUGGK-UHFFFAOYSA-N	303.939552064							114643
ASN 06536979	LSM-26106	SID24797083, BRD-K04279360	3221575	InChI=1S/C19H25N5OS/c1-13-9-14(2)16-11-15(12-20)18(24-17(16)10-13)21-6-7-23-19(26)22-5-4-8-25-3/h9-11H,4-8H2,1-3H3,(H,21,24)(H2,22,23,26)	PMMDMFAGRFABCV-UHFFFAOYSA-N	COCCCN=C(S)NCCNc1nc2cc(C)cc(C)c2cc1C#N	BroadT	BRD-K04279360	BRD-K04279360-001-06-2	Asinex Ltd.	ASN 06536979			COCCCN=C(S)NCCNc1nc2cc(C)cc(C)c2cc1C#N	InChI=1S/C19H25N5OS/c1-13-9-14(2)16-11-15(12-20)18(24-17(16)10-13)21-6-7-23-19(26)22-5-4-8-25-3/h9-11H,4-8H2,1-3H3,(H,21,24)(H2,22,23,26)	PMMDMFAGRFABCV-UHFFFAOYSA-N	371.17798116							114644
AC1NRNRL	LSM-26107	SID24781677, BRD-K63881275	5295326	InChI=1S/C16H26N4O/c1-5-20(6-2)9-7-8-18-16-15(11-17)14(12-21-4)10-13(3)19-16/h10H,5-9,12H2,1-4H3,(H,18,19)	UZEWKCCRRLSPDD-UHFFFAOYSA-N	CCN(CC)CCCNc1nc(C)cc(COC)c1C#N	BroadT	BRD-K63881275	BRD-K63881275-001-05-9	ChemDiv Inc.	8016-8668			CCN(CC)CCCNc1nc(C)cc(COC)c1C#N	InChI=1S/C16H26N4O/c1-5-20(6-2)9-7-8-18-16-15(11-17)14(12-21-4)10-13(3)19-16/h10H,5-9,12H2,1-4H3,(H,18,19)	UZEWKCCRRLSPDD-UHFFFAOYSA-N	290.210661492							114645
MCULE-2810534720	LSM-26108	BRD-K64344152	25798805	InChI=1S/C16H13ClN2O3/c1-10(18-9-11-4-2-5-12(17)8-11)14-16(20)22-15(19-14)13-6-3-7-21-13/h2-8,20H,9H2,1H3	DVBZMFYFRRHLDH-UHFFFAOYSA-N	CC(=NCc1cccc(Cl)c1)c2nc(oc2O)c3occc3	BroadT	BRD-K64344152	BRD-K64344152-001-06-3	Specs	AJ-030/12105820			CC(=NCc1cccc(Cl)c1)c1nc(oc1O)-c1ccco1	InChI=1S/C16H13ClN2O3/c1-10(18-9-11-4-2-5-12(17)8-11)14-16(20)22-15(19-14)13-6-3-7-21-13/h2-8,20H,9H2,1H3	DVBZMFYFRRHLDH-UHFFFAOYSA-N	316.061470006							
ZINC00492913	LSM-26109	SID26665354, BRD-K54725510	614657	InChI=1S/C12H6N2O3/c15-12-9-2-1-5-13-11(9)8-4-3-7(14(16)17)6-10(8)12/h1-6H	UHKGMCVBCVDFKM-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2c(c1)C(=O)c3cccnc23	BroadT	BRD-K54725510	BRD-K54725510-001-07-0	InterBioScreen Ltd.	STOCK1S-04382			[O-][N+](=O)c1ccc-2c(c1)C(=O)c1cccnc-21	InChI=1S/C12H6N2O3/c15-12-9-2-1-5-13-11(9)8-4-3-7(14(16)17)6-10(8)12/h1-6H	UHKGMCVBCVDFKM-UHFFFAOYSA-N	226.037842072							114647
MLS000771025	LSM-26110	SID24829877, BRD-K31388867	2100904	InChI=1S/C17H13BrF3N7/c1-9-15-12(17(19,20)21)8-13(10-2-4-11(18)5-3-10)22-16(15)28(25-9)7-6-14-23-26-27-24-14/h2-5,8H,6-7H2,1H3,(H,23,24,26,27)	DIDCTDHQEYBHHD-UHFFFAOYSA-N	Cc1nn(CCc2nn[nH]n2)c3nc(cc(c13)C(F)(F)F)c4ccc(Br)cc4	BroadT	BRD-K31388867	BRD-K31388867-001-05-8	Enamine Ltd.	T5234956			Cc1nn(CCc2nn[nH]n2)c2nc(cc(c12)C(F)(F)F)-c1ccc(Br)cc1	InChI=1S/C17H13BrF3N7/c1-9-15-12(17(19,20)21)8-13(10-2-4-11(18)5-3-10)22-16(15)28(25-9)7-6-14-23-26-27-24-14/h2-5,8H,6-7H2,1H3,(H,23,24,26,27)	DIDCTDHQEYBHHD-UHFFFAOYSA-N	451.036790686							114648
JDL 167	LSM-26111	SID22400840, BRD-K00289030	902007	InChI=1S/C11H10ClN3O2S/c12-8-1-3-9(4-2-8)15-10-5-6-14-7-11(10)18(13,16)17/h1-7H,(H,14,15)(H2,13,16,17)	DYKKJJAURORKBH-UHFFFAOYSA-N	NS(=O)(=O)c1cnccc1Nc2ccc(Cl)cc2	BroadT	BRD-K00289030	BRD-K00289030-001-05-7	Specs	AJ-333/25006237			NS(=O)(=O)c1cnccc1Nc1ccc(Cl)cc1	InChI=1S/C11H10ClN3O2S/c12-8-1-3-9(4-2-8)15-10-5-6-14-7-11(10)18(13,16)17/h1-7H,(H,14,15)(H2,13,16,17)	DYKKJJAURORKBH-UHFFFAOYSA-N	283.01822499							114649
AJ-333/36117039	LSM-26112	SID22400842, BRD-K67547420	902058	InChI=1S/C9H9NO3S/c1-6(11)5-14-8-3-2-7(4-10-8)9(12)13/h2-4H,5H2,1H3,(H,12,13)	LRBIKSYRCFHKBN-UHFFFAOYSA-N	CC(=O)CSc1ccc(cn1)C(=O)O	BroadT	BRD-K67547420	BRD-K67547420-001-05-6	Specs	AJ-333/36117039			CC(=O)CSc1ccc(cn1)C(O)=O	InChI=1S/C9H9NO3S/c1-6(11)5-14-8-3-2-7(4-10-8)9(12)13/h2-4H,5H2,1H3,(H,12,13)	LRBIKSYRCFHKBN-UHFFFAOYSA-N	211.030313848							114650
SMR000144117	LSM-26113	SID14732460, BRD-K41006170	930809	InChI=1S/C17H17N3OS/c1-10-6-8-11(9-7-10)15-19-16-14(17(21)20(15)18)12-4-2-3-5-13(12)22-16/h6-9H,2-5,18H2,1H3	SZZIEUHVPZVEIC-UHFFFAOYSA-N	Cc1ccc(cc1)C2=Nc3sc4CCCCc4c3C(=O)N2N	BroadT	BRD-K41006170	BRD-K41006170-001-05-6	ChemBridge Corporation	7859151			Cc1ccc(cc1)-c1nc2sc3CCCCc3c2c(=O)n1N	InChI=1S/C17H17N3OS/c1-10-6-8-11(9-7-10)15-19-16-14(17(21)20(15)18)12-4-2-3-5-13(12)22-16/h6-9H,2-5,18H2,1H3	SZZIEUHVPZVEIC-UHFFFAOYSA-N	311.109232884							114651
BRD-A29544928	LSM-26114			InChI=1S/C24H25NO4/c1-15-20(23(27)29-14-16-8-5-4-6-9-16)22(19-10-7-11-28-19)21-17(25-15)12-24(2,3)13-18(21)26/h4-11,21-22H,12-14H2,1-3H3	ADVVHPUGRWNUCK-UHFFFAOYSA-N	CC1=C(C(C2C(=O)CC(C)(C)CC2=N1)c3occc3)C(=O)OCc4ccccc4	BroadT	BRD-A29544928	BRD-A29544928-001-05-9	ChemBridge Corporation	6044854			CC1=C(C(C2C(=O)CC(C)(C)CC2=N1)c1ccco1)C(=O)OCc1ccccc1	InChI=1S/C24H25NO4/c1-15-20(23(27)29-14-16-8-5-4-6-9-16)22(19-10-7-11-28-19)21-17(25-15)12-24(2,3)13-18(21)26/h4-11,21-22H,12-14H2,1-3H3	ADVVHPUGRWNUCK-UHFFFAOYSA-N	391.17835829							114652
ZINC04971104	LSM-26115	SID14727273, BRD-K79925921	3225246	InChI=1S/C16H14N2O3S/c1-18-12-7-8-22-14(12)9-13(18)15(19)17-11-5-3-10(4-6-11)16(20)21-2/h3-9H,1-2H3,(H,17,19)	SPJSKAAMTRHOJN-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=O)c2cc3sccc3n2C)cc1	BroadT	BRD-K79925921	BRD-K79925921-001-05-4	Asinex Ltd.	ASN 06915081			COC(=O)c1ccc(NC(=O)c2cc3sccc3n2C)cc1	InChI=1S/C16H14N2O3S/c1-18-12-7-8-22-14(12)9-13(18)15(19)17-11-5-3-10(4-6-11)16(20)21-2/h3-9H,1-2H3,(H,17,19)	SPJSKAAMTRHOJN-UHFFFAOYSA-N	314.072513018							114653
5-[1-(4-Methylbenzyl)-1H-pyrazol-3-yl]-2-phenyl-1,3-thiazole	LSM-26116	SID14730702, BRD-K66197367	1476741	InChI=1S/C20H17N3S/c1-15-7-9-16(10-8-15)14-23-12-11-18(22-23)19-13-21-20(24-19)17-5-3-2-4-6-17/h2-13H,14H2,1H3	SMZNGPNGQZVFPT-UHFFFAOYSA-N	Cc1ccc(Cn2ccc(n2)c3cnc(s3)c4ccccc4)cc1	BroadT	BRD-K66197367	BRD-K66197367-001-05-6	Key Organics Ltd.	4M-036			Cc1ccc(Cn2ccc(n2)-c2cnc(s2)-c2ccccc2)cc1	InChI=1S/C20H17N3S/c1-15-7-9-16(10-8-15)14-23-12-11-18(22-23)19-13-21-20(24-19)17-5-3-2-4-6-17/h2-13H,14H2,1H3	SMZNGPNGQZVFPT-UHFFFAOYSA-N	331.114318264							114654
SMR000196378	LSM-26117	SID17413517, BRD-K58784344	2288185	InChI=1S/C19H16F7NO4/c1-29-14-5-3-10(7-15(14)30-2)16(28)27-11-4-6-13(12(8-11)19(24,25)26)31-9-18(22,23)17(20)21/h3-8,17H,9H2,1-2H3,(H,27,28)	YRRHKSBORHLKLJ-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)Nc2ccc(OCC(F)(F)C(F)F)c(c2)C(F)(F)F	BroadT	BRD-K58784344	BRD-K58784344-001-06-7	ChemBridge Corporation	6825798			COc1ccc(cc1OC)C(=O)Nc1ccc(OCC(F)(F)C(F)F)c(c1)C(F)(F)F	InChI=1S/C19H16F7NO4/c1-29-14-5-3-10(7-15(14)30-2)16(28)27-11-4-6-13(12(8-11)19(24,25)26)31-9-18(22,23)17(20)21/h3-8,17H,9H2,1-2H3,(H,27,28)	YRRHKSBORHLKLJ-UHFFFAOYSA-N	455.096755402							114655
SMR000125619	LSM-26118	SID14730306, BRD-K82371836	1488442	InChI=1S/C12H7ClN2S2/c13-9-3-5-16-11(9)10-7-17-12(15-10)8-2-1-4-14-6-8/h1-7H	KIHWNFXLKWHVRY-UHFFFAOYSA-N	Clc1ccsc1c2csc(n2)c3cccnc3	BroadT	BRD-K82371836	BRD-K82371836-001-05-0	Key Organics Ltd.	9J-911			Clc1ccsc1-c1csc(n1)-c1cccnc1	InChI=1S/C12H7ClN2S2/c13-9-3-5-16-11(9)10-7-17-12(15-10)8-2-1-4-14-6-8/h1-7H	KIHWNFXLKWHVRY-UHFFFAOYSA-N	277.973917334							114656
2-Hydroxybenzaldehyde phenylhydrazone	LSM-26119	BRD-K33088594	5356945	InChI=1S/C13H12N2O/c16-13-9-5-4-6-11(13)10-14-15-12-7-2-1-3-8-12/h1-10,15-16H	SERARPRVBWDEBA-UHFFFAOYSA-N	Oc1ccccc1C=NNc2ccccc2	BroadT	BRD-K33088594	BRD-K33088594-001-06-0	Enamine Ltd.	T0503-9794			Oc1ccccc1C=NNc1ccccc1	InChI=1S/C13H12N2O/c16-13-9-5-4-6-11(13)10-14-15-12-7-2-1-3-8-12/h1-10,15-16H	SERARPRVBWDEBA-UHFFFAOYSA-N	212.094963024							
3-(2,3-Dihydro-1,4-benzodioxin-2-yl)-6-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole	LSM-26120	SID866091, SID87348695, BRD-A70653874	667351	InChI=1S/C17H11FN4O2S/c18-11-7-5-10(6-8-11)16-21-22-15(19-20-17(22)25-16)14-9-23-12-3-1-2-4-13(12)24-14/h1-8,14H,9H2	CCWFGRSYZMQDGC-UHFFFAOYSA-N	Fc1ccc(cc1)c2nn3c(nnc3s2)C4COc5ccccc5O4	BroadT	BRD-A70653874	BRD-A70653874-001-05-0	InterBioScreen Ltd.	STOCK5S-57451			Fc1ccc(cc1)-c1nn2c(nnc2s1)C1COc2ccccc2O1	InChI=1S/C17H11FN4O2S/c18-11-7-5-10(6-8-11)16-21-22-15(19-20-17(22)25-16)14-9-23-12-3-1-2-4-13(12)24-14/h1-8,14H,9H2	CCWFGRSYZMQDGC-UHFFFAOYSA-N	354.058674522							114658
3-Amino-4-methoxy-1H-indole-2-carbohydrazide	LSM-26121	SID26671266, BRD-K02260952	931776	InChI=1S/C10H12N4O2/c1-16-6-4-2-3-5-7(6)8(11)9(13-5)10(15)14-12/h2-4,13H,11-12H2,1H3,(H,14,15)	KKEAIGKIYWJFSC-UHFFFAOYSA-N	COc1cccc2[nH]c(C(=O)NN)c(N)c12	BroadT	BRD-K02260952	BRD-K02260952-001-05-0	InterBioScreen Ltd.	STOCK3S-97844			COc1cccc2[nH]c(C(=O)NN)c(N)c12	InChI=1S/C10H12N4O2/c1-16-6-4-2-3-5-7(6)8(11)9(13-5)10(15)14-12/h2-4,13H,11-12H2,1H3,(H,14,15)	KKEAIGKIYWJFSC-UHFFFAOYSA-N	220.096025664							114659
2-(4-Chloro-2-methylphenyl)hydrazine-1-carbothioamide	LSM-26122	SID26729889, BRD-K98636592	2826085	InChI=1S/C8H10ClN3S/c1-5-4-6(9)2-3-7(5)11-12-8(10)13/h2-4,11H,1H3,(H3,10,12,13)	UKIGFCKGSAOYRH-UHFFFAOYSA-N	Cc1cc(Cl)ccc1NN=C(N)S	BroadT	BRD-K98636592	BRD-K98636592-001-05-2	Maybridge	PD 00321			Cc1cc(Cl)ccc1NN=C(N)S	InChI=1S/C8H10ClN3S/c1-5-4-6(9)2-3-7(5)11-12-8(10)13/h2-4,11H,1H3,(H3,10,12,13)	UKIGFCKGSAOYRH-UHFFFAOYSA-N	215.02839575							114660
STK851126	LSM-26123	SID17512676, BRD-K96789916	1969521	InChI=1S/C19H17N5O2S/c1-25-13-8-9-17(26-2)16(10-13)24-18(22-23-19(24)27)15-11-14(20-21-15)12-6-4-3-5-7-12/h3-11H,1-2H3,(H,20,21)(H,23,27)	RWFZAKSDPNBBPR-UHFFFAOYSA-N	COc1ccc(OC)c(c1)n2c(S)nnc2c3cc([nH]n3)c4ccccc4	BroadT	BRD-K96789916	BRD-K96789916-001-05-0	InterBioScreen Ltd.	STOCK5S-57458			COc1ccc(OC)c(c1)-n1c(S)nnc1-c1cc([nH]n1)-c1ccccc1	InChI=1S/C19H17N5O2S/c1-25-13-8-9-17(26-2)16(10-13)24-18(22-23-19(24)27)15-11-14(20-21-15)12-6-4-3-5-7-12/h3-11H,1-2H3,(H,20,21)(H,23,27)	RWFZAKSDPNBBPR-UHFFFAOYSA-N	379.110295524							114661
2-[3-(3-Morpholinopropyl)-4-oxo-1,2,3,4-tetrahydro-2-quinazolinyl]benzoic acid	LSM-26124	SID26726861, BRD-A63882908	2815288	InChI=1S/C22H25N3O4/c26-21-18-8-3-4-9-19(18)23-20(16-6-1-2-7-17(16)22(27)28)25(21)11-5-10-24-12-14-29-15-13-24/h1-4,6-9,20,23H,5,10-15H2,(H,27,28)	NECDRBSBZMQGEX-UHFFFAOYSA-N	OC(=O)c1ccccc1C2Nc3ccccc3C(=O)N2CCCN4CCOCC4	BroadT	BRD-A63882908	BRD-A63882908-001-04-7	Maybridge	HTS 10256			OC(=O)c1ccccc1C1Nc2ccccc2C(=O)N1CCCN1CCOCC1	InChI=1S/C22H25N3O4/c26-21-18-8-3-4-9-19(18)23-20(16-6-1-2-7-17(16)22(27)28)25(21)11-5-10-24-12-14-29-15-13-24/h1-4,6-9,20,23H,5,10-15H2,(H,27,28)	NECDRBSBZMQGEX-UHFFFAOYSA-N	395.18450631							114662
1-(4-Methylphenyl)-2-[(1-phenyl-1H-imidazol-2-yl)sulfanyl]-1-ethanone	LSM-26125	SID17402624, BRD-K14456313	4297783	InChI=1S/C18H16N2OS/c1-14-7-9-15(10-8-14)17(21)13-22-18-19-11-12-20(18)16-5-3-2-4-6-16/h2-12H,13H2,1H3	BVTQVXKWNPSFEE-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)CSc2nccn2c3ccccc3	BroadT	BRD-K14456313	BRD-K14456313-001-05-4	Key Organics Ltd.	3R-0246			Cc1ccc(cc1)C(=O)CSc1nccn1-c1ccccc1	InChI=1S/C18H16N2OS/c1-14-7-9-15(10-8-14)17(21)13-22-18-19-11-12-20(18)16-5-3-2-4-6-16/h2-12H,13H2,1H3	BVTQVXKWNPSFEE-UHFFFAOYSA-N	308.098333842							114663
AC1NDJLP	LSM-26126	BRD-K62132202	4602276	InChI=1S/C11H10N2OS2/c1-8(9-4-2-6-15-9)12-13-11(14)10-5-3-7-16-10/h2-7H,1H3,(H,13,14)	NZECVLMIUBMJSK-UHFFFAOYSA-N	CC(=NNC(=O)c1cccs1)c2cccs2	BroadT	BRD-K62132202	BRD-K62132202-001-05-6	InterBioScreen Ltd.	STOCK3S-54301			CC(=NNC(=O)c1cccs1)c1cccs1	InChI=1S/C11H10N2OS2/c1-8(9-4-2-6-15-9)12-13-11(14)10-5-3-7-16-10/h2-7H,1H3,(H,13,14)	NZECVLMIUBMJSK-UHFFFAOYSA-N	250.02345434							114664
MLS-0002494.0001	LSM-2762	BRD-K34968258, SID50102718, SID860630, SID87544523, SID99495704	661907	InChI=1S/C24H26N6/c1-18-3-7-20(8-4-18)16-30-24-22(15-27-30)23(25-17-26-24)29-13-11-28(12-14-29)21-9-5-19(2)6-10-21/h3-10,15,17H,11-14,16H2,1-2H3	OJTUEASMVVJXHR-UHFFFAOYSA-N	Cc1ccc(Cn2ncc3c(ncnc23)N4CCN(CC4)c5ccc(C)cc5)cc1	BroadT	BRD-K34968258	BRD-K34968258-001-05-1	InterBioScreen Ltd.	STOCK3S-83834			Cc1ccc(Cn2ncc3c(ncnc23)N2CCN(CC2)c2ccc(C)cc2)cc1	InChI=1S/C24H26N6/c1-18-3-7-20(8-4-18)16-30-24-22(15-27-30)23(25-17-26-24)29-13-11-28(12-14-29)21-9-5-19(2)6-10-21/h3-10,15,17H,11-14,16H2,1-2H3	OJTUEASMVVJXHR-UHFFFAOYSA-N	398.221894892							92610
SMR000064866	LSM-26127	SID3711141, BRD-K37827001	2615575	InChI=1S/C19H21N5O3S/c1-5-27-18(26)16-12(3)17(20-13(16)4)15(25)10-28-19-21-22-23-24(19)14-8-6-11(2)7-9-14/h6-9,20H,5,10H2,1-4H3	KZUCFQLQDUSNBZ-UHFFFAOYSA-N	CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nnnn2c3ccc(C)cc3)c1C	BroadT	BRD-K37827001	BRD-K37827001-001-05-6	Enamine Ltd.	Z46233627			CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nnnn2-c2ccc(C)cc2)c1C	InChI=1S/C19H21N5O3S/c1-5-27-18(26)16-12(3)17(20-13(16)4)15(25)10-28-19-21-22-23-24(19)14-8-6-11(2)7-9-14/h6-9,20H,5,10H2,1-4H3	KZUCFQLQDUSNBZ-UHFFFAOYSA-N	399.136510272							114665
AC1MWWPG	LSM-26128	BRD-K27286000	3806289	InChI=1S/C18H17N3O2/c1-12-16(15-5-3-4-6-17(15)21(12)2)11-19-20-14-9-7-13(8-10-14)18(22)23/h3-11,20H,1-2H3,(H,22,23)	OBUSGVGUBNMRSQ-UHFFFAOYSA-N	Cc1c(C=NNc2ccc(cc2)C(=O)O)c3ccccc3n1C	BroadT	BRD-K27286000	BRD-K27286000-001-05-8	InterBioScreen Ltd.	STOCK5S-25961			Cc1c(C=NNc2ccc(cc2)C(O)=O)c2ccccc2n1C	InChI=1S/C18H17N3O2/c1-12-16(15-5-3-4-6-17(15)21(12)2)11-19-20-14-9-7-13(8-10-14)18(22)23/h3-11,20H,1-2H3,(H,22,23)	OBUSGVGUBNMRSQ-UHFFFAOYSA-N	307.132076814							114666
F3285-1101	LSM-26129	SID4241888, BRD-K31444829	755924	InChI=1S/C16H14N4OS2/c1-10-13(11(2)21-19-10)8-22-15-17-18-16-20(15)14(9-23-16)12-6-4-3-5-7-12/h3-7,9H,8H2,1-2H3	WJBUHJLXIFDVAR-UHFFFAOYSA-N	Cc1onc(C)c1CSc2nnc3scc(c4ccccc4)n23	BroadT	BRD-K31444829	BRD-K31444829-001-05-6	ChemDiv Inc.	5867-4095			Cc1noc(C)c1CSc1nnc2scc(-c3ccccc3)n12	InChI=1S/C16H14N4OS2/c1-10-13(11(2)21-19-10)8-22-15-17-18-16-20(15)14(9-23-16)12-6-4-3-5-7-12/h3-7,9H,8H2,1-2H3	WJBUHJLXIFDVAR-UHFFFAOYSA-N	342.060902488							114667
MLS000859089	LSM-26130	SID26726697, BRD-K46839081	2818993	InChI=1S/C19H10Cl2N4S/c20-11-5-7-12(8-6-11)26-19-15(10-23)17(14(9-22)18(24)25-19)13-3-1-2-4-16(13)21/h1-8H,(H2,24,25)	MBIBRDAYPLTCFX-UHFFFAOYSA-N	Nc1nc(Sc2ccc(Cl)cc2)c(C#N)c(c3ccccc3Cl)c1C#N	BroadT	BRD-K46839081	BRD-K46839081-001-06-1	Maybridge	KM 00564			Nc1nc(Sc2ccc(Cl)cc2)c(C#N)c(-c2ccccc2Cl)c1C#N	InChI=1S/C19H10Cl2N4S/c20-11-5-7-12(8-6-11)26-19-15(10-23)17(14(9-22)18(24)25-19)13-3-1-2-4-16(13)21/h1-8H,(H2,24,25)	MBIBRDAYPLTCFX-UHFFFAOYSA-N	396.00032247							114668
SMR000007982	LSM-26131	SID849943, BRD-A81508267	652453	InChI=1S/C20H18N6/c1-14-11-16-9-5-6-10-17(16)26(14)20-18-19(21-13-22-20)25(24-23-18)12-15-7-3-2-4-8-15/h2-10,13-14H,11-12H2,1H3	CCUGFXABKVOWQL-UHFFFAOYSA-N	CC1Cc2ccccc2N1c3ncnc4c3nnn4Cc5ccccc5	BroadT	BRD-A81508267	BRD-A81508267-001-05-8	Asinex Ltd.	ASN 07369370			CC1Cc2ccccc2N1c1ncnc2n(Cc3ccccc3)nnc12	InChI=1S/C20H18N6/c1-14-11-16-9-5-6-10-17(16)26(14)20-18-19(21-13-22-20)25(24-23-18)12-15-7-3-2-4-8-15/h2-10,13-14H,11-12H2,1H3	CCUGFXABKVOWQL-UHFFFAOYSA-N	342.159294636							114669
AC1M4NRF	LSM-26132	BRD-K44536345, SID24836970	2311715	InChI=1S/C16H16N4O3S/c1-20(2)24(22,23)12-9-7-11(8-10-12)15(21)19-16-17-13-5-3-4-6-14(13)18-16/h3-10H,1-2H3,(H2,17,18,19,21)	CPMUZVRDGXEAOX-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc2nc3ccccc3[nH]2	BroadT	BRD-K44536345	BRD-K44536345-001-05-9	Enamine Ltd.	T0500-9409			CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nc2ccccc2[nH]1	InChI=1S/C16H16N4O3S/c1-20(2)24(22,23)12-9-7-11(8-10-12)15(21)19-16-17-13-5-3-4-6-14(13)18-16/h3-10H,1-2H3,(H2,17,18,19,21)	CPMUZVRDGXEAOX-UHFFFAOYSA-N	344.094311102							114670
MLS000045001	LSM-26133	SID4244028, BRD-K71329101	3238688	InChI=1S/C18H28N4O2/c1-8-24-17(23)19-10-9-14-11(2)15-13(4)21-22(18(5,6)7)16(15)20-12(14)3/h8-10H2,1-7H3,(H,19,23)	POSNDLRTSIMCBO-UHFFFAOYSA-N	CCOC(=O)NCCc1c(C)nc2c(c(C)nn2C(C)(C)C)c1C	BroadT	BRD-K71329101	BRD-K71329101-001-05-9	ChemDiv Inc.	C430-0684			CCOC(=O)NCCc1c(C)nc2n(nc(C)c2c1C)C(C)(C)C	InChI=1S/C18H28N4O2/c1-8-24-17(23)19-10-9-14-11(2)15-13(4)21-22(18(5,6)7)16(15)20-12(14)3/h8-10H2,1-7H3,(H,19,23)	POSNDLRTSIMCBO-UHFFFAOYSA-N	332.221226176							114671
1-(2-Naphthyl)-1,4-hexanedione	LSM-26134	SID22413730, BRD-K29039767	825940	InChI=1S/C16H16O2/c1-2-15(17)9-10-16(18)14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,2,9-10H2,1H3	HVJXZZHMSDQQCF-UHFFFAOYSA-N	CCC(=O)CCC(=O)c1ccc2ccccc2c1	BroadT	BRD-K29039767	BRD-K29039767-001-06-0	Specs	AE-562/12222424			CCC(=O)CCC(=O)c1ccc2ccccc2c1	InChI=1S/C16H16O2/c1-2-15(17)9-10-16(18)14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,2,9-10H2,1H3	HVJXZZHMSDQQCF-UHFFFAOYSA-N	240.115029752							114672
T0503-0855	LSM-26135	SID24829590, BRD-A81729309	4061451	InChI=1S/C16H17Br2NO2/c1-9-3-10(2)8-19(7-9)16(20)14-5-11-4-12(17)6-13(18)15(11)21-14/h4-6,9-10H,3,7-8H2,1-2H3	LKZMKXQIYSQRFC-UHFFFAOYSA-N	CC1CC(C)CN(C1)C(=O)c2oc3c(Br)cc(Br)cc3c2	BroadT	BRD-A81729309	BRD-A81729309-001-05-0	Enamine Ltd.	T0503-0855			CC1CC(C)CN(C1)C(=O)c1cc2cc(Br)cc(Br)c2o1	InChI=1S/C16H17Br2NO2/c1-9-3-10(2)8-19(7-9)16(20)14-5-11-4-12(17)6-13(18)15(11)21-14/h4-6,9-10H,3,7-8H2,1-2H3	LKZMKXQIYSQRFC-UHFFFAOYSA-N	412.962603994							114673
N1-(3-Methoxypropyl)-2-[4-(dimethylamino)benzylidene]hydrazine-1-carbothioamide	LSM-26136	BRD-K97050484	2306709	InChI=1S/C14H22N4OS/c1-18(2)13-7-5-12(6-8-13)11-16-17-14(20)15-9-4-10-19-3/h5-8,11H,4,9-10H2,1-3H3,(H2,15,17,20)	DKXHROBSCZJNTE-UHFFFAOYSA-N	COCCCN=C(S)NN=Cc1ccc(cc1)N(C)C	BroadT	BRD-K97050484	BRD-K97050484-001-05-8	Enamine Ltd.	T0518-4848			COCCCN=C(S)NN=Cc1ccc(cc1)N(C)C	InChI=1S/C14H22N4OS/c1-18(2)13-7-5-12(6-8-13)11-16-17-14(20)15-9-4-10-19-3/h5-8,11H,4,9-10H2,1-3H3,(H2,15,17,20)	DKXHROBSCZJNTE-UHFFFAOYSA-N	294.151432054							114674
STK638346	LSM-26137	SID22401802, BRD-K47254543	1963468	InChI=1S/C22H20N6O5S2/c1-14(29)24-15-8-12-18(13-9-15)35(32,33)28-22-21(26-19-4-2-3-5-20(19)27-22)25-16-6-10-17(11-7-16)34(23,30)31/h2-13H,1H3,(H,24,29)(H,25,26)(H,27,28)(H2,23,30,31)	QBZDBXBXLKXGGS-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4ccc(cc4)S(=O)(=O)N	BroadT	BRD-K47254543	BRD-K47254543-001-05-6	InterBioScreen Ltd.	STOCK1S-23125			CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1ccc(cc1)S(N)(=O)=O	InChI=1S/C22H20N6O5S2/c1-14(29)24-15-8-12-18(13-9-15)35(32,33)28-22-21(26-19-4-2-3-5-20(19)27-22)25-16-6-10-17(11-7-16)34(23,30)31/h2-13H,1H3,(H,24,29)(H,25,26)(H,27,28)(H2,23,30,31)	QBZDBXBXLKXGGS-UHFFFAOYSA-N	512.09365918							114675
ST50979769	LSM-26138	SID17512788, BRD-A16891671	3828453	InChI=1S/C19H22N2O2S/c1-10-4-6-11(7-5-10)14-15-12(22)8-19(2,3)9-13(15)23-17(20)16(14)18(21)24/h4-7,14H,8-9,20H2,1-3H3,(H2,21,24)	CJKSMIXGEGEQGJ-UHFFFAOYSA-N	Cc1ccc(cc1)C2C(=C(N)OC3=C2C(=O)CC(C)(C)C3)C(=N)S	BroadT	BRD-A16891671	BRD-A16891671-001-05-8	InterBioScreen Ltd.	STOCK1S-21512			Cc1ccc(cc1)C1C(C(S)=N)=C(N)OC2=C1C(=O)CC(C)(C)C2	InChI=1S/C19H22N2O2S/c1-10-4-6-11(7-5-10)14-15-12(22)8-19(2,3)9-13(15)23-17(20)16(14)18(21)24/h4-7,14H,8-9,20H2,1-3H3,(H2,21,24)	CJKSMIXGEGEQGJ-UHFFFAOYSA-N	342.140198654							114676
AC1N23GS	LSM-26139	SID17517148, BRD-A54431720	4040459	InChI=1S/C23H21NO5/c1-2-28-20-15-9-7-13-18(20)24-22(26)21(16-10-4-3-5-11-16)29-23(27)17-12-6-8-14-19(17)25/h3-15,21,25H,2H2,1H3,(H,24,26)	NYKLFPUZVGXCLS-UHFFFAOYSA-N	CCOc1ccccc1NC(=O)C(OC(=O)c2ccccc2O)c3ccccc3	BroadT	BRD-A54431720	BRD-A54431720-001-05-7	Enamine Ltd.	T0515-4242			CCOc1ccccc1NC(=O)C(OC(=O)c1ccccc1O)c1ccccc1	InChI=1S/C23H21NO5/c1-2-28-20-15-9-7-13-18(20)24-22(26)21(16-10-4-3-5-11-16)29-23(27)17-12-6-8-14-19(17)25/h3-15,21,25H,2H2,1H3,(H,24,26)	NYKLFPUZVGXCLS-UHFFFAOYSA-N	391.141972782							114677
2-[(Dimethylamino)methylene]indan-1-one	LSM-44161	SID26729883, BRD-K92282284	2826073	InChI=1S/C12H13NO/c1-13(2)8-10-7-9-5-3-4-6-11(9)12(10)14/h3-6,8H,7H2,1-2H3/b10-8+	PTVLHYNESKGNCV-CSKARUKUSA-N	CN(C)\C=C\1/Cc2ccccc2C1=O	BroadT	BRD-K92282284	BRD-K92282284-001-05-4	Maybridge	PD 00297			CN(C)\C=C1/Cc2ccccc2C1=O	InChI=1S/C12H13NO/c1-13(2)8-10-7-9-5-3-4-6-11(9)12(10)14/h3-6,8H,7H2,1-2H3/b10-8+	PTVLHYNESKGNCV-CSKARUKUSA-N	187.099714046							
AC1LIULI	LSM-26141	BRD-K61487648	911562	InChI=1S/C13H11FN4O3/c1-18-11(19)6-10(16-13(18)21)12(20)17-15-7-8-2-4-9(14)5-3-8/h2-7H,1H3,(H,16,21)(H,17,20)	RSZUJISUKGMDJN-UHFFFAOYSA-N	CN1C(=O)NC(=CC1=O)C(=O)NN=Cc2ccc(F)cc2	BroadT	BRD-K61487648	BRD-K61487648-001-06-5	InterBioScreen Ltd.	STOCK1S-19295			Cn1c(=O)cc([nH]c1=O)C(=O)NN=Cc1ccc(F)cc1	InChI=1S/C13H11FN4O3/c1-18-11(19)6-10(16-13(18)21)12(20)17-15-7-8-2-4-9(14)5-3-8/h2-7H,1H3,(H,16,21)(H,17,20)	RSZUJISUKGMDJN-UHFFFAOYSA-N	290.081518452							114679
AC1MK0OX	LSM-26142	SID24807012, BRD-A39869104	3121944	InChI=1S/C21H16N2O2S/c24-20(14-7-2-1-3-8-14)21-23-17(15-9-4-5-10-18(15)25-21)13-16(22-23)19-11-6-12-26-19/h1-12,17,21H,13H2	ZUXHVMXOTOYINI-UHFFFAOYSA-N	O=C(C1Oc2ccccc2C3CC(=NN13)c4cccs4)c5ccccc5	BroadT	BRD-A39869104	BRD-A39869104-001-05-4	Asinex Ltd.	BAS 00890103			O=C(C1Oc2ccccc2C2CC(=NN12)c1cccs1)c1ccccc1	InChI=1S/C21H16N2O2S/c24-20(14-7-2-1-3-8-14)21-23-17(15-9-4-5-10-18(15)25-21)13-16(22-23)19-11-6-12-26-19/h1-12,17,21H,13H2	ZUXHVMXOTOYINI-UHFFFAOYSA-N	360.093248462							114680
MLS000374860	LSM-26143	SID22407107, BRD-K17341006	2079709	InChI=1S/C21H17NO3S/c23-20(15-25-21(24)16-9-3-1-4-10-16)22-18-13-7-8-14-19(18)26-17-11-5-2-6-12-17/h1-14H,15H2,(H,22,23)	KZCVLTRDOCICSI-UHFFFAOYSA-N	O=C(COC(=O)c1ccccc1)Nc2ccccc2Sc3ccccc3	BroadT	BRD-K17341006	BRD-K17341006-001-06-5	Enamine Ltd.	T5257311			O=C(COC(=O)c1ccccc1)Nc1ccccc1Sc1ccccc1	InChI=1S/C21H17NO3S/c23-20(15-25-21(24)16-9-3-1-4-10-16)22-18-13-7-8-14-19(18)26-17-11-5-2-6-12-17/h1-14H,15H2,(H,22,23)	KZCVLTRDOCICSI-UHFFFAOYSA-N	363.092914104							114681
AC1NA0XE	LSM-26144	SID26666632, BRD-A41619259	4419461	InChI=1S/C20H20N2O4/c1-13(23)22-19(15-8-10-16(25-3)11-9-15)12-18(21-22)17-6-4-5-7-20(17)26-14(2)24/h4-11,19H,12H2,1-3H3	ZMNZKBKAGCIHEI-UHFFFAOYSA-N	COc1ccc(cc1)C2CC(=NN2C(=O)C)c3ccccc3OC(=O)C	BroadT	BRD-A41619259	BRD-A41619259-001-05-2	InterBioScreen Ltd.	STOCK3S-47866			COc1ccc(cc1)C1CC(=NN1C(C)=O)c1ccccc1OC(C)=O	InChI=1S/C20H20N2O4/c1-13(23)22-19(15-8-10-16(25-3)11-9-15)12-18(21-22)17-6-4-5-7-20(17)26-14(2)24/h4-11,19H,12H2,1-3H3	ZMNZKBKAGCIHEI-UHFFFAOYSA-N	352.14230714							114682
AC1LCSDS	LSM-26145	SID852632, BRD-A84760076	655269	InChI=1S/C16H16N2O3S/c1-11-16(20)18(13-6-2-3-7-14(13)21-11)10-15(19)17-9-12-5-4-8-22-12/h2-8,11H,9-10H2,1H3,(H,17,19)	AVBBDSGNHQAWBO-UHFFFAOYSA-N	CC1Oc2ccccc2N(CC(=O)NCc3cccs3)C1=O	BroadT	BRD-A84760076	BRD-A84760076-001-05-3	Asinex Ltd.	ASN 06912025			CC1Oc2ccccc2N(CC(=O)NCc2cccs2)C1=O	InChI=1S/C16H16N2O3S/c1-11-16(20)18(13-6-2-3-7-14(13)21-11)10-15(19)17-9-12-5-4-8-22-12/h2-8,11H,9-10H2,1H3,(H,17,19)	AVBBDSGNHQAWBO-UHFFFAOYSA-N	316.088163082							114683
SMR000068035	LSM-26146	SID24840177, SID3713190, BRD-K29697183	2998325	InChI=1S/C23H24N4O3S/c1-14-12-20(15(2)27(14)17-6-8-18(29-5)9-7-17)21(28)13-31-23-25-24-22(26(23)4)19-10-11-30-16(19)3/h6-12H,13H2,1-5H3	SDFCUWYLNZJSBK-UHFFFAOYSA-N	COc1ccc(cc1)n2c(C)cc(C(=O)CSc3nnc(c4ccoc4C)n3C)c2C	BroadT	BRD-K29697183	BRD-K29697183-001-05-3	Enamine Ltd.	T5333712			COc1ccc(cc1)-n1c(C)cc(C(=O)CSc2nnc(-c3ccoc3C)n2C)c1C	InChI=1S/C23H24N4O3S/c1-14-12-20(15(2)27(14)17-6-8-18(29-5)9-7-17)21(28)13-31-23-25-24-22(26(23)4)19-10-11-30-16(19)3/h6-12H,13H2,1-5H3	SDFCUWYLNZJSBK-UHFFFAOYSA-N	436.156911358							114684
AC1LJ3HL	LSM-26147	BRD-K78226178	916279	InChI=1S/C18H19N3O2/c1-4-21-17-7-5-13(11(2)19-22)9-15(17)16-10-14(12(3)20-23)6-8-18(16)21/h5-10,22-23H,4H2,1-3H3	SMADFIJMWGFTLC-UHFFFAOYSA-N	CCn1c2ccc(cc2c3cc(ccc13)C(=NO)C)C(=NO)C	BroadT	BRD-K78226178	BRD-K78226178-001-06-6	InterBioScreen Ltd.	STOCK1S-78087			CCn1c2ccc(cc2c2cc(ccc12)C(C)=NO)C(C)=NO	InChI=1S/C18H19N3O2/c1-4-21-17-7-5-13(11(2)19-22)9-15(17)16-10-14(12(3)20-23)6-8-18(16)21/h5-10,22-23H,4H2,1-3H3	SMADFIJMWGFTLC-UHFFFAOYSA-N	309.147726878							114685
MLS000099058	LSM-26148	SID4265216, BRD-K13788958	717145	InChI=1S/C15H15N3O2S/c19-14(12-3-1-5-16-11-12)17-6-8-18(9-7-17)15(20)13-4-2-10-21-13/h1-5,10-11H,6-9H2	OBJPERSDPVULEI-UHFFFAOYSA-N	O=C(N1CCN(CC1)C(=O)c2cccs2)c3cccnc3	BroadT	BRD-K13788958	BRD-K13788958-001-05-1	ChemBridge Corporation	5970181			O=C(N1CCN(CC1)C(=O)c1cccnc1)c1cccs1	InChI=1S/C15H15N3O2S/c19-14(12-3-1-5-16-11-12)17-6-8-18(9-7-17)15(20)13-4-2-10-21-13/h1-5,10-11H,6-9H2	OBJPERSDPVULEI-UHFFFAOYSA-N	301.08849744							114686
SMR000041962	LSM-26149	SID50102392, SID859984, BRD-K91979367	661296	InChI=1S/C11H10BrNO2/c1-2-7-8-5-6(12)3-4-9(8)13-10(7)11(14)15/h3-5,13H,2H2,1H3,(H,14,15)	VDWBOEDWXSJGGH-UHFFFAOYSA-N	CCc1c([nH]c2ccc(Br)cc12)C(=O)O	BroadT	BRD-K91979367	BRD-K91979367-001-05-6	InterBioScreen Ltd.	STOCK3S-46937			CCc1c([nH]c2ccc(Br)cc12)C(O)=O	InChI=1S/C11H10BrNO2/c1-2-7-8-5-6(12)3-4-9(8)13-10(7)11(14)15/h3-5,13H,2H2,1H3,(H,14,15)	VDWBOEDWXSJGGH-UHFFFAOYSA-N	266.98949117							114687
AC1MMHUY	LSM-26150	SID4244395, BRD-K01425987	3239000	InChI=1S/C11H10F3N3O2S/c1-17-6-10(15-7-17)20(18,19)16-9-4-2-8(3-5-9)11(12,13)14/h2-7,16H,1H3	QFMCGTGHSYOLIV-UHFFFAOYSA-N	Cn1cnc(c1)S(=O)(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K01425987	BRD-K01425987-001-06-7	ChemDiv Inc.	K906-2489			Cn1cnc(c1)S(=O)(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C11H10F3N3O2S/c1-17-6-10(15-7-17)20(18,19)16-9-4-2-8(3-5-9)11(12,13)14/h2-7,16H,1H3	QFMCGTGHSYOLIV-UHFFFAOYSA-N	305.04458188							114688
STK579531	LSM-26151	BRD-K39329527	4892387	InChI=1S/C19H20N4O2/c1-12-8-13(2)22-19(21-12)23-20-11-16-17(24)9-15(10-18(16)25)14-6-4-3-5-7-14/h3-8,11,15-16H,9-10H2,1-2H3,(H,21,22,23)	CAOVKCLZRVHWDQ-UHFFFAOYSA-N	Cc1cc(C)nc(NN=CC2C(=O)CC(CC2=O)c2ccccc2)n1	BroadT	BRD-K39329527	BRD-K39329527-001-05-6	InterBioScreen Ltd.	STOCK5S-49836			Cc1cc(C)nc(NNC=C2C(=O)CC(CC2=O)c2ccccc2)n1	InChI=1S/C19H20N4O2/c1-12-8-13(2)22-19(21-12)23-20-11-16-17(24)9-15(10-18(16)25)14-6-4-3-5-7-14/h3-8,11,15,20H,9-10H2,1-2H3,(H,21,22,23)	YTPNYSRDAKYDPI-UHFFFAOYSA-N	336.15862592							
ZINC15953239	LSM-26152	SID24823658, SID24268925, BRD-K72025565	26879070	InChI=1S/C21H18N4O4/c1-13-19(21(28)25(24(13)2)14-8-4-3-5-9-14)22-20(27)16-12-18(29-23-16)15-10-6-7-11-17(15)26/h3-12,26H,1-2H3,(H,22,27)	UCWCLDWOKRRWNF-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)NC(=O)c2cc(on2)c3ccccc3O)c4ccccc4	BroadT	BRD-K72025565	BRD-K72025565-001-06-9	ChemDiv Inc.	C226-2475			Cc1c(NC(=O)c2cc(on2)-c2ccccc2O)c(=O)n(-c2ccccc2)n1C	InChI=1S/C21H18N4O4/c1-13-19(21(28)25(24(13)2)14-8-4-3-5-9-14)22-20(27)16-12-18(29-23-16)15-10-6-7-11-17(15)26/h3-12,26H,1-2H3,(H,22,27)	UCWCLDWOKRRWNF-UHFFFAOYSA-N	390.132805096							
AC1N6YJ6	LSM-26153	BRD-K20284192	4223284	InChI=1S/C13H17N3O3S/c1-17-5-4-14-13(20)16-15-9-10-2-3-11-12(8-10)19-7-6-18-11/h2-3,8-9H,4-7H2,1H3,(H2,14,16,20)	DZDXWXIQOTUUBV-UHFFFAOYSA-N	COCCN=C(S)NN=Cc1ccc2OCCOc2c1	BroadT	BRD-K20284192	BRD-K20284192-001-05-8	Enamine Ltd.	T5228513			COCCN=C(S)NN=Cc1ccc2OCCOc2c1	InChI=1S/C13H17N3O3S/c1-17-5-4-14-13(20)16-15-9-10-2-3-11-12(8-10)19-7-6-18-11/h2-3,8-9H,4-7H2,1H3,(H2,14,16,20)	DZDXWXIQOTUUBV-UHFFFAOYSA-N	295.099062124							114691
MLS000561556	LSM-26154	SID17407398, BRD-K65500369	11958621	InChI=1S/C21H25ClN4OS2/c1-4-5-6-7-8-18(27)26-21-23-14(3)19(29-21)17-12-28-20(25-17)24-16-11-15(22)10-9-13(16)2/h9-12H,4-8H2,1-3H3,(H,24,25)(H,23,26,27)	SUJPMPMXQFHKGP-UHFFFAOYSA-N	CCCCCCC(=O)Nc1nc(C)c(s1)c2csc(Nc3cc(Cl)ccc3C)n2	BroadT	BRD-K65500369	BRD-K65500369-001-05-0	University of California at Davis	CLY_Corr_C11			CCCCCCC(=O)Nc1nc(C)c(s1)-c1csc(Nc2cc(Cl)ccc2C)n1	InChI=1S/C21H25ClN4OS2/c1-4-5-6-7-8-18(27)26-21-23-14(3)19(29-21)17-12-28-20(25-17)24-16-11-15(22)10-9-13(16)2/h9-12H,4-8H2,1-3H3,(H,24,25)(H,23,26,27)	SUJPMPMXQFHKGP-UHFFFAOYSA-N	448.11583055							114692
MLS000070816	LSM-26155	SID851405, BRD-A69992442	653974	InChI=1S/C23H30N6O/c1-17(2)29-23(24-25-26-29)22(19-11-9-18(3)10-12-19)28-15-13-27(14-16-28)20-7-5-6-8-21(20)30-4/h5-12,17,22H,13-16H2,1-4H3	HTDBSXZYBAPPEH-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)C(c3ccc(C)cc3)c4nnnn4C(C)C	BroadT	BRD-A69992442	BRD-A69992442-001-05-8	Asinex Ltd.	ASN 05554205			COc1ccccc1N1CCN(CC1)C(c1nnnn1C(C)C)c1ccc(C)cc1	InChI=1S/C23H30N6O/c1-17(2)29-23(24-25-26-29)22(19-11-9-18(3)10-12-19)28-15-13-27(14-16-28)20-7-5-6-8-21(20)30-4/h5-12,17,22H,13-16H2,1-4H3	HTDBSXZYBAPPEH-UHFFFAOYSA-N	406.24810964							114693
STK275780	LSM-26156	SID24786429, BRD-A96767816	2937733	InChI=1S/C17H16ClN3O2/c1-10-3-2-4-12(9-10)16(22)19-15-14(20-21-17(15)23)11-5-7-13(18)8-6-11/h2-9,14-15,20H,1H3,(H,19,22)(H,21,23)	DKVMDBSQBOIJMP-UHFFFAOYSA-N	Cc1cccc(c1)C(=O)NC2C(NNC2=O)c3ccc(Cl)cc3	BroadT	BRD-A96767816	BRD-A96767816-001-07-5	ChemBridge Corporation	7377226			Cc1cccc(c1)C(=O)NC1C(NNC1=O)c1ccc(Cl)cc1	InChI=1S/C17H16ClN3O2/c1-10-3-2-4-12(9-10)16(22)19-15-14(20-21-17(15)23)11-5-7-13(18)8-6-11/h2-9,14-15,20H,1H3,(H,19,22)(H,21,23)	DKVMDBSQBOIJMP-UHFFFAOYSA-N	329.093104492							114694
5-Benzyl-1-(2-methoxyphenyl)-1,3,5-triazinane-2-thione	LSM-26157	SID26663739, BRD-K24198990	751570	InChI=1S/C17H19N3OS/c1-21-16-10-6-5-9-15(16)20-13-19(12-18-17(20)22)11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H,18,22)	XRORQPYKVYMLRB-UHFFFAOYSA-N	COc1ccccc1N2CN(Cc3ccccc3)CN=C2S	BroadT	BRD-K24198990	BRD-K24198990-001-05-0	InterBioScreen Ltd.	STOCK3S-54910			COc1ccccc1N1CN(Cc2ccccc2)CN=C1S	InChI=1S/C17H19N3OS/c1-21-16-10-6-5-9-15(16)20-13-19(12-18-17(20)22)11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H,18,22)	XRORQPYKVYMLRB-UHFFFAOYSA-N	313.124882948							114695
MLS000092675	LSM-26158	SID4242870, BRD-A99565171	3237669	InChI=1S/C17H22N2O3/c1-21-14-9-5-6-12(10-14)15-11-16(22-19-15)17(20)18-13-7-3-2-4-8-13/h5-6,9-10,13,16H,2-4,7-8,11H2,1H3,(H,18,20)	GOKNYOHQPLPAOF-UHFFFAOYSA-N	COc1cccc(c1)C2=NOC(C2)C(=O)NC3CCCCC3	BroadT	BRD-A99565171	BRD-A99565171-001-05-3	ChemDiv Inc.	C651-0128			COc1cccc(c1)C1=NOC(C1)C(=O)NC1CCCCC1	InChI=1S/C17H22N2O3/c1-21-14-9-5-6-12(10-14)15-11-16(22-19-15)17(20)18-13-7-3-2-4-8-13/h5-6,9-10,13,16H,2-4,7-8,11H2,1H3,(H,18,20)	GOKNYOHQPLPAOF-UHFFFAOYSA-N	302.163042584							114696
ZINC01057797	LSM-26159	SID50086734, BRD-K02347735	1248670	InChI=1S/C17H14ClN3O2S/c18-12-6-8-14(9-7-12)24-11-16(22)19-15-10-17(23)21(20-15)13-4-2-1-3-5-13/h1-9H,10-11H2,(H,19,20,22)	VHQNPDPEAIYATG-UHFFFAOYSA-N	Clc1ccc(SCC(=O)NC2=NN(C(=O)C2)c3ccccc3)cc1	BroadT	BRD-K02347735	BRD-K02347735-001-06-7	Key Organics Ltd.	JS-0991			Clc1ccc(SCC(=O)NC2=NN(C(=O)C2)c2ccccc2)cc1	InChI=1S/C17H14ClN3O2S/c18-12-6-8-14(9-7-12)24-11-16(22)19-15-10-17(23)21(20-15)13-4-2-1-3-5-13/h1-9H,10-11H2,(H,19,20,22)	VHQNPDPEAIYATG-UHFFFAOYSA-N	359.049525118							114697
MLS000033728	LSM-26160	SID846073, BRD-A88485418	648445	InChI=1S/C19H23N5S/c1-19(2,3)24-18(20-21-22-24)17(16-11-7-13-25-16)23-12-6-9-14-8-4-5-10-15(14)23/h4-5,7-8,10-11,13,17H,6,9,12H2,1-3H3	PKBQJMQIGGMRNY-UHFFFAOYSA-N	CC(C)(C)n1nnnc1C(N2CCCc3ccccc23)c4cccs4	BroadT	BRD-A88485418	BRD-A88485418-001-05-0	Asinex Ltd.	ASN 05084272			CC(C)(C)n1nnnc1C(N1CCCc2ccccc12)c1cccs1	InChI=1S/C19H23N5S/c1-19(2,3)24-18(20-21-22-24)17(16-11-7-13-25-16)23-12-6-9-14-8-4-5-10-15(14)23/h4-5,7-8,10-11,13,17H,6,9,12H2,1-3H3	PKBQJMQIGGMRNY-UHFFFAOYSA-N	353.167416476							114698
MLS000051721	LSM-26161	SID4265809, BRD-K47562470	1246434	InChI=1S/C13H14BrN3OS2/c14-10-7-6-9(19-10)11(18)15-13-17-16-12(20-13)8-4-2-1-3-5-8/h6-8H,1-5H2,(H,15,17,18)	VOMVGESEQIDZMP-UHFFFAOYSA-N	Brc1ccc(s1)C(=O)Nc2nnc(s2)C3CCCCC3	BroadT	BRD-K47562470	BRD-K47562470-001-07-5	ChemBridge Corporation	7947019			Brc1ccc(s1)C(=O)Nc1nnc(s1)C1CCCCC1	InChI=1S/C13H14BrN3OS2/c14-10-7-6-9(19-10)11(18)15-13-17-16-12(20-13)8-4-2-1-3-5-8/h6-8H,1-5H2,(H,15,17,18)	VOMVGESEQIDZMP-UHFFFAOYSA-N	370.976166078							114699
N-(4,5-Dimethyl-1,3-thiazol-2-yl)cyclohexanecarboxamide	LSM-26162	SID14719160, BRD-K41364172	903390	InChI=1S/C12H18N2OS/c1-8-9(2)16-12(13-8)14-11(15)10-6-4-3-5-7-10/h10H,3-7H2,1-2H3,(H,13,14,15)	ONHVSTCBBDWPOI-UHFFFAOYSA-N	Cc1nc(NC(=O)C2CCCCC2)sc1C	BroadT	BRD-K41364172	BRD-K41364172-001-05-7	Specs	AK-968/12117058			Cc1nc(NC(=O)C2CCCCC2)sc1C	InChI=1S/C12H18N2OS/c1-8-9(2)16-12(13-8)14-11(15)10-6-4-3-5-7-10/h10H,3-7H2,1-2H3,(H,13,14,15)	ONHVSTCBBDWPOI-UHFFFAOYSA-N	238.113983906							114700
BAS 08316667	LSM-26163	SID846861, BRD-K24760559	649257	InChI=1S/C21H22N2O3/c1-4-20(24)23(19-8-6-5-7-14(19)2)13-16-11-15-12-17(26-3)9-10-18(15)22-21(16)25/h5-12H,4,13H2,1-3H3,(H,22,25)	KQCNUKKSZLAMDC-UHFFFAOYSA-N	CCC(=O)N(Cc1cc2cc(OC)ccc2nc1O)c3ccccc3C	BroadT	BRD-K24760559	BRD-K24760559-001-05-0	Asinex Ltd.	BAS 08316667			CCC(=O)N(Cc1cc2cc(OC)ccc2nc1O)c1ccccc1C	InChI=1S/C21H22N2O3/c1-4-20(24)23(19-8-6-5-7-14(19)2)13-16-11-15-12-17(26-3)9-10-18(15)22-21(16)25/h5-12H,4,13H2,1-3H3,(H,22,25)	KQCNUKKSZLAMDC-UHFFFAOYSA-N	350.163042584							114701
SMR000104288	LSM-26164	SID7975421, BRD-K16491556	1131786	InChI=1S/C24H26N2O3/c1-2-27-22-9-4-3-7-20(22)16-26(17-21-8-5-6-13-25-21)14-12-19-10-11-23-24(15-19)29-18-28-23/h3-11,13,15H,2,12,14,16-18H2,1H3	ZULFRKZYEQZTBD-UHFFFAOYSA-N	CCOc1ccccc1CN(CCc2ccc3OCOc3c2)Cc4ccccn4	BroadT	BRD-K16491556	BRD-K16491556-001-06-3	ChemBridge Corporation	5969632			CCOc1ccccc1CN(CCc1ccc2OCOc2c1)Cc1ccccn1	InChI=1S/C24H26N2O3/c1-2-27-22-9-4-3-7-20(22)16-26(17-21-8-5-6-13-25-21)14-12-19-10-11-23-24(15-19)29-18-28-23/h3-11,13,15H,2,12,14,16-18H2,1H3	ZULFRKZYEQZTBD-UHFFFAOYSA-N	390.194342712							114702
ST50831554	LSM-26165	SID22414214, BRD-A49765532	4167592	InChI=1S/C15H17F3N2O3/c1-3-23-12-6-4-11(5-7-12)8-13(21)20-14(22,15(16,17)18)9-10(2)19-20/h4-7,22H,3,8-9H2,1-2H3	ONOVBPWRKMANPF-UHFFFAOYSA-N	CCOc1ccc(CC(=O)N2N=C(C)CC2(O)C(F)(F)F)cc1	BroadT	BRD-A49765532	BRD-A49765532-001-05-4	Specs	AK-968/41171426			CCOc1ccc(CC(=O)N2N=C(C)CC2(O)C(F)(F)F)cc1	InChI=1S/C15H17F3N2O3/c1-3-23-12-6-4-11(5-7-12)8-13(21)20-14(22,15(16,17)18)9-10(2)19-20/h4-7,22H,3,8-9H2,1-2H3	ONOVBPWRKMANPF-UHFFFAOYSA-N	330.119127024							114703
ST51000802	LSM-26166	SID7974211, BRD-K42395056	340715	InChI=1S/C15H14N4O2/c1-3-21-15(20)14-10(2)19-13(16-17-14)9-12(18-19)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3	LEXSJFGRMWIXBS-UHFFFAOYSA-N	CCOC(=O)c1nnc2cc(nn2c1C)c3ccccc3	BroadT	BRD-K42395056	BRD-K42395056-001-04-4	ChemBridge Corporation	6073976			CCOC(=O)c1nnc2cc(nn2c1C)-c1ccccc1	InChI=1S/C15H14N4O2/c1-3-21-15(20)14-10(2)19-13(16-17-14)9-12(18-19)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3	LEXSJFGRMWIXBS-UHFFFAOYSA-N	282.111675728							114704
T0517-7262	LSM-26167	SID17517101, BRD-K83125254	2437421	InChI=1S/C22H15ClN4O5S/c23-16-9-8-15(27(30)31)11-17(16)24-21(28)13-32-22(29)19-12-18(20-7-4-10-33-20)25-26(19)14-5-2-1-3-6-14/h1-12H,13H2,(H,24,28)	DAOPEHMXPXDRRF-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(Cl)c(NC(=O)COC(=O)c2cc(nn2c3ccccc3)c4cccs4)c1	BroadT	BRD-K83125254	BRD-K83125254-001-05-2	Enamine Ltd.	T0517-7262			[O-][N+](=O)c1ccc(Cl)c(NC(=O)COC(=O)c2cc(nn2-c2ccccc2)-c2cccs2)c1	InChI=1S/C22H15ClN4O5S/c23-16-9-8-15(27(30)31)11-17(16)24-21(28)13-32-22(29)19-12-18(20-7-4-10-33-20)25-26(19)14-5-2-1-3-6-14/h1-12H,13H2,(H,24,28)	DAOPEHMXPXDRRF-UHFFFAOYSA-N	482.04516802							114705
SMR000041205	LSM-26168	SID858939, BRD-A75150014	660245	InChI=1S/C20H25N3O2/c1-3-4-5-8-13-23-17-11-7-6-10-16(17)22-19(23)15(2)21-20(24)18-12-9-14-25-18/h6-7,9-12,14-15H,3-5,8,13H2,1-2H3,(H,21,24)	KZLPAAATSBKGPW-UHFFFAOYSA-N	CCCCCCn1c(nc2ccccc12)C(C)NC(=O)c3occc3	BroadT	BRD-A75150014	BRD-A75150014-001-05-3	InterBioScreen Ltd.	STOCK2S-86361			CCCCCCn1c(nc2ccccc12)C(C)NC(=O)c1ccco1	InChI=1S/C20H25N3O2/c1-3-4-5-8-13-23-17-11-7-6-10-16(17)22-19(23)15(2)21-20(24)18-12-9-14-25-18/h6-7,9-12,14-15H,3-5,8,13H2,1-2H3,(H,21,24)	KZLPAAATSBKGPW-UHFFFAOYSA-N	339.19467707							114706
SMR000120254	LSM-26169	SID14725846, BRD-A44803380	3156453	InChI=1S/C21H18F3N5/c1-2-29-8-7-13-15(9-25)19(28)20(11-26,12-27)18(16(13)10-29)14-5-3-4-6-17(14)21(22,23)24/h3-8,16,18-19H,2,10,28H2,1H3	RVFTYZUZLXPIGM-UHFFFAOYSA-N	CCN1CC2C(c3ccccc3C(F)(F)F)C(C#N)(C#N)C(N)C(=C2C=C1)C#N	BroadT	BRD-A44803380	BRD-A44803380-001-06-9	Asinex Ltd.	BAS 07417739			CCN1CC2C(c3ccccc3C(F)(F)F)C(C#N)(C#N)C(N)C(C#N)=C2C=C1	InChI=1S/C21H18F3N5/c1-2-29-8-7-13-15(9-25)19(28)20(11-26,12-27)18(16(13)10-29)14-5-3-4-6-17(14)21(22,23)24/h3-8,16,18-19H,2,10,28H2,1H3	RVFTYZUZLXPIGM-UHFFFAOYSA-N	397.151430226							114707
ILP-II-34	LSM-26170	SID24833796, BRD-K30320072	16196542	InChI=1S/C16H26N4O4/c1-9(2)7-10(15(23)24-16(3,4)5)20-14(22)12-11(13(21)17-6)18-8-19-12/h8-10H,7H2,1-6H3,(H,17,21)(H,18,19)(H,20,22)/t10-/m0/s1	OARSCXSYJUMDMB-JTQLQIEISA-N	CNC(=O)c1[nH]cnc1C(=O)N[C@@H](CC(C)C)C(=O)OC(C)(C)C	BroadT	BRD-K30320072	BRD-K30320072-001-05-3	University of Tulsa	ILP-II-34 AE08_PA06			CNC(=O)c1[nH]cnc1C(=O)N[C@@H](CC(C)C)C(=O)OC(C)(C)C	InChI=1S/C16H26N4O4/c1-9(2)7-10(15(23)24-16(3,4)5)20-14(22)12-11(13(21)17-6)18-8-19-12/h8-10H,7H2,1-6H3,(H,17,21)(H,18,19)(H,20,22)/t10-/m0/s1	OARSCXSYJUMDMB-JTQLQIEISA-N	338.195405352							114708
MLS000050472	LSM-26171	SID4259128, BRD-K81524053	2953887	InChI=1S/C25H27N3O5S/c1-18-11-12-19(16-23(18)34(31,32)28-13-5-2-6-14-28)24(29)27-22-10-4-3-9-21(22)25(30)26-17-20-8-7-15-33-20/h3-4,7-12,15-16H,2,5-6,13-14,17H2,1H3,(H,26,30)(H,27,29)	OBZURGGDVSLKAS-UHFFFAOYSA-N	Cc1ccc(cc1S(=O)(=O)N2CCCCC2)C(=O)Nc3ccccc3C(=O)NCc4occc4	BroadT	BRD-K81524053	BRD-K81524053-001-06-9	ChemBridge Corporation	7781625			Cc1ccc(cc1S(=O)(=O)N1CCCCC1)C(=O)Nc1ccccc1C(=O)NCc1ccco1	InChI=1S/C25H27N3O5S/c1-18-11-12-19(16-23(18)34(31,32)28-13-5-2-6-14-28)24(29)27-22-10-4-3-9-21(22)25(30)26-17-20-8-7-15-33-20/h3-4,7-12,15-16H,2,5-6,13-14,17H2,1H3,(H,26,30)(H,27,29)	OBZURGGDVSLKAS-UHFFFAOYSA-N	481.167141684							114709
T5697196	LSM-26172	SID49823169, BRD-K61494026	16391033	InChI=1S/C18H16N2O2/c1-12-7-8-17(19-11-12)20-18(21)15-9-13-5-3-4-6-14(13)10-16(15)22-2/h3-11H,1-2H3,(H,19,20,21)	GGRHEXSJDYSXBC-UHFFFAOYSA-N	COc1cc2ccccc2cc1C(=O)Nc3ccc(C)cn3	BroadT	BRD-K61494026	BRD-K61494026-001-05-5	UkrOrgSynthesis Ltd.	PB59498666			COc1cc2ccccc2cc1C(=O)Nc1ccc(C)cn1	InChI=1S/C18H16N2O2/c1-12-7-8-17(19-11-12)20-18(21)15-9-13-5-3-4-6-14(13)10-16(15)22-2/h3-11H,1-2H3,(H,19,20,21)	GGRHEXSJDYSXBC-UHFFFAOYSA-N	292.121177772							114710
5-Tert-butyl-n-[2-(cyclopentylamino)-2-oxoethyl]-n-(2,5-dimethylphenyl)-3-methylfuran-2-carboxamide	LSM-26173	SID17408390, BRD-K57778080	1454981	InChI=1S/C25H34N2O3/c1-16-11-12-17(2)20(13-16)27(15-22(28)26-19-9-7-8-10-19)24(29)23-18(3)14-21(30-23)25(4,5)6/h11-14,19H,7-10,15H2,1-6H3,(H,26,28)	FVHDXZMRUQCZTC-UHFFFAOYSA-N	Cc1ccc(C)c(c1)N(CC(=O)NC2CCCC2)C(=O)c3oc(cc3C)C(C)(C)C	BroadT	BRD-K57778080	BRD-K57778080-001-05-0	Asinex Ltd.	ASN 06744254			Cc1cc(oc1C(=O)N(CC(=O)NC1CCCC1)c1cc(C)ccc1C)C(C)(C)C	InChI=1S/C25H34N2O3/c1-16-11-12-17(2)20(13-16)27(15-22(28)26-19-9-7-8-10-19)24(29)23-18(3)14-21(30-23)25(4,5)6/h11-14,19H,7-10,15H2,1-6H3,(H,26,28)	FVHDXZMRUQCZTC-UHFFFAOYSA-N	410.256942968							114711
MLS000051812	LSM-26174	SID4260855, BRD-K87226979	1248078	InChI=1S/C19H23N3O3S/c1-5-21-16-11-14(4)18(12-17(16)22(6-2)19(21)23)26(24,25)20-15-10-8-7-9-13(15)3/h7-12,20H,5-6H2,1-4H3	WCRQIQPTWOLLQK-UHFFFAOYSA-N	CCN1C(=O)N(CC)c2cc(c(C)cc12)S(=O)(=O)Nc3ccccc3C	BroadT	BRD-K87226979	BRD-K87226979-001-06-6	ChemBridge Corporation	7950435			CCn1c2cc(C)c(cc2n(CC)c1=O)S(=O)(=O)Nc1ccccc1C	InChI=1S/C19H23N3O3S/c1-5-21-16-11-14(4)18(12-17(16)22(6-2)19(21)23)26(24,25)20-15-10-8-7-9-13(15)3/h7-12,20H,5-6H2,1-4H3	WCRQIQPTWOLLQK-UHFFFAOYSA-N	373.146012316							114712
N-{2-[5-(4-Tert-butyl-benzylsulfanyl)-[1,3,4]oxadiazol-2-yl]-phenyl}-benzamide	LSM-26175	SID17507288, BRD-K26985219	3137384	InChI=1S/C26H25N3O2S/c1-26(2,3)20-15-13-18(14-16-20)17-32-25-29-28-24(31-25)21-11-7-8-12-22(21)27-23(30)19-9-5-4-6-10-19/h4-16H,17H2,1-3H3,(H,27,30)	ZWEBXSFCUCGYRH-UHFFFAOYSA-N	CC(C)(C)c1ccc(CSc2oc(nn2)c3ccccc3NC(=O)c4ccccc4)cc1	BroadT	BRD-K26985219	BRD-K26985219-001-06-1	Asinex Ltd.	BAS 02069938			CC(C)(C)c1ccc(CSc2nnc(o2)-c2ccccc2NC(=O)c2ccccc2)cc1	InChI=1S/C26H25N3O2S/c1-26(2,3)20-15-13-18(14-16-20)17-32-25-29-28-24(31-25)21-11-7-8-12-22(21)27-23(30)19-9-5-4-6-10-19/h4-16H,17H2,1-3H3,(H,27,30)	ZWEBXSFCUCGYRH-UHFFFAOYSA-N	443.16674776							114713
2-(2-Chlorobenzoyl)-n-(2-methoxy-5-methylphenyl)hydrazinecarbothioamide	LSM-26176	SID14740420, BRD-K49281678	978041	InChI=1S/C16H16ClN3O2S/c1-10-7-8-14(22-2)13(9-10)18-16(23)20-19-15(21)11-5-3-4-6-12(11)17/h3-9H,1-2H3,(H,19,21)(H2,18,20,23)	NHOMQKHBWQCVLD-UHFFFAOYSA-N	COc1ccc(C)cc1N=C(S)NNC(=O)c2ccccc2Cl	BroadT	BRD-K49281678	BRD-K49281678-001-04-7	ChemBridge Corporation	7784139			COc1ccc(C)cc1N=C(S)NNC(=O)c1ccccc1Cl	InChI=1S/C16H16ClN3O2S/c1-10-7-8-14(22-2)13(9-10)18-16(23)20-19-15(21)11-5-3-4-6-12(11)17/h3-9H,1-2H3,(H,19,21)(H2,18,20,23)	NHOMQKHBWQCVLD-UHFFFAOYSA-N	349.065175182							114714
F1537-0035	LSM-26177	SID14726490, BRD-A91543130	2947295	InChI=1S/C22H26N4O3/c1-24(2)17-7-9-19(10-8-17)26-21(27)15-20(22(26)28)23-16-3-5-18(6-4-16)25-11-13-29-14-12-25/h3-10,20,23H,11-15H2,1-2H3	DORUFEBPUPGXPT-UHFFFAOYSA-N	CN(C)c1ccc(cc1)N2C(=O)CC(Nc3ccc(cc3)N4CCOCC4)C2=O	BroadT	BRD-A91543130	BRD-A91543130-001-06-6	Asinex Ltd.	BAS 07438839			CN(C)c1ccc(cc1)N1C(=O)CC(Nc2ccc(cc2)N2CCOCC2)C1=O	InChI=1S/C22H26N4O3/c1-24(2)17-7-9-19(10-8-17)26-21(27)15-20(22(26)28)23-16-3-5-18(6-4-16)25-11-13-29-14-12-25/h3-10,20,23H,11-15H2,1-2H3	DORUFEBPUPGXPT-UHFFFAOYSA-N	394.200490732							114715
T5333197	LSM-26178	SID17516593, BRD-K35907578	4969491	InChI=1S/C20H24F3N3S/c1-25(2)12-7-13-26(15-16-8-4-3-5-9-16)19(27)24-18-11-6-10-17(14-18)20(21,22)23/h3-6,8-11,14H,7,12-13,15H2,1-2H3,(H,24,27)	RGERENBIMAVPHU-UHFFFAOYSA-N	CN(C)CCCN(Cc1ccccc1)C(=Nc2cccc(c2)C(F)(F)F)S	BroadT	BRD-K35907578	BRD-K35907578-001-05-1	Enamine Ltd.	T5333197			CN(C)CCCN(Cc1ccccc1)C(S)=Nc1cccc(c1)C(F)(F)F	InChI=1S/C20H24F3N3S/c1-25(2)12-7-13-26(15-16-8-4-3-5-9-16)19(27)24-18-11-6-10-17(14-18)20(21,22)23/h3-6,8-11,14H,7,12-13,15H2,1-2H3,(H,24,27)	RGERENBIMAVPHU-UHFFFAOYSA-N	395.164303088							114716
1-(Diethylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile	LSM-26179	SID26663799, BRD-K85351291	679573	InChI=1S/C17H18N4/c1-4-20(5-2)16-10-12(3)13(11-18)17-19-14-8-6-7-9-15(14)21(16)17/h6-10H,4-5H2,1-3H3	XONJKKJNPBFWFF-UHFFFAOYSA-N	CCN(CC)c1cc(C)c(C#N)c2nc3ccccc3n12	BroadT	BRD-K85351291	BRD-K85351291-001-05-7	InterBioScreen Ltd.	STOCK3S-36774			CCN(CC)c1cc(C)c(C#N)c2nc3ccccc3n12	InChI=1S/C17H18N4/c1-4-20(5-2)16-10-12(3)13(11-18)17-19-14-8-6-7-9-15(14)21(16)17/h6-10H,4-5H2,1-3H3	XONJKKJNPBFWFF-UHFFFAOYSA-N	278.153146616							114717
ST50839782	LSM-26180	SID47198629, BRD-A38054473	6468194	InChI=1S/C15H19N3O2S/c1-10-7-18(8-11(2)20-10)9-14(19)17-15-16-12-5-3-4-6-13(12)21-15/h3-6,10-11H,7-9H2,1-2H3,(H,16,17,19)	FVWYHIRBYMNAMA-UHFFFAOYSA-N	CC1CN(CC(=O)Nc2nc3ccccc3s2)CC(C)O1	BroadT	BRD-A38054473	BRD-A38054473-001-05-7	ChemBridge Corporation	9050169			CC1CN(CC(=O)Nc2nc3ccccc3s2)CC(C)O1	InChI=1S/C15H19N3O2S/c1-10-7-18(8-11(2)20-10)9-14(19)17-15-16-12-5-3-4-6-13(12)21-15/h3-6,10-11H,7-9H2,1-2H3,(H,16,17,19)	FVWYHIRBYMNAMA-UHFFFAOYSA-N	305.119797568							114718
ST51020440	LSM-26181	SID17415216, SID85176595, BRD-K77393308	2279440	InChI=1S/C28H31N3O3S/c32-28(29-26-12-14-27(15-13-26)35(33,34)31-17-4-1-5-18-31)24-10-8-22(9-11-24)20-30-19-16-23-6-2-3-7-25(23)21-30/h2-3,6-15H,1,4-5,16-21H2,(H,29,32)	ZWLIOLNWONUVEB-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)S(=O)(=O)N2CCCCC2)c3ccc(CN4CCc5ccccc5C4)cc3	BroadT	BRD-K77393308	BRD-K77393308-001-06-8	ChemBridge Corporation	6394275			O=C(Nc1ccc(cc1)S(=O)(=O)N1CCCCC1)c1ccc(CN2CCc3ccccc3C2)cc1	InChI=1S/C28H31N3O3S/c32-28(29-26-12-14-27(15-13-26)35(33,34)31-17-4-1-5-18-31)24-10-8-22(9-11-24)20-30-19-16-23-6-2-3-7-25(23)21-30/h2-3,6-15H,1,4-5,16-21H2,(H,29,32)	ZWLIOLNWONUVEB-UHFFFAOYSA-N	489.208612572							114719
T6213400	LSM-26182	SID3714421, BRD-K35448613	2998794	InChI=1S/C17H19Cl2N3O2S/c1-21-8-10-22(11-9-21)16-7-6-13(18)12-15(16)20-25(23,24)17-5-3-2-4-14(17)19/h2-7,12,20H,8-11H2,1H3	JAXHRWLWPCLFRN-UHFFFAOYSA-N	CN1CCN(CC1)c2ccc(Cl)cc2NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K35448613	BRD-K35448613-001-05-3	Enamine Ltd.	T5338766			CN1CCN(CC1)c1ccc(Cl)cc1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C17H19Cl2N3O2S/c1-21-8-10-22(11-9-21)16-7-6-13(18)12-15(16)20-25(23,24)17-5-3-2-4-14(17)19/h2-7,12,20H,8-11H2,1H3	JAXHRWLWPCLFRN-UHFFFAOYSA-N	399.057502988							114720
SMR000116447	LSM-26183	SID14724573, BRD-K52542093	1103668	InChI=1S/C17H10ClF3N4O2S/c18-13-14(16(26)22-8-9-3-1-5-27-9)24-25-12(17(19,20)21)7-10(23-15(13)25)11-4-2-6-28-11/h1-7H,8H2,(H,22,26)	YNQCXSMSMTZTRH-UHFFFAOYSA-N	FC(F)(F)c1cc(nc2c(Cl)c(nn12)C(=O)NCc3occc3)c4cccs4	BroadT	BRD-K52542093	BRD-K52542093-001-05-0	Asinex Ltd.	BAS 00481769			FC(F)(F)c1cc(nc2c(Cl)c(nn12)C(=O)NCc1ccco1)-c1cccs1	InChI=1S/C17H10ClF3N4O2S/c18-13-14(16(26)22-8-9-3-1-5-27-9)24-25-12(17(19,20)21)7-10(23-15(13)25)11-4-2-6-28-11/h1-7H,8H2,(H,22,26)	YNQCXSMSMTZTRH-UHFFFAOYSA-N	426.0165086							114721
ST50323053	LSM-26184	SID49645376, BRD-K15976239	3097937	InChI=1S/C13H11N3O5S2/c14-22(18,19)7-1-3-9-10-4-2-8(23(15,20)21)6-12(10)13(16-17)11(9)5-7/h1-6,17H,(H2,14,18,19)(H2,15,20,21)	AAUWIESHYVTZBJ-UHFFFAOYSA-N	NS(=O)(=O)c1ccc2c3ccc(cc3C(=NO)c2c1)S(=O)(=O)N	BroadT	BRD-K15976239	BRD-K15976239-001-07-7	Asinex Ltd.	BAS 00291867			NS(=O)(=O)c1ccc2-c3ccc(cc3C(=NO)c2c1)S(N)(=O)=O	InChI=1S/C13H11N3O5S2/c14-22(18,19)7-1-3-9-10-4-2-8(23(15,20)21)6-12(10)13(16-17)11(9)5-7/h1-6,17H,(H2,14,18,19)(H2,15,20,21)	AAUWIESHYVTZBJ-UHFFFAOYSA-N	353.014011862							114722
MLS000070919	LSM-26185	SID848175, BRD-K63816485	650604	InChI=1S/C14H14N4O2S3/c1-6-4-21-13(15-6)16-9(19)5-22-14-17-11(20)10-7(2)8(3)23-12(10)18-14/h4H,5H2,1-3H3,(H,15,16,19)(H,17,18,20)	SSLFSJSESOYTHY-UHFFFAOYSA-N	Cc1csc(NC(=O)CSc2nc(O)c3c(C)c(C)sc3n2)n1	BroadT	BRD-K63816485	BRD-K63816485-001-05-1	Asinex Ltd.	ASN 06153314			Cc1csc(NC(=O)CSc2nc(O)c3c(C)c(C)sc3n2)n1	InChI=1S/C14H14N4O2S3/c1-6-4-21-13(15-6)16-9(19)5-22-14-17-11(20)10-7(2)8(3)23-12(10)18-14/h4H,5H2,1-3H3,(H,15,16,19)(H,17,18,20)	SSLFSJSESOYTHY-UHFFFAOYSA-N	366.027887798							114723
AC1MKTOA	LSM-15386	BRD-A75539147	3209614	InChI=1S/C26H34N6O4/c1-33-20-8-6-19(7-9-20)30-12-14-31(15-13-30)25(23-17-21(34-2)10-11-24(23)35-3)26-27-28-29-32(26)18-22-5-4-16-36-22/h6-11,17,22,25H,4-5,12-16,18H2,1-3H3	LDWGDKIDKBYSIM-UHFFFAOYSA-N	COc1ccc(cc1)N2CCN(CC2)C(c3cc(OC)ccc3OC)c4nnnn4CC5CCCO5	BroadT	BRD-A75539147	BRD-A75539147-003-05-3	Asinex Ltd.	ASN 05555291		Cl	COc1ccc(cc1)N1CCN(CC1)C(c1nnnn1CC1CCCO1)c1cc(OC)ccc1OC.Cl	InChI=1S/C26H34N6O4.ClH/c1-33-20-8-6-19(7-9-20)30-12-14-31(15-13-30)25(23-17-21(34-2)10-11-24(23)35-3)26-27-28-29-32(26)18-22-5-4-16-36-22;/h6-11,17,22,25H,4-5,12-16,18H2,1-3H3;1H	NPVRQCLOISIMCW-UHFFFAOYSA-N	494.264153628							104028, 104028
Methyl 4-{[(2-methyl-1,3-benzothiazol-6-yl)carbonyl]amino}benzoate	LSM-26186	SID49640867, BRD-K74231754	900716	InChI=1S/C17H14N2O3S/c1-10-18-14-8-5-12(9-15(14)23-10)16(20)19-13-6-3-11(4-7-13)17(21)22-2/h3-9H,1-2H3,(H,19,20)	ZZEFQWDTFDCEEU-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=O)c2ccc3nc(C)sc3c2)cc1	BroadT	BRD-K74231754	BRD-K74231754-001-05-4	Asinex Ltd.	BAS 06838048			COC(=O)c1ccc(NC(=O)c2ccc3nc(C)sc3c2)cc1	InChI=1S/C17H14N2O3S/c1-10-18-14-8-5-12(9-15(14)23-10)16(20)19-13-6-3-11(4-7-13)17(21)22-2/h3-9H,1-2H3,(H,19,20)	ZZEFQWDTFDCEEU-UHFFFAOYSA-N	326.072513018							114724
MLS000755403	LSM-26187	SID24824515, BRD-K12235135	1483674	InChI=1S/C16H9Cl2NO2S/c17-11-5-6-12(13(18)7-11)14-8-22-15(19-14)9-1-3-10(4-2-9)16(20)21/h1-8H,(H,20,21)	PHLNMNRVMBDTSX-UHFFFAOYSA-N	OC(=O)c1ccc(cc1)c2nc(cs2)c3ccc(Cl)cc3Cl	BroadT	BRD-K12235135	BRD-K12235135-001-05-0	Key Organics Ltd.	1G-326S			OC(=O)c1ccc(cc1)-c1nc(cs1)-c1ccc(Cl)cc1Cl	InChI=1S/C16H9Cl2NO2S/c17-11-5-6-12(13(18)7-11)14-8-22-15(19-14)9-1-3-10(4-2-9)16(20)21/h1-8H,(H,20,21)	PHLNMNRVMBDTSX-UHFFFAOYSA-N	348.973104648							114725
N-(4-Oxo-3,4-dihydro-quinazolin-2-ylmethyl)-n-phenethyl-butyramide	LSM-26188	SID853353, BRD-K66631864	656009	InChI=1S/C21H23N3O2/c1-2-8-20(25)24(14-13-16-9-4-3-5-10-16)15-19-22-18-12-7-6-11-17(18)21(26)23-19/h3-7,9-12H,2,8,13-15H2,1H3,(H,22,23,26)	QIEBFLCHNHPKEK-UHFFFAOYSA-N	CCCC(=O)N(CCc1ccccc1)Cc2nc(O)c3ccccc3n2	BroadT	BRD-K66631864	BRD-K66631864-001-05-2	Asinex Ltd.	ASN 05812703			CCCC(=O)N(CCc1ccccc1)Cc1nc(O)c2ccccc2n1	InChI=1S/C21H23N3O2/c1-2-8-20(25)24(14-13-16-9-4-3-5-10-16)15-19-22-18-12-7-6-11-17(18)21(26)23-19/h3-7,9-12H,2,8,13-15H2,1H3,(H,22,23,26)	QIEBFLCHNHPKEK-UHFFFAOYSA-N	349.179027006							114726
SMR000221098	LSM-44162	SID22402715, BRD-K10810958	1850689	InChI=1S/C25H20N4O3S/c1-32-17-10-8-16(9-11-17)12-13-27-24(30)20(15-26)22-18-5-2-3-6-19(18)23(28-22)29-25(31)21-7-4-14-33-21/h2-11,14H,12-13H2,1H3,(H,27,30)(H,28,29,31)/b22-20-	VCCGQFJXGMRRHV-XDOYNYLZSA-N	COc1ccc(CCNC(=O)\C(=C\2/N=C(NC(=O)c3cccs3)c4ccccc24)\C#N)cc1	BroadT	BRD-K10810958	BRD-K10810958-001-05-6	InterBioScreen Ltd.	STOCK5S-38169			COc1ccc(CCNC(=O)C(\C#N)=C2/N=C(NC(=O)c3cccs3)c3ccccc23)cc1	InChI=1S/C25H20N4O3S/c1-32-17-10-8-16(9-11-17)12-13-27-24(30)20(15-26)22-18-5-2-3-6-19(18)23(28-22)29-25(31)21-7-4-14-33-21/h2-11,14H,12-13H2,1H3,(H,27,30)(H,28,29,31)/b22-20-	VCCGQFJXGMRRHV-XDOYNYLZSA-N	456.12561123							
MLS000713731	LSM-44163	SID24801983, BRD-K90976916	1745927	InChI=1S/C22H19N3O4S2/c1-13-19(21(28)25(23(13)2)15-7-5-4-6-8-15)24-20(27)18(31-22(24)30)12-14-9-10-16(26)17(11-14)29-3/h4-12,26H,1-3H3/b18-12+	SZESRDLHBLPEJF-LDADJPATSA-N	COc1cc(\C=C/2\SC(=S)N(C2=O)C3=C(C)N(C)N(C3=O)c4ccccc4)ccc1O	BroadT	BRD-K90976916	BRD-K90976916-001-05-9	Asinex Ltd.	BAS 00664884			COc1cc(\C=C2\SC(=S)N(C2=O)c2c(C)n(C)n(-c3ccccc3)c2=O)ccc1O	InChI=1S/C22H19N3O4S2/c1-13-19(21(28)25(23(13)2)15-7-5-4-6-8-15)24-20(27)18(31-22(24)30)12-14-9-10-16(26)17(11-14)29-3/h4-12,26H,1-3H3/b18-12+	SZESRDLHBLPEJF-LDADJPATSA-N	453.081697498							
T5235581	LSM-26191	SID22410236, BRD-K64876000	4355159	InChI=1S/C23H26N6O3S3/c1-16-9-11-17(12-10-16)26-22-27-28-23(34-22)33-15-21(30)25-18-6-5-7-19(14-18)35(31,32)29-20-8-3-2-4-13-24-20/h5-7,9-12,14H,2-4,8,13,15H2,1H3,(H,24,29)(H,25,30)(H,26,27)	NQERPKGESVOKTF-UHFFFAOYSA-N	Cc1ccc(Nc2nnc(SCC(=O)Nc3cccc(c3)S(=O)(=O)NC4=NCCCCC4)s2)cc1	BroadT	BRD-K64876000	BRD-K64876000-001-05-0	Enamine Ltd.	T5235581			Cc1ccc(Nc2nnc(SCC(=O)Nc3cccc(c3)S(=O)(=O)NC3=NCCCCC3)s2)cc1	InChI=1S/C23H26N6O3S3/c1-16-9-11-17(12-10-16)26-22-27-28-23(34-22)33-15-21(30)25-18-6-5-7-19(14-18)35(31,32)29-20-8-3-2-4-13-24-20/h5-7,9-12,14H,2-4,8,13,15H2,1H3,(H,24,29)(H,25,30)(H,26,27)	NQERPKGESVOKTF-UHFFFAOYSA-N	530.122850822							114729
2-Chloro-4,6-diphenylpyrimidine	LSM-26192	SID17432609, BRD-K94144404	1804739	InChI=1S/C16H11ClN2/c17-16-18-14(12-7-3-1-4-8-12)11-15(19-16)13-9-5-2-6-10-13/h1-11H	QNGVEVOZKYHNGL-UHFFFAOYSA-N	Clc1nc(cc(n1)c2ccccc2)c3ccccc3	BroadT	BRD-K94144404	BRD-K94144404-001-05-9	ChemBridge Corporation	5256452			Clc1nc(cc(n1)-c1ccccc1)-c1ccccc1	InChI=1S/C16H11ClN2/c17-16-18-14(12-7-3-1-4-8-12)11-15(19-16)13-9-5-2-6-10-13/h1-11H	QNGVEVOZKYHNGL-UHFFFAOYSA-N	266.061076082							114730
STK067779	LSM-26193	SID17415864, BRD-K66768592	1347073	InChI=1S/C20H15ClN2O2S/c21-15-6-10-17(11-7-15)25-18-12-8-16(9-13-18)22-20(26)23-19(24)14-4-2-1-3-5-14/h1-13H,(H2,22,23,24,26)	PVYQODCQLOJHKG-UHFFFAOYSA-N	Clc1ccc(Oc2ccc(NC(=S)NC(=O)c3ccccc3)cc2)cc1	BroadT	BRD-K66768592	BRD-K66768592-001-05-1	ChemBridge Corporation	6340406			Clc1ccc(Oc2ccc(NC(=S)NC(=O)c3ccccc3)cc2)cc1	InChI=1S/C20H15ClN2O2S/c21-15-6-10-17(11-7-15)25-18-12-8-16(9-13-18)22-20(26)23-19(24)14-4-2-1-3-5-14/h1-13H,(H2,22,23,24,26)	PVYQODCQLOJHKG-UHFFFAOYSA-N	382.05427614							114731
SMR000175975	LSM-26194	SID17403172, BRD-K01383926	1105480	InChI=1S/C21H22N2O3S2/c1-21(2)19-18(14-11-13(24-3)7-8-15(14)22-21)20(27)23(28-19)12-6-9-16(25-4)17(10-12)26-5/h6-11,22H,1-5H3	ZNASCFNVWPEJQA-UHFFFAOYSA-N	COc1ccc2NC(C)(C)C3=C(C(=S)N(S3)c4ccc(OC)c(OC)c4)c2c1	BroadT	BRD-K01383926	BRD-K01383926-001-07-0	Asinex Ltd.	BAS 00757589			COc1ccc2NC(C)(C)c3sn(-c4ccc(OC)c(OC)c4)c(=S)c3-c2c1	InChI=1S/C21H22N2O3S2/c1-21(2)19-18(14-11-13(24-3)7-8-15(14)22-21)20(27)23(28-19)12-6-9-16(25-4)17(10-12)26-5/h6-11,22H,1-5H3	ZNASCFNVWPEJQA-UHFFFAOYSA-N	414.107183964							114732
6P-666S	LSM-26195	SID17411472, BRD-K83579280	1481301	InChI=1S/C21H17Cl2N5OS/c1-2-27-20(19-18(29)10-11-28(26-19)15-6-4-3-5-7-15)24-25-21(27)30-13-14-8-9-16(22)17(23)12-14/h3-12H,2,13H2,1H3	LIOAXJASPFPCTE-UHFFFAOYSA-N	CCn1c(SCc2ccc(Cl)c(Cl)c2)nnc1C3=NN(C=CC3=O)c4ccccc4	BroadT	BRD-K83579280	BRD-K83579280-001-05-8	Key Organics Ltd.	6P-666S			CCn1c(SCc2ccc(Cl)c(Cl)c2)nnc1-c1nn(ccc1=O)-c1ccccc1	InChI=1S/C21H17Cl2N5OS/c1-2-27-20(19-18(29)10-11-28(26-19)15-6-4-3-5-7-15)24-25-21(27)30-13-14-8-9-16(22)17(23)12-14/h3-12H,2,13H2,1H3	LIOAXJASPFPCTE-UHFFFAOYSA-N	457.053086324							114733
ZINC03184329	LSM-26196	SID24825575, BRD-K87267431	2317127	InChI=1S/C15H14BrNO/c1-2-11-7-9-12(10-8-11)17-15(18)13-5-3-4-6-14(13)16/h3-10H,2H2,1H3,(H,17,18)	OUXGAIHLHUOONA-UHFFFAOYSA-N	CCc1ccc(NC(=O)c2ccccc2Br)cc1	BroadT	BRD-K87267431	BRD-K87267431-001-05-4	Enamine Ltd.	T0400-0744			CCc1ccc(NC(=O)c2ccccc2Br)cc1	InChI=1S/C15H14BrNO/c1-2-11-7-9-12(10-8-11)17-15(18)13-5-3-4-6-14(13)16/h3-10H,2H2,1H3,(H,17,18)	OUXGAIHLHUOONA-UHFFFAOYSA-N	303.025876678							114734
CDS1_004939	LSM-15387	BRD-K83500212	2880423	InChI=1S/C13H17N3OS/c1-9-5-6-10(17-9)7-14-16-12-15-11(8-18-12)13(2,3)4/h5-8H,1-4H3,(H,15,16)	ZQIPGMMXNTXGPR-UHFFFAOYSA-N	Cc1oc(C=NNc2nc(cs2)C(C)(C)C)cc1	BroadT	BRD-K83500212	BRD-K83500212-003-12-9	ChemBridge Corporation	6004750		Cl	Cc1ccc(C=NNc2nc(cs2)C(C)(C)C)o1.Cl	InChI=1S/C13H17N3OS.ClH/c1-9-5-6-10(17-9)7-14-16-12-15-11(8-18-12)13(2,3)4;/h5-8H,1-4H3,(H,15,16);1H	IXLBHOZUWAOZOA-UHFFFAOYSA-N	263.109232884							104029
(Quinolin-8-ylsulfanyl)acetic acid	LSM-15187	SID7967636, BRD-K62723829	693120	InChI=1S/C11H9NO2S/c13-10(14)7-15-9-5-1-3-8-4-2-6-12-11(8)9/h1-6H,7H2,(H,13,14)	UDBABHVKOSPWKD-UHFFFAOYSA-N	OC(=O)CSc1cccc2cccnc12	BroadT	BRD-K62723829	BRD-K62723829-236-05-7	ChemBridge Corporation	7123737		[Na]	OC(=O)CSc1cccc2cccnc12.[Na]	InChI=1S/C11H9NO2S.Na.H/c13-10(14)7-15-9-5-1-3-8-4-2-6-12-11(8)9;;/h1-6H,7H2,(H,13,14);;	MOCXSMJZESTUHI-UHFFFAOYSA-N	219.035399228							103837, 103837
ST50943003	LSM-26197	SID24822788, BRD-K50874768	3728297	InChI=1S/C24H24N4O2/c1-2-30-19-10-8-18(9-11-19)23-16-21(20-6-3-4-7-22(20)27-23)24(29)26-12-5-14-28-15-13-25-17-28/h3-4,6-11,13,15-17H,2,5,12,14H2,1H3,(H,26,29)	GBHIPHOGLQHORF-UHFFFAOYSA-N	CCOc1ccc(cc1)c2cc(C(=O)NCCCn3ccnc3)c4ccccc4n2	BroadT	BRD-K50874768	BRD-K50874768-001-05-3	ChemDiv Inc.	6049-2988			CCOc1ccc(cc1)-c1cc(C(=O)NCCCn2ccnc2)c2ccccc2n1	InChI=1S/C24H24N4O2/c1-2-30-19-10-8-18(9-11-19)23-16-21(20-6-3-4-7-22(20)27-23)24(29)26-12-5-14-28-15-13-25-17-28/h3-4,6-11,13,15-17H,2,5,12,14H2,1H3,(H,26,29)	GBHIPHOGLQHORF-UHFFFAOYSA-N	400.189926048							114735
AC1LZGVI	LSM-26198	SID14742095, BRD-K30879928	1921979	InChI=1S/C20H20N2O3S/c23-26(24,20-10-5-16-3-1-2-4-17(16)15-20)21-18-6-8-19(9-7-18)22-11-13-25-14-12-22/h1-10,15,21H,11-14H2	HTDGPERBSREBHY-UHFFFAOYSA-N	O=S(=O)(Nc1ccc(cc1)N2CCOCC2)c3ccc4ccccc4c3	BroadT	BRD-K30879928	BRD-K30879928-001-05-4	InterBioScreen Ltd.	STOCK2S-47074			O=S(=O)(Nc1ccc(cc1)N1CCOCC1)c1ccc2ccccc2c1	InChI=1S/C20H20N2O3S/c23-26(24,20-10-5-16-3-1-2-4-17(16)15-20)21-18-6-8-19(9-7-18)22-11-13-25-14-12-22/h1-10,15,21H,11-14H2	HTDGPERBSREBHY-UHFFFAOYSA-N	368.11946321							114736
AC1M0VVY	LSM-26199	SID24816087, BRD-K02491227	2057788	InChI=1S/C17H16N4O5S2/c22-15(18-17-20-19-16(26-17)14-2-1-11-27-14)12-3-5-13(6-4-12)28(23,24)21-7-9-25-10-8-21/h1-6,11H,7-10H2,(H,18,20,22)	WQQJILXJCLOLGG-UHFFFAOYSA-N	O=C(Nc1oc(nn1)c2cccs2)c3ccc(cc3)S(=O)(=O)N4CCOCC4	BroadT	BRD-K02491227	BRD-K02491227-001-05-0	Life Chemicals Inc.	F0559-0348			O=C(Nc1nnc(o1)-c1cccs1)c1ccc(cc1)S(=O)(=O)N1CCOCC1	InChI=1S/C17H16N4O5S2/c22-15(18-17-20-19-16(26-17)14-2-1-11-27-14)12-3-5-13(6-4-12)28(23,24)21-7-9-25-10-8-21/h1-6,11H,7-10H2,(H,18,20,22)	WQQJILXJCLOLGG-UHFFFAOYSA-N	420.056211032							114737
AC1N6QS9	LSM-26200	BRD-K91045668	4264345	InChI=1S/C19H16N6O/c26-19(25-23-14-16-6-10-21-11-7-16)17-2-1-3-18(12-17)24-22-13-15-4-8-20-9-5-15/h1-14,24H,(H,25,26)	WNQDZWBRSCRHEM-UHFFFAOYSA-N	O=C(NN=Cc1ccncc1)c2cccc(NN=Cc3ccncc3)c2	BroadT	BRD-K91045668	BRD-K91045668-001-07-8	Enamine Ltd.	T0514-4524			O=C(NN=Cc1ccncc1)c1cccc(NN=Cc2ccncc2)c1	InChI=1S/C19H16N6O/c26-19(25-23-14-16-6-10-21-11-7-16)17-2-1-3-18(12-17)24-22-13-15-4-8-20-9-5-15/h1-14,24H,(H,25,26)	WNQDZWBRSCRHEM-UHFFFAOYSA-N	344.138559192							114738
MLS000091143	LSM-26201	SID4247053, BRD-K81572714	3241309	InChI=1S/C21H23N3O2/c1-3-24(15-17-7-5-4-6-8-17)20(25)14-13-19-22-21(23-26-19)18-11-9-16(2)10-12-18/h4-12H,3,13-15H2,1-2H3	XZDCSBQBJZBHKX-UHFFFAOYSA-N	CCN(Cc1ccccc1)C(=O)CCc2onc(n2)c3ccc(C)cc3	BroadT	BRD-K81572714	BRD-K81572714-001-06-9	ChemDiv Inc.	C289-0657			CCN(Cc1ccccc1)C(=O)CCc1nc(no1)-c1ccc(C)cc1	InChI=1S/C21H23N3O2/c1-3-24(15-17-7-5-4-6-8-17)20(25)14-13-19-22-21(23-26-19)18-11-9-16(2)10-12-18/h4-12H,3,13-15H2,1-2H3	XZDCSBQBJZBHKX-UHFFFAOYSA-N	349.179027006							114739
AC1MX0BL	LSM-15219	BRD-A82293681	3782737	InChI=1S/C28H29BrNO2/c29-25-13-11-22(12-14-25)27(31)20-30-17-15-21(16-18-30)26(19-30)28(32,23-7-3-1-4-8-23)24-9-5-2-6-10-24/h1-14,21,26,32H,15-20H2/q+1	JHQFDHSPOYHZMH-UHFFFAOYSA-N	OC(C1C[N+]2(CC(=O)c3ccc(Br)cc3)CCC1CC2)(c4ccccc4)c5ccccc5	BroadT	BRD-A82293681	BRD-A82293681-004-06-6	InterBioScreen Ltd.	STOCK2S-46466		Br	OC(C1C[N+]2(CCC1CC2)CC(=O)c1ccc(Br)cc1)(c1ccccc1)c1ccccc1.Br	InChI=1S/C28H29BrNO2.BrH/c29-25-13-11-22(12-14-25)27(31)20-30-17-15-21(16-18-30)26(19-30)28(32,23-7-3-1-4-8-23)24-9-5-2-6-10-24;/h1-14,21,26,32H,15-20H2;1H/q+1;	DXZUMBLTFOAMIF-UHFFFAOYSA-N	490.138166778							103866, 103866
AC1LGYJE	LSM-26202	BRD-K70195702	829173	InChI=1S/C15H18N4OS/c1-19(2)13-7-5-12(6-8-13)10-17-18-15(21)16-11-14-4-3-9-20-14/h3-10H,11H2,1-2H3,(H2,16,18,21)	SEUJBLRENXKWQS-UHFFFAOYSA-N	CN(C)c1ccc(C=NN=C(S)NCc2occc2)cc1	BroadT	BRD-K70195702	BRD-K70195702-001-06-6	Specs	AF-399/15030125			CN(C)c1ccc(C=NN=C(S)NCc2ccco2)cc1	InChI=1S/C15H18N4OS/c1-19(2)13-7-5-12(6-8-13)10-17-18-15(21)16-11-14-4-3-9-20-14/h3-10H,11H2,1-2H3,(H2,16,18,21)	SEUJBLRENXKWQS-UHFFFAOYSA-N	302.120131926							114740
UNM000011099101	LSM-26203	SID57299466, SID4244513, BRD-K08198475	3239096	InChI=1S/C18H15N3O3/c1-2-24-18(23)12-6-5-7-13(10-12)20-17(22)16-11-19-14-8-3-4-9-15(14)21-16/h3-11H,2H2,1H3,(H,20,22)	MBQCDYMTQRDDJC-UHFFFAOYSA-N	CCOC(=O)c1cccc(NC(=O)c2cnc3ccccc3n2)c1	BroadT	BRD-K08198475	BRD-K08198475-001-05-4	ChemDiv Inc.	C286-0016			CCOC(=O)c1cccc(NC(=O)c2cnc3ccccc3n2)c1	InChI=1S/C18H15N3O3/c1-2-24-18(23)12-6-5-7-13(10-12)20-17(22)16-11-19-14-8-3-4-9-15(14)21-16/h3-11H,2H2,1H3,(H,20,22)	MBQCDYMTQRDDJC-UHFFFAOYSA-N	321.11134137							114741
2-[(4,6-Dimethylpyrimidin-2-yl)sulfanyl]-n-(4,5-diphenyl-1,3-oxazol-2-yl)acetamide	LSM-26204	SID17433592, BRD-K33960484	1213344	InChI=1S/C23H20N4O2S/c1-15-13-16(2)25-23(24-15)30-14-19(28)26-22-27-20(17-9-5-3-6-10-17)21(29-22)18-11-7-4-8-12-18/h3-13H,14H2,1-2H3,(H,26,27,28)	PPZRWTWOIPKTKX-UHFFFAOYSA-N	Cc1cc(C)nc(SCC(=O)Nc2oc(c3ccccc3)c(n2)c4ccccc4)n1	BroadT	BRD-K33960484	BRD-K33960484-001-05-5	ChemBridge Corporation	7226704			Cc1cc(C)nc(SCC(=O)Nc2nc(c(o2)-c2ccccc2)-c2ccccc2)n1	InChI=1S/C23H20N4O2S/c1-15-13-16(2)25-23(24-15)30-14-19(28)26-22-27-20(17-9-5-3-6-10-17)21(29-22)18-11-7-4-8-12-18/h3-13H,14H2,1-2H3,(H,26,27,28)	PPZRWTWOIPKTKX-UHFFFAOYSA-N	416.13069661							114742
ZINC03346018	LSM-26205	SID24831972, BRD-K34072195	2462661	InChI=1S/C17H16N2O3S/c1-10-18-13-6-5-12(9-16(13)23-10)19-17(20)11-4-7-14(21-2)15(8-11)22-3/h4-9H,1-3H3,(H,19,20)	AULWRMWVYRKDQT-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)Nc2ccc3nc(C)sc3c2	BroadT	BRD-K34072195	BRD-K34072195-001-05-8	Enamine Ltd.	T5319086			COc1ccc(cc1OC)C(=O)Nc1ccc2nc(C)sc2c1	InChI=1S/C17H16N2O3S/c1-10-18-13-6-5-12(9-16(13)23-10)19-17(20)11-4-7-14(21-2)15(8-11)22-3/h4-9H,1-3H3,(H,19,20)	AULWRMWVYRKDQT-UHFFFAOYSA-N	328.088163082							114743
SMR000009711	LSM-26206	SID849412, BRD-A54760339	651898	InChI=1S/C17H27NO5/c1-14(19)15-3-4-16-17(13-15)23-12-10-21-8-6-18(2)5-7-20-9-11-22-16/h3-4,13-14,19H,5-12H2,1-2H3	JKEUHRWYEDMOHX-UHFFFAOYSA-N	CC(O)c1ccc2OCCOCCN(C)CCOCCOc2c1	BroadT	BRD-A54760339	BRD-A54760339-001-05-2	Asinex Ltd.	BAS 00918709			CC(O)c1ccc2OCCOCCN(C)CCOCCOc2c1	InChI=1S/C17H27NO5/c1-14(19)15-3-4-16-17(13-15)23-12-10-21-8-6-18(2)5-7-20-9-11-22-16/h3-4,13-14,19H,5-12H2,1-2H3	JKEUHRWYEDMOHX-UHFFFAOYSA-N	325.188922974							114744
MLS000581626	LSM-26207	SID17432269, BRD-K26748151	972779	InChI=1S/C16H14N4OS/c1-21-13-5-2-11(3-6-13)19-16(22)20-12-4-7-14-15(10-12)18-9-8-17-14/h2-10H,1H3,(H2,19,20,22)	QZPCJJRASLLHBS-UHFFFAOYSA-N	COc1ccc(NC(=Nc2ccc3nccnc3c2)S)cc1	BroadT	BRD-K26748151	BRD-K26748151-001-06-3	ChemBridge Corporation	7863517			COc1ccc(NC(S)=Nc2ccc3nccnc3c2)cc1	InChI=1S/C16H14N4OS/c1-21-13-5-2-11(3-6-13)19-16(22)20-12-4-7-14-15(10-12)18-9-8-17-14/h2-10H,1H3,(H2,19,20,22)	QZPCJJRASLLHBS-UHFFFAOYSA-N	310.088831798							114745
7G-421S	LSM-26208	SID17410390, BRD-K23890108	1483262	InChI=1S/C14H12Cl2F3N3O/c1-7(2)20-13-21-11(14(17,18)19)6-12(22-13)23-10-4-3-8(15)5-9(10)16/h3-7H,1-2H3,(H,20,21,22)	KPZTYFJZQWHZPA-UHFFFAOYSA-N	CC(C)Nc1nc(Oc2ccc(Cl)cc2Cl)cc(n1)C(F)(F)F	BroadT	BRD-K23890108	BRD-K23890108-001-05-2	Key Organics Ltd.	7G-421S			CC(C)Nc1nc(Oc2ccc(Cl)cc2Cl)cc(n1)C(F)(F)F	InChI=1S/C14H12Cl2F3N3O/c1-7(2)20-13-21-11(14(17,18)19)6-12(22-13)23-10-4-3-8(15)5-9(10)16/h3-7H,1-2H3,(H,20,21,22)	KPZTYFJZQWHZPA-UHFFFAOYSA-N	365.030952054							114746
MLS000116131	LSM-26209	SID7968159, BRD-K47243638	5309256	InChI=1S/C21H24N6O/c1-3-26-8-10-27(11-9-26)20-12-15(2)17-13-16(4-5-18(17)25-20)24-21(28)19-14-22-6-7-23-19/h4-7,12-14H,3,8-11H2,1-2H3,(H,24,28)	OKBFUFJXNIYMDI-UHFFFAOYSA-N	CCN1CCN(CC1)c2cc(C)c3cc(NC(=O)c4cnccn4)ccc3n2	BroadT	BRD-K47243638	BRD-K47243638-001-04-8	ChemDiv Inc.	C095-0278			CCN1CCN(CC1)c1cc(C)c2cc(NC(=O)c3cnccn3)ccc2n1	InChI=1S/C21H24N6O/c1-3-26-8-10-27(11-9-26)20-12-15(2)17-13-16(4-5-18(17)25-20)24-21(28)19-14-22-6-7-23-19/h4-7,12-14H,3,8-11H2,1-2H3,(H,24,28)	OKBFUFJXNIYMDI-UHFFFAOYSA-N	376.201159448							114747
CHEMBL1304613	LSM-26210	SID24817335, BRD-K55286161	686075	InChI=1S/C13H12N4S/c1-8-7-9(2)15-12(14-8)17-13-16-10-5-3-4-6-11(10)18-13/h3-7H,1-2H3,(H,14,15,16,17)	PLHCEZLRRVUOQJ-UHFFFAOYSA-N	Cc1cc(C)nc(Nc2nc3ccccc3s2)n1	BroadT	BRD-K55286161	BRD-K55286161-001-05-8	Asinex Ltd.	BAS 01306652			Cc1cc(C)nc(Nc2nc3ccccc3s2)n1	InChI=1S/C13H12N4S/c1-8-7-9(2)15-12(14-8)17-13-16-10-5-3-4-6-11(10)18-13/h3-7H,1-2H3,(H,14,15,16,17)	PLHCEZLRRVUOQJ-UHFFFAOYSA-N	256.078267114							114748
T0512-7569	LSM-26211	SID22406023, BRD-K01804914	2370104	InChI=1S/C11H11N5OS/c1-8-2-4-9(5-3-8)10(17)14-11(18)15-16-6-12-13-7-16/h2-7H,1H3,(H2,14,15,17,18)	QIANOMNQLLDDLA-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)NC(=S)Nn2cnnc2	BroadT	BRD-K01804914	BRD-K01804914-001-05-3	Enamine Ltd.	T0512-7569			Cc1ccc(cc1)C(=O)NC(=S)Nn1cnnc1	InChI=1S/C11H11N5OS/c1-8-2-4-9(5-3-8)10(17)14-11(18)15-16-6-12-13-7-16/h2-7H,1H3,(H2,14,15,17,18)	QIANOMNQLLDDLA-UHFFFAOYSA-N	261.068430712							114749
F0174-0236	LSM-26212	SID24780778, BRD-K28006365	708275	InChI=1S/C16H16N2O2S/c1-16(2)8-11-13(12(19)9-16)21-15(17-11)18-14(20)10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,17,18,20)	HRYGWQGTSUEQIC-UHFFFAOYSA-N	CC1(C)CC(=O)c2sc(NC(=O)c3ccccc3)nc2C1	BroadT	BRD-K28006365	BRD-K28006365-001-03-3	ChemBridge Corporation	5962067			CC1(C)Cc2nc(NC(=O)c3ccccc3)sc2C(=O)C1	InChI=1S/C16H16N2O2S/c1-16(2)8-11-13(12(19)9-16)21-15(17-11)18-14(20)10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,17,18,20)	HRYGWQGTSUEQIC-UHFFFAOYSA-N	300.093248462							114750
AC1N3INH	LSM-26213	BRD-K53662664	4113077	InChI=1S/C16H15ClF3N3OS/c17-13-3-1-11(16(18,19)20)9-14(13)22-21-10-12-2-4-15(25-12)23-5-7-24-8-6-23/h1-4,9-10,22H,5-8H2	GPRVDBNZTWBIJR-UHFFFAOYSA-N	FC(F)(F)c1ccc(Cl)c(NN=Cc2ccc(s2)N3CCOCC3)c1	BroadT	BRD-K53662664	BRD-K53662664-001-05-4	Enamine Ltd.	T0506-8992			FC(F)(F)c1ccc(Cl)c(NN=Cc2ccc(s2)N2CCOCC2)c1	InChI=1S/C16H15ClF3N3OS/c17-13-3-1-11(16(18,19)20)9-14(13)22-21-10-12-2-4-15(25-12)23-5-7-24-8-6-23/h1-4,9-10,22H,5-8H2	GPRVDBNZTWBIJR-UHFFFAOYSA-N	389.05764513							114751
N-(3-Methylphenyl)-n'-(2-pyridyl)thiourea	LSM-26214	SID26727706, BRD-K79207495	2730970	InChI=1S/C13H13N3S/c1-10-5-4-6-11(9-10)15-13(17)16-12-7-2-3-8-14-12/h2-9H,1H3,(H2,14,15,16,17)	PQYWQBHBAVCIGA-UHFFFAOYSA-N	Cc1cccc(NC(=Nc2ccccn2)S)c1	BroadT	BRD-K79207495	BRD-K79207495-001-05-3	Maybridge	S 00360			Cc1cccc(NC(S)=Nc2ccccn2)c1	InChI=1S/C13H13N3S/c1-10-5-4-6-11(9-10)15-13(17)16-12-7-2-3-8-14-12/h2-9H,1H3,(H2,14,15,16,17)	PQYWQBHBAVCIGA-UHFFFAOYSA-N	243.083018136							114752
MLS000097339	LSM-26215	SID4257362, BRD-A35442115	2952136	InChI=1S/C14H16BrClN2O2/c1-8(2)18-7-9(5-13(18)19)14(20)17-10-3-4-11(15)12(16)6-10/h3-4,6,8-9H,5,7H2,1-2H3,(H,17,20)	AEILPZOZSYMSEF-UHFFFAOYSA-N	CC(C)N1CC(CC1=O)C(=O)Nc2ccc(Br)c(Cl)c2	BroadT	BRD-A35442115	BRD-A35442115-001-06-9	ChemBridge Corporation	7753136			CC(C)N1CC(CC1=O)C(=O)Nc1ccc(Br)c(Cl)c1	InChI=1S/C14H16BrClN2O2/c1-8(2)18-7-9(5-13(18)19)14(20)17-10-3-4-11(15)12(16)6-10/h3-4,6,8-9H,5,7H2,1-2H3,(H,17,20)	AEILPZOZSYMSEF-UHFFFAOYSA-N	358.008368082							114753
AC1M59XU	LSM-44164	SID14738582, BRD-K75200342	2298970	InChI=1S/C19H18N4O4S/c1-13-14(2)22-27-19(13)23-28(25,26)17-5-3-16(4-6-17)21-12-9-18(24)15-7-10-20-11-8-15/h3-12,21,23H,1-2H3/b12-9+	KGCFJXZHRBCKRK-FMIVXFBMSA-N	Cc1noc(NS(=O)(=O)c2ccc(N\C=C\C(=O)c3ccncc3)cc2)c1C	BroadT	BRD-K75200342	BRD-K75200342-001-05-7	ChemDiv Inc.	3976-0069			Cc1noc(NS(=O)(=O)c2ccc(N\C=C\C(=O)c3ccncc3)cc2)c1C	InChI=1S/C19H18N4O4S/c1-13-14(2)22-27-19(13)23-28(25,26)17-5-3-16(4-6-17)21-12-9-18(24)15-7-10-20-11-8-15/h3-12,21,23H,1-2H3/b12-9+	KGCFJXZHRBCKRK-FMIVXFBMSA-N	398.104875786							
AC1M4V53	LSM-26217	BRD-K49532631	2289838	InChI=1S/C18H18N4O3/c1-23-18-11-15(12-21-22-13-19-20-14-22)7-8-17(18)25-10-9-24-16-5-3-2-4-6-16/h2-8,11-14H,9-10H2,1H3	WDILFMOJYFMFBR-UHFFFAOYSA-N	COc1cc(C=Nn2cnnc2)ccc1OCCOc3ccccc3	BroadT	BRD-K49532631	BRD-K49532631-001-05-6	ChemBridge Corporation	5822254			COc1cc(C=Nn2cnnc2)ccc1OCCOc1ccccc1	InChI=1S/C18H18N4O3/c1-23-18-11-15(12-21-22-13-19-20-14-22)7-8-17(18)25-10-9-24-16-5-3-2-4-6-16/h2-8,11-14H,9-10H2,1H3	WDILFMOJYFMFBR-UHFFFAOYSA-N	338.137890476							114755
T6578878	LSM-26218	SID14718937, BRD-K04006746	852870	InChI=1S/C13H10BrNO4/c14-8-6-11-12(19-5-4-18-11)7-9(8)15-13(16)10-2-1-3-17-10/h1-3,6-7H,4-5H2,(H,15,16)	AEIKRJVOTGGRQH-UHFFFAOYSA-N	Brc1cc2OCCOc2cc1NC(=O)c3occc3	BroadT	BRD-K04006746	BRD-K04006746-001-05-6	Specs	AR-378/42397709			Brc1cc2OCCOc2cc1NC(=O)c1ccco1	InChI=1S/C13H10BrNO4/c14-8-6-11-12(19-5-4-18-11)7-9(8)15-13(16)10-2-1-3-17-10/h1-3,6-7H,4-5H2,(H,15,16)	AEIKRJVOTGGRQH-UHFFFAOYSA-N	322.97932041							114756
AK-968/41018365	LSM-26219	SID14731213, BRD-K70760275	1316580	InChI=1S/C16H18BrN3O3/c1-4-20-14(13(17)9-18-20)15(21)19-12-7-5-11(6-8-12)16(22)23-10(2)3/h5-10H,4H2,1-3H3,(H,19,21)	PQCYGOOWNHMIIA-UHFFFAOYSA-N	CCn1ncc(Br)c1C(=O)Nc2ccc(cc2)C(=O)OC(C)C	BroadT	BRD-K70760275	BRD-K70760275-001-05-6	ChemBridge Corporation	7561699			CCn1ncc(Br)c1C(=O)Nc1ccc(cc1)C(=O)OC(C)C	InChI=1S/C16H18BrN3O3/c1-4-20-14(13(17)9-18-20)15(21)19-12-7-5-11(6-8-12)16(22)23-10(2)3/h5-10H,4H2,1-3H3,(H,19,21)	PQCYGOOWNHMIIA-UHFFFAOYSA-N	379.053154066							114757
SBB046013	LSM-26220	SID14738731, BRD-K93059446	803513	InChI=1S/C15H12ClN3S/c16-12-6-8-13(9-7-12)19-10-17-14(18-15(19)20)11-4-2-1-3-5-11/h1-9H,10H2,(H,17,18,20)	WDLGORJQXRPGSB-UHFFFAOYSA-N	SC1=NC(=NCN1c2ccc(Cl)cc2)c3ccccc3	BroadT	BRD-K93059446	BRD-K93059446-001-05-0	ChemBridge Corporation	7012617			SC1=NC(=NCN1c1ccc(Cl)cc1)c1ccccc1	InChI=1S/C15H12ClN3S/c16-12-6-8-13(9-7-12)19-10-17-14(18-15(19)20)11-4-2-1-3-5-11/h1-9H,10H2,(H,17,18,20)	WDLGORJQXRPGSB-UHFFFAOYSA-N	301.044045814							114758
SMR000008039	LSM-26221	SID846879, BRD-A43658783	649274	InChI=1S/C19H20N2O3S/c1-13(18(22)20-10-8-14-6-4-3-5-7-14)24-19(23)16-12-17-15(21(16)2)9-11-25-17/h3-7,9,11-13H,8,10H2,1-2H3,(H,20,22)	WNQHXXVAJMZPFF-UHFFFAOYSA-N	CC(OC(=O)c1cc2sccc2n1C)C(=O)NCCc3ccccc3	BroadT	BRD-A43658783	BRD-A43658783-001-05-3	Asinex Ltd.	ASN 07460856			CC(OC(=O)c1cc2sccc2n1C)C(=O)NCCc1ccccc1	InChI=1S/C19H20N2O3S/c1-13(18(22)20-10-8-14-6-4-3-5-7-14)24-19(23)16-12-17-15(21(16)2)9-11-25-17/h3-7,9,11-13H,8,10H2,1-2H3,(H,20,22)	WNQHXXVAJMZPFF-UHFFFAOYSA-N	356.11946321							114759
SMR000026583	LSM-26222	SID4241449, BRD-K26748504	3236422	InChI=1S/C14H13N3O/c1-18-13-7-3-2-5-11(13)9-17-10-16-12-6-4-8-15-14(12)17/h2-8,10H,9H2,1H3	QWDUXZVXSWTBGA-UHFFFAOYSA-N	COc1ccccc1Cn2cnc3cccnc23	BroadT	BRD-K26748504	BRD-K26748504-001-05-9	ChemDiv Inc.	C430-0438			COc1ccccc1Cn1cnc2cccnc12	InChI=1S/C14H13N3O/c1-18-13-7-3-2-5-11(13)9-17-10-16-12-6-4-8-15-14(12)17/h2-8,10H,9H2,1H3	QWDUXZVXSWTBGA-UHFFFAOYSA-N	239.105862066							114760
AC1MXPHJ	LSM-26223	BRD-K51358889	3819296	InChI=1S/C15H13N3S2/c1-11-14(12-6-3-2-4-7-12)17-15(20-11)18-16-10-13-8-5-9-19-13/h2-10H,1H3,(H,17,18)	AWDSAJYBMPMVJZ-UHFFFAOYSA-N	Cc1sc(NN=Cc2cccs2)nc1c3ccccc3	BroadT	BRD-K51358889	BRD-K51358889-001-05-0	InterBioScreen Ltd.	STOCK1S-96058			Cc1sc(NN=Cc2cccs2)nc1-c1ccccc1	InChI=1S/C15H13N3S2/c1-11-14(12-6-3-2-4-7-12)17-15(20-11)18-16-10-13-8-5-9-19-13/h2-10H,1H3,(H,17,18)	AWDSAJYBMPMVJZ-UHFFFAOYSA-N	299.055088826							114761
AC1LITD3	LSM-26224	SID26663245, BRD-K35396724	937801	InChI=1S/C15H20N4S/c16-19-14(13-9-5-2-6-10-13)17-18-15(19)20-11-12-7-3-1-4-8-12/h1,3-4,7-8,13H,2,5-6,9-11,16H2	LCBOTHXQLDLJKO-UHFFFAOYSA-N	Nn1c(SCc2ccccc2)nnc1C3CCCCC3	BroadT	BRD-K35396724	BRD-K35396724-001-06-8	InterBioScreen Ltd.	STOCK4S-26197			Nn1c(SCc2ccccc2)nnc1C1CCCCC1	InChI=1S/C15H20N4S/c16-19-14(13-9-5-2-6-10-13)17-18-15(19)20-11-12-7-3-1-4-8-12/h1,3-4,7-8,13H,2,5-6,9-11,16H2	LCBOTHXQLDLJKO-UHFFFAOYSA-N	288.14086737							114762
STK023052	LSM-15562	BRD-K57808487	1080757	InChI=1S/C24H32N2O2/c1-19(2)16-25-24(27)22-12-14-26(15-13-22)17-20-8-10-23(11-9-20)28-18-21-6-4-3-5-7-21/h3-11,19,22H,12-18H2,1-2H3,(H,25,27)	DGJHKYICICNUHL-UHFFFAOYSA-N	CC(C)CNC(=O)C1CCN(Cc2ccc(OCc3ccccc3)cc2)CC1	BroadT	BRD-K57808487	BRD-K57808487-034-06-3	ChemBridge Corporation	6578429		OC(=O)C(=O)O	CC(C)CNC(=O)C1CCN(Cc2ccc(OCc3ccccc3)cc2)CC1.OC(=O)C(=O)O	InChI=1S/C24H32N2O2.C2H2O4/c1-19(2)16-25-24(27)22-12-14-26(15-13-22)17-20-8-10-23(11-9-20)28-18-21-6-4-3-5-7-21;3-1(4)2(5)6/h3-11,19,22H,12-18H2,1-2H3,(H,25,27);(H,3,4)(H,5,6)	QJCOHAOARSBYBK-UHFFFAOYSA-N	380.246378284							104198, 104198
AC1LGDVN	LSM-26225	BRD-K81742580	793122	InChI=1S/C12H18N4O/c1-3-16(4-2)11-7-5-10(6-8-11)9-14-15-12(13)17/h5-9H,3-4H2,1-2H3,(H3,13,15,17)	XPPDVSPFQAFILG-UHFFFAOYSA-N	CCN(CC)c1ccc(C=NNC(=O)N)cc1	BroadT	BRD-K81742580	BRD-K81742580-001-06-9	ChemBridge Corporation	5108419			CCN(CC)c1ccc(C=NNC(N)=O)cc1	InChI=1S/C12H18N4O/c1-3-16(4-2)11-7-5-10(6-8-11)9-14-15-12(13)17/h5-9H,3-4H2,1-2H3,(H3,13,15,17)	XPPDVSPFQAFILG-UHFFFAOYSA-N	234.148061236							114763
AC1LJEDK	LSM-26226	BRD-K91540193	921807	InChI=1S/C14H14N2O2S/c17-14(16-15-8-10-4-3-7-18-10)12-9-19-13-6-2-1-5-11(12)13/h3-4,7-9H,1-2,5-6H2,(H,16,17)	STQWEQZSVMWPAL-UHFFFAOYSA-N	O=C(NN=Cc1occc1)c2csc3CCCCc23	BroadT	BRD-K91540193	BRD-K91540193-001-05-6	InterBioScreen Ltd.	STOCK2S-46842			O=C(NN=Cc1ccco1)c1csc2CCCCc12	InChI=1S/C14H14N2O2S/c17-14(16-15-8-10-4-3-7-18-10)12-9-19-13-6-2-1-5-11(12)13/h3-4,7-9H,1-2,5-6H2,(H,16,17)	STQWEQZSVMWPAL-UHFFFAOYSA-N	274.077598398							114764
N-[4-(2,5-Dimethyl-pyrrol-1-yl)-phenyl]-benzamide	LSM-26227	SID17507130, BRD-K38686857	765813	InChI=1S/C19H18N2O/c1-14-8-9-15(2)21(14)18-12-10-17(11-13-18)20-19(22)16-6-4-3-5-7-16/h3-13H,1-2H3,(H,20,22)	LAXJSLCWBAMXMV-UHFFFAOYSA-N	Cc1ccc(C)n1c2ccc(NC(=O)c3ccccc3)cc2	BroadT	BRD-K38686857	BRD-K38686857-001-05-0	Asinex Ltd.	BAS 00260717			Cc1ccc(C)n1-c1ccc(NC(=O)c2ccccc2)cc1	InChI=1S/C19H18N2O/c1-14-8-9-15(2)21(14)18-12-10-17(11-13-18)20-19(22)16-6-4-3-5-7-16/h3-13H,1-2H3,(H,20,22)	LAXJSLCWBAMXMV-UHFFFAOYSA-N	290.141913216							114765
MLS000830800	LSM-26228	SID26726725, BRD-K34748852	2810963	InChI=1S/C19H23N3O3S/c1-4-25-18(23)16-14-9-10-22(3)11-15(14)26-17(16)21-19(24)20-13-7-5-12(2)6-8-13/h5-8H,4,9-11H2,1-3H3,(H2,20,21,24)	VUYKSZUDMFHYMP-UHFFFAOYSA-N	CCOC(=O)c1c2CCN(C)Cc2sc1NC(=O)Nc3ccc(C)cc3	BroadT	BRD-K34748852	BRD-K34748852-001-05-7	Maybridge	HTS 02981			CCOC(=O)c1c(NC(=O)Nc2ccc(C)cc2)sc2CN(C)CCc12	InChI=1S/C19H23N3O3S/c1-4-25-18(23)16-14-9-10-22(3)11-15(14)26-17(16)21-19(24)20-13-7-5-12(2)6-8-13/h5-8H,4,9-11H2,1-3H3,(H2,20,21,24)	VUYKSZUDMFHYMP-UHFFFAOYSA-N	373.146012316							114766
ST50851609	LSM-26229	SID24785175, BRD-K56979584	970474	InChI=1S/C18H20N2O4/c1-3-24-17(21)13-8-10-15(11-9-13)20-18(22)19-12-14-6-4-5-7-16(14)23-2/h4-11H,3,12H2,1-2H3,(H2,19,20,22)	SGXAREKZFCEBHU-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)NCc2ccccc2OC)cc1	BroadT	BRD-K56979584	BRD-K56979584-001-05-6	ChemBridge Corporation	7799984			CCOC(=O)c1ccc(NC(=O)NCc2ccccc2OC)cc1	InChI=1S/C18H20N2O4/c1-3-24-17(21)13-8-10-15(11-9-13)20-18(22)19-12-14-6-4-5-7-16(14)23-2/h4-11H,3,12H2,1-2H3,(H2,19,20,22)	SGXAREKZFCEBHU-UHFFFAOYSA-N	328.14230714							114767
F1862-0246	LSM-26230	SID49678036, BRD-K42951459	1383581	InChI=1S/C20H18O6/c1-12(21)11-25-15-6-4-14-8-16(20(22)26-18(14)10-15)13-5-7-17(23-2)19(9-13)24-3/h4-10H,11H2,1-3H3	GPGIPQZPUTVIGJ-UHFFFAOYSA-N	COc1ccc(cc1OC)C2=Cc3ccc(OCC(=O)C)cc3OC2=O	BroadT	BRD-K42951459	BRD-K42951459-001-05-4	Life Chemicals Inc.	F1862-0246			COc1ccc(cc1OC)-c1cc2ccc(OCC(C)=O)cc2oc1=O	InChI=1S/C20H18O6/c1-12(21)11-25-15-6-4-14-8-16(20(22)26-18(14)10-15)13-5-7-17(23-2)19(9-13)24-3/h4-10H,11H2,1-3H3	GPGIPQZPUTVIGJ-UHFFFAOYSA-N	354.110338296							114768
AC1NG4NZ	LSM-26231	BRD-K84635282	4669198	InChI=1S/C18H13N3O5/c1-11(15-10-13-4-2-3-5-16(13)26-18(15)23)19-20-17(22)12-6-8-14(9-7-12)21(24)25/h2-10H,1H3,(H,20,22)	KRNSWEKBTTUMQG-UHFFFAOYSA-N	CC(=NNC(=O)c1ccc(cc1)[N+](=O)[O-])C2=Cc3ccccc3OC2=O	BroadT	BRD-K84635282	BRD-K84635282-001-05-5	InterBioScreen Ltd.	STOCK1S-11553			CC(=NNC(=O)c1ccc(cc1)[N+]([O-])=O)c1cc2ccccc2oc1=O	InChI=1S/C18H13N3O5/c1-11(15-10-13-4-2-3-5-16(13)26-18(15)23)19-20-17(22)12-6-8-14(9-7-12)21(24)25/h2-10H,1H3,(H,20,22)	KRNSWEKBTTUMQG-UHFFFAOYSA-N	351.085520546							114769
MLS000101259	LSM-44165	SID7970634, BRD-K45599961	2155075	InChI=1S/C17H22N6/c1-3-23(14-7-4-6-13(2)10-14)9-5-8-18-16-15-17(20-11-19-15)22-12-21-16/h4,6-7,10-12H,3,5,8-9H2,1-2H3,(H2,18,19,20,21,22)	JVTCKOKKQHNTRM-UHFFFAOYSA-N	CCN(CCCNc1[nH]cnc2ncnc12)c3cccc(C)c3	BroadT	BRD-K45599961	BRD-K45599961-001-04-2	Life Chemicals Inc.	F0578-0219			CCN(CCCNc1[nH]cnc2ncnc12)c1cccc(C)c1	InChI=1S/C17H22N6/c1-3-23(14-7-4-6-13(2)10-14)9-5-8-18-16-15-17(20-11-19-15)22-12-21-16/h4,6-7,10-12H,3,5,8-9H2,1-2H3,(H2,18,19,20,21,22)	JVTCKOKKQHNTRM-UHFFFAOYSA-N	310.190594764							
AC1LDESJ	LSM-26233	SID844617, BRD-A28409908	646950	InChI=1S/C13H14N4O2S/c1-17(12(18)9-5-7-19-8-9)13-16-15-11(20-13)10-4-2-3-6-14-10/h2-4,6,9H,5,7-8H2,1H3	NQUVOUKOXGTLEL-UHFFFAOYSA-N	CN(C(=O)C1CCOC1)c2nnc(s2)c3ccccn3	BroadT	BRD-A28409908	BRD-A28409908-001-05-0	Asinex Ltd.	ASN 09114440			CN(C(=O)C1CCOC1)c1nnc(s1)-c1ccccn1	InChI=1S/C13H14N4O2S/c1-17(12(18)9-5-7-19-8-9)13-16-15-11(20-13)10-4-2-3-6-14-10/h2-4,6,9H,5,7-8H2,1H3	NQUVOUKOXGTLEL-UHFFFAOYSA-N	290.083746418							114771
AG-690/11629021	LSM-26234	SID843214, BRD-K82612152	645498	InChI=1S/C10H7Cl2N3O2/c11-7-1-2-8(9(12)3-7)10(16)17-6-15-5-13-4-14-15/h1-5H,6H2	BNXNZYLIALZAMV-UHFFFAOYSA-N	Clc1ccc(C(=O)OCn2cncn2)c(Cl)c1	BroadT	BRD-K82612152	BRD-K82612152-001-05-3	Asinex Ltd.	BAS 00017890			Clc1ccc(C(=O)OCn2cncn2)c(Cl)c1	InChI=1S/C10H7Cl2N3O2/c11-7-1-2-8(9(12)3-7)10(16)17-6-15-5-13-4-14-15/h1-5H,6H2	BNXNZYLIALZAMV-UHFFFAOYSA-N	270.991531914							114772
SMR000116383	LSM-26235	SID14724543, BRD-K50450241	3186847	InChI=1S/C20H18N2O4S/c1-12-7-13(2)9-15(8-12)19-21-22-20(26-19)27-11-16(23)14-3-4-17-18(10-14)25-6-5-24-17/h3-4,7-10H,5-6,11H2,1-2H3	WRSUQPGAAXHXCS-UHFFFAOYSA-N	Cc1cc(C)cc(c1)c2oc(SCC(=O)c3ccc4OCCOc4c3)nn2	BroadT	BRD-K50450241	BRD-K50450241-001-05-9	Asinex Ltd.	ASN 04392604			Cc1cc(C)cc(c1)-c1nnc(SCC(=O)c2ccc3OCCOc3c2)o1	InChI=1S/C20H18N2O4S/c1-12-7-13(2)9-15(8-12)19-21-22-20(26-19)27-11-16(23)14-3-4-17-18(10-14)25-6-5-24-17/h3-4,7-10H,5-6,11H2,1-2H3	WRSUQPGAAXHXCS-UHFFFAOYSA-N	382.098727766							114773
Diethanolamine	LSM-26236	Diethanolamine	8113	InChI=1S/C4H11NO2/c6-3-1-5-2-4-7/h5-7H,1-4H2	ZBCBWPMODOFKDW-UHFFFAOYSA-N	OCCNCCO	BroadT	BRD-K19401842	BRD-K19401842-001-04-8	Battelle Memorial Institute	Diethanolamine;111-42-2 719			OCCNCCO	InChI=1S/C4H11NO2/c6-3-1-5-2-4-7/h5-7H,1-4H2	ZBCBWPMODOFKDW-UHFFFAOYSA-N	105.078978602							28123
SMR000008128	LSM-26237	SID847519, BRD-K44084227	649924	InChI=1S/C23H30N2O4/c26-21(24-22-11-15-7-16(12-22)9-17(8-15)13-22)25-5-3-23(27,4-6-25)18-1-2-19-20(10-18)29-14-28-19/h1-2,10,15-17,27H,3-9,11-14H2,(H,24,26)	GDRFYXHETWABFZ-UHFFFAOYSA-N	OC1(CCN(CC1)C(=O)NC23CC4CC(CC(C4)C2)C3)c5ccc6OCOc6c5	BroadT	BRD-K44084227	BRD-K44084227-001-05-3	Asinex Ltd.	ASN 07832897			OC1(CCN(CC1)C(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc2OCOc2c1	InChI=1S/C23H30N2O4/c26-21(24-22-11-15-7-16(12-22)9-17(8-15)13-22)25-5-3-23(27,4-6-25)18-1-2-19-20(10-18)29-14-28-19/h1-2,10,15-17,27H,3-9,11-14H2,(H,24,26)	GDRFYXHETWABFZ-UHFFFAOYSA-N	398.22055746							114774
F0642-0953	LSM-26238	SID24824306, BRD-K11710893	7105576	InChI=1S/C15H12FN3O2S/c16-11-7-4-8-12-14(11)17-15(22-12)19-18-13(20)9-21-10-5-2-1-3-6-10/h1-8H,9H2,(H,17,19)(H,18,20)	AHJFWPADOKSKIE-UHFFFAOYSA-N	Fc1cccc2sc(NNC(=O)COc3ccccc3)nc12	BroadT	BRD-K11710893	BRD-K11710893-001-05-5	Life Chemicals Inc.	F0642-0953			Fc1cccc2sc(NNC(=O)COc3ccccc3)nc12	InChI=1S/C15H12FN3O2S/c16-11-7-4-8-12-14(11)17-15(22-12)19-18-13(20)9-21-10-5-2-1-3-6-10/h1-8H,9H2,(H,17,19)(H,18,20)	AHJFWPADOKSKIE-UHFFFAOYSA-N	317.063425544							114775
CID 25845734	LSM-26239	BRD-A73547039	25845734	InChI=1S/C17H16N2O5/c1-9-12-6-11(22-3)4-5-15(12)24-16(9)17(21)23-8-14(20)13(7-18)10(2)19/h4-6,13,19H,8H2,1-3H3	XFCJGXQPMBMOEL-UHFFFAOYSA-N	COc1ccc2oc(C(=O)OCC(=O)C(C#N)C(=N)C)c(C)c2c1	BroadT	BRD-A73547039	BRD-A73547039-001-05-3	Enamine Ltd.	T5213471			COc1ccc2oc(C(=O)OCC(=O)C(C#N)C(C)=N)c(C)c2c1	InChI=1S/C17H16N2O5/c1-9-12-6-11(22-3)4-5-15(12)24-16(9)17(21)23-8-14(20)13(7-18)10(2)19/h4-6,13,19H,8H2,1-3H3	XFCJGXQPMBMOEL-UHFFFAOYSA-N	328.105921632							114776
MLS000050866	LSM-26240	SID4259896, BRD-K86471821	2963439	InChI=1S/C23H20N4O3S2/c1-3-27-22(20-9-6-10-31-20)25-26-23(27)32-13-21(28)24-16-12-18-15(11-19(16)29-2)14-7-4-5-8-17(14)30-18/h4-12H,3,13H2,1-2H3,(H,24,28)	GHGULWMGPZJWNQ-UHFFFAOYSA-N	CCn1c(SCC(=O)Nc2cc3oc4ccccc4c3cc2OC)nnc1c5cccs5	BroadT	BRD-K86471821	BRD-K86471821-001-06-9	ChemBridge Corporation	7909775			CCn1c(SCC(=O)Nc2cc3oc4ccccc4c3cc2OC)nnc1-c1cccs1	InChI=1S/C23H20N4O3S2/c1-3-27-22(20-9-6-10-31-20)25-26-23(27)32-13-21(28)24-16-12-18-15(11-19(16)29-2)14-7-4-5-8-17(14)30-18/h4-12H,3,13H2,1-2H3,(H,24,28)	GHGULWMGPZJWNQ-UHFFFAOYSA-N	464.09768192							114777
MLS000533256	LSM-26241	SID14739541, BRD-K06708756	869554	InChI=1S/C21H25NO2/c1-6-22(7-2)21(24)18-10-8-17(9-11-18)20(23)19-15(4)12-14(3)13-16(19)5/h8-13H,6-7H2,1-5H3	IJUDGERWGNGOPM-UHFFFAOYSA-N	CCN(CC)C(=O)c1ccc(cc1)C(=O)c2c(C)cc(C)cc2C	BroadT	BRD-K06708756	BRD-K06708756-001-05-2	ChemBridge Corporation	5743204			CCN(CC)C(=O)c1ccc(cc1)C(=O)c1c(C)cc(C)cc1C	InChI=1S/C21H25NO2/c1-6-22(7-2)21(24)18-10-8-17(9-11-18)20(23)19-15(4)12-14(3)13-16(19)5/h8-13H,6-7H2,1-5H3	IJUDGERWGNGOPM-UHFFFAOYSA-N	323.18852905							114778
MLS000094769	LSM-26242	SID4246977, BRD-K63141600	3241250	InChI=1S/C20H23N5O4/c1-27-15-7-5-4-6-14(15)25-19(21)18(23-24-25)20(26)22-11-10-13-8-9-16(28-2)17(12-13)29-3/h4-9,12H,10-11,21H2,1-3H3,(H,22,26)	YDISKDVNKWZTKB-UHFFFAOYSA-N	COc1ccc(CCNC(=O)c2nnn(c2N)c3ccccc3OC)cc1OC	BroadT	BRD-K63141600	BRD-K63141600-001-06-2	ChemDiv Inc.	K236-0110			COc1ccc(CCNC(=O)c2nnn(c2N)-c2ccccc2OC)cc1OC	InChI=1S/C20H23N5O4/c1-27-15-7-5-4-6-14(15)25-19(21)18(23-24-25)20(26)22-11-10-13-8-9-16(28-2)17(12-13)29-3/h4-9,12H,10-11,21H2,1-3H3,(H,22,26)	YDISKDVNKWZTKB-UHFFFAOYSA-N	397.175004266							114779
AK-968/41924484	LSM-26243	SID22413160, BRD-K95534312	843863	InChI=1S/C17H13N3S2/c1-11-6-2-4-8-14(11)20-16(18-19-17(20)21)13-10-22-15-9-5-3-7-12(13)15/h2-10H,1H3,(H,19,21)	ODNUJYATAXLXSW-UHFFFAOYSA-N	Cc1ccccc1n2c(S)nnc2c3csc4ccccc34	BroadT	BRD-K95534312	BRD-K95534312-001-05-1	Specs	AK-968/41924484			Cc1ccccc1-n1c(S)nnc1-c1csc2ccccc12	InChI=1S/C17H13N3S2/c1-11-6-2-4-8-14(11)20-16(18-19-17(20)21)13-10-22-15-9-5-3-7-12(13)15/h2-10H,1H3,(H,19,21)	ODNUJYATAXLXSW-UHFFFAOYSA-N	323.055088826							114780
MLS000548269	LSM-26244	SID17507356, BRD-K98879597	2938624	InChI=1S/C21H29N3O4S2/c1-16-6-9-19(10-7-16)29(25,26)23(5)21-17(2)8-11-20(18(21)3)30(27,28)24-14-12-22(4)13-15-24/h6-11H,12-15H2,1-5H3	PUSKNGNFKHCXSN-UHFFFAOYSA-N	CN(c1c(C)ccc(c1C)S(=O)(=O)N2CCN(C)CC2)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K98879597	BRD-K98879597-001-06-1	Asinex Ltd.	BAS 05209519			CN(c1c(C)ccc(c1C)S(=O)(=O)N1CCN(C)CC1)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C21H29N3O4S2/c1-16-6-9-19(10-7-16)29(25,26)23(5)21-17(2)8-11-20(18(21)3)30(27,28)24-14-12-22(4)13-15-24/h6-11H,12-15H2,1-5H3	PUSKNGNFKHCXSN-UHFFFAOYSA-N	451.159947818							114781
T5302669	LSM-26245	SID24784350, BRD-K24138834	1168293	InChI=1S/C15H18N2O5S2/c18-23(19,16-12-13-4-3-11-22-13)14-5-7-15(8-6-14)24(20,21)17-9-1-2-10-17/h3-8,11,16H,1-2,9-10,12H2	OSQYMKOYUIIFFA-UHFFFAOYSA-N	O=S(=O)(NCc1occc1)c2ccc(cc2)S(=O)(=O)N3CCCC3	BroadT	BRD-K24138834	BRD-K24138834-001-05-6	Asinex Ltd.	BAS 04363877			O=S(=O)(NCc1ccco1)c1ccc(cc1)S(=O)(=O)N1CCCC1	InChI=1S/C15H18N2O5S2/c18-23(19,16-12-13-4-3-11-22-13)14-5-7-15(8-6-14)24(20,21)17-9-1-2-10-17/h3-8,11,16H,1-2,9-10,12H2	OSQYMKOYUIIFFA-UHFFFAOYSA-N	370.065713076							114782
SMR000008297	LSM-26246	SID849492, BRD-K94452775	651986	InChI=1S/C19H20N2O5S/c1-4-26-19(23)15-10-17-14(7-8-27-17)21(15)11-18(22)20-13-6-5-12(24-2)9-16(13)25-3/h5-10H,4,11H2,1-3H3,(H,20,22)	DRIRBTLYNFBGJY-UHFFFAOYSA-N	CCOC(=O)c1cc2sccc2n1CC(=O)Nc3ccc(OC)cc3OC	BroadT	BRD-K94452775	BRD-K94452775-001-05-7	Asinex Ltd.	ASN 08223565			CCOC(=O)c1cc2sccc2n1CC(=O)Nc1ccc(OC)cc1OC	InChI=1S/C19H20N2O5S/c1-4-26-19(23)15-10-17-14(7-8-27-17)21(15)11-18(22)20-13-6-5-12(24-2)9-16(13)25-3/h5-10H,4,11H2,1-3H3,(H,20,22)	DRIRBTLYNFBGJY-UHFFFAOYSA-N	388.10929245							114783
N-{4-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl}-2-(2-methoxyphenyl)acetamide	LSM-26247	SID7972530, BRD-K83349888	1339710	InChI=1S/C21H17N3O4/c1-26-17-6-3-2-5-15(17)13-19(25)22-16-10-8-14(9-11-16)20-23-24-21(28-20)18-7-4-12-27-18/h2-12H,13H2,1H3,(H,22,25)	OHSIRHBXHGGCQC-UHFFFAOYSA-N	COc1ccccc1CC(=O)Nc2ccc(cc2)c3oc(nn3)c4occc4	BroadT	BRD-K83349888	BRD-K83349888-001-05-2	ChemBridge Corporation	6498948			COc1ccccc1CC(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccco1	InChI=1S/C21H17N3O4/c1-26-17-6-3-2-5-15(17)13-19(25)22-16-10-8-14(9-11-16)20-23-24-21(28-20)18-7-4-12-27-18/h2-12H,13H2,1H3,(H,22,25)	OHSIRHBXHGGCQC-UHFFFAOYSA-N	375.121906054							114784
AC1LFWCI	LSM-26248	BRD-K43325186	761167	InChI=1S/C18H21N3O2/c1-23-18-8-3-2-7-17(18)20-9-11-21(12-10-20)19-14-15-5-4-6-16(22)13-15/h2-8,13-14,22H,9-12H2,1H3	TUMWRGAABYOSEC-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)N=Cc3cccc(O)c3	BroadT	BRD-K43325186	BRD-K43325186-001-05-0	ChemBridge Corporation	5902573			COc1ccccc1N1CCN(CC1)N=Cc1cccc(O)c1	InChI=1S/C18H21N3O2/c1-23-18-8-3-2-7-17(18)20-9-11-21(12-10-20)19-14-15-5-4-6-16(22)13-15/h2-8,13-14,22H,9-12H2,1H3	TUMWRGAABYOSEC-UHFFFAOYSA-N	311.163376942							131273
SMR000026269	LSM-26249	SID24838819, SID4242108, BRD-K88734341	3237003	InChI=1S/C21H24N2O4S/c24-13-12-22(15-16-4-2-1-3-5-16)28(26,27)19-8-9-20-18(14-19)10-11-23(20)21(25)17-6-7-17/h1-5,8-9,14,17,24H,6-7,10-13,15H2	USKCGFQIFFACFN-UHFFFAOYSA-N	OCCN(Cc1ccccc1)S(=O)(=O)c2ccc3N(CCc3c2)C(=O)C4CC4	BroadT	BRD-K88734341	BRD-K88734341-001-05-1	ChemDiv Inc.	C361-0807			OCCN(Cc1ccccc1)S(=O)(=O)c1ccc2N(CCc2c1)C(=O)C1CC1	InChI=1S/C21H24N2O4S/c24-13-12-22(15-16-4-2-1-3-5-16)28(26,27)19-8-9-20-18(14-19)10-11-23(20)21(25)17-6-7-17/h1-5,8-9,14,17,24H,6-7,10-13,15H2	USKCGFQIFFACFN-UHFFFAOYSA-N	400.145677958							114787
SMR000204161	LSM-26250	SID17510258, BRD-K03078367	1191851	InChI=1S/C26H23NO5/c1-3-17-6-4-5-7-22(17)27-26(29)16-31-20-12-13-24-21(14-20)23(28)15-25(32-24)18-8-10-19(30-2)11-9-18/h4-15H,3,16H2,1-2H3,(H,27,29)	MUWWXLXICPSZEO-UHFFFAOYSA-N	CCc1ccccc1NC(=O)COc2ccc3OC(=CC(=O)c3c2)c4ccc(OC)cc4	BroadT	BRD-K03078367	BRD-K03078367-001-05-4	ChemDiv Inc.	5695-0520			CCc1ccccc1NC(=O)COc1ccc2oc(cc(=O)c2c1)-c1ccc(OC)cc1	InChI=1S/C26H23NO5/c1-3-17-6-4-5-7-22(17)27-26(29)16-31-20-12-13-24-21(14-20)23(28)15-25(32-24)18-8-10-19(30-2)11-9-18/h4-15H,3,16H2,1-2H3,(H,27,29)	MUWWXLXICPSZEO-UHFFFAOYSA-N	429.157622846							114788
SMR000079844	LSM-26251	SID4265373, BRD-K33413612	2224615	InChI=1S/C15H16ClN3O3S/c1-19(23(2,21)22)14-8-4-7-13(10-14)18-15(20)17-12-6-3-5-11(16)9-12/h3-10H,1-2H3,(H2,17,18,20)	UPPOPLUMQLTCIE-UHFFFAOYSA-N	CN(c1cccc(NC(=O)Nc2cccc(Cl)c2)c1)S(=O)(=O)C	BroadT	BRD-K33413612	BRD-K33413612-001-05-0	ChemBridge Corporation	7936759			CN(c1cccc(NC(=O)Nc2cccc(Cl)c2)c1)S(C)(=O)=O	InChI=1S/C15H16ClN3O3S/c1-19(23(2,21)22)14-8-4-7-13(10-14)18-15(20)17-12-6-3-5-11(16)9-12/h3-10H,1-2H3,(H2,17,18,20)	UPPOPLUMQLTCIE-UHFFFAOYSA-N	353.060089802							114789
ASN 05108127	LSM-26252	SID844395, BRD-K73426366	646721	InChI=1S/C21H21FN2O4/c1-2-28-18-7-8-19-15(12-18)11-16(20(26)23-19)13-24(9-10-25)21(27)14-3-5-17(22)6-4-14/h3-8,11-12,25H,2,9-10,13H2,1H3,(H,23,26)	OHOYVLMIQYGWPT-UHFFFAOYSA-N	CCOc1ccc2nc(O)c(CN(CCO)C(=O)c3ccc(F)cc3)cc2c1	BroadT	BRD-K73426366	BRD-K73426366-001-05-1	Asinex Ltd.	ASN 05108127			CCOc1ccc2nc(O)c(CN(CCO)C(=O)c3ccc(F)cc3)cc2c1	InChI=1S/C21H21FN2O4/c1-2-28-18-7-8-19-15(12-18)11-16(20(26)23-19)13-24(9-10-25)21(27)14-3-5-17(22)6-4-14/h3-8,11-12,25H,2,9-10,13H2,1H3,(H,23,26)	OHOYVLMIQYGWPT-UHFFFAOYSA-N	384.148535372							114790
MLS000547815	LSM-26253	SID17508227, BRD-K83749296	2910040	InChI=1S/C17H18ClN3O5S/c1-3-20(4-2)27(25,26)16-11-12(9-10-13(16)18)17(22)19-14-7-5-6-8-15(14)21(23)24/h5-11H,3-4H2,1-2H3,(H,19,22)	AJFAFMACKFUGBN-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1cc(ccc1Cl)C(=O)Nc2ccccc2[N+](=O)[O-]	BroadT	BRD-K83749296	BRD-K83749296-001-07-5	Asinex Ltd.	BAS 00680158			CCN(CC)S(=O)(=O)c1cc(ccc1Cl)C(=O)Nc1ccccc1[N+]([O-])=O	InChI=1S/C17H18ClN3O5S/c1-3-20(4-2)27(25,26)16-11-12(9-10-13(16)18)17(22)19-14-7-5-6-8-15(14)21(23)24/h5-11H,3-4H2,1-2H3,(H,19,22)	AJFAFMACKFUGBN-UHFFFAOYSA-N	411.065569106							114791
AC1N2YVX	LSM-26254	BRD-K52094785	4079216	InChI=1S/C12H14N6O3/c1-19-8-4-3-7(5-9(8)20-2)6-15-16-11(13)10-12(14)18-21-17-10/h3-6H,1-2H3,(H2,13,16)(H2,14,18)	JTOAAPLNBLPKMM-UHFFFAOYSA-N	COc1ccc(C=NN=C(N)c2nonc2N)cc1OC	BroadT	BRD-K52094785	BRD-K52094785-001-05-5	ChemDiv Inc.	6190-0430			COc1ccc(C=NN=C(N)c2nonc2N)cc1OC	InChI=1S/C12H14N6O3/c1-19-8-4-3-7(5-9(8)20-2)6-15-16-11(13)10-12(14)18-21-17-10/h3-6H,1-2H3,(H2,13,16)(H2,14,18)	JTOAAPLNBLPKMM-UHFFFAOYSA-N	290.112738368							114792
MLS000664868	LSM-26255	SID24794001, BRD-K74195971	972870	InChI=1S/C16H24ClN3OS/c1-12-5-8-20(9-6-12)10-7-18-16(22)19-13-3-4-15(21-2)14(17)11-13/h3-4,11-12H,5-10H2,1-2H3,(H2,18,19,22)	LWULRPYIMPIYQD-UHFFFAOYSA-N	COc1ccc(NC(=NCCN2CCC(C)CC2)S)cc1Cl	BroadT	BRD-K74195971	BRD-K74195971-001-05-8	ChemBridge Corporation	7869464			COc1ccc(NC(S)=NCCN2CCC(C)CC2)cc1Cl	InChI=1S/C16H24ClN3OS/c1-12-5-8-20(9-6-12)10-7-18-16(22)19-13-3-4-15(21-2)14(17)11-13/h3-4,11-12H,5-10H2,1-2H3,(H2,18,19,22)	LWULRPYIMPIYQD-UHFFFAOYSA-N	341.132860818							114793
MLS000039339	LSM-26256	SID859339, BRD-K09173891	660641	InChI=1S/C21H19N3O4S2/c1-21(2)7-11-12(8-28-21)16(13-5-4-6-27-13)24-19-15(11)17-18(30-19)20(23-10-22-17)29-9-14(25)26-3/h4-6,10H,7-9H2,1-3H3	MLNLMDQZKUYJES-UHFFFAOYSA-N	COC(=O)CSc1ncnc2c1sc3nc(c4COC(C)(C)Cc4c23)c5occc5	BroadT	BRD-K09173891	BRD-K09173891-001-02-9	InterBioScreen Ltd.	STOCK3S-12461			COC(=O)CSc1ncnc2c1sc1nc(-c3ccco3)c3COC(C)(C)Cc3c21	InChI=1S/C21H19N3O4S2/c1-21(2)7-11-12(8-28-21)16(13-5-4-6-27-13)24-19-15(11)17-18(30-19)20(23-10-22-17)29-9-14(25)26-3/h4-6,10H,7-9H2,1-3H3	MLNLMDQZKUYJES-UHFFFAOYSA-N	441.081697498							114794
STK848566	LSM-26257	SID842232, BRD-A42359060	644487	InChI=1S/C21H22N2O4/c1-14-5-2-6-15-11-16(20(24)22-19(14)15)12-23(13-17-7-3-9-26-17)21(25)18-8-4-10-27-18/h2,4-6,8,10-11,17H,3,7,9,12-13H2,1H3,(H,22,24)	YPCBDXOGNBTXEG-UHFFFAOYSA-N	Cc1cccc2cc(CN(CC3CCCO3)C(=O)c4occc4)c(O)nc12	BroadT	BRD-A42359060	BRD-A42359060-001-05-3	Asinex Ltd.	BAS 05100774			Cc1cccc2cc(CN(CC3CCCO3)C(=O)c3ccco3)c(O)nc12	InChI=1S/C21H22N2O4/c1-14-5-2-6-15-11-16(20(24)22-19(14)15)12-23(13-17-7-3-9-26-17)21(25)18-8-4-10-27-18/h2,4-6,8,10-11,17H,3,7,9,12-13H2,1H3,(H,22,24)	YPCBDXOGNBTXEG-UHFFFAOYSA-N	366.157957204							114795
MLS000676416	LSM-26258	SID24797237, BRD-K27008127	882243	InChI=1S/C14H12N2O2/c17-10-5-6-13(18)9(7-10)8-14-15-11-3-1-2-4-12(11)16-14/h1-7,17-18H,8H2,(H,15,16)	LGDLZQUSAVSGIM-UHFFFAOYSA-N	Oc1ccc(O)c(Cc2nc3ccccc3[nH]2)c1	BroadT	BRD-K27008127	BRD-K27008127-001-05-4	ChemBridge Corporation	6430631			Oc1ccc(O)c(Cc2nc3ccccc3[nH]2)c1	InChI=1S/C14H12N2O2/c17-10-5-6-13(18)9(7-10)8-14-15-11-3-1-2-4-12(11)16-14/h1-7,17-18H,8H2,(H,15,16)	LGDLZQUSAVSGIM-UHFFFAOYSA-N	240.089877644							114796
ZINC04863062	LSM-44166	SID17432912, BRD-K87573578	5346559	InChI=1S/C23H16N2O4/c26-17-5-3-4-16(13-17)25-22(24-19-7-2-1-6-18(19)23(25)27)11-9-15-8-10-20-21(12-15)29-14-28-20/h1-13,26H,14H2/b11-9+	YXZBNHDVRXRUBE-PKNBQFBNSA-N	Oc1cccc(c1)N2C(=Nc3ccccc3C2=O)\C=C\c4ccc5OCOc5c4	BroadT	BRD-K87573578	BRD-K87573578-001-05-8	ChemBridge Corporation	6032830			Oc1cccc(c1)-n1c(\C=C\c2ccc3OCOc3c2)nc2ccccc2c1=O	InChI=1S/C23H16N2O4/c26-17-5-3-4-16(13-17)25-22(24-19-7-2-1-6-18(19)23(25)27)11-9-15-8-10-20-21(12-15)29-14-28-20/h1-13,26H,14H2/b11-9+	YXZBNHDVRXRUBE-PKNBQFBNSA-N	384.111007012							
MLS000075275	LSM-26260	SID851056, BRD-A91821072	653608	InChI=1S/C16H15ClN4O/c1-2-4-13-15(16(22)21-20-13)14(11(8-18)9-19)10-5-3-6-12(17)7-10/h3,5-7,11,14H,2,4H2,1H3,(H2,20,21,22)	XZBNCNIMVWBANH-UHFFFAOYSA-N	CCCc1n[nH]c(O)c1C(C(C#N)C#N)c2cccc(Cl)c2	BroadT	BRD-A91821072	BRD-A91821072-001-06-6	Asinex Ltd.	BAS 07417687			CCCc1n[nH]c(O)c1C(C(C#N)C#N)c1cccc(Cl)c1	InChI=1S/C16H15ClN4O/c1-2-4-13-15(16(22)21-20-13)14(11(8-18)9-19)10-5-3-6-12(17)7-10/h3,5-7,11,14H,2,4H2,1H3,(H2,20,21,22)	XZBNCNIMVWBANH-UHFFFAOYSA-N	314.09343885							114798
ST50894815	LSM-26261	SID4254946, BRD-K48613747	822001	InChI=1S/C13H13NOS/c1-9-8-11(13(15)14-2)16-12(9)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,14,15)	MKDZZSRGUFKBSV-UHFFFAOYSA-N	CNC(=O)c1cc(C)c(s1)c2ccccc2	BroadT	BRD-K48613747	BRD-K48613747-001-05-6	ChemBridge Corporation	7947027			CNC(=O)c1cc(C)c(s1)-c1ccccc1	InChI=1S/C13H13NOS/c1-9-8-11(13(15)14-2)16-12(9)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,14,15)	MKDZZSRGUFKBSV-UHFFFAOYSA-N	231.071784736							114799
ST50020496	LSM-15563	BRD-K05321880	655250	InChI=1S/C15H22N2O4/c1-19-13-9-12(10-14(11-13)20-2)15(18)16-3-4-17-5-7-21-8-6-17/h9-11H,3-8H2,1-2H3,(H,16,18)	OGDRJWCPGWAPFN-UHFFFAOYSA-N	COc1cc(OC)cc(c1)C(=O)NCCN2CCOCC2	BroadT	BRD-K05321880	BRD-K05321880-034-05-5	Asinex Ltd.	BAS 04887035		OC(=O)C(=O)O	COc1cc(OC)cc(c1)C(=O)NCCN1CCOCC1.OC(=O)C(=O)O	InChI=1S/C15H22N2O4.C2H2O4/c1-19-13-9-12(10-14(11-13)20-2)15(18)16-3-4-17-5-7-21-8-6-17;3-1(4)2(5)6/h9-11H,3-8H2,1-2H3,(H,16,18);(H,3,4)(H,5,6)	HCFLUUDKPZEVDL-UHFFFAOYSA-N	294.157957204							104199, 104199
AC1LHQHS	LSM-26262	BRD-K74936979	842273	InChI=1S/C17H19N5O/c1-4-22-12(3)14(11(2)21-22)10-19-20-17(23)15-9-18-16-8-6-5-7-13(15)16/h5-10,18H,4H2,1-3H3,(H,20,23)	ZOTYKHWGDRVZAA-UHFFFAOYSA-N	CCn1nc(C)c(C=NNC(=O)c2c[nH]c3ccccc23)c1C	BroadT	BRD-K74936979	BRD-K74936979-001-06-5	Specs	AK-968/41025913			CCn1nc(C)c(C=NNC(=O)c2c[nH]c3ccccc23)c1C	InChI=1S/C17H19N5O/c1-4-22-12(3)14(11(2)21-22)10-19-20-17(23)15-9-18-16-8-6-5-7-13(15)16/h5-10,18H,4H2,1-3H3,(H,20,23)	ZOTYKHWGDRVZAA-UHFFFAOYSA-N	309.158960278							114800
STK203808	LSM-26263	SID22403510, BRD-K50842855	883858	InChI=1S/C13H18ClNO2/c1-9-7-10(5-6-11(9)14)17-8-12(16)15-13(2,3)4/h5-7H,8H2,1-4H3,(H,15,16)	WAUWJXQVSPEGKP-UHFFFAOYSA-N	Cc1cc(OCC(=O)NC(C)(C)C)ccc1Cl	BroadT	BRD-K50842855	BRD-K50842855-001-05-4	ChemBridge Corporation	6577228			Cc1cc(OCC(=O)NC(C)(C)C)ccc1Cl	InChI=1S/C13H18ClNO2/c1-9-7-10(5-6-11(9)14)17-8-12(16)15-13(2,3)4/h5-7H,8H2,1-4H3,(H,15,16)	WAUWJXQVSPEGKP-UHFFFAOYSA-N	255.102606536							114801
MLS000051319	LSM-26264	SID4259199, BRD-K79824643	1263560	InChI=1S/C21H27N5OS/c27-18(17-10-4-1-5-11-17)16-28-21-23-19(25-12-6-2-7-13-25)22-20(24-21)26-14-8-3-9-15-26/h1,4-5,10-11H,2-3,6-9,12-16H2	PUHDKEAOTZDBBZ-UHFFFAOYSA-N	O=C(CSc1nc(nc(n1)N2CCCCC2)N3CCCCC3)c4ccccc4	BroadT	BRD-K79824643	BRD-K79824643-001-07-2	ChemBridge Corporation	7928273			O=C(CSc1nc(nc(n1)N1CCCCC1)N1CCCCC1)c1ccccc1	InChI=1S/C21H27N5OS/c27-18(17-10-4-1-5-11-17)16-28-21-23-19(25-12-6-2-7-13-25)22-20(24-21)26-14-8-3-9-15-26/h1,4-5,10-11H,2-3,6-9,12-16H2	PUHDKEAOTZDBBZ-UHFFFAOYSA-N	397.193631224							114802
SMR000003960	LSM-26265	SID844525, BRD-A69594173	646852	InChI=1S/C20H31N5S/c1-19(2,3)25-18(21-22-23-25)17(16-9-7-14-26-16)24-13-8-12-20(15-24)10-5-4-6-11-20/h7,9,14,17H,4-6,8,10-13,15H2,1-3H3	ZUDUIVDMNJJWCM-UHFFFAOYSA-N	CC(C)(C)n1nnnc1C(N2CCCC3(CCCCC3)C2)c4cccs4	BroadT	BRD-A69594173	BRD-A69594173-001-06-5	Asinex Ltd.	ASN 05075060			CC(C)(C)n1nnnc1C(N1CCCC2(CCCCC2)C1)c1cccs1	InChI=1S/C20H31N5S/c1-19(2,3)25-18(21-22-23-25)17(16-9-7-14-26-16)24-13-8-12-20(15-24)10-5-4-6-11-20/h7,9,14,17H,4-6,8,10-13,15H2,1-3H3	ZUDUIVDMNJJWCM-UHFFFAOYSA-N	373.230016732							114803
5-(9H-Carbazol-9-ylmethyl)-4-methyl-4H-1,2,4-triazole-3-thiol	LSM-26266	SID26727679, BRD-K71832874	2728369	InChI=1S/C16H14N4S/c1-19-15(17-18-16(19)21)10-20-13-8-4-2-6-11(13)12-7-3-5-9-14(12)20/h2-9H,10H2,1H3,(H,18,21)	IJTCUQCTNPSRDK-UHFFFAOYSA-N	Cn1c(S)nnc1Cn2c3ccccc3c4ccccc24	BroadT	BRD-K71832874	BRD-K71832874-001-05-7	Maybridge	RH 02011			Cn1c(S)nnc1Cn1c2ccccc2c2ccccc12	InChI=1S/C16H14N4S/c1-19-15(17-18-16(19)21)10-20-13-8-4-2-6-11(13)12-7-3-5-9-14(12)20/h2-9H,10H2,1H3,(H,18,21)	IJTCUQCTNPSRDK-UHFFFAOYSA-N	294.093917178							114804
ST50889304	LSM-26267	SID4256121, BRD-K55145427	1247744	InChI=1S/C21H19N3O5S/c25-21(24-17-8-11-19-20(12-17)29-14-28-19)23-16-6-9-18(10-7-16)30(26,27)22-13-15-4-2-1-3-5-15/h1-12,22H,13-14H2,(H2,23,24,25)	XELFYNSJCCHXCC-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)S(=O)(=O)NCc2ccccc2)Nc3ccc4OCOc4c3	BroadT	BRD-K55145427	BRD-K55145427-001-05-6	ChemBridge Corporation	7949593			O=C(Nc1ccc(cc1)S(=O)(=O)NCc1ccccc1)Nc1ccc2OCOc2c1	InChI=1S/C21H19N3O5S/c25-21(24-17-8-11-19-20(12-17)29-14-28-19)23-16-6-9-18(10-7-16)30(26,27)22-13-15-4-2-1-3-5-15/h1-12,22H,13-14H2,(H2,23,24,25)	XELFYNSJCCHXCC-UHFFFAOYSA-N	425.104541428							114805
MLS000589097	LSM-26268	SID17513320, BRD-K08703598	3297379	InChI=1S/C18H25N7O2/c1-4-23-7-9-24(10-8-23)18-21-16(19)15(25(26)27)17(22-18)20-14-6-5-12(2)13(3)11-14/h5-6,11H,4,7-10H2,1-3H3,(H3,19,20,21,22)	AWMZXKYPBZZDKM-UHFFFAOYSA-N	CCN1CCN(CC1)c2nc(N)c(c(Nc3ccc(C)c(C)c3)n2)[N+](=O)[O-]	BroadT	BRD-K08703598	BRD-K08703598-001-06-1	InterBioScreen Ltd.	STOCK4S-06743			CCN1CCN(CC1)c1nc(N)c(c(Nc2ccc(C)c(C)c2)n1)[N+]([O-])=O	InChI=1S/C18H25N7O2/c1-4-23-7-9-24(10-8-23)18-21-16(19)15(25(26)27)17(22-18)20-14-6-5-12(2)13(3)11-14/h5-6,11H,4,7-10H2,1-3H3,(H3,19,20,21,22)	AWMZXKYPBZZDKM-UHFFFAOYSA-N	371.20697311							114806
3-(4-Methylphenyl)-1-[2-oxo-2-(phenylamino)ethyl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium	LSM-15388	BRD-K26371873	1399307	InChI=1S/C21H21N3O/c1-16-9-11-17(12-10-16)19-14-23(21-8-5-13-24(19)21)15-20(25)22-18-6-3-2-4-7-18/h2-4,6-7,9-12,14H,5,8,13,15H2,1H3/p+1	MKWPYROABAONGW-UHFFFAOYSA-O	Cc1ccc(cc1)c2c[n+](CC(=O)Nc3ccccc3)c4CCCn24	BroadT	BRD-K26371873	BRD-K26371873-003-05-9	InterBioScreen Ltd.	STOCK4S-55384		Cl	Cc1ccc(cc1)-c1c[n+](CC(=O)Nc2ccccc2)c2CCCn12.Cl	InChI=1S/C21H21N3O.ClH/c1-16-9-11-17(12-10-16)19-14-23(21-8-5-13-24(19)21)15-20(25)22-18-6-3-2-4-7-18;/h2-4,6-7,9-12,14H,5,8,13,15H2,1H3;1H/p+1	VPMSAIDFKXHXMA-UHFFFAOYSA-O	332.176287354							104030, 104030
BRD-A10557930	LSM-26269			InChI=1S/C21H22N2O5/c1-10-6-7-13-9-14(19(24)23-15(13)8-10)18-16(20(25)27-4)11(2)22-12(3)17(18)21(26)28-5/h6-9,16,18H,1-5H3,(H,23,24)	NWZKZFFARSOMDJ-UHFFFAOYSA-N	COC(=O)C1C(C(=C(C)N=C1C)C(=O)OC)c2cc3ccc(C)cc3nc2O	BroadT	BRD-A10557930	BRD-A10557930-001-05-8	Asinex Ltd.	ASN 02592926			COC(=O)C1C(c2cc3ccc(C)cc3nc2O)C(C(=O)OC)=C(C)N=C1C	InChI=1S/C21H22N2O5/c1-10-6-7-13-9-14(19(24)23-15(13)8-10)18-16(20(25)27-4)11(2)22-12(3)17(18)21(26)28-5/h6-9,16,18H,1-5H3,(H,23,24)	NWZKZFFARSOMDJ-UHFFFAOYSA-N	382.152871824							114807
AG-205/08932017	LSM-26270	SID17432497, BRD-K67677217	596395	InChI=1S/C15H14BrN3O3/c16-12-3-1-2-11(10-12)15(20)18-9-8-17-13-4-6-14(7-5-13)19(21)22/h1-7,10,17H,8-9H2,(H,18,20)	GVTZMKNKMGOFHE-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NCCNC(=O)c2cccc(Br)c2)cc1	BroadT	BRD-K67677217	BRD-K67677217-001-05-8	ChemBridge Corporation	5616470			[O-][N+](=O)c1ccc(NCCNC(=O)c2cccc(Br)c2)cc1	InChI=1S/C15H14BrN3O3/c16-12-3-1-2-11(10-12)15(20)18-9-8-17-13-4-6-14(7-5-13)19(21)22/h1-7,10,17H,8-9H2,(H,18,20)	GVTZMKNKMGOFHE-UHFFFAOYSA-N	363.021853938							114808
N-(2-Fluoro-5-nitrophenyl)-2,2-dimethylbutanamide	LSM-26271	SID17433530, BRD-K21056537	884024	InChI=1S/C12H15FN2O3/c1-4-12(2,3)11(16)14-10-7-8(15(17)18)5-6-9(10)13/h5-7H,4H2,1-3H3,(H,14,16)	MUTYXMBDDZHSDQ-UHFFFAOYSA-N	CCC(C)(C)C(=O)Nc1cc(ccc1F)[N+](=O)[O-]	BroadT	BRD-K21056537	BRD-K21056537-001-05-3	ChemBridge Corporation	6584883			CCC(C)(C)C(=O)Nc1cc(ccc1F)[N+]([O-])=O	InChI=1S/C12H15FN2O3/c1-4-12(2,3)11(16)14-10-7-8(15(17)18)5-6-9(10)13/h5-7H,4H2,1-3H3,(H,14,16)	MUTYXMBDDZHSDQ-UHFFFAOYSA-N	254.10667056							114809
ST50631117	LSM-26272	SID4257998, BRD-K69046399	974087	InChI=1S/C18H22N2O3/c1-3-13(4-2)18(22)20-15-8-5-7-14(11-15)17(21)19-12-16-9-6-10-23-16/h5-11,13H,3-4,12H2,1-2H3,(H,19,21)(H,20,22)	BPKBIZIKUJPWKX-UHFFFAOYSA-N	CCC(CC)C(=O)Nc1cccc(c1)C(=O)NCc2occc2	BroadT	BRD-K69046399	BRD-K69046399-001-05-4	ChemBridge Corporation	7908161			CCC(CC)C(=O)Nc1cccc(c1)C(=O)NCc1ccco1	InChI=1S/C18H22N2O3/c1-3-13(4-2)18(22)20-15-8-5-7-14(11-15)17(21)19-12-16-9-6-10-23-16/h5-11,13H,3-4,12H2,1-2H3,(H,19,21)(H,20,22)	BPKBIZIKUJPWKX-UHFFFAOYSA-N	314.163042584							114810
MLS000547108	LSM-26273	SID14728117, BRD-K82116022	990443	InChI=1S/C17H13ClN8/c1-9-14-10(2)25(13-5-3-4-12(18)6-13)24-15(14)17(23-22-9)26-16(20)11(7-19)8-21-26/h3-6,8H,20H2,1-2H3	XSRKAFTZNYRSSC-UHFFFAOYSA-N	Cc1nnc(c2nn(c(C)c12)c3cccc(Cl)c3)n4ncc(C#N)c4N	BroadT	BRD-K82116022	BRD-K82116022-001-05-3	Specs	AO-476/43201350			Cc1n(nc2c(nnc(C)c12)-n1ncc(C#N)c1N)-c1cccc(Cl)c1	InChI=1S/C17H13ClN8/c1-9-14-10(2)25(13-5-3-4-12(18)6-13)24-15(14)17(23-22-9)26-16(20)11(7-19)8-21-26/h3-6,8H,20H2,1-2H3	XSRKAFTZNYRSSC-UHFFFAOYSA-N	364.095170206							114811
ST056946	LSM-26274	SID17433163, BRD-K20937978	2284157	InChI=1S/C17H19NOS/c19-17(13-15-7-3-1-4-8-15)18-11-12-20-14-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,18,19)	GNZFKPRTACAROG-UHFFFAOYSA-N	O=C(Cc1ccccc1)NCCSCc2ccccc2	BroadT	BRD-K20937978	BRD-K20937978-001-05-1	ChemBridge Corporation	6454152			O=C(Cc1ccccc1)NCCSCc1ccccc1	InChI=1S/C17H19NOS/c19-17(13-15-7-3-1-4-8-15)18-11-12-20-14-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,18,19)	GNZFKPRTACAROG-UHFFFAOYSA-N	285.118734928							114812
AC1LR90S	LSM-26275	BRD-K08227755	1419982	InChI=1S/C17H15ClN4O2S2/c1-10-3-4-12(7-14(10)18)15-6-5-13(24-15)8-19-21-16(23)9-25-17-22-20-11(2)26-17/h3-8H,9H2,1-2H3,(H,21,23)	QMPRPPMKSBBTOV-UHFFFAOYSA-N	Cc1ccc(cc1Cl)c2oc(C=NNC(=O)CSc3nnc(C)s3)cc2	BroadT	BRD-K08227755	BRD-K08227755-001-05-2	InterBioScreen Ltd.	STOCK2S-35941			Cc1nnc(SCC(=O)NN=Cc2ccc(o2)-c2ccc(C)c(Cl)c2)s1	InChI=1S/C17H15ClN4O2S2/c1-10-3-4-12(7-14(10)18)15-6-5-13(24-15)8-19-21-16(23)9-25-17-22-20-11(2)26-17/h3-8H,9H2,1-2H3,(H,21,23)	QMPRPPMKSBBTOV-UHFFFAOYSA-N	406.03249485							114813
BRD-K65541951	LSM-12428		54661364	InChI=1S/C18H20F3N3O4/c19-18(20,21)8-22-16(27)15-11(7-25)10-6-23-12(2-1-3-13(23)26)14(10)24(15)17(28)9-4-5-9/h1-3,9-11,14-15,25H,4-8H2,(H,22,27)/t10-,11-,14+,15-/m1/s1	HYHGLNWEXAHCEQ-HKCMKHECSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N([C@H]1C(=O)NCC(F)(F)F)C(=O)C4CC4	BroadT	BRD-K65541951	BRD-K65541951-001-01-7	Broad Institute of MIT and Harvard	BRD-K65541951			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N([C@H]1C(=O)NCC(F)(F)F)C(=O)C1CC1	InChI=1S/C18H20F3N3O4/c19-18(20,21)8-22-16(27)15-11(7-25)10-6-23-12(2-1-3-13(23)26)14(10)24(15)17(28)9-4-5-9/h1-3,9-11,14-15,25H,4-8H2,(H,22,27)/t10-,11-,14+,15-/m1/s1	HYHGLNWEXAHCEQ-HKCMKHECSA-N	399.14059075							101055
BRD-K46751125	LSM-11284		54661274	InChI=1S/C24H29N3O6S/c1-33-16-8-6-14(7-9-16)17-10-11-20-21-18(12-26(20)24(17)30)19(13-28)22(27(21)34(2,31)32)23(29)25-15-4-3-5-15/h6-11,15,18-19,21-22,28H,3-5,12-13H2,1-2H3,(H,25,29)/t18-,19-,21+,22-/m0/s1	MYJOCAZVFWJZEW-MPJJRAAHSA-N	COc1ccc(cc1)C2=CC=C3[C@H]4[C@@H](CN3C2=O)[C@H](CO)[C@H](N4S(=O)(=O)C)C(=O)NC5CCC5	BroadT	BRD-K46751125	BRD-K46751125-001-01-7	Broad Institute of MIT and Harvard	BRD-K46751125			COc1ccc(cc1)-c1ccc2[C@H]3[C@@H](Cn2c1=O)[C@H](CO)[C@H](N3S(C)(=O)=O)C(=O)NC1CCC1	InChI=1S/C24H29N3O6S/c1-33-16-8-6-14(7-9-16)17-10-11-20-21-18(12-26(20)24(17)30)19(13-28)22(27(21)34(2,31)32)23(29)25-15-4-3-5-15/h6-11,15,18-19,21-22,28H,3-5,12-13H2,1-2H3,(H,25,29)/t18-,19-,21+,22-/m0/s1	MYJOCAZVFWJZEW-MPJJRAAHSA-N	487.177706368							99905
BRD-K74732057	LSM-13009		54661089	InChI=1S/C27H28FN3O3/c1-29(2)27(34)24-21(16-32)23-15-31-22(25(24)30(23)14-17-7-4-3-5-8-17)12-11-20(26(31)33)18-9-6-10-19(28)13-18/h3-13,21,23-25,32H,14-16H2,1-2H3/t21-,23-,24+,25+/m1/s1	DPECORRGLVHITO-VGCGRUFVSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@@H]1N2Cc5ccccc5	BroadT	BRD-K74732057	BRD-K74732057-001-01-4	Broad Institute of MIT and Harvard	BRD-K74732057			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]1N2Cc1ccccc1	InChI=1S/C27H28FN3O3/c1-29(2)27(34)24-21(16-32)23-15-31-22(25(24)30(23)14-17-7-4-3-5-8-17)12-11-20(26(31)33)18-9-6-10-19(28)13-18/h3-13,21,23-25,32H,14-16H2,1-2H3/t21-,23-,24+,25+/m1/s1	DPECORRGLVHITO-VGCGRUFVSA-N	461.211469986							101646
BRD-K99327410	LSM-14530		54661139	InChI=1S/C25H35F3N4O3/c1-30(2)12-5-11-29-23(34)22-19(15-33)18-14-32-20(21(18)31(22)13-10-25(26,27)28)9-8-17(24(32)35)16-6-3-4-7-16/h6,8-9,18-19,21-22,33H,3-5,7,10-15H2,1-2H3,(H,29,34)/t18-,19-,21+,22-/m0/s1	VFQPYNAQKZTJPV-MPJJRAAHSA-N	CN(C)CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N1CCC(F)(F)F)C4=CCCC4	BroadT	BRD-K99327410	BRD-K99327410-001-01-6	Broad Institute of MIT and Harvard	BRD-K99327410			CN(C)CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]2N1CCC(F)(F)F	InChI=1S/C25H35F3N4O3/c1-30(2)12-5-11-29-23(34)22-19(15-33)18-14-32-20(21(18)31(22)13-10-25(26,27)28)9-8-17(24(32)35)16-6-3-4-7-16/h6,8-9,18-19,21-22,33H,3-5,7,10-15H2,1-2H3,(H,29,34)/t18-,19-,21+,22-/m0/s1	VFQPYNAQKZTJPV-MPJJRAAHSA-N	496.26612562							103185
BRD-K99786514	LSM-14560		54661134	InChI=1S/C28H32FN3O4/c29-21-8-4-3-7-18(21)19-11-12-22-26-25(27(35)30-17-5-1-2-6-17)20(15-33)23(14-31(22)28(19)36)32(26)24(34)13-16-9-10-16/h3-4,7-8,11-12,16-17,20,23,25-26,33H,1-2,5-6,9-10,13-15H2,(H,30,35)/t20-,23-,25+,26+/m1/s1	ISISPWKPTDWXNP-HDDJIDQQSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]([C@H]1C(=O)NC5CCCC5)N2C(=O)CC6CC6	BroadT	BRD-K99786514	BRD-K99786514-001-01-8	Broad Institute of MIT and Harvard	BRD-K99786514			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]([C@H]1C(=O)NC1CCCC1)N2C(=O)CC1CC1	InChI=1S/C28H32FN3O4/c29-21-8-4-3-7-18(21)19-11-12-22-26-25(27(35)30-17-5-1-2-6-17)20(15-33)23(14-31(22)28(19)36)32(26)24(34)13-16-9-10-16/h3-4,7-8,11-12,16-17,20,23,25-26,33H,1-2,5-6,9-10,13-15H2,(H,30,35)/t20-,23-,25+,26+/m1/s1	ISISPWKPTDWXNP-HDDJIDQQSA-N	493.237684734							103216
BRD-M32495507	LSM-45025		54661376	InChI=1S/C26H31N3O3/c1-3-7-16-10-11-22-23-20(14-29(22)26(16)32)21(15-30)24(28(23)4-2)25(31)27-19-12-17-8-5-6-9-18(17)13-19/h3,5-11,19-21,23-24,30H,4,12-15H2,1-2H3,(H,27,31)/t20-,21-,23+,24-/m1/s1	SKIOLEAINHAYRR-CJTFWIGWSA-N	CCN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C=CC)C3=O)[C@@H]12)C(=O)NC4Cc5ccccc5C4	BroadT	BRD-M32495507	BRD-M32495507-001-01-3	Broad Institute of MIT and Harvard	BRD-M32495507		CCN1[C@@H](C(=O)NC2Cc3ccccc3C2)[C@H](CO)[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]12.CCN1[C@@H](C(=O)NC2Cc3ccccc3C2)[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@@H]12)\C=C/C	CCN1[C@@H](C(=O)NC2Cc3ccccc3C2)[C@H](CO)[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]12.CCN1[C@@H](C(=O)NC2Cc3ccccc3C2)[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@@H]12)\C=C/C	InChI=1S/2C26H31N3O3/c2*1-3-7-16-10-11-22-23-20(14-29(22)26(16)32)21(15-30)24(28(23)4-2)25(31)27-19-12-17-8-5-6-9-18(17)13-19/h2*3,5-11,19-21,23-24,30H,4,12-15H2,1-2H3,(H,27,31)/b7-3+;7-3-/t2*20-,21-,23+,24-/m11/s1	HOSOAPKQWKWYQB-IQEMNFCBSA-N	433.236541882							103262
BRD-K78704198	LSM-13235		54661417	InChI=1S/C23H20FN3O6S/c24-16-3-1-2-4-19(16)34(32,33)27-18-11-26-17(21(27)20(23(30)31)15(18)12-28)6-5-14(22(26)29)13-7-9-25-10-8-13/h1-10,15,18,20-21,28H,11-12H2,(H,30,31)/t15-,18-,20+,21+/m0/s1	OZRBNBICDFVIFO-GDVKCFTOSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@H]([C@@H]1C(=O)O)N2S(=O)(=O)c5ccccc5F	BroadT	BRD-K78704198	BRD-K78704198-001-01-9	Broad Institute of MIT and Harvard	BRD-K78704198			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]([C@@H]1C(O)=O)N2S(=O)(=O)c1ccccc1F	InChI=1S/C23H20FN3O6S/c24-16-3-1-2-4-19(16)34(32,33)27-18-11-26-17(21(27)20(23(30)31)15(18)12-28)6-5-14(22(26)29)13-7-9-25-10-8-13/h1-10,15,18,20-21,28H,11-12H2,(H,30,31)/t15-,18-,20+,21+/m0/s1	OZRBNBICDFVIFO-GDVKCFTOSA-N	485.10568428							101874
BRD-K49640920	LSM-11448		54661172	InChI=1S/C25H24FN3O3/c26-17-8-4-7-16(11-17)18-9-10-21-23-22(24(31)27-12-15-5-2-1-3-6-15)19(14-30)20(28-23)13-29(21)25(18)32/h1-11,19-20,22-23,28,30H,12-14H2,(H,27,31)/t19-,20-,22+,23+/m0/s1	VSJWYLDRVGFTPJ-JFJDKTSWSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H](N2)[C@@H]1C(=O)NCc4ccccc4)c5cccc(F)c5	BroadT	BRD-K49640920	BRD-K49640920-001-01-6	Broad Institute of MIT and Harvard	BRD-K49640920			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H](N2)[C@@H]1C(=O)NCc1ccccc1	InChI=1S/C25H24FN3O3/c26-17-8-4-7-16(11-17)18-9-10-21-23-22(24(31)27-12-15-5-2-1-3-6-15)19(14-30)20(28-23)13-29(21)25(18)32/h1-11,19-20,22-23,28,30H,12-14H2,(H,27,31)/t19-,20-,22+,23+/m0/s1	VSJWYLDRVGFTPJ-JFJDKTSWSA-N	433.180169858							100069
BRD-K79900369	LSM-13303		54661203	InChI=1S/C29H36N4O3/c34-18-23-25-17-33-24(9-8-22(29(33)36)21-4-2-1-3-5-21)27(32(25)16-20-6-7-20)26(23)28(35)31-15-12-19-10-13-30-14-11-19/h4,8-11,13-14,20,23,25-27,34H,1-3,5-7,12,15-18H2,(H,31,35)/t23-,25-,26+,27+/m0/s1	FIQPJBHILIXVDO-ALLMYJPZSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@H]([C@@H]1C(=O)NCCc4ccncc4)N2CC5CC5)C6=CCCCC6	BroadT	BRD-K79900369	BRD-K79900369-001-01-5	Broad Institute of MIT and Harvard	BRD-K79900369			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]([C@@H]1C(=O)NCCc1ccncc1)N2CC1CC1	InChI=1S/C29H36N4O3/c34-18-23-25-17-33-24(9-8-22(29(33)36)21-4-2-1-3-5-21)27(32(25)16-20-6-7-20)26(23)28(35)31-15-12-19-10-13-30-14-11-19/h4,8-11,13-14,20,23,25-27,34H,1-3,5-7,12,15-18H2,(H,31,35)/t23-,25-,26+,27+/m0/s1	FIQPJBHILIXVDO-ALLMYJPZSA-N	488.278741052							101942
CHEMBL2362917	LSM-12592	BRD-K68303822, SID131457601	54661264	InChI=1S/C29H32FN3O3/c1-3-14-32-26-23(24(17-34)27(32)28(35)31-18(2)19-8-5-4-6-9-19)16-33-25(26)13-12-22(29(33)36)20-10-7-11-21(30)15-20/h4-13,15,18,23-24,26-27,34H,3,14,16-17H2,1-2H3,(H,31,35)/t18-,23-,24-,26+,27-/m0/s1	FDXOBPCLNSDZHU-LFKLMQSZSA-N	CCCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@H]12)C(=O)N[C@@H](C)c5ccccc5	BroadT	BRD-K68303822	BRD-K68303822-001-01-6	Broad Institute of MIT and Harvard	BRD-K68303822			CCCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]12)C(=O)N[C@@H](C)c1ccccc1	InChI=1S/C29H32FN3O3/c1-3-14-32-26-23(24(17-34)27(32)28(35)31-18(2)19-8-5-4-6-9-19)16-33-25(26)13-12-22(29(33)36)20-10-7-11-21(30)15-20/h4-13,15,18,23-24,26-27,34H,3,14,16-17H2,1-2H3,(H,31,35)/t18-,23-,24-,26+,27-/m0/s1	FDXOBPCLNSDZHU-LFKLMQSZSA-N	489.242770114							131209
BRD-K46120075	LSM-11239		54661406	InChI=1S/C28H33N3O4/c1-17(19-9-5-3-6-10-19)29-27(34)25-22(16-32)24-15-30-23(26(25)31(24)18(2)33)14-13-21(28(30)35)20-11-7-4-8-12-20/h3,5-6,9-11,13-14,17,22,24-26,32H,4,7-8,12,15-16H2,1-2H3,(H,29,34)/t17-,22-,24-,25+,26+/m0/s1	GHJDVSDORYSUSR-GOMQFJOLSA-N	C[C@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C4=CCCCC4)C3=O)[C@H]1N2C(=O)C)c5ccccc5	BroadT	BRD-K46120075	BRD-K46120075-001-01-5	Broad Institute of MIT and Harvard	BRD-K46120075			C[C@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]1N2C(C)=O)c1ccccc1	InChI=1S/C28H33N3O4/c1-17(19-9-5-3-6-10-19)29-27(34)25-22(16-32)24-15-30-23(26(25)31(24)18(2)33)14-13-21(28(30)35)20-11-7-4-8-12-20/h3,5-6,9-11,13-14,17,22,24-26,32H,4,7-8,12,15-16H2,1-2H3,(H,29,34)/t17-,22-,24-,25+,26+/m0/s1	GHJDVSDORYSUSR-GOMQFJOLSA-N	475.247106566							99860
BRD-K20954269	LSM-9705		54661110	InChI=1S/C25H31N3O4/c1-26-22-18(19(15-29)23(26)25(31)27-12-6-3-7-13-27)14-28-20(22)11-10-17(24(28)30)16-8-4-5-9-21(16)32-2/h4-5,8-11,18-19,22-23,29H,3,6-7,12-15H2,1-2H3/t18-,19-,22+,23-/m1/s1	AZPGNHDLGJGRCW-PJIZGREPSA-N	COc1ccccc1C2=CC=C3[C@@H]4[C@H](CN3C2=O)[C@@H](CO)[C@@H](N4C)C(=O)N5CCCCC5	BroadT	BRD-K20954269	BRD-K20954269-001-01-3	Broad Institute of MIT and Harvard	BRD-K20954269			COc1ccccc1-c1ccc2[C@@H]3[C@H](Cn2c1=O)[C@@H](CO)[C@@H](N3C)C(=O)N1CCCCC1	InChI=1S/C25H31N3O4/c1-26-22-18(19(15-29)23(26)25(31)27-12-6-3-7-13-27)14-28-20(22)11-10-17(24(28)30)16-8-4-5-9-21(16)32-2/h4-5,8-11,18-19,22-23,29H,3,6-7,12-15H2,1-2H3/t18-,19-,22+,23-/m1/s1	AZPGNHDLGJGRCW-PJIZGREPSA-N	437.231456502							98326
BRD-K23051555	LSM-9826		54661047	InChI=1S/C18H23N3O5/c22-9-12-11-8-20-13(6-3-7-14(20)23)15(11)21(16(12)17(24)25)18(26)19-10-4-1-2-5-10/h3,6-7,10-12,15-16,22H,1-2,4-5,8-9H2,(H,19,26)(H,24,25)/t11-,12-,15+,16-/m1/s1	HAYQQCQIMZIRJI-AVRGHOLYSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N([C@H]1C(=O)O)C(=O)NC4CCCC4	BroadT	BRD-K23051555	BRD-K23051555-001-01-8	Broad Institute of MIT and Harvard	BRD-K23051555			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N([C@H]1C(O)=O)C(=O)NC1CCCC1	InChI=1S/C18H23N3O5/c22-9-12-11-8-20-13(6-3-7-14(20)23)15(11)21(16(12)17(24)25)18(26)19-10-4-1-2-5-10/h3,6-7,10-12,15-16,22H,1-2,4-5,8-9H2,(H,19,26)(H,24,25)/t11-,12-,15+,16-/m1/s1	HAYQQCQIMZIRJI-AVRGHOLYSA-N	361.163770866							98447
BRD-M92802283	LSM-45083		54661113	InChI=1S/C27H28FN5O3/c1-2-3-19-6-9-23-24-21(14-32(23)27(19)36)22(15-34)25(33(24)13-18-10-29-16-30-11-18)26(35)31-12-17-4-7-20(28)8-5-17/h2-11,16,21-22,24-25,34H,12-15H2,1H3,(H,31,35)/t21-,22-,24+,25-/m0/s1	LGAKJZSEUNBQTH-HFOXQMJASA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3Cc4cncnc4)C(=O)NCc5ccc(F)cc5	BroadT	BRD-M92802283	BRD-M92802283-001-01-7	Broad Institute of MIT and Harvard	BRD-M92802283		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCc4ccc(F)cc4)N(Cc4cncnc4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCc4ccc(F)cc4)N(Cc4cncnc4)[C@@H]23)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCc4ccc(F)cc4)N(Cc4cncnc4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCc4ccc(F)cc4)N(Cc4cncnc4)[C@@H]23)c1=O	InChI=1S/2C27H28FN5O3/c2*1-2-3-19-6-9-23-24-21(14-32(23)27(19)36)22(15-34)25(33(24)13-18-10-29-16-30-11-18)26(35)31-12-17-4-7-20(28)8-5-17/h2*2-11,16,21-22,24-25,34H,12-15H2,1H3,(H,31,35)/b3-2+;3-2-/t2*21-,22-,24+,25-/m00/s1	AGZSFSMFFQULRF-CWUUPWPKSA-N	489.217618006							103320
BRD-M69191681	LSM-45058		54661127	InChI=1S/C25H31N3O3/c1-4-9-18-12-13-20-23-22(24(30)26-16(3)17-10-7-6-8-11-17)19(15-29)21(27(23)5-2)14-28(20)25(18)31/h4,6-13,16,19,21-23,29H,5,14-15H2,1-3H3,(H,26,30)/t16-,19-,21-,22+,23+/m1/s1	ZMVMPHHWVOTKTD-OYOAKMGBSA-N	CCN1[C@@H]2CN3C(=CC=C(C=CC)C3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N[C@H](C)c4ccccc4	BroadT	BRD-M69191681	BRD-M69191681-001-01-2	Broad Institute of MIT and Harvard	BRD-M69191681		CCN1[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1[C@@H](C(=O)N[C@H](C)c1ccccc1)[C@@H]2CO.CCN1[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]1[C@@H](C(=O)N[C@H](C)c1ccccc1)[C@@H]2CO	CCN1[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1[C@@H](C(=O)N[C@H](C)c1ccccc1)[C@@H]2CO.CCN1[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]1[C@@H](C(=O)N[C@H](C)c1ccccc1)[C@@H]2CO	InChI=1S/2C25H31N3O3/c2*1-4-9-18-12-13-20-23-22(24(30)26-16(3)17-10-7-6-8-11-17)19(15-29)21(27(23)5-2)14-28(20)25(18)31/h2*4,6-13,16,19,21-23,29H,5,14-15H2,1-3H3,(H,26,30)/b9-4+;9-4-/t2*16-,19-,21-,22+,23+/m11/s1	QNYIUHHVJKFROO-CQAFDOCSSA-N	421.236541882							103295
BRD-K44911253	LSM-11161		54661445	InChI=1S/C24H30FN3O4/c1-3-11-27-20-13-28-19(9-8-17(24(28)31)15-4-6-16(25)7-5-15)22(27)21(18(20)14-29)23(30)26-10-12-32-2/h4-9,18,20-22,29H,3,10-14H2,1-2H3,(H,26,30)/t18-,20-,21+,22+/m0/s1	IYRJHNQZTHMZFV-VXSCBNMQSA-N	CCCN1[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCOC	BroadT	BRD-K44911253	BRD-K44911253-001-01-3	Broad Institute of MIT and Harvard	BRD-K44911253			CCCN1[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCOC	InChI=1S/C24H30FN3O4/c1-3-11-27-20-13-28-19(9-8-17(24(28)31)15-4-6-16(25)7-5-15)22(27)21(18(20)14-29)23(30)26-10-12-32-2/h4-9,18,20-22,29H,3,10-14H2,1-2H3,(H,26,30)/t18-,20-,21+,22+/m0/s1	IYRJHNQZTHMZFV-VXSCBNMQSA-N	443.22203467							99782
BRD-K17546203	LSM-9483		54661332	InChI=1S/C26H32N4O4/c1-28(2)14-22(32)30-23-19(20(15-31)24(30)25(33)27-17-9-6-10-17)13-29-21(23)12-11-18(26(29)34)16-7-4-3-5-8-16/h3-5,7-8,11-12,17,19-20,23-24,31H,6,9-10,13-15H2,1-2H3,(H,27,33)/t19-,20-,23+,24-/m1/s1	LSXZROMFDROJOP-MYSJAJEPSA-N	CN(C)CC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@@H]12)C(=O)NC5CCC5	BroadT	BRD-K17546203	BRD-K17546203-001-01-1	Broad Institute of MIT and Harvard	BRD-K17546203			CN(C)CC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]12)C(=O)NC1CCC1	InChI=1S/C26H32N4O4/c1-28(2)14-22(32)30-23-19(20(15-31)24(30)25(33)27-17-9-6-10-17)13-29-21(23)12-11-18(26(29)34)16-7-4-3-5-8-16/h3-5,7-8,11-12,17,19-20,23-24,31H,6,9-10,13-15H2,1-2H3,(H,27,33)/t19-,20-,23+,24-/m1/s1	LSXZROMFDROJOP-MYSJAJEPSA-N	464.242355544							98104
BRD-K20736932	LSM-9686		54661433	InChI=1S/C25H24FN3O4/c1-33-25(32)22-19(14-30)21-13-29-20(23(22)28(21)12-15-3-2-10-27-11-15)9-8-18(24(29)31)16-4-6-17(26)7-5-16/h2-11,19,21-23,30H,12-14H2,1H3/t19-,21-,22+,23+/m1/s1	VJGVMCSFSOLAAN-LGKPFJOYSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]1N2Cc5cccnc5	BroadT	BRD-K20736932	BRD-K20736932-001-01-1	Broad Institute of MIT and Harvard	BRD-K20736932			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]1N2Cc1cccnc1	InChI=1S/C25H24FN3O4/c1-33-25(32)22-19(14-30)21-13-29-20(23(22)28(21)12-15-3-2-10-27-11-15)9-8-18(24(29)31)16-4-6-17(26)7-5-16/h2-11,19,21-23,30H,12-14H2,1H3/t19-,21-,22+,23+/m1/s1	VJGVMCSFSOLAAN-LGKPFJOYSA-N	449.175084478							98307
BRD-K76595742	LSM-13115		54661327	InChI=1S/C21H31N3O3/c1-2-22-21(27)20-16(13-25)15-12-23-17(9-6-10-18(23)26)19(15)24(20)11-14-7-4-3-5-8-14/h6,9-10,14-16,19-20,25H,2-5,7-8,11-13H2,1H3,(H,22,27)/t15-,16-,19+,20-/m1/s1	ZLPHSXDBJGBVPE-YAJHFMINSA-N	CCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@H]2N1CC4CCCCC4	BroadT	BRD-K76595742	BRD-K76595742-001-01-4	Broad Institute of MIT and Harvard	BRD-K76595742			CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@H]2N1CC1CCCCC1	InChI=1S/C21H31N3O3/c1-2-22-21(27)20-16(13-25)15-12-23-17(9-6-10-18(23)26)19(15)24(20)11-14-7-4-3-5-8-14/h6,9-10,14-16,19-20,25H,2-5,7-8,11-13H2,1H3,(H,22,27)/t15-,16-,19+,20-/m1/s1	ZLPHSXDBJGBVPE-YAJHFMINSA-N	373.236541882							101753
BRD-K21230248	LSM-9720		54661271	InChI=1S/C25H30N4O6/c1-13(2)26-25(35)29-19-11-28-18(21(29)20(24(33)34)17(19)12-30)9-8-16(23(28)32)14-6-5-7-15(10-14)22(31)27(3)4/h5-10,13,17,19-21,30H,11-12H2,1-4H3,(H,26,35)(H,33,34)/t17-,19-,20+,21+/m1/s1	HBVVCYLQQFLTLW-PBASOCQRSA-N	CC(C)NC(=O)N1[C@@H]2CN3C(=CC=C(C3=O)c4cccc(c4)C(=O)N(C)C)[C@H]1[C@H]([C@@H]2CO)C(=O)O	BroadT	BRD-K21230248	BRD-K21230248-001-01-3	Broad Institute of MIT and Harvard	BRD-K21230248			CC(C)NC(=O)N1[C@@H]2Cn3c(ccc(-c4cccc(c4)C(=O)N(C)C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(O)=O	InChI=1S/C25H30N4O6/c1-13(2)26-25(35)29-19-11-28-18(21(29)20(24(33)34)17(19)12-30)9-8-16(23(28)32)14-6-5-7-15(10-14)22(31)27(3)4/h5-10,13,17,19-21,30H,11-12H2,1-4H3,(H,26,35)(H,33,34)/t17-,19-,20+,21+/m1/s1	HBVVCYLQQFLTLW-PBASOCQRSA-N	482.21653472							98341
BRD-K27237215	LSM-10075		54661105	InChI=1S/C23H31N3O4/c1-3-11-24-22(29)20-16(13-27)18-12-25-17(21(20)26(18)19(28)4-2)10-9-15(23(25)30)14-7-5-6-8-14/h7,9-10,16,18,20-21,27H,3-6,8,11-13H2,1-2H3,(H,24,29)/t16-,18-,20+,21+/m0/s1	FTXRYBFBPIDHAK-XIGKFDRGSA-N	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]1N2C(=O)CC)C4=CCCC4	BroadT	BRD-K27237215	BRD-K27237215-001-01-1	Broad Institute of MIT and Harvard	BRD-K27237215			CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]1N2C(=O)CC	InChI=1S/C23H31N3O4/c1-3-11-24-22(29)20-16(13-27)18-12-25-17(21(20)26(18)19(28)4-2)10-9-15(23(25)30)14-7-5-6-8-14/h7,9-10,16,18,20-21,27H,3-6,8,11-13H2,1-2H3,(H,24,29)/t16-,18-,20+,21+/m0/s1	FTXRYBFBPIDHAK-XIGKFDRGSA-N	413.231456502							98696
BRD-K80313395	LSM-13336		54661250	InChI=1S/C27H36N4O4/c1-2-30-23-17-31-22(10-9-20(27(31)34)19-7-4-3-5-8-19)25(30)24(21(23)18-32)26(33)28-11-6-12-29-13-15-35-16-14-29/h3-5,7-10,21,23-25,32H,2,6,11-18H2,1H3,(H,28,33)/t21-,23-,24+,25+/m1/s1	VXNMHMGWLBIVRP-VGCGRUFVSA-N	CCN1[C@@H]2CN3C(=O)C(=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)NCCCN4CCOCC4)c5ccccc5	BroadT	BRD-K80313395	BRD-K80313395-001-01-6	Broad Institute of MIT and Harvard	BRD-K80313395			CCN1[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCCN1CCOCC1	InChI=1S/C27H36N4O4/c1-2-30-23-17-31-22(10-9-20(27(31)34)19-7-4-3-5-8-19)25(30)24(21(23)18-32)26(33)28-11-6-12-29-13-15-35-16-14-29/h3-5,7-10,21,23-25,32H,2,6,11-18H2,1H3,(H,28,33)/t21-,23-,24+,25+/m1/s1	VXNMHMGWLBIVRP-VGCGRUFVSA-N	480.273655672							101975
BRD-K25799352	LSM-9995		54661434	InChI=1S/C25H24FN3O4/c1-33-25(32)23-20(14-30)19-13-28-21(8-7-18(24(28)31)16-5-3-9-27-11-16)22(19)29(23)12-15-4-2-6-17(26)10-15/h2-11,19-20,22-23,30H,12-14H2,1H3/t19-,20-,22+,23-/m0/s1	QSBCJQTYLRTAIU-RLBLXZPPSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]2N1Cc5cccc(F)c5	BroadT	BRD-K25799352	BRD-K25799352-001-01-5	Broad Institute of MIT and Harvard	BRD-K25799352			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]2N1Cc1cccc(F)c1	InChI=1S/C25H24FN3O4/c1-33-25(32)23-20(14-30)19-13-28-21(8-7-18(24(28)31)16-5-3-9-27-11-16)22(19)29(23)12-15-4-2-6-17(26)10-15/h2-11,19-20,22-23,30H,12-14H2,1H3/t19-,20-,22+,23-/m0/s1	QSBCJQTYLRTAIU-RLBLXZPPSA-N	449.175084478							98616
BRD-K41767152	LSM-10968		54661106	InChI=1S/C23H31N3O4/c1-3-11-24-22(29)20-16(13-27)18-12-25-17(21(20)26(18)19(28)4-2)10-9-15(23(25)30)14-7-5-6-8-14/h7,9-10,16,18,20-21,27H,3-6,8,11-13H2,1-2H3,(H,24,29)/t16-,18-,20+,21+/m1/s1	FTXRYBFBPIDHAK-LMQGHGSNSA-N	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]1N2C(=O)CC)C4=CCCC4	BroadT	BRD-K41767152	BRD-K41767152-001-01-4	Broad Institute of MIT and Harvard	BRD-K41767152			CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]1N2C(=O)CC	InChI=1S/C23H31N3O4/c1-3-11-24-22(29)20-16(13-27)18-12-25-17(21(20)26(18)19(28)4-2)10-9-15(23(25)30)14-7-5-6-8-14/h7,9-10,16,18,20-21,27H,3-6,8,11-13H2,1-2H3,(H,24,29)/t16-,18-,20+,21+/m1/s1	FTXRYBFBPIDHAK-LMQGHGSNSA-N	413.231456502							99589
BRD-K85072179	LSM-13625		54661070	InChI=1S/C25H32N4O3/c1-28-22-19(20(15-30)23(28)24(31)27-12-16-6-3-2-4-7-16)14-29-21(22)10-9-18(25(29)32)17-8-5-11-26-13-17/h5,8-11,13,16,19-20,22-23,30H,2-4,6-7,12,14-15H2,1H3,(H,27,31)/t19-,20-,22+,23-/m1/s1	ODVRBXJNMOGDSF-YXPKMTABSA-N	CN1[C@H]([C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]12)c4cccnc4)C(=O)NCC5CCCCC5	BroadT	BRD-K85072179	BRD-K85072179-001-01-5	Broad Institute of MIT and Harvard	BRD-K85072179			CN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]12)C(=O)NCC1CCCCC1	InChI=1S/C25H32N4O3/c1-28-22-19(20(15-30)23(28)24(31)27-12-16-6-3-2-4-7-16)14-29-21(22)10-9-18(25(29)32)17-8-5-11-26-13-17/h5,8-11,13,16,19-20,22-23,30H,2-4,6-7,12,14-15H2,1H3,(H,27,31)/t19-,20-,22+,23-/m1/s1	ODVRBXJNMOGDSF-YXPKMTABSA-N	436.247440924							102272
BRD-K90781287	LSM-14016		54661439	InChI=1S/C25H26N4O3/c1-2-28-21-14-29-20(9-8-18(25(29)32)16-10-12-26-13-11-16)23(28)22(19(21)15-30)24(31)27-17-6-4-3-5-7-17/h3-13,19,21-23,30H,2,14-15H2,1H3,(H,27,31)/t19-,21-,22+,23+/m0/s1	OPFBOJMKCVWWQL-KZKAQZJJSA-N	CCN1[C@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@@H]1[C@@H]([C@H]2CO)C(=O)Nc5ccccc5	BroadT	BRD-K90781287	BRD-K90781287-001-01-3	Broad Institute of MIT and Harvard	BRD-K90781287			CCN1[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)Nc1ccccc1	InChI=1S/C25H26N4O3/c1-2-28-21-14-29-20(9-8-18(25(29)32)16-10-12-26-13-11-16)23(28)22(19(21)15-30)24(31)27-17-6-4-3-5-7-17/h3-13,19,21-23,30H,2,14-15H2,1H3,(H,27,31)/t19-,21-,22+,23+/m0/s1	OPFBOJMKCVWWQL-KZKAQZJJSA-N	430.200490732							102669
BRD-K92399508	LSM-14097		54661052	InChI=1S/C24H29N3O6S/c1-33-16-5-3-4-15(10-16)17-8-9-19-22-21(23(29)25-11-14-6-7-14)18(13-28)20(12-26(19)24(17)30)27(22)34(2,31)32/h3-5,8-10,14,18,20-22,28H,6-7,11-13H2,1-2H3,(H,25,29)/t18-,20-,21+,22+/m0/s1	ZMTYCZRIJUNYPN-VXSCBNMQSA-N	COc1cccc(c1)C2=CC=C3[C@@H]4[C@@H]([C@@H](CO)[C@H](CN3C2=O)N4S(=O)(=O)C)C(=O)NCC5CC5	BroadT	BRD-K92399508	BRD-K92399508-001-01-5	Broad Institute of MIT and Harvard	BRD-K92399508			COc1cccc(c1)-c1ccc2[C@@H]3[C@@H]([C@@H](CO)[C@H](Cn2c1=O)N3S(C)(=O)=O)C(=O)NCC1CC1	InChI=1S/C24H29N3O6S/c1-33-16-5-3-4-15(10-16)17-8-9-19-22-21(23(29)25-11-14-6-7-14)18(13-28)20(12-26(19)24(17)30)27(22)34(2,31)32/h3-5,8-10,14,18,20-22,28H,6-7,11-13H2,1-2H3,(H,25,29)/t18-,20-,21+,22+/m0/s1	ZMTYCZRIJUNYPN-VXSCBNMQSA-N	487.177706368							102751
BRD-K15989099	LSM-9387		54661270	InChI=1S/C27H32FN3O5/c1-36-13-12-29-25(33)24-20(15-32)19-14-30-22(23(19)31(24)26(34)16-6-2-3-7-16)11-10-18(27(30)35)17-8-4-5-9-21(17)28/h4-5,8-11,16,19-20,23-24,32H,2-3,6-7,12-15H2,1H3,(H,29,33)/t19-,20-,23+,24-/m1/s1	SEDOFMLHYRNKHQ-MYSJAJEPSA-N	COCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@H]2N1C(=O)C4CCCC4)c5ccccc5F	BroadT	BRD-K15989099	BRD-K15989099-001-01-2	Broad Institute of MIT and Harvard	BRD-K15989099			COCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]2N1C(=O)C1CCCC1	InChI=1S/C27H32FN3O5/c1-36-13-12-29-25(33)24-20(15-32)19-14-30-22(23(19)31(24)26(34)16-6-2-3-7-16)11-10-18(27(30)35)17-8-4-5-9-21(17)28/h4-5,8-11,16,19-20,23-24,32H,2-3,6-7,12-15H2,1H3,(H,29,33)/t19-,20-,23+,24-/m1/s1	SEDOFMLHYRNKHQ-MYSJAJEPSA-N	497.232599354							98008
BRD-M41610223	LSM-45034		54661310	InChI=1S/C26H29N3O7/c1-3-4-16-6-7-18-24-23(25(32)27-10-15-5-8-20-21(9-15)36-14-35-20)17(12-30)19(11-28(18)26(16)33)29(24)22(31)13-34-2/h3-9,17,19,23-24,30H,10-14H2,1-2H3,(H,27,32)/t17-,19-,23+,24+/m1/s1	HQJXANMCBMUVFV-DQHAIFDPSA-N	COCC(=O)N1[C@@H]2CN3C(=O)C(=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)NCc4ccc5OCOc5c4)C=CC	BroadT	BRD-M41610223	BRD-M41610223-001-01-9	Broad Institute of MIT and Harvard	BRD-M41610223		COCC(=O)N1[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc1ccc2OCOc2c1.COCC(=O)N1[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc1ccc2OCOc2c1	COCC(=O)N1[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc1ccc2OCOc2c1.COCC(=O)N1[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc1ccc2OCOc2c1	InChI=1S/2C26H29N3O7/c2*1-3-4-16-6-7-18-24-23(25(32)27-10-15-5-8-20-21(9-15)36-14-35-20)17(12-30)19(11-28(18)26(16)33)29(24)22(31)13-34-2/h2*3-9,17,19,23-24,30H,10-14H2,1-2H3,(H,27,32)/b4-3+;4-3-/t2*17-,19-,23+,24+/m11/s1	GLTXLIQGXWGMJJ-JCVVOPFRSA-N	495.200550298							103271
BRD-K13272610	LSM-9224		54661341	InChI=1S/C25H24FN3O3/c1-28-22-19(20(14-30)23(28)24(31)27-17-5-3-2-4-6-17)13-29-21(22)12-11-18(25(29)32)15-7-9-16(26)10-8-15/h2-12,19-20,22-23,30H,13-14H2,1H3,(H,27,31)/t19-,20-,22+,23-/m0/s1	FCBXOAREBJGYON-RLBLXZPPSA-N	CN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]12)C(=O)Nc5ccccc5	BroadT	BRD-K13272610	BRD-K13272610-001-01-5	Broad Institute of MIT and Harvard	BRD-K13272610			CN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]12)C(=O)Nc1ccccc1	InChI=1S/C25H24FN3O3/c1-28-22-19(20(14-30)23(28)24(31)27-17-5-3-2-4-6-17)13-29-21(22)12-11-18(25(29)32)15-7-9-16(26)10-8-15/h2-12,19-20,22-23,30H,13-14H2,1H3,(H,27,31)/t19-,20-,22+,23-/m0/s1	FCBXOAREBJGYON-RLBLXZPPSA-N	433.180169858							97845
BRD-K90496835	LSM-14001		54661192	InChI=1S/C26H30FN5O3/c1-3-31-23-20(21(14-33)24(31)25(34)28-11-10-18-12-30(2)15-29-18)13-32-22(23)9-8-19(26(32)35)16-4-6-17(27)7-5-16/h4-9,12,15,20-21,23-24,33H,3,10-11,13-14H2,1-2H3,(H,28,34)/t20-,21-,23+,24-/m1/s1	QCFMKJOQGAVCFD-CJTFWIGWSA-N	CCN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]12)C(=O)NCCc5cn(C)cn5	BroadT	BRD-K90496835	BRD-K90496835-001-01-5	Broad Institute of MIT and Harvard	BRD-K90496835			CCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]12)C(=O)NCCc1cn(C)cn1	InChI=1S/C26H30FN5O3/c1-3-31-23-20(21(14-33)24(31)25(34)28-11-10-18-12-30(2)15-29-18)13-32-22(23)9-8-19(26(32)35)16-4-6-17(27)7-5-16/h4-9,12,15,20-21,23-24,33H,3,10-11,13-14H2,1-2H3,(H,28,34)/t20-,21-,23+,24-/m1/s1	QCFMKJOQGAVCFD-CJTFWIGWSA-N	479.23326807							102654
BRD-M08461891	LSM-45001		54661156	InChI=1S/C25H28F2N4O4/c1-3-5-14-6-9-19-22-21(23(33)28-10-4-2)16(13-32)20(12-30(19)24(14)34)31(22)25(35)29-18-11-15(26)7-8-17(18)27/h3,5-9,11,16,20-22,32H,4,10,12-13H2,1-2H3,(H,28,33)(H,29,35)/t16-,20-,21+,22+/m0/s1	ICXYKFCCQOPFQC-FBEWHJACSA-N	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C=CC)C3=O)[C@H]1N2C(=O)Nc4cc(F)ccc4F	BroadT	BRD-M08461891	BRD-M08461891-001-01-9	Broad Institute of MIT and Harvard	BRD-M08461891		CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]1N2C(=O)Nc1cc(F)ccc1F.CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]1N2C(=O)Nc1cc(F)ccc1F	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]1N2C(=O)Nc1cc(F)ccc1F.CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]1N2C(=O)Nc1cc(F)ccc1F	InChI=1S/2C25H28F2N4O4/c2*1-3-5-14-6-9-19-22-21(23(33)28-10-4-2)16(13-32)20(12-30(19)24(14)34)31(22)25(35)29-18-11-15(26)7-8-17(18)27/h2*3,5-9,11,16,20-22,32H,4,10,12-13H2,1-2H3,(H,28,33)(H,29,35)/b5-3+;5-3-/t2*16-,20-,21+,22+/m00/s1	QFZYXZULAIJTQK-VKVAKOOHSA-N	486.207861816							103238
BRD-K25736729	LSM-9990		54661066	InChI=1S/C25H24F3N5O3/c26-25(27,28)14-31-23(35)22-19(13-34)18-12-32-20(21(18)33(22)11-15-3-7-29-8-4-15)2-1-17(24(32)36)16-5-9-30-10-6-16/h1-10,18-19,21-22,34H,11-14H2,(H,31,35)/t18-,19-,21+,22-/m0/s1	VFFISKNUVGRLDD-MPJJRAAHSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@@H]2N(Cc5ccncc5)[C@@H]1C(=O)NCC(F)(F)F	BroadT	BRD-K25736729	BRD-K25736729-001-01-3	Broad Institute of MIT and Harvard	BRD-K25736729			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]2N(Cc2ccncc2)[C@@H]1C(=O)NCC(F)(F)F	InChI=1S/C25H24F3N5O3/c26-25(27,28)14-31-23(35)22-19(13-34)18-12-32-20(21(18)33(22)11-15-3-7-29-8-4-15)2-1-17(24(32)36)16-5-9-30-10-6-16/h1-10,18-19,21-22,34H,11-14H2,(H,31,35)/t18-,19-,21+,22-/m0/s1	VFFISKNUVGRLDD-MPJJRAAHSA-N	499.183124278							98611
BRD-K86654865	LSM-13736		54661193	InChI=1S/C26H30FN5O3/c1-3-31-23-20(21(14-33)24(31)25(34)28-11-10-18-12-30(2)15-29-18)13-32-22(23)9-8-19(26(32)35)16-4-6-17(27)7-5-16/h4-9,12,15,20-21,23-24,33H,3,10-11,13-14H2,1-2H3,(H,28,34)/t20-,21-,23+,24-/m0/s1	QCFMKJOQGAVCFD-ZQRMPTRQSA-N	CCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]12)C(=O)NCCc5cn(C)cn5	BroadT	BRD-K86654865	BRD-K86654865-001-01-8	Broad Institute of MIT and Harvard	BRD-K86654865			CCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]12)C(=O)NCCc1cn(C)cn1	InChI=1S/C26H30FN5O3/c1-3-31-23-20(21(14-33)24(31)25(34)28-11-10-18-12-30(2)15-29-18)13-32-22(23)9-8-19(26(32)35)16-4-6-17(27)7-5-16/h4-9,12,15,20-21,23-24,33H,3,10-11,13-14H2,1-2H3,(H,28,34)/t20-,21-,23+,24-/m0/s1	QCFMKJOQGAVCFD-ZQRMPTRQSA-N	479.23326807							102385
BRD-K67086788	LSM-12512		54661144	InChI=1S/C25H29N3O5/c1-26(2)25(32)22-19(13-29)18-12-27-20(21(18)28(22)23(30)14-7-8-14)10-9-17(24(27)31)15-5-4-6-16(11-15)33-3/h4-6,9-11,14,18-19,21-22,29H,7-8,12-13H2,1-3H3/t18-,19-,21+,22-/m1/s1	GXOJNSFKOZUWBX-KRXUUXHPSA-N	COc1cccc(c1)C2=CC=C3[C@@H]4[C@H](CN3C2=O)[C@@H](CO)[C@@H](N4C(=O)C5CC5)C(=O)N(C)C	BroadT	BRD-K67086788	BRD-K67086788-001-01-0	Broad Institute of MIT and Harvard	BRD-K67086788			COc1cccc(c1)-c1ccc2[C@@H]3[C@H](Cn2c1=O)[C@@H](CO)[C@@H](N3C(=O)C1CC1)C(=O)N(C)C	InChI=1S/C25H29N3O5/c1-26(2)25(32)22-19(13-29)18-12-27-20(21(18)28(22)23(30)14-7-8-14)10-9-17(24(27)31)15-5-4-6-16(11-15)33-3/h4-6,9-11,14,18-19,21-22,29H,7-8,12-13H2,1-3H3/t18-,19-,21+,22-/m1/s1	GXOJNSFKOZUWBX-KRXUUXHPSA-N	451.210721058							101143
BRD-K84061726	LSM-13565		54661379	InChI=1S/C22H23F4N3O3/c23-14-6-4-13(5-7-14)10-27-21(32)20-16(12-30)15-11-29-17(2-1-3-18(29)31)19(15)28(20)9-8-22(24,25)26/h1-7,15-16,19-20,30H,8-12H2,(H,27,32)/t15-,16-,19+,20-/m0/s1	CPSLJULDKOVODL-FEHORTKBSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N(CCC(F)(F)F)[C@@H]1C(=O)NCc4ccc(F)cc4	BroadT	BRD-K84061726	BRD-K84061726-001-01-7	Broad Institute of MIT and Harvard	BRD-K84061726			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N(CCC(F)(F)F)[C@@H]1C(=O)NCc1ccc(F)cc1	InChI=1S/C22H23F4N3O3/c23-14-6-4-13(5-7-14)10-27-21(32)20-16(12-30)15-11-29-17(2-1-3-18(29)31)19(15)28(20)9-8-22(24,25)26/h1-7,15-16,19-20,30H,8-12H2,(H,27,32)/t15-,16-,19+,20-/m0/s1	CPSLJULDKOVODL-FEHORTKBSA-N	453.167554426							102207
BRD-K72956282	LSM-12893		54661295	InChI=1S/C25H30FN3O3/c26-20-9-5-4-8-16(20)17-10-11-21-22-18(13-29(21)25(17)32)19(14-30)23(28-22)24(31)27-12-15-6-2-1-3-7-15/h4-5,8-11,15,18-19,22-23,28,30H,1-3,6-7,12-14H2,(H,27,31)/t18-,19-,22+,23-/m1/s1	IZVHJOOQVCWXPA-PJIZGREPSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H]2N[C@H]1C(=O)NCC4CCCCC4)c5ccccc5F	BroadT	BRD-K72956282	BRD-K72956282-001-01-8	Broad Institute of MIT and Harvard	BRD-K72956282			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]2N[C@H]1C(=O)NCC1CCCCC1	InChI=1S/C25H30FN3O3/c26-20-9-5-4-8-16(20)17-10-11-21-22-18(13-29(21)25(17)32)19(14-30)23(28-22)24(31)27-12-15-6-2-1-3-7-15/h4-5,8-11,15,18-19,22-23,28,30H,1-3,6-7,12-14H2,(H,27,31)/t18-,19-,22+,23-/m1/s1	IZVHJOOQVCWXPA-PJIZGREPSA-N	439.22712005							101530
BRD-K20793945	LSM-9694		54661323	InChI=1S/C23H29N5O3/c1-25-9-11-26(12-10-25)23(31)21-17(15-29)19-14-27-18(3-2-4-20(27)30)22(21)28(19)13-16-5-7-24-8-6-16/h2-8,17,19,21-22,29H,9-15H2,1H3/t17-,19-,21+,22+/m0/s1	BSTTWZJBQFNDNI-HVJHZFLKSA-N	CN1CCN(CC1)C(=O)[C@@H]2[C@@H](CO)[C@@H]3CN4C(=O)C=CC=C4[C@H]2N3Cc5ccncc5	BroadT	BRD-K20793945	BRD-K20793945-001-01-7	Broad Institute of MIT and Harvard	BRD-K20793945			CN1CCN(CC1)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2Cc1ccncc1	InChI=1S/C23H29N5O3/c1-25-9-11-26(12-10-25)23(31)21-17(15-29)19-14-27-18(3-2-4-20(27)30)22(21)28(19)13-16-5-7-24-8-6-16/h2-8,17,19,21-22,29H,9-15H2,1H3/t17-,19-,21+,22+/m0/s1	BSTTWZJBQFNDNI-HVJHZFLKSA-N	423.227039838							98315
BRD-K59352217	LSM-12017		54661067	InChI=1S/C27H35N5O4/c1-28(2)16-23(34)32-22-15-31-21(10-9-19(26(31)35)18-7-5-4-6-8-18)25(32)24(20(22)17-33)27(36)30-13-11-29(3)12-14-30/h4-10,20,22,24-25,33H,11-17H2,1-3H3/t20-,22-,24+,25+/m0/s1	HDUKPTJRZGCVRV-MMTHZHQFSA-N	CN(C)CC(=O)N1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@@H]1[C@@H]([C@H]2CO)C(=O)N5CCN(C)CC5	BroadT	BRD-K59352217	BRD-K59352217-001-01-7	Broad Institute of MIT and Harvard	BRD-K59352217			CN(C)CC(=O)N1[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N1CCN(C)CC1	InChI=1S/C27H35N5O4/c1-28(2)16-23(34)32-22-15-31-21(10-9-19(26(31)35)18-7-5-4-6-8-18)25(32)24(20(22)17-33)27(36)30-13-11-29(3)12-14-30/h4-10,20,22,24-25,33H,11-17H2,1-3H3/t20-,22-,24+,25+/m0/s1	HDUKPTJRZGCVRV-MMTHZHQFSA-N	493.26890465							100643
BRD-K57476701	LSM-11906		54661459	InChI=1S/C25H27N3O4/c1-15(30)28-22-19(20(14-29)23(28)24(31)26-17-9-3-2-4-10-17)13-27-21(22)12-11-18(25(27)32)16-7-5-6-8-16/h2-4,7,9-12,19-20,22-23,29H,5-6,8,13-14H2,1H3,(H,26,31)/t19-,20-,22+,23-/m0/s1	CIRAGUKJUQGHED-RLBLXZPPSA-N	CC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@H]12)C(=O)Nc5ccccc5	BroadT	BRD-K57476701	BRD-K57476701-001-01-9	Broad Institute of MIT and Harvard	BRD-K57476701			CC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]12)C(=O)Nc1ccccc1	InChI=1S/C25H27N3O4/c1-15(30)28-22-19(20(14-29)23(28)24(31)26-17-9-3-2-4-10-17)13-27-21(22)12-11-18(25(27)32)16-7-5-6-8-16/h2-4,7,9-12,19-20,22-23,29H,5-6,8,13-14H2,1H3,(H,26,31)/t19-,20-,22+,23-/m0/s1	CIRAGUKJUQGHED-RLBLXZPPSA-N	433.200156374							100532
BRD-K97031447	LSM-14389		54661245	InChI=1S/C27H34N4O5/c1-3-12-28-27(35)31-22-14-30-21(11-10-19(26(30)34)16-6-4-9-18(13-16)36-2)24(31)23(20(22)15-32)25(33)29-17-7-5-8-17/h4,6,9-11,13,17,20,22-24,32H,3,5,7-8,12,14-15H2,1-2H3,(H,28,35)(H,29,33)/t20-,22-,23+,24+/m1/s1	BCMXGMGGSHUCMP-AZOUXBGGSA-N	CCCNC(=O)N1[C@@H]2CN3C(=O)C(=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)NC4CCC4)c5cccc(OC)c5	BroadT	BRD-K97031447	BRD-K97031447-001-01-3	Broad Institute of MIT and Harvard	BRD-K97031447			CCCNC(=O)N1[C@@H]2Cn3c(ccc(-c4cccc(OC)c4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NC1CCC1	InChI=1S/C27H34N4O5/c1-3-12-28-27(35)31-22-14-30-21(11-10-19(26(30)34)16-6-4-9-18(13-16)36-2)24(31)23(20(22)15-32)25(33)29-17-7-5-8-17/h4,6,9-11,13,17,20,22-24,32H,3,5,7-8,12,14-15H2,1-2H3,(H,28,35)(H,29,33)/t20-,22-,23+,24+/m1/s1	BCMXGMGGSHUCMP-AZOUXBGGSA-N	494.252920228							103043
BRD-K99299141	LSM-14528		54661284	InChI=1S/C24H30N4O3/c1-2-11-27-21-18(19(14-29)22(27)23(30)26-16-6-3-7-16)13-28-20(21)9-8-17(24(28)31)15-5-4-10-25-12-15/h4-5,8-10,12,16,18-19,21-22,29H,2-3,6-7,11,13-14H2,1H3,(H,26,30)/t18-,19-,21+,22-/m0/s1	FSWHIZWXGPVXBM-MPJJRAAHSA-N	CCCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]12)c4cccnc4)C(=O)NC5CCC5	BroadT	BRD-K99299141	BRD-K99299141-001-01-3	Broad Institute of MIT and Harvard	BRD-K99299141			CCCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]12)C(=O)NC1CCC1	InChI=1S/C24H30N4O3/c1-2-11-27-21-18(19(14-29)22(27)23(30)26-16-6-3-7-16)13-28-20(21)9-8-17(24(28)31)15-5-4-10-25-12-15/h4-5,8-10,12,16,18-19,21-22,29H,2-3,6-7,11,13-14H2,1H3,(H,26,30)/t18-,19-,21+,22-/m0/s1	FSWHIZWXGPVXBM-MPJJRAAHSA-N	422.23179086							103183
BRD-M80240720	LSM-45070		54661211	InChI=1S/C25H37N5O4/c1-4-7-17-8-9-20-21-18(14-29(20)24(17)33)19(15-31)22(30(21)25(34)27-16(2)3)23(32)26-10-13-28-11-5-6-12-28/h4,7-9,16,18-19,21-22,31H,5-6,10-15H2,1-3H3,(H,26,32)(H,27,34)/t18-,19-,21+,22-/m0/s1	PNJNHSHUQBINAQ-MPJJRAAHSA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3C(=O)NC(C)C)C(=O)NCCN4CCCC4	BroadT	BRD-M80240720	BRD-M80240720-001-01-5	Broad Institute of MIT and Harvard	BRD-M80240720		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCN4CCCC4)N(C(=O)NC(C)C)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCN4CCCC4)N(C(=O)NC(C)C)[C@@H]23)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCN4CCCC4)N(C(=O)NC(C)C)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCN4CCCC4)N(C(=O)NC(C)C)[C@@H]23)c1=O	InChI=1S/2C25H37N5O4/c2*1-4-7-17-8-9-20-21-18(14-29(20)24(17)33)19(15-31)22(30(21)25(34)27-16(2)3)23(32)26-10-13-28-11-5-6-12-28/h2*4,7-9,16,18-19,21-22,31H,5-6,10-15H2,1-3H3,(H,26,32)(H,27,34)/b7-4+;7-4-/t2*18-,19-,21+,22-/m00/s1	CBUQVPCXQOBTTM-RBBNHILASA-N	471.284554714							103307
BRD-K46407773	LSM-11262		54661305	InChI=1S/C19H25N3O4/c1-11(24)22-15-9-21-14(7-4-8-16(21)25)18(22)17(13(15)10-23)19(26)20-12-5-2-3-6-12/h4,7-8,12-13,15,17-18,23H,2-3,5-6,9-10H2,1H3,(H,20,26)/t13-,15-,17+,18+/m1/s1	RWDQACDHOIJVRL-WCZJQEMASA-N	CC(=O)N1[C@@H]2CN3C(=O)C=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)NC4CCCC4	BroadT	BRD-K46407773	BRD-K46407773-001-01-1	Broad Institute of MIT and Harvard	BRD-K46407773			CC(=O)N1[C@@H]2Cn3c(cccc3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NC1CCCC1	InChI=1S/C19H25N3O4/c1-11(24)22-15-9-21-14(7-4-8-16(21)25)18(22)17(13(15)10-23)19(26)20-12-5-2-3-6-12/h4,7-8,12-13,15,17-18,23H,2-3,5-6,9-10H2,1H3,(H,20,26)/t13-,15-,17+,18+/m1/s1	RWDQACDHOIJVRL-WCZJQEMASA-N	359.18450631							99883
BRD-M41154708	LSM-45033		54661373	InChI=1S/C26H31N3O3/c1-3-7-16-10-11-22-23-20(14-29(22)26(16)32)21(15-30)24(28(23)4-2)25(31)27-19-12-17-8-5-6-9-18(17)13-19/h3,5-11,19-21,23-24,30H,4,12-15H2,1-2H3,(H,27,31)/t20-,21-,23+,24-/m0/s1	SKIOLEAINHAYRR-ZQRMPTRQSA-N	CCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C=CC)C3=O)[C@H]12)C(=O)NC4Cc5ccccc5C4	BroadT	BRD-M41154708	BRD-M41154708-001-01-2	Broad Institute of MIT and Harvard	BRD-M41154708		CCN1[C@H](C(=O)NC2Cc3ccccc3C2)[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]12.CCN1[C@H](C(=O)NC2Cc3ccccc3C2)[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@H]12)\C=C/C	CCN1[C@H](C(=O)NC2Cc3ccccc3C2)[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]12.CCN1[C@H](C(=O)NC2Cc3ccccc3C2)[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@H]12)\C=C/C	InChI=1S/2C26H31N3O3/c2*1-3-7-16-10-11-22-23-20(14-29(22)26(16)32)21(15-30)24(28(23)4-2)25(31)27-19-12-17-8-5-6-9-18(17)13-19/h2*3,5-11,19-21,23-24,30H,4,12-15H2,1-2H3,(H,27,31)/b7-3+;7-3-/t2*20-,21-,23+,24-/m00/s1	HOSOAPKQWKWYQB-KNFGSJPGSA-N	433.236541882							103270
BRD-K74152422	LSM-12968		54661380	InChI=1S/C22H23F4N3O3/c23-14-6-4-13(5-7-14)10-27-21(32)20-16(12-30)15-11-29-17(2-1-3-18(29)31)19(15)28(20)9-8-22(24,25)26/h1-7,15-16,19-20,30H,8-12H2,(H,27,32)/t15-,16-,19+,20-/m1/s1	CPSLJULDKOVODL-YAJHFMINSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N(CCC(F)(F)F)[C@H]1C(=O)NCc4ccc(F)cc4	BroadT	BRD-K74152422	BRD-K74152422-001-01-3	Broad Institute of MIT and Harvard	BRD-K74152422			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N(CCC(F)(F)F)[C@H]1C(=O)NCc1ccc(F)cc1	InChI=1S/C22H23F4N3O3/c23-14-6-4-13(5-7-14)10-27-21(32)20-16(12-30)15-11-29-17(2-1-3-18(29)31)19(15)28(20)9-8-22(24,25)26/h1-7,15-16,19-20,30H,8-12H2,(H,27,32)/t15-,16-,19+,20-/m1/s1	CPSLJULDKOVODL-YAJHFMINSA-N	453.167554426							101605
BRD-K78247419	LSM-43495		54661200	InChI=1S/C29H33N3O4/c33-17-22-24-16-31-23(14-13-21(28(31)35)12-11-18-5-2-1-3-6-18)26(32(24)29(36)20-7-4-8-20)25(22)27(34)30-15-19-9-10-19/h1-3,5-6,11-14,19-20,22,24-26,33H,4,7-10,15-17H2,(H,30,34)/b12-11+/t22-,24-,25+,26+/m0/s1	IAXCLMCZIRASFG-OEVAXVTLSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@H]([C@@H]1C(=O)NCC4CC4)N2C(=O)C5CCC5)\C=C\c6ccccc6	BroadT	BRD-K78247419	BRD-K78247419-001-01-2	Broad Institute of MIT and Harvard	BRD-K78247419			OC[C@H]1[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]([C@@H]1C(=O)NCC1CC1)N2C(=O)C1CCC1	InChI=1S/C29H33N3O4/c33-17-22-24-16-31-23(14-13-21(28(31)35)12-11-18-5-2-1-3-6-18)26(32(24)29(36)20-7-4-8-20)25(22)27(34)30-15-19-9-10-19/h1-3,5-6,11-14,19-20,22,24-26,33H,4,7-10,15-17H2,(H,30,34)/b12-11+/t22-,24-,25+,26+/m0/s1	IAXCLMCZIRASFG-OEVAXVTLSA-N	487.247106566							
BRD-K64937432	LSM-12395		54661313	InChI=1S/C28H32FN3O4/c1-2-24(34)32-25-21(15-31-23(25)13-12-20(28(31)36)18-6-4-3-5-7-18)22(16-33)26(32)27(35)30-14-17-8-10-19(29)11-9-17/h6,8-13,21-22,25-26,33H,2-5,7,14-16H2,1H3,(H,30,35)/t21-,22-,25+,26-/m1/s1	YUSKIZLEIJYDDG-ULDOEVFSSA-N	CCC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]12)C4=CCCCC4)C(=O)NCc5ccc(F)cc5	BroadT	BRD-K64937432	BRD-K64937432-001-01-7	Broad Institute of MIT and Harvard	BRD-K64937432			CCC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]12)C(=O)NCc1ccc(F)cc1	InChI=1S/C28H32FN3O4/c1-2-24(34)32-25-21(15-31-23(25)13-12-20(28(31)36)18-6-4-3-5-7-18)22(16-33)26(32)27(35)30-14-17-8-10-19(29)11-9-17/h6,8-13,21-22,25-26,33H,2-5,7,14-16H2,1H3,(H,30,35)/t21-,22-,25+,26-/m1/s1	YUSKIZLEIJYDDG-ULDOEVFSSA-N	493.237684734							101022
BRD-K51640940	LSM-11587		54661251	InChI=1S/C26H23FN2O6/c1-35-15-8-6-14(7-9-15)16-10-11-20-23-22(26(33)34)18(13-30)21(12-28(20)24(16)31)29(23)25(32)17-4-2-3-5-19(17)27/h2-11,18,21-23,30H,12-13H2,1H3,(H,33,34)/t18-,21-,22+,23+/m0/s1	HJRLJVUTEJWJEN-XSEFMFLKSA-N	COc1ccc(cc1)C2=CC=C3[C@@H]4[C@@H]([C@@H](CO)[C@H](CN3C2=O)N4C(=O)c5ccccc5F)C(=O)O	BroadT	BRD-K51640940	BRD-K51640940-001-01-7	Broad Institute of MIT and Harvard	BRD-K51640940			COc1ccc(cc1)-c1ccc2[C@@H]3[C@@H]([C@@H](CO)[C@H](Cn2c1=O)N3C(=O)c1ccccc1F)C(O)=O	InChI=1S/C26H23FN2O6/c1-35-15-8-6-14(7-9-15)16-10-11-20-23-22(26(33)34)18(13-30)21(12-28(20)24(16)31)29(23)25(32)17-4-2-3-5-19(17)27/h2-11,18,21-23,30H,12-13H2,1H3,(H,33,34)/t18-,21-,22+,23+/m0/s1	HJRLJVUTEJWJEN-XSEFMFLKSA-N	478.154014676							100210
BRD-K12805419	LSM-9186		54661207	InChI=1S/C28H27N5O4/c34-15-23-22-14-32-24(9-8-21(28(32)36)19-7-4-10-29-12-19)25(22)33(13-20-16-37-17-31-20)26(23)27(35)30-11-18-5-2-1-3-6-18/h1-10,12,16-17,22-23,25-26,34H,11,13-15H2,(H,30,35)/t22-,23-,25+,26-/m0/s1	FQHAKQIPMBJGGK-LJCOXQHRSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]2N(Cc5cocn5)[C@@H]1C(=O)NCc6ccccc6	BroadT	BRD-K12805419	BRD-K12805419-001-01-6	Broad Institute of MIT and Harvard	BRD-K12805419			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]2N(Cc2cocn2)[C@@H]1C(=O)NCc1ccccc1	InChI=1S/C28H27N5O4/c34-15-23-22-14-32-24(9-8-21(28(32)36)19-7-4-10-29-12-19)25(22)33(13-20-16-37-17-31-20)26(23)27(35)30-11-18-5-2-1-3-6-18/h1-10,12,16-17,22-23,25-26,34H,11,13-15H2,(H,30,35)/t22-,23-,25+,26-/m0/s1	FQHAKQIPMBJGGK-LJCOXQHRSA-N	497.206304394							97807
BRD-K73228437-001-01-5	LSM-26276	BRD-K73228437	54661035	InChI=1S/C26H27FN4O4/c27-16-4-1-3-15(9-16)19-7-8-21-24-23(25(33)29-17-5-2-6-17)20(12-32)22(11-31(21)26(19)34)30(24)10-18-13-35-14-28-18/h1,3-4,7-9,13-14,17,20,22-24,32H,2,5-6,10-12H2,(H,29,33)/t20-,22-,23+,24+/m0/s1	UTTHWALNPQWSTE-IQFVJIFQSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@H]([C@@H]1C(=O)NC5CCC5)N2Cc6cocn6	BroadT	BRD-K73228437	BRD-K73228437-001-01-5	Broad Institute of MIT and Harvard	BRD-K73228437			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]([C@@H]1C(=O)NC1CCC1)N2Cc1cocn1	InChI=1S/C26H27FN4O4/c27-16-4-1-3-15(9-16)19-7-8-21-24-23(25(33)29-17-5-2-6-17)20(12-32)22(11-31(21)26(19)34)30(24)10-18-13-35-14-28-18/h1,3-4,7-9,13-14,17,20,22-24,32H,2,5-6,10-12H2,(H,29,33)/t20-,22-,23+,24+/m0/s1	UTTHWALNPQWSTE-IQFVJIFQSA-N	478.201633584							114814
BRD-K59793998	LSM-12042		54661412	InChI=1S/C24H25FN2O5/c1-32-24(31)21-18(12-28)17-11-26-19(20(17)27(21)22(29)14-3-2-4-14)10-9-16(23(26)30)13-5-7-15(25)8-6-13/h5-10,14,17-18,20-21,28H,2-4,11-12H2,1H3/t17-,18-,20+,21-/m1/s1	YQHVQTZYSLOMSV-RMVXJAJNSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]2N1C(=O)C5CCC5	BroadT	BRD-K59793998	BRD-K59793998-001-01-7	Broad Institute of MIT and Harvard	BRD-K59793998			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@H]2N1C(=O)C1CCC1)-c1ccc(F)cc1	InChI=1S/C24H25FN2O5/c1-32-24(31)21-18(12-28)17-11-26-19(20(17)27(21)22(29)14-3-2-4-14)10-9-16(23(26)30)13-5-7-15(25)8-6-13/h5-10,14,17-18,20-21,28H,2-4,11-12H2,1H3/t17-,18-,20+,21-/m1/s1	YQHVQTZYSLOMSV-RMVXJAJNSA-N	440.17475012							100668
BRD-K13544395	LSM-9242		54661346	InChI=1S/C22H25N3O5/c1-30-13-19(28)25-20-15(11-24-17(20)8-5-9-18(24)27)16(12-26)21(25)22(29)23-10-14-6-3-2-4-7-14/h2-9,15-16,20-21,26H,10-13H2,1H3,(H,23,29)/t15-,16-,20+,21-/m1/s1	DTBBLQRMWRNBOL-WWEWDKITSA-N	COCC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]12)C(=O)NCc4ccccc4	BroadT	BRD-K13544395	BRD-K13544395-001-01-8	Broad Institute of MIT and Harvard	BRD-K13544395			COCC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]12)C(=O)NCc1ccccc1	InChI=1S/C22H25N3O5/c1-30-13-19(28)25-20-15(11-24-17(20)8-5-9-18(24)27)16(12-26)21(25)22(29)23-10-14-6-3-2-4-7-14/h2-9,15-16,20-21,26H,10-13H2,1H3,(H,23,29)/t15-,16-,20+,21-/m1/s1	DTBBLQRMWRNBOL-WWEWDKITSA-N	411.17942093							97863
BRD-K83058591	LSM-13505		54661280	InChI=1S/C23H26FN3O4/c1-4-19(29)27-20-16(17(12-28)21(27)23(31)25(2)3)11-26-18(20)10-9-15(22(26)30)13-5-7-14(24)8-6-13/h5-10,16-17,20-21,28H,4,11-12H2,1-3H3/t16-,17-,20+,21-/m0/s1	OMUHXYIQFYOIMG-PZBISTMVSA-N	CCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]12)C(=O)N(C)C	BroadT	BRD-K83058591	BRD-K83058591-001-01-6	Broad Institute of MIT and Harvard	BRD-K83058591			CCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]12)C(=O)N(C)C	InChI=1S/C23H26FN3O4/c1-4-19(29)27-20-16(17(12-28)21(27)23(31)25(2)3)11-26-18(20)10-9-15(22(26)30)13-5-7-14(24)8-6-13/h5-10,16-17,20-21,28H,4,11-12H2,1-3H3/t16-,17-,20+,21-/m0/s1	OMUHXYIQFYOIMG-PZBISTMVSA-N	427.190734542							102146
BRD-M53346459	LSM-45044		54661450	InChI=1S/C24H28ClN3O3/c1-3-7-15-10-11-20-21-17(13-27(20)24(15)31)18(14-29)22(23(30)26-4-2)28(21)12-16-8-5-6-9-19(16)25/h3,5-11,17-18,21-22,29H,4,12-14H2,1-2H3,(H,26,30)/t17-,18-,21+,22-/m0/s1	FRGNTWRPDAOXEK-HXHBTQRASA-N	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N1Cc4ccccc4Cl)C=CC	BroadT	BRD-M53346459	BRD-M53346459-001-01-0	Broad Institute of MIT and Harvard	BRD-M53346459		CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]2N1Cc1ccccc1Cl.CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]2N1Cc1ccccc1Cl	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]2N1Cc1ccccc1Cl.CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]2N1Cc1ccccc1Cl	InChI=1S/2C24H28ClN3O3/c2*1-3-7-15-10-11-20-21-17(13-27(20)24(15)31)18(14-29)22(23(30)26-4-2)28(21)12-16-8-5-6-9-19(16)25/h2*3,5-11,17-18,21-22,29H,4,12-14H2,1-2H3,(H,26,30)/b7-3+;7-3-/t2*17-,18-,21+,22-/m00/s1	BBJDFTMDCDCETN-FEGHWDKZSA-N	441.181919496							103281
BRD-K87838848	LSM-13816		54661322	InChI=1S/C26H32N2O5/c1-32-22-10-6-5-9-17(22)18-11-12-21-23-19(14-27(21)25(18)30)20(15-29)24(26(31)33-2)28(23)13-16-7-3-4-8-16/h5-6,9-12,16,19-20,23-24,29H,3-4,7-8,13-15H2,1-2H3/t19-,20-,23+,24-/m1/s1	FQNLDYTYHLYOSL-MYSJAJEPSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@H]2N1CC5CCCC5	BroadT	BRD-K87838848	BRD-K87838848-001-01-8	Broad Institute of MIT and Harvard	BRD-K87838848			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@H]2N1CC1CCCC1	InChI=1S/C26H32N2O5/c1-32-22-10-6-5-9-17(22)18-11-12-21-23-19(14-27(21)25(18)30)20(15-29)24(26(31)33-2)28(23)13-16-7-3-4-8-16/h5-6,9-12,16,19-20,23-24,29H,3-4,7-8,13-15H2,1-2H3/t19-,20-,23+,24-/m1/s1	FQNLDYTYHLYOSL-MYSJAJEPSA-N	452.231122144							131226
BRD-K38370145	LSM-10751		54661263	InChI=1S/C29H32FN3O3/c1-3-14-32-26-23(24(17-34)27(32)28(35)31-18(2)19-8-5-4-6-9-19)16-33-25(26)13-12-22(29(33)36)20-10-7-11-21(30)15-20/h4-13,15,18,23-24,26-27,34H,3,14,16-17H2,1-2H3,(H,31,35)/t18-,23+,24+,26-,27+/m0/s1	FDXOBPCLNSDZHU-PWXPXDTKSA-N	CCCN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@@H]12)C(=O)N[C@@H](C)c5ccccc5	BroadT	BRD-K38370145	BRD-K38370145-001-01-2	Broad Institute of MIT and Harvard	BRD-K38370145			CCCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]12)C(=O)N[C@@H](C)c1ccccc1	InChI=1S/C29H32FN3O3/c1-3-14-32-26-23(24(17-34)27(32)28(35)31-18(2)19-8-5-4-6-9-19)16-33-25(26)13-12-22(29(33)36)20-10-7-11-21(30)15-20/h4-13,15,18,23-24,26-27,34H,3,14,16-17H2,1-2H3,(H,31,35)/t18-,23+,24+,26-,27+/m0/s1	FDXOBPCLNSDZHU-PWXPXDTKSA-N	489.242770114							99372
BRD-K94081674-001-01-5	LSM-26277	BRD-K94081674	54661062	InChI=1S/C25H23FN4O4/c26-17-8-6-15(7-9-17)11-28-24(33)23-19(14-31)18-13-29-20(4-1-5-21(29)32)22(18)30(23)25(34)16-3-2-10-27-12-16/h1-10,12,18-19,22-23,31H,11,13-14H2,(H,28,33)/t18-,19-,22+,23-/m0/s1	UPOVAPIOUWKYFQ-LBVMUVSTSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N([C@@H]1C(=O)NCc4ccc(F)cc4)C(=O)c5cccnc5	BroadT	BRD-K94081674	BRD-K94081674-001-01-5	Broad Institute of MIT and Harvard	BRD-K94081674			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N([C@@H]1C(=O)NCc1ccc(F)cc1)C(=O)c1cccnc1	InChI=1S/C25H23FN4O4/c26-17-8-6-15(7-9-17)11-28-24(33)23-19(14-31)18-13-29-20(4-1-5-21(29)32)22(18)30(23)25(34)16-3-2-10-27-12-16/h1-10,12,18-19,22-23,31H,11,13-14H2,(H,28,33)/t18-,19-,22+,23-/m0/s1	UPOVAPIOUWKYFQ-LBVMUVSTSA-N	462.170333456							114815
BRD-K93680063	LSM-14174		54661111	InChI=1S/C30H37N3O3/c1-2-15-32-26-18-33-25(13-12-23(29(33)35)21-9-4-3-5-10-21)28(32)27(24(26)19-34)30(36)31-16-14-20-8-6-7-11-22(20)17-31/h6-9,11-13,24,26-28,34H,2-5,10,14-19H2,1H3/t24-,26-,27+,28+/m1/s1	KTCZPISMGPPISS-OIIADRAWSA-N	CCCN1[C@@H]2CN3C(=O)C(=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)N4CCc5ccccc5C4)C6=CCCCC6	BroadT	BRD-K93680063	BRD-K93680063-001-01-4	Broad Institute of MIT and Harvard	BRD-K93680063			CCCN1[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N1CCc2ccccc2C1	InChI=1S/C30H37N3O3/c1-2-15-32-26-18-33-25(13-12-23(29(33)35)21-9-4-3-5-10-21)28(32)27(24(26)19-34)30(36)31-16-14-20-8-6-7-11-22(20)17-31/h6-9,11-13,24,26-28,34H,2-5,10,14-19H2,1H3/t24-,26-,27+,28+/m1/s1	KTCZPISMGPPISS-OIIADRAWSA-N	487.283492074							102828
BRD-K91834385	LSM-14073		54661437	InChI=1S/C23H26F3N3O3/c1-27(2)22(32)20-17(13-30)16-12-29-18(19(16)28(20)11-10-23(24,25)26)9-8-15(21(29)31)14-6-4-3-5-7-14/h3-9,16-17,19-20,30H,10-13H2,1-2H3/t16-,17-,19+,20-/m1/s1	LSVFVIWAXGKISN-IZBJGVDFSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@H]2N1CCC(F)(F)F	BroadT	BRD-K91834385	BRD-K91834385-001-01-0	Broad Institute of MIT and Harvard	BRD-K91834385			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]2N1CCC(F)(F)F	InChI=1S/C23H26F3N3O3/c1-27(2)22(32)20-17(13-30)16-12-29-18(19(16)28(20)11-10-23(24,25)26)9-8-15(21(29)31)14-6-4-3-5-7-14/h3-9,16-17,19-20,30H,10-13H2,1-2H3/t16-,17-,19+,20-/m1/s1	LSVFVIWAXGKISN-IZBJGVDFSA-N	449.192626322							102727
BRD-K55813437	LSM-11810		54661349	InChI=1S/C25H28N4O4/c30-13-18-20-12-28-19(8-7-17(25(28)33)16-2-1-9-26-11-16)22(29(20)24(32)15-5-6-15)21(18)23(31)27-10-14-3-4-14/h1-2,7-9,11,14-15,18,20-22,30H,3-6,10,12-13H2,(H,27,31)/t18-,20-,21+,22+/m1/s1	YVZLAXVGGRSZTP-YJMBLLCNSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]([C@H]1C(=O)NCC5CC5)N2C(=O)C6CC6	BroadT	BRD-K55813437	BRD-K55813437-001-01-6	Broad Institute of MIT and Harvard	BRD-K55813437			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]([C@H]1C(=O)NCC1CC1)N2C(=O)C1CC1	InChI=1S/C25H28N4O4/c30-13-18-20-12-28-19(8-7-17(25(28)33)16-2-1-9-26-11-16)22(29(20)24(32)15-5-6-15)21(18)23(31)27-10-14-3-4-14/h1-2,7-9,11,14-15,18,20-22,30H,3-6,10,12-13H2,(H,27,31)/t18-,20-,21+,22+/m1/s1	YVZLAXVGGRSZTP-YJMBLLCNSA-N	448.211055416							100435
BRD-K46017924	LSM-11233		54661103	InChI=1S/C27H28FN3O3/c1-16(17-8-4-3-5-9-17)29-26(33)24-20(15-32)23-14-31-22(25(24)30(23)2)13-12-19(27(31)34)18-10-6-7-11-21(18)28/h3-13,16,20,23-25,32H,14-15H2,1-2H3,(H,29,33)/t16-,20+,23+,24-,25-/m1/s1	XOPHINQZQCNQKH-UAZIBMMXSA-N	C[C@@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]1N2C)c5ccccc5	BroadT	BRD-K46017924	BRD-K46017924-001-01-6	Broad Institute of MIT and Harvard	BRD-K46017924			C[C@@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]1N2C)c1ccccc1	InChI=1S/C27H28FN3O3/c1-16(17-8-4-3-5-9-17)29-26(33)24-20(15-32)23-14-31-22(25(24)30(23)2)13-12-19(27(31)34)18-10-6-7-11-21(18)28/h3-13,16,20,23-25,32H,14-15H2,1-2H3,(H,29,33)/t16-,20+,23+,24-,25-/m1/s1	XOPHINQZQCNQKH-UAZIBMMXSA-N	461.211469986							99854
BRD-K41326905	LSM-10938		54661231	InChI=1S/C28H29FN4O3/c29-22-6-2-1-5-19(22)20-9-10-23-26-25(27(35)31-13-17-7-8-17)21(16-34)24(15-33(23)28(20)36)32(26)14-18-4-3-11-30-12-18/h1-6,9-12,17,21,24-26,34H,7-8,13-16H2,(H,31,35)/t21-,24-,25+,26+/m1/s1	PGXATXJTQODNDY-AFQFEXIYSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]([C@H]1C(=O)NCC5CC5)N2Cc6cccnc6	BroadT	BRD-K41326905	BRD-K41326905-001-01-9	Broad Institute of MIT and Harvard	BRD-K41326905			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]([C@H]1C(=O)NCC1CC1)N2Cc1cccnc1	InChI=1S/C28H29FN4O3/c29-22-6-2-1-5-19(22)20-9-10-23-26-25(27(35)31-13-17-7-8-17)21(16-34)24(15-33(23)28(20)36)32(26)14-18-4-3-11-30-12-18/h1-6,9-12,17,21,24-26,34H,7-8,13-16H2,(H,31,35)/t21-,24-,25+,26+/m1/s1	PGXATXJTQODNDY-AFQFEXIYSA-N	488.222369028							99559
BRD-K41341398	LSM-10939		54661277	InChI=1S/C25H30FN3O3/c1-2-10-28-21-13-29-20(9-8-18(25(29)32)16-4-3-5-17(26)11-16)23(28)22(19(21)14-30)24(31)27-12-15-6-7-15/h3-5,8-9,11,15,19,21-23,30H,2,6-7,10,12-14H2,1H3,(H,27,31)/t19-,21-,22+,23+/m1/s1	IRMAIVPGTUGMHM-LGKPFJOYSA-N	CCCN1[C@@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@H]1[C@H]([C@@H]2CO)C(=O)NCC5CC5	BroadT	BRD-K41341398	BRD-K41341398-001-01-2	Broad Institute of MIT and Harvard	BRD-K41341398			CCCN1[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCC1CC1	InChI=1S/C25H30FN3O3/c1-2-10-28-21-13-29-20(9-8-18(25(29)32)16-4-3-5-17(26)11-16)23(28)22(19(21)14-30)24(31)27-12-15-6-7-15/h3-5,8-9,11,15,19,21-23,30H,2,6-7,10,12-14H2,1H3,(H,27,31)/t19-,21-,22+,23+/m1/s1	IRMAIVPGTUGMHM-LGKPFJOYSA-N	439.22712005							99560
BRD-K47204106	LSM-11311		54661425	InChI=1S/C25H30N4O4/c1-28(2)24(32)16-5-3-4-15(10-16)17-8-9-20-21-18(12-29(20)25(17)33)19(13-30)22(27-21)23(31)26-11-14-6-7-14/h3-5,8-10,14,18-19,21-22,27,30H,6-7,11-13H2,1-2H3,(H,26,31)/t18-,19-,21+,22-/m1/s1	BQHFMDKBCXXEDN-KRXUUXHPSA-N	CN(C)C(=O)c1cccc(c1)C2=CC=C3[C@H]4N[C@H]([C@H](CO)[C@H]4CN3C2=O)C(=O)NCC5CC5	BroadT	BRD-K47204106	BRD-K47204106-001-01-9	Broad Institute of MIT and Harvard	BRD-K47204106			CN(C)C(=O)c1cccc(c1)-c1ccc2[C@H]3N[C@H]([C@H](CO)[C@H]3Cn2c1=O)C(=O)NCC1CC1	InChI=1S/C25H30N4O4/c1-28(2)24(32)16-5-3-4-15(10-16)17-8-9-20-21-18(12-29(20)25(17)33)19(13-30)22(27-21)23(31)26-11-14-6-7-14/h3-5,8-10,14,18-19,21-22,27,30H,6-7,11-13H2,1-2H3,(H,26,31)/t18-,19-,21+,22-/m1/s1	BQHFMDKBCXXEDN-KRXUUXHPSA-N	450.22670548							99932
BRD-K19054042	LSM-9571		54661242	InChI=1S/C20H27N3O4/c1-2-16(25)23-18-13(11-22-15(18)7-6-8-17(22)26)14(12-24)19(23)20(27)21-9-4-3-5-10-21/h6-8,13-14,18-19,24H,2-5,9-12H2,1H3/t13-,14-,18+,19-/m1/s1	DUBNWEBJLMWVKU-TUFGIGEDSA-N	CCC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]12)C(=O)N4CCCCC4	BroadT	BRD-K19054042	BRD-K19054042-001-01-9	Broad Institute of MIT and Harvard	BRD-K19054042			CCC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]12)C(=O)N1CCCCC1	InChI=1S/C20H27N3O4/c1-2-16(25)23-18-13(11-22-15(18)7-6-8-17(22)26)14(12-24)19(23)20(27)21-9-4-3-5-10-21/h6-8,13-14,18-19,24H,2-5,9-12H2,1H3/t13-,14-,18+,19-/m1/s1	DUBNWEBJLMWVKU-TUFGIGEDSA-N	373.200156374							98192
BRD-K74799293	LSM-13012		54661294	InChI=1S/C26H27N5O3/c1-30-23-20(12-31-22(23)7-6-19(26(31)34)17-10-27-14-28-11-17)21(13-32)24(30)25(33)29-18-8-15-4-2-3-5-16(15)9-18/h2-7,10-11,14,18,20-21,23-24,32H,8-9,12-13H2,1H3,(H,29,33)/t20-,21-,23+,24-/m0/s1	DWBOFDUJFWPQPT-ZQRMPTRQSA-N	CN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@H]12)C(=O)NC5Cc6ccccc6C5	BroadT	BRD-K74799293	BRD-K74799293-001-01-7	Broad Institute of MIT and Harvard	BRD-K74799293			CN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@H]12)C(=O)NC1Cc2ccccc2C1	InChI=1S/C26H27N5O3/c1-30-23-20(12-31-22(23)7-6-19(26(31)34)17-10-27-14-28-11-17)21(13-32)24(30)25(33)29-18-8-15-4-2-3-5-16(15)9-18/h2-7,10-11,14,18,20-21,23-24,32H,8-9,12-13H2,1H3,(H,29,33)/t20-,21-,23+,24-/m0/s1	DWBOFDUJFWPQPT-ZQRMPTRQSA-N	457.211389774							101649
BRD-M20534100	LSM-45011		54661071	InChI=1S/C27H33N3O5/c1-3-6-18-9-10-22-24-20(16-29(22)26(18)32)21(17-31)25(27(33)28-11-13-35-14-12-28)30(24)15-19-7-4-5-8-23(19)34-2/h3-10,20-21,24-25,31H,11-17H2,1-2H3/t20-,21-,24+,25-/m1/s1	KLSOMJQHNGKNNV-KZKYLIHBSA-N	COc1ccccc1CN2[C@H]([C@H](CO)[C@H]3CN4C(=CC=C(C=CC)C4=O)[C@@H]23)C(=O)N5CCOCC5	BroadT	BRD-M20534100	BRD-M20534100-001-01-4	Broad Institute of MIT and Harvard	BRD-M20534100		COc1ccccc1CN1[C@@H](C(=O)N2CCOCC2)[C@H](CO)[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]12.COc1ccccc1CN1[C@@H](C(=O)N2CCOCC2)[C@H](CO)[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]12	COc1ccccc1CN1[C@@H](C(=O)N2CCOCC2)[C@H](CO)[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]12.COc1ccccc1CN1[C@@H](C(=O)N2CCOCC2)[C@H](CO)[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]12	InChI=1S/2C27H33N3O5/c2*1-3-6-18-9-10-22-24-20(16-29(22)26(18)32)21(17-31)25(27(33)28-11-13-35-14-12-28)30(24)15-19-7-4-5-8-23(19)34-2/h2*3-10,20-21,24-25,31H,11-17H2,1-2H3/b6-3+;6-3-/t2*20-,21-,24+,25-/m11/s1	MUKTYZHOEUTDIA-BODYVZRESA-N	479.242021186							103248
BRD-K88995397	LSM-13904		54661232	InChI=1S/C28H29FN4O3/c29-22-6-2-1-5-19(22)20-9-10-23-26-25(27(35)31-13-17-7-8-17)21(16-34)24(15-33(23)28(20)36)32(26)14-18-4-3-11-30-12-18/h1-6,9-12,17,21,24-26,34H,7-8,13-16H2,(H,31,35)/t21-,24-,25+,26+/m0/s1	PGXATXJTQODNDY-DTGGKOQTSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]([C@@H]1C(=O)NCC5CC5)N2Cc6cccnc6	BroadT	BRD-K88995397	BRD-K88995397-001-01-0	Broad Institute of MIT and Harvard	BRD-K88995397			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]([C@@H]1C(=O)NCC1CC1)N2Cc1cccnc1	InChI=1S/C28H29FN4O3/c29-22-6-2-1-5-19(22)20-9-10-23-26-25(27(35)31-13-17-7-8-17)21(16-34)24(15-33(23)28(20)36)32(26)14-18-4-3-11-30-12-18/h1-6,9-12,17,21,24-26,34H,7-8,13-16H2,(H,31,35)/t21-,24-,25+,26+/m0/s1	PGXATXJTQODNDY-DTGGKOQTSA-N	488.222369028							102557
BRD-M31871110	LSM-45024		54661091	InChI=1S/C20H26F3N3O3/c1-4-5-12-6-7-15-16-13(10-26(15)18(12)28)14(11-27)17(19(29)24(2)3)25(16)9-8-20(21,22)23/h4-7,13-14,16-17,27H,8-11H2,1-3H3/t13-,14-,16+,17-/m0/s1	VAVDPECDKRRSEN-DIECFANBSA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3CCC(F)(F)F)C(=O)N(C)C	BroadT	BRD-M31871110	BRD-M31871110-001-01-5	Broad Institute of MIT and Harvard	BRD-M31871110		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N(C)C)N(CCC(F)(F)F)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N(C)C)N(CCC(F)(F)F)[C@@H]23)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N(C)C)N(CCC(F)(F)F)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N(C)C)N(CCC(F)(F)F)[C@@H]23)c1=O	InChI=1S/2C20H26F3N3O3/c2*1-4-5-12-6-7-15-16-13(10-26(15)18(12)28)14(11-27)17(19(29)24(2)3)25(16)9-8-20(21,22)23/h2*4-7,13-14,16-17,27H,8-11H2,1-3H3/b5-4+;5-4-/t2*13-,14-,16+,17-/m00/s1	CJGQOCAJLGESLC-OMBGKVETSA-N	413.192626322							103261
BRD-K52379384	LSM-11632		54661080	InChI=1S/C23H26N4O4/c28-14-15-18-13-26-17(8-6-9-19(26)29)21(20(15)23(31)25-11-4-1-5-12-25)27(18)22(30)16-7-2-3-10-24-16/h2-3,6-10,15,18,20-21,28H,1,4-5,11-14H2/t15-,18-,20+,21+/m1/s1	NNGWCWYYPXSIHJ-NXXWWENFSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)N4CCCCC4)N2C(=O)c5ccccn5	BroadT	BRD-K52379384	BRD-K52379384-001-01-4	Broad Institute of MIT and Harvard	BRD-K52379384			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)N1CCCCC1)N2C(=O)c1ccccn1	InChI=1S/C23H26N4O4/c28-14-15-18-13-26-17(8-6-9-19(26)29)21(20(15)23(31)25-11-4-1-5-12-25)27(18)22(30)16-7-2-3-10-24-16/h2-3,6-10,15,18,20-21,28H,1,4-5,11-14H2/t15-,18-,20+,21+/m1/s1	NNGWCWYYPXSIHJ-NXXWWENFSA-N	422.195405352							100257
BRD-M09121311	LSM-45002		54661285	InChI=1S/C22H26N4O3/c1-3-6-14-8-9-17-20-19(21(28)24-11-15-7-4-5-10-23-15)16(13-27)18(25(20)2)12-26(17)22(14)29/h3-10,16,18-20,27H,11-13H2,1-2H3,(H,24,28)/t16-,18-,19+,20+/m1/s1	DXALFQYFVAIBRG-LMCOJAPRSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3C)C(=O)NCc4ccccn4	BroadT	BRD-M09121311	BRD-M09121311-001-01-0	Broad Institute of MIT and Harvard	BRD-M09121311		C\C=C\c1ccc2[C@H]3[C@H]([C@H](CO)[C@@H](Cn2c1=O)N3C)C(=O)NCc1ccccn1.C\C=C/c1ccc2[C@H]3[C@H]([C@H](CO)[C@@H](Cn2c1=O)N3C)C(=O)NCc1ccccn1	C\C=C\c1ccc2[C@H]3[C@H]([C@H](CO)[C@@H](Cn2c1=O)N3C)C(=O)NCc1ccccn1.C\C=C/c1ccc2[C@H]3[C@H]([C@H](CO)[C@@H](Cn2c1=O)N3C)C(=O)NCc1ccccn1	InChI=1S/2C22H26N4O3/c2*1-3-6-14-8-9-17-20-19(21(28)24-11-15-7-4-5-10-23-15)16(13-27)18(25(20)2)12-26(17)22(14)29/h2*3-10,16,18-20,27H,11-13H2,1-2H3,(H,24,28)/b6-3+;6-3-/t2*16-,18-,19+,20+/m11/s1	IHSKUGUXVPPFMN-JTKQLSPMSA-N	394.200490732							103239
BRD-K04147035	LSM-8683		54661190	InChI=1S/C27H36N4O5/c1-5-23(33)31-24-19(20(16-32)25(31)26(34)28-13-8-14-29(2)3)15-30-21(24)12-11-18(27(30)35)17-9-6-7-10-22(17)36-4/h6-7,9-12,19-20,24-25,32H,5,8,13-16H2,1-4H3,(H,28,34)/t19-,20-,24+,25-/m1/s1	GDXCTQXPLLMICC-KYXKYNKESA-N	CCC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@@H]12)C(=O)NCCCN(C)C	BroadT	BRD-K04147035	BRD-K04147035-001-01-7	Broad Institute of MIT and Harvard	BRD-K04147035			CCC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@@H]12)C(=O)NCCCN(C)C	InChI=1S/C27H36N4O5/c1-5-23(33)31-24-19(20(16-32)25(31)26(34)28-13-8-14-29(2)3)15-30-21(24)12-11-18(27(30)35)17-9-6-7-10-22(17)36-4/h6-7,9-12,19-20,24-25,32H,5,8,13-16H2,1-4H3,(H,28,34)/t19-,20-,24+,25-/m1/s1	GDXCTQXPLLMICC-KYXKYNKESA-N	496.268570292							97304
BRD-K02602944	LSM-8600		54661414	InChI=1S/C21H32N4O3/c1-23(2)10-4-9-22-21(28)19-15(13-26)17-12-24-16(5-3-6-18(24)27)20(19)25(17)11-14-7-8-14/h3,5-6,14-15,17,19-20,26H,4,7-13H2,1-2H3,(H,22,28)/t15-,17-,19+,20+/m1/s1	FYGCWFQCJMSVAD-BEKAIBRUSA-N	CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]1N2CC4CC4	BroadT	BRD-K02602944	BRD-K02602944-001-01-3	Broad Institute of MIT and Harvard	BRD-K02602944			CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2CC1CC1	InChI=1S/C21H32N4O3/c1-23(2)10-4-9-22-21(28)19-15(13-26)17-12-24-16(5-3-6-18(24)27)20(19)25(17)11-14-7-8-14/h3,5-6,14-15,17,19-20,26H,4,7-13H2,1-2H3,(H,22,28)/t15-,17-,19+,20+/m1/s1	FYGCWFQCJMSVAD-BEKAIBRUSA-N	388.247440924							97221
BRD-K93666423	LSM-14170		54661350	InChI=1S/C25H28N4O4/c30-13-18-20-12-28-19(8-7-17(25(28)33)16-2-1-9-26-11-16)22(29(20)24(32)15-5-6-15)21(18)23(31)27-10-14-3-4-14/h1-2,7-9,11,14-15,18,20-22,30H,3-6,10,12-13H2,(H,27,31)/t18-,20-,21+,22+/m0/s1	YVZLAXVGGRSZTP-VXSCBNMQSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]([C@@H]1C(=O)NCC5CC5)N2C(=O)C6CC6	BroadT	BRD-K93666423	BRD-K93666423-001-01-8	Broad Institute of MIT and Harvard	BRD-K93666423			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]([C@@H]1C(=O)NCC1CC1)N2C(=O)C1CC1	InChI=1S/C25H28N4O4/c30-13-18-20-12-28-19(8-7-17(25(28)33)16-2-1-9-26-11-16)22(29(20)24(32)15-5-6-15)21(18)23(31)27-10-14-3-4-14/h1-2,7-9,11,14-15,18,20-22,30H,3-6,10,12-13H2,(H,27,31)/t18-,20-,21+,22+/m0/s1	YVZLAXVGGRSZTP-VXSCBNMQSA-N	448.211055416							102824
BRD-K65160163	LSM-12405		54661176	InChI=1S/C20H22FN3O3/c1-23(2)20(27)18-15(10-25)14-9-24-16(17(14)22-18)8-7-13(19(24)26)11-3-5-12(21)6-4-11/h3-8,14-15,17-18,22,25H,9-10H2,1-2H3/t14-,15-,17+,18-/m0/s1	HRNJAQRGDGXKJI-ONIAQPFYSA-N	CN(C)C(=O)[C@H]1N[C@@H]2[C@@H](CN3C2=CC=C(C3=O)c4ccc(F)cc4)[C@@H]1CO	BroadT	BRD-K65160163	BRD-K65160163-001-01-0	Broad Institute of MIT and Harvard	BRD-K65160163			CN(C)C(=O)[C@H]1N[C@@H]2[C@@H](Cn3c2ccc(-c2ccc(F)cc2)c3=O)[C@@H]1CO	InChI=1S/C20H22FN3O3/c1-23(2)20(27)18-15(10-25)14-9-24-16(17(14)22-18)8-7-13(19(24)26)11-3-5-12(21)6-4-11/h3-8,14-15,17-18,22,25H,9-10H2,1-2H3/t14-,15-,17+,18-/m0/s1	HRNJAQRGDGXKJI-ONIAQPFYSA-N	371.164519794							101032
BRD-K34553907	LSM-10514		54661411	InChI=1S/C26H30N4O4/c1-28(2)25(33)22-19(15-31)21-14-29-20(13-12-18(24(29)32)16-8-6-7-9-16)23(22)30(21)26(34)27-17-10-4-3-5-11-17/h3-5,8,10-13,19,21-23,31H,6-7,9,14-15H2,1-2H3,(H,27,34)/t19-,21-,22+,23+/m1/s1	HXGRDUONOGFVHC-LGKPFJOYSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@@H]1N2C(=O)Nc5ccccc5	BroadT	BRD-K34553907	BRD-K34553907-001-01-5	Broad Institute of MIT and Harvard	BRD-K34553907			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]1N2C(=O)Nc1ccccc1	InChI=1S/C26H30N4O4/c1-28(2)25(33)22-19(15-31)21-14-29-20(13-12-18(24(29)32)16-8-6-7-9-16)23(22)30(21)26(34)27-17-10-4-3-5-11-17/h3-5,8,10-13,19,21-23,31H,6-7,9,14-15H2,1-2H3,(H,27,34)/t19-,21-,22+,23+/m1/s1	HXGRDUONOGFVHC-LGKPFJOYSA-N	462.22670548							99135
BRD-K49178877	LSM-11419		54661301	InChI=1S/C23H26F3N3O3/c1-2-27-21(31)19-16(13-30)18-12-29-17(20(19)28(18)11-10-23(24,25)26)9-8-15(22(29)32)14-6-4-3-5-7-14/h3-9,16,18-20,30H,2,10-13H2,1H3,(H,27,31)/t16-,18-,19+,20+/m1/s1	KIAQQOUXENLKMW-LMCOJAPRSA-N	CCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@@H]1N2CCC(F)(F)F	BroadT	BRD-K49178877	BRD-K49178877-001-01-0	Broad Institute of MIT and Harvard	BRD-K49178877			CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]1N2CCC(F)(F)F	InChI=1S/C23H26F3N3O3/c1-2-27-21(31)19-16(13-30)18-12-29-17(20(19)28(18)11-10-23(24,25)26)9-8-15(22(29)32)14-6-4-3-5-7-14/h3-9,16,18-20,30H,2,10-13H2,1H3,(H,27,31)/t16-,18-,19+,20+/m1/s1	KIAQQOUXENLKMW-LMCOJAPRSA-N	449.192626322							100040
BRD-K74530260	LSM-12992		54661086	InChI=1S/C29H32N4O4/c1-32(2)28(36)20-10-8-19(9-11-20)21-12-13-24-25-22(16-33(24)29(21)37)23(17-34)26(31-25)27(35)30-15-14-18-6-4-3-5-7-18/h3-13,22-23,25-26,31,34H,14-17H2,1-2H3,(H,30,35)/t22-,23-,25+,26-/m1/s1	HHBAGBOVOCHPKM-VHCQPULKSA-N	CN(C)C(=O)c1ccc(cc1)C2=CC=C3[C@H]4N[C@H]([C@H](CO)[C@H]4CN3C2=O)C(=O)NCCc5ccccc5	BroadT	BRD-K74530260	BRD-K74530260-001-01-5	Broad Institute of MIT and Harvard	BRD-K74530260			CN(C)C(=O)c1ccc(cc1)-c1ccc2[C@H]3N[C@H]([C@H](CO)[C@H]3Cn2c1=O)C(=O)NCCc1ccccc1	InChI=1S/C29H32N4O4/c1-32(2)28(36)20-10-8-19(9-11-20)21-12-13-24-25-22(16-33(24)29(21)37)23(17-34)26(31-25)27(35)30-15-14-18-6-4-3-5-7-18/h3-13,22-23,25-26,31,34H,14-17H2,1-2H3,(H,30,35)/t22-,23-,25+,26-/m1/s1	HHBAGBOVOCHPKM-VHCQPULKSA-N	500.242355544							101629
BRD-K09880340	LSM-9036		54661238	InChI=1S/C23H26FN3O3/c1-26-19-11-27-18(10-9-16(23(27)30)13-5-7-14(24)8-6-13)21(26)20(17(19)12-28)22(29)25-15-3-2-4-15/h5-10,15,17,19-21,28H,2-4,11-12H2,1H3,(H,25,29)/t17-,19-,20+,21+/m0/s1	JCKMTOKPWGTWPB-MJUUVYJYSA-N	CN1[C@H]2CN3C(=O)C(=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)NC4CCC4)c5ccc(F)cc5	BroadT	BRD-K09880340	BRD-K09880340-001-01-8	Broad Institute of MIT and Harvard	BRD-K09880340			CN1[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NC1CCC1	InChI=1S/C23H26FN3O3/c1-26-19-11-27-18(10-9-16(23(27)30)13-5-7-14(24)8-6-13)21(26)20(17(19)12-28)22(29)25-15-3-2-4-15/h5-10,15,17,19-21,28H,2-4,11-12H2,1H3,(H,25,29)/t17-,19-,20+,21+/m0/s1	JCKMTOKPWGTWPB-MJUUVYJYSA-N	411.195819922							97657
BRD-K05717370	LSM-8765		54661243	InChI=1S/C21H25N5O3/c27-11-16-15-10-25-17(2-1-3-18(25)28)19(15)26(9-14-6-22-12-23-7-14)20(16)21(29)24-8-13-4-5-13/h1-3,6-7,12-13,15-16,19-20,27H,4-5,8-11H2,(H,24,29)/t15-,16-,19+,20-/m1/s1	RTAKVDRHOCSOCY-YAJHFMINSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N(Cc4cncnc4)[C@H]1C(=O)NCC5CC5	BroadT	BRD-K05717370	BRD-K05717370-001-01-9	Broad Institute of MIT and Harvard	BRD-K05717370			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N(Cc2cncnc2)[C@H]1C(=O)NCC1CC1	InChI=1S/C21H25N5O3/c27-11-16-15-10-25-17(2-1-3-18(25)28)19(15)26(9-14-6-22-12-23-7-14)20(16)21(29)24-8-13-4-5-13/h1-3,6-7,12-13,15-16,19-20,27H,4-5,8-11H2,(H,24,29)/t15-,16-,19+,20-/m1/s1	RTAKVDRHOCSOCY-YAJHFMINSA-N	395.19573971							97386
BRD-K45466167	LSM-11199		54661060	InChI=1S/C23H26ClN3O4/c24-16-4-1-3-15(11-16)12-27-19-13-26-18(5-2-6-20(26)29)22(27)21(17(19)14-28)23(30)25-7-9-31-10-8-25/h1-6,11,17,19,21-22,28H,7-10,12-14H2/t17-,19-,21+,22+/m1/s1	JHNJYMNWNCZPKL-IVOMFYJKSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)N4CCOCC4)N2Cc5cccc(Cl)c5	BroadT	BRD-K45466167	BRD-K45466167-001-01-2	Broad Institute of MIT and Harvard	BRD-K45466167			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)N1CCOCC1)N2Cc1cccc(Cl)c1	InChI=1S/C23H26ClN3O4/c24-16-4-1-3-15(11-16)12-27-19-13-26-18(5-2-6-20(26)29)22(27)21(17(19)14-28)23(30)25-7-9-31-10-8-25/h1-6,11,17,19,21-22,28H,7-10,12-14H2/t17-,19-,21+,22+/m1/s1	JHNJYMNWNCZPKL-IVOMFYJKSA-N	443.161184052							99820
BRD-K49299173	LSM-11427		54661297	InChI=1S/C21H23N3O3/c25-12-15-16-11-24-17(6-3-7-18(24)26)20(22-16)19(15)21(27)23-9-8-13-4-1-2-5-14(13)10-23/h1-7,15-16,19-20,22,25H,8-12H2/t15-,16-,19+,20+/m0/s1	WCVQZBWBNHVCOB-XAMWDVODSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H](N2)[C@@H]1C(=O)N4CCc5ccccc5C4	BroadT	BRD-K49299173	BRD-K49299173-001-01-5	Broad Institute of MIT and Harvard	BRD-K49299173			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H](N2)[C@@H]1C(=O)N1CCc2ccccc2C1	InChI=1S/C21H23N3O3/c25-12-15-16-11-24-17(6-3-7-18(24)26)20(22-16)19(15)21(27)23-9-8-13-4-1-2-5-14(13)10-23/h1-7,15-16,19-20,22,25H,8-12H2/t15-,16-,19+,20+/m0/s1	WCVQZBWBNHVCOB-XAMWDVODSA-N	365.173941626							100048
BRD-K21216453	LSM-9719		54661236	InChI=1S/C27H28N2O5/c1-33-23-11-7-6-10-18(23)19-12-13-21-25-24(27(32)34-2)20(16-30)22(15-29(21)26(19)31)28(25)14-17-8-4-3-5-9-17/h3-13,20,22,24-25,30H,14-16H2,1-2H3/t20-,22-,24+,25+/m0/s1	VLQJEDUGSYPRCL-MMTHZHQFSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@H]1N2Cc5ccccc5	BroadT	BRD-K21216453	BRD-K21216453-001-01-2	Broad Institute of MIT and Harvard	BRD-K21216453			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@H]1N2Cc1ccccc1	InChI=1S/C27H28N2O5/c1-33-23-11-7-6-10-18(23)19-12-13-21-25-24(27(32)34-2)20(16-30)22(15-29(21)26(19)31)28(25)14-17-8-4-3-5-9-17/h3-13,20,22,24-25,30H,14-16H2,1-2H3/t20-,22-,24+,25+/m0/s1	VLQJEDUGSYPRCL-MMTHZHQFSA-N	460.199822016							98340
BRD-K65729053	LSM-12432		54661145	InChI=1S/C24H20F2N4O5/c25-13-3-5-16(26)17(8-13)28-24(35)30-19-10-29-18(21(30)20(23(33)34)15(19)11-31)6-4-14(22(29)32)12-2-1-7-27-9-12/h1-9,15,19-21,31H,10-11H2,(H,28,35)(H,33,34)/t15-,19-,20+,21+/m0/s1	VFFJPMQBAVMOHZ-JWOSDPRPSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]([C@@H]1C(=O)O)N2C(=O)Nc5cc(F)ccc5F	BroadT	BRD-K65729053	BRD-K65729053-001-01-5	Broad Institute of MIT and Harvard	BRD-K65729053			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]([C@@H]1C(O)=O)N2C(=O)Nc1cc(F)ccc1F	InChI=1S/C24H20F2N4O5/c25-13-3-5-16(26)17(8-13)28-24(35)30-19-10-29-18(21(30)20(23(33)34)15(19)11-31)6-4-14(22(29)32)12-2-1-7-27-9-12/h1-9,15,19-21,31H,10-11H2,(H,28,35)(H,33,34)/t15-,19-,20+,21+/m0/s1	VFFJPMQBAVMOHZ-JWOSDPRPSA-N	482.14017618							101059
BRD-K37451830	LSM-10691		54661444	InChI=1S/C22H29N3O3/c26-12-17-16-11-25-18(9-8-15(22(25)28)14-4-2-1-3-5-14)19(16)24-20(17)21(27)23-10-13-6-7-13/h4,8-9,13,16-17,19-20,24,26H,1-3,5-7,10-12H2,(H,23,27)/t16-,17-,19+,20-/m1/s1	GFSIQHCCTSVNND-IZBJGVDFSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H]2N[C@H]1C(=O)NCC4CC4)C5=CCCCC5	BroadT	BRD-K37451830	BRD-K37451830-001-01-1	Broad Institute of MIT and Harvard	BRD-K37451830			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]2N[C@H]1C(=O)NCC1CC1	InChI=1S/C22H29N3O3/c26-12-17-16-11-25-18(9-8-15(22(25)28)14-4-2-1-3-5-14)19(16)24-20(17)21(27)23-10-13-6-7-13/h4,8-9,13,16-17,19-20,24,26H,1-3,5-7,10-12H2,(H,23,27)/t16-,17-,19+,20-/m1/s1	GFSIQHCCTSVNND-IZBJGVDFSA-N	383.220891818							99312
BRD-K50949213	LSM-11537		54661403	InChI=1S/C25H32N6O3/c1-28-6-8-29(9-7-28)25(34)23-20(14-32)19-13-30-21(22(19)31(23)12-16-2-3-16)5-4-18(24(30)33)17-10-26-15-27-11-17/h4-5,10-11,15-16,19-20,22-23,32H,2-3,6-9,12-14H2,1H3/t19-,20-,22+,23-/m0/s1	NKEKVCULWNFMKR-RLBLXZPPSA-N	CN1CCN(CC1)C(=O)[C@@H]2[C@@H](CO)[C@@H]3CN4C(=CC=C(C4=O)c5cncnc5)[C@@H]3N2CC6CC6	BroadT	BRD-K50949213	BRD-K50949213-001-01-3	Broad Institute of MIT and Harvard	BRD-K50949213			CN1CCN(CC1)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@@H]2N1CC1CC1	InChI=1S/C25H32N6O3/c1-28-6-8-29(9-7-28)25(34)23-20(14-32)19-13-30-21(22(19)31(23)12-16-2-3-16)5-4-18(24(30)33)17-10-26-15-27-11-17/h4-5,10-11,15-16,19-20,22-23,32H,2-3,6-9,12-14H2,1H3/t19-,20-,22+,23-/m0/s1	NKEKVCULWNFMKR-RLBLXZPPSA-N	464.253588944							100160
BRD-K55106539	LSM-11769		54661413	InChI=1S/C24H25FN2O5/c1-32-24(31)21-18(12-28)17-11-26-19(20(17)27(21)22(29)14-3-2-4-14)10-9-16(23(26)30)13-5-7-15(25)8-6-13/h5-10,14,17-18,20-21,28H,2-4,11-12H2,1H3/t17-,18-,20+,21-/m0/s1	YQHVQTZYSLOMSV-MMKMLUHNSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]2N1C(=O)C5CCC5	BroadT	BRD-K55106539	BRD-K55106539-001-01-2	Broad Institute of MIT and Harvard	BRD-K55106539			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@@H]2N1C(=O)C1CCC1)-c1ccc(F)cc1	InChI=1S/C24H25FN2O5/c1-32-24(31)21-18(12-28)17-11-26-19(20(17)27(21)22(29)14-3-2-4-14)10-9-16(23(26)30)13-5-7-15(25)8-6-13/h5-10,14,17-18,20-21,28H,2-4,11-12H2,1H3/t17-,18-,20+,21-/m0/s1	YQHVQTZYSLOMSV-MMKMLUHNSA-N	440.17475012							100394
BRD-K05643885	LSM-8759		54661234	InChI=1S/C25H30N4O4/c30-15-18-20-14-28-19(9-4-10-21(28)31)23(29(20)25(33)17-8-5-11-26-13-17)22(18)24(32)27-12-16-6-2-1-3-7-16/h4-5,8-11,13,16,18,20,22-23,30H,1-3,6-7,12,14-15H2,(H,27,32)/t18-,20-,22+,23+/m0/s1	CJMOIVLGTXOFHT-NEKRIBJYSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)NCC4CCCCC4)N2C(=O)c5cccnc5	BroadT	BRD-K05643885	BRD-K05643885-001-01-5	Broad Institute of MIT and Harvard	BRD-K05643885			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NCC1CCCCC1)N2C(=O)c1cccnc1	InChI=1S/C25H30N4O4/c30-15-18-20-14-28-19(9-4-10-21(28)31)23(29(20)25(33)17-8-5-11-26-13-17)22(18)24(32)27-12-16-6-2-1-3-7-16/h4-5,8-11,13,16,18,20,22-23,30H,1-3,6-7,12,14-15H2,(H,27,32)/t18-,20-,22+,23+/m0/s1	CJMOIVLGTXOFHT-NEKRIBJYSA-N	450.22670548							97380
MLS005000170	LSM-13945	BRD-K89507938	54661059	InChI=1S/C23H26ClN3O4/c24-16-4-1-3-15(11-16)12-27-19-13-26-18(5-2-6-20(26)29)22(27)21(17(19)14-28)23(30)25-7-9-31-10-8-25/h1-6,11,17,19,21-22,28H,7-10,12-14H2/t17-,19-,21+,22+/m0/s1	JHNJYMNWNCZPKL-HVJHZFLKSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)N4CCOCC4)N2Cc5cccc(Cl)c5	BroadT	BRD-K89507938	BRD-K89507938-001-01-8	Broad Institute of MIT and Harvard	BRD-K89507938			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)N1CCOCC1)N2Cc1cccc(Cl)c1	InChI=1S/C23H26ClN3O4/c24-16-4-1-3-15(11-16)12-27-19-13-26-18(5-2-6-20(26)29)22(27)21(17(19)14-28)23(30)25-7-9-31-10-8-25/h1-6,11,17,19,21-22,28H,7-10,12-14H2/t17-,19-,21+,22+/m0/s1	JHNJYMNWNCZPKL-HVJHZFLKSA-N	443.161184052							102598
BRD-K43036943	LSM-11045		54661149	InChI=1S/C26H28N4O3/c31-17-20-22-16-29-21(10-6-11-23(29)32)25(30(22)15-19-9-4-5-13-27-19)24(20)26(33)28-14-12-18-7-2-1-3-8-18/h1-11,13,20,22,24-25,31H,12,14-17H2,(H,28,33)/t20-,22-,24+,25+/m0/s1	ZMVBPFYUTZNCSY-MMTHZHQFSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)NCCc4ccccc4)N2Cc5ccccn5	BroadT	BRD-K43036943	BRD-K43036943-001-01-6	Broad Institute of MIT and Harvard	BRD-K43036943			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NCCc1ccccc1)N2Cc1ccccn1	InChI=1S/C26H28N4O3/c31-17-20-22-16-29-21(10-6-11-23(29)32)25(30(22)15-19-9-4-5-13-27-19)24(20)26(33)28-14-12-18-7-2-1-3-8-18/h1-11,13,20,22,24-25,31H,12,14-17H2,(H,28,33)/t20-,22-,24+,25+/m0/s1	ZMVBPFYUTZNCSY-MMTHZHQFSA-N	444.216140796							99666
BRD-K10701104	LSM-9075		54661303	InChI=1S/C26H28N4O3/c1-29-22-15-30-21(10-9-19(26(30)33)18-8-5-12-27-14-18)24(29)23(20(22)16-31)25(32)28-13-11-17-6-3-2-4-7-17/h2-10,12,14,20,22-24,31H,11,13,15-16H2,1H3,(H,28,32)/t20-,22-,23+,24+/m1/s1	MSLHGMMBDZHUMV-AZOUXBGGSA-N	CN1[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCc5ccccc5	BroadT	BRD-K10701104	BRD-K10701104-001-01-9	Broad Institute of MIT and Harvard	BRD-K10701104			CN1[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCc1ccccc1	InChI=1S/C26H28N4O3/c1-29-22-15-30-21(10-9-19(26(30)33)18-8-5-12-27-14-18)24(29)23(20(22)16-31)25(32)28-13-11-17-6-3-2-4-7-17/h2-10,12,14,20,22-24,31H,11,13,15-16H2,1H3,(H,28,32)/t20-,22-,23+,24+/m1/s1	MSLHGMMBDZHUMV-AZOUXBGGSA-N	444.216140796							97696
BRD-K20827972	LSM-9698		54661407	InChI=1S/C28H33N3O4/c1-17(19-9-5-3-6-10-19)29-27(34)25-22(16-32)24-15-30-23(26(25)31(24)18(2)33)14-13-21(28(30)35)20-11-7-4-8-12-20/h3,5-6,9-11,13-14,17,22,24-26,32H,4,7-8,12,15-16H2,1-2H3,(H,29,34)/t17-,22+,24+,25-,26-/m0/s1	GHJDVSDORYSUSR-DTDUXPSVSA-N	C[C@H](NC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C4=CCCCC4)C3=O)[C@@H]1N2C(=O)C)c5ccccc5	BroadT	BRD-K20827972	BRD-K20827972-001-01-9	Broad Institute of MIT and Harvard	BRD-K20827972			C[C@H](NC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]1N2C(C)=O)c1ccccc1	InChI=1S/C28H33N3O4/c1-17(19-9-5-3-6-10-19)29-27(34)25-22(16-32)24-15-30-23(26(25)31(24)18(2)33)14-13-21(28(30)35)20-11-7-4-8-12-20/h3,5-6,9-11,13-14,17,22,24-26,32H,4,7-8,12,15-16H2,1-2H3,(H,29,34)/t17-,22+,24+,25-,26-/m0/s1	GHJDVSDORYSUSR-DTDUXPSVSA-N	475.247106566							98319
BRD-K76991985	LSM-13139		54661083	InChI=1S/C28H29FN4O3/c29-18-9-7-17(8-10-18)21-11-12-24-25-22(15-32(24)28(21)36)23(16-34)26(27(35)31-19-5-3-6-19)33(25)14-20-4-1-2-13-30-20/h1-2,4,7-13,19,22-23,25-26,34H,3,5-6,14-16H2,(H,31,35)/t22-,23-,25+,26-/m0/s1	GFQXIANWUUUKJA-LJCOXQHRSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]2N(Cc5ccccn5)[C@@H]1C(=O)NC6CCC6	BroadT	BRD-K76991985	BRD-K76991985-001-01-1	Broad Institute of MIT and Harvard	BRD-K76991985			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]2N(Cc2ccccn2)[C@@H]1C(=O)NC1CCC1	InChI=1S/C28H29FN4O3/c29-18-9-7-17(8-10-18)21-11-12-24-25-22(15-32(24)28(21)36)23(16-34)26(27(35)31-19-5-3-6-19)33(25)14-20-4-1-2-13-30-20/h1-2,4,7-13,19,22-23,25-26,34H,3,5-6,14-16H2,(H,31,35)/t22-,23-,25+,26-/m0/s1	GFQXIANWUUUKJA-LJCOXQHRSA-N	488.222369028							101777
BRD-K56325098	LSM-11835		54661088	InChI=1S/C25H37N5O5/c31-16-18-20-15-29-19(7-3-8-21(29)32)23(30(20)25(34)27-17-5-1-2-6-17)22(18)24(33)26-9-4-10-28-11-13-35-14-12-28/h3,7-8,17-18,20,22-23,31H,1-2,4-6,9-16H2,(H,26,33)(H,27,34)/t18-,20-,22+,23+/m0/s1	RTKWEIPARALZJI-NEKRIBJYSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)NCCCN4CCOCC4)N2C(=O)NC5CCCC5	BroadT	BRD-K56325098	BRD-K56325098-001-01-0	Broad Institute of MIT and Harvard	BRD-K56325098			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NCCCN1CCOCC1)N2C(=O)NC1CCCC1	InChI=1S/C25H37N5O5/c31-16-18-20-15-29-19(7-3-8-21(29)32)23(30(20)25(34)27-17-5-1-2-6-17)22(18)24(33)26-9-4-10-28-11-13-35-14-12-28/h3,7-8,17-18,20,22-23,31H,1-2,4-6,9-16H2,(H,26,33)(H,27,34)/t18-,20-,22+,23+/m0/s1	RTKWEIPARALZJI-NEKRIBJYSA-N	487.279469334							100460
BRD-K69493165	LSM-12667		54661169	InChI=1S/C25H23FN2O4/c26-20-9-5-4-8-16(20)12-28-22-18(19(14-29)23(28)25(31)32)13-27-21(22)11-10-17(24(27)30)15-6-2-1-3-7-15/h1-11,18-19,22-23,29H,12-14H2,(H,31,32)/t18-,19-,22+,23-/m0/s1	CTVHZJUSZJAUDM-LBVMUVSTSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@@H]2N(Cc5ccccc5F)[C@@H]1C(=O)O	BroadT	BRD-K69493165	BRD-K69493165-001-01-9	Broad Institute of MIT and Harvard	BRD-K69493165			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]2N(Cc2ccccc2F)[C@@H]1C(O)=O	InChI=1S/C25H23FN2O4/c26-20-9-5-4-8-16(20)12-28-22-18(19(14-29)23(28)25(31)32)13-27-21(22)11-10-17(24(27)30)15-6-2-1-3-7-15/h1-11,18-19,22-23,29H,12-14H2,(H,31,32)/t18-,19-,22+,23-/m0/s1	CTVHZJUSZJAUDM-LBVMUVSTSA-N	434.164185436							101301
BRD-K01798544	LSM-8546		54661208	InChI=1S/C28H27N5O4/c34-15-23-22-14-32-24(9-8-21(28(32)36)19-7-4-10-29-12-19)25(22)33(13-20-16-37-17-31-20)26(23)27(35)30-11-18-5-2-1-3-6-18/h1-10,12,16-17,22-23,25-26,34H,11,13-15H2,(H,30,35)/t22-,23-,25+,26-/m1/s1	FQHAKQIPMBJGGK-VHCQPULKSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]2N(Cc5cocn5)[C@H]1C(=O)NCc6ccccc6	BroadT	BRD-K01798544	BRD-K01798544-001-01-4	Broad Institute of MIT and Harvard	BRD-K01798544			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]2N(Cc2cocn2)[C@H]1C(=O)NCc1ccccc1	InChI=1S/C28H27N5O4/c34-15-23-22-14-32-24(9-8-21(28(32)36)19-7-4-10-29-12-19)25(22)33(13-20-16-37-17-31-20)26(23)27(35)30-11-18-5-2-1-3-6-18/h1-10,12,16-17,22-23,25-26,34H,11,13-15H2,(H,30,35)/t22-,23-,25+,26-/m1/s1	FQHAKQIPMBJGGK-VHCQPULKSA-N	497.206304394							97167
BRD-K84307821	LSM-13582		54661081	InChI=1S/C28H34FN3O4/c29-20-3-1-2-19(12-20)21-6-7-24-25-22(15-31(24)28(21)35)23(16-33)26(27(34)30-13-17-4-5-17)32(25)14-18-8-10-36-11-9-18/h1-3,6-7,12,17-18,22-23,25-26,33H,4-5,8-11,13-16H2,(H,30,34)/t22-,23-,25+,26-/m1/s1	QQHZYPMPDOLVNZ-VHCQPULKSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H]2N(CC4CCOCC4)[C@H]1C(=O)NCC5CC5)c6cccc(F)c6	BroadT	BRD-K84307821	BRD-K84307821-001-01-8	Broad Institute of MIT and Harvard	BRD-K84307821			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]2N(CC2CCOCC2)[C@H]1C(=O)NCC1CC1	InChI=1S/C28H34FN3O4/c29-20-3-1-2-19(12-20)21-6-7-24-25-22(15-31(24)28(21)35)23(16-33)26(27(34)30-13-17-4-5-17)32(25)14-18-8-10-36-11-9-18/h1-3,6-7,12,17-18,22-23,25-26,33H,4-5,8-11,13-16H2,(H,30,34)/t22-,23-,25+,26-/m1/s1	QQHZYPMPDOLVNZ-VHCQPULKSA-N	495.253334798							102226
BRD-M90541854	LSM-45079		54661421	InChI=1S/C26H31N3O3/c1-3-7-18-10-11-21-24-23(20(16-30)22(28(24)4-2)15-29(21)25(18)31)26(32)27-13-12-17-8-5-6-9-19(17)14-27/h3,5-11,20,22-24,30H,4,12-16H2,1-2H3/t20-,22-,23+,24+/m1/s1	SCCGZMIGIRUPAJ-AZOUXBGGSA-N	CCN1[C@@H]2CN3C(=CC=C(C=CC)C3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N4CCc5ccccc5C4	BroadT	BRD-M90541854	BRD-M90541854-001-01-2	Broad Institute of MIT and Harvard	BRD-M90541854		CCN1[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N1CCc2ccccc2C1.CCN1[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N1CCc2ccccc2C1	CCN1[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N1CCc2ccccc2C1.CCN1[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N1CCc2ccccc2C1	InChI=1S/2C26H31N3O3/c2*1-3-7-18-10-11-21-24-23(20(16-30)22(28(24)4-2)15-29(21)25(18)31)26(32)27-13-12-17-8-5-6-9-19(17)14-27/h2*3,5-11,20,22-24,30H,4,12-16H2,1-2H3/b7-3+;7-3-/t2*20-,22-,23+,24+/m11/s1	RTSTWBAHJBYZDW-VTQDNXMLSA-N	433.236541882							103316
BRD-K14437503	LSM-43452		54661391	InChI=1S/C25H29N3O3/c29-16-20-19-15-28-21(22(19)26-23(20)25(31)27-13-5-2-6-14-27)12-11-18(24(28)30)10-9-17-7-3-1-4-8-17/h1,3-4,7-12,19-20,22-23,26,29H,2,5-6,13-16H2/b10-9+/t19-,20-,22+,23-/m0/s1	XTBUFSZDYWNFLD-RDVACDIASA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N[C@@H]1C(=O)N4CCCCC4)\C=C\c5ccccc5	BroadT	BRD-K14437503	BRD-K14437503-001-01-3	Broad Institute of MIT and Harvard	BRD-K14437503			OC[C@H]1[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]2N[C@@H]1C(=O)N1CCCCC1	InChI=1S/C25H29N3O3/c29-16-20-19-15-28-21(22(19)26-23(20)25(31)27-13-5-2-6-14-27)12-11-18(24(28)30)10-9-17-7-3-1-4-8-17/h1,3-4,7-12,19-20,22-23,26,29H,2,5-6,13-16H2/b10-9+/t19-,20-,22+,23-/m0/s1	XTBUFSZDYWNFLD-RDVACDIASA-N	419.220891818							
BRD-M56188090	LSM-45048		54661351	InChI=1S/C23H27N3O4/c1-3-5-15-8-9-19-20-17(12-26(19)23(15)29)18(13-27)21(25-20)22(28)24-11-14-6-4-7-16(10-14)30-2/h3-10,17-18,20-21,25,27H,11-13H2,1-2H3,(H,24,28)/t17-,18-,20+,21-/m1/s1	NWTIRCSUWOGELC-RMVXJAJNSA-N	COc1cccc(CNC(=O)[C@@H]2N[C@H]3[C@H](CN4C(=O)C(=CC=C34)C=CC)[C@H]2CO)c1	BroadT	BRD-M56188090	BRD-M56188090-001-01-8	Broad Institute of MIT and Harvard	BRD-M56188090		COc1cccc(CNC(=O)[C@@H]2N[C@H]3[C@H](Cn4c3ccc(\C=C\C)c4=O)[C@H]2CO)c1.COc1cccc(CNC(=O)[C@@H]2N[C@H]3[C@H](Cn4c3ccc(\C=C/C)c4=O)[C@H]2CO)c1	COc1cccc(CNC(=O)[C@@H]2N[C@H]3[C@H](Cn4c3ccc(\C=C\C)c4=O)[C@H]2CO)c1.COc1cccc(CNC(=O)[C@@H]2N[C@H]3[C@H](Cn4c3ccc(\C=C/C)c4=O)[C@H]2CO)c1	InChI=1S/2C23H27N3O4/c2*1-3-5-15-8-9-19-20-17(12-26(19)23(15)29)18(13-27)21(25-20)22(28)24-11-14-6-4-7-16(10-14)30-2/h2*3-10,17-18,20-21,25,27H,11-13H2,1-2H3,(H,24,28)/b5-3+;5-3-/t2*17-,18-,20+,21-/m11/s1	GZTMFBFGJVKLKE-SWBCVRAPSA-N	409.200156374							103285
BRD-K40425733	LSM-10894		54661108	InChI=1S/C22H26FN3O6S/c1-32-10-9-24-21(28)19-15(12-27)18-11-25-17(20(19)26(18)33(2,30)31)8-7-14(22(25)29)13-5-3-4-6-16(13)23/h3-8,15,18-20,27H,9-12H2,1-2H3,(H,24,28)/t15-,18-,19+,20+/m0/s1	YXSNWGVIGBSYFO-KCUHQSDYSA-N	COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]1N2S(=O)(=O)C	BroadT	BRD-K40425733	BRD-K40425733-001-01-8	Broad Institute of MIT and Harvard	BRD-K40425733			COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]1N2S(C)(=O)=O	InChI=1S/C22H26FN3O6S/c1-32-10-9-24-21(28)19-15(12-27)18-11-25-17(20(19)26(18)33(2,30)31)8-7-14(22(25)29)13-5-3-4-6-16(13)23/h3-8,15,18-20,27H,9-12H2,1-2H3,(H,24,28)/t15-,18-,19+,20+/m0/s1	YXSNWGVIGBSYFO-KCUHQSDYSA-N	479.152634472							99515
BRD-K85656047	LSM-43498		54661063	InChI=1S/C27H30N2O5/c1-34-27(33)24-21(16-30)20-15-28-22(23(20)29(24)26(32)18-9-5-6-10-18)14-13-19(25(28)31)12-11-17-7-3-2-4-8-17/h2-4,7-8,11-14,18,20-21,23-24,30H,5-6,9-10,15-16H2,1H3/b12-11+/t20-,21-,23+,24-/m1/s1	SPQKGDIXEATJCL-XDEPJRTOSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@H]2N1C(=O)C5CCCC5	BroadT	BRD-K85656047	BRD-K85656047-001-01-5	Broad Institute of MIT and Harvard	BRD-K85656047			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]2N1C(=O)C1CCCC1	InChI=1S/C27H30N2O5/c1-34-27(33)24-21(16-30)20-15-28-22(23(20)29(24)26(32)18-9-5-6-10-18)14-13-19(25(28)31)12-11-17-7-3-2-4-8-17/h2-4,7-8,11-14,18,20-21,23-24,30H,5-6,9-10,15-16H2,1H3/b12-11+/t20-,21-,23+,24-/m1/s1	SPQKGDIXEATJCL-XDEPJRTOSA-N	462.21547208							
BRD-K24680618	LSM-9926		54661049	InChI=1S/C23H29N3O4/c1-2-24-21(28)20-17(12-27)16-11-25-18(19(16)26(20)22(29)14-7-8-14)10-9-15(23(25)30)13-5-3-4-6-13/h5,9-10,14,16-17,19-20,27H,2-4,6-8,11-12H2,1H3,(H,24,28)/t16-,17-,19+,20-/m1/s1	NWUADCREYHZISA-IZBJGVDFSA-N	CCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@H]2N1C(=O)C4CC4)C5=CCCC5	BroadT	BRD-K24680618	BRD-K24680618-001-01-8	Broad Institute of MIT and Harvard	BRD-K24680618			CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]2N1C(=O)C1CC1	InChI=1S/C23H29N3O4/c1-2-24-21(28)20-17(12-27)16-11-25-18(19(16)26(20)22(29)14-7-8-14)10-9-15(23(25)30)13-5-3-4-6-13/h5,9-10,14,16-17,19-20,27H,2-4,6-8,11-12H2,1H3,(H,24,28)/t16-,17-,19+,20-/m1/s1	NWUADCREYHZISA-IZBJGVDFSA-N	411.215806438							98547
BRD-K24522647	LSM-9916		54661084	InChI=1S/C28H29FN4O3/c29-18-9-7-17(8-10-18)21-11-12-24-25-22(15-32(24)28(21)36)23(16-34)26(27(35)31-19-5-3-6-19)33(25)14-20-4-1-2-13-30-20/h1-2,4,7-13,19,22-23,25-26,34H,3,5-6,14-16H2,(H,31,35)/t22-,23-,25+,26-/m1/s1	GFQXIANWUUUKJA-VHCQPULKSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]2N(Cc5ccccn5)[C@H]1C(=O)NC6CCC6	BroadT	BRD-K24522647	BRD-K24522647-001-01-7	Broad Institute of MIT and Harvard	BRD-K24522647			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]2N(Cc2ccccn2)[C@H]1C(=O)NC1CCC1	InChI=1S/C28H29FN4O3/c29-18-9-7-17(8-10-18)21-11-12-24-25-22(15-32(24)28(21)36)23(16-34)26(27(35)31-19-5-3-6-19)33(25)14-20-4-1-2-13-30-20/h1-2,4,7-13,19,22-23,25-26,34H,3,5-6,14-16H2,(H,31,35)/t22-,23-,25+,26-/m1/s1	GFQXIANWUUUKJA-VHCQPULKSA-N	488.222369028							98537
BRD-K69425327	LSM-43491		54661330	InChI=1S/C27H33N3O3/c1-2-29-23-17-30-22(14-13-20(26(30)32)12-11-19-9-5-3-6-10-19)25(29)24(21(23)18-31)27(33)28-15-7-4-8-16-28/h3,5-6,9-14,21,23-25,31H,2,4,7-8,15-18H2,1H3/b12-11+/t21-,23-,24+,25+/m1/s1	YGSIRKPQRSDRAD-UVMVBKAHSA-N	CCN1[C@@H]2CN3C(=O)C(=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)N4CCCCC4)\C=C\c5ccccc5	BroadT	BRD-K69425327	BRD-K69425327-001-01-6	Broad Institute of MIT and Harvard	BRD-K69425327			CCN1[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N1CCCCC1	InChI=1S/C27H33N3O3/c1-2-29-23-17-30-22(14-13-20(26(30)32)12-11-19-9-5-3-6-10-19)25(29)24(21(23)18-31)27(33)28-15-7-4-8-16-28/h3,5-6,9-14,21,23-25,31H,2,4,7-8,15-18H2,1H3/b12-11+/t21-,23-,24+,25+/m1/s1	YGSIRKPQRSDRAD-UVMVBKAHSA-N	447.252191946							
BRD-M69929484	LSM-45059		54661094	InChI=1S/C20H26F3N3O3/c1-4-5-12-6-7-15-16-13(10-26(15)18(12)28)14(11-27)17(19(29)24(2)3)25(16)9-8-20(21,22)23/h4-7,13-14,16-17,27H,8-11H2,1-3H3/t13-,14-,16+,17-/m1/s1	VAVDPECDKRRSEN-TXCZRRACSA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3CCC(F)(F)F)C(=O)N(C)C	BroadT	BRD-M69929484	BRD-M69929484-001-01-4	Broad Institute of MIT and Harvard	BRD-M69929484		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N(C)C)N(CCC(F)(F)F)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N(C)C)N(CCC(F)(F)F)[C@H]23)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N(C)C)N(CCC(F)(F)F)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N(C)C)N(CCC(F)(F)F)[C@H]23)c1=O	InChI=1S/2C20H26F3N3O3/c2*1-4-5-12-6-7-15-16-13(10-26(15)18(12)28)14(11-27)17(19(29)24(2)3)25(16)9-8-20(21,22)23/h2*4-7,13-14,16-17,27H,8-11H2,1-3H3/b5-4+;5-4-/t2*13-,14-,16+,17-/m11/s1	CJGQOCAJLGESLC-XAZNIJQHSA-N	413.192626322							103296
BRD-K29802265	LSM-10236		54661265	InChI=1S/C25H32N4O4/c1-6-28-21-18(19(14-30)22(28)25(33)27(4)5)13-29-20(21)11-10-17(24(29)32)15-8-7-9-16(12-15)23(31)26(2)3/h7-12,18-19,21-22,30H,6,13-14H2,1-5H3/t18-,19-,21+,22-/m0/s1	QNTNHIANOHBUGN-MPJJRAAHSA-N	CCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccc(c4)C(=O)N(C)C)[C@H]12)C(=O)N(C)C	BroadT	BRD-K29802265	BRD-K29802265-001-01-9	Broad Institute of MIT and Harvard	BRD-K29802265			CCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccc(c4)C(=O)N(C)C)c3=O)[C@H]12)C(=O)N(C)C	InChI=1S/C25H32N4O4/c1-6-28-21-18(19(14-30)22(28)25(33)27(4)5)13-29-20(21)11-10-17(24(29)32)15-8-7-9-16(12-15)23(31)26(2)3/h7-12,18-19,21-22,30H,6,13-14H2,1-5H3/t18-,19-,21+,22-/m0/s1	QNTNHIANOHBUGN-MPJJRAAHSA-N	452.242355544							98857
BRD-M65187017	LSM-45055		54661315	InChI=1S/C23H28N4O3S/c1-2-3-15-6-7-18-20-16(11-26(18)23(15)30)17(13-28)21(22(29)25-10-14-4-5-14)27(20)12-19-24-8-9-31-19/h2-3,6-9,14,16-17,20-21,28H,4-5,10-13H2,1H3,(H,25,29)/t16-,17-,20+,21-/m1/s1	LDJBNXGTZHCRNA-SGLNWRHMSA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3Cc4nccs4)C(=O)NCC5CC5	BroadT	BRD-M65187017	BRD-M65187017-001-01-9	Broad Institute of MIT and Harvard	BRD-M65187017		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCC4CC4)N(Cc4nccs4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCC4CC4)N(Cc4nccs4)[C@H]23)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCC4CC4)N(Cc4nccs4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCC4CC4)N(Cc4nccs4)[C@H]23)c1=O	InChI=1S/2C23H28N4O3S/c2*1-2-3-15-6-7-18-20-16(11-26(18)23(15)30)17(13-28)21(22(29)25-10-14-4-5-14)27(20)12-19-24-8-9-31-19/h2*2-3,6-9,14,16-17,20-21,28H,4-5,10-13H2,1H3,(H,25,29)/b3-2+;3-2-/t2*16-,17-,20+,21-/m11/s1	JBQIXEWNJHRVMZ-LJZRPPDPSA-N	440.188211486							103292
BRD-K68908437	LSM-12637		54661198	InChI=1S/C25H31N5O4/c1-28(2)13-21(32)30-20-12-29-19(9-8-17(25(29)34)15-5-4-10-26-11-15)23(30)22(18(20)14-31)24(33)27-16-6-3-7-16/h4-5,8-11,16,18,20,22-23,31H,3,6-7,12-14H2,1-2H3,(H,27,33)/t18-,20-,22+,23+/m0/s1	BUXSVEZUKJHFER-NEKRIBJYSA-N	CN(C)CC(=O)N1[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]1[C@@H]([C@H]2CO)C(=O)NC5CCC5	BroadT	BRD-K68908437	BRD-K68908437-001-01-9	Broad Institute of MIT and Harvard	BRD-K68908437			CN(C)CC(=O)N1[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NC1CCC1	InChI=1S/C25H31N5O4/c1-28(2)13-21(32)30-20-12-29-19(9-8-17(25(29)34)15-5-4-10-26-11-15)23(30)22(18(20)14-31)24(33)27-16-6-3-7-16/h4-5,8-11,16,18,20,22-23,31H,3,6-7,12-14H2,1-2H3,(H,27,33)/t18-,20-,22+,23+/m0/s1	BUXSVEZUKJHFER-NEKRIBJYSA-N	465.237604522							101270
BRD-K27433204	LSM-43459		54661037	InChI=1S/C29H31N5O3/c35-17-24-23-16-33-25(12-11-21(29(33)37)10-9-19-5-2-1-3-6-19)26(23)34(15-20-13-30-18-31-14-20)27(24)28(36)32-22-7-4-8-22/h1-3,5-6,9-14,18,22-24,26-27,35H,4,7-8,15-17H2,(H,32,36)/b10-9+/t23-,24-,26+,27-/m0/s1	FXEKXDJWVVQJEU-MXZZZELRSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N(Cc4cncnc4)[C@@H]1C(=O)NC5CCC5)\C=C\c6ccccc6	BroadT	BRD-K27433204	BRD-K27433204-001-01-9	Broad Institute of MIT and Harvard	BRD-K27433204			OC[C@H]1[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]2N(Cc2cncnc2)[C@@H]1C(=O)NC1CCC1	InChI=1S/C29H31N5O3/c35-17-24-23-16-33-25(12-11-21(29(33)37)10-9-19-5-2-1-3-6-19)26(23)34(15-20-13-30-18-31-14-20)27(24)28(36)32-22-7-4-8-22/h1-3,5-6,9-14,18,22-24,26-27,35H,4,7-8,15-17H2,(H,32,36)/b10-9+/t23-,24-,26+,27-/m0/s1	FXEKXDJWVVQJEU-MXZZZELRSA-N	497.242689902							
BRD-K28149578	LSM-10135		54661133	InChI=1S/C28H32FN3O4/c29-21-8-4-3-7-18(21)19-11-12-22-26-25(27(35)30-17-5-1-2-6-17)20(15-33)23(14-31(22)28(19)36)32(26)24(34)13-16-9-10-16/h3-4,7-8,11-12,16-17,20,23,25-26,33H,1-2,5-6,9-10,13-15H2,(H,30,35)/t20-,23-,25+,26+/m0/s1	ISISPWKPTDWXNP-XOEVLYMDSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]([C@@H]1C(=O)NC5CCCC5)N2C(=O)CC6CC6	BroadT	BRD-K28149578	BRD-K28149578-001-01-8	Broad Institute of MIT and Harvard	BRD-K28149578			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]([C@@H]1C(=O)NC1CCCC1)N2C(=O)CC1CC1	InChI=1S/C28H32FN3O4/c29-21-8-4-3-7-18(21)19-11-12-22-26-25(27(35)30-17-5-1-2-6-17)20(15-33)23(14-31(22)28(19)36)32(26)24(34)13-16-9-10-16/h3-4,7-8,11-12,16-17,20,23,25-26,33H,1-2,5-6,9-10,13-15H2,(H,30,35)/t20-,23-,25+,26+/m0/s1	ISISPWKPTDWXNP-XOEVLYMDSA-N	493.237684734							98756
BRD-K74066682	LSM-12961		54661136	InChI=1S/C24H34N4O5S/c1-25-10-12-26(13-11-25)24(31)21-18(15-29)20-14-27-19(22(21)28(20)34(2,32)33)9-8-17(23(27)30)16-6-4-3-5-7-16/h6,8-9,18,20-22,29H,3-5,7,10-15H2,1-2H3/t18-,20-,21+,22+/m1/s1	NRVZDTJJXPAHOA-YJMBLLCNSA-N	CN1CCN(CC1)C(=O)[C@H]2[C@H](CO)[C@H]3CN4C(=CC=C(C5=CCCCC5)C4=O)[C@@H]2N3S(=O)(=O)C	BroadT	BRD-K74066682	BRD-K74066682-001-01-0	Broad Institute of MIT and Harvard	BRD-K74066682			CN1CCN(CC1)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]1N2S(C)(=O)=O	InChI=1S/C24H34N4O5S/c1-25-10-12-26(13-11-25)24(31)21-18(15-29)20-14-27-19(22(21)28(20)34(2,32)33)9-8-17(23(27)30)16-6-4-3-5-7-16/h6,8-9,18,20-22,29H,3-5,7,10-15H2,1-2H3/t18-,20-,21+,22+/m1/s1	NRVZDTJJXPAHOA-YJMBLLCNSA-N	490.224990918							101598
BRD-K34007913	LSM-10486		54661077	InChI=1S/C25H23FN2O6S/c1-14-3-2-4-17(11-14)35(33,34)28-21-12-27-20(23(28)22(25(31)32)19(21)13-29)10-9-18(24(27)30)15-5-7-16(26)8-6-15/h2-11,19,21-23,29H,12-13H2,1H3,(H,31,32)/t19-,21-,22+,23+/m0/s1	MTJUDQAFHZBLAH-KZKAQZJJSA-N	Cc1cccc(c1)S(=O)(=O)N2[C@H]3CN4C(=CC=C(C4=O)c5ccc(F)cc5)[C@@H]2[C@@H]([C@H]3CO)C(=O)O	BroadT	BRD-K34007913	BRD-K34007913-001-01-4	Broad Institute of MIT and Harvard	BRD-K34007913			Cc1cccc(c1)S(=O)(=O)N1[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(O)=O	InChI=1S/C25H23FN2O6S/c1-14-3-2-4-17(11-14)35(33,34)28-21-12-27-20(23(28)22(25(31)32)19(21)13-29)10-9-18(24(27)30)15-5-7-16(26)8-6-15/h2-11,19,21-23,29H,12-13H2,1H3,(H,31,32)/t19-,21-,22+,23+/m0/s1	MTJUDQAFHZBLAH-KZKAQZJJSA-N	498.126085366							99107
BRD-K58524976	LSM-11961		54661159	InChI=1S/C26H29N3O3/c30-14-20-21-13-29-22(10-9-19(26(29)32)15-5-1-2-6-15)24(28-21)23(20)25(31)27-18-11-16-7-3-4-8-17(16)12-18/h3-5,7-10,18,20-21,23-24,28,30H,1-2,6,11-14H2,(H,27,31)/t20-,21-,23+,24+/m0/s1	OCQMLVVPVHYQPL-NEUULRRLSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H](N2)[C@@H]1C(=O)NC4Cc5ccccc5C4)C6=CCCC6	BroadT	BRD-K58524976	BRD-K58524976-001-01-3	Broad Institute of MIT and Harvard	BRD-K58524976			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H](N2)[C@@H]1C(=O)NC1Cc2ccccc2C1	InChI=1S/C26H29N3O3/c30-14-20-21-13-29-22(10-9-19(26(29)32)15-5-1-2-6-15)24(28-21)23(20)25(31)27-18-11-16-7-3-4-8-17(16)12-18/h3-5,7-10,18,20-21,23-24,28,30H,1-2,6,11-14H2,(H,27,31)/t20-,21-,23+,24+/m0/s1	OCQMLVVPVHYQPL-NEUULRRLSA-N	431.220891818							100587
BRD-K62366931	LSM-12217		54661454	InChI=1S/C25H28FN3O3/c26-17-8-6-15(7-9-17)12-27-24(31)22-19(14-30)20-13-29-21(23(22)28-20)11-10-18(25(29)32)16-4-2-1-3-5-16/h4,6-11,19-20,22-23,28,30H,1-3,5,12-14H2,(H,27,31)/t19-,20-,22+,23+/m1/s1	NDSDOOPKNRYURC-SCPDWHHUSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H](N2)[C@H]1C(=O)NCc4ccc(F)cc4)C5=CCCCC5	BroadT	BRD-K62366931	BRD-K62366931-001-01-7	Broad Institute of MIT and Harvard	BRD-K62366931			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H](N2)[C@H]1C(=O)NCc1ccc(F)cc1	InChI=1S/C25H28FN3O3/c26-17-8-6-15(7-9-17)12-27-24(31)22-19(14-30)20-13-29-21(23(22)28-20)11-10-18(25(29)32)16-4-2-1-3-5-16/h4,6-11,19-20,22-23,28,30H,1-3,5,12-14H2,(H,27,31)/t19-,20-,22+,23+/m1/s1	NDSDOOPKNRYURC-SCPDWHHUSA-N	437.211469986							100843
BRD-K59689930	LSM-12034		54661173	InChI=1S/C25H24FN3O3/c26-17-8-4-7-16(11-17)18-9-10-21-23-22(24(31)27-12-15-5-2-1-3-6-15)19(14-30)20(28-23)13-29(21)25(18)32/h1-11,19-20,22-23,28,30H,12-14H2,(H,27,31)/t19-,20-,22+,23+/m1/s1	VSJWYLDRVGFTPJ-SCPDWHHUSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H](N2)[C@H]1C(=O)NCc4ccccc4)c5cccc(F)c5	BroadT	BRD-K59689930	BRD-K59689930-001-01-8	Broad Institute of MIT and Harvard	BRD-K59689930			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H](N2)[C@H]1C(=O)NCc1ccccc1	InChI=1S/C25H24FN3O3/c26-17-8-4-7-16(11-17)18-9-10-21-23-22(24(31)27-12-15-5-2-1-3-6-15)19(14-30)20(28-23)13-29(21)25(18)32/h1-11,19-20,22-23,28,30H,12-14H2,(H,27,31)/t19-,20-,22+,23+/m1/s1	VSJWYLDRVGFTPJ-SCPDWHHUSA-N	433.180169858							100660
BRD-K82494420	LSM-13469		54661054	InChI=1S/C17H25N3O3/c1-4-8-19-13-9-20-12(6-5-7-14(20)22)16(19)15(11(13)10-21)17(23)18(2)3/h5-7,11,13,15-16,21H,4,8-10H2,1-3H3/t11-,13-,15+,16+/m1/s1	OCXQXADZMXZZGR-OYNZBZHQSA-N	CCCN1[C@@H]2CN3C(=O)C=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)N(C)C	BroadT	BRD-K82494420	BRD-K82494420-001-01-1	Broad Institute of MIT and Harvard	BRD-K82494420			CCCN1[C@@H]2Cn3c(cccc3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N(C)C	InChI=1S/C17H25N3O3/c1-4-8-19-13-9-20-12(6-5-7-14(20)22)16(19)15(11(13)10-21)17(23)18(2)3/h5-7,11,13,15-16,21H,4,8-10H2,1-3H3/t11-,13-,15+,16+/m1/s1	OCXQXADZMXZZGR-OYNZBZHQSA-N	319.18959169							102109
BRD-K43179840	LSM-11050		54661269	InChI=1S/C27H32FN3O5/c1-36-13-12-29-25(33)24-20(15-32)19-14-30-22(23(19)31(24)26(34)16-6-2-3-7-16)11-10-18(27(30)35)17-8-4-5-9-21(17)28/h4-5,8-11,16,19-20,23-24,32H,2-3,6-7,12-15H2,1H3,(H,29,33)/t19-,20-,23+,24-/m0/s1	SEDOFMLHYRNKHQ-JVODISISSA-N	COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N1C(=O)C4CCCC4)c5ccccc5F	BroadT	BRD-K43179840	BRD-K43179840-001-01-8	Broad Institute of MIT and Harvard	BRD-K43179840			COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]2N1C(=O)C1CCCC1	InChI=1S/C27H32FN3O5/c1-36-13-12-29-25(33)24-20(15-32)19-14-30-22(23(19)31(24)26(34)16-6-2-3-7-16)11-10-18(27(30)35)17-8-4-5-9-21(17)28/h4-5,8-11,16,19-20,23-24,32H,2-3,6-7,12-15H2,1H3,(H,29,33)/t19-,20-,23+,24-/m0/s1	SEDOFMLHYRNKHQ-JVODISISSA-N	497.232599354							99671
BRD-K90671064	LSM-14013		54661415	InChI=1S/C21H32N4O3/c1-23(2)10-4-9-22-21(28)19-15(13-26)17-12-24-16(5-3-6-18(24)27)20(19)25(17)11-14-7-8-14/h3,5-6,14-15,17,19-20,26H,4,7-13H2,1-2H3,(H,22,28)/t15-,17-,19+,20+/m0/s1	FYGCWFQCJMSVAD-SMMRIJLZSA-N	CN(C)CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]1N2CC4CC4	BroadT	BRD-K90671064	BRD-K90671064-001-01-5	Broad Institute of MIT and Harvard	BRD-K90671064			CN(C)CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2CC1CC1	InChI=1S/C21H32N4O3/c1-23(2)10-4-9-22-21(28)19-15(13-26)17-12-24-16(5-3-6-18(24)27)20(19)25(17)11-14-7-8-14/h3,5-6,14-15,17,19-20,26H,4,7-13H2,1-2H3,(H,22,28)/t15-,17-,19+,20+/m0/s1	FYGCWFQCJMSVAD-SMMRIJLZSA-N	388.247440924							102666
BRD-M51208417	LSM-45040		54661074	InChI=1S/C27H33N3O5/c1-3-6-18-9-10-22-24-20(16-29(22)26(18)32)21(17-31)25(27(33)28-11-13-35-14-12-28)30(24)15-19-7-4-5-8-23(19)34-2/h3-10,20-21,24-25,31H,11-17H2,1-2H3/t20-,21-,24+,25-/m0/s1	KLSOMJQHNGKNNV-MHOPESGUSA-N	COc1ccccc1CN2[C@@H]([C@@H](CO)[C@@H]3CN4C(=CC=C(C=CC)C4=O)[C@H]23)C(=O)N5CCOCC5	BroadT	BRD-M51208417	BRD-M51208417-001-01-5	Broad Institute of MIT and Harvard	BRD-M51208417		COc1ccccc1CN1[C@H](C(=O)N2CCOCC2)[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]12.COc1ccccc1CN1[C@H](C(=O)N2CCOCC2)[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]12	COc1ccccc1CN1[C@H](C(=O)N2CCOCC2)[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]12.COc1ccccc1CN1[C@H](C(=O)N2CCOCC2)[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]12	InChI=1S/2C27H33N3O5/c2*1-3-6-18-9-10-22-24-20(16-29(22)26(18)32)21(17-31)25(27(33)28-11-13-35-14-12-28)30(24)15-19-7-4-5-8-23(19)34-2/h2*3-10,20-21,24-25,31H,11-17H2,1-2H3/b6-3+;6-3-/t2*20-,21-,24+,25-/m00/s1	MUKTYZHOEUTDIA-PDSYRFPBSA-N	479.242021186							103277
BRD-K06832445	LSM-8834		54661342	InChI=1S/C25H24FN3O3/c1-28-22-19(20(14-30)23(28)24(31)27-17-5-3-2-4-6-17)13-29-21(22)12-11-18(25(29)32)15-7-9-16(26)10-8-15/h2-12,19-20,22-23,30H,13-14H2,1H3,(H,27,31)/t19-,20-,22+,23-/m1/s1	FCBXOAREBJGYON-YXPKMTABSA-N	CN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]12)C(=O)Nc5ccccc5	BroadT	BRD-K06832445	BRD-K06832445-001-01-6	Broad Institute of MIT and Harvard	BRD-K06832445			CN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]12)C(=O)Nc1ccccc1	InChI=1S/C25H24FN3O3/c1-28-22-19(20(14-30)23(28)24(31)27-17-5-3-2-4-6-17)13-29-21(22)12-11-18(25(29)32)15-7-9-16(26)10-8-15/h2-12,19-20,22-23,30H,13-14H2,1H3,(H,27,31)/t19-,20-,22+,23-/m1/s1	FCBXOAREBJGYON-YXPKMTABSA-N	433.180169858							97455
BRD-K62124038	LSM-12199		54661405	InChI=1S/C21H22FN3O4/c1-23(2)21(29)18-14(11-26)16-10-24-15(4-3-5-17(24)27)19(18)25(16)20(28)12-6-8-13(22)9-7-12/h3-9,14,16,18-19,26H,10-11H2,1-2H3/t14-,16-,18+,19+/m1/s1	BBMUHFCQMOUBDR-JZGRTCEGSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]1N2C(=O)c4ccc(F)cc4	BroadT	BRD-K62124038	BRD-K62124038-001-01-2	Broad Institute of MIT and Harvard	BRD-K62124038			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2C(=O)c1ccc(F)cc1	InChI=1S/C21H22FN3O4/c1-23(2)21(29)18-14(11-26)16-10-24-15(4-3-5-17(24)27)19(18)25(16)20(28)12-6-8-13(22)9-7-12/h3-9,14,16,18-19,26H,10-11H2,1-2H3/t14-,16-,18+,19+/m1/s1	BBMUHFCQMOUBDR-JZGRTCEGSA-N	399.159434414							100825
BRD-M88324697	LSM-45077		54661178	InChI=1S/C28H35N3O3/c1-3-7-21-10-11-24-25-22(17-31(24)27(21)33)23(18-32)26(29(25)2)28(34)30-14-12-20(13-15-30)16-19-8-5-4-6-9-19/h3-11,20,22-23,25-26,32H,12-18H2,1-2H3/t22-,23-,25+,26-/m0/s1	NDQSGMPNQQNYJD-LJCOXQHRSA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3C)C(=O)N4CCC(Cc5ccccc5)CC4	BroadT	BRD-M88324697	BRD-M88324697-001-01-8	Broad Institute of MIT and Harvard	BRD-M88324697		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@H](N(C)[C@@H]23)C(=O)N2CCC(CC2)Cc2ccccc2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@H](N(C)[C@@H]23)C(=O)N2CCC(CC2)Cc2ccccc2)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@H](N(C)[C@@H]23)C(=O)N2CCC(CC2)Cc2ccccc2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@H](N(C)[C@@H]23)C(=O)N2CCC(CC2)Cc2ccccc2)c1=O	InChI=1S/2C28H35N3O3/c2*1-3-7-21-10-11-24-25-22(17-31(24)27(21)33)23(18-32)26(29(25)2)28(34)30-14-12-20(13-15-30)16-19-8-5-4-6-9-19/h2*3-11,20,22-23,25-26,32H,12-18H2,1-2H3/b7-3+;7-3-/t2*22-,23-,25+,26-/m00/s1	RCRORROKKZWOHQ-ILYPDCDPSA-N	461.26784201							103314
BRD-K54022924	LSM-11716		54661205	InChI=1S/C27H27FN4O4/c1-2-11-30-25(34)24-20(15-33)19-14-31-22(10-9-17(26(31)35)16-6-5-12-29-13-16)23(19)32(24)27(36)18-7-3-4-8-21(18)28/h3-10,12-13,19-20,23-24,33H,2,11,14-15H2,1H3,(H,30,34)/t19-,20-,23+,24-/m1/s1	LVLNEDZJLRSBBP-MYSJAJEPSA-N	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]2N1C(=O)c5ccccc5F	BroadT	BRD-K54022924	BRD-K54022924-001-01-5	Broad Institute of MIT and Harvard	BRD-K54022924			CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]2N1C(=O)c1ccccc1F	InChI=1S/C27H27FN4O4/c1-2-11-30-25(34)24-20(15-33)19-14-31-22(10-9-17(26(31)35)16-6-5-12-29-13-16)23(19)32(24)27(36)18-7-3-4-8-21(18)28/h3-10,12-13,19-20,23-24,33H,2,11,14-15H2,1H3,(H,30,34)/t19-,20-,23+,24-/m1/s1	LVLNEDZJLRSBBP-MYSJAJEPSA-N	490.201633584							100341
BRD-K10837140	LSM-9088		54661455	InChI=1S/C25H35N3O4/c1-26(2)25(31)22-19(15-29)21-14-28-20(8-7-18(24(28)30)17-5-3-4-6-17)23(22)27(21)13-16-9-11-32-12-10-16/h5,7-8,16,19,21-23,29H,3-4,6,9-15H2,1-2H3/t19-,21-,22+,23+/m1/s1	GAIIVBPAQZZTRV-LGKPFJOYSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]1N2CC4CCOCC4)C5=CCCC5	BroadT	BRD-K10837140	BRD-K10837140-001-01-7	Broad Institute of MIT and Harvard	BRD-K10837140			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]1N2CC1CCOCC1	InChI=1S/C25H35N3O4/c1-26(2)25(31)22-19(15-29)21-14-28-20(8-7-18(24(28)30)17-5-3-4-6-17)23(22)27(21)13-16-9-11-32-12-10-16/h5,7-8,16,19,21-23,29H,3-4,6,9-15H2,1-2H3/t19-,21-,22+,23+/m1/s1	GAIIVBPAQZZTRV-LGKPFJOYSA-N	441.26275663							97709
BRD-M87776818	LSM-45074		54661367	InChI=1S/C25H33N3O4/c1-2-7-16-10-11-19-22-21(25(32)26-12-4-3-5-13-26)18(15-29)20(14-27(19)23(16)30)28(22)24(31)17-8-6-9-17/h2,7,10-11,17-18,20-22,29H,3-6,8-9,12-15H2,1H3/t18-,20-,21+,22+/m1/s1	RGMNVADEAWNQHQ-YJMBLLCNSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3C(=O)C4CCC4)C(=O)N5CCCCC5	BroadT	BRD-M87776818	BRD-M87776818-001-01-4	Broad Institute of MIT and Harvard	BRD-M87776818		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N4CCCCC4)[C@H]2N3C(=O)C2CCC2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N4CCCCC4)[C@H]2N3C(=O)C2CCC2)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N4CCCCC4)[C@H]2N3C(=O)C2CCC2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N4CCCCC4)[C@H]2N3C(=O)C2CCC2)c1=O	InChI=1S/2C25H33N3O4/c2*1-2-7-16-10-11-19-22-21(25(32)26-12-4-3-5-13-26)18(15-29)20(14-27(19)23(16)30)28(22)24(31)17-8-6-9-17/h2*2,7,10-11,17-18,20-22,29H,3-6,8-9,12-15H2,1H3/b7-2+;7-2-/t2*18-,20-,21+,22+/m11/s1	WJKJVCBRAFWZEB-ZDFWTMOSSA-N	439.247106566							103311
BRD-K36701739	LSM-10648		54661401	InChI=1S/C28H29N3O4/c1-35-20-8-4-7-18(13-20)21-9-10-24-25-22(14-31(24)28(21)34)23(15-32)26(30-25)27(33)29-19-11-16-5-2-3-6-17(16)12-19/h2-10,13,19,22-23,25-26,30,32H,11-12,14-15H2,1H3,(H,29,33)/t22-,23-,25+,26-/m1/s1	CTULAYPPZYFJRD-VHCQPULKSA-N	COc1cccc(c1)C2=CC=C3[C@H]4N[C@H]([C@H](CO)[C@H]4CN3C2=O)C(=O)NC5Cc6ccccc6C5	BroadT	BRD-K36701739	BRD-K36701739-001-01-2	Broad Institute of MIT and Harvard	BRD-K36701739			COc1cccc(c1)-c1ccc2[C@H]3N[C@H]([C@H](CO)[C@H]3Cn2c1=O)C(=O)NC1Cc2ccccc2C1	InChI=1S/C28H29N3O4/c1-35-20-8-4-7-18(13-20)21-9-10-24-25-22(14-31(24)28(21)34)23(15-32)26(30-25)27(33)29-19-11-16-5-2-3-6-17(16)12-19/h2-10,13,19,22-23,25-26,30,32H,11-12,14-15H2,1H3,(H,29,33)/t22-,23-,25+,26-/m1/s1	CTULAYPPZYFJRD-VHCQPULKSA-N	471.215806438							99269
BRD-K10600561	LSM-9066		54661365	InChI=1S/C26H33N3O3/c1-28-22-15-29-21(13-12-19(26(29)32)18-10-6-3-7-11-18)24(28)23(20(22)16-30)25(31)27-14-17-8-4-2-5-9-17/h3,6-7,10-13,17,20,22-24,30H,2,4-5,8-9,14-16H2,1H3,(H,27,31)/t20-,22-,23+,24+/m1/s1	IUNMLESRWJTJRT-AZOUXBGGSA-N	CN1[C@@H]2CN3C(=O)C(=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)NCC4CCCCC4)c5ccccc5	BroadT	BRD-K10600561	BRD-K10600561-001-01-9	Broad Institute of MIT and Harvard	BRD-K10600561			CN1[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCC1CCCCC1	InChI=1S/C26H33N3O3/c1-28-22-15-29-21(13-12-19(26(29)32)18-10-6-3-7-11-18)24(28)23(20(22)16-30)25(31)27-14-17-8-4-2-5-9-17/h3,6-7,10-13,17,20,22-24,30H,2,4-5,8-9,14-16H2,1H3,(H,27,31)/t20-,22-,23+,24+/m1/s1	IUNMLESRWJTJRT-AZOUXBGGSA-N	435.252191946							97687
BRD-K84368021	LSM-13585		54661306	InChI=1S/C25H28ClN3O5/c26-19-5-2-1-4-16(19)12-27-24(32)23-18(14-30)17-13-28-20(6-3-7-21(28)31)22(17)29(23)25(33)15-8-10-34-11-9-15/h1-7,15,17-18,22-23,30H,8-14H2,(H,27,32)/t17-,18-,22+,23-/m0/s1	FUBLKTUGGJCEAF-JRSMBCBASA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N([C@@H]1C(=O)NCc4ccccc4Cl)C(=O)C5CCOCC5	BroadT	BRD-K84368021	BRD-K84368021-001-01-8	Broad Institute of MIT and Harvard	BRD-K84368021			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N([C@@H]1C(=O)NCc1ccccc1Cl)C(=O)C1CCOCC1	InChI=1S/C25H28ClN3O5/c26-19-5-2-1-4-16(19)12-27-24(32)23-18(14-30)17-13-28-20(6-3-7-21(28)31)22(17)29(23)25(33)15-8-10-34-11-9-15/h1-7,15,17-18,22-23,30H,8-14H2,(H,27,32)/t17-,18-,22+,23-/m0/s1	FUBLKTUGGJCEAF-JRSMBCBASA-N	485.171748736							102229
BRD-K08394807	LSM-8935		54661262	InChI=1S/C29H32FN3O3/c1-3-14-32-26-23(24(17-34)27(32)28(35)31-18(2)19-8-5-4-6-9-19)16-33-25(26)13-12-22(29(33)36)20-10-7-11-21(30)15-20/h4-13,15,18,23-24,26-27,34H,3,14,16-17H2,1-2H3,(H,31,35)/t18-,23+,24+,26-,27+/m1/s1	FDXOBPCLNSDZHU-BZZKEYFGSA-N	CCCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@H]12)C(=O)N[C@H](C)c5ccccc5	BroadT	BRD-K08394807	BRD-K08394807-001-01-7	Broad Institute of MIT and Harvard	BRD-K08394807			CCCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]12)C(=O)N[C@H](C)c1ccccc1	InChI=1S/C29H32FN3O3/c1-3-14-32-26-23(24(17-34)27(32)28(35)31-18(2)19-8-5-4-6-9-19)16-33-25(26)13-12-22(29(33)36)20-10-7-11-21(30)15-20/h4-13,15,18,23-24,26-27,34H,3,14,16-17H2,1-2H3,(H,31,35)/t18-,23+,24+,26-,27+/m1/s1	FDXOBPCLNSDZHU-BZZKEYFGSA-N	489.242770114							97556
BRD-K93736495	LSM-14179		54661435	InChI=1S/C25H24FN3O4/c1-33-25(32)23-20(14-30)19-13-28-21(8-7-18(24(28)31)16-5-3-9-27-11-16)22(19)29(23)12-15-4-2-6-17(26)10-15/h2-11,19-20,22-23,30H,12-14H2,1H3/t19-,20-,22+,23-/m1/s1	QSBCJQTYLRTAIU-YXPKMTABSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]2N1Cc5cccc(F)c5	BroadT	BRD-K93736495	BRD-K93736495-001-01-2	Broad Institute of MIT and Harvard	BRD-K93736495			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]2N1Cc1cccc(F)c1	InChI=1S/C25H24FN3O4/c1-33-25(32)23-20(14-30)19-13-28-21(8-7-18(24(28)31)16-5-3-9-27-11-16)22(19)29(23)12-15-4-2-6-17(26)10-15/h2-11,19-20,22-23,30H,12-14H2,1H3/t19-,20-,22+,23-/m1/s1	QSBCJQTYLRTAIU-YXPKMTABSA-N	449.175084478							102833
CHEMBL2361372	LSM-11938	BRD-K58129723, SID131457511	54661140	InChI=1S/C25H35F3N4O3/c1-30(2)12-5-11-29-23(34)22-19(15-33)18-14-32-20(21(18)31(22)13-10-25(26,27)28)9-8-17(24(32)35)16-6-3-4-7-16/h6,8-9,18-19,21-22,33H,3-5,7,10-15H2,1-2H3,(H,29,34)/t18-,19-,21+,22-/m1/s1	VFQPYNAQKZTJPV-KRXUUXHPSA-N	CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@H]2N1CCC(F)(F)F)C4=CCCC4	BroadT	BRD-K58129723	BRD-K58129723-001-01-7	Broad Institute of MIT and Harvard	BRD-K58129723			CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]2N1CCC(F)(F)F	InChI=1S/C25H35F3N4O3/c1-30(2)12-5-11-29-23(34)22-19(15-33)18-14-32-20(21(18)31(22)13-10-25(26,27)28)9-8-17(24(32)35)16-6-3-4-7-16/h6,8-9,18-19,21-22,33H,3-5,7,10-15H2,1-2H3,(H,29,34)/t18-,19-,21+,22-/m1/s1	VFQPYNAQKZTJPV-KRXUUXHPSA-N	496.26612562							100564
BRD-K52918979	LSM-11658		54661416	InChI=1S/C23H20FN3O6S/c24-16-3-1-2-4-19(16)34(32,33)27-18-11-26-17(21(27)20(23(30)31)15(18)12-28)6-5-14(22(26)29)13-7-9-25-10-8-13/h1-10,15,18,20-21,28H,11-12H2,(H,30,31)/t15-,18-,20+,21+/m1/s1	OZRBNBICDFVIFO-NXXWWENFSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@@H]([C@H]1C(=O)O)N2S(=O)(=O)c5ccccc5F	BroadT	BRD-K52918979	BRD-K52918979-001-01-0	Broad Institute of MIT and Harvard	BRD-K52918979			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]([C@H]1C(O)=O)N2S(=O)(=O)c1ccccc1F	InChI=1S/C23H20FN3O6S/c24-16-3-1-2-4-19(16)34(32,33)27-18-11-26-17(21(27)20(23(30)31)15(18)12-28)6-5-14(22(26)29)13-7-9-25-10-8-13/h1-10,15,18,20-21,28H,11-12H2,(H,30,31)/t15-,18-,20+,21+/m1/s1	OZRBNBICDFVIFO-NXXWWENFSA-N	485.10568428							100283
BRD-K62123687	LSM-12198		54661197	InChI=1S/C25H31N5O4/c1-28(2)13-21(32)30-20-12-29-19(9-8-17(25(29)34)15-5-4-10-26-11-15)23(30)22(18(20)14-31)24(33)27-16-6-3-7-16/h4-5,8-11,16,18,20,22-23,31H,3,6-7,12-14H2,1-2H3,(H,27,33)/t18-,20-,22+,23+/m1/s1	BUXSVEZUKJHFER-SQMBMXPBSA-N	CN(C)CC(=O)N1[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]1[C@H]([C@@H]2CO)C(=O)NC5CCC5	BroadT	BRD-K62123687	BRD-K62123687-001-01-8	Broad Institute of MIT and Harvard	BRD-K62123687			CN(C)CC(=O)N1[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NC1CCC1	InChI=1S/C25H31N5O4/c1-28(2)13-21(32)30-20-12-29-19(9-8-17(25(29)34)15-5-4-10-26-11-15)23(30)22(18(20)14-31)24(33)27-16-6-3-7-16/h4-5,8-11,16,18,20,22-23,31H,3,6-7,12-14H2,1-2H3,(H,27,33)/t18-,20-,22+,23+/m1/s1	BUXSVEZUKJHFER-SQMBMXPBSA-N	465.237604522							100824
BRD-K53193280	LSM-11673		54661281	InChI=1S/C26H32N6O4/c33-13-20-19-12-31-21(8-7-18(25(31)35)16-10-27-14-28-11-16)22(19)32(26(36)30-17-3-1-2-4-17)23(20)24(34)29-9-15-5-6-15/h7-8,10-11,14-15,17,19-20,22-23,33H,1-6,9,12-13H2,(H,29,34)(H,30,36)/t19-,20-,22+,23-/m1/s1	KFSHNWDAJUKWQL-YXPKMTABSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H]2N([C@H]1C(=O)NCC4CC4)C(=O)NC5CCCC5)c6cncnc6	BroadT	BRD-K53193280	BRD-K53193280-001-01-3	Broad Institute of MIT and Harvard	BRD-K53193280			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@H]2N([C@H]1C(=O)NCC1CC1)C(=O)NC1CCCC1	InChI=1S/C26H32N6O4/c33-13-20-19-12-31-21(8-7-18(25(31)35)16-10-27-14-28-11-16)22(19)32(26(36)30-17-3-1-2-4-17)23(20)24(34)29-9-15-5-6-15/h7-8,10-11,14-15,17,19-20,22-23,33H,1-6,9,12-13H2,(H,29,34)(H,30,36)/t19-,20-,22+,23-/m1/s1	KFSHNWDAJUKWQL-YXPKMTABSA-N	492.248503564							100298
BRD-K84673192	LSM-14959		54661055	InChI=1S/C17H25N3O3/c1-4-8-19-13-9-20-12(6-5-7-14(20)22)16(19)15(11(13)10-21)17(23)18(2)3/h5-7,11,13,15-16,21H,4,8-10H2,1-3H3/t11-,13-,15+,16+/m0/s1	OCXQXADZMXZZGR-DDUYRFODSA-N	CCCN1[C@H]2CN3C(=O)C=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)N(C)C	BroadT	BRD-K84673192	BRD-K84673192-001-01-4	Broad Institute of MIT and Harvard	BRD-K84673192			CCCN1[C@H]2Cn3c(cccc3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N(C)C	InChI=1S/C17H25N3O3/c1-4-8-19-13-9-20-12(6-5-7-14(20)22)16(19)15(11(13)10-21)17(23)18(2)3/h5-7,11,13,15-16,21H,4,8-10H2,1-3H3/t11-,13-,15+,16+/m0/s1	OCXQXADZMXZZGR-DDUYRFODSA-N	319.18959169							103615
BRD-K12981857	LSM-9202		54661304	InChI=1S/C19H25N3O4/c1-11(24)22-15-9-21-14(7-4-8-16(21)25)18(22)17(13(15)10-23)19(26)20-12-5-2-3-6-12/h4,7-8,12-13,15,17-18,23H,2-3,5-6,9-10H2,1H3,(H,20,26)/t13-,15-,17+,18+/m0/s1	RWDQACDHOIJVRL-OXXUSNJHSA-N	CC(=O)N1[C@H]2CN3C(=O)C=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)NC4CCCC4	BroadT	BRD-K12981857	BRD-K12981857-001-01-4	Broad Institute of MIT and Harvard	BRD-K12981857			CC(=O)N1[C@H]2Cn3c(cccc3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NC1CCCC1	InChI=1S/C19H25N3O4/c1-11(24)22-15-9-21-14(7-4-8-16(21)25)18(22)17(13(15)10-23)19(26)20-12-5-2-3-6-12/h4,7-8,12-13,15,17-18,23H,2-3,5-6,9-10H2,1H3,(H,20,26)/t13-,15-,17+,18+/m0/s1	RWDQACDHOIJVRL-OXXUSNJHSA-N	359.18450631							97823
BRD-M70861773	LSM-45060		54661214	InChI=1S/C25H37N5O4/c1-4-7-17-8-9-20-21-18(14-29(20)24(17)33)19(15-31)22(30(21)25(34)27-16(2)3)23(32)26-10-13-28-11-5-6-12-28/h4,7-9,16,18-19,21-22,31H,5-6,10-15H2,1-3H3,(H,26,32)(H,27,34)/t18-,19-,21+,22-/m1/s1	PNJNHSHUQBINAQ-KRXUUXHPSA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3C(=O)NC(C)C)C(=O)NCCN4CCCC4	BroadT	BRD-M70861773	BRD-M70861773-001-01-6	Broad Institute of MIT and Harvard	BRD-M70861773		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCN4CCCC4)N(C(=O)NC(C)C)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCN4CCCC4)N(C(=O)NC(C)C)[C@H]23)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCN4CCCC4)N(C(=O)NC(C)C)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCN4CCCC4)N(C(=O)NC(C)C)[C@H]23)c1=O	InChI=1S/2C25H37N5O4/c2*1-4-7-17-8-9-20-21-18(14-29(20)24(17)33)19(15-31)22(30(21)25(34)27-16(2)3)23(32)26-10-13-28-11-5-6-12-28/h2*4,7-9,16,18-19,21-22,31H,5-6,10-15H2,1-3H3,(H,26,32)(H,27,34)/b7-4+;7-4-/t2*18-,19-,21+,22-/m11/s1	CBUQVPCXQOBTTM-OJSQGVTQSA-N	471.284554714							103297
BRD-K41028488	LSM-10927		54661300	InChI=1S/C23H26F3N3O3/c1-2-27-21(31)19-16(13-30)18-12-29-17(20(19)28(18)11-10-23(24,25)26)9-8-15(22(29)32)14-6-4-3-5-7-14/h3-9,16,18-20,30H,2,10-13H2,1H3,(H,27,31)/t16-,18-,19+,20+/m0/s1	KIAQQOUXENLKMW-IJXRJRJASA-N	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@H]1N2CCC(F)(F)F	BroadT	BRD-K41028488	BRD-K41028488-001-01-6	Broad Institute of MIT and Harvard	BRD-K41028488			CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]1N2CCC(F)(F)F	InChI=1S/C23H26F3N3O3/c1-2-27-21(31)19-16(13-30)18-12-29-17(20(19)28(18)11-10-23(24,25)26)9-8-15(22(29)32)14-6-4-3-5-7-14/h3-9,16,18-20,30H,2,10-13H2,1H3,(H,27,31)/t16-,18-,19+,20+/m0/s1	KIAQQOUXENLKMW-IJXRJRJASA-N	449.192626322							99548
BRD-K75990896	LSM-13076		54661112	InChI=1S/C30H37N3O3/c1-2-15-32-26-18-33-25(13-12-23(29(33)35)21-9-4-3-5-10-21)28(32)27(24(26)19-34)30(36)31-16-14-20-8-6-7-11-22(20)17-31/h6-9,11-13,24,26-28,34H,2-5,10,14-19H2,1H3/t24-,26-,27+,28+/m0/s1	KTCZPISMGPPISS-GDWZEYGFSA-N	CCCN1[C@H]2CN3C(=O)C(=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)N4CCc5ccccc5C4)C6=CCCCC6	BroadT	BRD-K75990896	BRD-K75990896-001-01-2	Broad Institute of MIT and Harvard	BRD-K75990896			CCCN1[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N1CCc2ccccc2C1	InChI=1S/C30H37N3O3/c1-2-15-32-26-18-33-25(13-12-23(29(33)35)21-9-4-3-5-10-21)28(32)27(24(26)19-34)30(36)31-16-14-20-8-6-7-11-22(20)17-31/h6-9,11-13,24,26-28,34H,2-5,10,14-19H2,1H3/t24-,26-,27+,28+/m0/s1	KTCZPISMGPPISS-GDWZEYGFSA-N	487.283492074							101714
BRD-M95331451	LSM-45087		54661124	InChI=1S/C25H31N3O3/c1-4-9-18-12-13-20-23-22(24(30)26-16(3)17-10-7-6-8-11-17)19(15-29)21(27(23)5-2)14-28(20)25(18)31/h4,6-13,16,19,21-23,29H,5,14-15H2,1-3H3,(H,26,30)/t16-,19+,21+,22-,23-/m0/s1	ZMVMPHHWVOTKTD-PFDGEDQDSA-N	CCN1[C@@H]2CN3C(=CC=C(C=CC)C3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N[C@@H](C)c4ccccc4	BroadT	BRD-M95331451	BRD-M95331451-001-01-0	Broad Institute of MIT and Harvard	BRD-M95331451		CCN1[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1[C@@H](C(=O)N[C@@H](C)c1ccccc1)[C@@H]2CO.CCN1[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]1[C@@H](C(=O)N[C@@H](C)c1ccccc1)[C@@H]2CO	CCN1[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1[C@@H](C(=O)N[C@@H](C)c1ccccc1)[C@@H]2CO.CCN1[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]1[C@@H](C(=O)N[C@@H](C)c1ccccc1)[C@@H]2CO	InChI=1S/2C25H31N3O3/c2*1-4-9-18-12-13-20-23-22(24(30)26-16(3)17-10-7-6-8-11-17)19(15-29)21(27(23)5-2)14-28(20)25(18)31/h2*4,6-13,16,19,21-23,29H,5,14-15H2,1-3H3,(H,26,30)/b9-4+;9-4-/t2*16-,19+,21+,22-,23-/m00/s1	QNYIUHHVJKFROO-QUBRPECCSA-N	421.236541882							103324
BRD-K23091084	LSM-9829		54661217	InChI=1S/C23H25F2N3O4/c24-15-4-5-18(25)14(10-15)11-28-21-16(12-27-19(21)2-1-3-20(27)30)17(13-29)22(28)23(31)26-6-8-32-9-7-26/h1-5,10,16-17,21-22,29H,6-9,11-13H2/t16-,17-,21+,22-/m1/s1	LANSPELNPINRAU-FTIBCMOBSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N(Cc4cc(F)ccc4F)[C@H]1C(=O)N5CCOCC5	BroadT	BRD-K23091084	BRD-K23091084-001-01-4	Broad Institute of MIT and Harvard	BRD-K23091084			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N(Cc2cc(F)ccc2F)[C@H]1C(=O)N1CCOCC1	InChI=1S/C23H25F2N3O4/c24-15-4-5-18(25)14(10-15)11-28-21-16(12-27-19(21)2-1-3-20(27)30)17(13-29)22(28)23(31)26-6-8-32-9-7-26/h1-5,10,16-17,21-22,29H,6-9,11-13H2/t16-,17-,21+,22-/m1/s1	LANSPELNPINRAU-FTIBCMOBSA-N	445.18131271							98450
BRD-K39812368	LSM-10854		54661333	InChI=1S/C26H32N4O3/c1-28(2)26(33)24-21(16-31)20-15-29-22(23(20)30(24)14-18-10-6-7-13-27-18)12-11-19(25(29)32)17-8-4-3-5-9-17/h6-8,10-13,20-21,23-24,31H,3-5,9,14-16H2,1-2H3/t20-,21-,23+,24-/m0/s1	QLERNNCBDUJEFV-ZQRMPTRQSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C4=CCCCC4)C3=O)[C@@H]2N1Cc5ccccn5	BroadT	BRD-K39812368	BRD-K39812368-001-01-2	Broad Institute of MIT and Harvard	BRD-K39812368			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]2N1Cc1ccccn1	InChI=1S/C26H32N4O3/c1-28(2)26(33)24-21(16-31)20-15-29-22(23(20)30(24)14-18-10-6-7-13-27-18)12-11-19(25(29)32)17-8-4-3-5-9-17/h6-8,10-13,20-21,23-24,31H,3-5,9,14-16H2,1-2H3/t20-,21-,23+,24-/m0/s1	QLERNNCBDUJEFV-ZQRMPTRQSA-N	448.247440924							99475
BRD-K60807183	LSM-12107		54661432	InChI=1S/C25H24FN3O4/c1-33-25(32)22-19(14-30)21-13-29-20(23(22)28(21)12-15-3-2-10-27-11-15)9-8-18(24(29)31)16-4-6-17(26)7-5-16/h2-11,19,21-23,30H,12-14H2,1H3/t19-,21-,22+,23+/m0/s1	VJGVMCSFSOLAAN-KZKAQZJJSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]1N2Cc5cccnc5	BroadT	BRD-K60807183	BRD-K60807183-001-01-7	Broad Institute of MIT and Harvard	BRD-K60807183			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]1N2Cc1cccnc1	InChI=1S/C25H24FN3O4/c1-33-25(32)22-19(14-30)21-13-29-20(23(22)28(21)12-15-3-2-10-27-11-15)9-8-18(24(29)31)16-4-6-17(26)7-5-16/h2-11,19,21-23,30H,12-14H2,1H3/t19-,21-,22+,23+/m0/s1	VJGVMCSFSOLAAN-KZKAQZJJSA-N	449.175084478							100733
BRD-K19593593	LSM-9610		54661104	InChI=1S/C27H28FN3O3/c1-16(17-8-4-3-5-9-17)29-26(33)24-20(15-32)23-14-31-22(25(24)30(23)2)13-12-19(27(31)34)18-10-6-7-11-21(18)28/h3-13,16,20,23-25,32H,14-15H2,1-2H3,(H,29,33)/t16-,20+,23+,24-,25-/m0/s1	XOPHINQZQCNQKH-AFIIBUEFSA-N	C[C@H](NC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]1N2C)c5ccccc5	BroadT	BRD-K19593593	BRD-K19593593-001-01-9	Broad Institute of MIT and Harvard	BRD-K19593593			C[C@H](NC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]1N2C)c1ccccc1	InChI=1S/C27H28FN3O3/c1-16(17-8-4-3-5-9-17)29-26(33)24-20(15-32)23-14-31-22(25(24)30(23)2)13-12-19(27(31)34)18-10-6-7-11-21(18)28/h3-13,16,20,23-25,32H,14-15H2,1-2H3,(H,29,33)/t16-,20+,23+,24-,25-/m0/s1	XOPHINQZQCNQKH-AFIIBUEFSA-N	461.211469986							98231
BRD-K97165733	LSM-14399		54661137	InChI=1S/C24H21F2N5O4/c25-14-6-13(7-15(26)8-14)9-29-23(34)21-16(12-32)19-11-30-18(2-1-3-20(30)33)22(21)31(19)24(35)17-10-27-4-5-28-17/h1-8,10,16,19,21-22,32H,9,11-12H2,(H,29,34)/t16-,19-,21+,22+/m1/s1	KPHBLEYIQPKXAE-MWRLGJARSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)NCc4cc(F)cc(F)c4)N2C(=O)c5cnccn5	BroadT	BRD-K97165733	BRD-K97165733-001-01-2	Broad Institute of MIT and Harvard	BRD-K97165733			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NCc1cc(F)cc(F)c1)N2C(=O)c1cnccn1	InChI=1S/C24H21F2N5O4/c25-14-6-13(7-15(26)8-14)9-29-23(34)21-16(12-32)19-11-30-18(2-1-3-20(30)33)22(21)31(19)24(35)17-10-27-4-5-28-17/h1-8,10,16,19,21-22,32H,9,11-12H2,(H,29,34)/t16-,19-,21+,22+/m1/s1	KPHBLEYIQPKXAE-MWRLGJARSA-N	481.156160602							103053
BRD-K32503834	LSM-10401		54661053	InChI=1S/C24H29N3O6S/c1-33-16-5-3-4-15(10-16)17-8-9-19-22-21(23(29)25-11-14-6-7-14)18(13-28)20(12-26(19)24(17)30)27(22)34(2,31)32/h3-5,8-10,14,18,20-22,28H,6-7,11-13H2,1-2H3,(H,25,29)/t18-,20-,21+,22+/m1/s1	ZMTYCZRIJUNYPN-YJMBLLCNSA-N	COc1cccc(c1)C2=CC=C3[C@H]4[C@H]([C@H](CO)[C@@H](CN3C2=O)N4S(=O)(=O)C)C(=O)NCC5CC5	BroadT	BRD-K32503834	BRD-K32503834-001-01-0	Broad Institute of MIT and Harvard	BRD-K32503834			COc1cccc(c1)-c1ccc2[C@H]3[C@H]([C@H](CO)[C@@H](Cn2c1=O)N3S(C)(=O)=O)C(=O)NCC1CC1	InChI=1S/C24H29N3O6S/c1-33-16-5-3-4-15(10-16)17-8-9-19-22-21(23(29)25-11-14-6-7-14)18(13-28)20(12-26(19)24(17)30)27(22)34(2,31)32/h3-5,8-10,14,18,20-22,28H,6-7,11-13H2,1-2H3,(H,25,29)/t18-,20-,21+,22+/m1/s1	ZMTYCZRIJUNYPN-YJMBLLCNSA-N	487.177706368							99022
BRD-K09927308	LSM-9037		54661201	InChI=1S/C29H33N3O4/c33-17-22-24-16-31-23(15-14-21(29(31)36)18-8-4-5-9-18)26(25(22)27(34)30-20-12-6-7-13-20)32(24)28(35)19-10-2-1-3-11-19/h1-3,8,10-11,14-15,20,22,24-26,33H,4-7,9,12-13,16-17H2,(H,30,34)/t22-,24-,25+,26+/m0/s1	MOGZBFKOCSCLHD-ADXHGGABSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@H]([C@@H]1C(=O)NC4CCCC4)N2C(=O)c5ccccc5)C6=CCCC6	BroadT	BRD-K09927308	BRD-K09927308-001-01-7	Broad Institute of MIT and Harvard	BRD-K09927308			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]([C@@H]1C(=O)NC1CCCC1)N2C(=O)c1ccccc1	InChI=1S/C29H33N3O4/c33-17-22-24-16-31-23(15-14-21(29(31)36)18-8-4-5-9-18)26(25(22)27(34)30-20-12-6-7-13-20)32(24)28(35)19-10-2-1-3-11-19/h1-3,8,10-11,14-15,20,22,24-26,33H,4-7,9,12-13,16-17H2,(H,30,34)/t22-,24-,25+,26+/m0/s1	MOGZBFKOCSCLHD-ADXHGGABSA-N	487.247106566							97658
BRD-K29390829	LSM-10212		54661343	InChI=1S/C25H25FN4O3/c1-29-22-19(20(14-31)23(29)24(32)28-12-17-7-2-3-10-27-17)13-30-21(22)9-8-18(25(30)33)15-5-4-6-16(26)11-15/h2-11,19-20,22-23,31H,12-14H2,1H3,(H,28,32)/t19-,20-,22+,23-/m0/s1	QUSVXALKSRSRLD-RLBLXZPPSA-N	CN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@H]12)C(=O)NCc5ccccn5	BroadT	BRD-K29390829	BRD-K29390829-001-01-4	Broad Institute of MIT and Harvard	BRD-K29390829			CN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]12)C(=O)NCc1ccccn1	InChI=1S/C25H25FN4O3/c1-29-22-19(20(14-31)23(29)24(32)28-12-17-7-2-3-10-27-17)13-30-21(22)9-8-18(25(30)33)15-5-4-6-16(26)11-15/h2-11,19-20,22-23,31H,12-14H2,1H3,(H,28,32)/t19-,20-,22+,23-/m0/s1	QUSVXALKSRSRLD-RLBLXZPPSA-N	448.1910689							98833
BRD-M76969896	LSM-45064		54661338	InChI=1S/C27H33FN4O4/c1-4-8-17-11-12-21-24-23(25(34)29-13-7-14-30(2)3)19(16-33)22(15-31(21)26(17)35)32(24)27(36)18-9-5-6-10-20(18)28/h4-6,8-12,19,22-24,33H,7,13-16H2,1-3H3,(H,29,34)/t19-,22-,23+,24+/m1/s1	ZXRDMZYXGOPOHF-JFTIXFDTSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3C(=O)c4ccccc4F)C(=O)NCCCN(C)C	BroadT	BRD-M76969896	BRD-M76969896-001-01-3	Broad Institute of MIT and Harvard	BRD-M76969896		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCCN(C)C)[C@H]2N3C(=O)c2ccccc2F)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCCN(C)C)[C@H]2N3C(=O)c2ccccc2F)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCCN(C)C)[C@H]2N3C(=O)c2ccccc2F)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCCN(C)C)[C@H]2N3C(=O)c2ccccc2F)c1=O	InChI=1S/2C27H33FN4O4/c2*1-4-8-17-11-12-21-24-23(25(34)29-13-7-14-30(2)3)19(16-33)22(15-31(21)26(17)35)32(24)27(36)18-9-5-6-10-20(18)28/h2*4-6,8-12,19,22-24,33H,7,13-16H2,1-3H3,(H,29,34)/b8-4+;8-4-/t2*19-,22-,23+,24+/m11/s1	HYTUMCUDYCUVDJ-JHGZHARESA-N	496.248583776							103301
BRD-M88044810	LSM-45075		54661357	InChI=1S/C25H31N3O3/c1-4-8-18-11-12-20-23-22(25(31)26(2)3)19(16-29)21(15-28(20)24(18)30)27(23)14-13-17-9-6-5-7-10-17/h4-12,19,21-23,29H,13-16H2,1-3H3/t19-,21-,22+,23+/m1/s1	IMLNKYQDLHUNSC-LGKPFJOYSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3CCc4ccccc4)C(=O)N(C)C	BroadT	BRD-M88044810	BRD-M88044810-001-01-4	Broad Institute of MIT and Harvard	BRD-M88044810		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N(C)C)[C@H]2N3CCc2ccccc2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N(C)C)[C@H]2N3CCc2ccccc2)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N(C)C)[C@H]2N3CCc2ccccc2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N(C)C)[C@H]2N3CCc2ccccc2)c1=O	InChI=1S/2C25H31N3O3/c2*1-4-8-18-11-12-20-23-22(25(31)26(2)3)19(16-29)21(15-28(20)24(18)30)27(23)14-13-17-9-6-5-7-10-17/h2*4-12,19,21-23,29H,13-16H2,1-3H3/b8-4+;8-4-/t2*19-,21-,22+,23+/m11/s1	DXCGDKXJJDOURF-KRJWZJQASA-N	421.236541882							103312
BRD-K01520647	LSM-8528		54661051	InChI=1S/C28H30N4O4/c33-18-22-24-17-32-23(9-8-21(27(32)34)20-6-2-1-3-7-20)26(31(24)16-19-5-4-10-29-15-19)25(22)28(35)30-11-13-36-14-12-30/h1-10,15,22,24-26,33H,11-14,16-18H2/t22-,24-,25+,26+/m1/s1	UHLPFNSCOMKACG-BPHNFWMXSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@@H]([C@H]1C(=O)N5CCOCC5)N2Cc6cccnc6	BroadT	BRD-K01520647	BRD-K01520647-001-01-8	Broad Institute of MIT and Harvard	BRD-K01520647			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]([C@H]1C(=O)N1CCOCC1)N2Cc1cccnc1	InChI=1S/C28H30N4O4/c33-18-22-24-17-32-23(9-8-21(27(32)34)20-6-2-1-3-7-20)26(31(24)16-19-5-4-10-29-15-19)25(22)28(35)30-11-13-36-14-12-30/h1-10,15,22,24-26,33H,11-14,16-18H2/t22-,24-,25+,26+/m1/s1	UHLPFNSCOMKACG-BPHNFWMXSA-N	486.22670548							97149
BRD-K25755601	LSM-9991		54661138	InChI=1S/C24H21F2N5O4/c25-14-6-13(7-15(26)8-14)9-29-23(34)21-16(12-32)19-11-30-18(2-1-3-20(30)33)22(21)31(19)24(35)17-10-27-4-5-28-17/h1-8,10,16,19,21-22,32H,9,11-12H2,(H,29,34)/t16-,19-,21+,22+/m0/s1	KPHBLEYIQPKXAE-NTSGDEEZSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)NCc4cc(F)cc(F)c4)N2C(=O)c5cnccn5	BroadT	BRD-K25755601	BRD-K25755601-001-01-6	Broad Institute of MIT and Harvard	BRD-K25755601			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NCc1cc(F)cc(F)c1)N2C(=O)c1cnccn1	InChI=1S/C24H21F2N5O4/c25-14-6-13(7-15(26)8-14)9-29-23(34)21-16(12-32)19-11-30-18(2-1-3-20(30)33)22(21)31(19)24(35)17-10-27-4-5-28-17/h1-8,10,16,19,21-22,32H,9,11-12H2,(H,29,34)/t16-,19-,21+,22+/m0/s1	KPHBLEYIQPKXAE-NTSGDEEZSA-N	481.156160602							98612
BRD-K43411248	LSM-11068		54661168	InChI=1S/C25H23FN2O4/c26-20-9-5-4-8-16(20)12-28-22-18(19(14-29)23(28)25(31)32)13-27-21(22)11-10-17(24(27)30)15-6-2-1-3-7-15/h1-11,18-19,22-23,29H,12-14H2,(H,31,32)/t18-,19-,22+,23-/m1/s1	CTVHZJUSZJAUDM-PJIZGREPSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@H]2N(Cc5ccccc5F)[C@H]1C(=O)O	BroadT	BRD-K43411248	BRD-K43411248-001-01-3	Broad Institute of MIT and Harvard	BRD-K43411248			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]2N(Cc2ccccc2F)[C@H]1C(O)=O	InChI=1S/C25H23FN2O4/c26-20-9-5-4-8-16(20)12-28-22-18(19(14-29)23(28)25(31)32)13-27-21(22)11-10-17(24(27)30)15-6-2-1-3-7-15/h1-11,18-19,22-23,29H,12-14H2,(H,31,32)/t18-,19-,22+,23-/m1/s1	CTVHZJUSZJAUDM-PJIZGREPSA-N	434.164185436							99689
BRD-K49383373	LSM-11430		54661101	InChI=1S/C27H28FN3O3/c1-16(17-8-4-3-5-9-17)29-26(33)24-20(15-32)23-14-31-22(25(24)30(23)2)13-12-19(27(31)34)18-10-6-7-11-21(18)28/h3-13,16,20,23-25,32H,14-15H2,1-2H3,(H,29,33)/t16-,20-,23-,24+,25+/m1/s1	XOPHINQZQCNQKH-XDPKZGBUSA-N	C[C@@H](NC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]1N2C)c5ccccc5	BroadT	BRD-K49383373	BRD-K49383373-001-01-5	Broad Institute of MIT and Harvard	BRD-K49383373			C[C@@H](NC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]1N2C)c1ccccc1	InChI=1S/C27H28FN3O3/c1-16(17-8-4-3-5-9-17)29-26(33)24-20(15-32)23-14-31-22(25(24)30(23)2)13-12-19(27(31)34)18-10-6-7-11-21(18)28/h3-13,16,20,23-25,32H,14-15H2,1-2H3,(H,29,33)/t16-,20-,23-,24+,25+/m1/s1	XOPHINQZQCNQKH-XDPKZGBUSA-N	461.211469986							100051
BRD-K09876067	LSM-9034		54661239	InChI=1S/C25H31N3O4/c1-3-26-24(30)22-19(14-29)21-13-28-20(23(22)27(21)12-15-4-5-15)11-10-18(25(28)31)16-6-8-17(32-2)9-7-16/h6-11,15,19,21-23,29H,3-5,12-14H2,1-2H3,(H,26,30)/t19-,21-,22+,23+/m0/s1	ZKVVKUIGPSFRPG-KZKAQZJJSA-N	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccc(OC)cc4)[C@H]1N2CC5CC5	BroadT	BRD-K09876067	BRD-K09876067-001-01-7	Broad Institute of MIT and Harvard	BRD-K09876067			CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccc(OC)cc4)c3=O)[C@H]1N2CC1CC1	InChI=1S/C25H31N3O4/c1-3-26-24(30)22-19(14-29)21-13-28-20(23(22)27(21)12-15-4-5-15)11-10-18(25(28)31)16-6-8-17(32-2)9-7-16/h6-11,15,19,21-23,29H,3-5,12-14H2,1-2H3,(H,26,30)/t19-,21-,22+,23+/m0/s1	ZKVVKUIGPSFRPG-KZKAQZJJSA-N	437.231456502							97655
MLS005000217	LSM-12251	BRD-K62902932	54661175	InChI=1S/C21H25N5O3/c27-11-15-17-10-25-16(2-1-3-18(25)28)20(26(17)9-13-4-5-13)19(15)21(29)23-8-14-6-7-22-12-24-14/h1-3,6-7,12-13,15,17,19-20,27H,4-5,8-11H2,(H,23,29)/t15-,17-,19+,20+/m1/s1	QFGPTMNHKNKAJU-BEKAIBRUSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)NCc4ccncn4)N2CC5CC5	BroadT	BRD-K62902932	BRD-K62902932-001-01-8	Broad Institute of MIT and Harvard	BRD-K62902932			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NCc1ccncn1)N2CC1CC1	InChI=1S/C21H25N5O3/c27-11-15-17-10-25-16(2-1-3-18(25)28)20(26(17)9-13-4-5-13)19(15)21(29)23-8-14-6-7-22-12-24-14/h1-3,6-7,12-13,15,17,19-20,27H,4-5,8-11H2,(H,23,29)/t15-,17-,19+,20+/m1/s1	QFGPTMNHKNKAJU-BEKAIBRUSA-N	395.19573971							100877
BRD-K87833465	LSM-13813		54661244	InChI=1S/C21H25N5O3/c27-11-16-15-10-25-17(2-1-3-18(25)28)19(15)26(9-14-6-22-12-23-7-14)20(16)21(29)24-8-13-4-5-13/h1-3,6-7,12-13,15-16,19-20,27H,4-5,8-11H2,(H,24,29)/t15-,16-,19+,20-/m0/s1	RTAKVDRHOCSOCY-FEHORTKBSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N(Cc4cncnc4)[C@@H]1C(=O)NCC5CC5	BroadT	BRD-K87833465	BRD-K87833465-001-01-1	Broad Institute of MIT and Harvard	BRD-K87833465			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N(Cc2cncnc2)[C@@H]1C(=O)NCC1CC1	InChI=1S/C21H25N5O3/c27-11-16-15-10-25-17(2-1-3-18(25)28)19(15)26(9-14-6-22-12-23-7-14)20(16)21(29)24-8-13-4-5-13/h1-3,6-7,12-13,15-16,19-20,27H,4-5,8-11H2,(H,24,29)/t15-,16-,19+,20-/m0/s1	RTAKVDRHOCSOCY-FEHORTKBSA-N	395.19573971							102462
BRD-K04061325	LSM-8678		54661204	InChI=1S/C29H36N4O3/c34-18-23-25-17-33-24(9-8-22(29(33)36)21-4-2-1-3-5-21)27(32(25)16-20-6-7-20)26(23)28(35)31-15-12-19-10-13-30-14-11-19/h4,8-11,13-14,20,23,25-27,34H,1-3,5-7,12,15-18H2,(H,31,35)/t23-,25-,26+,27+/m1/s1	FIQPJBHILIXVDO-ZDEZRRDYSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@@H]([C@H]1C(=O)NCCc4ccncc4)N2CC5CC5)C6=CCCCC6	BroadT	BRD-K04061325	BRD-K04061325-001-01-9	Broad Institute of MIT and Harvard	BRD-K04061325			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]([C@H]1C(=O)NCCc1ccncc1)N2CC1CC1	InChI=1S/C29H36N4O3/c34-18-23-25-17-33-24(9-8-22(29(33)36)21-4-2-1-3-5-21)27(32(25)16-20-6-7-20)26(23)28(35)31-15-12-19-10-13-30-14-11-19/h4,8-11,13-14,20,23,25-27,34H,1-3,5-7,12,15-18H2,(H,31,35)/t23-,25-,26+,27+/m1/s1	FIQPJBHILIXVDO-ZDEZRRDYSA-N	488.278741052							97299
BRD-K58593815	LSM-11965		54661302	InChI=1S/C26H28N4O3/c1-29-22-15-30-21(10-9-19(26(30)33)18-8-5-12-27-14-18)24(29)23(20(22)16-31)25(32)28-13-11-17-6-3-2-4-7-17/h2-10,12,14,20,22-24,31H,11,13,15-16H2,1H3,(H,28,32)/t20-,22-,23+,24+/m0/s1	MSLHGMMBDZHUMV-IQFVJIFQSA-N	CN1[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCc5ccccc5	BroadT	BRD-K58593815	BRD-K58593815-001-01-3	Broad Institute of MIT and Harvard	BRD-K58593815			CN1[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCc1ccccc1	InChI=1S/C26H28N4O3/c1-29-22-15-30-21(10-9-19(26(30)33)18-8-5-12-27-14-18)24(29)23(20(22)16-31)25(32)28-13-11-17-6-3-2-4-7-17/h2-10,12,14,20,22-24,31H,11,13,15-16H2,1H3,(H,28,32)/t20-,22-,23+,24+/m0/s1	MSLHGMMBDZHUMV-IQFVJIFQSA-N	444.216140796							100591
BRD-M85886474	LSM-45072		54661370	InChI=1S/C25H33N3O4/c1-2-7-16-10-11-19-22-21(25(32)26-12-4-3-5-13-26)18(15-29)20(14-27(19)23(16)30)28(22)24(31)17-8-6-9-17/h2,7,10-11,17-18,20-22,29H,3-6,8-9,12-15H2,1H3/t18-,20-,21+,22+/m0/s1	RGMNVADEAWNQHQ-VXSCBNMQSA-N	CC=CC1=CC=C2[C@@H]3[C@@H]([C@@H](CO)[C@H](CN2C1=O)N3C(=O)C4CCC4)C(=O)N5CCCCC5	BroadT	BRD-M85886474	BRD-M85886474-001-01-8	Broad Institute of MIT and Harvard	BRD-M85886474		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N4CCCCC4)[C@@H]2N3C(=O)C2CCC2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N4CCCCC4)[C@@H]2N3C(=O)C2CCC2)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N4CCCCC4)[C@@H]2N3C(=O)C2CCC2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N4CCCCC4)[C@@H]2N3C(=O)C2CCC2)c1=O	InChI=1S/2C25H33N3O4/c2*1-2-7-16-10-11-19-22-21(25(32)26-12-4-3-5-13-26)18(15-29)20(14-27(19)23(16)30)28(22)24(31)17-8-6-9-17/h2*2,7,10-11,17-18,20-22,29H,3-6,8-9,12-15H2,1H3/b7-2+;7-2-/t2*18-,20-,21+,22+/m00/s1	WJKJVCBRAFWZEB-IRIPNOOASA-N	439.247106566							103309
BRD-M60886831	LSM-45052		54661388	InChI=1S/C23H23F3N4O4/c1-2-4-13-6-7-17-18-15(10-29(17)21(13)33)16(11-31)19(20(32)28-12-23(24,25)26)30(18)22(34)14-5-3-8-27-9-14/h2-9,15-16,18-19,31H,10-12H2,1H3,(H,28,32)/t15-,16-,18+,19-/m1/s1	HTNUCZUVQLGPFO-ZAWLATJESA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3C(=O)c4cccnc4)C(=O)NCC(F)(F)F	BroadT	BRD-M60886831	BRD-M60886831-001-01-5	Broad Institute of MIT and Harvard	BRD-M60886831		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCC(F)(F)F)N(C(=O)c4cccnc4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCC(F)(F)F)N(C(=O)c4cccnc4)[C@H]23)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCC(F)(F)F)N(C(=O)c4cccnc4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCC(F)(F)F)N(C(=O)c4cccnc4)[C@H]23)c1=O	InChI=1S/2C23H23F3N4O4/c2*1-2-4-13-6-7-17-18-15(10-29(17)21(13)33)16(11-31)19(20(32)28-12-23(24,25)26)30(18)22(34)14-5-3-8-27-9-14/h2*2-9,15-16,18-19,31H,10-12H2,1H3,(H,28,32)/b4-2+;4-2-/t2*15-,16-,18+,19-/m11/s1	MMSVXHZGTZHGPG-NUKVJJGHSA-N	476.167139856							103289
BRD-K85727265	LSM-13677		54661249	InChI=1S/C27H36N4O4/c1-2-30-23-17-31-22(10-9-20(27(31)34)19-7-4-3-5-8-19)25(30)24(21(23)18-32)26(33)28-11-6-12-29-13-15-35-16-14-29/h3-5,7-10,21,23-25,32H,2,6,11-18H2,1H3,(H,28,33)/t21-,23-,24+,25+/m0/s1	VXNMHMGWLBIVRP-VLYJIQRVSA-N	CCN1[C@H]2CN3C(=O)C(=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCCN4CCOCC4)c5ccccc5	BroadT	BRD-K85727265	BRD-K85727265-001-01-9	Broad Institute of MIT and Harvard	BRD-K85727265			CCN1[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCCN1CCOCC1	InChI=1S/C27H36N4O4/c1-2-30-23-17-31-22(10-9-20(27(31)34)19-7-4-3-5-8-19)25(30)24(21(23)18-32)26(33)28-11-6-12-29-13-15-35-16-14-29/h3-5,7-10,21,23-25,32H,2,6,11-18H2,1H3,(H,28,33)/t21-,23-,24+,25+/m0/s1	VXNMHMGWLBIVRP-VLYJIQRVSA-N	480.273655672							102324
BRD-M91342002	LSM-45080		54661426	InChI=1S/C25H30FN3O3/c1-3-5-17-8-11-20-23-22(24(31)27-13-16-6-9-18(26)10-7-16)19(15-30)21(28(23)12-4-2)14-29(20)25(17)32/h3,5-11,19,21-23,30H,4,12-15H2,1-2H3,(H,27,31)/t19-,21-,22+,23+/m0/s1	USKAOISCUCDLDP-KZKAQZJJSA-N	CCCN1[C@H]2CN3C(=CC=C(C=CC)C3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc4ccc(F)cc4	BroadT	BRD-M91342002	BRD-M91342002-001-01-5	Broad Institute of MIT and Harvard	BRD-M91342002		CCCN1[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1[C@H](C(=O)NCc1ccc(F)cc1)[C@H]2CO.CCCN1[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]1[C@H](C(=O)NCc1ccc(F)cc1)[C@H]2CO	CCCN1[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1[C@H](C(=O)NCc1ccc(F)cc1)[C@H]2CO.CCCN1[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]1[C@H](C(=O)NCc1ccc(F)cc1)[C@H]2CO	InChI=1S/2C25H30FN3O3/c2*1-3-5-17-8-11-20-23-22(24(31)27-13-16-6-9-18(26)10-7-16)19(15-30)21(28(23)12-4-2)14-29(20)25(17)32/h2*3,5-11,19,21-23,30H,4,12-15H2,1-2H3,(H,27,31)/b5-3+;5-3-/t2*19-,21-,22+,23+/m00/s1	GGIDMMYQUXUKCO-XCCFBOGYSA-N	439.22712005							103317
BRD-M40773246	LSM-45032		54661116	InChI=1S/C27H28FN5O3/c1-2-3-19-6-9-23-24-21(14-32(23)27(19)36)22(15-34)25(33(24)13-18-10-29-16-30-11-18)26(35)31-12-17-4-7-20(28)8-5-17/h2-11,16,21-22,24-25,34H,12-15H2,1H3,(H,31,35)/t21-,22-,24+,25-/m1/s1	LGAKJZSEUNBQTH-YQIMAOPZSA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3Cc4cncnc4)C(=O)NCc5ccc(F)cc5	BroadT	BRD-M40773246	BRD-M40773246-001-01-9	Broad Institute of MIT and Harvard	BRD-M40773246		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4ccc(F)cc4)N(Cc4cncnc4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4ccc(F)cc4)N(Cc4cncnc4)[C@H]23)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4ccc(F)cc4)N(Cc4cncnc4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4ccc(F)cc4)N(Cc4cncnc4)[C@H]23)c1=O	InChI=1S/2C27H28FN5O3/c2*1-2-3-19-6-9-23-24-21(14-32(23)27(19)36)22(15-34)25(33(24)13-18-10-29-16-30-11-18)26(35)31-12-17-4-7-20(28)8-5-17/h2*2-11,16,21-22,24-25,34H,12-15H2,1H3,(H,31,35)/b3-2+;3-2-/t2*21-,22-,24+,25-/m11/s1	AGZSFSMFFQULRF-IVUMAWKZSA-N	489.217618006							103269
BRD-K54565270	LSM-11739		54661160	InChI=1S/C24H27F3N4O4/c1-29(2)22(34)14-6-4-5-13(9-14)15-7-8-17-20-19(21(33)28-12-24(25,26)27)16(11-32)18(30(20)3)10-31(17)23(15)35/h4-9,16,18-20,32H,10-12H2,1-3H3,(H,28,33)/t16-,18-,19+,20+/m0/s1	KOJKRQVKKNDDMT-IJXRJRJASA-N	CN(C)C(=O)c1cccc(c1)C2=CC=C3[C@@H]4[C@@H]([C@@H](CO)[C@H](CN3C2=O)N4C)C(=O)NCC(F)(F)F	BroadT	BRD-K54565270	BRD-K54565270-001-01-3	Broad Institute of MIT and Harvard	BRD-K54565270			CN(C)C(=O)c1cccc(c1)-c1ccc2[C@@H]3[C@@H]([C@@H](CO)[C@H](Cn2c1=O)N3C)C(=O)NCC(F)(F)F	InChI=1S/C24H27F3N4O4/c1-29(2)22(34)14-6-4-5-13(9-14)15-7-8-17-20-19(21(33)28-12-24(25,26)27)16(11-32)18(30(20)3)10-31(17)23(15)35/h4-9,16,18-20,32H,10-12H2,1-3H3,(H,28,33)/t16-,18-,19+,20+/m0/s1	KOJKRQVKKNDDMT-IJXRJRJASA-N	492.198439984							100364
BRD-K82779934-001-01-4	LSM-44167	BRD-K82779934	54661036	InChI=1S/C29H31N5O3/c35-17-24-23-16-33-25(12-11-21(29(33)37)10-9-19-5-2-1-3-6-19)26(23)34(15-20-13-30-18-31-14-20)27(24)28(36)32-22-7-4-8-22/h1-3,5-6,9-14,18,22-24,26-27,35H,4,7-8,15-17H2,(H,32,36)/b10-9+/t23-,24-,26+,27-/m1/s1	FXEKXDJWVVQJEU-HJLMAQGISA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H]2N(Cc4cncnc4)[C@H]1C(=O)NC5CCC5)\C=C\c6ccccc6	BroadT	BRD-K82779934	BRD-K82779934-001-01-4	Broad Institute of MIT and Harvard	BRD-K82779934			OC[C@@H]1[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]2N(Cc2cncnc2)[C@H]1C(=O)NC1CCC1	InChI=1S/C29H31N5O3/c35-17-24-23-16-33-25(12-11-21(29(33)37)10-9-19-5-2-1-3-6-19)26(23)34(15-20-13-30-18-31-14-20)27(24)28(36)32-22-7-4-8-22/h1-3,5-6,9-14,18,22-24,26-27,35H,4,7-8,15-17H2,(H,32,36)/b10-9+/t23-,24-,26+,27-/m1/s1	FXEKXDJWVVQJEU-HJLMAQGISA-N	497.242689902							
BRD-K20016217	LSM-9644		54661347	InChI=1S/C28H30FN3O4/c1-3-31-25-21(22(16-33)26(31)27(34)30-14-17-8-10-18(29)11-9-17)15-32-23(25)13-12-20(28(32)35)19-6-4-5-7-24(19)36-2/h4-13,21-22,25-26,33H,3,14-16H2,1-2H3,(H,30,34)/t21-,22-,25+,26-/m1/s1	YMOXWRNKFBHBMI-ULDOEVFSSA-N	CCN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@@H]12)C(=O)NCc5ccc(F)cc5	BroadT	BRD-K20016217	BRD-K20016217-001-01-4	Broad Institute of MIT and Harvard	BRD-K20016217			CCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@@H]12)C(=O)NCc1ccc(F)cc1	InChI=1S/C28H30FN3O4/c1-3-31-25-21(22(16-33)26(31)27(34)30-14-17-8-10-18(29)11-9-17)15-32-23(25)13-12-20(28(32)35)19-6-4-5-7-24(19)36-2/h4-13,21-22,25-26,33H,3,14-16H2,1-2H3,(H,30,34)/t21-,22-,25+,26-/m1/s1	YMOXWRNKFBHBMI-ULDOEVFSSA-N	491.22203467							98265
BRD-K81054062	LSM-13387		54661453	InChI=1S/C25H28FN3O3/c26-17-8-6-15(7-9-17)12-27-24(31)22-19(14-30)20-13-29-21(23(22)28-20)11-10-18(25(29)32)16-4-2-1-3-5-16/h4,6-11,19-20,22-23,28,30H,1-3,5,12-14H2,(H,27,31)/t19-,20-,22+,23+/m0/s1	NDSDOOPKNRYURC-JFJDKTSWSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H](N2)[C@@H]1C(=O)NCc4ccc(F)cc4)C5=CCCCC5	BroadT	BRD-K81054062	BRD-K81054062-001-01-7	Broad Institute of MIT and Harvard	BRD-K81054062			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H](N2)[C@@H]1C(=O)NCc1ccc(F)cc1	InChI=1S/C25H28FN3O3/c26-17-8-6-15(7-9-17)12-27-24(31)22-19(14-30)20-13-29-21(23(22)28-20)11-10-18(25(29)32)16-4-2-1-3-5-16/h4,6-11,19-20,22-23,28,30H,1-3,5,12-14H2,(H,27,31)/t19-,20-,22+,23+/m0/s1	NDSDOOPKNRYURC-JFJDKTSWSA-N	437.211469986							102026
BRD-K33064169	LSM-10441		54661260	InChI=1S/C30H37N3O3/c34-19-25-24-18-33-26(12-11-23(29(33)35)22-9-5-2-6-10-22)27(24)31-28(25)30(36)32-15-13-21(14-16-32)17-20-7-3-1-4-8-20/h1,3-4,7-9,11-12,21,24-25,27-28,31,34H,2,5-6,10,13-19H2/t24-,25-,27+,28-/m1/s1	FDPYZAHJFSZBPH-QKBZBAIHSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H]2N[C@H]1C(=O)N4CCC(Cc5ccccc5)CC4)C6=CCCCC6	BroadT	BRD-K33064169	BRD-K33064169-001-01-7	Broad Institute of MIT and Harvard	BRD-K33064169			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]2N[C@H]1C(=O)N1CCC(Cc2ccccc2)CC1	InChI=1S/C30H37N3O3/c34-19-25-24-18-33-26(12-11-23(29(33)35)22-9-5-2-6-10-22)27(24)31-28(25)30(36)32-15-13-21(14-16-32)17-20-7-3-1-4-8-20/h1,3-4,7-9,11-12,21,24-25,27-28,31,34H,2,5-6,10,13-19H2/t24-,25-,27+,28-/m1/s1	FDPYZAHJFSZBPH-QKBZBAIHSA-N	487.283492074							99062
BRD-K71761800	LSM-12821		54661438	InChI=1S/C25H26N4O3/c1-2-28-21-14-29-20(9-8-18(25(29)32)16-10-12-26-13-11-16)23(28)22(19(21)15-30)24(31)27-17-6-4-3-5-7-17/h3-13,19,21-23,30H,2,14-15H2,1H3,(H,27,31)/t19-,21-,22+,23+/m1/s1	OPFBOJMKCVWWQL-LGKPFJOYSA-N	CCN1[C@@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@H]1[C@H]([C@@H]2CO)C(=O)Nc5ccccc5	BroadT	BRD-K71761800	BRD-K71761800-001-01-6	Broad Institute of MIT and Harvard	BRD-K71761800			CCN1[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)Nc1ccccc1	InChI=1S/C25H26N4O3/c1-2-28-21-14-29-20(9-8-18(25(29)32)16-10-12-26-13-11-16)23(28)22(19(21)15-30)24(31)27-17-6-4-3-5-7-17/h3-13,19,21-23,30H,2,14-15H2,1H3,(H,27,31)/t19-,21-,22+,23+/m1/s1	OPFBOJMKCVWWQL-LGKPFJOYSA-N	430.200490732							101458
BRD-K06482871	LSM-8808		54661348	InChI=1S/C28H30FN3O4/c1-3-31-25-21(22(16-33)26(31)27(34)30-14-17-8-10-18(29)11-9-17)15-32-23(25)13-12-20(28(32)35)19-6-4-5-7-24(19)36-2/h4-13,21-22,25-26,33H,3,14-16H2,1-2H3,(H,30,34)/t21-,22-,25+,26-/m0/s1	YMOXWRNKFBHBMI-RLBRRGQKSA-N	CCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@H]12)C(=O)NCc5ccc(F)cc5	BroadT	BRD-K06482871	BRD-K06482871-001-01-3	Broad Institute of MIT and Harvard	BRD-K06482871			CCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@H]12)C(=O)NCc1ccc(F)cc1	InChI=1S/C28H30FN3O4/c1-3-31-25-21(22(16-33)26(31)27(34)30-14-17-8-10-18(29)11-9-17)15-32-23(25)13-12-20(28(32)35)19-6-4-5-7-24(19)36-2/h4-13,21-22,25-26,33H,3,14-16H2,1-2H3,(H,30,34)/t21-,22-,25+,26-/m0/s1	YMOXWRNKFBHBMI-RLBRRGQKSA-N	491.22203467							97429
BRD-K14356681	LSM-9295		54661246	InChI=1S/C27H34N4O5/c1-3-12-28-27(35)31-22-14-30-21(11-10-19(26(30)34)16-6-4-9-18(13-16)36-2)24(31)23(20(22)15-32)25(33)29-17-7-5-8-17/h4,6,9-11,13,17,20,22-24,32H,3,5,7-8,12,14-15H2,1-2H3,(H,28,35)(H,29,33)/t20-,22-,23+,24+/m0/s1	BCMXGMGGSHUCMP-IQFVJIFQSA-N	CCCNC(=O)N1[C@H]2CN3C(=O)C(=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)NC4CCC4)c5cccc(OC)c5	BroadT	BRD-K14356681	BRD-K14356681-001-01-9	Broad Institute of MIT and Harvard	BRD-K14356681			CCCNC(=O)N1[C@H]2Cn3c(ccc(-c4cccc(OC)c4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NC1CCC1	InChI=1S/C27H34N4O5/c1-3-12-28-27(35)31-22-14-30-21(11-10-19(26(30)34)16-6-4-9-18(13-16)36-2)24(31)23(20(22)15-32)25(33)29-17-7-5-8-17/h4,6,9-11,13,17,20,22-24,32H,3,5,7-8,12,14-15H2,1-2H3,(H,28,35)(H,29,33)/t20-,22-,23+,24+/m0/s1	BCMXGMGGSHUCMP-IQFVJIFQSA-N	494.252920228							97916
BRD-M45350951	LSM-45036		54661228	InChI=1S/C26H35N5O5/c1-2-4-18-5-6-21-24-23(25(33)27-7-3-8-29-9-11-35-12-10-29)20(15-32)22(14-31(21)26(18)34)30(24)13-19-16-36-17-28-19/h2,4-6,16-17,20,22-24,32H,3,7-15H2,1H3,(H,27,33)/t20-,22-,23+,24+/m0/s1	PCOBEWZBZDTQSP-IQFVJIFQSA-N	CC=CC1=CC=C2[C@@H]3[C@@H]([C@@H](CO)[C@H](CN2C1=O)N3Cc4cocn4)C(=O)NCCCN5CCOCC5	BroadT	BRD-M45350951	BRD-M45350951-001-01-6	Broad Institute of MIT and Harvard	BRD-M45350951		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCCN4CCOCC4)[C@@H]2N3Cc2ncoc2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCCN4CCOCC4)[C@@H]2N3Cc2ncoc2)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCCN4CCOCC4)[C@@H]2N3Cc2ncoc2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCCN4CCOCC4)[C@@H]2N3Cc2ncoc2)c1=O	InChI=1S/2C26H35N5O5/c2*1-2-4-18-5-6-21-24-23(25(33)27-7-3-8-29-9-11-35-12-10-29)20(15-32)22(14-31(21)26(18)34)30(24)13-19-16-36-17-28-19/h2*2,4-6,16-17,20,22-24,32H,3,7-15H2,1H3,(H,27,33)/b4-2+;4-2-/t2*20-,22-,23+,24+/m00/s1	BHAQUFGGEAXVJP-GOESXOETSA-N	497.26381927							103273
BRD-K89440651	LSM-13940		54661424	InChI=1S/C25H30N4O4/c1-28(2)24(32)16-5-3-4-15(10-16)17-8-9-20-21-18(12-29(20)25(17)33)19(13-30)22(27-21)23(31)26-11-14-6-7-14/h3-5,8-10,14,18-19,21-22,27,30H,6-7,11-13H2,1-2H3,(H,26,31)/t18-,19-,21+,22-/m0/s1	BQHFMDKBCXXEDN-MPJJRAAHSA-N	CN(C)C(=O)c1cccc(c1)C2=CC=C3[C@@H]4N[C@@H]([C@@H](CO)[C@@H]4CN3C2=O)C(=O)NCC5CC5	BroadT	BRD-K89440651	BRD-K89440651-001-01-7	Broad Institute of MIT and Harvard	BRD-K89440651			CN(C)C(=O)c1cccc(c1)-c1ccc2[C@@H]3N[C@@H]([C@@H](CO)[C@@H]3Cn2c1=O)C(=O)NCC1CC1	InChI=1S/C25H30N4O4/c1-28(2)24(32)16-5-3-4-15(10-16)17-8-9-20-21-18(12-29(20)25(17)33)19(13-30)22(27-21)23(31)26-11-14-6-7-14/h3-5,8-10,14,18-19,21-22,27,30H,6-7,11-13H2,1-2H3,(H,26,31)/t18-,19-,21+,22-/m0/s1	BQHFMDKBCXXEDN-MPJJRAAHSA-N	450.22670548							102593
BRD-K96779965	LSM-14374		54661100	InChI=1S/C21H21F4N3O3/c1-27-17-13(14(9-29)18(27)19(30)26-10-21(23,24)25)8-28-16(17)7-6-12(20(28)31)11-4-2-3-5-15(11)22/h2-7,13-14,17-18,29H,8-10H2,1H3,(H,26,30)/t13-,14-,17+,18-/m0/s1	IFOYIUHYIPKUPM-ZZCKCESHSA-N	CN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]12)C(=O)NCC(F)(F)F	BroadT	BRD-K96779965	BRD-K96779965-001-01-0	Broad Institute of MIT and Harvard	BRD-K96779965			CN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]12)C(=O)NCC(F)(F)F	InChI=1S/C21H21F4N3O3/c1-27-17-13(14(9-29)18(27)19(30)26-10-21(23,24)25)8-28-16(17)7-6-12(20(28)31)11-4-2-3-5-15(11)22/h2-7,13-14,17-18,29H,8-10H2,1H3,(H,26,30)/t13-,14-,17+,18-/m0/s1	IFOYIUHYIPKUPM-ZZCKCESHSA-N	439.151904362							103028
BRD-M58692868	LSM-45050		54661040	InChI=1S/C26H33N5O4/c1-3-5-16-8-9-21-22-19(13-30(21)25(16)34)20(14-32)23(31(22)26(35)17-6-4-7-17)24(33)27-11-10-18-12-29(2)15-28-18/h3,5,8-9,12,15,17,19-20,22-23,32H,4,6-7,10-11,13-14H2,1-2H3,(H,27,33)/t19-,20-,22+,23-/m0/s1	UQZMKBRPQWZRBW-RLBLXZPPSA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3C(=O)C4CCC4)C(=O)NCCc5cn(C)cn5	BroadT	BRD-M58692868	BRD-M58692868-001-01-7	Broad Institute of MIT and Harvard	BRD-M58692868		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCc4ncn(C)c4)N(C(=O)C4CCC4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCc4ncn(C)c4)N(C(=O)C4CCC4)[C@@H]23)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCc4ncn(C)c4)N(C(=O)C4CCC4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCc4ncn(C)c4)N(C(=O)C4CCC4)[C@@H]23)c1=O	InChI=1S/2C26H33N5O4/c2*1-3-5-16-8-9-21-22-19(13-30(21)25(16)34)20(14-32)23(31(22)26(35)17-6-4-7-17)24(33)27-11-10-18-12-29(2)15-28-18/h2*3,5,8-9,12,15,17,19-20,22-23,32H,4,6-7,10-11,13-14H2,1-2H3,(H,27,33)/b5-3+;5-3-/t2*19-,20-,22+,23-/m00/s1	KFLXYRYRDPTUGX-DJTCQFJVSA-N	479.253254586							103287
BRD-K18481678	LSM-9543		54661233	InChI=1S/C25H30N4O4/c30-15-18-20-14-28-19(9-4-10-21(28)31)23(29(20)25(33)17-8-5-11-26-13-17)22(18)24(32)27-12-16-6-2-1-3-7-16/h4-5,8-11,13,16,18,20,22-23,30H,1-3,6-7,12,14-15H2,(H,27,32)/t18-,20-,22+,23+/m1/s1	CJMOIVLGTXOFHT-SQMBMXPBSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)NCC4CCCCC4)N2C(=O)c5cccnc5	BroadT	BRD-K18481678	BRD-K18481678-001-01-6	Broad Institute of MIT and Harvard	BRD-K18481678			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NCC1CCCCC1)N2C(=O)c1cccnc1	InChI=1S/C25H30N4O4/c30-15-18-20-14-28-19(9-4-10-21(28)31)23(29(20)25(33)17-8-5-11-26-13-17)22(18)24(32)27-12-16-6-2-1-3-7-16/h4-5,8-11,13,16,18,20,22-23,30H,1-3,6-7,12,14-15H2,(H,27,32)/t18-,20-,22+,23+/m1/s1	CJMOIVLGTXOFHT-SQMBMXPBSA-N	450.22670548							98164
BRD-M17304464	LSM-45007		54661288	InChI=1S/C22H26N4O3/c1-3-6-14-8-9-17-20-19(21(28)24-11-15-7-4-5-10-23-15)16(13-27)18(25(20)2)12-26(17)22(14)29/h3-10,16,18-20,27H,11-13H2,1-2H3,(H,24,28)/t16-,18-,19+,20+/m0/s1	DXALFQYFVAIBRG-IJXRJRJASA-N	CC=CC1=CC=C2[C@@H]3[C@@H]([C@@H](CO)[C@H](CN2C1=O)N3C)C(=O)NCc4ccccn4	BroadT	BRD-M17304464	BRD-M17304464-001-01-7	Broad Institute of MIT and Harvard	BRD-M17304464		C\C=C\c1ccc2[C@@H]3[C@@H]([C@@H](CO)[C@H](Cn2c1=O)N3C)C(=O)NCc1ccccn1.C\C=C/c1ccc2[C@@H]3[C@@H]([C@@H](CO)[C@H](Cn2c1=O)N3C)C(=O)NCc1ccccn1	C\C=C\c1ccc2[C@@H]3[C@@H]([C@@H](CO)[C@H](Cn2c1=O)N3C)C(=O)NCc1ccccn1.C\C=C/c1ccc2[C@@H]3[C@@H]([C@@H](CO)[C@H](Cn2c1=O)N3C)C(=O)NCc1ccccn1	InChI=1S/2C22H26N4O3/c2*1-3-6-14-8-9-17-20-19(21(28)24-11-15-7-4-5-10-23-15)16(13-27)18(25(20)2)12-26(17)22(14)29/h2*3-10,16,18-20,27H,11-13H2,1-2H3,(H,24,28)/b6-3+;6-3-/t2*16-,18-,19+,20+/m00/s1	IHSKUGUXVPPFMN-CYYYMMCWSA-N	394.200490732							103244
BRD-M88429329	LSM-45078		54661181	InChI=1S/C28H35N3O3/c1-3-7-21-10-11-24-25-22(17-31(24)27(21)33)23(18-32)26(29(25)2)28(34)30-14-12-20(13-15-30)16-19-8-5-4-6-9-19/h3-11,20,22-23,25-26,32H,12-18H2,1-2H3/t22-,23-,25+,26-/m1/s1	NDQSGMPNQQNYJD-VHCQPULKSA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3C)C(=O)N4CCC(Cc5ccccc5)CC4	BroadT	BRD-M88429329	BRD-M88429329-001-01-1	Broad Institute of MIT and Harvard	BRD-M88429329		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@@H](N(C)[C@H]23)C(=O)N2CCC(CC2)Cc2ccccc2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@@H](N(C)[C@H]23)C(=O)N2CCC(CC2)Cc2ccccc2)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@@H](N(C)[C@H]23)C(=O)N2CCC(CC2)Cc2ccccc2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@@H](N(C)[C@H]23)C(=O)N2CCC(CC2)Cc2ccccc2)c1=O	InChI=1S/2C28H35N3O3/c2*1-3-7-21-10-11-24-25-22(17-31(24)27(21)33)23(18-32)26(29(25)2)28(34)30-14-12-20(13-15-30)16-19-8-5-4-6-9-19/h2*3-11,20,22-23,25-26,32H,12-18H2,1-2H3/b7-3+;7-3-/t2*22-,23-,25+,26-/m11/s1	RCRORROKKZWOHQ-QSXOYBCMSA-N	461.26784201							103315
BRD-K45466793	LSM-11200		54661410	InChI=1S/C26H30N4O4/c1-28(2)25(33)22-19(15-31)21-14-29-20(13-12-18(24(29)32)16-8-6-7-9-16)23(22)30(21)26(34)27-17-10-4-3-5-11-17/h3-5,8,10-13,19,21-23,31H,6-7,9,14-15H2,1-2H3,(H,27,34)/t19-,21-,22+,23+/m0/s1	HXGRDUONOGFVHC-KZKAQZJJSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@H]1N2C(=O)Nc5ccccc5	BroadT	BRD-K45466793	BRD-K45466793-001-01-4	Broad Institute of MIT and Harvard	BRD-K45466793			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]1N2C(=O)Nc1ccccc1	InChI=1S/C26H30N4O4/c1-28(2)25(33)22-19(15-31)21-14-29-20(13-12-18(24(29)32)16-8-6-7-9-16)23(22)30(21)26(34)27-17-10-4-3-5-11-17/h3-5,8,10-13,19,21-23,31H,6-7,9,14-15H2,1-2H3,(H,27,34)/t19-,21-,22+,23+/m0/s1	HXGRDUONOGFVHC-KZKAQZJJSA-N	462.22670548							99821
BRD-K34940426	LSM-10531		54661218	InChI=1S/C23H25F2N3O4/c24-15-4-5-18(25)14(10-15)11-28-21-16(12-27-19(21)2-1-3-20(27)30)17(13-29)22(28)23(31)26-6-8-32-9-7-26/h1-5,10,16-17,21-22,29H,6-9,11-13H2/t16-,17-,21+,22-/m0/s1	LANSPELNPINRAU-QPAOKJHLSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N(Cc4cc(F)ccc4F)[C@@H]1C(=O)N5CCOCC5	BroadT	BRD-K34940426	BRD-K34940426-001-01-6	Broad Institute of MIT and Harvard	BRD-K34940426			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N(Cc2cc(F)ccc2F)[C@@H]1C(=O)N1CCOCC1	InChI=1S/C23H25F2N3O4/c24-15-4-5-18(25)14(10-15)11-28-21-16(12-27-19(21)2-1-3-20(27)30)17(13-29)22(28)23(31)26-6-8-32-9-7-26/h1-5,10,16-17,21-22,29H,6-9,11-13H2/t16-,17-,21+,22-/m0/s1	LANSPELNPINRAU-QPAOKJHLSA-N	445.18131271							99152
BRD-K22863062	LSM-9818		54661068	InChI=1S/C27H35N5O4/c1-28(2)16-23(34)32-22-15-31-21(10-9-19(26(31)35)18-7-5-4-6-8-18)25(32)24(20(22)17-33)27(36)30-13-11-29(3)12-14-30/h4-10,20,22,24-25,33H,11-17H2,1-3H3/t20-,22-,24+,25+/m1/s1	HDUKPTJRZGCVRV-KAKDDGLXSA-N	CN(C)CC(=O)N1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@H]1[C@H]([C@@H]2CO)C(=O)N5CCN(C)CC5	BroadT	BRD-K22863062	BRD-K22863062-001-01-3	Broad Institute of MIT and Harvard	BRD-K22863062			CN(C)CC(=O)N1[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N1CCN(C)CC1	InChI=1S/C27H35N5O4/c1-28(2)16-23(34)32-22-15-31-21(10-9-19(26(31)35)18-7-5-4-6-8-18)25(32)24(20(22)17-33)27(36)30-13-11-29(3)12-14-30/h4-10,20,22,24-25,33H,11-17H2,1-3H3/t20-,22-,24+,25+/m1/s1	HDUKPTJRZGCVRV-KAKDDGLXSA-N	493.26890465							98439
BRD-K05657439	LSM-8762		54661298	InChI=1S/C28H32N4O4/c1-3-14-31-23-16-32-22(12-11-20(28(32)35)19-9-4-5-10-24(19)36-2)26(31)25(21(23)17-33)27(34)30-15-18-8-6-7-13-29-18/h4-13,21,23,25-26,33H,3,14-17H2,1-2H3,(H,30,34)/t21-,23-,25+,26+/m0/s1	HGCDJUDEQZLPFK-AAOIWRJWSA-N	CCCN1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc5ccccn5	BroadT	BRD-K05657439	BRD-K05657439-001-01-6	Broad Institute of MIT and Harvard	BRD-K05657439			CCCN1[C@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc1ccccn1	InChI=1S/C28H32N4O4/c1-3-14-31-23-16-32-22(12-11-20(28(32)35)19-9-4-5-10-24(19)36-2)26(31)25(21(23)17-33)27(34)30-15-18-8-6-7-13-29-18/h4-13,21,23,25-26,33H,3,14-17H2,1-2H3,(H,30,34)/t21-,23-,25+,26+/m0/s1	HGCDJUDEQZLPFK-AAOIWRJWSA-N	488.242355544							97383
BRD-M54814689	LSM-45046		54661187	InChI=1S/C25H28N4O4/c1-2-6-15-10-11-19-22-21(23(31)27-16-7-5-8-16)17(14-30)20(13-28(19)24(15)32)29(22)25(33)18-9-3-4-12-26-18/h2-4,6,9-12,16-17,20-22,30H,5,7-8,13-14H2,1H3,(H,27,31)/t17-,20-,21+,22+/m0/s1	RQFILIGFJPUTQD-GUGJDKNPSA-N	CC=CC1=CC=C2[C@@H]3[C@@H]([C@@H](CO)[C@H](CN2C1=O)N3C(=O)c4ccccn4)C(=O)NC5CCC5	BroadT	BRD-M54814689	BRD-M54814689-001-01-8	Broad Institute of MIT and Harvard	BRD-M54814689		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NC4CCC4)[C@@H]2N3C(=O)c2ccccn2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NC4CCC4)[C@@H]2N3C(=O)c2ccccn2)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NC4CCC4)[C@@H]2N3C(=O)c2ccccn2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NC4CCC4)[C@@H]2N3C(=O)c2ccccn2)c1=O	InChI=1S/2C25H28N4O4/c2*1-2-6-15-10-11-19-22-21(23(31)27-16-7-5-8-16)17(14-30)20(13-28(19)24(15)32)29(22)25(33)18-9-3-4-12-26-18/h2*2-4,6,9-12,16-17,20-22,30H,5,7-8,13-14H2,1H3,(H,27,31)/b6-2+;6-2-/t2*17-,20-,21+,22+/m00/s1	HWNQSPGDBFKSOQ-ZCHRXCPBSA-N	448.211055416							103283
BRD-K50570214	LSM-11502		54661241	InChI=1S/C20H27N3O4/c1-2-16(25)23-18-13(11-22-15(18)7-6-8-17(22)26)14(12-24)19(23)20(27)21-9-4-3-5-10-21/h6-8,13-14,18-19,24H,2-5,9-12H2,1H3/t13-,14-,18+,19-/m0/s1	DUBNWEBJLMWVKU-QAMTZSDWSA-N	CCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]12)C(=O)N4CCCCC4	BroadT	BRD-K50570214	BRD-K50570214-001-01-6	Broad Institute of MIT and Harvard	BRD-K50570214			CCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]12)C(=O)N1CCCCC1	InChI=1S/C20H27N3O4/c1-2-16(25)23-18-13(11-22-15(18)7-6-8-17(22)26)14(12-24)19(23)20(27)21-9-4-3-5-10-21/h6-8,13-14,18-19,24H,2-5,9-12H2,1H3/t13-,14-,18+,19-/m0/s1	DUBNWEBJLMWVKU-QAMTZSDWSA-N	373.200156374							100123
BRD-K89960068	LSM-13977		54661056	InChI=1S/C28H29N3O3/c32-17-23-22-16-30-24(7-4-8-25(30)33)26(22)31(15-18-9-10-18)27(23)28(34)29-21-13-11-20(12-14-21)19-5-2-1-3-6-19/h1-8,11-14,18,22-23,26-27,32H,9-10,15-17H2,(H,29,34)/t22-,23-,26+,27-/m1/s1	SJOVMCPVBGRFMC-JUIYCPNDSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N(CC4CC4)[C@H]1C(=O)Nc5ccc(cc5)c6ccccc6	BroadT	BRD-K89960068	BRD-K89960068-001-01-1	Broad Institute of MIT and Harvard	BRD-K89960068			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N(CC2CC2)[C@H]1C(=O)Nc1ccc(cc1)-c1ccccc1	InChI=1S/C28H29N3O3/c32-17-23-22-16-30-24(7-4-8-25(30)33)26(22)31(15-18-9-10-18)27(23)28(34)29-21-13-11-20(12-14-21)19-5-2-1-3-6-19/h1-8,11-14,18,22-23,26-27,32H,9-10,15-17H2,(H,29,34)/t22-,23-,26+,27-/m1/s1	SJOVMCPVBGRFMC-JUIYCPNDSA-N	455.220891818							102630
BRD-K55251364	LSM-11776		54661191	InChI=1S/C27H36N4O5/c1-5-23(33)31-24-19(20(16-32)25(31)26(34)28-13-8-14-29(2)3)15-30-21(24)12-11-18(27(30)35)17-9-6-7-10-22(17)36-4/h6-7,9-12,19-20,24-25,32H,5,8,13-16H2,1-4H3,(H,28,34)/t19-,20-,24+,25-/m0/s1	GDXCTQXPLLMICC-UIYANEJRSA-N	CCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@H]12)C(=O)NCCCN(C)C	BroadT	BRD-K55251364	BRD-K55251364-001-01-6	Broad Institute of MIT and Harvard	BRD-K55251364			CCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@H]12)C(=O)NCCCN(C)C	InChI=1S/C27H36N4O5/c1-5-23(33)31-24-19(20(16-32)25(31)26(34)28-13-8-14-29(2)3)15-30-21(24)12-11-18(27(30)35)17-9-6-7-10-22(17)36-4/h6-7,9-12,19-20,24-25,32H,5,8,13-16H2,1-4H3,(H,28,34)/t19-,20-,24+,25-/m0/s1	GDXCTQXPLLMICC-UIYANEJRSA-N	496.268570292							100401
BRD-K65836281	LSM-12443		54661383	InChI=1S/C25H29N3O4/c1-26(2)25(32)21-18(14-29)20-13-27-19(22(21)28(20)23(30)16-9-6-10-16)12-11-17(24(27)31)15-7-4-3-5-8-15/h3-5,7-8,11-12,16,18,20-22,29H,6,9-10,13-14H2,1-2H3/t18-,20-,21+,22+/m1/s1	MBRBGBQUUNVPJA-YJMBLLCNSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@@H]1N2C(=O)C5CCC5	BroadT	BRD-K65836281	BRD-K65836281-001-01-2	Broad Institute of MIT and Harvard	BRD-K65836281			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]1N2C(=O)C1CCC1	InChI=1S/C25H29N3O4/c1-26(2)25(32)21-18(14-29)20-13-27-19(22(21)28(20)23(30)16-9-6-10-16)12-11-17(24(27)31)15-7-4-3-5-8-15/h3-5,7-8,11-12,16,18,20-22,29H,6,9-10,13-14H2,1-2H3/t18-,20-,21+,22+/m1/s1	MBRBGBQUUNVPJA-YJMBLLCNSA-N	435.215806438							101071
BRD-K15912020	LSM-9380		54596125	InChI=1S/C20H23N3O5S/c1-29(27,28)23-16-11-22-15(8-5-9-17(22)25)19(23)18(14(16)12-24)20(26)21-10-13-6-3-2-4-7-13/h2-9,14,16,18-19,24H,10-12H2,1H3,(H,21,26)/t14-,16-,18+,19+/m1/s1	BTVFIDRKUITRHL-JZGRTCEGSA-N	CS(=O)(=O)N1[C@@H]2CN3C(=O)C=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)NCc4ccccc4	BroadT	BRD-K15912020	BRD-K15912020-001-01-8	Broad Institute of MIT and Harvard	BRD-K15912020			CS(=O)(=O)N1[C@@H]2Cn3c(cccc3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc1ccccc1	InChI=1S/C20H23N3O5S/c1-29(27,28)23-16-11-22-15(8-5-9-17(22)25)19(23)18(14(16)12-24)20(26)21-10-13-6-3-2-4-7-13/h2-9,14,16,18-19,24H,10-12H2,1H3,(H,21,26)/t14-,16-,18+,19+/m1/s1	BTVFIDRKUITRHL-JZGRTCEGSA-N	417.135841556							98001
BRD-K64133040	LSM-12344		54661235	InChI=1S/C27H28N2O5/c1-33-23-11-7-6-10-18(23)19-12-13-21-25-24(27(32)34-2)20(16-30)22(15-29(21)26(19)31)28(25)14-17-8-4-3-5-9-17/h3-13,20,22,24-25,30H,14-16H2,1-2H3/t20-,22-,24+,25+/m1/s1	VLQJEDUGSYPRCL-KAKDDGLXSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@@H]1N2Cc5ccccc5	BroadT	BRD-K64133040	BRD-K64133040-001-01-7	Broad Institute of MIT and Harvard	BRD-K64133040			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@@H]1N2Cc1ccccc1	InChI=1S/C27H28N2O5/c1-33-23-11-7-6-10-18(23)19-12-13-21-25-24(27(32)34-2)20(16-30)22(15-29(21)26(19)31)28(25)14-17-8-4-3-5-9-17/h3-13,20,22,24-25,30H,14-16H2,1-2H3/t20-,22-,24+,25+/m1/s1	VLQJEDUGSYPRCL-KAKDDGLXSA-N	460.199822016							100971
BRD-K74101931	LSM-12965		54661399	InChI=1S/C25H30FN3O3/c1-2-28-22-19(20(15-30)23(28)25(32)27-11-4-3-5-12-27)14-29-21(22)10-9-18(24(29)31)16-7-6-8-17(26)13-16/h6-10,13,19-20,22-23,30H,2-5,11-12,14-15H2,1H3/t19-,20-,22+,23-/m1/s1	IVBSCMTWKAMHGA-YXPKMTABSA-N	CCN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@@H]12)C(=O)N5CCCCC5	BroadT	BRD-K74101931	BRD-K74101931-001-01-4	Broad Institute of MIT and Harvard	BRD-K74101931			CCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]12)C(=O)N1CCCCC1	InChI=1S/C25H30FN3O3/c1-2-28-22-19(20(15-30)23(28)25(32)27-11-4-3-5-12-27)14-29-21(22)10-9-18(24(29)31)16-7-6-8-17(26)13-16/h6-10,13,19-20,22-23,30H,2-5,11-12,14-15H2,1H3/t19-,20-,22+,23-/m1/s1	IVBSCMTWKAMHGA-YXPKMTABSA-N	439.22712005							101602
BRD-M85914958	LSM-45073		54661418	InChI=1S/C26H31N3O3/c1-3-7-18-10-11-21-24-23(20(16-30)22(28(24)4-2)15-29(21)25(18)31)26(32)27-13-12-17-8-5-6-9-19(17)14-27/h3,5-11,20,22-24,30H,4,12-16H2,1-2H3/t20-,22-,23+,24+/m0/s1	SCCGZMIGIRUPAJ-IQFVJIFQSA-N	CCN1[C@H]2CN3C(=CC=C(C=CC)C3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N4CCc5ccccc5C4	BroadT	BRD-M85914958	BRD-M85914958-001-01-3	Broad Institute of MIT and Harvard	BRD-M85914958		CCN1[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N1CCc2ccccc2C1.CCN1[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N1CCc2ccccc2C1	CCN1[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N1CCc2ccccc2C1.CCN1[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N1CCc2ccccc2C1	InChI=1S/2C26H31N3O3/c2*1-3-7-18-10-11-21-24-23(20(16-30)22(28(24)4-2)15-29(21)25(18)31)26(32)27-13-12-17-8-5-6-9-19(17)14-27/h2*3,5-11,20,22-24,30H,4,12-16H2,1-2H3/b7-3+;7-3-/t2*20-,22-,23+,24+/m00/s1	RTSTWBAHJBYZDW-WITXEOOKSA-N	433.236541882							103310
BRD-M91876180	LSM-45082		54661354	InChI=1S/C23H27N3O4/c1-3-5-15-8-9-19-20-17(12-26(19)23(15)29)18(13-27)21(25-20)22(28)24-11-14-6-4-7-16(10-14)30-2/h3-10,17-18,20-21,25,27H,11-13H2,1-2H3,(H,24,28)/t17-,18-,20+,21-/m0/s1	NWTIRCSUWOGELC-MMKMLUHNSA-N	COc1cccc(CNC(=O)[C@H]2N[C@@H]3[C@@H](CN4C(=O)C(=CC=C34)C=CC)[C@@H]2CO)c1	BroadT	BRD-M91876180	BRD-M91876180-001-01-6	Broad Institute of MIT and Harvard	BRD-M91876180		COc1cccc(CNC(=O)[C@H]2N[C@@H]3[C@@H](Cn4c3ccc(\C=C\C)c4=O)[C@@H]2CO)c1.COc1cccc(CNC(=O)[C@H]2N[C@@H]3[C@@H](Cn4c3ccc(\C=C/C)c4=O)[C@@H]2CO)c1	COc1cccc(CNC(=O)[C@H]2N[C@@H]3[C@@H](Cn4c3ccc(\C=C\C)c4=O)[C@@H]2CO)c1.COc1cccc(CNC(=O)[C@H]2N[C@@H]3[C@@H](Cn4c3ccc(\C=C/C)c4=O)[C@@H]2CO)c1	InChI=1S/2C23H27N3O4/c2*1-3-5-15-8-9-19-20-17(12-26(19)23(15)29)18(13-27)21(25-20)22(28)24-11-14-6-4-7-16(10-14)30-2/h2*3-10,17-18,20-21,25,27H,11-13H2,1-2H3,(H,24,28)/b5-3+;5-3-/t2*17-,18-,20+,21-/m00/s1	GZTMFBFGJVKLKE-CFCJOGGUSA-N	409.200156374							103319
BRD-K08171986	LSM-8921		54661046	InChI=1S/C18H23N3O5/c22-9-12-11-8-20-13(6-3-7-14(20)23)15(11)21(16(12)17(24)25)18(26)19-10-4-1-2-5-10/h3,6-7,10-12,15-16,22H,1-2,4-5,8-9H2,(H,19,26)(H,24,25)/t11-,12-,15+,16-/m0/s1	HAYQQCQIMZIRJI-RKLWJJNISA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N([C@@H]1C(=O)O)C(=O)NC4CCCC4	BroadT	BRD-K08171986	BRD-K08171986-001-01-2	Broad Institute of MIT and Harvard	BRD-K08171986			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N([C@@H]1C(O)=O)C(=O)NC1CCCC1	InChI=1S/C18H23N3O5/c22-9-12-11-8-20-13(6-3-7-14(20)23)15(11)21(16(12)17(24)25)18(26)19-10-4-1-2-5-10/h3,6-7,10-12,15-16,22H,1-2,4-5,8-9H2,(H,19,26)(H,24,25)/t11-,12-,15+,16-/m0/s1	HAYQQCQIMZIRJI-RKLWJJNISA-N	361.163770866							97542
BRD-K57228329	LSM-11897		54661436	InChI=1S/C23H26F3N3O3/c1-27(2)22(32)20-17(13-30)16-12-29-18(19(16)28(20)11-10-23(24,25)26)9-8-15(21(29)31)14-6-4-3-5-7-14/h3-9,16-17,19-20,30H,10-13H2,1-2H3/t16-,17-,19+,20-/m0/s1	LSVFVIWAXGKISN-XEYPJELSSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@@H]2N1CCC(F)(F)F	BroadT	BRD-K57228329	BRD-K57228329-001-01-6	Broad Institute of MIT and Harvard	BRD-K57228329			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]2N1CCC(F)(F)F	InChI=1S/C23H26F3N3O3/c1-27(2)22(32)20-17(13-30)16-12-29-18(19(16)28(20)11-10-23(24,25)26)9-8-15(21(29)31)14-6-4-3-5-7-14/h3-9,16-17,19-20,30H,10-13H2,1-2H3/t16-,17-,19+,20-/m0/s1	LSVFVIWAXGKISN-XEYPJELSSA-N	449.192626322							100523
BRD-K22846014	LSM-9817		54661107	InChI=1S/C22H26FN3O6S/c1-32-10-9-24-21(28)19-15(12-27)18-11-25-17(20(19)26(18)33(2,30)31)8-7-14(22(25)29)13-5-3-4-6-16(13)23/h3-8,15,18-20,27H,9-12H2,1-2H3,(H,24,28)/t15-,18-,19+,20+/m1/s1	YXSNWGVIGBSYFO-XCLNPWKQSA-N	COCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]1N2S(=O)(=O)C	BroadT	BRD-K22846014	BRD-K22846014-001-01-7	Broad Institute of MIT and Harvard	BRD-K22846014			COCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]1N2S(C)(=O)=O	InChI=1S/C22H26FN3O6S/c1-32-10-9-24-21(28)19-15(12-27)18-11-25-17(20(19)26(18)33(2,30)31)8-7-14(22(25)29)13-5-3-4-6-16(13)23/h3-8,15,18-20,27H,9-12H2,1-2H3,(H,24,28)/t15-,18-,19+,20+/m1/s1	YXSNWGVIGBSYFO-XCLNPWKQSA-N	479.152634472							98438
BRD-M28080892	LSM-45018		54661219	InChI=1S/C24H31N5O4/c1-4-6-15-7-8-18-22-21(23(32)25-10-9-16-11-27(3)14-26-16)17(13-30)19(12-28(18)24(15)33)29(22)20(31)5-2/h4,6-8,11,14,17,19,21-22,30H,5,9-10,12-13H2,1-3H3,(H,25,32)/t17-,19-,21+,22+/m1/s1	VOGACUDSELLWLB-IVOMFYJKSA-N	CCC(=O)N1[C@@H]2CN3C(=CC=C(C=CC)C3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCc4cn(C)cn4	BroadT	BRD-M28080892	BRD-M28080892-001-01-2	Broad Institute of MIT and Harvard	BRD-M28080892		CCC(=O)N1[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCc1cn(C)cn1.CCC(=O)N1[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCc1cn(C)cn1	CCC(=O)N1[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCc1cn(C)cn1.CCC(=O)N1[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCc1cn(C)cn1	InChI=1S/2C24H31N5O4/c2*1-4-6-15-7-8-18-22-21(23(32)25-10-9-16-11-27(3)14-26-16)17(13-30)19(12-28(18)24(15)33)29(22)20(31)5-2/h2*4,6-8,11,14,17,19,21-22,30H,5,9-10,12-13H2,1-3H3,(H,25,32)/b6-4+;6-4-/t2*17-,19-,21+,22+/m11/s1	WMZNZTBMFPTLSB-KOYLBJCESA-N	453.237604522							103255
BRD-K90562112	LSM-14007		54661202	InChI=1S/C29H33N3O4/c33-17-22-24-16-31-23(15-14-21(29(31)36)18-8-4-5-9-18)26(25(22)27(34)30-20-12-6-7-13-20)32(24)28(35)19-10-2-1-3-11-19/h1-3,8,10-11,14-15,20,22,24-26,33H,4-7,9,12-13,16-17H2,(H,30,34)/t22-,24-,25+,26+/m1/s1	MOGZBFKOCSCLHD-BPHNFWMXSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@@H]([C@H]1C(=O)NC4CCCC4)N2C(=O)c5ccccc5)C6=CCCC6	BroadT	BRD-K90562112	BRD-K90562112-001-01-8	Broad Institute of MIT and Harvard	BRD-K90562112			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]([C@H]1C(=O)NC1CCCC1)N2C(=O)c1ccccc1	InChI=1S/C29H33N3O4/c33-17-22-24-16-31-23(15-14-21(29(31)36)18-8-4-5-9-18)26(25(22)27(34)30-20-12-6-7-13-20)32(24)28(35)19-10-2-1-3-11-19/h1-3,8,10-11,14-15,20,22,24-26,33H,4-7,9,12-13,16-17H2,(H,30,34)/t22-,24-,25+,26+/m1/s1	MOGZBFKOCSCLHD-BPHNFWMXSA-N	487.247106566							102660
BRD-K26199553	LSM-10017		54661282	InChI=1S/C26H32N6O4/c33-13-20-19-12-31-21(8-7-18(25(31)35)16-10-27-14-28-11-16)22(19)32(26(36)30-17-3-1-2-4-17)23(20)24(34)29-9-15-5-6-15/h7-8,10-11,14-15,17,19-20,22-23,33H,1-6,9,12-13H2,(H,29,34)(H,30,36)/t19-,20-,22+,23-/m0/s1	KFSHNWDAJUKWQL-RLBLXZPPSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N([C@@H]1C(=O)NCC4CC4)C(=O)NC5CCCC5)c6cncnc6	BroadT	BRD-K26199553	BRD-K26199553-001-01-4	Broad Institute of MIT and Harvard	BRD-K26199553			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@@H]2N([C@@H]1C(=O)NCC1CC1)C(=O)NC1CCCC1	InChI=1S/C26H32N6O4/c33-13-20-19-12-31-21(8-7-18(25(31)35)16-10-27-14-28-11-16)22(19)32(26(36)30-17-3-1-2-4-17)23(20)24(34)29-9-15-5-6-15/h7-8,10-11,14-15,17,19-20,22-23,33H,1-6,9,12-13H2,(H,29,34)(H,30,36)/t19-,20-,22+,23-/m0/s1	KFSHNWDAJUKWQL-RLBLXZPPSA-N	492.248503564							98638
BRD-K80201761	LSM-13326		54661048	InChI=1S/C23H29N3O4/c1-2-24-21(28)20-17(12-27)16-11-25-18(19(16)26(20)22(29)14-7-8-14)10-9-15(23(25)30)13-5-3-4-6-13/h5,9-10,14,16-17,19-20,27H,2-4,6-8,11-12H2,1H3,(H,24,28)/t16-,17-,19+,20-/m0/s1	NWUADCREYHZISA-XEYPJELSSA-N	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N1C(=O)C4CC4)C5=CCCC5	BroadT	BRD-K80201761	BRD-K80201761-001-01-9	Broad Institute of MIT and Harvard	BRD-K80201761			CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]2N1C(=O)C1CC1	InChI=1S/C23H29N3O4/c1-2-24-21(28)20-17(12-27)16-11-25-18(19(16)26(20)22(29)14-7-8-14)10-9-15(23(25)30)13-5-3-4-6-13/h5,9-10,14,16-17,19-20,27H,2-4,6-8,11-12H2,1H3,(H,24,28)/t16-,17-,19+,20-/m0/s1	NWUADCREYHZISA-XEYPJELSSA-N	411.215806438							101965
BRD-K11436949	LSM-9125		54661331	InChI=1S/C26H32N4O4/c1-28(2)14-22(32)30-23-19(20(15-31)24(30)25(33)27-17-9-6-10-17)13-29-21(23)12-11-18(26(29)34)16-7-4-3-5-8-16/h3-5,7-8,11-12,17,19-20,23-24,31H,6,9-10,13-15H2,1-2H3,(H,27,33)/t19-,20-,23+,24-/m0/s1	LSXZROMFDROJOP-JVODISISSA-N	CN(C)CC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@H]12)C(=O)NC5CCC5	BroadT	BRD-K11436949	BRD-K11436949-001-01-0	Broad Institute of MIT and Harvard	BRD-K11436949			CN(C)CC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]12)C(=O)NC1CCC1	InChI=1S/C26H32N4O4/c1-28(2)14-22(32)30-23-19(20(15-31)24(30)25(33)27-17-9-6-10-17)13-29-21(23)12-11-18(26(29)34)16-7-4-3-5-8-16/h3-5,7-8,11-12,17,19-20,23-24,31H,6,9-10,13-15H2,1-2H3,(H,27,33)/t19-,20-,23+,24-/m0/s1	LSXZROMFDROJOP-JVODISISSA-N	464.242355544							97746
BRD-K07591847	LSM-8882		54661097	InChI=1S/C26H27N5O5/c1-2-29-25(33)24-19(12-32)18-11-30-20(5-4-17(26(30)34)16-8-27-13-28-9-16)23(18)31(24)10-15-3-6-21-22(7-15)36-14-35-21/h3-9,13,18-19,23-24,32H,2,10-12,14H2,1H3,(H,29,33)/t18-,19-,23+,24-/m0/s1	ARVCVDNKKYJMNG-TWXAQOBRSA-N	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N1Cc4ccc5OCOc5c4)c6cncnc6	BroadT	BRD-K07591847	BRD-K07591847-001-01-1	Broad Institute of MIT and Harvard	BRD-K07591847			CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@@H]2N1Cc1ccc2OCOc2c1	InChI=1S/C26H27N5O5/c1-2-29-25(33)24-19(12-32)18-11-30-20(5-4-17(26(30)34)16-8-27-13-28-9-16)23(18)31(24)10-15-3-6-21-22(7-15)36-14-35-21/h3-9,13,18-19,23-24,32H,2,10-12,14H2,1H3,(H,29,33)/t18-,19-,23+,24-/m0/s1	ARVCVDNKKYJMNG-TWXAQOBRSA-N	489.201219014							97503
BRD-K14336497	LSM-9293		54661119	InChI=1S/C17H20N2O5/c1-24-17(23)14-10(8-20)12-7-18-11(3-2-4-13(18)21)15(14)19(12)16(22)9-5-6-9/h2-4,9-10,12,14-15,20H,5-8H2,1H3/t10-,12-,14+,15+/m1/s1	KUBNHDDGXKERLH-DWZYQQQCSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]1N2C(=O)C4CC4	BroadT	BRD-K14336497	BRD-K14336497-001-01-5	Broad Institute of MIT and Harvard	BRD-K14336497			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2C(=O)C1CC1	InChI=1S/C17H20N2O5/c1-24-17(23)14-10(8-20)12-7-18-11(3-2-4-13(18)21)15(14)19(12)16(22)9-5-6-9/h2-4,9-10,12,14-15,20H,5-8H2,1H3/t10-,12-,14+,15+/m1/s1	KUBNHDDGXKERLH-DWZYQQQCSA-N	332.13722176							97914
BRD-M77293869	LSM-45066		54661360	InChI=1S/C25H31N3O3/c1-4-8-18-11-12-20-23-22(25(31)26(2)3)19(16-29)21(15-28(20)24(18)30)27(23)14-13-17-9-6-5-7-10-17/h4-12,19,21-23,29H,13-16H2,1-3H3/t19-,21-,22+,23+/m0/s1	IMLNKYQDLHUNSC-KZKAQZJJSA-N	CC=CC1=CC=C2[C@@H]3[C@@H]([C@@H](CO)[C@H](CN2C1=O)N3CCc4ccccc4)C(=O)N(C)C	BroadT	BRD-M77293869	BRD-M77293869-001-01-0	Broad Institute of MIT and Harvard	BRD-M77293869		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N(C)C)[C@@H]2N3CCc2ccccc2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N(C)C)[C@@H]2N3CCc2ccccc2)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N(C)C)[C@@H]2N3CCc2ccccc2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N(C)C)[C@@H]2N3CCc2ccccc2)c1=O	InChI=1S/2C25H31N3O3/c2*1-4-8-18-11-12-20-23-22(25(31)26(2)3)19(16-29)21(15-28(20)24(18)30)27(23)14-13-17-9-6-5-7-10-17/h2*4-12,19,21-23,29H,13-16H2,1-3H3/b8-4+;8-4-/t2*19-,21-,22+,23+/m00/s1	DXCGDKXJJDOURF-CISDEKMLSA-N	421.236541882							103303
BRD-K61161989	LSM-12130		54661314	InChI=1S/C28H32FN3O4/c1-2-24(34)32-25-21(15-31-23(25)13-12-20(28(31)36)18-6-4-3-5-7-18)22(16-33)26(32)27(35)30-14-17-8-10-19(29)11-9-17/h6,8-13,21-22,25-26,33H,2-5,7,14-16H2,1H3,(H,30,35)/t21-,22-,25+,26-/m0/s1	YUSKIZLEIJYDDG-RLBRRGQKSA-N	CCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]12)C4=CCCCC4)C(=O)NCc5ccc(F)cc5	BroadT	BRD-K61161989	BRD-K61161989-001-01-4	Broad Institute of MIT and Harvard	BRD-K61161989			CCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]12)C(=O)NCc1ccc(F)cc1	InChI=1S/C28H32FN3O4/c1-2-24(34)32-25-21(15-31-23(25)13-12-20(28(31)36)18-6-4-3-5-7-18)22(16-33)26(32)27(35)30-14-17-8-10-19(29)11-9-17/h6,8-13,21-22,25-26,33H,2-5,7,14-16H2,1H3,(H,30,35)/t21-,22-,25+,26-/m0/s1	YUSKIZLEIJYDDG-RLBRRGQKSA-N	493.237684734							100756
BRD-K35562235	LSM-10563		54661152	InChI=1S/C27H27FN4O4/c1-2-30-26(35)25-21(15-33)20-14-31-22(10-9-19(27(31)36)17-5-7-18(28)8-6-17)24(20)32(25)23(34)12-16-4-3-11-29-13-16/h3-11,13,20-21,24-25,33H,2,12,14-15H2,1H3,(H,30,35)/t20-,21-,24+,25-/m1/s1	KPWZAVBDHNROKR-KZKYLIHBSA-N	CCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]2N1C(=O)Cc5cccnc5	BroadT	BRD-K35562235	BRD-K35562235-001-01-8	Broad Institute of MIT and Harvard	BRD-K35562235			CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]2N1C(=O)Cc1cccnc1	InChI=1S/C27H27FN4O4/c1-2-30-26(35)25-21(15-33)20-14-31-22(10-9-19(27(31)36)17-5-7-18(28)8-6-17)24(20)32(25)23(34)12-16-4-3-11-29-13-16/h3-11,13,20-21,24-25,33H,2,12,14-15H2,1H3,(H,30,35)/t20-,21-,24+,25-/m1/s1	KPWZAVBDHNROKR-KZKYLIHBSA-N	490.201633584							99184
BRD-K58679476	LSM-11973		54661177	InChI=1S/C20H22FN3O3/c1-23(2)20(27)18-15(10-25)14-9-24-16(17(14)22-18)8-7-13(19(24)26)11-3-5-12(21)6-4-11/h3-8,14-15,17-18,22,25H,9-10H2,1-2H3/t14-,15-,17+,18-/m1/s1	HRNJAQRGDGXKJI-XYVMCAHJSA-N	CN(C)C(=O)[C@@H]1N[C@H]2[C@H](CN3C2=CC=C(C3=O)c4ccc(F)cc4)[C@H]1CO	BroadT	BRD-K58679476	BRD-K58679476-001-01-0	Broad Institute of MIT and Harvard	BRD-K58679476			CN(C)C(=O)[C@@H]1N[C@H]2[C@H](Cn3c2ccc(-c2ccc(F)cc2)c3=O)[C@H]1CO	InChI=1S/C20H22FN3O3/c1-23(2)20(27)18-15(10-25)14-9-24-16(17(14)22-18)8-7-13(19(24)26)11-3-5-12(21)6-4-11/h3-8,14-15,17-18,22,25H,9-10H2,1-2H3/t14-,15-,17+,18-/m1/s1	HRNJAQRGDGXKJI-XYVMCAHJSA-N	371.164519794							100599
BRD-K47423282	LSM-11322		54661400	InChI=1S/C28H29N3O4/c1-35-20-8-4-7-18(13-20)21-9-10-24-25-22(14-31(24)28(21)34)23(15-32)26(30-25)27(33)29-19-11-16-5-2-3-6-17(16)12-19/h2-10,13,19,22-23,25-26,30,32H,11-12,14-15H2,1H3,(H,29,33)/t22-,23-,25+,26-/m0/s1	CTULAYPPZYFJRD-LJCOXQHRSA-N	COc1cccc(c1)C2=CC=C3[C@@H]4N[C@@H]([C@@H](CO)[C@@H]4CN3C2=O)C(=O)NC5Cc6ccccc6C5	BroadT	BRD-K47423282	BRD-K47423282-001-01-1	Broad Institute of MIT and Harvard	BRD-K47423282			COc1cccc(c1)-c1ccc2[C@@H]3N[C@@H]([C@@H](CO)[C@@H]3Cn2c1=O)C(=O)NC1Cc2ccccc2C1	InChI=1S/C28H29N3O4/c1-35-20-8-4-7-18(13-20)21-9-10-24-25-22(14-31(24)28(21)34)23(15-32)26(30-25)27(33)29-19-11-16-5-2-3-6-17(16)12-19/h2-10,13,19,22-23,25-26,30,32H,11-12,14-15H2,1H3,(H,29,33)/t22-,23-,25+,26-/m0/s1	CTULAYPPZYFJRD-LJCOXQHRSA-N	471.215806438							99943
BRD-K42365464	LSM-10996		54661087	InChI=1S/C25H37N5O5/c31-16-18-20-15-29-19(7-3-8-21(29)32)23(30(20)25(34)27-17-5-1-2-6-17)22(18)24(33)26-9-4-10-28-11-13-35-14-12-28/h3,7-8,17-18,20,22-23,31H,1-2,4-6,9-16H2,(H,26,33)(H,27,34)/t18-,20-,22+,23+/m1/s1	RTKWEIPARALZJI-SQMBMXPBSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)NCCCN4CCOCC4)N2C(=O)NC5CCCC5	BroadT	BRD-K42365464	BRD-K42365464-001-01-9	Broad Institute of MIT and Harvard	BRD-K42365464			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NCCCN1CCOCC1)N2C(=O)NC1CCCC1	InChI=1S/C25H37N5O5/c31-16-18-20-15-29-19(7-3-8-21(29)32)23(30(20)25(34)27-17-5-1-2-6-17)22(18)24(33)26-9-4-10-28-11-13-35-14-12-28/h3,7-8,17-18,20,22-23,31H,1-2,4-6,9-16H2,(H,26,33)(H,27,34)/t18-,20-,22+,23+/m1/s1	RTKWEIPARALZJI-SQMBMXPBSA-N	487.279469334							99617
BRD-K88990907	LSM-13903		54661141	InChI=1S/C27H28N4O5/c1-36-16-23(33)31-22-14-30-21(11-10-19(27(30)35)17-7-3-2-4-8-17)25(31)24(20(22)15-32)26(34)29-13-18-9-5-6-12-28-18/h2-12,20,22,24-25,32H,13-16H2,1H3,(H,29,34)/t20-,22-,24+,25+/m0/s1	YNLXOCAZEKAELA-MMTHZHQFSA-N	COCC(=O)N1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc5ccccn5	BroadT	BRD-K88990907	BRD-K88990907-001-01-4	Broad Institute of MIT and Harvard	BRD-K88990907			COCC(=O)N1[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc1ccccn1	InChI=1S/C27H28N4O5/c1-36-16-23(33)31-22-14-30-21(11-10-19(27(30)35)17-7-3-2-4-8-17)25(31)24(20(22)15-32)26(34)29-13-18-9-5-6-12-28-18/h2-12,20,22,24-25,32H,13-16H2,1H3,(H,29,34)/t20-,22-,24+,25+/m0/s1	YNLXOCAZEKAELA-MMTHZHQFSA-N	488.205970036							102556
BRD-K11345845	LSM-9118		54661461	InChI=1S/C25H30N4O4S/c30-15-19-18-13-28-20(6-5-17(24(28)31)16-3-1-2-4-16)22(18)29(14-21-26-7-12-34-21)23(19)25(32)27-8-10-33-11-9-27/h3,5-7,12,18-19,22-23,30H,1-2,4,8-11,13-15H2/t18-,19-,22+,23-/m0/s1	XJTVLIMGWLYCNW-LBVMUVSTSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@@H]2N(Cc5nccs5)[C@@H]1C(=O)N6CCOCC6	BroadT	BRD-K11345845	BRD-K11345845-001-01-8	Broad Institute of MIT and Harvard	BRD-K11345845			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]2N(Cc2nccs2)[C@@H]1C(=O)N1CCOCC1	InChI=1S/C25H30N4O4S/c30-15-19-18-13-28-20(6-5-17(24(28)31)16-3-1-2-4-16)22(18)29(14-21-26-7-12-34-21)23(19)25(32)27-8-10-33-11-9-27/h3,5-7,12,18-19,22-23,30H,1-2,4,8-11,13-15H2/t18-,19-,22+,23-/m0/s1	XJTVLIMGWLYCNW-LBVMUVSTSA-N	482.19877617							97739
BRD-K19073426	LSM-9575		54661174	InChI=1S/C21H25N5O3/c27-11-15-17-10-25-16(2-1-3-18(25)28)20(26(17)9-13-4-5-13)19(15)21(29)23-8-14-6-7-22-12-24-14/h1-3,6-7,12-13,15,17,19-20,27H,4-5,8-11H2,(H,23,29)/t15-,17-,19+,20+/m0/s1	QFGPTMNHKNKAJU-SMMRIJLZSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)NCc4ccncn4)N2CC5CC5	BroadT	BRD-K19073426	BRD-K19073426-001-01-5	Broad Institute of MIT and Harvard	BRD-K19073426			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NCc1ccncn1)N2CC1CC1	InChI=1S/C21H25N5O3/c27-11-15-17-10-25-16(2-1-3-18(25)28)20(26(17)9-13-4-5-13)19(15)21(29)23-8-14-6-7-22-12-24-14/h1-3,6-7,12-13,15,17,19-20,27H,4-5,8-11H2,(H,23,29)/t15-,17-,19+,20+/m0/s1	QFGPTMNHKNKAJU-SMMRIJLZSA-N	395.19573971							98196
BRD-K97865175	LSM-14443		54661150	InChI=1S/C26H28N4O3/c31-17-20-22-16-29-21(10-6-11-23(29)32)25(30(22)15-19-9-4-5-13-27-19)24(20)26(33)28-14-12-18-7-2-1-3-8-18/h1-11,13,20,22,24-25,31H,12,14-17H2,(H,28,33)/t20-,22-,24+,25+/m1/s1	ZMVBPFYUTZNCSY-KAKDDGLXSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)NCCc4ccccc4)N2Cc5ccccn5	BroadT	BRD-K97865175	BRD-K97865175-001-01-2	Broad Institute of MIT and Harvard	BRD-K97865175			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NCCc1ccccc1)N2Cc1ccccn1	InChI=1S/C26H28N4O3/c31-17-20-22-16-29-21(10-6-11-23(29)32)25(30(22)15-19-9-4-5-13-27-19)24(20)26(33)28-14-12-18-7-2-1-3-8-18/h1-11,13,20,22,24-25,31H,12,14-17H2,(H,28,33)/t20-,22-,24+,25+/m1/s1	ZMVBPFYUTZNCSY-KAKDDGLXSA-N	444.216140796							103098
BRD-K19558952	LSM-9608		54661462	InChI=1S/C25H30N4O4S/c30-15-19-18-13-28-20(6-5-17(24(28)31)16-3-1-2-4-16)22(18)29(14-21-26-7-12-34-21)23(19)25(32)27-8-10-33-11-9-27/h3,5-7,12,18-19,22-23,30H,1-2,4,8-11,13-15H2/t18-,19-,22+,23-/m1/s1	XJTVLIMGWLYCNW-PJIZGREPSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@H]2N(Cc5nccs5)[C@H]1C(=O)N6CCOCC6	BroadT	BRD-K19558952	BRD-K19558952-001-01-7	Broad Institute of MIT and Harvard	BRD-K19558952			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]2N(Cc2nccs2)[C@H]1C(=O)N1CCOCC1	InChI=1S/C25H30N4O4S/c30-15-19-18-13-28-20(6-5-17(24(28)31)16-3-1-2-4-16)22(18)29(14-21-26-7-12-34-21)23(19)25(32)27-8-10-33-11-9-27/h3,5-7,12,18-19,22-23,30H,1-2,4,8-11,13-15H2/t18-,19-,22+,23-/m1/s1	XJTVLIMGWLYCNW-PJIZGREPSA-N	482.19877617							98229
BRD-K28001738	LSM-10124		54661299	InChI=1S/C28H32N4O4/c1-3-14-31-23-16-32-22(12-11-20(28(32)35)19-9-4-5-10-24(19)36-2)26(31)25(21(23)17-33)27(34)30-15-18-8-6-7-13-29-18/h4-13,21,23,25-26,33H,3,14-17H2,1-2H3,(H,30,34)/t21-,23-,25+,26+/m1/s1	HGCDJUDEQZLPFK-KUSCKROYSA-N	CCCN1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc5ccccn5	BroadT	BRD-K28001738	BRD-K28001738-001-01-8	Broad Institute of MIT and Harvard	BRD-K28001738			CCCN1[C@@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc1ccccn1	InChI=1S/C28H32N4O4/c1-3-14-31-23-16-32-22(12-11-20(28(32)35)19-9-4-5-10-24(19)36-2)26(31)25(21(23)17-33)27(34)30-15-18-8-6-7-13-29-18/h4-13,21,23,25-26,33H,3,14-17H2,1-2H3,(H,30,34)/t21-,23-,25+,26+/m1/s1	HGCDJUDEQZLPFK-KUSCKROYSA-N	488.242355544							98745
BRD-K32106123	LSM-10375		54661147	InChI=1S/C26H28N6O4/c1-2-10-29-24(34)22-19(14-33)21-13-31-20(9-8-18(25(31)35)16-11-27-15-28-12-16)23(22)32(21)26(36)30-17-6-4-3-5-7-17/h3-9,11-12,15,19,21-23,33H,2,10,13-14H2,1H3,(H,29,34)(H,30,36)/t19-,21-,22+,23+/m0/s1	NNSFVWHQEZSLFM-KZKAQZJJSA-N	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@H]1N2C(=O)Nc5ccccc5	BroadT	BRD-K32106123	BRD-K32106123-001-01-2	Broad Institute of MIT and Harvard	BRD-K32106123			CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@H]1N2C(=O)Nc1ccccc1	InChI=1S/C26H28N6O4/c1-2-10-29-24(34)22-19(14-33)21-13-31-20(9-8-18(25(31)35)16-11-27-15-28-12-16)23(22)32(21)26(36)30-17-6-4-3-5-7-17/h3-9,11-12,15,19,21-23,33H,2,10,13-14H2,1H3,(H,29,34)(H,30,36)/t19-,21-,22+,23+/m0/s1	NNSFVWHQEZSLFM-KZKAQZJJSA-N	488.217203436							98996
BRD-K83183082	LSM-43497		54661064	InChI=1S/C27H30N2O5/c1-34-27(33)24-21(16-30)20-15-28-22(23(20)29(24)26(32)18-9-5-6-10-18)14-13-19(25(28)31)12-11-17-7-3-2-4-8-17/h2-4,7-8,11-14,18,20-21,23-24,30H,5-6,9-10,15-16H2,1H3/b12-11+/t20-,21-,23+,24-/m0/s1	SPQKGDIXEATJCL-SYWGRWHUSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@@H]2N1C(=O)C5CCCC5	BroadT	BRD-K83183082	BRD-K83183082-001-01-8	Broad Institute of MIT and Harvard	BRD-K83183082			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]2N1C(=O)C1CCCC1	InChI=1S/C27H30N2O5/c1-34-27(33)24-21(16-30)20-15-28-22(23(20)29(24)26(32)18-9-5-6-10-18)14-13-19(25(28)31)12-11-17-7-3-2-4-8-17/h2-4,7-8,11-14,18,20-21,23-24,30H,5-6,9-10,15-16H2,1H3/b12-11+/t20-,21-,23+,24-/m0/s1	SPQKGDIXEATJCL-SYWGRWHUSA-N	462.21547208							
BRD-K74835229	LSM-13017		54661275	InChI=1S/C18H23F3N4O4/c1-2-6-22-17(29)25-12-7-24-11(4-3-5-13(24)27)15(25)14(10(12)8-26)16(28)23-9-18(19,20)21/h3-5,10,12,14-15,26H,2,6-9H2,1H3,(H,22,29)(H,23,28)/t10-,12-,14+,15+/m0/s1	YCXHAHZKXMJVEB-OBCWZRDOSA-N	CCCNC(=O)N1[C@H]2CN3C(=O)C=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)NCC(F)(F)F	BroadT	BRD-K74835229	BRD-K74835229-001-01-8	Broad Institute of MIT and Harvard	BRD-K74835229			CCCNC(=O)N1[C@H]2Cn3c(cccc3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCC(F)(F)F	InChI=1S/C18H23F3N4O4/c1-2-6-22-17(29)25-12-7-24-11(4-3-5-13(24)27)15(25)14(10(12)8-26)16(28)23-9-18(19,20)21/h3-5,10,12,14-15,26H,2,6-9H2,1H3,(H,22,29)(H,23,28)/t10-,12-,14+,15+/m0/s1	YCXHAHZKXMJVEB-OBCWZRDOSA-N	416.167139856							101654
MLS005000157	LSM-10850	BRD-K39779204	54661276	InChI=1S/C18H23F3N4O4/c1-2-6-22-17(29)25-12-7-24-11(4-3-5-13(24)27)15(25)14(10(12)8-26)16(28)23-9-18(19,20)21/h3-5,10,12,14-15,26H,2,6-9H2,1H3,(H,22,29)(H,23,28)/t10-,12-,14+,15+/m1/s1	YCXHAHZKXMJVEB-DWZYQQQCSA-N	CCCNC(=O)N1[C@@H]2CN3C(=O)C=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)NCC(F)(F)F	BroadT	BRD-K39779204	BRD-K39779204-001-01-1	Broad Institute of MIT and Harvard	BRD-K39779204			CCCNC(=O)N1[C@@H]2Cn3c(cccc3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCC(F)(F)F	InChI=1S/C18H23F3N4O4/c1-2-6-22-17(29)25-12-7-24-11(4-3-5-13(24)27)15(25)14(10(12)8-26)16(28)23-9-18(19,20)21/h3-5,10,12,14-15,26H,2,6-9H2,1H3,(H,22,29)(H,23,28)/t10-,12-,14+,15+/m1/s1	YCXHAHZKXMJVEB-DWZYQQQCSA-N	416.167139856							99471
BRD-K87539610	LSM-13799		54661344	InChI=1S/C25H25FN4O3/c1-29-22-19(20(14-31)23(29)24(32)28-12-17-7-2-3-10-27-17)13-30-21(22)9-8-18(25(30)33)15-5-4-6-16(26)11-15/h2-11,19-20,22-23,31H,12-14H2,1H3,(H,28,32)/t19-,20-,22+,23-/m1/s1	QUSVXALKSRSRLD-YXPKMTABSA-N	CN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@@H]12)C(=O)NCc5ccccn5	BroadT	BRD-K87539610	BRD-K87539610-001-01-8	Broad Institute of MIT and Harvard	BRD-K87539610			CN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]12)C(=O)NCc1ccccn1	InChI=1S/C25H25FN4O3/c1-29-22-19(20(14-31)23(29)24(32)28-12-17-7-2-3-10-27-17)13-30-21(22)9-8-18(25(30)33)15-5-4-6-16(26)11-15/h2-11,19-20,22-23,31H,12-14H2,1H3,(H,28,32)/t19-,20-,22+,23-/m1/s1	QUSVXALKSRSRLD-YXPKMTABSA-N	448.1910689							102448
BRD-M94053246	LSM-45084		54661194	InChI=1S/C23H25F2N3O5S/c1-3-4-14-5-6-18-21-20(22(30)26-10-13-7-15(24)9-16(25)8-13)17(12-29)19(11-27(18)23(14)31)28(21)34(2,32)33/h3-9,17,19-21,29H,10-12H2,1-2H3,(H,26,30)/t17-,19-,20+,21+/m1/s1	GJMSSMVDMJSJLU-PBASOCQRSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3S(=O)(=O)C)C(=O)NCc4cc(F)cc(F)c4	BroadT	BRD-M94053246	BRD-M94053246-001-01-1	Broad Institute of MIT and Harvard	BRD-M94053246		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4cc(F)cc(F)c4)[C@H]2N3S(C)(=O)=O)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4cc(F)cc(F)c4)[C@H]2N3S(C)(=O)=O)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4cc(F)cc(F)c4)[C@H]2N3S(C)(=O)=O)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4cc(F)cc(F)c4)[C@H]2N3S(C)(=O)=O)c1=O	InChI=1S/2C23H25F2N3O5S/c2*1-3-4-14-5-6-18-21-20(22(30)26-10-13-7-15(24)9-16(25)8-13)17(12-29)19(11-27(18)23(14)31)28(21)34(2,32)33/h2*3-9,17,19-21,29H,10-12H2,1-2H3,(H,26,30)/b4-3+;4-3-/t2*17-,19-,20+,21+/m11/s1	CCZGDERCCJEOFJ-XQCHWOEBSA-N	493.14829802							103321
BRD-K62395041	LSM-12219		54661279	InChI=1S/C23H26FN3O4/c1-4-19(29)27-20-16(17(12-28)21(27)23(31)25(2)3)11-26-18(20)10-9-15(22(26)30)13-5-7-14(24)8-6-13/h5-10,16-17,20-21,28H,4,11-12H2,1-3H3/t16-,17-,20+,21-/m1/s1	OMUHXYIQFYOIMG-SGLNWRHMSA-N	CCC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]12)C(=O)N(C)C	BroadT	BRD-K62395041	BRD-K62395041-001-01-3	Broad Institute of MIT and Harvard	BRD-K62395041			CCC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]12)C(=O)N(C)C	InChI=1S/C23H26FN3O4/c1-4-19(29)27-20-16(17(12-28)21(27)23(31)25(2)3)11-26-18(20)10-9-15(22(26)30)13-5-7-14(24)8-6-13/h5-10,16-17,20-21,28H,4,11-12H2,1-3H3/t16-,17-,20+,21-/m1/s1	OMUHXYIQFYOIMG-SGLNWRHMSA-N	427.190734542							100845
BRD-K89332300	LSM-13928		54661146	InChI=1S/C24H20F2N4O5/c25-13-3-5-16(26)17(8-13)28-24(35)30-19-10-29-18(21(30)20(23(33)34)15(19)11-31)6-4-14(22(29)32)12-2-1-7-27-9-12/h1-9,15,19-21,31H,10-11H2,(H,28,35)(H,33,34)/t15-,19-,20+,21+/m1/s1	VFFJPMQBAVMOHZ-IDCXYZFESA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]([C@H]1C(=O)O)N2C(=O)Nc5cc(F)ccc5F	BroadT	BRD-K89332300	BRD-K89332300-001-01-1	Broad Institute of MIT and Harvard	BRD-K89332300			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]([C@H]1C(O)=O)N2C(=O)Nc1cc(F)ccc1F	InChI=1S/C24H20F2N4O5/c25-13-3-5-16(26)17(8-13)28-24(35)30-19-10-29-18(21(30)20(23(33)34)15(19)11-31)6-4-14(22(29)32)12-2-1-7-27-9-12/h1-9,15,19-21,31H,10-11H2,(H,28,35)(H,33,34)/t15-,19-,20+,21+/m1/s1	VFFJPMQBAVMOHZ-IDCXYZFESA-N	482.14017618							102581
BRD-K48257023	LSM-11364		54661381	InChI=1S/C25H30FN3O3/c1-2-11-27-24(31)23-19(14-30)18-13-28-21(22(18)29(23)12-15-7-8-15)10-9-17(25(28)32)16-5-3-4-6-20(16)26/h3-6,9-10,15,18-19,22-23,30H,2,7-8,11-14H2,1H3,(H,27,31)/t18-,19-,22+,23-/m0/s1	CGXNZKQEBMYQRR-LBVMUVSTSA-N	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]2N1CC5CC5	BroadT	BRD-K48257023	BRD-K48257023-001-01-6	Broad Institute of MIT and Harvard	BRD-K48257023			CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]2N1CC1CC1	InChI=1S/C25H30FN3O3/c1-2-11-27-24(31)23-19(14-30)18-13-28-21(22(18)29(23)12-15-7-8-15)10-9-17(25(28)32)16-5-3-4-6-20(16)26/h3-6,9-10,15,18-19,22-23,30H,2,7-8,11-14H2,1H3,(H,27,31)/t18-,19-,22+,23-/m0/s1	CGXNZKQEBMYQRR-LBVMUVSTSA-N	439.22712005							99985
BRD-M51239075	LSM-45041		54661184	InChI=1S/C25H28N4O4/c1-2-6-15-10-11-19-22-21(23(31)27-16-7-5-8-16)17(14-30)20(13-28(19)24(15)32)29(22)25(33)18-9-3-4-12-26-18/h2-4,6,9-12,16-17,20-22,30H,5,7-8,13-14H2,1H3,(H,27,31)/t17-,20-,21+,22+/m1/s1	RQFILIGFJPUTQD-GFRNBQLOSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3C(=O)c4ccccn4)C(=O)NC5CCC5	BroadT	BRD-M51239075	BRD-M51239075-001-01-3	Broad Institute of MIT and Harvard	BRD-M51239075		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NC4CCC4)[C@H]2N3C(=O)c2ccccn2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NC4CCC4)[C@H]2N3C(=O)c2ccccn2)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NC4CCC4)[C@H]2N3C(=O)c2ccccn2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NC4CCC4)[C@H]2N3C(=O)c2ccccn2)c1=O	InChI=1S/2C25H28N4O4/c2*1-2-6-15-10-11-19-22-21(23(31)27-16-7-5-8-16)17(14-30)20(13-28(19)24(15)32)29(22)25(33)18-9-3-4-12-26-18/h2*2-4,6,9-12,16-17,20-22,30H,5,7-8,13-14H2,1H3,(H,27,31)/b6-2+;6-2-/t2*17-,20-,21+,22+/m11/s1	HWNQSPGDBFKSOQ-PCEUYWCVSA-N	448.211055416							103278
BRD-K00697836	LSM-8479		54661273	InChI=1S/C24H29N3O6S/c1-33-16-8-6-14(7-9-16)17-10-11-20-21-18(12-26(20)24(17)30)19(13-28)22(27(21)34(2,31)32)23(29)25-15-4-3-5-15/h6-11,15,18-19,21-22,28H,3-5,12-13H2,1-2H3,(H,25,29)/t18-,19-,21+,22-/m1/s1	MYJOCAZVFWJZEW-KRXUUXHPSA-N	COc1ccc(cc1)C2=CC=C3[C@@H]4[C@H](CN3C2=O)[C@@H](CO)[C@@H](N4S(=O)(=O)C)C(=O)NC5CCC5	BroadT	BRD-K00697836	BRD-K00697836-001-01-6	Broad Institute of MIT and Harvard	BRD-K00697836			COc1ccc(cc1)-c1ccc2[C@@H]3[C@H](Cn2c1=O)[C@@H](CO)[C@@H](N3S(C)(=O)=O)C(=O)NC1CCC1	InChI=1S/C24H29N3O6S/c1-33-16-8-6-14(7-9-16)17-10-11-20-21-18(12-26(20)24(17)30)19(13-28)22(27(21)34(2,31)32)23(29)25-15-4-3-5-15/h6-11,15,18-19,21-22,28H,3-5,12-13H2,1-2H3,(H,25,29)/t18-,19-,21+,22-/m1/s1	MYJOCAZVFWJZEW-KRXUUXHPSA-N	487.177706368							97100
BRD-K00754679	LSM-8481		54661402	InChI=1S/C25H32N6O3/c1-28-6-8-29(9-7-28)25(34)23-20(14-32)19-13-30-21(22(19)31(23)12-16-2-3-16)5-4-18(24(30)33)17-10-26-15-27-11-17/h4-5,10-11,15-16,19-20,22-23,32H,2-3,6-9,12-14H2,1H3/t19-,20-,22+,23-/m1/s1	NKEKVCULWNFMKR-YXPKMTABSA-N	CN1CCN(CC1)C(=O)[C@H]2[C@H](CO)[C@H]3CN4C(=CC=C(C4=O)c5cncnc5)[C@H]3N2CC6CC6	BroadT	BRD-K00754679	BRD-K00754679-001-01-5	Broad Institute of MIT and Harvard	BRD-K00754679			CN1CCN(CC1)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@H]2N1CC1CC1	InChI=1S/C25H32N6O3/c1-28-6-8-29(9-7-28)25(34)23-20(14-32)19-13-30-21(22(19)31(23)12-16-2-3-16)5-4-18(24(30)33)17-10-26-15-27-11-17/h4-5,10-11,15-16,19-20,22-23,32H,2-3,6-9,12-14H2,1H3/t19-,20-,22+,23-/m1/s1	NKEKVCULWNFMKR-YXPKMTABSA-N	464.253588944							97102
BRD-K77318689	LSM-13157		54661057	InChI=1S/C27H33N3O5/c1-35-19-10-5-7-17(13-19)14-28-26(33)24-20(16-31)22-15-29-21(11-6-12-23(29)32)25(24)30(22)27(34)18-8-3-2-4-9-18/h5-7,10-13,18,20,22,24-25,31H,2-4,8-9,14-16H2,1H3,(H,28,33)/t20-,22-,24+,25+/m0/s1	PNHDRDYFFADBCF-MMTHZHQFSA-N	COc1cccc(CNC(=O)[C@@H]2[C@@H](CO)[C@@H]3CN4C(=O)C=CC=C4[C@H]2N3C(=O)C5CCCCC5)c1	BroadT	BRD-K77318689	BRD-K77318689-001-01-5	Broad Institute of MIT and Harvard	BRD-K77318689			COc1cccc(CNC(=O)[C@@H]2[C@@H](CO)[C@@H]3Cn4c(cccc4=O)[C@H]2N3C(=O)C2CCCCC2)c1	InChI=1S/C27H33N3O5/c1-35-19-10-5-7-17(13-19)14-28-26(33)24-20(16-31)22-15-29-21(11-6-12-23(29)32)25(24)30(22)27(34)18-8-3-2-4-9-18/h5-7,10-13,18,20,22,24-25,31H,2-4,8-9,14-16H2,1H3,(H,28,33)/t20-,22-,24+,25+/m0/s1	PNHDRDYFFADBCF-MMTHZHQFSA-N	479.242021186							101795
BRD-K46118045	LSM-11238		54661099	InChI=1S/C21H21F4N3O3/c1-27-17-13(14(9-29)18(27)19(30)26-10-21(23,24)25)8-28-16(17)7-6-12(20(28)31)11-4-2-3-5-15(11)22/h2-7,13-14,17-18,29H,8-10H2,1H3,(H,26,30)/t13-,14-,17+,18-/m1/s1	IFOYIUHYIPKUPM-KJWYOANISA-N	CN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]12)C(=O)NCC(F)(F)F	BroadT	BRD-K46118045	BRD-K46118045-001-01-6	Broad Institute of MIT and Harvard	BRD-K46118045			CN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]12)C(=O)NCC(F)(F)F	InChI=1S/C21H21F4N3O3/c1-27-17-13(14(9-29)18(27)19(30)26-10-21(23,24)25)8-28-16(17)7-6-12(20(28)31)11-4-2-3-5-15(11)22/h2-7,13-14,17-18,29H,8-10H2,1H3,(H,26,30)/t13-,14-,17+,18-/m1/s1	IFOYIUHYIPKUPM-KJWYOANISA-N	439.151904362							99859
BRD-M18093923	LSM-45008		54661385	InChI=1S/C23H23F3N4O4/c1-2-4-13-6-7-17-18-15(10-29(17)21(13)33)16(11-31)19(20(32)28-12-23(24,25)26)30(18)22(34)14-5-3-8-27-9-14/h2-9,15-16,18-19,31H,10-12H2,1H3,(H,28,32)/t15-,16-,18+,19-/m0/s1	HTNUCZUVQLGPFO-DKKFBQAASA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3C(=O)c4cccnc4)C(=O)NCC(F)(F)F	BroadT	BRD-M18093923	BRD-M18093923-001-01-0	Broad Institute of MIT and Harvard	BRD-M18093923		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCC(F)(F)F)N(C(=O)c4cccnc4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCC(F)(F)F)N(C(=O)c4cccnc4)[C@@H]23)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCC(F)(F)F)N(C(=O)c4cccnc4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCC(F)(F)F)N(C(=O)c4cccnc4)[C@@H]23)c1=O	InChI=1S/2C23H23F3N4O4/c2*1-2-4-13-6-7-17-18-15(10-29(17)21(13)33)16(11-31)19(20(32)28-12-23(24,25)26)30(18)22(34)14-5-3-8-27-9-14/h2*2-9,15-16,18-19,31H,10-12H2,1H3,(H,28,32)/b4-2+;4-2-/t2*15-,16-,18+,19-/m00/s1	MMSVXHZGTZHGPG-YEYLPMBRSA-N	476.167139856							103245
BRD-M64817521	LSM-45054		54661429	InChI=1S/C25H30FN3O3/c1-3-5-17-8-11-20-23-22(24(31)27-13-16-6-9-18(26)10-7-16)19(15-30)21(28(23)12-4-2)14-29(20)25(17)32/h3,5-11,19,21-23,30H,4,12-15H2,1-2H3,(H,27,31)/t19-,21-,22+,23+/m1/s1	USKAOISCUCDLDP-LGKPFJOYSA-N	CCCN1[C@@H]2CN3C(=CC=C(C=CC)C3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc4ccc(F)cc4	BroadT	BRD-M64817521	BRD-M64817521-001-01-1	Broad Institute of MIT and Harvard	BRD-M64817521		CCCN1[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1[C@@H](C(=O)NCc1ccc(F)cc1)[C@@H]2CO.CCCN1[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]1[C@@H](C(=O)NCc1ccc(F)cc1)[C@@H]2CO	CCCN1[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1[C@@H](C(=O)NCc1ccc(F)cc1)[C@@H]2CO.CCCN1[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]1[C@@H](C(=O)NCc1ccc(F)cc1)[C@@H]2CO	InChI=1S/2C25H30FN3O3/c2*1-3-5-17-8-11-20-23-22(24(31)27-13-16-6-9-18(26)10-7-16)19(15-30)21(28(23)12-4-2)14-29(20)25(17)32/h2*3,5-11,19,21-23,30H,4,12-15H2,1-2H3,(H,27,31)/b5-3+;5-3-/t2*19-,21-,22+,23+/m11/s1	GGIDMMYQUXUKCO-RWUMBAORSA-N	439.22712005							103291
BRD-K69521358	LSM-12670		54661283	InChI=1S/C24H30N4O3/c1-2-11-27-21-18(19(14-29)22(27)23(30)26-16-6-3-7-16)13-28-20(21)9-8-17(24(28)31)15-5-4-10-25-12-15/h4-5,8-10,12,16,18-19,21-22,29H,2-3,6-7,11,13-14H2,1H3,(H,26,30)/t18-,19-,21+,22-/m1/s1	FSWHIZWXGPVXBM-KRXUUXHPSA-N	CCCN1[C@H]([C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]12)c4cccnc4)C(=O)NC5CCC5	BroadT	BRD-K69521358	BRD-K69521358-001-01-4	Broad Institute of MIT and Harvard	BRD-K69521358			CCCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]12)C(=O)NC1CCC1	InChI=1S/C24H30N4O3/c1-2-11-27-21-18(19(14-29)22(27)23(30)26-16-6-3-7-16)13-28-20(21)9-8-17(24(28)31)15-5-4-10-25-12-15/h4-5,8-10,12,16,18-19,21-22,29H,2-3,6-7,11,13-14H2,1H3,(H,26,30)/t18-,19-,21+,22-/m1/s1	FSWHIZWXGPVXBM-KRXUUXHPSA-N	422.23179086							101304
BRD-K93681700	LSM-14175		54661161	InChI=1S/C24H27F3N4O4/c1-29(2)22(34)14-6-4-5-13(9-14)15-7-8-17-20-19(21(33)28-12-24(25,26)27)16(11-32)18(30(20)3)10-31(17)23(15)35/h4-9,16,18-20,32H,10-12H2,1-3H3,(H,28,33)/t16-,18-,19+,20+/m1/s1	KOJKRQVKKNDDMT-LMCOJAPRSA-N	CN(C)C(=O)c1cccc(c1)C2=CC=C3[C@H]4[C@H]([C@H](CO)[C@@H](CN3C2=O)N4C)C(=O)NCC(F)(F)F	BroadT	BRD-K93681700	BRD-K93681700-001-01-1	Broad Institute of MIT and Harvard	BRD-K93681700			CN(C)C(=O)c1cccc(c1)-c1ccc2[C@H]3[C@H]([C@H](CO)[C@@H](Cn2c1=O)N3C)C(=O)NCC(F)(F)F	InChI=1S/C24H27F3N4O4/c1-29(2)22(34)14-6-4-5-13(9-14)15-7-8-17-20-19(21(33)28-12-24(25,26)27)16(11-32)18(30(20)3)10-31(17)23(15)35/h4-9,16,18-20,32H,10-12H2,1-3H3,(H,28,33)/t16-,18-,19+,20+/m1/s1	KOJKRQVKKNDDMT-LMCOJAPRSA-N	492.198439984							102829
BRD-K66602457	LSM-12483		54661261	InChI=1S/C29H32FN3O3/c1-3-14-32-26-23(24(17-34)27(32)28(35)31-18(2)19-8-5-4-6-9-19)16-33-25(26)13-12-22(29(33)36)20-10-7-11-21(30)15-20/h4-13,15,18,23-24,26-27,34H,3,14,16-17H2,1-2H3,(H,31,35)/t18-,23-,24-,26+,27-/m1/s1	FDXOBPCLNSDZHU-MQWSOPDOSA-N	CCCN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@@H]12)C(=O)N[C@H](C)c5ccccc5	BroadT	BRD-K66602457	BRD-K66602457-001-01-5	Broad Institute of MIT and Harvard	BRD-K66602457			CCCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]12)C(=O)N[C@H](C)c1ccccc1	InChI=1S/C29H32FN3O3/c1-3-14-32-26-23(24(17-34)27(32)28(35)31-18(2)19-8-5-4-6-9-19)16-33-25(26)13-12-22(29(33)36)20-10-7-11-21(30)15-20/h4-13,15,18,23-24,26-27,34H,3,14,16-17H2,1-2H3,(H,31,35)/t18-,23-,24-,26+,27-/m1/s1	FDXOBPCLNSDZHU-MQWSOPDOSA-N	489.242770114							101114
BRD-K15420741	LSM-9352		54661090	InChI=1S/C27H28FN3O3/c1-29(2)27(34)24-21(16-32)23-15-31-22(25(24)30(23)14-17-7-4-3-5-8-17)12-11-20(26(31)33)18-9-6-10-19(28)13-18/h3-13,21,23-25,32H,14-16H2,1-2H3/t21-,23-,24+,25+/m0/s1	DPECORRGLVHITO-VLYJIQRVSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@H]1N2Cc5ccccc5	BroadT	BRD-K15420741	BRD-K15420741-001-01-0	Broad Institute of MIT and Harvard	BRD-K15420741			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]1N2Cc1ccccc1	InChI=1S/C27H28FN3O3/c1-29(2)27(34)24-21(16-32)23-15-31-22(25(24)30(23)14-17-7-4-3-5-8-17)12-11-20(26(31)33)18-9-6-10-19(28)13-18/h3-13,21,23-25,32H,14-16H2,1-2H3/t21-,23-,24+,25+/m0/s1	DPECORRGLVHITO-VLYJIQRVSA-N	461.211469986							97973
BRD-K45525014	LSM-11207		54661266	InChI=1S/C25H32N4O4/c1-6-28-21-18(19(14-30)22(28)25(33)27(4)5)13-29-20(21)11-10-17(24(29)32)15-8-7-9-16(12-15)23(31)26(2)3/h7-12,18-19,21-22,30H,6,13-14H2,1-5H3/t18-,19-,21+,22-/m1/s1	QNTNHIANOHBUGN-KRXUUXHPSA-N	CCN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccc(c4)C(=O)N(C)C)[C@@H]12)C(=O)N(C)C	BroadT	BRD-K45525014	BRD-K45525014-001-01-0	Broad Institute of MIT and Harvard	BRD-K45525014			CCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4cccc(c4)C(=O)N(C)C)c3=O)[C@@H]12)C(=O)N(C)C	InChI=1S/C25H32N4O4/c1-6-28-21-18(19(14-30)22(28)25(33)27(4)5)13-29-20(21)11-10-17(24(29)32)15-8-7-9-16(12-15)23(31)26(2)3/h7-12,18-19,21-22,30H,6,13-14H2,1-5H3/t18-,19-,21+,22-/m1/s1	QNTNHIANOHBUGN-KRXUUXHPSA-N	452.242355544							99828
BRD-K13417398	LSM-9231		54661079	InChI=1S/C23H26N4O4/c28-14-15-18-13-26-17(8-6-9-19(26)29)21(20(15)23(31)25-11-4-1-5-12-25)27(18)22(30)16-7-2-3-10-24-16/h2-3,6-10,15,18,20-21,28H,1,4-5,11-14H2/t15-,18-,20+,21+/m0/s1	NNGWCWYYPXSIHJ-GDVKCFTOSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)N4CCCCC4)N2C(=O)c5ccccn5	BroadT	BRD-K13417398	BRD-K13417398-001-01-4	Broad Institute of MIT and Harvard	BRD-K13417398			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)N1CCCCC1)N2C(=O)c1ccccn1	InChI=1S/C23H26N4O4/c28-14-15-18-13-26-17(8-6-9-19(26)29)21(20(15)23(31)25-11-4-1-5-12-25)27(18)22(30)16-7-2-3-10-24-16/h2-3,6-10,15,18,20-21,28H,1,4-5,11-14H2/t15-,18-,20+,21+/m0/s1	NNGWCWYYPXSIHJ-GDVKCFTOSA-N	422.195405352							97852
BRD-M18345234	LSM-45009		54661130	InChI=1S/C25H31N3O3/c1-4-9-18-12-13-20-23-22(24(30)26-16(3)17-10-7-6-8-11-17)19(15-29)21(27(23)5-2)14-28(20)25(18)31/h4,6-13,16,19,21-23,29H,5,14-15H2,1-3H3,(H,26,30)/t16-,19+,21+,22-,23-/m1/s1	ZMVMPHHWVOTKTD-BLYUNERFSA-N	CCN1[C@H]2CN3C(=CC=C(C=CC)C3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N[C@H](C)c4ccccc4	BroadT	BRD-M18345234	BRD-M18345234-001-01-8	Broad Institute of MIT and Harvard	BRD-M18345234		CCN1[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1[C@H](C(=O)N[C@H](C)c1ccccc1)[C@H]2CO.CCN1[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]1[C@H](C(=O)N[C@H](C)c1ccccc1)[C@H]2CO	CCN1[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1[C@H](C(=O)N[C@H](C)c1ccccc1)[C@H]2CO.CCN1[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]1[C@H](C(=O)N[C@H](C)c1ccccc1)[C@H]2CO	InChI=1S/2C25H31N3O3/c2*1-4-9-18-12-13-20-23-22(24(30)26-16(3)17-10-7-6-8-11-17)19(15-29)21(27(23)5-2)14-28(20)25(18)31/h2*4,6-13,16,19,21-23,29H,5,14-15H2,1-3H3,(H,26,30)/b9-4+;9-4-/t2*16-,19+,21+,22-,23-/m11/s1	QNYIUHHVJKFROO-XNECVGOFSA-N	421.236541882							103246
BRD-K84443834	LSM-13590		54661460	InChI=1S/C25H27N3O4/c1-15(30)28-22-19(20(14-29)23(28)24(31)26-17-9-3-2-4-10-17)13-27-21(22)12-11-18(25(27)32)16-7-5-6-8-16/h2-4,7,9-12,19-20,22-23,29H,5-6,8,13-14H2,1H3,(H,26,31)/t19-,20-,22+,23-/m1/s1	CIRAGUKJUQGHED-YXPKMTABSA-N	CC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@@H]12)C(=O)Nc5ccccc5	BroadT	BRD-K84443834	BRD-K84443834-001-01-6	Broad Institute of MIT and Harvard	BRD-K84443834			CC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]12)C(=O)Nc1ccccc1	InChI=1S/C25H27N3O4/c1-15(30)28-22-19(20(14-29)23(28)24(31)26-17-9-3-2-4-10-17)13-27-21(22)12-11-18(25(27)32)16-7-5-6-8-16/h2-4,7,9-12,19-20,22-23,29H,5-6,8,13-14H2,1H3,(H,26,31)/t19-,20-,22+,23-/m1/s1	CIRAGUKJUQGHED-YXPKMTABSA-N	433.200156374							102234
BRD-K14622703	LSM-9314		54661443	InChI=1S/C22H29N3O3/c26-12-17-16-11-25-18(9-8-15(22(25)28)14-4-2-1-3-5-14)19(16)24-20(17)21(27)23-10-13-6-7-13/h4,8-9,13,16-17,19-20,24,26H,1-3,5-7,10-12H2,(H,23,27)/t16-,17-,19+,20-/m0/s1	GFSIQHCCTSVNND-XEYPJELSSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N[C@@H]1C(=O)NCC4CC4)C5=CCCCC5	BroadT	BRD-K14622703	BRD-K14622703-001-01-8	Broad Institute of MIT and Harvard	BRD-K14622703			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]2N[C@@H]1C(=O)NCC1CC1	InChI=1S/C22H29N3O3/c26-12-17-16-11-25-18(9-8-15(22(25)28)14-4-2-1-3-5-14)19(16)24-20(17)21(27)23-10-13-6-7-13/h4,8-9,13,16-17,19-20,24,26H,1-3,5-7,10-12H2,(H,23,27)/t16-,17-,19+,20-/m0/s1	GFSIQHCCTSVNND-XEYPJELSSA-N	383.220891818							97935
BRD-K59455917	LSM-43484		54661291	InChI=1S/C24H27N3O4/c1-15(29)27-20-13-26-19(22(27)21(18(20)14-28)24(31)25(2)3)12-11-17(23(26)30)10-9-16-7-5-4-6-8-16/h4-12,18,20-22,28H,13-14H2,1-3H3/b10-9+/t18-,20-,21+,22+/m1/s1	SFMBZXLPYFCTAU-GECRNVAXSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@@H]1N2C(=O)C	BroadT	BRD-K59455917	BRD-K59455917-001-01-1	Broad Institute of MIT and Harvard	BRD-K59455917			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]1N2C(C)=O	InChI=1S/C24H27N3O4/c1-15(29)27-20-13-26-19(22(27)21(18(20)14-28)24(31)25(2)3)12-11-17(23(26)30)10-9-16-7-5-4-6-8-16/h4-12,18,20-22,28H,13-14H2,1-3H3/b10-9+/t18-,20-,21+,22+/m1/s1	SFMBZXLPYFCTAU-GECRNVAXSA-N	421.200156374							
BRD-K86530412	LSM-13728		54661409	InChI=1S/C28H33N3O4/c1-17(19-9-5-3-6-10-19)29-27(34)25-22(16-32)24-15-30-23(26(25)31(24)18(2)33)14-13-21(28(30)35)20-11-7-4-8-12-20/h3,5-6,9-11,13-14,17,22,24-26,32H,4,7-8,12,15-16H2,1-2H3,(H,29,34)/t17-,22-,24-,25+,26+/m1/s1	GHJDVSDORYSUSR-DUVDYXJLSA-N	C[C@@H](NC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C4=CCCCC4)C3=O)[C@@H]1N2C(=O)C)c5ccccc5	BroadT	BRD-K86530412	BRD-K86530412-001-01-8	Broad Institute of MIT and Harvard	BRD-K86530412			C[C@@H](NC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]1N2C(C)=O)c1ccccc1	InChI=1S/C28H33N3O4/c1-17(19-9-5-3-6-10-19)29-27(34)25-22(16-32)24-15-30-23(26(25)31(24)18(2)33)14-13-21(28(30)35)20-11-7-4-8-12-20/h3,5-6,9-11,13-14,17,22,24-26,32H,4,7-8,12,15-16H2,1-2H3,(H,29,34)/t17-,22-,24-,25+,26+/m1/s1	GHJDVSDORYSUSR-DUVDYXJLSA-N	475.247106566							102377
BRD-K14302953	LSM-9292		54661240	InChI=1S/C25H31N3O4/c1-3-26-24(30)22-19(14-29)21-13-28-20(23(22)27(21)12-15-4-5-15)11-10-18(25(28)31)16-6-8-17(32-2)9-7-16/h6-11,15,19,21-23,29H,3-5,12-14H2,1-2H3,(H,26,30)/t19-,21-,22+,23+/m1/s1	ZKVVKUIGPSFRPG-LGKPFJOYSA-N	CCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccc(OC)cc4)[C@@H]1N2CC5CC5	BroadT	BRD-K14302953	BRD-K14302953-001-01-4	Broad Institute of MIT and Harvard	BRD-K14302953			CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccc(OC)cc4)c3=O)[C@@H]1N2CC1CC1	InChI=1S/C25H31N3O4/c1-3-26-24(30)22-19(14-29)21-13-28-20(23(22)27(21)12-15-4-5-15)11-10-18(25(28)31)16-6-8-17(32-2)9-7-16/h6-11,15,19,21-23,29H,3-5,12-14H2,1-2H3,(H,26,30)/t19-,21-,22+,23+/m1/s1	ZKVVKUIGPSFRPG-LGKPFJOYSA-N	437.231456502							97913
BRD-K85568664	LSM-13659		54661069	InChI=1S/C25H32N4O3/c1-28-22-19(20(15-30)23(28)24(31)27-12-16-6-3-2-4-7-16)14-29-21(22)10-9-18(25(29)32)17-8-5-11-26-13-17/h5,8-11,13,16,19-20,22-23,30H,2-4,6-7,12,14-15H2,1H3,(H,27,31)/t19-,20-,22+,23-/m0/s1	ODVRBXJNMOGDSF-RLBLXZPPSA-N	CN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]12)c4cccnc4)C(=O)NCC5CCCCC5	BroadT	BRD-K85568664	BRD-K85568664-001-01-4	Broad Institute of MIT and Harvard	BRD-K85568664			CN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]12)C(=O)NCC1CCCCC1	InChI=1S/C25H32N4O3/c1-28-22-19(20(15-30)23(28)24(31)27-12-16-6-3-2-4-7-16)14-29-21(22)10-9-18(25(29)32)17-8-5-11-26-13-17/h5,8-11,13,16,19-20,22-23,30H,2-4,6-7,12,14-15H2,1H3,(H,27,31)/t19-,20-,22+,23-/m0/s1	ODVRBXJNMOGDSF-RLBLXZPPSA-N	436.247440924							102306
BRD-K16113530	LSM-9398		54661334	InChI=1S/C26H32N4O3/c1-28(2)26(33)24-21(16-31)20-15-29-22(23(20)30(24)14-18-10-6-7-13-27-18)12-11-19(25(29)32)17-8-4-3-5-9-17/h6-8,10-13,20-21,23-24,31H,3-5,9,14-16H2,1-2H3/t20-,21-,23+,24-/m1/s1	QLERNNCBDUJEFV-CJTFWIGWSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C4=CCCCC4)C3=O)[C@H]2N1Cc5ccccn5	BroadT	BRD-K16113530	BRD-K16113530-001-01-5	Broad Institute of MIT and Harvard	BRD-K16113530			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]2N1Cc1ccccn1	InChI=1S/C26H32N4O3/c1-28(2)26(33)24-21(16-31)20-15-29-22(23(20)30(24)14-18-10-6-7-13-27-18)12-11-19(25(29)32)17-8-4-3-5-9-17/h6-8,10-13,20-21,23-24,31H,3-5,9,14-16H2,1-2H3/t20-,21-,23+,24-/m1/s1	QLERNNCBDUJEFV-CJTFWIGWSA-N	448.247440924							98019
BRD-K08707982	LSM-8956		54661143	InChI=1S/C25H29N3O5/c1-26(2)25(32)22-19(13-29)18-12-27-20(21(18)28(22)23(30)14-7-8-14)10-9-17(24(27)31)15-5-4-6-16(11-15)33-3/h4-6,9-11,14,18-19,21-22,29H,7-8,12-13H2,1-3H3/t18-,19-,21+,22-/m0/s1	GXOJNSFKOZUWBX-MPJJRAAHSA-N	COc1cccc(c1)C2=CC=C3[C@H]4[C@@H](CN3C2=O)[C@H](CO)[C@H](N4C(=O)C5CC5)C(=O)N(C)C	BroadT	BRD-K08707982	BRD-K08707982-001-01-7	Broad Institute of MIT and Harvard	BRD-K08707982			COc1cccc(c1)-c1ccc2[C@H]3[C@@H](Cn2c1=O)[C@H](CO)[C@H](N3C(=O)C1CC1)C(=O)N(C)C	InChI=1S/C25H29N3O5/c1-26(2)25(32)22-19(13-29)18-12-27-20(21(18)28(22)23(30)14-7-8-14)10-9-17(24(27)31)15-5-4-6-16(11-15)33-3/h4-6,9-11,14,18-19,21-22,29H,7-8,12-13H2,1-3H3/t18-,19-,21+,22-/m0/s1	GXOJNSFKOZUWBX-MPJJRAAHSA-N	451.210721058							97577
BRD-M63389385	LSM-45053		54661318	InChI=1S/C23H28N4O3S/c1-2-3-15-6-7-18-20-16(11-26(18)23(15)30)17(13-28)21(22(29)25-10-14-4-5-14)27(20)12-19-24-8-9-31-19/h2-3,6-9,14,16-17,20-21,28H,4-5,10-13H2,1H3,(H,25,29)/t16-,17-,20+,21-/m0/s1	LDJBNXGTZHCRNA-PZBISTMVSA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3Cc4nccs4)C(=O)NCC5CC5	BroadT	BRD-M63389385	BRD-M63389385-001-01-7	Broad Institute of MIT and Harvard	BRD-M63389385		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCC4CC4)N(Cc4nccs4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCC4CC4)N(Cc4nccs4)[C@@H]23)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCC4CC4)N(Cc4nccs4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCC4CC4)N(Cc4nccs4)[C@@H]23)c1=O	InChI=1S/2C23H28N4O3S/c2*1-2-3-15-6-7-18-20-16(11-26(18)23(15)30)17(13-28)21(22(29)25-10-14-4-5-14)27(20)12-19-24-8-9-31-19/h2*2-3,6-9,14,16-17,20-21,28H,4-5,10-13H2,1H3,(H,25,29)/b3-2+;3-2-/t2*16-,17-,20+,21-/m00/s1	JBQIXEWNJHRVMZ-OSXHJNLWSA-N	440.188211486							103290
BRD-K82332258	LSM-13460		54661082	InChI=1S/C28H34FN3O4/c29-20-3-1-2-19(12-20)21-6-7-24-25-22(15-31(24)28(21)35)23(16-33)26(27(34)30-13-17-4-5-17)32(25)14-18-8-10-36-11-9-18/h1-3,6-7,12,17-18,22-23,25-26,33H,4-5,8-11,13-16H2,(H,30,34)/t22-,23-,25+,26-/m0/s1	QQHZYPMPDOLVNZ-LJCOXQHRSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N(CC4CCOCC4)[C@@H]1C(=O)NCC5CC5)c6cccc(F)c6	BroadT	BRD-K82332258	BRD-K82332258-001-01-0	Broad Institute of MIT and Harvard	BRD-K82332258			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]2N(CC2CCOCC2)[C@@H]1C(=O)NCC1CC1	InChI=1S/C28H34FN3O4/c29-20-3-1-2-19(12-20)21-6-7-24-25-22(15-31(24)28(21)35)23(16-33)26(27(34)30-13-17-4-5-17)32(25)14-18-8-10-36-11-9-18/h1-3,6-7,12,17-18,22-23,25-26,33H,4-5,8-11,13-16H2,(H,30,34)/t22-,23-,25+,26-/m0/s1	QQHZYPMPDOLVNZ-LJCOXQHRSA-N	495.253334798							102100
BRD-M78319284	LSM-45068		54661335	InChI=1S/C27H33FN4O4/c1-4-8-17-11-12-21-24-23(25(34)29-13-7-14-30(2)3)19(16-33)22(15-31(21)26(17)35)32(24)27(36)18-9-5-6-10-20(18)28/h4-6,8-12,19,22-24,33H,7,13-16H2,1-3H3,(H,29,34)/t19-,22-,23+,24+/m0/s1	ZXRDMZYXGOPOHF-ZMUKGBGYSA-N	CC=CC1=CC=C2[C@@H]3[C@@H]([C@@H](CO)[C@H](CN2C1=O)N3C(=O)c4ccccc4F)C(=O)NCCCN(C)C	BroadT	BRD-M78319284	BRD-M78319284-001-01-9	Broad Institute of MIT and Harvard	BRD-M78319284		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCCN(C)C)[C@@H]2N3C(=O)c2ccccc2F)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCCN(C)C)[C@@H]2N3C(=O)c2ccccc2F)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCCN(C)C)[C@@H]2N3C(=O)c2ccccc2F)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCCN(C)C)[C@@H]2N3C(=O)c2ccccc2F)c1=O	InChI=1S/2C27H33FN4O4/c2*1-4-8-17-11-12-21-24-23(25(34)29-13-7-14-30(2)3)19(16-33)22(15-31(21)26(17)35)32(24)27(36)18-9-5-6-10-20(18)28/h2*4-6,8-12,19,22-24,33H,7,13-16H2,1-3H3,(H,29,34)/b8-4+;8-4-/t2*19-,22-,23+,24+/m00/s1	HYTUMCUDYCUVDJ-GTBANQJZSA-N	496.248583776							103305
BRD-K65761985	LSM-12437		54661324	InChI=1S/C23H29N5O3/c1-25-9-11-26(12-10-25)23(31)21-17(15-29)19-14-27-18(3-2-4-20(27)30)22(21)28(19)13-16-5-7-24-8-6-16/h2-8,17,19,21-22,29H,9-15H2,1H3/t17-,19-,21+,22+/m1/s1	BSTTWZJBQFNDNI-IVOMFYJKSA-N	CN1CCN(CC1)C(=O)[C@H]2[C@H](CO)[C@H]3CN4C(=O)C=CC=C4[C@@H]2N3Cc5ccncc5	BroadT	BRD-K65761985	BRD-K65761985-001-01-1	Broad Institute of MIT and Harvard	BRD-K65761985			CN1CCN(CC1)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2Cc1ccncc1	InChI=1S/C23H29N5O3/c1-25-9-11-26(12-10-25)23(31)21-17(15-29)19-14-27-18(3-2-4-20(27)30)22(21)28(19)13-16-5-7-24-8-6-16/h2-8,17,19,21-22,29H,9-15H2,1H3/t17-,19-,21+,22+/m1/s1	BSTTWZJBQFNDNI-IVOMFYJKSA-N	423.227039838							101065
BRD-K43771394	LSM-11098		54661151	InChI=1S/C27H27FN4O4/c1-2-30-26(35)25-21(15-33)20-14-31-22(10-9-19(27(31)36)17-5-7-18(28)8-6-17)24(20)32(25)23(34)12-16-4-3-11-29-13-16/h3-11,13,20-21,24-25,33H,2,12,14-15H2,1H3,(H,30,35)/t20-,21-,24+,25-/m0/s1	KPWZAVBDHNROKR-MHOPESGUSA-N	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]2N1C(=O)Cc5cccnc5	BroadT	BRD-K43771394	BRD-K43771394-001-01-2	Broad Institute of MIT and Harvard	BRD-K43771394			CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]2N1C(=O)Cc1cccnc1	InChI=1S/C27H27FN4O4/c1-2-30-26(35)25-21(15-33)20-14-31-22(10-9-19(27(31)36)17-5-7-18(28)8-6-17)24(20)32(25)23(34)12-16-4-3-11-29-13-16/h3-11,13,20-21,24-25,33H,2,12,14-15H2,1H3,(H,30,35)/t20-,21-,24+,25-/m0/s1	KPWZAVBDHNROKR-MHOPESGUSA-N	490.201633584							99719
BRD-M22422412	LSM-45013		54661043	InChI=1S/C26H33N5O4/c1-3-5-16-8-9-21-22-19(13-30(21)25(16)34)20(14-32)23(31(22)26(35)17-6-4-7-17)24(33)27-11-10-18-12-29(2)15-28-18/h3,5,8-9,12,15,17,19-20,22-23,32H,4,6-7,10-11,13-14H2,1-2H3,(H,27,33)/t19-,20-,22+,23-/m1/s1	UQZMKBRPQWZRBW-YXPKMTABSA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3C(=O)C4CCC4)C(=O)NCCc5cn(C)cn5	BroadT	BRD-M22422412	BRD-M22422412-001-01-3	Broad Institute of MIT and Harvard	BRD-M22422412		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCc4ncn(C)c4)N(C(=O)C4CCC4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCc4ncn(C)c4)N(C(=O)C4CCC4)[C@H]23)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCc4ncn(C)c4)N(C(=O)C4CCC4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCc4ncn(C)c4)N(C(=O)C4CCC4)[C@H]23)c1=O	InChI=1S/2C26H33N5O4/c2*1-3-5-16-8-9-21-22-19(13-30(21)25(16)34)20(14-32)23(31(22)26(35)17-6-4-7-17)24(33)27-11-10-18-12-29(2)15-28-18/h2*3,5,8-9,12,15,17,19-20,22-23,32H,4,6-7,10-11,13-14H2,1-2H3,(H,27,33)/b5-3+;5-3-/t2*19-,20-,22+,23-/m11/s1	KFLXYRYRDPTUGX-MUSMGLNYSA-N	479.253254586							103250
BRD-K13094522	LSM-9212		54661248	InChI=1S/C27H36N4O5/c1-5-13-30-23-20(21(16-32)24(30)25(33)28-12-14-36-4)15-31-22(23)11-10-19(27(31)35)17-6-8-18(9-7-17)26(34)29(2)3/h6-11,20-21,23-24,32H,5,12-16H2,1-4H3,(H,28,33)/t20-,21-,23+,24-/m1/s1	MMSAETDDPZXZRS-CJTFWIGWSA-N	CCCN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccc(cc4)C(=O)N(C)C)[C@@H]12)C(=O)NCCOC	BroadT	BRD-K13094522	BRD-K13094522-001-01-0	Broad Institute of MIT and Harvard	BRD-K13094522			CCCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccc(cc4)C(=O)N(C)C)c3=O)[C@@H]12)C(=O)NCCOC	InChI=1S/C27H36N4O5/c1-5-13-30-23-20(21(16-32)24(30)25(33)28-12-14-36-4)15-31-22(23)11-10-19(27(31)35)17-6-8-18(9-7-17)26(34)29(2)3/h6-11,20-21,23-24,32H,5,12-16H2,1-4H3,(H,28,33)/t20-,21-,23+,24-/m1/s1	MMSAETDDPZXZRS-CJTFWIGWSA-N	496.268570292							97833
BRD-K88272013	LSM-13850		54661326	InChI=1S/C25H29FN2O4/c1-32-25(31)22-18(14-29)21-13-28-20(23(22)27(21)12-15-6-2-3-7-15)11-10-17(24(28)30)16-8-4-5-9-19(16)26/h4-5,8-11,15,18,21-23,29H,2-3,6-7,12-14H2,1H3/t18-,21-,22+,23+/m0/s1	PYNGVIMXOMYUPN-XSEFMFLKSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]1N2CC5CCCC5	BroadT	BRD-K88272013	BRD-K88272013-001-01-8	Broad Institute of MIT and Harvard	BRD-K88272013			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]1N2CC1CCCC1	InChI=1S/C25H29FN2O4/c1-32-25(31)22-18(14-29)21-13-28-20(23(22)27(21)12-15-6-2-3-7-15)11-10-17(24(28)30)16-8-4-5-9-19(16)26/h4-5,8-11,15,18,21-23,29H,2-3,6-7,12-14H2,1H3/t18-,21-,22+,23+/m0/s1	PYNGVIMXOMYUPN-XSEFMFLKSA-N	440.211135628							102501
BRD-M97109212	LSM-45091		54661447	InChI=1S/C24H28ClN3O3/c1-3-7-15-10-11-20-21-17(13-27(20)24(15)31)18(14-29)22(23(30)26-4-2)28(21)12-16-8-5-6-9-19(16)25/h3,5-11,17-18,21-22,29H,4,12-14H2,1-2H3,(H,26,30)/t17-,18-,21+,22-/m1/s1	FRGNTWRPDAOXEK-RPHTVSPISA-N	CCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@H]2N1Cc4ccccc4Cl)C=CC	BroadT	BRD-M97109212	BRD-M97109212-001-01-8	Broad Institute of MIT and Harvard	BRD-M97109212		CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]2N1Cc1ccccc1Cl.CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]2N1Cc1ccccc1Cl	CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]2N1Cc1ccccc1Cl.CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]2N1Cc1ccccc1Cl	InChI=1S/2C24H28ClN3O3/c2*1-3-7-15-10-11-20-21-17(13-27(20)24(15)31)18(14-29)22(23(30)26-4-2)28(21)12-16-8-5-6-9-19(16)25/h2*3,5-11,17-18,21-22,29H,4,12-14H2,1-2H3,(H,26,30)/b7-3+;7-3-/t2*17-,18-,21+,22-/m11/s1	BBJDFTMDCDCETN-JGQYPKSMSA-N	441.181919496							103328
BRD-K49620695	LSM-11445		54661050	InChI=1S/C28H30N4O4/c33-18-22-24-17-32-23(9-8-21(27(32)34)20-6-2-1-3-7-20)26(31(24)16-19-5-4-10-29-15-19)25(22)28(35)30-11-13-36-14-12-30/h1-10,15,22,24-26,33H,11-14,16-18H2/t22-,24-,25+,26+/m0/s1	UHLPFNSCOMKACG-ADXHGGABSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@H]([C@@H]1C(=O)N5CCOCC5)N2Cc6cccnc6	BroadT	BRD-K49620695	BRD-K49620695-001-01-1	Broad Institute of MIT and Harvard	BRD-K49620695			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]([C@@H]1C(=O)N1CCOCC1)N2Cc1cccnc1	InChI=1S/C28H30N4O4/c33-18-22-24-17-32-23(9-8-21(27(32)34)20-6-2-1-3-7-20)26(31(24)16-19-5-4-10-29-15-19)25(22)28(35)30-11-13-36-14-12-30/h1-10,15,22,24-26,33H,11-14,16-18H2/t22-,24-,25+,26+/m0/s1	UHLPFNSCOMKACG-ADXHGGABSA-N	486.22670548							100066
BRD-K51147043	LSM-11555		54661065	InChI=1S/C25H24F3N5O3/c26-25(27,28)14-31-23(35)22-19(13-34)18-12-32-20(21(18)33(22)11-15-3-7-29-8-4-15)2-1-17(24(32)36)16-5-9-30-10-6-16/h1-10,18-19,21-22,34H,11-14H2,(H,31,35)/t18-,19-,21+,22-/m1/s1	VFFISKNUVGRLDD-KRXUUXHPSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@H]2N(Cc5ccncc5)[C@H]1C(=O)NCC(F)(F)F	BroadT	BRD-K51147043	BRD-K51147043-001-01-9	Broad Institute of MIT and Harvard	BRD-K51147043			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]2N(Cc2ccncc2)[C@H]1C(=O)NCC(F)(F)F	InChI=1S/C25H24F3N5O3/c26-25(27,28)14-31-23(35)22-19(13-34)18-12-32-20(21(18)33(22)11-15-3-7-29-8-4-15)2-1-17(24(32)36)16-5-9-30-10-6-16/h1-10,18-19,21-22,34H,11-14H2,(H,31,35)/t18-,19-,21+,22-/m1/s1	VFFISKNUVGRLDD-KRXUUXHPSA-N	499.183124278							100178
BRD-K23406211	LSM-9838		54661408	InChI=1S/C28H33N3O4/c1-17(19-9-5-3-6-10-19)29-27(34)25-22(16-32)24-15-30-23(26(25)31(24)18(2)33)14-13-21(28(30)35)20-11-7-4-8-12-20/h3,5-6,9-11,13-14,17,22,24-26,32H,4,7-8,12,15-16H2,1-2H3,(H,29,34)/t17-,22+,24+,25-,26-/m1/s1	GHJDVSDORYSUSR-OPISNSTKSA-N	C[C@@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C4=CCCCC4)C3=O)[C@H]1N2C(=O)C)c5ccccc5	BroadT	BRD-K23406211	BRD-K23406211-001-01-0	Broad Institute of MIT and Harvard	BRD-K23406211			C[C@@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]1N2C(C)=O)c1ccccc1	InChI=1S/C28H33N3O4/c1-17(19-9-5-3-6-10-19)29-27(34)25-22(16-32)24-15-30-23(26(25)31(24)18(2)33)14-13-21(28(30)35)20-11-7-4-8-12-20/h3,5-6,9-11,13-14,17,22,24-26,32H,4,7-8,12,15-16H2,1-2H3,(H,29,34)/t17-,22+,24+,25-,26-/m1/s1	GHJDVSDORYSUSR-OPISNSTKSA-N	475.247106566							98459
BRD-M23605671	LSM-45015		54661256	InChI=1S/C27H33N3O4/c1-3-6-18-11-12-21-25-24(26(32)28-13-17-9-10-17)20(16-31)22(15-30(21)27(18)33)29(25)14-19-7-4-5-8-23(19)34-2/h3-8,11-12,17,20,22,24-25,31H,9-10,13-16H2,1-2H3,(H,28,32)/t20-,22-,24+,25+/m1/s1	HTMWEZISYHEYGX-KAKDDGLXSA-N	COc1ccccc1CN2[C@@H]3CN4C(=CC=C(C=CC)C4=O)[C@H]2[C@H]([C@@H]3CO)C(=O)NCC5CC5	BroadT	BRD-M23605671	BRD-M23605671-001-01-8	Broad Institute of MIT and Harvard	BRD-M23605671		COc1ccccc1CN1[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1[C@@H](C(=O)NCC1CC1)[C@@H]2CO.COc1ccccc1CN1[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]1[C@@H](C(=O)NCC1CC1)[C@@H]2CO	COc1ccccc1CN1[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1[C@@H](C(=O)NCC1CC1)[C@@H]2CO.COc1ccccc1CN1[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]1[C@@H](C(=O)NCC1CC1)[C@@H]2CO	InChI=1S/2C27H33N3O4/c2*1-3-6-18-11-12-21-25-24(26(32)28-13-17-9-10-17)20(16-31)22(15-30(21)27(18)33)29(25)14-19-7-4-5-8-23(19)34-2/h2*3-8,11-12,17,20,22,24-25,31H,9-10,13-16H2,1-2H3,(H,28,32)/b6-3+;6-3-/t2*20-,22-,24+,25+/m11/s1	JHOBQZIWRGZUGJ-CXFGJDQDSA-N	463.247106566							103252
BRD-K16794723	LSM-9447		54661210	InChI=1S/C23H28N4O3/c1-25(2)23(30)20-17(13-28)19-12-27-18(21(20)26(19)11-14-3-4-14)6-5-16(22(27)29)15-7-9-24-10-8-15/h5-10,14,17,19-21,28H,3-4,11-13H2,1-2H3/t17-,19-,20+,21+/m0/s1	JAONLNNFEYMMMA-MJUUVYJYSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]1N2CC4CC4)c5ccncc5	BroadT	BRD-K16794723	BRD-K16794723-001-01-9	Broad Institute of MIT and Harvard	BRD-K16794723			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]1N2CC1CC1	InChI=1S/C23H28N4O3/c1-25(2)23(30)20-17(13-28)19-12-27-18(21(20)26(19)11-14-3-4-14)6-5-16(22(27)29)15-7-9-24-10-8-15/h5-10,14,17,19-21,28H,3-4,11-13H2,1-2H3/t17-,19-,20+,21+/m0/s1	JAONLNNFEYMMMA-MJUUVYJYSA-N	408.216140796							98068
BRD-K92770212	LSM-14114		54661456	InChI=1S/C25H35N3O4/c1-26(2)25(31)22-19(15-29)21-14-28-20(8-7-18(24(28)30)17-5-3-4-6-17)23(22)27(21)13-16-9-11-32-12-10-16/h5,7-8,16,19,21-23,29H,3-4,6,9-15H2,1-2H3/t19-,21-,22+,23+/m0/s1	GAIIVBPAQZZTRV-KZKAQZJJSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]1N2CC4CCOCC4)C5=CCCC5	BroadT	BRD-K92770212	BRD-K92770212-001-01-4	Broad Institute of MIT and Harvard	BRD-K92770212			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]1N2CC1CCOCC1	InChI=1S/C25H35N3O4/c1-26(2)25(31)22-19(15-29)21-14-28-20(8-7-18(24(28)30)17-5-3-4-6-17)23(22)27(21)13-16-9-11-32-12-10-16/h5,7-8,16,19,21-23,29H,3-4,6,9-15H2,1-2H3/t19-,21-,22+,23+/m0/s1	GAIIVBPAQZZTRV-KZKAQZJJSA-N	441.26275663							102768
BRD-K86578973	LSM-13731		54661058	InChI=1S/C27H33N3O5/c1-35-19-10-5-7-17(13-19)14-28-26(33)24-20(16-31)22-15-29-21(11-6-12-23(29)32)25(24)30(22)27(34)18-8-3-2-4-9-18/h5-7,10-13,18,20,22,24-25,31H,2-4,8-9,14-16H2,1H3,(H,28,33)/t20-,22-,24+,25+/m1/s1	PNHDRDYFFADBCF-KAKDDGLXSA-N	COc1cccc(CNC(=O)[C@H]2[C@H](CO)[C@H]3CN4C(=O)C=CC=C4[C@@H]2N3C(=O)C5CCCCC5)c1	BroadT	BRD-K86578973	BRD-K86578973-001-01-8	Broad Institute of MIT and Harvard	BRD-K86578973			COc1cccc(CNC(=O)[C@H]2[C@H](CO)[C@H]3Cn4c(cccc4=O)[C@@H]2N3C(=O)C2CCCCC2)c1	InChI=1S/C27H33N3O5/c1-35-19-10-5-7-17(13-19)14-28-26(33)24-20(16-31)22-15-29-21(11-6-12-23(29)32)25(24)30(22)27(34)18-8-3-2-4-9-18/h5-7,10-13,18,20,22,24-25,31H,2-4,8-9,14-16H2,1H3,(H,28,33)/t20-,22-,24+,25+/m1/s1	PNHDRDYFFADBCF-KAKDDGLXSA-N	479.242021186							102380
BRD-K93406741	LSM-14156		54661142	InChI=1S/C27H28N4O5/c1-36-16-23(33)31-22-14-30-21(11-10-19(27(30)35)17-7-3-2-4-8-17)25(31)24(20(22)15-32)26(34)29-13-18-9-5-6-12-28-18/h2-12,20,22,24-25,32H,13-16H2,1H3,(H,29,34)/t20-,22-,24+,25+/m1/s1	YNLXOCAZEKAELA-KAKDDGLXSA-N	COCC(=O)N1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc5ccccn5	BroadT	BRD-K93406741	BRD-K93406741-001-01-4	Broad Institute of MIT and Harvard	BRD-K93406741			COCC(=O)N1[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc1ccccn1	InChI=1S/C27H28N4O5/c1-36-16-23(33)31-22-14-30-21(11-10-19(27(30)35)17-7-3-2-4-8-17)25(31)24(20(22)15-32)26(34)29-13-18-9-5-6-12-28-18/h2-12,20,22,24-25,32H,13-16H2,1H3,(H,29,34)/t20-,22-,24+,25+/m1/s1	YNLXOCAZEKAELA-KAKDDGLXSA-N	488.205970036							102810
BRD-K71533863	LSM-12804		54661268	InChI=1S/C21H24N2O4/c1-27-21(26)19-15(13-24)17-12-23-16(8-5-9-18(23)25)20(19)22(17)11-10-14-6-3-2-4-7-14/h2-9,15,17,19-20,24H,10-13H2,1H3/t15-,17-,19+,20+/m0/s1	YMDLGNDEUAJUCM-SMMRIJLZSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]1N2CCc4ccccc4	BroadT	BRD-K71533863	BRD-K71533863-001-01-3	Broad Institute of MIT and Harvard	BRD-K71533863			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2CCc1ccccc1	InChI=1S/C21H24N2O4/c1-27-21(26)19-15(13-24)17-12-23-16(8-5-9-18(23)25)20(19)22(17)11-10-14-6-3-2-4-7-14/h2-9,15,17,19-20,24H,10-13H2,1H3/t15-,17-,19+,20+/m0/s1	YMDLGNDEUAJUCM-SMMRIJLZSA-N	368.173607268							101441
BRD-K52303942	LSM-11626		54661446	InChI=1S/C24H30FN3O4/c1-3-11-27-20-13-28-19(9-8-17(24(28)31)15-4-6-16(25)7-5-15)22(27)21(18(20)14-29)23(30)26-10-12-32-2/h4-9,18,20-22,29H,3,10-14H2,1-2H3,(H,26,30)/t18-,20-,21+,22+/m1/s1	IYRJHNQZTHMZFV-YJMBLLCNSA-N	CCCN1[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCOC	BroadT	BRD-K52303942	BRD-K52303942-001-01-9	Broad Institute of MIT and Harvard	BRD-K52303942			CCCN1[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCOC	InChI=1S/C24H30FN3O4/c1-3-11-27-20-13-28-19(9-8-17(24(28)31)15-4-6-16(25)7-5-15)22(27)21(18(20)14-29)23(30)26-10-12-32-2/h4-9,18,20-22,29H,3,10-14H2,1-2H3,(H,26,30)/t18-,20-,21+,22+/m1/s1	IYRJHNQZTHMZFV-YJMBLLCNSA-N	443.22203467							100251
BRD-K41215666	LSM-10936		54661102	InChI=1S/C27H28FN3O3/c1-16(17-8-4-3-5-9-17)29-26(33)24-20(15-32)23-14-31-22(25(24)30(23)2)13-12-19(27(31)34)18-10-6-7-11-21(18)28/h3-13,16,20,23-25,32H,14-15H2,1-2H3,(H,29,33)/t16-,20-,23-,24+,25+/m0/s1	XOPHINQZQCNQKH-CJYVJLDJSA-N	C[C@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]1N2C)c5ccccc5	BroadT	BRD-K41215666	BRD-K41215666-001-01-3	Broad Institute of MIT and Harvard	BRD-K41215666			C[C@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]1N2C)c1ccccc1	InChI=1S/C27H28FN3O3/c1-16(17-8-4-3-5-9-17)29-26(33)24-20(15-32)23-14-31-22(25(24)30(23)2)13-12-19(27(31)34)18-10-6-7-11-21(18)28/h3-13,16,20,23-25,32H,14-15H2,1-2H3,(H,29,33)/t16-,20-,23-,24+,25+/m0/s1	XOPHINQZQCNQKH-CJYVJLDJSA-N	461.211469986							99557
BRD-K46811158-001-01-9	LSM-26279	BRD-K46811158	54661061	InChI=1S/C25H23FN4O4/c26-17-8-6-15(7-9-17)11-28-24(33)23-19(14-31)18-13-29-20(4-1-5-21(29)32)22(18)30(23)25(34)16-3-2-10-27-12-16/h1-10,12,18-19,22-23,31H,11,13-14H2,(H,28,33)/t18-,19-,22+,23-/m1/s1	UPOVAPIOUWKYFQ-PJIZGREPSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N([C@H]1C(=O)NCc4ccc(F)cc4)C(=O)c5cccnc5	BroadT	BRD-K46811158	BRD-K46811158-001-01-9	Broad Institute of MIT and Harvard	BRD-K46811158			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N([C@H]1C(=O)NCc1ccc(F)cc1)C(=O)c1cccnc1	InChI=1S/C25H23FN4O4/c26-17-8-6-15(7-9-17)11-28-24(33)23-19(14-31)18-13-29-20(4-1-5-21(29)32)22(18)30(23)25(34)16-3-2-10-27-12-16/h1-10,12,18-19,22-23,31H,11,13-14H2,(H,28,33)/t18-,19-,22+,23-/m1/s1	UPOVAPIOUWKYFQ-PJIZGREPSA-N	462.170333456							114817
BRD-K09817289	LSM-9028		54661328	InChI=1S/C21H31N3O3/c1-2-22-21(27)20-16(13-25)15-12-23-17(9-6-10-18(23)26)19(15)24(20)11-14-7-4-3-5-8-14/h6,9-10,14-16,19-20,25H,2-5,7-8,11-13H2,1H3,(H,22,27)/t15-,16-,19+,20-/m0/s1	ZLPHSXDBJGBVPE-FEHORTKBSA-N	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N1CC4CCCCC4	BroadT	BRD-K09817289	BRD-K09817289-001-01-3	Broad Institute of MIT and Harvard	BRD-K09817289			CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@@H]2N1CC1CCCCC1	InChI=1S/C21H31N3O3/c1-2-22-21(27)20-16(13-25)15-12-23-17(9-6-10-18(23)26)19(15)24(20)11-14-7-4-3-5-8-14/h6,9-10,14-16,19-20,25H,2-5,7-8,11-13H2,1H3,(H,22,27)/t15-,16-,19+,20-/m0/s1	ZLPHSXDBJGBVPE-FEHORTKBSA-N	373.236541882							97649
BRD-K72383170	LSM-12871		54661458	InChI=1S/C25H25N3O4/c1-32-25(31)23-20(15-29)19-14-27-21(22(19)28(23)13-17-9-5-6-12-26-17)11-10-18(24(27)30)16-7-3-2-4-8-16/h2-12,19-20,22-23,29H,13-15H2,1H3/t19-,20-,22+,23-/m0/s1	HHLLHWFWRSRSTM-RLBLXZPPSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@@H]2N1Cc5ccccn5	BroadT	BRD-K72383170	BRD-K72383170-001-01-0	Broad Institute of MIT and Harvard	BRD-K72383170			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]2N1Cc1ccccn1	InChI=1S/C25H25N3O4/c1-32-25(31)23-20(15-29)19-14-27-21(22(19)28(23)13-17-9-5-6-12-26-17)11-10-18(24(27)30)16-7-3-2-4-8-16/h2-12,19-20,22-23,29H,13-15H2,1H3/t19-,20-,22+,23-/m0/s1	HHLLHWFWRSRSTM-RLBLXZPPSA-N	431.18450631							101508
BRD-K51826244	LSM-11600		54661259	InChI=1S/C30H37N3O3/c34-19-25-24-18-33-26(12-11-23(29(33)35)22-9-5-2-6-10-22)27(24)31-28(25)30(36)32-15-13-21(14-16-32)17-20-7-3-1-4-8-20/h1,3-4,7-9,11-12,21,24-25,27-28,31,34H,2,5-6,10,13-19H2/t24-,25-,27+,28-/m0/s1	FDPYZAHJFSZBPH-KWNVVKLJSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N[C@@H]1C(=O)N4CCC(Cc5ccccc5)CC4)C6=CCCCC6	BroadT	BRD-K51826244	BRD-K51826244-001-01-5	Broad Institute of MIT and Harvard	BRD-K51826244			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]2N[C@@H]1C(=O)N1CCC(Cc2ccccc2)CC1	InChI=1S/C30H37N3O3/c34-19-25-24-18-33-26(12-11-23(29(33)35)22-9-5-2-6-10-22)27(24)31-28(25)30(36)32-15-13-21(14-16-32)17-20-7-3-1-4-8-20/h1,3-4,7-9,11-12,21,24-25,27-28,31,34H,2,5-6,10,13-19H2/t24-,25-,27+,28-/m0/s1	FDPYZAHJFSZBPH-KWNVVKLJSA-N	487.283492074							100223
BRD-K79025148	LSM-13255		54661329	InChI=1S/C26H30N2O4/c29-16-20-22-15-28-21(12-11-19(25(28)30)18-9-5-2-6-10-18)24(23(20)26(31)32)27(22)14-13-17-7-3-1-4-8-17/h1,3-4,7-9,11-12,20,22-24,29H,2,5-6,10,13-16H2,(H,31,32)/t20-,22-,23+,24+/m0/s1	BMAHPQVXADCICS-IQFVJIFQSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@H]([C@@H]1C(=O)O)N2CCc4ccccc4)C5=CCCCC5	BroadT	BRD-K79025148	BRD-K79025148-001-01-9	Broad Institute of MIT and Harvard	BRD-K79025148			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]([C@@H]1C(O)=O)N2CCc1ccccc1	InChI=1S/C26H30N2O4/c29-16-20-22-15-28-21(12-11-19(25(28)30)18-9-5-2-6-10-18)24(23(20)26(31)32)27(22)14-13-17-7-3-1-4-8-17/h1,3-4,7-9,11-12,20,22-24,29H,2,5-6,10,13-16H2,(H,31,32)/t20-,22-,23+,24+/m0/s1	BMAHPQVXADCICS-IQFVJIFQSA-N	434.22055746							101894
BRD-M03817478	LSM-44999		54661395	InChI=1S/C24H35N3O3/c1-3-7-17-10-11-19-22-21(23(29)25-12-4-2)18(15-28)20(14-27(19)24(17)30)26(22)13-16-8-5-6-9-16/h3,7,10-11,16,18,20-22,28H,4-6,8-9,12-15H2,1-2H3,(H,25,29)/t18-,20-,21+,22+/m1/s1	GKHQQRXCSHYBEI-YJMBLLCNSA-N	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]1N2CC4CCCC4)C=CC	BroadT	BRD-M03817478	BRD-M03817478-001-01-8	Broad Institute of MIT and Harvard	BRD-M03817478		CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1N2CC1CCCC1.CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@@H]1N2CC1CCCC1)\C=C/C	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1N2CC1CCCC1.CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@@H]1N2CC1CCCC1)\C=C/C	InChI=1S/2C24H35N3O3/c2*1-3-7-17-10-11-19-22-21(23(29)25-12-4-2)18(15-28)20(14-27(19)24(17)30)26(22)13-16-8-5-6-9-16/h2*3,7,10-11,16,18,20-22,28H,4-6,8-9,12-15H2,1-2H3,(H,25,29)/b7-3+;7-3-/t2*18-,20-,21+,22+/m11/s1	ZGZYPOOKVOHETF-XSGFGFKGSA-N	413.26784201							103236
BRD-K42379673	LSM-10997		54661442	InChI=1S/C23H33N3O4/c1-3-25-19-13-26-18(10-9-16(23(26)29)15-7-5-4-6-8-15)21(25)20(17(19)14-27)22(28)24-11-12-30-2/h7,9-10,17,19-21,27H,3-6,8,11-14H2,1-2H3,(H,24,28)/t17-,19-,20+,21+/m1/s1	JJLSIBFTWJLCMJ-PBASOCQRSA-N	CCN1[C@@H]2CN3C(=O)C(=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)NCCOC)C4=CCCCC4	BroadT	BRD-K42379673	BRD-K42379673-001-01-7	Broad Institute of MIT and Harvard	BRD-K42379673			CCN1[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCOC	InChI=1S/C23H33N3O4/c1-3-25-19-13-26-18(10-9-16(23(26)29)15-7-5-4-6-8-15)21(25)20(17(19)14-27)22(28)24-11-12-30-2/h7,9-10,17,19-21,27H,3-6,8,11-14H2,1-2H3,(H,24,28)/t17-,19-,20+,21+/m1/s1	JJLSIBFTWJLCMJ-PBASOCQRSA-N	415.247106566							99618
BRD-M12376605	LSM-45006		54661153	InChI=1S/C25H28F2N4O4/c1-3-5-14-6-9-19-22-21(23(33)28-10-4-2)16(13-32)20(12-30(19)24(14)34)31(22)25(35)29-18-11-15(26)7-8-17(18)27/h3,5-9,11,16,20-22,32H,4,10,12-13H2,1-2H3,(H,28,33)(H,29,35)/t16-,20-,21+,22+/m1/s1	ICXYKFCCQOPFQC-XXMUNEJQSA-N	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C=CC)C3=O)[C@@H]1N2C(=O)Nc4cc(F)ccc4F	BroadT	BRD-M12376605	BRD-M12376605-001-01-0	Broad Institute of MIT and Harvard	BRD-M12376605		CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]1N2C(=O)Nc1cc(F)ccc1F.CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]1N2C(=O)Nc1cc(F)ccc1F	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]1N2C(=O)Nc1cc(F)ccc1F.CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]1N2C(=O)Nc1cc(F)ccc1F	InChI=1S/2C25H28F2N4O4/c2*1-3-5-14-6-9-19-22-21(23(33)28-10-4-2)16(13-32)20(12-30(19)24(14)34)31(22)25(35)29-18-11-15(26)7-8-17(18)27/h2*3,5-9,11,16,20-22,32H,4,10,12-13H2,1-2H3,(H,28,33)(H,29,35)/b5-3+;5-3-/t2*16-,20-,21+,22+/m11/s1	QFZYXZULAIJTQK-UULBCUFKSA-N	486.207861816							103243
BRD-K24164383	LSM-9888		54661398	InChI=1S/C25H30FN3O3/c1-2-28-22-19(20(15-30)23(28)25(32)27-11-4-3-5-12-27)14-29-21(22)10-9-18(24(29)31)16-7-6-8-17(26)13-16/h6-10,13,19-20,22-23,30H,2-5,11-12,14-15H2,1H3/t19-,20-,22+,23-/m0/s1	IVBSCMTWKAMHGA-RLBLXZPPSA-N	CCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@H]12)C(=O)N5CCCCC5	BroadT	BRD-K24164383	BRD-K24164383-001-01-6	Broad Institute of MIT and Harvard	BRD-K24164383			CCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]12)C(=O)N1CCCCC1	InChI=1S/C25H30FN3O3/c1-2-28-22-19(20(15-30)23(28)25(32)27-11-4-3-5-12-27)14-29-21(22)10-9-18(24(29)31)16-7-6-8-17(26)13-16/h6-10,13,19-20,22-23,30H,2-5,11-12,14-15H2,1H3/t19-,20-,22+,23-/m0/s1	IVBSCMTWKAMHGA-RLBLXZPPSA-N	439.22712005							98509
BRD-K61519911	LSM-12158		54661457	InChI=1S/C25H25N3O4/c1-32-25(31)23-20(15-29)19-14-27-21(22(19)28(23)13-17-9-5-6-12-26-17)11-10-18(24(27)30)16-7-3-2-4-8-16/h2-12,19-20,22-23,29H,13-15H2,1H3/t19-,20-,22+,23-/m1/s1	HHLLHWFWRSRSTM-YXPKMTABSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@H]2N1Cc5ccccn5	BroadT	BRD-K61519911	BRD-K61519911-001-01-6	Broad Institute of MIT and Harvard	BRD-K61519911			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]2N1Cc1ccccn1	InChI=1S/C25H25N3O4/c1-32-25(31)23-20(15-29)19-14-27-21(22(19)28(23)13-17-9-5-6-12-26-17)11-10-18(24(27)30)16-7-3-2-4-8-16/h2-12,19-20,22-23,29H,13-15H2,1H3/t19-,20-,22+,23-/m1/s1	HHLLHWFWRSRSTM-YXPKMTABSA-N	431.18450631							100784
BRD-K90004145	LSM-13982		54661267	InChI=1S/C21H24N2O4/c1-27-21(26)19-15(13-24)17-12-23-16(8-5-9-18(23)25)20(19)22(17)11-10-14-6-3-2-4-7-14/h2-9,15,17,19-20,24H,10-13H2,1H3/t15-,17-,19+,20+/m1/s1	YMDLGNDEUAJUCM-BEKAIBRUSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]1N2CCc4ccccc4	BroadT	BRD-K90004145	BRD-K90004145-001-01-2	Broad Institute of MIT and Harvard	BRD-K90004145			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2CCc1ccccc1	InChI=1S/C21H24N2O4/c1-27-21(26)19-15(13-24)17-12-23-16(8-5-9-18(23)25)20(19)22(17)11-10-14-6-3-2-4-7-14/h2-9,15,17,19-20,24H,10-13H2,1H3/t15-,17-,19+,20+/m1/s1	YMDLGNDEUAJUCM-BEKAIBRUSA-N	368.173607268							102635
BRD-K04643052	LSM-8714		54596142	InChI=1S/C20H23N3O5S/c1-29(27,28)23-16-11-22-15(8-5-9-17(22)25)19(23)18(14(16)12-24)20(26)21-10-13-6-3-2-4-7-13/h2-9,14,16,18-19,24H,10-12H2,1H3,(H,21,26)/t14-,16-,18+,19+/m0/s1	BTVFIDRKUITRHL-IAAVTCLWSA-N	CS(=O)(=O)N1[C@H]2CN3C(=O)C=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc4ccccc4	BroadT	BRD-K04643052	BRD-K04643052-001-01-3	Broad Institute of MIT and Harvard	BRD-K04643052			CS(=O)(=O)N1[C@H]2Cn3c(cccc3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc1ccccc1	InChI=1S/C20H23N3O5S/c1-29(27,28)23-16-11-22-15(8-5-9-17(22)25)19(23)18(14(16)12-24)20(26)21-10-13-6-3-2-4-7-13/h2-9,14,16,18-19,24H,10-12H2,1H3,(H,21,26)/t14-,16-,18+,19+/m0/s1	BTVFIDRKUITRHL-IAAVTCLWSA-N	417.135841556							97335
BRD-K31422806	LSM-10332		54661293	InChI=1S/C26H27N5O3/c1-30-23-20(12-31-22(23)7-6-19(26(31)34)17-10-27-14-28-11-17)21(13-32)24(30)25(33)29-18-8-15-4-2-3-5-16(15)9-18/h2-7,10-11,14,18,20-21,23-24,32H,8-9,12-13H2,1H3,(H,29,33)/t20-,21-,23+,24-/m1/s1	DWBOFDUJFWPQPT-CJTFWIGWSA-N	CN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@@H]12)C(=O)NC5Cc6ccccc6C5	BroadT	BRD-K31422806	BRD-K31422806-001-01-8	Broad Institute of MIT and Harvard	BRD-K31422806			CN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@@H]12)C(=O)NC1Cc2ccccc2C1	InChI=1S/C26H27N5O3/c1-30-23-20(12-31-22(23)7-6-19(26(31)34)17-10-27-14-28-11-17)21(13-32)24(30)25(33)29-18-8-15-4-2-3-5-16(15)9-18/h2-7,10-11,14,18,20-21,23-24,32H,8-9,12-13H2,1H3,(H,29,33)/t20-,21-,23+,24-/m1/s1	DWBOFDUJFWPQPT-CJTFWIGWSA-N	457.211389774							98953
BRD-K43407975	LSM-11067		54661135	InChI=1S/C24H34N4O5S/c1-25-10-12-26(13-11-25)24(31)21-18(15-29)20-14-27-19(22(21)28(20)34(2,32)33)9-8-17(23(27)30)16-6-4-3-5-7-16/h6,8-9,18,20-22,29H,3-5,7,10-15H2,1-2H3/t18-,20-,21+,22+/m0/s1	NRVZDTJJXPAHOA-VXSCBNMQSA-N	CN1CCN(CC1)C(=O)[C@@H]2[C@@H](CO)[C@@H]3CN4C(=CC=C(C5=CCCCC5)C4=O)[C@H]2N3S(=O)(=O)C	BroadT	BRD-K43407975	BRD-K43407975-001-01-0	Broad Institute of MIT and Harvard	BRD-K43407975			CN1CCN(CC1)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]1N2S(C)(=O)=O	InChI=1S/C24H34N4O5S/c1-25-10-12-26(13-11-25)24(31)21-18(15-29)20-14-27-19(22(21)28(20)34(2,32)33)9-8-17(23(27)30)16-6-4-3-5-7-16/h6,8-9,18,20-22,29H,3-5,7,10-15H2,1-2H3/t18-,20-,21+,22+/m0/s1	NRVZDTJJXPAHOA-VXSCBNMQSA-N	490.224990918							99688
BRD-K47663354	LSM-11331		54661109	InChI=1S/C25H31N3O4/c1-26-22-18(19(15-29)23(26)25(31)27-12-6-3-7-13-27)14-28-20(22)11-10-17(24(28)30)16-8-4-5-9-21(16)32-2/h4-5,8-11,18-19,22-23,29H,3,6-7,12-15H2,1-2H3/t18-,19-,22+,23-/m0/s1	AZPGNHDLGJGRCW-LBVMUVSTSA-N	COc1ccccc1C2=CC=C3[C@H]4[C@@H](CN3C2=O)[C@H](CO)[C@H](N4C)C(=O)N5CCCCC5	BroadT	BRD-K47663354	BRD-K47663354-001-01-5	Broad Institute of MIT and Harvard	BRD-K47663354			COc1ccccc1-c1ccc2[C@H]3[C@@H](Cn2c1=O)[C@H](CO)[C@H](N3C)C(=O)N1CCCCC1	InChI=1S/C25H31N3O4/c1-26-22-18(19(15-29)23(26)25(31)27-12-6-3-7-13-27)14-28-20(22)11-10-17(24(28)30)16-8-4-5-9-21(16)32-2/h4-5,8-11,18-19,22-23,29H,3,6-7,12-15H2,1-2H3/t18-,19-,22+,23-/m0/s1	AZPGNHDLGJGRCW-LBVMUVSTSA-N	437.231456502							99952
BRD-K74043769	LSM-12960		54661345	InChI=1S/C22H25N3O5/c1-30-13-19(28)25-20-15(11-24-17(20)8-5-9-18(24)27)16(12-26)21(25)22(29)23-10-14-6-3-2-4-7-14/h2-9,15-16,20-21,26H,10-13H2,1H3,(H,23,29)/t15-,16-,20+,21-/m0/s1	DTBBLQRMWRNBOL-AFMUBRCDSA-N	COCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]12)C(=O)NCc4ccccc4	BroadT	BRD-K74043769	BRD-K74043769-001-01-5	Broad Institute of MIT and Harvard	BRD-K74043769			COCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]12)C(=O)NCc1ccccc1	InChI=1S/C22H25N3O5/c1-30-13-19(28)25-20-15(11-24-17(20)8-5-9-18(24)27)16(12-26)21(25)22(29)23-10-14-6-3-2-4-7-14/h2-9,15-16,20-21,26H,10-13H2,1H3,(H,23,29)/t15-,16-,20+,21-/m0/s1	DTBBLQRMWRNBOL-AFMUBRCDSA-N	411.17942093							101597
BRD-M95763088	LSM-45089		54661222	InChI=1S/C24H31N5O4/c1-4-6-15-7-8-18-22-21(23(32)25-10-9-16-11-27(3)14-26-16)17(13-30)19(12-28(18)24(15)33)29(22)20(31)5-2/h4,6-8,11,14,17,19,21-22,30H,5,9-10,12-13H2,1-3H3,(H,25,32)/t17-,19-,21+,22+/m0/s1	VOGACUDSELLWLB-HVJHZFLKSA-N	CCC(=O)N1[C@H]2CN3C(=CC=C(C=CC)C3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCc4cn(C)cn4	BroadT	BRD-M95763088	BRD-M95763088-001-01-5	Broad Institute of MIT and Harvard	BRD-M95763088		CCC(=O)N1[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCc1cn(C)cn1.CCC(=O)N1[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCc1cn(C)cn1	CCC(=O)N1[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCc1cn(C)cn1.CCC(=O)N1[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCc1cn(C)cn1	InChI=1S/2C24H31N5O4/c2*1-4-6-15-7-8-18-22-21(23(32)25-10-9-16-11-27(3)14-26-16)17(13-30)19(12-28(18)24(15)33)29(22)20(31)5-2/h2*4,6-8,11,14,17,19,21-22,30H,5,9-10,12-13H2,1-3H3,(H,25,32)/b6-4+;6-4-/t2*17-,19-,21+,22+/m00/s1	WMZNZTBMFPTLSB-GEYVEPQASA-N	453.237604522							103326
BRD-K31122916	LSM-10308		54661272	InChI=1S/C25H30N4O6/c1-13(2)26-25(35)29-19-11-28-18(21(29)20(24(33)34)17(19)12-30)9-8-16(23(28)32)14-6-5-7-15(10-14)22(31)27(3)4/h5-10,13,17,19-21,30H,11-12H2,1-4H3,(H,26,35)(H,33,34)/t17-,19-,20+,21+/m0/s1	HBVVCYLQQFLTLW-MJUUVYJYSA-N	CC(C)NC(=O)N1[C@H]2CN3C(=CC=C(C3=O)c4cccc(c4)C(=O)N(C)C)[C@@H]1[C@@H]([C@H]2CO)C(=O)O	BroadT	BRD-K31122916	BRD-K31122916-001-01-1	Broad Institute of MIT and Harvard	BRD-K31122916			CC(C)NC(=O)N1[C@H]2Cn3c(ccc(-c4cccc(c4)C(=O)N(C)C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(O)=O	InChI=1S/C25H30N4O6/c1-13(2)26-25(35)29-19-11-28-18(21(29)20(24(33)34)17(19)12-30)9-8-16(23(28)32)14-6-5-7-15(10-14)22(31)27(3)4/h5-10,13,17,19-21,30H,11-12H2,1-4H3,(H,26,35)(H,33,34)/t17-,19-,20+,21+/m0/s1	HBVVCYLQQFLTLW-MJUUVYJYSA-N	482.21653472							98929
BRD-K19645992	LSM-9616		54661170	InChI=1S/C27H29FN4O3/c1-2-11-30-26(34)24-20(16-33)23-15-32-22(8-7-19(27(32)35)17-9-12-29-13-10-17)25(24)31(23)14-18-5-3-4-6-21(18)28/h3-10,12-13,20,23-25,33H,2,11,14-16H2,1H3,(H,30,34)/t20-,23-,24+,25+/m0/s1	FKAVMSLVYBDOGB-MNPDLOSFSA-N	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@H]1N2Cc5ccccc5F	BroadT	BRD-K19645992	BRD-K19645992-001-01-4	Broad Institute of MIT and Harvard	BRD-K19645992			CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]1N2Cc1ccccc1F	InChI=1S/C27H29FN4O3/c1-2-11-30-26(34)24-20(16-33)23-15-32-22(8-7-19(27(32)35)17-9-12-29-13-10-17)25(24)31(23)14-18-5-3-4-6-21(18)28/h3-10,12-13,20,23-25,33H,2,11,14-16H2,1H3,(H,30,34)/t20-,23-,24+,25+/m0/s1	FKAVMSLVYBDOGB-MNPDLOSFSA-N	476.222369028							98237
BRD-K13896696	LSM-9270		54661441	InChI=1S/C23H33N3O4/c1-3-25-19-13-26-18(10-9-16(23(26)29)15-7-5-4-6-8-15)21(25)20(17(19)14-27)22(28)24-11-12-30-2/h7,9-10,17,19-21,27H,3-6,8,11-14H2,1-2H3,(H,24,28)/t17-,19-,20+,21+/m0/s1	JJLSIBFTWJLCMJ-MJUUVYJYSA-N	CCN1[C@H]2CN3C(=O)C(=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCOC)C4=CCCCC4	BroadT	BRD-K13896696	BRD-K13896696-001-01-8	Broad Institute of MIT and Harvard	BRD-K13896696			CCN1[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCOC	InChI=1S/C23H33N3O4/c1-3-25-19-13-26-18(10-9-16(23(26)29)15-7-5-4-6-8-15)21(25)20(17(19)14-27)22(28)24-11-12-30-2/h7,9-10,17,19-21,27H,3-6,8,11-14H2,1-2H3,(H,24,28)/t17-,19-,20+,21+/m0/s1	JJLSIBFTWJLCMJ-MJUUVYJYSA-N	415.247106566							97891
BRD-K75882457	LSM-13069		54661120	InChI=1S/C17H20N2O5/c1-24-17(23)14-10(8-20)12-7-18-11(3-2-4-13(18)21)15(14)19(12)16(22)9-5-6-9/h2-4,9-10,12,14-15,20H,5-8H2,1H3/t10-,12-,14+,15+/m0/s1	KUBNHDDGXKERLH-OBCWZRDOSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]1N2C(=O)C4CC4	BroadT	BRD-K75882457	BRD-K75882457-001-01-2	Broad Institute of MIT and Harvard	BRD-K75882457			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2C(=O)C1CC1	InChI=1S/C17H20N2O5/c1-24-17(23)14-10(8-20)12-7-18-11(3-2-4-13(18)21)15(14)19(12)16(22)9-5-6-9/h2-4,9-10,12,14-15,20H,5-8H2,1H3/t10-,12-,14+,15+/m0/s1	KUBNHDDGXKERLH-OBCWZRDOSA-N	332.13722176							101706
BRD-K09416407	LSM-8998		54661206	InChI=1S/C27H27FN4O4/c1-2-11-30-25(34)24-20(15-33)19-14-31-22(10-9-17(26(31)35)16-6-5-12-29-13-16)23(19)32(24)27(36)18-7-3-4-8-21(18)28/h3-10,12-13,19-20,23-24,33H,2,11,14-15H2,1H3,(H,30,34)/t19-,20-,23+,24-/m0/s1	LVLNEDZJLRSBBP-JVODISISSA-N	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]2N1C(=O)c5ccccc5F	BroadT	BRD-K09416407	BRD-K09416407-001-01-1	Broad Institute of MIT and Harvard	BRD-K09416407			CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]2N1C(=O)c1ccccc1F	InChI=1S/C27H27FN4O4/c1-2-11-30-25(34)24-20(15-33)19-14-31-22(10-9-17(26(31)35)16-6-5-12-29-13-16)23(19)32(24)27(36)18-7-3-4-8-21(18)28/h3-10,12-13,19-20,23-24,33H,2,11,14-15H2,1H3,(H,30,34)/t19-,20-,23+,24-/m0/s1	LVLNEDZJLRSBBP-JVODISISSA-N	490.201633584							97619
BRD-K03515977	LSM-8651		54661384	InChI=1S/C25H29N3O4/c1-26(2)25(32)21-18(14-29)20-13-27-19(22(21)28(20)23(30)16-9-6-10-16)12-11-17(24(27)31)15-7-4-3-5-8-15/h3-5,7-8,11-12,16,18,20-22,29H,6,9-10,13-14H2,1-2H3/t18-,20-,21+,22+/m0/s1	MBRBGBQUUNVPJA-VXSCBNMQSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@H]1N2C(=O)C5CCC5	BroadT	BRD-K03515977	BRD-K03515977-001-01-6	Broad Institute of MIT and Harvard	BRD-K03515977			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]1N2C(=O)C1CCC1	InChI=1S/C25H29N3O4/c1-26(2)25(32)21-18(14-29)20-13-27-19(22(21)28(20)23(30)16-9-6-10-16)12-11-17(24(27)31)15-7-4-3-5-8-15/h3-5,7-8,11-12,16,18,20-22,29H,6,9-10,13-14H2,1-2H3/t18-,20-,21+,22+/m0/s1	MBRBGBQUUNVPJA-VXSCBNMQSA-N	435.215806438							97272
BRD-M53302603	LSM-45043		54661162	InChI=1S/C23H26N2O6S/c1-4-6-15-9-10-18-21-20(23(28)31-3)17(13-26)19(12-24(18)22(15)27)25(21)32(29,30)16-8-5-7-14(2)11-16/h4-11,17,19-21,26H,12-13H2,1-3H3/t17-,19-,20+,21+/m1/s1	JDXNLCPGROUHQS-PBASOCQRSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C=CC)C3=O)[C@@H]1N2S(=O)(=O)c4cccc(C)c4	BroadT	BRD-M53302603	BRD-M53302603-001-01-8	Broad Institute of MIT and Harvard	BRD-M53302603		COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1N2S(=O)(=O)c1cccc(C)c1.COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]1N2S(=O)(=O)c1cccc(C)c1	COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1N2S(=O)(=O)c1cccc(C)c1.COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]1N2S(=O)(=O)c1cccc(C)c1	InChI=1S/2C23H26N2O6S/c2*1-4-6-15-9-10-18-21-20(23(28)31-3)17(13-26)19(12-24(18)22(15)27)25(21)32(29,30)16-8-5-7-14(2)11-16/h2*4-11,17,19-21,26H,12-13H2,1-3H3/b6-4+;6-4-/t2*17-,19-,20+,21+/m11/s1	OPJCSXFNIRQLBQ-WICKTZIJSA-N	458.151157262							103280
BRD-K08477148	LSM-8940		54661038	InChI=1S/C28H32FN3O3/c29-23-8-4-3-7-19(23)14-32-25-21(22(16-33)26(32)27(34)30-13-17-9-10-17)15-31-24(25)12-11-20(28(31)35)18-5-1-2-6-18/h3-5,7-8,11-12,17,21-22,25-26,33H,1-2,6,9-10,13-16H2,(H,30,34)/t21-,22-,25+,26-/m0/s1	KHFULICTXBCFCV-RLBRRGQKSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@@H]2N(Cc5ccccc5F)[C@@H]1C(=O)NCC6CC6	BroadT	BRD-K08477148	BRD-K08477148-001-01-8	Broad Institute of MIT and Harvard	BRD-K08477148			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]2N(Cc2ccccc2F)[C@@H]1C(=O)NCC1CC1	InChI=1S/C28H32FN3O3/c29-23-8-4-3-7-19(23)14-32-25-21(22(16-33)26(32)27(34)30-13-17-9-10-17)15-31-24(25)12-11-20(28(31)35)18-5-1-2-6-18/h3-5,7-8,11-12,17,21-22,25-26,33H,1-2,6,9-10,13-16H2,(H,30,34)/t21-,22-,25+,26-/m0/s1	KHFULICTXBCFCV-RLBRRGQKSA-N	477.242770114							97561
BRD-K32083350	LSM-43466		54661440	InChI=1S/C25H31N3O3/c1-3-14-27-21-15-28-20(23(27)22(19(21)16-29)24(30)26-4-2)13-12-18(25(28)31)11-10-17-8-6-5-7-9-17/h5-13,19,21-23,29H,3-4,14-16H2,1-2H3,(H,26,30)/b11-10+/t19-,21-,22+,23+/m1/s1	WELAGKOSDCWUQO-TWSJCRGDSA-N	CCCN1[C@@H]2CN3C(=O)C(=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)NCC)\C=C\c4ccccc4	BroadT	BRD-K32083350	BRD-K32083350-001-01-7	Broad Institute of MIT and Harvard	BRD-K32083350			CCCN1[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCC	InChI=1S/C25H31N3O3/c1-3-14-27-21-15-28-20(23(27)22(19(21)16-29)24(30)26-4-2)13-12-18(25(28)31)11-10-17-8-6-5-7-9-17/h5-13,19,21-23,29H,3-4,14-16H2,1-2H3,(H,26,30)/b11-10+/t19-,21-,22+,23+/m1/s1	WELAGKOSDCWUQO-TWSJCRGDSA-N	421.236541882							
BRD-K86684694	LSM-13738		54661078	InChI=1S/C25H23FN2O6S/c1-14-3-2-4-17(11-14)35(33,34)28-21-12-27-20(23(28)22(25(31)32)19(21)13-29)10-9-18(24(27)30)15-5-7-16(26)8-6-15/h2-11,19,21-23,29H,12-13H2,1H3,(H,31,32)/t19-,21-,22+,23+/m1/s1	MTJUDQAFHZBLAH-LGKPFJOYSA-N	Cc1cccc(c1)S(=O)(=O)N2[C@@H]3CN4C(=CC=C(C4=O)c5ccc(F)cc5)[C@H]2[C@H]([C@@H]3CO)C(=O)O	BroadT	BRD-K86684694	BRD-K86684694-001-01-2	Broad Institute of MIT and Harvard	BRD-K86684694			Cc1cccc(c1)S(=O)(=O)N1[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(O)=O	InChI=1S/C25H23FN2O6S/c1-14-3-2-4-17(11-14)35(33,34)28-21-12-27-20(23(28)22(25(31)32)19(21)13-29)10-9-18(24(27)30)15-5-7-16(26)8-6-15/h2-11,19,21-23,29H,12-13H2,1H3,(H,31,32)/t19-,21-,22+,23+/m1/s1	MTJUDQAFHZBLAH-LGKPFJOYSA-N	498.126085366							102387
BRD-K05649470	LSM-8761		54661098	InChI=1S/C26H27N5O5/c1-2-29-25(33)24-19(12-32)18-11-30-20(5-4-17(26(30)34)16-8-27-13-28-9-16)23(18)31(24)10-15-3-6-21-22(7-15)36-14-35-21/h3-9,13,18-19,23-24,32H,2,10-12,14H2,1H3,(H,29,33)/t18-,19-,23+,24-/m1/s1	ARVCVDNKKYJMNG-PBIIQAGSSA-N	CCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@H]2N1Cc4ccc5OCOc5c4)c6cncnc6	BroadT	BRD-K05649470	BRD-K05649470-001-01-3	Broad Institute of MIT and Harvard	BRD-K05649470			CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@H]2N1Cc1ccc2OCOc2c1	InChI=1S/C26H27N5O5/c1-2-29-25(33)24-19(12-32)18-11-30-20(5-4-17(26(30)34)16-8-27-13-28-9-16)23(18)31(24)10-15-3-6-21-22(7-15)36-14-35-21/h3-9,13,18-19,23-24,32H,2,10-12,14H2,1H3,(H,29,33)/t18-,19-,23+,24-/m1/s1	ARVCVDNKKYJMNG-PBIIQAGSSA-N	489.201219014							97382
BRD-K28589277	LSM-10161		54661404	InChI=1S/C21H22FN3O4/c1-23(2)21(29)18-14(11-26)16-10-24-15(4-3-5-17(24)27)19(18)25(16)20(28)12-6-8-13(22)9-7-12/h3-9,14,16,18-19,26H,10-11H2,1-2H3/t14-,16-,18+,19+/m0/s1	BBMUHFCQMOUBDR-IAAVTCLWSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]1N2C(=O)c4ccc(F)cc4	BroadT	BRD-K28589277	BRD-K28589277-001-01-9	Broad Institute of MIT and Harvard	BRD-K28589277			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2C(=O)c1ccc(F)cc1	InChI=1S/C21H22FN3O4/c1-23(2)21(29)18-14(11-26)16-10-24-15(4-3-5-17(24)27)19(18)25(16)20(28)12-6-8-13(22)9-7-12/h3-9,14,16,18-19,26H,10-11H2,1-2H3/t14-,16-,18+,19+/m0/s1	BBMUHFCQMOUBDR-IAAVTCLWSA-N	399.159434414							98782
BRD-M29192968	LSM-45019		54661225	InChI=1S/C26H35N5O5/c1-2-4-18-5-6-21-24-23(25(33)27-7-3-8-29-9-11-35-12-10-29)20(15-32)22(14-31(21)26(18)34)30(24)13-19-16-36-17-28-19/h2,4-6,16-17,20,22-24,32H,3,7-15H2,1H3,(H,27,33)/t20-,22-,23+,24+/m1/s1	PCOBEWZBZDTQSP-AZOUXBGGSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3Cc4cocn4)C(=O)NCCCN5CCOCC5	BroadT	BRD-M29192968	BRD-M29192968-001-01-3	Broad Institute of MIT and Harvard	BRD-M29192968		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCCN4CCOCC4)[C@H]2N3Cc2ncoc2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCCN4CCOCC4)[C@H]2N3Cc2ncoc2)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCCN4CCOCC4)[C@H]2N3Cc2ncoc2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCCN4CCOCC4)[C@H]2N3Cc2ncoc2)c1=O	InChI=1S/2C26H35N5O5/c2*1-2-4-18-5-6-21-24-23(25(33)27-7-3-8-29-9-11-35-12-10-29)20(15-32)22(14-31(21)26(18)34)30(24)13-19-16-36-17-28-19/h2*2,4-6,16-17,20,22-24,32H,3,7-15H2,1H3,(H,27,33)/b4-2+;4-2-/t2*20-,22-,23+,24+/m11/s1	BHAQUFGGEAXVJP-IHMYRQIWSA-N	497.26381927							103256
CHEMBL3187508	LSM-13673	BRD-K85689251	54661325	InChI=1S/C25H29FN2O4/c1-32-25(31)22-18(14-29)21-13-28-20(23(22)27(21)12-15-6-2-3-7-15)11-10-17(24(28)30)16-8-4-5-9-19(16)26/h4-5,8-11,15,18,21-23,29H,2-3,6-7,12-14H2,1H3/t18-,21-,22+,23+/m1/s1	PYNGVIMXOMYUPN-QQUTXWOLSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]1N2CC5CCCC5	BroadT	BRD-K85689251	BRD-K85689251-001-01-7	Broad Institute of MIT and Harvard	BRD-K85689251			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]1N2CC1CCCC1	InChI=1S/C25H29FN2O4/c1-32-25(31)22-18(14-29)21-13-28-20(23(22)27(21)12-15-6-2-3-7-15)11-10-17(24(28)30)16-8-4-5-9-19(16)26/h4-5,8-11,15,18,21-23,29H,2-3,6-7,12-14H2,1H3/t18-,21-,22+,23+/m1/s1	PYNGVIMXOMYUPN-QQUTXWOLSA-N	440.211135628							102320
BRD-K69097792	LSM-12645		54661382	InChI=1S/C25H30FN3O3/c1-2-11-27-24(31)23-19(14-30)18-13-28-21(22(18)29(23)12-15-7-8-15)10-9-17(25(28)32)16-5-3-4-6-20(16)26/h3-6,9-10,15,18-19,22-23,30H,2,7-8,11-14H2,1H3,(H,27,31)/t18-,19-,22+,23-/m1/s1	CGXNZKQEBMYQRR-PJIZGREPSA-N	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]2N1CC5CC5	BroadT	BRD-K69097792	BRD-K69097792-001-01-9	Broad Institute of MIT and Harvard	BRD-K69097792			CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]2N1CC1CC1	InChI=1S/C25H30FN3O3/c1-2-11-27-24(31)23-19(14-30)18-13-28-21(22(18)29(23)12-15-7-8-15)10-9-17(25(28)32)16-5-3-4-6-20(16)26/h3-6,9-10,15,18-19,22-23,30H,2,7-8,11-14H2,1H3,(H,27,31)/t18-,19-,22+,23-/m1/s1	CGXNZKQEBMYQRR-PJIZGREPSA-N	439.22712005							131211
BRD-M31111440	LSM-45023		54661165	InChI=1S/C23H26N2O6S/c1-4-6-15-9-10-18-21-20(23(28)31-3)17(13-26)19(12-24(18)22(15)27)25(21)32(29,30)16-8-5-7-14(2)11-16/h4-11,17,19-21,26H,12-13H2,1-3H3/t17-,19-,20+,21+/m0/s1	JDXNLCPGROUHQS-MJUUVYJYSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C=CC)C3=O)[C@H]1N2S(=O)(=O)c4cccc(C)c4	BroadT	BRD-M31111440	BRD-M31111440-001-01-7	Broad Institute of MIT and Harvard	BRD-M31111440		COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1N2S(=O)(=O)c1cccc(C)c1.COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]1N2S(=O)(=O)c1cccc(C)c1	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1N2S(=O)(=O)c1cccc(C)c1.COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]1N2S(=O)(=O)c1cccc(C)c1	InChI=1S/2C23H26N2O6S/c2*1-4-6-15-9-10-18-21-20(23(28)31-3)17(13-26)19(12-24(18)22(15)27)25(21)32(29,30)16-8-5-7-14(2)11-16/h2*4-11,17,19-21,26H,12-13H2,1-3H3/b6-4+;6-4-/t2*17-,19-,20+,21+/m00/s1	OPJCSXFNIRQLBQ-LWUOBCQHSA-N	458.151157262							103260
BRD-K27113545	LSM-10069		54661247	InChI=1S/C27H36N4O5/c1-5-13-30-23-20(21(16-32)24(30)25(33)28-12-14-36-4)15-31-22(23)11-10-19(27(31)35)17-6-8-18(9-7-17)26(34)29(2)3/h6-11,20-21,23-24,32H,5,12-16H2,1-4H3,(H,28,33)/t20-,21-,23+,24-/m0/s1	MMSAETDDPZXZRS-ZQRMPTRQSA-N	CCCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccc(cc4)C(=O)N(C)C)[C@H]12)C(=O)NCCOC	BroadT	BRD-K27113545	BRD-K27113545-001-01-5	Broad Institute of MIT and Harvard	BRD-K27113545			CCCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccc(cc4)C(=O)N(C)C)c3=O)[C@H]12)C(=O)NCCOC	InChI=1S/C27H36N4O5/c1-5-13-30-23-20(21(16-32)24(30)25(33)28-12-14-36-4)15-31-22(23)11-10-19(27(31)35)17-6-8-18(9-7-17)26(34)29(2)3/h6-11,20-21,23-24,32H,5,12-16H2,1-4H3,(H,28,33)/t20-,21-,23+,24-/m0/s1	MMSAETDDPZXZRS-ZQRMPTRQSA-N	496.268570292							98690
BRD-M73564418	LSM-45062		54661121	InChI=1S/C25H31N3O3/c1-4-9-18-12-13-20-23-22(24(30)26-16(3)17-10-7-6-8-11-17)19(15-29)21(27(23)5-2)14-28(20)25(18)31/h4,6-13,16,19,21-23,29H,5,14-15H2,1-3H3,(H,26,30)/t16-,19-,21-,22+,23+/m0/s1	ZMVMPHHWVOTKTD-JWPNJBJBSA-N	CCN1[C@H]2CN3C(=CC=C(C=CC)C3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N[C@@H](C)c4ccccc4	BroadT	BRD-M73564418	BRD-M73564418-001-01-4	Broad Institute of MIT and Harvard	BRD-M73564418		CCN1[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1[C@H](C(=O)N[C@@H](C)c1ccccc1)[C@H]2CO.CCN1[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]1[C@H](C(=O)N[C@@H](C)c1ccccc1)[C@H]2CO	CCN1[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1[C@H](C(=O)N[C@@H](C)c1ccccc1)[C@H]2CO.CCN1[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]1[C@H](C(=O)N[C@@H](C)c1ccccc1)[C@H]2CO	InChI=1S/2C25H31N3O3/c2*1-4-9-18-12-13-20-23-22(24(30)26-16(3)17-10-7-6-8-11-17)19(15-29)21(27(23)5-2)14-28(20)25(18)31/h2*4,6-13,16,19,21-23,29H,5,14-15H2,1-3H3,(H,26,30)/b9-4+;9-4-/t2*16-,19-,21-,22+,23+/m00/s1	QNYIUHHVJKFROO-CASUZUPASA-N	421.236541882							103299
BRD-K87688096	LSM-13805		54661148	InChI=1S/C26H28N6O4/c1-2-10-29-24(34)22-19(14-33)21-13-31-20(9-8-18(25(31)35)16-11-27-15-28-12-16)23(22)32(21)26(36)30-17-6-4-3-5-7-17/h3-9,11-12,15,19,21-23,33H,2,10,13-14H2,1H3,(H,29,34)(H,30,36)/t19-,21-,22+,23+/m1/s1	NNSFVWHQEZSLFM-LGKPFJOYSA-N	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@@H]1N2C(=O)Nc5ccccc5	BroadT	BRD-K87688096	BRD-K87688096-001-01-6	Broad Institute of MIT and Harvard	BRD-K87688096			CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@@H]1N2C(=O)Nc1ccccc1	InChI=1S/C26H28N6O4/c1-2-10-29-24(34)22-19(14-33)21-13-31-20(9-8-18(25(31)35)16-11-27-15-28-12-16)23(22)32(21)26(36)30-17-6-4-3-5-7-17/h3-9,11-12,15,19,21-23,33H,2,10,13-14H2,1H3,(H,29,34)(H,30,36)/t19-,21-,22+,23+/m1/s1	NNSFVWHQEZSLFM-LGKPFJOYSA-N	488.217203436							102454
BRD-K37284732	LSM-10678		54661278	InChI=1S/C25H30FN3O3/c1-2-10-28-21-13-29-20(9-8-18(25(29)32)16-4-3-5-17(26)11-16)23(28)22(19(21)14-30)24(31)27-12-15-6-7-15/h3-5,8-9,11,15,19,21-23,30H,2,6-7,10,12-14H2,1H3,(H,27,31)/t19-,21-,22+,23+/m0/s1	IRMAIVPGTUGMHM-KZKAQZJJSA-N	CCCN1[C@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCC5CC5	BroadT	BRD-K37284732	BRD-K37284732-001-01-5	Broad Institute of MIT and Harvard	BRD-K37284732			CCCN1[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCC1CC1	InChI=1S/C25H30FN3O3/c1-2-10-28-21-13-29-20(9-8-18(25(29)32)16-4-3-5-17(26)11-16)23(28)22(19(21)14-30)24(31)27-12-15-6-7-15/h3-5,8-9,11,15,19,21-23,30H,2,6-7,10,12-14H2,1H3,(H,27,31)/t19-,21-,22+,23+/m0/s1	IRMAIVPGTUGMHM-KZKAQZJJSA-N	439.22712005							99299
BRD-K97258019	LSM-14406		54661296	InChI=1S/C21H23N3O3/c25-12-15-16-11-24-17(6-3-7-18(24)26)20(22-16)19(15)21(27)23-9-8-13-4-1-2-5-14(13)10-23/h1-7,15-16,19-20,22,25H,8-12H2/t15-,16-,19+,20+/m1/s1	WCVQZBWBNHVCOB-YKCBXCCJSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H](N2)[C@H]1C(=O)N4CCc5ccccc5C4	BroadT	BRD-K97258019	BRD-K97258019-001-01-0	Broad Institute of MIT and Harvard	BRD-K97258019			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H](N2)[C@H]1C(=O)N1CCc2ccccc2C1	InChI=1S/C21H23N3O3/c25-12-15-16-11-24-17(6-3-7-18(24)26)20(22-16)19(15)21(27)23-9-8-13-4-1-2-5-14(13)10-23/h1-7,15-16,19-20,22,25H,8-12H2/t15-,16-,19+,20+/m1/s1	WCVQZBWBNHVCOB-YKCBXCCJSA-N	365.173941626							103060
BRD-K82150563	LSM-13447		54661085	InChI=1S/C29H32N4O4/c1-32(2)28(36)20-10-8-19(9-11-20)21-12-13-24-25-22(16-33(24)29(21)37)23(17-34)26(31-25)27(35)30-15-14-18-6-4-3-5-7-18/h3-13,22-23,25-26,31,34H,14-17H2,1-2H3,(H,30,35)/t22-,23-,25+,26-/m0/s1	HHBAGBOVOCHPKM-LJCOXQHRSA-N	CN(C)C(=O)c1ccc(cc1)C2=CC=C3[C@@H]4N[C@@H]([C@@H](CO)[C@@H]4CN3C2=O)C(=O)NCCc5ccccc5	BroadT	BRD-K82150563	BRD-K82150563-001-01-6	Broad Institute of MIT and Harvard	BRD-K82150563			CN(C)C(=O)c1ccc(cc1)-c1ccc2[C@@H]3N[C@@H]([C@@H](CO)[C@@H]3Cn2c1=O)C(=O)NCCc1ccccc1	InChI=1S/C29H32N4O4/c1-32(2)28(36)20-10-8-19(9-11-20)21-12-13-24-25-22(16-33(24)29(21)37)23(17-34)26(31-25)27(35)30-15-14-18-6-4-3-5-7-18/h3-13,22-23,25-26,31,34H,14-17H2,1-2H3,(H,30,35)/t22-,23-,25+,26-/m0/s1	HHBAGBOVOCHPKM-LJCOXQHRSA-N	500.242355544							102087
BRD-M76499661	LSM-45063		54661253	InChI=1S/C27H33N3O4/c1-3-6-18-11-12-21-25-24(26(32)28-13-17-9-10-17)20(16-31)22(15-30(21)27(18)33)29(25)14-19-7-4-5-8-23(19)34-2/h3-8,11-12,17,20,22,24-25,31H,9-10,13-16H2,1-2H3,(H,28,32)/t20-,22-,24+,25+/m0/s1	HTMWEZISYHEYGX-MMTHZHQFSA-N	COc1ccccc1CN2[C@H]3CN4C(=CC=C(C=CC)C4=O)[C@@H]2[C@@H]([C@H]3CO)C(=O)NCC5CC5	BroadT	BRD-M76499661	BRD-M76499661-001-01-4	Broad Institute of MIT and Harvard	BRD-M76499661		COc1ccccc1CN1[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1[C@H](C(=O)NCC1CC1)[C@H]2CO.COc1ccccc1CN1[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]1[C@H](C(=O)NCC1CC1)[C@H]2CO	COc1ccccc1CN1[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1[C@H](C(=O)NCC1CC1)[C@H]2CO.COc1ccccc1CN1[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]1[C@H](C(=O)NCC1CC1)[C@H]2CO	InChI=1S/2C27H33N3O4/c2*1-3-6-18-11-12-21-25-24(26(32)28-13-17-9-10-17)20(16-31)22(15-30(21)27(18)33)29(25)14-19-7-4-5-8-23(19)34-2/h2*3-8,11-12,17,20,22,24-25,31H,9-10,13-16H2,1-2H3,(H,28,32)/b6-3+;6-3-/t2*20-,22-,24+,25+/m00/s1	JHOBQZIWRGZUGJ-GHWRSBIYSA-N	463.247106566							103300
BRD-M24732042	LSM-45017		54661307	InChI=1S/C26H29N3O7/c1-3-4-16-6-7-18-24-23(25(32)27-10-15-5-8-20-21(9-15)36-14-35-20)17(12-30)19(11-28(18)26(16)33)29(24)22(31)13-34-2/h3-9,17,19,23-24,30H,10-14H2,1-2H3,(H,27,32)/t17-,19-,23+,24+/m0/s1	HQJXANMCBMUVFV-BLCURXPKSA-N	COCC(=O)N1[C@H]2CN3C(=O)C(=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc4ccc5OCOc5c4)C=CC	BroadT	BRD-M24732042	BRD-M24732042-001-01-1	Broad Institute of MIT and Harvard	BRD-M24732042		COCC(=O)N1[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc1ccc2OCOc2c1.COCC(=O)N1[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc1ccc2OCOc2c1	COCC(=O)N1[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc1ccc2OCOc2c1.COCC(=O)N1[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc1ccc2OCOc2c1	InChI=1S/2C26H29N3O7/c2*1-3-4-16-6-7-18-24-23(25(32)27-10-15-5-8-20-21(9-15)36-14-35-20)17(12-30)19(11-28(18)26(16)33)29(24)22(31)13-34-2/h2*3-9,17,19,23-24,30H,10-14H2,1-2H3,(H,27,32)/b4-3+;4-3-/t2*17-,19-,23+,24+/m00/s1	GLTXLIQGXWGMJJ-CMEYWLSJSA-N	495.200550298							103254
BRD-K32030161	LSM-10370		54661366	InChI=1S/C26H33N3O3/c1-28-22-15-29-21(13-12-19(26(29)32)18-10-6-3-7-11-18)24(28)23(20(22)16-30)25(31)27-14-17-8-4-2-5-9-17/h3,6-7,10-13,17,20,22-24,30H,2,4-5,8-9,14-16H2,1H3,(H,27,31)/t20-,22-,23+,24+/m0/s1	IUNMLESRWJTJRT-IQFVJIFQSA-N	CN1[C@H]2CN3C(=O)C(=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)NCC4CCCCC4)c5ccccc5	BroadT	BRD-K32030161	BRD-K32030161-001-01-7	Broad Institute of MIT and Harvard	BRD-K32030161			CN1[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCC1CCCCC1	InChI=1S/C26H33N3O3/c1-28-22-15-29-21(13-12-19(26(29)32)18-10-6-3-7-11-18)24(28)23(20(22)16-30)25(31)27-14-17-8-4-2-5-9-17/h3,6-7,10-13,17,20,22-24,30H,2,4-5,8-9,14-16H2,1H3,(H,27,31)/t20-,22-,23+,24+/m0/s1	IUNMLESRWJTJRT-IQFVJIFQSA-N	435.252191946							98991
BRD-K73517214	LSM-12933		54661252	InChI=1S/C26H23FN2O6/c1-35-15-8-6-14(7-9-15)16-10-11-20-23-22(26(33)34)18(13-30)21(12-28(20)24(16)31)29(23)25(32)17-4-2-3-5-19(17)27/h2-11,18,21-23,30H,12-13H2,1H3,(H,33,34)/t18-,21-,22+,23+/m1/s1	HJRLJVUTEJWJEN-QQUTXWOLSA-N	COc1ccc(cc1)C2=CC=C3[C@H]4[C@H]([C@H](CO)[C@@H](CN3C2=O)N4C(=O)c5ccccc5F)C(=O)O	BroadT	BRD-K73517214	BRD-K73517214-001-01-0	Broad Institute of MIT and Harvard	BRD-K73517214			COc1ccc(cc1)-c1ccc2[C@H]3[C@H]([C@H](CO)[C@@H](Cn2c1=O)N3C(=O)c1ccccc1F)C(O)=O	InChI=1S/C26H23FN2O6/c1-35-15-8-6-14(7-9-15)16-10-11-20-23-22(26(33)34)18(13-30)21(12-28(20)24(16)31)29(23)25(32)17-4-2-3-5-19(17)27/h2-11,18,21-23,30H,12-13H2,1H3,(H,33,34)/t18-,21-,22+,23+/m1/s1	HJRLJVUTEJWJEN-QQUTXWOLSA-N	478.154014676							101570
CHEMBL3188002	LSM-43496	BRD-K78845122	54661292	InChI=1S/C24H27N3O4/c1-15(29)27-20-13-26-19(22(27)21(18(20)14-28)24(31)25(2)3)12-11-17(23(26)30)10-9-16-7-5-4-6-8-16/h4-12,18,20-22,28H,13-14H2,1-3H3/b10-9+/t18-,20-,21+,22+/m0/s1	SFMBZXLPYFCTAU-RMDVGAJOSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@H]1N2C(=O)C	BroadT	BRD-K78845122	BRD-K78845122-001-01-1	Broad Institute of MIT and Harvard	BRD-K78845122			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]1N2C(C)=O	InChI=1S/C24H27N3O4/c1-15(29)27-20-13-26-19(22(27)21(18(20)14-28)24(31)25(2)3)12-11-17(23(26)30)10-9-16-7-5-4-6-8-16/h4-12,18,20-22,28H,13-14H2,1-3H3/b10-9+/t18-,20-,21+,22+/m0/s1	SFMBZXLPYFCTAU-RMDVGAJOSA-N	421.200156374							
BRD-K82019527	LSM-13437		54661171	InChI=1S/C27H29FN4O3/c1-2-11-30-26(34)24-20(16-33)23-15-32-22(8-7-19(27(32)35)17-9-12-29-13-10-17)25(24)31(23)14-18-5-3-4-6-21(18)28/h3-10,12-13,20,23-25,33H,2,11,14-16H2,1H3,(H,30,34)/t20-,23-,24+,25+/m1/s1	FKAVMSLVYBDOGB-GATIMQMVSA-N	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@@H]1N2Cc5ccccc5F	BroadT	BRD-K82019527	BRD-K82019527-001-01-8	Broad Institute of MIT and Harvard	BRD-K82019527			CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]1N2Cc1ccccc1F	InChI=1S/C27H29FN4O3/c1-2-11-30-26(34)24-20(16-33)23-15-32-22(8-7-19(27(32)35)17-9-12-29-13-10-17)25(24)31(23)14-18-5-3-4-6-21(18)28/h3-10,12-13,20,23-25,33H,2,11,14-16H2,1H3,(H,30,34)/t20-,23-,24+,25+/m1/s1	FKAVMSLVYBDOGB-GATIMQMVSA-N	476.222369028							102077
BRD-K17427497	LSM-9475		54661039	InChI=1S/C28H32FN3O3/c29-23-8-4-3-7-19(23)14-32-25-21(22(16-33)26(32)27(34)30-13-17-9-10-17)15-31-24(25)12-11-20(28(31)35)18-5-1-2-6-18/h3-5,7-8,11-12,17,21-22,25-26,33H,1-2,6,9-10,13-16H2,(H,30,34)/t21-,22-,25+,26-/m1/s1	KHFULICTXBCFCV-ULDOEVFSSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@H]2N(Cc5ccccc5F)[C@H]1C(=O)NCC6CC6	BroadT	BRD-K17427497	BRD-K17427497-001-01-9	Broad Institute of MIT and Harvard	BRD-K17427497			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]2N(Cc2ccccc2F)[C@H]1C(=O)NCC1CC1	InChI=1S/C28H32FN3O3/c29-23-8-4-3-7-19(23)14-32-25-21(22(16-33)26(32)27(34)30-13-17-9-10-17)15-31-24(25)12-11-20(28(31)35)18-5-1-2-6-18/h3-5,7-8,11-12,17,21-22,25-26,33H,1-2,6,9-10,13-16H2,(H,30,34)/t21-,22-,25+,26-/m1/s1	KHFULICTXBCFCV-ULDOEVFSSA-N	477.242770114							98096
BRD-M39787390	LSM-45030		54661392	InChI=1S/C24H35N3O3/c1-3-7-17-10-11-19-22-21(23(29)25-12-4-2)18(15-28)20(14-27(19)24(17)30)26(22)13-16-8-5-6-9-16/h3,7,10-11,16,18,20-22,28H,4-6,8-9,12-15H2,1-2H3,(H,25,29)/t18-,20-,21+,22+/m0/s1	GKHQQRXCSHYBEI-VXSCBNMQSA-N	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]1N2CC4CCCC4)C=CC	BroadT	BRD-M39787390	BRD-M39787390-001-01-6	Broad Institute of MIT and Harvard	BRD-M39787390		CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1N2CC1CCCC1.CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@H]1N2CC1CCCC1)\C=C/C	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1N2CC1CCCC1.CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@H]1N2CC1CCCC1)\C=C/C	InChI=1S/2C24H35N3O3/c2*1-3-7-17-10-11-19-22-21(23(29)25-12-4-2)18(15-28)20(14-27(19)24(17)30)26(22)13-16-8-5-6-9-16/h2*3,7,10-11,16,18,20-22,28H,4-6,8-9,12-15H2,1-2H3,(H,25,29)/b7-3+;7-3-/t2*18-,20-,21+,22+/m00/s1	ZGZYPOOKVOHETF-NLPWMXNUSA-N	413.26784201							103267
BRD-K20191348	LSM-43454		54661199	InChI=1S/C29H33N3O4/c33-17-22-24-16-31-23(14-13-21(28(31)35)12-11-18-5-2-1-3-6-18)26(32(24)29(36)20-7-4-8-20)25(22)27(34)30-15-19-9-10-19/h1-3,5-6,11-14,19-20,22,24-26,33H,4,7-10,15-17H2,(H,30,34)/b12-11+/t22-,24-,25+,26+/m1/s1	IAXCLMCZIRASFG-RONVXQAYSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@@H]([C@H]1C(=O)NCC4CC4)N2C(=O)C5CCC5)\C=C\c6ccccc6	BroadT	BRD-K20191348	BRD-K20191348-001-01-7	Broad Institute of MIT and Harvard	BRD-K20191348			OC[C@@H]1[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]([C@H]1C(=O)NCC1CC1)N2C(=O)C1CCC1	InChI=1S/C29H33N3O4/c33-17-22-24-16-31-23(14-13-21(28(31)35)12-11-18-5-2-1-3-6-18)26(32(24)29(36)20-7-4-8-20)25(22)27(34)30-15-19-9-10-19/h1-3,5-6,11-14,19-20,22,24-26,33H,4,7-10,15-17H2,(H,30,34)/b12-11+/t22-,24-,25+,26+/m1/s1	IAXCLMCZIRASFG-RONVXQAYSA-N	487.247106566							
BRD-K50670216	LSM-11514		54661209	InChI=1S/C23H28N4O3/c1-25(2)23(30)20-17(13-28)19-12-27-18(21(20)26(19)11-14-3-4-14)6-5-16(22(27)29)15-7-9-24-10-8-15/h5-10,14,17,19-21,28H,3-4,11-13H2,1-2H3/t17-,19-,20+,21+/m1/s1	JAONLNNFEYMMMA-PBASOCQRSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]1N2CC4CC4)c5ccncc5	BroadT	BRD-K50670216	BRD-K50670216-001-01-2	Broad Institute of MIT and Harvard	BRD-K50670216			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]1N2CC1CC1	InChI=1S/C23H28N4O3/c1-25(2)23(30)20-17(13-28)19-12-27-18(21(20)26(19)11-14-3-4-14)6-5-16(22(27)29)15-7-9-24-10-8-15/h5-10,14,17,19-21,28H,3-4,11-13H2,1-2H3/t17-,19-,20+,21+/m1/s1	JAONLNNFEYMMMA-PBASOCQRSA-N	408.216140796							100135
BRD-K16512302	LSM-9428		54661363	InChI=1S/C18H20F3N3O4/c19-18(20,21)8-22-16(27)15-11(7-25)10-6-23-12(2-1-3-13(23)26)14(10)24(15)17(28)9-4-5-9/h1-3,9-11,14-15,25H,4-8H2,(H,22,27)/t10-,11-,14+,15-/m0/s1	HYHGLNWEXAHCEQ-AZHAFVHUSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N([C@@H]1C(=O)NCC(F)(F)F)C(=O)C4CC4	BroadT	BRD-K16512302	BRD-K16512302-001-01-4	Broad Institute of MIT and Harvard	BRD-K16512302			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N([C@@H]1C(=O)NCC(F)(F)F)C(=O)C1CC1	InChI=1S/C18H20F3N3O4/c19-18(20,21)8-22-16(27)15-11(7-25)10-6-23-12(2-1-3-13(23)26)14(10)24(15)17(28)9-4-5-9/h1-3,9-11,14-15,25H,4-8H2,(H,22,27)/t10-,11-,14+,15-/m0/s1	HYHGLNWEXAHCEQ-AZHAFVHUSA-N	399.14059075							98049
BRD-K66860235	LSM-12503		54661237	InChI=1S/C23H26FN3O3/c1-26-19-11-27-18(10-9-16(23(27)30)13-5-7-14(24)8-6-13)21(26)20(17(19)12-28)22(29)25-15-3-2-4-15/h5-10,15,17,19-21,28H,2-4,11-12H2,1H3,(H,25,29)/t17-,19-,20+,21+/m1/s1	JCKMTOKPWGTWPB-PBASOCQRSA-N	CN1[C@@H]2CN3C(=O)C(=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)NC4CCC4)c5ccc(F)cc5	BroadT	BRD-K66860235	BRD-K66860235-001-01-8	Broad Institute of MIT and Harvard	BRD-K66860235			CN1[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NC1CCC1	InChI=1S/C23H26FN3O3/c1-26-19-11-27-18(10-9-16(23(27)30)13-5-7-14(24)8-6-13)21(26)20(17(19)12-28)22(29)25-15-3-2-4-15/h5-10,15,17,19-21,28H,2-4,11-12H2,1H3,(H,25,29)/t17-,19-,20+,21+/m1/s1	JCKMTOKPWGTWPB-PBASOCQRSA-N	411.195819922							101134
BRD-K87758256	LSM-13811		54661321	InChI=1S/C26H32N2O5/c1-32-22-10-6-5-9-17(22)18-11-12-21-23-19(14-27(21)25(18)30)20(15-29)24(26(31)33-2)28(23)13-16-7-3-4-8-16/h5-6,9-12,16,19-20,23-24,29H,3-4,7-8,13-15H2,1-2H3/t19-,20-,23+,24-/m0/s1	FQNLDYTYHLYOSL-JVODISISSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@@H]2N1CC5CCCC5	BroadT	BRD-K87758256	BRD-K87758256-001-01-3	Broad Institute of MIT and Harvard	BRD-K87758256			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@@H]2N1CC1CCCC1	InChI=1S/C26H32N2O5/c1-32-22-10-6-5-9-17(22)18-11-12-21-23-19(14-27(21)25(18)30)20(15-29)24(26(31)33-2)28(23)13-16-7-3-4-8-16/h5-6,9-12,16,19-20,23-24,29H,3-4,7-8,13-15H2,1-2H3/t19-,20-,23+,24-/m0/s1	FQNLDYTYHLYOSL-JVODISISSA-N	452.231122144							102460
BRD-K39143839	LSM-10802		54654254	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23-,25+/m0/s1	LLFGMIFPADLUOD-GRYUFTJMSA-N	CN1[C@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K39143839	BRD-K39143839-001-01-3	Broad Institute of MIT and Harvard	BRD-K39143839			CN1[C@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23-,25+/m0/s1	LLFGMIFPADLUOD-GRYUFTJMSA-N	535.22309731							99423
BRD-K12511144	LSM-9175		54654100	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23+,25+/m0/s1	WOMWNJCZYVCUPK-QQKQFIJSSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	BroadT	BRD-K12511144	BRD-K12511144-001-01-2	Broad Institute of MIT and Harvard	BRD-K12511144			COc1ccc(CNC(=O)C[C@@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23+,25+/m0/s1	WOMWNJCZYVCUPK-QQKQFIJSSA-N	509.25258587							97796
BRD-K38540783	LSM-10763		54653979	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24+,26+/m1/s1	CJRLOTNMWBMMLN-DSBYRVASSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K38540783	BRD-K38540783-001-01-7	Broad Institute of MIT and Harvard	BRD-K38540783			CN1[C@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24+,26+/m1/s1	CJRLOTNMWBMMLN-DSBYRVASSA-N	570.251205666							99384
BRD-K96646082	LSM-14363		54654055	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24+,28-/m0/s1	GPWYEVCXUJXIOI-VGKYISKLSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc5ccc(NC(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K96646082	BRD-K96646082-001-01-9	Broad Institute of MIT and Harvard	BRD-K96646082			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc2ccc(NC(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24+,28-/m0/s1	GPWYEVCXUJXIOI-VGKYISKLSA-N	575.20677853							103017
BRD-K32784186	LSM-10417		54654125	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26+,28-/m0/s1	KPGMTKVYFCJESC-AQHOXQCLSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C1=O	BroadT	BRD-K32784186	BRD-K32784186-001-01-0	Broad Institute of MIT and Harvard	BRD-K32784186			CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26+,28-/m0/s1	KPGMTKVYFCJESC-AQHOXQCLSA-N	578.219905538							99038
BRD-K81674214	LSM-13416		54654095	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22-,24+/m1/s1	CUJGJHGFROPBKV-BKULYWANSA-N	COCCNC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K81674214	BRD-K81674214-001-01-9	Broad Institute of MIT and Harvard	BRD-K81674214			COCCNC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22-,24+/m1/s1	CUJGJHGFROPBKV-BKULYWANSA-N	495.236935806							102056
BRD-K50845321	LSM-11531		54654014	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21-,23+/m0/s1	OWLQYYZEQLHDAT-AVCGJXAMSA-N	CN1[C@H]2CC[C@@H](CC(=O)NC3CCCC3)O[C@@H]2COc4ccc(NC(=O)c5cc(C)on5)cc4C1=O	BroadT	BRD-K50845321	BRD-K50845321-001-01-2	Broad Institute of MIT and Harvard	BRD-K50845321			CN1[C@H]2CC[C@@H](CC(=O)NC3CCCC3)O[C@@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21-,23+/m0/s1	OWLQYYZEQLHDAT-AVCGJXAMSA-N	496.232184784							100154
BRD-K31618614-001-01-3	LSM-10345	BRD-K31618614	54654212	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27+/m0/s1	BSKZHQCAOYVBFU-VXQMPNGUSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K31618614	BRD-K31618614-001-02-1	Broad Institute of MIT and Harvard	BRD-K31618614			CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27+/m0/s1	BSKZHQCAOYVBFU-VXQMPNGUSA-N	537.263899482							98966
BRD-K38955087	LSM-10787		54654101	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23+,25-/m0/s1	WOMWNJCZYVCUPK-PWWKTKHKSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	BroadT	BRD-K38955087	BRD-K38955087-001-01-0	Broad Institute of MIT and Harvard	BRD-K38955087			COc1ccc(CNC(=O)C[C@@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23+,25-/m0/s1	WOMWNJCZYVCUPK-PWWKTKHKSA-N	509.25258587							99408
CHEMBL3184601	LSM-11577	BRD-K51471107	54654268	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26-,28-/m0/s1	UIBIEJVTTJAUBZ-BPRLDMBXSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K51471107	BRD-K51471107-001-01-6	Broad Institute of MIT and Harvard	BRD-K51471107			C[C@H](NC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26-,28-/m0/s1	UIBIEJVTTJAUBZ-BPRLDMBXSA-N	597.170034174							100200
BRD-K98383296	LSM-14474		54654019	InChI=1S/C32H32ClN3O5/c1-36-27-13-12-23(17-30(37)34-21-10-9-19-5-4-6-20(19)15-21)41-29(27)18-40-28-14-11-22(16-25(28)32(36)39)35-31(38)24-7-2-3-8-26(24)33/h2-3,7-11,14-16,23,27,29H,4-6,12-13,17-18H2,1H3,(H,34,37)(H,35,38)/t23-,27+,29-/m1/s1	OTEDYSPKROHHLA-FNHKZSGOSA-N	CN1[C@H]2CC[C@H](CC(=O)Nc3ccc4CCCc4c3)O[C@@H]2COc5ccc(NC(=O)c6ccccc6Cl)cc5C1=O	BroadT	BRD-K98383296	BRD-K98383296-001-02-7	Broad Institute of MIT and Harvard	BRD-K98383296			CN1[C@H]2CC[C@H](CC(=O)Nc3ccc4CCCc4c3)O[C@@H]2COc2ccc(NC(=O)c3ccccc3Cl)cc2C1=O	InChI=1S/C32H32ClN3O5/c1-36-27-13-12-23(17-30(37)34-21-10-9-19-5-4-6-20(19)15-21)41-29(27)18-40-28-14-11-22(16-25(28)32(36)39)35-31(38)24-7-2-3-8-26(24)33/h2-3,7-11,14-16,23,27,29H,4-6,12-13,17-18H2,1H3,(H,34,37)(H,35,38)/t23-,27+,29-/m1/s1	OTEDYSPKROHHLA-FNHKZSGOSA-N	573.203048864							103129
BRD-K54586093	LSM-11741		54654023	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18-,20-/m1/s1	RXPZKEATMSRBBD-YVWKXTFCSA-N	CN1[C@@H]2CC[C@H](CC(=O)O)O[C@@H]2COc3ccc(NS(=O)(=O)c4ccccc4C)cc3C1=O	BroadT	BRD-K54586093	BRD-K54586093-001-01-4	Broad Institute of MIT and Harvard	BRD-K54586093			CN1[C@@H]2CC[C@H](CC(O)=O)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccccc3C)cc2C1=O	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18-,20-/m1/s1	RXPZKEATMSRBBD-YVWKXTFCSA-N	474.146071882							100366
BRD-K81873565	LSM-13425		54654132	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21-,23-/m1/s1	OPKRVFTXMKZUJR-KJXAQDMKSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC3CC3)O[C@@H]2COc4ccc(NC(=O)NC5CCCC5)cc4C1=O	BroadT	BRD-K81873565	BRD-K81873565-001-01-2	Broad Institute of MIT and Harvard	BRD-K81873565			CN1[C@@H]2CC[C@H](CC(=O)NCC3CC3)O[C@@H]2COc2ccc(NC(=O)NC3CCCC3)cc2C1=O	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21-,23-/m1/s1	OPKRVFTXMKZUJR-KJXAQDMKSA-N	484.268570292							102065
BRD-K57330428	LSM-11900		54654207	InChI=1S/C31H35N3O7S/c1-20-8-12-24(13-9-20)42(37,38)33-22-10-15-28-25(16-22)31(36)34(2)26-14-11-23(41-29(26)19-40-28)17-30(35)32-18-21-6-4-5-7-27(21)39-3/h4-10,12-13,15-16,23,26,29,33H,11,14,17-19H2,1-3H3,(H,32,35)/t23-,26+,29+/m0/s1	GYVRMNXHBKDJFJ-SCWLSEGGSA-N	COc1ccccc1CNC(=O)C[C@@H]2CC[C@@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C(=O)N3C)O2	BroadT	BRD-K57330428	BRD-K57330428-001-01-0	Broad Institute of MIT and Harvard	BRD-K57330428			COc1ccccc1CNC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C(=O)N2C)O1	InChI=1S/C31H35N3O7S/c1-20-8-12-24(13-9-20)42(37,38)33-22-10-15-28-25(16-22)31(36)34(2)26-14-11-23(41-29(26)19-40-28)17-30(35)32-18-21-6-4-5-7-27(21)39-3/h4-10,12-13,15-16,23,26,29,33H,11,14,17-19H2,1-3H3,(H,32,35)/t23-,26+,29+/m0/s1	GYVRMNXHBKDJFJ-SCWLSEGGSA-N	593.21957118							100526
BRD-K95033227	LSM-14253		54654148	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20-,24+/m1/s1	OHHWUSSTVAUIQP-FPGHNAPASA-N	CCCNC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	BroadT	BRD-K95033227	BRD-K95033227-001-01-7	Broad Institute of MIT and Harvard	BRD-K95033227			CCCNC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20-,24+/m1/s1	OHHWUSSTVAUIQP-FPGHNAPASA-N	509.216200362							102907
BRD-K20342961	LSM-9672		54654162	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20-,22-/m1/s1	MBWHXZFHLNKYMT-NQSCKRDGSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)c5cscn5)cc4C(=O)N3C)O2	BroadT	BRD-K20342961	BRD-K20342961-001-01-2	Broad Institute of MIT and Harvard	BRD-K20342961			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4cscn4)cc3C(=O)N2C)O1	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20-,22-/m1/s1	MBWHXZFHLNKYMT-NQSCKRDGSA-N	513.204589832							98293
BRD-K13107877	LSM-9213		54654008	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24+,26+/m0/s1	VRPVHEJOGHTQDQ-GGBSJPMNSA-N	COc1cccc(NC(=O)C[C@@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K13107877	BRD-K13107877-001-01-1	Broad Institute of MIT and Harvard	BRD-K13107877			COc1cccc(NC(=O)C[C@@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24+,26+/m0/s1	VRPVHEJOGHTQDQ-GGBSJPMNSA-N	537.24750049							97834
BRD-K91535031	LSM-14051		54654247	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25-,27+/m0/s1	MRUYUJCJGOFQDV-RIACCQAKSA-N	COc1cccc(CNC(=O)C[C@@H]2CC[C@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	BroadT	BRD-K91535031	BRD-K91535031-001-01-1	Broad Institute of MIT and Harvard	BRD-K91535031			COc1cccc(CNC(=O)C[C@@H]2CC[C@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25-,27+/m0/s1	MRUYUJCJGOFQDV-RIACCQAKSA-N	597.194499284							102704
BRD-K09584219	LSM-9014		54654171	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19+,21-/m1/s1	RQAOUBOGQGVTCU-SLYNCCJLSA-N	CNC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	BroadT	BRD-K09584219	BRD-K09584219-001-02-2	Broad Institute of MIT and Harvard	BRD-K09584219			CNC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19+,21-/m1/s1	RQAOUBOGQGVTCU-SLYNCCJLSA-N	473.17622733							97635
BRD-K34684441	LSM-10516		54654170	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19-,21-/m1/s1	RQAOUBOGQGVTCU-YFVAEKQCSA-N	CNC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	BroadT	BRD-K34684441	BRD-K34684441-001-01-1	Broad Institute of MIT and Harvard	BRD-K34684441			CNC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19-,21-/m1/s1	RQAOUBOGQGVTCU-YFVAEKQCSA-N	473.17622733							99137
BRD-K48809858	LSM-11400		54654224	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27-,29-/m1/s1	ZIFILFAABSOBLR-WOEHHYBBSA-N	CN1[C@@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COc5ccc(NS(=O)(=O)c6cccc(F)c6)cc5C1=O	BroadT	BRD-K48809858	BRD-K48809858-001-01-4	Broad Institute of MIT and Harvard	BRD-K48809858			CN1[C@@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27-,29-/m1/s1	ZIFILFAABSOBLR-WOEHHYBBSA-N	593.199584664							100021
BRD-K34929727	LSM-10530		54654120	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22+,24-/m0/s1	BYJFOJVMGKORHN-FJIJXJHWSA-N	CCCC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCc4cccc(F)c4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K34929727	BRD-K34929727-001-01-5	Broad Institute of MIT and Harvard	BRD-K34929727			CCCC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCc4cccc(F)c4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22+,24-/m0/s1	BYJFOJVMGKORHN-FJIJXJHWSA-N	497.232599354							99151
BRD-K13119088	LSM-9215		54654046	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18-,20+/m1/s1	SDVZNQMNQVCLRJ-POAQFYNOSA-N	CN1[C@@H]2CC[C@H](CC(=O)O)O[C@H]2COc3ccc(NC(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K13119088	BRD-K13119088-001-01-1	Broad Institute of MIT and Harvard	BRD-K13119088			CN1[C@@H]2CC[C@H](CC(O)=O)O[C@H]2COc2ccc(NC(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18-,20+/m1/s1	SDVZNQMNQVCLRJ-POAQFYNOSA-N	458.124464186							97836
BRD-K41888384	LSM-10973		54654012	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21-,23-/m0/s1	OWLQYYZEQLHDAT-HARLFGEKSA-N	CN1[C@H]2CC[C@@H](CC(=O)NC3CCCC3)O[C@H]2COc4ccc(NC(=O)c5cc(C)on5)cc4C1=O	BroadT	BRD-K41888384	BRD-K41888384-001-01-8	Broad Institute of MIT and Harvard	BRD-K41888384			CN1[C@H]2CC[C@@H](CC(=O)NC3CCCC3)O[C@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21-,23-/m0/s1	OWLQYYZEQLHDAT-HARLFGEKSA-N	496.232184784							99594
BRD-K35081088	LSM-10538		54654071	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19-,21-/m1/s1	QOIMCQVGUSYUFV-OZOXKJRCSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K35081088	BRD-K35081088-001-01-7	Broad Institute of MIT and Harvard	BRD-K35081088			COC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19-,21-/m1/s1	QOIMCQVGUSYUFV-OZOXKJRCSA-N	492.13665005							99159
BRD-K93376546	LSM-14155		54654277	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22+,24+/m1/s1	RISZPRWRWDPXQV-OUOWLKGYSA-N	CN1[C@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@H]2COc4ccc(NC(=O)c5ccc(F)c(F)c5)cc4C1=O	BroadT	BRD-K93376546	BRD-K93376546-001-01-6	Broad Institute of MIT and Harvard	BRD-K93376546			CN1[C@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22+,24+/m1/s1	RISZPRWRWDPXQV-OUOWLKGYSA-N	529.202442078							102809
BRD-K20820984	LSM-9695		54654068	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19+,21-/m0/s1	QOIMCQVGUSYUFV-SCWSEQNSSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K20820984	BRD-K20820984-001-01-0	Broad Institute of MIT and Harvard	BRD-K20820984			COC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19+,21-/m0/s1	QOIMCQVGUSYUFV-SCWSEQNSSA-N	492.13665005							98316
CHEMBL2139135	LSM-11124	SID131450462, BRD-K44150994	54654040	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26-,28+/m1/s1	SECMWWJMRQEFAV-RJRADHEHSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccccc3Cl)O[C@H]2COc4ccc(NC(=O)Nc5cccc(C)c5)cc4C1=O	BroadT	BRD-K44150994	BRD-K44150994-001-01-2	Broad Institute of MIT and Harvard	BRD-K44150994			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccccc3Cl)O[C@H]2COc2ccc(NC(=O)Nc3cccc(C)c3)cc2C1=O	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26-,28+/m1/s1	SECMWWJMRQEFAV-RJRADHEHSA-N	576.213947906							99745
BRD-K28987821	LSM-10186		54654226	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27-,29-/m0/s1	ZIFILFAABSOBLR-KMDNEMHUSA-N	CN1[C@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COc5ccc(NS(=O)(=O)c6cccc(F)c6)cc5C1=O	BroadT	BRD-K28987821	BRD-K28987821-001-01-6	Broad Institute of MIT and Harvard	BRD-K28987821			CN1[C@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27-,29-/m0/s1	ZIFILFAABSOBLR-KMDNEMHUSA-N	593.199584664							98807
BRD-K12907790	LSM-9197		54654175	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23-,25+/m0/s1	DZYZVJKKUJSUJU-UMXIMWEHSA-N	COc1cccc(CNC(=O)C[C@@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K12907790	BRD-K12907790-001-01-9	Broad Institute of MIT and Harvard	BRD-K12907790			COc1cccc(CNC(=O)C[C@@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23-,25+/m0/s1	DZYZVJKKUJSUJU-UMXIMWEHSA-N	549.193356432							97818
BRD-K20121961	LSM-9654		54654260	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26-,28+/m1/s1	UIBIEJVTTJAUBZ-KJCNKPTMSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K20121961	BRD-K20121961-001-01-0	Broad Institute of MIT and Harvard	BRD-K20121961			C[C@@H](NC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26-,28+/m1/s1	UIBIEJVTTJAUBZ-KJCNKPTMSA-N	597.170034174							98275
BRD-K15707609	LSM-9370		54654221	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27+,29+/m0/s1	ZIFILFAABSOBLR-WIDNXDAUSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COc5ccc(NS(=O)(=O)c6cccc(F)c6)cc5C1=O	BroadT	BRD-K15707609	BRD-K15707609-001-01-1	Broad Institute of MIT and Harvard	BRD-K15707609			CN1[C@@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27+,29+/m0/s1	ZIFILFAABSOBLR-WIDNXDAUSA-N	593.199584664							97991
BRD-K90883684-001-01-6	LSM-26280	BRD-K90883684	54654236	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27+,29+/m1/s1	JZQJXXSKGFWMTL-AUFDDLSKSA-N	CN1[C@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K90883684	BRD-K90883684-001-01-6	Broad Institute of MIT and Harvard	BRD-K90883684			CN1[C@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27+,29+/m1/s1	JZQJXXSKGFWMTL-AUFDDLSKSA-N	616.30093306							114818
BRD-K04577097	LSM-8708		54654198	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30+,32+/m0/s1	DRCDGYYITPZHEH-HYRLGQOJSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K04577097	BRD-K04577097-001-01-0	Broad Institute of MIT and Harvard	BRD-K04577097			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30+,32+/m0/s1	DRCDGYYITPZHEH-HYRLGQOJSA-N	609.22974194							97329
BRD-K19995377	LSM-9642		54654270	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26-,28+/m0/s1	UIBIEJVTTJAUBZ-ULUNRTEESA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K19995377	BRD-K19995377-001-01-8	Broad Institute of MIT and Harvard	BRD-K19995377			C[C@H](NC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26-,28+/m0/s1	UIBIEJVTTJAUBZ-ULUNRTEESA-N	597.170034174							98263
BRD-K91377183	LSM-14043		54654119	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22-,24-/m1/s1	BYJFOJVMGKORHN-KIFXHHALSA-N	CCCC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCc4cccc(F)c4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K91377183	BRD-K91377183-001-01-4	Broad Institute of MIT and Harvard	BRD-K91377183			CCCC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCc4cccc(F)c4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22-,24-/m1/s1	BYJFOJVMGKORHN-KIFXHHALSA-N	497.232599354							102696
BRD-K57640948	LSM-11917		54654102	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23+,25+/m1/s1	WOMWNJCZYVCUPK-VTZPFEBOSA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	BroadT	BRD-K57640948	BRD-K57640948-001-01-3	Broad Institute of MIT and Harvard	BRD-K57640948			COc1ccc(CNC(=O)C[C@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23+,25+/m1/s1	WOMWNJCZYVCUPK-VTZPFEBOSA-N	509.25258587							100543
BRD-K14030662	LSM-9276		54654107	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25+,27-/m1/s1	CEZHWMAQWNYMAY-BUALBWRZSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccccc3F)O[C@@H]2COc4ccc(NC(=O)C5CCCCC5)cc4C1=O	BroadT	BRD-K14030662	BRD-K14030662-001-01-3	Broad Institute of MIT and Harvard	BRD-K14030662			CN1[C@H]2CC[C@H](CC(=O)NCc3ccccc3F)O[C@@H]2COc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25+,27-/m1/s1	CEZHWMAQWNYMAY-BUALBWRZSA-N	537.263899482							97897
BRD-K40518011	LSM-10903		54654183	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23-,25-/m1/s1	HUCZTLCWVGQLCW-GZGNHOFSSA-N	COCC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N4CCc5ccccc5C4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K40518011	BRD-K40518011-001-01-3	Broad Institute of MIT and Harvard	BRD-K40518011			COCC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N4CCc5ccccc5C4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23-,25-/m1/s1	HUCZTLCWVGQLCW-GZGNHOFSSA-N	507.236935806							99524
BRD-K35716266	LSM-10571		54654215	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16-,18+/m0/s1	WVVDCAKHEAPTNY-QILLFSRXSA-N	CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K35716266	BRD-K35716266-001-01-2	Broad Institute of MIT and Harvard	BRD-K35716266			CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(C)=O)cc3C(=O)N2C)O1	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16-,18+/m0/s1	WVVDCAKHEAPTNY-QILLFSRXSA-N	389.195070994							99192
MLS004342454	LSM-14245	BRD-K94846015	54654066	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19+,21+/m0/s1	QOIMCQVGUSYUFV-LDQXTDLNSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K94846015	BRD-K94846015-001-01-9	Broad Institute of MIT and Harvard	BRD-K94846015			COC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19+,21+/m0/s1	QOIMCQVGUSYUFV-LDQXTDLNSA-N	492.13665005							102899
BRD-K84245233	LSM-6856		54654203	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30-,32+/m1/s1	DRCDGYYITPZHEH-VUSUJWAUSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K84245233	BRD-K84245233-001-01-2	Broad Institute of MIT and Harvard	BRD-K84245233			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30-,32+/m1/s1	DRCDGYYITPZHEH-VUSUJWAUSA-N	609.22974194							95477
BRD-K85549762	LSM-13658		54653998	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19-,21+/m0/s1	RRCKKFPVDDPSKT-HFSMHLIXSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N4CCN(C)CC4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K85549762	BRD-K85549762-001-01-5	Broad Institute of MIT and Harvard	BRD-K85549762			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N4CCN(C)CC4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19-,21+/m0/s1	RRCKKFPVDDPSKT-HFSMHLIXSA-N	494.219905538							102305
MLS004342539	LSM-11202	BRD-K45480436	54653981	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24+,26-/m1/s1	CJRLOTNMWBMMLN-LJGDZFJRSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K45480436	BRD-K45480436-001-02-6	Broad Institute of MIT and Harvard	BRD-K45480436			CN1[C@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24+,26-/m1/s1	CJRLOTNMWBMMLN-LJGDZFJRSA-N	570.251205666							99823
BRD-K32380923	LSM-10394		54654238	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27-,29-/m1/s1	JZQJXXSKGFWMTL-ABMPEJCWSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K32380923	BRD-K32380923-001-01-5	Broad Institute of MIT and Harvard	BRD-K32380923			CN1[C@@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27-,29-/m1/s1	JZQJXXSKGFWMTL-ABMPEJCWSA-N	616.30093306							99015
BRD-K80563095	LSM-13355		54654219	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16+,18-/m0/s1	WVVDCAKHEAPTNY-LESCRADOSA-N	CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K80563095	BRD-K80563095-001-01-9	Broad Institute of MIT and Harvard	BRD-K80563095			CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(C)=O)cc3C(=O)N2C)O1	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16+,18-/m0/s1	WVVDCAKHEAPTNY-LESCRADOSA-N	389.195070994							101994
BRD-K09861842	LSM-9032		54654090	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22+,24-/m0/s1	CUJGJHGFROPBKV-FJIJXJHWSA-N	COCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K09861842	BRD-K09861842-001-01-1	Broad Institute of MIT and Harvard	BRD-K09861842			COCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22+,24-/m0/s1	CUJGJHGFROPBKV-FJIJXJHWSA-N	495.236935806							97653
BRD-K51908245	LSM-11606		54654114	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22-,24+/m0/s1	BYJFOJVMGKORHN-ODGPQVTHSA-N	CCCC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCc4cccc(F)c4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K51908245	BRD-K51908245-001-01-0	Broad Institute of MIT and Harvard	BRD-K51908245			CCCC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCc4cccc(F)c4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22-,24+/m0/s1	BYJFOJVMGKORHN-ODGPQVTHSA-N	497.232599354							100229
BRD-K69980290	LSM-12701		54653999	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19-,21-/m1/s1	RRCKKFPVDDPSKT-YFVAEKQCSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N4CCN(C)CC4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K69980290	BRD-K69980290-001-01-3	Broad Institute of MIT and Harvard	BRD-K69980290			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N4CCN(C)CC4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19-,21-/m1/s1	RRCKKFPVDDPSKT-YFVAEKQCSA-N	494.219905538							101336
BRD-K33562246	LSM-10463		54654065	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18+,20-/m0/s1	CDAYNQARGBNMSE-HQRMLTQVSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K33562246	BRD-K33562246-001-01-7	Broad Institute of MIT and Harvard	BRD-K33562246			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NS(C)(=O)=O)cc3C(=O)N2C)O1	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18+,20-/m0/s1	CDAYNQARGBNMSE-HQRMLTQVSA-N	482.219905538							99084
BRD-K50791850	LSM-11524		54654105	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23-,25+/m0/s1	WOMWNJCZYVCUPK-UMXIMWEHSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	BroadT	BRD-K50791850	BRD-K50791850-001-01-7	Broad Institute of MIT and Harvard	BRD-K50791850			COc1ccc(CNC(=O)C[C@@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23-,25+/m0/s1	WOMWNJCZYVCUPK-UMXIMWEHSA-N	509.25258587							100145
SCHEMBL16984308	LSM-6838	BRD-K55082668	54654200	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30-,32-/m0/s1	DRCDGYYITPZHEH-BOAXMXEYSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K55082668	BRD-K55082668-001-01-8	Broad Institute of MIT and Harvard	BRD-K55082668			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30-,32-/m0/s1	DRCDGYYITPZHEH-BOAXMXEYSA-N	609.22974194							95459
BRD-K95481773	LSM-14279		54654075	InChI=1S/C26H28F3N3O6/c1-32-20-8-7-18(12-23(33)30-14-26(27,28)29)38-22(20)13-37-21-9-6-16(11-19(21)25(32)35)31-24(34)15-4-3-5-17(10-15)36-2/h3-6,9-11,18,20,22H,7-8,12-14H2,1-2H3,(H,30,33)(H,31,34)/t18-,20+,22+/m1/s1	RKECGHSSKXUWCJ-CBQOVEMMSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@@H]4O[C@@H](CC(=O)NCC(F)(F)F)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K95481773	BRD-K95481773-001-01-6	Broad Institute of MIT and Harvard	BRD-K95481773			COc1cccc(c1)C(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCC(F)(F)F)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C26H28F3N3O6/c1-32-20-8-7-18(12-23(33)30-14-26(27,28)29)38-22(20)13-37-21-9-6-16(11-19(21)25(32)35)31-24(34)15-4-3-5-17(10-15)36-2/h3-6,9-11,18,20,22H,7-8,12-14H2,1-2H3,(H,30,33)(H,31,34)/t18-,20+,22+/m1/s1	RKECGHSSKXUWCJ-CBQOVEMMSA-N	535.193020246							102933
BRD-K54743934	LSM-11751		54654002	InChI=1S/C21H23N3O6S/c1-24-15-5-4-13(8-19(25)28-2)30-17(15)10-29-16-6-3-12(7-14(16)21(24)27)23-20(26)18-9-22-11-31-18/h3,6-7,9,11,13,15,17H,4-5,8,10H2,1-2H3,(H,23,26)/t13-,15+,17-/m1/s1	UYHAGXSFPLQSEJ-UKPHBRMFSA-N	COC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4cncs4)cc3C(=O)N2C)O1	BroadT	BRD-K54743934	BRD-K54743934-001-02-2	Broad Institute of MIT and Harvard	BRD-K54743934			COC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4cncs4)cc3C(=O)N2C)O1	InChI=1S/C21H23N3O6S/c1-24-15-5-4-13(8-19(25)28-2)30-17(15)10-29-16-6-3-12(7-14(16)21(24)27)23-20(26)18-9-22-11-31-18/h3,6-7,9,11,13,15,17H,4-5,8,10H2,1-2H3,(H,23,26)/t13-,15+,17-/m1/s1	UYHAGXSFPLQSEJ-UKPHBRMFSA-N	445.130756176							100376
BRD-K15955205	LSM-9382		54654262	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26-,28-/m1/s1	UIBIEJVTTJAUBZ-SDYNEGHTSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K15955205	BRD-K15955205-001-01-4	Broad Institute of MIT and Harvard	BRD-K15955205			C[C@@H](NC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26-,28-/m1/s1	UIBIEJVTTJAUBZ-SDYNEGHTSA-N	597.170034174							98003
CHEMBL3189023	LSM-12370	BRD-K64544620	54654140	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25-,27+/m1/s1	TUUZOQPHVDGSNW-JBBQQGGESA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc4ccc(NS(=O)(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K64544620	BRD-K64544620-001-01-3	Broad Institute of MIT and Harvard	BRD-K64544620			CN1[C@@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25-,27+/m1/s1	TUUZOQPHVDGSNW-JBBQQGGESA-N	588.241783834							100997
BRD-K78710535	LSM-13236		54654178	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23-,25-/m1/s1	DZYZVJKKUJSUJU-GZGNHOFSSA-N	COc1cccc(CNC(=O)C[C@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K78710535	BRD-K78710535-001-01-8	Broad Institute of MIT and Harvard	BRD-K78710535			COc1cccc(CNC(=O)C[C@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23-,25-/m1/s1	DZYZVJKKUJSUJU-GZGNHOFSSA-N	549.193356432							101875
BRD-K69449918	LSM-12664		54654004	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24+,26-/m0/s1	VRPVHEJOGHTQDQ-FBILRYNDSA-N	COc1cccc(NC(=O)C[C@@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K69449918	BRD-K69449918-001-01-1	Broad Institute of MIT and Harvard	BRD-K69449918			COc1cccc(NC(=O)C[C@@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24+,26-/m0/s1	VRPVHEJOGHTQDQ-FBILRYNDSA-N	537.24750049							101298
BRD-K83654676	LSM-13544		54654284	InChI=1S/C30H33N5O5/c1-18(2)19-5-4-6-20(13-19)33-28(36)15-22-8-9-25-27(40-22)17-39-26-10-7-21(14-23(26)30(38)35(25)3)34-29(37)24-16-31-11-12-32-24/h4-7,10-14,16,18,22,25,27H,8-9,15,17H2,1-3H3,(H,33,36)(H,34,37)/t22-,25+,27-/m1/s1	RRAKYIDNKDNDJG-BUALBWRZSA-N	CC(C)c1cccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5cnccn5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K83654676	BRD-K83654676-001-02-8	Broad Institute of MIT and Harvard	BRD-K83654676			CC(C)c1cccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5cnccn5)cc4C(=O)N3C)O2)c1	InChI=1S/C30H33N5O5/c1-18(2)19-5-4-6-20(13-19)33-28(36)15-22-8-9-25-27(40-22)17-39-26-10-7-21(14-23(26)30(38)35(25)3)34-29(37)24-16-31-11-12-32-24/h4-7,10-14,16,18,22,25,27H,8-9,15,17H2,1-3H3,(H,33,36)(H,34,37)/t22-,25+,27-/m1/s1	RRAKYIDNKDNDJG-BUALBWRZSA-N	543.248169206							102186
BRD-K43481697	LSM-11074		54654150	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20+,24+/m0/s1	OHHWUSSTVAUIQP-MFSJNOQSSA-N	CCCNC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	BroadT	BRD-K43481697	BRD-K43481697-001-01-2	Broad Institute of MIT and Harvard	BRD-K43481697			CCCNC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20+,24+/m0/s1	OHHWUSSTVAUIQP-MFSJNOQSSA-N	509.216200362							99695
BRD-K26968526	LSM-10064		54654237	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27-,29+/m1/s1	JZQJXXSKGFWMTL-VSUKXTEZSA-N	CN1[C@@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K26968526	BRD-K26968526-001-01-6	Broad Institute of MIT and Harvard	BRD-K26968526			CN1[C@@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27-,29+/m1/s1	JZQJXXSKGFWMTL-VSUKXTEZSA-N	616.30093306							98685
BRD-K89087272	LSM-13911		54654083	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20+,22+/m1/s1	IFOOEWPAOUEVPY-CBQOVEMMSA-N	CN1[C@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cccs5)cc4C1=O	BroadT	BRD-K89087272	BRD-K89087272-001-01-5	Broad Institute of MIT and Harvard	BRD-K89087272			CN1[C@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cccs3)cc2C1=O	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20+,22+/m1/s1	IFOOEWPAOUEVPY-CBQOVEMMSA-N	497.198441812							102564
BRD-K60759206	LSM-12102		54654155	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20-,22-/m0/s1	MBWHXZFHLNKYMT-XJABCFGWSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)c5cscn5)cc4C(=O)N3C)O2	BroadT	BRD-K60759206	BRD-K60759206-001-01-3	Broad Institute of MIT and Harvard	BRD-K60759206			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4cscn4)cc3C(=O)N2C)O1	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20-,22-/m0/s1	MBWHXZFHLNKYMT-XJABCFGWSA-N	513.204589832							100728
BRD-K43568193	LSM-11082		54654294	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24+,26-/m0/s1	CJRLOTNMWBMMLN-NZJKTDFXSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K43568193	BRD-K43568193-001-01-5	Broad Institute of MIT and Harvard	BRD-K43568193			CN1[C@@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24+,26-/m0/s1	CJRLOTNMWBMMLN-NZJKTDFXSA-N	570.251205666							99703
BRD-K95352880	LSM-14273		54654117	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22-,24+/m1/s1	BYJFOJVMGKORHN-BKULYWANSA-N	CCCC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCc4cccc(F)c4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K95352880	BRD-K95352880-001-01-9	Broad Institute of MIT and Harvard	BRD-K95352880			CCCC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCc4cccc(F)c4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22-,24+/m1/s1	BYJFOJVMGKORHN-BKULYWANSA-N	497.232599354							102927
BRD-K32735617	LSM-10413		54654096	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22+,24+/m1/s1	CUJGJHGFROPBKV-SFLYRZDNSA-N	COCCNC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K32735617	BRD-K32735617-001-01-1	Broad Institute of MIT and Harvard	BRD-K32735617			COCCNC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22+,24+/m1/s1	CUJGJHGFROPBKV-SFLYRZDNSA-N	495.236935806							99034
BRD-K15513102	LSM-9358		54654007	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24+,26+/m1/s1	VRPVHEJOGHTQDQ-CWDLOFLHSA-N	COc1cccc(NC(=O)C[C@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K15513102	BRD-K15513102-001-01-5	Broad Institute of MIT and Harvard	BRD-K15513102			COc1cccc(NC(=O)C[C@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24+,26+/m1/s1	VRPVHEJOGHTQDQ-CWDLOFLHSA-N	537.24750049							97979
BRD-K58415365	LSM-11951		54654187	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23+,25+/m0/s1	HUCZTLCWVGQLCW-QQKQFIJSSA-N	COCC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N4CCc5ccccc5C4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K58415365	BRD-K58415365-001-01-3	Broad Institute of MIT and Harvard	BRD-K58415365			COCC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N4CCc5ccccc5C4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23+,25+/m0/s1	HUCZTLCWVGQLCW-QQKQFIJSSA-N	507.236935806							100577
BRD-K38860595	LSM-10781		54654153	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20+,24-/m1/s1	OHHWUSSTVAUIQP-LJFZDNNRSA-N	CCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	BroadT	BRD-K38860595	BRD-K38860595-001-01-7	Broad Institute of MIT and Harvard	BRD-K38860595			CCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20+,24-/m1/s1	OHHWUSSTVAUIQP-LJFZDNNRSA-N	509.216200362							99402
BRD-K01547285	LSM-8530		54654059	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18-,20-/m1/s1	CDAYNQARGBNMSE-YVWKXTFCSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K01547285	BRD-K01547285-001-01-8	Broad Institute of MIT and Harvard	BRD-K01547285			CN(C)CCCNC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NS(C)(=O)=O)cc3C(=O)N2C)O1	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18-,20-/m1/s1	CDAYNQARGBNMSE-YVWKXTFCSA-N	482.219905538							97151
BRD-K92924609	LSM-14124		54654142	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25+,27+/m1/s1	TUUZOQPHVDGSNW-PWMMPXSUSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc4ccc(NS(=O)(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K92924609	BRD-K92924609-001-01-8	Broad Institute of MIT and Harvard	BRD-K92924609			CN1[C@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25+,27+/m1/s1	TUUZOQPHVDGSNW-PWMMPXSUSA-N	588.241783834							102778
BRD-K70117295	LSM-12709		54654108	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25-,27-/m1/s1	CEZHWMAQWNYMAY-AVPJRLCVSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccccc3F)O[C@@H]2COc4ccc(NC(=O)C5CCCCC5)cc4C1=O	BroadT	BRD-K70117295	BRD-K70117295-001-01-4	Broad Institute of MIT and Harvard	BRD-K70117295			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccccc3F)O[C@@H]2COc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25-,27-/m1/s1	CEZHWMAQWNYMAY-AVPJRLCVSA-N	537.263899482							101344
BRD-K26962314	LSM-10063		54654063	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18-,20+/m0/s1	CDAYNQARGBNMSE-XKGZKEIXSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K26962314	BRD-K26962314-001-01-5	Broad Institute of MIT and Harvard	BRD-K26962314			CN(C)CCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NS(C)(=O)=O)cc3C(=O)N2C)O1	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18-,20+/m0/s1	CDAYNQARGBNMSE-XKGZKEIXSA-N	482.219905538							98684
BRD-K55149044	LSM-6839		54654201	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30-,32-/m1/s1	DRCDGYYITPZHEH-FTOUHTJISA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K55149044	BRD-K55149044-001-01-0	Broad Institute of MIT and Harvard	BRD-K55149044			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30-,32-/m1/s1	DRCDGYYITPZHEH-FTOUHTJISA-N	609.22974194							95460
BRD-K96274292	LSM-14337		54654190	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25-,27+/m1/s1	XIGYLWQKLZSYNZ-HYZYYIOASA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc4ccc(NC(=O)Nc5ccc(Cl)cc5)cc4C1=O	BroadT	BRD-K96274292	BRD-K96274292-001-01-6	Broad Institute of MIT and Harvard	BRD-K96274292			CN1[C@@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2C1=O	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25-,27+/m1/s1	XIGYLWQKLZSYNZ-HYZYYIOASA-N	583.256147076							102991
BRD-K25765811	LSM-9993		54653986	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25-,27+/m1/s1	KLEFMXRWIUTPPC-RMXYQJDTSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NC(=O)Nc5ccccc5F)cc4C1=O	BroadT	BRD-K25765811	BRD-K25765811-001-01-1	Broad Institute of MIT and Harvard	BRD-K25765811			CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NC(=O)Nc3ccccc3F)cc2C1=O	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25-,27+/m1/s1	KLEFMXRWIUTPPC-RMXYQJDTSA-N	561.238747374							98614
BRD-K50307707-001-01-7	LSM-26281	BRD-K50307707	54654235	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27+,29+/m0/s1	JZQJXXSKGFWMTL-OFPSWZBWSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K50307707	BRD-K50307707-001-01-7	Broad Institute of MIT and Harvard	BRD-K50307707			CN1[C@@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27+,29+/m0/s1	JZQJXXSKGFWMTL-OFPSWZBWSA-N	616.30093306							114819
BRD-K11627226	LSM-9136		54654109	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25+,27+/m1/s1	CEZHWMAQWNYMAY-PWMMPXSUSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccccc3F)O[C@H]2COc4ccc(NC(=O)C5CCCCC5)cc4C1=O	BroadT	BRD-K11627226	BRD-K11627226-001-01-8	Broad Institute of MIT and Harvard	BRD-K11627226			CN1[C@H]2CC[C@H](CC(=O)NCc3ccccc3F)O[C@H]2COc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25+,27+/m1/s1	CEZHWMAQWNYMAY-PWMMPXSUSA-N	537.263899482							97757
BRD-K67260071	LSM-12523		54654282	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22-,24+/m0/s1	RISZPRWRWDPXQV-JKFKMHIGSA-N	CN1[C@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@@H]2COc4ccc(NC(=O)c5ccc(F)c(F)c5)cc4C1=O	BroadT	BRD-K67260071	BRD-K67260071-001-01-7	Broad Institute of MIT and Harvard	BRD-K67260071			CN1[C@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22-,24+/m0/s1	RISZPRWRWDPXQV-JKFKMHIGSA-N	529.202442078							101154
BRD-K95880052	LSM-14307		54654027	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21+,23+/m1/s1	IOGMTQBPALZMTJ-NWSQWKLXSA-N	CN(C)C(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K95880052	BRD-K95880052-001-01-1	Broad Institute of MIT and Harvard	BRD-K95880052			CN(C)C(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21+,23+/m1/s1	IOGMTQBPALZMTJ-NWSQWKLXSA-N	480.237270164							102961
CHEMBL2360847	LSM-11287	BRD-K46810582, SID131450415	54653993	InChI=1S/C27H26Cl2N4O5S/c1-33-22-6-4-17(10-25(34)30-11-15-2-5-19(28)20(29)8-15)38-24(22)12-37-23-7-3-16(9-18(23)27(33)36)32-26(35)21-13-39-14-31-21/h2-3,5,7-9,13-14,17,22,24H,4,6,10-12H2,1H3,(H,30,34)(H,32,35)/t17-,22+,24+/m0/s1	LHGVLKOLCXFJRT-VXWZWFMZSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@@H]2COc4ccc(NC(=O)c5cscn5)cc4C1=O	BroadT	BRD-K46810582	BRD-K46810582-001-01-7	Broad Institute of MIT and Harvard	BRD-K46810582			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@@H]2COc2ccc(NC(=O)c3cscn3)cc2C1=O	InChI=1S/C27H26Cl2N4O5S/c1-33-22-6-4-17(10-25(34)30-11-15-2-5-19(28)20(29)8-15)38-24(22)12-37-23-7-3-16(9-18(23)27(33)36)32-26(35)21-13-39-14-31-21/h2-3,5,7-9,13-14,17,22,24H,4,6,10-12H2,1H3,(H,30,34)(H,32,35)/t17-,22+,24+/m0/s1	LHGVLKOLCXFJRT-VXWZWFMZSA-N	588.100096082							99908
BRD-K86842803	LSM-13752		54654069	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19-,21-/m0/s1	QOIMCQVGUSYUFV-LRQRDZAKSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K86842803	BRD-K86842803-001-01-4	Broad Institute of MIT and Harvard	BRD-K86842803			COC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19-,21-/m0/s1	QOIMCQVGUSYUFV-LRQRDZAKSA-N	492.13665005							102401
BRD-K78128989	LSM-13209		54654033	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21-,23+/m1/s1	IOGMTQBPALZMTJ-LSWJPFSZSA-N	CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K78128989	BRD-K78128989-001-01-4	Broad Institute of MIT and Harvard	BRD-K78128989			CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21-,23+/m1/s1	IOGMTQBPALZMTJ-LSWJPFSZSA-N	480.237270164							101847
BRD-K31618614-001-01-3	LSM-10345	BRD-K31618614	54654212	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27+/m0/s1	BSKZHQCAOYVBFU-VXQMPNGUSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K31618614	BRD-K31618614-001-01-3	Broad Institute of MIT and Harvard	BRD-K31618614			CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27+/m0/s1	BSKZHQCAOYVBFU-VXQMPNGUSA-N	537.263899482							98966
BRD-K71361154	LSM-12791		54654206	InChI=1S/C31H35N3O7S/c1-20-8-12-24(13-9-20)42(37,38)33-22-10-15-28-25(16-22)31(36)34(2)26-14-11-23(41-29(26)19-40-28)17-30(35)32-18-21-6-4-5-7-27(21)39-3/h4-10,12-13,15-16,23,26,29,33H,11,14,17-19H2,1-3H3,(H,32,35)/t23-,26-,29+/m0/s1	GYVRMNXHBKDJFJ-RSRUXJMGSA-N	COc1ccccc1CNC(=O)C[C@@H]2CC[C@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C(=O)N3C)O2	BroadT	BRD-K71361154	BRD-K71361154-001-01-7	Broad Institute of MIT and Harvard	BRD-K71361154			COc1ccccc1CNC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C(=O)N2C)O1	InChI=1S/C31H35N3O7S/c1-20-8-12-24(13-9-20)42(37,38)33-22-10-15-28-25(16-22)31(36)34(2)26-14-11-23(41-29(26)19-40-28)17-30(35)32-18-21-6-4-5-7-27(21)39-3/h4-10,12-13,15-16,23,26,29,33H,11,14,17-19H2,1-3H3,(H,32,35)/t23-,26-,29+/m0/s1	GYVRMNXHBKDJFJ-RSRUXJMGSA-N	593.21957118							101428
BRD-K39398102	LSM-10819		54654082	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20-,22-/m0/s1	IFOOEWPAOUEVPY-VCOUNFBDSA-N	CN1[C@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cccs5)cc4C1=O	BroadT	BRD-K39398102	BRD-K39398102-001-01-3	Broad Institute of MIT and Harvard	BRD-K39398102			CN1[C@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cccs3)cc2C1=O	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20-,22-/m0/s1	IFOOEWPAOUEVPY-VCOUNFBDSA-N	497.198441812							99440
CHEMBL2356570	LSM-10565	BRD-K35584941, SID131450712	54654289	InChI=1S/C33H32F3N3O5/c1-39-27-12-11-25(17-30(40)37-24-14-20-4-2-3-5-21(20)15-24)44-29(27)18-43-28-13-10-23(16-26(28)32(39)42)38-31(41)19-6-8-22(9-7-19)33(34,35)36/h2-10,13,16,24-25,27,29H,11-12,14-15,17-18H2,1H3,(H,37,40)(H,38,41)/t25-,27-,29-/m1/s1	CCWJWXJNOLFYBD-ONDZYYNLSA-N	CN1[C@@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc5ccc(NC(=O)c6ccc(cc6)C(F)(F)F)cc5C1=O	BroadT	BRD-K35584941	BRD-K35584941-001-01-7	Broad Institute of MIT and Harvard	BRD-K35584941			CN1[C@@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc2ccc(NC(=O)c3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C33H32F3N3O5/c1-39-27-12-11-25(17-30(40)37-24-14-20-4-2-3-5-21(20)15-24)44-29(27)18-43-28-13-10-23(16-26(28)32(39)42)38-31(41)19-6-8-22(9-7-19)33(34,35)36/h2-10,13,16,24-25,27,29H,11-12,14-15,17-18H2,1H3,(H,37,40)(H,38,41)/t25-,27-,29-/m1/s1	CCWJWXJNOLFYBD-ONDZYYNLSA-N	607.229405754							99186
BRD-K81662460	LSM-13414		54654263	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26+,28-/m1/s1	UIBIEJVTTJAUBZ-CJCBTBSHSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K81662460	BRD-K81662460-001-01-5	Broad Institute of MIT and Harvard	BRD-K81662460			C[C@@H](NC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26+,28-/m1/s1	UIBIEJVTTJAUBZ-CJCBTBSHSA-N	597.170034174							102054
BRD-K49255961	LSM-11422		54654048	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18-,20-/m0/s1	SDVZNQMNQVCLRJ-QRFRQXIXSA-N	CN1[C@H]2CC[C@@H](CC(=O)O)O[C@H]2COc3ccc(NC(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K49255961	BRD-K49255961-001-01-3	Broad Institute of MIT and Harvard	BRD-K49255961			CN1[C@H]2CC[C@@H](CC(O)=O)O[C@H]2COc2ccc(NC(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18-,20-/m0/s1	SDVZNQMNQVCLRJ-QRFRQXIXSA-N	458.124464186							100043
BRD-K34502913	LSM-10512		54654279	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22-,24-/m0/s1	RISZPRWRWDPXQV-OEOAZWSVSA-N	CN1[C@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@H]2COc4ccc(NC(=O)c5ccc(F)c(F)c5)cc4C1=O	BroadT	BRD-K34502913	BRD-K34502913-001-01-4	Broad Institute of MIT and Harvard	BRD-K34502913			CN1[C@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22-,24-/m0/s1	RISZPRWRWDPXQV-OEOAZWSVSA-N	529.202442078							99133
BRD-K80632398-001-01-6	LSM-26282	BRD-K80632398	54654213	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16+,18+/m0/s1	WVVDCAKHEAPTNY-YXJHDRRASA-N	CCNC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K80632398	BRD-K80632398-001-01-6	Broad Institute of MIT and Harvard	BRD-K80632398			CCNC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(C)=O)cc3C(=O)N2C)O1	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16+,18+/m0/s1	WVVDCAKHEAPTNY-YXJHDRRASA-N	389.195070994							114820
BRD-K48225424	LSM-11362		54654192	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25+,27-/m0/s1	XIGYLWQKLZSYNZ-RELGLDOUSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc4ccc(NC(=O)Nc5ccc(Cl)cc5)cc4C1=O	BroadT	BRD-K48225424	BRD-K48225424-001-01-8	Broad Institute of MIT and Harvard	BRD-K48225424			CN1[C@@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2C1=O	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25+,27-/m0/s1	XIGYLWQKLZSYNZ-RELGLDOUSA-N	583.256147076							99983
BRD-K85779012	LSM-13683		54654145	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25+,27-/m1/s1	TUUZOQPHVDGSNW-BUALBWRZSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc4ccc(NS(=O)(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K85779012	BRD-K85779012-001-02-4	Broad Institute of MIT and Harvard	BRD-K85779012			CN1[C@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25+,27-/m1/s1	TUUZOQPHVDGSNW-BUALBWRZSA-N	588.241783834							102331
BRD-K69317358	LSM-12654		54654051	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24+,28+/m1/s1	GPWYEVCXUJXIOI-COVQPCOOSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc5ccc(NC(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K69317358	BRD-K69317358-001-01-7	Broad Institute of MIT and Harvard	BRD-K69317358			CN1[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc2ccc(NC(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24+,28+/m1/s1	GPWYEVCXUJXIOI-COVQPCOOSA-N	575.20677853							101288
BRD-K57851810	LSM-11928		54654106	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25-,27+/m1/s1	CEZHWMAQWNYMAY-JBBQQGGESA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccccc3F)O[C@H]2COc4ccc(NC(=O)C5CCCCC5)cc4C1=O	BroadT	BRD-K57851810	BRD-K57851810-001-01-1	Broad Institute of MIT and Harvard	BRD-K57851810			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccccc3F)O[C@H]2COc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25-,27+/m1/s1	CEZHWMAQWNYMAY-JBBQQGGESA-N	537.263899482							100554
CHEMBL2362627	LSM-12339	BRD-K64040351, SID131450714	54654291	InChI=1S/C33H32F3N3O5/c1-39-27-12-11-25(17-30(40)37-24-14-20-4-2-3-5-21(20)15-24)44-29(27)18-43-28-13-10-23(16-26(28)32(39)42)38-31(41)19-6-8-22(9-7-19)33(34,35)36/h2-10,13,16,24-25,27,29H,11-12,14-15,17-18H2,1H3,(H,37,40)(H,38,41)/t25-,27-,29+/m1/s1	CCWJWXJNOLFYBD-NLFWHDTNSA-N	CN1[C@@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc5ccc(NC(=O)c6ccc(cc6)C(F)(F)F)cc5C1=O	BroadT	BRD-K64040351	BRD-K64040351-001-01-7	Broad Institute of MIT and Harvard	BRD-K64040351			CN1[C@@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc2ccc(NC(=O)c3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C33H32F3N3O5/c1-39-27-12-11-25(17-30(40)37-24-14-20-4-2-3-5-21(20)15-24)44-29(27)18-43-28-13-10-23(16-26(28)32(39)42)38-31(41)19-6-8-22(9-7-19)33(34,35)36/h2-10,13,16,24-25,27,29H,11-12,14-15,17-18H2,1H3,(H,37,40)(H,38,41)/t25-,27-,29+/m1/s1	CCWJWXJNOLFYBD-NLFWHDTNSA-N	607.229405754							100966
BRD-K06039860-001-01-4	LSM-8779	BRD-K06039860	54654211	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27-/m0/s1	BSKZHQCAOYVBFU-RELGLDOUSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K06039860	BRD-K06039860-001-02-2	Broad Institute of MIT and Harvard	BRD-K06039860			CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-12-11-23(16-28(35)32-17-19-6-3-2-4-7-19)39-27(25)18-38-26-13-10-22(15-24(26)30(34)37)33-29(36)20-8-5-9-21(31)14-20/h5,8-10,13-15,19,23,25,27H,2-4,6-7,11-12,16-18H2,1H3,(H,32,35)(H,33,36)/t23-,25+,27-/m0/s1	BSKZHQCAOYVBFU-RELGLDOUSA-N	537.263899482							97400
BRD-K46746423	LSM-11283		54654173	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23+,25+/m0/s1	DZYZVJKKUJSUJU-QQKQFIJSSA-N	COc1cccc(CNC(=O)C[C@@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K46746423	BRD-K46746423-001-01-6	Broad Institute of MIT and Harvard	BRD-K46746423			COc1cccc(CNC(=O)C[C@@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23+,25+/m0/s1	DZYZVJKKUJSUJU-QQKQFIJSSA-N	549.193356432							99904
BRD-K31027517	LSM-10299		54653997	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19-,21+/m1/s1	RRCKKFPVDDPSKT-QFUCXCTJSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N4CCN(C)CC4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K31027517	BRD-K31027517-001-01-5	Broad Institute of MIT and Harvard	BRD-K31027517			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N4CCN(C)CC4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19-,21+/m1/s1	RRCKKFPVDDPSKT-QFUCXCTJSA-N	494.219905538							98920
BRD-K07686903	LSM-8892		54654256	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23-,25-/m0/s1	LLFGMIFPADLUOD-OPHFCASCSA-N	CN1[C@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K07686903	BRD-K07686903-001-01-0	Broad Institute of MIT and Harvard	BRD-K07686903			CN1[C@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23-,25-/m0/s1	LLFGMIFPADLUOD-OPHFCASCSA-N	535.22309731							97513
BRD-K78853683	LSM-13244		54654088	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20+,22-/m0/s1	IFOOEWPAOUEVPY-DWLFOUALSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cccs5)cc4C1=O	BroadT	BRD-K78853683	BRD-K78853683-001-01-6	Broad Institute of MIT and Harvard	BRD-K78853683			CN1[C@@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cccs3)cc2C1=O	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20+,22-/m0/s1	IFOOEWPAOUEVPY-DWLFOUALSA-N	497.198441812							101883
BRD-K40212960	LSM-10881		54654188	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25-,27-/m0/s1	XIGYLWQKLZSYNZ-RMDSEJHCSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc4ccc(NC(=O)Nc5ccc(Cl)cc5)cc4C1=O	BroadT	BRD-K40212960	BRD-K40212960-001-01-4	Broad Institute of MIT and Harvard	BRD-K40212960			CN1[C@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2C1=O	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25-,27-/m0/s1	XIGYLWQKLZSYNZ-RMDSEJHCSA-N	583.256147076							99502
BRD-K55345900	LSM-11784		54654275	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26+,28-/m1/s1	UIBIEJVTTJAUBZ-NTTHZYIWSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K55345900	BRD-K55345900-001-02-5	Broad Institute of MIT and Harvard	BRD-K55345900			C[C@@H](NC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26+,28-/m1/s1	UIBIEJVTTJAUBZ-NTTHZYIWSA-N	597.170034174							100409
BRD-K83873778	LSM-13556		54654169	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19-,21-/m0/s1	RQAOUBOGQGVTCU-CUWPLCDZSA-N	CNC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	BroadT	BRD-K83873778	BRD-K83873778-001-01-3	Broad Institute of MIT and Harvard	BRD-K83873778			CNC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19-,21-/m0/s1	RQAOUBOGQGVTCU-CUWPLCDZSA-N	473.17622733							102198
BRD-K95611306	LSM-14291		54654230	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27+,29-/m0/s1	JZQJXXSKGFWMTL-WLIZDUGGSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K95611306	BRD-K95611306-001-01-4	Broad Institute of MIT and Harvard	BRD-K95611306			CN1[C@@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27+,29-/m0/s1	JZQJXXSKGFWMTL-WLIZDUGGSA-N	616.30093306							102945
BRD-K35995122	LSM-10593		54654091	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22+,24+/m0/s1	CUJGJHGFROPBKV-BGWNEDDSSA-N	COCCNC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K35995122	BRD-K35995122-001-01-6	Broad Institute of MIT and Harvard	BRD-K35995122			COCCNC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22+,24+/m0/s1	CUJGJHGFROPBKV-BGWNEDDSSA-N	495.236935806							99214
BRD-K17666351	LSM-9492		54654252	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25+,27-/m1/s1	MRUYUJCJGOFQDV-BUALBWRZSA-N	COc1cccc(CNC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	BroadT	BRD-K17666351	BRD-K17666351-001-02-5	Broad Institute of MIT and Harvard	BRD-K17666351			COc1cccc(CNC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25+,27-/m1/s1	MRUYUJCJGOFQDV-BUALBWRZSA-N	597.194499284							98113
BRD-K16954564	LSM-9454		54654081	InChI=1S/C27H34N4O5/c1-4-13-28-27(34)29-18-9-12-23-20(14-18)26(33)31(3)22-11-10-19(36-24(22)16-35-23)15-25(32)30-21-8-6-5-7-17(21)2/h5-9,12,14,19,22,24H,4,10-11,13,15-16H2,1-3H3,(H,30,32)(H2,28,29,34)/t19-,22+,24-/m1/s1	LTDWREVRDPXYNK-WNOPAQSVSA-N	CCCNC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4ccccc4C)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K16954564	BRD-K16954564-001-02-9	Broad Institute of MIT and Harvard	BRD-K16954564			CCCNC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4ccccc4C)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H34N4O5/c1-4-13-28-27(34)29-18-9-12-23-20(14-18)26(33)31(3)22-11-10-19(36-24(22)16-35-23)15-25(32)30-21-8-6-5-7-17(21)2/h5-9,12,14,19,22,24H,4,10-11,13,15-16H2,1-3H3,(H,30,32)(H2,28,29,34)/t19-,22+,24-/m1/s1	LTDWREVRDPXYNK-WNOPAQSVSA-N	494.252920228							98075
BRD-K22827077	LSM-9816		54654196	InChI=1S/C23H28F3N3O5/c1-29-17-7-6-15(10-20(30)27-13-3-2-4-13)34-19(17)12-33-18-8-5-14(9-16(18)22(29)32)28-21(31)11-23(24,25)26/h5,8-9,13,15,17,19H,2-4,6-7,10-12H2,1H3,(H,27,30)(H,28,31)/t15-,17+,19-/m1/s1	IKDLIQCVPGJRSQ-HHXXYDBFSA-N	CN1[C@H]2CC[C@H](CC(=O)NC3CCC3)O[C@@H]2COc4ccc(NC(=O)CC(F)(F)F)cc4C1=O	BroadT	BRD-K22827077	BRD-K22827077-001-02-9	Broad Institute of MIT and Harvard	BRD-K22827077			CN1[C@H]2CC[C@H](CC(=O)NC3CCC3)O[C@@H]2COc2ccc(NC(=O)CC(F)(F)F)cc2C1=O	InChI=1S/C23H28F3N3O5/c1-29-17-7-6-15(10-20(30)27-13-3-2-4-13)34-19(17)12-33-18-8-5-14(9-16(18)22(29)32)28-21(31)11-23(24,25)26/h5,8-9,13,15,17,19H,2-4,6-7,10-12H2,1H3,(H,27,30)(H,28,31)/t15-,17+,19-/m1/s1	IKDLIQCVPGJRSQ-HHXXYDBFSA-N	483.198105626							98437
BRD-K97614198	LSM-14425		54654116	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22+,24+/m1/s1	BYJFOJVMGKORHN-SFLYRZDNSA-N	CCCC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCc4cccc(F)c4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K97614198	BRD-K97614198-001-01-7	Broad Institute of MIT and Harvard	BRD-K97614198			CCCC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)NCc4cccc(F)c4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22+,24+/m1/s1	BYJFOJVMGKORHN-SFLYRZDNSA-N	497.232599354							103080
BRD-K53283097	LSM-11676		54654225	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27+,29-/m1/s1	ZIFILFAABSOBLR-PZFKOMAXSA-N	CN1[C@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COc5ccc(NS(=O)(=O)c6cccc(F)c6)cc5C1=O	BroadT	BRD-K53283097	BRD-K53283097-001-01-5	Broad Institute of MIT and Harvard	BRD-K53283097			CN1[C@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27+,29-/m1/s1	ZIFILFAABSOBLR-PZFKOMAXSA-N	593.199584664							100301
BRD-K00596708	LSM-8472		54654243	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27-,29+/m0/s1	JZQJXXSKGFWMTL-IKQRCTNISA-N	CN1[C@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K00596708	BRD-K00596708-001-02-3	Broad Institute of MIT and Harvard	BRD-K00596708			CN1[C@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27-,29+/m0/s1	JZQJXXSKGFWMTL-IKQRCTNISA-N	616.30093306							97093
CHEMBL2359801	LSM-13646	BRD-K85314854, SID131450617	54654195	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25+,27-/m1/s1	XIGYLWQKLZSYNZ-NRRYGQPISA-N	CN1[C@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc4ccc(NC(=O)Nc5ccc(Cl)cc5)cc4C1=O	BroadT	BRD-K85314854	BRD-K85314854-001-02-1	Broad Institute of MIT and Harvard	BRD-K85314854			CN1[C@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2C1=O	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25+,27-/m1/s1	XIGYLWQKLZSYNZ-NRRYGQPISA-N	583.256147076							102293
BRD-K30758351	LSM-10281		54654044	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18+,20+/m0/s1	SDVZNQMNQVCLRJ-ILZDJORESA-N	CN1[C@@H]2CC[C@@H](CC(=O)O)O[C@@H]2COc3ccc(NC(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K30758351	BRD-K30758351-001-01-5	Broad Institute of MIT and Harvard	BRD-K30758351			CN1[C@@H]2CC[C@@H](CC(O)=O)O[C@@H]2COc2ccc(NC(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18+,20+/m0/s1	SDVZNQMNQVCLRJ-ILZDJORESA-N	458.124464186							98902
BRD-K59611536	LSM-12031		54654061	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18-,20+/m1/s1	CDAYNQARGBNMSE-POAQFYNOSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K59611536	BRD-K59611536-001-01-0	Broad Institute of MIT and Harvard	BRD-K59611536			CN(C)CCCNC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NS(C)(=O)=O)cc3C(=O)N2C)O1	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18-,20+/m1/s1	CDAYNQARGBNMSE-POAQFYNOSA-N	482.219905538							100657
BRD-K97408390	LSM-14413		54654020	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18-,20+/m1/s1	RXPZKEATMSRBBD-POAQFYNOSA-N	CN1[C@@H]2CC[C@H](CC(=O)O)O[C@H]2COc3ccc(NS(=O)(=O)c4ccccc4C)cc3C1=O	BroadT	BRD-K97408390	BRD-K97408390-001-01-0	Broad Institute of MIT and Harvard	BRD-K97408390			CN1[C@@H]2CC[C@H](CC(O)=O)O[C@H]2COc2ccc(NS(=O)(=O)c3ccccc3C)cc2C1=O	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18-,20+/m1/s1	RXPZKEATMSRBBD-POAQFYNOSA-N	474.146071882							103068
CHEMBL3188568	LSM-11468	BRD-K49988102	54654147	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20-,24-/m1/s1	OHHWUSSTVAUIQP-DRMXPCRNSA-N	CCCNC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	BroadT	BRD-K49988102	BRD-K49988102-001-01-9	Broad Institute of MIT and Harvard	BRD-K49988102			CCCNC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20-,24-/m1/s1	OHHWUSSTVAUIQP-DRMXPCRNSA-N	509.216200362							100089
BRD-K82582276	LSM-13472		54654038	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26+,28+/m1/s1	SECMWWJMRQEFAV-KHGZIGHDSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccccc3Cl)O[C@H]2COc4ccc(NC(=O)Nc5cccc(C)c5)cc4C1=O	BroadT	BRD-K82582276	BRD-K82582276-001-01-8	Broad Institute of MIT and Harvard	BRD-K82582276			CN1[C@H]2CC[C@H](CC(=O)NCc3ccccc3Cl)O[C@H]2COc2ccc(NC(=O)Nc3cccc(C)c3)cc2C1=O	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26+,28+/m1/s1	SECMWWJMRQEFAV-KHGZIGHDSA-N	576.213947906							102112
BRD-K32652655	LSM-10408		54653991	InChI=1S/C27H26Cl2N4O5S/c1-33-22-6-4-17(10-25(34)30-11-15-2-5-19(28)20(29)8-15)38-24(22)12-37-23-7-3-16(9-18(23)27(33)36)32-26(35)21-13-39-14-31-21/h2-3,5,7-9,13-14,17,22,24H,4,6,10-12H2,1H3,(H,30,34)(H,32,35)/t17-,22-,24+/m0/s1	LHGVLKOLCXFJRT-OZWPHOJSSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@@H]2COc4ccc(NC(=O)c5cscn5)cc4C1=O	BroadT	BRD-K32652655	BRD-K32652655-001-01-1	Broad Institute of MIT and Harvard	BRD-K32652655			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@@H]2COc2ccc(NC(=O)c3cscn3)cc2C1=O	InChI=1S/C27H26Cl2N4O5S/c1-33-22-6-4-17(10-25(34)30-11-15-2-5-19(28)20(29)8-15)38-24(22)12-37-23-7-3-16(9-18(23)27(33)36)32-26(35)21-13-39-14-31-21/h2-3,5,7-9,13-14,17,22,24H,4,6,10-12H2,1H3,(H,30,34)(H,32,35)/t17-,22-,24+/m0/s1	LHGVLKOLCXFJRT-OZWPHOJSSA-N	588.100096082							99029
BRD-K62219715	LSM-12207		54654024	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18-,20-/m0/s1	RXPZKEATMSRBBD-QRFRQXIXSA-N	CN1[C@H]2CC[C@@H](CC(=O)O)O[C@H]2COc3ccc(NS(=O)(=O)c4ccccc4C)cc3C1=O	BroadT	BRD-K62219715	BRD-K62219715-001-01-0	Broad Institute of MIT and Harvard	BRD-K62219715			CN1[C@H]2CC[C@@H](CC(O)=O)O[C@H]2COc2ccc(NS(=O)(=O)c3ccccc3C)cc2C1=O	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18-,20-/m0/s1	RXPZKEATMSRBBD-QRFRQXIXSA-N	474.146071882							100833
BRD-K05984448	LSM-8777		54654239	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27+,29+/m1/s1	JZQJXXSKGFWMTL-XYCBIXARSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K05984448	BRD-K05984448-001-01-3	Broad Institute of MIT and Harvard	BRD-K05984448			CN1[C@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27+,29+/m1/s1	JZQJXXSKGFWMTL-XYCBIXARSA-N	616.30093306							97398
BRD-K44887903	LSM-11159		54653980	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24-,26-/m0/s1	CJRLOTNMWBMMLN-CVJWPJSTSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K44887903	BRD-K44887903-001-01-9	Broad Institute of MIT and Harvard	BRD-K44887903			CN1[C@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24-,26-/m0/s1	CJRLOTNMWBMMLN-CVJWPJSTSA-N	570.251205666							99780
BRD-K35455895	LSM-10556		54654054	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24-,28+/m1/s1	GPWYEVCXUJXIOI-GDRRSRKRSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc5ccc(NC(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K35455895	BRD-K35455895-001-01-6	Broad Institute of MIT and Harvard	BRD-K35455895			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc2ccc(NC(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24-,28+/m1/s1	GPWYEVCXUJXIOI-GDRRSRKRSA-N	575.20677853							99177
BRD-K87492806	LSM-13794		54654126	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26+,28+/m0/s1	KPGMTKVYFCJESC-DANFDKMISA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C1=O	BroadT	BRD-K87492806	BRD-K87492806-001-01-4	Broad Institute of MIT and Harvard	BRD-K87492806			CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26+,28+/m0/s1	KPGMTKVYFCJESC-DANFDKMISA-N	578.219905538							102443
BRD-K09645804	LSM-9019		54654220	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16+,18-/m1/s1	WVVDCAKHEAPTNY-UWWQBHOKSA-N	CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K09645804	BRD-K09645804-001-02-2	Broad Institute of MIT and Harvard	BRD-K09645804			CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(C)=O)cc3C(=O)N2C)O1	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16+,18-/m1/s1	WVVDCAKHEAPTNY-UWWQBHOKSA-N	389.195070994							97640
BRD-K68167702	LSM-12583		54654078	InChI=1S/C26H28F3N3O6/c1-32-20-8-7-18(12-23(33)30-14-26(27,28)29)38-22(20)13-37-21-9-6-16(11-19(21)25(32)35)31-24(34)15-4-3-5-17(10-15)36-2/h3-6,9-11,18,20,22H,7-8,12-14H2,1-2H3,(H,30,33)(H,31,34)/t18-,20+,22+/m0/s1	RKECGHSSKXUWCJ-CZTZKLFOSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@H]4O[C@H](CC(=O)NCC(F)(F)F)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K68167702	BRD-K68167702-001-01-0	Broad Institute of MIT and Harvard	BRD-K68167702			COc1cccc(c1)C(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCC(F)(F)F)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C26H28F3N3O6/c1-32-20-8-7-18(12-23(33)30-14-26(27,28)29)38-22(20)13-37-21-9-6-16(11-19(21)25(32)35)31-24(34)15-4-3-5-17(10-15)36-2/h3-6,9-11,18,20,22H,7-8,12-14H2,1-2H3,(H,30,33)(H,31,34)/t18-,20+,22+/m0/s1	RKECGHSSKXUWCJ-CZTZKLFOSA-N	535.193020246							101214
BRD-K43842808	LSM-11104		54654131	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21-,23+/m0/s1	OPKRVFTXMKZUJR-IEIRFRATSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCC3CC3)O[C@@H]2COc4ccc(NC(=O)NC5CCCC5)cc4C1=O	BroadT	BRD-K43842808	BRD-K43842808-001-01-1	Broad Institute of MIT and Harvard	BRD-K43842808			CN1[C@H]2CC[C@@H](CC(=O)NCC3CC3)O[C@@H]2COc2ccc(NC(=O)NC3CCCC3)cc2C1=O	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21-,23+/m0/s1	OPKRVFTXMKZUJR-IEIRFRATSA-N	484.268570292							99725
BRD-K15104539	LSM-9332		54653989	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25-,27-/m1/s1	KLEFMXRWIUTPPC-FZBZCGEPSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NC(=O)Nc5ccccc5F)cc4C1=O	BroadT	BRD-K15104539	BRD-K15104539-001-01-6	Broad Institute of MIT and Harvard	BRD-K15104539			CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3F)cc2C1=O	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25-,27-/m1/s1	KLEFMXRWIUTPPC-FZBZCGEPSA-N	561.238747374							97953
BRD-K71855031	LSM-12830		54654058	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24+,28-/m1/s1	GPWYEVCXUJXIOI-MCQPEXAWSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc5ccc(NC(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K71855031	BRD-K71855031-001-02-5	Broad Institute of MIT and Harvard	BRD-K71855031			CN1[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc2ccc(NC(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24+,28-/m1/s1	GPWYEVCXUJXIOI-MCQPEXAWSA-N	575.20677853							101467
BRD-K70077013	LSM-12708		54654255	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23-,25-/m1/s1	LLFGMIFPADLUOD-QFZRFWILSA-N	CN1[C@@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K70077013	BRD-K70077013-001-01-1	Broad Institute of MIT and Harvard	BRD-K70077013			CN1[C@@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23-,25-/m1/s1	LLFGMIFPADLUOD-QFZRFWILSA-N	535.22309731							101343
MLS004342466	LSM-12513	BRD-K67087978, SID131450630	54654208	InChI=1S/C31H35N3O7S/c1-20-8-12-24(13-9-20)42(37,38)33-22-10-15-28-25(16-22)31(36)34(2)26-14-11-23(41-29(26)19-40-28)17-30(35)32-18-21-6-4-5-7-27(21)39-3/h4-10,12-13,15-16,23,26,29,33H,11,14,17-19H2,1-3H3,(H,32,35)/t23-,26+,29+/m1/s1	GYVRMNXHBKDJFJ-IXLXJOPFSA-N	COc1ccccc1CNC(=O)C[C@H]2CC[C@H]3[C@H](COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C(=O)N3C)O2	BroadT	BRD-K67087978	BRD-K67087978-001-01-8	Broad Institute of MIT and Harvard	BRD-K67087978			COc1ccccc1CNC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C(=O)N2C)O1	InChI=1S/C31H35N3O7S/c1-20-8-12-24(13-9-20)42(37,38)33-22-10-15-28-25(16-22)31(36)34(2)26-14-11-23(41-29(26)19-40-28)17-30(35)32-18-21-6-4-5-7-27(21)39-3/h4-10,12-13,15-16,23,26,29,33H,11,14,17-19H2,1-3H3,(H,32,35)/t23-,26+,29+/m1/s1	GYVRMNXHBKDJFJ-IXLXJOPFSA-N	593.21957118							101144
BRD-K36853464	LSM-10657		54654172	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23-,25+/m1/s1	DZYZVJKKUJSUJU-PFATUAPWSA-N	COc1cccc(CNC(=O)C[C@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K36853464	BRD-K36853464-001-01-2	Broad Institute of MIT and Harvard	BRD-K36853464			COc1cccc(CNC(=O)C[C@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23-,25+/m1/s1	DZYZVJKKUJSUJU-PFATUAPWSA-N	549.193356432							99278
BRD-K31641287	LSM-10346		54654047	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18+,20+/m1/s1	SDVZNQMNQVCLRJ-KPFFTGBYSA-N	CN1[C@H]2CC[C@H](CC(=O)O)O[C@H]2COc3ccc(NC(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K31641287	BRD-K31641287-001-01-1	Broad Institute of MIT and Harvard	BRD-K31641287			CN1[C@H]2CC[C@H](CC(O)=O)O[C@H]2COc2ccc(NC(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18+,20+/m1/s1	SDVZNQMNQVCLRJ-KPFFTGBYSA-N	458.124464186							98967
CHEMBL2136392	LSM-6835	BRD-K47533918, SID131450711	54654288	InChI=1S/C33H32F3N3O5/c1-39-27-12-11-25(17-30(40)37-24-14-20-4-2-3-5-21(20)15-24)44-29(27)18-43-28-13-10-23(16-26(28)32(39)42)38-31(41)19-6-8-22(9-7-19)33(34,35)36/h2-10,13,16,24-25,27,29H,11-12,14-15,17-18H2,1H3,(H,37,40)(H,38,41)/t25-,27+,29+/m1/s1	CCWJWXJNOLFYBD-WBJKNQCFSA-N	CN1[C@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc5ccc(NC(=O)c6ccc(cc6)C(F)(F)F)cc5C1=O	BroadT	BRD-K47533918	BRD-K47533918-001-01-9	Broad Institute of MIT and Harvard	BRD-K47533918			CN1[C@H]2CC[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc2ccc(NC(=O)c3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C33H32F3N3O5/c1-39-27-12-11-25(17-30(40)37-24-14-20-4-2-3-5-21(20)15-24)44-29(27)18-43-28-13-10-23(16-26(28)32(39)42)38-31(41)19-6-8-22(9-7-19)33(34,35)36/h2-10,13,16,24-25,27,29H,11-12,14-15,17-18H2,1H3,(H,37,40)(H,38,41)/t25-,27+,29+/m1/s1	CCWJWXJNOLFYBD-WBJKNQCFSA-N	607.229405754							95456
BRD-K61683215	LSM-12168		54654276	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22-,24-/m1/s1	RISZPRWRWDPXQV-IHLLOCCUSA-N	CN1[C@@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@@H]2COc4ccc(NC(=O)c5ccc(F)c(F)c5)cc4C1=O	BroadT	BRD-K61683215	BRD-K61683215-001-01-3	Broad Institute of MIT and Harvard	BRD-K61683215			CN1[C@@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22-,24-/m1/s1	RISZPRWRWDPXQV-IHLLOCCUSA-N	529.202442078							100794
BRD-K32053117	LSM-10372		54654072	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19-,21+/m1/s1	QOIMCQVGUSYUFV-BSIFCXSSSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K32053117	BRD-K32053117-001-01-4	Broad Institute of MIT and Harvard	BRD-K32053117			COC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19-,21+/m1/s1	QOIMCQVGUSYUFV-BSIFCXSSSA-N	492.13665005							98993
CHEMBL2356492	LSM-9860	BRD-K23728767, SID131450515	54654093	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22-,24-/m0/s1	CUJGJHGFROPBKV-SSPYTLHUSA-N	COCCNC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K23728767	BRD-K23728767-001-01-5	Broad Institute of MIT and Harvard	BRD-K23728767			COCCNC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22-,24-/m0/s1	CUJGJHGFROPBKV-SSPYTLHUSA-N	495.236935806							98481
CHEMBL2138717	LSM-9488	BRD-K17654006, SID131450461	54654039	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26+,28-/m0/s1	SECMWWJMRQEFAV-AQHOXQCLSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccccc3Cl)O[C@H]2COc4ccc(NC(=O)Nc5cccc(C)c5)cc4C1=O	BroadT	BRD-K17654006	BRD-K17654006-001-01-2	Broad Institute of MIT and Harvard	BRD-K17654006			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccccc3Cl)O[C@H]2COc2ccc(NC(=O)Nc3cccc(C)c3)cc2C1=O	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26+,28-/m0/s1	SECMWWJMRQEFAV-AQHOXQCLSA-N	576.213947906							98109
BRD-K07105437	LSM-8847		54654293	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24-,26+/m0/s1	CJRLOTNMWBMMLN-PMWMKWCKSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K07105437	BRD-K07105437-001-01-6	Broad Institute of MIT and Harvard	BRD-K07105437			CN1[C@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24-,26+/m0/s1	CJRLOTNMWBMMLN-PMWMKWCKSA-N	570.251205666							97468
BRD-K57027181	LSM-11882		54654031	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21+,23-/m0/s1	IOGMTQBPALZMTJ-WPYKKVEZSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K57027181	BRD-K57027181-001-01-9	Broad Institute of MIT and Harvard	BRD-K57027181			CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21+,23-/m0/s1	IOGMTQBPALZMTJ-WPYKKVEZSA-N	480.237270164							100508
BRD-K71943487	LSM-12837		54654295	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24-,26-/m1/s1	CJRLOTNMWBMMLN-YMVVMYQSSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K71943487	BRD-K71943487-001-01-0	Broad Institute of MIT and Harvard	BRD-K71943487			CN1[C@@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24-,26-/m1/s1	CJRLOTNMWBMMLN-YMVVMYQSSA-N	570.251205666							101474
BRD-K22630074	LSM-9801		54654060	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18+,20+/m0/s1	CDAYNQARGBNMSE-ILZDJORESA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K22630074	BRD-K22630074-001-01-2	Broad Institute of MIT and Harvard	BRD-K22630074			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NS(C)(=O)=O)cc3C(=O)N2C)O1	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18+,20+/m0/s1	CDAYNQARGBNMSE-ILZDJORESA-N	482.219905538							98422
CHEMBL2132939	LSM-11185	BRD-K45319476, SID131450694	54654271	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26+,28+/m0/s1	UIBIEJVTTJAUBZ-FUCCEYAGSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K45319476	BRD-K45319476-001-01-9	Broad Institute of MIT and Harvard	BRD-K45319476			C[C@H](NC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26+,28+/m0/s1	UIBIEJVTTJAUBZ-FUCCEYAGSA-N	597.170034174							99806
BRD-K98092496	LSM-14459		54654035	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26-,28-/m1/s1	SECMWWJMRQEFAV-KODFZCBSSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccccc3Cl)O[C@@H]2COc4ccc(NC(=O)Nc5cccc(C)c5)cc4C1=O	BroadT	BRD-K98092496	BRD-K98092496-001-01-4	Broad Institute of MIT and Harvard	BRD-K98092496			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccccc3Cl)O[C@@H]2COc2ccc(NC(=O)Nc3cccc(C)c3)cc2C1=O	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26-,28-/m1/s1	SECMWWJMRQEFAV-KODFZCBSSA-N	576.213947906							103114
BRD-K89347234	LSM-13929		54654135	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21+,23+/m0/s1	OPKRVFTXMKZUJR-XKCSPQBFSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC3CC3)O[C@@H]2COc4ccc(NC(=O)NC5CCCC5)cc4C1=O	BroadT	BRD-K89347234	BRD-K89347234-001-01-0	Broad Institute of MIT and Harvard	BRD-K89347234			CN1[C@@H]2CC[C@@H](CC(=O)NCC3CC3)O[C@@H]2COc2ccc(NC(=O)NC3CCCC3)cc2C1=O	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21+,23+/m0/s1	OPKRVFTXMKZUJR-XKCSPQBFSA-N	484.268570292							102582
CHEMBL3185630	LSM-9339	BRD-K15185037	54654184	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23-,25+/m1/s1	HUCZTLCWVGQLCW-PFATUAPWSA-N	COCC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N4CCc5ccccc5C4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K15185037	BRD-K15185037-001-01-2	Broad Institute of MIT and Harvard	BRD-K15185037			COCC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N4CCc5ccccc5C4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23-,25+/m1/s1	HUCZTLCWVGQLCW-PFATUAPWSA-N	507.236935806							97960
BRD-K71045429	LSM-12766		54654104	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23-,25-/m1/s1	WOMWNJCZYVCUPK-GZGNHOFSSA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	BroadT	BRD-K71045429	BRD-K71045429-001-01-5	Broad Institute of MIT and Harvard	BRD-K71045429			COc1ccc(CNC(=O)C[C@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23-,25-/m1/s1	WOMWNJCZYVCUPK-GZGNHOFSSA-N	509.25258587							101403
BRD-K63860984	LSM-12322		54654241	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27-,29+/m1/s1	JZQJXXSKGFWMTL-IMBSVQIASA-N	CN1[C@@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K63860984	BRD-K63860984-001-01-4	Broad Institute of MIT and Harvard	BRD-K63860984			CN1[C@@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27-,29+/m1/s1	JZQJXXSKGFWMTL-IMBSVQIASA-N	616.30093306							100949
BRD-K35131740	LSM-10541		54654030	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21-,23-/m0/s1	IOGMTQBPALZMTJ-RRPUWOKSSA-N	CN(C)C(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K35131740	BRD-K35131740-001-01-0	Broad Institute of MIT and Harvard	BRD-K35131740			CN(C)C(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21-,23-/m0/s1	IOGMTQBPALZMTJ-RRPUWOKSSA-N	480.237270164							99162
BRD-K32388810	LSM-10396		54654111	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25+,27-/m0/s1	CEZHWMAQWNYMAY-RWUBSVTLSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccccc3F)O[C@H]2COc4ccc(NC(=O)C5CCCCC5)cc4C1=O	BroadT	BRD-K32388810	BRD-K32388810-001-01-4	Broad Institute of MIT and Harvard	BRD-K32388810			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccccc3F)O[C@H]2COc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25+,27-/m0/s1	CEZHWMAQWNYMAY-RWUBSVTLSA-N	537.263899482							99017
BRD-K74429632	LSM-12986		54654000	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19-,21-/m0/s1	RRCKKFPVDDPSKT-CUWPLCDZSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N4CCN(C)CC4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K74429632	BRD-K74429632-001-01-1	Broad Institute of MIT and Harvard	BRD-K74429632			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N4CCN(C)CC4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19-,21-/m0/s1	RRCKKFPVDDPSKT-CUWPLCDZSA-N	494.219905538							101623
BRD-K70802145	LSM-12748		54654218	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16+,18+/m1/s1	WVVDCAKHEAPTNY-HFTRVMKXSA-N	CCNC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K70802145	BRD-K70802145-001-01-3	Broad Institute of MIT and Harvard	BRD-K70802145			CCNC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(C)=O)cc3C(=O)N2C)O1	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16+,18+/m1/s1	WVVDCAKHEAPTNY-HFTRVMKXSA-N	389.195070994							101385
BRD-K76885481	LSM-13134		54654089	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20+,22-/m1/s1	IFOOEWPAOUEVPY-KAGYGMCKSA-N	CN1[C@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccs5)cc4C1=O	BroadT	BRD-K76885481	BRD-K76885481-001-01-4	Broad Institute of MIT and Harvard	BRD-K76885481			CN1[C@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccs3)cc2C1=O	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20+,22-/m1/s1	IFOOEWPAOUEVPY-KAGYGMCKSA-N	497.198441812							101772
BRD-K92434936	LSM-14098		54654113	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25-,27+/m0/s1	CEZHWMAQWNYMAY-RIACCQAKSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccccc3F)O[C@@H]2COc4ccc(NC(=O)C5CCCCC5)cc4C1=O	BroadT	BRD-K92434936	BRD-K92434936-001-01-2	Broad Institute of MIT and Harvard	BRD-K92434936			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccccc3F)O[C@@H]2COc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25-,27+/m0/s1	CEZHWMAQWNYMAY-RIACCQAKSA-N	537.263899482							102752
CHEMBL3182597	LSM-14055	BRD-K91595583	54654286	InChI=1S/C33H32F3N3O5/c1-39-27-12-11-25(17-30(40)37-24-14-20-4-2-3-5-21(20)15-24)44-29(27)18-43-28-13-10-23(16-26(28)32(39)42)38-31(41)19-6-8-22(9-7-19)33(34,35)36/h2-10,13,16,24-25,27,29H,11-12,14-15,17-18H2,1H3,(H,37,40)(H,38,41)/t25-,27-,29+/m0/s1	CCWJWXJNOLFYBD-MDZVADFISA-N	CN1[C@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc5ccc(NC(=O)c6ccc(cc6)C(F)(F)F)cc5C1=O	BroadT	BRD-K91595583	BRD-K91595583-001-01-7	Broad Institute of MIT and Harvard	BRD-K91595583			CN1[C@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc2ccc(NC(=O)c3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C33H32F3N3O5/c1-39-27-12-11-25(17-30(40)37-24-14-20-4-2-3-5-21(20)15-24)44-29(27)18-43-28-13-10-23(16-26(28)32(39)42)38-31(41)19-6-8-22(9-7-19)33(34,35)36/h2-10,13,16,24-25,27,29H,11-12,14-15,17-18H2,1H3,(H,37,40)(H,38,41)/t25-,27-,29+/m0/s1	CCWJWXJNOLFYBD-MDZVADFISA-N	607.229405754							102708
BRD-K21665449	LSM-9747		54654287	InChI=1S/C33H32F3N3O5/c1-39-27-12-11-25(17-30(40)37-24-14-20-4-2-3-5-21(20)15-24)44-29(27)18-43-28-13-10-23(16-26(28)32(39)42)38-31(41)19-6-8-22(9-7-19)33(34,35)36/h2-10,13,16,24-25,27,29H,11-12,14-15,17-18H2,1H3,(H,37,40)(H,38,41)/t25-,27+,29+/m0/s1	CCWJWXJNOLFYBD-BOSLPAGOSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc5ccc(NC(=O)c6ccc(cc6)C(F)(F)F)cc5C1=O	BroadT	BRD-K21665449	BRD-K21665449-001-01-7	Broad Institute of MIT and Harvard	BRD-K21665449			CN1[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2COc2ccc(NC(=O)c3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C33H32F3N3O5/c1-39-27-12-11-25(17-30(40)37-24-14-20-4-2-3-5-21(20)15-24)44-29(27)18-43-28-13-10-23(16-26(28)32(39)42)38-31(41)19-6-8-22(9-7-19)33(34,35)36/h2-10,13,16,24-25,27,29H,11-12,14-15,17-18H2,1H3,(H,37,40)(H,38,41)/t25-,27+,29+/m0/s1	CCWJWXJNOLFYBD-BOSLPAGOSA-N	607.229405754							98368
BRD-K06188347	LSM-8788		54654013	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21-,23-/m1/s1	OWLQYYZEQLHDAT-JMUQELJHSA-N	CN1[C@@H]2CC[C@H](CC(=O)NC3CCCC3)O[C@@H]2COc4ccc(NC(=O)c5cc(C)on5)cc4C1=O	BroadT	BRD-K06188347	BRD-K06188347-001-01-2	Broad Institute of MIT and Harvard	BRD-K06188347			CN1[C@@H]2CC[C@H](CC(=O)NC3CCCC3)O[C@@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21-,23-/m1/s1	OWLQYYZEQLHDAT-JMUQELJHSA-N	496.232184784							97409
BRD-K64694541	LSM-12382		54654222	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27+,29-/m0/s1	ZIFILFAABSOBLR-HWUUJZMBSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COc5ccc(NS(=O)(=O)c6cccc(F)c6)cc5C1=O	BroadT	BRD-K64694541	BRD-K64694541-001-01-2	Broad Institute of MIT and Harvard	BRD-K64694541			CN1[C@@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27+,29-/m0/s1	ZIFILFAABSOBLR-HWUUJZMBSA-N	593.199584664							101009
BRD-K86336638	LSM-6857		54654199	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30-,32+/m0/s1	DRCDGYYITPZHEH-OCUZPWFOSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K86336638	BRD-K86336638-001-01-8	Broad Institute of MIT and Harvard	BRD-K86336638			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30-,32+/m0/s1	DRCDGYYITPZHEH-OCUZPWFOSA-N	609.22974194							95478
CHEMBL2356525	LSM-11957	BRD-K58493165, SID131450414	54653992	InChI=1S/C27H26Cl2N4O5S/c1-33-22-6-4-17(10-25(34)30-11-15-2-5-19(28)20(29)8-15)38-24(22)12-37-23-7-3-16(9-18(23)27(33)36)32-26(35)21-13-39-14-31-21/h2-3,5,7-9,13-14,17,22,24H,4,6,10-12H2,1H3,(H,30,34)(H,32,35)/t17-,22+,24-/m0/s1	LHGVLKOLCXFJRT-YJGRUCBDSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2COc4ccc(NC(=O)c5cscn5)cc4C1=O	BroadT	BRD-K58493165	BRD-K58493165-001-01-2	Broad Institute of MIT and Harvard	BRD-K58493165			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2COc2ccc(NC(=O)c3cscn3)cc2C1=O	InChI=1S/C27H26Cl2N4O5S/c1-33-22-6-4-17(10-25(34)30-11-15-2-5-19(28)20(29)8-15)38-24(22)12-37-23-7-3-16(9-18(23)27(33)36)32-26(35)21-13-39-14-31-21/h2-3,5,7-9,13-14,17,22,24H,4,6,10-12H2,1H3,(H,30,34)(H,32,35)/t17-,22+,24-/m0/s1	LHGVLKOLCXFJRT-YJGRUCBDSA-N	588.100096082							100583
BRD-K94797630	LSM-14242		54654003	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24+,26-/m1/s1	VRPVHEJOGHTQDQ-KTIWRFAQSA-N	COc1cccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K94797630	BRD-K94797630-001-01-9	Broad Institute of MIT and Harvard	BRD-K94797630			COc1cccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24+,26-/m1/s1	VRPVHEJOGHTQDQ-KTIWRFAQSA-N	537.24750049							102896
BRD-K18319377	LSM-9528		54654163	InChI=1S/C26H31ClN4O5/c1-15(2)28-26(34)29-16-8-11-22-18(12-16)25(33)31(3)21-10-9-17(36-23(21)14-35-22)13-24(32)30-20-7-5-4-6-19(20)27/h4-8,11-12,15,17,21,23H,9-10,13-14H2,1-3H3,(H,30,32)(H2,28,29,34)/t17-,21+,23-/m1/s1	FZGMKYAFXDIPHD-FRGLQRNOSA-N	CC(C)NC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4ccccc4Cl)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K18319377	BRD-K18319377-001-02-0	Broad Institute of MIT and Harvard	BRD-K18319377			CC(C)NC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4ccccc4Cl)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C26H31ClN4O5/c1-15(2)28-26(34)29-16-8-11-22-18(12-16)25(33)31(3)21-10-9-17(36-23(21)14-35-22)13-24(32)30-20-7-5-4-6-19(20)27/h4-8,11-12,15,17,21,23H,9-10,13-14H2,1-3H3,(H,30,32)(H2,28,29,34)/t17-,21+,23-/m1/s1	FZGMKYAFXDIPHD-FRGLQRNOSA-N	514.198297842							98149
BRD-K81641277	LSM-13411		54654009	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24-,26+/m1/s1	VRPVHEJOGHTQDQ-NOOIUNMQSA-N	COc1cccc(NC(=O)C[C@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K81641277	BRD-K81641277-001-01-2	Broad Institute of MIT and Harvard	BRD-K81641277			COc1cccc(NC(=O)C[C@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24-,26+/m1/s1	VRPVHEJOGHTQDQ-NOOIUNMQSA-N	537.24750049							102051
BRD-K66732564	LSM-12493		54654285	InChI=1S/C32H34N4O7/c1-36-26-11-10-23(15-30(37)33-21-8-7-19-16-41-17-20(19)13-21)43-29(26)18-42-27-12-9-22(14-24(27)31(36)38)34-32(39)35-25-5-3-4-6-28(25)40-2/h3-9,12-14,23,26,29H,10-11,15-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26+,29-/m1/s1	XZXFEFKMJGRIPH-ZSOKXDGFSA-N	COc1ccccc1NC(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)Nc5ccc6COCc6c5)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K66732564	BRD-K66732564-001-02-8	Broad Institute of MIT and Harvard	BRD-K66732564			COc1ccccc1NC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4ccc5COCc5c4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C32H34N4O7/c1-36-26-11-10-23(15-30(37)33-21-8-7-19-16-41-17-20(19)13-21)43-29(26)18-42-27-12-9-22(14-24(27)31(36)38)34-32(39)35-25-5-3-4-6-28(25)40-2/h3-9,12-14,23,26,29H,10-11,15-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26+,29-/m1/s1	XZXFEFKMJGRIPH-ZSOKXDGFSA-N	586.242749468							101124
BRD-K85388022	LSM-13650		54654151	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20+,24-/m0/s1	OHHWUSSTVAUIQP-NRYAXDJKSA-N	CCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	BroadT	BRD-K85388022	BRD-K85388022-001-01-4	Broad Institute of MIT and Harvard	BRD-K85388022			CCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20+,24-/m0/s1	OHHWUSSTVAUIQP-NRYAXDJKSA-N	509.216200362							102297
BRD-K79219981	LSM-13269		54653977	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24-,26+/m1/s1	CJRLOTNMWBMMLN-QQSVUBKYSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K79219981	BRD-K79219981-001-01-8	Broad Institute of MIT and Harvard	BRD-K79219981			CN1[C@@H]2CC[C@H](CC(=O)NCCCN3CCOCC3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24-,26+/m1/s1	CJRLOTNMWBMMLN-QQSVUBKYSA-N	570.251205666							101908
BRD-K42702351	LSM-11021		54654177	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23+,25-/m0/s1	DZYZVJKKUJSUJU-PWWKTKHKSA-N	COc1cccc(CNC(=O)C[C@@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K42702351	BRD-K42702351-001-01-9	Broad Institute of MIT and Harvard	BRD-K42702351			COc1cccc(CNC(=O)C[C@@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23+,25-/m0/s1	DZYZVJKKUJSUJU-PWWKTKHKSA-N	549.193356432							99642
BRD-K19873234	LSM-9631		54654189	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25+,27+/m0/s1	XIGYLWQKLZSYNZ-VXQMPNGUSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc4ccc(NC(=O)Nc5ccc(Cl)cc5)cc4C1=O	BroadT	BRD-K19873234	BRD-K19873234-001-01-0	Broad Institute of MIT and Harvard	BRD-K19873234			CN1[C@@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2C1=O	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25+,27+/m0/s1	XIGYLWQKLZSYNZ-VXQMPNGUSA-N	583.256147076							98252
BRD-K47943934	LSM-11345		54654118	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22+,24+/m0/s1	BYJFOJVMGKORHN-BGWNEDDSSA-N	CCCC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCc4cccc(F)c4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K47943934	BRD-K47943934-001-01-0	Broad Institute of MIT and Harvard	BRD-K47943934			CCCC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)NCc4cccc(F)c4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22+,24+/m0/s1	BYJFOJVMGKORHN-BGWNEDDSSA-N	497.232599354							99966
BRD-K20950855	LSM-9704		54654156	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20+,22+/m0/s1	MBWHXZFHLNKYMT-UCNVEGJOSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)c5cscn5)cc4C(=O)N3C)O2	BroadT	BRD-K20950855	BRD-K20950855-001-01-1	Broad Institute of MIT and Harvard	BRD-K20950855			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4cscn4)cc3C(=O)N2C)O1	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20+,22+/m0/s1	MBWHXZFHLNKYMT-UCNVEGJOSA-N	513.204589832							98325
BRD-K90679612	LSM-14014		54654141	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25-,27-/m1/s1	TUUZOQPHVDGSNW-AVPJRLCVSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc4ccc(NS(=O)(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K90679612	BRD-K90679612-001-01-5	Broad Institute of MIT and Harvard	BRD-K90679612			CN1[C@@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25-,27-/m1/s1	TUUZOQPHVDGSNW-AVPJRLCVSA-N	588.241783834							102667
BRD-K53283295	LSM-11677		54654057	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24+,28+/m0/s1	GPWYEVCXUJXIOI-MUXSNRJPSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc5ccc(NC(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K53283295	BRD-K53283295-001-01-5	Broad Institute of MIT and Harvard	BRD-K53283295			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc2ccc(NC(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24+,28+/m0/s1	GPWYEVCXUJXIOI-MUXSNRJPSA-N	575.20677853							100302
BRD-K48431409	LSM-11374		54654092	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22-,24+/m0/s1	CUJGJHGFROPBKV-ODGPQVTHSA-N	COCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K48431409	BRD-K48431409-001-01-1	Broad Institute of MIT and Harvard	BRD-K48431409			COCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22-,24+/m0/s1	CUJGJHGFROPBKV-ODGPQVTHSA-N	495.236935806							99995
BRD-K51812182	LSM-11598		54654264	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26-,28-/m1/s1	UIBIEJVTTJAUBZ-SJJZSITHSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K51812182	BRD-K51812182-001-01-9	Broad Institute of MIT and Harvard	BRD-K51812182			C[C@@H](NC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26-,28-/m1/s1	UIBIEJVTTJAUBZ-SJJZSITHSA-N	597.170034174							100221
BRD-K39367499	LSM-10816		54653985	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25-,27+/m0/s1	KLEFMXRWIUTPPC-IDNYDCHQSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NC(=O)Nc5ccccc5F)cc4C1=O	BroadT	BRD-K39367499	BRD-K39367499-001-01-9	Broad Institute of MIT and Harvard	BRD-K39367499			CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3F)cc2C1=O	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25-,27+/m0/s1	KLEFMXRWIUTPPC-IDNYDCHQSA-N	561.238747374							99437
BRD-K12506756	LSM-9174		54654281	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22+,24+/m0/s1	RISZPRWRWDPXQV-KUWBRRTOSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@@H]2COc4ccc(NC(=O)c5ccc(F)c(F)c5)cc4C1=O	BroadT	BRD-K12506756	BRD-K12506756-001-01-1	Broad Institute of MIT and Harvard	BRD-K12506756			CN1[C@@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22+,24+/m0/s1	RISZPRWRWDPXQV-KUWBRRTOSA-N	529.202442078							97795
BRD-K89637659	LSM-13958		54654026	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18+,20-/m1/s1	RXPZKEATMSRBBD-IMFGXOCKSA-N	CN1[C@H]2CC[C@H](CC(=O)O)O[C@@H]2COc3ccc(NS(=O)(=O)c4ccccc4C)cc3C1=O	BroadT	BRD-K89637659	BRD-K89637659-001-02-8	Broad Institute of MIT and Harvard	BRD-K89637659			CN1[C@H]2CC[C@H](CC(O)=O)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccccc3C)cc2C1=O	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18+,20-/m1/s1	RXPZKEATMSRBBD-IMFGXOCKSA-N	474.146071882							102611
BRD-K30851490	LSM-10289		54654181	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23+,25+/m1/s1	HUCZTLCWVGQLCW-VTZPFEBOSA-N	COCC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N4CCc5ccccc5C4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K30851490	BRD-K30851490-001-01-0	Broad Institute of MIT and Harvard	BRD-K30851490			COCC(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N4CCc5ccccc5C4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23+,25+/m1/s1	HUCZTLCWVGQLCW-VTZPFEBOSA-N	507.236935806							98910
BRD-K48054407	LSM-11356		54654070	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19-,21+/m0/s1	QOIMCQVGUSYUFV-NBHGPNQESA-N	COC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K48054407	BRD-K48054407-001-01-3	Broad Institute of MIT and Harvard	BRD-K48054407			COC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19-,21+/m0/s1	QOIMCQVGUSYUFV-NBHGPNQESA-N	492.13665005							99977
BRD-K50572265	LSM-11503		54654032	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21+,23-/m1/s1	IOGMTQBPALZMTJ-UNWVZKJWSA-N	CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K50572265	BRD-K50572265-001-01-0	Broad Institute of MIT and Harvard	BRD-K50572265			CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21+,23-/m1/s1	IOGMTQBPALZMTJ-UNWVZKJWSA-N	480.237270164							100124
BRD-K39014692	LSM-10793		54654227	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27+,29+/m1/s1	ZIFILFAABSOBLR-QXGAZULMSA-N	CN1[C@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COc5ccc(NS(=O)(=O)c6cccc(F)c6)cc5C1=O	BroadT	BRD-K39014692	BRD-K39014692-001-01-2	Broad Institute of MIT and Harvard	BRD-K39014692			CN1[C@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27+,29+/m1/s1	ZIFILFAABSOBLR-QXGAZULMSA-N	593.199584664							99414
BRD-K68655663	LSM-12615		54654130	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21+,23+/m1/s1	OPKRVFTXMKZUJR-NWSQWKLXSA-N	CN1[C@H]2CC[C@H](CC(=O)NCC3CC3)O[C@H]2COc4ccc(NC(=O)NC5CCCC5)cc4C1=O	BroadT	BRD-K68655663	BRD-K68655663-001-01-1	Broad Institute of MIT and Harvard	BRD-K68655663			CN1[C@H]2CC[C@H](CC(=O)NCC3CC3)O[C@H]2COc2ccc(NC(=O)NC3CCCC3)cc2C1=O	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21+,23+/m1/s1	OPKRVFTXMKZUJR-NWSQWKLXSA-N	484.268570292							101247
CHEMBL2142395	LSM-9911	BRD-K24469697, SID131450713	54654290	InChI=1S/C33H32F3N3O5/c1-39-27-12-11-25(17-30(40)37-24-14-20-4-2-3-5-21(20)15-24)44-29(27)18-43-28-13-10-23(16-26(28)32(39)42)38-31(41)19-6-8-22(9-7-19)33(34,35)36/h2-10,13,16,24-25,27,29H,11-12,14-15,17-18H2,1H3,(H,37,40)(H,38,41)/t25-,27+,29-/m0/s1	CCWJWXJNOLFYBD-BUAQGSAMSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc5ccc(NC(=O)c6ccc(cc6)C(F)(F)F)cc5C1=O	BroadT	BRD-K24469697	BRD-K24469697-001-01-0	Broad Institute of MIT and Harvard	BRD-K24469697			CN1[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2COc2ccc(NC(=O)c3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C33H32F3N3O5/c1-39-27-12-11-25(17-30(40)37-24-14-20-4-2-3-5-21(20)15-24)44-29(27)18-43-28-13-10-23(16-26(28)32(39)42)38-31(41)19-6-8-22(9-7-19)33(34,35)36/h2-10,13,16,24-25,27,29H,11-12,14-15,17-18H2,1H3,(H,37,40)(H,38,41)/t25-,27+,29-/m0/s1	CCWJWXJNOLFYBD-BUAQGSAMSA-N	607.229405754							98532
BRD-K13007539	LSM-9206		54654278	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22-,24+/m1/s1	RISZPRWRWDPXQV-XANCMCCPSA-N	CN1[C@@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@H]2COc4ccc(NC(=O)c5ccc(F)c(F)c5)cc4C1=O	BroadT	BRD-K13007539	BRD-K13007539-001-01-3	Broad Institute of MIT and Harvard	BRD-K13007539			CN1[C@@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22-,24+/m1/s1	RISZPRWRWDPXQV-XANCMCCPSA-N	529.202442078							97827
BRD-K81699431	LSM-13418		54654246	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25+,27+/m1/s1	MRUYUJCJGOFQDV-PWMMPXSUSA-N	COc1cccc(CNC(=O)C[C@H]2CC[C@H]3[C@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	BroadT	BRD-K81699431	BRD-K81699431-001-01-3	Broad Institute of MIT and Harvard	BRD-K81699431			COc1cccc(CNC(=O)C[C@H]2CC[C@H]3[C@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25+,27+/m1/s1	MRUYUJCJGOFQDV-PWMMPXSUSA-N	597.194499284							102058
BRD-K81706693	LSM-13419		54654121	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22+,24-/m1/s1	BYJFOJVMGKORHN-JCTONOIOSA-N	CCCC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCc4cccc(F)c4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K81706693	BRD-K81706693-001-02-7	Broad Institute of MIT and Harvard	BRD-K81706693			CCCC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCc4cccc(F)c4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22+,24-/m1/s1	BYJFOJVMGKORHN-JCTONOIOSA-N	497.232599354							102059
BRD-K82121314	LSM-13446		54654052	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24-,28-/m0/s1	GPWYEVCXUJXIOI-IDOVBLGQSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc5ccc(NC(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K82121314	BRD-K82121314-001-01-9	Broad Institute of MIT and Harvard	BRD-K82121314			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COc2ccc(NC(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24-,28-/m0/s1	GPWYEVCXUJXIOI-IDOVBLGQSA-N	575.20677853							102086
BRD-K83426260	LSM-13530		54654094	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22-,24-/m1/s1	CUJGJHGFROPBKV-KIFXHHALSA-N	COCCNC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K83426260	BRD-K83426260-001-01-5	Broad Institute of MIT and Harvard	BRD-K83426260			COCCNC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22-,24-/m1/s1	CUJGJHGFROPBKV-KIFXHHALSA-N	495.236935806							102172
BRD-K86981020	LSM-13763		54653987	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25+,27-/m0/s1	KLEFMXRWIUTPPC-BBVXACFBSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NC(=O)Nc5ccccc5F)cc4C1=O	BroadT	BRD-K86981020	BRD-K86981020-001-01-7	Broad Institute of MIT and Harvard	BRD-K86981020			CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NC(=O)Nc3ccccc3F)cc2C1=O	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25+,27-/m0/s1	KLEFMXRWIUTPPC-BBVXACFBSA-N	561.238747374							102412
BRD-K82494270	LSM-13468		54654232	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27-,29-/m0/s1	JZQJXXSKGFWMTL-JVGXHWGJSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K82494270	BRD-K82494270-001-01-2	Broad Institute of MIT and Harvard	BRD-K82494270			CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27-,29-/m0/s1	JZQJXXSKGFWMTL-JVGXHWGJSA-N	616.30093306							102108
BRD-K39839350	LSM-10856		54654015	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21+,23+/m1/s1	OWLQYYZEQLHDAT-JZWVFAODSA-N	CN1[C@H]2CC[C@H](CC(=O)NC3CCCC3)O[C@H]2COc4ccc(NC(=O)c5cc(C)on5)cc4C1=O	BroadT	BRD-K39839350	BRD-K39839350-001-01-5	Broad Institute of MIT and Harvard	BRD-K39839350			CN1[C@H]2CC[C@H](CC(=O)NC3CCCC3)O[C@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21+,23+/m1/s1	OWLQYYZEQLHDAT-JZWVFAODSA-N	496.232184784							99477
BRD-K10388622	LSM-9057		54654029	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21+,23+/m0/s1	IOGMTQBPALZMTJ-XKCSPQBFSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K10388622	BRD-K10388622-001-01-8	Broad Institute of MIT and Harvard	BRD-K10388622			CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21+,23+/m0/s1	IOGMTQBPALZMTJ-XKCSPQBFSA-N	480.237270164							97678
BRD-K86843304	LSM-13753		54653990	InChI=1S/C25H34F3N3O6S/c1-31-20-9-8-18(12-23(32)29-13-16-5-3-2-4-6-16)37-22(20)14-36-21-10-7-17(11-19(21)24(31)33)30-38(34,35)15-25(26,27)28/h7,10-11,16,18,20,22,30H,2-6,8-9,12-15H2,1H3,(H,29,32)/t18-,20+,22-/m1/s1	POTYIVUJTYUDPC-KAGYGMCKSA-N	CN1[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc4ccc(NS(=O)(=O)CC(F)(F)F)cc4C1=O	BroadT	BRD-K86843304	BRD-K86843304-001-02-4	Broad Institute of MIT and Harvard	BRD-K86843304			CN1[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NS(=O)(=O)CC(F)(F)F)cc2C1=O	InChI=1S/C25H34F3N3O6S/c1-31-20-9-8-18(12-23(32)29-13-16-5-3-2-4-6-16)37-22(20)14-36-21-10-7-17(11-19(21)24(31)33)30-38(34,35)15-25(26,27)28/h7,10-11,16,18,20,22,30H,2-6,8-9,12-15H2,1H3,(H,29,32)/t18-,20+,22-/m1/s1	POTYIVUJTYUDPC-KAGYGMCKSA-N	561.212041128							102402
BRD-K43438744	LSM-11071		54654080	InChI=1S/C32H37N3O7S/c1-20(2)21-8-10-22(11-9-21)33-31(36)18-25-13-14-28-30(42-25)19-41-29-15-12-23(16-27(29)32(37)35(28)3)34-43(38,39)26-7-5-6-24(17-26)40-4/h5-12,15-17,20,25,28,30,34H,13-14,18-19H2,1-4H3,(H,33,36)/t25-,28+,30-/m1/s1	UOPAUQKTAXJBGP-JEBMXCGPSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)Nc5ccc(cc5)C(C)C)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K43438744	BRD-K43438744-001-02-3	Broad Institute of MIT and Harvard	BRD-K43438744			COc1cccc(c1)S(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4ccc(cc4)C(C)C)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C32H37N3O7S/c1-20(2)21-8-10-22(11-9-21)33-31(36)18-25-13-14-28-30(42-25)19-41-29-15-12-23(16-27(29)32(37)35(28)3)34-43(38,39)26-7-5-6-24(17-26)40-4/h5-12,15-17,20,25,28,30,34H,13-14,18-19H2,1-4H3,(H,33,36)/t25-,28+,30-/m1/s1	UOPAUQKTAXJBGP-JEBMXCGPSA-N	607.235221244							99692
BRD-K34604832	LSM-10515		54654129	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26-,28-/m1/s1	KPGMTKVYFCJESC-KODFZCBSSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C1=O	BroadT	BRD-K34604832	BRD-K34604832-001-01-6	Broad Institute of MIT and Harvard	BRD-K34604832			CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26-,28-/m1/s1	KPGMTKVYFCJESC-KODFZCBSSA-N	578.219905538							99136
BRD-K14487375	LSM-9307		54654087	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20+,22+/m0/s1	IFOOEWPAOUEVPY-CZTZKLFOSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccs5)cc4C1=O	BroadT	BRD-K14487375	BRD-K14487375-001-01-3	Broad Institute of MIT and Harvard	BRD-K14487375			CN1[C@@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccs3)cc2C1=O	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20+,22+/m0/s1	IFOOEWPAOUEVPY-CZTZKLFOSA-N	497.198441812							97928
BRD-K31815095	LSM-10358		54654168	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19+,21+/m0/s1	RQAOUBOGQGVTCU-FBBABVLZSA-N	CNC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	BroadT	BRD-K31815095	BRD-K31815095-001-01-3	Broad Institute of MIT and Harvard	BRD-K31815095			CNC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19+,21+/m0/s1	RQAOUBOGQGVTCU-FBBABVLZSA-N	473.17622733							98979
BRD-K29674378	LSM-10228		54654098	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23-,25-/m0/s1	WOMWNJCZYVCUPK-RSEQLOHWSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	BroadT	BRD-K29674378	BRD-K29674378-001-01-6	Broad Institute of MIT and Harvard	BRD-K29674378			COc1ccc(CNC(=O)C[C@@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23-,25-/m0/s1	WOMWNJCZYVCUPK-RSEQLOHWSA-N	509.25258587							98849
CHEMBL2356652	LSM-10489	BRD-K34038660, SID131450571	54654149	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20-,24-/m0/s1	OHHWUSSTVAUIQP-WXVUKLJWSA-N	CCCNC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	BroadT	BRD-K34038660	BRD-K34038660-001-01-4	Broad Institute of MIT and Harvard	BRD-K34038660			CCCNC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20-,24-/m0/s1	OHHWUSSTVAUIQP-WXVUKLJWSA-N	509.216200362							99110
BRD-K15690570	LSM-9368		54654167	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19-,21+/m0/s1	RQAOUBOGQGVTCU-HFSMHLIXSA-N	CNC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	BroadT	BRD-K15690570	BRD-K15690570-001-01-4	Broad Institute of MIT and Harvard	BRD-K15690570			CNC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19-,21+/m0/s1	RQAOUBOGQGVTCU-HFSMHLIXSA-N	473.17622733							97989
BRD-K42752188	LSM-11028		54653982	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25-,27-/m0/s1	KLEFMXRWIUTPPC-NOOLENRPSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NC(=O)Nc5ccccc5F)cc4C1=O	BroadT	BRD-K42752188	BRD-K42752188-001-01-3	Broad Institute of MIT and Harvard	BRD-K42752188			CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NC(=O)Nc3ccccc3F)cc2C1=O	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25-,27-/m0/s1	KLEFMXRWIUTPPC-NOOLENRPSA-N	561.238747374							99649
BRD-K29110787	LSM-10193		54654085	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20-,22+/m1/s1	IFOOEWPAOUEVPY-UZKOGDIHSA-N	CN1[C@@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@H]2COc4ccc(NC(=O)c5cccs5)cc4C1=O	BroadT	BRD-K29110787	BRD-K29110787-001-01-6	Broad Institute of MIT and Harvard	BRD-K29110787			CN1[C@@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@H]2COc2ccc(NC(=O)c3cccs3)cc2C1=O	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20-,22+/m1/s1	IFOOEWPAOUEVPY-UZKOGDIHSA-N	497.198441812							98814
BRD-K22608272	LSM-9799		54654076	InChI=1S/C26H28F3N3O6/c1-32-20-8-7-18(12-23(33)30-14-26(27,28)29)38-22(20)13-37-21-9-6-16(11-19(21)25(32)35)31-24(34)15-4-3-5-17(10-15)36-2/h3-6,9-11,18,20,22H,7-8,12-14H2,1-2H3,(H,30,33)(H,31,34)/t18-,20+,22-/m0/s1	RKECGHSSKXUWCJ-DWLFOUALSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@@H]4O[C@H](CC(=O)NCC(F)(F)F)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K22608272	BRD-K22608272-001-01-8	Broad Institute of MIT and Harvard	BRD-K22608272			COc1cccc(c1)C(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCC(F)(F)F)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C26H28F3N3O6/c1-32-20-8-7-18(12-23(33)30-14-26(27,28)29)38-22(20)13-37-21-9-6-16(11-19(21)25(32)35)31-24(34)15-4-3-5-17(10-15)36-2/h3-6,9-11,18,20,22H,7-8,12-14H2,1-2H3,(H,30,33)(H,31,34)/t18-,20+,22-/m0/s1	RKECGHSSKXUWCJ-DWLFOUALSA-N	535.193020246							98420
BRD-K01800462	LSM-8547		54654122	InChI=1S/C25H28FN3O6/c1-29-20-9-8-18(12-23(30)27-16-5-3-15(26)4-6-16)35-22(20)13-34-21-10-7-17(11-19(21)25(29)32)28-24(31)14-33-2/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,27,30)(H,28,31)/t18-,20+,22-/m1/s1	SISNYLBWEAESFQ-KAGYGMCKSA-N	COCC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4ccc(F)cc4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K01800462	BRD-K01800462-001-02-4	Broad Institute of MIT and Harvard	BRD-K01800462			COCC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)Nc4ccc(F)cc4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C25H28FN3O6/c1-29-20-9-8-18(12-23(30)27-16-5-3-15(26)4-6-16)35-22(20)13-34-21-10-7-17(11-19(21)25(29)32)28-24(31)14-33-2/h3-7,10-11,18,20,22H,8-9,12-14H2,1-2H3,(H,27,30)(H,28,31)/t18-,20+,22-/m1/s1	SISNYLBWEAESFQ-KAGYGMCKSA-N	485.196213846							97168
BRD-K56553629	LSM-11847		54654157	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20-,22+/m1/s1	MBWHXZFHLNKYMT-ZNLUXHQJSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)c5cscn5)cc4C(=O)N3C)O2	BroadT	BRD-K56553629	BRD-K56553629-001-01-5	Broad Institute of MIT and Harvard	BRD-K56553629			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4cscn4)cc3C(=O)N2C)O1	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20-,22+/m1/s1	MBWHXZFHLNKYMT-ZNLUXHQJSA-N	513.204589832							100473
BRD-K43325273	LSM-11062		54654062	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18-,20-/m0/s1	CDAYNQARGBNMSE-QRFRQXIXSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K43325273	BRD-K43325273-001-01-3	Broad Institute of MIT and Harvard	BRD-K43325273			CN(C)CCCNC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NS(C)(=O)=O)cc3C(=O)N2C)O1	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18-,20-/m0/s1	CDAYNQARGBNMSE-QRFRQXIXSA-N	482.219905538							99683
BRD-K00611064	LSM-8474		54654043	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18-,20-/m1/s1	SDVZNQMNQVCLRJ-YVWKXTFCSA-N	CN1[C@@H]2CC[C@H](CC(=O)O)O[C@@H]2COc3ccc(NC(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K00611064	BRD-K00611064-001-01-0	Broad Institute of MIT and Harvard	BRD-K00611064			CN1[C@@H]2CC[C@H](CC(O)=O)O[C@@H]2COc2ccc(NC(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18-,20-/m1/s1	SDVZNQMNQVCLRJ-YVWKXTFCSA-N	458.124464186							97095
BRD-K67402106	LSM-12533		54654174	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23-,25-/m0/s1	DZYZVJKKUJSUJU-RSEQLOHWSA-N	COc1cccc(CNC(=O)C[C@@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K67402106	BRD-K67402106-001-01-4	Broad Institute of MIT and Harvard	BRD-K67402106			COc1cccc(CNC(=O)C[C@@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23-,25-/m0/s1	DZYZVJKKUJSUJU-RSEQLOHWSA-N	549.193356432							101164
BRD-K61387428	LSM-12146		54654021	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18+,20+/m0/s1	RXPZKEATMSRBBD-ILZDJORESA-N	CN1[C@@H]2CC[C@@H](CC(=O)O)O[C@@H]2COc3ccc(NS(=O)(=O)c4ccccc4C)cc3C1=O	BroadT	BRD-K61387428	BRD-K61387428-001-01-4	Broad Institute of MIT and Harvard	BRD-K61387428			CN1[C@@H]2CC[C@@H](CC(O)=O)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccccc3C)cc2C1=O	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18+,20+/m0/s1	RXPZKEATMSRBBD-ILZDJORESA-N	474.146071882							100772
BRD-K61045941	LSM-12122		54654144	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25-,27+/m0/s1	TUUZOQPHVDGSNW-RIACCQAKSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc4ccc(NS(=O)(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K61045941	BRD-K61045941-001-01-6	Broad Institute of MIT and Harvard	BRD-K61045941			CN1[C@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25-,27+/m0/s1	TUUZOQPHVDGSNW-RIACCQAKSA-N	588.241783834							100748
BRD-K87010644	LSM-13767		54654079	InChI=1S/C25H27N5O5/c1-27-23(31)12-18-8-9-20-22(35-18)14-34-21-10-7-17(11-19(21)24(32)30(20)2)29-25(33)28-16-5-3-15(13-26)4-6-16/h3-7,10-11,18,20,22H,8-9,12,14H2,1-2H3,(H,27,31)(H2,28,29,33)/t18-,20+,22-/m1/s1	WEQMSGPPXPWAGN-KAGYGMCKSA-N	CNC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Nc4ccc(cc4)C#N)cc3C(=O)N2C)O1	BroadT	BRD-K87010644	BRD-K87010644-001-02-8	Broad Institute of MIT and Harvard	BRD-K87010644			CNC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Nc4ccc(cc4)C#N)cc3C(=O)N2C)O1	InChI=1S/C25H27N5O5/c1-27-23(31)12-18-8-9-20-22(35-18)14-34-21-10-7-17(11-19(21)24(32)30(20)2)29-25(33)28-16-5-3-15(13-26)4-6-16/h3-7,10-11,18,20,22H,8-9,12,14H2,1-2H3,(H,27,31)(H2,28,29,33)/t18-,20+,22-/m1/s1	WEQMSGPPXPWAGN-KAGYGMCKSA-N	477.201219014							102416
BRD-K89520577	LSM-13946		54654049	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18+,20-/m0/s1	SDVZNQMNQVCLRJ-HQRMLTQVSA-N	CN1[C@@H]2CC[C@@H](CC(=O)O)O[C@H]2COc3ccc(NC(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K89520577	BRD-K89520577-001-01-7	Broad Institute of MIT and Harvard	BRD-K89520577			CN1[C@@H]2CC[C@@H](CC(O)=O)O[C@H]2COc2ccc(NC(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18+,20-/m0/s1	SDVZNQMNQVCLRJ-HQRMLTQVSA-N	458.124464186							102599
BRD-K46661156	LSM-11276		54654267	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26+,28-/m0/s1	UIBIEJVTTJAUBZ-XZPWIQQXSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K46661156	BRD-K46661156-001-01-0	Broad Institute of MIT and Harvard	BRD-K46661156			C[C@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26+,28-/m0/s1	UIBIEJVTTJAUBZ-XZPWIQQXSA-N	597.170034174							99897
BRD-K84336022	LSM-13584		54654161	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20+,22-/m1/s1	MBWHXZFHLNKYMT-PIPMEXSNSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5cscn5)cc4C(=O)N3C)O2	BroadT	BRD-K84336022	BRD-K84336022-001-01-4	Broad Institute of MIT and Harvard	BRD-K84336022			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4cscn4)cc3C(=O)N2C)O1	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20+,22-/m1/s1	MBWHXZFHLNKYMT-PIPMEXSNSA-N	513.204589832							102228
BRD-K09557852	LSM-9012		54653984	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25+,27+/m1/s1	KLEFMXRWIUTPPC-UDZXTKBFSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NC(=O)Nc5ccccc5F)cc4C1=O	BroadT	BRD-K09557852	BRD-K09557852-001-01-2	Broad Institute of MIT and Harvard	BRD-K09557852			CN1[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NC(=O)Nc3ccccc3F)cc2C1=O	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25+,27+/m1/s1	KLEFMXRWIUTPPC-UDZXTKBFSA-N	561.238747374							97633
BRD-K50230035	LSM-11487		54654001	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19+,21+/m1/s1	RRCKKFPVDDPSKT-LMNJBCLMSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N4CCN(C)CC4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K50230035	BRD-K50230035-001-01-4	Broad Institute of MIT and Harvard	BRD-K50230035			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@@H](CC(=O)N4CCN(C)CC4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19+,21+/m1/s1	RRCKKFPVDDPSKT-LMNJBCLMSA-N	494.219905538							100108
BRD-K17883815	LSM-9502		54654160	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20+,22-/m0/s1	MBWHXZFHLNKYMT-WEYGHZABSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)c5cscn5)cc4C(=O)N3C)O2	BroadT	BRD-K17883815	BRD-K17883815-001-01-8	Broad Institute of MIT and Harvard	BRD-K17883815			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4cscn4)cc3C(=O)N2C)O1	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20+,22-/m0/s1	MBWHXZFHLNKYMT-WEYGHZABSA-N	513.204589832							98123
BRD-K13960684	LSM-9272		54654074	InChI=1S/C26H28F3N3O6/c1-32-20-8-7-18(12-23(33)30-14-26(27,28)29)38-22(20)13-37-21-9-6-16(11-19(21)25(32)35)31-24(34)15-4-3-5-17(10-15)36-2/h3-6,9-11,18,20,22H,7-8,12-14H2,1-2H3,(H,30,33)(H,31,34)/t18-,20-,22-/m0/s1	RKECGHSSKXUWCJ-VCOUNFBDSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@@H]4O[C@H](CC(=O)NCC(F)(F)F)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K13960684	BRD-K13960684-001-01-6	Broad Institute of MIT and Harvard	BRD-K13960684			COc1cccc(c1)C(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCC(F)(F)F)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C26H28F3N3O6/c1-32-20-8-7-18(12-23(33)30-14-26(27,28)29)38-22(20)13-37-21-9-6-16(11-19(21)25(32)35)31-24(34)15-4-3-5-17(10-15)36-2/h3-6,9-11,18,20,22H,7-8,12-14H2,1-2H3,(H,30,33)(H,31,34)/t18-,20-,22-/m0/s1	RKECGHSSKXUWCJ-VCOUNFBDSA-N	535.193020246							97893
BRD-K96636466	LSM-14361		54654010	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24-,26-/m1/s1	VRPVHEJOGHTQDQ-QIGHUWCUSA-N	COc1cccc(NC(=O)C[C@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K96636466	BRD-K96636466-001-01-6	Broad Institute of MIT and Harvard	BRD-K96636466			COc1cccc(NC(=O)C[C@H]2CC[C@@H]3[C@@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24-,26-/m1/s1	VRPVHEJOGHTQDQ-QIGHUWCUSA-N	537.24750049							103015
CHEMBL3182377	LSM-9711	BRD-K21082546	54654086	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20-,22-/m1/s1	IFOOEWPAOUEVPY-SYYKKAFVSA-N	CN1[C@@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccs5)cc4C1=O	BroadT	BRD-K21082546	BRD-K21082546-001-01-7	Broad Institute of MIT and Harvard	BRD-K21082546			CN1[C@@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccs3)cc2C1=O	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20-,22-/m1/s1	IFOOEWPAOUEVPY-SYYKKAFVSA-N	497.198441812							98332
BRD-K09124072	LSM-8982		54654292	InChI=1S/C30H35N5O5/c1-34-25-9-8-23(17-28(36)32-11-14-35-12-2-3-13-35)40-27(25)19-39-26-10-7-22(16-24(26)30(34)38)33-29(37)21-6-4-5-20(15-21)18-31/h4-7,10,15-16,23,25,27H,2-3,8-9,11-14,17,19H2,1H3,(H,32,36)(H,33,37)/t23-,25+,27-/m1/s1	BJZSGQQIPOLCTA-NRRYGQPISA-N	CN1[C@H]2CC[C@H](CC(=O)NCCN3CCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccc(c5)C#N)cc4C1=O	BroadT	BRD-K09124072	BRD-K09124072-001-02-3	Broad Institute of MIT and Harvard	BRD-K09124072			CN1[C@H]2CC[C@H](CC(=O)NCCN3CCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccc(c3)C#N)cc2C1=O	InChI=1S/C30H35N5O5/c1-34-25-9-8-23(17-28(36)32-11-14-35-12-2-3-13-35)40-27(25)19-39-26-10-7-22(16-24(26)30(34)38)33-29(37)21-6-4-5-20(15-21)18-31/h4-7,10,15-16,23,25,27H,2-3,8-9,11-14,17,19H2,1H3,(H,32,36)(H,33,37)/t23-,25+,27-/m1/s1	BJZSGQQIPOLCTA-NRRYGQPISA-N	545.26381927							97603
BRD-K35193027	LSM-10545		54654022	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18-,20+/m0/s1	RXPZKEATMSRBBD-XKGZKEIXSA-N	CN1[C@H]2CC[C@@H](CC(=O)O)O[C@@H]2COc3ccc(NS(=O)(=O)c4ccccc4C)cc3C1=O	BroadT	BRD-K35193027	BRD-K35193027-001-01-4	Broad Institute of MIT and Harvard	BRD-K35193027			CN1[C@H]2CC[C@@H](CC(O)=O)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccccc3C)cc2C1=O	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18-,20+/m0/s1	RXPZKEATMSRBBD-XKGZKEIXSA-N	474.146071882							99166
BRD-K16117792	LSM-9399		54654164	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19+,21-/m0/s1	RQAOUBOGQGVTCU-DSKINZAPSA-N	CNC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	BroadT	BRD-K16117792	BRD-K16117792-001-01-9	Broad Institute of MIT and Harvard	BRD-K16117792			CNC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19+,21-/m0/s1	RQAOUBOGQGVTCU-DSKINZAPSA-N	473.17622733							98020
BRD-K62993927	LSM-12260		54654138	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25+,27-/m0/s1	TUUZOQPHVDGSNW-RWUBSVTLSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc4ccc(NS(=O)(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K62993927	BRD-K62993927-001-01-4	Broad Institute of MIT and Harvard	BRD-K62993927			CN1[C@@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25+,27-/m0/s1	TUUZOQPHVDGSNW-RWUBSVTLSA-N	588.241783834							100886
BRD-K87377799	LSM-13789		54654034	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21-,23-/m1/s1	IOGMTQBPALZMTJ-KJXAQDMKSA-N	CN(C)C(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K87377799	BRD-K87377799-001-01-6	Broad Institute of MIT and Harvard	BRD-K87377799			CN(C)C(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21-,23-/m1/s1	IOGMTQBPALZMTJ-KJXAQDMKSA-N	480.237270164							102438
BRD-K19520352	LSM-9605		54654136	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21-,23+/m1/s1	OPKRVFTXMKZUJR-LSWJPFSZSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCC3CC3)O[C@H]2COc4ccc(NC(=O)NC5CCCC5)cc4C1=O	BroadT	BRD-K19520352	BRD-K19520352-001-01-3	Broad Institute of MIT and Harvard	BRD-K19520352			CN1[C@@H]2CC[C@H](CC(=O)NCC3CC3)O[C@H]2COc2ccc(NC(=O)NC3CCCC3)cc2C1=O	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21-,23+/m1/s1	OPKRVFTXMKZUJR-LSWJPFSZSA-N	484.268570292							98226
BRD-K90842913	LSM-14019		54654182	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23-,25-/m0/s1	HUCZTLCWVGQLCW-RSEQLOHWSA-N	COCC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N4CCc5ccccc5C4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K90842913	BRD-K90842913-001-01-5	Broad Institute of MIT and Harvard	BRD-K90842913			COCC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N4CCc5ccccc5C4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23-,25-/m0/s1	HUCZTLCWVGQLCW-RSEQLOHWSA-N	507.236935806							102672
BRD-K87252271	LSM-13777		54654123	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26-,28-/m0/s1	KPGMTKVYFCJESC-WSHBGFIESA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C1=O	BroadT	BRD-K87252271	BRD-K87252271-001-01-8	Broad Institute of MIT and Harvard	BRD-K87252271			CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26-,28-/m0/s1	KPGMTKVYFCJESC-WSHBGFIESA-N	578.219905538							102426
BRD-K36671358	LSM-10645		54654205	InChI=1S/C31H35N3O7S/c1-20-8-12-24(13-9-20)42(37,38)33-22-10-15-28-25(16-22)31(36)34(2)26-14-11-23(41-29(26)19-40-28)17-30(35)32-18-21-6-4-5-7-27(21)39-3/h4-10,12-13,15-16,23,26,29,33H,11,14,17-19H2,1-3H3,(H,32,35)/t23-,26+,29-/m0/s1	GYVRMNXHBKDJFJ-LBGGBARHSA-N	COc1ccccc1CNC(=O)C[C@@H]2CC[C@@H]3[C@H](COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C(=O)N3C)O2	BroadT	BRD-K36671358	BRD-K36671358-001-01-7	Broad Institute of MIT and Harvard	BRD-K36671358			COc1ccccc1CNC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C(=O)N2C)O1	InChI=1S/C31H35N3O7S/c1-20-8-12-24(13-9-20)42(37,38)33-22-10-15-28-25(16-22)31(36)34(2)26-14-11-23(41-29(26)19-40-28)17-30(35)32-18-21-6-4-5-7-27(21)39-3/h4-10,12-13,15-16,23,26,29,33H,11,14,17-19H2,1-3H3,(H,32,35)/t23-,26+,29-/m0/s1	GYVRMNXHBKDJFJ-LBGGBARHSA-N	593.21957118							99266
BRD-K01922500	LSM-8550		54654240	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27-,29-/m1/s1	JZQJXXSKGFWMTL-GCMXZSHTSA-N	CN1[C@@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K01922500	BRD-K01922500-001-01-2	Broad Institute of MIT and Harvard	BRD-K01922500			CN1[C@@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27-,29-/m1/s1	JZQJXXSKGFWMTL-GCMXZSHTSA-N	616.30093306							97171
BRD-K03413212	LSM-8644		54654180	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23-,25+/m0/s1	HUCZTLCWVGQLCW-UMXIMWEHSA-N	COCC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N4CCc5ccccc5C4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K03413212	BRD-K03413212-001-01-9	Broad Institute of MIT and Harvard	BRD-K03413212			COCC(=O)Nc1ccc2OC[C@H]3O[C@H](CC(=O)N4CCc5ccccc5C4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23-,25+/m0/s1	HUCZTLCWVGQLCW-UMXIMWEHSA-N	507.236935806							97265
BRD-K77804886	LSM-13186		54654217	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16-,18-/m0/s1	WVVDCAKHEAPTNY-ZVZYQTTQSA-N	CCNC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K77804886	BRD-K77804886-001-01-5	Broad Institute of MIT and Harvard	BRD-K77804886			CCNC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NC(C)=O)cc3C(=O)N2C)O1	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16-,18-/m0/s1	WVVDCAKHEAPTNY-ZVZYQTTQSA-N	389.195070994							101824
BRD-K16980601	LSM-9459		54654112	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25+,27+/m0/s1	CEZHWMAQWNYMAY-GEWUYGHSSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccccc3F)O[C@@H]2COc4ccc(NC(=O)C5CCCCC5)cc4C1=O	BroadT	BRD-K16980601	BRD-K16980601-001-01-1	Broad Institute of MIT and Harvard	BRD-K16980601			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccccc3F)O[C@@H]2COc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25+,27+/m0/s1	CEZHWMAQWNYMAY-GEWUYGHSSA-N	537.263899482							98080
BRD-K40121369	LSM-10876		54654257	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23+,25+/m1/s1	LLFGMIFPADLUOD-PBXXJUDPSA-N	CN1[C@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K40121369	BRD-K40121369-001-01-4	Broad Institute of MIT and Harvard	BRD-K40121369			CN1[C@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23+,25+/m1/s1	LLFGMIFPADLUOD-PBXXJUDPSA-N	535.22309731							99497
BRD-K00812396	LSM-8485		54654042	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26+,28-/m1/s1	SECMWWJMRQEFAV-RXWNPYQGSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccccc3Cl)O[C@@H]2COc4ccc(NC(=O)Nc5cccc(C)c5)cc4C1=O	BroadT	BRD-K00812396	BRD-K00812396-001-02-1	Broad Institute of MIT and Harvard	BRD-K00812396			CN1[C@H]2CC[C@H](CC(=O)NCc3ccccc3Cl)O[C@@H]2COc2ccc(NC(=O)Nc3cccc(C)c3)cc2C1=O	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26+,28-/m1/s1	SECMWWJMRQEFAV-RXWNPYQGSA-N	576.213947906							97106
BRD-K71104315	LSM-12771		54654067	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19+,21+/m1/s1	QOIMCQVGUSYUFV-PBEJRMEISA-N	COC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	BroadT	BRD-K71104315	BRD-K71104315-001-01-7	Broad Institute of MIT and Harvard	BRD-K71104315			COC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)N2C)O1	InChI=1S/C23H25FN2O7S/c1-26-19-9-6-16(12-22(27)31-2)33-21(19)13-32-20-10-5-15(11-18(20)23(26)28)25-34(29,30)17-7-3-14(24)4-8-17/h3-5,7-8,10-11,16,19,21,25H,6,9,12-13H2,1-2H3/t16-,19+,21+/m1/s1	QOIMCQVGUSYUFV-PBEJRMEISA-N	492.13665005							101408
BRD-K56593673	LSM-11850		54654077	InChI=1S/C26H28F3N3O6/c1-32-20-8-7-18(12-23(33)30-14-26(27,28)29)38-22(20)13-37-21-9-6-16(11-19(21)25(32)35)31-24(34)15-4-3-5-17(10-15)36-2/h3-6,9-11,18,20,22H,7-8,12-14H2,1-2H3,(H,30,33)(H,31,34)/t18-,20-,22-/m1/s1	RKECGHSSKXUWCJ-SYYKKAFVSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)NCC(F)(F)F)CC[C@H]4N(C)C(=O)c3c2	BroadT	BRD-K56593673	BRD-K56593673-001-01-6	Broad Institute of MIT and Harvard	BRD-K56593673			COc1cccc(c1)C(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCC(F)(F)F)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C26H28F3N3O6/c1-32-20-8-7-18(12-23(33)30-14-26(27,28)29)38-22(20)13-37-21-9-6-16(11-19(21)25(32)35)31-24(34)15-4-3-5-17(10-15)36-2/h3-6,9-11,18,20,22H,7-8,12-14H2,1-2H3,(H,30,33)(H,31,34)/t18-,20-,22-/m1/s1	RKECGHSSKXUWCJ-SYYKKAFVSA-N	535.193020246							100476
BRD-K63964021	LSM-12333		54654053	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24-,28-/m1/s1	GPWYEVCXUJXIOI-ZQSLEGLSSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc5ccc(NC(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K63964021	BRD-K63964021-001-01-9	Broad Institute of MIT and Harvard	BRD-K63964021			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc2ccc(NC(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24-,28-/m1/s1	GPWYEVCXUJXIOI-ZQSLEGLSSA-N	575.20677853							100960
BRD-K58282082	LSM-11945		54654006	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24-,26+/m0/s1	VRPVHEJOGHTQDQ-LLZJGCNPSA-N	COc1cccc(NC(=O)C[C@@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K58282082	BRD-K58282082-001-01-9	Broad Institute of MIT and Harvard	BRD-K58282082			COc1cccc(NC(=O)C[C@@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24-,26+/m0/s1	VRPVHEJOGHTQDQ-LLZJGCNPSA-N	537.24750049							100571
BRD-K86448961	LSM-13723		54654050	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18+,20-/m1/s1	SDVZNQMNQVCLRJ-IMFGXOCKSA-N	CN1[C@H]2CC[C@H](CC(=O)O)O[C@@H]2COc3ccc(NC(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K86448961	BRD-K86448961-001-02-6	Broad Institute of MIT and Harvard	BRD-K86448961			CN1[C@H]2CC[C@H](CC(O)=O)O[C@@H]2COc2ccc(NC(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18+,20-/m1/s1	SDVZNQMNQVCLRJ-IMFGXOCKSA-N	458.124464186							102372
MLS004342538	LSM-12120	BRD-K61004012	54654179	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23+,25-/m1/s1	DZYZVJKKUJSUJU-NMVJMZGASA-N	COc1cccc(CNC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K61004012	BRD-K61004012-001-02-5	Broad Institute of MIT and Harvard	BRD-K61004012			COc1cccc(CNC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23+,25-/m1/s1	DZYZVJKKUJSUJU-NMVJMZGASA-N	549.193356432							100746
BRD-K43931839	LSM-11109		54654137	InChI=1S/C32H37N5O6/c1-18-30(19(2)43-36-18)35-32(40)34-23-10-13-27-25(15-23)31(39)37(3)26-12-11-24(42-28(26)17-41-27)16-29(38)33-22-9-8-20-6-4-5-7-21(20)14-22/h8-10,13-15,24,26,28H,4-7,11-12,16-17H2,1-3H3,(H,33,38)(H2,34,35,40)/t24-,26+,28-/m1/s1	PMBFMNXVRNVJKX-MAARLIENSA-N	CN1[C@H]2CC[C@H](CC(=O)Nc3ccc4CCCCc4c3)O[C@@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K43931839	BRD-K43931839-001-02-3	Broad Institute of MIT and Harvard	BRD-K43931839			CN1[C@H]2CC[C@H](CC(=O)Nc3ccc4CCCCc4c3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C32H37N5O6/c1-18-30(19(2)43-36-18)35-32(40)34-23-10-13-27-25(15-23)31(39)37(3)26-12-11-24(42-28(26)17-41-27)16-29(38)33-22-9-8-20-6-4-5-7-21(20)14-22/h8-10,13-15,24,26,28H,4-7,11-12,16-17H2,1-3H3,(H,33,38)(H2,34,35,40)/t24-,26+,28-/m1/s1	PMBFMNXVRNVJKX-MAARLIENSA-N	587.274383954							99730
BRD-K19204484	LSM-9583		54654191	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25+,27+/m1/s1	XIGYLWQKLZSYNZ-NIYJGHKDSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc4ccc(NC(=O)Nc5ccc(Cl)cc5)cc4C1=O	BroadT	BRD-K19204484	BRD-K19204484-001-01-5	Broad Institute of MIT and Harvard	BRD-K19204484			CN1[C@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2C1=O	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25+,27+/m1/s1	XIGYLWQKLZSYNZ-NIYJGHKDSA-N	583.256147076							98204
BRD-K62265198	LSM-12210		54654265	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26+,28+/m1/s1	UIBIEJVTTJAUBZ-LCBFVJPYSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K62265198	BRD-K62265198-001-01-9	Broad Institute of MIT and Harvard	BRD-K62265198			C[C@@H](NC(=O)C[C@@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26+,28+/m1/s1	UIBIEJVTTJAUBZ-LCBFVJPYSA-N	597.170034174							100836
BRD-K80998388	LSM-13385		54653988	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25+,27-/m1/s1	KLEFMXRWIUTPPC-NKPLSRDGSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NC(=O)Nc5ccccc5F)cc4C1=O	BroadT	BRD-K80998388	BRD-K80998388-001-01-3	Broad Institute of MIT and Harvard	BRD-K80998388			CN1[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3F)cc2C1=O	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25+,27-/m1/s1	KLEFMXRWIUTPPC-NKPLSRDGSA-N	561.238747374							102024
BRD-K14346766	LSM-9294		54653978	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24+,26+/m0/s1	CJRLOTNMWBMMLN-BBVWWWHTSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc4ccc(NC(=O)Cc5cccs5)cc4C1=O	BroadT	BRD-K14346766	BRD-K14346766-001-01-8	Broad Institute of MIT and Harvard	BRD-K14346766			CN1[C@@H]2CC[C@@H](CC(=O)NCCCN3CCOCC3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C29H38N4O6S/c1-32-24-7-6-21(17-27(34)30-9-3-10-33-11-13-37-14-12-33)39-26(24)19-38-25-8-5-20(16-23(25)29(32)36)31-28(35)18-22-4-2-15-40-22/h2,4-5,8,15-16,21,24,26H,3,6-7,9-14,17-19H2,1H3,(H,30,34)(H,31,35)/t21-,24+,26+/m0/s1	CJRLOTNMWBMMLN-BBVWWWHTSA-N	570.251205666							97915
BRD-K46447740	LSM-11265		54654280	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22+,24-/m0/s1	RISZPRWRWDPXQV-ANJVHQHFSA-N	CN1[C@@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@H]2COc4ccc(NC(=O)c5ccc(F)c(F)c5)cc4C1=O	BroadT	BRD-K46447740	BRD-K46447740-001-01-7	Broad Institute of MIT and Harvard	BRD-K46447740			CN1[C@@H]2CC[C@@H](CC(=O)N3CCOCC3)O[C@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22+,24-/m0/s1	RISZPRWRWDPXQV-ANJVHQHFSA-N	529.202442078							99886
BRD-K45887240	LSM-11224		54654025	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18+,20-/m0/s1	RXPZKEATMSRBBD-HQRMLTQVSA-N	CN1[C@@H]2CC[C@@H](CC(=O)O)O[C@H]2COc3ccc(NS(=O)(=O)c4ccccc4C)cc3C1=O	BroadT	BRD-K45887240	BRD-K45887240-001-01-0	Broad Institute of MIT and Harvard	BRD-K45887240			CN1[C@@H]2CC[C@@H](CC(O)=O)O[C@H]2COc2ccc(NS(=O)(=O)c3ccccc3C)cc2C1=O	InChI=1S/C23H26N2O7S/c1-14-5-3-4-6-21(14)33(29,30)24-15-7-10-19-17(11-15)23(28)25(2)18-9-8-16(12-22(26)27)32-20(18)13-31-19/h3-7,10-11,16,18,20,24H,8-9,12-13H2,1-2H3,(H,26,27)/t16-,18+,20-/m0/s1	RXPZKEATMSRBBD-HQRMLTQVSA-N	474.146071882							99845
BRD-K20441249	LSM-9676		54653995	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19+,21-/m0/s1	RRCKKFPVDDPSKT-DSKINZAPSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N4CCN(C)CC4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K20441249	BRD-K20441249-001-01-6	Broad Institute of MIT and Harvard	BRD-K20441249			CCS(=O)(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N4CCN(C)CC4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19+,21-/m0/s1	RRCKKFPVDDPSKT-DSKINZAPSA-N	494.219905538							98297
BRD-K23414424	LSM-9840		54654186	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23+,25-/m1/s1	HUCZTLCWVGQLCW-NMVJMZGASA-N	COCC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N4CCc5ccccc5C4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K23414424	BRD-K23414424-001-01-7	Broad Institute of MIT and Harvard	BRD-K23414424			COCC(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N4CCc5ccccc5C4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23+,25-/m1/s1	HUCZTLCWVGQLCW-NMVJMZGASA-N	507.236935806							98461
BRD-K47002284	LSM-11294		54654228	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27-,29+/m0/s1	ZIFILFAABSOBLR-JPZGVGIDSA-N	CN1[C@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COc5ccc(NS(=O)(=O)c6cccc(F)c6)cc5C1=O	BroadT	BRD-K47002284	BRD-K47002284-001-01-1	Broad Institute of MIT and Harvard	BRD-K47002284			CN1[C@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27-,29+/m0/s1	ZIFILFAABSOBLR-JPZGVGIDSA-N	593.199584664							99915
BRD-K87507139	LSM-13795		54654185	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23+,25-/m0/s1	HUCZTLCWVGQLCW-PWWKTKHKSA-N	COCC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N4CCc5ccccc5C4)CC[C@H]3N(C)C(=O)c2c1	BroadT	BRD-K87507139	BRD-K87507139-001-01-7	Broad Institute of MIT and Harvard	BRD-K87507139			COCC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)N4CCc5ccccc5C4)CC[C@H]3N(C)C(=O)c2c1	InChI=1S/C28H33N3O6/c1-30-23-9-8-21(14-27(33)31-12-11-18-5-3-4-6-19(18)15-31)37-25(23)16-36-24-10-7-20(13-22(24)28(30)34)29-26(32)17-35-2/h3-7,10,13,21,23,25H,8-9,11-12,14-17H2,1-2H3,(H,29,32)/t21-,23+,25-/m0/s1	HUCZTLCWVGQLCW-PWWKTKHKSA-N	507.236935806							102444
BRD-K62689646	LSM-12234		54654158	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20+,22+/m1/s1	MBWHXZFHLNKYMT-AGHHOFFYSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)c5cscn5)cc4C(=O)N3C)O2	BroadT	BRD-K62689646	BRD-K62689646-001-01-8	Broad Institute of MIT and Harvard	BRD-K62689646			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4cscn4)cc3C(=O)N2C)O1	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20+,22+/m1/s1	MBWHXZFHLNKYMT-AGHHOFFYSA-N	513.204589832							100860
CHEMBL2354316	LSM-14267	BRD-K95269843, SID131450537	54654115	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22-,24-/m0/s1	BYJFOJVMGKORHN-SSPYTLHUSA-N	CCCC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCc4cccc(F)c4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K95269843	BRD-K95269843-001-01-1	Broad Institute of MIT and Harvard	BRD-K95269843			CCCC(=O)Nc1ccc2OC[C@@H]3O[C@H](CC(=O)NCc4cccc(F)c4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C27H32FN3O5/c1-3-5-25(32)30-19-8-11-23-21(13-19)27(34)31(2)22-10-9-20(36-24(22)16-35-23)14-26(33)29-15-17-6-4-7-18(28)12-17/h4,6-8,11-13,20,22,24H,3,5,9-10,14-16H2,1-2H3,(H,29,33)(H,30,32)/t20-,22-,24-/m0/s1	BYJFOJVMGKORHN-SSPYTLHUSA-N	497.232599354							102921
BRD-K60667054	LSM-12094		54654273	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26-,28+/m1/s1	UIBIEJVTTJAUBZ-BXQNBQJFSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K60667054	BRD-K60667054-001-01-1	Broad Institute of MIT and Harvard	BRD-K60667054			C[C@@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26-,28+/m1/s1	UIBIEJVTTJAUBZ-BXQNBQJFSA-N	597.170034174							100720
BRD-K36446300	LSM-10629		54654097	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22+,24-/m1/s1	CUJGJHGFROPBKV-JCTONOIOSA-N	COCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K36446300	BRD-K36446300-001-02-1	Broad Institute of MIT and Harvard	BRD-K36446300			COCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)Cc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C27H33N3O6/c1-30-22-10-9-20(16-25(31)28-12-13-34-2)36-24(22)17-35-23-11-8-19(15-21(23)27(30)33)29-26(32)14-18-6-4-3-5-7-18/h3-8,11,15,20,22,24H,9-10,12-14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t20-,22+,24-/m1/s1	CUJGJHGFROPBKV-JCTONOIOSA-N	495.236935806							99250
BRD-K93339435	LSM-14153		54654274	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26-,28+/m0/s1	UIBIEJVTTJAUBZ-RGBPKTGBSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K93339435	BRD-K93339435-001-02-6	Broad Institute of MIT and Harvard	BRD-K93339435			C[C@H](NC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26-,28+/m0/s1	UIBIEJVTTJAUBZ-RGBPKTGBSA-N	597.170034174							102807
BRD-K53808186	LSM-11698		54654194	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25-,27-/m1/s1	XIGYLWQKLZSYNZ-DFZDUAMZSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc4ccc(NC(=O)Nc5ccc(Cl)cc5)cc4C1=O	BroadT	BRD-K53808186	BRD-K53808186-001-01-1	Broad Institute of MIT and Harvard	BRD-K53808186			CN1[C@@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2C1=O	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25-,27-/m1/s1	XIGYLWQKLZSYNZ-DFZDUAMZSA-N	583.256147076							100323
BRD-K31610599	LSM-10343		54654253	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23+,25-/m0/s1	LLFGMIFPADLUOD-ZWSUVBHBSA-N	CN1[C@@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K31610599	BRD-K31610599-001-01-9	Broad Institute of MIT and Harvard	BRD-K31610599			CN1[C@@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23+,25-/m0/s1	LLFGMIFPADLUOD-ZWSUVBHBSA-N	535.22309731							98964
BRD-K59983542	LSM-12055		54654283	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22+,24-/m1/s1	RISZPRWRWDPXQV-RVSNTGDXSA-N	CN1[C@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@@H]2COc4ccc(NC(=O)c5ccc(F)c(F)c5)cc4C1=O	BroadT	BRD-K59983542	BRD-K59983542-001-01-5	Broad Institute of MIT and Harvard	BRD-K59983542			CN1[C@H]2CC[C@H](CC(=O)N3CCOCC3)O[C@@H]2COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2C1=O	InChI=1S/C27H29F2N3O6/c1-31-22-6-4-18(14-25(33)32-8-10-36-11-9-32)38-24(22)15-37-23-7-3-17(13-19(23)27(31)35)30-26(34)16-2-5-20(28)21(29)12-16/h2-3,5,7,12-13,18,22,24H,4,6,8-11,14-15H2,1H3,(H,30,34)/t18-,22+,24-/m1/s1	RISZPRWRWDPXQV-RVSNTGDXSA-N	529.202442078							100681
BRD-K65124350	LSM-12403		54654193	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25-,27+/m0/s1	XIGYLWQKLZSYNZ-SCTDOJESSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc4ccc(NC(=O)Nc5ccc(Cl)cc5)cc4C1=O	BroadT	BRD-K65124350	BRD-K65124350-001-01-9	Broad Institute of MIT and Harvard	BRD-K65124350			CN1[C@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2C1=O	InChI=1S/C30H38ClN5O5/c1-35-25-11-10-23(18-28(37)32-13-16-36-14-3-2-4-15-36)41-27(25)19-40-26-12-9-22(17-24(26)29(35)38)34-30(39)33-21-7-5-20(31)6-8-21/h5-9,12,17,23,25,27H,2-4,10-11,13-16,18-19H2,1H3,(H,32,37)(H2,33,34,39)/t23-,25-,27+/m0/s1	XIGYLWQKLZSYNZ-SCTDOJESSA-N	583.256147076							101030
BRD-K55252655	LSM-11777		54654036	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26-,28+/m0/s1	SECMWWJMRQEFAV-PAUTXSKSSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccccc3Cl)O[C@@H]2COc4ccc(NC(=O)Nc5cccc(C)c5)cc4C1=O	BroadT	BRD-K55252655	BRD-K55252655-001-01-2	Broad Institute of MIT and Harvard	BRD-K55252655			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccccc3Cl)O[C@@H]2COc2ccc(NC(=O)Nc3cccc(C)c3)cc2C1=O	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26-,28+/m0/s1	SECMWWJMRQEFAV-PAUTXSKSSA-N	576.213947906							100402
BRD-K42216874	LSM-10992		54654037	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26+,28+/m0/s1	SECMWWJMRQEFAV-DANFDKMISA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccccc3Cl)O[C@@H]2COc4ccc(NC(=O)Nc5cccc(C)c5)cc4C1=O	BroadT	BRD-K42216874	BRD-K42216874-001-01-8	Broad Institute of MIT and Harvard	BRD-K42216874			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccccc3Cl)O[C@@H]2COc2ccc(NC(=O)Nc3cccc(C)c3)cc2C1=O	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26+,28+/m0/s1	SECMWWJMRQEFAV-DANFDKMISA-N	576.213947906							99613
BRD-K83365001	LSM-13522		54654124	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26+,28+/m1/s1	KPGMTKVYFCJESC-KHGZIGHDSA-N	CN1[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C1=O	BroadT	BRD-K83365001	BRD-K83365001-001-01-9	Broad Institute of MIT and Harvard	BRD-K83365001			CN1[C@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26+,28+/m1/s1	KPGMTKVYFCJESC-KHGZIGHDSA-N	578.219905538							102163
BRD-K72324716	LSM-12863		54654128	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26-,28+/m1/s1	KPGMTKVYFCJESC-RJRADHEHSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C1=O	BroadT	BRD-K72324716	BRD-K72324716-001-01-5	Broad Institute of MIT and Harvard	BRD-K72324716			CN1[C@@H]2CC[C@H](CC(=O)NCCc3ccncc3)O[C@H]2COc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26-,28+/m1/s1	KPGMTKVYFCJESC-RJRADHEHSA-N	578.219905538							101500
BRD-K13667629	LSM-9252		54654143	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25+,27+/m0/s1	TUUZOQPHVDGSNW-GEWUYGHSSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc4ccc(NS(=O)(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K13667629	BRD-K13667629-001-01-5	Broad Institute of MIT and Harvard	BRD-K13667629			CN1[C@@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25+,27+/m0/s1	TUUZOQPHVDGSNW-GEWUYGHSSA-N	588.241783834							97873
BRD-K08666983	LSM-8952		54654041	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26-,28-/m0/s1	SECMWWJMRQEFAV-WSHBGFIESA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccccc3Cl)O[C@H]2COc4ccc(NC(=O)Nc5cccc(C)c5)cc4C1=O	BroadT	BRD-K08666983	BRD-K08666983-001-01-4	Broad Institute of MIT and Harvard	BRD-K08666983			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccccc3Cl)O[C@H]2COc2ccc(NC(=O)Nc3cccc(C)c3)cc2C1=O	InChI=1S/C31H33ClN4O5/c1-19-6-5-8-21(14-19)34-31(39)35-22-10-13-27-24(15-22)30(38)36(2)26-12-11-23(41-28(26)18-40-27)16-29(37)33-17-20-7-3-4-9-25(20)32/h3-10,13-15,23,26,28H,11-12,16-18H2,1-2H3,(H,33,37)(H2,34,35,39)/t23-,26-,28-/m0/s1	SECMWWJMRQEFAV-WSHBGFIESA-N	576.213947906							97573
BRD-K46373821	LSM-11258		54654176	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23+,25+/m1/s1	DZYZVJKKUJSUJU-VTZPFEBOSA-N	COc1cccc(CNC(=O)C[C@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K46373821	BRD-K46373821-001-01-7	Broad Institute of MIT and Harvard	BRD-K46373821			COc1cccc(CNC(=O)C[C@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)c5cccs5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H31N3O6S/c1-32-23-10-9-21(15-27(33)30-16-18-5-3-6-20(13-18)36-2)38-25(23)17-37-24-11-8-19(14-22(24)29(32)35)31-28(34)26-7-4-12-39-26/h3-8,11-14,21,23,25H,9-10,15-17H2,1-2H3,(H,30,33)(H,31,34)/t21-,23+,25+/m1/s1	DZYZVJKKUJSUJU-VTZPFEBOSA-N	549.193356432							99879
BRD-K83980681	LSM-13560		54654011	InChI=1S/C28H30N4O7/c1-32-21-9-8-19(14-26(33)29-15-17-5-3-4-6-22(17)36-2)38-25(21)16-37-23-10-7-18(13-20(23)28(32)35)31-27(34)24-11-12-30-39-24/h3-7,10-13,19,21,25H,8-9,14-16H2,1-2H3,(H,29,33)(H,31,34)/t19-,21+,25-/m1/s1	NHAXNTZRJLBPPG-FZOAFFARSA-N	COc1ccccc1CNC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5oncc5)cc4C(=O)N3C)O2	BroadT	BRD-K83980681	BRD-K83980681-001-02-0	Broad Institute of MIT and Harvard	BRD-K83980681			COc1ccccc1CNC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4ccno4)cc3C(=O)N2C)O1	InChI=1S/C28H30N4O7/c1-32-21-9-8-19(14-26(33)29-15-17-5-3-4-6-22(17)36-2)38-25(21)16-37-23-10-7-18(13-20(23)28(32)35)31-27(34)24-11-12-30-39-24/h3-7,10-13,19,21,25H,8-9,14-16H2,1-2H3,(H,29,33)(H,31,34)/t19-,21+,25-/m1/s1	NHAXNTZRJLBPPG-FZOAFFARSA-N	534.21144934							102202
BRD-K70875408	LSM-12758		54654159	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20-,22+/m0/s1	MBWHXZFHLNKYMT-RBDMOPTHSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)c5cscn5)cc4C(=O)N3C)O2	BroadT	BRD-K70875408	BRD-K70875408-001-01-1	Broad Institute of MIT and Harvard	BRD-K70875408			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4cscn4)cc3C(=O)N2C)O1	InChI=1S/C25H31N5O5S/c1-28-7-9-30(10-8-28)23(31)12-17-4-5-20-22(35-17)13-34-21-6-3-16(11-18(21)25(33)29(20)2)27-24(32)19-14-36-15-26-19/h3,6,11,14-15,17,20,22H,4-5,7-10,12-13H2,1-2H3,(H,27,32)/t17-,20-,22+/m0/s1	MBWHXZFHLNKYMT-RBDMOPTHSA-N	513.204589832							101395
BRD-K76379937	LSM-13101		54654231	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27-,29+/m0/s1	JZQJXXSKGFWMTL-SEGPTPNXSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K76379937	BRD-K76379937-001-01-8	Broad Institute of MIT and Harvard	BRD-K76379937			CN1[C@H]2CC[C@@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27-,29+/m0/s1	JZQJXXSKGFWMTL-SEGPTPNXSA-N	616.30093306							101739
CHEMBL2360619	LSM-11991	SID131450624, BRD-K58980886	54654202	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30+,32-/m0/s1	DRCDGYYITPZHEH-KUYURNMDSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K58980886	BRD-K58980886-001-01-6	Broad Institute of MIT and Harvard	BRD-K58980886			CN1[C@@H]2CC[C@@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30+,32-/m0/s1	DRCDGYYITPZHEH-KUYURNMDSA-N	609.22974194							100617
BRD-K14417684	LSM-9302		54654134	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21-,23-/m0/s1	OPKRVFTXMKZUJR-RRPUWOKSSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCC3CC3)O[C@H]2COc4ccc(NC(=O)NC5CCCC5)cc4C1=O	BroadT	BRD-K14417684	BRD-K14417684-001-01-6	Broad Institute of MIT and Harvard	BRD-K14417684			CN1[C@H]2CC[C@@H](CC(=O)NCC3CC3)O[C@H]2COc2ccc(NC(=O)NC3CCCC3)cc2C1=O	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21-,23-/m0/s1	OPKRVFTXMKZUJR-RRPUWOKSSA-N	484.268570292							97923
BRD-K74582039	LSM-12997		54654269	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26+,28+/m0/s1	UIBIEJVTTJAUBZ-RCTOPIGZSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K74582039	BRD-K74582039-001-01-6	Broad Institute of MIT and Harvard	BRD-K74582039			C[C@H](NC(=O)C[C@@H]1CC[C@@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26+,28+/m0/s1	UIBIEJVTTJAUBZ-RCTOPIGZSA-N	597.170034174							101634
BRD-K03679890	LSM-8658		54654028	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21-,23+/m0/s1	IOGMTQBPALZMTJ-IEIRFRATSA-N	CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	BroadT	BRD-K03679890	BRD-K03679890-001-01-4	Broad Institute of MIT and Harvard	BRD-K03679890			CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)NCc4ccccc4)cc3C(=O)N2C)O1	InChI=1S/C26H32N4O5/c1-29(2)24(31)14-19-10-11-21-23(35-19)16-34-22-12-9-18(13-20(22)25(32)30(21)3)28-26(33)27-15-17-7-5-4-6-8-17/h4-9,12-13,19,21,23H,10-11,14-16H2,1-3H3,(H2,27,28,33)/t19-,21-,23+/m0/s1	IOGMTQBPALZMTJ-IEIRFRATSA-N	480.237270164							97279
CHEMBL2362638	LSM-13831	BRD-K88003242, SID131450574	54654152	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20+,24+/m1/s1	OHHWUSSTVAUIQP-WWEVIYMKSA-N	CCCNC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	BroadT	BRD-K88003242	BRD-K88003242-001-01-0	Broad Institute of MIT and Harvard	BRD-K88003242			CCCNC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20+,24+/m1/s1	OHHWUSSTVAUIQP-WWEVIYMKSA-N	509.216200362							102481
BRD-K77905217	LSM-13192		54654216	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16-,18+/m1/s1	WVVDCAKHEAPTNY-KYJSFNMBSA-N	CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K77905217	BRD-K77905217-001-01-0	Broad Institute of MIT and Harvard	BRD-K77905217			CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(C)=O)cc3C(=O)N2C)O1	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16-,18+/m1/s1	WVVDCAKHEAPTNY-KYJSFNMBSA-N	389.195070994							101830
BRD-K11424789	LSM-9124		54654223	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27-,29+/m1/s1	ZIFILFAABSOBLR-VQFWCGETSA-N	CN1[C@@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COc5ccc(NS(=O)(=O)c6cccc(F)c6)cc5C1=O	BroadT	BRD-K11424789	BRD-K11424789-001-01-9	Broad Institute of MIT and Harvard	BRD-K11424789			CN1[C@@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C31H32FN3O6S/c1-34-27-11-10-24(17-30(36)35-14-13-20-5-2-3-6-21(20)18-35)41-29(27)19-40-28-12-9-23(16-26(28)31(34)37)33-42(38,39)25-8-4-7-22(32)15-25/h2-9,12,15-16,24,27,29,33H,10-11,13-14,17-19H2,1H3/t24-,27-,29+/m1/s1	ZIFILFAABSOBLR-VQFWCGETSA-N	593.199584664							97745
BRD-K88281008	LSM-13852		54654272	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26+,28-/m0/s1	UIBIEJVTTJAUBZ-PWQSGXPHSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K88281008	BRD-K88281008-001-01-6	Broad Institute of MIT and Harvard	BRD-K88281008			C[C@H](NC(=O)C[C@@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26+,28-/m0/s1	UIBIEJVTTJAUBZ-PWQSGXPHSA-N	597.170034174							102503
BRD-K11857988	LSM-9145		54654258	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23-,25+/m1/s1	LLFGMIFPADLUOD-XRODADMRSA-N	CN1[C@@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K11857988	BRD-K11857988-001-01-9	Broad Institute of MIT and Harvard	BRD-K11857988			CN1[C@@H]2CC[C@H](CC(=O)Nc3cn(C)nc3C)O[C@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23-,25+/m1/s1	LLFGMIFPADLUOD-XRODADMRSA-N	535.22309731							97766
BRD-K77729938	LSM-13181		54653996	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19+,21-/m1/s1	RRCKKFPVDDPSKT-SLYNCCJLSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N4CCN(C)CC4)CC[C@@H]3N(C)C(=O)c2c1	BroadT	BRD-K77729938	BRD-K77729938-001-01-2	Broad Institute of MIT and Harvard	BRD-K77729938			CCS(=O)(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)N4CCN(C)CC4)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C23H34N4O6S/c1-4-34(30,31)24-16-5-8-20-18(13-16)23(29)26(3)19-7-6-17(33-21(19)15-32-20)14-22(28)27-11-9-25(2)10-12-27/h5,8,13,17,19,21,24H,4,6-7,9-12,14-15H2,1-3H3/t17-,19+,21-/m1/s1	RRCKKFPVDDPSKT-SLYNCCJLSA-N	494.219905538							101819
BRD-K51703152	LSM-11590		54654266	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26-,28-/m0/s1	UIBIEJVTTJAUBZ-OKWYHVSVSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K51703152	BRD-K51703152-001-01-6	Broad Institute of MIT and Harvard	BRD-K51703152			C[C@H](NC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23+,26-,28-/m0/s1	UIBIEJVTTJAUBZ-OKWYHVSVSA-N	597.170034174							100213
BRD-K88560304	LSM-13871		54654248	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25-,27-/m0/s1	MRUYUJCJGOFQDV-LNBJVWSJSA-N	COc1cccc(CNC(=O)C[C@@H]2CC[C@H]3[C@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	BroadT	BRD-K88560304	BRD-K88560304-001-01-4	Broad Institute of MIT and Harvard	BRD-K88560304			COc1cccc(CNC(=O)C[C@@H]2CC[C@H]3[C@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25-,27-/m0/s1	MRUYUJCJGOFQDV-LNBJVWSJSA-N	597.194499284							102523
BRD-K55362990	LSM-11785		54654133	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21+,23-/m0/s1	OPKRVFTXMKZUJR-WPYKKVEZSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCC3CC3)O[C@H]2COc4ccc(NC(=O)NC5CCCC5)cc4C1=O	BroadT	BRD-K55362990	BRD-K55362990-001-01-3	Broad Institute of MIT and Harvard	BRD-K55362990			CN1[C@@H]2CC[C@@H](CC(=O)NCC3CC3)O[C@H]2COc2ccc(NC(=O)NC3CCCC3)cc2C1=O	InChI=1S/C26H36N4O5/c1-30-21-10-9-19(13-24(31)27-14-16-6-7-16)35-23(21)15-34-22-11-8-18(12-20(22)25(30)32)29-26(33)28-17-4-2-3-5-17/h8,11-12,16-17,19,21,23H,2-7,9-10,13-15H2,1H3,(H,27,31)(H2,28,29,33)/t19-,21+,23-/m0/s1	OPKRVFTXMKZUJR-WPYKKVEZSA-N	484.268570292							100410
CHEMBL2362005	LSM-10324	BRD-K31314139, SID131450416	54653994	InChI=1S/C27H26Cl2N4O5S/c1-33-22-6-4-17(10-25(34)30-11-15-2-5-19(28)20(29)8-15)38-24(22)12-37-23-7-3-16(9-18(23)27(33)36)32-26(35)21-13-39-14-31-21/h2-3,5,7-9,13-14,17,22,24H,4,6,10-12H2,1H3,(H,30,34)(H,32,35)/t17-,22-,24+/m1/s1	LHGVLKOLCXFJRT-BSDZUQITSA-N	CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2COc4ccc(NC(=O)c5cscn5)cc4C1=O	BroadT	BRD-K31314139	BRD-K31314139-001-01-5	Broad Institute of MIT and Harvard	BRD-K31314139			CN1[C@@H]2CC[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2COc2ccc(NC(=O)c3cscn3)cc2C1=O	InChI=1S/C27H26Cl2N4O5S/c1-33-22-6-4-17(10-25(34)30-11-15-2-5-19(28)20(29)8-15)38-24(22)12-37-23-7-3-16(9-18(23)27(33)36)32-26(35)21-13-39-14-31-21/h2-3,5,7-9,13-14,17,22,24H,4,6,10-12H2,1H3,(H,30,34)(H,32,35)/t17-,22-,24+/m1/s1	LHGVLKOLCXFJRT-BSDZUQITSA-N	588.100096082							98945
BRD-K97029281	LSM-14388		54654146	InChI=1S/C31H34ClN3O6S/c1-19(2)20-7-6-8-21(15-20)33-30(36)17-23-12-13-26-28(41-23)18-40-27-14-11-22(16-24(27)31(37)35(26)3)34-42(38,39)29-10-5-4-9-25(29)32/h4-11,14-16,19,23,26,28,34H,12-13,17-18H2,1-3H3,(H,33,36)/t23-,26+,28-/m1/s1	ZFXZNAWVDNVUMV-RXWNPYQGSA-N	CC(C)c1cccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccccc5Cl)cc4C(=O)N3C)O2)c1	BroadT	BRD-K97029281	BRD-K97029281-001-02-4	Broad Institute of MIT and Harvard	BRD-K97029281			CC(C)c1cccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccccc5Cl)cc4C(=O)N3C)O2)c1	InChI=1S/C31H34ClN3O6S/c1-19(2)20-7-6-8-21(15-20)33-30(36)17-23-12-13-26-28(41-23)18-40-27-14-11-22(16-24(27)31(37)35(26)3)34-42(38,39)29-10-5-4-9-25(29)32/h4-11,14-16,19,23,26,28,34H,12-13,17-18H2,1-3H3,(H,33,36)/t23-,26+,28-/m1/s1	ZFXZNAWVDNVUMV-RXWNPYQGSA-N	611.185684238							103042
BRD-K79004751	LSM-13254		54654245	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25-,27-/m1/s1	MRUYUJCJGOFQDV-AVPJRLCVSA-N	COc1cccc(CNC(=O)C[C@H]2CC[C@@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	BroadT	BRD-K79004751	BRD-K79004751-001-01-2	Broad Institute of MIT and Harvard	BRD-K79004751			COc1cccc(CNC(=O)C[C@H]2CC[C@@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25-,27-/m1/s1	MRUYUJCJGOFQDV-AVPJRLCVSA-N	597.194499284							101893
BRD-K20272026	LSM-9666		54654250	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25-,27+/m1/s1	MRUYUJCJGOFQDV-JBBQQGGESA-N	COc1cccc(CNC(=O)C[C@H]2CC[C@@H]3[C@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	BroadT	BRD-K20272026	BRD-K20272026-001-01-4	Broad Institute of MIT and Harvard	BRD-K20272026			COc1cccc(CNC(=O)C[C@H]2CC[C@@H]3[C@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25-,27+/m1/s1	MRUYUJCJGOFQDV-JBBQQGGESA-N	597.194499284							98287
BRD-K88901529	LSM-13893		54654127	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26-,28+/m0/s1	KPGMTKVYFCJESC-PAUTXSKSSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C1=O	BroadT	BRD-K88901529	BRD-K88901529-001-01-9	Broad Institute of MIT and Harvard	BRD-K88901529			CN1[C@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H34N4O6S/c1-20-3-7-24(8-4-20)41(37,38)33-22-5-10-27-25(17-22)30(36)34(2)26-9-6-23(40-28(26)19-39-27)18-29(35)32-16-13-21-11-14-31-15-12-21/h3-5,7-8,10-12,14-15,17,23,26,28,33H,6,9,13,16,18-19H2,1-2H3,(H,32,35)/t23-,26-,28+/m0/s1	KPGMTKVYFCJESC-PAUTXSKSSA-N	578.219905538							102546
CHEMBL2354644	LSM-9458	BRD-K16980308, SID131450632	54654210	InChI=1S/C31H35N3O7S/c1-20-8-12-24(13-9-20)42(37,38)33-22-10-15-28-25(16-22)31(36)34(2)26-14-11-23(41-29(26)19-40-28)17-30(35)32-18-21-6-4-5-7-27(21)39-3/h4-10,12-13,15-16,23,26,29,33H,11,14,17-19H2,1-3H3,(H,32,35)/t23-,26+,29-/m1/s1	GYVRMNXHBKDJFJ-ZSOKXDGFSA-N	COc1ccccc1CNC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C(=O)N3C)O2	BroadT	BRD-K16980308	BRD-K16980308-001-02-5	Broad Institute of MIT and Harvard	BRD-K16980308			COc1ccccc1CNC(=O)C[C@H]1CC[C@H]2[C@@H](COc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C(=O)N2C)O1	InChI=1S/C31H35N3O7S/c1-20-8-12-24(13-9-20)42(37,38)33-22-10-15-28-25(16-22)31(36)34(2)26-14-11-23(41-29(26)19-40-28)17-30(35)32-18-21-6-4-5-7-27(21)39-3/h4-10,12-13,15-16,23,26,29,33H,11,14,17-19H2,1-3H3,(H,32,35)/t23-,26+,29-/m1/s1	GYVRMNXHBKDJFJ-ZSOKXDGFSA-N	593.21957118							98079
BRD-K09002810	LSM-8973		54654018	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21-,23+/m1/s1	OWLQYYZEQLHDAT-AAIMPIBUSA-N	CN1[C@@H]2CC[C@H](CC(=O)NC3CCCC3)O[C@H]2COc4ccc(NC(=O)c5cc(C)on5)cc4C1=O	BroadT	BRD-K09002810	BRD-K09002810-001-01-0	Broad Institute of MIT and Harvard	BRD-K09002810			CN1[C@@H]2CC[C@H](CC(=O)NC3CCCC3)O[C@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21-,23+/m1/s1	OWLQYYZEQLHDAT-AAIMPIBUSA-N	496.232184784							97594
BRD-K30468438	LSM-10266		54654045	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18-,20+/m0/s1	SDVZNQMNQVCLRJ-XKGZKEIXSA-N	CN1[C@H]2CC[C@@H](CC(=O)O)O[C@@H]2COc3ccc(NC(=O)c4ccc(Cl)cc4)cc3C1=O	BroadT	BRD-K30468438	BRD-K30468438-001-01-8	Broad Institute of MIT and Harvard	BRD-K30468438			CN1[C@H]2CC[C@@H](CC(O)=O)O[C@@H]2COc2ccc(NC(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C23H23ClN2O6/c1-26-18-8-7-16(11-21(27)28)32-20(18)12-31-19-9-6-15(10-17(19)23(26)30)25-22(29)13-2-4-14(24)5-3-13/h2-6,9-10,16,18,20H,7-8,11-12H2,1H3,(H,25,29)(H,27,28)/t16-,18-,20+/m0/s1	SDVZNQMNQVCLRJ-XKGZKEIXSA-N	458.124464186							98887
BRD-K68200852	LSM-14904		54654229	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27+,29-/m0/s1	JZQJXXSKGFWMTL-RCZLLDMCSA-N	CN1[C@@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K68200852	BRD-K68200852-001-01-7	Broad Institute of MIT and Harvard	BRD-K68200852			CN1[C@@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27+,29-/m0/s1	JZQJXXSKGFWMTL-RCZLLDMCSA-N	616.30093306							103560
BRD-K01221769	LSM-8506		54654244	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27+,29-/m1/s1	JZQJXXSKGFWMTL-MCXWQWDOSA-N	CN1[C@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K01221769	BRD-K01221769-001-02-3	Broad Institute of MIT and Harvard	BRD-K01221769			CN1[C@H]2CC[C@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25-,27+,29-/m1/s1	JZQJXXSKGFWMTL-MCXWQWDOSA-N	616.30093306							97127
CHEMBL2135125	LSM-9544	SID131450619, BRD-K18511213	54654197	InChI=1S/C32H34F2N4O5/c1-18(2)19-4-6-20(7-5-19)35-30(39)16-23-10-12-27-29(43-23)17-42-28-13-9-21(14-24(28)31(40)38(27)3)36-32(41)37-22-8-11-25(33)26(34)15-22/h4-9,11,13-15,18,23,27,29H,10,12,16-17H2,1-3H3,(H,35,39)(H2,36,37,41)/t23-,27+,29-/m1/s1	SWJXLXSMFCPIRK-FNHKZSGOSA-N	CC(C)c1ccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)Nc5ccc(F)c(F)c5)cc4C(=O)N3C)O2)cc1	BroadT	BRD-K18511213	BRD-K18511213-001-02-0	Broad Institute of MIT and Harvard	BRD-K18511213			CC(C)c1ccc(NC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)Nc5ccc(F)c(F)c5)cc4C(=O)N3C)O2)cc1	InChI=1S/C32H34F2N4O5/c1-18(2)19-4-6-20(7-5-19)35-30(39)16-23-10-12-27-29(43-23)17-42-28-13-9-21(14-24(28)31(40)38(27)3)36-32(41)37-22-8-11-25(33)26(34)15-22/h4-9,11,13-15,18,23,27,29H,10,12,16-17H2,1-3H3,(H,35,39)(H2,36,37,41)/t23-,27+,29-/m1/s1	SWJXLXSMFCPIRK-FNHKZSGOSA-N	592.249726628							98165
BRD-K35493431	LSM-10558		54654016	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21+,23+/m0/s1	OWLQYYZEQLHDAT-QTGUNEKASA-N	CN1[C@@H]2CC[C@@H](CC(=O)NC3CCCC3)O[C@@H]2COc4ccc(NC(=O)c5cc(C)on5)cc4C1=O	BroadT	BRD-K35493431	BRD-K35493431-001-01-8	Broad Institute of MIT and Harvard	BRD-K35493431			CN1[C@@H]2CC[C@@H](CC(=O)NC3CCCC3)O[C@@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21+,23+/m0/s1	OWLQYYZEQLHDAT-QTGUNEKASA-N	496.232184784							99179
BRD-K00172657	LSM-8433		54654166	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19-,21+/m1/s1	RQAOUBOGQGVTCU-QFUCXCTJSA-N	CNC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	BroadT	BRD-K00172657	BRD-K00172657-001-01-6	Broad Institute of MIT and Harvard	BRD-K00172657			CNC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19-,21+/m1/s1	RQAOUBOGQGVTCU-QFUCXCTJSA-N	473.17622733							97054
BRD-K88279116	LSM-13851		54654165	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19+,21+/m1/s1	RQAOUBOGQGVTCU-LMNJBCLMSA-N	CNC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	BroadT	BRD-K88279116	BRD-K88279116-001-01-9	Broad Institute of MIT and Harvard	BRD-K88279116			CNC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1	InChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19+,21+/m1/s1	RQAOUBOGQGVTCU-LMNJBCLMSA-N	473.17622733							102502
BRD-K59108735	LSM-12000		54654064	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18+,20+/m1/s1	CDAYNQARGBNMSE-KPFFTGBYSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K59108735	BRD-K59108735-001-01-6	Broad Institute of MIT and Harvard	BRD-K59108735			CN(C)CCCNC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NS(C)(=O)=O)cc3C(=O)N2C)O1	InChI=1S/C22H34N4O6S/c1-25(2)11-5-10-23-21(27)13-16-7-8-18-20(32-16)14-31-19-9-6-15(24-33(4,29)30)12-17(19)22(28)26(18)3/h6,9,12,16,18,20,24H,5,7-8,10-11,13-14H2,1-4H3,(H,23,27)/t16-,18+,20+/m1/s1	CDAYNQARGBNMSE-KPFFTGBYSA-N	482.219905538							100626
BRD-K24572125	LSM-9920		54653983	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25+,27+/m0/s1	KLEFMXRWIUTPPC-MAFNXUKGSA-N	CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc4ccc(NC(=O)Nc5ccccc5F)cc4C1=O	BroadT	BRD-K24572125	BRD-K24572125-001-01-3	Broad Institute of MIT and Harvard	BRD-K24572125			CN1[C@@H]2CC[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3F)cc2C1=O	InChI=1S/C30H32FN5O5/c1-36-25-8-7-21(17-28(37)33-15-12-19-10-13-32-14-11-19)41-27(25)18-40-26-9-6-20(16-22(26)29(36)38)34-30(39)35-24-5-3-2-4-23(24)31/h2-6,9-11,13-14,16,21,25,27H,7-8,12,15,17-18H2,1H3,(H,33,37)(H2,34,35,39)/t21-,25+,27+/m0/s1	KLEFMXRWIUTPPC-MAFNXUKGSA-N	561.238747374							98541
BRD-K31791559	LSM-10356		54654073	InChI=1S/C26H28F3N3O6/c1-32-20-8-7-18(12-23(33)30-14-26(27,28)29)38-22(20)13-37-21-9-6-16(11-19(21)25(32)35)31-24(34)15-4-3-5-17(10-15)36-2/h3-6,9-11,18,20,22H,7-8,12-14H2,1-2H3,(H,30,33)(H,31,34)/t18-,20+,22-/m1/s1	RKECGHSSKXUWCJ-KAGYGMCKSA-N	COc1cccc(c1)C(=O)Nc2ccc3OC[C@H]4O[C@@H](CC(=O)NCC(F)(F)F)CC[C@@H]4N(C)C(=O)c3c2	BroadT	BRD-K31791559	BRD-K31791559-001-01-5	Broad Institute of MIT and Harvard	BRD-K31791559			COc1cccc(c1)C(=O)Nc1ccc2OC[C@H]3O[C@@H](CC(=O)NCC(F)(F)F)CC[C@@H]3N(C)C(=O)c2c1	InChI=1S/C26H28F3N3O6/c1-32-20-8-7-18(12-23(33)30-14-26(27,28)29)38-22(20)13-37-21-9-6-16(11-19(21)25(32)35)31-24(34)15-4-3-5-17(10-15)36-2/h3-6,9-11,18,20,22H,7-8,12-14H2,1-2H3,(H,30,33)(H,31,34)/t18-,20+,22-/m1/s1	RKECGHSSKXUWCJ-KAGYGMCKSA-N	535.193020246							98977
BRD-K07660364	LSM-8890		54654234	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27-,29-/m0/s1	JZQJXXSKGFWMTL-GEMKGBFXSA-N	CN1[C@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K07660364	BRD-K07660364-001-01-7	Broad Institute of MIT and Harvard	BRD-K07660364			CN1[C@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27-,29-/m0/s1	JZQJXXSKGFWMTL-GEMKGBFXSA-N	616.30093306							97511
BRD-K37933621	LSM-10725		54654251	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25+,27+/m0/s1	MRUYUJCJGOFQDV-GEWUYGHSSA-N	COc1cccc(CNC(=O)C[C@@H]2CC[C@@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	BroadT	BRD-K37933621	BRD-K37933621-001-01-1	Broad Institute of MIT and Harvard	BRD-K37933621			COc1cccc(CNC(=O)C[C@@H]2CC[C@@H]3[C@@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25+,27+/m0/s1	MRUYUJCJGOFQDV-GEWUYGHSSA-N	597.194499284							99346
BRD-K83726357	LSM-13546		54654103	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23+,25-/m1/s1	WOMWNJCZYVCUPK-NMVJMZGASA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	BroadT	BRD-K83726357	BRD-K83726357-001-01-2	Broad Institute of MIT and Harvard	BRD-K83726357			COc1ccc(CNC(=O)C[C@H]2CC[C@H]3[C@@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23+,25-/m1/s1	WOMWNJCZYVCUPK-NMVJMZGASA-N	509.25258587							102188
BRD-K39066612	LSM-10798		54654110	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25-,27-/m0/s1	CEZHWMAQWNYMAY-LNBJVWSJSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccccc3F)O[C@H]2COc4ccc(NC(=O)C5CCCCC5)cc4C1=O	BroadT	BRD-K39066612	BRD-K39066612-001-01-9	Broad Institute of MIT and Harvard	BRD-K39066612			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccccc3F)O[C@H]2COc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H36FN3O5/c1-34-25-13-12-22(16-28(35)32-17-20-9-5-6-10-24(20)31)39-27(25)18-38-26-14-11-21(15-23(26)30(34)37)33-29(36)19-7-3-2-4-8-19/h5-6,9-11,14-15,19,22,25,27H,2-4,7-8,12-13,16-18H2,1H3,(H,32,35)(H,33,36)/t22-,25-,27-/m0/s1	CEZHWMAQWNYMAY-LNBJVWSJSA-N	537.263899482							99419
BRD-K88392283	LSM-13866		54654209	InChI=1S/C31H35N3O7S/c1-20-8-12-24(13-9-20)42(37,38)33-22-10-15-28-25(16-22)31(36)34(2)26-14-11-23(41-29(26)19-40-28)17-30(35)32-18-21-6-4-5-7-27(21)39-3/h4-10,12-13,15-16,23,26,29,33H,11,14,17-19H2,1-3H3,(H,32,35)/t23-,26-,29+/m1/s1	GYVRMNXHBKDJFJ-FIYSCABWSA-N	COc1ccccc1CNC(=O)C[C@H]2CC[C@@H]3[C@H](COc4ccc(NS(=O)(=O)c5ccc(C)cc5)cc4C(=O)N3C)O2	BroadT	BRD-K88392283	BRD-K88392283-001-01-7	Broad Institute of MIT and Harvard	BRD-K88392283			COc1ccccc1CNC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C(=O)N2C)O1	InChI=1S/C31H35N3O7S/c1-20-8-12-24(13-9-20)42(37,38)33-22-10-15-28-25(16-22)31(36)34(2)26-14-11-23(41-29(26)19-40-28)17-30(35)32-18-21-6-4-5-7-27(21)39-3/h4-10,12-13,15-16,23,26,29,33H,11,14,17-19H2,1-3H3,(H,32,35)/t23-,26-,29+/m1/s1	GYVRMNXHBKDJFJ-FIYSCABWSA-N	593.21957118							102518
BRD-K23664396	LSM-9851		54654259	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23+,25+/m0/s1	LLFGMIFPADLUOD-QUURXOELSA-N	CN1[C@@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc4ccc(NC(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K23664396	BRD-K23664396-001-01-1	Broad Institute of MIT and Harvard	BRD-K23664396			CN1[C@@H]2CC[C@@H](CC(=O)Nc3cn(C)nc3C)O[C@@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C28H30FN5O5/c1-16-22(14-33(2)32-16)31-26(35)13-20-8-9-23-25(39-20)15-38-24-10-7-19(12-21(24)28(37)34(23)3)30-27(36)17-5-4-6-18(29)11-17/h4-7,10-12,14,20,23,25H,8-9,13,15H2,1-3H3,(H,30,36)(H,31,35)/t20-,23+,25+/m0/s1	LLFGMIFPADLUOD-QUURXOELSA-N	535.22309731							98472
BRD-K93754181	LSM-14182		54654154	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20-,24+/m0/s1	OHHWUSSTVAUIQP-VAXXYWNWSA-N	CCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	BroadT	BRD-K93754181	BRD-K93754181-001-01-4	Broad Institute of MIT and Harvard	BRD-K93754181			CCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COc3ccc(NC(=O)c4ccc5OCOc5c4)cc3C(=O)N2C)O1	InChI=1S/C27H31N3O7/c1-3-10-28-25(31)13-18-6-7-20-24(37-18)14-34-21-9-5-17(12-19(21)27(33)30(20)2)29-26(32)16-4-8-22-23(11-16)36-15-35-22/h4-5,8-9,11-12,18,20,24H,3,6-7,10,13-15H2,1-2H3,(H,28,31)(H,29,32)/t18-,20-,24+/m0/s1	OHHWUSSTVAUIQP-VAXXYWNWSA-N	509.216200362							102836
CHEMBL2362456	LSM-9596	SID131450656, BRD-K19390271	54654233	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27+,29+/m0/s1	JZQJXXSKGFWMTL-HLBHGXTFSA-N	CN1[C@@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K19390271	BRD-K19390271-001-01-9	Broad Institute of MIT and Harvard	BRD-K19390271			CN1[C@@H]2CC[C@H](CC(=O)N[C@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27+,29+/m0/s1	JZQJXXSKGFWMTL-HLBHGXTFSA-N	616.30093306							98217
BRD-K39363780	LSM-10815		54654084	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20-,22+/m0/s1	IFOOEWPAOUEVPY-RCZSKKKRSA-N	CN1[C@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@@H]2COc4ccc(NC(=O)c5cccs5)cc4C1=O	BroadT	BRD-K39363780	BRD-K39363780-001-01-6	Broad Institute of MIT and Harvard	BRD-K39363780			CN1[C@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccs3)cc2C1=O	InChI=1S/C26H31N3O5S/c1-28-20-9-8-18(15-24(30)29-11-3-2-4-12-29)34-22(20)16-33-21-10-7-17(14-19(21)26(28)32)27-25(31)23-6-5-13-35-23/h5-7,10,13-14,18,20,22H,2-4,8-9,11-12,15-16H2,1H3,(H,27,31)/t18-,20-,22+/m0/s1	IFOOEWPAOUEVPY-RCZSKKKRSA-N	497.198441812							99436
BRD-K46732958	LSM-11281		54654056	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24-,28+/m0/s1	GPWYEVCXUJXIOI-WQHXYCOISA-N	CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc5ccc(NC(=O)c6ccccc6F)cc5C1=O	BroadT	BRD-K46732958	BRD-K46732958-001-01-9	Broad Institute of MIT and Harvard	BRD-K46732958			CN1[C@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COc2ccc(NC(=O)c3ccccc3F)cc2C1=O	InChI=1S/C31H30FN3O7/c1-35-24-9-8-20(14-29(36)33-15-18-6-10-26-27(12-18)41-17-40-26)42-28(24)16-39-25-11-7-19(13-22(25)31(35)38)34-30(37)21-4-2-3-5-23(21)32/h2-7,10-13,20,24,28H,8-9,14-17H2,1H3,(H,33,36)(H,34,37)/t20-,24-,28+/m0/s1	GPWYEVCXUJXIOI-WQHXYCOISA-N	575.20677853							99902
BRD-K90410459	LSM-13998		54654099	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23-,25+/m1/s1	WOMWNJCZYVCUPK-PFATUAPWSA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	BroadT	BRD-K90410459	BRD-K90410459-001-01-1	Broad Institute of MIT and Harvard	BRD-K90410459			COc1ccc(CNC(=O)C[C@H]2CC[C@@H]3[C@H](COc4ccc(NC(=O)C(C)C)cc4C(=O)N3C)O2)cc1	InChI=1S/C28H35N3O6/c1-17(2)27(33)30-19-7-12-24-22(13-19)28(34)31(3)23-11-10-21(37-25(23)16-36-24)14-26(32)29-15-18-5-8-20(35-4)9-6-18/h5-9,12-13,17,21,23,25H,10-11,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,23-,25+/m1/s1	WOMWNJCZYVCUPK-PFATUAPWSA-N	509.25258587							102651
BRD-K07594626	LSM-8883		54654005	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24-,26-/m0/s1	VRPVHEJOGHTQDQ-GVUKDKGQSA-N	COc1cccc(NC(=O)C[C@@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	BroadT	BRD-K07594626	BRD-K07594626-001-01-2	Broad Institute of MIT and Harvard	BRD-K07594626			COc1cccc(NC(=O)C[C@@H]2CC[C@H]3[C@H](COc4ccc(NC(=O)C5CCOCC5)cc4C(=O)N3C)O2)c1	InChI=1S/C29H35N3O7/c1-32-24-8-7-22(16-27(33)30-19-4-3-5-21(14-19)36-2)39-26(24)17-38-25-9-6-20(15-23(25)29(32)35)31-28(34)18-10-12-37-13-11-18/h3-6,9,14-15,18,22,24,26H,7-8,10-13,16-17H2,1-2H3,(H,30,33)(H,31,34)/t22-,24-,26-/m0/s1	VRPVHEJOGHTQDQ-GVUKDKGQSA-N	537.24750049							97504
BRD-K36623409	LSM-10642		54654242	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27+,29-/m1/s1	JZQJXXSKGFWMTL-NKLDQQJQSA-N	CN1[C@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc5ccc(NC(=O)Nc6c(C)onc6C)cc5C1=O	BroadT	BRD-K36623409	BRD-K36623409-001-01-7	Broad Institute of MIT and Harvard	BRD-K36623409			CN1[C@H]2CC[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)O[C@@H]2COc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C33H40N6O6/c1-20-31(21(2)45-37-20)36-33(42)35-23-9-12-28-26(15-23)32(41)38(3)27-11-10-25(44-29(27)19-43-28)16-30(40)34-24-13-14-39(18-24)17-22-7-5-4-6-8-22/h4-9,12,15,24-25,27,29H,10-11,13-14,16-19H2,1-3H3,(H,34,40)(H2,35,36,42)/t24-,25+,27+,29-/m1/s1	JZQJXXSKGFWMTL-NKLDQQJQSA-N	616.30093306							99263
BRD-K17289060	LSM-9469		54654249	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25+,27-/m0/s1	MRUYUJCJGOFQDV-RWUBSVTLSA-N	COc1cccc(CNC(=O)C[C@@H]2CC[C@@H]3[C@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	BroadT	BRD-K17289060	BRD-K17289060-001-01-0	Broad Institute of MIT and Harvard	BRD-K17289060			COc1cccc(CNC(=O)C[C@@H]2CC[C@@H]3[C@H](COc4ccc(NS(=O)(=O)c5ccccc5F)cc4C(=O)N3C)O2)c1	InChI=1S/C30H32FN3O7S/c1-34-25-12-11-22(16-29(35)32-17-19-6-5-7-21(14-19)39-2)41-27(25)18-40-26-13-10-20(15-23(26)30(34)36)33-42(37,38)28-9-4-3-8-24(28)31/h3-10,13-15,22,25,27,33H,11-12,16-18H2,1-2H3,(H,32,35)/t22-,25+,27-/m0/s1	MRUYUJCJGOFQDV-RWUBSVTLSA-N	597.194499284							98090
BRD-K12974237	LSM-9200		54654204	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30+,32-/m1/s1	DRCDGYYITPZHEH-FRVZOEQDSA-N	CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(cc3)c4ccccc4)O[C@@H]2COc5ccc(NC(=O)Cc6cccs6)cc5C1=O	BroadT	BRD-K12974237	BRD-K12974237-001-02-8	Broad Institute of MIT and Harvard	BRD-K12974237			CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@@H]2COc2ccc(NC(=O)Cc3cccs3)cc2C1=O	InChI=1S/C35H35N3O5S/c1-38-30-15-14-27(19-33(39)36-21-23-9-11-25(12-10-23)24-6-3-2-4-7-24)43-32(30)22-42-31-16-13-26(18-29(31)35(38)41)37-34(40)20-28-8-5-17-44-28/h2-13,16-18,27,30,32H,14-15,19-22H2,1H3,(H,36,39)(H,37,40)/t27-,30+,32-/m1/s1	DRCDGYYITPZHEH-FRVZOEQDSA-N	609.22974194							97821
BRD-K79116978	LSM-13262		54654139	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25-,27-/m0/s1	TUUZOQPHVDGSNW-LNBJVWSJSA-N	CN1[C@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc4ccc(NS(=O)(=O)c5cccc(F)c5)cc4C1=O	BroadT	BRD-K79116978	BRD-K79116978-001-01-1	Broad Institute of MIT and Harvard	BRD-K79116978			CN1[C@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2COc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2C1=O	InChI=1S/C29H37FN4O6S/c1-33-25-10-9-22(18-28(35)31-12-15-34-13-3-2-4-14-34)40-27(25)19-39-26-11-8-21(17-24(26)29(33)36)32-41(37,38)23-7-5-6-20(30)16-23/h5-8,11,16-17,22,25,27,32H,2-4,9-10,12-15,18-19H2,1H3,(H,31,35)/t22-,25-,27-/m0/s1	TUUZOQPHVDGSNW-LNBJVWSJSA-N	588.241783834							101901
BRD-K85236776-001-01-3	LSM-26283	BRD-K85236776	54654214	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16-,18-/m1/s1	WVVDCAKHEAPTNY-QGPMSJSTSA-N	CCNC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(=O)C)cc3C(=O)N2C)O1	BroadT	BRD-K85236776	BRD-K85236776-001-01-3	Broad Institute of MIT and Harvard	BRD-K85236776			CCNC(=O)C[C@H]1CC[C@@H]2[C@@H](COc3ccc(NC(C)=O)cc3C(=O)N2C)O1	InChI=1S/C20H27N3O5/c1-4-21-19(25)10-14-6-7-16-18(28-14)11-27-17-8-5-13(22-12(2)24)9-15(17)20(26)23(16)3/h5,8-9,14,16,18H,4,6-7,10-11H2,1-3H3,(H,21,25)(H,22,24)/t14-,16-,18-/m1/s1	WVVDCAKHEAPTNY-QGPMSJSTSA-N	389.195070994							114821
BRD-K95773671	LSM-14301		54654017	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21+,23-/m0/s1	OWLQYYZEQLHDAT-ZEYPLWLESA-N	CN1[C@@H]2CC[C@@H](CC(=O)NC3CCCC3)O[C@H]2COc4ccc(NC(=O)c5cc(C)on5)cc4C1=O	BroadT	BRD-K95773671	BRD-K95773671-001-01-9	Broad Institute of MIT and Harvard	BRD-K95773671			CN1[C@@H]2CC[C@@H](CC(=O)NC3CCCC3)O[C@H]2COc2ccc(NC(=O)c3cc(C)on3)cc2C1=O	InChI=1S/C26H32N4O6/c1-15-11-20(29-36-15)25(32)28-17-7-10-22-19(12-17)26(33)30(2)21-9-8-18(35-23(21)14-34-22)13-24(31)27-16-5-3-4-6-16/h7,10-12,16,18,21,23H,3-6,8-9,13-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,21+,23-/m0/s1	OWLQYYZEQLHDAT-ZEYPLWLESA-N	496.232184784							102955
BRD-K96003120	LSM-14315		54654261	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26+,28+/m1/s1	UIBIEJVTTJAUBZ-MVSIMOHVSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c5ccccc5	BroadT	BRD-K96003120	BRD-K96003120-001-01-7	Broad Institute of MIT and Harvard	BRD-K96003120			C[C@@H](NC(=O)C[C@H]1CC[C@H]2[C@H](COc3ccc(NS(=O)(=O)c4ccc(Cl)cc4)cc3C(=O)N2C)O1)c1ccccc1	InChI=1S/C30H32ClN3O6S/c1-19(20-6-4-3-5-7-20)32-29(35)17-23-11-14-26-28(40-23)18-39-27-15-10-22(16-25(27)30(36)34(26)2)33-41(37,38)24-12-8-21(31)9-13-24/h3-10,12-13,15-16,19,23,26,28,33H,11,14,17-18H2,1-2H3,(H,32,35)/t19-,23-,26+,28+/m1/s1	UIBIEJVTTJAUBZ-MVSIMOHVSA-N	597.170034174							102969
BRD-K88334823	LSM-13858		54650125	InChI=1S/C21H19FN2O3S/c1-2-28(26,27)24-19(13-23)21(20(24)14-25)17-11-8-15(9-12-17)7-10-16-5-3-4-6-18(16)22/h3-6,8-9,11-12,19-21,25H,2,14H2,1H3/t19-,20+,21-/m0/s1	UCQARJGLVBPITC-HBMCJLEFSA-N	CCS(=O)(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)C#Cc3ccccc3F	BroadT	BRD-K88334823	BRD-K88334823-001-01-6	Broad Institute of MIT and Harvard	BRD-K88334823			CCS(=O)(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C21H19FN2O3S/c1-2-28(26,27)24-19(13-23)21(20(24)14-25)17-11-8-15(9-12-17)7-10-16-5-3-4-6-18(16)22/h3-6,8-9,11-12,19-21,25H,2,14H2,1H3/t19-,20+,21-/m0/s1	UCQARJGLVBPITC-HBMCJLEFSA-N	398.110041378							102509
BRD-K16667431	LSM-9434		54649927	InChI=1S/C21H23N3O4S/c1-23(2)21(26)17-10-6-15(7-11-17)14-4-8-16(9-5-14)20-18(12-22)24(19(20)13-25)29(3,27)28/h4-11,18-20,25H,13H2,1-3H3/t18-,19+,20-/m0/s1	DINYZOMRIFESDL-ZCNNSNEGSA-N	CN(C)C(=O)c1ccc(cc1)c2ccc(cc2)[C@@H]3[C@@H](CO)N([C@H]3C#N)S(=O)(=O)C	BroadT	BRD-K16667431	BRD-K16667431-001-01-0	Broad Institute of MIT and Harvard	BRD-K16667431			CN(C)C(=O)c1ccc(cc1)-c1ccc(cc1)[C@@H]1[C@@H](CO)N([C@H]1C#N)S(C)(=O)=O	InChI=1S/C21H23N3O4S/c1-23(2)21(26)17-10-6-15(7-11-17)14-4-8-16(9-5-14)20-18(12-22)24(19(20)13-25)29(3,27)28/h4-11,18-20,25H,13H2,1-3H3/t18-,19+,20-/m0/s1	DINYZOMRIFESDL-ZCNNSNEGSA-N	413.140926936							98055
BRD-K76820571	LSM-13130		54650207	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20-,21-/m0/s1	IQRVCTXELZIWDH-ACRUOGEOSA-N	CCc1cnc(s1)N2[C@@H](CO)[C@H]([C@@H]2C#N)c3ccc(cc3)c4cccc(F)c4	BroadT	BRD-K76820571	BRD-K76820571-001-01-2	Broad Institute of MIT and Harvard	BRD-K76820571			CCc1cnc(s1)N1[C@@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20-,21-/m0/s1	IQRVCTXELZIWDH-ACRUOGEOSA-N	393.13111118							101768
BRD-K01570637	LSM-8532		54650038	InChI=1S/C19H19FN2O3S/c1-2-26(24,25)22-17(11-21)19(18(22)12-23)14-8-6-13(7-9-14)15-4-3-5-16(20)10-15/h3-10,17-19,23H,2,12H2,1H3/t17-,18+,19-/m0/s1	FWARPLPHHGVTHJ-OTWHNJEPSA-N	CCS(=O)(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)c3cccc(F)c3	BroadT	BRD-K01570637	BRD-K01570637-001-01-5	Broad Institute of MIT and Harvard	BRD-K01570637			CCS(=O)(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C19H19FN2O3S/c1-2-26(24,25)22-17(11-21)19(18(22)12-23)14-8-6-13(7-9-14)15-4-3-5-16(20)10-15/h3-10,17-19,23H,2,12H2,1H3/t17-,18+,19-/m0/s1	FWARPLPHHGVTHJ-OTWHNJEPSA-N	374.110041378							97153
BRD-K06589837	LSM-8814		54649975	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17-,18+/m1/s1	SEDZELNMUHOWSZ-KURKYZTESA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1S(=O)(=O)Cc2ccccc2)c3ccccc3	BroadT	BRD-K06589837	BRD-K06589837-001-01-8	Broad Institute of MIT and Harvard	BRD-K06589837			OC[C@@H]1[C@H]([C@@H](C#N)N1S(=O)(=O)Cc1ccccc1)c1ccccc1	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17-,18+/m1/s1	SEDZELNMUHOWSZ-KURKYZTESA-N	342.103813146							97435
BRD-K19516543	LSM-9604		54650191	InChI=1S/C23H19FN4O2/c24-18-7-9-19(10-8-18)27-23(30)28-20(12-25)22(21(28)14-29)16-5-3-15(4-6-16)17-2-1-11-26-13-17/h1-11,13,20-22,29H,14H2,(H,27,30)/t20-,21+,22+/m1/s1	OSGUSCSJMGIYLG-FSSWDIPSSA-N	OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)Nc2ccc(F)cc2)c3ccc(cc3)c4cccnc4	BroadT	BRD-K19516543	BRD-K19516543-001-01-1	Broad Institute of MIT and Harvard	BRD-K19516543			OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)Nc1ccc(F)cc1)c1ccc(cc1)-c1cccnc1	InChI=1S/C23H19FN4O2/c24-18-7-9-19(10-8-18)27-23(30)28-20(12-25)22(21(28)14-29)16-5-3-15(4-6-16)17-2-1-11-26-13-17/h1-11,13,20-22,29H,14H2,(H,27,30)/t20-,21+,22+/m1/s1	OSGUSCSJMGIYLG-FSSWDIPSSA-N	402.149204088							98225
BRD-K88684430	LSM-15062		54649913	InChI=1S/C25H23N3OS/c26-14-22-24(20-12-10-18(11-13-20)17-6-4-5-7-17)23(15-29)28(22)25-27-21(16-30-25)19-8-2-1-3-9-19/h1-3,6,8-13,16,22-24,29H,4-5,7,15H2/t22-,23+,24-/m1/s1	YWUOOJZCEOJKLU-TZRRMPRUSA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1c2nc(cs2)c3ccccc3)c4ccc(cc4)C5=CCCC5	BroadT	BRD-K88684430	BRD-K88684430-001-01-9	Broad Institute of MIT and Harvard	BRD-K88684430			OC[C@H]1[C@@H]([C@@H](C#N)N1c1nc(cs1)-c1ccccc1)c1ccc(cc1)C1=CCCC1	InChI=1S/C25H23N3OS/c26-14-22-24(20-12-10-18(11-13-20)17-6-4-5-7-17)23(15-29)28(22)25-27-21(16-30-25)19-8-2-1-3-9-19/h1-3,6,8-13,16,22-24,29H,4-5,7,15H2/t22-,23+,24-/m1/s1	YWUOOJZCEOJKLU-TZRRMPRUSA-N	413.156183076							103718
BRD-K01011412	LSM-8500		54650022	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15-,18-/m0/s1	NUSFKYNBTAYYBW-MPGHIAIKSA-N	OC[C@H]1[C@H]([C@H](C#N)N1C(=O)c2ccc3OCOc3c2)c4ccccc4	BroadT	BRD-K01011412	BRD-K01011412-001-01-1	Broad Institute of MIT and Harvard	BRD-K01011412			OC[C@H]1[C@H]([C@H](C#N)N1C(=O)c1ccc2OCOc2c1)c1ccccc1	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15-,18-/m0/s1	NUSFKYNBTAYYBW-MPGHIAIKSA-N	336.111007012							97121
BRD-K60132930	LSM-12065		54650059	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16-,17+/m0/s1	NDKYDEPQZPJKDZ-YESZJQIVSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)Nc2cccc(F)c2)c3ccccc3	BroadT	BRD-K60132930	BRD-K60132930-001-01-6	Broad Institute of MIT and Harvard	BRD-K60132930			OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)Nc1cccc(F)c1)c1ccccc1	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16-,17+/m0/s1	NDKYDEPQZPJKDZ-YESZJQIVSA-N	325.122654982							100691
BRD-K52682771	LSM-11646		54650130	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16+,17-/m1/s1	LIAUQGYQVCFFMZ-IXDOHACOSA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1S(=O)(=O)c2ccc(F)cc2)c3ccccc3	BroadT	BRD-K52682771	BRD-K52682771-001-01-2	Broad Institute of MIT and Harvard	BRD-K52682771			OC[C@H]1[C@@H]([C@@H](C#N)N1S(=O)(=O)c1ccc(F)cc1)c1ccccc1	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16+,17-/m1/s1	LIAUQGYQVCFFMZ-IXDOHACOSA-N	346.07874125							100271
BRD-K68185250	LSM-12585		54649988	InChI=1S/C23H22N2O3S/c1-16-4-2-3-5-22(16)29(27,28)25-20(14-24)23(21(25)15-26)19-12-10-18(11-13-19)9-8-17-6-7-17/h2-5,10-13,17,20-21,23,26H,6-7,15H2,1H3/t20-,21+,23-/m0/s1	WYRXOKNMJBDANC-XJUOHMSHSA-N	Cc1ccccc1S(=O)(=O)N2[C@H](CO)[C@H]([C@@H]2C#N)c3ccc(cc3)C#CC4CC4	BroadT	BRD-K68185250	BRD-K68185250-001-01-8	Broad Institute of MIT and Harvard	BRD-K68185250			Cc1ccccc1S(=O)(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C#CC1CC1	InChI=1S/C23H22N2O3S/c1-16-4-2-3-5-22(16)29(27,28)25-20(14-24)23(21(25)15-26)19-12-10-18(11-13-19)9-8-17-6-7-17/h2-5,10-13,17,20-21,23,26H,6-7,15H2,1H3/t20-,21+,23-/m0/s1	WYRXOKNMJBDANC-XJUOHMSHSA-N	406.135113274							101216
BRD-K94067270	LSM-43501		54650172	InChI=1S/C20H19N3O2/c1-2-4-14-6-8-15(9-7-14)19-17(11-21)23(18(19)13-24)20(25)16-5-3-10-22-12-16/h2-10,12,17-19,24H,13H2,1H3/b4-2+/t17-,18+,19+/m1/s1	SONVGTXFTWWDQR-HHXYLULKSA-N	C\C=C\c1ccc(cc1)[C@@H]2[C@H](CO)N([C@@H]2C#N)C(=O)c3cccnc3	BroadT	BRD-K94067270	BRD-K94067270-001-01-2	Broad Institute of MIT and Harvard	BRD-K94067270			C\C=C\c1ccc(cc1)[C@@H]1[C@H](CO)N([C@@H]1C#N)C(=O)c1cccnc1	InChI=1S/C20H19N3O2/c1-2-4-14-6-8-15(9-7-14)19-17(11-21)23(18(19)13-24)20(25)16-5-3-10-22-12-16/h2-10,12,17-19,24H,13H2,1H3/b4-2+/t17-,18+,19+/m1/s1	SONVGTXFTWWDQR-HHXYLULKSA-N	333.147726878							
BRD-K49689003	LSM-11450		54650057	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16-,17+/m1/s1	NDKYDEPQZPJKDZ-ZACQAIPSSA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)Nc2cccc(F)c2)c3ccccc3	BroadT	BRD-K49689003	BRD-K49689003-001-01-3	Broad Institute of MIT and Harvard	BRD-K49689003			OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)Nc1cccc(F)c1)c1ccccc1	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16-,17+/m1/s1	NDKYDEPQZPJKDZ-ZACQAIPSSA-N	325.122654982							100071
BRD-K82014438	LSM-13436		54649979	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17+,18-/m1/s1	SEDZELNMUHOWSZ-FGTMMUONSA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1S(=O)(=O)Cc2ccccc2)c3ccccc3	BroadT	BRD-K82014438	BRD-K82014438-001-01-7	Broad Institute of MIT and Harvard	BRD-K82014438			OC[C@H]1[C@@H]([C@@H](C#N)N1S(=O)(=O)Cc1ccccc1)c1ccccc1	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17+,18-/m1/s1	SEDZELNMUHOWSZ-FGTMMUONSA-N	342.103813146							102076
BRD-K96713754	LSM-14369		54650106	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16-,18+/m1/s1	MOIIHOSYSQGYMW-NUJGCVRESA-N	COc1ccccc1NC(=O)N2[C@H](CO)[C@H]([C@H]2C#N)c3ccccc3	BroadT	BRD-K96713754	BRD-K96713754-001-01-4	Broad Institute of MIT and Harvard	BRD-K96713754			COc1ccccc1NC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccccc1	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16-,18+/m1/s1	MOIIHOSYSQGYMW-NUJGCVRESA-N	337.142641498							103023
BRD-K99496840	LSM-14538		54650054	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16+,17+/m1/s1	NDKYDEPQZPJKDZ-IKGGRYGDSA-N	OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)Nc2cccc(F)c2)c3ccccc3	BroadT	BRD-K99496840	BRD-K99496840-001-01-9	Broad Institute of MIT and Harvard	BRD-K99496840			OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)Nc1cccc(F)c1)c1ccccc1	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16+,17+/m1/s1	NDKYDEPQZPJKDZ-IKGGRYGDSA-N	325.122654982							103193
BRD-K43349989	LSM-11063		54650105	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16-,18+/m0/s1	MOIIHOSYSQGYMW-XYJFISCASA-N	COc1ccccc1NC(=O)N2[C@@H](CO)[C@@H]([C@@H]2C#N)c3ccccc3	BroadT	BRD-K43349989	BRD-K43349989-001-01-8	Broad Institute of MIT and Harvard	BRD-K43349989			COc1ccccc1NC(=O)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c1ccccc1	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16-,18+/m0/s1	MOIIHOSYSQGYMW-XYJFISCASA-N	337.142641498							99684
BRD-K70399291	LSM-12723		54650157	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20-,21-/m0/s1	DBVJKEGLTFFIFT-ACRUOGEOSA-N	CCc1cnc(s1)N2[C@@H](CO)[C@H]([C@@H]2C#N)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K70399291	BRD-K70399291-001-01-2	Broad Institute of MIT and Harvard	BRD-K70399291			CCc1cnc(s1)N1[C@@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20-,21-/m0/s1	DBVJKEGLTFFIFT-ACRUOGEOSA-N	379.17183314							101359
BRD-K58826089	LSM-11983		54649993	InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19+,22-/m1/s1	IQHJIJSRQPJLPZ-XQBPLPMBSA-N	COc1ccccc1c2ccc(cc2)[C@H]3[C@H](CO)N([C@@H]3C#N)C(=O)CN(C)C	BroadT	BRD-K58826089	BRD-K58826089-001-01-6	Broad Institute of MIT and Harvard	BRD-K58826089			COc1ccccc1-c1ccc(cc1)[C@H]1[C@H](CO)N([C@@H]1C#N)C(=O)CN(C)C	InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19+,22-/m1/s1	IQHJIJSRQPJLPZ-XQBPLPMBSA-N	379.18959169							100609
BRD-K60993486	LSM-12118		54650097	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19+,20+/m1/s1	GQNJFXBZXQABNJ-AABGKKOBSA-N	CC(C)NC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)c3ccc(F)cc3	BroadT	BRD-K60993486	BRD-K60993486-001-01-9	Broad Institute of MIT and Harvard	BRD-K60993486			CC(C)NC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)-c1ccc(F)cc1	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19+,20+/m1/s1	GQNJFXBZXQABNJ-AABGKKOBSA-N	367.169605174							100744
BRD-K15525634	LSM-6748		54650041	InChI=1S/C16H19N3O/c1-19(2)9-3-4-12-5-7-13(8-6-12)16-14(10-17)18-15(16)11-20/h5-8,14-16,18,20H,9,11H2,1-2H3/t14-,15+,16+/m0/s1	FYJCWMHGNJCWQV-ARFHVFGLSA-N	CN(C)CC#Cc1ccc(cc1)[C@H]2[C@@H](CO)N[C@H]2C#N	BroadT	BRD-K15525634	BRD-K15525634-004-02-8	Broad Institute of MIT and Harvard	BRD-K15525634		Br	CN(C)CC#Cc1ccc(cc1)[C@H]1[C@@H](CO)N[C@H]1C#N.Br	InChI=1S/C16H19N3O.BrH/c1-19(2)9-3-4-12-5-7-13(8-6-12)16-14(10-17)18-15(16)11-20;/h5-8,14-16,18,20H,9,11H2,1-2H3;1H/t14-,15+,16+;/m0./s1	XOKJZYOEVSSJDK-FUQNERGOSA-N	269.152812258							95369
BRD-K05931533	LSM-8774		54649922	InChI=1S/C21H26N2O3S/c1-2-27(25,26)23-19(14-22)21(20(23)15-24)18-12-10-17(11-13-18)9-5-8-16-6-3-4-7-16/h10-13,16,19-21,24H,2-4,6-8,15H2,1H3/t19-,20+,21-/m0/s1	FMUUBOBUXMLTIS-HBMCJLEFSA-N	CCS(=O)(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)C#CCC3CCCC3	BroadT	BRD-K05931533	BRD-K05931533-001-01-0	Broad Institute of MIT and Harvard	BRD-K05931533			CCS(=O)(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C#CCC1CCCC1	InChI=1S/C21H26N2O3S/c1-2-27(25,26)23-19(14-22)21(20(23)15-24)18-12-10-17(11-13-18)9-5-8-16-6-3-4-7-16/h10-13,16,19-21,24H,2-4,6-8,15H2,1H3/t19-,20+,21-/m0/s1	FMUUBOBUXMLTIS-HBMCJLEFSA-N	386.166413402							97395
BRD-K74656908	LSM-13003		54650161	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18-,19+/m1/s1	ANDSQWRABKLSGR-QRVBRYPASA-N	OC[C@H]1N[C@H](C#N)[C@@H]1c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K74656908	BRD-K74656908-001-01-6	Broad Institute of MIT and Harvard	BRD-K74656908			OC[C@H]1N[C@H](C#N)[C@@H]1c1ccc(cc1)C#CC1CCCCC1	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18-,19+/m1/s1	ANDSQWRABKLSGR-QRVBRYPASA-N	294.173213344							101640
BRD-K67769696	LSM-12558		54650079	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21-,23+/m0/s1	VFHDDKSZNLSDOB-QNWVGRARSA-N	COc1ccccc1C#Cc2ccc(cc2)[C@H]3[C@H](CO)N([C@H]3C#N)C(=O)C4CC4	BroadT	BRD-K67769696	BRD-K67769696-001-01-2	Broad Institute of MIT and Harvard	BRD-K67769696			COc1ccccc1C#Cc1ccc(cc1)[C@H]1[C@H](CO)N([C@H]1C#N)C(=O)C1CC1	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21-,23+/m0/s1	VFHDDKSZNLSDOB-QNWVGRARSA-N	386.163042584							101189
BRD-K47407883	LSM-11321		54650007	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22-,23+/m1/s1	POAXSVANNSAIAV-ZLNRFVROSA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1S(=O)(=O)c2ccccc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K47407883	BRD-K47407883-001-01-7	Broad Institute of MIT and Harvard	BRD-K47407883			OC[C@@H]1[C@H]([C@@H](C#N)N1S(=O)(=O)c1ccccc1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22-,23+/m1/s1	POAXSVANNSAIAV-ZLNRFVROSA-N	408.150763338							99942
BRD-K31427141	LSM-10333		54650152	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20-,21-/m1/s1	DBVJKEGLTFFIFT-NJDAHSKKSA-N	CCc1cnc(s1)N2[C@H](CO)[C@@H]([C@H]2C#N)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K31427141	BRD-K31427141-001-02-9	Broad Institute of MIT and Harvard	BRD-K31427141			CCc1cnc(s1)N1[C@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20-,21-/m1/s1	DBVJKEGLTFFIFT-NJDAHSKKSA-N	379.17183314							98954
BRD-K26909795	LSM-10060		54650183	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19-,20-/m0/s1	BSUDBHASFVKNIG-UFYCRDLUSA-N	CCCNC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)C3=CCCCC3	BroadT	BRD-K26909795	BRD-K26909795-001-01-4	Broad Institute of MIT and Harvard	BRD-K26909795			CCCNC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19-,20-/m0/s1	BSUDBHASFVKNIG-UFYCRDLUSA-N	353.210327134							98681
BRD-K65481562	LSM-12423		54649992	InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19-,22+/m1/s1	IQHJIJSRQPJLPZ-KNKQGSTJSA-N	COc1ccccc1c2ccc(cc2)[C@@H]3[C@@H](CO)N([C@@H]3C#N)C(=O)CN(C)C	BroadT	BRD-K65481562	BRD-K65481562-001-01-7	Broad Institute of MIT and Harvard	BRD-K65481562			COc1ccccc1-c1ccc(cc1)[C@@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)CN(C)C	InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19-,22+/m1/s1	IQHJIJSRQPJLPZ-KNKQGSTJSA-N	379.18959169							101050
BRD-K27005217	LSM-43458		54650170	InChI=1S/C20H19N3O2/c1-2-4-14-6-8-15(9-7-14)19-17(11-21)23(18(19)13-24)20(25)16-5-3-10-22-12-16/h2-10,12,17-19,24H,13H2,1H3/b4-2+/t17-,18+,19+/m0/s1	SONVGTXFTWWDQR-OOHZSNRESA-N	C\C=C\c1ccc(cc1)[C@H]2[C@@H](CO)N([C@H]2C#N)C(=O)c3cccnc3	BroadT	BRD-K27005217	BRD-K27005217-001-01-0	Broad Institute of MIT and Harvard	BRD-K27005217			C\C=C\c1ccc(cc1)[C@H]1[C@@H](CO)N([C@H]1C#N)C(=O)c1cccnc1	InChI=1S/C20H19N3O2/c1-2-4-14-6-8-15(9-7-14)19-17(11-21)23(18(19)13-24)20(25)16-5-3-10-22-12-16/h2-10,12,17-19,24H,13H2,1H3/b4-2+/t17-,18+,19+/m0/s1	SONVGTXFTWWDQR-OOHZSNRESA-N	333.147726878							
CHEMBL2356228	LSM-8710	SID131446406, BRD-K04588345	54649997	InChI=1S/C26H21N3O3/c1-32-21-6-4-5-19(15-21)9-8-18-10-12-20(13-11-18)25-23(16-27)29(24(25)17-30)26(31)22-7-2-3-14-28-22/h2-7,10-15,23-25,30H,17H2,1H3/t23-,24-,25+/m0/s1	RQNIZPLHIPGYGU-CCDWMCETSA-N	COc1cccc(c1)C#Cc2ccc(cc2)[C@H]3[C@H](CO)N([C@H]3C#N)C(=O)c4ccccn4	BroadT	BRD-K04588345	BRD-K04588345-001-01-7	Broad Institute of MIT and Harvard	BRD-K04588345			COc1cccc(c1)C#Cc1ccc(cc1)[C@H]1[C@H](CO)N([C@H]1C#N)C(=O)c1ccccn1	InChI=1S/C26H21N3O3/c1-32-21-6-4-5-19(15-21)9-8-18-10-12-20(13-11-18)25-23(16-27)29(24(25)17-30)26(31)22-7-2-3-14-28-22/h2-7,10-15,23-25,30H,17H2,1H3/t23-,24-,25+/m0/s1	RQNIZPLHIPGYGU-CCDWMCETSA-N	423.158291562							97331
BRD-K37612077	LSM-10702		54650164	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18+,19+/m1/s1	ANDSQWRABKLSGR-QYZOEREBSA-N	OC[C@@H]1N[C@H](C#N)[C@@H]1c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K37612077	BRD-K37612077-001-01-0	Broad Institute of MIT and Harvard	BRD-K37612077			OC[C@@H]1N[C@H](C#N)[C@@H]1c1ccc(cc1)C#CC1CCCCC1	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18+,19+/m1/s1	ANDSQWRABKLSGR-QYZOEREBSA-N	294.173213344							99323
BRD-K32986110	LSM-10432		54649999	InChI=1S/C26H21N3O3/c1-32-21-6-4-5-19(15-21)9-8-18-10-12-20(13-11-18)25-23(16-27)29(24(25)17-30)26(31)22-7-2-3-14-28-22/h2-7,10-15,23-25,30H,17H2,1H3/t23-,24+,25-/m1/s1	RQNIZPLHIPGYGU-DSNGMDLFSA-N	COc1cccc(c1)C#Cc2ccc(cc2)[C@H]3[C@H](CO)N([C@@H]3C#N)C(=O)c4ccccn4	BroadT	BRD-K32986110	BRD-K32986110-001-01-2	Broad Institute of MIT and Harvard	BRD-K32986110			COc1cccc(c1)C#Cc1ccc(cc1)[C@H]1[C@H](CO)N([C@@H]1C#N)C(=O)c1ccccn1	InChI=1S/C26H21N3O3/c1-32-21-6-4-5-19(15-21)9-8-18-10-12-20(13-11-18)25-23(16-27)29(24(25)17-30)26(31)22-7-2-3-14-28-22/h2-7,10-15,23-25,30H,17H2,1H3/t23-,24+,25-/m1/s1	RQNIZPLHIPGYGU-DSNGMDLFSA-N	423.158291562							99053
BRD-K99644669	LSM-14551		54650018	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16-,17+/m1/s1	WYIJFLWERXFFKQ-ZACQAIPSSA-N	OC[C@H]1N[C@H](C#N)[C@@H]1c2ccc(cc2)c3cccc(F)c3	BroadT	BRD-K99644669	BRD-K99644669-001-01-2	Broad Institute of MIT and Harvard	BRD-K99644669			OC[C@H]1N[C@H](C#N)[C@@H]1c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16-,17+/m1/s1	WYIJFLWERXFFKQ-ZACQAIPSSA-N	282.11684132							103206
BRD-K46766834	LSM-6752		54650145	InChI=1S/C23H21FN2O2/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18/h3-5,8-12,15,20-22,27H,14H2,1-2H3/t20-,21+,22+/m0/s1	DGEMMPDKDCWCNC-BHDDXSALSA-N	CC(C)C#Cc1ccc(cc1)[C@H]2[C@@H](CO)N([C@H]2C#N)C(=O)c3cccc(F)c3	BroadT	BRD-K46766834	BRD-K46766834-004-02-9	Broad Institute of MIT and Harvard	BRD-K46766834		Br	CC(C)C#Cc1ccc(cc1)[C@H]1[C@@H](CO)N([C@H]1C#N)C(=O)c1cccc(F)c1.Br	InChI=1S/C23H21FN2O2.BrH/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18;/h3-5,8-12,15,20-22,27H,14H2,1-2H3;1H/t20-,21+,22+;/m0./s1	VQXRVFHTJURJCS-DWAQFSJKSA-N	376.158706132							95373
BRD-K11309655	LSM-9117		54650177	InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18+,19+/m1/s1	BQRBXGWYUGGWQF-QYZOEREBSA-N	OC[C@@H]1N[C@H](C#N)[C@@H]1c2ccc(cc2)C#Cc3ccccc3F	BroadT	BRD-K11309655	BRD-K11309655-001-01-3	Broad Institute of MIT and Harvard	BRD-K11309655			OC[C@@H]1N[C@H](C#N)[C@@H]1c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18+,19+/m1/s1	BQRBXGWYUGGWQF-QYZOEREBSA-N	306.11684132							97738
BRD-K48492265	LSM-11379		54650119	InChI=1S/C22H26N2O3/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3/t19-,20+,22+/m1/s1	FOQJOAXBJHEYGA-URVUXULASA-N	COCC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)C#CCC3CCCC3	BroadT	BRD-K48492265	BRD-K48492265-001-01-6	Broad Institute of MIT and Harvard	BRD-K48492265			COCC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)C#CCC1CCCC1	InChI=1S/C22H26N2O3/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3/t19-,20+,22+/m1/s1	FOQJOAXBJHEYGA-URVUXULASA-N	366.194342712							100000
BRD-K89961851	LSM-13978		54650136	InChI=1S/C24H25N3O2/c25-15-21-24(20-8-6-19(7-9-20)18-4-2-1-3-5-18)22(16-28)27(21)23(29)14-17-10-12-26-13-11-17/h4,6-13,21-22,24,28H,1-3,5,14,16H2/t21-,22-,24+/m0/s1	GMLMGXOKFZUTJK-WPFOTENUSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)Cc2ccncc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K89961851	BRD-K89961851-001-01-0	Broad Institute of MIT and Harvard	BRD-K89961851			OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)Cc1ccncc1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C24H25N3O2/c25-15-21-24(20-8-6-19(7-9-20)18-4-2-1-3-5-18)22(16-28)27(21)23(29)14-17-10-12-26-13-11-17/h4,6-13,21-22,24,28H,1-3,5,14,16H2/t21-,22-,24+/m0/s1	GMLMGXOKFZUTJK-WPFOTENUSA-N	387.19467707							102631
BRD-K46088987	LSM-6833		54650090	InChI=1S/C26H20FN3O2/c27-22-9-5-19(6-10-22)2-1-18-3-7-21(8-4-18)26-23(16-28)30(24(26)17-31)25(32)15-20-11-13-29-14-12-20/h3-14,23-24,26,31H,15,17H2/t23-,24-,26-/m0/s1	BPOGNEBUOZNYSO-GNKBHMEESA-N	OC[C@H]1[C@H]([C@H](C#N)N1C(=O)Cc2ccncc2)c3ccc(cc3)C#Cc4ccc(F)cc4	BroadT	BRD-K46088987	BRD-K46088987-001-01-1	Broad Institute of MIT and Harvard	BRD-K46088987			OC[C@H]1[C@H]([C@H](C#N)N1C(=O)Cc1ccncc1)c1ccc(cc1)C#Cc1ccc(F)cc1	InChI=1S/C26H20FN3O2/c27-22-9-5-19(6-10-22)2-1-18-3-7-21(8-4-18)26-23(16-28)30(24(26)17-31)25(32)15-20-11-13-29-14-12-20/h3-14,23-24,26,31H,15,17H2/t23-,24-,26-/m0/s1	BPOGNEBUOZNYSO-GNKBHMEESA-N	425.15395511							95454
BRD-K62052419-001-02-2	LSM-26284	BRD-K62052419	54649891	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15-,16-/m1/s1	RUNWFOIXOHBRTB-BZUAXINKSA-N	OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)C2CCCC2)c3ccccc3	BroadT	BRD-K62052419	BRD-K62052419-001-02-2	Broad Institute of MIT and Harvard	BRD-K62052419			OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)C1CCCC1)c1ccccc1	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15-,16-/m1/s1	RUNWFOIXOHBRTB-BZUAXINKSA-N	284.1524779							114822
BRD-K38622866	LSM-10770		54650201	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20-,21-/m1/s1	IQRVCTXELZIWDH-NJDAHSKKSA-N	CCc1cnc(s1)N2[C@H](CO)[C@@H]([C@H]2C#N)c3ccc(cc3)c4cccc(F)c4	BroadT	BRD-K38622866	BRD-K38622866-001-02-1	Broad Institute of MIT and Harvard	BRD-K38622866			CCc1cnc(s1)N1[C@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20-,21-/m1/s1	IQRVCTXELZIWDH-NJDAHSKKSA-N	393.13111118							99391
BRD-K69661816	LSM-12678		54649973	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17+,18+/m0/s1	SEDZELNMUHOWSZ-RCCFBDPRSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1S(=O)(=O)Cc2ccccc2)c3ccccc3	BroadT	BRD-K69661816	BRD-K69661816-001-02-2	Broad Institute of MIT and Harvard	BRD-K69661816			OC[C@@H]1[C@@H]([C@H](C#N)N1S(=O)(=O)Cc1ccccc1)c1ccccc1	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17+,18+/m0/s1	SEDZELNMUHOWSZ-RCCFBDPRSA-N	342.103813146							101312
BRD-K71777270	LSM-12823		54649929	InChI=1S/C21H23N3O4S/c1-23(2)21(26)17-10-6-15(7-11-17)14-4-8-16(9-5-14)20-18(12-22)24(19(20)13-25)29(3,27)28/h4-11,18-20,25H,13H2,1-3H3/t18-,19+,20+/m1/s1	DINYZOMRIFESDL-AABGKKOBSA-N	CN(C)C(=O)c1ccc(cc1)c2ccc(cc2)[C@@H]3[C@H](CO)N([C@@H]3C#N)S(=O)(=O)C	BroadT	BRD-K71777270	BRD-K71777270-001-01-3	Broad Institute of MIT and Harvard	BRD-K71777270			CN(C)C(=O)c1ccc(cc1)-c1ccc(cc1)[C@@H]1[C@H](CO)N([C@@H]1C#N)S(C)(=O)=O	InChI=1S/C21H23N3O4S/c1-23(2)21(26)17-10-6-15(7-11-17)14-4-8-16(9-5-14)20-18(12-22)24(19(20)13-25)29(3,27)28/h4-11,18-20,25H,13H2,1-3H3/t18-,19+,20+/m1/s1	DINYZOMRIFESDL-AABGKKOBSA-N	413.140926936							101460
BRD-K66814954	LSM-12499		54650131	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16-,17+/m1/s1	LIAUQGYQVCFFMZ-ZACQAIPSSA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1S(=O)(=O)c2ccc(F)cc2)c3ccccc3	BroadT	BRD-K66814954	BRD-K66814954-001-01-4	Broad Institute of MIT and Harvard	BRD-K66814954			OC[C@@H]1[C@H]([C@@H](C#N)N1S(=O)(=O)c1ccc(F)cc1)c1ccccc1	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16-,17+/m1/s1	LIAUQGYQVCFFMZ-ZACQAIPSSA-N	346.07874125							101130
BRD-K60784115	LSM-12105		54650068	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16+,17+/m1/s1	BPKNALSRVQDTLI-IKGGRYGDSA-N	OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)c2ccccc2F)c3ccccc3	BroadT	BRD-K60784115	BRD-K60784115-001-01-1	Broad Institute of MIT and Harvard	BRD-K60784115			OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)c1ccccc1F)c1ccccc1	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16+,17+/m1/s1	BPKNALSRVQDTLI-IKGGRYGDSA-N	310.11175594							100731
BRD-K45319854	LSM-11186		54649919	InChI=1S/C25H23N3O3/c1-31-21-4-2-3-20(14-21)18-5-7-19(8-6-18)25-22(15-26)28(23(25)16-29)24(30)13-17-9-11-27-12-10-17/h2-12,14,22-23,25,29H,13,16H2,1H3/t22-,23-,25+/m1/s1	QYAAHEQVWPVPBC-OYRHQHFDSA-N	COc1cccc(c1)c2ccc(cc2)[C@@H]3[C@@H](CO)N([C@@H]3C#N)C(=O)Cc4ccncc4	BroadT	BRD-K45319854	BRD-K45319854-001-01-1	Broad Institute of MIT and Harvard	BRD-K45319854			COc1cccc(c1)-c1ccc(cc1)[C@@H]1[C@@H](CO)N(C(=O)Cc2ccncc2)[C@@H]1C#N	InChI=1S/C25H23N3O3/c1-31-21-4-2-3-20(14-21)18-5-7-19(8-6-18)25-22(15-26)28(23(25)16-29)24(30)13-17-9-11-27-12-10-17/h2-12,14,22-23,25,29H,13,16H2,1H3/t22-,23-,25+/m1/s1	QYAAHEQVWPVPBC-OYRHQHFDSA-N	413.173941626							99807
BRD-K70470333	LSM-12729		54650025	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15+,18+/m1/s1	NUSFKYNBTAYYBW-VKJFTORMSA-N	OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)c2ccc3OCOc3c2)c4ccccc4	BroadT	BRD-K70470333	BRD-K70470333-001-01-1	Broad Institute of MIT and Harvard	BRD-K70470333			OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)c1ccc2OCOc2c1)c1ccccc1	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15+,18+/m1/s1	NUSFKYNBTAYYBW-VKJFTORMSA-N	336.111007012							101365
BRD-K21109208	LSM-9714		54650138	InChI=1S/C24H25N3O2/c25-15-21-24(20-8-6-19(7-9-20)18-4-2-1-3-5-18)22(16-28)27(21)23(29)14-17-10-12-26-13-11-17/h4,6-13,21-22,24,28H,1-3,5,14,16H2/t21-,22-,24+/m1/s1	GMLMGXOKFZUTJK-AKFKNWHVSA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)Cc2ccncc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K21109208	BRD-K21109208-001-01-7	Broad Institute of MIT and Harvard	BRD-K21109208			OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)Cc1ccncc1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C24H25N3O2/c25-15-21-24(20-8-6-19(7-9-20)18-4-2-1-3-5-18)22(16-28)27(21)23(29)14-17-10-12-26-13-11-17/h4,6-13,21-22,24,28H,1-3,5,14,16H2/t21-,22-,24+/m1/s1	GMLMGXOKFZUTJK-AKFKNWHVSA-N	387.19467707							98335
BRD-K64641861	LSM-12378		54650109	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16+,18-/m1/s1	MOIIHOSYSQGYMW-SOLBZPMBSA-N	COc1ccccc1NC(=O)N2[C@@H](CO)[C@@H]([C@H]2C#N)c3ccccc3	BroadT	BRD-K64641861	BRD-K64641861-001-01-5	Broad Institute of MIT and Harvard	BRD-K64641861			COc1ccccc1NC(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccccc1	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16+,18-/m1/s1	MOIIHOSYSQGYMW-SOLBZPMBSA-N	337.142641498							101005
BRD-K42886157	LSM-43474		54649955	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17+,18-/m1/s1	SLFKQKCTISPXPS-NSVSUOBESA-N	CCc1csc(n1)N2[C@@H](CO)[C@@H]([C@H]2C#N)c3ccc(\C=C\C)cc3	BroadT	BRD-K42886157	BRD-K42886157-001-01-6	Broad Institute of MIT and Harvard	BRD-K42886157			CCc1csc(n1)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)\C=C\C	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17+,18-/m1/s1	SLFKQKCTISPXPS-NSVSUOBESA-N	339.140533012							
BRD-K26903971	LSM-10059		54650008	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22+,23-/m1/s1	POAXSVANNSAIAV-XPWALMASSA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1S(=O)(=O)c2ccccc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K26903971	BRD-K26903971-001-01-3	Broad Institute of MIT and Harvard	BRD-K26903971			OC[C@H]1[C@@H]([C@@H](C#N)N1S(=O)(=O)c1ccccc1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22+,23-/m1/s1	POAXSVANNSAIAV-XPWALMASSA-N	408.150763338							98680
BRD-K14023438	LSM-43451		54649952	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17+,18-/m0/s1	SLFKQKCTISPXPS-MAOGIPSHSA-N	CCc1csc(n1)N2[C@H](CO)[C@H]([C@@H]2C#N)c3ccc(\C=C\C)cc3	BroadT	BRD-K14023438	BRD-K14023438-001-01-1	Broad Institute of MIT and Harvard	BRD-K14023438			CCc1csc(n1)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)\C=C\C	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17+,18-/m0/s1	SLFKQKCTISPXPS-MAOGIPSHSA-N	339.140533012							
BRD-K48598367	LSM-11388		54650132	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16+,17-/m0/s1	LIAUQGYQVCFFMZ-BBWFWOEESA-N	OC[C@@H]1[C@H]([C@H](C#N)N1S(=O)(=O)c2ccc(F)cc2)c3ccccc3	BroadT	BRD-K48598367	BRD-K48598367-001-01-7	Broad Institute of MIT and Harvard	BRD-K48598367			OC[C@@H]1[C@H]([C@H](C#N)N1S(=O)(=O)c1ccc(F)cc1)c1ccccc1	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16+,17-/m0/s1	LIAUQGYQVCFFMZ-BBWFWOEESA-N	346.07874125							100009
BRD-K78655498	LSM-13233		54650086	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16+,17-/m0/s1	COUPNDMEVDHIHS-BBWFWOEESA-N	CCCC#Cc1ccc(cc1)[C@@H]2[C@@H](CO)N([C@H]2C#N)S(=O)(=O)C	BroadT	BRD-K78655498	BRD-K78655498-001-01-0	Broad Institute of MIT and Harvard	BRD-K78655498			CCCC#Cc1ccc(cc1)[C@@H]1[C@@H](CO)N([C@H]1C#N)S(C)(=O)=O	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16+,17-/m0/s1	COUPNDMEVDHIHS-BBWFWOEESA-N	332.11946321							101872
CHEMBL2355378	LSM-13471	BRD-K82560670, SID131446311	54649903	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19-,20+/m0/s1	DBBLKINRPPNEJI-SLFFLAALSA-N	CCc1cnc(s1)N2[C@@H](CO)[C@@H]([C@@H]2C#N)c3ccc(cc3)C#CC(C)C	BroadT	BRD-K82560670	BRD-K82560670-001-01-6	Broad Institute of MIT and Harvard	BRD-K82560670			CCc1cnc(s1)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)C#CC(C)C	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19-,20+/m0/s1	DBBLKINRPPNEJI-SLFFLAALSA-N	365.156183076							102111
BRD-K06202986	LSM-8790		54650120	InChI=1S/C22H26N2O3/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3/t19-,20-,22-/m0/s1	FOQJOAXBJHEYGA-ONTIZHBOSA-N	COCC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)C#CCC3CCCC3	BroadT	BRD-K06202986	BRD-K06202986-001-01-7	Broad Institute of MIT and Harvard	BRD-K06202986			COCC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C#CCC1CCCC1	InChI=1S/C22H26N2O3/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3/t19-,20-,22-/m0/s1	FOQJOAXBJHEYGA-ONTIZHBOSA-N	366.194342712							97411
BRD-K98367121	LSM-14471		54650100	InChI=1S/C23H20N4O2/c24-11-20-23(18-8-6-17(7-9-18)19-12-25-15-26-13-19)21(14-28)27(20)22(29)10-16-4-2-1-3-5-16/h1-9,12-13,15,20-21,23,28H,10,14H2/t20-,21+,23-/m1/s1	OPKRCVVELWLOIA-FUPPJEDESA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)Cc2ccccc2)c3ccc(cc3)c4cncnc4	BroadT	BRD-K98367121	BRD-K98367121-001-01-3	Broad Institute of MIT and Harvard	BRD-K98367121			OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)Cc1ccccc1)c1ccc(cc1)-c1cncnc1	InChI=1S/C23H20N4O2/c24-11-20-23(18-8-6-17(7-9-18)19-12-25-15-26-13-19)21(14-28)27(20)22(29)10-16-4-2-1-3-5-16/h1-9,12-13,15,20-21,23,28H,10,14H2/t20-,21+,23-/m1/s1	OPKRCVVELWLOIA-FUPPJEDESA-N	384.15862592							103126
BRD-K44916273	LSM-11162		54649944	InChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22+,23+/m0/s1	BSEGMNXKWUIHHS-YTFSRNRJSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)c2cccc(F)c2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K44916273	BRD-K44916273-001-01-8	Broad Institute of MIT and Harvard	BRD-K44916273			OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)c1cccc(F)c1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22+,23+/m0/s1	BSEGMNXKWUIHHS-YTFSRNRJSA-N	390.174356196							99783
CHEMBL2355193	LSM-8992	BRD-K09329774, SID131446342	54649934	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23+,24-/m0/s1	NFTCJLSEEOPUCW-VXNXHJTFSA-N	OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)c2cccnc2)c3ccc(cc3)C#Cc4ccccc4F	BroadT	BRD-K09329774	BRD-K09329774-001-01-1	Broad Institute of MIT and Harvard	BRD-K09329774			OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)c1cccnc1)c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23+,24-/m0/s1	NFTCJLSEEOPUCW-VXNXHJTFSA-N	411.138305046							97613
CHEMBL2358056	LSM-43490	SID131446318, BRD-K67514995	54649910	InChI=1S/C20H19FN2O3S/c1-2-4-14-7-9-15(10-8-14)20-18(12-22)23(19(20)13-24)27(25,26)17-6-3-5-16(21)11-17/h2-11,18-20,24H,13H2,1H3/b4-2+/t18-,19-,20-/m1/s1	CRECGCTYSBAAAJ-GVJSHHSGSA-N	C\C=C\c1ccc(cc1)[C@H]2[C@@H](CO)N([C@@H]2C#N)S(=O)(=O)c3cccc(F)c3	BroadT	BRD-K67514995	BRD-K67514995-001-02-8	Broad Institute of MIT and Harvard	BRD-K67514995			C\C=C\c1ccc(cc1)[C@H]1[C@@H](CO)N([C@@H]1C#N)S(=O)(=O)c1cccc(F)c1	InChI=1S/C20H19FN2O3S/c1-2-4-14-7-9-15(10-8-14)20-18(12-22)23(19(20)13-24)27(25,26)17-6-3-5-16(21)11-17/h2-11,18-20,24H,13H2,1H3/b4-2+/t18-,19-,20-/m1/s1	CRECGCTYSBAAAJ-GVJSHHSGSA-N	386.110041378							
BRD-K06716139	LSM-8822		54650103	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16+,18+/m0/s1	MOIIHOSYSQGYMW-LZLYRXPVSA-N	COc1ccccc1NC(=O)N2[C@H](CO)[C@@H]([C@@H]2C#N)c3ccccc3	BroadT	BRD-K06716139	BRD-K06716139-001-01-2	Broad Institute of MIT and Harvard	BRD-K06716139			COc1ccccc1NC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccccc1	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16+,18+/m0/s1	MOIIHOSYSQGYMW-LZLYRXPVSA-N	337.142641498							97443
BRD-K48593692	LSM-11387		54650021	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15-,18+/m0/s1	NUSFKYNBTAYYBW-RLFYNMQTSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)c2ccc3OCOc3c2)c4ccccc4	BroadT	BRD-K48593692	BRD-K48593692-001-01-4	Broad Institute of MIT and Harvard	BRD-K48593692			OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)c1ccc2OCOc2c1)c1ccccc1	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15-,18+/m0/s1	NUSFKYNBTAYYBW-RLFYNMQTSA-N	336.111007012							100008
BRD-K50314382	LSM-11491		54650200	InChI=1S/C23H29N3O2/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28)/t20-,21-,22+/m1/s1	FHQNTJUBGIRGFL-VSKRKVRLSA-N	CC(C)NC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K50314382	BRD-K50314382-001-01-5	Broad Institute of MIT and Harvard	BRD-K50314382			CC(C)NC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)C#CC1CCCCC1	InChI=1S/C23H29N3O2/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28)/t20-,21-,22+/m1/s1	FHQNTJUBGIRGFL-VSKRKVRLSA-N	379.225977198							100112
BRD-K53039836	LSM-11664		54650165	InChI=1S/C22H21N3O2/c23-13-19-21(17-10-8-16(9-11-17)15-5-1-2-6-15)20(14-26)25(19)22(27)18-7-3-4-12-24-18/h3-5,7-12,19-21,26H,1-2,6,14H2/t19-,20+,21+/m0/s1	MYJKJHLNWUIKMG-PWRODBHTSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)c2ccccn2)c3ccc(cc3)C4=CCCC4	BroadT	BRD-K53039836	BRD-K53039836-001-02-5	Broad Institute of MIT and Harvard	BRD-K53039836			OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)c1ccccn1)c1ccc(cc1)C1=CCCC1	InChI=1S/C22H21N3O2/c23-13-19-21(17-10-8-16(9-11-17)15-5-1-2-6-15)20(14-26)25(19)22(27)18-7-3-4-12-24-18/h3-5,7-12,19-21,26H,1-2,6,14H2/t19-,20+,21+/m0/s1	MYJKJHLNWUIKMG-PWRODBHTSA-N	359.163376942							100289
BRD-K39376673-001-02-6	LSM-43471	BRD-K39376673	54649985	InChI=1S/C19H18N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h1-11,17-19,21-22H,13H2/b7-6+/t17-,18-,19-/m1/s1	XJSDSDQJCAYADY-IOIJZZRGSA-N	OC[C@H]1N[C@H](C#N)[C@H]1c2ccc(\C=C\c3ccccc3)cc2	BroadT	BRD-K39376673	BRD-K39376673-001-02-6	Broad Institute of MIT and Harvard	BRD-K39376673			OC[C@H]1N[C@H](C#N)[C@H]1c1ccc(\C=C\c2ccccc2)cc1	InChI=1S/C19H18N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h1-11,17-19,21-22H,13H2/b7-6+/t17-,18-,19-/m1/s1	XJSDSDQJCAYADY-IOIJZZRGSA-N	290.141913216							
BRD-K80926963	LSM-13381		54650124	InChI=1S/C21H19FN2O3S/c1-2-28(26,27)24-19(13-23)21(20(24)14-25)17-11-8-15(9-12-17)7-10-16-5-3-4-6-18(16)22/h3-6,8-9,11-12,19-21,25H,2,14H2,1H3/t19-,20+,21+/m1/s1	UCQARJGLVBPITC-HKBOAZHASA-N	CCS(=O)(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)C#Cc3ccccc3F	BroadT	BRD-K80926963	BRD-K80926963-001-01-7	Broad Institute of MIT and Harvard	BRD-K80926963			CCS(=O)(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C21H19FN2O3S/c1-2-28(26,27)24-19(13-23)21(20(24)14-25)17-11-8-15(9-12-17)7-10-16-5-3-4-6-18(16)22/h3-6,8-9,11-12,19-21,25H,2,14H2,1H3/t19-,20+,21+/m1/s1	UCQARJGLVBPITC-HKBOAZHASA-N	398.110041378							102020
BRD-K96635690	LSM-14360		54650181	InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18-,19-/m0/s1	BQRBXGWYUGGWQF-FHWLQOOXSA-N	OC[C@@H]1N[C@@H](C#N)[C@@H]1c2ccc(cc2)C#Cc3ccccc3F	BroadT	BRD-K96635690	BRD-K96635690-001-01-6	Broad Institute of MIT and Harvard	BRD-K96635690			OC[C@@H]1N[C@@H](C#N)[C@@H]1c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18-,19-/m0/s1	BQRBXGWYUGGWQF-FHWLQOOXSA-N	306.11684132							103014
BRD-K02446652	LSM-8586		54650192	InChI=1S/C23H19FN4O2/c24-18-7-9-19(10-8-18)27-23(30)28-20(12-25)22(21(28)14-29)16-5-3-15(4-6-16)17-2-1-11-26-13-17/h1-11,13,20-22,29H,14H2,(H,27,30)/t20-,21-,22-/m0/s1	OSGUSCSJMGIYLG-FKBYEOEOSA-N	OC[C@H]1[C@H]([C@H](C#N)N1C(=O)Nc2ccc(F)cc2)c3ccc(cc3)c4cccnc4	BroadT	BRD-K02446652	BRD-K02446652-001-01-7	Broad Institute of MIT and Harvard	BRD-K02446652			OC[C@H]1[C@H]([C@H](C#N)N1C(=O)Nc1ccc(F)cc1)c1ccc(cc1)-c1cccnc1	InChI=1S/C23H19FN4O2/c24-18-7-9-19(10-8-18)27-23(30)28-20(12-25)22(21(28)14-29)16-5-3-15(4-6-16)17-2-1-11-26-13-17/h1-11,13,20-22,29H,14H2,(H,27,30)/t20-,21-,22-/m0/s1	OSGUSCSJMGIYLG-FKBYEOEOSA-N	402.149204088							97207
BRD-K19194092	LSM-6750		54649966	InChI=1S/C23H21N3O2/c24-14-20-23(18-10-8-17(9-11-18)7-6-16-4-5-16)21(15-27)26(20)22(28)13-19-3-1-2-12-25-19/h1-3,8-12,16,20-21,23,27H,4-5,13,15H2/t20-,21-,23-/m1/s1	FLQYRXYGAVUNDA-MQSCRBSSSA-N	OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)Cc2ccccn2)c3ccc(cc3)C#CC4CC4	BroadT	BRD-K19194092	BRD-K19194092-004-02-4	Broad Institute of MIT and Harvard	BRD-K19194092		Br	OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)Cc1ccccn1)c1ccc(cc1)C#CC1CC1.Br	InChI=1S/C23H21N3O2.BrH/c24-14-20-23(18-10-8-17(9-11-18)7-6-16-4-5-16)21(15-27)26(20)22(28)13-19-3-1-2-12-25-19;/h1-3,8-12,16,20-21,23,27H,4-5,13,15H2;1H/t20-,21-,23-;/m1./s1	UUGYAGWUMIWOAW-HMYAGPHPSA-N	371.163376942							95371
BRD-K07431800	LSM-8866		54650058	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16+,17-/m0/s1	NDKYDEPQZPJKDZ-BBWFWOEESA-N	OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)Nc2cccc(F)c2)c3ccccc3	BroadT	BRD-K07431800	BRD-K07431800-001-01-5	Broad Institute of MIT and Harvard	BRD-K07431800			OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)Nc1cccc(F)c1)c1ccccc1	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16+,17-/m0/s1	NDKYDEPQZPJKDZ-BBWFWOEESA-N	325.122654982							97487
CHEMBL2359168	LSM-13718	BRD-K86354270, SID131446598	54650189	InChI=1S/C23H19FN4O2/c24-18-7-9-19(10-8-18)27-23(30)28-20(12-25)22(21(28)14-29)16-5-3-15(4-6-16)17-2-1-11-26-13-17/h1-11,13,20-22,29H,14H2,(H,27,30)/t20-,21+,22+/m0/s1	OSGUSCSJMGIYLG-BHDDXSALSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)Nc2ccc(F)cc2)c3ccc(cc3)c4cccnc4	BroadT	BRD-K86354270	BRD-K86354270-001-02-2	Broad Institute of MIT and Harvard	BRD-K86354270			OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)Nc1ccc(F)cc1)c1ccc(cc1)-c1cccnc1	InChI=1S/C23H19FN4O2/c24-18-7-9-19(10-8-18)27-23(30)28-20(12-25)22(21(28)14-29)16-5-3-15(4-6-16)17-2-1-11-26-13-17/h1-11,13,20-22,29H,14H2,(H,27,30)/t20-,21+,22+/m0/s1	OSGUSCSJMGIYLG-BHDDXSALSA-N	402.149204088							102366
BRD-K21400342	LSM-9728		54650048	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21+,22-/m1/s1	NDTMOTIIGWPVNE-BHIFYINESA-N	CN(C)C(=O)c1cccc(c1)c2ccc(cc2)[C@H]3[C@H](CO)N([C@@H]3C#N)C(=O)C4CC4	BroadT	BRD-K21400342	BRD-K21400342-001-01-7	Broad Institute of MIT and Harvard	BRD-K21400342			CN(C)C(=O)c1cccc(c1)-c1ccc(cc1)[C@H]1[C@H](CO)N([C@@H]1C#N)C(=O)C1CC1	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21+,22-/m1/s1	NDTMOTIIGWPVNE-BHIFYINESA-N	403.18959169							98349
BRD-K96098018	LSM-43503		54649986	InChI=1S/C19H18N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h1-11,17-19,21-22H,13H2/b7-6+/t17-,18+,19+/m0/s1	XJSDSDQJCAYADY-SHWAFNQQSA-N	OC[C@H]1N[C@@H](C#N)[C@H]1c2ccc(\C=C\c3ccccc3)cc2	BroadT	BRD-K96098018	BRD-K96098018-001-02-0	Broad Institute of MIT and Harvard	BRD-K96098018			OC[C@H]1N[C@@H](C#N)[C@H]1c1ccc(\C=C\c2ccccc2)cc1	InChI=1S/C19H18N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h1-11,17-19,21-22H,13H2/b7-6+/t17-,18+,19+/m0/s1	XJSDSDQJCAYADY-SHWAFNQQSA-N	290.141913216							
BRD-K71477834	LSM-12797		54650067	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16-,17-/m1/s1	BPKNALSRVQDTLI-BRWVUGGUSA-N	OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)c2ccccc2F)c3ccccc3	BroadT	BRD-K71477834	BRD-K71477834-001-01-9	Broad Institute of MIT and Harvard	BRD-K71477834			OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)c1ccccc1F)c1ccccc1	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16-,17-/m1/s1	BPKNALSRVQDTLI-BRWVUGGUSA-N	310.11175594							101434
BRD-K71166745	LSM-6761		54650121	InChI=1S/C21H19FN2O3S/c1-2-28(26,27)24-19(13-23)21(20(24)14-25)17-11-8-15(9-12-17)7-10-16-5-3-4-6-18(16)22/h3-6,8-9,11-12,19-21,25H,2,14H2,1H3/t19-,20+,21+/m0/s1	UCQARJGLVBPITC-PWRODBHTSA-N	CCS(=O)(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)C#Cc3ccccc3F	BroadT	BRD-K71166745	BRD-K71166745-004-01-0	Broad Institute of MIT and Harvard	BRD-K71166745		Br	CCS(=O)(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)C#Cc1ccccc1F.Br	InChI=1S/C21H19FN2O3S.BrH/c1-2-28(26,27)24-19(13-23)21(20(24)14-25)17-11-8-15(9-12-17)7-10-16-5-3-4-6-18(16)22;/h3-6,8-9,11-12,19-21,25H,2,14H2,1H3;1H/t19-,20+,21+;/m0./s1	VQAVLAMZTIEDCY-HWAJWLCKSA-N	398.110041378							95382
BRD-K76856691	LSM-13131		54650182	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19+,20+/m0/s1	BSUDBHASFVKNIG-XUVXKRRUSA-N	CCCNC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)C3=CCCCC3	BroadT	BRD-K76856691	BRD-K76856691-001-01-1	Broad Institute of MIT and Harvard	BRD-K76856691			CCCNC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19+,20+/m0/s1	BSUDBHASFVKNIG-XUVXKRRUSA-N	353.210327134							101769
BRD-K99481965	LSM-14537		54650146	InChI=1S/C23H21FN2O2/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18/h3-5,8-12,15,20-22,27H,14H2,1-2H3/t20-,21-,22+/m0/s1	DGEMMPDKDCWCNC-FDFHNCONSA-N	CC(C)C#Cc1ccc(cc1)[C@H]2[C@H](CO)N([C@H]2C#N)C(=O)c3cccc(F)c3	BroadT	BRD-K99481965	BRD-K99481965-001-01-0	Broad Institute of MIT and Harvard	BRD-K99481965			CC(C)C#Cc1ccc(cc1)[C@H]1[C@H](CO)N([C@H]1C#N)C(=O)c1cccc(F)c1	InChI=1S/C23H21FN2O2/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18/h3-5,8-12,15,20-22,27H,14H2,1-2H3/t20-,21-,22+/m0/s1	DGEMMPDKDCWCNC-FDFHNCONSA-N	376.158706132							103192
BRD-K03969729	LSM-8674		54650098	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19-,20+/m1/s1	GQNJFXBZXQABNJ-AQNXPRMDSA-N	CC(C)NC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)c3ccc(F)cc3	BroadT	BRD-K03969729	BRD-K03969729-001-01-6	Broad Institute of MIT and Harvard	BRD-K03969729			CC(C)NC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)-c1ccc(F)cc1	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19-,20+/m1/s1	GQNJFXBZXQABNJ-AQNXPRMDSA-N	367.169605174							97295
BRD-K99999497	LSM-14576		54650199	InChI=1S/C23H29N3O2/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28)/t20-,21+,22-/m0/s1	FHQNTJUBGIRGFL-BDTNDASRSA-N	CC(C)NC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K99999497	BRD-K99999497-001-01-8	Broad Institute of MIT and Harvard	BRD-K99999497			CC(C)NC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C#CC1CCCCC1	InChI=1S/C23H29N3O2/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28)/t20-,21+,22-/m0/s1	FHQNTJUBGIRGFL-BDTNDASRSA-N	379.225977198							103232
BRD-K95526045	LSM-14285		54650117	InChI=1S/C22H26N2O3/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3/t19-,20-,22+/m0/s1	FOQJOAXBJHEYGA-JAXLGGSGSA-N	COCC(=O)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)C#CCC3CCCC3	BroadT	BRD-K95526045	BRD-K95526045-001-01-0	Broad Institute of MIT and Harvard	BRD-K95526045			COCC(=O)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)C#CCC1CCCC1	InChI=1S/C22H26N2O3/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3/t19-,20-,22+/m0/s1	FOQJOAXBJHEYGA-JAXLGGSGSA-N	366.194342712							102939
BRD-K30934140	LSM-10294		54650203	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20-,21+/m1/s1	IQRVCTXELZIWDH-NJYVYQBISA-N	CCc1cnc(s1)N2[C@H](CO)[C@H]([C@H]2C#N)c3ccc(cc3)c4cccc(F)c4	BroadT	BRD-K30934140	BRD-K30934140-001-01-8	Broad Institute of MIT and Harvard	BRD-K30934140			CCc1cnc(s1)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20-,21+/m1/s1	IQRVCTXELZIWDH-NJYVYQBISA-N	393.13111118							98915
BRD-K80999199	LSM-13386		54649971	InChI=1S/C16H17N3OS/c1-10-11(2)21-16(18-10)19-13(8-17)15(14(19)9-20)12-6-4-3-5-7-12/h3-7,13-15,20H,9H2,1-2H3/t13-,14-,15-/m0/s1	AVGQIEGBBUBHIP-KKUMJFAQSA-N	Cc1nc(sc1C)N2[C@@H](CO)[C@H]([C@@H]2C#N)c3ccccc3	BroadT	BRD-K80999199	BRD-K80999199-001-01-0	Broad Institute of MIT and Harvard	BRD-K80999199			Cc1nc(sc1C)N1[C@@H](CO)[C@H]([C@@H]1C#N)c1ccccc1	InChI=1S/C16H17N3OS/c1-10-11(2)21-16(18-10)19-13(8-17)15(14(19)9-20)12-6-4-3-5-7-12/h3-7,13-15,20H,9H2,1-2H3/t13-,14-,15-/m0/s1	AVGQIEGBBUBHIP-KKUMJFAQSA-N	299.109232884							102025
BRD-K13701195	LSM-9256		54649976	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17+,18+/m1/s1	SEDZELNMUHOWSZ-SQNIBIBYSA-N	OC[C@H]1[C@H]([C@@H](C#N)N1S(=O)(=O)Cc2ccccc2)c3ccccc3	BroadT	BRD-K13701195	BRD-K13701195-001-01-6	Broad Institute of MIT and Harvard	BRD-K13701195			OC[C@H]1[C@H]([C@@H](C#N)N1S(=O)(=O)Cc1ccccc1)c1ccccc1	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17+,18+/m1/s1	SEDZELNMUHOWSZ-SQNIBIBYSA-N	342.103813146							97877
BRD-K48864121	LSM-11403		54650198	InChI=1S/C23H29N3O2/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28)/t20-,21+,22+/m1/s1	FHQNTJUBGIRGFL-FSSWDIPSSA-N	CC(C)NC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K48864121	BRD-K48864121-001-01-0	Broad Institute of MIT and Harvard	BRD-K48864121			CC(C)NC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)C#CC1CCCCC1	InChI=1S/C23H29N3O2/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28)/t20-,21+,22+/m1/s1	FHQNTJUBGIRGFL-FSSWDIPSSA-N	379.225977198							100024
CHEMBL3183425	LSM-9420	BRD-K16413530	54649981	InChI=1S/C25H29N3O3/c1-31-21-13-11-18(12-14-21)17-7-9-19(10-8-17)24-22(15-26)28(23(24)16-29)25(30)27-20-5-3-2-4-6-20/h7-14,20,22-24,29H,2-6,16H2,1H3,(H,27,30)/t22-,23+,24+/m1/s1	UEJLJRRJJUOYFY-SGNDLWITSA-N	COc1ccc(cc1)c2ccc(cc2)[C@@H]3[C@H](CO)N([C@@H]3C#N)C(=O)NC4CCCCC4	BroadT	BRD-K16413530	BRD-K16413530-001-01-9	Broad Institute of MIT and Harvard	BRD-K16413530			COc1ccc(cc1)-c1ccc(cc1)[C@@H]1[C@H](CO)N([C@@H]1C#N)C(=O)NC1CCCCC1	InChI=1S/C25H29N3O3/c1-31-21-13-11-18(12-14-21)17-7-9-19(10-8-17)24-22(15-26)28(23(24)16-29)25(30)27-20-5-3-2-4-6-20/h7-14,20,22-24,29H,2-6,16H2,1H3,(H,27,30)/t22-,23+,24+/m1/s1	UEJLJRRJJUOYFY-SGNDLWITSA-N	419.220891818							98041
BRD-K48030215	LSM-11349		54650118	InChI=1S/C22H26N2O3/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3/t19-,20+,22-/m0/s1	FOQJOAXBJHEYGA-VWPQPMDRSA-N	COCC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)C#CCC3CCCC3	BroadT	BRD-K48030215	BRD-K48030215-001-01-5	Broad Institute of MIT and Harvard	BRD-K48030215			COCC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C#CCC1CCCC1	InChI=1S/C22H26N2O3/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3/t19-,20+,22-/m0/s1	FOQJOAXBJHEYGA-VWPQPMDRSA-N	366.194342712							99970
BRD-K19362120	LSM-9595		54650185	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19+,20-/m1/s1	BSUDBHASFVKNIG-HSALFYBXSA-N	CCCNC(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)C3=CCCCC3	BroadT	BRD-K19362120	BRD-K19362120-001-01-1	Broad Institute of MIT and Harvard	BRD-K19362120			CCCNC(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19+,20-/m1/s1	BSUDBHASFVKNIG-HSALFYBXSA-N	353.210327134							98216
BRD-K63898109	LSM-12324		54650093	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19-,20+/m0/s1	GQNJFXBZXQABNJ-SLFFLAALSA-N	CC(C)NC(=O)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)c3ccc(F)cc3	BroadT	BRD-K63898109	BRD-K63898109-001-01-4	Broad Institute of MIT and Harvard	BRD-K63898109			CC(C)NC(=O)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)-c1ccc(F)cc1	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19-,20+/m0/s1	GQNJFXBZXQABNJ-SLFFLAALSA-N	367.169605174							100951
BRD-K28884887	LSM-43462		54649939	InChI=1S/C20H25N3O3/c1-2-3-15-4-6-16(7-5-15)20-17(12-21)23(18(20)14-24)19(25)13-22-8-10-26-11-9-22/h2-7,17-18,20,24H,8-11,13-14H2,1H3/b3-2+/t17-,18-,20+/m0/s1	KJLVFPZXKUGLPF-XEDFNGOPSA-N	C\C=C\c1ccc(cc1)[C@H]2[C@H](CO)N([C@H]2C#N)C(=O)CN3CCOCC3	BroadT	BRD-K28884887	BRD-K28884887-001-01-6	Broad Institute of MIT and Harvard	BRD-K28884887			C\C=C\c1ccc(cc1)[C@H]1[C@H](CO)N([C@H]1C#N)C(=O)CN1CCOCC1	InChI=1S/C20H25N3O3/c1-2-3-15-4-6-16(7-5-15)20-17(12-21)23(18(20)14-24)19(25)13-22-8-10-26-11-9-22/h2-7,17-18,20,24H,8-11,13-14H2,1H3/b3-2+/t17-,18-,20+/m0/s1	KJLVFPZXKUGLPF-XEDFNGOPSA-N	355.18959169							
BRD-K42156657	LSM-10987		54650169	InChI=1S/C22H21N3O2/c23-13-19-21(17-10-8-16(9-11-17)15-5-1-2-6-15)20(14-26)25(19)22(27)18-7-3-4-12-24-18/h3-5,7-12,19-21,26H,1-2,6,14H2/t19-,20-,21+/m1/s1	MYJKJHLNWUIKMG-NJYVYQBISA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)c2ccccn2)c3ccc(cc3)C4=CCCC4	BroadT	BRD-K42156657	BRD-K42156657-001-01-9	Broad Institute of MIT and Harvard	BRD-K42156657			OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)c1ccccn1)c1ccc(cc1)C1=CCCC1	InChI=1S/C22H21N3O2/c23-13-19-21(17-10-8-16(9-11-17)15-5-1-2-6-15)20(14-26)25(19)22(27)18-7-3-4-12-24-18/h3-5,7-12,19-21,26H,1-2,6,14H2/t19-,20-,21+/m1/s1	MYJKJHLNWUIKMG-NJYVYQBISA-N	359.163376942							99608
BRD-K85976669	LSM-6765		54650114	InChI=1S/C22H26N2O3/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3/t19-,20+,22+/m0/s1	FOQJOAXBJHEYGA-TUNNFDKTSA-N	COCC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)C#CCC3CCCC3	BroadT	BRD-K85976669	BRD-K85976669-004-01-8	Broad Institute of MIT and Harvard	BRD-K85976669		Br	COCC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)C#CCC1CCCC1.Br	InChI=1S/C22H26N2O3.BrH/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16;/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3;1H/t19-,20+,22+;/m0./s1	FXTNXTWLQZLJBX-RFXPFWSYSA-N	366.194342712							95386
BRD-K51800846	LSM-11596		54649896	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15+,16-/m1/s1	RUNWFOIXOHBRTB-OWCLPIDISA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)C2CCCC2)c3ccccc3	BroadT	BRD-K51800846	BRD-K51800846-001-01-2	Broad Institute of MIT and Harvard	BRD-K51800846			OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)C1CCCC1)c1ccccc1	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15+,16-/m1/s1	RUNWFOIXOHBRTB-OWCLPIDISA-N	284.1524779							100219
BRD-K63724542	LSM-43487		54649942	InChI=1S/C20H25N3O3/c1-2-3-15-4-6-16(7-5-15)20-17(12-21)23(18(20)14-24)19(25)13-22-8-10-26-11-9-22/h2-7,17-18,20,24H,8-11,13-14H2,1H3/b3-2+/t17-,18+,20+/m1/s1	KJLVFPZXKUGLPF-VDIFYOHGSA-N	C\C=C\c1ccc(cc1)[C@@H]2[C@H](CO)N([C@@H]2C#N)C(=O)CN3CCOCC3	BroadT	BRD-K63724542	BRD-K63724542-001-01-7	Broad Institute of MIT and Harvard	BRD-K63724542			C\C=C\c1ccc(cc1)[C@@H]1[C@H](CO)N([C@@H]1C#N)C(=O)CN1CCOCC1	InChI=1S/C20H25N3O3/c1-2-3-15-4-6-16(7-5-15)20-17(12-21)23(18(20)14-24)19(25)13-22-8-10-26-11-9-22/h2-7,17-18,20,24H,8-11,13-14H2,1H3/b3-2+/t17-,18+,20+/m1/s1	KJLVFPZXKUGLPF-VDIFYOHGSA-N	355.18959169							
BRD-K03130528	LSM-8628		54650085	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16+,17-/m1/s1	COUPNDMEVDHIHS-IXDOHACOSA-N	CCCC#Cc1ccc(cc1)[C@H]2[C@H](CO)N([C@@H]2C#N)S(=O)(=O)C	BroadT	BRD-K03130528	BRD-K03130528-001-01-8	Broad Institute of MIT and Harvard	BRD-K03130528			CCCC#Cc1ccc(cc1)[C@H]1[C@H](CO)N([C@@H]1C#N)S(C)(=O)=O	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16+,17-/m1/s1	COUPNDMEVDHIHS-IXDOHACOSA-N	332.11946321							97249
BRD-K50791983	LSM-11525		54650094	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19+,20-/m1/s1	GQNJFXBZXQABNJ-HSALFYBXSA-N	CC(C)NC(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)c3ccc(F)cc3	BroadT	BRD-K50791983	BRD-K50791983-001-01-7	Broad Institute of MIT and Harvard	BRD-K50791983			CC(C)NC(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)-c1ccc(F)cc1	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19+,20-/m1/s1	GQNJFXBZXQABNJ-HSALFYBXSA-N	367.169605174							131200
BRD-K43580610	LSM-11085		54650040	InChI=1S/C20H21N3O2/c1-23(2)20(25)16-9-5-14(6-10-16)13-3-7-15(8-4-13)19-17(11-21)22-18(19)12-24/h3-10,17-19,22,24H,12H2,1-2H3/t17-,18-,19+/m1/s1	BHVPTKKRAGQFTB-QRVBRYPASA-N	CN(C)C(=O)c1ccc(cc1)c2ccc(cc2)[C@@H]3[C@@H](CO)N[C@@H]3C#N	BroadT	BRD-K43580610	BRD-K43580610-001-01-5	Broad Institute of MIT and Harvard	BRD-K43580610			CN(C)C(=O)c1ccc(cc1)-c1ccc(cc1)[C@@H]1[C@@H](CO)N[C@@H]1C#N	InChI=1S/C20H21N3O2/c1-23(2)20(25)16-9-5-14(6-10-16)13-3-7-15(8-4-13)19-17(11-21)22-18(19)12-24/h3-10,17-19,22,24H,12H2,1-2H3/t17-,18-,19+/m1/s1	BHVPTKKRAGQFTB-QRVBRYPASA-N	335.163376942							99706
BRD-K30563708	LSM-43464		54649954	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17+,18+/m1/s1	SLFKQKCTISPXPS-ZCJAAJKWSA-N	CCc1csc(n1)N2[C@@H](CO)[C@H]([C@H]2C#N)c3ccc(\C=C\C)cc3	BroadT	BRD-K30563708	BRD-K30563708-001-01-9	Broad Institute of MIT and Harvard	BRD-K30563708			CCc1csc(n1)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)\C=C\C	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17+,18+/m1/s1	SLFKQKCTISPXPS-ZCJAAJKWSA-N	339.140533012							
BRD-K64305210	LSM-6756		54649920	InChI=1S/C21H26N2O3S/c1-2-27(25,26)23-19(14-22)21(20(23)15-24)18-12-10-17(11-13-18)9-5-8-16-6-3-4-7-16/h10-13,16,19-21,24H,2-4,6-8,15H2,1H3/t19-,20+,21+/m0/s1	FMUUBOBUXMLTIS-PWRODBHTSA-N	CCS(=O)(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)C#CCC3CCCC3	BroadT	BRD-K64305210	BRD-K64305210-004-01-9	Broad Institute of MIT and Harvard	BRD-K64305210		Br	CCS(=O)(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)C#CCC1CCCC1.Br	InChI=1S/C21H26N2O3S.BrH/c1-2-27(25,26)23-19(14-22)21(20(23)15-24)18-12-10-17(11-13-18)9-5-8-16-6-3-4-7-16;/h10-13,16,19-21,24H,2-4,6-8,15H2,1H3;1H/t19-,20+,21+;/m0./s1	DAWUFBUBRBLIGO-HWAJWLCKSA-N	386.166413402							95377
BRD-K15600521	LSM-6749		54649898	InChI=1S/C20H18N2O2/c1-24-17-4-2-3-15(11-17)6-5-14-7-9-16(10-8-14)20-18(12-21)22-19(20)13-23/h2-4,7-11,18-20,22-23H,13H2,1H3/t18-,19-,20-/m1/s1	XRGAKVKGJSFEJA-VAMGGRTRSA-N	COc1cccc(c1)C#Cc2ccc(cc2)[C@H]3[C@@H](CO)N[C@@H]3C#N	BroadT	BRD-K15600521	BRD-K15600521-004-02-5	Broad Institute of MIT and Harvard	BRD-K15600521		Br	COc1cccc(c1)C#Cc1ccc(cc1)[C@H]1[C@@H](CO)N[C@@H]1C#N.Br	InChI=1S/C20H18N2O2.BrH/c1-24-17-4-2-3-15(11-17)6-5-14-7-9-16(10-8-14)20-18(12-21)22-19(20)13-23;/h2-4,7-11,18-20,22-23H,13H2,1H3;1H/t18-,19-,20-;/m1./s1	BRYWVBISBFPINO-DEXIKXDTSA-N	318.136827836							95370
BRD-K67236726	LSM-12519		54650011	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22-,23+/m0/s1	POAXSVANNSAIAV-RJGXRXQPSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1S(=O)(=O)c2ccccc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K67236726	BRD-K67236726-001-01-6	Broad Institute of MIT and Harvard	BRD-K67236726			OC[C@H]1[C@@H]([C@H](C#N)N1S(=O)(=O)c1ccccc1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22-,23+/m0/s1	POAXSVANNSAIAV-RJGXRXQPSA-N	408.150763338							101150
BRD-K13944250	LSM-6746		54650110	InChI=1S/C22H24N2O3/c23-13-18-20(19(14-25)24(18)21(26)17-7-8-17)16-5-3-15(4-6-16)9-12-22(27)10-1-2-11-22/h3-6,17-20,25,27H,1-2,7-8,10-11,14H2/t18-,19-,20-/m1/s1	PBPFKUQGSPUXQC-VAMGGRTRSA-N	OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)C2CC2)c3ccc(cc3)C#CC4(O)CCCC4	BroadT	BRD-K13944250	BRD-K13944250-004-02-6	Broad Institute of MIT and Harvard	BRD-K13944250		Br	OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)C1CC1)c1ccc(cc1)C#CC1(O)CCCC1.Br	InChI=1S/C22H24N2O3.BrH/c23-13-18-20(19(14-25)24(18)21(26)17-7-8-17)16-5-3-15(4-6-16)9-12-22(27)10-1-2-11-22;/h3-6,17-20,25,27H,1-2,7-8,10-11,14H2;1H/t18-,19-,20-;/m1./s1	BDAJOKVIEVEPPP-DEXIKXDTSA-N	364.178692648							95367
BRD-K64582453	LSM-12374		54649926	InChI=1S/C21H23N3O4S/c1-23(2)21(26)17-10-6-15(7-11-17)14-4-8-16(9-5-14)20-18(12-22)24(19(20)13-25)29(3,27)28/h4-11,18-20,25H,13H2,1-3H3/t18-,19-,20-/m0/s1	DINYZOMRIFESDL-UFYCRDLUSA-N	CN(C)C(=O)c1ccc(cc1)c2ccc(cc2)[C@@H]3[C@H](CO)N([C@H]3C#N)S(=O)(=O)C	BroadT	BRD-K64582453	BRD-K64582453-001-01-5	Broad Institute of MIT and Harvard	BRD-K64582453			CN(C)C(=O)c1ccc(cc1)-c1ccc(cc1)[C@@H]1[C@H](CO)N([C@H]1C#N)S(C)(=O)=O	InChI=1S/C21H23N3O4S/c1-23(2)21(26)17-10-6-15(7-11-17)14-4-8-16(9-5-14)20-18(12-22)24(19(20)13-25)29(3,27)28/h4-11,18-20,25H,13H2,1-3H3/t18-,19-,20-/m0/s1	DINYZOMRIFESDL-UFYCRDLUSA-N	413.140926936							101001
BRD-K46446437	LSM-11264		54649893	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15+,16+/m1/s1	RUNWFOIXOHBRTB-PMPSAXMXSA-N	OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)C2CCCC2)c3ccccc3	BroadT	BRD-K46446437	BRD-K46446437-001-01-7	Broad Institute of MIT and Harvard	BRD-K46446437			OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)C1CCCC1)c1ccccc1	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15+,16+/m1/s1	RUNWFOIXOHBRTB-PMPSAXMXSA-N	284.1524779							99885
BRD-K15626512	LSM-9362		54649970	InChI=1S/C16H17N3OS/c1-10-11(2)21-16(18-10)19-13(8-17)15(14(19)9-20)12-6-4-3-5-7-12/h3-7,13-15,20H,9H2,1-2H3/t13-,14-,15+/m1/s1	AVGQIEGBBUBHIP-KFWWJZLASA-N	Cc1nc(sc1C)N2[C@H](CO)[C@H]([C@H]2C#N)c3ccccc3	BroadT	BRD-K15626512	BRD-K15626512-001-01-9	Broad Institute of MIT and Harvard	BRD-K15626512			Cc1nc(sc1C)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccccc1	InChI=1S/C16H17N3OS/c1-10-11(2)21-16(18-10)19-13(8-17)15(14(19)9-20)12-6-4-3-5-7-12/h3-7,13-15,20H,9H2,1-2H3/t13-,14-,15+/m1/s1	AVGQIEGBBUBHIP-KFWWJZLASA-N	299.109232884							97983
BRD-K30724479	LSM-10277		54649980	InChI=1S/C25H29N3O3/c1-31-21-13-11-18(12-14-21)17-7-9-19(10-8-17)24-22(15-26)28(23(24)16-29)25(30)27-20-5-3-2-4-6-20/h7-14,20,22-24,29H,2-6,16H2,1H3,(H,27,30)/t22-,23+,24-/m1/s1	UEJLJRRJJUOYFY-TZRRMPRUSA-N	COc1ccc(cc1)c2ccc(cc2)[C@H]3[C@H](CO)N([C@@H]3C#N)C(=O)NC4CCCCC4	BroadT	BRD-K30724479	BRD-K30724479-001-01-4	Broad Institute of MIT and Harvard	BRD-K30724479			COc1ccc(cc1)-c1ccc(cc1)[C@H]1[C@H](CO)N([C@@H]1C#N)C(=O)NC1CCCCC1	InChI=1S/C25H29N3O3/c1-31-21-13-11-18(12-14-21)17-7-9-19(10-8-17)24-22(15-26)28(23(24)16-29)25(30)27-20-5-3-2-4-6-20/h7-14,20,22-24,29H,2-6,16H2,1H3,(H,27,30)/t22-,23+,24-/m1/s1	UEJLJRRJJUOYFY-TZRRMPRUSA-N	419.220891818							98898
BRD-K28568387	LSM-43461		54650060	InChI=1S/C20H20N2O3S/c1-26(24,25)22-18(13-21)20(19(22)14-23)17-11-9-16(10-12-17)8-7-15-5-3-2-4-6-15/h2-12,18-20,23H,14H2,1H3/b8-7+/t18-,19-,20-/m1/s1	YERKJFOBGVBJDV-FBYXPACISA-N	CS(=O)(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c2ccc(\C=C\c3ccccc3)cc2	BroadT	BRD-K28568387	BRD-K28568387-001-01-0	Broad Institute of MIT and Harvard	BRD-K28568387			CS(=O)(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c1ccc(\C=C\c2ccccc2)cc1	InChI=1S/C20H20N2O3S/c1-26(24,25)22-18(13-21)20(19(22)14-23)17-11-9-16(10-12-17)8-7-15-5-3-2-4-6-15/h2-12,18-20,23H,14H2,1H3/b8-7+/t18-,19-,20-/m1/s1	YERKJFOBGVBJDV-FBYXPACISA-N	368.11946321							
BRD-K96935347	LSM-14380		54650123	InChI=1S/C21H19FN2O3S/c1-2-28(26,27)24-19(13-23)21(20(24)14-25)17-11-8-15(9-12-17)7-10-16-5-3-4-6-18(16)22/h3-6,8-9,11-12,19-21,25H,2,14H2,1H3/t19-,20+,21-/m1/s1	UCQARJGLVBPITC-QHAWAJNXSA-N	CCS(=O)(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)C#Cc3ccccc3F	BroadT	BRD-K96935347	BRD-K96935347-001-01-7	Broad Institute of MIT and Harvard	BRD-K96935347			CCS(=O)(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C21H19FN2O3S/c1-2-28(26,27)24-19(13-23)21(20(24)14-25)17-11-8-15(9-12-17)7-10-16-5-3-4-6-18(16)22/h3-6,8-9,11-12,19-21,25H,2,14H2,1H3/t19-,20+,21-/m1/s1	UCQARJGLVBPITC-QHAWAJNXSA-N	398.110041378							103034
BRD-K41547297	LSM-43473		54650004	InChI=1S/C26H22FN3O2/c27-21-8-4-5-9-22(21)29-26(32)30-23(16-28)25(24(30)17-31)20-14-12-19(13-15-20)11-10-18-6-2-1-3-7-18/h1-15,23-25,31H,17H2,(H,29,32)/b11-10+/t23-,24+,25+/m0/s1	FKHVKGICKJIMOZ-IFFDQHHNSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)Nc2ccccc2F)c3ccc(\C=C\c4ccccc4)cc3	BroadT	BRD-K41547297	BRD-K41547297-001-02-4	Broad Institute of MIT and Harvard	BRD-K41547297			OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)Nc1ccccc1F)c1ccc(\C=C\c2ccccc2)cc1	InChI=1S/C26H22FN3O2/c27-21-8-4-5-9-22(21)29-26(32)30-23(16-28)25(24(30)17-31)20-14-12-19(13-15-20)11-10-18-6-2-1-3-7-18/h1-15,23-25,31H,17H2,(H,29,32)/b11-10+/t23-,24+,25+/m0/s1	FKHVKGICKJIMOZ-IFFDQHHNSA-N	427.169605174							
BRD-K46267071	LSM-11250		54650190	InChI=1S/C23H19FN4O2/c24-18-7-9-19(10-8-18)27-23(30)28-20(12-25)22(21(28)14-29)16-5-3-15(4-6-16)17-2-1-11-26-13-17/h1-11,13,20-22,29H,14H2,(H,27,30)/t20-,21+,22-/m1/s1	OSGUSCSJMGIYLG-BHIFYINESA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)Nc2ccc(F)cc2)c3ccc(cc3)c4cccnc4	BroadT	BRD-K46267071	BRD-K46267071-001-01-8	Broad Institute of MIT and Harvard	BRD-K46267071			OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)Nc1ccc(F)cc1)c1ccc(cc1)-c1cccnc1	InChI=1S/C23H19FN4O2/c24-18-7-9-19(10-8-18)27-23(30)28-20(12-25)22(21(28)14-29)16-5-3-15(4-6-16)17-2-1-11-26-13-17/h1-11,13,20-22,29H,14H2,(H,27,30)/t20-,21+,22-/m1/s1	OSGUSCSJMGIYLG-BHIFYINESA-N	402.149204088							99871
BRD-K88856990	LSM-43499		54650174	InChI=1S/C20H19N3O2/c1-2-4-14-6-8-15(9-7-14)19-17(11-21)23(18(19)13-24)20(25)16-5-3-10-22-12-16/h2-10,12,17-19,24H,13H2,1H3/b4-2+/t17-,18-,19+/m0/s1	SONVGTXFTWWDQR-WQGPWHEQSA-N	C\C=C\c1ccc(cc1)[C@H]2[C@H](CO)N([C@H]2C#N)C(=O)c3cccnc3	BroadT	BRD-K88856990	BRD-K88856990-001-01-5	Broad Institute of MIT and Harvard	BRD-K88856990			C\C=C\c1ccc(cc1)[C@H]1[C@H](CO)N([C@H]1C#N)C(=O)c1cccnc1	InChI=1S/C20H19N3O2/c1-2-4-14-6-8-15(9-7-14)19-17(11-21)23(18(19)13-24)20(25)16-5-3-10-22-12-16/h2-10,12,17-19,24H,13H2,1H3/b4-2+/t17-,18-,19+/m0/s1	SONVGTXFTWWDQR-WQGPWHEQSA-N	333.147726878							
BRD-K93730701	LSM-14178		54650046	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21-,22+/m0/s1	NDTMOTIIGWPVNE-FDFHNCONSA-N	CN(C)C(=O)c1cccc(c1)c2ccc(cc2)[C@H]3[C@H](CO)N([C@H]3C#N)C(=O)C4CC4	BroadT	BRD-K93730701	BRD-K93730701-001-01-5	Broad Institute of MIT and Harvard	BRD-K93730701			CN(C)C(=O)c1cccc(c1)-c1ccc(cc1)[C@H]1[C@H](CO)N([C@H]1C#N)C(=O)C1CC1	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21-,22+/m0/s1	NDTMOTIIGWPVNE-FDFHNCONSA-N	403.18959169							102832
BRD-K45151011	LSM-11177		54650049	InChI=1S/C22H26N2O3/c23-13-19-21(17-7-5-16(6-8-17)15-3-1-2-4-15)20(14-25)24(19)22(26)18-9-11-27-12-10-18/h3,5-8,18-21,25H,1-2,4,9-12,14H2/t19-,20+,21+/m0/s1	RYSHWXRXFKBMCF-PWRODBHTSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)C2CCOCC2)c3ccc(cc3)C4=CCCC4	BroadT	BRD-K45151011	BRD-K45151011-001-01-8	Broad Institute of MIT and Harvard	BRD-K45151011			OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)C1CCOCC1)c1ccc(cc1)C1=CCCC1	InChI=1S/C22H26N2O3/c23-13-19-21(17-7-5-16(6-8-17)15-3-1-2-4-15)20(14-25)24(19)22(26)18-9-11-27-12-10-18/h3,5-8,18-21,25H,1-2,4,9-12,14H2/t19-,20+,21+/m0/s1	RYSHWXRXFKBMCF-PWRODBHTSA-N	366.194342712							99798
CHEMBL3186267	LSM-11034	BRD-K42931788	54650061	InChI=1S/C19H19N3O3/c1-25-12-18(24)22-16(9-20)19(17(22)11-23)14-6-4-13(5-7-14)15-3-2-8-21-10-15/h2-8,10,16-17,19,23H,11-12H2,1H3/t16-,17+,19+/m0/s1	NONDGOMIDWLUNU-YQVWRLOYSA-N	COCC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)c3cccnc3	BroadT	BRD-K42931788	BRD-K42931788-001-01-7	Broad Institute of MIT and Harvard	BRD-K42931788			COCC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)-c1cccnc1	InChI=1S/C19H19N3O3/c1-25-12-18(24)22-16(9-20)19(17(22)11-23)14-6-4-13(5-7-14)15-3-2-8-21-10-15/h2-8,10,16-17,19,23H,11-12H2,1H3/t16-,17+,19+/m0/s1	NONDGOMIDWLUNU-YQVWRLOYSA-N	337.142641498							99655
BRD-K13942440	LSM-9271		54650000	InChI=1S/C26H21N3O3/c1-32-21-6-4-5-19(15-21)9-8-18-10-12-20(13-11-18)25-23(16-27)29(24(25)17-30)26(31)22-7-2-3-14-28-22/h2-7,10-15,23-25,30H,17H2,1H3/t23-,24+,25-/m0/s1	RQNIZPLHIPGYGU-GVAUOCQISA-N	COc1cccc(c1)C#Cc2ccc(cc2)[C@@H]3[C@@H](CO)N([C@H]3C#N)C(=O)c4ccccn4	BroadT	BRD-K13942440	BRD-K13942440-001-01-9	Broad Institute of MIT and Harvard	BRD-K13942440			COc1cccc(c1)C#Cc1ccc(cc1)[C@@H]1[C@@H](CO)N([C@H]1C#N)C(=O)c1ccccn1	InChI=1S/C26H21N3O3/c1-32-21-6-4-5-19(15-21)9-8-18-10-12-20(13-11-18)25-23(16-27)29(24(25)17-30)26(31)22-7-2-3-14-28-22/h2-7,10-15,23-25,30H,17H2,1H3/t23-,24+,25-/m0/s1	RQNIZPLHIPGYGU-GVAUOCQISA-N	423.158291562							97892
BRD-K20827004	LSM-9697		54649945	InChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22-,23-/m1/s1	BSEGMNXKWUIHHS-DNVJHFABSA-N	OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)c2cccc(F)c2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K20827004	BRD-K20827004-001-02-9	Broad Institute of MIT and Harvard	BRD-K20827004			OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)c1cccc(F)c1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22-,23-/m1/s1	BSEGMNXKWUIHHS-DNVJHFABSA-N	390.174356196							98318
BRD-K50986888	LSM-11541		54650088	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16-,17-/m0/s1	COUPNDMEVDHIHS-ULQDDVLXSA-N	CCCC#Cc1ccc(cc1)[C@@H]2[C@H](CO)N([C@H]2C#N)S(=O)(=O)C	BroadT	BRD-K50986888	BRD-K50986888-001-01-9	Broad Institute of MIT and Harvard	BRD-K50986888			CCCC#Cc1ccc(cc1)[C@@H]1[C@H](CO)N([C@H]1C#N)S(C)(=O)=O	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16-,17-/m0/s1	COUPNDMEVDHIHS-ULQDDVLXSA-N	332.11946321							100164
BRD-K61362569	LSM-12145		54650072	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16+,17-/m0/s1	BPKNALSRVQDTLI-BBWFWOEESA-N	OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)c2ccccc2F)c3ccccc3	BroadT	BRD-K61362569	BRD-K61362569-001-01-6	Broad Institute of MIT and Harvard	BRD-K61362569			OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)c1ccccc1F)c1ccccc1	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16+,17-/m0/s1	BPKNALSRVQDTLI-BBWFWOEESA-N	310.11175594							100771
BRD-K63030439	LSM-12264		54650127	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16-,17-/m1/s1	LIAUQGYQVCFFMZ-BRWVUGGUSA-N	OC[C@@H]1[C@@H]([C@@H](C#N)N1S(=O)(=O)c2ccc(F)cc2)c3ccccc3	BroadT	BRD-K63030439	BRD-K63030439-001-01-5	Broad Institute of MIT and Harvard	BRD-K63030439			OC[C@@H]1[C@@H]([C@@H](C#N)N1S(=O)(=O)c1ccc(F)cc1)c1ccccc1	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16-,17-/m1/s1	LIAUQGYQVCFFMZ-BRWVUGGUSA-N	346.07874125							100890
BRD-K43830653	LSM-11103		54649928	InChI=1S/C21H23N3O4S/c1-23(2)21(26)17-10-6-15(7-11-17)14-4-8-16(9-5-14)20-18(12-22)24(19(20)13-25)29(3,27)28/h4-11,18-20,25H,13H2,1-3H3/t18-,19+,20-/m1/s1	DINYZOMRIFESDL-HSALFYBXSA-N	CN(C)C(=O)c1ccc(cc1)c2ccc(cc2)[C@H]3[C@H](CO)N([C@@H]3C#N)S(=O)(=O)C	BroadT	BRD-K43830653	BRD-K43830653-001-01-2	Broad Institute of MIT and Harvard	BRD-K43830653			CN(C)C(=O)c1ccc(cc1)-c1ccc(cc1)[C@H]1[C@H](CO)N([C@@H]1C#N)S(C)(=O)=O	InChI=1S/C21H23N3O4S/c1-23(2)21(26)17-10-6-15(7-11-17)14-4-8-16(9-5-14)20-18(12-22)24(19(20)13-25)29(3,27)28/h4-11,18-20,25H,13H2,1-3H3/t18-,19+,20-/m1/s1	DINYZOMRIFESDL-HSALFYBXSA-N	413.140926936							99724
BRD-K53867540	LSM-11701		54650178	InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18+,19-/m1/s1	BQRBXGWYUGGWQF-CEXWTWQISA-N	OC[C@@H]1N[C@H](C#N)[C@H]1c2ccc(cc2)C#Cc3ccccc3F	BroadT	BRD-K53867540	BRD-K53867540-001-01-8	Broad Institute of MIT and Harvard	BRD-K53867540			OC[C@@H]1N[C@H](C#N)[C@H]1c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18+,19-/m1/s1	BQRBXGWYUGGWQF-CEXWTWQISA-N	306.11684132							100326
BRD-K29102147	LSM-10192		54650160	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18-,19+/m0/s1	ANDSQWRABKLSGR-GBESFXJTSA-N	OC[C@@H]1N[C@@H](C#N)[C@H]1c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K29102147	BRD-K29102147-001-01-8	Broad Institute of MIT and Harvard	BRD-K29102147			OC[C@@H]1N[C@@H](C#N)[C@H]1c1ccc(cc1)C#CC1CCCCC1	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18-,19+/m0/s1	ANDSQWRABKLSGR-GBESFXJTSA-N	294.173213344							98813
BRD-K58307544	LSM-43483		54649951	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17-,18-/m1/s1	SLFKQKCTISPXPS-ILDBZRBNSA-N	CCc1csc(n1)N2[C@H](CO)[C@@H]([C@H]2C#N)c3ccc(\C=C\C)cc3	BroadT	BRD-K58307544	BRD-K58307544-001-02-4	Broad Institute of MIT and Harvard	BRD-K58307544			CCc1csc(n1)N1[C@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)\C=C\C	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17-,18-/m1/s1	SLFKQKCTISPXPS-ILDBZRBNSA-N	339.140533012							
BRD-K00069117	LSM-6816		54649961	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19-,20+/m0/s1	NYKFFZXKZNVNOG-SLFFLAALSA-N	CCCNC(=O)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)c3ccccc3F	BroadT	BRD-K00069117	BRD-K00069117-001-01-8	Broad Institute of MIT and Harvard	BRD-K00069117			CCCNC(=O)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)-c1ccccc1F	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19-,20+/m0/s1	NYKFFZXKZNVNOG-SLFFLAALSA-N	367.169605174							95437
BRD-K77229182	LSM-13150		54650091	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19+,20+/m0/s1	GQNJFXBZXQABNJ-XUVXKRRUSA-N	CC(C)NC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)c3ccc(F)cc3	BroadT	BRD-K77229182	BRD-K77229182-001-01-6	Broad Institute of MIT and Harvard	BRD-K77229182			CC(C)NC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)-c1ccc(F)cc1	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19+,20+/m0/s1	GQNJFXBZXQABNJ-XUVXKRRUSA-N	367.169605174							101788
CHEMBL2358156	LSM-8930	BRD-K08340668, SID131446486	54650077	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21-,23-/m0/s1	VFHDDKSZNLSDOB-FUDKSRODSA-N	COc1ccccc1C#Cc2ccc(cc2)[C@@H]3[C@H](CO)N([C@H]3C#N)C(=O)C4CC4	BroadT	BRD-K08340668	BRD-K08340668-001-01-8	Broad Institute of MIT and Harvard	BRD-K08340668			COc1ccccc1C#Cc1ccc(cc1)[C@@H]1[C@H](CO)N([C@H]1C#N)C(=O)C1CC1	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21-,23-/m0/s1	VFHDDKSZNLSDOB-FUDKSRODSA-N	386.163042584							97551
BRD-K07458582	LSM-8869		54650080	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21+,23+/m1/s1	VFHDDKSZNLSDOB-GIWBLDEGSA-N	COc1ccccc1C#Cc2ccc(cc2)[C@@H]3[C@H](CO)N([C@@H]3C#N)C(=O)C4CC4	BroadT	BRD-K07458582	BRD-K07458582-001-01-2	Broad Institute of MIT and Harvard	BRD-K07458582			COc1ccccc1C#Cc1ccc(cc1)[C@@H]1[C@H](CO)N([C@@H]1C#N)C(=O)C1CC1	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21+,23+/m1/s1	VFHDDKSZNLSDOB-GIWBLDEGSA-N	386.163042584							97490
BRD-K90805324	LSM-14017		54650202	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20-,21+/m0/s1	IQRVCTXELZIWDH-PCCBWWKXSA-N	CCc1cnc(s1)N2[C@@H](CO)[C@@H]([C@@H]2C#N)c3ccc(cc3)c4cccc(F)c4	BroadT	BRD-K90805324	BRD-K90805324-001-01-5	Broad Institute of MIT and Harvard	BRD-K90805324			CCc1cnc(s1)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20-,21+/m0/s1	IQRVCTXELZIWDH-PCCBWWKXSA-N	393.13111118							102670
BRD-K73769216	LSM-12948		54649972	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17-,18-/m1/s1	SEDZELNMUHOWSZ-KZNAEPCWSA-N	OC[C@@H]1[C@@H]([C@@H](C#N)N1S(=O)(=O)Cc2ccccc2)c3ccccc3	BroadT	BRD-K73769216	BRD-K73769216-001-01-5	Broad Institute of MIT and Harvard	BRD-K73769216			OC[C@@H]1[C@@H]([C@@H](C#N)N1S(=O)(=O)Cc1ccccc1)c1ccccc1	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17-,18-/m1/s1	SEDZELNMUHOWSZ-KZNAEPCWSA-N	342.103813146							101585
BRD-K54375254	LSM-11730		54649900	InChI=1S/C20H18N2O2/c1-24-17-4-2-3-15(11-17)6-5-14-7-9-16(10-8-14)20-18(12-21)22-19(20)13-23/h2-4,7-11,18-20,22-23H,13H2,1H3/t18-,19-,20+/m1/s1	XRGAKVKGJSFEJA-AQNXPRMDSA-N	COc1cccc(c1)C#Cc2ccc(cc2)[C@@H]3[C@@H](CO)N[C@@H]3C#N	BroadT	BRD-K54375254	BRD-K54375254-001-01-7	Broad Institute of MIT and Harvard	BRD-K54375254			COc1cccc(c1)C#Cc1ccc(cc1)[C@@H]1[C@@H](CO)N[C@@H]1C#N	InChI=1S/C20H18N2O2/c1-24-17-4-2-3-15(11-17)6-5-14-7-9-16(10-8-14)20-18(12-21)22-19(20)13-23/h2-4,7-11,18-20,22-23H,13H2,1H3/t18-,19-,20+/m1/s1	XRGAKVKGJSFEJA-AQNXPRMDSA-N	318.136827836							100355
BRD-K38571007-001-01-2	LSM-26285	BRD-K38571007	54649890	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15+,16+/m0/s1	RUNWFOIXOHBRTB-ARFHVFGLSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)C2CCCC2)c3ccccc3	BroadT	BRD-K38571007	BRD-K38571007-001-01-2	Broad Institute of MIT and Harvard	BRD-K38571007			OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)C1CCCC1)c1ccccc1	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15+,16+/m0/s1	RUNWFOIXOHBRTB-ARFHVFGLSA-N	284.1524779							114823
BRD-K07799833	LSM-6743		54649930	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23-,24-/m1/s1	NFTCJLSEEOPUCW-WXFUMESZSA-N	OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)c2cccnc2)c3ccc(cc3)C#Cc4ccccc4F	BroadT	BRD-K07799833	BRD-K07799833-004-02-8	Broad Institute of MIT and Harvard	BRD-K07799833		Br	OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)c1cccnc1)c1ccc(cc1)C#Cc1ccccc1F.Br	InChI=1S/C25H18FN3O2.BrH/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20;/h1-6,8-9,11-13,15,22-24,30H,16H2;1H/t22-,23-,24-;/m1./s1	GSJSORPAAZRURE-AKEJJZJZSA-N	411.138305046							95364
BRD-K86838317	LSM-13751		54649937	InChI=1S/C17H20N2O/c18-10-15-17(16(11-20)19-15)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h4,6-9,15-17,19-20H,1-3,5,11H2/t15-,16-,17-/m1/s1	SIGXZWYEWAPHMA-BRWVUGGUSA-N	OC[C@H]1N[C@H](C#N)[C@H]1c2ccc(cc2)C3=CCCCC3	BroadT	BRD-K86838317	BRD-K86838317-001-02-9	Broad Institute of MIT and Harvard	BRD-K86838317			OC[C@H]1N[C@H](C#N)[C@H]1c1ccc(cc1)C1=CCCCC1	InChI=1S/C17H20N2O/c18-10-15-17(16(11-20)19-15)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h4,6-9,15-17,19-20H,1-3,5,11H2/t15-,16-,17-/m1/s1	SIGXZWYEWAPHMA-BRWVUGGUSA-N	268.15756328							102400
BRD-K40123546	LSM-10877		54650032	InChI=1S/C18H18N2O2/c1-22-17-5-3-2-4-14(17)12-6-8-13(9-7-12)18-15(10-19)20-16(18)11-21/h2-9,15-16,18,20-21H,11H2,1H3/t15-,16-,18+/m0/s1	BGJLKNVJWQWPQD-XYJFISCASA-N	COc1ccccc1c2ccc(cc2)[C@H]3[C@H](CO)N[C@H]3C#N	BroadT	BRD-K40123546	BRD-K40123546-001-01-6	Broad Institute of MIT and Harvard	BRD-K40123546			COc1ccccc1-c1ccc(cc1)[C@H]1[C@H](CO)N[C@H]1C#N	InChI=1S/C18H18N2O2/c1-22-17-5-3-2-4-14(17)12-6-8-13(9-7-12)18-15(10-19)20-16(18)11-21/h2-9,15-16,18,20-21H,11H2,1H3/t15-,16-,18+/m0/s1	BGJLKNVJWQWPQD-XYJFISCASA-N	294.136827836							99498
BRD-K04133968	LSM-8682		54650099	InChI=1S/C23H20N4O2/c24-11-20-23(18-8-6-17(7-9-18)19-12-25-15-26-13-19)21(14-28)27(20)22(29)10-16-4-2-1-3-5-16/h1-9,12-13,15,20-21,23,28H,10,14H2/t20-,21-,23+/m1/s1	OPKRCVVELWLOIA-XPNTWCBSSA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)Cc2ccccc2)c3ccc(cc3)c4cncnc4	BroadT	BRD-K04133968	BRD-K04133968-001-01-8	Broad Institute of MIT and Harvard	BRD-K04133968			OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)Cc1ccccc1)c1ccc(cc1)-c1cncnc1	InChI=1S/C23H20N4O2/c24-11-20-23(18-8-6-17(7-9-18)19-12-25-15-26-13-19)21(14-28)27(20)22(29)10-16-4-2-1-3-5-16/h1-9,12-13,15,20-21,23,28H,10,14H2/t20-,21-,23+/m1/s1	OPKRCVVELWLOIA-XPNTWCBSSA-N	384.15862592							97303
BRD-K33713995	LSM-10473		54650126	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16+,17+/m0/s1	LIAUQGYQVCFFMZ-GVDBMIGSSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1S(=O)(=O)c2ccc(F)cc2)c3ccccc3	BroadT	BRD-K33713995	BRD-K33713995-001-01-9	Broad Institute of MIT and Harvard	BRD-K33713995			OC[C@@H]1[C@@H]([C@H](C#N)N1S(=O)(=O)c1ccc(F)cc1)c1ccccc1	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16+,17+/m0/s1	LIAUQGYQVCFFMZ-GVDBMIGSSA-N	346.07874125							99094
BRD-K65506786	LSM-6757		54650194	InChI=1S/C23H29N3O2/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28)/t20-,21-,22-/m1/s1	FHQNTJUBGIRGFL-YPAWHYETSA-N	CC(C)NC(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K65506786	BRD-K65506786-004-02-3	Broad Institute of MIT and Harvard	BRD-K65506786		Br	CC(C)NC(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C#CC1CCCCC1.Br	InChI=1S/C23H29N3O2.BrH/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17;/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28);1H/t20-,21-,22-;/m1./s1	AOJPQSCHYSFFGC-AFYLVLOISA-N	379.225977198							95378
BRD-K46381939	LSM-11259		54650188	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19+,20-/m0/s1	BSUDBHASFVKNIG-ZCNNSNEGSA-N	CCCNC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)C3=CCCCC3	BroadT	BRD-K46381939	BRD-K46381939-001-01-9	Broad Institute of MIT and Harvard	BRD-K46381939			CCCNC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19+,20-/m0/s1	BSUDBHASFVKNIG-ZCNNSNEGSA-N	353.210327134							99880
BRD-K84155921-001-02-8	LSM-26286	BRD-K84155921	54649912	InChI=1S/C25H23N3OS/c26-14-22-24(20-12-10-18(11-13-20)17-6-4-5-7-17)23(15-29)28(22)25-27-21(16-30-25)19-8-2-1-3-9-19/h1-3,6,8-13,16,22-24,29H,4-5,7,15H2/t22-,23-,24-/m1/s1	YWUOOJZCEOJKLU-WXFUMESZSA-N	OC[C@@H]1[C@@H]([C@@H](C#N)N1c2nc(cs2)c3ccccc3)c4ccc(cc4)C5=CCCC5	BroadT	BRD-K84155921	BRD-K84155921-001-02-8	Broad Institute of MIT and Harvard	BRD-K84155921			OC[C@@H]1[C@@H]([C@@H](C#N)N1c1nc(cs1)-c1ccccc1)c1ccc(cc1)C1=CCCC1	InChI=1S/C25H23N3OS/c26-14-22-24(20-12-10-18(11-13-20)17-6-4-5-7-17)23(15-29)28(22)25-27-21(16-30-25)19-8-2-1-3-9-19/h1-3,6,8-13,16,22-24,29H,4-5,7,15H2/t22-,23-,24-/m1/s1	YWUOOJZCEOJKLU-WXFUMESZSA-N	413.156183076							114824
BRD-K25006240	LSM-9948		54650023	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15+,18-/m1/s1	NUSFKYNBTAYYBW-RVKKMQEKSA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)c2ccc3OCOc3c2)c4ccccc4	BroadT	BRD-K25006240	BRD-K25006240-001-01-1	Broad Institute of MIT and Harvard	BRD-K25006240			OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)c1ccc2OCOc2c1)c1ccccc1	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15+,18-/m1/s1	NUSFKYNBTAYYBW-RVKKMQEKSA-N	336.111007012							98569
BRD-K80400482	LSM-13343		54650187	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19-,20+/m0/s1	BSUDBHASFVKNIG-SLFFLAALSA-N	CCCNC(=O)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)C3=CCCCC3	BroadT	BRD-K80400482	BRD-K80400482-001-01-5	Broad Institute of MIT and Harvard	BRD-K80400482			CCCNC(=O)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19-,20+/m0/s1	BSUDBHASFVKNIG-SLFFLAALSA-N	353.210327134							101982
BRD-K37461197	LSM-43469		54650173	InChI=1S/C20H19N3O2/c1-2-4-14-6-8-15(9-7-14)19-17(11-21)23(18(19)13-24)20(25)16-5-3-10-22-12-16/h2-10,12,17-19,24H,13H2,1H3/b4-2+/t17-,18-,19+/m1/s1	SONVGTXFTWWDQR-RFFLOCSQSA-N	C\C=C\c1ccc(cc1)[C@@H]2[C@@H](CO)N([C@@H]2C#N)C(=O)c3cccnc3	BroadT	BRD-K37461197	BRD-K37461197-001-01-7	Broad Institute of MIT and Harvard	BRD-K37461197			C\C=C\c1ccc(cc1)[C@@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)c1cccnc1	InChI=1S/C20H19N3O2/c1-2-4-14-6-8-15(9-7-14)19-17(11-21)23(18(19)13-24)20(25)16-5-3-10-22-12-16/h2-10,12,17-19,24H,13H2,1H3/b4-2+/t17-,18-,19+/m1/s1	SONVGTXFTWWDQR-RFFLOCSQSA-N	333.147726878							
BRD-K51993206	LSM-11610		54649947	InChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22+,23-/m0/s1	BSEGMNXKWUIHHS-ZRBLBEILSA-N	OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)c2cccc(F)c2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K51993206	BRD-K51993206-001-01-9	Broad Institute of MIT and Harvard	BRD-K51993206			OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)c1cccc(F)c1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22+,23-/m0/s1	BSEGMNXKWUIHHS-ZRBLBEILSA-N	390.174356196							100233
BRD-K68735643	LSM-12621		54650055	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16+,17-/m1/s1	NDKYDEPQZPJKDZ-IXDOHACOSA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)Nc2cccc(F)c2)c3ccccc3	BroadT	BRD-K68735643	BRD-K68735643-001-01-6	Broad Institute of MIT and Harvard	BRD-K68735643			OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)Nc1cccc(F)c1)c1ccccc1	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16+,17-/m1/s1	NDKYDEPQZPJKDZ-IXDOHACOSA-N	325.122654982							101253
BRD-K81164606-001-01-7	LSM-6853	BRD-K81164606	54649959	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19+,20+/m1/s1	NYKFFZXKZNVNOG-AABGKKOBSA-N	CCCNC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)c3ccccc3F	BroadT	BRD-K81164606	BRD-K81164606-001-01-7	Broad Institute of MIT and Harvard	BRD-K81164606			CCCNC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)-c1ccccc1F	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19+,20+/m1/s1	NYKFFZXKZNVNOG-AABGKKOBSA-N	367.169605174							95474
CHEMBL2354995	LSM-11089	BRD-K43621195, SID131446344	54649936	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23-,24-/m0/s1	NFTCJLSEEOPUCW-HJOGWXRNSA-N	OC[C@H]1[C@H]([C@H](C#N)N1C(=O)c2cccnc2)c3ccc(cc3)C#Cc4ccccc4F	BroadT	BRD-K43621195	BRD-K43621195-001-01-0	Broad Institute of MIT and Harvard	BRD-K43621195			OC[C@H]1[C@H]([C@H](C#N)N1C(=O)c1cccnc1)c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23-,24-/m0/s1	NFTCJLSEEOPUCW-HJOGWXRNSA-N	411.138305046							99710
BRD-K97910278	LSM-14445		54650096	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19-,20-/m0/s1	GQNJFXBZXQABNJ-UFYCRDLUSA-N	CC(C)NC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)c3ccc(F)cc3	BroadT	BRD-K97910278	BRD-K97910278-001-01-2	Broad Institute of MIT and Harvard	BRD-K97910278			CC(C)NC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)-c1ccc(F)cc1	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19-,20-/m0/s1	GQNJFXBZXQABNJ-UFYCRDLUSA-N	367.169605174							103100
BRD-K37316675	LSM-10683		54650042	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21+,22+/m0/s1	NDTMOTIIGWPVNE-BHDDXSALSA-N	CN(C)C(=O)c1cccc(c1)c2ccc(cc2)[C@H]3[C@@H](CO)N([C@H]3C#N)C(=O)C4CC4	BroadT	BRD-K37316675	BRD-K37316675-001-02-2	Broad Institute of MIT and Harvard	BRD-K37316675			CN(C)C(=O)c1cccc(c1)-c1ccc(cc1)[C@H]1[C@@H](CO)N([C@H]1C#N)C(=O)C1CC1	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21+,22+/m0/s1	NDTMOTIIGWPVNE-BHDDXSALSA-N	403.18959169							99304
BRD-K37879473	LSM-10722		54650015	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16+,17-/m1/s1	WYIJFLWERXFFKQ-IXDOHACOSA-N	OC[C@@H]1N[C@H](C#N)[C@H]1c2ccc(cc2)c3cccc(F)c3	BroadT	BRD-K37879473	BRD-K37879473-001-01-5	Broad Institute of MIT and Harvard	BRD-K37879473			OC[C@@H]1N[C@H](C#N)[C@H]1c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16+,17-/m1/s1	WYIJFLWERXFFKQ-IXDOHACOSA-N	282.11684132							99343
BRD-K06541323	LSM-8811		54650078	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21-,23+/m1/s1	VFHDDKSZNLSDOB-XPNTWCBSSA-N	COc1ccccc1C#Cc2ccc(cc2)[C@@H]3[C@@H](CO)N([C@@H]3C#N)C(=O)C4CC4	BroadT	BRD-K06541323	BRD-K06541323-001-01-0	Broad Institute of MIT and Harvard	BRD-K06541323			COc1ccccc1C#Cc1ccc(cc1)[C@@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)C1CC1	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21-,23+/m1/s1	VFHDDKSZNLSDOB-XPNTWCBSSA-N	386.163042584							97432
BRD-K01608965	LSM-8538		54650151	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20+,21+/m0/s1	DBVJKEGLTFFIFT-PWRODBHTSA-N	CCc1cnc(s1)N2[C@H](CO)[C@@H]([C@@H]2C#N)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K01608965	BRD-K01608965-001-02-3	Broad Institute of MIT and Harvard	BRD-K01608965			CCc1cnc(s1)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20+,21+/m0/s1	DBVJKEGLTFFIFT-PWRODBHTSA-N	379.17183314							97159
BRD-K07004447	LSM-6742		54650158	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18-,19-/m1/s1	ANDSQWRABKLSGR-GUDVDZBRSA-N	OC[C@H]1N[C@H](C#N)[C@H]1c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K07004447	BRD-K07004447-004-02-1	Broad Institute of MIT and Harvard	BRD-K07004447		Br	OC[C@H]1N[C@H](C#N)[C@H]1c1ccc(cc1)C#CC1CCCCC1.Br	InChI=1S/C19H22N2O.BrH/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14;/h8-11,14,17-19,21-22H,1-5,13H2;1H/t17-,18-,19-;/m1./s1	QLLKOZGKRQNXIM-OYXQGUJPSA-N	294.173213344							95363
BRD-K31000214	LSM-10298		54649895	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15-,16-/m0/s1	RUNWFOIXOHBRTB-JYJNAYRXSA-N	OC[C@H]1[C@H]([C@H](C#N)N1C(=O)C2CCCC2)c3ccccc3	BroadT	BRD-K31000214	BRD-K31000214-001-01-8	Broad Institute of MIT and Harvard	BRD-K31000214			OC[C@H]1[C@H]([C@H](C#N)N1C(=O)C1CCCC1)c1ccccc1	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15-,16-/m0/s1	RUNWFOIXOHBRTB-JYJNAYRXSA-N	284.1524779							98919
BRD-K47029744	LSM-11298		54650129	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16+,17+/m1/s1	LIAUQGYQVCFFMZ-IKGGRYGDSA-N	OC[C@H]1[C@H]([C@@H](C#N)N1S(=O)(=O)c2ccc(F)cc2)c3ccccc3	BroadT	BRD-K47029744	BRD-K47029744-001-01-8	Broad Institute of MIT and Harvard	BRD-K47029744			OC[C@H]1[C@H]([C@@H](C#N)N1S(=O)(=O)c1ccc(F)cc1)c1ccccc1	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16+,17+/m1/s1	LIAUQGYQVCFFMZ-IKGGRYGDSA-N	346.07874125							99919
CHEMBL2355432	LSM-12125	BRD-K61082257, SID131446407	54649998	InChI=1S/C26H21N3O3/c1-32-21-6-4-5-19(15-21)9-8-18-10-12-20(13-11-18)25-23(16-27)29(24(25)17-30)26(31)22-7-2-3-14-28-22/h2-7,10-15,23-25,30H,17H2,1H3/t23-,24-,25+/m1/s1	RQNIZPLHIPGYGU-SDHSZQHLSA-N	COc1cccc(c1)C#Cc2ccc(cc2)[C@@H]3[C@@H](CO)N([C@@H]3C#N)C(=O)c4ccccn4	BroadT	BRD-K61082257	BRD-K61082257-001-01-7	Broad Institute of MIT and Harvard	BRD-K61082257			COc1cccc(c1)C#Cc1ccc(cc1)[C@@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)c1ccccn1	InChI=1S/C26H21N3O3/c1-32-21-6-4-5-19(15-21)9-8-18-10-12-20(13-11-18)25-23(16-27)29(24(25)17-30)26(31)22-7-2-3-14-28-22/h2-7,10-15,23-25,30H,17H2,1H3/t23-,24-,25+/m1/s1	RQNIZPLHIPGYGU-SDHSZQHLSA-N	423.158291562							100751
BRD-K18746324	LSM-9553		54650137	InChI=1S/C24H25N3O2/c25-15-21-24(20-8-6-19(7-9-20)18-4-2-1-3-5-18)22(16-28)27(21)23(29)14-17-10-12-26-13-11-17/h4,6-13,21-22,24,28H,1-3,5,14,16H2/t21-,22+,24-/m1/s1	GMLMGXOKFZUTJK-AOHZBQACSA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)Cc2ccncc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K18746324	BRD-K18746324-001-01-0	Broad Institute of MIT and Harvard	BRD-K18746324			OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)Cc1ccncc1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C24H25N3O2/c25-15-21-24(20-8-6-19(7-9-20)18-4-2-1-3-5-18)22(16-28)27(21)23(29)14-17-10-12-26-13-11-17/h4,6-13,21-22,24,28H,1-3,5,14,16H2/t21-,22+,24-/m1/s1	GMLMGXOKFZUTJK-AOHZBQACSA-N	387.19467707							98174
BRD-K45295352	LSM-11184		54650095	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19+,20-/m0/s1	GQNJFXBZXQABNJ-ZCNNSNEGSA-N	CC(C)NC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)c3ccc(F)cc3	BroadT	BRD-K45295352	BRD-K45295352-001-01-0	Broad Institute of MIT and Harvard	BRD-K45295352			CC(C)NC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)-c1ccc(F)cc1	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19+,20-/m0/s1	GQNJFXBZXQABNJ-ZCNNSNEGSA-N	367.169605174							99805
BRD-K65968843	LSM-12451		54649948	InChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22+,23+/m1/s1	BSEGMNXKWUIHHS-VJBWXMMDSA-N	OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)c2cccc(F)c2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K65968843	BRD-K65968843-001-01-4	Broad Institute of MIT and Harvard	BRD-K65968843			OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)c1cccc(F)c1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22+,23+/m1/s1	BSEGMNXKWUIHHS-VJBWXMMDSA-N	390.174356196							101079
BRD-K29611469	LSM-10223		54650050	InChI=1S/C22H26N2O3/c23-13-19-21(17-7-5-16(6-8-17)15-3-1-2-4-15)20(14-25)24(19)22(26)18-9-11-27-12-10-18/h3,5-8,18-21,25H,1-2,4,9-12,14H2/t19-,20+,21+/m1/s1	RYSHWXRXFKBMCF-HKBOAZHASA-N	OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)C2CCOCC2)c3ccc(cc3)C4=CCCC4	BroadT	BRD-K29611469	BRD-K29611469-001-01-8	Broad Institute of MIT and Harvard	BRD-K29611469			OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)C1CCOCC1)c1ccc(cc1)C1=CCCC1	InChI=1S/C22H26N2O3/c23-13-19-21(17-7-5-16(6-8-17)15-3-1-2-4-15)20(14-25)24(19)22(26)18-9-11-27-12-10-18/h3,5-8,18-21,25H,1-2,4,9-12,14H2/t19-,20+,21+/m1/s1	RYSHWXRXFKBMCF-HKBOAZHASA-N	366.194342712							98844
BRD-K47234370	LSM-11314		54649892	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15+,16-/m0/s1	RUNWFOIXOHBRTB-XHSDSOJGSA-N	OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)C2CCCC2)c3ccccc3	BroadT	BRD-K47234370	BRD-K47234370-001-01-5	Broad Institute of MIT and Harvard	BRD-K47234370			OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)C1CCCC1)c1ccccc1	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15+,16-/m0/s1	RUNWFOIXOHBRTB-XHSDSOJGSA-N	284.1524779							99935
BRD-K31126514	LSM-10309		54650196	InChI=1S/C23H29N3O2/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28)/t20-,21+,22-/m1/s1	FHQNTJUBGIRGFL-BHIFYINESA-N	CC(C)NC(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K31126514	BRD-K31126514-001-01-8	Broad Institute of MIT and Harvard	BRD-K31126514			CC(C)NC(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C#CC1CCCCC1	InChI=1S/C23H29N3O2/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28)/t20-,21+,22-/m1/s1	FHQNTJUBGIRGFL-BHIFYINESA-N	379.225977198							98930
BRD-K51895259	LSM-11605		54650204	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20+,21-/m0/s1	IQRVCTXELZIWDH-HBMCJLEFSA-N	CCc1cnc(s1)N2[C@H](CO)[C@H]([C@@H]2C#N)c3ccc(cc3)c4cccc(F)c4	BroadT	BRD-K51895259	BRD-K51895259-001-01-2	Broad Institute of MIT and Harvard	BRD-K51895259			CCc1cnc(s1)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20+,21-/m0/s1	IQRVCTXELZIWDH-HBMCJLEFSA-N	393.13111118							100228
BRD-K97008061	LSM-14386		54650073	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16-,17-/m0/s1	BPKNALSRVQDTLI-ULQDDVLXSA-N	OC[C@H]1[C@H]([C@H](C#N)N1C(=O)c2ccccc2F)c3ccccc3	BroadT	BRD-K97008061	BRD-K97008061-001-01-6	Broad Institute of MIT and Harvard	BRD-K97008061			OC[C@H]1[C@H]([C@H](C#N)N1C(=O)c1ccccc1F)c1ccccc1	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16-,17-/m0/s1	BPKNALSRVQDTLI-ULQDDVLXSA-N	310.11175594							103040
BRD-K00124439	LSM-8431		54649967	InChI=1S/C23H21N3O2/c24-14-20-23(18-10-8-17(9-11-18)7-6-16-4-5-16)21(15-27)26(20)22(28)13-19-3-1-2-12-25-19/h1-3,8-12,16,20-21,23,27H,4-5,13,15H2/t20-,21-,23-/m0/s1	FLQYRXYGAVUNDA-FUDKSRODSA-N	OC[C@H]1[C@H]([C@H](C#N)N1C(=O)Cc2ccccn2)c3ccc(cc3)C#CC4CC4	BroadT	BRD-K00124439	BRD-K00124439-001-01-2	Broad Institute of MIT and Harvard	BRD-K00124439			OC[C@H]1[C@H]([C@H](C#N)N1C(=O)Cc1ccccn1)c1ccc(cc1)C#CC1CC1	InChI=1S/C23H21N3O2/c24-14-20-23(18-10-8-17(9-11-18)7-6-16-4-5-16)21(15-27)26(20)22(28)13-19-3-1-2-12-25-19/h1-3,8-12,16,20-21,23,27H,4-5,13,15H2/t20-,21-,23-/m0/s1	FLQYRXYGAVUNDA-FUDKSRODSA-N	371.163376942							97052
BRD-K81956993	LSM-14946		54649906	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19+,20+/m1/s1	DBBLKINRPPNEJI-AABGKKOBSA-N	CCc1cnc(s1)N2[C@@H](CO)[C@H]([C@H]2C#N)c3ccc(cc3)C#CC(C)C	BroadT	BRD-K81956993	BRD-K81956993-001-01-7	Broad Institute of MIT and Harvard	BRD-K81956993			CCc1cnc(s1)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)C#CC(C)C	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19+,20+/m1/s1	DBBLKINRPPNEJI-AABGKKOBSA-N	365.156183076							103602
BRD-K37957530	LSM-10727		54650108	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16+,18+/m1/s1	MOIIHOSYSQGYMW-RYRKJORJSA-N	COc1ccccc1NC(=O)N2[C@@H](CO)[C@H]([C@H]2C#N)c3ccccc3	BroadT	BRD-K37957530	BRD-K37957530-001-01-0	Broad Institute of MIT and Harvard	BRD-K37957530			COc1ccccc1NC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccccc1	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16+,18+/m1/s1	MOIIHOSYSQGYMW-RYRKJORJSA-N	337.142641498							99348
BRD-K89141537	LSM-13916		54649924	InChI=1S/C21H23N3O4S/c1-23(2)21(26)17-10-6-15(7-11-17)14-4-8-16(9-5-14)20-18(12-22)24(19(20)13-25)29(3,27)28/h4-11,18-20,25H,13H2,1-3H3/t18-,19-,20+/m0/s1	DINYZOMRIFESDL-SLFFLAALSA-N	CN(C)C(=O)c1ccc(cc1)c2ccc(cc2)[C@H]3[C@H](CO)N([C@H]3C#N)S(=O)(=O)C	BroadT	BRD-K89141537	BRD-K89141537-001-01-1	Broad Institute of MIT and Harvard	BRD-K89141537			CN(C)C(=O)c1ccc(cc1)-c1ccc(cc1)[C@H]1[C@H](CO)N([C@H]1C#N)S(C)(=O)=O	InChI=1S/C21H23N3O4S/c1-23(2)21(26)17-10-6-15(7-11-17)14-4-8-16(9-5-14)20-18(12-22)24(19(20)13-25)29(3,27)28/h4-11,18-20,25H,13H2,1-3H3/t18-,19-,20+/m0/s1	DINYZOMRIFESDL-SLFFLAALSA-N	413.140926936							102569
BRD-K29746329	LSM-10233		54650043	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21-,22-/m1/s1	NDTMOTIIGWPVNE-YPAWHYETSA-N	CN(C)C(=O)c1cccc(c1)c2ccc(cc2)[C@H]3[C@@H](CO)N([C@@H]3C#N)C(=O)C4CC4	BroadT	BRD-K29746329	BRD-K29746329-001-02-0	Broad Institute of MIT and Harvard	BRD-K29746329			CN(C)C(=O)c1cccc(c1)-c1ccc(cc1)[C@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)C1CC1	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21-,22-/m1/s1	NDTMOTIIGWPVNE-YPAWHYETSA-N	403.18959169							98854
BRD-K60539617	LSM-6754		54650176	InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18+,19+/m0/s1	BQRBXGWYUGGWQF-IPMKNSEASA-N	OC[C@H]1N[C@@H](C#N)[C@H]1c2ccc(cc2)C#Cc3ccccc3F	BroadT	BRD-K60539617	BRD-K60539617-004-02-4	Broad Institute of MIT and Harvard	BRD-K60539617		Br	OC[C@H]1N[C@@H](C#N)[C@H]1c1ccc(cc1)C#Cc1ccccc1F.Br	InChI=1S/C19H15FN2O.BrH/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23;/h1-4,6-7,9-10,17-19,22-23H,12H2;1H/t17-,18+,19+;/m0./s1	ICMPQENXYQPVRQ-JQPLGUQCSA-N	306.11684132							95375
BRD-K55749829	LSM-43479		54649953	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17-,18+/m1/s1	SLFKQKCTISPXPS-UDGIKMKVSA-N	CCc1csc(n1)N2[C@H](CO)[C@H]([C@H]2C#N)c3ccc(\C=C\C)cc3	BroadT	BRD-K55749829	BRD-K55749829-001-01-8	Broad Institute of MIT and Harvard	BRD-K55749829			CCc1csc(n1)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)\C=C\C	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17-,18+/m1/s1	SLFKQKCTISPXPS-UDGIKMKVSA-N	339.140533012							
BRD-K45932120	LSM-11229		54650005	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22+,23+/m0/s1	POAXSVANNSAIAV-YTFSRNRJSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1S(=O)(=O)c2ccccc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K45932120	BRD-K45932120-001-01-9	Broad Institute of MIT and Harvard	BRD-K45932120			OC[C@@H]1[C@@H]([C@H](C#N)N1S(=O)(=O)c1ccccc1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22+,23+/m0/s1	POAXSVANNSAIAV-YTFSRNRJSA-N	408.150763338							99850
BRD-K35702939	LSM-10570		54649984	InChI=1S/C25H29N3O3/c1-31-21-13-11-18(12-14-21)17-7-9-19(10-8-17)24-22(15-26)28(23(24)16-29)25(30)27-20-5-3-2-4-6-20/h7-14,20,22-24,29H,2-6,16H2,1H3,(H,27,30)/t22-,23-,24+/m1/s1	UEJLJRRJJUOYFY-SMIHKQSGSA-N	COc1ccc(cc1)c2ccc(cc2)[C@@H]3[C@@H](CO)N([C@@H]3C#N)C(=O)NC4CCCCC4	BroadT	BRD-K35702939	BRD-K35702939-001-01-9	Broad Institute of MIT and Harvard	BRD-K35702939			COc1ccc(cc1)-c1ccc(cc1)[C@@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)NC1CCCCC1	InChI=1S/C25H29N3O3/c1-31-21-13-11-18(12-14-21)17-7-9-19(10-8-17)24-22(15-26)28(23(24)16-29)25(30)27-20-5-3-2-4-6-20/h7-14,20,22-24,29H,2-6,16H2,1H3,(H,27,30)/t22-,23-,24+/m1/s1	UEJLJRRJJUOYFY-SMIHKQSGSA-N	419.220891818							99191
BRD-K14974894	LSM-9328		54649938	InChI=1S/C17H20N2O/c18-10-15-17(16(11-20)19-15)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h4,6-9,15-17,19-20H,1-3,5,11H2/t15-,16-,17+/m0/s1	SIGXZWYEWAPHMA-YESZJQIVSA-N	OC[C@@H]1N[C@@H](C#N)[C@H]1c2ccc(cc2)C3=CCCCC3	BroadT	BRD-K14974894	BRD-K14974894-001-01-2	Broad Institute of MIT and Harvard	BRD-K14974894			OC[C@@H]1N[C@@H](C#N)[C@H]1c1ccc(cc1)C1=CCCCC1	InChI=1S/C17H20N2O/c18-10-15-17(16(11-20)19-15)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h4,6-9,15-17,19-20H,1-3,5,11H2/t15-,16-,17+/m0/s1	SIGXZWYEWAPHMA-YESZJQIVSA-N	268.15756328							97949
BRD-K36078054	LSM-10603		54649904	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19-,20-/m0/s1	DBBLKINRPPNEJI-UFYCRDLUSA-N	CCc1cnc(s1)N2[C@@H](CO)[C@H]([C@@H]2C#N)c3ccc(cc3)C#CC(C)C	BroadT	BRD-K36078054	BRD-K36078054-001-01-2	Broad Institute of MIT and Harvard	BRD-K36078054			CCc1cnc(s1)N1[C@@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C#CC(C)C	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19-,20-/m0/s1	DBBLKINRPPNEJI-UFYCRDLUSA-N	365.156183076							99224
BRD-K66642908	LSM-43489		54649943	InChI=1S/C20H25N3O3/c1-2-3-15-4-6-16(7-5-15)20-17(12-21)23(18(20)14-24)19(25)13-22-8-10-26-11-9-22/h2-7,17-18,20,24H,8-11,13-14H2,1H3/b3-2+/t17-,18+,20-/m1/s1	KJLVFPZXKUGLPF-XAAJGVHKSA-N	C\C=C\c1ccc(cc1)[C@H]2[C@H](CO)N([C@@H]2C#N)C(=O)CN3CCOCC3	BroadT	BRD-K66642908	BRD-K66642908-001-01-6	Broad Institute of MIT and Harvard	BRD-K66642908			C\C=C\c1ccc(cc1)[C@H]1[C@H](CO)N([C@@H]1C#N)C(=O)CN1CCOCC1	InChI=1S/C20H25N3O3/c1-2-3-15-4-6-16(7-5-15)20-17(12-21)23(18(20)14-24)19(25)13-22-8-10-26-11-9-22/h2-7,17-18,20,24H,8-11,13-14H2,1H3/b3-2+/t17-,18+,20-/m1/s1	KJLVFPZXKUGLPF-XAAJGVHKSA-N	355.18959169							
CHEMBL2362352	LSM-9333	BRD-K15108654, SID131446343	54649935	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23-,24+/m1/s1	NFTCJLSEEOPUCW-SMIHKQSGSA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)c2cccnc2)c3ccc(cc3)C#Cc4ccccc4F	BroadT	BRD-K15108654	BRD-K15108654-001-01-6	Broad Institute of MIT and Harvard	BRD-K15108654			OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)c1cccnc1)c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23-,24+/m1/s1	NFTCJLSEEOPUCW-SMIHKQSGSA-N	411.138305046							97954
BRD-K36232701	LSM-43468		54649909	InChI=1S/C20H19FN2O3S/c1-2-4-14-7-9-15(10-8-14)20-18(12-22)23(19(20)13-24)27(25,26)17-6-3-5-16(21)11-17/h2-11,18-20,24H,13H2,1H3/b4-2+/t18-,19+,20+/m0/s1	CRECGCTYSBAAAJ-VXEPRYIESA-N	C\C=C\c1ccc(cc1)[C@H]2[C@@H](CO)N([C@H]2C#N)S(=O)(=O)c3cccc(F)c3	BroadT	BRD-K36232701	BRD-K36232701-001-01-2	Broad Institute of MIT and Harvard	BRD-K36232701			C\C=C\c1ccc(cc1)[C@H]1[C@@H](CO)N([C@H]1C#N)S(=O)(=O)c1cccc(F)c1	InChI=1S/C20H19FN2O3S/c1-2-4-14-7-9-15(10-8-14)20-18(12-22)23(19(20)13-24)27(25,26)17-6-3-5-16(21)11-17/h2-11,18-20,24H,13H2,1H3/b4-2+/t18-,19+,20+/m0/s1	CRECGCTYSBAAAJ-VXEPRYIESA-N	386.110041378							
BRD-K30628839	LSM-10271		54650102	InChI=1S/C23H20N4O2/c24-11-20-23(18-8-6-17(7-9-18)19-12-25-15-26-13-19)21(14-28)27(20)22(29)10-16-4-2-1-3-5-16/h1-9,12-13,15,20-21,23,28H,10,14H2/t20-,21+,23-/m0/s1	OPKRCVVELWLOIA-XJUOHMSHSA-N	OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)Cc2ccccc2)c3ccc(cc3)c4cncnc4	BroadT	BRD-K30628839	BRD-K30628839-001-01-2	Broad Institute of MIT and Harvard	BRD-K30628839			OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)Cc1ccccc1)c1ccc(cc1)-c1cncnc1	InChI=1S/C23H20N4O2/c24-11-20-23(18-8-6-17(7-9-18)19-12-25-15-26-13-19)21(14-28)27(20)22(29)10-16-4-2-1-3-5-16/h1-9,12-13,15,20-21,23,28H,10,14H2/t20-,21+,23-/m0/s1	OPKRCVVELWLOIA-XJUOHMSHSA-N	384.15862592							98892
BRD-K05688054	LSM-8763		54650020	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15-,18-/m1/s1	NUSFKYNBTAYYBW-IIDMSEBBSA-N	OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)c2ccc3OCOc3c2)c4ccccc4	BroadT	BRD-K05688054	BRD-K05688054-001-02-3	Broad Institute of MIT and Harvard	BRD-K05688054			OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)c1ccc2OCOc2c1)c1ccccc1	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15-,18-/m1/s1	NUSFKYNBTAYYBW-IIDMSEBBSA-N	336.111007012							97384
BRD-K24776817	LSM-9934		54650009	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22+,23+/m1/s1	POAXSVANNSAIAV-VJBWXMMDSA-N	OC[C@H]1[C@H]([C@@H](C#N)N1S(=O)(=O)c2ccccc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K24776817	BRD-K24776817-001-01-3	Broad Institute of MIT and Harvard	BRD-K24776817			OC[C@H]1[C@H]([C@@H](C#N)N1S(=O)(=O)c1ccccc1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22+,23+/m1/s1	POAXSVANNSAIAV-VJBWXMMDSA-N	408.150763338							98555
BRD-K63301075	LSM-12280		54649989	InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19-,22-/m0/s1	IQHJIJSRQPJLPZ-IPJJNNNSSA-N	COc1ccccc1c2ccc(cc2)[C@@H]3[C@H](CO)N([C@H]3C#N)C(=O)CN(C)C	BroadT	BRD-K63301075	BRD-K63301075-001-01-9	Broad Institute of MIT and Harvard	BRD-K63301075			COc1ccccc1-c1ccc(cc1)[C@@H]1[C@H](CO)N([C@H]1C#N)C(=O)CN(C)C	InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19-,22-/m0/s1	IQHJIJSRQPJLPZ-IPJJNNNSSA-N	379.18959169							100906
BRD-K37530005	LSM-10697		54650044	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21+,22-/m0/s1	NDTMOTIIGWPVNE-BDTNDASRSA-N	CN(C)C(=O)c1cccc(c1)c2ccc(cc2)[C@@H]3[C@@H](CO)N([C@H]3C#N)C(=O)C4CC4	BroadT	BRD-K37530005	BRD-K37530005-001-01-1	Broad Institute of MIT and Harvard	BRD-K37530005			CN(C)C(=O)c1cccc(c1)-c1ccc(cc1)[C@@H]1[C@@H](CO)N([C@H]1C#N)C(=O)C1CC1	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21+,22-/m0/s1	NDTMOTIIGWPVNE-BDTNDASRSA-N	403.18959169							99318
BRD-K63944563	LSM-12331		54650154	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20+,21-/m1/s1	DBVJKEGLTFFIFT-QHAWAJNXSA-N	CCc1cnc(s1)N2[C@@H](CO)[C@@H]([C@H]2C#N)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K63944563	BRD-K63944563-001-01-5	Broad Institute of MIT and Harvard	BRD-K63944563			CCc1cnc(s1)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20+,21-/m1/s1	DBVJKEGLTFFIFT-QHAWAJNXSA-N	379.17183314							100958
BRD-K68325500	LSM-6759		54649965	InChI=1S/C23H21N3O2/c24-14-20-23(18-10-8-17(9-11-18)7-6-16-4-5-16)21(15-27)26(20)22(28)13-19-3-1-2-12-25-19/h1-3,8-12,16,20-21,23,27H,4-5,13,15H2/t20-,21+,23+/m0/s1	FLQYRXYGAVUNDA-QZNHQXDQSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)Cc2ccccn2)c3ccc(cc3)C#CC4CC4	BroadT	BRD-K68325500	BRD-K68325500-004-02-0	Broad Institute of MIT and Harvard	BRD-K68325500		Br	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)Cc1ccccn1)c1ccc(cc1)C#CC1CC1.Br	InChI=1S/C23H21N3O2.BrH/c24-14-20-23(18-10-8-17(9-11-18)7-6-16-4-5-16)21(15-27)26(20)22(28)13-19-3-1-2-12-25-19;/h1-3,8-12,16,20-21,23,27H,4-5,13,15H2;1H/t20-,21+,23+;/m0./s1	UUGYAGWUMIWOAW-FJKQHKIKSA-N	371.163376942							95380
BRD-K80732408	LSM-13366		54650024	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15+,18-/m0/s1	NUSFKYNBTAYYBW-DAYGRLMNSA-N	OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)c2ccc3OCOc3c2)c4ccccc4	BroadT	BRD-K80732408	BRD-K80732408-001-01-2	Broad Institute of MIT and Harvard	BRD-K80732408			OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)c1ccc2OCOc2c1)c1ccccc1	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15+,18-/m0/s1	NUSFKYNBTAYYBW-DAYGRLMNSA-N	336.111007012							102005
BRD-K38385428	LSM-10752		54650033	InChI=1S/C18H18N2O2/c1-22-17-5-3-2-4-14(17)12-6-8-13(9-7-12)18-15(10-19)20-16(18)11-21/h2-9,15-16,18,20-21H,11H2,1H3/t15-,16-,18+/m1/s1	BGJLKNVJWQWPQD-NUJGCVRESA-N	COc1ccccc1c2ccc(cc2)[C@@H]3[C@@H](CO)N[C@@H]3C#N	BroadT	BRD-K38385428	BRD-K38385428-001-01-8	Broad Institute of MIT and Harvard	BRD-K38385428			COc1ccccc1-c1ccc(cc1)[C@@H]1[C@@H](CO)N[C@@H]1C#N	InChI=1S/C18H18N2O2/c1-22-17-5-3-2-4-14(17)12-6-8-13(9-7-12)18-15(10-19)20-16(18)11-21/h2-9,15-16,18,20-21H,11H2,1H3/t15-,16-,18+/m1/s1	BGJLKNVJWQWPQD-NUJGCVRESA-N	294.136827836							99373
BRD-K77943850	LSM-6762		54650052	InChI=1S/C22H22N4O2/c1-25(2)14-21(28)26-19(12-23)22(20(26)15-27)18-9-7-16(8-10-18)5-6-17-4-3-11-24-13-17/h3-4,7-11,13,19-20,22,27H,14-15H2,1-2H3/t19-,20-,22-/m1/s1	VMSOXHKZIPRGST-KCZVDYSFSA-N	CN(C)CC(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)C#Cc3cccnc3	BroadT	BRD-K77943850	BRD-K77943850-004-02-5	Broad Institute of MIT and Harvard	BRD-K77943850		Br	CN(C)CC(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C#Cc1cccnc1.Br	InChI=1S/C22H22N4O2.BrH/c1-25(2)14-21(28)26-19(12-23)22(20(26)15-27)18-9-7-16(8-10-18)5-6-17-4-3-11-24-13-17;/h3-4,7-11,13,19-20,22,27H,14-15H2,1-2H3;1H/t19-,20-,22-;/m1./s1	XVRNPSBTGAIHPM-XLTSWDRCSA-N	374.174275984							95383
BRD-K43209476	LSM-11054		54650147	InChI=1S/C23H21FN2O2/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18/h3-5,8-12,15,20-22,27H,14H2,1-2H3/t20-,21+,22-/m0/s1	DGEMMPDKDCWCNC-BDTNDASRSA-N	CC(C)C#Cc1ccc(cc1)[C@@H]2[C@@H](CO)N([C@H]2C#N)C(=O)c3cccc(F)c3	BroadT	BRD-K43209476	BRD-K43209476-001-01-4	Broad Institute of MIT and Harvard	BRD-K43209476			CC(C)C#Cc1ccc(cc1)[C@@H]1[C@@H](CO)N([C@H]1C#N)C(=O)c1cccc(F)c1	InChI=1S/C23H21FN2O2/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18/h3-5,8-12,15,20-22,27H,14H2,1-2H3/t20-,21+,22-/m0/s1	DGEMMPDKDCWCNC-BDTNDASRSA-N	376.158706132							99675
BRD-K88402291	LSM-13867		54649963	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19-,20+/m1/s1	NYKFFZXKZNVNOG-AQNXPRMDSA-N	CCCNC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)c3ccccc3F	BroadT	BRD-K88402291	BRD-K88402291-001-01-4	Broad Institute of MIT and Harvard	BRD-K88402291			CCCNC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)-c1ccccc1F	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19-,20+/m1/s1	NYKFFZXKZNVNOG-AQNXPRMDSA-N	367.169605174							102519
BRD-K29322455	LSM-10204		54649914	InChI=1S/C25H23N3OS/c26-14-22-24(20-12-10-18(11-13-20)17-6-4-5-7-17)23(15-29)28(22)25-27-21(16-30-25)19-8-2-1-3-9-19/h1-3,6,8-13,16,22-24,29H,4-5,7,15H2/t22-,23+,24-/m0/s1	YWUOOJZCEOJKLU-VXNXHJTFSA-N	OC[C@@H]1[C@H]([C@H](C#N)N1c2nc(cs2)c3ccccc3)c4ccc(cc4)C5=CCCC5	BroadT	BRD-K29322455	BRD-K29322455-001-01-8	Broad Institute of MIT and Harvard	BRD-K29322455			OC[C@@H]1[C@H]([C@H](C#N)N1c1nc(cs1)-c1ccccc1)c1ccc(cc1)C1=CCCC1	InChI=1S/C25H23N3OS/c26-14-22-24(20-12-10-18(11-13-20)17-6-4-5-7-17)23(15-29)28(22)25-27-21(16-30-25)19-8-2-1-3-9-19/h1-3,6,8-13,16,22-24,29H,4-5,7,15H2/t22-,23+,24-/m0/s1	YWUOOJZCEOJKLU-VXNXHJTFSA-N	413.156183076							98825
BRD-K50739913	LSM-11521		54650034	InChI=1S/C18H18N2O2/c1-22-17-5-3-2-4-14(17)12-6-8-13(9-7-12)18-15(10-19)20-16(18)11-21/h2-9,15-16,18,20-21H,11H2,1H3/t15-,16+,18-/m0/s1	BGJLKNVJWQWPQD-JZXOWHBKSA-N	COc1ccccc1c2ccc(cc2)[C@@H]3[C@@H](CO)N[C@H]3C#N	BroadT	BRD-K50739913	BRD-K50739913-001-01-1	Broad Institute of MIT and Harvard	BRD-K50739913			COc1ccccc1-c1ccc(cc1)[C@@H]1[C@@H](CO)N[C@H]1C#N	InChI=1S/C18H18N2O2/c1-22-17-5-3-2-4-14(17)12-6-8-13(9-7-12)18-15(10-19)20-16(18)11-21/h2-9,15-16,18,20-21H,11H2,1H3/t15-,16+,18-/m0/s1	BGJLKNVJWQWPQD-JZXOWHBKSA-N	294.136827836							100142
BRD-K29181432	LSM-6771		54650135	InChI=1S/C24H25N3O2/c25-15-21-24(20-8-6-19(7-9-20)18-4-2-1-3-5-18)22(16-28)27(21)23(29)14-17-10-12-26-13-11-17/h4,6-13,21-22,24,28H,1-3,5,14,16H2/t21-,22-,24-/m1/s1	GMLMGXOKFZUTJK-CQOQZXRMSA-N	OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)Cc2ccncc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K29181432	BRD-K29181432-003-02-0	Broad Institute of MIT and Harvard	BRD-K29181432		Cl	OC[C@@H]1[C@@H]([C@@H](C#N)N1C(=O)Cc1ccncc1)c1ccc(cc1)C1=CCCCC1.Cl	InChI=1S/C24H25N3O2.ClH/c25-15-21-24(20-8-6-19(7-9-20)18-4-2-1-3-5-18)22(16-28)27(21)23(29)14-17-10-12-26-13-11-17;/h4,6-13,21-22,24,28H,1-3,5,14,16H2;1H/t21-,22-,24-;/m1./s1	ATJSNRYWCMPJPN-GOXMAUIJSA-N	387.19467707							95392
BRD-K36065557	LSM-10601		54649931	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23-,24+/m0/s1	NFTCJLSEEOPUCW-KMDXXIMOSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)c2cccnc2)c3ccc(cc3)C#Cc4ccccc4F	BroadT	BRD-K36065557	BRD-K36065557-001-01-1	Broad Institute of MIT and Harvard	BRD-K36065557			OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)c1cccnc1)c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23-,24+/m0/s1	NFTCJLSEEOPUCW-KMDXXIMOSA-N	411.138305046							99222
BRD-K85632805	LSM-13665		54650087	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16+,17+/m1/s1	COUPNDMEVDHIHS-IKGGRYGDSA-N	CCCC#Cc1ccc(cc1)[C@@H]2[C@H](CO)N([C@@H]2C#N)S(=O)(=O)C	BroadT	BRD-K85632805	BRD-K85632805-001-01-8	Broad Institute of MIT and Harvard	BRD-K85632805			CCCC#Cc1ccc(cc1)[C@@H]1[C@H](CO)N([C@@H]1C#N)S(C)(=O)=O	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16+,17+/m1/s1	COUPNDMEVDHIHS-IKGGRYGDSA-N	332.11946321							102312
BRD-K31220088	LSM-10315		54650019	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15+,18+/m0/s1	NUSFKYNBTAYYBW-HDMKZQKVSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)c2ccc3OCOc3c2)c4ccccc4	BroadT	BRD-K31220088	BRD-K31220088-001-01-5	Broad Institute of MIT and Harvard	BRD-K31220088			OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)c1ccc2OCOc2c1)c1ccccc1	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15+,18+/m0/s1	NUSFKYNBTAYYBW-HDMKZQKVSA-N	336.111007012							98936
BRD-K78094112	LSM-13205		54649960	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19+,20-/m1/s1	NYKFFZXKZNVNOG-HSALFYBXSA-N	CCCNC(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)c3ccccc3F	BroadT	BRD-K78094112	BRD-K78094112-001-01-8	Broad Institute of MIT and Harvard	BRD-K78094112			CCCNC(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)-c1ccccc1F	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19+,20-/m1/s1	NYKFFZXKZNVNOG-HSALFYBXSA-N	367.169605174							101843
BRD-K03785392	LSM-8664		54649921	InChI=1S/C21H26N2O3S/c1-2-27(25,26)23-19(14-22)21(20(23)15-24)18-12-10-17(11-13-18)9-5-8-16-6-3-4-7-16/h10-13,16,19-21,24H,2-4,6-8,15H2,1H3/t19-,20+,21-/m1/s1	FMUUBOBUXMLTIS-QHAWAJNXSA-N	CCS(=O)(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)C#CCC3CCCC3	BroadT	BRD-K03785392	BRD-K03785392-001-01-2	Broad Institute of MIT and Harvard	BRD-K03785392			CCS(=O)(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C#CCC1CCCC1	InChI=1S/C21H26N2O3S/c1-2-27(25,26)23-19(14-22)21(20(23)15-24)18-12-10-17(11-13-18)9-5-8-16-6-3-4-7-16/h10-13,16,19-21,24H,2-4,6-8,15H2,1H3/t19-,20+,21-/m1/s1	FMUUBOBUXMLTIS-QHAWAJNXSA-N	386.166413402							97285
BRD-K39376673-001-02-6	LSM-43471	BRD-K39376673	54649985	InChI=1S/C19H18N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h1-11,17-19,21-22H,13H2/b7-6+/t17-,18-,19-/m1/s1	XJSDSDQJCAYADY-IOIJZZRGSA-N	OC[C@H]1N[C@H](C#N)[C@H]1c2ccc(\C=C\c3ccccc3)cc2	BroadT	BRD-K39376673	BRD-K39376673-001-04-2	Broad Institute of MIT and Harvard	BRD-K39376673			OC[C@H]1N[C@H](C#N)[C@H]1c1ccc(\C=C\c2ccccc2)cc1	InChI=1S/C19H18N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h1-11,17-19,21-22H,13H2/b7-6+/t17-,18-,19-/m1/s1	XJSDSDQJCAYADY-IOIJZZRGSA-N	290.141913216							
BRD-K52785744-001-01-7	LSM-6837	BRD-K52785744	54650184	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19+,20+/m1/s1	BSUDBHASFVKNIG-AABGKKOBSA-N	CCCNC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)C3=CCCCC3	BroadT	BRD-K52785744	BRD-K52785744-001-01-7	Broad Institute of MIT and Harvard	BRD-K52785744			CCCNC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19+,20+/m1/s1	BSUDBHASFVKNIG-AABGKKOBSA-N	353.210327134							95458
BRD-K66729212	LSM-12492		54650010	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22+,23-/m0/s1	POAXSVANNSAIAV-ZRBLBEILSA-N	OC[C@@H]1[C@H]([C@H](C#N)N1S(=O)(=O)c2ccccc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K66729212	BRD-K66729212-001-01-2	Broad Institute of MIT and Harvard	BRD-K66729212			OC[C@@H]1[C@H]([C@H](C#N)N1S(=O)(=O)c1ccccc1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22+,23-/m0/s1	POAXSVANNSAIAV-ZRBLBEILSA-N	408.150763338							101123
BRD-K34382714	LSM-10500		54650168	InChI=1S/C22H21N3O2/c23-13-19-21(17-10-8-16(9-11-17)15-5-1-2-6-15)20(14-26)25(19)22(27)18-7-3-4-12-24-18/h3-5,7-12,19-21,26H,1-2,6,14H2/t19-,20+,21-/m0/s1	MYJKJHLNWUIKMG-HBMCJLEFSA-N	OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)c2ccccn2)c3ccc(cc3)C4=CCCC4	BroadT	BRD-K34382714	BRD-K34382714-001-01-2	Broad Institute of MIT and Harvard	BRD-K34382714			OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)c1ccccn1)c1ccc(cc1)C1=CCCC1	InChI=1S/C22H21N3O2/c23-13-19-21(17-10-8-16(9-11-17)15-5-1-2-6-15)20(14-26)25(19)22(27)18-7-3-4-12-24-18/h3-5,7-12,19-21,26H,1-2,6,14H2/t19-,20+,21-/m0/s1	MYJKJHLNWUIKMG-HBMCJLEFSA-N	359.163376942							99121
BRD-K28530075	LSM-10156		54649897	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15-,16+/m1/s1	RUNWFOIXOHBRTB-OAGGEKHMSA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)C2CCCC2)c3ccccc3	BroadT	BRD-K28530075	BRD-K28530075-001-01-7	Broad Institute of MIT and Harvard	BRD-K28530075			OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)C1CCCC1)c1ccccc1	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15-,16+/m1/s1	RUNWFOIXOHBRTB-OAGGEKHMSA-N	284.1524779							98777
BRD-K24062021	LSM-9882		54650012	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16-,17-/m1/s1	WYIJFLWERXFFKQ-BRWVUGGUSA-N	OC[C@H]1N[C@H](C#N)[C@H]1c2ccc(cc2)c3cccc(F)c3	BroadT	BRD-K24062021	BRD-K24062021-001-02-8	Broad Institute of MIT and Harvard	BRD-K24062021			OC[C@H]1N[C@H](C#N)[C@H]1c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16-,17-/m1/s1	WYIJFLWERXFFKQ-BRWVUGGUSA-N	282.11684132							98503
BRD-K93896332	LSM-14188		54650045	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21+,22+/m1/s1	NDTMOTIIGWPVNE-FSSWDIPSSA-N	CN(C)C(=O)c1cccc(c1)c2ccc(cc2)[C@@H]3[C@H](CO)N([C@@H]3C#N)C(=O)C4CC4	BroadT	BRD-K93896332	BRD-K93896332-001-01-1	Broad Institute of MIT and Harvard	BRD-K93896332			CN(C)C(=O)c1cccc(c1)-c1ccc(cc1)[C@@H]1[C@H](CO)N([C@@H]1C#N)C(=O)C1CC1	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21+,22+/m1/s1	NDTMOTIIGWPVNE-FSSWDIPSSA-N	403.18959169							102842
BRD-K41539131	LSM-10949		54649925	InChI=1S/C21H23N3O4S/c1-23(2)21(26)17-10-6-15(7-11-17)14-4-8-16(9-5-14)20-18(12-22)24(19(20)13-25)29(3,27)28/h4-11,18-20,25H,13H2,1-3H3/t18-,19-,20+/m1/s1	DINYZOMRIFESDL-AQNXPRMDSA-N	CN(C)C(=O)c1ccc(cc1)c2ccc(cc2)[C@@H]3[C@@H](CO)N([C@@H]3C#N)S(=O)(=O)C	BroadT	BRD-K41539131	BRD-K41539131-001-01-3	Broad Institute of MIT and Harvard	BRD-K41539131			CN(C)C(=O)c1ccc(cc1)-c1ccc(cc1)[C@@H]1[C@@H](CO)N([C@@H]1C#N)S(C)(=O)=O	InChI=1S/C21H23N3O4S/c1-23(2)21(26)17-10-6-15(7-11-17)14-4-8-16(9-5-14)20-18(12-22)24(19(20)13-25)29(3,27)28/h4-11,18-20,25H,13H2,1-3H3/t18-,19-,20+/m1/s1	DINYZOMRIFESDL-AQNXPRMDSA-N	413.140926936							99570
BRD-K11401713	LSM-9120		54649894	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15-,16+/m0/s1	RUNWFOIXOHBRTB-HRCADAONSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)C2CCCC2)c3ccccc3	BroadT	BRD-K11401713	BRD-K11401713-001-01-8	Broad Institute of MIT and Harvard	BRD-K11401713			OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)C1CCCC1)c1ccccc1	InChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15-,16+/m0/s1	RUNWFOIXOHBRTB-HRCADAONSA-N	284.1524779							97741
BRD-K62732905	LSM-12236		54649969	InChI=1S/C16H17N3OS/c1-10-11(2)21-16(18-10)19-13(8-17)15(14(19)9-20)12-6-4-3-5-7-12/h3-7,13-15,20H,9H2,1-2H3/t13-,14-,15+/m0/s1	AVGQIEGBBUBHIP-SOUVJXGZSA-N	Cc1nc(sc1C)N2[C@@H](CO)[C@@H]([C@@H]2C#N)c3ccccc3	BroadT	BRD-K62732905	BRD-K62732905-001-01-2	Broad Institute of MIT and Harvard	BRD-K62732905			Cc1nc(sc1C)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c1ccccc1	InChI=1S/C16H17N3OS/c1-10-11(2)21-16(18-10)19-13(8-17)15(14(19)9-20)12-6-4-3-5-7-12/h3-7,13-15,20H,9H2,1-2H3/t13-,14-,15+/m0/s1	AVGQIEGBBUBHIP-SOUVJXGZSA-N	299.109232884							100862
BRD-K81123598	LSM-6764		54650122	InChI=1S/C21H19FN2O3S/c1-2-28(26,27)24-19(13-23)21(20(24)14-25)17-11-8-15(9-12-17)7-10-16-5-3-4-6-18(16)22/h3-6,8-9,11-12,19-21,25H,2,14H2,1H3/t19-,20-,21-/m1/s1	UCQARJGLVBPITC-NJDAHSKKSA-N	CCS(=O)(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)C#Cc3ccccc3F	BroadT	BRD-K81123598	BRD-K81123598-004-02-5	Broad Institute of MIT and Harvard	BRD-K81123598		Br	CCS(=O)(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C#Cc1ccccc1F.Br	InChI=1S/C21H19FN2O3S.BrH/c1-2-28(26,27)24-19(13-23)21(20(24)14-25)17-11-8-15(9-12-17)7-10-16-5-3-4-6-18(16)22;/h3-6,8-9,11-12,19-21,25H,2,14H2,1H3;1H/t19-,20-,21-;/m1./s1	VQAVLAMZTIEDCY-UOUVWZHNSA-N	398.110041378							95385
BRD-K37225211	LSM-10676		54649990	InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19-,22+/m0/s1	IQHJIJSRQPJLPZ-CNNODRBYSA-N	COc1ccccc1c2ccc(cc2)[C@H]3[C@H](CO)N([C@H]3C#N)C(=O)CN(C)C	BroadT	BRD-K37225211	BRD-K37225211-001-01-8	Broad Institute of MIT and Harvard	BRD-K37225211			COc1ccccc1-c1ccc(cc1)[C@H]1[C@H](CO)N([C@H]1C#N)C(=O)CN(C)C	InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19-,22+/m0/s1	IQHJIJSRQPJLPZ-CNNODRBYSA-N	379.18959169							99297
BRD-K33217566	LSM-10446		54650013	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16+,17+/m0/s1	WYIJFLWERXFFKQ-GVDBMIGSSA-N	OC[C@H]1N[C@@H](C#N)[C@H]1c2ccc(cc2)c3cccc(F)c3	BroadT	BRD-K33217566	BRD-K33217566-001-02-8	Broad Institute of MIT and Harvard	BRD-K33217566			OC[C@H]1N[C@@H](C#N)[C@H]1c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16+,17+/m0/s1	WYIJFLWERXFFKQ-GVDBMIGSSA-N	282.11684132							99067
BRD-K93584503	LSM-6767		54650001	InChI=1S/C23H22N2O3/c1-28-13-5-8-17-9-11-19(12-10-17)23-20(15-24)25(21(23)16-26)22(27)14-18-6-3-2-4-7-18/h2-4,6-7,9-12,20-21,23,26H,13-14,16H2,1H3/t20-,21-,23-/m1/s1	ZCPNEUJBLOUKDH-MQSCRBSSSA-N	COCC#Cc1ccc(cc1)[C@H]2[C@@H](CO)N([C@@H]2C#N)C(=O)Cc3ccccc3	BroadT	BRD-K93584503	BRD-K93584503-004-02-8	Broad Institute of MIT and Harvard	BRD-K93584503		Br	COCC#Cc1ccc(cc1)[C@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)Cc1ccccc1.Br	InChI=1S/C23H22N2O3.BrH/c1-28-13-5-8-17-9-11-19(12-10-17)23-20(15-24)25(21(23)16-26)22(27)14-18-6-3-2-4-7-18;/h2-4,6-7,9-12,20-21,23,26H,13-14,16H2,1H3;1H/t20-,21-,23-;/m1./s1	RWHHVPYXXDGCCE-HMYAGPHPSA-N	374.163042584							95388
BRD-K52651393	LSM-11642		54650112	InChI=1S/C22H24N2O3/c23-13-18-20(19(14-25)24(18)21(26)17-7-8-17)16-5-3-15(4-6-16)9-12-22(27)10-1-2-11-22/h3-6,17-20,25,27H,1-2,7-8,10-11,14H2/t18-,19-,20+/m0/s1	PBPFKUQGSPUXQC-SLFFLAALSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)C2CC2)c3ccc(cc3)C#CC4(O)CCCC4	BroadT	BRD-K52651393	BRD-K52651393-001-01-5	Broad Institute of MIT and Harvard	BRD-K52651393			OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)C1CC1)c1ccc(cc1)C#CC1(O)CCCC1	InChI=1S/C22H24N2O3/c23-13-18-20(19(14-25)24(18)21(26)17-7-8-17)16-5-3-15(4-6-16)9-12-22(27)10-1-2-11-22/h3-6,17-20,25,27H,1-2,7-8,10-11,14H2/t18-,19-,20+/m0/s1	PBPFKUQGSPUXQC-SLFFLAALSA-N	364.178692648							100267
CHEMBL2361659	LSM-6755	BRD-K64190282, SID131446404	54649995	InChI=1S/C26H21N3O3/c1-32-21-6-4-5-19(15-21)9-8-18-10-12-20(13-11-18)25-23(16-27)29(24(25)17-30)26(31)22-7-2-3-14-28-22/h2-7,10-15,23-25,30H,17H2,1H3/t23-,24+,25+/m0/s1	RQNIZPLHIPGYGU-ISJGIBHGSA-N	COc1cccc(c1)C#Cc2ccc(cc2)[C@H]3[C@@H](CO)N([C@H]3C#N)C(=O)c4ccccn4	BroadT	BRD-K64190282	BRD-K64190282-004-01-8	Broad Institute of MIT and Harvard	BRD-K64190282		Br	COc1cccc(c1)C#Cc1ccc(cc1)[C@H]1[C@@H](CO)N([C@H]1C#N)C(=O)c1ccccn1.Br	InChI=1S/C26H21N3O3.BrH/c1-32-21-6-4-5-19(15-21)9-8-18-10-12-20(13-11-18)25-23(16-27)29(24(25)17-30)26(31)22-7-2-3-14-28-22;/h2-7,10-15,23-25,30H,17H2,1H3;1H/t23-,24+,25+;/m0./s1	LMIJJWMXODGMLC-UTXSYOJYSA-N	423.158291562							95376
BRD-K64513711	LSM-12367		54650002	InChI=1S/C23H22N2O3/c1-28-13-5-8-17-9-11-19(12-10-17)23-20(15-24)25(21(23)16-26)22(27)14-18-6-3-2-4-7-18/h2-4,6-7,9-12,20-21,23,26H,13-14,16H2,1H3/t20-,21-,23+/m0/s1	ZCPNEUJBLOUKDH-QNWVGRARSA-N	COCC#Cc1ccc(cc1)[C@H]2[C@H](CO)N([C@H]2C#N)C(=O)Cc3ccccc3	BroadT	BRD-K64513711	BRD-K64513711-001-01-8	Broad Institute of MIT and Harvard	BRD-K64513711			COCC#Cc1ccc(cc1)[C@H]1[C@H](CO)N([C@H]1C#N)C(=O)Cc1ccccc1	InChI=1S/C23H22N2O3/c1-28-13-5-8-17-9-11-19(12-10-17)23-20(15-24)25(21(23)16-26)22(27)14-18-6-3-2-4-7-18/h2-4,6-7,9-12,20-21,23,26H,13-14,16H2,1H3/t20-,21-,23+/m0/s1	ZCPNEUJBLOUKDH-QNWVGRARSA-N	374.163042584							100994
CHEMBL2359579	LSM-13360	BRD-K80648041, SID131446588	54650179	InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18-,19+/m1/s1	BQRBXGWYUGGWQF-QRVBRYPASA-N	OC[C@H]1N[C@H](C#N)[C@@H]1c2ccc(cc2)C#Cc3ccccc3F	BroadT	BRD-K80648041	BRD-K80648041-001-01-3	Broad Institute of MIT and Harvard	BRD-K80648041			OC[C@H]1N[C@H](C#N)[C@@H]1c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18-,19+/m1/s1	BQRBXGWYUGGWQF-QRVBRYPASA-N	306.11684132							101999
BRD-K37197256	LSM-10673		54649974	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17-,18+/m0/s1	SEDZELNMUHOWSZ-OKZBNKHCSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1S(=O)(=O)Cc2ccccc2)c3ccccc3	BroadT	BRD-K37197256	BRD-K37197256-001-01-5	Broad Institute of MIT and Harvard	BRD-K37197256			OC[C@H]1[C@@H]([C@H](C#N)N1S(=O)(=O)Cc1ccccc1)c1ccccc1	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17-,18+/m0/s1	SEDZELNMUHOWSZ-OKZBNKHCSA-N	342.103813146							99294
BRD-K30954716	LSM-10297		54650031	InChI=1S/C18H18N2O2/c1-22-17-5-3-2-4-14(17)12-6-8-13(9-7-12)18-15(10-19)20-16(18)11-21/h2-9,15-16,18,20-21H,11H2,1H3/t15-,16-,18-/m1/s1	BGJLKNVJWQWPQD-JFIYKMOQSA-N	COc1ccccc1c2ccc(cc2)[C@H]3[C@@H](CO)N[C@@H]3C#N	BroadT	BRD-K30954716	BRD-K30954716-001-02-8	Broad Institute of MIT and Harvard	BRD-K30954716			COc1ccccc1-c1ccc(cc1)[C@H]1[C@@H](CO)N[C@@H]1C#N	InChI=1S/C18H18N2O2/c1-22-17-5-3-2-4-14(17)12-6-8-13(9-7-12)18-15(10-19)20-16(18)11-21/h2-9,15-16,18,20-21H,11H2,1H3/t15-,16-,18-/m1/s1	BGJLKNVJWQWPQD-JFIYKMOQSA-N	294.136827836							98918
BRD-K21590495	LSM-9740		54650003	InChI=1S/C23H22N2O3/c1-28-13-5-8-17-9-11-19(12-10-17)23-20(15-24)25(21(23)16-26)22(27)14-18-6-3-2-4-7-18/h2-4,6-7,9-12,20-21,23,26H,13-14,16H2,1H3/t20-,21-,23+/m1/s1	ZCPNEUJBLOUKDH-XPNTWCBSSA-N	COCC#Cc1ccc(cc1)[C@@H]2[C@@H](CO)N([C@@H]2C#N)C(=O)Cc3ccccc3	BroadT	BRD-K21590495	BRD-K21590495-001-01-0	Broad Institute of MIT and Harvard	BRD-K21590495			COCC#Cc1ccc(cc1)[C@@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)Cc1ccccc1	InChI=1S/C23H22N2O3/c1-28-13-5-8-17-9-11-19(12-10-17)23-20(15-24)25(21(23)16-26)22(27)14-18-6-3-2-4-7-18/h2-4,6-7,9-12,20-21,23,26H,13-14,16H2,1H3/t20-,21-,23+/m1/s1	ZCPNEUJBLOUKDH-XPNTWCBSSA-N	374.163042584							98361
CHEMBL3186226	LSM-6747	BRD-K15464148	54650175	InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18-,19-/m1/s1	BQRBXGWYUGGWQF-GUDVDZBRSA-N	OC[C@H]1N[C@H](C#N)[C@H]1c2ccc(cc2)C#Cc3ccccc3F	BroadT	BRD-K15464148	BRD-K15464148-004-02-9	Broad Institute of MIT and Harvard	BRD-K15464148		Br	OC[C@H]1N[C@H](C#N)[C@H]1c1ccc(cc1)C#Cc1ccccc1F.Br	InChI=1S/C19H15FN2O.BrH/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23;/h1-4,6-7,9-10,17-19,22-23H,12H2;1H/t17-,18-,19-;/m1./s1	ICMPQENXYQPVRQ-OYXQGUJPSA-N	306.11684132							95368
BRD-K50014464	LSM-11471		54649962	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19-,20-/m0/s1	NYKFFZXKZNVNOG-UFYCRDLUSA-N	CCCNC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)c3ccccc3F	BroadT	BRD-K50014464	BRD-K50014464-001-01-2	Broad Institute of MIT and Harvard	BRD-K50014464			CCCNC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)-c1ccccc1F	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19-,20-/m0/s1	NYKFFZXKZNVNOG-UFYCRDLUSA-N	367.169605174							100092
BRD-K01594737	LSM-8535		54650081	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21+,23-/m1/s1	VFHDDKSZNLSDOB-FUPPJEDESA-N	COc1ccccc1C#Cc2ccc(cc2)[C@H]3[C@H](CO)N([C@@H]3C#N)C(=O)C4CC4	BroadT	BRD-K01594737	BRD-K01594737-001-01-4	Broad Institute of MIT and Harvard	BRD-K01594737			COc1ccccc1C#Cc1ccc(cc1)[C@H]1[C@H](CO)N([C@@H]1C#N)C(=O)C1CC1	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21+,23-/m1/s1	VFHDDKSZNLSDOB-FUPPJEDESA-N	386.163042584							97156
BRD-K98866561-004-01-5	LSM-6769	BRD-K98866561	54650074	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21+,23+/m0/s1	VFHDDKSZNLSDOB-QZNHQXDQSA-N	COc1ccccc1C#Cc2ccc(cc2)[C@H]3[C@@H](CO)N([C@H]3C#N)C(=O)C4CC4	BroadT	BRD-K98866561	BRD-K98866561-004-01-5	Broad Institute of MIT and Harvard	BRD-K98866561		Br	COc1ccccc1C#Cc1ccc(cc1)[C@H]1[C@@H](CO)N([C@H]1C#N)C(=O)C1CC1.Br	InChI=1S/C24H22N2O3.BrH/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19;/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3;1H/t20-,21+,23+;/m0./s1	SRWPNXFYCBVPPO-FJKQHKIKSA-N	386.163042584							95390
BRD-K08123737	LSM-8919		54649899	InChI=1S/C20H18N2O2/c1-24-17-4-2-3-15(11-17)6-5-14-7-9-16(10-8-14)20-18(12-21)22-19(20)13-23/h2-4,7-11,18-20,22-23H,13H2,1H3/t18-,19-,20+/m0/s1	XRGAKVKGJSFEJA-SLFFLAALSA-N	COc1cccc(c1)C#Cc2ccc(cc2)[C@H]3[C@H](CO)N[C@H]3C#N	BroadT	BRD-K08123737	BRD-K08123737-001-01-5	Broad Institute of MIT and Harvard	BRD-K08123737			COc1cccc(c1)C#Cc1ccc(cc1)[C@H]1[C@H](CO)N[C@H]1C#N	InChI=1S/C20H18N2O2/c1-24-17-4-2-3-15(11-17)6-5-14-7-9-16(10-8-14)20-18(12-21)22-19(20)13-23/h2-4,7-11,18-20,22-23H,13H2,1H3/t18-,19-,20+/m0/s1	XRGAKVKGJSFEJA-SLFFLAALSA-N	318.136827836							97540
BRD-K58660339	LSM-11970		54649991	InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19+,22-/m0/s1	IQHJIJSRQPJLPZ-JQVVWYNYSA-N	COc1ccccc1c2ccc(cc2)[C@@H]3[C@@H](CO)N([C@H]3C#N)C(=O)CN(C)C	BroadT	BRD-K58660339	BRD-K58660339-001-01-7	Broad Institute of MIT and Harvard	BRD-K58660339			COc1ccccc1-c1ccc(cc1)[C@@H]1[C@@H](CO)N([C@H]1C#N)C(=O)CN(C)C	InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19+,22-/m0/s1	IQHJIJSRQPJLPZ-JQVVWYNYSA-N	379.18959169							100596
BRD-K99795671	LSM-43506		54649950	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17+,18+/m0/s1	SLFKQKCTISPXPS-HQCVKXHESA-N	CCc1csc(n1)N2[C@H](CO)[C@@H]([C@@H]2C#N)c3ccc(\C=C\C)cc3	BroadT	BRD-K99795671	BRD-K99795671-001-02-6	Broad Institute of MIT and Harvard	BRD-K99795671			CCc1csc(n1)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)\C=C\C	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17+,18+/m0/s1	SLFKQKCTISPXPS-HQCVKXHESA-N	339.140533012							
BRD-K94655951	LSM-14226		54650047	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21-,22+/m1/s1	NDTMOTIIGWPVNE-VSKRKVRLSA-N	CN(C)C(=O)c1cccc(c1)c2ccc(cc2)[C@@H]3[C@@H](CO)N([C@@H]3C#N)C(=O)C4CC4	BroadT	BRD-K94655951	BRD-K94655951-001-01-0	Broad Institute of MIT and Harvard	BRD-K94655951			CN(C)C(=O)c1cccc(c1)-c1ccc(cc1)[C@@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)C1CC1	InChI=1S/C24H25N3O3/c1-26(2)23(29)19-5-3-4-18(12-19)15-6-8-16(9-7-15)22-20(13-25)27(21(22)14-28)24(30)17-10-11-17/h3-9,12,17,20-22,28H,10-11,14H2,1-2H3/t20-,21-,22+/m1/s1	NDTMOTIIGWPVNE-VSKRKVRLSA-N	403.18959169							102880
BRD-K26537262	LSM-10035		54650026	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15-,18+/m1/s1	NUSFKYNBTAYYBW-RKVPGOIHSA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)c2ccc3OCOc3c2)c4ccccc4	BroadT	BRD-K26537262	BRD-K26537262-001-01-7	Broad Institute of MIT and Harvard	BRD-K26537262			OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)c1ccc2OCOc2c1)c1ccccc1	InChI=1S/C19H16N2O4/c20-9-14-18(12-4-2-1-3-5-12)15(10-22)21(14)19(23)13-6-7-16-17(8-13)25-11-24-16/h1-8,14-15,18,22H,10-11H2/t14-,15-,18+/m1/s1	NUSFKYNBTAYYBW-RKVPGOIHSA-N	336.111007012							98656
BRD-K02694971	LSM-8605		54650066	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16+,17+/m0/s1	BPKNALSRVQDTLI-GVDBMIGSSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)c2ccccc2F)c3ccccc3	BroadT	BRD-K02694971	BRD-K02694971-001-01-6	Broad Institute of MIT and Harvard	BRD-K02694971			OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)c1ccccc1F)c1ccccc1	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16+,17+/m0/s1	BPKNALSRVQDTLI-GVDBMIGSSA-N	310.11175594							97226
BRD-K95042038	LSM-14255		54650030	InChI=1S/C18H18N2O2/c1-22-17-5-3-2-4-14(17)12-6-8-13(9-7-12)18-15(10-19)20-16(18)11-21/h2-9,15-16,18,20-21H,11H2,1H3/t15-,16+,18+/m0/s1	BGJLKNVJWQWPQD-LZLYRXPVSA-N	COc1ccccc1c2ccc(cc2)[C@H]3[C@@H](CO)N[C@H]3C#N	BroadT	BRD-K95042038	BRD-K95042038-001-02-5	Broad Institute of MIT and Harvard	BRD-K95042038			COc1ccccc1-c1ccc(cc1)[C@H]1[C@@H](CO)N[C@H]1C#N	InChI=1S/C18H18N2O2/c1-22-17-5-3-2-4-14(17)12-6-8-13(9-7-12)18-15(10-19)20-16(18)11-21/h2-9,15-16,18,20-21H,11H2,1H3/t15-,16+,18+/m0/s1	BGJLKNVJWQWPQD-LZLYRXPVSA-N	294.136827836							102909
BRD-K71533707	LSM-26287		54650834	InChI=1S/C24H25N3O3/c1-26(2)23(29)18-9-5-16(6-10-18)15-3-7-17(8-4-15)22-20(13-25)27(21(22)14-28)24(30)19-11-12-19/h3-10,19-22,28H,11-12,14H2,1-2H3/t20-,21+,22-/m1/s1	BYRAUYRNNUGPGD-BHIFYINESA-N	CN(C)C(=O)c1ccc(cc1)c2ccc(cc2)[C@H]3[C@H](CO)N([C@@H]3C#N)C(=O)C4CC4	BroadT	BRD-K71533707	BRD-K71533707-001-02-1	Broad Institute of MIT and Harvard	BRD-K71533707			CN(C)C(=O)c1ccc(cc1)-c1ccc(cc1)[C@H]1[C@H](CO)N([C@@H]1C#N)C(=O)C1CC1	InChI=1S/C24H25N3O3/c1-26(2)23(29)18-9-5-16(6-10-18)15-3-7-17(8-4-15)22-20(13-25)27(21(22)14-28)24(30)19-11-12-19/h3-10,19-22,28H,11-12,14H2,1-2H3/t20-,21+,22-/m1/s1	BYRAUYRNNUGPGD-BHIFYINESA-N	403.18959169							114825
BRD-K04367289	LSM-8695		54650092	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19-,20-/m1/s1	GQNJFXBZXQABNJ-VAMGGRTRSA-N	CC(C)NC(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)c3ccc(F)cc3	BroadT	BRD-K04367289	BRD-K04367289-001-02-2	Broad Institute of MIT and Harvard	BRD-K04367289			CC(C)NC(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)-c1ccc(F)cc1	InChI=1S/C21H22FN3O2/c1-13(2)24-21(27)25-18(11-23)20(19(25)12-26)16-5-3-14(4-6-16)15-7-9-17(22)10-8-15/h3-10,13,18-20,26H,12H2,1-2H3,(H,24,27)/t18-,19-,20-/m1/s1	GQNJFXBZXQABNJ-VAMGGRTRSA-N	367.169605174							97316
BRD-K69936629	LSM-12696		54650150	InChI=1S/C23H21FN2O2/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18/h3-5,8-12,15,20-22,27H,14H2,1-2H3/t20-,21+,22-/m1/s1	DGEMMPDKDCWCNC-BHIFYINESA-N	CC(C)C#Cc1ccc(cc1)[C@H]2[C@H](CO)N([C@@H]2C#N)C(=O)c3cccc(F)c3	BroadT	BRD-K69936629	BRD-K69936629-001-01-7	Broad Institute of MIT and Harvard	BRD-K69936629			CC(C)C#Cc1ccc(cc1)[C@H]1[C@H](CO)N([C@@H]1C#N)C(=O)c1cccc(F)c1	InChI=1S/C23H21FN2O2/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18/h3-5,8-12,15,20-22,27H,14H2,1-2H3/t20-,21+,22-/m1/s1	DGEMMPDKDCWCNC-BHIFYINESA-N	376.158706132							101330
BRD-K28035139	LSM-10128		54650159	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18-,19-/m0/s1	ANDSQWRABKLSGR-FHWLQOOXSA-N	OC[C@@H]1N[C@@H](C#N)[C@@H]1c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K28035139	BRD-K28035139-001-01-1	Broad Institute of MIT and Harvard	BRD-K28035139			OC[C@@H]1N[C@@H](C#N)[C@@H]1c1ccc(cc1)C#CC1CCCCC1	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18-,19-/m0/s1	ANDSQWRABKLSGR-FHWLQOOXSA-N	294.173213344							98749
BRD-K59605310	LSM-12030		54649994	InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19+,22+/m1/s1	IQHJIJSRQPJLPZ-DXIQSLLYSA-N	COc1ccccc1c2ccc(cc2)[C@@H]3[C@H](CO)N([C@@H]3C#N)C(=O)CN(C)C	BroadT	BRD-K59605310	BRD-K59605310-001-01-4	Broad Institute of MIT and Harvard	BRD-K59605310			COc1ccccc1-c1ccc(cc1)[C@@H]1[C@H](CO)N([C@@H]1C#N)C(=O)CN(C)C	InChI=1S/C22H25N3O3/c1-24(2)13-21(27)25-18(12-23)22(19(25)14-26)16-10-8-15(9-11-16)17-6-4-5-7-20(17)28-3/h4-11,18-19,22,26H,13-14H2,1-3H3/t18-,19+,22+/m1/s1	IQHJIJSRQPJLPZ-DXIQSLLYSA-N	379.18959169							100656
BRD-K89079417	LSM-13910		54650128	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16-,17+/m0/s1	LIAUQGYQVCFFMZ-YESZJQIVSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1S(=O)(=O)c2ccc(F)cc2)c3ccccc3	BroadT	BRD-K89079417	BRD-K89079417-001-01-8	Broad Institute of MIT and Harvard	BRD-K89079417			OC[C@H]1[C@@H]([C@H](C#N)N1S(=O)(=O)c1ccc(F)cc1)c1ccccc1	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16-,17+/m0/s1	LIAUQGYQVCFFMZ-YESZJQIVSA-N	346.07874125							102563
BRD-K27586026	LSM-10090		54650064	InChI=1S/C19H19N3O3/c1-25-12-18(24)22-16(9-20)19(17(22)11-23)14-6-4-13(5-7-14)15-3-2-8-21-10-15/h2-8,10,16-17,19,23H,11-12H2,1H3/t16-,17+,19-/m0/s1	NONDGOMIDWLUNU-SCTDSRPQSA-N	COCC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)c3cccnc3	BroadT	BRD-K27586026	BRD-K27586026-001-01-0	Broad Institute of MIT and Harvard	BRD-K27586026			COCC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)-c1cccnc1	InChI=1S/C19H19N3O3/c1-25-12-18(24)22-16(9-20)19(17(22)11-23)14-6-4-13(5-7-14)15-3-2-8-21-10-15/h2-8,10,16-17,19,23H,11-12H2,1H3/t16-,17+,19-/m0/s1	NONDGOMIDWLUNU-SCTDSRPQSA-N	337.142641498							98711
BRD-K17745445	LSM-43453		54650171	InChI=1S/C20H19N3O2/c1-2-4-14-6-8-15(9-7-14)19-17(11-21)23(18(19)13-24)20(25)16-5-3-10-22-12-16/h2-10,12,17-19,24H,13H2,1H3/b4-2+/t17-,18-,19-/m1/s1	SONVGTXFTWWDQR-RVONUSJBSA-N	C\C=C\c1ccc(cc1)[C@H]2[C@@H](CO)N([C@@H]2C#N)C(=O)c3cccnc3	BroadT	BRD-K17745445	BRD-K17745445-001-02-5	Broad Institute of MIT and Harvard	BRD-K17745445			C\C=C\c1ccc(cc1)[C@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)c1cccnc1	InChI=1S/C20H19N3O2/c1-2-4-14-6-8-15(9-7-14)19-17(11-21)23(18(19)13-24)20(25)16-5-3-10-22-12-16/h2-10,12,17-19,24H,13H2,1H3/b4-2+/t17-,18-,19-/m1/s1	SONVGTXFTWWDQR-RVONUSJBSA-N	333.147726878							
BRD-K02076218	LSM-8560		54649958	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19+,20+/m0/s1	NYKFFZXKZNVNOG-XUVXKRRUSA-N	CCCNC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)c3ccccc3F	BroadT	BRD-K02076218	BRD-K02076218-001-01-9	Broad Institute of MIT and Harvard	BRD-K02076218			CCCNC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)-c1ccccc1F	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19+,20+/m0/s1	NYKFFZXKZNVNOG-XUVXKRRUSA-N	367.169605174							97181
BRD-K44410738	LSM-11132		54650205	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20+,21+/m1/s1	IQRVCTXELZIWDH-HKBOAZHASA-N	CCc1cnc(s1)N2[C@@H](CO)[C@H]([C@H]2C#N)c3ccc(cc3)c4cccc(F)c4	BroadT	BRD-K44410738	BRD-K44410738-001-01-1	Broad Institute of MIT and Harvard	BRD-K44410738			CCc1cnc(s1)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20+,21+/m1/s1	IQRVCTXELZIWDH-HKBOAZHASA-N	393.13111118							99753
BRD-K18778674	LSM-9556		54649915	InChI=1S/C25H23N3OS/c26-14-22-24(20-12-10-18(11-13-20)17-6-4-5-7-17)23(15-29)28(22)25-27-21(16-30-25)19-8-2-1-3-9-19/h1-3,6,8-13,16,22-24,29H,4-5,7,15H2/t22-,23-,24-/m0/s1	YWUOOJZCEOJKLU-HJOGWXRNSA-N	OC[C@H]1[C@H]([C@H](C#N)N1c2nc(cs2)c3ccccc3)c4ccc(cc4)C5=CCCC5	BroadT	BRD-K18778674	BRD-K18778674-001-01-9	Broad Institute of MIT and Harvard	BRD-K18778674			OC[C@H]1[C@H]([C@H](C#N)N1c1nc(cs1)-c1ccccc1)c1ccc(cc1)C1=CCCC1	InChI=1S/C25H23N3OS/c26-14-22-24(20-12-10-18(11-13-20)17-6-4-5-7-17)23(15-29)28(22)25-27-21(16-30-25)19-8-2-1-3-9-19/h1-3,6,8-13,16,22-24,29H,4-5,7,15H2/t22-,23-,24-/m0/s1	YWUOOJZCEOJKLU-HJOGWXRNSA-N	413.156183076							98177
BRD-K05273600	LSM-8741		54649968	InChI=1S/C23H21N3O2/c24-14-20-23(18-10-8-17(9-11-18)7-6-16-4-5-16)21(15-27)26(20)22(28)13-19-3-1-2-12-25-19/h1-3,8-12,16,20-21,23,27H,4-5,13,15H2/t20-,21+,23-/m1/s1	FLQYRXYGAVUNDA-FUPPJEDESA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)Cc2ccccn2)c3ccc(cc3)C#CC4CC4	BroadT	BRD-K05273600	BRD-K05273600-001-01-5	Broad Institute of MIT and Harvard	BRD-K05273600			OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)Cc1ccccn1)c1ccc(cc1)C#CC1CC1	InChI=1S/C23H21N3O2/c24-14-20-23(18-10-8-17(9-11-18)7-6-16-4-5-16)21(15-27)26(20)22(28)13-19-3-1-2-12-25-19/h1-3,8-12,16,20-21,23,27H,4-5,13,15H2/t20-,21+,23-/m1/s1	FLQYRXYGAVUNDA-FUPPJEDESA-N	371.163376942							97362
BRD-K25018652	LSM-9949		54649905	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19+,20-/m0/s1	DBBLKINRPPNEJI-ZCNNSNEGSA-N	CCc1cnc(s1)N2[C@H](CO)[C@H]([C@@H]2C#N)c3ccc(cc3)C#CC(C)C	BroadT	BRD-K25018652	BRD-K25018652-001-01-7	Broad Institute of MIT and Harvard	BRD-K25018652			CCc1cnc(s1)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C#CC(C)C	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19+,20-/m0/s1	DBBLKINRPPNEJI-ZCNNSNEGSA-N	365.156183076							98570
BRD-K16533918	LSM-9430		54650107	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16-,18-/m0/s1	MOIIHOSYSQGYMW-BQFCYCMXSA-N	COc1ccccc1NC(=O)N2[C@@H](CO)[C@H]([C@@H]2C#N)c3ccccc3	BroadT	BRD-K16533918	BRD-K16533918-001-01-6	Broad Institute of MIT and Harvard	BRD-K16533918			COc1ccccc1NC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c1ccccc1	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16-,18-/m0/s1	MOIIHOSYSQGYMW-BQFCYCMXSA-N	337.142641498							98051
BRD-K64326023	LSM-12353		54650006	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22-,23-/m1/s1	POAXSVANNSAIAV-DNVJHFABSA-N	OC[C@@H]1[C@@H]([C@@H](C#N)N1S(=O)(=O)c2ccccc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K64326023	BRD-K64326023-001-02-6	Broad Institute of MIT and Harvard	BRD-K64326023			OC[C@@H]1[C@@H]([C@@H](C#N)N1S(=O)(=O)c1ccccc1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C23H24N2O3S/c24-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-26)25(21)29(27,28)20-9-5-2-6-10-20/h2,5-7,9-14,21-23,26H,1,3-4,8,16H2/t21-,22-,23-/m1/s1	POAXSVANNSAIAV-DNVJHFABSA-N	408.150763338							100980
BRD-K86961442	LSM-13761		54650162	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18+,19-/m1/s1	ANDSQWRABKLSGR-CEXWTWQISA-N	OC[C@@H]1N[C@H](C#N)[C@H]1c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K86961442	BRD-K86961442-001-01-9	Broad Institute of MIT and Harvard	BRD-K86961442			OC[C@@H]1N[C@H](C#N)[C@H]1c1ccc(cc1)C#CC1CCCCC1	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18+,19-/m1/s1	ANDSQWRABKLSGR-CEXWTWQISA-N	294.173213344							102410
BRD-K96482472	LSM-14346		54649983	InChI=1S/C25H29N3O3/c1-31-21-13-11-18(12-14-21)17-7-9-19(10-8-17)24-22(15-26)28(23(24)16-29)25(30)27-20-5-3-2-4-6-20/h7-14,20,22-24,29H,2-6,16H2,1H3,(H,27,30)/t22-,23-,24-/m0/s1	UEJLJRRJJUOYFY-HJOGWXRNSA-N	COc1ccc(cc1)c2ccc(cc2)[C@@H]3[C@H](CO)N([C@H]3C#N)C(=O)NC4CCCCC4	BroadT	BRD-K96482472	BRD-K96482472-001-01-7	Broad Institute of MIT and Harvard	BRD-K96482472			COc1ccc(cc1)-c1ccc(cc1)[C@@H]1[C@H](CO)N([C@H]1C#N)C(=O)NC1CCCCC1	InChI=1S/C25H29N3O3/c1-31-21-13-11-18(12-14-21)17-7-9-19(10-8-17)24-22(15-26)28(23(24)16-29)25(30)27-20-5-3-2-4-6-20/h7-14,20,22-24,29H,2-6,16H2,1H3,(H,27,30)/t22-,23-,24-/m0/s1	UEJLJRRJJUOYFY-HJOGWXRNSA-N	419.220891818							103000
BRD-K41344641	LSM-43472		54649941	InChI=1S/C20H25N3O3/c1-2-3-15-4-6-16(7-5-15)20-17(12-21)23(18(20)14-24)19(25)13-22-8-10-26-11-9-22/h2-7,17-18,20,24H,8-11,13-14H2,1H3/b3-2+/t17-,18-,20+/m1/s1	KJLVFPZXKUGLPF-PTWFHZBFSA-N	C\C=C\c1ccc(cc1)[C@@H]2[C@@H](CO)N([C@@H]2C#N)C(=O)CN3CCOCC3	BroadT	BRD-K41344641	BRD-K41344641-001-01-1	Broad Institute of MIT and Harvard	BRD-K41344641			C\C=C\c1ccc(cc1)[C@@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)CN1CCOCC1	InChI=1S/C20H25N3O3/c1-2-3-15-4-6-16(7-5-15)20-17(12-21)23(18(20)14-24)19(25)13-22-8-10-26-11-9-22/h2-7,17-18,20,24H,8-11,13-14H2,1H3/b3-2+/t17-,18-,20+/m1/s1	KJLVFPZXKUGLPF-PTWFHZBFSA-N	355.18959169							
BRD-K77233343	LSM-13151		54649908	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19-,20+/m1/s1	DBBLKINRPPNEJI-AQNXPRMDSA-N	CCc1cnc(s1)N2[C@H](CO)[C@H]([C@H]2C#N)c3ccc(cc3)C#CC(C)C	BroadT	BRD-K77233343	BRD-K77233343-001-01-4	Broad Institute of MIT and Harvard	BRD-K77233343			CCc1cnc(s1)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)C#CC(C)C	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19-,20+/m1/s1	DBBLKINRPPNEJI-AQNXPRMDSA-N	365.156183076							101789
BRD-K94781393	LSM-14241		54650180	InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18-,19+/m0/s1	BQRBXGWYUGGWQF-GBESFXJTSA-N	OC[C@@H]1N[C@@H](C#N)[C@H]1c2ccc(cc2)C#Cc3ccccc3F	BroadT	BRD-K94781393	BRD-K94781393-001-01-0	Broad Institute of MIT and Harvard	BRD-K94781393			OC[C@@H]1N[C@@H](C#N)[C@H]1c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18-,19+/m0/s1	BQRBXGWYUGGWQF-GBESFXJTSA-N	306.11684132							102895
BRD-K19914944	LSM-6825		54650153	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20-,21+/m0/s1	DBVJKEGLTFFIFT-PCCBWWKXSA-N	CCc1cnc(s1)N2[C@@H](CO)[C@@H]([C@@H]2C#N)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K19914944	BRD-K19914944-001-01-3	Broad Institute of MIT and Harvard	BRD-K19914944			CCc1cnc(s1)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20-,21+/m0/s1	DBVJKEGLTFFIFT-PCCBWWKXSA-N	379.17183314							95446
BRD-K28250273	LSM-10138		54650056	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16-,17-/m0/s1	NDKYDEPQZPJKDZ-ULQDDVLXSA-N	OC[C@H]1[C@H]([C@H](C#N)N1C(=O)Nc2cccc(F)c2)c3ccccc3	BroadT	BRD-K28250273	BRD-K28250273-001-01-2	Broad Institute of MIT and Harvard	BRD-K28250273			OC[C@H]1[C@H]([C@H](C#N)N1C(=O)Nc1cccc(F)c1)c1ccccc1	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16-,17-/m0/s1	NDKYDEPQZPJKDZ-ULQDDVLXSA-N	325.122654982							98759
BRD-K46574442	LSM-11271		54650148	InChI=1S/C23H21FN2O2/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18/h3-5,8-12,15,20-22,27H,14H2,1-2H3/t20-,21-,22+/m1/s1	DGEMMPDKDCWCNC-VSKRKVRLSA-N	CC(C)C#Cc1ccc(cc1)[C@@H]2[C@@H](CO)N([C@@H]2C#N)C(=O)c3cccc(F)c3	BroadT	BRD-K46574442	BRD-K46574442-001-01-9	Broad Institute of MIT and Harvard	BRD-K46574442			CC(C)C#Cc1ccc(cc1)[C@@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)c1cccc(F)c1	InChI=1S/C23H21FN2O2/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18/h3-5,8-12,15,20-22,27H,14H2,1-2H3/t20-,21-,22+/m1/s1	DGEMMPDKDCWCNC-VSKRKVRLSA-N	376.158706132							99892
BRD-K29499344	LSM-10217		54650035	InChI=1S/C18H18N2O2/c1-22-17-5-3-2-4-14(17)12-6-8-13(9-7-12)18-15(10-19)20-16(18)11-21/h2-9,15-16,18,20-21H,11H2,1H3/t15-,16+,18-/m1/s1	BGJLKNVJWQWPQD-SOLBZPMBSA-N	COc1ccccc1c2ccc(cc2)[C@H]3[C@H](CO)N[C@@H]3C#N	BroadT	BRD-K29499344	BRD-K29499344-001-01-9	Broad Institute of MIT and Harvard	BRD-K29499344			COc1ccccc1-c1ccc(cc1)[C@H]1[C@H](CO)N[C@@H]1C#N	InChI=1S/C18H18N2O2/c1-22-17-5-3-2-4-14(17)12-6-8-13(9-7-12)18-15(10-19)20-16(18)11-21/h2-9,15-16,18,20-21H,11H2,1H3/t15-,16+,18-/m1/s1	BGJLKNVJWQWPQD-SOLBZPMBSA-N	294.136827836							98838
BRD-K31970894	LSM-6772		54650134	InChI=1S/C24H25N3O2/c25-15-21-24(20-8-6-19(7-9-20)18-4-2-1-3-5-18)22(16-28)27(21)23(29)14-17-10-12-26-13-11-17/h4,6-13,21-22,24,28H,1-3,5,14,16H2/t21-,22+,24+/m0/s1	GMLMGXOKFZUTJK-WMTXJRDZSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)Cc2ccncc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K31970894	BRD-K31970894-003-01-5	Broad Institute of MIT and Harvard	BRD-K31970894		Cl	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)Cc1ccncc1)c1ccc(cc1)C1=CCCCC1.Cl	InChI=1S/C24H25N3O2.ClH/c25-15-21-24(20-8-6-19(7-9-20)18-4-2-1-3-5-18)22(16-28)27(21)23(29)14-17-10-12-26-13-11-17;/h4,6-13,21-22,24,28H,1-3,5,14,16H2;1H/t21-,22+,24+;/m0./s1	ATJSNRYWCMPJPN-ASEJRGIKSA-N	387.19467707							95393
BRD-K06663546	LSM-8819		54650113	InChI=1S/C22H24N2O3/c23-13-18-20(19(14-25)24(18)21(26)17-7-8-17)16-5-3-15(4-6-16)9-12-22(27)10-1-2-11-22/h3-6,17-20,25,27H,1-2,7-8,10-11,14H2/t18-,19-,20+/m1/s1	PBPFKUQGSPUXQC-AQNXPRMDSA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)C2CC2)c3ccc(cc3)C#CC4(O)CCCC4	BroadT	BRD-K06663546	BRD-K06663546-001-01-3	Broad Institute of MIT and Harvard	BRD-K06663546			OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)C1CC1)c1ccc(cc1)C#CC1(O)CCCC1	InChI=1S/C22H24N2O3/c23-13-18-20(19(14-25)24(18)21(26)17-7-8-17)16-5-3-15(4-6-16)9-12-22(27)10-1-2-11-22/h3-6,17-20,25,27H,1-2,7-8,10-11,14H2/t18-,19-,20+/m1/s1	PBPFKUQGSPUXQC-AQNXPRMDSA-N	364.178692648							97440
BRD-K36200934	LSM-10615		54649932	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23+,24-/m1/s1	NFTCJLSEEOPUCW-TZRRMPRUSA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)c2cccnc2)c3ccc(cc3)C#Cc4ccccc4F	BroadT	BRD-K36200934	BRD-K36200934-001-01-8	Broad Institute of MIT and Harvard	BRD-K36200934			OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)c1cccnc1)c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23+,24-/m1/s1	NFTCJLSEEOPUCW-TZRRMPRUSA-N	411.138305046							99236
BRD-K60151881	LSM-12068		54649977	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17-,18-/m0/s1	SEDZELNMUHOWSZ-BZSNNMDCSA-N	OC[C@H]1[C@H]([C@H](C#N)N1S(=O)(=O)Cc2ccccc2)c3ccccc3	BroadT	BRD-K60151881	BRD-K60151881-001-01-5	Broad Institute of MIT and Harvard	BRD-K60151881			OC[C@H]1[C@H]([C@H](C#N)N1S(=O)(=O)Cc1ccccc1)c1ccccc1	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17-,18-/m0/s1	SEDZELNMUHOWSZ-BZSNNMDCSA-N	342.103813146							100694
BRD-K80044001	LSM-13315		54650016	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16+,17-/m0/s1	WYIJFLWERXFFKQ-BBWFWOEESA-N	OC[C@H]1N[C@@H](C#N)[C@@H]1c2ccc(cc2)c3cccc(F)c3	BroadT	BRD-K80044001	BRD-K80044001-001-01-3	Broad Institute of MIT and Harvard	BRD-K80044001			OC[C@H]1N[C@@H](C#N)[C@@H]1c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16+,17-/m0/s1	WYIJFLWERXFFKQ-BBWFWOEESA-N	282.11684132							101954
BRD-K35801592	LSM-10578		54650028	InChI=1S/C25H23FN2O3/c26-21-3-1-2-18(14-21)5-4-17-6-8-19(9-7-17)24-22(15-27)28(23(24)16-29)25(30)20-10-12-31-13-11-20/h1-3,6-9,14,20,22-24,29H,10-13,16H2/t22-,23+,24-/m0/s1	HZJTYSQKFIQHQZ-VXNXHJTFSA-N	OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)C2CCOCC2)c3ccc(cc3)C#Cc4cccc(F)c4	BroadT	BRD-K35801592	BRD-K35801592-001-01-7	Broad Institute of MIT and Harvard	BRD-K35801592			OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)C1CCOCC1)c1ccc(cc1)C#Cc1cccc(F)c1	InChI=1S/C25H23FN2O3/c26-21-3-1-2-18(14-21)5-4-17-6-8-19(9-7-17)24-22(15-27)28(23(24)16-29)25(30)20-10-12-31-13-11-20/h1-3,6-9,14,20,22-24,29H,10-13,16H2/t22-,23+,24-/m0/s1	HZJTYSQKFIQHQZ-VXNXHJTFSA-N	418.169270816							99199
BRD-K56379651	LSM-11840		54650206	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20+,21-/m1/s1	IQRVCTXELZIWDH-QHAWAJNXSA-N	CCc1cnc(s1)N2[C@@H](CO)[C@@H]([C@H]2C#N)c3ccc(cc3)c4cccc(F)c4	BroadT	BRD-K56379651	BRD-K56379651-001-01-6	Broad Institute of MIT and Harvard	BRD-K56379651			CCc1cnc(s1)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C22H20FN3OS/c1-2-18-12-25-22(28-18)26-19(11-24)21(20(26)13-27)15-8-6-14(7-9-15)16-4-3-5-17(23)10-16/h3-10,12,19-21,27H,2,13H2,1H3/t19-,20+,21-/m1/s1	IQRVCTXELZIWDH-QHAWAJNXSA-N	393.13111118							100466
BRD-K96741939	LSM-6768		54650111	InChI=1S/C22H24N2O3/c23-13-18-20(19(14-25)24(18)21(26)17-7-8-17)16-5-3-15(4-6-16)9-12-22(27)10-1-2-11-22/h3-6,17-20,25,27H,1-2,7-8,10-11,14H2/t18-,19+,20+/m0/s1	PBPFKUQGSPUXQC-XUVXKRRUSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)C2CC2)c3ccc(cc3)C#CC4(O)CCCC4	BroadT	BRD-K96741939	BRD-K96741939-004-02-5	Broad Institute of MIT and Harvard	BRD-K96741939		Br	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)C1CC1)c1ccc(cc1)C#CC1(O)CCCC1.Br	InChI=1S/C22H24N2O3.BrH/c23-13-18-20(19(14-25)24(18)21(26)17-7-8-17)16-5-3-15(4-6-16)9-12-22(27)10-1-2-11-22;/h3-6,17-20,25,27H,1-2,7-8,10-11,14H2;1H/t18-,19+,20+;/m0./s1	BDAJOKVIEVEPPP-WUHLWKCASA-N	364.178692648							95389
BRD-K89895693	LSM-13971		54650141	InChI=1S/C19H25N3O2/c20-13-16-19(15-7-3-1-4-8-15)17(14-23)22(16)18(24)9-12-21-10-5-2-6-11-21/h1,3-4,7-8,16-17,19,23H,2,5-6,9-12,14H2/t16-,17+,19+/m1/s1	DNWBFORDJWKZCR-AOIWGVFYSA-N	OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)CCN2CCCCC2)c3ccccc3	BroadT	BRD-K89895693	BRD-K89895693-001-01-2	Broad Institute of MIT and Harvard	BRD-K89895693			OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)CCN1CCCCC1)c1ccccc1	InChI=1S/C19H25N3O2/c20-13-16-19(15-7-3-1-4-8-15)17(14-23)22(16)18(24)9-12-21-10-5-2-6-11-21/h1,3-4,7-8,16-17,19,23H,2,5-6,9-12,14H2/t16-,17+,19+/m1/s1	DNWBFORDJWKZCR-AOIWGVFYSA-N	327.19467707							102624
BRD-K76005262	LSM-13078		54649949	InChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22-,23+/m0/s1	BSEGMNXKWUIHHS-RJGXRXQPSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)c2cccc(F)c2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K76005262	BRD-K76005262-001-01-4	Broad Institute of MIT and Harvard	BRD-K76005262			OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)c1cccc(F)c1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22-,23+/m0/s1	BSEGMNXKWUIHHS-RJGXRXQPSA-N	390.174356196							101716
BRD-K89860739	LSM-13969		54650116	InChI=1S/C22H26N2O3/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3/t19-,20-,22+/m1/s1	FOQJOAXBJHEYGA-SJBKTWHCSA-N	COCC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)C#CCC3CCCC3	BroadT	BRD-K89860739	BRD-K89860739-001-01-2	Broad Institute of MIT and Harvard	BRD-K89860739			COCC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)C#CCC1CCCC1	InChI=1S/C22H26N2O3/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3/t19-,20-,22+/m1/s1	FOQJOAXBJHEYGA-SJBKTWHCSA-N	366.194342712							102622
BRD-K52981369	LSM-11663		54649933	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23+,24+/m1/s1	NFTCJLSEEOPUCW-SGNDLWITSA-N	OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)c2cccnc2)c3ccc(cc3)C#Cc4ccccc4F	BroadT	BRD-K52981369	BRD-K52981369-001-01-6	Broad Institute of MIT and Harvard	BRD-K52981369			OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)c1cccnc1)c1ccc(cc1)C#Cc1ccccc1F	InChI=1S/C25H18FN3O2/c26-21-6-2-1-4-18(21)10-7-17-8-11-19(12-9-17)24-22(14-27)29(23(24)16-30)25(31)20-5-3-13-28-15-20/h1-6,8-9,11-13,15,22-24,30H,16H2/t22-,23+,24+/m1/s1	NFTCJLSEEOPUCW-SGNDLWITSA-N	411.138305046							100288
BRD-K52221985	LSM-11624		54649964	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19+,20-/m0/s1	NYKFFZXKZNVNOG-ZCNNSNEGSA-N	CCCNC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)c3ccccc3F	BroadT	BRD-K52221985	BRD-K52221985-001-01-1	Broad Institute of MIT and Harvard	BRD-K52221985			CCCNC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)-c1ccccc1F	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19+,20-/m0/s1	NYKFFZXKZNVNOG-ZCNNSNEGSA-N	367.169605174							100249
BRD-K02952507	LSM-6740		54650144	InChI=1S/C23H21FN2O2/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18/h3-5,8-12,15,20-22,27H,14H2,1-2H3/t20-,21-,22-/m1/s1	DGEMMPDKDCWCNC-YPAWHYETSA-N	CC(C)C#Cc1ccc(cc1)[C@H]2[C@@H](CO)N([C@@H]2C#N)C(=O)c3cccc(F)c3	BroadT	BRD-K02952507	BRD-K02952507-004-02-3	Broad Institute of MIT and Harvard	BRD-K02952507		Br	CC(C)C#Cc1ccc(cc1)[C@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)c1cccc(F)c1.Br	InChI=1S/C23H21FN2O2.BrH/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18;/h3-5,8-12,15,20-22,27H,14H2,1-2H3;1H/t20-,21-,22-;/m1./s1	VQXRVFHTJURJCS-AFYLVLOISA-N	376.158706132							95361
BRD-K45371861	LSM-43476		54649911	InChI=1S/C20H19FN2O3S/c1-2-4-14-7-9-15(10-8-14)20-18(12-22)23(19(20)13-24)27(25,26)17-6-3-5-16(21)11-17/h2-11,18-20,24H,13H2,1H3/b4-2+/t18-,19+,20+/m1/s1	CRECGCTYSBAAAJ-BWXOOPFESA-N	C\C=C\c1ccc(cc1)[C@@H]2[C@H](CO)N([C@@H]2C#N)S(=O)(=O)c3cccc(F)c3	BroadT	BRD-K45371861	BRD-K45371861-001-01-3	Broad Institute of MIT and Harvard	BRD-K45371861			C\C=C\c1ccc(cc1)[C@@H]1[C@H](CO)N([C@@H]1C#N)S(=O)(=O)c1cccc(F)c1	InChI=1S/C20H19FN2O3S/c1-2-4-14-7-9-15(10-8-14)20-18(12-22)23(19(20)13-24)27(25,26)17-6-3-5-16(21)11-17/h2-11,18-20,24H,13H2,1H3/b4-2+/t18-,19+,20+/m1/s1	CRECGCTYSBAAAJ-BWXOOPFESA-N	386.110041378							
BRD-K48296029	LSM-11366		54650186	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19-,20+/m1/s1	BSUDBHASFVKNIG-AQNXPRMDSA-N	CCCNC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)C3=CCCCC3	BroadT	BRD-K48296029	BRD-K48296029-001-01-8	Broad Institute of MIT and Harvard	BRD-K48296029			CCCNC(=O)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C21H27N3O2/c1-2-12-23-21(26)24-18(13-22)20(19(24)14-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,18-20,25H,2-5,7,12,14H2,1H3,(H,23,26)/t18-,19-,20+/m1/s1	BSUDBHASFVKNIG-AQNXPRMDSA-N	353.210327134							99987
BRD-K67863009	LSM-12567		54649982	InChI=1S/C25H29N3O3/c1-31-21-13-11-18(12-14-21)17-7-9-19(10-8-17)24-22(15-26)28(23(24)16-29)25(30)27-20-5-3-2-4-6-20/h7-14,20,22-24,29H,2-6,16H2,1H3,(H,27,30)/t22-,23-,24+/m0/s1	UEJLJRRJJUOYFY-KMDXXIMOSA-N	COc1ccc(cc1)c2ccc(cc2)[C@H]3[C@H](CO)N([C@H]3C#N)C(=O)NC4CCCCC4	BroadT	BRD-K67863009	BRD-K67863009-001-01-5	Broad Institute of MIT and Harvard	BRD-K67863009			COc1ccc(cc1)-c1ccc(cc1)[C@H]1[C@H](CO)N([C@H]1C#N)C(=O)NC1CCCCC1	InChI=1S/C25H29N3O3/c1-31-21-13-11-18(12-14-21)17-7-9-19(10-8-17)24-22(15-26)28(23(24)16-29)25(30)27-20-5-3-2-4-6-20/h7-14,20,22-24,29H,2-6,16H2,1H3,(H,27,30)/t22-,23-,24+/m0/s1	UEJLJRRJJUOYFY-KMDXXIMOSA-N	419.220891818							101198
BRD-K93054014	LSM-14137		54650062	InChI=1S/C19H19N3O3/c1-25-12-18(24)22-16(9-20)19(17(22)11-23)14-6-4-13(5-7-14)15-3-2-8-21-10-15/h2-8,10,16-17,19,23H,11-12H2,1H3/t16-,17-,19-/m0/s1	NONDGOMIDWLUNU-LNLFQRSKSA-N	COCC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)c3cccnc3	BroadT	BRD-K93054014	BRD-K93054014-001-01-2	Broad Institute of MIT and Harvard	BRD-K93054014			COCC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)-c1cccnc1	InChI=1S/C19H19N3O3/c1-25-12-18(24)22-16(9-20)19(17(22)11-23)14-6-4-13(5-7-14)15-3-2-8-21-10-15/h2-8,10,16-17,19,23H,11-12H2,1H3/t16-,17-,19-/m0/s1	NONDGOMIDWLUNU-LNLFQRSKSA-N	337.142641498							102791
BRD-K83473338	LSM-13532		54650051	InChI=1S/C22H26N2O3/c23-13-19-21(17-7-5-16(6-8-17)15-3-1-2-4-15)20(14-25)24(19)22(26)18-9-11-27-12-10-18/h3,5-8,18-21,25H,1-2,4,9-12,14H2/t19-,20+,21-/m0/s1	RYSHWXRXFKBMCF-HBMCJLEFSA-N	OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)C2CCOCC2)c3ccc(cc3)C4=CCCC4	BroadT	BRD-K83473338	BRD-K83473338-001-01-5	Broad Institute of MIT and Harvard	BRD-K83473338			OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)C1CCOCC1)c1ccc(cc1)C1=CCCC1	InChI=1S/C22H26N2O3/c23-13-19-21(17-7-5-16(6-8-17)15-3-1-2-4-15)20(14-25)24(19)22(26)18-9-11-27-12-10-18/h3,5-8,18-21,25H,1-2,4,9-12,14H2/t19-,20+,21-/m0/s1	RYSHWXRXFKBMCF-HBMCJLEFSA-N	366.194342712							102174
BRD-K49071649	LSM-11411		54650029	InChI=1S/C25H23FN2O3/c26-21-3-1-2-18(14-21)5-4-17-6-8-19(9-7-17)24-22(15-27)28(23(24)16-29)25(30)20-10-12-31-13-11-20/h1-3,6-9,14,20,22-24,29H,10-13,16H2/t22-,23+,24-/m1/s1	HZJTYSQKFIQHQZ-TZRRMPRUSA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)C2CCOCC2)c3ccc(cc3)C#Cc4cccc(F)c4	BroadT	BRD-K49071649	BRD-K49071649-001-01-4	Broad Institute of MIT and Harvard	BRD-K49071649			OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)C1CCOCC1)c1ccc(cc1)C#Cc1cccc(F)c1	InChI=1S/C25H23FN2O3/c26-21-3-1-2-18(14-21)5-4-17-6-8-19(9-7-17)24-22(15-27)28(23(24)16-29)25(30)20-10-12-31-13-11-20/h1-3,6-9,14,20,22-24,29H,10-13,16H2/t22-,23+,24-/m1/s1	HZJTYSQKFIQHQZ-TZRRMPRUSA-N	418.169270816							100032
BRD-K90064059	LSM-13985		54650063	InChI=1S/C19H19N3O3/c1-25-12-18(24)22-16(9-20)19(17(22)11-23)14-6-4-13(5-7-14)15-3-2-8-21-10-15/h2-8,10,16-17,19,23H,11-12H2,1H3/t16-,17+,19-/m1/s1	NONDGOMIDWLUNU-ZIFCJYIRSA-N	COCC(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)c3cccnc3	BroadT	BRD-K90064059	BRD-K90064059-001-01-0	Broad Institute of MIT and Harvard	BRD-K90064059			COCC(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)-c1cccnc1	InChI=1S/C19H19N3O3/c1-25-12-18(24)22-16(9-20)19(17(22)11-23)14-6-4-13(5-7-14)15-3-2-8-21-10-15/h2-8,10,16-17,19,23H,11-12H2,1H3/t16-,17+,19-/m1/s1	NONDGOMIDWLUNU-ZIFCJYIRSA-N	337.142641498							102638
BRD-K37957394	LSM-10726		54650084	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16-,17+/m1/s1	COUPNDMEVDHIHS-ZACQAIPSSA-N	CCCC#Cc1ccc(cc1)[C@@H]2[C@@H](CO)N([C@@H]2C#N)S(=O)(=O)C	BroadT	BRD-K37957394	BRD-K37957394-001-01-5	Broad Institute of MIT and Harvard	BRD-K37957394			CCCC#Cc1ccc(cc1)[C@@H]1[C@@H](CO)N([C@@H]1C#N)S(C)(=O)=O	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16-,17+/m1/s1	COUPNDMEVDHIHS-ZACQAIPSSA-N	332.11946321							99347
BRD-K58761147	LSM-11981		54650167	InChI=1S/C22H21N3O2/c23-13-19-21(17-10-8-16(9-11-17)15-5-1-2-6-15)20(14-26)25(19)22(27)18-7-3-4-12-24-18/h3-5,7-12,19-21,26H,1-2,6,14H2/t19-,20-,21+/m0/s1	MYJKJHLNWUIKMG-PCCBWWKXSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)c2ccccn2)c3ccc(cc3)C4=CCCC4	BroadT	BRD-K58761147	BRD-K58761147-001-01-5	Broad Institute of MIT and Harvard	BRD-K58761147			OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)c1ccccn1)c1ccc(cc1)C1=CCCC1	InChI=1S/C22H21N3O2/c23-13-19-21(17-10-8-16(9-11-17)15-5-1-2-6-15)20(14-26)25(19)22(27)18-7-3-4-12-24-18/h3-5,7-12,19-21,26H,1-2,6,14H2/t19-,20-,21+/m0/s1	MYJKJHLNWUIKMG-PCCBWWKXSA-N	359.163376942							100607
BRD-K57611352	LSM-6753		54649901	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19+,20+/m0/s1	DBBLKINRPPNEJI-XUVXKRRUSA-N	CCc1cnc(s1)N2[C@H](CO)[C@@H]([C@@H]2C#N)c3ccc(cc3)C#CC(C)C	BroadT	BRD-K57611352	BRD-K57611352-004-02-5	Broad Institute of MIT and Harvard	BRD-K57611352		Br	CCc1cnc(s1)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)C#CC(C)C.Br	InChI=1S/C21H23N3OS.BrH/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3;/h7-10,12,14,18-20,25H,4,13H2,1-3H3;1H/t18-,19+,20+;/m0./s1	BRVLIRIBCZBZLE-WUHLWKCASA-N	365.156183076							95374
BRD-K90259550	LSM-6766		54650075	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21-,23-/m1/s1	VFHDDKSZNLSDOB-MQSCRBSSSA-N	COc1ccccc1C#Cc2ccc(cc2)[C@H]3[C@@H](CO)N([C@@H]3C#N)C(=O)C4CC4	BroadT	BRD-K90259550	BRD-K90259550-004-02-2	Broad Institute of MIT and Harvard	BRD-K90259550		Br	COc1ccccc1C#Cc1ccc(cc1)[C@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)C1CC1.Br	InChI=1S/C24H22N2O3.BrH/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19;/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3;1H/t20-,21-,23-;/m1./s1	SRWPNXFYCBVPPO-HMYAGPHPSA-N	386.163042584							95387
BRD-K28576143	LSM-6751		54650027	InChI=1S/C25H23FN2O3/c26-21-3-1-2-18(14-21)5-4-17-6-8-19(9-7-17)24-22(15-27)28(23(24)16-29)25(30)20-10-12-31-13-11-20/h1-3,6-9,14,20,22-24,29H,10-13,16H2/t22-,23+,24+/m0/s1	HZJTYSQKFIQHQZ-RBZQAINGSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)C2CCOCC2)c3ccc(cc3)C#Cc4cccc(F)c4	BroadT	BRD-K28576143	BRD-K28576143-004-02-0	Broad Institute of MIT and Harvard	BRD-K28576143		Br	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)C1CCOCC1)c1ccc(cc1)C#Cc1cccc(F)c1.Br	InChI=1S/C25H23FN2O3.BrH/c26-21-3-1-2-18(14-21)5-4-17-6-8-19(9-7-17)24-22(15-27)28(23(24)16-29)25(30)20-10-12-31-13-11-20;/h1-3,6-9,14,20,22-24,29H,10-13,16H2;1H/t22-,23+,24+;/m0./s1	AMQBQXMNHLFALY-BAUONJEJSA-N	418.169270816							95372
BRD-K68554461	LSM-12611		54649918	InChI=1S/C25H23N3O3/c1-31-21-4-2-3-20(14-21)18-5-7-19(8-6-18)25-22(15-26)28(23(25)16-29)24(30)13-17-9-11-27-12-10-17/h2-12,14,22-23,25,29H,13,16H2,1H3/t22-,23-,25-/m0/s1	QYAAHEQVWPVPBC-LSQMVHIFSA-N	COc1cccc(c1)c2ccc(cc2)[C@@H]3[C@H](CO)N([C@H]3C#N)C(=O)Cc4ccncc4	BroadT	BRD-K68554461	BRD-K68554461-001-01-0	Broad Institute of MIT and Harvard	BRD-K68554461			COc1cccc(c1)-c1ccc(cc1)[C@@H]1[C@H](CO)N(C(=O)Cc2ccncc2)[C@H]1C#N	InChI=1S/C25H23N3O3/c1-31-21-4-2-3-20(14-21)18-5-7-19(8-6-18)25-22(15-26)28(23(25)16-29)24(30)13-17-9-11-27-12-10-17/h2-12,14,22-23,25,29H,13,16H2,1H3/t22-,23-,25-/m0/s1	QYAAHEQVWPVPBC-LSQMVHIFSA-N	413.173941626							101243
BRD-K79947616	LSM-6763		54649902	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19-,20-/m1/s1	DBBLKINRPPNEJI-VAMGGRTRSA-N	CCc1cnc(s1)N2[C@H](CO)[C@@H]([C@H]2C#N)c3ccc(cc3)C#CC(C)C	BroadT	BRD-K79947616	BRD-K79947616-004-02-9	Broad Institute of MIT and Harvard	BRD-K79947616		Br	CCc1cnc(s1)N1[C@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C#CC(C)C.Br	InChI=1S/C21H23N3OS.BrH/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3;/h7-10,12,14,18-20,25H,4,13H2,1-3H3;1H/t18-,19-,20-;/m1./s1	BRVLIRIBCZBZLE-DEXIKXDTSA-N	365.156183076							95384
BRD-K25300451	LSM-9966		54650036	InChI=1S/C19H19FN2O3S/c1-2-26(24,25)22-17(11-21)19(18(22)12-23)14-8-6-13(7-9-14)15-4-3-5-16(20)10-15/h3-10,17-19,23H,2,12H2,1H3/t17-,18+,19+/m0/s1	FWARPLPHHGVTHJ-IPMKNSEASA-N	CCS(=O)(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)c3cccc(F)c3	BroadT	BRD-K25300451	BRD-K25300451-001-02-0	Broad Institute of MIT and Harvard	BRD-K25300451			CCS(=O)(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C19H19FN2O3S/c1-2-26(24,25)22-17(11-21)19(18(22)12-23)14-8-6-13(7-9-14)15-4-3-5-16(20)10-15/h3-10,17-19,23H,2,12H2,1H3/t17-,18+,19+/m0/s1	FWARPLPHHGVTHJ-IPMKNSEASA-N	374.110041378							98587
BRD-K73843002	LSM-12952		54650076	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21+,23-/m0/s1	VFHDDKSZNLSDOB-XJUOHMSHSA-N	COc1ccccc1C#Cc2ccc(cc2)[C@@H]3[C@@H](CO)N([C@H]3C#N)C(=O)C4CC4	BroadT	BRD-K73843002	BRD-K73843002-001-01-6	Broad Institute of MIT and Harvard	BRD-K73843002			COc1ccccc1C#Cc1ccc(cc1)[C@@H]1[C@@H](CO)N([C@H]1C#N)C(=O)C1CC1	InChI=1S/C24H22N2O3/c1-29-22-5-3-2-4-17(22)9-6-16-7-10-18(11-8-16)23-20(14-25)26(21(23)15-27)24(28)19-12-13-19/h2-5,7-8,10-11,19-21,23,27H,12-13,15H2,1H3/t20-,21+,23-/m0/s1	VFHDDKSZNLSDOB-XJUOHMSHSA-N	386.163042584							101589
BRD-K43194109	LSM-11053		54650156	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20+,21-/m0/s1	DBVJKEGLTFFIFT-HBMCJLEFSA-N	CCc1cnc(s1)N2[C@H](CO)[C@H]([C@@H]2C#N)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K43194109	BRD-K43194109-001-01-3	Broad Institute of MIT and Harvard	BRD-K43194109			CCc1cnc(s1)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20+,21-/m0/s1	DBVJKEGLTFFIFT-HBMCJLEFSA-N	379.17183314							99674
CHEMBL2355356	LSM-6758	SID131446405, BRD-K66084396	54649996	InChI=1S/C26H21N3O3/c1-32-21-6-4-5-19(15-21)9-8-18-10-12-20(13-11-18)25-23(16-27)29(24(25)17-30)26(31)22-7-2-3-14-28-22/h2-7,10-15,23-25,30H,17H2,1H3/t23-,24-,25-/m1/s1	RQNIZPLHIPGYGU-UBFVSLLYSA-N	COc1cccc(c1)C#Cc2ccc(cc2)[C@H]3[C@@H](CO)N([C@@H]3C#N)C(=O)c4ccccn4	BroadT	BRD-K66084396	BRD-K66084396-004-02-2	Broad Institute of MIT and Harvard	BRD-K66084396		Br	COc1cccc(c1)C#Cc1ccc(cc1)[C@H]1[C@@H](CO)N([C@@H]1C#N)C(=O)c1ccccn1.Br	InChI=1S/C26H21N3O3.BrH/c1-32-21-6-4-5-19(15-21)9-8-18-10-12-20(13-11-18)25-23(16-27)29(24(25)17-30)26(31)22-7-2-3-14-28-22;/h2-7,10-15,23-25,30H,17H2,1H3;1H/t23-,24-,25-;/m1./s1	LMIJJWMXODGMLC-RFCMRFBMSA-N	423.158291562							95379
BRD-K03258328	LSM-8636		54650133	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16-,17-/m0/s1	LIAUQGYQVCFFMZ-ULQDDVLXSA-N	OC[C@H]1[C@H]([C@H](C#N)N1S(=O)(=O)c2ccc(F)cc2)c3ccccc3	BroadT	BRD-K03258328	BRD-K03258328-001-01-9	Broad Institute of MIT and Harvard	BRD-K03258328			OC[C@H]1[C@H]([C@H](C#N)N1S(=O)(=O)c1ccc(F)cc1)c1ccccc1	InChI=1S/C17H15FN2O3S/c18-13-6-8-14(9-7-13)24(22,23)20-15(10-19)17(16(20)11-21)12-4-2-1-3-5-12/h1-9,15-17,21H,11H2/t15-,16-,17-/m0/s1	LIAUQGYQVCFFMZ-ULQDDVLXSA-N	346.07874125							97257
CHEMBL2132134	LSM-9684	BRD-K20725229, SID131446462	54650053	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16+,17+/m0/s1	NDKYDEPQZPJKDZ-GVDBMIGSSA-N	OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)Nc2cccc(F)c2)c3ccccc3	BroadT	BRD-K20725229	BRD-K20725229-001-01-6	Broad Institute of MIT and Harvard	BRD-K20725229			OC[C@@H]1[C@@H]([C@H](C#N)N1C(=O)Nc1cccc(F)c1)c1ccccc1	InChI=1S/C18H16FN3O2/c19-13-7-4-8-14(9-13)21-18(24)22-15(10-20)17(16(22)11-23)12-5-2-1-3-6-12/h1-9,15-17,23H,11H2,(H,21,24)/t15-,16+,17+/m0/s1	NDKYDEPQZPJKDZ-GVDBMIGSSA-N	325.122654982							98305
BRD-K99524324	LSM-14541		54650069	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16+,17-/m1/s1	BPKNALSRVQDTLI-IXDOHACOSA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)c2ccccc2F)c3ccccc3	BroadT	BRD-K99524324	BRD-K99524324-001-01-3	Broad Institute of MIT and Harvard	BRD-K99524324			OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)c1ccccc1F)c1ccccc1	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16+,17-/m1/s1	BPKNALSRVQDTLI-IXDOHACOSA-N	310.11175594							103196
BRD-K07107626	LSM-6770		54649916	InChI=1S/C25H23N3O3/c1-31-21-4-2-3-20(14-21)18-5-7-19(8-6-18)25-22(15-26)28(23(25)16-29)24(30)13-17-9-11-27-12-10-17/h2-12,14,22-23,25,29H,13,16H2,1H3/t22-,23-,25-/m1/s1	QYAAHEQVWPVPBC-VDKIKQQVSA-N	COc1cccc(c1)c2ccc(cc2)[C@H]3[C@@H](CO)N([C@@H]3C#N)C(=O)Cc4ccncc4	BroadT	BRD-K07107626	BRD-K07107626-003-02-7	Broad Institute of MIT and Harvard	BRD-K07107626		Cl	COc1cccc(c1)-c1ccc(cc1)[C@H]1[C@@H](CO)N(C(=O)Cc2ccncc2)[C@@H]1C#N.Cl	InChI=1S/C25H23N3O3.ClH/c1-31-21-4-2-3-20(14-21)18-5-7-19(8-6-18)25-22(15-26)28(23(25)16-29)24(30)13-17-9-11-27-12-10-17;/h2-12,14,22-23,25,29H,13,16H2,1H3;1H/t22-,23-,25-;/m1./s1	UWGRRESILPDKSV-MNRXJBBMSA-N	413.173941626							95391
BRD-K74260000	LSM-12974		54650163	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18+,19-/m0/s1	ANDSQWRABKLSGR-OTWHNJEPSA-N	OC[C@H]1N[C@@H](C#N)[C@@H]1c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K74260000	BRD-K74260000-001-01-4	Broad Institute of MIT and Harvard	BRD-K74260000			OC[C@H]1N[C@@H](C#N)[C@@H]1c1ccc(cc1)C#CC1CCCCC1	InChI=1S/C19H22N2O/c20-12-17-19(18(13-22)21-17)16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h8-11,14,17-19,21-22H,1-5,13H2/t17-,18+,19-/m0/s1	ANDSQWRABKLSGR-OTWHNJEPSA-N	294.173213344							101611
BRD-K03034193	LSM-6741		54650115	InChI=1S/C22H26N2O3/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3/t19-,20-,22-/m1/s1	FOQJOAXBJHEYGA-KCZVDYSFSA-N	COCC(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)C#CCC3CCCC3	BroadT	BRD-K03034193	BRD-K03034193-004-02-8	Broad Institute of MIT and Harvard	BRD-K03034193		Br	COCC(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C#CCC1CCCC1.Br	InChI=1S/C22H26N2O3.BrH/c1-27-15-21(26)24-19(13-23)22(20(24)14-25)18-11-9-17(10-12-18)8-4-7-16-5-2-3-6-16;/h9-12,16,19-20,22,25H,2-3,5-7,14-15H2,1H3;1H/t19-,20-,22-;/m1./s1	FXTNXTWLQZLJBX-XLTSWDRCSA-N	366.194342712							95362
BRD-K19833084	LSM-9629		54649907	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19+,20-/m1/s1	DBBLKINRPPNEJI-HSALFYBXSA-N	CCc1cnc(s1)N2[C@@H](CO)[C@@H]([C@H]2C#N)c3ccc(cc3)C#CC(C)C	BroadT	BRD-K19833084	BRD-K19833084-001-01-5	Broad Institute of MIT and Harvard	BRD-K19833084			CCc1cnc(s1)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C#CC(C)C	InChI=1S/C21H23N3OS/c1-4-17-12-23-21(26-17)24-18(11-22)20(19(24)13-25)16-9-7-15(8-10-16)6-5-14(2)3/h7-10,12,14,18-20,25H,4,13H2,1-3H3/t18-,19+,20-/m1/s1	DBBLKINRPPNEJI-HSALFYBXSA-N	365.156183076							98250
BRD-K25866499	LSM-9996		54650149	InChI=1S/C23H21FN2O2/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18/h3-5,8-12,15,20-22,27H,14H2,1-2H3/t20-,21+,22+/m1/s1	DGEMMPDKDCWCNC-FSSWDIPSSA-N	CC(C)C#Cc1ccc(cc1)[C@@H]2[C@H](CO)N([C@@H]2C#N)C(=O)c3cccc(F)c3	BroadT	BRD-K25866499	BRD-K25866499-001-01-6	Broad Institute of MIT and Harvard	BRD-K25866499			CC(C)C#Cc1ccc(cc1)[C@@H]1[C@H](CO)N([C@@H]1C#N)C(=O)c1cccc(F)c1	InChI=1S/C23H21FN2O2/c1-15(2)6-7-16-8-10-17(11-9-16)22-20(13-25)26(21(22)14-27)23(28)18-4-3-5-19(24)12-18/h3-5,8-12,15,20-22,27H,14H2,1-2H3/t20-,21+,22+/m1/s1	DGEMMPDKDCWCNC-FSSWDIPSSA-N	376.158706132							98617
BRD-K97024014	LSM-14387		54650037	InChI=1S/C19H19FN2O3S/c1-2-26(24,25)22-17(11-21)19(18(22)12-23)14-8-6-13(7-9-14)15-4-3-5-16(20)10-15/h3-10,17-19,23H,2,12H2,1H3/t17-,18+,19+/m1/s1	FWARPLPHHGVTHJ-QYZOEREBSA-N	CCS(=O)(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)c3cccc(F)c3	BroadT	BRD-K97024014	BRD-K97024014-001-01-1	Broad Institute of MIT and Harvard	BRD-K97024014			CCS(=O)(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C19H19FN2O3S/c1-2-26(24,25)22-17(11-21)19(18(22)12-23)14-8-6-13(7-9-14)15-4-3-5-16(20)10-15/h3-10,17-19,23H,2,12H2,1H3/t17-,18+,19+/m1/s1	FWARPLPHHGVTHJ-QYZOEREBSA-N	374.110041378							103041
BRD-K85630885	LSM-13664		54650070	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16-,17+/m1/s1	BPKNALSRVQDTLI-ZACQAIPSSA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)c2ccccc2F)c3ccccc3	BroadT	BRD-K85630885	BRD-K85630885-001-01-5	Broad Institute of MIT and Harvard	BRD-K85630885			OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)c1ccccc1F)c1ccccc1	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16-,17+/m1/s1	BPKNALSRVQDTLI-ZACQAIPSSA-N	310.11175594							102311
BRD-K97924168	LSM-14446		54650139	InChI=1S/C24H25N3O2/c25-15-21-24(20-8-6-19(7-9-20)18-4-2-1-3-5-18)22(16-28)27(21)23(29)14-17-10-12-26-13-11-17/h4,6-13,21-22,24,28H,1-3,5,14,16H2/t21-,22+,24-/m0/s1	GMLMGXOKFZUTJK-ZDXQCDESSA-N	OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)Cc2ccncc2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K97924168	BRD-K97924168-001-01-6	Broad Institute of MIT and Harvard	BRD-K97924168			OC[C@@H]1[C@H]([C@H](C#N)N1C(=O)Cc1ccncc1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C24H25N3O2/c25-15-21-24(20-8-6-19(7-9-20)18-4-2-1-3-5-18)22(16-28)27(21)23(29)14-17-10-12-26-13-11-17/h4,6-13,21-22,24,28H,1-3,5,14,16H2/t21-,22+,24-/m0/s1	GMLMGXOKFZUTJK-ZDXQCDESSA-N	387.19467707							103101
BRD-K55854370	LSM-11812		54649978	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17+,18-/m0/s1	SEDZELNMUHOWSZ-KSZLIROESA-N	OC[C@@H]1[C@H]([C@H](C#N)N1S(=O)(=O)Cc2ccccc2)c3ccccc3	BroadT	BRD-K55854370	BRD-K55854370-001-01-9	Broad Institute of MIT and Harvard	BRD-K55854370			OC[C@@H]1[C@H]([C@H](C#N)N1S(=O)(=O)Cc1ccccc1)c1ccccc1	InChI=1S/C18H18N2O3S/c19-11-16-18(15-9-5-2-6-10-15)17(12-21)20(16)24(22,23)13-14-7-3-1-4-8-14/h1-10,16-18,21H,12-13H2/t16-,17+,18-/m0/s1	SEDZELNMUHOWSZ-KSZLIROESA-N	342.103813146							100437
BRD-K25362512	LSM-9969		54650017	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16-,17-/m0/s1	WYIJFLWERXFFKQ-ULQDDVLXSA-N	OC[C@@H]1N[C@@H](C#N)[C@@H]1c2ccc(cc2)c3cccc(F)c3	BroadT	BRD-K25362512	BRD-K25362512-001-01-9	Broad Institute of MIT and Harvard	BRD-K25362512			OC[C@@H]1N[C@@H](C#N)[C@@H]1c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16-,17-/m0/s1	WYIJFLWERXFFKQ-ULQDDVLXSA-N	282.11684132							98590
BRD-K71225733	LSM-12779		54650140	InChI=1S/C19H25N3O2/c20-13-16-19(15-7-3-1-4-8-15)17(14-23)22(16)18(24)9-12-21-10-5-2-6-11-21/h1,3-4,7-8,16-17,19,23H,2,5-6,9-12,14H2/t16-,17-,19-/m0/s1	DNWBFORDJWKZCR-LNLFQRSKSA-N	OC[C@H]1[C@H]([C@H](C#N)N1C(=O)CCN2CCCCC2)c3ccccc3	BroadT	BRD-K71225733	BRD-K71225733-001-01-4	Broad Institute of MIT and Harvard	BRD-K71225733			OC[C@H]1[C@H]([C@H](C#N)N1C(=O)CCN1CCCCC1)c1ccccc1	InChI=1S/C19H25N3O2/c20-13-16-19(15-7-3-1-4-8-15)17(14-23)22(16)18(24)9-12-21-10-5-2-6-11-21/h1,3-4,7-8,16-17,19,23H,2,5-6,9-12,14H2/t16-,17-,19-/m0/s1	DNWBFORDJWKZCR-LNLFQRSKSA-N	327.19467707							101416
BRD-K72354054	LSM-12866		54650208	InChI=1S/C23H24FN3O3/c24-19-3-1-2-18(12-19)16-4-6-17(7-5-16)23-20(13-25)27(21(23)15-28)22(29)14-26-8-10-30-11-9-26/h1-7,12,20-21,23,28H,8-11,14-15H2/t20-,21-,23+/m0/s1	DLEHFJVYHARQFS-QNWVGRARSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)CN2CCOCC2)c3ccc(cc3)c4cccc(F)c4	BroadT	BRD-K72354054	BRD-K72354054-001-01-2	Broad Institute of MIT and Harvard	BRD-K72354054			OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)CN1CCOCC1)c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C23H24FN3O3/c24-19-3-1-2-18(12-19)16-4-6-17(7-5-16)23-20(13-25)27(21(23)15-28)22(29)14-26-8-10-30-11-9-26/h1-7,12,20-21,23,28H,8-11,14-15H2/t20-,21-,23+/m0/s1	DLEHFJVYHARQFS-QNWVGRARSA-N	409.180169858							101503
BRD-K39894071	LSM-10860		54650089	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16-,17+/m0/s1	COUPNDMEVDHIHS-YESZJQIVSA-N	CCCC#Cc1ccc(cc1)[C@H]2[C@H](CO)N([C@H]2C#N)S(=O)(=O)C	BroadT	BRD-K39894071	BRD-K39894071-001-01-8	Broad Institute of MIT and Harvard	BRD-K39894071			CCCC#Cc1ccc(cc1)[C@H]1[C@H](CO)N([C@H]1C#N)S(C)(=O)=O	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16-,17+/m0/s1	COUPNDMEVDHIHS-YESZJQIVSA-N	332.11946321							99481
BRD-K87304961	LSM-13782		54650014	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16-,17+/m0/s1	WYIJFLWERXFFKQ-YESZJQIVSA-N	OC[C@@H]1N[C@@H](C#N)[C@H]1c2ccc(cc2)c3cccc(F)c3	BroadT	BRD-K87304961	BRD-K87304961-001-01-2	Broad Institute of MIT and Harvard	BRD-K87304961			OC[C@@H]1N[C@@H](C#N)[C@H]1c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C17H15FN2O/c18-14-3-1-2-13(8-14)11-4-6-12(7-5-11)17-15(9-19)20-16(17)10-21/h1-8,15-17,20-21H,10H2/t15-,16-,17+/m0/s1	WYIJFLWERXFFKQ-YESZJQIVSA-N	282.11684132							102431
CHEMBL2355500	LSM-6760	BRD-K69664985, SID131446602	54650193	InChI=1S/C23H29N3O2/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28)/t20-,21+,22+/m0/s1	FHQNTJUBGIRGFL-BHDDXSALSA-N	CC(C)NC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K69664985	BRD-K69664985-004-02-5	Broad Institute of MIT and Harvard	BRD-K69664985		Br	CC(C)NC(=O)N1[C@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)C#CC1CCCCC1.Br	InChI=1S/C23H29N3O2.BrH/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17;/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28);1H/t20-,21+,22+;/m0./s1	AOJPQSCHYSFFGC-DWAQFSJKSA-N	379.225977198							95381
BRD-K72972600	LSM-12895		54650166	InChI=1S/C22H21N3O2/c23-13-19-21(17-10-8-16(9-11-17)15-5-1-2-6-15)20(14-26)25(19)22(27)18-7-3-4-12-24-18/h3-5,7-12,19-21,26H,1-2,6,14H2/t19-,20+,21+/m1/s1	MYJKJHLNWUIKMG-HKBOAZHASA-N	OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)c2ccccn2)c3ccc(cc3)C4=CCCC4	BroadT	BRD-K72972600	BRD-K72972600-001-01-0	Broad Institute of MIT and Harvard	BRD-K72972600			OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)c1ccccn1)c1ccc(cc1)C1=CCCC1	InChI=1S/C22H21N3O2/c23-13-19-21(17-10-8-16(9-11-17)15-5-1-2-6-15)20(14-26)25(19)22(27)18-7-3-4-12-24-18/h3-5,7-12,19-21,26H,1-2,6,14H2/t19-,20+,21+/m1/s1	MYJKJHLNWUIKMG-HKBOAZHASA-N	359.163376942							101532
BRD-K52403701	LSM-11634		54649957	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19-,20-/m1/s1	NYKFFZXKZNVNOG-VAMGGRTRSA-N	CCCNC(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)c3ccccc3F	BroadT	BRD-K52403701	BRD-K52403701-001-01-8	Broad Institute of MIT and Harvard	BRD-K52403701			CCCNC(=O)N1[C@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)-c1ccccc1F	InChI=1S/C21H22FN3O2/c1-2-11-24-21(27)25-18(12-23)20(19(25)13-26)15-9-7-14(8-10-15)16-5-3-4-6-17(16)22/h3-10,18-20,26H,2,11,13H2,1H3,(H,24,27)/t18-,19-,20-/m1/s1	NYKFFZXKZNVNOG-VAMGGRTRSA-N	367.169605174							100259
BRD-K37357652	LSM-6773		54649917	InChI=1S/C25H23N3O3/c1-31-21-4-2-3-20(14-21)18-5-7-19(8-6-18)25-22(15-26)28(23(25)16-29)24(30)13-17-9-11-27-12-10-17/h2-12,14,22-23,25,29H,13,16H2,1H3/t22-,23+,25+/m0/s1	QYAAHEQVWPVPBC-JBRSBNLGSA-N	COc1cccc(c1)c2ccc(cc2)[C@H]3[C@@H](CO)N([C@H]3C#N)C(=O)Cc4ccncc4	BroadT	BRD-K37357652	BRD-K37357652-003-02-9	Broad Institute of MIT and Harvard	BRD-K37357652		Cl	COc1cccc(c1)-c1ccc(cc1)[C@H]1[C@@H](CO)N(C(=O)Cc2ccncc2)[C@H]1C#N.Cl	InChI=1S/C25H23N3O3.ClH/c1-31-21-4-2-3-20(14-21)18-5-7-19(8-6-18)25-22(15-26)28(23(25)16-29)24(30)13-17-9-11-27-12-10-17;/h2-12,14,22-23,25,29H,13,16H2,1H3;1H/t22-,23+,25+;/m0./s1	UWGRRESILPDKSV-ZELIPEIJSA-N	413.173941626							95394
BRD-K12216461	LSM-6745		54650083	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16-,17-/m1/s1	COUPNDMEVDHIHS-BRWVUGGUSA-N	CCCC#Cc1ccc(cc1)[C@H]2[C@@H](CO)N([C@@H]2C#N)S(=O)(=O)C	BroadT	BRD-K12216461	BRD-K12216461-004-02-5	Broad Institute of MIT and Harvard	BRD-K12216461		Br	CCCC#Cc1ccc(cc1)[C@H]1[C@@H](CO)N([C@@H]1C#N)S(C)(=O)=O.Br	InChI=1S/C17H20N2O3S.BrH/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22;/h7-10,15-17,20H,3-4,12H2,1-2H3;1H/t15-,16-,17-;/m1./s1	PTOGAKXKMDAUJW-UATJXVQHSA-N	332.11946321							95366
BRD-K54046891	LSM-11718		54650101	InChI=1S/C23H20N4O2/c24-11-20-23(18-8-6-17(7-9-18)19-12-25-15-26-13-19)21(14-28)27(20)22(29)10-16-4-2-1-3-5-16/h1-9,12-13,15,20-21,23,28H,10,14H2/t20-,21+,23+/m1/s1	OPKRCVVELWLOIA-GIWBLDEGSA-N	OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)Cc2ccccc2)c3ccc(cc3)c4cncnc4	BroadT	BRD-K54046891	BRD-K54046891-001-01-3	Broad Institute of MIT and Harvard	BRD-K54046891			OC[C@H]1[C@H]([C@@H](C#N)N1C(=O)Cc1ccccc1)c1ccc(cc1)-c1cncnc1	InChI=1S/C23H20N4O2/c24-11-20-23(18-8-6-17(7-9-18)19-12-25-15-26-13-19)21(14-28)27(20)22(29)10-16-4-2-1-3-5-16/h1-9,12-13,15,20-21,23,28H,10,14H2/t20-,21+,23+/m1/s1	OPKRCVVELWLOIA-GIWBLDEGSA-N	384.15862592							100343
BRD-K24272049	LSM-9899		54650197	InChI=1S/C23H29N3O2/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28)/t20-,21-,22-/m0/s1	FHQNTJUBGIRGFL-FKBYEOEOSA-N	CC(C)NC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c2ccc(cc2)C#CC3CCCCC3	BroadT	BRD-K24272049	BRD-K24272049-001-01-3	Broad Institute of MIT and Harvard	BRD-K24272049			CC(C)NC(=O)N1[C@@H](CO)[C@H]([C@@H]1C#N)c1ccc(cc1)C#CC1CCCCC1	InChI=1S/C23H29N3O2/c1-16(2)25-23(28)26-20(14-24)22(21(26)15-27)19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17/h10-13,16-17,20-22,27H,3-7,15H2,1-2H3,(H,25,28)/t20-,21-,22-/m0/s1	FHQNTJUBGIRGFL-FKBYEOEOSA-N	379.225977198							98520
BRD-K35224528	LSM-10548		54650143	InChI=1S/C19H25N3O2/c20-13-16-19(15-7-3-1-4-8-15)17(14-23)22(16)18(24)9-12-21-10-5-2-6-11-21/h1,3-4,7-8,16-17,19,23H,2,5-6,9-12,14H2/t16-,17-,19+/m0/s1	DNWBFORDJWKZCR-JENIJYKNSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)CCN2CCCCC2)c3ccccc3	BroadT	BRD-K35224528	BRD-K35224528-001-01-1	Broad Institute of MIT and Harvard	BRD-K35224528			OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)CCN1CCCCC1)c1ccccc1	InChI=1S/C19H25N3O2/c20-13-16-19(15-7-3-1-4-8-15)17(14-23)22(16)18(24)9-12-21-10-5-2-6-11-21/h1,3-4,7-8,16-17,19,23H,2,5-6,9-12,14H2/t16-,17-,19+/m0/s1	DNWBFORDJWKZCR-JENIJYKNSA-N	327.19467707							99169
BRD-K62957477	LSM-12256		54650142	InChI=1S/C19H25N3O2/c20-13-16-19(15-7-3-1-4-8-15)17(14-23)22(16)18(24)9-12-21-10-5-2-6-11-21/h1,3-4,7-8,16-17,19,23H,2,5-6,9-12,14H2/t16-,17-,19+/m1/s1	DNWBFORDJWKZCR-LMMKCTJWSA-N	OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)CCN2CCCCC2)c3ccccc3	BroadT	BRD-K62957477	BRD-K62957477-001-01-3	Broad Institute of MIT and Harvard	BRD-K62957477			OC[C@@H]1[C@H]([C@@H](C#N)N1C(=O)CCN1CCCCC1)c1ccccc1	InChI=1S/C19H25N3O2/c20-13-16-19(15-7-3-1-4-8-15)17(14-23)22(16)18(24)9-12-21-10-5-2-6-11-21/h1,3-4,7-8,16-17,19,23H,2,5-6,9-12,14H2/t16-,17-,19+/m1/s1	DNWBFORDJWKZCR-LMMKCTJWSA-N	327.19467707							100882
BRD-K36008374	LSM-10595		54649946	InChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22+,23-/m1/s1	BSEGMNXKWUIHHS-XPWALMASSA-N	OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)c2cccc(F)c2)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K36008374	BRD-K36008374-001-01-2	Broad Institute of MIT and Harvard	BRD-K36008374			OC[C@H]1[C@@H]([C@@H](C#N)N1C(=O)c1cccc(F)c1)c1ccc(cc1)C1=CCCCC1	InChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22+,23-/m1/s1	BSEGMNXKWUIHHS-XPWALMASSA-N	390.174356196							99216
BRD-K47977047-001-01-2	LSM-6836	BRD-K47977047	54650155	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20-,21+/m1/s1	DBVJKEGLTFFIFT-NJYVYQBISA-N	CCc1cnc(s1)N2[C@H](CO)[C@H]([C@H]2C#N)c3ccc(cc3)C4=CCCCC4	BroadT	BRD-K47977047	BRD-K47977047-001-01-2	Broad Institute of MIT and Harvard	BRD-K47977047			CCc1cnc(s1)N1[C@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)C1=CCCCC1	InChI=1S/C22H25N3OS/c1-2-18-13-24-22(27-18)25-19(12-23)21(20(25)14-26)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h6,8-11,13,19-21,26H,2-5,7,14H2,1H3/t19-,20-,21+/m1/s1	DBVJKEGLTFFIFT-NJYVYQBISA-N	379.17183314							95457
BRD-K60703528	LSM-43485		54649956	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17-,18+/m0/s1	SLFKQKCTISPXPS-FCUPAANNSA-N	CCc1csc(n1)N2[C@@H](CO)[C@@H]([C@@H]2C#N)c3ccc(\C=C\C)cc3	BroadT	BRD-K60703528	BRD-K60703528-001-01-2	Broad Institute of MIT and Harvard	BRD-K60703528			CCc1csc(n1)N1[C@@H](CO)[C@@H]([C@@H]1C#N)c1ccc(cc1)\C=C\C	InChI=1S/C19H21N3OS/c1-3-5-13-6-8-14(9-7-13)18-16(10-20)22(17(18)11-23)19-21-15(4-2)12-24-19/h3,5-9,12,16-18,23H,4,11H2,1-2H3/b5-3+/t16-,17-,18+/m0/s1	SLFKQKCTISPXPS-FCUPAANNSA-N	339.140533012							
BRD-K99344911	LSM-14532		54649987	InChI=1S/C23H22N2O3S/c1-16-4-2-3-5-22(16)29(27,28)25-20(14-24)23(21(25)15-26)19-12-10-18(11-13-19)9-8-17-6-7-17/h2-5,10-13,17,20-21,23,26H,6-7,15H2,1H3/t20-,21+,23-/m1/s1	WYRXOKNMJBDANC-FUPPJEDESA-N	Cc1ccccc1S(=O)(=O)N2[C@@H](CO)[C@@H]([C@H]2C#N)c3ccc(cc3)C#CC4CC4	BroadT	BRD-K99344911	BRD-K99344911-001-01-5	Broad Institute of MIT and Harvard	BRD-K99344911			Cc1ccccc1S(=O)(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)C#CC1CC1	InChI=1S/C23H22N2O3S/c1-16-4-2-3-5-22(16)29(27,28)25-20(14-24)23(21(25)15-26)19-12-10-18(11-13-19)9-8-17-6-7-17/h2-5,10-13,17,20-21,23,26H,6-7,15H2,1H3/t20-,21+,23-/m1/s1	WYRXOKNMJBDANC-FUPPJEDESA-N	406.135113274							103187
BRD-K71805031	LSM-12828		54650065	InChI=1S/C19H19N3O3/c1-25-12-18(24)22-16(9-20)19(17(22)11-23)14-6-4-13(5-7-14)15-3-2-8-21-10-15/h2-8,10,16-17,19,23H,11-12H2,1H3/t16-,17+,19+/m1/s1	NONDGOMIDWLUNU-AOIWGVFYSA-N	COCC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)c3cccnc3	BroadT	BRD-K71805031	BRD-K71805031-001-01-2	Broad Institute of MIT and Harvard	BRD-K71805031			COCC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)-c1cccnc1	InChI=1S/C19H19N3O3/c1-25-12-18(24)22-16(9-20)19(17(22)11-23)14-6-4-13(5-7-14)15-3-2-8-21-10-15/h2-8,10,16-17,19,23H,11-12H2,1H3/t16-,17+,19+/m1/s1	NONDGOMIDWLUNU-AOIWGVFYSA-N	337.142641498							101465
BRD-K80065513	LSM-13318		54650104	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16+,18-/m0/s1	MOIIHOSYSQGYMW-JZXOWHBKSA-N	COc1ccccc1NC(=O)N2[C@H](CO)[C@H]([C@@H]2C#N)c3ccccc3	BroadT	BRD-K80065513	BRD-K80065513-001-01-9	Broad Institute of MIT and Harvard	BRD-K80065513			COc1ccccc1NC(=O)N1[C@H](CO)[C@H]([C@@H]1C#N)c1ccccc1	InChI=1S/C19H19N3O3/c1-25-17-10-6-5-9-14(17)21-19(24)22-15(11-20)18(16(22)12-23)13-7-3-2-4-8-13/h2-10,15-16,18,23H,12H2,1H3,(H,21,24)/t15-,16+,18-/m0/s1	MOIIHOSYSQGYMW-JZXOWHBKSA-N	337.142641498							101957
BRD-K12395425	LSM-9166		54650039	InChI=1S/C19H19FN2O3S/c1-2-26(24,25)22-17(11-21)19(18(22)12-23)14-8-6-13(7-9-14)15-4-3-5-16(20)10-15/h3-10,17-19,23H,2,12H2,1H3/t17-,18+,19-/m1/s1	FWARPLPHHGVTHJ-CEXWTWQISA-N	CCS(=O)(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c2ccc(cc2)c3cccc(F)c3	BroadT	BRD-K12395425	BRD-K12395425-001-01-0	Broad Institute of MIT and Harvard	BRD-K12395425			CCS(=O)(=O)N1[C@@H](CO)[C@@H]([C@H]1C#N)c1ccc(cc1)-c1cccc(F)c1	InChI=1S/C19H19FN2O3S/c1-2-26(24,25)22-17(11-21)19(18(22)12-23)14-8-6-13(7-9-14)15-4-3-5-16(20)10-15/h3-10,17-19,23H,2,12H2,1H3/t17-,18+,19-/m1/s1	FWARPLPHHGVTHJ-CEXWTWQISA-N	374.110041378							97787
BRD-K45033698	LSM-43475		54649940	InChI=1S/C20H25N3O3/c1-2-3-15-4-6-16(7-5-15)20-17(12-21)23(18(20)14-24)19(25)13-22-8-10-26-11-9-22/h2-7,17-18,20,24H,8-11,13-14H2,1H3/b3-2+/t17-,18+,20-/m0/s1	KJLVFPZXKUGLPF-HRQNTSHBSA-N	C\C=C\c1ccc(cc1)[C@@H]2[C@@H](CO)N([C@H]2C#N)C(=O)CN3CCOCC3	BroadT	BRD-K45033698	BRD-K45033698-001-01-8	Broad Institute of MIT and Harvard	BRD-K45033698			C\C=C\c1ccc(cc1)[C@@H]1[C@@H](CO)N([C@H]1C#N)C(=O)CN1CCOCC1	InChI=1S/C20H25N3O3/c1-2-3-15-4-6-16(7-5-15)20-17(12-21)23(18(20)14-24)19(25)13-22-8-10-26-11-9-22/h2-7,17-18,20,24H,8-11,13-14H2,1H3/b3-2+/t17-,18+,20-/m0/s1	KJLVFPZXKUGLPF-HRQNTSHBSA-N	355.18959169							
BRD-K08831772	LSM-6744		54650082	InChI=1S/C17H20N2O3S/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22/h7-10,15-17,20H,3-4,12H2,1-2H3/t15-,16+,17+/m0/s1	COUPNDMEVDHIHS-GVDBMIGSSA-N	CCCC#Cc1ccc(cc1)[C@H]2[C@@H](CO)N([C@H]2C#N)S(=O)(=O)C	BroadT	BRD-K08831772	BRD-K08831772-004-02-1	Broad Institute of MIT and Harvard	BRD-K08831772		Br	CCCC#Cc1ccc(cc1)[C@H]1[C@@H](CO)N([C@H]1C#N)S(C)(=O)=O.Br	InChI=1S/C17H20N2O3S.BrH/c1-3-4-5-6-13-7-9-14(10-8-13)17-15(11-18)19(16(17)12-20)23(2,21)22;/h7-10,15-17,20H,3-4,12H2,1-2H3;1H/t15-,16+,17+;/m0./s1	PTOGAKXKMDAUJW-NINZUIERSA-N	332.11946321							95365
BRD-K69735552	LSM-12687		54650071	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16-,17+/m0/s1	BPKNALSRVQDTLI-YESZJQIVSA-N	OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)c2ccccc2F)c3ccccc3	BroadT	BRD-K69735552	BRD-K69735552-001-01-4	Broad Institute of MIT and Harvard	BRD-K69735552			OC[C@H]1[C@@H]([C@H](C#N)N1C(=O)c1ccccc1F)c1ccccc1	InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16-,17+/m0/s1	BPKNALSRVQDTLI-YESZJQIVSA-N	310.11175594							101321
BRD-K89348354	LSM-13930		54649923	InChI=1S/C21H26N2O3S/c1-2-27(25,26)23-19(14-22)21(20(23)15-24)18-12-10-17(11-13-18)9-5-8-16-6-3-4-7-16/h10-13,16,19-21,24H,2-4,6-8,15H2,1H3/t19-,20+,21+/m1/s1	FMUUBOBUXMLTIS-HKBOAZHASA-N	CCS(=O)(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c2ccc(cc2)C#CCC3CCCC3	BroadT	BRD-K89348354	BRD-K89348354-001-01-2	Broad Institute of MIT and Harvard	BRD-K89348354			CCS(=O)(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)C#CCC1CCCC1	InChI=1S/C21H26N2O3S/c1-2-27(25,26)23-19(14-22)21(20(23)15-24)18-12-10-17(11-13-18)9-5-8-16-6-3-4-7-16/h10-13,16,19-21,24H,2-4,6-8,15H2,1H3/t19-,20+,21+/m1/s1	FMUUBOBUXMLTIS-HKBOAZHASA-N	386.166413402							102583
MLS000571696	LSM-44168	SID17412687, BRD-K80031845	1183480	InChI=1S/C20H20ClNO6/c1-25-16-7-5-12(9-18(16)27-3)6-8-19(23)22-15-11-17(26-2)13(10-14(15)21)20(24)28-4/h5-11H,1-4H3,(H,22,23)/b8-6+	YPQWBEOGNMKRQB-SOFGYWHQSA-N	COC(=O)c1cc(Cl)c(NC(=O)\C=C\c2ccc(OC)c(OC)c2)cc1OC	BroadT	BRD-K80031845	BRD-K80031845-001-05-1	ChemBridge Corporation	5943556			COC(=O)c1cc(Cl)c(NC(=O)\C=C\c2ccc(OC)c(OC)c2)cc1OC	InChI=1S/C20H20ClNO6/c1-25-16-7-5-12(9-18(16)27-3)6-8-19(23)22-15-11-17(26-2)13(10-14(15)21)20(24)28-4/h5-11H,1-4H3,(H,22,23)/b8-6+	YPQWBEOGNMKRQB-SOFGYWHQSA-N	405.09791508							
N-(3-Methoxyphenyl)-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]benzamide	LSM-26289	SID864429, BRD-K45631567	665676	InChI=1S/C23H19N3O4/c1-28-17-12-10-15(11-13-17)21-25-23(30-26-21)20-9-4-3-8-19(20)22(27)24-16-6-5-7-18(14-16)29-2/h3-14H,1-2H3,(H,24,27)	HZZGBUKOGHGEBN-UHFFFAOYSA-N	COc1ccc(cc1)c2noc(n2)c3ccccc3C(=O)Nc4cccc(OC)c4	BroadT	BRD-K45631567	BRD-K45631567-001-05-8	InterBioScreen Ltd.	STOCK5S-13091			COc1ccc(cc1)-c1noc(n1)-c1ccccc1C(=O)Nc1cccc(OC)c1	InChI=1S/C23H19N3O4/c1-28-17-12-10-15(11-13-17)21-25-23(30-26-21)20-9-4-3-8-19(20)22(27)24-16-6-5-7-18(14-16)29-2/h3-14H,1-2H3,(H,24,27)	HZZGBUKOGHGEBN-UHFFFAOYSA-N	401.137556118							114827
SMR000075452	LSM-26290	SID4257463, BRD-A74992649	2950432	InChI=1S/C15H10F3N3O2S/c16-15(17,18)9-4-1-2-5-10(9)21-12(22)8-11(13(21)23)24-14-19-6-3-7-20-14/h1-7,11H,8H2	AGNULNVDXZEHSS-UHFFFAOYSA-N	FC(F)(F)c1ccccc1N2C(=O)CC(Sc3ncccn3)C2=O	BroadT	BRD-A74992649	BRD-A74992649-001-05-2	ChemBridge Corporation	7730598			FC(F)(F)c1ccccc1N1C(=O)CC(Sc2ncccn2)C1=O	InChI=1S/C15H10F3N3O2S/c16-15(17,18)9-4-1-2-5-10(9)21-12(22)8-11(13(21)23)24-14-19-6-3-7-20-14/h1-7,11H,8H2	AGNULNVDXZEHSS-UHFFFAOYSA-N	353.04458188							114828
SMR000149088	LSM-26291	SID14741044, BRD-K02180460	1979096	InChI=1S/C26H25N3O4/c1-15-7-9-18(10-8-15)29-23(13-17(3)28-29)27-24(30)14-32-21-11-16(2)12-22-25(21)19-5-4-6-20(19)26(31)33-22/h7-13H,4-6,14H2,1-3H3,(H,27,30)	UZSRYNVWOXCPDV-UHFFFAOYSA-N	Cc1ccc(cc1)n2nc(C)cc2NC(=O)COc3cc(C)cc4OC(=O)C5=C(CCC5)c34	BroadT	BRD-K02180460	BRD-K02180460-001-05-5	InterBioScreen Ltd.	STOCK4S-17365			Cc1cc(NC(=O)COc2cc(C)cc3oc(=O)c4CCCc4c23)n(n1)-c1ccc(C)cc1	InChI=1S/C26H25N3O4/c1-15-7-9-18(10-8-15)29-23(13-17(3)28-29)27-24(30)14-32-21-11-16(2)12-22-25(21)19-5-4-6-20(19)26(31)33-22/h7-13H,4-6,14H2,1-3H3,(H,27,30)	UZSRYNVWOXCPDV-UHFFFAOYSA-N	443.18450631							114829
MLS000573233	LSM-26292	SID17431823, BRD-K06357013	1036446	InChI=1S/C20H18N2O4/c1-2-24-20(23)15-12-21-16-6-4-3-5-14(16)19(15)22-13-7-8-17-18(11-13)26-10-9-25-17/h3-8,11-12H,2,9-10H2,1H3,(H,21,22)	FVNDGSXKACRQMH-UHFFFAOYSA-N	CCOC(=O)c1cnc2ccccc2c1Nc3ccc4OCCOc4c3	BroadT	BRD-K06357013	BRD-K06357013-001-07-3	ChemBridge Corporation	6351665			CCOC(=O)c1cnc2ccccc2c1Nc1ccc2OCCOc2c1	InChI=1S/C20H18N2O4/c1-2-24-20(23)15-12-21-16-6-4-3-5-14(16)19(15)22-13-7-8-17-18(11-13)26-10-9-25-17/h3-8,11-12H,2,9-10H2,1H3,(H,21,22)	FVNDGSXKACRQMH-UHFFFAOYSA-N	350.126657076							114830
ZINC00095685	LSM-26293	SID26669434, BRD-K45328494	707946	InChI=1S/C18H13N5O/c24-16(14-9-5-2-6-10-14)20-17-21-18-19-12-11-15(23(18)22-17)13-7-3-1-4-8-13/h1-12H,(H,20,22,24)	ULZRSQREYWUMAP-UHFFFAOYSA-N	O=C(Nc1nc2nccc(c3ccccc3)n2n1)c4ccccc4	BroadT	BRD-K45328494	BRD-K45328494-001-05-9	InterBioScreen Ltd.	STOCK3S-26633			O=C(Nc1nc2nccc(-c3ccccc3)n2n1)c1ccccc1	InChI=1S/C18H13N5O/c24-16(14-9-5-2-6-10-14)20-17-21-18-19-12-11-15(23(18)22-17)13-7-3-1-4-8-13/h1-12H,(H,20,22,24)	ULZRSQREYWUMAP-UHFFFAOYSA-N	315.112010086							114831
ST50274949	LSM-26294	SJ000163669, BRD-K47277196	1073338	InChI=1S/C26H29NO7/c1-16-7-9-17(10-8-16)13-27-14-19(25(28)33-5)23(20(15-27)26(29)34-6)18-11-21(30-2)24(32-4)22(12-18)31-3/h7-12,14-15,23H,13H2,1-6H3	IGKWIHYNVWWXOU-UHFFFAOYSA-N	COC(=O)C1=CN(Cc2ccc(C)cc2)C=C(C1c3cc(OC)c(OC)c(OC)c3)C(=O)OC	BroadT	BRD-K47277196	BRD-K47277196-001-05-7	Asinex Ltd.	BAS 04378040			COC(=O)C1=CN(Cc2ccc(C)cc2)C=C(C1c1cc(OC)c(OC)c(OC)c1)C(=O)OC	InChI=1S/C26H29NO7/c1-16-7-9-17(10-8-16)13-27-14-19(25(28)33-5)23(20(15-27)26(29)34-6)18-11-21(30-2)24(32-4)22(12-18)31-3/h7-12,14-15,23H,13H2,1-6H3	IGKWIHYNVWWXOU-UHFFFAOYSA-N	467.194402278							114832
MLS000034498	LSM-26295	SID852801, BRD-K08118219	655441	InChI=1S/C16H19N3OS/c1-3-4-14(20)19-8-7-11-9-12(5-6-13(11)19)15-10(2)21-16(17)18-15/h5-6,9H,3-4,7-8H2,1-2H3,(H2,17,18)	MCGGSGQMWHQCGO-UHFFFAOYSA-N	CCCC(=O)N1CCc2cc(ccc12)c3nc(N)sc3C	BroadT	BRD-K08118219	BRD-K08118219-001-08-7	Asinex Ltd.	ASN 09627000			CCCC(=O)N1CCc2cc(ccc12)-c1nc(N)sc1C	InChI=1S/C16H19N3OS/c1-3-4-14(20)19-8-7-11-9-12(5-6-13(11)19)15-10(2)21-16(17)18-15/h5-6,9H,3-4,7-8H2,1-2H3,(H2,17,18)	MCGGSGQMWHQCGO-UHFFFAOYSA-N	301.124882948							114833
ST050795	LSM-26296	SID848994, BRD-K15642374	651460	InChI=1S/C19H22N6O2/c1-14-4-2-5-15(12-14)21-18-22-17(20-13-16-6-3-9-27-16)23-19(24-18)25-7-10-26-11-8-25/h2-6,9,12H,7-8,10-11,13H2,1H3,(H2,20,21,22,23,24)	XRIFRYRAMVQYND-UHFFFAOYSA-N	Cc1cccc(Nc2nc(NCc3occc3)nc(n2)N4CCOCC4)c1	BroadT	BRD-K15642374	BRD-K15642374-001-05-4	Asinex Ltd.	BAS 01849703			Cc1cccc(Nc2nc(NCc3ccco3)nc(n2)N2CCOCC2)c1	InChI=1S/C19H22N6O2/c1-14-4-2-5-15(12-14)21-18-22-17(20-13-16-6-3-9-27-16)23-19(24-18)25-7-10-26-11-8-25/h2-6,9,12H,7-8,10-11,13H2,1H3,(H2,20,21,22,23,24)	XRIFRYRAMVQYND-UHFFFAOYSA-N	366.180424004							114834
F1359-1148	LSM-26297	BRD-K79159370	4160559	InChI=1S/C18H17N3O6S2/c1-27-10-9-20-15-8-7-12(29(2,25)26)11-16(15)28-18(20)19-17(22)13-5-3-4-6-14(13)21(23)24/h3-8,11H,9-10H2,1-2H3	AOHIWHBKJBUJOF-UHFFFAOYSA-N	COCCN1C(=NC(=O)c2ccccc2[N+](=O)[O-])Sc3cc(ccc13)S(=O)(=O)C	BroadT	BRD-K79159370	BRD-K79159370-001-05-6	Life Chemicals Inc.	F1359-1148			COCCn1c2ccc(cc2sc1=NC(=O)c1ccccc1[N+]([O-])=O)S(C)(=O)=O	InChI=1S/C18H17N3O6S2/c1-27-10-9-20-15-8-7-12(29(2,25)26)11-16(15)28-18(20)19-17(22)13-5-3-4-6-14(13)21(23)24/h3-8,11H,9-10H2,1-2H3	AOHIWHBKJBUJOF-UHFFFAOYSA-N	435.055876674							114835
SMR000047538	LSM-26298	SID864973, BRD-K80592260	666221	InChI=1S/C18H20N4O5/c1-4-25-16(23)8-6-13-10(2)12-5-7-14(11(3)17(12)27-18(13)24)26-9-15-19-21-22-20-15/h5,7H,4,6,8-9H2,1-3H3,(H,19,20,21,22)	VMYWBUOMXIOWSV-UHFFFAOYSA-N	CCOC(=O)CCC1=C(C)c2ccc(OCc3nn[nH]n3)c(C)c2OC1=O	BroadT	BRD-K80592260	BRD-K80592260-001-05-8	InterBioScreen Ltd.	STOCK5S-34326			CCOC(=O)CCc1c(C)c2ccc(OCc3nn[nH]n3)c(C)c2oc1=O	InChI=1S/C18H20N4O5/c1-4-25-16(23)8-6-13-10(2)12-5-7-14(11(3)17(12)27-18(13)24)26-9-15-19-21-22-20-15/h5,7H,4,6,8-9H2,1-3H3,(H,19,20,21,22)	VMYWBUOMXIOWSV-UHFFFAOYSA-N	372.14336978							114836
12K-390S	LSM-44169	SID17410629, BRD-K78037786	6409773	InChI=1S/C14H16N4S/c1-10-4-6-12(7-5-10)15-9-8-13-11(2)17-18-14(16-13)19-3/h4-9,15H,1-3H3/b9-8+	BSKBIDKLFKEAEN-CMDGGOBGSA-N	CSc1nnc(C)c(\C=C\Nc2ccc(C)cc2)n1	BroadT	BRD-K78037786	BRD-K78037786-001-05-3	Key Organics Ltd.	12K-390S			CSc1nnc(C)c(\C=C\Nc2ccc(C)cc2)n1	InChI=1S/C14H16N4S/c1-10-4-6-12(7-5-10)15-9-8-13-11(2)17-18-14(16-13)19-3/h4-9,15H,1-3H3/b9-8+	BSKBIDKLFKEAEN-CMDGGOBGSA-N	272.109567242							
MLS001074431	LSM-26300	SID49817440, BRD-K88899914	24816799	InChI=1S/C21H25ClN2O5/c1-20(2,3)28-19(27)24-10-8-21(9-11-24,18(25)26)13-16-12-17(23-29-16)14-4-6-15(22)7-5-14/h4-7,12H,8-11,13H2,1-3H3,(H,25,26)	CJEIOHLLURWDLL-UHFFFAOYSA-N	CC(C)(C)OC(=O)N1CCC(Cc2onc(c2)c3ccc(Cl)cc3)(CC1)C(=O)O	BroadT	BRD-K88899914	BRD-K88899914-001-05-9	University of California at Davis	DS-OBOC-I4b-2			CC(C)(C)OC(=O)N1CCC(Cc2cc(no2)-c2ccc(Cl)cc2)(CC1)C(O)=O	InChI=1S/C21H25ClN2O5/c1-20(2,3)28-19(27)24-10-8-21(9-11-24,18(25)26)13-16-12-17(23-29-16)14-4-6-15(22)7-5-14/h4-7,12H,8-11,13H2,1-3H3,(H,25,26)	CJEIOHLLURWDLL-UHFFFAOYSA-N	420.14519963							114838
MLS000042393	LSM-15389	BRD-K10278497	1980599	InChI=1S/C22H23N5O2S/c1-13-6-5-9-18(14(13)2)25-20(28)12-30-22-27-26-21(29-22)17(23)10-15-11-24-19-8-4-3-7-16(15)19/h3-9,11,17,24H,10,12,23H2,1-2H3,(H,25,28)/t17-/m0/s1	KFACAZZBECASJS-KRWDZBQOSA-N	Cc1cccc(NC(=O)CSc2oc(nn2)[C@@H](N)Cc3c[nH]c4ccccc34)c1C	BroadT	BRD-K10278497	BRD-K10278497-003-06-8	InterBioScreen Ltd.	STOCK4S-18048		Cl	Cc1cccc(NC(=O)CSc2nnc(o2)[C@@H](N)Cc2c[nH]c3ccccc23)c1C.Cl	InChI=1S/C22H23N5O2S.ClH/c1-13-6-5-9-18(14(13)2)25-20(28)12-30-22-27-26-21(29-22)17(23)10-15-11-24-19-8-4-3-7-16(15)19;/h3-9,11,17,24H,10,12,23H2,1-2H3,(H,25,28);1H/t17-;/m0./s1	BMMRHWOSSJELQZ-LMOVPXPDSA-N	421.157245716							104031, 104031
AC1OAJ3Q	LSM-26301	SID24820647, BRD-K99683454	6805482	InChI=1S/C20H17N3O3/c1-25-18-8-7-13(11-19(18)26-2)15-12-21-23-10-9-16(22-20(15)23)14-5-3-4-6-17(14)24/h3-12,24H,1-2H3	SAOSKEQDVBMJSI-UHFFFAOYSA-N	COc1ccc(cc1OC)c2cnn3ccc(nc23)c4ccccc4O	BroadT	BRD-K99683454	BRD-K99683454-001-05-0	Key Organics Ltd.	9T-0295			COc1ccc(cc1OC)-c1cnn2ccc(nc12)-c1ccccc1O	InChI=1S/C20H17N3O3/c1-25-18-8-7-13(11-19(18)26-2)15-12-21-23-10-9-16(22-20(15)23)14-5-3-4-6-17(14)24/h3-12,24H,1-2H3	SAOSKEQDVBMJSI-UHFFFAOYSA-N	347.126991434							
SMR000029255	LSM-26302	SID4249913, BRD-A42288717	3243792	InChI=1S/C18H22FN3O/c1-3-4-16-17-10-5-13(2)21(17)11-12-22(16)18(23)20-15-8-6-14(19)7-9-15/h5-10,16H,3-4,11-12H2,1-2H3,(H,20,23)	ZHSHKOCEFHHTCH-UHFFFAOYSA-N	CCCC1N(CCn2c(C)ccc12)C(=O)Nc3ccc(F)cc3	BroadT	BRD-A42288717	BRD-A42288717-001-06-9	ChemDiv Inc.	C795-0406			CCCC1N(CCn2c(C)ccc12)C(=O)Nc1ccc(F)cc1	InChI=1S/C18H22FN3O/c1-3-4-16-17-10-5-13(2)21(17)11-12-22(16)18(23)20-15-8-6-14(19)7-9-15/h5-10,16H,3-4,11-12H2,1-2H3,(H,20,23)	ZHSHKOCEFHHTCH-UHFFFAOYSA-N	315.174690554							114840
SMR000011765	LSM-26303	SID851001, BRD-K32081673	653554	InChI=1S/C21H19N3O3S2/c1-13-14(2)29-19-18(13)20(26)24(15-7-4-3-5-8-15)21(23-19)28-12-17(25)22-11-16-9-6-10-27-16/h3-10H,11-12H2,1-2H3,(H,22,25)	FEUMYZAQYLDEPS-UHFFFAOYSA-N	Cc1sc2N=C(SCC(=O)NCc3occc3)N(C(=O)c2c1C)c4ccccc4	BroadT	BRD-K32081673	BRD-K32081673-001-06-0	Asinex Ltd.	BAS 03016868			Cc1sc2nc(SCC(=O)NCc3ccco3)n(-c3ccccc3)c(=O)c2c1C	InChI=1S/C21H19N3O3S2/c1-13-14(2)29-19-18(13)20(26)24(15-7-4-3-5-8-15)21(23-19)28-12-17(25)22-11-16-9-6-10-27-16/h3-10H,11-12H2,1-2H3,(H,22,25)	FEUMYZAQYLDEPS-UHFFFAOYSA-N	425.086782878							114841
MLS001018558	LSM-15220	BRD-K03225200	2311088	InChI=1S/C24H20ClN2O/c1-28-21-13-11-20(12-14-21)27-23(18-6-9-19(25)10-7-18)16-26-22-5-3-2-4-17(22)8-15-24(26)27/h2-7,9-14,16H,8,15H2,1H3/q+1	LLCHPKABGFRGHB-UHFFFAOYSA-N	COc1ccc(cc1)[n+]2c3CCc4ccccc4n3cc2c5ccc(Cl)cc5	BroadT	BRD-K03225200	BRD-K03225200-004-08-0	Enamine Ltd.	T0502-5569		Br	COc1ccc(cc1)-[n+]1c(cn-2c1CCc1ccccc-21)-c1ccc(Cl)cc1.Br	InChI=1S/C24H20ClN2O.BrH/c1-28-21-13-11-20(12-14-21)27-23(18-6-9-19(25)10-7-18)16-26-22-5-3-2-4-17(22)8-15-24(26)27;/h2-7,9-14,16H,8,15H2,1H3;1H/q+1;	QEPUEYAFKJNCPP-UHFFFAOYSA-N	387.12641599							103867, 103867
MLS-0058733.0001	LSM-26304	SID861482, SID87218763, SID87544156, BRD-K85154427	662723	InChI=1S/C19H15ClN4OS/c20-16-8-2-1-6-14(16)13-26-19-23-22-18(17-9-3-4-10-21-17)24(19)12-15-7-5-11-25-15/h1-11H,12-13H2	PKZVRLOJPOMAAJ-UHFFFAOYSA-N	Clc1ccccc1CSc2nnc(c3ccccn3)n2Cc4occc4	BroadT	BRD-K85154427	BRD-K85154427-001-05-2	InterBioScreen Ltd.	STOCK4S-13029			Clc1ccccc1CSc1nnc(-c2ccccn2)n1Cc1ccco1	InChI=1S/C19H15ClN4OS/c20-16-8-2-1-6-14(16)13-26-19-23-22-18(17-9-3-4-10-21-17)24(19)12-15-7-5-11-25-15/h1-11H,12-13H2	PKZVRLOJPOMAAJ-UHFFFAOYSA-N	382.06550954							114842
SMR000002958	LSM-26305	SID845506, BRD-A21751475	647856	InChI=1S/C21H24N6O4/c28-21-15(8-13-9-17-18(31-12-30-17)10-16(13)22-21)19(26-5-1-2-6-26)20-23-24-25-27(20)11-14-4-3-7-29-14/h8-10,14,19H,1-7,11-12H2,(H,22,28)	FZMLUBURPQWWJO-UHFFFAOYSA-N	Oc1nc2cc3OCOc3cc2cc1C(N4CCCC4)c5nnnn5CC6CCCO6	BroadT	BRD-A21751475	BRD-A21751475-001-05-5	Asinex Ltd.	ASN 04190381			Oc1nc2cc3OCOc3cc2cc1C(N1CCCC1)c1nnnn1CC1CCCO1	InChI=1S/C21H24N6O4/c28-21-15(8-13-9-17-18(31-12-30-17)10-16(13)22-21)19(26-5-1-2-6-26)20-23-24-25-27(20)11-14-4-3-7-29-14/h8-10,14,19H,1-7,11-12H2,(H,22,28)	FZMLUBURPQWWJO-UHFFFAOYSA-N	424.185903308							114843
N'-(4-chlorobenzoyl)-2-hydroxy-3-methylbenzohydrazide	LSM-26306	SID17414527, BRD-K62573456	870346	InChI=1S/C15H13ClN2O3/c1-9-3-2-4-12(13(9)19)15(21)18-17-14(20)10-5-7-11(16)8-6-10/h2-8,19H,1H3,(H,17,20)(H,18,21)	ZGYTXQNJBNXQPJ-UHFFFAOYSA-N	Cc1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2)c1O	BroadT	BRD-K62573456	BRD-K62573456-001-06-2	ChemBridge Corporation	5795957			Cc1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2)c1O	InChI=1S/C15H13ClN2O3/c1-9-3-2-4-12(13(9)19)15(21)18-17-14(20)10-5-7-11(16)8-6-10/h2-8,19H,1H3,(H,17,20)(H,18,21)	ZGYTXQNJBNXQPJ-UHFFFAOYSA-N	304.061470006							114844
T5255403	LSM-26307	SID3716253, BRD-K53756135	2127929	InChI=1S/C20H20N4O4/c1-2-24(10-18-22-15-6-4-3-5-14(15)20(26)23-18)11-19(25)21-13-7-8-16-17(9-13)28-12-27-16/h3-9H,2,10-12H2,1H3,(H,21,25)(H,22,23,26)	LKXUWZZXBNQMRT-UHFFFAOYSA-N	CCN(CC(=O)Nc1ccc2OCOc2c1)Cc3nc(O)c4ccccc4n3	BroadT	BRD-K53756135	BRD-K53756135-001-05-5	Enamine Ltd.	T5255403			CCN(CC(=O)Nc1ccc2OCOc2c1)Cc1nc(O)c2ccccc2n1	InChI=1S/C20H20N4O4/c1-2-24(10-18-22-15-6-4-3-5-14(15)20(26)23-18)11-19(25)21-13-7-8-16-17(9-13)28-12-27-16/h3-9H,2,10-12H2,1H3,(H,21,25)(H,22,23,26)	LKXUWZZXBNQMRT-UHFFFAOYSA-N	380.14845516							114845
ST50941261	LSM-26308	SID3717461, BRD-K21568497	2608481	InChI=1S/C17H19ClN2O2/c1-12-10-16(13(2)22-12)17(21)20-8-6-19(7-9-20)15-5-3-4-14(18)11-15/h3-5,10-11H,6-9H2,1-2H3	QWYINRZMJJWMTH-UHFFFAOYSA-N	Cc1oc(C)c(c1)C(=O)N2CCN(CC2)c3cccc(Cl)c3	BroadT	BRD-K21568497	BRD-K21568497-001-06-3	Enamine Ltd.	T5331346			Cc1cc(C(=O)N2CCN(CC2)c2cccc(Cl)c2)c(C)o1	InChI=1S/C17H19ClN2O2/c1-12-10-16(13(2)22-12)17(21)20-8-6-19(7-9-20)15-5-3-4-14(18)11-15/h3-5,10-11H,6-9H2,1-2H3	QWYINRZMJJWMTH-UHFFFAOYSA-N	318.113505578							114846
AC1O9KMS	LSM-26309	SID862792, BRD-K96026742	6760824	InChI=1S/C20H20N2O4/c1-13(2)12-25-14-8-9-15(16(23)10-14)20-19(11-21-22-20)26-18-7-5-4-6-17(18)24-3/h4-11,23H,1,12H2,2-3H3,(H,21,22)	MENVPFREXUPMCN-UHFFFAOYSA-N	COc1ccccc1Oc2c[nH]nc2c3ccc(OCC(=C)C)cc3O	BroadT	BRD-K96026742	BRD-K96026742-001-05-7	InterBioScreen Ltd.	STOCK4S-56482			COc1ccccc1Oc1c[nH]nc1-c1ccc(OCC(C)=C)cc1O	InChI=1S/C20H20N2O4/c1-13(2)12-25-14-8-9-15(16(23)10-14)20-19(11-21-22-20)26-18-7-5-4-6-17(18)24-3/h4-11,23H,1,12H2,2-3H3,(H,21,22)	MENVPFREXUPMCN-UHFFFAOYSA-N	352.14230714							
4-{[(2-Chloro-1,3-thiazol-5-yl)methyl]sulfanyl}benzenecarboxylic acid	LSM-26310	SID17410288, BRD-K42111185	1480675	InChI=1S/C11H8ClNO2S2/c12-11-13-5-9(17-11)6-16-8-3-1-7(2-4-8)10(14)15/h1-5H,6H2,(H,14,15)	GHMOISZEIKTQDE-UHFFFAOYSA-N	OC(=O)c1ccc(SCc2cnc(Cl)s2)cc1	BroadT	BRD-K42111185	BRD-K42111185-001-06-4	Key Organics Ltd.	5W-0025			OC(=O)c1ccc(SCc2cnc(Cl)s2)cc1	InChI=1S/C11H8ClNO2S2/c12-11-13-5-9(17-11)6-16-8-3-1-7(2-4-8)10(14)15/h1-5H,6H2,(H,14,15)	GHMOISZEIKTQDE-UHFFFAOYSA-N	284.968497596							114848
BAS 03181272	LSM-26311	SID24806530, BRD-K62791766	2254951	InChI=1S/C11H9N3O3/c15-6-5-14-10-7-3-1-2-4-8(7)17-11(16)9(10)12-13-14/h1-4,15H,5-6H2	QZQOQRVWBXBSOT-UHFFFAOYSA-N	OCCn1nnc2C(=O)Oc3ccccc3c12	BroadT	BRD-K62791766	BRD-K62791766-001-05-7	Asinex Ltd.	BAS 03181272			OCCn1nnc2c1c1ccccc1oc2=O	InChI=1S/C11H9N3O3/c15-6-5-14-10-7-3-1-2-4-8(7)17-11(16)9(10)12-13-14/h1-4,15H,5-6H2	QZQOQRVWBXBSOT-UHFFFAOYSA-N	231.064391178							114849
T0506-2116	LSM-26312	SID17516044, BRD-K50340937	2354876	InChI=1S/C23H18N2O6/c1-15-9-11-16(12-10-15)22(27)19-7-2-3-8-20(19)23(28)31-14-21(26)24-17-5-4-6-18(13-17)25(29)30/h2-13H,14H2,1H3,(H,24,26)	FRINEQRALXNDGK-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)c2ccccc2C(=O)OCC(=O)Nc3cccc(c3)[N+](=O)[O-]	BroadT	BRD-K50340937	BRD-K50340937-001-05-1	Enamine Ltd.	T0506-2116			Cc1ccc(cc1)C(=O)c1ccccc1C(=O)OCC(=O)Nc1cccc(c1)[N+]([O-])=O	InChI=1S/C23H18N2O6/c1-15-9-11-16(12-10-15)22(27)19-7-2-3-8-20(19)23(28)31-14-21(26)24-17-5-4-6-18(13-17)25(29)30/h2-13H,14H2,1H3,(H,24,26)	FRINEQRALXNDGK-UHFFFAOYSA-N	418.116486316							114850
T5244708	LSM-26313	SID3717177, BRD-K64422077	2116211	InChI=1S/C17H15N3O3S/c1-10-3-4-15(21)14(5-10)17(23)12-7-18-20(8-12)16(22)6-13-9-24-11(2)19-13/h3-5,7-9,21H,6H2,1-2H3	WTAJHNPXWRFBGT-UHFFFAOYSA-N	Cc1ccc(O)c(c1)C(=O)c2cnn(c2)C(=O)Cc3csc(C)n3	BroadT	BRD-K64422077	BRD-K64422077-001-04-4	Enamine Ltd.	T5244708			Cc1nc(CC(=O)n2cc(cn2)C(=O)c2cc(C)ccc2O)cs1	InChI=1S/C17H15N3O3S/c1-10-3-4-15(21)14(5-10)17(23)12-7-18-20(8-12)16(22)6-13-9-24-11(2)19-13/h3-5,7-9,21H,6H2,1-2H3	WTAJHNPXWRFBGT-UHFFFAOYSA-N	341.08341206							114851
SMR000012167	LSM-26314	SID848493, BRD-K25623999	650942	InChI=1S/C16H23N3O3/c1-12-13(10-17)15(21)19(8-5-9-20)16(22)14(12)11-18-6-3-2-4-7-18/h20,22H,2-9,11H2,1H3	SUHNLTKVHGUCDT-UHFFFAOYSA-N	CC1=C(C#N)C(=O)N(CCCO)C(=C1CN2CCCCC2)O	BroadT	BRD-K25623999	BRD-K25623999-001-06-5	Asinex Ltd.	BAS 03294568			Cc1c(CN2CCCCC2)c(O)n(CCCO)c(=O)c1C#N	InChI=1S/C16H23N3O3/c1-12-13(10-17)15(21)19(8-5-9-20)16(22)14(12)11-18-6-3-2-4-7-18/h20,22H,2-9,11H2,1H3	SUHNLTKVHGUCDT-UHFFFAOYSA-N	305.173941626							114852
STK034434	LSM-26315	SID24810818, BRD-K58944846	3550153	InChI=1S/C23H27N3OS/c1-18-7-3-6-10-22(18)27-16-15-26-17-20(19-8-4-5-9-21(19)26)23(28)25-13-11-24(2)12-14-25/h3-10,17H,11-16H2,1-2H3	VEJZRVBLKGZKPW-UHFFFAOYSA-N	CN1CCN(CC1)C(=S)c2cn(CCOc3ccccc3C)c4ccccc24	BroadT	BRD-K58944846	BRD-K58944846-001-05-2	ChemDiv Inc.	5371-1435			CN1CCN(CC1)C(=S)c1cn(CCOc2ccccc2C)c2ccccc12	InChI=1S/C23H27N3OS/c1-18-7-3-6-10-22(18)27-16-15-26-17-20(19-8-4-5-9-21(19)26)23(28)25-13-11-24(2)12-14-25/h3-10,17H,11-16H2,1-2H3	VEJZRVBLKGZKPW-UHFFFAOYSA-N	393.187483204							114853
AC1NBAE9	LSM-15390	BRD-A96826680	4440122	InChI=1S/C15H28N2O/c1-14(2)11-7-8-12(9-11)15(14,3)16-13(18)10-17(4,5)6/h11-12H,7-10H2,1-6H3/p+1	XXQURODNNRBKEW-UHFFFAOYSA-O	CC1(C)C2CCC(C2)C1(C)NC(=O)C[N+](C)(C)C	BroadT	BRD-A96826680	BRD-A96826680-003-05-2	InterBioScreen Ltd.	STOCK1S-94008		Cl	CC1(C)C2CCC(C2)C1(C)NC(=O)C[N+](C)(C)C.Cl	InChI=1S/C15H28N2O.ClH/c1-14(2)11-7-8-12(9-11)15(14,3)16-13(18)10-17(4,5)6;/h11-12H,7-10H2,1-6H3;1H/p+1	DZXHQKSSVFAZEM-UHFFFAOYSA-O	253.227988568							104032, 104032
MLS000374570	LSM-26316	SID22402773, BRD-A02503159	3540946	InChI=1S/C27H22N2O6S2/c1-18(30)20-11-7-12-21(17-20)28-26(31)25(19-9-3-2-4-10-19)35-27(32)22-13-5-6-14-23(22)29-37(33,34)24-15-8-16-36-24/h2-17,25,29H,1H3,(H,28,31)	NXMSBWZPDMYQRQ-UHFFFAOYSA-N	CC(=O)c1cccc(NC(=O)C(OC(=O)c2ccccc2NS(=O)(=O)c3cccs3)c4ccccc4)c1	BroadT	BRD-A02503159	BRD-A02503159-001-05-6	Enamine Ltd.	T0516-6341			CC(=O)c1cccc(NC(=O)C(OC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c2ccccc2)c1	InChI=1S/C27H22N2O6S2/c1-18(30)20-11-7-12-21(17-20)28-26(31)25(19-9-3-2-4-10-19)35-27(32)22-13-5-6-14-23(22)29-37(33,34)24-15-8-16-36-24/h2-17,25,29H,1H3,(H,28,31)	NXMSBWZPDMYQRQ-UHFFFAOYSA-N	534.091927824							114854
AC1LLUOJ	LSM-26317	BRD-K58893347	1073636	InChI=1S/C21H16N4O2/c26-21(19-12-7-13-27-19)23-22-14-17-15-25(18-10-5-2-6-11-18)24-20(17)16-8-3-1-4-9-16/h1-15H,(H,23,26)	PGMUYVZMPKMYNI-UHFFFAOYSA-N	O=C(NN=Cc1cn(nc1c2ccccc2)c3ccccc3)c4occc4	BroadT	BRD-K58893347	BRD-K58893347-001-05-5	Asinex Ltd.	BAS 02104528			O=C(NN=Cc1cn(nc1-c1ccccc1)-c1ccccc1)c1ccco1	InChI=1S/C21H16N4O2/c26-21(19-12-7-13-27-19)23-22-14-17-15-25(18-10-5-2-6-11-18)24-20(17)16-8-3-1-4-9-16/h1-15H,(H,23,26)	PGMUYVZMPKMYNI-UHFFFAOYSA-N	356.127325792							114855
MLS000533896	LSM-26318	SID14738992, BRD-K01759431	788565	InChI=1S/C16H19N3O/c1-3-16(19-9-11-20-12-10-19)4-2-15(1)18-13-14-5-7-17-8-6-14/h1-8,18H,9-13H2	YGHPMOCMMSDMAZ-UHFFFAOYSA-N	C(Nc1ccc(cc1)N2CCOCC2)c3ccncc3	BroadT	BRD-K01759431	BRD-K01759431-001-05-3	ChemBridge Corporation	6104953			C(Nc1ccc(cc1)N1CCOCC1)c1ccncc1	InChI=1S/C16H19N3O/c1-3-16(19-9-11-20-12-10-19)4-2-15(1)18-13-14-5-7-17-8-6-14/h1-8,18H,9-13H2	YGHPMOCMMSDMAZ-UHFFFAOYSA-N	269.152812258							114856
SMR000060840	LSM-26319	SID3716330, BRD-K91234654	730319	InChI=1S/C14H9N3O2S2/c18-10(11-5-3-7-19-11)8-20-13-15-16-14-17(13)9-4-1-2-6-12(9)21-14/h1-7H,8H2	JURPOFUGWOBVIO-UHFFFAOYSA-N	O=C(CSc1nnc2sc3ccccc3n12)c4occc4	BroadT	BRD-K91234654	BRD-K91234654-001-05-8	Enamine Ltd.	T0505-0688			O=C(CSc1nnc2sc3ccccc3n12)c1ccco1	InChI=1S/C14H9N3O2S2/c18-10(11-5-3-7-19-11)8-20-13-15-16-14-17(13)9-4-1-2-6-12(9)21-14/h1-7H,8H2	JURPOFUGWOBVIO-UHFFFAOYSA-N	315.013617938							114857
SMR000043346	LSM-26320	SID861421, BRD-K74977283	662667	InChI=1S/C20H14Cl2N4O2S/c21-16-6-5-13(9-17(16)22)18(27)12-29-20-25-24-19(14-3-1-7-23-10-14)26(20)11-15-4-2-8-28-15/h1-10H,11-12H2	LKMSMQNVNZLANE-UHFFFAOYSA-N	Clc1ccc(cc1Cl)C(=O)CSc2nnc(c3cccnc3)n2Cc4occc4	BroadT	BRD-K74977283	BRD-K74977283-001-05-2	InterBioScreen Ltd.	STOCK4S-10169			Clc1ccc(cc1Cl)C(=O)CSc1nnc(-c2cccnc2)n1Cc1ccco1	InChI=1S/C20H14Cl2N4O2S/c21-16-6-5-13(9-17(16)22)18(27)12-29-20-25-24-19(14-3-1-7-23-10-14)26(20)11-15-4-2-8-28-15/h1-10H,11-12H2	LKMSMQNVNZLANE-UHFFFAOYSA-N	444.021451838							114858
MLS000778506	LSM-26321	SID26658594, BRD-K10601491	1968565	InChI=1S/C18H19N5O3/c1-4-26-17(25)15-10-19-18(23-12(3)9-11(2)22-23)21-16(15)20-13-5-7-14(24)8-6-13/h5-10,24H,4H2,1-3H3,(H,19,20,21)	JLQSDPUKMIJEII-UHFFFAOYSA-N	CCOC(=O)c1cnc(nc1Nc2ccc(O)cc2)n3nc(C)cc3C	BroadT	BRD-K10601491	BRD-K10601491-001-06-1	InterBioScreen Ltd.	STOCK4S-05997			CCOC(=O)c1cnc(nc1Nc1ccc(O)cc1)-n1nc(C)cc1C	InChI=1S/C18H19N5O3/c1-4-26-17(25)15-10-19-18(23-12(3)9-11(2)22-23)21-16(15)20-13-5-7-14(24)8-6-13/h5-10,24H,4H2,1-3H3,(H,19,20,21)	JLQSDPUKMIJEII-UHFFFAOYSA-N	353.148789518							114859
ST50655289	LSM-26322	SID17413887, BRD-K66795831	2233519	InChI=1S/C24H23FN2O8/c1-4-34-23(29)17-12-26(16-8-6-7-15(25)11-16)13-18(24(30)35-5-2)21(17)14-9-19(27(31)32)22(28)20(10-14)33-3/h6-13,21,28H,4-5H2,1-3H3	LDGNVSYTILRGDO-UHFFFAOYSA-N	CCOC(=O)C1=CN(C=C(C1c2cc(OC)c(O)c(c2)[N+](=O)[O-])C(=O)OCC)c3cccc(F)c3	BroadT	BRD-K66795831	BRD-K66795831-001-06-3	ChemBridge Corporation	7970418			CCOC(=O)C1=CN(C=C(C1c1cc(OC)c(O)c(c1)[N+]([O-])=O)C(=O)OCC)c1cccc(F)c1	InChI=1S/C24H23FN2O8/c1-4-34-23(29)17-12-26(16-8-6-7-15(25)11-16)13-18(24(30)35-5-2)21(17)14-9-19(27(31)32)22(28)20(10-14)33-3/h6-13,21,28H,4-5H2,1-3H3	LDGNVSYTILRGDO-UHFFFAOYSA-N	486.143843916							114860
MLS000558042	LSM-26323	SID14742809, BRD-K30185021	1988521	InChI=1S/C25H24N6O2S/c1-3-30-21-7-5-4-6-19(21)20-14-17(10-13-22(20)30)27-23(32)15-34-25-29-28-24(31(25)26)16-8-11-18(33-2)12-9-16/h4-14H,3,15,26H2,1-2H3,(H,27,32)	GJNVYCCWYGSTRP-UHFFFAOYSA-N	CCn1c2ccccc2c3cc(NC(=O)CSc4nnc(c5ccc(OC)cc5)n4N)ccc13	BroadT	BRD-K30185021	BRD-K30185021-001-05-2	InterBioScreen Ltd.	STOCK4S-23030			CCn1c2ccccc2c2cc(NC(=O)CSc3nnc(-c4ccc(OC)cc4)n3N)ccc12	InChI=1S/C25H24N6O2S/c1-3-30-21-7-5-4-6-19(21)20-14-17(10-13-22(20)30)27-23(32)15-34-25-29-28-24(31(25)26)16-8-11-18(33-2)12-9-16/h4-14H,3,15,26H2,1-2H3,(H,27,32)	GJNVYCCWYGSTRP-UHFFFAOYSA-N	472.168144758							114861
STK135104	LSM-26324	SID14726344, BRD-K53493992	973120	InChI=1S/C17H17N3O2S/c1-11-5-4-8-18-16(11)20-17-19-13(10-23-17)12-6-7-14(21-2)15(9-12)22-3/h4-10H,1-3H3,(H,18,19,20)	QLDLWULSIMIMHS-UHFFFAOYSA-N	COc1ccc(cc1OC)c2csc(Nc3ncccc3C)n2	BroadT	BRD-K53493992	BRD-K53493992-001-05-7	Asinex Ltd.	BAS 08769870			COc1ccc(cc1OC)-c1csc(Nc2ncccc2C)n1	InChI=1S/C17H17N3O2S/c1-11-5-4-8-18-16(11)20-17-19-13(10-23-17)12-6-7-14(21-2)15(9-12)22-3/h4-10H,1-3H3,(H,18,19,20)	QLDLWULSIMIMHS-UHFFFAOYSA-N	327.104147504							114862
STK358142	LSM-26325	SID7973405, BRD-K66102950	2252415	InChI=1S/C17H20N2O3S/c1-2-18-17(20)14-19(13-15-9-5-3-6-10-15)23(21,22)16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3,(H,18,20)	VYGXGDJJDIBRJI-UHFFFAOYSA-N	CCNC(=O)CN(Cc1ccccc1)S(=O)(=O)c2ccccc2	BroadT	BRD-K66102950	BRD-K66102950-001-05-9	ChemBridge Corporation	5607417			CCNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccccc1	InChI=1S/C17H20N2O3S/c1-2-18-17(20)14-19(13-15-9-5-3-6-10-15)23(21,22)16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3,(H,18,20)	VYGXGDJJDIBRJI-UHFFFAOYSA-N	332.11946321							114863
SMR000119052	LSM-26326	SID14721531, BRD-A36422927	3190231	InChI=1S/C23H28N6O3S2/c30-20(15-28-26-22(25-27-28)19-10-5-13-34-19)29(16-6-1-2-7-16)21(18-9-4-12-33-18)23(31)24-14-17-8-3-11-32-17/h4-5,9-10,12-13,16-17,21H,1-3,6-8,11,14-15H2,(H,24,31)	IXVNMHKBGZUMBO-UHFFFAOYSA-N	O=C(Cn1nnc(n1)c2cccs2)N(C(C(=O)NCC3CCCO3)c4cccs4)C5CCCC5	BroadT	BRD-A36422927	BRD-A36422927-001-05-0	Asinex Ltd.	ASN 04509174			O=C(NCC1CCCO1)C(N(C1CCCC1)C(=O)Cn1nnc(n1)-c1cccs1)c1cccs1	InChI=1S/C23H28N6O3S2/c30-20(15-28-26-22(25-27-28)19-10-5-13-34-19)29(16-6-1-2-7-16)21(18-9-4-12-33-18)23(31)24-14-17-8-3-11-32-17/h4-5,9-10,12-13,16-17,21H,1-3,6-8,11,14-15H2,(H,24,31)	IXVNMHKBGZUMBO-UHFFFAOYSA-N	500.166430196							114864
AC1LCHUZ	LSM-26327	SID848028, BRD-K43290614	650452	InChI=1S/C20H20ClN3O4S/c21-14-1-3-16-17(11-14)23-20(22-16)13-5-7-24(8-6-13)29(25,26)15-2-4-18-19(12-15)28-10-9-27-18/h1-4,11-13H,5-10H2,(H,22,23)	PTAVAGHPTJSPBH-UHFFFAOYSA-N	Clc1ccc2[nH]c(nc2c1)C3CCN(CC3)S(=O)(=O)c4ccc5OCCOc5c4	BroadT	BRD-K43290614	BRD-K43290614-001-05-8	Asinex Ltd.	ASN 06580545			Clc1ccc2[nH]c(nc2c1)C1CCN(CC1)S(=O)(=O)c1ccc2OCCOc2c1	InChI=1S/C20H20ClN3O4S/c21-14-1-3-16-17(11-14)23-20(22-16)13-5-7-24(8-6-13)29(25,26)15-2-4-18-19(12-15)28-10-9-27-18/h1-4,11-13H,5-10H2,(H,22,23)	PTAVAGHPTJSPBH-UHFFFAOYSA-N	433.08630455							114865
AMBCB67830931	LSM-26328	SID24786142, BRD-A02502222	16188949	InChI=1S/C22H25N3O3/c1-25(14-19-16-26-12-13-27-19)15-20-23-22(24-28-20)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,19,21H,12-16H2,1H3	NJPYPBRTHCCIND-UHFFFAOYSA-N	CN(CC1COCCO1)Cc2onc(n2)C(c3ccccc3)c4ccccc4	BroadT	BRD-A02502222	BRD-A02502222-001-05-1	ChemBridge Corporation	67830931			CN(CC1COCCO1)Cc1nc(no1)C(c1ccccc1)c1ccccc1	InChI=1S/C22H25N3O3/c1-25(14-19-16-26-12-13-27-19)15-20-23-22(24-28-20)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,19,21H,12-16H2,1H3	NJPYPBRTHCCIND-UHFFFAOYSA-N	379.18959169							114866
MLS000094281	LSM-26329	SID4252410, BRD-K86012160	3245967	InChI=1S/C14H16N2O2S/c1-2-18-12-7-4-3-6-11(12)10-15-14(17)16-13-8-5-9-19-13/h3-9H,2,10H2,1H3,(H2,15,16,17)	GGRKNAVHMVVVKD-UHFFFAOYSA-N	CCOc1ccccc1CNC(=O)Nc2cccs2	BroadT	BRD-K86012160	BRD-K86012160-001-05-2	ChemDiv Inc.	E002-0005			CCOc1ccccc1CNC(=O)Nc1cccs1	InChI=1S/C14H16N2O2S/c1-2-18-12-7-4-3-6-11(12)10-15-14(17)16-13-8-5-9-19-13/h3-9H,2,10H2,1H3,(H2,15,16,17)	GGRKNAVHMVVVKD-UHFFFAOYSA-N	276.093248462							114867
AC1MQG9Z	LSM-15391	BRD-K51784280	3451299	InChI=1S/C11H13FN6/c1-2-10-15-17-11(18(10)13)16-14-7-8-5-3-4-6-9(8)12/h3-7H,2,13H2,1H3,(H,16,17)	DGHXNZQGSIGCPJ-UHFFFAOYSA-N	CCc1nnc(NN=Cc2ccccc2F)n1N	BroadT	BRD-K51784280	BRD-K51784280-003-05-8	ChemDiv Inc.	8008-9019		Cl	CCc1nnc(NN=Cc2ccccc2F)n1N.Cl	InChI=1S/C11H13FN6.ClH/c1-2-10-15-17-11(18(10)13)16-14-7-8-5-3-4-6-9(8)12;/h3-7H,2,13H2,1H3,(H,16,17);1H	ZWPXNMRDLGPTCX-UHFFFAOYSA-N	248.118572676							104033
ST50865991	LSM-26330	SID49826951, BRD-K08385872	6468205	InChI=1S/C14H15N3O2/c1-10-3-4-13(19-2)12(9-10)17-14(18)16-11-5-7-15-8-6-11/h3-9H,1-2H3,(H2,15,16,17,18)	VVOAMFHAJNZXMP-UHFFFAOYSA-N	COc1ccc(C)cc1NC(=O)Nc2ccncc2	BroadT	BRD-K08385872	BRD-K08385872-001-05-6	Chemical Technologies & Investigations	AMNCO-30081			COc1ccc(C)cc1NC(=O)Nc1ccncc1	InChI=1S/C14H15N3O2/c1-10-3-4-13(19-2)12(9-10)17-14(18)16-11-5-7-15-8-6-11/h3-9H,1-2H3,(H2,15,16,17,18)	VVOAMFHAJNZXMP-UHFFFAOYSA-N	257.11642675							114868
T0510-7420	LSM-26331	SID26724266, BRD-K44472573	2386022	InChI=1S/C23H23NO5S/c1-29-21-13-12-20(23(25)26)16-22(21)30(27,28)24(17-19-10-6-3-7-11-19)15-14-18-8-4-2-5-9-18/h2-13,16H,14-15,17H2,1H3,(H,25,26)	HSQBDHJDOYWBQV-UHFFFAOYSA-N	COc1ccc(cc1S(=O)(=O)N(CCc2ccccc2)Cc3ccccc3)C(=O)O	BroadT	BRD-K44472573	BRD-K44472573-001-05-0	Enamine Ltd.	T0510-7420			COc1ccc(cc1S(=O)(=O)N(CCc1ccccc1)Cc1ccccc1)C(O)=O	InChI=1S/C23H23NO5S/c1-29-21-13-12-20(23(25)26)16-22(21)30(27,28)24(17-19-10-6-3-7-11-19)15-14-18-8-4-2-5-9-18/h2-13,16H,14-15,17H2,1H3,(H,25,26)	HSQBDHJDOYWBQV-UHFFFAOYSA-N	425.129693536							114869
MLS000558301	LSM-26332	SID17408981, BRD-A86597680	3221486	InChI=1S/C22H25N3OS2/c1-15-10-16(2)13-25(12-15)21(26)14-28-22-18-7-3-4-8-19(18)23-20(24-22)11-17-6-5-9-27-17/h3-9,15-16H,10-14H2,1-2H3	SGORSFNEAJAJHL-UHFFFAOYSA-N	CC1CC(C)CN(C1)C(=O)CSc2nc(Cc3cccs3)nc4ccccc24	BroadT	BRD-A86597680	BRD-A86597680-001-05-5	Asinex Ltd.	ASN 06533087			CC1CC(C)CN(C1)C(=O)CSc1nc(Cc2cccs2)nc2ccccc12	InChI=1S/C22H25N3OS2/c1-15-10-16(2)13-25(12-15)21(26)14-28-22-18-7-3-4-8-19(18)23-20(24-22)11-17-6-5-9-27-17/h3-9,15-16H,10-14H2,1-2H3	SGORSFNEAJAJHL-UHFFFAOYSA-N	411.14390383							114870
F0599-0058	LSM-26333	SID4242052, BRD-K99609423	3236954	InChI=1S/C16H17N5OS3/c1-3-23-16-20-19-14(25-16)18-13(22)10-24-15-17-7-8-21(15)12-6-4-5-11(2)9-12/h4-9H,3,10H2,1-2H3,(H,18,19,22)	BQSDVILHDHVVLP-UHFFFAOYSA-N	CCSc1nnc(NC(=O)CSc2nccn2c3cccc(C)c3)s1	BroadT	BRD-K99609423	BRD-K99609423-001-05-3	ChemDiv Inc.	C262-0058			CCSc1nnc(NC(=O)CSc2nccn2-c2cccc(C)c2)s1	InChI=1S/C16H17N5OS3/c1-3-23-16-20-19-14(25-16)18-13(22)10-24-15-17-7-8-21(15)12-6-4-5-11(2)9-12/h4-9H,3,10H2,1-2H3,(H,18,19,22)	BQSDVILHDHVVLP-UHFFFAOYSA-N	391.059522284							114871
MLS000665517	LSM-26334	SID22416016, BRD-K91897328	1190108	InChI=1S/C25H24N4O/c1-18-5-4-6-19(17-18)24-27-23-8-3-2-7-22(23)25(28-24)26-20-9-11-21(12-10-20)29-13-15-30-16-14-29/h2-12,17H,13-16H2,1H3,(H,26,27,28)	VAUJUBZDJPZPPG-UHFFFAOYSA-N	Cc1cccc(c1)c2nc(Nc3ccc(cc3)N4CCOCC4)c5ccccc5n2	BroadT	BRD-K91897328	BRD-K91897328-001-07-4	ChemBridge Corporation	6888605			Cc1cccc(c1)-c1nc(Nc2ccc(cc2)N2CCOCC2)c2ccccc2n1	InChI=1S/C25H24N4O/c1-18-5-4-6-19(17-18)24-27-23-8-3-2-7-22(23)25(28-24)26-20-9-11-21(12-10-20)29-13-15-30-16-14-29/h2-12,17H,13-16H2,1H3,(H,26,27,28)	VAUJUBZDJPZPPG-UHFFFAOYSA-N	396.195011428							114872
BRD-A29660540	LSM-26335			InChI=1S/C24H20N2O5/c1-30-17-11-9-15(10-12-17)21-20(22(27)16-6-5-7-18(14-16)31-2)23(28)24(29)26(21)19-8-3-4-13-25-19/h3-14,20-21H,1-2H3	YULKRCRRKXFSST-UHFFFAOYSA-N	COc1ccc(cc1)C2C(C(=O)c3cccc(OC)c3)C(=O)C(=O)N2c4ccccn4	BroadT	BRD-A29660540	BRD-A29660540-001-05-1	InterBioScreen Ltd.	STOCK3S-82739			COc1ccc(cc1)C1C(C(=O)c2cccc(OC)c2)C(=O)C(=O)N1c1ccccn1	InChI=1S/C24H20N2O5/c1-30-17-11-9-15(10-12-17)21-20(22(27)16-6-5-7-18(14-16)31-2)23(28)24(29)26(21)19-8-3-4-13-25-19/h3-14,20-21H,1-2H3	YULKRCRRKXFSST-UHFFFAOYSA-N	416.13722176							114873
SMR000004331	LSM-26336	SID851167, BRD-K13570689	653728	InChI=1S/C21H18N6O4/c1-30-15-10-8-14(9-11-15)22-19(28)13-27-25-20(24-26-27)16-5-2-3-6-17(16)23-21(29)18-7-4-12-31-18/h2-12H,13H2,1H3,(H,22,28)(H,23,29)	JWUXDKXSUBASKG-UHFFFAOYSA-N	COc1ccc(NC(=O)Cn2nnc(n2)c3ccccc3NC(=O)c4occc4)cc1	BroadT	BRD-K13570689	BRD-K13570689-001-05-9	Asinex Ltd.	ASN 05296076			COc1ccc(NC(=O)Cn2nnc(n2)-c2ccccc2NC(=O)c2ccco2)cc1	InChI=1S/C21H18N6O4/c1-30-15-10-8-14(9-11-15)22-19(28)13-27-25-20(24-26-27)16-5-2-3-6-17(16)23-21(29)18-7-4-12-31-18/h2-12H,13H2,1H3,(H,22,28)(H,23,29)	JWUXDKXSUBASKG-UHFFFAOYSA-N	418.138953116							114874
MLS000097714	LSM-26337	SID3712587, BRD-A20971274	2998082	InChI=1S/C16H20N4O4S/c1-3-16(2)14(23)20(15(24)19-16)7-10(21)18-13-11(12(17)22)8-5-4-6-9(8)25-13/h3-7H2,1-2H3,(H2,17,22)(H,18,21)(H,19,24)	FNFQXHMKSUJOJW-UHFFFAOYSA-N	CCC1(C)NC(=O)N(CC(=O)Nc2sc3CCCc3c2C(=O)N)C1=O	BroadT	BRD-A20971274	BRD-A20971274-001-06-1	Enamine Ltd.	T5254262			CCC1(C)NC(=O)N(CC(=O)Nc2sc3CCCc3c2C(N)=O)C1=O	InChI=1S/C16H20N4O4S/c1-3-16(2)14(23)20(15(24)19-16)7-10(21)18-13-11(12(17)22)8-5-4-6-9(8)25-13/h3-7H2,1-2H3,(H2,17,22)(H,18,21)(H,19,24)	FNFQXHMKSUJOJW-UHFFFAOYSA-N	364.12052585							114875
BAS 06731041	LSM-26338	SID842156, BRD-A20398558	644412	InChI=1S/C22H20N2O4/c1-27-19-10-6-5-9-17(19)24-21(14-11-12-18(25)20(13-14)28-2)23-16-8-4-3-7-15(16)22(24)26/h3-13,21,23,25H,1-2H3	ZRONGYGNCHSBHS-UHFFFAOYSA-N	COc1ccccc1N2C(Nc3ccccc3C2=O)c4ccc(O)c(OC)c4	BroadT	BRD-A20398558	BRD-A20398558-001-05-6	Asinex Ltd.	BAS 06731041			COc1cc(ccc1O)C1Nc2ccccc2C(=O)N1c1ccccc1OC	InChI=1S/C22H20N2O4/c1-27-19-10-6-5-9-17(19)24-21(14-11-12-18(25)20(13-14)28-2)23-16-8-4-3-7-15(16)22(24)26/h3-13,21,23,25H,1-2H3	ZRONGYGNCHSBHS-UHFFFAOYSA-N	376.14230714							114876
MLS000679942	LSM-26339	SID24797436, BRD-K26385698	2238406	InChI=1S/C13H15Cl2N3O2S/c1-13(2,3)11(20)16-12(21)18-17-10(19)8-5-4-7(14)6-9(8)15/h4-6H,1-3H3,(H,17,19)(H2,16,18,20,21)	PARYXWHDTYLTQP-UHFFFAOYSA-N	CC(C)(C)C(=O)NC(=S)NNC(=O)c1ccc(Cl)cc1Cl	BroadT	BRD-K26385698	BRD-K26385698-001-06-4	ChemBridge Corporation	7985160			CC(C)(C)C(=O)NC(=S)NNC(=O)c1ccc(Cl)cc1Cl	InChI=1S/C13H15Cl2N3O2S/c1-13(2,3)11(20)16-12(21)18-17-10(19)8-5-4-7(14)6-9(8)15/h4-6H,1-3H3,(H,17,19)(H2,16,18,20,21)	PARYXWHDTYLTQP-UHFFFAOYSA-N	347.02620286							114877
ASN 08221961	LSM-26340	SID851006, BRD-K59855942	653559	InChI=1S/C20H20N2O4/c1-2-25-20(24)17-12-18-16(9-11-26-18)22(17)13-19(23)21-10-5-7-14-6-3-4-8-15(14)21/h3-4,6,8-9,11-12H,2,5,7,10,13H2,1H3	LVRHABGQKFQNCY-UHFFFAOYSA-N	CCOC(=O)c1cc2occc2n1CC(=O)N3CCCc4ccccc34	BroadT	BRD-K59855942	BRD-K59855942-001-06-0	Asinex Ltd.	ASN 08221961			CCOC(=O)c1cc2occc2n1CC(=O)N1CCCc2ccccc12	InChI=1S/C20H20N2O4/c1-2-25-20(24)17-12-18-16(9-11-26-18)22(17)13-19(23)21-10-5-7-14-6-3-4-8-15(14)21/h3-4,6,8-9,11-12H,2,5,7,10,13H2,1H3	LVRHABGQKFQNCY-UHFFFAOYSA-N	352.14230714							114878
F1055-0233	LSM-26341	SID4254931, BRD-K44206907	706367	InChI=1S/C17H21NO4S/c1-11(2)15-10-16(12(3)9-17(15)19)18-23(20,21)14-7-5-13(22-4)6-8-14/h5-11,18-19H,1-4H3	NGWJQCDRHNFCSY-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)Nc2cc(C(C)C)c(O)cc2C	BroadT	BRD-K44206907	BRD-K44206907-001-05-9	ChemBridge Corporation	7176608			COc1ccc(cc1)S(=O)(=O)Nc1cc(C(C)C)c(O)cc1C	InChI=1S/C17H21NO4S/c1-11(2)15-10-16(12(3)9-17(15)19)18-23(20,21)14-7-5-13(22-4)6-8-14/h5-11,18-19H,1-4H3	NGWJQCDRHNFCSY-UHFFFAOYSA-N	335.119128852							114879
AK-968/41024875	LSM-26342	SID17401119, BRD-A76228075	5159576	InChI=1S/C19H19N3OS2/c1-11-7-8-14-15(10-20)18(25-16(14)9-11)22-19(24)21-17(23)13-6-4-3-5-12(13)2/h3-6,11H,7-9H2,1-2H3,(H2,21,22,23,24)	HCVKEOMJMKJSJH-UHFFFAOYSA-N	CC1CCc2c(C1)sc(NC(=S)NC(=O)c3ccccc3C)c2C#N	BroadT	BRD-A76228075	BRD-A76228075-001-05-2	Specs	AK-968/41024875			CC1CCc2c(C1)sc(NC(=S)NC(=O)c1ccccc1C)c2C#N	InChI=1S/C19H19N3OS2/c1-11-7-8-14-15(10-20)18(25-16(14)9-11)22-19(24)21-17(23)13-6-4-3-5-12(13)2/h3-6,11H,7-9H2,1-2H3,(H2,21,22,23,24)	HCVKEOMJMKJSJH-UHFFFAOYSA-N	369.096953638							114880
F0453-0309	LSM-26343	SID7970259, BRD-K95425880	1291335	InChI=1S/C16H15ClN4O2S/c1-8(2)15-19-20-16(24-15)18-14(22)12-9(3)23-21-13(12)10-6-4-5-7-11(10)17/h4-8H,1-3H3,(H,18,20,22)	AMSYFDFBIFZQBP-UHFFFAOYSA-N	CC(C)c1nnc(NC(=O)c2c(C)onc2c3ccccc3Cl)s1	BroadT	BRD-K95425880	BRD-K95425880-001-04-7	Life Chemicals Inc.	F0453-0309			CC(C)c1nnc(NC(=O)c2c(C)onc2-c2ccccc2Cl)s1	InChI=1S/C16H15ClN4O2S/c1-8(2)15-19-20-16(24-15)18-14(22)12-9(3)23-21-13(12)10-6-4-5-7-11(10)17/h4-8H,1-3H3,(H,18,20,22)	AMSYFDFBIFZQBP-UHFFFAOYSA-N	362.06042416							114881
5-Benzyl-1,4,5,6-tetrahydro-[1,3,5]triazin-2-yl-cyanamide	LSM-26344	SID3715116, BRD-K82283388	944503	InChI=1S/C11H13N5/c12-7-13-11-14-8-16(9-15-11)6-10-4-2-1-3-5-10/h1-5H,6,8-9H2,(H2,13,14,15)	ZETWHUQIVXOREE-UHFFFAOYSA-N	N#CNC1=NCN(Cc2ccccc2)CN1	BroadT	BRD-K82283388	BRD-K82283388-001-05-9	Enamine Ltd.	T5339630			N#CNC1=NCN(Cc2ccccc2)CN1	InChI=1S/C11H13N5/c12-7-13-11-14-8-16(9-15-11)6-10-4-2-1-3-5-10/h1-5H,6,8-9H2,(H2,13,14,15)	ZETWHUQIVXOREE-UHFFFAOYSA-N	215.117095466							114882
2-Bromo-n-[3-(pentanoylamino)phenyl]benzamide	LSM-3693	BRD-K75903201, SID17414307, SID87219016, SID87457112	2186104	InChI=1S/C18H19BrN2O2/c1-2-3-11-17(22)20-13-7-6-8-14(12-13)21-18(23)15-9-4-5-10-16(15)19/h4-10,12H,2-3,11H2,1H3,(H,20,22)(H,21,23)	AKMWGEBAOLJYCR-UHFFFAOYSA-N	CCCCC(=O)Nc1cccc(NC(=O)c2ccccc2Br)c1	BroadT	BRD-K75903201	BRD-K75903201-001-09-8	ChemBridge Corporation	7367082			CCCCC(=O)Nc1cccc(NC(=O)c2ccccc2Br)c1	InChI=1S/C18H19BrN2O2/c1-2-3-11-17(22)20-13-7-6-8-14(12-13)21-18(23)15-9-4-5-10-16(15)19/h4-10,12H,2-3,11H2,1H3,(H,20,22)(H,21,23)	AKMWGEBAOLJYCR-UHFFFAOYSA-N	374.062990468							93331
AC1LD9Z9	LSM-15392	BRD-A44310174	663671	InChI=1S/C19H21N3O3/c1-3-24-19(23)13-7-6-10-22(11-13)18-17-16(20-12(2)21-18)14-8-4-5-9-15(14)25-17/h4-5,8-9,13H,3,6-7,10-11H2,1-2H3	XVSASXGJQRVIDN-UHFFFAOYSA-N	CCOC(=O)C1CCCN(C1)c2nc(C)nc3c2oc4ccccc34	BroadT	BRD-A44310174	BRD-A44310174-003-05-3	InterBioScreen Ltd.	STOCK4S-44748		Cl	CCOC(=O)C1CCCN(C1)c1nc(C)nc2c3ccccc3oc12.Cl	InChI=1S/C19H21N3O3.ClH/c1-3-24-19(23)13-7-6-10-22(11-13)18-17-16(20-12(2)21-18)14-8-4-5-9-15(14)25-17;/h4-5,8-9,13H,3,6-7,10-11H2,1-2H3;1H	MFYXGQOKXSOYLR-UHFFFAOYSA-N	339.158291562							104034, 104034
1-Ethylbenz(cd)indol-2(1H)-one	LSM-26345	SID3711803, BRD-K64146385	74592	InChI=1S/C13H11NO/c1-2-14-11-8-4-6-9-5-3-7-10(12(9)11)13(14)15/h3-8H,2H2,1H3	BYZKRKXJSNSHEE-UHFFFAOYSA-N	CCN1C(=O)c2cccc3cccc1c23	BroadT	BRD-K64146385	BRD-K64146385-001-05-3	Enamine Ltd.	T0503-6911			CCN1C(=O)c2cccc3cccc1c23	InChI=1S/C13H11NO/c1-2-14-11-8-4-6-9-5-3-7-10(12(9)11)13(14)15/h3-8H,2H2,1H3	BYZKRKXJSNSHEE-UHFFFAOYSA-N	197.084063982							114883
MLS000518921	LSM-15221	BRD-K25140952	3959095	InChI=1S/C20H20N4O2S/c1-3-13-24-18(15-9-11-17(26-2)12-10-15)14-27-20(24)23-22-19(25)21-16-7-5-4-6-8-16/h3-12,14H,1,13H2,2H3,(H2,21,22,25)/p+1	JAADJIYHZHDCSG-UHFFFAOYSA-O	COc1ccc(cc1)c2csc(NNC(=O)Nc3ccccc3)[n+]2CC=C	BroadT	BRD-K25140952	BRD-K25140952-004-06-9	ChemDiv Inc.	1487-1730		Br	COc1ccc(cc1)-c1csc(NNC(=O)Nc2ccccc2)[n+]1CC=C.Br	InChI=1S/C20H20N4O2S.BrH/c1-3-13-24-18(15-9-11-17(26-2)12-10-15)14-27-20(24)23-22-19(25)21-16-7-5-4-6-8-16;/h3-12,14H,1,13H2,2H3,(H2,21,22,25);1H/p+1	VLEOWCVSLWKCKG-UHFFFAOYSA-O	381.138521642							103868, 103868
AN-465/42246421	LSM-15393	BRD-K11302672	1814823	InChI=1S/C20H26FNO3/c1-3-24-12-4-11-22-14-17-7-10-19(20(13-17)23-2)25-15-16-5-8-18(21)9-6-16/h5-10,13,22H,3-4,11-12,14-15H2,1-2H3	ITJUEEFHEQFJNS-UHFFFAOYSA-N	CCOCCCNCc1ccc(OCc2ccc(F)cc2)c(OC)c1	BroadT	BRD-K11302672	BRD-K11302672-003-06-2	ChemBridge Corporation	7964275		Cl	CCOCCCNCc1ccc(OCc2ccc(F)cc2)c(OC)c1.Cl	InChI=1S/C20H26FNO3.ClH/c1-3-24-12-4-11-22-14-17-7-10-19(20(13-17)23-2)25-15-16-5-8-18(21)9-6-16;/h5-10,13,22H,3-4,11-12,14-15H2,1-2H3;1H	LMMBOVYAERHQMX-UHFFFAOYSA-N	347.189671902							104035, 104035
N-{2-[tert-Butyl(methyl)amino]ethyl}-n-methyl-2,2-diphenylacetamide	LSM-26346	SID26660812, BRD-K74053974	1900319	InChI=1S/C22H30N2O/c1-22(2,3)24(5)17-16-23(4)21(25)20(18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,20H,16-17H2,1-5H3	OUPLFPPBLRTXTE-UHFFFAOYSA-N	CN(CCN(C)C(C)(C)C)C(=O)C(c1ccccc1)c2ccccc2	BroadT	BRD-K74053974	BRD-K74053974-001-05-6	InterBioScreen Ltd.	STOCK1S-62409			CN(CCN(C)C(C)(C)C)C(=O)C(c1ccccc1)c1ccccc1	InChI=1S/C22H30N2O/c1-22(2,3)24(5)17-16-23(4)21(25)20(18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,20H,16-17H2,1-5H3	OUPLFPPBLRTXTE-UHFFFAOYSA-N	338.2358136							114884
AC1LHJ5T	LSM-26347	SID17386760, BRD-K00408104	838773	InChI=1S/C11H9N3OS2/c1-2-16-11-13-14-9(15)7-5-3-4-6-8(7)12-10(14)17-11/h3-6H,2H2,1H3	ANBICWUKCFLASK-UHFFFAOYSA-N	CCSC1=NN2C(=Nc3ccccc3C2=O)S1	BroadT	BRD-K00408104	BRD-K00408104-001-06-2	Specs	AN-806/41205065			CCSc1nn2c(nc3ccccc3c2=O)s1	InChI=1S/C11H9N3OS2/c1-2-16-11-13-14-9(15)7-5-3-4-6-8(7)12-10(14)17-11/h3-6H,2H2,1H3	ANBICWUKCFLASK-UHFFFAOYSA-N	263.018703318							114885
ST50852465	LSM-26348	SID4257809, BRD-K15828986	972071	InChI=1S/C15H15N3O2/c1-11(19)12-5-4-7-13(9-12)18-15(20)17-10-14-6-2-3-8-16-14/h2-9H,10H2,1H3,(H2,17,18,20)	WXIJTGKVEDWXOD-UHFFFAOYSA-N	CC(=O)c1cccc(NC(=O)NCc2ccccn2)c1	BroadT	BRD-K15828986	BRD-K15828986-001-05-9	ChemBridge Corporation	7839230			CC(=O)c1cccc(NC(=O)NCc2ccccn2)c1	InChI=1S/C15H15N3O2/c1-11(19)12-5-4-7-13(9-12)18-15(20)17-10-14-6-2-3-8-16-14/h2-9H,10H2,1H3,(H2,17,18,20)	WXIJTGKVEDWXOD-UHFFFAOYSA-N	269.11642675							114886
BAS 01199794	LSM-26349	SID24786664, BRD-K66842888	405209	InChI=1S/C13H10ClN3OS/c1-17-12(18)10(7-15)11(16-13(17)19-2)8-3-5-9(14)6-4-8/h3-6H,1-2H3	WMPKTVPCGJINJE-UHFFFAOYSA-N	CSC1=NC(=C(C#N)C(=O)N1C)c2ccc(Cl)cc2	BroadT	BRD-K66842888	BRD-K66842888-001-05-7	Asinex Ltd.	BAS 01199794			CSc1nc(-c2ccc(Cl)cc2)c(C#N)c(=O)n1C	InChI=1S/C13H10ClN3OS/c1-17-12(18)10(7-15)11(16-13(17)19-2)8-3-5-9(14)6-4-8/h3-6H,1-2H3	WMPKTVPCGJINJE-UHFFFAOYSA-N	291.02331037							114887
CHEMBL211740	LSM-26350	SID14744441, BRD-K98122962	2679292	InChI=1S/C12H12N2O2S/c1-8-7-17-12(13-8)14-11(15)9-4-3-5-10(6-9)16-2/h3-7H,1-2H3,(H,13,14,15)	PAGPVSQZNPBQLP-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Nc2nc(C)cs2	BroadT	BRD-K98122962	BRD-K98122962-001-06-3	Enamine Ltd.	Z68300217			COc1cccc(c1)C(=O)Nc1nc(C)cs1	InChI=1S/C12H12N2O2S/c1-8-7-17-12(13-8)14-11(15)9-4-3-5-10(6-9)16-2/h3-7H,1-2H3,(H,13,14,15)	PAGPVSQZNPBQLP-UHFFFAOYSA-N	248.061948334							114888
MLS000333748	LSM-26351	SID26663145, BRD-K54776285	4529257	InChI=1S/C24H20N4O/c1-16-22(24(29)28(27(16)2)17-10-4-3-5-11-17)26-23-18-12-6-8-14-20(18)25-21-15-9-7-13-19(21)23/h3-15H,1-2H3,(H,25,26)	VNNJMJFCBTYYKX-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)Nc2c3ccccc3nc4ccccc24)c5ccccc5	BroadT	BRD-K54776285	BRD-K54776285-001-05-0	InterBioScreen Ltd.	STOCK4S-85726			Cc1c(Nc2c3ccccc3nc3ccccc23)c(=O)n(-c2ccccc2)n1C	InChI=1S/C24H20N4O/c1-16-22(24(29)28(27(16)2)17-10-4-3-5-11-17)26-23-18-12-6-8-14-20(18)25-21-15-9-7-13-19(21)23/h3-15H,1-2H3,(H,25,26)	VNNJMJFCBTYYKX-UHFFFAOYSA-N	380.1637113							114889
Estradiol Benzoate	LSM-26352	Follidrin, Difolliculin, Benzogynestryl, Benzestrofol, Oestradiol Benzoate, Estradiol Benzoate, Estradiol Monobenzoate, Beta-Estradiol Benzoate	222757	InChI=1S/C25H28O3/c1-25-14-13-20-19-10-8-18(28-24(27)16-5-3-2-4-6-16)15-17(19)7-9-21(20)22(25)11-12-23(25)26/h2-6,8,10,15,20-23,26H,7,9,11-14H2,1H3/t20-,21-,22+,23+,25+/m1/s1	UYIFTLBWAOGQBI-BZDYCCQFSA-N	C[C@]12CC[C@H]3[C@@H](CCc4cc(OC(=O)c5ccccc5)ccc34)[C@@H]1CC[C@@H]2O	BroadT	BRD-K44412991	BRD-K44412991-001-06-8	Sigma-Aldrich	E8515			C[C@]12CC[C@H]3[C@@H](CCc4cc(OC(=O)c5ccccc5)ccc34)[C@@H]1CC[C@@H]2O	InChI=1S/C25H28O3/c1-25-14-13-20-19-10-8-18(28-24(27)16-5-3-2-4-6-16)15-17(19)7-9-21(20)22(25)11-12-23(25)26/h2-6,8,10,15,20-23,26H,7,9,11-14H2,1H3/t20-,21-,22+,23+,25+/m1/s1	UYIFTLBWAOGQBI-BZDYCCQFSA-N	376.203844756							77006
MLS000065789	LSM-26353	SID4257612, BRD-K78604226	1245970	InChI=1S/C8H5F3N4O2S/c1-3-2-4(15-17-3)5(16)12-7-14-13-6(18-7)8(9,10)11/h2H,1H3,(H,12,14,16)	DJUUHURIIACUIC-UHFFFAOYSA-N	Cc1onc(c1)C(=O)Nc2nnc(s2)C(F)(F)F	BroadT	BRD-K78604226	BRD-K78604226-001-05-8	ChemBridge Corporation	7946158			Cc1cc(no1)C(=O)Nc1nnc(s1)C(F)(F)F	InChI=1S/C8H5F3N4O2S/c1-3-2-4(15-17-3)5(16)12-7-14-13-6(18-7)8(9,10)11/h2H,1H3,(H,12,14,16)	DJUUHURIIACUIC-UHFFFAOYSA-N	278.00853073							114890
SMR000060143	LSM-26354	SID3714819, BRD-K77480726	1540501	InChI=1S/C17H18N2O4/c1-2-21-16(20)19-17(18-12-13-8-4-3-5-9-13)22-14-10-6-7-11-15(14)23-17/h3-11,18H,2,12H2,1H3,(H,19,20)	OVBADZUBJQQZFR-UHFFFAOYSA-N	CCOC(=O)NC1(NCc2ccccc2)Oc3ccccc3O1	BroadT	BRD-K77480726	BRD-K77480726-001-05-9	Enamine Ltd.	T0501-2199			CCOC(=O)NC1(NCc2ccccc2)Oc2ccccc2O1	InChI=1S/C17H18N2O4/c1-2-21-16(20)19-17(18-12-13-8-4-3-5-9-13)22-14-10-6-7-11-15(14)23-17/h3-11,18H,2,12H2,1H3,(H,19,20)	OVBADZUBJQQZFR-UHFFFAOYSA-N	314.126657076							114891
F0020-1468	LSM-15222	BRD-K88399551	1575629	InChI=1S/C22H24BrN2O/c1-2-26-20-13-11-19(12-14-20)25-21(17-7-9-18(23)10-8-17)16-24-15-5-3-4-6-22(24)25/h7-14,16H,2-6,15H2,1H3/q+1	YFYTWDJVYRDONY-UHFFFAOYSA-N	CCOc1ccc(cc1)[n+]2c3CCCCCn3cc2c4ccc(Br)cc4	BroadT	BRD-K88399551	BRD-K88399551-004-10-2	Enamine Ltd.	T0504-7289		Br	CCOc1ccc(cc1)-[n+]1c(cn2CCCCCc12)-c1ccc(Br)cc1.Br	InChI=1S/C22H24BrN2O.BrH/c1-2-26-20-13-11-19(12-14-20)25-21(17-7-9-18(23)10-8-17)16-24-15-5-3-4-6-22(24)25;/h7-14,16H,2-6,15H2,1H3;1H/q+1;	YQSYMRHLVVRFLS-UHFFFAOYSA-N	411.107201008							103869, 103869
MLS000730499	LSM-26355	SID24810574, BRD-K18210693	16193152	InChI=1S/C22H33N5S/c1-5-7-10-25(4)22(28)23-18-8-9-20-19(16-18)17(3)15-21(24-20)27-13-11-26(6-2)12-14-27/h8-9,15-16H,5-7,10-14H2,1-4H3,(H,23,28)	VVSHUHWQCFJNOL-UHFFFAOYSA-N	CCCCN(C)C(=Nc1ccc2nc(cc(C)c2c1)N3CCN(CC)CC3)S	BroadT	BRD-K18210693	BRD-K18210693-001-05-1	ChemDiv Inc.	C267-0082			CCCCN(C)C(S)=Nc1ccc2nc(cc(C)c2c1)N1CCN(CC)CC1	InChI=1S/C22H33N5S/c1-5-7-10-25(4)22(28)23-18-8-9-20-19(16-18)17(3)15-21(24-20)27-13-11-26(6-2)12-14-27/h8-9,15-16H,5-7,10-14H2,1-4H3,(H,23,28)	VVSHUHWQCFJNOL-UHFFFAOYSA-N	399.245666796							114892
AG-205/41005453	LSM-26356	SID17386385, BRD-A94413900	4026064	InChI=1S/C18H24N2O2/c1-3-4-5-6-10-13-20-18(22)16(14(2)19-20)17(21)15-11-8-7-9-12-15/h7-9,11-12,16H,3-6,10,13H2,1-2H3	YAPYNCGECVXNED-UHFFFAOYSA-N	CCCCCCCN1N=C(C)C(C(=O)c2ccccc2)C1=O	BroadT	BRD-A94413900	BRD-A94413900-001-06-7	Specs	AG-205/41005453			CCCCCCCN1N=C(C)C(C(=O)c2ccccc2)C1=O	InChI=1S/C18H24N2O2/c1-3-4-5-6-10-13-20-18(22)16(14(2)19-20)17(21)15-11-8-7-9-12-15/h7-9,11-12,16H,3-6,10,13H2,1-2H3	YAPYNCGECVXNED-UHFFFAOYSA-N	300.183778028							114893
2,2'-[Oxybis(Ethane-2,1-diyloxy)]dianiline	LSM-26357	SID4246899, BRD-K71952344	239750	InChI=1S/C16H20N2O3/c17-13-5-1-3-7-15(13)20-11-9-19-10-12-21-16-8-4-2-6-14(16)18/h1-8H,9-12,17-18H2	DFVJTOXKLOMBAK-UHFFFAOYSA-N	Nc1ccccc1OCCOCCOc2ccccc2N	BroadT	BRD-K71952344	BRD-K71952344-001-05-5	ChemDiv Inc.	0176-0004			Nc1ccccc1OCCOCCOc1ccccc1N	InChI=1S/C16H20N2O3/c17-13-5-1-3-7-15(13)20-11-9-19-10-12-21-16-8-4-2-6-14(16)18/h1-8H,9-12,17-18H2	DFVJTOXKLOMBAK-UHFFFAOYSA-N	288.14739252							114894
3-{5-[(Dimethylamino)sulfonyl]-1-ethyl-1H-benzimidazol-2-yl}propanoic acid	LSM-26358	SID24839328, BRD-K54032565	3694700	InChI=1S/C14H19N3O4S/c1-4-17-12-6-5-10(22(20,21)16(2)3)9-11(12)15-13(17)7-8-14(18)19/h5-6,9H,4,7-8H2,1-3H3,(H,18,19)	WTLSVINLKZXZDI-UHFFFAOYSA-N	CCn1c(CCC(=O)O)nc2cc(ccc12)S(=O)(=O)N(C)C	BroadT	BRD-K54032565	BRD-K54032565-001-05-9	Enamine Ltd.	T0519-8185			CCn1c(CCC(O)=O)nc2cc(ccc12)S(=O)(=O)N(C)C	InChI=1S/C14H19N3O4S/c1-4-17-12-6-5-10(22(20,21)16(2)3)9-11(12)15-13(17)7-8-14(18)19/h5-6,9H,4,7-8H2,1-3H3,(H,18,19)	WTLSVINLKZXZDI-UHFFFAOYSA-N	325.109626808							114895
ZINC02415885	LSM-26359	SID14742851, BRD-K46711444	2012958	InChI=1S/C20H17N3O2S/c1-13-22-18-15-9-5-6-10-16(15)25-19(18)20(23-13)26-12-17(24)21-11-14-7-3-2-4-8-14/h2-10H,11-12H2,1H3,(H,21,24)	WNQMTIUEFBINEP-UHFFFAOYSA-N	Cc1nc(SCC(=O)NCc2ccccc2)c3oc4ccccc4c3n1	BroadT	BRD-K46711444	BRD-K46711444-001-05-6	InterBioScreen Ltd.	STOCK4S-48584			Cc1nc(SCC(=O)NCc2ccccc2)c2oc3ccccc3c2n1	InChI=1S/C20H17N3O2S/c1-13-22-18-15-9-5-6-10-16(15)25-19(18)20(23-13)26-12-17(24)21-11-14-7-3-2-4-8-14/h2-10H,11-12H2,1H3,(H,21,24)	WNQMTIUEFBINEP-UHFFFAOYSA-N	363.104147504							114896
BDBM47477	LSM-26360	BRD-K84471282	40559727	InChI=1S/C14H8ClNO4/c15-8-3-4-12-9(6-8)16-10(14(18)20-12)7-11(17)13-2-1-5-19-13/h1-6H,7H2	XZODWNWSRGNRJS-UHFFFAOYSA-N	Clc1ccc2OC(=O)C(=Nc2c1)CC(=O)c3occc3	BroadT	BRD-K84471282	BRD-K84471282-001-06-3	InterBioScreen Ltd.	STOCK3S-29801			Clc1ccc2oc(=O)c(CC(=O)c3ccco3)nc2c1	InChI=1S/C14H8ClNO4/c15-8-3-4-12-9(6-8)16-10(14(18)20-12)7-11(17)13-2-1-5-19-13/h1-6H,7H2	XZODWNWSRGNRJS-UHFFFAOYSA-N	289.014185456							114897
ST047752	LSM-26361	SID17413616, BRD-K80638866	1070244	InChI=1S/C21H16N2O2S2/c1-14-11-12-19(27-14)18(24)13-26-21-22-17-10-6-5-9-16(17)20(25)23(21)15-7-3-2-4-8-15/h2-12H,13H2,1H3	ACCPBDSGHDRJJU-UHFFFAOYSA-N	Cc1ccc(s1)C(=O)CSC2=Nc3ccccc3C(=O)N2c4ccccc4	BroadT	BRD-K80638866	BRD-K80638866-001-05-7	ChemBridge Corporation	6950477			Cc1ccc(s1)C(=O)CSc1nc2ccccc2c(=O)n1-c1ccccc1	InChI=1S/C21H16N2O2S2/c1-14-11-12-19(27-14)18(24)13-26-21-22-17-10-6-5-9-16(17)20(25)23(21)15-7-3-2-4-8-15/h2-12H,13H2,1H3	ACCPBDSGHDRJJU-UHFFFAOYSA-N	392.065319152							114898
SMR000248228	LSM-26362	SID22410679, BRD-K95418770	3312717	InChI=1S/C25H24N2O6S/c1-31-21-9-7-19(15-23(21)34(29,30)27-10-12-32-13-11-27)26-24(28)14-18-16-33-22-8-6-17-4-2-3-5-20(17)25(18)22/h2-9,15-16H,10-14H2,1H3,(H,26,28)	YOCUYKUAUSSWQB-UHFFFAOYSA-N	COc1ccc(NC(=O)Cc2coc3ccc4ccccc4c23)cc1S(=O)(=O)N5CCOCC5	BroadT	BRD-K95418770	BRD-K95418770-001-05-2	Enamine Ltd.	T5219388			COc1ccc(NC(=O)Cc2coc3ccc4ccccc4c23)cc1S(=O)(=O)N1CCOCC1	InChI=1S/C25H24N2O6S/c1-31-21-9-7-19(15-23(21)34(29,30)27-10-12-32-13-11-27)26-24(28)14-18-16-33-22-8-6-17-4-2-3-5-20(17)25(18)22/h2-9,15-16H,10-14H2,1H3,(H,26,28)	YOCUYKUAUSSWQB-UHFFFAOYSA-N	480.135507198							114899
AC1LYFTF	LSM-26363	BRD-K65897894	1822115	InChI=1S/C21H23N7O3/c1-14-19(28(29)30)20(24-16-7-11-18(31-4)12-8-16)25-21(23-14)26-22-13-15-5-9-17(10-6-15)27(2)3/h5-13H,1-4H3,(H2,23,24,25,26)	MQAYHVCYUJWVEG-UHFFFAOYSA-N	COc1ccc(Nc2nc(NN=Cc3ccc(cc3)N(C)C)nc(C)c2[N+](=O)[O-])cc1	BroadT	BRD-K65897894	BRD-K65897894-001-06-2	Asinex Ltd.	BAS 00275595			COc1ccc(Nc2nc(NN=Cc3ccc(cc3)N(C)C)nc(C)c2[N+]([O-])=O)cc1	InChI=1S/C21H23N7O3/c1-14-19(28(29)30)20(24-16-7-11-18(31-4)12-8-16)25-21(23-14)26-22-13-15-5-9-17(10-6-15)27(2)3/h5-13H,1-4H3,(H2,23,24,25,26)	MQAYHVCYUJWVEG-UHFFFAOYSA-N	421.186237666							114900
BAS 01290067	LSM-26364	SID24780911, BRD-K88441166	767302	InChI=1S/C17H12N2O2/c1-11-5-4-8-19-10-14(18-16(11)19)13-9-12-6-2-3-7-15(12)21-17(13)20/h2-10H,1H3	MYVGHDCBGHLCNI-UHFFFAOYSA-N	Cc1cccn2cc(nc12)C3=Cc4ccccc4OC3=O	BroadT	BRD-K88441166	BRD-K88441166-001-05-5	Asinex Ltd.	BAS 01290067			Cc1cccn2cc(nc12)-c1cc2ccccc2oc1=O	InChI=1S/C17H12N2O2/c1-11-5-4-8-19-10-14(18-16(11)19)13-9-12-6-2-3-7-15(12)21-17(13)20/h2-10H,1H3	MYVGHDCBGHLCNI-UHFFFAOYSA-N	276.089877644							114901
SMR000201473	LSM-26365	SID17413592, BRD-K01423400	2236068	InChI=1S/C21H25N3O3/c1-2-3-9-19(25)22-18-13-11-17(12-14-18)21(27)24-23-20(26)15-10-16-7-5-4-6-8-16/h4-8,11-14H,2-3,9-10,15H2,1H3,(H,22,25)(H,23,26)(H,24,27)	FAHXYXLXGLKCBP-UHFFFAOYSA-N	CCCCC(=O)Nc1ccc(cc1)C(=O)NNC(=O)CCc2ccccc2	BroadT	BRD-K01423400	BRD-K01423400-001-05-3	ChemBridge Corporation	7976644			CCCCC(=O)Nc1ccc(cc1)C(=O)NNC(=O)CCc1ccccc1	InChI=1S/C21H25N3O3/c1-2-3-9-19(25)22-18-13-11-17(12-14-18)21(27)24-23-20(26)15-10-16-7-5-4-6-8-16/h4-8,11-14H,2-3,9-10,15H2,1H3,(H,22,25)(H,23,26)(H,24,27)	FAHXYXLXGLKCBP-UHFFFAOYSA-N	367.18959169							114902
MLS000121584	LSM-26366	SID17388197, BRD-K29793373	5770420	InChI=1S/C19H15N5O4S/c1-26-11-3-4-13-12(7-11)17-18(21-13)22-19(24-23-17)29-8-16(25)20-10-2-5-14-15(6-10)28-9-27-14/h2-7H,8-9H2,1H3,(H,20,25)(H,21,22,24)	SDHGBSYDYXYUND-UHFFFAOYSA-N	COc1ccc2[nH]c3nc(SCC(=O)Nc4ccc5OCOc5c4)nnc3c2c1	BroadT	BRD-K29793373	BRD-K29793373-001-05-0	Asinex Ltd.	ASN 03160512			COc1ccc2[nH]c3nc(SCC(=O)Nc4ccc5OCOc5c4)nnc3c2c1	InChI=1S/C19H15N5O4S/c1-26-11-3-4-13-12(7-11)17-18(21-13)22-19(24-23-17)29-8-16(25)20-10-2-5-14-15(6-10)28-9-27-14/h2-7H,8-9H2,1H3,(H,20,25)(H,21,22,24)	SDHGBSYDYXYUND-UHFFFAOYSA-N	409.0844747							114903
90012-40-1	LSM-26367	SID14745766, BRD-K53314213	854142	InChI=1S/C16H15N3/c1-12-7-9-13(10-8-12)15-11-16(17)19(18-15)14-5-3-2-4-6-14/h2-11H,17H2,1H3	WMJZITXAXMNGCH-UHFFFAOYSA-N	Cc1ccc(cc1)c2cc(N)n(n2)c3ccccc3	BroadT	BRD-K53314213	BRD-K53314213-001-05-8	Enamine Ltd.	T0514-0137			Cc1ccc(cc1)-c1cc(N)n(n1)-c1ccccc1	InChI=1S/C16H15N3/c1-12-7-9-13(10-8-12)15-11-16(17)19(18-15)14-5-3-2-4-6-14/h2-11H,17H2,1H3	WMJZITXAXMNGCH-UHFFFAOYSA-N	249.12659751							114904
AC1N4ZA5	LSM-15564	BRD-K72136171	4163561	InChI=1S/C23H32N4O4S/c1-3-26(4-2)22-11-10-20(32(29,30)27-12-14-31-15-13-27)16-21(22)25-23(28)18-24-17-19-8-6-5-7-9-19/h5-11,16,24H,3-4,12-15,17-18H2,1-2H3,(H,25,28)	TYFHCZDZHOJROC-UHFFFAOYSA-N	CCN(CC)c1ccc(cc1NC(=O)CNCc2ccccc2)S(=O)(=O)N3CCOCC3	BroadT	BRD-K72136171	BRD-K72136171-034-05-3	Enamine Ltd.	T0505-6710		OC(=O)C(=O)O	CCN(CC)c1ccc(cc1NC(=O)CNCc1ccccc1)S(=O)(=O)N1CCOCC1.OC(=O)C(=O)O	InChI=1S/C23H32N4O4S.C2H2O4/c1-3-26(4-2)22-11-10-20(32(29,30)27-12-14-31-15-13-27)16-21(22)25-23(28)18-24-17-19-8-6-5-7-9-19;3-1(4)2(5)6/h5-11,16,24H,3-4,12-15,17-18H2,1-2H3,(H,25,28);(H,3,4)(H,5,6)	XNFYLKZQXMYUDO-UHFFFAOYSA-N	460.214426234							104200, 104200
2-(4-Methoxyphenoxy)-n-(2-methoxyphenyl)acetamide	LSM-26368	SID7977116, BRD-K27340728	868087	InChI=1S/C16H17NO4/c1-19-12-7-9-13(10-8-12)21-11-16(18)17-14-5-3-4-6-15(14)20-2/h3-10H,11H2,1-2H3,(H,17,18)	JOMRBSYHYLDSBX-UHFFFAOYSA-N	COc1ccc(OCC(=O)Nc2ccccc2OC)cc1	BroadT	BRD-K27340728	BRD-K27340728-001-05-4	ChemBridge Corporation	5688017			COc1ccc(OCC(=O)Nc2ccccc2OC)cc1	InChI=1S/C16H17NO4/c1-19-12-7-9-13(10-8-12)21-11-16(18)17-14-5-3-4-6-15(14)20-2/h3-10H,11H2,1-2H3,(H,17,18)	JOMRBSYHYLDSBX-UHFFFAOYSA-N	287.115758034							114905
SMR000179722	LSM-26369	SID17402753, BRD-K88861395	3696046	InChI=1S/C17H13F3N2S/c18-17(19,20)14-8-6-13(7-9-14)12-23-16-21-10-11-22(16)15-4-2-1-3-5-15/h1-11H,12H2	BLFXIQOXFXUXCT-UHFFFAOYSA-N	FC(F)(F)c1ccc(CSc2nccn2c3ccccc3)cc1	BroadT	BRD-K88861395	BRD-K88861395-001-06-5	Key Organics Ltd.	3R-0242			FC(F)(F)c1ccc(CSc2nccn2-c2ccccc2)cc1	InChI=1S/C17H13F3N2S/c18-17(19,20)14-8-6-13(7-9-14)12-23-16-21-10-11-22(16)15-4-2-1-3-5-15/h1-11H,12H2	BLFXIQOXFXUXCT-UHFFFAOYSA-N	334.075153726							114906
MLS000778580	LSM-44170	SID26670969, BRD-K36858276	6863660	InChI=1S/C26H23FN4O5S/c27-16-7-5-15(6-8-16)14-31-25(36)19(24(35)30-26(31)37)13-21-18(17-3-1-2-4-20(17)29-21)11-12-28-22(32)9-10-23(33)34/h1-8,13,29H,9-12,14H2,(H,28,32)(H,33,34)(H,30,35,37)/b19-13-	PSKAJKMJFXYKJG-UYRXBGFRSA-N	OC(=O)CCC(=O)NCCc1c(\C=C/2\C(=O)NC(=S)N(Cc3ccc(F)cc3)C2=O)[nH]c4ccccc14	BroadT	BRD-K36858276	BRD-K36858276-001-05-0	InterBioScreen Ltd.	STOCK5S-13363			OC(=O)CCC(=O)NCCc1c(\C=C2\C(=O)NC(=S)N(Cc3ccc(F)cc3)C2=O)[nH]c2ccccc12	InChI=1S/C26H23FN4O5S/c27-16-7-5-15(6-8-16)14-31-25(36)19(24(35)30-26(31)37)13-21-18(17-3-1-2-4-20(17)29-21)11-12-28-22(32)9-10-23(33)34/h1-8,13,29H,9-12,14H2,(H,28,32)(H,33,34)(H,30,35,37)/b19-13-	PSKAJKMJFXYKJG-UYRXBGFRSA-N	522.137318766							
F1366-0834	LSM-26371	BRD-K32644030	3599260	InChI=1S/C15H10ClFN2O3S2/c1-22-13(20)7-19-9-3-2-8(17)6-11(9)24-15(19)18-14(21)10-4-5-12(16)23-10/h2-6H,7H2,1H3	AEHUGZKHQGCBCH-UHFFFAOYSA-N	COC(=O)CN1C(=NC(=O)c2ccc(Cl)s2)Sc3cc(F)ccc13	BroadT	BRD-K32644030	BRD-K32644030-001-05-5	Life Chemicals Inc.	F1366-0834			COC(=O)Cn1c2ccc(F)cc2sc1=NC(=O)c1ccc(Cl)s1	InChI=1S/C15H10ClFN2O3S2/c1-22-13(20)7-19-9-3-2-8(17)6-11(9)24-15(19)18-14(21)10-4-5-12(16)23-10/h2-6H,7H2,1H3	AEHUGZKHQGCBCH-UHFFFAOYSA-N	383.98053949							114908
N-(2-Chlorophenyl)-4-(1H-pyrrol-1-yl)-1,3,5-triazin-2-amine	LSM-26372	SID17411273, BRD-K91255991	2730361	InChI=1S/C13H10ClN5/c14-10-5-1-2-6-11(10)17-12-15-9-16-13(18-12)19-7-3-4-8-19/h1-9H,(H,15,16,17,18)	OQHYTNFJMHVUCY-UHFFFAOYSA-N	Clc1ccccc1Nc2ncnc(n2)n3cccc3	BroadT	BRD-K91255991	BRD-K91255991-001-06-3	Key Organics Ltd.	12W-0938			Clc1ccccc1Nc1ncnc(n1)-n1cccc1	InChI=1S/C13H10ClN5/c14-10-5-1-2-6-11(10)17-12-15-9-16-13(18-12)19-7-3-4-8-19/h1-9H,(H,15,16,17,18)	OQHYTNFJMHVUCY-UHFFFAOYSA-N	271.06247308							114909
AK-968/12120476	LSM-26373	SID4258387, BRD-A16754239	2931826	InChI=1S/C16H21NO4/c1-2-3-10-21-16(19)12-6-8-13(9-7-12)17-15(18)14-5-4-11-20-14/h6-9,14H,2-5,10-11H2,1H3,(H,17,18)	WEDABFJUBIFUAY-UHFFFAOYSA-N	CCCCOC(=O)c1ccc(NC(=O)C2CCCO2)cc1	BroadT	BRD-A16754239	BRD-A16754239-001-05-3	ChemBridge Corporation	7248992			CCCCOC(=O)c1ccc(NC(=O)C2CCCO2)cc1	InChI=1S/C16H21NO4/c1-2-3-10-21-16(19)12-6-8-13(9-7-12)17-15(18)14-5-4-11-20-14/h6-9,14H,2-5,10-11H2,1H3,(H,17,18)	WEDABFJUBIFUAY-UHFFFAOYSA-N	291.147058162							114910
AC1LYSHO	LSM-26374	SID22400411, BRD-K62497162	1883561	InChI=1S/C19H21N3O4/c1-2-3-12-26-19(25)15-4-6-16(7-5-15)22-18(24)17(23)21-13-14-8-10-20-11-9-14/h4-11H,2-3,12-13H2,1H3,(H,21,23)(H,22,24)	YEGSQJQQCCCHML-UHFFFAOYSA-N	CCCCOC(=O)c1ccc(NC(=O)C(=O)NCc2ccncc2)cc1	BroadT	BRD-K62497162	BRD-K62497162-001-05-1	InterBioScreen Ltd.	STOCK1S-01677			CCCCOC(=O)c1ccc(NC(=O)C(=O)NCc2ccncc2)cc1	InChI=1S/C19H21N3O4/c1-2-3-12-26-19(25)15-4-6-16(7-5-15)22-18(24)17(23)21-13-14-8-10-20-11-9-14/h4-11H,2-3,12-13H2,1H3,(H,21,23)(H,22,24)	YEGSQJQQCCCHML-UHFFFAOYSA-N	355.153206182							114911
F1359-3104	LSM-44171	BRD-K08831457	9615265	InChI=1S/C22H22ClN3O3S/c1-3-29-13-12-26-19-10-9-17(24-15(2)27)14-20(19)30-22(26)25-21(28)11-8-16-6-4-5-7-18(16)23/h4-11,14H,3,12-13H2,1-2H3,(H,24,27)/b11-8+,25-22?	ZCPCVRZWDGRYBS-IUKKXOIKSA-N	CCOCCN1C(=NC(=O)\C=C\c2ccccc2Cl)Sc3cc(NC(=O)C)ccc13	BroadT	BRD-K08831457	BRD-K08831457-001-05-2	Life Chemicals Inc.	F1359-3104			CCOCCn1c2ccc(NC(C)=O)cc2sc1=NC(=O)\C=C\c1ccccc1Cl	InChI=1S/C22H22ClN3O3S/c1-3-29-13-12-26-19-10-9-17(24-15(2)27)14-20(19)30-22(26)25-21(28)11-8-16-6-4-5-7-18(16)23/h4-11,14H,3,12-13H2,1-2H3,(H,24,27)/b11-8+,25-22?	ZCPCVRZWDGRYBS-IUKKXOIKSA-N	443.107039994							
5-(4-Chlorophenyl)-2-[(phenylsulfonyl)methyl]-1,3-cyclohexanedione	LSM-26376	SID24822153, BRD-K34531679	1486430	InChI=1S/C19H17ClO4S/c20-15-8-6-13(7-9-15)14-10-18(21)17(19(22)11-14)12-25(23,24)16-4-2-1-3-5-16/h1-9,14,17H,10-12H2	FSHIPBXJKASDDF-UHFFFAOYSA-N	Clc1ccc(cc1)C2CC(=O)C(CS(=O)(=O)c3ccccc3)C(=O)C2	BroadT	BRD-K34531679	BRD-K34531679-001-05-8	Key Organics Ltd.	8H-905			Clc1ccc(cc1)C1CC(=O)C(CS(=O)(=O)c2ccccc2)C(=O)C1	InChI=1S/C19H17ClO4S/c20-15-8-6-13(7-9-15)14-10-18(21)17(19(22)11-14)12-25(23,24)16-4-2-1-3-5-16/h1-9,14,17H,10-12H2	FSHIPBXJKASDDF-UHFFFAOYSA-N	376.053607424							114913
T0515-1265	LSM-26377	SID22407773, BRD-K50034275	2407431	InChI=1S/C23H19F2NO3S/c24-23(25)30-19-12-10-18(11-13-19)26-21(27)15-29-22(28)20-9-5-4-8-17(20)14-16-6-2-1-3-7-16/h1-13,23H,14-15H2,(H,26,27)	ZUAFFQHNJXBZDL-UHFFFAOYSA-N	FC(F)Sc1ccc(NC(=O)COC(=O)c2ccccc2Cc3ccccc3)cc1	BroadT	BRD-K50034275	BRD-K50034275-001-05-0	Enamine Ltd.	T0515-1265			FC(F)Sc1ccc(NC(=O)COC(=O)c2ccccc2Cc2ccccc2)cc1	InChI=1S/C23H19F2NO3S/c24-23(25)30-19-12-10-18(11-13-19)26-21(27)15-29-22(28)20-9-5-4-8-17(20)14-16-6-2-1-3-7-16/h1-13,23H,14-15H2,(H,26,27)	ZUAFFQHNJXBZDL-UHFFFAOYSA-N	427.105370568							114914
MLS000767686	LSM-26378	SID26666513, BRD-K78221775	793865	InChI=1S/C14H13N3OS/c1-8-3-5-10(6-4-8)13-11(7-15)9(2)12(19-13)14(18)17-16/h3-6H,16H2,1-2H3,(H,17,18)	PPMYPMZSKXINOE-UHFFFAOYSA-N	Cc1ccc(cc1)c2sc(C(=O)NN)c(C)c2C#N	BroadT	BRD-K78221775	BRD-K78221775-001-05-6	InterBioScreen Ltd.	STOCK2S-68597			Cc1c(sc(c1C#N)-c1ccc(C)cc1)C(=O)NN	InChI=1S/C14H13N3OS/c1-8-3-5-10(6-4-8)13-11(7-15)9(2)12(19-13)14(18)17-16/h3-6H,16H2,1-2H3,(H,17,18)	PPMYPMZSKXINOE-UHFFFAOYSA-N	271.077932756							114915
AC1MJDGQ	LSM-26379	SID24809472, BRD-A17167769	3090180	InChI=1S/C11H14Cl3N3OS/c1-10(2,3)7(18)17-8(11(12,13)14)19-9-15-5-4-6-16-9/h4-6,8H,1-3H3,(H,17,18)	PESIIBWYOIWVIY-UHFFFAOYSA-N	CC(C)(C)C(=O)NC(Sc1ncccn1)C(Cl)(Cl)Cl	BroadT	BRD-A17167769	BRD-A17167769-001-05-5	Asinex Ltd.	BAS 00087459			CC(C)(C)C(=O)NC(Sc1ncccn1)C(Cl)(Cl)Cl	InChI=1S/C11H14Cl3N3OS/c1-10(2,3)7(18)17-8(11(12,13)14)19-9-15-5-4-6-16-9/h4-6,8H,1-3H3,(H,17,18)	PESIIBWYOIWVIY-UHFFFAOYSA-N	340.992315918							114916
T0514-7307	LSM-26380	SID24830527, BRD-A50098360	4335680	InChI=1S/C21H21Cl2N3OS/c1-12-3-6-18-15(9-12)16-11-25(2)8-7-19(16)26(18)21(28)24-20(27)14-5-4-13(22)10-17(14)23/h3-6,9-10,16,19H,7-8,11H2,1-2H3,(H,24,27,28)	OSPIDPFZYXYNBW-UHFFFAOYSA-N	CN1CCC2C(C1)c3cc(C)ccc3N2C(=S)NC(=O)c4ccc(Cl)cc4Cl	BroadT	BRD-A50098360	BRD-A50098360-001-05-3	Enamine Ltd.	T0514-7307			CN1CCC2C(C1)c1cc(C)ccc1N2C(=S)NC(=O)c1ccc(Cl)cc1Cl	InChI=1S/C21H21Cl2N3OS/c1-12-3-6-18-15(9-12)16-11-25(2)8-7-19(16)26(18)21(28)24-20(27)14-5-4-13(22)10-17(14)23/h3-6,9-10,16,19H,7-8,11H2,1-2H3,(H,24,27,28)	OSPIDPFZYXYNBW-UHFFFAOYSA-N	433.078238432							114917
NSC681782	LSM-26381	SID26659388, SID519033, BRD-A57779024	387753	InChI=1S/C12H12N4O/c1-9(2)4-10(3)11(5-13,6-14)12(9,7-15)8(16)17-10/h16H,4H2,1-3H3	PERGIMFAIDAJHC-UHFFFAOYSA-N	CC1(C)CC2(C)OC(=N)C1(C#N)C2(C#N)C#N	BroadT	BRD-A57779024	BRD-A57779024-001-06-7	InterBioScreen Ltd.	STOCK1S-01257			CC1(C)CC2(C)OC(=N)C1(C#N)C2(C#N)C#N	InChI=1S/C12H12N4O/c1-9(2)4-10(3)11(5-13,6-14)12(9,7-15)8(16)17-10/h16H,4H2,1-3H3	PERGIMFAIDAJHC-UHFFFAOYSA-N	228.101111044							114918
ASN 06236112	LSM-26382	SID17407537, BRD-K40820894	3218495	InChI=1S/C25H22ClN3O2S/c26-19-8-2-1-7-18(19)24(30)27-17-13-15-28(16-14-17)25(31)29-20-9-3-5-11-22(20)32-23-12-6-4-10-21(23)29/h1-12,17H,13-16H2,(H,27,30)	BTUMIUCIIPZDME-UHFFFAOYSA-N	Clc1ccccc1C(=O)NC2CCN(CC2)C(=O)N3c4ccccc4Sc5ccccc35	BroadT	BRD-K40820894	BRD-K40820894-001-05-6	Asinex Ltd.	ASN 06236112			Clc1ccccc1C(=O)NC1CCN(CC1)C(=O)N1c2ccccc2Sc2ccccc12	InChI=1S/C25H22ClN3O2S/c26-19-8-2-1-7-18(19)24(30)27-17-13-15-28(16-14-17)25(31)29-20-9-3-5-11-22(20)32-23-12-6-4-10-21(23)29/h1-12,17H,13-16H2,(H,27,30)	BTUMIUCIIPZDME-UHFFFAOYSA-N	463.112125374							114919
AC1MCZR5	LSM-26383	BRD-A52551996	2803421	InChI=1S/C17H23N3O2S/c1-21-15-5-3-4-13(16(15)22-2)10-18-20-17(23)19-14-9-11-6-7-12(14)8-11/h3-5,10-12,14H,6-9H2,1-2H3,(H2,19,20,23)	ZWERSZHUAAXQIO-UHFFFAOYSA-N	COc1cccc(C=NN=C(S)NC2CC3CCC2C3)c1OC	BroadT	BRD-A52551996	BRD-A52551996-001-05-1	Maybridge	CD 02063			COc1cccc(C=NN=C(S)NC2CC3CCC2C3)c1OC	InChI=1S/C17H23N3O2S/c1-21-15-5-3-4-13(16(15)22-2)10-18-20-17(23)19-14-9-11-6-7-12(14)8-11/h3-5,10-12,14H,6-9H2,1-2H3,(H2,19,20,23)	ZWERSZHUAAXQIO-UHFFFAOYSA-N	333.151097696							114920
MLS001115691	LSM-26384	SID49722495, SID24394852, BRD-K78140317	16016994	InChI=1S/C17H17ClN4O2/c1-2-15-20-22(17(24)14-8-5-9-21(14)15)11-16(23)19-10-12-6-3-4-7-13(12)18/h3-9H,2,10-11H2,1H3,(H,19,23)	NNMCTWVXYHSUPA-UHFFFAOYSA-N	CCC1=NN(CC(=O)NCc2ccccc2Cl)C(=O)c3cccn13	BroadT	BRD-K78140317	BRD-K78140317-001-05-3	ChemDiv Inc.	E020-0697			CCc1nn(CC(=O)NCc2ccccc2Cl)c(=O)c2cccn12	InChI=1S/C17H17ClN4O2/c1-2-15-20-22(17(24)14-8-5-9-21(14)15)11-16(23)19-10-12-6-3-4-7-13(12)18/h3-9H,2,10-11H2,1H3,(H,19,23)	NNMCTWVXYHSUPA-UHFFFAOYSA-N	344.104003534							114921
MLS000043676	LSM-26385	SID4244806, BRD-K45243865	1506381	InChI=1S/C17H15N5O2/c1-23-12-6-4-5-11(9-12)10-22-14-8-3-2-7-13(14)19-17(22)15-16(18)21-24-20-15/h2-9H,10H2,1H3,(H2,18,21)	ZTQIQQGRCNJUPF-UHFFFAOYSA-N	COc1cccc(Cn2c(nc3ccccc23)c4nonc4N)c1	BroadT	BRD-K45243865	BRD-K45243865-001-06-9	ChemDiv Inc.	7182-0064			COc1cccc(Cn2c(nc3ccccc23)-c2nonc2N)c1	InChI=1S/C17H15N5O2/c1-23-12-6-4-5-11(9-12)10-22-14-8-3-2-7-13(14)19-17(22)15-16(18)21-24-20-15/h2-9H,10H2,1H3,(H2,18,21)	ZTQIQQGRCNJUPF-UHFFFAOYSA-N	321.12257477							114922
MLS000097758	LSM-26386	SID3715305, BRD-K83885069	2128445	InChI=1S/C18H18N2O5/c21-16(19-11-15-3-2-10-24-15)12-25-18(23)13-5-7-14(8-6-13)20-9-1-4-17(20)22/h2-3,5-8,10H,1,4,9,11-12H2,(H,19,21)	IGEILYGSUOCDIY-UHFFFAOYSA-N	O=C(COC(=O)c1ccc(cc1)N2CCCC2=O)NCc3occc3	BroadT	BRD-K83885069	BRD-K83885069-001-05-6	Enamine Ltd.	T5255869			O=C(COC(=O)c1ccc(cc1)N1CCCC1=O)NCc1ccco1	InChI=1S/C18H18N2O5/c21-16(19-11-15-3-2-10-24-15)12-25-18(23)13-5-7-14(8-6-13)20-9-1-4-17(20)22/h2-3,5-8,10H,1,4,9,11-12H2,(H,19,21)	IGEILYGSUOCDIY-UHFFFAOYSA-N	342.121571696							114923
SMR000024388	LSM-26387	SID4243219, BRD-A82389349	3237971	InChI=1S/C23H30N2O2/c1-3-7-20-16-19(2)10-11-23(20)27-18-22(26)17-24-12-14-25(15-13-24)21-8-5-4-6-9-21/h3-6,8-11,16,22,26H,1,7,12-15,17-18H2,2H3	WDYIXLPYUNDXQP-UHFFFAOYSA-N	Cc1ccc(OCC(O)CN2CCN(CC2)c3ccccc3)c(CC=C)c1	BroadT	BRD-A82389349	BRD-A82389349-001-05-4	ChemDiv Inc.	3672-0051			Cc1ccc(OCC(O)CN2CCN(CC2)c2ccccc2)c(CC=C)c1	InChI=1S/C23H30N2O2/c1-3-7-20-16-19(2)10-11-23(20)27-18-22(26)17-24-12-14-25(15-13-24)21-8-5-4-6-9-21/h3-6,8-11,16,22,26H,1,7,12-15,17-18H2,2H3	WDYIXLPYUNDXQP-UHFFFAOYSA-N	366.23072822							114924
AC1M5D1O	LSM-15565	BRD-K29977000	2351364	InChI=1S/C21H22N4O4/c1-14-20(21(27)25(24(14)2)16-6-4-3-5-7-16)23-19(26)12-22-11-15-8-9-17-18(10-15)29-13-28-17/h3-10,22H,11-13H2,1-2H3,(H,23,26)	HHIHHYXYXHILOT-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)NC(=O)CNCc2ccc3OCOc3c2)c4ccccc4	BroadT	BRD-K29977000	BRD-K29977000-034-05-1	Enamine Ltd.	T0508-5235		OC(=O)C(=O)O	Cc1c(NC(=O)CNCc2ccc3OCOc3c2)c(=O)n(-c2ccccc2)n1C.OC(=O)C(=O)O	InChI=1S/C21H22N4O4.C2H2O4/c1-14-20(21(27)25(24(14)2)16-6-4-3-5-7-16)23-19(26)12-22-11-15-8-9-17-18(10-15)29-13-28-17;3-1(4)2(5)6/h3-10,22H,11-13H2,1-2H3,(H,23,26);(H,3,4)(H,5,6)	XJFJBYXBGUIOFP-UHFFFAOYSA-N	394.164105224							104201, 104201
SMR000066873	LSM-26388	SID3711108, BRD-K75206195	2115012	InChI=1S/C16H20N4O6/c1-5-6-20-13(17)12(14(22)19(4)16(20)24)10(21)7-25-15(23)11-8(2)18-26-9(11)3/h5-7,17H2,1-4H3	AAHZIIKQJCMENQ-UHFFFAOYSA-N	CCCN1C(=C(C(=O)COC(=O)c2c(C)onc2C)C(=O)N(C)C1=O)N	BroadT	BRD-K75206195	BRD-K75206195-001-06-0	Enamine Ltd.	T5243580			CCCn1c(N)c(C(=O)COC(=O)c2c(C)noc2C)c(=O)n(C)c1=O	InChI=1S/C16H20N4O6/c1-5-6-20-13(17)12(14(22)19(4)16(20)24)10(21)7-25-15(23)11-8(2)18-26-9(11)3/h5-7,17H2,1-4H3	AAHZIIKQJCMENQ-UHFFFAOYSA-N	364.1382844							114925
4-Amino-6,7-diphenyl-2(1H)-pteridinethione	LSM-26389	SID24786596, BRD-K61551974	5357512	InChI=1S/C18H13N5S/c19-16-15-17(23-18(24)22-16)21-14(12-9-5-2-6-10-12)13(20-15)11-7-3-1-4-8-11/h1-10H,(H3,19,21,22,23,24)	KVWKYWQHNUYWKX-UHFFFAOYSA-N	Nc1nc(S)nc2nc(c3ccccc3)c(nc12)c4ccccc4	BroadT	BRD-K61551974	BRD-K61551974-001-05-4	Specs	AB-323/13887383			Nc1nc(S)nc2nc(-c3ccccc3)c(nc12)-c1ccccc1	InChI=1S/C18H13N5S/c19-16-15-17(23-18(24)22-16)21-14(12-9-5-2-6-10-12)13(20-15)11-7-3-1-4-8-11/h1-10H,(H3,19,21,22,23,24)	KVWKYWQHNUYWKX-UHFFFAOYSA-N	331.089166156							114926
AC1M5PBL	LSM-15566	BRD-K29244353	2382871	InChI=1S/C16H17N3O3/c1-22-16(21)13-2-4-14(5-3-13)19-15(20)11-18-10-12-6-8-17-9-7-12/h2-9,18H,10-11H2,1H3,(H,19,20)	ILEOUAHJEOKIKW-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=O)CNCc2ccncc2)cc1	BroadT	BRD-K29244353	BRD-K29244353-034-05-9	Enamine Ltd.	T0510-5954		OC(=O)C(=O)O	COC(=O)c1ccc(NC(=O)CNCc2ccncc2)cc1.OC(=O)C(=O)O	InChI=1S/C16H17N3O3.C2H2O4/c1-22-16(21)13-2-4-14(5-3-13)19-15(20)11-18-10-12-6-8-17-9-7-12;3-1(4)2(5)6/h2-9,18H,10-11H2,1H3,(H,19,20);(H,3,4)(H,5,6)	QZWDNOPUFVBYPK-UHFFFAOYSA-N	299.126991434							104202, 104202
AC1LMDXL	LSM-44172	SID49645207, BRD-K26516932	1128830	InChI=1S/C22H15ClN2O5/c1-29-16-5-3-15(4-6-16)25-21(26)14(12-24)10-17-7-9-20(30-17)13-2-8-19(23)18(11-13)22(27)28/h2-11H,1H3,(H,25,26)(H,27,28)/b14-10+	HVFQACVXHGQGHH-GXDHUFHOSA-N	COc1ccc(NC(=O)\C(=C\c2oc(cc2)c3ccc(Cl)c(c3)C(=O)O)\C#N)cc1	BroadT	BRD-K26516932	BRD-K26516932-001-05-2	Asinex Ltd.	BAS 02276105			COc1ccc(NC(=O)C(=C\c2ccc(o2)-c2ccc(Cl)c(c2)C(O)=O)\C#N)cc1	InChI=1S/C22H15ClN2O5/c1-29-16-5-3-15(4-6-16)25-21(26)14(12-24)10-17-7-9-20(30-17)13-2-8-19(23)18(11-13)22(27)28/h2-11H,1H3,(H,25,26)(H,27,28)/b14-10+	HVFQACVXHGQGHH-GXDHUFHOSA-N	422.06694931							
STK587330	LSM-26391	SID14743024, BRD-A57497262	4596552	InChI=1S/C21H22N2O/c1-13(2)14-7-9-16(10-8-14)19-18-12-11-15-5-3-4-6-17(15)20(18)23-21(24)22-19/h3-10,13,19H,11-12H2,1-2H3,(H2,22,23,24)	ZGEPBEZNBKLBQM-UHFFFAOYSA-N	CC(C)c1ccc(cc1)C2NC(=O)NC3=C2CCc4ccccc34	BroadT	BRD-A57497262	BRD-A57497262-001-05-9	InterBioScreen Ltd.	STOCK4S-71146			CC(C)c1ccc(cc1)C1NC(=O)NC2=C1CCc1ccccc21	InChI=1S/C21H22N2O/c1-13(2)14-7-9-16(10-8-14)19-18-12-11-15-5-3-4-6-17(15)20(18)23-21(24)22-19/h3-10,13,19H,11-12H2,1-2H3,(H2,22,23,24)	ZGEPBEZNBKLBQM-UHFFFAOYSA-N	318.173213344							114928
2-(4-Fluoro-phenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine	LSM-26392	SID14726015, BRD-K87955555	753357	InChI=1S/C13H11FN4/c1-8-7-9(2)18-13(15-8)16-12(17-18)10-3-5-11(14)6-4-10/h3-7H,1-2H3	FCVQQTYBCRGHNI-UHFFFAOYSA-N	Cc1cc(C)n2nc(nc2n1)c3ccc(F)cc3	BroadT	BRD-K87955555	BRD-K87955555-001-05-4	Asinex Ltd.	BAS 06172348			Cc1cc(C)n2nc(nc2n1)-c1ccc(F)cc1	InChI=1S/C13H11FN4/c1-8-7-9(2)18-13(15-8)16-12(17-18)10-3-5-11(14)6-4-10/h3-7H,1-2H3	FCVQQTYBCRGHNI-UHFFFAOYSA-N	242.096774592							114929
N-Bicyclo[2.2.1]hept-2-yl-2-[5-(4-chloro-phenyl)-tetrazol-2-yl]-acetamide	LSM-26393	SID849166, BRD-A90994427	651635	InChI=1S/C16H18ClN5O/c17-13-5-3-11(4-6-13)16-19-21-22(20-16)9-15(23)18-14-8-10-1-2-12(14)7-10/h3-6,10,12,14H,1-2,7-9H2,(H,18,23)	VMEDHRYDUGZJAU-UHFFFAOYSA-N	Clc1ccc(cc1)c2nnn(CC(=O)NC3CC4CCC3C4)n2	BroadT	BRD-A90994427	BRD-A90994427-001-05-6	Asinex Ltd.	ASN 05830010			Clc1ccc(cc1)-c1nnn(CC(=O)NC2CC3CCC2C3)n1	InChI=1S/C16H18ClN5O/c17-13-5-3-11(4-6-13)16-19-21-22(20-16)9-15(23)18-14-8-10-1-2-12(14)7-10/h3-6,10,12,14H,1-2,7-9H2,(H,18,23)	VMEDHRYDUGZJAU-UHFFFAOYSA-N	331.119987956							114930
AC1M8OPE	LSM-44173	SID24833830, BRD-K89426642	2541773	InChI=1S/C22H20FN3O3S/c23-18-6-10-20(11-7-18)30(28,29)26-15-13-25(14-16-26)22(27)12-9-19-8-5-17-3-1-2-4-21(17)24-19/h1-12H,13-16H2/b12-9+	KDBMWACETLRQAS-FMIVXFBMSA-N	Fc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(=O)\C=C\c3ccc4ccccc4n3	BroadT	BRD-K89426642	BRD-K89426642-001-05-9	Enamine Ltd.	T5322817			Fc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)\C=C\c1ccc2ccccc2n1	InChI=1S/C22H20FN3O3S/c23-18-6-10-20(11-7-18)30(28,29)26-15-13-25(14-16-26)22(27)12-9-19-8-5-17-3-1-2-4-21(17)24-19/h1-12H,13-16H2/b12-9+	KDBMWACETLRQAS-FMIVXFBMSA-N	425.12094042							
ZINC04807833	LSM-44174	SID26659462, BRD-K32531300	5399172	InChI=1S/C17H14N2O5/c20-16(18-11-13-5-2-8-23-13)14(10-12-4-1-7-22-12)19-17(21)15-6-3-9-24-15/h1-10H,11H2,(H,18,20)(H,19,21)/b14-10+	YBQNMTCWAUEUQU-GXDHUFHOSA-N	O=C(NCc1occc1)\C(=C/c2occc2)\NC(=O)c3occc3	BroadT	BRD-K32531300	BRD-K32531300-001-05-7	InterBioScreen Ltd.	STOCK1S-75759			O=C(NCc1ccco1)C(\NC(=O)c1ccco1)=C/c1ccco1	InChI=1S/C17H14N2O5/c20-16(18-11-13-5-2-8-23-13)14(10-12-4-1-7-22-12)19-17(21)15-6-3-9-24-15/h1-10H,11H2,(H,18,20)(H,19,21)/b14-10+	YBQNMTCWAUEUQU-GXDHUFHOSA-N	326.090271568							
AC1M478J	LSM-26396	BRD-K52150124	2302289	InChI=1S/C20H19N3O4/c1-25-16-9-8-14(11-18(16)26-2)12-22-23-19(24)13-27-17-7-3-5-15-6-4-10-21-20(15)17/h3-12H,13H2,1-2H3,(H,23,24)	VBKWVQQKOMKNPY-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)COc2cccc3cccnc23)cc1OC	BroadT	BRD-K52150124	BRD-K52150124-001-05-5	Enamine Ltd.	T0502-1814			COc1ccc(C=NNC(=O)COc2cccc3cccnc23)cc1OC	InChI=1S/C20H19N3O4/c1-25-16-9-8-14(11-18(16)26-2)12-22-23-19(24)13-27-17-7-3-5-15-6-4-10-21-20(15)17/h3-12H,13H2,1-2H3,(H,23,24)	VBKWVQQKOMKNPY-UHFFFAOYSA-N	365.137556118							114933
BRD-A68662875	LSM-26397	SID24813750		InChI=1S/C15H14N4O4/c1-16-12-6-4-3-5-7-13(12)17(2)15(16)9-8-11(18(20)21)10-14(15)19(22)23/h3-10H,1-2H3	CWMIMOPIOOXSEA-UHFFFAOYSA-N	CN1C2=CC=CC=CC2=[N+](C)C13C=CC(=[N+]([O-])[O-])C=C3[N+](=O)[O-]	BroadT	BRD-A68662875	BRD-A68662875-001-05-4	Asinex Ltd.	BAS 01280740			CN1C2=CC=CC=CC2=[N+](C)C11C=CC(C=C1[N+]([O-])=O)=[N+]([O-])[O-]	InChI=1S/C15H14N4O4/c1-16-12-6-4-3-5-7-13(12)17(2)15(16)9-8-11(18(20)21)10-14(15)19(22)23/h3-10H,1-2H3	CWMIMOPIOOXSEA-UHFFFAOYSA-N	314.101504968							114934
SMR000369784	LSM-26398	SID24833267, BRD-K87424856	3514523	InChI=1S/C19H16BrN3O3S/c1-23(17-7-3-2-4-8-17)27(25,26)18-9-5-6-16(11-18)22-19(24)14-10-15(20)13-21-12-14/h2-13H,1H3,(H,22,24)	UGHPSGHYSHXLSK-UHFFFAOYSA-N	CN(c1ccccc1)S(=O)(=O)c2cccc(NC(=O)c3cncc(Br)c3)c2	BroadT	BRD-K87424856	BRD-K87424856-001-05-7	Enamine Ltd.	T5268663			CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)c2cncc(Br)c2)c1	InChI=1S/C19H16BrN3O3S/c1-23(17-7-3-2-4-8-17)27(25,26)18-9-5-6-16(11-18)22-19(24)14-10-15(20)13-21-12-14/h2-13H,1H3,(H,22,24)	UGHPSGHYSHXLSK-UHFFFAOYSA-N	445.009574692							114935
AC1LNRU2	LSM-26399	BRD-K52002039	1226441	InChI=1S/C24H23N5O/c1-15-9-10-18(11-16(15)2)23-12-21(20-7-5-6-8-22(20)27-23)24(30)28-25-13-19-14-26-29(4)17(19)3/h5-14H,1-4H3,(H,28,30)	XMYMSJOTLQWCPD-UHFFFAOYSA-N	Cc1ccc(cc1C)c2cc(C(=O)NN=Cc3cnn(C)c3C)c4ccccc4n2	BroadT	BRD-K52002039	BRD-K52002039-001-05-2	Specs	AK-968/41025651			Cc1c(C=NNC(=O)c2cc(nc3ccccc23)-c2ccc(C)c(C)c2)cnn1C	InChI=1S/C24H23N5O/c1-15-9-10-18(11-16(15)2)23-12-21(20-7-5-6-8-22(20)27-23)24(30)28-25-13-19-14-26-29(4)17(19)3/h5-14H,1-4H3,(H,28,30)	XMYMSJOTLQWCPD-UHFFFAOYSA-N	397.190260406							114936
5-Bromo-furan-2-carboxylic acid [3-(2-oxo-2H-chromen-3-yl)-phenyl]-amide	LSM-26400	SID14725584, BRD-K00601724	1142582	InChI=1S/C20H12BrNO4/c21-18-9-8-17(25-18)19(23)22-14-6-3-5-12(10-14)15-11-13-4-1-2-7-16(13)26-20(15)24/h1-11H,(H,22,23)	LLNZVRCHUHIFMZ-UHFFFAOYSA-N	Brc1oc(cc1)C(=O)Nc2cccc(c2)C3=Cc4ccccc4OC3=O	BroadT	BRD-K00601724	BRD-K00601724-001-05-4	Asinex Ltd.	BAS 00649512			Brc1ccc(o1)C(=O)Nc1cccc(c1)-c1cc2ccccc2oc1=O	InChI=1S/C20H12BrNO4/c21-18-9-8-17(25-18)19(23)22-14-6-3-5-12(10-14)15-11-13-4-1-2-7-16(13)26-20(15)24/h1-11H,(H,22,23)	LLNZVRCHUHIFMZ-UHFFFAOYSA-N	408.994970474							114937
SMR000155369	LSM-26401	SID16952816, BRD-K94584466	1548434	InChI=1S/C18H23N3O5S2/c1-5-21(6-2)28(24,25)14-10-8-13(9-11-14)16(22)20-18-19-12(4)15(27-18)17(23)26-7-3/h8-11H,5-7H2,1-4H3,(H,19,20,22)	NQKYAUGUQSTEAV-UHFFFAOYSA-N	CCOC(=O)c1sc(NC(=O)c2ccc(cc2)S(=O)(=O)N(CC)CC)nc1C	BroadT	BRD-K94584466	BRD-K94584466-001-05-1	Enamine Ltd.	T0504-3175			CCOC(=O)c1sc(NC(=O)c2ccc(cc2)S(=O)(=O)N(CC)CC)nc1C	InChI=1S/C18H23N3O5S2/c1-5-21(6-2)28(24,25)14-10-8-13(9-11-14)16(22)20-18-19-12(4)15(27-18)17(23)26-7-3/h8-11H,5-7H2,1-4H3,(H,19,20,22)	NQKYAUGUQSTEAV-UHFFFAOYSA-N	425.107912246							114938
F0676-0196	LSM-26402	SJ000240587, BRD-K45386025	3236478	InChI=1S/C17H13ClN6O2S/c1-10-8-13(23-26-10)19-15(25)9-27-16-7-6-14-20-21-17(24(14)22-16)11-2-4-12(18)5-3-11/h2-8H,9H2,1H3,(H,19,23,25)	DGQUBZJYXZYPCN-UHFFFAOYSA-N	Cc1onc(NC(=O)CSc2ccc3nnc(c4ccc(Cl)cc4)n3n2)c1	BroadT	BRD-K45386025	BRD-K45386025-001-05-5	ChemDiv Inc.	C742-0196			Cc1cc(NC(=O)CSc2ccc3nnc(-c4ccc(Cl)cc4)n3n2)no1	InChI=1S/C17H13ClN6O2S/c1-10-8-13(23-26-10)19-15(25)9-27-16-7-6-14-20-21-17(24(14)22-16)11-2-4-12(18)5-3-11/h2-8H,9H2,1H3,(H,19,23,25)	DGQUBZJYXZYPCN-UHFFFAOYSA-N	400.050922116							114939
MLS000756458	LSM-26403	SID26666154, BRD-K06788463	5236119	InChI=1S/C27H19N7O5/c35-27(32-18-3-1-17(2-4-18)30-19-9-12-28-13-10-19)22-7-5-20(15-26(22)34(38)39)31-25-11-14-29-24-8-6-21(33(36)37)16-23(24)25/h1-16H,(H,28,30)(H,29,31)(H,32,35)	YUOOWNPVFAMPNZ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2nccc(Nc3ccc(C(=O)Nc4ccc(Nc5ccncc5)cc4)c(c3)[N+](=O)[O-])c2c1	BroadT	BRD-K06788463	BRD-K06788463-001-06-6	National Cancer Institute Chemotherapeutic Agents Repository	202386			[O-][N+](=O)c1ccc2nccc(Nc3ccc(C(=O)Nc4ccc(Nc5ccncc5)cc4)c(c3)[N+]([O-])=O)c2c1	InChI=1S/C27H19N7O5/c35-27(32-18-3-1-17(2-4-18)30-19-9-12-28-13-10-19)22-7-5-20(15-26(22)34(38)39)31-25-11-14-29-24-8-6-21(33(36)37)16-23(24)25/h1-16H,(H,28,30)(H,29,31)(H,32,35)	YUOOWNPVFAMPNZ-UHFFFAOYSA-N	521.144766778							114940
N-(4-Methylpiperazin-1-yl)-1-(4-phenylphenyl)methanimine	LSM-26404	BRD-K25585945	5220364	InChI=1S/C18H21N3/c1-20-11-13-21(14-12-20)19-15-16-7-9-18(10-8-16)17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3	FBPUSSTVPCEHJZ-UHFFFAOYSA-N	CN1CCN(CC1)N=Cc2ccc(cc2)c3ccccc3	BroadT	BRD-K25585945	BRD-K25585945-001-05-3	Enamine Ltd.	T0519-3038			CN1CCN(CC1)N=Cc1ccc(cc1)-c1ccccc1	InChI=1S/C18H21N3/c1-20-11-13-21(14-12-20)19-15-16-7-9-18(10-8-16)17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3	FBPUSSTVPCEHJZ-UHFFFAOYSA-N	279.173547702							114941
ST50313799	LSM-26405	SID850422, BRD-K18853405	652943	InChI=1S/C17H19N3O3S/c1-22-14-4-2-13(3-5-14)15-6-7-18-17(19-15)24-12-16(21)20-8-10-23-11-9-20/h2-7H,8-12H2,1H3	LJAVIEUWQYYONW-UHFFFAOYSA-N	COc1ccc(cc1)c2ccnc(SCC(=O)N3CCOCC3)n2	BroadT	BRD-K18853405	BRD-K18853405-001-06-5	Asinex Ltd.	ASN 07850950			COc1ccc(cc1)-c1ccnc(SCC(=O)N2CCOCC2)n1	InChI=1S/C17H19N3O3S/c1-22-14-4-2-13(3-5-14)15-6-7-18-17(19-15)24-12-16(21)20-8-10-23-11-9-20/h2-7H,8-12H2,1H3	LJAVIEUWQYYONW-UHFFFAOYSA-N	345.114712188							114942
T5215362	LSM-26406	SID17516510, BRD-K32927380	2452268	InChI=1S/C21H17ClN4/c22-16-8-6-7-15(13-16)20-14-21(24-19-12-5-4-11-18(19)23)26(25-20)17-9-2-1-3-10-17/h1-14,24H,23H2	HRYVJTWMPJASSO-UHFFFAOYSA-N	Nc1ccccc1Nc2cc(nn2c3ccccc3)c4cccc(Cl)c4	BroadT	BRD-K32927380	BRD-K32927380-001-06-8	Enamine Ltd.	T5215362			Nc1ccccc1Nc1cc(nn1-c1ccccc1)-c1cccc(Cl)c1	InChI=1S/C21H17ClN4/c22-16-8-6-7-15(13-16)20-14-21(24-19-12-5-4-11-18(19)23)26(25-20)17-9-2-1-3-10-17/h1-14,24H,23H2	HRYVJTWMPJASSO-UHFFFAOYSA-N	360.114174294							114943
AC1MMSLC	LSM-26407	BRD-A56684992	3243771	InChI=1S/C21H18N4O4/c1-11(2)18-17-16(14(10-22)19(23)29-20(17)25-24-18)12-5-7-13(8-6-12)28-21(26)15-4-3-9-27-15/h3-9,11,14,16,23H,1-2H3,(H,24,25)	BOCKCPQWCCUNJI-UHFFFAOYSA-N	CC(C)c1[nH]nc2OC(=N)C(C#N)C(c12)c1ccc(OC(=O)c2ccco2)cc1	BroadT	BRD-A56684992	BRD-A56684992-001-06-8	ChemDiv Inc.	3448-7881			CC(C)c1n[nH]c2OC(N)=C(C#N)C(c12)c1ccc(OC(=O)c2ccco2)cc1	InChI=1S/C21H18N4O4/c1-11(2)18-17-16(14(10-22)19(23)29-20(17)25-24-18)12-5-7-13(8-6-12)28-21(26)15-4-3-9-27-15/h3-9,11,16H,23H2,1-2H3,(H,24,25)	OFHLATCYEMCERE-UHFFFAOYSA-N	390.132805096							
2-Thiophenecarboxaldehyde, 5-(1-methyl-1H-benzimidazol-2-yl)-	LSM-26408	SID14739082, BRD-K78069431	874047	InChI=1S/C13H10N2OS/c1-15-11-5-3-2-4-10(11)14-13(15)12-7-6-9(8-16)17-12/h2-8H,1H3	KWTIMXKKCXQFCD-UHFFFAOYSA-N	Cn1c(nc2ccccc12)c3ccc(C=O)s3	BroadT	BRD-K78069431	BRD-K78069431-001-05-5	ChemBridge Corporation	5821604			Cn1c(nc2ccccc12)-c1ccc(C=O)s1	InChI=1S/C13H10N2OS/c1-15-11-5-3-2-4-10(11)14-13(15)12-7-6-9(8-16)17-12/h2-8H,1H3	KWTIMXKKCXQFCD-UHFFFAOYSA-N	242.05138365							114945
AC1LIH0V	LSM-15223	BRD-K42084391	931073	InChI=1S/C16H16N4O2S/c1-10(2)18-19-16-17-13(9-23-16)11-3-5-12(6-4-11)20-14(21)7-8-15(20)22/h3-6,9H,7-8H2,1-2H3,(H,17,19)	WHSGRBCODMWCOM-UHFFFAOYSA-N	CC(=NNc1nc(cs1)c2ccc(cc2)N3C(=O)CCC3=O)C	BroadT	BRD-K42084391	BRD-K42084391-004-06-7	InterBioScreen Ltd.	STOCK3S-93997		Br	CC(C)=NNc1nc(cs1)-c1ccc(cc1)N1C(=O)CCC1=O.Br	InChI=1S/C16H16N4O2S.BrH/c1-10(2)18-19-16-17-13(9-23-16)11-3-5-12(6-4-11)20-14(21)7-8-15(20)22;/h3-6,9H,7-8H2,1-2H3,(H,17,19);1H	FJNIGWRORKFIJR-UHFFFAOYSA-N	328.099396482							103870, 103870
ST071928	LSM-26409	SID24823869, BRD-K32854385	54690850	InChI=1S/C17H12N2O2S/c1-9-7-11(10-5-3-2-4-6-10)14-15-16(22-17(14)18-9)12(20)8-13(21)19-15/h2-8H,1H3,(H2,19,20,21)	RNEJAXWYSZGXSP-UHFFFAOYSA-N	Cc1cc(c2ccccc2)c3c(n1)sc4c(O)cc(O)nc34	BroadT	BRD-K32854385	BRD-K32854385-001-03-6	ChemDiv Inc.	6773-0256			Cc1cc(-c2ccccc2)c2c(n1)sc1c(O)cc(O)nc21	InChI=1S/C17H12N2O2S/c1-9-7-11(10-5-3-2-4-6-10)14-15-16(22-17(14)18-9)12(20)8-13(21)19-15/h2-8H,1H3,(H2,19,20,21)	RNEJAXWYSZGXSP-UHFFFAOYSA-N	308.061948334							114946
2-Piperidino-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile	LSM-26410	SID26727331, BRD-K08862111	2726260	InChI=1S/C16H14F3N3S/c17-16(18,19)12-9-13(14-5-4-8-23-14)21-15(11(12)10-20)22-6-2-1-3-7-22/h4-5,8-9H,1-3,6-7H2	KGBXGQJLQZFTGA-UHFFFAOYSA-N	FC(F)(F)c1cc(nc(N2CCCCC2)c1C#N)c3cccs3	BroadT	BRD-K08862111	BRD-K08862111-001-05-5	Maybridge	RF 01024			FC(F)(F)c1cc(nc(N2CCCCC2)c1C#N)-c1cccs1	InChI=1S/C16H14F3N3S/c17-16(18,19)12-9-13(14-5-4-8-23-14)21-15(11(12)10-20)22-6-2-1-3-7-22/h4-5,8-9H,1-3,6-7H2	KGBXGQJLQZFTGA-UHFFFAOYSA-N	337.086052768							114947
4-[(3-Cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-4-oxobutanoic acid	LSM-26411	SID24780630, BRD-K48091964	2887106	InChI=1S/C14H16N2O3S/c15-8-10-9-4-2-1-3-5-11(9)20-14(10)16-12(17)6-7-13(18)19/h1-7H2,(H,16,17)(H,18,19)	YEQFYCUDSXWGKM-UHFFFAOYSA-N	OC(=O)CCC(=O)Nc1sc2CCCCCc2c1C#N	BroadT	BRD-K48091964	BRD-K48091964-001-05-1	Asinex Ltd.	BAS 05512753			OC(=O)CCC(=O)Nc1sc2CCCCCc2c1C#N	InChI=1S/C14H16N2O3S/c15-8-10-9-4-2-1-3-5-11(9)20-14(10)16-12(17)6-7-13(18)19/h1-7H2,(H,16,17)(H,18,19)	YEQFYCUDSXWGKM-UHFFFAOYSA-N	292.088163082							114948
AC1NYMIH	LSM-44175	SID26663391, BRD-K05464415	5859672	InChI=1S/C20H24N4O3/c1-3-4-11-24-19(26)17(18(25)23-20(24)27)13(2)21-10-9-14-12-22-16-8-6-5-7-15(14)16/h5-8,12,21-22H,3-4,9-11H2,1-2H3,(H,23,25,27)/b17-13+	IAIIZGTUTBPXFW-GHRIWEEISA-N	CCCCN1C(=O)NC(=O)\C(=C(\C)/NCCc2c[nH]c3ccccc23)\C1=O	BroadT	BRD-K05464415	BRD-K05464415-001-05-6	InterBioScreen Ltd.	STOCK4S-20834			CCCCN1C(=O)NC(=O)\C(=C(\C)NCCc2c[nH]c3ccccc23)C1=O	InChI=1S/C20H24N4O3/c1-3-4-11-24-19(26)17(18(25)23-20(24)27)13(2)21-10-9-14-12-22-16-8-6-5-7-15(14)16/h5-8,12,21-22H,3-4,9-11H2,1-2H3,(H,23,25,27)/b17-13+	IAIIZGTUTBPXFW-GHRIWEEISA-N	368.184840668							
6-[(2,4-Dichlorophenoxy)methyl]-3-(2-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole	LSM-26413	SID861650, BRD-K04242120	662888	InChI=1S/C17H12Cl2N4O2S/c1-24-13-5-3-2-4-11(13)16-20-21-17-23(16)22-15(26-17)9-25-14-7-6-10(18)8-12(14)19/h2-8H,9H2,1H3	KDEIWIGENYCHKU-UHFFFAOYSA-N	COc1ccccc1c2nnc3sc(COc4ccc(Cl)cc4Cl)nn23	BroadT	BRD-K04242120	BRD-K04242120-001-05-3	InterBioScreen Ltd.	STOCK4S-16487			COc1ccccc1-c1nnc2sc(COc3ccc(Cl)cc3Cl)nn12	InChI=1S/C17H12Cl2N4O2S/c1-24-13-5-3-2-4-11(13)16-20-21-17-23(16)22-15(26-17)9-25-14-7-6-10(18)8-12(14)19/h2-8H,9H2,1H3	KDEIWIGENYCHKU-UHFFFAOYSA-N	406.005801774							114950
MLS000058371	LSM-26414	SID3711304, BRD-K58473865	2083077	InChI=1S/C21H19N3O3S2/c1-13-11-17(14(2)24(13)15-6-8-16(26-3)9-7-15)18(25)12-29-21-23-22-20(27-21)19-5-4-10-28-19/h4-11H,12H2,1-3H3	JLYSXIINKUKSSB-UHFFFAOYSA-N	COc1ccc(cc1)n2c(C)cc(C(=O)CSc3oc(nn3)c4cccs4)c2C	BroadT	BRD-K58473865	BRD-K58473865-001-05-8	Enamine Ltd.	T5261023			COc1ccc(cc1)-n1c(C)cc(C(=O)CSc2nnc(o2)-c2cccs2)c1C	InChI=1S/C21H19N3O3S2/c1-13-11-17(14(2)24(13)15-6-8-16(26-3)9-7-15)18(25)12-29-21-23-22-20(27-21)19-5-4-10-28-19/h4-11H,12H2,1-3H3	JLYSXIINKUKSSB-UHFFFAOYSA-N	425.086782878							114951
AC1M7IJ0	LSM-26415	SID3713538, BRD-K69712716	2418824	InChI=1S/C8H7N3O2S/c12-6(7-2-1-3-13-7)4-14-8-9-5-10-11-8/h1-3,5H,4H2,(H,9,10,11)	UHYCGEMACRGOGH-UHFFFAOYSA-N	O=C(CSc1nc[nH]n1)c2occc2	BroadT	BRD-K69712716	BRD-K69712716-001-05-7	Enamine Ltd.	T0515-6224			O=C(CSc1nc[nH]n1)c1ccco1	InChI=1S/C8H7N3O2S/c12-6(7-2-1-3-13-7)4-14-8-9-5-10-11-8/h1-3,5H,4H2,(H,9,10,11)	UHYCGEMACRGOGH-UHFFFAOYSA-N	209.025897184							114952
N-(6-Butyrylamino-pyridin-3-yl)-2-methoxy-benzamide	LSM-26416	SID843343, BRD-K40152400	645634	InChI=1S/C17H19N3O3/c1-3-6-16(21)20-15-10-9-12(11-18-15)19-17(22)13-7-4-5-8-14(13)23-2/h4-5,7-11H,3,6H2,1-2H3,(H,19,22)(H,18,20,21)	IBRNIRCFVVCJOQ-UHFFFAOYSA-N	CCCC(=O)Nc1ccc(NC(=O)c2ccccc2OC)cn1	BroadT	BRD-K40152400	BRD-K40152400-001-05-1	Asinex Ltd.	ASN 05804048			CCCC(=O)Nc1ccc(NC(=O)c2ccccc2OC)cn1	InChI=1S/C17H19N3O3/c1-3-6-16(21)20-15-10-9-12(11-18-15)19-17(22)13-7-4-5-8-14(13)23-2/h4-5,7-11H,3,6H2,1-2H3,(H,19,22)(H,18,20,21)	IBRNIRCFVVCJOQ-UHFFFAOYSA-N	313.142641498							131274
MLS000065925	LSM-26417	SID4257652, BRD-A53365187	2971196	InChI=1S/C13H18N2O3S/c1-2-4-8-7-9(11(14)16)13(19-8)15-12(17)10-5-3-6-18-10/h7,10H,2-6H2,1H3,(H2,14,16)(H,15,17)	GLEKPBDUBXWOAQ-UHFFFAOYSA-N	CCCc1cc(C(=O)N)c(NC(=O)C2CCCO2)s1	BroadT	BRD-A53365187	BRD-A53365187-001-06-2	ChemBridge Corporation	7947820			CCCc1cc(C(N)=O)c(NC(=O)C2CCCO2)s1	InChI=1S/C13H18N2O3S/c1-2-4-8-7-9(11(14)16)13(19-8)15-12(17)10-5-3-6-18-10/h7,10H,2-6H2,1H3,(H2,14,16)(H,15,17)	GLEKPBDUBXWOAQ-UHFFFAOYSA-N	282.103813146							114955
ZINC00112082	LSM-26418	SID4247318, BRD-K23474839	715538	InChI=1S/C18H17N5O2/c1-11-7-8-12(9-15(11)24-2)10-23-14-6-4-3-5-13(14)20-18(23)16-17(19)22-25-21-16/h3-9H,10H2,1-2H3,(H2,19,22)	SNAHHWCKTZHBIF-UHFFFAOYSA-N	COc1cc(Cn2c(nc3ccccc23)c4nonc4N)ccc1C	BroadT	BRD-K23474839	BRD-K23474839-001-06-9	ChemDiv Inc.	8015-1399			COc1cc(Cn2c(nc3ccccc23)-c2nonc2N)ccc1C	InChI=1S/C18H17N5O2/c1-11-7-8-12(9-15(11)24-2)10-23-14-6-4-3-5-13(14)20-18(23)16-17(19)22-25-21-16/h3-9H,10H2,1-2H3,(H2,19,22)	SNAHHWCKTZHBIF-UHFFFAOYSA-N	335.138224834							114956
MLS000680746	LSM-44176	SID22416203, BRD-K88687273	888046	InChI=1S/C16H18N2O2/c1-12-4-9-15(20-12)10-11-16(19)17-13-5-7-14(8-6-13)18(2)3/h4-11H,1-3H3,(H,17,19)/b11-10+	QSWMESJMZAVPMY-ZHACJKMWSA-N	CN(C)c1ccc(NC(=O)\C=C\c2oc(C)cc2)cc1	BroadT	BRD-K88687273	BRD-K88687273-001-05-3	ChemBridge Corporation	7308316			CN(C)c1ccc(NC(=O)\C=C\c2ccc(C)o2)cc1	InChI=1S/C16H18N2O2/c1-12-4-9-15(20-12)10-11-16(19)17-13-5-7-14(8-6-13)18(2)3/h4-11H,1-3H3,(H,17,19)/b11-10+	QSWMESJMZAVPMY-ZHACJKMWSA-N	270.136827836							
ZINC00211459	LSM-26420	SID24805715, BRD-K85819329	756019	InChI=1S/C21H21N3O2/c1-15-6-10-17(11-7-15)21(26,18-12-8-16(2)9-13-18)20(25)24-23-19-5-3-4-14-22-19/h3-14,26H,1-2H3,(H,22,23)(H,24,25)	JYLXQQVVSIIMIO-UHFFFAOYSA-N	Cc1ccc(cc1)C(O)(C(=O)NNc2ccccn2)c3ccc(C)cc3	BroadT	BRD-K85819329	BRD-K85819329-001-06-7	Asinex Ltd.	BAS 02097284			Cc1ccc(cc1)C(O)(C(=O)NNc1ccccn1)c1ccc(C)cc1	InChI=1S/C21H21N3O2/c1-15-6-10-17(11-7-15)21(26,18-12-8-16(2)9-13-18)20(25)24-23-19-5-3-4-14-22-19/h3-14,26H,1-2H3,(H,22,23)(H,24,25)	JYLXQQVVSIIMIO-UHFFFAOYSA-N	347.163376942							114958
ST072731	LSM-44177	SID24817671, BRD-K67332226	753700	InChI=1S/C16H10ClNO3/c17-12-8-6-11(7-9-12)15-18-14(16(19)21-15)5-1-3-13-4-2-10-20-13/h1-10H/b3-1+,14-5-	BFUPUTNYJMGQRD-NQDFZQDQSA-N	Clc1ccc(cc1)C2=N\C(=C/C=C/c3occc3)\C(=O)O2	BroadT	BRD-K67332226	BRD-K67332226-001-05-9	Asinex Ltd.	BAS 00412950			Clc1ccc(cc1)C1=N/C(=C\C=C\c2ccco2)C(=O)O1	InChI=1S/C16H10ClNO3/c17-12-8-6-11(7-9-12)15-18-14(16(19)21-15)5-1-3-13-4-2-10-20-13/h1-10H/b3-1+,14-5-	BFUPUTNYJMGQRD-NQDFZQDQSA-N	299.0349209							
MLS000118695	LSM-26422	SID24838234, SID7967163, BRD-K11738698	5308660	InChI=1S/C23H22ClN5O2S/c1-28-13-3-4-19(28)14-21-26-27-23(29(21)18-9-11-20(31-2)12-10-18)32-15-22(30)25-17-7-5-16(24)6-8-17/h3-13H,14-15H2,1-2H3,(H,25,30)	LCWUCLWJFGDLEY-UHFFFAOYSA-N	COc1ccc(cc1)n2c(Cc3cccn3C)nnc2SCC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K11738698	BRD-K11738698-001-04-6	Life Chemicals Inc.	F0659-0397			COc1ccc(cc1)-n1c(Cc2cccn2C)nnc1SCC(=O)Nc1ccc(Cl)cc1	InChI=1S/C23H22ClN5O2S/c1-28-13-3-4-19(28)14-21-26-27-23(29(21)18-9-11-20(31-2)12-10-18)32-15-22(30)25-17-7-5-16(24)6-8-17/h3-13H,14-15H2,1-2H3,(H,25,30)	LCWUCLWJFGDLEY-UHFFFAOYSA-N	467.118273394							114960
CHEMDIV2_008077	LSM-15394	BRD-K38361432	4208311	InChI=1S/C23H24N4O3S2/c1-26(2)11-12-27-22(29)21-20(17-9-4-5-10-18(17)32-21)25-23(27)31-14-19(28)24-15-7-6-8-16(13-15)30-3/h4-10,13H,11-12,14H2,1-3H3,(H,24,28)	UFEQYRJCKVCSOS-UHFFFAOYSA-N	COc1cccc(NC(=O)CSC2=Nc3c(sc4ccccc34)C(=O)N2CCN(C)C)c1	BroadT	BRD-K38361432	BRD-K38361432-003-05-0	ChemDiv Inc.	K263-0647		Cl	COc1cccc(NC(=O)CSc2nc3c4ccccc4sc3c(=O)n2CCN(C)C)c1.Cl	InChI=1S/C23H24N4O3S2.ClH/c1-26(2)11-12-27-22(29)21-20(17-9-4-5-10-18(17)32-21)25-23(27)31-14-19(28)24-15-7-6-8-16(13-15)30-3;/h4-10,13H,11-12,14H2,1-3H3,(H,24,28);1H	FCGJDJIWQUXDTC-UHFFFAOYSA-N	468.128982048							104036, 104036
SMR000068774	LSM-26423	SID24839731, SID3717181, BRD-K61244093	2669371	InChI=1S/C18H19NO6S/c1-3-19(4-2)26(21,22)15-8-5-13(6-9-15)18(20)25-14-7-10-16-17(11-14)24-12-23-16/h5-11H,3-4,12H2,1-2H3	BTMWJCGDBMWKQP-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)Oc2ccc3OCOc3c2	BroadT	BRD-K61244093	BRD-K61244093-001-05-2	Enamine Ltd.	ZT-5190460			CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)Oc1ccc2OCOc2c1	InChI=1S/C18H19NO6S/c1-3-19(4-2)26(21,22)15-8-5-13(6-9-15)18(20)25-14-7-10-16-17(11-14)24-12-23-16/h5-11H,3-4,12H2,1-2H3	BTMWJCGDBMWKQP-UHFFFAOYSA-N	377.093308028							114961
Dimethyl-(6-phenyl-pyridazin-3-yl)-amine	LSM-26424	SID843688, BRD-K85833074	645991	InChI=1S/C12H13N3/c1-15(2)12-9-8-11(13-14-12)10-6-4-3-5-7-10/h3-9H,1-2H3	XAIYYANINDXOQO-UHFFFAOYSA-N	CN(C)c1ccc(nn1)c2ccccc2	BroadT	BRD-K85833074	BRD-K85833074-001-05-7	Asinex Ltd.	ASN 09858625			CN(C)c1ccc(nn1)-c1ccccc1	InChI=1S/C12H13N3/c1-15(2)12-9-8-11(13-14-12)10-6-4-3-5-7-10/h3-9H,1-2H3	XAIYYANINDXOQO-UHFFFAOYSA-N	199.110947446							114962
STK223488	LSM-26425	SID14740571, BRD-K30528364	1331763	InChI=1S/C25H22N2O5/c1-25(2,3)24(31)26-15-4-10-18(11-5-15)32-19-12-13-20-21(14-19)23(30)27(22(20)29)16-6-8-17(28)9-7-16/h4-14,28H,1-3H3,(H,26,31)	AXPFXXATVAGGEH-UHFFFAOYSA-N	CC(C)(C)C(=O)Nc1ccc(Oc2ccc3C(=O)N(C(=O)c3c2)c4ccc(O)cc4)cc1	BroadT	BRD-K30528364	BRD-K30528364-001-05-8	ChemBridge Corporation	7098569			CC(C)(C)C(=O)Nc1ccc(Oc2ccc3C(=O)N(C(=O)c3c2)c2ccc(O)cc2)cc1	InChI=1S/C25H22N2O5/c1-25(2,3)24(31)26-15-4-10-18(11-5-15)32-19-12-13-20-21(14-19)23(30)27(22(20)29)16-6-8-17(28)9-7-16/h4-14,28H,1-3H3,(H,26,31)	AXPFXXATVAGGEH-UHFFFAOYSA-N	430.152871824							114963
T5326468	LSM-26426	SID24832124, BRD-K65262694	5038862	InChI=1S/C16H17ClN2O2S/c1-20-14-9-15(21-2)13(8-12(14)17)19-16(22)18-10-11-6-4-3-5-7-11/h3-9H,10H2,1-2H3,(H2,18,19,22)	ZZQUPGHRVWOPTQ-UHFFFAOYSA-N	COc1cc(OC)c(NC(=NCc2ccccc2)S)cc1Cl	BroadT	BRD-K65262694	BRD-K65262694-001-07-9	Enamine Ltd.	T5326468			COc1cc(OC)c(NC(S)=NCc2ccccc2)cc1Cl	InChI=1S/C16H17ClN2O2S/c1-20-14-9-15(21-2)13(8-12(14)17)19-16(22)18-10-11-6-4-3-5-7-11/h3-9H,10H2,1-2H3,(H2,18,19,22)	ZZQUPGHRVWOPTQ-UHFFFAOYSA-N	336.069926204							114964
3-{3-[4-(3-Chlorophenyl)piperazino]-3-oxopropyl}pyrido[2,3-d]pyrimidin-4(3H)-one	LSM-26427	SID26727376, BRD-K63120275	2729857	InChI=1S/C20H20ClN5O2/c21-15-3-1-4-16(13-15)24-9-11-25(12-10-24)18(27)6-8-26-14-23-19-17(20(26)28)5-2-7-22-19/h1-5,7,13-14H,6,8-12H2	IVUZTMUESOXDNZ-UHFFFAOYSA-N	Clc1cccc(c1)N2CCN(CC2)C(=O)CCN3C=Nc4ncccc4C3=O	BroadT	BRD-K63120275	BRD-K63120275-001-05-2	Maybridge	RJC 03950			Clc1cccc(c1)N1CCN(CC1)C(=O)CCn1cnc2ncccc2c1=O	InChI=1S/C20H20ClN5O2/c21-15-3-1-4-16(13-15)24-9-11-25(12-10-24)18(27)6-8-26-14-23-19-17(20(26)28)5-2-7-22-19/h1-5,7,13-14H,6,8-12H2	IVUZTMUESOXDNZ-UHFFFAOYSA-N	397.13055264							114965
STK142153	LSM-26428	SID4259956, BRD-A48784068	2956096	InChI=1S/C20H19N3O3/c24-19(22-14-16-9-4-5-11-21-16)17(13-15-7-2-1-3-8-15)23-20(25)18-10-6-12-26-18/h1-12,17H,13-14H2,(H,22,24)(H,23,25)	IWVIJZQCWFDLKJ-UHFFFAOYSA-N	O=C(NCc1ccccn1)C(Cc2ccccc2)NC(=O)c3occc3	BroadT	BRD-A48784068	BRD-A48784068-001-06-6	ChemBridge Corporation	7805652			O=C(NCc1ccccn1)C(Cc1ccccc1)NC(=O)c1ccco1	InChI=1S/C20H19N3O3/c24-19(22-14-16-9-4-5-11-21-16)17(13-15-7-2-1-3-8-15)23-20(25)18-10-6-12-26-18/h1-12,17H,13-14H2,(H,22,24)(H,23,25)	IWVIJZQCWFDLKJ-UHFFFAOYSA-N	349.142641498							114966
ZINC02286426	LSM-26429	BRD-K56304698	6825442	InChI=1S/C18H19N3O5/c1-25-15-9-5-6-13(18(15)24)10-20-21-16(22)11-19-17(23)12-26-14-7-3-2-4-8-14/h2-10,24H,11-12H2,1H3,(H,19,23)(H,21,22)	OBVSXVXAWMTVAY-UHFFFAOYSA-N	COc1cccc(C=NNC(=O)CNC(=O)COc2ccccc2)c1O	BroadT	BRD-K56304698	BRD-K56304698-001-05-0	InterBioScreen Ltd.	STOCK1S-80905			COc1cccc(C=NNC(=O)CNC(=O)COc2ccccc2)c1O	InChI=1S/C18H19N3O5/c1-25-15-9-5-6-13(18(15)24)10-20-21-16(22)11-19-17(23)12-26-14-7-3-2-4-8-14/h2-10,24H,11-12H2,1H3,(H,19,23)(H,21,22)	OBVSXVXAWMTVAY-UHFFFAOYSA-N	357.132470738							
AC1MMV2R	LSM-26430	BRD-A85790029	3244886	InChI=1S/C21H23N5O4/c1-12(2)18-17-16(15(11-22)19(23)30-20(17)25-24-18)13-4-3-5-14(10-13)29-21(27)26-6-8-28-9-7-26/h3-5,10,12,15-16,23H,6-9H2,1-2H3,(H,24,25)	JJSSJGAEBYVVAI-UHFFFAOYSA-N	CC(C)c1[nH]nc2OC(=N)C(C#N)C(c12)c1cccc(OC(=O)N2CCOCC2)c1	BroadT	BRD-A85790029	BRD-A85790029-001-06-5	ChemDiv Inc.	8011-0674			CC(C)c1n[nH]c2OC(N)=C(C#N)C(c12)c1cccc(OC(=O)N2CCOCC2)c1	InChI=1S/C21H23N5O4/c1-12(2)18-17-16(15(11-22)19(23)30-20(17)25-24-18)13-4-3-5-14(10-13)29-21(27)26-6-8-28-9-7-26/h3-5,10,12,16H,6-9,23H2,1-2H3,(H,24,25)	VDPBIFHDBGERIF-UHFFFAOYSA-N	409.175004266							
MLS000055158	LSM-15224	BRD-K27498170	2997613	InChI=1S/C17H16ClN3/c18-14-7-8-17-19-15(12-21(17)10-14)11-20-9-3-5-13-4-1-2-6-16(13)20/h1-2,4,6-8,10,12H,3,5,9,11H2	QZAITRZFFWETMC-UHFFFAOYSA-N	Clc1ccc2nc(CN3CCCc4ccccc34)cn2c1	BroadT	BRD-K27498170	BRD-K27498170-004-05-7	Enamine Ltd.	T0502-2716		Br	Clc1ccc2nc(CN3CCCc4ccccc34)cn2c1.Br	InChI=1S/C17H16ClN3.BrH/c18-14-7-8-17-19-15(12-21(17)10-14)11-20-9-3-5-13-4-1-2-6-16(13)20;/h1-2,4,6-8,10,12H,3,5,9,11H2;1H	CARLSXVWFPWVJT-UHFFFAOYSA-N	297.103275252							103871, 103871
ST50261602	LSM-26431	SID7977864, BRD-K68079120	5310902	InChI=1S/C20H21NO3/c1-3-21(4-2)13-17-18(22)11-10-15-16(12-19(23)24-20(15)17)14-8-6-5-7-9-14/h5-12,22H,3-4,13H2,1-2H3	FFIWPKDKGYYXEH-UHFFFAOYSA-N	CCN(CC)Cc1c(O)ccc2C(=CC(=O)Oc12)c3ccccc3	BroadT	BRD-K68079120	BRD-K68079120-001-05-2	ChemBridge Corporation	6142428			CCN(CC)Cc1c(O)ccc2c(cc(=O)oc12)-c1ccccc1	InChI=1S/C20H21NO3/c1-3-21(4-2)13-17-18(22)11-10-15-16(12-19(23)24-20(15)17)14-8-6-5-7-9-14/h5-12,22H,3-4,13H2,1-2H3	FFIWPKDKGYYXEH-UHFFFAOYSA-N	323.152143542							114969
3-(4-Methylphenyl)-n-phenylpyrrolidine-1-carboxamide	LSM-26432	SID4250984, BRD-A30293581	3244727	InChI=1S/C18H20N2O/c1-14-7-9-15(10-8-14)16-11-12-20(13-16)18(21)19-17-5-3-2-4-6-17/h2-10,16H,11-13H2,1H3,(H,19,21)	AQAHUNCWGUYMGM-UHFFFAOYSA-N	Cc1ccc(cc1)C2CCN(C2)C(=O)Nc3ccccc3	BroadT	BRD-A30293581	BRD-A30293581-001-06-6	ChemDiv Inc.	K788-7565			Cc1ccc(cc1)C1CCN(C1)C(=O)Nc1ccccc1	InChI=1S/C18H20N2O/c1-14-7-9-15(10-8-14)16-11-12-20(13-16)18(21)19-17-5-3-2-4-6-17/h2-10,16H,11-13H2,1H3,(H,19,21)	AQAHUNCWGUYMGM-UHFFFAOYSA-N	280.15756328							114970
N-Benzyl-2-(3-nitrophenyl)quinazolin-4-amine	LSM-26433	SID17414802, BRD-K43300822	2927831	InChI=1S/C21H16N4O2/c26-25(27)17-10-6-9-16(13-17)20-23-19-12-5-4-11-18(19)21(24-20)22-14-15-7-2-1-3-8-15/h1-13H,14H2,(H,22,23,24)	BPHLUJMJQBCHJQ-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)c2nc(NCc3ccccc3)c4ccccc4n2	BroadT	BRD-K43300822	BRD-K43300822-001-06-1	ChemBridge Corporation	7129463			[O-][N+](=O)c1cccc(c1)-c1nc(NCc2ccccc2)c2ccccc2n1	InChI=1S/C21H16N4O2/c26-25(27)17-10-6-9-16(13-17)20-23-19-12-5-4-11-18(19)21(24-20)22-14-15-7-2-1-3-8-15/h1-13H,14H2,(H,22,23,24)	BPHLUJMJQBCHJQ-UHFFFAOYSA-N	356.127325792							114971
AK-968/40730332	LSM-26434	SID17387253, BRD-K75508034	5064003	InChI=1S/C21H26N4O/c26-20(24-21-9-16-6-17(10-21)8-18(7-16)11-21)23-19-12-22-25(14-19)13-15-4-2-1-3-5-15/h1-5,12,14,16-18H,6-11,13H2,(H2,23,24,26)	OIOPLWGPWFSWNX-UHFFFAOYSA-N	O=C(Nc1cnn(Cc2ccccc2)c1)NC34CC5CC(CC(C5)C3)C4	BroadT	BRD-K75508034	BRD-K75508034-001-05-6	Specs	AK-968/40730332			O=C(Nc1cnn(Cc2ccccc2)c1)NC12CC3CC(CC(C3)C1)C2	InChI=1S/C21H26N4O/c26-20(24-21-9-16-6-17(10-21)8-18(7-16)11-21)23-19-12-22-25(14-19)13-15-4-2-1-3-5-15/h1-5,12,14,16-18H,6-11,13H2,(H2,23,24,26)	OIOPLWGPWFSWNX-UHFFFAOYSA-N	350.210661492							114972
AC1NQMPX	LSM-26435	BRD-A31359260	5225274	InChI=1S/C13H23N3O3S/c1-8(2)6-18-7-11-5-10(12(17)19-11)4-9(3)15-16-13(14)20/h8,10-11H,4-7H2,1-3H3,(H3,14,16,20)	XKPAFYQXOQSFOP-UHFFFAOYSA-N	CC(C)COCC1CC(CC(=NN=C(N)S)C)C(=O)O1	BroadT	BRD-A31359260	BRD-A31359260-001-05-4	InterBioScreen Ltd.	STOCK1S-22320			CC(C)COCC1CC(CC(C)=NN=C(N)S)C(=O)O1	InChI=1S/C13H23N3O3S/c1-8(2)6-18-7-11-5-10(12(17)19-11)4-9(3)15-16-13(14)20/h8,10-11H,4-7H2,1-3H3,(H3,14,16,20)	XKPAFYQXOQSFOP-UHFFFAOYSA-N	301.146012316							114973
3-Amino-n-(2-chloro-phenyl)-4-pyrrolidin-1-yl-benzenesulfonamide	LSM-26436	SID24835793, BRD-K65359641	4989913	InChI=1S/C16H18ClN3O2S/c17-13-5-1-2-6-15(13)19-23(21,22)12-7-8-16(14(18)11-12)20-9-3-4-10-20/h1-2,5-8,11,19H,3-4,9-10,18H2	RCPBHQKTURGGOV-UHFFFAOYSA-N	Nc1cc(ccc1N2CCCC2)S(=O)(=O)Nc3ccccc3Cl	BroadT	BRD-K65359641	BRD-K65359641-001-05-1	Enamine Ltd.	T0504-2728			Nc1cc(ccc1N1CCCC1)S(=O)(=O)Nc1ccccc1Cl	InChI=1S/C16H18ClN3O2S/c17-13-5-1-2-6-15(13)19-23(21,22)12-7-8-16(14(18)11-12)20-9-3-4-10-20/h1-2,5-8,11,19H,3-4,9-10,18H2	RCPBHQKTURGGOV-UHFFFAOYSA-N	351.080825246							114974
SMR000060866	LSM-26437	SID3716318, BRD-A23259903	2999558	InChI=1S/C16H18N4O5/c1-3-23-13(21)11(14(22)24-4-2)12-18-15(17)19-16-20(12)9-7-5-6-8-10(9)25-16/h5-8,11-12H,3-4H2,1-2H3,(H2,17,18)	HAVTXXLROYGERX-UHFFFAOYSA-N	CCOC(=O)C(C1N=C(N)N=C2Oc3ccccc3N12)C(=O)OCC	BroadT	BRD-A23259903	BRD-A23259903-001-05-9	Enamine Ltd.	T0505-1917			CCOC(=O)C(C1N=C(N)N=C2Oc3ccccc3N12)C(=O)OCC	InChI=1S/C16H18N4O5/c1-3-23-13(21)11(14(22)24-4-2)12-18-15(17)19-16-20(12)9-7-5-6-8-10(9)25-16/h5-8,11-12H,3-4H2,1-2H3,(H2,17,18)	HAVTXXLROYGERX-UHFFFAOYSA-N	346.127719716							114975
N-(4-Methylphenyl)-6-(1H-pyrazol-1-yl)nicotinamide	LSM-26438	SID24821101, BRD-K95981157	4298772	InChI=1S/C16H14N4O/c1-12-3-6-14(7-4-12)19-16(21)13-5-8-15(17-11-13)20-10-2-9-18-20/h2-11H,1H3,(H,19,21)	IEVSRXSQYJJTAY-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2ccc(nc2)n3cccn3)cc1	BroadT	BRD-K95981157	BRD-K95981157-001-05-2	Key Organics Ltd.	2F-360S			Cc1ccc(NC(=O)c2ccc(nc2)-n2cccn2)cc1	InChI=1S/C16H14N4O/c1-12-3-6-14(7-4-12)19-16(21)13-5-8-15(17-11-13)20-10-2-9-18-20/h2-11H,1H3,(H,19,21)	IEVSRXSQYJJTAY-UHFFFAOYSA-N	278.116761108							114976
SMR000093142	LSM-26439	SID7969051, BRD-K41939183	5309746	InChI=1S/C18H14N4O3/c1-11-2-4-14(25-11)17-18(22-7-6-19-9-16(22)21-17)20-12-3-5-13-15(8-12)24-10-23-13/h2-9,20H,10H2,1H3	OZYLJAIYPGSIHE-UHFFFAOYSA-N	Cc1oc(cc1)c2nc3cnccn3c2Nc4ccc5OCOc5c4	BroadT	BRD-K41939183	BRD-K41939183-001-05-3	ChemDiv Inc.	C169-0204			Cc1ccc(o1)-c1nc2cnccn2c1Nc1ccc2OCOc2c1	InChI=1S/C18H14N4O3/c1-11-2-4-14(25-11)17-18(22-7-6-19-9-16(22)21-17)20-12-3-5-13-15(8-12)24-10-23-13/h2-9,20H,10H2,1H3	OZYLJAIYPGSIHE-UHFFFAOYSA-N	334.106590348							114977
N-(1,3-Benzodioxol-5-yl)-5-(tert-butyl)-2-methyl-3-furamide	LSM-26440	SID26729137, BRD-K22881133	2742909	InChI=1S/C17H19NO4/c1-10-12(8-15(22-10)17(2,3)4)16(19)18-11-5-6-13-14(7-11)21-9-20-13/h5-8H,9H2,1-4H3,(H,18,19)	SHAULVJXJIVKPR-UHFFFAOYSA-N	Cc1oc(cc1C(=O)Nc2ccc3OCOc3c2)C(C)(C)C	BroadT	BRD-K22881133	BRD-K22881133-001-04-4	Maybridge	SP 01223			Cc1oc(cc1C(=O)Nc1ccc2OCOc2c1)C(C)(C)C	InChI=1S/C17H19NO4/c1-10-12(8-15(22-10)17(2,3)4)16(19)18-11-5-6-13-14(7-11)21-9-20-13/h5-8H,9H2,1-4H3,(H,18,19)	SHAULVJXJIVKPR-UHFFFAOYSA-N	301.131408098							114978
MLS001010722	LSM-26441	SID26658131, BRD-K95473893	2466262	InChI=1S/C14H11N3O2S/c1-9-5-6-12(19-9)13(18)17-14-16-11(8-20-14)10-4-2-3-7-15-10/h2-8H,1H3,(H,16,17,18)	JBHGMEXQQLQBSO-UHFFFAOYSA-N	Cc1oc(cc1)C(=O)Nc2nc(cs2)c3ccccn3	BroadT	BRD-K95473893	BRD-K95473893-001-06-7	Enamine Ltd.	T5320600			Cc1ccc(o1)C(=O)Nc1nc(cs1)-c1ccccn1	InChI=1S/C14H11N3O2S/c1-9-5-6-12(19-9)13(18)17-14-16-11(8-20-14)10-4-2-3-7-15-10/h2-8H,1H3,(H,16,17,18)	JBHGMEXQQLQBSO-UHFFFAOYSA-N	285.057197312							114979
AC1LCPCY	LSM-26442	BRD-A93004034	653868	InChI=1S/C18H20N4O3/c1-4-5-13-16-15(11-7-6-10(23-2)8-14(11)24-3)12(9-19)17(20)25-18(16)22-21-13/h6-8,12,15,20H,4-5H2,1-3H3,(H,21,22)	QSAQGZDQKGTMRL-UHFFFAOYSA-N	CCCc1[nH]nc2OC(=N)C(C#N)C(c12)c1ccc(OC)cc1OC	BroadT	BRD-A93004034	BRD-A93004034-001-06-4	Asinex Ltd.	BAS 07093388			CCCc1n[nH]c2OC(N)=C(C#N)C(c12)c1ccc(OC)cc1OC	InChI=1S/C18H20N4O3/c1-4-5-13-16-15(11-7-6-10(23-2)8-14(11)24-3)12(9-19)17(20)25-18(16)22-21-13/h6-8,15H,4-5,20H2,1-3H3,(H,21,22)	BDGSLSCWWPISTB-UHFFFAOYSA-N	340.15354054							
ST50894093	LSM-26443	SID24792408, BRD-K29581056	2965497	InChI=1S/C25H21BrN4O3S/c26-18-9-10-22-20(16-18)21(17-24(28-22)23-8-4-5-11-27-23)25(31)29-12-14-30(15-13-29)34(32,33)19-6-2-1-3-7-19/h1-11,16-17H,12-15H2	ZQPCEFWSXOJISA-UHFFFAOYSA-N	Brc1ccc2nc(cc(C(=O)N3CCN(CC3)S(=O)(=O)c4ccccc4)c2c1)c5ccccn5	BroadT	BRD-K29581056	BRD-K29581056-001-05-3	ChemBridge Corporation	7922509			Brc1ccc2nc(cc(C(=O)N3CCN(CC3)S(=O)(=O)c3ccccc3)c2c1)-c1ccccn1	InChI=1S/C25H21BrN4O3S/c26-18-9-10-22-20(16-18)21(17-24(28-22)23-8-4-5-11-27-23)25(31)29-12-14-30(15-13-29)34(32,33)19-6-2-1-3-7-19/h1-11,16-17H,12-15H2	ZQPCEFWSXOJISA-UHFFFAOYSA-N	536.051773862							114981
T5864878	LSM-26444	SID22404572, BRD-K60500314	852879	InChI=1S/C17H16ClNO3/c18-13-10-15-16(22-9-8-21-15)11-14(13)19-17(20)7-6-12-4-2-1-3-5-12/h1-5,10-11H,6-9H2,(H,19,20)	LQKZLYZBKGTRSC-UHFFFAOYSA-N	Clc1cc2OCCOc2cc1NC(=O)CCc3ccccc3	BroadT	BRD-K60500314	BRD-K60500314-001-05-1	Specs	AR-378/42655251			Clc1cc2OCCOc2cc1NC(=O)CCc1ccccc1	InChI=1S/C17H16ClNO3/c18-13-10-15-16(22-9-8-21-15)11-14(13)19-17(20)7-6-12-4-2-1-3-5-12/h1-5,10-11H,6-9H2,(H,19,20)	LQKZLYZBKGTRSC-UHFFFAOYSA-N	317.081871092							114982
SMR000149104	LSM-26445	SID14741664, BRD-A96972925	4266456	InChI=1S/C27H26N4O2/c28-26-24-23(20-7-2-1-3-8-20)22-11-10-19-6-4-5-9-21(19)25(22)33-27(24)29-18-31(26)13-12-30-14-16-32-17-15-30/h1-11,18,23,28H,12-17H2	PIJBYDDOCXHZFH-UHFFFAOYSA-N	N=C1N(CCN2CCOCC2)C=NC3=C1C(c4ccccc4)c5ccc6ccccc6c5O3	BroadT	BRD-A96972925	BRD-A96972925-001-06-1	InterBioScreen Ltd.	STOCK4S-80955			N=c1c2C(c3ccccc3)c3ccc4ccccc4c3Oc2ncn1CCN1CCOCC1	InChI=1S/C27H26N4O2/c28-26-24-23(20-7-2-1-3-8-20)22-11-10-19-6-4-5-9-21(19)25(22)33-27(24)29-18-31(26)13-12-30-14-16-32-17-15-30/h1-11,18,23,28H,12-17H2	PIJBYDDOCXHZFH-UHFFFAOYSA-N	438.205576112							114983
2-Amino-6-ethyl-8-(4-methoxybenzyl)-4-(4-methoxyphenyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile	LSM-26446	SID17401372, BRD-A12306934	3293213	InChI=1S/C26H27N3O3/c1-4-29-15-19(13-17-5-9-20(30-2)10-6-17)25-23(16-29)24(22(14-27)26(28)32-25)18-7-11-21(31-3)12-8-18/h5-12,15,24H,4,13,16,28H2,1-3H3	LSLYBGCMZYXURD-UHFFFAOYSA-N	CCN1CC2=C(OC(=C(C#N)C2c3ccc(OC)cc3)N)C(=C1)Cc4ccc(OC)cc4	BroadT	BRD-A12306934	BRD-A12306934-001-05-4	Specs	AK-968/12097062			CCN1CC2=C(OC(N)=C(C#N)C2c2ccc(OC)cc2)C(Cc2ccc(OC)cc2)=C1	InChI=1S/C26H27N3O3/c1-4-29-15-19(13-17-5-9-20(30-2)10-6-17)25-23(16-29)24(22(14-27)26(28)32-25)18-7-11-21(31-3)12-8-18/h5-12,15,24H,4,13,16,28H2,1-3H3	LSLYBGCMZYXURD-UHFFFAOYSA-N	429.205241754							114984
MLS000082585	LSM-26447	SID863559, BRD-K67844479	664810	InChI=1S/C21H25N3O3S3/c1-12(2)29-20-23-18(28-11-16(25)22-9-13-6-5-7-26-13)17-14-8-21(3,4)27-10-15(14)30-19(17)24-20/h5-7,12H,8-11H2,1-4H3,(H,22,25)	XRTAWJHHBGVNEE-UHFFFAOYSA-N	CC(C)Sc1nc(SCC(=O)NCc2occc2)c3c4CC(C)(C)OCc4sc3n1	BroadT	BRD-K67844479	BRD-K67844479-001-07-3	InterBioScreen Ltd.	STOCK4S-78022			CC(C)Sc1nc(SCC(=O)NCc2ccco2)c2c3CC(C)(C)OCc3sc2n1	InChI=1S/C21H25N3O3S3/c1-12(2)29-20-23-18(28-11-16(25)22-9-13-6-5-7-26-13)17-14-8-21(3,4)27-10-15(14)30-19(17)24-20/h5-7,12H,8-11H2,1-4H3,(H,22,25)	XRTAWJHHBGVNEE-UHFFFAOYSA-N	463.10580376							114985
ZINC04423993	LSM-15225	BRD-K38436437	5169910	InChI=1S/C19H19N5OS/c1-2-3-18(25)22-16-6-4-15(5-7-16)17-13-26-19(23-17)24-21-12-14-8-10-20-11-9-14/h4-13H,2-3H2,1H3,(H,22,25)(H,23,24)	ODQKSIYNQROGSR-UHFFFAOYSA-N	CCCC(=O)Nc1ccc(cc1)c2csc(NN=Cc3ccncc3)n2	BroadT	BRD-K38436437	BRD-K38436437-004-05-3	InterBioScreen Ltd.	STOCK3S-42333		Br	CCCC(=O)Nc1ccc(cc1)-c1csc(NN=Cc2ccncc2)n1.Br	InChI=1S/C19H19N5OS.BrH/c1-2-3-18(25)22-16-6-4-15(5-7-16)17-13-26-19(23-17)24-21-12-14-8-10-20-11-9-14;/h4-13H,2-3H2,1H3,(H,22,25)(H,23,24);1H	GFTJPDIIBWKVHE-UHFFFAOYSA-N	365.131030968							103872
SMR000002372	LSM-26448	SID842881, BRD-K78920481	645157	InChI=1S/C21H23N3O4S/c1-14-5-4-6-16(11-14)20-23-24-21(28-20)29-13-19(25)22-10-9-15-7-8-17(26-2)18(12-15)27-3/h4-8,11-12H,9-10,13H2,1-3H3,(H,22,25)	JDSTZSYKWPWHOA-UHFFFAOYSA-N	COc1ccc(CCNC(=O)CSc2oc(nn2)c3cccc(C)c3)cc1OC	BroadT	BRD-K78920481	BRD-K78920481-001-05-8	Asinex Ltd.	ASN 03574600			COc1ccc(CCNC(=O)CSc2nnc(o2)-c2cccc(C)c2)cc1OC	InChI=1S/C21H23N3O4S/c1-14-5-4-6-16(11-14)20-23-24-21(28-20)29-13-19(25)22-10-9-15-7-8-17(26-2)18(12-15)27-3/h4-8,11-12H,9-10,13H2,1-3H3,(H,22,25)	JDSTZSYKWPWHOA-UHFFFAOYSA-N	413.140926936							114986
STK285267	LSM-26449	SID853110, BRD-K87234097	655762	InChI=1S/C19H19N3O5/c1-12-8-13(11-26-2)15(9-20)18(24)22(12)10-17(23)21-16-7-5-4-6-14(16)19(25)27-3/h4-8H,10-11H2,1-3H3,(H,21,23)	NRNTXYRVKCFNDU-UHFFFAOYSA-N	COCC1=C(C#N)C(=O)N(CC(=O)Nc2ccccc2C(=O)OC)C(=C1)C	BroadT	BRD-K87234097	BRD-K87234097-001-05-9	Asinex Ltd.	BAS 07787165			COCc1cc(C)n(CC(=O)Nc2ccccc2C(=O)OC)c(=O)c1C#N	InChI=1S/C19H19N3O5/c1-12-8-13(11-26-2)15(9-20)18(24)22(12)10-17(23)21-16-7-5-4-6-14(16)19(25)27-3/h4-8H,10-11H2,1-3H3,(H,21,23)	NRNTXYRVKCFNDU-UHFFFAOYSA-N	369.132470738							114987
MLS000713793	LSM-26450	SID24822580, BRD-A34301196	2830008	InChI=1S/C17H13Cl3N4O5S/c18-17(19,20)15(22-13(25)9-3-2-6-12(8-9)24(28)29)23-16(30)21-11-5-1-4-10(7-11)14(26)27/h1-8,15H,(H,22,25)(H,26,27)(H2,21,23,30)	GPWHVVCHKQBJTJ-UHFFFAOYSA-N	OC(=O)c1cccc(NC(=NC(NC(=O)c2cccc(c2)[N+](=O)[O-])C(Cl)(Cl)Cl)S)c1	BroadT	BRD-A34301196	BRD-A34301196-001-05-2	Asinex Ltd.	BAS 00775854			OC(=O)c1cccc(NC(S)=NC(NC(=O)c2cccc(c2)[N+]([O-])=O)C(Cl)(Cl)Cl)c1	InChI=1S/C17H13Cl3N4O5S/c18-17(19,20)15(22-13(25)9-3-2-6-12(8-9)24(28)29)23-16(30)21-11-5-1-4-10(7-11)14(26)27/h1-8,15H,(H,22,25)(H,26,27)(H2,21,23,30)	GPWHVVCHKQBJTJ-UHFFFAOYSA-N	489.967223376							114988
AO-365/43113280	LSM-26451	SID4258376, BRD-K70891549	2228668	InChI=1S/C17H13BrN4OS/c1-23-12-8-6-11(7-9-12)10-15-21-22-16(19-20-17(22)24-15)13-4-2-3-5-14(13)18/h2-9H,10H2,1H3	HIEBWMWHUYJLPK-UHFFFAOYSA-N	COc1ccc(Cc2nn3c(nnc3s2)c4ccccc4Br)cc1	BroadT	BRD-K70891549	BRD-K70891549-001-07-5	ChemBridge Corporation	7957358			COc1ccc(Cc2nn3c(nnc3s2)-c2ccccc2Br)cc1	InChI=1S/C17H13BrN4OS/c1-23-12-8-6-11(7-9-12)10-15-21-22-16(19-20-17(22)24-15)13-4-2-3-5-14(13)18/h2-9H,10H2,1H3	HIEBWMWHUYJLPK-UHFFFAOYSA-N	399.999344366							114989
BRD-A34862016	LSM-26452			InChI=1S/C23H26N2O5/c1-5-13-29-17-8-6-7-16(14-17)20-19(21(26)18-10-9-15(2)30-18)22(27)23(28)25(20)12-11-24(3)4/h5-10,14,19-20H,1,11-13H2,2-4H3	MPEUEANVNUIUKW-UHFFFAOYSA-N	CN(C)CCN1C(C(C(=O)c2oc(C)cc2)C(=O)C1=O)c3cccc(OCC=C)c3	BroadT	BRD-A34862016	BRD-A34862016-001-04-4	Asinex Ltd.	BAS 06487594			CN(C)CCN1C(C(C(=O)c2ccc(C)o2)C(=O)C1=O)c1cccc(OCC=C)c1	InChI=1S/C23H26N2O5/c1-5-13-29-17-8-6-7-16(14-17)20-19(21(26)18-10-9-15(2)30-18)22(27)23(28)25(20)12-11-24(3)4/h5-10,14,19-20H,1,11-13H2,2-4H3	MPEUEANVNUIUKW-UHFFFAOYSA-N	410.184171952							114990
MLS000703724	LSM-26453	SID24784584, BRD-K08396981	3127906	InChI=1S/C18H22N2O6S/c1-5-25-17(21)15(18(22)26-6-2)9-12-11-19-16-8-7-13(10-14(12)16)27(23,24)20(3)4/h7-11,19H,5-6H2,1-4H3	LXEGLNQYFVTKMV-UHFFFAOYSA-N	CCOC(=O)C(=Cc1c[nH]c2ccc(cc12)S(=O)(=O)N(C)C)C(=O)OCC	BroadT	BRD-K08396981	BRD-K08396981-001-06-9	Asinex Ltd.	BAS 01217150			CCOC(=O)C(=Cc1c[nH]c2ccc(cc12)S(=O)(=O)N(C)C)C(=O)OCC	InChI=1S/C18H22N2O6S/c1-5-25-17(21)15(18(22)26-6-2)9-12-11-19-16-8-7-13(10-14(12)16)27(23,24)20(3)4/h7-11,19H,5-6H2,1-4H3	LXEGLNQYFVTKMV-UHFFFAOYSA-N	394.119857134							114991
SMR000067195	LSM-26454	SID3714914, BRD-K53643756	2999008	InChI=1S/C18H18N2O4S3/c21-18(24-12-16-19-14-4-1-2-5-15(14)26-16)13-7-9-20(10-8-13)27(22,23)17-6-3-11-25-17/h1-6,11,13H,7-10,12H2	CPHJAJTTZNNUSO-UHFFFAOYSA-N	O=C(OCc1nc2ccccc2s1)C3CCN(CC3)S(=O)(=O)c4cccs4	BroadT	BRD-K53643756	BRD-K53643756-001-05-3	Enamine Ltd.	T5257127			O=C(OCc1nc2ccccc2s1)C1CCN(CC1)S(=O)(=O)c1cccs1	InChI=1S/C18H18N2O4S3/c21-18(24-12-16-19-14-4-1-2-5-15(14)26-16)13-7-9-20(10-8-13)27(22,23)17-6-3-11-25-17/h1-6,11,13H,7-10,12H2	CPHJAJTTZNNUSO-UHFFFAOYSA-N	422.042869146							114992
MLS000588157	LSM-44178	SID17513698, BRD-K50993082	1399275	InChI=1S/C20H23N3O2S/c1-3-9-22-11-5-6-15-12-14(7-8-17(15)22)13-16-18(24)21-20(26)23(10-4-2)19(16)25/h4,7-8,12-13H,2-3,5-6,9-11H2,1H3,(H,21,24,26)/b16-13+	CBVRNKHUXZRTLB-DTQAZKPQSA-N	CCCN1CCCc2cc(\C=C\3/C(=O)NC(=S)N(CC=C)C3=O)ccc12	BroadT	BRD-K50993082	BRD-K50993082-001-05-0	InterBioScreen Ltd.	STOCK4S-77540			CCCN1CCCc2cc(\C=C3/C(=O)NC(=S)N(CC=C)C3=O)ccc12	InChI=1S/C20H23N3O2S/c1-3-9-22-11-5-6-15-12-14(7-8-17(15)22)13-16-18(24)21-20(26)23(10-4-2)19(16)25/h4,7-8,12-13H,2-3,5-6,9-11H2,1H3,(H,21,24,26)/b16-13+	CBVRNKHUXZRTLB-DTQAZKPQSA-N	369.151097696							
MLS000081670	LSM-26456	SID3716387, BRD-A49987716	2999584	InChI=1S/C19H18N2O3/c22-19(20-12-13-5-3-9-23-13)15-11-17(18-8-4-10-24-18)21-16-7-2-1-6-14(15)16/h1-2,4,6-8,10-11,13H,3,5,9,12H2,(H,20,22)	UCXSQRYCERRUHA-UHFFFAOYSA-N	O=C(NCC1CCCO1)c2cc(nc3ccccc23)c4occc4	BroadT	BRD-A49987716	BRD-A49987716-001-05-2	Enamine Ltd.	T0516-5605			O=C(NCC1CCCO1)c1cc(nc2ccccc12)-c1ccco1	InChI=1S/C19H18N2O3/c22-19(20-12-13-5-3-9-23-13)15-11-17(18-8-4-10-24-18)21-16-7-2-1-6-14(15)16/h1-2,4,6-8,10-11,13H,3,5,9,12H2,(H,20,22)	UCXSQRYCERRUHA-UHFFFAOYSA-N	322.131742456							114994
AC1OBON9	LSM-44179	BRD-K94506757	6882390	InChI=1S/C19H19N3O5/c1-27-16-7-2-13(3-8-16)4-9-18(25)20-12-19(26)22-21-11-14-5-6-15(23)10-17(14)24/h2-11,23-24H,12H2,1H3,(H,20,25)(H,22,26)/b9-4-,21-11?	JUEWNXRUTKPSTG-YDLCSXQRSA-N	COc1ccc(\C=C/C(=O)NCC(=O)NN=Cc2ccc(O)cc2O)cc1	BroadT	BRD-K94506757	BRD-K94506757-001-05-2	InterBioScreen Ltd.	STOCK1S-72027			COc1ccc(cc1)\C=C/C(=O)NCC(=O)NN=Cc1ccc(O)cc1O	InChI=1S/C19H19N3O5/c1-27-16-7-2-13(3-8-16)4-9-18(25)20-12-19(26)22-21-11-14-5-6-15(23)10-17(14)24/h2-11,23-24H,12H2,1H3,(H,20,25)(H,22,26)/b9-4-,21-11?	JUEWNXRUTKPSTG-YDLCSXQRSA-N	369.132470738							
MLS000071813	LSM-26458	SID846156, BRD-K96923443	54676687	InChI=1S/C19H19N3O3/c1-2-11-22-15-6-4-3-5-14(15)17(23)16(19(22)25)18(24)21-12-13-7-9-20-10-8-13/h3-10,23H,2,11-12H2,1H3,(H,21,24)	MNQQZTMIQNSOBI-UHFFFAOYSA-N	CCCN1C(=O)C(=C(O)c2ccccc12)C(=O)NCc3ccncc3	BroadT	BRD-K96923443	BRD-K96923443-001-05-7	Asinex Ltd.	BAS 00364025			CCCn1c2ccccc2c(O)c(C(=O)NCc2ccncc2)c1=O	InChI=1S/C19H19N3O3/c1-2-11-22-15-6-4-3-5-14(15)17(23)16(19(22)25)18(24)21-12-13-7-9-20-10-8-13/h3-10,23H,2,11-12H2,1H3,(H,21,24)	MNQQZTMIQNSOBI-UHFFFAOYSA-N	337.142641498							114996
AC1LRKPS	LSM-44180	BRD-K83654012	1398685	InChI=1S/C17H17BrN6O3/c1-23-14-13(15(26)21-17(23)27)24(7-8-25)16(20-14)22-19-10-12(18)9-11-5-3-2-4-6-11/h2-6,9-10,25H,7-8H2,1H3,(H,20,22)(H,21,26,27)/b12-9-,19-10?	INGKAJAMJPKWNA-MXLXCKMSSA-N	CN1C(=O)NC(=O)c2c1nc(NN=C\C(=C\c3ccccc3)\Br)n2CCO	BroadT	BRD-K83654012	BRD-K83654012-001-06-2	InterBioScreen Ltd.	STOCK4S-61352			Cn1c2nc(NN=C\C(Br)=C\c3ccccc3)n(CCO)c2c(=O)[nH]c1=O	InChI=1S/C17H17BrN6O3/c1-23-14-13(15(26)21-17(23)27)24(7-8-25)16(20-14)22-19-10-12(18)9-11-5-3-2-4-6-11/h2-6,9-10,25H,7-8H2,1H3,(H,20,22)(H,21,26,27)/b12-9-,19-10?	INGKAJAMJPKWNA-MXLXCKMSSA-N	432.054551064							
MLS000862116	LSM-26460	SID26668938, SID4265472, BRD-K61168850	980267	InChI=1S/C22H23ClN4O2S/c1-2-27-21(29)18-5-3-4-6-19(18)24-22(27)30-15-20(28)26-13-11-25(12-14-26)17-9-7-16(23)8-10-17/h3-10H,2,11-15H2,1H3	UOHJTTYUBKMUAQ-UHFFFAOYSA-N	CCN1C(=O)c2ccccc2N=C1SCC(=O)N3CCN(CC3)c4ccc(Cl)cc4	BroadT	BRD-K61168850	BRD-K61168850-001-05-6	ChemBridge Corporation	7759197			CCn1c(SCC(=O)N2CCN(CC2)c2ccc(Cl)cc2)nc2ccccc2c1=O	InChI=1S/C22H23ClN4O2S/c1-2-27-21(29)18-5-3-4-6-19(18)24-22(27)30-15-20(28)26-13-11-25(12-14-26)17-9-7-16(23)8-10-17/h3-10H,2,11-15H2,1H3	UOHJTTYUBKMUAQ-UHFFFAOYSA-N	442.123024416							114998
AC1LJNKF	LSM-26461	SID49642770, BRD-K43032805	1003502	InChI=1S/C22H23NO5/c1-28-14-10-8-13(9-11-14)20-21-15(4-2-6-17(21)24)23(12-19(26)27)16-5-3-7-18(25)22(16)20/h8-11,20H,2-7,12H2,1H3,(H,26,27)	ZEKRPRCRYHOKQK-UHFFFAOYSA-N	COc1ccc(cc1)C2C3=C(CCCC3=O)N(CC(=O)O)C4=C2C(=O)CCC4	BroadT	BRD-K43032805	BRD-K43032805-001-05-3	Asinex Ltd.	BAS 03135086			COc1ccc(cc1)C1C2=C(CCCC2=O)N(CC(O)=O)C2=C1C(=O)CCC2	InChI=1S/C22H23NO5/c1-28-14-10-8-13(9-11-14)20-21-15(4-2-6-17(21)24)23(12-19(26)27)16-5-3-7-18(25)22(16)20/h8-11,20H,2-7,12H2,1H3,(H,26,27)	ZEKRPRCRYHOKQK-UHFFFAOYSA-N	381.157622846							114999
AC1NALDF	LSM-26462	BRD-K20626553	4428751	InChI=1S/C20H17N5O2S2/c21-29(26,27)18-10-8-16(9-11-18)23-22-13-15-14-25(17-5-2-1-3-6-17)24-20(15)19-7-4-12-28-19/h1-14,23H,(H2,21,26,27)	FIUOGNMGXXVDTP-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(NN=Cc2cn(nc2c3cccs3)c4ccccc4)cc1	BroadT	BRD-K20626553	BRD-K20626553-001-06-1	Enamine Ltd.	T0514-2797			NS(=O)(=O)c1ccc(NN=Cc2cn(nc2-c2cccs2)-c2ccccc2)cc1	InChI=1S/C20H17N5O2S2/c21-29(26,27)18-10-8-16(9-11-18)23-22-13-15-14-25(17-5-2-1-3-6-17)24-20(15)19-7-4-12-28-19/h1-14,23H,(H2,21,26,27)	FIUOGNMGXXVDTP-UHFFFAOYSA-N	423.082366214							115000
AC1NSJLT	LSM-26463	SID7977219, BRD-K69047074	5310873	InChI=1S/C19H25N3O4/c1-5-14-7-9-15(10-8-14)26-12-6-11-20-13(2)16-17(23)21(3)19(25)22(4)18(16)24/h7-10,20H,5-6,11-12H2,1-4H3	ZGCQRYAOMLBSQR-UHFFFAOYSA-N	CCc1ccc(OCCCNC(=C2C(=O)N(C)C(=O)N(C)C2=O)C)cc1	BroadT	BRD-K69047074	BRD-K69047074-001-05-4	ChemBridge Corporation	5241053			CCc1ccc(OCCCNC(C)=C2C(=O)N(C)C(=O)N(C)C2=O)cc1	InChI=1S/C19H25N3O4/c1-5-14-7-9-15(10-8-14)26-12-6-11-20-13(2)16-17(23)21(3)19(25)22(4)18(16)24/h7-10,20H,5-6,11-12H2,1-4H3	ZGCQRYAOMLBSQR-UHFFFAOYSA-N	359.18450631							115001
BAS 08315370	LSM-26464	SID846259, BRD-K42448167	648645	InChI=1S/C17H17N3O3/c1-4-22-14-8-6-5-7-12(14)17-19-15(20-23-17)13-10-9-11(2)18-16(13)21-3/h5-10H,4H2,1-3H3	GMNZZFOHRVUORQ-UHFFFAOYSA-N	CCOc1ccccc1c2onc(n2)c3ccc(C)nc3OC	BroadT	BRD-K42448167	BRD-K42448167-001-06-2	Asinex Ltd.	BAS 08315370			CCOc1ccccc1-c1nc(no1)-c1ccc(C)nc1OC	InChI=1S/C17H17N3O3/c1-4-22-14-8-6-5-7-12(14)17-19-15(20-23-17)13-10-9-11(2)18-16(13)21-3/h5-10H,4H2,1-3H3	GMNZZFOHRVUORQ-UHFFFAOYSA-N	311.126991434							115002
AC1LOW87	LSM-26465	SID4264063, BRD-K98248857	1248857	InChI=1S/C16H14N6OS2/c1-22-15(13-3-2-6-24-13)20-21-16(22)25-9-14(23)18-11-5-4-10-8-17-19-12(10)7-11/h2-8H,9H2,1H3,(H,17,19)(H,18,23)	PHVSJWUJLATVJJ-UHFFFAOYSA-N	Cn1c(SCC(=O)Nc2ccc3c[nH]nc3c2)nnc1c4cccs4	BroadT	BRD-K98248857	BRD-K98248857-001-05-6	ChemBridge Corporation	7911383			Cn1c(SCC(=O)Nc2ccc3c[nH]nc3c2)nnc1-c1cccs1	InChI=1S/C16H14N6OS2/c1-22-15(13-3-2-6-24-13)20-21-16(22)25-9-14(23)18-11-5-4-10-8-17-19-12(10)7-11/h2-8H,9H2,1H3,(H,17,19)(H,18,23)	PHVSJWUJLATVJJ-UHFFFAOYSA-N	370.067050508							115003
SMR000172778	LSM-26466	SID17410568, BRD-K69379911	1172453	InChI=1S/C26H29N3O4S/c1-5-32-23-16-22(29-26(34)27-19-8-7-9-20(14-19)31-4)24(33-6-2)15-21(23)28-25(30)18-12-10-17(3)11-13-18/h7-16H,5-6H2,1-4H3,(H,28,30)(H2,27,29,34)	PAIZXMTYRRASII-UHFFFAOYSA-N	CCOc1cc(N=C(S)Nc2cccc(OC)c2)c(OCC)cc1NC(=O)c3ccc(C)cc3	BroadT	BRD-K69379911	BRD-K69379911-001-05-8	Asinex Ltd.	ASN 04375333			CCOc1cc(N=C(S)Nc2cccc(OC)c2)c(OCC)cc1NC(=O)c1ccc(C)cc1	InChI=1S/C26H29N3O4S/c1-5-32-23-16-22(29-26(34)27-19-8-7-9-20(14-19)31-4)24(33-6-2)15-21(23)28-25(30)18-12-10-17(3)11-13-18/h7-16H,5-6H2,1-4H3,(H,28,30)(H2,27,29,34)	PAIZXMTYRRASII-UHFFFAOYSA-N	479.187877128							115004
SMR000174586	LSM-26467	SID17408569, BRD-A36541729	2833596	InChI=1S/C24H21N3O2S/c1-17-9-8-14-20(15-17)27-22(28)16-21(23(27)29)30-24(25-18-10-4-2-5-11-18)26-19-12-6-3-7-13-19/h2-15,21H,16H2,1H3,(H,25,26)	GPPXCGOIFIIHAR-UHFFFAOYSA-N	Cc1cccc(c1)N2C(=O)CC(SC(=Nc3ccccc3)Nc4ccccc4)C2=O	BroadT	BRD-A36541729	BRD-A36541729-001-05-7	Asinex Ltd.	BAS 00345431			Cc1cccc(c1)N1C(=O)CC(SC(Nc2ccccc2)=Nc2ccccc2)C1=O	InChI=1S/C24H21N3O2S/c1-17-9-8-14-20(15-17)27-22(28)16-21(23(27)29)30-24(25-18-10-4-2-5-11-18)26-19-12-6-3-7-13-19/h2-15,21H,16H2,1H3,(H,25,26)	GPPXCGOIFIIHAR-UHFFFAOYSA-N	415.135447632							115005
SMR000062795	LSM-26468	SID3711687, BRD-K11819200	2431072	InChI=1S/C12H15NO4S/c1-9-2-7-18-11(9)12(15)17-8-10(14)13-3-5-16-6-4-13/h2,7H,3-6,8H2,1H3	HSBGEASFQTWFHZ-UHFFFAOYSA-N	Cc1ccsc1C(=O)OCC(=O)N2CCOCC2	BroadT	BRD-K11819200	BRD-K11819200-001-05-2	Enamine Ltd.	T0516-1132			Cc1ccsc1C(=O)OCC(=O)N1CCOCC1	InChI=1S/C12H15NO4S/c1-9-2-7-18-11(9)12(15)17-8-10(14)13-3-5-16-6-4-13/h2,7H,3-6,8H2,1H3	HSBGEASFQTWFHZ-UHFFFAOYSA-N	269.07217866							115006
SMR000123896	LSM-26469	SID14722712, BRD-K11018825	3194161	InChI=1S/C28H28N2O5/c1-4-35-24-11-7-20(8-12-24)28(32)30(17-19-5-9-23(33-2)10-6-19)18-22-15-21-16-25(34-3)13-14-26(21)29-27(22)31/h5-16H,4,17-18H2,1-3H3,(H,29,31)	MLAUSULBYMVQSR-UHFFFAOYSA-N	CCOc1ccc(cc1)C(=O)N(Cc2ccc(OC)cc2)Cc3cc4cc(OC)ccc4nc3O	BroadT	BRD-K11018825	BRD-K11018825-001-05-6	Asinex Ltd.	ASN 05107863			CCOc1ccc(cc1)C(=O)N(Cc1ccc(OC)cc1)Cc1cc2cc(OC)ccc2nc1O	InChI=1S/C28H28N2O5/c1-4-35-24-11-7-20(8-12-24)28(32)30(17-19-5-9-23(33-2)10-6-19)18-22-15-21-16-25(34-3)13-14-26(21)29-27(22)31/h5-16H,4,17-18H2,1-3H3,(H,29,31)	MLAUSULBYMVQSR-UHFFFAOYSA-N	472.199822016							115007
T5265259	LSM-26470	SID3711862, BRD-K02043783	2088448	InChI=1S/C20H19NO2/c1-2-14-7-8-17-16(12-20(22)23-19(17)11-14)13-21-10-9-15-5-3-4-6-18(15)21/h3-8,11-12H,2,9-10,13H2,1H3	JBYKGYAXBSYBJB-UHFFFAOYSA-N	CCc1ccc2C(=CC(=O)Oc2c1)CN3CCc4ccccc34	BroadT	BRD-K02043783	BRD-K02043783-001-05-5	Enamine Ltd.	T5265259			CCc1ccc2c(CN3CCc4ccccc34)cc(=O)oc2c1	InChI=1S/C20H19NO2/c1-2-14-7-8-17-16(12-20(22)23-19(17)11-14)13-21-10-9-15-5-3-4-6-18(15)21/h3-8,11-12H,2,9-10,13H2,1H3	JBYKGYAXBSYBJB-UHFFFAOYSA-N	305.141578858							115008
ST037131	LSM-26471	SID3713868, BRD-A87899349	2998573	InChI=1S/C17H19N3O3/c1-11-9-20(10-12(2)23-11)17(22)14-6-4-3-5-13(14)15(21)16-18-7-8-19-16/h3-8,11-12H,9-10H2,1-2H3,(H,18,19)	LDNSQXWWNOUSSN-UHFFFAOYSA-N	CC1CN(CC(C)O1)C(=O)c2ccccc2C(=O)c3ncc[nH]3	BroadT	BRD-A87899349	BRD-A87899349-001-05-7	Enamine Ltd.	T0504-1717			CC1CN(CC(C)O1)C(=O)c1ccccc1C(=O)c1ncc[nH]1	InChI=1S/C17H19N3O3/c1-11-9-20(10-12(2)23-11)17(22)14-6-4-3-5-13(14)15(21)16-18-7-8-19-16/h3-8,11-12H,9-10H2,1-2H3,(H,18,19)	LDNSQXWWNOUSSN-UHFFFAOYSA-N	313.142641498							115009
MLS000041502	LSM-44181	SID861959, BRD-K51475173	5389663	InChI=1S/C18H21N3O5/c1-5-6-21-17(23)15(16(22)20-18(21)24)11(2)19-10-12-7-13(25-3)9-14(8-12)26-4/h5,7-9,19H,1,6,10H2,2-4H3,(H,20,22,24)/b15-11+	AHTJFPVCZKLMIE-RVDMUPIBSA-N	COc1cc(CN\C(=C\2/C(=O)NC(=O)N(CC=C)C2=O)\C)cc(OC)c1	BroadT	BRD-K51475173	BRD-K51475173-001-05-7	InterBioScreen Ltd.	STOCK4S-26554			COc1cc(CN\C(C)=C2/C(=O)NC(=O)N(CC=C)C2=O)cc(OC)c1	InChI=1S/C18H21N3O5/c1-5-6-21-17(23)15(16(22)20-18(21)24)11(2)19-10-12-7-13(25-3)9-14(8-12)26-4/h5,7-9,19H,1,6,10H2,2-4H3,(H,20,22,24)/b15-11+	AHTJFPVCZKLMIE-RVDMUPIBSA-N	359.148120802							
STK248490	LSM-26473	SID851082, BRD-K68338279	653643	InChI=1S/C10H11N5O/c1-7-3-5-8(6-4-7)9(16)11-10-12-14-15(2)13-10/h3-6H,1-2H3,(H,11,13,16)	BCTCBVIEXIJXAF-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)Nc2nnn(C)n2	BroadT	BRD-K68338279	BRD-K68338279-001-05-1	Asinex Ltd.	BAS 07005707			Cc1ccc(cc1)C(=O)Nc1nnn(C)n1	InChI=1S/C10H11N5O/c1-7-3-5-8(6-4-7)9(16)11-10-12-14-15(2)13-10/h3-6H,1-2H3,(H,11,13,16)	BCTCBVIEXIJXAF-UHFFFAOYSA-N	217.096360022							115011
N-[(3-Cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide	LSM-26474	SID17503765, BRD-A28335000	4263716	InChI=1S/C22H20N4O2S2/c1-12-8-9-15-16(11-23)21(30-17(15)10-12)25-22(29)24-20(27)18-13(2)28-26-19(18)14-6-4-3-5-7-14/h3-7,12H,8-10H2,1-2H3,(H2,24,25,27,29)	YHHQZLFZISHRPF-UHFFFAOYSA-N	CC1CCc2c(C1)sc(NC(=S)NC(=O)c3c(C)onc3c4ccccc4)c2C#N	BroadT	BRD-A28335000	BRD-A28335000-001-05-4	InterBioScreen Ltd.	STOCK3S-64199			CC1CCc2c(C1)sc(NC(=S)NC(=O)c1c(C)onc1-c1ccccc1)c2C#N	InChI=1S/C22H20N4O2S2/c1-12-8-9-15-16(11-23)21(30-17(15)10-12)25-22(29)24-20(27)18-13(2)28-26-19(18)14-6-4-3-5-7-14/h3-7,12H,8-10H2,1-2H3,(H2,24,25,27,29)	YHHQZLFZISHRPF-UHFFFAOYSA-N	436.1027673							115012
SMR000025400	LSM-26475	SID4243140, BRD-K54089330	3237901	InChI=1S/C18H23N3O/c22-18(19-11-6-14-21-12-3-4-13-21)20-17-10-5-8-15-7-1-2-9-16(15)17/h1-2,5,7-10H,3-4,6,11-14H2,(H2,19,20,22)	MHJAJFKAOWXGFR-UHFFFAOYSA-N	O=C(NCCCN1CCCC1)Nc2cccc3ccccc23	BroadT	BRD-K54089330	BRD-K54089330-001-06-1	ChemDiv Inc.	C270-0279			O=C(NCCCN1CCCC1)Nc1cccc2ccccc12	InChI=1S/C18H23N3O/c22-18(19-11-6-14-21-12-3-4-13-21)20-17-10-5-8-15-7-1-2-9-16(15)17/h1-2,5,7-10H,3-4,6,11-14H2,(H2,19,20,22)	MHJAJFKAOWXGFR-UHFFFAOYSA-N	297.184112386							115013
8-(Prop-2-ene-1-sulfonyl)-quinoline	LSM-26476	SID24796629, BRD-K80545596	581982	InChI=1S/C12H11NO2S/c1-2-9-16(14,15)11-7-3-5-10-6-4-8-13-12(10)11/h2-8H,1,9H2	ICDCKRMKQIUBNL-UHFFFAOYSA-N	C=CCS(=O)(=O)c1cccc2cccnc12	BroadT	BRD-K80545596	BRD-K80545596-001-05-1	Asinex Ltd.	BAS 04456354			C=CCS(=O)(=O)c1cccc2cccnc12	InChI=1S/C12H11NO2S/c1-2-9-16(14,15)11-7-3-5-10-6-4-8-13-12(10)11/h2-8H,1,9H2	ICDCKRMKQIUBNL-UHFFFAOYSA-N	233.051049292							115014
MLS000065941	LSM-26477	SID4258057, BRD-K37426855	934505	InChI=1S/C13H13N3OS3/c1-18-12-14-13(20-15-12)19-8-11(17)16-7-6-9-4-2-3-5-10(9)16/h2-5H,6-8H2,1H3	AJJCISNFRLJCLL-UHFFFAOYSA-N	CSc1nsc(SCC(=O)N2CCc3ccccc23)n1	BroadT	BRD-K37426855	BRD-K37426855-001-06-2	ChemBridge Corporation	7926790			CSc1nsc(SCC(=O)N2CCc3ccccc23)n1	InChI=1S/C13H13N3OS3/c1-18-12-14-13(20-15-12)19-8-11(17)16-7-6-9-4-2-3-5-10(9)16/h2-5H,6-8H2,1H3	AJJCISNFRLJCLL-UHFFFAOYSA-N	323.022074136							115015
MLS000042493	LSM-26478	SID865897, BRD-A29522922	667155	InChI=1S/C22H21N3O3/c1-14-8-10-16(11-9-14)25-20(27)22(19(26)23-21(25)28)13-15-5-2-3-6-17(15)24-12-4-7-18(22)24/h2-3,5-6,8-11,18H,4,7,12-13H2,1H3,(H,23,26,28)	PTKLITULSWPWCX-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=O)NC(=O)C3(Cc4ccccc4N5CCCC35)C2=O	BroadT	BRD-A29522922	BRD-A29522922-001-06-9	InterBioScreen Ltd.	STOCK5S-54392			Cc1ccc(cc1)N1C(=O)NC(=O)C2(Cc3ccccc3N3CCCC23)C1=O	InChI=1S/C22H21N3O3/c1-14-8-10-16(11-9-14)25-20(27)22(19(26)23-21(25)28)13-15-5-2-3-6-17(15)24-12-4-7-18(22)24/h2-3,5-6,8-11,18H,4,7,12-13H2,1H3,(H,23,26,28)	PTKLITULSWPWCX-UHFFFAOYSA-N	375.158291562							115016
AC1MEZZX	LSM-26479	SID17506507, BRD-A47636648	2886866	InChI=1S/C21H19NO2S/c1-24-19-15-9-8-14-18(19)22-21(23)20(16-10-4-2-5-11-16)25-17-12-6-3-7-13-17/h2-15,20H,1H3,(H,22,23)	GYICFNXDEQEEFQ-UHFFFAOYSA-N	COc1ccccc1NC(=O)C(Sc2ccccc2)c3ccccc3	BroadT	BRD-A47636648	BRD-A47636648-001-05-0	ChemBridge Corporation	6122662			COc1ccccc1NC(=O)C(Sc1ccccc1)c1ccccc1	InChI=1S/C21H19NO2S/c1-24-19-15-9-8-14-18(19)22-21(23)20(16-10-4-2-5-11-16)25-17-12-6-3-7-13-17/h2-15,20H,1H3,(H,22,23)	GYICFNXDEQEEFQ-UHFFFAOYSA-N	349.113649548							115017
MLS000911316	LSM-26480	SID49733433, BRD-K35249847	24793386	InChI=1S/C21H35N5O6/c1-20(2,3)31-14(27)12-24-18(29)16-15(25-13-26-16)17(28)22-10-8-7-9-11-23-19(30)32-21(4,5)6/h13H,7-12H2,1-6H3,(H,22,28)(H,23,30)(H,24,29)(H,25,26)	KCVHFGFPHUIUFI-UHFFFAOYSA-N	CC(C)(C)OC(=O)CNC(=O)c1[nH]cnc1C(=O)NCCCCCNC(=O)OC(C)(C)C	BroadT	BRD-K35249847	BRD-K35249847-001-05-3	University of Tulsa	ILP-II-120 AE05_PA07			CC(C)(C)OC(=O)CNC(=O)c1[nH]cnc1C(=O)NCCCCCNC(=O)OC(C)(C)C	InChI=1S/C21H35N5O6/c1-20(2,3)31-14(27)12-24-18(29)16-15(25-13-26-16)17(28)22-10-8-7-9-11-23-19(30)32-21(4,5)6/h13H,7-12H2,1-6H3,(H,22,28)(H,23,30)(H,24,29)(H,25,26)	KCVHFGFPHUIUFI-UHFFFAOYSA-N	453.25873389							115018
8-Chloro-4-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-5H-pyrimido[5,4-b]indole	LSM-26481	SID17401607, BRD-K79581798	3601679	InChI=1S/C17H17ClN4O2/c18-11-1-2-13-12(9-11)14-15(21-13)16(20-10-19-14)22-5-3-17(4-6-22)23-7-8-24-17/h1-2,9-10,21H,3-8H2	UEXINIASTXLPIV-UHFFFAOYSA-N	Clc1ccc2[nH]c3c(ncnc3c2c1)N4CCC5(CC4)OCCO5	BroadT	BRD-K79581798	BRD-K79581798-001-03-0	InterBioScreen Ltd.	STOCK3S-06994			Clc1ccc2[nH]c3c(ncnc3c2c1)N1CCC2(CC1)OCCO2	InChI=1S/C17H17ClN4O2/c18-11-1-2-13-12(9-11)14-15(21-13)16(20-10-19-14)22-5-3-17(4-6-22)23-7-8-24-17/h1-2,9-10,21H,3-8H2	UEXINIASTXLPIV-UHFFFAOYSA-N	344.104003534							115019
MLS000537201	LSM-26482	SID17386982, BRD-A55959468	11840887	InChI=1S/C17H16N4O3S/c1-9-13(16(22)24-3)14(10-5-4-6-11(7-10)23-2)21-15(19)12(8-18)25-17(21)20-9/h4-7,14H,19H2,1-3H3	ZQVHNYQRPHHVCI-UHFFFAOYSA-N	COC(=O)C1=C(C)N=C2SC(=C(N)N2C1c3cccc(OC)c3)C#N	BroadT	BRD-A55959468	BRD-A55959468-001-07-8	Specs	AO-476/43201327			COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2C1c1cccc(OC)c1	InChI=1S/C17H16N4O3S/c1-9-13(16(22)24-3)14(10-5-4-6-11(7-10)23-2)21-15(19)12(8-18)25-17(21)20-9/h4-7,14H,19H2,1-3H3	ZQVHNYQRPHHVCI-UHFFFAOYSA-N	356.094311102							115020
SMR000013662	LSM-26483	SID844095, BRD-A89219483	646405	InChI=1S/C22H20N4O4S/c23-20-18(31(28,29)16-8-2-1-3-9-16)13-17-21(26(20)14-15-7-6-12-30-15)24-19-10-4-5-11-25(19)22(17)27/h1-5,8-11,13,15,23H,6-7,12,14H2	YOBPVVQQTXGMLH-UHFFFAOYSA-N	N=C1N(CC2CCCO2)C3=C(C=C1S(=O)(=O)c4ccccc4)C(=O)N5C=CC=CC5=N3	BroadT	BRD-A89219483	BRD-A89219483-001-04-5	Asinex Ltd.	BAS 06260825			N=c1c(cc2c(nc3ccccn3c2=O)n1CC1CCCO1)S(=O)(=O)c1ccccc1	InChI=1S/C22H20N4O4S/c23-20-18(31(28,29)16-8-2-1-3-9-16)13-17-21(26(20)14-15-7-6-12-30-15)24-19-10-4-5-11-25(19)22(17)27/h1-5,8-11,13,15,23H,6-7,12,14H2	YOBPVVQQTXGMLH-UHFFFAOYSA-N	436.12052585							115021
SMR000029300	LSM-26484	SID24838451, SID4242345, BRD-K78264606	3237208	InChI=1S/C24H24N4O4S/c1-3-32-24(30)27-12-10-26(11-13-27)22(29)17-6-9-20-21(14-17)33-23-25-19(15-28(20)23)16-4-7-18(31-2)8-5-16/h4-9,14-15H,3,10-13H2,1-2H3	JMNIMECMVSKGKS-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)c2ccc3c(c2)sc4nc(cn34)c5ccc(OC)cc5	BroadT	BRD-K78264606	BRD-K78264606-001-06-9	ChemDiv Inc.	C797-0895			CCOC(=O)N1CCN(CC1)C(=O)c1ccc2c(c1)sc1nc(cn21)-c1ccc(OC)cc1	InChI=1S/C24H24N4O4S/c1-3-32-24(30)27-12-10-26(11-13-27)22(29)17-6-9-20-21(14-17)33-23-25-19(15-28(20)23)16-4-7-18(31-2)8-5-16/h4-9,14-15H,3,10-13H2,1-2H3	JMNIMECMVSKGKS-UHFFFAOYSA-N	464.151825978							115022
N-(4-Butylphenyl)-4-pyrimidin-2-ylpiperazine-1-carbothioamide	LSM-26485	SID24794267, BRD-K96208549	1999953	InChI=1S/C19H25N5S/c1-2-3-5-16-6-8-17(9-7-16)22-19(25)24-14-12-23(13-15-24)18-20-10-4-11-21-18/h4,6-11H,2-3,5,12-15H2,1H3,(H,22,25)	XZAJBIOTSDUBQE-UHFFFAOYSA-N	CCCCc1ccc(NC(=S)N2CCN(CC2)c3ncccn3)cc1	BroadT	BRD-K96208549	BRD-K96208549-001-05-6	ChemBridge Corporation	7666574			CCCCc1ccc(NC(=S)N2CCN(CC2)c2ncccn2)cc1	InChI=1S/C19H25N5S/c1-2-3-5-16-6-8-17(9-7-16)22-19(25)24-14-12-23(13-15-24)18-20-10-4-11-21-18/h4,6-11H,2-3,5,12-15H2,1H3,(H,22,25)	XZAJBIOTSDUBQE-UHFFFAOYSA-N	355.18306654							115023
MLS000545157	LSM-26486	SID17387060, BRD-K32981850	844040	InChI=1S/C11H9N3O4/c1-7-4-5-12-9(6-7)13-11(15)8-2-3-10(18-8)14(16)17/h2-6H,1H3,(H,12,13,15)	NNBAZVUVMQINHE-UHFFFAOYSA-N	Cc1ccnc(NC(=O)c2oc(cc2)[N+](=O)[O-])c1	BroadT	BRD-K32981850	BRD-K32981850-001-06-6	Specs	AG-690/36278007			Cc1ccnc(NC(=O)c2ccc(o2)[N+]([O-])=O)c1	InChI=1S/C11H9N3O4/c1-7-4-5-12-9(6-7)13-11(15)8-2-3-10(18-8)14(16)17/h2-6H,1H3,(H,12,13,15)	NNBAZVUVMQINHE-UHFFFAOYSA-N	247.059305798							115024
STK247631	LSM-26487	SID24789331, BRD-K23401224	1287632	InChI=1S/C20H23N3O2S/c1-14-3-8-18(15(2)13-14)19(24)22-20(26)21-16-4-6-17(7-5-16)23-9-11-25-12-10-23/h3-8,13H,9-12H2,1-2H3,(H2,21,22,24,26)	UGLLLYKVEHVZBC-UHFFFAOYSA-N	Cc1ccc(C(=O)NC(=S)Nc2ccc(cc2)N3CCOCC3)c(C)c1	BroadT	BRD-K23401224	BRD-K23401224-001-05-7	ChemBridge Corporation	7724001			Cc1ccc(C(=O)NC(=S)Nc2ccc(cc2)N2CCOCC2)c(C)c1	InChI=1S/C20H23N3O2S/c1-14-3-8-18(15(2)13-14)19(24)22-20(26)21-16-4-6-17(7-5-16)23-9-11-25-12-10-23/h3-8,13H,9-12H2,1-2H3,(H2,21,22,24,26)	UGLLLYKVEHVZBC-UHFFFAOYSA-N	369.151097696							115025
AMBCB35138818	LSM-26488	SID24780266, BRD-K21817916	16187285	InChI=1S/C16H11ClF2N2O3S/c17-14-5-4-10(25-14)7-20-16(22)13-6-9(24-21-13)8-23-15-11(18)2-1-3-12(15)19/h1-6H,7-8H2,(H,20,22)	QHVKHHNGMOCGQQ-UHFFFAOYSA-N	Fc1cccc(F)c1OCc2onc(c2)C(=O)NCc3ccc(Cl)s3	BroadT	BRD-K21817916	BRD-K21817916-001-05-9	ChemBridge Corporation	35138818			Fc1cccc(F)c1OCc1cc(no1)C(=O)NCc1ccc(Cl)s1	InChI=1S/C16H11ClF2N2O3S/c17-14-5-4-10(25-14)7-20-16(22)13-6-9(24-21-13)8-23-15-11(18)2-1-3-12(15)19/h1-6H,7-8H2,(H,20,22)	QHVKHHNGMOCGQQ-UHFFFAOYSA-N	384.014697032							115026
ZINC00800729	LSM-26489	SID7967311, SID848439, BRD-K53867059	650881	InChI=1S/C17H13ClN4O2S/c1-10-2-4-13-15(6-10)25-17(20-13)21-16(23)14-5-3-12(24-14)9-22-8-11(18)7-19-22/h2-8H,9H2,1H3,(H,20,21,23)	USUXXCCOZZWEJK-UHFFFAOYSA-N	Cc1ccc2nc(NC(=O)c3oc(Cn4cc(Cl)cn4)cc3)sc2c1	BroadT	BRD-K53867059	BRD-K53867059-001-05-2	ChemDiv Inc.	6228-1398			Cc1ccc2nc(NC(=O)c3ccc(Cn4cc(Cl)cn4)o3)sc2c1	InChI=1S/C17H13ClN4O2S/c1-10-2-4-13-15(6-10)25-17(20-13)21-16(23)14-5-3-12(24-14)9-22-8-11(18)7-19-22/h2-8H,9H2,1H3,(H,20,21,23)	USUXXCCOZZWEJK-UHFFFAOYSA-N	372.044774096							115027
MLS000694605	LSM-26490	SID24818347, BRD-K56443686	1478416	InChI=1S/C14H10ClFN4/c15-10-6-4-9(5-7-10)11-8-20(19-14(11)17)13-3-1-2-12(16)18-13/h1-8H,(H2,17,19)	DTVVDWOJSTZXJT-UHFFFAOYSA-N	Nc1nn(cc1c2ccc(Cl)cc2)c3cccc(F)n3	BroadT	BRD-K56443686	BRD-K56443686-001-05-0	Key Organics Ltd.	5.00E-37			Nc1nn(cc1-c1ccc(Cl)cc1)-c1cccc(F)n1	InChI=1S/C14H10ClFN4/c15-10-6-4-9(5-7-10)11-8-20(19-14(11)17)13-3-1-2-12(16)18-13/h1-8H,(H2,17,19)	DTVVDWOJSTZXJT-UHFFFAOYSA-N	288.05780227							115028
MLS000055145	LSM-26491	SID3713199, BRD-K02379202	5394360	InChI=1S/C19H16O6/c1-10-17(11-3-4-14-15(7-11)24-6-2-5-23-14)19(22)18-13(21)8-12(20)9-16(18)25-10/h3-4,7-9,20-21H,2,5-6H2,1H3	LVOYLLOLYGVLEE-UHFFFAOYSA-N	CC1=C(C(=O)c2c(O)cc(O)cc2O1)c3ccc4OCCCOc4c3	BroadT	BRD-K02379202	BRD-K02379202-001-11-4	Enamine Ltd.	T0502-1828			Cc1oc2cc(O)cc(O)c2c(=O)c1-c1ccc2OCCCOc2c1	InChI=1S/C19H16O6/c1-10-17(11-3-4-14-15(7-11)24-6-2-5-23-14)19(22)18-13(21)8-12(20)9-16(18)25-10/h3-4,7-9,20-21H,2,5-6H2,1H3	LVOYLLOLYGVLEE-UHFFFAOYSA-N	340.094688232							115029
1-(4-Amino-1,2,5-oxadiazol-3-yl)-n-[(3-phenylmethoxyphenyl)methylideneamino]-5-propan-2-yltriazole-4-carboxamide	LSM-26492	BRD-K25423143	1992624	InChI=1S/C22H22N8O3/c1-14(2)19-18(25-29-30(19)21-20(23)27-33-28-21)22(31)26-24-12-16-9-6-10-17(11-16)32-13-15-7-4-3-5-8-15/h3-12,14H,13H2,1-2H3,(H2,23,27)(H,26,31)	GLZVHQXXRHVQQB-UHFFFAOYSA-N	CC(C)c1c(nnn1c2nonc2N)C(=O)NN=Cc3cccc(OCc4ccccc4)c3	BroadT	BRD-K25423143	BRD-K25423143-001-06-5	InterBioScreen Ltd.	STOCK4S-26937			CC(C)c1c(nnn1-c1nonc1N)C(=O)NN=Cc1cccc(OCc2ccccc2)c1	InChI=1S/C22H22N8O3/c1-14(2)19-18(25-29-30(19)21-20(23)27-33-28-21)22(31)26-24-12-16-9-6-10-17(11-16)32-13-15-7-4-3-5-8-15/h3-12,14H,13H2,1-2H3,(H2,23,27)(H,26,31)	GLZVHQXXRHVQQB-UHFFFAOYSA-N	446.181486644							115030
ZINC04811314	LSM-44182	SID26663132, BRD-K79005256	1914140	InChI=1S/C18H15NO4/c1-12-16(18(21)22-2)17(20)15(11-14-9-6-10-23-14)19(12)13-7-4-3-5-8-13/h3-11H,1-2H3/b15-11+	XKSZXIXQQVPLER-RVDMUPIBSA-N	COC(=O)C1=C(C)N(\C(=C\c2occc2)\C1=O)c3ccccc3	BroadT	BRD-K79005256	BRD-K79005256-001-06-8	InterBioScreen Ltd.	STOCK2S-42082			COC(=O)C1=C(C)N(\C(=C\c2ccco2)C1=O)c1ccccc1	InChI=1S/C18H15NO4/c1-12-16(18(21)22-2)17(20)15(11-14-9-6-10-23-14)19(12)13-7-4-3-5-8-13/h3-11H,1-2H3/b15-11+	XKSZXIXQQVPLER-RVDMUPIBSA-N	309.10010797							
Benzyl 3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxylate	LSM-26494	SID3716226, BRD-K61488195	2367131	InChI=1S/C16H14N2O3/c19-15-10-18(14-9-5-4-8-13(14)17-15)16(20)21-11-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,19)	XIJVGCYRIIUFKS-UHFFFAOYSA-N	O=C(OCc1ccccc1)N2CC(=O)Nc3ccccc23	BroadT	BRD-K61488195	BRD-K61488195-001-05-2	Enamine Ltd.	T0516-6207			O=C(OCc1ccccc1)N1CC(=O)Nc2ccccc12	InChI=1S/C16H14N2O3/c19-15-10-18(14-9-5-4-8-13(14)17-15)16(20)21-11-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,19)	XIJVGCYRIIUFKS-UHFFFAOYSA-N	282.100442328							115032
SMR000062416	LSM-26495	SID3717835, BRD-K71447090	2394820	InChI=1S/C16H14N2O4S3/c1-25(21,22)10-4-5-11-14(9-10)24-16(17-11)18-15(20)7-6-12(19)13-3-2-8-23-13/h2-5,8-9H,6-7H2,1H3,(H,17,18,20)	SSAYLFVGTIMJLI-UHFFFAOYSA-N	CS(=O)(=O)c1ccc2nc(NC(=O)CCC(=O)c3cccs3)sc2c1	BroadT	BRD-K71447090	BRD-K71447090-001-05-2	Enamine Ltd.	T0514-6272			CS(=O)(=O)c1ccc2nc(NC(=O)CCC(=O)c3cccs3)sc2c1	InChI=1S/C16H14N2O4S3/c1-25(21,22)10-4-5-11-14(9-10)24-16(17-11)18-15(20)7-6-12(19)13-3-2-8-23-13/h2-5,8-9H,6-7H2,1H3,(H,17,18,20)	SSAYLFVGTIMJLI-UHFFFAOYSA-N	394.011569018							115033
MLS000117916	LSM-26496	SID7965899, BRD-A09279836	5307900	InChI=1S/C20H24N6O4S/c1-14-18(20(28)26(24(14)2)16-8-4-3-5-9-16)23-19(27)15-7-6-10-25(12-15)31(29,30)17-11-21-13-22-17/h3-5,8-9,11,13,15H,6-7,10,12H2,1-2H3,(H,21,22)(H,23,27)	CUZDAMPFOBLSFT-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)NC(=O)C2CCCN(C2)S(=O)(=O)c3c[nH]cn3)c4ccccc4	BroadT	BRD-A09279836	BRD-A09279836-001-04-0	ChemDiv Inc.	C548-2308			Cc1c(NC(=O)C2CCCN(C2)S(=O)(=O)c2c[nH]cn2)c(=O)n(-c2ccccc2)n1C	InChI=1S/C20H24N6O4S/c1-14-18(20(28)26(24(14)2)16-8-4-3-5-9-16)23-19(27)15-7-6-10-25(12-15)31(29,30)17-11-21-13-22-17/h3-5,8-9,11,13,15H,6-7,10,12H2,1-2H3,(H,21,22)(H,23,27)	CUZDAMPFOBLSFT-UHFFFAOYSA-N	444.157973998							115034
SMR000045959	LSM-26497	SID863642, BRD-K65070020	664897	InChI=1S/C25H23N3O3/c1-29-22-11-10-17(14-23(22)30-2)12-13-27-25-21(16-26)28-24(31-25)15-19-8-5-7-18-6-3-4-9-20(18)19/h3-11,14,27H,12-13,15H2,1-2H3	MVSMAYUECPPYMV-UHFFFAOYSA-N	COc1ccc(CCNc2oc(Cc3cccc4ccccc34)nc2C#N)cc1OC	BroadT	BRD-K65070020	BRD-K65070020-001-05-5	InterBioScreen Ltd.	STOCK4S-83741			COc1ccc(CCNc2oc(Cc3cccc4ccccc34)nc2C#N)cc1OC	InChI=1S/C25H23N3O3/c1-29-22-11-10-17(14-23(22)30-2)12-13-27-25-21(16-26)28-24(31-25)15-19-8-5-7-18-6-3-4-9-20(18)19/h3-11,14,27H,12-13,15H2,1-2H3	MVSMAYUECPPYMV-UHFFFAOYSA-N	413.173941626							115035
T5332367	LSM-26498	SID26670210, BRD-A87965784	6416736	InChI=1S/C20H19N3OS/c1-3-8-15(9-4-1)18-19(16-10-5-2-6-11-16)22-23-20(21-18)25-14-17-12-7-13-24-17/h1-6,8-11,17H,7,12-14H2	FNAUWAQVSINIOV-UHFFFAOYSA-N	C(Sc1nnc(c2ccccc2)c(n1)c3ccccc3)C4CCCO4	BroadT	BRD-A87965784	BRD-A87965784-001-05-8	Enamine Ltd.	T5332367			C(Sc1nnc(-c2ccccc2)c(n1)-c1ccccc1)C1CCCO1	InChI=1S/C20H19N3OS/c1-3-8-15(9-4-1)18-19(16-10-5-2-6-11-16)22-23-20(21-18)25-14-17-12-7-13-24-17/h1-6,8-11,17H,7,12-14H2	FNAUWAQVSINIOV-UHFFFAOYSA-N	349.124882948							115036
ZINC04923263	LSM-15395	BRD-K16165450	4130822	InChI=1S/C20H16N2/c1-14-10-12-15(13-11-14)21-22-20-18-8-4-2-6-16(18)17-7-3-5-9-19(17)20/h2-13,21H,1H3	PNQGCUBIIRWOLO-UHFFFAOYSA-N	Cc1ccc(NN=C2c3ccccc3c4ccccc24)cc1	BroadT	BRD-K16165450	BRD-K16165450-003-05-8	Enamine Ltd.	T0506-7880		Cl	Cc1ccc(NN=C2c3ccccc3-c3ccccc23)cc1.Cl	InChI=1S/C20H16N2.ClH/c1-14-10-12-15(13-11-14)21-22-20-18-8-4-2-6-16(18)17-7-3-5-9-19(17)20;/h2-13,21H,1H3;1H	SGIMYRJAFZMJAF-UHFFFAOYSA-N	284.131348532							104037, 104037
MLS000041586	LSM-26499	SID863680, BRD-K44587037	664933	InChI=1S/C19H14FN3O2S/c1-11-21-17-14-4-2-3-5-15(14)25-18(17)19(22-11)26-10-16(24)23-13-8-6-12(20)7-9-13/h2-9H,10H2,1H3,(H,23,24)	VBCXUWRJIYPESD-UHFFFAOYSA-N	Cc1nc(SCC(=O)Nc2ccc(F)cc2)c3oc4ccccc4c3n1	BroadT	BRD-K44587037	BRD-K44587037-001-05-5	InterBioScreen Ltd.	STOCK4S-83599			Cc1nc(SCC(=O)Nc2ccc(F)cc2)c2oc3ccccc3c2n1	InChI=1S/C19H14FN3O2S/c1-11-21-17-14-4-2-3-5-15(14)25-18(17)19(22-11)26-10-16(24)23-13-8-6-12(20)7-9-13/h2-9H,10H2,1H3,(H,23,24)	VBCXUWRJIYPESD-UHFFFAOYSA-N	367.079075608							115037
SMR000007919	LSM-26500	SID850473, SID85240365, BRD-K92967245	652994	InChI=1S/C22H20ClN5O2/c1-15-12-21(26-7-9-27(10-8-26)22(29)19-6-3-11-30-19)28-20(24-15)14-18(25-28)16-4-2-5-17(23)13-16/h2-6,11-14H,7-10H2,1H3	KCGMIJAMMIIVFQ-UHFFFAOYSA-N	Cc1cc(N2CCN(CC2)C(=O)c3occc3)n4nc(cc4n1)c5cccc(Cl)c5	BroadT	BRD-K92967245	BRD-K92967245-001-05-8	Asinex Ltd.	ASN 07273949			Cc1cc(N2CCN(CC2)C(=O)c2ccco2)n2nc(cc2n1)-c1cccc(Cl)c1	InChI=1S/C22H20ClN5O2/c1-15-12-21(26-7-9-27(10-8-26)22(29)19-6-3-11-30-19)28-20(24-15)14-18(25-28)16-4-2-5-17(23)13-16/h2-6,11-14H,7-10H2,1H3	KCGMIJAMMIIVFQ-UHFFFAOYSA-N	421.13055264							115038
2-Methylsulfanyl-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b]quinazolin-8-one	LSM-26501	SID14742865, BRD-A42631608	3161782	InChI=1S/C16H14N4OS/c1-22-16-18-15-17-13-7-11(10-5-3-2-4-6-10)8-14(21)12(13)9-20(15)19-16/h2-6,9,11H,7-8H2,1H3	WORTWKUTRHMYIY-UHFFFAOYSA-N	CSc1nc2nc3CC(CC(=O)c3cn2n1)c4ccccc4	BroadT	BRD-A42631608	BRD-A42631608-001-05-4	InterBioScreen Ltd.	STOCK5S-42874			CSc1nc2nc3CC(CC(=O)c3cn2n1)c1ccccc1	InChI=1S/C16H14N4OS/c1-22-16-18-15-17-13-7-11(10-5-3-2-4-6-10)8-14(21)12(13)9-20(15)19-16/h2-6,9,11H,7-8H2,1H3	WORTWKUTRHMYIY-UHFFFAOYSA-N	310.088831798							115039
MLS001211833	LSM-44183	BRD-K27616003, SID49643486	1938996	InChI=1S/C20H20N2O4S/c1-4-12-5-7-14(8-6-12)21-20-22-19(24)17(27-20)11-13-9-15(25-2)18(23)16(10-13)26-3/h5-11,23H,4H2,1-3H3,(H,21,22,24)/b17-11-	MDHXRSDCPWIQIZ-BOPFTXTBSA-N	CCc1ccc(NC2=NC(=O)\C(=C\c3cc(OC)c(O)c(OC)c3)\S2)cc1	BroadT	BRD-K27616003	BRD-K27616003-001-07-9	Asinex Ltd.	BAS 02039405			CCc1ccc(NC2=NC(=O)\C(S2)=C\c2cc(OC)c(O)c(OC)c2)cc1	InChI=1S/C20H20N2O4S/c1-4-12-5-7-14(8-6-12)21-20-22-19(24)17(27-20)11-13-9-15(25-2)18(23)16(10-13)26-3/h5-11,23H,4H2,1-3H3,(H,21,22,24)/b17-11-	MDHXRSDCPWIQIZ-BOPFTXTBSA-N	384.11437783							
AC1MEZO6	LSM-26503	SID49643240, BRD-K65871716	2886721	InChI=1S/C14H10BrN3O4/c15-12-4-2-1-3-11(12)14(19)22-17-13(16)9-5-7-10(8-6-9)18(20)21/h1-8H,(H2,16,17)	QWBZEMYFWMWFBB-UHFFFAOYSA-N	NC(=NOC(=O)c1ccccc1Br)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K65871716	BRD-K65871716-001-05-5	Asinex Ltd.	BAS 01363931			NC(=NOC(=O)c1ccccc1Br)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C14H10BrN3O4/c15-12-4-2-1-3-11(12)14(19)22-17-13(16)9-5-7-10(8-6-9)18(20)21/h1-8H,(H2,16,17)	QWBZEMYFWMWFBB-UHFFFAOYSA-N	362.98546843							115041
1-(2,5-Dimethoxyphenyl)-3-[5-(2-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]urea	LSM-26504	SID24812914, BRD-A85811398	3457778	InChI=1S/C17H23N5O3S/c1-11-6-4-5-9-22(11)17-21-20-16(26-17)19-15(23)18-13-10-12(24-2)7-8-14(13)25-3/h7-8,10-11H,4-6,9H2,1-3H3,(H2,18,19,20,23)	ZYWZVCJJFMZMIM-UHFFFAOYSA-N	COc1ccc(OC)c(NC(=O)Nc2nnc(s2)N3CCCCC3C)c1	BroadT	BRD-A85811398	BRD-A85811398-001-05-4	ChemDiv Inc.	E002-0151			COc1ccc(OC)c(NC(=O)Nc2nnc(s2)N2CCCCC2C)c1	InChI=1S/C17H23N5O3S/c1-11-6-4-5-9-22(11)17-21-20-16(26-17)19-15(23)18-13-10-12(24-2)7-8-14(13)25-3/h7-8,10-11H,4-6,9H2,1-3H3,(H2,18,19,20,23)	ZYWZVCJJFMZMIM-UHFFFAOYSA-N	377.152160336							115042
SMR000045368	LSM-26505	SID863310, BRD-A29110038	664556	InChI=1S/C23H19N3O3/c1-12-10-22(2,3)26-19-14(12)5-4-6-16(19)23(21(26)28)15-8-7-13(27)9-18(15)29-20(25)17(23)11-24/h4-10,27H,25H2,1-3H3	KAVKFLFQNFYHGR-UHFFFAOYSA-N	CC1=CC(C)(C)N2C(=O)C3(C(=C(N)Oc4cc(O)ccc34)C#N)c5cccc1c25	BroadT	BRD-A29110038	BRD-A29110038-001-05-6	InterBioScreen Ltd.	STOCK4S-67098			CC1=CC(C)(C)N2C(=O)C3(c4cccc1c24)c1ccc(O)cc1OC(N)=C3C#N	InChI=1S/C23H19N3O3/c1-12-10-22(2,3)26-19-14(12)5-4-6-16(19)23(21(26)28)15-8-7-13(27)9-18(15)29-20(25)17(23)11-24/h4-10,27H,25H2,1-3H3	KAVKFLFQNFYHGR-UHFFFAOYSA-N	385.142641498							115043
381175-08-2	LSM-26506	SID4259161, BRD-A77777381	5728633	InChI=1S/C12H10F3N3O3/c13-12(14,15)9-4-6(8-2-1-3-21-8)16-10-5-7(11(19)20)17-18(9)10/h1-3,5-6,9,16H,4H2,(H,19,20)	HTGYRHUXRYMVAM-UHFFFAOYSA-N	OC(=O)c1cc2NC(CC(n2n1)C(F)(F)F)c3occc3	BroadT	BRD-A77777381	BRD-A77777381-001-05-6	ChemBridge Corporation	6067994			OC(=O)c1cc2NC(CC(n2n1)C(F)(F)F)c1ccco1	InChI=1S/C12H10F3N3O3/c13-12(14,15)9-4-6(8-2-1-3-21-8)16-10-5-7(11(19)20)17-18(9)10/h1-3,5-6,9,16H,4H2,(H,19,20)	HTGYRHUXRYMVAM-UHFFFAOYSA-N	301.06742581							
SMR000135767	LSM-26507	SID14734740, BRD-K52520502	2950112	InChI=1S/C22H33N3O5S/c1-5-30-22(27)24-12-10-23(11-13-24)21(26)19-6-8-25(9-7-19)31(28,29)20-17(3)14-16(2)15-18(20)4/h14-15,19H,5-13H2,1-4H3	RWPGXQYABKRTBC-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)c3c(C)cc(C)cc3C	BroadT	BRD-K52520502	BRD-K52520502-001-05-1	ChemBridge Corporation	7726883			CCOC(=O)N1CCN(CC1)C(=O)C1CCN(CC1)S(=O)(=O)c1c(C)cc(C)cc1C	InChI=1S/C22H33N3O5S/c1-5-30-22(27)24-12-10-23(11-13-24)21(26)19-6-8-25(9-7-19)31(28,29)20-17(3)14-16(2)15-18(20)4/h14-15,19H,5-13H2,1-4H3	RWPGXQYABKRTBC-UHFFFAOYSA-N	451.214091876							115045
STK218553	LSM-26508	SID4257684, BRD-K08586435	1262602	InChI=1S/C23H21N3O4S/c1-4-12-26-22(20-13-16-6-5-7-19(29-3)21(16)30-20)24-25-23(26)31-14-18(27)15-8-10-17(28-2)11-9-15/h4-11,13H,1,12,14H2,2-3H3	BFNRLDJAXRLKKI-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)CSc2nnc(c3oc4c(OC)cccc4c3)n2CC=C	BroadT	BRD-K08586435	BRD-K08586435-001-05-9	ChemBridge Corporation	7925351			COc1ccc(cc1)C(=O)CSc1nnc(-c2cc3cccc(OC)c3o2)n1CC=C	InChI=1S/C23H21N3O4S/c1-4-12-26-22(20-13-16-6-5-7-19(29-3)21(16)30-20)24-25-23(26)31-14-18(27)15-8-10-17(28-2)11-9-15/h4-11,13H,1,12,14H2,2-3H3	BFNRLDJAXRLKKI-UHFFFAOYSA-N	435.125276872							115046
AJ-091/40652526	LSM-44184	SID14719142, BRD-K92201676	1212000	InChI=1S/C22H18O/c23-22-20(10-5-9-18-7-3-4-11-21(18)22)15-16-12-13-17-6-1-2-8-19(17)14-16/h1-4,6-8,11-15H,5,9-10H2/b20-15-	GADKJBDEDCGOFL-HKWRFOASSA-N	O=C1\C(=C/c2ccc3ccccc3c2)\CCCc4ccccc14	BroadT	BRD-K92201676	BRD-K92201676-001-05-0	Specs	AJ-091/40652526			O=C1c2ccccc2CCC\C1=C\c1ccc2ccccc2c1	InChI=1S/C22H18O/c23-22-20(10-5-9-18-7-3-4-11-21(18)22)15-16-12-13-17-6-1-2-8-19(17)14-16/h1-4,6-8,11-15H,5,9-10H2/b20-15-	GADKJBDEDCGOFL-HKWRFOASSA-N	298.135765196							
AC1OA4QX	LSM-26510	SID26658583, BRD-K11852949	6747697	InChI=1S/C20H20N2O3/c1-13(2)12-25-16-8-9-17(19(23)10-16)20-18(11-21-22-20)14-4-6-15(24-3)7-5-14/h4-11,23H,1,12H2,2-3H3,(H,21,22)	NMVGQILMABMRCI-UHFFFAOYSA-N	COc1ccc(cc1)c2c[nH]nc2c3ccc(OCC(=C)C)cc3O	BroadT	BRD-K11852949	BRD-K11852949-001-06-7	InterBioScreen Ltd.	STOCK4S-54916			COc1ccc(cc1)-c1c[nH]nc1-c1ccc(OCC(C)=C)cc1O	InChI=1S/C20H20N2O3/c1-13(2)12-25-16-8-9-17(19(23)10-16)20-18(11-21-22-20)14-4-6-15(24-3)7-5-14/h4-11,23H,1,12H2,2-3H3,(H,21,22)	NMVGQILMABMRCI-UHFFFAOYSA-N	336.14739252							
T0515-1776	LSM-26511	SID3716996, BRD-K91893126	2408627	InChI=1S/C17H13ClN4O/c18-13-6-4-12(5-7-13)16-22-15(11-19)17(23-16)21-10-8-14-3-1-2-9-20-14/h1-7,9,21H,8,10H2	PAETVSOVNBBHAS-UHFFFAOYSA-N	Clc1ccc(cc1)c2oc(NCCc3ccccn3)c(n2)C#N	BroadT	BRD-K91893126	BRD-K91893126-001-05-1	Enamine Ltd.	T0515-1776			Clc1ccc(cc1)-c1nc(C#N)c(NCCc2ccccn2)o1	InChI=1S/C17H13ClN4O/c18-13-6-4-12(5-7-13)16-22-15(11-19)17(23-16)21-10-8-14-3-1-2-9-20-14/h1-7,9,21H,8,10H2	PAETVSOVNBBHAS-UHFFFAOYSA-N	324.077788786							115049
ZINC05050986	LSM-26512	SID14735822, BRD-K53618899	2968198	InChI=1S/C16H23ClN2O3S/c1-23(21,22)19(12-14-6-8-15(17)9-7-14)13-16(20)18-10-4-2-3-5-11-18/h6-9H,2-5,10-13H2,1H3	LIDWCBXJROJUDC-UHFFFAOYSA-N	CS(=O)(=O)N(CC(=O)N1CCCCCC1)Cc2ccc(Cl)cc2	BroadT	BRD-K53618899	BRD-K53618899-001-06-1	ChemBridge Corporation	7934450			CS(=O)(=O)N(CC(=O)N1CCCCCC1)Cc1ccc(Cl)cc1	InChI=1S/C16H23ClN2O3S/c1-23(21,22)19(12-14-6-8-15(17)9-7-14)13-16(20)18-10-4-2-3-5-11-18/h6-9H,2-5,10-13H2,1H3	LIDWCBXJROJUDC-UHFFFAOYSA-N	358.111791016							115050
ST026024	LSM-26513	SID4242538, BRD-K07741505	717126	InChI=1S/C20H20N2O3/c1-2-15-6-8-17(9-7-15)24-14-18-10-11-19(25-18)20(23)22-13-16-5-3-4-12-21-16/h3-12H,2,13-14H2,1H3,(H,22,23)	UAUHBRCHPWJVAK-UHFFFAOYSA-N	CCc1ccc(OCc2oc(cc2)C(=O)NCc3ccccn3)cc1	BroadT	BRD-K07741505	BRD-K07741505-001-05-6	ChemDiv Inc.	6228-2265			CCc1ccc(OCc2ccc(o2)C(=O)NCc2ccccn2)cc1	InChI=1S/C20H20N2O3/c1-2-15-6-8-17(9-7-15)24-14-18-10-11-19(25-18)20(23)22-13-16-5-3-4-12-21-16/h3-12H,2,13-14H2,1H3,(H,22,23)	UAUHBRCHPWJVAK-UHFFFAOYSA-N	336.14739252							115051
ZINC08395614	LSM-26514	SID49674319, BRD-K68055051	9509560	InChI=1S/C18H19ClN2O2S/c1-24-16-5-2-4-15(12-16)21-17(22)6-3-11-20-18(23)13-7-9-14(19)10-8-13/h2,4-5,7-10,12H,3,6,11H2,1H3,(H,20,23)(H,21,22)	ZCPJAOYUQGQPHZ-UHFFFAOYSA-N	CSc1cccc(NC(=O)CCCNC(=O)c2ccc(Cl)cc2)c1	BroadT	BRD-K68055051	BRD-K68055051-001-05-5	Enamine Ltd.	T5564345			CSc1cccc(NC(=O)CCCNC(=O)c2ccc(Cl)cc2)c1	InChI=1S/C18H19ClN2O2S/c1-24-16-5-2-4-15(12-16)21-17(22)6-3-11-20-18(23)13-7-9-14(19)10-8-13/h2,4-5,7-10,12H,3,6,11H2,1H3,(H,20,23)(H,21,22)	ZCPJAOYUQGQPHZ-UHFFFAOYSA-N	362.085576268							115052
MLS000046981	LSM-26515	SID4251000, BRD-K46487274	3244742	InChI=1S/C17H15N3O4S/c1-3-20-7-18-16-13(17(20)22)9(2)14(25-16)15(21)19-10-4-5-11-12(6-10)24-8-23-11/h4-7H,3,8H2,1-2H3,(H,19,21)	OZWVGXILNZHMJF-UHFFFAOYSA-N	CCN1C=Nc2sc(C(=O)Nc3ccc4OCOc4c3)c(C)c2C1=O	BroadT	BRD-K46487274	BRD-K46487274-001-06-6	ChemDiv Inc.	K840-0313			CCn1cnc2sc(C(=O)Nc3ccc4OCOc4c3)c(C)c2c1=O	InChI=1S/C17H15N3O4S/c1-3-20-7-18-16-13(17(20)22)9(2)14(25-16)15(21)19-10-4-5-11-12(6-10)24-8-23-11/h4-7H,3,8H2,1-2H3,(H,19,21)	OZWVGXILNZHMJF-UHFFFAOYSA-N	357.07832668							115053
7-(3,5-Dimethyl-1H-pyrazol-1-yl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidine	LSM-26516	SID864691, BRD-K65456920	665932	InChI=1S/C18H17N5/c1-12-10-17(22-14(3)9-13(2)21-22)23-18(20-12)16(11-19-23)15-7-5-4-6-8-15/h4-11H,1-3H3	SPOZCEKGUJQEHP-UHFFFAOYSA-N	Cc1cc(n2nc(C)cc2C)n3ncc(c4ccccc4)c3n1	BroadT	BRD-K65456920	BRD-K65456920-001-05-7	InterBioScreen Ltd.	STOCK5S-26028			Cc1cc(C)n(n1)-c1cc(C)nc2c(cnn12)-c1ccccc1	InChI=1S/C18H17N5/c1-12-10-17(22-14(3)9-13(2)21-22)23-18(20-12)16(11-19-23)15-7-5-4-6-8-15/h4-11H,1-3H3	SPOZCEKGUJQEHP-UHFFFAOYSA-N	303.148395594							115054
N-(1-Butyl-1H-benzimidazol-2-yl)cyclohexanecarboxamide	LSM-26517	SID14732656, BRD-K30759881	2908678	InChI=1S/C18H25N3O/c1-2-3-13-21-16-12-8-7-11-15(16)19-18(21)20-17(22)14-9-5-4-6-10-14/h7-8,11-12,14H,2-6,9-10,13H2,1H3,(H,19,20,22)	PMDXJRHNRGXQOK-UHFFFAOYSA-N	CCCCn1c(NC(=O)C2CCCCC2)nc3ccccc13	BroadT	BRD-K30759881	BRD-K30759881-001-05-3	ChemBridge Corporation	6655445			CCCCn1c(NC(=O)C2CCCCC2)nc2ccccc12	InChI=1S/C18H25N3O/c1-2-3-13-21-16-12-8-7-11-15(16)19-18(21)20-17(22)14-9-5-4-6-10-14/h7-8,11-12,14H,2-6,9-10,13H2,1H3,(H,19,20,22)	PMDXJRHNRGXQOK-UHFFFAOYSA-N	299.19976245							115055
N-(2-Methoxydibenzofuran-3-yl)-2-(4-methoxyphenoxy)acetamide	LSM-26518	SID17507795, BRD-K71793847	2711781	InChI=1S/C22H19NO5/c1-25-14-7-9-15(10-8-14)27-13-22(24)23-18-12-20-17(11-21(18)26-2)16-5-3-4-6-19(16)28-20/h3-12H,13H2,1-2H3,(H,23,24)	GGJTWUAZBRROEN-UHFFFAOYSA-N	COc1ccc(OCC(=O)Nc2cc3oc4ccccc4c3cc2OC)cc1	BroadT	BRD-K71793847	BRD-K71793847-001-05-5	Asinex Ltd.	BAS 01188591			COc1ccc(OCC(=O)Nc2cc3oc4ccccc4c3cc2OC)cc1	InChI=1S/C22H19NO5/c1-25-14-7-9-15(10-8-14)27-13-22(24)23-18-12-20-17(11-21(18)26-2)16-5-3-4-6-19(16)28-20/h3-12H,13H2,1-2H3,(H,23,24)	GGJTWUAZBRROEN-UHFFFAOYSA-N	377.126322718							115056
5-Methoxy-n-(2-methoxy-1-methylethyl)-1H-indole-2-carboxamide	LSM-26519	SID26730019, BRD-A22299460	2742894	InChI=1S/C14H18N2O3/c1-9(8-18-2)15-14(17)13-7-10-6-11(19-3)4-5-12(10)16-13/h4-7,9,16H,8H2,1-3H3,(H,15,17)	LPLUMFPBJGLPKS-UHFFFAOYSA-N	COCC(C)NC(=O)c1cc2cc(OC)ccc2[nH]1	BroadT	BRD-A22299460	BRD-A22299460-001-05-1	Maybridge	SP 01206			COCC(C)NC(=O)c1cc2cc(OC)ccc2[nH]1	InChI=1S/C14H18N2O3/c1-9(8-18-2)15-14(17)13-7-10-6-11(19-3)4-5-12(10)16-13/h4-7,9,16H,8H2,1-3H3,(H,15,17)	LPLUMFPBJGLPKS-UHFFFAOYSA-N	262.131742456							115057
AK-918/42271854	LSM-26520	SID4256255, BRD-K09753654	1288179	InChI=1S/C22H22N4O2/c1-16(27)25-19-7-6-8-20(13-19)28-22-12-18(15-24)17(14-23)11-21(22)26-9-4-2-3-5-10-26/h6-8,11-13H,2-5,9-10H2,1H3,(H,25,27)	AVDKNUNMNZNUPV-UHFFFAOYSA-N	CC(=O)Nc1cccc(Oc2cc(C#N)c(cc2N3CCCCCC3)C#N)c1	BroadT	BRD-K09753654	BRD-K09753654-001-06-6	ChemBridge Corporation	7727936			CC(=O)Nc1cccc(Oc2cc(C#N)c(cc2N2CCCCCC2)C#N)c1	InChI=1S/C22H22N4O2/c1-16(27)25-19-7-6-8-20(13-19)28-22-12-18(15-24)17(14-23)11-21(22)26-9-4-2-3-5-10-26/h6-8,11-13H,2-5,9-10H2,1H3,(H,25,27)	AVDKNUNMNZNUPV-UHFFFAOYSA-N	374.174275984							115058
MLS000849709	LSM-26521	SID26670489, BRD-K07505457	16682661	InChI=1S/C18H17N3O3/c1-11-2-5-16-13(8-11)10-24-18-14-4-3-12(17(23)19-6-7-22)9-15(14)20-21(16)18/h2-5,8-9,22H,6-7,10H2,1H3,(H,19,23)	JEHKCBWUXXZVBG-UHFFFAOYSA-N	Cc1ccc2c(COc3c4ccc(cc4nn23)C(=O)NCCO)c1	BroadT	BRD-K07505457	BRD-K07505457-001-05-3	University of California at Davis	JDB-034			Cc1ccc-2c(COc3n-2nc2cc(ccc32)C(=O)NCCO)c1	InChI=1S/C18H17N3O3/c1-11-2-5-16-13(8-11)10-24-18-14-4-3-12(17(23)19-6-7-22)9-15(14)20-21(16)18/h2-5,8-9,22H,6-7,10H2,1H3,(H,19,23)	JEHKCBWUXXZVBG-UHFFFAOYSA-N	323.126991434							115059
MLS000685386	LSM-15396	BRD-K04362500	16194708	InChI=1S/C21H24ClN3O3S/c1-24(2)12-5-13-25(19(26)14-28-16-10-8-15(22)9-11-16)21-23-20-17(27-3)6-4-7-18(20)29-21/h4,6-11H,5,12-14H2,1-3H3	KORYSINRSCHIAA-UHFFFAOYSA-N	COc1cccc2sc(nc12)N(CCCN(C)C)C(=O)COc3ccc(Cl)cc3	BroadT	BRD-K04362500	BRD-K04362500-003-05-5	Life Chemicals Inc.	F2019-1066		Cl	COc1cccc2sc(nc12)N(CCCN(C)C)C(=O)COc1ccc(Cl)cc1.Cl	InChI=1S/C21H24ClN3O3S.ClH/c1-24(2)12-5-13-25(19(26)14-28-16-10-8-15(22)9-11-16)21-23-20-17(27-3)6-4-7-18(20)29-21;/h4,6-11H,5,12-14H2,1-3H3;1H	APXUFINKESNJHN-UHFFFAOYSA-N	433.122690058							104038, 104038
SMR000095579	LSM-26522	SID7965329, BRD-K04034373	5307562	InChI=1S/C17H16FN3O3S/c1-11-9-12(7-8-14(11)18)25(22,23)21-17(19)10-15(20-21)13-5-3-4-6-16(13)24-2/h3-10H,19H2,1-2H3	LWFIBLCVEXHJFH-UHFFFAOYSA-N	COc1ccccc1c2cc(N)n(n2)S(=O)(=O)c3ccc(F)c(C)c3	BroadT	BRD-K04034373	BRD-K04034373-001-04-1	ChemDiv Inc.	C665-0102			COc1ccccc1-c1cc(N)n(n1)S(=O)(=O)c1ccc(F)c(C)c1	InChI=1S/C17H16FN3O3S/c1-11-9-12(7-8-14(11)18)25(22,23)21-17(19)10-15(20-21)13-5-3-4-6-16(13)24-2/h3-10H,19H2,1-2H3	LWFIBLCVEXHJFH-UHFFFAOYSA-N	361.089640292							115060
F0679-0503	LSM-26523	SID4240510, BRD-K23754425	3235609	InChI=1S/C23H23N5O4/c1-14-5-6-16(9-15(14)2)28-22-18(11-25-28)23(30)27(13-24-22)12-21(29)26-19-8-7-17(31-3)10-20(19)32-4/h5-11,13H,12H2,1-4H3,(H,26,29)	NHANYQUWFGOOMZ-UHFFFAOYSA-N	COc1ccc(NC(=O)CN2C=Nc3c(cnn3c4ccc(C)c(C)c4)C2=O)c(OC)c1	BroadT	BRD-K23754425	BRD-K23754425-001-05-6	ChemDiv Inc.	C801-0509			COc1ccc(NC(=O)Cn2cnc3n(ncc3c2=O)-c2ccc(C)c(C)c2)c(OC)c1	InChI=1S/C23H23N5O4/c1-14-5-6-16(9-15(14)2)28-22-18(11-25-28)23(30)27(13-24-22)12-21(29)26-19-8-7-17(31-3)10-20(19)32-4/h5-11,13H,12H2,1-4H3,(H,26,29)	NHANYQUWFGOOMZ-UHFFFAOYSA-N	433.175004266							115061
7-Hydroxy-8-[4-(2-hydroxy-ethyl)-piperazin-1-ylmethyl]-4-methyl-chromen-2-one	LSM-26524	SID49643239, BRD-K50120401	5289738	InChI=1S/C17H22N2O4/c1-12-10-16(22)23-17-13(12)2-3-15(21)14(17)11-19-6-4-18(5-7-19)8-9-20/h2-3,10,20-21H,4-9,11H2,1H3	SCTSSAKKVILHNG-UHFFFAOYSA-N	CC1=CC(=O)Oc2c(CN3CCN(CCO)CC3)c(O)ccc12	BroadT	BRD-K50120401	BRD-K50120401-001-05-4	Asinex Ltd.	BAS 03603110			Cc1cc(=O)oc2c(CN3CCN(CCO)CC3)c(O)ccc12	InChI=1S/C17H22N2O4/c1-12-10-16(22)23-17-13(12)2-3-15(21)14(17)11-19-6-4-18(5-7-19)8-9-20/h2-3,10,20-21H,4-9,11H2,1H3	SCTSSAKKVILHNG-UHFFFAOYSA-N	318.157957204							115062
T5320052	LSM-26525	SID24835153, BRD-K18871470	2464971	InChI=1S/C19H22N2OS/c1-3-13-21(14-16-7-5-4-6-8-16)19(23)20-18-11-9-17(10-12-18)15(2)22/h4-12H,3,13-14H2,1-2H3,(H,20,23)	BAQJEWUWFZYGBK-UHFFFAOYSA-N	CCCN(Cc1ccccc1)C(=Nc2ccc(cc2)C(=O)C)S	BroadT	BRD-K18871470	BRD-K18871470-001-05-9	Enamine Ltd.	T5320052			CCCN(Cc1ccccc1)C(S)=Nc1ccc(cc1)C(C)=O	InChI=1S/C19H22N2OS/c1-3-13-21(14-16-7-5-4-6-8-16)19(23)20-18-11-9-17(10-12-18)15(2)22/h4-12H,3,13-14H2,1-2H3,(H,20,23)	BAQJEWUWFZYGBK-UHFFFAOYSA-N	326.145284034							115063
MLS000098258	LSM-26526	SID3716630, BRD-K92983829	2116697	InChI=1S/C21H17N5OS/c27-19(22-21-24-23-20(28-21)15-11-12-15)18-13-17(14-7-3-1-4-8-14)25-26(18)16-9-5-2-6-10-16/h1-10,13,15H,11-12H2,(H,22,24,27)	JHAMGSJDLVIXQK-UHFFFAOYSA-N	O=C(Nc1nnc(s1)C2CC2)c3cc(nn3c4ccccc4)c5ccccc5	BroadT	BRD-K92983829	BRD-K92983829-001-06-7	Enamine Ltd.	T5245212			O=C(Nc1nnc(s1)C1CC1)c1cc(nn1-c1ccccc1)-c1ccccc1	InChI=1S/C21H17N5OS/c27-19(22-21-24-23-20(28-21)15-11-12-15)18-13-17(14-7-3-1-4-8-14)25-26(18)16-9-5-2-6-10-16/h1-10,13,15H,11-12H2,(H,22,24,27)	JHAMGSJDLVIXQK-UHFFFAOYSA-N	387.115380904							115064
N-[(6-Methylpyrimidin-4-yl)sulfanylmethyl]benzamide	LSM-26527	SID7975634, BRD-K79601920	871711	InChI=1S/C13H13N3OS/c1-10-7-12(15-8-14-10)18-9-16-13(17)11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,16,17)	RSJIWZOLNCBJPB-UHFFFAOYSA-N	Cc1cc(SCNC(=O)c2ccccc2)ncn1	BroadT	BRD-K79601920	BRD-K79601920-001-06-0	ChemBridge Corporation	5552578			Cc1cc(SCNC(=O)c2ccccc2)ncn1	InChI=1S/C13H13N3OS/c1-10-7-12(15-8-14-10)18-9-16-13(17)11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,16,17)	RSJIWZOLNCBJPB-UHFFFAOYSA-N	259.077932756							115065
STK617239	LSM-26528	SID843591, BRD-K08989716	645893	InChI=1S/C22H29N3O/c1-3-25(4-2)15-18-23-20-17-11-7-6-10-16(17)14-22(12-8-5-9-13-22)19(20)21(26)24-18/h6-7,10-11H,3-5,8-9,12-15H2,1-2H3,(H,23,24,26)	SEMFKNVFKSUDSC-UHFFFAOYSA-N	CCN(CC)Cc1nc(O)c2c(n1)c3ccccc3CC24CCCCC4	BroadT	BRD-K08989716	BRD-K08989716-001-05-5	Asinex Ltd.	BAS 00327489			CCN(CC)Cc1nc(O)c2c(n1)-c1ccccc1CC21CCCCC1	InChI=1S/C22H29N3O/c1-3-25(4-2)15-18-23-20-17-11-7-6-10-16(17)14-22(12-8-5-9-13-22)19(20)21(26)24-18/h6-7,10-11H,3-5,8-9,12-15H2,1-2H3,(H,23,24,26)	SEMFKNVFKSUDSC-UHFFFAOYSA-N	351.231062578							115066
670243-42-2	LSM-26529	SID865058, BRD-A55074229	666304	InChI=1S/C16H18O4/c1-8-6-13(19-12(5)11(4)17)15-9(2)10(3)16(18)20-14(15)7-8/h6-7,12H,1-5H3	RCMROVGQFYVIEZ-UHFFFAOYSA-N	CC(Oc1cc(C)cc2OC(=O)C(=C(C)c12)C)C(=O)C	BroadT	BRD-A55074229	BRD-A55074229-001-05-0	InterBioScreen Ltd.	STOCK5S-35350			CC(Oc1cc(C)cc2oc(=O)c(C)c(C)c12)C(C)=O	InChI=1S/C16H18O4/c1-8-6-13(19-12(5)11(4)17)15-9(2)10(3)16(18)20-14(15)7-8/h6-7,12H,1-5H3	RCMROVGQFYVIEZ-UHFFFAOYSA-N	274.120509056							115067
2-(2,6-Dichloroanilino)-3-pyridinesulfonamide	LSM-26530	SID17386463, BRD-K71659012	901910	InChI=1S/C11H9Cl2N3O2S/c12-7-3-1-4-8(13)10(7)16-11-9(19(14,17)18)5-2-6-15-11/h1-6H,(H,15,16)(H2,14,17,18)	CTUDWPLUUVGGGP-UHFFFAOYSA-N	NS(=O)(=O)c1cccnc1Nc2c(Cl)cccc2Cl	BroadT	BRD-K71659012	BRD-K71659012-001-05-7	Specs	AJ-333/09219027			NS(=O)(=O)c1cccnc1Nc1c(Cl)cccc1Cl	InChI=1S/C11H9Cl2N3O2S/c12-7-3-1-4-8(13)10(7)16-11-9(19(14,17)18)5-2-6-15-11/h1-6H,(H,15,16)(H2,14,17,18)	CTUDWPLUUVGGGP-UHFFFAOYSA-N	316.979252668							115068
T0505-3833	LSM-26531	SID22411267, BRD-K71904196	6242651	InChI=1S/C18H19N5O5S/c1-3-22(4-2)29(27,28)16-11-12(23(25)26)9-10-15(16)20-21-17-13-7-5-6-8-14(13)19-18(17)24/h5-11,19,24H,3-4H2,1-2H3	ZXANFFNPFNDQRN-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1cc(ccc1N=Nc2c(O)[nH]c3ccccc23)[N+](=O)[O-]	BroadT	BRD-K71904196	BRD-K71904196-001-05-5	Enamine Ltd.	T0505-3833			CCN(CC)S(=O)(=O)c1cc(ccc1N=Nc1c(O)[nH]c2ccccc12)[N+]([O-])=O	InChI=1S/C18H19N5O5S/c1-3-22(4-2)29(27,28)16-11-12(23(25)26)9-10-15(16)20-21-17-13-7-5-6-8-14(13)19-18(17)24/h5-11,19,24H,3-4H2,1-2H3	ZXANFFNPFNDQRN-UHFFFAOYSA-N	417.110689448							
MLS000758507	LSM-26532	SID26667295, BRD-K14138849	332435	InChI=1S/C16H15N3OS2/c1-10-5-3-8-13-14(10)18-16(22-13)19-15(20)17-11-6-4-7-12(9-11)21-2/h3-9H,1-2H3,(H2,17,18,19,20)	DPHIIOLWWBGYNC-UHFFFAOYSA-N	CSc1cccc(NC(=O)Nc2nc3c(C)cccc3s2)c1	BroadT	BRD-K14138849	BRD-K14138849-001-05-1	National Cancer Institute Chemotherapeutic Agents Repository	329255			CSc1cccc(NC(=O)Nc2nc3c(C)cccc3s2)c1	InChI=1S/C16H15N3OS2/c1-10-5-3-8-13-14(10)18-16(22-13)19-15(20)17-11-6-4-7-12(9-11)21-2/h3-9H,1-2H3,(H2,17,18,19,20)	DPHIIOLWWBGYNC-UHFFFAOYSA-N	329.06565351							115070
SMR000024342	LSM-26533	SID4248113, BRD-K99043244	3242230	InChI=1S/C19H20N2O5S/c22-18(20-16-8-4-7-15(12-16)19(23)24)14-6-5-9-17(13-14)27(25,26)21-10-2-1-3-11-21/h4-9,12-13H,1-3,10-11H2,(H,20,22)(H,23,24)	NMLTYVFSQJBYCF-UHFFFAOYSA-N	OC(=O)c1cccc(NC(=O)c2cccc(c2)S(=O)(=O)N3CCCCC3)c1	BroadT	BRD-K99043244	BRD-K99043244-001-06-0	ChemDiv Inc.	3507-0150			OC(=O)c1cccc(NC(=O)c2cccc(c2)S(=O)(=O)N2CCCCC2)c1	InChI=1S/C19H20N2O5S/c22-18(20-16-8-4-7-15(12-16)19(23)24)14-6-5-9-17(13-14)27(25,26)21-10-2-1-3-11-21/h4-9,12-13H,1-3,10-11H2,(H,20,22)(H,23,24)	NMLTYVFSQJBYCF-UHFFFAOYSA-N	388.10929245							115071
SMR000141990	LSM-26534	SID14736498, BRD-K61673053	799886	InChI=1S/C15H16N4S/c1-4-7-19-14(17-18-15(19)20)11-5-6-13-12(8-11)9(2)10(3)16-13/h4-6,8,16H,1,7H2,2-3H3,(H,18,20)	UVDNXJZOYWXFEU-UHFFFAOYSA-N	Cc1[nH]c2ccc(cc2c1C)c3nnc(S)n3CC=C	BroadT	BRD-K61673053	BRD-K61673053-001-05-0	ChemBridge Corporation	6897988			Cc1[nH]c2ccc(cc2c1C)-c1nnc(S)n1CC=C	InChI=1S/C15H16N4S/c1-4-7-19-14(17-18-15(19)20)11-5-6-13-12(8-11)9(2)10(3)16-13/h4-6,8,16H,1,7H2,2-3H3,(H,18,20)	UVDNXJZOYWXFEU-UHFFFAOYSA-N	284.109567242							115072
6-Tert-butyl-3-cyclohexyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine	LSM-26535	SID50102144, SID862178, BRD-K47318215	663403	InChI=1S/C14H22N4S/c1-14(2,3)11-9-19-13-16-15-12(18(13)17-11)10-7-5-4-6-8-10/h10H,4-9H2,1-3H3	XJRBAZDZCXFLBD-UHFFFAOYSA-N	CC(C)(C)C1=Nn2c(SC1)nnc2C3CCCCC3	BroadT	BRD-K47318215	BRD-K47318215-001-05-6	InterBioScreen Ltd.	STOCK4S-34823			CC(C)(C)C1=Nn2c(SC1)nnc2C1CCCCC1	InChI=1S/C14H22N4S/c1-14(2,3)11-9-19-13-16-15-12(18(13)17-11)10-7-5-4-6-8-10/h10H,4-9H2,1-3H3	XJRBAZDZCXFLBD-UHFFFAOYSA-N	278.156517434							115073
MLS000328048	LSM-26536	SID17411054, BRD-K52518198	1474190	InChI=1S/C16H15Cl2N3O2S/c1-9-6-13-16(19-8-21(13)3)15(10(9)2)20-24(22,23)14-7-11(17)4-5-12(14)18/h4-8,20H,1-3H3	FVDRAHRSWLZRPW-UHFFFAOYSA-N	Cc1cc2c(ncn2C)c(NS(=O)(=O)c3cc(Cl)ccc3Cl)c1C	BroadT	BRD-K52518198	BRD-K52518198-001-06-2	Key Organics Ltd.	3J-365S			Cc1cc2n(C)cnc2c(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1C	InChI=1S/C16H15Cl2N3O2S/c1-9-6-13-16(19-8-21(13)3)15(10(9)2)20-24(22,23)14-7-11(17)4-5-12(14)18/h4-8,20H,1-3H3	FVDRAHRSWLZRPW-UHFFFAOYSA-N	383.02620286							115074
AC1MMVLH	LSM-26537	BRD-A69564129	3245117	InChI=1S/C20H21N5O4/c1-2-15-17-16(14(11-21)18(22)29-19(17)24-23-15)12-4-3-5-13(10-12)28-20(26)25-6-8-27-9-7-25/h3-5,10,14,16,22H,2,6-9H2,1H3,(H,23,24)	LRLPSMQAPGCCIC-UHFFFAOYSA-N	CCc1[nH]nc2OC(=N)C(C#N)C(c12)c1cccc(OC(=O)N2CCOCC2)c1	BroadT	BRD-A69564129	BRD-A69564129-001-07-1	ChemDiv Inc.	3448-7893			CCc1n[nH]c2OC(N)=C(C#N)C(c12)c1cccc(OC(=O)N2CCOCC2)c1	InChI=1S/C20H21N5O4/c1-2-15-17-16(14(11-21)18(22)29-19(17)24-23-15)12-4-3-5-13(10-12)28-20(26)25-6-8-27-9-7-25/h3-5,10,16H,2,6-9,22H2,1H3,(H,23,24)	UUFGQZDPLNAEHS-UHFFFAOYSA-N	395.159354202							
MLS000035341	LSM-26538	SID848125, BRD-K49515162	650554	InChI=1S/C26H26N4O3/c1-31-21-9-7-20(8-10-21)23-17-24-27-22(19-5-3-2-4-6-19)18-25(30(24)28-23)29-13-11-26(12-14-29)32-15-16-33-26/h2-10,17-18H,11-16H2,1H3	RGSXJCBSMXDJGZ-UHFFFAOYSA-N	COc1ccc(cc1)c2cc3nc(cc(N4CCC5(CC4)OCCO5)n3n2)c6ccccc6	BroadT	BRD-K49515162	BRD-K49515162-001-05-8	Asinex Ltd.	ASN 08736170			COc1ccc(cc1)-c1cc2nc(cc(N3CCC4(CC3)OCCO4)n2n1)-c1ccccc1	InChI=1S/C26H26N4O3/c1-31-21-9-7-20(8-10-21)23-17-24-27-22(19-5-3-2-4-6-19)18-25(30(24)28-23)29-13-11-26(12-14-29)32-15-16-33-26/h2-10,17-18H,11-16H2,1H3	RGSXJCBSMXDJGZ-UHFFFAOYSA-N	442.200490732							115076
2-(4-Bromophenoxy)-1-[4-(1H-indol-3-ylmethyl)piperazin-1-yl]ethanone	LSM-15567	BRD-K57120168	1529971	InChI=1S/C21H22BrN3O2/c22-17-5-7-18(8-6-17)27-15-21(26)25-11-9-24(10-12-25)14-16-13-23-20-4-2-1-3-19(16)20/h1-8,13,23H,9-12,14-15H2	WRAAMQSIINUQQB-UHFFFAOYSA-N	Brc1ccc(OCC(=O)N2CCN(Cc3c[nH]c4ccccc34)CC2)cc1	BroadT	BRD-K57120168	BRD-K57120168-034-06-9	ChemBridge Corporation	5947752		OC(=O)C(=O)O	Brc1ccc(OCC(=O)N2CCN(Cc3c[nH]c4ccccc34)CC2)cc1.OC(=O)C(=O)O	InChI=1S/C21H22BrN3O2.C2H2O4/c22-17-5-7-18(8-6-17)27-15-21(26)25-11-9-24(10-12-25)14-16-13-23-20-4-2-1-3-19(16)20;3-1(4)2(5)6/h1-8,13,23H,9-12,14-15H2;(H,3,4)(H,5,6)	LLRKCBQSIZRLBN-UHFFFAOYSA-N	427.089539574							104203, 104203
BRD-A11178225	LSM-26539			InChI=1S/C20H18ClN3O4/c1-3-28-19(27)20(2)17(23-22-15-12-8-7-11-14(15)21)16(25)18(26)24(20)13-9-5-4-6-10-13/h4-12,17H,3H2,1-2H3	XDSCWAIVPSYVMI-UHFFFAOYSA-N	CCOC(=O)C1(C)C(N=Nc2ccccc2Cl)C(=O)C(=O)N1c3ccccc3	BroadT	BRD-A11178225	BRD-A11178225-001-05-6	InterBioScreen Ltd.	STOCK3S-08640			CCOC(=O)C1(C)C(N=Nc2ccccc2Cl)C(=O)C(=O)N1c1ccccc1	InChI=1S/C20H18ClN3O4/c1-3-28-19(27)20(2)17(23-22-15-12-8-7-11-14(15)21)16(25)18(26)24(20)13-9-5-4-6-10-13/h4-12,17H,3H2,1-2H3	XDSCWAIVPSYVMI-UHFFFAOYSA-N	399.098583796							115077
AN-329/42667797	LSM-44185	SID17388551, BRD-K36071816	1792586	InChI=1S/C22H23N3O3S2/c1-3-16-25(17-4-2)30(27,28)20-13-11-19(12-14-20)23-22(29)24-21(26)15-10-18-8-6-5-7-9-18/h3-15H,1-2,16-17H2,(H2,23,24,26,29)/b15-10+	WTOUUQDQLGXNTF-XNTDXEJSSA-N	C=CCN(CC=C)S(=O)(=O)c1ccc(NC(=S)NC(=O)\C=C\c2ccccc2)cc1	BroadT	BRD-K36071816	BRD-K36071816-001-06-5	Specs	AN-329/42667797			C=CCN(CC=C)S(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)\C=C\c1ccccc1	InChI=1S/C22H23N3O3S2/c1-3-16-25(17-4-2)30(27,28)20-13-11-19(12-14-20)23-22(29)24-21(26)15-10-18-8-6-5-7-9-18/h3-15H,1-2,16-17H2,(H2,23,24,26,29)/b15-10+	WTOUUQDQLGXNTF-XNTDXEJSSA-N	441.118083006							
MLS000082464	LSM-26541	SID862282, BRD-A86962683	5389714	InChI=1S/C21H22ClN5O3/c1-29-12-19(28)24-20-25-21-23-17(13-7-9-14(30-2)10-8-13)11-18(27(21)26-20)15-5-3-4-6-16(15)22/h3-10,17-18H,11-12H2,1-2H3,(H2,23,24,25,26,28)	DPVMPIVJZJFLDH-UHFFFAOYSA-N	COCC(=O)Nc1nc2NC(CC(c3ccccc3Cl)n2n1)c4ccc(OC)cc4	BroadT	BRD-A86962683	BRD-A86962683-001-06-6	InterBioScreen Ltd.	STOCK4S-32779			COCC(=O)Nc1nc2NC(CC(c3ccccc3Cl)n2n1)c1ccc(OC)cc1	InChI=1S/C21H22ClN5O3/c1-29-12-19(28)24-20-25-21-23-17(13-7-9-14(30-2)10-8-13)11-18(27(21)26-20)15-5-3-4-6-16(15)22/h3-10,17-18H,11-12H2,1-2H3,(H2,23,24,25,26,28)	DPVMPIVJZJFLDH-UHFFFAOYSA-N	427.141117324							115079
5N-597S	LSM-26542	SID17402272, BRD-K43631652	5128071	InChI=1S/C20H16Cl3N3O2/c21-14-3-1-13(2-4-14)19-12-18(20(27)25-7-9-28-10-8-25)24-26(19)15-5-6-16(22)17(23)11-15/h1-6,11-12H,7-10H2	IRKIHPNDZGZDBJ-UHFFFAOYSA-N	Clc1ccc(cc1)c2cc(nn2c3ccc(Cl)c(Cl)c3)C(=O)N4CCOCC4	BroadT	BRD-K43631652	BRD-K43631652-001-05-6	Key Organics Ltd.	5N-597S			Clc1ccc(cc1)-c1cc(nn1-c1ccc(Cl)c(Cl)c1)C(=O)N1CCOCC1	InChI=1S/C20H16Cl3N3O2/c21-14-3-1-13(2-4-14)19-12-18(20(27)25-7-9-28-10-8-25)24-26(19)15-5-6-16(22)17(23)11-15/h1-6,11-12H,7-10H2	IRKIHPNDZGZDBJ-UHFFFAOYSA-N	435.030809912							115080
T5589881	LSM-26543	SID3716868, BRD-K25501017	2078659	InChI=1S/C23H31N3O3/c27-20(25-14-10-19(11-15-25)16-18-8-4-3-5-9-18)17-26-21(28)23(24-22(26)29)12-6-1-2-7-13-23/h3-5,8-9,19H,1-2,6-7,10-17H2,(H,24,29)	OSUUYKLBHLTSDZ-UHFFFAOYSA-N	O=C(CN1C(=O)NC2(CCCCCC2)C1=O)N3CCC(Cc4ccccc4)CC3	BroadT	BRD-K25501017	BRD-K25501017-001-05-3	Enamine Ltd.	T5256421			O=C(CN1C(=O)NC2(CCCCCC2)C1=O)N1CCC(Cc2ccccc2)CC1	InChI=1S/C23H31N3O3/c27-20(25-14-10-19(11-15-25)16-18-8-4-3-5-9-18)17-26-21(28)23(24-22(26)29)12-6-1-2-7-13-23/h3-5,8-9,19H,1-2,6-7,10-17H2,(H,24,29)	OSUUYKLBHLTSDZ-UHFFFAOYSA-N	397.236541882							115081
MLS000551053	LSM-26544	SID17407783, BRD-K91990892	803810	InChI=1S/C15H13N5S/c1-2-19-15-20-14(18)13(21-15)12(11(8-16)9-17)10-6-4-3-5-7-10/h3-7H,2,18H2,1H3,(H,19,20)	UPSVKSUEPUIPCI-UHFFFAOYSA-N	CCNc1nc(N)c(s1)C(=C(C#N)C#N)c2ccccc2	BroadT	BRD-K91990892	BRD-K91990892-001-06-5	Asinex Ltd.	BAS 00537271			CCNc1nc(N)c(s1)C(=C(C#N)C#N)c1ccccc1	InChI=1S/C15H13N5S/c1-2-19-15-20-14(18)13(21-15)12(11(8-16)9-17)10-6-4-3-5-7-10/h3-7H,2,18H2,1H3,(H,19,20)	UPSVKSUEPUIPCI-UHFFFAOYSA-N	295.089166156							115082
MLS000704135	LSM-26545	SID22414123, BRD-K51739279	843691	InChI=1S/C14H15N3OS2/c1-9-4-3-5-12(6-9)15-14(19)17-16-13(18)11-7-10(2)20-8-11/h3-8H,1-2H3,(H,16,18)(H2,15,17,19)	CDVVPAZWOVIUFY-UHFFFAOYSA-N	Cc1cccc(NC(=NNC(=O)c2csc(C)c2)S)c1	BroadT	BRD-K51739279	BRD-K51739279-001-05-9	Specs	AK-968/41923971			Cc1cc(cs1)C(=O)NN=C(S)Nc1cccc(C)c1	InChI=1S/C14H15N3OS2/c1-9-4-3-5-12(6-9)15-14(19)17-16-13(18)11-7-10(2)20-8-11/h3-8H,1-2H3,(H,16,18)(H2,15,17,19)	CDVVPAZWOVIUFY-UHFFFAOYSA-N	305.06565351							115083
BRD-A71557276	LSM-26546			InChI=1S/C16H12ClNO5/c1-9-5-2-3-6-10(9)18-13-12(17)15(20)23-16(13)22-14(19)11-7-4-8-21-11/h2-8,12,16H,1H3	APSCARLKDBOHLQ-UHFFFAOYSA-N	Cc1ccccc1N=C2C(OC(=O)c3occc3)OC(=O)C2Cl	BroadT	BRD-A71557276	BRD-A71557276-001-06-4	ChemDiv Inc.	4798-0009			Cc1ccccc1N=C1C(OC(=O)c2ccco2)OC(=O)C1Cl	InChI=1S/C16H12ClNO5/c1-9-5-2-3-6-10(9)18-13-12(17)15(20)23-16(13)22-14(19)11-7-4-8-21-11/h2-8,12,16H,1H3	APSCARLKDBOHLQ-UHFFFAOYSA-N	333.040400204							115084
AC1NEU7Y	LSM-26547	BRD-A78640654	4598116	InChI=1S/C23H22N2O4S/c1-2-28-18-12-14-19(15-13-18)30(26,27)25-24-21-16-23(17-8-4-3-5-9-17)29-22-11-7-6-10-20(21)22/h3-15,23,25H,2,16H2,1H3	TVQDTDRDHPFHTJ-UHFFFAOYSA-N	CCOc1ccc(cc1)S(=O)(=O)NN=C2CC(Oc3ccccc23)c4ccccc4	BroadT	BRD-A78640654	BRD-A78640654-001-05-5	Enamine Ltd.	T0506-1685			CCOc1ccc(cc1)S(=O)(=O)NN=C1CC(Oc2ccccc12)c1ccccc1	InChI=1S/C23H22N2O4S/c1-2-28-18-12-14-19(15-13-18)30(26,27)25-24-21-16-23(17-8-4-3-5-9-17)29-22-11-7-6-10-20(21)22/h3-15,23,25H,2,16H2,1H3	TVQDTDRDHPFHTJ-UHFFFAOYSA-N	422.130027894							115085
MLS000097589	LSM-26548	SID3717817, BRD-A46218757	3000152	InChI=1S/C18H19NO4/c1-19(11-13-7-3-4-8-14(13)21-2)18(20)17-12-22-15-9-5-6-10-16(15)23-17/h3-10,17H,11-12H2,1-2H3	BAEGBZISIZCDGP-UHFFFAOYSA-N	COc1ccccc1CN(C)C(=O)C2COc3ccccc3O2	BroadT	BRD-A46218757	BRD-A46218757-001-06-3	Enamine Ltd.	T5336237			COc1ccccc1CN(C)C(=O)C1COc2ccccc2O1	InChI=1S/C18H19NO4/c1-19(11-13-7-3-4-8-14(13)21-2)18(20)17-12-22-15-9-5-6-10-16(15)23-17/h3-10,17H,11-12H2,1-2H3	BAEGBZISIZCDGP-UHFFFAOYSA-N	313.131408098							131275
MLS000877345	LSM-26549	SID26661134, BRD-A28370127	16682183	InChI=1S/C25H24ClFN2O4/c1-15(2)23(31)29-11-9-24(10-12-29)25(22(30)19-13-18(27)7-8-21(19)32-24)14-20(28-33-25)16-3-5-17(26)6-4-16/h3-8,13,15H,9-12,14H2,1-2H3	DRFRKBFXLIYSKF-UHFFFAOYSA-N	CC(C)C(=O)N1CCC2(CC1)Oc3ccc(F)cc3C(=O)C24CC(=NO4)c5ccc(Cl)cc5	BroadT	BRD-A28370127	BRD-A28370127-001-05-9	University of California at Davis	PTJ3C6			CC(C)C(=O)N1CCC2(CC1)Oc1ccc(F)cc1C(=O)C21CC(=NO1)c1ccc(Cl)cc1	InChI=1S/C25H24ClFN2O4/c1-15(2)23(31)29-11-9-24(10-12-29)25(22(30)19-13-18(27)7-8-21(19)32-24)14-20(28-33-25)16-3-5-17(26)6-4-16/h3-8,13,15H,9-12,14H2,1-2H3	DRFRKBFXLIYSKF-UHFFFAOYSA-N	470.140863178							115088
SMR000079654	LSM-26550	SID4255144, BRD-K22375870	1205193	InChI=1S/C16H12ClN5OS2/c1-21-16(18-19-20-21)24-9-15(23)22-11-4-2-3-5-13(11)25-14-7-6-10(17)8-12(14)22/h2-8H,9H2,1H3	HJCBMYWBOPHAGQ-UHFFFAOYSA-N	Cn1nnnc1SCC(=O)N2c3ccccc3Sc4ccc(Cl)cc24	BroadT	BRD-K22375870	BRD-K22375870-001-04-4	ChemBridge Corporation	7933253			Cn1nnnc1SCC(=O)N1c2ccccc2Sc2ccc(Cl)cc12	InChI=1S/C16H12ClN5OS2/c1-21-16(18-19-20-21)24-9-15(23)22-11-4-2-3-5-13(11)25-14-7-6-10(17)8-12(14)22/h2-8H,9H2,1H3	HJCBMYWBOPHAGQ-UHFFFAOYSA-N	389.017179144							115089
SMR000060437	LSM-26551	SID3715014, BRD-K75383830	2999040	InChI=1S/C22H20FN5O/c23-18-9-7-17(8-10-18)21-20(15-28(26-21)19-5-2-1-3-6-19)22(29)25-11-4-13-27-14-12-24-16-27/h1-3,5-10,12,14-16H,4,11,13H2,(H,25,29)	YWHQYJNDMHIWAA-UHFFFAOYSA-N	Fc1ccc(cc1)c2nn(cc2C(=O)NCCCn3ccnc3)c4ccccc4	BroadT	BRD-K75383830	BRD-K75383830-001-05-0	Enamine Ltd.	T0502-7729			Fc1ccc(cc1)-c1nn(cc1C(=O)NCCCn1ccnc1)-c1ccccc1	InChI=1S/C22H20FN5O/c23-18-9-7-17(8-10-18)21-20(15-28(26-21)19-5-2-1-3-6-19)22(29)25-11-4-13-27-14-12-24-16-27/h1-3,5-10,12,14-16H,4,11,13H2,(H,25,29)	YWHQYJNDMHIWAA-UHFFFAOYSA-N	389.16518851							115090
MLS000083413	LSM-26552	SID865570, BRD-A54900462	666829	InChI=1S/C17H18N4O3/c1-9-3-4-12-13(7-9)11-5-6-14(10(2)16(11)24-17(12)22)23-8-15-18-20-21-19-15/h5-6,9H,3-4,7-8H2,1-2H3,(H,18,19,20,21)	XZYPMPKDHQMQGP-UHFFFAOYSA-N	CC1CCC2=C(C1)c3ccc(OCc4nn[nH]n4)c(C)c3OC2=O	BroadT	BRD-A54900462	BRD-A54900462-001-05-3	InterBioScreen Ltd.	STOCK5S-46618			CC1CCc2c(C1)c1ccc(OCc3nn[nH]n3)c(C)c1oc2=O	InChI=1S/C17H18N4O3/c1-9-3-4-12-13(7-9)11-5-6-14(10(2)16(11)24-17(12)22)23-8-15-18-20-21-19-15/h5-6,9H,3-4,7-8H2,1-2H3,(H,18,19,20,21)	XZYPMPKDHQMQGP-UHFFFAOYSA-N	326.137890476							115091
MLS000591696	LSM-26553	SID17503768, BRD-K00633144	1543852	InChI=1S/C18H11Cl2N3S/c19-15-5-3-12(8-16(15)20)11-24-18-13(9-21)4-6-17(23-18)14-2-1-7-22-10-14/h1-8,10H,11H2	RGPKBTUJNWWAHD-UHFFFAOYSA-N	Clc1ccc(CSc2nc(ccc2C#N)c3cccnc3)cc1Cl	BroadT	BRD-K00633144	BRD-K00633144-001-04-2	InterBioScreen Ltd.	STOCK3S-10959			Clc1ccc(CSc2nc(ccc2C#N)-c2cccnc2)cc1Cl	InChI=1S/C18H11Cl2N3S/c19-15-5-3-12(8-16(15)20)11-24-18-13(9-21)4-6-17(23-18)14-2-1-7-22-10-14/h1-8,10H,11H2	RGPKBTUJNWWAHD-UHFFFAOYSA-N	371.005073492							115092
MLS000540821	LSM-26554	SID17386357, BRD-K71233464	1026516	InChI=1S/C23H19NO6/c1-13-3-4-15(11-14(13)2)21(25)24-16-5-7-17(8-6-16)30-18-9-10-19(22(26)27)20(12-18)23(28)29/h3-12H,1-2H3,(H,24,25)(H,26,27)(H,28,29)	FHIYBDUACNKHBF-UHFFFAOYSA-N	Cc1ccc(cc1C)C(=O)Nc2ccc(Oc3ccc(C(=O)O)c(c3)C(=O)O)cc2	BroadT	BRD-K71233464	BRD-K71233464-001-05-4	Specs	AN-979/42273874			Cc1ccc(cc1C)C(=O)Nc1ccc(Oc2ccc(C(O)=O)c(c2)C(O)=O)cc1	InChI=1S/C23H19NO6/c1-13-3-4-15(11-14(13)2)21(25)24-16-5-7-17(8-6-16)30-18-9-10-19(22(26)27)20(12-18)23(28)29/h3-12H,1-2H3,(H,24,25)(H,26,27)(H,28,29)	FHIYBDUACNKHBF-UHFFFAOYSA-N	405.121237338							115093
6,7-Dimethoxy-n-(4-methylbenzyl)-4-quinazolinamine	LSM-26555	SID17411496, BRD-K87752722	1474885	InChI=1S/C18H19N3O2/c1-12-4-6-13(7-5-12)10-19-18-14-8-16(22-2)17(23-3)9-15(14)20-11-21-18/h4-9,11H,10H2,1-3H3,(H,19,20,21)	YAKWQVCFIIHGRR-UHFFFAOYSA-N	COc1cc2ncnc(NCc3ccc(C)cc3)c2cc1OC	BroadT	BRD-K87752722	BRD-K87752722-001-05-3	Key Organics Ltd.	11N-114			COc1cc2ncnc(NCc3ccc(C)cc3)c2cc1OC	InChI=1S/C18H19N3O2/c1-12-4-6-13(7-5-12)10-19-18-14-8-16(22-2)17(23-3)9-15(14)20-11-21-18/h4-9,11H,10H2,1-3H3,(H,19,20,21)	YAKWQVCFIIHGRR-UHFFFAOYSA-N	309.147726878							115094
MLS000717682	LSM-1320	SID24807366, BRD-A11929187, SID87225742	3193014	InChI=1S/C21H24N4O2S/c1-13-5-6-15-17(12-13)28-20-18(15)19(22-14(2)23-20)24-7-9-25(10-8-24)21(26)16-4-3-11-27-16/h3-4,11,13H,5-10,12H2,1-2H3	HXELDYRZCKHWSK-UHFFFAOYSA-N	CC1CCc2c(C1)sc3nc(C)nc(N4CCN(CC4)C(=O)c5occc5)c23	BroadT	BRD-A11929187	BRD-A11929187-001-06-6	Asinex Ltd.	ASN 05019661			CC1CCc2c(C1)sc1nc(C)nc(N3CCN(CC3)C(=O)c3ccco3)c21	InChI=1S/C21H24N4O2S/c1-13-5-6-15-17(12-13)28-20-18(15)19(22-14(2)23-20)24-7-9-25(10-8-24)21(26)16-4-3-11-27-16/h3-4,11,13H,5-10,12H2,1-2H3	HXELDYRZCKHWSK-UHFFFAOYSA-N	396.161996738							91533
BAS 02875928	LSM-26556	SID14725557, BRD-K48426893	1142116	InChI=1S/C22H18F3N3OS/c23-22(24,25)20-17-11-10-15-8-4-5-9-16(15)19(17)27-21(28-20)30-13-18(29)26-12-14-6-2-1-3-7-14/h1-9H,10-13H2,(H,26,29)	OMIFDDSDBIAWPJ-UHFFFAOYSA-N	FC(F)(F)c1nc(SCC(=O)NCc2ccccc2)nc3c1CCc4ccccc34	BroadT	BRD-K48426893	BRD-K48426893-001-05-5	Asinex Ltd.	BAS 02875928			FC(F)(F)c1nc(SCC(=O)NCc2ccccc2)nc-2c1CCc1ccccc-21	InChI=1S/C22H18F3N3OS/c23-22(24,25)20-17-11-10-15-8-4-5-9-16(15)19(17)27-21(28-20)30-13-18(29)26-12-14-6-2-1-3-7-14/h1-9H,10-13H2,(H,26,29)	OMIFDDSDBIAWPJ-UHFFFAOYSA-N	429.112267516							115095
1-[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]-1-ethylthiourea	LSM-26557	BRD-K79458448	3660272	InChI=1S/C10H19N7S/c1-4-12-8-14-9(13-5-2)16-10(15-8)17(6-3)7(11)18/h4-6H2,1-3H3,(H2,11,18)(H2,12,13,14,15,16)	PNJNJSLWDICINV-UHFFFAOYSA-N	CCNc1nc(NCC)nc(n1)N(CC)C(=N)S	BroadT	BRD-K79458448	BRD-K79458448-001-05-0	InterBioScreen Ltd.	STOCK1S-26609			CCNc1nc(NCC)nc(n1)N(CC)C(S)=N	InChI=1S/C10H19N7S/c1-4-12-8-14-9(13-5-2)16-10(15-8)17(6-3)7(11)18/h4-6H2,1-3H3,(H2,11,18)(H2,12,13,14,15,16)	PNJNJSLWDICINV-UHFFFAOYSA-N	269.142264368							115096
SMR000021556	LSM-26558	SID24838953, SID4244409, BRD-K61680422	3239011	InChI=1S/C30H40N2O4/c1-29(2)16-22-27(24(33)18-29)26(20-6-8-21(35-5)9-7-20)28-23(17-30(3,4)19-25(28)34)32(22)11-10-31-12-14-36-15-13-31/h6-9,26H,10-19H2,1-5H3	QSDLLOZCZGCZKG-UHFFFAOYSA-N	COc1ccc(cc1)C2C3=C(CC(C)(C)CC3=O)N(CCN4CCOCC4)C5=C2C(=O)CC(C)(C)C5	BroadT	BRD-K61680422	BRD-K61680422-001-05-9	ChemDiv Inc.	C047-0116			COc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)N(CCN2CCOCC2)C2=C1C(=O)CC(C)(C)C2	InChI=1S/C30H40N2O4/c1-29(2)16-22-27(24(33)18-29)26(20-6-8-21(35-5)9-7-20)28-23(17-30(3,4)19-25(28)34)32(22)11-10-31-12-14-36-15-13-31/h6-9,26H,10-19H2,1-5H3	QSDLLOZCZGCZKG-UHFFFAOYSA-N	492.29880778							115097
MLS000578477	LSM-44186	SID17434064, BRD-K21570970	1310155	InChI=1S/C22H20N2O3S2/c1-14-11-16(15(2)24(14)17-6-8-18(26-3)9-7-17)12-20-21(25)23(22(28)29-20)13-19-5-4-10-27-19/h4-12H,13H2,1-3H3/b20-12-	KWPXITIHJMLUTL-NDENLUEZSA-N	COc1ccc(cc1)n2c(C)cc(\C=C\3/SC(=S)N(Cc4occc4)C3=O)c2C	BroadT	BRD-K21570970	BRD-K21570970-001-06-5	ChemBridge Corporation	7479653			COc1ccc(cc1)-n1c(C)cc(\C=C2/SC(=S)N(Cc3ccco3)C2=O)c1C	InChI=1S/C22H20N2O3S2/c1-14-11-16(15(2)24(14)17-6-8-18(26-3)9-7-17)12-20-21(25)23(22(28)29-20)13-19-5-4-10-27-19/h4-12H,13H2,1-3H3/b20-12-	KWPXITIHJMLUTL-NDENLUEZSA-N	424.0915339							
MLS000106657	LSM-26560	SID7976079, BRD-K01129951	784359	InChI=1S/C15H17NO2S/c1-18-14-9-11(7-8-13(14)17)10-16-12-5-3-4-6-15(12)19-2/h3-9,16-17H,10H2,1-2H3	MVAFKNJHVWDJGK-UHFFFAOYSA-N	COc1cc(CNc2ccccc2SC)ccc1O	BroadT	BRD-K01129951	BRD-K01129951-001-06-7	ChemBridge Corporation	5460975			COc1cc(CNc2ccccc2SC)ccc1O	InChI=1S/C15H17NO2S/c1-18-14-9-11(7-8-13(14)17)10-16-12-5-3-4-6-15(12)19-2/h3-9,16-17H,10H2,1-2H3	MVAFKNJHVWDJGK-UHFFFAOYSA-N	275.097999484							115099
BRD-A01494972	LSM-26561			InChI=1S/C26H29N3O6/c1-3-28-19-8-5-4-7-18(19)26(25(28)33)21(22(30)20-10-9-17(2)35-20)23(31)24(32)29(26)12-6-11-27-13-15-34-16-14-27/h4-5,7-10,21H,3,6,11-16H2,1-2H3	LDEAOGJYCWIDPI-UHFFFAOYSA-N	CCN1C(=O)C2(C(C(=O)c3oc(C)cc3)C(=O)C(=O)N2CCCN4CCOCC4)c5ccccc15	BroadT	BRD-A01494972	BRD-A01494972-001-05-4	InterBioScreen Ltd.	STOCK4S-56913			CCN1C(=O)C2(C(C(=O)c3ccc(C)o3)C(=O)C(=O)N2CCCN2CCOCC2)c2ccccc12	InChI=1S/C26H29N3O6/c1-3-28-19-8-5-4-7-18(19)26(25(28)33)21(22(30)20-10-9-17(2)35-20)23(31)24(32)29(26)12-6-11-27-13-15-34-16-14-27/h4-5,7-10,21H,3,6,11-16H2,1-2H3	LDEAOGJYCWIDPI-UHFFFAOYSA-N	479.205635678							115100
SMR000647254	LSM-26562	SID49820088, BRD-A62591979	4015762	InChI=1S/C28H31N5O5/c1-17-6-4-11-33-25(17)31-26-21(28(33)35)15-20(27(34)30-16-19-7-5-13-38-19)24(29)32(26)12-10-18-8-9-22(36-2)23(14-18)37-3/h4,6,8-9,11,14-15,19,29H,5,7,10,12-13,16H2,1-3H3,(H,30,34)	OKNNYFBGZAFSPA-UHFFFAOYSA-N	COc1ccc(CCN2C(=N)C(=CC3=C2N=C4N(C=CC=C4C)C3=O)C(=O)NCC5CCCO5)cc1OC	BroadT	BRD-A62591979	BRD-A62591979-001-05-6	InterBioScreen Ltd.	STOCK4S-76259			COc1ccc(CCn2c3nc4c(C)cccn4c(=O)c3cc(C(=O)NCC3CCCO3)c2=N)cc1OC	InChI=1S/C28H31N5O5/c1-17-6-4-11-33-25(17)31-26-21(28(33)35)15-20(27(34)30-16-19-7-5-13-38-19)24(29)32(26)12-10-18-8-9-22(36-2)23(14-18)37-3/h4,6,8-9,11,14-15,19,29H,5,7,10,12-13,16H2,1-3H3,(H,30,34)	OKNNYFBGZAFSPA-UHFFFAOYSA-N	517.232519142							115101
ASN 09114597	LSM-26563	SID848768, BRD-K69383473	651223	InChI=1S/C14H11N5OS/c1-19(13(20)11-5-3-7-16-9-11)14-18-17-12(21-14)10-4-2-6-15-8-10/h2-9H,1H3	FASDLJZKZQRXCL-UHFFFAOYSA-N	CN(C(=O)c1cccnc1)c2nnc(s2)c3cccnc3	BroadT	BRD-K69383473	BRD-K69383473-001-05-0	Asinex Ltd.	ASN 09114597			CN(C(=O)c1cccnc1)c1nnc(s1)-c1cccnc1	InChI=1S/C14H11N5OS/c1-19(13(20)11-5-3-7-16-9-11)14-18-17-12(21-14)10-4-2-6-15-8-10/h2-9H,1H3	FASDLJZKZQRXCL-UHFFFAOYSA-N	297.068430712							115102
6-(2,5-Dimethoxyphenyl)-3-[3-(propan-2-yloxy)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine	LSM-26564	SID861119, BRD-K56477505	662384	InChI=1S/C21H22N4O3S/c1-13(2)28-16-7-5-6-14(10-16)20-22-23-21-25(20)24-18(12-29-21)17-11-15(26-3)8-9-19(17)27-4/h5-11,13H,12H2,1-4H3	BJHKYFFVKNFAFN-UHFFFAOYSA-N	COc1ccc(OC)c(c1)C2=Nn3c(SC2)nnc3c4cccc(OC(C)C)c4	BroadT	BRD-K56477505	BRD-K56477505-001-05-7	InterBioScreen Ltd.	STOCK4S-03907			COc1ccc(OC)c(c1)C1=Nn2c(SC1)nnc2-c1cccc(OC(C)C)c1	InChI=1S/C21H22N4O3S/c1-13(2)28-16-7-5-6-14(10-16)20-22-23-21-25(20)24-18(12-29-21)17-11-15(26-3)8-9-19(17)27-4/h5-11,13H,12H2,1-4H3	BJHKYFFVKNFAFN-UHFFFAOYSA-N	410.141261294							115103
MLS000544364	LSM-26565	BRD-K82602420	1209058	InChI=1S/C15H10ClN3O2/c16-12-5-1-10(2-6-12)14-9-15(18-17-14)11-3-7-13(8-4-11)19(20)21/h1-9H,(H,17,18)	QSWCWEZCOFJLMS-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)c2cc([nH]n2)c3ccc(Cl)cc3	BroadT	BRD-K82602420	BRD-K82602420-001-05-0	Specs	AE-848/30721052			[O-][N+](=O)c1ccc(cc1)-c1cc([nH]n1)-c1ccc(Cl)cc1	InChI=1S/C15H10ClN3O2/c16-12-5-1-10(2-6-12)14-9-15(18-17-14)11-3-7-13(8-4-11)19(20)21/h1-9H,(H,17,18)	QSWCWEZCOFJLMS-UHFFFAOYSA-N	299.0461543							115104
F0331-0134	LSM-26566	SID24836736, BRD-K61048130	2382083	InChI=1S/C12H15N5OS2/c1-2-13-11(19)17-16-10(18)7-20-12-14-8-5-3-4-6-9(8)15-12/h3-6H,2,7H2,1H3,(H,14,15)(H,16,18)(H2,13,17,19)	TUEDXKYOMFHLPF-UHFFFAOYSA-N	CCN=C(S)NNC(=O)CSc1nc2ccccc2[nH]1	BroadT	BRD-K61048130	BRD-K61048130-001-05-2	Enamine Ltd.	T0513-3575			CCN=C(S)NNC(=O)CSc1nc2ccccc2[nH]1	InChI=1S/C12H15N5OS2/c1-2-13-11(19)17-16-10(18)7-20-12-14-8-5-3-4-6-9(8)15-12/h3-6H,2,7H2,1H3,(H,14,15)(H,16,18)(H2,13,17,19)	TUEDXKYOMFHLPF-UHFFFAOYSA-N	309.07180153							115105
ZINC03338432	LSM-26567	SID24791774, BRD-K09760553	2454688	InChI=1S/C17H12N4O2S2/c22-14-12-8-4-5-9-13(12)15(23)21(14)10-24-17-20-19-16(25-17)18-11-6-2-1-3-7-11/h1-9H,10H2,(H,18,19)	TYSLCUFVJVGIDQ-UHFFFAOYSA-N	O=C1N(CSc2nnc(Nc3ccccc3)s2)C(=O)c4ccccc14	BroadT	BRD-K09760553	BRD-K09760553-001-05-5	Enamine Ltd.	T5311322			O=C1N(CSc2nnc(Nc3ccccc3)s2)C(=O)c2ccccc12	InChI=1S/C17H12N4O2S2/c22-14-12-8-4-5-9-13(12)15(23)21(14)10-24-17-20-19-16(25-17)18-11-6-2-1-3-7-11/h1-9H,10H2,(H,18,19)	TYSLCUFVJVGIDQ-UHFFFAOYSA-N	368.040167044							115106
SMR000154886	LSM-44187	SID14744109, BRD-K86963651	2456996	InChI=1S/C21H20N2O2/c1-21(2)14-9-5-6-10-15(14)23(3)18(21)12-16(24)20-19(22)13-8-4-7-11-17(13)25-20/h4-12H,22H2,1-3H3/b18-12-	GTGGBHFTZAOINR-PDGQHHTCSA-N	CN1\C(=C/C(=O)c2oc3ccccc3c2N)\C(C)(C)c4ccccc14	BroadT	BRD-K86963651	BRD-K86963651-001-05-2	Enamine Ltd.	T0518-3979			CN1c2ccccc2C(C)(C)\C1=C\C(=O)c1oc2ccccc2c1N	InChI=1S/C21H20N2O2/c1-21(2)14-9-5-6-10-15(14)23(3)18(21)12-16(24)20-19(22)13-8-4-7-11-17(13)25-20/h4-12H,22H2,1-3H3/b18-12-	GTGGBHFTZAOINR-PDGQHHTCSA-N	332.1524779							
T0506-8422	LSM-26569	SID22403701, BRD-K56221708	2381586	InChI=1S/C22H19ClN4/c23-16-11-9-15(10-12-16)20-14-18(17-6-3-4-7-19(17)24-20)22-26-25-21-8-2-1-5-13-27(21)22/h3-4,6-7,9-12,14H,1-2,5,8,13H2	BIXSQXUNILNRJU-UHFFFAOYSA-N	Clc1ccc(cc1)c2cc(c3nnc4CCCCCn34)c5ccccc5n2	BroadT	BRD-K56221708	BRD-K56221708-001-07-0	Enamine Ltd.	T0506-8422			Clc1ccc(cc1)-c1cc(-c2nnc3CCCCCn23)c2ccccc2n1	InChI=1S/C22H19ClN4/c23-16-11-9-15(10-12-16)20-14-18(17-6-3-4-7-19(17)24-20)22-26-25-21-8-2-1-5-13-27(21)22/h3-4,6-7,9-12,14H,1-2,5,8,13H2	BIXSQXUNILNRJU-UHFFFAOYSA-N	374.129824358							115108
ST50449078	LSM-26570	SID17387920, BRD-A58837359	3414515	InChI=1S/C30H30N4O2/c1-18(2)19-10-12-20(13-11-19)28-23(17-34(33-28)21-8-6-5-7-9-21)26-22(16-31)29(32)36-25-15-30(3,4)14-24(35)27(25)26/h5-13,17-18,26H,14-15,32H2,1-4H3	OCFSEPBSLYJRJI-UHFFFAOYSA-N	CC(C)c1ccc(cc1)c2nn(cc2C3C(=C(N)OC4=C3C(=O)CC(C)(C)C4)C#N)c5ccccc5	BroadT	BRD-A58837359	BRD-A58837359-001-05-9	Specs	AG-690/37079216			CC(C)c1ccc(cc1)-c1nn(cc1C1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2)-c1ccccc1	InChI=1S/C30H30N4O2/c1-18(2)19-10-12-20(13-11-19)28-23(17-34(33-28)21-8-6-5-7-9-21)26-22(16-31)29(32)36-25-15-30(3,4)14-24(35)27(25)26/h5-13,17-18,26H,14-15,32H2,1-4H3	OCFSEPBSLYJRJI-UHFFFAOYSA-N	478.23687624							115109
3-Chloro-n-{4-[(phenylacetyl)amino]phenyl}benzamide	LSM-26571	SID17433383, BRD-K27900780	1361396	InChI=1S/C21H17ClN2O2/c22-17-8-4-7-16(14-17)21(26)24-19-11-9-18(10-12-19)23-20(25)13-15-5-2-1-3-6-15/h1-12,14H,13H2,(H,23,25)(H,24,26)	SFJBKKLZHJKIGK-UHFFFAOYSA-N	Clc1cccc(c1)C(=O)Nc2ccc(NC(=O)Cc3ccccc3)cc2	BroadT	BRD-K27900780	BRD-K27900780-001-05-0	ChemBridge Corporation	5839902			Clc1cccc(c1)C(=O)Nc1ccc(NC(=O)Cc2ccccc2)cc1	InChI=1S/C21H17ClN2O2/c22-17-8-4-7-16(14-17)21(26)24-19-11-9-18(10-12-19)23-20(25)13-15-5-2-1-3-6-15/h1-12,14H,13H2,(H,23,25)(H,24,26)	SFJBKKLZHJKIGK-UHFFFAOYSA-N	364.097855514							115110
AK-778/41050986	LSM-26572	SID843777, BRD-A91426462	646082	InChI=1S/C25H21NO5/c1-16-6-9-18(10-7-16)21(27)13-25(29)19-4-2-3-5-20(19)26(24(25)28)14-17-8-11-22-23(12-17)31-15-30-22/h2-12,29H,13-15H2,1H3	COQRQYLRLFIBOS-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)CC2(O)C(=O)N(Cc3ccc4OCOc4c3)c5ccccc25	BroadT	BRD-A91426462	BRD-A91426462-001-05-4	Asinex Ltd.	BAS 04819155			Cc1ccc(cc1)C(=O)CC1(O)C(=O)N(Cc2ccc3OCOc3c2)c2ccccc12	InChI=1S/C25H21NO5/c1-16-6-9-18(10-7-16)21(27)13-25(29)19-4-2-3-5-20(19)26(24(25)28)14-17-8-11-22-23(12-17)31-15-30-22/h2-12,29H,13-15H2,1H3	COQRQYLRLFIBOS-UHFFFAOYSA-N	415.141972782							115111
MLS000778759	LSM-26573	SID26660850, BRD-A03925449	5219557	InChI=1S/C24H21N3O5/c1-29-18-8-5-14(10-20(18)30-2)21-17-7-6-15(28)11-19(17)32-24-22(21)23(25)27(13-26-24)12-16-4-3-9-31-16/h3-11,13,21,25,28H,12H2,1-2H3	DYUPIQFGYZQMGK-UHFFFAOYSA-N	COc1ccc(cc1OC)C2C3=C(Oc4cc(O)ccc24)N=CN(Cc5occc5)C3=N	BroadT	BRD-A03925449	BRD-A03925449-001-06-8	InterBioScreen Ltd.	STOCK4S-79964			COc1ccc(cc1OC)C1c2ccc(O)cc2Oc2ncn(Cc3ccco3)c(=N)c12	InChI=1S/C24H21N3O5/c1-29-18-8-5-14(10-20(18)30-2)21-17-7-6-15(28)11-19(17)32-24-22(21)23(25)27(13-26-24)12-16-4-3-9-31-16/h3-11,13,21,25,28H,12H2,1-2H3	DYUPIQFGYZQMGK-UHFFFAOYSA-N	431.148120802							115112
AC1MFLMO	LSM-26574	SID7973933, BRD-A30257315	2921163	InChI=1S/C20H18F2N2O4/c1-12-16(18(25)27-11-13-7-3-2-4-8-13)17(24-20(26)23-12)14-9-5-6-10-15(14)28-19(21)22/h2-10,17,19H,11H2,1H3,(H2,23,24,26)	VRZFQPRZNSDGPI-UHFFFAOYSA-N	CC1=C(C(NC(=O)N1)c2ccccc2OC(F)F)C(=O)OCc3ccccc3	BroadT	BRD-A30257315	BRD-A30257315-001-06-4	ChemBridge Corporation	6971822			CC1=C(C(NC(=O)N1)c1ccccc1OC(F)F)C(=O)OCc1ccccc1	InChI=1S/C20H18F2N2O4/c1-12-16(18(25)27-11-13-7-3-2-4-8-13)17(24-20(26)23-12)14-9-5-6-10-15(14)28-19(21)22/h2-10,17,19H,11H2,1H3,(H2,23,24,26)	VRZFQPRZNSDGPI-UHFFFAOYSA-N	388.123463476							115113
MLS000055548	LSM-26575	SID3716447, BRD-K12052661	678368	InChI=1S/C16H13N5S/c1-4-8-13-10(5-1)14-15(17-9-18-16(14)22-13)21-12-7-3-2-6-11(12)19-20-21/h2-3,6-7,9H,1,4-5,8H2	MHKFSUVKILPXAD-UHFFFAOYSA-N	C1CCc2c(C1)sc3ncnc(c23)n4nnc5ccccc45	BroadT	BRD-K12052661	BRD-K12052661-001-05-1	Enamine Ltd.	T0500-9204			C1CCc2c(C1)sc1ncnc(-n3nnc4ccccc34)c21	InChI=1S/C16H13N5S/c1-4-8-13-10(5-1)14-15(17-9-18-16(14)22-13)21-12-7-3-2-6-11(12)19-20-21/h2-3,6-7,9H,1,4-5,8H2	MHKFSUVKILPXAD-UHFFFAOYSA-N	307.089166156							115114
SMR000062706	LSM-26576	SID3713870, BRD-K13985009	2421979	InChI=1S/C18H21N3O3/c1-2-24-17-6-4-3-5-16(17)19-11-13-20(14-12-19)18(22)15-7-9-21(23)10-8-15/h3-10H,2,11-14H2,1H3	QTMDBZSXBAOBSP-UHFFFAOYSA-N	CCOc1ccccc1N2CCN(CC2)C(=O)c3cc[n+]([O-])cc3	BroadT	BRD-K13985009	BRD-K13985009-001-05-2	Enamine Ltd.	T0515-7511			CCOc1ccccc1N1CCN(CC1)C(=O)c1cc[n+]([O-])cc1	InChI=1S/C18H21N3O3/c1-2-24-17-6-4-3-5-16(17)19-11-13-20(14-12-19)18(22)15-7-9-21(23)10-8-15/h3-10H,2,11-14H2,1H3	QTMDBZSXBAOBSP-UHFFFAOYSA-N	327.158291562							115115
SMR000117842	LSM-44188	SID14725672, BRD-K03756240	789261	InChI=1S/C8H5BrN2O2/c9-7-2-1-6(13-7)3-5(4-10)8(11)12/h1-3H,(H2,11,12)/b5-3-	DSPQMKOMBMQWDD-HYXAFXHYSA-N	NC(=O)\C(=C/c1oc(Br)cc1)\C#N	BroadT	BRD-K03756240	BRD-K03756240-001-06-6	Asinex Ltd.	BAS 00779683			NC(=O)C(=C/c1ccc(Br)o1)\C#N	InChI=1S/C8H5BrN2O2/c9-7-2-1-6(13-7)3-5(4-10)8(11)12/h1-3H,(H2,11,12)/b5-3-	DSPQMKOMBMQWDD-HYXAFXHYSA-N	239.95344002							
2-(4-Nitrophenoxy)-1-[4-(4-phenylphthalazin-1-yl)piperazin-1-yl]ethanone	LSM-26578	SID26665458, BRD-K57604476	6404186	InChI=1S/C26H23N5O4/c32-24(18-35-21-12-10-20(11-13-21)31(33)34)29-14-16-30(17-15-29)26-23-9-5-4-8-22(23)25(27-28-26)19-6-2-1-3-7-19/h1-13H,14-18H2	PVJUCSOYEJNSRU-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(OCC(=O)N2CCN(CC2)c3nnc(c4ccccc4)c5ccccc35)cc1	BroadT	BRD-K57604476	BRD-K57604476-001-05-0	InterBioScreen Ltd.	STOCK3S-98927			[O-][N+](=O)c1ccc(OCC(=O)N2CCN(CC2)c2nnc(-c3ccccc3)c3ccccc23)cc1	InChI=1S/C26H23N5O4/c32-24(18-35-21-12-10-20(11-13-21)31(33)34)29-14-16-30(17-15-29)26-23-9-5-4-8-22(23)25(27-28-26)19-6-2-1-3-7-19/h1-13H,14-18H2	PVJUCSOYEJNSRU-UHFFFAOYSA-N	469.175004266							115117
T5531597	LSM-26579	SID49672767, BRD-A84419568	16290602	InChI=1S/C26H29ClN2O2/c27-23-12-7-13-24(18-23)29-16-14-28(15-17-29)19-25(30)20-31-26(21-8-3-1-4-9-21)22-10-5-2-6-11-22/h1-13,18,25-26,30H,14-17,19-20H2	VRJIARCVQYLUSK-UHFFFAOYSA-N	OC(COC(c1ccccc1)c2ccccc2)CN3CCN(CC3)c4cccc(Cl)c4	BroadT	BRD-A84419568	BRD-A84419568-001-05-1	Enamine Ltd.	T5531597			OC(COC(c1ccccc1)c1ccccc1)CN1CCN(CC1)c1cccc(Cl)c1	InChI=1S/C26H29ClN2O2/c27-23-12-7-13-24(18-23)29-16-14-28(15-17-29)19-25(30)20-31-26(21-8-3-1-4-9-21)22-10-5-2-6-11-22/h1-13,18,25-26,30H,14-17,19-20H2	VRJIARCVQYLUSK-UHFFFAOYSA-N	436.191755898							115118
ZINC00623036	LSM-26580	SID24826414, BRD-K06888640	979004	InChI=1S/C18H18N4O4S2/c1-18(2,3)14-15(24)22-16(20-19-14)28-17(21-22)27-9-11(23)10-4-5-12-13(8-10)26-7-6-25-12/h4-5,8H,6-7,9H2,1-3H3	GBODLDMNXWLBRB-UHFFFAOYSA-N	CC(C)(C)C1=NN=C2SC(=NN2C1=O)SCC(=O)c3ccc4OCCOc4c3	BroadT	BRD-K06888640	BRD-K06888640-001-05-2	Enamine Ltd.	T5337830			CC(C)(C)c1nnc2sc(SCC(=O)c3ccc4OCCOc4c3)nn2c1=O	InChI=1S/C18H18N4O4S2/c1-18(2,3)14-15(24)22-16(20-19-14)28-17(21-22)27-9-11(23)10-4-5-12-13(8-10)26-7-6-25-12/h4-5,8H,6-7,9H2,1-3H3	GBODLDMNXWLBRB-UHFFFAOYSA-N	418.076946476							115119
T5257977	LSM-26581	SID3716528, BRD-K75290520	2080384	InChI=1S/C17H13BrN2O4/c18-13-6-8-14(9-7-13)22-11-16(21)23-10-15-19-20-17(24-15)12-4-2-1-3-5-12/h1-9H,10-11H2	XYHGIDNNAFOFSL-UHFFFAOYSA-N	Brc1ccc(OCC(=O)OCc2oc(nn2)c3ccccc3)cc1	BroadT	BRD-K75290520	BRD-K75290520-001-05-2	Enamine Ltd.	T5257977			Brc1ccc(OCC(=O)OCc2nnc(o2)-c2ccccc2)cc1	InChI=1S/C17H13BrN2O4/c18-13-6-8-14(9-7-13)22-11-16(21)23-10-15-19-20-17(24-15)12-4-2-1-3-5-12/h1-9H,10-11H2	XYHGIDNNAFOFSL-UHFFFAOYSA-N	388.005869516							115120
MLS000672249	LSM-15568	BRD-K60247522	2199925	InChI=1S/C13H21NO/c1-10-8-11(2)12(3)13(9-10)15-7-5-6-14-4/h8-9,14H,5-7H2,1-4H3	VFEHOEAMLKLDHI-UHFFFAOYSA-N	CNCCCOc1cc(C)cc(C)c1C	BroadT	BRD-K60247522	BRD-K60247522-034-06-6	ChemBridge Corporation	7715062		OC(=O)C(=O)O	CNCCCOc1cc(C)cc(C)c1C.OC(=O)C(=O)O	InChI=1S/C13H21NO.C2H2O4/c1-10-8-11(2)12(3)13(9-10)15-7-5-6-14-4;3-1(4)2(5)6/h8-9,14H,5-7H2,1-4H3;(H,3,4)(H,5,6)	CPIISYNSHPFAKQ-UHFFFAOYSA-N	207.162314302							104204, 104204
MLS000528749	LSM-26582	SID14726680, BRD-K82683513	1469660	InChI=1S/C23H23F3N6O2S/c1-2-34-16-4-5-17-20(12-16)35-22(27-17)28-21(33)13-31-9-7-15(8-10-31)32-19-6-3-14(23(24,25)26)11-18(19)29-30-32/h3-6,11-12,15H,2,7-10,13H2,1H3,(H,27,28,33)	PHQQBFKDTXONPB-UHFFFAOYSA-N	CCOc1ccc2nc(NC(=O)CN3CCC(CC3)n4nnc5cc(ccc45)C(F)(F)F)sc2c1	BroadT	BRD-K82683513	BRD-K82683513-001-06-6	Asinex Ltd.	ASN 06365339			CCOc1ccc2nc(NC(=O)CN3CCC(CC3)n3nnc4cc(ccc34)C(F)(F)F)sc2c1	InChI=1S/C23H23F3N6O2S/c1-2-34-16-4-5-17-20(12-16)35-22(27-17)28-21(33)13-31-9-7-15(8-10-31)32-19-6-3-14(23(24,25)26)11-18(19)29-30-32/h3-6,11-12,15H,2,7-10,13H2,1H3,(H,27,28,33)	PHQQBFKDTXONPB-UHFFFAOYSA-N	504.155529326							115121
BRD-K75626008	LSM-26583		54633251	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m0/s1	IPCOCSCQFWJAQB-BXTJHSDWSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K75626008	BRD-K75626008-001-01-7	Broad Institute of MIT and Harvard	BRD-K75626008			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m0/s1	IPCOCSCQFWJAQB-BXTJHSDWSA-N	435.236935806							115122
BRD-K36055854	LSM-26584		54633391	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25+/m0/s1	KLLGWSLDFNRCLI-XHNVNVPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(CC4CCOCC4)C[C@@H]1C	BroadT	BRD-K36055854	BRD-K36055854-001-01-2	Broad Institute of MIT and Harvard	BRD-K36055854			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(CC2CCOCC2)C[C@@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25+/m0/s1	KLLGWSLDFNRCLI-XHNVNVPESA-N	487.304621442							115123
BRD-K34524418	LSM-26585		54633456	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18+,23+/m0/s1	GMUJITXJIMGEOF-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K34524418	BRD-K34524418-001-01-8	Broad Institute of MIT and Harvard	BRD-K34524418			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18+,23+/m0/s1	GMUJITXJIMGEOF-YZZKKUAISA-N	513.281441326							115124
BRD-K12708839	LSM-26586		54633495	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16+,21-/m1/s1	DJUMVAZPGRPTOB-VWKPWSFCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3nccs3)C[C@H]1C	BroadT	BRD-K12708839	BRD-K12708839-001-01-4	Broad Institute of MIT and Harvard	BRD-K12708839			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16+,21-/m1/s1	DJUMVAZPGRPTOB-VWKPWSFCSA-N	460.214426234							115125
BRD-K44858727	LSM-26587		54633437	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24+/m1/s1	CIVNAWRIQAGZDO-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K44858727	BRD-K44858727-001-01-4	Broad Institute of MIT and Harvard	BRD-K44858727			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24+/m1/s1	CIVNAWRIQAGZDO-YTZAWJCFSA-N	482.252920228							115126
BRD-K64827406	LSM-26588		54633393	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25+/m0/s1	KLLGWSLDFNRCLI-OSWQYVSFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(CC4CCOCC4)C[C@@H]1C	BroadT	BRD-K64827406	BRD-K64827406-001-01-2	Broad Institute of MIT and Harvard	BRD-K64827406			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(CC2CCOCC2)C[C@@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25+/m0/s1	KLLGWSLDFNRCLI-OSWQYVSFSA-N	487.304621442							115127
BRD-K96417480	LSM-26589		54633443	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-20-21(11-19)35-14-18(6)30(25(33)27-16(3)4)12-17(5)22(34-8)13-29(7)23(20)31/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18-,22+/m1/s1	JABHCOSNXLYONB-HMFYCAOWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K96417480	BRD-K96417480-001-01-3	Broad Institute of MIT and Harvard	BRD-K96417480			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-20-21(11-19)35-14-18(6)30(25(33)27-16(3)4)12-17(5)22(34-8)13-29(7)23(20)31/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18-,22+/m1/s1	JABHCOSNXLYONB-HMFYCAOWSA-N	491.310769462							115128
BRD-K06264262	LSM-26590		54633274	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18+,23+/m0/s1	SZRRAHWFAJRXLY-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K06264262	BRD-K06264262-001-01-2	Broad Institute of MIT and Harvard	BRD-K06264262			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18+,23+/m0/s1	SZRRAHWFAJRXLY-YZZKKUAISA-N	488.29987042							115129
BRD-K89952634	LSM-26591		54633436	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24+/m0/s1	CIVNAWRIQAGZDO-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K89952634	BRD-K89952634-001-01-3	Broad Institute of MIT and Harvard	BRD-K89952634			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24+/m0/s1	CIVNAWRIQAGZDO-LLJLJFOGSA-N	482.252920228							115130
BRD-K85659077	LSM-26592		54633409	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15-,19-/m0/s1	UQDKPOMZCZHHDG-DOXZYTNZSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K85659077	BRD-K85659077-001-01-2	Broad Institute of MIT and Harvard	BRD-K85659077			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15-,19-/m0/s1	UQDKPOMZCZHHDG-DOXZYTNZSA-N	427.214091876							115131
BRD-K27476515	LSM-26593		54633253	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20-/m0/s1	IPCOCSCQFWJAQB-MDOVXXIYSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K27476515	BRD-K27476515-001-01-2	Broad Institute of MIT and Harvard	BRD-K27476515			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20-/m0/s1	IPCOCSCQFWJAQB-MDOVXXIYSA-N	435.236935806							115132
BRD-K38519440	LSM-26594		54633345	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28-/m1/s1	GRFOSLOREGQSPJ-DQCZWYHMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(Cc4ccccn4)C[C@H]1C	BroadT	BRD-K38519440	BRD-K38519440-001-01-6	Broad Institute of MIT and Harvard	BRD-K38519440			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28-/m1/s1	GRFOSLOREGQSPJ-DQCZWYHMSA-N	552.240640982							115133
BRD-K35936801	LSM-26595		54633490	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16-,21+/m1/s1	DJUMVAZPGRPTOB-ZOCZFRKYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3nccs3)C[C@H]1C	BroadT	BRD-K35936801	BRD-K35936801-001-01-8	Broad Institute of MIT and Harvard	BRD-K35936801			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16-,21+/m1/s1	DJUMVAZPGRPTOB-ZOCZFRKYSA-N	460.214426234							115134
BRD-K51320582	LSM-26596		54633237	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16+,20-/m0/s1	BDXAOMRZMUOHST-YRNRMSPPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K51320582	BRD-K51320582-001-01-9	Broad Institute of MIT and Harvard	BRD-K51320582			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16+,20-/m0/s1	BDXAOMRZMUOHST-YRNRMSPPSA-N	484.235555602							115135
BRD-K33179234	LSM-26597		54633402	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17+,23-/m0/s1	UPIUFFQPNYDCFX-MFEFFIJZSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@H]1C)OC	BroadT	BRD-K33179234	BRD-K33179234-001-01-4	Broad Institute of MIT and Harvard	BRD-K33179234			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@H]1C)OC	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17+,23-/m0/s1	UPIUFFQPNYDCFX-MFEFFIJZSA-N	501.295119398							115136
BRD-K73014869	LSM-26598		54633486	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20+,25-/m0/s1	JAZMVIWKDLKWHZ-DFIYOIEZSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccncc3)[C@H](C)COc2c1	BroadT	BRD-K73014869	BRD-K73014869-001-01-6	Broad Institute of MIT and Harvard	BRD-K73014869			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccncc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20+,25-/m0/s1	JAZMVIWKDLKWHZ-DFIYOIEZSA-N	482.289305736							115137
BRD-K45348630	LSM-26599		54633334	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22-/m0/s1	YXLXBGWRVYMONT-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K45348630	BRD-K45348630-001-01-1	Broad Institute of MIT and Harvard	BRD-K45348630			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22-/m0/s1	YXLXBGWRVYMONT-WCJKSRRJSA-N	458.232933712							115138
BRD-K65933652	LSM-26600		54633263	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16-,22-/m1/s1	OTCOGNWSMBTRMR-XCGNWRKASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC3CC3	BroadT	BRD-K65933652	BRD-K65933652-001-01-8	Broad Institute of MIT and Harvard	BRD-K65933652			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16-,22-/m1/s1	OTCOGNWSMBTRMR-XCGNWRKASA-N	445.25767125							115139
BRD-K36382446	LSM-26601		54633338	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17-,22+/m1/s1	FXOJDLIATDATEB-YVHKJVDXSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	BroadT	BRD-K36382446	BRD-K36382446-001-01-5	Broad Institute of MIT and Harvard	BRD-K36382446			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17-,22+/m1/s1	FXOJDLIATDATEB-YVHKJVDXSA-N	483.248169206							115140
BRD-K84391462	LSM-26602		54633419	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15+,21-/m1/s1	OTZAREIZRHIYQA-LRAJWGHMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C3CC3	BroadT	BRD-K84391462	BRD-K84391462-001-01-6	Broad Institute of MIT and Harvard	BRD-K84391462			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15+,21-/m1/s1	OTZAREIZRHIYQA-LRAJWGHMSA-N	431.242021186							115141
BRD-K94845132	LSM-26603		54633347	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28+/m1/s1	GRFOSLOREGQSPJ-XJGOYTCSSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(Cc4ccccn4)C[C@H]1C	BroadT	BRD-K94845132	BRD-K94845132-001-01-9	Broad Institute of MIT and Harvard	BRD-K94845132			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28+/m1/s1	GRFOSLOREGQSPJ-XJGOYTCSSA-N	552.240640982							115142
BRD-K16264250	LSM-26604		54633433	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16-,22-/m0/s1	YNEIZQUEDXPWMX-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(CC3CC3)C[C@@H]1C	BroadT	BRD-K16264250	BRD-K16264250-001-01-4	Broad Institute of MIT and Harvard	BRD-K16264250			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16-,22-/m0/s1	YNEIZQUEDXPWMX-WCJKSRRJSA-N	417.26275663							115143
BRD-K68162101	LSM-26605		54633455	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18+,23+/m1/s1	GMUJITXJIMGEOF-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K68162101	BRD-K68162101-001-01-8	Broad Institute of MIT and Harvard	BRD-K68162101			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18+,23+/m1/s1	GMUJITXJIMGEOF-STSQHVNTSA-N	513.281441326							115144
BRD-K12099407	LSM-26606		54633356	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16-,21-/m0/s1	FNRFWBTYLPGHMZ-QYWGDWMGSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K12099407	BRD-K12099407-001-01-0	Broad Institute of MIT and Harvard	BRD-K12099407			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H]1C)OC	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16-,21-/m0/s1	FNRFWBTYLPGHMZ-QYWGDWMGSA-N	445.25767125							115145
BRD-K11516621	LSM-26607		54633463	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15+,20+/m0/s1	IQGWQEXQBGDRAI-BXTJHSDWSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K11516621	BRD-K11516621-001-01-4	Broad Institute of MIT and Harvard	BRD-K11516621			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15+,20+/m0/s1	IQGWQEXQBGDRAI-BXTJHSDWSA-N	455.209006496							115146
BRD-K00765599	LSM-26608		54633366	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21-/m0/s1	ADNFOFPYARHFIV-MRUHUIDDSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K00765599	BRD-K00765599-001-01-8	Broad Institute of MIT and Harvard	BRD-K00765599			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21-/m0/s1	ADNFOFPYARHFIV-MRUHUIDDSA-N	433.25767125							115147
BRD-K54115231	LSM-26609		54633198	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19+,26+/m0/s1	FHVMFMOLSIFJFC-GNBJCERTSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K54115231	BRD-K54115231-001-01-5	Broad Institute of MIT and Harvard	BRD-K54115231			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19+,26+/m0/s1	FHVMFMOLSIFJFC-GNBJCERTSA-N	497.268984862							115148
BRD-K74198088	LSM-26610		54633369	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m1/s1	GETIABPODKAIIC-SXGZJXTBSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K74198088	BRD-K74198088-001-01-1	Broad Institute of MIT and Harvard	BRD-K74198088			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m1/s1	GETIABPODKAIIC-SXGZJXTBSA-N	419.242021186							115149
BRD-K12411112	LSM-26611		54633246	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19+,25-/m1/s1	CNOFTFCPQVHJBJ-HHJKRLRDSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K12411112	BRD-K12411112-001-01-3	Broad Institute of MIT and Harvard	BRD-K12411112			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19+,25-/m1/s1	CNOFTFCPQVHJBJ-HHJKRLRDSA-N	513.263899482							115150
BRD-K69375224	LSM-26612		54633231	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16-,20-/m1/s1	BDXAOMRZMUOHST-JXXFODFXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K69375224	BRD-K69375224-001-01-7	Broad Institute of MIT and Harvard	BRD-K69375224			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16-,20-/m1/s1	BDXAOMRZMUOHST-JXXFODFXSA-N	484.235555602							115151
BRD-K64001802	LSM-26613		54633351	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28-/m1/s1	GRFOSLOREGQSPJ-RZIGYZOXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H](C)N(Cc4ccccn4)C[C@H]1C	BroadT	BRD-K64001802	BRD-K64001802-001-01-4	Broad Institute of MIT and Harvard	BRD-K64001802			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28-/m1/s1	GRFOSLOREGQSPJ-RZIGYZOXSA-N	552.240640982							115152
BRD-K31377965	LSM-26614		54633413	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15-,21+/m0/s1	OTZAREIZRHIYQA-VFCRVFHLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C3CC3	BroadT	BRD-K31377965	BRD-K31377965-001-01-1	Broad Institute of MIT and Harvard	BRD-K31377965			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15-,21+/m0/s1	OTZAREIZRHIYQA-VFCRVFHLSA-N	431.242021186							115153
BRD-K91795767	LSM-26615		54633323	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21-/m0/s1	HHYKIZYLLRVKIM-MRUHUIDDSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K91795767	BRD-K91795767-001-01-1	Broad Institute of MIT and Harvard	BRD-K91795767			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21-/m0/s1	HHYKIZYLLRVKIM-MRUHUIDDSA-N	495.15946949							115154
BRD-K64451058	LSM-26616		54633472	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20-,26-/m1/s1	SPHXOOCVMGXZSD-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc4ccncc4)C[C@H]1C	BroadT	BRD-K64451058	BRD-K64451058-001-01-2	Broad Institute of MIT and Harvard	BRD-K64451058			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20-,26-/m1/s1	SPHXOOCVMGXZSD-XMERXJNXSA-N	494.289305736							131276
BRD-K54036439	LSM-26617		54633374	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15+,20-/m0/s1	GETIABPODKAIIC-MDOVXXIYSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K54036439	BRD-K54036439-001-01-3	Broad Institute of MIT and Harvard	BRD-K54036439			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15+,20-/m0/s1	GETIABPODKAIIC-MDOVXXIYSA-N	419.242021186							115157
BRD-K63654001	LSM-26618		54633215	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m1/s1	BCUUTPUMPAWJAT-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K63654001	BRD-K63654001-001-01-0	Broad Institute of MIT and Harvard	BRD-K63654001			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m1/s1	BCUUTPUMPAWJAT-SAHWJRBASA-N	472.248583776							115158
BRD-K75327442-001-01-6	LSM-26619	BRD-K75327442	54633188	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21-,26+/m1/s1	PEHKQIRDOAVSKY-YPCDYVTLSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K75327442	BRD-K75327442-001-01-6	Broad Institute of MIT and Harvard	BRD-K75327442			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21-,26+/m1/s1	PEHKQIRDOAVSKY-YPCDYVTLSA-N	481.294056758							115159
BRD-K89305325	LSM-26620		54633233	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16+,20+/m1/s1	BDXAOMRZMUOHST-GUXCAODWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K89305325	BRD-K89305325-001-01-8	Broad Institute of MIT and Harvard	BRD-K89305325			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16+,20+/m1/s1	BDXAOMRZMUOHST-GUXCAODWSA-N	484.235555602							115160
BRD-K49908787	LSM-26621		54633228	InChI=1S/C28H41N3O5/c1-18-15-31(27(33)21-8-6-5-7-9-21)19(2)17-36-24-14-22(29-26(32)20-10-11-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h12-14,18-21,25H,5-11,15-17H2,1-4H3,(H,29,32)/t18-,19-,25+/m0/s1	HUUYFVWWRMTXKP-XHNVNVPESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C4CCCCC4	BroadT	BRD-K49908787	BRD-K49908787-001-01-9	Broad Institute of MIT and Harvard	BRD-K49908787			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CCCCC1	InChI=1S/C28H41N3O5/c1-18-15-31(27(33)21-8-6-5-7-9-21)19(2)17-36-24-14-22(29-26(32)20-10-11-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h12-14,18-21,25H,5-11,15-17H2,1-4H3,(H,29,32)/t18-,19-,25+/m0/s1	HUUYFVWWRMTXKP-XHNVNVPESA-N	499.304621442							115161
BRD-K70302892	LSM-26622		54633387	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23-/m0/s1	HWGKHULHTVQYGT-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K70302892	BRD-K70302892-001-01-9	Broad Institute of MIT and Harvard	BRD-K70302892			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23-/m0/s1	HWGKHULHTVQYGT-MFEFFIJZSA-N	491.209006496							115162
BRD-K59120074	LSM-26623		54633450	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-14-23(30-28(34)29-22-8-6-5-7-9-22)12-13-24(25)27(33)31(3)17-26(19)35-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20-,26+/m0/s1	LRUQUVHRPDASPT-CUVVAGTFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K59120074	BRD-K59120074-001-01-0	Broad Institute of MIT and Harvard	BRD-K59120074			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-14-23(30-28(34)29-22-8-6-5-7-9-22)12-13-24(25)27(33)31(3)17-26(19)35-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20-,26+/m0/s1	LRUQUVHRPDASPT-CUVVAGTFSA-N	494.289305736							115163
BRD-K51017127	LSM-26624		54633364	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21+/m0/s1	ADNFOFPYARHFIV-GCKMJXCFSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K51017127	BRD-K51017127-001-01-3	Broad Institute of MIT and Harvard	BRD-K51017127			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21+/m0/s1	ADNFOFPYARHFIV-GCKMJXCFSA-N	433.25767125							115164
BRD-K24614157	LSM-26625		54633506	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20-,29+/m0/s1	DXCXCRUBZQZACJ-QWQFASRJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(Cc4cc(F)ccc4F)C[C@@H]1C	BroadT	BRD-K24614157	BRD-K24614157-001-01-4	Broad Institute of MIT and Harvard	BRD-K24614157			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@H](C)N(Cc2cc(F)ccc2F)C[C@@H]1C	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20-,29+/m0/s1	DXCXCRUBZQZACJ-QWQFASRJSA-N	605.217126508							115165
BRD-K39342915	LSM-26626		54633439	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24+/m0/s1	CIVNAWRIQAGZDO-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K39342915	BRD-K39342915-001-01-8	Broad Institute of MIT and Harvard	BRD-K39342915			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24+/m0/s1	CIVNAWRIQAGZDO-HOOSLVGPSA-N	482.252920228							115166
BRD-K31325635	LSM-26627		54633466	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15+,20-/m1/s1	IQGWQEXQBGDRAI-QEEYODRMSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K31325635	BRD-K31325635-001-01-0	Broad Institute of MIT and Harvard	BRD-K31325635			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15+,20-/m1/s1	IQGWQEXQBGDRAI-QEEYODRMSA-N	455.209006496							115167
BRD-K51654114	LSM-26628		54633400	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17+,23+/m0/s1	UPIUFFQPNYDCFX-YGKZAACZSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@H]1C)OC	BroadT	BRD-K51654114	BRD-K51654114-001-01-8	Broad Institute of MIT and Harvard	BRD-K51654114			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@H]1C)OC	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17+,23+/m0/s1	UPIUFFQPNYDCFX-YGKZAACZSA-N	501.295119398							115168
BRD-K98541397	LSM-26629		54633496	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	AMWULHWHNZGRQW-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccccn3	BroadT	BRD-K98541397	BRD-K98541397-001-01-0	Broad Institute of MIT and Harvard	BRD-K98541397			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccn1	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	AMWULHWHNZGRQW-SEPYTNNBSA-N	468.237270164							115169
BRD-K11227160	LSM-26630		54633431	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16+,22+/m1/s1	YNEIZQUEDXPWMX-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(CC3CC3)C[C@H]1C	BroadT	BRD-K11227160	BRD-K11227160-001-01-5	Broad Institute of MIT and Harvard	BRD-K11227160			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16+,22+/m1/s1	YNEIZQUEDXPWMX-VVBPWWLESA-N	417.26275663							115170
BRD-K68078571	LSM-26631		54633415	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15+,21+/m1/s1	OTZAREIZRHIYQA-WIEQDCTASA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C3CC3	BroadT	BRD-K68078571	BRD-K68078571-001-01-7	Broad Institute of MIT and Harvard	BRD-K68078571			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15+,21+/m1/s1	OTZAREIZRHIYQA-WIEQDCTASA-N	431.242021186							115171
BRD-K40266835	LSM-26632		54633428	InChI=1S/C23H38N4O4/c1-8-27-12-16(4)21(30-7)13-26(6)22(28)19-11-18(25-23(29)24-15(2)3)9-10-20(19)31-14-17(27)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,24,25,29)/t16-,17-,21-/m1/s1	ACRVFZXZQIIBSJ-CBGDNZLLSA-N	CCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K40266835	BRD-K40266835-001-01-3	Broad Institute of MIT and Harvard	BRD-K40266835			CCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H]1C)OC	InChI=1S/C23H38N4O4/c1-8-27-12-16(4)21(30-7)13-26(6)22(28)19-11-18(25-23(29)24-15(2)3)9-10-20(19)31-14-17(27)5/h9-11,15-17,21H,8,12-14H2,1-7H3,(H2,24,25,29)/t16-,17-,21-/m1/s1	ACRVFZXZQIIBSJ-CBGDNZLLSA-N	434.289305736							115172
BRD-K95943192	LSM-26633		54633191	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21-,26-/m0/s1	PEHKQIRDOAVSKY-WOVHNISZSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K95943192	BRD-K95943192-001-01-8	Broad Institute of MIT and Harvard	BRD-K95943192			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21-,26-/m0/s1	PEHKQIRDOAVSKY-WOVHNISZSA-N	481.294056758							115173
BRD-K30418433	LSM-26634		54633207	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20-/m1/s1	IKJJLFFXKGXEKB-GQIGUUNPSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K30418433	BRD-K30418433-001-01-8	Broad Institute of MIT and Harvard	BRD-K30418433			CCCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20-/m1/s1	IKJJLFFXKGXEKB-GQIGUUNPSA-N	405.26275663							115174
BRD-K77241556	LSM-26635		54633504	InChI=1S/C29H33FN6O5/c1-18-15-36(28(38)24-14-31-11-12-32-24)19(2)17-41-25-10-9-22(13-23(25)27(37)35(3)16-26(18)40-4)34-29(39)33-21-7-5-20(30)6-8-21/h5-14,18-19,26H,15-17H2,1-4H3,(H2,33,34,39)/t18-,19-,26-/m1/s1	SKVAANJMWULWKE-LJKQEARRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4cnccn4	BroadT	BRD-K77241556	BRD-K77241556-001-01-9	Broad Institute of MIT and Harvard	BRD-K77241556			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(F)cc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C29H33FN6O5/c1-18-15-36(28(38)24-14-31-11-12-32-24)19(2)17-41-25-10-9-22(13-23(25)27(37)35(3)16-26(18)40-4)34-29(39)33-21-7-5-20(30)6-8-21/h5-14,18-19,26H,15-17H2,1-4H3,(H2,33,34,39)/t18-,19-,26-/m1/s1	SKVAANJMWULWKE-LJKQEARRSA-N	564.249646416							115175
BRD-K38955287	LSM-26636		54633212	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m0/s1	BCUUTPUMPAWJAT-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K38955287	BRD-K38955287-001-01-8	Broad Institute of MIT and Harvard	BRD-K38955287			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m0/s1	BCUUTPUMPAWJAT-QQMNAOGKSA-N	472.248583776							115176
BRD-K43570522	LSM-26637		54633408	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15+,19+/m0/s1	UQDKPOMZCZHHDG-QMTMVMCOSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K43570522	BRD-K43570522-001-01-3	Broad Institute of MIT and Harvard	BRD-K43570522			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15+,19+/m0/s1	UQDKPOMZCZHHDG-QMTMVMCOSA-N	427.214091876							115177
BRD-K24385654	LSM-26638		54633352	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16-,21+/m0/s1	FNRFWBTYLPGHMZ-CKJXQJPGSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K24385654	BRD-K24385654-001-01-9	Broad Institute of MIT and Harvard	BRD-K24385654			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H]1C)OC	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16-,21+/m0/s1	FNRFWBTYLPGHMZ-CKJXQJPGSA-N	445.25767125							115178
BRD-K15478481	LSM-26639		54633285	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21-,28+/m0/s1	HSWIGQKLSXZYGZ-YHGPEZAFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)c4ccccc4)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K15478481	BRD-K15478481-001-01-2	Broad Institute of MIT and Harvard	BRD-K15478481			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)-c3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21-,28+/m0/s1	HSWIGQKLSXZYGZ-YHGPEZAFSA-N	537.22974194							115179
BRD-K41829399	LSM-26640		54633298	InChI=1S/C31H36F2N4O4/c1-20-16-37(17-22-9-5-6-10-25(22)32)21(2)19-41-28-14-13-23(15-24(28)30(38)36(3)18-29(20)40-4)34-31(39)35-27-12-8-7-11-26(27)33/h5-15,20-21,29H,16-19H2,1-4H3,(H2,34,35,39)/t20-,21-,29-/m1/s1	HKYYWNCRFDPCOS-GVNDJSPXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(Cc4ccccc4F)C[C@H]1C	BroadT	BRD-K41829399	BRD-K41829399-001-01-5	Broad Institute of MIT and Harvard	BRD-K41829399			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(Cc2ccccc2F)C[C@H]1C	InChI=1S/C31H36F2N4O4/c1-20-16-37(17-22-9-5-6-10-25(22)32)21(2)19-41-28-14-13-23(15-24(28)30(38)36(3)18-29(20)40-4)34-31(39)35-27-12-8-7-11-26(27)33/h5-15,20-21,29H,16-19H2,1-4H3,(H2,34,35,39)/t20-,21-,29-/m1/s1	HKYYWNCRFDPCOS-GVNDJSPXSA-N	566.270462072							115180
BRD-K51237617	LSM-26641		54633427	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20-/m1/s1	PRQHOYZGRSXLAM-GQIGUUNPSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K51237617	BRD-K51237617-001-01-4	Broad Institute of MIT and Harvard	BRD-K51237617			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20-/m1/s1	PRQHOYZGRSXLAM-GQIGUUNPSA-N	420.273655672							115181
BRD-K87088675	LSM-26642		54633292	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-18(12-19(22)24(31)30(4)14-23(16)33-5)27-25(32)28-21-9-7-6-8-20(21)26/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m1/s1	DRBBUCMGGUNGRG-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3Cl)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K87088675	BRD-K87088675-001-01-8	Broad Institute of MIT and Harvard	BRD-K87088675			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3Cl)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-11-10-18(12-19(22)24(31)30(4)14-23(16)33-5)27-25(32)28-21-9-7-6-8-20(21)26/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m1/s1	DRBBUCMGGUNGRG-SEPYTNNBSA-N	488.219033286							115182
BRD-K02802091	LSM-26643		54633204	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20+/m0/s1	IKJJLFFXKGXEKB-RZQQEMMASA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K02802091	BRD-K02802091-001-01-0	Broad Institute of MIT and Harvard	BRD-K02802091			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20+/m0/s1	IKJJLFFXKGXEKB-RZQQEMMASA-N	405.26275663							115183
BRD-K60777422	LSM-26644		54633290	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28-/m0/s1	HSWIGQKLSXZYGZ-GTNJKRJXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)c4ccccc4)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K60777422	BRD-K60777422-001-01-3	Broad Institute of MIT and Harvard	BRD-K60777422			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)-c3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28-/m0/s1	HSWIGQKLSXZYGZ-GTNJKRJXSA-N	537.22974194							115184
BRD-K26026745	LSM-26645		54633467	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20-,26+/m0/s1	SPHXOOCVMGXZSD-CUVVAGTFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc4ccncc4)C[C@@H]1C	BroadT	BRD-K26026745	BRD-K26026745-001-01-8	Broad Institute of MIT and Harvard	BRD-K26026745			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20-,26+/m0/s1	SPHXOOCVMGXZSD-CUVVAGTFSA-N	494.289305736							115185
BRD-K84551755	LSM-26646		54633337	InChI=1S/C26H35N5O4/c1-17-13-31(14-19-5-6-19)18(2)16-35-23-11-20(29-25(32)22-12-27-9-10-28-22)7-8-21(23)26(33)30(3)15-24(17)34-4/h7-12,17-19,24H,5-6,13-16H2,1-4H3,(H,29,32)/t17-,18-,24-/m1/s1	OMCAOHFEXVQYKR-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K84551755	BRD-K84551755-001-01-1	Broad Institute of MIT and Harvard	BRD-K84551755			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cnccn3)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C26H35N5O4/c1-17-13-31(14-19-5-6-19)18(2)16-35-23-11-20(29-25(32)22-12-27-9-10-28-22)7-8-21(23)26(33)30(3)15-24(17)34-4/h7-12,17-19,24H,5-6,13-16H2,1-4H3,(H,29,32)/t17-,18-,24-/m1/s1	OMCAOHFEXVQYKR-QZTZHPFYSA-N	481.26890465							115186
BRD-K17675523	LSM-26647		54633478	InChI=1S/C28H39N3O5/c1-7-13-31-16-19(2)26(35-6)17-30(4)28(33)24-12-11-22(15-25(24)36-18-20(31)3)29-27(32)21-9-8-10-23(14-21)34-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H,29,32)/t19-,20+,26+/m1/s1	PRIYVIVOOHHDTI-GOHWNWGWSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H]1C)OC	BroadT	BRD-K17675523	BRD-K17675523-001-01-1	Broad Institute of MIT and Harvard	BRD-K17675523			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H]1C)OC	InChI=1S/C28H39N3O5/c1-7-13-31-16-19(2)26(35-6)17-30(4)28(33)24-12-11-22(15-25(24)36-18-20(31)3)29-27(32)21-9-8-10-23(14-21)34-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H,29,32)/t19-,20+,26+/m1/s1	PRIYVIVOOHHDTI-GOHWNWGWSA-N	497.288971378							115187
BRD-K63950697	LSM-26648		54633311	InChI=1S/C26H33N5O5/c1-16-13-31(26(34)21-12-27-9-10-28-21)17(2)15-36-22-11-19(29-24(32)18-5-6-18)7-8-20(22)25(33)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17+,23-/m1/s1	KUWUIGLKRHREQK-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c4cnccn4	BroadT	BRD-K63950697	BRD-K63950697-001-01-1	Broad Institute of MIT and Harvard	BRD-K63950697			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c1-16-13-31(26(34)21-12-27-9-10-28-21)17(2)15-36-22-11-19(29-24(32)18-5-6-18)7-8-20(22)25(33)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17+,23-/m1/s1	KUWUIGLKRHREQK-SAHWJRBASA-N	495.248169206							115188
BRD-K14392329	LSM-26649		54633394	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25-/m0/s1	KLLGWSLDFNRCLI-CEYNDMKZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(CC4CCOCC4)C[C@@H]1C	BroadT	BRD-K14392329	BRD-K14392329-001-01-2	Broad Institute of MIT and Harvard	BRD-K14392329			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(CC2CCOCC2)C[C@@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25-/m0/s1	KLLGWSLDFNRCLI-CEYNDMKZSA-N	487.304621442							115189
BRD-K63908919	LSM-26650		54633336	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	YXLXBGWRVYMONT-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K63908919	BRD-K63908919-001-01-1	Broad Institute of MIT and Harvard	BRD-K63908919			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	YXLXBGWRVYMONT-ZMPRRUGASA-N	458.232933712							115190
BRD-K80965028	LSM-26651		54633471	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20-,26-/m0/s1	SPHXOOCVMGXZSD-DYLHXGEVSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc4ccncc4)C[C@@H]1C	BroadT	BRD-K80965028	BRD-K80965028-001-01-8	Broad Institute of MIT and Harvard	BRD-K80965028			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20-,26-/m0/s1	SPHXOOCVMGXZSD-DYLHXGEVSA-N	494.289305736							115191
BRD-K41410736	LSM-26652		54633242	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19+,25+/m1/s1	CNOFTFCPQVHJBJ-WYEJZRMESA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K41410736	BRD-K41410736-001-01-6	Broad Institute of MIT and Harvard	BRD-K41410736			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19+,25+/m1/s1	CNOFTFCPQVHJBJ-WYEJZRMESA-N	513.263899482							115192
BRD-K76420749	LSM-26653		54633310	InChI=1S/C26H33N5O5/c1-16-13-31(26(34)21-12-27-9-10-28-21)17(2)15-36-22-11-19(29-24(32)18-5-6-18)7-8-20(22)25(33)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23-/m0/s1	KUWUIGLKRHREQK-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4cnccn4	BroadT	BRD-K76420749	BRD-K76420749-001-01-8	Broad Institute of MIT and Harvard	BRD-K76420749			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c1-16-13-31(26(34)21-12-27-9-10-28-21)17(2)15-36-22-11-19(29-24(32)18-5-6-18)7-8-20(22)25(33)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23-/m0/s1	KUWUIGLKRHREQK-QQMNAOGKSA-N	495.248169206							115193
BRD-K35196805	LSM-26654		54633497	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	AMWULHWHNZGRQW-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccccn3	BroadT	BRD-K35196805	BRD-K35196805-001-01-5	Broad Institute of MIT and Harvard	BRD-K35196805			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccn1	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	AMWULHWHNZGRQW-HKARXFIJSA-N	468.237270164							115194
BRD-K97938633	LSM-26655		54633382	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17-,23-/m1/s1	HWGKHULHTVQYGT-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K97938633	BRD-K97938633-001-01-3	Broad Institute of MIT and Harvard	BRD-K97938633			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17-,23-/m1/s1	HWGKHULHTVQYGT-SEPYTNNBSA-N	491.209006496							115195
BRD-K62320774	LSM-26656		54633318	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16-,21+/m1/s1	HHYKIZYLLRVKIM-ZOCZFRKYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K62320774	BRD-K62320774-001-01-4	Broad Institute of MIT and Harvard	BRD-K62320774			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16-,21+/m1/s1	HHYKIZYLLRVKIM-ZOCZFRKYSA-N	495.15946949							131277
BRD-K51600962	LSM-26657		54633340	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17+,22+/m1/s1	FXOJDLIATDATEB-JLHGSKIFSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K51600962	BRD-K51600962-001-01-4	Broad Institute of MIT and Harvard	BRD-K51600962			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17+,22+/m1/s1	FXOJDLIATDATEB-JLHGSKIFSA-N	483.248169206							115198
BRD-K53559383	LSM-26658		54633489	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16+,21+/m1/s1	DJUMVAZPGRPTOB-XFQAVAEZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3nccs3)C[C@H]1C	BroadT	BRD-K53559383	BRD-K53559383-001-01-1	Broad Institute of MIT and Harvard	BRD-K53559383			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16+,21+/m1/s1	DJUMVAZPGRPTOB-XFQAVAEZSA-N	460.214426234							115199
BRD-K80803211	LSM-26659		54633357	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16-,21-/m1/s1	FNRFWBTYLPGHMZ-WHSLLNHNSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H]1C)OC	BroadT	BRD-K80803211	BRD-K80803211-001-01-8	Broad Institute of MIT and Harvard	BRD-K80803211			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H]1C)OC	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16-,21-/m1/s1	FNRFWBTYLPGHMZ-WHSLLNHNSA-N	445.25767125							115200
BRD-K05015930	LSM-26660		54633305	InChI=1S/C27H34N4O5S2/c1-19-15-31(17-26-28-12-13-37-26)20(2)18-36-24-14-21(29-38(33,34)22-8-6-5-7-9-22)10-11-23(24)27(32)30(3)16-25(19)35-4/h5-14,19-20,25,29H,15-18H2,1-4H3/t19-,20+,25-/m1/s1	DFOOTVJERHUVDB-OHUGHZGNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K05015930	BRD-K05015930-001-01-1	Broad Institute of MIT and Harvard	BRD-K05015930			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C27H34N4O5S2/c1-19-15-31(17-26-28-12-13-37-26)20(2)18-36-24-14-21(29-38(33,34)22-8-6-5-7-9-22)10-11-23(24)27(32)30(3)16-25(19)35-4/h5-14,19-20,25,29H,15-18H2,1-4H3/t19-,20+,25-/m1/s1	DFOOTVJERHUVDB-OHUGHZGNSA-N	558.197061608							115201
BRD-K59535072	LSM-26661		54633401	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17-,23-/m0/s1	UPIUFFQPNYDCFX-QQMNAOGKSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H]1C)OC	BroadT	BRD-K59535072	BRD-K59535072-001-01-1	Broad Institute of MIT and Harvard	BRD-K59535072			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H]1C)OC	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17-,23-/m0/s1	UPIUFFQPNYDCFX-QQMNAOGKSA-N	501.295119398							115202
BRD-K59893572	LSM-26662		54633498	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	AMWULHWHNZGRQW-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccccn3	BroadT	BRD-K59893572	BRD-K59893572-001-01-9	Broad Institute of MIT and Harvard	BRD-K59893572			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccn1	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	AMWULHWHNZGRQW-QZMQVMSPSA-N	468.237270164							115203
BRD-K07473245	LSM-26663		54633421	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20+/m0/s1	PRQHOYZGRSXLAM-TWOQFEAHSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K07473245	BRD-K07473245-001-01-0	Broad Institute of MIT and Harvard	BRD-K07473245			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20+/m0/s1	PRQHOYZGRSXLAM-TWOQFEAHSA-N	420.273655672							115204
BRD-K57184082	LSM-26664		54633326	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-8-10-26-11-9-19)17(2)15-34-22-7-6-20(27-18(3)30)12-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	WMTZQZROEPTADL-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccncc3	BroadT	BRD-K57184082	BRD-K57184082-001-01-8	Broad Institute of MIT and Harvard	BRD-K57184082			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccncc1	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-8-10-26-11-9-19)17(2)15-34-22-7-6-20(27-18(3)30)12-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	WMTZQZROEPTADL-QZMQVMSPSA-N	468.237270164							115205
BRD-K35222206	LSM-26665		54633383	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17-,23+/m1/s1	HWGKHULHTVQYGT-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K35222206	BRD-K35222206-001-01-4	Broad Institute of MIT and Harvard	BRD-K35222206			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17-,23+/m1/s1	HWGKHULHTVQYGT-QZMQVMSPSA-N	491.209006496							115206
BRD-K15930345	LSM-26666		54633267	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16+,22+/m0/s1	OTCOGNWSMBTRMR-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC3CC3	BroadT	BRD-K15930345	BRD-K15930345-001-01-8	Broad Institute of MIT and Harvard	BRD-K15930345			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16+,22+/m0/s1	OTCOGNWSMBTRMR-WJONJSRFSA-N	445.25767125							115207
BRD-K76984291	LSM-26667		54633346	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28+/m0/s1	GRFOSLOREGQSPJ-RXYILKCJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H](C)N(Cc4ccccn4)C[C@@H]1C	BroadT	BRD-K76984291	BRD-K76984291-001-01-5	Broad Institute of MIT and Harvard	BRD-K76984291			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28+/m0/s1	GRFOSLOREGQSPJ-RXYILKCJSA-N	552.240640982							115208
BRD-K42480393	LSM-26668		54633403	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17+,23-/m1/s1	UPIUFFQPNYDCFX-SAHWJRBASA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H]1C)OC	BroadT	BRD-K42480393	BRD-K42480393-001-01-2	Broad Institute of MIT and Harvard	BRD-K42480393			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H]1C)OC	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17+,23-/m1/s1	UPIUFFQPNYDCFX-SAHWJRBASA-N	501.295119398							115209
BRD-K10580455	LSM-26669		54633367	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21-/m1/s1	ADNFOFPYARHFIV-VWKPWSFCSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K10580455	BRD-K10580455-001-01-2	Broad Institute of MIT and Harvard	BRD-K10580455			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21-/m1/s1	ADNFOFPYARHFIV-VWKPWSFCSA-N	433.25767125							115210
BRD-K39813155	LSM-26670		54633378	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24+/m0/s1	AWPMFDCDNKJCST-OBWXTZQISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K39813155	BRD-K39813155-001-01-7	Broad Institute of MIT and Harvard	BRD-K39813155			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24+/m0/s1	AWPMFDCDNKJCST-OBWXTZQISA-N	485.232599354							115211
BRD-K66963616	LSM-26671		54633484	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20+,25+/m1/s1	JAZMVIWKDLKWHZ-RNHFSVANSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccncc3)[C@@H](C)COc2c1	BroadT	BRD-K66963616	BRD-K66963616-001-01-9	Broad Institute of MIT and Harvard	BRD-K66963616			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccncc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20+,25+/m1/s1	JAZMVIWKDLKWHZ-RNHFSVANSA-N	482.289305736							115212
BRD-K53508363	LSM-26672		54633200	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19+,26-/m1/s1	FHVMFMOLSIFJFC-UYXZNNOOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K53508363	BRD-K53508363-001-01-2	Broad Institute of MIT and Harvard	BRD-K53508363			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19+,26-/m1/s1	FHVMFMOLSIFJFC-UYXZNNOOSA-N	497.268984862							115213
BRD-K69077676	LSM-26673		54633307	InChI=1S/C26H33N5O5/c1-16-13-31(26(34)21-12-27-9-10-28-21)17(2)15-36-22-11-19(29-24(32)18-5-6-18)7-8-20(22)25(33)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23+/m1/s1	KUWUIGLKRHREQK-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4cnccn4	BroadT	BRD-K69077676	BRD-K69077676-001-01-2	Broad Institute of MIT and Harvard	BRD-K69077676			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c1-16-13-31(26(34)21-12-27-9-10-28-21)17(2)15-36-22-11-19(29-24(32)18-5-6-18)7-8-20(22)25(33)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23+/m1/s1	KUWUIGLKRHREQK-QZMQVMSPSA-N	495.248169206							115214
BRD-K76618080	LSM-26674		54633386	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23+/m0/s1	HWGKHULHTVQYGT-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K76618080	BRD-K76618080-001-01-4	Broad Institute of MIT and Harvard	BRD-K76618080			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23+/m0/s1	HWGKHULHTVQYGT-YGKZAACZSA-N	491.209006496							115215
BRD-K17718789	LSM-26675		54633358	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16+,21-/m0/s1	FNRFWBTYLPGHMZ-MRUHUIDDSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H]1C)OC	BroadT	BRD-K17718789	BRD-K17718789-001-01-8	Broad Institute of MIT and Harvard	BRD-K17718789			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H]1C)OC	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16+,21-/m0/s1	FNRFWBTYLPGHMZ-MRUHUIDDSA-N	445.25767125							115216
BRD-K71590663	LSM-26676		54633202	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16-,20+/m1/s1	IKJJLFFXKGXEKB-QINHECLXSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K71590663	BRD-K71590663-001-01-5	Broad Institute of MIT and Harvard	BRD-K71590663			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16-,20+/m1/s1	IKJJLFFXKGXEKB-QINHECLXSA-N	405.26275663							131278
BRD-K71521842	LSM-26677		54633328	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-8-10-26-11-9-19)17(2)15-34-22-7-6-20(27-18(3)30)12-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	WMTZQZROEPTADL-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccncc3	BroadT	BRD-K71521842	BRD-K71521842-001-01-4	Broad Institute of MIT and Harvard	BRD-K71521842			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccncc1	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-8-10-26-11-9-19)17(2)15-34-22-7-6-20(27-18(3)30)12-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	WMTZQZROEPTADL-DGGJZMOXSA-N	468.237270164							115219
BRD-K10635555	LSM-26678		54633476	InChI=1S/C28H39N3O5/c1-7-13-31-16-19(2)26(35-6)17-30(4)28(33)24-12-11-22(15-25(24)36-18-20(31)3)29-27(32)21-9-8-10-23(14-21)34-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H,29,32)/t19-,20-,26+/m1/s1	PRIYVIVOOHHDTI-KYTVRQNUSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H]1C)OC	BroadT	BRD-K10635555	BRD-K10635555-001-01-3	Broad Institute of MIT and Harvard	BRD-K10635555			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H]1C)OC	InChI=1S/C28H39N3O5/c1-7-13-31-16-19(2)26(35-6)17-30(4)28(33)24-12-11-22(15-25(24)36-18-20(31)3)29-27(32)21-9-8-10-23(14-21)34-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H,29,32)/t19-,20-,26+/m1/s1	PRIYVIVOOHHDTI-KYTVRQNUSA-N	497.288971378							115220
BRD-K56125296	LSM-26679		54633440	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24-/m0/s1	CIVNAWRIQAGZDO-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K56125296	BRD-K56125296-001-01-4	Broad Institute of MIT and Harvard	BRD-K56125296			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24-/m0/s1	CIVNAWRIQAGZDO-XFAGBWLFSA-N	482.252920228							115221
BRD-K03343162	LSM-26680		54633241	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19-,25+/m0/s1	CNOFTFCPQVHJBJ-XHNVNVPESA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K03343162	BRD-K03343162-001-01-8	Broad Institute of MIT and Harvard	BRD-K03343162			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19-,25+/m0/s1	CNOFTFCPQVHJBJ-XHNVNVPESA-N	513.263899482							115222
BRD-K15502859	LSM-26681		54633500	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	AMWULHWHNZGRQW-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccccn3	BroadT	BRD-K15502859	BRD-K15502859-001-01-3	Broad Institute of MIT and Harvard	BRD-K15502859			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccn1	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	AMWULHWHNZGRQW-YGKZAACZSA-N	468.237270164							115223
BRD-K66883387	LSM-26682		54633240	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19-,25+/m1/s1	CNOFTFCPQVHJBJ-RRQZXNHTSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K66883387	BRD-K66883387-001-01-6	Broad Institute of MIT and Harvard	BRD-K66883387			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19-,25+/m1/s1	CNOFTFCPQVHJBJ-RRQZXNHTSA-N	513.263899482							115224
BRD-K38273665	LSM-26683		54633422	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20+/m1/s1	PRQHOYZGRSXLAM-QINHECLXSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K38273665	BRD-K38273665-001-01-8	Broad Institute of MIT and Harvard	BRD-K38273665			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20+/m1/s1	PRQHOYZGRSXLAM-QINHECLXSA-N	420.273655672							115225
BRD-K33283629	LSM-26684		54633192	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21+,26-/m0/s1	PEHKQIRDOAVSKY-UZINWLIJSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K33283629	BRD-K33283629-001-01-7	Broad Institute of MIT and Harvard	BRD-K33283629			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21+,26-/m0/s1	PEHKQIRDOAVSKY-UZINWLIJSA-N	481.294056758							115226
BRD-K69922285	LSM-26685		54633254	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20-/m1/s1	IPCOCSCQFWJAQB-QEEYODRMSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K69922285	BRD-K69922285-001-01-2	Broad Institute of MIT and Harvard	BRD-K69922285			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20-/m1/s1	IPCOCSCQFWJAQB-QEEYODRMSA-N	435.236935806							115227
BRD-K92650579	LSM-26686		54633330	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	YXLXBGWRVYMONT-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K92650579	BRD-K92650579-001-01-5	Broad Institute of MIT and Harvard	BRD-K92650579			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	YXLXBGWRVYMONT-MCFFVMPBSA-N	458.232933712							115228
BRD-K84936524	LSM-26687		54633395	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25-/m1/s1	KLLGWSLDFNRCLI-HHJKRLRDSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(CC4CCOCC4)C[C@H]1C	BroadT	BRD-K84936524	BRD-K84936524-001-01-4	Broad Institute of MIT and Harvard	BRD-K84936524			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25-/m1/s1	KLLGWSLDFNRCLI-HHJKRLRDSA-N	487.304621442							115229
BRD-K70538196-001-01-1	LSM-26688	BRD-K70538196	54633211	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m0/s1	BCUUTPUMPAWJAT-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K70538196	BRD-K70538196-001-01-1	Broad Institute of MIT and Harvard	BRD-K70538196			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m0/s1	BCUUTPUMPAWJAT-YGKZAACZSA-N	472.248583776							115230
BRD-K34274486	LSM-26689		54633372	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m0/s1	GETIABPODKAIIC-BXTJHSDWSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K34274486	BRD-K34274486-001-01-7	Broad Institute of MIT and Harvard	BRD-K34274486			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m0/s1	GETIABPODKAIIC-BXTJHSDWSA-N	419.242021186							115231
BRD-K56428170	LSM-26690		54633447	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-20-21(11-19)35-14-18(6)30(25(33)27-16(3)4)12-17(5)22(34-8)13-29(7)23(20)31/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22-/m0/s1	JABHCOSNXLYONB-SVMVAKDDSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K56428170	BRD-K56428170-001-01-3	Broad Institute of MIT and Harvard	BRD-K56428170			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-20-21(11-19)35-14-18(6)30(25(33)27-16(3)4)12-17(5)22(34-8)13-29(7)23(20)31/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22-/m0/s1	JABHCOSNXLYONB-SVMVAKDDSA-N	491.310769462							115232
BRD-K56783915	LSM-26691		54633327	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-8-10-26-11-9-19)17(2)15-34-22-7-6-20(27-18(3)30)12-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	WMTZQZROEPTADL-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccncc3	BroadT	BRD-K56783915	BRD-K56783915-001-01-1	Broad Institute of MIT and Harvard	BRD-K56783915			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccncc1	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-8-10-26-11-9-19)17(2)15-34-22-7-6-20(27-18(3)30)12-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	WMTZQZROEPTADL-HKARXFIJSA-N	468.237270164							115233
BRD-K78907463	LSM-26692		54633288	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28+/m0/s1	HSWIGQKLSXZYGZ-BALWLHIASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)c4ccccc4)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K78907463	BRD-K78907463-001-01-6	Broad Institute of MIT and Harvard	BRD-K78907463			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)-c3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28+/m0/s1	HSWIGQKLSXZYGZ-BALWLHIASA-N	537.22974194							115234
BRD-K65184008	LSM-26693		54633255	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22-/m1/s1	DKOCUBLREHHOPE-XCGNWRKASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K65184008	BRD-K65184008-001-01-9	Broad Institute of MIT and Harvard	BRD-K65184008			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22-/m1/s1	DKOCUBLREHHOPE-XCGNWRKASA-N	443.22203467							115235
BRD-K27398402	LSM-26694		54633457	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18-,23-/m1/s1	GMUJITXJIMGEOF-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K27398402	BRD-K27398402-001-01-4	Broad Institute of MIT and Harvard	BRD-K27398402			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18-,23-/m1/s1	GMUJITXJIMGEOF-PMAPCBKXSA-N	513.281441326							115236
BRD-K32862383	LSM-26695		54633473	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20+,26-/m0/s1	SPHXOOCVMGXZSD-UNVFRBQDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc4ccncc4)C[C@@H]1C	BroadT	BRD-K32862383	BRD-K32862383-001-01-5	Broad Institute of MIT and Harvard	BRD-K32862383			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20+,26-/m0/s1	SPHXOOCVMGXZSD-UNVFRBQDSA-N	494.289305736							115237
BRD-K52001024	LSM-26696		54633438	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24+/m1/s1	CIVNAWRIQAGZDO-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K52001024	BRD-K52001024-001-01-0	Broad Institute of MIT and Harvard	BRD-K52001024			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24+/m1/s1	CIVNAWRIQAGZDO-GGUMNFRJSA-N	482.252920228							115238
BRD-K32118188	LSM-26697		54633273	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18+,23+/m1/s1	SZRRAHWFAJRXLY-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K32118188	BRD-K32118188-001-01-9	Broad Institute of MIT and Harvard	BRD-K32118188			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18+,23+/m1/s1	SZRRAHWFAJRXLY-STSQHVNTSA-N	488.29987042							131279
BRD-K43306617	LSM-26698		54633344	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17+,22-/m1/s1	FXOJDLIATDATEB-HYFFOGBASA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K43306617	BRD-K43306617-001-01-8	Broad Institute of MIT and Harvard	BRD-K43306617			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17+,22-/m1/s1	FXOJDLIATDATEB-HYFFOGBASA-N	483.248169206							115241
BRD-K33236055	LSM-26699		54633488	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16-,21+/m0/s1	DJUMVAZPGRPTOB-CKJXQJPGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3nccs3)C[C@@H]1C	BroadT	BRD-K33236055	BRD-K33236055-001-01-8	Broad Institute of MIT and Harvard	BRD-K33236055			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16-,21+/m0/s1	DJUMVAZPGRPTOB-CKJXQJPGSA-N	460.214426234							115242
BRD-K44007425	LSM-26700		54633248	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m0/s1	IPCOCSCQFWJAQB-AUSJPIAWSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K44007425	BRD-K44007425-001-01-3	Broad Institute of MIT and Harvard	BRD-K44007425			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m0/s1	IPCOCSCQFWJAQB-AUSJPIAWSA-N	435.236935806							115243
BRD-K00059671	LSM-26701		54633243	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19+,25+/m0/s1	CNOFTFCPQVHJBJ-OSWQYVSFSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K00059671	BRD-K00059671-001-01-7	Broad Institute of MIT and Harvard	BRD-K00059671			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19+,25+/m0/s1	CNOFTFCPQVHJBJ-OSWQYVSFSA-N	513.263899482							115244
BRD-K87558616	LSM-26702		54633410	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15+,19-/m0/s1	UQDKPOMZCZHHDG-KHYOSLBOSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K87558616	BRD-K87558616-001-01-2	Broad Institute of MIT and Harvard	BRD-K87558616			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15+,19-/m0/s1	UQDKPOMZCZHHDG-KHYOSLBOSA-N	427.214091876							115245
BRD-K76135327	LSM-26703		54633494	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16+,21-/m0/s1	DJUMVAZPGRPTOB-MRUHUIDDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3nccs3)C[C@@H]1C	BroadT	BRD-K76135327	BRD-K76135327-001-01-2	Broad Institute of MIT and Harvard	BRD-K76135327			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16+,21-/m0/s1	DJUMVAZPGRPTOB-MRUHUIDDSA-N	460.214426234							115246
BRD-K92974694	LSM-26704		54633227	InChI=1S/C28H41N3O5/c1-18-15-31(27(33)21-8-6-5-7-9-21)19(2)17-36-24-14-22(29-26(32)20-10-11-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h12-14,18-21,25H,5-11,15-17H2,1-4H3,(H,29,32)/t18-,19-,25+/m1/s1	HUUYFVWWRMTXKP-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CCCCC4	BroadT	BRD-K92974694	BRD-K92974694-001-01-9	Broad Institute of MIT and Harvard	BRD-K92974694			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCCCC1	InChI=1S/C28H41N3O5/c1-18-15-31(27(33)21-8-6-5-7-9-21)19(2)17-36-24-14-22(29-26(32)20-10-11-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h12-14,18-21,25H,5-11,15-17H2,1-4H3,(H,29,32)/t18-,19-,25+/m1/s1	HUUYFVWWRMTXKP-RRQZXNHTSA-N	499.304621442							115247
BRD-K43854848	LSM-26705		54633449	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-14-23(30-28(34)29-22-8-6-5-7-9-22)12-13-24(25)27(33)31(3)17-26(19)35-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20-,26+/m1/s1	LRUQUVHRPDASPT-KYTVRQNUSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K43854848	BRD-K43854848-001-01-8	Broad Institute of MIT and Harvard	BRD-K43854848			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-14-23(30-28(34)29-22-8-6-5-7-9-22)12-13-24(25)27(33)31(3)17-26(19)35-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20-,26+/m1/s1	LRUQUVHRPDASPT-KYTVRQNUSA-N	494.289305736							115248
BRD-K28472865	LSM-26706		54633487	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20+,25-/m1/s1	JAZMVIWKDLKWHZ-OHUGHZGNSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccncc3)[C@@H](C)COc2c1	BroadT	BRD-K28472865	BRD-K28472865-001-01-6	Broad Institute of MIT and Harvard	BRD-K28472865			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccncc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20+,25-/m1/s1	JAZMVIWKDLKWHZ-OHUGHZGNSA-N	482.289305736							115249
BRD-K30795375	LSM-26707		54633380	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24-/m0/s1	AWPMFDCDNKJCST-SRGWNRLKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K30795375	BRD-K30795375-001-01-9	Broad Institute of MIT and Harvard	BRD-K30795375			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24-/m0/s1	AWPMFDCDNKJCST-SRGWNRLKSA-N	485.232599354							115250
BRD-K45642123	LSM-26708		54633350	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28-/m0/s1	GRFOSLOREGQSPJ-VPYPWEPUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H](C)N(Cc4ccccn4)C[C@@H]1C	BroadT	BRD-K45642123	BRD-K45642123-001-01-1	Broad Institute of MIT and Harvard	BRD-K45642123			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28-/m0/s1	GRFOSLOREGQSPJ-VPYPWEPUSA-N	552.240640982							115251
BRD-K95578456	LSM-26709		54633432	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16+,22+/m0/s1	YNEIZQUEDXPWMX-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(CC3CC3)C[C@@H]1C	BroadT	BRD-K95578456	BRD-K95578456-001-01-3	Broad Institute of MIT and Harvard	BRD-K95578456			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16+,22+/m0/s1	YNEIZQUEDXPWMX-WJONJSRFSA-N	417.26275663							115252
BRD-K39534157	LSM-26710		54633454	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18-,23+/m0/s1	GMUJITXJIMGEOF-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K39534157	BRD-K39534157-001-01-7	Broad Institute of MIT and Harvard	BRD-K39534157			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18-,23+/m0/s1	GMUJITXJIMGEOF-IUKKYPGJSA-N	513.281441326							115253
BRD-K12778320	LSM-26711		54633355	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16+,21+/m0/s1	FNRFWBTYLPGHMZ-GCKMJXCFSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H]1C)OC	BroadT	BRD-K12778320	BRD-K12778320-001-01-3	Broad Institute of MIT and Harvard	BRD-K12778320			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H]1C)OC	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16+,21+/m0/s1	FNRFWBTYLPGHMZ-GCKMJXCFSA-N	445.25767125							115254
BRD-K28375929	LSM-26712		54633459	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18+,23-/m1/s1	GMUJITXJIMGEOF-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K28375929	BRD-K28375929-001-01-5	Broad Institute of MIT and Harvard	BRD-K28375929			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18+,23-/m1/s1	GMUJITXJIMGEOF-IEGUWTFLSA-N	513.281441326							115255
BRD-K61274359	LSM-26713		54633277	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18+,23-/m1/s1	SZRRAHWFAJRXLY-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K61274359	BRD-K61274359-001-01-7	Broad Institute of MIT and Harvard	BRD-K61274359			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18+,23-/m1/s1	SZRRAHWFAJRXLY-IEGUWTFLSA-N	488.29987042							115256
BRD-K43203897	LSM-26714		54633235	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16+,20+/m0/s1	BDXAOMRZMUOHST-RZQQEMMASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K43203897	BRD-K43203897-001-01-8	Broad Institute of MIT and Harvard	BRD-K43203897			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16+,20+/m0/s1	BDXAOMRZMUOHST-RZQQEMMASA-N	484.235555602							115257
BRD-K12397820	LSM-26715		54633291	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28-/m1/s1	HSWIGQKLSXZYGZ-PHVLTXCSSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)c4ccccc4)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K12397820	BRD-K12397820-001-01-7	Broad Institute of MIT and Harvard	BRD-K12397820			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)-c3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28-/m1/s1	HSWIGQKLSXZYGZ-PHVLTXCSSA-N	537.22974194							115258
BRD-K67087027	LSM-26716		54633245	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19+,25-/m0/s1	CNOFTFCPQVHJBJ-CEYNDMKZSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K67087027	BRD-K67087027-001-01-9	Broad Institute of MIT and Harvard	BRD-K67087027			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19+,25-/m0/s1	CNOFTFCPQVHJBJ-CEYNDMKZSA-N	513.263899482							115259
BRD-K49570068	LSM-26717		54633201	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16-,20+/m0/s1	IKJJLFFXKGXEKB-TWOQFEAHSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K49570068	BRD-K49570068-001-01-7	Broad Institute of MIT and Harvard	BRD-K49570068			CCCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16-,20+/m0/s1	IKJJLFFXKGXEKB-TWOQFEAHSA-N	405.26275663							115260
BRD-K67572910	LSM-26718		54633375	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24+/m1/s1	AWPMFDCDNKJCST-OJLQRUNKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K67572910	BRD-K67572910-001-01-0	Broad Institute of MIT and Harvard	BRD-K67572910			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24+/m1/s1	AWPMFDCDNKJCST-OJLQRUNKSA-N	485.232599354							115261
BRD-K91003483	LSM-26719		54633216	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23-/m1/s1	WEWHHSRLSBIWPH-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K91003483	BRD-K91003483-001-01-3	Broad Institute of MIT and Harvard	BRD-K91003483			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23-/m1/s1	WEWHHSRLSBIWPH-SEPYTNNBSA-N	455.242021186							115262
BRD-K58883090	LSM-26720		54633199	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19+,26-/m0/s1	FHVMFMOLSIFJFC-ANSQWYIGSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K58883090	BRD-K58883090-001-01-4	Broad Institute of MIT and Harvard	BRD-K58883090			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19+,26-/m0/s1	FHVMFMOLSIFJFC-ANSQWYIGSA-N	497.268984862							115263
BRD-K30548577	LSM-26721		54633276	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18+,23-/m0/s1	SZRRAHWFAJRXLY-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K30548577	BRD-K30548577-001-01-8	Broad Institute of MIT and Harvard	BRD-K30548577			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18+,23-/m0/s1	SZRRAHWFAJRXLY-IXFSTUDKSA-N	488.29987042							115264
BRD-K64072266	LSM-26722		54633482	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20-,25+/m1/s1	JAZMVIWKDLKWHZ-FHAGJXEFSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccncc3)[C@H](C)COc2c1	BroadT	BRD-K64072266	BRD-K64072266-001-01-4	Broad Institute of MIT and Harvard	BRD-K64072266			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccncc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20-,25+/m1/s1	JAZMVIWKDLKWHZ-FHAGJXEFSA-N	482.289305736							115265
BRD-K70843862	LSM-26723		54633458	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18+,23-/m0/s1	GMUJITXJIMGEOF-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K70843862	BRD-K70843862-001-01-8	Broad Institute of MIT and Harvard	BRD-K70843862			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18+,23-/m0/s1	GMUJITXJIMGEOF-IXFSTUDKSA-N	513.281441326							115266
BRD-K92484282	LSM-26724		54633234	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16-,20+/m1/s1	BDXAOMRZMUOHST-QINHECLXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K92484282	BRD-K92484282-001-01-7	Broad Institute of MIT and Harvard	BRD-K92484282			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16-,20+/m1/s1	BDXAOMRZMUOHST-QINHECLXSA-N	484.235555602							115267
BRD-K47658117	LSM-26725		54633451	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-14-23(30-28(34)29-22-8-6-5-7-9-22)12-13-24(25)27(33)31(3)17-26(19)35-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26+/m1/s1	LRUQUVHRPDASPT-GOHWNWGWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K47658117	BRD-K47658117-001-01-3	Broad Institute of MIT and Harvard	BRD-K47658117			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-14-23(30-28(34)29-22-8-6-5-7-9-22)12-13-24(25)27(33)31(3)17-26(19)35-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26+/m1/s1	LRUQUVHRPDASPT-GOHWNWGWSA-N	494.289305736							115268
BRD-K29408413	LSM-26726		54633229	InChI=1S/C28H41N3O5/c1-18-15-31(27(33)21-8-6-5-7-9-21)19(2)17-36-24-14-22(29-26(32)20-10-11-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h12-14,18-21,25H,5-11,15-17H2,1-4H3,(H,29,32)/t18-,19+,25-/m0/s1	HUUYFVWWRMTXKP-CEYNDMKZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C4CCCCC4	BroadT	BRD-K29408413	BRD-K29408413-001-01-6	Broad Institute of MIT and Harvard	BRD-K29408413			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CCCCC1	InChI=1S/C28H41N3O5/c1-18-15-31(27(33)21-8-6-5-7-9-21)19(2)17-36-24-14-22(29-26(32)20-10-11-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h12-14,18-21,25H,5-11,15-17H2,1-4H3,(H,29,32)/t18-,19+,25-/m0/s1	HUUYFVWWRMTXKP-CEYNDMKZSA-N	499.304621442							115269
BRD-K46897949	LSM-26727		54633342	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17-,22-/m0/s1	FXOJDLIATDATEB-HOIFWPIMSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K46897949	BRD-K46897949-001-01-2	Broad Institute of MIT and Harvard	BRD-K46897949			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17-,22-/m0/s1	FXOJDLIATDATEB-HOIFWPIMSA-N	483.248169206							115270
BRD-K80950551	LSM-26728		54633411	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15+,19-/m1/s1	UQDKPOMZCZHHDG-ZRGWGRIASA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K80950551	BRD-K80950551-001-01-5	Broad Institute of MIT and Harvard	BRD-K80950551			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15+,19-/m1/s1	UQDKPOMZCZHHDG-ZRGWGRIASA-N	427.214091876							115271
BRD-K37402529	LSM-26729		54633505	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20-,29-/m1/s1	DXCXCRUBZQZACJ-NIAOJTHTSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(Cc4cc(F)ccc4F)C[C@H]1C	BroadT	BRD-K37402529	BRD-K37402529-001-01-0	Broad Institute of MIT and Harvard	BRD-K37402529			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cccc(F)c3)ccc2OC[C@@H](C)N(Cc2cc(F)ccc2F)C[C@H]1C	InChI=1S/C30H34F3N3O5S/c1-19-15-36(16-21-12-23(32)8-10-27(21)33)20(2)18-41-28-11-9-24(14-26(28)30(37)35(3)17-29(19)40-4)34-42(38,39)25-7-5-6-22(31)13-25/h5-14,19-20,29,34H,15-18H2,1-4H3/t19-,20-,29-/m1/s1	DXCXCRUBZQZACJ-NIAOJTHTSA-N	605.217126508							115272
BRD-K79997957	LSM-26730		54633480	InChI=1S/C28H39N3O5/c1-7-13-31-16-19(2)26(35-6)17-30(4)28(33)24-12-11-22(15-25(24)36-18-20(31)3)29-27(32)21-9-8-10-23(14-21)34-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H,29,32)/t19-,20+,26-/m0/s1	PRIYVIVOOHHDTI-UNVFRBQDSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H]1C)OC	BroadT	BRD-K79997957	BRD-K79997957-001-01-9	Broad Institute of MIT and Harvard	BRD-K79997957			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H]1C)OC	InChI=1S/C28H39N3O5/c1-7-13-31-16-19(2)26(35-6)17-30(4)28(33)24-12-11-22(15-25(24)36-18-20(31)3)29-27(32)21-9-8-10-23(14-21)34-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H,29,32)/t19-,20+,26-/m0/s1	PRIYVIVOOHHDTI-UNVFRBQDSA-N	497.288971378							115273
BRD-K18864235	LSM-26731		54633414	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15-,21+/m1/s1	OTZAREIZRHIYQA-PZPWOCDFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CC3	BroadT	BRD-K18864235	BRD-K18864235-001-01-9	Broad Institute of MIT and Harvard	BRD-K18864235			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15-,21+/m1/s1	OTZAREIZRHIYQA-PZPWOCDFSA-N	431.242021186							115274
BRD-K90759274	LSM-26732		54633304	InChI=1S/C27H34N4O5S2/c1-19-15-31(17-26-28-12-13-37-26)20(2)18-36-24-14-21(29-38(33,34)22-8-6-5-7-9-22)10-11-23(24)27(32)30(3)16-25(19)35-4/h5-14,19-20,25,29H,15-18H2,1-4H3/t19-,20+,25-/m0/s1	DFOOTVJERHUVDB-DFIYOIEZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K90759274	BRD-K90759274-001-01-4	Broad Institute of MIT and Harvard	BRD-K90759274			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C27H34N4O5S2/c1-19-15-31(17-26-28-12-13-37-26)20(2)18-36-24-14-21(29-38(33,34)22-8-6-5-7-9-22)10-11-23(24)27(32)30(3)16-25(19)35-4/h5-14,19-20,25,29H,15-18H2,1-4H3/t19-,20+,25-/m0/s1	DFOOTVJERHUVDB-DFIYOIEZSA-N	558.197061608							115275
BRD-K76539747	LSM-26733		54633190	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21+,26+/m0/s1	PEHKQIRDOAVSKY-LZCXECNNSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K76539747	BRD-K76539747-001-01-7	Broad Institute of MIT and Harvard	BRD-K76539747			CCCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21+,26+/m0/s1	PEHKQIRDOAVSKY-LZCXECNNSA-N	481.294056758							115276
BRD-K68663367	LSM-26734		54633282	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,21-/m1/s1	VQXGITUCISALNO-WHSLLNHNSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)C3CC3	BroadT	BRD-K68663367	BRD-K68663367-001-01-4	Broad Institute of MIT and Harvard	BRD-K68663367			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)C2CC2)c1	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,21-/m1/s1	VQXGITUCISALNO-WHSLLNHNSA-N	445.25767125							115277
BRD-K58118393	LSM-26735		54633381	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24-/m1/s1	AWPMFDCDNKJCST-XVTZWQNCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K58118393	BRD-K58118393-001-01-9	Broad Institute of MIT and Harvard	BRD-K58118393			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24-/m1/s1	AWPMFDCDNKJCST-XVTZWQNCSA-N	485.232599354							115278
BRD-K76966915	LSM-26736		54633460	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15-,20+/m0/s1	IQGWQEXQBGDRAI-AUSJPIAWSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K76966915	BRD-K76966915-001-01-8	Broad Institute of MIT and Harvard	BRD-K76966915			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15-,20+/m0/s1	IQGWQEXQBGDRAI-AUSJPIAWSA-N	455.209006496							115279
BRD-K41418032	LSM-26737		54633294	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-9-10-22-21(12-20)26(33)29(4)15-23(34-5)17(2)14-30(18(3)16-35-22)25(32)19-8-7-11-27-13-19/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	WCPNWHOTSKXGIK-YZZKKUAISA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3cccnc3	BroadT	BRD-K41418032	BRD-K41418032-001-01-0	Broad Institute of MIT and Harvard	BRD-K41418032			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1cccnc1	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-9-10-22-21(12-20)26(33)29(4)15-23(34-5)17(2)14-30(18(3)16-35-22)25(32)19-8-7-11-27-13-19/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	WCPNWHOTSKXGIK-YZZKKUAISA-N	482.252920228							115280
BRD-K36104357	LSM-26738		54633299	InChI=1S/C28H37F2N3O4/c1-6-7-27(34)31-22-9-10-23-25(13-22)37-17-19(3)33(15-20-12-21(29)8-11-24(20)30)14-18(2)26(36-5)16-32(4)28(23)35/h8-13,18-19,26H,6-7,14-17H2,1-5H3,(H,31,34)/t18-,19-,26-/m1/s1	QXVLXOALVVIWSG-LJKQEARRSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3cc(F)ccc3F)[C@H](C)COc2c1	BroadT	BRD-K36104357	BRD-K36104357-001-01-0	Broad Institute of MIT and Harvard	BRD-K36104357			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C28H37F2N3O4/c1-6-7-27(34)31-22-9-10-23-25(13-22)37-17-19(3)33(15-20-12-21(29)8-11-24(20)30)14-18(2)26(36-5)16-32(4)28(23)35/h8-13,18-19,26H,6-7,14-17H2,1-5H3,(H,31,34)/t18-,19-,26-/m1/s1	QXVLXOALVVIWSG-LJKQEARRSA-N	517.275213094							115281
CHEMBL2354607	LSM-26739	SID131429734, BRD-K05804651	54633483	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20-,25+/m0/s1	JAZMVIWKDLKWHZ-ZYLNGJIFSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccncc3)[C@@H](C)COc2c1	BroadT	BRD-K05804651	BRD-K05804651-001-01-5	Broad Institute of MIT and Harvard	BRD-K05804651			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccncc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20-,25+/m0/s1	JAZMVIWKDLKWHZ-ZYLNGJIFSA-N	482.289305736							115282
BRD-K47854067	LSM-26740		54633363	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21+/m1/s1	ADNFOFPYARHFIV-XFQAVAEZSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K47854067	BRD-K47854067-001-01-8	Broad Institute of MIT and Harvard	BRD-K47854067			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21+/m1/s1	ADNFOFPYARHFIV-XFQAVAEZSA-N	433.25767125							115283
BRD-K89364982	LSM-26741		54633452	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-14-23(30-28(34)29-22-8-6-5-7-9-22)12-13-24(25)27(33)31(3)17-26(19)35-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26+/m0/s1	LRUQUVHRPDASPT-OUDXUNEISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K89364982	BRD-K89364982-001-01-9	Broad Institute of MIT and Harvard	BRD-K89364982			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-14-23(30-28(34)29-22-8-6-5-7-9-22)12-13-24(25)27(33)31(3)17-26(19)35-4/h5-9,12-14,19-21,26H,10-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26+/m0/s1	LRUQUVHRPDASPT-OUDXUNEISA-N	494.289305736							115284
BRD-K10876822	LSM-26742		54633479	InChI=1S/C28H39N3O5/c1-7-13-31-16-19(2)26(35-6)17-30(4)28(33)24-12-11-22(15-25(24)36-18-20(31)3)29-27(32)21-9-8-10-23(14-21)34-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H,29,32)/t19-,20+,26+/m0/s1	PRIYVIVOOHHDTI-OUDXUNEISA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H]1C)OC	BroadT	BRD-K10876822	BRD-K10876822-001-01-0	Broad Institute of MIT and Harvard	BRD-K10876822			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H]1C)OC	InChI=1S/C28H39N3O5/c1-7-13-31-16-19(2)26(35-6)17-30(4)28(33)24-12-11-22(15-25(24)36-18-20(31)3)29-27(32)21-9-8-10-23(14-21)34-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H,29,32)/t19-,20+,26+/m0/s1	PRIYVIVOOHHDTI-OUDXUNEISA-N	497.288971378							115285
BRD-K68995447	LSM-26743		54633325	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-8-10-26-11-9-19)17(2)15-34-22-7-6-20(27-18(3)30)12-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	WMTZQZROEPTADL-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccncc3	BroadT	BRD-K68995447	BRD-K68995447-001-01-4	Broad Institute of MIT and Harvard	BRD-K68995447			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccncc1	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-8-10-26-11-9-19)17(2)15-34-22-7-6-20(27-18(3)30)12-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	WMTZQZROEPTADL-SEPYTNNBSA-N	468.237270164							115286
BRD-K12015168	LSM-26744		54633461	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15+,20+/m1/s1	IQGWQEXQBGDRAI-SIFCLUCFSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K12015168	BRD-K12015168-001-01-5	Broad Institute of MIT and Harvard	BRD-K12015168			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15+,20+/m1/s1	IQGWQEXQBGDRAI-SIFCLUCFSA-N	455.209006496							115287
BRD-K88087295	LSM-26745		54633392	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25+/m1/s1	KLLGWSLDFNRCLI-WYEJZRMESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(CC4CCOCC4)C[C@H]1C	BroadT	BRD-K88087295	BRD-K88087295-001-01-9	Broad Institute of MIT and Harvard	BRD-K88087295			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19+,25+/m1/s1	KLLGWSLDFNRCLI-WYEJZRMESA-N	487.304621442							115288
BRD-K07624584	LSM-26746		54633319	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16-,21+/m0/s1	HHYKIZYLLRVKIM-CKJXQJPGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K07624584	BRD-K07624584-001-01-7	Broad Institute of MIT and Harvard	BRD-K07624584			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16-,21+/m0/s1	HHYKIZYLLRVKIM-CKJXQJPGSA-N	495.15946949							115289
BRD-K20077349	LSM-26747		54633370	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m0/s1	GETIABPODKAIIC-AUSJPIAWSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)C	BroadT	BRD-K20077349	BRD-K20077349-001-01-7	Broad Institute of MIT and Harvard	BRD-K20077349			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m0/s1	GETIABPODKAIIC-AUSJPIAWSA-N	419.242021186							115290
BRD-K47995281	LSM-26748		54633417	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15-,21-/m0/s1	OTZAREIZRHIYQA-GXZWQRSESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C3CC3	BroadT	BRD-K47995281	BRD-K47995281-001-01-9	Broad Institute of MIT and Harvard	BRD-K47995281			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15-,21-/m0/s1	OTZAREIZRHIYQA-GXZWQRSESA-N	431.242021186							115291
BRD-K00816476	LSM-26749		54633499	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	AMWULHWHNZGRQW-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccccn3	BroadT	BRD-K00816476	BRD-K00816476-001-01-7	Broad Institute of MIT and Harvard	BRD-K00816476			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccn1	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	AMWULHWHNZGRQW-DGGJZMOXSA-N	468.237270164							115292
BRD-K50058129	LSM-26750		54633329	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-8-10-26-11-9-19)17(2)15-34-22-7-6-20(27-18(3)30)12-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m0/s1	WMTZQZROEPTADL-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccncc3	BroadT	BRD-K50058129	BRD-K50058129-001-01-6	Broad Institute of MIT and Harvard	BRD-K50058129			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccncc1	InChI=1S/C25H32N4O5/c1-16-13-29(24(31)19-8-10-26-11-9-19)17(2)15-34-22-7-6-20(27-18(3)30)12-21(22)25(32)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m0/s1	WMTZQZROEPTADL-QQMNAOGKSA-N	468.237270164							115293
BRD-K28122619	LSM-26751		54633244	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19-,25-/m0/s1	CNOFTFCPQVHJBJ-MHPIHPPYSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K28122619	BRD-K28122619-001-01-6	Broad Institute of MIT and Harvard	BRD-K28122619			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19-,25-/m0/s1	CNOFTFCPQVHJBJ-MHPIHPPYSA-N	513.263899482							115294
BRD-K69238239	LSM-26752		54633361	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21+/m0/s1	ADNFOFPYARHFIV-CKJXQJPGSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K69238239	BRD-K69238239-001-01-0	Broad Institute of MIT and Harvard	BRD-K69238239			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21+/m0/s1	ADNFOFPYARHFIV-CKJXQJPGSA-N	433.25767125							115295
BRD-K98190019	LSM-26753		54633462	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15-,20+/m1/s1	IQGWQEXQBGDRAI-SXGZJXTBSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K98190019	BRD-K98190019-001-01-4	Broad Institute of MIT and Harvard	BRD-K98190019			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15-,20+/m1/s1	IQGWQEXQBGDRAI-SXGZJXTBSA-N	455.209006496							115296
BRD-K34804325	LSM-26754		54633283	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,21-/m0/s1	VQXGITUCISALNO-MRUHUIDDSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)C3CC3	BroadT	BRD-K34804325	BRD-K34804325-001-01-6	Broad Institute of MIT and Harvard	BRD-K34804325			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)C2CC2)c1	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,21-/m0/s1	VQXGITUCISALNO-MRUHUIDDSA-N	445.25767125							115297
BRD-K12064774	LSM-26755		54633218	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23+/m0/s1	WEWHHSRLSBIWPH-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K12064774	BRD-K12064774-001-01-9	Broad Institute of MIT and Harvard	BRD-K12064774			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23+/m0/s1	WEWHHSRLSBIWPH-HKARXFIJSA-N	455.242021186							115298
BRD-K28354175	LSM-26756		54633270	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16+,22-/m1/s1	OTCOGNWSMBTRMR-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CC3CC3	BroadT	BRD-K28354175	BRD-K28354175-001-01-1	Broad Institute of MIT and Harvard	BRD-K28354175			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16+,22-/m1/s1	OTCOGNWSMBTRMR-ZMPRRUGASA-N	445.25767125							115299
BRD-K59392325	LSM-26757		54633426	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20-/m0/s1	PRQHOYZGRSXLAM-YRNRMSPPSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K59392325	BRD-K59392325-001-01-2	Broad Institute of MIT and Harvard	BRD-K59392325			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20-/m0/s1	PRQHOYZGRSXLAM-YRNRMSPPSA-N	420.273655672							115300
BRD-K77697725	LSM-26758		54633250	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m1/s1	IPCOCSCQFWJAQB-SIFCLUCFSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K77697725	BRD-K77697725-001-01-8	Broad Institute of MIT and Harvard	BRD-K77697725			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m1/s1	IPCOCSCQFWJAQB-SIFCLUCFSA-N	435.236935806							115301
BRD-K74892102	LSM-26759		54633313	InChI=1S/C25H37N5O6S/c1-7-8-23(31)27-19-9-10-20-21(11-19)36-15-18(3)30(37(33,34)24-14-28(4)16-26-24)12-17(2)22(35-6)13-29(5)25(20)32/h9-11,14,16-18,22H,7-8,12-13,15H2,1-6H3,(H,27,31)/t17-,18+,22+/m1/s1	YAZPLJHKVLFFGT-FGSXEWAUSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K74892102	BRD-K74892102-001-01-1	Broad Institute of MIT and Harvard	BRD-K74892102			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)S(=O)(=O)c2cn(C)cn2)c1	InChI=1S/C25H37N5O6S/c1-7-8-23(31)27-19-9-10-20-21(11-19)36-15-18(3)30(37(33,34)24-14-28(4)16-26-24)12-17(2)22(35-6)13-29(5)25(20)32/h9-11,14,16-18,22H,7-8,12-13,15H2,1-6H3,(H,27,31)/t17-,18+,22+/m1/s1	YAZPLJHKVLFFGT-FGSXEWAUSA-N	535.246454644							115302
BRD-K77634878	LSM-26760		54633272	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18-,23+/m0/s1	SZRRAHWFAJRXLY-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K77634878	BRD-K77634878-001-01-6	Broad Institute of MIT and Harvard	BRD-K77634878			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18-,23+/m0/s1	SZRRAHWFAJRXLY-IUKKYPGJSA-N	488.29987042							115303
BRD-K03715233	LSM-26761		54633441	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m0/s1	CIVNAWRIQAGZDO-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K03715233	BRD-K03715233-001-01-2	Broad Institute of MIT and Harvard	BRD-K03715233			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m0/s1	CIVNAWRIQAGZDO-RHGYRFJNSA-N	482.252920228							115304
BRD-K94889489	LSM-26762		54633208	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m0/s1	BCUUTPUMPAWJAT-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K94889489	BRD-K94889489-001-01-6	Broad Institute of MIT and Harvard	BRD-K94889489			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m0/s1	BCUUTPUMPAWJAT-HKARXFIJSA-N	472.248583776							115305
BRD-K63711467	LSM-26763		54633492	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16-,21-/m0/s1	DJUMVAZPGRPTOB-QYWGDWMGSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(Cc3nccs3)C[C@@H]1C	BroadT	BRD-K63711467	BRD-K63711467-001-01-5	Broad Institute of MIT and Harvard	BRD-K63711467			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16-,21-/m0/s1	DJUMVAZPGRPTOB-QYWGDWMGSA-N	460.214426234							115306
BRD-K03057797	LSM-26764		54633333	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m0/s1	YXLXBGWRVYMONT-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K03057797	BRD-K03057797-001-01-7	Broad Institute of MIT and Harvard	BRD-K03057797			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m0/s1	YXLXBGWRVYMONT-WJONJSRFSA-N	458.232933712							115307
BRD-K59708864	LSM-26765		54633193	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21+,26-/m1/s1	PEHKQIRDOAVSKY-YZIHRLCOSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K59708864	BRD-K59708864-001-01-6	Broad Institute of MIT and Harvard	BRD-K59708864			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21+,26-/m1/s1	PEHKQIRDOAVSKY-YZIHRLCOSA-N	481.294056758							115308
BRD-K40826084	LSM-26766		54633406	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15-,19+/m1/s1	UQDKPOMZCZHHDG-CLCXKQKWSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K40826084	BRD-K40826084-001-01-2	Broad Institute of MIT and Harvard	BRD-K40826084			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15-,19+/m1/s1	UQDKPOMZCZHHDG-CLCXKQKWSA-N	427.214091876							115309
BRD-K17259076	LSM-26767		54633339	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17-,22+/m0/s1	FXOJDLIATDATEB-PNLZDCPESA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K17259076	BRD-K17259076-001-01-5	Broad Institute of MIT and Harvard	BRD-K17259076			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17-,22+/m0/s1	FXOJDLIATDATEB-PNLZDCPESA-N	483.248169206							115310
BRD-K88179337	LSM-26768		54633341	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17+,22+/m0/s1	FXOJDLIATDATEB-GSHUGGBRSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	BroadT	BRD-K88179337	BRD-K88179337-001-01-4	Broad Institute of MIT and Harvard	BRD-K88179337			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17+,22+/m0/s1	FXOJDLIATDATEB-GSHUGGBRSA-N	483.248169206							115311
BRD-K92344227	LSM-26769		54633396	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17-,23-/m1/s1	UPIUFFQPNYDCFX-SEPYTNNBSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@H]1C)OC	BroadT	BRD-K92344227	BRD-K92344227-001-01-1	Broad Institute of MIT and Harvard	BRD-K92344227			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@H]1C)OC	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17-,23-/m1/s1	UPIUFFQPNYDCFX-SEPYTNNBSA-N	501.295119398							115312
BRD-K81982648	LSM-26770		54633266	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16+,22+/m1/s1	OTCOGNWSMBTRMR-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CC3CC3	BroadT	BRD-K81982648	BRD-K81982648-001-01-2	Broad Institute of MIT and Harvard	BRD-K81982648			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16+,22+/m1/s1	OTCOGNWSMBTRMR-VVBPWWLESA-N	445.25767125							115313
BRD-K27092365	LSM-26771		54633348	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28+/m1/s1	GRFOSLOREGQSPJ-WENCSYSZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H](C)N(Cc4ccccn4)C[C@H]1C	BroadT	BRD-K27092365	BRD-K27092365-001-01-8	Broad Institute of MIT and Harvard	BRD-K27092365			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28+/m1/s1	GRFOSLOREGQSPJ-WENCSYSZSA-N	552.240640982							115314
BRD-K19320442	LSM-26772		54633407	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15+,19+/m1/s1	UQDKPOMZCZHHDG-VCBZYWHSSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K19320442	BRD-K19320442-001-01-0	Broad Institute of MIT and Harvard	BRD-K19320442			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15+,19+/m1/s1	UQDKPOMZCZHHDG-VCBZYWHSSA-N	427.214091876							115315
BRD-K83049611	LSM-26773		54633384	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17-,23+/m0/s1	HWGKHULHTVQYGT-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K83049611	BRD-K83049611-001-01-1	Broad Institute of MIT and Harvard	BRD-K83049611			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17-,23+/m0/s1	HWGKHULHTVQYGT-HKARXFIJSA-N	491.209006496							115316
BRD-K43982279	LSM-26774		54633312	InChI=1S/C25H37N5O6S/c1-7-8-23(31)27-19-9-10-20-21(11-19)36-15-18(3)30(37(33,34)24-14-28(4)16-26-24)12-17(2)22(35-6)13-29(5)25(20)32/h9-11,14,16-18,22H,7-8,12-13,15H2,1-6H3,(H,27,31)/t17-,18-,22-/m1/s1	YAZPLJHKVLFFGT-JBYIUTFZSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K43982279	BRD-K43982279-001-01-5	Broad Institute of MIT and Harvard	BRD-K43982279			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)S(=O)(=O)c2cn(C)cn2)c1	InChI=1S/C25H37N5O6S/c1-7-8-23(31)27-19-9-10-20-21(11-19)36-15-18(3)30(37(33,34)24-14-28(4)16-26-24)12-17(2)22(35-6)13-29(5)25(20)32/h9-11,14,16-18,22H,7-8,12-13,15H2,1-6H3,(H,27,31)/t17-,18-,22-/m1/s1	YAZPLJHKVLFFGT-JBYIUTFZSA-N	535.246454644							115317
BRD-K94936556	LSM-26775		54633256	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22+/m1/s1	DKOCUBLREHHOPE-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K94936556	BRD-K94936556-001-01-3	Broad Institute of MIT and Harvard	BRD-K94936556			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22+/m1/s1	DKOCUBLREHHOPE-MCFFVMPBSA-N	443.22203467							115318
BRD-K41192699	LSM-26776		54633221	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23-/m0/s1	WEWHHSRLSBIWPH-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K41192699	BRD-K41192699-001-01-5	Broad Institute of MIT and Harvard	BRD-K41192699			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23-/m0/s1	WEWHHSRLSBIWPH-MFEFFIJZSA-N	455.242021186							115319
BRD-K85823016	LSM-26777		54633442	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m1/s1	CIVNAWRIQAGZDO-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K85823016	BRD-K85823016-001-01-8	Broad Institute of MIT and Harvard	BRD-K85823016			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-12-11-21(28-26(33)27-20-9-7-6-8-10-20)13-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m1/s1	CIVNAWRIQAGZDO-NXMSCROESA-N	482.252920228							115320
BRD-K58890106	LSM-26778		54633491	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16+,21+/m0/s1	DJUMVAZPGRPTOB-GCKMJXCFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3nccs3)C[C@@H]1C	BroadT	BRD-K58890106	BRD-K58890106-001-01-1	Broad Institute of MIT and Harvard	BRD-K58890106			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16+,21+/m0/s1	DJUMVAZPGRPTOB-GCKMJXCFSA-N	460.214426234							115321
BRD-K97236134	LSM-26779		54633247	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m1/s1	IPCOCSCQFWJAQB-STXHMFSFSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K97236134	BRD-K97236134-001-01-6	Broad Institute of MIT and Harvard	BRD-K97236134			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m1/s1	IPCOCSCQFWJAQB-STXHMFSFSA-N	435.236935806							115322
BRD-K88119862	LSM-26780		54633289	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21-,28-/m0/s1	HSWIGQKLSXZYGZ-CZBREUMFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)c4ccccc4)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K88119862	BRD-K88119862-001-01-3	Broad Institute of MIT and Harvard	BRD-K88119862			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)-c3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21-,28-/m0/s1	HSWIGQKLSXZYGZ-CZBREUMFSA-N	537.22974194							115323
BRD-K89805341	LSM-26781		54633222	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23-/m1/s1	WEWHHSRLSBIWPH-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K89805341	BRD-K89805341-001-01-7	Broad Institute of MIT and Harvard	BRD-K89805341			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23-/m1/s1	WEWHHSRLSBIWPH-SAHWJRBASA-N	455.242021186							115324
BRD-K63008302	LSM-26782		54633321	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21+/m0/s1	HHYKIZYLLRVKIM-GCKMJXCFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K63008302	BRD-K63008302-001-01-5	Broad Institute of MIT and Harvard	BRD-K63008302			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21+/m0/s1	HHYKIZYLLRVKIM-GCKMJXCFSA-N	495.15946949							115325
BRD-K50575036	LSM-26783		54633379	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24-/m0/s1	AWPMFDCDNKJCST-UAVUOLJFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K50575036	BRD-K50575036-001-01-1	Broad Institute of MIT and Harvard	BRD-K50575036			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24-/m0/s1	AWPMFDCDNKJCST-UAVUOLJFSA-N	485.232599354							115326
BRD-K98896251-001-01-3	LSM-26784	BRD-K98896251	54633349	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28+/m0/s1	GRFOSLOREGQSPJ-PFPZSTESSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(Cc4ccccn4)C[C@@H]1C	BroadT	BRD-K98896251	BRD-K98896251-001-01-3	Broad Institute of MIT and Harvard	BRD-K98896251			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28+/m0/s1	GRFOSLOREGQSPJ-PFPZSTESSA-N	552.240640982							115327
BRD-K76734722	LSM-26785		54633354	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16+,21+/m1/s1	FNRFWBTYLPGHMZ-XFQAVAEZSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K76734722	BRD-K76734722-001-01-3	Broad Institute of MIT and Harvard	BRD-K76734722			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H]1C)OC	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16+,21+/m1/s1	FNRFWBTYLPGHMZ-XFQAVAEZSA-N	445.25767125							115328
BRD-K67348226	LSM-26786		54633376	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24+/m0/s1	AWPMFDCDNKJCST-WOGXIUBCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K67348226	BRD-K67348226-001-01-4	Broad Institute of MIT and Harvard	BRD-K67348226			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17-,24+/m0/s1	AWPMFDCDNKJCST-WOGXIUBCSA-N	485.232599354							115329
BRD-K44649335	LSM-26787		54633209	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m1/s1	BCUUTPUMPAWJAT-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K44649335	BRD-K44649335-001-01-1	Broad Institute of MIT and Harvard	BRD-K44649335			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m1/s1	BCUUTPUMPAWJAT-DGGJZMOXSA-N	472.248583776							115330
BRD-K45819372	LSM-26788		54633224	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(9-10-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-7-6-8-20(11-18)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23+/m1/s1	NAQHKEYVSHPAHI-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(OC)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K45819372	BRD-K45819372-001-01-3	Broad Institute of MIT and Harvard	BRD-K45819372			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(OC)c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(9-10-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-7-6-8-20(11-18)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23+/m1/s1	NAQHKEYVSHPAHI-DGGJZMOXSA-N	470.252920228							115331
BRD-K76910883	LSM-26789		54633353	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16-,21+/m1/s1	FNRFWBTYLPGHMZ-ZOCZFRKYSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H]1C)OC	BroadT	BRD-K76910883	BRD-K76910883-001-01-4	Broad Institute of MIT and Harvard	BRD-K76910883			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H]1C)OC	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16-,21+/m1/s1	FNRFWBTYLPGHMZ-ZOCZFRKYSA-N	445.25767125							115332
BRD-K40378743	LSM-26790		54633446	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-20-21(11-19)35-14-18(6)30(25(33)27-16(3)4)12-17(5)22(34-8)13-29(7)23(20)31/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18-,22-/m1/s1	JABHCOSNXLYONB-JBYIUTFZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K40378743	BRD-K40378743-001-01-7	Broad Institute of MIT and Harvard	BRD-K40378743			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-20-21(11-19)35-14-18(6)30(25(33)27-16(3)4)12-17(5)22(34-8)13-29(7)23(20)31/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18-,22-/m1/s1	JABHCOSNXLYONB-JBYIUTFZSA-N	491.310769462							115333
BRD-K76400756	LSM-26791		54633303	InChI=1S/C27H34N4O5S2/c1-19-15-31(17-26-28-12-13-37-26)20(2)18-36-24-14-21(29-38(33,34)22-8-6-5-7-9-22)10-11-23(24)27(32)30(3)16-25(19)35-4/h5-14,19-20,25,29H,15-18H2,1-4H3/t19-,20+,25+/m0/s1	DFOOTVJERHUVDB-WZOHSFFVSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K76400756	BRD-K76400756-001-01-0	Broad Institute of MIT and Harvard	BRD-K76400756			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C27H34N4O5S2/c1-19-15-31(17-26-28-12-13-37-26)20(2)18-36-24-14-21(29-38(33,34)22-8-6-5-7-9-22)10-11-23(24)27(32)30(3)16-25(19)35-4/h5-14,19-20,25,29H,15-18H2,1-4H3/t19-,20+,25+/m0/s1	DFOOTVJERHUVDB-WZOHSFFVSA-N	558.197061608							115334
BRD-K02681754	LSM-26792		54633230	InChI=1S/C28H41N3O5/c1-18-15-31(27(33)21-8-6-5-7-9-21)19(2)17-36-24-14-22(29-26(32)20-10-11-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h12-14,18-21,25H,5-11,15-17H2,1-4H3,(H,29,32)/t18-,19+,25-/m1/s1	HUUYFVWWRMTXKP-HHJKRLRDSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C4CCCCC4	BroadT	BRD-K02681754	BRD-K02681754-001-01-6	Broad Institute of MIT and Harvard	BRD-K02681754			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CCCCC1	InChI=1S/C28H41N3O5/c1-18-15-31(27(33)21-8-6-5-7-9-21)19(2)17-36-24-14-22(29-26(32)20-10-11-20)12-13-23(24)28(34)30(3)16-25(18)35-4/h12-14,18-21,25H,5-11,15-17H2,1-4H3,(H,29,32)/t18-,19+,25-/m1/s1	HUUYFVWWRMTXKP-HHJKRLRDSA-N	499.304621442							115335
BRD-K73330516	LSM-26793		54633416	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15+,21+/m0/s1	OTZAREIZRHIYQA-PDSXEYIOSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C3CC3	BroadT	BRD-K73330516	BRD-K73330516-001-01-3	Broad Institute of MIT and Harvard	BRD-K73330516			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15+,21+/m0/s1	OTZAREIZRHIYQA-PDSXEYIOSA-N	431.242021186							115336
BRD-K84815485	LSM-26794		54633444	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-20-21(11-19)35-14-18(6)30(25(33)27-16(3)4)12-17(5)22(34-8)13-29(7)23(20)31/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22+/m1/s1	JABHCOSNXLYONB-FGSXEWAUSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K84815485	BRD-K84815485-001-01-7	Broad Institute of MIT and Harvard	BRD-K84815485			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-20-21(11-19)35-14-18(6)30(25(33)27-16(3)4)12-17(5)22(34-8)13-29(7)23(20)31/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22+/m1/s1	JABHCOSNXLYONB-FGSXEWAUSA-N	491.310769462							115337
BRD-K92440102	LSM-26795		54633389	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25-/m1/s1	KLLGWSLDFNRCLI-MPCDZSKCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(CC4CCOCC4)C[C@H]1C	BroadT	BRD-K92440102	BRD-K92440102-001-01-7	Broad Institute of MIT and Harvard	BRD-K92440102			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25-/m1/s1	KLLGWSLDFNRCLI-MPCDZSKCSA-N	487.304621442							115338
BRD-K96834095	LSM-26796		54633481	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20-,25-/m1/s1	JAZMVIWKDLKWHZ-UMEGOILYSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccncc3)[C@H](C)COc2c1	BroadT	BRD-K96834095	BRD-K96834095-001-01-6	Broad Institute of MIT and Harvard	BRD-K96834095			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccncc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20-,25-/m1/s1	JAZMVIWKDLKWHZ-UMEGOILYSA-N	482.289305736							115339
BRD-K58932103	LSM-26797		54633430	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16-,22+/m0/s1	YNEIZQUEDXPWMX-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(CC3CC3)C[C@@H]1C	BroadT	BRD-K58932103	BRD-K58932103-001-01-4	Broad Institute of MIT and Harvard	BRD-K58932103			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16-,22+/m0/s1	YNEIZQUEDXPWMX-PONJGIIJSA-N	417.26275663							115340
BRD-K22754756-001-01-5	LSM-26798	BRD-K22754756	54633189	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21+,26+/m1/s1	PEHKQIRDOAVSKY-SWYRRKHMSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K22754756	BRD-K22754756-001-01-5	Broad Institute of MIT and Harvard	BRD-K22754756			CCCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O4/c1-6-10-27(32)29-23-13-14-25-24(15-23)28(33)30(4)18-26(34-5)20(2)16-31(21(3)19-35-25)17-22-11-8-7-9-12-22/h7-9,11-15,20-21,26H,6,10,16-19H2,1-5H3,(H,29,32)/t20-,21+,26+/m1/s1	PEHKQIRDOAVSKY-SWYRRKHMSA-N	481.294056758							115341
BRD-K11844860	LSM-26799		54633373	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m0/s1	GETIABPODKAIIC-AVYPCKFXSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)C	BroadT	BRD-K11844860	BRD-K11844860-001-01-0	Broad Institute of MIT and Harvard	BRD-K11844860			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m0/s1	GETIABPODKAIIC-AVYPCKFXSA-N	419.242021186							115342
BRD-K14250524	LSM-26800		54633301	InChI=1S/C27H34N4O5S2/c1-19-15-31(17-26-28-12-13-37-26)20(2)18-36-24-14-21(29-38(33,34)22-8-6-5-7-9-22)10-11-23(24)27(32)30(3)16-25(19)35-4/h5-14,19-20,25,29H,15-18H2,1-4H3/t19-,20-,25+/m0/s1	DFOOTVJERHUVDB-ZYLNGJIFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K14250524	BRD-K14250524-001-01-5	Broad Institute of MIT and Harvard	BRD-K14250524			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C27H34N4O5S2/c1-19-15-31(17-26-28-12-13-37-26)20(2)18-36-24-14-21(29-38(33,34)22-8-6-5-7-9-22)10-11-23(24)27(32)30(3)16-25(19)35-4/h5-14,19-20,25,29H,15-18H2,1-4H3/t19-,20-,25+/m0/s1	DFOOTVJERHUVDB-ZYLNGJIFSA-N	558.197061608							115343
BRD-K11509270-001-01-3	LSM-26801	BRD-K11509270	54633210	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m1/s1	BCUUTPUMPAWJAT-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K11509270	BRD-K11509270-001-01-3	Broad Institute of MIT and Harvard	BRD-K11509270			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m1/s1	BCUUTPUMPAWJAT-QZMQVMSPSA-N	472.248583776							115344
BRD-K73166462	LSM-26802		54633275	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18-,23-/m1/s1	SZRRAHWFAJRXLY-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K73166462	BRD-K73166462-001-01-5	Broad Institute of MIT and Harvard	BRD-K73166462			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18-,23-/m1/s1	SZRRAHWFAJRXLY-PMAPCBKXSA-N	488.29987042							115345
BRD-K06784595	LSM-26803		54633287	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28+/m1/s1	HSWIGQKLSXZYGZ-GGJMMHKRSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)c4ccccc4)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K06784595	BRD-K06784595-001-01-7	Broad Institute of MIT and Harvard	BRD-K06784595			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)-c3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21+,28+/m1/s1	HSWIGQKLSXZYGZ-GGJMMHKRSA-N	537.22974194							115346
BRD-K59865704	LSM-26804		54633368	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m1/s1	GETIABPODKAIIC-STXHMFSFSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K59865704	BRD-K59865704-001-01-8	Broad Institute of MIT and Harvard	BRD-K59865704			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m1/s1	GETIABPODKAIIC-STXHMFSFSA-N	419.242021186							115347
BRD-K37000177	LSM-26805		54633300	InChI=1S/C27H34N4O5S2/c1-19-15-31(17-26-28-12-13-37-26)20(2)18-36-24-14-21(29-38(33,34)22-8-6-5-7-9-22)10-11-23(24)27(32)30(3)16-25(19)35-4/h5-14,19-20,25,29H,15-18H2,1-4H3/t19-,20-,25+/m1/s1	DFOOTVJERHUVDB-FHAGJXEFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K37000177	BRD-K37000177-001-01-7	Broad Institute of MIT and Harvard	BRD-K37000177			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C27H34N4O5S2/c1-19-15-31(17-26-28-12-13-37-26)20(2)18-36-24-14-21(29-38(33,34)22-8-6-5-7-9-22)10-11-23(24)27(32)30(3)16-25(19)35-4/h5-14,19-20,25,29H,15-18H2,1-4H3/t19-,20-,25+/m1/s1	DFOOTVJERHUVDB-FHAGJXEFSA-N	558.197061608							115348
BRD-K82765368	LSM-26806		54633429	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16-,22+/m1/s1	YNEIZQUEDXPWMX-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(CC3CC3)C[C@H]1C	BroadT	BRD-K82765368	BRD-K82765368-001-01-8	Broad Institute of MIT and Harvard	BRD-K82765368			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16-,22+/m1/s1	YNEIZQUEDXPWMX-MCFFVMPBSA-N	417.26275663							115349
BRD-K65829768	LSM-26807		54633362	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21+/m1/s1	ADNFOFPYARHFIV-ZOCZFRKYSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K65829768	BRD-K65829768-001-01-9	Broad Institute of MIT and Harvard	BRD-K65829768			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21+/m1/s1	ADNFOFPYARHFIV-ZOCZFRKYSA-N	433.25767125							115350
BRD-K48788132	LSM-26808		54633425	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20-/m0/s1	PRQHOYZGRSXLAM-FTRWYGJKSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K48788132	BRD-K48788132-001-01-8	Broad Institute of MIT and Harvard	BRD-K48788132			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20-/m0/s1	PRQHOYZGRSXLAM-FTRWYGJKSA-N	420.273655672							115351
BRD-K76672145	LSM-26809		54633469	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20+,26+/m1/s1	SPHXOOCVMGXZSD-GOHWNWGWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc4ccncc4)C[C@H]1C	BroadT	BRD-K76672145	BRD-K76672145-001-01-4	Broad Institute of MIT and Harvard	BRD-K76672145			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20+,26+/m1/s1	SPHXOOCVMGXZSD-GOHWNWGWSA-N	494.289305736							115352
MLS003650046	LSM-26810	BRD-K86937728	53382704	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28-/m0/s1	GRFOSLOREGQSPJ-TYPXCFOJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(Cc4ccccn4)C[C@@H]1C	BroadT	BRD-K86937728	BRD-K86937728-001-01-4	Broad Institute of MIT and Harvard	BRD-K86937728			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-24-10-8-9-15-30-24)22(2)20-38-27-14-13-23(31-39(35,36)25-11-6-5-7-12-25)16-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28-/m0/s1	GRFOSLOREGQSPJ-TYPXCFOJSA-N	552.240640982							115353
BRD-K53356402	LSM-26811		54633239	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19-,25-/m1/s1	CNOFTFCPQVHJBJ-MPCDZSKCSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3ccccc3F	BroadT	BRD-K53356402	BRD-K53356402-001-01-9	Broad Institute of MIT and Harvard	BRD-K53356402			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1ccccc1F	InChI=1S/C28H36FN3O5/c1-6-9-26(33)30-20-12-13-24-22(14-20)27(34)31(4)16-25(36-5)18(2)15-32(19(3)17-37-24)28(35)21-10-7-8-11-23(21)29/h7-8,10-14,18-19,25H,6,9,15-17H2,1-5H3,(H,30,33)/t18-,19-,25-/m1/s1	CNOFTFCPQVHJBJ-MPCDZSKCSA-N	513.263899482							115354
BRD-K91897530	LSM-26812		54633477	InChI=1S/C28H39N3O5/c1-7-13-31-16-19(2)26(35-6)17-30(4)28(33)24-12-11-22(15-25(24)36-18-20(31)3)29-27(32)21-9-8-10-23(14-21)34-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H,29,32)/t19-,20-,26+/m0/s1	PRIYVIVOOHHDTI-CUVVAGTFSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H]1C)OC	BroadT	BRD-K91897530	BRD-K91897530-001-01-1	Broad Institute of MIT and Harvard	BRD-K91897530			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@@H]1C)OC	InChI=1S/C28H39N3O5/c1-7-13-31-16-19(2)26(35-6)17-30(4)28(33)24-12-11-22(15-25(24)36-18-20(31)3)29-27(32)21-9-8-10-23(14-21)34-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H,29,32)/t19-,20-,26+/m0/s1	PRIYVIVOOHHDTI-CUVVAGTFSA-N	497.288971378							115355
BRD-K73880067	LSM-26813		54633278	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,21+/m1/s1	VQXGITUCISALNO-ZOCZFRKYSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)C3CC3	BroadT	BRD-K73880067	BRD-K73880067-001-01-0	Broad Institute of MIT and Harvard	BRD-K73880067			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)C2CC2)c1	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,21+/m1/s1	VQXGITUCISALNO-ZOCZFRKYSA-N	445.25767125							115356
BRD-K91216645	LSM-26814		54633320	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21+/m1/s1	HHYKIZYLLRVKIM-XFQAVAEZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K91216645	BRD-K91216645-001-01-6	Broad Institute of MIT and Harvard	BRD-K91216645			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21+/m1/s1	HHYKIZYLLRVKIM-XFQAVAEZSA-N	495.15946949							115357
BRD-K18211442	LSM-26815		54633359	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16+,21-/m1/s1	FNRFWBTYLPGHMZ-VWKPWSFCSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K18211442	BRD-K18211442-001-01-2	Broad Institute of MIT and Harvard	BRD-K18211442			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H]1C)OC	InChI=1S/C24H35N3O5/c1-6-22(28)27-12-15(2)21(31-5)13-26(4)24(30)19-11-18(25-23(29)17-7-8-17)9-10-20(19)32-14-16(27)3/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,29)/t15-,16+,21-/m1/s1	FNRFWBTYLPGHMZ-VWKPWSFCSA-N	445.25767125							115358
BRD-K95651150	LSM-26816		54633475	InChI=1S/C28H39N3O5/c1-7-13-31-16-19(2)26(35-6)17-30(4)28(33)24-12-11-22(15-25(24)36-18-20(31)3)29-27(32)21-9-8-10-23(14-21)34-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H,29,32)/t19-,20-,26-/m1/s1	PRIYVIVOOHHDTI-XMERXJNXSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H]1C)OC	BroadT	BRD-K95651150	BRD-K95651150-001-01-7	Broad Institute of MIT and Harvard	BRD-K95651150			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)c3cccc(OC)c3)cc2OC[C@H]1C)OC	InChI=1S/C28H39N3O5/c1-7-13-31-16-19(2)26(35-6)17-30(4)28(33)24-12-11-22(15-25(24)36-18-20(31)3)29-27(32)21-9-8-10-23(14-21)34-5/h8-12,14-15,19-20,26H,7,13,16-18H2,1-6H3,(H,29,32)/t19-,20-,26-/m1/s1	PRIYVIVOOHHDTI-XMERXJNXSA-N	497.288971378							115359
BRD-K37625653	LSM-26817		54633335	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	YXLXBGWRVYMONT-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K37625653	BRD-K37625653-001-01-4	Broad Institute of MIT and Harvard	BRD-K37625653			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	YXLXBGWRVYMONT-DMPWYTOCSA-N	458.232933712							115360
BRD-K43431234	LSM-26818		54633226	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(9-10-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-7-6-8-20(11-18)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m1/s1	NAQHKEYVSHPAHI-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(OC)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K43431234	BRD-K43431234-001-01-7	Broad Institute of MIT and Harvard	BRD-K43431234			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(OC)c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(9-10-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-7-6-8-20(11-18)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m1/s1	NAQHKEYVSHPAHI-SAHWJRBASA-N	470.252920228							115361
BRD-K58044926	LSM-26819		54633448	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-20-21(11-19)35-14-18(6)30(25(33)27-16(3)4)12-17(5)22(34-8)13-29(7)23(20)31/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22-/m1/s1	JABHCOSNXLYONB-KGVIQGDOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K58044926	BRD-K58044926-001-01-3	Broad Institute of MIT and Harvard	BRD-K58044926			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-20-21(11-19)35-14-18(6)30(25(33)27-16(3)4)12-17(5)22(34-8)13-29(7)23(20)31/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22-/m1/s1	JABHCOSNXLYONB-KGVIQGDOSA-N	491.310769462							115362
BRD-K24333636	LSM-26820		54633418	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15+,21-/m0/s1	OTZAREIZRHIYQA-ZSDSOXJFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C3CC3	BroadT	BRD-K24333636	BRD-K24333636-001-01-2	Broad Institute of MIT and Harvard	BRD-K24333636			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CC1	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15+,21-/m0/s1	OTZAREIZRHIYQA-ZSDSOXJFSA-N	431.242021186							115363
BRD-K92955882	LSM-26821		54633223	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(9-10-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-7-6-8-20(11-18)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23-/m1/s1	NAQHKEYVSHPAHI-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(OC)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K92955882	BRD-K92955882-001-01-0	Broad Institute of MIT and Harvard	BRD-K92955882			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(OC)c3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(9-10-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-7-6-8-20(11-18)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23-/m1/s1	NAQHKEYVSHPAHI-SEPYTNNBSA-N	470.252920228							115364
BRD-K18253469	LSM-26822		54633271	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18-,23+/m1/s1	SZRRAHWFAJRXLY-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K18253469	BRD-K18253469-001-01-2	Broad Institute of MIT and Harvard	BRD-K18253469			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)30-13-17(3)23(34-6)14-29(5)25(32)21-11-10-20(12-22(21)35-15-18(30)4)28-24(31)19-8-7-9-19/h10-12,16-19,23H,7-9,13-15H2,1-6H3,(H,27,33)(H,28,31)/t17-,18-,23+/m1/s1	SZRRAHWFAJRXLY-PNCHPQGNSA-N	488.29987042							115365
BRD-K37176385	LSM-26823		54633284	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,21-/m1/s1	VQXGITUCISALNO-VWKPWSFCSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C3CC3	BroadT	BRD-K37176385	BRD-K37176385-001-01-3	Broad Institute of MIT and Harvard	BRD-K37176385			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)C2CC2)c1	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,21-/m1/s1	VQXGITUCISALNO-VWKPWSFCSA-N	445.25767125							115366
BRD-K13646706	LSM-26824		54633493	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16-,21-/m1/s1	DJUMVAZPGRPTOB-WHSLLNHNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(Cc3nccs3)C[C@H]1C	BroadT	BRD-K13646706	BRD-K13646706-001-01-5	Broad Institute of MIT and Harvard	BRD-K13646706			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C23H32N4O4S/c1-15-11-27(13-22-24-8-9-32-22)16(2)14-31-20-7-6-18(25-17(3)28)10-19(20)23(29)26(4)12-21(15)30-5/h6-10,15-16,21H,11-14H2,1-5H3,(H,25,28)/t15-,16-,21-/m1/s1	DJUMVAZPGRPTOB-WHSLLNHNSA-N	460.214426234							115367
BRD-K40248932	LSM-26825		54633194	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19-,26-/m1/s1	FHVMFMOLSIFJFC-LJKQEARRSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K40248932	BRD-K40248932-001-01-3	Broad Institute of MIT and Harvard	BRD-K40248932			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19-,26-/m1/s1	FHVMFMOLSIFJFC-LJKQEARRSA-N	497.268984862							115368
BRD-K13567350	LSM-26826		54633397	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17-,23+/m1/s1	UPIUFFQPNYDCFX-QZMQVMSPSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@H]1C)OC	BroadT	BRD-K13567350	BRD-K13567350-001-01-2	Broad Institute of MIT and Harvard	BRD-K13567350			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@H]1C)OC	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17-,23+/m1/s1	UPIUFFQPNYDCFX-QZMQVMSPSA-N	501.295119398							115369
CHEMBL3188527	LSM-26827	BRD-K22661969	54633265	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16-,22+/m1/s1	OTCOGNWSMBTRMR-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC3CC3	BroadT	BRD-K22661969	BRD-K22661969-001-01-5	Broad Institute of MIT and Harvard	BRD-K22661969			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16-,22+/m1/s1	OTCOGNWSMBTRMR-MCFFVMPBSA-N	445.25767125							115370
BRD-K16518464	LSM-26828		54633424	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20+/m0/s1	PRQHOYZGRSXLAM-RZQQEMMASA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K16518464	BRD-K16518464-001-01-5	Broad Institute of MIT and Harvard	BRD-K16518464			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20+/m0/s1	PRQHOYZGRSXLAM-RZQQEMMASA-N	420.273655672							115371
BRD-K82729862	LSM-26829		54633206	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20-/m0/s1	IKJJLFFXKGXEKB-YRNRMSPPSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K82729862	BRD-K82729862-001-01-5	Broad Institute of MIT and Harvard	BRD-K82729862			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20-/m0/s1	IKJJLFFXKGXEKB-YRNRMSPPSA-N	405.26275663							115372
BRD-K31720099	LSM-26830		54633232	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16-,20+/m0/s1	BDXAOMRZMUOHST-TWOQFEAHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K31720099	BRD-K31720099-001-01-1	Broad Institute of MIT and Harvard	BRD-K31720099			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16-,20+/m0/s1	BDXAOMRZMUOHST-TWOQFEAHSA-N	484.235555602							115373
BRD-K06614664	LSM-26831		54633197	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19+,26+/m1/s1	FHVMFMOLSIFJFC-MVYHEMRASA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K06614664	BRD-K06614664-001-01-2	Broad Institute of MIT and Harvard	BRD-K06614664			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19+,26+/m1/s1	FHVMFMOLSIFJFC-MVYHEMRASA-N	497.268984862							115374
BRD-K00530465	LSM-26832		54633220	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23+/m0/s1	WEWHHSRLSBIWPH-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K00530465	BRD-K00530465-001-01-7	Broad Institute of MIT and Harvard	BRD-K00530465			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23+/m0/s1	WEWHHSRLSBIWPH-YGKZAACZSA-N	455.242021186							115375
BRD-K80357394	LSM-26833		54633485	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20+,25+/m0/s1	JAZMVIWKDLKWHZ-WZOHSFFVSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccncc3)[C@H](C)COc2c1	BroadT	BRD-K80357394	BRD-K80357394-001-01-4	Broad Institute of MIT and Harvard	BRD-K80357394			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccncc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-7-26(32)29-22-8-9-23-24(14-22)35-18-20(3)31(16-21-10-12-28-13-11-21)15-19(2)25(34-5)17-30(4)27(23)33/h8-14,19-20,25H,6-7,15-18H2,1-5H3,(H,29,32)/t19-,20+,25+/m0/s1	JAZMVIWKDLKWHZ-WZOHSFFVSA-N	482.289305736							115376
BRD-K86746660	LSM-26834		54633217	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23+/m1/s1	WEWHHSRLSBIWPH-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K86746660	BRD-K86746660-001-01-9	Broad Institute of MIT and Harvard	BRD-K86746660			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17-,23+/m1/s1	WEWHHSRLSBIWPH-QZMQVMSPSA-N	455.242021186							115377
BRD-K07959057	LSM-26835		54633322	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16-,21-/m0/s1	HHYKIZYLLRVKIM-QYWGDWMGSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K07959057	BRD-K07959057-001-01-5	Broad Institute of MIT and Harvard	BRD-K07959057			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16-,21-/m0/s1	HHYKIZYLLRVKIM-QYWGDWMGSA-N	495.15946949							115378
BRD-K96997646	LSM-26836		54633465	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15+,20-/m0/s1	IQGWQEXQBGDRAI-MDOVXXIYSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K96997646	BRD-K96997646-001-01-5	Broad Institute of MIT and Harvard	BRD-K96997646			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15+,20-/m0/s1	IQGWQEXQBGDRAI-MDOVXXIYSA-N	455.209006496							115379
BRD-K68547601	LSM-26837		54633468	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20-,26+/m1/s1	SPHXOOCVMGXZSD-KYTVRQNUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc4ccncc4)C[C@H]1C	BroadT	BRD-K68547601	BRD-K68547601-001-01-5	Broad Institute of MIT and Harvard	BRD-K68547601			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20-,26+/m1/s1	SPHXOOCVMGXZSD-KYTVRQNUSA-N	494.289305736							115380
BRD-K92655427	LSM-26838		54633377	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24+/m1/s1	AWPMFDCDNKJCST-KCYKTTMJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K92655427	BRD-K92655427-001-01-8	Broad Institute of MIT and Harvard	BRD-K92655427			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H32FN3O5/c1-16-13-30(18(3)31)17(2)15-35-23-12-21(28-25(32)19-7-6-8-20(27)11-19)9-10-22(23)26(33)29(4)14-24(16)34-5/h6-12,16-17,24H,13-15H2,1-5H3,(H,28,32)/t16-,17+,24+/m1/s1	AWPMFDCDNKJCST-KCYKTTMJSA-N	485.232599354							115381
BRD-K42016545	LSM-26839		54633214	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m0/s1	BCUUTPUMPAWJAT-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K42016545	BRD-K42016545-001-01-1	Broad Institute of MIT and Harvard	BRD-K42016545			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m0/s1	BCUUTPUMPAWJAT-MFEFFIJZSA-N	472.248583776							115382
BRD-K22471908	LSM-26840		54633464	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15-,20-/m0/s1	IQGWQEXQBGDRAI-AVYPCKFXSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K22471908	BRD-K22471908-001-01-3	Broad Institute of MIT and Harvard	BRD-K22471908			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C21H33N3O6S/c1-7-31(27,28)22-17-8-9-19-18(10-17)21(26)23(5)12-20(29-6)14(2)11-24(16(4)25)15(3)13-30-19/h8-10,14-15,20,22H,7,11-13H2,1-6H3/t14-,15-,20-/m0/s1	IQGWQEXQBGDRAI-AVYPCKFXSA-N	455.209006496							115383
BRD-K51502220	LSM-26841		54633420	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20-/m1/s1	PRQHOYZGRSXLAM-JXXFODFXSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K51502220	BRD-K51502220-001-01-0	Broad Institute of MIT and Harvard	BRD-K51502220			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20-/m1/s1	PRQHOYZGRSXLAM-JXXFODFXSA-N	420.273655672							115384
BRD-K14925361	LSM-26842		54633286	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21-,28+/m1/s1	HSWIGQKLSXZYGZ-CJYOKPGZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)c4ccccc4)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K14925361	BRD-K14925361-001-01-8	Broad Institute of MIT and Harvard	BRD-K14925361			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(cc3)-c3ccccc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C29H35N3O5S/c1-20-17-30-21(2)19-37-27-15-12-24(16-26(27)29(33)32(3)18-28(20)36-4)31-38(34,35)25-13-10-23(11-14-25)22-8-6-5-7-9-22/h5-16,20-21,28,30-31H,17-19H2,1-4H3/t20-,21-,28+/m1/s1	HSWIGQKLSXZYGZ-CJYOKPGZSA-N	537.22974194							115385
CHEMBL2356360	LSM-26843	BRD-K62213484, SID131429639	54633388	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23-/m1/s1	HWGKHULHTVQYGT-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K62213484	BRD-K62213484-001-01-2	Broad Institute of MIT and Harvard	BRD-K62213484			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23-/m1/s1	HWGKHULHTVQYGT-SAHWJRBASA-N	491.209006496							115386
BRD-K61929684	LSM-26844		54633503	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	AMWULHWHNZGRQW-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccccn3	BroadT	BRD-K61929684	BRD-K61929684-001-01-2	Broad Institute of MIT and Harvard	BRD-K61929684			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccn1	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	AMWULHWHNZGRQW-SAHWJRBASA-N	468.237270164							115387
BRD-K82107155	LSM-26845		54633261	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22-/m0/s1	DKOCUBLREHHOPE-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K82107155	BRD-K82107155-001-01-0	Broad Institute of MIT and Harvard	BRD-K82107155			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22-/m0/s1	DKOCUBLREHHOPE-DMPWYTOCSA-N	443.22203467							115388
BRD-K84233365	LSM-26846		54633203	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20+/m1/s1	IKJJLFFXKGXEKB-GUXCAODWSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K84233365	BRD-K84233365-001-01-8	Broad Institute of MIT and Harvard	BRD-K84233365			CCCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20+/m1/s1	IKJJLFFXKGXEKB-GUXCAODWSA-N	405.26275663							115389
BRD-K04036799	LSM-26847		54633249	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m1/s1	IPCOCSCQFWJAQB-SXGZJXTBSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K04036799	BRD-K04036799-001-01-8	Broad Institute of MIT and Harvard	BRD-K04036799			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m1/s1	IPCOCSCQFWJAQB-SXGZJXTBSA-N	435.236935806							115390
BRD-K88498468	LSM-26848		54633279	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,21+/m0/s1	VQXGITUCISALNO-CKJXQJPGSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)C3CC3	BroadT	BRD-K88498468	BRD-K88498468-001-01-9	Broad Institute of MIT and Harvard	BRD-K88498468			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)C2CC2)c1	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,21+/m0/s1	VQXGITUCISALNO-CKJXQJPGSA-N	445.25767125							115391
BRD-K84241565	LSM-26849		54633423	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20+/m1/s1	PRQHOYZGRSXLAM-GUXCAODWSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K84241565	BRD-K84241565-001-01-9	Broad Institute of MIT and Harvard	BRD-K84241565			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-19-18(11-17)21(27)26(5)13-20(29-6)15(2)12-25(4)16(3)14-30-19/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20+/m1/s1	PRQHOYZGRSXLAM-GUXCAODWSA-N	420.273655672							115392
BRD-K63579322	LSM-26850		54633360	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21-/m1/s1	ADNFOFPYARHFIV-WHSLLNHNSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K63579322	BRD-K63579322-001-01-1	Broad Institute of MIT and Harvard	BRD-K63579322			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21-/m1/s1	ADNFOFPYARHFIV-WHSLLNHNSA-N	433.25767125							115393
BRD-K42367391	LSM-26851		54633196	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19-,26+/m0/s1	FHVMFMOLSIFJFC-LZJCXSABSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K42367391	BRD-K42367391-001-01-3	Broad Institute of MIT and Harvard	BRD-K42367391			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19-,26+/m0/s1	FHVMFMOLSIFJFC-LZJCXSABSA-N	497.268984862							115394
BRD-K50367303	LSM-26852		54633281	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,21-/m0/s1	VQXGITUCISALNO-QYWGDWMGSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)C3CC3	BroadT	BRD-K50367303	BRD-K50367303-001-01-9	Broad Institute of MIT and Harvard	BRD-K50367303			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)C2CC2)c1	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16-,21-/m0/s1	VQXGITUCISALNO-QYWGDWMGSA-N	445.25767125							115395
BRD-K33697018	LSM-26853		54633268	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16-,22-/m0/s1	OTCOGNWSMBTRMR-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC3CC3	BroadT	BRD-K33697018	BRD-K33697018-001-01-7	Broad Institute of MIT and Harvard	BRD-K33697018			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16-,22-/m0/s1	OTCOGNWSMBTRMR-WCJKSRRJSA-N	445.25767125							115396
BRD-K53617314	LSM-26854		54633404	InChI=1S/C32H40N4O4/c1-6-31(37)34-26-14-15-29-27(17-26)32(38)35(4)20-30(39-5)22(2)18-36(23(3)21-40-29)19-24-10-12-25(13-11-24)28-9-7-8-16-33-28/h7-17,22-23,30H,6,18-21H2,1-5H3,(H,34,37)/t22-,23-,30-/m1/s1	OLNTYBWXSHFDFU-IQLGONJTSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccc(cc3)c4ccccn4)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K53617314	BRD-K53617314-001-01-1	Broad Institute of MIT and Harvard	BRD-K53617314			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccc(cc3)-c3ccccn3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C32H40N4O4/c1-6-31(37)34-26-14-15-29-27(17-26)32(38)35(4)20-30(39-5)22(2)18-36(23(3)21-40-29)19-24-10-12-25(13-11-24)28-9-7-8-16-33-28/h7-17,22-23,30H,6,18-21H2,1-5H3,(H,34,37)/t22-,23-,30-/m1/s1	OLNTYBWXSHFDFU-IQLGONJTSA-N	544.3049558							115397
BRD-K71274071	LSM-26855		54633365	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21-/m0/s1	ADNFOFPYARHFIV-QYWGDWMGSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K71274071	BRD-K71274071-001-01-2	Broad Institute of MIT and Harvard	BRD-K71274071			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-20-19(11-18)23(29)25(5)13-21(30-6)15(2)12-26(17(4)27)16(3)14-31-20/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21-/m0/s1	ADNFOFPYARHFIV-QYWGDWMGSA-N	433.25767125							115398
BRD-K16355056	LSM-26856		54633390	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25+/m1/s1	KLLGWSLDFNRCLI-RRQZXNHTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(CC4CCOCC4)C[C@H]1C	BroadT	BRD-K16355056	BRD-K16355056-001-01-6	Broad Institute of MIT and Harvard	BRD-K16355056			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(CC2CCOCC2)C[C@H]1C	InChI=1S/C27H41N3O5/c1-18-14-30(15-20-9-11-34-12-10-20)19(2)17-35-24-13-22(28-26(31)21-5-6-21)7-8-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25+/m1/s1	KLLGWSLDFNRCLI-RRQZXNHTSA-N	487.304621442							115399
BRD-K30491662	LSM-26857		54633225	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(9-10-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-7-6-8-20(11-18)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m0/s1	NAQHKEYVSHPAHI-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(OC)c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K30491662	BRD-K30491662-001-01-7	Broad Institute of MIT and Harvard	BRD-K30491662			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(OC)c3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(9-10-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-7-6-8-20(11-18)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m0/s1	NAQHKEYVSHPAHI-MFEFFIJZSA-N	470.252920228							115400
BRD-K99530482	LSM-26858		54633398	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17-,23+/m0/s1	UPIUFFQPNYDCFX-HKARXFIJSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H]1C)OC	BroadT	BRD-K99530482	BRD-K99530482-001-01-8	Broad Institute of MIT and Harvard	BRD-K99530482			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H]1C)OC	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17-,23+/m0/s1	UPIUFFQPNYDCFX-HKARXFIJSA-N	501.295119398							115401
BRD-K73577714	LSM-26859		54633316	InChI=1S/C25H37N5O6S/c1-7-8-23(31)27-19-9-10-20-21(11-19)36-15-18(3)30(37(33,34)24-14-28(4)16-26-24)12-17(2)22(35-6)13-29(5)25(20)32/h9-11,14,16-18,22H,7-8,12-13,15H2,1-6H3,(H,27,31)/t17-,18+,22-/m1/s1	YAZPLJHKVLFFGT-KGVIQGDOSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K73577714	BRD-K73577714-001-01-9	Broad Institute of MIT and Harvard	BRD-K73577714			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)S(=O)(=O)c2cn(C)cn2)c1	InChI=1S/C25H37N5O6S/c1-7-8-23(31)27-19-9-10-20-21(11-19)36-15-18(3)30(37(33,34)24-14-28(4)16-26-24)12-17(2)22(35-6)13-29(5)25(20)32/h9-11,14,16-18,22H,7-8,12-13,15H2,1-6H3,(H,27,31)/t17-,18+,22-/m1/s1	YAZPLJHKVLFFGT-KGVIQGDOSA-N	535.246454644							115402
BRD-K00411149	LSM-26860		54633371	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m1/s1	GETIABPODKAIIC-SIFCLUCFSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C	BroadT	BRD-K00411149	BRD-K00411149-001-01-4	Broad Institute of MIT and Harvard	BRD-K00411149			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-18-19(10-17)30-13-15(3)25(16(4)26)11-14(2)20(29-6)12-24(5)22(18)28/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m1/s1	GETIABPODKAIIC-SIFCLUCFSA-N	419.242021186							115403
BRD-K52492854	LSM-26861		54633195	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19-,26+/m1/s1	FHVMFMOLSIFJFC-UDCNLSRBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K52492854	BRD-K52492854-001-01-6	Broad Institute of MIT and Harvard	BRD-K52492854			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3F)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-9-10-20)19(2)17-36-25-13-21(30-27(33)22-7-5-6-8-24(22)29)11-12-23(25)28(34)31(3)16-26(18)35-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)/t18-,19-,26+/m1/s1	FHVMFMOLSIFJFC-UDCNLSRBSA-N	497.268984862							115404
BRD-K78697404	LSM-26862		54633315	InChI=1S/C25H37N5O6S/c1-7-8-23(31)27-19-9-10-20-21(11-19)36-15-18(3)30(37(33,34)24-14-28(4)16-26-24)12-17(2)22(35-6)13-29(5)25(20)32/h9-11,14,16-18,22H,7-8,12-13,15H2,1-6H3,(H,27,31)/t17-,18+,22-/m0/s1	YAZPLJHKVLFFGT-SVMVAKDDSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K78697404	BRD-K78697404-001-01-5	Broad Institute of MIT and Harvard	BRD-K78697404			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)S(=O)(=O)c2cn(C)cn2)c1	InChI=1S/C25H37N5O6S/c1-7-8-23(31)27-19-9-10-20-21(11-19)36-15-18(3)30(37(33,34)24-14-28(4)16-26-24)12-17(2)22(35-6)13-29(5)25(20)32/h9-11,14,16-18,22H,7-8,12-13,15H2,1-6H3,(H,27,31)/t17-,18+,22-/m0/s1	YAZPLJHKVLFFGT-SVMVAKDDSA-N	535.246454644							115405
BRD-K19161227	LSM-26863		54633317	InChI=1S/C29H39N5O6S/c1-20-14-34(15-22-8-7-9-24(12-22)38-5)21(2)18-40-26-13-23(31-41(36,37)28-17-32(3)19-30-28)10-11-25(26)29(35)33(4)16-27(20)39-6/h7-13,17,19-21,27,31H,14-16,18H2,1-6H3/t20-,21-,27-/m1/s1	PBRMDHGSJWKIAR-LGVUCKNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc4cccc(OC)c4)C[C@H]1C	BroadT	BRD-K19161227	BRD-K19161227-001-01-9	Broad Institute of MIT and Harvard	BRD-K19161227			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cn(C)cn3)cc2OC[C@@H](C)N(Cc2cccc(OC)c2)C[C@H]1C	InChI=1S/C29H39N5O6S/c1-20-14-34(15-22-8-7-9-24(12-22)38-5)21(2)18-40-26-13-23(31-41(36,37)28-17-32(3)19-30-28)10-11-25(26)29(35)33(4)16-27(20)39-6/h7-13,17,19-21,27,31H,14-16,18H2,1-6H3/t20-,21-,27-/m1/s1	PBRMDHGSJWKIAR-LGVUCKNBSA-N	585.262104708							115406
BRD-K92581247	LSM-26864		54633219	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23+/m1/s1	WEWHHSRLSBIWPH-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K92581247	BRD-K92581247-001-01-4	Broad Institute of MIT and Harvard	BRD-K92581247			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H33N3O5/c1-16-13-26-17(2)15-33-22-12-19(27-24(29)18-6-9-20(31-4)10-7-18)8-11-21(22)25(30)28(3)14-23(16)32-5/h6-12,16-17,23,26H,13-15H2,1-5H3,(H,27,29)/t16-,17+,23+/m1/s1	WEWHHSRLSBIWPH-DGGJZMOXSA-N	455.242021186							115407
BRD-K35429158	LSM-26865		54633257	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22+/m0/s1	DKOCUBLREHHOPE-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K35429158	BRD-K35429158-001-01-3	Broad Institute of MIT and Harvard	BRD-K35429158			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22+/m0/s1	DKOCUBLREHHOPE-PONJGIIJSA-N	443.22203467							115408
BRD-K45941986	LSM-26866		54633306	InChI=1S/C26H33N5O5/c1-16-13-31(26(34)21-12-27-9-10-28-21)17(2)15-36-22-11-19(29-24(32)18-5-6-18)7-8-20(22)25(33)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23-/m1/s1	KUWUIGLKRHREQK-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4cnccn4	BroadT	BRD-K45941986	BRD-K45941986-001-01-3	Broad Institute of MIT and Harvard	BRD-K45941986			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c1-16-13-31(26(34)21-12-27-9-10-28-21)17(2)15-36-22-11-19(29-24(32)18-5-6-18)7-8-20(22)25(33)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23-/m1/s1	KUWUIGLKRHREQK-SEPYTNNBSA-N	495.248169206							115409
BRD-K85234739	LSM-26867		54633405	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15-,19+/m0/s1	UQDKPOMZCZHHDG-YZVOILCLSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K85234739	BRD-K85234739-001-01-4	Broad Institute of MIT and Harvard	BRD-K85234739			CCS(=O)(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C20H33N3O5S/c1-7-29(25,26)21-16-8-9-18-17(10-16)20(24)23(5)12-19(27-6)14(2)11-22(4)15(3)13-28-18/h8-10,14-15,19,21H,7,11-13H2,1-6H3/t14-,15-,19+/m0/s1	UQDKPOMZCZHHDG-YZVOILCLSA-N	427.214091876							115410
BRD-K39761541	LSM-26868		54633474	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20+,26-/m1/s1	SPHXOOCVMGXZSD-BVFVYWQFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc4ccncc4)C[C@H]1C	BroadT	BRD-K39761541	BRD-K39761541-001-01-1	Broad Institute of MIT and Harvard	BRD-K39761541			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20+,26-/m1/s1	SPHXOOCVMGXZSD-BVFVYWQFSA-N	494.289305736							115411
BRD-K48634117	LSM-26869		54633309	InChI=1S/C26H33N5O5/c1-16-13-31(26(34)21-12-27-9-10-28-21)17(2)15-36-22-11-19(29-24(32)18-5-6-18)7-8-20(22)25(33)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17+,23+/m1/s1	KUWUIGLKRHREQK-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c4cnccn4	BroadT	BRD-K48634117	BRD-K48634117-001-01-3	Broad Institute of MIT and Harvard	BRD-K48634117			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c1-16-13-31(26(34)21-12-27-9-10-28-21)17(2)15-36-22-11-19(29-24(32)18-5-6-18)7-8-20(22)25(33)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17+,23+/m1/s1	KUWUIGLKRHREQK-DGGJZMOXSA-N	495.248169206							115412
BRD-K77417197	LSM-26870		54633205	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16-,20-/m0/s1	IKJJLFFXKGXEKB-FTRWYGJKSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K77417197	BRD-K77417197-001-01-0	Broad Institute of MIT and Harvard	BRD-K77417197			CCCC(=O)Nc1ccc2OC[C@H](C)N(C)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-19-18(11-17)22(27)25(5)13-20(28-6)15(2)12-24(4)16(3)14-29-19/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16-,20-/m0/s1	IKJJLFFXKGXEKB-FTRWYGJKSA-N	405.26275663							115413
BRD-K75821161	LSM-26871		54633308	InChI=1S/C26H33N5O5/c1-16-13-31(26(34)21-12-27-9-10-28-21)17(2)15-36-22-11-19(29-24(32)18-5-6-18)7-8-20(22)25(33)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23+/m0/s1	KUWUIGLKRHREQK-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4cnccn4	BroadT	BRD-K75821161	BRD-K75821161-001-01-7	Broad Institute of MIT and Harvard	BRD-K75821161			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c1-16-13-31(26(34)21-12-27-9-10-28-21)17(2)15-36-22-11-19(29-24(32)18-5-6-18)7-8-20(22)25(33)30(3)14-23(16)35-4/h7-12,16-18,23H,5-6,13-15H2,1-4H3,(H,29,32)/t16-,17-,23+/m0/s1	KUWUIGLKRHREQK-HKARXFIJSA-N	495.248169206							115414
BRD-K82224868	LSM-26872		54633470	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20+,26+/m0/s1	SPHXOOCVMGXZSD-OUDXUNEISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc4ccncc4)C[C@@H]1C	BroadT	BRD-K82224868	BRD-K82224868-001-01-1	Broad Institute of MIT and Harvard	BRD-K82224868			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-21-10-12-29-13-11-21)20(2)18-36-25-9-8-23(30-27(33)22-6-5-7-22)14-24(25)28(34)31(3)17-26(19)35-4/h8-14,19-20,22,26H,5-7,15-18H2,1-4H3,(H,30,33)/t19-,20+,26+/m0/s1	SPHXOOCVMGXZSD-OUDXUNEISA-N	494.289305736							115415
BRD-K07336866	LSM-26873		54633331	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	YXLXBGWRVYMONT-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K07336866	BRD-K07336866-001-01-7	Broad Institute of MIT and Harvard	BRD-K07336866			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	YXLXBGWRVYMONT-PONJGIIJSA-N	458.232933712							115416
BRD-K42008693	LSM-26874		54633502	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	AMWULHWHNZGRQW-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccccn3	BroadT	BRD-K42008693	BRD-K42008693-001-01-8	Broad Institute of MIT and Harvard	BRD-K42008693			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccn1	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	AMWULHWHNZGRQW-MFEFFIJZSA-N	468.237270164							115417
BRD-K62957665	LSM-26875		54633280	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,21+/m1/s1	VQXGITUCISALNO-XFQAVAEZSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C3CC3	BroadT	BRD-K62957665	BRD-K62957665-001-01-5	Broad Institute of MIT and Harvard	BRD-K62957665			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)C2CC2)c1	InChI=1S/C24H35N3O5/c1-6-22(28)25-18-9-10-19-20(11-18)32-14-16(3)27(23(29)17-7-8-17)12-15(2)21(31-5)13-26(4)24(19)30/h9-11,15-17,21H,6-8,12-14H2,1-5H3,(H,25,28)/t15-,16+,21+/m1/s1	VQXGITUCISALNO-XFQAVAEZSA-N	445.25767125							115418
BRD-K99638698	LSM-26876		54633259	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22+/m0/s1	DKOCUBLREHHOPE-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K99638698	BRD-K99638698-001-01-9	Broad Institute of MIT and Harvard	BRD-K99638698			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22+/m0/s1	DKOCUBLREHHOPE-WJONJSRFSA-N	443.22203467							115419
BRD-K64111129	LSM-26877		54633385	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23+/m1/s1	HWGKHULHTVQYGT-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K64111129	BRD-K64111129-001-01-7	Broad Institute of MIT and Harvard	BRD-K64111129			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(OC)c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H33N3O6S/c1-16-13-25-17(2)15-33-22-11-18(9-10-21(22)24(28)27(3)14-23(16)32-5)26-34(29,30)20-8-6-7-19(12-20)31-4/h6-12,16-17,23,25-26H,13-15H2,1-5H3/t16-,17+,23+/m1/s1	HWGKHULHTVQYGT-DGGJZMOXSA-N	491.209006496							115420
BRD-K08359838	LSM-26878		54633269	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16+,22-/m0/s1	OTCOGNWSMBTRMR-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC3CC3	BroadT	BRD-K08359838	BRD-K08359838-001-01-3	Broad Institute of MIT and Harvard	BRD-K08359838			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16+,22-/m0/s1	OTCOGNWSMBTRMR-DMPWYTOCSA-N	445.25767125							115421
BRD-K99221119	LSM-26879		54633445	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-20-21(11-19)35-14-18(6)30(25(33)27-16(3)4)12-17(5)22(34-8)13-29(7)23(20)31/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22+/m0/s1	JABHCOSNXLYONB-NJNPRVFISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K99221119	BRD-K99221119-001-01-5	Broad Institute of MIT and Harvard	BRD-K99221119			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-20-21(11-19)35-14-18(6)30(25(33)27-16(3)4)12-17(5)22(34-8)13-29(7)23(20)31/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22+/m0/s1	JABHCOSNXLYONB-NJNPRVFISA-N	491.310769462							115422
BRD-K31021810	LSM-26880		54633314	InChI=1S/C25H37N5O6S/c1-7-8-23(31)27-19-9-10-20-21(11-19)36-15-18(3)30(37(33,34)24-14-28(4)16-26-24)12-17(2)22(35-6)13-29(5)25(20)32/h9-11,14,16-18,22H,7-8,12-13,15H2,1-6H3,(H,27,31)/t17-,18+,22+/m0/s1	YAZPLJHKVLFFGT-NJNPRVFISA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)S(=O)(=O)c3cn(C)cn3	BroadT	BRD-K31021810	BRD-K31021810-001-01-2	Broad Institute of MIT and Harvard	BRD-K31021810			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)S(=O)(=O)c2cn(C)cn2)c1	InChI=1S/C25H37N5O6S/c1-7-8-23(31)27-19-9-10-20-21(11-19)36-15-18(3)30(37(33,34)24-14-28(4)16-26-24)12-17(2)22(35-6)13-29(5)25(20)32/h9-11,14,16-18,22H,7-8,12-13,15H2,1-6H3,(H,27,31)/t17-,18+,22+/m0/s1	YAZPLJHKVLFFGT-NJNPRVFISA-N	535.246454644							115423
BRD-K11506071	LSM-26881		54633435	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16+,22-/m1/s1	YNEIZQUEDXPWMX-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(CC3CC3)C[C@H]1C	BroadT	BRD-K11506071	BRD-K11506071-001-01-0	Broad Institute of MIT and Harvard	BRD-K11506071			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16+,22-/m1/s1	YNEIZQUEDXPWMX-ZMPRRUGASA-N	417.26275663							115424
BRD-K56426074	LSM-26882		54633236	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16-,20-/m0/s1	BDXAOMRZMUOHST-FTRWYGJKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K56426074	BRD-K56426074-001-01-4	Broad Institute of MIT and Harvard	BRD-K56426074			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16-,20-/m0/s1	BDXAOMRZMUOHST-FTRWYGJKSA-N	484.235555602							115425
BRD-K92950328	LSM-26883		54633296	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-9-10-22-21(12-20)26(33)29(4)15-23(34-5)17(2)14-30(18(3)16-35-22)25(32)19-8-7-11-27-13-19/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	WCPNWHOTSKXGIK-IXFSTUDKSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3cccnc3	BroadT	BRD-K92950328	BRD-K92950328-001-01-3	Broad Institute of MIT and Harvard	BRD-K92950328			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1cccnc1	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-9-10-22-21(12-20)26(33)29(4)15-23(34-5)17(2)14-30(18(3)16-35-22)25(32)19-8-7-11-27-13-19/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	WCPNWHOTSKXGIK-IXFSTUDKSA-N	482.252920228							115426
BRD-K38487270	LSM-26884		54633434	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16+,22-/m0/s1	YNEIZQUEDXPWMX-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(CC3CC3)C[C@@H]1C	BroadT	BRD-K38487270	BRD-K38487270-001-01-1	Broad Institute of MIT and Harvard	BRD-K38487270			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C23H35N3O4/c1-15-11-26(12-18-6-7-18)16(2)14-30-21-10-19(24-17(3)27)8-9-20(21)23(28)25(4)13-22(15)29-5/h8-10,15-16,18,22H,6-7,11-14H2,1-5H3,(H,24,27)/t15-,16+,22-/m0/s1	YNEIZQUEDXPWMX-DMPWYTOCSA-N	417.26275663							115427
BRD-K82064887	LSM-26885		54633295	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-9-10-22-21(12-20)26(33)29(4)15-23(34-5)17(2)14-30(18(3)16-35-22)25(32)19-8-7-11-27-13-19/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m0/s1	WCPNWHOTSKXGIK-BSRJHKFKSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3cccnc3	BroadT	BRD-K82064887	BRD-K82064887-001-01-8	Broad Institute of MIT and Harvard	BRD-K82064887			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1cccnc1	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-9-10-22-21(12-20)26(33)29(4)15-23(34-5)17(2)14-30(18(3)16-35-22)25(32)19-8-7-11-27-13-19/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m0/s1	WCPNWHOTSKXGIK-BSRJHKFKSA-N	482.252920228							115428
BRD-K84935293	LSM-26886		54633258	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22+/m1/s1	DKOCUBLREHHOPE-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K84935293	BRD-K84935293-001-01-5	Broad Institute of MIT and Harvard	BRD-K84935293			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22+/m1/s1	DKOCUBLREHHOPE-VVBPWWLESA-N	443.22203467							115429
BRD-K59821372	LSM-26887		54633238	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16+,20-/m1/s1	BDXAOMRZMUOHST-GQIGUUNPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K59821372	BRD-K59821372-001-01-2	Broad Institute of MIT and Harvard	BRD-K59821372			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C22H36N4O6S/c1-15-11-26(21(27)13-24(3)4)16(2)14-32-19-9-8-17(23-33(7,29)30)10-18(19)22(28)25(5)12-20(15)31-6/h8-10,15-16,20,23H,11-14H2,1-7H3/t15-,16+,20-/m1/s1	BDXAOMRZMUOHST-GQIGUUNPSA-N	484.235555602							115430
BRD-K37564297	LSM-26888		54633453	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18-,23+/m1/s1	GMUJITXJIMGEOF-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K37564297	BRD-K37564297-001-01-7	Broad Institute of MIT and Harvard	BRD-K37564297			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C26H38F3N3O4/c1-17-14-32(12-11-26(27,28)29)18(2)16-36-22-13-20(30-24(33)19-7-5-6-8-19)9-10-21(22)25(34)31(3)15-23(17)35-4/h9-10,13,17-19,23H,5-8,11-12,14-16H2,1-4H3,(H,30,33)/t17-,18-,23+/m1/s1	GMUJITXJIMGEOF-PNCHPQGNSA-N	513.281441326							115431
BRD-K10820981	LSM-26889		54633343	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17+,22-/m0/s1	FXOJDLIATDATEB-JKSBSHDWSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	BroadT	BRD-K10820981	BRD-K10820981-001-01-5	Broad Institute of MIT and Harvard	BRD-K10820981			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)c3cnccn3)ccc2OC[C@H]1C)OC	InChI=1S/C25H33N5O5/c1-6-23(31)30-13-16(2)22(34-5)14-29(4)25(33)19-11-18(7-8-21(19)35-15-17(30)3)28-24(32)20-12-26-9-10-27-20/h7-12,16-17,22H,6,13-15H2,1-5H3,(H,28,32)/t16-,17+,22-/m0/s1	FXOJDLIATDATEB-JKSBSHDWSA-N	483.248169206							115432
BRD-K32495578	LSM-26890		54633260	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22-/m0/s1	DKOCUBLREHHOPE-WCJKSRRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K32495578	BRD-K32495578-001-01-9	Broad Institute of MIT and Harvard	BRD-K32495578			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16-,22-/m0/s1	DKOCUBLREHHOPE-WCJKSRRJSA-N	443.22203467							115433
BRD-K06029218	LSM-26891		54633293	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-9-10-22-21(12-20)26(33)29(4)15-23(34-5)17(2)14-30(18(3)16-35-22)25(32)19-8-7-11-27-13-19/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	WCPNWHOTSKXGIK-STSQHVNTSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c3cccnc3	BroadT	BRD-K06029218	BRD-K06029218-001-01-4	Broad Institute of MIT and Harvard	BRD-K06029218			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)c1cccnc1	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-9-10-22-21(12-20)26(33)29(4)15-23(34-5)17(2)14-30(18(3)16-35-22)25(32)19-8-7-11-27-13-19/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	WCPNWHOTSKXGIK-STSQHVNTSA-N	482.252920228							115434
BRD-K05127596	LSM-26892		54633262	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22-/m1/s1	DKOCUBLREHHOPE-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K05127596	BRD-K05127596-001-01-9	Broad Institute of MIT and Harvard	BRD-K05127596			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30FN3O4/c1-15-12-26-16(2)14-32-21-11-19(27-23(29)17-6-5-7-18(25)10-17)8-9-20(21)24(30)28(3)13-22(15)31-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H,27,29)/t15-,16+,22-/m1/s1	DKOCUBLREHHOPE-ZMPRRUGASA-N	443.22203467							115435
BRD-K43611837	LSM-26893		54633252	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m0/s1	IPCOCSCQFWJAQB-AVYPCKFXSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K43611837	BRD-K43611837-001-01-5	Broad Institute of MIT and Harvard	BRD-K43611837			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-8-7-17(23-21(27)13-29-5)9-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m0/s1	IPCOCSCQFWJAQB-AVYPCKFXSA-N	435.236935806							115436
BRD-K72549552	LSM-26894		54633324	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21-/m1/s1	HHYKIZYLLRVKIM-VWKPWSFCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K72549552	BRD-K72549552-001-01-4	Broad Institute of MIT and Harvard	BRD-K72549552			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H30ClN3O5S/c1-15-12-25-16(2)14-32-20-11-17(26-33(29,30)22-8-6-5-7-19(22)24)9-10-18(20)23(28)27(3)13-21(15)31-4/h5-11,15-16,21,25-26H,12-14H2,1-4H3/t15-,16+,21-/m1/s1	HHYKIZYLLRVKIM-VWKPWSFCSA-N	495.15946949							115437
BRD-K83697352	LSM-26895		54633332	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	YXLXBGWRVYMONT-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K83697352	BRD-K83697352-001-01-0	Broad Institute of MIT and Harvard	BRD-K83697352			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-17(27-24(31)28-20-8-6-5-7-19(20)25)9-10-18(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	YXLXBGWRVYMONT-VVBPWWLESA-N	458.232933712							115438
BRD-K77884956	LSM-26896		54633213	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m1/s1	BCUUTPUMPAWJAT-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K77884956	BRD-K77884956-001-01-2	Broad Institute of MIT and Harvard	BRD-K77884956			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(F)c3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-10-9-20(12-21(22)24(31)30(4)14-23(16)33-5)28-25(32)27-19-8-6-7-18(26)11-19/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23-/m1/s1	BCUUTPUMPAWJAT-SEPYTNNBSA-N	472.248583776							115439
BRD-K06475437	LSM-26897		54633264	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16-,22+/m0/s1	OTCOGNWSMBTRMR-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC3CC3	BroadT	BRD-K06475437	BRD-K06475437-001-01-4	Broad Institute of MIT and Harvard	BRD-K06475437			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C24H35N3O5/c1-15-12-27(23(29)10-18-6-7-18)16(2)14-32-21-9-8-19(25-17(3)28)11-20(21)24(30)26(4)13-22(15)31-5/h8-9,11,15-16,18,22H,6-7,10,12-14H2,1-5H3,(H,25,28)/t15-,16-,22+/m0/s1	OTCOGNWSMBTRMR-PONJGIIJSA-N	445.25767125							115440
BRD-K53703060	LSM-26898		54633501	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m0/s1	AMWULHWHNZGRQW-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccccn3	BroadT	BRD-K53703060	BRD-K53703060-001-01-5	Broad Institute of MIT and Harvard	BRD-K53703060			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccn1	InChI=1S/C25H32N4O5/c1-16-13-29(25(32)21-8-6-7-11-26-21)17(2)15-34-22-10-9-19(27-18(3)30)12-20(22)24(31)28(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m0/s1	AMWULHWHNZGRQW-QQMNAOGKSA-N	468.237270164							115441
BRD-K42871839	LSM-26899		54633297	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-9-10-22-21(12-20)26(33)29(4)15-23(34-5)17(2)14-30(18(3)16-35-22)25(32)19-8-7-11-27-13-19/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	WCPNWHOTSKXGIK-IEGUWTFLSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c3cccnc3	BroadT	BRD-K42871839	BRD-K42871839-001-01-4	Broad Institute of MIT and Harvard	BRD-K42871839			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)c1cccnc1	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-9-10-22-21(12-20)26(33)29(4)15-23(34-5)17(2)14-30(18(3)16-35-22)25(32)19-8-7-11-27-13-19/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	WCPNWHOTSKXGIK-IEGUWTFLSA-N	482.252920228							115442
BRD-K92468187	LSM-26900		54633302	InChI=1S/C27H34N4O5S2/c1-19-15-31(17-26-28-12-13-37-26)20(2)18-36-24-14-21(29-38(33,34)22-8-6-5-7-9-22)10-11-23(24)27(32)30(3)16-25(19)35-4/h5-14,19-20,25,29H,15-18H2,1-4H3/t19-,20+,25+/m1/s1	DFOOTVJERHUVDB-RNHFSVANSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K92468187	BRD-K92468187-001-01-6	Broad Institute of MIT and Harvard	BRD-K92468187			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C27H34N4O5S2/c1-19-15-31(17-26-28-12-13-37-26)20(2)18-36-24-14-21(29-38(33,34)22-8-6-5-7-9-22)10-11-23(24)27(32)30(3)16-25(19)35-4/h5-14,19-20,25,29H,15-18H2,1-4H3/t19-,20+,25+/m1/s1	DFOOTVJERHUVDB-RNHFSVANSA-N	558.197061608							115443
BRD-K27026825	LSM-26901		54633412	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15-,21-/m1/s1	OTZAREIZRHIYQA-VTJXTGGHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CC3	BroadT	BRD-K27026825	BRD-K27026825-001-01-0	Broad Institute of MIT and Harvard	BRD-K27026825			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CC1	InChI=1S/C23H33N3O5/c1-14-11-26(22(28)17-6-7-17)15(2)13-31-20-9-8-18(24-16(3)27)10-19(20)23(29)25(4)12-21(14)30-5/h8-10,14-15,17,21H,6-7,11-13H2,1-5H3,(H,24,27)/t14-,15-,21-/m1/s1	OTZAREIZRHIYQA-VTJXTGGHSA-N	431.242021186							115444
BRD-K96491043	LSM-26902		54633399	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17+,23+/m1/s1	UPIUFFQPNYDCFX-DGGJZMOXSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)onc3C)cc2OC[C@@H]1C)OC	BroadT	BRD-K96491043	BRD-K96491043-001-01-8	Broad Institute of MIT and Harvard	BRD-K96491043			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)Nc3c(C)noc3C)cc2OC[C@@H]1C)OC	InChI=1S/C26H39N5O5/c1-8-11-31-13-16(2)23(34-7)14-30(6)25(32)21-10-9-20(12-22(21)35-15-17(31)3)27-26(33)28-24-18(4)29-36-19(24)5/h9-10,12,16-17,23H,8,11,13-15H2,1-7H3,(H2,27,28,33)/t16-,17+,23+/m1/s1	UPIUFFQPNYDCFX-DGGJZMOXSA-N	501.295119398							115445
T5368231	LSM-26903	BRD-K43017905, SID24831802	2622544	InChI=1S/C17H20N2O4/c1-23-14(20)13-7-5-12(6-8-13)11-19-15(21)17(18-16(19)22)9-3-2-4-10-17/h5-8H,2-4,9-11H2,1H3,(H,18,22)	ZJSOEFXABVVYCZ-UHFFFAOYSA-N	COC(=O)c1ccc(CN2C(=O)NC3(CCCCC3)C2=O)cc1	BroadT	BRD-K43017905	BRD-K43017905-001-05-3	Enamine Ltd.	ZT-1792391			COC(=O)c1ccc(CN2C(=O)NC3(CCCCC3)C2=O)cc1	InChI=1S/C17H20N2O4/c1-23-14(20)13-7-5-12(6-8-13)11-19-15(21)17(18-16(19)22)9-3-2-4-10-17/h5-8H,2-4,9-11H2,1H3,(H,18,22)	ZJSOEFXABVVYCZ-UHFFFAOYSA-N	316.14230714							115446
AC1M1XEQ	LSM-26904	BRD-K10269761, SID24816742	2157931	InChI=1S/C24H22F2N4S/c1-16-21(22-13-19(26)7-8-23(22)28-16)9-11-30(15-17-4-3-10-27-14-17)24(31)29-20-6-2-5-18(25)12-20/h2-8,10,12-14,28H,9,11,15H2,1H3,(H,29,31)	JSJDJVKIJBHDEV-UHFFFAOYSA-N	Cc1[nH]c2ccc(F)cc2c1CCN(Cc3cccnc3)C(=Nc4cccc(F)c4)S	BroadT	BRD-K10269761	BRD-K10269761-001-06-0	Life Chemicals Inc.	F0591-1125			Cc1[nH]c2ccc(F)cc2c1CCN(Cc1cccnc1)C(S)=Nc1cccc(F)c1	InChI=1S/C24H22F2N4S/c1-16-21(22-13-19(26)7-8-23(22)28-16)9-11-30(15-17-4-3-10-27-14-17)24(31)29-20-6-2-5-18(25)12-20/h2-8,10,12-14,28H,9,11,15H2,1H3,(H,29,31)	JSJDJVKIJBHDEV-UHFFFAOYSA-N	436.153323834							115447
AC1LEFRY	LSM-26905	BRD-K57315740, SID7969561	711507	InChI=1S/C15H17N5/c1-15(2,3)19-13-12-9-18-20(14(12)17-10-16-13)11-7-5-4-6-8-11/h4-10H,1-3H3,(H,16,17,19)	XZUAMWUIKKNSDI-UHFFFAOYSA-N	CC(C)(C)Nc1ncnc2c1cnn2c3ccccc3	BroadT	BRD-K57315740	BRD-K57315740-001-04-6	Life Chemicals Inc.	F0517-0021			CC(C)(C)Nc1ncnc2n(ncc12)-c1ccccc1	InChI=1S/C15H17N5/c1-15(2,3)19-13-12-9-18-20(14(12)17-10-16-13)11-7-5-4-6-8-11/h4-10H,1-3H3,(H,16,17,19)	XZUAMWUIKKNSDI-UHFFFAOYSA-N	267.148395594							115448
BAS 00921890	LSM-26906	BRD-K22915992	781474	InChI=1S/C18H20N4O2/c23-22(24)18-8-6-16(7-9-18)14-19-21-12-10-20(11-13-21)15-17-4-2-1-3-5-17/h1-9,14H,10-13,15H2	IFTHHVIKAXMTQT-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(C=NN2CCN(Cc3ccccc3)CC2)cc1	BroadT	BRD-K22915992	BRD-K22915992-001-05-7	Asinex Ltd.	BAS 00921890			[O-][N+](=O)c1ccc(C=NN2CCN(Cc3ccccc3)CC2)cc1	InChI=1S/C18H20N4O2/c23-22(24)18-8-6-16(7-9-18)14-19-21-12-10-20(11-13-21)15-17-4-2-1-3-5-17/h1-9,14H,10-13,15H2	IFTHHVIKAXMTQT-UHFFFAOYSA-N	324.15862592							115449
SMR000031407	LSM-26907	BRD-K67508052, SID4252336	3245901	InChI=1S/C18H17N3O3S/c1-12(22)21-15-9-5-3-7-13(15)20-18(21)25-11-17(23)19-14-8-4-6-10-16(14)24-2/h3-10H,11H2,1-2H3,(H,19,23)	PCDLACJXVSBKOT-UHFFFAOYSA-N	COc1ccccc1NC(=O)CSc2nc3ccccc3n2C(=O)C	BroadT	BRD-K67508052	BRD-K67508052-001-05-3	ChemDiv Inc.	K781-2297			COc1ccccc1NC(=O)CSc1nc2ccccc2n1C(C)=O	InChI=1S/C18H17N3O3S/c1-12(22)21-15-9-5-3-7-13(15)20-18(21)25-11-17(23)19-14-8-4-6-10-16(14)24-2/h3-10H,11H2,1-2H3,(H,19,23)	PCDLACJXVSBKOT-UHFFFAOYSA-N	355.099062124							115450
AC1M1OSK	LSM-26908	BRD-K37328981	2127686	InChI=1S/C19H13N3OS2/c23-19(22-20-11-13-7-9-24-12-13)15-10-17(18-6-3-8-25-18)21-16-5-2-1-4-14(15)16/h1-12H,(H,22,23)	CEYVFPCBJTWVIV-UHFFFAOYSA-N	O=C(NN=Cc1ccsc1)c2cc(nc3ccccc23)c4cccs4	BroadT	BRD-K37328981	BRD-K37328981-001-05-9	Enamine Ltd.	T5255164			O=C(NN=Cc1ccsc1)c1cc(nc2ccccc12)-c1cccs1	InChI=1S/C19H13N3OS2/c23-19(22-20-11-13-7-9-24-12-13)15-10-17(18-6-3-8-25-18)21-16-5-2-1-4-14(15)16/h1-12H,(H,22,23)	CEYVFPCBJTWVIV-UHFFFAOYSA-N	363.050003446							115451
SMR000204242	LSM-26909	BRD-A05828965, SID17510208	12005121	InChI=1S/C16H32NO3/c1-4-6-7-14(5-2)16-19-13-15(20-16)12-17(3)8-10-18-11-9-17/h14-16H,4-13H2,1-3H3/q+1	PFBYGNWQTPOBMO-UHFFFAOYSA-N	CCCCC(CC)C1OCC(C[N+]2(C)CCOCC2)O1	BroadT	BRD-A05828965	BRD-A05828965-001-05-8	ChemDiv Inc.	6228-0844			CCCCC(CC)C1OCC(C[N+]2(C)CCOCC2)O1	InChI=1S/C16H32NO3/c1-4-6-7-14(5-2)16-19-13-15(20-16)12-17(3)8-10-18-11-9-17/h14-16H,4-13H2,1-3H3/q+1	PFBYGNWQTPOBMO-UHFFFAOYSA-N	286.238218894							115452
423735-93-7	LSM-3308	SID17412682, BRD-K59036917, SID87219021, SID87457110	1048267	InChI=1S/C17H17BrN2O2/c1-2-6-16(21)19-12-7-5-8-13(11-12)20-17(22)14-9-3-4-10-15(14)18/h3-5,7-11H,2,6H2,1H3,(H,19,21)(H,20,22)	DFOVLSMXPWPCFH-UHFFFAOYSA-N	CCCC(=O)Nc1cccc(NC(=O)c2ccccc2Br)c1	BroadT	BRD-K59036917	BRD-K59036917-001-09-2	ChemBridge Corporation	5946339			CCCC(=O)Nc1cccc(NC(=O)c2ccccc2Br)c1	InChI=1S/C17H17BrN2O2/c1-2-6-16(21)19-12-7-5-8-13(11-12)20-17(22)14-9-3-4-10-15(14)18/h3-5,7-11H,2,6H2,1H3,(H,19,21)(H,20,22)	DFOVLSMXPWPCFH-UHFFFAOYSA-N	360.047340404							93032
SMR000114924	LSM-26910	BRD-K70052888, SID14719242	841625	InChI=1S/C14H19NOS/c1-16-13-8-6-12(7-9-13)14(17)15-10-4-2-3-5-11-15/h6-9H,2-5,10-11H2,1H3	QOKHKPQVXZPGFY-UHFFFAOYSA-N	COc1ccc(cc1)C(=S)N2CCCCCC2	BroadT	BRD-K70052888	BRD-K70052888-001-05-7	Specs	AK-968/40809314			COc1ccc(cc1)C(=S)N1CCCCCC1	InChI=1S/C14H19NOS/c1-16-13-8-6-12(7-9-13)14(17)15-10-4-2-3-5-11-15/h6-9H,2-5,10-11H2,1H3	QOKHKPQVXZPGFY-UHFFFAOYSA-N	249.118734928							115453
5-Benzyl-4-butyl-4H-[1,2,4]triazole-3-thiol	LSM-26911	BRD-K36884445, SID4265348	2208854	InChI=1S/C13H17N3S/c1-2-3-9-16-12(14-15-13(16)17)10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H,15,17)	OCDFGWHAKIHFQG-UHFFFAOYSA-N	CCCCn1c(S)nnc1Cc2ccccc2	BroadT	BRD-K36884445	BRD-K36884445-001-05-2	ChemBridge Corporation	7806736			CCCCn1c(S)nnc1Cc1ccccc1	InChI=1S/C13H17N3S/c1-2-3-9-16-12(14-15-13(16)17)10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H,15,17)	OCDFGWHAKIHFQG-UHFFFAOYSA-N	247.114318264							115454
AC1LHQ2X	LSM-26912	BRD-K20440082	867321	InChI=1S/C14H11N3OS/c18-14(17-16-9-11-4-2-8-19-11)12-5-1-3-10-6-7-15-13(10)12/h1-9,15H,(H,17,18)	CKCOVVRZIBGGEZ-UHFFFAOYSA-N	O=C(NN=Cc1cccs1)c2cccc3cc[nH]c23	BroadT	BRD-K20440082	BRD-K20440082-001-05-9	ChemBridge Corporation	5471833			O=C(NN=Cc1cccs1)c1cccc2cc[nH]c12	InChI=1S/C14H11N3OS/c18-14(17-16-9-11-4-2-8-19-11)12-5-1-3-10-6-7-15-13(10)12/h1-9,15H,(H,17,18)	CKCOVVRZIBGGEZ-UHFFFAOYSA-N	269.062282692							115455
ST50833454	LSM-26913	BRD-K16411174, SID4263517	1245652	InChI=1S/C14H15BrN2O3/c1-17(2)6-5-16-13(18)11-8-9-7-10(15)3-4-12(9)20-14(11)19/h3-4,7-8H,5-6H2,1-2H3,(H,16,18)	WNWMIKOZXLLSAK-UHFFFAOYSA-N	CN(C)CCNC(=O)C1=Cc2cc(Br)ccc2OC1=O	BroadT	BRD-K16411174	BRD-K16411174-001-05-5	ChemBridge Corporation	7945527			CN(C)CCNC(=O)c1cc2cc(Br)ccc2oc1=O	InChI=1S/C14H15BrN2O3/c1-17(2)6-5-16-13(18)11-8-9-7-10(15)3-4-12(9)20-14(11)19/h3-4,7-8H,5-6H2,1-2H3,(H,16,18)	WNWMIKOZXLLSAK-UHFFFAOYSA-N	338.02660496							115456
T5338767	LSM-26914	BRD-K65564503, SID26670099	4885343	InChI=1S/C16H16BrFN2O3/c1-22-11-4-6-14(15(8-11)23-2)19-9-16(21)20-13-5-3-10(17)7-12(13)18/h3-8,19H,9H2,1-2H3,(H,20,21)	QTWCCGFQGAIQCI-UHFFFAOYSA-N	COc1ccc(NCC(=O)Nc2ccc(Br)cc2F)c(OC)c1	BroadT	BRD-K65564503	BRD-K65564503-001-05-3	Enamine Ltd.	T5338767			COc1ccc(NCC(=O)Nc2ccc(Br)cc2F)c(OC)c1	InChI=1S/C16H16BrFN2O3/c1-22-11-4-6-14(15(8-11)23-2)19-9-16(21)20-13-5-3-10(17)7-12(13)18/h3-8,19H,9H2,1-2H3,(H,20,21)	QTWCCGFQGAIQCI-UHFFFAOYSA-N	382.032833192							115457
SMR000201521	LSM-26915	BRD-A84695402, SID17413156	2981167	InChI=1S/C24H20ClFN4O2S/c25-17-1-7-20(8-2-17)30-23(32)21(15-22(31)28-19-5-3-18(26)4-6-19)29(24(30)33)14-11-16-9-12-27-13-10-16/h1-10,12-13,21H,11,14-15H2,(H,28,31)	ZYOPHNLIMLMZHQ-UHFFFAOYSA-N	Fc1ccc(NC(=O)CC2N(CCc3ccncc3)C(=S)N(C2=O)c4ccc(Cl)cc4)cc1	BroadT	BRD-A84695402	BRD-A84695402-001-05-6	ChemBridge Corporation	7980537			Fc1ccc(NC(=O)CC2N(CCc3ccncc3)C(=S)N(C2=O)c2ccc(Cl)cc2)cc1	InChI=1S/C24H20ClFN4O2S/c25-17-1-7-20(8-2-17)30-23(32)21(15-22(31)28-19-5-3-18(26)4-6-19)29(24(30)33)14-11-16-9-12-27-13-10-16/h1-10,12-13,21H,11,14-15H2,(H,28,31)	ZYOPHNLIMLMZHQ-UHFFFAOYSA-N	482.09795252							115458
MLS000677965	LSM-26916	BRD-K14392619, SID24813343	3132706	InChI=1S/C18H18N6O3/c1-13-7-9-15(10-8-13)27-12-17(26)20-19-16(25)11-24-22-18(21-23-24)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,19,25)(H,20,26)	PQONJSRKTLAQLC-UHFFFAOYSA-N	Cc1ccc(OCC(=O)NNC(=O)Cn2nnc(n2)c3ccccc3)cc1	BroadT	BRD-K14392619	BRD-K14392619-001-05-2	Asinex Ltd.	BAS 01556142			Cc1ccc(OCC(=O)NNC(=O)Cn2nnc(n2)-c2ccccc2)cc1	InChI=1S/C18H18N6O3/c1-13-7-9-15(10-8-13)27-12-17(26)20-19-16(25)11-24-22-18(21-23-24)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,19,25)(H,20,26)	PQONJSRKTLAQLC-UHFFFAOYSA-N	366.144038496							115459
AC1MQJED	LSM-26917	SID24811076, BRD-K65888165	3477686	InChI=1S/C13H10N4O4/c14-12(10-6-3-4-8-15-10)16-21-13(18)9-5-1-2-7-11(9)17(19)20/h1-8H,(H2,14,16)	CAPDMQCHOWSAMU-UHFFFAOYSA-N	NC(=NOC(=O)c1ccccc1[N+](=O)[O-])c2ccccn2	BroadT	BRD-K65888165	BRD-K65888165-001-05-5	ChemDiv Inc.	4260-0629			NC(=NOC(=O)c1ccccc1[N+]([O-])=O)c1ccccn1	InChI=1S/C13H10N4O4/c14-12(10-6-3-4-8-15-10)16-21-13(18)9-5-1-2-7-11(9)17(19)20/h1-8H,(H2,14,16)	CAPDMQCHOWSAMU-UHFFFAOYSA-N	286.07020484							115460
CHEMBL1451030	LSM-26918	BRD-K38190084, SID26660931	915709	InChI=1S/C17H15N3O4/c1-24-16-8-3-2-7-15(16)19-10-9-14(18-17(19)21)12-5-4-6-13(11-12)20(22)23/h2-9,11H,10H2,1H3,(H,18,21)	JIAGZNMPGSZKSD-UHFFFAOYSA-N	COc1ccccc1N2CC=C(NC2=O)c3cccc(c3)[N+](=O)[O-]	BroadT	BRD-K38190084	BRD-K38190084-001-05-8	InterBioScreen Ltd.	STOCK1S-65555			COc1ccccc1N1CC=C(NC1=O)c1cccc(c1)[N+]([O-])=O	InChI=1S/C17H15N3O4/c1-24-16-8-3-2-7-15(16)19-10-9-14(18-17(19)21)12-5-4-6-13(11-12)20(22)23/h2-9,11H,10H2,1H3,(H,18,21)	JIAGZNMPGSZKSD-UHFFFAOYSA-N	325.10625599							115461
SMR000177183	LSM-26919	BRD-K71262871, SID17507290	1128694	InChI=1S/C25H19N3O5/c1-17-12-13-19(14-22(17)28(31)32)23(29)16-33-25(30)21-15-27(20-10-6-3-7-11-20)26-24(21)18-8-4-2-5-9-18/h2-15H,16H2,1H3	PIMNHOYSPVIZMY-UHFFFAOYSA-N	Cc1ccc(cc1[N+](=O)[O-])C(=O)COC(=O)c2cn(nc2c3ccccc3)c4ccccc4	BroadT	BRD-K71262871	BRD-K71262871-001-05-0	Asinex Ltd.	BAS 01859969			Cc1ccc(cc1[N+]([O-])=O)C(=O)COC(=O)c1cn(nc1-c1ccccc1)-c1ccccc1	InChI=1S/C25H19N3O5/c1-17-12-13-19(14-22(17)28(31)32)23(29)16-33-25(30)21-15-27(20-10-6-3-7-11-20)26-24(21)18-8-4-2-5-9-18/h2-15H,16H2,1H3	PIMNHOYSPVIZMY-UHFFFAOYSA-N	441.132470738							115462
MLS000550109	LSM-26920	BRD-A98203122, SID14719183	5840998	InChI=1S/C22H21N5/c1-14-8-7-11-18-20-12-15(2)24-27(20)22(23-21(14)18)19-13-26(25-16(19)3)17-9-5-4-6-10-17/h4-13,22-23H,1-3H3	HFJGFIKIJONBNH-UHFFFAOYSA-N	Cc1cc2c3cccc(C)c3NC(c4cn(nc4C)c5ccccc5)n2n1	BroadT	BRD-A98203122	BRD-A98203122-001-05-2	Specs	AO-081/41698935			Cc1cc2-c3cccc(C)c3NC(c3cn(nc3C)-c3ccccc3)n2n1	InChI=1S/C22H21N5/c1-14-8-7-11-18-20-12-15(2)24-27(20)22(23-21(14)18)19-13-26(25-16(19)3)17-9-5-4-6-10-17/h4-13,22-23H,1-3H3	HFJGFIKIJONBNH-UHFFFAOYSA-N	355.179695722							
MLS000102896	LSM-26921	BRD-K28036658, SID7970847	4053250	InChI=1S/C17H14N2O4/c1-22-11-6-4-5-10(9-11)17(21)19-14-12-7-2-3-8-13(12)23-15(14)16(18)20/h2-9H,1H3,(H2,18,20)(H,19,21)	ARLNYGOQDMCXLP-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Nc2c(oc3ccccc23)C(=O)N	BroadT	BRD-K28036658	BRD-K28036658-001-04-4	Life Chemicals Inc.	F0834-0836			COc1cccc(c1)C(=O)Nc1c(oc2ccccc12)C(N)=O	InChI=1S/C17H14N2O4/c1-22-11-6-4-5-10(9-11)17(21)19-14-12-7-2-3-8-13(12)23-15(14)16(18)20/h2-9H,1H3,(H2,18,20)(H,19,21)	ARLNYGOQDMCXLP-UHFFFAOYSA-N	310.095356948							115464
AO-989/42174898	LSM-15226	BRD-K28320832	849659	InChI=1S/C12H11N2OS/c15-9-13-6-5-12-14(7-8-16-12)11-4-2-1-3-10(11)13/h1-4,7-9H,5-6H2/q+1	VQYRZZSYTUTGOW-UHFFFAOYSA-N	O=CN1CCc2scc[n+]2c3ccccc13	BroadT	BRD-K28320832	BRD-K28320832-004-05-2	Specs	AO-989/42174898		Br	O=CN1CCc2scc[n+]2-c2ccccc12.Br	InChI=1S/C12H11N2OS.BrH/c15-9-13-6-5-12-14(7-8-16-12)11-4-2-1-3-10(11)13;/h1-4,7-9H,5-6H2;1H/q+1;	SNHPQTFDAXYUAL-UHFFFAOYSA-N	231.059208682							103873, 103873
MLS000121981	LSM-26922	BRD-A37645929, SID14721750	3211229	InChI=1S/C23H29N3O5S2/c1-2-31-20(28)15-26(19(27)14-24-22(29)18-11-7-13-33-18)21(17-10-6-12-32-17)23(30)25-16-8-4-3-5-9-16/h6-7,10-13,16,21H,2-5,8-9,14-15H2,1H3,(H,24,29)(H,25,30)	JQGGJWOZKVGIAX-UHFFFAOYSA-N	CCOC(=O)CN(C(C(=O)NC1CCCCC1)c2cccs2)C(=O)CNC(=O)c3cccs3	BroadT	BRD-A37645929	BRD-A37645929-001-05-3	Asinex Ltd.	ASN 05582304			CCOC(=O)CN(C(C(=O)NC1CCCCC1)c1cccs1)C(=O)CNC(=O)c1cccs1	InChI=1S/C23H29N3O5S2/c1-2-31-20(28)15-26(19(27)14-24-22(29)18-11-7-13-33-18)21(17-10-6-12-32-17)23(30)25-16-8-4-3-5-9-16/h6-7,10-13,16,21H,2-5,8-9,14-15H2,1H3,(H,24,29)(H,25,30)	JQGGJWOZKVGIAX-UHFFFAOYSA-N	491.154862438							115465
SMR000131609	LSM-26923	SID14733602, SID24416000, BRD-K03957217	9550532	InChI=1S/C29H42N4O3/c1-3-14-32-16-5-7-25-22-24(8-13-28(25)32)23-33(17-6-15-31-18-20-35-21-19-31)29(34)30-26-9-11-27(12-10-26)36-4-2/h8-13,22H,3-7,14-21,23H2,1-2H3,(H,30,34)	WXVKUPMEDPTHBL-UHFFFAOYSA-N	CCCN1CCCc2cc(CN(CCCN3CCOCC3)C(=O)Nc4ccc(OCC)cc4)ccc12	BroadT	BRD-K03957217	BRD-K03957217-001-05-1	ChemDiv Inc.	K788-5172			CCCN1CCCc2cc(CN(CCCN3CCOCC3)C(=O)Nc3ccc(OCC)cc3)ccc12	InChI=1S/C29H42N4O3/c1-3-14-32-16-5-7-25-22-24(8-13-28(25)32)23-33(17-6-15-31-18-20-35-21-19-31)29(34)30-26-9-11-27(12-10-26)36-4-2/h8-13,22H,3-7,14-21,23H2,1-2H3,(H,30,34)	WXVKUPMEDPTHBL-UHFFFAOYSA-N	494.325691244							115466
N-(1-Ethyl-1H-benzoimidazol-5-yl)-4-methyl-benzenesulfonamide	LSM-26924	BRD-K71615409, SID14722586	777772	InChI=1S/C16H17N3O2S/c1-3-19-11-17-15-10-13(6-9-16(15)19)18-22(20,21)14-7-4-12(2)5-8-14/h4-11,18H,3H2,1-2H3	BWRLFAVXHFYLJO-UHFFFAOYSA-N	CCn1cnc2cc(NS(=O)(=O)c3ccc(C)cc3)ccc12	BroadT	BRD-K71615409	BRD-K71615409-001-06-8	Asinex Ltd.	BAS 05022439			CCn1cnc2cc(NS(=O)(=O)c3ccc(C)cc3)ccc12	InChI=1S/C16H17N3O2S/c1-3-19-11-17-15-10-13(6-9-16(15)19)18-22(20,21)14-7-4-12(2)5-8-14/h4-11,18H,3H2,1-2H3	BWRLFAVXHFYLJO-UHFFFAOYSA-N	315.104147504							115467
SMR000154859	LSM-26925	BRD-K18726958, SID14743794	2531448	InChI=1S/C17H18N6O2/c1-12-6-7-18-17-20-15(21-23(12)17)16(24)19-13-2-4-14(5-3-13)22-8-10-25-11-9-22/h2-7H,8-11H2,1H3,(H,19,24)	OFQLWGKWGGQSTA-UHFFFAOYSA-N	Cc1ccnc2nc(nn12)C(=O)Nc3ccc(cc3)N4CCOCC4	BroadT	BRD-K18726958	BRD-K18726958-001-05-6	Enamine Ltd.	T5278932			Cc1ccnc2nc(nn12)C(=O)Nc1ccc(cc1)N1CCOCC1	InChI=1S/C17H18N6O2/c1-12-6-7-18-17-20-15(21-23(12)17)16(24)19-13-2-4-14(5-3-13)22-8-10-25-11-9-22/h2-7H,8-11H2,1H3,(H,19,24)	OFQLWGKWGGQSTA-UHFFFAOYSA-N	338.149123876							115468
KUC100011	LSM-26926	SID124350923, SID14728543, BRD-K73275682	5706431	InChI=1S/C22H17NO2/c1-15-11-12-19(18-10-6-5-9-17(15)18)20-13-14-21(25-20)22(24)23-16-7-3-2-4-8-16/h2-14H,1H3,(H,23,24)	VQEYKAXFBYWKJC-UHFFFAOYSA-N	Cc1ccc(c2oc(cc2)C(=O)Nc3ccccc3)c4ccccc14	BroadT	BRD-K73275682	BRD-K73275682-001-05-9	University of Kansas CMLD	KUC100011			Cc1ccc(-c2ccc(o2)C(=O)Nc2ccccc2)c2ccccc12	InChI=1S/C22H17NO2/c1-15-11-12-19(18-10-6-5-9-17(15)18)20-13-14-21(25-20)22(24)23-16-7-3-2-4-8-16/h2-14H,1H3,(H,23,24)	VQEYKAXFBYWKJC-UHFFFAOYSA-N	327.125928794							115469
MLS000594926	LSM-26927	BRD-K89141455, SID22401330	1580316	InChI=1S/C18H17N5OS4/c24-15(20-21-16(25)19-14-9-5-2-6-10-14)12-27-18-23-22-17(28-18)26-11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H,20,24)(H2,19,21,25)	GABPKGOYNYEOQW-UHFFFAOYSA-N	O=C(CSc1nnc(SCc2ccccc2)s1)NNC(=S)Nc3ccccc3	BroadT	BRD-K89141455	BRD-K89141455-001-05-0	InterBioScreen Ltd.	STOCK3S-02670			O=C(CSc1nnc(SCc2ccccc2)s1)NNC(=S)Nc1ccccc1	InChI=1S/C18H17N5OS4/c24-15(20-21-16(25)19-14-9-5-2-6-10-14)12-27-18-23-22-17(28-18)26-11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H,20,24)(H2,19,21,25)	GABPKGOYNYEOQW-UHFFFAOYSA-N	447.031592974							115470
SMR000007349	LSM-26928	SID26667457, SID843686, BRD-A17902629	645989	InChI=1S/C25H27N3O4/c1-4-22-25(30)28(21-12-17(2)7-10-23(21)32-22)16-24(29)27(14-19-6-5-11-26-13-19)15-20-9-8-18(3)31-20/h5-13,22H,4,14-16H2,1-3H3	WWYFUGXRLQKAHQ-UHFFFAOYSA-N	CCC1Oc2ccc(C)cc2N(CC(=O)N(Cc3oc(C)cc3)Cc4cccnc4)C1=O	BroadT	BRD-A17902629	BRD-A17902629-001-06-3	Asinex Ltd.	ASN 06914179			CCC1Oc2ccc(C)cc2N(CC(=O)N(Cc2ccc(C)o2)Cc2cccnc2)C1=O	InChI=1S/C25H27N3O4/c1-4-22-25(30)28(21-12-17(2)7-10-23(21)32-22)16-24(29)27(14-19-6-5-11-26-13-19)15-20-9-8-18(3)31-20/h5-13,22H,4,14-16H2,1-3H3	WWYFUGXRLQKAHQ-UHFFFAOYSA-N	433.200156374							115471
(1-Methylnaphtho[2,1-b]furan-2-yl)(phenyl)methanone	LSM-26929	BRD-K99198579, SID26727229	2728502	InChI=1S/C20H14O2/c1-13-18-16-10-6-5-7-14(16)11-12-17(18)22-20(13)19(21)15-8-3-2-4-9-15/h2-12H,1H3	ZKNZFFSZGIOMNJ-UHFFFAOYSA-N	Cc1c(oc2ccc3ccccc3c12)C(=O)c4ccccc4	BroadT	BRD-K99198579	BRD-K99198579-001-05-9	Maybridge	RH 02204			Cc1c(oc2ccc3ccccc3c12)C(=O)c1ccccc1	InChI=1S/C20H14O2/c1-13-18-16-10-6-5-7-14(16)11-12-17(18)22-20(13)19(21)15-8-3-2-4-9-15/h2-12H,1H3	ZKNZFFSZGIOMNJ-UHFFFAOYSA-N	286.099379688							115472
ST50846353	LSM-44189	BRD-K76543697, SID24827461	2362469	InChI=1S/C11H7N3OS2/c12-7-8(6-9-2-1-4-16-9)10(15)14-11-13-3-5-17-11/h1-6H,(H,13,14,15)/b8-6+	WGUFNWHDWQOIHD-SOFGYWHQSA-N	O=C(Nc1nccs1)\C(=C\c2cccs2)\C#N	BroadT	BRD-K76543697	BRD-K76543697-001-05-0	Enamine Ltd.	T0512-6731			O=C(Nc1nccs1)C(=C\c1cccs1)\C#N	InChI=1S/C11H7N3OS2/c12-7-8(6-9-2-1-4-16-9)10(15)14-11-13-3-5-17-11/h1-6H,(H,13,14,15)/b8-6+	WGUFNWHDWQOIHD-SOFGYWHQSA-N	261.003053254							
AC1NHB3H	LSM-26931	BRD-K27554804, SID22401504	4737320	InChI=1S/C15H11N3O2S/c19-18(20)13-8-6-11(7-9-13)14-10-17(15(21)16-14)12-4-2-1-3-5-12/h1-10H,(H,16,21)	ZCEPBEJOXQFEHJ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)c2cn(c(S)n2)c3ccccc3	BroadT	BRD-K27554804	BRD-K27554804-001-05-7	ChemDiv Inc.	K241-0161			[O-][N+](=O)c1ccc(cc1)-c1cn(c(S)n1)-c1ccccc1	InChI=1S/C15H11N3O2S/c19-18(20)13-8-6-11(7-9-13)14-10-17(15(21)16-14)12-4-2-1-3-5-12/h1-10H,(H,16,21)	ZCEPBEJOXQFEHJ-UHFFFAOYSA-N	297.057197312							115474
ASN 03578392	LSM-26932	BRD-K00509345, SID26667815, SID852772	655412	InChI=1S/C20H27N5O4S2/c1-24-19(22-23-20(24)30-14-18(26)21-16-4-2-3-5-16)15-6-8-17(9-7-15)31(27,28)25-10-12-29-13-11-25/h6-9,16H,2-5,10-14H2,1H3,(H,21,26)	DKPHXMYJBPCQRE-UHFFFAOYSA-N	Cn1c(SCC(=O)NC2CCCC2)nnc1c3ccc(cc3)S(=O)(=O)N4CCOCC4	BroadT	BRD-K00509345	BRD-K00509345-001-05-8	Asinex Ltd.	ASN 03578392			Cn1c(SCC(=O)NC2CCCC2)nnc1-c1ccc(cc1)S(=O)(=O)N1CCOCC1	InChI=1S/C20H27N5O4S2/c1-24-19(22-23-20(24)30-14-18(26)21-16-4-2-3-5-16)15-6-8-17(9-7-15)31(27,28)25-10-12-29-13-11-25/h6-9,16H,2-5,10-14H2,1H3,(H,21,26)	DKPHXMYJBPCQRE-UHFFFAOYSA-N	465.150445774							115475
MLS000556665	LSM-26933	BRD-K06500446, SID17410509	1442634	InChI=1S/C20H22N4OS2/c1-2-7-17-21-14-9-4-3-8-13(14)19(23-17)26-12-18(25)24-20-22-15-10-5-6-11-16(15)27-20/h3-4,8-9H,2,5-7,10-12H2,1H3,(H,22,24,25)	WKKOBEPTXJLDBD-UHFFFAOYSA-N	CCCc1nc(SCC(=O)Nc2nc3CCCCc3s2)c4ccccc4n1	BroadT	BRD-K06500446	BRD-K06500446-001-05-9	Asinex Ltd.	ASN 06532806			CCCc1nc(SCC(=O)Nc2nc3CCCCc3s2)c2ccccc2n1	InChI=1S/C20H22N4OS2/c1-2-7-17-21-14-9-4-3-8-13(14)19(23-17)26-12-18(25)24-20-22-15-10-5-6-11-16(15)27-20/h3-4,8-9H,2,5-7,10-12H2,1H3,(H,22,24,25)	WKKOBEPTXJLDBD-UHFFFAOYSA-N	398.123502744							115476
T0505-3141	LSM-26934	BRD-A27422067, SID24828919	4567653	InChI=1S/C15H18N2OS2/c1-11(10-14-4-3-9-20-14)16-15(19)17-12-5-7-13(18-2)8-6-12/h3-9,11H,10H2,1-2H3,(H2,16,17,19)	CLOLPUXUKBYDTC-UHFFFAOYSA-N	COc1ccc(NC(=NC(C)Cc2cccs2)S)cc1	BroadT	BRD-A27422067	BRD-A27422067-001-05-1	Enamine Ltd.	T0505-3141			COc1ccc(NC(S)=NC(C)Cc2cccs2)cc1	InChI=1S/C15H18N2OS2/c1-11(10-14-4-3-9-20-14)16-15(19)17-12-5-7-13(18-2)8-6-12/h3-9,11H,10H2,1-2H3,(H2,16,17,19)	CLOLPUXUKBYDTC-UHFFFAOYSA-N	306.086054596							115477
SMR000097543	LSM-26935	SID7968746, SID56373625, BRD-K12826618	5309580	InChI=1S/C17H15NO3/c19-16-14-9-5-4-8-13(14)11-18(16)15(17(20)21)10-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,20,21)/t15-/m0/s1	FZEBPJBRDFXKIH-HNNXBMFYSA-N	OC(=O)[C@H](Cc1ccccc1)N2Cc3ccccc3C2=O	BroadT	BRD-K12826618	BRD-K12826618-001-05-2	ChemDiv Inc.	C430-0017			OC(=O)[C@H](Cc1ccccc1)N1Cc2ccccc2C1=O	InChI=1S/C17H15NO3/c19-16-14-9-5-4-8-13(14)11-18(16)15(17(20)21)10-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,20,21)/t15-/m0/s1	FZEBPJBRDFXKIH-HNNXBMFYSA-N	281.10519335							115478
N-{[2-Methoxy-4-(trifluoromethyl)-3-pyridinyl]carbonyl}-n'-phenylurea	LSM-26936	BRD-K14812927, SID26730775	2727113	InChI=1S/C15H12F3N3O3/c1-24-13-11(10(7-8-19-13)15(16,17)18)12(22)21-14(23)20-9-5-3-2-4-6-9/h2-8H,1H3,(H2,20,21,22,23)	BQDKVXFAQJWIKE-UHFFFAOYSA-N	COc1nccc(c1C(=O)NC(=O)Nc2ccccc2)C(F)(F)F	BroadT	BRD-K14812927	BRD-K14812927-001-06-4	Maybridge	RF 04650			COc1nccc(c1C(=O)NC(=O)Nc1ccccc1)C(F)(F)F	InChI=1S/C15H12F3N3O3/c1-24-13-11(10(7-8-19-13)15(16,17)18)12(22)21-14(23)20-9-5-3-2-4-6-9/h2-8H,1H3,(H2,20,21,22,23)	BQDKVXFAQJWIKE-UHFFFAOYSA-N	339.083075874							115479
Dibenzo-18-crown-6	LSM-15178	BRD-K14875480	26541	InChI=1S/C20H24O6/c1-2-6-18-17(5-1)23-13-9-21-11-15-25-19-7-3-4-8-20(19)26-16-12-22-10-14-24-18/h1-8H,9-16H2	YSSSPARMOAYJTE-UHFFFAOYSA-N	C1COc2ccccc2OCCOCCOc3ccccc3OCCO1	BroadT	BRD-K14875480	BRD-K14875480-352-06-7	Specs	AE-641/00796004		[K].CC(=O)O	C1COc2ccccc2OCCOCCOc2ccccc2OCCO1.[K].CC(=O)O	InChI=1S/C20H24O6.C2H4O2.K.H/c1-2-6-18-17(5-1)23-13-9-21-11-15-25-19-7-3-4-8-20(19)26-16-12-22-10-14-24-18;1-2(3)4;;/h1-8H,9-16H2;1H3,(H,3,4);;	SMNXCBFMASXCCO-UHFFFAOYSA-N	360.157288488							358732, 358732
SMR000178540	LSM-26937	BRD-K02979518, SID17413769	1090028	InChI=1S/C21H13ClN2O3S/c22-14-7-5-13(21-24-15-3-1-2-4-19(15)28-21)9-16(14)23-20(25)12-6-8-17-18(10-12)27-11-26-17/h1-10H,11H2,(H,23,25)	QGYZAWCNJCDUSE-UHFFFAOYSA-N	Clc1ccc(cc1NC(=O)c2ccc3OCOc3c2)c4nc5ccccc5s4	BroadT	BRD-K02979518	BRD-K02979518-001-05-2	Asinex Ltd.	BAS 07437519			Clc1ccc(cc1NC(=O)c1ccc2OCOc2c1)-c1nc2ccccc2s1	InChI=1S/C21H13ClN2O3S/c22-14-7-5-13(21-24-15-3-1-2-4-19(15)28-21)9-16(14)23-20(25)12-6-8-17-18(10-12)27-11-26-17/h1-10H,11H2,(H,23,25)	QGYZAWCNJCDUSE-UHFFFAOYSA-N	408.033540696							115480
F0594-0394	LSM-26938	BRD-K06020071, SID7965587	855628	InChI=1S/C15H16ClN3O2S/c16-12-7-3-2-6-11(12)14-17-18-15(21-14)22-10-13(20)19-8-4-1-5-9-19/h2-3,6-7H,1,4-5,8-10H2	GBPZFEGFFOATMH-UHFFFAOYSA-N	Clc1ccccc1c2oc(SCC(=O)N3CCCCC3)nn2	BroadT	BRD-K06020071	BRD-K06020071-001-04-3	ChemDiv Inc.	C292-0255			Clc1ccccc1-c1nnc(SCC(=O)N2CCCCC2)o1	InChI=1S/C15H16ClN3O2S/c16-12-7-3-2-6-11(12)14-17-18-15(21-14)22-10-13(20)19-8-4-1-5-9-19/h2-3,6-7H,1,4-5,8-10H2	GBPZFEGFFOATMH-UHFFFAOYSA-N	337.065175182							115481
MLS000731403	LSM-44190	BRD-K04725393, SID24813681	16194116	InChI=1S/C17H12N4O2S2/c18-15-13(16(22)20-17-21(15)19-10-25-17)8-12-6-7-14(23-12)24-9-11-4-2-1-3-5-11/h1-8,10,18H,9H2/b13-8+,18-15?	AUDQXZNQLJRRGD-KQCXNUNXSA-N	N=C1N2N=CSC2=NC(=O)/C/1=C/c3oc(SCc4ccccc4)cc3	BroadT	BRD-K04725393	BRD-K04725393-001-07-3	ChemDiv Inc.	C639-0317			N=C1N2N=CSC2=NC(=O)\C1=C\c1ccc(SCc2ccccc2)o1	InChI=1S/C17H12N4O2S2/c18-15-13(16(22)20-17-21(15)19-10-25-17)8-12-6-7-14(23-12)24-9-11-4-2-1-3-5-11/h1-8,10,18H,9H2/b13-8+,18-15?	AUDQXZNQLJRRGD-KQCXNUNXSA-N	368.040167044							
MLS003170993	LSM-26940	BRD-K56224420, SID121283287	335122	InChI=1S/C18H15NO3/c1-11(19-12-7-9-13(22-2)10-8-12)16-17(20)14-5-3-4-6-15(14)18(16)21/h3-10,16H,1-2H3	VYZZPCGEFWRJMT-UHFFFAOYSA-N	COc1ccc(cc1)N=C(C)C2C(=O)c3ccccc3C2=O	BroadT	BRD-K56224420	BRD-K56224420-001-06-3	ChemBridge Corporation	6216267			COc1ccc(cc1)N=C(C)C1C(=O)c2ccccc2C1=O	InChI=1S/C18H15NO3/c1-11(19-12-7-9-13(22-2)10-8-12)16-17(20)14-5-3-4-6-15(14)18(16)21/h3-10,16H,1-2H3	VYZZPCGEFWRJMT-UHFFFAOYSA-N	293.10519335							115483
MLS000532470	LSM-26941	BRD-A69383366, SID14731379	2843367	InChI=1S/C15H21N3O2S/c1-15(2,3)11-4-6-13(7-5-11)20-8-12(19)9-21-14-16-10-17-18-14/h4-7,10,12,19H,8-9H2,1-3H3,(H,16,17,18)	GELABSIHEHAUTB-UHFFFAOYSA-N	CC(C)(C)c1ccc(OCC(O)CSc2nc[nH]n2)cc1	BroadT	BRD-A69383366	BRD-A69383366-001-05-2	ChemBridge Corporation	5356999			CC(C)(C)c1ccc(OCC(O)CSc2nc[nH]n2)cc1	InChI=1S/C15H21N3O2S/c1-15(2,3)11-4-6-13(7-5-11)20-8-12(19)9-21-14-16-10-17-18-14/h4-7,10,12,19H,8-9H2,1-3H3,(H,16,17,18)	GELABSIHEHAUTB-UHFFFAOYSA-N	307.135447632							115484
Methyl 2-[4-(4-chlorobenzoyl)-3,4-dihydro-2H-1,4-benzoxazin-3-yl]acetate	LSM-26942	BRD-A68427178, SID17402735	3645398	InChI=1S/C18H16ClNO4/c1-23-17(21)10-14-11-24-16-5-3-2-4-15(16)20(14)18(22)12-6-8-13(19)9-7-12/h2-9,14H,10-11H2,1H3	ADGPQFOXXMCWCA-UHFFFAOYSA-N	COC(=O)CC1COc2ccccc2N1C(=O)c3ccc(Cl)cc3	BroadT	BRD-A68427178	BRD-A68427178-001-05-6	Key Organics Ltd.	2T-0265			COC(=O)CC1COc2ccccc2N1C(=O)c1ccc(Cl)cc1	InChI=1S/C18H16ClNO4/c1-23-17(21)10-14-11-24-16-5-3-2-4-15(16)20(14)18(22)12-6-8-13(19)9-7-12/h2-9,14H,10-11H2,1H3	ADGPQFOXXMCWCA-UHFFFAOYSA-N	345.076785712							115485
2-Benzyl-n-(4-methoxybenzyl)-1,3-thiazole-4-carboxamide	LSM-26943	BRD-K94258680, SID17410106	3428654	InChI=1S/C19H18N2O2S/c1-23-16-9-7-15(8-10-16)12-20-19(22)17-13-24-18(21-17)11-14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3,(H,20,22)	NJKXKQBBRSNLTF-UHFFFAOYSA-N	COc1ccc(CNC(=O)c2csc(Cc3ccccc3)n2)cc1	BroadT	BRD-K94258680	BRD-K94258680-001-05-2	Key Organics Ltd.	3R-1544			COc1ccc(CNC(=O)c2csc(Cc3ccccc3)n2)cc1	InChI=1S/C19H18N2O2S/c1-23-16-9-7-15(8-10-16)12-20-19(22)17-13-24-18(21-17)11-14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3,(H,20,22)	NJKXKQBBRSNLTF-UHFFFAOYSA-N	338.108898526							115486
MLS000565755	LSM-26944	BRD-A44046220, SID14745859	5214311	InChI=1S/C12H11FN2O2S/c13-7-3-4-8-10(6-7)18-12(14-8)15-11(16)9-2-1-5-17-9/h3-4,6,9H,1-2,5H2,(H,14,15,16)	BPIDEEBLGGVDOY-UHFFFAOYSA-N	Fc1ccc2nc(NC(=O)C3CCCO3)sc2c1	BroadT	BRD-A44046220	BRD-A44046220-001-05-1	Enamine Ltd.	T5278466			Fc1ccc2nc(NC(=O)C3CCCO3)sc2c1	InChI=1S/C12H11FN2O2S/c13-7-3-4-8-10(6-7)18-12(14-8)15-11(16)9-2-1-5-17-9/h3-4,6,9H,1-2,5H2,(H,14,15,16)	BPIDEEBLGGVDOY-UHFFFAOYSA-N	266.052526502							115487
SMR000221562	LSM-26945	BRD-K19501975, SID17505233	1998473	InChI=1S/C18H23N3S/c1-21(2)12-7-13-22-18-15-10-6-11-16(15)19-17(20-18)14-8-4-3-5-9-14/h3-5,8-9H,6-7,10-13H2,1-2H3	AZYBPQSWPOOMFP-UHFFFAOYSA-N	CN(C)CCCSc1nc(nc2CCCc12)c3ccccc3	BroadT	BRD-K19501975	BRD-K19501975-001-07-7	InterBioScreen Ltd.	STOCK4S-33016			CN(C)CCCSc1nc(nc2CCCc12)-c1ccccc1	InChI=1S/C18H23N3S/c1-21(2)12-7-13-22-18-15-10-6-11-16(15)19-17(20-18)14-8-4-3-5-9-14/h3-5,8-9H,6-7,10-13H2,1-2H3	AZYBPQSWPOOMFP-UHFFFAOYSA-N	313.161268456							115488
ST50940894	LSM-26946	SID4264267, BRD-K25917968	1245751	InChI=1S/C13H13NO2S/c1-9-7-8-11(16-9)13(15)14-10-5-3-4-6-12(10)17-2/h3-8H,1-2H3,(H,14,15)	UPLBRSHRZGEKMR-UHFFFAOYSA-N	CSc1ccccc1NC(=O)c2oc(C)cc2	BroadT	BRD-K25917968	BRD-K25917968-001-05-0	ChemBridge Corporation	7945743			CSc1ccccc1NC(=O)c1ccc(C)o1	InChI=1S/C13H13NO2S/c1-9-7-8-11(16-9)13(15)14-10-5-3-4-6-12(10)17-2/h3-8H,1-2H3,(H,14,15)	UPLBRSHRZGEKMR-UHFFFAOYSA-N	247.066699356							115489
AC1O99HI	LSM-26947	BRD-K15442833, TCMDC-125733	6751941	InChI=1S/C18H16N2O4S/c1-11-6-5-7-12(2)16(11)23-15(22)10-25-18-20-19-17(24-18)13-8-3-4-9-14(13)21/h3-9,21H,10H2,1-2H3	MFSXUZSBFVWAKZ-UHFFFAOYSA-N	Cc1cccc(C)c1OC(=O)CSc2oc(nn2)c3ccccc3O	BroadT	BRD-K15442833	BRD-K15442833-001-05-4	Asinex Ltd.	BAS 01094803			Cc1cccc(C)c1OC(=O)CSc1nnc(o1)-c1ccccc1O	InChI=1S/C18H16N2O4S/c1-11-6-5-7-12(2)16(11)23-15(22)10-25-18-20-19-17(24-18)13-8-3-4-9-14(13)21/h3-9,21H,10H2,1-2H3	MFSXUZSBFVWAKZ-UHFFFAOYSA-N	356.083077702							
SMR000000521	LSM-26948	BRD-K04819729, SID843410	645698	InChI=1S/C23H25N3O2/c1-16-12-20-21(13-17(16)2)26(15-23(28)25-10-6-7-11-25)22(27)14-19(24-20)18-8-4-3-5-9-18/h3-5,8-9,12-13H,6-7,10-11,14-15H2,1-2H3	ARZQAIDEAJTKDX-UHFFFAOYSA-N	Cc1cc2N=C(CC(=O)N(CC(=O)N3CCCC3)c2cc1C)c4ccccc4	BroadT	BRD-K04819729	BRD-K04819729-001-05-3	Asinex Ltd.	ASN 08973725			Cc1cc2N=C(CC(=O)N(CC(=O)N3CCCC3)c2cc1C)c1ccccc1	InChI=1S/C23H25N3O2/c1-16-12-20-21(13-17(16)2)26(15-23(28)25-10-6-7-11-25)22(27)14-19(24-20)18-8-4-3-5-9-18/h3-5,8-9,12-13H,6-7,10-11,14-15H2,1-2H3	ARZQAIDEAJTKDX-UHFFFAOYSA-N	375.19467707							115491
ZINC00443784	LSM-26949	BRD-K63970901	6745451	InChI=1S/C17H18N2O3S/c1-22-15-8-6-13(7-9-15)11-23-12-17(21)19-18-10-14-4-2-3-5-16(14)20/h2-10,20H,11-12H2,1H3,(H,19,21)	GUZWKTOEQLXTFI-UHFFFAOYSA-N	COc1ccc(CSCC(=O)NN=Cc2ccccc2O)cc1	BroadT	BRD-K63970901	BRD-K63970901-001-05-2	ChemBridge Corporation	6179133			COc1ccc(CSCC(=O)NN=Cc2ccccc2O)cc1	InChI=1S/C17H18N2O3S/c1-22-15-8-6-13(7-9-15)11-23-12-17(21)19-18-10-14-4-2-3-5-16(14)20/h2-10,20H,11-12H2,1H3,(H,19,21)	GUZWKTOEQLXTFI-UHFFFAOYSA-N	330.103813146							
BRD-K15939043	LSM-26950	BRD-K15939043		InChI=1S/C14H16N2O2/c1-14(2)6-12(17)11(13(18)7-14)9-16-10-4-3-5-15-8-10/h3-5,8-9,11H,6-7H2,1-2H3	VNMDASQUVHLDRG-UHFFFAOYSA-N	CC1(C)CC(=O)C(C=Nc2cccnc2)C(=O)C1	BroadT	BRD-K15939043	BRD-K15939043-001-06-3	ChemBridge Corporation	5666611			CC1(C)CC(=O)C(C=Nc2cccnc2)C(=O)C1	InChI=1S/C14H16N2O2/c1-14(2)6-12(17)11(13(18)7-14)9-16-10-4-3-5-15-8-10/h3-5,8-9,11H,6-7H2,1-2H3	VNMDASQUVHLDRG-UHFFFAOYSA-N	244.121177772							115493
SMR000102739	LSM-26951	SID7974966, BRD-K76353834	787920	InChI=1S/C16H18O4S2/c1-5-16(2,12-8-6-10(21-12)14(17)19-3)13-9-7-11(22-13)15(18)20-4/h6-9H,5H2,1-4H3	DXEOUNBMNBYGPG-UHFFFAOYSA-N	CCC(C)(c1ccc(s1)C(=O)OC)c2ccc(s2)C(=O)OC	BroadT	BRD-K76353834	BRD-K76353834-001-05-8	ChemBridge Corporation	5190741			CCC(C)(c1ccc(s1)C(=O)OC)c1ccc(s1)C(=O)OC	InChI=1S/C16H18O4S2/c1-5-16(2,12-8-6-10(21-12)14(17)19-3)13-9-7-11(22-13)15(18)20-4/h6-9H,5H2,1-4H3	DXEOUNBMNBYGPG-UHFFFAOYSA-N	338.064650436							115494
N-(Phenethylcarbamothioyl)benzamide	LSM-26952	BRD-K12884811, N-(Phenethylcarbamothioyl)Benzamide	692092	InChI=1S/C16H16N2OS/c19-15(14-9-5-2-6-10-14)18-16(20)17-12-11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H2,17,18,19,20)	WTHFYGYKFAIQEO-UHFFFAOYSA-N	O=C(NC(=S)NCCc1ccccc1)c2ccccc2	BroadT	BRD-K12884811	BRD-K12884811-001-05-6	ChemBridge Corporation	5366213			O=C(NC(=S)NCCc1ccccc1)c1ccccc1	InChI=1S/C16H16N2OS/c19-15(14-9-5-2-6-10-14)18-16(20)17-12-11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H2,17,18,19,20)	WTHFYGYKFAIQEO-UHFFFAOYSA-N	284.098333842							115495
Propyl 4-(5-formyl-2-furyl)benzoate	LSM-26953	BRD-K51643438, SID22416684	1714230	InChI=1S/C15H14O4/c1-2-9-18-15(17)12-5-3-11(4-6-12)14-8-7-13(10-16)19-14/h3-8,10H,2,9H2,1H3	IUSZPBINXWIYTP-UHFFFAOYSA-N	CCCOC(=O)c1ccc(cc1)c2oc(C=O)cc2	BroadT	BRD-K51643438	BRD-K51643438-001-06-9	ChemBridge Corporation	6254381			CCCOC(=O)c1ccc(cc1)-c1ccc(C=O)o1	InChI=1S/C15H14O4/c1-2-9-18-15(17)12-5-3-11(4-6-12)14-8-7-13(10-16)19-14/h3-8,10H,2,9H2,1H3	IUSZPBINXWIYTP-UHFFFAOYSA-N	258.089208928							115496
MLS000402293	LSM-26954	BRD-K47903820, SID22411285	2920050	InChI=1S/C19H20N4O4S/c1-2-22(28(26,27)15-7-4-3-5-8-15)14-13-20-17-10-11-18(23(24)25)16-9-6-12-21-19(16)17/h3-12,20H,2,13-14H2,1H3	WAGUZILONSGUTI-UHFFFAOYSA-N	CCN(CCNc1ccc(c2cccnc12)[N+](=O)[O-])S(=O)(=O)c3ccccc3	BroadT	BRD-K47903820	BRD-K47903820-001-05-2	Enamine Ltd.	T0515-6973			CCN(CCNc1ccc([N+]([O-])=O)c2cccnc12)S(=O)(=O)c1ccccc1	InChI=1S/C19H20N4O4S/c1-2-22(28(26,27)15-7-4-3-5-8-15)14-13-20-17-10-11-18(23(24)25)16-9-6-12-21-19(16)17/h3-12,20H,2,13-14H2,1H3	WAGUZILONSGUTI-UHFFFAOYSA-N	400.12052585							115497
CHEMBL1450329	LSM-26955	BRD-K55972185, SID14736132	886929	InChI=1S/C15H14N2/c1-12-5-4-6-13(9-12)10-17-11-16-14-7-2-3-8-15(14)17/h2-9,11H,10H2,1H3	CLVZYYZRLSFTTE-UHFFFAOYSA-N	Cc1cccc(Cn2cnc3ccccc23)c1	BroadT	BRD-K55972185	BRD-K55972185-001-05-5	ChemBridge Corporation	7153244			Cc1cccc(Cn2cnc3ccccc23)c1	InChI=1S/C15H14N2/c1-12-5-4-6-13(9-12)10-17-11-16-14-7-2-3-8-15(14)17/h2-9,11H,10H2,1H3	CLVZYYZRLSFTTE-UHFFFAOYSA-N	222.115698468							115498
SMR000067160	LSM-26956	BRD-K40560569, SID3715991	2079383	InChI=1S/C19H23N3O2S/c1-13-11-15(14(2)21(13)3)18(23)12-25-10-6-9-22-17-8-5-4-7-16(17)20-19(22)24/h4-5,7-8,11H,6,9-10,12H2,1-3H3,(H,20,24)	YDQQNESQPSLCCD-UHFFFAOYSA-N	Cc1cc(C(=O)CSCCCn2c(O)nc3ccccc23)c(C)n1C	BroadT	BRD-K40560569	BRD-K40560569-001-05-2	Enamine Ltd.	T5256621			Cc1cc(C(=O)CSCCCn2c(O)nc3ccccc23)c(C)n1C	InChI=1S/C19H23N3O2S/c1-13-11-15(14(2)21(13)3)18(23)12-25-10-6-9-22-17-8-5-4-7-16(17)20-19(22)24/h4-5,7-8,11H,6,9-10,12H2,1-3H3,(H,20,24)	YDQQNESQPSLCCD-UHFFFAOYSA-N	357.151097696							115499
3228-71-5	LSM-4491	Vidarabine, SID113825, SID124879308, SID124879309	191	InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)	OIRDTQYFTABQOQ-UHFFFAOYSA-N	Nc1ncnc2c1ncn2C3OC(CO)C(O)C3O	BroadT	BRD-A88237615	BRD-A88237615-001-14-8	Specs	AE-848/01031004			Nc1ncnc2n(cnc12)C1OC(CO)C(O)C1O	InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)	OIRDTQYFTABQOQ-UHFFFAOYSA-N	267.096753946							93913
SMR000073690	LSM-26957	BRD-K77273085, SID4259540	1314466	InChI=1S/C18H21N5O5/c1-11-5-7-14(8-6-11)15(24)19-18(4,9-25-16-12(2)20-27-22-16)10-26-17-13(3)21-28-23-17/h5-8H,9-10H2,1-4H3,(H,19,24)	QAIBPFAWVINELY-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)NC(C)(COc2nonc2C)COc3nonc3C	BroadT	BRD-K77273085	BRD-K77273085-001-05-3	ChemBridge Corporation	7598741			Cc1nonc1OCC(C)(COc1nonc1C)NC(=O)c1ccc(C)cc1	InChI=1S/C18H21N5O5/c1-11-5-7-14(8-6-11)15(24)19-18(4,9-25-16-12(2)20-27-22-16)10-26-17-13(3)21-28-23-17/h5-8H,9-10H2,1-4H3,(H,19,24)	QAIBPFAWVINELY-UHFFFAOYSA-N	387.154268822							115500
GNF-PF-521	LSM-26958	BRD-K45251081	2956655	InChI=1S/C14H18N4O2S/c1-2-7-15-14(21)17-10-8-16(9-11-17)12-3-5-13(6-4-12)18(19)20/h2-6H,1,7-11H2,(H,15,21)	IDWNGYCBOHLITE-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)N2CCN(CC2)C(=NCC=C)S	BroadT	BRD-K45251081	BRD-K45251081-001-05-2	ChemBridge Corporation	7814067			[O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(S)=NCC=C	InChI=1S/C14H18N4O2S/c1-2-7-15-14(21)17-10-8-16(9-11-17)12-3-5-13(6-4-12)18(19)20/h2-6H,1,7-11H2,(H,15,21)	IDWNGYCBOHLITE-UHFFFAOYSA-N	306.115046546							115501
BRD-A23955117	LSM-26959	BRD-A23955117		InChI=1S/C21H23NO8/c1-27-14-6-5-13(12-16(14)28-2)18-17(19(24)15-4-3-9-30-15)20(25)21(26)22(18)7-10-29-11-8-23/h3-6,9,12,17-18,23H,7-8,10-11H2,1-2H3	PVFBKFGUZTYAFD-UHFFFAOYSA-N	COc1ccc(cc1OC)C2C(C(=O)c3occc3)C(=O)C(=O)N2CCOCCO	BroadT	BRD-A23955117	BRD-A23955117-001-05-4	InterBioScreen Ltd.	STOCK4S-30583			COc1ccc(cc1OC)C1C(C(=O)c2ccco2)C(=O)C(=O)N1CCOCCO	InChI=1S/C21H23NO8/c1-27-14-6-5-13(12-16(14)28-2)18-17(19(24)15-4-3-9-30-15)20(25)21(26)22(18)7-10-29-11-8-23/h3-6,9,12,17-18,23H,7-8,10-11H2,1-2H3	PVFBKFGUZTYAFD-UHFFFAOYSA-N	417.142366706							115502
AC1OIVA2	LSM-26960	SID17408822, BRD-K17606413	7309422	InChI=1S/C19H16N6O2/c1-27-14-9-5-8-13(10-14)22-23-17-18(20)24-25-16(26)11-15(21-19(17)25)12-6-3-2-4-7-12/h2-11,26H,1H3,(H2,20,24)	QWZDAYOWZVUNRA-UHFFFAOYSA-N	COc1cccc(c1)N=Nc2c(N)nn3c(O)cc(nc23)c4ccccc4	BroadT	BRD-K17606413	BRD-K17606413-001-06-8	Specs	AO-476/43250164			COc1cccc(c1)N=Nc1c(N)nn2c(O)cc(nc12)-c1ccccc1	InChI=1S/C19H16N6O2/c1-27-14-9-5-8-13(10-14)22-23-17-18(20)24-25-16(26)11-15(21-19(17)25)12-6-3-2-4-7-12/h2-11,26H,1H3,(H2,20,24)	QWZDAYOWZVUNRA-UHFFFAOYSA-N	360.133473812							
MLS000519322	LSM-26961	BRD-K44803159, SID14738507, SID24417206	1192535	InChI=1S/C20H19N3O4/c1-3-26-19(24)13-9-11-14(12-10-13)21-17-15-7-5-6-8-16(15)22-18(23-17)20(25)27-4-2/h5-12H,3-4H2,1-2H3,(H,21,22,23)	SJNMMVLVXJMMGZ-UHFFFAOYSA-N	CCOC(=O)c1ccc(Nc2nc(nc3ccccc23)C(=O)OCC)cc1	BroadT	BRD-K44803159	BRD-K44803159-001-05-8	ChemDiv Inc.	5847-0336			CCOC(=O)c1ccc(Nc2nc(nc3ccccc23)C(=O)OCC)cc1	InChI=1S/C20H19N3O4/c1-3-26-19(24)13-9-11-14(12-10-13)21-17-15-7-5-6-8-16(15)22-18(23-17)20(25)27-4-2/h5-12H,3-4H2,1-2H3,(H,21,22,23)	SJNMMVLVXJMMGZ-UHFFFAOYSA-N	365.137556118							115504
N-(2-Phenylimidazo[1,2-a]pyridin-6-yl)acetamide	LSM-26962	BRD-K60847609, SID22402460	852390	InChI=1S/C15H13N3O/c1-11(19)16-13-7-8-15-17-14(10-18(15)9-13)12-5-3-2-4-6-12/h2-10H,1H3,(H,16,19)	TZNJVVXSMGKGMR-UHFFFAOYSA-N	CC(=O)Nc1ccc2nc(cn2c1)c3ccccc3	BroadT	BRD-K60847609	BRD-K60847609-001-05-0	Specs	AQ-776/42801458			CC(=O)Nc1ccc2nc(cn2c1)-c1ccccc1	InChI=1S/C15H13N3O/c1-11(19)16-13-7-8-15-17-14(10-18(15)9-13)12-5-3-2-4-6-12/h2-10H,1H3,(H,16,19)	TZNJVVXSMGKGMR-UHFFFAOYSA-N	251.105862066							115505
T5254367	LSM-26963	BRD-K69790201, SID22401119	2126691	InChI=1S/C14H10Cl2N2O2S3/c1-21-14-17-11-6-5-8(7-12(11)22-14)18-23(19,20)13-9(15)3-2-4-10(13)16/h2-7,18H,1H3	NNLPRDFLHLZBIJ-UHFFFAOYSA-N	CSc1nc2ccc(NS(=O)(=O)c3c(Cl)cccc3Cl)cc2s1	BroadT	BRD-K69790201	BRD-K69790201-001-05-5	Enamine Ltd.	T5254367			CSc1nc2ccc(NS(=O)(=O)c3c(Cl)cccc3Cl)cc2s1	InChI=1S/C14H10Cl2N2O2S3/c1-21-14-17-11-6-5-8(7-12(11)22-14)18-23(19,20)13-9(15)3-2-4-10(13)16/h2-7,18H,1H3	NNLPRDFLHLZBIJ-UHFFFAOYSA-N	403.92814507							115506
F1635-0010	LSM-26964	SID14723168, BRD-A42030853	3157409	InChI=1S/C20H21NO6S/c1-3-26-20(23)19-16(18-5-4-10-27-18)11-14(12-17(19)22)13-6-8-15(9-7-13)21-28(2,24)25/h4-10,12,16,19,21H,3,11H2,1-2H3	LLIGLHYTXFHWLO-UHFFFAOYSA-N	CCOC(=O)C1C(CC(=CC1=O)c2ccc(NS(=O)(=O)C)cc2)c3occc3	BroadT	BRD-A42030853	BRD-A42030853-001-05-1	Asinex Ltd.	BAS 08330322			CCOC(=O)C1C(CC(=CC1=O)c1ccc(NS(C)(=O)=O)cc1)c1ccco1	InChI=1S/C20H21NO6S/c1-3-26-20(23)19-16(18-5-4-10-27-18)11-14(12-17(19)22)13-6-8-15(9-7-13)21-28(2,24)25/h4-10,12,16,19,21H,3,11H2,1-2H3	LLIGLHYTXFHWLO-UHFFFAOYSA-N	403.108958092							115507
SMR000017086	LSM-26965	BRD-A20242387, SID7971738	3636712	InChI=1S/C25H29N5O4S/c1-16-26-25-30(27-16)24(31)23(35-25)21(17-14-19(32-2)22(34-4)20(15-17)33-3)29-12-10-28(11-13-29)18-8-6-5-7-9-18/h5-9,14-15,21,31H,10-13H2,1-4H3	IFKHJYZMEFGHLK-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(N2CCN(CC2)c3ccccc3)c4sc5nc(C)nn5c4O	BroadT	BRD-A20242387	BRD-A20242387-001-05-3	Life Chemicals Inc.	F0631-0375			COc1cc(cc(OC)c1OC)C(N1CCN(CC1)c1ccccc1)c1sc2nc(C)nn2c1O	InChI=1S/C25H29N5O4S/c1-16-26-25-30(27-16)24(31)23(35-25)21(17-14-19(32-2)22(34-4)20(15-17)33-3)29-12-10-28(11-13-29)18-8-6-5-7-9-18/h5-9,14-15,21,31H,10-13H2,1-4H3	IFKHJYZMEFGHLK-UHFFFAOYSA-N	495.194025148							115508
SMR000023839	LSM-26966	BRD-K49490091, SID4243482	3238197	InChI=1S/C13H11ClN2O3S2/c14-9-1-3-10(4-2-9)21(18,19)13(5-6-13)11(17)16-12-15-7-8-20-12/h1-4,7-8H,5-6H2,(H,15,16,17)	YYFWSLAOKLGGFW-UHFFFAOYSA-N	Clc1ccc(cc1)S(=O)(=O)C2(CC2)C(=O)Nc3nccs3	BroadT	BRD-K49490091	BRD-K49490091-001-05-0	ChemDiv Inc.	C256-1383			Clc1ccc(cc1)S(=O)(=O)C1(CC1)C(=O)Nc1nccs1	InChI=1S/C13H11ClN2O3S2/c14-9-1-3-10(4-2-9)21(18,19)13(5-6-13)11(17)16-12-15-7-8-20-12/h1-4,7-8H,5-6H2,(H,15,16,17)	YYFWSLAOKLGGFW-UHFFFAOYSA-N	341.989961322							115509
AC1M1Y0X	LSM-26967	BRD-K36084688, SID49723888	2158358	InChI=1S/C18H18N4O4S/c1-2-26-18(25)21-9-7-20(8-10-21)17(24)13-11-12-15(27-13)19-14-5-3-4-6-22(14)16(12)23/h3-6,11H,2,7-10H2,1H3	OODXHJLIJWNJIH-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)c2cc3C(=O)N4C=CC=CC4=Nc3s2	BroadT	BRD-K36084688	BRD-K36084688-001-05-5	ChemBridge Corporation	7964604			CCOC(=O)N1CCN(CC1)C(=O)c1cc2c(nc3ccccn3c2=O)s1	InChI=1S/C18H18N4O4S/c1-2-26-18(25)21-9-7-20(8-10-21)17(24)13-11-12-15(27-13)19-14-5-3-4-6-22(14)16(12)23/h3-6,11H,2,7-10H2,1H3	OODXHJLIJWNJIH-UHFFFAOYSA-N	386.104875786							115510
T5329011	LSM-26968	SID24831281, BRD-K19534880	2475619	InChI=1S/C19H22N2O5/c1-12-10-15(13(2)21(12)9-8-18(23)25-3)16(22)11-26-17-7-5-4-6-14(17)19(20)24/h4-7,10H,8-9,11H2,1-3H3,(H2,20,24)	FYYVKBJGCYJVKE-UHFFFAOYSA-N	COC(=O)CCn1c(C)cc(C(=O)COc2ccccc2C(=O)N)c1C	BroadT	BRD-K19534880	BRD-K19534880-001-06-4	Enamine Ltd.	T5329011			COC(=O)CCn1c(C)cc(C(=O)COc2ccccc2C(N)=O)c1C	InChI=1S/C19H22N2O5/c1-12-10-15(13(2)21(12)9-8-18(23)25-3)16(22)11-26-17-7-5-4-6-14(17)19(20)24/h4-7,10H,8-9,11H2,1-3H3,(H2,20,24)	FYYVKBJGCYJVKE-UHFFFAOYSA-N	358.152871824							115511
SMR000261152	LSM-26969	BRD-K56161905, SID22408137	2412986	InChI=1S/C22H27N5O5/c1-5-30-17-8-7-16(12-18(17)31-6-2)9-10-23-19(28)13-32-21(29)20-25-22-24-14(3)11-15(4)27(22)26-20/h7-8,11-12H,5-6,9-10,13H2,1-4H3,(H,23,28)	GBALQDJUWKBQMT-UHFFFAOYSA-N	CCOc1ccc(CCNC(=O)COC(=O)c2nc3nc(C)cc(C)n3n2)cc1OCC	BroadT	BRD-K56161905	BRD-K56161905-001-05-3	Enamine Ltd.	T0515-4193			CCOc1ccc(CCNC(=O)COC(=O)c2nc3nc(C)cc(C)n3n2)cc1OCC	InChI=1S/C22H27N5O5/c1-5-30-17-8-7-16(12-18(17)31-6-2)9-10-23-19(28)13-32-21(29)20-25-22-24-14(3)11-15(4)27(22)26-20/h7-8,11-12H,5-6,9-10,13H2,1-4H3,(H,23,28)	GBALQDJUWKBQMT-UHFFFAOYSA-N	441.201219014							115512
ZINC03343514	LSM-26970	BRD-K98731550, SID24827135	2459972	InChI=1S/C16H14ClNO3/c1-2-11-5-7-12(8-6-11)14(19)10-21-16(20)13-4-3-9-18-15(13)17/h3-9H,2,10H2,1H3	WIHTVZXBANYSJS-UHFFFAOYSA-N	CCc1ccc(cc1)C(=O)COC(=O)c2cccnc2Cl	BroadT	BRD-K98731550	BRD-K98731550-001-05-1	Enamine Ltd.	T0518-5240			CCc1ccc(cc1)C(=O)COC(=O)c1cccnc1Cl	InChI=1S/C16H14ClNO3/c1-2-11-5-7-12(8-6-11)14(19)10-21-16(20)13-4-3-9-18-15(13)17/h3-9H,2,10H2,1H3	WIHTVZXBANYSJS-UHFFFAOYSA-N	303.066221028							115513
AC1O9YJ7	LSM-26971	BRD-K36583698	6740948	InChI=1S/C13H19N3O3/c1-4-16(5-2)11-7-6-10(12(17)8-11)9-14-15-13(18)19-3/h6-9,17H,4-5H2,1-3H3,(H,15,18)	GMXXAMMBJIKULY-UHFFFAOYSA-N	CCN(CC)c1ccc(C=NNC(=O)OC)c(O)c1	BroadT	BRD-K36583698	BRD-K36583698-001-05-4	Specs	AN-329/40380487			CCN(CC)c1ccc(C=NNC(=O)OC)c(O)c1	InChI=1S/C13H19N3O3/c1-4-16(5-2)11-7-6-10(12(17)8-11)9-14-15-13(18)19-3/h6-9,17H,4-5H2,1-3H3,(H,15,18)	GMXXAMMBJIKULY-UHFFFAOYSA-N	265.142641498							
Ethyl 5-hydroxy-2-methylnaphtho[1,2-b]furan-3-carboxylate	LSM-26972	BRD-K24133999, SID4242051	678599	InChI=1S/C16H14O4/c1-3-19-16(18)14-9(2)20-15-11-7-5-4-6-10(11)13(17)8-12(14)15/h4-8,17H,3H2,1-2H3	NAYMIPUFIQUKOS-UHFFFAOYSA-N	CCOC(=O)c1c(C)oc2c3ccccc3c(O)cc12	BroadT	BRD-K24133999	BRD-K24133999-001-05-8	ChemDiv Inc.	7706-0968			CCOC(=O)c1c(C)oc2c1cc(O)c1ccccc21	InChI=1S/C16H14O4/c1-3-19-16(18)14-9(2)20-15-11-7-5-4-6-10(11)13(17)8-12(14)15/h4-8,17H,3H2,1-2H3	NAYMIPUFIQUKOS-UHFFFAOYSA-N	270.089208928							115515
AF-399/41753361	LSM-44191	SID22404544, BRD-K01534436	6020016	InChI=1S/C13H10ClNO/c14-11-5-2-1-4-10(11)7-8-13(16)12-6-3-9-15-12/h1-9,15H/b8-7+	XSOAGLJGAHVYSG-BQYQJAHWSA-N	Clc1ccccc1\C=C\C(=O)c2ccc[nH]2	BroadT	BRD-K01534436	BRD-K01534436-001-06-3	Specs	AF-399/41753361			Clc1ccccc1\C=C\C(=O)c1ccc[nH]1	InChI=1S/C13H10ClNO/c14-11-5-2-1-4-10(11)7-8-13(16)12-6-3-9-15-12/h1-9,15H/b8-7+	XSOAGLJGAHVYSG-BQYQJAHWSA-N	231.04509166							
MLS000058550	LSM-26974	BRD-K22599787, SID3715068	2545865	InChI=1S/C23H22N2O7/c1-4-30-23(29)19-13(2)20(24-14(19)3)17(26)12-32-22(28)15-8-5-6-9-16(15)25-21(27)18-10-7-11-31-18/h5-11,24H,4,12H2,1-3H3,(H,25,27)	NFJSJDPZIWMCCE-UHFFFAOYSA-N	CCOC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2ccccc2NC(=O)c3occc3)c1C	BroadT	BRD-K22599787	BRD-K22599787-001-05-8	Enamine Ltd.	T5339376			CCOC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2ccccc2NC(=O)c2ccco2)c1C	InChI=1S/C23H22N2O7/c1-4-30-23(29)19-13(2)20(24-14(19)3)17(26)12-32-22(28)15-8-5-6-9-16(15)25-21(27)18-10-7-11-31-18/h5-11,24H,4,12H2,1-3H3,(H,25,27)	NFJSJDPZIWMCCE-UHFFFAOYSA-N	438.142701064							115517
SMR000155071	LSM-26975	BRD-A35294449, SID14744667	3276442	InChI=1S/C21H22N2O/c1-15-13-23(14-16(2)24-15)21-12-19(17-8-4-3-5-9-17)18-10-6-7-11-20(18)22-21/h3-12,15-16H,13-14H2,1-2H3	UZXIGSNSCQTFTO-UHFFFAOYSA-N	CC1CN(CC(C)O1)c2cc(c3ccccc3)c4ccccc4n2	BroadT	BRD-A35294449	BRD-A35294449-001-05-3	Enamine Ltd.	T0504-4419			CC1CN(CC(C)O1)c1cc(-c2ccccc2)c2ccccc2n1	InChI=1S/C21H22N2O/c1-15-13-23(14-16(2)24-15)21-12-19(17-8-4-3-5-9-17)18-10-6-7-11-20(18)22-21/h3-12,15-16H,13-14H2,1-2H3	UZXIGSNSCQTFTO-UHFFFAOYSA-N	318.173213344							115518
AC1LHP2G	LSM-26976	BRD-K03035008	841626	InChI=1S/C17H17N3O2S/c1-10-11(2)23-16-15(10)17(21)20(12(3)19-16)18-9-13-5-7-14(22-4)8-6-13/h5-9H,1-4H3	JMZMJBBPWXKWGY-UHFFFAOYSA-N	COc1ccc(C=NN2C(=Nc3sc(C)c(C)c3C2=O)C)cc1	BroadT	BRD-K03035008	BRD-K03035008-001-04-2	InterBioScreen Ltd.	STOCK2S-49998			COc1ccc(C=Nn2c(C)nc3sc(C)c(C)c3c2=O)cc1	InChI=1S/C17H17N3O2S/c1-10-11(2)23-16-15(10)17(21)20(12(3)19-16)18-9-13-5-7-14(22-4)8-6-13/h5-9H,1-4H3	JMZMJBBPWXKWGY-UHFFFAOYSA-N	327.104147504							115519
AC1N9T1H	LSM-26977	BRD-K05185748	4366024	InChI=1S/C20H15ClF3N3O2S/c1-27-18(30-12-14-9-5-6-10-16(14)21)15(17(26-27)20(22,23)24)11-25-29-19(28)13-7-3-2-4-8-13/h2-11H,12H2,1H3	AFVGONWLNGCEGV-UHFFFAOYSA-N	Cn1nc(c(C=NOC(=O)c2ccccc2)c1SCc3ccccc3Cl)C(F)(F)F	BroadT	BRD-K05185748	BRD-K05185748-001-05-5	Key Organics Ltd.	3F-403S			Cn1nc(c(C=NOC(=O)c2ccccc2)c1SCc1ccccc1Cl)C(F)(F)F	InChI=1S/C20H15ClF3N3O2S/c1-27-18(30-12-14-9-5-6-10-16(14)21)15(17(26-27)20(22,23)24)11-25-29-19(28)13-7-3-2-4-8-13/h2-11H,12H2,1H3	AFVGONWLNGCEGV-UHFFFAOYSA-N	453.05255975							115520
AC1O0N5K	LSM-44192	SID24832906, BRD-K58688519	6020915	InChI=1S/C14H11NO2/c16-13-5-1-3-11(9-13)6-7-14(17)12-4-2-8-15-10-12/h1-10,16H/b7-6+	YWQFCRRNTSUDQK-VOTSOKGWSA-N	Oc1cccc(\C=C\C(=O)c2cccnc2)c1	BroadT	BRD-K58688519	BRD-K58688519-001-05-1	Enamine Ltd.	T5275354			Oc1cccc(\C=C\C(=O)c2cccnc2)c1	InChI=1S/C14H11NO2/c16-13-5-1-3-11(9-13)6-7-14(17)12-4-2-8-15-10-12/h1-10,16H/b7-6+	YWQFCRRNTSUDQK-VOTSOKGWSA-N	225.078978602							
SMR000204252	LSM-26979	SID17510203, BRD-A80705936	4411622	InChI=1S/C19H22N4O3/c1-4-26-19(25)21-23-17(13-9-11-14(12-10-13)22(2)3)20-16-8-6-5-7-15(16)18(23)24/h5-12,17,20H,4H2,1-3H3,(H,21,25)	IWUJEXSCYGXFPP-UHFFFAOYSA-N	CCOC(=O)NN1C(Nc2ccccc2C1=O)c3ccc(cc3)N(C)C	BroadT	BRD-A80705936	BRD-A80705936-001-05-2	ChemDiv Inc.	6267-0008			CCOC(=O)NN1C(Nc2ccccc2C1=O)c1ccc(cc1)N(C)C	InChI=1S/C19H22N4O3/c1-4-26-19(25)21-23-17(13-9-11-14(12-10-13)22(2)3)20-16-8-6-5-7-15(16)18(23)24/h5-12,17,20H,4H2,1-3H3,(H,21,25)	IWUJEXSCYGXFPP-UHFFFAOYSA-N	354.169190604							115522
SMR000070940	LSM-26980	BRD-K65137277, SID4259329	882256	InChI=1S/C14H10BrNO4/c15-9-3-1-2-8(6-9)13(18)16-12-5-4-10(17)7-11(12)14(19)20/h1-7,17H,(H,16,18)(H,19,20)	RTWXTCVRZFFJIJ-UHFFFAOYSA-N	OC(=O)c1cc(O)ccc1NC(=O)c2cccc(Br)c2	BroadT	BRD-K65137277	BRD-K65137277-001-05-2	ChemBridge Corporation	6431003			OC(=O)c1cc(O)ccc1NC(=O)c1cccc(Br)c1	InChI=1S/C14H10BrNO4/c15-9-3-1-2-8(6-9)13(18)16-12-5-4-10(17)7-11(12)14(19)20/h1-7,17H,(H,16,18)(H,19,20)	RTWXTCVRZFFJIJ-UHFFFAOYSA-N	334.97932041							115523
MLS000889595	LSM-26981	BRD-A23980907, SID26668729, SID850094	652603	InChI=1S/C24H29N7O3/c1-17(32)25-22(16-18-8-10-21(34-2)11-9-18)23(33)26-19-12-14-30(15-13-19)24-27-28-29-31(24)20-6-4-3-5-7-20/h3-11,19,22H,12-16H2,1-2H3,(H,25,32)(H,26,33)	HQJYBEJZCHGQLI-UHFFFAOYSA-N	COc1ccc(CC(NC(=O)C)C(=O)NC2CCN(CC2)c3nnnn3c4ccccc4)cc1	BroadT	BRD-A23980907	BRD-A23980907-001-05-6	Asinex Ltd.	ASN 10814125			COc1ccc(CC(NC(C)=O)C(=O)NC2CCN(CC2)c2nnnn2-c2ccccc2)cc1	InChI=1S/C24H29N7O3/c1-17(32)25-22(16-18-8-10-21(34-2)11-9-18)23(33)26-19-12-14-30(15-13-19)24-27-28-29-31(24)20-6-4-3-5-7-20/h3-11,19,22H,12-16H2,1-2H3,(H,25,32)(H,26,33)	HQJYBEJZCHGQLI-UHFFFAOYSA-N	463.233187858							115524
SMR000171036	LSM-26982	BRD-K22670776, SID17505126	1463756	InChI=1S/C23H22N6O5S/c1-33-16-11-13-17(14-12-16)35(31,32)27-19-8-4-3-7-18(19)23-25-28-29(26-23)15-22(30)24-20-9-5-6-10-21(20)34-2/h3-14,27H,15H2,1-2H3,(H,24,30)	OPPLUVKIADPUJN-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccccc2c3nnn(CC(=O)Nc4ccccc4OC)n3	BroadT	BRD-K22670776	BRD-K22670776-001-05-0	Asinex Ltd.	ASN 05295894			COc1ccc(cc1)S(=O)(=O)Nc1ccccc1-c1nnn(CC(=O)Nc2ccccc2OC)n1	InChI=1S/C23H22N6O5S/c1-33-16-11-13-17(14-12-16)35(31,32)27-19-8-4-3-7-18(19)23-25-28-29(26-23)15-22(30)24-20-9-5-6-10-21(20)34-2/h3-14,27H,15H2,1-2H3,(H,24,30)	OPPLUVKIADPUJN-UHFFFAOYSA-N	494.137238554							115525
NSC665105	LSM-26983	BRD-K90749965, SID24808204, SID510997	3106764	InChI=1S/C10H6Cl3N3O2/c11-7(9(12)13)8(16(17)18)10-14-5-3-1-2-4-6(5)15-10/h1-4,14-15H	NMWNNVAECBLGFO-UHFFFAOYSA-N	[O-][N+](=O)C(=C1Nc2ccccc2N1)C(=C(Cl)Cl)Cl	BroadT	BRD-K90749965	BRD-K90749965-001-05-0	Asinex Ltd.	BAS 00432089			[O-][N+](=O)C(C(Cl)=C(Cl)Cl)=C1Nc2ccccc2N1	InChI=1S/C10H6Cl3N3O2/c11-7(9(12)13)8(16(17)18)10-14-5-3-1-2-4-6(5)15-10/h1-4,14-15H	NMWNNVAECBLGFO-UHFFFAOYSA-N	304.952559592							115526
F1177-0034	LSM-26984	BRD-K21588993, SID24830096	700198	InChI=1S/C14H12ClN3O/c1-10-7-11(15)3-4-13(10)19-9-12-8-18-6-2-5-16-14(18)17-12/h2-8H,9H2,1H3	VIEYBSQJYOJUSR-UHFFFAOYSA-N	Cc1cc(Cl)ccc1OCc2cn3cccnc3n2	BroadT	BRD-K21588993	BRD-K21588993-001-06-0	Enamine Ltd.	T0510-2922			Cc1cc(Cl)ccc1OCc1cn2cccnc2n1	InChI=1S/C14H12ClN3O/c1-10-7-11(15)3-4-13(10)19-9-12-8-18-6-2-5-16-14(18)17-12/h2-8H,9H2,1H3	VIEYBSQJYOJUSR-UHFFFAOYSA-N	273.066889744							115527
T5668612	LSM-26985	BRD-K31660953, SID24835577	4393750	InChI=1S/C18H21N3O/c1-13-7-8-14(2)21(13)17-11-9-15(10-12-17)18(22)20-19-16-5-3-4-6-16/h7-12H,3-6H2,1-2H3,(H,20,22)	PWNQPIYFCSGLBO-UHFFFAOYSA-N	Cc1ccc(C)n1c2ccc(cc2)C(=O)NN=C3CCCC3	BroadT	BRD-K31660953	BRD-K31660953-001-06-3	Enamine Ltd.	T0506-6398			Cc1ccc(C)n1-c1ccc(cc1)C(=O)NN=C1CCCC1	InChI=1S/C18H21N3O/c1-13-7-8-14(2)21(13)17-11-9-15(10-12-17)18(22)20-19-16-5-3-4-6-16/h7-12H,3-6H2,1-2H3,(H,20,22)	PWNQPIYFCSGLBO-UHFFFAOYSA-N	295.168462322							115528
SMR000031007	LSM-26986	SID4248704, BRD-K12111274	3242750	InChI=1S/C16H22N2O4S/c1-4-21-13-9-11-12(10-14(13)22-5-2)17-16(23)18(15(11)19)7-6-8-20-3/h9-10H,4-8H2,1-3H3,(H,17,23)	WBCIAHUEWFZRQG-UHFFFAOYSA-N	CCOc1cc2NC(=S)N(CCCOC)C(=O)c2cc1OCC	BroadT	BRD-K12111274	BRD-K12111274-001-06-2	ChemDiv Inc.	K284-7495			CCOc1cc2[nH]c(=S)n(CCCOC)c(=O)c2cc1OCC	InChI=1S/C16H22N2O4S/c1-4-21-13-9-11-12(10-14(13)22-5-2)17-16(23)18(15(11)19)7-6-8-20-3/h9-10H,4-8H2,1-3H3,(H,17,23)	WBCIAHUEWFZRQG-UHFFFAOYSA-N	338.130027894							115529
MLS000707436	LSM-44193	BRD-K54686062, SID24809331	5770944	InChI=1S/C19H18N4O2S/c1-25-13-12-23(17(24)10-9-15-6-3-2-4-7-15)19-22-21-18(26-19)16-8-5-11-20-14-16/h2-11,14H,12-13H2,1H3/b10-9+	OKXJPDSIZNCWMY-MDZDMXLPSA-N	COCCN(C(=O)\C=C\c1ccccc1)c2nnc(s2)c3cccnc3	BroadT	BRD-K54686062	BRD-K54686062-001-06-8	Asinex Ltd.	ASN 05672101			COCCN(C(=O)\C=C\c1ccccc1)c1nnc(s1)-c1cccnc1	InChI=1S/C19H18N4O2S/c1-25-13-12-23(17(24)10-9-15-6-3-2-4-7-15)19-22-21-18(26-19)16-8-5-11-20-14-16/h2-11,14H,12-13H2,1H3/b10-9+	OKXJPDSIZNCWMY-MDZDMXLPSA-N	366.115046546							
AC1M57KW	LSM-15569	BRD-K56889360	2296770	InChI=1S/C15H25NO2/c1-4-6-11-16(3)12-13-18-15-10-8-7-9-14(15)17-5-2/h7-10H,4-6,11-13H2,1-3H3	OAYLZHOWNGBAPB-UHFFFAOYSA-N	CCCCN(C)CCOc1ccccc1OCC	BroadT	BRD-K56889360	BRD-K56889360-034-05-8	ChemBridge Corporation	7003235		OC(=O)C(=O)O	CCCCN(C)CCOc1ccccc1OCC.OC(=O)C(=O)O	InChI=1S/C15H25NO2.C2H2O4/c1-4-6-11-16(3)12-13-18-15-10-8-7-9-14(15)17-5-2;3-1(4)2(5)6/h7-10H,4-6,11-13H2,1-3H3;(H,3,4)(H,5,6)	NAKXTTHCGMKJST-UHFFFAOYSA-N	251.18852905							104205, 104205
F0656-0822	LSM-26988	BRD-K98841583, SID4250916	3244667	InChI=1S/C19H16FN5O/c1-12-3-4-13(2)14(9-12)10-24-11-21-18-17(19(24)26)22-23-25(18)16-7-5-15(20)6-8-16/h3-9,11H,10H2,1-2H3	NTECUVJCPIVLNR-UHFFFAOYSA-N	Cc1ccc(C)c(CN2C=Nc3c(nnn3c4ccc(F)cc4)C2=O)c1	BroadT	BRD-K98841583	BRD-K98841583-001-05-9	ChemDiv Inc.	C656-0448			Cc1ccc(C)c(Cn2cnc3n(nnc3c2=O)-c2ccc(F)cc2)c1	InChI=1S/C19H16FN5O/c1-12-3-4-13(2)14(9-12)10-24-11-21-18-17(19(24)26)22-23-25(18)16-7-5-15(20)6-8-16/h3-9,11H,10H2,1-2H3	NTECUVJCPIVLNR-UHFFFAOYSA-N	349.133888382							115531
STK069124	LSM-26989	BRD-K52406139, SID17433006	2192679	InChI=1S/C15H23N3OS/c1-2-3-4-13-5-7-14(8-6-13)16-15(20)17-18-9-11-19-12-10-18/h5-8H,2-4,9-12H2,1H3,(H2,16,17,20)	SJHLDWBNOZHZKI-UHFFFAOYSA-N	CCCCc1ccc(NC(=NN2CCOCC2)S)cc1	BroadT	BRD-K52406139	BRD-K52406139-001-05-4	ChemBridge Corporation	7515218			CCCCc1ccc(NC(S)=NN2CCOCC2)cc1	InChI=1S/C15H23N3OS/c1-2-3-4-13-5-7-14(8-6-13)16-15(20)17-18-9-11-19-12-10-18/h5-8H,2-4,9-12H2,1H3,(H2,16,17,20)	SJHLDWBNOZHZKI-UHFFFAOYSA-N	293.156183076							115532
SMR000081067	LSM-26990	BRD-K87669186, SID4262378	2972664	InChI=1S/C22H24ClN5O4S/c1-2-32-22(29)28-13-11-16(12-14-28)24-20-21(26-19-6-4-3-5-18(19)25-20)27-33(30,31)17-9-7-15(23)8-10-17/h3-10,16H,2,11-14H2,1H3,(H,24,25)(H,26,27)	WKVPOCJWCZSIQB-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)Nc2nc3ccccc3nc2NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K87669186	BRD-K87669186-001-07-4	ChemBridge Corporation	7953395			CCOC(=O)N1CCC(CC1)Nc1nc2ccccc2nc1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H24ClN5O4S/c1-2-32-22(29)28-13-11-16(12-14-28)24-20-21(26-19-6-4-3-5-18(19)25-20)27-33(30,31)17-9-7-15(23)8-10-17/h3-10,16H,2,11-14H2,1H3,(H,24,25)(H,26,27)	WKVPOCJWCZSIQB-UHFFFAOYSA-N	489.123752698							115533
6-Chloro-n-cyclohexyl-n'-isopropyl-[1,3,5]triazine-2,4-diamine	LSM-26991	BRD-K61206648, SID49642956	779462	InChI=1S/C12H20ClN5/c1-8(2)14-11-16-10(13)17-12(18-11)15-9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3,(H2,14,15,16,17,18)	XROJXFOXCKFAEG-UHFFFAOYSA-N	CC(C)Nc1nc(Cl)nc(NC2CCCCC2)n1	BroadT	BRD-K61206648	BRD-K61206648-001-05-1	Asinex Ltd.	BAS 00733918			CC(C)Nc1nc(Cl)nc(NC2CCCCC2)n1	InChI=1S/C12H20ClN5/c1-8(2)14-11-16-10(13)17-12(18-11)15-9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3,(H2,14,15,16,17,18)	XROJXFOXCKFAEG-UHFFFAOYSA-N	269.1407234							115534
MLS000730889	LSM-26992	BRD-A02927672, SID24812076	16002732	InChI=1S/C21H21BrN4O3S/c1-4-5-16(29-13-8-6-12(22)7-9-13)19-24-20-14-10-17(27-2)18(28-3)11-15(14)23-21(30)26(20)25-19/h6-11,16H,4-5H2,1-3H3,(H,23,30)	TXQUPVHAFRNVNR-UHFFFAOYSA-N	CCCC(Oc1ccc(Br)cc1)c2nc3c4cc(OC)c(OC)cc4nc(S)n3n2	BroadT	BRD-A02927672	BRD-A02927672-001-06-3	ChemDiv Inc.	C445-0009			CCCC(Oc1ccc(Br)cc1)c1nc2c3cc(OC)c(OC)cc3nc(S)n2n1	InChI=1S/C21H21BrN4O3S/c1-4-5-16(29-13-8-6-12(22)7-9-13)19-24-20-14-10-17(27-2)18(28-3)11-15(14)23-21(30)26(20)25-19/h6-11,16H,4-5H2,1-3H3,(H,23,30)	TXQUPVHAFRNVNR-UHFFFAOYSA-N	488.051773862							
AC1LI5Y0	LSM-26993	BRD-K23405268, SID17387749	849400	InChI=1S/C15H12N2OS/c1-2-4-12(5-3-1)10-18-14-8-6-13(7-9-14)15-11-19-17-16-15/h1-9,11H,10H2	YXNNWYABAKEBBC-UHFFFAOYSA-N	C(Oc1ccc(cc1)c2csnn2)c3ccccc3	BroadT	BRD-K23405268	BRD-K23405268-001-06-3	Specs	AO-638/40907157			C(Oc1ccc(cc1)-c1csnn1)c1ccccc1	InChI=1S/C15H12N2OS/c1-2-4-12(5-3-1)10-18-14-8-6-13(7-9-14)15-11-19-17-16-15/h1-9,11H,10H2	YXNNWYABAKEBBC-UHFFFAOYSA-N	268.067033714							115536
ZINC02706577	LSM-26994	BRD-K56024344, SID14733520	2145363	InChI=1S/C18H15FN2O3/c1-24-16-4-2-3-15-14(16)9-10-21(18(15)23)11-17(22)20-13-7-5-12(19)6-8-13/h2-10H,11H2,1H3,(H,20,22)	ICUFVCYRCLHYOA-UHFFFAOYSA-N	COc1cccc2C(=O)N(CC(=O)Nc3ccc(F)cc3)C=Cc12	BroadT	BRD-K56024344	BRD-K56024344-001-04-5	Life Chemicals Inc.	F1808-0025			COc1cccc2c1ccn(CC(=O)Nc1ccc(F)cc1)c2=O	InChI=1S/C18H15FN2O3/c1-24-16-4-2-3-15-14(16)9-10-21(18(15)23)11-17(22)20-13-7-5-12(19)6-8-13/h2-10H,11H2,1H3,(H,20,22)	ICUFVCYRCLHYOA-UHFFFAOYSA-N	326.10667056							115537
AN-979/15447130	LSM-26995	SID47195816, BRD-K21759602	839399	InChI=1S/C13H7N3O4/c17-12-9-3-1-2-4-10(9)13(18)15(12)11-7-8(16(19)20)5-6-14-11/h1-7H	DJRIHOHHHKLNRT-UHFFFAOYSA-N	[O-][N+](=O)c1ccnc(c1)N2C(=O)c3ccccc3C2=O	BroadT	BRD-K21759602	BRD-K21759602-001-05-2	Specs	AN-979/15447130			[O-][N+](=O)c1ccnc(c1)N1C(=O)c2ccccc2C1=O	InChI=1S/C13H7N3O4/c17-12-9-3-1-2-4-10(9)13(18)15(12)11-7-8(16(19)20)5-6-14-11/h1-7H	DJRIHOHHHKLNRT-UHFFFAOYSA-N	269.043655734							115538
MLS001007645	LSM-26996	BRD-K97527915, SID24831131	2110942	InChI=1S/C16H15N3O/c1-20-14-9-7-12(8-10-14)16-15(17)11-19(18-16)13-5-3-2-4-6-13/h2-11H,17H2,1H3	NUAGXUJVJWBMOC-UHFFFAOYSA-N	COc1ccc(cc1)c2nn(cc2N)c3ccccc3	BroadT	BRD-K97527915	BRD-K97527915-001-06-2	Enamine Ltd.	T5241079			COc1ccc(cc1)-c1nn(cc1N)-c1ccccc1	InChI=1S/C16H15N3O/c1-20-14-9-7-12(8-10-14)16-15(17)11-19(18-16)13-5-3-2-4-6-13/h2-11H,17H2,1H3	NUAGXUJVJWBMOC-UHFFFAOYSA-N	265.12151213							115539
2-Propyl-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole	LSM-26997	BRD-K44897610, SID22404888	833654	InChI=1S/C14H18N2O4/c1-5-6-12-15-16-14(20-12)9-7-10(17-2)13(19-4)11(8-9)18-3/h7-8H,5-6H2,1-4H3	IKNWKOSHHOXPEO-UHFFFAOYSA-N	CCCc1oc(nn1)c2cc(OC)c(OC)c(OC)c2	BroadT	BRD-K44897610	BRD-K44897610-001-05-3	Specs	AN-329/42343909			CCCc1nnc(o1)-c1cc(OC)c(OC)c(OC)c1	InChI=1S/C14H18N2O4/c1-5-6-12-15-16-14(20-12)9-7-10(17-2)13(19-4)11(8-9)18-3/h7-8H,5-6H2,1-4H3	IKNWKOSHHOXPEO-UHFFFAOYSA-N	278.126657076							115540
MLS000557947	LSM-26998	BRD-K39985369, SID14743244	5102303	InChI=1S/C12H20N2O2S2/c1-14(11-5-3-2-4-6-11)12(17)13-10-7-8-18(15,16)9-10/h7,11H,2-6,8-9H2,1H3,(H,13,17)	RYJYEOJHMSTHSG-UHFFFAOYSA-N	CN(C1CCCCC1)C(=NC2=CCS(=O)(=O)C2)S	BroadT	BRD-K39985369	BRD-K39985369-001-06-4	InterBioScreen Ltd.	STOCK5S-03525			CN(C1CCCCC1)C(S)=NC1=CCS(=O)(=O)C1	InChI=1S/C12H20N2O2S2/c1-14(11-5-3-2-4-6-11)12(17)13-10-7-8-18(15,16)9-10/h7,11H,2-6,8-9H2,1H3,(H,13,17)	RYJYEOJHMSTHSG-UHFFFAOYSA-N	288.09661928							115541
AC1LCIIK	LSM-26999	BRD-K45190659, SID848312	650748	InChI=1S/C12H16BrN3/c1-8-11(15-12(2,3)4)16-7-9(13)5-6-10(16)14-8/h5-7,15H,1-4H3	FNJGDIFUFSECNH-UHFFFAOYSA-N	Cc1nc2ccc(Br)cn2c1NC(C)(C)C	BroadT	BRD-K45190659	BRD-K45190659-001-06-2	Asinex Ltd.	ASN 03929771			Cc1nc2ccc(Br)cn2c1NC(C)(C)C	InChI=1S/C12H16BrN3/c1-8-11(15-12(2,3)4)16-7-9(13)5-6-10(16)14-8/h5-7,15H,1-4H3	FNJGDIFUFSECNH-UHFFFAOYSA-N	281.052760142							115542
T5297910	LSM-27000	BRD-K20416270, SID26657481	2543157	InChI=1S/C16H14N4O/c1-11-6-8-12(9-7-11)16(21)20-19-15-13-4-2-3-5-14(13)17-10-18-15/h2-10H,1H3,(H,20,21)(H,17,18,19)	RSDGCYDAXDDFIL-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)NNc2ncnc3ccccc23	BroadT	BRD-K20416270	BRD-K20416270-001-06-9	Enamine Ltd.	T5297910			Cc1ccc(cc1)C(=O)NNc1ncnc2ccccc12	InChI=1S/C16H14N4O/c1-11-6-8-12(9-7-11)16(21)20-19-15-13-4-2-3-5-14(13)17-10-18-15/h2-10H,1H3,(H,20,21)(H,17,18,19)	RSDGCYDAXDDFIL-UHFFFAOYSA-N	278.116761108							115543
MLS000555389	LSM-27001	BRD-K21937603, SID17408485	997475	InChI=1S/C20H17NO5/c22-20-18-4-2-1-3-16(18)17-10-9-15(11-19(17)26-20)25-12-13-5-7-14(8-6-13)21(23)24/h5-11H,1-4,12H2	AGYDNJPPEFCTLE-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(COc2ccc3C4=C(CCCC4)C(=O)Oc3c2)cc1	BroadT	BRD-K21937603	BRD-K21937603-001-05-3	Asinex Ltd.	BAS 00872218			[O-][N+](=O)c1ccc(COc2ccc3c4CCCCc4c(=O)oc3c2)cc1	InChI=1S/C20H17NO5/c22-20-18-4-2-1-3-16(18)17-10-9-15(11-19(17)26-20)25-12-13-5-7-14(8-6-13)21(23)24/h5-11H,1-4,12H2	AGYDNJPPEFCTLE-UHFFFAOYSA-N	351.110672654							115544
MLS000582986	LSM-27002	BRD-K84874502, SID17506727	2224786	InChI=1S/C17H18N4O3S2/c1-10(2)14(22)18-12-7-5-11(6-8-12)15(23)20-21-17(25)19-16(24)13-4-3-9-26-13/h3-10H,1-2H3,(H,18,22)(H,20,23)(H2,19,21,24,25)	WVEHKULHEMECDQ-UHFFFAOYSA-N	CC(C)C(=O)Nc1ccc(cc1)C(=O)NNC(=S)NC(=O)c2cccs2	BroadT	BRD-K84874502	BRD-K84874502-001-06-2	ChemBridge Corporation	7940208			CC(C)C(=O)Nc1ccc(cc1)C(=O)NNC(=S)NC(=O)c1cccs1	InChI=1S/C17H18N4O3S2/c1-10(2)14(22)18-12-7-5-11(6-8-12)15(23)20-21-17(25)19-16(24)13-4-3-9-26-13/h3-10H,1-2H3,(H,18,22)(H,20,23)(H2,19,21,24,25)	WVEHKULHEMECDQ-UHFFFAOYSA-N	390.082031856							115545
MLS000567174	LSM-27003	SID14744471, BRD-K81099637	4885101	InChI=1S/C20H21N3OS/c1-15-8-9-18(12-16(15)2)22-19(24)14-25-20-21-10-11-23(20)13-17-6-4-3-5-7-17/h3-12H,13-14H2,1-2H3,(H,22,24)	NEUCIWKTRFNBDI-UHFFFAOYSA-N	Cc1ccc(NC(=O)CSc2nccn2Cc3ccccc3)cc1C	BroadT	BRD-K81099637	BRD-K81099637-001-05-9	Enamine Ltd.	T5339046			Cc1ccc(NC(=O)CSc2nccn2Cc2ccccc2)cc1C	InChI=1S/C20H21N3OS/c1-15-8-9-18(12-16(15)2)22-19(24)14-25-20-21-10-11-23(20)13-17-6-4-3-5-7-17/h3-12H,13-14H2,1-2H3,(H,22,24)	NEUCIWKTRFNBDI-UHFFFAOYSA-N	351.140533012							115546
SMR000007590	LSM-27004	BRD-K15280583, SID26667929, SID842917	645189	InChI=1S/C25H29N5O2S/c1-25(2)16-18-8-4-5-9-19(18)23-26-27-24(30(23)25)33-17-22(31)29-14-12-28(13-15-29)20-10-6-7-11-21(20)32-3/h4-11H,12-17H2,1-3H3	QHRLIQVZSCVBLO-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)C(=O)CSc3nnc4c5ccccc5CC(C)(C)n34	BroadT	BRD-K15280583	BRD-K15280583-001-05-0	Asinex Ltd.	ASN 06978375			COc1ccccc1N1CCN(CC1)C(=O)CSc1nnc2-c3ccccc3CC(C)(C)n12	InChI=1S/C25H29N5O2S/c1-25(2)16-18-8-4-5-9-19(18)23-26-27-24(30(23)25)33-17-22(31)29-14-12-28(13-15-29)20-10-6-7-11-21(20)32-3/h4-11H,12-17H2,1-3H3	QHRLIQVZSCVBLO-UHFFFAOYSA-N	463.204195908							115547
AC1MCBVD	LSM-27005	BRD-K34088127, SID17409615	2765821	InChI=1S/C14H11ClN4OS/c15-11-3-1-10(2-4-11)7-20-19-9-17-13-12-5-6-21-14(12)18-8-16-13/h1-6,8-9H,7H2,(H,16,17,18,19)	NQSVBSNDOSRTDQ-UHFFFAOYSA-N	Clc1ccc(CONC=Nc2ncnc3sccc23)cc1	BroadT	BRD-K34088127	BRD-K34088127-001-06-5	Key Organics Ltd.	10N-806			Clc1ccc(CONC=Nc2ncnc3sccc23)cc1	InChI=1S/C14H11ClN4OS/c15-11-3-1-10(2-4-11)7-20-19-9-17-13-12-5-6-21-14(12)18-8-16-13/h1-6,8-9H,7H2,(H,16,17,18,19)	NQSVBSNDOSRTDQ-UHFFFAOYSA-N	318.034209412							115548
SMR000349346	LSM-27006	BRD-K48593237, SID24826367	3419559	InChI=1S/C26H27N3O6S/c1-33-21-11-5-3-8-18(21)14-28-23(30)16-35-26(32)20-10-7-13-27-25(20)36-17-24(31)29-15-19-9-4-6-12-22(19)34-2/h3-13H,14-17H2,1-2H3,(H,28,30)(H,29,31)	FVPQHDUJMGOBLU-UHFFFAOYSA-N	COc1ccccc1CNC(=O)COC(=O)c2cccnc2SCC(=O)NCc3ccccc3OC	BroadT	BRD-K48593237	BRD-K48593237-001-05-7	Enamine Ltd.	T0510-7907			COc1ccccc1CNC(=O)COC(=O)c1cccnc1SCC(=O)NCc1ccccc1OC	InChI=1S/C26H27N3O6S/c1-33-21-11-5-3-8-18(21)14-28-23(30)16-35-26(32)20-10-7-13-27-25(20)36-17-24(31)29-15-19-9-4-6-12-22(19)34-2/h3-13H,14-17H2,1-2H3,(H,28,30)(H,29,31)	FVPQHDUJMGOBLU-UHFFFAOYSA-N	509.162056304							115549
STK172771	LSM-27007	BRD-K20377072, SID24793732	2905590	InChI=1S/C15H13ClN2O2S/c1-9-6-7-13(19)12(8-9)17-15(21)18-14(20)10-4-2-3-5-11(10)16/h2-8,19H,1H3,(H2,17,18,20,21)	KECHDTKJESICOZ-UHFFFAOYSA-N	Cc1ccc(O)c(NC(=S)NC(=O)c2ccccc2Cl)c1	BroadT	BRD-K20377072	BRD-K20377072-001-05-5	ChemBridge Corporation	6616297			Cc1ccc(O)c(NC(=S)NC(=O)c2ccccc2Cl)c1	InChI=1S/C15H13ClN2O2S/c1-9-6-7-13(19)12(8-9)17-15(21)18-14(20)10-4-2-3-5-11(10)16/h2-8,19H,1H3,(H2,17,18,20,21)	KECHDTKJESICOZ-UHFFFAOYSA-N	320.038626076							115550
SMR000062212	LSM-27008	BRD-K05137000, SID3715206	763035	InChI=1S/C12H9F3N2O3/c1-2-20-10(19)6-3-4-8-7(5-6)9(18)17-11(16-8)12(13,14)15/h3-5H,2H2,1H3,(H,16,17,18)	OBBHPRQRZBYBHN-UHFFFAOYSA-N	CCOC(=O)c1ccc2nc(nc(O)c2c1)C(F)(F)F	BroadT	BRD-K05137000	BRD-K05137000-001-05-9	Enamine Ltd.	T0513-3381			CCOC(=O)c1ccc2nc(nc(O)c2c1)C(F)(F)F	InChI=1S/C12H9F3N2O3/c1-2-20-10(19)6-3-4-8-7(5-6)9(18)17-11(16-8)12(13,14)15/h3-5H,2H2,1H3,(H,16,17,18)	OBBHPRQRZBYBHN-UHFFFAOYSA-N	286.056526768							115551
SMR000093128	LSM-27009	BRD-A92357389, SID24838241, SID7968506	5309443	InChI=1S/C22H29N3O3S/c1-22(2,3)17-10-12-19(13-11-17)29(27,28)25-15-7-5-9-20(25)21(26)24-16-18-8-4-6-14-23-18/h4,6,8,10-14,20H,5,7,9,15-16H2,1-3H3,(H,24,26)	VYBRUXXNPXPFGA-UHFFFAOYSA-N	CC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCCCC2C(=O)NCc3ccccn3	BroadT	BRD-A92357389	BRD-A92357389-001-04-3	ChemDiv Inc.	C155-0652			CC(C)(C)c1ccc(cc1)S(=O)(=O)N1CCCCC1C(=O)NCc1ccccn1	InChI=1S/C22H29N3O3S/c1-22(2,3)17-10-12-19(13-11-17)29(27,28)25-15-7-5-9-20(25)21(26)24-16-18-8-4-6-14-23-18/h4,6,8,10-14,20H,5,7,9,15-16H2,1-3H3,(H,24,26)	VYBRUXXNPXPFGA-UHFFFAOYSA-N	415.192962508							115552
(4-Benzoyl-1-methyltetrahydro-1H-pyrrol-3-yl)(phenyl)methanone	LSM-27010	SID17411214, BRD-A15086915	4269490	InChI=1S/C19H19NO2/c1-20-12-16(18(21)14-8-4-2-5-9-14)17(13-20)19(22)15-10-6-3-7-11-15/h2-11,16-17H,12-13H2,1H3	WWXHATMUSYQHED-UHFFFAOYSA-N	CN1CC(C(C1)C(=O)c2ccccc2)C(=O)c3ccccc3	BroadT	BRD-A15086915	BRD-A15086915-001-05-2	Key Organics Ltd.	6N-726			CN1CC(C(C1)C(=O)c1ccccc1)C(=O)c1ccccc1	InChI=1S/C19H19NO2/c1-20-12-16(18(21)14-8-4-2-5-9-14)17(13-20)19(22)15-10-6-3-7-11-15/h2-11,16-17H,12-13H2,1H3	WWXHATMUSYQHED-UHFFFAOYSA-N	293.141578858							115553
SMR000035695	LSM-27011	BRD-A34826857, SID859272	660571	InChI=1S/C21H28N2O3S/c1-16-14-22(15-17(2)26-16)20-9-11-23(12-10-20)27(24,25)21-8-7-18-5-3-4-6-19(18)13-21/h3-8,13,16-17,20H,9-12,14-15H2,1-2H3	AJKSWRPZYOXMGP-UHFFFAOYSA-N	CC1CN(CC(C)O1)C2CCN(CC2)S(=O)(=O)c3ccc4ccccc4c3	BroadT	BRD-A34826857	BRD-A34826857-001-05-8	InterBioScreen Ltd.	STOCK3S-00414			CC1CN(CC(C)O1)C1CCN(CC1)S(=O)(=O)c1ccc2ccccc2c1	InChI=1S/C21H28N2O3S/c1-16-14-22(15-17(2)26-16)20-9-11-23(12-10-20)27(24,25)21-8-7-18-5-3-4-6-19(18)13-21/h3-8,13,16-17,20H,9-12,14-15H2,1-2H3	AJKSWRPZYOXMGP-UHFFFAOYSA-N	388.182063466							115554
SMR000012510	LSM-27012	BRD-K94090114, SID26667972, SID851163	653724	InChI=1S/C19H17F3N4O4S/c1-10-6-16(26-30-10)25-17(27)9-31-18-23-12(8-15(24-18)19(20,21)22)11-4-5-13(28-2)14(7-11)29-3/h4-8H,9H2,1-3H3,(H,25,26,27)	DDSAPUCNAANPSY-UHFFFAOYSA-N	COc1ccc(cc1OC)c2cc(nc(SCC(=O)Nc3cc(C)on3)n2)C(F)(F)F	BroadT	BRD-K94090114	BRD-K94090114-001-05-5	Asinex Ltd.	BAS 03613487			COc1ccc(cc1OC)-c1cc(nc(SCC(=O)Nc2cc(C)on2)n1)C(F)(F)F	InChI=1S/C19H17F3N4O4S/c1-10-6-16(26-30-10)25-17(27)9-31-18-23-12(8-15(24-18)19(20,21)22)11-4-5-13(28-2)14(7-11)29-3/h4-8H,9H2,1-3H3,(H,25,26,27)	DDSAPUCNAANPSY-UHFFFAOYSA-N	454.092260354							115555
SMR000219459	LSM-27013	BRD-A10134527, SID17504069	4678842	InChI=1S/C25H20ClFN4O4S/c1-35-20-12-8-18(9-13-20)28-22(32)14-21-24(34)30(19-10-6-17(27)7-11-19)25(36)31(21)29-23(33)15-2-4-16(26)5-3-15/h2-13,21H,14H2,1H3,(H,28,32)(H,29,33)	NVISMUCUSDUQFO-UHFFFAOYSA-N	COc1ccc(NC(=O)CC2N(NC(=O)c3ccc(Cl)cc3)C(=S)N(C2=O)c4ccc(F)cc4)cc1	BroadT	BRD-A10134527	BRD-A10134527-001-05-5	InterBioScreen Ltd.	STOCK3S-64480			COc1ccc(NC(=O)CC2N(NC(=O)c3ccc(Cl)cc3)C(=S)N(C2=O)c2ccc(F)cc2)cc1	InChI=1S/C25H20ClFN4O4S/c1-35-20-12-8-18(9-13-20)28-22(32)14-21-24(34)30(19-10-6-17(27)7-11-19)25(36)31(21)29-23(33)15-2-4-16(26)5-3-15/h2-13,21H,14H2,1H3,(H,28,32)(H,29,33)	NVISMUCUSDUQFO-UHFFFAOYSA-N	526.08778176							115556
AC1MG3LR	LSM-27014	BRD-A63501481, SID4263010	2954977	InChI=1S/C18H21NO3/c1-14-4-6-15(7-5-14)16(17-3-2-10-22-17)13-18(20)19-8-11-21-12-9-19/h2-7,10,16H,8-9,11-13H2,1H3	AFBWAJQRQKNZTG-UHFFFAOYSA-N	Cc1ccc(cc1)C(CC(=O)N2CCOCC2)c3occc3	BroadT	BRD-A63501481	BRD-A63501481-001-05-5	ChemBridge Corporation	7791100			Cc1ccc(cc1)C(CC(=O)N1CCOCC1)c1ccco1	InChI=1S/C18H21NO3/c1-14-4-6-15(7-5-14)16(17-3-2-10-22-17)13-18(20)19-8-11-21-12-9-19/h2-7,10,16H,8-9,11-13H2,1H3	AFBWAJQRQKNZTG-UHFFFAOYSA-N	299.152143542							115557
MLS001215766	LSM-27015	BRD-K35026224, SID49726404	6493454	InChI=1S/C17H24Cl2N4O3S/c18-15-5-4-14(12-16(15)19)20-17(24)13-21-8-10-23(11-9-21)27(25,26)22-6-2-1-3-7-22/h4-5,12H,1-3,6-11,13H2,(H,20,24)	HUKBKDHKEFUZNB-UHFFFAOYSA-N	Clc1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)N3CCCCC3)cc1Cl	BroadT	BRD-K35026224	BRD-K35026224-001-06-6	Asinex Ltd.	ASN 12914272			Clc1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)N2CCCCC2)cc1Cl	InChI=1S/C17H24Cl2N4O3S/c18-15-5-4-14(12-16(15)19)20-17(24)13-21-8-10-23(11-9-21)27(25,26)22-6-2-1-3-7-22/h4-5,12H,1-3,6-11,13H2,(H,20,24)	HUKBKDHKEFUZNB-UHFFFAOYSA-N	434.094616778							115558
MLS000092668	LSM-27016	BRD-A20018680, SID4247264	3241493	InChI=1S/C19H20N2O5/c1-23-14-6-4-5-12(9-14)15-11-18(26-21-15)19(22)20-13-7-8-16(24-2)17(10-13)25-3/h4-10,18H,11H2,1-3H3,(H,20,22)	RUSNEHISXMHECV-UHFFFAOYSA-N	COc1cccc(c1)C2=NOC(C2)C(=O)Nc3ccc(OC)c(OC)c3	BroadT	BRD-A20018680	BRD-A20018680-001-05-1	ChemDiv Inc.	C651-0103			COc1cccc(c1)C1=NOC(C1)C(=O)Nc1ccc(OC)c(OC)c1	InChI=1S/C19H20N2O5/c1-23-14-6-4-5-12(9-14)15-11-18(26-21-15)19(22)20-13-7-8-16(24-2)17(10-13)25-3/h4-10,18H,11H2,1-3H3,(H,20,22)	RUSNEHISXMHECV-UHFFFAOYSA-N	356.13722176							115559
9-Methyl-5,6,7,8-tetrahydro[1,2,3,4]tetraazolo[5,1-b]quinazoline	LSM-27017	BRD-K03015524, SID24821750	1481962	InChI=1S/C9H11N5/c1-6-7-4-2-3-5-8(7)10-9-11-12-13-14(6)9/h2-5H2,1H3	WFHYJKKLGBROEX-UHFFFAOYSA-N	Cc1c2CCCCc2nc3nnnn13	BroadT	BRD-K03015524	BRD-K03015524-001-05-6	Key Organics Ltd.	11T-0809			Cc1c2CCCCc2nc2nnnn12	InChI=1S/C9H11N5/c1-6-7-4-2-3-5-8(7)10-9-11-12-13-14(6)9/h2-5H2,1H3	WFHYJKKLGBROEX-UHFFFAOYSA-N	189.101445402							115560
CBMICRO_026494	LSM-27018	BRD-K58827489	6614581	InChI=1S/C24H24N6O4S/c1-15-5-8-19(13-16(15)2)30-24(31)21(17(3)28-30)14-27-18-6-9-20(10-7-18)35(32,33)29-22-23(34-4)26-12-11-25-22/h5-14,31H,1-4H3,(H,25,29)	NPMQQPZLEBASQD-UHFFFAOYSA-N	COc1nccnc1NS(=O)(=O)c2ccc(cc2)N=Cc3c(C)nn(c3O)c4ccc(C)c(C)c4	BroadT	BRD-K58827489	BRD-K58827489-001-05-1	ChemBridge Corporation	5627124			COc1nccnc1NS(=O)(=O)c1ccc(cc1)N=Cc1c(C)nn(c1O)-c1ccc(C)c(C)c1	InChI=1S/C24H24N6O4S/c1-15-5-8-19(13-16(15)2)30-24(31)21(17(3)28-30)14-27-18-6-9-20(10-7-18)35(32,33)29-22-23(34-4)26-12-11-25-22/h5-14,31H,1-4H3,(H,25,29)	NPMQQPZLEBASQD-UHFFFAOYSA-N	492.157973998							
Thiourea, n-(4-bromophenyl)-n'-(2-phenylethyl)-	LSM-27019	BRD-K88527653, SID22415925	805738	InChI=1S/C15H15BrN2S/c16-13-6-8-14(9-7-13)18-15(19)17-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H2,17,18,19)	YZSQKACOUOYKMQ-UHFFFAOYSA-N	Brc1ccc(NC(=S)NCCc2ccccc2)cc1	BroadT	BRD-K88527653	BRD-K88527653-001-05-1	ChemBridge Corporation	6686719			Brc1ccc(NC(=S)NCCc2ccccc2)cc1	InChI=1S/C15H15BrN2S/c16-13-6-8-14(9-7-13)18-15(19)17-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H2,17,18,19)	YZSQKACOUOYKMQ-UHFFFAOYSA-N	334.01393179							115562
SMR000041096	LSM-27020	BRD-K55638368, SID858815	660123	InChI=1S/C22H26N6O2/c1-15(2)13-28-20-18(19-21(28)25-17-6-4-3-5-16(17)24-19)22(29)27(14-23-20)8-7-26-9-11-30-12-10-26/h3-6,14-15H,7-13H2,1-2H3	UZEDOLZGHXNXQZ-UHFFFAOYSA-N	CC(C)Cn1c2N=CN(CCN3CCOCC3)C(=O)c2c4nc5ccccc5nc14	BroadT	BRD-K55638368	BRD-K55638368-001-05-1	InterBioScreen Ltd.	STOCK2S-74068			CC(C)Cn1c2ncn(CCN3CCOCC3)c(=O)c2c2nc3ccccc3nc12	InChI=1S/C22H26N6O2/c1-15(2)13-28-20-18(19-21(28)25-17-6-4-3-5-16(17)24-19)22(29)27(14-23-20)8-7-26-9-11-30-12-10-26/h3-6,14-15H,7-13H2,1-2H3	UZEDOLZGHXNXQZ-UHFFFAOYSA-N	406.211724132							115563
SMR000220354	LSM-27021	BRD-K52552873, SID17505783	938851	InChI=1S/C16H13NO3S/c1-10-4-5-13-11(7-10)8-12(15(18)17-13)9-20-16(19)14-3-2-6-21-14/h2-8H,9H2,1H3,(H,17,18)	MKZQTGYFCIZIKT-UHFFFAOYSA-N	Cc1ccc2nc(O)c(COC(=O)c3cccs3)cc2c1	BroadT	BRD-K52552873	BRD-K52552873-001-05-5	InterBioScreen Ltd.	STOCK4S-34157			Cc1ccc2nc(O)c(COC(=O)c3cccs3)cc2c1	InChI=1S/C16H13NO3S/c1-10-4-5-13-11(7-10)8-12(15(18)17-13)9-20-16(19)14-3-2-6-21-14/h2-8H,9H2,1H3,(H,17,18)	MKZQTGYFCIZIKT-UHFFFAOYSA-N	299.061613976							115564
MLS000118915	LSM-27022	BRD-K42123500, SID7968683	5309544	InChI=1S/C15H14FN5/c16-12-5-3-11(4-6-12)15-18-17-13-7-8-14(19-21(13)15)20-9-1-2-10-20/h3-8H,1-2,9-10H2	IKGYBPKBZSTEQA-UHFFFAOYSA-N	Fc1ccc(cc1)c2nnc3ccc(nn23)N4CCCC4	BroadT	BRD-K42123500	BRD-K42123500-001-06-7	ChemDiv Inc.	C713-0135			Fc1ccc(cc1)-c1nnc2ccc(nn12)N1CCCC1	InChI=1S/C15H14FN5/c16-12-5-3-11(4-6-12)15-18-17-13-7-8-14(19-21(13)15)20-9-1-2-10-20/h3-8H,1-2,9-10H2	IKGYBPKBZSTEQA-UHFFFAOYSA-N	283.123323698							115565
MLS000672399	LSM-27023	BRD-K47599758, SID24796034	1178958	InChI=1S/C19H11NO5/c21-16-13-6-1-2-7-14(13)24-17(15-8-4-10-23-15)18(16)25-19(22)12-5-3-9-20-11-12/h1-11H	JFTJURXXWDEBAZ-UHFFFAOYSA-N	O=C(OC1=C(Oc2ccccc2C1=O)c3occc3)c4cccnc4	BroadT	BRD-K47599758	BRD-K47599758-001-05-4	ChemBridge Corporation	7950783			O=C(Oc1c(oc2ccccc2c1=O)-c1ccco1)c1cccnc1	InChI=1S/C19H11NO5/c21-16-13-6-1-2-7-14(13)24-17(15-8-4-10-23-15)18(16)25-19(22)12-5-3-9-20-11-12/h1-11H	JFTJURXXWDEBAZ-UHFFFAOYSA-N	333.063722462							115566
11B-083	LSM-27024	BRD-K48221699	6762659	InChI=1S/C17H12F3N3O/c18-17(19,20)12-6-8-13(9-7-12)21-10-14-15(22-23-16(14)24)11-4-2-1-3-5-11/h1-10H,(H2,22,23,24)	XQAIXLLSPGQYNJ-UHFFFAOYSA-N	Oc1[nH]nc(c1C=Nc2ccc(cc2)C(F)(F)F)c3ccccc3	BroadT	BRD-K48221699	BRD-K48221699-001-05-6	Key Organics Ltd.	11B-083			Oc1[nH]nc(c1C=Nc1ccc(cc1)C(F)(F)F)-c1ccccc1	InChI=1S/C17H12F3N3O/c18-17(19,20)12-6-8-13(9-7-12)21-10-14-15(22-23-16(14)24)11-4-2-1-3-5-11/h1-10H,(H2,22,23,24)	XQAIXLLSPGQYNJ-UHFFFAOYSA-N	331.093246634							
MLS000683509	LSM-27025	BRD-A12894472, SID24814844	4226016	InChI=1S/C21H27N3OS/c1-15-5-4-6-16(2)20(15)23-21(26)22-13-17-11-12-24(14-17)18-7-9-19(25-3)10-8-18/h4-10,17H,11-14H2,1-3H3,(H2,22,23,26)	ANXQJSVQYXQAAT-UHFFFAOYSA-N	COc1ccc(cc1)N2CCC(CN=C(S)Nc3c(C)cccc3C)C2	BroadT	BRD-A12894472	BRD-A12894472-001-06-5	ChemDiv Inc.	K788-1216			COc1ccc(cc1)N1CCC(CN=C(S)Nc2c(C)cccc2C)C1	InChI=1S/C21H27N3OS/c1-15-5-4-6-16(2)20(15)23-21(26)22-13-17-11-12-24(14-17)18-7-9-19(25-3)10-8-18/h4-10,17H,11-14H2,1-3H3,(H2,22,23,26)	ANXQJSVQYXQAAT-UHFFFAOYSA-N	369.187483204							115568
4-Oxazolo[4,5-b]pyridin-2-yl-phenylamine	LSM-27026	BRD-K80923834, SID49642907	486277	InChI=1S/C12H9N3O/c13-9-5-3-8(4-6-9)12-15-11-10(16-12)2-1-7-14-11/h1-7H,13H2	IQYADSABMIDDAV-UHFFFAOYSA-N	Nc1ccc(cc1)c2oc3cccnc3n2	BroadT	BRD-K80923834	BRD-K80923834-001-05-2	Asinex Ltd.	BAS 00326745			Nc1ccc(cc1)-c1nc2ncccc2o1	InChI=1S/C12H9N3O/c13-9-5-3-8(4-6-9)12-15-11-10(16-12)2-1-7-14-11/h1-7H,13H2	IQYADSABMIDDAV-UHFFFAOYSA-N	211.074561938							115569
AC1MDSI1	LSM-27027	BRD-K73286847	2842192	InChI=1S/C16H14N4O/c1-12-10-15(13-6-3-2-4-7-13)19-16(18-12)20-17-11-14-8-5-9-21-14/h2-11H,1H3,(H,18,19,20)	HJJHAFQKCZPHLI-UHFFFAOYSA-N	Cc1cc(nc(NN=Cc2occc2)n1)c3ccccc3	BroadT	BRD-K73286847	BRD-K73286847-001-05-8	ChemBridge Corporation	5339299			Cc1cc(nc(NN=Cc2ccco2)n1)-c1ccccc1	InChI=1S/C16H14N4O/c1-12-10-15(13-6-3-2-4-7-13)19-16(18-12)20-17-11-14-8-5-9-21-14/h2-11H,1H3,(H,18,19,20)	HJJHAFQKCZPHLI-UHFFFAOYSA-N	278.116761108							115570
MLS000527911	LSM-27028	BRD-K37601439, SID14725995	828535	InChI=1S/C14H10ClN3O2S/c1-21-14-16-12(9-4-6-10(15)7-5-9)17-18(14)13(19)11-3-2-8-20-11/h2-8H,1H3	LPHQKRKEXZBEJK-UHFFFAOYSA-N	CSc1nc(nn1C(=O)c2occc2)c3ccc(Cl)cc3	BroadT	BRD-K37601439	BRD-K37601439-001-06-5	Asinex Ltd.	BAS 06344399			CSc1nc(nn1C(=O)c1ccco1)-c1ccc(Cl)cc1	InChI=1S/C14H10ClN3O2S/c1-21-14-16-12(9-4-6-10(15)7-5-9)17-18(14)13(19)11-3-2-8-20-11/h2-8H,1H3	LPHQKRKEXZBEJK-UHFFFAOYSA-N	319.01822499							115571
AC1LV3ZQ	LSM-15497	BRD-K75360899	1646173	InChI=1S/C19H18ClNO/c1-13(2)12-21-17-11-19(14-6-4-3-5-7-14)22-18-9-8-15(20)10-16(17)18/h3-11,13H,12H2,1-2H3	QAIJLJNVSBGMNY-UHFFFAOYSA-N	CC(C)CN=C1C=C(Oc2ccc(Cl)cc12)c3ccccc3	BroadT	BRD-K75360899	BRD-K75360899-245-05-9	ChemDiv Inc.	6197-5094		F[B-](F)(F)F	CC(C)CN=c1cc(oc2ccc(Cl)cc12)-c1ccccc1.F[B-](F)(F)F	InChI=1S/C19H18ClNO.BF4/c1-13(2)12-21-17-11-19(14-6-4-3-5-7-14)22-18-9-8-15(20)10-16(17)18;2-1(3,4)5/h3-11,13H,12H2,1-2H3;/q;-1	RTMVROJBTKOVDR-UHFFFAOYSA-N	311.107691916							104138, 104138
AP-263/42911341	LSM-27029	BRD-K68733377, SID14733750	2147476	InChI=1S/C12H11FN2O3S/c1-18-11-8-9(5-6-10(11)13)19(16,17)15-12-4-2-3-7-14-12/h2-8H,1H3,(H,14,15)	PJUNJQAGCGMRAS-UHFFFAOYSA-N	COc1cc(ccc1F)S(=O)(=O)Nc2ccccn2	BroadT	BRD-K68733377	BRD-K68733377-001-05-4	ChemBridge Corporation	7985630			COc1cc(ccc1F)S(=O)(=O)Nc1ccccn1	InChI=1S/C12H11FN2O3S/c1-18-11-8-9(5-6-10(11)13)19(16,17)15-12-4-2-3-7-14-12/h2-8H,1H3,(H,14,15)	PJUNJQAGCGMRAS-UHFFFAOYSA-N	282.047441122							115572
T0506-1036	LSM-27030	BRD-K29502299, SID24825958	2344638	InChI=1S/C12H11F2NO3/c13-7-1-4-9(10(14)5-7)12(17)18-6-11(16)15-8-2-3-8/h1,4-5,8H,2-3,6H2,(H,15,16)	YNOIPTRKOYGMCT-UHFFFAOYSA-N	Fc1ccc(C(=O)OCC(=O)NC2CC2)c(F)c1	BroadT	BRD-K29502299	BRD-K29502299-001-05-6	Enamine Ltd.	T0506-1036			Fc1ccc(C(=O)OCC(=O)NC2CC2)c(F)c1	InChI=1S/C12H11F2NO3/c13-7-1-4-9(10(14)5-7)12(17)18-6-11(16)15-8-2-3-8/h1,4-5,8H,2-3,6H2,(H,15,16)	YNOIPTRKOYGMCT-UHFFFAOYSA-N	255.070699622							115573
AC1LHYJK	LSM-27031	BRD-K60255752	846020	InChI=1S/C14H12N4O3S/c1-8-9(2)16-17(13(8)19)14-15-12(7-22-14)10-4-3-5-11(6-10)18(20)21/h3-7,19H,1-2H3	LEJAQCBKHAZCAO-UHFFFAOYSA-N	Cc1nn(c(O)c1C)c2nc(cs2)c3cccc(c3)[N+](=O)[O-]	BroadT	BRD-K60255752	BRD-K60255752-001-05-1	Specs	AG-690/15432699			Cc1nn(c(O)c1C)-c1nc(cs1)-c1cccc(c1)[N+]([O-])=O	InChI=1S/C14H12N4O3S/c1-8-9(2)16-17(13(8)19)14-15-12(7-22-14)10-4-3-5-11(6-10)18(20)21/h3-7,19H,1-2H3	LEJAQCBKHAZCAO-UHFFFAOYSA-N	316.063010974							
AC1MJ1NT	LSM-27032	BRD-K09900382	3129949	InChI=1S/C11H12Cl2N4OS/c1-6(16-17-11(14)19)4-10(18)15-7-2-3-8(12)9(13)5-7/h2-3,5H,4H2,1H3,(H,15,18)(H3,14,17,19)	XCICCEPDNVVCFU-UHFFFAOYSA-N	CC(=NN=C(N)S)CC(=O)Nc1ccc(Cl)c(Cl)c1	BroadT	BRD-K09900382	BRD-K09900382-001-05-4	Asinex Ltd.	BAS 01314417			CC(CC(=O)Nc1ccc(Cl)c(Cl)c1)=NN=C(N)S	InChI=1S/C11H12Cl2N4OS/c1-6(16-17-11(14)19)4-10(18)15-7-2-3-8(12)9(13)5-7/h2-3,5H,4H2,1H3,(H,15,18)(H3,14,17,19)	XCICCEPDNVVCFU-UHFFFAOYSA-N	318.010887154							115575
AC1LFLRP	LSM-27033	BRD-K37507671, SID24792253	805047	InChI=1S/C15H19N3O3S/c16-14(19)11-3-5-18(6-4-11)15(22)17-8-10-1-2-12-13(7-10)21-9-20-12/h1-2,7,11H,3-6,8-9H2,(H2,16,19)(H,17,22)	GZHPZIVORGWFLM-UHFFFAOYSA-N	NC(=O)C1CCN(CC1)C(=NCc2ccc3OCOc3c2)S	BroadT	BRD-K37507671	BRD-K37507671-001-05-3	ChemBridge Corporation	7115450			NC(=O)C1CCN(CC1)C(S)=NCc1ccc2OCOc2c1	InChI=1S/C15H19N3O3S/c16-14(19)11-3-5-18(6-4-11)15(22)17-8-10-1-2-12-13(7-10)21-9-20-12/h1-2,7,11H,3-6,8-9H2,(H2,16,19)(H,17,22)	GZHPZIVORGWFLM-UHFFFAOYSA-N	321.114712188							115576
N-(1,3-Benzodioxol-5-yl)-5-bromopyridine-3-carboxamide	LSM-27034	BRD-K08996393, SID858619	659924	InChI=1S/C13H9BrN2O3/c14-9-3-8(5-15-6-9)13(17)16-10-1-2-11-12(4-10)19-7-18-11/h1-6H,7H2,(H,16,17)	UNFNSXQZQLNUTC-UHFFFAOYSA-N	Brc1cncc(c1)C(=O)Nc2ccc3OCOc3c2	BroadT	BRD-K08996393	BRD-K08996393-001-05-0	InterBioScreen Ltd.	STOCK2S-56768			Brc1cncc(c1)C(=O)Nc1ccc2OCOc2c1	InChI=1S/C13H9BrN2O3/c14-9-3-8(5-15-6-9)13(17)16-10-1-2-11-12(4-10)19-7-18-11/h1-6H,7H2,(H,16,17)	UNFNSXQZQLNUTC-UHFFFAOYSA-N	319.979654768							115577
AC1M2MWN	LSM-15397	BRD-K21879622	2120077	InChI=1S/C12H17N3S/c1-4-5-15-8(2)6-10(9(15)3)11-7-16-12(13)14-11/h6-7H,4-5H2,1-3H3,(H2,13,14)	ANNYAOZIWXFBSS-UHFFFAOYSA-N	CCCn1c(C)cc(c1C)c2csc(N)n2	BroadT	BRD-K21879622	BRD-K21879622-003-05-0	Enamine Ltd.	T5247555		Cl	CCCn1c(C)cc(-c2csc(N)n2)c1C.Cl	InChI=1S/C12H17N3S.ClH/c1-4-5-15-8(2)6-10(9(15)3)11-7-16-12(13)14-11;/h6-7H,4-5H2,1-3H3,(H2,13,14);1H	ZOLBKOGTMIRWAV-UHFFFAOYSA-N	235.114318264							104039, 104039
BRD-A33596659	LSM-44194		12005666	InChI=1S/C20H22BrN3OS/c1-19(2)13-7-8-20(19,3)16(11-13)23-24-18-22-17(25)15(26-18)10-12-5-4-6-14(21)9-12/h4-6,9-10,13H,7-8,11H2,1-3H3,(H,22,24,25)/b15-10+,23-16?	XGBYPXJUPDRINW-YXCGMMHFSA-N	CC1(C)C2CCC1(C)C(=NNC3=NC(=O)\C(=C/c4cccc(Br)c4)\S3)C2	BroadT	BRD-A33596659	BRD-A33596659-001-07-4	InterBioScreen Ltd.	STOCK2S-26569			CC1(C)C2CCC1(C)C(C2)=NNC1=NC(=O)\C(S1)=C/c1cccc(Br)c1	InChI=1S/C20H22BrN3OS/c1-19(2)13-7-8-20(19,3)16(11-13)23-24-18-22-17(25)15(26-18)10-12-5-4-6-14(21)9-12/h4-6,9-10,13H,7-8,11H2,1-3H3,(H,22,24,25)/b15-10+,23-16?	XGBYPXJUPDRINW-YXCGMMHFSA-N	431.066695644							
MLS000078218	LSM-44195	BRD-K79678951, SID858284	5389151	InChI=1S/C22H24N4O3/c1-4-25(5-2)17-12-10-16(11-13-17)23-14-18-20(27)24-22(29)26(21(18)28)19-9-7-6-8-15(19)3/h6-14,23H,4-5H2,1-3H3,(H,24,27,29)/b18-14-	YFRDTLCUPHRUGB-JXAWBTAJSA-N	CCN(CC)c1ccc(N\C=C/2\C(=O)NC(=O)N(C2=O)c3ccccc3C)cc1	BroadT	BRD-K79678951	BRD-K79678951-001-07-8	InterBioScreen Ltd.	STOCK2S-33467			CCN(CC)c1ccc(N\C=C2\C(=O)NC(=O)N(C2=O)c2ccccc2C)cc1	InChI=1S/C22H24N4O3/c1-4-25(5-2)17-12-10-16(11-13-17)23-14-18-20(27)24-22(29)26(21(18)28)19-9-7-6-8-15(19)3/h6-14,23H,4-5H2,1-3H3,(H,24,27,29)/b18-14-	YFRDTLCUPHRUGB-JXAWBTAJSA-N	392.184840668							
MLS000391393	LSM-27037	BRD-K58955712, SID22410226	2383159	InChI=1S/C19H19N3O4S/c1-4-25-19(24)16-11(2)12(3)27-18(16)22-15(23)9-26-17-13-7-5-6-8-14(13)20-10-21-17/h5-8,10H,4,9H2,1-3H3,(H,22,23)	UYALLXWKEKJHQP-UHFFFAOYSA-N	CCOC(=O)c1c(C)c(C)sc1NC(=O)COc2ncnc3ccccc23	BroadT	BRD-K58955712	BRD-K58955712-001-05-9	Enamine Ltd.	T0511-5630			CCOC(=O)c1c(NC(=O)COc2ncnc3ccccc23)sc(C)c1C	InChI=1S/C19H19N3O4S/c1-4-25-19(24)16-11(2)12(3)27-18(16)22-15(23)9-26-17-13-7-5-6-8-14(13)20-10-21-17/h5-8,10H,4,9H2,1-3H3,(H,22,23)	UYALLXWKEKJHQP-UHFFFAOYSA-N	385.109626808							115580
AC1O99TB	LSM-27038	BRD-K23393260	6752562	InChI=1S/C20H18N2O3S/c1-24-14-6-4-13-5-8-18-19(15(13)10-14)22-20(26-18)21-11-12-3-7-16(23)17(9-12)25-2/h3-4,6-7,9-11,23H,5,8H2,1-2H3	UJQZNKYKJTWKJX-UHFFFAOYSA-N	COc1ccc2CCc3sc(N=Cc4ccc(O)c(OC)c4)nc3c2c1	BroadT	BRD-K23393260	BRD-K23393260-001-04-4	Asinex Ltd.	BAS 01969121			COc1ccc2CCc3sc(N=Cc4ccc(O)c(OC)c4)nc3-c2c1	InChI=1S/C20H18N2O3S/c1-24-14-6-4-13-5-8-18-19(15(13)10-14)22-20(26-18)21-11-12-3-7-16(23)17(9-12)25-2/h3-4,6-7,9-11,23H,5,8H2,1-2H3	UJQZNKYKJTWKJX-UHFFFAOYSA-N	366.103813146							
STK021643	LSM-27039	2-Methyl-4-4-(Phenylsulfonyl)Piperazinoquinoline, SID7978355	1164592	InChI=1S/C20H21N3O2S/c1-16-15-20(18-9-5-6-10-19(18)21-16)22-11-13-23(14-12-22)26(24,25)17-7-3-2-4-8-17/h2-10,15H,11-14H2,1H3	RXONUPQQCYQNPN-UHFFFAOYSA-N	Cc1cc(N2CCN(CC2)S(=O)(=O)c3ccccc3)c4ccccc4n1	BroadT	BRD-K08219814	BRD-K08219814-001-05-8	ChemBridge Corporation	6833907			Cc1cc(N2CCN(CC2)S(=O)(=O)c2ccccc2)c2ccccc2n1	InChI=1S/C20H21N3O2S/c1-16-15-20(18-9-5-6-10-19(18)21-16)22-11-13-23(14-12-22)26(24,25)17-7-3-2-4-8-17/h2-10,15H,11-14H2,1H3	RXONUPQQCYQNPN-UHFFFAOYSA-N	367.135447632							115582
ST50871994	LSM-27040	BRD-K75252192, SID4265335	1247116	InChI=1S/C13H14N2O2S/c1-8-12(9(2)17-15-8)13(16)14-10-6-4-5-7-11(10)18-3/h4-7H,1-3H3,(H,14,16)	MZTXHSDLDYVFIW-UHFFFAOYSA-N	CSc1ccccc1NC(=O)c2c(C)onc2C	BroadT	BRD-K75252192	BRD-K75252192-001-05-9	ChemBridge Corporation	7948432			CSc1ccccc1NC(=O)c1c(C)noc1C	InChI=1S/C13H14N2O2S/c1-8-12(9(2)17-15-8)13(16)14-10-6-4-5-7-11(10)18-3/h4-7H,1-3H3,(H,14,16)	MZTXHSDLDYVFIW-UHFFFAOYSA-N	262.077598398							115583
AP-970/42784265	LSM-15398	BRD-K46121327	2982073	InChI=1S/C22H23ClN2O3S/c23-20-8-11-22(28-16-18-4-2-1-3-5-18)19(14-20)15-25-13-12-17-6-9-21(10-7-17)29(24,26)27/h1-11,14,25H,12-13,15-16H2,(H2,24,26,27)	JOFPPGQIKAPUQO-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(CCNCc2cc(Cl)ccc2OCc3ccccc3)cc1	BroadT	BRD-K46121327	BRD-K46121327-003-05-6	Specs	AP-970/42784265		Cl	NS(=O)(=O)c1ccc(CCNCc2cc(Cl)ccc2OCc2ccccc2)cc1.Cl	InChI=1S/C22H23ClN2O3S.ClH/c23-20-8-11-22(28-16-18-4-2-1-3-5-18)19(14-20)15-25-13-12-17-6-9-21(10-7-17)29(24,26)27;/h1-11,14,25H,12-13,15-16H2,(H2,24,26,27);1H	DDZHRGKWJVRLDB-UHFFFAOYSA-N	430.111791016							104040, 104040
MLS000101088	LSM-27041	BRD-K32699895, SID7970621	4075942	InChI=1S/C20H21ClN6O4S/c1-2-31-20(30)26-9-7-25(8-10-26)16(28)12-32-19-23-17-15(18(29)24-19)11-22-27(17)14-5-3-13(21)4-6-14/h3-6,11H,2,7-10,12H2,1H3,(H,23,24,29)	RMWHYSKNRURCFY-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)CSc2nc(O)c3cnn(c4ccc(Cl)cc4)c3n2	BroadT	BRD-K32699895	BRD-K32699895-001-05-3	Life Chemicals Inc.	F0568-0137			CCOC(=O)N1CCN(CC1)C(=O)CSc1nc(O)c2cnn(-c3ccc(Cl)cc3)c2n1	InChI=1S/C20H21ClN6O4S/c1-2-31-20(30)26-9-7-25(8-10-26)16(28)12-32-19-23-17-15(18(29)24-19)11-22-27(17)14-5-3-13(21)4-6-14/h3-6,11H,2,7-10,12H2,1H3,(H,23,24,29)	RMWHYSKNRURCFY-UHFFFAOYSA-N	476.103351612							
MLS001123429	LSM-27042	BRD-K58382884, SID49735044	22551996	InChI=1S/C14H16N2O4S/c1-20-14(17)13-9-12(10-15-13)21(18,19)16-8-7-11-5-3-2-4-6-11/h2-6,9-10,15-16H,7-8H2,1H3	BEYQYDJJYFDALV-UHFFFAOYSA-N	COC(=O)c1cc(c[nH]1)S(=O)(=O)NCCc2ccccc2	BroadT	BRD-K58382884	BRD-K58382884-001-05-8	ChemDiv Inc.	E511-3778			COC(=O)c1cc(c[nH]1)S(=O)(=O)NCCc1ccccc1	InChI=1S/C14H16N2O4S/c1-20-14(17)13-9-12(10-15-13)21(18,19)16-8-7-11-5-3-2-4-6-11/h2-6,9-10,15-16H,7-8H2,1H3	BEYQYDJJYFDALV-UHFFFAOYSA-N	308.083077702							115585
SMR000033119	LSM-27043	BRD-A04618830, SID4251714	3245367	InChI=1S/C19H23ClN6O2S/c1-4-14(18(27)22-8-9-28-3)29-19-23-17-15(11(2)24-25-17)16(21)26(19)13-7-5-6-12(20)10-13/h5-7,10,14H,4,8-9,21H2,1-3H3,(H,22,27)	LXNUZWHEMOKYNJ-UHFFFAOYSA-N	CCC(Sc1nc2nnc(C)c2c(N)n1c3cccc(Cl)c3)C(=O)NCCOC	BroadT	BRD-A04618830	BRD-A04618830-001-05-7	ChemDiv Inc.	K898-1227			CCC(Sc1nc2nnc(C)c2c(N)n1-c1cccc(Cl)c1)C(=O)NCCOC	InChI=1S/C19H23ClN6O2S/c1-4-14(18(27)22-8-9-28-3)29-19-23-17-15(11(2)24-25-17)16(21)26(19)13-7-5-6-12(20)10-13/h5-7,10,14H,4,8-9,21H2,1-3H3,(H,22,27)	LXNUZWHEMOKYNJ-UHFFFAOYSA-N	434.129172436							115586
T5395013	LSM-27044	BRD-K67458784, SID3717412	2608648	InChI=1S/C17H15N5OS2/c1-11-7-8-14(23-2)13(9-11)22-17(19-20-21-22)24-10-16-18-12-5-3-4-6-15(12)25-16/h3-9H,10H2,1-2H3	GGOXXPDZGAXDBB-UHFFFAOYSA-N	COc1ccc(C)cc1n2nnnc2SCc3nc4ccccc4s3	BroadT	BRD-K67458784	BRD-K67458784-001-05-6	Enamine Ltd.	ZT-1272951			COc1ccc(C)cc1-n1nnnc1SCc1nc2ccccc2s1	InChI=1S/C17H15N5OS2/c1-11-7-8-14(23-2)13(9-11)22-17(19-20-21-22)24-10-16-18-12-5-3-4-6-15(12)25-16/h3-9H,10H2,1-2H3	GGOXXPDZGAXDBB-UHFFFAOYSA-N	369.07180153							115587
MLS000520591	LSM-27045	BRD-K82019575, SID14735692	9550813	InChI=1S/C20H14N4O2/c1-12-6-7-15(9-13(12)2)24-18-16(10-14(11-21)19(24)25)20(26)23-8-4-3-5-17(23)22-18/h3-10H,1-2H3	KMGKYDMQPCVWOS-UHFFFAOYSA-N	Cc1ccc(cc1C)N2C(=O)C(=CC3=C2N=C4C=CC=CN4C3=O)C#N	BroadT	BRD-K82019575	BRD-K82019575-001-07-6	ChemDiv Inc.	D021-0215			Cc1ccc(cc1C)-n1c2nc3ccccn3c(=O)c2cc(C#N)c1=O	InChI=1S/C20H14N4O2/c1-12-6-7-15(9-13(12)2)24-18-16(10-14(11-21)19(24)25)20(26)23-8-4-3-5-17(23)22-18/h3-10H,1-2H3	KMGKYDMQPCVWOS-UHFFFAOYSA-N	342.111675728							115588
ST50057481	LSM-27046	BRD-K93472147	1095086	InChI=1S/C15H11BrN4S/c16-13-8-4-5-11(9-13)10-17-20-14(18-19-15(20)21)12-6-2-1-3-7-12/h1-10H,(H,19,21)	GESPWZBVNAYMDX-UHFFFAOYSA-N	Sc1nnc(c2ccccc2)n1N=Cc3cccc(Br)c3	BroadT	BRD-K93472147	BRD-K93472147-001-05-7	Asinex Ltd.	BAS 00330528			Sc1nnc(-c2ccccc2)n1N=Cc1cccc(Br)c1	InChI=1S/C15H11BrN4S/c16-13-8-4-5-11(9-13)10-17-20-14(18-19-15(20)21)12-6-2-1-3-7-12/h1-10H,(H,19,21)	GESPWZBVNAYMDX-UHFFFAOYSA-N	357.988779682							115589
SMR000131328	LSM-27047	SID14732250, BRD-K47366416	3586856	InChI=1S/C17H14ClN3O3/c18-12-2-3-14-13(9-12)17(23)21-10-11(1-4-15(21)19-14)16(22)20-5-7-24-8-6-20/h1-4,9-10H,5-8H2	VIURMXCKGJBPOY-UHFFFAOYSA-N	Clc1ccc2N=C3C=CC(=CN3C(=O)c2c1)C(=O)N4CCOCC4	BroadT	BRD-K47366416	BRD-K47366416-001-05-2	ChemDiv Inc.	K308-0110			Clc1ccc2nc3ccc(cn3c(=O)c2c1)C(=O)N1CCOCC1	InChI=1S/C17H14ClN3O3/c18-12-2-3-14-13(9-12)17(23)21-10-11(1-4-15(21)19-14)16(22)20-5-7-24-8-6-20/h1-4,9-10H,5-8H2	VIURMXCKGJBPOY-UHFFFAOYSA-N	343.072369048							115590
AC1MDHI9	LSM-27048	BRD-K06926365	2789665	InChI=1S/C13H15N5O3/c1-8-12(15-13(19)18-16-8)17-14-7-9-4-5-10(20-2)11(6-9)21-3/h4-7H,1-3H3,(H2,15,17,18,19)	RDUHDVYPHAQPMC-UHFFFAOYSA-N	COc1ccc(C=NNc2nc(O)nnc2C)cc1OC	BroadT	BRD-K06926365	BRD-K06926365-001-05-3	InterBioScreen Ltd.	STOCK2S-57936			COc1ccc(C=NNc2nc(O)nnc2C)cc1OC	InChI=1S/C13H15N5O3/c1-8-12(15-13(19)18-16-8)17-14-7-9-4-5-10(20-2)11(6-9)21-3/h4-7H,1-3H3,(H2,15,17,18,19)	RDUHDVYPHAQPMC-UHFFFAOYSA-N	289.11748939							115591
3-Ethyl-5-(4-isobutoxy-benzylsulfanyl)-4H-[1,2,4]triazole	LSM-27049	BRD-K01083922, SID49644082	799707	InChI=1S/C15H21N3OS/c1-4-14-16-15(18-17-14)20-10-12-5-7-13(8-6-12)19-9-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,16,17,18)	NRIBYXIOCGUVEW-UHFFFAOYSA-N	CCc1n[nH]c(SCc2ccc(OCC(C)C)cc2)n1	BroadT	BRD-K01083922	BRD-K01083922-001-06-2	Asinex Ltd.	BAS 00609189			CCc1n[nH]c(SCc2ccc(OCC(C)C)cc2)n1	InChI=1S/C15H21N3OS/c1-4-14-16-15(18-17-14)20-10-12-5-7-13(8-6-12)19-9-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,16,17,18)	NRIBYXIOCGUVEW-UHFFFAOYSA-N	291.140533012							115592
GNF-PF-435	LSM-27050	BRD-K94469522, GNF-PF-435	5307851	InChI=1S/C20H20N2O5/c1-25-8-7-22-12-13-3-2-4-15(18(13)20(22)24)19(23)21-14-5-6-16-17(11-14)27-10-9-26-16/h2-6,11H,7-10,12H2,1H3,(H,21,23)	HAVBXXSEEKCGAT-UHFFFAOYSA-N	COCCN1Cc2cccc(C(=O)Nc3ccc4OCCOc4c3)c2C1=O	BroadT	BRD-K94469522	BRD-K94469522-001-05-7	ChemDiv Inc.	C447-0866			COCCN1Cc2cccc(C(=O)Nc3ccc4OCCOc4c3)c2C1=O	InChI=1S/C20H20N2O5/c1-25-8-7-22-12-13-3-2-4-15(18(13)20(22)24)19(23)21-14-5-6-16-17(11-14)27-10-9-26-16/h2-6,11H,7-10,12H2,1H3,(H,21,23)	HAVBXXSEEKCGAT-UHFFFAOYSA-N	368.13722176							115593
ST071229	LSM-27051	BRD-A67697194	657572	InChI=1S/C16H16N4O3/c1-21-8-12-14-13(9-3-5-10(22-2)6-4-9)11(7-17)15(18)23-16(14)20-19-12/h3-6,11,13,18H,8H2,1-2H3,(H,19,20)	XXOPYIJJTJEQSO-UHFFFAOYSA-N	COCc1[nH]nc2OC(=N)C(C#N)C(c12)c1ccc(OC)cc1	BroadT	BRD-A67697194	BRD-A67697194-001-06-3	InterBioScreen Ltd.	STOCK1S-05440			COCc1n[nH]c2OC(N)=C(C#N)C(c12)c1ccc(OC)cc1	InChI=1S/C16H16N4O3/c1-21-8-12-14-13(9-3-5-10(22-2)6-4-9)11(7-17)15(18)23-16(14)20-19-12/h3-6,13H,8,18H2,1-2H3,(H,19,20)	PRHUPQFGFQHUJY-UHFFFAOYSA-N	312.122240412							
5-(3,4-Dimethoxyphenyl)-1H-tetrazole	LSM-27052	SID14731892, BRD-K71566411	601291	InChI=1S/C9H10N4O2/c1-14-7-4-3-6(5-8(7)15-2)9-10-12-13-11-9/h3-5H,1-2H3,(H,10,11,12,13)	WMRZMZRQOCOXLD-UHFFFAOYSA-N	COc1ccc(cc1OC)c2nn[nH]n2	BroadT	BRD-K71566411	BRD-K71566411-001-05-1	ChemBridge Corporation	6569283			COc1ccc(cc1OC)-c1nn[nH]n1	InChI=1S/C9H10N4O2/c1-14-7-4-3-6(5-8(7)15-2)9-10-12-13-11-9/h3-5H,1-2H3,(H,10,11,12,13)	WMRZMZRQOCOXLD-UHFFFAOYSA-N	206.0803756							115595
SMR000145094	LSM-27053	BRD-A52794651, SID14742099	3486379	InChI=1S/C28H26N4O4S/c1-36-21-14-12-19(13-15-21)28-22(18-31(30-28)20-7-3-2-4-8-20)24-17-23(25-9-6-16-37-25)29-32(24)26(33)10-5-11-27(34)35/h2-4,6-9,12-16,18,24H,5,10-11,17H2,1H3,(H,34,35)	BLGRDCIMLYXWFQ-UHFFFAOYSA-N	COc1ccc(cc1)c2nn(cc2C3CC(=NN3C(=O)CCCC(=O)O)c4cccs4)c5ccccc5	BroadT	BRD-A52794651	BRD-A52794651-001-05-3	InterBioScreen Ltd.	STOCK2S-63968			COc1ccc(cc1)-c1nn(cc1C1CC(=NN1C(=O)CCCC(O)=O)c1cccs1)-c1ccccc1	InChI=1S/C28H26N4O4S/c1-36-21-14-12-19(13-15-21)28-22(18-31(30-28)20-7-3-2-4-8-20)24-17-23(25-9-6-16-37-25)29-32(24)26(33)10-5-11-27(34)35/h2-4,6-9,12-16,18,24H,5,10-11,17H2,1H3,(H,34,35)	BLGRDCIMLYXWFQ-UHFFFAOYSA-N	514.167476042							115596
MLS000103257	LSM-27054	BRD-K71836501, SID7971072	5310374	InChI=1S/C12H16N2O2S/c13-10(15)9-6-7-17-12(9)14-11(16)8-4-2-1-3-5-8/h6-8H,1-5H2,(H2,13,15)(H,14,16)	QOPUTUZZAFIRJE-UHFFFAOYSA-N	NC(=O)c1ccsc1NC(=O)C2CCCCC2	BroadT	BRD-K71836501	BRD-K71836501-001-06-7	Life Chemicals Inc.	F1358-0303			NC(=O)c1ccsc1NC(=O)C1CCCCC1	InChI=1S/C12H16N2O2S/c13-10(15)9-6-7-17-12(9)14-11(16)8-4-2-1-3-5-8/h6-8H,1-5H2,(H2,13,15)(H,14,16)	QOPUTUZZAFIRJE-UHFFFAOYSA-N	252.093248462							115597
SMR000023953	LSM-27055	BRD-K90049800, SID4244606	3239181	InChI=1S/C21H16ClN3O3/c1-2-27-18-9-8-13(12-16(18)22)19(26)24-15-6-3-5-14(11-15)20-25-17-7-4-10-23-21(17)28-20/h3-12H,2H2,1H3,(H,24,26)	KNRQWYZQUVVSRF-UHFFFAOYSA-N	CCOc1ccc(cc1Cl)C(=O)Nc2cccc(c2)c3oc4ncccc4n3	BroadT	BRD-K90049800	BRD-K90049800-001-05-4	ChemDiv Inc.	2364-0303			CCOc1ccc(cc1Cl)C(=O)Nc1cccc(c1)-c1nc2cccnc2o1	InChI=1S/C21H16ClN3O3/c1-2-27-18-9-8-13(12-16(18)22)19(26)24-15-6-3-5-14(11-15)20-25-17-7-4-10-23-21(17)28-20/h3-12H,2H2,1H3,(H,24,26)	KNRQWYZQUVVSRF-UHFFFAOYSA-N	393.088019112							115598
AC1OA50D	LSM-27056	BRD-K93537437	6747954	InChI=1S/C12H12N6O5/c1-23-10-3-9(18(21)22)2-8(12(10)20)4-14-16-11(19)5-17-7-13-6-15-17/h2-4,6-7,20H,5H2,1H3,(H,16,19)	LTLSMCTUUZSNMM-UHFFFAOYSA-N	COc1cc(cc(C=NNC(=O)Cn2cncn2)c1O)[N+](=O)[O-]	BroadT	BRD-K93537437	BRD-K93537437-001-05-6	InterBioScreen Ltd.	STOCK2S-76825			COc1cc(cc(C=NNC(=O)Cn2cncn2)c1O)[N+]([O-])=O	InChI=1S/C12H12N6O5/c1-23-10-3-9(18(21)22)2-8(12(10)20)4-14-16-11(19)5-17-7-13-6-15-17/h2-4,6-7,20H,5H2,1H3,(H,16,19)	LTLSMCTUUZSNMM-UHFFFAOYSA-N	320.086917544							
T5320409	LSM-27057	SID16953625, BRD-K76515685	2465824	InChI=1S/C14H14N2O2S/c1-10(17)16-12-6-4-11(5-7-12)14(19)15-9-13-3-2-8-18-13/h2-8H,9H2,1H3,(H,15,19)(H,16,17)	VRLBEDQEHFAPQY-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)C(=NCc2occc2)S	BroadT	BRD-K76515685	BRD-K76515685-001-05-2	Enamine Ltd.	T5320409			CC(=O)Nc1ccc(cc1)C(S)=NCc1ccco1	InChI=1S/C14H14N2O2S/c1-10(17)16-12-6-4-11(5-7-12)14(19)15-9-13-3-2-8-18-13/h2-8H,9H2,1H3,(H,15,19)(H,16,17)	VRLBEDQEHFAPQY-UHFFFAOYSA-N	274.077598398							115600
BRD-A01759464	LSM-27058	BRD-A01759464		InChI=1S/C16H9FO3/c17-12-8-4-3-7-11(12)13-14(18)9-5-1-2-6-10(9)15(19)16(13)20/h1-8,13H	HVXBBVFPABFKBP-UHFFFAOYSA-N	Fc1ccccc1C2C(=O)C(=O)c3ccccc3C2=O	BroadT	BRD-A01759464	BRD-A01759464-001-11-3	InterBioScreen Ltd.	STOCK1S-13398			Fc1ccccc1C1C(=O)C(=O)c2ccccc2C1=O	InChI=1S/C16H9FO3/c17-12-8-4-3-7-11(12)13-14(18)9-5-1-2-6-10(9)15(19)16(13)20/h1-8,13H	HVXBBVFPABFKBP-UHFFFAOYSA-N	268.053572348							115601
ST050494	LSM-27059	BRD-A47615980, SID24838955, SID4251139	3244863	InChI=1S/C23H25N3O7/c1-29-17-10-13(11-18(30-2)21(17)33-23(28)26-6-8-31-9-7-26)19-14(12-24)22(25)32-16-5-3-4-15(27)20(16)19/h10-11,19H,3-9,25H2,1-2H3	WIKGFSQXRKPATH-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC(=O)N2CCOCC2)C3C(=C(N)OC4=C3C(=O)CCC4)C#N	BroadT	BRD-A47615980	BRD-A47615980-001-06-8	ChemDiv Inc.	8010-5606			COc1cc(cc(OC)c1OC(=O)N1CCOCC1)C1C(C#N)=C(N)OC2=C1C(=O)CCC2	InChI=1S/C23H25N3O7/c1-29-17-10-13(11-18(30-2)21(17)33-23(28)26-6-8-31-9-7-26)19-14(12-24)22(25)32-16-5-3-4-15(27)20(16)19/h10-11,19H,3-9,25H2,1-2H3	WIKGFSQXRKPATH-UHFFFAOYSA-N	455.16925017							115602
BRD-A43330902	LSM-27060	BRD-A43330902		InChI=1S/C16H15N3O/c1-10-12(8-17)15(11-4-3-7-18-9-11)16-13(19-10)5-2-6-14(16)20/h3-4,7,9,15-16H,2,5-6H2,1H3	FNUYSKGZOHOBNO-UHFFFAOYSA-N	CC1=C(C#N)C(C2C(=O)CCCC2=N1)c3cccnc3	BroadT	BRD-A43330902	BRD-A43330902-001-04-8	Asinex Ltd.	BAS 00633849			CC1=C(C#N)C(C2C(=O)CCCC2=N1)c1cccnc1	InChI=1S/C16H15N3O/c1-10-12(8-17)15(11-4-3-7-18-9-11)16-13(19-10)5-2-6-14(16)20/h3-4,7,9,15-16H,2,5-6H2,1H3	FNUYSKGZOHOBNO-UHFFFAOYSA-N	265.12151213							115603
F1835-0315	LSM-27061	BRD-K34026318, SID7969558	5310005	InChI=1S/C16H13N7O2S/c1-10-7-12(22-25-10)18-14(24)9-26-15-5-4-13-19-20-16(23(13)21-15)11-3-2-6-17-8-11/h2-8H,9H2,1H3,(H,18,22,24)	UEEIVLUBPVJWMV-UHFFFAOYSA-N	Cc1onc(NC(=O)CSc2ccc3nnc(c4cccnc4)n3n2)c1	BroadT	BRD-K34026318	BRD-K34026318-001-04-9	Life Chemicals Inc.	F1835-0315			Cc1cc(NC(=O)CSc2ccc3nnc(-c4cccnc4)n3n2)no1	InChI=1S/C16H13N7O2S/c1-10-7-12(22-25-10)18-14(24)9-26-15-5-4-13-19-20-16(23(13)21-15)11-3-2-6-17-8-11/h2-8H,9H2,1H3,(H,18,22,24)	UEEIVLUBPVJWMV-UHFFFAOYSA-N	367.085143416							115604
AC1MUGQ3	LSM-27062	BRD-A52475911, SID24831312	3640616	InChI=1S/C18H13NO4S/c20-17(23-15-7-8-22-18(15)21)12-10-14(16-6-3-9-24-16)19-13-5-2-1-4-11(12)13/h1-6,9-10,15H,7-8H2	QHHRGGYLVVFJCP-UHFFFAOYSA-N	O=C(OC1CCOC1=O)c2cc(nc3ccccc23)c4cccs4	BroadT	BRD-A52475911	BRD-A52475911-001-05-5	Enamine Ltd.	T5277332			O=C(OC1CCOC1=O)c1cc(nc2ccccc12)-c1cccs1	InChI=1S/C18H13NO4S/c20-17(23-15-7-8-22-18(15)21)12-10-14(16-6-3-9-24-16)19-13-5-2-1-4-11(12)13/h1-6,9-10,15H,7-8H2	QHHRGGYLVVFJCP-UHFFFAOYSA-N	339.056528596							115605
ST033793	LSM-27063	BRD-K87034416, SID14731049	1521631	InChI=1S/C25H23N3O2S/c29-23(26-15-14-16-8-2-1-3-9-16)21-18-11-5-7-13-20(18)31-25(21)28-22-17-10-4-6-12-19(17)27-24(22)30/h1-4,6,8-10,12H,5,7,11,13-15H2,(H,26,29)(H,27,28,30)	WKVSORVFMULQOF-UHFFFAOYSA-N	O=C(NCCc1ccccc1)c2c3CCCCc3sc2N=C4C(=O)Nc5ccccc45	BroadT	BRD-K87034416	BRD-K87034416-001-05-7	ChemDiv Inc.	8012-4407			O=C(NCCc1ccccc1)c1c(N=C2C(=O)Nc3ccccc23)sc2CCCCc12	InChI=1S/C25H23N3O2S/c29-23(26-15-14-16-8-2-1-3-9-16)21-18-11-5-7-13-20(18)31-25(21)28-22-17-10-4-6-12-19(17)27-24(22)30/h1-4,6,8-10,12H,5,7,11,13-15H2,(H,26,29)(H,27,28,30)	WKVSORVFMULQOF-UHFFFAOYSA-N	429.151097696							115606
AC1MPZ3E	LSM-27064	BRD-K73149920	3418737	InChI=1S/C22H30N4O4/c1-22(2,3)30-21(28)23-13-7-5-6-8-20(27)26-24-15-17-10-9-16-14-18(29-4)11-12-19(16)25-17/h9-12,14-15H,5-8,13H2,1-4H3,(H,23,28)(H,26,27)	OVZQPDCTBLERMQ-UHFFFAOYSA-N	COc1ccc2nc(C=NNC(=O)CCCCCNC(=O)OC(C)(C)C)ccc2c1	BroadT	BRD-K73149920	BRD-K73149920-001-05-8	InterBioScreen Ltd.	STOCK4S-18979			COc1ccc2nc(C=NNC(=O)CCCCCNC(=O)OC(C)(C)C)ccc2c1	InChI=1S/C22H30N4O4/c1-22(2,3)30-21(28)23-13-7-5-6-8-20(27)26-24-15-17-10-9-16-14-18(29-4)11-12-19(16)25-17/h9-12,14-15H,5-8,13H2,1-4H3,(H,23,28)(H,26,27)	OVZQPDCTBLERMQ-UHFFFAOYSA-N	414.22670548							115607
361390-39-8	LSM-27065	BRD-K43782839, SID24818760	1482857	InChI=1S/C17H15N3O2/c1-2-22-17(21)12-7-9-13(10-8-12)19-16-11-18-14-5-3-4-6-15(14)20-16/h3-11H,2H2,1H3,(H,19,20)	ZCLXAFUZIXNJHF-UHFFFAOYSA-N	CCOC(=O)c1ccc(Nc2cnc3ccccc3n2)cc1	BroadT	BRD-K43782839	BRD-K43782839-001-05-3	Key Organics Ltd.	10T-0022			CCOC(=O)c1ccc(Nc2cnc3ccccc3n2)cc1	InChI=1S/C17H15N3O2/c1-2-22-17(21)12-7-9-13(10-8-12)19-16-11-18-14-5-3-4-6-15(14)20-16/h3-11H,2H2,1H3,(H,19,20)	ZCLXAFUZIXNJHF-UHFFFAOYSA-N	293.11642675							115608
N-(4-Nitrophenyl)-2-phenoxyacetamide	LSM-27066	SID22415134, BRD-K19731191	309593	InChI=1S/C14H12N2O4/c17-14(10-20-13-4-2-1-3-5-13)15-11-6-8-12(9-7-11)16(18)19/h1-9H,10H2,(H,15,17)	OPPGBYUDMBADNI-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NC(=O)COc2ccccc2)cc1	BroadT	BRD-K19731191	BRD-K19731191-001-05-2	ChemBridge Corporation	7161425			[O-][N+](=O)c1ccc(NC(=O)COc2ccccc2)cc1	InChI=1S/C14H12N2O4/c17-14(10-20-13-4-2-1-3-5-13)15-11-6-8-12(9-7-11)16(18)19/h1-9H,10H2,(H,15,17)	OPPGBYUDMBADNI-UHFFFAOYSA-N	272.079706884							115609
AC1NUB2J	LSM-44196	BRD-K57096799, SID26725612	5423137	InChI=1S/C15H13N3O4S/c19-13-10(14(20)18(9-2-3-9)15(23)17-13)6-16-8-1-4-11-12(5-8)22-7-21-11/h1,4-6,9,16H,2-3,7H2,(H,17,19,23)/b10-6+	JOMMASUXUYHPOR-UXBLZVDNSA-N	O=C1NC(=S)N(C2CC2)C(=O)/C/1=C/Nc3ccc4OCOc4c3	BroadT	BRD-K57096799	BRD-K57096799-001-06-7	InterBioScreen Ltd.	STOCK4S-32174			O=C1NC(=S)N(C2CC2)C(=O)\C1=C\Nc1ccc2OCOc2c1	InChI=1S/C15H13N3O4S/c19-13-10(14(20)18(9-2-3-9)15(23)17-13)6-16-8-1-4-11-12(5-8)22-7-21-11/h1,4-6,9,16H,2-3,7H2,(H,17,19,23)/b10-6+	JOMMASUXUYHPOR-UXBLZVDNSA-N	331.062676616							
91089-11-1	LSM-27068	BRD-K27374902, SID24818846	3780371	InChI=1S/C11H12N4OS/c1-16-8-4-2-7(3-5-8)9-6-17-11(14-9)15-10(12)13/h2-6H,1H3,(H4,12,13,14,15)	LFCQUNMSNZYLTF-UHFFFAOYSA-N	COc1ccc(cc1)c2csc(N=C(N)N)n2	BroadT	BRD-K27374902	BRD-K27374902-001-06-9	Key Organics Ltd.	6T-0803			COc1ccc(cc1)-c1csc(N=C(N)N)n1	InChI=1S/C11H12N4OS/c1-16-8-4-2-7(3-5-8)9-6-17-11(14-9)15-10(12)13/h2-6H,1H3,(H4,12,13,14,15)	LFCQUNMSNZYLTF-UHFFFAOYSA-N	248.073181734							115611, 115611
MLS000081589	LSM-27069	BRD-K13637593, SID861152	662414	InChI=1S/C21H22N2O2S/c1-14-6-8-15(9-7-14)19-22-20(26)17-13-25-21(2,3)11-18(17)23(19)12-16-5-4-10-24-16/h4-10H,11-13H2,1-3H3	JRXGQPDRQYXBSA-UHFFFAOYSA-N	Cc1ccc(cc1)C2=NC(=S)C3=C(CC(C)(C)OC3)N2Cc4occc4	BroadT	BRD-K13637593	BRD-K13637593-001-05-1	InterBioScreen Ltd.	STOCK4S-01197			Cc1ccc(cc1)-c1nc(=S)c2COC(C)(C)Cc2n1Cc1ccco1	InChI=1S/C21H22N2O2S/c1-14-6-8-15(9-7-14)19-22-20(26)17-13-25-21(2,3)11-18(17)23(19)12-16-5-4-10-24-16/h4-10H,11-13H2,1-3H3	JRXGQPDRQYXBSA-UHFFFAOYSA-N	366.140198654							115612
4-Methoxy-n-(8-methyl[1,3]dioxolo[4,5-g]quinazolin-6-yl)benzamide	LSM-27070	BRD-K80359388, SID17505841	1511731	InChI=1S/C18H15N3O4/c1-10-13-7-15-16(25-9-24-15)8-14(13)20-18(19-10)21-17(22)11-3-5-12(23-2)6-4-11/h3-8H,9H2,1-2H3,(H,19,20,21,22)	XAESXNPBEDJXJH-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)Nc2nc(C)c3cc4OCOc4cc3n2	BroadT	BRD-K80359388	BRD-K80359388-001-05-9	InterBioScreen Ltd.	STOCK5S-57502			COc1ccc(cc1)C(=O)Nc1nc(C)c2cc3OCOc3cc2n1	InChI=1S/C18H15N3O4/c1-10-13-7-15-16(25-9-24-15)8-14(13)20-18(19-10)21-17(22)11-3-5-12(23-2)6-4-11/h3-8H,9H2,1-2H3,(H,19,20,21,22)	XAESXNPBEDJXJH-UHFFFAOYSA-N	337.10625599							115613
ASN 05440960	LSM-27071	BRD-A17741195, SID845088	647425	InChI=1S/C27H24N6O3/c1-19-10-12-21(13-11-19)33(25(34)18-32-24-9-3-2-8-23(24)30-31-32)26(20-6-4-14-28-16-20)27(35)29-17-22-7-5-15-36-22/h2-16,26H,17-18H2,1H3,(H,29,35)	VMNJCMKMYUPVQX-UHFFFAOYSA-N	Cc1ccc(cc1)N(C(C(=O)NCc2occc2)c3cccnc3)C(=O)Cn4nnc5ccccc45	BroadT	BRD-A17741195	BRD-A17741195-001-05-1	Asinex Ltd.	ASN 05440960			Cc1ccc(cc1)N(C(C(=O)NCc1ccco1)c1cccnc1)C(=O)Cn1nnc2ccccc12	InChI=1S/C27H24N6O3/c1-19-10-12-21(13-11-19)33(25(34)18-32-24-9-3-2-8-23(24)30-31-32)26(20-6-4-14-28-16-20)27(35)29-17-22-7-5-15-36-22/h2-16,26H,17-18H2,1H3,(H,29,35)	VMNJCMKMYUPVQX-UHFFFAOYSA-N	480.190988688							115614
Ethyl 3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole-5-carboxylate	LSM-27072	BRD-K59507567, SID24785577	4912763	InChI=1S/C13H14N2O5/c1-4-19-13(16)12-14-11(15-20-12)8-5-6-9(17-2)10(7-8)18-3/h5-7H,4H2,1-3H3	UAOQPEANZVBDPV-UHFFFAOYSA-N	CCOC(=O)c1onc(n1)c2ccc(OC)c(OC)c2	BroadT	BRD-K59507567	BRD-K59507567-001-05-3	ChemDiv Inc.	8016-4996			CCOC(=O)c1nc(no1)-c1ccc(OC)c(OC)c1	InChI=1S/C13H14N2O5/c1-4-19-13(16)12-14-11(15-20-12)8-5-6-9(17-2)10(7-8)18-3/h5-7H,4H2,1-3H3	UAOQPEANZVBDPV-UHFFFAOYSA-N	278.090271568							115615
MLS000101103	LSM-27073	BRD-A96007399, SID7971262	4643991	InChI=1S/C16H18N4OS/c1-4-11(3)22-16-18-14-13(15(21)19-16)9-17-20(14)12-7-5-10(2)6-8-12/h5-9,11H,4H2,1-3H3,(H,18,19,21)	XVPBLANCKAPBTR-UHFFFAOYSA-N	CCC(C)Sc1nc(O)c2cnn(c3ccc(C)cc3)c2n1	BroadT	BRD-A96007399	BRD-A96007399-001-04-8	Life Chemicals Inc.	F0568-0208			CCC(C)Sc1nc(O)c2cnn(-c3ccc(C)cc3)c2n1	InChI=1S/C16H18N4OS/c1-4-11(3)22-16-18-14-13(15(21)19-16)9-17-20(14)12-7-5-10(2)6-8-12/h5-9,11H,4H2,1-3H3,(H,18,19,21)	XVPBLANCKAPBTR-UHFFFAOYSA-N	314.120131926							
AQ-390/42708504	LSM-27074	BRD-K83270526, SID24787101	2133840	InChI=1S/C22H18N2O5S/c1-13(25)21-14(2)29-19-10-9-17(12-18(19)21)24(15(3)26)30(27,28)20-8-4-6-16-7-5-11-23-22(16)20/h4-12H,1-3H3	TUVMBYMUELVTNS-UHFFFAOYSA-N	CC(=O)N(c1ccc2oc(C)c(C(=O)C)c2c1)S(=O)(=O)c3cccc4cccnc34	BroadT	BRD-K83270526	BRD-K83270526-001-07-4	ChemBridge Corporation	7784998			CC(=O)N(c1ccc2oc(C)c(C(C)=O)c2c1)S(=O)(=O)c1cccc2cccnc12	InChI=1S/C22H18N2O5S/c1-13(25)21-14(2)29-19-10-9-17(12-18(19)21)24(15(3)26)30(27,28)20-8-4-6-16-7-5-11-23-22(16)20/h4-12H,1-3H3	TUVMBYMUELVTNS-UHFFFAOYSA-N	422.093642386							115617
AC1NK9U3	LSM-27075	BRD-K37900095	4884572	InChI=1S/C22H22N2O5S/c1-3-28-21(26)12-20-24(14-19(25)23-13-17-5-4-10-29-17)22(27)18(30-20)11-16-8-6-15(2)7-9-16/h4-12H,3,13-14H2,1-2H3,(H,23,25)	UCWSAHOOLYRYJB-UHFFFAOYSA-N	CCOC(=O)C=C1SC(=Cc2ccc(C)cc2)C(=O)N1CC(=O)NCc3occc3	BroadT	BRD-K37900095	BRD-K37900095-001-05-8	Enamine Ltd.	T5335604			CCOC(=O)C=c1sc(=Cc2ccc(C)cc2)c(=O)n1CC(=O)NCc1ccco1	InChI=1S/C22H22N2O5S/c1-3-28-21(26)12-20-24(14-19(25)23-13-17-5-4-10-29-17)22(27)18(30-20)11-16-8-6-15(2)7-9-16/h4-12H,3,13-14H2,1-2H3,(H,23,25)	UCWSAHOOLYRYJB-UHFFFAOYSA-N	426.124942514							115618
AC1MLU3J	LSM-27076	BRD-A64915300, SID24780734	3228603	InChI=1S/C19H26N2O5/c1-11(2)17(18(22)20-10-13-6-5-7-24-13)26-19(23)15-9-16-14(21(15)4)8-12(3)25-16/h8-9,11,13,17H,5-7,10H2,1-4H3,(H,20,22)	MIFOMLKDBYKSDC-UHFFFAOYSA-N	CC(C)C(OC(=O)c1cc2oc(C)cc2n1C)C(=O)NCC3CCCO3	BroadT	BRD-A64915300	BRD-A64915300-001-05-5	Asinex Ltd.	ASN 07463391			CC(C)C(OC(=O)c1cc2oc(C)cc2n1C)C(=O)NCC1CCCO1	InChI=1S/C19H26N2O5/c1-11(2)17(18(22)20-10-13-6-5-7-24-13)26-19(23)15-9-16-14(21(15)4)8-12(3)25-16/h8-9,11,13,17H,5-7,10H2,1-4H3,(H,20,22)	MIFOMLKDBYKSDC-UHFFFAOYSA-N	362.184171952							115619
MLS001121473	LSM-27077	BRD-K55727377, SID24395335, SID49723013	16017430	InChI=1S/C15H18N4O3S2/c1-10(2)9-13(20)16-14-17-18-15(23-14)24(21,22)19-8-7-11-5-3-4-6-12(11)19/h3-6,10H,7-9H2,1-2H3,(H,16,17,20)	KXHGGDLYJZRWJY-UHFFFAOYSA-N	CC(C)CC(=O)Nc1nnc(s1)S(=O)(=O)N2CCc3ccccc23	BroadT	BRD-K55727377	BRD-K55727377-001-04-4	ChemDiv Inc.	E157-2630			CC(C)CC(=O)Nc1nnc(s1)S(=O)(=O)N1CCc2ccccc12	InChI=1S/C15H18N4O3S2/c1-10(2)9-13(20)16-14-17-18-15(23-14)24(21,22)19-8-7-11-5-3-4-6-12(11)19/h3-6,10H,7-9H2,1-2H3,(H,16,17,20)	KXHGGDLYJZRWJY-UHFFFAOYSA-N	366.082031856							115620
T0514-5945	LSM-44197	BRD-K34297711, SID17517157	2394148	InChI=1S/C21H22N2O7/c1-28-18-13-15(4-6-16(18)24)5-7-20(26)30-14-19(25)22-8-10-23(11-9-22)21(27)17-3-2-12-29-17/h2-7,12-13,24H,8-11,14H2,1H3/b7-5+	FNACFNWYCZZNOP-FNORWQNLSA-N	COc1cc(\C=C\C(=O)OCC(=O)N2CCN(CC2)C(=O)c3occc3)ccc1O	BroadT	BRD-K34297711	BRD-K34297711-001-05-6	Enamine Ltd.	T0514-5945			COc1cc(\C=C\C(=O)OCC(=O)N2CCN(CC2)C(=O)c2ccco2)ccc1O	InChI=1S/C21H22N2O7/c1-28-18-13-15(4-6-16(18)24)5-7-20(26)30-14-19(25)22-8-10-23(11-9-22)21(27)17-3-2-12-29-17/h2-7,12-13,24H,8-11,14H2,1H3/b7-5+	FNACFNWYCZZNOP-FNORWQNLSA-N	414.142701064							
MLS000684308	LSM-27079	BRD-K12260863, SID24786089	1363548	InChI=1S/C21H19N3O5/c25-21(22-15-5-7-16(8-6-15)23-11-13-28-14-12-23)20-10-9-19(29-20)17-3-1-2-4-18(17)24(26)27/h1-10H,11-14H2,(H,22,25)	FUOCUISHQOYNHP-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1c2oc(cc2)C(=O)Nc3ccc(cc3)N4CCOCC4	BroadT	BRD-K12260863	BRD-K12260863-001-11-4	ChemBridge Corporation	6016380			[O-][N+](=O)c1ccccc1-c1ccc(o1)C(=O)Nc1ccc(cc1)N1CCOCC1	InChI=1S/C21H19N3O5/c25-21(22-15-5-7-16(8-6-15)23-11-13-28-14-12-23)20-10-9-19(29-20)17-3-1-2-4-18(17)24(26)27/h1-10H,11-14H2,(H,22,25)	FUOCUISHQOYNHP-UHFFFAOYSA-N	393.132470738							115622
MLS000704078	LSM-27080	BRD-K78889331, SID22414154	841627	InChI=1S/C13H11N3OS/c1-9-5-2-3-6-10(9)16-12(14-15-13(16)18)11-7-4-8-17-11/h2-8H,1H3,(H,15,18)	HVPOKHPNVUVCMQ-UHFFFAOYSA-N	Cc1ccccc1n2c(S)nnc2c3occc3	BroadT	BRD-K78889331	BRD-K78889331-001-05-7	Specs	AK-968/40843092			Cc1ccccc1-n1c(S)nnc1-c1ccco1	InChI=1S/C13H11N3OS/c1-9-5-2-3-6-10(9)16-12(14-15-13(16)18)11-7-4-8-17-11/h2-8H,1H3,(H,15,18)	HVPOKHPNVUVCMQ-UHFFFAOYSA-N	257.062282692							115623
ZINC02930447	LSM-27081	BRD-K16479784, SID14732287	2261646	InChI=1S/C19H14ClNO4/c1-24-19(23)14-7-2-3-8-15(14)21-18(22)17-10-9-16(25-17)12-5-4-6-13(20)11-12/h2-11H,1H3,(H,21,22)	LFCIGTCYRRODCT-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)c2oc(cc2)c3cccc(Cl)c3	BroadT	BRD-K16479784	BRD-K16479784-001-05-4	ChemBridge Corporation	6002460			COC(=O)c1ccccc1NC(=O)c1ccc(o1)-c1cccc(Cl)c1	InChI=1S/C19H14ClNO4/c1-24-19(23)14-7-2-3-8-15(14)21-18(22)17-10-9-16(25-17)12-5-4-6-13(20)11-12/h2-11H,1H3,(H,21,22)	LFCIGTCYRRODCT-UHFFFAOYSA-N	355.061135648							115624
ZINC00357536	LSM-27082	BRD-K75495990	6744333	InChI=1S/C16H18N4O2/c1-2-4-15(21)19-13-8-6-12(7-9-13)16(22)20-18-11-14-5-3-10-17-14/h3,5-11,17H,2,4H2,1H3,(H,19,21)(H,20,22)	MTTDOVPMVNGWCP-UHFFFAOYSA-N	CCCC(=O)Nc1ccc(cc1)C(=O)NN=Cc2ccc[nH]2	BroadT	BRD-K75495990	BRD-K75495990-001-05-8	Specs	AN-329/15535044			CCCC(=O)Nc1ccc(cc1)C(=O)NN=Cc1ccc[nH]1	InChI=1S/C16H18N4O2/c1-2-4-15(21)19-13-8-6-12(7-9-13)16(22)20-18-11-14-5-3-10-17-14/h3,5-11,17H,2,4H2,1H3,(H,19,21)(H,20,22)	MTTDOVPMVNGWCP-UHFFFAOYSA-N	298.142975856							
STK099140	LSM-15399	BRD-K91039552	1599975	InChI=1S/C17H30N2O/c1(3-19-4-6-20-7-5-19)2-18-17-15-9-13-8-14(11-15)12-16(17)10-13/h13-18H,1-12H2	PTOISOHRJJUJID-UHFFFAOYSA-N	C(CNC1C2CC3CC(CC1C3)C2)CN4CCOCC4	BroadT	BRD-K91039552	BRD-K91039552-003-05-0	InterBioScreen Ltd.	STOCK1S-13342		Cl	C(CNC1C2CC3CC(C2)CC1C3)CN1CCOCC1.Cl	InChI=1S/C17H30N2O.ClH/c1(3-19-4-6-20-7-5-19)2-18-17-15-9-13-8-14(11-15)12-16(17)10-13;/h13-18H,1-12H2;1H	FFGVJHIRGSZAAS-UHFFFAOYSA-N	278.2358136							104041, 104041
AC1OA4RN	LSM-27083	BRD-K14233531, SID862932	6747713	InChI=1S/C19H20N2O4/c1-3-23-13-9-10-14(15(22)11-13)19-18(12-20-21-19)25-17-8-6-5-7-16(17)24-4-2/h5-12,22H,3-4H2,1-2H3,(H,20,21)	WNVLPJAJNYJBFT-UHFFFAOYSA-N	CCOc1ccc(c(O)c1)c2[nH]ncc2Oc3ccccc3OCC	BroadT	BRD-K14233531	BRD-K14233531-001-05-3	InterBioScreen Ltd.	STOCK4S-58064			CCOc1ccc(-c2[nH]ncc2Oc2ccccc2OCC)c(O)c1	InChI=1S/C19H20N2O4/c1-3-23-13-9-10-14(15(22)11-13)19-18(12-20-21-19)25-17-8-6-5-7-16(17)24-4-2/h5-12,22H,3-4H2,1-2H3,(H,20,21)	WNVLPJAJNYJBFT-UHFFFAOYSA-N	340.14230714							
SMR000038917	LSM-44198	BRD-A71962374, SID856639	5389040	InChI=1S/C16H21ClN4O4S/c1-5-10(14(23)25-6-2)26-16-18-12-11(21(16)8-7-9(3)17)13(22)19-15(24)20(12)4/h7,10H,5-6,8H2,1-4H3,(H,19,22,24)/b9-7-	WCEQHYBVVNNHCD-CLFYSBASSA-N	CCOC(=O)C(CC)Sc1nc2N(C)C(=O)NC(=O)c2n1C\C=C(\C)/Cl	BroadT	BRD-A71962374	BRD-A71962374-001-05-9	InterBioScreen Ltd.	STOCK1S-24247			CCOC(=O)C(CC)Sc1nc2n(C)c(=O)[nH]c(=O)c2n1C\C=C(\C)Cl	InChI=1S/C16H21ClN4O4S/c1-5-10(14(23)25-6-2)26-16-18-12-11(21(16)8-7-9(3)17)13(22)19-15(24)20(12)4/h7,10H,5-6,8H2,1-4H3,(H,19,22,24)/b9-7-	WCEQHYBVVNNHCD-CLFYSBASSA-N	400.097203592							
SMR000093105	LSM-27085	SID7965261, BRD-A36774080	4198087	InChI=1S/C22H26N2O2/c1-26-19-12-10-17(11-13-19)21(22(25)23-18-7-3-4-8-18)24-15-14-16-6-2-5-9-20(16)24/h2,5-6,9-13,18,21H,3-4,7-8,14-15H2,1H3,(H,23,25)	TYDXTZOUGWPWNR-UHFFFAOYSA-N	COc1ccc(cc1)C(N2CCc3ccccc23)C(=O)NC4CCCC4	BroadT	BRD-A36774080	BRD-A36774080-001-04-0	ChemDiv Inc.	C094-1509			COc1ccc(cc1)C(N1CCc2ccccc12)C(=O)NC1CCCC1	InChI=1S/C22H26N2O2/c1-26-19-12-10-17(11-13-19)21(22(25)23-18-7-3-4-8-18)24-15-14-16-6-2-5-9-20(16)24/h2,5-6,9-13,18,21H,3-4,7-8,14-15H2,1H3,(H,23,25)	TYDXTZOUGWPWNR-UHFFFAOYSA-N	350.199428092							115628
AC1LIX3Z	LSM-27086	BRD-K17175263	939871	InChI=1S/C7H9N3OS/c1-8-7(12)10-9-5-6-3-2-4-11-6/h2-5H,1H3,(H2,8,10,12)	HYXWOVSEEKCMOC-UHFFFAOYSA-N	CN=C(S)NN=Cc1occc1	BroadT	BRD-K17175263	BRD-K17175263-001-05-7	InterBioScreen Ltd.	STOCK2S-94303			CN=C(S)NN=Cc1ccco1	InChI=1S/C7H9N3OS/c1-8-7(12)10-9-5-6-3-2-4-11-6/h2-5H,1H3,(H2,8,10,12)	HYXWOVSEEKCMOC-UHFFFAOYSA-N	183.046632628							115629
Methyl 4-[3-methyl-5-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazol-4-yl]benzoate	LSM-27087	BRD-A53850583, SID7964961	3436636	InChI=1S/C21H19N3O3/c1-12-4-10-16(11-5-12)24-19(17-13(2)22-23-18(17)20(24)25)14-6-8-15(9-7-14)21(26)27-3/h4-11,19H,1-3H3,(H,22,23)	QQXYVCDNGJFOJM-UHFFFAOYSA-N	COC(=O)c1ccc(cc1)C2N(C(=O)c3[nH]nc(C)c23)c4ccc(C)cc4	BroadT	BRD-A53850583	BRD-A53850583-001-04-8	ChemDiv Inc.	C390-0239			COC(=O)c1ccc(cc1)C1N(C(=O)c2[nH]nc(C)c12)c1ccc(C)cc1	InChI=1S/C21H19N3O3/c1-12-4-10-16(11-5-12)24-19(17-13(2)22-23-18(17)20(24)25)14-6-8-15(9-7-14)21(26)27-3/h4-11,19H,1-3H3,(H,22,23)	QQXYVCDNGJFOJM-UHFFFAOYSA-N	361.142641498							115630
SMR000206833	LSM-27088	BRD-K95343362, SID17504787	12004536	InChI=1S/C18H18BrN5O4S/c19-13-2-4-14(5-3-13)20-18(29)22-21-17(25)12-1-6-15(16(11-12)24(26)27)23-7-9-28-10-8-23/h1-6,11H,7-10H2,(H,21,25)(H2,20,22,29)	OGTNJANPSONZFG-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1N2CCOCC2)C(=O)NN=C(S)Nc3ccc(Br)cc3	BroadT	BRD-K95343362	BRD-K95343362-001-05-6	ChemDiv Inc.	K781-1903			[O-][N+](=O)c1cc(ccc1N1CCOCC1)C(=O)NN=C(S)Nc1ccc(Br)cc1	InChI=1S/C18H18BrN5O4S/c19-13-2-4-14(5-3-13)20-18(29)22-21-17(25)12-1-6-15(16(11-12)24(26)27)23-7-9-28-10-8-23/h1-6,11H,7-10H2,(H,21,25)(H2,20,22,29)	OGTNJANPSONZFG-UHFFFAOYSA-N	479.026287396							115631
ASN 05338532	LSM-27089	BRD-K67141726, SID24806920	1465566	InChI=1S/C26H35N3O4/c1-26(2,3)19-11-9-18(10-12-19)25(31)28-21-16-22(32-4)20(15-23(21)33-5)27-24(30)17-29-13-7-6-8-14-29/h9-12,15-16H,6-8,13-14,17H2,1-5H3,(H,27,30)(H,28,31)	YXRQVJPCKRPJEE-UHFFFAOYSA-N	COc1cc(NC(=O)c2ccc(cc2)C(C)(C)C)c(OC)cc1NC(=O)CN3CCCCC3	BroadT	BRD-K67141726	BRD-K67141726-001-05-9	Asinex Ltd.	ASN 05338532			COc1cc(NC(=O)c2ccc(cc2)C(C)(C)C)c(OC)cc1NC(=O)CN1CCCCC1	InChI=1S/C26H35N3O4/c1-26(2,3)19-11-9-18(10-12-19)25(31)28-21-16-22(32-4)20(15-23(21)33-5)27-24(30)17-29-13-7-6-8-14-29/h9-12,15-16H,6-8,13-14,17H2,1-5H3,(H,27,30)(H,28,31)	YXRQVJPCKRPJEE-UHFFFAOYSA-N	453.26275663							115632
ST50108519	LSM-15400	BRD-A99344113	2981295	InChI=1S/C27H31NO3/c1-2-27(30)24-13-15-26(16-14-24)31-21-25(29)20-28(19-23-11-7-4-8-12-23)18-17-22-9-5-3-6-10-22/h3-16,25,29H,2,17-21H2,1H3	RQDZLDRYAKHKPP-UHFFFAOYSA-N	CCC(=O)c1ccc(OCC(O)CN(CCc2ccccc2)Cc3ccccc3)cc1	BroadT	BRD-A99344113	BRD-A99344113-003-05-0	ChemBridge Corporation	7980982		Cl	CCC(=O)c1ccc(OCC(O)CN(CCc2ccccc2)Cc2ccccc2)cc1.Cl	InChI=1S/C27H31NO3.ClH/c1-2-27(30)24-13-15-26(16-14-24)31-21-25(29)20-28(19-23-11-7-4-8-12-23)18-17-22-9-5-3-6-10-22;/h3-16,25,29H,2,17-21H2,1H3;1H	PIPPCUVCDCDBGW-UHFFFAOYSA-N	417.230393862							104042, 104042
AC1MK6RU	LSM-27090	SID24784777, BRD-A78042852	3151807	InChI=1S/C12H16N2O3S/c1-8(15)12(4)13(16)10(9-6-5-7-18-9)11(2,3)14(12)17/h5-7,17H,1-4H3	CSXZOGWWQNYZQR-UHFFFAOYSA-N	CC(=O)C1(C)N(O)C(C)(C)C(=[N+]1[O-])c2cccs2	BroadT	BRD-A78042852	BRD-A78042852-001-05-4	Asinex Ltd.	BAS 05210272			CC(=O)C1(C)N(O)C(C)(C)C(c2cccs2)=[N+]1[O-]	InChI=1S/C12H16N2O3S/c1-8(15)12(4)13(16)10(9-6-5-7-18-9)11(2,3)14(12)17/h5-7,17H,1-4H3	CSXZOGWWQNYZQR-UHFFFAOYSA-N	268.088163082							115633
SMR000022398	LSM-27091	BRD-K70844489, SID4246157	3240537	InChI=1S/C20H25BrN2O5S/c1-2-28-20(25)14-5-8-22(9-6-14)29(26,27)17-12-16(21)11-15-7-10-23(18(15)17)19(24)13-3-4-13/h11-14H,2-10H2,1H3	QHQSRZNZEVODOK-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC1)S(=O)(=O)c2cc(Br)cc3CCN(C(=O)C4CC4)c23	BroadT	BRD-K70844489	BRD-K70844489-001-05-0	ChemDiv Inc.	C137-2144			CCOC(=O)C1CCN(CC1)S(=O)(=O)c1cc(Br)cc2CCN(C(=O)C3CC3)c12	InChI=1S/C20H25BrN2O5S/c1-2-28-20(25)14-5-8-22(9-6-14)29(26,27)17-12-16(21)11-15-7-10-23(18(15)17)19(24)13-3-4-13/h11-14H,2-10H2,1H3	QHQSRZNZEVODOK-UHFFFAOYSA-N	484.06675521							115634
MLS000389503	LSM-27092	SID22407362, BRD-K97070268	2421792	InChI=1S/C17H15BrF3NO/c1-9-6-10(2)15(11(3)7-9)16(23)22-12-4-5-14(18)13(8-12)17(19,20)21/h4-8H,1-3H3,(H,22,23)	AQKGMHKALMBSDU-UHFFFAOYSA-N	Cc1cc(C)c(C(=O)Nc2ccc(Br)c(c2)C(F)(F)F)c(C)c1	BroadT	BRD-K97070268	BRD-K97070268-001-06-6	Enamine Ltd.	T5214542			Cc1cc(C)c(C(=O)Nc2ccc(Br)c(c2)C(F)(F)F)c(C)c1	InChI=1S/C17H15BrF3NO/c1-9-6-10(2)15(11(3)7-9)16(23)22-12-4-5-14(18)13(8-12)17(19,20)21/h4-8H,1-3H3,(H,22,23)	AQKGMHKALMBSDU-UHFFFAOYSA-N	385.02891131							115635
BAS 01156096	LSM-44199	BRD-K45062933, SID24784537	774613	InChI=1S/C16H12ClNO3/c17-13-7-5-12(6-8-13)16(21)18-14-3-1-2-11(10-14)4-9-15(19)20/h1-10H,(H,18,21)(H,19,20)/b9-4+	WRSQBHLTGLFCSJ-RUDMXATFSA-N	OC(=O)\C=C\c1cccc(NC(=O)c2ccc(Cl)cc2)c1	BroadT	BRD-K45062933	BRD-K45062933-001-05-3	Asinex Ltd.	BAS 01156096			OC(=O)\C=C\c1cccc(NC(=O)c2ccc(Cl)cc2)c1	InChI=1S/C16H12ClNO3/c17-13-7-5-12(6-8-13)16(21)18-14-3-1-2-11(10-14)4-9-15(19)20/h1-10H,(H,18,21)(H,19,20)/b9-4+	WRSQBHLTGLFCSJ-RUDMXATFSA-N	301.050570964							
SMR000026222	LSM-27094	BRD-A86748098, SID24838823, SID4247833	3241993	InChI=1S/C25H24N6O2S/c26-12-17-34-25-28-20-9-5-4-8-19(20)23-27-21(24(33)31(23)25)10-11-22(32)30-15-13-29(14-16-30)18-6-2-1-3-7-18/h1-9,21H,10-11,13-17H2	MHVVVUUHOWVVLK-UHFFFAOYSA-N	O=C(CCC1N=C2N(C1=O)C(=Nc3ccccc23)SCC#N)N4CCN(CC4)c5ccccc5	BroadT	BRD-A86748098	BRD-A86748098-001-05-0	ChemDiv Inc.	C336-0170			O=C(CCC1N=C2N(C1=O)C(SCC#N)=Nc1ccccc21)N1CCN(CC1)c1ccccc1	InChI=1S/C25H24N6O2S/c26-12-17-34-25-28-20-9-5-4-8-19(20)23-27-21(24(33)31(23)25)10-11-22(32)30-15-13-29(14-16-30)18-6-2-1-3-7-18/h1-9,21H,10-11,13-17H2	MHVVVUUHOWVVLK-UHFFFAOYSA-N	472.168144758							115637
ST50851490	LSM-27095	SID24792642, BRD-K72835476	2210439	InChI=1S/C14H16BrN5O2S/c1-8-4-5-11(22-3)10(6-8)17-14(23)19-18-13(21)12-9(15)7-16-20(12)2/h4-7H,1-3H3,(H,18,21)(H2,17,19,23)	SNWMANMTUVGILJ-UHFFFAOYSA-N	COc1ccc(C)cc1N=C(S)NNC(=O)c2c(Br)cnn2C	BroadT	BRD-K72835476	BRD-K72835476-001-06-9	ChemBridge Corporation	7819658			COc1ccc(C)cc1N=C(S)NNC(=O)c1c(Br)cnn1C	InChI=1S/C14H16BrN5O2S/c1-8-4-5-11(22-3)10(6-8)17-14(23)19-18-13(21)12-9(15)7-16-20(12)2/h4-7H,1-3H3,(H,18,21)(H2,17,19,23)	SNWMANMTUVGILJ-UHFFFAOYSA-N	397.020808092							115638
MLS000572838	LSM-27096	BRD-K52634604, SID17415818	739027	InChI=1S/C14H11N3OS3/c1-8-4-5-9-11(7-8)21-14(15-9)17-13(19)16-12(18)10-3-2-6-20-10/h2-7H,1H3,(H2,15,16,17,18,19)	NZHMXRNRVISYPP-UHFFFAOYSA-N	Cc1ccc2nc(NC(=S)NC(=O)c3cccs3)sc2c1	BroadT	BRD-K52634604	BRD-K52634604-001-05-7	ChemBridge Corporation	6337112			Cc1ccc2nc(NC(=S)NC(=O)c3cccs3)sc2c1	InChI=1S/C14H11N3OS3/c1-8-4-5-9-11(7-8)21-14(15-9)17-13(19)16-12(18)10-3-2-6-20-10/h2-7H,1H3,(H2,15,16,17,18,19)	NZHMXRNRVISYPP-UHFFFAOYSA-N	333.006424072							115639
(4-Chlorophenyl)[5-morpholino-4-(2-pyridinyl)-2-thienyl]methanone	LSM-27097	BRD-K70851631, SID17410000	1485938	InChI=1S/C20H17ClN2O2S/c21-15-6-4-14(5-7-15)19(24)18-13-16(17-3-1-2-8-22-17)20(26-18)23-9-11-25-12-10-23/h1-8,13H,9-12H2	JESJJHJNIOQXKN-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)c2cc(c3ccccn3)c(s2)N4CCOCC4	BroadT	BRD-K70851631	BRD-K70851631-001-05-2	Key Organics Ltd.	8D-112			Clc1ccc(cc1)C(=O)c1cc(c(s1)N1CCOCC1)-c1ccccn1	InChI=1S/C20H17ClN2O2S/c21-15-6-4-14(5-7-15)19(24)18-13-16(17-3-1-2-8-22-17)20(26-18)23-9-11-25-12-10-23/h1-8,13H,9-12H2	JESJJHJNIOQXKN-UHFFFAOYSA-N	384.069926204							115640
ASN 10296607	LSM-27098	BRD-K26251149, SID17507661	3231931	InChI=1S/C26H27N3O3/c1-19(2)32-26(31)24-16-23-22(14-15-27(23)3)29(24)18-25(30)28(21-12-8-5-9-13-21)17-20-10-6-4-7-11-20/h4-16,19H,17-18H2,1-3H3	RRELPZIEZSCVER-UHFFFAOYSA-N	CC(C)OC(=O)c1cc2c(ccn2C)n1CC(=O)N(Cc3ccccc3)c4ccccc4	BroadT	BRD-K26251149	BRD-K26251149-001-06-3	Asinex Ltd.	ASN 10296607			CC(C)OC(=O)c1cc2n(C)ccc2n1CC(=O)N(Cc1ccccc1)c1ccccc1	InChI=1S/C26H27N3O3/c1-19(2)32-26(31)24-16-23-22(14-15-27(23)3)29(24)18-25(30)28(21-12-8-5-9-13-21)17-20-10-6-4-7-11-20/h4-16,19H,17-18H2,1-3H3	RRELPZIEZSCVER-UHFFFAOYSA-N	429.205241754							115641
SMR000199998	LSM-27099	BRD-K22437400, SID17434094	715513	InChI=1S/C17H11ClN4S/c18-12-6-8-13(9-7-12)22-16(20-21-17(22)23)15-10-5-11-3-1-2-4-14(11)19-15/h1-10H,(H,21,23)	NEUZYMNJUNTSIF-UHFFFAOYSA-N	Sc1nnc(c2ccc3ccccc3n2)n1c4ccc(Cl)cc4	BroadT	BRD-K22437400	BRD-K22437400-001-05-8	ChemBridge Corporation	7820948			Sc1nnc(-c2ccc3ccccc3n2)n1-c1ccc(Cl)cc1	InChI=1S/C17H11ClN4S/c18-12-6-8-13(9-7-12)22-16(20-21-17(22)23)15-10-5-11-3-1-2-4-14(11)19-15/h1-10H,(H,21,23)	NEUZYMNJUNTSIF-UHFFFAOYSA-N	338.039294792							115642
AC1MEDO4	LSM-27100	BRD-A95480808, SID24797702	2876755	InChI=1S/C22H23NO3/c1-14(2)22(25)23-21(16-8-11-17(26-3)12-9-16)20-18-7-5-4-6-15(18)10-13-19(20)24/h4-14,21,24H,1-3H3,(H,23,25)	PVVXKVZDFCYHSG-UHFFFAOYSA-N	COc1ccc(cc1)C(NC(=O)C(C)C)c2c(O)ccc3ccccc23	BroadT	BRD-A95480808	BRD-A95480808-001-05-0	ChemBridge Corporation	5926104			COc1ccc(cc1)C(NC(=O)C(C)C)c1c(O)ccc2ccccc12	InChI=1S/C22H23NO3/c1-14(2)22(25)23-21(16-8-11-17(26-3)12-9-16)20-18-7-5-4-6-15(18)10-13-19(20)24/h4-14,21,24H,1-3H3,(H,23,25)	PVVXKVZDFCYHSG-UHFFFAOYSA-N	349.167793606							115643
MLS000066044	LSM-27101	BRD-A91461229, SID4256458	2967179	InChI=1S/C19H19N3O2/c23-13-19-20-16-6-2-4-8-18(16)22(19)12-15(24)11-21-10-9-14-5-1-3-7-17(14)21/h1-10,15,23-24H,11-13H2	WTGSVBSOJQMRQK-UHFFFAOYSA-N	OCc1nc2ccccc2n1CC(O)Cn3ccc4ccccc34	BroadT	BRD-A91461229	BRD-A91461229-001-06-3	ChemBridge Corporation	7930115			OCc1nc2ccccc2n1CC(O)Cn1ccc2ccccc12	InChI=1S/C19H19N3O2/c23-13-19-20-16-6-2-4-8-18(16)22(19)12-15(24)11-21-10-9-14-5-1-3-7-17(14)21/h1-10,15,23-24H,11-13H2	WTGSVBSOJQMRQK-UHFFFAOYSA-N	321.147726878							115644
N,4-Dimethyl-n-(4-methylphenyl)benzenesulfonamide	LSM-27102	BRD-K66735533, SID14731648	800890	InChI=1S/C15H17NO2S/c1-12-4-8-14(9-5-12)16(3)19(17,18)15-10-6-13(2)7-11-15/h4-11H,1-3H3	AFMKTQHRDBNAKW-UHFFFAOYSA-N	CN(c1ccc(C)cc1)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K66735533	BRD-K66735533-001-05-2	ChemBridge Corporation	6943632			CN(c1ccc(C)cc1)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C15H17NO2S/c1-12-4-8-14(9-5-12)16(3)19(17,18)15-10-6-13(2)7-11-15/h4-11H,1-3H3	AFMKTQHRDBNAKW-UHFFFAOYSA-N	275.097999484							115645
AC1M4OQL	LSM-27103	SID17508190, BRD-K84459640	2263510	InChI=1S/C13H12N2O2S/c1-9-5-2-3-6-10(9)12(14)15-17-13(16)11-7-4-8-18-11/h2-8H,1H3,(H2,14,15)	WNHVMJXGJPAPEP-UHFFFAOYSA-N	Cc1ccccc1C(=N)NOC(=O)c2cccs2	BroadT	BRD-K84459640	BRD-K84459640-001-05-7	Asinex Ltd.	BAS 01364145			Cc1ccccc1C(=N)NOC(=O)c1cccs1	InChI=1S/C13H12N2O2S/c1-9-5-2-3-6-10(9)12(14)15-17-13(16)11-7-4-8-18-11/h2-8H,1H3,(H2,14,15)	WNHVMJXGJPAPEP-UHFFFAOYSA-N	260.061948334							115646
MLS000119788	LSM-27104	BRD-K50345393, SID7967464	5308838	InChI=1S/C18H23N3O/c1-12-8-13(2)18(14(3)9-12)19-17(22)11-21-10-15-6-4-5-7-16(15)20-21/h8-10H,4-7,11H2,1-3H3,(H,19,22)	JMCHPNQXMYTLMV-UHFFFAOYSA-N	Cc1cc(C)c(NC(=O)Cn2cc3CCCCc3n2)c(C)c1	BroadT	BRD-K50345393	BRD-K50345393-001-04-0	ChemDiv Inc.	C881-0433			Cc1cc(C)c(NC(=O)Cn2cc3CCCCc3n2)c(C)c1	InChI=1S/C18H23N3O/c1-12-8-13(2)18(14(3)9-12)19-17(22)11-21-10-15-6-4-5-7-16(15)20-21/h8-10H,4-7,11H2,1-3H3,(H,19,22)	JMCHPNQXMYTLMV-UHFFFAOYSA-N	297.184112386							115647
MLS000830205	LSM-27105	BRD-K11518913, SID26728733	2810212	InChI=1S/C14H16ClN3OS/c1-14(2,3)11-8-20-13(16-11)18-17-12(19)9-4-6-10(15)7-5-9/h4-8H,1-3H3,(H,16,18)(H,17,19)	WCPFZGBUCMKJHI-UHFFFAOYSA-N	CC(C)(C)c1csc(NNC(=O)c2ccc(Cl)cc2)n1	BroadT	BRD-K11518913	BRD-K11518913-001-05-8	Maybridge	HTS 01570			CC(C)(C)c1csc(NNC(=O)c2ccc(Cl)cc2)n1	InChI=1S/C14H16ClN3OS/c1-14(2,3)11-8-20-13(16-11)18-17-12(19)9-4-6-10(15)7-5-9/h4-8H,1-3H3,(H,16,18)(H,17,19)	WCPFZGBUCMKJHI-UHFFFAOYSA-N	309.070260562							115648
5-Bromo-n-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methylideneamino]furan-2-carboxamide	LSM-27106	BRD-K73723329	1365366	InChI=1S/C22H17BrN4O3/c1-29-18-9-7-15(8-10-18)21-16(14-27(26-21)17-5-3-2-4-6-17)13-24-25-22(28)19-11-12-20(23)30-19/h2-14H,1H3,(H,25,28)	OLVOAEVHANZTPJ-UHFFFAOYSA-N	COc1ccc(cc1)c2nn(cc2C=NNC(=O)c3oc(Br)cc3)c4ccccc4	BroadT	BRD-K73723329	BRD-K73723329-001-06-5	ChemBridge Corporation	5760210			COc1ccc(cc1)-c1nn(cc1C=NNC(=O)c1ccc(Br)o1)-c1ccccc1	InChI=1S/C22H17BrN4O3/c1-29-18-9-7-15(8-10-18)21-16(14-27(26-21)17-5-3-2-4-6-17)13-24-25-22(28)19-11-12-20(23)30-19/h2-14H,1H3,(H,25,28)	OLVOAEVHANZTPJ-UHFFFAOYSA-N	464.048403044							115649
MLS000665074	LSM-27107	BRD-K05339908, SID24794098	951890	InChI=1S/C16H14ClN3S/c17-13-7-9-14(10-8-13)20-15(18-19-16(20)21)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2,(H,19,21)	DVHVILYRNLYZRM-UHFFFAOYSA-N	Sc1nnc(CCc2ccccc2)n1c3ccc(Cl)cc3	BroadT	BRD-K05339908	BRD-K05339908-001-05-4	ChemBridge Corporation	7863541			Sc1nnc(CCc2ccccc2)n1-c1ccc(Cl)cc1	InChI=1S/C16H14ClN3S/c17-13-7-9-14(10-8-13)20-15(18-19-16(20)21)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2,(H,19,21)	DVHVILYRNLYZRM-UHFFFAOYSA-N	315.059695878							115650
SMR000161963	LSM-27108	BRD-K03812127, SID17386276	1235256	InChI=1S/C22H17NO/c24-16-7-3-6-15(13-16)22-19-10-4-9-18(19)21-17-8-2-1-5-14(17)11-12-20(21)23-22/h1-3,5-8,11-13,24H,4,9-10H2	XVUVVFWKJOVPBV-UHFFFAOYSA-N	Oc1cccc(c1)c2nc3ccc4ccccc4c3c5CCCc25	BroadT	BRD-K03812127	BRD-K03812127-001-06-5	Specs	AG-690/11449010			Oc1cccc(c1)-c1nc2ccc3ccccc3c2c2CCCc12	InChI=1S/C22H17NO/c24-16-7-3-6-15(13-16)22-19-10-4-9-18(19)21-17-8-2-1-5-14(17)11-12-20(21)23-22/h1-3,5-8,11-13,24H,4,9-10H2	XVUVVFWKJOVPBV-UHFFFAOYSA-N	311.131014174							115651
MLS000092893	LSM-27109	BRD-K66383189, SID4244220	3238843	InChI=1S/C13H13ClN2O3/c1-7-12(19-8(2)15-7)13(17)16-10-6-9(14)4-5-11(10)18-3/h4-6H,1-3H3,(H,16,17)	QDTHQOSTOYYFHN-UHFFFAOYSA-N	COc1ccc(Cl)cc1NC(=O)c2oc(C)nc2C	BroadT	BRD-K66383189	BRD-K66383189-001-05-8	ChemDiv Inc.	C662-0195			COc1ccc(Cl)cc1NC(=O)c1oc(C)nc1C	InChI=1S/C13H13ClN2O3/c1-7-12(19-8(2)15-7)13(17)16-10-6-9(14)4-5-11(10)18-3/h4-6H,1-3H3,(H,16,17)	QDTHQOSTOYYFHN-UHFFFAOYSA-N	280.061470006							115652
3-Benzyl-2-thioxo-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one	LSM-27110	BRD-K13696195, SID17516365	2117383	InChI=1S/C13H10N2OS2/c16-12-11-10(6-7-18-11)14-13(17)15(12)8-9-4-2-1-3-5-9/h1-7H,8H2,(H,14,17)	OPQCANYPSHWIDV-UHFFFAOYSA-N	O=C1N(Cc2ccccc2)C(=S)Nc3ccsc13	BroadT	BRD-K13696195	BRD-K13696195-001-05-9	Enamine Ltd.	T5266918			O=c1n(Cc2ccccc2)c(=S)[nH]c2ccsc12	InChI=1S/C13H10N2OS2/c16-12-11-10(6-7-18-11)14-13(17)15(12)8-9-4-2-1-3-5-9/h1-7H,8H2,(H,14,17)	OPQCANYPSHWIDV-UHFFFAOYSA-N	274.02345434							115653
MLS001142998	LSM-27111	BRD-K17233342, SID49825036	3848385	InChI=1S/C22H20N4O3S/c1-4-10-26-20(23)18(30(28,29)16-9-8-14(2)15(3)12-16)13-17-21(26)24-19-7-5-6-11-25(19)22(17)27/h4-9,11-13,23H,1,10H2,2-3H3	FHRJSUUAGIDHJY-UHFFFAOYSA-N	Cc1ccc(cc1C)S(=O)(=O)C2=CC3=C(N=C4C=CC=CN4C3=O)N(CC=C)C2=N	BroadT	BRD-K17233342	BRD-K17233342-001-05-9	InterBioScreen Ltd.	STOCK5S-12253			Cc1ccc(cc1C)S(=O)(=O)c1cc2c(nc3ccccn3c2=O)n(CC=C)c1=N	InChI=1S/C22H20N4O3S/c1-4-10-26-20(23)18(30(28,29)16-9-8-14(2)15(3)12-16)13-17-21(26)24-19-7-5-6-11-25(19)22(17)27/h4-9,11-13,23H,1,10H2,2-3H3	FHRJSUUAGIDHJY-UHFFFAOYSA-N	420.12561123							115654
AC1MN6G8	LSM-27112	BRD-K49409947	3272448	InChI=1S/C17H18N2O5/c1-17(2,3)24-16(21)19-18-11-12-6-8-13(9-7-12)23-15(20)14-5-4-10-22-14/h4-11H,1-3H3,(H,19,21)	SHBIXMBNSNZCFJ-UHFFFAOYSA-N	CC(C)(C)OC(=O)NN=Cc1ccc(OC(=O)c2occc2)cc1	BroadT	BRD-K49409947	BRD-K49409947-001-06-4	ChemDiv Inc.	4328-0185			CC(C)(C)OC(=O)NN=Cc1ccc(OC(=O)c2ccco2)cc1	InChI=1S/C17H18N2O5/c1-17(2,3)24-16(21)19-18-11-12-6-8-13(9-7-12)23-15(20)14-5-4-10-22-14/h4-11H,1-3H3,(H,19,21)	SHBIXMBNSNZCFJ-UHFFFAOYSA-N	330.121571696							115655
AC1O9ZLO	LSM-27113	BRD-K63668467	6742101	InChI=1S/C17H17N5O3/c1-25-13-6-7-16(23)12(10-13)11-18-20-17(24)8-9-22-15-5-3-2-4-14(15)19-21-22/h2-7,10-11,23H,8-9H2,1H3,(H,20,24)	WDYSVVYLZDOACC-UHFFFAOYSA-N	COc1ccc(O)c(C=NNC(=O)CCn2nnc3ccccc23)c1	BroadT	BRD-K63668467	BRD-K63668467-001-05-8	Specs	AG-205/08235063			COc1ccc(O)c(C=NNC(=O)CCn2nnc3ccccc23)c1	InChI=1S/C17H17N5O3/c1-25-13-6-7-16(23)12(10-13)11-18-20-17(24)8-9-22-15-5-3-2-4-14(15)19-21-22/h2-7,10-11,23H,8-9H2,1H3,(H,20,24)	WDYSVVYLZDOACC-UHFFFAOYSA-N	339.133139454							
AC1MOKXU	LSM-27114	BRD-A63382799	3321972	InChI=1S/C21H20N2O2/c24-21(23-22-20-13-17-5-4-8-19(17)20)16-11-9-15(10-12-16)14-25-18-6-2-1-3-7-18/h1-4,6-12,17,19H,5,13-14H2,(H,23,24)	RCGUBUHAAHJUQJ-UHFFFAOYSA-N	O=C(NN=C1CC2CC=CC12)c3ccc(COc4ccccc4)cc3	BroadT	BRD-A63382799	BRD-A63382799-001-05-7	Enamine Ltd.	T0508-5980			O=C(NN=C1CC2CC=CC12)c1ccc(COc2ccccc2)cc1	InChI=1S/C21H20N2O2/c24-21(23-22-20-13-17-5-4-8-19(17)20)16-11-9-15(10-12-16)14-25-18-6-2-1-3-7-18/h1-4,6-12,17,19H,5,13-14H2,(H,23,24)	RCGUBUHAAHJUQJ-UHFFFAOYSA-N	332.1524779							115657
SMR000185185	LSM-44200	BRD-K40917447, SID17506577	5338376	InChI=1S/C19H18BrNO/c1-13-17(12-15-4-2-3-5-18(15)21-13)19(22)11-8-14-6-9-16(20)10-7-14/h6-12H,2-5H2,1H3/b11-8+	UGBVQJDTOZWKNQ-DHZHZOJOSA-N	Cc1nc2CCCCc2cc1C(=O)\C=C\c3ccc(Br)cc3	BroadT	BRD-K40917447	BRD-K40917447-001-07-8	ChemBridge Corporation	5278672			Cc1nc2CCCCc2cc1C(=O)\C=C\c1ccc(Br)cc1	InChI=1S/C19H18BrNO/c1-13-17(12-15-4-2-3-5-18(15)21-13)19(22)11-8-14-6-9-16(20)10-7-14/h6-12H,2-5H2,1H3/b11-8+	UGBVQJDTOZWKNQ-DHZHZOJOSA-N	355.057176806							
AC1MMIKW	LSM-27116	BRD-K38907993, SID4244771	3239324	InChI=1S/C15H22N2O3S/c1-12-6-8-14(9-7-12)21(19,20)16-11-10-15(18)17-13-4-2-3-5-13/h6-9,13,16H,2-5,10-11H2,1H3,(H,17,18)	YOIGLJWXVFPSED-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NCCC(=O)NC2CCCC2	BroadT	BRD-K38907993	BRD-K38907993-001-05-5	ChemDiv Inc.	K784-4191			Cc1ccc(cc1)S(=O)(=O)NCCC(=O)NC1CCCC1	InChI=1S/C15H22N2O3S/c1-12-6-8-14(9-7-12)21(19,20)16-11-10-15(18)17-13-4-2-3-5-13/h6-9,13,16H,2-5,10-11H2,1H3,(H,17,18)	YOIGLJWXVFPSED-UHFFFAOYSA-N	310.135113274							115659
UPCMLD04BGHW001087	LSM-27117	BRD-K56332068, SID17384966, SID24707899	3247356	InChI=1S/C30H30N2O3S/c1-21(29(33)31-25-18-17-22-11-9-10-14-24(22)19-25)27-20-30(27,2)28(23-12-5-3-6-13-23)32-36(34,35)26-15-7-4-8-16-26/h3-19,21,27-28,32H,20H2,1-2H3,(H,31,33)/t21-,27-,28-,30+/m1/s1	TXWWUPZFSFCKAH-FEPJPVGFSA-N	C[C@H]([C@H]1C[C@]1(C)[C@H](NS(=O)(=O)c2ccccc2)c3ccccc3)C(=O)Nc4ccc5ccccc5c4	BroadT	BRD-K56332068	BRD-K56332068-001-03-8	University of Pittsburgh CMLD	UPCMLD04BGHW001087			C[C@H]([C@H]1C[C@]1(C)[C@H](NS(=O)(=O)c1ccccc1)c1ccccc1)C(=O)Nc1ccc2ccccc2c1	InChI=1S/C30H30N2O3S/c1-21(29(33)31-25-18-17-22-11-9-10-14-24(22)19-25)27-20-30(27,2)28(23-12-5-3-6-13-23)32-36(34,35)26-15-7-4-8-16-26/h3-19,21,27-28,32H,20H2,1-2H3,(H,31,33)/t21-,27-,28-,30+/m1/s1	TXWWUPZFSFCKAH-FEPJPVGFSA-N	498.19771353							115660
T0400-4295	LSM-27118	BRD-K56336567, SID24825280	521303	InChI=1S/C21H24N3OP/c1-22(19-13-7-4-8-14-19)26(25,23(2)20-15-9-5-10-16-20)24(3)21-17-11-6-12-18-21/h4-18H,1-3H3	SXDAZEJYDNATRB-UHFFFAOYSA-N	CN(c1ccccc1)P(=O)(N(C)c2ccccc2)N(C)c3ccccc3	BroadT	BRD-K56336567	BRD-K56336567-001-05-0	Enamine Ltd.	T0400-4295			CN(c1ccccc1)P(=O)(N(C)c1ccccc1)N(C)c1ccccc1	InChI=1S/C21H24N3OP/c1-22(19-13-7-4-8-14-19)26(25,23(2)20-15-9-5-10-16-20)24(3)21-17-11-6-12-18-21/h4-18H,1-3H3	SXDAZEJYDNATRB-UHFFFAOYSA-N	365.165698928							115661
N-[3-(4-Chlorophenyl)-4-methyl-3H-1,5-benzodiazepin-2-yl]benzamide	LSM-27119	BRD-A63503250, SID24798182	2947277	InChI=1S/C23H18ClN3O/c1-15-21(16-11-13-18(24)14-12-16)22(26-20-10-6-5-9-19(20)25-15)27-23(28)17-7-3-2-4-8-17/h2-14,21H,1H3,(H,26,27,28)	WQYDOUFKOYQSSS-UHFFFAOYSA-N	CC1=Nc2ccccc2N=C(NC(=O)c3ccccc3)C1c4ccc(Cl)cc4	BroadT	BRD-A63503250	BRD-A63503250-001-05-0	ChemBridge Corporation	7679161			CC1=Nc2ccccc2N=C(NC(=O)c2ccccc2)C1c1ccc(Cl)cc1	InChI=1S/C23H18ClN3O/c1-15-21(16-11-13-18(24)14-12-16)22(26-20-10-6-5-9-19(20)25-15)27-23(28)17-7-3-2-4-8-17/h2-14,21H,1H3,(H,26,27,28)	WQYDOUFKOYQSSS-UHFFFAOYSA-N	387.113839936							115662
AC1LYJ03	LSM-27120	BRD-K02719847	1925937	InChI=1S/C19H20BrN5S/c1-3-24(4-2)15-11-9-14(10-12-15)13-21-25-18(22-23-19(25)26)16-7-5-6-8-17(16)20/h5-13H,3-4H2,1-2H3,(H,23,26)	WLVWBARTACPUQP-UHFFFAOYSA-N	CCN(CC)c1ccc(C=Nn2c(S)nnc2c3ccccc3Br)cc1	BroadT	BRD-K02719847	BRD-K02719847-001-06-2	InterBioScreen Ltd.	STOCK3S-14702			CCN(CC)c1ccc(C=Nn2c(S)nnc2-c2ccccc2Br)cc1	InChI=1S/C19H20BrN5S/c1-3-24(4-2)15-11-9-14(10-12-15)13-21-25-18(22-23-19(25)26)16-7-5-6-8-17(16)20/h5-13H,3-4H2,1-2H3,(H,23,26)	WLVWBARTACPUQP-UHFFFAOYSA-N	429.06227898							115663
ZINC01032625	LSM-27121	BRD-K52123365, SID26728723	2811934	InChI=1S/C20H25NO6/c1-11-12(9-17(27-11)20(2,3)4)18(22)21-14-10-16(25-6)15(24-5)8-13(14)19(23)26-7/h8-10H,1-7H3,(H,21,22)	BRCYLLXDYIBSSJ-UHFFFAOYSA-N	COC(=O)c1cc(OC)c(OC)cc1NC(=O)c2cc(oc2C)C(C)(C)C	BroadT	BRD-K52123365	BRD-K52123365-001-05-0	Maybridge	HTS 04673			COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cc(oc1C)C(C)(C)C	InChI=1S/C20H25NO6/c1-11-12(9-17(27-11)20(2,3)4)18(22)21-14-10-16(25-6)15(24-5)8-13(14)19(23)26-7/h8-10H,1-7H3,(H,21,22)	BRCYLLXDYIBSSJ-UHFFFAOYSA-N	375.16818753							115664
BAS 09620786	LSM-27122	SID14723319, BRD-K50716325	1094923	InChI=1S/C14H14Cl2N2O3S/c1-2-21-13-7-12(16)14(8-11(13)15)22(19,20)18-9-10-5-3-4-6-17-10/h3-8,18H,2,9H2,1H3	PSUMVFGKYILJBG-UHFFFAOYSA-N	CCOc1cc(Cl)c(cc1Cl)S(=O)(=O)NCc2ccccn2	BroadT	BRD-K50716325	BRD-K50716325-001-05-2	Asinex Ltd.	BAS 09620786			CCOc1cc(Cl)c(cc1Cl)S(=O)(=O)NCc1ccccn1	InChI=1S/C14H14Cl2N2O3S/c1-2-21-13-7-12(16)14(8-11(13)15)22(19,20)18-9-10-5-3-4-6-17-10/h3-8,18H,2,9H2,1H3	PSUMVFGKYILJBG-UHFFFAOYSA-N	360.010218438							115665
BAS 04049218	LSM-27123	BRD-K36171309, SID49643870	855776	InChI=1S/C17H15N3O2S/c1-20-16(22)13-9-5-6-10-14(13)19-17(20)23-11-15(21)18-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,18,21)	KPELHUIWVYZRKU-UHFFFAOYSA-N	CN1C(=Nc2ccccc2C1=O)SCC(=O)Nc3ccccc3	BroadT	BRD-K36171309	BRD-K36171309-001-06-7	Asinex Ltd.	BAS 04049218			Cn1c(SCC(=O)Nc2ccccc2)nc2ccccc2c1=O	InChI=1S/C17H15N3O2S/c1-20-16(22)13-9-5-6-10-14(13)19-17(20)23-11-15(21)18-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,18,21)	KPELHUIWVYZRKU-UHFFFAOYSA-N	325.08849744							115666
SMR000023450	LSM-27124	SID4250594, BRD-K53612850	3244386	InChI=1S/C20H17FN4O3/c1-12-19(13(2)25(23-12)11-14-5-7-15(21)8-6-14)22-20(26)16-10-18(28-24-16)17-4-3-9-27-17/h3-10H,11H2,1-2H3,(H,22,26)	CMVSDEZYOMTDLW-UHFFFAOYSA-N	Cc1nn(Cc2ccc(F)cc2)c(C)c1NC(=O)c3cc(on3)c4occc4	BroadT	BRD-K53612850	BRD-K53612850-001-06-1	ChemDiv Inc.	C226-1810			Cc1nn(Cc2ccc(F)cc2)c(C)c1NC(=O)c1cc(on1)-c1ccco1	InChI=1S/C20H17FN4O3/c1-12-19(13(2)25(23-12)11-14-5-7-15(21)8-6-14)22-20(26)16-10-18(28-24-16)17-4-3-9-27-17/h3-10H,11H2,1-2H3,(H,22,26)	CMVSDEZYOMTDLW-UHFFFAOYSA-N	380.128468644							115667
ST50851491	LSM-27125	BRD-K58112932, SID17432204	2954530	InChI=1S/C18H18FN3O4S2/c1-26-17(23)15-11-5-3-2-4-6-14(11)28-16(15)21-18(27)20-12-8-7-10(19)9-13(12)22(24)25/h7-9H,2-6H2,1H3,(H2,20,21,27)	ZWPGINLNSOSFIM-UHFFFAOYSA-N	COC(=O)c1c2CCCCCc2sc1N=C(S)Nc3ccc(F)cc3[N+](=O)[O-]	BroadT	BRD-K58112932	BRD-K58112932-001-05-1	ChemBridge Corporation	7786639			COC(=O)c1c2CCCCCc2sc1N=C(S)Nc1ccc(F)cc1[N+]([O-])=O	InChI=1S/C18H18FN3O4S2/c1-26-17(23)15-11-5-3-2-4-6-14(11)28-16(15)21-18(27)20-12-8-7-10(19)9-13(12)22(24)25/h7-9H,2-6H2,1H3,(H2,20,21,27)	ZWPGINLNSOSFIM-UHFFFAOYSA-N	423.072275666							115668
N-(6-Methoxy-2-oxo-1,2-dihydro-quinolin-3-ylmethyl)-n-phenethyl-acetamide	LSM-27126	BRD-K94344234, SID14722640	1459121	InChI=1S/C21H22N2O3/c1-15(24)23(11-10-16-6-4-3-5-7-16)14-18-12-17-13-19(26-2)8-9-20(17)22-21(18)25/h3-9,12-13H,10-11,14H2,1-2H3,(H,22,25)	RKRISZFRMDOHMV-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(CCc3ccccc3)C(=O)C)cc2c1	BroadT	BRD-K94344234	BRD-K94344234-001-05-1	Asinex Ltd.	ASN 05108008			COc1ccc2nc(O)c(CN(CCc3ccccc3)C(C)=O)cc2c1	InChI=1S/C21H22N2O3/c1-15(24)23(11-10-16-6-4-3-5-7-16)14-18-12-17-13-19(26-2)8-9-20(17)22-21(18)25/h3-9,12-13H,10-11,14H2,1-2H3,(H,22,25)	RKRISZFRMDOHMV-UHFFFAOYSA-N	350.163042584							115669
AC1LLXFF	LSM-27127	BRD-K70116387, SID24802226	1091861	InChI=1S/C15H12N6/c1-10-5-4-6-11(9-10)16-14-15-18-19-20-21(15)13-8-3-2-7-12(13)17-14/h2-9H,1H3,(H,16,17)	PFJPWAHAOJVVLY-UHFFFAOYSA-N	Cc1cccc(Nc2nc3ccccc3n4nnnc24)c1	BroadT	BRD-K70116387	BRD-K70116387-001-05-6	Asinex Ltd.	BAS 08315320			Cc1cccc(Nc2nc3ccccc3n3nnnc23)c1	InChI=1S/C15H12N6/c1-10-5-4-6-11(9-10)16-14-15-18-19-20-21(15)13-8-3-2-7-12(13)17-14/h2-9H,1H3,(H,16,17)	PFJPWAHAOJVVLY-UHFFFAOYSA-N	276.112344444							115670
CID 73136277	LSM-27128	BRD-A21814529	73136277	InChI=1S/C21H23N5O2/c1-12-7-8-17(22-9-12)25-21(28)18-13(2)24-15-5-4-6-16(27)20(15)19(18)14-10-23-26(3)11-14/h7-11,19-20H,4-6H2,1-3H3,(H,22,25,28)	HWBYNOWDWNJUDE-UHFFFAOYSA-N	CC1=C(C(C2C(=O)CCCC2=N1)c3cnn(C)c3)C(=O)Nc4ccc(C)cn4	BroadT	BRD-A21814529	BRD-A21814529-001-05-7	Specs	AK-968/40945893			Cc1ccc(NC(=O)C2=C(C)N=C3CCCC(=O)C3C2c2cnn(C)c2)nc1	InChI=1S/C21H23N5O2/c1-12-7-8-17(22-9-12)25-21(28)18-13(2)24-15-5-4-6-16(27)20(15)19(18)14-10-23-26(3)11-14/h7-11,19-20H,4-6H2,1-3H3,(H,22,25,28)	HWBYNOWDWNJUDE-UHFFFAOYSA-N	377.185175026							115671
AC1LG68O	LSM-27129	BRD-K57270624	789590	InChI=1S/C21H19N3O/c1-13-8-9-17(10-14(13)2)24-21(25)19(15(3)23-24)11-16-12-22-20-7-5-4-6-18(16)20/h4-12,25H,1-3H3	IUADYGKGLBCALL-UHFFFAOYSA-N	Cc1ccc(cc1C)n2nc(C)c(C=C3C=Nc4ccccc34)c2O	BroadT	BRD-K57270624	BRD-K57270624-001-05-1	Specs	AG-690/12000104			Cc1nn(c(O)c1C=C1C=Nc2ccccc12)-c1ccc(C)c(C)c1	InChI=1S/C21H19N3O/c1-13-8-9-17(10-14(13)2)24-21(25)19(15(3)23-24)11-16-12-22-20-7-5-4-6-18(16)20/h4-12,25H,1-3H3	IUADYGKGLBCALL-UHFFFAOYSA-N	329.152812258							
SMR000097177	LSM-27130	BRD-K26591929, SID7964754	4183437	InChI=1S/C21H26N4O/c1-15-14-19(24-12-8-4-5-9-13-24)25-21(22-15)20(16(2)23-25)17-10-6-7-11-18(17)26-3/h6-7,10-11,14H,4-5,8-9,12-13H2,1-3H3	IXHRPSIJGXCIOH-UHFFFAOYSA-N	COc1ccccc1c2c(C)nn3c(cc(C)nc23)N4CCCCCC4	BroadT	BRD-K26591929	BRD-K26591929-001-04-3	ChemDiv Inc.	K788-9284			COc1ccccc1-c1c(C)nn2c(cc(C)nc12)N1CCCCCC1	InChI=1S/C21H26N4O/c1-15-14-19(24-12-8-4-5-9-13-24)25-21(22-15)20(16(2)23-25)17-10-6-7-11-18(17)26-3/h6-7,10-11,14H,4-5,8-9,12-13H2,1-3H3	IXHRPSIJGXCIOH-UHFFFAOYSA-N	350.210661492							115673
MLS000535158	LSM-27131	SID14746076, BRD-K46119789	1301366	InChI=1S/C19H15FN4OS/c20-14-6-8-15(9-7-14)21-18(25)11-12-26-19-23-22-17-10-5-13-3-1-2-4-16(13)24(17)19/h1-10H,11-12H2,(H,21,25)	SOOKCLBBQRPXBC-UHFFFAOYSA-N	Fc1ccc(NC(=O)CCSc2nnc3ccc4ccccc4n23)cc1	BroadT	BRD-K46119789	BRD-K46119789-001-05-5	ChemBridge Corporation	7368569			Fc1ccc(NC(=O)CCSc2nnc3ccc4ccccc4n23)cc1	InChI=1S/C19H15FN4OS/c20-14-6-8-15(9-7-14)21-18(25)11-12-26-19-23-22-17-10-5-13-3-1-2-4-16(13)24(17)19/h1-10H,11-12H2,(H,21,25)	SOOKCLBBQRPXBC-UHFFFAOYSA-N	366.09506003							115674
F1814-1747	LSM-27132	BRD-K73802986	2151131	InChI=1S/C15H10FN3O3S/c1-18-13-10(16)6-4-8-12(13)23-15(18)17-14(20)9-5-2-3-7-11(9)19(21)22/h2-8H,1H3	ZGYYAMRPNAHPIZ-UHFFFAOYSA-N	CN1C(=NC(=O)c2ccccc2[N+](=O)[O-])Sc3cccc(F)c13	BroadT	BRD-K73802986	BRD-K73802986-001-05-3	Life Chemicals Inc.	F1814-1747			Cn1c2c(F)cccc2sc1=NC(=O)c1ccccc1[N+]([O-])=O	InChI=1S/C15H10FN3O3S/c1-18-13-10(16)6-4-8-12(13)23-15(18)17-14(20)9-5-2-3-7-11(9)19(21)22/h2-8H,1H3	ZGYYAMRPNAHPIZ-UHFFFAOYSA-N	331.0426901							115675
ASN 06532296	LSM-27133	BRD-K65005311, SID17408896	1442430	InChI=1S/C21H24N4OS2/c1-21(2,3)19-22-14-9-5-4-8-13(14)18(25-19)27-12-17(26)24-20-23-15-10-6-7-11-16(15)28-20/h4-5,8-9H,6-7,10-12H2,1-3H3,(H,23,24,26)	OLWIOBBJLBPIJD-UHFFFAOYSA-N	CC(C)(C)c1nc(SCC(=O)Nc2nc3CCCCc3s2)c4ccccc4n1	BroadT	BRD-K65005311	BRD-K65005311-001-06-7	Asinex Ltd.	ASN 06532296			CC(C)(C)c1nc(SCC(=O)Nc2nc3CCCCc3s2)c2ccccc2n1	InChI=1S/C21H24N4OS2/c1-21(2,3)19-22-14-9-5-4-8-13(14)18(25-19)27-12-17(26)24-20-23-15-10-6-7-11-16(15)28-20/h4-5,8-9H,6-7,10-12H2,1-3H3,(H,23,24,26)	OLWIOBBJLBPIJD-UHFFFAOYSA-N	412.139152808							115676
AC1MCEWY	LSM-27134	BRD-K50704115	2767968	InChI=1S/C20H18N2O2S/c1-13-8-7-11-17(12-13)20(23)24-22-15(3)18-14(2)21-19(25-18)16-9-5-4-6-10-16/h4-12H,1-3H3	RHBWSRQRWUDTTE-UHFFFAOYSA-N	CC(=NOC(=O)c1cccc(C)c1)c2sc(nc2C)c3ccccc3	BroadT	BRD-K50704115	BRD-K50704115-001-05-2	Key Organics Ltd.	11P-569S			CC(=NOC(=O)c1cccc(C)c1)c1sc(nc1C)-c1ccccc1	InChI=1S/C20H18N2O2S/c1-13-8-7-11-17(12-13)20(23)24-22-15(3)18-14(2)21-19(25-18)16-9-5-4-6-10-16/h4-12H,1-3H3	RHBWSRQRWUDTTE-UHFFFAOYSA-N	350.108898526							115677
ST50181390	LSM-27135	BRD-K95952081, SID24795113	5348623	InChI=1S/C22H25NO3/c1-3-5-13-23(4-2)15-19-20(24)12-11-17-18(14-21(25)26-22(17)19)16-9-7-6-8-10-16/h6-12,14,24H,3-5,13,15H2,1-2H3	GOANVLYQSREXOW-UHFFFAOYSA-N	CCCCN(CC)Cc1c(O)ccc2C(=CC(=O)Oc12)c3ccccc3	BroadT	BRD-K95952081	BRD-K95952081-001-05-4	ChemBridge Corporation	6150978			CCCCN(CC)Cc1c(O)ccc2c(cc(=O)oc12)-c1ccccc1	InChI=1S/C22H25NO3/c1-3-5-13-23(4-2)15-19-20(24)12-11-17-18(14-21(25)26-22(17)19)16-9-7-6-8-10-16/h6-12,14,24H,3-5,13,15H2,1-2H3	GOANVLYQSREXOW-UHFFFAOYSA-N	351.18344367							115678
F1751-0035	LSM-44201	BRD-A91891312, SID4254779	5740385	InChI=1S/C24H26N2O3/c1-5-29-18-12-10-17(11-13-18)26-22(27)15-16(23(26)28)14-21-24(2,3)19-8-6-7-9-20(19)25(21)4/h6-14,16H,5,15H2,1-4H3/b21-14+	VHZKNCQLDVENIL-KGENOOAVSA-N	CCOc1ccc(cc1)N2C(=O)CC(\C=C/3\N(C)c4ccccc4C3(C)C)C2=O	BroadT	BRD-A91891312	BRD-A91891312-001-05-1	ChemBridge Corporation	7910193			CCOc1ccc(cc1)N1C(=O)CC(\C=C2\N(C)c3ccccc3C2(C)C)C1=O	InChI=1S/C24H26N2O3/c1-5-29-18-12-10-17(11-13-18)26-22(27)15-16(23(26)28)14-21-24(2,3)19-8-6-7-9-20(19)25(21)4/h6-14,16H,5,15H2,1-4H3/b21-14+	VHZKNCQLDVENIL-KGENOOAVSA-N	390.194342712							
MLS000522325	LSM-27137	BRD-K88189489, SID14737864	3981948	InChI=1S/C13H9BrN2O3/c1-17-9-4-2-8(3-5-9)13-15-12(16-19-13)10-6-7-11(14)18-10/h2-7H,1H3	AMCDOYQAFPUTSD-UHFFFAOYSA-N	COc1ccc(cc1)c2onc(n2)c3oc(Br)cc3	BroadT	BRD-K88189489	BRD-K88189489-001-04-3	ChemDiv Inc.	8015-2169			COc1ccc(cc1)-c1nc(no1)-c1ccc(Br)o1	InChI=1S/C13H9BrN2O3/c1-17-9-4-2-8(3-5-9)13-15-12(16-19-13)10-6-7-11(14)18-10/h2-7H,1H3	AMCDOYQAFPUTSD-UHFFFAOYSA-N	319.979654768							115680
CID 2409901	LSM-44202	BRD-K86586698	2409901	InChI=1S/C23H21N3O4S/c1-3-30-19-11-9-18(10-12-19)24-23(31)21(25-13-5-4-6-14-25)22(27)17-8-7-16(2)20(15-17)26(28)29/h4-15H,3H2,1-2H3,(H-,24,27,31)/p+1	UMYVGHMKCQMLTG-UHFFFAOYSA-O	CCOc1ccc(N\C(=C(\C(=O)c2ccc(C)c(c2)[N+](=O)[O-])/[n+]3ccccc3)\S)cc1	BroadT	BRD-K86586698	BRD-K86586698-001-05-6	Enamine Ltd.	T0515-2374			CCOc1ccc(N\C(S)=C(\C(=O)c2ccc(C)c(c2)[N+]([O-])=O)[n+]2ccccc2)cc1	InChI=1S/C23H21N3O4S/c1-3-30-19-11-9-18(10-12-19)24-23(31)21(25-13-5-4-6-14-25)22(27)17-8-7-16(2)20(15-17)26(28)29/h4-15H,3H2,1-2H3,(H-,24,27,31)/p+1	UMYVGHMKCQMLTG-UHFFFAOYSA-O	436.133101904							115681
N-(4-Bromophenyl)-4-(2-methoxyphenyl)tetrahydropyridine-1(2H)-carbothioamide	LSM-27139	BRD-K32406588, SID26727689	2728011	InChI=1S/C19H21BrN2OS/c1-23-18-5-3-2-4-17(18)14-10-12-22(13-11-14)19(24)21-16-8-6-15(20)7-9-16/h2-9,14H,10-13H2,1H3,(H,21,24)	RJYFVJPEXKPGNZ-UHFFFAOYSA-N	COc1ccccc1C2CCN(CC2)C(=Nc3ccc(Br)cc3)S	BroadT	BRD-K32406588	BRD-K32406588-001-05-5	Maybridge	RH 01416			COc1ccccc1C1CCN(CC1)C(S)=Nc1ccc(Br)cc1	InChI=1S/C19H21BrN2OS/c1-23-18-5-3-2-4-17(18)14-10-12-22(13-11-14)19(24)21-16-8-6-15(20)7-9-16/h2-9,14H,10-13H2,1H3,(H,21,24)	RJYFVJPEXKPGNZ-UHFFFAOYSA-N	404.055796602							115682
MLS000334397	LSM-27140	BRD-K05796207, SID22402911	2481957	InChI=1S/C16H11Cl2N3O3S/c1-8-10(17)5-19-15(14(8)18)21-13(22)6-24-16(23)9-2-3-11-12(4-9)25-7-20-11/h2-5,7H,6H2,1H3,(H,19,21,22)	OYOPYZXBHFJXPZ-UHFFFAOYSA-N	Cc1c(Cl)cnc(NC(=O)COC(=O)c2ccc3ncsc3c2)c1Cl	BroadT	BRD-K05796207	BRD-K05796207-001-05-3	Enamine Ltd.	T5284647			Cc1c(Cl)cnc(NC(=O)COC(=O)c2ccc3ncsc3c2)c1Cl	InChI=1S/C16H11Cl2N3O3S/c1-8-10(17)5-19-15(14(8)18)21-13(22)6-24-16(23)9-2-3-11-12(4-9)25-7-20-11/h2-5,7H,6H2,1H3,(H,19,21,22)	OYOPYZXBHFJXPZ-UHFFFAOYSA-N	394.989817352							115683
1-(4-Methyl-2-{[2-(4-methylphenoxy)ethyl]amino}-1,3-thiazol-5-yl)ethanone	LSM-27141	BRD-K35635390, SID24782300	1980098	InChI=1S/C15H18N2O2S/c1-10-4-6-13(7-5-10)19-9-8-16-15-17-11(2)14(20-15)12(3)18/h4-7H,8-9H2,1-3H3,(H,16,17)	JWTPPVAJYSZIMF-UHFFFAOYSA-N	CC(=O)c1sc(NCCOc2ccc(C)cc2)nc1C	BroadT	BRD-K35635390	BRD-K35635390-001-05-4	ChemBridge Corporation	7436049			CC(=O)c1sc(NCCOc2ccc(C)cc2)nc1C	InChI=1S/C15H18N2O2S/c1-10-4-6-13(7-5-10)19-9-8-16-15-17-11(2)14(20-15)12(3)18/h4-7H,8-9H2,1-3H3,(H,16,17)	JWTPPVAJYSZIMF-UHFFFAOYSA-N	290.108898526							115684
T6394138	LSM-27142	SID24826460, BRD-K16364953	2453505	InChI=1S/C17H16F2N2O2/c18-17(19)23-15-8-4-2-6-13(15)20-11-16(22)21-10-9-12-5-1-3-7-14(12)21/h1-8,17,20H,9-11H2	ZGQACWAIBRDFCW-UHFFFAOYSA-N	FC(F)Oc1ccccc1NCC(=O)N2CCc3ccccc23	BroadT	BRD-K16364953	BRD-K16364953-001-06-1	Enamine Ltd.	T0518-2975			FC(F)Oc1ccccc1NCC(=O)N1CCc2ccccc12	InChI=1S/C17H16F2N2O2/c18-17(19)23-15-8-4-2-6-13(15)20-11-16(22)21-10-9-12-5-1-3-7-14(12)21/h1-8,17,20H,9-11H2	ZGQACWAIBRDFCW-UHFFFAOYSA-N	318.117984172							115685
ZINC00993921	LSM-27143	BRD-K51153795, SID22412973	1219220	InChI=1S/C15H21BrN2O2/c1-15(2,3)10-4-6-11(7-5-10)17-18-14(19)12-8-9-13(16)20-12/h8-10H,4-7H2,1-3H3,(H,18,19)	XCHVPYSFXMFKGF-UHFFFAOYSA-N	CC(C)(C)C1CCC(=NNC(=O)c2oc(Br)cc2)CC1	BroadT	BRD-K51153795	BRD-K51153795-001-05-8	Specs	AK-968/11367282			CC(C)(C)C1CCC(CC1)=NNC(=O)c1ccc(Br)o1	InChI=1S/C15H21BrN2O2/c1-15(2,3)10-4-6-11(7-5-10)17-18-14(19)12-8-9-13(16)20-12/h8-10H,4-7H2,1-3H3,(H,18,19)	XCHVPYSFXMFKGF-UHFFFAOYSA-N	340.078640532							
STK520329	LSM-27144	BRD-K83336425, SID16953806	924631	InChI=1S/C12H14N2O2S/c1-9-4-2-3-5-10(9)16-8-11(15)14-12-13-6-7-17-12/h2-5H,6-8H2,1H3,(H,13,14,15)	VTDBLIGOEROGEY-UHFFFAOYSA-N	Cc1ccccc1OCC(=O)NC2=NCCS2	BroadT	BRD-K83336425	BRD-K83336425-001-05-9	Enamine Ltd.	ZT-2137369			Cc1ccccc1OCC(=O)NC1=NCCS1	InChI=1S/C12H14N2O2S/c1-9-4-2-3-5-10(9)16-8-11(15)14-12-13-6-7-17-12/h2-5H,6-8H2,1H3,(H,13,14,15)	VTDBLIGOEROGEY-UHFFFAOYSA-N	250.077598398							115687
OPREA1_358356	LSM-27145	BRD-K23831817	659541	InChI=1S/C16H22N4S/c1-19-7-9-20(10-8-19)12-18-16-14(11-17)13-5-3-2-4-6-15(13)21-16/h12H,2-10H2,1H3	FCMGAQVDVZZVMS-UHFFFAOYSA-N	CN1CCN(CC1)C=Nc2sc3CCCCCc3c2C#N	BroadT	BRD-K23831817	BRD-K23831817-001-07-4	InterBioScreen Ltd.	STOCK2S-29908			CN1CCN(CC1)C=Nc1sc2CCCCCc2c1C#N	InChI=1S/C16H22N4S/c1-19-7-9-20(10-8-19)12-18-16-14(11-17)13-5-3-2-4-6-15(13)21-16/h12H,2-10H2,1H3	FCMGAQVDVZZVMS-UHFFFAOYSA-N	302.156517434							115688
STK369721	LSM-27146	SID4257465, BRD-A23193246	2832697	InChI=1S/C10H8F4N2O/c1-5-2-3-6-7(4-5)16-9(15-6)8(11)17-10(12,13)14/h2-4,8H,1H3,(H,15,16)	DCLOSCFPNJJECN-UHFFFAOYSA-N	Cc1ccc2[nH]c(nc2c1)C(F)OC(F)(F)F	BroadT	BRD-A23193246	BRD-A23193246-001-05-6	ChemBridge Corporation	5190417			Cc1ccc2[nH]c(nc2c1)C(F)OC(F)(F)F	InChI=1S/C10H8F4N2O/c1-5-2-3-6-7(4-5)16-9(15-6)8(11)17-10(12,13)14/h2-4,8H,1H3,(H,15,16)	DCLOSCFPNJJECN-UHFFFAOYSA-N	248.057275696							115689
MLS000566289	LSM-44203	BRD-A90289676, SID14745610	6212611	InChI=1S/C21H21N5O3S/c1-25-13-22-23-21(25)30-12-18(27)26-20(17-8-4-10-29-17)16-7-2-5-14(19(16)24-26)11-15-6-3-9-28-15/h3-4,6,8-11,13,16,20H,2,5,7,12H2,1H3/b14-11+	XSOOYTWLQLUBLV-SDNWHVSQSA-N	Cn1cnnc1SCC(=O)N2N=C3C(CCC/C/3=C\c4occc4)C2c5occc5	BroadT	BRD-A90289676	BRD-A90289676-001-05-9	Enamine Ltd.	ZT-0197727			Cn1cnnc1SCC(=O)N1N=C2C(CCCC\2=C/c2ccco2)C1c1ccco1	InChI=1S/C21H21N5O3S/c1-25-13-22-23-21(25)30-12-18(27)26-20(17-8-4-10-29-17)16-7-2-5-14(19(16)24-26)11-15-6-3-9-28-15/h3-4,6,8-11,13,16,20H,2,5,7,12H2,1H3/b14-11+	XSOOYTWLQLUBLV-SDNWHVSQSA-N	423.136510272							
AC1OAPG3	LSM-27148	BRD-K47292239	6808272	InChI=1S/C21H25N3O2/c1-3-6-17-7-4-8-18(21(17)26)15-23-24-20(25)9-5-14-22-19-12-10-16(2)11-13-19/h3-4,7-8,10-13,15,22,26H,1,5-6,9,14H2,2H3,(H,24,25)	MOUFTZXKPJIVSJ-UHFFFAOYSA-N	Cc1ccc(NCCCC(=O)NN=Cc2cccc(CC=C)c2O)cc1	BroadT	BRD-K47292239	BRD-K47292239-001-05-5	ChemBridge Corporation	5248682			Cc1ccc(NCCCC(=O)NN=Cc2cccc(CC=C)c2O)cc1	InChI=1S/C21H25N3O2/c1-3-6-17-7-4-8-18(21(17)26)15-23-24-20(25)9-5-14-22-19-12-10-16(2)11-13-19/h3-4,7-8,10-13,15,22,26H,1,5-6,9,14H2,2H3,(H,24,25)	MOUFTZXKPJIVSJ-UHFFFAOYSA-N	351.19467707							
F0666-1608	LSM-27149	BRD-K83877780, SID4252304	3245877	InChI=1S/C16H13NO4S/c1-2-20-16(19)14-13(10-6-3-4-7-11(10)21-14)17-15(18)12-8-5-9-22-12/h3-9H,2H2,1H3,(H,17,18)	QXAWIKOPTGQDGT-UHFFFAOYSA-N	CCOC(=O)c1oc2ccccc2c1NC(=O)c3cccs3	BroadT	BRD-K83877780	BRD-K83877780-001-05-1	ChemDiv Inc.	C686-1505			CCOC(=O)c1oc2ccccc2c1NC(=O)c1cccs1	InChI=1S/C16H13NO4S/c1-2-20-16(19)14-13(10-6-3-4-7-11(10)21-14)17-15(18)12-8-5-9-22-12/h3-9H,2H2,1H3,(H,17,18)	QXAWIKOPTGQDGT-UHFFFAOYSA-N	315.056528596							115692
AC1LFW7I	LSM-27150	BRD-K31917106	761057	InChI=1S/C11H12N4OS/c1-7-6-9(14-12-7)11(16)15-13-8(2)10-4-3-5-17-10/h3-6H,1-2H3,(H,12,14)(H,15,16)	HWUGSOASARVEJH-UHFFFAOYSA-N	CC(=NNC(=O)c1cc(C)[nH]n1)c2cccs2	BroadT	BRD-K31917106	BRD-K31917106-001-05-5	Asinex Ltd.	BAS 00290705			CC(=NNC(=O)c1cc(C)[nH]n1)c1cccs1	InChI=1S/C11H12N4OS/c1-7-6-9(14-12-7)11(16)15-13-8(2)10-4-3-5-17-10/h3-6H,1-2H3,(H,12,14)(H,15,16)	HWUGSOASARVEJH-UHFFFAOYSA-N	248.073181734							115693
MLS000552107	LSM-27151	BRD-K91191855, SID14740745	5503040	InChI=1S/C22H23NO5/c1-3-23(4-2)12-16-18(24)7-6-15-21(25)17(13-28-22(15)16)14-5-8-19-20(11-14)27-10-9-26-19/h5-8,11,13,24H,3-4,9-10,12H2,1-2H3	GQPQCJXHGVLEOY-UHFFFAOYSA-N	CCN(CC)Cc1c(O)ccc2C(=O)C(=COc12)c3ccc4OCCOc4c3	BroadT	BRD-K91191855	BRD-K91191855-001-06-5	InterBioScreen Ltd.	STOCK4S-42578			CCN(CC)Cc1c(O)ccc2c1occ(-c1ccc3OCCOc3c1)c2=O	InChI=1S/C22H23NO5/c1-3-23(4-2)12-16-18(24)7-6-15-21(25)17(13-28-22(15)16)14-5-8-19-20(11-14)27-10-9-26-19/h5-8,11,13,24H,3-4,9-10,12H2,1-2H3	GQPQCJXHGVLEOY-UHFFFAOYSA-N	381.157622846							115694
SMR000130258	LSM-27152	SID14735292, BRD-A60513937	4918698	InChI=1S/C25H24N4O3S/c1-2-32-21-13-11-18(12-14-21)27-23(30)16-22-24(31)29(20-9-4-3-5-10-20)25(33)28(22)17-19-8-6-7-15-26-19/h3-15,22H,2,16-17H2,1H3,(H,27,30)	VEGBESMCQDBMTD-UHFFFAOYSA-N	CCOc1ccc(NC(=O)CC2N(Cc3ccccn3)C(=S)N(C2=O)c4ccccc4)cc1	BroadT	BRD-A60513937	BRD-A60513937-001-06-1	ChemDiv Inc.	C148-0758			CCOc1ccc(NC(=O)CC2N(Cc3ccccn3)C(=S)N(C2=O)c2ccccc2)cc1	InChI=1S/C25H24N4O3S/c1-2-32-21-13-11-18(12-14-21)27-23(30)16-22-24(31)29(20-9-4-3-5-10-20)25(33)28(22)17-19-8-6-7-15-26-19/h3-15,22H,2,16-17H2,1H3,(H,27,30)	VEGBESMCQDBMTD-UHFFFAOYSA-N	460.156911358							115695
MLS000095955	LSM-44204	BRD-K76197651, SID4240961	5771281	InChI=1S/C9H7ClN2O/c10-7-2-3-9(8(12)6-7)13-5-1-4-11/h1-3,5-6H,12H2/b5-1-	XKTKHUXAWUXQOJ-KTAJNNJTSA-N	Nc1cc(Cl)ccc1O\C=C/C#N	BroadT	BRD-K76197651	BRD-K76197651-001-05-9	ChemDiv Inc.	K783-4175			Nc1cc(Cl)ccc1O\C=C/C#N	InChI=1S/C9H7ClN2O/c10-7-2-3-9(8(12)6-7)13-5-1-4-11/h1-3,5-6H,12H2/b5-1-	XKTKHUXAWUXQOJ-KTAJNNJTSA-N	194.024690574							
ST50939203	LSM-27154	BRD-K79228133, SID14743894	2579380	InChI=1S/C10H14N2OS/c1-7-6-11-10(14-7)12-9(13)8-4-2-3-5-8/h6,8H,2-5H2,1H3,(H,11,12,13)	VJXYDYVVQABSFI-UHFFFAOYSA-N	Cc1cnc(NC(=O)C2CCCC2)s1	BroadT	BRD-K79228133	BRD-K79228133-001-06-5	Enamine Ltd.	T5323659			Cc1cnc(NC(=O)C2CCCC2)s1	InChI=1S/C10H14N2OS/c1-7-6-11-10(14-7)12-9(13)8-4-2-3-5-8/h6,8H,2-5H2,1H3,(H,11,12,13)	VJXYDYVVQABSFI-UHFFFAOYSA-N	210.082683778							115697
AC1N48SN	LSM-27155	BRD-A06471483	4125012	InChI=1S/C12H15N3O2S/c1-2-3-6-10-11(16)14-12(18-10)15-13-8-9-5-4-7-17-9/h4-5,7-8,10H,2-3,6H2,1H3,(H,14,15,16)	HKFJXVWFHGANRS-UHFFFAOYSA-N	CCCCC1SC(=NC1=O)NN=Cc2occc2	BroadT	BRD-A06471483	BRD-A06471483-001-06-7	Specs	AE-848/11245282			CCCCC1SC(NN=Cc2ccco2)=NC1=O	InChI=1S/C12H15N3O2S/c1-2-3-6-10-11(16)14-12(18-10)15-13-8-9-5-4-7-17-9/h4-5,7-8,10H,2-3,6H2,1H3,(H,14,15,16)	HKFJXVWFHGANRS-UHFFFAOYSA-N	265.08849744							115698
ENAMINE_004007	LSM-27156	BRD-K60053695, SID22409719	2389179	InChI=1S/C21H20N2O/c24-21(23-15-17-9-3-1-4-10-17)16-22-20-14-8-7-13-19(20)18-11-5-2-6-12-18/h1-14,22H,15-16H2,(H,23,24)	AXXFFGSCUWRDJL-UHFFFAOYSA-N	O=C(CNc1ccccc1c2ccccc2)NCc3ccccc3	BroadT	BRD-K60053695	BRD-K60053695-001-05-0	Enamine Ltd.	T0510-9032			O=C(CNc1ccccc1-c1ccccc1)NCc1ccccc1	InChI=1S/C21H20N2O/c24-21(23-15-17-9-3-1-4-10-17)16-22-20-14-8-7-13-19(20)18-11-5-2-6-12-18/h1-14,22H,15-16H2,(H,23,24)	AXXFFGSCUWRDJL-UHFFFAOYSA-N	316.15756328							115699
3-[1-(3,5-Dichlorophenyl)-1H-1,2,3,4-tetraazol-5-yl]-5-methylisoxazole	LSM-27157	3-1-(3,5-Dichlorophenyl)-1H-1,2,3,4-Tetraazol-5-yl-5-Methylisoxazole, SID26729726	2744841	InChI=1S/C11H7Cl2N5O/c1-6-2-10(15-19-6)11-14-16-17-18(11)9-4-7(12)3-8(13)5-9/h2-5H,1H3	TWGZSIYMQDUBJP-UHFFFAOYSA-N	Cc1onc(c1)c2nnnn2c3cc(Cl)cc(Cl)c3	BroadT	BRD-K49992772	BRD-K49992772-001-06-9	Maybridge	SPB 03621			Cc1cc(no1)-c1nnnn1-c1cc(Cl)cc(Cl)c1	InChI=1S/C11H7Cl2N5O/c1-6-2-10(15-19-6)11-14-16-17-18(11)9-4-7(12)3-8(13)5-9/h2-5H,1H3	TWGZSIYMQDUBJP-UHFFFAOYSA-N	295.002765314							115700
MLS000325352	LSM-27158	BRD-K03309398, SID17386486	1236179	InChI=1S/C21H19N5O3/c1-3-29-20(28)19-24-26(16-11-9-14(2)10-12-16)21-23-17(13-18(27)25(19)21)22-15-7-5-4-6-8-15/h4-13,22H,3H2,1-2H3	XNZKUANASINUDG-UHFFFAOYSA-N	CCOC(=O)C1=NN(C2=NC(=CC(=O)N12)Nc3ccccc3)c4ccc(C)cc4	BroadT	BRD-K03309398	BRD-K03309398-001-06-4	Specs	AP-982/40919003			CCOC(=O)c1nn(-c2ccc(C)cc2)c2nc(Nc3ccccc3)cc(=O)n12	InChI=1S/C21H19N5O3/c1-3-29-20(28)19-24-26(16-11-9-14(2)10-12-16)21-23-17(13-18(27)25(19)21)22-15-7-5-4-6-8-15/h4-13,22H,3H2,1-2H3	XNZKUANASINUDG-UHFFFAOYSA-N	389.148789518							115701
BRD-A83672804	LSM-27159	BRD-A83672804		InChI=1S/C20H16N2O5S/c1-11-9-15(21-27-11)22-17(12-5-3-6-13(10-12)26-2)16(19(24)20(22)25)18(23)14-7-4-8-28-14/h3-10,16-17H,1-2H3	UYJKWFGMIFMGBE-UHFFFAOYSA-N	COc1cccc(c1)C2C(C(=O)c3cccs3)C(=O)C(=O)N2c4cc(C)on4	BroadT	BRD-A83672804	BRD-A83672804-001-05-0	InterBioScreen Ltd.	STOCK3S-85791			COc1cccc(c1)C1C(C(=O)c2cccs2)C(=O)C(=O)N1c1cc(C)on1	InChI=1S/C20H16N2O5S/c1-11-9-15(21-27-11)22-17(12-5-3-6-13(10-12)26-2)16(19(24)20(22)25)18(23)14-7-4-8-28-14/h3-10,16-17H,1-2H3	UYJKWFGMIFMGBE-UHFFFAOYSA-N	396.077992322							115702
129880-85-9	LSM-27160	BRD-K86998514, SID24827723	2326533	InChI=1S/C14H14N2O2S/c17-10-12-13(11-4-2-1-3-5-11)15-14(19-12)16-6-8-18-9-7-16/h1-5,10H,6-9H2	OFUUYKAZFQDERO-UHFFFAOYSA-N	O=Cc1sc(nc1c2ccccc2)N3CCOCC3	BroadT	BRD-K86998514	BRD-K86998514-001-03-0	Enamine Ltd.	T0504-7721			O=Cc1sc(nc1-c1ccccc1)N1CCOCC1	InChI=1S/C14H14N2O2S/c17-10-12-13(11-4-2-1-3-5-11)15-14(19-12)16-6-8-18-9-7-16/h1-5,10H,6-9H2	OFUUYKAZFQDERO-UHFFFAOYSA-N	274.077598398							115703
AC1MXE62	LSM-27161	BRD-K87669982	3788999	InChI=1S/C22H19N5O2/c1-16-20(14-24-25-22-12-11-18(13-23-22)27(28)29)19-9-5-6-10-21(19)26(16)15-17-7-3-2-4-8-17/h2-14H,15H2,1H3,(H,23,25)	DTSYLCWIQGTBHQ-UHFFFAOYSA-N	Cc1c(C=NNc2ccc(cn2)[N+](=O)[O-])c3ccccc3n1Cc4ccccc4	BroadT	BRD-K87669982	BRD-K87669982-001-06-2	InterBioScreen Ltd.	STOCK2S-38524			Cc1c(C=NNc2ccc(cn2)[N+]([O-])=O)c2ccccc2n1Cc1ccccc1	InChI=1S/C22H19N5O2/c1-16-20(14-24-25-22-12-11-18(13-23-22)27(28)29)19-9-5-6-10-21(19)26(16)15-17-7-3-2-4-8-17/h2-14H,15H2,1H3,(H,23,25)	DTSYLCWIQGTBHQ-UHFFFAOYSA-N	385.153874898							115704
MLS000730821	LSM-44205	BRD-K60780031, SID24814035	16194205	InChI=1S/C23H18ClN3O2S/c1-27-19-11-17(22(28)26-14-15-5-4-10-25-13-15)8-9-20(19)30-21(23(27)29)12-16-6-2-3-7-18(16)24/h2-13H,14H2,1H3,(H,26,28)/b21-12-	DQWWOGMLOVWNHI-MTJSOVHGSA-N	CN1C(=O)\C(=C\c2ccccc2Cl)\Sc3ccc(cc13)C(=O)NCc4cccnc4	BroadT	BRD-K60780031	BRD-K60780031-001-06-9	ChemDiv Inc.	C310-2512			CN1C(=O)\C(Sc2ccc(cc12)C(=O)NCc1cccnc1)=C\c1ccccc1Cl	InChI=1S/C23H18ClN3O2S/c1-27-19-11-17(22(28)26-14-15-5-4-10-25-13-15)8-9-20(19)30-21(23(27)29)12-16-6-2-3-7-18(16)24/h2-13H,14H2,1H3,(H,26,28)/b21-12-	DQWWOGMLOVWNHI-MTJSOVHGSA-N	435.080825246							
JDUMTSOFUMWLJQ-UHFFFAOYSA-N	LSM-27163	BRD-K16357911, SID14726808	570268	InChI=1S/C16H12N2O3/c17-15(19)14-13(11-8-4-5-9-12(11)21-14)18-16(20)10-6-2-1-3-7-10/h1-9H,(H2,17,19)(H,18,20)	JDUMTSOFUMWLJQ-UHFFFAOYSA-N	NC(=O)c1oc2ccccc2c1NC(=O)c3ccccc3	BroadT	BRD-K16357911	BRD-K16357911-001-05-8	Asinex Ltd.	BAS 01508074			NC(=O)c1oc2ccccc2c1NC(=O)c1ccccc1	InChI=1S/C16H12N2O3/c17-15(19)14-13(11-8-4-5-9-12(11)21-14)18-16(20)10-6-2-1-3-7-10/h1-9H,(H2,17,19)(H,18,20)	JDUMTSOFUMWLJQ-UHFFFAOYSA-N	280.084792264							115706
AC1LZANI	LSM-44206	BRD-K65626032	1917653	InChI=1S/C19H19N3O5/c1-26-17-9-8-15(12-18(17)27-2)13-19(23)21-20-10-4-6-14-5-3-7-16(11-14)22(24)25/h3-12H,13H2,1-2H3,(H,21,23)/b6-4+,20-10?	SBCWZYDVFQSFID-YFICEVNTSA-N	COc1ccc(CC(=O)NN=C\C=C\c2cccc(c2)[N+](=O)[O-])cc1OC	BroadT	BRD-K65626032	BRD-K65626032-001-04-3	InterBioScreen Ltd.	STOCK2S-12363			COc1ccc(CC(=O)NN=C\C=C\c2cccc(c2)[N+]([O-])=O)cc1OC	InChI=1S/C19H19N3O5/c1-26-17-9-8-15(12-18(17)27-2)13-19(23)21-20-10-4-6-14-5-3-7-16(11-14)22(24)25/h3-12H,13H2,1-2H3,(H,21,23)/b6-4+,20-10?	SBCWZYDVFQSFID-YFICEVNTSA-N	369.132470738							
ST061143	LSM-27165	SID852501, BRD-K62833556	655126	InChI=1S/C15H15ClN2O3/c16-12-10-11(17-15(19)14-2-1-7-21-14)3-4-13(12)18-5-8-20-9-6-18/h1-4,7,10H,5-6,8-9H2,(H,17,19)	WRGUVNXNRMCKCI-UHFFFAOYSA-N	Clc1cc(NC(=O)c2occc2)ccc1N3CCOCC3	BroadT	BRD-K62833556	BRD-K62833556-001-05-1	Asinex Ltd.	BAS 01065957			Clc1cc(NC(=O)c2ccco2)ccc1N1CCOCC1	InChI=1S/C15H15ClN2O3/c16-12-10-11(17-15(19)14-2-1-7-21-14)3-4-13(12)18-5-8-20-9-6-18/h1-4,7,10H,5-6,8-9H2,(H,17,19)	WRGUVNXNRMCKCI-UHFFFAOYSA-N	306.07712007							115708
F0545-0045	LSM-27166	BRD-K43468685, SID7970791	3529029	InChI=1S/C20H17N3OS2/c24-19(22-20-21-10-11-25-20)14-26-18-13-23(12-15-6-2-1-3-7-15)17-9-5-4-8-16(17)18/h1-11,13H,12,14H2,(H,21,22,24)	PGZBYZSNZQTPID-UHFFFAOYSA-N	O=C(CSc1cn(Cc2ccccc2)c3ccccc13)Nc4nccs4	BroadT	BRD-K43468685	BRD-K43468685-001-05-4	Life Chemicals Inc.	F0545-0045			O=C(CSc1cn(Cc2ccccc2)c2ccccc12)Nc1nccs1	InChI=1S/C20H17N3OS2/c24-19(22-20-21-10-11-25-20)14-26-18-13-23(12-15-6-2-1-3-7-15)17-9-5-4-8-16(17)18/h1-11,13H,12,14H2,(H,21,22,24)	PGZBYZSNZQTPID-UHFFFAOYSA-N	379.081303574							115709
STK368736	LSM-27167	BRD-A68175400, SID22404374	2829551	InChI=1S/C13H14F3NO5/c1-17(11(19)22-3)9-6-4-8(5-7-9)12(20,10(18)21-2)13(14,15)16/h4-7,20H,1-3H3	AYHCDPNOUNUKBK-UHFFFAOYSA-N	COC(=O)N(C)c1ccc(cc1)C(O)(C(=O)OC)C(F)(F)F	BroadT	BRD-A68175400	BRD-A68175400-001-05-1	Specs	AG-690/40092698			COC(=O)N(C)c1ccc(cc1)C(O)(C(=O)OC)C(F)(F)F	InChI=1S/C13H14F3NO5/c1-17(11(19)22-3)9-6-4-8(5-7-9)12(20,10(18)21-2)13(14,15)16/h4-7,20H,1-3H3	AYHCDPNOUNUKBK-UHFFFAOYSA-N	321.082407158							115710
MLS000666180	LSM-27168	BRD-A68865339, SID22415210	2925018	InChI=1S/C17H15NO5/c1-11-7-9-13(10-8-11)16(19)12(2)23-17(20)14-5-3-4-6-15(14)18(21)22/h3-10,12H,1-2H3	WCXWRQHRYBYAMT-UHFFFAOYSA-N	CC(OC(=O)c1ccccc1[N+](=O)[O-])C(=O)c2ccc(C)cc2	BroadT	BRD-A68865339	BRD-A68865339-001-05-3	ChemBridge Corporation	7044317			CC(OC(=O)c1ccccc1[N+]([O-])=O)C(=O)c1ccc(C)cc1	InChI=1S/C17H15NO5/c1-11-7-9-13(10-8-11)16(19)12(2)23-17(20)14-5-3-4-6-15(14)18(21)22/h3-10,12H,1-2H3	WCXWRQHRYBYAMT-UHFFFAOYSA-N	313.09502259							115711
MLS000035914	LSM-27169	BRD-K56588599, SID50086053, SID853014	655657	InChI=1S/C21H25N5O5S2/c1-5-31-19(28)17-13(2)22-20(33-17)23-16(27)12-32-21-25-24-18(26(21)10-11-29-3)14-6-8-15(30-4)9-7-14/h6-9H,5,10-12H2,1-4H3,(H,22,23,27)	KFOPCWIEXWDMIY-UHFFFAOYSA-N	CCOC(=O)c1sc(NC(=O)CSc2nnc(c3ccc(OC)cc3)n2CCOC)nc1C	BroadT	BRD-K56588599	BRD-K56588599-001-07-4	Asinex Ltd.	ASN 03200691			CCOC(=O)c1sc(NC(=O)CSc2nnc(-c3ccc(OC)cc3)n2CCOC)nc1C	InChI=1S/C21H25N5O5S2/c1-5-31-19(28)17-13(2)22-20(33-17)23-16(27)12-32-21-25-24-18(26(21)10-11-29-3)14-6-8-15(30-4)9-7-14/h6-9H,5,10-12H2,1-4H3,(H,22,23,27)	KFOPCWIEXWDMIY-UHFFFAOYSA-N	491.12971033							115712
AC1LCIVH	LSM-15570	BRD-K79833963	650915	InChI=1S/C24H26N4O2/c29-22(17-27-12-14-30-15-13-27)26-23-19-8-4-5-9-21(19)25-24-20(23)10-11-28(24)16-18-6-2-1-3-7-18/h1-9H,10-17H2,(H,25,26,29)	VFJKMHBQTJARIE-UHFFFAOYSA-N	O=C(CN1CCOCC1)Nc2c3CCN(Cc4ccccc4)c3nc5ccccc25	BroadT	BRD-K79833963	BRD-K79833963-034-05-0	Asinex Ltd.	BAS 00371745		OC(=O)C(=O)O	O=C(CN1CCOCC1)Nc1c2CCN(Cc3ccccc3)c2nc2ccccc12.OC(=O)C(=O)O	InChI=1S/C24H26N4O2.C2H2O4/c29-22(17-27-12-14-30-15-13-27)26-23-19-8-4-5-9-21(19)25-24-20(23)10-11-28(24)16-18-6-2-1-3-7-18;3-1(4)2(5)6/h1-9H,10-17H2,(H,25,26,29);(H,3,4)(H,5,6)	SDEZJLBPQPKBAR-UHFFFAOYSA-N	402.205576112							104206, 104206
ST062472	LSM-27170	BRD-A45607610, SID4259335	2958417	InChI=1S/C11H11N3O2S2/c15-9(8-4-2-6-17-8)12-11-14-13-10(18-11)7-3-1-5-16-7/h2,4,6-7H,1,3,5H2,(H,12,14,15)	FBJGAVUWYMPHHL-UHFFFAOYSA-N	O=C(Nc1nnc(s1)C2CCCO2)c3cccs3	BroadT	BRD-A45607610	BRD-A45607610-001-05-7	ChemBridge Corporation	7846549			O=C(Nc1nnc(s1)C1CCCO1)c1cccs1	InChI=1S/C11H11N3O2S2/c15-9(8-4-2-6-17-8)12-11-14-13-10(18-11)7-3-1-5-16-7/h2,4,6-7H,1,3,5H2,(H,12,14,15)	FBJGAVUWYMPHHL-UHFFFAOYSA-N	281.029268002							115713
BAS 04880619	LSM-27171	BRD-K98601267, SID24807788	1075906	InChI=1S/C18H13N3O2S/c19-12-5-7-13(8-6-12)20-18-21-15(10-24-18)14-9-11-3-1-2-4-16(11)23-17(14)22/h1-10H,19H2,(H,20,21)	SUUGUKZPDTXTBW-UHFFFAOYSA-N	Nc1ccc(Nc2nc(cs2)C3=Cc4ccccc4OC3=O)cc1	BroadT	BRD-K98601267	BRD-K98601267-001-05-0	Asinex Ltd.	BAS 04880619			Nc1ccc(Nc2nc(cs2)-c2cc3ccccc3oc2=O)cc1	InChI=1S/C18H13N3O2S/c19-12-5-7-13(8-6-12)20-18-21-15(10-24-18)14-9-11-3-1-2-4-16(11)23-17(14)22/h1-10H,19H2,(H,20,21)	SUUGUKZPDTXTBW-UHFFFAOYSA-N	335.072847376							115714
MLS000522343	LSM-27172	SID14731772, BRD-K36120694	6619057	InChI=1S/C19H15ClN4O2/c1-26-14-7-4-12-9-15-18(21)23-24(19(15)22-16(12)10-14)17(25)8-11-2-5-13(20)6-3-11/h2-7,9-10H,8H2,1H3,(H2,21,23)	GOXQIHPDRMZTOY-UHFFFAOYSA-N	COc1ccc2cc3c(N)nn(C(=O)Cc4ccc(Cl)cc4)c3nc2c1	BroadT	BRD-K36120694	BRD-K36120694-001-04-2	ChemDiv Inc.	C066-3075			COc1ccc2cc3c(N)nn(C(=O)Cc4ccc(Cl)cc4)c3nc2c1	InChI=1S/C19H15ClN4O2/c1-26-14-7-4-12-9-15-18(21)23-24(19(15)22-16(12)10-14)17(25)8-11-2-5-13(20)6-3-11/h2-7,9-10H,8H2,1H3,(H2,21,23)	GOXQIHPDRMZTOY-UHFFFAOYSA-N	366.08835347							115715
CDS1_001449	LSM-27173	BRD-K54814515	3455989	InChI=1S/C22H17ClFN3O/c1-15-9-10-27-20(13-25-28-14-16-3-2-4-19(24)12-16)22(26-21(27)11-15)17-5-7-18(23)8-6-17/h2-13H,14H2,1H3	HVFWLCCZBLOLKI-UHFFFAOYSA-N	Cc1ccn2c(C=NOCc3cccc(F)c3)c(nc2c1)c4ccc(Cl)cc4	BroadT	BRD-K54814515	BRD-K54814515-001-05-1	Key Organics Ltd.	8P-677S			Cc1ccn2c(C=NOCc3cccc(F)c3)c(nc2c1)-c1ccc(Cl)cc1	InChI=1S/C22H17ClFN3O/c1-15-9-10-27-20(13-25-28-14-16-3-2-4-19(24)12-16)22(26-21(27)11-15)17-5-7-18(23)8-6-17/h2-13H,14H2,1H3	HVFWLCCZBLOLKI-UHFFFAOYSA-N	393.104418104							115716
6-Amino-1,3-diphenyl-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile	LSM-27174	BRD-A95904137, SID17513182	5195681	InChI=1S/C28H24N4O4/c1-33-21-14-18(15-22(34-2)26(21)35-3)23-20(16-29)27(30)36-28-24(23)25(17-10-6-4-7-11-17)31-32(28)19-12-8-5-9-13-19/h4-15,23H,30H2,1-3H3	SAVRRISSMPTKQV-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C2C(=C(N)Oc3c2c(nn3c4ccccc4)c5ccccc5)C#N	BroadT	BRD-A95904137	BRD-A95904137-001-06-9	InterBioScreen Ltd.	STOCK3S-78149			COc1cc(cc(OC)c1OC)C1c2c(nn(c2OC(N)=C1C#N)-c1ccccc1)-c1ccccc1	InChI=1S/C28H24N4O4/c1-33-21-14-18(15-22(34-2)26(21)35-3)23-20(16-29)27(30)36-28-24(23)25(17-10-6-4-7-11-17)31-32(28)19-12-8-5-9-13-19/h4-15,23H,30H2,1-3H3	SAVRRISSMPTKQV-UHFFFAOYSA-N	480.179755288							115717
BRD-A88461048	LSM-27175	BRD-A88461048		InChI=1S/C13H15NO2/c1-9-7-11(15)5-6-12(9)14-8-10-3-2-4-13(10)16/h5-8,10,15H,2-4H2,1H3	GCACZWYJITZZPM-UHFFFAOYSA-N	Cc1cc(O)ccc1N=CC2CCCC2=O	BroadT	BRD-A88461048	BRD-A88461048-001-05-9	InterBioScreen Ltd.	STOCK3S-98516			Cc1cc(O)ccc1N=CC1CCCC1=O	InChI=1S/C13H15NO2/c1-9-7-11(15)5-6-12(9)14-8-10-3-2-4-13(10)16/h5-8,10,15H,2-4H2,1H3	GCACZWYJITZZPM-UHFFFAOYSA-N	217.11027873							115718
4-[4-(4-Methylphenyl)-2-pyrimidinyl]benzenol	LSM-27176	BRD-K86491317, SID24820677	5524417	InChI=1S/C17H14N2O/c1-12-2-4-13(5-3-12)16-10-11-18-17(19-16)14-6-8-15(20)9-7-14/h2-11,20H,1H3	VDFQHZOBBWXIHT-UHFFFAOYSA-N	Cc1ccc(cc1)c2ccnc(n2)c3ccc(O)cc3	BroadT	BRD-K86491317	BRD-K86491317-001-05-0	Key Organics Ltd.	10P-121			Cc1ccc(cc1)-c1ccnc(n1)-c1ccc(O)cc1	InChI=1S/C17H14N2O/c1-12-2-4-13(5-3-12)16-10-11-18-17(19-16)14-6-8-15(20)9-7-14/h2-11,20H,1H3	VDFQHZOBBWXIHT-UHFFFAOYSA-N	262.110613088							
ZINC03208149	LSM-27177	BRD-K73556828, SID22401639	2329166	InChI=1S/C19H15ClN2O3S/c1-11-17(9-12-2-7-15-16(8-12)25-10-24-15)26-19(21-11)22-18(23)13-3-5-14(20)6-4-13/h2-8H,9-10H2,1H3,(H,21,22,23)	WOLZFGWIQVCIDK-UHFFFAOYSA-N	Cc1nc(NC(=O)c2ccc(Cl)cc2)sc1Cc3ccc4OCOc4c3	BroadT	BRD-K73556828	BRD-K73556828-001-05-7	Enamine Ltd.	T0504-9728			Cc1nc(NC(=O)c2ccc(Cl)cc2)sc1Cc1ccc2OCOc2c1	InChI=1S/C19H15ClN2O3S/c1-11-17(9-12-2-7-15-16(8-12)25-10-24-15)26-19(21-11)22-18(23)13-3-5-14(20)6-4-13/h2-8H,9-10H2,1H3,(H,21,22,23)	WOLZFGWIQVCIDK-UHFFFAOYSA-N	386.04919076							115720
MLS000704231	LSM-27178	BRD-K66841501, SID22404689	3568622	InChI=1S/C15H11ClN4O4S/c16-11-7-3-1-5-9(11)14(22)18-19-15(25)17-13(21)10-6-2-4-8-12(10)20(23)24/h1-8H,(H,18,22)(H2,17,19,21,25)	GWDIGPDYYXVEDK-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1C(=O)NC(=S)NNC(=O)c2ccccc2Cl	BroadT	BRD-K66841501	BRD-K66841501-001-05-6	Specs	AN-329/41563394			[O-][N+](=O)c1ccccc1C(=O)NC(=S)NNC(=O)c1ccccc1Cl	InChI=1S/C15H11ClN4O4S/c16-11-7-3-1-5-9(11)14(22)18-19-15(25)17-13(21)10-6-2-4-8-12(10)20(23)24/h1-8H,(H,18,22)(H2,17,19,21,25)	GWDIGPDYYXVEDK-UHFFFAOYSA-N	378.018953272							115721
AC1MUS4J	LSM-15227	BRD-K24350933	3623274	InChI=1S/C19H18N4OS/c1-13(15-6-4-3-5-7-15)22-23-19-21-18(12-25-19)16-8-10-17(11-9-16)20-14(2)24/h3-12H,1-2H3,(H,20,24)(H,21,23)	CPAWHXGQQUWODG-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)c2csc(NN=C(C)c3ccccc3)n2	BroadT	BRD-K24350933	BRD-K24350933-004-05-1	InterBioScreen Ltd.	STOCK3S-37977		Br	CC(=O)Nc1ccc(cc1)-c1csc(NN=C(C)c2ccccc2)n1.Br	InChI=1S/C19H18N4OS.BrH/c1-13(15-6-4-3-5-7-15)22-23-19-21-18(12-25-19)16-8-10-17(11-9-16)20-14(2)24;/h3-12H,1-2H3,(H,20,24)(H,21,23);1H	MNMRRTFKFZZACC-UHFFFAOYSA-N	350.120131926							103874
STK846565	LSM-27179	BRD-K32021110, SID7969913	1119296	InChI=1S/C19H17BrN2O2/c20-14-6-7-16-15(12-14)17(13-4-2-1-3-5-13)18(19(23)21-16)22-8-10-24-11-9-22/h1-7,12H,8-11H2,(H,21,23)	XLACUUBVCXQYMT-UHFFFAOYSA-N	Oc1nc2ccc(Br)cc2c(c3ccccc3)c1N4CCOCC4	BroadT	BRD-K32021110	BRD-K32021110-001-04-2	Life Chemicals Inc.	F0431-0076			Oc1nc2ccc(Br)cc2c(-c2ccccc2)c1N1CCOCC1	InChI=1S/C19H17BrN2O2/c20-14-6-7-16-15(12-14)17(13-4-2-1-3-5-13)18(19(23)21-16)22-8-10-24-11-9-22/h1-7,12H,8-11H2,(H,21,23)	XLACUUBVCXQYMT-UHFFFAOYSA-N	384.047340404							115722
AC1MGDMC	LSM-15401	BRD-A09243694	2984507	InChI=1S/C17H26ClNO2/c1-2-3-8-17(20,15-4-6-16(18)7-5-15)9-10-19-11-13-21-14-12-19/h4-7,20H,2-3,8-14H2,1H3	JQGJZCGPFJCXDL-UHFFFAOYSA-N	CCCCC(O)(CCN1CCOCC1)c2ccc(Cl)cc2	BroadT	BRD-A09243694	BRD-A09243694-003-05-0	ChemBridge Corporation	7991016		Cl	CCCCC(O)(CCN1CCOCC1)c1ccc(Cl)cc1.Cl	InChI=1S/C17H26ClNO2.ClH/c1-2-3-8-17(20,15-4-6-16(18)7-5-15)9-10-19-11-13-21-14-12-19;/h4-7,20H,2-3,8-14H2,1H3;1H	KKCWAVVBDYZONJ-UHFFFAOYSA-N	311.165206792							104043, 104043
1-Benzyl-4-(benzylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine	LSM-27180	BRD-K71419092, SID14743446	3842823	InChI=1S/C19H16N4S/c1-3-7-15(8-4-1)12-23-18-17(11-22-23)19(21-14-20-18)24-13-16-9-5-2-6-10-16/h1-11,14H,12-13H2	SVEGGFBAMCRNEL-UHFFFAOYSA-N	C(Sc1ncnc2c1cnn2Cc3ccccc3)c4ccccc4	BroadT	BRD-K71419092	BRD-K71419092-001-05-9	InterBioScreen Ltd.	STOCK5S-16555			C(Sc1ncnc2n(Cc3ccccc3)ncc12)c1ccccc1	InChI=1S/C19H16N4S/c1-3-7-15(8-4-1)12-23-18-17(11-22-23)19(21-14-20-18)24-13-16-9-5-2-6-10-16/h1-11,14H,12-13H2	SVEGGFBAMCRNEL-UHFFFAOYSA-N	332.109567242							115723
T0511-3349	LSM-27181	SID24830271, BRD-K07365255	4173597	InChI=1S/C17H21NO2S/c19-15(11-21-16-3-1-2-4-18(16)20)17-8-12-5-13(9-17)7-14(6-12)10-17/h1-4,12-14H,5-11H2	MWTSSRQBQIHWBR-UHFFFAOYSA-N	[O-][n+]1ccccc1SCC(=O)C23CC4CC(CC(C4)C2)C3	BroadT	BRD-K07365255	BRD-K07365255-001-05-6	Enamine Ltd.	T0511-3349			[O-][n+]1ccccc1SCC(=O)C12CC3CC(CC(C3)C1)C2	InChI=1S/C17H21NO2S/c19-15(11-21-16-3-1-2-4-18(16)20)17-8-12-5-13(9-17)7-14(6-12)10-17/h1-4,12-14H,5-11H2	MWTSSRQBQIHWBR-UHFFFAOYSA-N	303.129299612							115724
11H-336S	LSM-27182	BRD-K61438422, SID14730210	2767159	InChI=1S/C20H13ClN2O3/c1-25-17-4-2-3-14(11-17)18-10-7-15(12-22)19(23-18)26-20(24)13-5-8-16(21)9-6-13/h2-11H,1H3	XDFHBSRFYYCUAV-UHFFFAOYSA-N	COc1cccc(c1)c2ccc(C#N)c(OC(=O)c3ccc(Cl)cc3)n2	BroadT	BRD-K61438422	BRD-K61438422-001-05-2	Key Organics Ltd.	11H-336S			COc1cccc(c1)-c1ccc(C#N)c(OC(=O)c2ccc(Cl)cc2)n1	InChI=1S/C20H13ClN2O3/c1-25-17-4-2-3-14(11-17)18-10-7-15(12-22)19(23-18)26-20(24)13-5-8-16(21)9-6-13/h2-11H,1H3	XDFHBSRFYYCUAV-UHFFFAOYSA-N	364.061470006							115725
SMR000151081	LSM-27183	BRD-A99644411, SID16953455	4882792	InChI=1S/C23H24N4OS/c24-13-18-20(25)27-22(19(21(26)28)23(18)11-4-1-5-12-23)29-14-16-9-6-8-15-7-2-3-10-17(15)16/h2-3,6-10,19H,1,4-5,11-12,14,25H2,(H2,26,28)	VCRLZNBGAQEQIJ-UHFFFAOYSA-N	NC(=O)C1C(=NC(=C(C#N)C12CCCCC2)N)SCc3cccc4ccccc34	BroadT	BRD-A99644411	BRD-A99644411-001-05-6	Enamine Ltd.	T5327341			NC(=O)C1C(SCc2cccc3ccccc23)=NC(N)=C(C#N)C11CCCCC1	InChI=1S/C23H24N4OS/c24-13-18-20(25)27-22(19(21(26)28)23(18)11-4-1-5-12-23)29-14-16-9-6-8-15-7-2-3-10-17(15)16/h2-3,6-10,19H,1,4-5,11-12,14,25H2,(H2,26,28)	VCRLZNBGAQEQIJ-UHFFFAOYSA-N	404.167082118							115726
ZINC02910870	LSM-27184	BRD-K35491869, SID22415927	2255031	InChI=1S/C12H15ClN2OS/c1-8(2)7-14-12(17)15-11(16)9-3-5-10(13)6-4-9/h3-6,8H,7H2,1-2H3,(H2,14,15,16,17)	STHGYDPUKPWQSD-UHFFFAOYSA-N	CC(C)CNC(=S)NC(=O)c1ccc(Cl)cc1	BroadT	BRD-K35491869	BRD-K35491869-001-05-4	ChemBridge Corporation	6684157			CC(C)CNC(=S)NC(=O)c1ccc(Cl)cc1	InChI=1S/C12H15ClN2OS/c1-8(2)7-14-12(17)15-11(16)9-3-5-10(13)6-4-9/h3-6,8H,7H2,1-2H3,(H2,14,15,16,17)	STHGYDPUKPWQSD-UHFFFAOYSA-N	270.05936152							115727
MLS000705115	LSM-27185	BRD-K91937280, SID24786906	839457	InChI=1S/C16H14ClNO4/c1-2-22-14-7-6-10(9-13(14)17)15(19)18-12-5-3-4-11(8-12)16(20)21/h3-9H,2H2,1H3,(H,18,19)(H,20,21)	VWSMSCNGEPAHSW-UHFFFAOYSA-N	CCOc1ccc(cc1Cl)C(=O)Nc2cccc(c2)C(=O)O	BroadT	BRD-K91937280	BRD-K91937280-001-05-8	Specs	AN-979/41714108			CCOc1ccc(cc1Cl)C(=O)Nc1cccc(c1)C(O)=O	InChI=1S/C16H14ClNO4/c1-2-22-14-7-6-10(9-13(14)17)15(19)18-12-5-3-4-11(8-12)16(20)21/h3-9H,2H2,1H3,(H,18,19)(H,20,21)	VWSMSCNGEPAHSW-UHFFFAOYSA-N	319.061135648							115728
F3096-1642	LSM-27186	BRD-K77609086, SID104219270, SID7974870	679960	InChI=1S/C18H20N2O2/c1-14-2-4-15(5-3-14)18(21)19-16-6-8-17(9-7-16)20-10-12-22-13-11-20/h2-9H,10-13H2,1H3,(H,19,21)	SEUFBHGLOPINDD-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)Nc2ccc(cc2)N3CCOCC3	BroadT	BRD-K77609086	BRD-K77609086-001-05-7	ChemBridge Corporation	5620268			Cc1ccc(cc1)C(=O)Nc1ccc(cc1)N1CCOCC1	InChI=1S/C18H20N2O2/c1-14-2-4-15(5-3-14)18(21)19-16-6-8-17(9-7-16)20-10-12-22-13-11-20/h2-9H,10-13H2,1H3,(H,19,21)	SEUFBHGLOPINDD-UHFFFAOYSA-N	296.1524779							115729
SMR000024367	LSM-27187	BRD-K50075939, SID4242508	3237354	InChI=1S/C14H12Cl2N2O2/c1-2-20-12-5-3-9(7-11(12)16)14(19)18-13-6-4-10(15)8-17-13/h3-8H,2H2,1H3,(H,17,18,19)	RBIAGCKCFJYTQH-UHFFFAOYSA-N	CCOc1ccc(cc1Cl)C(=O)Nc2ccc(Cl)cn2	BroadT	BRD-K50075939	BRD-K50075939-001-05-1	ChemDiv Inc.	3617-0723			CCOc1ccc(cc1Cl)C(=O)Nc1ccc(Cl)cn1	InChI=1S/C14H12Cl2N2O2/c1-2-20-12-5-3-9(7-11(12)16)14(19)18-13-6-4-10(15)8-17-13/h3-8H,2H2,1H3,(H,17,18,19)	RBIAGCKCFJYTQH-UHFFFAOYSA-N	310.027583064							115730
MLS000522627	LSM-27188	SID14733385, BRD-K96893659	6619932	InChI=1S/C21H24N2OS/c24-21(22-11-5-2-6-12-22)18-9-10-20-19(15-18)23(13-14-25-20)16-17-7-3-1-4-8-17/h1,3-4,7-10,15H,2,5-6,11-14,16H2	NCFMUKJXYRXFJE-UHFFFAOYSA-N	O=C(N1CCCCC1)c2ccc3SCCN(Cc4ccccc4)c3c2	BroadT	BRD-K96893659	BRD-K96893659-001-04-4	ChemDiv Inc.	C699-0273			O=C(N1CCCCC1)c1ccc2SCCN(Cc3ccccc3)c2c1	InChI=1S/C21H24N2OS/c24-21(22-11-5-2-6-12-22)18-9-10-20-19(15-18)23(13-14-25-20)16-17-7-3-1-4-8-17/h1,3-4,7-10,15H,2,5-6,11-14,16H2	NCFMUKJXYRXFJE-UHFFFAOYSA-N	352.160934098							115731
SMR000096903	LSM-27189	BRD-A26343863, SID7966726	3457780	InChI=1S/C16H21N5O2S/c1-11-6-3-4-9-21(11)16-20-19-15(24-16)18-14(22)17-12-7-5-8-13(10-12)23-2/h5,7-8,10-11H,3-4,6,9H2,1-2H3,(H2,17,18,19,22)	JJFHYFRHANDDTO-UHFFFAOYSA-N	COc1cccc(NC(=O)Nc2nnc(s2)N3CCCCC3C)c1	BroadT	BRD-A26343863	BRD-A26343863-001-04-9	ChemDiv Inc.	E002-0153			COc1cccc(NC(=O)Nc2nnc(s2)N2CCCCC2C)c1	InChI=1S/C16H21N5O2S/c1-11-6-3-4-9-21(11)16-20-19-15(24-16)18-14(22)17-12-7-5-8-13(10-12)23-2/h5,7-8,10-11H,3-4,6,9H2,1-2H3,(H2,17,18,19,22)	JJFHYFRHANDDTO-UHFFFAOYSA-N	347.141595652							115732
BAS 03324442	LSM-27190	BRD-K43684831, SID849379	651868	InChI=1S/C17H14N2O4/c1-10-5-3-8-14(18-10)19-16(20)12-9-11-6-4-7-13(22-2)15(11)23-17(12)21/h3-9H,1-2H3,(H,18,19,20)	MTOLMGWWKLVWAL-UHFFFAOYSA-N	COc1cccc2C=C(C(=O)Nc3cccc(C)n3)C(=O)Oc12	BroadT	BRD-K43684831	BRD-K43684831-001-05-9	Asinex Ltd.	BAS 03324442			COc1cccc2cc(C(=O)Nc3cccc(C)n3)c(=O)oc12	InChI=1S/C17H14N2O4/c1-10-5-3-8-14(18-10)19-16(20)12-9-11-6-4-7-13(22-2)15(11)23-17(12)21/h3-9H,1-2H3,(H,18,19,20)	MTOLMGWWKLVWAL-UHFFFAOYSA-N	310.095356948							115733
MLS000579851	LSM-27191	BRD-K31806725, SID17432169	2015219	InChI=1S/C17H20N2OS2/c1-13-7-9-14(10-8-13)22-12-11-18-17(21)19-15-5-3-4-6-16(15)20-2/h3-10H,11-12H2,1-2H3,(H2,18,19,21)	MKENOLOEEAQRKB-UHFFFAOYSA-N	COc1ccccc1N=C(S)NCCSc2ccc(C)cc2	BroadT	BRD-K31806725	BRD-K31806725-001-05-1	ChemBridge Corporation	7672123			COc1ccccc1N=C(S)NCCSc1ccc(C)cc1	InChI=1S/C17H20N2OS2/c1-13-7-9-14(10-8-13)22-12-11-18-17(21)19-15-5-3-4-6-16(15)20-2/h3-10H,11-12H2,1-2H3,(H2,18,19,21)	MKENOLOEEAQRKB-UHFFFAOYSA-N	332.10170466							115734
AC1OB7GT	LSM-27192	BRD-K79777851	6816390	InChI=1S/C14H13N3O6S/c1-9-2-5-12(7-13(9)17(20)21)24(22,23)16-15-8-10-3-4-11(18)6-14(10)19/h2-8,16,18-19H,1H3	GIRKNDSBKWKUKP-UHFFFAOYSA-N	Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)NN=Cc2ccc(O)cc2O	BroadT	BRD-K79777851	BRD-K79777851-001-05-3	Enamine Ltd.	T0511-3748			Cc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NN=Cc1ccc(O)cc1O	InChI=1S/C14H13N3O6S/c1-9-2-5-12(7-13(9)17(20)21)24(22,23)16-15-8-10-3-4-11(18)6-14(10)19/h2-8,16,18-19H,1H3	GIRKNDSBKWKUKP-UHFFFAOYSA-N	351.052505856							
SMR000016543	LSM-27193	BRD-K27476975, SID7971091	5158448	InChI=1S/C15H15N3O2S/c1-9-13(14(19)16-2)21-15-17-12(8-18(9)15)10-4-6-11(20-3)7-5-10/h4-8H,1-3H3,(H,16,19)	XNVCSLBYGANPNX-UHFFFAOYSA-N	CNC(=O)c1sc2nc(cn2c1C)c3ccc(OC)cc3	BroadT	BRD-K27476975	BRD-K27476975-001-05-6	Life Chemicals Inc.	F0650-0249			CNC(=O)c1sc2nc(cn2c1C)-c1ccc(OC)cc1	InChI=1S/C15H15N3O2S/c1-9-13(14(19)16-2)21-15-17-12(8-18(9)15)10-4-6-11(20-3)7-5-10/h4-8H,1-3H3,(H,16,19)	XNVCSLBYGANPNX-UHFFFAOYSA-N	301.08849744							115736
AC1MX4F2	LSM-27194	BRD-K30782795, SID26660588	3759788	InChI=1S/C10H9BrN4O2/c1-6-9(15(16)17)10(14-13-6)12-8-4-2-7(11)3-5-8/h2-5H,1H3,(H2,12,13,14)	ICLCJLQPWWMXKF-UHFFFAOYSA-N	Cc1n[nH]c(Nc2ccc(Br)cc2)c1[N+](=O)[O-]	BroadT	BRD-K30782795	BRD-K30782795-001-06-8	InterBioScreen Ltd.	STOCK2S-21627			Cc1n[nH]c(Nc2ccc(Br)cc2)c1[N+]([O-])=O	InChI=1S/C10H9BrN4O2/c1-6-9(15(16)17)10(14-13-6)12-8-4-2-7(11)3-5-8/h2-5H,1H3,(H2,12,13,14)	ICLCJLQPWWMXKF-UHFFFAOYSA-N	295.990888168							115737
MLS000039662	LSM-27195	BRD-K39688447, SID865550	666809	InChI=1S/C18H21N3O2/c1-3-9-21-12-20-15-10-14(7-8-16(15)21)19-11-13-5-4-6-17(23-2)18(13)22/h4-8,10,12,19,22H,3,9,11H2,1-2H3	LTVSJAQANUCADC-UHFFFAOYSA-N	CCCn1cnc2cc(NCc3cccc(OC)c3O)ccc12	BroadT	BRD-K39688447	BRD-K39688447-001-05-2	InterBioScreen Ltd.	STOCK5S-46751			CCCn1cnc2cc(NCc3cccc(OC)c3O)ccc12	InChI=1S/C18H21N3O2/c1-3-9-21-12-20-15-10-14(7-8-16(15)21)19-11-13-5-4-6-17(23-2)18(13)22/h4-8,10,12,19,22H,3,9,11H2,1-2H3	LTVSJAQANUCADC-UHFFFAOYSA-N	311.163376942							115738
MLS000050961	LSM-27196	SID4264225, SID26669009, BRD-K47438870	1248971	InChI=1S/C21H24N2O5S/c1-15-5-7-17(12-20(15)29(25,26)23-9-3-2-4-10-23)21(24)22-13-16-6-8-18-19(11-16)28-14-27-18/h5-8,11-12H,2-4,9-10,13-14H2,1H3,(H,22,24)	CSMNCCQFSPSUPU-UHFFFAOYSA-N	Cc1ccc(cc1S(=O)(=O)N2CCCCC2)C(=O)NCc3ccc4OCOc4c3	BroadT	BRD-K47438870	BRD-K47438870-001-05-8	ChemBridge Corporation	7912050			Cc1ccc(cc1S(=O)(=O)N1CCCCC1)C(=O)NCc1ccc2OCOc2c1	InChI=1S/C21H24N2O5S/c1-15-5-7-17(12-20(15)29(25,26)23-9-3-2-4-10-23)21(24)22-13-16-6-8-18-19(11-16)28-14-27-18/h5-8,11-12H,2-4,9-10,13-14H2,1H3,(H,22,24)	CSMNCCQFSPSUPU-UHFFFAOYSA-N	416.140592578							115739
MLS000666312	LSM-27197	BRD-K75857911, SID22415301	803313	InChI=1S/C19H19N3O3/c1-19(2,3)12-9-7-11(8-10-12)16(23)20-14-6-4-5-13-15(14)18(25)22-21-17(13)24/h4-10H,1-3H3,(H,20,23)(H,21,24)(H,22,25)	IGNFTROUOFNFEO-UHFFFAOYSA-N	CC(C)(C)c1ccc(cc1)C(=O)Nc2cccc3C(=O)NNC(=O)c23	BroadT	BRD-K75857911	BRD-K75857911-001-06-3	ChemBridge Corporation	7009231			CC(C)(C)c1ccc(cc1)C(=O)Nc1cccc2c1c(=O)[nH][nH]c2=O	InChI=1S/C19H19N3O3/c1-19(2,3)12-9-7-11(8-10-12)16(23)20-14-6-4-5-13-15(14)18(25)22-21-17(13)24/h4-10H,1-3H3,(H,20,23)(H,21,24)(H,22,25)	IGNFTROUOFNFEO-UHFFFAOYSA-N	337.142641498							115740
MLS000402289	LSM-27198	BRD-K15591233, SID22402532	2405538	InChI=1S/C18H12ClN3O2S/c19-17-18(21-16-8-4-3-7-15(16)20-17)22-25(23,24)14-10-9-12-5-1-2-6-13(12)11-14/h1-11H,(H,21,22)	SGXPMUXCSGOXQW-UHFFFAOYSA-N	Clc1nc2ccccc2nc1NS(=O)(=O)c3ccc4ccccc4c3	BroadT	BRD-K15591233	BRD-K15591233-001-06-2	Enamine Ltd.	T0520-3083			Clc1nc2ccccc2nc1NS(=O)(=O)c1ccc2ccccc2c1	InChI=1S/C18H12ClN3O2S/c19-17-18(21-16-8-4-3-7-15(16)20-17)22-25(23,24)14-10-9-12-5-1-2-6-13(12)11-14/h1-11H,(H,21,22)	SGXPMUXCSGOXQW-UHFFFAOYSA-N	369.033875054							115741
4-Nitrophenyl quinoline-2-carboxylate	LSM-27199	BRD-K02093145, SID17413876	301065	InChI=1S/C16H10N2O4/c19-16(22-13-8-6-12(7-9-13)18(20)21)15-10-5-11-3-1-2-4-14(11)17-15/h1-10H	ASTICKBBDNPFLV-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(OC(=O)c2ccc3ccccc3n2)cc1	BroadT	BRD-K02093145	BRD-K02093145-001-05-3	ChemBridge Corporation	7959756			[O-][N+](=O)c1ccc(OC(=O)c2ccc3ccccc3n2)cc1	InChI=1S/C16H10N2O4/c19-16(22-13-8-6-12(7-9-13)18(20)21)15-10-5-11-3-1-2-4-14(11)17-15/h1-10H	ASTICKBBDNPFLV-UHFFFAOYSA-N	294.06405682							115742
1-(2,4-Dichlorophenyl)-5-(dimethylamino)-1,4-pentadien-3-one	LSM-44207	BRD-K00502656, SID24821504	5398509	InChI=1S/C13H13Cl2NO/c1-16(2)8-7-12(17)6-4-10-3-5-11(14)9-13(10)15/h3-9H,1-2H3/b6-4+,8-7+	NPWVLJBJSWANRE-GFGVWQOPSA-N	CN(C)\C=C\C(=O)\C=C\c1ccc(Cl)cc1Cl	BroadT	BRD-K00502656	BRD-K00502656-001-05-6	Key Organics Ltd.	4L-035			CN(C)\C=C\C(=O)\C=C\c1ccc(Cl)cc1Cl	InChI=1S/C13H13Cl2NO/c1-16(2)8-7-12(17)6-4-10-3-5-11(14)9-13(10)15/h3-9H,1-2H3/b6-4+,8-7+	NPWVLJBJSWANRE-GFGVWQOPSA-N	269.037419466							
N-[3-(2-Phenyl-1,3-thiazol-4-yl)phenyl]propanamide	LSM-27201	BRD-K04562748, SID17506429	737888	InChI=1S/C18H16N2OS/c1-2-17(21)19-15-10-6-9-14(11-15)16-12-22-18(20-16)13-7-4-3-5-8-13/h3-12H,2H2,1H3,(H,19,21)	AREXEJCINWJIMP-UHFFFAOYSA-N	CCC(=O)Nc1cccc(c1)c2csc(n2)c3ccccc3	BroadT	BRD-K04562748	BRD-K04562748-001-05-6	ChemBridge Corporation	6016040			CCC(=O)Nc1cccc(c1)-c1csc(n1)-c1ccccc1	InChI=1S/C18H16N2OS/c1-2-17(21)19-15-10-6-9-14(11-15)16-12-22-18(20-16)13-7-4-3-5-8-13/h3-12H,2H2,1H3,(H,19,21)	AREXEJCINWJIMP-UHFFFAOYSA-N	308.098333842							115744
573950-75-1	LSM-27202	BRD-K23793049, SID26666767, SID85176583	936364	InChI=1S/C11H12ClN5/c1-7-3-2-4-8(5-7)14-11-16-9(6-12)15-10(13)17-11/h2-5H,6H2,1H3,(H3,13,14,15,16,17)	RRFIGUHVIZZXQT-UHFFFAOYSA-N	Cc1cccc(Nc2nc(N)nc(CCl)n2)c1	BroadT	BRD-K23793049	BRD-K23793049-001-06-8	InterBioScreen Ltd.	STOCK4S-14981			Cc1cccc(Nc2nc(N)nc(CCl)n2)c1	InChI=1S/C11H12ClN5/c1-7-3-2-4-8(5-7)14-11-16-9(6-12)15-10(13)17-11/h2-5H,6H2,1H3,(H3,13,14,15,16,17)	RRFIGUHVIZZXQT-UHFFFAOYSA-N	249.078123144							115745
SMR000177677	LSM-27203	SID17409072, BRD-A19615705	2893671	InChI=1S/C27H24N2O3/c1-32-22-14-7-13-21(17-22)25(29-27(31)20-10-3-2-4-11-20)18-26(30)28-24-16-8-12-19-9-5-6-15-23(19)24/h2-17,25H,18H2,1H3,(H,28,30)(H,29,31)	HOVMMDREJSUEDD-UHFFFAOYSA-N	COc1cccc(c1)C(CC(=O)Nc2cccc3ccccc23)NC(=O)c4ccccc4	BroadT	BRD-A19615705	BRD-A19615705-001-06-6	Asinex Ltd.	BAS 02729778			COc1cccc(c1)C(CC(=O)Nc1cccc2ccccc12)NC(=O)c1ccccc1	InChI=1S/C27H24N2O3/c1-32-22-14-7-13-21(17-22)25(29-27(31)20-10-3-2-4-11-20)18-26(30)28-24-16-8-12-19-9-5-6-15-23(19)24/h2-17,25H,18H2,1H3,(H,28,30)(H,29,31)	HOVMMDREJSUEDD-UHFFFAOYSA-N	424.178692648							115746
3-Methyl-n-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]butanamide	LSM-27204	BRD-K14269958, SID22415267	704822	InChI=1S/C19H18N2O3/c1-12(2)11-17(22)20-14-9-7-13(8-10-14)18-21-16-6-4-3-5-15(16)19(23)24-18/h3-10,12H,11H2,1-2H3,(H,20,22)	GOIRMFYSMBQYEW-UHFFFAOYSA-N	CC(C)CC(=O)Nc1ccc(cc1)C2=Nc3ccccc3C(=O)O2	BroadT	BRD-K14269958	BRD-K14269958-001-05-1	ChemBridge Corporation	7036833			CC(C)CC(=O)Nc1ccc(cc1)-c1nc2ccccc2c(=O)o1	InChI=1S/C19H18N2O3/c1-12(2)11-17(22)20-14-9-7-13(8-10-14)18-21-16-6-4-3-5-15(16)19(23)24-18/h3-10,12H,11H2,1-2H3,(H,20,22)	GOIRMFYSMBQYEW-UHFFFAOYSA-N	322.131742456							115747
MLS000034267	LSM-27205	BRD-K04367224, SID843813	646118	InChI=1S/C17H21N5O/c1-4-15-12(2)21-17-19-11-20-22(17)16(15)18-10-9-13-5-7-14(23-3)8-6-13/h5-8,11,18H,4,9-10H2,1-3H3	MJLCBZGLWGWHSA-UHFFFAOYSA-N	CCc1c(C)nc2ncnn2c1NCCc3ccc(OC)cc3	BroadT	BRD-K04367224	BRD-K04367224-001-06-1	Asinex Ltd.	ASN 07102669			CCc1c(C)nc2ncnn2c1NCCc1ccc(OC)cc1	InChI=1S/C17H21N5O/c1-4-15-12(2)21-17-19-11-20-22(17)16(15)18-10-9-13-5-7-14(23-3)8-6-13/h5-8,11,18H,4,9-10H2,1-3H3	MJLCBZGLWGWHSA-UHFFFAOYSA-N	311.174610342							115748
T0516-7975	LSM-27206	BRD-K59518944, SID24841317	4612148	InChI=1S/C19H16N4O2S/c20-18-17(26(24,25)13-6-2-1-3-7-13)16-19(23(18)12-10-11-12)22-15-9-5-4-8-14(15)21-16/h1-9,12H,10-11,20H2	NRYCOPTUAJGUTC-UHFFFAOYSA-N	Nc1c(c2nc3ccccc3nc2n1C4CC4)S(=O)(=O)c5ccccc5	BroadT	BRD-K59518944	BRD-K59518944-001-05-4	Enamine Ltd.	T0516-7975			Nc1c(c2nc3ccccc3nc2n1C1CC1)S(=O)(=O)c1ccccc1	InChI=1S/C19H16N4O2S/c20-18-17(26(24,25)13-6-2-1-3-7-13)16-19(23(18)12-10-11-12)22-15-9-5-4-8-14(15)21-16/h1-9,12H,10-11,20H2	NRYCOPTUAJGUTC-UHFFFAOYSA-N	364.099396482							115749
ZINC27520074	LSM-27207	BRD-K00767817	92847301	InChI=1S/C21H15ClN4O5/c22-16-5-1-3-13(9-16)20(28)24-17-6-2-4-14(10-17)21(29)25-23-12-15-11-18(26(30)31)7-8-19(15)27/h1-12,27H,(H,24,28)(H,25,29)	XGYMJVFWAURNHR-UHFFFAOYSA-N	Oc1ccc(cc1C=NNC(=O)c2cccc(NC(=O)c3cccc(Cl)c3)c2)[N+](=O)[O-]	BroadT	BRD-K00767817	BRD-K00767817-001-08-5	ChemDiv Inc.	2262-2507			Oc1ccc(cc1C=NNC(=O)c1cccc(NC(=O)c2cccc(Cl)c2)c1)[N+]([O-])=O	InChI=1S/C21H15ClN4O5/c22-16-5-1-3-13(9-16)20(28)24-17-6-2-4-14(10-17)21(29)25-23-12-15-11-18(26(30)31)7-8-19(15)27/h1-12,27H,(H,24,28)(H,25,29)	XGYMJVFWAURNHR-UHFFFAOYSA-N	438.07309733							
SMR000032373	LSM-27208	BRD-K01297681, SID4247527	3241729	InChI=1S/C17H22N4O2/c1-13-4-6-14(7-5-13)15-8-9-17(23)21(19-15)12-16(22)18-10-11-20(2)3/h4-9H,10-12H2,1-3H3,(H,18,22)	ZFNAWHPUCPSXBF-UHFFFAOYSA-N	CN(C)CCNC(=O)CN1N=C(C=CC1=O)c2ccc(C)cc2	BroadT	BRD-K01297681	BRD-K01297681-001-05-1	ChemDiv Inc.	K786-7547			CN(C)CCNC(=O)Cn1nc(ccc1=O)-c1ccc(C)cc1	InChI=1S/C17H22N4O2/c1-13-4-6-14(7-5-13)15-8-9-17(23)21(19-15)12-16(22)18-10-11-20(2)3/h4-9H,10-12H2,1-3H3,(H,18,22)	ZFNAWHPUCPSXBF-UHFFFAOYSA-N	314.174275984							115751
BRD-K93879663-001-01-6	LSM-27209	BRD-K93879663	54634264	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21+/m0/s1	XCHGKOIROWQQCM-CKJXQJPGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K93879663	BRD-K93879663-001-01-6	Broad Institute of MIT and Harvard	BRD-K93879663			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21+/m0/s1	XCHGKOIROWQQCM-CKJXQJPGSA-N	448.268570292							115752
BRD-K09043083-001-01-4	LSM-27210	BRD-K09043083	54634458	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21-/m0/s1	CBUFPLKBNRJCSB-FVJLSDCUSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@H]1C)OC	BroadT	BRD-K09043083	BRD-K09043083-001-01-4	Broad Institute of MIT and Harvard	BRD-K09043083			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21-/m0/s1	CBUFPLKBNRJCSB-FVJLSDCUSA-N	435.273321314							115753
BRD-K78964751-001-01-8	LSM-27211	BRD-K78964751	54634238	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22+/m0/s1	VMZAIKVTLMIHQJ-GSHUGGBRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K78964751	BRD-K78964751-001-01-8	Broad Institute of MIT and Harvard	BRD-K78964751			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22+/m0/s1	VMZAIKVTLMIHQJ-GSHUGGBRSA-N	440.242355544							115754
BRD-K45497474-001-01-5	LSM-27212	BRD-K45497474	54634360	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19-/m1/s1	NCNZCRGMWPPFEB-SPYBWZPUSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H]1C)OC	BroadT	BRD-K45497474	BRD-K45497474-001-01-5	Broad Institute of MIT and Harvard	BRD-K45497474			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19-/m1/s1	NCNZCRGMWPPFEB-SPYBWZPUSA-N	455.209006496							115755
BRD-K32049892-001-01-3	LSM-27213	BRD-K32049892	54634215	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19+/m0/s1	NNLGSVIPEFKMPH-QMTMVMCOSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K32049892	BRD-K32049892-001-01-3	Broad Institute of MIT and Harvard	BRD-K32049892			CCCC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19+/m0/s1	NNLGSVIPEFKMPH-QMTMVMCOSA-N	391.247106566							115756
BRD-K14697814-001-01-6	LSM-27214	BRD-K14697814	54634331	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	GLKVRACLSULUNI-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K14697814	BRD-K14697814-001-01-6	Broad Institute of MIT and Harvard	BRD-K14697814			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m1/s1	GLKVRACLSULUNI-SAHWJRBASA-N	457.237684734							115757
BRD-K13668681-001-01-8	LSM-27215	BRD-K13668681	54634303	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20-/m1/s1	KXQBGTLFJGTYSJ-JXXFODFXSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(C)[C@H](C)COc2c1	BroadT	BRD-K13668681	BRD-K13668681-001-01-8	Broad Institute of MIT and Harvard	BRD-K13668681			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20-/m1/s1	KXQBGTLFJGTYSJ-JXXFODFXSA-N	420.273655672							115758
BRD-K01910309-001-01-0	LSM-27216	BRD-K01910309	54634373	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m0/s1	WNEVNPYHFIROBB-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K01910309	BRD-K01910309-001-01-0	Broad Institute of MIT and Harvard	BRD-K01910309			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m0/s1	WNEVNPYHFIROBB-RHGYRFJNSA-N	469.25767125							115759
BRD-K51767504-001-01-6	LSM-27217	BRD-K51767504	54634181	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m0/s1	ACBVZQMFXFPRGI-PMUMKWKESA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K51767504	BRD-K51767504-001-01-6	Broad Institute of MIT and Harvard	BRD-K51767504			CCC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m0/s1	ACBVZQMFXFPRGI-PMUMKWKESA-N	377.231456502							115760
BRD-K10461210-001-01-1	LSM-27218	BRD-K10461210	54634237	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22+/m1/s1	VMZAIKVTLMIHQJ-JLHGSKIFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K10461210	BRD-K10461210-001-01-1	Broad Institute of MIT and Harvard	BRD-K10461210			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22+/m1/s1	VMZAIKVTLMIHQJ-JLHGSKIFSA-N	440.242355544							115761
BRD-K76168315-001-01-7	LSM-27219	BRD-K76168315	54634240	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22-/m0/s1	VMZAIKVTLMIHQJ-JKSBSHDWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K76168315	BRD-K76168315-001-01-7	Broad Institute of MIT and Harvard	BRD-K76168315			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22-/m0/s1	VMZAIKVTLMIHQJ-JKSBSHDWSA-N	440.242355544							115762
BRD-K56277353-001-01-3	LSM-27220	BRD-K56277353	54634307	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20-/m0/s1	KXQBGTLFJGTYSJ-FTRWYGJKSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(C)[C@@H](C)COc2c1	BroadT	BRD-K56277353	BRD-K56277353-001-01-3	Broad Institute of MIT and Harvard	BRD-K56277353			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(C)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20-/m0/s1	KXQBGTLFJGTYSJ-FTRWYGJKSA-N	420.273655672							115763
BRD-K88073024-001-01-7	LSM-27221	BRD-K88073024	54634277	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-17(25)6-8-18)9-10-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	IDXVVRWJPVHXLQ-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K88073024	BRD-K88073024-001-01-7	Broad Institute of MIT and Harvard	BRD-K88073024			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-17(25)6-8-18)9-10-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m0/s1	IDXVVRWJPVHXLQ-PONJGIIJSA-N	458.232933712							115764
BRD-K14955157-001-01-3	LSM-27222	BRD-K14955157	54634308	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20-/m0/s1	KXQBGTLFJGTYSJ-YRNRMSPPSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(C)[C@H](C)COc2c1	BroadT	BRD-K14955157	BRD-K14955157-001-01-3	Broad Institute of MIT and Harvard	BRD-K14955157			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(C)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20-/m0/s1	KXQBGTLFJGTYSJ-YRNRMSPPSA-N	420.273655672							115765
BRD-K44447974-001-01-6	LSM-27223	BRD-K44447974	54634336	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21+/m0/s1	HCBZRBWAINIAIP-GCKMJXCFSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K44447974	BRD-K44447974-001-01-6	Broad Institute of MIT and Harvard	BRD-K44447974			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21+/m0/s1	HCBZRBWAINIAIP-GCKMJXCFSA-N	433.25767125							115766
BRD-K57189778-001-01-6	LSM-27224	BRD-K57189778	54634175	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14-,18-/m0/s1	IWUYHSCDOFQSQQ-DEYYWGMASA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K57189778	BRD-K57189778-001-01-6	Broad Institute of MIT and Harvard	BRD-K57189778			CCS(=O)(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14-,18-/m0/s1	IWUYHSCDOFQSQQ-DEYYWGMASA-N	413.198441812							115767
BRD-K85067281-001-01-0	LSM-27225	BRD-K85067281	54634407	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22-/m0/s1	YTFMHZRWJRHUBM-HOIFWPIMSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K85067281	BRD-K85067281-001-01-0	Broad Institute of MIT and Harvard	BRD-K85067281			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22-/m0/s1	YTFMHZRWJRHUBM-HOIFWPIMSA-N	447.273321314							115768
BRD-K48651279-001-01-1	LSM-27226	BRD-K48651279	54634208	InChI=1S/C23H34F3N3O4/c1-6-21(30)27-17-7-8-18-19(11-17)33-14-16(3)29(10-9-23(24,25)26)12-15(2)20(32-5)13-28(4)22(18)31/h7-8,11,15-16,20H,6,9-10,12-14H2,1-5H3,(H,27,30)/t15-,16+,20+/m1/s1	KLQKGCQUDAKEQP-GUXCAODWSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CCC(F)(F)F)[C@@H](C)COc2c1	BroadT	BRD-K48651279	BRD-K48651279-001-01-1	Broad Institute of MIT and Harvard	BRD-K48651279			CCC(=O)Nc1ccc2c(OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O4/c1-6-21(30)27-17-7-8-18-19(11-17)33-14-16(3)29(10-9-23(24,25)26)12-15(2)20(32-5)13-28(4)22(18)31/h7-8,11,15-16,20H,6,9-10,12-14H2,1-5H3,(H,27,30)/t15-,16+,20+/m1/s1	KLQKGCQUDAKEQP-GUXCAODWSA-N	473.250141198							115769
BRD-K13097083-001-01-4	LSM-27227	BRD-K13097083	54634350	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19-/m0/s1	AQVJCVRFMZPTMV-KHYOSLBOSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K13097083	BRD-K13097083-001-01-4	Broad Institute of MIT and Harvard	BRD-K13097083			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19-/m0/s1	AQVJCVRFMZPTMV-KHYOSLBOSA-N	406.258005608							115770
BRD-K04518481-001-01-8	LSM-27228	BRD-K04518481	54634359	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m1/s1	NQRVDZOPZOORAV-YDIMBITNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K04518481	BRD-K04518481-001-01-8	Broad Institute of MIT and Harvard	BRD-K04518481			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m1/s1	NQRVDZOPZOORAV-YDIMBITNSA-N	453.26275663							115771
BRD-K71150692-001-01-3	LSM-27229	BRD-K71150692	54634185	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17-,21-/m1/s1	YMYKUEFQMUUFAJ-CBGDNZLLSA-N	CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@H]1C)OC	BroadT	BRD-K71150692	BRD-K71150692-001-01-3	Broad Institute of MIT and Harvard	BRD-K71150692			CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@H]1C)OC	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17-,21-/m1/s1	YMYKUEFQMUUFAJ-CBGDNZLLSA-N	498.251205666							115772
BRD-K38229551-001-01-7	LSM-27230	BRD-K38229551	54634321	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20-/m1/s1	LSBAXAJPBMYKOG-GQIGUUNPSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K38229551	BRD-K38229551-001-01-7	Broad Institute of MIT and Harvard	BRD-K38229551			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H]1C)OC	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20-/m1/s1	LSBAXAJPBMYKOG-GQIGUUNPSA-N	441.22974194							115773
BRD-K42318535-001-01-3	LSM-27231	BRD-K42318535	54634250	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24-/m0/s1	KOWUZEVVBMMFIA-RHGYRFJNSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K42318535	BRD-K42318535-001-01-3	Broad Institute of MIT and Harvard	BRD-K42318535			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24-/m0/s1	KOWUZEVVBMMFIA-RHGYRFJNSA-N	499.248249418							115774
BRD-K45562432-001-01-7	LSM-27232	BRD-K45562432	54634234	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m1/s1	BBNOXYVHIXNILT-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K45562432	BRD-K45562432-001-01-7	Broad Institute of MIT and Harvard	BRD-K45562432			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m1/s1	BBNOXYVHIXNILT-IEGUWTFLSA-N	439.247106566							115775
BRD-K75297755-001-01-2	LSM-27233	BRD-K75297755	54634438	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	HPGQIGUDQFUDBC-IEGUWTFLSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K75297755	BRD-K75297755-001-01-2	Broad Institute of MIT and Harvard	BRD-K75297755			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	HPGQIGUDQFUDBC-IEGUWTFLSA-N	482.252920228							115776
BRD-K96426084-001-01-4	LSM-27234	BRD-K96426084	54634230	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m1/s1	BBNOXYVHIXNILT-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K96426084	BRD-K96426084-001-01-4	Broad Institute of MIT and Harvard	BRD-K96426084			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m1/s1	BBNOXYVHIXNILT-STSQHVNTSA-N	439.247106566							115777
BRD-K36540588-001-01-6	LSM-27235	BRD-K36540588	54634327	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	GLKVRACLSULUNI-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K36540588	BRD-K36540588-001-01-6	Broad Institute of MIT and Harvard	BRD-K36540588			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m1/s1	GLKVRACLSULUNI-DGGJZMOXSA-N	457.237684734							115778
BRD-K97762922-001-01-7	LSM-27236	BRD-K97762922	54634172	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14-,18+/m1/s1	IWUYHSCDOFQSQQ-LBTNJELSSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K97762922	BRD-K97762922-001-01-7	Broad Institute of MIT and Harvard	BRD-K97762922			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14-,18+/m1/s1	IWUYHSCDOFQSQQ-LBTNJELSSA-N	413.198441812							115779
BRD-K98671227-001-01-1	LSM-27237	BRD-K98671227	54634380	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24-/m0/s1	GCVUEFRAKHDCHL-GLDPYIMESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K98671227	BRD-K98671227-001-01-1	Broad Institute of MIT and Harvard	BRD-K98671227			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24-/m0/s1	GCVUEFRAKHDCHL-GLDPYIMESA-N	489.22974194							115780
BRD-K67192696-001-01-7	LSM-27238	BRD-K67192696	54634189	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17+,21+/m0/s1	YMYKUEFQMUUFAJ-CSODHUTKSA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@H]1C)OC	BroadT	BRD-K67192696	BRD-K67192696-001-01-7	Broad Institute of MIT and Harvard	BRD-K67192696			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@H]1C)OC	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17+,21+/m0/s1	YMYKUEFQMUUFAJ-CSODHUTKSA-N	498.251205666							115781
BRD-K19502810-001-01-7	LSM-27239	BRD-K19502810	54634244	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18-,24+/m1/s1	KOWUZEVVBMMFIA-GGUMNFRJSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K19502810	BRD-K19502810-001-01-7	Broad Institute of MIT and Harvard	BRD-K19502810			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18-,24+/m1/s1	KOWUZEVVBMMFIA-GGUMNFRJSA-N	499.248249418							115782
BRD-K36122249-001-01-4	LSM-27240	BRD-K36122249	54634187	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17-,21+/m1/s1	YMYKUEFQMUUFAJ-LZJOCLMNSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@H]1C)OC	BroadT	BRD-K36122249	BRD-K36122249-001-01-4	Broad Institute of MIT and Harvard	BRD-K36122249			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@H]1C)OC	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17-,21+/m1/s1	YMYKUEFQMUUFAJ-LZJOCLMNSA-N	498.251205666							115783
BRD-K66937768-001-01-9	LSM-27241	BRD-K66937768	54634163	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m0/s1	IZVZICFLHPWRDR-IYOUNJFTSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K66937768	BRD-K66937768-001-01-9	Broad Institute of MIT and Harvard	BRD-K66937768			COCC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m0/s1	IZVZICFLHPWRDR-IYOUNJFTSA-N	393.226371122							115784
BRD-K54067859-001-01-9	LSM-27242	BRD-K54067859	54634411	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m0/s1	GLPQOGXKNQYMAV-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccccc3	BroadT	BRD-K54067859	BRD-K54067859-001-01-9	Broad Institute of MIT and Harvard	BRD-K54067859			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m0/s1	GLPQOGXKNQYMAV-LLJLJFOGSA-N	467.242021186							115785
BRD-K15501855-001-01-9	LSM-27243	BRD-K15501855	54634330	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	GLKVRACLSULUNI-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K15501855	BRD-K15501855-001-01-9	Broad Institute of MIT and Harvard	BRD-K15501855			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23-/m0/s1	GLKVRACLSULUNI-MFEFFIJZSA-N	457.237684734							115786
BRD-K10375974-001-01-9	LSM-27244	BRD-K10375974	54634314	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(8-11-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m0/s1	AVBHYNTVSDLUSA-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K10375974	BRD-K10375974-001-01-9	Broad Institute of MIT and Harvard	BRD-K10375974			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(8-11-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m0/s1	AVBHYNTVSDLUSA-MFEFFIJZSA-N	470.252920228							115787
BRD-K68297445-001-01-7	LSM-27245	BRD-K68297445	54634247	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24+/m0/s1	KOWUZEVVBMMFIA-HOOSLVGPSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K68297445	BRD-K68297445-001-01-7	Broad Institute of MIT and Harvard	BRD-K68297445			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24+/m0/s1	KOWUZEVVBMMFIA-HOOSLVGPSA-N	499.248249418							115788
BRD-K78337482-001-01-3	LSM-27246	BRD-K78337482	54634345	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15-,19+/m1/s1	AQVJCVRFMZPTMV-CLCXKQKWSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K78337482	BRD-K78337482-001-01-3	Broad Institute of MIT and Harvard	BRD-K78337482			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15-,19+/m1/s1	AQVJCVRFMZPTMV-CLCXKQKWSA-N	406.258005608							115789
BRD-K77282822-001-01-1	LSM-27247	BRD-K77282822	54634153	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-18-19(11-17)29-14-16(3)24(4)12-15(2)20(28-6)13-25(5)22(18)27/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16-,20+/m0/s1	GQKMEBDXNYRVIF-TWOQFEAHSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(C)[C@@H](C)COc2c1	BroadT	BRD-K77282822	BRD-K77282822-001-01-1	Broad Institute of MIT and Harvard	BRD-K77282822			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-18-19(11-17)29-14-16(3)24(4)12-15(2)20(28-6)13-25(5)22(18)27/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16-,20+/m0/s1	GQKMEBDXNYRVIF-TWOQFEAHSA-N	405.26275663							115790
BRD-K41043551-001-01-7	LSM-27248	BRD-K41043551	54634440	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20-,26+/m0/s1	KZQLWMFDTATSFP-CUVVAGTFSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K41043551	BRD-K41043551-001-01-7	Broad Institute of MIT and Harvard	BRD-K41043551			CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20-,26+/m0/s1	KZQLWMFDTATSFP-CUVVAGTFSA-N	497.288971378							115791
BRD-K81783273-001-01-6	LSM-27249	BRD-K81783273	54634441	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20-,26+/m1/s1	KZQLWMFDTATSFP-KYTVRQNUSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K81783273	BRD-K81783273-001-01-6	Broad Institute of MIT and Harvard	BRD-K81783273			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20-,26+/m1/s1	KZQLWMFDTATSFP-KYTVRQNUSA-N	497.288971378							115792
BRD-K96020320-001-01-9	LSM-27250	BRD-K96020320	54634317	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16-,20+/m0/s1	LSBAXAJPBMYKOG-TWOQFEAHSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K96020320	BRD-K96020320-001-01-9	Broad Institute of MIT and Harvard	BRD-K96020320			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H]1C)OC	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16-,20+/m0/s1	LSBAXAJPBMYKOG-TWOQFEAHSA-N	441.22974194							115793
BRD-K56094749-001-01-5	LSM-27251	BRD-K56094749	54634241	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22-/m1/s1	VMZAIKVTLMIHQJ-HYFFOGBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K56094749	BRD-K56094749-001-01-5	Broad Institute of MIT and Harvard	BRD-K56094749			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22-/m1/s1	VMZAIKVTLMIHQJ-HYFFOGBASA-N	440.242355544							115794
BRD-K06402607-001-01-2	LSM-27252	BRD-K06402607	54634324	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	GLKVRACLSULUNI-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K06402607	BRD-K06402607-001-01-2	Broad Institute of MIT and Harvard	BRD-K06402607			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m1/s1	GLKVRACLSULUNI-SEPYTNNBSA-N	457.237684734							115795
BRD-K91840053-001-01-8	LSM-27253	BRD-K91840053	54634404	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22+/m1/s1	YTFMHZRWJRHUBM-YVHKJVDXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K91840053	BRD-K91840053-001-01-8	Broad Institute of MIT and Harvard	BRD-K91840053			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22+/m1/s1	YTFMHZRWJRHUBM-YVHKJVDXSA-N	447.273321314							115796
BRD-K57280897-001-01-9	LSM-27254	BRD-K57280897	54634268	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16+,21-/m1/s1	XCHGKOIROWQQCM-VWKPWSFCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K57280897	BRD-K57280897-001-01-9	Broad Institute of MIT and Harvard	BRD-K57280897			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16+,21-/m1/s1	XCHGKOIROWQQCM-VWKPWSFCSA-N	448.268570292							115797
BRD-K15639467-001-01-7	LSM-27255	BRD-K15639467	54634256	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22+/m1/s1	VGIZUFWCBMAECV-FGSXEWAUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K15639467	BRD-K15639467-001-01-7	Broad Institute of MIT and Harvard	BRD-K15639467			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22+/m1/s1	VGIZUFWCBMAECV-FGSXEWAUSA-N	491.310769462							115798
BRD-K34448293-001-01-0	LSM-27256	BRD-K34448293	54634325	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	GLKVRACLSULUNI-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K34448293	BRD-K34448293-001-01-0	Broad Institute of MIT and Harvard	BRD-K34448293			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m0/s1	GLKVRACLSULUNI-HKARXFIJSA-N	457.237684734							115799
BRD-K74932485-001-01-2	LSM-27257	BRD-K74932485	54634449	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-7-18(26)11-19)9-10-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m1/s1	IAEXBJMXVKONHW-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K74932485	BRD-K74932485-001-01-2	Broad Institute of MIT and Harvard	BRD-K74932485			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-7-18(26)11-19)9-10-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m1/s1	IAEXBJMXVKONHW-DGGJZMOXSA-N	472.248583776							115800
BRD-K07565949-001-01-2	LSM-27258	BRD-K07565949	54634400	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-7-6-15(24-32(28,29)12-20(21,22)23)8-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14+,18-/m0/s1	NAKUAOPJLXDQOX-IYOUNJFTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K07565949	BRD-K07565949-001-01-2	Broad Institute of MIT and Harvard	BRD-K07565949			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-7-6-15(24-32(28,29)12-20(21,22)23)8-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14+,18-/m0/s1	NAKUAOPJLXDQOX-IYOUNJFTSA-N	481.18582638							115801
BRD-K79949474-001-01-4	LSM-27259	BRD-K79949474	54634427	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m1/s1	DGGJSEMSEUAJQA-WYEJZRMESA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccccc3F)[C@@H](C)COc2c1	BroadT	BRD-K79949474	BRD-K79949474-001-01-4	Broad Institute of MIT and Harvard	BRD-K79949474			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m1/s1	DGGJSEMSEUAJQA-WYEJZRMESA-N	485.268984862							115802
BRD-K49775517-001-01-9	LSM-27260	BRD-K49775517	54634382	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15-,20-/m1/s1	OTDLGAQSEPTCMV-STXHMFSFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K49775517	BRD-K49775517-001-01-9	Broad Institute of MIT and Harvard	BRD-K49775517			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15-,20-/m1/s1	OTDLGAQSEPTCMV-STXHMFSFSA-N	403.247106566							115803
BRD-K44460895-001-01-5	LSM-27261	BRD-K44460895	54634367	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19-/m1/s1	NCNZCRGMWPPFEB-ZRGWGRIASA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K44460895	BRD-K44460895-001-01-5	Broad Institute of MIT and Harvard	BRD-K44460895			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19-/m1/s1	NCNZCRGMWPPFEB-ZRGWGRIASA-N	455.209006496							115804
BRD-K73541274-001-01-7	LSM-27262	BRD-K73541274	54634339	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-13-21(28-26(33)27-20-9-7-6-8-10-20)11-12-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24+/m1/s1	MYURTGQUXIJGDV-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K73541274	BRD-K73541274-001-01-7	Broad Institute of MIT and Harvard	BRD-K73541274			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-13-21(28-26(33)27-20-9-7-6-8-10-20)11-12-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24+/m1/s1	MYURTGQUXIJGDV-GGUMNFRJSA-N	482.252920228							115805
BRD-K53496131-001-01-1	LSM-27263	BRD-K53496131	54634419	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19-,23+/m1/s1	NQTWUKGAHCTDGB-PWHSHALESA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)CN3CCOCC3	BroadT	BRD-K53496131	BRD-K53496131-001-01-1	Broad Institute of MIT and Harvard	BRD-K53496131			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)CN2CCOCC2)c1	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19-,23+/m1/s1	NQTWUKGAHCTDGB-PWHSHALESA-N	504.29478504							115806
BRD-K93051140-001-01-5	LSM-27264	BRD-K93051140	54634354	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m1/s1	NQRVDZOPZOORAV-IMWIBFENSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K93051140	BRD-K93051140-001-01-5	Broad Institute of MIT and Harvard	BRD-K93051140			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m1/s1	NQRVDZOPZOORAV-IMWIBFENSA-N	453.26275663							115807
BRD-K95251282-001-01-7	LSM-27265	BRD-K95251282	54634167	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-17-18(9-16)29-12-15(4)22-10-14(3)19(28-6)11-25(5)20(17)26/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19+/m0/s1	BCEADABJMKBPCA-QMTMVMCOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K95251282	BRD-K95251282-001-01-7	Broad Institute of MIT and Harvard	BRD-K95251282			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-17-18(9-16)29-12-15(4)22-10-14(3)19(28-6)11-25(5)20(17)26/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19+/m0/s1	BCEADABJMKBPCA-QMTMVMCOSA-N	406.258005608							115808
BRD-K15782163-001-01-2	LSM-27266	BRD-K15782163	54634369	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m1/s1	WNEVNPYHFIROBB-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K15782163	BRD-K15782163-001-01-2	Broad Institute of MIT and Harvard	BRD-K15782163			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m1/s1	WNEVNPYHFIROBB-GGUMNFRJSA-N	469.25767125							115809
BRD-K68879722-001-01-6	LSM-27267	BRD-K68879722	54634157	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-18-19(11-17)29-14-16(3)24(4)12-15(2)20(28-6)13-25(5)22(18)27/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20-/m1/s1	GQKMEBDXNYRVIF-GQIGUUNPSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(C)[C@@H](C)COc2c1	BroadT	BRD-K68879722	BRD-K68879722-001-01-6	Broad Institute of MIT and Harvard	BRD-K68879722			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-18-19(11-17)29-14-16(3)24(4)12-15(2)20(28-6)13-25(5)22(18)27/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20-/m1/s1	GQKMEBDXNYRVIF-GQIGUUNPSA-N	405.26275663							115810
BRD-K90483291-001-01-0	LSM-27268	BRD-K90483291	54634224	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-18(26)7-9-19)10-11-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m1/s1	JEYMQXVPUHGLIB-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K90483291	BRD-K90483291-001-01-0	Broad Institute of MIT and Harvard	BRD-K90483291			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-18(26)7-9-19)10-11-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m1/s1	JEYMQXVPUHGLIB-SAHWJRBASA-N	488.219033286							115811
BRD-K33654706-001-01-5	LSM-27269	BRD-K33654706	54634252	InChI=1S/C33H41N3O4/c1-24-21-36(18-17-26-11-7-5-8-12-26)25(2)23-40-30-16-15-28(34-32(37)19-27-13-9-6-10-14-27)20-29(30)33(38)35(3)22-31(24)39-4/h5-16,20,24-25,31H,17-19,21-23H2,1-4H3,(H,34,37)/t24-,25-,31-/m1/s1	LUANKTMYVFQSTN-XQOXSZQVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(CCc4ccccc4)C[C@H]1C	BroadT	BRD-K33654706	BRD-K33654706-001-01-5	Broad Institute of MIT and Harvard	BRD-K33654706			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@H]1C	InChI=1S/C33H41N3O4/c1-24-21-36(18-17-26-11-7-5-8-12-26)25(2)23-40-30-16-15-28(34-32(37)19-27-13-9-6-10-14-27)20-29(30)33(38)35(3)22-31(24)39-4/h5-16,20,24-25,31H,17-19,21-23H2,1-4H3,(H,34,37)/t24-,25-,31-/m1/s1	LUANKTMYVFQSTN-XQOXSZQVSA-N	543.309706822							115812
BRD-K26598812-001-01-4	LSM-27270	BRD-K26598812	54634150	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27-/m0/s1	VDJCKUULTDNAAX-ISCCLHIJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc5ccncc5)C[C@@H]1C	BroadT	BRD-K26598812	BRD-K26598812-001-01-4	Broad Institute of MIT and Harvard	BRD-K26598812			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27-/m0/s1	VDJCKUULTDNAAX-ISCCLHIJSA-N	573.24097534							115813
BRD-K37830821-001-01-7	LSM-27271	BRD-K37830821	54634179	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m0/s1	ACBVZQMFXFPRGI-SUNYJGFJSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K37830821	BRD-K37830821-001-01-7	Broad Institute of MIT and Harvard	BRD-K37830821			CCC(=O)Nc1ccc2c(OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m0/s1	ACBVZQMFXFPRGI-SUNYJGFJSA-N	377.231456502							115814
BRD-K81968420-001-01-5	LSM-27272	BRD-K81968420	54634204	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	MWXNSOOKWBVWAA-IXFSTUDKSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3ccncc3	BroadT	BRD-K81968420	BRD-K81968420-001-01-5	Broad Institute of MIT and Harvard	BRD-K81968420			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccncc2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	MWXNSOOKWBVWAA-IXFSTUDKSA-N	482.252920228							115815
BRD-K24060538-001-01-0	LSM-27273	BRD-K24060538	54634362	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19+/m0/s1	NCNZCRGMWPPFEB-YZVOILCLSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K24060538	BRD-K24060538-001-01-0	Broad Institute of MIT and Harvard	BRD-K24060538			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19+/m0/s1	NCNZCRGMWPPFEB-YZVOILCLSA-N	455.209006496							115816
BRD-K26100563-001-01-0	LSM-27274	BRD-K26100563	54634279	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-17(25)6-8-18)9-10-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	IDXVVRWJPVHXLQ-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K26100563	BRD-K26100563-001-01-0	Broad Institute of MIT and Harvard	BRD-K26100563			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-17(25)6-8-18)9-10-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m0/s1	IDXVVRWJPVHXLQ-DMPWYTOCSA-N	458.232933712							115817
BRD-K97060549-001-01-9	LSM-27275	BRD-K97060549	54634428	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m0/s1	DGGJSEMSEUAJQA-OSWQYVSFSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccccc3F)[C@H](C)COc2c1	BroadT	BRD-K97060549	BRD-K97060549-001-01-9	Broad Institute of MIT and Harvard	BRD-K97060549			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3F)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19+,25+/m0/s1	DGGJSEMSEUAJQA-OSWQYVSFSA-N	485.268984862							115818
BRD-K79934445-001-01-2	LSM-27276	BRD-K79934445	54634364	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19+/m0/s1	NCNZCRGMWPPFEB-QMTMVMCOSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H]1C)OC	BroadT	BRD-K79934445	BRD-K79934445-001-01-2	Broad Institute of MIT and Harvard	BRD-K79934445			CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19+/m0/s1	NCNZCRGMWPPFEB-QMTMVMCOSA-N	455.209006496							115819
BRD-K59550463-001-01-7	LSM-27277	BRD-K59550463	54634218	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19-/m1/s1	NNLGSVIPEFKMPH-ZRGWGRIASA-N	CCCC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K59550463	BRD-K59550463-001-01-7	Broad Institute of MIT and Harvard	BRD-K59550463			CCCC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19-/m1/s1	NNLGSVIPEFKMPH-ZRGWGRIASA-N	391.247106566							115820
BRD-K60969355-001-01-7	LSM-27278	BRD-K60969355	54634436	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m0/s1	HPGQIGUDQFUDBC-BSRJHKFKSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K60969355	BRD-K60969355-001-01-7	Broad Institute of MIT and Harvard	BRD-K60969355			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m0/s1	HPGQIGUDQFUDBC-BSRJHKFKSA-N	482.252920228							115821
BRD-K48616207-001-01-1	LSM-27279	BRD-K48616207	54634437	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	HPGQIGUDQFUDBC-IXFSTUDKSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K48616207	BRD-K48616207-001-01-1	Broad Institute of MIT and Harvard	BRD-K48616207			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m0/s1	HPGQIGUDQFUDBC-IXFSTUDKSA-N	482.252920228							115822
BRD-K48968493-001-01-9	LSM-27280	BRD-K48968493	54634259	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18-,22-/m1/s1	VGIZUFWCBMAECV-JBYIUTFZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K48968493	BRD-K48968493-001-01-9	Broad Institute of MIT and Harvard	BRD-K48968493			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18-,22-/m1/s1	VGIZUFWCBMAECV-JBYIUTFZSA-N	491.310769462							115823
BRD-K18000748-001-01-0	LSM-27281	BRD-K18000748	54634228	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m1/s1	BBNOXYVHIXNILT-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K18000748	BRD-K18000748-001-01-0	Broad Institute of MIT and Harvard	BRD-K18000748			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m1/s1	BBNOXYVHIXNILT-PNCHPQGNSA-N	439.247106566							115824
MLS003650035	LSM-27282	BRD-K50718651	53382695	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m1/s1	DGGJSEMSEUAJQA-RRQZXNHTSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccccc3F)[C@H](C)COc2c1	BroadT	BRD-K50718651	BRD-K50718651-001-01-1	Broad Institute of MIT and Harvard	BRD-K50718651			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m1/s1	DGGJSEMSEUAJQA-RRQZXNHTSA-N	485.268984862							115825
BRD-K12534235-001-01-4	LSM-27283	BRD-K12534235	54634377	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24+/m0/s1	GCVUEFRAKHDCHL-AXHZCLLHSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K12534235	BRD-K12534235-001-01-4	Broad Institute of MIT and Harvard	BRD-K12534235			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24+/m0/s1	GCVUEFRAKHDCHL-AXHZCLLHSA-N	489.22974194							115826
BRD-K48876783-001-01-3	LSM-27284	BRD-K48876783	54634329	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m0/s1	GLKVRACLSULUNI-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K48876783	BRD-K48876783-001-01-3	Broad Institute of MIT and Harvard	BRD-K48876783			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23-/m0/s1	GLKVRACLSULUNI-QQMNAOGKSA-N	457.237684734							115827
CHEMBL3188611	LSM-27285	BRD-K56402522	54634322	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-17(5-7-18(21)23(31)30(3)12-22(14)33-4)29-24(32)28-16-6-8-19(25)20(26)9-16/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22+/m1/s1	XHOPKPACQVDKTO-GTQRCTGISA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K56402522	BRD-K56402522-001-01-3	Broad Institute of MIT and Harvard	BRD-K56402522			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-17(5-7-18(21)23(31)30(3)12-22(14)33-4)29-24(32)28-16-6-8-19(25)20(26)9-16/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22+/m1/s1	XHOPKPACQVDKTO-GTQRCTGISA-N	508.1644109							115828
BRD-K87883927-001-01-8	LSM-27286	BRD-K87883927	54634421	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19+,23+/m1/s1	NQTWUKGAHCTDGB-MSYCTHLASA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)CN3CCOCC3	BroadT	BRD-K87883927	BRD-K87883927-001-01-8	Broad Institute of MIT and Harvard	BRD-K87883927			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)CN2CCOCC2)c1	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19+,23+/m1/s1	NQTWUKGAHCTDGB-MSYCTHLASA-N	504.29478504							115829
BRD-K41229500-001-01-4	LSM-27287	BRD-K41229500	54634376	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24+/m1/s1	GCVUEFRAKHDCHL-IECBHUPTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K41229500	BRD-K41229500-001-01-4	Broad Institute of MIT and Harvard	BRD-K41229500			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24+/m1/s1	GCVUEFRAKHDCHL-IECBHUPTSA-N	489.22974194							115830
BRD-K17315280-001-01-7	LSM-27288	BRD-K17315280	54634446	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20+,26-/m1/s1	KZQLWMFDTATSFP-BVFVYWQFSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K17315280	BRD-K17315280-001-01-7	Broad Institute of MIT and Harvard	BRD-K17315280			CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20+,26-/m1/s1	KZQLWMFDTATSFP-BVFVYWQFSA-N	497.288971378							115831
BRD-K85029360-001-01-4	LSM-27289	BRD-K85029360	54634355	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m1/s1	NQRVDZOPZOORAV-IECBHUPTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K85029360	BRD-K85029360-001-01-4	Broad Institute of MIT and Harvard	BRD-K85029360			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m1/s1	NQRVDZOPZOORAV-IECBHUPTSA-N	453.26275663							115832
BRD-K30033105-001-01-2	LSM-27290	BRD-K30033105	54634393	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22+/m0/s1	COGTYPOCQQQYGQ-NJNPRVFISA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	BroadT	BRD-K30033105	BRD-K30033105-001-01-2	Broad Institute of MIT and Harvard	BRD-K30033105			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22+/m0/s1	COGTYPOCQQQYGQ-NJNPRVFISA-N	433.294056758							115833
BRD-K72015275-001-01-2	LSM-27291	BRD-K72015275	54634374	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m1/s1	WNEVNPYHFIROBB-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K72015275	BRD-K72015275-001-01-2	Broad Institute of MIT and Harvard	BRD-K72015275			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m1/s1	WNEVNPYHFIROBB-NXMSCROESA-N	469.25767125							115834
BRD-K49673472-001-01-9	LSM-27292	BRD-K49673472	54634338	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21-/m1/s1	HCBZRBWAINIAIP-VWKPWSFCSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C	BroadT	BRD-K49673472	BRD-K49673472-001-01-9	Broad Institute of MIT and Harvard	BRD-K49673472			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21-/m1/s1	HCBZRBWAINIAIP-VWKPWSFCSA-N	433.25767125							115835
BRD-K16213683-001-01-8	LSM-27293	BRD-K16213683	54634293	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23-/m0/s1	BXKRIFOMXVJDTH-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K16213683	BRD-K16213683-001-01-8	Broad Institute of MIT and Harvard	BRD-K16213683			CO[C@@H]1[C@@H](C)CN(C)[C@@H](C)COc2ccc(cc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23-/m0/s1	BXKRIFOMXVJDTH-BSRJHKFKSA-N	475.214091876							115836
BRD-K92013289-001-01-7	LSM-27294	BRD-K92013289	54634161	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m1/s1	IZVZICFLHPWRDR-GLJUWKHASA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K92013289	BRD-K92013289-001-01-7	Broad Institute of MIT and Harvard	BRD-K92013289			COCC(=O)Nc1ccc2c(OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m1/s1	IZVZICFLHPWRDR-GLJUWKHASA-N	393.226371122							115837
BRD-K86662598-001-01-5	LSM-27295	BRD-K86662598	54634320	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20-/m0/s1	LSBAXAJPBMYKOG-YRNRMSPPSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H]1C)OC	BroadT	BRD-K86662598	BRD-K86662598-001-01-5	Broad Institute of MIT and Harvard	BRD-K86662598			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H]1C)OC	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20-/m0/s1	LSBAXAJPBMYKOG-YRNRMSPPSA-N	441.22974194							115838
BRD-K50083570-001-01-8	LSM-27296	BRD-K50083570	54634203	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	MWXNSOOKWBVWAA-PMAPCBKXSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3ccncc3	BroadT	BRD-K50083570	BRD-K50083570-001-01-8	Broad Institute of MIT and Harvard	BRD-K50083570			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccncc2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	MWXNSOOKWBVWAA-PMAPCBKXSA-N	482.252920228							115839
BRD-K67896343-001-01-0	LSM-27297	BRD-K67896343	54634220	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-18(26)7-9-19)10-11-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m0/s1	JEYMQXVPUHGLIB-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K67896343	BRD-K67896343-001-01-0	Broad Institute of MIT and Harvard	BRD-K67896343			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-18(26)7-9-19)10-11-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m0/s1	JEYMQXVPUHGLIB-HKARXFIJSA-N	488.219033286							115840
BRD-K15670962-001-01-2	LSM-27298	BRD-K15670962	54634422	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19+,23+/m0/s1	NQTWUKGAHCTDGB-YCRNBWNJSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)CN3CCOCC3	BroadT	BRD-K15670962	BRD-K15670962-001-01-2	Broad Institute of MIT and Harvard	BRD-K15670962			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CN2CCOCC2)c1	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19+,23+/m0/s1	NQTWUKGAHCTDGB-YCRNBWNJSA-N	504.29478504							115841
BRD-K54903189-001-01-6	LSM-27299	BRD-K54903189	54634274	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20-/m0/s1	XSLDIBSITHUXPL-MDOVXXIYSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K54903189	BRD-K54903189-001-01-6	Broad Institute of MIT and Harvard	BRD-K54903189			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20-/m0/s1	XSLDIBSITHUXPL-MDOVXXIYSA-N	435.236935806							115842
BRD-K30151925-001-01-0	LSM-27300	BRD-K30151925	54634424	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19+,23-/m0/s1	NQTWUKGAHCTDGB-YYDVJCTNSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)CN3CCOCC3	BroadT	BRD-K30151925	BRD-K30151925-001-01-0	Broad Institute of MIT and Harvard	BRD-K30151925			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)CN2CCOCC2)c1	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19+,23-/m0/s1	NQTWUKGAHCTDGB-YYDVJCTNSA-N	504.29478504							115843
BRD-K41311485-001-01-9	LSM-27301	BRD-K41311485	54634145	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27+/m0/s1	VDJCKUULTDNAAX-NOMHHCBYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc5ccncc5)C[C@@H]1C	BroadT	BRD-K41311485	BRD-K41311485-001-01-9	Broad Institute of MIT and Harvard	BRD-K41311485			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27+/m0/s1	VDJCKUULTDNAAX-NOMHHCBYSA-N	573.24097534							115844
BRD-K66579420-001-01-9	LSM-27302	BRD-K66579420	54634278	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-17(25)6-8-18)9-10-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	IDXVVRWJPVHXLQ-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K66579420	BRD-K66579420-001-01-9	Broad Institute of MIT and Harvard	BRD-K66579420			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-17(25)6-8-18)9-10-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22+/m1/s1	IDXVVRWJPVHXLQ-VVBPWWLESA-N	458.232933712							115845
BRD-K42803695-001-01-0	LSM-27303	BRD-K42803695	54634286	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m0/s1	CNRVBXYBTSVRFK-AVYPCKFXSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K42803695	BRD-K42803695-001-01-0	Broad Institute of MIT and Harvard	BRD-K42803695			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m0/s1	CNRVBXYBTSVRFK-AVYPCKFXSA-N	419.242021186							115846
BRD-K63972351-001-01-2	LSM-27304	BRD-K63972351	54634435	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	HPGQIGUDQFUDBC-YZZKKUAISA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K63972351	BRD-K63972351-001-01-2	Broad Institute of MIT and Harvard	BRD-K63972351			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	HPGQIGUDQFUDBC-YZZKKUAISA-N	482.252920228							115847
BRD-K73884583-001-01-7	LSM-27305	BRD-K73884583	54634242	InChI=1S/C31H38N4O6S/c1-21-8-6-10-26(14-21)42(38,39)33-25-11-12-27-28(16-25)41-20-23(3)35(30(36)15-24-9-7-13-32-17-24)18-22(2)29(40-5)19-34(4)31(27)37/h6-14,16-17,22-23,29,33H,15,18-20H2,1-5H3/t22-,23-,29-/m1/s1	YAWHVHOWVVLDOZ-VDWGHMIBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(C)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc4cccnc4	BroadT	BRD-K73884583	BRD-K73884583-001-01-7	Broad Institute of MIT and Harvard	BRD-K73884583			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3cccc(C)c3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Cc1cccnc1	InChI=1S/C31H38N4O6S/c1-21-8-6-10-26(14-21)42(38,39)33-25-11-12-27-28(16-25)41-20-23(3)35(30(36)15-24-9-7-13-32-17-24)18-22(2)29(40-5)19-34(4)31(27)37/h6-14,16-17,22-23,29,33H,15,18-20H2,1-5H3/t22-,23-,29-/m1/s1	YAWHVHOWVVLDOZ-VDWGHMIBSA-N	594.251205666							115848
BRD-K97378175-001-01-6	LSM-27306	BRD-K97378175	54634281	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m1/s1	CNRVBXYBTSVRFK-STXHMFSFSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K97378175	BRD-K97378175-001-01-6	Broad Institute of MIT and Harvard	BRD-K97378175			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m1/s1	CNRVBXYBTSVRFK-STXHMFSFSA-N	419.242021186							115849
BRD-K91071880-001-01-9	LSM-27307	BRD-K91071880	54634408	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m0/s1	YTFMHZRWJRHUBM-JKSBSHDWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K91071880	BRD-K91071880-001-01-9	Broad Institute of MIT and Harvard	BRD-K91071880			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m0/s1	YTFMHZRWJRHUBM-JKSBSHDWSA-N	447.273321314							115850
BRD-K00241924-001-01-6	LSM-27308	BRD-K00241924	54634375	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24-/m1/s1	GCVUEFRAKHDCHL-KHCICDEESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K00241924	BRD-K00241924-001-01-6	Broad Institute of MIT and Harvard	BRD-K00241924			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19-,24-/m1/s1	GCVUEFRAKHDCHL-KHCICDEESA-N	489.22974194							115851
BRD-K83538063-001-01-6	LSM-27309	BRD-K83538063	54634287	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15+,20-/m0/s1	CNRVBXYBTSVRFK-MDOVXXIYSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K83538063	BRD-K83538063-001-01-6	Broad Institute of MIT and Harvard	BRD-K83538063			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15+,20-/m0/s1	CNRVBXYBTSVRFK-MDOVXXIYSA-N	419.242021186							115852
BRD-K62002770-001-01-2	LSM-27310	BRD-K62002770	54634300	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16+,20+/m0/s1	LPUASZNJMDRPQZ-RZQQEMMASA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K62002770	BRD-K62002770-001-01-2	Broad Institute of MIT and Harvard	BRD-K62002770			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16+,20+/m0/s1	LPUASZNJMDRPQZ-RZQQEMMASA-N	465.24750049							115853
BRD-K99936346-001-01-3	LSM-27311	BRD-K99936346	54634395	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22-/m1/s1	COGTYPOCQQQYGQ-KGVIQGDOSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K99936346	BRD-K99936346-001-01-3	Broad Institute of MIT and Harvard	BRD-K99936346			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22-/m1/s1	COGTYPOCQQQYGQ-KGVIQGDOSA-N	433.294056758							115854
BRD-K55120206-001-01-5	LSM-27312	BRD-K55120206	54634275	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20-/m1/s1	XSLDIBSITHUXPL-QEEYODRMSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C	BroadT	BRD-K55120206	BRD-K55120206-001-01-5	Broad Institute of MIT and Harvard	BRD-K55120206			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20-/m1/s1	XSLDIBSITHUXPL-QEEYODRMSA-N	435.236935806							115855
BRD-K53371416-001-01-2	LSM-27313	BRD-K53371416	54634385	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15+,20+/m1/s1	OTDLGAQSEPTCMV-SIFCLUCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K53371416	BRD-K53371416-001-01-2	Broad Institute of MIT and Harvard	BRD-K53371416			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15+,20+/m1/s1	OTDLGAQSEPTCMV-SIFCLUCFSA-N	403.247106566							115856
BRD-K63835902-001-01-5	LSM-27314	BRD-K63835902	54634311	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(8-11-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23+/m1/s1	AVBHYNTVSDLUSA-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K63835902	BRD-K63835902-001-01-5	Broad Institute of MIT and Harvard	BRD-K63835902			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(8-11-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23+/m1/s1	AVBHYNTVSDLUSA-QZMQVMSPSA-N	470.252920228							115857
BRD-K27640884-001-01-6	LSM-27315	BRD-K27640884	54634453	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17-,21+/m1/s1	CBUFPLKBNRJCSB-LZJOCLMNSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@H]1C)OC	BroadT	BRD-K27640884	BRD-K27640884-001-01-6	Broad Institute of MIT and Harvard	BRD-K27640884			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17-,21+/m1/s1	CBUFPLKBNRJCSB-LZJOCLMNSA-N	435.273321314							115858
BRD-K57447071-001-01-2	LSM-27316	BRD-K57447071	54634280	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-17(25)6-8-18)9-10-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	IDXVVRWJPVHXLQ-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K57447071	BRD-K57447071-001-01-2	Broad Institute of MIT and Harvard	BRD-K57447071			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-17(25)6-8-18)9-10-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16+,22-/m1/s1	IDXVVRWJPVHXLQ-ZMPRRUGASA-N	458.232933712							115859
BRD-K11984658-001-01-0	LSM-27317	BRD-K11984658	54634232	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23-/m0/s1	BBNOXYVHIXNILT-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K11984658	BRD-K11984658-001-01-0	Broad Institute of MIT and Harvard	BRD-K11984658			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23-/m0/s1	BBNOXYVHIXNILT-BSRJHKFKSA-N	439.247106566							115860
BRD-K20747951-001-01-4	LSM-27318	BRD-K20747951	54634205	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	MWXNSOOKWBVWAA-IEGUWTFLSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccncc3	BroadT	BRD-K20747951	BRD-K20747951-001-01-4	Broad Institute of MIT and Harvard	BRD-K20747951			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccncc2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23-/m1/s1	MWXNSOOKWBVWAA-IEGUWTFLSA-N	482.252920228							115861
BRD-K38294415-001-01-7	LSM-27319	BRD-K38294415	54634196	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19-,24-/m1/s1	RENBNVSQSOQEFF-KHCICDEESA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K38294415	BRD-K38294415-001-01-7	Broad Institute of MIT and Harvard	BRD-K38294415			CCC(=O)N1C[C@@H](C)[C@H](OC)CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H]1C	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19-,24-/m1/s1	RENBNVSQSOQEFF-KHCICDEESA-N	487.304621442							115862
BRD-K42376176-001-01-5	LSM-27320	BRD-K42376176	54634356	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m0/s1	NQRVDZOPZOORAV-XLNZFTOWSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K42376176	BRD-K42376176-001-01-5	Broad Institute of MIT and Harvard	BRD-K42376176			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24+/m0/s1	NQRVDZOPZOORAV-XLNZFTOWSA-N	453.26275663							115863
BRD-K87254984-001-01-2	LSM-27321	BRD-K87254984	54634191	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17+,21-/m1/s1	YMYKUEFQMUUFAJ-LLGFUMIMSA-N	CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K87254984	BRD-K87254984-001-01-2	Broad Institute of MIT and Harvard	BRD-K87254984			CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17+,21-/m1/s1	YMYKUEFQMUUFAJ-LLGFUMIMSA-N	498.251205666							115864
BRD-K79534443-001-01-2	LSM-27322	BRD-K79534443	54634340	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-13-21(28-26(33)27-20-9-7-6-8-10-20)11-12-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24+/m0/s1	MYURTGQUXIJGDV-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K79534443	BRD-K79534443-001-01-2	Broad Institute of MIT and Harvard	BRD-K79534443			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-13-21(28-26(33)27-20-9-7-6-8-10-20)11-12-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18-,24+/m0/s1	MYURTGQUXIJGDV-LLJLJFOGSA-N	482.252920228							115865
BRD-K21979173-001-01-4	LSM-27323	BRD-K21979173	54634358	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m0/s1	NQRVDZOPZOORAV-GLDPYIMESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K21979173	BRD-K21979173-001-01-4	Broad Institute of MIT and Harvard	BRD-K21979173			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19+,24-/m0/s1	NQRVDZOPZOORAV-GLDPYIMESA-N	453.26275663							115866
BRD-K42910129-001-01-9	LSM-27324	BRD-K42910129	54634365	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19-/m0/s1	NCNZCRGMWPPFEB-DOXZYTNZSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K42910129	BRD-K42910129-001-01-9	Broad Institute of MIT and Harvard	BRD-K42910129			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19-/m0/s1	NCNZCRGMWPPFEB-DOXZYTNZSA-N	455.209006496							115867
BRD-K53889083-001-01-5	LSM-27325	BRD-K53889083	54634195	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19+,24+/m0/s1	RENBNVSQSOQEFF-XLNZFTOWSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K53889083	BRD-K53889083-001-01-5	Broad Institute of MIT and Harvard	BRD-K53889083			CCC(=O)N1C[C@H](C)[C@H](OC)CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H]1C	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19+,24+/m0/s1	RENBNVSQSOQEFF-XLNZFTOWSA-N	487.304621442							115868
BRD-K48721554-001-01-8	LSM-27326	BRD-K48721554	54634168	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-17-18(9-16)29-12-15(4)22-10-14(3)19(28-6)11-25(5)20(17)26/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19-/m0/s1	BCEADABJMKBPCA-KHYOSLBOSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K48721554	BRD-K48721554-001-01-8	Broad Institute of MIT and Harvard	BRD-K48721554			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-17-18(9-16)29-12-15(4)22-10-14(3)19(28-6)11-25(5)20(17)26/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19-/m0/s1	BCEADABJMKBPCA-KHYOSLBOSA-N	406.258005608							115869
BRD-K65911477-001-01-7	LSM-27327	BRD-K65911477	54634221	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-18(26)7-9-19)10-11-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m1/s1	JEYMQXVPUHGLIB-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K65911477	BRD-K65911477-001-01-7	Broad Institute of MIT and Harvard	BRD-K65911477			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-18(26)7-9-19)10-11-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m1/s1	JEYMQXVPUHGLIB-DGGJZMOXSA-N	488.219033286							115870
BRD-K04419755-001-01-8	LSM-27328	BRD-K04419755	54634266	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21-/m0/s1	XCHGKOIROWQQCM-QYWGDWMGSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K04419755	BRD-K04419755-001-01-8	Broad Institute of MIT and Harvard	BRD-K04419755			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21-/m0/s1	XCHGKOIROWQQCM-QYWGDWMGSA-N	448.268570292							115871
BRD-K14157853-001-01-3	LSM-27329	BRD-K14157853	54634260	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22-/m0/s1	VGIZUFWCBMAECV-SVMVAKDDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K14157853	BRD-K14157853-001-01-3	Broad Institute of MIT and Harvard	BRD-K14157853			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22-/m0/s1	VGIZUFWCBMAECV-SVMVAKDDSA-N	491.310769462							115872
BRD-K67704884-001-01-1	LSM-27330	BRD-K67704884	54634193	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19-,24+/m0/s1	RENBNVSQSOQEFF-AXHZCLLHSA-N	CCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H]1C)OC	BroadT	BRD-K67704884	BRD-K67704884-001-01-1	Broad Institute of MIT and Harvard	BRD-K67704884			CCC(=O)N1C[C@H](C)[C@H](OC)CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H]1C	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19-,24+/m0/s1	RENBNVSQSOQEFF-AXHZCLLHSA-N	487.304621442							115873
BRD-K15317580-001-01-2	LSM-27331	BRD-K15317580	54634217	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19-/m0/s1	NNLGSVIPEFKMPH-KHYOSLBOSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K15317580	BRD-K15317580-001-01-2	Broad Institute of MIT and Harvard	BRD-K15317580			CCCC(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19-/m0/s1	NNLGSVIPEFKMPH-KHYOSLBOSA-N	391.247106566							115874
BRD-K48692579-001-01-2	LSM-27332	BRD-K48692579	54634368	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24-/m1/s1	WNEVNPYHFIROBB-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K48692579	BRD-K48692579-001-01-2	Broad Institute of MIT and Harvard	BRD-K48692579			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24-/m1/s1	WNEVNPYHFIROBB-QZTZHPFYSA-N	469.25767125							115875
BRD-K80380728-001-01-3	LSM-27333	BRD-K80380728	54634202	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	MWXNSOOKWBVWAA-YZZKKUAISA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)c3ccncc3	BroadT	BRD-K80380728	BRD-K80380728-001-01-3	Broad Institute of MIT and Harvard	BRD-K80380728			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccncc2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m0/s1	MWXNSOOKWBVWAA-YZZKKUAISA-N	482.252920228							115876
BRD-K18341023-001-01-4	LSM-27334	BRD-K18341023	54634197	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19+,24-/m0/s1	RENBNVSQSOQEFF-GLDPYIMESA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K18341023	BRD-K18341023-001-01-4	Broad Institute of MIT and Harvard	BRD-K18341023			CCC(=O)N1C[C@H](C)[C@@H](OC)CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H]1C	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19+,24-/m0/s1	RENBNVSQSOQEFF-GLDPYIMESA-N	487.304621442							115877
BRD-K10395996-001-01-1	LSM-27335	BRD-K10395996	54634155	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-18-19(11-17)29-14-16(3)24(4)12-15(2)20(28-6)13-25(5)22(18)27/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20+/m0/s1	GQKMEBDXNYRVIF-RZQQEMMASA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(C)[C@H](C)COc2c1	BroadT	BRD-K10395996	BRD-K10395996-001-01-1	Broad Institute of MIT and Harvard	BRD-K10395996			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-18-19(11-17)29-14-16(3)24(4)12-15(2)20(28-6)13-25(5)22(18)27/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20+/m0/s1	GQKMEBDXNYRVIF-RZQQEMMASA-N	405.26275663							115878
BRD-K05669308-001-01-9	LSM-27336	BRD-K05669308	54634418	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19-,23-/m1/s1	NQTWUKGAHCTDGB-DNVFCKCGSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)CN3CCOCC3	BroadT	BRD-K05669308	BRD-K05669308-001-01-9	Broad Institute of MIT and Harvard	BRD-K05669308			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CN2CCOCC2)c1	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19-,23-/m1/s1	NQTWUKGAHCTDGB-DNVFCKCGSA-N	504.29478504							115879
BRD-K50207032-001-01-5	LSM-27337	BRD-K50207032	54634295	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23-/m1/s1	BXKRIFOMXVJDTH-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K50207032	BRD-K50207032-001-01-5	Broad Institute of MIT and Harvard	BRD-K50207032			CO[C@H]1[C@H](C)CN(C)[C@@H](C)COc2ccc(cc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23-/m1/s1	BXKRIFOMXVJDTH-IEGUWTFLSA-N	475.214091876							115880
BRD-K90874312-001-01-5	LSM-27338	BRD-K90874312	54634214	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19+/m1/s1	NNLGSVIPEFKMPH-VCBZYWHSSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K90874312	BRD-K90874312-001-01-5	Broad Institute of MIT and Harvard	BRD-K90874312			CCCC(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15+,19+/m1/s1	NNLGSVIPEFKMPH-VCBZYWHSSA-N	391.247106566							115881
CHEMBL2362324	LSM-27339	SID131430418, BRD-K31652752	54634165	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-17-18(9-16)29-12-15(4)22-10-14(3)19(28-6)11-25(5)20(17)26/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15-,19+/m1/s1	BCEADABJMKBPCA-CLCXKQKWSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K31652752	BRD-K31652752-001-01-4	Broad Institute of MIT and Harvard	BRD-K31652752			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-17-18(9-16)29-12-15(4)22-10-14(3)19(28-6)11-25(5)20(17)26/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15-,19+/m1/s1	BCEADABJMKBPCA-CLCXKQKWSA-N	406.258005608							115882
BRD-K20322710-001-01-8	LSM-27340	BRD-K20322710	54634148	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27+/m0/s1	VDJCKUULTDNAAX-FYQCMVGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc5ccncc5)C[C@@H]1C	BroadT	BRD-K20322710	BRD-K20322710-001-01-8	Broad Institute of MIT and Harvard	BRD-K20322710			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27+/m0/s1	VDJCKUULTDNAAX-FYQCMVGJSA-N	573.24097534							115883
BRD-K07716317-001-01-5	LSM-27341	BRD-K07716317	54634389	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18-,22-/m1/s1	COGTYPOCQQQYGQ-JBYIUTFZSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	BroadT	BRD-K07716317	BRD-K07716317-001-01-5	Broad Institute of MIT and Harvard	BRD-K07716317			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18-,22-/m1/s1	COGTYPOCQQQYGQ-JBYIUTFZSA-N	433.294056758							115884
BRD-K26762105-001-01-2	LSM-27342	BRD-K26762105	54634310	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(8-11-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23-/m1/s1	AVBHYNTVSDLUSA-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K26762105	BRD-K26762105-001-01-2	Broad Institute of MIT and Harvard	BRD-K26762105			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(OC)cc3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(8-11-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23-/m1/s1	AVBHYNTVSDLUSA-SEPYTNNBSA-N	470.252920228							115885
BRD-K34124517-001-01-7	LSM-27343	BRD-K34124517	54634200	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m0/s1	MWXNSOOKWBVWAA-IUKKYPGJSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccncc3	BroadT	BRD-K34124517	BRD-K34124517-001-01-7	Broad Institute of MIT and Harvard	BRD-K34124517			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccncc2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m0/s1	MWXNSOOKWBVWAA-IUKKYPGJSA-N	482.252920228							115886
BRD-K81288769-001-01-7	LSM-27344	BRD-K81288769	54634397	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-7-6-15(24-32(28,29)12-20(21,22)23)8-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14-,18+/m1/s1	NAKUAOPJLXDQOX-LBTNJELSSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K81288769	BRD-K81288769-001-01-7	Broad Institute of MIT and Harvard	BRD-K81288769			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-7-6-15(24-32(28,29)12-20(21,22)23)8-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14-,18+/m1/s1	NAKUAOPJLXDQOX-LBTNJELSSA-N	481.18582638							115887
BRD-K96145526-001-01-6	LSM-27345	BRD-K96145526	54634319	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20+/m0/s1	LSBAXAJPBMYKOG-RZQQEMMASA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H]1C)OC	BroadT	BRD-K96145526	BRD-K96145526-001-01-6	Broad Institute of MIT and Harvard	BRD-K96145526			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H]1C)OC	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20+/m0/s1	LSBAXAJPBMYKOG-RZQQEMMASA-N	441.22974194							115888
BRD-K52043064-001-01-3	LSM-27346	BRD-K52043064	54634243	InChI=1S/C28H44N4O5/c1-19-15-32(27(34)21-10-8-7-9-11-21)20(2)18-37-24-14-22(29-26(33)17-30(3)4)12-13-23(24)28(35)31(5)16-25(19)36-6/h12-14,19-21,25H,7-11,15-18H2,1-6H3,(H,29,33)/t19-,20-,25-/m1/s1	IFWHMPCIUXQPDW-UMEGOILYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)CN(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CCCCC3	BroadT	BRD-K52043064	BRD-K52043064-001-01-3	Broad Institute of MIT and Harvard	BRD-K52043064			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)CN(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCCCC1	InChI=1S/C28H44N4O5/c1-19-15-32(27(34)21-10-8-7-9-11-21)20(2)18-37-24-14-22(29-26(33)17-30(3)4)12-13-23(24)28(35)31(5)16-25(19)36-6/h12-14,19-21,25H,7-11,15-18H2,1-6H3,(H,29,33)/t19-,20-,25-/m1/s1	IFWHMPCIUXQPDW-UMEGOILYSA-N	516.331170548							115889
BRD-K24472528-001-01-9	LSM-27347	BRD-K24472528	54634357	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24-/m0/s1	NQRVDZOPZOORAV-JXQFQVJHSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K24472528	BRD-K24472528-001-01-9	Broad Institute of MIT and Harvard	BRD-K24472528			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24-/m0/s1	NQRVDZOPZOORAV-JXQFQVJHSA-N	453.26275663							115890
BRD-K46452107-001-01-4	LSM-27348	BRD-K46452107	54634332	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21-/m1/s1	HCBZRBWAINIAIP-WHSLLNHNSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K46452107	BRD-K46452107-001-01-4	Broad Institute of MIT and Harvard	BRD-K46452107			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21-/m1/s1	HCBZRBWAINIAIP-WHSLLNHNSA-N	433.25767125							115891
BRD-K54788330-001-01-9	LSM-27349	BRD-K54788330	54634306	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20+/m0/s1	KXQBGTLFJGTYSJ-RZQQEMMASA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(C)[C@H](C)COc2c1	BroadT	BRD-K54788330	BRD-K54788330-001-01-9	Broad Institute of MIT and Harvard	BRD-K54788330			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(C)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20+/m0/s1	KXQBGTLFJGTYSJ-RZQQEMMASA-N	420.273655672							115892
BRD-K45710967-001-01-5	LSM-27350	BRD-K45710967	54634452	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-7-18(26)11-19)9-10-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m1/s1	IAEXBJMXVKONHW-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K45710967	BRD-K45710967-001-01-5	Broad Institute of MIT and Harvard	BRD-K45710967			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-7-18(26)11-19)9-10-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m1/s1	IAEXBJMXVKONHW-SAHWJRBASA-N	472.248583776							115893
BRD-K60384728-001-01-9	LSM-27351	BRD-K60384728	54634190	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17-,21-/m0/s1	YMYKUEFQMUUFAJ-FIKGOQFSSA-N	CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K60384728	BRD-K60384728-001-01-9	Broad Institute of MIT and Harvard	BRD-K60384728			CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17-,21-/m0/s1	YMYKUEFQMUUFAJ-FIKGOQFSSA-N	498.251205666							115894
BRD-K66555184-001-01-5	LSM-27352	BRD-K66555184	54634432	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m1/s1	DGGJSEMSEUAJQA-HHJKRLRDSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccc3F)[C@@H](C)COc2c1	BroadT	BRD-K66555184	BRD-K66555184-001-01-5	Broad Institute of MIT and Harvard	BRD-K66555184			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m1/s1	DGGJSEMSEUAJQA-HHJKRLRDSA-N	485.268984862							115895
BRD-K02110718-001-01-1	LSM-27353	BRD-K02110718	54634288	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23-/m1/s1	BXKRIFOMXVJDTH-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K02110718	BRD-K02110718-001-01-1	Broad Institute of MIT and Harvard	BRD-K02110718			CO[C@H]1[C@H](C)CN(C)[C@H](C)COc2ccc(cc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23-/m1/s1	BXKRIFOMXVJDTH-PMAPCBKXSA-N	475.214091876							115896
BRD-K42647635-001-01-4	LSM-27354	BRD-K42647635	54634265	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16+,21+/m0/s1	XCHGKOIROWQQCM-GCKMJXCFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K42647635	BRD-K42647635-001-01-4	Broad Institute of MIT and Harvard	BRD-K42647635			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16+,21+/m0/s1	XCHGKOIROWQQCM-GCKMJXCFSA-N	448.268570292							115897
BRD-K73817081-001-01-4	LSM-27355	BRD-K73817081	54634328	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	GLKVRACLSULUNI-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K73817081	BRD-K73817081-001-01-4	Broad Institute of MIT and Harvard	BRD-K73817081			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17+,23+/m0/s1	GLKVRACLSULUNI-YGKZAACZSA-N	457.237684734							115898
BRD-K38304603-001-01-6	LSM-27356	BRD-K38304603	54634201	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	MWXNSOOKWBVWAA-STSQHVNTSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccncc3	BroadT	BRD-K38304603	BRD-K38304603-001-01-6	Broad Institute of MIT and Harvard	BRD-K38304603			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccncc2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	MWXNSOOKWBVWAA-STSQHVNTSA-N	482.252920228							115899
BRD-K57329557-001-01-5	LSM-27357	BRD-K57329557	54634263	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21+/m1/s1	XCHGKOIROWQQCM-ZOCZFRKYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K57329557	BRD-K57329557-001-01-5	Broad Institute of MIT and Harvard	BRD-K57329557			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21+/m1/s1	XCHGKOIROWQQCM-ZOCZFRKYSA-N	448.268570292							115900
BRD-K45535542-001-01-0	LSM-27358	BRD-K45535542	54634459	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21-/m1/s1	CBUFPLKBNRJCSB-LLGFUMIMSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@@H]1C)OC	BroadT	BRD-K45535542	BRD-K45535542-001-01-0	Broad Institute of MIT and Harvard	BRD-K45535542			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21-/m1/s1	CBUFPLKBNRJCSB-LLGFUMIMSA-N	435.273321314							115901
BRD-K30124080-001-01-8	LSM-27359	BRD-K30124080	54634229	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m0/s1	BBNOXYVHIXNILT-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K30124080	BRD-K30124080-001-01-8	Broad Institute of MIT and Harvard	BRD-K30124080			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18-,23+/m0/s1	BBNOXYVHIXNILT-IUKKYPGJSA-N	439.247106566							115902
BRD-K74338348-001-01-9	LSM-27360	BRD-K74338348	54634251	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24-/m1/s1	KOWUZEVVBMMFIA-NXMSCROESA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K74338348	BRD-K74338348-001-01-9	Broad Institute of MIT and Harvard	BRD-K74338348			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24-/m1/s1	KOWUZEVVBMMFIA-NXMSCROESA-N	499.248249418							115903
BRD-K55346158-001-01-4	LSM-27361	BRD-K55346158	54634169	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-17-18(9-16)29-12-15(4)22-10-14(3)19(28-6)11-25(5)20(17)26/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19-/m1/s1	BCEADABJMKBPCA-ZRGWGRIASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K55346158	BRD-K55346158-001-01-4	Broad Institute of MIT and Harvard	BRD-K55346158			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-17-18(9-16)29-12-15(4)22-10-14(3)19(28-6)11-25(5)20(17)26/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19-/m1/s1	BCEADABJMKBPCA-ZRGWGRIASA-N	406.258005608							115904
BRD-K86175430-001-01-0	LSM-27362	BRD-K86175430	54634291	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23+/m1/s1	BXKRIFOMXVJDTH-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K86175430	BRD-K86175430-001-01-0	Broad Institute of MIT and Harvard	BRD-K86175430			CO[C@@H]1[C@H](C)CN(C)[C@@H](C)COc2ccc(cc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23+/m1/s1	BXKRIFOMXVJDTH-STSQHVNTSA-N	475.214091876							115905
BRD-K66832982-001-01-2	LSM-27363	BRD-K66832982	54634292	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23+/m0/s1	BXKRIFOMXVJDTH-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K66832982	BRD-K66832982-001-01-2	Broad Institute of MIT and Harvard	BRD-K66832982			CO[C@H]1[C@@H](C)CN(C)[C@H](C)COc2ccc(cc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23+/m0/s1	BXKRIFOMXVJDTH-YZZKKUAISA-N	475.214091876							115906
BRD-K55721543-001-01-2	LSM-27364	BRD-K55721543	54634156	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-18-19(11-17)29-14-16(3)24(4)12-15(2)20(28-6)13-25(5)22(18)27/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20-/m0/s1	GQKMEBDXNYRVIF-YRNRMSPPSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(C)[C@H](C)COc2c1	BroadT	BRD-K55721543	BRD-K55721543-001-01-2	Broad Institute of MIT and Harvard	BRD-K55721543			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-18-19(11-17)29-14-16(3)24(4)12-15(2)20(28-6)13-25(5)22(18)27/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20-/m0/s1	GQKMEBDXNYRVIF-YRNRMSPPSA-N	405.26275663							115907
BRD-K12299093-001-01-5	LSM-27365	BRD-K12299093	54634282	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m1/s1	CNRVBXYBTSVRFK-SXGZJXTBSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K12299093	BRD-K12299093-001-01-5	Broad Institute of MIT and Harvard	BRD-K12299093			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m1/s1	CNRVBXYBTSVRFK-SXGZJXTBSA-N	419.242021186							115908
BRD-K00839478-001-01-7	LSM-27366	BRD-K00839478	54634227	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-9-16(21-15(3)24)7-8-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14+,19-/m0/s1	KEAMYVMGHPITQJ-KSMMKXTCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)C	BroadT	BRD-K00839478	BRD-K00839478-001-01-7	Broad Institute of MIT and Harvard	BRD-K00839478			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)S(C)(=O)=O	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-9-16(21-15(3)24)7-8-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14+,19-/m0/s1	KEAMYVMGHPITQJ-KSMMKXTCSA-N	441.193356432							115909
BRD-K92048895-001-01-9	LSM-27367	BRD-K92048895	54634258	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18-,22-/m0/s1	VGIZUFWCBMAECV-SPEDKVCISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K92048895	BRD-K92048895-001-01-9	Broad Institute of MIT and Harvard	BRD-K92048895			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18-,22-/m0/s1	VGIZUFWCBMAECV-SPEDKVCISA-N	491.310769462							115910
BRD-K97501058-001-01-5	LSM-27368	BRD-K97501058	54634207	InChI=1S/C23H34F3N3O4/c1-6-21(30)27-17-7-8-18-19(11-17)33-14-16(3)29(10-9-23(24,25)26)12-15(2)20(32-5)13-28(4)22(18)31/h7-8,11,15-16,20H,6,9-10,12-14H2,1-5H3,(H,27,30)/t15-,16-,20+/m0/s1	KLQKGCQUDAKEQP-TWOQFEAHSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CCC(F)(F)F)[C@@H](C)COc2c1	BroadT	BRD-K97501058	BRD-K97501058-001-01-5	Broad Institute of MIT and Harvard	BRD-K97501058			CCC(=O)Nc1ccc2c(OC[C@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O4/c1-6-21(30)27-17-7-8-18-19(11-17)33-14-16(3)29(10-9-23(24,25)26)12-15(2)20(32-5)13-28(4)22(18)31/h7-8,11,15-16,20H,6,9-10,12-14H2,1-5H3,(H,27,30)/t15-,16-,20+/m0/s1	KLQKGCQUDAKEQP-TWOQFEAHSA-N	473.250141198							115911
BRD-K49745008-001-01-8	LSM-27369	BRD-K49745008	54634429	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m0/s1	DGGJSEMSEUAJQA-MHPIHPPYSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccccc3F)[C@@H](C)COc2c1	BroadT	BRD-K49745008	BRD-K49745008-001-01-8	Broad Institute of MIT and Harvard	BRD-K49745008			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3F)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m0/s1	DGGJSEMSEUAJQA-MHPIHPPYSA-N	485.268984862							115912
BRD-K62976808-001-01-3	LSM-27370	BRD-K62976808	54634216	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15-,19-/m0/s1	NNLGSVIPEFKMPH-DOXZYTNZSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K62976808	BRD-K62976808-001-01-3	Broad Institute of MIT and Harvard	BRD-K62976808			CCCC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15-,19-/m0/s1	NNLGSVIPEFKMPH-DOXZYTNZSA-N	391.247106566							115913
BRD-K15063689-001-01-2	LSM-27371	BRD-K15063689	54634182	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m0/s1	ACBVZQMFXFPRGI-DEYYWGMASA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K15063689	BRD-K15063689-001-01-2	Broad Institute of MIT and Harvard	BRD-K15063689			CCC(=O)Nc1ccc2c(OC[C@H](C)NC[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m0/s1	ACBVZQMFXFPRGI-DEYYWGMASA-N	377.231456502							115914
BRD-K60293048-001-01-5	LSM-27372	BRD-K60293048	54634235	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17-,22+/m0/s1	VMZAIKVTLMIHQJ-PNLZDCPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K60293048	BRD-K60293048-001-01-5	Broad Institute of MIT and Harvard	BRD-K60293048			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17-,22+/m0/s1	VMZAIKVTLMIHQJ-PNLZDCPESA-N	440.242355544							115915
BRD-K93438811-001-01-2	LSM-27373	BRD-K93438811	54634159	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m1/s1	IZVZICFLHPWRDR-LBTNJELSSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K93438811	BRD-K93438811-001-01-2	Broad Institute of MIT and Harvard	BRD-K93438811			COCC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m1/s1	IZVZICFLHPWRDR-LBTNJELSSA-N	393.226371122							115916
BRD-K21143836-001-01-6	LSM-27374	BRD-K21143836	54634171	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14-,18+/m0/s1	IWUYHSCDOFQSQQ-SUNYJGFJSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K21143836	BRD-K21143836-001-01-6	Broad Institute of MIT and Harvard	BRD-K21143836			CCS(=O)(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14-,18+/m0/s1	IWUYHSCDOFQSQQ-SUNYJGFJSA-N	413.198441812							115917
BRD-K51452547-001-01-4	LSM-27375	BRD-K51452547	54634383	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15-,20+/m1/s1	OTDLGAQSEPTCMV-SXGZJXTBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K51452547	BRD-K51452547-001-01-4	Broad Institute of MIT and Harvard	BRD-K51452547			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15-,20+/m1/s1	OTDLGAQSEPTCMV-SXGZJXTBSA-N	403.247106566							115918
BRD-K08020434-001-01-9	LSM-27376	BRD-K08020434	54634188	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17+,21+/m1/s1	YMYKUEFQMUUFAJ-WWMYMODYSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K08020434	BRD-K08020434-001-01-9	Broad Institute of MIT and Harvard	BRD-K08020434			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17+,21+/m1/s1	YMYKUEFQMUUFAJ-WWMYMODYSA-N	498.251205666							115919
BRD-K65219220-001-01-5	LSM-27377	BRD-K65219220	54634151	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27-/m1/s1	VDJCKUULTDNAAX-PBDKAQRYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc5ccncc5)C[C@H]1C	BroadT	BRD-K65219220	BRD-K65219220-001-01-5	Broad Institute of MIT and Harvard	BRD-K65219220			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27-/m1/s1	VDJCKUULTDNAAX-PBDKAQRYSA-N	573.24097534							115920
BRD-K93467992-001-01-2	LSM-27378	BRD-K93467992	54634416	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m0/s1	GLPQOGXKNQYMAV-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccccc3	BroadT	BRD-K93467992	BRD-K93467992-001-01-2	Broad Institute of MIT and Harvard	BRD-K93467992			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m0/s1	GLPQOGXKNQYMAV-RHGYRFJNSA-N	467.242021186							115921
BRD-K43286877-001-01-7	LSM-27379	BRD-K43286877	54634162	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m0/s1	IZVZICFLHPWRDR-PMUMKWKESA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K43286877	BRD-K43286877-001-01-7	Broad Institute of MIT and Harvard	BRD-K43286877			COCC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m0/s1	IZVZICFLHPWRDR-PMUMKWKESA-N	393.226371122							115922
BRD-K94545013-001-01-9	LSM-27380	BRD-K94545013	54634294	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23-/m0/s1	BXKRIFOMXVJDTH-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K94545013	BRD-K94545013-001-01-9	Broad Institute of MIT and Harvard	BRD-K94545013			CO[C@@H]1[C@@H](C)CN(C)[C@H](C)COc2ccc(cc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18+,23-/m0/s1	BXKRIFOMXVJDTH-IXFSTUDKSA-N	475.214091876							115923
BRD-K28017688-001-01-4	LSM-27381	BRD-K28017688	54634442	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20+,26+/m1/s1	KZQLWMFDTATSFP-GOHWNWGWSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K28017688	BRD-K28017688-001-01-4	Broad Institute of MIT and Harvard	BRD-K28017688			CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20+,26+/m1/s1	KZQLWMFDTATSFP-GOHWNWGWSA-N	497.288971378							115924
BRD-K82696158-001-01-9	LSM-27382	BRD-K82696158	54634239	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17-,22-/m0/s1	VMZAIKVTLMIHQJ-HOIFWPIMSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K82696158	BRD-K82696158-001-01-9	Broad Institute of MIT and Harvard	BRD-K82696158			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17-,22-/m0/s1	VMZAIKVTLMIHQJ-HOIFWPIMSA-N	440.242355544							115925
BRD-K18566432-001-01-1	LSM-27383	BRD-K18566432	54634413	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m0/s1	GLPQOGXKNQYMAV-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccccc3	BroadT	BRD-K18566432	BRD-K18566432-001-01-1	Broad Institute of MIT and Harvard	BRD-K18566432			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m0/s1	GLPQOGXKNQYMAV-HOOSLVGPSA-N	467.242021186							115926
BRD-K34545368-001-01-3	LSM-27384	BRD-K34545368	54634269	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m1/s1	XSLDIBSITHUXPL-STXHMFSFSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K34545368	BRD-K34545368-001-01-3	Broad Institute of MIT and Harvard	BRD-K34545368			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20-/m1/s1	XSLDIBSITHUXPL-STXHMFSFSA-N	435.236935806							115927
BRD-K42966506-001-01-4	LSM-27385	BRD-K42966506	54634326	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	GLKVRACLSULUNI-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K42966506	BRD-K42966506-001-01-4	Broad Institute of MIT and Harvard	BRD-K42966506			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H32FN3O4/c1-16-13-28(3)17(2)15-33-22-11-10-20(27-24(30)18-6-8-19(26)9-7-18)12-21(22)25(31)29(4)14-23(16)32-5/h6-12,16-17,23H,13-15H2,1-5H3,(H,27,30)/t16-,17-,23+/m1/s1	GLKVRACLSULUNI-QZMQVMSPSA-N	457.237684734							115928
BRD-K51205051-001-01-4	LSM-27386	BRD-K51205051	54634401	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-7-6-15(24-32(28,29)12-20(21,22)23)8-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14+,18-/m1/s1	NAKUAOPJLXDQOX-QWQRMKEZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K51205051	BRD-K51205051-001-01-4	Broad Institute of MIT and Harvard	BRD-K51205051			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-7-6-15(24-32(28,29)12-20(21,22)23)8-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14+,18-/m1/s1	NAKUAOPJLXDQOX-QWQRMKEZSA-N	481.18582638							115929
BRD-K38375888-001-01-2	LSM-27387	BRD-K38375888	54634391	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22+/m1/s1	COGTYPOCQQQYGQ-FGSXEWAUSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K38375888	BRD-K38375888-001-01-2	Broad Institute of MIT and Harvard	BRD-K38375888			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22+/m1/s1	COGTYPOCQQQYGQ-FGSXEWAUSA-N	433.294056758							115930
BRD-K40911145-001-01-9	LSM-27388	BRD-K40911145	54634434	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	HPGQIGUDQFUDBC-STSQHVNTSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K40911145	BRD-K40911145-001-01-9	Broad Institute of MIT and Harvard	BRD-K40911145			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18+,23+/m1/s1	HPGQIGUDQFUDBC-STSQHVNTSA-N	482.252920228							115931
BRD-K15335187-001-01-1	LSM-27389	BRD-K15335187	54634184	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m1/s1	ACBVZQMFXFPRGI-QWQRMKEZSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K15335187	BRD-K15335187-001-01-1	Broad Institute of MIT and Harvard	BRD-K15335187			CCC(=O)Nc1ccc2c(OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m1/s1	ACBVZQMFXFPRGI-QWQRMKEZSA-N	377.231456502							115932
BRD-K05018589-001-01-9	LSM-27390	BRD-K05018589	54634248	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18-,24-/m0/s1	KOWUZEVVBMMFIA-XFAGBWLFSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K05018589	BRD-K05018589-001-01-9	Broad Institute of MIT and Harvard	BRD-K05018589			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18-,24-/m0/s1	KOWUZEVVBMMFIA-XFAGBWLFSA-N	499.248249418							115933
BRD-K70414920-001-01-8	LSM-27391	BRD-K70414920	54634225	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-9-16(21-15(3)24)7-8-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14-,19-/m1/s1	KEAMYVMGHPITQJ-PJIJBLCYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K70414920	BRD-K70414920-001-01-8	Broad Institute of MIT and Harvard	BRD-K70414920			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-9-16(21-15(3)24)7-8-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14-,19-/m1/s1	KEAMYVMGHPITQJ-PJIJBLCYSA-N	441.193356432							115934
BRD-K98899174-001-01-1	LSM-27392	BRD-K98899174	54634253	InChI=1S/C28H34N4O7S/c1-18-15-32(40(35,36)22-9-7-6-8-10-22)19(2)17-38-25-14-21(29-27(33)24-13-20(3)39-30-24)11-12-23(25)28(34)31(4)16-26(18)37-5/h6-14,18-19,26H,15-17H2,1-5H3,(H,29,33)/t18-,19-,26-/m1/s1	PPUYVSOUEBCZTH-LJKQEARRSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c4ccccc4	BroadT	BRD-K98899174	BRD-K98899174-001-01-1	Broad Institute of MIT and Harvard	BRD-K98899174			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c1ccccc1	InChI=1S/C28H34N4O7S/c1-18-15-32(40(35,36)22-9-7-6-8-10-22)19(2)17-38-25-14-21(29-27(33)24-13-20(3)39-30-24)11-12-23(25)28(34)31(4)16-26(18)37-5/h6-14,18-19,26H,15-17H2,1-5H3,(H,29,33)/t18-,19-,26-/m1/s1	PPUYVSOUEBCZTH-LJKQEARRSA-N	570.214820158							115935
BRD-K99134742-001-01-5	LSM-27393	BRD-K99134742	54634455	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21+/m1/s1	CBUFPLKBNRJCSB-WWMYMODYSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@@H]1C)OC	BroadT	BRD-K99134742	BRD-K99134742-001-01-5	Broad Institute of MIT and Harvard	BRD-K99134742			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21+/m1/s1	CBUFPLKBNRJCSB-WWMYMODYSA-N	435.273321314							115936
BRD-K32276982-001-01-3	LSM-27394	BRD-K32276982	54634363	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19+/m1/s1	NCNZCRGMWPPFEB-VCBZYWHSSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K32276982	BRD-K32276982-001-01-3	Broad Institute of MIT and Harvard	BRD-K32276982			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19+/m1/s1	NCNZCRGMWPPFEB-VCBZYWHSSA-N	455.209006496							115937
BRD-K57526394-001-01-3	LSM-27395	BRD-K57526394	54634352	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24-/m1/s1	NQRVDZOPZOORAV-KHCICDEESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K57526394	BRD-K57526394-001-01-3	Broad Institute of MIT and Harvard	BRD-K57526394			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24-/m1/s1	NQRVDZOPZOORAV-KHCICDEESA-N	453.26275663							115938
BRD-K74500561-001-01-4	LSM-27396	BRD-K74500561	54634414	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m0/s1	GLPQOGXKNQYMAV-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccccc3	BroadT	BRD-K74500561	BRD-K74500561-001-01-4	Broad Institute of MIT and Harvard	BRD-K74500561			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m0/s1	GLPQOGXKNQYMAV-XFAGBWLFSA-N	467.242021186							115939
BRD-K13683812-001-01-9	LSM-27397	BRD-K13683812	54634177	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-21-9-10-23-22(12-21)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-20-8-7-11-26-13-20/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19-,24-/m1/s1	UWHHOQDATRPBOP-KHCICDEESA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K13683812	BRD-K13683812-001-01-9	Broad Institute of MIT and Harvard	BRD-K13683812			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)N(Cc3cccnc3)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C25H36N4O5S/c1-6-35(31,32)27-21-9-10-23-22(12-21)25(30)28(4)16-24(33-5)18(2)14-29(19(3)17-34-23)15-20-8-7-11-26-13-20/h7-13,18-19,24,27H,6,14-17H2,1-5H3/t18-,19-,24-/m1/s1	UWHHOQDATRPBOP-KHCICDEESA-N	504.240640982							115940
BRD-K67548663-001-01-9	LSM-27398	BRD-K67548663	54634406	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m0/s1	YTFMHZRWJRHUBM-GSHUGGBRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K67548663	BRD-K67548663-001-01-9	Broad Institute of MIT and Harvard	BRD-K67548663			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m0/s1	YTFMHZRWJRHUBM-GSHUGGBRSA-N	447.273321314							115941
BRD-K46653873-001-01-9	LSM-27399	BRD-K46653873	54634457	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17-,21-/m0/s1	CBUFPLKBNRJCSB-FIKGOQFSSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@@H]1C)OC	BroadT	BRD-K46653873	BRD-K46653873-001-01-9	Broad Institute of MIT and Harvard	BRD-K46653873			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17-,21-/m0/s1	CBUFPLKBNRJCSB-FIKGOQFSSA-N	435.273321314							115942
BRD-K30105006-001-01-8	LSM-27400	BRD-K30105006	54634445	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20+,26-/m0/s1	KZQLWMFDTATSFP-UNVFRBQDSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K30105006	BRD-K30105006-001-01-8	Broad Institute of MIT and Harvard	BRD-K30105006			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20+,26-/m0/s1	KZQLWMFDTATSFP-UNVFRBQDSA-N	497.288971378							115943
BRD-K06526639-001-01-0	LSM-27401	BRD-K06526639	54634206	InChI=1S/C23H34F3N3O4/c1-6-21(30)27-17-7-8-18-19(11-17)33-14-16(3)29(10-9-23(24,25)26)12-15(2)20(32-5)13-28(4)22(18)31/h7-8,11,15-16,20H,6,9-10,12-14H2,1-5H3,(H,27,30)/t15-,16-,20+/m1/s1	KLQKGCQUDAKEQP-QINHECLXSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CCC(F)(F)F)[C@H](C)COc2c1	BroadT	BRD-K06526639	BRD-K06526639-001-01-0	Broad Institute of MIT and Harvard	BRD-K06526639			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O4/c1-6-21(30)27-17-7-8-18-19(11-17)33-14-16(3)29(10-9-23(24,25)26)12-15(2)20(32-5)13-28(4)22(18)31/h7-8,11,15-16,20H,6,9-10,12-14H2,1-5H3,(H,27,30)/t15-,16-,20+/m1/s1	KLQKGCQUDAKEQP-QINHECLXSA-N	473.250141198							115944
BRD-K76012989-001-01-2	LSM-27402	BRD-K76012989	54634423	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19-,23-/m0/s1	NQTWUKGAHCTDGB-YDHSSHFGSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)CN3CCOCC3	BroadT	BRD-K76012989	BRD-K76012989-001-01-2	Broad Institute of MIT and Harvard	BRD-K76012989			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)CN2CCOCC2)c1	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19-,23-/m0/s1	NQTWUKGAHCTDGB-YDHSSHFGSA-N	504.29478504							115945
BRD-K93003148-001-01-8	LSM-27403	BRD-K93003148	54634347	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19+/m1/s1	AQVJCVRFMZPTMV-VCBZYWHSSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K93003148	BRD-K93003148-001-01-8	Broad Institute of MIT and Harvard	BRD-K93003148			CCCNC(=O)Nc1ccc2c(OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19+/m1/s1	AQVJCVRFMZPTMV-VCBZYWHSSA-N	406.258005608							115946
BRD-K04051198-001-01-4	LSM-27404	BRD-K04051198	54634219	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-18(26)7-9-19)10-11-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m1/s1	JEYMQXVPUHGLIB-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K04051198	BRD-K04051198-001-01-4	Broad Institute of MIT and Harvard	BRD-K04051198			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-18(26)7-9-19)10-11-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m1/s1	JEYMQXVPUHGLIB-QZMQVMSPSA-N	488.219033286							115947
BRD-K58195185-001-01-9	LSM-27405	BRD-K58195185	54634349	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15-,19-/m0/s1	AQVJCVRFMZPTMV-DOXZYTNZSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K58195185	BRD-K58195185-001-01-9	Broad Institute of MIT and Harvard	BRD-K58195185			CCCNC(=O)Nc1ccc2c(OC[C@H](C)NC[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15-,19-/m0/s1	AQVJCVRFMZPTMV-DOXZYTNZSA-N	406.258005608							115948
BRD-K87397286-001-01-4	LSM-27406	BRD-K87397286	54634301	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16-,20-/m0/s1	LPUASZNJMDRPQZ-FTRWYGJKSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K87397286	BRD-K87397286-001-01-4	Broad Institute of MIT and Harvard	BRD-K87397286			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16-,20-/m0/s1	LPUASZNJMDRPQZ-FTRWYGJKSA-N	465.24750049							115949
BRD-K76949527-001-01-4	LSM-27407	BRD-K76949527	54634394	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22-/m0/s1	COGTYPOCQQQYGQ-SVMVAKDDSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	BroadT	BRD-K76949527	BRD-K76949527-001-01-4	Broad Institute of MIT and Harvard	BRD-K76949527			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22-/m0/s1	COGTYPOCQQQYGQ-SVMVAKDDSA-N	433.294056758							115950
BRD-K95145680-001-01-9	LSM-27408	BRD-K95145680	54634272	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m1/s1	XSLDIBSITHUXPL-SIFCLUCFSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C	BroadT	BRD-K95145680	BRD-K95145680-001-01-9	Broad Institute of MIT and Harvard	BRD-K95145680			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m1/s1	XSLDIBSITHUXPL-SIFCLUCFSA-N	435.236935806							115951
BRD-K04489687-001-01-4	LSM-27409	BRD-K04489687	54634384	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15-,20+/m0/s1	OTDLGAQSEPTCMV-AUSJPIAWSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K04489687	BRD-K04489687-001-01-4	Broad Institute of MIT and Harvard	BRD-K04489687			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15-,20+/m0/s1	OTDLGAQSEPTCMV-AUSJPIAWSA-N	403.247106566							115952
BRD-K89209163-001-01-7	LSM-27410	BRD-K89209163	54634316	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16-,20+/m1/s1	LSBAXAJPBMYKOG-QINHECLXSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H]1C)OC	BroadT	BRD-K89209163	BRD-K89209163-001-01-7	Broad Institute of MIT and Harvard	BRD-K89209163			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H]1C)OC	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16-,20+/m1/s1	LSBAXAJPBMYKOG-QINHECLXSA-N	441.22974194							115953
BRD-K91497242-001-01-9	LSM-27411	BRD-K91497242	54634439	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20-,26-/m1/s1	KZQLWMFDTATSFP-XMERXJNXSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K91497242	BRD-K91497242-001-01-9	Broad Institute of MIT and Harvard	BRD-K91497242			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20-,26-/m1/s1	KZQLWMFDTATSFP-XMERXJNXSA-N	497.288971378							115954
BRD-K43767973-001-01-9	LSM-27412	BRD-K43767973	54634209	InChI=1S/C23H34F3N3O4/c1-6-21(30)27-17-7-8-18-19(11-17)33-14-16(3)29(10-9-23(24,25)26)12-15(2)20(32-5)13-28(4)22(18)31/h7-8,11,15-16,20H,6,9-10,12-14H2,1-5H3,(H,27,30)/t15-,16+,20+/m0/s1	KLQKGCQUDAKEQP-RZQQEMMASA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CCC(F)(F)F)[C@H](C)COc2c1	BroadT	BRD-K43767973	BRD-K43767973-001-01-9	Broad Institute of MIT and Harvard	BRD-K43767973			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O4/c1-6-21(30)27-17-7-8-18-19(11-17)33-14-16(3)29(10-9-23(24,25)26)12-15(2)20(32-5)13-28(4)22(18)31/h7-8,11,15-16,20H,6,9-10,12-14H2,1-5H3,(H,27,30)/t15-,16+,20+/m0/s1	KLQKGCQUDAKEQP-RZQQEMMASA-N	473.250141198							115955
BRD-K61504852-001-01-9	LSM-27413	BRD-K61504852	54634381	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24-/m1/s1	GCVUEFRAKHDCHL-YDIMBITNSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K61504852	BRD-K61504852-001-01-9	Broad Institute of MIT and Harvard	BRD-K61504852			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24-/m1/s1	GCVUEFRAKHDCHL-YDIMBITNSA-N	489.22974194							115956
BRD-K57053641-001-01-9	LSM-27414	BRD-K57053641	54634343	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-13-21(28-26(33)27-20-9-7-6-8-10-20)11-12-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m0/s1	MYURTGQUXIJGDV-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K57053641	BRD-K57053641-001-01-9	Broad Institute of MIT and Harvard	BRD-K57053641			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-13-21(28-26(33)27-20-9-7-6-8-10-20)11-12-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m0/s1	MYURTGQUXIJGDV-RHGYRFJNSA-N	482.252920228							115957
BRD-K50472505-001-01-3	LSM-27415	BRD-K50472505	54634348	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19+/m0/s1	AQVJCVRFMZPTMV-QMTMVMCOSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K50472505	BRD-K50472505-001-01-3	Broad Institute of MIT and Harvard	BRD-K50472505			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19+/m0/s1	AQVJCVRFMZPTMV-QMTMVMCOSA-N	406.258005608							131280
BRD-K86529104-001-01-3	LSM-27416	BRD-K86529104	54634261	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22-/m1/s1	VGIZUFWCBMAECV-KGVIQGDOSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K86529104	BRD-K86529104-001-01-3	Broad Institute of MIT and Harvard	BRD-K86529104			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22-/m1/s1	VGIZUFWCBMAECV-KGVIQGDOSA-N	491.310769462							115960
BRD-K62381513-001-01-2	LSM-27417	BRD-K62381513	54634276	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-17(25)6-8-18)9-10-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	IDXVVRWJPVHXLQ-MCFFVMPBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K62381513	BRD-K62381513-001-01-2	Broad Institute of MIT and Harvard	BRD-K62381513			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H31FN4O4/c1-15-12-26-16(2)14-33-21-11-19(28-24(31)27-18-7-5-17(25)6-8-18)9-10-20(21)23(30)29(3)13-22(15)32-4/h5-11,15-16,22,26H,12-14H2,1-4H3,(H2,27,28,31)/t15-,16-,22+/m1/s1	IDXVVRWJPVHXLQ-MCFFVMPBSA-N	458.232933712							115961
BRD-K72861429-001-01-4	LSM-27418	BRD-K72861429	54634270	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m1/s1	XSLDIBSITHUXPL-SXGZJXTBSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K72861429	BRD-K72861429-001-01-4	Broad Institute of MIT and Harvard	BRD-K72861429			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m1/s1	XSLDIBSITHUXPL-SXGZJXTBSA-N	435.236935806							115962
BRD-K79221627-001-01-4	LSM-27419	BRD-K79221627	54634186	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17-,21+/m0/s1	YMYKUEFQMUUFAJ-XGHQBKJUSA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K79221627	BRD-K79221627-001-01-4	Broad Institute of MIT and Harvard	BRD-K79221627			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)CC)ccc2OC[C@@H]1C)OC	InChI=1S/C23H38N4O6S/c1-7-11-24-23(29)27-13-16(3)21(32-6)14-26(5)22(28)19-12-18(25-34(30,31)8-2)9-10-20(19)33-15-17(27)4/h9-10,12,16-17,21,25H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17-,21+/m0/s1	YMYKUEFQMUUFAJ-XGHQBKJUSA-N	498.251205666							115963
BRD-K70234464-001-01-2	LSM-27420	BRD-K70234464	54634245	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18-,24+/m0/s1	KOWUZEVVBMMFIA-LLJLJFOGSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K70234464	BRD-K70234464-001-01-2	Broad Institute of MIT and Harvard	BRD-K70234464			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18-,24+/m0/s1	KOWUZEVVBMMFIA-LLJLJFOGSA-N	499.248249418							115964
BRD-K06268567-001-01-5	LSM-27421	BRD-K06268567	54634390	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18-,22+/m0/s1	COGTYPOCQQQYGQ-NPPFBWRTSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	BroadT	BRD-K06268567	BRD-K06268567-001-01-5	Broad Institute of MIT and Harvard	BRD-K06268567			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18-,22+/m0/s1	COGTYPOCQQQYGQ-NPPFBWRTSA-N	433.294056758							115965
BRD-K16939013-001-01-9	LSM-27422	BRD-K16939013	54634152	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-18-19(11-17)29-14-16(3)24(4)12-15(2)20(28-6)13-25(5)22(18)27/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16-,20+/m1/s1	GQKMEBDXNYRVIF-QINHECLXSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(C)[C@H](C)COc2c1	BroadT	BRD-K16939013	BRD-K16939013-001-01-9	Broad Institute of MIT and Harvard	BRD-K16939013			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-18-19(11-17)29-14-16(3)24(4)12-15(2)20(28-6)13-25(5)22(18)27/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16-,20+/m1/s1	GQKMEBDXNYRVIF-QINHECLXSA-N	405.26275663							115966
BRD-K98330720-001-01-6	LSM-27423	BRD-K98330720	54634366	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19-/m0/s1	NCNZCRGMWPPFEB-KHYOSLBOSA-N	CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H]1C)OC	BroadT	BRD-K98330720	BRD-K98330720-001-01-6	Broad Institute of MIT and Harvard	BRD-K98330720			CCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15+,19-/m0/s1	NCNZCRGMWPPFEB-KHYOSLBOSA-N	455.209006496							115967
MLS003650033	LSM-27424	SID125305337, BRD-K22338485	53382693	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m1/s1	ACBVZQMFXFPRGI-LBTNJELSSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K22338485	BRD-K22338485-001-01-5	Broad Institute of MIT and Harvard	BRD-K22338485			CCC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m1/s1	ACBVZQMFXFPRGI-LBTNJELSSA-N	377.231456502							115968
BRD-K50011338-001-01-2	LSM-27425	BRD-K50011338	54634341	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-13-21(28-26(33)27-20-9-7-6-8-10-20)11-12-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24+/m1/s1	MYURTGQUXIJGDV-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K50011338	BRD-K50011338-001-01-2	Broad Institute of MIT and Harvard	BRD-K50011338			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-13-21(28-26(33)27-20-9-7-6-8-10-20)11-12-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24+/m1/s1	MYURTGQUXIJGDV-YTZAWJCFSA-N	482.252920228							115969
BRD-K02593388-001-01-7	LSM-27426	BRD-K02593388	54634353	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m0/s1	NQRVDZOPZOORAV-AXHZCLLHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K02593388	BRD-K02593388-001-01-7	Broad Institute of MIT and Harvard	BRD-K02593388			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Cc3ccccc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O4/c1-18-15-28(3)19(2)17-33-23-12-11-21(27-25(30)13-20-9-7-6-8-10-20)14-22(23)26(31)29(4)16-24(18)32-5/h6-12,14,18-19,24H,13,15-17H2,1-5H3,(H,27,30)/t18-,19-,24+/m0/s1	NQRVDZOPZOORAV-AXHZCLLHSA-N	453.26275663							115970
BRD-K11526862-001-01-1	LSM-27427	BRD-K11526862	54634410	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m1/s1	GLPQOGXKNQYMAV-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccccc3	BroadT	BRD-K11526862	BRD-K11526862-001-01-1	Broad Institute of MIT and Harvard	BRD-K11526862			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m1/s1	GLPQOGXKNQYMAV-YTZAWJCFSA-N	467.242021186							115971
BRD-K65538777-001-01-5	LSM-27428	BRD-K65538777	54634299	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16+,20+/m1/s1	LPUASZNJMDRPQZ-GUXCAODWSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K65538777	BRD-K65538777-001-01-5	Broad Institute of MIT and Harvard	BRD-K65538777			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16+,20+/m1/s1	LPUASZNJMDRPQZ-GUXCAODWSA-N	465.24750049							115972
BRD-K34381021-001-01-2	LSM-27429	BRD-K34381021	54634174	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14+,18+/m0/s1	IWUYHSCDOFQSQQ-PMUMKWKESA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K34381021	BRD-K34381021-001-01-2	Broad Institute of MIT and Harvard	BRD-K34381021			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14+,18+/m0/s1	IWUYHSCDOFQSQQ-PMUMKWKESA-N	413.198441812							115973
BRD-K97972387-001-01-0	LSM-27430	BRD-K97972387	54634173	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14+,18+/m1/s1	IWUYHSCDOFQSQQ-GLJUWKHASA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K97972387	BRD-K97972387-001-01-0	Broad Institute of MIT and Harvard	BRD-K97972387			CCS(=O)(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14+,18+/m1/s1	IWUYHSCDOFQSQQ-GLJUWKHASA-N	413.198441812							115974
BRD-K96352615-001-01-0	LSM-27431	BRD-K96352615	54634351	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19-/m1/s1	AQVJCVRFMZPTMV-ZRGWGRIASA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K96352615	BRD-K96352615-001-01-0	Broad Institute of MIT and Harvard	BRD-K96352615			CCCNC(=O)Nc1ccc2c(OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15+,19-/m1/s1	AQVJCVRFMZPTMV-ZRGWGRIASA-N	406.258005608							115975
BRD-K01658812-001-01-5	LSM-27432	BRD-K01658812	54634290	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23+/m1/s1	BXKRIFOMXVJDTH-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K01658812	BRD-K01658812-001-01-5	Broad Institute of MIT and Harvard	BRD-K01658812			CO[C@@H]1[C@H](C)CN(C)[C@H](C)COc2ccc(cc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23+/m1/s1	BXKRIFOMXVJDTH-PNCHPQGNSA-N	475.214091876							115976
BRD-K07482091-001-01-6	LSM-27433	BRD-K07482091	54634456	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21+/m0/s1	CBUFPLKBNRJCSB-CSODHUTKSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@H]1C)OC	BroadT	BRD-K07482091	BRD-K07482091-001-01-6	Broad Institute of MIT and Harvard	BRD-K07482091			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17+,21+/m0/s1	CBUFPLKBNRJCSB-CSODHUTKSA-N	435.273321314							115977
BRD-K36720672-001-01-1	LSM-27434	BRD-K36720672	54634333	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21+/m1/s1	HCBZRBWAINIAIP-ZOCZFRKYSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K36720672	BRD-K36720672-001-01-1	Broad Institute of MIT and Harvard	BRD-K36720672			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21+/m1/s1	HCBZRBWAINIAIP-ZOCZFRKYSA-N	433.25767125							115978
BRD-K21568202-001-01-0	LSM-27435	BRD-K21568202	54634305	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20+/m1/s1	KXQBGTLFJGTYSJ-GUXCAODWSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(C)[C@@H](C)COc2c1	BroadT	BRD-K21568202	BRD-K21568202-001-01-0	Broad Institute of MIT and Harvard	BRD-K21568202			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(C)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20+/m1/s1	KXQBGTLFJGTYSJ-GUXCAODWSA-N	420.273655672							115979
BRD-K61699306-001-01-9	LSM-27436	BRD-K61699306	54634284	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m1/s1	CNRVBXYBTSVRFK-SIFCLUCFSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K61699306	BRD-K61699306-001-01-9	Broad Institute of MIT and Harvard	BRD-K61699306			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m1/s1	CNRVBXYBTSVRFK-SIFCLUCFSA-N	419.242021186							115980
BRD-K56186124-001-01-4	LSM-27437	BRD-K56186124	54634170	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14-,18-/m1/s1	IWUYHSCDOFQSQQ-HBUWYVDXSA-N	CCS(=O)(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K56186124	BRD-K56186124-001-01-4	Broad Institute of MIT and Harvard	BRD-K56186124			CCS(=O)(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14-,18-/m1/s1	IWUYHSCDOFQSQQ-HBUWYVDXSA-N	413.198441812							115981
BRD-K99195544-001-01-6	LSM-27438	BRD-K99195544	54634420	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19-,23+/m0/s1	NQTWUKGAHCTDGB-SFYKDHMMSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)CN3CCOCC3	BroadT	BRD-K99195544	BRD-K99195544-001-01-6	Broad Institute of MIT and Harvard	BRD-K99195544			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CN2CCOCC2)c1	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19-,23+/m0/s1	NQTWUKGAHCTDGB-SFYKDHMMSA-N	504.29478504							115982
BRD-K84317952-001-01-8	LSM-27439	BRD-K84317952	54634289	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23+/m0/s1	BXKRIFOMXVJDTH-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K84317952	BRD-K84317952-001-01-8	Broad Institute of MIT and Harvard	BRD-K84317952			CO[C@H]1[C@@H](C)CN(C)[C@@H](C)COc2ccc(cc2C(=O)N(C)C1)NS(=O)(=O)c1ccccc1	InChI=1S/C24H33N3O5S/c1-17-14-26(3)18(2)16-32-22-12-11-19(25-33(29,30)20-9-7-6-8-10-20)13-21(22)24(28)27(4)15-23(17)31-5/h6-13,17-18,23,25H,14-16H2,1-5H3/t17-,18-,23+/m0/s1	BXKRIFOMXVJDTH-IUKKYPGJSA-N	475.214091876							115983
BRD-K70843279-001-01-5	LSM-27440	BRD-K70843279	54634430	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m1/s1	DGGJSEMSEUAJQA-MPCDZSKCSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccc3F)[C@H](C)COc2c1	BroadT	BRD-K70843279	BRD-K70843279-001-01-5	Broad Institute of MIT and Harvard	BRD-K70843279			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3F)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19-,25-/m1/s1	DGGJSEMSEUAJQA-MPCDZSKCSA-N	485.268984862							115984
BRD-K44513339-001-01-5	LSM-27441	BRD-K44513339	54634183	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m0/s1	ACBVZQMFXFPRGI-IYOUNJFTSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K44513339	BRD-K44513339-001-01-5	Broad Institute of MIT and Harvard	BRD-K44513339			CCC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m0/s1	ACBVZQMFXFPRGI-IYOUNJFTSA-N	377.231456502							115985
BRD-K52626777-001-01-3	LSM-27442	BRD-K52626777	54634273	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m0/s1	XSLDIBSITHUXPL-BXTJHSDWSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K52626777	BRD-K52626777-001-01-3	Broad Institute of MIT and Harvard	BRD-K52626777			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m0/s1	XSLDIBSITHUXPL-BXTJHSDWSA-N	435.236935806							115986
BRD-K41802522-001-01-2	LSM-27443	BRD-K41802522	54634426	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m0/s1	DGGJSEMSEUAJQA-XHNVNVPESA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccccc3F)[C@@H](C)COc2c1	BroadT	BRD-K41802522	BRD-K41802522-001-01-2	Broad Institute of MIT and Harvard	BRD-K41802522			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccc3F)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19-,25+/m0/s1	DGGJSEMSEUAJQA-XHNVNVPESA-N	485.268984862							115987
BRD-K03505987-001-01-5	LSM-27444	BRD-K03505987	54634313	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(8-11-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23+/m1/s1	AVBHYNTVSDLUSA-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(OC)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K03505987	BRD-K03505987-001-01-5	Broad Institute of MIT and Harvard	BRD-K03505987			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(OC)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(8-11-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23+/m1/s1	AVBHYNTVSDLUSA-DGGJZMOXSA-N	470.252920228							115988
MLS003650028	LSM-27445	BRD-K30389488	53382690	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-17-18(9-16)29-12-15(4)22-10-14(3)19(28-6)11-25(5)20(17)26/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19+/m1/s1	BCEADABJMKBPCA-VCBZYWHSSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K30389488	BRD-K30389488-001-01-5	Broad Institute of MIT and Harvard	BRD-K30389488			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-17-18(9-16)29-12-15(4)22-10-14(3)19(28-6)11-25(5)20(17)26/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15+,19+/m1/s1	BCEADABJMKBPCA-VCBZYWHSSA-N	406.258005608							115989
BRD-K30631660-001-01-0	LSM-27446	BRD-K30631660	54634448	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-7-18(26)11-19)9-10-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m0/s1	IAEXBJMXVKONHW-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K30631660	BRD-K30631660-001-01-0	Broad Institute of MIT and Harvard	BRD-K30631660			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-7-18(26)11-19)9-10-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m0/s1	IAEXBJMXVKONHW-HKARXFIJSA-N	472.248583776							115990
BRD-K88973486-001-01-9	LSM-27447	BRD-K88973486	54634409	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m1/s1	YTFMHZRWJRHUBM-HYFFOGBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K88973486	BRD-K88973486-001-01-9	Broad Institute of MIT and Harvard	BRD-K88973486			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22-/m1/s1	YTFMHZRWJRHUBM-HYFFOGBASA-N	447.273321314							115991
BRD-K09942336-001-01-2	LSM-27448	BRD-K09942336	54634342	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-13-21(28-26(33)27-20-9-7-6-8-10-20)11-12-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24+/m0/s1	MYURTGQUXIJGDV-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K09942336	BRD-K09942336-001-01-2	Broad Institute of MIT and Harvard	BRD-K09942336			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-13-21(28-26(33)27-20-9-7-6-8-10-20)11-12-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24+/m0/s1	MYURTGQUXIJGDV-HOOSLVGPSA-N	482.252920228							115992
BRD-K70276915-001-01-8	LSM-27449	BRD-K70276915	54634198	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19+,24-/m1/s1	RENBNVSQSOQEFF-YDIMBITNSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H]1C)OC	BroadT	BRD-K70276915	BRD-K70276915-001-01-8	Broad Institute of MIT and Harvard	BRD-K70276915			CCC(=O)N1C[C@@H](C)[C@H](OC)CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H]1C	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19+,24-/m1/s1	RENBNVSQSOQEFF-YDIMBITNSA-N	487.304621442							115993
BRD-K24960579-001-01-1	LSM-27450	BRD-K24960579	54634158	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m1/s1	IZVZICFLHPWRDR-HBUWYVDXSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K24960579	BRD-K24960579-001-01-1	Broad Institute of MIT and Harvard	BRD-K24960579			COCC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m1/s1	IZVZICFLHPWRDR-HBUWYVDXSA-N	393.226371122							115994
BRD-K48571261-001-01-1	LSM-27451	BRD-K48571261	54634378	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24+/m1/s1	GCVUEFRAKHDCHL-IMWIBFENSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K48571261	BRD-K48571261-001-01-1	Broad Institute of MIT and Harvard	BRD-K48571261			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24+/m1/s1	GCVUEFRAKHDCHL-IMWIBFENSA-N	489.22974194							115995
BRD-K28625530-001-01-4	LSM-27452	BRD-K28625530	54634379	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24+/m0/s1	GCVUEFRAKHDCHL-XLNZFTOWSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K28625530	BRD-K28625530-001-01-4	Broad Institute of MIT and Harvard	BRD-K28625530			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H35N3O5S/c1-17-7-10-21(11-8-17)34(30,31)26-20-9-12-22-23(13-20)33-16-19(3)27(4)14-18(2)24(32-6)15-28(5)25(22)29/h7-13,18-19,24,26H,14-16H2,1-6H3/t18-,19+,24+/m0/s1	GCVUEFRAKHDCHL-XLNZFTOWSA-N	489.22974194							115996
BRD-K20751868-001-01-8	LSM-27453	BRD-K20751868	54634178	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m1/s1	ACBVZQMFXFPRGI-HBUWYVDXSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN[C@H](C)COc2c1	BroadT	BRD-K20751868	BRD-K20751868-001-01-8	Broad Institute of MIT and Harvard	BRD-K20751868			CCC(=O)Nc1ccc2c(OC[C@@H](C)NC[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14-,18-/m1/s1	ACBVZQMFXFPRGI-HBUWYVDXSA-N	377.231456502							115997
BRD-K24238945-001-01-9	LSM-27454	BRD-K24238945	54634315	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(8-11-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m1/s1	AVBHYNTVSDLUSA-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(OC)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K24238945	BRD-K24238945-001-01-9	Broad Institute of MIT and Harvard	BRD-K24238945			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(OC)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(8-11-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m1/s1	AVBHYNTVSDLUSA-SAHWJRBASA-N	470.252920228							115998
BRD-K98743153-001-01-6	LSM-27455	BRD-K98743153	54634309	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20-/m1/s1	KXQBGTLFJGTYSJ-GQIGUUNPSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(C)[C@@H](C)COc2c1	BroadT	BRD-K98743153	BRD-K98743153-001-01-6	Broad Institute of MIT and Harvard	BRD-K98743153			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(C)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16+,20-/m1/s1	KXQBGTLFJGTYSJ-GQIGUUNPSA-N	420.273655672							115999
MLS003650050	LSM-27456	BRD-K67790067	53382707	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	HPGQIGUDQFUDBC-PNCHPQGNSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K67790067	BRD-K67790067-001-01-9	Broad Institute of MIT and Harvard	BRD-K67790067			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	HPGQIGUDQFUDBC-PNCHPQGNSA-N	482.252920228							116000
BRD-K39773077-001-01-8	LSM-27457	BRD-K39773077	54634249	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18-,24-/m1/s1	KOWUZEVVBMMFIA-QZTZHPFYSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K39773077	BRD-K39773077-001-01-8	Broad Institute of MIT and Harvard	BRD-K39773077			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18-,24-/m1/s1	KOWUZEVVBMMFIA-QZTZHPFYSA-N	499.248249418							116001
BRD-K99353774-001-01-2	LSM-27458	BRD-K99353774	54634222	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-18(26)7-9-19)10-11-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m0/s1	JEYMQXVPUHGLIB-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K99353774	BRD-K99353774-001-01-2	Broad Institute of MIT and Harvard	BRD-K99353774			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-18(26)7-9-19)10-11-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m0/s1	JEYMQXVPUHGLIB-YGKZAACZSA-N	488.219033286							116002
BRD-K66797163-001-01-8	LSM-27459	BRD-K66797163	54634454	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17-,21+/m0/s1	CBUFPLKBNRJCSB-XGHQBKJUSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@@H]1C)OC	BroadT	BRD-K66797163	BRD-K66797163-001-01-8	Broad Institute of MIT and Harvard	BRD-K66797163			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)COC)cc2OC[C@@H]1C)OC	InChI=1S/C23H37N3O5/c1-7-10-26-12-16(2)21(30-6)13-25(4)23(28)19-9-8-18(24-22(27)15-29-5)11-20(19)31-14-17(26)3/h8-9,11,16-17,21H,7,10,12-15H2,1-6H3,(H,24,27)/t16-,17-,21+/m0/s1	CBUFPLKBNRJCSB-XGHQBKJUSA-N	435.273321314							116003
BRD-K06376904-001-01-8	LSM-27460	BRD-K06376904	54634254	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18-,22+/m0/s1	VGIZUFWCBMAECV-NPPFBWRTSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K06376904	BRD-K06376904-001-01-8	Broad Institute of MIT and Harvard	BRD-K06376904			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18-,22+/m0/s1	VGIZUFWCBMAECV-NPPFBWRTSA-N	491.310769462							116004
BRD-K70516984-001-01-3	LSM-27461	BRD-K70516984	54634176	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14+,18-/m1/s1	IWUYHSCDOFQSQQ-QWQRMKEZSA-N	CCS(=O)(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K70516984	BRD-K70516984-001-01-3	Broad Institute of MIT and Harvard	BRD-K70516984			CCS(=O)(=O)Nc1ccc2OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C19H31N3O5S/c1-6-28(24,25)21-15-7-8-17-16(9-15)19(23)22(4)11-18(26-5)13(2)10-20-14(3)12-27-17/h7-9,13-14,18,20-21H,6,10-12H2,1-5H3/t13-,14+,18-/m1/s1	IWUYHSCDOFQSQQ-QWQRMKEZSA-N	413.198441812							116005
BRD-K30399765-001-01-8	LSM-27462	BRD-K30399765	54634460	InChI=1S/C24H32FN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17-,23-/m1/s1	MUJMHXHQZVNQLB-SEPYTNNBSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K30399765	BRD-K30399765-001-01-8	Broad Institute of MIT and Harvard	BRD-K30399765			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C24H32FN3O5S/c1-16-13-27(3)17(2)15-33-22-11-8-19(12-21(22)24(29)28(4)14-23(16)32-5)26-34(30,31)20-9-6-18(25)7-10-20/h6-12,16-17,23,26H,13-15H2,1-5H3/t16-,17-,23-/m1/s1	MUJMHXHQZVNQLB-SEPYTNNBSA-N	493.204670044							116006
BRD-K46421255-001-01-9	LSM-27463	BRD-K46421255	54634415	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m1/s1	GLPQOGXKNQYMAV-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccccc3	BroadT	BRD-K46421255	BRD-K46421255-001-01-9	Broad Institute of MIT and Harvard	BRD-K46421255			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m1/s1	GLPQOGXKNQYMAV-QZTZHPFYSA-N	467.242021186							116007
BRD-K66111770-001-01-7	LSM-27464	BRD-K66111770	54634194	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19+,24+/m1/s1	RENBNVSQSOQEFF-IMWIBFENSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H]1C)OC	BroadT	BRD-K66111770	BRD-K66111770-001-01-7	Broad Institute of MIT and Harvard	BRD-K66111770			CCC(=O)N1C[C@@H](C)[C@@H](OC)CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H]1C	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19+,24+/m1/s1	RENBNVSQSOQEFF-IMWIBFENSA-N	487.304621442							116008
BRD-K76404656-001-01-3	LSM-27465	BRD-K76404656	54634399	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-7-6-15(24-32(28,29)12-20(21,22)23)8-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14-,18-/m1/s1	NAKUAOPJLXDQOX-HBUWYVDXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K76404656	BRD-K76404656-001-01-3	Broad Institute of MIT and Harvard	BRD-K76404656			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-7-6-15(24-32(28,29)12-20(21,22)23)8-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14-,18-/m1/s1	NAKUAOPJLXDQOX-HBUWYVDXSA-N	481.18582638							116009
BRD-K88290715-001-01-1	LSM-27466	BRD-K88290715	54634371	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m1/s1	WNEVNPYHFIROBB-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K88290715	BRD-K88290715-001-01-1	Broad Institute of MIT and Harvard	BRD-K88290715			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m1/s1	WNEVNPYHFIROBB-YTZAWJCFSA-N	469.25767125							116010
BRD-K89507688-001-01-0	LSM-27467	BRD-K89507688	54634149	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27-/m0/s1	VDJCKUULTDNAAX-IZVMNLJQSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc5ccncc5)C[C@@H]1C	BroadT	BRD-K89507688	BRD-K89507688-001-01-0	Broad Institute of MIT and Harvard	BRD-K89507688			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc2ccncc2)C[C@@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27-/m0/s1	VDJCKUULTDNAAX-IZVMNLJQSA-N	573.24097534							116011
BRD-K26020334-001-01-8	LSM-27468	BRD-K26020334	54634302	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16+,20-/m0/s1	LPUASZNJMDRPQZ-YRNRMSPPSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K26020334	BRD-K26020334-001-01-8	Broad Institute of MIT and Harvard	BRD-K26020334			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16+,20-/m0/s1	LPUASZNJMDRPQZ-YRNRMSPPSA-N	465.24750049							116012
BRD-K04368117-001-01-0	LSM-27469	BRD-K04368117	54634255	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18-,22+/m1/s1	VGIZUFWCBMAECV-HMFYCAOWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	BroadT	BRD-K04368117	BRD-K04368117-001-01-0	Broad Institute of MIT and Harvard	BRD-K04368117			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18-,22+/m1/s1	VGIZUFWCBMAECV-HMFYCAOWSA-N	491.310769462							116013
BRD-K75801019-001-01-3	LSM-27470	BRD-K75801019	54634451	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-7-18(26)11-19)9-10-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m0/s1	IAEXBJMXVKONHW-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K75801019	BRD-K75801019-001-01-3	Broad Institute of MIT and Harvard	BRD-K75801019			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-7-18(26)11-19)9-10-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m0/s1	IAEXBJMXVKONHW-MFEFFIJZSA-N	472.248583776							116014
BRD-K03187112-001-01-0	LSM-27471	BRD-K03187112	54634396	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-7-6-15(24-32(28,29)12-20(21,22)23)8-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14+,18+/m1/s1	NAKUAOPJLXDQOX-GLJUWKHASA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K03187112	BRD-K03187112-001-01-0	Broad Institute of MIT and Harvard	BRD-K03187112			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-7-6-15(24-32(28,29)12-20(21,22)23)8-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14+,18+/m1/s1	NAKUAOPJLXDQOX-GLJUWKHASA-N	481.18582638							116015
BRD-K91354313-001-01-6	LSM-27472	BRD-K91354313	54634283	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m0/s1	CNRVBXYBTSVRFK-AUSJPIAWSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K91354313	BRD-K91354313-001-01-6	Broad Institute of MIT and Harvard	BRD-K91354313			CCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m0/s1	CNRVBXYBTSVRFK-AUSJPIAWSA-N	419.242021186							116016
BRD-K97319253-001-01-5	LSM-27473	BRD-K97319253	54634262	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21-/m1/s1	XCHGKOIROWQQCM-WHSLLNHNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	BroadT	BRD-K97319253	BRD-K97319253-001-01-5	Broad Institute of MIT and Harvard	BRD-K97319253			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16-,21-/m1/s1	XCHGKOIROWQQCM-WHSLLNHNSA-N	448.268570292							116017
BRD-K32151626-001-01-0	LSM-27474	BRD-K32151626	54634370	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m0/s1	WNEVNPYHFIROBB-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K32151626	BRD-K32151626-001-01-0	Broad Institute of MIT and Harvard	BRD-K32151626			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m0/s1	WNEVNPYHFIROBB-LLJLJFOGSA-N	469.25767125							116018
BRD-K14928207-001-01-0	LSM-27475	BRD-K14928207	54634346	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15-,19+/m0/s1	AQVJCVRFMZPTMV-YZVOILCLSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K14928207	BRD-K14928207-001-01-0	Broad Institute of MIT and Harvard	BRD-K14928207			CCCNC(=O)Nc1ccc2c(OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C21H34N4O4/c1-6-9-22-21(27)24-16-7-8-17-18(10-16)29-13-15(3)23-11-14(2)19(28-5)12-25(4)20(17)26/h7-8,10,14-15,19,23H,6,9,11-13H2,1-5H3,(H2,22,24,27)/t14-,15-,19+/m0/s1	AQVJCVRFMZPTMV-YZVOILCLSA-N	406.258005608							116019
BRD-K97709518-001-01-8	LSM-27476	BRD-K97709518	54634160	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m0/s1	IZVZICFLHPWRDR-SUNYJGFJSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K97709518	BRD-K97709518-001-01-8	Broad Institute of MIT and Harvard	BRD-K97709518			COCC(=O)Nc1ccc2c(OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14-,18+/m0/s1	IZVZICFLHPWRDR-SUNYJGFJSA-N	393.226371122							116020
BRD-K49560337-001-01-3	LSM-27477	BRD-K49560337	54634296	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16-,20-/m1/s1	LPUASZNJMDRPQZ-JXXFODFXSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K49560337	BRD-K49560337-001-01-3	Broad Institute of MIT and Harvard	BRD-K49560337			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16-,20-/m1/s1	LPUASZNJMDRPQZ-JXXFODFXSA-N	465.24750049							116021
BRD-K40790345-001-01-5	LSM-27478	BRD-K40790345	54634164	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m1/s1	IZVZICFLHPWRDR-QWQRMKEZSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K40790345	BRD-K40790345-001-01-5	Broad Institute of MIT and Harvard	BRD-K40790345			COCC(=O)Nc1ccc2c(OC[C@H](C)NC[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O5/c1-13-9-21-14(2)11-28-17-8-15(22-19(24)12-26-4)6-7-16(17)20(25)23(3)10-18(13)27-5/h6-8,13-14,18,21H,9-12H2,1-5H3,(H,22,24)/t13-,14+,18-/m1/s1	IZVZICFLHPWRDR-QWQRMKEZSA-N	393.226371122							116022
BRD-K36694584-001-01-5	LSM-27479	BRD-K36694584	54634304	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20+/m0/s1	KXQBGTLFJGTYSJ-TWOQFEAHSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(C)[C@@H](C)COc2c1	BroadT	BRD-K36694584	BRD-K36694584-001-01-5	Broad Institute of MIT and Harvard	BRD-K36694584			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(C)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C22H36N4O4/c1-7-10-23-22(28)24-17-8-9-18-19(11-17)30-14-16(3)25(4)12-15(2)20(29-6)13-26(5)21(18)27/h8-9,11,15-16,20H,7,10,12-14H2,1-6H3,(H2,23,24,28)/t15-,16-,20+/m0/s1	KXQBGTLFJGTYSJ-TWOQFEAHSA-N	420.273655672							116023
BRD-K96012167-001-01-2	LSM-27480	BRD-K96012167	54634267	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16+,21-/m0/s1	XCHGKOIROWQQCM-MRUHUIDDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	BroadT	BRD-K96012167	BRD-K96012167-001-01-2	Broad Institute of MIT and Harvard	BRD-K96012167			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CN(C)C	InChI=1S/C23H36N4O5/c1-15-11-27(22(29)13-25(4)5)16(2)14-32-20-9-8-18(24-17(3)28)10-19(20)23(30)26(6)12-21(15)31-7/h8-10,15-16,21H,11-14H2,1-7H3,(H,24,28)/t15-,16+,21-/m0/s1	XCHGKOIROWQQCM-MRUHUIDDSA-N	448.268570292							116024
BRD-K81884179-001-01-7	LSM-27481	BRD-K81884179	54634154	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-18-19(11-17)29-14-16(3)24(4)12-15(2)20(28-6)13-25(5)22(18)27/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20+/m1/s1	GQKMEBDXNYRVIF-GUXCAODWSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(C)[C@@H](C)COc2c1	BroadT	BRD-K81884179	BRD-K81884179-001-01-7	Broad Institute of MIT and Harvard	BRD-K81884179			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C22H35N3O4/c1-7-8-21(26)23-17-9-10-18-19(11-17)29-14-16(3)24(4)12-15(2)20(28-6)13-25(5)22(18)27/h9-11,15-16,20H,7-8,12-14H2,1-6H3,(H,23,26)/t15-,16+,20+/m1/s1	GQKMEBDXNYRVIF-GUXCAODWSA-N	405.26275663							116025
BRD-K39062619-001-01-1	LSM-27482	BRD-K39062619	54634417	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m1/s1	GLPQOGXKNQYMAV-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccccc3	BroadT	BRD-K39062619	BRD-K39062619-001-01-1	Broad Institute of MIT and Harvard	BRD-K39062619			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m1/s1	GLPQOGXKNQYMAV-NXMSCROESA-N	467.242021186							116026
BRD-K07505039-001-01-9	LSM-27483	BRD-K07505039	54634180	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m1/s1	ACBVZQMFXFPRGI-GLJUWKHASA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN[C@@H](C)COc2c1	BroadT	BRD-K07505039	BRD-K07505039-001-01-9	Broad Institute of MIT and Harvard	BRD-K07505039			CCC(=O)Nc1ccc2c(OC[C@H](C)NC[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C20H31N3O4/c1-6-19(24)22-15-7-8-16-17(9-15)27-12-14(3)21-10-13(2)18(26-5)11-23(4)20(16)25/h7-9,13-14,18,21H,6,10-12H2,1-5H3,(H,22,24)/t13-,14+,18+/m1/s1	ACBVZQMFXFPRGI-GLJUWKHASA-N	377.231456502							116027
BRD-K03452462-001-01-4	LSM-27484	BRD-K03452462	54634425	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19+,23-/m1/s1	NQTWUKGAHCTDGB-SELNLUPBSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)CN3CCOCC3	BroadT	BRD-K03452462	BRD-K03452462-001-01-4	Broad Institute of MIT and Harvard	BRD-K03452462			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CN2CCOCC2)c1	InChI=1S/C26H40N4O6/c1-6-24(31)27-20-7-8-21-22(13-20)36-17-19(3)30(25(32)16-29-9-11-35-12-10-29)14-18(2)23(34-5)15-28(4)26(21)33/h7-8,13,18-19,23H,6,9-12,14-17H2,1-5H3,(H,27,31)/t18-,19+,23-/m1/s1	NQTWUKGAHCTDGB-SELNLUPBSA-N	504.29478504							116028
BRD-K11018734-001-01-5	LSM-27485	BRD-K11018734	54634147	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27+/m1/s1	VDJCKUULTDNAAX-GNMOFYLKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc5ccncc5)C[C@H]1C	BroadT	BRD-K11018734	BRD-K11018734-001-01-5	Broad Institute of MIT and Harvard	BRD-K11018734			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21-,27+/m1/s1	VDJCKUULTDNAAX-GNMOFYLKSA-N	573.24097534							116029
BRD-K55801977-001-01-7	LSM-27486	BRD-K55801977	54634212	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15-,19+/m0/s1	NNLGSVIPEFKMPH-YZVOILCLSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K55801977	BRD-K55801977-001-01-7	Broad Institute of MIT and Harvard	BRD-K55801977			CCCC(=O)Nc1ccc2OC[C@H](C)NC[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15-,19+/m0/s1	NNLGSVIPEFKMPH-YZVOILCLSA-N	391.247106566							116030
BRD-K42541972-001-01-0	LSM-27487	BRD-K42541972	54634213	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15-,19+/m1/s1	NNLGSVIPEFKMPH-CLCXKQKWSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K42541972	BRD-K42541972-001-01-0	Broad Institute of MIT and Harvard	BRD-K42541972			CCCC(=O)Nc1ccc2OC[C@@H](C)NC[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C21H33N3O4/c1-6-7-20(25)23-16-8-9-18-17(10-16)21(26)24(4)12-19(27-5)14(2)11-22-15(3)13-28-18/h8-10,14-15,19,22H,6-7,11-13H2,1-5H3,(H,23,25)/t14-,15-,19+/m1/s1	NNLGSVIPEFKMPH-CLCXKQKWSA-N	391.247106566							116031
BRD-K99330192-001-01-4	LSM-27488	BRD-K99330192	54634388	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15+,20-/m1/s1	OTDLGAQSEPTCMV-QEEYODRMSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K99330192	BRD-K99330192-001-01-4	Broad Institute of MIT and Harvard	BRD-K99330192			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15+,20-/m1/s1	OTDLGAQSEPTCMV-QEEYODRMSA-N	403.247106566							116032
BRD-K76817428-001-01-3	LSM-27489	BRD-K76817428	54634431	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m0/s1	DGGJSEMSEUAJQA-CEYNDMKZSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccccc3F)[C@H](C)COc2c1	BroadT	BRD-K76817428	BRD-K76817428-001-01-3	Broad Institute of MIT and Harvard	BRD-K76817428			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccc3F)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H36FN3O4/c1-6-26(32)29-21-11-12-22-24(13-21)35-17-19(3)31(15-20-9-7-8-10-23(20)28)14-18(2)25(34-5)16-30(4)27(22)33/h7-13,18-19,25H,6,14-17H2,1-5H3,(H,29,32)/t18-,19+,25-/m0/s1	DGGJSEMSEUAJQA-CEYNDMKZSA-N	485.268984862							116033
BRD-K82277625-001-01-3	LSM-27490	BRD-K82277625	54634257	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22+/m0/s1	VGIZUFWCBMAECV-NJNPRVFISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	BroadT	BRD-K82277625	BRD-K82277625-001-01-3	Broad Institute of MIT and Harvard	BRD-K82277625			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)NC(C)C	InChI=1S/C25H41N5O5/c1-15(2)26-24(32)28-19-9-10-21-20(11-19)23(31)29(7)13-22(34-8)17(5)12-30(18(6)14-35-21)25(33)27-16(3)4/h9-11,15-18,22H,12-14H2,1-8H3,(H,27,33)(H2,26,28,32)/t17-,18+,22+/m0/s1	VGIZUFWCBMAECV-NJNPRVFISA-N	491.310769462							116034
BRD-K06858302-001-01-3	LSM-27491	BRD-K06858302	54634233	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m0/s1	BBNOXYVHIXNILT-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K06858302	BRD-K06858302-001-01-3	Broad Institute of MIT and Harvard	BRD-K06858302			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23-/m0/s1	BBNOXYVHIXNILT-IXFSTUDKSA-N	439.247106566							116035
BRD-K89917618-001-01-6	LSM-27492	BRD-K89917618	54634337	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21-/m0/s1	HCBZRBWAINIAIP-MRUHUIDDSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K89917618	BRD-K89917618-001-01-6	Broad Institute of MIT and Harvard	BRD-K89917618			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21-/m0/s1	HCBZRBWAINIAIP-MRUHUIDDSA-N	433.25767125							116036
BRD-K76795498-001-01-6	LSM-27493	BRD-K76795498	54634433	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	HPGQIGUDQFUDBC-PMAPCBKXSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3ccccn3	BroadT	BRD-K76795498	BRD-K76795498-001-01-6	Broad Institute of MIT and Harvard	BRD-K76795498			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)c2ccccn2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-19-10-11-20-22(13-19)35-16-18(3)30(26(33)21-9-7-8-12-27-21)14-17(2)23(34-5)15-29(4)25(20)32/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23-/m1/s1	HPGQIGUDQFUDBC-PMAPCBKXSA-N	482.252920228							116037
BRD-K31752301-001-01-8	LSM-27494	BRD-K31752301	54634444	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20-,26-/m0/s1	KZQLWMFDTATSFP-DYLHXGEVSA-N	CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K31752301	BRD-K31752301-001-01-8	Broad Institute of MIT and Harvard	BRD-K31752301			CCC(=O)Nc1ccc2OC[C@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20-,26-/m0/s1	KZQLWMFDTATSFP-DYLHXGEVSA-N	497.288971378							116038
BRD-K24520803-001-01-1	LSM-27495	BRD-K24520803	54634447	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-7-18(26)11-19)9-10-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m1/s1	IAEXBJMXVKONHW-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K24520803	BRD-K24520803-001-01-1	Broad Institute of MIT and Harvard	BRD-K24520803			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-7-18(26)11-19)9-10-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17-,23+/m1/s1	IAEXBJMXVKONHW-QZMQVMSPSA-N	472.248583776							116039
BRD-K93260218-001-01-9	LSM-27496	BRD-K93260218	54634403	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22+/m0/s1	YTFMHZRWJRHUBM-PNLZDCPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K93260218	BRD-K93260218-001-01-9	Broad Institute of MIT and Harvard	BRD-K93260218			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22+/m0/s1	YTFMHZRWJRHUBM-PNLZDCPESA-N	447.273321314							116040
BRD-K12675005-001-01-3	LSM-27497	BRD-K12675005	54634312	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(8-11-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23+/m0/s1	AVBHYNTVSDLUSA-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(OC)cc3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K12675005	BRD-K12675005-001-01-3	Broad Institute of MIT and Harvard	BRD-K12675005			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(OC)cc3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-22-12-19(8-11-21(22)24(30)29(3)14-23(16)33-5)28-25(31)27-18-6-9-20(32-4)10-7-18/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23+/m0/s1	AVBHYNTVSDLUSA-HKARXFIJSA-N	470.252920228							116041
BRD-K20233828-001-01-6	LSM-27498	BRD-K20233828	54634412	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m1/s1	GLPQOGXKNQYMAV-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccccc3	BroadT	BRD-K20233828	BRD-K20233828-001-01-6	Broad Institute of MIT and Harvard	BRD-K20233828			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-12-11-21(27-19(3)30)13-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m1/s1	GLPQOGXKNQYMAV-GGUMNFRJSA-N	467.242021186							116042
BRD-K32283791-001-01-0	LSM-27499	BRD-K32283791	54634361	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19+/m1/s1	NCNZCRGMWPPFEB-CLCXKQKWSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H]1C)OC	BroadT	BRD-K32283791	BRD-K32283791-001-01-0	Broad Institute of MIT and Harvard	BRD-K32283791			CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H]1C)OC	InChI=1S/C21H33N3O6S/c1-7-20(25)24-11-14(2)19(29-5)12-23(4)21(26)17-9-8-16(22-31(6,27)28)10-18(17)30-13-15(24)3/h8-10,14-15,19,22H,7,11-13H2,1-6H3/t14-,15-,19+/m1/s1	NCNZCRGMWPPFEB-CLCXKQKWSA-N	455.209006496							116043
BRD-K67424961-001-01-2	LSM-27500	BRD-K67424961	54634246	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24+/m1/s1	KOWUZEVVBMMFIA-YTZAWJCFSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)c3ccccc3F	BroadT	BRD-K67424961	BRD-K67424961-001-01-2	Broad Institute of MIT and Harvard	BRD-K67424961			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccccc2F)c1	InChI=1S/C27H34FN3O5/c1-6-25(32)29-19-11-12-21-23(13-19)36-16-18(3)31(27(34)20-9-7-8-10-22(20)28)14-17(2)24(35-5)15-30(4)26(21)33/h7-13,17-18,24H,6,14-16H2,1-5H3,(H,29,32)/t17-,18+,24+/m1/s1	KOWUZEVVBMMFIA-YTZAWJCFSA-N	499.248249418							116044
BRD-K23673171-001-01-3	LSM-27501	BRD-K23673171	54634223	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-18(26)7-9-19)10-11-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m0/s1	JEYMQXVPUHGLIB-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K23673171	BRD-K23673171-001-01-3	Broad Institute of MIT and Harvard	BRD-K23673171			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33ClN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-18(26)7-9-19)10-11-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23-/m0/s1	JEYMQXVPUHGLIB-MFEFFIJZSA-N	488.219033286							116045
BRD-K36495064-001-01-6	LSM-27502	BRD-K36495064	54634236	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17-,22+/m1/s1	VMZAIKVTLMIHQJ-YVHKJVDXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K36495064	BRD-K36495064-001-01-6	Broad Institute of MIT and Harvard	BRD-K36495064			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17-,22+/m1/s1	VMZAIKVTLMIHQJ-YVHKJVDXSA-N	440.242355544							116046
BRD-K09144413-001-01-1	LSM-27503	BRD-K09144413	54634211	InChI=1S/C23H34F3N3O4/c1-6-21(30)27-17-7-8-18-19(11-17)33-14-16(3)29(10-9-23(24,25)26)12-15(2)20(32-5)13-28(4)22(18)31/h7-8,11,15-16,20H,6,9-10,12-14H2,1-5H3,(H,27,30)/t15-,16+,20-/m1/s1	KLQKGCQUDAKEQP-GQIGUUNPSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(CCC(F)(F)F)[C@@H](C)COc2c1	BroadT	BRD-K09144413	BRD-K09144413-001-01-1	Broad Institute of MIT and Harvard	BRD-K09144413			CCC(=O)Nc1ccc2c(OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O4/c1-6-21(30)27-17-7-8-18-19(11-17)33-14-16(3)29(10-9-23(24,25)26)12-15(2)20(32-5)13-28(4)22(18)31/h7-8,11,15-16,20H,6,9-10,12-14H2,1-5H3,(H,27,30)/t15-,16+,20-/m1/s1	KLQKGCQUDAKEQP-GQIGUUNPSA-N	473.250141198							116047
BRD-K22406508-001-01-3	LSM-27504	BRD-K22406508	54634450	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-7-18(26)11-19)9-10-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m0/s1	IAEXBJMXVKONHW-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K22406508	BRD-K22406508-001-01-3	Broad Institute of MIT and Harvard	BRD-K22406508			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cccc(F)c3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33FN4O4/c1-16-13-29(3)17(2)15-34-22-12-20(28-25(32)27-19-8-6-7-18(26)11-19)9-10-21(22)24(31)30(4)14-23(16)33-5/h6-12,16-17,23H,13-15H2,1-5H3,(H2,27,28,32)/t16-,17+,23+/m0/s1	IAEXBJMXVKONHW-YGKZAACZSA-N	472.248583776							116048
BRD-K17901778-001-01-3	LSM-27505	BRD-K17901778	54634387	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15+,20-/m0/s1	OTDLGAQSEPTCMV-MDOVXXIYSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K17901778	BRD-K17901778-001-01-3	Broad Institute of MIT and Harvard	BRD-K17901778			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15+,20-/m0/s1	OTDLGAQSEPTCMV-MDOVXXIYSA-N	403.247106566							116049
BRD-K42443121-001-01-9	LSM-27506	BRD-K42443121	54634199	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	MWXNSOOKWBVWAA-PNCHPQGNSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)c3ccncc3	BroadT	BRD-K42443121	BRD-K42443121-001-01-9	Broad Institute of MIT and Harvard	BRD-K42443121			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccncc2)c1	InChI=1S/C26H34N4O5/c1-6-24(31)28-20-7-8-21-22(13-20)35-16-18(3)30(25(32)19-9-11-27-12-10-19)14-17(2)23(34-5)15-29(4)26(21)33/h7-13,17-18,23H,6,14-16H2,1-5H3,(H,28,31)/t17-,18-,23+/m1/s1	MWXNSOOKWBVWAA-PNCHPQGNSA-N	482.252920228							116050
BRD-K31226640-001-01-3	LSM-27507	BRD-K31226640	54634192	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19-,24+/m1/s1	RENBNVSQSOQEFF-IECBHUPTSA-N	CCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H]1C)OC	BroadT	BRD-K31226640	BRD-K31226640-001-01-3	Broad Institute of MIT and Harvard	BRD-K31226640			CCC(=O)N1C[C@@H](C)[C@@H](OC)CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H]1C	InChI=1S/C27H41N3O5/c1-6-25(31)30-15-18(2)24(34-5)16-29(4)27(33)22-13-12-21(14-23(22)35-17-19(30)3)28-26(32)20-10-8-7-9-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,32)/t18-,19-,24+/m1/s1	RENBNVSQSOQEFF-IECBHUPTSA-N	487.304621442							116051
BRD-K53538949-001-01-2	LSM-27508	BRD-K53538949	54634285	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m0/s1	CNRVBXYBTSVRFK-BXTJHSDWSA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C	BroadT	BRD-K53538949	BRD-K53538949-001-01-2	Broad Institute of MIT and Harvard	BRD-K53538949			CCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(C)=O	InChI=1S/C22H33N3O5/c1-7-21(27)23-17-8-9-19-18(10-17)22(28)24(5)12-20(29-6)14(2)11-25(16(4)26)15(3)13-30-19/h8-10,14-15,20H,7,11-13H2,1-6H3,(H,23,27)/t14-,15+,20+/m0/s1	CNRVBXYBTSVRFK-BXTJHSDWSA-N	419.242021186							116052
BRD-K07767844-001-01-0	LSM-27509	BRD-K07767844	54634146	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27+/m1/s1	VDJCKUULTDNAAX-BUEREQSYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc5ccncc5)C[C@H]1C	BroadT	BRD-K07767844	BRD-K07767844-001-01-0	Broad Institute of MIT and Harvard	BRD-K07767844			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3nc4ccccc4s3)ccc2OC[C@H](C)N(Cc2ccncc2)C[C@H]1C	InChI=1S/C31H35N5O4S/c1-20-16-36(17-22-11-13-32-14-12-22)21(2)19-40-26-10-9-23(15-24(26)31(38)35(3)18-27(20)39-4)33-29(37)30-34-25-7-5-6-8-28(25)41-30/h5-15,20-21,27H,16-19H2,1-4H3,(H,33,37)/t20-,21+,27+/m1/s1	VDJCKUULTDNAAX-BUEREQSYSA-N	573.24097534							116053
BRD-K65101674-001-01-6	LSM-27510	BRD-K65101674	54634386	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15+,20+/m0/s1	OTDLGAQSEPTCMV-BXTJHSDWSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K65101674	BRD-K65101674-001-01-6	Broad Institute of MIT and Harvard	BRD-K65101674			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCC3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C22H33N3O4/c1-14-11-23-15(2)13-29-19-10-17(24-21(26)16-6-5-7-16)8-9-18(19)22(27)25(3)12-20(14)28-4/h8-10,14-16,20,23H,5-7,11-13H2,1-4H3,(H,24,26)/t14-,15+,20+/m0/s1	OTDLGAQSEPTCMV-BXTJHSDWSA-N	403.247106566							116054
BRD-K93554629-001-01-8	LSM-27511	BRD-K93554629	54634226	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-9-16(21-15(3)24)7-8-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14-,19-/m0/s1	KEAMYVMGHPITQJ-NJSLBKSFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)S(=O)(=O)C	BroadT	BRD-K93554629	BRD-K93554629-001-01-8	Broad Institute of MIT and Harvard	BRD-K93554629			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@@H]1C)S(C)(=O)=O	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-9-16(21-15(3)24)7-8-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14-,19-/m0/s1	KEAMYVMGHPITQJ-NJSLBKSFSA-N	441.193356432							116055
BRD-K06749709-001-01-3	LSM-27512	BRD-K06749709	54634335	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21+/m1/s1	HCBZRBWAINIAIP-XFQAVAEZSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C	BroadT	BRD-K06749709	BRD-K06749709-001-01-3	Broad Institute of MIT and Harvard	BRD-K06749709			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16+,21+/m1/s1	HCBZRBWAINIAIP-XFQAVAEZSA-N	433.25767125							116056
BRD-K58879628-001-01-3	LSM-27513	BRD-K58879628	54634297	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16-,20+/m0/s1	LPUASZNJMDRPQZ-TWOQFEAHSA-N	COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K58879628	BRD-K58879628-001-01-3	Broad Institute of MIT and Harvard	BRD-K58879628			COCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16-,20+/m0/s1	LPUASZNJMDRPQZ-TWOQFEAHSA-N	465.24750049							116057
BRD-K43733177-001-01-5	LSM-27514	BRD-K43733177	54634334	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21+/m0/s1	HCBZRBWAINIAIP-CKJXQJPGSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)C	BroadT	BRD-K43733177	BRD-K43733177-001-01-5	Broad Institute of MIT and Harvard	BRD-K43733177			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H35N3O5/c1-7-8-22(28)24-18-9-10-19-20(11-18)31-14-16(3)26(17(4)27)12-15(2)21(30-6)13-25(5)23(19)29/h9-11,15-16,21H,7-8,12-14H2,1-6H3,(H,24,28)/t15-,16-,21+/m0/s1	HCBZRBWAINIAIP-CKJXQJPGSA-N	433.25767125							116058
BRD-K20414032-001-01-4	LSM-27515	BRD-K20414032	54634318	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20+/m1/s1	LSBAXAJPBMYKOG-GUXCAODWSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H]1C)OC	BroadT	BRD-K20414032	BRD-K20414032-001-01-4	Broad Institute of MIT and Harvard	BRD-K20414032			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H]1C)OC	InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20+/m1/s1	LSBAXAJPBMYKOG-GUXCAODWSA-N	441.22974194							116059
BRD-K30256953-001-01-2	LSM-27516	BRD-K30256953	54634372	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m0/s1	WNEVNPYHFIROBB-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K30256953	BRD-K30256953-001-01-2	Broad Institute of MIT and Harvard	BRD-K30256953			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(OC)cc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-13-20(27-25(30)19-7-10-21(32-5)11-8-19)9-12-22(23)26(31)29(4)15-24(17)33-6/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m0/s1	WNEVNPYHFIROBB-HOOSLVGPSA-N	469.25767125							116060
BRD-K73459362-001-01-5	LSM-27517	BRD-K73459362	54634271	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m0/s1	XSLDIBSITHUXPL-AUSJPIAWSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)C	BroadT	BRD-K73459362	BRD-K73459362-001-01-5	Broad Institute of MIT and Harvard	BRD-K73459362			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C22H33N3O6/c1-14-10-25(16(3)26)15(2)12-31-19-9-17(23-21(27)13-29-5)7-8-18(19)22(28)24(4)11-20(14)30-6/h7-9,14-15,20H,10-13H2,1-6H3,(H,23,27)/t14-,15-,20+/m0/s1	XSLDIBSITHUXPL-AUSJPIAWSA-N	435.236935806							116061
BRD-K76726787-001-01-1	LSM-27518	BRD-K76726787	54634405	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m1/s1	YTFMHZRWJRHUBM-JLHGSKIFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K76726787	BRD-K76726787-001-01-1	Broad Institute of MIT and Harvard	BRD-K76726787			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17+,22+/m1/s1	YTFMHZRWJRHUBM-JLHGSKIFSA-N	447.273321314							116062
BRD-K53701656-001-01-9	LSM-27519	BRD-K53701656	54634231	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m0/s1	BBNOXYVHIXNILT-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K53701656	BRD-K53701656-001-01-9	Broad Institute of MIT and Harvard	BRD-K53701656			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccc3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C25H33N3O4/c1-17-14-27(3)18(2)16-32-22-13-20(26-24(29)19-9-7-6-8-10-19)11-12-21(22)25(30)28(4)15-23(17)31-5/h6-13,17-18,23H,14-16H2,1-5H3,(H,26,29)/t17-,18+,23+/m0/s1	BBNOXYVHIXNILT-YZZKKUAISA-N	439.247106566							116063
BRD-K89115896-001-01-0	LSM-27520	BRD-K89115896	54634298	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16-,20+/m1/s1	LPUASZNJMDRPQZ-QINHECLXSA-N	COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	BroadT	BRD-K89115896	BRD-K89115896-001-01-0	Broad Institute of MIT and Harvard	BRD-K89115896			COCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)COC	InChI=1S/C23H35N3O7/c1-15-10-26(22(28)14-31-5)16(2)12-33-19-8-7-17(24-21(27)13-30-4)9-18(19)23(29)25(3)11-20(15)32-6/h7-9,15-16,20H,10-14H2,1-6H3,(H,24,27)/t15-,16-,20+/m1/s1	LPUASZNJMDRPQZ-QINHECLXSA-N	465.24750049							116064
BRD-K14527934-001-01-0	LSM-27521	BRD-K14527934	54634443	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20+,26+/m0/s1	KZQLWMFDTATSFP-OUDXUNEISA-N	CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K14527934	BRD-K14527934-001-01-0	Broad Institute of MIT and Harvard	BRD-K14527934			CCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3ccccc3OC)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C28H39N3O5/c1-7-27(32)29-22-12-13-25-23(14-22)28(33)30(4)17-26(35-6)19(2)15-31(20(3)18-36-25)16-21-10-8-9-11-24(21)34-5/h8-14,19-20,26H,7,15-18H2,1-6H3,(H,29,32)/t19-,20+,26+/m0/s1	KZQLWMFDTATSFP-OUDXUNEISA-N	497.288971378							116065
BRD-K34371768-001-01-0	LSM-27522	BRD-K34371768	54634402	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22-/m1/s1	YTFMHZRWJRHUBM-DRSNIGMVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K34371768	BRD-K34371768-001-01-0	Broad Institute of MIT and Harvard	BRD-K34371768			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCOCC3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C24H37N3O5/c1-16-13-26(3)17(2)15-32-21-7-6-19(25-23(28)18-8-10-31-11-9-18)12-20(21)24(29)27(4)14-22(16)30-5/h6-7,12,16-18,22H,8-11,13-15H2,1-5H3,(H,25,28)/t16-,17-,22-/m1/s1	YTFMHZRWJRHUBM-DRSNIGMVSA-N	447.273321314							116066
BRD-K63814979-001-01-8	LSM-27523	BRD-K63814979	54634166	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-17-18(9-16)29-12-15(4)22-10-14(3)19(28-6)11-25(5)20(17)26/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15-,19+/m0/s1	BCEADABJMKBPCA-YZVOILCLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K63814979	BRD-K63814979-001-01-8	Broad Institute of MIT and Harvard	BRD-K63814979			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C21H34N4O4/c1-13(2)23-21(27)24-16-7-8-17-18(9-16)29-12-15(4)22-10-14(3)19(28-6)11-25(5)20(17)26/h7-9,13-15,19,22H,10-12H2,1-6H3,(H2,23,24,27)/t14-,15-,19+/m0/s1	BCEADABJMKBPCA-YZVOILCLSA-N	406.258005608							116067
BRD-K17844758-001-01-9	LSM-27524	BRD-K17844758	54634344	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-13-21(28-26(33)27-20-9-7-6-8-10-20)11-12-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m1/s1	MYURTGQUXIJGDV-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K17844758	BRD-K17844758-001-01-9	Broad Institute of MIT and Harvard	BRD-K17844758			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H34N4O5/c1-17-14-30(19(3)31)18(2)16-35-23-13-21(28-26(33)27-20-9-7-6-8-10-20)11-12-22(23)25(32)29(4)15-24(17)34-5/h6-13,17-18,24H,14-16H2,1-5H3,(H2,27,28,33)/t17-,18+,24-/m1/s1	MYURTGQUXIJGDV-NXMSCROESA-N	482.252920228							116068
BRD-K81206758-001-01-2	LSM-27525	BRD-K81206758	54634398	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-7-6-15(24-32(28,29)12-20(21,22)23)8-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14-,18-/m0/s1	NAKUAOPJLXDQOX-DEYYWGMASA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K81206758	BRD-K81206758-001-01-2	Broad Institute of MIT and Harvard	BRD-K81206758			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)CC(F)(F)F)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-7-6-15(24-32(28,29)12-20(21,22)23)8-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14-,18-/m0/s1	NAKUAOPJLXDQOX-DEYYWGMASA-N	481.18582638							116069
BRD-K62769676-001-01-1	LSM-27526	BRD-K62769676	54634392	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18-,22+/m1/s1	COGTYPOCQQQYGQ-HMFYCAOWSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	BroadT	BRD-K62769676	BRD-K62769676-001-01-1	Broad Institute of MIT and Harvard	BRD-K62769676			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)CCC)ccc2OC[C@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-21-20(13-19)24(29)26(5)15-22(30-6)17(3)14-27(12-8-2)18(4)16-31-21/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18-,22+/m1/s1	COGTYPOCQQQYGQ-HMFYCAOWSA-N	433.294056758							116070
CHEMBL3187782	LSM-27527	BRD-K99261483	54634323	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-17(5-7-18(21)23(31)30(3)12-22(14)33-4)29-24(32)28-16-6-8-19(25)20(26)9-16/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22-/m0/s1	XHOPKPACQVDKTO-DFFLPILJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K99261483	BRD-K99261483-001-01-9	Broad Institute of MIT and Harvard	BRD-K99261483			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-17(5-7-18(21)23(31)30(3)12-22(14)33-4)29-24(32)28-16-6-8-19(25)20(26)9-16/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22-/m0/s1	XHOPKPACQVDKTO-DFFLPILJSA-N	508.1644109							116071
BRD-K75437155-001-01-0	LSM-27528	BRD-K75437155	54634210	InChI=1S/C23H34F3N3O4/c1-6-21(30)27-17-7-8-18-19(11-17)33-14-16(3)29(10-9-23(24,25)26)12-15(2)20(32-5)13-28(4)22(18)31/h7-8,11,15-16,20H,6,9-10,12-14H2,1-5H3,(H,27,30)/t15-,16+,20-/m0/s1	KLQKGCQUDAKEQP-YRNRMSPPSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(CCC(F)(F)F)[C@H](C)COc2c1	BroadT	BRD-K75437155	BRD-K75437155-001-01-0	Broad Institute of MIT and Harvard	BRD-K75437155			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(CCC(F)(F)F)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C23H34F3N3O4/c1-6-21(30)27-17-7-8-18-19(11-17)33-14-16(3)29(10-9-23(24,25)26)12-15(2)20(32-5)13-28(4)22(18)31/h7-8,11,15-16,20H,6,9-10,12-14H2,1-5H3,(H,27,30)/t15-,16+,20-/m0/s1	KLQKGCQUDAKEQP-YRNRMSPPSA-N	473.250141198							116072
AC1LLGA2	LSM-27529	BRD-K81288145	1109527	InChI=1S/C18H20N4O5/c1-13-2-3-14(10-16(13)22(24)25)17-5-4-15(27-17)11-19-20-18(23)12-21-6-8-26-9-7-21/h2-5,10-11H,6-9,12H2,1H3,(H,20,23)	KOSIRPOFLSHMNW-UHFFFAOYSA-N	Cc1ccc(cc1[N+](=O)[O-])c2oc(C=NNC(=O)CN3CCOCC3)cc2	BroadT	BRD-K81288145	BRD-K81288145-001-05-3	Asinex Ltd.	BAS 00885679			Cc1ccc(cc1[N+]([O-])=O)-c1ccc(C=NNC(=O)CN2CCOCC2)o1	InChI=1S/C18H20N4O5/c1-13-2-3-14(10-16(13)22(24)25)17-5-4-15(27-17)11-19-20-18(23)12-21-6-8-26-9-7-21/h2-5,10-11H,6-9,12H2,1H3,(H,20,23)	KOSIRPOFLSHMNW-UHFFFAOYSA-N	372.14336978							116073
4-(3-Nitro-phenyl)-1-phenyl-1H-imidazole-2-thiol	LSM-27530	SID24841166, BRD-K80742614	3482844	InChI=1S/C15H11N3O2S/c19-18(20)13-8-4-5-11(9-13)14-10-17(15(21)16-14)12-6-2-1-3-7-12/h1-10H,(H,16,21)	DZJQPKKLPUCNDW-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)c2cn(c(S)n2)c3ccccc3	BroadT	BRD-K80742614	BRD-K80742614-001-06-0	Enamine Ltd.	T0519-8222			[O-][N+](=O)c1cccc(c1)-c1cn(c(S)n1)-c1ccccc1	InChI=1S/C15H11N3O2S/c19-18(20)13-8-4-5-11(9-13)14-10-17(15(21)16-14)12-6-2-1-3-7-12/h1-10H,(H,16,21)	DZJQPKKLPUCNDW-UHFFFAOYSA-N	297.057197312							116074
MLS000074230	LSM-27531	SID851322, SID26668744, BRD-K44630927	653893	InChI=1S/C26H38N4O3/c1-19-15-21-17-22(25(31)28-24(21)16-20(19)2)18-30(10-6-9-29-11-13-33-14-12-29)26(32)27-23-7-4-3-5-8-23/h15-17,23H,3-14,18H2,1-2H3,(H,27,32)(H,28,31)	OCZKUXCPTZVGRD-UHFFFAOYSA-N	Cc1cc2cc(CN(CCCN3CCOCC3)C(=O)NC4CCCCC4)c(O)nc2cc1C	BroadT	BRD-K44630927	BRD-K44630927-001-06-4	Asinex Ltd.	ASN 03367612			Cc1cc2cc(CN(CCCN3CCOCC3)C(=O)NC3CCCCC3)c(O)nc2cc1C	InChI=1S/C26H38N4O3/c1-19-15-21-17-22(25(31)28-24(21)16-20(19)2)18-30(10-6-9-29-11-13-33-14-12-29)26(32)27-23-7-4-3-5-8-23/h15-17,23H,3-14,18H2,1-2H3,(H,27,32)(H,28,31)	OCZKUXCPTZVGRD-UHFFFAOYSA-N	454.294391116							116075
ASN 08235036	LSM-15571	BRD-A62768503	655232	InChI=1S/C17H22N2O4/c1-11-5-3-4-6-19(11)9-17(21)18-14-8-16-15(22-10-23-16)7-13(14)12(2)20/h7-8,11H,3-6,9-10H2,1-2H3,(H,18,21)	LULPXNLMGSBWQQ-UHFFFAOYSA-N	CC1CCCCN1CC(=O)Nc2cc3OCOc3cc2C(=O)C	BroadT	BRD-A62768503	BRD-A62768503-034-05-6	Asinex Ltd.	ASN 08235036		OC(=O)C(=O)O	CC1CCCCN1CC(=O)Nc1cc2OCOc2cc1C(C)=O.OC(=O)C(=O)O	InChI=1S/C17H22N2O4.C2H2O4/c1-11-5-3-4-6-19(11)9-17(21)18-14-8-16-15(22-10-23-16)7-13(14)12(2)20;3-1(4)2(5)6/h7-8,11H,3-6,9-10H2,1-2H3,(H,18,21);(H,3,4)(H,5,6)	GGDCINMYBXBJSB-UHFFFAOYSA-N	318.157957204							104207, 104207
4-(Imidazo[1,2-a]pyridin-2-ylmethoxy)benzaldehyde	LSM-27532	SID24830549, BRD-K25682102	739244	InChI=1S/C15H12N2O2/c18-10-12-4-6-14(7-5-12)19-11-13-9-17-8-2-1-3-15(17)16-13/h1-10H,11H2	DJDDDYGGKVCWQO-UHFFFAOYSA-N	O=Cc1ccc(OCc2cn3ccccc3n2)cc1	BroadT	BRD-K25682102	BRD-K25682102-001-05-7	Enamine Ltd.	EN300-15160			O=Cc1ccc(OCc2cn3ccccc3n2)cc1	InChI=1S/C15H12N2O2/c18-10-12-4-6-14(7-5-12)19-11-13-9-17-8-2-1-3-15(17)16-13/h1-10H,11H2	DJDDDYGGKVCWQO-UHFFFAOYSA-N	252.089877644							116076
BIONET2_000175	LSM-27533	BRD-K64632848	3710004	InChI=1S/C13H11ClN2O2/c1-16-8-10(6-12(16)7-15-18)13(17)9-3-2-4-11(14)5-9/h2-8,18H,1H3	VPULOGSWHHBAOC-UHFFFAOYSA-N	Cn1cc(cc1C=NO)C(=O)c2cccc(Cl)c2	BroadT	BRD-K64632848	BRD-K64632848-001-06-1	Key Organics Ltd.	9F-031			Cn1cc(cc1C=NO)C(=O)c1cccc(Cl)c1	InChI=1S/C13H11ClN2O2/c1-16-8-10(6-12(16)7-15-18)13(17)9-3-2-4-11(14)5-9/h2-8,18H,1H3	VPULOGSWHHBAOC-UHFFFAOYSA-N	262.050905322							116077
MLS001237994	LSM-27534	SID51087795, BRD-A95447864	4170573	InChI=1S/C23H30N4O4S2/c1-15-6-4-5-12-27(15)33(30,31)17-9-7-16(8-10-17)21(28)25-23-20(22(29)24-2)18-11-13-26(3)14-19(18)32-23/h7-10,15H,4-6,11-14H2,1-3H3,(H,24,29)(H,25,28)	UJOHDNAUCYSMOG-UHFFFAOYSA-N	CNC(=O)c1c2CCN(C)Cc2sc1NC(=O)c3ccc(cc3)S(=O)(=O)N4CCCCC4C	BroadT	BRD-A95447864	BRD-A95447864-001-06-8	Life Chemicals Inc.	F0562-0063			CNC(=O)c1c(NC(=O)c2ccc(cc2)S(=O)(=O)N2CCCCC2C)sc2CN(C)CCc12	InChI=1S/C23H30N4O4S2/c1-15-6-4-5-12-27(15)33(30,31)17-9-7-16(8-10-17)21(28)25-23-20(22(29)24-2)18-11-13-26(3)14-19(18)32-23/h7-10,15H,4-6,11-14H2,1-3H3,(H,24,29)(H,25,28)	UJOHDNAUCYSMOG-UHFFFAOYSA-N	490.17084686							116078
MLS000565407	LSM-44208	SID14745990, BRD-K40455506	5567858	InChI=1S/C27H24N4O5/c1-17-24(27(34)31(29(17)2)18-8-5-4-6-9-18)28-15-23-21-12-11-19(35-3)14-22(21)25(32)30(26(23)33)16-20-10-7-13-36-20/h4-15,28H,16H2,1-3H3/b23-15-	NVWFNGRWBYLOQL-HAHDFKILSA-N	COc1ccc2\C(=C\NC3=C(C)N(C)N(C3=O)c4ccccc4)\C(=O)N(Cc5occc5)C(=O)c2c1	BroadT	BRD-K40455506	BRD-K40455506-001-05-1	Enamine Ltd.	T0503-4193			COc1ccc2c(c1)C(=O)N(Cc1ccco1)C(=O)\C2=C/Nc1c(C)n(C)n(-c2ccccc2)c1=O	InChI=1S/C27H24N4O5/c1-17-24(27(34)31(29(17)2)18-8-5-4-6-9-18)28-15-23-21-12-11-19(35-3)14-22(21)25(32)30(26(23)33)16-20-10-7-13-36-20/h4-15,28H,16H2,1-3H3/b23-15-	NVWFNGRWBYLOQL-HAHDFKILSA-N	484.174669908							
MLS000420564	LSM-27536	SID26732004, BRD-A13191421	16746201	InChI=1S/C29H27FN4O4/c30-24-11-4-2-7-20(24)14-15-32-25-13-12-22(16-27(25)34(37)38)26(18-28(31)35)33-29(36)17-21-9-5-8-19-6-1-3-10-23(19)21/h1-13,16,26,32H,14-15,17-18H2,(H2,31,35)(H,33,36)	HMNVBBZRQSHGFH-UHFFFAOYSA-N	NC(=O)CC(NC(=O)Cc1cccc2ccccc12)c3ccc(NCCc4ccccc4F)c(c3)[N+](=O)[O-]	BroadT	BRD-A13191421	BRD-A13191421-001-05-9	University of California at Davis	X2-R12-R248			NC(=O)CC(NC(=O)Cc1cccc2ccccc12)c1ccc(NCCc2ccccc2F)c(c1)[N+]([O-])=O	InChI=1S/C29H27FN4O4/c30-24-11-4-2-7-20(24)14-15-32-25-13-12-22(16-27(25)34(37)38)26(18-28(31)35)33-29(36)17-21-9-5-8-19-6-1-3-10-23(19)21/h1-13,16,26,32H,14-15,17-18H2,(H2,31,35)(H,33,36)	HMNVBBZRQSHGFH-UHFFFAOYSA-N	514.201633584							116080
ST50941939	LSM-27537	SID49826054, BRD-K49207268	1246230	InChI=1S/C13H11BrClNOS/c14-12-6-5-11(18-12)13(17)16-8-7-9-1-3-10(15)4-2-9/h1-6H,7-8H2,(H,16,17)	IVYDVHNGOCPYNY-UHFFFAOYSA-N	Clc1ccc(CCNC(=O)c2ccc(Br)s2)cc1	BroadT	BRD-K49207268	BRD-K49207268-001-05-5	Chemical Technologies & Investigations	UZI/9445341			Clc1ccc(CCNC(=O)c2ccc(Br)s2)cc1	InChI=1S/C13H11BrClNOS/c14-12-6-5-11(18-12)13(17)16-8-7-9-1-3-10(15)4-2-9/h1-6H,7-8H2,(H,16,17)	IVYDVHNGOCPYNY-UHFFFAOYSA-N	342.943324982							116081
BAS 02056251	LSM-27538	SID24782941, BRD-K32682075	702124	InChI=1S/C18H16N2O/c1-12-11-18(16-5-3-4-6-17(16)19-12)20-15-9-7-14(8-10-15)13(2)21/h3-11H,1-2H3,(H,19,20)	UBBKSXXYIVHEHC-UHFFFAOYSA-N	CC(=O)c1ccc(Nc2cc(C)nc3ccccc23)cc1	BroadT	BRD-K32682075	BRD-K32682075-001-06-9	Asinex Ltd.	BAS 02056251			CC(=O)c1ccc(Nc2cc(C)nc3ccccc23)cc1	InChI=1S/C18H16N2O/c1-12-11-18(16-5-3-4-6-17(16)19-12)20-15-9-7-14(8-10-15)13(2)21/h3-11H,1-2H3,(H,19,20)	UBBKSXXYIVHEHC-UHFFFAOYSA-N	276.126263152							116082
MLS000585413	LSM-44209	SID22401482, BRD-K40599163	15944783	InChI=1S/C18H17N3O3S/c1-11-4-3-5-13(8-11)19-16(22)10-21-17(23)15(20-18(21)24)9-14-7-6-12(2)25-14/h3-9H,10H2,1-2H3,(H,19,22)(H,20,24)/b15-9+	QJCCIJNTDDNXKC-OQLLNIDSSA-N	Cc1cccc(NC(=O)CN2C(=O)N\C(=C\c3ccc(C)s3)\C2=O)c1	BroadT	BRD-K40599163	BRD-K40599163-001-06-8	ChemDiv Inc.	5775-2425			Cc1ccc(\C=C2\NC(=O)N(CC(=O)Nc3cccc(C)c3)C2=O)s1	InChI=1S/C18H17N3O3S/c1-11-4-3-5-13(8-11)19-16(22)10-21-17(23)15(20-18(21)24)9-14-7-6-12(2)25-14/h3-9H,10H2,1-2H3,(H,19,22)(H,20,24)/b15-9+	QJCCIJNTDDNXKC-OQLLNIDSSA-N	355.099062124							
MLS000063023	LSM-27540	SID4262796, BRD-K76563814	844198	InChI=1S/C14H13NO4S/c1-18-10-5-3-9(4-6-10)13(16)15-11-7-8-20-12(11)14(17)19-2/h3-8H,1-2H3,(H,15,16)	IQHFVFGUPWQQCP-UHFFFAOYSA-N	COC(=O)c1sccc1NC(=O)c2ccc(OC)cc2	BroadT	BRD-K76563814	BRD-K76563814-001-05-6	ChemBridge Corporation	7244733			COC(=O)c1sccc1NC(=O)c1ccc(OC)cc1	InChI=1S/C14H13NO4S/c1-18-10-5-3-9(4-6-10)13(16)15-11-7-8-20-12(11)14(17)19-2/h3-8H,1-2H3,(H,15,16)	IQHFVFGUPWQQCP-UHFFFAOYSA-N	291.056528596							116084
MLS002415569	LSM-3074	BRD-K48974000, SID57287604, SID85147014	1398345	InChI=1S/C19H16ClN3O3S/c1-2-8-23-18(13-4-3-5-14(20)9-13)21-22-19(23)27-11-17(26)12-6-7-15(24)16(25)10-12/h2-7,9-10,24-25H,1,8,11H2	DZTFRDMOGLIUFL-UHFFFAOYSA-N	Oc1ccc(cc1O)C(=O)CSc2nnc(c3cccc(Cl)c3)n2CC=C	BroadT	BRD-K48974000	BRD-K48974000-001-04-7	Sanford-Burnham Medical Research Institute	MLS-0390857.0001			Oc1ccc(cc1O)C(=O)CSc1nnc(-c2cccc(Cl)c2)n1CC=C	InChI=1S/C19H16ClN3O3S/c1-2-8-23-18(13-4-3-5-14(20)9-13)21-22-19(23)27-11-17(26)12-6-7-15(24)16(25)10-12/h2-7,9-10,24-25H,1,8,11H2	DZTFRDMOGLIUFL-UHFFFAOYSA-N	401.060089802							92847
SMR000031006	LSM-27541	SID26724719, SID4244832, BRD-K79335867	3239379	InChI=1S/C23H31N3O6S/c1-3-29-18-14-16-17(15-19(18)30-4-2)24-22(33)26(21(16)28)9-5-6-20(27)25-10-7-23(8-11-25)31-12-13-32-23/h14-15H,3-13H2,1-2H3,(H,24,33)	LHOXOGTWVAVRGV-UHFFFAOYSA-N	CCOc1cc2NC(=S)N(CCCC(=O)N3CCC4(CC3)OCCO4)C(=O)c2cc1OCC	BroadT	BRD-K79335867	BRD-K79335867-001-05-2	ChemDiv Inc.	K284-7490			CCOc1cc2[nH]c(=S)n(CCCC(=O)N3CCC4(CC3)OCCO4)c(=O)c2cc1OCC	InChI=1S/C23H31N3O6S/c1-3-29-18-14-16-17(15-19(18)30-4-2)24-22(33)26(21(16)28)9-5-6-20(27)25-10-7-23(8-11-25)31-12-13-32-23/h14-15H,3-13H2,1-2H3,(H,24,33)	LHOXOGTWVAVRGV-UHFFFAOYSA-N	477.193356432							116085
MLS000033601	LSM-27542	SID26668164, SID853452, BRD-K18551565	656111	InChI=1S/C22H27N5O4S2/c28-32(29,24-17-6-1-2-7-17)19-8-5-9-20(16-19)33(30,31)26-14-12-18(13-15-26)27-22-11-4-3-10-21(22)23-25-27/h3-5,8-11,16-18,24H,1-2,6-7,12-15H2	OJYISAUOTBLSLB-UHFFFAOYSA-N	O=S(=O)(NC1CCCC1)c2cccc(c2)S(=O)(=O)N3CCC(CC3)n4nnc5ccccc45	BroadT	BRD-K18551565	BRD-K18551565-001-05-3	Asinex Ltd.	ASN 06365159			O=S(=O)(NC1CCCC1)c1cccc(c1)S(=O)(=O)N1CCC(CC1)n1nnc2ccccc12	InChI=1S/C22H27N5O4S2/c28-32(29,24-17-6-1-2-7-17)19-8-5-9-20(16-19)33(30,31)26-14-12-18(13-15-26)27-22-11-4-3-10-21(22)23-25-27/h3-5,8-11,16-18,24H,1-2,6-7,12-15H2	OJYISAUOTBLSLB-UHFFFAOYSA-N	489.150445774							116086
MLS000066371	LSM-27543	SID4258346, BRD-K70281809	1250533	InChI=1S/C18H21N3O/c1-3-9-21-13-20-17-11-15(7-8-18(17)21)19-12-14-5-4-6-16(10-14)22-2/h4-8,10-11,13,19H,3,9,12H2,1-2H3	PRPHWGJCZXFCCY-UHFFFAOYSA-N	CCCn1cnc2cc(NCc3cccc(OC)c3)ccc12	BroadT	BRD-K70281809	BRD-K70281809-001-07-4	ChemBridge Corporation	7957258			CCCn1cnc2cc(NCc3cccc(OC)c3)ccc12	InChI=1S/C18H21N3O/c1-3-9-21-13-20-17-11-15(7-8-18(17)21)19-12-14-5-4-6-16(10-14)22-2/h4-8,10-11,13,19H,3,9,12H2,1-2H3	PRPHWGJCZXFCCY-UHFFFAOYSA-N	295.168462322							116087
SMR000248644	LSM-27544	SID24784729, BRD-K96189035	4329797	InChI=1S/C24H22N4O3S2/c29-20(13-32-24-28-27-23(33-24)26-14-6-2-1-3-7-14)25-15-10-11-18-19(12-15)22(31)17-9-5-4-8-16(17)21(18)30/h4-5,8-12,14H,1-3,6-7,13H2,(H,25,29)(H,26,27)	AYDYLYXVAHBVDG-UHFFFAOYSA-N	O=C(CSc1nnc(NC2CCCCC2)s1)Nc3ccc4C(=O)c5ccccc5C(=O)c4c3	BroadT	BRD-K96189035	BRD-K96189035-001-05-9	Enamine Ltd.	T5234375			O=C(CSc1nnc(NC2CCCCC2)s1)Nc1ccc2C(=O)c3ccccc3C(=O)c2c1	InChI=1S/C24H22N4O3S2/c29-20(13-32-24-28-27-23(33-24)26-14-6-2-1-3-7-14)25-15-10-11-18-19(12-15)22(31)17-9-5-4-8-16(17)21(18)30/h4-5,8-12,14H,1-3,6-7,13H2,(H,25,29)(H,26,27)	AYDYLYXVAHBVDG-UHFFFAOYSA-N	478.113331984							116088
AC1NJOLW	LSM-27545	SID24830507, BRD-K52179506	4875314	InChI=1S/C16H15N3O4/c20-15(10-23-14-5-2-8-17-16(14)19(21)22)18-13-7-6-11-3-1-4-12(11)9-13/h2,5-9H,1,3-4,10H2,(H,18,20)	OHYBJDLWXZKHJW-UHFFFAOYSA-N	[O-][N+](=O)c1ncccc1OCC(=O)Nc2ccc3CCCc3c2	BroadT	BRD-K52179506	BRD-K52179506-001-06-0	Enamine Ltd.	T5293435			[O-][N+](=O)c1ncccc1OCC(=O)Nc1ccc2CCCc2c1	InChI=1S/C16H15N3O4/c20-15(10-23-14-5-2-8-17-16(14)19(21)22)18-13-7-6-11-3-1-4-12(11)9-13/h2,5-9H,1,3-4,10H2,(H,18,20)	OHYBJDLWXZKHJW-UHFFFAOYSA-N	313.10625599							116089
ST027719	LSM-27546	SID4262985, BRD-A93016805	2921825	InChI=1S/C16H18N2O5/c1-4-7-18-15(20)11(14(19)17-16(18)21)8-10-5-6-12(22-2)13(9-10)23-3/h4-6,9,11H,1,7-8H2,2-3H3,(H,17,19,21)	NNMGFXIYGXIDHC-UHFFFAOYSA-N	COc1ccc(CC2C(=O)NC(=O)N(CC=C)C2=O)cc1OC	BroadT	BRD-A93016805	BRD-A93016805-001-05-7	ChemBridge Corporation	6990444			COc1ccc(CC2C(=O)NC(=O)N(CC=C)C2=O)cc1OC	InChI=1S/C16H18N2O5/c1-4-7-18-15(20)11(14(19)17-16(18)21)8-10-5-6-12(22-2)13(9-10)23-3/h4-6,9,11H,1,7-8H2,2-3H3,(H,17,19,21)	NNMGFXIYGXIDHC-UHFFFAOYSA-N	318.121571696							116090
AC1LEP2N	LSM-27547	BRD-K06058625	739590	InChI=1S/C16H19N3O2/c1-12-6-4-7-13(2)16(12)21-11-15(20)18-17-10-14-8-5-9-19(14)3/h4-10H,11H2,1-3H3,(H,18,20)	DKRSBQYTZPNEQE-UHFFFAOYSA-N	Cc1cccc(C)c1OCC(=O)NN=Cc2cccn2C	BroadT	BRD-K06058625	BRD-K06058625-001-05-1	Asinex Ltd.	BAS 00740715			Cc1cccc(C)c1OCC(=O)NN=Cc1cccn1C	InChI=1S/C16H19N3O2/c1-12-6-4-7-13(2)16(12)21-11-15(20)18-17-10-14-8-5-9-19(14)3/h4-10H,11H2,1-3H3,(H,18,20)	DKRSBQYTZPNEQE-UHFFFAOYSA-N	285.147726878							116091
SMR000002491	LSM-27548	SID845478, SID26667511, BRD-A55463634	647828	InChI=1S/C28H33N7O2/c1-19-11-12-20-18-22(28(36)29-23(20)17-19)26(27-30-31-32-35(27)21-7-3-4-8-21)34-15-13-33(14-16-34)24-9-5-6-10-25(24)37-2/h5-6,9-12,17-18,21,26H,3-4,7-8,13-16H2,1-2H3,(H,29,36)	AMMRMSUGAMFLLR-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)C(c3cc4ccc(C)cc4nc3O)c5nnnn5C6CCCC6	BroadT	BRD-A55463634	BRD-A55463634-001-05-4	Asinex Ltd.	ASN 03777361			COc1ccccc1N1CCN(CC1)C(c1nnnn1C1CCCC1)c1cc2ccc(C)cc2nc1O	InChI=1S/C28H33N7O2/c1-19-11-12-20-18-22(28(36)29-23(20)17-19)26(27-30-31-32-35(27)21-7-3-4-8-21)34-15-13-33(14-16-34)24-9-5-6-10-25(24)37-2/h5-6,9-12,17-18,21,26H,3-4,7-8,13-16H2,1-2H3,(H,29,36)	AMMRMSUGAMFLLR-UHFFFAOYSA-N	499.269573366							116092
AE-406/41056642	LSM-27549	SID22411658, BRD-K05577975	825094	InChI=1S/C19H12ClN3O/c1-22-14-9-5-6-10-15(14)23-18(22)13(11-21)16(17(20)19(23)24)12-7-3-2-4-8-12/h2-10H,1H3	YMEAAIMKOVPHEM-UHFFFAOYSA-N	CN1C2=C(C#N)C(=C(Cl)C(=O)N2c3ccccc13)c4ccccc4	BroadT	BRD-K05577975	BRD-K05577975-001-05-7	Specs	AE-406/41056642			Cn1c2ccccc2n2c1c(C#N)c(-c1ccccc1)c(Cl)c2=O	InChI=1S/C19H12ClN3O/c1-22-14-9-5-6-10-15(14)23-18(22)13(11-21)16(17(20)19(23)24)12-7-3-2-4-8-12/h2-10H,1H3	YMEAAIMKOVPHEM-UHFFFAOYSA-N	333.066889744							116093
SMR000130982	LSM-27550	SID14735305, BRD-K53334174	6623584	InChI=1S/C15H18N2O/c1-2-13-5-7-14(8-6-13)16-15(18)9-12-17-10-3-4-11-17/h3-8,10-11H,2,9,12H2,1H3,(H,16,18)	QOMWEOIUCWVMAF-UHFFFAOYSA-N	CCc1ccc(NC(=O)CCn2cccc2)cc1	BroadT	BRD-K53334174	BRD-K53334174-001-06-1	ChemDiv Inc.	C920-0063			CCc1ccc(NC(=O)CCn2cccc2)cc1	InChI=1S/C15H18N2O/c1-2-13-5-7-14(8-6-13)16-15(18)9-12-17-10-3-4-11-17/h3-8,10-11H,2,9,12H2,1H3,(H,16,18)	QOMWEOIUCWVMAF-UHFFFAOYSA-N	242.141913216							116094
N-Benzyl-2-(hydroxymethyl)benzamide	LSM-27551	SID22413918, BRD-K33647175	826787	InChI=1S/C15H15NO2/c17-11-13-8-4-5-9-14(13)15(18)16-10-12-6-2-1-3-7-12/h1-9,17H,10-11H2,(H,16,18)	CYMDYUHOPAWQJF-UHFFFAOYSA-N	OCc1ccccc1C(=O)NCc2ccccc2	BroadT	BRD-K33647175	BRD-K33647175-001-05-2	Specs	AE-641/05583048			OCc1ccccc1C(=O)NCc1ccccc1	InChI=1S/C15H15NO2/c17-11-13-8-4-5-9-14(13)15(18)16-10-12-6-2-1-3-7-12/h1-9,17H,10-11H2,(H,16,18)	CYMDYUHOPAWQJF-UHFFFAOYSA-N	241.11027873							116095
MLS000771818	LSM-27552	SID24825962, BRD-K43915291	4885280	InChI=1S/C13H14Cl2N4O/c1-7-12(8(2)19(3)18-7)17-13(20)16-9-4-5-10(14)11(15)6-9/h4-6H,1-3H3,(H2,16,17,20)	DKMZNLLUOHHFOR-UHFFFAOYSA-N	Cc1nn(C)c(C)c1NC(=O)Nc2ccc(Cl)c(Cl)c2	BroadT	BRD-K43915291	BRD-K43915291-001-05-0	Enamine Ltd.	T5338635			Cc1nn(C)c(C)c1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C13H14Cl2N4O/c1-7-12(8(2)19(3)18-7)17-13(20)16-9-4-5-10(14)11(15)6-9/h4-6H,1-3H3,(H2,16,17,20)	DKMZNLLUOHHFOR-UHFFFAOYSA-N	312.054466528							116096
SMR000064335	LSM-27553	SID3717206, BRD-K35238169	2082848	InChI=1S/C21H19ClN2O5/c1-14(25)15-6-10-18(11-7-15)27-12-2-3-20(26)28-13-19-23-24-21(29-19)16-4-8-17(22)9-5-16/h4-11H,2-3,12-13H2,1H3	SBWWJGMNCQQHKA-UHFFFAOYSA-N	CC(=O)c1ccc(OCCCC(=O)OCc2oc(nn2)c3ccc(Cl)cc3)cc1	BroadT	BRD-K35238169	BRD-K35238169-001-05-6	Enamine Ltd.	T5274071			CC(=O)c1ccc(OCCCC(=O)OCc2nnc(o2)-c2ccc(Cl)cc2)cc1	InChI=1S/C21H19ClN2O5/c1-14(25)15-6-10-18(11-7-15)27-12-2-3-20(26)28-13-19-23-24-21(29-19)16-4-8-17(22)9-5-16/h4-11H,2-3,12-13H2,1H3	SBWWJGMNCQQHKA-UHFFFAOYSA-N	414.098249438							116097
CHEMBL1509437	LSM-27554	SID17505913, BRD-A84731713	5123423	InChI=1S/C22H20N2O2/c1-25-22-14-8-6-12-19(22)24-20(15-23)18-11-5-7-13-21(18)26-16-17-9-3-2-4-10-17/h2-14,20,24H,16H2,1H3	KYFXPHPBTUJULU-UHFFFAOYSA-N	COc1ccccc1NC(C#N)c2ccccc2OCc3ccccc3	BroadT	BRD-A84731713	BRD-A84731713-001-05-3	InterBioScreen Ltd.	STOCK4S-00850			COc1ccccc1NC(C#N)c1ccccc1OCc1ccccc1	InChI=1S/C22H20N2O2/c1-25-22-14-8-6-12-19(22)24-20(15-23)18-11-5-7-13-21(18)26-16-17-9-3-2-4-10-17/h2-14,20,24H,16H2,1H3	KYFXPHPBTUJULU-UHFFFAOYSA-N	344.1524779							116098
1-[4-Cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]piperidine-4-carboxamide	LSM-27555	SID862901, BRD-K46843625	664140	InChI=1S/C14H14N4O3/c15-8-10-14(18-5-3-9(4-6-18)12(16)19)21-13(17-10)11-2-1-7-20-11/h1-2,7,9H,3-6H2,(H2,16,19)	GIAVKNUIFAOEHQ-UHFFFAOYSA-N	NC(=O)C1CCN(CC1)c2oc(nc2C#N)c3occc3	BroadT	BRD-K46843625	BRD-K46843625-001-05-8	InterBioScreen Ltd.	STOCK4S-61467			NC(=O)C1CCN(CC1)c1oc(nc1C#N)-c1ccco1	InChI=1S/C14H14N4O3/c15-8-10-14(18-5-3-9(4-6-18)12(16)19)21-13(17-10)11-2-1-7-20-11/h1-2,7,9H,3-6H2,(H2,16,19)	GIAVKNUIFAOEHQ-UHFFFAOYSA-N	286.106590348							116099
2-{2-[2-(3-Fluorophenyl)-1,3-thiazol-4-yl]ethyl}-1H-isoindole-1,3(2H)-dione	LSM-27556	SID17409414, BRD-K71585834	1473493	InChI=1S/C19H13FN2O2S/c20-13-5-3-4-12(10-13)17-21-14(11-25-17)8-9-22-18(23)15-6-1-2-7-16(15)19(22)24/h1-7,10-11H,8-9H2	YTGSAHLSZMMNRT-UHFFFAOYSA-N	Fc1cccc(c1)c2nc(CCN3C(=O)c4ccccc4C3=O)cs2	BroadT	BRD-K71585834	BRD-K71585834-001-05-0	Key Organics Ltd.	12W-0275			Fc1cccc(c1)-c1nc(CCN2C(=O)c3ccccc3C2=O)cs1	InChI=1S/C19H13FN2O2S/c20-13-5-3-4-12(10-13)17-21-14(11-25-17)8-9-22-18(23)15-6-1-2-7-16(15)19(22)24/h1-7,10-11H,8-9H2	YTGSAHLSZMMNRT-UHFFFAOYSA-N	352.068176566							116100
STK112234	LSM-27557	SID4264867, BRD-K38082684	893856	InChI=1S/C12H17NOS/c1-10-4-6-11(7-5-10)15-9-8-12(14)13(2)3/h4-7H,8-9H2,1-3H3	LQYXSXYNJWKSML-UHFFFAOYSA-N	CN(C)C(=O)CCSc1ccc(C)cc1	BroadT	BRD-K38082684	BRD-K38082684-001-05-1	ChemBridge Corporation	7599113			CN(C)C(=O)CCSc1ccc(C)cc1	InChI=1S/C12H17NOS/c1-10-4-6-11(7-5-10)15-9-8-12(14)13(2)3/h4-7H,8-9H2,1-3H3	LQYXSXYNJWKSML-UHFFFAOYSA-N	223.103084864							116101
MLS000579620	LSM-27558	SID17432218, BRD-K44461009	974989	InChI=1S/C16H20N4O3S/c21-15(17-11-5-3-1-2-4-6-11)10-24-16-18-13-8-7-12(20(22)23)9-14(13)19-16/h7-9,11H,1-6,10H2,(H,17,21)(H,18,19)	UXAHGCRRTODSNS-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2[nH]c(SCC(=O)NC3CCCCCC3)nc2c1	BroadT	BRD-K44461009	BRD-K44461009-001-05-7	ChemBridge Corporation	7661885			[O-][N+](=O)c1ccc2[nH]c(SCC(=O)NC3CCCCCC3)nc2c1	InChI=1S/C16H20N4O3S/c21-15(17-11-5-3-1-2-4-6-11)10-24-16-18-13-8-7-12(20(22)23)9-14(13)19-16/h7-9,11H,1-6,10H2,(H,17,21)(H,18,19)	UXAHGCRRTODSNS-UHFFFAOYSA-N	348.12561123							116102
AC1OALAC	LSM-27559	BRD-K17238654	6806444	InChI=1S/C15H15N3O5/c1-22-12-6-2-4-10(13(12)19)8-17-18-15(21)14(20)16-9-11-5-3-7-23-11/h2-8,19H,9H2,1H3,(H,16,20)(H,18,21)	UZQFDTKIEOHUBY-UHFFFAOYSA-N	COc1cccc(C=NNC(=O)C(=O)NCc2occc2)c1O	BroadT	BRD-K17238654	BRD-K17238654-001-05-0	ChemBridge Corporation	5569269			COc1cccc(C=NNC(=O)C(=O)NCc2ccco2)c1O	InChI=1S/C15H15N3O5/c1-22-12-6-2-4-10(13(12)19)8-17-18-15(21)14(20)16-9-11-5-3-7-23-11/h2-8,19H,9H2,1H3,(H,16,20)(H,18,21)	UZQFDTKIEOHUBY-UHFFFAOYSA-N	317.10117061							
KUC100025	LSM-27560	SID14728658, SID124350944, BRD-K59075097	5136765	InChI=1S/C19H14F3NO3/c1-25-13-8-6-12(7-9-13)23-18(24)17-11-10-16(26-17)14-4-2-3-5-15(14)19(20,21)22/h2-11H,1H3,(H,23,24)	RXKDAZIRHPJDFT-UHFFFAOYSA-N	COc1ccc(NC(=O)c2oc(cc2)c3ccccc3C(F)(F)F)cc1	BroadT	BRD-K59075097	BRD-K59075097-001-05-0	University of Kansas CMLD	KUC100025			COc1ccc(NC(=O)c2ccc(o2)-c2ccccc2C(F)(F)F)cc1	InChI=1S/C19H14F3NO3/c1-25-13-8-6-12(7-9-13)23-18(24)17-11-10-16(26-17)14-4-2-3-5-15(14)19(20,21)22/h2-11H,1H3,(H,23,24)	RXKDAZIRHPJDFT-UHFFFAOYSA-N	361.092577918							116104
4-(2,6-Dimethylphenoxy)-5-methoxy-2-(2-pyridinyl)pyrimidine	LSM-27561	SID24818276, BRD-K26721785	1474153	InChI=1S/C18H17N3O2/c1-12-7-6-8-13(2)16(12)23-18-15(22-3)11-20-17(21-18)14-9-4-5-10-19-14/h4-11H,1-3H3	LTVKLRHBVSLSPX-UHFFFAOYSA-N	COc1cnc(nc1Oc2c(C)cccc2C)c3ccccn3	BroadT	BRD-K26721785	BRD-K26721785-001-06-4	Key Organics Ltd.	3J-326S			COc1cnc(nc1Oc1c(C)cccc1C)-c1ccccn1	InChI=1S/C18H17N3O2/c1-12-7-6-8-13(2)16(12)23-18-15(22-3)11-20-17(21-18)14-9-4-5-10-19-14/h4-11H,1-3H3	LTVKLRHBVSLSPX-UHFFFAOYSA-N	307.132076814							116105
MLS000094938	LSM-27562	SID24838790, SID4244572, BRD-A62218934	3239149	InChI=1S/C20H22N4O4S/c1-12(2)9-15(19(27)28-3)22-16(25)11-29-20-23-17(13-7-5-4-6-8-13)14(10-21)18(26)24-20/h4-8,12,15H,9,11H2,1-3H3,(H,22,25)(H,23,24,26)	AKPKVAZBSUXKSJ-UHFFFAOYSA-N	COC(=O)C(CC(C)C)NC(=O)CSc1nc(O)c(C#N)c(n1)c2ccccc2	BroadT	BRD-A62218934	BRD-A62218934-001-06-8	ChemDiv Inc.	4499-0011			COC(=O)C(CC(C)C)NC(=O)CSc1nc(O)c(C#N)c(n1)-c1ccccc1	InChI=1S/C20H22N4O4S/c1-12(2)9-15(19(27)28-3)22-16(25)11-29-20-23-17(13-7-5-4-6-8-13)14(10-21)18(26)24-20/h4-8,12,15H,9,11H2,1-3H3,(H,22,25)(H,23,24,26)	AKPKVAZBSUXKSJ-UHFFFAOYSA-N	414.136175914							116106
1-(1H-Benzimidazol-2-yl)-3-cyclohexylurea	LSM-27563	SID49824254, BRD-K53146207	4159955	InChI=1S/C14H18N4O/c19-14(15-10-6-2-1-3-7-10)18-13-16-11-8-4-5-9-12(11)17-13/h4-5,8-10H,1-3,6-7H2,(H3,15,16,17,18,19)	BZSIUMLEFGANJH-UHFFFAOYSA-N	O=C(NC1CCCCC1)Nc2nc3ccccc3[nH]2	BroadT	BRD-K53146207	BRD-K53146207-001-05-2	Chemical Technologies & Investigations	UZI/9012228			O=C(NC1CCCCC1)Nc1nc2ccccc2[nH]1	InChI=1S/C14H18N4O/c19-14(15-10-6-2-1-3-7-10)18-13-16-11-8-4-5-9-12(11)17-13/h4-5,8-10H,1-3,6-7H2,(H3,15,16,17,18,19)	BZSIUMLEFGANJH-UHFFFAOYSA-N	258.148061236							116107
MLS001004161	LSM-27564	SID24831497, BRD-K16442062	2466273	InChI=1S/C12H12N2O2S/c1-8-5-6-17-11(8)12(15)14-9-3-4-10(16-2)13-7-9/h3-7H,1-2H3,(H,14,15)	DVJRBENVECQQBY-UHFFFAOYSA-N	COc1ccc(NC(=O)c2sccc2C)cn1	BroadT	BRD-K16442062	BRD-K16442062-001-05-5	Enamine Ltd.	T5320606			COc1ccc(NC(=O)c2sccc2C)cn1	InChI=1S/C12H12N2O2S/c1-8-5-6-17-11(8)12(15)14-9-3-4-10(16-2)13-7-9/h3-7H,1-2H3,(H,14,15)	DVJRBENVECQQBY-UHFFFAOYSA-N	248.061948334							116108
Amiodarone	LSM-2379	Pacerone, Cordarone, Amiodarone, SKF-33134A, L-3428	2157	InChI=1S/C25H29I2NO3/c1-4-7-11-22-23(18-10-8-9-12-21(18)31-22)24(29)17-15-19(26)25(20(27)16-17)30-14-13-28(5-2)6-3/h8-10,12,15-16H,4-7,11,13-14H2,1-3H3	IYIKLHRQXLHMJQ-UHFFFAOYSA-N	CCCCc1oc2ccccc2c1C(=O)c3cc(I)c(OCCN(CC)CC)c(I)c3	BroadT	BRD-K17561142	BRD-K17561142-003-19-2	Prestwick Chemical Inc.	Prestw-409		Cl	CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCCN(CC)CC)c(I)c1.Cl	InChI=1S/C25H29I2NO3.ClH/c1-4-7-11-22-23(18-10-8-9-12-21(18)31-22)24(29)17-15-19(26)25(20(27)16-17)30-14-13-28(5-2)6-3;/h8-10,12,15-16H,4-7,11,13-14H2,1-3H3;1H	ITPDYQOUSLNIHG-UHFFFAOYSA-N	645.023679798							2663, 2663
MLS000777418	LSM-27565	SID26670882, BRD-K81969319	1415822	InChI=1S/C16H9ClN2O7/c1-7-12(15(20)8-2-4-9(17)5-3-8)13-11(26-7)6-10(18(22)23)16(21)14(13)19(24)25/h2-6,21H,1H3	HZSADKRNPPIODV-UHFFFAOYSA-N	Cc1oc2cc(c(O)c(c2c1C(=O)c3ccc(Cl)cc3)[N+](=O)[O-])[N+](=O)[O-]	BroadT	BRD-K81969319	BRD-K81969319-001-06-6	InterBioScreen Ltd.	STOCK1S-41193			Cc1oc2cc(c(O)c([N+]([O-])=O)c2c1C(=O)c1ccc(Cl)cc1)[N+]([O-])=O	InChI=1S/C16H9ClN2O7/c1-7-12(15(20)8-2-4-9(17)5-3-8)13-11(26-7)6-10(18(22)23)16(21)14(13)19(24)25/h2-6,21H,1H3	HZSADKRNPPIODV-UHFFFAOYSA-N	376.009828358							116109
F0642-3375	LSM-27566	SID24816748, BRD-K37696850	7105654	InChI=1S/C12H15N3OS/c1-4-10(16)14-15-12-13-11-8(3)7(2)5-6-9(11)17-12/h5-6H,4H2,1-3H3,(H,13,15)(H,14,16)	DQNRVEZJSBSRLK-UHFFFAOYSA-N	CCC(=O)NNc1nc2c(C)c(C)ccc2s1	BroadT	BRD-K37696850	BRD-K37696850-001-05-7	Life Chemicals Inc.	F0642-3375			CCC(=O)NNc1nc2c(C)c(C)ccc2s1	InChI=1S/C12H15N3OS/c1-4-10(16)14-15-12-13-11-8(3)7(2)5-6-9(11)17-12/h5-6H,4H2,1-3H3,(H,13,15)(H,14,16)	DQNRVEZJSBSRLK-UHFFFAOYSA-N	249.09358282							116110
ST50021162	LSM-27567	SID17408386, BRD-K47117281	1078308	InChI=1S/C23H21N3O3S/c1-14-8-4-5-9-16(14)12-26-13-24-22-19(23(26)28)15(2)20(30-22)21(27)25-17-10-6-7-11-18(17)29-3/h4-11,13H,12H2,1-3H3,(H,25,27)	ZTRWCLRJZHJKAF-UHFFFAOYSA-N	COc1ccccc1NC(=O)c2sc3N=CN(Cc4ccccc4C)C(=O)c3c2C	BroadT	BRD-K47117281	BRD-K47117281-001-05-1	Asinex Ltd.	BAS 05171414			COc1ccccc1NC(=O)c1sc2ncn(Cc3ccccc3C)c(=O)c2c1C	InChI=1S/C23H21N3O3S/c1-14-8-4-5-9-16(14)12-26-13-24-22-19(23(26)28)15(2)20(30-22)21(27)25-17-10-6-7-11-18(17)29-3/h4-11,13H,12H2,1-3H3,(H,25,27)	ZTRWCLRJZHJKAF-UHFFFAOYSA-N	419.130362252							116111
T5317928	LSM-27568	SID24833194, BRD-K14894773	4880075	InChI=1S/C21H23ClN4O2/c1-2-26(13-19-24-18-6-4-3-5-17(18)21(28)25-19)14-20(27)23-12-11-15-7-9-16(22)10-8-15/h3-10H,2,11-14H2,1H3,(H,23,27)(H,24,25,28)	KRLIIJKUTXLTTJ-UHFFFAOYSA-N	CCN(CC(=O)NCCc1ccc(Cl)cc1)Cc2nc(O)c3ccccc3n2	BroadT	BRD-K14894773	BRD-K14894773-001-05-9	Enamine Ltd.	T5317928			CCN(CC(=O)NCCc1ccc(Cl)cc1)Cc1nc(O)c2ccccc2n1	InChI=1S/C21H23ClN4O2/c1-2-26(13-19-24-18-6-4-3-5-17(18)21(28)25-19)14-20(27)23-12-11-15-7-9-16(22)10-8-15/h3-10H,2,11-14H2,1H3,(H,23,27)(H,24,25,28)	KRLIIJKUTXLTTJ-UHFFFAOYSA-N	398.150953726							116112
4-Benzyl-n-(naphthalen-1-yl)piperazine-1-carboxamide	LSM-27569	SID7972926, BRD-K94868185	796895	InChI=1S/C22H23N3O/c26-22(23-21-12-6-10-19-9-4-5-11-20(19)21)25-15-13-24(14-16-25)17-18-7-2-1-3-8-18/h1-12H,13-17H2,(H,23,26)	RFMHQGJRWXPKJH-UHFFFAOYSA-N	O=C(Nc1cccc2ccccc12)N3CCN(Cc4ccccc4)CC3	BroadT	BRD-K94868185	BRD-K94868185-001-05-8	ChemBridge Corporation	5115506			O=C(Nc1cccc2ccccc12)N1CCN(Cc2ccccc2)CC1	InChI=1S/C22H23N3O/c26-22(23-21-12-6-10-19-9-4-5-11-20(19)21)25-15-13-24(14-16-25)17-18-7-2-1-3-8-18/h1-12H,13-17H2,(H,23,26)	RFMHQGJRWXPKJH-UHFFFAOYSA-N	345.184112386							116113
ST50669209	LSM-27570	SID4260217, BRD-K79957343	1803129	InChI=1S/C13H14N2O2S2/c1-17-7-9-18-11-5-3-2-4-10(11)12(16)15-13-14-6-8-19-13/h2-6,8H,7,9H2,1H3,(H,14,15,16)	GCMNJKOOERJOAN-UHFFFAOYSA-N	COCCSc1ccccc1C(=O)Nc2nccs2	BroadT	BRD-K79957343	BRD-K79957343-001-05-7	ChemBridge Corporation	7908327			COCCSc1ccccc1C(=O)Nc1nccs1	InChI=1S/C13H14N2O2S2/c1-17-7-9-18-11-5-3-2-4-10(11)12(16)15-13-14-6-8-19-13/h2-6,8H,7,9H2,1H3,(H,14,15,16)	GCMNJKOOERJOAN-UHFFFAOYSA-N	294.049669088							116114
STK267412	LSM-27571	SID14727222, BRD-A90137291	2948751	InChI=1S/C11H10N4O2S/c16-10-9(6-7-17-10)18-11-12-13-14-15(11)8-4-2-1-3-5-8/h1-5,9H,6-7H2	IPAZIKZSNCFZNP-UHFFFAOYSA-N	O=C1OCCC1Sc2nnnn2c3ccccc3	BroadT	BRD-A90137291	BRD-A90137291-001-05-5	Asinex Ltd.	BAS 06984752			O=C1OCCC1Sc1nnnn1-c1ccccc1	InChI=1S/C11H10N4O2S/c16-10-9(6-7-17-10)18-11-12-13-14-15(11)8-4-2-1-3-5-8/h1-5,9H,6-7H2	IPAZIKZSNCFZNP-UHFFFAOYSA-N	262.05244629							116115
T5665671	LSM-27572	SID14745235, BRD-A92199425	9551971	InChI=1S/C17H21N3O4S/c1-4-5-8-20-15(22)12-7-6-11(16(23)24-3)9-13(12)19-17(20)25-10(2)14(18)21/h6-7,9-10H,4-5,8H2,1-3H3,(H2,18,21)	KOPJXQVAPJRMJZ-UHFFFAOYSA-N	CCCCN1C(=Nc2cc(ccc2C1=O)C(=O)OC)SC(C)C(=O)N	BroadT	BRD-A92199425	BRD-A92199425-001-05-2	Enamine Ltd.	ZU-0924224			CCCCn1c(SC(C)C(N)=O)nc2cc(ccc2c1=O)C(=O)OC	InChI=1S/C17H21N3O4S/c1-4-5-8-20-15(22)12-7-6-11(16(23)24-3)9-13(12)19-17(20)25-10(2)14(18)21/h6-7,9-10H,4-5,8H2,1-3H3,(H2,18,21)	KOPJXQVAPJRMJZ-UHFFFAOYSA-N	363.125276872							116116
MLS001006280	LSM-15402	BRD-A14853781	2757784	InChI=1S/C14H19ClN2O/c1-12(13-5-3-2-4-6-13)16-7-9-17(10-8-16)14(18)11-15/h2-6,12H,7-11H2,1H3	SFALRUMUWIIQMK-UHFFFAOYSA-N	CC(N1CCN(CC1)C(=O)CCl)c2ccccc2	BroadT	BRD-A14853781	BRD-A14853781-003-07-9	Enamine Ltd.	EN300-12966		Cl	CC(N1CCN(CC1)C(=O)CCl)c1ccccc1.Cl	InChI=1S/C14H19ClN2O.ClH/c1-12(13-5-3-2-4-6-13)16-7-9-17(10-8-16)14(18)11-15;/h2-6,12H,7-11H2,1H3;1H	AGPGWESEOOOUOO-UHFFFAOYSA-N	266.118590958							104044, 104044
STK243869	LSM-27573	SID4257802, BRD-K37354015	851455	InChI=1S/C20H24N2O3/c1-15-4-3-5-18(19(15)24-2)20(23)21-17-8-6-16(7-9-17)14-22-10-12-25-13-11-22/h3-9H,10-14H2,1-2H3,(H,21,23)	DZOUUKYQLDDNKN-UHFFFAOYSA-N	COc1c(C)cccc1C(=O)Nc2ccc(CN3CCOCC3)cc2	BroadT	BRD-K37354015	BRD-K37354015-001-05-5	ChemBridge Corporation	7521577			COc1c(C)cccc1C(=O)Nc1ccc(CN2CCOCC2)cc1	InChI=1S/C20H24N2O3/c1-15-4-3-5-18(19(15)24-2)20(23)21-17-8-6-16(7-9-17)14-22-10-12-25-13-11-22/h3-9H,10-14H2,1-2H3,(H,21,23)	DZOUUKYQLDDNKN-UHFFFAOYSA-N	340.178692648							116117
Ethyl 5-methyl-2-[(2-phenylethyl)amino]-1,3-thiazole-4-carboxylate	LSM-27574	SID24831038, BRD-K74009137	2474286	InChI=1S/C15H18N2O2S/c1-3-19-14(18)13-11(2)20-15(17-13)16-10-9-12-7-5-4-6-8-12/h4-8H,3,9-10H2,1-2H3,(H,16,17)	PWMKNXQNIPVSRQ-UHFFFAOYSA-N	CCOC(=O)c1nc(NCCc2ccccc2)sc1C	BroadT	BRD-K74009137	BRD-K74009137-001-06-0	Enamine Ltd.	T5328405			CCOC(=O)c1nc(NCCc2ccccc2)sc1C	InChI=1S/C15H18N2O2S/c1-3-19-14(18)13-11(2)20-15(17-13)16-10-9-12-7-5-4-6-8-12/h4-8H,3,9-10H2,1-2H3,(H,16,17)	PWMKNXQNIPVSRQ-UHFFFAOYSA-N	290.108898526							116118
MLS000053550	LSM-27575	SID3713302, BRD-K47507533	2098006	InChI=1S/C19H13FN2O3/c1-10-17(23)14-9-11(20)7-8-15(14)25-18(10)16-12-5-3-4-6-13(12)19(24)22(2)21-16/h3-9H,1-2H3	OJGFIJSOTGXACX-UHFFFAOYSA-N	CN1N=C(C2=C(C)C(=O)c3cc(F)ccc3O2)c4ccccc4C1=O	BroadT	BRD-K47507533	BRD-K47507533-001-06-7	Enamine Ltd.	T5230822			Cc1c(oc2ccc(F)cc2c1=O)-c1nn(C)c(=O)c2ccccc12	InChI=1S/C19H13FN2O3/c1-10-17(23)14-9-11(20)7-8-15(14)25-18(10)16-12-5-3-4-6-13(12)19(24)22(2)21-16/h3-9H,1-2H3	OJGFIJSOTGXACX-UHFFFAOYSA-N	336.091020496							116119
AC1N4QZ5	LSM-27576	SID24827372, BRD-A29757134	4159827	InChI=1S/C14H19F3N2S/c1-9(13(2,3)4)18-12(20)19-11-7-5-6-10(8-11)14(15,16)17/h5-9H,1-4H3,(H2,18,19,20)	WDOSJUOKMFKKIP-UHFFFAOYSA-N	CC(N=C(S)Nc1cccc(c1)C(F)(F)F)C(C)(C)C	BroadT	BRD-A29757134	BRD-A29757134-001-05-7	Enamine Ltd.	T0503-5708			CC(N=C(S)Nc1cccc(c1)C(F)(F)F)C(C)(C)C	InChI=1S/C14H19F3N2S/c1-9(13(2,3)4)18-12(20)19-11-7-5-6-10(8-11)14(15,16)17/h5-9H,1-4H3,(H2,18,19,20)	WDOSJUOKMFKKIP-UHFFFAOYSA-N	304.122103918							116120
T0502-9862	LSM-27577	SID22402007, BRD-K12180028	2314360	InChI=1S/C23H16F6N2O6S/c1-14-6-12-17(13-7-14)38(35,36)30-16-10-8-15(9-11-16)21(22(24,25)26,23(27,28)29)37-20(32)18-4-2-3-5-19(18)31(33)34/h2-13,30H,1H3	XDJWAOUGFANZTF-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)Nc2ccc(cc2)C(OC(=O)c3ccccc3[N+](=O)[O-])(C(F)(F)F)C(F)(F)F	BroadT	BRD-K12180028	BRD-K12180028-001-08-2	Enamine Ltd.	T0502-9862			Cc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)C(OC(=O)c1ccccc1[N+]([O-])=O)(C(F)(F)F)C(F)(F)F	InChI=1S/C23H16F6N2O6S/c1-14-6-12-17(13-7-14)38(35,36)30-16-10-8-15(9-11-16)21(22(24,25)26,23(27,28)29)37-20(32)18-4-2-3-5-19(18)31(33)34/h2-13,30H,1H3	XDJWAOUGFANZTF-UHFFFAOYSA-N	562.063326142							116121
AC1M1DEL	LSM-27578	BRD-K20889980	2093252	InChI=1S/C20H23N3O4S/c1-25-12-11-21-20(28)23-22-13-15-5-9-18(10-6-15)27-14-16-3-7-17(8-4-16)19(24)26-2/h3-10,13H,11-12,14H2,1-2H3,(H2,21,23,28)	HHJXVDBRNWOGGI-UHFFFAOYSA-N	COCCN=C(S)NN=Cc1ccc(OCc2ccc(cc2)C(=O)OC)cc1	BroadT	BRD-K20889980	BRD-K20889980-001-05-0	Enamine Ltd.	T5276134			COCCN=C(S)NN=Cc1ccc(OCc2ccc(cc2)C(=O)OC)cc1	InChI=1S/C20H23N3O4S/c1-25-12-11-21-20(28)23-22-13-15-5-9-18(10-6-15)27-14-16-3-7-17(8-4-16)19(24)26-2/h3-10,13H,11-12,14H2,1-2H3,(H2,21,23,28)	HHJXVDBRNWOGGI-UHFFFAOYSA-N	401.140926936							116122
AC1NWO4F	LSM-44210	SID17433294, BRD-K26715984	5732879	InChI=1S/C22H19N3O3S/c1-27-19-10-9-14(12-20(19)28-2)22(26)25-18(13-15-6-5-11-29-15)21-23-16-7-3-4-8-17(16)24-21/h3-13H,1-2H3,(H,23,24)(H,25,26)/b18-13+	WLKUKVVCHULREC-QGOAFFKASA-N	COc1ccc(cc1OC)C(=O)N\C(=C\c2cccs2)\c3nc4ccccc4[nH]3	BroadT	BRD-K26715984	BRD-K26715984-001-05-7	ChemBridge Corporation	6680681			COc1ccc(cc1OC)C(=O)N\C(=C\c1cccs1)c1nc2ccccc2[nH]1	InChI=1S/C22H19N3O3S/c1-27-19-10-9-14(12-20(19)28-2)22(26)25-18(13-15-6-5-11-29-15)21-23-16-7-3-4-8-17(16)24-21/h3-13H,1-2H3,(H,23,24)(H,25,26)/b18-13+	WLKUKVVCHULREC-QGOAFFKASA-N	405.114712188							
ST078917	LSM-27580	SID14738297, BRD-K36562527	1263189	InChI=1S/C14H17NO3S2/c1-8-5-12(6-9(2)14(8)16)15-20(17,18)13-7-10(3)19-11(13)4/h5-7,15-16H,1-4H3	IWORMWOSTFKLJS-UHFFFAOYSA-N	Cc1cc(c(C)s1)S(=O)(=O)Nc2cc(C)c(O)c(C)c2	BroadT	BRD-K36562527	BRD-K36562527-001-05-5	ChemDiv Inc.	8014-1740			Cc1cc(c(C)s1)S(=O)(=O)Nc1cc(C)c(O)c(C)c1	InChI=1S/C14H17NO3S2/c1-8-5-12(6-9(2)14(8)16)15-20(17,18)13-7-10(3)19-11(13)4/h5-7,15-16H,1-4H3	IWORMWOSTFKLJS-UHFFFAOYSA-N	311.064984794							116124
1-[2-(5,6-Dimethyl-1H-benzimidazol-2-yl)ethyl]-3-(2-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea	LSM-27581	SID17409185, BRD-K15617593	1454804	InChI=1S/C25H27N5OS/c1-17-13-21-22(14-18(17)2)28-24(27-21)10-12-30(16-19-7-6-11-26-15-19)25(32)29-20-8-4-5-9-23(20)31-3/h4-9,11,13-15H,10,12,16H2,1-3H3,(H,27,28)(H,29,32)	XISUDBJEZXADGL-UHFFFAOYSA-N	COc1ccccc1N=C(S)N(CCc2nc3cc(C)c(C)cc3[nH]2)Cc4cccnc4	BroadT	BRD-K15617593	BRD-K15617593-001-05-1	Asinex Ltd.	ASN 06610322			COc1ccccc1N=C(S)N(CCc1nc2cc(C)c(C)cc2[nH]1)Cc1cccnc1	InChI=1S/C25H27N5OS/c1-17-13-21-22(14-18(17)2)28-24(27-21)10-12-30(16-19-7-6-11-26-15-19)25(32)29-20-8-4-5-9-23(20)31-3/h4-9,11,13-15H,10,12,16H2,1-3H3,(H,27,28)(H,29,32)	XISUDBJEZXADGL-UHFFFAOYSA-N	445.193631224							116125
5-Bromo-n-(6-sulfamoyl-1,3-benzothiazol-2-yl)furan-2-carboxamide	LSM-27582	SID24823392, BRD-K15060283	2138818	InChI=1S/C12H8BrN3O4S2/c13-10-4-3-8(20-10)11(17)16-12-15-7-2-1-6(22(14,18)19)5-9(7)21-12/h1-5H,(H2,14,18,19)(H,15,16,17)	WRMMTKDIJFSDHI-UHFFFAOYSA-N	NS(=O)(=O)c1ccc2nc(NC(=O)c3oc(Br)cc3)sc2c1	BroadT	BRD-K15060283	BRD-K15060283-001-05-9	ChemDiv Inc.	G786-1550			NS(=O)(=O)c1ccc2nc(NC(=O)c3ccc(Br)o3)sc2c1	InChI=1S/C12H8BrN3O4S2/c13-10-4-3-8(20-10)11(17)16-12-15-7-2-1-6(22(14,18)19)5-9(7)21-12/h1-5H,(H2,14,18,19)(H,15,16,17)	WRMMTKDIJFSDHI-UHFFFAOYSA-N	400.913959746							116126
5-(2-Thienyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine	LSM-27583	SID24806895, BRD-K43712612	673375	InChI=1S/C10H5F3N4S/c11-10(12,13)8-4-6(7-2-1-3-18-7)16-9-14-5-15-17(8)9/h1-5H	XMKJDVXRDGBKRF-UHFFFAOYSA-N	FC(F)(F)c1cc(nc2ncnn12)c3cccs3	BroadT	BRD-K43712612	BRD-K43712612-001-06-1	Asinex Ltd.	BAS 00398176			FC(F)(F)c1cc(nc2ncnn12)-c1cccs1	InChI=1S/C10H5F3N4S/c11-10(12,13)8-4-6(7-2-1-3-18-7)16-9-14-5-15-17(8)9/h1-5H	XMKJDVXRDGBKRF-UHFFFAOYSA-N	270.01870149							116127
ASN 05548171	LSM-27584	SID24784243, BRD-K75240039	3208202	InChI=1S/C19H20N4O3S/c1-4-12-7-13-10(2)5-6-11(3)16(13)22-18(12)27-9-15(24)21-14-8-20-19(26)23-17(14)25/h5-8H,4,9H2,1-3H3,(H,21,24)(H2,20,23,25,26)	RHJNURGZMZLYEZ-UHFFFAOYSA-N	CCc1cc2c(C)ccc(C)c2nc1SCC(=O)Nc3cnc(O)nc3O	BroadT	BRD-K75240039	BRD-K75240039-001-05-1	Asinex Ltd.	ASN 05548171			CCc1cc2c(C)ccc(C)c2nc1SCC(=O)Nc1cnc(O)nc1O	InChI=1S/C19H20N4O3S/c1-4-12-7-13-10(2)5-6-11(3)16(13)22-18(12)27-9-15(24)21-14-8-20-19(26)23-17(14)25/h5-8H,4,9H2,1-3H3,(H,21,24)(H2,20,23,25,26)	RHJNURGZMZLYEZ-UHFFFAOYSA-N	384.12561123							116128
5-(2,2-Dimethoxyethyl)-4-phenyl-4H-1,2,4-triazole-3-thiol	LSM-27585	SID17402984, BRD-K30956565	2764610	InChI=1S/C12H15N3O2S/c1-16-11(17-2)8-10-13-14-12(18)15(10)9-6-4-3-5-7-9/h3-7,11H,8H2,1-2H3,(H,14,18)	RLKLOQQUNLJRGE-UHFFFAOYSA-N	COC(Cc1nnc(S)n1c2ccccc2)OC	BroadT	BRD-K30956565	BRD-K30956565-001-05-8	Key Organics Ltd.	10B-022			COC(Cc1nnc(S)n1-c1ccccc1)OC	InChI=1S/C12H15N3O2S/c1-16-11(17-2)8-10-13-14-12(18)15(10)9-6-4-3-5-7-9/h3-7,11H,8H2,1-2H3,(H,14,18)	RLKLOQQUNLJRGE-UHFFFAOYSA-N	265.08849744							116129
OPREA1_597984	LSM-27586	SID22406076, BRD-K06743581	15945117	InChI=1S/C17H15N5O3S2/c1-11-6-2-3-7-12(11)19-16-20-21-17(27-16)26-10-15(23)18-13-8-4-5-9-14(13)22(24)25/h2-9H,10H2,1H3,(H,18,23)(H,19,20)	OIWXYXFBRDMAIX-UHFFFAOYSA-N	Cc1ccccc1Nc2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])s2	BroadT	BRD-K06743581	BRD-K06743581-001-05-0	Enamine Ltd.	ZT-0311253			Cc1ccccc1Nc1nnc(SCC(=O)Nc2ccccc2[N+]([O-])=O)s1	InChI=1S/C17H15N5O3S2/c1-11-6-2-3-7-12(11)19-16-20-21-17(27-16)26-10-15(23)18-13-8-4-5-9-14(13)22(24)25/h2-9H,10H2,1H3,(H,18,23)(H,19,20)	OIWXYXFBRDMAIX-UHFFFAOYSA-N	401.06163077							116130
SMR000144478	LSM-44211	SID14739873, BRD-K51679460	1246367	InChI=1S/C18H19BrN2OS/c19-17-9-8-16(23-17)18(22)21-13-11-20(12-14-21)10-4-7-15-5-2-1-3-6-15/h1-9H,10-14H2/b7-4+	YUXOQMOFSAGSCF-QPJJXVBHSA-N	Brc1ccc(s1)C(=O)N2CCN(C\C=C\c3ccccc3)CC2	BroadT	BRD-K51679460	BRD-K51679460-001-05-6	ChemBridge Corporation	7946873			Brc1ccc(s1)C(=O)N1CCN(C\C=C\c2ccccc2)CC1	InChI=1S/C18H19BrN2OS/c19-17-9-8-16(23-17)18(22)21-13-11-20(12-14-21)10-4-7-15-5-2-1-3-6-15/h1-9H,10-14H2/b7-4+	YUXOQMOFSAGSCF-QPJJXVBHSA-N	390.040146538							
BAS 02140548	LSM-27588	SID847478, BRD-K68843466	649883	InChI=1S/C19H16N4O3/c1-26-15-9-5-4-8-13(15)23-10-14(24)16(17(23)20)18-21-12-7-3-2-6-11(12)19(25)22-18/h2-9H,10,20H2,1H3,(H,21,22,25)	NJALYGUGCOGFLT-UHFFFAOYSA-N	COc1ccccc1N2CC(=O)C(=C2N)c3nc(O)c4ccccc4n3	BroadT	BRD-K68843466	BRD-K68843466-001-05-3	Asinex Ltd.	BAS 02140548			COc1ccccc1N1CC(=O)C(=C1N)c1nc(O)c2ccccc2n1	InChI=1S/C19H16N4O3/c1-26-15-9-5-4-8-13(15)23-10-14(24)16(17(23)20)18-21-12-7-3-2-6-11(12)19(25)22-18/h2-9H,10,20H2,1H3,(H,21,22,25)	NJALYGUGCOGFLT-UHFFFAOYSA-N	348.122240412							116132
SMR000039725	LSM-44212	SID857359, BRD-K09665624	915757	InChI=1S/C16H16N2O2S/c19-14-13(9-4-8-12-6-2-1-3-7-12)15(20)18-10-5-11-21-16(18)17-14/h1-4,6-8,19H,5,9-11H2/b8-4+	ZLUPNWDYCDIBDP-XBXARRHUSA-N	OC1=C(C\C=C\c2ccccc2)C(=O)N3CCCSC3=N1	BroadT	BRD-K09665624	BRD-K09665624-001-05-1	InterBioScreen Ltd.	STOCK1S-66875			Oc1nc2SCCCn2c(=O)c1C\C=C\c1ccccc1	InChI=1S/C16H16N2O2S/c19-14-13(9-4-8-12-6-2-1-3-7-12)15(20)18-10-5-11-21-16(18)17-14/h1-4,6-8,19H,5,9-11H2/b8-4+	ZLUPNWDYCDIBDP-XBXARRHUSA-N	300.093248462							
SMR000150315	LSM-27590	SID14746882, BRD-K47645297	4362424	InChI=1S/C24H36N4O7S/c1-18(2)8-9-25-24(31)26-22(29)17-35-23(30)20-16-19(36(32,33)28-12-14-34-15-13-28)6-7-21(20)27-10-4-3-5-11-27/h6-7,16,18H,3-5,8-15,17H2,1-2H3,(H2,25,26,29,31)	XJJZJGLIVVMNRP-UHFFFAOYSA-N	CC(C)CCNC(=O)NC(=O)COC(=O)c1cc(ccc1N2CCCCC2)S(=O)(=O)N3CCOCC3	BroadT	BRD-K47645297	BRD-K47645297-001-05-3	Enamine Ltd.	T5217294			CC(C)CCNC(=O)NC(=O)COC(=O)c1cc(ccc1N1CCCCC1)S(=O)(=O)N1CCOCC1	InChI=1S/C24H36N4O7S/c1-18(2)8-9-25-24(31)26-22(29)17-35-23(30)20-16-19(36(32,33)28-12-14-34-15-13-28)6-7-21(20)27-10-4-3-5-11-27/h6-7,16,18H,3-5,8-15,17H2,1-2H3,(H2,25,26,29,31)	XJJZJGLIVVMNRP-UHFFFAOYSA-N	524.230470222							116134
BDBM50367298	LSM-15403	BRD-A36835536	54145859	InChI=1S/C26H29N3O6/c1-17-22(25(30)34-4)24(20-11-8-12-21(15-20)29(32)33)23(18(2)27-17)26(31)35-14-13-28(3)16-19-9-6-5-7-10-19/h5-12,15,22,24H,13-14,16H2,1-4H3	OEIGWXLWQNTHHG-UHFFFAOYSA-N	COC(=O)C1C(C(=C(C)N=C1C)C(=O)OCCN(C)Cc2ccccc2)c3cccc(c3)[N+](=O)[O-]	BroadT	BRD-A36835536	BRD-A36835536-003-11-0	Prestwick Chemical Inc.	Prestw-383		Cl	COC(=O)C1C(c2cccc(c2)[N+]([O-])=O)C(C(=O)OCCN(C)Cc2ccccc2)=C(C)N=C1C.Cl	InChI=1S/C26H29N3O6.ClH/c1-17-22(25(30)34-4)24(20-11-8-12-21(15-20)29(32)33)23(18(2)27-17)26(31)35-14-13-28(3)16-19-9-6-5-7-10-19;/h5-12,15,22,24H,13-14,16H2,1-4H3;1H	GLGDXTNYLZNYPR-UHFFFAOYSA-N	479.205635678							104045
1-(3-Pyridin-4-yl-4-oxa-1,2-diaza-spiro[4.6]undec-2-en-1-yl)-ethanone	LSM-27591	SID14724828, BRD-K42279422	600088	InChI=1S/C15H19N3O2/c1-12(19)18-15(8-4-2-3-5-9-15)20-14(17-18)13-6-10-16-11-7-13/h6-7,10-11H,2-5,8-9H2,1H3	DACIUTKLQUZGRE-UHFFFAOYSA-N	CC(=O)N1N=C(OC12CCCCCC2)c3ccncc3	BroadT	BRD-K42279422	BRD-K42279422-001-05-4	Asinex Ltd.	BAS 03194176			CC(=O)N1N=C(OC11CCCCCC1)c1ccncc1	InChI=1S/C15H19N3O2/c1-12(19)18-15(8-4-2-3-5-9-15)20-14(17-18)13-6-10-16-11-7-13/h6-7,10-11H,2-5,8-9H2,1H3	DACIUTKLQUZGRE-UHFFFAOYSA-N	273.147726878							116135
AC1N1QIM	LSM-27592	BRD-K57379878	4034542	InChI=1S/C17H20N4OS2/c22-16(12-6-7-12)20-18-11-14-15(13-5-4-10-23-13)19-17(24-14)21-8-2-1-3-9-21/h4-5,10-12H,1-3,6-9H2,(H,20,22)	ACSNUPGSJBXXDR-UHFFFAOYSA-N	O=C(NN=Cc1sc(nc1c2cccs2)N3CCCCC3)C4CC4	BroadT	BRD-K57379878	BRD-K57379878-001-05-3	Enamine Ltd.	T5248445			O=C(NN=Cc1sc(nc1-c1cccs1)N1CCCCC1)C1CC1	InChI=1S/C17H20N4OS2/c22-16(12-6-7-12)20-18-11-14-15(13-5-4-10-23-13)19-17(24-14)21-8-2-1-3-9-21/h4-5,10-12H,1-3,6-9H2,(H,20,22)	ACSNUPGSJBXXDR-UHFFFAOYSA-N	360.10785268							116136
MLS000409077	LSM-44213	SID17516467, BRD-K85063951	5917350	InChI=1S/C21H20N4O4/c1-29-20-7-3-2-6-18(20)23-21(26)16(14-22)12-15-13-17(25(27)28)8-9-19(15)24-10-4-5-11-24/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H,23,26)/b16-12+	OUUMZOOASRSWGE-FOWTUZBSSA-N	COc1ccccc1NC(=O)\C(=C\c2cc(ccc2N3CCCC3)[N+](=O)[O-])\C#N	BroadT	BRD-K85063951	BRD-K85063951-001-06-7	Enamine Ltd.	T0517-0914			COc1ccccc1NC(=O)C(=C\c1cc(ccc1N1CCCC1)[N+]([O-])=O)\C#N	InChI=1S/C21H20N4O4/c1-29-20-7-3-2-6-18(20)23-21(26)16(14-22)12-15-13-17(25(27)28)8-9-19(15)24-10-4-5-11-24/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H,23,26)/b16-12+	OUUMZOOASRSWGE-FOWTUZBSSA-N	392.14845516							
AC1NJ7J2	LSM-27594	SID24835023, BRD-K13643355	4817366	InChI=1S/C14H12FN3O4/c1-9-2-7-12(14(16-9)18(20)21)22-8-13(19)17-11-5-3-10(15)4-6-11/h2-7H,8H2,1H3,(H,17,19)	GPNIDDVDNAYOHE-UHFFFAOYSA-N	Cc1ccc(OCC(=O)Nc2ccc(F)cc2)c(n1)[N+](=O)[O-]	BroadT	BRD-K13643355	BRD-K13643355-001-05-7	Enamine Ltd.	ZT-9514378			Cc1ccc(OCC(=O)Nc2ccc(F)cc2)c(n1)[N+]([O-])=O	InChI=1S/C14H12FN3O4/c1-9-2-7-12(14(16-9)18(20)21)22-8-13(19)17-11-5-3-10(15)4-6-11/h2-7H,8H2,1H3,(H,17,19)	GPNIDDVDNAYOHE-UHFFFAOYSA-N	305.081184094							116138
BRD-K23168519	LSM-27595			InChI=1S/C24H20N4O4S/c1-32-19-6-4-5-17(15-19)23(29)13-14-25-18-9-11-20(12-10-18)33(30,31)28-24-16-26-21-7-2-3-8-22(21)27-24/h2-12,14-16H,13H2,1H3,(H,27,28)	XTIYLNTXJFRJPN-UHFFFAOYSA-N	COc1cccc(c1)C(=O)CC=Nc2ccc(cc2)S(=O)(=O)Nc3cnc4ccccc4n3	BroadT	BRD-K23168519	BRD-K23168519-001-05-6	ChemBridge Corporation	6502495			COc1cccc(c1)C(=O)CC=Nc1ccc(cc1)S(=O)(=O)Nc1cnc2ccccc2n1	InChI=1S/C24H20N4O4S/c1-32-19-6-4-5-17(15-19)23(29)13-14-25-18-9-11-20(12-10-18)33(30,31)28-24-16-26-21-7-2-3-8-22(21)27-24/h2-12,14-16H,13H2,1H3,(H,27,28)	XTIYLNTXJFRJPN-UHFFFAOYSA-N	460.12052585							116139
SMR000034514	LSM-27596	SID857481, BRD-A06283479	658832	InChI=1S/C12H17N3O2S2/c1-2-5-15-10(13)9(19-12(15)18)11(16)14-7-8-4-3-6-17-8/h2,8H,1,3-7,13H2,(H,14,16)	LBMHYUPARPBHQJ-UHFFFAOYSA-N	NC1=C(SC(=S)N1CC=C)C(=O)NCC2CCCO2	BroadT	BRD-A06283479	BRD-A06283479-001-05-4	InterBioScreen Ltd.	STOCK1S-69251			Nc1c(sc(=S)n1CC=C)C(=O)NCC1CCCO1	InChI=1S/C12H17N3O2S2/c1-2-5-15-10(13)9(19-12(15)18)11(16)14-7-8-4-3-6-17-8/h2,8H,1,3-7,13H2,(H,14,16)	LBMHYUPARPBHQJ-UHFFFAOYSA-N	299.076218194							116140
MLS000568870	LSM-27597	SID14746965, BRD-K68564092	2449572	InChI=1S/C19H17N3O2/c1-21-18(23)16-9-5-4-8-15(16)17(20-21)19(24)22-11-10-13-6-2-3-7-14(13)12-22/h2-9H,10-12H2,1H3	CLGCYKSLIGYXRS-UHFFFAOYSA-N	CN1N=C(C(=O)N2CCc3ccccc3C2)c4ccccc4C1=O	BroadT	BRD-K68564092	BRD-K68564092-001-05-7	Enamine Ltd.	T0518-1899			Cn1nc(C(=O)N2CCc3ccccc3C2)c2ccccc2c1=O	InChI=1S/C19H17N3O2/c1-21-18(23)16-9-5-4-8-15(16)17(20-21)19(24)22-11-10-13-6-2-3-7-14(13)12-22/h2-9H,10-12H2,1H3	CLGCYKSLIGYXRS-UHFFFAOYSA-N	319.132076814							116141
T0514-5371	LSM-27598	SID24835038, BRD-A95399037	4566826	InChI=1S/C27H25N3O5/c1-34-21-10-8-18(9-11-21)24-15-23(20-7-6-17-4-2-3-5-19(17)14-20)29-30(24)26(32)16-35-27(33)22-12-13-25(31)28-22/h2-11,14,22,24H,12-13,15-16H2,1H3,(H,28,31)	XOUYFUQKZSEUQZ-UHFFFAOYSA-N	COc1ccc(cc1)C2CC(=NN2C(=O)COC(=O)C3CCC(=O)N3)c4ccc5ccccc5c4	BroadT	BRD-A95399037	BRD-A95399037-001-06-3	Enamine Ltd.	T0514-5371			COc1ccc(cc1)C1CC(=NN1C(=O)COC(=O)C1CCC(=O)N1)c1ccc2ccccc2c1	InChI=1S/C27H25N3O5/c1-34-21-10-8-18(9-11-21)24-15-23(20-7-6-17-4-2-3-5-19(17)14-20)29-30(24)26(32)16-35-27(33)22-12-13-25(31)28-22/h2-11,14,22,24H,12-13,15-16H2,1H3,(H,28,31)	XOUYFUQKZSEUQZ-UHFFFAOYSA-N	471.17942093							116142
N-[2-(2,3-Dihydro-indole-1-carbonyl)-phenyl]-acetamide	LSM-27599	SID845043, BRD-K61377358	647381	InChI=1S/C17H16N2O2/c1-12(20)18-15-8-4-3-7-14(15)17(21)19-11-10-13-6-2-5-9-16(13)19/h2-9H,10-11H2,1H3,(H,18,20)	RVKPHFXIULALBT-UHFFFAOYSA-N	CC(=O)Nc1ccccc1C(=O)N2CCc3ccccc23	BroadT	BRD-K61377358	BRD-K61377358-001-05-0	Asinex Ltd.	BAS 00854362			CC(=O)Nc1ccccc1C(=O)N1CCc2ccccc12	InChI=1S/C17H16N2O2/c1-12(20)18-15-8-4-3-7-14(15)17(21)19-11-10-13-6-2-5-9-16(13)19/h2-9H,10-11H2,1H3,(H,18,20)	RVKPHFXIULALBT-UHFFFAOYSA-N	280.121177772							116143
STK074332	LSM-27600	SID24807097, BRD-K55000729	844733	InChI=1S/C12H9N5O2S/c1-16-12(14-11(15-16)17(18)19)20-9-6-2-4-8-5-3-7-13-10(8)9/h2-7H,1H3	GHHDGOWHHDYBAW-UHFFFAOYSA-N	Cn1nc(nc1Sc2cccc3cccnc23)[N+](=O)[O-]	BroadT	BRD-K55000729	BRD-K55000729-001-08-2	Asinex Ltd.	BAS 03295972			Cn1nc(nc1Sc1cccc2cccnc12)[N+]([O-])=O	InChI=1S/C12H9N5O2S/c1-16-12(14-11(15-16)17(18)19)20-9-6-2-4-8-5-3-7-13-10(8)9/h2-7H,1H3	GHHDGOWHHDYBAW-UHFFFAOYSA-N	287.047695268							116144
STK619554	LSM-27601	SID862144, BRD-K18295153	663370	InChI=1S/C18H17N3O3/c1-21(18(23)12-5-7-19-8-6-12)11-14-9-13-10-15(24-2)3-4-16(13)20-17(14)22/h3-10H,11H2,1-2H3,(H,20,22)	YUMYPBDOPOHTHJ-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(C)C(=O)c3ccncc3)cc2c1	BroadT	BRD-K18295153	BRD-K18295153-001-05-5	InterBioScreen Ltd.	STOCK4S-33537			COc1ccc2nc(O)c(CN(C)C(=O)c3ccncc3)cc2c1	InChI=1S/C18H17N3O3/c1-21(18(23)12-5-7-19-8-6-12)11-14-9-13-10-15(24-2)3-4-16(13)20-17(14)22/h3-10H,11H2,1-2H3,(H,20,22)	YUMYPBDOPOHTHJ-UHFFFAOYSA-N	323.126991434							116145
F2019-0939	LSM-15404	BRD-K78574379	7208771	InChI=1S/C21H24ClN3O2S/c1-15-6-4-7-18-20(15)23-21(28-18)25(13-5-12-24(2)3)19(26)14-27-17-10-8-16(22)9-11-17/h4,6-11H,5,12-14H2,1-3H3	MLQBEUZAAKBBBK-UHFFFAOYSA-N	CN(C)CCCN(C(=O)COc1ccc(Cl)cc1)c2nc3c(C)cccc3s2	BroadT	BRD-K78574379	BRD-K78574379-003-05-4	Life Chemicals Inc.	F2019-0939		Cl	CN(C)CCCN(C(=O)COc1ccc(Cl)cc1)c1nc2c(C)cccc2s1.Cl	InChI=1S/C21H24ClN3O2S.ClH/c1-15-6-4-7-18-20(15)23-21(28-18)25(13-5-12-24(2)3)19(26)14-27-17-10-8-16(22)9-11-17;/h4,6-11H,5,12-14H2,1-3H3;1H	CBOGQWQGEIKNHF-UHFFFAOYSA-N	417.127775438							104046, 104046
STK276697	LSM-27602	SID4263811, BRD-K86641584	891301	InChI=1S/C17H16N2O4/c1-2-7-19-16(21)13-6-5-11(9-14(13)17(19)22)15(20)18-10-12-4-3-8-23-12/h3-6,8-9H,2,7,10H2,1H3,(H,18,20)	KLAKTBJHBDQVEA-UHFFFAOYSA-N	CCCN1C(=O)c2ccc(cc2C1=O)C(=O)NCc3occc3	BroadT	BRD-K86641584	BRD-K86641584-001-05-6	ChemBridge Corporation	7474377			CCCN1C(=O)c2ccc(cc2C1=O)C(=O)NCc1ccco1	InChI=1S/C17H16N2O4/c1-2-7-19-16(21)13-6-5-11(9-14(13)17(19)22)15(20)18-10-12-4-3-8-23-12/h3-6,8-9H,2,7,10H2,1H3,(H,18,20)	KLAKTBJHBDQVEA-UHFFFAOYSA-N	312.111007012							116146
N,N-Dibutyl-2-(pyridin-4-yl)quinazolin-4-amine	LSM-27603	SID26659234, BRD-K99435890	1926906	InChI=1S/C21H26N4/c1-3-5-15-25(16-6-4-2)21-18-9-7-8-10-19(18)23-20(24-21)17-11-13-22-14-12-17/h7-14H,3-6,15-16H2,1-2H3	OWFJNGOIGZRDRD-UHFFFAOYSA-N	CCCCN(CCCC)c1nc(nc2ccccc12)c3ccncc3	BroadT	BRD-K99435890	BRD-K99435890-001-06-5	InterBioScreen Ltd.	STOCK2S-56310			CCCCN(CCCC)c1nc(nc2ccccc12)-c1ccncc1	InChI=1S/C21H26N4/c1-3-5-15-25(16-6-4-2)21-18-9-7-8-10-19(18)23-20(24-21)17-11-13-22-14-12-17/h7-14H,3-6,15-16H2,1-2H3	OWFJNGOIGZRDRD-UHFFFAOYSA-N	334.215746872							116147
AC1MGHBW	LSM-27604	SID24795848, BRD-K97315384	2935904	InChI=1S/C14H12N4O4/c15-14(11-5-3-7-16-9-11)17-22-13(19)8-10-4-1-2-6-12(10)18(20)21/h1-7,9H,8H2,(H2,15,17)	ZNIFCGNLDPWOHO-UHFFFAOYSA-N	NC(=NOC(=O)Cc1ccccc1[N+](=O)[O-])c2cccnc2	BroadT	BRD-K97315384	BRD-K97315384-001-07-2	ChemBridge Corporation	7344042			NC(=NOC(=O)Cc1ccccc1[N+]([O-])=O)c1cccnc1	InChI=1S/C14H12N4O4/c15-14(11-5-3-7-16-9-11)17-22-13(19)8-10-4-1-2-6-12(10)18(20)21/h1-7,9H,8H2,(H2,15,17)	ZNIFCGNLDPWOHO-UHFFFAOYSA-N	300.085854904							116148
N-[2-(2-Ethyl-2H-tetrazol-5-yl)-phenyl]-4-tetrazol-1-yl-benzamide	LSM-27605	SID849001, BRD-K14259424	651467	InChI=1S/C17H15N9O/c1-2-26-21-16(20-23-26)14-5-3-4-6-15(14)19-17(27)12-7-9-13(10-8-12)25-11-18-22-24-25/h3-11H,2H2,1H3,(H,19,27)	XOGCPQKIXHFAQN-UHFFFAOYSA-N	CCn1nnc(n1)c2ccccc2NC(=O)c3ccc(cc3)n4cnnn4	BroadT	BRD-K14259424	BRD-K14259424-001-05-8	Asinex Ltd.	ASN 05018166			CCn1nnc(n1)-c1ccccc1NC(=O)c1ccc(cc1)-n1cnnn1	InChI=1S/C17H15N9O/c1-2-26-21-16(20-23-26)14-5-3-4-6-15(14)19-17(27)12-7-9-13(10-8-12)25-11-18-22-24-25/h3-11H,2H2,1H3,(H,19,27)	XOGCPQKIXHFAQN-UHFFFAOYSA-N	361.13995619							116149
T5230605	LSM-44214	SID22402889, BRD-K07985176	2097776	InChI=1S/C15H15NO5/c17-14(16-11-3-4-11)8-19-15(18)6-2-10-1-5-12-13(7-10)21-9-20-12/h1-2,5-7,11H,3-4,8-9H2,(H,16,17)/b6-2+	CWEMYEUMTPISEA-QHHAFSJGSA-N	O=C(COC(=O)\C=C\c1ccc2OCOc2c1)NC3CC3	BroadT	BRD-K07985176	BRD-K07985176-001-05-7	Enamine Ltd.	T5230605			O=C(COC(=O)\C=C\c1ccc2OCOc2c1)NC1CC1	InChI=1S/C15H15NO5/c17-14(16-11-3-4-11)8-19-15(18)6-2-10-1-5-12-13(7-10)21-9-20-12/h1-2,5-7,11H,3-4,8-9H2,(H,16,17)/b6-2+	CWEMYEUMTPISEA-QHHAFSJGSA-N	289.09502259							
AC1LLNL6	LSM-27607	SID49728348, BRD-K16134892	54679611	InChI=1S/C19H16ClN3O4/c1-2-23-14-10-6-4-8-12(14)16(24)15(19(23)27)18(26)22-21-17(25)11-7-3-5-9-13(11)20/h3-10,24H,2H2,1H3,(H,21,25)(H,22,26)	VGEMDDJFIFVZLI-UHFFFAOYSA-N	CCN1C(=O)C(=C(O)c2ccccc12)C(=O)NNC(=O)c3ccccc3Cl	BroadT	BRD-K16134892	BRD-K16134892-001-05-4	Asinex Ltd.	BAS 00693327			CCn1c2ccccc2c(O)c(C(=O)NNC(=O)c2ccccc2Cl)c1=O	InChI=1S/C19H16ClN3O4/c1-2-23-14-10-6-4-8-12(14)16(24)15(19(23)27)18(26)22-21-17(25)11-7-3-5-9-13(11)20/h3-10,24H,2H2,1H3,(H,21,25)(H,22,26)	VGEMDDJFIFVZLI-UHFFFAOYSA-N	385.082933732							116151
3-[(2,5-Dimethyl-furan-3-carbonyl)-amino]-benzoic acid	LSM-27608	SID16952899, BRD-K07146076	798035	InChI=1S/C14H13NO4/c1-8-6-12(9(2)19-8)13(16)15-11-5-3-4-10(7-11)14(17)18/h3-7H,1-2H3,(H,15,16)(H,17,18)	MRKCFCRNCNACNW-UHFFFAOYSA-N	Cc1oc(C)c(c1)C(=O)Nc2cccc(c2)C(=O)O	BroadT	BRD-K07146076	BRD-K07146076-001-05-7	Asinex Ltd.	BAS 01983546			Cc1cc(C(=O)Nc2cccc(c2)C(O)=O)c(C)o1	InChI=1S/C14H13NO4/c1-8-6-12(9(2)19-8)13(16)15-11-5-3-4-10(7-11)14(17)18/h3-7H,1-2H3,(H,15,16)(H,17,18)	MRKCFCRNCNACNW-UHFFFAOYSA-N	259.084457906							116152
T5478267	LSM-27609	BRD-K26628264	2160945	InChI=1S/C22H20N4O5/c1-4-30-22(29)15-12-14-18(23-17-9-5-6-10-25(17)21(14)28)26(13(2)3)19(15)24-20(27)16-8-7-11-31-16/h5-13H,4H2,1-3H3	JJNKNLVOAKBURU-UHFFFAOYSA-N	CCOC(=O)C1=CC2=C(N=C3C=CC=CN3C2=O)N(C(C)C)C1=NC(=O)c4occc4	BroadT	BRD-K26628264	BRD-K26628264-001-05-3	ChemDiv Inc.	C098-0198			CCOC(=O)c1cc2c(nc3ccccn3c2=O)n(C(C)C)c1=NC(=O)c1ccco1	InChI=1S/C22H20N4O5/c1-4-30-22(29)15-12-14-18(23-17-9-5-6-10-25(17)21(14)28)26(13(2)3)19(15)24-20(27)16-8-7-11-31-16/h5-13H,4H2,1-3H3	JJNKNLVOAKBURU-UHFFFAOYSA-N	420.14336978							116153
AC1NEEQ6	LSM-27610	SID22405587, BRD-K20324289	4641095	InChI=1S/C21H21N3O5/c1-13-5-10-20(21(22-13)24(26)27)29-12-19(25)18-11-14(2)23(15(18)3)16-6-8-17(28-4)9-7-16/h5-11H,12H2,1-4H3	UESVFZUIBJDQDX-UHFFFAOYSA-N	COc1ccc(cc1)n2c(C)cc(C(=O)COc3ccc(C)nc3[N+](=O)[O-])c2C	BroadT	BRD-K20324289	BRD-K20324289-001-05-6	Enamine Ltd.	T5260076			COc1ccc(cc1)-n1c(C)cc(C(=O)COc2ccc(C)nc2[N+]([O-])=O)c1C	InChI=1S/C21H21N3O5/c1-13-5-10-20(21(22-13)24(26)27)29-12-19(25)18-11-14(2)23(15(18)3)16-6-8-17(28-4)9-7-16/h5-11H,12H2,1-4H3	UESVFZUIBJDQDX-UHFFFAOYSA-N	395.148120802							116154
SMR000063576	LSM-27611	SID3711208, BRD-K03903304	2997546	InChI=1S/C24H19N5O2S/c1-30-20-14-12-19(13-15-20)29-22(17-8-4-2-5-9-17)26-28-24(29)32-16-21-25-27-23(31-21)18-10-6-3-7-11-18/h2-15H,16H2,1H3	YEKVYXVPJFEXRZ-UHFFFAOYSA-N	COc1ccc(cc1)n2c(SCc3oc(nn3)c4ccccc4)nnc2c5ccccc5	BroadT	BRD-K03903304	BRD-K03903304-001-05-9	Enamine Ltd.	T5248442			COc1ccc(cc1)-n1c(SCc2nnc(o2)-c2ccccc2)nnc1-c1ccccc1	InChI=1S/C24H19N5O2S/c1-30-20-14-12-19(13-15-20)29-22(17-8-4-2-5-9-17)26-28-24(29)32-16-21-25-27-23(31-21)18-10-6-3-7-11-18/h2-15H,16H2,1H3	YEKVYXVPJFEXRZ-UHFFFAOYSA-N	441.125945588							116155
AC1M0YYW	LSM-44215	BRD-K75593789	2085871	InChI=1S/C15H14N4O4S/c16-24(22,23)14-9-7-13(8-10-14)18-17-11-3-5-12-4-1-2-6-15(12)19(20)21/h1-11,18H,(H2,16,22,23)/b5-3+,17-11?	ORXCGXHVOYBNNM-OWJSUJKRSA-N	NS(=O)(=O)c1ccc(NN=C\C=C\c2ccccc2[N+](=O)[O-])cc1	BroadT	BRD-K75593789	BRD-K75593789-001-05-5	Enamine Ltd.	T5263389			NS(=O)(=O)c1ccc(NN=C\C=C\c2ccccc2[N+]([O-])=O)cc1	InChI=1S/C15H14N4O4S/c16-24(22,23)14-9-7-13(8-10-14)18-17-11-3-5-12-4-1-2-6-15(12)19(20)21/h1-11,18H,(H2,16,22,23)/b5-3+,17-11?	ORXCGXHVOYBNNM-OWJSUJKRSA-N	346.073575658							
2-(1-Ethyl-1H-pyrazol-4-yl)quinoline-4-carboxylic acid	LSM-27613	SID24787247, BRD-K46341909	6485380	InChI=1S/C15H13N3O2/c1-2-18-9-10(8-16-18)14-7-12(15(19)20)11-5-3-4-6-13(11)17-14/h3-9H,2H2,1H3,(H,19,20)	RISILWSTJFAVEB-UHFFFAOYSA-N	CCn1cc(cn1)c2cc(C(=O)O)c3ccccc3n2	BroadT	BRD-K46341909	BRD-K46341909-001-05-0	Asinex Ltd.	BAS 13527882			CCn1cc(cn1)-c1cc(C(O)=O)c2ccccc2n1	InChI=1S/C15H13N3O2/c1-2-18-9-10(8-16-18)14-7-12(15(19)20)11-5-3-4-6-13(11)17-14/h3-9H,2H2,1H3,(H,19,20)	RISILWSTJFAVEB-UHFFFAOYSA-N	267.100776686							116157
MLS001223764	LSM-27614	SID49823407, BRD-K63164588	1245654	InChI=1S/C15H16N2O2S/c1-3-10-9(2)20-8-12(10)15(19)17-13-7-5-4-6-11(13)14(16)18/h4-8H,3H2,1-2H3,(H2,16,18)(H,17,19)	LGZNBPWXFGDHNY-UHFFFAOYSA-N	CCc1c(C)scc1C(=O)Nc2ccccc2C(=O)N	BroadT	BRD-K63164588	BRD-K63164588-001-06-0	Chemical Technologies & Investigations	UZI/4004903			CCc1c(C)scc1C(=O)Nc1ccccc1C(N)=O	InChI=1S/C15H16N2O2S/c1-3-10-9(2)20-8-12(10)15(19)17-13-7-5-4-6-11(13)14(16)18/h4-8H,3H2,1-2H3,(H2,16,18)(H,17,19)	LGZNBPWXFGDHNY-UHFFFAOYSA-N	288.093248462							116158
MLS000539065	LSM-27615	SID17387164, BRD-A99440046	4885570	InChI=1S/C19H17N3O4S/c1-12(26-15-9-8-13-5-2-3-6-14(13)11-15)17(23)21-22-19(27)20-18(24)16-7-4-10-25-16/h2-12H,1H3,(H,21,23)(H2,20,22,24,27)	QKKQANBQYRPLBU-UHFFFAOYSA-N	CC(Oc1ccc2ccccc2c1)C(=O)NNC(=S)NC(=O)c3occc3	BroadT	BRD-A99440046	BRD-A99440046-001-06-0	Specs	AK-968/40215964			CC(Oc1ccc2ccccc2c1)C(=O)NNC(=S)NC(=O)c1ccco1	InChI=1S/C19H17N3O4S/c1-12(26-15-9-8-13-5-2-3-6-14(13)11-15)17(23)21-22-19(27)20-18(24)16-7-4-10-25-16/h2-12H,1H3,(H,21,23)(H2,20,22,24,27)	QKKQANBQYRPLBU-UHFFFAOYSA-N	383.093976744							116159
1-[[5-Methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl]-n-(pyridin-3-ylmethyl)piperidine-4-carboxamide	LSM-27616	BRD-K53354260, SID4250380	3244199	InChI=1S/C24H28N4O2/c1-17-6-3-4-8-21(17)24-27-22(18(2)30-24)16-28-12-9-20(10-13-28)23(29)26-15-19-7-5-11-25-14-19/h3-8,11,14,20H,9-10,12-13,15-16H2,1-2H3,(H,26,29)	ZZFWKQIIXGUOMU-UHFFFAOYSA-N	Cc1oc(nc1CN2CCC(CC2)C(=O)NCc3cccnc3)c4ccccc4C	BroadT	BRD-K53354260	BRD-K53354260-001-05-6	ChemDiv Inc.	C522-0837			Cc1oc(nc1CN1CCC(CC1)C(=O)NCc1cccnc1)-c1ccccc1C	InChI=1S/C24H28N4O2/c1-17-6-3-4-8-21(17)24-27-22(18(2)30-24)16-28-12-9-20(10-13-28)23(29)26-15-19-7-5-11-25-14-19/h3-8,11,14,20H,9-10,12-13,15-16H2,1-2H3,(H,26,29)	ZZFWKQIIXGUOMU-UHFFFAOYSA-N	404.221226176							116160
T5337223	LSM-44216	SID24828317, BRD-K84810548	6224263	InChI=1S/C28H28N4O/c33-27(24-13-5-2-6-14-24)22-32-26-16-8-7-15-25(26)29-28(32)31-20-18-30(19-21-31)17-9-12-23-10-3-1-4-11-23/h1-16H,17-22H2/b12-9+	OKFKHUSURYSPGT-FMIVXFBMSA-N	O=C(Cn1c(nc2ccccc12)N3CCN(C\C=C\c4ccccc4)CC3)c5ccccc5	BroadT	BRD-K84810548	BRD-K84810548-001-03-9	Enamine Ltd.	T5337223			O=C(Cn1c(nc2ccccc12)N1CCN(C\C=C\c2ccccc2)CC1)c1ccccc1	InChI=1S/C28H28N4O/c33-27(24-13-5-2-6-14-24)22-32-26-16-8-7-15-25(26)29-28(32)31-20-18-30(19-21-31)17-9-12-23-10-3-1-4-11-23/h1-16H,17-22H2/b12-9+	OKFKHUSURYSPGT-FMIVXFBMSA-N	436.226311556							
MLS000040641	LSM-27618	SID861750, BRD-K63519112	662981	InChI=1S/C16H21N5O3/c1-4-24-15(22)13-10-17-16(21-12(3)9-11(2)19-21)18-14(13)20-5-7-23-8-6-20/h9-10H,4-8H2,1-3H3	FRRWFMKLNVJHMR-UHFFFAOYSA-N	CCOC(=O)c1cnc(nc1N2CCOCC2)n3nc(C)cc3C	BroadT	BRD-K63519112	BRD-K63519112-001-05-2	InterBioScreen Ltd.	STOCK4S-19002			CCOC(=O)c1cnc(nc1N1CCOCC1)-n1nc(C)cc1C	InChI=1S/C16H21N5O3/c1-4-24-15(22)13-10-17-16(21-12(3)9-11(2)19-21)18-14(13)20-5-7-23-8-6-20/h9-10H,4-8H2,1-3H3	FRRWFMKLNVJHMR-UHFFFAOYSA-N	331.164439582							116162
AC1N0GE9	LSM-27619	SID24826819, BRD-K59757588	3916633	InChI=1S/C24H23N3O4/c1-4-16-20(24(29)30-5-2)22(26-18-12-8-7-11-17(18)25-16)27-23(28)21-14(3)15-10-6-9-13-19(15)31-21/h6-13,26H,4-5H2,1-3H3,(H,27,28)	ZQSSGSJKVVJJMP-UHFFFAOYSA-N	CCOC(=O)C1=C(NC(=O)c2oc3ccccc3c2C)Nc4ccccc4N=C1CC	BroadT	BRD-K59757588	BRD-K59757588-001-05-9	Enamine Ltd.	T0518-8520			CCOC(=O)C1=C(NC(=O)c2oc3ccccc3c2C)Nc2ccccc2N=C1CC	InChI=1S/C24H23N3O4/c1-4-16-20(24(29)30-5-2)22(26-18-12-8-7-11-17(18)25-16)27-23(28)21-14(3)15-10-6-9-13-19(15)31-21/h6-13,26H,4-5H2,1-3H3,(H,27,28)	ZQSSGSJKVVJJMP-UHFFFAOYSA-N	417.168856246							
8-(1H-Indol-3-ylmethylidene)-6,10-dioxaspiro[4.5]decane-7,9-dione	LSM-27620	SID24808312, BRD-K75438609	745172	InChI=1S/C17H15NO4/c19-15-13(16(20)22-17(21-15)7-3-4-8-17)9-11-10-18-14-6-2-1-5-12(11)14/h1-2,5-6,9-10,18H,3-4,7-8H2	MJWHROGCWPIPKO-UHFFFAOYSA-N	O=C1OC2(CCCC2)OC(=O)C1=Cc3c[nH]c4ccccc34	BroadT	BRD-K75438609	BRD-K75438609-001-07-7	Asinex Ltd.	BAS 01346840			O=C1OC2(CCCC2)OC(=O)C1=Cc1c[nH]c2ccccc12	InChI=1S/C17H15NO4/c19-15-13(16(20)22-17(21-15)7-3-4-8-17)9-11-10-18-14-6-2-1-5-12(11)14/h1-2,5-6,9-10,18H,3-4,7-8H2	MJWHROGCWPIPKO-UHFFFAOYSA-N	297.10010797							116164
F1757-0256	LSM-27621	SID7974157, BRD-K51978335	1322658	InChI=1S/C14H20N2O3/c1-4-16(5-2)14(18)15-12-9-7-11(8-10-12)13(17)19-6-3/h7-10H,4-6H2,1-3H3,(H,15,18)	JYOKMVSFPCQOIO-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)N(CC)CC)cc1	BroadT	BRD-K51978335	BRD-K51978335-001-05-5	ChemBridge Corporation	7121368			CCOC(=O)c1ccc(NC(=O)N(CC)CC)cc1	InChI=1S/C14H20N2O3/c1-4-16(5-2)14(18)15-12-9-7-11(8-10-12)13(17)19-6-3/h7-10H,4-6H2,1-3H3,(H,15,18)	JYOKMVSFPCQOIO-UHFFFAOYSA-N	264.14739252							116165
MS-1404	LSM-27622	SID24822048, BRD-K38446720	4221181	InChI=1S/C8H6Cl2N2O2/c1-3-5(9)7(13)12-8(14)6(10)4(2)11(3)12/h1-2H3	KFPXZZNCTKCXSW-UHFFFAOYSA-N	CC1=C(Cl)C(=O)N2N1C(=C(Cl)C2=O)C	BroadT	BRD-K38446720	BRD-K38446720-001-05-4	Key Organics Ltd.	MS-1404			Cc1c(Cl)c(=O)n2n1c(C)c(Cl)c2=O	InChI=1S/C8H6Cl2N2O2/c1-3-5(9)7(13)12-8(14)6(10)4(2)11(3)12/h1-2H3	KFPXZZNCTKCXSW-UHFFFAOYSA-N	231.980632872							116166
ST038324	LSM-27623	SID14744006, BRD-K07069564	5374954	InChI=1S/C11H11N3O/c1-7-11(14-15)8(2)13-10-6-4-3-5-9(10)12-7/h3-6,15H,1-2H3	QDZRKMVGVOWFHT-UHFFFAOYSA-N	CC1=Nc2ccccc2N=C(C)C1=NO	BroadT	BRD-K07069564	BRD-K07069564-001-05-0	Enamine Ltd.	T0501-5473			Cc1nc2ccccc2nc(C)c1=NO	InChI=1S/C11H11N3O/c1-7-11(14-15)8(2)13-10-6-4-3-5-9(10)12-7/h3-6,15H,1-2H3	QDZRKMVGVOWFHT-UHFFFAOYSA-N	201.090212002							
2-(Benzooxazol-2-ylsulfanyl)-propionic acid	LSM-27624	SID842324, BRD-A39464762	644583	InChI=1S/C10H9NO3S/c1-6(9(12)13)15-10-11-7-4-2-3-5-8(7)14-10/h2-6H,1H3,(H,12,13)	MWCCDEDKPAULRG-UHFFFAOYSA-N	CC(Sc1oc2ccccc2n1)C(=O)O	BroadT	BRD-A39464762	BRD-A39464762-001-05-7	Asinex Ltd.	BAS 10119821			CC(Sc1nc2ccccc2o1)C(O)=O	InChI=1S/C10H9NO3S/c1-6(9(12)13)15-10-11-7-4-2-3-5-8(7)14-10/h2-6H,1H3,(H,12,13)	MWCCDEDKPAULRG-UHFFFAOYSA-N	223.030313848							116168
ZINC02881085	LSM-27625	SID24786274, BRD-K73629966	2233288	InChI=1S/C20H19NO5S/c1-25-19(23)16-11-21(10-15-7-4-8-27-15)12-17(20(24)26-2)18(16)13-5-3-6-14(22)9-13/h3-9,11-12,18,22H,10H2,1-2H3	SFTXZAQSIAHULA-UHFFFAOYSA-N	COC(=O)C1=CN(Cc2cccs2)C=C(C1c3cccc(O)c3)C(=O)OC	BroadT	BRD-K73629966	BRD-K73629966-001-05-4	ChemBridge Corporation	7970020			COC(=O)C1=CN(Cc2cccs2)C=C(C1c1cccc(O)c1)C(=O)OC	InChI=1S/C20H19NO5S/c1-25-19(23)16-11-21(10-15-7-4-8-27-15)12-17(20(24)26-2)18(16)13-5-3-6-14(22)9-13/h3-9,11-12,18,22H,10H2,1-2H3	SFTXZAQSIAHULA-UHFFFAOYSA-N	385.098393408							116169
4-[4-(3-Methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]morpholine	LSM-27626	SID4249273, BRD-K95631895	2052768	InChI=1S/C16H16F3N3O2/c1-23-12-4-2-3-11(9-12)13-10-14(16(17,18)19)21-15(20-13)22-5-7-24-8-6-22/h2-4,9-10H,5-8H2,1H3	YEQOIPOXVQAWPR-UHFFFAOYSA-N	COc1cccc(c1)c2cc(nc(n2)N3CCOCC3)C(F)(F)F	BroadT	BRD-K95631895	BRD-K95631895-001-05-0	ChemDiv Inc.	C130-0305			COc1cccc(c1)-c1cc(nc(n1)N1CCOCC1)C(F)(F)F	InChI=1S/C16H16F3N3O2/c1-23-12-4-2-3-11(9-12)13-10-14(16(17,18)19)21-15(20-13)22-5-7-24-8-6-22/h2-4,9-10H,5-8H2,1H3	YEQOIPOXVQAWPR-UHFFFAOYSA-N	339.119461382							116170
AC1N3UFG	LSM-27627	BRD-M57109082	4070687	InChI=1S/C19H18N4O5/c1-11-16(18(24)21-13-8-4-6-10-15(13)28-2)17(22-19(25)20-11)12-7-3-5-9-14(12)23(26)27/h3-10,17H,1-2H3,(H,21,24)(H2,20,22,25)	MBTBTBVNWMKAEK-UHFFFAOYSA-N	COc1ccccc1NC(=O)C2=C(C)NC(=O)NC2c3ccccc3[N+](=O)[O-]	BroadT	BRD-M57109082	BRD-M57109082-001-05-4	Enamine Ltd.	T0511-7011		CN(C)C=O.COc1ccccc1NC(=O)C1=C(C)NC(=O)NC1c1ccccc1[N+]([O-])=O	CN(C)C=O.COc1ccccc1NC(=O)C1=C(C)NC(=O)NC1c1ccccc1[N+]([O-])=O	InChI=1S/C19H18N4O5.C3H7NO/c1-11-16(18(24)21-13-8-4-6-10-15(13)28-2)17(22-19(25)20-11)12-7-3-5-9-14(12)23(26)27;1-4(2)3-5/h3-10,17H,1-2H3,(H,21,24)(H2,20,22,25);3H,1-2H3	WUJVOOZWVXXYRS-UHFFFAOYSA-N	382.127719716							116171
STK275266	LSM-27628	SID14736443, BRD-K63517890	897256	InChI=1S/C16H14O4/c1-19-16(18)13-7-9-14(10-8-13)20-11-15(17)12-5-3-2-4-6-12/h2-10H,11H2,1H3	BCQXPIIOARROPF-UHFFFAOYSA-N	COC(=O)c1ccc(OCC(=O)c2ccccc2)cc1	BroadT	BRD-K63517890	BRD-K63517890-001-05-4	ChemBridge Corporation	7248383			COC(=O)c1ccc(OCC(=O)c2ccccc2)cc1	InChI=1S/C16H14O4/c1-19-16(18)13-7-9-14(10-8-13)20-11-15(17)12-5-3-2-4-6-12/h2-10H,11H2,1H3	BCQXPIIOARROPF-UHFFFAOYSA-N	270.089208928							116172
(1-Methanesulfonyl-piperidin-4-yl)-morpholin-4-yl-methanone	LSM-27629	SID844869, BRD-K11795918	647201	InChI=1S/C11H20N2O4S/c1-18(15,16)13-4-2-10(3-5-13)11(14)12-6-8-17-9-7-12/h10H,2-9H2,1H3	WNVPROALADAWPB-UHFFFAOYSA-N	CS(=O)(=O)N1CCC(CC1)C(=O)N2CCOCC2	BroadT	BRD-K11795918	BRD-K11795918-001-05-7	Asinex Ltd.	BAS 06051420			CS(=O)(=O)N1CCC(CC1)C(=O)N1CCOCC1	InChI=1S/C11H20N2O4S/c1-18(15,16)13-4-2-10(3-5-13)11(14)12-6-8-17-9-7-12/h10H,2-9H2,1H3	WNVPROALADAWPB-UHFFFAOYSA-N	276.11437783							116173
39181-40-3	LSM-27630	SID7976837, BRD-K20726747	676760	InChI=1S/C10H11N3S/c11-10-13-12-9(14-10)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,11,13)	HSTFNSVDVOLQQH-UHFFFAOYSA-N	Nc1nnc(CCc2ccccc2)s1	BroadT	BRD-K20726747	BRD-K20726747-001-05-8	ChemBridge Corporation	5315400			Nc1nnc(CCc2ccccc2)s1	InChI=1S/C10H11N3S/c11-10-13-12-9(14-10)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,11,13)	HSTFNSVDVOLQQH-UHFFFAOYSA-N	205.067368072							116174
T5273513	LSM-27631	SID14745038, BRD-A17082641	4647004	InChI=1S/C20H14BrNO4/c21-13-7-5-12(6-8-13)17-11-15(14-3-1-2-4-16(14)22-17)19(23)26-18-9-10-25-20(18)24/h1-8,11,18H,9-10H2	PDOHGSITFBKCRS-UHFFFAOYSA-N	Brc1ccc(cc1)c2cc(C(=O)OC3CCOC3=O)c4ccccc4n2	BroadT	BRD-A17082641	BRD-A17082641-001-05-0	Enamine Ltd.	T5273513			Brc1ccc(cc1)-c1cc(C(=O)OC2CCOC2=O)c2ccccc2n1	InChI=1S/C20H14BrNO4/c21-13-7-5-12(6-8-13)17-11-15(14-3-1-2-4-16(14)22-17)19(23)26-18-9-10-25-20(18)24/h1-8,11,18H,9-10H2	PDOHGSITFBKCRS-UHFFFAOYSA-N	411.010620538							116175
Urea, n-2-benzothiazolyl-n'-phenyl-	LSM-27632	SID24805936, BRD-K76713286	726342	InChI=1S/C14H11N3OS/c18-13(15-10-6-2-1-3-7-10)17-14-16-11-8-4-5-9-12(11)19-14/h1-9H,(H2,15,16,17,18)	LDFWEBWORFXBQN-UHFFFAOYSA-N	O=C(Nc1ccccc1)Nc2nc3ccccc3s2	BroadT	BRD-K76713286	BRD-K76713286-001-05-6	Asinex Ltd.	BAS 04914448			O=C(Nc1nc2ccccc2s1)Nc1ccccc1	InChI=1S/C14H11N3OS/c18-13(15-10-6-2-1-3-7-10)17-14-16-11-8-4-5-9-12(11)19-14/h1-9H,(H2,15,16,17,18)	LDFWEBWORFXBQN-UHFFFAOYSA-N	269.062282692							116176
T5226399	LSM-27633	SID22406325, BRD-K54146362	2079214	InChI=1S/C23H25N5OS/c1-15-10-11-17-18(12-15)25-22(24-17)30-14-21(29)26-20-13-19(23(2,3)4)27-28(20)16-8-6-5-7-9-16/h5-13H,14H2,1-4H3,(H,24,25)(H,26,29)	XDRIWAKGXCNRQY-UHFFFAOYSA-N	Cc1ccc2[nH]c(SCC(=O)Nc3cc(nn3c4ccccc4)C(C)(C)C)nc2c1	BroadT	BRD-K54146362	BRD-K54146362-001-05-2	Enamine Ltd.	T5226399			Cc1ccc2[nH]c(SCC(=O)Nc3cc(nn3-c3ccccc3)C(C)(C)C)nc2c1	InChI=1S/C23H25N5OS/c1-15-10-11-17-18(12-15)25-22(24-17)30-14-21(29)26-20-13-19(23(2,3)4)27-28(20)16-8-6-5-7-9-16/h5-13H,14H2,1-4H3,(H,24,25)(H,26,29)	XDRIWAKGXCNRQY-UHFFFAOYSA-N	419.17798116							116177
3-Benzo[1,3]dioxol-5-yl-1-(5-methyl-furan-2-yl)-propenone	LSM-44217	SID17408976, BRD-K40891589	5735380	InChI=1S/C15H12O4/c1-10-2-6-13(19-10)12(16)5-3-11-4-7-14-15(8-11)18-9-17-14/h2-8H,9H2,1H3/b5-3+	UQXMSWRHUCRNHF-HWKANZROSA-N	Cc1oc(cc1)C(=O)\C=C\c2ccc3OCOc3c2	BroadT	BRD-K40891589	BRD-K40891589-001-05-7	Asinex Ltd.	BAS 04239999			Cc1ccc(o1)C(=O)\C=C\c1ccc2OCOc2c1	InChI=1S/C15H12O4/c1-10-2-6-13(19-10)12(16)5-3-11-4-7-14-15(8-11)18-9-17-14/h2-8H,9H2,1H3/b5-3+	UQXMSWRHUCRNHF-HWKANZROSA-N	256.073558864							
5-(4-Methylphenyl)-1H-tetrazole	LSM-27635	SID3711340, BRD-K94695718	285164	InChI=1S/C8H8N4/c1-6-2-4-7(5-3-6)8-9-11-12-10-8/h2-5H,1H3,(H,9,10,11,12)	BCCJIAZPYBJASR-UHFFFAOYSA-N	Cc1ccc(cc1)c2nn[nH]n2	BroadT	BRD-K94695718	BRD-K94695718-001-06-9	Enamine Ltd.	T5247680			Cc1ccc(cc1)-c1nn[nH]n1	InChI=1S/C8H8N4/c1-6-2-4-7(5-3-6)8-9-11-12-10-8/h2-5H,1H3,(H,9,10,11,12)	BCCJIAZPYBJASR-UHFFFAOYSA-N	160.074896296							116179
ZINC00385108	LSM-27636	SID865205, BRD-K16578870	666455	InChI=1S/C14H10N4S/c1-9-15-16-14-18(9)17-13(19-14)12-8-4-6-10-5-2-3-7-11(10)12/h2-8H,1H3	OWOCCHTZYZJFRF-UHFFFAOYSA-N	Cc1nnc2sc(nn12)c3cccc4ccccc34	BroadT	BRD-K16578870	BRD-K16578870-001-05-8	InterBioScreen Ltd.	STOCK5S-38512			Cc1nnc2sc(nn12)-c1cccc2ccccc12	InChI=1S/C14H10N4S/c1-9-15-16-14-18(9)17-13(19-14)12-8-4-6-10-5-2-3-7-11(10)12/h2-8H,1H3	OWOCCHTZYZJFRF-UHFFFAOYSA-N	266.06261705							116180
SMR000156432	LSM-27637	SID17407482, BRD-K18805175	11958686	InChI=1S/C22H29N3O2/c1-3-25-21(27-2)18-5-4-17(9-19(18)24-25)20(26)23-13-22-10-14-6-15(11-22)8-16(7-14)12-22/h4-5,9,14-16H,3,6-8,10-13H2,1-2H3,(H,23,26)	MDTLAHMQZNZXSI-UHFFFAOYSA-N	CCn1nc2cc(ccc2c1OC)C(=O)NCC34CC5CC(CC(C5)C3)C4	BroadT	BRD-K18805175	BRD-K18805175-001-05-5	University of California at Davis	UCD_ADM_1-159			CCn1nc2cc(ccc2c1OC)C(=O)NCC12CC3CC(CC(C3)C1)C2	InChI=1S/C22H29N3O2/c1-3-25-21(27-2)18-5-4-17(9-19(18)24-25)20(26)23-13-22-10-14-6-15(11-22)8-16(7-14)12-22/h4-5,9,14-16H,3,6-8,10-13H2,1-2H3,(H,23,26)	MDTLAHMQZNZXSI-UHFFFAOYSA-N	367.225977198							116181
AC1LCRIH	LSM-27638	SID852249, BRD-A73031012	654865	InChI=1S/C13H15N5O2S/c1-8-6-15-9(7-14-8)11-16-17-13(21-11)18(2)12(19)10-4-3-5-20-10/h6-7,10H,3-5H2,1-2H3	JFXIUNONSAETHV-UHFFFAOYSA-N	CN(C(=O)C1CCCO1)c2nnc(s2)c3cnc(C)cn3	BroadT	BRD-A73031012	BRD-A73031012-001-05-9	Asinex Ltd.	ASN 09114456			CN(C(=O)C1CCCO1)c1nnc(s1)-c1cnc(C)cn1	InChI=1S/C13H15N5O2S/c1-8-6-15-9(7-14-8)11-16-17-13(21-11)18(2)12(19)10-4-3-5-20-10/h6-7,10H,3-5H2,1-2H3	JFXIUNONSAETHV-UHFFFAOYSA-N	305.09464546							116182
BAS 09529897	LSM-27639	SID4262770, BRD-K54573667	1093810	InChI=1S/C16H13N5O2/c1-10-3-5-11(6-4-10)14-7-13(20-23-14)16(22)19-15-12(8-17)9-18-21(15)2/h3-7,9H,1-2H3,(H,19,22)	FDDYPOTWBCFJKR-UHFFFAOYSA-N	Cc1ccc(cc1)c2onc(c2)C(=O)Nc3c(cnn3C)C#N	BroadT	BRD-K54573667	BRD-K54573667-001-05-9	ChemBridge Corporation	7957599			Cc1ccc(cc1)-c1cc(no1)C(=O)Nc1c(cnn1C)C#N	InChI=1S/C16H13N5O2/c1-10-3-5-11(6-4-10)14-7-13(20-23-14)16(22)19-15-12(8-17)9-18-21(15)2/h3-7,9H,1-2H3,(H,19,22)	FDDYPOTWBCFJKR-UHFFFAOYSA-N	307.106924706							116183
ST007035	LSM-27640	BRD-M59199604	3716403	InChI=1S/C17H13N5O4/c1-21-13(23)11-14(22(2)16(21)25)26-12(19)9(7-18)17(11)8-5-3-4-6-10(8)20-15(17)24/h3-6H,19H2,1-2H3,(H,20,24)	NWAXQIGOONAAQX-UHFFFAOYSA-N	CN1C(=O)N(C)C2=C(C1=O)C3(C(=O)Nc4ccccc34)C(=C(N)O2)C#N	BroadT	BRD-M59199604	BRD-M59199604-001-05-2	Specs	AG-205/36992120		CCO.Cn1c2OC(N)=C(C#N)C3(C(=O)Nc4ccccc34)c2c(=O)n(C)c1=O	CCO.Cn1c2OC(N)=C(C#N)C3(C(=O)Nc4ccccc34)c2c(=O)n(C)c1=O	InChI=1S/C17H13N5O4.C2H6O/c1-21-13(23)11-14(22(2)16(21)25)26-12(19)9(7-18)17(11)8-5-3-4-6-10(8)20-15(17)24;1-2-3/h3-6H,19H2,1-2H3,(H,20,24);3H,2H2,1H3	NUTBBQJVBIMZTE-UHFFFAOYSA-N	351.096753946							116184, 116184
AC1NLTBZ	LSM-27641	BRD-A09594699	4989611	InChI=1S/C14H14ClN7O2S/c15-8-4-2-1-3-7(8)12-18-20-21-22(12)10-5-9(17-19-14(16)25)13-23-6-11(10)24-13/h1-4,10-11,13H,5-6H2,(H3,16,19,25)	YBDDQEKCHZFQOA-UHFFFAOYSA-N	NC(=NN=C1CC(C2COC1O2)n3nnnc3c4ccccc4Cl)S	BroadT	BRD-A09594699	BRD-A09594699-001-06-3	ChemDiv Inc.	8015-2247			NC(S)=NN=C1CC(C2COC1O2)n1nnnc1-c1ccccc1Cl	InChI=1S/C14H14ClN7O2S/c15-8-4-2-1-3-7(8)12-18-20-21-22(12)10-5-9(17-19-14(16)25)13-23-6-11(10)24-13/h1-4,10-11,13H,5-6H2,(H3,16,19,25)	YBDDQEKCHZFQOA-UHFFFAOYSA-N	379.061821158							116185
AC1LZS28	LSM-44218	SID17514398, BRD-K76445846	1981782	InChI=1S/C24H20N4O3/c1-15(2)17-8-10-19(11-9-17)28-23(30)20(22(29)27-24(28)31)12-16-13-25-21(26-14-16)18-6-4-3-5-7-18/h3-15H,1-2H3,(H,27,29,31)/b20-12-	AGXWWAUSOBQQID-NDENLUEZSA-N	CC(C)c1ccc(cc1)N2C(=O)NC(=O)\C(=C\c3cnc(nc3)c4ccccc4)\C2=O	BroadT	BRD-K76445846	BRD-K76445846-001-05-8	InterBioScreen Ltd.	STOCK4S-19717			CC(C)c1ccc(cc1)N1C(=O)NC(=O)\C(=C\c2cnc(nc2)-c2ccccc2)C1=O	InChI=1S/C24H20N4O3/c1-15(2)17-8-10-19(11-9-17)28-23(30)20(22(29)27-24(28)31)12-16-13-25-21(26-14-16)18-6-4-3-5-7-18/h3-15H,1-2H3,(H,27,29,31)/b20-12-	AGXWWAUSOBQQID-NDENLUEZSA-N	412.15354054							
ST50766042	LSM-27643	SID4263380, BRD-A27660863	2974453	InChI=1S/C15H18N2O4S/c1-19-12-6-10-11(7-13(12)20-2)16-15(22)17(14(10)18)8-9-4-3-5-21-9/h6-7,9H,3-5,8H2,1-2H3,(H,16,22)	MWJZBNXOLWKWSA-UHFFFAOYSA-N	COc1cc2NC(=S)N(CC3CCCO3)C(=O)c2cc1OC	BroadT	BRD-A27660863	BRD-A27660863-001-05-2	ChemBridge Corporation	7959566			COc1cc2[nH]c(=S)n(CC3CCCO3)c(=O)c2cc1OC	InChI=1S/C15H18N2O4S/c1-19-12-6-10-11(7-13(12)20-2)16-15(22)17(14(10)18)8-9-4-3-5-21-9/h6-7,9H,3-5,8H2,1-2H3,(H,16,22)	MWJZBNXOLWKWSA-UHFFFAOYSA-N	322.098727766							116187
Isoquinoline-1-carboxylic acid {3-[(furan-2-carbonyl)-amino]-phenyl}-amide	LSM-27644	SID843360, BRD-K44978128	645650	InChI=1S/C21H15N3O3/c25-20(18-9-4-12-27-18)23-15-6-3-7-16(13-15)24-21(26)19-17-8-2-1-5-14(17)10-11-22-19/h1-13H,(H,23,25)(H,24,26)	GJVHEWNSKJVPJM-UHFFFAOYSA-N	O=C(Nc1cccc(NC(=O)c2nccc3ccccc23)c1)c4occc4	BroadT	BRD-K44978128	BRD-K44978128-001-04-9	Asinex Ltd.	ASN 08218203			O=C(Nc1cccc(NC(=O)c2nccc3ccccc23)c1)c1ccco1	InChI=1S/C21H15N3O3/c25-20(18-9-4-12-27-18)23-15-6-3-7-16(13-15)24-21(26)19-17-8-2-1-5-14(17)10-11-22-19/h1-13H,(H,23,25)(H,24,26)	GJVHEWNSKJVPJM-UHFFFAOYSA-N	357.11134137							116188
CHEMDIV2_005866	LSM-27645	SID24812700, BRD-K00415980	6619170	InChI=1S/C23H21N3O3/c1-2-12-26-22(28)19-9-8-18(15-20(19)24-23(26)29)21(27)25-13-10-17(11-14-25)16-6-4-3-5-7-16/h2-10,15H,1,11-14H2,(H,24,29)	GQXSLUIVBTVWJH-UHFFFAOYSA-N	C=CCN1C(=O)Nc2cc(ccc2C1=O)C(=O)N3CCC(=CC3)c4ccccc4	BroadT	BRD-K00415980	BRD-K00415980-001-05-8	ChemDiv Inc.	C200-0318			C=CCn1c(=O)[nH]c2cc(ccc2c1=O)C(=O)N1CCC(=CC1)c1ccccc1	InChI=1S/C23H21N3O3/c1-2-12-26-22(28)19-9-8-18(15-20(19)24-23(26)29)21(27)25-13-10-17(11-14-25)16-6-4-3-5-7-16/h2-10,15H,1,11-14H2,(H,24,29)	GQXSLUIVBTVWJH-UHFFFAOYSA-N	387.158291562							116189
N-(2-Pyridin-4-yl-benzooxazol-5-yl)-butyramide	LSM-27646	SID849955, BRD-K53291358	652465	InChI=1S/C16H15N3O2/c1-2-3-15(20)18-12-4-5-14-13(10-12)19-16(21-14)11-6-8-17-9-7-11/h4-10H,2-3H2,1H3,(H,18,20)	DRSCWSKFWPKNNR-UHFFFAOYSA-N	CCCC(=O)Nc1ccc2oc(nc2c1)c3ccncc3	BroadT	BRD-K53291358	BRD-K53291358-001-05-3	Asinex Ltd.	BAS 01405892			CCCC(=O)Nc1ccc2oc(nc2c1)-c1ccncc1	InChI=1S/C16H15N3O2/c1-2-3-15(20)18-12-4-5-14-13(10-12)19-16(21-14)11-6-8-17-9-7-11/h4-10H,2-3H2,1H3,(H,18,20)	DRSCWSKFWPKNNR-UHFFFAOYSA-N	281.11642675							116190
1-Benzyl-2-(2-ethoxy-2-oxoethyl)isoquinolinium	LSM-15405	BRD-K64889185	4286579	InChI=1S/C20H20NO2/c1-2-23-20(22)15-21-13-12-17-10-6-7-11-18(17)19(21)14-16-8-4-3-5-9-16/h3-13H,2,14-15H2,1H3/q+1	HYGFHCMHDKEVAK-UHFFFAOYSA-N	CCOC(=O)C[n+]1ccc2ccccc2c1Cc3ccccc3	BroadT	BRD-K64889185	BRD-K64889185-003-06-4	Specs	AQ-405/42300425		Cl	CCOC(=O)C[n+]1ccc2ccccc2c1Cc1ccccc1.Cl	InChI=1S/C20H20NO2.ClH/c1-2-23-20(22)15-21-13-12-17-10-6-7-11-18(17)19(21)14-16-8-4-3-5-9-16;/h3-13H,2,14-15H2,1H3;1H/q+1;	QYFJTXHCKCDOLJ-UHFFFAOYSA-N	306.14940389							104047, 104047
1-Cyclopropyl-3-(4-sulfamoylphenyl)thiourea	LSM-27647	SID87544835, SID85176604, SID24802939, BRD-K63932701	891589	InChI=1S/C10H13N3O2S2/c11-17(14,15)9-5-3-8(4-6-9)13-10(16)12-7-1-2-7/h3-7H,1-2H2,(H2,11,14,15)(H2,12,13,16)	LKZHBUZAWUGNOM-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(NC(=NC2CC2)S)cc1	BroadT	BRD-K63932701	BRD-K63932701-001-05-4	ChemBridge Corporation	7488601			NS(=O)(=O)c1ccc(NC(S)=NC2CC2)cc1	InChI=1S/C10H13N3O2S2/c11-17(14,15)9-5-3-8(4-6-9)13-10(16)12-7-1-2-7/h3-7H,1-2H2,(H2,11,14,15)(H2,12,13,16)	LKZHBUZAWUGNOM-UHFFFAOYSA-N	271.044918066							116191
4-Methyl-n-(3-morpholin-4-ylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide	LSM-27648	SID4248727, BRD-K86818611	3242767	InChI=1S/C19H27N3O3/c1-15-5-6-16(14-17(15)22-9-2-4-18(22)23)19(24)20-7-3-8-21-10-12-25-13-11-21/h5-6,14H,2-4,7-13H2,1H3,(H,20,24)	OLDSXEYZPZTVHI-UHFFFAOYSA-N	Cc1ccc(cc1N2CCCC2=O)C(=O)NCCCN3CCOCC3	BroadT	BRD-K86818611	BRD-K86818611-001-05-7	ChemDiv Inc.	C389-0262			Cc1ccc(cc1N1CCCC1=O)C(=O)NCCCN1CCOCC1	InChI=1S/C19H27N3O3/c1-15-5-6-16(14-17(15)22-9-2-4-18(22)23)19(24)20-7-3-8-21-10-12-25-13-11-21/h5-6,14H,2-4,7-13H2,1H3,(H,20,24)	OLDSXEYZPZTVHI-UHFFFAOYSA-N	345.205241754							116192
SBB001606	LSM-27649	SID24822968, BRD-K63305836	1255233	InChI=1S/C4H4N6O2/c5-2-1(8-12-9-2)3-7-4(6)11-10-3/h(H2,5,9)(H2,6,7,10)	OXXKTGRIPAUKMA-UHFFFAOYSA-N	Nc1onc(n1)c2nonc2N	BroadT	BRD-K63305836	BRD-K63305836-001-06-9	ChemDiv Inc.	8010-3880			Nc1nc(no1)-c1nonc1N	InChI=1S/C4H4N6O2/c5-2-1(8-12-9-2)3-7-4(6)11-10-3/h(H2,5,9)(H2,6,7,10)	OXXKTGRIPAUKMA-UHFFFAOYSA-N	168.039573428							116193
AC1LCRMW	LSM-27650	SID852304, BRD-K93301753	654919	InChI=1S/C21H23N3O4/c1-15(25)23-8-10-24(11-9-23)18-5-3-17(4-6-18)22-21(26)16-2-7-19-20(14-16)28-13-12-27-19/h2-7,14H,8-13H2,1H3,(H,22,26)	YFMOVFMMGPQHLV-UHFFFAOYSA-N	CC(=O)N1CCN(CC1)c2ccc(NC(=O)c3ccc4OCCOc4c3)cc2	BroadT	BRD-K93301753	BRD-K93301753-001-05-3	Asinex Ltd.	BAS 02244189			CC(=O)N1CCN(CC1)c1ccc(NC(=O)c2ccc3OCCOc3c2)cc1	InChI=1S/C21H23N3O4/c1-15(25)23-8-10-24(11-9-23)18-5-3-17(4-6-18)22-21(26)16-2-7-19-20(14-16)28-13-12-27-19/h2-7,14H,8-13H2,1H3,(H,22,26)	YFMOVFMMGPQHLV-UHFFFAOYSA-N	381.168856246							116194
MLS000679755	LSM-27651	SID24794255, BRD-K52094462	1870807	InChI=1S/C17H19ClN2OS2/c1-21-16-8-7-13(11-15(16)18)12-23-10-9-19-17(22)20-14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H2,19,20,22)	IIBGMLFTVJEWFU-UHFFFAOYSA-N	COc1ccc(CSCCN=C(S)Nc2ccccc2)cc1Cl	BroadT	BRD-K52094462	BRD-K52094462-001-06-3	ChemBridge Corporation	7991756			COc1ccc(CSCCN=C(S)Nc2ccccc2)cc1Cl	InChI=1S/C17H19ClN2OS2/c1-21-16-8-7-13(11-15(16)18)12-23-10-9-19-17(22)20-14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H2,19,20,22)	IIBGMLFTVJEWFU-UHFFFAOYSA-N	366.062732338							116195
AC1MJQGL	LSM-27652	BRD-K17039039	3141484	InChI=1S/C18H16FN3/c1-12-3-8-17-16(9-12)18(10-13(2)21-17)22-20-11-14-4-6-15(19)7-5-14/h3-11H,1-2H3,(H,21,22)	IYNVAAFEWIWHER-UHFFFAOYSA-N	Cc1ccc2nc(C)cc(NN=Cc3ccc(F)cc3)c2c1	BroadT	BRD-K17039039	BRD-K17039039-001-05-8	Asinex Ltd.	BAS 02379549			Cc1ccc2nc(C)cc(NN=Cc3ccc(F)cc3)c2c1	InChI=1S/C18H16FN3/c1-12-3-8-17-16(9-12)18(10-13(2)21-17)22-20-11-14-4-6-15(19)7-5-14/h3-11H,1-2H3,(H,21,22)	IYNVAAFEWIWHER-UHFFFAOYSA-N	293.132825742							116196
Imipramine	LSM-2852	Imipramine, Janimine, Pramine, Presamine, Tofranil, Tofranil-PM	3696	InChI=1S/C19H24N2/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21/h3-6,8-11H,7,12-15H2,1-2H3	BCGWQEUPMDMJNV-UHFFFAOYSA-N	CN(C)CCCN1c2ccccc2CCc3ccccc13	BroadT	BRD-K38436528	BRD-K38436528-003-17-0	Prestwick Chemical Inc.	Prestw-72		Cl	CN(C)CCCN1c2ccccc2CCc2ccccc12.Cl	InChI=1S/C19H24N2.ClH/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21;/h3-6,8-11H,7,12-15H2,1-2H3;1H	XZZXIYZZBJDEEP-UHFFFAOYSA-N	280.193948788							47499, 47499, 47499
STK698814	LSM-43996	SID24829514, BRD-K72036124	5425073	InChI=1S/C20H17N3O/c1-14-18(20(24)23(21-14)16-8-4-3-5-9-16)12-15-13-22(2)19-11-7-6-10-17(15)19/h3-13H,1-2H3/b18-12-	LDXSNVKQYCIAAK-PDGQHHTCSA-N	CC1=NN(C(=O)/C/1=C\c2cn(C)c3ccccc23)c4ccccc4	BroadT	BRD-K72036124	BRD-K72036124-001-06-0	Enamine Ltd.	T0507-5397			CC1=NN(C(=O)C\1=C/c1cn(C)c2ccccc12)c1ccccc1	InChI=1S/C20H17N3O/c1-14-18(20(24)23(21-14)16-8-4-3-5-9-16)12-15-13-22(2)19-11-7-6-10-17(15)19/h3-13H,1-2H3/b18-12-	LDXSNVKQYCIAAK-PDGQHHTCSA-N	315.137162194							
AC1NJ254	LSM-27653	BRD-K70331698	4840452	InChI=1S/C15H14N4O/c1-10-13(11(2)20-19-10)9-16-18-15-8-7-12-5-3-4-6-14(12)17-15/h3-9H,1-2H3,(H,17,18)	PDZNEDAWBRMLDI-UHFFFAOYSA-N	Cc1onc(C)c1C=NNc2ccc3ccccc3n2	BroadT	BRD-K70331698	BRD-K70331698-001-05-5	Enamine Ltd.	T5339145			Cc1noc(C)c1C=NNc1ccc2ccccc2n1	InChI=1S/C15H14N4O/c1-10-13(11(2)20-19-10)9-16-18-15-8-7-12-5-3-4-6-14(12)17-15/h3-9H,1-2H3,(H,17,18)	PDZNEDAWBRMLDI-UHFFFAOYSA-N	266.116761108							116197
AC1LFUL4	LSM-27654	BRD-K11312319	760224	InChI=1S/C17H19N3O/c1-17(2,3)14-9-7-13(8-10-14)12-19-20-16(21)15-6-4-5-11-18-15/h4-12H,1-3H3,(H,20,21)	DSNAVLQCDUEVFB-UHFFFAOYSA-N	CC(C)(C)c1ccc(C=NNC(=O)c2ccccn2)cc1	BroadT	BRD-K11312319	BRD-K11312319-001-05-6	Asinex Ltd.	BAS 00269495			CC(C)(C)c1ccc(C=NNC(=O)c2ccccn2)cc1	InChI=1S/C17H19N3O/c1-17(2,3)14-9-7-13(8-10-14)12-19-20-16(21)15-6-4-5-11-18-15/h4-12H,1-3H3,(H,20,21)	DSNAVLQCDUEVFB-UHFFFAOYSA-N	281.152812258							116198
N-(4-Methoxyphenyl)-1,3-benzothiazol-2-amine	LSM-27655	SID24807674, BRD-K42446198	220926	InChI=1S/C14H12N2OS/c1-17-11-8-6-10(7-9-11)15-14-16-12-4-2-3-5-13(12)18-14/h2-9H,1H3,(H,15,16)	OPIFKWJRFLXODB-UHFFFAOYSA-N	COc1ccc(Nc2nc3ccccc3s2)cc1	BroadT	BRD-K42446198	BRD-K42446198-001-06-9	Asinex Ltd.	BAS 05289416			COc1ccc(Nc2nc3ccccc3s2)cc1	InChI=1S/C14H12N2OS/c1-17-11-8-6-10(7-9-11)15-14-16-12-4-2-3-5-13(12)18-14/h2-9H,1H3,(H,15,16)	OPIFKWJRFLXODB-UHFFFAOYSA-N	256.067033714							116199
4,6-Bis(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-3-ol	LSM-27656	SID4248440, BRD-K25891940	1262956	InChI=1S/C8H3F6N3O/c9-7(10,11)2-1-3(8(12,13)14)15-5-4(2)6(18)17-16-5/h1H,(H2,15,16,17,18)	OPBHNLKZFXNZLY-UHFFFAOYSA-N	Oc1[nH]nc2nc(cc(c12)C(F)(F)F)C(F)(F)F	BroadT	BRD-K25891940	BRD-K25891940-001-06-8	ChemDiv Inc.	8014-1471			Oc1[nH]nc2nc(cc(c12)C(F)(F)F)C(F)(F)F	InChI=1S/C8H3F6N3O/c9-7(10,11)2-1-3(8(12,13)14)15-5-4(2)6(18)17-16-5/h1H,(H2,15,16,17,18)	OPBHNLKZFXNZLY-UHFFFAOYSA-N	271.018030946							116200
AC1NB00S	LSM-27657	BRD-K19960094	4460323	InChI=1S/C14H11N5O4/c1-9-13(18-7-3-2-4-11(18)16-9)14(20)17-15-8-10-5-6-12(23-10)19(21)22/h2-8H,1H3,(H,17,20)	RZLDQCPWBBEYSG-UHFFFAOYSA-N	Cc1nc2ccccn2c1C(=O)NN=Cc3oc(cc3)[N+](=O)[O-]	BroadT	BRD-K19960094	BRD-K19960094-001-08-9	Enamine Ltd.	T0510-3482			Cc1nc2ccccn2c1C(=O)NN=Cc1ccc(o1)[N+]([O-])=O	InChI=1S/C14H11N5O4/c1-9-13(18-7-3-2-4-11(18)16-9)14(20)17-15-8-10-5-6-12(23-10)19(21)22/h2-8H,1H3,(H,17,20)	RZLDQCPWBBEYSG-UHFFFAOYSA-N	313.081103882							116201
F1143-2849	LSM-27658	SID24829348, BRD-K93079468	675503	InChI=1S/C15H13NO4/c1-9-13(10(2)20-16-9)8-18-12-5-3-11-4-6-15(17)19-14(11)7-12/h3-7H,8H2,1-2H3	MSXDLPJTYVZYDB-UHFFFAOYSA-N	Cc1onc(C)c1COc2ccc3C=CC(=O)Oc3c2	BroadT	BRD-K93079468	BRD-K93079468-001-06-9	Enamine Ltd.	T0504-4409			Cc1noc(C)c1COc1ccc2ccc(=O)oc2c1	InChI=1S/C15H13NO4/c1-9-13(10(2)20-16-9)8-18-12-5-3-11-4-6-15(17)19-14(11)7-12/h3-7H,8H2,1-2H3	MSXDLPJTYVZYDB-UHFFFAOYSA-N	271.084457906							116202
STK076413	LSM-44219	SID49815805, BRD-K67064288	2251836	InChI=1S/C16H11NO4S2/c1-17-14(18)13(23-16(17)22)9-10-4-6-11(7-5-10)21-15(19)12-3-2-8-20-12/h2-9H,1H3/b13-9+	CBAFQPVCJDQMPM-UKTHLTGXSA-N	CN1C(=S)S\C(=C\c2ccc(OC(=O)c3occc3)cc2)\C1=O	BroadT	BRD-K67064288	BRD-K67064288-001-05-3	ChemDiv Inc.	1588-0370			CN1C(=S)S\C(=C\c2ccc(OC(=O)c3ccco3)cc2)C1=O	InChI=1S/C16H11NO4S2/c1-17-14(18)13(23-16(17)22)9-10-4-6-11(7-5-10)21-15(19)12-3-2-8-20-12/h2-9H,1H3/b13-9+	CBAFQPVCJDQMPM-UKTHLTGXSA-N	345.012949222							
2-[(4-Chlorophenyl)sulfonyl]quinoxaline	LSM-27660	SID24817108, BRD-K45731868	3720993	InChI=1S/C14H9ClN2O2S/c15-10-5-7-11(8-6-10)20(18,19)14-9-16-12-3-1-2-4-13(12)17-14/h1-9H	LLXDUUGOALZQRF-UHFFFAOYSA-N	Clc1ccc(cc1)S(=O)(=O)c2cnc3ccccc3n2	BroadT	BRD-K45731868	BRD-K45731868-001-05-2	Key Organics Ltd.	2D-014			Clc1ccc(cc1)S(=O)(=O)c1cnc2ccccc2n1	InChI=1S/C14H9ClN2O2S/c15-10-5-7-11(8-6-10)20(18,19)14-9-16-12-3-1-2-4-13(12)17-14/h1-9H	LLXDUUGOALZQRF-UHFFFAOYSA-N	304.007325948							116204
MLS000057770	LSM-27661	SID3713643, BRD-A01047964	2998487	InChI=1S/C22H21N5O/c23-14-17(22(28)24-15-16-8-2-1-3-9-16)20-21(27-12-6-7-13-27)26-19-11-5-4-10-18(19)25-20/h1-5,8-11,17H,6-7,12-13,15H2,(H,24,28)	NKIVOSNKOKGQNL-UHFFFAOYSA-N	O=C(NCc1ccccc1)C(C#N)c2nc3ccccc3nc2N4CCCC4	BroadT	BRD-A01047964	BRD-A01047964-001-06-8	Enamine Ltd.	T0512-2044			O=C(NCc1ccccc1)C(C#N)c1nc2ccccc2nc1N1CCCC1	InChI=1S/C22H21N5O/c23-14-17(22(28)24-15-16-8-2-1-3-9-16)20-21(27-12-6-7-13-27)26-19-11-5-4-10-18(19)25-20/h1-5,8-11,17H,6-7,12-13,15H2,(H,24,28)	NKIVOSNKOKGQNL-UHFFFAOYSA-N	371.174610342							116205
MLS000568198	LSM-43627	BRD-A01863324	6224016	InChI=1S/C23H28ClN3O2/c1-18(23(28)25-21-17-20(24)10-11-22(21)29-2)27-15-13-26(14-16-27)12-6-9-19-7-4-3-5-8-19/h3-11,17-18H,12-16H2,1-2H3,(H,25,28)/b9-6+	AVASCBHTYQRLBW-RMKNXTFCSA-N	COc1ccc(Cl)cc1NC(=O)C(C)N2CCN(C\C=C\c3ccccc3)CC2	BroadT	BRD-A01863324	BRD-A01863324-034-05-6	Enamine Ltd.	T5324268		OC(=O)C(=O)O	COc1ccc(Cl)cc1NC(=O)C(C)N1CCN(CC1)C\C=C\c1ccccc1.OC(=O)C(=O)O	InChI=1S/C23H28ClN3O2.C2H2O4/c1-18(23(28)25-21-17-20(24)10-11-22(21)29-2)27-15-13-26(14-16-27)12-6-9-19-7-4-3-5-8-19;3-1(4)2(5)6/h3-11,17-18H,12-16H2,1-2H3,(H,25,28);(H,3,4)(H,5,6)/b9-6+;	DZMXTWOUUSCYTR-MLBSPLJJSA-N	413.187004876							, 
ZINC01858083	LSM-27662	SID26663122, BRD-K85914008	1617920	InChI=1S/C17H28N2OS/c1-2-3-4-5-15(20)18-17(21)19-16-13-7-11-6-12(9-13)10-14(16)8-11/h11-14,16H,2-10H2,1H3,(H2,18,19,20,21)	KYLITGQQDLYBCT-UHFFFAOYSA-N	CCCCCC(=O)NC(=S)NC1C2CC3CC(CC1C3)C2	BroadT	BRD-K85914008	BRD-K85914008-001-06-4	InterBioScreen Ltd.	STOCK4S-85801			CCCCCC(=O)NC(=S)NC1C2CC3CC(C2)CC1C3	InChI=1S/C17H28N2OS/c1-2-3-4-5-15(20)18-17(21)19-16-13-7-11-6-12(9-13)10-14(16)8-11/h11-14,16H,2-10H2,1H3,(H2,18,19,20,21)	KYLITGQQDLYBCT-UHFFFAOYSA-N	308.192234226							116206
AC1LDK27	LSM-27663	BRD-K90040871	668402	InChI=1S/C11H10N2OS2/c1-8-4-6-16-10(8)7-12-13-11(14)9-3-2-5-15-9/h2-7H,1H3,(H,13,14)	FJLQPCRQLSAFGY-UHFFFAOYSA-N	Cc1ccsc1C=NNC(=O)c2cccs2	BroadT	BRD-K90040871	BRD-K90040871-001-05-7	InterBioScreen Ltd.	STOCK3S-61010			Cc1ccsc1C=NNC(=O)c1cccs1	InChI=1S/C11H10N2OS2/c1-8-4-6-16-10(8)7-12-13-11(14)9-3-2-5-15-9/h2-7H,1H3,(H,13,14)	FJLQPCRQLSAFGY-UHFFFAOYSA-N	250.02345434							116207
AC1LNY9H	LSM-27664	BRD-K28694186	1210927	InChI=1S/C14H13ClN4O3S/c15-10-6-8-12(9-7-10)23(21,22)14(13(20)17-16)19-18-11-4-2-1-3-5-11/h1-9,18H,16H2,(H,17,20)	BDHAVMZIEHDUSJ-UHFFFAOYSA-N	NNC(=O)C(=NNc1ccccc1)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K28694186	BRD-K28694186-001-07-4	Specs	AE-848/31939027			NNC(=O)C(=NNc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C14H13ClN4O3S/c15-10-6-8-12(9-7-10)23(21,22)14(13(20)17-16)19-18-11-4-2-1-3-5-11/h1-9,18H,16H2,(H,17,20)	BDHAVMZIEHDUSJ-UHFFFAOYSA-N	352.039688716							116208
MLS000040531	LSM-27665	SID863405, BRD-K25081504	664659	InChI=1S/C24H27ClN4O4/c1-32-19-8-4-7-18-21(19)22(23(26-18)24(31)33-2)27-20(30)9-10-28-11-13-29(14-12-28)17-6-3-5-16(25)15-17/h3-8,15,26H,9-14H2,1-2H3,(H,27,30)	GQKARFNRWGAMTR-UHFFFAOYSA-N	COC(=O)c1[nH]c2cccc(OC)c2c1NC(=O)CCN3CCN(CC3)c4cccc(Cl)c4	BroadT	BRD-K25081504	BRD-K25081504-001-01-5	InterBioScreen Ltd.	STOCK4S-72217			COC(=O)c1[nH]c2cccc(OC)c2c1NC(=O)CCN1CCN(CC1)c1cccc(Cl)c1	InChI=1S/C24H27ClN4O4/c1-32-19-8-4-7-18-21(19)22(23(26-18)24(31)33-2)27-20(30)9-10-28-11-13-29(14-12-28)17-6-3-5-16(25)15-17/h3-8,15,26H,9-14H2,1-2H3,(H,27,30)	GQKARFNRWGAMTR-UHFFFAOYSA-N	470.172083094							116209
MLS000730738	LSM-44220	SID24814092, BRD-K50424014	16194219	InChI=1S/C20H19N5O4S2/c1-11-9-13(12(2)24(11)15-7-5-6-8-16(15)29-3)10-14-17(21)25-19(22-18(14)26)30-23-20(25)31(4,27)28/h5-10,21H,1-4H3/b14-10-,21-17?	TZGJLEFQFYYRDS-QBILMKHKSA-N	COc1ccccc1n2c(C)cc(\C=C\3/C(=O)N=C4SN=C(N4C3=N)S(=O)(=O)C)c2C	BroadT	BRD-K50424014	BRD-K50424014-001-05-9	ChemDiv Inc.	C355-0253			COc1ccccc1-n1c(C)cc(\C=C2\C(=N)N3C(SN=C3S(C)(=O)=O)=NC2=O)c1C	InChI=1S/C20H19N5O4S2/c1-11-9-13(12(2)24(11)15-7-5-6-8-16(15)29-3)10-14-17(21)25-19(22-18(14)26)30-23-20(25)31(4,27)28/h5-10,21H,1-4H3/b14-10-,21-17?	TZGJLEFQFYYRDS-QBILMKHKSA-N	457.087845518							
Methyl [4-(benzyloxy)phenyl]carbamate	LSM-27667	SID4262314, BRD-K18044510	894605	InChI=1S/C15H15NO3/c1-18-15(17)16-13-7-9-14(10-8-13)19-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,16,17)	FHTMZNVXGSGVOA-UHFFFAOYSA-N	COC(=O)Nc1ccc(OCc2ccccc2)cc1	BroadT	BRD-K18044510	BRD-K18044510-001-05-5	ChemBridge Corporation	7627484			COC(=O)Nc1ccc(OCc2ccccc2)cc1	InChI=1S/C15H15NO3/c1-18-15(17)16-13-7-9-14(10-8-13)19-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,16,17)	FHTMZNVXGSGVOA-UHFFFAOYSA-N	257.10519335							116211
SMR000097165	LSM-27668	SID24838871, SID7968143, BRD-K73625057	5309247	InChI=1S/C24H28ClN3O4/c1-2-32-24(31)27-12-10-16(11-13-27)26-22(29)15-28-21-9-5-7-18(21)19(14-23(28)30)17-6-3-4-8-20(17)25/h3-4,6,8,14,16H,2,5,7,9-13,15H2,1H3,(H,26,29)	STMMMTLOMTZTRZ-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)NC(=O)CN2C(=O)C=C(C3=C2CCC3)c4ccccc4Cl	BroadT	BRD-K73625057	BRD-K73625057-001-05-2	ChemDiv Inc.	K788-8844			CCOC(=O)N1CCC(CC1)NC(=O)Cn1c2CCCc2c(cc1=O)-c1ccccc1Cl	InChI=1S/C24H28ClN3O4/c1-2-32-24(31)27-12-10-16(11-13-27)26-22(29)15-28-21-9-5-7-18(21)19(14-23(28)30)17-6-3-4-8-20(17)25/h3-4,6,8,14,16H,2,5,7,9-13,15H2,1H3,(H,26,29)	STMMMTLOMTZTRZ-UHFFFAOYSA-N	457.176834116							116212
SMR000031312	LSM-27669	SID4240513, BRD-K23226467	3235611	InChI=1S/C19H22N2O3/c22-17(20-12-10-14-6-2-1-3-7-14)11-13-21-18(23)15-8-4-5-9-16(15)19(21)24/h4-6,8-9H,1-3,7,10-13H2,(H,20,22)	SMOBTKNMJWKWDY-UHFFFAOYSA-N	O=C(CCN1C(=O)c2ccccc2C1=O)NCCC3=CCCCC3	BroadT	BRD-K23226467	BRD-K23226467-001-05-4	ChemDiv Inc.	K694-0020			O=C(CCN1C(=O)c2ccccc2C1=O)NCCC1=CCCCC1	InChI=1S/C19H22N2O3/c22-17(20-12-10-14-6-2-1-3-7-14)11-13-21-18(23)15-8-4-5-9-16(15)19(21)24/h4-6,8-9H,1-3,7,10-13H2,(H,20,22)	SMOBTKNMJWKWDY-UHFFFAOYSA-N	326.163042584							116213
MLS000684400	LSM-27670	SID24791066, BRD-K14244640	2225565	InChI=1S/C24H19N5O2S/c1-15-20(24(31)29(28(15)2)16-9-4-3-5-10-16)25-21-17-11-6-7-12-18(17)22(26-21)27-23(30)19-13-8-14-32-19/h3-14H,1-2H3,(H,25,26,27,30)	HDIQTPDPEVFBGS-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)N=C2N=C(NC(=O)c3cccs3)c4ccccc24)c5ccccc5	BroadT	BRD-K14244640	BRD-K14244640-001-05-8	ChemBridge Corporation	7949692			Cc1c(N=C2N=C(NC(=O)c3cccs3)c3ccccc23)c(=O)n(-c2ccccc2)n1C	InChI=1S/C24H19N5O2S/c1-15-20(24(31)29(28(15)2)16-9-4-3-5-10-16)25-21-17-11-6-7-12-18(17)22(26-21)27-23(30)19-13-8-14-32-19/h3-14H,1-2H3,(H,25,26,27,30)	HDIQTPDPEVFBGS-UHFFFAOYSA-N	441.125945588							116214
SMR000148196	LSM-27671	SID14743545, BRD-K69464508	3543597	InChI=1S/C24H28N4O/c1-17(2)15-22-20-10-6-9-19(20)21(16-25)23(26-22)27-11-13-28(14-12-27)24(29)18-7-4-3-5-8-18/h3-5,7-8,17H,6,9-15H2,1-2H3	APIUJQLXJPJERX-UHFFFAOYSA-N	CC(C)Cc1nc(N2CCN(CC2)C(=O)c3ccccc3)c(C#N)c4CCCc14	BroadT	BRD-K69464508	BRD-K69464508-001-05-7	InterBioScreen Ltd.	STOCK3S-70526			CC(C)Cc1nc(N2CCN(CC2)C(=O)c2ccccc2)c(C#N)c2CCCc12	InChI=1S/C24H28N4O/c1-17(2)15-22-20-10-6-9-19(20)21(16-25)23(26-22)27-11-13-28(14-12-27)24(29)18-7-4-3-5-8-18/h3-5,7-8,17H,6,9-15H2,1-2H3	APIUJQLXJPJERX-UHFFFAOYSA-N	388.226311556							116215
CHEMDIV3_002032	LSM-27672	SID24782944, BRD-K12205966	5058762	InChI=1S/C15H11NO3/c1-9(17)16-13-8-12-11-5-3-2-4-10(11)6-7-14(12)19-15(13)18/h2-8H,1H3,(H,16,17)	GLGOAFMFRQOUSV-UHFFFAOYSA-N	CC(=O)NC1=Cc2c(OC1=O)ccc3ccccc23	BroadT	BRD-K12205966	BRD-K12205966-001-06-5	ChemDiv Inc.	3409-4057			CC(=O)Nc1cc2c(ccc3ccccc23)oc1=O	InChI=1S/C15H11NO3/c1-9(17)16-13-8-12-11-5-3-2-4-10(11)6-7-14(12)19-15(13)18/h2-8H,1H3,(H,16,17)	GLGOAFMFRQOUSV-UHFFFAOYSA-N	253.073893222							116216
SMR000154039	LSM-27673	SID14744781, BRD-K70801949	2571309	InChI=1S/C16H24N4OS/c1-11-12(2)22-15-13(11)14(18-10-19-15)17-9-16(3,4)20-5-7-21-8-6-20/h10H,5-9H2,1-4H3,(H,17,18,19)	KQXYFFACRYKBSU-UHFFFAOYSA-N	Cc1sc2ncnc(NCC(C)(C)N3CCOCC3)c2c1C	BroadT	BRD-K70801949	BRD-K70801949-001-06-2	Enamine Ltd.	T5346984			Cc1sc2ncnc(NCC(C)(C)N3CCOCC3)c2c1C	InChI=1S/C16H24N4OS/c1-11-12(2)22-15-13(11)14(18-10-19-15)17-9-16(3,4)20-5-7-21-8-6-20/h10H,5-9H2,1-4H3,(H,17,18,19)	KQXYFFACRYKBSU-UHFFFAOYSA-N	320.167082118							116217
CHEMDIV2_007987	LSM-27674	SID24789240, BRD-K77771145	5123661	InChI=1S/C25H28N4O2S2/c1-3-28(4-2)14-15-29-24(31)23-22(19-12-8-9-13-20(19)33-23)27-25(29)32-17-21(30)26-16-18-10-6-5-7-11-18/h5-13H,3-4,14-17H2,1-2H3,(H,26,30)	ZEWFJYBVIKDCCU-UHFFFAOYSA-N	CCN(CC)CCN1C(=Nc2c(sc3ccccc23)C1=O)SCC(=O)NCc4ccccc4	BroadT	BRD-K77771145	BRD-K77771145-001-06-2	ChemDiv Inc.	K263-0274			CCN(CC)CCn1c(SCC(=O)NCc2ccccc2)nc2c3ccccc3sc2c1=O	InChI=1S/C25H28N4O2S2/c1-3-28(4-2)14-15-29-24(31)23-22(19-12-8-9-13-20(19)33-23)27-25(29)32-17-21(30)26-16-18-10-6-5-7-11-18/h5-13H,3-4,14-17H2,1-2H3,(H,26,30)	ZEWFJYBVIKDCCU-UHFFFAOYSA-N	480.165367556							116218
F0921-5864	LSM-27675	SID4258093, BRD-K79496991	866472	InChI=1S/C10H9N3O2/c1-7-5-9(13-15-7)10(14)12-8-3-2-4-11-6-8/h2-6H,1H3,(H,12,14)	UMGGLCPRBMHTEY-UHFFFAOYSA-N	Cc1onc(c1)C(=O)Nc2cccnc2	BroadT	BRD-K79496991	BRD-K79496991-001-06-9	ChemBridge Corporation	7947847			Cc1cc(no1)C(=O)Nc1cccnc1	InChI=1S/C10H9N3O2/c1-7-5-9(13-15-7)10(14)12-8-3-2-4-11-6-8/h2-6H,1H3,(H,12,14)	UMGGLCPRBMHTEY-UHFFFAOYSA-N	203.069476558							116219
SMR000197736	LSM-27676	SID17433000, BRD-K88823691	1291068	InChI=1S/C19H20ClN3O2S/c20-15-7-5-14(6-8-15)13-18(24)22-19(26)21-16-3-1-2-4-17(16)23-9-11-25-12-10-23/h1-8H,9-13H2,(H2,21,22,24,26)	OVGDVQQRNWPDHJ-UHFFFAOYSA-N	Clc1ccc(CC(=O)NC(=S)Nc2ccccc2N3CCOCC3)cc1	BroadT	BRD-K88823691	BRD-K88823691-001-05-8	ChemBridge Corporation	7250396			Clc1ccc(CC(=O)NC(=S)Nc2ccccc2N2CCOCC2)cc1	InChI=1S/C19H20ClN3O2S/c20-15-7-5-14(6-8-15)13-18(24)22-19(26)21-16-3-1-2-4-17(16)23-9-11-25-12-10-23/h1-8H,9-13H2,(H2,21,22,24,26)	OVGDVQQRNWPDHJ-UHFFFAOYSA-N	389.09647531							116220
7-(2-Chloro-6-fluorophenyl)-5-methyl-6,7-dihydro-1H-1,4-diazepine-2,3-dicarbonitrile	LSM-27677	SID24821748, BRD-A50711791	3586809	InChI=1S/C14H10ClFN4/c1-8-5-11(14-9(15)3-2-4-10(14)16)20-13(7-18)12(6-17)19-8/h2-4,11,20H,5H2,1H3	JTHRQQGJOBUXAL-UHFFFAOYSA-N	CC1=NC(=C(NC(C1)c2c(F)cccc2Cl)C#N)C#N	BroadT	BRD-A50711791	BRD-A50711791-001-05-0	Key Organics Ltd.	2W-0204			CC1=NC(C#N)=C(NC(C1)c1c(F)cccc1Cl)C#N	InChI=1S/C14H10ClFN4/c1-8-5-11(14-9(15)3-2-4-10(14)16)20-13(7-18)12(6-17)19-8/h2-4,11,20H,5H2,1H3	JTHRQQGJOBUXAL-UHFFFAOYSA-N	288.05780227							116221
MLS000056958	LSM-27678	SID3713637, BRD-A61408421	2998485	InChI=1S/C22H31NO5/c1-14-6-18(15(2)23(14)4-5-27-3)19(24)12-28-20(25)21-8-16-7-17(9-21)11-22(26,10-16)13-21/h6,16-17,26H,4-5,7-13H2,1-3H3	DZJVYXDAMKUXEQ-UHFFFAOYSA-N	COCCn1c(C)cc(C(=O)COC(=O)C23CC4CC(CC(O)(C4)C2)C3)c1C	BroadT	BRD-A61408421	BRD-A61408421-001-05-8	Enamine Ltd.	T5264876			COCCn1c(C)cc(C(=O)COC(=O)C23CC4CC(CC(O)(C4)C2)C3)c1C	InChI=1S/C22H31NO5/c1-14-6-18(15(2)23(14)4-5-27-3)19(24)12-28-20(25)21-8-16-7-17(9-21)11-22(26,10-16)13-21/h6,16-17,26H,4-5,7-13H2,1-3H3	DZJVYXDAMKUXEQ-UHFFFAOYSA-N	389.220223102							116222
T5229758	LSM-27679	SID24839858, SID3715628, BRD-K80797842	2096878	InChI=1S/C20H22ClN3O6S/c21-16-4-7-18(22-13-16)23-19(25)14-30-20(26)8-3-15-1-5-17(6-2-15)31(27,28)24-9-11-29-12-10-24/h1-2,4-7,13H,3,8-12,14H2,(H,22,23,25)	GQHGLXNBBCWJGE-UHFFFAOYSA-N	Clc1ccc(NC(=O)COC(=O)CCc2ccc(cc2)S(=O)(=O)N3CCOCC3)nc1	BroadT	BRD-K80797842	BRD-K80797842-001-06-8	Enamine Ltd.	T5229758			Clc1ccc(NC(=O)COC(=O)CCc2ccc(cc2)S(=O)(=O)N2CCOCC2)nc1	InChI=1S/C20H22ClN3O6S/c21-16-4-7-18(22-13-16)23-19(25)14-30-20(26)8-3-15-1-5-17(6-2-15)31(27,28)24-9-11-29-12-10-24/h1-2,4-7,13H,3,8-12,14H2,(H,22,23,25)	GQHGLXNBBCWJGE-UHFFFAOYSA-N	467.091783854							116223
SMR000048559	LSM-27680	SID865864, BRD-A52655849	667123	InChI=1S/C17H19N3O/c1-20-15-11-7-6-10-14(15)19-16(20)17(18,12-21-2)13-8-4-3-5-9-13/h3-11H,12,18H2,1-2H3	BOHSCRHNXFOGTC-UHFFFAOYSA-N	COCC(N)(c1ccccc1)c2nc3ccccc3n2C	BroadT	BRD-A52655849	BRD-A52655849-001-05-9	InterBioScreen Ltd.	STOCK5S-55843			COCC(N)(c1nc2ccccc2n1C)c1ccccc1	InChI=1S/C17H19N3O/c1-20-15-11-7-6-10-14(15)19-16(20)17(18,12-21-2)13-8-4-3-5-9-13/h3-11H,12,18H2,1-2H3	BOHSCRHNXFOGTC-UHFFFAOYSA-N	281.152812258							116224
MLS000760658	LSM-4217	BRD-K98219271, SID24837116, SID87225728	4832119	InChI=1S/C23H29N5O5S/c1-24(2)34(32,33)20-9-10-22(26-11-3-4-12-26)21(17-20)23(29)27-15-13-25(14-16-27)18-5-7-19(8-6-18)28(30)31/h5-10,17H,3-4,11-16H2,1-2H3	WXBVFZVJSITTKR-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(c1)C(=O)N3CCN(CC3)c4ccc(cc4)[N+](=O)[O-]	BroadT	BRD-K98219271	BRD-K98219271-001-05-5	Enamine Ltd.	T5295669			CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(c1)C(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C23H29N5O5S/c1-24(2)34(32,33)20-9-10-22(26-11-3-4-12-26)21(17-20)23(29)27-15-13-25(14-16-27)18-5-7-19(8-6-18)28(30)31/h5-10,17H,3-4,11-16H2,1-2H3	WXBVFZVJSITTKR-UHFFFAOYSA-N	487.188939768							93724
T0503-9813	LSM-27681	SID24828596, BRD-K29328661	5064871	InChI=1S/C21H37N5O5P2S/c1-22-19-20(32(27,23-2-10-28-11-3-23)24-4-12-29-13-5-24)18-21(22)33(34,25-6-14-30-15-7-25)26-8-16-31-17-9-26/h18-19H,2-17H2,1H3	CFHWAVVAKZUYKT-UHFFFAOYSA-N	Cn1cc(cc1P(=S)(N2CCOCC2)N3CCOCC3)P(=O)(N4CCOCC4)N5CCOCC5	BroadT	BRD-K29328661	BRD-K29328661-001-05-6	Enamine Ltd.	T0503-9813			Cn1cc(cc1P(=S)(N1CCOCC1)N1CCOCC1)P(=O)(N1CCOCC1)N1CCOCC1	InChI=1S/C21H37N5O5P2S/c1-22-19-20(32(27,23-2-10-28-11-3-23)24-4-12-29-13-5-24)18-21(22)33(34,25-6-14-30-15-7-25)26-8-16-31-17-9-26/h18-19H,2-17H2,1H3	CFHWAVVAKZUYKT-UHFFFAOYSA-N	533.199063044							131281
11-Oxo-6,11-dihydrodibenzo[b,e]oxepin-2-yl acetate	LSM-27682	SID14729535, BRD-K03897573	678309	InChI=1S/C16H12O4/c1-10(17)20-12-6-7-15-14(8-12)16(18)13-5-3-2-4-11(13)9-19-15/h2-8H,9H2,1H3	RNFDQFXMAXHPKE-UHFFFAOYSA-N	CC(=O)Oc1ccc2OCc3ccccc3C(=O)c2c1	BroadT	BRD-K03897573	BRD-K03897573-001-05-7	Key Organics Ltd.	MS-2288			CC(=O)Oc1ccc2OCc3ccccc3C(=O)c2c1	InChI=1S/C16H12O4/c1-10(17)20-12-6-7-15-14(8-12)16(18)13-5-3-2-4-11(13)9-19-15/h2-8H,9H2,1H3	RNFDQFXMAXHPKE-UHFFFAOYSA-N	268.073558864							116227
MLS000871735	LSM-27683	SID24814473, BRD-K27961620	16194374	InChI=1S/C18H17N5O5/c1-2-12-4-3-5-13(10-12)19-17-18(23(25)26)20-21(22(17)24)14-6-7-15-16(11-14)28-9-8-27-15/h3-7,10-11,19H,2,8-9H2,1H3	SHKMCRAYGUCKFW-UHFFFAOYSA-N	CCc1cccc(Nc2c(nn(c3ccc4OCCOc4c3)[n+]2[O-])[N+](=O)[O-])c1	BroadT	BRD-K27961620	BRD-K27961620-001-06-4	ChemDiv Inc.	C437-0056			CCc1cccc(Nc2c(nn(-c3ccc4OCCOc4c3)[n+]2[O-])[N+]([O-])=O)c1	InChI=1S/C18H17N5O5/c1-2-12-4-3-5-13(10-12)19-17-18(23(25)26)20-21(22(17)24)14-6-7-15-16(11-14)28-9-8-27-15/h3-7,10-11,19H,2,8-9H2,1H3	SHKMCRAYGUCKFW-UHFFFAOYSA-N	383.122968694							
TCMDC-125506	LSM-27684	TCMDC-125506, BRD-K37338244	4798096	InChI=1S/C16H13ClN2/c17-13-6-7-14-15(8-9-18-16(14)10-13)19-11-12-4-2-1-3-5-12/h1-10H,11H2,(H,18,19)	IMBPMAAMRHSTEU-UHFFFAOYSA-N	Clc1ccc2c(NCc3ccccc3)ccnc2c1	BroadT	BRD-K37338244	BRD-K37338244-001-05-1	Enamine Ltd.	T5389392			Clc1ccc2c(NCc3ccccc3)ccnc2c1	InChI=1S/C16H13ClN2/c17-13-6-7-14-15(8-9-18-16(14)10-13)19-11-12-4-2-1-3-5-12/h1-10H,11H2,(H,18,19)	IMBPMAAMRHSTEU-UHFFFAOYSA-N	268.076726146							116229
F0779-0485	LSM-27685	SID24784657, BRD-K20636447	4071548	InChI=1S/C16H15NO3S/c1-20-16(19)14-12(17-15(18)11-7-8-11)9-13(21-14)10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H,17,18)	RIMVNGIWSLFHJI-UHFFFAOYSA-N	COC(=O)c1sc(cc1NC(=O)C2CC2)c3ccccc3	BroadT	BRD-K20636447	BRD-K20636447-001-05-2	Life Chemicals Inc.	F0779-0485			COC(=O)c1sc(cc1NC(=O)C1CC1)-c1ccccc1	InChI=1S/C16H15NO3S/c1-20-16(19)14-12(17-15(18)11-7-8-11)9-13(21-14)10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H,17,18)	RIMVNGIWSLFHJI-UHFFFAOYSA-N	301.07726404							116230
MLS000516282	LSM-15406	BRD-A39737108	3314979	InChI=1S/C21H35NO2/c1-15(2)20-11-10-16(3)12-21(20)24-14-19(23)13-22-17(4)18-8-6-5-7-9-18/h5-9,15-17,19-23H,10-14H2,1-4H3	JTFAPYUEBOLXAA-UHFFFAOYSA-N	CC(C)C1CCC(C)CC1OCC(O)CNC(C)c2ccccc2	BroadT	BRD-A39737108	BRD-A39737108-003-05-5	Enamine Ltd.	T0515-7668		Cl	CC(C)C1CCC(C)CC1OCC(O)CNC(C)c1ccccc1.Cl	InChI=1S/C21H35NO2.ClH/c1-15(2)20-11-10-16(3)12-21(20)24-14-19(23)13-22-17(4)18-8-6-5-7-9-18;/h5-9,15-17,19-23H,10-14H2,1-4H3;1H	VMYGYNWLYSFAFC-UHFFFAOYSA-N	333.26677937							104048, 104048
ZINC02868834	LSM-27686	SID24795928, BRD-K03238393	2221968	InChI=1S/C13H11FN2O3/c14-9-3-5-10(6-4-9)16-12(17)8-15-13(18)11-2-1-7-19-11/h1-7H,8H2,(H,15,18)(H,16,17)	AQQZWSKKBHAKCI-UHFFFAOYSA-N	Fc1ccc(NC(=O)CNC(=O)c2occc2)cc1	BroadT	BRD-K03238393	BRD-K03238393-001-06-0	ChemBridge Corporation	7926772			Fc1ccc(NC(=O)CNC(=O)c2ccco2)cc1	InChI=1S/C13H11FN2O3/c14-9-3-5-10(6-4-9)16-12(17)8-15-13(18)11-2-1-7-19-11/h1-7H,8H2,(H,15,18)(H,16,17)	AQQZWSKKBHAKCI-UHFFFAOYSA-N	262.075370432							116231
MLS000678061	LSM-27687	SID24790984, BRD-K57437091	1728277	InChI=1S/C14H19N3O2S/c1-3-4-5-12(18)16-17-14(20)15-13(19)11-8-6-10(2)7-9-11/h6-9H,3-5H2,1-2H3,(H,16,18)(H2,15,17,19,20)	ASVYLSLJHPYBNG-UHFFFAOYSA-N	CCCCC(=O)NNC(=S)NC(=O)c1ccc(C)cc1	BroadT	BRD-K57437091	BRD-K57437091-001-06-8	Asinex Ltd.	BAS 02136353			CCCCC(=O)NNC(=S)NC(=O)c1ccc(C)cc1	InChI=1S/C14H19N3O2S/c1-3-4-5-12(18)16-17-14(20)15-13(19)11-8-6-10(2)7-9-11/h6-9H,3-5H2,1-2H3,(H,16,18)(H2,15,17,19,20)	ASVYLSLJHPYBNG-UHFFFAOYSA-N	293.119797568							116232
ST50014468	LSM-27688	SID843496, BRD-K81479219	645790	InChI=1S/C12H11N3O/c1-8-3-4-15-7-10(6-11(15)5-8)12-9(2)13-16-14-12/h3-7H,1-2H3	LINODUCFMAMRFQ-UHFFFAOYSA-N	Cc1ccn2cc(cc2c1)c3nonc3C	BroadT	BRD-K81479219	BRD-K81479219-001-05-9	Asinex Ltd.	BAS 02828248			Cc1nonc1-c1cc2cc(C)ccn2c1	InChI=1S/C12H11N3O/c1-8-3-4-15-7-10(6-11(15)5-8)12-9(2)13-16-14-12/h3-7H,1-2H3	LINODUCFMAMRFQ-UHFFFAOYSA-N	213.090212002							116233
F5860-4223	LSM-27689	SID4262600, BRD-K53056600	1291195	InChI=1S/C18H18N4O2S/c23-16(21-18-20-14-7-3-4-8-15(14)25-18)9-10-22-11-19-13-6-2-1-5-12(13)17(22)24/h1-2,5-6,11H,3-4,7-10H2,(H,20,21,23)	WTVKWGXFVNQBSQ-UHFFFAOYSA-N	O=C(CCN1C=Nc2ccccc2C1=O)Nc3nc4CCCCc4s3	BroadT	BRD-K53056600	BRD-K53056600-001-05-6	ChemBridge Corporation	7748355			O=C(CCn1cnc2ccccc2c1=O)Nc1nc2CCCCc2s1	InChI=1S/C18H18N4O2S/c23-16(21-18-20-14-7-3-4-8-15(14)25-18)9-10-22-11-19-13-6-2-1-5-12(13)17(22)24/h1-2,5-6,11H,3-4,7-10H2,(H,20,21,23)	WTVKWGXFVNQBSQ-UHFFFAOYSA-N	354.115046546							116234
1-(2-{2-[3-(Trifluoromethyl)phenoxy]ethoxy}ethyl)-1H-1,2,4-triazole	LSM-27690	SID4260476, BRD-K40692795	2199944	InChI=1S/C13H14F3N3O2/c14-13(15,16)11-2-1-3-12(8-11)21-7-6-20-5-4-19-10-17-9-18-19/h1-3,8-10H,4-7H2	ILZYUUFSWRGJKD-UHFFFAOYSA-N	FC(F)(F)c1cccc(OCCOCCn2cncn2)c1	BroadT	BRD-K40692795	BRD-K40692795-001-05-9	ChemBridge Corporation	7716148			FC(F)(F)c1cccc(OCCOCCn2cncn2)c1	InChI=1S/C13H14F3N3O2/c14-13(15,16)11-2-1-3-12(8-11)21-7-6-20-5-4-19-10-17-9-18-19/h1-3,8-10H,4-7H2	ILZYUUFSWRGJKD-UHFFFAOYSA-N	301.103811318							116235
AC1NCAEM	LSM-27691	BRD-K75576822	4555756	InChI=1S/C24H23N3O4S/c1-15(2)11-12-31-18-10-9-16(13-19(18)30-3)14-20-23(29)27-24(32-20)25-22(28)21(26-27)17-7-5-4-6-8-17/h4-10,13-15H,11-12H2,1-3H3	LLGXDNBBUQAQNN-UHFFFAOYSA-N	COc1cc(C=C2SC3=NC(=O)C(=NN3C2=O)c4ccccc4)ccc1OCCC(C)C	BroadT	BRD-K75576822	BRD-K75576822-001-04-2	InterBioScreen Ltd.	STOCK2S-29248			COc1cc(C=c2sc3nc(=O)c(nn3c2=O)-c2ccccc2)ccc1OCCC(C)C	InChI=1S/C24H23N3O4S/c1-15(2)11-12-31-18-10-9-16(13-19(18)30-3)14-20-23(29)27-24(32-20)25-22(28)21(26-27)17-7-5-4-6-8-17/h4-10,13-15H,11-12H2,1-3H3	LLGXDNBBUQAQNN-UHFFFAOYSA-N	449.140926936							116236
3-[(3-Bromophenyl)amino]-2-oxo-2,3-dihydro-1H-indole-3-carbonitrile	LSM-27692	SID26664139, BRD-A94340270	3728994	InChI=1S/C15H10BrN3O/c16-10-4-3-5-11(8-10)19-15(9-17)12-6-1-2-7-13(12)18-14(15)20/h1-8,19H,(H,18,20)	KWLLOZQKTMTYOZ-UHFFFAOYSA-N	Brc1cccc(NC2(C#N)C(=O)Nc3ccccc23)c1	BroadT	BRD-A94340270	BRD-A94340270-001-05-6	InterBioScreen Ltd.	STOCK3S-12955			Brc1cccc(NC2(C#N)C(=O)Nc3ccccc23)c1	InChI=1S/C15H10BrN3O/c16-10-4-3-5-11(8-10)19-15(9-17)12-6-1-2-7-13(12)18-14(15)20/h1-8,19H,(H,18,20)	KWLLOZQKTMTYOZ-UHFFFAOYSA-N	327.00072457							116237
4-Piperidinecarboxamide,n-(4-methylcyclohexyl)-1-pyrazinyl-	LSM-27693	SID853694, BRD-K76652136	656353	InChI=1S/C17H26N4O/c1-13-2-4-15(5-3-13)20-17(22)14-6-10-21(11-7-14)16-12-18-8-9-19-16/h8-9,12-15H,2-7,10-11H2,1H3,(H,20,22)	BHLZLWCQTVYCJE-UHFFFAOYSA-N	CC1CCC(CC1)NC(=O)C2CCN(CC2)c3cnccn3	BroadT	BRD-K76652136	BRD-K76652136-001-06-6	Asinex Ltd.	ASN 06570885			CC1CCC(CC1)NC(=O)C1CCN(CC1)c1cnccn1	InChI=1S/C17H26N4O/c1-13-2-4-15(5-3-13)20-17(22)14-6-10-21(11-7-14)16-12-18-8-9-19-16/h8-9,12-15H,2-7,10-11H2,1H3,(H,20,22)	BHLZLWCQTVYCJE-UHFFFAOYSA-N	302.210661492							116238
MLS000830568	LSM-27694	SID24841563, BRD-K02887938	16197056	InChI=1S/C17H25NO4/c1-3-9-18-16(20)15-11-14(12-7-8-12)13(6-5-10-19)17(22-15)21-4-2/h1,11-14,17,19H,4-10H2,2H3,(H,18,20)/t13-,14-,17-/m0/s1	GPOIXRBWWGESBD-ZQIUZPCESA-N	CCO[C@H]1OC(=C[C@@H](C2CC2)[C@@H]1CCCO)C(=O)NCC#C	BroadT	BRD-K02887938	BRD-K02887938-001-06-7	Harvard University	DHPC11_000886			CCO[C@H]1OC(=C[C@@H](C2CC2)[C@@H]1CCCO)C(=O)NCC#C	InChI=1S/C17H25NO4/c1-3-9-18-16(20)15-11-14(12-7-8-12)13(6-5-10-19)17(22-15)21-4-2/h1,11-14,17,19H,4-10H2,2H3,(H,18,20)/t13-,14-,17-/m0/s1	GPOIXRBWWGESBD-ZQIUZPCESA-N	307.17835829							116239
STK597557	LSM-27695	SID24783630, BRD-A59609656	6460315	InChI=1S/C22H21N5O2/c1-22(2)11-15-18(16(28)12-22)19(14-8-5-6-10-23-14)26-20(24-15)27-21-25-13-7-3-4-9-17(13)29-21/h3-10,19H,11-12H2,1-2H3,(H2,24,25,26,27)	GDVZNNUXEGUATE-UHFFFAOYSA-N	CC1(C)CC(=O)C2=C(C1)N=C(Nc3oc4ccccc4n3)NC2c5ccccn5	BroadT	BRD-A59609656	BRD-A59609656-001-05-1	Asinex Ltd.	BAS 12290705			CC1(C)CC(=O)C2=C(C1)N=C(Nc1nc3ccccc3o1)NC2c1ccccn1	InChI=1S/C22H21N5O2/c1-22(2)11-15-18(16(28)12-22)19(14-8-5-6-10-23-14)26-20(24-15)27-21-25-13-7-3-4-9-17(13)29-21/h3-10,19H,11-12H2,1-2H3,(H2,24,25,26,27)	GDVZNNUXEGUATE-UHFFFAOYSA-N	387.169524962							116240
6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile	LSM-27696	SID17410119, BRD-K24352979	1471070	InChI=1S/C13H11N3O3S/c1-19-13-9(8-14)7-11(12(15)16-13)20(17,18)10-5-3-2-4-6-10/h2-7H,1H3,(H2,15,16)	POFXOAUYEITUSF-UHFFFAOYSA-N	COc1nc(N)c(cc1C#N)S(=O)(=O)c2ccccc2	BroadT	BRD-K24352979	BRD-K24352979-001-05-8	Key Organics Ltd.	2K-512S			COc1nc(N)c(cc1C#N)S(=O)(=O)c1ccccc1	InChI=1S/C13H11N3O3S/c1-19-13-9(8-14)7-11(12(15)16-13)20(17,18)10-5-3-2-4-6-10/h2-7H,1H3,(H2,15,16)	POFXOAUYEITUSF-UHFFFAOYSA-N	289.052111932							116241
MLS000538955	LSM-27697	SID14730134, BRD-K61639240	2243581	InChI=1S/C16H21ClN2O3/c1-11-5-7-19(8-6-11)10-15(20)18-14-9-12(16(21)22-2)3-4-13(14)17/h3-4,9,11H,5-8,10H2,1-2H3,(H,18,20)	VMEHJKKDVHVRQV-UHFFFAOYSA-N	COC(=O)c1ccc(Cl)c(NC(=O)CN2CCC(C)CC2)c1	BroadT	BRD-K61639240	BRD-K61639240-001-05-5	ChemBridge Corporation	7991714			COC(=O)c1ccc(Cl)c(NC(=O)CN2CCC(C)CC2)c1	InChI=1S/C16H21ClN2O3/c1-11-5-7-19(8-6-11)10-15(20)18-14-9-12(16(21)22-2)3-4-13(14)17/h3-4,9,11H,5-8,10H2,1-2H3,(H,18,20)	VMEHJKKDVHVRQV-UHFFFAOYSA-N	324.124070262							116242
SMR000132093	LSM-27698	SID14737596, BRD-K31067689	9551081	InChI=1S/C18H19N3O4S3/c1-25-13-4-5-14-15(11-13)27-18(19-14)20-17(22)12-6-8-21(9-7-12)28(23,24)16-3-2-10-26-16/h2-5,10-12H,6-9H2,1H3,(H,19,20,22)	DFPRYLMPIDXCHP-UHFFFAOYSA-N	COc1ccc2nc(NC(=O)C3CCN(CC3)S(=O)(=O)c4cccs4)sc2c1	BroadT	BRD-K31067689	BRD-K31067689-001-06-2	ChemDiv Inc.	C224-1415			COc1ccc2nc(NC(=O)C3CCN(CC3)S(=O)(=O)c3cccs3)sc2c1	InChI=1S/C18H19N3O4S3/c1-25-13-4-5-14-15(11-13)27-18(19-14)20-17(22)12-6-8-21(9-7-12)28(23,24)16-3-2-10-26-16/h2-5,10-12H,6-9H2,1H3,(H,19,20,22)	DFPRYLMPIDXCHP-UHFFFAOYSA-N	437.053768188							116243
MLS000571693	LSM-44221	SID17412250, BRD-K07562941	1183484	InChI=1S/C18H15Cl2NO4/c1-24-16-10-15(14(20)9-13(16)18(23)25-2)21-17(22)8-5-11-3-6-12(19)7-4-11/h3-10H,1-2H3,(H,21,22)/b8-5+	XHXXQGAUWNULLS-VMPITWQZSA-N	COC(=O)c1cc(Cl)c(NC(=O)\C=C\c2ccc(Cl)cc2)cc1OC	BroadT	BRD-K07562941	BRD-K07562941-001-05-8	ChemBridge Corporation	5941361			COC(=O)c1cc(Cl)c(NC(=O)\C=C\c2ccc(Cl)cc2)cc1OC	InChI=1S/C18H15Cl2NO4/c1-24-16-10-15(14(20)9-13(16)18(23)25-2)21-17(22)8-5-11-3-6-12(19)7-4-11/h3-10H,1-2H3,(H,21,22)/b8-5+	XHXXQGAUWNULLS-VMPITWQZSA-N	379.03781339							
ST50420597	LSM-27700	BRD-K45628893	892902	InChI=1S/C17H19N5O2/c1-14(15-5-7-16(8-6-15)22(23)24)19-21-12-10-20(11-13-21)17-4-2-3-9-18-17/h2-9H,10-13H2,1H3	QFCSRGFPAOMMAE-UHFFFAOYSA-N	CC(=NN1CCN(CC1)c2ccccn2)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-K45628893	BRD-K45628893-001-06-7	ChemBridge Corporation	7184018			CC(=NN1CCN(CC1)c1ccccn1)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C17H19N5O2/c1-14(15-5-7-16(8-6-15)22(23)24)19-21-12-10-20(11-13-21)17-4-2-3-9-18-17/h2-9H,10-13H2,1H3	QFCSRGFPAOMMAE-UHFFFAOYSA-N	325.153874898							116245
CID 25845556	LSM-27701	BRD-A20633493	25845556	InChI=1S/C18H20ClN3O4/c1-10(2)16(22-17(24)12-6-4-5-7-14(12)19)18(25)26-9-15(23)13(8-20)11(3)21/h4-7,10,13,16,21H,9H2,1-3H3,(H,22,24)/t13?,16-/m0/s1	KZPBGGBSVDFJRX-VYIIXAMBSA-N	CC(C)[C@H](NC(=O)c1ccccc1Cl)C(=O)OCC(=O)C(C#N)C(=N)C	BroadT	BRD-A20633493	BRD-A20633493-001-05-4	Enamine Ltd.	T5212674			CC(C)[C@H](NC(=O)c1ccccc1Cl)C(=O)OCC(=O)C(C#N)C(C)=N	InChI=1S/C18H20ClN3O4/c1-10(2)16(22-17(24)12-6-4-5-7-14(12)19)18(25)26-9-15(23)13(8-20)11(3)21/h4-7,10,13,16,21H,9H2,1-3H3,(H,22,24)/t13?,16-/m0/s1	KZPBGGBSVDFJRX-VYIIXAMBSA-N	377.11423386							116246
MLS000543222	LSM-27702	SID17410085, BRD-K39618258	1480507	InChI=1S/C18H12ClN3O/c1-23-14-9-7-12(8-10-14)16-15(11-20)17(19)22-18(21-16)13-5-3-2-4-6-13/h2-10H,1H3	GVCAJCMWYITQHP-UHFFFAOYSA-N	COc1ccc(cc1)c2nc(nc(Cl)c2C#N)c3ccccc3	BroadT	BRD-K39618258	BRD-K39618258-001-06-5	Key Organics Ltd.	1E-194S			COc1ccc(cc1)-c1nc(nc(Cl)c1C#N)-c1ccccc1	InChI=1S/C18H12ClN3O/c1-23-14-9-7-12(8-10-14)16-15(11-20)17(19)22-18(21-16)13-5-3-2-4-6-13/h2-10H,1H3	GVCAJCMWYITQHP-UHFFFAOYSA-N	321.066889744							116247
AC1N6AW5	LSM-27703	SID24833299, BRD-A89441445	4212532	InChI=1S/C18H20N4O3S/c1-12(17-20-15-9-4-5-10-16(15)21-17)19-18(23)13-7-6-8-14(11-13)26(24,25)22(2)3/h4-12H,1-3H3,(H,19,23)(H,20,21)	MDHGRLQRUCJZPE-UHFFFAOYSA-N	CC(NC(=O)c1cccc(c1)S(=O)(=O)N(C)C)c2nc3ccccc3[nH]2	BroadT	BRD-A89441445	BRD-A89441445-001-05-9	Enamine Ltd.	T0504-9038			CC(NC(=O)c1cccc(c1)S(=O)(=O)N(C)C)c1nc2ccccc2[nH]1	InChI=1S/C18H20N4O3S/c1-12(17-20-15-9-4-5-10-16(15)21-17)19-18(23)13-7-6-8-14(11-13)26(24,25)22(2)3/h4-12H,1-3H3,(H,19,23)(H,20,21)	MDHGRLQRUCJZPE-UHFFFAOYSA-N	372.12561123							116248
MLS001368693	LSM-27704	SID50086029, BRD-K66624616	24856265	InChI=1S/C20H33N3/c1-4-5-6-7-11-14-23-19(15-17(2)3)16-21-20(23)22-18-12-9-8-10-13-18/h8-10,12-13,17,19H,4-7,11,14-16H2,1-3H3,(H,21,22)/t19-/m0/s1	QXUKVIGEIGRVAI-IBGZPJMESA-N	CCCCCCCN1[C@@H](CC(C)C)CN=C1Nc2ccccc2	BroadT	BRD-K66624616	BRD-K66624616-001-06-6	Torrey Pines Institute for Molecular Studies	1755-28			CCCCCCCN1[C@@H](CC(C)C)CN=C1Nc1ccccc1	InChI=1S/C20H33N3/c1-4-5-6-7-11-14-23-19(15-17(2)3)16-21-20(23)22-18-12-9-8-10-13-18/h8-10,12-13,17,19H,4-7,11,14-16H2,1-3H3,(H,21,22)/t19-/m0/s1	QXUKVIGEIGRVAI-IBGZPJMESA-N	315.267448086							116249
T0511-8025	LSM-27705	SID24828002, BRD-K82489853	2426562	InChI=1S/C20H20N4O3S2/c1-4-10-23(17(27)12-28-19-22-16(26)11-24(19)14(3)25)20-21-13(2)18(29-20)15-8-6-5-7-9-15/h4-9H,1,10-12H2,2-3H3	RIRFWBYBUNDBHY-UHFFFAOYSA-N	CC(=O)N1CC(=O)N=C1SCC(=O)N(CC=C)c2nc(C)c(s2)c3ccccc3	BroadT	BRD-K82489853	BRD-K82489853-001-07-4	Enamine Ltd.	T0511-8025			CC(=O)N1CC(=O)N=C1SCC(=O)N(CC=C)c1nc(C)c(s1)-c1ccccc1	InChI=1S/C20H20N4O3S2/c1-4-10-23(17(27)12-28-19-22-16(26)11-24(19)14(3)25)20-21-13(2)18(29-20)15-8-6-5-7-9-15/h4-9H,1,10-12H2,2-3H3	RIRFWBYBUNDBHY-UHFFFAOYSA-N	428.09768192							116250
STK649435	LSM-27706	SID17513683, BRD-K15857320	942384	InChI=1S/C18H13N3O2/c22-17-14-10-13-8-4-5-9-15(13)21(16(14)19-18(23)20-17)11-12-6-2-1-3-7-12/h1-10H,11H2,(H,20,22,23)	HXUDVRBCISXVSU-UHFFFAOYSA-N	O=C1NC(=O)C2=Cc3ccccc3N(Cc4ccccc4)C2=N1	BroadT	BRD-K15857320	BRD-K15857320-001-03-8	InterBioScreen Ltd.	STOCK4S-53397			O=c1nc2n(Cc3ccccc3)c3ccccc3cc2c(=O)[nH]1	InChI=1S/C18H13N3O2/c22-17-14-10-13-8-4-5-9-15(13)21(16(14)19-18(23)20-17)11-12-6-2-1-3-7-12/h1-10H,11H2,(H,20,22,23)	HXUDVRBCISXVSU-UHFFFAOYSA-N	303.100776686							116251
ST50850657	LSM-27707	SID4263467, BRD-K01479216	971039	InChI=1S/C13H13N3O3/c1-9-7-14-16(8-9)13(18)15-11-6-4-3-5-10(11)12(17)19-2/h3-8H,1-2H3,(H,15,18)	QFZYKCOJMOPUGB-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)n2cc(C)cn2	BroadT	BRD-K01479216	BRD-K01479216-001-06-7	ChemBridge Corporation	7812105			COC(=O)c1ccccc1NC(=O)n1cc(C)cn1	InChI=1S/C13H13N3O3/c1-9-7-14-16(8-9)13(18)15-11-6-4-3-5-10(11)12(17)19-2/h3-8H,1-2H3,(H,15,18)	QFZYKCOJMOPUGB-UHFFFAOYSA-N	259.095691306							116252
EN300-05738	LSM-27708	SID24831370, BRD-A35743566	3407389	InChI=1S/C16H13N3O3S/c1-9(16(21)22)23-8-10-6-14(20)19-13-5-3-2-4-12(13)18-15(19)11(10)7-17/h2-6,9,20H,8H2,1H3,(H,21,22)	DIQZWHKBVGVFQQ-UHFFFAOYSA-N	CC(SCc1cc(O)n2c3ccccc3nc2c1C#N)C(=O)O	BroadT	BRD-A35743566	BRD-A35743566-001-05-6	Enamine Ltd.	T0517-6116			CC(SCc1cc(O)n2c(nc3ccccc23)c1C#N)C(O)=O	InChI=1S/C16H13N3O3S/c1-9(16(21)22)23-8-10-6-14(20)19-13-5-3-2-4-12(13)18-15(19)11(10)7-17/h2-6,9,20H,8H2,1H3,(H,21,22)	DIQZWHKBVGVFQQ-UHFFFAOYSA-N	327.067761996							
ST50326808	LSM-27709	SID4263342, BRD-K03370557	2218825	InChI=1S/C18H20O5/c1-3-21-17(19)10-22-15-9-14-12-6-4-5-7-13(12)18(20)23-16(14)8-11(15)2/h8-9H,3-7,10H2,1-2H3	XKLZQYJZLXDQHE-UHFFFAOYSA-N	CCOC(=O)COc1cc2C3=C(CCCC3)C(=O)Oc2cc1C	BroadT	BRD-K03370557	BRD-K03370557-001-05-5	ChemBridge Corporation	7910846			CCOC(=O)COc1cc2c3CCCCc3c(=O)oc2cc1C	InChI=1S/C18H20O5/c1-3-21-17(19)10-22-15-9-14-12-6-4-5-7-13(12)18(20)23-16(14)8-11(15)2/h8-9H,3-7,10H2,1-2H3	XKLZQYJZLXDQHE-UHFFFAOYSA-N	316.13107374							116254
MLS000516810	LSM-27710	SID124360058, SID24830623, BRD-K10453547	2484453	InChI=1S/C18H16ClN3O3S/c1-25-11-6-7-14-15(10-11)26-18(21-14)22-16(23)8-9-20-17(24)12-4-2-3-5-13(12)19/h2-7,10H,8-9H2,1H3,(H,20,24)(H,21,22,23)	SKKYWAALJLNZAD-UHFFFAOYSA-N	COc1ccc2nc(NC(=O)CCNC(=O)c3ccccc3Cl)sc2c1	BroadT	BRD-K10453547	BRD-K10453547-001-06-1	Enamine Ltd.	T5285551			COc1ccc2nc(NC(=O)CCNC(=O)c3ccccc3Cl)sc2c1	InChI=1S/C18H16ClN3O3S/c1-25-11-6-7-14-15(10-11)26-18(21-14)22-16(23)8-9-20-17(24)12-4-2-3-5-13(12)19/h2-7,10H,8-9H2,1H3,(H,20,24)(H,21,22,23)	SKKYWAALJLNZAD-UHFFFAOYSA-N	389.060089802							116255
SMR000013667	LSM-27711	SID26667570, SID844327, BRD-A72371933	646647	InChI=1S/C24H30N2O6/c1-28-20-11-15(12-21(29-2)23(20)30-3)22(24(27)26-16-7-5-4-6-8-16)25-17-9-10-18-19(13-17)32-14-31-18/h9-13,16,22,25H,4-8,14H2,1-3H3,(H,26,27)	KPLDGBRMQQHKJO-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(Nc2ccc3OCOc3c2)C(=O)NC4CCCCC4	BroadT	BRD-A72371933	BRD-A72371933-001-05-6	Asinex Ltd.	BAS 06264612			COc1cc(cc(OC)c1OC)C(Nc1ccc2OCOc2c1)C(=O)NC1CCCCC1	InChI=1S/C24H30N2O6/c1-28-20-11-15(12-21(29-2)23(20)30-3)22(24(27)26-16-7-5-4-6-8-16)25-17-9-10-18-19(13-17)32-14-31-18/h9-13,16,22,25H,4-8,14H2,1-3H3,(H,26,27)	KPLDGBRMQQHKJO-UHFFFAOYSA-N	442.2103867							116256
MLS000582782	LSM-27712	SID17413190, BRD-K70238113	2236636	InChI=1S/C11H13BrN2O3S/c1-17-9-3-2-7(6-8(9)12)10(16)14-11(18)13-4-5-15/h2-3,6,15H,4-5H2,1H3,(H2,13,14,16,18)	MOZZCSKTILCGTM-UHFFFAOYSA-N	COc1ccc(cc1Br)C(=O)NC(=S)NCCO	BroadT	BRD-K70238113	BRD-K70238113-001-06-7	ChemBridge Corporation	7977564			COc1ccc(cc1Br)C(=O)NC(=S)NCCO	InChI=1S/C11H13BrN2O3S/c1-17-9-3-2-7(6-8(9)12)10(16)14-11(18)13-4-5-15/h2-3,6,15H,4-5H2,1H3,(H2,13,14,16,18)	MOZZCSKTILCGTM-UHFFFAOYSA-N	331.983025586							116257
ST027159	LSM-27713	SID17407832, BRD-K69929163	3147216	InChI=1S/C18H14N6O3/c1-23-16(15(10-19-23)24(26)27)18(25)20-12-8-6-11(7-9-12)17-21-13-4-2-3-5-14(13)22-17/h2-10H,1H3,(H,20,25)(H,21,22)	VMHHZDBQXJXGAX-UHFFFAOYSA-N	Cn1ncc(c1C(=O)Nc2ccc(cc2)c3nc4ccccc4[nH]3)[N+](=O)[O-]	BroadT	BRD-K69929163	BRD-K69929163-001-05-5	Asinex Ltd.	BAS 03421708			Cn1ncc(c1C(=O)Nc1ccc(cc1)-c1nc2ccccc2[nH]1)[N+]([O-])=O	InChI=1S/C18H14N6O3/c1-23-16(15(10-19-23)24(26)27)18(25)20-12-8-6-11(7-9-12)17-21-13-4-2-3-5-14(13)22-17/h2-10H,1H3,(H,20,25)(H,21,22)	VMHHZDBQXJXGAX-UHFFFAOYSA-N	362.112738368							116258
AC1MRSO7	LSM-27714	BRD-K59273601	3473346	InChI=1S/C21H20ClN5O3/c1-14(25-26-21(29)20-18(22)12-23-27(20)2)15-7-6-8-16(11-15)24-19(28)13-30-17-9-4-3-5-10-17/h3-12H,13H2,1-2H3,(H,24,28)(H,26,29)	XLNLFKUQTGIGBS-UHFFFAOYSA-N	CC(=NNC(=O)c1c(Cl)cnn1C)c2cccc(NC(=O)COc3ccccc3)c2	BroadT	BRD-K59273601	BRD-K59273601-001-05-0	Specs	AK-968/40708833			CC(=NNC(=O)c1c(Cl)cnn1C)c1cccc(NC(=O)COc2ccccc2)c1	InChI=1S/C21H20ClN5O3/c1-14(25-26-21(29)20-18(22)12-23-27(20)2)15-7-6-8-16(11-15)24-19(28)13-30-17-9-4-3-5-10-17/h3-12H,13H2,1-2H3,(H,24,28)(H,26,29)	XLNLFKUQTGIGBS-UHFFFAOYSA-N	425.12546726							116259
AC1MW0YT	LSM-27715	BRD-K80365613	3692078	InChI=1S/C15H20N4S/c1-11-7-13(9-15(2,3)8-11)18-19-14(20)17-12-5-4-6-16-10-12/h4-7,10H,8-9H2,1-3H3,(H2,17,19,20)	GQPRFYNCYULXIG-UHFFFAOYSA-N	CC1=CC(=NN=C(S)Nc2cccnc2)CC(C)(C)C1	BroadT	BRD-K80365613	BRD-K80365613-001-05-3	Enamine Ltd.	T0509-1037			CC1=CC(CC(C)(C)C1)=NN=C(S)Nc1cccnc1	InChI=1S/C15H20N4S/c1-11-7-13(9-15(2,3)8-11)18-19-14(20)17-12-5-4-6-16-10-12/h4-7,10H,8-9H2,1-3H3,(H2,17,19,20)	GQPRFYNCYULXIG-UHFFFAOYSA-N	288.14086737							116260
MLS000095128	LSM-27716	SID24838642, SID4248851, BRD-K68928072	3242874	InChI=1S/C23H27N3O5S/c1-2-25-16-20(23(28)24-15-17-8-7-13-31-17)22(27)19-14-18(9-10-21(19)25)32(29,30)26-11-5-3-4-6-12-26/h7-10,13-14,16H,2-6,11-12,15H2,1H3,(H,24,28)	JIGPFXZXYSFAGH-UHFFFAOYSA-N	CCN1C=C(C(=O)NCc2occc2)C(=O)c3cc(ccc13)S(=O)(=O)N4CCCCCC4	BroadT	BRD-K68928072	BRD-K68928072-001-05-8	ChemDiv Inc.	C519-1628			CCn1cc(C(=O)NCc2ccco2)c(=O)c2cc(ccc12)S(=O)(=O)N1CCCCCC1	InChI=1S/C23H27N3O5S/c1-2-25-16-20(23(28)24-15-17-8-7-13-31-17)22(27)19-14-18(9-10-21(19)25)32(29,30)26-11-5-3-4-6-12-26/h7-10,13-14,16H,2-6,11-12,15H2,1H3,(H,24,28)	JIGPFXZXYSFAGH-UHFFFAOYSA-N	457.167141684							116261
MLS000834504	LSM-27717	SID24779731, BRD-K94579643	16187139	InChI=1S/C34H34N2O6S/c37-19-23-5-7-24(8-6-23)20-39-33-17-26(28-21-43-32-4-2-1-3-27(28)32)16-31(42-33)34(38)36-13-11-35(12-14-36)18-25-9-10-29-30(15-25)41-22-40-29/h1-10,15-16,21,26,33,37H,11-14,17-20,22H2/t26-,33+/m0/s1	CYKOLZWTLFGEPE-OOOSNSGVSA-N	OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6csc7ccccc67)cc1	BroadT	BRD-K94579643	BRD-K94579643-001-08-1	Harvard University	((2R,4R)-4-(benzo[b]thiophen-3-yl)-2-(4-(hydroxymethyl)benzyloxy)-3,4-dihydro-2H-pyran-6-yl)(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)methanone DHPC11_001122			OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)c2csc3ccccc23)cc1	InChI=1S/C34H34N2O6S/c37-19-23-5-7-24(8-6-23)20-39-33-17-26(28-21-43-32-4-2-1-3-27(28)32)16-31(42-33)34(38)36-13-11-35(12-14-36)18-25-9-10-29-30(15-25)41-22-40-29/h1-10,15-16,21,26,33,37H,11-14,17-20,22H2/t26-,33+/m0/s1	CYKOLZWTLFGEPE-OOOSNSGVSA-N	598.213757518							116262
Methanone, (4-chloro-5-hydroxy-3-benzofuranyl)phenyl-	LSM-27718	SID863447, BRD-K35447486	664699	InChI=1S/C15H9ClO3/c16-14-11(17)6-7-12-13(14)10(8-19-12)15(18)9-4-2-1-3-5-9/h1-8,17H	NYSBKDYDLJWGPN-UHFFFAOYSA-N	Oc1ccc2occ(C(=O)c3ccccc3)c2c1Cl	BroadT	BRD-K35447486	BRD-K35447486-001-06-7	InterBioScreen Ltd.	STOCK4S-72703			Oc1ccc2occ(C(=O)c3ccccc3)c2c1Cl	InChI=1S/C15H9ClO3/c16-14-11(17)6-7-12-13(14)10(8-19-12)15(18)9-4-2-1-3-5-9/h1-8,17H	NYSBKDYDLJWGPN-UHFFFAOYSA-N	272.024021858							116263
ZINC00549048	LSM-44222	SID47202209, BRD-K98660933	948732	InChI=1S/C15H13ClN2O2/c1-20-13-7-3-2-5-11(13)8-9-14(19)18-12-6-4-10-17-15(12)16/h2-10H,1H3,(H,18,19)/b9-8+	OVIMJAMJRIMNPH-CMDGGOBGSA-N	COc1ccccc1\C=C\C(=O)Nc2cccnc2Cl	BroadT	BRD-K98660933	BRD-K98660933-001-05-0	Vitas-M Laboratory Ltd.	STK071689			COc1ccccc1\C=C\C(=O)Nc1cccnc1Cl	InChI=1S/C15H13ClN2O2/c1-20-13-7-3-2-5-11(13)8-9-14(19)18-12-6-4-10-17-15(12)16/h2-10H,1H3,(H,18,19)/b9-8+	OVIMJAMJRIMNPH-CMDGGOBGSA-N	288.066555386							
MLS000591748	LSM-27720	SID17513924, BRD-K46306463	6411721	InChI=1S/C25H23N5O3/c1-17-5-4-6-19(15-17)26-25-21-8-3-2-7-20(21)24(27-28-25)18-9-10-22(23(16-18)30(31)32)29-11-13-33-14-12-29/h2-10,15-16H,11-14H2,1H3,(H,26,28)	RLDJXJNLXMWGOA-UHFFFAOYSA-N	Cc1cccc(Nc2nnc(c3ccc(N4CCOCC4)c(c3)[N+](=O)[O-])c5ccccc25)c1	BroadT	BRD-K46306463	BRD-K46306463-001-06-9	InterBioScreen Ltd.	STOCK3S-56743			Cc1cccc(Nc2nnc(-c3ccc(N4CCOCC4)c(c3)[N+]([O-])=O)c3ccccc23)c1	InChI=1S/C25H23N5O3/c1-17-5-4-6-19(15-17)26-25-21-8-3-2-7-20(21)24(27-28-25)18-9-10-22(23(16-18)30(31)32)29-11-13-33-14-12-29/h2-10,15-16H,11-14H2,1H3,(H,26,28)	RLDJXJNLXMWGOA-UHFFFAOYSA-N	441.180089646							116265
ZINC00050049	LSM-27721	SID856812, BRD-K85430673	658166	InChI=1S/C13H14N2O3S/c1-4-18-12(17)7-19-13-10(6-14)5-11(9(3)16)8(2)15-13/h5H,4,7H2,1-3H3	FBFOMFWBVIXBMA-UHFFFAOYSA-N	CCOC(=O)CSc1nc(C)c(cc1C#N)C(=O)C	BroadT	BRD-K85430673	BRD-K85430673-001-05-7	InterBioScreen Ltd.	STOCK1S-30240			CCOC(=O)CSc1nc(C)c(cc1C#N)C(C)=O	InChI=1S/C13H14N2O3S/c1-4-18-12(17)7-19-13-10(6-14)5-11(9(3)16)8(2)15-13/h5H,4,7H2,1-3H3	FBFOMFWBVIXBMA-UHFFFAOYSA-N	278.072513018							116266
MLS000530682	LSM-27722	SID14732084, BRD-K52316915	1161100	InChI=1S/C18H17Cl2N3O2/c1-11-16(21-10-12-8-13(19)9-15(20)17(12)24)18(25)23(22(11)2)14-6-4-3-5-7-14/h3-9,21,24H,10H2,1-2H3	WZSRQXOFFNGVLZ-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)NCc2cc(Cl)cc(Cl)c2O)c3ccccc3	BroadT	BRD-K52316915	BRD-K52316915-001-06-3	ChemBridge Corporation	6524175			Cc1c(NCc2cc(Cl)cc(Cl)c2O)c(=O)n(-c2ccccc2)n1C	InChI=1S/C18H17Cl2N3O2/c1-11-16(21-10-12-8-13(19)9-15(20)17(12)24)18(25)23(22(11)2)14-6-4-3-5-7-14/h3-9,21,24H,10H2,1-2H3	WZSRQXOFFNGVLZ-UHFFFAOYSA-N	377.069782234							116267
T5318385	LSM-27723	SID24831387, BRD-K57951152	2460969	InChI=1S/C21H25N3O2S/c1-13-7-9-24(10-8-13)20-19-16(12-27-21(19)23-14(2)22-20)15-5-6-17(25-3)18(11-15)26-4/h5-6,11-13H,7-10H2,1-4H3	QAXNAVOAQMKWLX-UHFFFAOYSA-N	COc1ccc(cc1OC)c2csc3nc(C)nc(N4CCC(C)CC4)c23	BroadT	BRD-K57951152	BRD-K57951152-001-06-4	Enamine Ltd.	T5318385			COc1ccc(cc1OC)-c1csc2nc(C)nc(N3CCC(C)CC3)c12	InChI=1S/C21H25N3O2S/c1-13-7-9-24(10-8-13)20-19-16(12-27-21(19)23-14(2)22-20)15-5-6-17(25-3)18(11-15)26-4/h5-6,11-13H,7-10H2,1-4H3	QAXNAVOAQMKWLX-UHFFFAOYSA-N	383.16674776							116268
AC1LQXVX	LSM-15228	BRD-K09706799	1358886	InChI=1S/C23H19N2OS2/c26-21(19-10-8-18(9-11-19)17-5-2-1-3-6-17)15-24-12-13-25-20(16-28-23(24)25)22-7-4-14-27-22/h1-11,14,16H,12-13,15H2/q+1	QNXBHVSYEIXHAP-UHFFFAOYSA-N	O=C(CN1CC[n+]2c(csc12)c3cccs3)c4ccc(cc4)c5ccccc5	BroadT	BRD-K09706799	BRD-K09706799-004-07-2	ChemBridge Corporation	5963981		Br	O=C(CN1CC[n+]2c(csc12)-c1cccs1)c1ccc(cc1)-c1ccccc1.Br	InChI=1S/C23H19N2OS2.BrH/c26-21(19-10-8-18(9-11-19)17-5-2-1-3-6-17)15-24-12-13-25-20(16-28-23(24)25)22-7-4-14-27-22;/h1-11,14,16H,12-13,15H2;1H/q+1;	LZJUYKOKJXBBGO-UHFFFAOYSA-N	403.093879628							103875, 103875
MLS000730626	LSM-27724	SID24810490, BRD-K18604957	16193114	InChI=1S/C21H24N6O3/c1-16-6-5-9-19(14-16)25-23-21(27(29)30)20(26(25)28)22-18-10-12-24(13-11-18)15-17-7-3-2-4-8-17/h2-9,14,18,22H,10-13,15H2,1H3	YWIAIAUFWCOZIR-UHFFFAOYSA-N	Cc1cccc(c1)n2nc(c(NC3CCN(Cc4ccccc4)CC3)[n+]2[O-])[N+](=O)[O-]	BroadT	BRD-K18604957	BRD-K18604957-001-05-6	ChemDiv Inc.	C301-0196			Cc1cccc(c1)-n1nc(c(NC2CCN(Cc3ccccc3)CC2)[n+]1[O-])[N+]([O-])=O	InChI=1S/C21H24N6O3/c1-16-6-5-9-19(14-16)25-23-21(27(29)30)20(26(25)28)22-18-10-12-24(13-11-18)15-17-7-3-2-4-8-17/h2-9,14,18,22H,10-13,15H2,1H3	YWIAIAUFWCOZIR-UHFFFAOYSA-N	408.190988688							
BRD-K05956735	LSM-27725	SID4255740		InChI=1S/C16H14N2O3/c1-11-15(13-7-4-3-5-8-13)18(20)16(12(2)17(11)19)14-9-6-10-21-14/h3-10H,1-2H3	TXQSLPNOAMHPEH-UHFFFAOYSA-N	Cc1c(c2occc2)[n+]([O-])c(c(C)[n+]1[O-])c3ccccc3	BroadT	BRD-K05956735	BRD-K05956735-001-06-2	ChemBridge Corporation	5212595			Cc1c(-c2ccco2)[n+]([O-])c(-c2ccccc2)c(C)[n+]1[O-]	InChI=1S/C16H14N2O3/c1-11-15(13-7-4-3-5-8-13)18(20)16(12(2)17(11)19)14-9-6-10-21-14/h3-10H,1-2H3	TXQSLPNOAMHPEH-UHFFFAOYSA-N	282.100442328							116270
AMBCB33186140	LSM-27726	SID24798802, BRD-K28709496	16190473	InChI=1S/C24H27N5/c1-19-8-10-23(11-9-19)29-18-22(17-25-12-4-14-28-15-5-13-26-28)24(27-29)21-7-3-6-20(2)16-21/h3,5-11,13,15-16,18,25H,4,12,14,17H2,1-2H3	WTEOAHRLJGTWRZ-UHFFFAOYSA-N	Cc1ccc(cc1)n2cc(CNCCCn3cccn3)c(n2)c4cccc(C)c4	BroadT	BRD-K28709496	BRD-K28709496-001-06-7	ChemBridge Corporation	33186140			Cc1ccc(cc1)-n1cc(CNCCCn2cccn2)c(n1)-c1cccc(C)c1	InChI=1S/C24H27N5/c1-19-8-10-23(11-9-19)29-18-22(17-25-12-4-14-28-15-5-13-26-28)24(27-29)21-7-3-6-20(2)16-21/h3,5-11,13,15-16,18,25H,4,12,14,17H2,1-2H3	WTEOAHRLJGTWRZ-UHFFFAOYSA-N	385.226645914							116271
T5270104	LSM-27727	SID3711209, BRD-A73593888	2997547	InChI=1S/C19H25ClN4O5S/c1-13(2)11-16-18(26)24(19(27)21-16)12-17(25)22-7-9-23(10-8-22)30(28,29)15-5-3-14(20)4-6-15/h3-6,13,16H,7-12H2,1-2H3,(H,21,27)	XJIIAAZPYVZDQY-UHFFFAOYSA-N	CC(C)CC1NC(=O)N(CC(=O)N2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3)C1=O	BroadT	BRD-A73593888	BRD-A73593888-001-05-9	Enamine Ltd.	T5270104			CC(C)CC1NC(=O)N(CC(=O)N2CCN(CC2)S(=O)(=O)c2ccc(Cl)cc2)C1=O	InChI=1S/C19H25ClN4O5S/c1-13(2)11-16-18(26)24(19(27)21-16)12-17(25)22-7-9-23(10-8-22)30(28,29)15-5-3-14(20)4-6-15/h3-6,13,16H,7-12H2,1-2H3,(H,21,27)	XJIIAAZPYVZDQY-UHFFFAOYSA-N	456.12341834							116272
ST50902035	LSM-27728	SID49819178, BRD-K06458049	1256983	InChI=1S/C21H13ClFN3O/c22-17-5-3-4-15-16(21(27)25-14-9-7-13(23)8-10-14)12-19(26-20(15)17)18-6-1-2-11-24-18/h1-12H,(H,25,27)	QUWNMQDSZCLYIZ-UHFFFAOYSA-N	Fc1ccc(NC(=O)c2cc(nc3c(Cl)cccc23)c4ccccn4)cc1	BroadT	BRD-K06458049	BRD-K06458049-001-05-1	ChemBridge Corporation	7922576			Fc1ccc(NC(=O)c2cc(nc3c(Cl)cccc23)-c2ccccn2)cc1	InChI=1S/C21H13ClFN3O/c22-17-5-3-4-15-16(21(27)25-14-9-7-13(23)8-10-14)12-19(26-20(15)17)18-6-1-2-11-24-18/h1-12H,(H,25,27)	QUWNMQDSZCLYIZ-UHFFFAOYSA-N	377.073117976							116273
(5-Phenoxymethyl-4-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetonitrile	LSM-27729	SID14721676, BRD-K92564655	3167004	InChI=1S/C17H14N4OS/c18-11-12-23-17-20-19-16(13-22-15-9-5-2-6-10-15)21(17)14-7-3-1-4-8-14/h1-10H,12-13H2	DPCLCSVUTDYVOW-UHFFFAOYSA-N	N#CCSc1nnc(COc2ccccc2)n1c3ccccc3	BroadT	BRD-K92564655	BRD-K92564655-001-05-6	Asinex Ltd.	ASN 02073309			N#CCSc1nnc(COc2ccccc2)n1-c1ccccc1	InChI=1S/C17H14N4OS/c18-11-12-23-17-20-19-16(13-22-15-9-5-2-6-10-15)21(17)14-7-3-1-4-8-14/h1-10H,12-13H2	DPCLCSVUTDYVOW-UHFFFAOYSA-N	322.088831798							116274
SMR000126873	LSM-27730	SID14736316, BRD-K12155719	3373841	InChI=1S/C20H19N3O3/c24-18(13-25-17-8-2-1-3-9-17)21-20-23-22-19(26-20)16-11-10-14-6-4-5-7-15(14)12-16/h1-3,8-12H,4-7,13H2,(H,21,23,24)	WPPQCGYTXQLEKO-UHFFFAOYSA-N	O=C(COc1ccccc1)Nc2oc(nn2)c3ccc4CCCCc4c3	BroadT	BRD-K12155719	BRD-K12155719-001-05-4	Life Chemicals Inc.	F0608-0653			O=C(COc1ccccc1)Nc1nnc(o1)-c1ccc2CCCCc2c1	InChI=1S/C20H19N3O3/c24-18(13-25-17-8-2-1-3-9-17)21-20-23-22-19(26-20)16-11-10-14-6-4-5-7-15(14)12-16/h1-3,8-12H,4-7,13H2,(H,21,23,24)	WPPQCGYTXQLEKO-UHFFFAOYSA-N	349.142641498							116275
Moronic acid	LSM-27731	Moronicacid, Moronic Acid	489941	InChI=1S/C30H46O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h18-19,21-22H,8-17H2,1-7H3,(H,32,33)/t19-,21+,22-,27+,28-,29-,30+/m1/s1	UMYJVVZWBKIXQQ-QALSDZMNSA-N	CC1(C)CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)C2=C1)C(=O)O	BroadT	BRD-K09497516	BRD-K09497516-001-06-8	University of North Carolina at Chapel Hill	Moronic acid LL-61			CC1(C)CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)C2=C1)C(O)=O	InChI=1S/C30H46O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h18-19,21-22H,8-17H2,1-7H3,(H,32,33)/t19-,21+,22-,27+,28-,29-,30+/m1/s1	UMYJVVZWBKIXQQ-QALSDZMNSA-N	454.344695332							30815
SMR000024607	LSM-44223	SID4240475, BRD-K35991078	3235580	InChI=1S/C13H14N2O2S/c1-3-15-12(16)11(17-13(15)18)9-14(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3/b11-9-	XGSVSNJXIXEAEW-LUAWRHEFSA-N	CCN1C(=S)O\C(=C/N(C)c2ccccc2)\C1=O	BroadT	BRD-K35991078	BRD-K35991078-001-06-8	ChemDiv Inc.	4311-2602			CCN1C(=S)O\C(C1=O)=C/N(C)c1ccccc1	InChI=1S/C13H14N2O2S/c1-3-15-12(16)11(17-13(15)18)9-14(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3/b11-9-	XGSVSNJXIXEAEW-LUAWRHEFSA-N	262.077598398							
MLS000679554	LSM-27733	SID24792994, BRD-K22870438	6470323	InChI=1S/C16H14N2O5/c19-16(18-11-2-4-13-15(8-11)23-9-22-13)17-10-1-3-12-14(7-10)21-6-5-20-12/h1-4,7-8H,5-6,9H2,(H2,17,18,19)	XEOBUSLELWJDNO-UHFFFAOYSA-N	O=C(Nc1ccc2OCCOc2c1)Nc3ccc4OCOc4c3	BroadT	BRD-K22870438	BRD-K22870438-001-05-6	ChemBridge Corporation	9054465			O=C(Nc1ccc2OCOc2c1)Nc1ccc2OCCOc2c1	InChI=1S/C16H14N2O5/c19-16(18-11-2-4-13-15(8-11)23-9-22-13)17-10-1-3-12-14(7-10)21-6-5-20-12/h1-4,7-8H,5-6,9H2,(H2,17,18,19)	XEOBUSLELWJDNO-UHFFFAOYSA-N	314.090271568							116277
2-Phenyl-5-[1-(phenylsulfonyl)-1H-pyrazol-3-yl]-1,3-thiazole	LSM-27734	SID17411039, BRD-K35844062	1476736	InChI=1S/C18H13N3O2S2/c22-25(23,15-9-5-2-6-10-15)21-12-11-16(20-21)17-13-19-18(24-17)14-7-3-1-4-8-14/h1-13H	ZZZPZDFBUDZIOU-UHFFFAOYSA-N	O=S(=O)(c1ccccc1)n2ccc(n2)c3cnc(s3)c4ccccc4	BroadT	BRD-K35844062	BRD-K35844062-001-05-9	Key Organics Ltd.	4M-022			O=S(=O)(c1ccccc1)n1ccc(n1)-c1cnc(s1)-c1ccccc1	InChI=1S/C18H13N3O2S2/c22-25(23,15-9-5-2-6-10-15)21-12-11-16(20-21)17-13-19-18(24-17)14-7-3-1-4-8-14/h1-13H	ZZZPZDFBUDZIOU-UHFFFAOYSA-N	367.044918066							131282
UPCMLD04ASTW002108	LSM-27735	SID24708211, SID17384899, BRD-K79731829	3247282	InChI=1S/C29H32N2O3/c1-21(27(32)30-19-22-12-6-3-7-13-22)25-18-29(25,2)26(24-16-10-5-11-17-24)31-28(33)34-20-23-14-8-4-9-15-23/h3-17,21,25-26H,18-20H2,1-2H3,(H,30,32)(H,31,33)/t21-,25-,26-,29+/m1/s1	WQTGKLHQESDVBY-UXJUWBFNSA-N	C[C@H]([C@H]1C[C@]1(C)[C@H](NC(=O)OCc2ccccc2)c3ccccc3)C(=O)NCc4ccccc4	BroadT	BRD-K79731829	BRD-K79731829-001-06-7	University of Pittsburgh CMLD	UPCMLD04ASTW002108			C[C@H]([C@H]1C[C@]1(C)[C@H](NC(=O)OCc1ccccc1)c1ccccc1)C(=O)NCc1ccccc1	InChI=1S/C29H32N2O3/c1-21(27(32)30-19-22-12-6-3-7-13-22)25-18-29(25,2)26(24-16-10-5-11-17-24)31-28(33)34-20-23-14-8-4-9-15-23/h3-17,21,25-26H,18-20H2,1-2H3,(H,30,32)(H,31,33)/t21-,25-,26-,29+/m1/s1	WQTGKLHQESDVBY-UXJUWBFNSA-N	456.241292904							116280
AC1LCYIU	LSM-27736	BRD-K00036163	658342	InChI=1S/C19H22N4S/c1-4-10-22(11-5-1)12-13-23-18-9-3-2-8-17(18)21-19(23)20-15-16-7-6-14-24-16/h2-3,6-9,14-15H,1,4-5,10-13H2	SIHXQHBGFVHAIS-UHFFFAOYSA-N	C(Cn1c(N=Cc2cccs2)nc3ccccc13)N4CCCCC4	BroadT	BRD-K00036163	BRD-K00036163-001-05-1	InterBioScreen Ltd.	STOCK1S-44087			C(Cn1c(N=Cc2cccs2)nc2ccccc12)N1CCCCC1	InChI=1S/C19H22N4S/c1-4-10-22(11-5-1)12-13-23-18-9-3-2-8-17(18)21-19(23)20-15-16-7-6-14-24-16/h2-3,6-9,14-15H,1,4-5,10-13H2	SIHXQHBGFVHAIS-UHFFFAOYSA-N	338.156517434							116281
Quinoxaline-6-carboxylic acid phenyl ester	LSM-27737	SID842757, BRD-K44423472	645032	InChI=1S/C15H10N2O2/c18-15(19-12-4-2-1-3-5-12)11-6-7-13-14(10-11)17-9-8-16-13/h1-10H	UEQNCAKZYBRWBL-UHFFFAOYSA-N	O=C(Oc1ccccc1)c2ccc3nccnc3c2	BroadT	BRD-K44423472	BRD-K44423472-001-05-5	Asinex Ltd.	BAS 01963778			O=C(Oc1ccccc1)c1ccc2nccnc2c1	InChI=1S/C15H10N2O2/c18-15(19-12-4-2-1-3-5-12)11-6-7-13-14(10-11)17-9-8-16-13/h1-10H	UEQNCAKZYBRWBL-UHFFFAOYSA-N	250.07422758							116282
BAS 01365261	LSM-15407	BRD-A04031618	3130802	InChI=1S/C20H27N3O2/c1-2-3-4-5-8-13-22-16-10-6-7-11-17(16)23(20(22)21)15-18(24)19-12-9-14-25-19/h6-7,9-12,14,18,21,24H,2-5,8,13,15H2,1H3	GANLGRNROBRFHX-UHFFFAOYSA-N	CCCCCCCN1C(=N)N(CC(O)c2occc2)c3ccccc13	BroadT	BRD-A04031618	BRD-A04031618-003-05-7	Asinex Ltd.	BAS 01365261		Cl	CCCCCCCn1c2ccccc2n(CC(O)c2ccco2)c1=N.Cl	InChI=1S/C20H27N3O2.ClH/c1-2-3-4-5-8-13-22-16-10-6-7-11-17(16)23(20(22)21)15-18(24)19-12-9-14-25-19;/h6-7,9-12,14,18,21,24H,2-5,8,13,15H2,1H3;1H	DHWSYTIATYZFGL-UHFFFAOYSA-N	341.210327134							104049, 104049
1-(3-Chlorophenyl)-3-pyridin-4-ylurea	LSM-27738	SID49823707, BRD-K53371258	4620841	InChI=1S/C12H10ClN3O/c13-9-2-1-3-11(8-9)16-12(17)15-10-4-6-14-7-5-10/h1-8H,(H2,14,15,16,17)	QGFXRTDUZHCUGA-UHFFFAOYSA-N	Clc1cccc(NC(=O)Nc2ccncc2)c1	BroadT	BRD-K53371258	BRD-K53371258-001-05-4	Chemical Technologies & Investigations	AMNCO-30045			Clc1cccc(NC(=O)Nc2ccncc2)c1	InChI=1S/C12H10ClN3O/c13-9-2-1-3-11(8-9)16-12(17)15-10-4-6-14-7-5-10/h1-8H,(H2,14,15,16,17)	QGFXRTDUZHCUGA-UHFFFAOYSA-N	247.05123968							116283
AC1OADW7	LSM-27739	BRD-K46665919	6803176	InChI=1S/C13H11N5O2/c14-12-13(18-20-17-12)16-15-7-10-9-4-2-1-3-8(9)5-6-11(10)19/h1-7,19H,(H2,14,17)(H,16,18)	QQNWJPFMAYYSPQ-UHFFFAOYSA-N	Nc1nonc1NN=Cc2c(O)ccc3ccccc23	BroadT	BRD-K46665919	BRD-K46665919-001-05-0	Asinex Ltd.	BAS 00450516			Nc1nonc1NN=Cc1c(O)ccc2ccccc12	InChI=1S/C13H11N5O2/c14-12-13(18-20-17-12)16-15-7-10-9-4-2-1-3-8(9)5-6-11(10)19/h1-7,19H,(H2,14,17)(H,16,18)	QQNWJPFMAYYSPQ-UHFFFAOYSA-N	269.091274642							
GNF-PF-4157	LSM-27740	GNF-PF-4157, BRD-K03591115	658464	InChI=1S/C24H26N2O5/c1-29-22-12-17-18(13-23(22)30-2)20(26-8-10-31-11-9-26)15-21(27)19(17)14-24(28)25-16-6-4-3-5-7-16/h3-7,12-13,15,27H,8-11,14H2,1-2H3,(H,25,28)	RPWLKLZKOBXITE-UHFFFAOYSA-N	COc1cc2c(CC(=O)Nc3ccccc3)c(O)cc(N4CCOCC4)c2cc1OC	BroadT	BRD-K03591115	BRD-K03591115-001-05-1	InterBioScreen Ltd.	STOCK1S-56281			COc1cc2c(CC(=O)Nc3ccccc3)c(O)cc(N3CCOCC3)c2cc1OC	InChI=1S/C24H26N2O5/c1-29-22-12-17-18(13-23(22)30-2)20(26-8-10-31-11-9-26)15-21(27)19(17)14-24(28)25-16-6-4-3-5-7-16/h3-7,12-13,15,27H,8-11,14H2,1-2H3,(H,25,28)	RPWLKLZKOBXITE-UHFFFAOYSA-N	422.184171952							116285
313554-20-0	LSM-15408	BRD-K48304347	3096134	InChI=1S/C10H13N3O/c11-7-3-4-8-9(6-7)13-10(12-8)2-1-5-14/h3-4,6,14H,1-2,5,11H2,(H,12,13)	BVNWGDZNXNWEIB-UHFFFAOYSA-N	Nc1ccc2[nH]c(CCCO)nc2c1	BroadT	BRD-K48304347	BRD-K48304347-003-06-0	Asinex Ltd.	BAS 00255284		Cl	Nc1ccc2[nH]c(CCCO)nc2c1.Cl	InChI=1S/C10H13N3O.ClH/c11-7-3-4-8-9(6-7)13-10(12-8)2-1-5-14;/h3-4,6,14H,1-2,5,11H2,(H,12,13);1H	AJQYPYYWHFOFPK-UHFFFAOYSA-N	191.105862066							104050, 104050
MLS000575341	LSM-27741	SID17505617, BRD-K54658376	2291919	InChI=1S/C16H17N3O5/c1-23-13-9-11(19-4-6-24-7-5-19)3-2-10(13)8-12-14(20)17-16(22)18-15(12)21/h2-3,8-9H,4-7H2,1H3,(H2,17,18,20,21,22)	CRYWJHOHJMFHGX-UHFFFAOYSA-N	COc1cc(ccc1C=C2C(=O)NC(=O)NC2=O)N3CCOCC3	BroadT	BRD-K54658376	BRD-K54658376-001-05-0	ChemBridge Corporation	6884374			COc1cc(ccc1C=C1C(=O)NC(=O)NC1=O)N1CCOCC1	InChI=1S/C16H17N3O5/c1-23-13-9-11(19-4-6-24-7-5-19)3-2-10(13)8-12-14(20)17-16(22)18-15(12)21/h2-3,8-9H,4-7H2,1H3,(H2,17,18,20,21,22)	CRYWJHOHJMFHGX-UHFFFAOYSA-N	331.116820674							116286
STK089341	LSM-44224	SID4265886, BRD-K01565214	2189191	InChI=1S/C15H19NO3/c1-18-12-7-8-15(19-2)13(9-12)16-10-11-5-3-4-6-14(11)17/h7-10,16H,3-6H2,1-2H3/b11-10-	ITVQURZJQQGRHF-KHPPLWFESA-N	COc1ccc(OC)c(N\C=C/2\CCCCC2=O)c1	BroadT	BRD-K01565214	BRD-K01565214-001-05-7	ChemBridge Corporation	7424251			COc1ccc(OC)c(N\C=C2\CCCCC2=O)c1	InChI=1S/C15H19NO3/c1-18-12-7-8-15(19-2)13(9-12)16-10-11-5-3-4-6-14(11)17/h7-10,16H,3-6H2,1-2H3/b11-10-	ITVQURZJQQGRHF-KHPPLWFESA-N	261.136493478							
STK508949	LSM-27743	SID7976843, BRD-K85193532	5310854	InChI=1S/C13H12N4S/c1-3-7-18-13-15-12-11(16-17-13)9-6-4-5-8(2)10(9)14-12/h3-6H,1,7H2,2H3,(H,14,15,17)	DSNPRSDQOUSZDD-UHFFFAOYSA-N	Cc1cccc2c1nc3[nH]c(SCC=C)nnc23	BroadT	BRD-K85193532	BRD-K85193532-001-08-6	ChemBridge Corporation	5484369			Cc1cccc2c1nc1[nH]c(SCC=C)nnc21	InChI=1S/C13H12N4S/c1-3-7-18-13-15-12-11(16-17-13)9-6-4-5-8(2)10(9)14-12/h3-6H,1,7H2,2H3,(H,14,15,17)	DSNPRSDQOUSZDD-UHFFFAOYSA-N	256.078267114							116288
AF-399/36284014	LSM-27744	SID24830846, BRD-K93545925	829401	InChI=1S/C20H20N2O2/c1-20(2)12-17(23)19(18(24)13-20)22-21-16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11,21H,12-13H2,1-2H3	MLOFCFMKIBGBRP-UHFFFAOYSA-N	CC1(C)CC(=O)C(=NNc2ccc(cc2)c3ccccc3)C(=O)C1	BroadT	BRD-K93545925	BRD-K93545925-001-05-8	Enamine Ltd.	T0500-5939			CC1(C)CC(=O)C(=NNc2ccc(cc2)-c2ccccc2)C(=O)C1	InChI=1S/C20H20N2O2/c1-20(2)12-17(23)19(18(24)13-20)22-21-16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11,21H,12-13H2,1-2H3	MLOFCFMKIBGBRP-UHFFFAOYSA-N	320.1524779							116289
Diphenyl-acetic acid 1-methyl-2-pyrrolidin-1-yl-ethyl ester	LSM-15409	BRD-A52937860	407599	InChI=1S/C21H25NO2/c1-17(16-22-14-8-9-15-22)24-21(23)20(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-7,10-13,17,20H,8-9,14-16H2,1H3	BVODEVLJXZALEU-UHFFFAOYSA-N	CC(CN1CCCC1)OC(=O)C(c2ccccc2)c3ccccc3	BroadT	BRD-A52937860	BRD-A52937860-003-07-7	Asinex Ltd.	BAS 06710998		Cl	CC(CN1CCCC1)OC(=O)C(c1ccccc1)c1ccccc1.Cl	InChI=1S/C21H25NO2.ClH/c1-17(16-22-14-8-9-15-22)24-21(23)20(18-10-4-2-5-11-18)19-12-6-3-7-13-19;/h2-7,10-13,17,20H,8-9,14-16H2,1H3;1H	TZDLXXHCACBRJE-UHFFFAOYSA-N	323.18852905							104051, 104051
AC1NDZNM	LSM-27745	SID49731065, BRD-K67030036	4609473	InChI=1S/C14H16N2O3/c1-10-4-6-16(7-5-10)14(17)11-9-13(19-15-11)12-3-2-8-18-12/h2-3,8-10H,4-7H2,1H3	VCAQFWXLGCCEEJ-UHFFFAOYSA-N	CC1CCN(CC1)C(=O)c2cc(on2)c3occc3	BroadT	BRD-K67030036	BRD-K67030036-001-05-9	ChemDiv Inc.	C226-1717			CC1CCN(CC1)C(=O)c1cc(on1)-c1ccco1	InChI=1S/C14H16N2O3/c1-10-4-6-16(7-5-10)14(17)11-9-13(19-15-11)12-3-2-8-18-12/h2-3,8-10H,4-7H2,1H3	VCAQFWXLGCCEEJ-UHFFFAOYSA-N	260.116092392							116290
AI-204/43164225	LSM-27746	SID17387662, BRD-K18400851	1211603	InChI=1S/C20H21FN2O4/c1-26-20(25)17-4-2-3-5-18(17)27-14-19(24)23-12-10-22(11-13-23)16-8-6-15(21)7-9-16/h2-9H,10-14H2,1H3	AHIXJJWCUYTEII-UHFFFAOYSA-N	COC(=O)c1ccccc1OCC(=O)N2CCN(CC2)c3ccc(F)cc3	BroadT	BRD-K18400851	BRD-K18400851-001-05-6	Specs	AI-204/43164225			COC(=O)c1ccccc1OCC(=O)N1CCN(CC1)c1ccc(F)cc1	InChI=1S/C20H21FN2O4/c1-26-20(25)17-4-2-3-5-18(17)27-14-19(24)23-12-10-22(11-13-23)16-8-6-15(21)7-9-16/h2-9H,10-14H2,1H3	AHIXJJWCUYTEII-UHFFFAOYSA-N	372.148535372							116291
3-{1-[(2,4-Dichlorophenyl)sulfonyl]-2-pyrrolidinyl}pyridine	LSM-27747	SID26728172, BRD-A08015887	2805684	InChI=1S/C15H14Cl2N2O2S/c16-12-5-6-15(13(17)9-12)22(20,21)19-8-2-4-14(19)11-3-1-7-18-10-11/h1,3,5-7,9-10,14H,2,4,8H2	LHEOSHHKCZRSST-UHFFFAOYSA-N	Clc1ccc(c(Cl)c1)S(=O)(=O)N2CCCC2c3cccnc3	BroadT	BRD-A08015887	BRD-A08015887-001-05-4	Maybridge	CD 10450			Clc1ccc(c(Cl)c1)S(=O)(=O)N1CCCC1c1cccnc1	InChI=1S/C15H14Cl2N2O2S/c16-12-5-6-15(13(17)9-12)22(20,21)19-8-2-4-14(19)11-3-1-7-18-10-11/h1,3,5-7,9-10,14H,2,4,8H2	LHEOSHHKCZRSST-UHFFFAOYSA-N	356.015303818							116292
BDBM69374	LSM-27748	BRD-M07987005	91897826	InChI=1S/C15H15N3OS/c1-8-12-14(11-6-3-7-20-11)13-9(4-2-5-10(13)19)16-15(12)18-17-8/h3,6-7,13-14H,2,4-5H2,1H3,(H,17,18)	KFGNLRLBFYNRGU-UHFFFAOYSA-N	Cc1n[nH]c2N=C3CCCC(=O)C3C(c4cccs4)c12	BroadT	BRD-M07987005	BRD-M07987005-001-06-6	Enamine Ltd.	T0509-4063		CCO.Cc1n[nH]c2N=C3CCCC(=O)C3C(c3cccs3)c12	CCO.Cc1n[nH]c2N=C3CCCC(=O)C3C(c3cccs3)c12	InChI=1S/C15H15N3OS.C2H6O/c1-8-12-14(11-6-3-7-20-11)13-9(4-2-5-10(13)19)16-15(12)18-17-8;1-2-3/h3,6-7,13-14H,2,4-5H2,1H3,(H,17,18);3H,2H2,1H3	BLMSDILLXMGZPC-UHFFFAOYSA-N	285.09358282							116293
SMR000147635	LSM-27749	SID14741412, BRD-A96759385	3823499	InChI=1S/C13H12N4O3S/c1-20-9-4-2-8(3-5-9)15-12(19)10-6-11(18)17-7-14-16-13(17)21-10/h2-5,7,10H,6H2,1H3,(H,15,19)	NZANEAPUUVIPHO-UHFFFAOYSA-N	COc1ccc(NC(=O)C2CC(=O)n3cnnc3S2)cc1	BroadT	BRD-A96759385	BRD-A96759385-001-05-7	InterBioScreen Ltd.	STOCK3S-49191			COc1ccc(NC(=O)C2CC(=O)n3cnnc3S2)cc1	InChI=1S/C13H12N4O3S/c1-20-9-4-2-8(3-5-9)15-12(19)10-6-11(18)17-7-14-16-13(17)21-10/h2-5,7,10H,6H2,1H3,(H,15,19)	NZANEAPUUVIPHO-UHFFFAOYSA-N	304.063010974							116294
MLS000121860	LSM-27750	SID14721665, BRD-A58908711	3220393	InChI=1S/C13H12Cl2N2O3S2/c1-2-8(12(18)16-6-7-4-3-5-21-7)20-13(19)10-9(14)11(15)22-17-10/h3-5,8H,2,6H2,1H3,(H,16,18)	BYVGVYCVFJGXSL-UHFFFAOYSA-N	CCC(OC(=O)c1nsc(Cl)c1Cl)C(=O)NCc2cccs2	BroadT	BRD-A58908711	BRD-A58908711-001-05-1	Asinex Ltd.	ASN 06396818			CCC(OC(=O)c1nsc(Cl)c1Cl)C(=O)NCc1cccs1	InChI=1S/C13H12Cl2N2O3S2/c1-2-8(12(18)16-6-7-4-3-5-21-7)20-13(19)10-9(14)11(15)22-17-10/h3-5,8H,2,6H2,1H3,(H,16,18)	BYVGVYCVFJGXSL-UHFFFAOYSA-N	377.966639064							116295
BRD-A79706900	LSM-27751			InChI=1S/C20H19N3O4/c1-3-27-19(26)20(2)17(22-21-14-10-6-4-7-11-14)16(24)18(25)23(20)15-12-8-5-9-13-15/h4-13,17H,3H2,1-2H3	ATIXZVQUFZWNFW-UHFFFAOYSA-N	CCOC(=O)C1(C)C(N=Nc2ccccc2)C(=O)C(=O)N1c3ccccc3	BroadT	BRD-A79706900	BRD-A79706900-001-05-5	InterBioScreen Ltd.	STOCK3S-23203			CCOC(=O)C1(C)C(N=Nc2ccccc2)C(=O)C(=O)N1c1ccccc1	InChI=1S/C20H19N3O4/c1-3-27-19(26)20(2)17(22-21-14-10-6-4-7-11-14)16(24)18(25)23(20)15-12-8-5-9-13-15/h4-13,17H,3H2,1-2H3	ATIXZVQUFZWNFW-UHFFFAOYSA-N	365.137556118							116296
AC1OAICJ	LSM-27752	SID26660918, BRD-K99137941	6805149	InChI=1S/C20H22N4O2/c1-23-10-12-24(13-11-23)20-14-6-3-4-8-16(14)21-19(22-20)15-7-5-9-17(26-2)18(15)25/h3-9,25H,10-13H2,1-2H3	MTAUNVGSPWPEJS-UHFFFAOYSA-N	COc1cccc(c1O)c2nc(N3CCN(C)CC3)c4ccccc4n2	BroadT	BRD-K99137941	BRD-K99137941-001-07-4	InterBioScreen Ltd.	STOCK3S-73989			COc1cccc(-c2nc(N3CCN(C)CC3)c3ccccc3n2)c1O	InChI=1S/C20H22N4O2/c1-23-10-12-24(13-11-23)20-14-6-3-4-8-16(14)21-19(22-20)15-7-5-9-17(26-2)18(15)25/h3-9,25H,10-13H2,1-2H3	MTAUNVGSPWPEJS-UHFFFAOYSA-N	350.174275984							
AC1MH2T5	LSM-27753	SID49827029, BRD-K19003947	2995467	InChI=1S/C14H9N3O4S/c18-13(16-14-15-7-8-22-14)12-6-5-11(21-12)9-3-1-2-4-10(9)17(19)20/h1-8H,(H,15,16,18)	CDBGUOPKWNXZDX-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1c2oc(cc2)C(=O)Nc3nccs3	BroadT	BRD-K19003947	BRD-K19003947-001-05-3	ChemBridge Corporation	9012626			[O-][N+](=O)c1ccccc1-c1ccc(o1)C(=O)Nc1nccs1	InChI=1S/C14H9N3O4S/c18-13(16-14-15-7-8-22-14)12-6-5-11(21-12)9-3-1-2-4-10(9)17(19)20/h1-8H,(H,15,16,18)	CDBGUOPKWNXZDX-UHFFFAOYSA-N	315.031376488							116298
1,3-Dichloro-7-methyl-5,6,7,8-tetrahydro-[2,7]naphthyridine-4-carbonitrile	LSM-27754	SID17512094, BRD-K94342112	617683	InChI=1S/C10H9Cl2N3/c1-15-3-2-6-7(4-13)9(11)14-10(12)8(6)5-15/h2-3,5H2,1H3	LFIDGHPVULHBNN-UHFFFAOYSA-N	CN1CCc2c(C1)c(Cl)nc(Cl)c2C#N	BroadT	BRD-K94342112	BRD-K94342112-001-05-2	InterBioScreen Ltd.	STOCK1S-58263			CN1CCc2c(C1)c(Cl)nc(Cl)c2C#N	InChI=1S/C10H9Cl2N3/c1-15-3-2-6-7(4-13)9(11)14-10(12)8(6)5-15/h2-3,5H2,1H3	LFIDGHPVULHBNN-UHFFFAOYSA-N	241.017352738							116299
SMR000030416	LSM-27755	SID4249698, BRD-A33011828	3243616	InChI=1S/C23H20N6O2S/c1-14-11-19(28-27-14)26-20(30)13-32-23-25-17-10-6-5-9-16(17)21-24-18(22(31)29(21)23)12-15-7-3-2-4-8-15/h2-11,18H,12-13H2,1H3,(H2,26,27,28,30)	CEDSXKNLVNWYSN-UHFFFAOYSA-N	Cc1cc(NC(=O)CSC2=Nc3ccccc3C4=NC(Cc5ccccc5)C(=O)N24)[nH]n1	BroadT	BRD-A33011828	BRD-A33011828-001-05-4	ChemDiv Inc.	K279-0138			Cc1cc(NC(=O)CSC2=Nc3ccccc3C3=NC(Cc4ccccc4)C(=O)N23)[nH]n1	InChI=1S/C23H20N6O2S/c1-14-11-19(28-27-14)26-20(30)13-32-23-25-17-10-6-5-9-16(17)21-24-18(22(31)29(21)23)12-15-7-3-2-4-8-15/h2-11,18H,12-13H2,1H3,(H2,26,27,28,30)	CEDSXKNLVNWYSN-UHFFFAOYSA-N	444.13684463							116300
F3098-7420	LSM-27756	SID24804935, BRD-K94314368	733782	InChI=1S/C17H20N2O2S/c1-10-14(11(2)20)22-16(18-10)19-15(21)12-6-8-13(9-7-12)17(3,4)5/h6-9H,1-5H3,(H,18,19,21)	KEZFFKVTGGRQMP-UHFFFAOYSA-N	CC(=O)c1sc(NC(=O)c2ccc(cc2)C(C)(C)C)nc1C	BroadT	BRD-K94314368	BRD-K94314368-001-05-2	Asinex Ltd.	BAS 07313920			CC(=O)c1sc(NC(=O)c2ccc(cc2)C(C)(C)C)nc1C	InChI=1S/C17H20N2O2S/c1-10-14(11(2)20)22-16(18-10)19-15(21)12-6-8-13(9-7-12)17(3,4)5/h6-9H,1-5H3,(H,18,19,21)	KEZFFKVTGGRQMP-UHFFFAOYSA-N	316.12454859							116301
AC1LDBTD	LSM-27757	SID863282, BRD-K18736126	664528	InChI=1S/C17H18N4O2S2/c1-2-3-10-20-12-21(25(22,23)15-9-6-11-24-15)17-16(20)18-13-7-4-5-8-14(13)19-17/h4-9,11H,2-3,10,12H2,1H3	ZOIGMXSNUBDIDR-UHFFFAOYSA-N	CCCCN1CN(c2nc3ccccc3nc12)S(=O)(=O)c4cccs4	BroadT	BRD-K18736126	BRD-K18736126-001-02-9	InterBioScreen Ltd.	STOCK4S-66616			CCCCN1CN(c2nc3ccccc3nc12)S(=O)(=O)c1cccs1	InChI=1S/C17H18N4O2S2/c1-2-3-10-20-12-21(25(22,23)15-9-6-11-24-15)17-16(20)18-13-7-4-5-8-14(13)19-17/h4-9,11H,2-3,10,12H2,1H3	ZOIGMXSNUBDIDR-UHFFFAOYSA-N	374.087117236							116302
AC1MT0OF	LSM-27758	BRD-A73109654	3593066	InChI=1S/C17H12N4O5/c22-17-13-6-5-11(21(23)24)9-14(13)19-16(15-4-2-8-26-15)20(17)18-10-12-3-1-7-25-12/h1-10,16,19H	PHWOXXWDZBNAIG-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2C(=O)N(N=Cc3occc3)C(Nc2c1)c4occc4	BroadT	BRD-A73109654	BRD-A73109654-001-05-6	ChemDiv Inc.	8011-7064			[O-][N+](=O)c1ccc2C(=O)N(N=Cc3ccco3)C(Nc2c1)c1ccco1	InChI=1S/C17H12N4O5/c22-17-13-6-5-11(21(23)24)9-14(13)19-16(15-4-2-8-26-15)20(17)18-10-12-3-1-7-25-12/h1-10,16,19H	PHWOXXWDZBNAIG-UHFFFAOYSA-N	352.080769524							116303
AC1NF6WG	LSM-27759	SID14745309, BRD-A16200758	4678870	InChI=1S/C21H19FN4O3S2/c22-16-7-3-4-8-18(16)31(28,29)26-12-15-6-2-1-5-14(15)11-17(26)19(27)23-21-25-24-20(30-21)13-9-10-13/h1-8,13,17H,9-12H2,(H,23,25,27)	XWBZNRYIHZLLEP-UHFFFAOYSA-N	Fc1ccccc1S(=O)(=O)N2Cc3ccccc3CC2C(=O)Nc4nnc(s4)C5CC5	BroadT	BRD-A16200758	BRD-A16200758-001-06-6	Enamine Ltd.	T5277176			Fc1ccccc1S(=O)(=O)N1Cc2ccccc2CC1C(=O)Nc1nnc(s1)C1CC1	InChI=1S/C21H19FN4O3S2/c22-16-7-3-4-8-18(16)31(28,29)26-12-15-6-2-1-5-14(15)11-17(26)19(27)23-21-25-24-20(30-21)13-9-10-13/h1-8,13,17H,9-12H2,(H,23,25,27)	XWBZNRYIHZLLEP-UHFFFAOYSA-N	458.088260088							116304
ST51035701	LSM-27760	SID17386717, BRD-K71648319	1210239	InChI=1S/C17H12ClN5O/c1-22-10-14(16(24)13-4-2-3-5-15(13)22)17-19-20-21-23(17)12-8-6-11(18)7-9-12/h2-10H,1H3	LKXFEAKPCBODPU-UHFFFAOYSA-N	CN1C=C(C(=O)c2ccccc12)c3nnnn3c4ccc(Cl)cc4	BroadT	BRD-K71648319	BRD-K71648319-001-05-0	Specs	AG-401/43237613			Cn1cc(-c2nnnn2-c2ccc(Cl)cc2)c(=O)c2ccccc12	InChI=1S/C17H12ClN5O/c1-22-10-14(16(24)13-4-2-3-5-15(13)22)17-19-20-21-23(17)12-8-6-11(18)7-9-12/h2-10H,1H3	LKXFEAKPCBODPU-UHFFFAOYSA-N	337.073037764							116305
SMR000155705	LSM-27761	SID14743826, BRD-K48292964	2313407	InChI=1S/C20H22F2N2OS/c21-20(22)26-16-11-9-15(10-12-16)23-18-8-4-3-7-17(18)19(25)24-13-5-1-2-6-14-24/h3-4,7-12,20,23H,1-2,5-6,13-14H2	IBDAZHHSRBJXSW-UHFFFAOYSA-N	FC(F)Sc1ccc(Nc2ccccc2C(=O)N3CCCCCC3)cc1	BroadT	BRD-K48292964	BRD-K48292964-001-05-5	Enamine Ltd.	T0501-6151			FC(F)Sc1ccc(Nc2ccccc2C(=O)N2CCCCCC2)cc1	InChI=1S/C20H22F2N2OS/c21-20(22)26-16-11-9-15(10-12-16)23-18-8-4-3-7-17(18)19(25)24-13-5-1-2-6-14-24/h3-4,7-12,20,23H,1-2,5-6,13-14H2	IBDAZHHSRBJXSW-UHFFFAOYSA-N	376.142090434							116306
SMR000008508	LSM-27762	SID848574, BRD-K07951672	651023	InChI=1S/C20H21FN4O/c21-15-5-3-4-14(12-15)18-13-19-22-17-7-2-1-6-16(17)20(25(19)23-18)24-8-10-26-11-9-24/h3-5,12-13H,1-2,6-11H2	LIKGABHWCKZCMD-UHFFFAOYSA-N	Fc1cccc(c1)c2cc3nc4CCCCc4c(N5CCOCC5)n3n2	BroadT	BRD-K07951672	BRD-K07951672-001-05-8	Asinex Ltd.	ASN 08737307			Fc1cccc(c1)-c1cc2nc3CCCCc3c(N3CCOCC3)n2n1	InChI=1S/C20H21FN4O/c21-15-5-3-4-14(12-15)18-13-19-22-17-7-2-1-6-16(17)20(25(19)23-18)24-8-10-26-11-9-24/h3-5,12-13H,1-2,6-11H2	LIKGABHWCKZCMD-UHFFFAOYSA-N	352.169939532							116307
ST50834857	LSM-27763	SID24797344, BRD-K98914446	6465706	InChI=1S/C14H13N3O3/c1-9-3-2-4-13(15-9)17-14(18)16-10-5-6-11-12(7-10)20-8-19-11/h2-7H,8H2,1H3,(H2,15,16,17,18)	DDZIXOYVCDSJBM-UHFFFAOYSA-N	Cc1cccc(NC(=O)Nc2ccc3OCOc3c2)n1	BroadT	BRD-K98914446	BRD-K98914446-001-06-9	ChemBridge Corporation	9045119			Cc1cccc(NC(=O)Nc2ccc3OCOc3c2)n1	InChI=1S/C14H13N3O3/c1-9-3-2-4-13(15-9)17-14(18)16-10-5-6-11-12(7-10)20-8-19-11/h2-7H,8H2,1H3,(H2,15,16,17,18)	DDZIXOYVCDSJBM-UHFFFAOYSA-N	271.095691306							116308
5-Methyl-2-(2-phenoxyethyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one	LSM-27764	SID17411063, BRD-K56631134	3380665	InChI=1S/C17H17N3O2/c1-14-18-19(12-13-22-16-10-6-3-7-11-16)17(21)20(14)15-8-4-2-5-9-15/h2-11H,12-13H2,1H3	VCQISNTXRSXCHM-UHFFFAOYSA-N	CC1=NN(CCOc2ccccc2)C(=O)N1c3ccccc3	BroadT	BRD-K56631134	BRD-K56631134-001-05-8	Key Organics Ltd.	1W-0861			Cc1nn(CCOc2ccccc2)c(=O)n1-c1ccccc1	InChI=1S/C17H17N3O2/c1-14-18-19(12-13-22-16-10-6-3-7-11-16)17(21)20(14)15-8-4-2-5-9-15/h2-11H,12-13H2,1H3	VCQISNTXRSXCHM-UHFFFAOYSA-N	295.132076814							116309
3-(4-Nitrophenyl)-4-oxo-4H-chromen-7-yl n-(tert-butoxycarbonyl)leucinate	LSM-27765	SID17511853, BRD-A32913510	3819689	InChI=1S/C26H28N2O8/c1-15(2)12-21(27-25(31)36-26(3,4)5)24(30)35-18-10-11-19-22(13-18)34-14-20(23(19)29)16-6-8-17(9-7-16)28(32)33/h6-11,13-15,21H,12H2,1-5H3,(H,27,31)	ARJBZCFGAHBHDX-UHFFFAOYSA-N	CC(C)CC(NC(=O)OC(C)(C)C)C(=O)Oc1ccc2C(=O)C(=COc2c1)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-A32913510	BRD-A32913510-001-05-5	InterBioScreen Ltd.	STOCK1S-39845			CC(C)CC(NC(=O)OC(C)(C)C)C(=O)Oc1ccc2c(c1)occ(-c1ccc(cc1)[N+]([O-])=O)c2=O	InChI=1S/C26H28N2O8/c1-15(2)12-21(27-25(31)36-26(3,4)5)24(30)35-18-10-11-19-22(13-18)34-14-20(23(19)29)16-6-8-17(9-7-16)28(32)33/h6-11,13-15,21H,12H2,1-5H3,(H,27,31)	ARJBZCFGAHBHDX-UHFFFAOYSA-N	496.184565876							116310
T0505-4977	LSM-27766	SID24835241, BRD-K92527501	2333097	InChI=1S/C20H18FN3O3S/c1-14-11-16(21)8-9-19(14)28(26,27)24-18-7-3-2-6-17(18)20(25)23-13-15-5-4-10-22-12-15/h2-12,24H,13H2,1H3,(H,23,25)	QUVFCUFFTTYOQH-UHFFFAOYSA-N	Cc1cc(F)ccc1S(=O)(=O)Nc2ccccc2C(=O)NCc3cccnc3	BroadT	BRD-K92527501	BRD-K92527501-001-05-9	Enamine Ltd.	T0505-4977			Cc1cc(F)ccc1S(=O)(=O)Nc1ccccc1C(=O)NCc1cccnc1	InChI=1S/C20H18FN3O3S/c1-14-11-16(21)8-9-19(14)28(26,27)24-18-7-3-2-6-17(18)20(25)23-13-15-5-4-10-22-12-15/h2-12,24H,13H2,1H3,(H,23,25)	QUVFCUFFTTYOQH-UHFFFAOYSA-N	399.105290356							116311
4M-042	LSM-27767	SID17410990, BRD-K21752274	1476742	InChI=1S/C18H12FN3O2S2/c19-14-6-8-15(9-7-14)26(23,24)22-11-10-16(21-22)17-12-20-18(25-17)13-4-2-1-3-5-13/h1-12H	KYIWXQOFAPTVCE-UHFFFAOYSA-N	Fc1ccc(cc1)S(=O)(=O)n2ccc(n2)c3cnc(s3)c4ccccc4	BroadT	BRD-K21752274	BRD-K21752274-001-05-4	Key Organics Ltd.	4M-042			Fc1ccc(cc1)S(=O)(=O)n1ccc(n1)-c1cnc(s1)-c1ccccc1	InChI=1S/C18H12FN3O2S2/c19-14-6-8-15(9-7-14)26(23,24)22-11-10-16(21-22)17-12-20-18(25-17)13-4-2-1-3-5-13/h1-12H	KYIWXQOFAPTVCE-UHFFFAOYSA-N	385.035496234							116312
AC1LP76M	LSM-27768	BRD-K29154868	1282476	InChI=1S/C12H11N3O2/c1-9(10-4-2-6-13-8-10)14-15-12(16)11-5-3-7-17-11/h2-8H,1H3,(H,15,16)	RHGWLXYGNFWRFV-UHFFFAOYSA-N	CC(=NNC(=O)c1occc1)c2cccnc2	BroadT	BRD-K29154868	BRD-K29154868-001-05-7	ChemDiv Inc.	0796-0266			CC(=NNC(=O)c1ccco1)c1cccnc1	InChI=1S/C12H11N3O2/c1-9(10-4-2-6-13-8-10)14-15-12(16)11-5-3-7-17-11/h2-8H,1H3,(H,15,16)	RHGWLXYGNFWRFV-UHFFFAOYSA-N	229.085126622							116313
MLS000582933	LSM-27769	SID17433263, BRD-K95763164	1258911	InChI=1S/C22H15BrN2O3/c1-13-18(23)9-10-20(24-13)25-21(26)16-7-4-6-14(11-16)17-12-15-5-2-3-8-19(15)28-22(17)27/h2-12H,1H3,(H,24,25,26)	LZDQKGBRYFXSLM-UHFFFAOYSA-N	Cc1nc(NC(=O)c2cccc(c2)C3=Cc4ccccc4OC3=O)ccc1Br	BroadT	BRD-K95763164	BRD-K95763164-001-06-3	ChemBridge Corporation	7988494			Cc1nc(NC(=O)c2cccc(c2)-c2cc3ccccc3oc2=O)ccc1Br	InChI=1S/C22H15BrN2O3/c1-13-18(23)9-10-20(24-13)25-21(26)16-7-4-6-14(11-16)17-12-15-5-2-3-8-19(15)28-22(17)27/h2-12H,1H3,(H,24,25,26)	LZDQKGBRYFXSLM-UHFFFAOYSA-N	434.02660496							131283
MLS000733374	LSM-27770	SID24784397, BRD-K01124303	16188430	InChI=1S/C23H20ClFN4/c24-22-7-2-1-6-21(22)23-17(15-26-14-12-19-5-3-4-13-27-19)16-29(28-23)20-10-8-18(25)9-11-20/h1-11,13,16,26H,12,14-15H2	VVEYWVLTXOWUHL-UHFFFAOYSA-N	Fc1ccc(cc1)n2cc(CNCCc3ccccn3)c(n2)c4ccccc4Cl	BroadT	BRD-K01124303	BRD-K01124303-001-12-1	ChemBridge Corporation	74873753			Fc1ccc(cc1)-n1cc(CNCCc2ccccn2)c(n1)-c1ccccc1Cl	InChI=1S/C23H20ClFN4/c24-22-7-2-1-6-21(22)23-17(15-26-14-12-19-5-3-4-13-27-19)16-29(28-23)20-10-8-18(25)9-11-20/h1-11,13,16,26H,12,14-15H2	VVEYWVLTXOWUHL-UHFFFAOYSA-N	406.13605259							116316
52505-42-7	LSM-27771	SID17407780, BRD-K43011399	698121	InChI=1S/C11H12N2OS/c1-5-4-6(2)13-11-8(5)9(12)10(15-11)7(3)14/h4H,12H2,1-3H3	ZDAPLZCKWHZNPX-UHFFFAOYSA-N	CC(=O)c1sc2nc(C)cc(C)c2c1N	BroadT	BRD-K43011399	BRD-K43011399-001-05-9	Asinex Ltd.	BAS 02053987			CC(=O)c1sc2nc(C)cc(C)c2c1N	InChI=1S/C11H12N2OS/c1-5-4-6(2)13-11-8(5)9(12)10(15-11)7(3)14/h4H,12H2,1-3H3	ZDAPLZCKWHZNPX-UHFFFAOYSA-N	220.067033714							116317
2-[(2-Carbamoylsulfanylacetyl)amino]benzoic acid	LSM-27772	SID26664276, BRD-K29112518	224665	InChI=1S/C10H10N2O4S/c11-10(16)17-5-8(13)12-7-4-2-1-3-6(7)9(14)15/h1-4H,5H2,(H2,11,16)(H,12,13)(H,14,15)	NWUAPELPCMQTDN-UHFFFAOYSA-N	NC(=O)SCC(=O)Nc1ccccc1C(=O)O	BroadT	BRD-K29112518	BRD-K29112518-001-05-9	National Cancer Institute Chemotherapeutic Agents Repository	13345			NC(=O)SCC(=O)Nc1ccccc1C(O)=O	InChI=1S/C10H10N2O4S/c11-10(16)17-5-8(13)12-7-4-2-1-3-6(7)9(14)15/h1-4H,5H2,(H2,11,16)(H,12,13)(H,14,15)	NWUAPELPCMQTDN-UHFFFAOYSA-N	254.03612751							116318
MLS000081454	LSM-27773	SID861598, BRD-K05963285	662838	InChI=1S/C18H22N4O/c1-4-9-22-18-14(11-13-7-5-6-8-15(13)19-18)17(21-22)20-16(23)10-12(2)3/h5-8,11-12H,4,9-10H2,1-3H3,(H,20,21,23)	GEVOPYRQBDFURJ-UHFFFAOYSA-N	CCCn1nc(NC(=O)CC(C)C)c2cc3ccccc3nc12	BroadT	BRD-K05963285	BRD-K05963285-001-06-2	InterBioScreen Ltd.	STOCK4S-14977			CCCn1nc(NC(=O)CC(C)C)c2cc3ccccc3nc12	InChI=1S/C18H22N4O/c1-4-9-22-18-14(11-13-7-5-6-8-15(13)19-18)17(21-22)20-16(23)10-12(2)3/h5-8,11-12H,4,9-10H2,1-3H3,(H,20,21,23)	GEVOPYRQBDFURJ-UHFFFAOYSA-N	310.179361364							116319
2-[(2-Chlorophenoxy)methyl]benzoic acid	LSM-27774	SID4262754, BRD-K88651417	847923	InChI=1S/C14H11ClO3/c15-12-7-3-4-8-13(12)18-9-10-5-1-2-6-11(10)14(16)17/h1-8H,9H2,(H,16,17)	JCXZPOKVGCJMCQ-UHFFFAOYSA-N	OC(=O)c1ccccc1COc2ccccc2Cl	BroadT	BRD-K88651417	BRD-K88651417-001-05-6	ChemBridge Corporation	7956183			OC(=O)c1ccccc1COc1ccccc1Cl	InChI=1S/C14H11ClO3/c15-12-7-3-4-8-13(12)18-9-10-5-1-2-6-11(10)14(16)17/h1-8H,9H2,(H,16,17)	JCXZPOKVGCJMCQ-UHFFFAOYSA-N	262.039671922							116320
AC1MFQ85	LSM-15573	BRD-K15392587	2923521	InChI=1S/C17H22N2O3/c1-3-5-15-6-4-7-16(20-2)17(15)22-13-12-21-11-10-19-9-8-18-14-19/h3-4,6-9,14H,1,5,10-13H2,2H3	NVWWGFWYIXBRBJ-UHFFFAOYSA-N	COc1cccc(CC=C)c1OCCOCCn2ccnc2	BroadT	BRD-K15392587	BRD-K15392587-034-05-0	ChemBridge Corporation	7012436		OC(=O)C(=O)O	COc1cccc(CC=C)c1OCCOCCn1ccnc1.OC(=O)C(=O)O	InChI=1S/C17H22N2O3.C2H2O4/c1-3-5-15-6-4-7-16(20-2)17(15)22-13-12-21-11-10-19-9-8-18-14-19;3-1(4)2(5)6/h3-4,6-9,14H,1,5,10-13H2,2H3;(H,3,4)(H,5,6)	USUAYCVIVFZQJW-UHFFFAOYSA-N	302.163042584							104209, 104209
SMR000140339	LSM-27775	SID14736604, BRD-A11869386	2845859	InChI=1S/C19H23F3N2/c20-19(21,22)17-2-1-3-18(12-17)24-8-6-23(7-9-24)13-16-11-14-4-5-15(16)10-14/h1-5,12,14-16H,6-11,13H2	FIAOAIAXJRLEKI-UHFFFAOYSA-N	FC(F)(F)c1cccc(c1)N2CCN(CC3CC4CC3C=C4)CC2	BroadT	BRD-A11869386	BRD-A11869386-001-05-5	ChemBridge Corporation	5426257			FC(F)(F)c1cccc(c1)N1CCN(CC2CC3CC2C=C3)CC1	InChI=1S/C19H23F3N2/c20-19(21,22)17-2-1-3-18(12-17)24-8-6-23(7-9-24)13-16-11-14-4-5-15(16)10-14/h1-5,12,14-16H,6-11,13H2	FIAOAIAXJRLEKI-UHFFFAOYSA-N	336.181333356							116321
AP-124/41376163	LSM-27776	SID24793656, BRD-K04854377	1180034	InChI=1S/C18H21N3O3S/c1-19(16-8-4-2-5-9-16)18(22)20-12-14-21(15-13-20)25(23,24)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3	NPKMMTCMJMJPDG-UHFFFAOYSA-N	CN(C(=O)N1CCN(CC1)S(=O)(=O)c2ccccc2)c3ccccc3	BroadT	BRD-K04854377	BRD-K04854377-001-05-5	ChemBridge Corporation	7199338			CN(C(=O)N1CCN(CC1)S(=O)(=O)c1ccccc1)c1ccccc1	InChI=1S/C18H21N3O3S/c1-19(16-8-4-2-5-9-16)18(22)20-12-14-21(15-13-20)25(23,24)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3	NPKMMTCMJMJPDG-UHFFFAOYSA-N	359.130362252							116322
AC1MMLHA	LSM-27777	SID24812113, BRD-K57202717	3287840	InChI=1S/C23H28N4O2S/c1-2-25(18-7-4-3-5-8-18)11-6-12-27-22(28)20-17-19(26-13-15-29-16-14-26)9-10-21(20)24-23(27)30/h3-5,7-10,17H,2,6,11-16H2,1H3,(H,24,30)	MMGHBKRCUCRVNT-UHFFFAOYSA-N	CCN(CCCN1C(=S)Nc2ccc(cc2C1=O)N3CCOCC3)c4ccccc4	BroadT	BRD-K57202717	BRD-K57202717-001-06-0	ChemDiv Inc.	K284-6264			CCN(CCCn1c(=S)[nH]c2ccc(cc2c1=O)N1CCOCC1)c1ccccc1	InChI=1S/C23H28N4O2S/c1-2-25(18-7-4-3-5-8-18)11-6-12-27-22(28)20-17-19(26-13-15-29-16-14-26)9-10-21(20)24-23(27)30/h3-5,7-10,17H,2,6,11-16H2,1H3,(H,24,30)	MMGHBKRCUCRVNT-UHFFFAOYSA-N	424.193296866							116323
SMR000003403	LSM-27778	SID26667883, SID852279, BRD-K64540005	654894	InChI=1S/C22H23ClN4O4/c1-3-31-20(28)10-11-24-22(30)26-17-8-9-19-18(12-17)21(29)27(14(2)25-19)13-15-4-6-16(23)7-5-15/h4-9,12H,3,10-11,13H2,1-2H3,(H2,24,26,30)	RFBPBRWPSOSLOB-UHFFFAOYSA-N	CCOC(=O)CCNC(=O)Nc1ccc2N=C(C)N(Cc3ccc(Cl)cc3)C(=O)c2c1	BroadT	BRD-K64540005	BRD-K64540005-001-05-7	Asinex Ltd.	ASN 04446027			CCOC(=O)CCNC(=O)Nc1ccc2nc(C)n(Cc3ccc(Cl)cc3)c(=O)c2c1	InChI=1S/C22H23ClN4O4/c1-3-31-20(28)10-11-24-22(30)26-17-8-9-19-18(12-17)21(29)27(14(2)25-19)13-15-4-6-16(23)7-5-15/h4-9,12H,3,10-11,13H2,1-2H3,(H2,24,26,30)	RFBPBRWPSOSLOB-UHFFFAOYSA-N	442.140782966							116324
AC1MFT4C	LSM-27779	SID24795389, BRD-K58277154	2975324	InChI=1S/C20H22N6O3/c27-25-19(20(26(28)29)22-24(25)18-9-5-2-6-10-18)21-17-11-13-23(14-12-17)15-16-7-3-1-4-8-16/h1-10,17,21H,11-15H2	KGWDIYMLQDNMQP-UHFFFAOYSA-N	[O-][N+](=O)c1nn(c2ccccc2)[n+]([O-])c1NC3CCN(Cc4ccccc4)CC3	BroadT	BRD-K58277154	BRD-K58277154-001-08-7	ChemBridge Corporation	7962653			[O-][N+](=O)c1nn(-c2ccccc2)[n+]([O-])c1NC1CCN(Cc2ccccc2)CC1	InChI=1S/C20H22N6O3/c27-25-19(20(26(28)29)22-24(25)18-9-5-2-6-10-18)21-17-11-13-23(14-12-17)15-16-7-3-1-4-8-16/h1-10,17,21H,11-15H2	KGWDIYMLQDNMQP-UHFFFAOYSA-N	394.175338624							
AC1MY9QO	LSM-27780	BRD-K07945281	3878391	InChI=1S/C13H15N5OS/c1-9-11(8-15-16-13(14)20)12(19-2)18(17-9)10-6-4-3-5-7-10/h3-8H,1-2H3,(H3,14,16,20)	QJUFAXHRSNZJBS-UHFFFAOYSA-N	COc1c(C=NN=C(N)S)c(C)nn1c2ccccc2	BroadT	BRD-K07945281	BRD-K07945281-001-05-3	ChemDiv Inc.	3733-0024			COc1c(C=NN=C(N)S)c(C)nn1-c1ccccc1	InChI=1S/C13H15N5OS/c1-9-11(8-15-16-13(14)20)12(19-2)18(17-9)10-6-4-3-5-7-10/h3-8H,1-2H3,(H3,14,16,20)	QJUFAXHRSNZJBS-UHFFFAOYSA-N	289.09973084							116326
SMR000005131	LSM-27781	SID26669114, SID852978, BRD-A26581222	655623	InChI=1S/C26H29N5O4/c1-18-17-22(30-35-18)29-23(32)11-12-24(33)31(21-9-3-2-4-10-21)25(19-13-15-27-16-14-19)26(34)28-20-7-5-6-8-20/h2-4,9-10,13-17,20,25H,5-8,11-12H2,1H3,(H,28,34)(H,29,30,32)	IUDUNQCOMAYBCM-UHFFFAOYSA-N	Cc1onc(NC(=O)CCC(=O)N(C(C(=O)NC2CCCC2)c3ccncc3)c4ccccc4)c1	BroadT	BRD-A26581222	BRD-A26581222-001-05-7	Asinex Ltd.	ASN 05570190			Cc1cc(NC(=O)CCC(=O)N(C(C(=O)NC2CCCC2)c2ccncc2)c2ccccc2)no1	InChI=1S/C26H29N5O4/c1-18-17-22(30-35-18)29-23(32)11-12-24(33)31(21-9-3-2-4-10-21)25(19-13-15-27-16-14-19)26(34)28-20-7-5-6-8-20/h2-4,9-10,13-17,20,25H,5-8,11-12H2,1H3,(H,28,34)(H,29,30,32)	IUDUNQCOMAYBCM-UHFFFAOYSA-N	475.221954458							116327
Meclizine	LSM-1607	Meclozine, Meclizine	4034	InChI=1S/C25H27ClN2/c1-20-6-5-7-21(18-20)19-27-14-16-28(17-15-27)25(22-8-3-2-4-9-22)23-10-12-24(26)13-11-23/h2-13,18,25H,14-17,19H2,1H3	OCJYIGYOJCODJL-UHFFFAOYSA-N	Cc1cccc(CN2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4)c1	BroadT	BRD-A50311610	BRD-A50311610-003-13-8	Prestwick Chemical Inc.	Prestw-457		Cl	Cc1cccc(CN2CCN(CC2)C(c2ccccc2)c2ccc(Cl)cc2)c1.Cl	InChI=1S/C25H27ClN2.ClH/c1-20-6-5-7-21(18-20)19-27-14-16-28(17-15-27)25(22-8-3-2-4-9-22)23-10-12-24(26)13-11-23;/h2-13,18,25H,14-17,19H2,1H3;1H	GJNMJOHYRWHJQB-UHFFFAOYSA-N	390.186276594							6709, 6709, 6709, 6709
N-(1H-Indol-3-ylmethyl)cyclohexanamine	LSM-27782	SID14737733, BRD-K49464210	96438	InChI=1S/C15H20N2/c1-2-6-13(7-3-1)16-10-12-11-17-15-9-5-4-8-14(12)15/h4-5,8-9,11,13,16-17H,1-3,6-7,10H2	MAMUGDCJLAKCPT-UHFFFAOYSA-N	C(NC1CCCCC1)c2c[nH]c3ccccc23	BroadT	BRD-K49464210	BRD-K49464210-001-04-4	ChemDiv Inc.	K780-0209			C(NC1CCCCC1)c1c[nH]c2ccccc12	InChI=1S/C15H20N2/c1-2-6-13(7-3-1)16-10-12-11-17-15-9-5-4-8-14(12)15/h4-5,8-9,11,13,16-17H,1-3,6-7,10H2	MAMUGDCJLAKCPT-UHFFFAOYSA-N	228.16264866							116328
2-(3,5-Dimethyl-4-nitro-1H-pyrazol-1-yl)-n-[(2-methylquinolin-4-yl)methyl]acetamide	LSM-27783	SID24811581, BRD-K04498580	1504530	InChI=1S/C18H19N5O3/c1-11-8-14(15-6-4-5-7-16(15)20-11)9-19-17(24)10-22-13(3)18(23(25)26)12(2)21-22/h4-8H,9-10H2,1-3H3,(H,19,24)	CNDCJFZFIJPIIM-UHFFFAOYSA-N	Cc1cc(CNC(=O)Cn2nc(C)c(c2C)[N+](=O)[O-])c3ccccc3n1	BroadT	BRD-K04498580	BRD-K04498580-001-05-4	ChemDiv Inc.	8015-9191			Cc1nn(CC(=O)NCc2cc(C)nc3ccccc23)c(C)c1[N+]([O-])=O	InChI=1S/C18H19N5O3/c1-11-8-14(15-6-4-5-7-16(15)20-11)9-19-17(24)10-22-13(3)18(23(25)26)12(2)21-22/h4-8H,9-10H2,1-3H3,(H,19,24)	CNDCJFZFIJPIIM-UHFFFAOYSA-N	353.148789518							116329
AK-820/13220609	LSM-27784	SID17387113, BRD-K31020584	1726470	InChI=1S/C27H22N2O4/c1-31-21-8-3-17(4-9-21)20-14-23(18-5-10-22(32-2)11-6-18)28-24(15-20)19-7-12-26-25(13-19)29-27(30)16-33-26/h3-15H,16H2,1-2H3,(H,29,30)	IXNRYSLFOXLNJJ-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(nc(c2)c3ccc4OCC(=O)Nc4c3)c5ccc(OC)cc5	BroadT	BRD-K31020584	BRD-K31020584-001-05-9	Specs	AK-820/13220609			COc1ccc(cc1)-c1cc(nc(c1)-c1ccc2OCC(=O)Nc2c1)-c1ccc(OC)cc1	InChI=1S/C27H22N2O4/c1-31-21-8-3-17(4-9-21)20-14-23(18-5-10-22(32-2)11-6-18)28-24(15-20)19-7-12-26-25(13-19)29-27(30)16-33-26/h3-15H,16H2,1-2H3,(H,29,30)	IXNRYSLFOXLNJJ-UHFFFAOYSA-N	438.157957204							116330
STK300516	LSM-27785	SID4260646, BRD-K67748685	1250645	InChI=1S/C14H11N3O2S/c18-14(11-7-4-8-20-11)15-9-12-16-13(17-19-12)10-5-2-1-3-6-10/h1-8H,9H2,(H,15,18)	PPJTWHARWSRTBQ-UHFFFAOYSA-N	O=C(NCc1onc(n1)c2ccccc2)c3cccs3	BroadT	BRD-K67748685	BRD-K67748685-001-06-8	ChemBridge Corporation	7957487			O=C(NCc1nc(no1)-c1ccccc1)c1cccs1	InChI=1S/C14H11N3O2S/c18-14(11-7-4-8-20-11)15-9-12-16-13(17-19-12)10-5-2-1-3-6-10/h1-8H,9H2,(H,15,18)	PPJTWHARWSRTBQ-UHFFFAOYSA-N	285.057197312							116331
MLS000574897	LSM-27786	BRD-K89925532, P-Hydroxyphenethyl Anisate	14704104	InChI=1S/C16H16O4/c1-19-15-8-4-13(5-9-15)16(18)20-11-10-12-2-6-14(17)7-3-12/h2-9,17H,10-11H2,1H3	DSMAYKYXHOGICG-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)OCCc2ccc(O)cc2	BroadT	BRD-K89925532	BRD-K89925532-001-06-1	University of North Carolina at Chapel Hill	p-Hydroxy-phenethylanisate LBT-34			COc1ccc(cc1)C(=O)OCCc1ccc(O)cc1	InChI=1S/C16H16O4/c1-19-15-8-4-13(5-9-15)16(18)20-11-10-12-2-6-14(17)7-3-12/h2-9,17H,10-11H2,1H3	DSMAYKYXHOGICG-UHFFFAOYSA-N	272.104858992							116332
SMR000065065	LSM-27787	SID3713342, BRD-K21943404	2525358	InChI=1S/C20H23NO4/c22-19(21-13-5-2-1-3-6-13)12-24-14-9-10-16-15-7-4-8-17(15)20(23)25-18(16)11-14/h9-11,13H,1-8,12H2,(H,21,22)	FHLRZZYYBVEOLL-UHFFFAOYSA-N	O=C(COc1ccc2C3=C(CCC3)C(=O)Oc2c1)NC4CCCCC4	BroadT	BRD-K21943404	BRD-K21943404-001-05-2	Enamine Ltd.	ZT-5465532			O=C(COc1ccc2c3CCCc3c(=O)oc2c1)NC1CCCCC1	InChI=1S/C20H23NO4/c22-19(21-13-5-2-1-3-6-13)12-24-14-9-10-16-15-7-4-8-17(15)20(23)25-18(16)11-14/h9-11,13H,1-8,12H2,(H,21,22)	FHLRZZYYBVEOLL-UHFFFAOYSA-N	341.162708226							116333
MLS000098339	LSM-27788	SID3714626, BRD-K16009006	2405976	InChI=1S/C20H17NO5/c22-19(21-13-16-9-6-12-24-16)14-25-20(23)17-10-4-5-11-18(17)26-15-7-2-1-3-8-15/h1-12H,13-14H2,(H,21,22)	JTMCJWXNGFPQOW-UHFFFAOYSA-N	O=C(COC(=O)c1ccccc1Oc2ccccc2)NCc3occc3	BroadT	BRD-K16009006	BRD-K16009006-001-05-1	Enamine Ltd.	T0515-0860			O=C(COC(=O)c1ccccc1Oc1ccccc1)NCc1ccco1	InChI=1S/C20H17NO5/c22-19(21-13-16-9-6-12-24-16)14-25-20(23)17-10-4-5-11-18(17)26-15-7-2-1-3-8-15/h1-12H,13-14H2,(H,21,22)	JTMCJWXNGFPQOW-UHFFFAOYSA-N	351.110672654							116334
AC1LF0SN	LSM-27789	BRD-K98559561	745009	InChI=1S/C18H22N4OS/c23-18(20-19-13-17-7-4-12-24-17)15-22-10-8-21(9-11-22)14-16-5-2-1-3-6-16/h1-7,12-13H,8-11,14-15H2,(H,20,23)	JOXNGBVJZJQWAV-UHFFFAOYSA-N	O=C(CN1CCN(Cc2ccccc2)CC1)NN=Cc3cccs3	BroadT	BRD-K98559561	BRD-K98559561-001-05-3	InterBioScreen Ltd.	STOCK3S-04729			O=C(CN1CCN(Cc2ccccc2)CC1)NN=Cc1cccs1	InChI=1S/C18H22N4OS/c23-18(20-19-13-17-7-4-12-24-17)15-22-10-8-21(9-11-22)14-16-5-2-1-3-6-16/h1-7,12-13H,8-11,14-15H2,(H,20,23)	JOXNGBVJZJQWAV-UHFFFAOYSA-N	342.151432054							116335
ZINC00471339	LSM-27790	SID17433260, BRD-K13311495	894589	InChI=1S/C16H14ClNO3/c1-11(19)18-14-8-6-12(7-9-14)16(20)21-10-13-4-2-3-5-15(13)17/h2-9H,10H2,1H3,(H,18,19)	ODSYRNSAOUZVNV-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)C(=O)OCc2ccccc2Cl	BroadT	BRD-K13311495	BRD-K13311495-001-05-2	ChemBridge Corporation	7627269			CC(=O)Nc1ccc(cc1)C(=O)OCc1ccccc1Cl	InChI=1S/C16H14ClNO3/c1-11(19)18-14-8-6-12(7-9-14)16(20)21-10-13-4-2-3-5-15(13)17/h2-9H,10H2,1H3,(H,18,19)	ODSYRNSAOUZVNV-UHFFFAOYSA-N	303.066221028							116336
1-Amino-4-benzamidoanthraquinone	LSM-27791	SID17413745, BRD-K36574752	66479	InChI=1S/C21H14N2O3/c22-15-10-11-16(23-21(26)12-6-2-1-3-7-12)18-17(15)19(24)13-8-4-5-9-14(13)20(18)25/h1-11H,22H2,(H,23,26)	PXNNPGGYHAWDJW-UHFFFAOYSA-N	Nc1ccc(NC(=O)c2ccccc2)c3C(=O)c4ccccc4C(=O)c13	BroadT	BRD-K36574752	BRD-K36574752-001-05-6	Asinex Ltd.	BAS 01183133			Nc1ccc(NC(=O)c2ccccc2)c2C(=O)c3ccccc3C(=O)c12	InChI=1S/C21H14N2O3/c22-15-10-11-16(23-21(26)12-6-2-1-3-7-12)18-17(15)19(24)13-8-4-5-9-14(13)20(18)25/h1-11H,22H2,(H,23,26)	PXNNPGGYHAWDJW-UHFFFAOYSA-N	342.100442328							116337
SMR000036552	LSM-27792	SID859191, BRD-K89890521	660496	InChI=1S/C14H18N4O2S/c1-10(2)17-14(16-9-15)21-8-13(19)18-11-6-4-5-7-12(11)20-3/h4-7,10H,8H2,1-3H3,(H,16,17)(H,18,19)	GUFGTTULDLSCJC-UHFFFAOYSA-N	COc1ccccc1NC(=O)CSC(=NC#N)NC(C)C	BroadT	BRD-K89890521	BRD-K89890521-001-05-2	InterBioScreen Ltd.	STOCK3S-01605			COc1ccccc1NC(=O)CSC(NC(C)C)=NC#N	InChI=1S/C14H18N4O2S/c1-10(2)17-14(16-9-15)21-8-13(19)18-11-6-4-5-7-12(11)20-3/h4-7,10H,8H2,1-3H3,(H,16,17)(H,18,19)	GUFGTTULDLSCJC-UHFFFAOYSA-N	306.115046546							116338
4-(1-Ethylindol-3-yl)-3-nitro-4-phenylbutan-2-one	LSM-27793	SID26666244, BRD-A45652209	3669275	InChI=1S/C20H20N2O3/c1-3-21-13-17(16-11-7-8-12-18(16)21)19(15-9-5-4-6-10-15)20(14(2)23)22(24)25/h4-13,19-20H,3H2,1-2H3	RSODEXWYNPXOMN-UHFFFAOYSA-N	CCn1cc(C(C(C(=O)C)[N+](=O)[O-])c2ccccc2)c3ccccc13	BroadT	BRD-A45652209	BRD-A45652209-001-05-0	InterBioScreen Ltd.	STOCK3S-34079			CCn1cc(C(C(C(C)=O)[N+]([O-])=O)c2ccccc2)c2ccccc12	InChI=1S/C20H20N2O3/c1-3-21-13-17(16-11-7-8-12-18(16)21)19(15-9-5-4-6-10-15)20(14(2)23)22(24)25/h4-13,19-20H,3H2,1-2H3	RSODEXWYNPXOMN-UHFFFAOYSA-N	336.14739252							116339
MLS000697787	LSM-27794	SID24708125, BRD-K02381571	16066612	InChI=1S/C16H10FN5/c17-11-5-7-12(8-6-11)22-20-16(19-21-22)14-9-10-18-15-4-2-1-3-13(14)15/h1-10H	LNWUZDAXRXUTPL-UHFFFAOYSA-N	Fc1ccc(cc1)n2nnc(n2)c3ccnc4ccccc34	BroadT	BRD-K02381571	BRD-K02381571-001-05-5	Sanford-Burnham Medical Research Institute	4-(2-(4-fluorophenyl)-2H-tetrazol-5-yl)quinoline TZ4F11			Fc1ccc(cc1)-n1nnc(n1)-c1ccnc2ccccc12	InChI=1S/C16H10FN5/c17-11-5-7-12(8-6-11)22-20-16(19-21-22)14-9-10-18-15-4-2-1-3-13(14)15/h1-10H	LNWUZDAXRXUTPL-UHFFFAOYSA-N	291.09202357							116340
SMR000198173	LSM-44225	SID17504662, BRD-K60183631	2186345	InChI=1S/C25H20N2O8/c1-3-33-24(30)16-7-9-17(10-8-16)27-23(29)18(22(28)26-27)13-15-6-11-19(21(14-15)32-2)35-25(31)20-5-4-12-34-20/h4-14H,3H2,1-2H3,(H,26,28)/b18-13-	QALIHEAITYRYDK-AQTBWJFISA-N	CCOC(=O)c1ccc(cc1)N2NC(=O)\C(=C\c3ccc(OC(=O)c4occc4)c(OC)c3)\C2=O	BroadT	BRD-K60183631	BRD-K60183631-001-03-7	ChemBridge Corporation	7371182			CCOC(=O)c1ccc(cc1)N1NC(=O)\C(=C\c2ccc(OC(=O)c3ccco3)c(OC)c2)C1=O	InChI=1S/C25H20N2O8/c1-3-33-24(30)16-7-9-17(10-8-16)27-23(29)18(22(28)26-27)13-15-6-11-19(21(14-15)32-2)35-25(31)20-5-4-12-34-20/h4-14H,3H2,1-2H3,(H,26,28)/b18-13-	QALIHEAITYRYDK-AQTBWJFISA-N	476.12196562							
MLS000582643	LSM-27796	SID17413903, BRD-K41427823	2976293	InChI=1S/C17H14ClN5O5/c18-13-4-2-1-3-11(13)10-19-16-17(23(25)26)20-21(22(16)24)12-5-6-14-15(9-12)28-8-7-27-14/h1-6,9,19H,7-8,10H2	KNBRAQWSXCMPBS-UHFFFAOYSA-N	[O-][N+](=O)c1nn(c2ccc3OCCOc3c2)[n+]([O-])c1NCc4ccccc4Cl	BroadT	BRD-K41427823	BRD-K41427823-001-05-5	ChemBridge Corporation	7965857			[O-][N+](=O)c1nn(-c2ccc3OCCOc3c2)[n+]([O-])c1NCc1ccccc1Cl	InChI=1S/C17H14ClN5O5/c18-13-4-2-1-3-11(13)10-19-16-17(23(25)26)20-21(22(16)24)12-5-6-14-15(9-12)28-8-7-27-14/h1-6,9,19H,7-8,10H2	KNBRAQWSXCMPBS-UHFFFAOYSA-N	403.068346308							
AC1N906E	LSM-27797	BRD-K65575586	4402867	InChI=1S/C21H17ClN4O2/c1-14(25-26-21(28)17-10-12-23-13-11-17)15-4-8-19(9-5-15)24-20(27)16-2-6-18(22)7-3-16/h2-13H,1H3,(H,24,27)(H,26,28)	XPXVWVJSARKJSH-UHFFFAOYSA-N	CC(=NNC(=O)c1ccncc1)c2ccc(NC(=O)c3ccc(Cl)cc3)cc2	BroadT	BRD-K65575586	BRD-K65575586-001-05-9	Chemical Technologies & Investigations	DBZK-032680			CC(=NNC(=O)c1ccncc1)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1	InChI=1S/C21H17ClN4O2/c1-14(25-26-21(28)17-10-12-23-13-11-17)15-4-8-19(9-5-15)24-20(27)16-2-6-18(22)7-3-16/h2-13H,1H3,(H,24,27)(H,26,28)	XPXVWVJSARKJSH-UHFFFAOYSA-N	392.104003534							116343
BDBM47473	LSM-27798	BRD-K37247498	51517452	InChI=1S/C14H14ClNO3/c1-14(2,3)12(17)7-10-13(18)19-11-5-4-8(15)6-9(11)16-10/h4-6H,7H2,1-3H3	PAGOEFKSIGOYFT-UHFFFAOYSA-N	CC(C)(C)C(=O)CC1=Nc2cc(Cl)ccc2OC1=O	BroadT	BRD-K37247498	BRD-K37247498-001-05-7	InterBioScreen Ltd.	STOCK2S-90309			CC(C)(C)C(=O)Cc1nc2cc(Cl)ccc2oc1=O	InChI=1S/C14H14ClNO3/c1-14(2,3)12(17)7-10-13(18)19-11-5-4-8(15)6-9(11)16-10/h4-6H,7H2,1-3H3	PAGOEFKSIGOYFT-UHFFFAOYSA-N	279.066221028							116344
ZINC02861299	LSM-27799	SID49827234, BRD-K19627923	2214566	InChI=1S/C17H18BrN3O4S/c1-10(2)11-5-6-13(12(18)8-11)25-9-15(22)20-21-17(26)19-16(23)14-4-3-7-24-14/h3-8,10H,9H2,1-2H3,(H,20,22)(H2,19,21,23,26)	AEKZOGLVLOZMLY-UHFFFAOYSA-N	CC(C)c1ccc(OCC(=O)NNC(=S)NC(=O)c2occc2)c(Br)c1	BroadT	BRD-K19627923	BRD-K19627923-001-06-5	ChemBridge Corporation	7861490			CC(C)c1ccc(OCC(=O)NNC(=S)NC(=O)c2ccco2)c(Br)c1	InChI=1S/C17H18BrN3O4S/c1-10(2)11-5-6-13(12(18)8-11)25-9-15(22)20-21-17(26)19-16(23)14-4-3-7-24-14/h3-8,10H,9H2,1-2H3,(H,20,22)(H2,19,21,23,26)	AEKZOGLVLOZMLY-UHFFFAOYSA-N	439.020139376							116345
ZINC02635526	LSM-27800	SID22402892, BRD-K21729489	2098158	InChI=1S/C19H18F2N2O3S/c20-19(21)27-14-9-7-12(8-10-14)22-16-4-2-1-3-15(16)18(25)26-11-17(24)23-13-5-6-13/h1-4,7-10,13,19,22H,5-6,11H2,(H,23,24)	GUOFRHAUOGBFPY-UHFFFAOYSA-N	FC(F)Sc1ccc(Nc2ccccc2C(=O)OCC(=O)NC3CC3)cc1	BroadT	BRD-K21729489	BRD-K21729489-001-05-3	Enamine Ltd.	T5230967			FC(F)Sc1ccc(Nc2ccccc2C(=O)OCC(=O)NC2CC2)cc1	InChI=1S/C19H18F2N2O3S/c20-19(21)27-14-9-7-12(8-10-14)22-16-4-2-1-3-15(16)18(25)26-11-17(24)23-13-5-6-13/h1-4,7-10,13,19,22H,5-6,11H2,(H,23,24)	GUOFRHAUOGBFPY-UHFFFAOYSA-N	392.100619546							116346
AC1LXZMM	LSM-27801	BRD-K19603445	1840893	InChI=1S/C19H19BrN6O3/c1-11-4-3-5-12(6-11)10-28-17-14(20)7-13(8-15(17)27-2)9-23-24-18(21)16-19(22)26-29-25-16/h3-9H,10H2,1-2H3,(H2,21,24)(H2,22,26)	SERMSLBHAPXAPJ-UHFFFAOYSA-N	COc1cc(C=NN=C(N)c2nonc2N)cc(Br)c1OCc3cccc(C)c3	BroadT	BRD-K19603445	BRD-K19603445-001-05-7	InterBioScreen Ltd.	STOCK3S-52606			COc1cc(C=NN=C(N)c2nonc2N)cc(Br)c1OCc1cccc(C)c1	InChI=1S/C19H19BrN6O3/c1-11-4-3-5-12(6-11)10-28-17-14(20)7-13(8-15(17)27-2)9-23-24-18(21)16-19(22)26-29-25-16/h3-9H,10H2,1-2H3,(H2,21,24)(H2,22,26)	SERMSLBHAPXAPJ-UHFFFAOYSA-N	458.070201128							116347
AC1NEEBZ	LSM-27802	SID24822705, BRD-K84951887	4616056	InChI=1S/C9H12ClN3OS/c1-5-3-7(12-9(15)13-11)8(14-2)4-6(5)10/h3-4H,11H2,1-2H3,(H2,12,13,15)	YVCJRAQYWBIIEG-UHFFFAOYSA-N	COc1cc(Cl)c(C)cc1N=C(S)NN	BroadT	BRD-K84951887	BRD-K84951887-001-05-5	ChemDiv Inc.	K783-3715			COc1cc(Cl)c(C)cc1N=C(S)NN	InChI=1S/C9H12ClN3OS/c1-5-3-7(12-9(15)13-11)8(14-2)4-6(5)10/h3-4H,11H2,1-2H3,(H2,12,13,15)	YVCJRAQYWBIIEG-UHFFFAOYSA-N	245.038960434							116348
MLS001239361	LSM-15410	BRD-K61943536	24892062	InChI=1S/C28H38N4O3S2/c1-5-21-12-17-25-26(20-21)36-28(29-25)32(19-9-18-30(2)3)27(33)22-13-15-24(16-14-22)37(34,35)31(4)23-10-7-6-8-11-23/h12-17,20,23H,5-11,18-19H2,1-4H3	ODAZHZCEIAHTBZ-UHFFFAOYSA-N	CCc1ccc2nc(sc2c1)N(CCCN(C)C)C(=O)c3ccc(cc3)S(=O)(=O)N(C)C4CCCCC4	BroadT	BRD-K61943536	BRD-K61943536-003-06-8	Life Chemicals Inc.	F2019-0869		Cl	CCc1ccc2nc(sc2c1)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N(C)C1CCCCC1.Cl	InChI=1S/C28H38N4O3S2.ClH/c1-5-21-12-17-25-26(20-21)36-28(29-25)32(19-9-18-30(2)3)27(33)22-13-15-24(16-14-22)37(34,35)31(4)23-10-7-6-8-11-23;/h12-17,20,23H,5-11,18-19H2,1-4H3;1H	FIZWSDFJSFVALJ-UHFFFAOYSA-N	542.238532496							104052, 104052
MLS000578767	LSM-27803	SID17412631, BRD-K00129447	2856552	InChI=1S/C18H24N4O3/c23-21-14-9-10-15(22(24)25)16(19-13-7-3-1-4-8-13)17(14)20-18(21)11-5-2-6-12-18/h9-10,13,19H,1-8,11-12H2	XZTKZSDVEQGNRB-UHFFFAOYSA-N	[O-][N+](=O)C1=C(NC2CCCCC2)C3=NC4(CCCCC4)[N+](=C3C=C1)[O-]	BroadT	BRD-K00129447	BRD-K00129447-001-05-2	ChemBridge Corporation	5626139			[O-][N+](=O)c1ccc2=[N+]([O-])C3(CCCCC3)N=c2c1NC1CCCCC1	InChI=1S/C18H24N4O3/c23-21-14-9-10-15(22(24)25)16(19-13-7-3-1-4-8-13)17(14)20-18(21)11-5-2-6-12-18/h9-10,13,19H,1-8,11-12H2	XZTKZSDVEQGNRB-UHFFFAOYSA-N	344.184840668							
SMR000064619	LSM-27804	SID3714070, BRD-A01482803	2998655	InChI=1S/C18H21ClN2O3/c1-23-16-7-6-13(19)11-14(16)18(22)20-12-15(17-5-4-10-24-17)21-8-2-3-9-21/h4-7,10-11,15H,2-3,8-9,12H2,1H3,(H,20,22)	DPOARQRNHJTCHV-UHFFFAOYSA-N	COc1ccc(Cl)cc1C(=O)NCC(N2CCCC2)c3occc3	BroadT	BRD-A01482803	BRD-A01482803-001-05-4	Enamine Ltd.	T5336060			COc1ccc(Cl)cc1C(=O)NCC(N1CCCC1)c1ccco1	InChI=1S/C18H21ClN2O3/c1-23-16-7-6-13(19)11-14(16)18(22)20-12-15(17-5-4-10-24-17)21-8-2-3-9-21/h4-7,10-11,15H,2-3,8-9,12H2,1H3,(H,20,22)	DPOARQRNHJTCHV-UHFFFAOYSA-N	348.124070262							116350
AC1O9DLI	LSM-27805	SID22406025, BRD-K49018282	6782670	InChI=1S/C15H15N3O2S/c1-3-20-10-4-5-11(14(19)6-10)15-12(7-16-18-15)13-8-21-9(2)17-13/h4-8,19H,3H2,1-2H3,(H,16,18)	IJHSEYRNPRHZPH-UHFFFAOYSA-N	CCOc1ccc(c(O)c1)c2[nH]ncc2c3csc(C)n3	BroadT	BRD-K49018282	BRD-K49018282-001-05-8	Enamine Ltd.	T0516-1590			CCOc1ccc(-c2[nH]ncc2-c2csc(C)n2)c(O)c1	InChI=1S/C15H15N3O2S/c1-3-20-10-4-5-11(14(19)6-10)15-12(7-16-18-15)13-8-21-9(2)17-13/h4-8,19H,3H2,1-2H3,(H,16,18)	IJHSEYRNPRHZPH-UHFFFAOYSA-N	301.08849744							
MLS-0067106.0001	LSM-27806	SID24707840, SID26514133, BRD-K81813867	16066511	InChI=1S/C13H10FN5O/c1-20-13-11(3-2-8-15-13)12-16-18-19(17-12)10-6-4-9(14)5-7-10/h2-8H,1H3	XSLZDEWMQYHBQJ-UHFFFAOYSA-N	COc1ncccc1c2nnn(n2)c3ccc(F)cc3	BroadT	BRD-K81813867	BRD-K81813867-001-05-4	Sanford-Burnham Medical Research Institute	3-(2-(4-fluorophenyl)-2H-tetrazol-5-yl)-2-methoxypyridine TZ4F01			COc1ncccc1-c1nnn(n1)-c1ccc(F)cc1	InChI=1S/C13H10FN5O/c1-20-13-11(3-2-8-15-13)12-16-18-19(17-12)10-6-4-9(14)5-7-10/h2-8H,1H3	XSLZDEWMQYHBQJ-UHFFFAOYSA-N	271.08693819							116352
Ethyl 2-(trifluoromethyl)imidazo[1,2-a]pyrimidine-3-carboxylate	LSM-27807	SID14730103, BRD-K27394403	3362760	InChI=1S/C10H8F3N3O2/c1-2-18-8(17)6-7(10(11,12)13)15-9-14-4-3-5-16(6)9/h3-5H,2H2,1H3	ZBJBMDGMSVPMCB-UHFFFAOYSA-N	CCOC(=O)c1c(nc2ncccn12)C(F)(F)F	BroadT	BRD-K27394403	BRD-K27394403-001-05-3	Key Organics Ltd.	9X-0816			CCOC(=O)c1c(nc2ncccn12)C(F)(F)F	InChI=1S/C10H8F3N3O2/c1-2-18-8(17)6-7(10(11,12)13)15-9-14-4-3-5-16(6)9/h3-5H,2H2,1H3	ZBJBMDGMSVPMCB-UHFFFAOYSA-N	259.056861126							116353
MLS000088394	LSM-27808	SID4261640, BRD-A63947228	2931382	InChI=1S/C14H15NO5S/c1-20-14(19)11-10(6-7-21-11)15-12(16)8-4-2-3-5-9(8)13(17)18/h2-3,6-9H,4-5H2,1H3,(H,15,16)(H,17,18)	NCLPSSAAUMRJND-UHFFFAOYSA-N	COC(=O)c1sccc1NC(=O)C2CC=CCC2C(=O)O	BroadT	BRD-A63947228	BRD-A63947228-001-05-8	ChemBridge Corporation	7238203			COC(=O)c1sccc1NC(=O)C1CC=CCC1C(O)=O	InChI=1S/C14H15NO5S/c1-20-14(19)11-10(6-7-21-11)15-12(16)8-4-2-3-5-9(8)13(17)18/h2-3,6-9H,4-5H2,1H3,(H,15,16)(H,17,18)	NCLPSSAAUMRJND-UHFFFAOYSA-N	309.06709328							116354
13673-63-7	LSM-27809	SID26728716, BRD-K44870499	139538	InChI=1S/C8H7NOS/c1-9-6-4-2-3-5-7(6)10-8(9)11/h2-5H,1H3	VMOIPIVQHVFUFO-UHFFFAOYSA-N	CN1C(=S)Oc2ccccc12	BroadT	BRD-K44870499	BRD-K44870499-001-06-4	Maybridge	AC 29729			Cn1c2ccccc2oc1=S	InChI=1S/C8H7NOS/c1-9-6-4-2-3-5-7(6)10-8(9)11/h2-5H,1H3	VMOIPIVQHVFUFO-UHFFFAOYSA-N	165.024834544							116355
5-Nitro-furan-2-carboxylic acid benzyl-methyl-amide	LSM-27810	SID17510498, BRD-K60514932	3099052	InChI=1S/C13H12N2O4/c1-14(9-10-5-3-2-4-6-10)13(16)11-7-8-12(19-11)15(17)18/h2-8H,9H2,1H3	KRBCCPLCOYOYAP-UHFFFAOYSA-N	CN(Cc1ccccc1)C(=O)c2oc(cc2)[N+](=O)[O-]	BroadT	BRD-K60514932	BRD-K60514932-001-05-4	ChemDiv Inc.	4130-0157			CN(Cc1ccccc1)C(=O)c1ccc(o1)[N+]([O-])=O	InChI=1S/C13H12N2O4/c1-14(9-10-5-3-2-4-6-10)13(16)11-7-8-12(19-11)15(17)18/h2-8H,9H2,1H3	KRBCCPLCOYOYAP-UHFFFAOYSA-N	260.079706884							116356
SMR000073240	LSM-27811	SID4261762, BRD-A00051892	2941904	InChI=1S/C13H13N3O2S/c14-7-10-12(15-8-9-3-1-5-17-9)18-13(16-10)11-4-2-6-19-11/h2,4,6,9,15H,1,3,5,8H2	AIPQAXWNBFJZCQ-UHFFFAOYSA-N	N#Cc1nc(oc1NCC2CCCO2)c3cccs3	BroadT	BRD-A00051892	BRD-A00051892-001-05-0	ChemBridge Corporation	7537609			N#Cc1nc(oc1NCC1CCCO1)-c1cccs1	InChI=1S/C13H13N3O2S/c14-7-10-12(15-8-9-3-1-5-17-9)18-13(16-10)11-4-2-6-19-11/h2,4,6,9,15H,1,3,5,8H2	AIPQAXWNBFJZCQ-UHFFFAOYSA-N	275.072847376							116357
2-(3,4-Dimethoxy-benzyl)-5-(4'-methoxy-biphenyl-4-yl)-[1,3,4]oxadiazole	LSM-27812	SID843411, BRD-K10982725	645699	InChI=1S/C24H22N2O4/c1-27-20-11-9-18(10-12-20)17-5-7-19(8-6-17)24-26-25-23(30-24)15-16-4-13-21(28-2)22(14-16)29-3/h4-14H,15H2,1-3H3	YFBHMVSAAVDNCB-UHFFFAOYSA-N	COc1ccc(cc1)c2ccc(cc2)c3oc(Cc4ccc(OC)c(OC)c4)nn3	BroadT	BRD-K10982725	BRD-K10982725-001-05-5	Asinex Ltd.	ASN 03156985			COc1ccc(cc1)-c1ccc(cc1)-c1nnc(Cc2ccc(OC)c(OC)c2)o1	InChI=1S/C24H22N2O4/c1-27-20-11-9-18(10-12-20)17-5-7-19(8-6-17)24-26-25-23(30-24)15-16-4-13-21(28-2)22(14-16)29-3/h4-14H,15H2,1-3H3	YFBHMVSAAVDNCB-UHFFFAOYSA-N	402.157957204							116358
AC1LX5EU	LSM-27813	SID49817378, BRD-K44956996	1745223	InChI=1S/C24H23NO6/c1-16-13-22(27)31-20-14-18(7-8-19(16)20)30-15-21(26)25-11-9-24(10-12-25,23(28)29)17-5-3-2-4-6-17/h2-8,13-14H,9-12,15H2,1H3,(H,28,29)	MJBZORKOZMBVFI-UHFFFAOYSA-N	CC1=CC(=O)Oc2cc(OCC(=O)N3CCC(CC3)(C(=O)O)c4ccccc4)ccc12	BroadT	BRD-K44956996	BRD-K44956996-001-04-4	InterBioScreen Ltd.	STOCK1N-01248			Cc1cc(=O)oc2cc(OCC(=O)N3CCC(CC3)(C(O)=O)c3ccccc3)ccc12	InChI=1S/C24H23NO6/c1-16-13-22(27)31-20-14-18(7-8-19(16)20)30-15-21(26)25-11-9-24(10-12-25,23(28)29)17-5-3-2-4-6-17/h2-8,13-14H,9-12,15H2,1H3,(H,28,29)	MJBZORKOZMBVFI-UHFFFAOYSA-N	421.152537466							116359
MLS000332179	LSM-27814	BRD-K06926074	1993390	InChI=1S/C23H15N5O4/c1-14-5-2-8-27-19(14)25-21-17(23(27)30)11-15(12-24)20(26-22(29)18-7-4-10-32-18)28(21)13-16-6-3-9-31-16/h2-11H,13H2,1H3	HSLVLERSHNOGAH-UHFFFAOYSA-N	CC1=CC=CN2C(=O)C3=C(N=C12)N(Cc4occc4)C(=NC(=O)c5occc5)C(=C3)C#N	BroadT	BRD-K06926074	BRD-K06926074-001-05-5	InterBioScreen Ltd.	STOCK4S-27945			Cc1cccn2c1nc1n(Cc3ccco3)c(=NC(=O)c3ccco3)c(cc1c2=O)C#N	InChI=1S/C23H15N5O4/c1-14-5-2-8-27-19(14)25-21-17(23(27)30)11-15(12-24)20(26-22(29)18-7-4-10-32-18)28(21)13-16-6-3-9-31-16/h2-11H,13H2,1H3	HSLVLERSHNOGAH-UHFFFAOYSA-N	425.11240401							116360
MLS000595320	LSM-27815	SID14742018, BRD-K45422987	1927171	InChI=1S/C26H29N5O4S/c1-3-35-26(33)19-15-9-4-7-12-18(15)36-25(19)30-24(32)20-21-23(31(22(20)27)13-8-14-34-2)29-17-11-6-5-10-16(17)28-21/h5-6,10-11H,3-4,7-9,12-14,27H2,1-2H3,(H,30,32)	KNRRWJMZMCKYOX-UHFFFAOYSA-N	CCOC(=O)c1c2CCCCc2sc1NC(=O)c3c(N)n(CCCOC)c4nc5ccccc5nc34	BroadT	BRD-K45422987	BRD-K45422987-001-07-0	InterBioScreen Ltd.	STOCK2S-57459			CCOC(=O)c1c(NC(=O)c2c(N)n(CCCOC)c3nc4ccccc4nc23)sc2CCCCc12	InChI=1S/C26H29N5O4S/c1-3-35-26(33)19-15-9-4-7-12-18(15)36-25(19)30-24(32)20-21-23(31(22(20)27)13-8-14-34-2)29-17-11-6-5-10-16(17)28-21/h5-6,10-11H,3-4,7-9,12-14,27H2,1-2H3,(H,30,32)	KNRRWJMZMCKYOX-UHFFFAOYSA-N	507.194025148							116361
MLS000687284	LSM-27816	SID24813095, BRD-A42993399	3179255	InChI=1S/C27H28N4O3/c1-27(2,3)30-25(32)24(20-13-15-28-16-14-20)31(18-21-10-7-17-34-21)26(33)23-12-11-22(29-23)19-8-5-4-6-9-19/h4-17,24,29H,18H2,1-3H3,(H,30,32)	JZJCEAUAKYQEBL-UHFFFAOYSA-N	CC(C)(C)NC(=O)C(N(Cc1occc1)C(=O)c2ccc([nH]2)c3ccccc3)c4ccncc4	BroadT	BRD-A42993399	BRD-A42993399-001-06-9	Asinex Ltd.	ASN 03862134			CC(C)(C)NC(=O)C(N(Cc1ccco1)C(=O)c1ccc([nH]1)-c1ccccc1)c1ccncc1	InChI=1S/C27H28N4O3/c1-27(2,3)30-25(32)24(20-13-15-28-16-14-20)31(18-21-10-7-17-34-21)26(33)23-12-11-22(29-23)19-8-5-4-6-9-19/h4-17,24,29H,18H2,1-3H3,(H,30,32)	JZJCEAUAKYQEBL-UHFFFAOYSA-N	456.216140796							116362
AC1LDG8U	LSM-27817	SID845261, BRD-K29126048	647601	InChI=1S/C11H11N3O2/c1-14-8(5-13-11(14)12)7-2-3-9-10(4-7)16-6-15-9/h2-5H,6H2,1H3,(H2,12,13)	IFFMVHLRENHEPF-UHFFFAOYSA-N	Cn1c(N)ncc1c2ccc3OCOc3c2	BroadT	BRD-K29126048	BRD-K29126048-001-05-8	Asinex Ltd.	BAS 10113348			Cn1c(N)ncc1-c1ccc2OCOc2c1	InChI=1S/C11H11N3O2/c1-14-8(5-13-11(14)12)7-2-3-9-10(4-7)16-6-15-9/h2-5H,6H2,1H3,(H2,12,13)	IFFMVHLRENHEPF-UHFFFAOYSA-N	217.085126622							116363
MLS000772196	LSM-44226	SID24832550, BRD-K21691341	2596473	InChI=1S/C18H17NO4/c1-21-15-4-2-3-13(11-15)5-8-18(20)19-14-6-7-16-17(12-14)23-10-9-22-16/h2-8,11-12H,9-10H2,1H3,(H,19,20)/b8-5+	HANSDZYCOLAKRO-VMPITWQZSA-N	COc1cccc(\C=C\C(=O)Nc2ccc3OCCOc3c2)c1	BroadT	BRD-K21691341	BRD-K21691341-001-05-3	Enamine Ltd.	ZT-2086083			COc1cccc(\C=C\C(=O)Nc2ccc3OCCOc3c2)c1	InChI=1S/C18H17NO4/c1-21-15-4-2-3-13(11-15)5-8-18(20)19-14-6-7-16-17(12-14)23-10-9-22-16/h2-8,11-12H,9-10H2,1H3,(H,19,20)/b8-5+	HANSDZYCOLAKRO-VMPITWQZSA-N	311.115758034							
T5244189	LSM-27819	SID24837550, BRD-K25028212	2115687	InChI=1S/C21H21N3O7S/c1-14-12-19(23-31-14)22-20(25)13-30-21(26)15-8-10-16(11-9-15)32(27,28)24(2)17-6-4-5-7-18(17)29-3/h4-12H,13H2,1-3H3,(H,22,23,25)	SPLZGKQPZZHDPJ-UHFFFAOYSA-N	COc1ccccc1N(C)S(=O)(=O)c2ccc(cc2)C(=O)OCC(=O)Nc3cc(C)on3	BroadT	BRD-K25028212	BRD-K25028212-001-05-0	Enamine Ltd.	T5244189			COc1ccccc1N(C)S(=O)(=O)c1ccc(cc1)C(=O)OCC(=O)Nc1cc(C)on1	InChI=1S/C21H21N3O7S/c1-14-12-19(23-31-14)22-20(25)13-30-21(26)15-8-10-16(11-9-15)32(27,28)24(2)17-6-4-5-7-18(17)29-3/h4-12H,13H2,1-3H3,(H,22,23,25)	SPLZGKQPZZHDPJ-UHFFFAOYSA-N	459.110020732							116365
MLS000559778	LSM-27820	SID17508470, BRD-K83139911	1083526	InChI=1S/C23H17N3O3S/c1-15-6-5-9-18(14-15)24-22(27)21-20(16-10-12-19(13-11-16)26(28)29)25-23(30-21)17-7-3-2-4-8-17/h2-14H,1H3,(H,24,27)	FOBVSAMPFBXORL-UHFFFAOYSA-N	Cc1cccc(NC(=O)c2sc(nc2c3ccc(cc3)[N+](=O)[O-])c4ccccc4)c1	BroadT	BRD-K83139911	BRD-K83139911-001-07-4	Asinex Ltd.	BAS 00684726			Cc1cccc(NC(=O)c2sc(nc2-c2ccc(cc2)[N+]([O-])=O)-c2ccccc2)c1	InChI=1S/C23H17N3O3S/c1-15-6-5-9-18(14-15)24-22(27)21-20(16-10-12-19(13-11-16)26(28)29)25-23(30-21)17-7-3-2-4-8-17/h2-14H,1H3,(H,24,27)	FOBVSAMPFBXORL-UHFFFAOYSA-N	415.099062124							116366
104675-23-2	LSM-27821	SID7977872, BRD-K87854166	184360	InChI=1S/C13H12N2O/c14-9-10-4-1-2-7-13(10)15-11-5-3-6-12(16)8-11/h1-2,4,7-8,15H,3,5-6H2	HCMIHVZZMOSHIE-UHFFFAOYSA-N	O=C1CCCC(=C1)Nc2ccccc2C#N	BroadT	BRD-K87854166	BRD-K87854166-001-05-0	ChemBridge Corporation	5575300			O=C1CCCC(Nc2ccccc2C#N)=C1	InChI=1S/C13H12N2O/c14-9-10-4-1-2-7-13(10)15-11-5-3-6-12(16)8-11/h1-2,4,7-8,15H,3,5-6H2	HCMIHVZZMOSHIE-UHFFFAOYSA-N	212.094963024							116367
SMR000102164	LSM-27822	SID7974838, BRD-K40446436	763417	InChI=1S/C15H17FN4/c16-14-4-1-3-13(11-14)12-19-7-9-20(10-8-19)15-17-5-2-6-18-15/h1-6,11H,7-10,12H2	DDFZWZOMOJAGID-UHFFFAOYSA-N	Fc1cccc(CN2CCN(CC2)c3ncccn3)c1	BroadT	BRD-K40446436	BRD-K40446436-001-04-8	ChemBridge Corporation	5262831			Fc1cccc(CN2CCN(CC2)c2ncccn2)c1	InChI=1S/C15H17FN4/c16-14-4-1-3-13(11-14)12-19-7-9-20(10-8-19)15-17-5-2-6-18-15/h1-6,11H,7-10,12H2	DDFZWZOMOJAGID-UHFFFAOYSA-N	272.143724784							116368
MLS000684006	LSM-27823	SID24786480, BRD-A70460003	2895217	InChI=1S/C14H17BrN2O2/c1-9-4-6-17(7-5-9)14(19)11-8-10(15)2-3-12(11)16-13(14)18/h2-3,8-9,19H,4-7H2,1H3,(H,16,18)	BZHRVIKIKHFHDG-UHFFFAOYSA-N	CC1CCN(CC1)C2(O)C(=O)Nc3ccc(Br)cc23	BroadT	BRD-A70460003	BRD-A70460003-001-05-4	ChemBridge Corporation	6372815			CC1CCN(CC1)C1(O)C(=O)Nc2ccc(Br)cc12	InChI=1S/C14H17BrN2O2/c1-9-4-6-17(7-5-9)14(19)11-8-10(15)2-3-12(11)16-13(14)18/h2-3,8-9,19H,4-7H2,1H3,(H,16,18)	BZHRVIKIKHFHDG-UHFFFAOYSA-N	324.047340404							116369
MLS000778665	LSM-44227	SID26663544, BRD-A55033239	5969577	InChI=1S/C19H15NO5S2/c1-25-14-9-11(7-8-13(14)21)10-15-17(22)20(19(26)27-15)16(18(23)24)12-5-3-2-4-6-12/h2-10,16,21H,1H3,(H,23,24)/b15-10-	RYBBZFHEKOTILB-GDNBJRDFSA-N	COc1cc(\C=C\2/SC(=S)N(C(C(=O)O)c3ccccc3)C2=O)ccc1O	BroadT	BRD-A55033239	BRD-A55033239-001-05-4	InterBioScreen Ltd.	STOCK4S-86381			COc1cc(ccc1O)\C=C1/SC(=S)N(C(C(O)=O)c2ccccc2)C1=O	InChI=1S/C19H15NO5S2/c1-25-14-9-11(7-8-13(14)21)10-15-17(22)20(19(26)27-15)16(18(23)24)12-5-3-2-4-6-12/h2-10,16,21H,1H3,(H,23,24)/b15-10-	RYBBZFHEKOTILB-GDNBJRDFSA-N	401.03916397							
11E-309S	LSM-27825	SID24819215, BRD-K21272646	2766582	InChI=1S/C15H12ClN3O2S/c1-22-15-18-17-13(21-15)12-6-3-7-19(14(12)20)9-10-4-2-5-11(16)8-10/h2-8H,9H2,1H3	CVMYRMXDQWBOJJ-UHFFFAOYSA-N	CSc1oc(nn1)C2=CC=CN(Cc3cccc(Cl)c3)C2=O	BroadT	BRD-K21272646	BRD-K21272646-001-05-4	Key Organics Ltd.	11E-309S			CSc1nnc(o1)-c1cccn(Cc2cccc(Cl)c2)c1=O	InChI=1S/C15H12ClN3O2S/c1-22-15-18-17-13(21-15)12-6-3-7-19(14(12)20)9-10-4-2-5-11(16)8-10/h2-8H,9H2,1H3	CVMYRMXDQWBOJJ-UHFFFAOYSA-N	333.033875054							116371
CHEMDIV3_008157	LSM-27826	SID24812776, BRD-A75163266	6621296	InChI=1S/C19H19N3O2S2/c23-17(20-11-13-5-2-1-3-6-13)14-7-4-9-22(12-14)19-21-15-8-10-25-16(15)18(24)26-19/h1-3,5-6,8,10,14H,4,7,9,11-12H2,(H,20,23)	JWDFFUVSYNKJTK-UHFFFAOYSA-N	O=C(NCc1ccccc1)C2CCCN(C2)C3=Nc4ccsc4C(=O)S3	BroadT	BRD-A75163266	BRD-A75163266-001-07-7	ChemDiv Inc.	C200-2163			O=C(NCc1ccccc1)C1CCCN(C1)c1nc2ccsc2c(=O)s1	InChI=1S/C19H19N3O2S2/c23-17(20-11-13-5-2-1-3-6-13)14-7-4-9-22(12-14)19-21-15-8-10-25-16(15)18(24)26-19/h1-3,5-6,8,10,14H,4,7,9,11-12H2,(H,20,23)	JWDFFUVSYNKJTK-UHFFFAOYSA-N	385.091868258							116372
3-Acetyl-2-methylnaphtho[2,3-b]furan-4,9-dione	LSM-27827	SID22416743, BRD-K24866413	879233	InChI=1S/C15H10O4/c1-7(16)11-8(2)19-15-12(11)13(17)9-5-3-4-6-10(9)14(15)18/h3-6H,1-2H3	WFPANMVZXCWYIG-UHFFFAOYSA-N	CC(=O)c1c(C)oc2C(=O)c3ccccc3C(=O)c12	BroadT	BRD-K24866413	BRD-K24866413-001-08-5	ChemBridge Corporation	6078565			CC(=O)c1c(C)oc2c1C(=O)c1ccccc1C2=O	InChI=1S/C15H10O4/c1-7(16)11-8(2)19-15-12(11)13(17)9-5-3-4-6-10(9)14(15)18/h3-6H,1-2H3	WFPANMVZXCWYIG-UHFFFAOYSA-N	254.0579088							116373
AC1NFEK4	LSM-15508	BRD-A36358469	4657326	InChI=1S/C18H20N5O4/c1-21-11-5-4-8-17(21)14-6-2-3-7-15(14)19-20-16-10-9-13(22(24)25)12-18(16)23(26)27/h4-5,8-12,14,20H,2-3,6-7H2,1H3/q+1	WOJYSKMQJAIHRX-UHFFFAOYSA-N	C[n+]1ccccc1C2CCCCC2=NNc3ccc(cc3[N+](=O)[O-])[N+](=O)[O-]	BroadT	BRD-A36358469	BRD-A36358469-005-05-1	Enamine Ltd.	T0502-5459		I	C[n+]1ccccc1C1CCCCC1=NNc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O.I	InChI=1S/C18H20N5O4.HI/c1-21-11-5-4-8-17(21)14-6-2-3-7-15(14)19-20-16-10-9-13(22(24)25)12-18(16)23(26)27;/h4-5,8-12,14,20H,2-3,6-7H2,1H3;1H/q+1;	MVRHULKMNZONJX-UHFFFAOYSA-N	370.15152917							104149
SMR000107542	LSM-27828	SID7972489, BRD-A37519151	2921112	InChI=1S/C22H28N2O6S/c1-15-7-5-6-12-24(15)31(26,27)18-10-8-17(9-11-18)23-22(25)16-13-19(28-2)21(30-4)20(14-16)29-3/h8-11,13-15H,5-7,12H2,1-4H3,(H,23,25)	CJGSZAGZCQBGGW-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)Nc2ccc(cc2)S(=O)(=O)N3CCCCC3C	BroadT	BRD-A37519151	BRD-A37519151-001-05-9	ChemBridge Corporation	6970234			COc1cc(cc(OC)c1OC)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCCC1C	InChI=1S/C22H28N2O6S/c1-15-7-5-6-12-24(15)31(26,27)18-10-8-17(9-11-18)23-22(25)16-13-19(28-2)21(30-4)20(14-16)29-3/h8-11,13-15H,5-7,12H2,1-4H3,(H,23,25)	CJGSZAGZCQBGGW-UHFFFAOYSA-N	448.166807326							116374
ZINC00307628	LSM-27829	SID24804773, BRD-K38672578	800809	InChI=1S/C17H18N2O/c1-3-19-16-7-5-4-6-15(16)18-17(19)12-20-14-10-8-13(2)9-11-14/h4-11H,3,12H2,1-2H3	FBXDQANPSGHGFG-UHFFFAOYSA-N	CCn1c(COc2ccc(C)cc2)nc3ccccc13	BroadT	BRD-K38672578	BRD-K38672578-001-05-8	Asinex Ltd.	BAS 07806013			CCn1c(COc2ccc(C)cc2)nc2ccccc12	InChI=1S/C17H18N2O/c1-3-19-16-7-5-4-6-15(16)18-17(19)12-20-14-10-8-13(2)9-11-14/h4-11H,3,12H2,1-2H3	FBXDQANPSGHGFG-UHFFFAOYSA-N	266.141913216							116375
ASN 02914542	LSM-27830	SID26669115, SID845251, BRD-K85083498	647591	InChI=1S/C24H20N4O4S2/c1-2-31-15-9-10-19-20(12-15)34-23(25-19)27-21(29)14-33-24-26-18-8-4-3-7-17(18)22(30)28(24)13-16-6-5-11-32-16/h3-12H,2,13-14H2,1H3,(H,25,27,29)	OMFYQJYSZOYJOC-UHFFFAOYSA-N	CCOc1ccc2nc(NC(=O)CSC3=Nc4ccccc4C(=O)N3Cc5occc5)sc2c1	BroadT	BRD-K85083498	BRD-K85083498-001-05-7	Asinex Ltd.	ASN 02914542			CCOc1ccc2nc(NC(=O)CSc3nc4ccccc4c(=O)n3Cc3ccco3)sc2c1	InChI=1S/C24H20N4O4S2/c1-2-31-15-9-10-19-20(12-15)34-23(25-19)27-21(29)14-33-24-26-18-8-4-3-7-17(18)22(30)28(24)13-16-6-5-11-32-16/h3-12H,2,13-14H2,1H3,(H,25,27,29)	OMFYQJYSZOYJOC-UHFFFAOYSA-N	492.09259654							116376
ZINC02448184	LSM-44228	SID22401762, BRD-K86738897	2043610	InChI=1S/C19H16N4O3S2/c1-12-16(17(23-26-12)13-6-3-2-4-7-13)18(25)21-22-19(27)20-15(24)10-9-14-8-5-11-28-14/h2-11H,1H3,(H,21,25)(H2,20,22,24,27)/b10-9+	MIMKBKGPDPZVSW-MDZDMXLPSA-N	Cc1onc(c2ccccc2)c1C(=O)NNC(=S)NC(=O)\C=C\c3cccs3	BroadT	BRD-K86738897	BRD-K86738897-001-06-0	InterBioScreen Ltd.	STOCK4S-08316			Cc1onc(c1C(=O)NNC(=S)NC(=O)\C=C\c1cccs1)-c1ccccc1	InChI=1S/C19H16N4O3S2/c1-12-16(17(23-26-12)13-6-3-2-4-7-13)18(25)21-22-19(27)20-15(24)10-9-14-8-5-11-28-14/h2-11H,1H3,(H,21,25)(H2,20,22,24,27)/b10-9+	MIMKBKGPDPZVSW-MDZDMXLPSA-N	412.066381792							
MLS000551634	LSM-27832	SID14742238, BRD-K36751710	943158	InChI=1S/C18H18N2O2/c1-12-4-3-5-15(8-12)19-11-14-9-13-10-16(22-2)6-7-17(13)20-18(14)21/h3-10,19H,11H2,1-2H3,(H,20,21)	JHPWKJXYSKRTOZ-UHFFFAOYSA-N	COc1ccc2nc(O)c(CNc3cccc(C)c3)cc2c1	BroadT	BRD-K36751710	BRD-K36751710-001-05-1	InterBioScreen Ltd.	STOCK4S-58579			COc1ccc2nc(O)c(CNc3cccc(C)c3)cc2c1	InChI=1S/C18H18N2O2/c1-12-4-3-5-15(8-12)19-11-14-9-13-10-16(22-2)6-7-17(13)20-18(14)21/h3-10,19H,11H2,1-2H3,(H,20,21)	JHPWKJXYSKRTOZ-UHFFFAOYSA-N	294.136827836							116378
MLS000673118	LSM-27833	SID24783035, BRD-K47615243	16188026	InChI=1S/C23H30N4O2S/c1-3-8-26-10-12-27(13-11-26)9-4-7-24-23(29)20-15-18-21(30-20)17-14-16(2)5-6-19(17)25-22(18)28/h5-6,14-15H,3-4,7-13H2,1-2H3,(H,24,29)(H,25,28)	FXVAYIYWMRLPEH-UHFFFAOYSA-N	CCCN1CCN(CCCNC(=O)c2cc3c(O)nc4ccc(C)cc4c3s2)CC1	BroadT	BRD-K47615243	BRD-K47615243-001-05-1	ChemDiv Inc.	C734-0218			CCCN1CCN(CCCNC(=O)c2cc3c(O)nc4ccc(C)cc4c3s2)CC1	InChI=1S/C23H30N4O2S/c1-3-8-26-10-12-27(13-11-26)9-4-7-24-23(29)20-15-18-21(30-20)17-14-16(2)5-6-19(17)25-22(18)28/h5-6,14-15H,3-4,7-13H2,1-2H3,(H,24,29)(H,25,28)	FXVAYIYWMRLPEH-UHFFFAOYSA-N	426.20894693							116379
AC1LEJQ5	LSM-27834	BRD-K74487438	687311	InChI=1S/C12H15N3O4/c1-12(2,3)19-11(16)14-13-8-9-5-4-6-10(7-9)15(17)18/h4-8H,1-3H3,(H,14,16)	ZHELXCPMQSVBSY-UHFFFAOYSA-N	CC(C)(C)OC(=O)NN=Cc1cccc(c1)[N+](=O)[O-]	BroadT	BRD-K74487438	BRD-K74487438-001-05-6	ChemDiv Inc.	8005-4610			CC(C)(C)OC(=O)NN=Cc1cccc(c1)[N+]([O-])=O	InChI=1S/C12H15N3O4/c1-12(2,3)19-11(16)14-13-8-9-5-4-6-10(7-9)15(17)18/h4-8H,1-3H3,(H,14,16)	ZHELXCPMQSVBSY-UHFFFAOYSA-N	265.10625599							116380
T0506-0730	LSM-27835	SID16953588, BRD-K42370867	2353606	InChI=1S/C24H27NO6/c1-4-24(2,3)17-5-9-19(10-6-17)31-20-11-7-18(8-12-20)25-22(26)16-30-23(27)21-15-28-13-14-29-21/h5-12,15H,4,13-14,16H2,1-3H3,(H,25,26)	CKTLEGBRDQGLJY-UHFFFAOYSA-N	CCC(C)(C)c1ccc(Oc2ccc(NC(=O)COC(=O)C3=COCCO3)cc2)cc1	BroadT	BRD-K42370867	BRD-K42370867-001-06-1	Enamine Ltd.	T0506-0730			CCC(C)(C)c1ccc(Oc2ccc(NC(=O)COC(=O)C3=COCCO3)cc2)cc1	InChI=1S/C24H27NO6/c1-4-24(2,3)17-5-9-19(10-6-17)31-20-11-7-18(8-12-20)25-22(26)16-30-23(27)21-15-28-13-14-29-21/h5-12,15H,4,13-14,16H2,1-3H3,(H,25,26)	CKTLEGBRDQGLJY-UHFFFAOYSA-N	425.183837594							116381
SMR000185304	LSM-27836	SID17416328, BRD-K51886779	2193801	InChI=1S/C20H13BrN2O/c21-18-12-6-5-11-17(18)20(24)23-22-19-15-9-3-1-7-13(15)14-8-2-4-10-16(14)19/h1-12H,(H,23,24)	HVMJEUBSNOSYSA-UHFFFAOYSA-N	Brc1ccccc1C(=O)NN=C2c3ccccc3c4ccccc24	BroadT	BRD-K51886779	BRD-K51886779-001-05-3	ChemBridge Corporation	5310899			Brc1ccccc1C(=O)NN=C1c2ccccc2-c2ccccc12	InChI=1S/C20H13BrN2O/c21-18-12-6-5-11-17(18)20(24)23-22-19-15-9-3-1-7-13(15)14-8-2-4-10-16(14)19/h1-12H,(H,23,24)	HVMJEUBSNOSYSA-UHFFFAOYSA-N	376.021125656							116382
MLS000068423	LSM-27837	SID26669126, SID851487, BRD-A39197956	654063	InChI=1S/C22H27N7O/c30-20-7-5-18(6-8-20)27-13-15-28(16-14-27)21(17-9-11-23-12-10-17)22-24-25-26-29(22)19-3-1-2-4-19/h5-12,19,21,30H,1-4,13-16H2	SMNMAHGKWFHKMC-UHFFFAOYSA-N	Oc1ccc(cc1)N2CCN(CC2)C(c3ccncc3)c4nnnn4C5CCCC5	BroadT	BRD-A39197956	BRD-A39197956-001-05-9	Asinex Ltd.	ASN 07880821			Oc1ccc(cc1)N1CCN(CC1)C(c1nnnn1C1CCCC1)c1ccncc1	InChI=1S/C22H27N7O/c30-20-7-5-18(6-8-20)27-13-15-28(16-14-27)21(17-9-11-23-12-10-17)22-24-25-26-29(22)19-3-1-2-4-19/h5-12,19,21,30H,1-4,13-16H2	SMNMAHGKWFHKMC-UHFFFAOYSA-N	405.227708554							116383
5-(Naphthalen-1-ylmethylidene)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one	LSM-27838	BRD-K11753353	3237902	InChI=1S/C15H9N3OS/c19-14-13(20-15-16-9-17-18(14)15)8-11-6-3-5-10-4-1-2-7-12(10)11/h1-9H	KIZICLZWXALVBN-UHFFFAOYSA-N	O=C1C(=Cc2cccc3ccccc23)Sc4ncnn14	BroadT	BRD-K11753353	BRD-K11753353-001-05-8	ChemDiv Inc.	5629-0547			O=c1n2ncnc2sc1=Cc1cccc2ccccc12	InChI=1S/C15H9N3OS/c19-14-13(20-15-16-9-17-18(14)15)8-11-6-3-5-10-4-1-2-7-12(10)11/h1-9H	KIZICLZWXALVBN-UHFFFAOYSA-N	279.046632628							116384
AC1MSNVD	LSM-27839	BRD-A28709850	3587298	InChI=1S/C18H23NO/c1-2-13-9-11-14(12-10-13)19-18(20)17-15-7-5-3-4-6-8-16(15)17/h5,7,9-12,15-17H,2-4,6,8H2,1H3,(H,19,20)	OYVUSKSAVUXUAZ-UHFFFAOYSA-N	CCc1ccc(NC(=O)C2C3CCCCC=CC23)cc1	BroadT	BRD-A28709850	BRD-A28709850-001-05-1	Specs	AO-081/42027395			CCc1ccc(NC(=O)C2C3CCCC\C=C/C23)cc1	InChI=1S/C18H23NO/c1-2-13-9-11-14(12-10-13)19-18(20)17-15-7-5-3-4-6-8-16(15)17/h5,7,9-12,15-17H,2-4,6,8H2,1H3,(H,19,20)/b7-5-	OYVUSKSAVUXUAZ-ALCCZGGFSA-N	269.177964366							116385
Pyrazine-2-carboxylic acid (5-methyl-[1,3,4]thiadiazol-2-yl)-phenyl-amide	LSM-27840	SID847265, BRD-K62933609	649664	InChI=1S/C14H11N5OS/c1-10-17-18-14(21-10)19(11-5-3-2-4-6-11)13(20)12-9-15-7-8-16-12/h2-9H,1H3	WIFZSJOBRSSDAY-UHFFFAOYSA-N	Cc1nnc(s1)N(C(=O)c2cnccn2)c3ccccc3	BroadT	BRD-K62933609	BRD-K62933609-001-05-6	Asinex Ltd.	ASN 09114535			Cc1nnc(s1)N(C(=O)c1cnccn1)c1ccccc1	InChI=1S/C14H11N5OS/c1-10-17-18-14(21-10)19(11-5-3-2-4-6-11)13(20)12-9-15-7-8-16-12/h2-9H,1H3	WIFZSJOBRSSDAY-UHFFFAOYSA-N	297.068430712							116386
Methyl 2-(chloroacetyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate	LSM-27841	SID24827584, BRD-A90694325	4961710	InChI=1S/C13H14ClNO3/c1-18-13(17)11-6-9-4-2-3-5-10(9)8-15(11)12(16)7-14/h2-5,11H,6-8H2,1H3	YOYAEGIJBAENNO-UHFFFAOYSA-N	COC(=O)C1Cc2ccccc2CN1C(=O)CCl	BroadT	BRD-A90694325	BRD-A90694325-001-05-5	Enamine Ltd.	T5320458			COC(=O)C1Cc2ccccc2CN1C(=O)CCl	InChI=1S/C13H14ClNO3/c1-18-13(17)11-6-9-4-2-3-5-10(9)8-15(11)12(16)7-14/h2-5,11H,6-8H2,1H3	YOYAEGIJBAENNO-UHFFFAOYSA-N	267.066221028							116387
MLS000830761	LSM-27842	SID26726802, BRD-K86055821	2810624	InChI=1S/C23H20ClN3OS/c1-17-22(14-25-27(17)20-11-9-19(24)10-12-20)23(28)26(16-21-8-5-13-29-21)15-18-6-3-2-4-7-18/h2-14H,15-16H2,1H3	ZNQUQWGFIOFWNM-UHFFFAOYSA-N	Cc1c(cnn1c2ccc(Cl)cc2)C(=O)N(Cc3ccccc3)Cc4cccs4	BroadT	BRD-K86055821	BRD-K86055821-001-07-8	Maybridge	HTS 02290			Cc1c(cnn1-c1ccc(Cl)cc1)C(=O)N(Cc1cccs1)Cc1ccccc1	InChI=1S/C23H20ClN3OS/c1-17-22(14-25-27(17)20-11-9-19(24)10-12-20)23(28)26(16-21-8-5-13-29-21)15-18-6-3-2-4-7-18/h2-14H,15-16H2,1H3	ZNQUQWGFIOFWNM-UHFFFAOYSA-N	421.10156069							116388
AC1O9PPA	LSM-27843	BRD-K17404963	6764427	InChI=1S/C16H12N2O3/c19-15-12-6-1-2-7-14(12)21-16(20)13(15)10-17-9-11-5-3-4-8-18-11/h1-8,10,19H,9H2	APDYKQQPDUSPQY-UHFFFAOYSA-N	OC1=C(C=NCc2ccccn2)C(=O)Oc3ccccc13	BroadT	BRD-K17404963	BRD-K17404963-001-06-2	Enamine Ltd.	T0509-4005			Oc1c(C=NCc2ccccn2)c(=O)oc2ccccc12	InChI=1S/C16H12N2O3/c19-15-12-6-1-2-7-14(12)21-16(20)13(15)10-17-9-11-5-3-4-8-18-11/h1-8,10,19H,9H2	APDYKQQPDUSPQY-UHFFFAOYSA-N	280.084792264							
1-Chloro-2-[2-(2-methoxy-4-methylphenoxy)ethoxy]-4-methylbenzene	LSM-27844	SID17416252, BRD-K97553787	2289107	InChI=1S/C17H19ClO3/c1-12-4-6-14(18)16(10-12)21-9-8-20-15-7-5-13(2)11-17(15)19-3/h4-7,10-11H,8-9H2,1-3H3	UVAOBHSWJTXPCD-UHFFFAOYSA-N	COc1cc(C)ccc1OCCOc2cc(C)ccc2Cl	BroadT	BRD-K97553787	BRD-K97553787-001-05-5	ChemBridge Corporation	6489529			COc1cc(C)ccc1OCCOc1cc(C)ccc1Cl	InChI=1S/C17H19ClO3/c1-12-4-6-14(18)16(10-12)21-9-8-20-15-7-5-13(2)11-17(15)19-3/h4-7,10-11H,8-9H2,1-3H3	UVAOBHSWJTXPCD-UHFFFAOYSA-N	306.102272178							116390
Diethyl-[2-(4-methyl-piperazin-1-yl)-quinazolin-4-yl]-amine	LSM-15411	BRD-K10514095	6458138	InChI=1S/C17H25N5/c1-4-21(5-2)16-14-8-6-7-9-15(14)18-17(19-16)22-12-10-20(3)11-13-22/h6-9H,4-5,10-13H2,1-3H3	OQJDEQRNNWINFZ-UHFFFAOYSA-N	CCN(CC)c1nc(nc2ccccc12)N3CCN(C)CC3	BroadT	BRD-K10514095	BRD-K10514095-003-06-2	Asinex Ltd.	BAS 12344803		Cl	CCN(CC)c1nc(nc2ccccc12)N1CCN(C)CC1.Cl	InChI=1S/C17H25N5.ClH/c1-4-21(5-2)16-14-8-6-7-9-15(14)18-17(19-16)22-12-10-20(3)11-13-22;/h6-9H,4-5,10-13H2,1-3H3;1H	HYQOWHBYBBHGSF-UHFFFAOYSA-N	299.21099585							104053, 104053
AC1N6Z1C	LSM-27845	SID24831054, BRD-A43323672	4223534	InChI=1S/C13H14Cl2N2S/c1-12(2)10(13(12,14)15)7-18-11-16-8-5-3-4-6-9(8)17-11/h3-6,10H,7H2,1-2H3,(H,16,17)	INLJVXVSKYGJAY-UHFFFAOYSA-N	CC1(C)C(CSc2nc3ccccc3[nH]2)C1(Cl)Cl	BroadT	BRD-A43323672	BRD-A43323672-001-05-8	Enamine Ltd.	T0501-3761			CC1(C)C(CSc2nc3ccccc3[nH]2)C1(Cl)Cl	InChI=1S/C13H14Cl2N2S/c1-12(2)10(13(12,14)15)7-18-11-16-8-5-3-4-6-9(8)17-11/h3-6,10H,7H2,1-2H3,(H,16,17)	INLJVXVSKYGJAY-UHFFFAOYSA-N	300.025474578							116391
F0894-0162	LSM-27846	SID14721737, BRD-A87492268	2881667	InChI=1S/C17H18N4O/c1-10(2)8-12-13(9-18)16(19)22-17-14(12)15(20-21-17)11-6-4-3-5-7-11/h3-7,10,12H,8,19H2,1-2H3,(H,20,21)	HJKVKJIUEPNLHI-UHFFFAOYSA-N	CC(C)CC1C(=C(N)Oc2[nH]nc(c3ccccc3)c12)C#N	BroadT	BRD-A87492268	BRD-A87492268-001-06-6	Asinex Ltd.	BAS 01369683			CC(C)CC1c2c(OC(N)=C1C#N)[nH]nc2-c1ccccc1	InChI=1S/C17H18N4O/c1-10(2)8-12-13(9-18)16(19)22-17-14(12)15(20-21-17)11-6-4-3-5-7-11/h3-7,10,12H,8,19H2,1-2H3,(H,20,21)	HJKVKJIUEPNLHI-UHFFFAOYSA-N	294.148061236							116392
3-Tert-butyl-7-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one	LSM-27847	SID14743461, BRD-K65160672	978866	InChI=1S/C17H18N4O2S2/c1-10-5-7-11(8-6-10)12(22)9-24-16-20-21-14(23)13(17(2,3)4)18-19-15(21)25-16/h5-8H,9H2,1-4H3	PWNAVGGHTMLMSI-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)CSC2=NN3C(=NN=C(C3=O)C(C)(C)C)S2	BroadT	BRD-K65160672	BRD-K65160672-001-05-5	InterBioScreen Ltd.	STOCK2S-33163			Cc1ccc(cc1)C(=O)CSc1nn2c(nnc(c2=O)C(C)(C)C)s1	InChI=1S/C17H18N4O2S2/c1-10-5-7-11(8-6-10)12(22)9-24-16-20-21-14(23)13(17(2,3)4)18-19-15(21)25-16/h5-8H,9H2,1-4H3	PWNAVGGHTMLMSI-UHFFFAOYSA-N	374.087117236							116393
93752-20-6	LSM-44229	SID26671429, BRD-K55604008	911730	InChI=1S/C6H4BrN3S/c7-3-1-4-5(8-2-3)10-6(11)9-4/h1-2H,(H2,8,9,10,11)	AOLQXGYCKFKIPQ-UHFFFAOYSA-N	Sc1nc2cc(Br)c[nH]c2n1	BroadT	BRD-K55604008	BRD-K55604008-001-05-9	InterBioScreen Ltd.	STOCK1S-21839			Sc1nc2cc(Br)c[nH]c2n1	InChI=1S/C6H4BrN3S/c7-3-1-4-5(8-2-3)10-6(11)9-4/h1-2H,(H2,8,9,10,11)	AOLQXGYCKFKIPQ-UHFFFAOYSA-N	228.930930448							
STK166438	LSM-27849	SID47200402, BRD-K39796245	3882765	InChI=1S/C16H13FN2O/c1-10-2-7-14-11(8-10)9-15(19-14)16(20)18-13-5-3-12(17)4-6-13/h2-9,19H,1H3,(H,18,20)	VAORNMWYMRWFNM-UHFFFAOYSA-N	Cc1ccc2[nH]c(cc2c1)C(=O)Nc3ccc(F)cc3	BroadT	BRD-K39796245	BRD-K39796245-001-05-7	Vitas-M Laboratory Ltd.	STK166438			Cc1ccc2[nH]c(C(=O)Nc3ccc(F)cc3)cc2c1	InChI=1S/C16H13FN2O/c1-10-2-7-14-11(8-10)9-15(19-14)16(20)18-13-5-3-12(17)4-6-13/h2-9,19H,1H3,(H,18,20)	VAORNMWYMRWFNM-UHFFFAOYSA-N	268.101191256							116395
SMR000200459	LSM-27850	SID17416285, BRD-K41963373	2962367	InChI=1S/C22H19N3O2/c1-15-7-6-8-16(13-15)27-14-21(26)24-25-22-17-9-2-4-11-19(17)23-20-12-5-3-10-18(20)22/h2-13H,14H2,1H3,(H,23,25)(H,24,26)	WXYVQORSQWZKSQ-UHFFFAOYSA-N	Cc1cccc(OCC(=O)NNc2c3ccccc3nc4ccccc24)c1	BroadT	BRD-K41963373	BRD-K41963373-001-06-1	ChemBridge Corporation	7905284			Cc1cccc(OCC(=O)NNc2c3ccccc3nc3ccccc23)c1	InChI=1S/C22H19N3O2/c1-15-7-6-8-16(13-15)27-14-21(26)24-25-22-17-9-2-4-11-19(17)23-20-12-5-3-10-18(20)22/h2-13H,14H2,1H3,(H,23,25)(H,24,26)	WXYVQORSQWZKSQ-UHFFFAOYSA-N	357.147726878							116396
MLS000401534	LSM-27851	SID22402475, SID87337181, BRD-K68085036	4092119	InChI=1S/C25H25N5O4S2/c31-35(32,20-11-3-1-4-12-20)29-25-24(27-22-14-5-6-15-23(22)28-25)26-19-10-9-13-21(18-19)36(33,34)30-16-7-2-8-17-30/h1,3-6,9-15,18H,2,7-8,16-17H2,(H,26,27)(H,28,29)	JBBGBYPGZPWZBG-UHFFFAOYSA-N	O=S(=O)(Nc1nc2ccccc2nc1Nc3cccc(c3)S(=O)(=O)N4CCCCC4)c5ccccc5	BroadT	BRD-K68085036	BRD-K68085036-001-06-0	Enamine Ltd.	T0503-6145			O=S(=O)(Nc1nc2ccccc2nc1Nc1cccc(c1)S(=O)(=O)N1CCCCC1)c1ccccc1	InChI=1S/C25H25N5O4S2/c31-35(32,20-11-3-1-4-12-20)29-25-24(27-22-14-5-6-15-23(22)28-25)26-19-10-9-13-21(18-19)36(33,34)30-16-7-2-8-17-30/h1,3-6,9-15,18H,2,7-8,16-17H2,(H,26,27)(H,28,29)	JBBGBYPGZPWZBG-UHFFFAOYSA-N	523.13479571							116397
AC1NBKPO	LSM-27852	BRD-A98703456	4444796	InChI=1S/C16H29N3S/c1-12(2)17-16(20)19-18-15-11-7-6-10-14(15)13-8-4-3-5-9-13/h12-14H,3-11H2,1-2H3,(H2,17,19,20)	PVBZSEMJXZETBJ-UHFFFAOYSA-N	CC(C)N=C(S)NN=C1CCCCC1C2CCCCC2	BroadT	BRD-A98703456	BRD-A98703456-001-05-7	Enamine Ltd.	T0516-5873			CC(C)N=C(S)NN=C1CCCCC1C1CCCCC1	InChI=1S/C16H29N3S/c1-12(2)17-16(20)19-18-15-11-7-6-10-14(15)13-8-4-3-5-9-13/h12-14H,3-11H2,1-2H3,(H2,17,19,20)	PVBZSEMJXZETBJ-UHFFFAOYSA-N	295.208218648							116398
SMR000198306	LSM-27853	SID17433431, BRD-K57843990	2188670	InChI=1S/C13H11BrN4OS/c1-8-2-3-16-11(4-8)17-13(20)18-12(19)9-5-10(14)7-15-6-9/h2-7H,1H3,(H2,16,17,18,19,20)	WTRBQKRLGVMELH-UHFFFAOYSA-N	Cc1ccnc(NC(=S)NC(=O)c2cncc(Br)c2)c1	BroadT	BRD-K57843990	BRD-K57843990-001-05-1	ChemBridge Corporation	7413630			Cc1ccnc(NC(=S)NC(=O)c2cncc(Br)c2)c1	InChI=1S/C13H11BrN4OS/c1-8-2-3-16-11(4-8)17-13(20)18-12(19)9-5-10(14)7-15-6-9/h2-7H,1H3,(H2,16,17,18,19,20)	WTRBQKRLGVMELH-UHFFFAOYSA-N	349.983694302							116399
AC1LU286	LSM-27854	BRD-K62340793	1544899	InChI=1S/C17H13N3O4S/c21-15(10-25-17-19-13-7-3-4-8-14(13)24-17)20-18-9-11-5-1-2-6-12(11)16(22)23/h1-9H,10H2,(H,20,21)(H,22,23)	UMWJDVHPIOIAPB-UHFFFAOYSA-N	OC(=O)c1ccccc1C=NNC(=O)CSc2oc3ccccc3n2	BroadT	BRD-K62340793	BRD-K62340793-001-05-0	InterBioScreen Ltd.	STOCK2S-90268			OC(=O)c1ccccc1C=NNC(=O)CSc1nc2ccccc2o1	InChI=1S/C17H13N3O4S/c21-15(10-25-17-19-13-7-3-4-8-14(13)24-17)20-18-9-11-5-1-2-6-12(11)16(22)23/h1-9H,10H2,(H,20,21)(H,22,23)	UMWJDVHPIOIAPB-UHFFFAOYSA-N	355.062676616							116400
AC1NF8WE	LSM-27855	BRD-K34151079	4679766	InChI=1S/C22H25F2N3O6S/c1-30-9-4-8-27-20(29)18(34-21(27)15(13-25)19(28)26-7-10-31-2)12-14-5-6-16(33-22(23)24)17(11-14)32-3/h5-6,11-12,22H,4,7-10H2,1-3H3,(H,26,28)	SFCAECFGEDOCOT-UHFFFAOYSA-N	COCCCN1C(=O)C(=Cc2ccc(OC(F)F)c(OC)c2)SC1=C(C#N)C(=O)NCCOC	BroadT	BRD-K34151079	BRD-K34151079-001-05-1	Enamine Ltd.	T0519-9607			COCCCn1c(=O)c(=Cc2ccc(OC(F)F)c(OC)c2)sc1=C(C#N)C(=O)NCCOC	InChI=1S/C22H25F2N3O6S/c1-30-9-4-8-27-20(29)18(34-21(27)15(13-25)19(28)26-7-10-31-2)12-14-5-6-16(33-22(23)24)17(11-14)32-3/h5-6,11-12,22H,4,7-10H2,1-3H3,(H,26,28)	SFCAECFGEDOCOT-UHFFFAOYSA-N	497.14321264							116401
AC1LULOQ	LSM-44230	BRD-K63499694	1584416	InChI=1S/C14H11N3O3S/c18-14(13-8-4-10-21-13)16-15-9-3-6-11-5-1-2-7-12(11)17(19)20/h1-10H,(H,16,18)/b6-3-,15-9?	APNMOOQPFHLKOS-QKDPKPEMSA-N	[O-][N+](=O)c1ccccc1\C=C/C=NNC(=O)c2cccs2	BroadT	BRD-K63499694	BRD-K63499694-001-05-3	ChemDiv Inc.	3254-3211			[O-][N+](=O)c1ccccc1\C=C/C=NNC(=O)c1cccs1	InChI=1S/C14H11N3O3S/c18-14(13-8-4-10-21-13)16-15-9-3-6-11-5-1-2-7-12(11)17(19)20/h1-10H,(H,16,18)/b6-3-,15-9?	APNMOOQPFHLKOS-QKDPKPEMSA-N	301.052111932							
MLS000692877	LSM-27857	SID24790538, BRD-K25290559	2052604	InChI=1S/C18H20ClNO5/c1-23-9-8-20-10-14(17(21)24-2)16(15(11-20)18(22)25-3)12-4-6-13(19)7-5-12/h4-7,10-11,16H,8-9H2,1-3H3	YIXFNDKDMFPVQV-UHFFFAOYSA-N	COCCN1C=C(C(C(=C1)C(=O)OC)c2ccc(Cl)cc2)C(=O)OC	BroadT	BRD-K25290559	BRD-K25290559-001-06-5	Asinex Ltd.	BAS 04379433			COCCN1C=C(C(c2ccc(Cl)cc2)C(=C1)C(=O)OC)C(=O)OC	InChI=1S/C18H20ClNO5/c1-23-9-8-20-10-14(17(21)24-2)16(15(11-20)18(22)25-3)12-4-6-13(19)7-5-12/h4-7,10-11,16H,8-9H2,1-3H3	YIXFNDKDMFPVQV-UHFFFAOYSA-N	365.10300046							116403
F0745-0962	LSM-27858	SID17516588, BRD-K66904418	1183992	InChI=1S/C21H20N4OS/c1-14-7-9-17(10-8-14)25-15(2)12-18(16(25)3)19(26)13-27-21-23-22-20-6-4-5-11-24(20)21/h4-12H,13H2,1-3H3	BDIBVTWWRGIXQA-UHFFFAOYSA-N	Cc1ccc(cc1)n2c(C)cc(C(=O)CSc3nnc4ccccn34)c2C	BroadT	BRD-K66904418	BRD-K66904418-001-06-2	Enamine Ltd.	T0501-6714			Cc1cc(C(=O)CSc2nnc3ccccn23)c(C)n1-c1ccc(C)cc1	InChI=1S/C21H20N4OS/c1-14-7-9-17(10-8-14)25-15(2)12-18(16(25)3)19(26)13-27-21-23-22-20-6-4-5-11-24(20)21/h4-12H,13H2,1-3H3	BDIBVTWWRGIXQA-UHFFFAOYSA-N	376.13578199							116404
ZINC02968549	LSM-27859	SID47198761, BRD-K54583722	2274462	InChI=1S/C19H15NO2/c1-13(21)15-7-4-8-18(12-15)20-19(22)17-10-9-14-5-2-3-6-16(14)11-17/h2-12H,1H3,(H,20,22)	HHZNWFMAOMBCMP-UHFFFAOYSA-N	CC(=O)c1cccc(NC(=O)c2ccc3ccccc3c2)c1	BroadT	BRD-K54583722	BRD-K54583722-001-05-1	ChemBridge Corporation	6242125			CC(=O)c1cccc(NC(=O)c2ccc3ccccc3c2)c1	InChI=1S/C19H15NO2/c1-13(21)15-7-4-8-18(12-15)20-19(22)17-10-9-14-5-2-3-6-16(14)11-17/h2-12H,1H3,(H,20,22)	HHZNWFMAOMBCMP-UHFFFAOYSA-N	289.11027873							116405
5,8-Dimethoxy-4-(4-methyl-piperazin-1-yl)-2-trifluoromethyl-quinoline	LSM-27860	SID851519, BRD-K50659271	654094	InChI=1S/C17H20F3N3O2/c1-22-6-8-23(9-7-22)11-10-14(17(18,19)20)21-16-13(25-3)5-4-12(24-2)15(11)16/h4-5,10H,6-9H2,1-3H3	VGSICGDXYTZNMG-UHFFFAOYSA-N	COc1ccc(OC)c2c(cc(nc12)C(F)(F)F)N3CCN(C)CC3	BroadT	BRD-K50659271	BRD-K50659271-001-05-8	Asinex Ltd.	BAS 05210878			COc1ccc(OC)c2c(cc(nc12)C(F)(F)F)N1CCN(C)CC1	InChI=1S/C17H20F3N3O2/c1-22-6-8-23(9-7-22)11-10-14(17(18,19)20)21-16-13(25-3)5-4-12(24-2)15(11)16/h4-5,10H,6-9H2,1-3H3	VGSICGDXYTZNMG-UHFFFAOYSA-N	355.15076151							116406
MLS000084897	LSM-44231	SID4247999, BRD-K10809028	3242134	InChI=1S/C14H15NOS/c1-3-13-9-11(14(16)17-13)10-15(2)12-7-5-4-6-8-12/h4-10H,3H2,1-2H3/b11-10-	SXHJFACKRQUEPO-KHPPLWFESA-N	CCC1=C\C(=C\N(C)c2ccccc2)\C(=O)S1	BroadT	BRD-K10809028	BRD-K10809028-001-06-2	ChemDiv Inc.	1726-0010			CCC1=C\C(=C\N(C)c2ccccc2)C(=O)S1	InChI=1S/C14H15NOS/c1-3-13-9-11(14(16)17-13)10-15(2)12-7-5-4-6-8-12/h4-10H,3H2,1-2H3/b11-10-	SXHJFACKRQUEPO-KHPPLWFESA-N	245.0874348							
MLS000325699	LSM-27862	SID17402967, BRD-K34719703	1487198	InChI=1S/C22H21Cl2NO2/c1-27-21-4-2-3-16(13-21)14-25-15-22(26,17-5-9-19(23)10-6-17)18-7-11-20(24)12-8-18/h2-13,25-26H,14-15H2,1H3	IHESIDBSDQSQLP-UHFFFAOYSA-N	COc1cccc(CNCC(O)(c2ccc(Cl)cc2)c3ccc(Cl)cc3)c1	BroadT	BRD-K34719703	BRD-K34719703-001-06-7	Key Organics Ltd.	1J-325S			COc1cccc(CNCC(O)(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c1	InChI=1S/C22H21Cl2NO2/c1-27-21-4-2-3-16(13-21)14-25-15-22(26,17-5-9-19(23)10-6-17)18-7-11-20(24)12-8-18/h2-13,25-26H,14-15H2,1H3	IHESIDBSDQSQLP-UHFFFAOYSA-N	401.094934342							116408
AN-329/42548499	LSM-27863	SID14727427, BRD-K85403577	1226680	InChI=1S/C19H23N3O3S/c1-15-4-3-5-16(14-15)19(23)20-17-6-8-18(9-7-17)26(24,25)22-12-10-21(2)11-13-22/h3-9,14H,10-13H2,1-2H3,(H,20,23)	LRWGXKLZCZFPDZ-UHFFFAOYSA-N	CN1CCN(CC1)S(=O)(=O)c2ccc(NC(=O)c3cccc(C)c3)cc2	BroadT	BRD-K85403577	BRD-K85403577-001-05-1	Specs	AN-329/42548499			CN1CCN(CC1)S(=O)(=O)c1ccc(NC(=O)c2cccc(C)c2)cc1	InChI=1S/C19H23N3O3S/c1-15-4-3-5-16(14-15)19(23)20-17-6-8-18(9-7-17)26(24,25)22-12-10-21(2)11-13-22/h3-9,14H,10-13H2,1-2H3,(H,20,23)	LRWGXKLZCZFPDZ-UHFFFAOYSA-N	373.146012316							116409
SMR000193739	LSM-44232	SID17431961, BRD-K63948827	5509098	InChI=1S/C21H16ClN3O5/c1-13-3-2-4-16(11-13)23-21(27)18(12-17-9-10-19(30-17)25(28)29)24-20(26)14-5-7-15(22)8-6-14/h2-12H,1H3,(H,23,27)(H,24,26)/b18-12+	MRRPZMLOSSTMBR-LDADJPATSA-N	Cc1cccc(NC(=O)\C(=C/c2oc(cc2)[N+](=O)[O-])\NC(=O)c3ccc(Cl)cc3)c1	BroadT	BRD-K63948827	BRD-K63948827-001-05-9	ChemBridge Corporation	5959333			Cc1cccc(NC(=O)C(\NC(=O)c2ccc(Cl)cc2)=C/c2ccc(o2)[N+]([O-])=O)c1	InChI=1S/C21H16ClN3O5/c1-13-3-2-4-16(11-13)23-21(27)18(12-17-9-10-19(30-17)25(28)29)24-20(26)14-5-7-15(22)8-6-14/h2-12H,1H3,(H,23,27)(H,24,26)/b18-12+	MRRPZMLOSSTMBR-LDADJPATSA-N	425.077848352							
SMR000007978	LSM-27865	SID26668322, SID850213, BRD-K01143720	652723	InChI=1S/C24H26ClN7O2/c1-24(2,3)23-26-20(30-10-12-31(13-11-30)22(33)18-9-6-14-34-18)19-21(27-23)32(29-28-19)15-16-7-4-5-8-17(16)25/h4-9,14H,10-13,15H2,1-3H3	XHFIJGWAJPCDKS-UHFFFAOYSA-N	CC(C)(C)c1nc(N2CCN(CC2)C(=O)c3occc3)c4nnn(Cc5ccccc5Cl)c4n1	BroadT	BRD-K01143720	BRD-K01143720-001-06-8	Asinex Ltd.	ASN 07369281			CC(C)(C)c1nc(N2CCN(CC2)C(=O)c2ccco2)c2nnn(Cc3ccccc3Cl)c2n1	InChI=1S/C24H26ClN7O2/c1-24(2,3)23-26-20(30-10-12-31(13-11-30)22(33)18-9-6-14-34-18)19-21(27-23)32(29-28-19)15-16-7-4-5-8-17(16)25/h4-9,14H,10-13,15H2,1-3H3	XHFIJGWAJPCDKS-UHFFFAOYSA-N	479.183650852							116411
N-Bicyclo[2.2.1]hept-2-yl-4-chloro-benzenesulfonamide	LSM-27866	SID49642250, BRD-A53838799	2894402	InChI=1S/C13H16ClNO2S/c14-11-3-5-12(6-4-11)18(16,17)15-13-8-9-1-2-10(13)7-9/h3-6,9-10,13,15H,1-2,7-8H2	YBPCQWFNLIMSAP-UHFFFAOYSA-N	Clc1ccc(cc1)S(=O)(=O)NC2CC3CCC2C3	BroadT	BRD-A53838799	BRD-A53838799-001-06-8	Asinex Ltd.	BAS 02173051			Clc1ccc(cc1)S(=O)(=O)NC1CC2CCC1C2	InChI=1S/C13H16ClNO2S/c14-11-3-5-12(6-4-11)18(16,17)15-13-8-9-1-2-10(13)7-9/h3-6,9-10,13,15H,1-2,7-8H2	YBPCQWFNLIMSAP-UHFFFAOYSA-N	285.059027162							116412
AC1MXFD2	LSM-27867	BRD-K23052602	3789524	InChI=1S/C20H23N7O4/c1-25-16-15(17(28)23-20(25)31)27(19(22-16)26-10-3-2-4-11-26)12-9-21-24-14-7-5-13(6-8-14)18(29)30/h5-9,24H,2-4,10-12H2,1H3,(H,29,30)(H,23,28,31)	LUUFZAGRLVKNHC-UHFFFAOYSA-N	CN1C(=O)NC(=O)c2c1nc(N3CCCCC3)n2CC=NNc4ccc(cc4)C(=O)O	BroadT	BRD-K23052602	BRD-K23052602-001-05-0	InterBioScreen Ltd.	STOCK1S-63585			Cn1c2nc(N3CCCCC3)n(CC=NNc3ccc(cc3)C(O)=O)c2c(=O)[nH]c1=O	InChI=1S/C20H23N7O4/c1-25-16-15(17(28)23-20(25)31)27(19(22-16)26-10-3-2-4-11-26)12-9-21-24-14-7-5-13(6-8-14)18(29)30/h5-9,24H,2-4,10-12H2,1H3,(H,29,30)(H,23,28,31)	LUUFZAGRLVKNHC-UHFFFAOYSA-N	425.181152286							116413
AC1MYJJ7	LSM-27868	BRD-A19485268	3832830	InChI=1S/C11H10N4O3S/c16-9(17)5-8-10(18)14-11(19-8)15-13-6-7-3-1-2-4-12-7/h1-4,6,8H,5H2,(H,16,17)(H,14,15,18)	TWNZROGDCWQZOW-UHFFFAOYSA-N	OC(=O)CC1SC(=NC1=O)NN=Cc2ccccn2	BroadT	BRD-A19485268	BRD-A19485268-001-06-3	InterBioScreen Ltd.	STOCK3S-82623			OC(=O)CC1SC(NN=Cc2ccccn2)=NC1=O	InChI=1S/C11H10N4O3S/c16-9(17)5-8-10(18)14-11(19-8)15-13-6-7-3-1-2-4-12-7/h1-4,6,8H,5H2,(H,16,17)(H,14,15,18)	TWNZROGDCWQZOW-UHFFFAOYSA-N	278.04736091							116414
AC1O9U9K	LSM-27869	SID860910, BRD-K76459284	6772582	InChI=1S/C20H22N4O2/c25-18-8-4-2-6-16(18)20-22-17-7-3-1-5-15(17)19(23-20)21-9-10-24-11-13-26-14-12-24/h1-8,25H,9-14H2,(H,21,22,23)	XVAZSZOISVGIDR-UHFFFAOYSA-N	Oc1ccccc1c2nc(NCCN3CCOCC3)c4ccccc4n2	BroadT	BRD-K76459284	BRD-K76459284-001-06-6	InterBioScreen Ltd.	STOCK3S-96030			Oc1ccccc1-c1nc(NCCN2CCOCC2)c2ccccc2n1	InChI=1S/C20H22N4O2/c25-18-8-4-2-6-16(18)20-22-17-7-3-1-5-15(17)19(23-20)21-9-10-24-11-13-26-14-12-24/h1-8,25H,9-14H2,(H,21,22,23)	XVAZSZOISVGIDR-UHFFFAOYSA-N	350.174275984							
SMR000075719	LSM-27870	SID4256369, BRD-K08104195	2067268	InChI=1S/C17H18N8O2S/c1-2-27-14(26)11-8-20-17(24-13(11)18)28-9-12-22-15(19)25-16(23-12)21-10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H2,18,20,24)(H3,19,21,22,23,25)	RRXYXSMOOQIPTM-UHFFFAOYSA-N	CCOC(=O)c1cnc(SCc2nc(N)nc(Nc3ccccc3)n2)nc1N	BroadT	BRD-K08104195	BRD-K08104195-001-06-9	ChemBridge Corporation	7742755			CCOC(=O)c1cnc(SCc2nc(N)nc(Nc3ccccc3)n2)nc1N	InChI=1S/C17H18N8O2S/c1-2-27-14(26)11-8-20-17(24-13(11)18)28-9-12-22-15(19)25-16(23-12)21-10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H2,18,20,24)(H3,19,21,22,23,25)	RRXYXSMOOQIPTM-UHFFFAOYSA-N	398.127342586							116416
MLS000099900	LSM-27871	SID4255755, BRD-K90441266	2013066	InChI=1S/C15H22N4O/c1-12-10-13(2)18-15(14(12)11-16)17-4-3-5-19-6-8-20-9-7-19/h10H,3-9H2,1-2H3,(H,17,18)	IFGDZGMJCVOVLP-UHFFFAOYSA-N	Cc1cc(C)c(C#N)c(NCCCN2CCOCC2)n1	BroadT	BRD-K90441266	BRD-K90441266-001-06-8	ChemBridge Corporation	7952893			Cc1cc(C)c(C#N)c(NCCCN2CCOCC2)n1	InChI=1S/C15H22N4O/c1-12-10-13(2)18-15(14(12)11-16)17-4-3-5-19-6-8-20-9-7-19/h10H,3-9H2,1-2H3,(H,17,18)	IFGDZGMJCVOVLP-UHFFFAOYSA-N	274.179361364							116417
MLS001124631	LSM-27872	SID49818938, BRD-A97036175	24817733	InChI=1S/C22H25N3O3/c1-14-7-8-16(11-15(14)2)25-20-6-4-5-19(18(20)12-23-25)24-22(26)21-10-9-17(28-21)13-27-3/h7-12,19H,4-6,13H2,1-3H3,(H,24,26)	YRKWRTZXNMAEFK-UHFFFAOYSA-N	COCc1oc(cc1)C(=O)NC2CCCc3c2cnn3c4ccc(C)c(C)c4	BroadT	BRD-A97036175	BRD-A97036175-001-05-3	ChemBridge Corporation	84190108			COCc1ccc(o1)C(=O)NC1CCCc2c1cnn2-c1ccc(C)c(C)c1	InChI=1S/C22H25N3O3/c1-14-7-8-16(11-15(14)2)25-20-6-4-5-19(18(20)12-23-25)24-22(26)21-10-9-17(28-21)13-27-3/h7-12,19H,4-6,13H2,1-3H3,(H,24,26)	YRKWRTZXNMAEFK-UHFFFAOYSA-N	379.18959169							116418
AC1LZMO3	LSM-44233	BRD-K93402858	1977954	InChI=1S/C18H15ClN4OS/c19-15(11-14-7-3-1-4-8-14)12-20-23-17(21-22-18(23)25)13-24-16-9-5-2-6-10-16/h1-12H,13H2,(H,22,25)/b15-11-,20-12?	BETBXBZZWDBHFR-RJAGYNMQSA-N	Sc1nnc(COc2ccccc2)n1N=C\C(=C\c3ccccc3)\Cl	BroadT	BRD-K93402858	BRD-K93402858-001-07-9	ChemBridge Corporation	7191178			Sc1nnc(COc2ccccc2)n1N=C\C(Cl)=C\c1ccccc1	InChI=1S/C18H15ClN4OS/c19-15(11-14-7-3-1-4-8-14)12-20-23-17(21-22-18(23)25)13-24-16-9-5-2-6-10-16/h1-12H,13H2,(H,22,25)/b15-11-,20-12?	BETBXBZZWDBHFR-RJAGYNMQSA-N	370.06550954							
AC1LMD95	LSM-27874	BRD-K48823689	1128434	InChI=1S/C19H21N5O4/c1-24-7-5-6-15(24)13-9-14(22-21-13)19(25)23-20-11-12-8-17(27-3)18(28-4)10-16(12)26-2/h5-11H,1-4H3,(H,21,22)(H,23,25)	QXDLTJZVPLCQFM-UHFFFAOYSA-N	COc1cc(OC)c(C=NNC(=O)c2cc([nH]n2)c3cccn3C)cc1OC	BroadT	BRD-K48823689	BRD-K48823689-001-05-1	Asinex Ltd.	BAS 01858808			COc1cc(OC)c(C=NNC(=O)c2cc([nH]n2)-c2cccn2C)cc1OC	InChI=1S/C19H21N5O4/c1-24-7-5-6-15(24)13-9-14(22-21-13)19(25)23-20-11-12-8-17(27-3)18(28-4)10-16(12)26-2/h5-11H,1-4H3,(H,21,22)(H,23,25)	QXDLTJZVPLCQFM-UHFFFAOYSA-N	383.159354202							116420
T5250104	LSM-27875	SID3716978, BRD-K01830527	2123287	InChI=1S/C10H10N4O2/c1-4-8(11-5-1)12-10-14-13-9(16-10)7-3-2-6-15-7/h2-3,6H,1,4-5H2,(H,11,12,14)	VMGYZKHFZRVYEU-UHFFFAOYSA-N	C1CN=C(C1)Nc2oc(nn2)c3occc3	BroadT	BRD-K01830527	BRD-K01830527-001-05-7	Enamine Ltd.	T5250104			C1CN=C(C1)Nc1nnc(o1)-c1ccco1	InChI=1S/C10H10N4O2/c1-4-8(11-5-1)12-10-14-13-9(16-10)7-3-2-6-15-7/h2-3,6H,1,4-5H2,(H,11,12,14)	VMGYZKHFZRVYEU-UHFFFAOYSA-N	218.0803756							116421
MLS000044522	LSM-27876	SID4245805, BRD-K47259384	3240232	InChI=1S/C25H21FN6O3/c26-20-7-3-4-8-22(20)30-11-13-31(14-12-30)24(34)19-16-32(25(35)18-6-2-1-5-17(18)19)29-23(33)21-15-27-9-10-28-21/h1-10,15-16H,11-14H2,(H,29,33)	FIJGPYYANFEKGF-UHFFFAOYSA-N	Fc1ccccc1N2CCN(CC2)C(=O)C3=CN(NC(=O)c4cnccn4)C(=O)c5ccccc35	BroadT	BRD-K47259384	BRD-K47259384-001-05-7	ChemDiv Inc.	C125-0876			Fc1ccccc1N1CCN(CC1)C(=O)c1cn(NC(=O)c2cnccn2)c(=O)c2ccccc12	InChI=1S/C25H21FN6O3/c26-20-7-3-4-8-22(20)30-11-13-31(14-12-30)24(34)19-16-32(25(35)18-6-2-1-5-17(18)19)29-23(33)21-15-27-9-10-28-21/h1-10,15-16H,11-14H2,(H,29,33)	FIJGPYYANFEKGF-UHFFFAOYSA-N	472.165916792							116422
BRD-K08878345	LSM-2179	SID85147380	73756217	InChI=1S/C17H15N3O2/c1-2-11-20-14-9-5-3-7-12(14)16(17(20)22)19-18-13-8-4-6-10-15(13)21/h2-10,21-22H,1,11H2	BGWLQENWEYEDFQ-UHFFFAOYSA-N	Oc1ccccc1N=Nc2c(O)n(CC=C)c3ccccc23	BroadT	BRD-K08878345	BRD-K08878345-001-05-9	Sanford-Burnham Medical Research Institute	MLS-0075347.0001			Oc1c(N=Nc2ccccc2O)c2ccccc2n1CC=C	InChI=1S/C17H15N3O2/c1-2-11-20-14-9-5-3-7-12(14)16(17(20)22)19-18-13-8-4-6-10-15(13)21/h2-10,21-22H,1,11H2	BGWLQENWEYEDFQ-UHFFFAOYSA-N	293.11642675							
2-(2-Azepan-1-yl-2-oxo-ethylsulfanyl)-6-methoxy-quinoline-3-carbonitrile	LSM-27877	SID847612, BRD-K11145147	650016	InChI=1S/C19H21N3O2S/c1-24-16-6-7-17-14(11-16)10-15(12-20)19(21-17)25-13-18(23)22-8-4-2-3-5-9-22/h6-7,10-11H,2-5,8-9,13H2,1H3	SJLNQKBEESYCMI-UHFFFAOYSA-N	COc1ccc2nc(SCC(=O)N3CCCCCC3)c(cc2c1)C#N	BroadT	BRD-K11145147	BRD-K11145147-001-05-8	Asinex Ltd.	ASN 05588362			COc1ccc2nc(SCC(=O)N3CCCCCC3)c(cc2c1)C#N	InChI=1S/C19H21N3O2S/c1-24-16-6-7-17-14(11-16)10-15(12-20)19(21-17)25-13-18(23)22-8-4-2-3-5-9-22/h6-7,10-11H,2-5,8-9,13H2,1H3	SJLNQKBEESYCMI-UHFFFAOYSA-N	355.135447632							116423
Isofervenulin	LSM-27878	BRD-K72609445, SID7967232, SID842558	334780	InChI=1S/C7H7N5O2/c1-11-5-4(10-9-3-8-5)6(13)12(2)7(11)14/h3H,1-2H3	LGLSGALYZJZNIG-UHFFFAOYSA-N	CN1C(=O)N(C)c2ncnnc2C1=O	BroadT	BRD-K72609445	BRD-K72609445-001-05-8	ChemDiv Inc.	5342-0645			Cn1c2ncnnc2c(=O)n(C)c1=O	InChI=1S/C7H7N5O2/c1-11-5-4(10-9-3-8-5)6(13)12(2)7(11)14/h3H,1-2H3	LGLSGALYZJZNIG-UHFFFAOYSA-N	193.059974514							116424
ZINC01435809	LSM-27879	BRD-K72283109	6763728	InChI=1S/C13H16Br2N2O3/c1-3-13(20,4-2)12(19)17-16-7-8-5-9(14)6-10(15)11(8)18/h5-7,18,20H,3-4H2,1-2H3,(H,17,19)	BUFRZQLWLYJKMY-UHFFFAOYSA-N	CCC(O)(CC)C(=O)NN=Cc1cc(Br)cc(Br)c1O	BroadT	BRD-K72283109	BRD-K72283109-001-07-5	InterBioScreen Ltd.	STOCK1S-62867			CCC(O)(CC)C(=O)NN=Cc1cc(Br)cc(Br)c1O	InChI=1S/C13H16Br2N2O3/c1-3-13(20,4-2)12(19)17-16-7-8-5-9(14)6-10(15)11(8)18/h5-7,18,20H,3-4H2,1-2H3,(H,17,19)	BUFRZQLWLYJKMY-UHFFFAOYSA-N	405.952767592							
SMR000081053	LSM-27880	SID4261738, BRD-A56930647	2972628	InChI=1S/C20H21ClN2O3/c1-12-18-16(22-19(12)20(25)23-6-8-26-9-7-23)10-13(11-17(18)24)14-4-2-3-5-15(14)21/h2-5,13,22H,6-11H2,1H3	ZUFSHMVDVFUFHP-UHFFFAOYSA-N	Cc1c([nH]c2CC(CC(=O)c12)c3ccccc3Cl)C(=O)N4CCOCC4	BroadT	BRD-A56930647	BRD-A56930647-001-05-6	ChemBridge Corporation	7953254			Cc1c([nH]c2CC(CC(=O)c12)c1ccccc1Cl)C(=O)N1CCOCC1	InChI=1S/C20H21ClN2O3/c1-12-18-16(22-19(12)20(25)23-6-8-26-9-7-23)10-13(11-17(18)24)14-4-2-3-5-15(14)21/h2-5,13,22H,6-11H2,1H3	ZUFSHMVDVFUFHP-UHFFFAOYSA-N	372.124070262							116426
AC1OBKEN	LSM-27881	BRD-K20631756	6824794	InChI=1S/C13H17N5/c1-3-18(4-2)13(15)12(10-14)17-16-11-8-6-5-7-9-11/h5-9,15-16H,3-4H2,1-2H3	XHKGNGBBOJVQME-UHFFFAOYSA-N	CCN(CC)C(=N)C(=NNc1ccccc1)C#N	BroadT	BRD-K20631756	BRD-K20631756-001-04-1	InterBioScreen Ltd.	STOCK1S-08337			CCN(CC)C(=N)C(=NNc1ccccc1)C#N	InChI=1S/C13H17N5/c1-3-18(4-2)13(15)12(10-14)17-16-11-8-6-5-7-9-11/h5-9,15-16H,3-4H2,1-2H3	XHKGNGBBOJVQME-UHFFFAOYSA-N	243.148395594							116427
Methyl 2-methyl-4-phenyl-1H-pyrrole-3-carboxylate	LSM-27882	SID26659818, BRD-K30978849	910657	InChI=1S/C13H13NO2/c1-9-12(13(15)16-2)11(8-14-9)10-6-4-3-5-7-10/h3-8,14H,1-2H3	OCIWPTHNKMNUIK-UHFFFAOYSA-N	COC(=O)c1c(C)[nH]cc1c2ccccc2	BroadT	BRD-K30978849	BRD-K30978849-001-05-0	InterBioScreen Ltd.	STOCK1S-07110			COC(=O)c1c(C)[nH]cc1-c1ccccc1	InChI=1S/C13H13NO2/c1-9-12(13(15)16-2)11(8-14-9)10-6-4-3-5-7-10/h3-8,14H,1-2H3	OCIWPTHNKMNUIK-UHFFFAOYSA-N	215.094628666							116428
SMR000176996	LSM-27883	SID17403231, BRD-K90047732	1933034	InChI=1S/C14H13N3O4S/c1-20-10-6-4-9(5-7-10)12(18)16-17-14(22)15-13(19)11-3-2-8-21-11/h2-8H,1H3,(H,16,18)(H2,15,17,19,22)	FRUXRPWKBWGSKB-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NNC(=S)NC(=O)c2occc2	BroadT	BRD-K90047732	BRD-K90047732-001-06-9	Asinex Ltd.	BAS 01555379			COc1ccc(cc1)C(=O)NNC(=S)NC(=O)c1ccco1	InChI=1S/C14H13N3O4S/c1-20-10-6-4-9(5-7-10)12(18)16-17-14(22)15-13(19)11-3-2-8-21-11/h2-8H,1H3,(H,16,18)(H2,15,17,19,22)	FRUXRPWKBWGSKB-UHFFFAOYSA-N	319.062676616							116429
MLS000573744	LSM-27884	SID17413269, BRD-A24014744	2831098	InChI=1S/C20H21N3O6/c1-20(2)7-13(24)18-16(8-20)29-19(22)11(9-21)17(18)10-5-14(27-3)15(28-4)6-12(10)23(25)26/h5-6,17H,7-8,22H2,1-4H3	KFYXKYQYEBICFR-UHFFFAOYSA-N	COc1cc(C2C(=C(N)OC3=C2C(=O)CC(C)(C)C3)C#N)c(cc1OC)[N+](=O)[O-]	BroadT	BRD-A24014744	BRD-A24014744-001-06-8	ChemBridge Corporation	5154938			COc1cc(C2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c(cc1OC)[N+]([O-])=O	InChI=1S/C20H21N3O6/c1-20(2)7-13(24)18-16(8-20)29-19(22)11(9-21)17(18)10-5-14(27-3)15(28-4)6-12(10)23(25)26/h5-6,17H,7-8,22H2,1-4H3	KFYXKYQYEBICFR-UHFFFAOYSA-N	399.143035422							116430
3-Benzyl-5-tert-butyl-1,3,5-thiadiazinane-2-thione	LSM-27885	SID24814223, BRD-K26967046	3328950	InChI=1S/C14H20N2S2/c1-14(2,3)16-10-15(13(17)18-11-16)9-12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3	INUJTAJCTGFIRA-UHFFFAOYSA-N	CC(C)(C)N1CSC(=S)N(Cc2ccccc2)C1	BroadT	BRD-K26967046	BRD-K26967046-001-05-0	ChemDiv Inc.	K417-0158			CC(C)(C)N1CSC(=S)N(Cc2ccccc2)C1	InChI=1S/C14H20N2S2/c1-14(2,3)16-10-15(13(17)18-11-16)9-12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3	INUJTAJCTGFIRA-UHFFFAOYSA-N	280.10679004							116431
AC1O9XB6	LSM-27886	SID14720521, BRD-K58160839	6739711	InChI=1S/C17H16N2O3/c1-21-12-5-3-11(4-6-12)15-10-16(19-18-15)14-9-13(22-2)7-8-17(14)20/h3-10,20H,1-2H3,(H,18,19)	RZODUFKQXLUCTQ-UHFFFAOYSA-N	COc1ccc(cc1)c2cc([nH]n2)c3cc(OC)ccc3O	BroadT	BRD-K58160839	BRD-K58160839-001-05-4	Asinex Ltd.	BAS 01121864			COc1ccc(cc1)-c1cc([nH]n1)-c1cc(OC)ccc1O	InChI=1S/C17H16N2O3/c1-21-12-5-3-11(4-6-12)15-10-16(19-18-15)14-9-13(22-2)7-8-17(14)20/h3-10,20H,1-2H3,(H,18,19)	RZODUFKQXLUCTQ-UHFFFAOYSA-N	296.116092392							
SMR000218495	LSM-27887	SID17504374, BRD-K99048138	6407317	InChI=1S/C28H28N4O2/c1-19-10-12-20(13-11-19)26-22-8-4-5-9-23(22)27(31-30-26)29-21-14-15-25(34-2)24(18-21)28(33)32-16-6-3-7-17-32/h4-5,8-15,18H,3,6-7,16-17H2,1-2H3,(H,29,31)	SCXVLXCGVBVLJG-UHFFFAOYSA-N	COc1ccc(Nc2nnc(c3ccc(C)cc3)c4ccccc24)cc1C(=O)N5CCCCC5	BroadT	BRD-K99048138	BRD-K99048138-001-06-8	InterBioScreen Ltd.	STOCK3S-33309			COc1ccc(Nc2nnc(-c3ccc(C)cc3)c3ccccc23)cc1C(=O)N1CCCCC1	InChI=1S/C28H28N4O2/c1-19-10-12-20(13-11-19)26-22-8-4-5-9-23(22)27(31-30-26)29-21-14-15-25(34-2)24(18-21)28(33)32-16-6-3-7-17-32/h4-5,8-15,18H,3,6-7,16-17H2,1-2H3,(H,29,31)	SCXVLXCGVBVLJG-UHFFFAOYSA-N	452.221226176							116433
MLS000535964	LSM-27888	SID16953033, BRD-K77484029	2100902	InChI=1S/C21H15F3N4OS/c1-13-12-30-20(26-13)17-11-25-28(16-8-3-2-4-9-16)18(17)27-19(29)14-6-5-7-15(10-14)21(22,23)24/h2-12H,1H3,(H,27,29)	AGAHBUGKJJYNCW-UHFFFAOYSA-N	Cc1csc(n1)c2cnn(c2NC(=O)c3cccc(c3)C(F)(F)F)c4ccccc4	BroadT	BRD-K77484029	BRD-K77484029-001-06-3	Enamine Ltd.	T5234955			Cc1csc(n1)-c1cnn(c1NC(=O)c1cccc(c1)C(F)(F)F)-c1ccccc1	InChI=1S/C21H15F3N4OS/c1-13-12-30-20(26-13)17-11-25-28(16-8-3-2-4-9-16)18(17)27-19(29)14-6-5-7-15(10-14)21(22,23)24/h2-12H,1H3,(H,27,29)	AGAHBUGKJJYNCW-UHFFFAOYSA-N	428.09186643							116434
BDBM94088	LSM-27889	BRD-A89277084	46708371	InChI=1S/C19H16N2O6/c1-2-27-19(24)15-16(12-7-6-10-14(11-12)21(25)26)20(18(23)17(15)22)13-8-4-3-5-9-13/h3-11,15-16H,2H2,1H3	WPKPQGLQJCXHCR-UHFFFAOYSA-N	CCOC(=O)C1C(N(C(=O)C1=O)c2ccccc2)c3cccc(c3)[N+](=O)[O-]	BroadT	BRD-A89277084	BRD-A89277084-001-05-3	InterBioScreen Ltd.	STOCK2S-86506			CCOC(=O)C1C(N(C(=O)C1=O)c1ccccc1)c1cccc(c1)[N+]([O-])=O	InChI=1S/C19H16N2O6/c1-2-27-19(24)15-16(12-7-6-10-14(11-12)21(25)26)20(18(23)17(15)22)13-8-4-3-5-9-13/h3-11,15-16H,2H2,1H3	WPKPQGLQJCXHCR-UHFFFAOYSA-N	368.100836252							116435
SMR000030979	LSM-27890	SID4241076, BRD-K38106829	3236096	InChI=1S/C19H28N4O2S/c1-3-4-7-21(2)8-9-23-18(24)16-14-15(22-10-12-25-13-11-22)5-6-17(16)20-19(23)26/h5-6,14H,3-4,7-13H2,1-2H3,(H,20,26)	BFAQHOKYGODPBW-UHFFFAOYSA-N	CCCCN(C)CCN1C(=S)Nc2ccc(cc2C1=O)N3CCOCC3	BroadT	BRD-K38106829	BRD-K38106829-001-05-4	ChemDiv Inc.	K284-6276			CCCCN(C)CCn1c(=S)[nH]c2ccc(cc2c1=O)N1CCOCC1	InChI=1S/C19H28N4O2S/c1-3-4-7-21(2)8-9-23-18(24)16-14-15(22-10-12-25-13-11-22)5-6-17(16)20-19(23)26/h5-6,14H,3-4,7-13H2,1-2H3,(H,20,26)	BFAQHOKYGODPBW-UHFFFAOYSA-N	376.193296866							116436
MLS000038682	LSM-27891	SID858433, SID87347325, BRD-K82571453	659754	InChI=1S/C10H12F6N4OS2/c1-3-8(9(11,12)13,10(14,15)16)18-5(21)17-6-19-20-7(23-6)22-4-2/h3-4H2,1-2H3,(H2,17,18,19,21)	XKAHKUXGIWVCPM-UHFFFAOYSA-N	CCSc1nnc(NC(=O)NC(CC)(C(F)(F)F)C(F)(F)F)s1	BroadT	BRD-K82571453	BRD-K82571453-001-06-5	InterBioScreen Ltd.	STOCK2S-42036			CCSc1nnc(NC(=O)NC(CC)(C(F)(F)F)C(F)(F)F)s1	InChI=1S/C10H12F6N4OS2/c1-3-8(9(11,12)13,10(14,15)16)18-5(21)17-6-19-20-7(23-6)22-4-2/h3-4H2,1-2H3,(H2,17,18,19,21)	XKAHKUXGIWVCPM-UHFFFAOYSA-N	382.035671624							116437
MLS000877142	LSM-27892	BRD-A12117573	3240986	InChI=1S/C23H32N2O3S2/c1-17-8-6-9-19(14-17)23-25-21(18(2)28-23)15-30(27)16-22(26)24-12-7-13-29-20-10-4-3-5-11-20/h6,8-9,14,20H,3-5,7,10-13,15-16H2,1-2H3,(H,24,26)	GXZOPNFPXQZSTG-UHFFFAOYSA-N	Cc1cccc(c1)c2oc(C)c(CS(=O)CC(=O)NCCCSC3CCCCC3)n2	BroadT	BRD-A12117573	BRD-A12117573-001-05-1	ChemDiv Inc.	C527-0659			Cc1oc(nc1CS(=O)CC(=O)NCCCSC1CCCCC1)-c1cccc(C)c1	InChI=1S/C23H32N2O3S2/c1-17-8-6-9-19(14-17)23-25-21(18(2)28-23)15-30(27)16-22(26)24-12-7-13-29-20-10-4-3-5-11-20/h6,8-9,14,20H,3-5,7,10-13,15-16H2,1-2H3,(H,24,26)	GXZOPNFPXQZSTG-UHFFFAOYSA-N	448.185434284							116438
SMR000047755	LSM-27893	SID24840762, SID865151, BRD-A27091254	666401	InChI=1S/C26H32N4O6/c1-16-12-22-24(26(31)30(16)7-5-6-29-8-10-35-11-9-29)23(18(15-27)25(28)36-22)17-13-20(33-3)21(34-4)14-19(17)32-2/h12-14,23H,5-11,28H2,1-4H3	FMHUZGLCEAUEMO-UHFFFAOYSA-N	COc1cc(OC)c(cc1OC)C2C(=C(N)OC3=C2C(=O)N(CCCN4CCOCC4)C(=C3)C)C#N	BroadT	BRD-A27091254	BRD-A27091254-001-05-7	InterBioScreen Ltd.	STOCK5S-38725			COc1cc(OC)c(cc1OC)C1C(C#N)=C(N)Oc2cc(C)n(CCCN3CCOCC3)c(=O)c12	InChI=1S/C26H32N4O6/c1-16-12-22-24(26(31)30(16)7-5-6-29-8-10-35-11-9-29)23(18(15-27)25(28)36-22)17-13-20(33-3)21(34-4)14-19(17)32-2/h12-14,23H,5-11,28H2,1-4H3	FMHUZGLCEAUEMO-UHFFFAOYSA-N	496.232184784							116439
AI-204/31710035	LSM-15412	DNDI1417119, BRD-K51993264	901063	InChI=1S/C14H15Cl2N2/c1-17(2)11-6-8-18(9-7-11)10-12-13(15)4-3-5-14(12)16/h3-9H,10H2,1-2H3/q+1	NWEBNKIPPPLMNS-UHFFFAOYSA-N	CN(C)c1cc[n+](Cc2c(Cl)cccc2Cl)cc1	BroadT	BRD-K51993264	BRD-K51993264-003-06-3	Specs	AI-204/31710035		Cl	CN(C)c1cc[n+](Cc2c(Cl)cccc2Cl)cc1.Cl	InChI=1S/C14H15Cl2N2.ClH/c1-17(2)11-6-8-18(9-7-11)10-12-13(15)4-3-5-14(12)16;/h3-9H,10H2,1-2H3;1H/q+1;	PMUSJWZXQSQURU-UHFFFAOYSA-N	281.06122892							104054, 104054
ASN 03776209	LSM-27894	SID24802777, BRD-A30348862	3175951	InChI=1S/C21H28N4O4S/c1-24(2)5-6-25(21(30)22-11-16-4-3-7-27-16)12-15-8-14-9-18-19(29-13-28-18)10-17(14)23-20(15)26/h8-10,16H,3-7,11-13H2,1-2H3,(H,22,30)(H,23,26)	WDKMWWJAYFRUHV-UHFFFAOYSA-N	CN(C)CCN(Cc1cc2cc3OCOc3cc2nc1O)C(=NCC4CCCO4)S	BroadT	BRD-A30348862	BRD-A30348862-001-05-0	Asinex Ltd.	ASN 03776209			CN(C)CCN(Cc1cc2cc3OCOc3cc2nc1O)C(S)=NCC1CCCO1	InChI=1S/C21H28N4O4S/c1-24(2)5-6-25(21(30)22-11-16-4-3-7-27-16)12-15-8-14-9-18-19(29-13-28-18)10-17(14)23-20(15)26/h8-10,16H,3-7,11-13H2,1-2H3,(H,22,30)(H,23,26)	WDKMWWJAYFRUHV-UHFFFAOYSA-N	432.183126106							116440
SMR000003113	LSM-27895	SID26667950, SID842407, BRD-K95528936	644674	InChI=1S/C21H23N5O5S2/c1-25-20(15-5-7-18(8-6-15)33(29,30)26-9-11-31-12-10-26)23-24-21(25)32-14-19(28)22-16-3-2-4-17(27)13-16/h2-8,13,27H,9-12,14H2,1H3,(H,22,28)	AVKUFZPTBDCXRO-UHFFFAOYSA-N	Cn1c(SCC(=O)Nc2cccc(O)c2)nnc1c3ccc(cc3)S(=O)(=O)N4CCOCC4	BroadT	BRD-K95528936	BRD-K95528936-001-05-9	Asinex Ltd.	ASN 04363325			Cn1c(SCC(=O)Nc2cccc(O)c2)nnc1-c1ccc(cc1)S(=O)(=O)N1CCOCC1	InChI=1S/C21H23N5O5S2/c1-25-20(15-5-7-18(8-6-15)33(29,30)26-9-11-31-12-10-26)23-24-21(25)32-14-19(28)22-16-3-2-4-17(27)13-16/h2-8,13,27H,9-12,14H2,1H3,(H,22,28)	AVKUFZPTBDCXRO-UHFFFAOYSA-N	489.114060266							116441
MLS000394593	LSM-27896	SID22407328, BRD-K66941800	2448618	InChI=1S/C24H23N3O4S/c1-14(2)21(26-22(29)16-8-6-7-15(3)11-16)23(30)31-13-17-12-20(28)27-18-9-4-5-10-19(18)32-24(27)25-17/h4-12,14,21H,13H2,1-3H3,(H,26,29)/t21-/m0/s1	SQMFWJMPYREEDQ-NRFANRHFSA-N	CC(C)[C@H](NC(=O)c1cccc(C)c1)C(=O)OCC2=CC(=O)N3C(=N2)Sc4ccccc34	BroadT	BRD-K66941800	BRD-K66941800-001-06-0	Enamine Ltd.	T5324733			CC(C)[C@H](NC(=O)c1cccc(C)c1)C(=O)OCc1cc(=O)n2c(n1)sc1ccccc21	InChI=1S/C24H23N3O4S/c1-14(2)21(26-22(29)16-8-6-7-15(3)11-16)23(30)31-13-17-12-20(28)27-18-9-4-5-10-19(18)32-24(27)25-17/h4-12,14,21H,13H2,1-3H3,(H,26,29)/t21-/m0/s1	SQMFWJMPYREEDQ-NRFANRHFSA-N	449.140926936							116442
CHEMBL1362335	LSM-27897	SID7976624, BRD-K34733241	2272355	InChI=1S/C16H15NO3S/c1-20-16(19)13-9-5-6-10-14(13)17-15(18)11-21-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,17,18)	OXYKUCGUWCMDHZ-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)CSc2ccccc2	BroadT	BRD-K34733241	BRD-K34733241-001-06-7	ChemBridge Corporation	6197806			COC(=O)c1ccccc1NC(=O)CSc1ccccc1	InChI=1S/C16H15NO3S/c1-20-16(19)13-9-5-6-10-14(13)17-15(18)11-21-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,17,18)	OXYKUCGUWCMDHZ-UHFFFAOYSA-N	301.07726404							116443
MLS000058476	LSM-27898	SID3713628, BRD-K91949116	2526141	InChI=1S/C15H10N6O2/c1-2-4-12(5-3-1)21-15(18-19-20-21)23-13-8-6-11(7-9-13)14-17-16-10-22-14/h1-10H	VLHXRYVJTGASCS-UHFFFAOYSA-N	O(c1ccc(cc1)c2ocnn2)c3nnnn3c4ccccc4	BroadT	BRD-K91949116	BRD-K91949116-001-06-1	Enamine Ltd.	T5334353			O(c1nnnn1-c1ccccc1)c1ccc(cc1)-c1nnco1	InChI=1S/C15H10N6O2/c1-2-4-12(5-3-1)21-15(18-19-20-21)23-13-8-6-11(7-9-13)14-17-16-10-22-14/h1-10H	VLHXRYVJTGASCS-UHFFFAOYSA-N	306.08652362							116444
SMR000005990	LSM-27899	SID843336, BRD-K92821282	645627	InChI=1S/C15H19N5O3S2/c1-3-23-12(22)6-10-7-24-14(16-10)17-11(21)8-25-15-19-18-13(20(15)2)9-4-5-9/h7,9H,3-6,8H2,1-2H3,(H,16,17,21)	FDKYTQRXSHSYPS-UHFFFAOYSA-N	CCOC(=O)Cc1csc(NC(=O)CSc2nnc(C3CC3)n2C)n1	BroadT	BRD-K92821282	BRD-K92821282-001-05-1	Asinex Ltd.	ASN 05988684			CCOC(=O)Cc1csc(NC(=O)CSc2nnc(C3CC3)n2C)n1	InChI=1S/C15H19N5O3S2/c1-3-23-12(22)6-10-7-24-14(16-10)17-11(21)8-25-15-19-18-13(20(15)2)9-4-5-9/h7,9H,3-6,8H2,1-2H3,(H,16,17,21)	FDKYTQRXSHSYPS-UHFFFAOYSA-N	381.092930898							116445
MLS000690435	LSM-44234	SID24802562, BRD-K42762874	5739979	InChI=1S/C21H18N4O6/c1-13-3-2-4-15(11-13)22-18(26)12-31-16-8-5-14(6-9-16)7-10-17-19(25(29)30)20(27)24-21(28)23-17/h2-11H,12H2,1H3,(H,22,26)(H2,23,24,27,28)/b10-7-	DRERXXIFEGSVDR-YFHOEESVSA-N	Cc1cccc(NC(=O)COc2ccc(\C=C/c3nc(O)nc(O)c3[N+](=O)[O-])cc2)c1	BroadT	BRD-K42762874	BRD-K42762874-001-05-2	ChemBridge Corporation	7839674			Cc1cccc(NC(=O)COc2ccc(\C=C/c3nc(O)nc(O)c3[N+]([O-])=O)cc2)c1	InChI=1S/C21H18N4O6/c1-13-3-2-4-15(11-13)22-18(26)12-31-16-8-5-14(6-9-16)7-10-17-19(25(29)30)20(27)24-21(28)23-17/h2-11H,12H2,1H3,(H,22,26)(H2,23,24,27,28)/b10-7-	DRERXXIFEGSVDR-YFHOEESVSA-N	422.122634336							
F1303-0013	LSM-27901	SID4261312, BRD-A79980229	2927570	InChI=1S/C19H33NO2/c1-13(2)11-20(12-14(3)4)16(22)19-9-8-18(7,15(21)10-19)17(19,5)6/h13-14H,8-12H2,1-7H3	HNHQJGPQHLCTSC-UHFFFAOYSA-N	CC(C)CN(CC(C)C)C(=O)C12CCC(C)(C(=O)C1)C2(C)C	BroadT	BRD-A79980229	BRD-A79980229-001-05-0	ChemBridge Corporation	7123852			CC(C)CN(CC(C)C)C(=O)C12CCC(C)(C(=O)C1)C2(C)C	InChI=1S/C19H33NO2/c1-13(2)11-20(12-14(3)4)16(22)19-9-8-18(7,15(21)10-19)17(19,5)6/h13-14H,8-12H2,1-7H3	HNHQJGPQHLCTSC-UHFFFAOYSA-N	307.251129306							116447
AK-968/41025072	LSM-44235	SID22414391, BRD-K03571922	6018480	InChI=1S/C15H16N2O/c1-3-17-12(2)14(11-16-17)9-10-15(18)13-7-5-4-6-8-13/h4-11H,3H2,1-2H3/b10-9+	VVFYQOKKAYLJKP-MDZDMXLPSA-N	CCn1ncc(\C=C\C(=O)c2ccccc2)c1C	BroadT	BRD-K03571922	BRD-K03571922-001-05-6	Specs	AK-968/41025072			CCn1ncc(\C=C\C(=O)c2ccccc2)c1C	InChI=1S/C15H16N2O/c1-3-17-12(2)14(11-16-17)9-10-15(18)13-7-5-4-6-8-13/h4-11H,3H2,1-2H3/b10-9+	VVFYQOKKAYLJKP-MDZDMXLPSA-N	240.126263152							
SMR000005056	LSM-27903	SID853221, SID26667767, BRD-A71744686	655875	InChI=1S/C25H28N6O2S/c1-32-22-11-10-19(17-23(22)33-2)24(25-26-27-28-31(25)18-21-9-6-16-34-21)30-14-12-29(13-15-30)20-7-4-3-5-8-20/h3-11,16-17,24H,12-15,18H2,1-2H3	XKYQUQDMGJYQSS-UHFFFAOYSA-N	COc1ccc(cc1OC)C(N2CCN(CC2)c3ccccc3)c4nnnn4Cc5cccs5	BroadT	BRD-A71744686	BRD-A71744686-001-05-4	Asinex Ltd.	ASN 05559095			COc1ccc(cc1OC)C(N1CCN(CC1)c1ccccc1)c1nnnn1Cc1cccs1	InChI=1S/C25H28N6O2S/c1-32-22-11-10-19(17-23(22)33-2)24(25-26-27-28-31(25)18-21-9-6-16-34-21)30-14-12-29(13-15-30)20-7-4-3-5-8-20/h3-11,16-17,24H,12-15,18H2,1-2H3	XKYQUQDMGJYQSS-UHFFFAOYSA-N	476.199444886							116449
AMBCB96707497	LSM-27904	SID49732550, BRD-K42926980	24793226	InChI=1S/C22H23N3O3/c1-25(14-16-5-4-10-23-13-16)22(26)21-12-20(28-24-21)15-27-19-9-8-17-6-2-3-7-18(17)11-19/h4-5,8-13H,2-3,6-7,14-15H2,1H3	MPDNXORLVWKNOG-UHFFFAOYSA-N	CN(Cc1cccnc1)C(=O)c2cc(COc3ccc4CCCCc4c3)on2	BroadT	BRD-K42926980	BRD-K42926980-001-05-4	ChemBridge Corporation	96707497			CN(Cc1cccnc1)C(=O)c1cc(COc2ccc3CCCCc3c2)on1	InChI=1S/C22H23N3O3/c1-25(14-16-5-4-10-23-13-16)22(26)21-12-20(28-24-21)15-27-19-9-8-17-6-2-3-7-18(17)11-19/h4-5,8-13H,2-3,6-7,14-15H2,1H3	MPDNXORLVWKNOG-UHFFFAOYSA-N	377.173941626							116450
AN-465/42889526	LSM-15413	BRD-A31566993	2982246	InChI=1S/C16H17Cl2NO/c1-11(16(20)12-5-3-2-4-6-12)19-10-13-7-8-14(17)9-15(13)18/h2-9,11,16,19-20H,10H2,1H3	JHYSENDMFUMZPU-UHFFFAOYSA-N	CC(NCc1ccc(Cl)cc1Cl)C(O)c2ccccc2	BroadT	BRD-A31566993	BRD-A31566993-003-05-4	ChemBridge Corporation	7983649		Cl	CC(NCc1ccc(Cl)cc1Cl)C(O)c1ccccc1.Cl	InChI=1S/C16H17Cl2NO.ClH/c1-11(16(20)12-5-3-2-4-6-12)19-10-13-7-8-14(17)9-15(13)18;/h2-9,11,16,19-20H,10H2,1H3;1H	RTJDZSLKGUUNQS-UHFFFAOYSA-N	309.068719594							104055, 104055
CID 91617125	LSM-27905	BRD-K17845464	91617125	InChI=1S/C14H15NO5/c1-14(2)19-12(16)11(13(17)20-14)8-15-9-5-4-6-10(7-9)18-3/h4-8,11H,1-3H3	OYXZTXHTLZWJTP-UHFFFAOYSA-N	COc1cccc(c1)N=CC2C(=O)OC(C)(C)OC2=O	BroadT	BRD-K17845464	BRD-K17845464-001-05-2	ChemBridge Corporation	6648448			COc1cccc(c1)N=CC1C(=O)OC(C)(C)OC1=O	InChI=1S/C14H15NO5/c1-14(2)19-12(16)11(13(17)20-14)8-15-9-5-4-6-10(7-9)18-3/h4-8,11H,1-3H3	OYXZTXHTLZWJTP-UHFFFAOYSA-N	277.09502259							116451
1-[1-(3-Chloro-4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxamide	LSM-4452	EMF-SUMO1-6, SID14726696, BRD-A61666925	2951172	InChI=1S/C16H17ClFN3O3/c17-11-7-10(1-2-12(11)18)21-14(22)8-13(16(21)24)20-5-3-9(4-6-20)15(19)23/h1-2,7,9,13H,3-6,8H2,(H2,19,23)	UMMYLBGDOPRQOH-UHFFFAOYSA-N	NC(=O)C1CCN(CC1)C2CC(=O)N(C2=O)c3ccc(F)c(Cl)c3	BroadT	BRD-A61666925	BRD-A61666925-001-09-4	Asinex Ltd.	BAS 07330735			NC(=O)C1CCN(CC1)C1CC(=O)N(C1=O)c1ccc(F)c(Cl)c1	InChI=1S/C16H17ClFN3O3/c17-11-7-10(1-2-12(11)18)21-14(22)8-13(16(21)24)20-5-3-9(4-6-20)15(19)23/h1-2,7,9,13H,3-6,8H2,(H2,19,23)	UMMYLBGDOPRQOH-UHFFFAOYSA-N	353.094247344							93878
AC1NLZX8	LSM-27906	SID24836504, BRD-K19495578	4968798	InChI=1S/C21H22N4O4S/c26-20(14-24-15-22-19-10-3-2-9-18(19)21(24)27)23-16-7-6-8-17(13-16)30(28,29)25-11-4-1-5-12-25/h2-3,6-10,13,15H,1,4-5,11-12,14H2,(H,23,26)	FDSRSBMERQOBIV-UHFFFAOYSA-N	O=C(CN1C=Nc2ccccc2C1=O)Nc3cccc(c3)S(=O)(=O)N4CCCCC4	BroadT	BRD-K19495578	BRD-K19495578-001-06-5	Enamine Ltd.	T5327883			O=C(Cn1cnc2ccccc2c1=O)Nc1cccc(c1)S(=O)(=O)N1CCCCC1	InChI=1S/C21H22N4O4S/c26-20(14-24-15-22-19-10-3-2-9-18(19)21(24)27)23-16-7-6-8-17(13-16)30(28,29)25-11-4-1-5-12-25/h2-3,6-10,13,15H,1,4-5,11-12,14H2,(H,23,26)	FDSRSBMERQOBIV-UHFFFAOYSA-N	426.136175914							116452
MLS000051640	LSM-44236	SID4254661, SID87340105, BRD-K89017236	1243762	InChI=1S/C22H16FNO5/c1-27-21-11-14(10-16(12-24)15-3-5-17(23)6-4-15)2-8-19(21)28-13-18-7-9-20(29-18)22(25)26/h2-11H,13H2,1H3,(H,25,26)/b16-10-	OBFVZGKWVQGPIN-YBEGLDIGSA-N	COc1cc(\C=C(\C#N)/c2ccc(F)cc2)ccc1OCc3oc(cc3)C(=O)O	BroadT	BRD-K89017236	BRD-K89017236-001-05-8	ChemBridge Corporation	7943292			COc1cc(\C=C(\C#N)c2ccc(F)cc2)ccc1OCc1ccc(o1)C(O)=O	InChI=1S/C22H16FNO5/c1-27-21-11-14(10-16(12-24)15-3-5-17(23)6-4-15)2-8-19(21)28-13-18-7-9-20(29-18)22(25)26/h2-11H,13H2,1H3,(H,25,26)/b16-10-	OBFVZGKWVQGPIN-YBEGLDIGSA-N	393.101250822							
ZINC00314466	LSM-27908	SID17415166, BRD-K88569216	805206	InChI=1S/C20H19N3OS/c1-12-7-9-15(10-8-12)19(24)23-20(25)22-17-6-4-5-16-13(2)11-14(3)21-18(16)17/h4-11H,1-3H3,(H2,22,23,24,25)	BQMKEWNYLUXDKI-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)NC(=S)Nc2cccc3c(C)cc(C)nc23	BroadT	BRD-K88569216	BRD-K88569216-001-05-3	ChemBridge Corporation	7118219			Cc1ccc(cc1)C(=O)NC(=S)Nc1cccc2c(C)cc(C)nc12	InChI=1S/C20H19N3OS/c1-12-7-9-15(10-8-12)19(24)23-20(25)22-17-6-4-5-16-13(2)11-14(3)21-18(16)17/h4-11H,1-3H3,(H2,22,23,24,25)	BQMKEWNYLUXDKI-UHFFFAOYSA-N	349.124882948							116454
MLS000774847	LSM-27909	DNDI1417601, BRD-A33265205	3491105	InChI=1S/C20H20ClN3O/c21-16-13-15(20(25)18-14(16)7-6-10-23-18)19(17-8-2-3-9-22-17)24-11-4-1-5-12-24/h2-3,6-10,13,19,25H,1,4-5,11-12H2	UUKXQRCKOJRJOL-UHFFFAOYSA-N	Oc1c(cc(Cl)c2cccnc12)C(N3CCCCC3)c4ccccn4	BroadT	BRD-A33265205	BRD-A33265205-001-06-7	Enamine Ltd.	T0505-8724			Oc1c(cc(Cl)c2cccnc12)C(N1CCCCC1)c1ccccn1	InChI=1S/C20H20ClN3O/c21-16-13-15(20(25)18-14(16)7-6-10-23-18)19(17-8-2-3-9-22-17)24-11-4-1-5-12-24/h2-3,6-10,13,19,25H,1,4-5,11-12H2	UUKXQRCKOJRJOL-UHFFFAOYSA-N	353.12949							116455
SMR000005559	LSM-27910	SID847730, BRD-K92273473	650139	InChI=1S/C25H21N3O5/c1-31-18-6-4-5-17(12-18)25(30)28(13-16-9-10-21-22(11-16)33-15-32-21)14-23-26-20-8-3-2-7-19(20)24(29)27-23/h2-12H,13-15H2,1H3,(H,26,27,29)	PRJJGFWUIYMQOA-UHFFFAOYSA-N	COc1cccc(c1)C(=O)N(Cc2ccc3OCOc3c2)Cc4nc(O)c5ccccc5n4	BroadT	BRD-K92273473	BRD-K92273473-001-05-4	Asinex Ltd.	ASN 05812597			COc1cccc(c1)C(=O)N(Cc1ccc2OCOc2c1)Cc1nc(O)c2ccccc2n1	InChI=1S/C25H21N3O5/c1-31-18-6-4-5-17(12-18)25(30)28(13-16-9-10-21-22(11-16)33-15-32-21)14-23-26-20-8-3-2-7-19(20)24(29)27-23/h2-12H,13-15H2,1H3,(H,26,27,29)	PRJJGFWUIYMQOA-UHFFFAOYSA-N	443.148120802							116456
MLS000035203	LSM-27911	SID852440, BRD-A31118426	655062	InChI=1S/C25H27N3O2/c1-17-14-23(27-24(26-17)18-6-4-3-5-7-18)28-20-10-11-21(28)16-25(29,15-20)19-8-12-22(30-2)13-9-19/h3-9,12-14,20-21,29H,10-11,15-16H2,1-2H3	KWDYFRJIOOERNJ-UHFFFAOYSA-N	COc1ccc(cc1)C2(O)CC3CCC(C2)N3c4cc(C)nc(n4)c5ccccc5	BroadT	BRD-A31118426	BRD-A31118426-001-05-5	Asinex Ltd.	ASN 07483032			COc1ccc(cc1)C1(O)CC2CCC(C1)N2c1cc(C)nc(n1)-c1ccccc1	InChI=1S/C25H27N3O2/c1-17-14-23(27-24(26-17)18-6-4-3-5-7-18)28-20-10-11-21(28)16-25(29,15-20)19-8-12-22(30-2)13-9-19/h3-9,12-14,20-21,29H,10-11,15-16H2,1-2H3	KWDYFRJIOOERNJ-UHFFFAOYSA-N	401.210327134							116457
SMR000075884	LSM-27912	SID4262449, BRD-K73049844	1291604	InChI=1S/C18H18N4O3S2/c1-3-25-17(24)12-6-8-13(9-7-12)19-15(23)11-27-18-21-20-16(22(18)2)14-5-4-10-26-14/h4-10H,3,11H2,1-2H3,(H,19,23)	YKBCCEUTWLIFOK-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)CSc2nnc(c3cccs3)n2C)cc1	BroadT	BRD-K73049844	BRD-K73049844-001-05-3	ChemBridge Corporation	7750283			CCOC(=O)c1ccc(NC(=O)CSc2nnc(-c3cccs3)n2C)cc1	InChI=1S/C18H18N4O3S2/c1-3-25-17(24)12-6-8-13(9-7-12)19-15(23)11-27-18-21-20-16(22(18)2)14-5-4-10-26-14/h4-10H,3,11H2,1-2H3,(H,19,23)	YKBCCEUTWLIFOK-UHFFFAOYSA-N	402.082031856							116458
MLS001110305	LSM-27913	SID49721318, BRD-A72903100	20893110	InChI=1S/C18H19N5O2S/c1-11-5-7-13(8-6-11)20-16(25)14-4-3-9-22(14)18-21-23-15(24)10-12(2)19-17(23)26-18/h5-8,10,14H,3-4,9H2,1-2H3,(H,20,25)	XWYTYZIAMQEZQK-UHFFFAOYSA-N	CC1=CC(=O)N2N=C(SC2=N1)N3CCCC3C(=O)Nc4ccc(C)cc4	BroadT	BRD-A72903100	BRD-A72903100-001-04-6	ChemDiv Inc.	C885-1257			Cc1ccc(NC(=O)C2CCCN2c2nn3c(nc(C)cc3=O)s2)cc1	InChI=1S/C18H19N5O2S/c1-11-5-7-13(8-6-11)20-16(25)14-4-3-9-22(14)18-21-23-15(24)10-12(2)19-17(23)26-18/h5-8,10,14H,3-4,9H2,1-2H3,(H,20,25)	XWYTYZIAMQEZQK-UHFFFAOYSA-N	369.125945588							116459
F1601-0474	LSM-27914	SID24822923, BRD-K14132644	768738	InChI=1S/C11H8ClN3O2S/c12-9-7(3-1-5-13-9)14-11(18)15-10(16)8-4-2-6-17-8/h1-6H,(H2,14,15,16,18)	ACHZMBMZCATIQR-UHFFFAOYSA-N	Clc1ncccc1NC(=S)NC(=O)c2occc2	BroadT	BRD-K14132644	BRD-K14132644-001-05-1	ChemDiv Inc.	C200-1450			Clc1ncccc1NC(=S)NC(=O)c1ccco1	InChI=1S/C11H8ClN3O2S/c12-9-7(3-1-5-13-9)14-11(18)15-10(16)8-4-2-6-17-8/h1-6H,(H2,14,15,16,18)	ACHZMBMZCATIQR-UHFFFAOYSA-N	281.002574926							116460
ZINC00183780	LSM-27915	SID24822724, BRD-K43879162	743751	InChI=1S/C17H17NO3/c1-13(19)21-16-9-7-15(8-10-16)17(20)18-12-11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,18,20)	DTEQKVYORJRXBL-UHFFFAOYSA-N	CC(=O)Oc1ccc(cc1)C(=O)NCCc2ccccc2	BroadT	BRD-K43879162	BRD-K43879162-001-05-4	ChemDiv Inc.	4130-4474			CC(=O)Oc1ccc(cc1)C(=O)NCCc1ccccc1	InChI=1S/C17H17NO3/c1-13(19)21-16-9-7-15(8-10-16)17(20)18-12-11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,18,20)	DTEQKVYORJRXBL-UHFFFAOYSA-N	283.120843414							116461
SMR000308398	LSM-27916	SID24812930, BRD-A38849179	16193835	InChI=1S/C27H28N4O3S/c1-18-7-9-20(10-8-18)31-24(32)22-21-11-12-27(34-21,23(22)25(31)33)17-28-26(35)30-15-13-29(14-16-30)19-5-3-2-4-6-19/h2-12,21-23H,13-17H2,1H3,(H,28,35)	ZJKFYWVWCGMLAO-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=O)C3C4OC(CN=C(S)N5CCN(CC5)c6ccccc6)(C=C4)C3C2=O	BroadT	BRD-A38849179	BRD-A38849179-001-06-5	ChemDiv Inc.	C200-1610			Cc1ccc(cc1)N1C(=O)C2C3OC(CN=C(S)N4CCN(CC4)c4ccccc4)(C=C3)C2C1=O	InChI=1S/C27H28N4O3S/c1-18-7-9-20(10-8-18)31-24(32)22-21-11-12-27(34-21,23(22)25(31)33)17-28-26(35)30-15-13-29(14-16-30)19-5-3-2-4-6-19/h2-12,21-23H,13-17H2,1H3,(H,28,35)	ZJKFYWVWCGMLAO-UHFFFAOYSA-N	488.188211486							116462
N-[2-(4-Acetylpiperazin-1-yl)phenyl]-2-(2-methylphenoxy)acetamide	LSM-27917	SID24804511, BRD-K52240337	6458731	InChI=1S/C21H25N3O3/c1-16-7-3-6-10-20(16)27-15-21(26)22-18-8-4-5-9-19(18)24-13-11-23(12-14-24)17(2)25/h3-10H,11-15H2,1-2H3,(H,22,26)	FPLNQFKLIQITJT-UHFFFAOYSA-N	CC(=O)N1CCN(CC1)c2ccccc2NC(=O)COc3ccccc3C	BroadT	BRD-K52240337	BRD-K52240337-001-05-7	Asinex Ltd.	ASN 11781014			CC(=O)N1CCN(CC1)c1ccccc1NC(=O)COc1ccccc1C	InChI=1S/C21H25N3O3/c1-16-7-3-6-10-20(16)27-15-21(26)22-18-8-4-5-9-19(18)24-13-11-23(12-14-24)17(2)25/h3-10H,11-15H2,1-2H3,(H,22,26)	FPLNQFKLIQITJT-UHFFFAOYSA-N	367.18959169							116463
AC1LGY0M	LSM-44237	SID7978259, BRD-K34142974	878657	InChI=1S/C13H12N2O4/c1-15(2)6-9-13(16)19-12(14-9)8-3-4-10-11(5-8)18-7-17-10/h3-6H,7H2,1-2H3/b9-6-	SSZDQYOVOQZKDY-TWGQIWQCSA-N	CN(C)\C=C\1/N=C(OC1=O)c2ccc3OCOc3c2	BroadT	BRD-K34142974	BRD-K34142974-001-05-6	ChemBridge Corporation	6046446			CN(C)\C=C1/N=C(OC1=O)c1ccc2OCOc2c1	InChI=1S/C13H12N2O4/c1-15(2)6-9-13(16)19-12(14-9)8-3-4-10-11(5-8)18-7-17-10/h3-6H,7H2,1-2H3/b9-6-	SSZDQYOVOQZKDY-TWGQIWQCSA-N	260.079706884							
ZINC00702611	LSM-27919	SID4262712, BRD-K60894184	1033230	InChI=1S/C20H19N3O3S/c24-18(15-7-4-10-26-15)23-20-17(14-6-1-2-8-16(14)27-20)19(25)22-12-13-5-3-9-21-11-13/h3-5,7,9-11H,1-2,6,8,12H2,(H,22,25)(H,23,24)	UHXZXBLFBFMHIY-UHFFFAOYSA-N	O=C(NCc1cccnc1)c2c3CCCCc3sc2NC(=O)c4occc4	BroadT	BRD-K60894184	BRD-K60894184-001-06-3	ChemBridge Corporation	7342673			O=C(Nc1sc2CCCCc2c1C(=O)NCc1cccnc1)c1ccco1	InChI=1S/C20H19N3O3S/c24-18(15-7-4-10-26-15)23-20-17(14-6-1-2-8-16(14)27-20)19(25)22-12-13-5-3-9-21-11-13/h3-5,7,9-11H,1-2,6,8,12H2,(H,22,25)(H,23,24)	UHXZXBLFBFMHIY-UHFFFAOYSA-N	381.114712188							116465
1-(2,7-Dimethylimidazo[1,2-a]pyridin-3-yl)-2-(phenylsulfanyl)-1-ethanone	LSM-27920	SID24820204, BRD-K23036924	3572801	InChI=1S/C17H16N2OS/c1-12-8-9-19-16(10-12)18-13(2)17(19)15(20)11-21-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3	CDBQPALJQSMKSD-UHFFFAOYSA-N	Cc1ccn2c(C(=O)CSc3ccccc3)c(C)nc2c1	BroadT	BRD-K23036924	BRD-K23036924-001-05-4	Key Organics Ltd.	3R-1197			Cc1nc2cc(C)ccn2c1C(=O)CSc1ccccc1	InChI=1S/C17H16N2OS/c1-12-8-9-19-16(10-12)18-13(2)17(19)15(20)11-21-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3	CDBQPALJQSMKSD-UHFFFAOYSA-N	296.098333842							116466
Alprenolol	LSM-1238	Alprenolol	2119	InChI=1S/C15H23NO2/c1-4-7-13-8-5-6-9-15(13)18-11-14(17)10-16-12(2)3/h4-6,8-9,12,14,16-17H,1,7,10-11H2,2-3H3	PAZJSJFMUHDSTF-UHFFFAOYSA-N	CC(C)NCC(O)COc1ccccc1CC=C	BroadT	BRD-A00993607	BRD-A00993607-003-17-0	Sigma-Aldrich	A8676		Cl	CC(C)NCC(O)COc1ccccc1CC=C.Cl	InChI=1S/C15H23NO2.ClH/c1-4-7-13-8-5-6-9-15(13)18-11-14(17)10-16-12(2)3;/h4-6,8-9,12,14,16-17H,1,7,10-11H2,2-3H3;1H	RRCPAXJDDNWJBI-UHFFFAOYSA-N	249.172878986							51211, 51211, 51211
MLS000768400	LSM-27921	BRD-K22191278	1863657	InChI=1S/C15H19N5O/c1-5-13(21)19-14(16)20-15-17-10(4)11-6-8(2)9(3)7-12(11)18-15/h6-7H,5H2,1-4H3,(H3,16,17,18,19,20,21)	YDKSHHRXNDNKDE-UHFFFAOYSA-N	CCC(=O)NC(=N)Nc1nc(C)c2cc(C)c(C)cc2n1	BroadT	BRD-K22191278	BRD-K22191278-001-05-0	InterBioScreen Ltd.	STOCK3S-68606			CCC(=O)NC(=N)Nc1nc(C)c2cc(C)c(C)cc2n1	InChI=1S/C15H19N5O/c1-5-13(21)19-14(16)20-15-17-10(4)11-6-8(2)9(3)7-12(11)18-15/h6-7H,5H2,1-4H3,(H3,16,17,18,19,20,21)	YDKSHHRXNDNKDE-UHFFFAOYSA-N	285.158960278							116467
F0676-0910	LSM-27922	SID24781649, BRD-K57830393	16187616	InChI=1S/C19H18N6O4S/c1-11-8-15(24-29-11)20-17(26)10-30-18-7-6-16-21-22-19(25(16)23-18)12-4-5-13(27-2)14(9-12)28-3/h4-9H,10H2,1-3H3,(H,20,24,26)	FLXVLYWRPYHUMS-UHFFFAOYSA-N	COc1ccc(cc1OC)c2nnc3ccc(SCC(=O)Nc4cc(C)on4)nn23	BroadT	BRD-K57830393	BRD-K57830393-001-05-1	Life Chemicals Inc.	F0676-0910			COc1ccc(cc1OC)-c1nnc2ccc(SCC(=O)Nc3cc(C)on3)nn12	InChI=1S/C19H18N6O4S/c1-11-8-15(24-29-11)20-17(26)10-30-18-7-6-16-21-22-19(25(16)23-18)12-4-5-13(27-2)14(9-12)28-3/h4-9H,10H2,1-3H3,(H,20,24,26)	FLXVLYWRPYHUMS-UHFFFAOYSA-N	426.111023806							116468
SMR000145471	LSM-27923	SID87346655, SID14743394, BRD-K14337427	3713000	InChI=1S/C24H20ClN3O4S2/c25-16-5-3-6-17(15-16)27-10-12-28(13-11-27)22-21(26-34(31,32)20-9-4-14-33-20)23(29)18-7-1-2-8-19(18)24(22)30/h1-9,14-15,26H,10-13H2	HQNIQZQMKGFDMV-UHFFFAOYSA-N	Clc1cccc(c1)N2CCN(CC2)C3=C(NS(=O)(=O)c4cccs4)C(=O)c5ccccc5C3=O	BroadT	BRD-K14337427	BRD-K14337427-001-05-9	InterBioScreen Ltd.	STOCK3S-01654			Clc1cccc(c1)N1CCN(CC1)C1=C(NS(=O)(=O)c2cccs2)C(=O)c2ccccc2C1=O	InChI=1S/C24H20ClN3O4S2/c25-16-5-3-6-17(15-16)27-10-12-28(13-11-27)22-21(26-34(31,32)20-9-4-14-33-20)23(29)18-7-1-2-8-19(18)24(22)30/h1-9,14-15,26H,10-13H2	HQNIQZQMKGFDMV-UHFFFAOYSA-N	513.05837524							116469
STK154969	LSM-44238	SID17406576, BRD-K39349294	1771029	InChI=1S/C17H20N2O3S/c1-3-19-16(20)15(23-17(19)21)11-13-4-5-14(10-12(13)2)18-6-8-22-9-7-18/h4-5,10-11H,3,6-9H2,1-2H3/b15-11-	INDDLKMOXVTJBT-PTNGSMBKSA-N	CCN1C(=O)S\C(=C/c2ccc(cc2C)N3CCOCC3)\C1=O	BroadT	BRD-K39349294	BRD-K39349294-001-05-5	Specs	AH-487/41656594			CCN1C(=O)S\C(=C/c2ccc(cc2C)N2CCOCC2)C1=O	InChI=1S/C17H20N2O3S/c1-3-19-16(20)15(23-17(19)21)11-13-4-5-14(10-12(13)2)18-6-8-22-9-7-18/h4-5,10-11H,3,6-9H2,1-2H3/b15-11-	INDDLKMOXVTJBT-PTNGSMBKSA-N	332.11946321							
MLS000075962	LSM-27925	SID26667573, SID842354, BRD-K15930005	644612	InChI=1S/C19H18FN3O4S/c20-15-6-2-3-7-16(15)21-9-11-22(12-10-21)18(24)13-23-19(25)14-5-1-4-8-17(14)28(23,26)27/h1-8H,9-13H2	JCLPGYGJSIWNCO-UHFFFAOYSA-N	Fc1ccccc1N2CCN(CC2)C(=O)CN3C(=O)c4ccccc4S3(=O)=O	BroadT	BRD-K15930005	BRD-K15930005-001-05-0	Asinex Ltd.	BAS 06738646			Fc1ccccc1N1CCN(CC1)C(=O)CN1C(=O)c2ccccc2S1(=O)=O	InChI=1S/C19H18FN3O4S/c20-15-6-2-3-7-16(15)21-9-11-22(12-10-21)18(24)13-23-19(25)14-5-1-4-8-17(14)28(23,26)27/h1-8H,9-13H2	JCLPGYGJSIWNCO-UHFFFAOYSA-N	403.100204976							116471
SMR000054527	LSM-27926	DNDI1417300, BRD-K10099406	789775	InChI=1S/C17H19N3OS/c1-5-6-15-11(2)18-17(22-4)20-16(15)19-14-9-7-13(8-10-14)12(3)21/h5,7-10H,1,6H2,2-4H3,(H,18,19,20)	RLOYZRXJORMUGM-UHFFFAOYSA-N	CSc1nc(C)c(CC=C)c(Nc2ccc(cc2)C(=O)C)n1	BroadT	BRD-K10099406	BRD-K10099406-001-05-4	ChemBridge Corporation	5234688			CSc1nc(C)c(CC=C)c(Nc2ccc(cc2)C(C)=O)n1	InChI=1S/C17H19N3OS/c1-5-6-15-11(2)18-17(22-4)20-16(15)19-14-9-7-13(8-10-14)12(3)21/h5,7-10H,1,6H2,2-4H3,(H,18,19,20)	RLOYZRXJORMUGM-UHFFFAOYSA-N	313.124882948							116472
SMR000156122	LSM-27927	SID17407384, BRD-K00130583	11958607	InChI=1S/C21H26N4O2S2/c1-4-5-6-7-11-18(26)25-21-22-14(2)19(29-21)17-13-28-20(24-17)23-15-9-8-10-16(12-15)27-3/h8-10,12-13H,4-7,11H2,1-3H3,(H,23,24)(H,22,25,26)	GZGQOEHHOLCDED-UHFFFAOYSA-N	CCCCCCC(=O)Nc1nc(C)c(s1)c2csc(Nc3cccc(OC)c3)n2	BroadT	BRD-K00130583	BRD-K00130583-001-05-4	University of California at Davis	CLY_Corr_G11			CCCCCCC(=O)Nc1nc(C)c(s1)-c1csc(Nc2cccc(OC)c2)n1	InChI=1S/C21H26N4O2S2/c1-4-5-6-7-11-18(26)25-21-22-14(2)19(29-21)17-13-28-20(24-17)23-15-9-8-10-16(12-15)27-3/h8-10,12-13H,4-7,11H2,1-3H3,(H,23,24)(H,22,25,26)	GZGQOEHHOLCDED-UHFFFAOYSA-N	430.149717492							116473
MLS001006727	LSM-27928	SID24827209, BRD-K32162177	4422741	InChI=1S/C22H27NO8/c1-26-16-10-15(11-17(12-16)27-2)23-20(24)13-31-21(25)7-6-14-8-18(28-3)22(30-5)19(9-14)29-4/h8-12H,6-7,13H2,1-5H3,(H,23,24)	DVYYGZOSLREYPL-UHFFFAOYSA-N	COc1cc(NC(=O)COC(=O)CCc2cc(OC)c(OC)c(OC)c2)cc(OC)c1	BroadT	BRD-K32162177	BRD-K32162177-001-06-9	Enamine Ltd.	T0509-0454			COc1cc(NC(=O)COC(=O)CCc2cc(OC)c(OC)c(OC)c2)cc(OC)c1	InChI=1S/C22H27NO8/c1-26-16-10-15(11-17(12-16)27-2)23-20(24)13-31-21(25)7-6-14-8-18(28-3)22(30-5)19(9-14)29-4/h8-12H,6-7,13H2,1-5H3,(H,23,24)	DVYYGZOSLREYPL-UHFFFAOYSA-N	433.173666834							116474
2,4-Bis(4-ethoxyphenyl)-6-methyl-1-[2-(morpholin-4-yl)ethyl]pyridinium	LSM-15604	BRD-K35383417	1875938	InChI=1S/C28H35N2O3/c1-4-32-26-10-6-23(7-11-26)25-20-22(3)30(15-14-29-16-18-31-19-17-29)28(21-25)24-8-12-27(13-9-24)33-5-2/h6-13,20-21H,4-5,14-19H2,1-3H3/q+1	XITSNPPPOFRDTN-UHFFFAOYSA-N	CCOc1ccc(cc1)c2cc(C)[n+](CCN3CCOCC3)c(c2)c4ccc(OCC)cc4	BroadT	BRD-K35383417	BRD-K35383417-009-05-3	InterBioScreen Ltd.	STOCK3S-78181		OCl(=O)(=O)=O	CCOc1ccc(cc1)-c1cc(C)[n+](CCN2CCOCC2)c(c1)-c1ccc(OCC)cc1.OCl(=O)(=O)=O	InChI=1S/C28H35N2O3.ClHO4/c1-4-32-26-10-6-23(7-11-26)25-20-22(3)30(15-14-29-16-18-31-19-17-29)28(21-25)24-8-12-27(13-9-24)33-5-2;2-1(3,4)5/h6-13,20-21H,4-5,14-19H2,1-3H3;(H,2,3,4,5)/q+1;	URIHEVKCBIAART-UHFFFAOYSA-N	447.264768							104239, 104239
SMR000248991	LSM-27929	SID17515999, BRD-A53235038	12006214	InChI=1S/C14H15N3O2S2/c1-2-9-3-5-10(6-4-9)15-13-16-17-14(21-13)20-11-7-8-19-12(11)18/h3-6,11H,2,7-8H2,1H3,(H,15,16)	SPYVAJANGRMILJ-UHFFFAOYSA-N	CCc1ccc(Nc2nnc(SC3CCOC3=O)s2)cc1	BroadT	BRD-A53235038	BRD-A53235038-001-05-0	Enamine Ltd.	ZT-8389474			CCc1ccc(Nc2nnc(SC3CCOC3=O)s2)cc1	InChI=1S/C14H15N3O2S2/c1-2-9-3-5-10(6-4-9)15-13-16-17-14(21-13)20-11-7-8-19-12(11)18/h3-6,11H,2,7-8H2,1H3,(H,15,16)	SPYVAJANGRMILJ-UHFFFAOYSA-N	321.06056813							116475
AO-080/41004734	LSM-27930	SID4265829, BRD-K51539721	847775	InChI=1S/C18H18N2O2/c1-12-3-5-14(6-4-12)18(22)19-16-7-8-17-15(11-16)9-10-20(17)13(2)21/h3-8,11H,9-10H2,1-2H3,(H,19,22)	HDENVUMPMZHCJP-UHFFFAOYSA-N	CC(=O)N1CCc2cc(NC(=O)c3ccc(C)cc3)ccc12	BroadT	BRD-K51539721	BRD-K51539721-001-06-5	ChemBridge Corporation	7951158			CC(=O)N1CCc2cc(NC(=O)c3ccc(C)cc3)ccc12	InChI=1S/C18H18N2O2/c1-12-3-5-14(6-4-12)18(22)19-16-7-8-17-15(11-16)9-10-20(17)13(2)21/h3-8,11H,9-10H2,1-2H3,(H,19,22)	HDENVUMPMZHCJP-UHFFFAOYSA-N	294.136827836							116476
SMR000185583	LSM-44239	BRD-K81227299	678470	InChI=1S/C14H16N2S/c1-8-5-9(2)11(4)13(10(8)3)6-12(7-15)14(16)17/h5-6H,1-4H3,(H2,16,17)/b12-6-	DKMNDHCKWPIRJA-SDQBBNPISA-N	Cc1cc(C)c(C)c(\C=C(\C#N)/C(=N)S)c1C	BroadT	BRD-K81227299	BRD-K81227299-001-05-5	ChemBridge Corporation	5353670			Cc1cc(C)c(C)c(\C=C(\C#N)C(S)=N)c1C	InChI=1S/C14H16N2S/c1-8-5-9(2)11(4)13(10(8)3)6-12(7-15)14(16)17/h5-6H,1-4H3,(H2,16,17)/b12-6-	DKMNDHCKWPIRJA-SDQBBNPISA-N	244.103419222							
ST036742	LSM-44240	SID17507326, BRD-K97241521	5759336	InChI=1S/C18H17NO5S/c1-11-13(10-12-6-4-3-5-7-12)25-17(16(11)18(23)24-2)19-14(20)8-9-15(21)22/h3-9H,10H2,1-2H3,(H,19,20)(H,21,22)/b9-8+	HTYFKYNJJYRMJB-CMDGGOBGSA-N	COC(=O)c1c(C)c(Cc2ccccc2)sc1NC(=O)\C=C\C(=O)O	BroadT	BRD-K97241521	BRD-K97241521-001-06-6	Asinex Ltd.	BAS 00676178			COC(=O)c1c(NC(=O)\C=C\C(O)=O)sc(Cc2ccccc2)c1C	InChI=1S/C18H17NO5S/c1-11-13(10-12-6-4-3-5-7-12)25-17(16(11)18(23)24-2)19-14(20)8-9-15(21)22/h3-9H,10H2,1-2H3,(H,19,20)(H,21,22)/b9-8+	HTYFKYNJJYRMJB-CMDGGOBGSA-N	359.082743344							
MLS000858932	LSM-27933	SID26729825, BRD-K49299219	2816407	InChI=1S/C14H16N4O3S/c1-3-21-13(19)11-8-15-18-12(11)17-14(22)16-9-4-6-10(20-2)7-5-9/h4-8H,3H2,1-2H3,(H3,15,16,17,18,22)	UGIWPJOWXGBXGH-UHFFFAOYSA-N	CCOC(=O)c1c[nH]nc1N=C(S)Nc2ccc(OC)cc2	BroadT	BRD-K49299219	BRD-K49299219-001-05-2	Maybridge	HTS 12502			CCOC(=O)c1c[nH]nc1N=C(S)Nc1ccc(OC)cc1	InChI=1S/C14H16N4O3S/c1-3-21-13(19)11-8-15-18-12(11)17-14(22)16-9-4-6-10(20-2)7-5-9/h4-8H,3H2,1-2H3,(H3,15,16,17,18,22)	UGIWPJOWXGBXGH-UHFFFAOYSA-N	320.094311102							116479
N-[[3-Methoxy-4-[2-(4-methylanilino)-2-oxoethoxy]phenyl]methylideneamino]pyridine-3-carboxamide	LSM-27934	BRD-K29925470	2449910	InChI=1S/C23H22N4O4/c1-16-5-8-19(9-6-16)26-22(28)15-31-20-10-7-17(12-21(20)30-2)13-25-27-23(29)18-4-3-11-24-14-18/h3-14H,15H2,1-2H3,(H,26,28)(H,27,29)	NKPNHVBFTBWXHW-UHFFFAOYSA-N	COc1cc(C=NNC(=O)c2cccnc2)ccc1OCC(=O)Nc3ccc(C)cc3	BroadT	BRD-K29925470	BRD-K29925470-001-05-0	Enamine Ltd.	T5309535			COc1cc(C=NNC(=O)c2cccnc2)ccc1OCC(=O)Nc1ccc(C)cc1	InChI=1S/C23H22N4O4/c1-16-5-8-19(9-6-16)26-22(28)15-31-20-10-7-17(12-21(20)30-2)13-25-27-23(29)18-4-3-11-24-14-18/h3-14H,15H2,1-2H3,(H,26,28)(H,27,29)	NKPNHVBFTBWXHW-UHFFFAOYSA-N	418.164105224							116480
BAS 00474270	LSM-27935	SID24802327, BRD-K42978373	3108515	InChI=1S/C13H16N4O5/c1-13(2,3)14-11(19)12(20)16-15-10(18)8-5-4-6-9(7-8)17(21)22/h4-7H,1-3H3,(H,14,19)(H,15,18)(H,16,20)	URXYMNAGVPADIN-UHFFFAOYSA-N	CC(C)(C)NC(=O)C(=O)NNC(=O)c1cccc(c1)[N+](=O)[O-]	BroadT	BRD-K42978373	BRD-K42978373-001-05-0	Asinex Ltd.	BAS 00474270			CC(C)(C)NC(=O)C(=O)NNC(=O)c1cccc(c1)[N+]([O-])=O	InChI=1S/C13H16N4O5/c1-13(2,3)14-11(19)12(20)16-15-10(18)8-5-4-6-9(7-8)17(21)22/h4-7H,1-3H3,(H,14,19)(H,15,18)(H,16,20)	URXYMNAGVPADIN-UHFFFAOYSA-N	308.112069652							116481
SMR000237936	LSM-27936	SID17515255, BRD-K39322275	2134169	InChI=1S/C23H20N2O2S/c1-16-11-12-22-21(13-16)20(17-7-4-3-5-8-17)15-23(24-22)18-9-6-10-19(14-18)25-28(2,26)27/h3-15,25H,1-2H3	KQXKBCNHGQUWOB-UHFFFAOYSA-N	Cc1ccc2nc(cc(c3ccccc3)c2c1)c4cccc(NS(=O)(=O)C)c4	BroadT	BRD-K39322275	BRD-K39322275-001-08-9	Life Chemicals Inc.	F1590-0078			Cc1ccc2nc(cc(-c3ccccc3)c2c1)-c1cccc(NS(C)(=O)=O)c1	InChI=1S/C23H20N2O2S/c1-16-11-12-22-21(13-16)20(17-7-4-3-5-8-17)15-23(24-22)18-9-6-10-19(14-18)25-28(2,26)27/h3-15,25H,1-2H3	KQXKBCNHGQUWOB-UHFFFAOYSA-N	388.12454859							116482
MLS000767168	LSM-27937	SID26664229, BRD-K06011222	2035550	InChI=1S/C23H23N3O2/c1-15(2)21-24-22-19(20(27)17-11-7-8-12-18(17)25(22)3)23(28)26(21)14-13-16-9-5-4-6-10-16/h4-12,15H,13-14H2,1-3H3	GAXKMKSYYAMYNY-UHFFFAOYSA-N	CC(C)C1=NC2=C(C(=O)N1CCc3ccccc3)C(=O)c4ccccc4N2C	BroadT	BRD-K06011222	BRD-K06011222-001-04-0	InterBioScreen Ltd.	STOCK5S-28367			CC(C)c1nc2n(C)c3ccccc3c(=O)c2c(=O)n1CCc1ccccc1	InChI=1S/C23H23N3O2/c1-15(2)21-24-22-19(20(27)17-11-7-8-12-18(17)25(22)3)23(28)26(21)14-13-16-9-5-4-6-10-16/h4-12,15H,13-14H2,1-3H3	GAXKMKSYYAMYNY-UHFFFAOYSA-N	373.179027006							116483
36164-39-3	LSM-27938	SID17508116, BRD-K47635975	790305	InChI=1S/C15H14ClNO3/c1-8(18)3-5-11-9(2)17-13-6-4-10(15(19)20)7-12(13)14(11)16/h4,6-7H,3,5H2,1-2H3,(H,19,20)	CRIDWQRCAMWXSF-UHFFFAOYSA-N	CC(=O)CCc1c(C)nc2ccc(cc2c1Cl)C(=O)O	BroadT	BRD-K47635975	BRD-K47635975-001-05-3	Asinex Ltd.	BAS 00733451			CC(=O)CCc1c(C)nc2ccc(cc2c1Cl)C(O)=O	InChI=1S/C15H14ClNO3/c1-8(18)3-5-11-9(2)17-13-6-4-10(15(19)20)7-12(13)14(11)16/h4,6-7H,3,5H2,1-2H3,(H,19,20)	CRIDWQRCAMWXSF-UHFFFAOYSA-N	291.066221028							116484
T0515-3175	LSM-27939	SID26724323, BRD-K41435651	2411091	InChI=1S/C16H14ClNO4/c1-10-6-7-11(14(19)8-10)16(21)22-9-15(20)18-13-5-3-2-4-12(13)17/h2-8,19H,9H2,1H3,(H,18,20)	OKSZCZYGLKJOOZ-UHFFFAOYSA-N	Cc1ccc(C(=O)OCC(=O)Nc2ccccc2Cl)c(O)c1	BroadT	BRD-K41435651	BRD-K41435651-001-05-5	Enamine Ltd.	T0515-3175			Cc1ccc(C(=O)OCC(=O)Nc2ccccc2Cl)c(O)c1	InChI=1S/C16H14ClNO4/c1-10-6-7-11(14(19)8-10)16(21)22-9-15(20)18-13-5-3-2-4-12(13)17/h2-8,19H,9H2,1H3,(H,18,20)	OKSZCZYGLKJOOZ-UHFFFAOYSA-N	319.061135648							116485
Triadimenol	LSM-27940	Triadimenol	41368	InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3	BAZVSMNPJJMILC-UHFFFAOYSA-N	CC(C)(C)C(O)C(Oc1ccc(Cl)cc1)n2cncn2	BroadT	BRD-A38582748	BRD-A38582748-001-13-0	InterBioScreen Ltd.	STOCK1S-19606			CC(C)(C)C(O)C(Oc1ccc(Cl)cc1)n1cncn1	InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3	BAZVSMNPJJMILC-UHFFFAOYSA-N	295.108754556							9666
MLS000856207	LSM-27941	SID24780631, BRD-A44577620	3218017	InChI=1S/C22H33N3S/c1-15-10-16(2)12-17(11-15)23-22(26)24-18-13-20-8-5-9-21(14-18)25(20)19-6-3-4-7-19/h10-12,18-21H,3-9,13-14H2,1-2H3,(H2,23,24,26)	MMVOFDXFPOWXGQ-UHFFFAOYSA-N	Cc1cc(C)cc(NC(=NC2CC3CCCC(C2)N3C4CCCC4)S)c1	BroadT	BRD-A44577620	BRD-A44577620-001-05-1	Asinex Ltd.	ASN 06222915			Cc1cc(C)cc(NC(S)=NC2CC3CCCC(C2)N3C2CCCC2)c1	InChI=1S/C22H33N3S/c1-15-10-16(2)12-17(11-15)23-22(26)24-18-13-20-8-5-9-21(14-18)25(20)19-6-3-4-7-19/h10-12,18-21H,3-9,13-14H2,1-2H3,(H2,23,24,26)	MMVOFDXFPOWXGQ-UHFFFAOYSA-N	371.239518776							116486
AC1M6UF7	LSM-15574	BRD-K58263593	2455405	InChI=1S/C16H16ClFN2O/c1-11-13(17)6-4-8-15(11)20-16(21)10-19-9-12-5-2-3-7-14(12)18/h2-8,19H,9-10H2,1H3,(H,20,21)	PIOKVNOEPYRLPB-UHFFFAOYSA-N	Cc1c(Cl)cccc1NC(=O)CNCc2ccccc2F	BroadT	BRD-K58263593	BRD-K58263593-034-05-3	Enamine Ltd.	T5311640		OC(=O)C(=O)O	Cc1c(Cl)cccc1NC(=O)CNCc1ccccc1F.OC(=O)C(=O)O	InChI=1S/C16H16ClFN2O.C2H2O4/c1-11-13(17)6-4-8-15(11)20-16(21)10-19-9-12-5-2-3-7-14(12)18;3-1(4)2(5)6/h2-8,19H,9-10H2,1H3,(H,20,21);(H,3,4)(H,5,6)	XEZSWNSKCZYRFJ-UHFFFAOYSA-N	306.093519062							104210, 104210
SMR000002002	LSM-27942	SID26726111, SID845854, BRD-K67246449	648213	InChI=1S/C26H21N5O4S/c1-34-25(33)19-6-5-7-20(14-19)28-24(32)17-36-26-30-29-23(31(26)21-8-3-2-4-9-21)16-35-22-12-10-18(15-27)11-13-22/h2-14H,16-17H2,1H3,(H,28,32)	ODLZATUUFMMQHH-UHFFFAOYSA-N	COC(=O)c1cccc(NC(=O)CSc2nnc(COc3ccc(cc3)C#N)n2c4ccccc4)c1	BroadT	BRD-K67246449	BRD-K67246449-001-05-2	Asinex Ltd.	ASN 03107928			COC(=O)c1cccc(NC(=O)CSc2nnc(COc3ccc(cc3)C#N)n2-c2ccccc2)c1	InChI=1S/C26H21N5O4S/c1-34-25(33)19-6-5-7-20(14-19)28-24(32)17-36-26-30-29-23(31(26)21-8-3-2-4-9-21)16-35-22-12-10-18(15-27)11-13-22/h2-14H,16-17H2,1H3,(H,28,32)	ODLZATUUFMMQHH-UHFFFAOYSA-N	499.131424892							116487
355381-61-2	LSM-15575	SID85747736, BRD-A73911485	2850121	InChI=1S/C17H18N2O2/c20-19(21)15-10-8-13(9-11-15)12-18-17-7-3-5-14-4-1-2-6-16(14)17/h1-2,4,6,8-11,17-18H,3,5,7,12H2	SXADGYYMOIHTNA-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(CNC2CCCc3ccccc23)cc1	BroadT	BRD-A73911485	BRD-A73911485-034-06-9	Asinex Ltd.	BAS 01124940		OC(=O)C(=O)O	[O-][N+](=O)c1ccc(CNC2CCCc3ccccc23)cc1.OC(=O)C(=O)O	InChI=1S/C17H18N2O2.C2H2O4/c20-19(21)15-10-8-13(9-11-15)12-18-17-7-3-5-14-4-1-2-6-16(14)17;3-1(4)2(5)6/h1-2,4,6,8-11,17-18H,3,5,7,12H2;(H,3,4)(H,5,6)	QJYJLGAXYRPJNV-UHFFFAOYSA-N	282.136827836							104211, 104211
ASN 09858152	LSM-27943	SID842878, BRD-K16912993	645154	InChI=1S/C15H16N6/c1-2-7-13-12(6-1)14(21-15(20-13)18-10-19-21)17-9-11-5-3-4-8-16-11/h3-5,8,10,17H,1-2,6-7,9H2	BMHHHRRRVQZUHU-UHFFFAOYSA-N	C(Nc1c2CCCCc2nc3ncnn13)c4ccccn4	BroadT	BRD-K16912993	BRD-K16912993-001-05-1	Asinex Ltd.	ASN 09858152			C(Nc1c2CCCCc2nc2ncnn12)c1ccccn1	InChI=1S/C15H16N6/c1-2-7-13-12(6-1)14(21-15(20-13)18-10-19-21)17-9-11-5-3-4-8-16-11/h3-5,8,10,17H,1-2,6-7,9H2	BMHHHRRRVQZUHU-UHFFFAOYSA-N	280.143644572							116488
4G-029	LSM-27944	SID24817222, BRD-K49969279	1475879	InChI=1S/C14H14ClN7/c1-9-7-10(2)22(21-9)14-19-17-13(18-20-14)16-8-11-3-5-12(15)6-4-11/h3-7H,8H2,1-2H3,(H,16,17,18)	GFUIVIGQVGIYEU-UHFFFAOYSA-N	Cc1cc(C)n(n1)c2nnc(NCc3ccc(Cl)cc3)nn2	BroadT	BRD-K49969279	BRD-K49969279-001-05-7	Key Organics Ltd.	4G-029			Cc1cc(C)n(n1)-c1nnc(NCc2ccc(Cl)cc2)nn1	InChI=1S/C14H14ClN7/c1-9-7-10(2)22(21-9)14-19-17-13(18-20-14)16-8-11-3-5-12(15)6-4-11/h3-7H,8H2,1-2H3,(H,16,17,18)	GFUIVIGQVGIYEU-UHFFFAOYSA-N	315.099921228							116489
MLS000082587	LSM-27945	SID862257, BRD-K12502272	663480	InChI=1S/C15H22N4OS2/c1-15(2)7-9-10(8-20-15)22-13-11(9)12(16)17-14(18-13)21-6-5-19(3)4/h5-8H2,1-4H3,(H2,16,17,18)	JDIXJTOGZIFVTO-UHFFFAOYSA-N	CN(C)CCSc1nc(N)c2c3CC(C)(C)OCc3sc2n1	BroadT	BRD-K12502272	BRD-K12502272-001-05-6	InterBioScreen Ltd.	STOCK4S-36324			CN(C)CCSc1nc(N)c2c3CC(C)(C)OCc3sc2n1	InChI=1S/C15H22N4OS2/c1-15(2)7-9-10(8-20-15)22-13-11(9)12(16)17-14(18-13)21-6-5-19(3)4/h5-8H2,1-4H3,(H2,16,17,18)	JDIXJTOGZIFVTO-UHFFFAOYSA-N	338.123502744							116490
ILP-II-83	LSM-27946	SID24834137, BRD-K48727178	16196665	InChI=1S/C28H41N5O6/c1-27(2,3)38-25(36)20(15-11-12-16-29-26(37)39-28(4,5)6)32-23(34)21-22(31-18-30-21)24(35)33(7)17-19-13-9-8-10-14-19/h8-10,13-14,18,20H,11-12,15-17H2,1-7H3,(H,29,37)(H,30,31)(H,32,34)/t20-/m0/s1	DINYHADKRMDGFI-FQEVSTJZSA-N	CN(Cc1ccccc1)C(=O)c2[nH]cnc2C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C	BroadT	BRD-K48727178	BRD-K48727178-001-05-2	University of Tulsa	ILP-II-83 AE10_SA06			CN(Cc1ccccc1)C(=O)c1[nH]cnc1C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C	InChI=1S/C28H41N5O6/c1-27(2,3)38-25(36)20(15-11-12-16-29-26(37)39-28(4,5)6)32-23(34)21-22(31-18-30-21)24(35)33(7)17-19-13-9-8-10-14-19/h8-10,13-14,18,20H,11-12,15-17H2,1-7H3,(H,29,37)(H,30,31)(H,32,34)/t20-/m0/s1	DINYHADKRMDGFI-FQEVSTJZSA-N	543.305684082							116491
SMR000109043	LSM-27947	SID7972891, BRD-K69485483	2297135	InChI=1S/C14H19BrClNO3/c15-12-1-2-14(13(16)11-12)20-10-9-19-8-5-17-3-6-18-7-4-17/h1-2,11H,3-10H2	CDNYXPCEFPPPAW-UHFFFAOYSA-N	Clc1cc(Br)ccc1OCCOCCN2CCOCC2	BroadT	BRD-K69485483	BRD-K69485483-001-06-9	ChemBridge Corporation	7004783			Clc1cc(Br)ccc1OCCOCCN1CCOCC1	InChI=1S/C14H19BrClNO3/c15-12-1-2-14(13(16)11-12)20-10-9-19-8-5-17-3-6-18-7-4-17/h1-2,11H,3-10H2	CDNYXPCEFPPPAW-UHFFFAOYSA-N	363.023683788							116492
1-Pyrimidin-2-yl-3-(2,2,2-trifluoroethyl)urea	LSM-27948	SID858289, BRD-K51219899	659628	InChI=1S/C7H7F3N4O/c8-7(9,10)4-13-6(15)14-5-11-2-1-3-12-5/h1-3H,4H2,(H2,11,12,13,14,15)	NKAPMRLUPGBPCH-UHFFFAOYSA-N	FC(F)(F)CNC(=O)Nc1ncccn1	BroadT	BRD-K51219899	BRD-K51219899-001-05-2	InterBioScreen Ltd.	STOCK2S-41577			FC(F)(F)CNC(=O)Nc1ncccn1	InChI=1S/C7H7F3N4O/c8-7(9,10)4-13-6(15)14-5-11-2-1-3-12-5/h1-3H,4H2,(H2,11,12,13,14,15)	NKAPMRLUPGBPCH-UHFFFAOYSA-N	220.057195484							116493
3-Hydroxy-3-{2-oxo-2-[4-(1H-pyrrol-1-yl)phenyl]ethyl}-1,3-dihydro-2H-indol-2-one	LSM-27949	SID4255882, BRD-A05315883	2950830	InChI=1S/C20H16N2O3/c23-18(14-7-9-15(10-8-14)22-11-3-4-12-22)13-20(25)16-5-1-2-6-17(16)21-19(20)24/h1-12,25H,13H2,(H,21,24)	XCAPTWNBIYWLQS-UHFFFAOYSA-N	OC1(CC(=O)c2ccc(cc2)n3cccc3)C(=O)Nc4ccccc14	BroadT	BRD-A05315883	BRD-A05315883-001-06-3	ChemBridge Corporation	7736295			OC1(CC(=O)c2ccc(cc2)-n2cccc2)C(=O)Nc2ccccc12	InChI=1S/C20H16N2O3/c23-18(14-7-9-15(10-8-14)22-11-3-4-12-22)13-20(25)16-5-1-2-6-17(16)21-19(20)24/h1-12,25H,13H2,(H,21,24)	XCAPTWNBIYWLQS-UHFFFAOYSA-N	332.116092392							116494
(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)-(2-methoxy-benzyl)-amine	LSM-27950	SID852533, BRD-K91263947	655157	InChI=1S/C19H18N6O/c1-26-16-10-6-5-9-15(16)11-20-18-17-19(22-13-21-18)25(24-23-17)12-14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3,(H,20,21,22)	JISRQFYNSLEHAN-UHFFFAOYSA-N	COc1ccccc1CNc2ncnc3c2nnn3Cc4ccccc4	BroadT	BRD-K91263947	BRD-K91263947-001-06-2	Asinex Ltd.	ASN 09122619			COc1ccccc1CNc1ncnc2n(Cc3ccccc3)nnc12	InChI=1S/C19H18N6O/c1-26-16-10-6-5-9-15(16)11-20-18-17-19(22-13-21-18)25(24-23-17)12-14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3,(H,20,21,22)	JISRQFYNSLEHAN-UHFFFAOYSA-N	346.154209256							116495
AC1LJZGG	LSM-27951	BRD-K11644911	1034588	InChI=1S/C17H19Cl2N3O2/c1-13-11-15(22(8-6-18)9-7-19)5-4-14(13)12-20-21-17(23)16-3-2-10-24-16/h2-5,10-12H,6-9H2,1H3,(H,21,23)	YUSOZANRPRLVOT-UHFFFAOYSA-N	Cc1cc(ccc1C=NNC(=O)c2occc2)N(CCCl)CCCl	BroadT	BRD-K11644911	BRD-K11644911-001-05-4	Specs	AF-615/36960013			Cc1cc(ccc1C=NNC(=O)c1ccco1)N(CCCl)CCCl	InChI=1S/C17H19Cl2N3O2/c1-13-11-15(22(8-6-18)9-7-19)5-4-14(13)12-20-21-17(23)16-3-2-10-24-16/h2-5,10-12H,6-9H2,1H3,(H,21,23)	YUSOZANRPRLVOT-UHFFFAOYSA-N	367.085432298							116496
AC1LXY5P	LSM-27952	BRD-K99117139	1861185	InChI=1S/C23H24N8O4/c1-4-33-17-11-7-16(8-12-17)20-19(26-30-31(20)22-21(24)28-35-29-22)23(32)27-25-13-15-5-9-18(10-6-15)34-14(2)3/h5-14H,4H2,1-3H3,(H2,24,28)(H,27,32)	BESGKGKKXGQWKT-UHFFFAOYSA-N	CCOc1ccc(cc1)c2c(nnn2c3nonc3N)C(=O)NN=Cc4ccc(OC(C)C)cc4	BroadT	BRD-K99117139	BRD-K99117139-001-05-2	InterBioScreen Ltd.	STOCK5S-41798			CCOc1ccc(cc1)-c1c(nnn1-c1nonc1N)C(=O)NN=Cc1ccc(OC(C)C)cc1	InChI=1S/C23H24N8O4/c1-4-33-17-11-7-16(8-12-17)20-19(26-30-31(20)22-21(24)28-35-29-22)23(32)27-25-13-15-5-9-18(10-6-15)34-14(2)3/h5-14H,4H2,1-3H3,(H2,24,28)(H,27,32)	BESGKGKKXGQWKT-UHFFFAOYSA-N	476.192051328							116497
MLS000057689	LSM-27953	SID3711628, BRD-K01860947	2562162	InChI=1S/C14H9NO4S/c16-11(12-2-1-5-18-12)7-19-14(17)9-3-4-10-13(6-9)20-8-15-10/h1-6,8H,7H2	CYRQVRWWJMWVJF-UHFFFAOYSA-N	O=C(COC(=O)c1ccc2ncsc2c1)c3occc3	BroadT	BRD-K01860947	BRD-K01860947-001-06-4	Enamine Ltd.	T5343254			O=C(COC(=O)c1ccc2ncsc2c1)c1ccco1	InChI=1S/C14H9NO4S/c16-11(12-2-1-5-18-12)7-19-14(17)9-3-4-10-13(6-9)20-8-15-10/h1-6,8H,7H2	CYRQVRWWJMWVJF-UHFFFAOYSA-N	287.025228468							116498
4-Methyl-2,7-diphenylpyrido[2,3-d]pyrimidin-5(8H)-one	LSM-27954	SID14735796, BRD-K29126144	5339079	InChI=1S/C20H15N3O/c1-13-18-17(24)12-16(14-8-4-2-5-9-14)22-20(18)23-19(21-13)15-10-6-3-7-11-15/h2-12H,1H3,(H,21,22,23,24)	NPKCOPDOIKMQLU-UHFFFAOYSA-N	Cc1nc(nc2nc(cc(O)c12)c3ccccc3)c4ccccc4	BroadT	BRD-K29126144	BRD-K29126144-001-05-1	ChemBridge Corporation	5365357			Cc1nc(nc2nc(cc(O)c12)-c1ccccc1)-c1ccccc1	InChI=1S/C20H15N3O/c1-13-18-17(24)12-16(14-8-4-2-5-9-14)22-20(18)23-19(21-13)15-10-6-3-7-11-15/h2-12H,1H3,(H,21,22,23,24)	NPKCOPDOIKMQLU-UHFFFAOYSA-N	313.12151213							116499
MLS000936915	LSM-27955	SID49715642, BRD-K48737866	22427462	InChI=1S/C16H18N2O5/c1-20-11-3-4-14(21-2)12(9-11)15-10-13(17-23-15)16(19)18-5-7-22-8-6-18/h3-4,9-10H,5-8H2,1-2H3	OSFVMCCUSVCQRH-UHFFFAOYSA-N	COc1ccc(OC)c(c1)c2onc(c2)C(=O)N3CCOCC3	BroadT	BRD-K48737866	BRD-K48737866-001-05-8	ChemDiv Inc.	C226-1628			COc1ccc(OC)c(c1)-c1cc(no1)C(=O)N1CCOCC1	InChI=1S/C16H18N2O5/c1-20-11-3-4-14(21-2)12(9-11)15-10-13(17-23-15)16(19)18-5-7-22-8-6-18/h3-4,9-10H,5-8H2,1-2H3	OSFVMCCUSVCQRH-UHFFFAOYSA-N	318.121571696							116500
BAS 00690376	LSM-44241	SID24796652, BRD-K96248317	1603017	InChI=1S/C19H18N2O4/c1-13(22)21-16(19(23)20-11-14-5-3-2-4-6-14)9-15-7-8-17-18(10-15)25-12-24-17/h2-10H,11-12H2,1H3,(H,20,23)(H,21,22)/b16-9+	BDWXGEIHUXSMQS-CXUHLZMHSA-N	CC(=O)N\C(=C\c1ccc2OCOc2c1)\C(=O)NCc3ccccc3	BroadT	BRD-K96248317	BRD-K96248317-001-05-2	Asinex Ltd.	BAS 00690376			CC(=O)N\C(=C\c1ccc2OCOc2c1)C(=O)NCc1ccccc1	InChI=1S/C19H18N2O4/c1-13(22)21-16(19(23)20-11-14-5-3-2-4-6-14)9-15-7-8-17-18(10-15)25-12-24-17/h2-10H,11-12H2,1H3,(H,20,23)(H,21,22)/b16-9+	BDWXGEIHUXSMQS-CXUHLZMHSA-N	338.126657076							
SMR000130330	LSM-27957	SID14733141, BRD-K62966215	9550392	InChI=1S/C24H28N4O4/c29-22(25-10-4-11-27-13-15-32-16-14-27)19-7-8-20-21(17-19)26-24(31)28(23(20)30)12-9-18-5-2-1-3-6-18/h1-3,5-8,17H,4,9-16H2,(H,25,29)(H,26,31)	MHGCZFJPLAZOGN-UHFFFAOYSA-N	O=C(NCCCN1CCOCC1)c2ccc3C(=O)N(CCc4ccccc4)C(=O)Nc3c2	BroadT	BRD-K62966215	BRD-K62966215-001-05-2	ChemDiv Inc.	C190-0348			O=C(NCCCN1CCOCC1)c1ccc2c(c1)[nH]c(=O)n(CCc1ccccc1)c2=O	InChI=1S/C24H28N4O4/c29-22(25-10-4-11-27-13-15-32-16-14-27)19-7-8-20-21(17-19)26-24(31)28(23(20)30)12-9-18-5-2-1-3-6-18/h1-3,5-8,17H,4,9-16H2,(H,25,29)(H,26,31)	MHGCZFJPLAZOGN-UHFFFAOYSA-N	436.211055416							116502
MLS000097278	LSM-27958	SID4265103, BRD-K26489559	1290684	InChI=1S/C22H17N5OS2/c1-3-8-16(9-4-1)21-23-20(28-26-21)15-30-22-25-24-19(14-18-12-7-13-29-18)27(22)17-10-5-2-6-11-17/h1-13H,14-15H2	RJHCGCBEVHOGBY-UHFFFAOYSA-N	C(Sc1nnc(Cc2cccs2)n1c3ccccc3)c4onc(n4)c5ccccc5	BroadT	BRD-K26489559	BRD-K26489559-001-05-4	ChemBridge Corporation	7746646			C(Sc1nnc(Cc2cccs2)n1-c1ccccc1)c1nc(no1)-c1ccccc1	InChI=1S/C22H17N5OS2/c1-3-8-16(9-4-1)21-23-20(28-26-21)15-30-22-25-24-19(14-18-12-7-13-29-18)27(22)17-10-5-2-6-11-17/h1-13H,14-15H2	RJHCGCBEVHOGBY-UHFFFAOYSA-N	431.087451594							116503
T5346507	LSM-27959	SID24839309, BRD-K62971767	4841613	InChI=1S/C23H31N5O5S/c1-18(29)19-5-7-20(8-6-19)26-13-15-27(16-14-26)22-10-9-21(17-23(22)28(30)31)34(32,33)24-11-4-12-25(2)3/h5-10,17,24H,4,11-16H2,1-3H3	NYTBDMVOUFFILS-UHFFFAOYSA-N	CN(C)CCCNS(=O)(=O)c1ccc(N2CCN(CC2)c3ccc(cc3)C(=O)C)c(c1)[N+](=O)[O-]	BroadT	BRD-K62971767	BRD-K62971767-001-06-2	Enamine Ltd.	T5346507			CN(C)CCCNS(=O)(=O)c1ccc(N2CCN(CC2)c2ccc(cc2)C(C)=O)c(c1)[N+]([O-])=O	InChI=1S/C23H31N5O5S/c1-18(29)19-5-7-20(8-6-19)26-13-15-27(16-14-26)22-10-9-21(17-23(22)28(30)31)34(32,33)24-11-4-12-25(2)3/h5-10,17,24H,4,11-16H2,1-3H3	NYTBDMVOUFFILS-UHFFFAOYSA-N	489.204589832							116504
7H-057	LSM-27960	SID24818245, BRD-A27827494	4399414	InChI=1S/C16H13N5O/c22-15-12-8-17-16-18-9-19-21(16)14(12)7-13-11-4-2-1-3-10(11)5-6-20(13)15/h1-4,8-9,13H,5-7H2	SERSOAJNGUIFSO-UHFFFAOYSA-N	O=C1N2CCc3ccccc3C2Cc4c1cnc5ncnn45	BroadT	BRD-A27827494	BRD-A27827494-001-06-2	Key Organics Ltd.	7H-057			O=C1N2CCc3ccccc3C2Cc2c1cnc1ncnn21	InChI=1S/C16H13N5O/c22-15-12-8-17-16-18-9-19-21(16)14(12)7-13-11-4-2-1-3-10(11)5-6-20(13)15/h1-4,8-9,13H,5-7H2	SERSOAJNGUIFSO-UHFFFAOYSA-N	291.112010086							116505
SMR000107521	LSM-27961	SID7974566, BRD-K18336404	797071	InChI=1S/C15H18N4O3S/c1-4-16-13-17-14(19-15(18-13)23-3)22-11-8-6-10(7-9-11)12(20)21-5-2/h6-9H,4-5H2,1-3H3,(H,16,17,18,19)	DUOGQOGECKWZKB-UHFFFAOYSA-N	CCNc1nc(Oc2ccc(cc2)C(=O)OCC)nc(SC)n1	BroadT	BRD-K18336404	BRD-K18336404-001-05-4	ChemBridge Corporation	6660426			CCNc1nc(Oc2ccc(cc2)C(=O)OCC)nc(SC)n1	InChI=1S/C15H18N4O3S/c1-4-16-13-17-14(19-15(18-13)23-3)22-11-8-6-10(7-9-11)12(20)21-5-2/h6-9H,4-5H2,1-3H3,(H,16,17,18,19)	DUOGQOGECKWZKB-UHFFFAOYSA-N	334.109961166							116506
MLS000055301	LSM-27962	SID3716991, BRD-K95339162	2999831	InChI=1S/C21H20N2O6S/c1-15-7-9-17(10-8-15)23-30(26,27)19-6-2-4-16(12-19)21(25)29-14-20(24)22-13-18-5-3-11-28-18/h2-12,23H,13-14H2,1H3,(H,22,24)	JBDSUQUPGGSFHW-UHFFFAOYSA-N	Cc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)OCC(=O)NCc3occc3)cc1	BroadT	BRD-K95339162	BRD-K95339162-001-05-6	Enamine Ltd.	T0512-0868			Cc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)OCC(=O)NCc2ccco2)cc1	InChI=1S/C21H20N2O6S/c1-15-7-9-17(10-8-15)23-30(26,27)19-6-2-4-16(12-19)21(25)29-14-20(24)22-13-18-5-3-11-28-18/h2-12,23H,13-14H2,1H3,(H,22,24)	JBDSUQUPGGSFHW-UHFFFAOYSA-N	428.10420707							116507
840479-48-3	LSM-27963	SID860840, BRD-A93122257	662118	InChI=1S/C14H13ClO5/c1-3-8-4-13(16)20-11-6-12(10(15)5-9(8)11)19-7(2)14(17)18/h4-7H,3H2,1-2H3,(H,17,18)	WSENSGWXVHWIOS-UHFFFAOYSA-N	CCC1=CC(=O)Oc2cc(OC(C)C(=O)O)c(Cl)cc12	BroadT	BRD-A93122257	BRD-A93122257-001-05-6	InterBioScreen Ltd.	STOCK3S-95905			CCc1cc(=O)oc2cc(OC(C)C(O)=O)c(Cl)cc12	InChI=1S/C14H13ClO5/c1-3-8-4-13(16)20-11-6-12(10(15)5-9(8)11)19-7(2)14(17)18/h4-7H,3H2,1-2H3,(H,17,18)	WSENSGWXVHWIOS-UHFFFAOYSA-N	296.045151226							116508
AC1NOG9D	LSM-27964	BRD-K73783662	5112661	InChI=1S/C15H16FN3O2/c1-10-8-12(9-17-18-15(20)21-3)11(2)19(10)14-6-4-13(16)5-7-14/h4-9H,1-3H3,(H,18,20)	IKASPFLUPXITON-UHFFFAOYSA-N	COC(=O)NN=Cc1cc(C)n(c1C)c2ccc(F)cc2	BroadT	BRD-K73783662	BRD-K73783662-001-05-6	ChemDiv Inc.	4291-0143			COC(=O)NN=Cc1cc(C)n(c1C)-c1ccc(F)cc1	InChI=1S/C15H16FN3O2/c1-10-8-12(9-17-18-15(20)21-3)11(2)19(10)14-6-4-13(16)5-7-14/h4-9H,1-3H3,(H,18,20)	IKASPFLUPXITON-UHFFFAOYSA-N	289.122654982							131284
AC1MEFRX	LSM-15414	BRD-K59074373	2877692	InChI=1S/C14H12N4S/c1-2-10-11(3-1)19-14-12(10)13(16-8-17-14)18-9-4-6-15-7-5-9/h4-8H,1-3H2,(H,15,16,17,18)	VUMKKNQXNAGPRJ-UHFFFAOYSA-N	C1Cc2sc3ncnc(Nc4ccncc4)c3c2C1	BroadT	BRD-K59074373	BRD-K59074373-003-05-4	ChemBridge Corporation	5935761		Cl	C1Cc2sc3ncnc(Nc4ccncc4)c3c2C1.Cl	InChI=1S/C14H12N4S.ClH/c1-2-10-11(3-1)19-14-12(10)13(16-8-17-14)18-9-4-6-15-7-5-9;/h4-8H,1-3H2,(H,15,16,17,18);1H	HNSZGXWHELRPFF-UHFFFAOYSA-N	268.078267114							104056, 104056
AC1LDANP	LSM-27965	SID862745, BRD-A84420531	663979	InChI=1S/C14H15N5O3/c1-14(2,3)12(20)13(19-8-15-7-16-19)21-10-6-4-5-9-11(10)18-22-17-9/h4-8,13H,1-3H3	PODIEYIBRDGSNM-UHFFFAOYSA-N	CC(C)(C)C(=O)C(Oc1cccc2nonc12)n3cncn3	BroadT	BRD-A84420531	BRD-A84420531-001-05-3	InterBioScreen Ltd.	STOCK4S-54503			CC(C)(C)C(=O)C(Oc1cccc2nonc12)n1cncn1	InChI=1S/C14H15N5O3/c1-14(2,3)12(20)13(19-8-15-7-16-19)21-10-6-4-5-9-11(10)18-22-17-9/h4-8,13H,1-3H3	PODIEYIBRDGSNM-UHFFFAOYSA-N	301.11748939							116511
UPCMLD04BGHW001083	LSM-27966	SID17384944, SID24707889, BRD-K34745013	3247353	InChI=1S/C30H32N4O2/c1-19-16-26(34(4)33-19)29(36)32-27(22-11-6-5-7-12-22)30(3)18-25(30)20(2)28(35)31-24-15-14-21-10-8-9-13-23(21)17-24/h5-17,20,25,27H,18H2,1-4H3,(H,31,35)(H,32,36)/t20-,25-,27-,30+/m1/s1	XFQNPVRVZXSQSI-IQURWINISA-N	C[C@H]([C@H]1C[C@]1(C)[C@H](NC(=O)c2cc(C)nn2C)c3ccccc3)C(=O)Nc4ccc5ccccc5c4	BroadT	BRD-K34745013	BRD-K34745013-001-07-5	University of Pittsburgh CMLD	UPCMLD04BGHW001083			C[C@H]([C@H]1C[C@]1(C)[C@H](NC(=O)c1cc(C)nn1C)c1ccccc1)C(=O)Nc1ccc2ccccc2c1	InChI=1S/C30H32N4O2/c1-19-16-26(34(4)33-19)29(36)32-27(22-11-6-5-7-12-22)30(3)18-25(30)20(2)28(35)31-24-15-14-21-10-8-9-13-23(21)17-24/h5-17,20,25,27H,18H2,1-4H3,(H,31,35)(H,32,36)/t20-,25-,27-,30+/m1/s1	XFQNPVRVZXSQSI-IQURWINISA-N	480.252526304							116512
SMR000218535	LSM-27967	SID17513996, BRD-A88772644	3807453	InChI=1S/C22H21ClN2O4S/c1-14-5-4-12-25(13-14)20-19(21(26)17-6-2-3-7-18(17)22(20)27)24-30(28,29)16-10-8-15(23)9-11-16/h2-3,6-11,14,24H,4-5,12-13H2,1H3	SEURDONILXFGPZ-UHFFFAOYSA-N	CC1CCCN(C1)C2=C(NS(=O)(=O)c3ccc(Cl)cc3)C(=O)c4ccccc4C2=O	BroadT	BRD-A88772644	BRD-A88772644-001-05-7	InterBioScreen Ltd.	STOCK2S-25882			CC1CCCN(C1)C1=C(NS(=O)(=O)c2ccc(Cl)cc2)C(=O)c2ccccc2C1=O	InChI=1S/C22H21ClN2O4S/c1-14-5-4-12-25(13-14)20-19(21(26)17-6-2-3-7-18(17)22(20)27)24-30(28,29)16-10-8-15(23)9-11-16/h2-3,6-11,14,24H,4-5,12-13H2,1H3	SEURDONILXFGPZ-UHFFFAOYSA-N	444.091055572							116513
AC1MK56A	LSM-27968	SID17403317, BRD-A55738484	3124999	InChI=1S/C21H18N4O/c1-15-19(20(18(12-22)13-23)17-10-6-3-7-11-17)21(26)25(24-15)14-16-8-4-2-5-9-16/h2-11,18-20H,14H2,1H3	ZIGSJELRQGYINN-UHFFFAOYSA-N	CC1=NN(Cc2ccccc2)C(=O)C1C(C(C#N)C#N)c3ccccc3	BroadT	BRD-A55738484	BRD-A55738484-001-07-6	Asinex Ltd.	BAS 01060110			CC1=NN(Cc2ccccc2)C(=O)C1C(C(C#N)C#N)c1ccccc1	InChI=1S/C21H18N4O/c1-15-19(20(18(12-22)13-23)17-10-6-3-7-11-17)21(26)25(24-15)14-16-8-4-2-5-9-16/h2-11,18-20H,14H2,1H3	ZIGSJELRQGYINN-UHFFFAOYSA-N	342.148061236							116514
3-(2-Hydroxy-3-morpholin-4-yl-propyl)-5,5-dimethyl-imidazolidine-2,4-dione	LSM-27969	SID845385, BRD-A73347505	647728	InChI=1S/C12H21N3O4/c1-12(2)10(17)15(11(18)13-12)8-9(16)7-14-3-5-19-6-4-14/h9,16H,3-8H2,1-2H3,(H,13,18)	NTMQHOLHUHTIQJ-UHFFFAOYSA-N	CC1(C)NC(=O)N(CC(O)CN2CCOCC2)C1=O	BroadT	BRD-A73347505	BRD-A73347505-001-05-3	Asinex Ltd.	BAS 01813011			CC1(C)NC(=O)N(CC(O)CN2CCOCC2)C1=O	InChI=1S/C12H21N3O4/c1-12(2)10(17)15(11(18)13-12)8-9(16)7-14-3-5-19-6-4-14/h9,16H,3-8H2,1-2H3,(H,13,18)	NTMQHOLHUHTIQJ-UHFFFAOYSA-N	271.153206182							116515
T0510-1657	LSM-44242	SID24828705, BRD-K33421056	5677808	InChI=1S/C22H26N2O3/c1-26-19-13-11-17(16-20(19)27-2)12-14-22(25)24(18-8-4-3-5-9-18)21-10-6-7-15-23-21/h6-7,10-16,18H,3-5,8-9H2,1-2H3/b14-12+	YSVXHIHWZLGYLG-WYMLVPIESA-N	COc1ccc(\C=C\C(=O)N(C2CCCCC2)c3ccccn3)cc1OC	BroadT	BRD-K33421056	BRD-K33421056-001-06-4	Enamine Ltd.	T0510-1657			COc1ccc(\C=C\C(=O)N(C2CCCCC2)c2ccccn2)cc1OC	InChI=1S/C22H26N2O3/c1-26-19-13-11-17(16-20(19)27-2)12-14-22(25)24(18-8-4-3-5-9-18)21-10-6-7-15-23-21/h6-7,10-16,18H,3-5,8-9H2,1-2H3/b14-12+	YSVXHIHWZLGYLG-WYMLVPIESA-N	366.194342712							
F1105-0448	LSM-27971	BRD-K55410263	4119285	InChI=1S/C18H16N2O5S2/c1-20-13-5-4-12(27(2,22)23)10-16(13)26-18(20)19-17(21)11-3-6-14-15(9-11)25-8-7-24-14/h3-6,9-10H,7-8H2,1-2H3	HFNZUPKADLLECY-UHFFFAOYSA-N	CN1C(=NC(=O)c2ccc3OCCOc3c2)Sc4cc(ccc14)S(=O)(=O)C	BroadT	BRD-K55410263	BRD-K55410263-001-05-1	ChemDiv Inc.	G786-0347			Cn1c2ccc(cc2sc1=NC(=O)c1ccc2OCCOc2c1)S(C)(=O)=O	InChI=1S/C18H16N2O5S2/c1-20-13-5-4-12(27(2,22)23)10-16(13)26-18(20)19-17(21)11-3-6-14-15(9-11)25-8-7-24-14/h3-6,9-10H,7-8H2,1-2H3	HFNZUPKADLLECY-UHFFFAOYSA-N	404.050063012							116517
2-[2-(4-Methoxy-phenyl)-5-methyl-pyrazolo[1,5-a]pyrimidin-7-ylamino]-ethanol	LSM-27972	SID849869, BRD-K42380497	652377	InChI=1S/C16H18N4O2/c1-11-9-15(17-7-8-21)20-16(18-11)10-14(19-20)12-3-5-13(22-2)6-4-12/h3-6,9-10,17,21H,7-8H2,1-2H3	BXVYSVNNCZSPAS-UHFFFAOYSA-N	COc1ccc(cc1)c2cc3nc(C)cc(NCCO)n3n2	BroadT	BRD-K42380497	BRD-K42380497-001-05-0	Asinex Ltd.	ASN 08734284			COc1ccc(cc1)-c1cc2nc(C)cc(NCCO)n2n1	InChI=1S/C16H18N4O2/c1-11-9-15(17-7-8-21)20-16(18-11)10-14(19-20)12-3-5-13(22-2)6-4-12/h3-6,9-10,17,21H,7-8H2,1-2H3	BXVYSVNNCZSPAS-UHFFFAOYSA-N	298.142975856							116518
AC1NTWUS	LSM-27973	SID864205, BRD-A68941917	5389940	InChI=1S/C17H23N3O4/c1-16(2)10-6-7-17(16,3)12(21)11(10)18-8-9-13(22)19(4)15(24)20(5)14(9)23/h8,10-11,18H,6-7H2,1-5H3	UULMCFPTNUQDHR-UHFFFAOYSA-N	CN1C(=O)N(C)C(=O)C(=CNC2C3CCC(C)(C2=O)C3(C)C)C1=O	BroadT	BRD-A68941917	BRD-A68941917-001-05-2	InterBioScreen Ltd.	STOCK5S-09065			CN1C(=O)N(C)C(=O)C(=CNC2C3CCC(C)(C2=O)C3(C)C)C1=O	InChI=1S/C17H23N3O4/c1-16(2)10-6-7-17(16,3)12(21)11(10)18-8-9-13(22)19(4)15(24)20(5)14(9)23/h8,10-11,18H,6-7H2,1-5H3	UULMCFPTNUQDHR-UHFFFAOYSA-N	333.168856246							116519
SMR000007811	LSM-27974	SID26667965, SID847102, BRD-K06437062	649505	InChI=1S/C23H27N3O6S/c27-23(24-18-1-6-21-22(15-18)32-16-31-21)17-7-9-25(10-8-17)19-2-4-20(5-3-19)33(28,29)26-11-13-30-14-12-26/h1-6,15,17H,7-14,16H2,(H,24,27)	KMOUVLZOJLLOTQ-UHFFFAOYSA-N	O=C(Nc1ccc2OCOc2c1)C3CCN(CC3)c4ccc(cc4)S(=O)(=O)N5CCOCC5	BroadT	BRD-K06437062	BRD-K06437062-001-05-7	Asinex Ltd.	ASN 07156948			O=C(Nc1ccc2OCOc2c1)C1CCN(CC1)c1ccc(cc1)S(=O)(=O)N1CCOCC1	InChI=1S/C23H27N3O6S/c27-23(24-18-1-6-21-22(15-18)32-16-31-21)17-7-9-25(10-8-17)19-2-4-20(5-3-19)33(28,29)26-11-13-30-14-12-26/h1-6,15,17H,7-14,16H2,(H,24,27)	KMOUVLZOJLLOTQ-UHFFFAOYSA-N	473.162056304							116520
AC1LDFLH	LSM-27975	SID865012, BRD-K72362513	666259	InChI=1S/C25H27N5O2/c1-28-22-10-9-19(26-25(31)23-8-5-17-32-23)18-21(22)27-24(28)11-12-29-13-15-30(16-14-29)20-6-3-2-4-7-20/h2-10,17-18H,11-16H2,1H3,(H,26,31)	CKQYQAZAMQUMRT-UHFFFAOYSA-N	Cn1c(CCN2CCN(CC2)c3ccccc3)nc4cc(NC(=O)c5occc5)ccc14	BroadT	BRD-K72362513	BRD-K72362513-001-05-1	InterBioScreen Ltd.	STOCK5S-32806			Cn1c(CCN2CCN(CC2)c2ccccc2)nc2cc(NC(=O)c3ccco3)ccc12	InChI=1S/C25H27N5O2/c1-28-22-10-9-19(26-25(31)23-8-5-17-32-23)18-21(22)27-24(28)11-12-29-13-15-30(16-14-29)20-6-3-2-4-7-20/h2-10,17-18H,11-16H2,1H3,(H,26,31)	CKQYQAZAMQUMRT-UHFFFAOYSA-N	429.216475154							116521
AC1MEJUE	LSM-27976	SID7978257, BRD-A47427006	2904517	InChI=1S/C16H17NO4/c1-2-11-7-8-15(20-11)16(18)17-9-12-10-19-13-5-3-4-6-14(13)21-12/h3-8,12H,2,9-10H2,1H3,(H,17,18)	BMDUNLDUEMNPMW-UHFFFAOYSA-N	CCc1oc(cc1)C(=O)NCC2COc3ccccc3O2	BroadT	BRD-A47427006	BRD-A47427006-001-05-0	ChemBridge Corporation	6595554			CCc1ccc(o1)C(=O)NCC1COc2ccccc2O1	InChI=1S/C16H17NO4/c1-2-11-7-8-15(20-11)16(18)17-9-12-10-19-13-5-3-4-6-14(13)21-12/h3-8,12H,2,9-10H2,1H3,(H,17,18)	BMDUNLDUEMNPMW-UHFFFAOYSA-N	287.115758034							116522
1-(4-Bromo-phenyl)-3-diethylamino-pyrrolidine-2,5-dione	LSM-27977	SID49645219, BRD-A01703017	2841262	InChI=1S/C14H17BrN2O2/c1-3-16(4-2)12-9-13(18)17(14(12)19)11-7-5-10(15)6-8-11/h5-8,12H,3-4,9H2,1-2H3	UIEKOKIAENKGCG-UHFFFAOYSA-N	CCN(CC)C1CC(=O)N(C1=O)c2ccc(Br)cc2	BroadT	BRD-A01703017	BRD-A01703017-001-06-3	Asinex Ltd.	BAS 00393543			CCN(CC)C1CC(=O)N(C1=O)c1ccc(Br)cc1	InChI=1S/C14H17BrN2O2/c1-3-16(4-2)12-9-13(18)17(14(12)19)11-7-5-10(15)6-8-11/h5-8,12H,3-4,9H2,1-2H3	UIEKOKIAENKGCG-UHFFFAOYSA-N	324.047340404							116523
AC1NLYS1	LSM-27978	BRD-K40681259	4968035	InChI=1S/C21H22N4O4/c1-27-17-11-15(12-18(28-2)20(17)29-3)21(26)25-24-16(13-19-22-9-10-23-19)14-7-5-4-6-8-14/h4-12H,13H2,1-3H3,(H,22,23)(H,25,26)	UTCCOJHKHVSQRA-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)NN=C(Cc2ncc[nH]2)c3ccccc3	BroadT	BRD-K40681259	BRD-K40681259-001-07-7	Enamine Ltd.	T5325242			COc1cc(cc(OC)c1OC)C(=O)NN=C(Cc1ncc[nH]1)c1ccccc1	InChI=1S/C21H22N4O4/c1-27-17-11-15(12-18(28-2)20(17)29-3)21(26)25-24-16(13-19-22-9-10-23-19)14-7-5-4-6-8-14/h4-12H,13H2,1-3H3,(H,22,23)(H,25,26)	UTCCOJHKHVSQRA-UHFFFAOYSA-N	394.164105224							116524
MLS002174182	LSM-27979	SID74373694, BRD-K99031252	42601170	InChI=1S/C28H26N2O4/c1-16-9-12-22-20(13-16)26(31)30-25-19-11-10-18(33-3)14-23(19)34-15-21(25)24(17-7-5-4-6-8-17)28(30,2)27(32)29-22/h4-14,21,24-25H,15H2,1-3H3,(H,29,32)/t21-,24+,25+,28-/m1/s1	JFSFFOSMTMIOSP-PUWQJRQGSA-N	COc1ccc2[C@H]3[C@H](COc2c1)[C@H](c4ccccc4)[C@@]5(C)N3C(=O)c6cc(C)ccc6NC5=O	BroadT	BRD-K99031252	BRD-K99031252-001-08-0	Fluorous Technologies Inc.	FTI0802-089			COc1ccc2[C@H]3[C@H](COc2c1)[C@H](c1ccccc1)[C@@]1(C)N3C(=O)c2cc(C)ccc2NC1=O	InChI=1S/C28H26N2O4/c1-16-9-12-22-20(13-16)26(31)30-25-19-11-10-18(33-3)14-23(19)34-15-21(25)24(17-7-5-4-6-8-17)28(30,2)27(32)29-22/h4-14,21,24-25H,15H2,1-3H3,(H,29,32)/t21-,24+,25+,28-/m1/s1	JFSFFOSMTMIOSP-PUWQJRQGSA-N	454.189257332							116525
SMR000107457	LSM-27980	SID7973059, BRD-K86326540	2247855	InChI=1S/C16H16O5/c1-4-7-19-15(17)9-20-12-5-6-13-10(2)11(3)16(18)21-14(13)8-12/h4-6,8H,1,7,9H2,2-3H3	MKPOGFKSYUTWKG-UHFFFAOYSA-N	CC1=C(C)c2ccc(OCC(=O)OCC=C)cc2OC1=O	BroadT	BRD-K86326540	BRD-K86326540-001-05-7	ChemBridge Corporation	6652404			Cc1c(C)c(=O)oc2cc(OCC(=O)OCC=C)ccc12	InChI=1S/C16H16O5/c1-4-7-19-15(17)9-20-12-5-6-13-10(2)11(3)16(18)21-14(13)8-12/h4-6,8H,1,7,9H2,2-3H3	MKPOGFKSYUTWKG-UHFFFAOYSA-N	288.099773612							116526
6-Methyl-2-[4-(piperidin-1-ylsulfonyl)phenyl]imidazo[1,2-a]pyridine	LSM-27981	SID24801525, BRD-K54922437	2909198	InChI=1S/C19H21N3O2S/c1-15-5-10-19-20-18(14-21(19)13-15)16-6-8-17(9-7-16)25(23,24)22-11-3-2-4-12-22/h5-10,13-14H,2-4,11-12H2,1H3	MQSQEXCUZALYQZ-UHFFFAOYSA-N	Cc1ccc2nc(cn2c1)c3ccc(cc3)S(=O)(=O)N4CCCCC4	BroadT	BRD-K54922437	BRD-K54922437-001-06-5	Asinex Ltd.	BAS 03302828			Cc1ccc2nc(cn2c1)-c1ccc(cc1)S(=O)(=O)N1CCCCC1	InChI=1S/C19H21N3O2S/c1-15-5-10-19-20-18(14-21(19)13-15)16-6-8-17(9-7-16)25(23,24)22-11-3-2-4-12-22/h5-10,13-14H,2-4,11-12H2,1H3	MQSQEXCUZALYQZ-UHFFFAOYSA-N	355.135447632							116527
MLS000334320	LSM-27982	SID22402768, BRD-A16099274	4875040	InChI=1S/C25H25N3O/c1-28(2)20-14-12-18(13-15-20)22(16-27-25(29)19-8-4-3-5-9-19)23-17-26-24-11-7-6-10-21(23)24/h3-15,17,22,26H,16H2,1-2H3,(H,27,29)	JXQXXCHEVVHQBR-UHFFFAOYSA-N	CN(C)c1ccc(cc1)C(CNC(=O)c2ccccc2)c3c[nH]c4ccccc34	BroadT	BRD-A16099274	BRD-A16099274-001-06-7	Enamine Ltd.	T5291926			CN(C)c1ccc(cc1)C(CNC(=O)c1ccccc1)c1c[nH]c2ccccc12	InChI=1S/C25H25N3O/c1-28(2)20-14-12-18(13-15-20)22(16-27-25(29)19-8-4-3-5-9-19)23-17-26-24-11-7-6-10-21(23)24/h3-15,17,22,26H,16H2,1-2H3,(H,27,29)	JXQXXCHEVVHQBR-UHFFFAOYSA-N	383.19976245							116528
T0519-0548	LSM-27983	SID24830879, BRD-A70214426	5214340	InChI=1S/C22H23N3O3/c1-15-19(21(26)17-5-3-2-4-6-17)20(24-22(27)23-15)16-7-9-18(10-8-16)25-11-13-28-14-12-25/h2-10,20H,11-14H2,1H3,(H2,23,24,27)	JGEBSSTWEFAKAN-UHFFFAOYSA-N	CC1=C(C(NC(=O)N1)c2ccc(cc2)N3CCOCC3)C(=O)c4ccccc4	BroadT	BRD-A70214426	BRD-A70214426-001-05-4	Enamine Ltd.	T0519-0548			CC1=C(C(NC(=O)N1)c1ccc(cc1)N1CCOCC1)C(=O)c1ccccc1	InChI=1S/C22H23N3O3/c1-15-19(21(26)17-5-3-2-4-6-17)20(24-22(27)23-15)16-7-9-18(10-8-16)25-11-13-28-14-12-25/h2-10,20H,11-14H2,1H3,(H2,23,24,27)	JGEBSSTWEFAKAN-UHFFFAOYSA-N	377.173941626							116529
2,4-Dibromo-6-[(quinolin-3-ylamino)methyl]phenol	LSM-27984	SID47202054, BRD-K44897776	1989794	InChI=1S/C16H12Br2N2O/c17-12-5-11(16(21)14(18)7-12)8-19-13-6-10-3-1-2-4-15(10)20-9-13/h1-7,9,19,21H,8H2	XSSXZAOJTXILLG-UHFFFAOYSA-N	Oc1c(Br)cc(Br)cc1CNc2cnc3ccccc3c2	BroadT	BRD-K44897776	BRD-K44897776-001-05-3	Vitas-M Laboratory Ltd.	STK105887			Oc1c(Br)cc(Br)cc1CNc1cnc2ccccc2c1	InChI=1S/C16H12Br2N2O/c17-12-5-11(16(21)14(18)7-12)8-19-13-6-10-3-1-2-4-15(10)20-9-13/h1-7,9,19,21H,8H2	XSSXZAOJTXILLG-UHFFFAOYSA-N	405.931638224							116530
STK053632	LSM-27985	SID4265518, BRD-K14305179	1092315	InChI=1S/C15H18N2O4S3/c18-23(19,15-5-4-12-22-15)16-13-6-8-14(9-7-13)24(20,21)17-10-2-1-3-11-17/h4-9,12,16H,1-3,10-11H2	LAXSHVLQKGTZOC-UHFFFAOYSA-N	O=S(=O)(Nc1ccc(cc1)S(=O)(=O)N2CCCCC2)c3cccs3	BroadT	BRD-K14305179	BRD-K14305179-001-05-6	ChemBridge Corporation	6262768			O=S(=O)(Nc1ccc(cc1)S(=O)(=O)N1CCCCC1)c1cccs1	InChI=1S/C15H18N2O4S3/c18-23(19,15-5-4-12-22-15)16-13-6-8-14(9-7-13)24(20,21)17-10-2-1-3-11-17/h4-9,12,16H,1-3,10-11H2	LAXSHVLQKGTZOC-UHFFFAOYSA-N	386.042869146							116531
AC1LUIBL	LSM-6693	BRD-K94018295, EMF-SUMO1-3	1607628	InChI=1S/C16H13ClN6O3S2/c1-22-15(10-2-4-11(17)5-3-10)20-21-16(22)27-9-13(24)19-18-8-12-6-7-14(28-12)23(25)26/h2-8H,9H2,1H3,(H,19,24)	HSXDVXSIMYPYTJ-UHFFFAOYSA-N	Cn1c(SCC(=O)NN=Cc2ccc(s2)[N+](=O)[O-])nnc1c3ccc(Cl)cc3	BroadT	BRD-K94018295	BRD-K94018295-001-09-9	InterBioScreen Ltd.	STOCK2S-79598			Cn1c(SCC(=O)NN=Cc2ccc(s2)[N+]([O-])=O)nnc1-c1ccc(Cl)cc1	InChI=1S/C16H13ClN6O3S2/c1-22-15(10-2-4-11(17)5-3-10)20-21-16(22)27-9-13(24)19-18-8-12-6-7-14(28-12)23(25)26/h2-8H,9H2,1H3,(H,19,24)	HSXDVXSIMYPYTJ-UHFFFAOYSA-N	436.017907426							95329
N-(1,3-Benzodioxol-5-ylmethyl)-3,5-dimethyl-1-benzofuran-2-carboxamide	LSM-27986	SID4262932, BRD-K11384830	975628	InChI=1S/C19H17NO4/c1-11-3-5-15-14(7-11)12(2)18(24-15)19(21)20-9-13-4-6-16-17(8-13)23-10-22-16/h3-8H,9-10H2,1-2H3,(H,20,21)	BHQANQKXHBAXHP-UHFFFAOYSA-N	Cc1ccc2oc(C(=O)NCc3ccc4OCOc4c3)c(C)c2c1	BroadT	BRD-K11384830	BRD-K11384830-001-05-5	ChemBridge Corporation	7687646			Cc1c(oc2ccc(C)cc12)C(=O)NCc1ccc2OCOc2c1	InChI=1S/C19H17NO4/c1-11-3-5-15-14(7-11)12(2)18(24-15)19(21)20-9-13-4-6-16-17(8-13)23-10-22-16/h3-8H,9-10H2,1-2H3,(H,20,21)	BHQANQKXHBAXHP-UHFFFAOYSA-N	323.115758034							116532
957510-87-1	LSM-27987	SID24783141, BRD-K19263029	6485360	InChI=1S/C6H8ClN3O/c1-10-3-2-5(9-10)8-6(11)4-7/h2-3H,4H2,1H3,(H,8,9,11)	RCSGAPCWQGHIPV-UHFFFAOYSA-N	Cn1ccc(NC(=O)CCl)n1	BroadT	BRD-K19263029	BRD-K19263029-001-05-4	Asinex Ltd.	BAS 13526599			Cn1ccc(NC(=O)CCl)n1	InChI=1S/C6H8ClN3O/c1-10-3-2-5(9-10)8-6(11)4-7/h2-3H,4H2,1H3,(H,8,9,11)	RCSGAPCWQGHIPV-UHFFFAOYSA-N	173.035589616							116533
SMR000064544	LSM-27988	SID24840180, SID3714464, BRD-K54294290	2525465	InChI=1S/C23H25FN2O3S/c24-21-6-8-22(9-7-21)30(28,29)26-16-12-20(13-17-26)23(27)25-14-10-19(11-15-25)18-4-2-1-3-5-18/h1-10,20H,11-17H2	STUVLABKSDEAAL-UHFFFAOYSA-N	Fc1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC(=CC3)c4ccccc4	BroadT	BRD-K54294290	BRD-K54294290-001-05-7	Enamine Ltd.	T5334146			Fc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1CCC(=CC1)c1ccccc1	InChI=1S/C23H25FN2O3S/c24-21-6-8-22(9-7-21)30(28,29)26-16-12-20(13-17-26)23(27)25-14-10-19(11-15-25)18-4-2-1-3-5-18/h1-10,20H,11-17H2	STUVLABKSDEAAL-UHFFFAOYSA-N	428.15699157							116534
8-(Methylsulfonylamino)quinoline	LSM-27989	SID7974518, BRD-K99105239	151506	InChI=1S/C10H10N2O2S/c1-15(13,14)12-9-6-2-4-8-5-3-7-11-10(8)9/h2-7,12H,1H3	XYEPUTZVZYUENX-UHFFFAOYSA-N	CS(=O)(=O)Nc1cccc2cccnc12	BroadT	BRD-K99105239	BRD-K99105239-001-04-9	ChemBridge Corporation	5220980			CS(=O)(=O)Nc1cccc2cccnc12	InChI=1S/C10H10N2O2S/c1-15(13,14)12-9-6-2-4-8-5-3-7-11-10(8)9/h2-7,12H,1H3	XYEPUTZVZYUENX-UHFFFAOYSA-N	222.04629827							
SMR000107271	LSM-27990	SID7972975, BRD-K05613796	1632774	InChI=1S/C11H13N3S2/c1-4-5-15-11-13-9(12)8-6(2)7(3)16-10(8)14-11/h4H,1,5H2,2-3H3,(H2,12,13,14)	QNVCAWNRXRVYSQ-UHFFFAOYSA-N	Cc1sc2nc(SCC=C)nc(N)c2c1C	BroadT	BRD-K05613796	BRD-K05613796-001-05-7	ChemBridge Corporation	6625324			Cc1sc2nc(SCC=C)nc(N)c2c1C	InChI=1S/C11H13N3S2/c1-4-5-15-11-13-9(12)8-6(2)7(3)16-10(8)14-11/h4H,1,5H2,2-3H3,(H2,12,13,14)	QNVCAWNRXRVYSQ-UHFFFAOYSA-N	251.055088826							116535
MLS000110397	LSM-27991	SID7975427, BRD-K14082747	854704	InChI=1S/C15H14O3/c1-3-4-10-5-15(16)18-14-7-13-11(6-12(10)14)9(2)8-17-13/h5-8H,3-4H2,1-2H3	ZTTLXIGZQRLEOL-UHFFFAOYSA-N	CCCC1=CC(=O)Oc2cc3occ(C)c3cc12	BroadT	BRD-K14082747	BRD-K14082747-001-05-4	ChemBridge Corporation	6433049			CCCc1cc(=O)oc2cc3occ(C)c3cc12	InChI=1S/C15H14O3/c1-3-4-10-5-15(16)18-14-7-13-11(6-12(10)14)9(2)8-17-13/h5-8H,3-4H2,1-2H3	ZTTLXIGZQRLEOL-UHFFFAOYSA-N	242.094294308							116536
MLS000721995	LSM-27992	SID22402147, BRD-K37654346	4457468	InChI=1S/C13H6Cl2FN3O2S/c14-9-5-8(10(15)22-9)11(20)17-13-19-18-12(21-13)6-1-3-7(16)4-2-6/h1-5H,(H,17,19,20)	CBPHONAGSPFBCY-UHFFFAOYSA-N	Fc1ccc(cc1)c2oc(NC(=O)c3cc(Cl)sc3Cl)nn2	BroadT	BRD-K37654346	BRD-K37654346-001-06-6	Life Chemicals Inc.	F1374-0163			Fc1ccc(cc1)-c1nnc(NC(=O)c2cc(Cl)sc2Cl)o1	InChI=1S/C13H6Cl2FN3O2S/c14-9-5-8(10(15)22-9)11(20)17-13-19-18-12(21-13)6-1-3-7(16)4-2-6/h1-5H,(H,17,19,20)	CBPHONAGSPFBCY-UHFFFAOYSA-N	356.954180772							116537
MLS000333994	LSM-27993	SID17516087, BRD-K42214482	2107253	InChI=1S/C23H17ClFN3O3/c24-16-9-10-19-20(11-16)28(14-21(29)26-18-8-4-7-17(25)12-18)23(31)22(30)27(19)13-15-5-2-1-3-6-15/h1-12H,13-14H2,(H,26,29)	NTZFMUWFXFTZDP-UHFFFAOYSA-N	Fc1cccc(NC(=O)CN2C(=O)C(=O)N(Cc3ccccc3)c4ccc(Cl)cc24)c1	BroadT	BRD-K42214482	BRD-K42214482-001-05-8	Enamine Ltd.	T5238587			Fc1cccc(NC(=O)Cn2c3cc(Cl)ccc3n(Cc3ccccc3)c(=O)c2=O)c1	InChI=1S/C23H17ClFN3O3/c24-16-9-10-19-20(11-16)28(14-21(29)26-18-8-4-7-17(25)12-18)23(31)22(30)27(19)13-15-5-2-1-3-6-15/h1-12H,13-14H2,(H,26,29)	NTZFMUWFXFTZDP-UHFFFAOYSA-N	437.094247344							116538
AC1NGLDZ	LSM-27994	BRD-A99725936	4751454	InChI=1S/C27H20N2O4S/c1-17-8-5-14-22(28-17)29-24(23(26(31)27(29)32)25(30)21-13-7-15-34-21)18-9-6-12-20(16-18)33-19-10-3-2-4-11-19/h2-16,23-24H,1H3	FXFPFNOMFHNZPP-UHFFFAOYSA-N	Cc1cccc(n1)N2C(C(C(=O)c3cccs3)C(=O)C2=O)c4cccc(Oc5ccccc5)c4	BroadT	BRD-A99725936	BRD-A99725936-001-05-9	InterBioScreen Ltd.	STOCK3S-13434			Cc1cccc(n1)N1C(C(C(=O)c2cccs2)C(=O)C1=O)c1cccc(Oc2ccccc2)c1	InChI=1S/C27H20N2O4S/c1-17-8-5-14-22(28-17)29-24(23(26(31)27(29)32)25(30)21-13-7-15-34-21)18-9-6-12-20(16-18)33-19-10-3-2-4-11-19/h2-16,23-24H,1H3	FXFPFNOMFHNZPP-UHFFFAOYSA-N	468.11437783							116539
MLS000830620	LSM-27995	SID24841569, BRD-K70911100	16197062	InChI=1S/C20H27NO4/c21-20(23)18-10-17(16-4-2-1-3-5-16)11-19(25-18)24-13-15-8-6-14(12-22)7-9-15/h6-10,16-17,19,22H,1-5,11-13H2,(H2,21,23)/t17-,19+/m0/s1	QRBJYWAFDJHZPG-PKOBYXMFSA-N	NC(=O)C1=C[C@@H](C[C@H](OCc2ccc(CO)cc2)O1)C3CCCCC3	BroadT	BRD-K70911100	BRD-K70911100-001-08-0	Harvard University	DHPC11_000138			NC(=O)C1=C[C@@H](C[C@H](OCc2ccc(CO)cc2)O1)C1CCCCC1	InChI=1S/C20H27NO4/c21-20(23)18-10-17(16-4-2-1-3-5-16)11-19(25-18)24-13-15-8-6-14(12-22)7-9-15/h6-10,16-17,19,22H,1-5,11-13H2,(H2,21,23)/t17-,19+/m0/s1	QRBJYWAFDJHZPG-PKOBYXMFSA-N	345.194008354							116540
STK873669	LSM-27996	SID26665508, BRD-K16013402	748072	InChI=1S/C15H14N4S/c1-10-3-4-11(2)13(9-10)19-14(17-18-15(19)20)12-5-7-16-8-6-12/h3-9H,1-2H3,(H,18,20)	IQVBUVZXVALZRD-UHFFFAOYSA-N	Cc1ccc(C)c(c1)n2c(S)nnc2c3ccncc3	BroadT	BRD-K16013402	BRD-K16013402-001-05-3	InterBioScreen Ltd.	STOCK4S-04390			Cc1ccc(C)c(c1)-n1c(S)nnc1-c1ccncc1	InChI=1S/C15H14N4S/c1-10-3-4-11(2)13(9-10)19-14(17-18-15(19)20)12-5-7-16-8-6-12/h3-9H,1-2H3,(H,18,20)	IQVBUVZXVALZRD-UHFFFAOYSA-N	282.093917178							116541
BAS 00165347	LSM-44243	BRD-K55501011	2254266	InChI=1S/C22H21N3O2S2/c1-4-12-25-20(26)19(29-22(25)23-14-15-8-6-5-7-9-15)21-24(2)17-13-16(27-3)10-11-18(17)28-21/h4-11,13H,1,12,14H2,2-3H3/b21-19-,23-22?	HRDPRTLZKJAGFY-BZMHFZIGSA-N	COc1ccc2S\C(=C\3/SC(=NCc4ccccc4)N(CC=C)C3=O)\N(C)c2c1	BroadT	BRD-K55501011	BRD-K55501011-001-05-2	Asinex Ltd.	BAS 00165347			COc1ccc2S\C(N(C)c2c1)=C1/SC(=NCc2ccccc2)N(CC=C)C1=O	InChI=1S/C22H21N3O2S2/c1-4-12-25-20(26)19(29-22(25)23-14-15-8-6-5-7-9-15)21-24(2)17-13-16(27-3)10-11-18(17)28-21/h4-11,13H,1,12,14H2,2-3H3/b21-19-,23-22?	HRDPRTLZKJAGFY-BZMHFZIGSA-N	423.107518322							
AC1NUBCD	LSM-27998	BRD-K76276202	939947	InChI=1S/C13H8Cl2N4OS/c14-9-3-1-4-10(15)8(9)7-16-19-12(17-18-13(19)21)11-5-2-6-20-11/h1-7H,(H,18,21)	CUKPMPLHZPXTQA-UHFFFAOYSA-N	Sc1nnc(c2occc2)n1N=Cc3c(Cl)cccc3Cl	BroadT	BRD-K76276202	BRD-K76276202-001-05-5	InterBioScreen Ltd.	STOCK2S-96367			Sc1nnc(-c2ccco2)n1N=Cc1c(Cl)cccc1Cl	InChI=1S/C13H8Cl2N4OS/c14-9-3-1-4-10(15)8(9)7-16-19-12(17-18-13(19)21)11-5-2-6-20-11/h1-7H,(H,18,21)	CUKPMPLHZPXTQA-UHFFFAOYSA-N	337.979587026							116543
BDBM50865	LSM-27999	BRD-A69467860	91896960	InChI=1S/C21H19N3O4S/c1-11(2)13-6-8-14(9-7-13)17-16(18(25)15-5-4-10-28-15)19(26)20(27)24(17)21-23-22-12(3)29-21/h4-11,16-17H,1-3H3	OEFDADDUKUVRTO-UHFFFAOYSA-N	CC(C)c1ccc(cc1)C2C(C(=O)c3occc3)C(=O)C(=O)N2c4nnc(C)s4	BroadT	BRD-A69467860	BRD-A69467860-001-06-2	Asinex Ltd.	BAS 03305200			CC(C)c1ccc(cc1)C1C(C(=O)c2ccco2)C(=O)C(=O)N1c1nnc(C)s1	InChI=1S/C21H19N3O4S/c1-11(2)13-6-8-14(9-7-13)17-16(18(25)15-5-4-10-28-15)19(26)20(27)24(17)21-23-22-12(3)29-21/h4-11,16-17H,1-3H3	OEFDADDUKUVRTO-UHFFFAOYSA-N	409.109626808							116544
SMR000005271	LSM-28000	SID26668132, SID847200, BRD-K18942494	649597	InChI=1S/C25H26N4O4S/c1-31-20-6-4-19(5-7-20)28-8-10-29(11-9-28)24(30)16-34-25-18(15-26)12-17-13-22(32-2)23(33-3)14-21(17)27-25/h4-7,12-14H,8-11,16H2,1-3H3	WOJRATVIFYWXPQ-UHFFFAOYSA-N	COc1ccc(cc1)N2CCN(CC2)C(=O)CSc3nc4cc(OC)c(OC)cc4cc3C#N	BroadT	BRD-K18942494	BRD-K18942494-001-05-0	Asinex Ltd.	ASN 05588961			COc1ccc(cc1)N1CCN(CC1)C(=O)CSc1nc2cc(OC)c(OC)cc2cc1C#N	InChI=1S/C25H26N4O4S/c1-31-20-6-4-19(5-7-20)28-8-10-29(11-9-28)24(30)16-34-25-18(15-26)12-17-13-22(32-2)23(33-3)14-21(17)27-25/h4-7,12-14H,8-11,16H2,1-3H3	WOJRATVIFYWXPQ-UHFFFAOYSA-N	478.167476042							116545
HMS2694D06	LSM-28001	BRD-K06618803	16195501	InChI=1S/C23H26N4O3S/c1-15-3-5-17(6-4-15)24-22(31)26-25-20-14-23(9-11-27(12-10-23)16(2)28)30-21-8-7-18(29)13-19(20)21/h3-8,13,29H,9-12,14H2,1-2H3,(H2,24,26,31)	OYHRYVPSYREGSG-UHFFFAOYSA-N	CC(=O)N1CCC2(CC1)CC(=NN=C(S)Nc3ccc(C)cc3)c4cc(O)ccc4O2	BroadT	BRD-K06618803	BRD-K06618803-001-05-6	ChemDiv Inc.	K786-0560			CC(=O)N1CCC2(CC1)CC(=NN=C(S)Nc1ccc(C)cc1)c1cc(O)ccc1O2	InChI=1S/C23H26N4O3S/c1-15-3-5-17(6-4-15)24-22(31)26-25-20-14-23(9-11-27(12-10-23)16(2)28)30-21-8-7-18(29)13-19(20)21/h3-8,13,29H,9-12,14H2,1-2H3,(H2,24,26,31)	OYHRYVPSYREGSG-UHFFFAOYSA-N	438.172561422							116546
CBMICRO_041127	LSM-28002	BRD-K23638265	878236	InChI=1S/C15H18N4S/c1-10-4-6-14(7-5-10)19-11(2)8-13(12(19)3)9-17-18-15(16)20/h4-9H,1-3H3,(H3,16,18,20)	SMPCJGBROFJISX-UHFFFAOYSA-N	Cc1ccc(cc1)n2c(C)cc(C=NN=C(N)S)c2C	BroadT	BRD-K23638265	BRD-K23638265-001-06-2	ChemBridge Corporation	6023157			Cc1cc(C=NN=C(N)S)c(C)n1-c1ccc(C)cc1	InChI=1S/C15H18N4S/c1-10-4-6-14(7-5-10)19-11(2)8-13(12(19)3)9-17-18-15(16)20/h4-9H,1-3H3,(H3,16,18,20)	SMPCJGBROFJISX-UHFFFAOYSA-N	286.125217306							116547
MLS000706176	LSM-28003	SID24821342, BRD-K46335764	1092908	InChI=1S/C21H16N2O4/c24-20(14-5-2-1-3-6-14)22-16-7-4-8-17(12-16)23-21(25)15-9-10-18-19(11-15)27-13-26-18/h1-12H,13H2,(H,22,24)(H,23,25)	OCCIJDXNHRWVPF-UHFFFAOYSA-N	O=C(Nc1cccc(NC(=O)c2ccc3OCOc3c2)c1)c4ccccc4	BroadT	BRD-K46335764	BRD-K46335764-001-06-4	Asinex Ltd.	BAS 08879666			O=C(Nc1cccc(NC(=O)c2ccc3OCOc3c2)c1)c1ccccc1	InChI=1S/C21H16N2O4/c24-20(14-5-2-1-3-6-14)22-16-7-4-8-17(12-16)23-21(25)15-9-10-18-19(11-15)27-13-26-18/h1-12H,13H2,(H,22,24)(H,23,25)	OCCIJDXNHRWVPF-UHFFFAOYSA-N	360.111007012							116548
OPREA1_611014	LSM-28004	SID7972500, BRD-A52809779	2848468	InChI=1S/C20H26N2O5/c1-11-5-4-6-14(9-11)27-19(24)17-12(2)21-20(25)22-18(17)13-7-8-15(23)16(10-13)26-3/h7-8,10-11,14,18,23H,4-6,9H2,1-3H3,(H2,21,22,25)	WQANRCGOBKNGNW-UHFFFAOYSA-N	COc1cc(ccc1O)C2NC(=O)NC(=C2C(=O)OC3CCCC(C)C3)C	BroadT	BRD-A52809779	BRD-A52809779-001-05-6	ChemBridge Corporation	5479767			COc1cc(ccc1O)C1NC(=O)NC(C)=C1C(=O)OC1CCCC(C)C1	InChI=1S/C20H26N2O5/c1-11-5-4-6-14(9-11)27-19(24)17-12(2)21-20(25)22-18(17)13-7-8-15(23)16(10-13)26-3/h7-8,10-11,14,18,23H,4-6,9H2,1-3H3,(H2,21,22,25)	WQANRCGOBKNGNW-UHFFFAOYSA-N	374.184171952							116549
GNF-PF-747	LSM-28005	GNF-PF-747, BRD-K12624245	1167735	InChI=1S/C24H25N3O3S/c1-15-6-8-17(9-7-15)22-25-26-23(30-22)31-14-21(28)27-20-11-10-18(29-5)12-19(20)16(2)13-24(27,3)4/h6-13H,14H2,1-5H3	XTWMSZMFOLXMFC-UHFFFAOYSA-N	COc1ccc2N(C(=O)CSc3oc(nn3)c4ccc(C)cc4)C(C)(C)C=C(C)c2c1	BroadT	BRD-K12624245	BRD-K12624245-001-05-2	ChemBridge Corporation	6907719			COc1ccc2N(C(=O)CSc3nnc(o3)-c3ccc(C)cc3)C(C)(C)C=C(C)c2c1	InChI=1S/C24H25N3O3S/c1-15-6-8-17(9-7-15)22-25-26-23(30-22)31-14-21(28)27-20-11-10-18(29-5)12-19(20)16(2)13-24(27,3)4/h6-13H,14H2,1-5H3	XTWMSZMFOLXMFC-UHFFFAOYSA-N	435.16166238							116550
T5299626	LSM-28006	SID26658077, BRD-K12322037	2552034	InChI=1S/C18H19ClN2O6S2/c1-9-10(2)28-17(20-11(3)22)16(9)18(24)27-8-15(23)21-14-7-12(29(4,25)26)5-6-13(14)19/h5-7H,8H2,1-4H3,(H,20,22)(H,21,23)	WKUDJUZAORNBFR-UHFFFAOYSA-N	CC(=O)Nc1sc(C)c(C)c1C(=O)OCC(=O)Nc2cc(ccc2Cl)S(=O)(=O)C	BroadT	BRD-K12322037	BRD-K12322037-001-06-3	Enamine Ltd.	T5299626			CC(=O)Nc1sc(C)c(C)c1C(=O)OCC(=O)Nc1cc(ccc1Cl)S(C)(=O)=O	InChI=1S/C18H19ClN2O6S2/c1-9-10(2)28-17(20-11(3)22)16(9)18(24)27-8-15(23)21-14-7-12(29(4,25)26)5-6-13(14)19/h5-7H,8H2,1-4H3,(H,20,22)(H,21,23)	WKUDJUZAORNBFR-UHFFFAOYSA-N	458.037305438							116551
SMR000155598	LSM-28007	BRD-K22447639, SID14744012	2331775	InChI=1S/C19H20N4O3S/c24-19(20-13-18-21-16-8-1-2-9-17(16)22-18)14-6-5-7-15(12-14)27(25,26)23-10-3-4-11-23/h1-2,5-9,12H,3-4,10-11,13H2,(H,20,24)(H,21,22)	RYVDPAIMWYPTMR-UHFFFAOYSA-N	O=C(NCc1nc2ccccc2[nH]1)c3cccc(c3)S(=O)(=O)N4CCCC4	BroadT	BRD-K22447639	BRD-K22447639-001-05-0	Enamine Ltd.	T0505-3756			O=C(NCc1nc2ccccc2[nH]1)c1cccc(c1)S(=O)(=O)N1CCCC1	InChI=1S/C19H20N4O3S/c24-19(20-13-18-21-16-8-1-2-9-17(16)22-18)14-6-5-7-15(12-14)27(25,26)23-10-3-4-11-23/h1-2,5-9,12H,3-4,10-11,13H2,(H,20,24)(H,21,22)	RYVDPAIMWYPTMR-UHFFFAOYSA-N	384.12561123							116552
2-Phenoxy-n-pyridin-2-yl-butyramide	LSM-28008	SID842348, BRD-A76538149	644606	InChI=1S/C15H16N2O2/c1-2-13(19-12-8-4-3-5-9-12)15(18)17-14-10-6-7-11-16-14/h3-11,13H,2H2,1H3,(H,16,17,18)	CCLWZYQBFWCPOO-UHFFFAOYSA-N	CCC(Oc1ccccc1)C(=O)Nc2ccccn2	BroadT	BRD-A76538149	BRD-A76538149-001-06-4	Asinex Ltd.	BAS 06979803			CCC(Oc1ccccc1)C(=O)Nc1ccccn1	InChI=1S/C15H16N2O2/c1-2-13(19-12-8-4-3-5-9-12)15(18)17-14-10-6-7-11-16-14/h3-11,13H,2H2,1H3,(H,16,17,18)	CCLWZYQBFWCPOO-UHFFFAOYSA-N	256.121177772							116553
MLS000416385	LSM-44244	SID22401447, BRD-K43991526	5823841	InChI=1S/C22H20Cl2N2O8/c1-31-17-5-3-13(9-15(17)23)25-19(27)11-33-21(29)7-8-22(30)34-12-20(28)26-14-4-6-18(32-2)16(24)10-14/h3-10H,11-12H2,1-2H3,(H,25,27)(H,26,28)/b8-7+	QYIBZXMTOIPDDS-BQYQJAHWSA-N	COc1ccc(NC(=O)COC(=O)\C=C\C(=O)OCC(=O)Nc2ccc(OC)c(Cl)c2)cc1Cl	BroadT	BRD-K43991526	BRD-K43991526-001-07-4	Enamine Ltd.	T0509-9094			COc1ccc(NC(=O)COC(=O)\C=C\C(=O)OCC(=O)Nc2ccc(OC)c(Cl)c2)cc1Cl	InChI=1S/C22H20Cl2N2O8/c1-31-17-5-3-13(9-15(17)23)25-19(27)11-33-21(29)7-8-22(30)34-12-20(28)26-14-4-6-18(32-2)16(24)10-14/h3-10H,11-12H2,1-2H3,(H,25,27)(H,26,28)/b8-7+	QYIBZXMTOIPDDS-BQYQJAHWSA-N	510.05967104							
F2005-0031	LSM-28010	SID24779605, BRD-K77538269	7207334	InChI=1S/C16H18N4OS/c21-15(18-12-5-1-2-6-12)11-22-16-9-8-14(19-20-16)13-7-3-4-10-17-13/h3-4,7-10,12H,1-2,5-6,11H2,(H,18,21)	RSSDRQCVHNIBGP-UHFFFAOYSA-N	O=C(CSc1ccc(nn1)c2ccccn2)NC3CCCC3	BroadT	BRD-K77538269	BRD-K77538269-001-05-7	Life Chemicals Inc.	F2005-0031			O=C(CSc1ccc(nn1)-c1ccccn1)NC1CCCC1	InChI=1S/C16H18N4OS/c21-15(18-12-5-1-2-6-12)11-22-16-9-8-14(19-20-16)13-7-3-4-10-17-13/h3-4,7-10,12H,1-2,5-6,11H2,(H,18,21)	RSSDRQCVHNIBGP-UHFFFAOYSA-N	314.120131926							116555
AC1LY8UV	LSM-44245	SID24791642, BRD-K60036355	1868412	InChI=1S/C23H19FN2O4S/c1-16(27)17-4-8-21(9-5-17)26-31(29,30)22-12-10-20(11-13-22)25-15-14-23(28)18-2-6-19(24)7-3-18/h2-15,25-26H,1H3/b15-14+	ISMBVCFQNZNCEW-CCEZHUSRSA-N	CC(=O)c1ccc(NS(=O)(=O)c2ccc(N\C=C\C(=O)c3ccc(F)cc3)cc2)cc1	BroadT	BRD-K60036355	BRD-K60036355-001-06-4	InterBioScreen Ltd.	STOCK2S-33665			CC(=O)c1ccc(NS(=O)(=O)c2ccc(N\C=C\C(=O)c3ccc(F)cc3)cc2)cc1	InChI=1S/C23H19FN2O4S/c1-16(27)17-4-8-21(9-5-17)26-31(29,30)22-12-10-20(11-13-22)25-15-14-23(28)18-2-6-19(24)7-3-18/h2-15,25-26H,1H3/b15-14+	ISMBVCFQNZNCEW-CCEZHUSRSA-N	438.104955998							
2-Pyridin-4-yl-benzo[h]chromen-4-one	LSM-28012	Uccf-029, BRD-K98050179	3163532	InChI=1S/C18H11NO2/c20-16-11-17(13-7-9-19-10-8-13)21-18-14-4-2-1-3-12(14)5-6-15(16)18/h1-11H	LZCOBWKVDSSOBB-UHFFFAOYSA-N	O=C1C=C(Oc2c1ccc3ccccc23)c4ccncc4	BroadT	BRD-K98050179	BRD-K98050179-001-07-3	Asinex Ltd.	BAS 12813734			O=c1cc(oc2c3ccccc3ccc12)-c1ccncc1	InChI=1S/C18H11NO2/c20-16-11-17(13-7-9-19-10-8-13)21-18-14-4-2-1-3-12(14)5-6-15(16)18/h1-11H	LZCOBWKVDSSOBB-UHFFFAOYSA-N	273.078978602							116557
AC1LCFUI	LSM-28013	SID24782175, BRD-K21200440	628572	InChI=1S/C22H12N2O6/c25-17-7-3-1-5-15(17)23-19(27)11-9-13-14(10-12(11)20(23)28)22(30)24(21(13)29)16-6-2-4-8-18(16)26/h1-10,25-26H	WYKSZSGFWPSFIS-UHFFFAOYSA-N	Oc1ccccc1N2C(=O)c3cc4C(=O)N(C(=O)c4cc3C2=O)c5ccccc5O	BroadT	BRD-K21200440	BRD-K21200440-001-05-3	Asinex Ltd.	BAS 00132937			Oc1ccccc1-n1c(=O)c2cc3c(cc2c1=O)c(=O)n(-c1ccccc1O)c3=O	InChI=1S/C22H12N2O6/c25-17-7-3-1-5-15(17)23-19(27)11-9-13-14(10-12(11)20(23)28)22(30)24(21(13)29)16-6-2-4-8-18(16)26/h1-10,25-26H	WYKSZSGFWPSFIS-UHFFFAOYSA-N	400.069536124							116558
3-(4-Methoxy-phenyl)-3,4-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-6-one	LSM-28014	SID14721237, BRD-K35493694	1389352	InChI=1S/C12H13N3O2S/c1-17-10-4-2-9(3-5-10)14-7-13-12-15(8-14)11(16)6-18-12/h2-5H,6-8H2,1H3	LCTOKHKDXBABBU-UHFFFAOYSA-N	COc1ccc(cc1)N2CN=C3SCC(=O)N3C2	BroadT	BRD-K35493694	BRD-K35493694-001-05-1	Asinex Ltd.	BAS 00636641			COc1ccc(cc1)N1CN=C2SCC(=O)N2C1	InChI=1S/C12H13N3O2S/c1-17-10-4-2-9(3-5-10)14-7-13-12-15(8-14)11(16)6-18-12/h2-5H,6-8H2,1H3	LCTOKHKDXBABBU-UHFFFAOYSA-N	263.072847376							116559
2-(1-Naphthyl)-2-oxoethyl thiocyanate	LSM-28015	SID17506942, BRD-K26391274	2175753	InChI=1S/C13H9NOS/c14-9-16-8-13(15)12-7-3-5-10-4-1-2-6-11(10)12/h1-7H,8H2	VXWSXLFEJJRUIT-UHFFFAOYSA-N	O=C(CSC#N)c1cccc2ccccc12	BroadT	BRD-K26391274	BRD-K26391274-001-05-6	ChemBridge Corporation	6536221			O=C(CSC#N)c1cccc2ccccc12	InChI=1S/C13H9NOS/c14-9-16-8-13(15)12-7-3-5-10-4-1-2-6-11(10)12/h1-7H,8H2	VXWSXLFEJJRUIT-UHFFFAOYSA-N	227.040484608							116560
3-Benzyl-6-(2-phenylethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole	LSM-28016	SID4257991, BRD-K52576537	850594	InChI=1S/C18H16N4S/c1-3-7-14(8-4-1)11-12-17-21-22-16(19-20-18(22)23-17)13-15-9-5-2-6-10-15/h1-10H,11-13H2	VOOQGWNIYDJKLT-UHFFFAOYSA-N	C(Cc1nn2c(Cc3ccccc3)nnc2s1)c4ccccc4	BroadT	BRD-K52576537	BRD-K52576537-001-05-2	ChemBridge Corporation	7863738			C(Cc1ccccc1)c1nn2c(Cc3ccccc3)nnc2s1	InChI=1S/C18H16N4S/c1-3-7-14(8-4-1)11-12-17-21-22-16(19-20-18(22)23-17)13-15-9-5-2-6-10-15/h1-10H,11-13H2	VOOQGWNIYDJKLT-UHFFFAOYSA-N	320.109567242							116561
BRN 1297095	LSM-28017	SID4261984, BRD-K88390751	5360356	InChI=1S/C21H21NO3/c23-19-10-9-16-17(15-7-3-1-4-8-15)13-20(24)25-21(16)18(19)14-22-11-5-2-6-12-22/h1,3-4,7-10,13,23H,2,5-6,11-12,14H2	PODWTADXQSKRMR-UHFFFAOYSA-N	Oc1ccc2C(=CC(=O)Oc2c1CN3CCCCC3)c4ccccc4	BroadT	BRD-K88390751	BRD-K88390751-001-05-5	ChemBridge Corporation	7941135			Oc1ccc2c(cc(=O)oc2c1CN1CCCCC1)-c1ccccc1	InChI=1S/C21H21NO3/c23-19-10-9-16-17(15-7-3-1-4-8-15)13-20(24)25-21(16)18(19)14-22-11-5-2-6-12-22/h1,3-4,7-10,13,23H,2,5-6,11-12,14H2	PODWTADXQSKRMR-UHFFFAOYSA-N	335.152143542							116562
SMR000095462	LSM-28018	SID24838359, SID7965476, BRD-A36410418	5307643	InChI=1S/C21H21FN2O7S/c1-3-31-20(27)18-15(10-32(29,30)13-5-6-14(22)11(2)8-13)23-21(28)24-19(18)12-4-7-16(25)17(26)9-12/h4-9,19,25-26H,3,10H2,1-2H3,(H2,23,24,28)	NPTIRTKTUKFTHJ-UHFFFAOYSA-N	CCOC(=O)C1=C(CS(=O)(=O)c2ccc(F)c(C)c2)NC(=O)NC1c3ccc(O)c(O)c3	BroadT	BRD-A36410418	BRD-A36410418-001-04-4	ChemDiv Inc.	C653-0211			CCOC(=O)C1=C(CS(=O)(=O)c2ccc(F)c(C)c2)NC(=O)NC1c1ccc(O)c(O)c1	InChI=1S/C21H21FN2O7S/c1-3-31-20(27)18-15(10-32(29,30)13-5-6-14(22)11(2)8-13)23-21(28)24-19(18)12-4-7-16(25)17(26)9-12/h4-9,19,25-26H,3,10H2,1-2H3,(H2,23,24,28)	NPTIRTKTUKFTHJ-UHFFFAOYSA-N	464.105349922							116563
ZINC01955991	LSM-15229	SID124898881, BRD-K24544741	1677386	InChI=1S/C18H16NO/c1-14-11-12-19(17-10-6-5-9-16(14)17)13-18(20)15-7-3-2-4-8-15/h2-12H,13H2,1H3/q+1	JXXFWNOEDPEZBN-UHFFFAOYSA-N	Cc1cc[n+](CC(=O)c2ccccc2)c3ccccc13	BroadT	BRD-K24544741	BRD-K24544741-004-05-1	Asinex Ltd.	BAS 00758877		Br	Cc1cc[n+](CC(=O)c2ccccc2)c2ccccc12.Br	InChI=1S/C18H16NO.BrH/c1-14-11-12-19(17-10-6-5-9-16(14)17)13-18(20)15-7-3-2-4-8-15;/h2-12H,13H2,1H3;1H/q+1;	QXOQPNUCSQCQIK-UHFFFAOYSA-N	262.123189142							103876, 103876
MLS000095184	LSM-2403	BRD5892, SID4246202, SID24838296, BRD-K18595892	3240581	InChI=1S/C25H37ClN4O2/c1-4-13-29(14-5-2)17-12-27-24(31)20-10-15-30(16-11-20)18-23-19(3)32-25(28-23)21-6-8-22(26)9-7-21/h6-9,20H,4-5,10-18H2,1-3H3,(H,27,31)	DJAFUYUUNCOPGL-UHFFFAOYSA-N	CCCN(CCC)CCNC(=O)C1CCN(Cc2nc(oc2C)c3ccc(Cl)cc3)CC1	BroadT	BRD-K18595892	BRD-K18595892-001-07-0	ChemDiv Inc.	C522-0766			CCCN(CCC)CCNC(=O)C1CCN(Cc2nc(oc2C)-c2ccc(Cl)cc2)CC1	InChI=1S/C25H37ClN4O2/c1-4-13-29(14-5-2)17-12-27-24(31)20-10-15-30(16-11-20)18-23-19(3)32-25(28-23)21-6-8-22(26)9-7-21/h6-9,20H,4-5,10-18H2,1-3H3,(H,27,31)	DJAFUYUUNCOPGL-UHFFFAOYSA-N	460.260504174							92331
MLS000065957	LSM-28019	SID4258787, BRD-K88283070	2222160	InChI=1S/C16H18BrN3O2/c1-19-8-10-20(11-9-19)13-5-3-2-4-12(13)18-16(21)14-6-7-15(17)22-14/h2-7H,8-11H2,1H3,(H,18,21)	SWJZESQMXHBAAK-UHFFFAOYSA-N	CN1CCN(CC1)c2ccccc2NC(=O)c3oc(Br)cc3	BroadT	BRD-K88283070	BRD-K88283070-001-06-4	ChemBridge Corporation	7927237			CN1CCN(CC1)c1ccccc1NC(=O)c1ccc(Br)o1	InChI=1S/C16H18BrN3O2/c1-19-8-10-20(11-9-19)13-5-3-2-4-12(13)18-16(21)14-6-7-15(17)22-14/h2-7H,8-11H2,1H3,(H,18,21)	SWJZESQMXHBAAK-UHFFFAOYSA-N	363.058239446							116564
MLS000544731	LSM-28020	SID17406944, BRD-K57598941	7551758	InChI=1S/C21H19N3O2/c1-2-3-13-23-20(25)17-14-15-9-7-8-12-18(15)24(19(17)22-21(23)26)16-10-5-4-6-11-16/h4-12,14H,2-3,13H2,1H3	KQDKCMGRJYFVSD-UHFFFAOYSA-N	CCCCN1C(=O)N=C2N(c3ccccc3)c4ccccc4C=C2C1=O	BroadT	BRD-K57598941	BRD-K57598941-001-05-1	Specs	AM-900/13371001			CCCCn1c(=O)nc2n(-c3ccccc3)c3ccccc3cc2c1=O	InChI=1S/C21H19N3O2/c1-2-3-13-23-20(25)17-14-15-9-7-8-12-18(15)24(19(17)22-21(23)26)16-10-5-4-6-11-16/h4-12,14H,2-3,13H2,1H3	KQDKCMGRJYFVSD-UHFFFAOYSA-N	345.147726878							116565
AJ-333/36115026	LSM-28021	SID17406893, BRD-K25369035	1214495	InChI=1S/C16H20FN3O4S/c1-10(2)9-19-14(11(3)4)18-15(20(21)22)16(19)25(23,24)13-7-5-12(17)6-8-13/h5-8,10-11H,9H2,1-4H3	QRLCLCSHNIFDFF-UHFFFAOYSA-N	CC(C)Cn1c(nc(c1S(=O)(=O)c2ccc(F)cc2)[N+](=O)[O-])C(C)C	BroadT	BRD-K25369035	BRD-K25369035-001-06-1	Specs	AJ-333/36115026			CC(C)Cn1c(nc(c1S(=O)(=O)c1ccc(F)cc1)[N+]([O-])=O)C(C)C	InChI=1S/C16H20FN3O4S/c1-10(2)9-19-14(11(3)4)18-15(20(21)22)16(19)25(23,24)13-7-5-12(17)6-8-13/h5-8,10-11H,9H2,1-4H3	QRLCLCSHNIFDFF-UHFFFAOYSA-N	369.11585504							116566
AC1LZ6VO	LSM-44246	SID26726397, BRD-K13480833	1943201	InChI=1S/C18H12N2O6S/c21-16-15(9-11-3-2-6-14(8-11)20(25)26)27-18(24)19(16)10-12-4-1-5-13(7-12)17(22)23/h1-9H,10H2,(H,22,23)/b15-9+	CKVJBQJWIBGJNO-OQLLNIDSSA-N	OC(=O)c1cccc(CN2C(=O)S\C(=C\c3cccc(c3)[N+](=O)[O-])\C2=O)c1	BroadT	BRD-K13480833	BRD-K13480833-001-05-6	InterBioScreen Ltd.	STOCK2S-89728			OC(=O)c1cccc(CN2C(=O)S\C(=C\c3cccc(c3)[N+]([O-])=O)C2=O)c1	InChI=1S/C18H12N2O6S/c21-16-15(9-11-3-2-6-14(8-11)20(25)26)27-18(24)19(16)10-12-4-1-5-13(7-12)17(22)23/h1-9H,10H2,(H,22,23)/b15-9+	CKVJBQJWIBGJNO-OQLLNIDSSA-N	384.041606814							
AM-807/41931686	LSM-28023	SID17408996, BRD-A50048201	3156546	InChI=1S/C19H15ClN2O3S/c1-2-24-19(23)16-15(13-8-9-14(20)26-13)12(10-21)18(22)25-17(16)11-6-4-3-5-7-11/h3-9,15H,2,22H2,1H3	GUPQZTILNQCEQJ-UHFFFAOYSA-N	CCOC(=O)C1=C(OC(=C(C#N)C1c2ccc(Cl)s2)N)c3ccccc3	BroadT	BRD-A50048201	BRD-A50048201-001-05-1	Asinex Ltd.	BAS 07418353			CCOC(=O)C1=C(OC(N)=C(C#N)C1c1ccc(Cl)s1)c1ccccc1	InChI=1S/C19H15ClN2O3S/c1-2-24-19(23)16-15(13-8-9-14(20)26-13)12(10-21)18(22)25-17(16)11-6-4-3-5-7-11/h3-9,15H,2,22H2,1H3	GUPQZTILNQCEQJ-UHFFFAOYSA-N	386.04919076							116568
CHEMBL1603947	LSM-28024	SID7972067, BRD-K22102307	1326327	InChI=1S/C20H30N2O3S/c1-16-8-10-19(11-9-16)26(24,25)22-14-12-17(13-15-22)20(23)21-18-6-4-2-3-5-7-18/h8-11,17-18H,2-7,12-15H2,1H3,(H,21,23)	JPKBXLDXYCGYJW-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)NC3CCCCCC3	BroadT	BRD-K22102307	BRD-K22102307-001-05-2	ChemBridge Corporation	6958206			Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCCCCC1	InChI=1S/C20H30N2O3S/c1-16-8-10-19(11-9-16)26(24,25)22-14-12-17(13-15-22)20(23)21-18-6-4-2-3-5-7-18/h8-11,17-18H,2-7,12-15H2,1H3,(H,21,23)	JPKBXLDXYCGYJW-UHFFFAOYSA-N	378.19771353							116569
AN-329/15538120	LSM-28025	SID49641227, BRD-K92195074	1010926	InChI=1S/C16H20N4O5S/c1-4-5-14(21)17-11-6-8-12(9-7-11)26(22,23)20-13-10-15(24-2)19-16(18-13)25-3/h6-10H,4-5H2,1-3H3,(H,17,21)(H,18,19,20)	ZPBKBNZIECGLRQ-UHFFFAOYSA-N	CCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2cc(OC)nc(OC)n2	BroadT	BRD-K92195074	BRD-K92195074-001-05-2	Asinex Ltd.	BAS 02930665			CCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1cc(OC)nc(OC)n1	InChI=1S/C16H20N4O5S/c1-4-5-14(21)17-11-6-8-12(9-7-11)26(22,23)20-13-10-15(24-2)19-16(18-13)25-3/h6-10H,4-5H2,1-3H3,(H,17,21)(H,18,19,20)	ZPBKBNZIECGLRQ-UHFFFAOYSA-N	380.11544047							116570
SMR000003485	LSM-28026	SID26668242, SID852963, BRD-A10460165	655608	InChI=1S/C20H23N5O5S2/c1-11-5-6-13(30-11)16(19(27)23-7-8-29-2)25(10-12-4-3-9-31-12)20(28)17-14(21)15(18(22)26)24-32-17/h3-6,9,16H,7-8,10,21H2,1-2H3,(H2,22,26)(H,23,27)	VXLZULRHUBHIQU-UHFFFAOYSA-N	COCCNC(=O)C(N(Cc1cccs1)C(=O)c2snc(C(=O)N)c2N)c3oc(C)cc3	BroadT	BRD-A10460165	BRD-A10460165-001-05-1	Asinex Ltd.	ASN 04451571			COCCNC(=O)C(N(Cc1cccs1)C(=O)c1snc(C(N)=O)c1N)c1ccc(C)o1	InChI=1S/C20H23N5O5S2/c1-11-5-6-13(30-11)16(19(27)23-7-8-29-2)25(10-12-4-3-9-31-12)20(28)17-14(21)15(18(22)26)24-32-17/h3-6,9,16H,7-8,10,21H2,1-2H3,(H2,22,26)(H,23,27)	VXLZULRHUBHIQU-UHFFFAOYSA-N	477.114060266							116571
AC1OCM86	LSM-28027	BRD-K38004132	6942516	InChI=1S/C14H13NO2/c1-8(15-9-6-7-9)12-13(16)10-4-2-3-5-11(10)14(12)17/h2-5,9,12H,6-7H2,1H3	DHYHZSRBFZHBDG-UHFFFAOYSA-N	CC(=NC1CC1)C2C(=O)c3ccccc3C2=O	BroadT	BRD-K38004132	BRD-K38004132-001-06-1	Asinex Ltd.	BAS 02927201			CC(=NC1CC1)C1C(=O)c2ccccc2C1=O	InChI=1S/C14H13NO2/c1-8(15-9-6-7-9)12-13(16)10-4-2-3-5-11(10)14(12)17/h2-5,9,12H,6-7H2,1H3	DHYHZSRBFZHBDG-UHFFFAOYSA-N	227.094628666							116572
CHEMBL356965	LSM-15415	BRD-K57565358	4557684	InChI=1S/C31H32ClN3O2/c32-26-14-9-15-27(22-26)34-20-18-33(19-21-34)16-7-8-17-35-29(36)23-28(31(35)37)30(24-10-3-1-4-11-24)25-12-5-2-6-13-25/h1-6,9-15,22H,7-8,16-21,23H2	ROGAOFMHAQAPFV-UHFFFAOYSA-N	Clc1cccc(c1)N2CCN(CCCCN3C(=O)CC(=C(c4ccccc4)c5ccccc5)C3=O)CC2	BroadT	BRD-K57565358	BRD-K57565358-003-06-0	Specs	AP-685/41280751		Cl	Clc1cccc(c1)N1CCN(CCCCN2C(=O)CC(=C(c3ccccc3)c3ccccc3)C2=O)CC1.Cl	InChI=1S/C31H32ClN3O2.ClH/c32-26-14-9-15-27(22-26)34-20-18-33(19-21-34)16-7-8-17-35-29(36)23-28(31(35)37)30(24-10-3-1-4-11-24)25-12-5-2-6-13-25;/h1-6,9-15,22H,7-8,16-21,23H2;1H	URDXPXQQHVBCAY-UHFFFAOYSA-N	513.218305004							104057, 104057
MLS000058105	LSM-28028	SID24839941, SID3711150, BRD-K15969875	2090539	InChI=1S/C19H21ClN6O3S2/c1-13-11-14(2)26-18(21-13)22-23-19(26)30-12-17(27)24-7-9-25(10-8-24)31(28,29)16-5-3-15(20)4-6-16/h3-6,11H,7-10,12H2,1-2H3	PDDXDBGCCXRJGU-UHFFFAOYSA-N	Cc1cc(C)n2c(SCC(=O)N3CCN(CC3)S(=O)(=O)c4ccc(Cl)cc4)nnc2n1	BroadT	BRD-K15969875	BRD-K15969875-001-05-5	Enamine Ltd.	T5269833			Cc1cc(C)n2c(SCC(=O)N3CCN(CC3)S(=O)(=O)c3ccc(Cl)cc3)nnc2n1	InChI=1S/C19H21ClN6O3S2/c1-13-11-14(2)26-18(21-13)22-23-19(26)30-12-17(27)24-7-9-25(10-8-24)31(28,29)16-5-3-15(20)4-6-16/h3-6,11H,7-10,12H2,1-2H3	PDDXDBGCCXRJGU-UHFFFAOYSA-N	480.080507682							116573
BAS 08770603	LSM-28029	SID14726739, BRD-K57582929	1092475	InChI=1S/C14H14N4S2/c1-9-12(20-13(15)17-9)11-8-19-14(18-11)16-7-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3,(H2,15,17)(H,16,18)	RMMSGACHNAARPR-UHFFFAOYSA-N	Cc1nc(N)sc1c2csc(NCc3ccccc3)n2	BroadT	BRD-K57582929	BRD-K57582929-001-05-1	Asinex Ltd.	BAS 08770603			Cc1nc(N)sc1-c1csc(NCc2ccccc2)n1	InChI=1S/C14H14N4S2/c1-9-12(20-13(15)17-9)11-8-19-14(18-11)16-7-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3,(H2,15,17)(H,16,18)	RMMSGACHNAARPR-UHFFFAOYSA-N	302.065987868							116574
MLS000098162	LSM-28030	SID3714094, BRD-K18827801	2350751	InChI=1S/C15H13FN4O2S2/c16-11-5-1-2-6-12(11)18-14-19-20-15(24-14)23-9-13(21)17-8-10-4-3-7-22-10/h1-7H,8-9H2,(H,17,21)(H,18,19)	BIOYSHGCYYKKQU-UHFFFAOYSA-N	Fc1ccccc1Nc2nnc(SCC(=O)NCc3occc3)s2	BroadT	BRD-K18827801	BRD-K18827801-001-03-6	Enamine Ltd.	T0508-4542			Fc1ccccc1Nc1nnc(SCC(=O)NCc2ccco2)s1	InChI=1S/C15H13FN4O2S2/c16-11-5-1-2-6-12(11)18-14-19-20-15(24-14)23-9-13(21)17-8-10-4-3-7-22-10/h1-7H,8-9H2,(H,17,21)(H,18,19)	BIOYSHGCYYKKQU-UHFFFAOYSA-N	364.046395276							116575
AC1LNRWZ	LSM-28031	BRD-K16338247	1226481	InChI=1S/C26H21N3O5/c1-31-17-8-9-19(24(12-17)32-2)22-13-20(18-5-3-4-6-21(18)28-22)26(30)29-27-14-16-7-10-23-25(11-16)34-15-33-23/h3-14H,15H2,1-2H3,(H,29,30)	FTCGMANTUWVKFZ-UHFFFAOYSA-N	COc1ccc(c(OC)c1)c2cc(C(=O)NN=Cc3ccc4OCOc4c3)c5ccccc5n2	BroadT	BRD-K16338247	BRD-K16338247-001-05-3	Specs	AK-968/41025741			COc1ccc(c(OC)c1)-c1cc(C(=O)NN=Cc2ccc3OCOc3c2)c2ccccc2n1	InChI=1S/C26H21N3O5/c1-31-17-8-9-19(24(12-17)32-2)22-13-20(18-5-3-4-6-21(18)28-22)26(30)29-27-14-16-7-10-23-25(11-16)34-15-33-23/h3-14H,15H2,1-2H3,(H,29,30)	FTCGMANTUWVKFZ-UHFFFAOYSA-N	455.148120802							116576
MLS000830667	LSM-28032	SID26728085, BRD-K23866598	2805117	InChI=1S/C12H13N3O2S2/c1-12(2,3)9-7-18-11(14-9)19-10-5-4-8(6-13-10)15(16)17/h4-7H,1-3H3	YQONGZXLMRKZNG-UHFFFAOYSA-N	CC(C)(C)c1csc(Sc2ccc(cn2)[N+](=O)[O-])n1	BroadT	BRD-K23866598	BRD-K23866598-001-06-7	Maybridge	CD 08407			CC(C)(C)c1csc(Sc2ccc(cn2)[N+]([O-])=O)n1	InChI=1S/C12H13N3O2S2/c1-12(2,3)9-7-18-11(14-9)19-10-5-4-8(6-13-10)15(16)17/h4-7H,1-3H3	YQONGZXLMRKZNG-UHFFFAOYSA-N	295.044918066							116577
MLS000113401	LSM-28033	SID7976262, BRD-K49413990	1332572	InChI=1S/C18H22O4/c1-10-7-13(21-9-15(19)18(4,5)6)16-11(2)12(3)17(20)22-14(16)8-10/h7-8H,9H2,1-6H3	WADWDCTUKOOASN-UHFFFAOYSA-N	CC1=C(C)c2c(OCC(=O)C(C)(C)C)cc(C)cc2OC1=O	BroadT	BRD-K49413990	BRD-K49413990-001-11-2	ChemBridge Corporation	7106269			Cc1cc(OCC(=O)C(C)(C)C)c2c(C)c(C)c(=O)oc2c1	InChI=1S/C18H22O4/c1-10-7-13(21-9-15(19)18(4,5)6)16-11(2)12(3)17(20)22-14(16)8-10/h7-8H,9H2,1-6H3	WADWDCTUKOOASN-UHFFFAOYSA-N	302.151809184							116578
MLS000072281	LSM-15416	BRD-A05523604	652639	InChI=1S/C23H27N5O2/c1-30-21-14-17(10-11-20(21)29)22(23-24-25-26-28(23)19-8-4-5-9-19)27-13-12-16-6-2-3-7-18(16)15-27/h2-3,6-7,10-11,14,19,22,29H,4-5,8-9,12-13,15H2,1H3	ZLKIBTOQISIPFV-UHFFFAOYSA-N	COc1cc(ccc1O)C(N2CCc3ccccc3C2)c4nnnn4C5CCCC5	BroadT	BRD-A05523604	BRD-A05523604-003-05-8	Asinex Ltd.	ASN 05346378		Cl	COc1cc(ccc1O)C(N1CCc2ccccc2C1)c1nnnn1C1CCCC1.Cl	InChI=1S/C23H27N5O2.ClH/c1-30-21-14-17(10-11-20(21)29)22(23-24-25-26-28(23)19-8-4-5-9-19)27-13-12-16-6-2-3-7-18(16)15-27;/h2-3,6-7,10-11,14,19,22,29H,4-5,8-9,12-13,15H2,1H3;1H	ZUYOSZQSWWWONZ-UHFFFAOYSA-N	405.216475154							104058, 104058
AP-501/42682669	LSM-28034	SID14719111, BRD-K00071669	850621	InChI=1S/C16H11F3N2O2/c1-22-13-4-2-3-11(9-13)15-21-20-14(23-15)10-5-7-12(8-6-10)16(17,18)19/h2-9H,1H3	UGTWMVRVWPEERZ-UHFFFAOYSA-N	COc1cccc(c1)c2oc(nn2)c3ccc(cc3)C(F)(F)F	BroadT	BRD-K00071669	BRD-K00071669-001-05-7	Specs	AP-501/42682669			COc1cccc(c1)-c1nnc(o1)-c1ccc(cc1)C(F)(F)F	InChI=1S/C16H11F3N2O2/c1-22-13-4-2-3-11(9-13)15-21-20-14(23-15)10-5-7-12(8-6-10)16(17,18)19/h2-9H,1H3	UGTWMVRVWPEERZ-UHFFFAOYSA-N	320.077262212							116579
MLS000539708	LSM-28035	SID17385679, BRD-K28323207	1217129	InChI=1S/C23H22N2O6S2/c1-16-7-8-17(14-21(16)33(28,29)25-9-11-30-12-10-25)23(27)31-19-5-2-4-18(15-19)24-22(26)20-6-3-13-32-20/h2-8,13-15H,9-12H2,1H3,(H,24,26)	PQOFIQOWYUUNNI-UHFFFAOYSA-N	Cc1ccc(cc1S(=O)(=O)N2CCOCC2)C(=O)Oc3cccc(NC(=O)c4cccs4)c3	BroadT	BRD-K28323207	BRD-K28323207-001-05-9	Specs	AK-918/13946016			Cc1ccc(cc1S(=O)(=O)N1CCOCC1)C(=O)Oc1cccc(NC(=O)c2cccs2)c1	InChI=1S/C23H22N2O6S2/c1-16-7-8-17(14-21(16)33(28,29)25-9-11-30-12-10-25)23(27)31-19-5-2-4-18(15-19)24-22(26)20-6-3-13-32-20/h2-8,13-15H,9-12H2,1H3,(H,24,26)	PQOFIQOWYUUNNI-UHFFFAOYSA-N	486.091927824							116580
AC1LD8ZG	LSM-15417	SID124349759, SID24275537, BRD-A83928706	663204	InChI=1S/C24H32N4O2/c1-19-8-7-9-21(16-19)30-18-20(29)17-28-23-11-4-3-10-22(23)27(24(28)25)15-14-26-12-5-2-6-13-26/h3-4,7-11,16,20,25,29H,2,5-6,12-15,17-18H2,1H3	DDXGBMILSYHELN-UHFFFAOYSA-N	Cc1cccc(OCC(O)CN2C(=N)N(CCN3CCCCC3)c4ccccc24)c1	BroadT	BRD-A83928706	BRD-A83928706-003-05-1	InterBioScreen Ltd.	STOCK4S-28256		Cl	Cc1cccc(OCC(O)Cn2c3ccccc3n(CCN3CCCCC3)c2=N)c1.Cl	InChI=1S/C24H32N4O2.ClH/c1-19-8-7-9-21(16-19)30-18-20(29)17-28-23-11-4-3-10-22(23)27(24(28)25)15-14-26-12-5-2-6-13-26;/h3-4,7-11,16,20,25,29H,2,5-6,12-15,17-18H2,1H3;1H	KCJOGQNAHCZBCF-UHFFFAOYSA-N	408.252526304							104059, 104059
F0614-0003	LSM-28036	SID14736031, BRD-K76122035	4462518	InChI=1S/C21H16N2O3/c1-13-11-17(22-18(24)12-14-7-3-2-4-8-14)23-20-15-9-5-6-10-16(15)26-21(25)19(13)20/h2-11H,12H2,1H3,(H,22,23,24)	XFACYXIWQPCFKH-UHFFFAOYSA-N	Cc1cc(NC(=O)Cc2ccccc2)nc3c4ccccc4OC(=O)c13	BroadT	BRD-K76122035	BRD-K76122035-001-04-7	Life Chemicals Inc.	F0614-0003			Cc1cc(NC(=O)Cc2ccccc2)nc2c3ccccc3oc(=O)c12	InChI=1S/C21H16N2O3/c1-13-11-17(22-18(24)12-14-7-3-2-4-8-14)23-20-15-9-5-6-10-16(15)26-21(25)19(13)20/h2-11H,12H2,1H3,(H,22,23,24)	XFACYXIWQPCFKH-UHFFFAOYSA-N	344.116092392							116581
ZINC03358385	LSM-28037	SID24838000, BRD-K83303188	2475805	InChI=1S/C13H13NO4S/c1-8-14-9(7-19-8)6-18-13(16)11-4-3-10(17-2)5-12(11)15/h3-5,7,15H,6H2,1-2H3	PWJJFOPAFDHVEW-UHFFFAOYSA-N	COc1ccc(C(=O)OCc2csc(C)n2)c(O)c1	BroadT	BRD-K83303188	BRD-K83303188-001-06-4	Enamine Ltd.	T5329085			COc1ccc(C(=O)OCc2csc(C)n2)c(O)c1	InChI=1S/C13H13NO4S/c1-8-14-9(7-19-8)6-18-13(16)11-4-3-10(17-2)5-12(11)15/h3-5,7,15H,6H2,1-2H3	PWJJFOPAFDHVEW-UHFFFAOYSA-N	279.056528596							116582
3-[(2,4-Difluorophenoxy)methyl]-4-methoxybenzaldehyde	LSM-28038	SID17386665, BRD-K80148460	1226032	InChI=1S/C15H12F2O3/c1-19-14-4-2-10(8-18)6-11(14)9-20-15-5-3-12(16)7-13(15)17/h2-8H,9H2,1H3	ARAMEYDTNQOQNB-UHFFFAOYSA-N	COc1ccc(C=O)cc1COc2ccc(F)cc2F	BroadT	BRD-K80148460	BRD-K80148460-001-05-7	Specs	AK-968/41018731			COc1ccc(C=O)cc1COc1ccc(F)cc1F	InChI=1S/C15H12F2O3/c1-19-14-4-2-10(8-18)6-11(14)9-20-15-5-3-12(16)7-13(15)17/h2-8H,9H2,1H3	ARAMEYDTNQOQNB-UHFFFAOYSA-N	278.075450644							116583
BRN 0027041	LSM-44247	SID22411904, BRD-K86784336	838793	InChI=1S/C18H16O4/c1-20-16-8-7-12(10-17(16)21-2)9-13-11-22-15-6-4-3-5-14(15)18(13)19/h3-10H,11H2,1-2H3/b13-9+	KNEFUOWBXSWAJV-UKTHLTGXSA-N	COc1ccc(\C=C\2/COc3ccccc3C2=O)cc1OC	BroadT	BRD-K86784336	BRD-K86784336-001-05-5	Specs	AN-829/13872001			COc1ccc(\C=C2/COc3ccccc3C2=O)cc1OC	InChI=1S/C18H16O4/c1-20-16-8-7-12(10-17(16)21-2)9-13-11-22-15-6-4-3-5-14(15)18(13)19/h3-10H,11H2,1-2H3/b13-9+	KNEFUOWBXSWAJV-UKTHLTGXSA-N	296.104858992							
4,8-Dimethyl-7-methoxycoumarin	LSM-28040	SID7972590, BRD-K37205734	879545	InChI=1S/C12H12O3/c1-7-6-11(13)15-12-8(2)10(14-3)5-4-9(7)12/h4-6H,1-3H3	OMNGMJMBWPLZLA-UHFFFAOYSA-N	COc1ccc2C(=CC(=O)Oc2c1C)C	BroadT	BRD-K37205734	BRD-K37205734-001-05-9	ChemBridge Corporation	6095963			COc1ccc2c(C)cc(=O)oc2c1C	InChI=1S/C12H12O3/c1-7-6-11(13)15-12-8(2)10(14-3)5-4-9(7)12/h4-6H,1-3H3	OMNGMJMBWPLZLA-UHFFFAOYSA-N	204.078644244							116585
AC1N6QMR	LSM-28041	SID26663699, BRD-A20676077	4264276	InChI=1S/C19H25N3O2/c1-4-19(3)12-13-8-6-7-9-14(13)16-15(19)17(24)22(5-2)18(21-16)20-10-11-23/h6-9,23H,4-5,10-12H2,1-3H3,(H,20,21)	YXAQHTAMNWEFBR-UHFFFAOYSA-N	CCN1C(=NC2=C(C1=O)C(C)(CC)Cc3ccccc23)NCCO	BroadT	BRD-A20676077	BRD-A20676077-001-05-7	InterBioScreen Ltd.	STOCK3S-87870			CCn1c(NCCO)nc2-c3ccccc3CC(C)(CC)c2c1=O	InChI=1S/C19H25N3O2/c1-4-19(3)12-13-8-6-7-9-14(13)16-15(19)17(24)22(5-2)18(21-16)20-10-11-23/h6-9,23H,4-5,10-12H2,1-3H3,(H,20,21)	YXAQHTAMNWEFBR-UHFFFAOYSA-N	327.19467707							116586
AC1OA2NB	LSM-4543	BRD-K14232336, EMF-SUMO1-5	6797340	InChI=1S/C15H11Br2NO3/c1-8-11(15(20)21)3-2-4-13(8)18-7-9-5-10(16)6-12(17)14(9)19/h2-7,19H,1H3,(H,20,21)	ARODOYFAWYMBKK-UHFFFAOYSA-N	Cc1c(cccc1C(=O)O)N=Cc2cc(Br)cc(Br)c2O	BroadT	BRD-K14232336	BRD-K14232336-001-09-4	ChemDiv Inc.	K048-0112			Cc1c(cccc1C(O)=O)N=Cc1cc(Br)cc(Br)c1O	InChI=1S/C15H11Br2NO3/c1-8-11(15(20)21)3-2-4-13(8)18-7-9-5-10(16)6-12(17)14(9)19/h2-7,19H,1H3,(H,20,21)	ARODOYFAWYMBKK-UHFFFAOYSA-N	410.910568422							
AC1MJU74	LSM-28042	SID24805848, BRD-A40790605	3143121	InChI=1S/C15H23N3O2S/c1-4-11(10-15(2,3)20)13(19)17-18-14(21)16-12-8-6-5-7-9-12/h5-9,11,20H,4,10H2,1-3H3,(H,17,19)(H2,16,18,21)	RMNBOJKGAAWJLB-UHFFFAOYSA-N	CCC(CC(C)(C)O)C(=O)NN=C(S)Nc1ccccc1	BroadT	BRD-A40790605	BRD-A40790605-001-05-3	Asinex Ltd.	BAS 02789630			CCC(CC(C)(C)O)C(=O)NN=C(S)Nc1ccccc1	InChI=1S/C15H23N3O2S/c1-4-11(10-15(2,3)20)13(19)17-18-14(21)16-12-8-6-5-7-9-12/h5-9,11,20H,4,10H2,1-3H3,(H,17,19)(H2,16,18,21)	RMNBOJKGAAWJLB-UHFFFAOYSA-N	309.151097696							116587
STK046800	LSM-28043	SID14720532, BRD-K89895159	1154224	InChI=1S/C19H19N3O5S/c1-13-11-18(21-27-13)22-28(24,25)17-9-5-15(6-10-17)20-19(23)12-14-3-7-16(26-2)8-4-14/h3-11H,12H2,1-2H3,(H,20,23)(H,21,22)	UDAJXXIKAHFTEO-UHFFFAOYSA-N	COc1ccc(CC(=O)Nc2ccc(cc2)S(=O)(=O)Nc3cc(C)on3)cc1	BroadT	BRD-K89895159	BRD-K89895159-001-05-0	Asinex Ltd.	BAS 03219150			COc1ccc(CC(=O)Nc2ccc(cc2)S(=O)(=O)Nc2cc(C)on2)cc1	InChI=1S/C19H19N3O5S/c1-13-11-18(21-27-13)22-28(24,25)17-9-5-15(6-10-17)20-19(23)12-14-3-7-16(26-2)8-4-14/h3-11H,12H2,1-2H3,(H,20,23)(H,21,22)	UDAJXXIKAHFTEO-UHFFFAOYSA-N	401.104541428							116588
STK350550	LSM-28044	BRD-K16427437	2938675	InChI=1S/C11H10N2O3/c1-7-6-10(14)13(12-7)9-4-2-8(3-5-9)11(15)16/h2-6,14H,1H3,(H,15,16)	WVUSFTYCRLXIOI-UHFFFAOYSA-N	Cc1cc(O)n(n1)c2ccc(cc2)C(=O)O	BroadT	BRD-K16427437	BRD-K16427437-001-06-2	ChemBridge Corporation	7406590			Cc1cc(O)n(n1)-c1ccc(cc1)C(O)=O	InChI=1S/C11H10N2O3/c1-7-6-10(14)13(12-7)9-4-2-8(3-5-9)11(15)16/h2-6,14H,1H3,(H,15,16)	WVUSFTYCRLXIOI-UHFFFAOYSA-N	218.0691422							
MLS000555693	LSM-15230	BRD-K60993676	3104427	InChI=1S/C27H21N3O3/c31-25(20-13-15-23(16-14-20)28-26(32)21-8-3-1-4-9-21)19-30-17-7-12-24(18-30)29-27(33)22-10-5-2-6-11-22/h1-18H,19H2,(H-,28,29,31,32,33)/p+1	VARJULNXGISUBP-UHFFFAOYSA-O	O=C(C[n+]1cccc(NC(=O)c2ccccc2)c1)c3ccc(NC(=O)c4ccccc4)cc3	BroadT	BRD-K60993676	BRD-K60993676-004-05-4	Asinex Ltd.	BAS 00393755		Br	O=C(C[n+]1cccc(NC(=O)c2ccccc2)c1)c1ccc(NC(=O)c2ccccc2)cc1.Br	InChI=1S/C27H21N3O3.BrH/c31-25(20-13-15-23(16-14-20)28-26(32)21-8-3-1-4-9-21)19-30-17-7-12-24(18-30)29-27(33)22-10-5-2-6-11-22;/h1-18H,19H2,(H-,28,29,31,32,33);1H/p+1	DGTLXTRLUHKDEL-UHFFFAOYSA-O	436.166116594							103877, 103877
MLS000674939	LSM-28045	SID24795573, BRD-K14812948	888680	InChI=1S/C17H16N2O2/c1-20-15-10-8-14(9-11-15)17-18-16(21-19-17)12-7-13-5-3-2-4-6-13/h2-6,8-11H,7,12H2,1H3	YSXLJBBJOHXUBE-UHFFFAOYSA-N	COc1ccc(cc1)c2noc(CCc3ccccc3)n2	BroadT	BRD-K14812948	BRD-K14812948-001-12-7	ChemBridge Corporation	7359200			COc1ccc(cc1)-c1noc(CCc2ccccc2)n1	InChI=1S/C17H16N2O2/c1-20-15-10-8-14(9-11-15)17-18-16(21-19-17)12-7-13-5-3-2-4-6-13/h2-6,8-11H,7,12H2,1H3	YSXLJBBJOHXUBE-UHFFFAOYSA-N	280.121177772							116590
2-{[5-{[(2-Methylquinolin-8-yl)oxy]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide	LSM-28046	SID4256909, BRD-K10787453	1291590	InChI=1S/C18H19N5O2S/c1-3-9-23-16(21-22-18(23)26-11-15(19)24)10-25-14-6-4-5-13-8-7-12(2)20-17(13)14/h3-8H,1,9-11H2,2H3,(H2,19,24)	HCRIJAADNQZZJZ-UHFFFAOYSA-N	Cc1ccc2cccc(OCc3nnc(SCC(=O)N)n3CC=C)c2n1	BroadT	BRD-K10787453	BRD-K10787453-001-05-6	ChemBridge Corporation	7750172			Cc1ccc2cccc(OCc3nnc(SCC(N)=O)n3CC=C)c2n1	InChI=1S/C18H19N5O2S/c1-3-9-23-16(21-22-18(23)26-11-15(19)24)10-25-14-6-4-5-13-8-7-12(2)20-17(13)14/h3-8H,1,9-11H2,2H3,(H2,19,24)	HCRIJAADNQZZJZ-UHFFFAOYSA-N	369.125945588							116591
MLS000110126	LSM-28047	SID7973843, BRD-A02786371	2897268	InChI=1S/C21H18N4OS/c26-15(14-25-17-8-2-1-7-16(17)22-23-25)13-24-18-9-3-5-11-20(18)27-21-12-6-4-10-19(21)24/h1-12,15,26H,13-14H2	QRYLEGDMIGVEDT-UHFFFAOYSA-N	OC(CN1c2ccccc2Sc3ccccc13)Cn4nnc5ccccc45	BroadT	BRD-A02786371	BRD-A02786371-001-07-5	ChemBridge Corporation	6409470			OC(CN1c2ccccc2Sc2ccccc12)Cn1nnc2ccccc12	InChI=1S/C21H18N4OS/c26-15(14-25-17-8-2-1-7-16(17)22-23-25)13-24-18-9-3-5-11-20(18)27-21-12-6-4-10-19(21)24/h1-12,15,26H,13-14H2	QRYLEGDMIGVEDT-UHFFFAOYSA-N	374.120131926							116592
4-(Morpholin-4-ylmethyl)quinolin-3-ol	LSM-28048	SID4261858, BRD-K15597456	877833	InChI=1S/C14H16N2O2/c17-14-9-15-13-4-2-1-3-11(13)12(14)10-16-5-7-18-8-6-16/h1-4,9,17H,5-8,10H2	VBAXUMQUBLRYRQ-UHFFFAOYSA-N	Oc1cnc2ccccc2c1CN3CCOCC3	BroadT	BRD-K15597456	BRD-K15597456-001-05-1	ChemBridge Corporation	5937256			Oc1cnc2ccccc2c1CN1CCOCC1	InChI=1S/C14H16N2O2/c17-14-9-15-13-4-2-1-3-11(13)12(14)10-16-5-7-18-8-6-16/h1-4,9,17H,5-8,10H2	VBAXUMQUBLRYRQ-UHFFFAOYSA-N	244.121177772							116593
AC1LCNSY	LSM-28049	SID850631, BRD-A16741156	653162	InChI=1S/C18H20N4O3/c23-17(21-14-4-5-15-16(11-14)25-10-9-24-15)13-3-1-8-22(12-13)18-19-6-2-7-20-18/h2,4-7,11,13H,1,3,8-10,12H2,(H,21,23)	XBJRXNJEGXBTCT-UHFFFAOYSA-N	O=C(Nc1ccc2OCCOc2c1)C3CCCN(C3)c4ncccn4	BroadT	BRD-A16741156	BRD-A16741156-001-05-9	Asinex Ltd.	ASN 06482143			O=C(Nc1ccc2OCCOc2c1)C1CCCN(C1)c1ncccn1	InChI=1S/C18H20N4O3/c23-17(21-14-4-5-15-16(11-14)25-10-9-24-15)13-3-1-8-22(12-13)18-19-6-2-7-20-18/h2,4-7,11,13H,1,3,8-10,12H2,(H,21,23)	XBJRXNJEGXBTCT-UHFFFAOYSA-N	340.15354054							116594
MLS000051782	LSM-28050	SID4259556, BRD-A13273443	2971528	InChI=1S/C23H24N2O5S/c26-22(19-8-2-3-9-20(19)23(27)28)24-17-11-13-18(14-12-17)31(29,30)25-15-5-7-16-6-1-4-10-21(16)25/h1-4,6,10-14,19-20H,5,7-9,15H2,(H,24,26)(H,27,28)	IBGUAUZZMLDYFF-UHFFFAOYSA-N	OC(=O)C1CC=CCC1C(=O)Nc2ccc(cc2)S(=O)(=O)N3CCCc4ccccc34	BroadT	BRD-A13273443	BRD-A13273443-001-06-7	ChemBridge Corporation	7949364			OC(=O)C1CC=CCC1C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCc2ccccc12	InChI=1S/C23H24N2O5S/c26-22(19-8-2-3-9-20(19)23(27)28)24-17-11-13-18(14-12-17)31(29,30)25-15-5-7-16-6-1-4-10-21(16)25/h1-4,6,10-14,19-20H,5,7-9,15H2,(H,24,26)(H,27,28)	IBGUAUZZMLDYFF-UHFFFAOYSA-N	440.140592578							116595
AC1LOSQU	LSM-28051	BRD-K46849635	1269521	InChI=1S/C7H9N5O3/c1-3-5(13)8-7(11-9-3)12-10-4(2)6(14)15/h1-2H3,(H,14,15)(H2,8,11,12,13)	NZSYRPJMGWWXKA-UHFFFAOYSA-N	CC(=NNc1nnc(C)c(O)n1)C(=O)O	BroadT	BRD-K46849635	BRD-K46849635-001-05-3	ChemDiv Inc.	1683-2901			CC(=NNc1nnc(C)c(O)n1)C(O)=O	InChI=1S/C7H9N5O3/c1-3-5(13)8-7(11-9-3)12-10-4(2)6(14)15/h1-2H3,(H,14,15)(H2,8,11,12,13)	NZSYRPJMGWWXKA-UHFFFAOYSA-N	211.070539198							116596
BAS 06106627	LSM-28052	SID17403540, BRD-K54672388	1082772	InChI=1S/C19H14N2O2S/c1-23-15-9-7-14(8-10-15)21-12-20-18-16(19(21)22)11-17(24-18)13-5-3-2-4-6-13/h2-12H,1H3	DPXOMSYGFJNGFP-UHFFFAOYSA-N	COc1ccc(cc1)N2C=Nc3sc(cc3C2=O)c4ccccc4	BroadT	BRD-K54672388	BRD-K54672388-001-05-7	Asinex Ltd.	BAS 06106627			COc1ccc(cc1)-n1cnc2sc(cc2c1=O)-c1ccccc1	InChI=1S/C19H14N2O2S/c1-23-15-9-7-14(8-10-15)21-12-20-18-16(19(21)22)11-17(24-18)13-5-3-2-4-6-13/h2-12H,1H3	DPXOMSYGFJNGFP-UHFFFAOYSA-N	334.077598398							116597
MLS000394574	LSM-44248	SID22407314, BRD-K57826568	2467621	InChI=1S/C24H17F2NO3/c1-15-5-4-6-17(13-15)27-22(28)20-8-3-2-7-19(20)21(23(27)29)14-16-9-11-18(12-10-16)30-24(25)26/h2-14,24H,1H3/b21-14-	WRUTZGXAQVJCAG-STZFKDTASA-N	Cc1cccc(c1)N2C(=O)\C(=C/c3ccc(OC(F)F)cc3)\c4ccccc4C2=O	BroadT	BRD-K57826568	BRD-K57826568-001-06-6	Enamine Ltd.	T5324477			Cc1cccc(c1)N1C(=O)\C(=C/c2ccc(OC(F)F)cc2)c2ccccc2C1=O	InChI=1S/C24H17F2NO3/c1-15-5-4-6-17(13-15)27-22(28)20-8-3-2-7-19(20)21(23(27)29)14-16-9-11-18(12-10-16)30-24(25)26/h2-14,24H,1H3/b21-14-	WRUTZGXAQVJCAG-STZFKDTASA-N	405.117649814							
MLS000071690	LSM-28054	SID844298, BRD-A81998904	646618	InChI=1S/C24H32N6O2/c1-15-6-4-8-29(13-15)22(23-26-27-28-30(23)14-19-7-5-9-32-19)20-12-18-11-16(2)10-17(3)21(18)25-24(20)31/h10-12,15,19,22H,4-9,13-14H2,1-3H3,(H,25,31)	FCMYNNFNLZEDLH-UHFFFAOYSA-N	CC1CCCN(C1)C(c2cc3cc(C)cc(C)c3nc2O)c4nnnn4CC5CCCO5	BroadT	BRD-A81998904	BRD-A81998904-001-05-0	Asinex Ltd.	ASN 03775555			CC1CCCN(C1)C(c1nnnn1CC1CCCO1)c1cc2cc(C)cc(C)c2nc1O	InChI=1S/C24H32N6O2/c1-15-6-4-8-29(13-15)22(23-26-27-28-30(23)14-19-7-5-9-32-19)20-12-18-11-16(2)10-17(3)21(18)25-24(20)31/h10-12,15,19,22H,4-9,13-14H2,1-3H3,(H,25,31)	FCMYNNFNLZEDLH-UHFFFAOYSA-N	436.258674324							116599
BRD-A46589364	LSM-28055			InChI=1S/C15H15F3N2O3/c1-23-10-5-2-4-9(8-10)14(22)20-19-12-7-3-6-11(12)13(21)15(16,17)18/h2,4-5,8,11H,3,6-7H2,1H3,(H,20,22)	QQLZMJUYUNOJOL-UHFFFAOYSA-N	COc1cccc(c1)C(=O)NN=C2CCCC2C(=O)C(F)(F)F	BroadT	BRD-A46589364	BRD-A46589364-001-05-4	InterBioScreen Ltd.	STOCK2S-11348			COc1cccc(c1)C(=O)NN=C1CCCC1C(=O)C(F)(F)F	InChI=1S/C15H15F3N2O3/c1-23-10-5-2-4-9(8-10)14(22)20-19-12-7-3-6-11(12)13(21)15(16,17)18/h2,4-5,8,11H,3,6-7H2,1H3,(H,20,22)	QQLZMJUYUNOJOL-UHFFFAOYSA-N	328.10347696							116600
MLS000555912	LSM-44249	SID17401730, BRD-K17024845	919665	InChI=1S/C17H18FN5O2/c1-2-25-17(24)23-7-5-22(6-8-23)16-15-14(19-10-20-16)12-9-11(18)3-4-13(12)21-15/h3-4,9-10H,2,5-8H2,1H3,(H,19,20)	UGPDILCTUXQXNZ-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)c2[nH]cnc3c4cc(F)ccc4nc23	BroadT	BRD-K17024845	BRD-K17024845-001-06-2	InterBioScreen Ltd.	STOCK2S-09639			CCOC(=O)N1CCN(CC1)c1[nH]cnc2c1nc1ccc(F)cc21	InChI=1S/C17H18FN5O2/c1-2-25-17(24)23-7-5-22(6-8-23)16-15-14(19-10-20-16)12-9-11(18)3-4-13(12)21-15/h3-4,9-10H,2,5-8H2,1H3,(H,19,20)	UGPDILCTUXQXNZ-UHFFFAOYSA-N	343.144453066							
Tuduranine Hydrochloride	LSM-15418	BRD-A55579743	494626	InChI=1S/C18H19NO3/c1-21-15-8-11-5-6-19-14-7-10-3-4-12(20)9-13(10)17(16(11)14)18(15)22-2/h3-4,8-9,14,19-20H,5-7H2,1-2H3	KUECBJOPWMRHEX-UHFFFAOYSA-N	COc1cc2CCNC3Cc4ccc(O)cc4c(c1OC)c23	BroadT	BRD-A55579743	BRD-A55579743-003-09-3	Asinex Ltd.	BAS 00674131		Cl	COc1cc2CCNC3Cc4ccc(O)cc4-c(c1OC)c23.Cl	InChI=1S/C18H19NO3.ClH/c1-21-15-8-11-5-6-19-14-7-10-3-4-12(20)9-13(10)17(16(11)14)18(15)22-2;/h3-4,8-9,14,19-20H,5-7H2,1-2H3;1H	VUYGQGRLDTYGFF-UHFFFAOYSA-N	297.136493478							104060, 104060
BAS 08184503	LSM-28057	SID26667571, SID849857, BRD-A45024610	652367	InChI=1S/C21H23NO8/c1-12-14(20(24)22-15(21(25)27-3)5-7-19(23)26-2)11-17(30-12)13-4-6-16-18(10-13)29-9-8-28-16/h4,6,10-11,15H,5,7-9H2,1-3H3,(H,22,24)	XSKYFPLGUZZMGD-UHFFFAOYSA-N	COC(=O)CCC(NC(=O)c1cc(oc1C)c2ccc3OCCOc3c2)C(=O)OC	BroadT	BRD-A45024610	BRD-A45024610-001-05-5	Asinex Ltd.	BAS 08184503			COC(=O)CCC(NC(=O)c1cc(oc1C)-c1ccc2OCCOc2c1)C(=O)OC	InChI=1S/C21H23NO8/c1-12-14(20(24)22-15(21(25)27-3)5-7-19(23)26-2)11-17(30-12)13-4-6-16-18(10-13)29-9-8-28-16/h4,6,10-11,15H,5,7-9H2,1-3H3,(H,22,24)	XSKYFPLGUZZMGD-UHFFFAOYSA-N	417.142366706							116602
AC1NTVS5	LSM-28058	SID860826, BRD-A79066130	5389452	InChI=1S/C20H21N5O4/c1-26-13-6-7-14(18(10-13)28-3)15-11-16(25-20(21-15)22-23-24-25)12-5-8-17(27-2)19(9-12)29-4/h5-11,16H,1-4H3,(H,21,22,24)	AADORYZVGJDNSZ-UHFFFAOYSA-N	COc1ccc(C2=CC(c3ccc(OC)c(OC)c3)n4nnnc4N2)c(OC)c1	BroadT	BRD-A79066130	BRD-A79066130-001-05-6	InterBioScreen Ltd.	STOCK3S-95206			COc1ccc(C2=CC(c3ccc(OC)c(OC)c3)n3nnnc3N2)c(OC)c1	InChI=1S/C20H21N5O4/c1-26-13-6-7-14(18(10-13)28-3)15-11-16(25-20(21-15)22-23-24-25)12-5-8-17(27-2)19(9-12)29-4/h5-11,16H,1-4H3,(H,21,22,24)	AADORYZVGJDNSZ-UHFFFAOYSA-N	395.159354202							116603
1-(Phenylsulfonyl)tetrahydro-3H-pyrazol-3-one	LSM-28059	SID17411298, BRD-K69456400	1487853	InChI=1S/C9H10N2O3S/c12-9-6-7-11(10-9)15(13,14)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,12)	SFRUXVFIUOZPQP-UHFFFAOYSA-N	O=C1CCN(N1)S(=O)(=O)c2ccccc2	BroadT	BRD-K69456400	BRD-K69456400-001-06-0	Key Organics Ltd.	11A-066			O=C1CCN(N1)S(=O)(=O)c1ccccc1	InChI=1S/C9H10N2O3S/c12-9-6-7-11(10-9)15(13,14)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,12)	SFRUXVFIUOZPQP-UHFFFAOYSA-N	226.04121289							116604
SMR000023719	LSM-28060	SID4242909, SID26724905, BRD-K50547308	3237701	InChI=1S/C25H34N4O3/c1-18-9-13-28(14-10-18)12-6-11-26-24(30)20-17-29(15-16-32-3)25(31)23-22(20)19-7-4-5-8-21(19)27(23)2/h4-5,7-8,17-18H,6,9-16H2,1-3H3,(H,26,30)	MNGYIVCCPRNWTG-UHFFFAOYSA-N	COCCN1C=C(C(=O)NCCCN2CCC(C)CC2)c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K50547308	BRD-K50547308-001-05-2	ChemDiv Inc.	C237-1166			COCCn1cc(C(=O)NCCCN2CCC(C)CC2)c2c3ccccc3n(C)c2c1=O	InChI=1S/C25H34N4O3/c1-18-9-13-28(14-10-18)12-6-11-26-24(30)20-17-29(15-16-32-3)25(31)23-22(20)19-7-4-5-8-21(19)27(23)2/h4-5,7-8,17-18H,6,9-16H2,1-3H3,(H,26,30)	MNGYIVCCPRNWTG-UHFFFAOYSA-N	438.263090988							116605
SMR000206321	LSM-28061	SID17510576, BRD-A44213882	12005268	InChI=1S/C24H23N3O3S/c1-14-3-7-16(8-4-14)26-23(31)25-13-24-12-11-18(30-24)19-20(24)22(29)27(21(19)28)17-9-5-15(2)6-10-17/h3-12,18-20H,13H2,1-2H3,(H2,25,26,31)	UAKHLGWRPMSYGS-UHFFFAOYSA-N	Cc1ccc(NC(=NCC23OC(C=C2)C4C3C(=O)N(C4=O)c5ccc(C)cc5)S)cc1	BroadT	BRD-A44213882	BRD-A44213882-001-06-4	ChemDiv Inc.	C344-0008			Cc1ccc(NC(S)=NCC23OC(C=C2)C2C3C(=O)N(C2=O)c2ccc(C)cc2)cc1	InChI=1S/C24H23N3O3S/c1-14-3-7-16(8-4-14)26-23(31)25-13-24-12-11-18(30-24)19-20(24)22(29)27(21(19)28)17-9-5-15(2)6-10-17/h3-12,18-20H,13H2,1-2H3,(H2,25,26,31)	UAKHLGWRPMSYGS-UHFFFAOYSA-N	433.146012316							116606
ASN 05551358	LSM-15419	BRD-A77073884	653499	InChI=1S/C18H26N6O2/c1-2-15(17-19-20-21-24(17)14-6-3-4-7-14)22-9-11-23(12-10-22)18(25)16-8-5-13-26-16/h5,8,13-15H,2-4,6-7,9-12H2,1H3	CJMISAWAJDLQIT-UHFFFAOYSA-N	CCC(N1CCN(CC1)C(=O)c2occc2)c3nnnn3C4CCCC4	BroadT	BRD-A77073884	BRD-A77073884-003-05-8	Asinex Ltd.	ASN 05551358		Cl	CCC(N1CCN(CC1)C(=O)c1ccco1)c1nnnn1C1CCCC1.Cl	InChI=1S/C18H26N6O2.ClH/c1-2-15(17-19-20-21-24(17)14-6-3-4-7-14)22-9-11-23(12-10-22)18(25)16-8-5-13-26-16;/h5,8,13-15H,2-4,6-7,9-12H2,1H3;1H	GDCADCWOFAXUFG-UHFFFAOYSA-N	358.211724132							104061, 104061
5-[4-(Propan-2-yl)phenyl]-1H-1,2,3,4-tetrazole	LSM-28062	SID3717126, BRD-K33076213	858905	InChI=1S/C10H12N4/c1-7(2)8-3-5-9(6-4-8)10-11-13-14-12-10/h3-7H,1-2H3,(H,11,12,13,14)	SZGJVSUTMOTAIB-UHFFFAOYSA-N	CC(C)c1ccc(cc1)c2nn[nH]n2	BroadT	BRD-K33076213	BRD-K33076213-001-05-8	Enamine Ltd.	T5270252			CC(C)c1ccc(cc1)-c1nn[nH]n1	InChI=1S/C10H12N4/c1-7(2)8-3-5-9(6-4-8)10-11-13-14-12-10/h3-7H,1-2H3,(H,11,12,13,14)	SZGJVSUTMOTAIB-UHFFFAOYSA-N	188.106196424							116607
MLS000032396	LSM-28063	SID853676, BRD-K34809856	656336	InChI=1S/C17H16ClN3O2S/c1-3-21-16(14-8-9-23-11(14)2)19-20-17(21)24-10-15(22)12-4-6-13(18)7-5-12/h4-9H,3,10H2,1-2H3	KNNMQRKLCDJAEQ-UHFFFAOYSA-N	CCn1c(SCC(=O)c2ccc(Cl)cc2)nnc1c3ccoc3C	BroadT	BRD-K34809856	BRD-K34809856-001-07-9	Asinex Ltd.	ASN 05920096			CCn1c(SCC(=O)c2ccc(Cl)cc2)nnc1-c1ccoc1C	InChI=1S/C17H16ClN3O2S/c1-3-21-16(14-8-9-23-11(14)2)19-20-17(21)24-10-15(22)12-4-6-13(18)7-5-12/h4-9H,3,10H2,1-2H3	KNNMQRKLCDJAEQ-UHFFFAOYSA-N	361.065175182							116608
MLS000417305	LSM-28064	SID22401390, BRD-K95721561	5949475	InChI=1S/C22H13ClN4O2S/c23-12-7-8-17-15(10-12)20(22(29)25-17)26-27-21(28)14-11-18(19-6-3-9-30-19)24-16-5-2-1-4-13(14)16/h1-11,25,29H	RSSGUWDFLYKHQB-UHFFFAOYSA-N	Oc1[nH]c2ccc(Cl)cc2c1N=NC(=O)c3cc(nc4ccccc34)c5cccs5	BroadT	BRD-K95721561	BRD-K95721561-001-05-2	Enamine Ltd.	T0519-0527			Oc1[nH]c2ccc(Cl)cc2c1N=NC(=O)c1cc(nc2ccccc12)-c1cccs1	InChI=1S/C22H13ClN4O2S/c23-12-7-8-17-15(10-12)20(22(29)25-17)26-27-21(28)14-11-18(19-6-3-9-30-19)24-16-5-2-1-4-13(14)16/h1-11,25,29H	RSSGUWDFLYKHQB-UHFFFAOYSA-N	432.044774096							
AC1LRAYS	LSM-44250	SID24806393, BRD-K57196907	1365592	InChI=1S/C17H13N3O3S2/c1-23-13-4-2-3-11(9-13)10-14-16(22)20(17(24)25-14)19-15(21)12-5-7-18-8-6-12/h2-10H,1H3,(H,19,21)/b14-10-	XETCJQBQFLVMQJ-UVTDQMKNSA-N	COc1cccc(\C=C\2/SC(=S)N(NC(=O)c3ccncc3)C2=O)c1	BroadT	BRD-K57196907	BRD-K57196907-001-06-4	Asinex Ltd.	BAS 00842020			COc1cccc(\C=C2/SC(=S)N(NC(=O)c3ccncc3)C2=O)c1	InChI=1S/C17H13N3O3S2/c1-23-13-4-2-3-11(9-13)10-14-16(22)20(17(24)25-14)19-15(21)12-5-7-18-8-6-12/h2-10H,1H3,(H,19,21)/b14-10-	XETCJQBQFLVMQJ-UVTDQMKNSA-N	371.039832686							
ENAMINE_001978	LSM-15420	BRD-K58250719	2380298	InChI=1S/C12H14N2O2/c1-8-6-12(13-4-5-15)10-7-9(16)2-3-11(10)14-8/h2-3,6-7,15-16H,4-5H2,1H3,(H,13,14)	UNPDIILTQRDEBJ-UHFFFAOYSA-N	Cc1cc(NCCO)c2cc(O)ccc2n1	BroadT	BRD-K58250719	BRD-K58250719-003-05-4	Enamine Ltd.	T0506-4070		Cl	Cc1cc(NCCO)c2cc(O)ccc2n1.Cl	InChI=1S/C12H14N2O2.ClH/c1-8-6-12(13-4-5-15)10-7-9(16)2-3-11(10)14-8;/h2-3,6-7,15-16H,4-5H2,1H3,(H,13,14);1H	XTHLPSPQLQEVDZ-UHFFFAOYSA-N	218.105527708							104062, 104062
F1820-0392	LSM-28066	BRD-K91716988	7161839	InChI=1S/C17H16N2O5S/c1-3-23-11-6-4-8-13-15(11)19(10-14(20)22-2)17(25-13)18-16(21)12-7-5-9-24-12/h4-9H,3,10H2,1-2H3	PLEUWZDEQUGFQC-UHFFFAOYSA-N	CCOc1cccc2SC(=NC(=O)c3occc3)N(CC(=O)OC)c12	BroadT	BRD-K91716988	BRD-K91716988-001-06-9	Life Chemicals Inc.	F1820-0392			CCOc1cccc2sc(=NC(=O)c3ccco3)n(CC(=O)OC)c12	InChI=1S/C17H16N2O5S/c1-3-23-11-6-4-8-13-15(11)19(10-14(20)22-2)17(25-13)18-16(21)12-7-5-9-24-12/h4-9H,3,10H2,1-2H3	PLEUWZDEQUGFQC-UHFFFAOYSA-N	360.077992322							116611
AC1OATBD	LSM-28067	BRD-A26950990	6809988	InChI=1S/C19H18N4O6/c1-29-16-5-2-14(3-6-16)22-11-13(9-18(22)25)19(26)21-20-10-12-8-15(23(27)28)4-7-17(12)24/h2-8,10,13,24H,9,11H2,1H3,(H,21,26)	BAQAZTAUSADEMZ-UHFFFAOYSA-N	COc1ccc(cc1)N2CC(CC2=O)C(=O)NN=Cc3cc(ccc3O)[N+](=O)[O-]	BroadT	BRD-A26950990	BRD-A26950990-001-05-4	ChemBridge Corporation	6060912			COc1ccc(cc1)N1CC(CC1=O)C(=O)NN=Cc1cc(ccc1O)[N+]([O-])=O	InChI=1S/C19H18N4O6/c1-29-16-5-2-14(3-6-16)22-11-13(9-18(22)25)19(26)21-20-10-12-8-15(23(27)28)4-7-17(12)24/h2-8,10,13,24H,9,11H2,1H3,(H,21,26)	BAQAZTAUSADEMZ-UHFFFAOYSA-N	398.122634336							
F1058-0406	LSM-28068	SID7975581, BRD-K20357318	566593	InChI=1S/C14H20BrNO4S/c1-19-12-10-14(13(20-2)9-11(12)15)21(17,18)16-7-5-3-4-6-8-16/h9-10H,3-8H2,1-2H3	OBMPTPFILZPOKI-UHFFFAOYSA-N	COc1cc(c(OC)cc1Br)S(=O)(=O)N2CCCCCC2	BroadT	BRD-K20357318	BRD-K20357318-001-06-9	ChemBridge Corporation	6472240			COc1cc(c(OC)cc1Br)S(=O)(=O)N1CCCCCC1	InChI=1S/C14H20BrNO4S/c1-19-12-10-14(13(20-2)9-11(12)15)21(17,18)16-7-5-3-4-6-8-16/h9-10H,3-8H2,1-2H3	OBMPTPFILZPOKI-UHFFFAOYSA-N	377.02964142							116613
N-Benzyl-2,3,4,5,6-pentafluorobenzamide	LSM-28069	SID856800, BRD-K19899168	658155	InChI=1S/C14H8F5NO/c15-9-8(10(16)12(18)13(19)11(9)17)14(21)20-6-7-4-2-1-3-5-7/h1-5H,6H2,(H,20,21)	WLOCBVBSMUWLFY-UHFFFAOYSA-N	Fc1c(F)c(F)c(C(=O)NCc2ccccc2)c(F)c1F	BroadT	BRD-K19899168	BRD-K19899168-001-05-6	InterBioScreen Ltd.	STOCK1S-32165			Fc1c(F)c(F)c(C(=O)NCc2ccccc2)c(F)c1F	InChI=1S/C14H8F5NO/c15-9-8(10(16)12(18)13(19)11(9)17)14(21)20-6-7-4-2-1-3-5-7/h1-5H,6H2,(H,20,21)	WLOCBVBSMUWLFY-UHFFFAOYSA-N	301.052604886							116614
MLS000529840	LSM-28070	SID92093129, SID14736804, SID131404744, BRD-K49829829	4617025	InChI=1S/C19H15Cl2N3O2/c20-14-7-8-15(16(21)10-14)17(25)22-19-24-23-18(26-19)13-6-5-11-3-1-2-4-12(11)9-13/h5-10H,1-4H2,(H,22,24,25)	JYYQAILVCFGHGN-UHFFFAOYSA-N	Clc1ccc(C(=O)Nc2oc(nn2)c3ccc4CCCCc4c3)c(Cl)c1	BroadT	BRD-K49829829	BRD-K49829829-001-08-2	Life Chemicals Inc.	F0608-0661			Clc1ccc(C(=O)Nc2nnc(o2)-c2ccc3CCCCc3c2)c(Cl)c1	InChI=1S/C19H15Cl2N3O2/c20-14-7-8-15(16(21)10-14)17(25)22-19-24-23-18(26-19)13-6-5-11-3-1-2-4-12(11)9-13/h5-10H,1-4H2,(H,22,24,25)	JYYQAILVCFGHGN-UHFFFAOYSA-N	387.05413217							116615
ST083890	LSM-28071	SID4240707, BRD-K67777496	709390	InChI=1S/C12H10N2O3S/c15-12(14-8-2-1-3-13-6-8)11-10-9(7-18-11)16-4-5-17-10/h1-3,6-7H,4-5H2,(H,14,15)	AOCJTXXSCQUWJK-UHFFFAOYSA-N	O=C(Nc1cccnc1)c2scc3OCCOc23	BroadT	BRD-K67777496	BRD-K67777496-001-07-4	ChemDiv Inc.	8013-3168			O=C(Nc1cccnc1)c1scc2OCCOc12	InChI=1S/C12H10N2O3S/c15-12(14-8-2-1-3-13-6-8)11-10-9(7-18-11)16-4-5-17-10/h1-3,6-7H,4-5H2,(H,14,15)	AOCJTXXSCQUWJK-UHFFFAOYSA-N	262.04121289							116616
MLS000027293	LSM-28072	SID844932, BRD-K39783031	647262	InChI=1S/C20H26N4O2/c1-15-6-8-16(9-7-15)17-14-21-20(23(17)2)22-18(25)10-11-19(26)24-12-4-3-5-13-24/h6-9,14H,3-5,10-13H2,1-2H3,(H,21,22,25)	GJBJJTZFOJOTTC-UHFFFAOYSA-N	Cc1ccc(cc1)c2cnc(NC(=O)CCC(=O)N3CCCCC3)n2C	BroadT	BRD-K39783031	BRD-K39783031-001-05-3	Asinex Ltd.	BAS 11101837			Cc1ccc(cc1)-c1cnc(NC(=O)CCC(=O)N2CCCCC2)n1C	InChI=1S/C20H26N4O2/c1-15-6-8-16(9-7-15)17-14-21-20(23(17)2)22-18(25)10-11-19(26)24-12-4-3-5-13-24/h6-9,14H,3-5,10-13H2,1-2H3,(H,21,22,25)	GJBJJTZFOJOTTC-UHFFFAOYSA-N	354.205576112							116617
MLS000392962	LSM-28073	SID24791386, BRD-K03118590	5961600	InChI=1S/C18H11BrF3N5O2/c19-9-5-6-11-10(7-9)15(16(29)23-11)26-25-14(28)8-27-13-4-2-1-3-12(13)24-17(27)18(20,21)22/h1-7,23,29H,8H2	UCQHXQGMILVZKU-UHFFFAOYSA-N	Oc1[nH]c2ccc(Br)cc2c1N=NC(=O)Cn3c(nc4ccccc34)C(F)(F)F	BroadT	BRD-K03118590	BRD-K03118590-001-07-3	Enamine Ltd.	T5228792			Oc1[nH]c2ccc(Br)cc2c1N=NC(=O)Cn1c(nc2ccccc12)C(F)(F)F	InChI=1S/C18H11BrF3N5O2/c19-9-5-6-11-10(7-9)15(16(29)23-11)26-25-14(28)8-27-13-4-2-1-3-12(13)24-17(27)18(20,21)22/h1-7,23,29H,8H2	UCQHXQGMILVZKU-UHFFFAOYSA-N	465.004821842							
MLS000110252	LSM-28074	SID7977835, BRD-K33623329	719759	InChI=1S/C17H19ClN2O2/c1-12-8-4-5-9-13(12)20-16(21)14(18)15(17(20)22)19-10-6-2-3-7-11-19/h4-5,8-9H,2-3,6-7,10-11H2,1H3	RPUTUZDJJXOQOU-UHFFFAOYSA-N	Cc1ccccc1N2C(=O)C(=C(N3CCCCCC3)C2=O)Cl	BroadT	BRD-K33623329	BRD-K33623329-001-05-8	ChemBridge Corporation	6137704			Cc1ccccc1N1C(=O)C(Cl)=C(N2CCCCCC2)C1=O	InChI=1S/C17H19ClN2O2/c1-12-8-4-5-9-13(12)20-16(21)14(18)15(17(20)22)19-10-6-2-3-7-11-19/h4-5,8-9H,2-3,6-7,10-11H2,1H3	RPUTUZDJJXOQOU-UHFFFAOYSA-N	318.113505578							116619
AC1M7DGU	LSM-28075	SID26670254, BRD-K51730616	2440093	InChI=1S/C20H21N3O3S2/c1-20(2,3)14-6-4-5-7-15(14)21-18(24)13-8-9-16-17(12-13)27-19-22-28(25,26)11-10-23(16)19/h4-9,12H,10-11H2,1-3H3,(H,21,24)	OZXAFFBHAJIEFV-UHFFFAOYSA-N	CC(C)(C)c1ccccc1NC(=O)c2ccc3N4CCS(=O)(=O)N=C4Sc3c2	BroadT	BRD-K51730616	BRD-K51730616-001-05-0	Enamine Ltd.	T5305980			CC(C)(C)c1ccccc1NC(=O)c1ccc2N3CCS(=O)(=O)N=C3Sc2c1	InChI=1S/C20H21N3O3S2/c1-20(2,3)14-6-4-5-7-15(14)21-18(24)13-8-9-16-17(12-13)27-19-22-28(25,26)11-10-23(16)19/h4-9,12H,10-11H2,1-3H3,(H,21,24)	OZXAFFBHAJIEFV-UHFFFAOYSA-N	415.102432942							116620
ST50868132	LSM-28076	SID4265264, BRD-K98377160	1246094	InChI=1S/C18H20N4OS/c1-4-15-13(3)24-10-16(15)17(23)20-18-19-11-22(21-18)9-14-7-5-6-12(2)8-14/h5-8,10-11H,4,9H2,1-3H3,(H,20,21,23)	DJYYBSQADFPZOV-UHFFFAOYSA-N	CCc1c(C)scc1C(=O)Nc2ncn(Cc3cccc(C)c3)n2	BroadT	BRD-K98377160	BRD-K98377160-001-05-5	ChemBridge Corporation	7946364			CCc1c(C)scc1C(=O)Nc1ncn(Cc2cccc(C)c2)n1	InChI=1S/C18H20N4OS/c1-4-15-13(3)24-10-16(15)17(23)20-18-19-11-22(21-18)9-14-7-5-6-12(2)8-14/h5-8,10-11H,4,9H2,1-3H3,(H,20,21,23)	DJYYBSQADFPZOV-UHFFFAOYSA-N	340.13578199							116621
AC1LY0CO	LSM-44251	SID14727652, BRD-K75571204	1811447	InChI=1S/C20H18O2/c1-22-18-12-13-19-17(14-18)11-10-16(20(19)21)9-5-8-15-6-3-2-4-7-15/h2-9,12-14H,10-11H2,1H3/b8-5+,16-9+	MLILABITTOVKMW-ZCPHBQKFSA-N	COc1ccc2C(=O)\C(=C\C=C\c3ccccc3)\CCc2c1	BroadT	BRD-K75571204	BRD-K75571204-001-05-8	Specs	AI-211/12451003			COc1ccc2C(=O)\C(CCc2c1)=C\C=C\c1ccccc1	InChI=1S/C20H18O2/c1-22-18-12-13-19-17(14-18)11-10-16(20(19)21)9-5-8-15-6-3-2-4-7-15/h2-9,12-14H,10-11H2,1H3/b8-5+,16-9+	MLILABITTOVKMW-ZCPHBQKFSA-N	290.130679816							
ST50487068	LSM-28078	SID14721260, BRD-K41916532	2927998	InChI=1S/C21H23N3O/c25-21(23-14-8-1-2-9-15-23)24-19-13-7-6-12-18(19)22-20(24)16-17-10-4-3-5-11-17/h3-7,10-13H,1-2,8-9,14-16H2	VJWIPWNYNSKZMP-UHFFFAOYSA-N	O=C(N1CCCCCC1)n2c(Cc3ccccc3)nc4ccccc24	BroadT	BRD-K41916532	BRD-K41916532-001-05-9	Asinex Ltd.	BAS 04999501			O=C(N1CCCCCC1)n1c(Cc2ccccc2)nc2ccccc12	InChI=1S/C21H23N3O/c25-21(23-14-8-1-2-9-15-23)24-19-13-7-6-12-18(19)22-20(24)16-17-10-4-3-5-11-17/h3-7,10-13H,1-2,8-9,14-16H2	VJWIPWNYNSKZMP-UHFFFAOYSA-N	333.184112386							116623
AC1N8LIB	LSM-28079	SID24784477, BRD-K78926565	4345669	InChI=1S/C19H30ClN3O2S/c1-14(2)22-9-7-16(8-10-22)23(11-12-24-3)19(26)21-15-5-6-18(25-4)17(20)13-15/h5-6,13-14,16H,7-12H2,1-4H3,(H,21,26)	SRTTYBAVYDRRIC-UHFFFAOYSA-N	COCCN(C1CCN(CC1)C(C)C)C(=Nc2ccc(OC)c(Cl)c2)S	BroadT	BRD-K78926565	BRD-K78926565-001-05-4	ChemDiv Inc.	K786-5282			COCCN(C1CCN(CC1)C(C)C)C(S)=Nc1ccc(OC)c(Cl)c1	InChI=1S/C19H30ClN3O2S/c1-14(2)22-9-7-16(8-10-22)23(11-12-24-3)19(26)21-15-5-6-18(25-4)17(20)13-15/h5-6,13-14,16H,7-12H2,1-4H3,(H,21,26)	SRTTYBAVYDRRIC-UHFFFAOYSA-N	399.17472563							116624
MLS000064358	LSM-28080	SID4260784, BRD-K87556527	945223	InChI=1S/C16H20FN3O/c1-10(2)4-9-14-11(3)18-16(20-15(14)21)19-13-7-5-12(17)6-8-13/h5-8,10H,4,9H2,1-3H3,(H2,18,19,20,21)	VGLRQUXOPQEKQZ-UHFFFAOYSA-N	CC(C)CCc1c(C)nc(Nc2ccc(F)cc2)nc1O	BroadT	BRD-K87556527	BRD-K87556527-001-05-5	ChemBridge Corporation	7791880			CC(C)CCc1c(C)nc(Nc2ccc(F)cc2)nc1O	InChI=1S/C16H20FN3O/c1-10(2)4-9-14-11(3)18-16(20-15(14)21)19-13-7-5-12(17)6-8-13/h5-8,10H,4,9H2,1-3H3,(H2,18,19,20,21)	VGLRQUXOPQEKQZ-UHFFFAOYSA-N	289.15904049							116625
AC1LFMGK	LSM-28081	SID3716184, BRD-K98700383	780382	InChI=1S/C16H16N2O/c1-19-14-9-7-13(8-10-14)17-16-11-6-12-4-2-3-5-15(12)18-16/h2-5,7-10H,6,11H2,1H3,(H,17,18)	JSPWKXVREJVMOS-UHFFFAOYSA-N	COc1ccc(NC2=Nc3ccccc3CC2)cc1	BroadT	BRD-K98700383	BRD-K98700383-001-04-2	Enamine Ltd.	T0503-5901			COc1ccc(cc1)\N=C1\CCc2ccccc2N1	InChI=1S/C16H16N2O/c1-19-14-9-7-13(8-10-14)17-16-11-6-12-4-2-3-5-15(12)18-16/h2-5,7-10H,6,11H2,1H3,(H,17,18)	JSPWKXVREJVMOS-UHFFFAOYSA-N	252.126263152							116626
AC1MERPE	LSM-28082	BRD-A69785207	2908001	InChI=1S/C20H18ClN3O5S/c1-28-16-8-12(5-6-15(16)29-11-13-3-2-4-14(21)7-13)10-22-24-20-23-19(27)17(30-20)9-18(25)26/h2-8,10,17H,9,11H2,1H3,(H,25,26)(H,23,24,27)	GZWPZEFQPQNJDX-UHFFFAOYSA-N	COc1cc(C=NNC2=NC(=O)C(CC(=O)O)S2)ccc1OCc3cccc(Cl)c3	BroadT	BRD-A69785207	BRD-A69785207-001-06-9	ChemBridge Corporation	6644642			COc1cc(C=NNC2=NC(=O)C(CC(O)=O)S2)ccc1OCc1cccc(Cl)c1	InChI=1S/C20H18ClN3O5S/c1-28-16-8-12(5-6-15(16)29-11-13-3-2-4-14(21)7-13)10-22-24-20-23-19(27)17(30-20)9-18(25)26/h2-8,10,17H,9,11H2,1H3,(H,25,26)(H,23,24,27)	GZWPZEFQPQNJDX-UHFFFAOYSA-N	447.065569106							116627
F1555-0025	LSM-28083	SID846110, BRD-K95841402	648482	InChI=1S/C15H16N2O3/c1-18-13-5-10-3-4-17-9-20-8-11(7-16)15(17)12(10)6-14(13)19-2/h5-6H,3-4,8-9H2,1-2H3	RLSMASSECQDNRN-UHFFFAOYSA-N	COc1cc2CCN3COCC(=C3c2cc1OC)C#N	BroadT	BRD-K95841402	BRD-K95841402-001-07-7	Asinex Ltd.	BAS 06503199			COc1cc2CCN3COCC(C#N)=C3c2cc1OC	InChI=1S/C15H16N2O3/c1-18-13-5-10-3-4-17-9-20-8-11(7-16)15(17)12(10)6-14(13)19-2/h5-6H,3-4,8-9H2,1-2H3	RLSMASSECQDNRN-UHFFFAOYSA-N	272.116092392							116628
CHEMBL90585	LSM-44252	SID26730250, BRD-K97213975	5702471	InChI=1S/C16H13NO/c18-16-14(11-12-7-9-17-10-8-12)6-5-13-3-1-2-4-15(13)16/h1-4,7-11H,5-6H2/b14-11+	BMJBYWJCQGXHFI-SDNWHVSQSA-N	O=C1\C(=C\c2ccncc2)\CCc3ccccc13	BroadT	BRD-K97213975	BRD-K97213975-001-05-8	Maybridge	S 12909			O=C1c2ccccc2CC\C1=C/c1ccncc1	InChI=1S/C16H13NO/c18-16-14(11-12-7-9-17-10-8-12)6-5-13-3-1-2-4-15(13)16/h1-4,7-11H,5-6H2/b14-11+	BMJBYWJCQGXHFI-SDNWHVSQSA-N	235.099714046							
SMR000023434	LSM-28085	SID4249884, BRD-K23347623	3243766	InChI=1S/C16H14N2O3/c1-2-11-5-7-12(8-6-11)17-16(19)13-10-15(21-18-13)14-4-3-9-20-14/h3-10H,2H2,1H3,(H,17,19)	UCQATMAWCAUGQE-UHFFFAOYSA-N	CCc1ccc(NC(=O)c2cc(on2)c3occc3)cc1	BroadT	BRD-K23347623	BRD-K23347623-001-05-9	ChemDiv Inc.	C226-1770			CCc1ccc(NC(=O)c2cc(on2)-c2ccco2)cc1	InChI=1S/C16H14N2O3/c1-2-11-5-7-12(8-6-11)17-16(19)13-10-15(21-18-13)14-4-3-9-20-14/h3-10H,2H2,1H3,(H,17,19)	UCQATMAWCAUGQE-UHFFFAOYSA-N	282.100442328							116630
MLS000044599	LSM-28086	SID4245420, BRD-A36352187	3239893	InChI=1S/C24H35N3O4/c1-2-31-24(30)27-15-13-20(14-16-27)25-23(29)21(17-18-9-5-3-6-10-18)26-22(28)19-11-7-4-8-12-19/h3,5-6,9-10,19-21H,2,4,7-8,11-17H2,1H3,(H,25,29)(H,26,28)	DLHXECUKFCNUOI-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)NC(=O)C(Cc2ccccc2)NC(=O)C3CCCCC3	BroadT	BRD-A36352187	BRD-A36352187-001-06-2	ChemDiv Inc.	C155-0302			CCOC(=O)N1CCC(CC1)NC(=O)C(Cc1ccccc1)NC(=O)C1CCCCC1	InChI=1S/C24H35N3O4/c1-2-31-24(30)27-15-13-20(14-16-27)25-23(29)21(17-18-9-5-3-6-10-18)26-22(28)19-11-7-4-8-12-19/h3,5-6,9-10,19-21H,2,4,7-8,11-17H2,1H3,(H,25,29)(H,26,28)	DLHXECUKFCNUOI-UHFFFAOYSA-N	429.26275663							116631
F1872-0528	LSM-28087	SID51089140, BRD-K16420971	8487439	InChI=1S/C19H19N3O2S/c1-24-17-9-7-16(8-10-17)21-18(23)14-25-19-20-11-12-22(19)13-15-5-3-2-4-6-15/h2-12H,13-14H2,1H3,(H,21,23)	KRKKIFKFHCKQKL-UHFFFAOYSA-N	COc1ccc(NC(=O)CSc2nccn2Cc3ccccc3)cc1	BroadT	BRD-K16420971	BRD-K16420971-001-05-1	Life Chemicals Inc.	F1872-0528			COc1ccc(NC(=O)CSc2nccn2Cc2ccccc2)cc1	InChI=1S/C19H19N3O2S/c1-24-17-9-7-16(8-10-17)21-18(23)14-25-19-20-11-12-22(19)13-15-5-3-2-4-6-15/h2-12H,13-14H2,1H3,(H,21,23)	KRKKIFKFHCKQKL-UHFFFAOYSA-N	353.119797568							116632
MLS000091984	LSM-28088	SID4249582, BRD-K38276256	3243515	InChI=1S/C25H30N4O4/c1-31-18-8-9-23(32-2)22(16-18)28-24-17-20(19-6-3-4-7-21(19)27-24)25(30)26-10-5-11-29-12-14-33-15-13-29/h3-4,6-9,16-17H,5,10-15H2,1-2H3,(H,26,30)(H,27,28)	OZCDRGAPQAFKIS-UHFFFAOYSA-N	COc1ccc(OC)c(Nc2cc(C(=O)NCCCN3CCOCC3)c4ccccc4n2)c1	BroadT	BRD-K38276256	BRD-K38276256-001-05-7	ChemDiv Inc.	C387-1214			COc1ccc(OC)c(Nc2cc(C(=O)NCCCN3CCOCC3)c3ccccc3n2)c1	InChI=1S/C25H30N4O4/c1-31-18-8-9-23(32-2)22(16-18)28-24-17-20(19-6-3-4-7-21(19)27-24)25(30)26-10-5-11-29-12-14-33-15-13-29/h3-4,6-9,16-17H,5,10-15H2,1-2H3,(H,26,30)(H,27,28)	OZCDRGAPQAFKIS-UHFFFAOYSA-N	450.22670548							116633
MLS000549968	LSM-28089	BRD-K54372191	1008756	InChI=1S/C17H13ClN2O3S/c18-16-9-5-4-8-15(16)17-11-10-13(23-17)12-19-20-24(21,22)14-6-2-1-3-7-14/h1-12,20H	NMHUJRNAZBKVGE-UHFFFAOYSA-N	Clc1ccccc1c2oc(C=NNS(=O)(=O)c3ccccc3)cc2	BroadT	BRD-K54372191	BRD-K54372191-001-05-1	Specs	AK-968/40642213			Clc1ccccc1-c1ccc(C=NNS(=O)(=O)c2ccccc2)o1	InChI=1S/C17H13ClN2O3S/c18-16-9-5-4-8-15(16)17-11-10-13(23-17)12-19-20-24(21,22)14-6-2-1-3-7-14/h1-12,20H	NMHUJRNAZBKVGE-UHFFFAOYSA-N	360.033540696							116634
Methyl (5-hydroxy-1-phenyl-1H-pyrazol-3-yl)acetate	LSM-28090	BRD-K43671236	715399	InChI=1S/C12H12N2O3/c1-17-12(16)8-9-7-11(15)14(13-9)10-5-3-2-4-6-10/h2-7,15H,8H2,1H3	XRRFUSZYFACUAU-UHFFFAOYSA-N	COC(=O)Cc1cc(O)n(n1)c2ccccc2	BroadT	BRD-K43671236	BRD-K43671236-001-07-3	ChemBridge Corporation	7516043			COC(=O)Cc1cc(O)n(n1)-c1ccccc1	InChI=1S/C12H12N2O3/c1-17-12(16)8-9-7-11(15)14(13-9)10-5-3-2-4-6-10/h2-7,15H,8H2,1H3	XRRFUSZYFACUAU-UHFFFAOYSA-N	232.084792264							
MLS000043197	LSM-28091	SID24838713, SID4250702, BRD-K68830125	3244473	InChI=1S/C21H23BrN2O5/c1-27-17-6-8-19(9-7-17)29-15-21(26)24-12-10-23(11-13-24)20(25)14-28-18-4-2-16(22)3-5-18/h2-9H,10-15H2,1H3	GZQNRHADMHEPNR-UHFFFAOYSA-N	COc1ccc(OCC(=O)N2CCN(CC2)C(=O)COc3ccc(Br)cc3)cc1	BroadT	BRD-K68830125	BRD-K68830125-001-05-3	ChemDiv Inc.	5607-0384			COc1ccc(OCC(=O)N2CCN(CC2)C(=O)COc2ccc(Br)cc2)cc1	InChI=1S/C21H23BrN2O5/c1-27-17-6-8-19(9-7-17)29-15-21(26)24-12-10-23(11-13-24)20(25)14-28-18-4-2-16(22)3-5-18/h2-9H,10-15H2,1H3	GZQNRHADMHEPNR-UHFFFAOYSA-N	462.079034456							116636
MLS000862541	LSM-28092	SID22416671, BRD-A86381030	2966178	InChI=1S/C20H15ClN4O/c21-16-11-15(20(26)19-14(16)6-4-10-24-19)18(13-5-3-8-22-12-13)25-17-7-1-2-9-23-17/h1-12,18,26H,(H,23,25)	ZQQXRNUVLBLBNW-UHFFFAOYSA-N	Oc1c(cc(Cl)c2cccnc12)C(Nc3ccccn3)c4cccnc4	BroadT	BRD-A86381030	BRD-A86381030-001-10-1	ChemBridge Corporation	7925818			Oc1c(cc(Cl)c2cccnc12)C(Nc1ccccn1)c1cccnc1	InChI=1S/C20H15ClN4O/c21-16-11-15(20(26)19-14(16)6-4-10-24-19)18(13-5-3-8-22-12-13)25-17-7-1-2-9-23-17/h1-12,18,26H,(H,23,25)	ZQQXRNUVLBLBNW-UHFFFAOYSA-N	362.09343885							116637
BAS 07005701	LSM-28093	SID14722297, BRD-K83100452	933405	InChI=1S/C13H11N5O/c1-18-16-13(15-17-18)14-12(19)11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3,(H,14,16,19)	IUDRRORFXYRGME-UHFFFAOYSA-N	Cn1nnc(NC(=O)c2ccc3ccccc3c2)n1	BroadT	BRD-K83100452	BRD-K83100452-001-05-5	Asinex Ltd.	BAS 07005701			Cn1nnc(NC(=O)c2ccc3ccccc3c2)n1	InChI=1S/C13H11N5O/c1-18-16-13(15-17-18)14-12(19)11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3,(H,14,16,19)	IUDRRORFXYRGME-UHFFFAOYSA-N	253.096360022							116638
CBDIVE_007969	LSM-15518	BRD-K71694566	658525	InChI=1S/C27H34N4O4/c32-26(9-10-29-11-15-34-16-12-29)28-23-8-7-22-6-5-21-3-1-2-4-24(21)31(25(22)19-23)27(33)20-30-13-17-35-18-14-30/h1-4,7-8,19H,5-6,9-18,20H2,(H,28,32)	ODJLZTDZFXQOIH-UHFFFAOYSA-N	O=C(CCN1CCOCC1)Nc2ccc3CCc4ccccc4N(C(=O)CN5CCOCC5)c3c2	BroadT	BRD-K71694566	BRD-K71694566-311-05-7	InterBioScreen Ltd.	STOCK1S-60559		O.Cl	O=C(CCN1CCOCC1)Nc1ccc2CCc3ccccc3N(C(=O)CN3CCOCC3)c2c1.O.Cl	InChI=1S/C27H34N4O4.ClH.H2O/c32-26(9-10-29-11-15-34-16-12-29)28-23-8-7-22-6-5-21-3-1-2-4-24(21)31(25(22)19-23)27(33)20-30-13-17-35-18-14-30;;/h1-4,7-8,19H,5-6,9-18,20H2,(H,28,32);1H;1H2	IPFBONZKZNGCOE-UHFFFAOYSA-N	478.258005608							104158, 104158
SMR000026702	LSM-28094	SID24838595, SID4251555, BRD-K53493250	3245223	InChI=1S/C24H29N3O6S/c1-16-6-9-20(10-7-16)27(34(29,30)24-17(2)26-33-18(24)3)15-23(28)25-13-12-19-8-11-21(31-4)22(14-19)32-5/h6-11,14H,12-13,15H2,1-5H3,(H,25,28)	QETTZFHQNRGXBQ-UHFFFAOYSA-N	COc1ccc(CCNC(=O)CN(c2ccc(C)cc2)S(=O)(=O)c3c(C)onc3C)cc1OC	BroadT	BRD-K53493250	BRD-K53493250-001-05-4	ChemDiv Inc.	C436-2087			COc1ccc(CCNC(=O)CN(c2ccc(C)cc2)S(=O)(=O)c2c(C)noc2C)cc1OC	InChI=1S/C24H29N3O6S/c1-16-6-9-20(10-7-16)27(34(29,30)24-17(2)26-33-18(24)3)15-23(28)25-13-12-19-8-11-21(31-4)22(14-19)32-5/h6-11,14H,12-13,15H2,1-5H3,(H,25,28)	QETTZFHQNRGXBQ-UHFFFAOYSA-N	487.177706368							116639
PD-173074	LSM-1026	PD-173074	1401	InChI=1S/C28H41N7O3/c1-8-35(9-2)13-11-10-12-29-26-30-18-20-16-23(19-14-21(37-6)17-22(15-19)38-7)25(31-24(20)32-26)33-27(36)34-28(3,4)5/h14-18H,8-13H2,1-7H3,(H3,29,30,31,32,33,34,36)	DXCUKNQANPLTEJ-UHFFFAOYSA-N	CCN(CC)CCCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)c3cc(OC)cc(OC)c3	BroadT	BRD-K97764662	BRD-K97764662-001-06-6	Sigma-Aldrich	P2499			CCN(CC)CCCCNc1ncc2cc(-c3cc(OC)cc(OC)c3)c(NC(=O)NC(C)(C)C)nc2n1	InChI=1S/C28H41N7O3/c1-8-35(9-2)13-11-10-12-29-26-30-18-20-16-23(19-14-21(37-6)17-22(15-19)38-7)25(31-24(20)32-26)33-27(36)34-28(3,4)5/h14-18H,8-13H2,1-7H3,(H3,29,30,31,32,33,34,36)	DXCUKNQANPLTEJ-UHFFFAOYSA-N	523.327088242							63448
SMR000153947	LSM-28095	SID14745129, BRD-K80718925	4878538	InChI=1S/C16H15Cl2N3O2S/c1-23-11-4-3-10-12(17)15(24-14(10)13(11)18)16(22)20-5-2-7-21-8-6-19-9-21/h3-4,6,8-9H,2,5,7H2,1H3,(H,20,22)	BPJWQGNYCMLEST-UHFFFAOYSA-N	COc1ccc2c(Cl)c(sc2c1Cl)C(=O)NCCCn3ccnc3	BroadT	BRD-K80718925	BRD-K80718925-001-05-6	Enamine Ltd.	T5311190			COc1ccc2c(Cl)c(sc2c1Cl)C(=O)NCCCn1ccnc1	InChI=1S/C16H15Cl2N3O2S/c1-23-11-4-3-10-12(17)15(24-14(10)13(11)18)16(22)20-5-2-7-21-8-6-19-9-21/h3-4,6,8-9H,2,5,7H2,1H3,(H,20,22)	BPJWQGNYCMLEST-UHFFFAOYSA-N	383.02620286							116640
AC1MWMTN	LSM-28096	BRD-K11896839	3776711	InChI=1S/C15H11ClN4/c16-12-5-3-4-11(8-12)9-19-20-15-13-6-1-2-7-14(13)17-10-18-15/h1-10H,(H,17,18,20)	NMIGSHVBGMMIAN-UHFFFAOYSA-N	Clc1cccc(C=NNc2ncnc3ccccc23)c1	BroadT	BRD-K11896839	BRD-K11896839-001-06-7	Key Organics Ltd.	8E-907			Clc1cccc(C=NNc2ncnc3ccccc23)c1	InChI=1S/C15H11ClN4/c16-12-5-3-4-11(8-12)9-19-20-15-13-6-1-2-7-14(13)17-10-18-15/h1-10H,(H,17,18,20)	NMIGSHVBGMMIAN-UHFFFAOYSA-N	282.067224102							116641
2-(Pentan-3-yl)-1H-imidazole	LSM-28097	SID26665091, BRD-K07846767	241106	InChI=1S/C8H14N2/c1-3-7(4-2)8-9-5-6-10-8/h5-7H,3-4H2,1-2H3,(H,9,10)	FPLOWPOUHNRUMN-UHFFFAOYSA-N	CCC(CC)c1ncc[nH]1	BroadT	BRD-K07846767	BRD-K07846767-001-05-6	National Cancer Institute Chemotherapeutic Agents Repository	48231			CCC(CC)c1ncc[nH]1	InChI=1S/C8H14N2/c1-3-7(4-2)8-9-5-6-10-8/h5-7H,3-4H2,1-2H3,(H,9,10)	FPLOWPOUHNRUMN-UHFFFAOYSA-N	138.115698468							116642
CHEMBL1330833	LSM-28098	SID24791726, BRD-K71898984	4122371	InChI=1S/C14H12N4O5S2/c15-25(22,23)12-6-2-4-10(8-12)16-14(24)17-13(19)9-3-1-5-11(7-9)18(20)21/h1-8H,(H2,15,22,23)(H2,16,17,19,24)	IULSTWYXVCZOLW-UHFFFAOYSA-N	NS(=O)(=O)c1cccc(NC(=S)NC(=O)c2cccc(c2)[N+](=O)[O-])c1	BroadT	BRD-K71898984	BRD-K71898984-001-05-5	Enamine Ltd.	T0508-1456			NS(=O)(=O)c1cccc(NC(=S)NC(=O)c2cccc(c2)[N+]([O-])=O)c1	InChI=1S/C14H12N4O5S2/c15-25(22,23)12-6-2-4-10(8-12)16-14(24)17-13(19)9-3-1-5-11(7-9)18(20)21/h1-8H,(H2,15,22,23)(H2,16,17,19,24)	IULSTWYXVCZOLW-UHFFFAOYSA-N	380.024910904							116643
T0509-1931	LSM-28099	SID22402700, BRD-K78049473	2357498	InChI=1S/C19H12ClNO5S/c20-17-11-3-1-2-4-15(11)27-18(17)19(24)26-8-13(22)10-5-6-14-12(7-10)21-16(23)9-25-14/h1-7H,8-9H2,(H,21,23)	CQFMERDFIJAWPC-UHFFFAOYSA-N	Clc1c(sc2ccccc12)C(=O)OCC(=O)c3ccc4OCC(=O)Nc4c3	BroadT	BRD-K78049473	BRD-K78049473-001-06-4	Enamine Ltd.	T0509-1931			Clc1c(sc2ccccc12)C(=O)OCC(=O)c1ccc2OCC(=O)Nc2c1	InChI=1S/C19H12ClNO5S/c20-17-11-3-1-2-4-15(11)27-18(17)19(24)26-8-13(22)10-5-6-14-12(7-10)21-16(23)9-25-14/h1-7H,8-9H2,(H,21,23)	CQFMERDFIJAWPC-UHFFFAOYSA-N	401.012470894							116644
2-(3-Nitrophenyl)-4H-3,1-benzoxazin-4-one	LSM-28100	SID49642152, BRD-K11205484	294660	InChI=1S/C14H8N2O4/c17-14-11-6-1-2-7-12(11)15-13(20-14)9-4-3-5-10(8-9)16(18)19/h1-8H	WKYQIWUAPDQQRV-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C2=Nc3ccccc3C(=O)O2	BroadT	BRD-K11205484	BRD-K11205484-001-05-1	Asinex Ltd.	BAS 00293981			[O-][N+](=O)c1cccc(c1)-c1nc2ccccc2c(=O)o1	InChI=1S/C14H8N2O4/c17-14-11-6-1-2-7-12(11)15-13(20-14)9-4-3-5-10(8-9)16(18)19/h1-8H	WKYQIWUAPDQQRV-UHFFFAOYSA-N	268.048406756							116645
N-[(4-Methyl-5-phenyldiazenyl-imidazol-2-ylidene)amino]aniline	LSM-28101	SID26664306, BRD-K64811139	5355589	InChI=1S/C16H14N6/c1-12-15(21-19-13-8-4-2-5-9-13)18-16(17-12)22-20-14-10-6-3-7-11-14/h2-11H,1H3,(H,17,18)	JLRWIRBFDUKCMN-UHFFFAOYSA-N	Cc1[nH]c(N=Nc2ccccc2)nc1N=Nc3ccccc3	BroadT	BRD-K64811139	BRD-K64811139-001-09-3	National Cancer Institute Chemotherapeutic Agents Repository	40749			Cc1[nH]c(N=Nc2ccccc2)nc1N=Nc1ccccc1	InChI=1S/C16H14N6/c1-12-15(21-19-13-8-4-2-5-9-13)18-16(17-12)22-20-14-10-6-3-7-11-14/h2-11H,1H3,(H,17,18)	JLRWIRBFDUKCMN-UHFFFAOYSA-N	290.127994508							
MLS000374708	LSM-28102	SID22406345, SID89852031, BRD-K07908552	6283541	InChI=1S/C24H14ClN5O4/c25-18-7-3-1-6-15(18)21-12-16(14-5-2-4-8-19(14)26-21)23(31)29-28-22-17-11-13(30(33)34)9-10-20(17)27-24(22)32/h1-12,27,32H	LURWMMNYAXSHCC-UHFFFAOYSA-N	Oc1[nH]c2ccc(cc2c1N=NC(=O)c3cc(nc4ccccc34)c5ccccc5Cl)[N+](=O)[O-]	BroadT	BRD-K07908552	BRD-K07908552-001-07-9	Enamine Ltd.	T0516-1413			Oc1[nH]c2ccc(cc2c1N=NC(=O)c1cc(nc2ccccc12)-c1ccccc1Cl)[N+]([O-])=O	InChI=1S/C24H14ClN5O4/c25-18-7-3-1-6-15(18)21-12-16(14-5-2-4-8-19(14)26-21)23(31)29-28-22-17-11-13(30(33)34)9-10-20(17)27-24(22)32/h1-12,27,32H	LURWMMNYAXSHCC-UHFFFAOYSA-N	471.073431688							
ST093914	LSM-15576	BRD-K37800423	1300118	InChI=1S/C18H21N3O2S2/c1-11-17(25-12(2)20-11)14-10-24-18(21-14)19-8-7-13-5-6-15(22-3)16(9-13)23-4/h5-6,9-10H,7-8H2,1-4H3,(H,19,21)	VQYVCSPBERHZRU-UHFFFAOYSA-N	COc1ccc(CCNc2nc(cs2)c3sc(C)nc3C)cc1OC	BroadT	BRD-K37800423	BRD-K37800423-034-05-4	ChemBridge Corporation	7885836		OC(=O)C(=O)O	COc1ccc(CCNc2nc(cs2)-c2sc(C)nc2C)cc1OC.OC(=O)C(=O)O	InChI=1S/C18H21N3O2S2.C2H2O4/c1-11-17(25-12(2)20-11)14-10-24-18(21-14)19-8-7-13-5-6-15(22-3)16(9-13)23-4;3-1(4)2(5)6/h5-6,9-10H,7-8H2,1-4H3,(H,19,21);(H,3,4)(H,5,6)	FTWIPVPSEKMBOF-UHFFFAOYSA-N	375.107518322							104212, 104212
N-Bicyclo[2.2.1]hept-2-yl-3-bromo-4-methoxy-benzenesulfonamide	LSM-28103	SID49644979, BRD-A04139106	2893758	InChI=1S/C14H18BrNO3S/c1-19-14-5-4-11(8-12(14)15)20(17,18)16-13-7-9-2-3-10(13)6-9/h4-5,8-10,13,16H,2-3,6-7H2,1H3	JRVCVQJAFKBAPN-UHFFFAOYSA-N	COc1ccc(cc1Br)S(=O)(=O)NC2CC3CCC2C3	BroadT	BRD-A04139106	BRD-A04139106-001-06-9	Asinex Ltd.	BAS 02173169			COc1ccc(cc1Br)S(=O)(=O)NC1CC2CCC1C2	InChI=1S/C14H18BrNO3S/c1-19-14-5-4-11(8-12(14)15)20(17,18)16-13-7-9-2-3-10(13)6-9/h4-5,8-10,13,16H,2-3,6-7H2,1H3	JRVCVQJAFKBAPN-UHFFFAOYSA-N	359.019076736							116648
MLS000730068	LSM-28104	SID24810639, BRD-K70639305	16193180	InChI=1S/C26H32N4O4/c1-34-21-10-7-19(8-11-21)18-30-25(32)22-12-9-20(17-23(22)28-26(30)33)24(31)27-13-6-16-29-14-4-2-3-5-15-29/h7-12,17H,2-6,13-16,18H2,1H3,(H,27,31)(H,28,33)	XQRCOZUZJMWDEW-UHFFFAOYSA-N	COc1ccc(CN2C(=O)Nc3cc(ccc3C2=O)C(=O)NCCCN4CCCCCC4)cc1	BroadT	BRD-K70639305	BRD-K70639305-001-05-6	ChemDiv Inc.	C190-0223			COc1ccc(Cn2c(=O)[nH]c3cc(ccc3c2=O)C(=O)NCCCN2CCCCCC2)cc1	InChI=1S/C26H32N4O4/c1-34-21-10-7-19(8-11-21)18-30-25(32)22-12-9-20(17-23(22)28-26(30)33)24(31)27-13-6-16-29-14-4-2-3-5-15-29/h7-12,17H,2-6,13-16,18H2,1H3,(H,27,31)(H,28,33)	XQRCOZUZJMWDEW-UHFFFAOYSA-N	464.242355544							116649
2-(3-Oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)-n-phenylacetamide	LSM-28105	SID4257301, BRD-A76260449	2829724	InChI=1S/C16H15N3O2/c20-15(17-11-6-2-1-3-7-11)10-14-16(21)19-13-9-5-4-8-12(13)18-14/h1-9,14,18H,10H2,(H,17,20)(H,19,21)	KJTNMDRAZRYXNY-UHFFFAOYSA-N	O=C(CC1Nc2ccccc2NC1=O)Nc3ccccc3	BroadT	BRD-A76260449	BRD-A76260449-001-06-2	ChemBridge Corporation	7207009			O=C(CC1Nc2ccccc2NC1=O)Nc1ccccc1	InChI=1S/C16H15N3O2/c20-15(17-11-6-2-1-3-7-11)10-14-16(21)19-13-9-5-4-8-12(13)18-14/h1-9,14,18H,10H2,(H,17,20)(H,19,21)	KJTNMDRAZRYXNY-UHFFFAOYSA-N	281.11642675							116650
AC1O9T33	LSM-28106	SID17505721, BRD-K53806213	6771463	InChI=1S/C16H13N3O4S/c20-10-2-3-11(12(21)8-10)15-17-18-16(24)19(15)9-1-4-13-14(7-9)23-6-5-22-13/h1-4,7-8,20-21H,5-6H2,(H,18,24)	FQOSLXVLYVFXEN-UHFFFAOYSA-N	Oc1ccc(c(O)c1)c2nnc(S)n2c3ccc4OCCOc4c3	BroadT	BRD-K53806213	BRD-K53806213-001-05-3	InterBioScreen Ltd.	STOCK5S-35514			Oc1ccc(-c2nnc(S)n2-c2ccc3OCCOc3c2)c(O)c1	InChI=1S/C16H13N3O4S/c20-10-2-3-11(12(21)8-10)15-17-18-16(24)19(15)9-1-4-13-14(7-9)23-6-5-22-13/h1-4,7-8,20-21H,5-6H2,(H,18,24)	FQOSLXVLYVFXEN-UHFFFAOYSA-N	343.062676616							
AC1NTWJC	LSM-28107	SID3712770, BRD-K05472148	5413051	InChI=1S/C18H17NO3/c1-3-6-12-9-13-16(10-15(12)20)22-11(2)17(18(13)21)14-7-4-5-8-19-14/h4-5,7-10,20H,3,6H2,1-2H3	FJAZHJWLZLBNNC-UHFFFAOYSA-N	CCCc1cc2C(=O)C(=C(C)Oc2cc1O)c3ccccn3	BroadT	BRD-K05472148	BRD-K05472148-001-05-3	Enamine Ltd.	T0505-2334			CCCc1cc2c(cc1O)oc(C)c(-c1ccccn1)c2=O	InChI=1S/C18H17NO3/c1-3-6-12-9-13-16(10-15(12)20)22-11(2)17(18(13)21)14-7-4-5-8-19-14/h4-5,7-10,20H,3,6H2,1-2H3	FJAZHJWLZLBNNC-UHFFFAOYSA-N	295.120843414							116652
MLS000109469	LSM-28108	SID7977128, BRD-K25545281	1363715	InChI=1S/C26H29N3O3/c1-31-24-13-12-22(18-25(24)32-2)27-26(30)21-10-8-20(9-11-21)19-28-14-16-29(17-15-28)23-6-4-3-5-7-23/h3-13,18H,14-17,19H2,1-2H3,(H,27,30)	ZRCMGZIIVNVXJQ-UHFFFAOYSA-N	COc1ccc(NC(=O)c2ccc(CN3CCN(CC3)c4ccccc4)cc2)cc1OC	BroadT	BRD-K25545281	BRD-K25545281-001-04-2	ChemBridge Corporation	6018744			COc1ccc(NC(=O)c2ccc(CN3CCN(CC3)c3ccccc3)cc2)cc1OC	InChI=1S/C26H29N3O3/c1-31-24-13-12-22(18-25(24)32-2)27-26(30)21-10-8-20(9-11-21)19-28-14-16-29(17-15-28)23-6-4-3-5-7-23/h3-13,18H,14-17,19H2,1-2H3,(H,27,30)	ZRCMGZIIVNVXJQ-UHFFFAOYSA-N	431.220891818							116653
SMR000129592	LSM-44253	SID14740400, BRD-A22290997	9551599	InChI=1S/C20H19N3OS2/c1-2-23-11-13(9-14-5-3-7-25-14)19-16(12-23)18(17-6-4-8-26-17)15(10-21)20(22)24-19/h3-9,18H,2,11-12,22H2,1H3/b13-9-	QJAKHWIVXMCRHK-LCYFTJDESA-N	CCN1C\C(=C\c2cccs2)\C3=C(C1)C(C(=C(N)O3)C#N)c4cccs4	BroadT	BRD-A22290997	BRD-A22290997-001-05-2	ChemDiv Inc.	4478-7281			CCN1CC(=C\c2cccs2)\C2=C(C1)C(c1cccs1)C(C#N)=C(N)O2	InChI=1S/C20H19N3OS2/c1-2-23-11-13(9-14-5-3-7-25-14)19-16(12-23)18(17-6-4-8-26-17)15(10-21)20(22)24-19/h3-9,18H,2,11-12,22H2,1H3/b13-9-	QJAKHWIVXMCRHK-LCYFTJDESA-N	381.096953638							
ASN 07461023	LSM-28110	SID852528, BRD-K87579237	655152	InChI=1S/C15H14N2O3S2/c1-17-11-4-6-22-13(11)7-12(17)15(19)20-9-14(18)16-8-10-3-2-5-21-10/h2-7H,8-9H2,1H3,(H,16,18)	CKTQOTBBJHKELS-UHFFFAOYSA-N	Cn1c(cc2sccc12)C(=O)OCC(=O)NCc3cccs3	BroadT	BRD-K87579237	BRD-K87579237-001-05-8	Asinex Ltd.	ASN 07461023			Cn1c(cc2sccc12)C(=O)OCC(=O)NCc1cccs1	InChI=1S/C15H14N2O3S2/c1-17-11-4-6-22-13(11)7-12(17)15(19)20-9-14(18)16-8-10-3-2-5-21-10/h2-7H,8-9H2,1H3,(H,16,18)	CKTQOTBBJHKELS-UHFFFAOYSA-N	334.044583708							116655
MLS000532223	LSM-28111	SID14733800, BRD-K06376072	781112	InChI=1S/C15H9NO3/c17-15(10-9-12-5-2-1-3-6-12)13-7-4-8-14(11-13)16(18)19/h1-8,11H	JODIUOIVYGKAJH-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C(=O)C#Cc2ccccc2	BroadT	BRD-K06376072	BRD-K06376072-001-08-9	ChemBridge Corporation	5213884			[O-][N+](=O)c1cccc(c1)C(=O)C#Cc1ccccc1	InChI=1S/C15H9NO3/c17-15(10-9-12-5-2-1-3-6-12)13-7-4-8-14(11-13)16(18)19/h1-8,11H	JODIUOIVYGKAJH-UHFFFAOYSA-N	251.058243158							116656
79966-13-5	LSM-6665	BRD7378, SID99432301, SID24804254, MW-A1-12	701939	InChI=1S/C10H7ClN2O3/c1-12-7-5-3-2-4-6(7)8(11)9(10(12)14)13(15)16/h2-5H,1H3	KPDOVJBEKCRATD-UHFFFAOYSA-N	CN1C(=O)C(=C(Cl)c2ccccc12)[N+](=O)[O-]	BroadT	BRD-K78867378	BRD-K78867378-001-10-7	Asinex Ltd.	BAS 01060322			Cn1c2ccccc2c(Cl)c([N+]([O-])=O)c1=O	InChI=1S/C10H7ClN2O3/c1-12-7-5-3-2-4-6(7)8(11)9(10(12)14)13(15)16/h2-5H,1H3	KPDOVJBEKCRATD-UHFFFAOYSA-N	238.014519814							95311
BRD-K55452151	LSM-7580		54618737	InChI=1S/C26H33N3O4S/c1-18-14-29(19(2)17-30)34(31,32)26-10-9-23(22-6-4-5-21(11-22)13-27)12-24(26)33-25(18)16-28(3)15-20-7-8-20/h4-6,9-12,18-20,25,30H,7-8,14-17H2,1-3H3/t18-,19+,25-/m1/s1	PCKDIUISIKHUJW-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K55452151	BRD-K55452151-001-01-7	Broad Institute of MIT and Harvard	BRD-K55452151			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C26H33N3O4S/c1-18-14-29(19(2)17-30)34(31,32)26-10-9-23(22-6-4-5-21(11-22)13-27)12-24(26)33-25(18)16-28(3)15-20-7-8-20/h4-6,9-12,18-20,25,30H,7-8,14-17H2,1-3H3/t18-,19+,25-/m1/s1	PCKDIUISIKHUJW-HHJKRLRDSA-N	483.219177256							96201
BRD-K97648508	LSM-8084		54618741	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18-,21+/m0/s1	JAWXPOQCFIAERV-BBTUJRGHSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K97648508	BRD-K97648508-001-01-0	Broad Institute of MIT and Harvard	BRD-K97648508			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC(C)(C)O	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18-,21+/m0/s1	JAWXPOQCFIAERV-BBTUJRGHSA-N	495.240306624							96705
BRD-K27503016	LSM-7192		54618901	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21+,25+/m0/s1	HVNBSBCCDAKDPU-BPYKYCOYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K27503016	BRD-K27503016-001-01-7	Broad Institute of MIT and Harvard	BRD-K27503016			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21+,25+/m0/s1	HVNBSBCCDAKDPU-BPYKYCOYSA-N	500.245726362							95813
BRD-K31559406	LSM-7258		54618717	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18+,21-/m1/s1	JAWXPOQCFIAERV-LVCYWYKZSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K31559406	BRD-K31559406-001-01-1	Broad Institute of MIT and Harvard	BRD-K31559406			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)(C)O	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18+,21-/m1/s1	JAWXPOQCFIAERV-LVCYWYKZSA-N	495.240306624							95879
BRD-K44436874	LSM-7411		54618810	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21-,27+/m1/s1	FZGPYLHWXNIREJ-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K44436874	BRD-K44436874-001-01-0	Broad Institute of MIT and Harvard	BRD-K44436874			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21-,27+/m1/s1	FZGPYLHWXNIREJ-GNMOFYLKSA-N	542.245057646							96032
CHEMBL2358208	LSM-7337	BRD-K37929770, SID131413913	54618812	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22-,27-/m0/s1	JVNQANUBSNFBGV-BERHBOFZSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CCC(C)C)cc1	BroadT	BRD-K37929770	BRD-K37929770-001-01-8	Broad Institute of MIT and Harvard	BRD-K37929770			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CCC(C)C)cc1	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22-,27-/m0/s1	JVNQANUBSNFBGV-BERHBOFZSA-N	557.255956688							95958
BRD-K03251393	LSM-6904		54618724	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20+,26+/m1/s1	JEPVQKOMBMDDOB-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4F	BroadT	BRD-K03251393	BRD-K03251393-001-01-4	Broad Institute of MIT and Harvard	BRD-K03251393			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1F	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20+,26+/m1/s1	JEPVQKOMBMDDOB-GOHWNWGWSA-N	513.209755424							95525
BRD-K93494624	LSM-8042		54618984	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20-,26+/m1/s1	JEPVQKOMBMDDOB-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4F	BroadT	BRD-K93494624	BRD-K93494624-001-01-2	Broad Institute of MIT and Harvard	BRD-K93494624			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1F	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20-,26+/m1/s1	JEPVQKOMBMDDOB-KYTVRQNUSA-N	513.209755424							96663
BRD-K57016057	LSM-7599		54618708	InChI=1S/C21H31N3O3/c1-14-12-24(15(2)13-25)21(26)18-9-17(16-7-5-4-6-8-16)10-23-20(18)27-19(14)11-22-3/h7,9-10,14-15,19,22,25H,4-6,8,11-13H2,1-3H3/t14-,15+,19-/m0/s1	CJMPJSHSWXOPJR-KHYOSLBOSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C3=CCCCC3	BroadT	BRD-K57016057	BRD-K57016057-001-01-3	Broad Institute of MIT and Harvard	BRD-K57016057			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCCC1	InChI=1S/C21H31N3O3/c1-14-12-24(15(2)13-25)21(26)18-9-17(16-7-5-4-6-8-16)10-23-20(18)27-19(14)11-22-3/h7,9-10,14-15,19,22,25H,4-6,8,11-13H2,1-3H3/t14-,15+,19-/m0/s1	CJMPJSHSWXOPJR-KHYOSLBOSA-N	373.236541882							96220
BRD-K71964750	LSM-7799		54618966	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20+,26+/m0/s1	SWUCWXMCDNCWDY-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K71964750	BRD-K71964750-001-01-6	Broad Institute of MIT and Harvard	BRD-K71964750			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20+,26+/m0/s1	SWUCWXMCDNCWDY-OUDXUNEISA-N	557.255956688							96420
BRD-K52373514	LSM-7525		54618848	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20+,25+/m1/s1	LMGISOPGJGQDCH-RNHFSVANSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K52373514	BRD-K52373514-001-01-0	Broad Institute of MIT and Harvard	BRD-K52373514			CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20+,25+/m1/s1	LMGISOPGJGQDCH-RNHFSVANSA-N	529.22465656							96146
BRD-K25119693	LSM-7168		54618808	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19+,25+/m0/s1	JPQXACXLPZYWDI-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K25119693	BRD-K25119693-001-01-4	Broad Institute of MIT and Harvard	BRD-K25119693			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19+,25+/m0/s1	JPQXACXLPZYWDI-OSWQYVSFSA-N	506.252920228							95789
BRD-K69817449	LSM-7782		44505716	InChI=1S/C30H37FN4O4/c1-20-17-35(21(2)19-36)29(37)26-15-23(13-12-22-8-7-9-24(31)14-22)16-32-28(26)39-27(20)18-34(3)30(38)33-25-10-5-4-6-11-25/h7-9,14-16,20-21,25,27,36H,4-6,10-11,17-19H2,1-3H3,(H,33,38)/t20-,21+,27-/m0/s1	QTWXHTQUMWQINH-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3ncc(cc3C1=O)C#Cc4cccc(F)c4	BroadT	BRD-K69817449	BRD-K69817449-001-01-7	Broad Institute of MIT and Harvard	BRD-K69817449			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2ncc(cc2C1=O)C#Cc1cccc(F)c1	InChI=1S/C30H37FN4O4/c1-20-17-35(21(2)19-36)29(37)26-15-23(13-12-22-8-7-9-24(31)14-22)16-32-28(26)39-27(20)18-34(3)30(38)33-25-10-5-4-6-11-25/h7-9,14-16,20-21,25,27,36H,4-6,10-11,17-19H2,1-3H3,(H,33,38)/t20-,21+,27-/m0/s1	QTWXHTQUMWQINH-ISCCLHIJSA-N	536.279883904							96403
BRD-K30478013	LSM-7243		54618951	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19+,23-/m1/s1	YBQMRNJYNXSOKR-SELNLUPBSA-N	CC(C)C#Cc1cnc2O[C@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K30478013	BRD-K30478013-001-01-0	Broad Institute of MIT and Harvard	BRD-K30478013			CC(C)C#Cc1cnc2O[C@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19+,23-/m1/s1	YBQMRNJYNXSOKR-SELNLUPBSA-N	464.242355544							95864
BRD-K65598823	LSM-7723		54618918	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19+,23+/m0/s1	YBQMRNJYNXSOKR-YCRNBWNJSA-N	CC(C)C#Cc1cnc2O[C@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K65598823	BRD-K65598823-001-01-3	Broad Institute of MIT and Harvard	BRD-K65598823			CC(C)C#Cc1cnc2O[C@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19+,23+/m0/s1	YBQMRNJYNXSOKR-YCRNBWNJSA-N	464.242355544							96344
BRD-K07315344	LSM-6949		54618894	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20+,25-/m1/s1	LMGISOPGJGQDCH-OHUGHZGNSA-N	CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K07315344	BRD-K07315344-001-01-3	Broad Institute of MIT and Harvard	BRD-K07315344			CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20+,25-/m1/s1	LMGISOPGJGQDCH-OHUGHZGNSA-N	529.22465656							95570
CHEMBL3183458	LSM-7414	BRD-K44589075	54618841	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22+,27-/m0/s1	JVNQANUBSNFBGV-XXAUWVGASA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)C#CCC(C)C)cc1	BroadT	BRD-K44589075	BRD-K44589075-001-01-3	Broad Institute of MIT and Harvard	BRD-K44589075			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)C#CCC(C)C)cc1	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22+,27-/m0/s1	JVNQANUBSNFBGV-XXAUWVGASA-N	557.255956688							96035
BRD-K53914976	LSM-7550		54618754	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18+,21+/m0/s1	JAWXPOQCFIAERV-WAOWUJCRSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K53914976	BRD-K53914976-001-01-1	Broad Institute of MIT and Harvard	BRD-K53914976			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)(C)O	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18+,21+/m0/s1	JAWXPOQCFIAERV-WAOWUJCRSA-N	495.240306624							96171
MLS003130051	LSM-7813	BRD-K73542906	46903414	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18-,21+/m1/s1	JAWXPOQCFIAERV-OPYAIIAOSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K73542906	BRD-K73542906-001-02-9	Broad Institute of MIT and Harvard	BRD-K73542906			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CC(C)(C)O	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18-,21+/m1/s1	JAWXPOQCFIAERV-OPYAIIAOSA-N	495.240306624							96434
BRD-K12016928	LSM-7001		54618793	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22+,27+/m0/s1	JVNQANUBSNFBGV-OREGWCPLSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)C#CCC(C)C)cc1	BroadT	BRD-K12016928	BRD-K12016928-001-01-4	Broad Institute of MIT and Harvard	BRD-K12016928			COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)C#CCC(C)C)cc1	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22+,27+/m0/s1	JVNQANUBSNFBGV-OREGWCPLSA-N	557.255956688							95622
CHEMBL2144310	LSM-43356	SID131414027, BRD-K02806746	54618923	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18+,23-/m1/s1	PICQTSXUFYQQHP-ZPXOVLSXSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K02806746	BRD-K02806746-001-01-0	Broad Institute of MIT and Harvard	BRD-K02806746			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18+,23-/m1/s1	PICQTSXUFYQQHP-ZPXOVLSXSA-N	505.204670044							
BRD-K12642652	LSM-7017		54618711	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19+,24+/m0/s1	BUQVOPHSTBMFAQ-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)c4cccnc4	BroadT	BRD-K12642652	BRD-K12642652-001-01-9	Broad Institute of MIT and Harvard	BRD-K12642652			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)-c1cccnc1	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19+,24+/m0/s1	BUQVOPHSTBMFAQ-XLNZFTOWSA-N	489.237604522							95638
BRD-K38814572	LSM-7346		54618891	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27+/m1/s1	NAXOUWLFRBOFLI-DVHCVUMVSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)S(=O)(=O)c4ccc(F)cc4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K38814572	BRD-K38814572-001-01-1	Broad Institute of MIT and Harvard	BRD-K38814572			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27+/m1/s1	NAXOUWLFRBOFLI-DVHCVUMVSA-N	592.171320996							95967
BRD-K79240958	LSM-7888		54618869	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20+,25-/m1/s1	RXPBILAYEMNMFE-OHUGHZGNSA-N	CCCC#Cc1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K79240958	BRD-K79240958-001-01-3	Broad Institute of MIT and Harvard	BRD-K79240958			CCCC#Cc1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20+,25-/m1/s1	RXPBILAYEMNMFE-OHUGHZGNSA-N	467.258420178							96509
BRD-K06361641	LSM-6940		54618910	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21-,26+/m0/s1	DSAVDXHQQHIKAO-ISJBWFOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K06361641	BRD-K06361641-001-01-8	Broad Institute of MIT and Harvard	BRD-K06361641			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21-,26+/m0/s1	DSAVDXHQQHIKAO-ISJBWFOZSA-N	527.245392004							95561
BRD-K95664364	LSM-8072		54618790	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19+,23-/m1/s1	KVTAKNNJYPDOHV-SELNLUPBSA-N	CC(C)C#Cc1cnc2O[C@H](CN(C)Cc3cncnc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K95664364	BRD-K95664364-001-01-2	Broad Institute of MIT and Harvard	BRD-K95664364			CC(C)C#Cc1cnc2O[C@H](CN(C)Cc3cncnc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19+,23-/m1/s1	KVTAKNNJYPDOHV-SELNLUPBSA-N	451.258339966							96693
BRD-K94267488	LSM-8049		54618875	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20-,25-/m0/s1	LMGISOPGJGQDCH-RLSLOFABSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K94267488	BRD-K94267488-001-01-6	Broad Institute of MIT and Harvard	BRD-K94267488			CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20-,25-/m0/s1	LMGISOPGJGQDCH-RLSLOFABSA-N	529.22465656							96670
CHEMBL2355890	LSM-6823	BRD-K18710049, SID131413968	54618864	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25-,31+/m0/s1	AXBJPSYRCLUHNL-QNBZCSHPSA-N	C[C@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K18710049	BRD-K18710049-001-01-0	Broad Institute of MIT and Harvard	BRD-K18710049			C[C@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25-,31+/m0/s1	AXBJPSYRCLUHNL-QNBZCSHPSA-N	562.250143026							95444
BRD-K42092012	LSM-7382		54618991	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15+,18-/m1/s1	ZLBUSWVWPMDVDO-RVKKMQEKSA-N	COCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K42092012	BRD-K42092012-001-01-6	Broad Institute of MIT and Harvard	BRD-K42092012			COCC#Cc1cnc2O[C@H](CN(C)S(C)(=O)=O)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15+,18-/m1/s1	ZLBUSWVWPMDVDO-RVKKMQEKSA-N	439.177706368							96003
BRD-K10108893	LSM-6982		54618990	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20+,24+/m1/s1	XQGYHBQFJUCHTM-NMMYMHLASA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K10108893	BRD-K10108893-001-01-2	Broad Institute of MIT and Harvard	BRD-K10108893			COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20+,24+/m1/s1	XQGYHBQFJUCHTM-NMMYMHLASA-N	487.214091876							95603
BRD-K35380368	LSM-7303		54618957	InChI=1S/C28H36N4O5/c1-18(2)11-12-21-13-22-26(29-14-21)37-25(19(3)15-32(27(22)34)20(4)17-33)16-31(5)28(35)30-23-9-7-8-10-24(23)36-6/h7-10,13-14,18-20,25,33H,15-17H2,1-6H3,(H,30,35)/t19-,20-,25-/m1/s1	KPXBVFREPGCPQF-UMEGOILYSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)C#CC(C)C	BroadT	BRD-K35380368	BRD-K35380368-001-01-4	Broad Institute of MIT and Harvard	BRD-K35380368			COc1ccccc1NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC(C)C	InChI=1S/C28H36N4O5/c1-18(2)11-12-21-13-22-26(29-14-21)37-25(19(3)15-32(27(22)34)20(4)17-33)16-31(5)28(35)30-23-9-7-8-10-24(23)36-6/h7-10,13-14,18-20,25,33H,15-17H2,1-6H3,(H,30,35)/t19-,20-,25-/m1/s1	KPXBVFREPGCPQF-UMEGOILYSA-N	508.268570292							95924
BRD-K36801517	LSM-7318		54618899	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18-,22+/m0/s1	GDMNEEJFLGDCSP-NPPFBWRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K36801517	BRD-K36801517-001-01-8	Broad Institute of MIT and Harvard	BRD-K36801517			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18-,22+/m0/s1	GDMNEEJFLGDCSP-NPPFBWRTSA-N	480.248503564							95939
BRD-K92741883	LSM-8027		54618884	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16-,19-/m0/s1	KFBFJFZZVCOITQ-BXWFABGCSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K92741883	BRD-K92741883-001-01-3	Broad Institute of MIT and Harvard	BRD-K92741883			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC(C)(C)O	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16-,19-/m0/s1	KFBFJFZZVCOITQ-BXWFABGCSA-N	447.236935806							96648
BRD-K04605510	LSM-6919		54618753	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20+,26+/m1/s1	DPWYORMJDFEMPA-GOHWNWGWSA-N	COc1ccc(cc1)C#Cc2cnc3O[C@@H](CN(C)C(=O)CC4CC4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K04605510	BRD-K04605510-001-01-8	Broad Institute of MIT and Harvard	BRD-K04605510			COc1ccc(cc1)C#Cc1cnc2O[C@@H](CN(C)C(=O)CC3CC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20+,26+/m1/s1	DPWYORMJDFEMPA-GOHWNWGWSA-N	505.25767125							95540
CHEMBL2358148	LSM-7568	BRD-K54857308, SID131413959	54618855	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23-,28+/m1/s1	GOIFBKSVWMRRGJ-MRJKTFCFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K54857308	BRD-K54857308-001-01-0	Broad Institute of MIT and Harvard	BRD-K54857308			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23-,28+/m1/s1	GOIFBKSVWMRRGJ-MRJKTFCFSA-N	583.181077186							96189
BRD-K51848823	LSM-7518		54618730	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19-,23-/m1/s1	YBQMRNJYNXSOKR-DNVFCKCGSA-N	CC(C)C#Cc1cnc2O[C@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K51848823	BRD-K51848823-001-01-8	Broad Institute of MIT and Harvard	BRD-K51848823			CC(C)C#Cc1cnc2O[C@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19-,23-/m1/s1	YBQMRNJYNXSOKR-DNVFCKCGSA-N	464.242355544							96139
CHEMBL2360752	LSM-7453	BRD-K47371343, SID131414048	54618943	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20+,25-/m0/s1	RXPBILAYEMNMFE-DFIYOIEZSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K47371343	BRD-K47371343-001-01-9	Broad Institute of MIT and Harvard	BRD-K47371343			CCCC#Cc1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20+,25-/m0/s1	RXPBILAYEMNMFE-DFIYOIEZSA-N	467.258420178							96074
CHEMBL2140978	LSM-7863	SID131413865, BRD-K77954087	54618764	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25+,31-/m0/s1	AXBJPSYRCLUHNL-UMDYSXRGSA-N	C[C@@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K77954087	BRD-K77954087-001-01-5	Broad Institute of MIT and Harvard	BRD-K77954087			C[C@@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25+,31-/m0/s1	AXBJPSYRCLUHNL-UMDYSXRGSA-N	562.250143026							96484
BRD-K47647527	LSM-7459		54618834	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18+,22-/m1/s1	GDMNEEJFLGDCSP-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K47647527	BRD-K47647527-001-01-0	Broad Institute of MIT and Harvard	BRD-K47647527			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18+,22-/m1/s1	GDMNEEJFLGDCSP-KGVIQGDOSA-N	480.248503564							96080
BRD-K54049773	LSM-7553		54618941	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19+,23-/m0/s1	KVTAKNNJYPDOHV-YYDVJCTNSA-N	CC(C)C#Cc1cnc2O[C@@H](CN(C)Cc3cncnc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K54049773	BRD-K54049773-001-01-0	Broad Institute of MIT and Harvard	BRD-K54049773			CC(C)C#Cc1cnc2O[C@@H](CN(C)Cc3cncnc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19+,23-/m0/s1	KVTAKNNJYPDOHV-YYDVJCTNSA-N	451.258339966							96174
CHEMBL2355663	LSM-6956	BRD-K07489121, SID131413819	54618719	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18-,24+/m1/s1	AHLJWBISIVXZIU-GGUMNFRJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccc(F)cc3	BroadT	BRD-K07489121	BRD-K07489121-001-01-5	Broad Institute of MIT and Harvard	BRD-K07489121			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(C)=O)Oc2cc(ccc2S1(=O)=O)C#Cc1ccc(F)cc1	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18-,24+/m1/s1	AHLJWBISIVXZIU-GGUMNFRJSA-N	488.178120938							95577
BRD-K49258369	LSM-7483		54618911	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27-/m0/s1	NAXOUWLFRBOFLI-VKIDHGPPSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)S(=O)(=O)c4ccc(F)cc4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K49258369	BRD-K49258369-001-01-5	Broad Institute of MIT and Harvard	BRD-K49258369			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27-/m0/s1	NAXOUWLFRBOFLI-VKIDHGPPSA-N	592.171320996							96104
CHEMBL2355724	LSM-7694	SID131413872, BRD-K63431240	54618771	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21-,28+/m0/s1	OYKBHWDUAQJSNT-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccncc5	BroadT	BRD-K63431240	BRD-K63431240-001-01-4	Broad Institute of MIT and Harvard	BRD-K63431240			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21-,28+/m0/s1	OYKBHWDUAQJSNT-YHGPEZAFSA-N	592.199170094							96315
MLS003130179	LSM-7117	BRD-K20300606, SID99358828	46903577	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20+,25+/m0/s1	QUERDMQYNZTGQF-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K20300606	BRD-K20300606-001-02-9	Broad Institute of MIT and Harvard	BRD-K20300606			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20+,25+/m0/s1	QUERDMQYNZTGQF-WZOHSFFVSA-N	552.184268958							95738
BRD-K55482336	LSM-7581		54618862	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20+,25+/m0/s1	RXPBILAYEMNMFE-WZOHSFFVSA-N	CCCC#Cc1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K55482336	BRD-K55482336-001-01-2	Broad Institute of MIT and Harvard	BRD-K55482336			CCCC#Cc1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20+,25+/m0/s1	RXPBILAYEMNMFE-WZOHSFFVSA-N	467.258420178							96202
BRD-K83344091	LSM-7920		54618704	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20+,26-/m1/s1	DPWYORMJDFEMPA-BVFVYWQFSA-N	COc1ccc(cc1)C#Cc2cnc3O[C@H](CN(C)C(=O)CC4CC4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K83344091	BRD-K83344091-001-01-5	Broad Institute of MIT and Harvard	BRD-K83344091			COc1ccc(cc1)C#Cc1cnc2O[C@H](CN(C)C(=O)CC3CC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20+,26-/m1/s1	DPWYORMJDFEMPA-BVFVYWQFSA-N	505.25767125							96541
CHEMBL3187170	LSM-6988	BRD-K10493820	54618776	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20-,26+/m0/s1	JEPVQKOMBMDDOB-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4F	BroadT	BRD-K10493820	BRD-K10493820-001-01-6	Broad Institute of MIT and Harvard	BRD-K10493820			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1F	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20-,26+/m0/s1	JEPVQKOMBMDDOB-CUVVAGTFSA-N	513.209755424							95609
BRD-K87286000	LSM-7970		54618744	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19-,24-/m1/s1	KBQBGAWQEUXRRY-KHCICDEESA-N	COCC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K87286000	BRD-K87286000-001-01-4	Broad Institute of MIT and Harvard	BRD-K87286000			COCC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19-,24-/m1/s1	KBQBGAWQEUXRRY-KHCICDEESA-N	518.188685622							96591
CHEMBL2357757	LSM-7216	BRD-K28714324, SID131414023	54618919	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23-,28-/m1/s1	GOIFBKSVWMRRGJ-MVOZIGHISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K28714324	BRD-K28714324-001-01-6	Broad Institute of MIT and Harvard	BRD-K28714324			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23-,28-/m1/s1	GOIFBKSVWMRRGJ-MVOZIGHISA-N	583.181077186							95837
BRD-K28467343	LSM-7213		54618696	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20+,25+/m1/s1	QUERDMQYNZTGQF-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K28467343	BRD-K28467343-001-01-8	Broad Institute of MIT and Harvard	BRD-K28467343			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20+,25+/m1/s1	QUERDMQYNZTGQF-RNHFSVANSA-N	552.184268958							95834
CHEMBL2357470	LSM-7927	BRD-K83831887, SID131413871	54618770	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25-,31+/m1/s1	AXBJPSYRCLUHNL-BHUVWSLTSA-N	C[C@@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K83831887	BRD-K83831887-001-01-9	Broad Institute of MIT and Harvard	BRD-K83831887			C[C@@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25-,31+/m1/s1	AXBJPSYRCLUHNL-BHUVWSLTSA-N	562.250143026							96548
BRD-K65529687	LSM-7722		54618970	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21-,25-/m0/s1	HVNBSBCCDAKDPU-WATLYSKOSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K65529687	BRD-K65529687-001-01-3	Broad Institute of MIT and Harvard	BRD-K65529687			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21-,25-/m0/s1	HVNBSBCCDAKDPU-WATLYSKOSA-N	500.245726362							96343
CHEMBL2130699	LSM-7527	BRD-K52476750, SID131414082	54618976	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20+,26-/m1/s1	SWUCWXMCDNCWDY-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K52476750	BRD-K52476750-001-01-4	Broad Institute of MIT and Harvard	BRD-K52476750			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20+,26-/m1/s1	SWUCWXMCDNCWDY-BVFVYWQFSA-N	557.255956688							96148
BRD-K91353140	LSM-8005		54618961	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17-,20-/m0/s1	LZCYHHOYYPSMEH-ZWOKBUDYSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K91353140	BRD-K91353140-001-01-7	Broad Institute of MIT and Harvard	BRD-K91353140			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17-,20-/m0/s1	LZCYHHOYYPSMEH-ZWOKBUDYSA-N	436.203192834							96626
BRD-K05463922	LSM-6931		54618856	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21+,25+/m1/s1	WKIFXSCDZKRENS-CZSZKKDXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K05463922	BRD-K05463922-001-01-3	Broad Institute of MIT and Harvard	BRD-K05463922			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21+,25+/m1/s1	WKIFXSCDZKRENS-CZSZKKDXSA-N	541.22465656							95552
BRD-K72999223	LSM-7808		54618916	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18+,22+/m1/s1	GDMNEEJFLGDCSP-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K72999223	BRD-K72999223-001-01-0	Broad Institute of MIT and Harvard	BRD-K72999223			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18+,22+/m1/s1	GDMNEEJFLGDCSP-FGSXEWAUSA-N	480.248503564							96429
CHEMBL2139685	LSM-7757	BRD-K68216590, SID131414010	54618906	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21+,28-/m1/s1	OYKBHWDUAQJSNT-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccncc5	BroadT	BRD-K68216590	BRD-K68216590-001-01-0	Broad Institute of MIT and Harvard	BRD-K68216590			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21+,28-/m1/s1	OYKBHWDUAQJSNT-PHVLTXCSSA-N	592.199170094							96378
BRD-K45850369	LSM-7433		54618857	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18-,21-/m1/s1	JAWXPOQCFIAERV-DBXWQHBBSA-N	CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K45850369	BRD-K45850369-001-01-3	Broad Institute of MIT and Harvard	BRD-K45850369			CCCNC(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CC(C)(C)O	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18-,21-/m1/s1	JAWXPOQCFIAERV-DBXWQHBBSA-N	495.240306624							96054
CHEMBL3188165	LSM-43366	BRD-K12796341	54618758	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24+,29-/m0/s1	PPFWZCPDKUHMOP-MBISFJOVSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K12796341	BRD-K12796341-001-01-0	Broad Institute of MIT and Harvard	BRD-K12796341			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24+,29-/m0/s1	PPFWZCPDKUHMOP-MBISFJOVSA-N	520.239578342							
BRD-K10432434	LSM-6987		54618756	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20-,26-/m1/s1	JEPVQKOMBMDDOB-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4F	BroadT	BRD-K10432434	BRD-K10432434-001-01-2	Broad Institute of MIT and Harvard	BRD-K10432434			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1F	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20-,26-/m1/s1	JEPVQKOMBMDDOB-XMERXJNXSA-N	513.209755424							95608
BRD-K13848456	LSM-43369		54618773	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23-,27+/m1/s1	BANHLTBDTXCVOB-MBOIVZQGSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K13848456	BRD-K13848456-001-01-9	Broad Institute of MIT and Harvard	BRD-K13848456			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23-,27+/m1/s1	BANHLTBDTXCVOB-MBOIVZQGSA-N	557.255956688							
BRD-K82067034	LSM-7912		44505680	InChI=1S/C30H37N3O4/c1-20-7-6-8-23(13-20)17-32(4)18-28-21(2)16-33(22(3)19-34)30(35)27-14-25(15-31-29(27)37-28)24-9-11-26(36-5)12-10-24/h6-15,21-22,28,34H,16-19H2,1-5H3/t21-,22+,28-/m0/s1	WIXJEAGMVWOKSS-TYPXCFOJSA-N	COc1ccc(cc1)c2cnc3O[C@@H](CN(C)Cc4cccc(C)c4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K82067034	BRD-K82067034-001-01-3	Broad Institute of MIT and Harvard	BRD-K82067034			COc1ccc(cc1)-c1cnc2O[C@@H](CN(C)Cc3cccc(C)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H37N3O4/c1-20-7-6-8-23(13-20)17-32(4)18-28-21(2)16-33(22(3)19-34)30(35)27-14-25(15-31-29(27)37-28)24-9-11-26(36-5)12-10-24/h6-15,21-22,28,34H,16-19H2,1-5H3/t21-,22+,28-/m0/s1	WIXJEAGMVWOKSS-TYPXCFOJSA-N	503.278406694							96533
BRD-K19755908	LSM-7106		54618989	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20-,26+/m1/s1	DPWYORMJDFEMPA-KYTVRQNUSA-N	COc1ccc(cc1)C#Cc2cnc3O[C@@H](CN(C)C(=O)CC4CC4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K19755908	BRD-K19755908-001-01-4	Broad Institute of MIT and Harvard	BRD-K19755908			COc1ccc(cc1)C#Cc1cnc2O[C@@H](CN(C)C(=O)CC3CC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20-,26+/m1/s1	DPWYORMJDFEMPA-KYTVRQNUSA-N	505.25767125							95727
CHEMBL2359470	LSM-7981	BRD-K88223257, SID131413851	54618750	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23+,28-/m1/s1	GOIFBKSVWMRRGJ-AWVRMFGXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K88223257	BRD-K88223257-001-01-6	Broad Institute of MIT and Harvard	BRD-K88223257			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23+,28-/m1/s1	GOIFBKSVWMRRGJ-AWVRMFGXSA-N	583.181077186							96602
BRD-K57371454	LSM-7610		49835814	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18+,24+/m1/s1	OLGOXCLKPVLFFW-YTZAWJCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ncc(cc3C1=O)c4ccncc4	BroadT	BRD-K57371454	BRD-K57371454-001-01-1	Broad Institute of MIT and Harvard	BRD-K57371454			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ncc(cc2C1=O)-c1ccncc1	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18+,24+/m1/s1	OLGOXCLKPVLFFW-YTZAWJCFSA-N	528.184268958							96231
BRD-K36935776	LSM-7320		54618755	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21-,25+/m1/s1	UQYDBQHFUBHFMT-OTPAQWSUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K36935776	BRD-K36935776-001-01-0	Broad Institute of MIT and Harvard	BRD-K36935776			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21-,25+/m1/s1	UQYDBQHFUBHFMT-OTPAQWSUSA-N	492.273655672							95941
CHEMBL3181912	LSM-7899	BRD-K80531070	54618718	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27-/m0/s1	NAXOUWLFRBOFLI-OSOCVKALSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)S(=O)(=O)c4ccc(F)cc4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K80531070	BRD-K80531070-001-01-5	Broad Institute of MIT and Harvard	BRD-K80531070			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27-/m0/s1	NAXOUWLFRBOFLI-OSOCVKALSA-N	592.171320996							96520
MLS003130191	LSM-7787	BRD-K70054078, SID99358840	46903589	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21-,26+/m0/s1	BLVPPUGYXWKWFY-ISJBWFOZSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CC4(O)CCCC4	BroadT	BRD-K70054078	BRD-K70054078-001-02-0	Broad Institute of MIT and Harvard	BRD-K70054078			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21-,26+/m0/s1	BLVPPUGYXWKWFY-ISJBWFOZSA-N	571.235221244							96408
BRD-K64894352	LSM-7713		54618960	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20+,24-/m0/s1	XQGYHBQFJUCHTM-ROKPMTFOSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K64894352	BRD-K64894352-001-01-6	Broad Institute of MIT and Harvard	BRD-K64894352			COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20+,24-/m0/s1	XQGYHBQFJUCHTM-ROKPMTFOSA-N	487.214091876							96334
BRD-K15849229	LSM-7063		54618811	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19-,23+/m0/s1	YBQMRNJYNXSOKR-SFYKDHMMSA-N	CC(C)C#Cc1cnc2O[C@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K15849229	BRD-K15849229-001-01-1	Broad Institute of MIT and Harvard	BRD-K15849229			CC(C)C#Cc1cnc2O[C@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19-,23+/m0/s1	YBQMRNJYNXSOKR-SFYKDHMMSA-N	464.242355544							95684
BRD-K30174465	LSM-43385		54618944	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17-,21+/m1/s1	WESXQGCLCDUYEJ-QNFPXEQRSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K30174465	BRD-K30174465-001-01-8	Broad Institute of MIT and Harvard	BRD-K30174465			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17-,21+/m1/s1	WESXQGCLCDUYEJ-QNFPXEQRSA-N	445.25767125							
BRD-K07081072	LSM-6947		54618978	InChI=1S/C21H31N3O3/c1-14-12-24(15(2)13-25)21(26)18-9-17(16-7-5-4-6-8-16)10-23-20(18)27-19(14)11-22-3/h7,9-10,14-15,19,22,25H,4-6,8,11-13H2,1-3H3/t14-,15-,19-/m0/s1	CJMPJSHSWXOPJR-DOXZYTNZSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C3=CCCCC3	BroadT	BRD-K07081072	BRD-K07081072-001-01-9	Broad Institute of MIT and Harvard	BRD-K07081072			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C1=CCCCC1	InChI=1S/C21H31N3O3/c1-14-12-24(15(2)13-25)21(26)18-9-17(16-7-5-4-6-8-16)10-23-20(18)27-19(14)11-22-3/h7,9-10,14-15,19,22,25H,4-6,8,11-13H2,1-3H3/t14-,15-,19-/m0/s1	CJMPJSHSWXOPJR-DOXZYTNZSA-N	373.236541882							95568
BRD-K97951470	LSM-8086		54618703	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20-,25+/m1/s1	QUERDMQYNZTGQF-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K97951470	BRD-K97951470-001-01-2	Broad Institute of MIT and Harvard	BRD-K97951470			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20-,25+/m1/s1	QUERDMQYNZTGQF-FHAGJXEFSA-N	552.184268958							96707
BRD-K46489288	LSM-7439		54618734	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20-,25-/m1/s1	QUERDMQYNZTGQF-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K46489288	BRD-K46489288-001-01-7	Broad Institute of MIT and Harvard	BRD-K46489288			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20-,25-/m1/s1	QUERDMQYNZTGQF-UMEGOILYSA-N	552.184268958							96060
BRD-K60069548	LSM-43416		54618930	InChI=1S/C23H29N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h4-12,16-17,21,24,27H,13-15H2,1-3H3/b10-9+/t16-,17-,21-/m0/s1	HURDRCJWSCCATG-QORFCUQFSA-N	CNC[C@@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K60069548	BRD-K60069548-001-01-4	Broad Institute of MIT and Harvard	BRD-K60069548			CNC[C@@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H29N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h4-12,16-17,21,24,27H,13-15H2,1-3H3/b10-9+/t16-,17-,21-/m0/s1	HURDRCJWSCCATG-QORFCUQFSA-N	395.220891818							
BRD-K51169491	LSM-7504		54618900	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20-,26+/m1/s1	SWUCWXMCDNCWDY-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K51169491	BRD-K51169491-001-01-0	Broad Institute of MIT and Harvard	BRD-K51169491			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20-,26+/m1/s1	SWUCWXMCDNCWDY-KYTVRQNUSA-N	557.255956688							96125
BRD-K60732356	LSM-7656		54618925	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21+,26+/m1/s1	DSAVDXHQQHIKAO-SWYRRKHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K60732356	BRD-K60732356-001-01-8	Broad Institute of MIT and Harvard	BRD-K60732356			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21+,26+/m1/s1	DSAVDXHQQHIKAO-SWYRRKHMSA-N	527.245392004							96277
BRD-K48954843	LSM-7479		54618865	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19-,23+/m0/s1	CFEPXBTYRQWTEY-SFYKDHMMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K48954843	BRD-K48954843-001-01-6	Broad Institute of MIT and Harvard	BRD-K48954843			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19-,23+/m0/s1	CFEPXBTYRQWTEY-SFYKDHMMSA-N	552.207626292							96100
BRD-K59099936	LSM-7629		54618785	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22-,27+/m0/s1	JVNQANUBSNFBGV-BCQCSXDESA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CCC(C)C)cc1	BroadT	BRD-K59099936	BRD-K59099936-001-01-4	Broad Institute of MIT and Harvard	BRD-K59099936			COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CCC(C)C)cc1	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22-,27+/m0/s1	JVNQANUBSNFBGV-BCQCSXDESA-N	557.255956688							96250
BRD-K04261044	LSM-6916		54618871	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21-,26-/m0/s1	BLVPPUGYXWKWFY-WOVHNISZSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CC4(O)CCCC4	BroadT	BRD-K04261044	BRD-K04261044-001-01-5	Broad Institute of MIT and Harvard	BRD-K04261044			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21-,26-/m0/s1	BLVPPUGYXWKWFY-WOVHNISZSA-N	571.235221244							95537
BRD-K51252203	LSM-7508		54618995	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19-,23+/m1/s1	KVTAKNNJYPDOHV-PWHSHALESA-N	CC(C)C#Cc1cnc2O[C@@H](CN(C)Cc3cncnc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K51252203	BRD-K51252203-001-01-3	Broad Institute of MIT and Harvard	BRD-K51252203			CC(C)C#Cc1cnc2O[C@@H](CN(C)Cc3cncnc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19-,23+/m1/s1	KVTAKNNJYPDOHV-PWHSHALESA-N	451.258339966							96129
BRD-K32816753	LSM-7272		54618913	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21+,27-/m1/s1	FZGPYLHWXNIREJ-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K32816753	BRD-K32816753-001-01-3	Broad Institute of MIT and Harvard	BRD-K32816753			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21+,27-/m1/s1	FZGPYLHWXNIREJ-PBDKAQRYSA-N	542.245057646							95893
BRD-K47020544	LSM-7446		54618972	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21-,25+/m0/s1	WKIFXSCDZKRENS-STWLZBDKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K47020544	BRD-K47020544-001-01-9	Broad Institute of MIT and Harvard	BRD-K47020544			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21-,25+/m0/s1	WKIFXSCDZKRENS-STWLZBDKSA-N	541.22465656							96067
BRD-K77805051	LSM-7861		54618927	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19+,23+/m0/s1	CFEPXBTYRQWTEY-YCRNBWNJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K77805051	BRD-K77805051-001-01-1	Broad Institute of MIT and Harvard	BRD-K77805051			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19+,23+/m0/s1	CFEPXBTYRQWTEY-YCRNBWNJSA-N	552.207626292							96482
BRD-K07426711	LSM-6952		54618843	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19-,24+/m0/s1	KBQBGAWQEUXRRY-AXHZCLLHSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K07426711	BRD-K07426711-001-01-3	Broad Institute of MIT and Harvard	BRD-K07426711			COCC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19-,24+/m0/s1	KBQBGAWQEUXRRY-AXHZCLLHSA-N	518.188685622							95573
BRD-K23240038	LSM-7152		54618732	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18-,24+/m0/s1	OLGOXCLKPVLFFW-LLJLJFOGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ncc(cc3C1=O)c4ccncc4	BroadT	BRD-K23240038	BRD-K23240038-001-01-4	Broad Institute of MIT and Harvard	BRD-K23240038			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ncc(cc2C1=O)-c1ccncc1	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18-,24+/m0/s1	OLGOXCLKPVLFFW-LLJLJFOGSA-N	528.184268958							95773
BRD-K55657259	LSM-7584		54618915	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20-,24+/m0/s1	XQGYHBQFJUCHTM-MZLICYQSSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K55657259	BRD-K55657259-001-01-2	Broad Institute of MIT and Harvard	BRD-K55657259			COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20-,24+/m0/s1	XQGYHBQFJUCHTM-MZLICYQSSA-N	487.214091876							96205
BRD-K57902493	LSM-7619		54618802	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19+,23+/m1/s1	KVTAKNNJYPDOHV-MSYCTHLASA-N	CC(C)C#Cc1cnc2O[C@@H](CN(C)Cc3cncnc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K57902493	BRD-K57902493-001-01-6	Broad Institute of MIT and Harvard	BRD-K57902493			CC(C)C#Cc1cnc2O[C@@H](CN(C)Cc3cncnc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19+,23+/m1/s1	KVTAKNNJYPDOHV-MSYCTHLASA-N	451.258339966							96240
BRD-K91757634	LSM-8011		54618826	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16-,19-/m1/s1	KFBFJFZZVCOITQ-GPMSIDNRSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K91757634	BRD-K91757634-001-01-2	Broad Institute of MIT and Harvard	BRD-K91757634			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC(C)(C)O	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16-,19-/m1/s1	KFBFJFZZVCOITQ-GPMSIDNRSA-N	447.236935806							96632
BRD-K76450606	LSM-7836		54618786	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27-/m1/s1	NAXOUWLFRBOFLI-SEXOINJZSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)S(=O)(=O)c4ccc(F)cc4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K76450606	BRD-K76450606-001-01-7	Broad Institute of MIT and Harvard	BRD-K76450606			COc1ccccc1-c1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27-/m1/s1	NAXOUWLFRBOFLI-SEXOINJZSA-N	592.171320996							96457
BRD-K16948767	LSM-7071		54618963	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18+,24-/m0/s1	AHLJWBISIVXZIU-RHGYRFJNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccc(F)cc3	BroadT	BRD-K16948767	BRD-K16948767-001-01-8	Broad Institute of MIT and Harvard	BRD-K16948767			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(C)=O)Oc2cc(ccc2S1(=O)=O)C#Cc1ccc(F)cc1	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18+,24-/m0/s1	AHLJWBISIVXZIU-RHGYRFJNSA-N	488.178120938							95692
BRD-K64147637	LSM-7705		54618872	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20+,24-/m1/s1	XQGYHBQFJUCHTM-JXALWOEJSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K64147637	BRD-K64147637-001-01-6	Broad Institute of MIT and Harvard	BRD-K64147637			COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20+,24-/m1/s1	XQGYHBQFJUCHTM-JXALWOEJSA-N	487.214091876							96326
BRD-K65611481	LSM-7724		54618858	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19-,24-/m0/s1	KBQBGAWQEUXRRY-JXQFQVJHSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3F)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K65611481	BRD-K65611481-001-01-7	Broad Institute of MIT and Harvard	BRD-K65611481			COCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3F)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19-,24-/m0/s1	KBQBGAWQEUXRRY-JXQFQVJHSA-N	518.188685622							96345
CHEMBL2142070	LSM-7155	BRD-K23378122, SID131414006	54618902	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21-,28-/m1/s1	OYKBHWDUAQJSNT-UMQWNRPGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccncc5	BroadT	BRD-K23378122	BRD-K23378122-001-01-9	Broad Institute of MIT and Harvard	BRD-K23378122			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21-,28-/m1/s1	OYKBHWDUAQJSNT-UMQWNRPGSA-N	592.199170094							95776
CHEMBL2362330	LSM-7503	BRD-K51031805, SID131413985	54618881	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21+,25-/m1/s1	HVNBSBCCDAKDPU-TYBLODHISA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K51031805	BRD-K51031805-001-01-3	Broad Institute of MIT and Harvard	BRD-K51031805			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21+,25-/m1/s1	HVNBSBCCDAKDPU-TYBLODHISA-N	500.245726362							96124
BRD-K95400509	LSM-8068		54618729	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21-,27-/m0/s1	FZGPYLHWXNIREJ-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K95400509	BRD-K95400509-001-01-7	Broad Institute of MIT and Harvard	BRD-K95400509			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21-,27-/m0/s1	FZGPYLHWXNIREJ-IZVMNLJQSA-N	542.245057646							96689
BRD-K05625127	LSM-43360		54618803	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18-,23-/m1/s1	PICQTSXUFYQQHP-YMBATADGSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K05625127	BRD-K05625127-001-01-0	Broad Institute of MIT and Harvard	BRD-K05625127			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18-,23-/m1/s1	PICQTSXUFYQQHP-YMBATADGSA-N	505.204670044							
BRD-K03458571	LSM-6907		54618720	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27+/m1/s1	NAXOUWLFRBOFLI-JVAFGIKQSA-N	COc1ccccc1c2ccc3c(O[C@@H](CN(C)S(=O)(=O)c4ccc(F)cc4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K03458571	BRD-K03458571-001-01-9	Broad Institute of MIT and Harvard	BRD-K03458571			COc1ccccc1-c1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27+/m1/s1	NAXOUWLFRBOFLI-JVAFGIKQSA-N	592.171320996							95528
BRD-K44070326	LSM-7405		54618985	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20+,25+/m1/s1	RXPBILAYEMNMFE-RNHFSVANSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K44070326	BRD-K44070326-001-01-1	Broad Institute of MIT and Harvard	BRD-K44070326			CCCC#Cc1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20+,25+/m1/s1	RXPBILAYEMNMFE-RNHFSVANSA-N	467.258420178							96026
BRD-K03050455	LSM-6903		54618709	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15-,18-/m0/s1	ZLBUSWVWPMDVDO-MPGHIAIKSA-N	COCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K03050455	BRD-K03050455-001-01-5	Broad Institute of MIT and Harvard	BRD-K03050455			COCC#Cc1cnc2O[C@@H](CN(C)S(C)(=O)=O)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15-,18-/m0/s1	ZLBUSWVWPMDVDO-MPGHIAIKSA-N	439.177706368							95524
BRD-K62214276	LSM-7677		54618749	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19-,24+/m1/s1	BUQVOPHSTBMFAQ-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)c4cccnc4	BroadT	BRD-K62214276	BRD-K62214276-001-01-2	Broad Institute of MIT and Harvard	BRD-K62214276			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)-c1cccnc1	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19-,24+/m1/s1	BUQVOPHSTBMFAQ-IECBHUPTSA-N	489.237604522							96298
BRD-K04260462	LSM-6915		54618849	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17+,20+/m0/s1	LZCYHHOYYPSMEH-SQGPQFPESA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K04260462	BRD-K04260462-001-01-0	Broad Institute of MIT and Harvard	BRD-K04260462			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17+,20+/m0/s1	LZCYHHOYYPSMEH-SQGPQFPESA-N	436.203192834							95536
BRD-K05363386	LSM-6930		54618897	InChI=1S/C21H31N3O3/c1-14-12-24(15(2)13-25)21(26)18-9-17(16-7-5-4-6-8-16)10-23-20(18)27-19(14)11-22-3/h7,9-10,14-15,19,22,25H,4-6,8,11-13H2,1-3H3/t14-,15+,19-/m1/s1	CJMPJSHSWXOPJR-ZRGWGRIASA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C3=CCCCC3	BroadT	BRD-K05363386	BRD-K05363386-001-01-4	Broad Institute of MIT and Harvard	BRD-K05363386			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCCC1	InChI=1S/C21H31N3O3/c1-14-12-24(15(2)13-25)21(26)18-9-17(16-7-5-4-6-8-16)10-23-20(18)27-19(14)11-22-3/h7,9-10,14-15,19,22,25H,4-6,8,11-13H2,1-3H3/t14-,15+,19-/m1/s1	CJMPJSHSWXOPJR-ZRGWGRIASA-N	373.236541882							95551
CHEMBL2143154	LSM-7200	BRD-K27735716, SID131413906	54618805	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20-,24+/m0/s1	YTUJKVHLLCOJEP-MZLICYQSSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K27735716	BRD-K27735716-001-01-8	Broad Institute of MIT and Harvard	BRD-K27735716			CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20-,24+/m0/s1	YTUJKVHLLCOJEP-MZLICYQSSA-N	499.214091876							95821
BRD-K42359528	LSM-7387		54618946	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18-,24-/m0/s1	OLGOXCLKPVLFFW-XFAGBWLFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ncc(cc3C1=O)c4ccncc4	BroadT	BRD-K42359528	BRD-K42359528-001-01-6	Broad Institute of MIT and Harvard	BRD-K42359528			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ncc(cc2C1=O)-c1ccncc1	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18-,24-/m0/s1	OLGOXCLKPVLFFW-XFAGBWLFSA-N	528.184268958							96008
BRD-K61535492	LSM-7667		54618809	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19-,23-/m1/s1	KVTAKNNJYPDOHV-DNVFCKCGSA-N	CC(C)C#Cc1cnc2O[C@H](CN(C)Cc3cncnc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K61535492	BRD-K61535492-001-01-9	Broad Institute of MIT and Harvard	BRD-K61535492			CC(C)C#Cc1cnc2O[C@H](CN(C)Cc3cncnc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19-,23-/m1/s1	KVTAKNNJYPDOHV-DNVFCKCGSA-N	451.258339966							96288
BRD-K43419088	LSM-43394		54618842	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18+,23-/m0/s1	PICQTSXUFYQQHP-UHFRQCOTSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K43419088	BRD-K43419088-001-01-9	Broad Institute of MIT and Harvard	BRD-K43419088			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18+,23-/m0/s1	PICQTSXUFYQQHP-UHFRQCOTSA-N	505.204670044							
BRD-K84838433	LSM-7938		54618698	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18-,24-/m1/s1	OLGOXCLKPVLFFW-QZTZHPFYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ncc(cc3C1=O)c4ccncc4	BroadT	BRD-K84838433	BRD-K84838433-001-01-2	Broad Institute of MIT and Harvard	BRD-K84838433			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ncc(cc2C1=O)-c1ccncc1	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18-,24-/m1/s1	OLGOXCLKPVLFFW-QZTZHPFYSA-N	528.184268958							96559
BRD-K64882872	LSM-7712		54618794	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21-,26-/m0/s1	CLQLHKYRPGBFMB-WOVHNISZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccn4	BroadT	BRD-K64882872	BRD-K64882872-001-01-2	Broad Institute of MIT and Harvard	BRD-K64882872			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccn1	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21-,26-/m0/s1	CLQLHKYRPGBFMB-WOVHNISZSA-N	476.278741052							96333
BRD-K05295391	LSM-6928		54618922	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18-,22+/m1/s1	GDMNEEJFLGDCSP-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K05295391	BRD-K05295391-001-01-1	Broad Institute of MIT and Harvard	BRD-K05295391			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18-,22+/m1/s1	GDMNEEJFLGDCSP-HMFYCAOWSA-N	480.248503564							95549
BRD-K86250672	LSM-7951		54618710	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21-,26+/m1/s1	CLQLHKYRPGBFMB-YPCDYVTLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccn4	BroadT	BRD-K86250672	BRD-K86250672-001-01-8	Broad Institute of MIT and Harvard	BRD-K86250672			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccn1	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21-,26+/m1/s1	CLQLHKYRPGBFMB-YPCDYVTLSA-N	476.278741052							96572
BRD-K27807043	LSM-7201		54618697	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18-,24+/m1/s1	OLGOXCLKPVLFFW-GGUMNFRJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ncc(cc3C1=O)c4ccncc4	BroadT	BRD-K27807043	BRD-K27807043-001-01-9	Broad Institute of MIT and Harvard	BRD-K27807043			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ncc(cc2C1=O)-c1ccncc1	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18-,24+/m1/s1	OLGOXCLKPVLFFW-GGUMNFRJSA-N	528.184268958							95822
BRD-K40487298	LSM-43390		54618868	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23-,27+/m0/s1	BANHLTBDTXCVOB-HGCZQBOQSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K40487298	BRD-K40487298-001-01-5	Broad Institute of MIT and Harvard	BRD-K40487298			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23-,27+/m0/s1	BANHLTBDTXCVOB-HGCZQBOQSA-N	557.255956688							
CHEMBL2135356	LSM-7937	BRD-K84797651, SID131413863	54618762	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25-,31+/m1/s1	AXBJPSYRCLUHNL-FXIKWKPTSA-N	C[C@@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K84797651	BRD-K84797651-001-01-5	Broad Institute of MIT and Harvard	BRD-K84797651			C[C@@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25-,31+/m1/s1	AXBJPSYRCLUHNL-FXIKWKPTSA-N	562.250143026							96558
BRD-K89074352	LSM-7989		54618895	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20+,26-/m0/s1	JEPVQKOMBMDDOB-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4F	BroadT	BRD-K89074352	BRD-K89074352-001-01-6	Broad Institute of MIT and Harvard	BRD-K89074352			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1F	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20+,26-/m0/s1	JEPVQKOMBMDDOB-UNVFRBQDSA-N	513.209755424							96610
BRD-K60056824	LSM-7642		54618789	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20-,25-/m0/s1	RXPBILAYEMNMFE-RLSLOFABSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K60056824	BRD-K60056824-001-01-6	Broad Institute of MIT and Harvard	BRD-K60056824			CCCC#Cc1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20-,25-/m0/s1	RXPBILAYEMNMFE-RLSLOFABSA-N	467.258420178							96263
BRD-K11518623	LSM-6995		49835851	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21+,26+/m1/s1	BLVPPUGYXWKWFY-SWYRRKHMSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)C#CC4(O)CCCC4	BroadT	BRD-K11518623	BRD-K11518623-001-01-8	Broad Institute of MIT and Harvard	BRD-K11518623			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21+,26+/m1/s1	BLVPPUGYXWKWFY-SWYRRKHMSA-N	571.235221244							95616
BRD-K78556523	LSM-43427		54618874	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18+,23+/m0/s1	PICQTSXUFYQQHP-DVUHTVQOSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K78556523	BRD-K78556523-001-01-9	Broad Institute of MIT and Harvard	BRD-K78556523			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18+,23+/m0/s1	PICQTSXUFYQQHP-DVUHTVQOSA-N	505.204670044							
BRD-K44978017	LSM-7418		54618761	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15-,18+/m0/s1	ZLBUSWVWPMDVDO-RLFYNMQTSA-N	COCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)C)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K44978017	BRD-K44978017-001-01-9	Broad Institute of MIT and Harvard	BRD-K44978017			COCC#Cc1cnc2O[C@H](CN(C)S(C)(=O)=O)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15-,18+/m0/s1	ZLBUSWVWPMDVDO-RLFYNMQTSA-N	439.177706368							96039
BRD-K34096870	LSM-7290		54618765	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21-,26+/m1/s1	DSAVDXHQQHIKAO-YPCDYVTLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K34096870	BRD-K34096870-001-01-8	Broad Institute of MIT and Harvard	BRD-K34096870			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21-,26+/m1/s1	DSAVDXHQQHIKAO-YPCDYVTLSA-N	527.245392004							95911
BRD-K93569047	LSM-8045		54618904	InChI=1S/C26H33N3O4S/c1-18-14-29(19(2)17-30)34(31,32)26-10-9-23(22-6-4-5-21(11-22)13-27)12-24(26)33-25(18)16-28(3)15-20-7-8-20/h4-6,9-12,18-20,25,30H,7-8,14-17H2,1-3H3/t18-,19+,25+/m0/s1	PCKDIUISIKHUJW-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K93569047	BRD-K93569047-001-01-0	Broad Institute of MIT and Harvard	BRD-K93569047			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C26H33N3O4S/c1-18-14-29(19(2)17-30)34(31,32)26-10-9-23(22-6-4-5-21(11-22)13-27)12-24(26)33-25(18)16-28(3)15-20-7-8-20/h4-6,9-12,18-20,25,30H,7-8,14-17H2,1-3H3/t18-,19+,25+/m0/s1	PCKDIUISIKHUJW-OSWQYVSFSA-N	483.219177256							96666
CHEMBL2131016	LSM-7590	BRD-K56274797, SID131413991	54618887	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21-,26-/m1/s1	DSAVDXHQQHIKAO-IPVFLDMMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K56274797	BRD-K56274797-001-01-4	Broad Institute of MIT and Harvard	BRD-K56274797			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21-,26-/m1/s1	DSAVDXHQQHIKAO-IPVFLDMMSA-N	527.245392004							96211
BRD-K92635027	LSM-8023		54618806	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20+,25+/m0/s1	LMGISOPGJGQDCH-WZOHSFFVSA-N	CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K92635027	BRD-K92635027-001-01-4	Broad Institute of MIT and Harvard	BRD-K92635027			CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20+,25+/m0/s1	LMGISOPGJGQDCH-WZOHSFFVSA-N	529.22465656							96644
BRD-K06449093	LSM-6941		54618850	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18+,22+/m0/s1	GDMNEEJFLGDCSP-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K06449093	BRD-K06449093-001-01-4	Broad Institute of MIT and Harvard	BRD-K06449093			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18+,22+/m0/s1	GDMNEEJFLGDCSP-NJNPRVFISA-N	480.248503564							95562
BRD-K49739160	LSM-7491		54618928	InChI=1S/C24H29N3O4/c1-16-14-27(17(2)15-28)24(29)21-11-19(12-26-23(21)31-22(16)13-25-3)9-8-18-6-5-7-20(10-18)30-4/h5-7,10-12,16-17,22,25,28H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	FZSLNURVQGYNPU-JKSBSHDWSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc3cccc(OC)c3	BroadT	BRD-K49739160	BRD-K49739160-001-01-5	Broad Institute of MIT and Harvard	BRD-K49739160			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc1cccc(OC)c1	InChI=1S/C24H29N3O4/c1-16-14-27(17(2)15-28)24(29)21-11-19(12-26-23(21)31-22(16)13-25-3)9-8-18-6-5-7-20(10-18)30-4/h5-7,10-12,16-17,22,25,28H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	FZSLNURVQGYNPU-JKSBSHDWSA-N	423.215806438							96112
BRD-K55504273	LSM-7582		54618909	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21+,26-/m0/s1	DSAVDXHQQHIKAO-UZINWLIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K55504273	BRD-K55504273-001-01-8	Broad Institute of MIT and Harvard	BRD-K55504273			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21+,26-/m0/s1	DSAVDXHQQHIKAO-UZINWLIJSA-N	527.245392004							96203
CHEMBL2134768	LSM-7130	BRD-K21509488, SID131414047	54618942	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25-,31+/m0/s1	AXBJPSYRCLUHNL-TXHDDHBJSA-N	C[C@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K21509488	BRD-K21509488-001-01-9	Broad Institute of MIT and Harvard	BRD-K21509488			C[C@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25-,31+/m0/s1	AXBJPSYRCLUHNL-TXHDDHBJSA-N	562.250143026							95751
BRD-K95190454	LSM-8066		54618772	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19-,24-/m1/s1	BUQVOPHSTBMFAQ-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)c4cccnc4	BroadT	BRD-K95190454	BRD-K95190454-001-01-9	Broad Institute of MIT and Harvard	BRD-K95190454			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)-c1cccnc1	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19-,24-/m1/s1	BUQVOPHSTBMFAQ-KHCICDEESA-N	489.237604522							96687
BRD-K65708449	LSM-7725		54618974	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19-,23-/m1/s1	CFEPXBTYRQWTEY-DNVFCKCGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K65708449	BRD-K65708449-001-01-2	Broad Institute of MIT and Harvard	BRD-K65708449			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19-,23-/m1/s1	CFEPXBTYRQWTEY-DNVFCKCGSA-N	552.207626292							96346
BRD-K54735832	LSM-43411		54618955	InChI=1S/C23H29N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h4-12,16-17,21,24,27H,13-15H2,1-3H3/b10-9+/t16-,17-,21+/m1/s1	HURDRCJWSCCATG-MFGJOAIOSA-N	CNC[C@@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K54735832	BRD-K54735832-001-01-3	Broad Institute of MIT and Harvard	BRD-K54735832			CNC[C@@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H29N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h4-12,16-17,21,24,27H,13-15H2,1-3H3/b10-9+/t16-,17-,21+/m1/s1	HURDRCJWSCCATG-MFGJOAIOSA-N	395.220891818							
BRD-K67891857	LSM-7754		54618878	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18-,24-/m1/s1	AHLJWBISIVXZIU-QZTZHPFYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccc(F)cc3	BroadT	BRD-K67891857	BRD-K67891857-001-01-9	Broad Institute of MIT and Harvard	BRD-K67891857			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(C)=O)Oc2cc(ccc2S1(=O)=O)C#Cc1ccc(F)cc1	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18-,24-/m1/s1	AHLJWBISIVXZIU-QZTZHPFYSA-N	488.178120938							96375
BRD-K10771753	LSM-43365		54618908	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24-,29+/m1/s1	PPFWZCPDKUHMOP-ZWCSXCLXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K10771753	BRD-K10771753-001-01-6	Broad Institute of MIT and Harvard	BRD-K10771753			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24-,29+/m1/s1	PPFWZCPDKUHMOP-ZWCSXCLXSA-N	520.239578342							
BRD-K45515828	LSM-7422		54618695	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19+,24-/m0/s1	BUQVOPHSTBMFAQ-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)c4cccnc4	BroadT	BRD-K45515828	BRD-K45515828-001-01-7	Broad Institute of MIT and Harvard	BRD-K45515828			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)-c1cccnc1	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19+,24-/m0/s1	BUQVOPHSTBMFAQ-GLDPYIMESA-N	489.237604522							96043
BRD-K65999663	LSM-7728		54618769	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17+,20-/m1/s1	LZCYHHOYYPSMEH-FUHIMQAGSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K65999663	BRD-K65999663-001-01-6	Broad Institute of MIT and Harvard	BRD-K65999663			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17+,20-/m1/s1	LZCYHHOYYPSMEH-FUHIMQAGSA-N	436.203192834							96349
BRD-K63947305	LSM-43417		54618821	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17-,21-/m1/s1	WESXQGCLCDUYEJ-BHKDKARYSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K63947305	BRD-K63947305-001-01-1	Broad Institute of MIT and Harvard	BRD-K63947305			C\C=C\c1cnc2O[C@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17-,21-/m1/s1	WESXQGCLCDUYEJ-BHKDKARYSA-N	445.25767125							
BRD-K13118417	LSM-7025		54618975	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17-,20+/m0/s1	LZCYHHOYYPSMEH-ABSDTBQOSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K13118417	BRD-K13118417-001-01-5	Broad Institute of MIT and Harvard	BRD-K13118417			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17-,20+/m0/s1	LZCYHHOYYPSMEH-ABSDTBQOSA-N	436.203192834							95646
BRD-K90734139	LSM-7999		54618818	InChI=1S/C24H29N3O4/c1-16-14-27(17(2)15-28)24(29)21-11-19(12-26-23(21)31-22(16)13-25-3)9-8-18-6-5-7-20(10-18)30-4/h5-7,10-12,16-17,22,25,28H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	FZSLNURVQGYNPU-HYFFOGBASA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc3cccc(OC)c3	BroadT	BRD-K90734139	BRD-K90734139-001-01-2	Broad Institute of MIT and Harvard	BRD-K90734139			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc1cccc(OC)c1	InChI=1S/C24H29N3O4/c1-16-14-27(17(2)15-28)24(29)21-11-19(12-26-23(21)31-22(16)13-25-3)9-8-18-6-5-7-20(10-18)30-4/h5-7,10-12,16-17,22,25,28H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	FZSLNURVQGYNPU-HYFFOGBASA-N	423.215806438							96620
BRD-K38688128	LSM-7344		54618774	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21-,25-/m1/s1	UQYDBQHFUBHFMT-DNRQZRRGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K38688128	BRD-K38688128-001-01-8	Broad Institute of MIT and Harvard	BRD-K38688128			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21-,25-/m1/s1	UQYDBQHFUBHFMT-DNRQZRRGSA-N	492.273655672							95965
BRD-K69892607	LSM-7784		54618824	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21+,26+/m0/s1	CLQLHKYRPGBFMB-LZCXECNNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccn4	BroadT	BRD-K69892607	BRD-K69892607-001-01-8	Broad Institute of MIT and Harvard	BRD-K69892607			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccn1	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21+,26+/m0/s1	CLQLHKYRPGBFMB-LZCXECNNSA-N	476.278741052							96405
BRD-K95096346	LSM-43441		54618936	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24+,29+/m0/s1	PPFWZCPDKUHMOP-HDWSHTFCSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K95096346	BRD-K95096346-001-01-0	Broad Institute of MIT and Harvard	BRD-K95096346			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24+,29+/m0/s1	PPFWZCPDKUHMOP-HDWSHTFCSA-N	520.239578342							
BRD-K28833951	LSM-7217		54618988	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19-,23+/m1/s1	CFEPXBTYRQWTEY-PWHSHALESA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K28833951	BRD-K28833951-001-01-4	Broad Institute of MIT and Harvard	BRD-K28833951			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19-,23+/m1/s1	CFEPXBTYRQWTEY-PWHSHALESA-N	552.207626292							95838
BRD-K94534355	LSM-8056		54618933	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23-,28-/m0/s1	GOIFBKSVWMRRGJ-LXWOLXCRSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K94534355	BRD-K94534355-001-01-9	Broad Institute of MIT and Harvard	BRD-K94534355			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23-,28-/m0/s1	GOIFBKSVWMRRGJ-LXWOLXCRSA-N	583.181077186							96677
CHEMBL2133024	LSM-7162	BRD-K24124456, SID131413951	54618847	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21+,26-/m1/s1	DSAVDXHQQHIKAO-YZIHRLCOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K24124456	BRD-K24124456-001-01-2	Broad Institute of MIT and Harvard	BRD-K24124456			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21+,26-/m1/s1	DSAVDXHQQHIKAO-YZIHRLCOSA-N	527.245392004							95783
BRD-K87276639	LSM-7969		54618860	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19+,24-/m0/s1	KBQBGAWQEUXRRY-GLDPYIMESA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3F)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K87276639	BRD-K87276639-001-01-4	Broad Institute of MIT and Harvard	BRD-K87276639			COCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3F)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19+,24-/m0/s1	KBQBGAWQEUXRRY-GLDPYIMESA-N	518.188685622							96590
BRD-K80003719	LSM-7895		54618699	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19-,23+/m0/s1	KVTAKNNJYPDOHV-SFYKDHMMSA-N	CC(C)C#Cc1cnc2O[C@H](CN(C)Cc3cncnc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K80003719	BRD-K80003719-001-01-2	Broad Institute of MIT and Harvard	BRD-K80003719			CC(C)C#Cc1cnc2O[C@H](CN(C)Cc3cncnc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19-,23+/m0/s1	KVTAKNNJYPDOHV-SFYKDHMMSA-N	451.258339966							96516
BRD-K12342216	LSM-7011		54618979	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19+,24-/m1/s1	KBQBGAWQEUXRRY-YDIMBITNSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K12342216	BRD-K12342216-001-01-5	Broad Institute of MIT and Harvard	BRD-K12342216			COCC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19+,24-/m1/s1	KBQBGAWQEUXRRY-YDIMBITNSA-N	518.188685622							95632
BRD-K83369119	LSM-7921		54618745	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19+,23-/m0/s1	CFEPXBTYRQWTEY-YYDVJCTNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K83369119	BRD-K83369119-001-01-0	Broad Institute of MIT and Harvard	BRD-K83369119			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19+,23-/m0/s1	CFEPXBTYRQWTEY-YYDVJCTNSA-N	552.207626292							96542
BRD-K35111787	LSM-7297		54618739	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21-,25-/m1/s1	HVNBSBCCDAKDPU-DNRQZRRGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K35111787	BRD-K35111787-001-01-6	Broad Institute of MIT and Harvard	BRD-K35111787			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21-,25-/m1/s1	HVNBSBCCDAKDPU-DNRQZRRGSA-N	500.245726362							95918
BRD-K42864285	LSM-7394		54618779	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21+,25+/m1/s1	UQYDBQHFUBHFMT-CZSZKKDXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K42864285	BRD-K42864285-001-01-8	Broad Institute of MIT and Harvard	BRD-K42864285			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21+,25+/m1/s1	UQYDBQHFUBHFMT-CZSZKKDXSA-N	492.273655672							96015
BRD-K89326053	LSM-7991		54618798	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21+,26+/m1/s1	CLQLHKYRPGBFMB-SWYRRKHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccn4	BroadT	BRD-K89326053	BRD-K89326053-001-01-2	Broad Institute of MIT and Harvard	BRD-K89326053			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccn1	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21+,26+/m1/s1	CLQLHKYRPGBFMB-SWYRRKHMSA-N	476.278741052							96612
BRD-K19189563	LSM-7096		54618782	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21-,25+/m1/s1	WKIFXSCDZKRENS-OTPAQWSUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K19189563	BRD-K19189563-001-01-2	Broad Institute of MIT and Harvard	BRD-K19189563			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21-,25+/m1/s1	WKIFXSCDZKRENS-OTPAQWSUSA-N	541.22465656							95717
CHEMBL3182493	LSM-7565	BRD-K54676281	54618829	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22+,27-/m1/s1	JVNQANUBSNFBGV-UMTXDNHDSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)C#CCC(C)C)cc1	BroadT	BRD-K54676281	BRD-K54676281-001-01-5	Broad Institute of MIT and Harvard	BRD-K54676281			COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)C#CCC(C)C)cc1	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22+,27-/m1/s1	JVNQANUBSNFBGV-UMTXDNHDSA-N	557.255956688							96186
BRD-K29946624	LSM-7234		54618958	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19-,23+/m1/s1	YBQMRNJYNXSOKR-PWHSHALESA-N	CC(C)C#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K29946624	BRD-K29946624-001-01-0	Broad Institute of MIT and Harvard	BRD-K29946624			CC(C)C#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19-,23+/m1/s1	YBQMRNJYNXSOKR-PWHSHALESA-N	464.242355544							95855
BRD-K94346523	LSM-8052		54618892	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21+,26-/m0/s1	BLVPPUGYXWKWFY-UZINWLIJSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)C#CC4(O)CCCC4	BroadT	BRD-K94346523	BRD-K94346523-001-01-5	Broad Institute of MIT and Harvard	BRD-K94346523			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21+,26-/m0/s1	BLVPPUGYXWKWFY-UZINWLIJSA-N	571.235221244							96673
BRD-K82881395	LSM-7914		54618757	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20+,25-/m0/s1	QUERDMQYNZTGQF-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K82881395	BRD-K82881395-001-01-0	Broad Institute of MIT and Harvard	BRD-K82881395			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20+,25-/m0/s1	QUERDMQYNZTGQF-DFIYOIEZSA-N	552.184268958							96535
BRD-K00133896	LSM-6862		54618905	InChI=1S/C26H33N3O4S/c1-18-14-29(19(2)17-30)34(31,32)26-10-9-23(22-6-4-5-21(11-22)13-27)12-24(26)33-25(18)16-28(3)15-20-7-8-20/h4-6,9-12,18-20,25,30H,7-8,14-17H2,1-3H3/t18-,19+,25-/m0/s1	PCKDIUISIKHUJW-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K00133896	BRD-K00133896-001-01-9	Broad Institute of MIT and Harvard	BRD-K00133896			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C26H33N3O4S/c1-18-14-29(19(2)17-30)34(31,32)26-10-9-23(22-6-4-5-21(11-22)13-27)12-24(26)33-25(18)16-28(3)15-20-7-8-20/h4-6,9-12,18-20,25,30H,7-8,14-17H2,1-3H3/t18-,19+,25-/m0/s1	PCKDIUISIKHUJW-CEYNDMKZSA-N	483.219177256							95483
BRD-K43690686	LSM-7401		54618705	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21+,26+/m0/s1	BLVPPUGYXWKWFY-LZCXECNNSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)C#CC4(O)CCCC4	BroadT	BRD-K43690686	BRD-K43690686-001-01-1	Broad Institute of MIT and Harvard	BRD-K43690686			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21+,26+/m0/s1	BLVPPUGYXWKWFY-LZCXECNNSA-N	571.235221244							96022
CHEMBL2359660	LSM-7356	BRD-K39841630, SID131413828	54618728	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25-,31-/m0/s1	AXBJPSYRCLUHNL-PBANKSGMSA-N	C[C@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K39841630	BRD-K39841630-001-01-3	Broad Institute of MIT and Harvard	BRD-K39841630			C[C@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25-,31-/m0/s1	AXBJPSYRCLUHNL-PBANKSGMSA-N	562.250143026							95977
MLS003130183	LSM-6972	BRD-K09167509, SID99358832	46903581	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20-,25+/m1/s1	LMGISOPGJGQDCH-FHAGJXEFSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K09167509	BRD-K09167509-001-02-5	Broad Institute of MIT and Harvard	BRD-K09167509			CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20-,25+/m1/s1	LMGISOPGJGQDCH-FHAGJXEFSA-N	529.22465656							95593
BRD-K13898895	LSM-7036		54618866	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20+,24+/m0/s1	YTUJKVHLLCOJEP-DCLXLUIPSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K13898895	BRD-K13898895-001-01-3	Broad Institute of MIT and Harvard	BRD-K13898895			CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20+,24+/m0/s1	YTUJKVHLLCOJEP-DCLXLUIPSA-N	499.214091876							95657
CHEMBL2131897	LSM-7928	SID85812192, BRD-K83879237	44505087	InChI=1S/C30H31F3N4O6/c1-17-13-37(18(2)15-38)28(39)23-10-20(19-5-4-6-21(9-19)30(31,32)33)12-34-27(23)43-26(17)14-36(3)29(40)35-22-7-8-24-25(11-22)42-16-41-24/h4-12,17-18,26,38H,13-16H2,1-3H3,(H,35,40)/t17-,18+,26-/m0/s1	CDAZLJBZDLYAFI-DFXHWTJYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4ncc(cc4C1=O)c5cccc(c5)C(F)(F)F	BroadT	BRD-K83879237	BRD-K83879237-001-01-5	Broad Institute of MIT and Harvard	BRD-K83879237			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2ncc(cc2C1=O)-c1cccc(c1)C(F)(F)F	InChI=1S/C30H31F3N4O6/c1-17-13-37(18(2)15-38)28(39)23-10-20(19-5-4-6-21(9-19)30(31,32)33)12-34-27(23)43-26(17)14-36(3)29(40)35-22-7-8-24-25(11-22)42-16-41-24/h4-12,17-18,26,38H,13-16H2,1-3H3,(H,35,40)/t17-,18+,26-/m0/s1	CDAZLJBZDLYAFI-DFXHWTJYSA-N	600.219569352							96549
CHEMBL3183177	LSM-7977	BRD-K87886529	54618996	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20+,26-/m0/s1	SWUCWXMCDNCWDY-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K87886529	BRD-K87886529-001-01-3	Broad Institute of MIT and Harvard	BRD-K87886529			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20+,26-/m0/s1	SWUCWXMCDNCWDY-UNVFRBQDSA-N	557.255956688							96598
BRD-K99808647	LSM-8102		54618914	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18-,24+/m0/s1	AHLJWBISIVXZIU-LLJLJFOGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccc(F)cc3	BroadT	BRD-K99808647	BRD-K99808647-001-01-0	Broad Institute of MIT and Harvard	BRD-K99808647			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(C)=O)Oc2cc(ccc2S1(=O)=O)C#Cc1ccc(F)cc1	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18-,24+/m0/s1	AHLJWBISIVXZIU-LLJLJFOGSA-N	488.178120938							96723
BRD-K18754288	LSM-7090		54618873	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21+,26-/m1/s1	BLVPPUGYXWKWFY-YZIHRLCOSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)C#CC4(O)CCCC4	BroadT	BRD-K18754288	BRD-K18754288-001-01-8	Broad Institute of MIT and Harvard	BRD-K18754288			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21+,26-/m1/s1	BLVPPUGYXWKWFY-YZIHRLCOSA-N	571.235221244							95711
BRD-K48840041	LSM-7477		54618797	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21+,25+/m1/s1	HVNBSBCCDAKDPU-CZSZKKDXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K48840041	BRD-K48840041-001-01-7	Broad Institute of MIT and Harvard	BRD-K48840041			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21+,25+/m1/s1	HVNBSBCCDAKDPU-CZSZKKDXSA-N	500.245726362							96098
BRD-K94597513	LSM-8057		54618956	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20-,26-/m0/s1	JEPVQKOMBMDDOB-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4F	BroadT	BRD-K94597513	BRD-K94597513-001-01-5	Broad Institute of MIT and Harvard	BRD-K94597513			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1F	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20-,26-/m0/s1	JEPVQKOMBMDDOB-DYLHXGEVSA-N	513.209755424							96678
BRD-K85301720	LSM-7943		54618814	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18+,24+/m0/s1	OLGOXCLKPVLFFW-HOOSLVGPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ncc(cc3C1=O)c4ccncc4	BroadT	BRD-K85301720	BRD-K85301720-001-01-2	Broad Institute of MIT and Harvard	BRD-K85301720			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ncc(cc2C1=O)-c1ccncc1	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18+,24+/m0/s1	OLGOXCLKPVLFFW-HOOSLVGPSA-N	528.184268958							96564
BRD-K00799745	LSM-6867		54618981	InChI=1S/C26H33N3O4S/c1-18-14-29(19(2)17-30)34(31,32)26-10-9-23(22-6-4-5-21(11-22)13-27)12-24(26)33-25(18)16-28(3)15-20-7-8-20/h4-6,9-12,18-20,25,30H,7-8,14-17H2,1-3H3/t18-,19-,25-/m0/s1	PCKDIUISIKHUJW-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K00799745	BRD-K00799745-001-01-0	Broad Institute of MIT and Harvard	BRD-K00799745			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C26H33N3O4S/c1-18-14-29(19(2)17-30)34(31,32)26-10-9-23(22-6-4-5-21(11-22)13-27)12-24(26)33-25(18)16-28(3)15-20-7-8-20/h4-6,9-12,18-20,25,30H,7-8,14-17H2,1-3H3/t18-,19-,25-/m0/s1	PCKDIUISIKHUJW-MHPIHPPYSA-N	483.219177256							95488
CHEMBL2135757	LSM-7847	BRD-K76996839, SID131413963	54618859	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21-,25-/m1/s1	WKIFXSCDZKRENS-DNRQZRRGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K76996839	BRD-K76996839-001-01-8	Broad Institute of MIT and Harvard	BRD-K76996839			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21-,25-/m1/s1	WKIFXSCDZKRENS-DNRQZRRGSA-N	541.22465656							96468
CHEMBL3184914	LSM-7791	BRD-K70744040	54618726	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20-,26-/m1/s1	SWUCWXMCDNCWDY-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K70744040	BRD-K70744040-001-01-3	Broad Institute of MIT and Harvard	BRD-K70744040			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20-,26-/m1/s1	SWUCWXMCDNCWDY-XMERXJNXSA-N	557.255956688							96412
BRD-K63448182	LSM-7695		54618880	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27+/m0/s1	NAXOUWLFRBOFLI-OWOAZTCBSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)S(=O)(=O)c4ccc(F)cc4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K63448182	BRD-K63448182-001-01-8	Broad Institute of MIT and Harvard	BRD-K63448182			COc1ccccc1-c1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20-,27+/m0/s1	NAXOUWLFRBOFLI-OWOAZTCBSA-N	592.171320996							96316
BRD-K76321890	LSM-7835		54618839	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27-/m1/s1	NAXOUWLFRBOFLI-IOKPGSKQSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)S(=O)(=O)c4ccc(F)cc4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K76321890	BRD-K76321890-001-01-5	Broad Institute of MIT and Harvard	BRD-K76321890			COc1ccccc1-c1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27-/m1/s1	NAXOUWLFRBOFLI-IOKPGSKQSA-N	592.171320996							96456
BRD-K15761174	LSM-7061		54618937	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21+,26-/m0/s1	CLQLHKYRPGBFMB-UZINWLIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccn4	BroadT	BRD-K15761174	BRD-K15761174-001-01-3	Broad Institute of MIT and Harvard	BRD-K15761174			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccn1	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21+,26-/m0/s1	CLQLHKYRPGBFMB-UZINWLIJSA-N	476.278741052							95682
BRD-K10098301-001-01-1	LSM-28112	BRD-K10098301	54618715	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21-,25-/m0/s1	WKIFXSCDZKRENS-WATLYSKOSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K10098301	BRD-K10098301-001-01-1	Broad Institute of MIT and Harvard	BRD-K10098301			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21-,25-/m0/s1	WKIFXSCDZKRENS-WATLYSKOSA-N	541.22465656							116657
CHEMBL2139355	LSM-7649	BRD-K60343011, SID131413821	54618721	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20-,26-/m0/s1	SWUCWXMCDNCWDY-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K60343011	BRD-K60343011-001-01-1	Broad Institute of MIT and Harvard	BRD-K60343011			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20-,26-/m0/s1	SWUCWXMCDNCWDY-DYLHXGEVSA-N	557.255956688							96270
BRD-K95852551	LSM-8075		54618945	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19-,23-/m0/s1	KVTAKNNJYPDOHV-YDHSSHFGSA-N	CC(C)C#Cc1cnc2O[C@@H](CN(C)Cc3cncnc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K95852551	BRD-K95852551-001-01-6	Broad Institute of MIT and Harvard	BRD-K95852551			CC(C)C#Cc1cnc2O[C@@H](CN(C)Cc3cncnc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19-,23-/m0/s1	KVTAKNNJYPDOHV-YDHSSHFGSA-N	451.258339966							96696
BRD-K91019833	LSM-8003		54618890	InChI=1S/C28H36N4O5/c1-18(2)11-12-21-13-22-26(29-14-21)37-25(19(3)15-32(27(22)34)20(4)17-33)16-31(5)28(35)30-23-9-7-8-10-24(23)36-6/h7-10,13-14,18-20,25,33H,15-17H2,1-6H3,(H,30,35)/t19-,20-,25+/m1/s1	KPXBVFREPGCPQF-FHAGJXEFSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)C#CC(C)C	BroadT	BRD-K91019833	BRD-K91019833-001-01-6	Broad Institute of MIT and Harvard	BRD-K91019833			COc1ccccc1NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC(C)C	InChI=1S/C28H36N4O5/c1-18(2)11-12-21-13-22-26(29-14-21)37-25(19(3)15-32(27(22)34)20(4)17-33)16-31(5)28(35)30-23-9-7-8-10-24(23)36-6/h7-10,13-14,18-20,25,33H,15-17H2,1-6H3,(H,30,35)/t19-,20-,25+/m1/s1	KPXBVFREPGCPQF-FHAGJXEFSA-N	508.268570292							96624
BRD-K11231529	LSM-6993		54618931	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22-,27-/m1/s1	JVNQANUBSNFBGV-VHFRWLAGSA-N	COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C#CCC(C)C)cc1	BroadT	BRD-K11231529	BRD-K11231529-001-01-3	Broad Institute of MIT and Harvard	BRD-K11231529			COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C#CCC(C)C)cc1	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22-,27-/m1/s1	JVNQANUBSNFBGV-VHFRWLAGSA-N	557.255956688							95614
CHEMBL2355345	LSM-7277	BRD-K33514849, SID131413896	54618795	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21-,28+/m1/s1	OYKBHWDUAQJSNT-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccncc5	BroadT	BRD-K33514849	BRD-K33514849-001-01-9	Broad Institute of MIT and Harvard	BRD-K33514849			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21-,28+/m1/s1	OYKBHWDUAQJSNT-CJYOKPGZSA-N	592.199170094							95898
BRD-K01060955	LSM-43353		54618921	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18-,23+/m0/s1	PICQTSXUFYQQHP-QSCGOKKNSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K01060955	BRD-K01060955-001-01-1	Broad Institute of MIT and Harvard	BRD-K01060955			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18-,23+/m0/s1	PICQTSXUFYQQHP-QSCGOKKNSA-N	505.204670044							
BRD-K02014458	LSM-6887		54618713	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20-,26+/m0/s1	DPWYORMJDFEMPA-CUVVAGTFSA-N	COc1ccc(cc1)C#Cc2cnc3O[C@H](CN(C)C(=O)CC4CC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K02014458	BRD-K02014458-001-01-9	Broad Institute of MIT and Harvard	BRD-K02014458			COc1ccc(cc1)C#Cc1cnc2O[C@H](CN(C)C(=O)CC3CC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20-,26+/m0/s1	DPWYORMJDFEMPA-CUVVAGTFSA-N	505.25767125							95508
BRD-K28922292	LSM-7220		54618867	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21-,26-/m1/s1	CLQLHKYRPGBFMB-IPVFLDMMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccn4	BroadT	BRD-K28922292	BRD-K28922292-001-01-3	Broad Institute of MIT and Harvard	BRD-K28922292			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccn1	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21-,26-/m1/s1	CLQLHKYRPGBFMB-IPVFLDMMSA-N	476.278741052							95841
BRD-K02341409	LSM-6891		54618861	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23+,28+/m0/s1	GOIFBKSVWMRRGJ-SXDGJLEOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K02341409	BRD-K02341409-001-01-6	Broad Institute of MIT and Harvard	BRD-K02341409			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23+,28+/m0/s1	GOIFBKSVWMRRGJ-SXDGJLEOSA-N	583.181077186							95512
BRD-K50126643	LSM-7493		54618759	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19+,24+/m1/s1	BUQVOPHSTBMFAQ-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)c4cccnc4	BroadT	BRD-K50126643	BRD-K50126643-001-01-8	Broad Institute of MIT and Harvard	BRD-K50126643			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)-c1cccnc1	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19+,24+/m1/s1	BUQVOPHSTBMFAQ-IMWIBFENSA-N	489.237604522							96114
BRD-K76132378	LSM-7833		54618987	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15+,18+/m0/s1	ZLBUSWVWPMDVDO-HDMKZQKVSA-N	COCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K76132378	BRD-K76132378-001-01-7	Broad Institute of MIT and Harvard	BRD-K76132378			COCC#Cc1cnc2O[C@H](CN(C)S(C)(=O)=O)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15+,18+/m0/s1	ZLBUSWVWPMDVDO-HDMKZQKVSA-N	439.177706368							96454
BRD-K19418666	LSM-7099		54618965	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18+,21-/m0/s1	JAWXPOQCFIAERV-UEXGIBASSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K19418666	BRD-K19418666-001-01-1	Broad Institute of MIT and Harvard	BRD-K19418666			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)(C)O	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18+,21-/m0/s1	JAWXPOQCFIAERV-UEXGIBASSA-N	495.240306624							95720
CHEMBL2356424	LSM-7756	SID131414074, BRD-K67944552	54618968	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25+,31+/m1/s1	AXBJPSYRCLUHNL-CYOUBLJMSA-N	C[C@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K67944552	BRD-K67944552-001-01-4	Broad Institute of MIT and Harvard	BRD-K67944552			C[C@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25+,31+/m1/s1	AXBJPSYRCLUHNL-CYOUBLJMSA-N	562.250143026							96377
CHEMBL2358386	LSM-7104	SID131413867, BRD-K19678433	54618766	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21-,28-/m0/s1	OYKBHWDUAQJSNT-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccncc5	BroadT	BRD-K19678433	BRD-K19678433-001-01-2	Broad Institute of MIT and Harvard	BRD-K19678433			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21-,28-/m0/s1	OYKBHWDUAQJSNT-CZBREUMFSA-N	592.199170094							95725
BRD-K14408783	LSM-43370		54618775	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23+,27+/m0/s1	BANHLTBDTXCVOB-FXTDCYOPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K14408783	BRD-K14408783-001-01-5	Broad Institute of MIT and Harvard	BRD-K14408783			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23+,27+/m0/s1	BANHLTBDTXCVOB-FXTDCYOPSA-N	557.255956688							
BRD-K61391179	LSM-7665		54618969	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21-,26-/m1/s1	BLVPPUGYXWKWFY-IPVFLDMMSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)C#CC4(O)CCCC4	BroadT	BRD-K61391179	BRD-K61391179-001-01-7	Broad Institute of MIT and Harvard	BRD-K61391179			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21-,26-/m1/s1	BLVPPUGYXWKWFY-IPVFLDMMSA-N	571.235221244							96286
BRD-K21980308	LSM-43376		54618823	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17-,21+/m0/s1	WESXQGCLCDUYEJ-LWUSATBJSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K21980308	BRD-K21980308-001-01-0	Broad Institute of MIT and Harvard	BRD-K21980308			C\C=C\c1cnc2O[C@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17-,21+/m0/s1	WESXQGCLCDUYEJ-LWUSATBJSA-N	445.25767125							
BRD-K57179401	LSM-7604		54618959	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21-,27-/m1/s1	FZGPYLHWXNIREJ-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K57179401	BRD-K57179401-001-01-2	Broad Institute of MIT and Harvard	BRD-K57179401			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21-,27-/m1/s1	FZGPYLHWXNIREJ-LGVUCKNBSA-N	542.245057646							96225
BRD-K17193648	LSM-7073		54618736	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21-,25+/m0/s1	UQYDBQHFUBHFMT-STWLZBDKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K17193648	BRD-K17193648-001-01-5	Broad Institute of MIT and Harvard	BRD-K17193648			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21-,25+/m0/s1	UQYDBQHFUBHFMT-STWLZBDKSA-N	492.273655672							95694
BRD-K37959950	LSM-43388		54618879	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17+,21+/m0/s1	WESXQGCLCDUYEJ-SIWTXCHWSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K37959950	BRD-K37959950-001-01-7	Broad Institute of MIT and Harvard	BRD-K37959950			C\C=C\c1cnc2O[C@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17+,21+/m0/s1	WESXQGCLCDUYEJ-SIWTXCHWSA-N	445.25767125							
BRD-K86482074	LSM-43433		54618886	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17+,21-/m0/s1	WESXQGCLCDUYEJ-UENYPMNWSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K86482074	BRD-K86482074-001-01-1	Broad Institute of MIT and Harvard	BRD-K86482074			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17+,21-/m0/s1	WESXQGCLCDUYEJ-UENYPMNWSA-N	445.25767125							
BRD-K44752001	LSM-7415		54618851	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19+,23-/m1/s1	CFEPXBTYRQWTEY-SELNLUPBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K44752001	BRD-K44752001-001-01-6	Broad Institute of MIT and Harvard	BRD-K44752001			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19+,23-/m1/s1	CFEPXBTYRQWTEY-SELNLUPBSA-N	552.207626292							96036
BRD-K47728674	LSM-7461		54618833	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15+,18-/m0/s1	ZLBUSWVWPMDVDO-DAYGRLMNSA-N	COCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)C)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K47728674	BRD-K47728674-001-01-9	Broad Institute of MIT and Harvard	BRD-K47728674			COCC#Cc1cnc2O[C@@H](CN(C)S(C)(=O)=O)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15+,18-/m0/s1	ZLBUSWVWPMDVDO-DAYGRLMNSA-N	439.177706368							96082
CHEMBL2359453	LSM-7391	BRD-K42581894, SID131414088	54618982	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25-,31-/m1/s1	AXBJPSYRCLUHNL-XDAUYTPDSA-N	C[C@@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K42581894	BRD-K42581894-001-01-1	Broad Institute of MIT and Harvard	BRD-K42581894			C[C@@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25-,31-/m1/s1	AXBJPSYRCLUHNL-XDAUYTPDSA-N	562.250143026							96012
BRD-K50360395	LSM-43406		54618783	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24-,29+/m0/s1	PPFWZCPDKUHMOP-VFZLWTGSSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K50360395	BRD-K50360395-001-01-3	Broad Institute of MIT and Harvard	BRD-K50360395			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24-,29+/m0/s1	PPFWZCPDKUHMOP-VFZLWTGSSA-N	520.239578342							
BRD-K13464529	LSM-7030		54618700	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20+,26-/m0/s1	DPWYORMJDFEMPA-UNVFRBQDSA-N	COc1ccc(cc1)C#Cc2cnc3O[C@@H](CN(C)C(=O)CC4CC4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K13464529	BRD-K13464529-001-01-8	Broad Institute of MIT and Harvard	BRD-K13464529			COc1ccc(cc1)C#Cc1cnc2O[C@@H](CN(C)C(=O)CC3CC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20+,26-/m0/s1	DPWYORMJDFEMPA-UNVFRBQDSA-N	505.25767125							95651
BRD-K44194212	LSM-7406		54618722	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19+,24+/m1/s1	KBQBGAWQEUXRRY-IMWIBFENSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K44194212	BRD-K44194212-001-01-6	Broad Institute of MIT and Harvard	BRD-K44194212			COCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19+,24+/m1/s1	KBQBGAWQEUXRRY-IMWIBFENSA-N	518.188685622							96027
BRD-K99039754-001-01-1	LSM-28113	BRD-K99039754	54618694	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21+,25-/m0/s1	UQYDBQHFUBHFMT-BKSPAHHJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K99039754	BRD-K99039754-001-01-1	Broad Institute of MIT and Harvard	BRD-K99039754			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21+,25-/m0/s1	UQYDBQHFUBHFMT-BKSPAHHJSA-N	492.273655672							116658
BRD-K82903423	LSM-43431		54618799	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24+,29-/m1/s1	PPFWZCPDKUHMOP-YREGGQMHSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K82903423	BRD-K82903423-001-01-8	Broad Institute of MIT and Harvard	BRD-K82903423			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24+,29-/m1/s1	PPFWZCPDKUHMOP-YREGGQMHSA-N	520.239578342							
BRD-K12438144	LSM-7012		54618994	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20+,24+/m1/s1	YTUJKVHLLCOJEP-NMMYMHLASA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K12438144	BRD-K12438144-001-01-8	Broad Institute of MIT and Harvard	BRD-K12438144			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20+,24+/m1/s1	YTUJKVHLLCOJEP-NMMYMHLASA-N	499.214091876							95633
BRD-K02201521	LSM-6889		54618788	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16+,19-/m0/s1	KFBFJFZZVCOITQ-FCEWJHQRSA-N	COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K02201521	BRD-K02201521-001-01-5	Broad Institute of MIT and Harvard	BRD-K02201521			COCC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)(C)O	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16+,19-/m0/s1	KFBFJFZZVCOITQ-FCEWJHQRSA-N	447.236935806							95510
BRD-K68670732	LSM-7766		54618760	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21+,27+/m1/s1	FZGPYLHWXNIREJ-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K68670732	BRD-K68670732-001-01-7	Broad Institute of MIT and Harvard	BRD-K68670732			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21+,27+/m1/s1	FZGPYLHWXNIREJ-BUEREQSYSA-N	542.245057646							96387
BRD-K85064040	LSM-7941		54618973	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19-,24+/m1/s1	KBQBGAWQEUXRRY-IECBHUPTSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K85064040	BRD-K85064040-001-01-9	Broad Institute of MIT and Harvard	BRD-K85064040			COCC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19-,24+/m1/s1	KBQBGAWQEUXRRY-IECBHUPTSA-N	518.188685622							96562
BRD-K14850613	LSM-7053		54618836	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22+,27+/m1/s1	JVNQANUBSNFBGV-VHSZZVNMSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)C#CCC(C)C)cc1	BroadT	BRD-K14850613	BRD-K14850613-001-01-4	Broad Institute of MIT and Harvard	BRD-K14850613			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)C#CCC(C)C)cc1	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22+,27+/m1/s1	JVNQANUBSNFBGV-VHSZZVNMSA-N	557.255956688							95674
CHEMBL3182162	LSM-43430	BRD-K80866161	54618815	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24-,29-/m0/s1	PPFWZCPDKUHMOP-ZBRISEINSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K80866161	BRD-K80866161-001-01-5	Broad Institute of MIT and Harvard	BRD-K80866161			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24-,29-/m0/s1	PPFWZCPDKUHMOP-ZBRISEINSA-N	520.239578342							
BRD-K47277477	LSM-43401		54618870	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18+,23+/m1/s1	PICQTSXUFYQQHP-XMFWOJDZSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K47277477	BRD-K47277477-001-01-6	Broad Institute of MIT and Harvard	BRD-K47277477			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18+,23+/m1/s1	PICQTSXUFYQQHP-XMFWOJDZSA-N	505.204670044							
BRD-K91684468	LSM-43435		54618781	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17+,21+/m1/s1	WESXQGCLCDUYEJ-RXTVBCQOSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K91684468	BRD-K91684468-001-01-9	Broad Institute of MIT and Harvard	BRD-K91684468			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17+,21+/m1/s1	WESXQGCLCDUYEJ-RXTVBCQOSA-N	445.25767125							
BRD-K56562216	LSM-7593		54618903	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21+,25-/m0/s1	HVNBSBCCDAKDPU-BKSPAHHJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K56562216	BRD-K56562216-001-01-5	Broad Institute of MIT and Harvard	BRD-K56562216			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21+,25-/m0/s1	HVNBSBCCDAKDPU-BKSPAHHJSA-N	500.245726362							96214
BRD-K63406313	LSM-7693		54618725	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20+,26-/m1/s1	JEPVQKOMBMDDOB-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4F	BroadT	BRD-K63406313	BRD-K63406313-001-01-8	Broad Institute of MIT and Harvard	BRD-K63406313			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1F	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20+,26-/m1/s1	JEPVQKOMBMDDOB-BVFVYWQFSA-N	513.209755424							96314
CHEMBL2355469	LSM-7494	BRD-K50282595, SID131414045	54618940	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21+,28+/m1/s1	OYKBHWDUAQJSNT-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccncc5	BroadT	BRD-K50282595	BRD-K50282595-001-01-7	Broad Institute of MIT and Harvard	BRD-K50282595			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21+,28+/m1/s1	OYKBHWDUAQJSNT-GGJMMHKRSA-N	592.199170094							96115
BRD-K64831080	LSM-7711		54618852	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21+,27+/m0/s1	FZGPYLHWXNIREJ-FYQCMVGJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K64831080	BRD-K64831080-001-01-7	Broad Institute of MIT and Harvard	BRD-K64831080			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21+,27+/m0/s1	FZGPYLHWXNIREJ-FYQCMVGJSA-N	542.245057646							96332
BRD-K75393430	LSM-7825		54618738	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19+,24-/m1/s1	BUQVOPHSTBMFAQ-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)c4cccnc4	BroadT	BRD-K75393430	BRD-K75393430-001-01-2	Broad Institute of MIT and Harvard	BRD-K75393430			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)-c1cccnc1	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19+,24-/m1/s1	BUQVOPHSTBMFAQ-YDIMBITNSA-N	489.237604522							96446
BRD-K48656305	LSM-7473		54618780	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20-,26+/m0/s1	SWUCWXMCDNCWDY-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K48656305	BRD-K48656305-001-01-8	Broad Institute of MIT and Harvard	BRD-K48656305			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20-,26+/m0/s1	SWUCWXMCDNCWDY-CUVVAGTFSA-N	557.255956688							96094
BRD-K18532833	LSM-7088		54618926	InChI=1S/C28H36N4O5/c1-18(2)11-12-21-13-22-26(29-14-21)37-25(19(3)15-32(27(22)34)20(4)17-33)16-31(5)28(35)30-23-9-7-8-10-24(23)36-6/h7-10,13-14,18-20,25,33H,15-17H2,1-6H3,(H,30,35)/t19-,20-,25-/m0/s1	KPXBVFREPGCPQF-RLSLOFABSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CC(C)C	BroadT	BRD-K18532833	BRD-K18532833-001-01-8	Broad Institute of MIT and Harvard	BRD-K18532833			COc1ccccc1NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC(C)C	InChI=1S/C28H36N4O5/c1-18(2)11-12-21-13-22-26(29-14-21)37-25(19(3)15-32(27(22)34)20(4)17-33)16-31(5)28(35)30-23-9-7-8-10-24(23)36-6/h7-10,13-14,18-20,25,33H,15-17H2,1-6H3,(H,30,35)/t19-,20-,25-/m0/s1	KPXBVFREPGCPQF-RLSLOFABSA-N	508.268570292							95709
BRD-K30738885	LSM-7249		54618807	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21-,25-/m0/s1	UQYDBQHFUBHFMT-WATLYSKOSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K30738885	BRD-K30738885-001-01-2	Broad Institute of MIT and Harvard	BRD-K30738885			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21-,25-/m0/s1	UQYDBQHFUBHFMT-WATLYSKOSA-N	492.273655672							95870
BRD-K73911580	LSM-7816		54618863	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18-,24-/m0/s1	AHLJWBISIVXZIU-XFAGBWLFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccc(F)cc3	BroadT	BRD-K73911580	BRD-K73911580-001-01-1	Broad Institute of MIT and Harvard	BRD-K73911580			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(C)=O)Oc2cc(ccc2S1(=O)=O)C#Cc1ccc(F)cc1	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18-,24-/m0/s1	AHLJWBISIVXZIU-XFAGBWLFSA-N	488.178120938							96437
BRD-K45794109	LSM-7430		54618893	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20-,24+/m1/s1	YTUJKVHLLCOJEP-REHUZNOOSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K45794109	BRD-K45794109-001-01-8	Broad Institute of MIT and Harvard	BRD-K45794109			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20-,24+/m1/s1	YTUJKVHLLCOJEP-REHUZNOOSA-N	499.214091876							96051
BRD-K18229142	LSM-7085		54618832	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19+,24+/m0/s1	KBQBGAWQEUXRRY-XLNZFTOWSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K18229142	BRD-K18229142-001-01-7	Broad Institute of MIT and Harvard	BRD-K18229142			COCC#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H31FN2O6S/c1-18-15-29(19(2)17-30)36(32,33)25-12-11-20(8-7-13-34-4)14-23(25)35-24(18)16-28(3)26(31)21-9-5-6-10-22(21)27/h5-6,9-12,14,18-19,24,30H,13,15-17H2,1-4H3/t18-,19+,24+/m0/s1	KBQBGAWQEUXRRY-XLNZFTOWSA-N	518.188685622							95706
BRD-K86693846	LSM-7957		54618846	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20-,25+/m0/s1	RXPBILAYEMNMFE-ZYLNGJIFSA-N	CCCC#Cc1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K86693846	BRD-K86693846-001-01-0	Broad Institute of MIT and Harvard	BRD-K86693846			CCCC#Cc1cnc2O[C@H](CN(C)Cc3ccccc3F)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20-,25+/m0/s1	RXPBILAYEMNMFE-ZYLNGJIFSA-N	467.258420178							96578
BRD-K35231228	LSM-7300		54618837	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19-,23-/m0/s1	YBQMRNJYNXSOKR-YDHSSHFGSA-N	CC(C)C#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K35231228	BRD-K35231228-001-01-9	Broad Institute of MIT and Harvard	BRD-K35231228			CC(C)C#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19-,23-/m0/s1	YBQMRNJYNXSOKR-YDHSSHFGSA-N	464.242355544							95921
BRD-K70018966	LSM-7786		54618727	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21+,27-/m0/s1	FZGPYLHWXNIREJ-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K70018966	BRD-K70018966-001-01-2	Broad Institute of MIT and Harvard	BRD-K70018966			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21+,27-/m0/s1	FZGPYLHWXNIREJ-ISCCLHIJSA-N	542.245057646							96407
BRD-K54543443	LSM-43409		54618853	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23+,27+/m1/s1	BANHLTBDTXCVOB-CWOUACLLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K54543443	BRD-K54543443-001-01-2	Broad Institute of MIT and Harvard	BRD-K54543443			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23+,27+/m1/s1	BANHLTBDTXCVOB-CWOUACLLSA-N	557.255956688							
BRD-K03683936	LSM-6909		54618997	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20+,26+/m0/s1	DPWYORMJDFEMPA-OUDXUNEISA-N	COc1ccc(cc1)C#Cc2cnc3O[C@H](CN(C)C(=O)CC4CC4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K03683936	BRD-K03683936-001-01-2	Broad Institute of MIT and Harvard	BRD-K03683936			COc1ccc(cc1)C#Cc1cnc2O[C@H](CN(C)C(=O)CC3CC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20+,26+/m0/s1	DPWYORMJDFEMPA-OUDXUNEISA-N	505.25767125							95530
BRD-K79345052	LSM-7890		54618747	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21+,25+/m0/s1	WKIFXSCDZKRENS-BPYKYCOYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K79345052	BRD-K79345052-001-01-5	Broad Institute of MIT and Harvard	BRD-K79345052			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21+,25+/m0/s1	WKIFXSCDZKRENS-BPYKYCOYSA-N	541.22465656							96511
BRD-K02985669	LSM-6902		54618791	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20-,25+/m0/s1	QUERDMQYNZTGQF-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K02985669	BRD-K02985669-001-01-5	Broad Institute of MIT and Harvard	BRD-K02985669			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20-,25+/m0/s1	QUERDMQYNZTGQF-ZYLNGJIFSA-N	552.184268958							95523
BRD-K31825071	LSM-7263		54618917	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20-,24-/m1/s1	XQGYHBQFJUCHTM-YOSAUDMPSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K31825071	BRD-K31825071-001-01-0	Broad Institute of MIT and Harvard	BRD-K31825071			COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20-,24-/m1/s1	XQGYHBQFJUCHTM-YOSAUDMPSA-N	487.214091876							95884
BRD-K53861829	LSM-7548		54618822	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20+,25-/m0/s1	LMGISOPGJGQDCH-DFIYOIEZSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K53861829	BRD-K53861829-001-01-3	Broad Institute of MIT and Harvard	BRD-K53861829			CCCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20+,25-/m0/s1	LMGISOPGJGQDCH-DFIYOIEZSA-N	529.22465656							96169
BRD-K24750847	LSM-7165		54618983	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15+,18+/m1/s1	ZLBUSWVWPMDVDO-VKJFTORMSA-N	COCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)C)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K24750847	BRD-K24750847-001-01-2	Broad Institute of MIT and Harvard	BRD-K24750847			COCC#Cc1cnc2O[C@@H](CN(C)S(C)(=O)=O)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15+,18+/m1/s1	ZLBUSWVWPMDVDO-VKJFTORMSA-N	439.177706368							95786
CHEMBL2359930	LSM-7980	BRD-K88033714, SID131413902	54618801	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23+,28-/m0/s1	GOIFBKSVWMRRGJ-JWZKTCGFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K88033714	BRD-K88033714-001-01-6	Broad Institute of MIT and Harvard	BRD-K88033714			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23+,28-/m0/s1	GOIFBKSVWMRRGJ-JWZKTCGFSA-N	583.181077186							96601
BRD-K17157581	LSM-7072		54618938	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19-,23-/m0/s1	CFEPXBTYRQWTEY-YDHSSHFGSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K17157581	BRD-K17157581-001-01-9	Broad Institute of MIT and Harvard	BRD-K17157581			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19-,23-/m0/s1	CFEPXBTYRQWTEY-YDHSSHFGSA-N	552.207626292							95693
BRD-K41761879	LSM-7376		54618883	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19+,23+/m1/s1	CFEPXBTYRQWTEY-MSYCTHLASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K41761879	BRD-K41761879-001-01-9	Broad Institute of MIT and Harvard	BRD-K41761879			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C25H36N4O6S2/c1-18-13-29(19(2)16-30)36(31,32)24-11-10-21(20-8-6-5-7-9-20)12-22(24)35-23(18)14-28(4)37(33,34)25-15-27(3)17-26-25/h8,10-12,15,17-19,23,30H,5-7,9,13-14,16H2,1-4H3/t18-,19+,23+/m1/s1	CFEPXBTYRQWTEY-MSYCTHLASA-N	552.207626292							95997
BRD-K23491633	LSM-7156		54618932	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19+,23-/m0/s1	YBQMRNJYNXSOKR-YYDVJCTNSA-N	CC(C)C#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K23491633	BRD-K23491633-001-01-2	Broad Institute of MIT and Harvard	BRD-K23491633			CC(C)C#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19+,23-/m0/s1	YBQMRNJYNXSOKR-YYDVJCTNSA-N	464.242355544							95777
CHEMBL3185684	LSM-7796	BRD-K71329594	54618828	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25+,31+/m0/s1	AXBJPSYRCLUHNL-DTTPJGKXSA-N	C[C@@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K71329594	BRD-K71329594-001-01-2	Broad Institute of MIT and Harvard	BRD-K71329594			C[C@@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25+,31+/m0/s1	AXBJPSYRCLUHNL-DTTPJGKXSA-N	562.250143026							96417
CHEMBL2362827	LSM-43371	BRD-K14518066, SID131414059	54618954	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18-,23-/m0/s1	PICQTSXUFYQQHP-IYHQUHIRSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K14518066	BRD-K14518066-001-01-9	Broad Institute of MIT and Harvard	BRD-K14518066			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18-,23-/m0/s1	PICQTSXUFYQQHP-IYHQUHIRSA-N	505.204670044							
BRD-K23011225	LSM-7148		54618796	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19-,25-/m1/s1	JPQXACXLPZYWDI-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K23011225	BRD-K23011225-001-01-2	Broad Institute of MIT and Harvard	BRD-K23011225			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19-,25-/m1/s1	JPQXACXLPZYWDI-MPCDZSKCSA-N	506.252920228							95769
BRD-K31310964	LSM-7255		54618920	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19+,25-/m1/s1	JPQXACXLPZYWDI-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K31310964	BRD-K31310964-001-01-3	Broad Institute of MIT and Harvard	BRD-K31310964			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19+,25-/m1/s1	JPQXACXLPZYWDI-HHJKRLRDSA-N	506.252920228							95876
BRD-K65997856	LSM-43352		54618712	InChI=1S/C23H29N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h4-12,16-17,21,24,27H,13-15H2,1-3H3/b10-9+/t16-,17+,21-/m0/s1	HURDRCJWSCCATG-RKXYDSBSSA-N	CNC[C@@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K65997856	BRD-K65997856-001-01-7	Broad Institute of MIT and Harvard	BRD-K65997856			CNC[C@@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H29N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h4-12,16-17,21,24,27H,13-15H2,1-3H3/b10-9+/t16-,17+,21-/m0/s1	HURDRCJWSCCATG-RKXYDSBSSA-N	395.220891818							
BRD-K52465094	LSM-7526		54618929	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17+,20+/m1/s1	LZCYHHOYYPSMEH-UWVAXJGDSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K52465094	BRD-K52465094-001-01-2	Broad Institute of MIT and Harvard	BRD-K52465094			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17+,20+/m1/s1	LZCYHHOYYPSMEH-UWVAXJGDSA-N	436.203192834							96147
BRD-K15513663	LSM-7057		54618898	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20-,25-/m1/s1	LMGISOPGJGQDCH-UMEGOILYSA-N	CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K15513663	BRD-K15513663-001-01-6	Broad Institute of MIT and Harvard	BRD-K15513663			CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20-,25-/m1/s1	LMGISOPGJGQDCH-UMEGOILYSA-N	529.22465656							95678
BRD-K14409255	LSM-7047		54618701	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19-,25+/m0/s1	JPQXACXLPZYWDI-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K14409255	BRD-K14409255-001-01-2	Broad Institute of MIT and Harvard	BRD-K14409255			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19-,25+/m0/s1	JPQXACXLPZYWDI-XHNVNVPESA-N	506.252920228							95668
BRD-K27957164	LSM-7206		54618950	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20-,24-/m0/s1	XQGYHBQFJUCHTM-SKPFHBQLSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K27957164	BRD-K27957164-001-01-5	Broad Institute of MIT and Harvard	BRD-K27957164			COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20-,24-/m0/s1	XQGYHBQFJUCHTM-SKPFHBQLSA-N	487.214091876							95827
CHEMBL2132498	LSM-7932	SID131413853, BRD-K84358317	54618752	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20-,24-/m1/s1	YTUJKVHLLCOJEP-YOSAUDMPSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K84358317	BRD-K84358317-001-01-2	Broad Institute of MIT and Harvard	BRD-K84358317			CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20-,24-/m1/s1	YTUJKVHLLCOJEP-YOSAUDMPSA-N	499.214091876							96553
BRD-K51004501	LSM-7502		54618934	InChI=1S/C26H33N3O4S/c1-18-14-29(19(2)17-30)34(31,32)26-10-9-23(22-6-4-5-21(11-22)13-27)12-24(26)33-25(18)16-28(3)15-20-7-8-20/h4-6,9-12,18-20,25,30H,7-8,14-17H2,1-3H3/t18-,19-,25-/m1/s1	PCKDIUISIKHUJW-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3cc(ccc3S1(=O)=O)c4cccc(c4)C#N	BroadT	BRD-K51004501	BRD-K51004501-001-01-7	Broad Institute of MIT and Harvard	BRD-K51004501			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C#N	InChI=1S/C26H33N3O4S/c1-18-14-29(19(2)17-30)34(31,32)26-10-9-23(22-6-4-5-21(11-22)13-27)12-24(26)33-25(18)16-28(3)15-20-7-8-20/h4-6,9-12,18-20,25,30H,7-8,14-17H2,1-3H3/t18-,19-,25-/m1/s1	PCKDIUISIKHUJW-MPCDZSKCSA-N	483.219177256							96123
BRD-K16480639	LSM-7068		54618742	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20+,25-/m1/s1	QUERDMQYNZTGQF-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K16480639	BRD-K16480639-001-01-8	Broad Institute of MIT and Harvard	BRD-K16480639			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20+,25-/m1/s1	QUERDMQYNZTGQF-OHUGHZGNSA-N	552.184268958							95689
BRD-K29107762	LSM-7222		54618971	InChI=1S/C28H36N4O5/c1-18(2)11-12-21-13-22-26(29-14-21)37-25(19(3)15-32(27(22)34)20(4)17-33)16-31(5)28(35)30-23-9-7-8-10-24(23)36-6/h7-10,13-14,18-20,25,33H,15-17H2,1-6H3,(H,30,35)/t19-,20-,25+/m0/s1	KPXBVFREPGCPQF-ZYLNGJIFSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CC(C)C	BroadT	BRD-K29107762	BRD-K29107762-001-01-1	Broad Institute of MIT and Harvard	BRD-K29107762			COc1ccccc1NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC(C)C	InChI=1S/C28H36N4O5/c1-18(2)11-12-21-13-22-26(29-14-21)37-25(19(3)15-32(27(22)34)20(4)17-33)16-31(5)28(35)30-23-9-7-8-10-24(23)36-6/h7-10,13-14,18-20,25,33H,15-17H2,1-6H3,(H,30,35)/t19-,20-,25+/m0/s1	KPXBVFREPGCPQF-ZYLNGJIFSA-N	508.268570292							95843
CHEMBL2142699	LSM-7079	BRD-K17619044, SID131413823	54618723	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21+,25-/m1/s1	WKIFXSCDZKRENS-TYBLODHISA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K17619044	BRD-K17619044-001-01-9	Broad Institute of MIT and Harvard	BRD-K17619044			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccnc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21+,25-/m1/s1	WKIFXSCDZKRENS-TYBLODHISA-N	541.22465656							95700
BRD-K18071543	LSM-7084		54618924	InChI=1S/C28H36N4O5/c1-18(2)11-12-21-13-22-26(29-14-21)37-25(19(3)15-32(27(22)34)20(4)17-33)16-31(5)28(35)30-23-9-7-8-10-24(23)36-6/h7-10,13-14,18-20,25,33H,15-17H2,1-6H3,(H,30,35)/t19-,20+,25+/m0/s1	KPXBVFREPGCPQF-WZOHSFFVSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2Oc3ncc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)C#CC(C)C	BroadT	BRD-K18071543	BRD-K18071543-001-01-8	Broad Institute of MIT and Harvard	BRD-K18071543			COc1ccccc1NC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC(C)C	InChI=1S/C28H36N4O5/c1-18(2)11-12-21-13-22-26(29-14-21)37-25(19(3)15-32(27(22)34)20(4)17-33)16-31(5)28(35)30-23-9-7-8-10-24(23)36-6/h7-10,13-14,18-20,25,33H,15-17H2,1-6H3,(H,30,35)/t19-,20+,25+/m0/s1	KPXBVFREPGCPQF-WZOHSFFVSA-N	508.268570292							95705
BRD-K97301290-001-01-8	LSM-44254	BRD-K97301290	54618693	InChI=1S/C23H29N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h4-12,16-17,21,24,27H,13-15H2,1-3H3/b10-9+/t16-,17+,21-/m1/s1	HURDRCJWSCCATG-QXBUYXJFSA-N	CNC[C@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K97301290	BRD-K97301290-001-01-8	Broad Institute of MIT and Harvard	BRD-K97301290			CNC[C@H]1Oc2ncc(\C=C\c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H29N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h4-12,16-17,21,24,27H,13-15H2,1-3H3/b10-9+/t16-,17+,21-/m1/s1	HURDRCJWSCCATG-QXBUYXJFSA-N	395.220891818							
BRD-K74843557	LSM-7821		54618819	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22-,27+/m1/s1	JVNQANUBSNFBGV-LOYIFYEOSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C#CCC(C)C)cc1	BroadT	BRD-K74843557	BRD-K74843557-001-01-4	Broad Institute of MIT and Harvard	BRD-K74843557			COc1ccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C#CCC(C)C)cc1	InChI=1S/C29H39N3O6S/c1-20(2)8-7-9-23-10-15-28-26(16-23)38-27(21(3)17-32(22(4)19-33)39(28,35)36)18-31(5)29(34)30-24-11-13-25(37-6)14-12-24/h10-16,20-22,27,33H,8,17-19H2,1-6H3,(H,30,34)/t21-,22-,27+/m1/s1	JVNQANUBSNFBGV-LOYIFYEOSA-N	557.255956688							96442
CHEMBL2136534	LSM-8100	BRD-K99732047, SID131413941	54618838	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25-,31-/m0/s1	AXBJPSYRCLUHNL-OSYMNAPVSA-N	C[C@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K99732047	BRD-K99732047-001-01-8	Broad Institute of MIT and Harvard	BRD-K99732047			C[C@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25-,31-/m0/s1	AXBJPSYRCLUHNL-OSYMNAPVSA-N	562.250143026							96721
BRD-K76227258	LSM-7834		54618792	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21+,25+/m0/s1	UQYDBQHFUBHFMT-BPYKYCOYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K76227258	BRD-K76227258-001-01-0	Broad Institute of MIT and Harvard	BRD-K76227258			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21+,25+/m0/s1	UQYDBQHFUBHFMT-BPYKYCOYSA-N	492.273655672							96455
BRD-K66975912	LSM-7742		54618947	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20-,26-/m1/s1	DPWYORMJDFEMPA-XMERXJNXSA-N	COc1ccc(cc1)C#Cc2cnc3O[C@H](CN(C)C(=O)CC4CC4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K66975912	BRD-K66975912-001-01-4	Broad Institute of MIT and Harvard	BRD-K66975912			COc1ccc(cc1)C#Cc1cnc2O[C@H](CN(C)C(=O)CC3CC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20-,26-/m1/s1	DPWYORMJDFEMPA-XMERXJNXSA-N	505.25767125							96363
BRD-K90108396	LSM-7996		54618896	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19+,23+/m1/s1	YBQMRNJYNXSOKR-MSYCTHLASA-N	CC(C)C#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K90108396	BRD-K90108396-001-01-7	Broad Institute of MIT and Harvard	BRD-K90108396			CC(C)C#Cc1cnc2O[C@@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H32N4O4/c1-17(2)8-9-20-11-22-24(28-12-20)34-23(18(3)14-30(26(22)33)19(4)16-31)15-29(5)25(32)21-7-6-10-27-13-21/h6-7,10-13,17-19,23,31H,14-16H2,1-5H3/t18-,19+,23+/m1/s1	YBQMRNJYNXSOKR-MSYCTHLASA-N	464.242355544							96617
BRD-K27558213	LSM-7195		54618787	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19+,25+/m1/s1	JPQXACXLPZYWDI-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K27558213	BRD-K27558213-001-01-2	Broad Institute of MIT and Harvard	BRD-K27558213			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19+,25+/m1/s1	JPQXACXLPZYWDI-WYEJZRMESA-N	506.252920228							95816
BRD-K13166308	LSM-7026		54618706	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21+,26-/m1/s1	CLQLHKYRPGBFMB-YZIHRLCOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccn4	BroadT	BRD-K13166308	BRD-K13166308-001-01-6	Broad Institute of MIT and Harvard	BRD-K13166308			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccn1	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21+,26-/m1/s1	CLQLHKYRPGBFMB-YZIHRLCOSA-N	476.278741052							95647
BRD-K87387784	LSM-7971		54618835	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16+,19-/m1/s1	KFBFJFZZVCOITQ-JTDSTZFVSA-N	COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K87387784	BRD-K87387784-001-01-2	Broad Institute of MIT and Harvard	BRD-K87387784			COCC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)(C)O	InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16+,19-/m1/s1	KFBFJFZZVCOITQ-JTDSTZFVSA-N	447.236935806							96592
BRD-K84405221	LSM-7933		54618998	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18+,21+/m1/s1	JAWXPOQCFIAERV-LQWHRVPQSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K84405221	BRD-K84405221-001-01-6	Broad Institute of MIT and Harvard	BRD-K84405221			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)(C)O	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18+,21+/m1/s1	JAWXPOQCFIAERV-LQWHRVPQSA-N	495.240306624							96554
BRD-K45803728	LSM-7431		54618967	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21+,25-/m1/s1	UQYDBQHFUBHFMT-TYBLODHISA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K45803728	BRD-K45803728-001-01-8	Broad Institute of MIT and Harvard	BRD-K45803728			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C28H36N4O4/c1-20-16-32(21(2)19-33)27(34)24-14-22(9-12-28(35)10-5-6-11-28)15-30-26(24)36-25(20)18-31(3)17-23-8-4-7-13-29-23/h4,7-8,13-15,20-21,25,33,35H,5-6,10-11,16-19H2,1-3H3/t20-,21+,25-/m1/s1	UQYDBQHFUBHFMT-TYBLODHISA-N	492.273655672							96052
BRD-K94766884	LSM-8060		54618840	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21-,25+/m1/s1	HVNBSBCCDAKDPU-OTPAQWSUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K94766884	BRD-K94766884-001-01-7	Broad Institute of MIT and Harvard	BRD-K94766884			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21-,25+/m1/s1	HVNBSBCCDAKDPU-OTPAQWSUSA-N	500.245726362							96681
BRD-K73928524	LSM-7817		54618877	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19-,25+/m1/s1	JPQXACXLPZYWDI-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K73928524	BRD-K73928524-001-01-4	Broad Institute of MIT and Harvard	BRD-K73928524			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19-,25+/m1/s1	JPQXACXLPZYWDI-RRQZXNHTSA-N	506.252920228							96438
BRD-K69142462	LSM-43421		54618882	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24+,29+/m1/s1	PPFWZCPDKUHMOP-YABOWLSTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K69142462	BRD-K69142462-001-01-2	Broad Institute of MIT and Harvard	BRD-K69142462			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24+,29+/m1/s1	PPFWZCPDKUHMOP-YABOWLSTSA-N	520.239578342							
BRD-K81464255	LSM-7908		54618888	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19+,25-/m0/s1	JPQXACXLPZYWDI-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K81464255	BRD-K81464255-001-01-5	Broad Institute of MIT and Harvard	BRD-K81464255			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19+,25-/m0/s1	JPQXACXLPZYWDI-CEYNDMKZSA-N	506.252920228							96529
BRD-K94292824	LSM-8050		54618748	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18-,21-/m0/s1	JAWXPOQCFIAERV-WFXMLNOXSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC(C)(C)O	BroadT	BRD-K94292824	BRD-K94292824-001-01-7	Broad Institute of MIT and Harvard	BRD-K94292824			CCCNC(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC(C)(C)O	InChI=1S/C24H37N3O6S/c1-7-12-25-23(29)26(6)15-21-17(2)14-27(18(3)16-28)34(31,32)22-9-8-19(13-20(22)33-21)10-11-24(4,5)30/h8-9,13,17-18,21,28,30H,7,12,14-16H2,1-6H3,(H,25,29)/t17-,18-,21-/m0/s1	JAWXPOQCFIAERV-WFXMLNOXSA-N	495.240306624							96671
MLS003130069	LSM-7973	SID99358653, SID131416908, BRD-K87434936	46903432	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25+,31+/m1/s1	AXBJPSYRCLUHNL-HSFWNXDSSA-N	C[C@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K87434936	BRD-K87434936-001-02-7	Broad Institute of MIT and Harvard	BRD-K87434936			C[C@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25+,31+/m1/s1	AXBJPSYRCLUHNL-HSFWNXDSSA-N	562.250143026							96594
BRD-K47224696-001-01-3	LSM-28115	BRD-K47224696	54618716	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20-,24+/m1/s1	XQGYHBQFJUCHTM-REHUZNOOSA-N	COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K47224696	BRD-K47224696-001-01-3	Broad Institute of MIT and Harvard	BRD-K47224696			COCC#Cc1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20-,24+/m1/s1	XQGYHBQFJUCHTM-REHUZNOOSA-N	487.214091876							116660
BRD-K21084378	LSM-7125		54618784	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27+/m0/s1	NAXOUWLFRBOFLI-ASHZAFPQSA-N	COc1ccccc1c2ccc3c(O[C@H](CN(C)S(=O)(=O)c4ccc(F)cc4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K21084378	BRD-K21084378-001-01-6	Broad Institute of MIT and Harvard	BRD-K21084378			COc1ccccc1-c1ccc2c(O[C@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27+/m0/s1	NAXOUWLFRBOFLI-ASHZAFPQSA-N	592.171320996							95746
BRD-K01204681	LSM-6876		54618949	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19-,25-/m0/s1	JPQXACXLPZYWDI-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)c4cccc(c4)C#N	BroadT	BRD-K01204681	BRD-K01204681-001-01-6	Broad Institute of MIT and Harvard	BRD-K01204681			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)-c1cccc(c1)C#N	InChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19-,25-/m0/s1	JPQXACXLPZYWDI-MHPIHPPYSA-N	506.252920228							95497
BRD-K84570482	LSM-7936		49835817	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21-,26+/m1/s1	BLVPPUGYXWKWFY-YPCDYVTLSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)C#CC4(O)CCCC4	BroadT	BRD-K84570482	BRD-K84570482-001-01-1	Broad Institute of MIT and Harvard	BRD-K84570482			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C29H37N3O7S/c1-20-17-32(21(2)19-33)28(34)25-15-22(11-14-29(35)12-5-6-13-29)16-30-27(25)39-26(20)18-31(3)40(36,37)24-9-7-23(38-4)8-10-24/h7-10,15-16,20-21,26,33,35H,5-6,12-13,17-19H2,1-4H3/t20-,21-,26+/m1/s1	BLVPPUGYXWKWFY-YPCDYVTLSA-N	571.235221244							96557
CHEMBL2357677	LSM-7738	BRD-K66698705, SID131413949	54618845	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21+,28+/m0/s1	OYKBHWDUAQJSNT-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccncc5	BroadT	BRD-K66698705	BRD-K66698705-001-01-3	Broad Institute of MIT and Harvard	BRD-K66698705			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21+,28+/m0/s1	OYKBHWDUAQJSNT-BALWLHIASA-N	592.199170094							96359
BRD-K88849270	LSM-7986		54618830	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18-,22-/m1/s1	GDMNEEJFLGDCSP-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K88849270	BRD-K88849270-001-01-1	Broad Institute of MIT and Harvard	BRD-K88849270			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18-,22-/m1/s1	GDMNEEJFLGDCSP-JBYIUTFZSA-N	480.248503564							96607
CHEMBL2356190	LSM-7399	BRD-K43440986, SID131413846	54618746	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23-,28+/m0/s1	GOIFBKSVWMRRGJ-UXWDXCIHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K43440986	BRD-K43440986-001-01-8	Broad Institute of MIT and Harvard	BRD-K43440986			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23-,28+/m0/s1	GOIFBKSVWMRRGJ-UXWDXCIHSA-N	583.181077186							96020
BRD-K29458822	LSM-7229		54618804	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15-,18+/m1/s1	ZLBUSWVWPMDVDO-RKVPGOIHSA-N	COCC#Cc1cnc2O[C@@H](CN(C)S(=O)(=O)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K29458822	BRD-K29458822-001-01-6	Broad Institute of MIT and Harvard	BRD-K29458822			COCC#Cc1cnc2O[C@@H](CN(C)S(C)(=O)=O)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15-,18+/m1/s1	ZLBUSWVWPMDVDO-RKVPGOIHSA-N	439.177706368							95850
CHEMBL3181907	LSM-7607	BRD-K57272712	54618735	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25+,31-/m0/s1	AXBJPSYRCLUHNL-NBTLCYJSSA-N	C[C@@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K57272712	BRD-K57272712-001-01-9	Broad Institute of MIT and Harvard	BRD-K57272712			C[C@@H](O)C#Cc1ccc2c(O[C@@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25+,31-/m0/s1	AXBJPSYRCLUHNL-NBTLCYJSSA-N	562.250143026							96228
BRD-K84522516	LSM-7935		54618820	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19-,24+/m0/s1	BUQVOPHSTBMFAQ-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)c4cccnc4	BroadT	BRD-K84522516	BRD-K84522516-001-01-2	Broad Institute of MIT and Harvard	BRD-K84522516			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)-c1cccnc1	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19-,24+/m0/s1	BUQVOPHSTBMFAQ-AXHZCLLHSA-N	489.237604522							96556
BRD-K66457675	LSM-8321		54618935	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18+,24-/m0/s1	OLGOXCLKPVLFFW-RHGYRFJNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ncc(cc3C1=O)c4ccncc4	BroadT	BRD-K66457675	BRD-K66457675-001-01-0	Broad Institute of MIT and Harvard	BRD-K66457675			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ncc(cc2C1=O)-c1ccncc1	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18+,24-/m0/s1	OLGOXCLKPVLFFW-RHGYRFJNSA-N	528.184268958							96942
CHEMBL2356894	LSM-8015	BRD-K92014291, SID131414016	54618912	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23+,28+/m1/s1	GOIFBKSVWMRRGJ-IWHLBADBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K92014291	BRD-K92014291-001-01-1	Broad Institute of MIT and Harvard	BRD-K92014291			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C29H33N3O6S2/c1-21-5-10-26(11-6-21)39(34,35)31(4)19-28-22(2)18-32(23(3)20-33)40(36,37)29-12-9-25(17-27(29)38-28)8-7-24-13-15-30-16-14-24/h5-6,9-17,22-23,28,33H,18-20H2,1-4H3/t22-,23+,28+/m1/s1	GOIFBKSVWMRRGJ-IWHLBADBSA-N	583.181077186							96636
BRD-K26006030	LSM-7178		54618800	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15-,18-/m1/s1	ZLBUSWVWPMDVDO-IIDMSEBBSA-N	COCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)C)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K26006030	BRD-K26006030-001-01-4	Broad Institute of MIT and Harvard	BRD-K26006030			COCC#Cc1cnc2O[C@H](CN(C)S(C)(=O)=O)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C20H29N3O6S/c1-14-11-23(15(2)13-24)20(25)17-9-16(7-6-8-28-4)10-21-19(17)29-18(14)12-22(3)30(5,26)27/h9-10,14-15,18,24H,8,11-13H2,1-5H3/t14-,15-,18-/m1/s1	ZLBUSWVWPMDVDO-IIDMSEBBSA-N	439.177706368							95799
BRD-K57218871	LSM-43413		54618939	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17-,21-/m0/s1	WESXQGCLCDUYEJ-WMGGKRPOSA-N	C\C=C\c1cnc2O[C@@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K57218871	BRD-K57218871-001-01-9	Broad Institute of MIT and Harvard	BRD-K57218871			C\C=C\c1cnc2O[C@@H](CN(C)C(=O)C3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17-,21-/m0/s1	WESXQGCLCDUYEJ-WMGGKRPOSA-N	445.25767125							
BRD-K60638204	LSM-7652		54618993	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18+,24-/m1/s1	OLGOXCLKPVLFFW-NXMSCROESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc3ncc(cc3C1=O)c4ccncc4	BroadT	BRD-K60638204	BRD-K60638204-001-01-1	Broad Institute of MIT and Harvard	BRD-K60638204			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)Oc2ncc(cc2C1=O)-c1ccncc1	InChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18+,24-/m1/s1	OLGOXCLKPVLFFW-NXMSCROESA-N	528.184268958							96273
BRD-K76582515	LSM-43423		54618964	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24-,29-/m1/s1	PPFWZCPDKUHMOP-SNIVGNPDSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K76582515	BRD-K76582515-001-01-7	Broad Institute of MIT and Harvard	BRD-K76582515			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C30H36N2O4S/c1-23-19-32(24(2)22-33)37(34,35)30-17-16-26(15-14-25-10-6-4-7-11-25)18-28(30)36-29(23)21-31(3)20-27-12-8-5-9-13-27/h4-18,23-24,29,33H,19-22H2,1-3H3/b15-14+/t23-,24-,29-/m1/s1	PPFWZCPDKUHMOP-SNIVGNPDSA-N	520.239578342							
BRD-K76893224	LSM-43424		54618948	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17+,21-/m1/s1	WESXQGCLCDUYEJ-FXIGTNJYSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K76893224	BRD-K76893224-001-01-0	Broad Institute of MIT and Harvard	BRD-K76893224			C\C=C\c1cnc2O[C@H](CN(C)C(=O)C3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C24H35N3O5/c1-5-6-18-11-20-22(25-12-18)32-21(16(2)13-27(24(20)30)17(3)15-28)14-26(4)23(29)19-7-9-31-10-8-19/h5-6,11-12,16-17,19,21,28H,7-10,13-15H2,1-4H3/b6-5+/t16-,17+,21-/m1/s1	WESXQGCLCDUYEJ-FXIGTNJYSA-N	445.25767125							
BRD-K66211423	LSM-7733		54618844	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18-,22-/m0/s1	GDMNEEJFLGDCSP-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K66211423	BRD-K66211423-001-01-6	Broad Institute of MIT and Harvard	BRD-K66211423			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cnccn2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C25H32N6O4/c1-17-14-31(18(2)16-32)24(33)20-11-19(7-6-10-29(3)4)12-28-23(20)35-22(17)15-30(5)25(34)21-13-26-8-9-27-21/h8-9,11-13,17-18,22,32H,10,14-16H2,1-5H3/t17-,18-,22-/m0/s1	GDMNEEJFLGDCSP-SPEDKVCISA-N	480.248503564							96354
BRD-K30316035	LSM-7239		54618825	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20-,26-/m0/s1	DPWYORMJDFEMPA-DYLHXGEVSA-N	COc1ccc(cc1)C#Cc2cnc3O[C@@H](CN(C)C(=O)CC4CC4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K30316035	BRD-K30316035-001-01-6	Broad Institute of MIT and Harvard	BRD-K30316035			COc1ccc(cc1)C#Cc1cnc2O[C@@H](CN(C)C(=O)CC3CC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C29H35N3O5/c1-19-16-32(20(2)18-33)29(35)25-13-23(8-5-21-9-11-24(36-4)12-10-21)15-30-28(25)37-26(19)17-31(3)27(34)14-22-6-7-22/h9-13,15,19-20,22,26,33H,6-7,14,16-18H2,1-4H3/t19-,20-,26-/m0/s1	DPWYORMJDFEMPA-DYLHXGEVSA-N	505.25767125							95860
BRD-K40904431	LSM-7368		54618767	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17-,20+/m1/s1	LZCYHHOYYPSMEH-HLIPFELVSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K40904431	BRD-K40904431-001-01-7	Broad Institute of MIT and Harvard	BRD-K40904431			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17-,20+/m1/s1	LZCYHHOYYPSMEH-HLIPFELVSA-N	436.203192834							95989
BRD-K48097043	LSM-7466		54618751	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20-,25+/m1/s1	RXPBILAYEMNMFE-FHAGJXEFSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K48097043	BRD-K48097043-001-01-2	Broad Institute of MIT and Harvard	BRD-K48097043			CCCC#Cc1cnc2O[C@@H](CN(C)Cc3ccccc3F)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20-,25+/m1/s1	RXPBILAYEMNMFE-FHAGJXEFSA-N	467.258420178							96087
BRD-K47810177	LSM-43403		54618977	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18-,23+/m1/s1	PICQTSXUFYQQHP-BULGAWEHSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K47810177	BRD-K47810177-001-01-7	Broad Institute of MIT and Harvard	BRD-K47810177			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32FN3O5S/c1-5-7-19-10-11-24-22(12-19)34-23(17(2)14-29(18(3)16-30)35(24,32)33)15-28(4)25(31)27-21-9-6-8-20(26)13-21/h5-13,17-18,23,30H,14-16H2,1-4H3,(H,27,31)/b7-5+/t17-,18-,23+/m1/s1	PICQTSXUFYQQHP-BULGAWEHSA-N	505.204670044							
BRD-K77424821	LSM-7857		54618743	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21-,26-/m0/s1	DSAVDXHQQHIKAO-WOVHNISZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K77424821	BRD-K77424821-001-01-0	Broad Institute of MIT and Harvard	BRD-K77424821			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21-,26-/m0/s1	DSAVDXHQQHIKAO-WOVHNISZSA-N	527.245392004							96478
BRD-K34102596	LSM-7291		54618813	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21+,25-/m0/s1	WKIFXSCDZKRENS-BKSPAHHJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc3cc(ccc3S1(=O)=O)C#CC4(O)CCCC4	BroadT	BRD-K34102596	BRD-K34102596-001-01-7	Broad Institute of MIT and Harvard	BRD-K34102596			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccnc2)Oc2cc(ccc2S1(=O)=O)C#CC1(O)CCCC1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(35,36)26-9-8-22(10-13-28(34)11-4-5-12-28)15-24(26)37-25(20)18-30(3)27(33)23-7-6-14-29-16-23/h6-9,14-16,20-21,25,32,34H,4-5,11-12,17-19H2,1-3H3/t20-,21+,25-/m0/s1	WKIFXSCDZKRENS-BKSPAHHJSA-N	541.22465656							95912
BRD-K22721982	LSM-7144		54618740	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19+,23+/m0/s1	KVTAKNNJYPDOHV-YCRNBWNJSA-N	CC(C)C#Cc1cnc2O[C@H](CN(C)Cc3cncnc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K22721982	BRD-K22721982-001-01-0	Broad Institute of MIT and Harvard	BRD-K22721982			CC(C)C#Cc1cnc2O[C@H](CN(C)Cc3cncnc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H33N5O3/c1-17(2)6-7-20-8-22-24(28-11-20)33-23(14-29(5)13-21-9-26-16-27-10-21)18(3)12-30(25(22)32)19(4)15-31/h8-11,16-19,23,31H,12-15H2,1-5H3/t18-,19+,23+/m0/s1	KVTAKNNJYPDOHV-YCRNBWNJSA-N	451.258339966							95765
BRD-K14212121	LSM-7041		54618827	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19-,24-/m0/s1	BUQVOPHSTBMFAQ-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc3ncc(cc3C1=O)c4cccnc4	BroadT	BRD-K14212121	BRD-K14212121-001-01-2	Broad Institute of MIT and Harvard	BRD-K14212121			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)-c1cccnc1	InChI=1S/C27H31N5O4/c1-18-15-32(19(2)17-33)26(34)23-12-21(20-8-7-11-28-13-20)14-29-25(23)36-24(18)16-31(3)27(35)30-22-9-5-4-6-10-22/h4-14,18-19,24,33H,15-17H2,1-3H3,(H,30,35)/t18-,19-,24-/m0/s1	BUQVOPHSTBMFAQ-JXQFQVJHSA-N	489.237604522							95662
BRD-K05209891	LSM-6927		44496854	InChI=1S/C28H28F3N3O5S2/c1-18-15-34(19(2)17-35)27(36)23-13-21(7-6-20-8-10-22(11-9-20)28(29,30)31)14-32-26(23)39-24(18)16-33(3)41(37,38)25-5-4-12-40-25/h4-5,8-14,18-19,24,35H,15-17H2,1-3H3/t18-,19+,24-/m0/s1	BZYDVGAUUQCKCK-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)Oc3ncc(cc3C1=O)C#Cc4ccc(cc4)C(F)(F)F	BroadT	BRD-K05209891	BRD-K05209891-001-01-7	Broad Institute of MIT and Harvard	BRD-K05209891			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)Oc2ncc(cc2C1=O)C#Cc1ccc(cc1)C(F)(F)F	InChI=1S/C28H28F3N3O5S2/c1-18-15-34(19(2)17-35)27(36)23-13-21(7-6-20-8-10-22(11-9-20)28(29,30)31)14-32-26(23)39-24(18)16-33(3)41(37,38)25-5-4-12-40-25/h4-5,8-14,18-19,24,35H,15-17H2,1-3H3/t18-,19+,24-/m0/s1	BZYDVGAUUQCKCK-GLDPYIMESA-N	607.142247006							95548
BRD-K36045097	LSM-7310		54618889	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21-,25+/m0/s1	HVNBSBCCDAKDPU-STWLZBDKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C#CCN(C)C	BroadT	BRD-K36045097	BRD-K36045097-001-01-0	Broad Institute of MIT and Harvard	BRD-K36045097			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#CCN(C)C	InChI=1S/C26H36N4O4S/c1-20-16-30(21(2)19-31)35(32,33)26-9-8-22(7-6-14-28(3)4)15-24(26)34-25(20)18-29(5)17-23-10-12-27-13-11-23/h8-13,15,20-21,25,31H,14,16-19H2,1-5H3/t20-,21-,25+/m0/s1	HVNBSBCCDAKDPU-STWLZBDKSA-N	500.245726362							95931
CHEMBL2354949	LSM-7514	BRD-K51757031, SID131413980	54618876	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25+,31-/m1/s1	AXBJPSYRCLUHNL-AOHZZOSCSA-N	C[C@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K51757031	BRD-K51757031-001-01-9	Broad Institute of MIT and Harvard	BRD-K51757031			C[C@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24+,25+,31-/m1/s1	AXBJPSYRCLUHNL-AOHZZOSCSA-N	562.250143026							96135
BRD-K17868036	LSM-7081		54618777	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20-,25+/m0/s1	LMGISOPGJGQDCH-ZYLNGJIFSA-N	CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K17868036	BRD-K17868036-001-01-2	Broad Institute of MIT and Harvard	BRD-K17868036			CCCC#Cc1cnc2O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H35N3O6S/c1-6-7-8-10-21-13-24-26(28-15-21)36-25(19(2)16-30(27(24)32)20(3)18-31)17-29(4)37(33,34)23-12-9-11-22(14-23)35-5/h9,11-15,19-20,25,31H,6-7,16-18H2,1-5H3/t19-,20-,25+/m0/s1	LMGISOPGJGQDCH-ZYLNGJIFSA-N	529.22465656							95702
BRD-K74885091	LSM-7822		54618831	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21+,28-/m0/s1	OYKBHWDUAQJSNT-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc4cc(ccc4S1(=O)=O)C#Cc5ccncc5	BroadT	BRD-K74885091	BRD-K74885091-001-01-8	Broad Institute of MIT and Harvard	BRD-K74885091			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C30H32N4O7S/c1-20-16-34(21(2)18-35)42(37,38)29-9-6-23(5-4-22-10-12-31-13-11-22)14-27(29)41-28(20)17-33(3)30(36)32-24-7-8-25-26(15-24)40-19-39-25/h6-15,20-21,28,35H,16-19H2,1-3H3,(H,32,36)/t20-,21+,28-/m0/s1	OYKBHWDUAQJSNT-GTNJKRJXSA-N	592.199170094							96443
BRD-K93958918	LSM-8046		54618768	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17-,20-/m1/s1	LZCYHHOYYPSMEH-MBOZVWFJSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CC3(O)CCCC3	BroadT	BRD-K93958918	BRD-K93958918-001-01-1	Broad Institute of MIT and Harvard	BRD-K93958918			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CC1(O)CCCC1	InChI=1S/C22H32N2O5S/c1-16-14-24(17(2)15-25)30(27,28)21-7-6-18(8-11-22(26)9-4-5-10-22)12-19(21)29-20(16)13-23-3/h6-7,12,16-17,20,23,25-26H,4-5,9-10,13-15H2,1-3H3/t16-,17-,20-/m1/s1	LZCYHHOYYPSMEH-MBOZVWFJSA-N	436.203192834							96667
BRD-K56961909	LSM-7597		54618778	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21-,27+/m0/s1	FZGPYLHWXNIREJ-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K56961909	BRD-K56961909-001-01-1	Broad Institute of MIT and Harvard	BRD-K56961909			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C29H38N2O6S/c1-20-16-31(21(2)19-32)38(35,36)28-13-12-24(23-9-5-4-6-10-23)15-26(28)37-27(20)18-30(3)17-22-8-7-11-25(14-22)29(33)34/h7-9,11-15,20-21,27,32H,4-6,10,16-19H2,1-3H3,(H,33,34)/t20-,21-,27+/m0/s1	FZGPYLHWXNIREJ-NOMHHCBYSA-N	542.245057646							96218
BRD-K69429207	LSM-7774		54618714	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18+,24+/m0/s1	AHLJWBISIVXZIU-HOOSLVGPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccc(F)cc3	BroadT	BRD-K69429207	BRD-K69429207-001-01-3	Broad Institute of MIT and Harvard	BRD-K69429207			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(C)=O)Oc2cc(ccc2S1(=O)=O)C#Cc1ccc(F)cc1	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18+,24+/m0/s1	AHLJWBISIVXZIU-HOOSLVGPSA-N	488.178120938							96395
BRD-K94974633	LSM-8064		54618953	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21-,26+/m0/s1	CLQLHKYRPGBFMB-ISJBWFOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCC2)Oc3ncc(cc3C1=O)C#Cc4ccccn4	BroadT	BRD-K94974633	BRD-K94974633-001-01-1	Broad Institute of MIT and Harvard	BRD-K94974633			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCC2)Oc2ncc(cc2C1=O)C#Cc1ccccn1	InChI=1S/C28H36N4O3/c1-20-16-32(21(2)19-33)28(34)25-14-23(11-12-24-10-6-7-13-29-24)15-30-27(25)35-26(20)18-31(3)17-22-8-4-5-9-22/h6-7,10,13-15,20-22,26,33H,4-5,8-9,16-19H2,1-3H3/t20-,21-,26+/m0/s1	CLQLHKYRPGBFMB-ISJBWFOZSA-N	476.278741052							96685
BRD-K38588505	LSM-7341		54618992	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18+,24+/m1/s1	AHLJWBISIVXZIU-YTZAWJCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccc(F)cc3	BroadT	BRD-K38588505	BRD-K38588505-001-01-3	Broad Institute of MIT and Harvard	BRD-K38588505			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(C)=O)Oc2cc(ccc2S1(=O)=O)C#Cc1ccc(F)cc1	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18+,24+/m1/s1	AHLJWBISIVXZIU-YTZAWJCFSA-N	488.178120938							95962
BRD-K67291850	LSM-7747		54618986	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21+,26+/m0/s1	DSAVDXHQQHIKAO-LZCXECNNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3cc(ccc3S1(=O)=O)C4=CCCCC4	BroadT	BRD-K67291850	BRD-K67291850-001-01-9	Broad Institute of MIT and Harvard	BRD-K67291850			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1	InChI=1S/C28H37N3O5S/c1-20-17-31(21(2)19-32)37(34,35)27-10-9-24(23-7-5-4-6-8-23)16-25(27)36-26(20)18-30(3)28(33)15-22-11-13-29-14-12-22/h7,9-14,16,20-21,26,32H,4-6,8,15,17-19H2,1-3H3/t20-,21+,26+/m0/s1	DSAVDXHQQHIKAO-LZCXECNNSA-N	527.245392004							96368
BRD-K07852185	LSM-6958		54618885	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20-,24-/m0/s1	YTUJKVHLLCOJEP-SKPFHBQLSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K07852185	BRD-K07852185-001-01-7	Broad Institute of MIT and Harvard	BRD-K07852185			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20-,24-/m0/s1	YTUJKVHLLCOJEP-SKPFHBQLSA-N	499.214091876							95579
BRD-K54347561	LSM-7556		54618854	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20+,24+/m0/s1	XQGYHBQFJUCHTM-DCLXLUIPSA-N	COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K54347561	BRD-K54347561-001-01-4	Broad Institute of MIT and Harvard	BRD-K54347561			COCC#Cc1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H33N3O5S/c1-19-15-28(20(2)18-29)34(30,31)25-11-10-21(8-7-13-32-4)14-23(25)33-24(19)17-27(3)16-22-9-5-6-12-26-22/h5-6,9-12,14,19-20,24,29H,13,15-18H2,1-4H3/t19-,20+,24+/m0/s1	XQGYHBQFJUCHTM-DCLXLUIPSA-N	487.214091876							96177
BRD-K98970645	LSM-8094		54618817	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25+,31-/m1/s1	AXBJPSYRCLUHNL-RXDUGQIKSA-N	C[C@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K98970645	BRD-K98970645-001-01-1	Broad Institute of MIT and Harvard	BRD-K98970645			C[C@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25+,31-/m1/s1	AXBJPSYRCLUHNL-RXDUGQIKSA-N	562.250143026							96715
BRD-K98238711	LSM-8089		54618707	InChI=1S/C28H36N4O5/c1-18(2)11-12-21-13-22-26(29-14-21)37-25(19(3)15-32(27(22)34)20(4)17-33)16-31(5)28(35)30-23-9-7-8-10-24(23)36-6/h7-10,13-14,18-20,25,33H,15-17H2,1-6H3,(H,30,35)/t19-,20+,25+/m1/s1	KPXBVFREPGCPQF-RNHFSVANSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2Oc3ncc(cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)C#CC(C)C	BroadT	BRD-K98238711	BRD-K98238711-001-01-2	Broad Institute of MIT and Harvard	BRD-K98238711			COc1ccccc1NC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC(C)C	InChI=1S/C28H36N4O5/c1-18(2)11-12-21-13-22-26(29-14-21)37-25(19(3)15-32(27(22)34)20(4)17-33)16-31(5)28(35)30-23-9-7-8-10-24(23)36-6/h7-10,13-14,18-20,25,33H,15-17H2,1-6H3,(H,30,35)/t19-,20+,25+/m1/s1	KPXBVFREPGCPQF-RNHFSVANSA-N	508.268570292							96710
BRD-K04284624	LSM-6918		54618952	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20+,26+/m1/s1	SWUCWXMCDNCWDY-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K04284624	BRD-K04284624-001-01-5	Broad Institute of MIT and Harvard	BRD-K04284624			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C29H39N3O6S/c1-19-16-32(20(2)18-33)39(36,37)27-14-13-24(21-9-11-23(12-10-21)28(34)30(3)4)15-25(27)38-26(19)17-31(5)29(35)22-7-6-8-22/h9-15,19-20,22,26,33H,6-8,16-18H2,1-5H3/t19-,20+,26+/m1/s1	SWUCWXMCDNCWDY-GOHWNWGWSA-N	557.255956688							95539
BRD-K12263461	LSM-7009		54618816	InChI=1S/C24H29N3O4/c1-16-14-27(17(2)15-28)24(29)21-11-19(12-26-23(21)31-22(16)13-25-3)9-8-18-6-5-7-20(10-18)30-4/h5-7,10-12,16-17,22,25,28H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	FZSLNURVQGYNPU-HOIFWPIMSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc3cccc(OC)c3	BroadT	BRD-K12263461	BRD-K12263461-001-01-5	Broad Institute of MIT and Harvard	BRD-K12263461			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc1cccc(OC)c1	InChI=1S/C24H29N3O4/c1-16-14-27(17(2)15-28)24(29)21-11-19(12-26-23(21)31-22(16)13-25-3)9-8-18-6-5-7-20(10-18)30-4/h5-7,10-12,16-17,22,25,28H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	FZSLNURVQGYNPU-HOIFWPIMSA-N	423.215806438							95630
BRD-K50696746	LSM-7498		54618702	InChI=1S/C24H29N3O4/c1-16-14-27(17(2)15-28)24(29)21-11-19(12-26-23(21)31-22(16)13-25-3)9-8-18-6-5-7-20(10-18)30-4/h5-7,10-12,16-17,22,25,28H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	FZSLNURVQGYNPU-DRSNIGMVSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc3cccc(OC)c3	BroadT	BRD-K50696746	BRD-K50696746-001-01-6	Broad Institute of MIT and Harvard	BRD-K50696746			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc1cccc(OC)c1	InChI=1S/C24H29N3O4/c1-16-14-27(17(2)15-28)24(29)21-11-19(12-26-23(21)31-22(16)13-25-3)9-8-18-6-5-7-20(10-18)30-4/h5-7,10-12,16-17,22,25,28H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	FZSLNURVQGYNPU-DRSNIGMVSA-N	423.215806438							96119
BRD-K02885102	LSM-6900		44505929	InChI=1S/C29H32N4O4/c1-19-15-33(20(2)18-34)29(35)24-12-23(26-13-22-6-4-5-7-25(22)36-26)14-31-28(24)37-27(19)17-32(3)16-21-8-10-30-11-9-21/h4-14,19-20,27,34H,15-18H2,1-3H3/t19-,20+,27-/m0/s1	VOAUTKMIJYSDGQ-VKIDHGPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc3ncc(cc3C1=O)c4oc5ccccc5c4	BroadT	BRD-K02885102	BRD-K02885102-001-01-2	Broad Institute of MIT and Harvard	BRD-K02885102			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)Oc2ncc(cc2C1=O)-c1cc2ccccc2o1	InChI=1S/C29H32N4O4/c1-19-15-33(20(2)18-34)29(35)24-12-23(26-13-22-6-4-5-7-25(22)36-26)14-31-28(24)37-27(19)17-32(3)16-21-8-10-30-11-9-21/h4-14,19-20,27,34H,15-18H2,1-3H3/t19-,20+,27-/m0/s1	VOAUTKMIJYSDGQ-VKIDHGPPSA-N	500.242355544							95521
MLS003130062	LSM-7536	BRD-K53185063, SID99358646	46903425	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25-,31-/m1/s1	AXBJPSYRCLUHNL-GTEDWBNGSA-N	C[C@@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K53185063	BRD-K53185063-001-02-0	Broad Institute of MIT and Harvard	BRD-K53185063			C[C@@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25-,31-/m1/s1	AXBJPSYRCLUHNL-GTEDWBNGSA-N	562.250143026							96157
CHEMBL2361224	LSM-6834	BRD-K46123637, SID131414068	54618962	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25+,31+/m0/s1	AXBJPSYRCLUHNL-CNFUJFEGSA-N	C[C@@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)c4ccccc4)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K46123637	BRD-K46123637-001-01-0	Broad Institute of MIT and Harvard	BRD-K46123637			C[C@@H](O)C#Cc1ccc2c(O[C@H](CN(C)Cc3ccc(cc3)-c3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C32H38N2O5S/c1-23-19-34(24(2)22-35)40(37,38)32-17-14-26(11-10-25(3)36)18-30(32)39-31(23)21-33(4)20-27-12-15-29(16-13-27)28-8-6-5-7-9-28/h5-9,12-18,23-25,31,35-36H,19-22H2,1-4H3/t23-,24-,25+,31+/m0/s1	AXBJPSYRCLUHNL-CNFUJFEGSA-N	562.250143026							95455
BRD-K33808757	LSM-7283		54618763	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20+,24-/m1/s1	YTUJKVHLLCOJEP-JXALWOEJSA-N	CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K33808757	BRD-K33808757-001-01-5	Broad Institute of MIT and Harvard	BRD-K33808757			CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccncc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20+,24-/m1/s1	YTUJKVHLLCOJEP-JXALWOEJSA-N	499.214091876							95904
BRD-K05357743	LSM-6929		54618980	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20-,25-/m0/s1	QUERDMQYNZTGQF-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4cccnc4	BroadT	BRD-K05357743	BRD-K05357743-001-01-4	Broad Institute of MIT and Harvard	BRD-K05357743			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1cccnc1	InChI=1S/C28H29FN4O5S/c1-19-16-33(20(2)18-34)28(35)23-13-22(11-10-21-7-6-12-30-14-21)15-31-27(23)38-25(19)17-32(3)39(36,37)26-9-5-4-8-24(26)29/h4-9,12-15,19-20,25,34H,16-18H2,1-3H3/t19-,20-,25-/m0/s1	QUERDMQYNZTGQF-RLSLOFABSA-N	552.184268958							95550
BRD-K78832647	LSM-7880		54618731	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18+,24-/m1/s1	AHLJWBISIVXZIU-NXMSCROESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C)Oc2cc(ccc2S1(=O)=O)C#Cc3ccc(F)cc3	BroadT	BRD-K78832647	BRD-K78832647-001-01-5	Broad Institute of MIT and Harvard	BRD-K78832647			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(C)=O)Oc2cc(ccc2S1(=O)=O)C#Cc1ccc(F)cc1	InChI=1S/C25H29FN2O5S/c1-17-14-28(18(2)16-29)34(31,32)25-12-9-21(6-5-20-7-10-22(26)11-8-20)13-23(25)33-24(17)15-27(4)19(3)30/h7-13,17-18,24,29H,14-16H2,1-4H3/t17-,18+,24-/m1/s1	AHLJWBISIVXZIU-NXMSCROESA-N	488.178120938							96501
BRD-K02559684	LSM-6893		54618733	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20+,24-/m0/s1	YTUJKVHLLCOJEP-ROKPMTFOSA-N	CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K02559684	BRD-K02559684-001-01-9	Broad Institute of MIT and Harvard	BRD-K02559684			CC(C)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C26H33N3O5S/c1-18(2)6-7-21-8-9-25-23(14-21)34-24(16-28(5)26(31)22-10-12-27-13-11-22)19(3)15-29(20(4)17-30)35(25,32)33/h8-14,18-20,24,30H,15-17H2,1-5H3/t19-,20+,24-/m0/s1	YTUJKVHLLCOJEP-ROKPMTFOSA-N	499.214091876							95514
BRD-K81291261	LSM-7907		54618907	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20+,26+/m0/s1	JEPVQKOMBMDDOB-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)Oc3cc(ccc3S1(=O)=O)c4ccccc4F	BroadT	BRD-K81291261	BRD-K81291261-001-01-4	Broad Institute of MIT and Harvard	BRD-K81291261			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1F	InChI=1S/C27H32FN3O4S/c1-19-15-31(20(2)18-32)36(33,34)27-11-10-22(23-8-4-5-9-24(23)28)13-25(27)35-26(19)17-30(3)16-21-7-6-12-29-14-21/h4-14,19-20,26,32H,15-18H2,1-3H3/t19-,20+,26+/m0/s1	JEPVQKOMBMDDOB-OUDXUNEISA-N	513.209755424							96528
BRD-K06380515	LSM-8800		54661001	InChI=1S/C28H32FN3O4/c29-21-10-3-2-9-18(21)19-11-12-22-25-24(28(36)30-13-4-1-5-14-30)20(16-33)23(15-31(22)27(19)35)32(25)26(34)17-7-6-8-17/h2-3,9-12,17,20,23-25,33H,1,4-8,13-16H2/t20-,23-,24+,25+/m0/s1	FMCRALLOZMCEMF-MNPDLOSFSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]([C@@H]1C(=O)N5CCCCC5)N2C(=O)C6CCC6	BroadT	BRD-K06380515	BRD-K06380515-001-01-1	Broad Institute of MIT and Harvard	BRD-K06380515			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]([C@@H]1C(=O)N1CCCCC1)N2C(=O)C1CCC1	InChI=1S/C28H32FN3O4/c29-21-10-3-2-9-18(21)19-11-12-22-25-24(28(36)30-13-4-1-5-14-30)20(16-33)23(15-31(22)27(19)35)32(25)26(34)17-7-6-8-17/h2-3,9-12,17,20,23-25,33H,1,4-8,13-16H2/t20-,23-,24+,25+/m0/s1	FMCRALLOZMCEMF-MNPDLOSFSA-N	493.237684734							97421
BRD-K28049955	LSM-10130		54660694	InChI=1S/C21H24N4O4S/c26-11-13-15-10-24-14(6-3-7-16(24)27)18(25(15)20(29)12-4-1-2-5-12)17(13)19(28)23-21-22-8-9-30-21/h3,6-9,12-13,15,17-18,26H,1-2,4-5,10-11H2,(H,22,23,28)/t13-,15-,17+,18+/m0/s1	WZQJIBXYFKEECF-OXXUSNJHSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)Nc4nccs4)N2C(=O)C5CCCC5	BroadT	BRD-K28049955	BRD-K28049955-001-01-3	Broad Institute of MIT and Harvard	BRD-K28049955			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)Nc1nccs1)N2C(=O)C1CCCC1	InChI=1S/C21H24N4O4S/c26-11-13-15-10-24-14(6-3-7-16(24)27)18(25(15)20(29)12-4-1-2-5-12)17(13)19(28)23-21-22-8-9-30-21/h3,6-9,12-13,15,17-18,26H,1-2,4-5,10-11H2,(H,22,23,28)/t13-,15-,17+,18+/m0/s1	WZQJIBXYFKEECF-OXXUSNJHSA-N	428.151825978							98751
BRD-K04058031	LSM-8677		54660667	InChI=1S/C24H28FN3O5S/c1-34(32,33)28-20-13-27-19(9-8-17(23(27)30)15-6-5-7-16(25)12-15)22(28)21(18(20)14-29)24(31)26-10-3-2-4-11-26/h5-9,12,18,20-22,29H,2-4,10-11,13-14H2,1H3/t18-,20-,21+,22+/m0/s1	WZTANFXJBQNXHQ-VXSCBNMQSA-N	CS(=O)(=O)N1[C@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@@H]1[C@@H]([C@H]2CO)C(=O)N5CCCCC5	BroadT	BRD-K04058031	BRD-K04058031-001-01-0	Broad Institute of MIT and Harvard	BRD-K04058031			CS(=O)(=O)N1[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N1CCCCC1	InChI=1S/C24H28FN3O5S/c1-34(32,33)28-20-13-27-19(9-8-17(23(27)30)15-6-5-7-16(25)12-15)22(28)21(18(20)14-29)24(31)26-10-3-2-4-11-26/h5-9,12,18,20-22,29H,2-4,10-11,13-14H2,1H3/t18-,20-,21+,22+/m0/s1	WZTANFXJBQNXHQ-VXSCBNMQSA-N	489.173369916							97298
BRD-K69464603	LSM-12665		54660833	InChI=1S/C26H29N5O4/c32-14-21-20-13-30-22(5-4-19(25(30)33)17-6-8-27-9-7-17)23(20)31(12-18-15-35-16-28-18)24(21)26(34)29-10-2-1-3-11-29/h4-9,15-16,20-21,23-24,32H,1-3,10-14H2/t20-,21-,23+,24-/m0/s1	KRPKJWJGWXBFEA-ZQRMPTRQSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@@H]2N(Cc5cocn5)[C@@H]1C(=O)N6CCCCC6	BroadT	BRD-K69464603	BRD-K69464603-001-01-0	Broad Institute of MIT and Harvard	BRD-K69464603			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]2N(Cc2cocn2)[C@@H]1C(=O)N1CCCCC1	InChI=1S/C26H29N5O4/c32-14-21-20-13-30-22(5-4-19(25(30)33)17-6-8-27-9-7-17)23(20)31(12-18-15-35-16-28-18)24(21)26(34)29-10-2-1-3-11-29/h4-9,15-16,20-21,23-24,32H,1-3,10-14H2/t20-,21-,23+,24-/m0/s1	KRPKJWJGWXBFEA-ZQRMPTRQSA-N	475.221954458							101299
BRD-K24626857	LSM-9923		54661015	InChI=1S/C28H30N4O4/c33-15-23-22-14-31-24(12-11-21(28(31)35)18-7-3-1-4-8-18)25(22)32(13-20-16-36-17-29-20)26(23)27(34)30-19-9-5-2-6-10-19/h2,5-7,9-12,16-17,22-23,25-26,33H,1,3-4,8,13-15H2,(H,30,34)/t22-,23-,25+,26-/m1/s1	NLGBQKPPTNRTKJ-VHCQPULKSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H]2N(Cc4cocn4)[C@H]1C(=O)Nc5ccccc5)C6=CCCCC6	BroadT	BRD-K24626857	BRD-K24626857-001-01-1	Broad Institute of MIT and Harvard	BRD-K24626857			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]2N(Cc2cocn2)[C@H]1C(=O)Nc1ccccc1	InChI=1S/C28H30N4O4/c33-15-23-22-14-31-24(12-11-21(28(31)35)18-7-3-1-4-8-18)25(22)32(13-20-16-36-17-29-20)26(23)27(34)30-19-9-5-2-6-10-19/h2,5-7,9-12,16-17,22-23,25-26,33H,1,3-4,8,13-15H2,(H,30,34)/t22-,23-,25+,26-/m1/s1	NLGBQKPPTNRTKJ-VHCQPULKSA-N	486.22670548							98544
BRD-K11415638	LSM-43449		54660882	InChI=1S/C30H31N3O3/c1-32-26-17-33-25(14-13-20(30(33)36)12-11-19-7-3-2-4-8-19)28(32)27(24(26)18-34)29(35)31-23-15-21-9-5-6-10-22(21)16-23/h2-14,23-24,26-28,34H,15-18H2,1H3,(H,31,35)/b12-11+/t24-,26-,27+,28+/m1/s1	LNRZCHBKBRYYMV-ACYUCAJWSA-N	CN1[C@@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NC5Cc6ccccc6C5	BroadT	BRD-K11415638	BRD-K11415638-001-01-0	Broad Institute of MIT and Harvard	BRD-K11415638			CN1[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NC1Cc2ccccc2C1	InChI=1S/C30H31N3O3/c1-32-26-17-33-25(14-13-20(30(33)36)12-11-19-7-3-2-4-8-19)28(32)27(24(26)18-34)29(35)31-23-15-21-9-5-6-10-22(21)16-23/h2-14,23-24,26-28,34H,15-18H2,1H3,(H,31,35)/b12-11+/t24-,26-,27+,28+/m1/s1	LNRZCHBKBRYYMV-ACYUCAJWSA-N	481.236541882							
BRD-K56975856	LSM-11878		54660858	InChI=1S/C27H26FN3O3/c28-22-8-4-3-7-18(22)19-9-10-23-24-20(14-31(23)26(19)33)21(15-32)25(29-24)27(34)30-12-11-16-5-1-2-6-17(16)13-30/h1-10,20-21,24-25,29,32H,11-15H2/t20-,21-,24+,25-/m1/s1	FZFLVCQZKXFTSN-KZKYLIHBSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]2N[C@H]1C(=O)N5CCc6ccccc6C5	BroadT	BRD-K56975856	BRD-K56975856-001-01-4	Broad Institute of MIT and Harvard	BRD-K56975856			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]2N[C@H]1C(=O)N1CCc2ccccc2C1	InChI=1S/C27H26FN3O3/c28-22-8-4-3-7-18(22)19-9-10-23-24-20(14-31(23)26(19)33)21(15-32)25(29-24)27(34)30-12-11-16-5-1-2-6-17(16)13-30/h1-10,20-21,24-25,29,32H,11-15H2/t20-,21-,24+,25-/m1/s1	FZFLVCQZKXFTSN-KZKYLIHBSA-N	459.195819922							100504
CHEMBL2357546	LSM-45028	BRD-M36167927	54660662	InChI=1S/C28H31N3O4/c1-2-5-18-10-11-23-24-21(15-30(23)26(18)33)22(16-32)25(31(24)27(34)19-8-9-19)28(35)29-13-12-17-6-3-4-7-20(17)14-29/h2-7,10-11,19,21-22,24-25,32H,8-9,12-16H2,1H3/t21-,22-,24+,25-/m1/s1	KWDFMNKBUPRJCJ-YQIMAOPZSA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3C(=O)C4CC4)C(=O)N5CCc6ccccc6C5	BroadT	BRD-M36167927	BRD-M36167927-001-01-6	Broad Institute of MIT and Harvard	BRD-M36167927		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N4CCc5ccccc5C4)N(C(=O)C4CC4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N4CCc5ccccc5C4)N(C(=O)C4CC4)[C@H]23)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N4CCc5ccccc5C4)N(C(=O)C4CC4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N4CCc5ccccc5C4)N(C(=O)C4CC4)[C@H]23)c1=O	InChI=1S/2C28H31N3O4/c2*1-2-5-18-10-11-23-24-21(15-30(23)26(18)33)22(16-32)25(31(24)27(34)19-8-9-19)28(35)29-13-12-17-6-3-4-7-20(17)14-29/h2*2-7,10-11,19,21-22,24-25,32H,8-9,12-16H2,1H3/b5-2+;5-2-/t2*21-,22-,24+,25-/m11/s1	LXQGCCZCUUVADU-ZWXZLVFNSA-N	473.231456502							103265
MLS005000174	LSM-8988	BRD-K09290524	54596120	InChI=1S/C21H25N3O5S/c1-13-6-4-7-14(10-13)30(28,29)24-17-11-23-16(8-5-9-18(23)26)20(24)19(15(17)12-25)21(27)22(2)3/h4-10,15,17,19-20,25H,11-12H2,1-3H3/t15-,17-,19+,20+/m0/s1	DIVLOMPALFPCBT-SMMRIJLZSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]1N2S(=O)(=O)c4cccc(C)c4	BroadT	BRD-K09290524	BRD-K09290524-001-01-8	Broad Institute of MIT and Harvard	BRD-K09290524			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2S(=O)(=O)c1cccc(C)c1	InChI=1S/C21H25N3O5S/c1-13-6-4-7-14(10-13)30(28,29)24-17-11-23-16(8-5-9-18(23)26)20(24)19(15(17)12-25)21(27)22(2)3/h4-10,15,17,19-20,25H,11-12H2,1-3H3/t15-,17-,19+,20+/m0/s1	DIVLOMPALFPCBT-SMMRIJLZSA-N	431.15149162							97609
BRD-K06745755	LSM-8828		54660945	InChI=1S/C26H28N4O3/c1-16(17-6-4-3-5-7-17)28-25(32)24-21(15-31)20-14-30-22(23(20)29(24)2)9-8-19(26(30)33)18-10-12-27-13-11-18/h3-13,16,20-21,23-24,31H,14-15H2,1-2H3,(H,28,32)/t16-,20-,21-,23+,24-/m1/s1	XRCXBUPUCMDVHO-DTVKDGSMSA-N	C[C@@H](NC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@H]2N1C)c5ccccc5	BroadT	BRD-K06745755	BRD-K06745755-001-01-4	Broad Institute of MIT and Harvard	BRD-K06745755			C[C@@H](NC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]2N1C)c1ccccc1	InChI=1S/C26H28N4O3/c1-16(17-6-4-3-5-7-17)28-25(32)24-21(15-31)20-14-30-22(23(20)29(24)2)9-8-19(26(30)33)18-10-12-27-13-11-18/h3-13,16,20-21,23-24,31H,14-15H2,1-2H3,(H,28,32)/t16-,20-,21-,23+,24-/m1/s1	XRCXBUPUCMDVHO-DTVKDGSMSA-N	444.216140796							97449
BRD-K30155575	LSM-10250		54660954	InChI=1S/C24H26N2O5/c1-31-24(30)22-18(13-27)17-12-25-19(21(17)26(22)20(28)11-14-7-8-14)10-9-16(23(25)29)15-5-3-2-4-6-15/h2-6,9-10,14,17-18,21-22,27H,7-8,11-13H2,1H3/t17-,18-,21+,22-/m1/s1	GLQBIINCSVPTPJ-RPHTVSPISA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@H]2N1C(=O)CC4CC4)c5ccccc5	BroadT	BRD-K30155575	BRD-K30155575-001-01-4	Broad Institute of MIT and Harvard	BRD-K30155575			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]2N1C(=O)CC1CC1	InChI=1S/C24H26N2O5/c1-31-24(30)22-18(13-27)17-12-25-19(21(17)26(22)20(28)11-14-7-8-14)10-9-16(23(25)29)15-5-3-2-4-6-15/h2-6,9-10,14,17-18,21-22,27H,7-8,11-13H2,1H3/t17-,18-,21+,22-/m1/s1	GLQBIINCSVPTPJ-RPHTVSPISA-N	422.184171952							98871
BRD-K45485804	LSM-11203		54661025	InChI=1S/C25H33N3O6/c1-33-15-21(30)28-22-18(19(14-29)23(28)25(32)26-9-11-34-12-10-26)13-27-20(22)8-7-17(24(27)31)16-5-3-2-4-6-16/h5,7-8,18-19,22-23,29H,2-4,6,9-15H2,1H3/t18-,19-,22+,23-/m0/s1	OPCBHRVVWMXJRO-LBVMUVSTSA-N	COCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]12)C4=CCCCC4)C(=O)N5CCOCC5	BroadT	BRD-K45485804	BRD-K45485804-001-01-1	Broad Institute of MIT and Harvard	BRD-K45485804			COCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]12)C(=O)N1CCOCC1	InChI=1S/C25H33N3O6/c1-33-15-21(30)28-22-18(19(14-29)23(28)25(32)26-9-11-34-12-10-26)13-27-20(22)8-7-17(24(27)31)16-5-3-2-4-6-16/h5,7-8,18-19,22-23,29H,2-4,6,9-15H2,1H3/t18-,19-,22+,23-/m0/s1	OPCBHRVVWMXJRO-LBVMUVSTSA-N	471.236935806							99824
BRD-M45544666	LSM-45037		54660982	InChI=1S/C28H29N5O4/c1-3-7-19-10-11-23-24-20(15-32(23)27(19)36)21(16-34)25(33(24)28(37)22-14-29-12-13-30-22)26(35)31-17(2)18-8-5-4-6-9-18/h3-14,17,20-21,24-25,34H,15-16H2,1-2H3,(H,31,35)/t17-,20+,21+,24-,25+/m0/s1	GAGDVGIWPFJCDU-DYMAAUEWSA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3C(=O)c4cnccn4)C(=O)N[C@@H](C)c5ccccc5	BroadT	BRD-M45544666	BRD-M45544666-001-01-0	Broad Institute of MIT and Harvard	BRD-M45544666		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N[C@@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N[C@@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@H]23)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N[C@@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N[C@@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@H]23)c1=O	InChI=1S/2C28H29N5O4/c2*1-3-7-19-10-11-23-24-20(15-32(23)27(19)36)21(16-34)25(33(24)28(37)22-14-29-12-13-30-22)26(35)31-17(2)18-8-5-4-6-9-18/h2*3-14,17,20-21,24-25,34H,15-16H2,1-2H3,(H,31,35)/b7-3+;7-3-/t2*17-,20+,21+,24-,25+/m00/s1	UURQJTAZHVTRJQ-KUOAXBMFSA-N	499.221954458							103274
BRD-K70512038	LSM-12730		54660838	InChI=1S/C25H31FN4O5/c1-14(2)28-25(34)30-20-12-29-19(8-7-17(24(29)33)15-5-4-6-16(26)11-15)22(30)21(18(20)13-31)23(32)27-9-10-35-3/h4-8,11,14,18,20-22,31H,9-10,12-13H2,1-3H3,(H,27,32)(H,28,34)/t18-,20-,21+,22+/m1/s1	RKZCTJVPZQLRIW-YJMBLLCNSA-N	COCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@@H]1N2C(=O)NC(C)C	BroadT	BRD-K70512038	BRD-K70512038-001-01-8	Broad Institute of MIT and Harvard	BRD-K70512038			COCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]1N2C(=O)NC(C)C	InChI=1S/C25H31FN4O5/c1-14(2)28-25(34)30-20-12-29-19(8-7-17(24(29)33)15-5-4-6-16(26)11-15)22(30)21(18(20)13-31)23(32)27-9-10-35-3/h4-8,11,14,18,20-22,31H,9-10,12-13H2,1-3H3,(H,27,32)(H,28,34)/t18-,20-,21+,22+/m1/s1	RKZCTJVPZQLRIW-YJMBLLCNSA-N	486.227848332							101366
BRD-K11847435	LSM-9144		54660894	InChI=1S/C26H27N5O5/c1-29(2)26(35)22-18(14-32)21-13-30-20(23(22)31(21)25(34)19-12-27-10-11-28-19)9-8-17(24(30)33)15-4-6-16(36-3)7-5-15/h4-12,18,21-23,32H,13-14H2,1-3H3/t18-,21-,22+,23+/m1/s1	BKGRDMUHEKXYSB-QQUTXWOLSA-N	COc1ccc(cc1)C2=CC=C3[C@H]4[C@H]([C@H](CO)[C@@H](CN3C2=O)N4C(=O)c5cnccn5)C(=O)N(C)C	BroadT	BRD-K11847435	BRD-K11847435-001-01-9	Broad Institute of MIT and Harvard	BRD-K11847435			COc1ccc(cc1)-c1ccc2[C@H]3[C@H]([C@H](CO)[C@@H](Cn2c1=O)N3C(=O)c1cnccn1)C(=O)N(C)C	InChI=1S/C26H27N5O5/c1-29(2)26(35)22-18(14-32)21-13-30-20(23(22)31(21)25(34)19-12-27-10-11-28-19)9-8-17(24(30)33)15-4-6-16(36-3)7-5-15/h4-12,18,21-23,32H,13-14H2,1-3H3/t18-,21-,22+,23+/m1/s1	BKGRDMUHEKXYSB-QQUTXWOLSA-N	489.201219014							97765
BRD-K79983157	LSM-13310		54660923	InChI=1S/C24H30F3N3O3/c25-24(26,27)9-10-29-19-12-30-18(8-7-16(23(30)33)15-3-1-2-4-15)21(29)20(17(19)13-31)22(32)28-11-14-5-6-14/h3,7-8,14,17,19-21,31H,1-2,4-6,9-13H2,(H,28,32)/t17-,19-,20+,21+/m0/s1	AMCQVYASXAVENJ-MJUUVYJYSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@H]([C@@H]1C(=O)NCC5CC5)N2CCC(F)(F)F	BroadT	BRD-K79983157	BRD-K79983157-001-01-7	Broad Institute of MIT and Harvard	BRD-K79983157			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]([C@@H]1C(=O)NCC1CC1)N2CCC(F)(F)F	InChI=1S/C24H30F3N3O3/c25-24(26,27)9-10-29-19-12-30-18(8-7-16(23(30)33)15-3-1-2-4-15)21(29)20(17(19)13-31)22(32)28-11-14-5-6-14/h3,7-8,14,17,19-21,31H,1-2,4-6,9-13H2,(H,28,32)/t17-,19-,20+,21+/m0/s1	AMCQVYASXAVENJ-MJUUVYJYSA-N	465.22392645							101949
BRD-K20211345	LSM-9662		54660947	InChI=1S/C26H28N4O3/c1-16(17-6-4-3-5-7-17)28-25(32)24-21(15-31)20-14-30-22(23(20)29(24)2)9-8-19(26(30)33)18-10-12-27-13-11-18/h3-13,16,20-21,23-24,31H,14-15H2,1-2H3,(H,28,32)/t16-,20-,21-,23+,24-/m0/s1	XRCXBUPUCMDVHO-ZOAOAULPSA-N	C[C@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@@H]2N1C)c5ccccc5	BroadT	BRD-K20211345	BRD-K20211345-001-01-6	Broad Institute of MIT and Harvard	BRD-K20211345			C[C@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]2N1C)c1ccccc1	InChI=1S/C26H28N4O3/c1-16(17-6-4-3-5-7-17)28-25(32)24-21(15-31)20-14-30-22(23(20)29(24)2)9-8-19(26(30)33)18-10-12-27-13-11-18/h3-13,16,20-21,23-24,31H,14-15H2,1-2H3,(H,28,32)/t16-,20-,21-,23+,24-/m0/s1	XRCXBUPUCMDVHO-ZOAOAULPSA-N	444.216140796							98283
BRD-M39727370	LSM-45029		54660771	InChI=1S/C26H32N6O4/c1-2-5-16-8-9-21-22-19(13-31(21)25(16)35)20(14-33)23(24(34)28-12-18-10-11-27-15-29-18)32(22)26(36)30-17-6-3-4-7-17/h2,5,8-11,15,17,19-20,22-23,33H,3-4,6-7,12-14H2,1H3,(H,28,34)(H,30,36)/t19-,20-,22+,23-/m1/s1	NIAAUHDJHRCSBO-YXPKMTABSA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3C(=O)NC4CCCC4)C(=O)NCc5ccncn5	BroadT	BRD-M39727370	BRD-M39727370-001-01-6	Broad Institute of MIT and Harvard	BRD-M39727370		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4ccncn4)N(C(=O)NC4CCCC4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4ccncn4)N(C(=O)NC4CCCC4)[C@H]23)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4ccncn4)N(C(=O)NC4CCCC4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4ccncn4)N(C(=O)NC4CCCC4)[C@H]23)c1=O	InChI=1S/2C26H32N6O4/c2*1-2-5-16-8-9-21-22-19(13-31(21)25(16)35)20(14-33)23(24(34)28-12-18-10-11-27-15-29-18)32(22)26(36)30-17-6-3-4-7-17/h2*2,5,8-11,15,17,19-20,22-23,33H,3-4,6-7,12-14H2,1H3,(H,28,34)(H,30,36)/b5-2+;5-2-/t2*19-,20-,22+,23-/m11/s1	SIZLOKOVAXLSOF-WJDHABMXSA-N	492.248503564							103266
BRD-K65049758	LSM-12400		54661000	InChI=1S/C28H32FN3O4/c29-21-10-3-2-9-18(21)19-11-12-22-25-24(28(36)30-13-4-1-5-14-30)20(16-33)23(15-31(22)27(19)35)32(25)26(34)17-7-6-8-17/h2-3,9-12,17,20,23-25,33H,1,4-8,13-16H2/t20-,23-,24+,25+/m1/s1	FMCRALLOZMCEMF-GATIMQMVSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]([C@H]1C(=O)N5CCCCC5)N2C(=O)C6CCC6	BroadT	BRD-K65049758	BRD-K65049758-001-01-6	Broad Institute of MIT and Harvard	BRD-K65049758			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]([C@H]1C(=O)N1CCCCC1)N2C(=O)C1CCC1	InChI=1S/C28H32FN3O4/c29-21-10-3-2-9-18(21)19-11-12-22-25-24(28(36)30-13-4-1-5-14-30)20(16-33)23(15-31(22)27(19)35)32(25)26(34)17-7-6-8-17/h2-3,9-12,17,20,23-25,33H,1,4-8,13-16H2/t20-,23-,24+,25+/m1/s1	FMCRALLOZMCEMF-GATIMQMVSA-N	493.237684734							101027
BRD-K09780243	LSM-9024		54660735	InChI=1S/C26H29F2N3O3/c1-30-22-13-31-21(8-7-19(26(31)34)16-5-3-2-4-6-16)24(30)23(20(22)14-32)25(33)29-12-15-9-17(27)11-18(28)10-15/h5,7-11,20,22-24,32H,2-4,6,12-14H2,1H3,(H,29,33)/t20-,22-,23+,24+/m0/s1	MBUIMBFODARIMW-IQFVJIFQSA-N	CN1[C@H]2CN3C(=O)C(=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc4cc(F)cc(F)c4)C5=CCCCC5	BroadT	BRD-K09780243	BRD-K09780243-001-01-8	Broad Institute of MIT and Harvard	BRD-K09780243			CN1[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc1cc(F)cc(F)c1	InChI=1S/C26H29F2N3O3/c1-30-22-13-31-21(8-7-19(26(31)34)16-5-3-2-4-6-16)24(30)23(20(22)14-32)25(33)29-12-15-9-17(27)11-18(28)10-15/h5,7-11,20,22-24,32H,2-4,6,12-14H2,1H3,(H,29,33)/t20-,22-,23+,24+/m0/s1	MBUIMBFODARIMW-IQFVJIFQSA-N	469.217698218							97645
BRD-K83157442	LSM-13512		54660820	InChI=1S/C24H30N6O4/c1-28(2)23(33)20-17(12-31)19-11-29-18(8-7-16(22(29)32)14-9-25-13-26-10-14)21(20)30(19)24(34)27-15-5-3-4-6-15/h7-10,13,15,17,19-21,31H,3-6,11-12H2,1-2H3,(H,27,34)/t17-,19-,20+,21+/m1/s1	IOQXCYVHGHXSII-PBASOCQRSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@@H]1N2C(=O)NC5CCCC5	BroadT	BRD-K83157442	BRD-K83157442-001-01-7	Broad Institute of MIT and Harvard	BRD-K83157442			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@@H]1N2C(=O)NC1CCCC1	InChI=1S/C24H30N6O4/c1-28(2)23(33)20-17(12-31)19-11-29-18(8-7-16(22(29)32)14-9-25-13-26-10-14)21(20)30(19)24(34)27-15-5-3-4-6-15/h7-10,13,15,17,19-21,31H,3-6,11-12H2,1-2H3,(H,27,34)/t17-,19-,20+,21+/m1/s1	IOQXCYVHGHXSII-PBASOCQRSA-N	466.2328535							102153
BRD-K91627479	LSM-14056		54660902	InChI=1S/C16H23N3O3/c1-3-7-17-16(22)15-11(9-20)10-8-19-12(14(10)18(15)2)5-4-6-13(19)21/h4-6,10-11,14-15,20H,3,7-9H2,1-2H3,(H,17,22)/t10-,11-,14+,15-/m0/s1	MRYDESPSWZCGBB-AZHAFVHUSA-N	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N1C	BroadT	BRD-K91627479	BRD-K91627479-001-01-5	Broad Institute of MIT and Harvard	BRD-K91627479			CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@@H]2N1C	InChI=1S/C16H23N3O3/c1-3-7-17-16(22)15-11(9-20)10-8-19-12(14(10)18(15)2)5-4-6-13(19)21/h4-6,10-11,14-15,20H,3,7-9H2,1-2H3,(H,17,22)/t10-,11-,14+,15-/m0/s1	MRYDESPSWZCGBB-AZHAFVHUSA-N	305.173941626							102709
BRD-K82151990	LSM-13448		54660903	InChI=1S/C23H27N3O3/c27-14-17-18-13-26-19(10-9-16(22(26)28)15-7-3-1-4-8-15)21(24-18)20(17)23(29)25-11-5-2-6-12-25/h1,3-4,7-10,17-18,20-21,24,27H,2,5-6,11-14H2/t17-,18-,20+,21+/m0/s1	JIIRQJXSNNBKIS-FMWKFLBASA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H](N2)[C@@H]1C(=O)N4CCCCC4)c5ccccc5	BroadT	BRD-K82151990	BRD-K82151990-001-01-7	Broad Institute of MIT and Harvard	BRD-K82151990			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H](N2)[C@@H]1C(=O)N1CCCCC1	InChI=1S/C23H27N3O3/c27-14-17-18-13-26-19(10-9-16(22(26)28)15-7-3-1-4-8-15)21(24-18)20(17)23(29)25-11-5-2-6-12-25/h1,3-4,7-10,17-18,20-21,24,27H,2,5-6,11-14H2/t17-,18-,20+,21+/m0/s1	JIIRQJXSNNBKIS-FMWKFLBASA-N	393.205241754							102088
BRD-K58745468	LSM-11980		54660956	InChI=1S/C23H29N5O5S/c1-25(2)23(31)20-16(12-29)18-10-27-17(9-8-15(22(27)30)14-6-4-5-7-14)21(20)28(18)34(32,33)19-11-26(3)13-24-19/h6,8-9,11,13,16,18,20-21,29H,4-5,7,10,12H2,1-3H3/t16-,18-,20+,21+/m1/s1	WKQWAKOEERQJQB-LMQGHGSNSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@@H]1N2S(=O)(=O)c5cn(C)cn5	BroadT	BRD-K58745468	BRD-K58745468-001-01-9	Broad Institute of MIT and Harvard	BRD-K58745468			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]1N2S(=O)(=O)c1cn(C)cn1	InChI=1S/C23H29N5O5S/c1-25(2)23(31)20-16(12-29)18-10-27-17(9-8-15(22(27)30)14-6-4-5-7-14)21(20)28(18)34(32,33)19-11-26(3)13-24-19/h6,8-9,11,13,16,18,20-21,29H,4-5,7,10,12H2,1-3H3/t16-,18-,20+,21+/m1/s1	WKQWAKOEERQJQB-LMQGHGSNSA-N	487.188939768							100606
BRD-K60087207	LSM-12062		54660755	InChI=1S/C26H26ClN3O4/c1-34-22-9-5-3-7-16(22)17-10-11-21-23-18(13-30(21)26(17)33)19(14-31)24(29-23)25(32)28-12-15-6-2-4-8-20(15)27/h2-11,18-19,23-24,29,31H,12-14H2,1H3,(H,28,32)/t18-,19-,23+,24-/m1/s1	HIRFHYYIFOJILK-PBIIQAGSSA-N	COc1ccccc1C2=CC=C3[C@H]4N[C@H]([C@H](CO)[C@H]4CN3C2=O)C(=O)NCc5ccccc5Cl	BroadT	BRD-K60087207	BRD-K60087207-001-01-8	Broad Institute of MIT and Harvard	BRD-K60087207			COc1ccccc1-c1ccc2[C@H]3N[C@H]([C@H](CO)[C@H]3Cn2c1=O)C(=O)NCc1ccccc1Cl	InChI=1S/C26H26ClN3O4/c1-34-22-9-5-3-7-16(22)17-10-11-21-23-18(13-30(21)26(17)33)19(14-31)24(29-23)25(32)28-12-15-6-2-4-8-20(15)27/h2-11,18-19,23-24,29,31H,12-14H2,1H3,(H,28,32)/t18-,19-,23+,24-/m1/s1	HIRFHYYIFOJILK-PBIIQAGSSA-N	479.161184052							100688
BRD-K51951665	LSM-11607		54660753	InChI=1S/C19H19F2N3O3/c20-11-4-10(5-12(21)6-11)7-22-19(27)17-13(9-25)14-8-24-15(18(17)23-14)2-1-3-16(24)26/h1-6,13-14,17-18,23,25H,7-9H2,(H,22,27)/t13-,14-,17+,18+/m1/s1	ZFBXTHNADMEDJT-KNCCTNLNSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H](N2)[C@H]1C(=O)NCc4cc(F)cc(F)c4	BroadT	BRD-K51951665	BRD-K51951665-001-01-1	Broad Institute of MIT and Harvard	BRD-K51951665			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H](N2)[C@H]1C(=O)NCc1cc(F)cc(F)c1	InChI=1S/C19H19F2N3O3/c20-11-4-10(5-12(21)6-11)7-22-19(27)17-13(9-25)14-8-24-15(18(17)23-14)2-1-3-16(24)26/h1-6,13-14,17-18,23,25H,7-9H2,(H,22,27)/t13-,14-,17+,18+/m1/s1	ZFBXTHNADMEDJT-KNCCTNLNSA-N	375.139447898							100230
BRD-K50052949	LSM-11472		54660817	InChI=1S/C28H28N4O4/c1-17(34)32-24-15-31-23(9-8-21(27(31)35)19-7-4-11-29-13-19)26(32)25(22(24)16-33)28(36)30-12-10-18-5-2-3-6-20(18)14-30/h2-9,11,13,22,24-26,33H,10,12,14-16H2,1H3/t22-,24-,25+,26+/m0/s1	KMPCXPGJDHNPDW-ADXHGGABSA-N	CC(=O)N1[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]1[C@@H]([C@H]2CO)C(=O)N5CCc6ccccc6C5	BroadT	BRD-K50052949	BRD-K50052949-001-01-7	Broad Institute of MIT and Harvard	BRD-K50052949			CC(=O)N1[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N1CCc2ccccc2C1	InChI=1S/C28H28N4O4/c1-17(34)32-24-15-31-23(9-8-21(27(31)35)19-7-4-11-29-13-19)26(32)25(22(24)16-33)28(36)30-12-10-18-5-2-3-6-20(18)14-30/h2-9,11,13,22,24-26,33H,10,12,14-16H2,1H3/t22-,24-,25+,26+/m0/s1	KMPCXPGJDHNPDW-ADXHGGABSA-N	484.211055416							100093
BRD-K07923524	LSM-8906		54660688	InChI=1S/C26H26N4O5/c31-14-18-20-13-29-19(4-1-5-23(29)32)25(30(20)12-17-3-2-8-27-10-17)24(18)26(33)28-11-16-6-7-21-22(9-16)35-15-34-21/h1-10,18,20,24-25,31H,11-15H2,(H,28,33)/t18-,20-,24+,25+/m1/s1	NQAPPCYATWXMBW-ZBXIDMRXSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)NCc4ccc5OCOc5c4)N2Cc6cccnc6	BroadT	BRD-K07923524	BRD-K07923524-001-01-6	Broad Institute of MIT and Harvard	BRD-K07923524			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NCc1ccc3OCOc3c1)N2Cc1cccnc1	InChI=1S/C26H26N4O5/c31-14-18-20-13-29-19(4-1-5-23(29)32)25(30(20)12-17-3-2-8-27-10-17)24(18)26(33)28-11-16-6-7-21-22(9-16)35-15-34-21/h1-10,18,20,24-25,31H,11-15H2,(H,28,33)/t18-,20-,24+,25+/m1/s1	NQAPPCYATWXMBW-ZBXIDMRXSA-N	474.190319972							97527
BRD-K02315839	LSM-8577		54660872	InChI=1S/C21H22FN3O4/c1-12(27)25-19-14(10-24-17(19)7-4-8-18(24)28)15(11-26)20(25)21(29)23-9-13-5-2-3-6-16(13)22/h2-8,14-15,19-20,26H,9-11H2,1H3,(H,23,29)/t14-,15-,19+,20-/m0/s1	JQQHJAYFWCMULB-QPAVJXABSA-N	CC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]12)C(=O)NCc4ccccc4F	BroadT	BRD-K02315839	BRD-K02315839-001-01-0	Broad Institute of MIT and Harvard	BRD-K02315839			CC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]12)C(=O)NCc1ccccc1F	InChI=1S/C21H22FN3O4/c1-12(27)25-19-14(10-24-17(19)7-4-8-18(24)28)15(11-26)20(25)21(29)23-9-13-5-2-3-6-16(13)22/h2-8,14-15,19-20,26H,9-11H2,1H3,(H,23,29)/t14-,15-,19+,20-/m0/s1	JQQHJAYFWCMULB-QPAVJXABSA-N	399.159434414							97198
CHEMBL3185581	LSM-43456	BRD-K22695599	54660685	InChI=1S/C27H28N4O3/c32-17-22-21-16-31-23(9-8-20(27(31)34)7-6-18-4-2-1-3-5-18)24(21)30-25(22)26(33)29-15-12-19-10-13-28-14-11-19/h1-11,13-14,21-22,24-25,30,32H,12,15-17H2,(H,29,33)/b7-6+/t21-,22-,24+,25-/m0/s1	XODDPLRMWVREGP-CTJXEPCXSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@@H]2N[C@@H]1C(=O)NCCc5ccncc5	BroadT	BRD-K22695599	BRD-K22695599-001-01-1	Broad Institute of MIT and Harvard	BRD-K22695599			OC[C@H]1[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]2N[C@@H]1C(=O)NCCc1ccncc1	InChI=1S/C27H28N4O3/c32-17-22-21-16-31-23(9-8-20(27(31)34)7-6-18-4-2-1-3-5-18)24(21)30-25(22)26(33)29-15-12-19-10-13-28-14-11-19/h1-11,13-14,21-22,24-25,30,32H,12,15-17H2,(H,29,33)/b7-6+/t21-,22-,24+,25-/m0/s1	XODDPLRMWVREGP-CTJXEPCXSA-N	456.216140796							
BRD-K78586486	LSM-13232		54660861	InChI=1S/C19H25N3O4/c1-20(2)19(26)17-13(10-23)12-9-21-14(7-4-8-15(21)24)16(12)22(17)18(25)11-5-3-6-11/h4,7-8,11-13,16-17,23H,3,5-6,9-10H2,1-2H3/t12-,13-,16+,17-/m1/s1	BHHDRXNUGFHOLE-UTJXIGIESA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@H]2N1C(=O)C4CCC4	BroadT	BRD-K78586486	BRD-K78586486-001-01-1	Broad Institute of MIT and Harvard	BRD-K78586486			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@H]2N1C(=O)C1CCC1	InChI=1S/C19H25N3O4/c1-20(2)19(26)17-13(10-23)12-9-21-14(7-4-8-15(21)24)16(12)22(17)18(25)11-5-3-6-11/h4,7-8,11-13,16-17,23H,3,5-6,9-10H2,1-2H3/t12-,13-,16+,17-/m1/s1	BHHDRXNUGFHOLE-UTJXIGIESA-N	359.18450631							101871
BRD-K16048293	LSM-9393		54660725	InChI=1S/C26H31FN4O4/c1-14(2)28-26(35)31-22-18(19(13-32)23(31)24(33)29-15-6-5-7-15)12-30-21(22)11-10-17(25(30)34)16-8-3-4-9-20(16)27/h3-4,8-11,14-15,18-19,22-23,32H,5-7,12-13H2,1-2H3,(H,28,35)(H,29,33)/t18-,19-,22+,23-/m1/s1	LYKIZZQLQMQPAT-PJIZGREPSA-N	CC(C)NC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]12)C(=O)NC5CCC5	BroadT	BRD-K16048293	BRD-K16048293-001-01-0	Broad Institute of MIT and Harvard	BRD-K16048293			CC(C)NC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]12)C(=O)NC1CCC1	InChI=1S/C26H31FN4O4/c1-14(2)28-26(35)31-22-18(19(13-32)23(31)24(33)29-15-6-5-7-15)12-30-21(22)11-10-17(25(30)34)16-8-3-4-9-20(16)27/h3-4,8-11,14-15,18-19,22-23,32H,5-7,12-13H2,1-2H3,(H,28,35)(H,29,33)/t18-,19-,22+,23-/m1/s1	LYKIZZQLQMQPAT-PJIZGREPSA-N	482.232933712							98014
BRD-K19331234	LSM-9591		54660955	InChI=1S/C23H29N5O5S/c1-25(2)23(31)20-16(12-29)18-10-27-17(9-8-15(22(27)30)14-6-4-5-7-14)21(20)28(18)34(32,33)19-11-26(3)13-24-19/h6,8-9,11,13,16,18,20-21,29H,4-5,7,10,12H2,1-3H3/t16-,18-,20+,21+/m0/s1	WKQWAKOEERQJQB-XIGKFDRGSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@H]1N2S(=O)(=O)c5cn(C)cn5	BroadT	BRD-K19331234	BRD-K19331234-001-01-9	Broad Institute of MIT and Harvard	BRD-K19331234			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]1N2S(=O)(=O)c1cn(C)cn1	InChI=1S/C23H29N5O5S/c1-25(2)23(31)20-16(12-29)18-10-27-17(9-8-15(22(27)30)14-6-4-5-7-14)21(20)28(18)34(32,33)19-11-26(3)13-24-19/h6,8-9,11,13,16,18,20-21,29H,4-5,7,10,12H2,1-3H3/t16-,18-,20+,21+/m0/s1	WKQWAKOEERQJQB-XIGKFDRGSA-N	487.188939768							98212
BRD-K56240483	LSM-11831		54660891	InChI=1S/C30H28N4O3/c35-19-24-26-18-33-25(7-4-8-27(33)36)29(34(26)17-20-13-15-31-16-14-20)28(24)30(37)32-23-11-9-22(10-12-23)21-5-2-1-3-6-21/h1-16,24,26,28-29,35H,17-19H2,(H,32,37)/t24-,26-,28+,29+/m1/s1	QNNNGHWPHFGBDZ-DOYJQPJHSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)Nc4ccc(cc4)c5ccccc5)N2Cc6ccncc6	BroadT	BRD-K56240483	BRD-K56240483-001-01-4	Broad Institute of MIT and Harvard	BRD-K56240483			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)Nc1ccc(cc1)-c1ccccc1)N2Cc1ccncc1	InChI=1S/C30H28N4O3/c35-19-24-26-18-33-25(7-4-8-27(33)36)29(34(26)17-20-13-15-31-16-14-20)28(24)30(37)32-23-11-9-22(10-12-23)21-5-2-1-3-6-21/h1-16,24,26,28-29,35H,17-19H2,(H,32,37)/t24-,26-,28+,29+/m1/s1	QNNNGHWPHFGBDZ-DOYJQPJHSA-N	492.216140796							100456
BRD-K39839146	LSM-10855		54660757	InChI=1S/C25H32N4O5/c1-4-12-27-25(33)29-19-13-28-18(22(29)21(17(19)14-30)23(31)26-5-2)11-10-16(24(28)32)15-8-6-7-9-20(15)34-3/h6-11,17,19,21-22,30H,4-5,12-14H2,1-3H3,(H,26,31)(H,27,33)/t17-,19-,21+,22+/m0/s1	RDJLSMVLUOAMPE-HVJHZFLKSA-N	CCCNC(=O)N1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCC	BroadT	BRD-K39839146	BRD-K39839146-001-01-4	Broad Institute of MIT and Harvard	BRD-K39839146			CCCNC(=O)N1[C@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCC	InChI=1S/C25H32N4O5/c1-4-12-27-25(33)29-19-13-28-18(22(29)21(17(19)14-30)23(31)26-5-2)11-10-16(24(28)32)15-8-6-7-9-20(15)34-3/h6-11,17,19,21-22,30H,4-5,12-14H2,1-3H3,(H,26,31)(H,27,33)/t17-,19-,21+,22+/m0/s1	RDJLSMVLUOAMPE-HVJHZFLKSA-N	468.237270164							99476
BRD-K02544880	LSM-43444		54660975	InChI=1S/C25H24N4O4S/c1-15(31)29-21-18(19(14-30)22(29)23(32)27-25-26-11-12-34-25)13-28-20(21)10-9-17(24(28)33)8-7-16-5-3-2-4-6-16/h2-12,18-19,21-22,30H,13-14H2,1H3,(H,26,27,32)/b8-7+/t18-,19-,21+,22-/m0/s1	JROUXBMWQRIOQN-HDTYGZQBSA-N	CC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@H]12)C(=O)Nc5nccs5	BroadT	BRD-K02544880	BRD-K02544880-001-01-3	Broad Institute of MIT and Harvard	BRD-K02544880			CC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]12)C(=O)Nc1nccs1	InChI=1S/C25H24N4O4S/c1-15(31)29-21-18(19(14-30)22(29)23(32)27-25-26-11-12-34-25)13-28-20(21)10-9-17(24(28)33)8-7-16-5-3-2-4-6-16/h2-12,18-19,21-22,30H,13-14H2,1H3,(H,26,27,32)/b8-7+/t18-,19-,21+,22-/m0/s1	JROUXBMWQRIOQN-HDTYGZQBSA-N	476.151825978							
BRD-M79326715	LSM-45069		54660877	InChI=1S/C23H26ClN3O5S/c1-3-6-14-9-10-19-20-16(12-26(19)23(14)30)17(13-28)21(27(20)33(2,31)32)22(29)25-11-15-7-4-5-8-18(15)24/h3-10,16-17,20-21,28H,11-13H2,1-2H3,(H,25,29)/t16-,17-,20+,21-/m0/s1	GLXDGGACPBJUPS-PZBISTMVSA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3S(=O)(=O)C)C(=O)NCc4ccccc4Cl	BroadT	BRD-M79326715	BRD-M79326715-001-01-2	Broad Institute of MIT and Harvard	BRD-M79326715		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCc4ccccc4Cl)N(S(C)(=O)=O)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCc4ccccc4Cl)N(S(C)(=O)=O)[C@@H]23)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCc4ccccc4Cl)N(S(C)(=O)=O)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCc4ccccc4Cl)N(S(C)(=O)=O)[C@@H]23)c1=O	InChI=1S/2C23H26ClN3O5S/c2*1-3-6-14-9-10-19-20-16(12-26(19)23(14)30)17(13-28)21(27(20)33(2,31)32)22(29)25-11-15-7-4-5-8-18(15)24/h2*3-10,16-17,20-21,28H,11-13H2,1-2H3,(H,25,29)/b6-3+;6-3-/t2*16-,17-,20+,21-/m00/s1	UCSZHFMIVXFQBI-ONOPUZHMSA-N	491.128169362							103306
BRD-K10777286-001-01-9	LSM-28116	BRD-K10777286	54660666	InChI=1S/C25H31N5O4S/c1-28(2)13-20(32)30-21-17(18(14-31)22(30)23(33)27-25-26-10-11-35-25)12-29-19(21)9-8-16(24(29)34)15-6-4-3-5-7-15/h6,8-11,17-18,21-22,31H,3-5,7,12-14H2,1-2H3,(H,26,27,33)/t17-,18-,21+,22-/m1/s1	ZANSJMBDKCDFCX-RPHTVSPISA-N	CN(C)CC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C4=CCCCC4)C3=O)[C@@H]12)C(=O)Nc5nccs5	BroadT	BRD-K10777286	BRD-K10777286-001-01-9	Broad Institute of MIT and Harvard	BRD-K10777286			CN(C)CC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]12)C(=O)Nc1nccs1	InChI=1S/C25H31N5O4S/c1-28(2)13-20(32)30-21-17(18(14-31)22(30)23(33)27-25-26-10-11-35-25)12-29-19(21)9-8-16(24(29)34)15-6-4-3-5-7-15/h6,8-11,17-18,21-22,31H,3-5,7,12-14H2,1-2H3,(H,26,27,33)/t17-,18-,21+,22-/m1/s1	ZANSJMBDKCDFCX-RPHTVSPISA-N	497.209675212							116661
BRD-K56370195	LSM-11839		54660870	InChI=1S/C24H29N3O3/c28-15-19-18-14-27-20(10-5-11-21(27)29)22(18)26(13-12-16-6-2-1-3-7-16)23(19)24(30)25-17-8-4-9-17/h1-3,5-7,10-11,17-19,22-23,28H,4,8-9,12-15H2,(H,25,30)/t18-,19-,22+,23-/m1/s1	TURNTDXZFQQILD-PJIZGREPSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N(CCc4ccccc4)[C@H]1C(=O)NC5CCC5	BroadT	BRD-K56370195	BRD-K56370195-001-01-8	Broad Institute of MIT and Harvard	BRD-K56370195			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N(CCc2ccccc2)[C@H]1C(=O)NC1CCC1	InChI=1S/C24H29N3O3/c28-15-19-18-14-27-20(10-5-11-21(27)29)22(18)26(13-12-16-6-2-1-3-7-16)23(19)24(30)25-17-8-4-9-17/h1-3,5-7,10-11,17-19,22-23,28H,4,8-9,12-15H2,(H,25,30)/t18-,19-,22+,23-/m1/s1	TURNTDXZFQQILD-PJIZGREPSA-N	407.220891818							100465
BRD-K69790925	LSM-12688		54660647	InChI=1S/C21H23N3O3/c25-11-16-15-10-24-17(6-3-7-18(24)26)19(15)23-20(16)21(27)22-14-8-12-4-1-2-5-13(12)9-14/h1-7,14-16,19-20,23,25H,8-11H2,(H,22,27)/t15-,16-,19+,20-/m1/s1	WRJPWVKEXURTAG-YAJHFMINSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N[C@H]1C(=O)NC4Cc5ccccc5C4	BroadT	BRD-K69790925	BRD-K69790925-001-01-9	Broad Institute of MIT and Harvard	BRD-K69790925			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N[C@H]1C(=O)NC1Cc2ccccc2C1	InChI=1S/C21H23N3O3/c25-11-16-15-10-24-17(6-3-7-18(24)26)19(15)23-20(16)21(27)22-14-8-12-4-1-2-5-13(12)9-14/h1-7,14-16,19-20,23,25H,8-11H2,(H,22,27)/t15-,16-,19+,20-/m1/s1	WRJPWVKEXURTAG-YAJHFMINSA-N	365.173941626							101322
BRD-K22932079	LSM-43457		54660917	InChI=1S/C29H36N4O3/c1-30-13-15-31(16-14-30)29(36)27-24(19-34)23-18-32-25(26(23)33(27)17-21-7-8-21)12-11-22(28(32)35)10-9-20-5-3-2-4-6-20/h2-6,9-12,21,23-24,26-27,34H,7-8,13-19H2,1H3/b10-9+/t23-,24-,26+,27-/m0/s1	BARBWXSVHSAMRQ-MXZZZELRSA-N	CN1CCN(CC1)C(=O)[C@@H]2[C@@H](CO)[C@@H]3CN4C(=O)C(=CC=C4[C@@H]3N2CC5CC5)\C=C\c6ccccc6	BroadT	BRD-K22932079	BRD-K22932079-001-01-7	Broad Institute of MIT and Harvard	BRD-K22932079			CN1CCN(CC1)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]2N1CC1CC1	InChI=1S/C29H36N4O3/c1-30-13-15-31(16-14-30)29(36)27-24(19-34)23-18-32-25(26(23)33(27)17-21-7-8-21)12-11-22(28(32)35)10-9-20-5-3-2-4-6-20/h2-6,9-12,21,23-24,26-27,34H,7-8,13-19H2,1H3/b10-9+/t23-,24-,26+,27-/m0/s1	BARBWXSVHSAMRQ-MXZZZELRSA-N	488.278741052							
BRD-K30114694	LSM-10248		54660971	InChI=1S/C21H25N3O5S/c1-13(14-7-4-3-5-8-14)22-21(27)20-16(12-25)15-11-23-17(9-6-10-18(23)26)19(15)24(20)30(2,28)29/h3-10,13,15-16,19-20,25H,11-12H2,1-2H3,(H,22,27)/t13-,15-,16-,19+,20-/m0/s1	LURAPRBVZDLHCY-JVZMEXGZSA-N	C[C@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N1S(=O)(=O)C)c4ccccc4	BroadT	BRD-K30114694	BRD-K30114694-001-01-7	Broad Institute of MIT and Harvard	BRD-K30114694			C[C@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@@H]2N1S(C)(=O)=O)c1ccccc1	InChI=1S/C21H25N3O5S/c1-13(14-7-4-3-5-8-14)22-21(27)20-16(12-25)15-11-23-17(9-6-10-18(23)26)19(15)24(20)30(2,28)29/h3-10,13,15-16,19-20,25H,11-12H2,1-2H3,(H,22,27)/t13-,15-,16-,19+,20-/m0/s1	LURAPRBVZDLHCY-JVZMEXGZSA-N	431.15149162							98869
BRD-K88027520	LSM-13833		54660743	InChI=1S/C24H25N3O5S/c1-31-15-5-3-4-14(10-15)16-6-7-19-21-17(11-26(19)23(16)29)18(13-28)22(24(30)32-2)27(21)12-20-25-8-9-33-20/h3-10,17-18,21-22,28H,11-13H2,1-2H3/t17-,18-,21+,22-/m0/s1	VROAXWWRWFQWDA-HXHBTQRASA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccc(OC)c4)[C@@H]2N1Cc5nccs5	BroadT	BRD-K88027520	BRD-K88027520-001-01-2	Broad Institute of MIT and Harvard	BRD-K88027520			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccc(OC)c4)c3=O)[C@@H]2N1Cc1nccs1	InChI=1S/C24H25N3O5S/c1-31-15-5-3-4-14(10-15)16-6-7-19-21-17(11-26(19)23(16)29)18(13-28)22(24(30)32-2)27(21)12-20-25-8-9-33-20/h3-10,17-18,21-22,28H,11-13H2,1-2H3/t17-,18-,21+,22-/m0/s1	VROAXWWRWFQWDA-HXHBTQRASA-N	467.15149162							102483
BRD-K94715393	LSM-14235		54660869	InChI=1S/C30H34N4O3/c1-32-26-18-34-25(8-7-23(29(34)36)22-9-13-31-14-10-22)28(32)27(24(26)19-35)30(37)33-15-11-21(12-16-33)17-20-5-3-2-4-6-20/h2-10,13-14,21,24,26-28,35H,11-12,15-19H2,1H3/t24-,26-,27+,28+/m1/s1	QUSLSSXBBMTUKA-OIIADRAWSA-N	CN1[C@@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@H]1[C@H]([C@@H]2CO)C(=O)N5CCC(Cc6ccccc6)CC5	BroadT	BRD-K94715393	BRD-K94715393-001-01-8	Broad Institute of MIT and Harvard	BRD-K94715393			CN1[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N1CCC(Cc2ccccc2)CC1	InChI=1S/C30H34N4O3/c1-32-26-18-34-25(8-7-23(29(34)36)22-9-13-31-14-10-22)28(32)27(24(26)19-35)30(37)33-15-11-21(12-16-33)17-20-5-3-2-4-6-20/h2-10,13-14,21,24,26-28,35H,11-12,15-19H2,1H3/t24-,26-,27+,28+/m1/s1	QUSLSSXBBMTUKA-OIIADRAWSA-N	498.263090988							102889
BRD-K75094920	LSM-13028		54660873	InChI=1S/C21H22FN3O4/c1-12(27)25-19-14(10-24-17(19)7-4-8-18(24)28)15(11-26)20(25)21(29)23-9-13-5-2-3-6-16(13)22/h2-8,14-15,19-20,26H,9-11H2,1H3,(H,23,29)/t14-,15-,19+,20-/m1/s1	JQQHJAYFWCMULB-XWYPRVOQSA-N	CC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]12)C(=O)NCc4ccccc4F	BroadT	BRD-K75094920	BRD-K75094920-001-01-3	Broad Institute of MIT and Harvard	BRD-K75094920			CC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]12)C(=O)NCc1ccccc1F	InChI=1S/C21H22FN3O4/c1-12(27)25-19-14(10-24-17(19)7-4-8-18(24)28)15(11-26)20(25)21(29)23-9-13-5-2-3-6-16(13)22/h2-8,14-15,19-20,26H,9-11H2,1H3,(H,23,29)/t14-,15-,19+,20-/m1/s1	JQQHJAYFWCMULB-XWYPRVOQSA-N	399.159434414							101665
BRD-M88256629	LSM-45076		54660714	InChI=1S/C22H28N4O4/c1-3-5-14-6-7-18-19-16(10-25(18)22(14)29)17(11-27)20(21(28)23-8-4-2)26(19)9-15-12-30-13-24-15/h3,5-7,12-13,16-17,19-20,27H,4,8-11H2,1-2H3,(H,23,28)/t16-,17-,19+,20-/m0/s1	UIYBGHYPRRSBHH-XEYPJELSSA-N	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N1Cc4cocn4)C=CC	BroadT	BRD-M88256629	BRD-M88256629-001-01-5	Broad Institute of MIT and Harvard	BRD-M88256629		CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]2N1Cc1cocn1.CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]2N1Cc1cocn1	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]2N1Cc1cocn1.CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]2N1Cc1cocn1	InChI=1S/2C22H28N4O4/c2*1-3-5-14-6-7-18-19-16(10-25(18)22(14)29)17(11-27)20(21(28)23-8-4-2)26(19)9-15-12-30-13-24-15/h2*3,5-7,12-13,16-17,19-20,27H,4,8-11H2,1-2H3,(H,23,28)/b5-3+;5-3-/t2*16-,17-,19+,20-/m00/s1	GOSQUEMGCNFWKR-YJOHIXJFSA-N	412.211055416							103313
BRD-K71182858	LSM-12774		54660943	InChI=1S/C24H28FN3O3/c25-15-6-4-5-14(11-15)17-9-10-20-21-18(12-28(20)24(17)31)19(13-29)22(27-21)23(30)26-16-7-2-1-3-8-16/h4-6,9-11,16,18-19,21-22,27,29H,1-3,7-8,12-13H2,(H,26,30)/t18-,19-,21+,22-/m0/s1	VBHCGIGHTBBWQL-MPJJRAAHSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N[C@@H]1C(=O)NC4CCCCC4)c5cccc(F)c5	BroadT	BRD-K71182858	BRD-K71182858-001-01-6	Broad Institute of MIT and Harvard	BRD-K71182858			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]2N[C@@H]1C(=O)NC1CCCCC1	InChI=1S/C24H28FN3O3/c25-15-6-4-5-14(11-15)17-9-10-20-21-18(12-28(20)24(17)31)19(13-29)22(27-21)23(30)26-16-7-2-1-3-8-16/h4-6,9-11,16,18-19,21-22,27,29H,1-3,7-8,12-13H2,(H,26,30)/t18-,19-,21+,22-/m0/s1	VBHCGIGHTBBWQL-MPJJRAAHSA-N	425.211469986							101411
BRD-K72751432-001-01-2	LSM-28117	BRD-K72751432	54660636	InChI=1S/C22H27N3O3/c1-3-23-21(27)20-17(13-26)16-12-25-18(19(16)24(20)4-2)11-10-15(22(25)28)14-8-6-5-7-9-14/h5-11,16-17,19-20,26H,3-4,12-13H2,1-2H3,(H,23,27)/t16-,17-,19+,20-/m1/s1	OSVRRGSOHNMBSG-IZBJGVDFSA-N	CCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@H]2N1CC)c4ccccc4	BroadT	BRD-K72751432	BRD-K72751432-001-01-2	Broad Institute of MIT and Harvard	BRD-K72751432			CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]2N1CC	InChI=1S/C22H27N3O3/c1-3-23-21(27)20-17(13-26)16-12-25-18(19(16)24(20)4-2)11-10-15(22(25)28)14-8-6-5-7-9-14/h5-11,16-17,19-20,26H,3-4,12-13H2,1-2H3,(H,23,27)/t16-,17-,19+,20-/m1/s1	OSVRRGSOHNMBSG-IZBJGVDFSA-N	381.205241754							116662
BRD-K32128027	LSM-10376		54660925	InChI=1S/C27H30N2O6/c1-33-27(32)25-20(14-30)19-13-28-21(9-8-18(26(28)31)17-5-3-2-4-6-17)24(19)29(25)12-16-7-10-22-23(11-16)35-15-34-22/h5,7-11,19-20,24-25,30H,2-4,6,12-15H2,1H3/t19-,20-,24+,25-/m0/s1	ONPKFTYLPVPFLT-UIYANEJRSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N1Cc4ccc5OCOc5c4)C6=CCCCC6	BroadT	BRD-K32128027	BRD-K32128027-001-01-3	Broad Institute of MIT and Harvard	BRD-K32128027			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]2N1Cc1ccc2OCOc2c1	InChI=1S/C27H30N2O6/c1-33-27(32)25-20(14-30)19-13-28-21(9-8-18(26(28)31)17-5-3-2-4-6-17)24(19)29(25)12-16-7-10-22-23(11-16)35-15-34-22/h5,7-11,19-20,24-25,30H,2-4,6,12-15H2,1H3/t19-,20-,24+,25-/m0/s1	ONPKFTYLPVPFLT-UIYANEJRSA-N	478.2103867							98997
BRD-K59174142	LSM-12002		54660808	InChI=1S/C26H26N4O5/c1-35-15-22(32)30-23-19(20(14-31)24(30)25(33)28-17-7-3-2-4-8-17)13-29-21(23)10-9-18(26(29)34)16-6-5-11-27-12-16/h2-12,19-20,23-24,31H,13-15H2,1H3,(H,28,33)/t19-,20-,23+,24-/m0/s1	ZBGRYIWHFJMRFQ-JVODISISSA-N	COCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]12)C(=O)Nc5ccccc5	BroadT	BRD-K59174142	BRD-K59174142-001-01-5	Broad Institute of MIT and Harvard	BRD-K59174142			COCC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]12)C(=O)Nc1ccccc1	InChI=1S/C26H26N4O5/c1-35-15-22(32)30-23-19(20(14-31)24(30)25(33)28-17-7-3-2-4-8-17)13-29-21(23)10-9-18(26(29)34)16-6-5-11-27-12-16/h2-12,19-20,23-24,31H,13-15H2,1H3,(H,28,33)/t19-,20-,23+,24-/m0/s1	ZBGRYIWHFJMRFQ-JVODISISSA-N	474.190319972							100628
BRD-K62430643	LSM-43486		54660763	InChI=1S/C28H28N4O4/c1-30(2)28(36)25-22(17-33)21-16-31-23(24(21)32(25)27(35)20-9-6-14-29-15-20)13-12-19(26(31)34)11-10-18-7-4-3-5-8-18/h3-15,21-22,24-25,33H,16-17H2,1-2H3/b11-10+/t21-,22-,24+,25-/m1/s1	JLXJOKBWOBKOCH-BTOBFZAUSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@H]2N1C(=O)c5cccnc5	BroadT	BRD-K62430643	BRD-K62430643-001-01-0	Broad Institute of MIT and Harvard	BRD-K62430643			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]2N1C(=O)c1cccnc1	InChI=1S/C28H28N4O4/c1-30(2)28(36)25-22(17-33)21-16-31-23(24(21)32(25)27(35)20-9-6-14-29-15-20)13-12-19(26(31)34)11-10-18-7-4-3-5-8-18/h3-15,21-22,24-25,33H,16-17H2,1-2H3/b11-10+/t21-,22-,24+,25-/m1/s1	JLXJOKBWOBKOCH-BTOBFZAUSA-N	484.211055416							
BRD-K93679872	LSM-14173		54660951	InChI=1S/C25H24ClN5O4/c1-14(33)31-22-18(11-30-21(22)7-6-17(25(30)35)16-8-27-13-28-9-16)19(12-32)23(31)24(34)29-10-15-4-2-3-5-20(15)26/h2-9,13,18-19,22-23,32H,10-12H2,1H3,(H,29,34)/t18-,19-,22+,23-/m1/s1	NRDXZHALSORZQF-PJIZGREPSA-N	CC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@@H]12)C(=O)NCc5ccccc5Cl	BroadT	BRD-K93679872	BRD-K93679872-001-01-7	Broad Institute of MIT and Harvard	BRD-K93679872			CC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@@H]12)C(=O)NCc1ccccc1Cl	InChI=1S/C25H24ClN5O4/c1-14(33)31-22-18(11-30-21(22)7-6-17(25(30)35)16-8-27-13-28-9-16)19(12-32)23(31)24(34)29-10-15-4-2-3-5-20(15)26/h2-9,13,18-19,22-23,32H,10-12H2,1H3,(H,29,34)/t18-,19-,22+,23-/m1/s1	NRDXZHALSORZQF-PJIZGREPSA-N	493.151682008							102827
BRD-K19658687	LSM-9618		54660900	InChI=1S/C25H29FN2O4/c26-17-8-6-16(7-9-17)18-10-11-20-23-22(25(31)32)19(14-29)21(13-28(20)24(18)30)27(23)12-15-4-2-1-3-5-15/h6-11,15,19,21-23,29H,1-5,12-14H2,(H,31,32)/t19-,21-,22+,23+/m1/s1	CWPRWIPOMXTHMO-LGKPFJOYSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]([C@H]1C(=O)O)N2CC5CCCCC5	BroadT	BRD-K19658687	BRD-K19658687-001-01-7	Broad Institute of MIT and Harvard	BRD-K19658687			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]([C@H]1C(O)=O)N2CC1CCCCC1	InChI=1S/C25H29FN2O4/c26-17-8-6-16(7-9-17)18-10-11-20-23-22(25(31)32)19(14-29)21(13-28(20)24(18)30)27(23)12-15-4-2-1-3-5-15/h6-11,15,19,21-23,29H,1-5,12-14H2,(H,31,32)/t19-,21-,22+,23+/m1/s1	CWPRWIPOMXTHMO-LGKPFJOYSA-N	440.211135628							98239
BRD-K38187891	LSM-43470		54661014	InChI=1S/C28H27FN2O4/c1-35-28(34)25-21(17-32)24-16-31-23(26(25)30(24)15-20-9-5-6-10-22(20)29)14-13-19(27(31)33)12-11-18-7-3-2-4-8-18/h2-14,21,24-26,32H,15-17H2,1H3/b12-11+/t21-,24-,25+,26+/m1/s1	XEFNAFZLQRVNGC-SILAPKCHSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@@H]1N2Cc5ccccc5F	BroadT	BRD-K38187891	BRD-K38187891-001-01-6	Broad Institute of MIT and Harvard	BRD-K38187891			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]1N2Cc1ccccc1F	InChI=1S/C28H27FN2O4/c1-35-28(34)25-21(17-32)24-16-31-23(26(25)30(24)15-20-9-5-6-10-22(20)29)14-13-19(27(31)33)12-11-18-7-3-2-4-8-18/h2-14,21,24-26,32H,15-17H2,1H3/b12-11+/t21-,24-,25+,26+/m1/s1	XEFNAFZLQRVNGC-SILAPKCHSA-N	474.195485564							
BRD-K50157880	LSM-11479		54660977	InChI=1S/C25H31FN4O4/c1-15(32)30-22-19(20(14-31)23(30)24(33)27-10-5-11-28(2)3)13-29-21(22)9-8-18(25(29)34)16-6-4-7-17(26)12-16/h4,6-9,12,19-20,22-23,31H,5,10-11,13-14H2,1-3H3,(H,27,33)/t19-,20-,22+,23-/m0/s1	KVNOQKWAHHZEJM-RLBLXZPPSA-N	CN(C)CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@@H]2N1C(=O)C	BroadT	BRD-K50157880	BRD-K50157880-001-01-5	Broad Institute of MIT and Harvard	BRD-K50157880			CN(C)CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]2N1C(C)=O	InChI=1S/C25H31FN4O4/c1-15(32)30-22-19(20(14-31)23(30)24(33)27-10-5-11-28(2)3)13-29-21(22)9-8-18(25(29)34)16-6-4-7-17(26)12-16/h4,6-9,12,19-20,22-23,31H,5,10-11,13-14H2,1-3H3,(H,27,33)/t19-,20-,22+,23-/m0/s1	KVNOQKWAHHZEJM-RLBLXZPPSA-N	470.232933712							100100
BRD-K75906982	LSM-13071		54660921	InChI=1S/C17H23N3O3/c1-19-13-8-20-12(3-2-4-14(20)22)16(19)15(11(13)9-21)17(23)18-7-10-5-6-10/h2-4,10-11,13,15-16,21H,5-9H2,1H3,(H,18,23)/t11-,13-,15+,16+/m0/s1	INXWNUBULGNKSP-DDUYRFODSA-N	CN1[C@H]2CN3C(=O)C=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)NCC4CC4	BroadT	BRD-K75906982	BRD-K75906982-001-01-3	Broad Institute of MIT and Harvard	BRD-K75906982			CN1[C@H]2Cn3c(cccc3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCC1CC1	InChI=1S/C17H23N3O3/c1-19-13-8-20-12(3-2-4-14(20)22)16(19)15(11(13)9-21)17(23)18-7-10-5-6-10/h2-4,10-11,13,15-16,21H,5-9H2,1H3,(H,18,23)/t11-,13-,15+,16+/m0/s1	INXWNUBULGNKSP-DDUYRFODSA-N	317.173941626							101708
BRD-K52725924	LSM-11648		54661032	InChI=1S/C26H25FN4O4/c1-2-28-24(33)22-18(14-32)21-13-30-20(23(22)31(21)26(35)19-5-3-4-12-29-19)11-10-17(25(30)34)15-6-8-16(27)9-7-15/h3-12,18,21-23,32H,2,13-14H2,1H3,(H,28,33)/t18-,21-,22+,23+/m1/s1	SQYOPUXXKNICGN-QQUTXWOLSA-N	CCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]1N2C(=O)c5ccccn5	BroadT	BRD-K52725924	BRD-K52725924-001-01-5	Broad Institute of MIT and Harvard	BRD-K52725924			CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]1N2C(=O)c1ccccn1	InChI=1S/C26H25FN4O4/c1-2-28-24(33)22-18(14-32)21-13-30-20(23(22)31(21)26(35)19-5-3-4-12-29-19)11-10-17(25(30)34)15-6-8-16(27)9-7-15/h3-12,18,21-23,32H,2,13-14H2,1H3,(H,28,33)/t18-,21-,22+,23+/m1/s1	SQYOPUXXKNICGN-QQUTXWOLSA-N	476.18598352							100273
BRD-M82627054	LSM-45071		54660914	InChI=1S/C25H29F3N4O3/c1-2-3-17-4-5-19-22-21(23(34)30-12-8-16-6-10-29-11-7-16)18(15-33)20(14-32(19)24(17)35)31(22)13-9-25(26,27)28/h2-7,10-11,18,20-22,33H,8-9,12-15H2,1H3,(H,30,34)/t18-,20-,21+,22+/m1/s1	GMFBTTQFVVUQAX-YJMBLLCNSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3CCC(F)(F)F)C(=O)NCCc4ccncc4	BroadT	BRD-M82627054	BRD-M82627054-001-01-7	Broad Institute of MIT and Harvard	BRD-M82627054		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCc4ccncc4)[C@H]2N3CCC(F)(F)F)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCc4ccncc4)[C@H]2N3CCC(F)(F)F)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCc4ccncc4)[C@H]2N3CCC(F)(F)F)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCCc4ccncc4)[C@H]2N3CCC(F)(F)F)c1=O	InChI=1S/2C25H29F3N4O3/c2*1-2-3-17-4-5-19-22-21(23(34)30-12-8-16-6-10-29-11-7-16)18(15-33)20(14-32(19)24(17)35)31(22)13-9-25(26,27)28/h2*2-7,10-11,18,20-22,33H,8-9,12-15H2,1H3,(H,30,34)/b3-2+;3-2-/t2*18-,20-,21+,22+/m11/s1	ADTLNXINPWOAFZ-FIETYXFUSA-N	490.219175428							103308
BRD-K04291521	LSM-8692		54660668	InChI=1S/C24H28FN3O5S/c1-34(32,33)28-20-13-27-19(9-8-17(23(27)30)15-6-5-7-16(25)12-15)22(28)21(18(20)14-29)24(31)26-10-3-2-4-11-26/h5-9,12,18,20-22,29H,2-4,10-11,13-14H2,1H3/t18-,20-,21+,22+/m1/s1	WZTANFXJBQNXHQ-YJMBLLCNSA-N	CS(=O)(=O)N1[C@@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@H]1[C@H]([C@@H]2CO)C(=O)N5CCCCC5	BroadT	BRD-K04291521	BRD-K04291521-001-01-4	Broad Institute of MIT and Harvard	BRD-K04291521			CS(=O)(=O)N1[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N1CCCCC1	InChI=1S/C24H28FN3O5S/c1-34(32,33)28-20-13-27-19(9-8-17(23(27)30)15-6-5-7-16(25)12-15)22(28)21(18(20)14-29)24(31)26-10-3-2-4-11-26/h5-9,12,18,20-22,29H,2-4,10-11,13-14H2,1H3/t18-,20-,21+,22+/m1/s1	WZTANFXJBQNXHQ-YJMBLLCNSA-N	489.173369916							97313
BRD-K29720768	LSM-43463		54660976	InChI=1S/C25H24N4O4S/c1-15(31)29-21-18(19(14-30)22(29)23(32)27-25-26-11-12-34-25)13-28-20(21)10-9-17(24(28)33)8-7-16-5-3-2-4-6-16/h2-12,18-19,21-22,30H,13-14H2,1H3,(H,26,27,32)/b8-7+/t18-,19-,21+,22-/m1/s1	JROUXBMWQRIOQN-DHFKTIRMSA-N	CC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@@H]12)C(=O)Nc5nccs5	BroadT	BRD-K29720768	BRD-K29720768-001-01-5	Broad Institute of MIT and Harvard	BRD-K29720768			CC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]12)C(=O)Nc1nccs1	InChI=1S/C25H24N4O4S/c1-15(31)29-21-18(19(14-30)22(29)23(32)27-25-26-11-12-34-25)13-28-20(21)10-9-17(24(28)33)8-7-16-5-3-2-4-6-16/h2-12,18-19,21-22,30H,13-14H2,1H3,(H,26,27,32)/b8-7+/t18-,19-,21+,22-/m1/s1	JROUXBMWQRIOQN-DHFKTIRMSA-N	476.151825978							
BRD-K76269942	LSM-13093		54660806	InChI=1S/C30H37N3O3/c1-2-14-32-27-24(17-33-26(27)13-12-23(30(33)36)19-8-4-3-5-9-19)25(18-34)28(32)29(35)31-22-15-20-10-6-7-11-21(20)16-22/h6-8,10-13,22,24-25,27-28,34H,2-5,9,14-18H2,1H3,(H,31,35)/t24-,25-,27+,28-/m1/s1	OSYNMQZPZHDZRS-QKBZBAIHSA-N	CCCN1[C@H]([C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]12)C4=CCCCC4)C(=O)NC5Cc6ccccc6C5	BroadT	BRD-K76269942	BRD-K76269942-001-01-4	Broad Institute of MIT and Harvard	BRD-K76269942			CCCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]12)C(=O)NC1Cc2ccccc2C1	InChI=1S/C30H37N3O3/c1-2-14-32-27-24(17-33-26(27)13-12-23(30(33)36)19-8-4-3-5-9-19)25(18-34)28(32)29(35)31-22-15-20-10-6-7-11-21(20)16-22/h6-8,10-13,22,24-25,27-28,34H,2-5,9,14-18H2,1H3,(H,31,35)/t24-,25-,27+,28-/m1/s1	OSYNMQZPZHDZRS-QKBZBAIHSA-N	487.283492074							101731
BRD-K62063025	LSM-12196		54660767	InChI=1S/C25H25N3O6S/c1-15-6-3-4-8-21(15)35(32,33)28-20-13-27-19(23(28)22(18(20)14-29)25(31)34-2)10-9-17(24(27)30)16-7-5-11-26-12-16/h3-12,18,20,22-23,29H,13-14H2,1-2H3/t18-,20-,22+,23+/m1/s1	IMWJJLFBFPCGES-SQMBMXPBSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]1N2S(=O)(=O)c5ccccc5C	BroadT	BRD-K62063025	BRD-K62063025-001-01-7	Broad Institute of MIT and Harvard	BRD-K62063025			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]1N2S(=O)(=O)c1ccccc1C	InChI=1S/C25H25N3O6S/c1-15-6-3-4-8-21(15)35(32,33)28-20-13-27-19(23(28)22(18(20)14-29)25(31)34-2)10-9-17(24(27)30)16-7-5-11-26-12-16/h3-12,18,20,22-23,29H,13-14H2,1-2H3/t18-,20-,22+,23+/m1/s1	IMWJJLFBFPCGES-SQMBMXPBSA-N	495.14640624							100822
CHEMBL3184271	LSM-43481	BRD-K57393707	54660701	InChI=1S/C28H26N2O6/c31-15-21-20-14-29-22(10-9-19(27(29)32)8-6-17-4-2-1-3-5-17)25(20)30(26(21)28(33)34)13-18-7-11-23-24(12-18)36-16-35-23/h1-12,20-21,25-26,31H,13-16H2,(H,33,34)/b8-6+/t20-,21-,25+,26-/m0/s1	JUBZNFCZFZOAAP-KURLUARPSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N(Cc4ccc5OCOc5c4)[C@@H]1C(=O)O)\C=C\c6ccccc6	BroadT	BRD-K57393707	BRD-K57393707-001-01-0	Broad Institute of MIT and Harvard	BRD-K57393707			OC[C@H]1[C@@H]2Cn3c(=O)c(\C=C\c4ccccc4)ccc3[C@@H]2N(Cc2ccc3OCOc3c2)[C@@H]1C(O)=O	InChI=1S/C28H26N2O6/c31-15-21-20-14-29-22(10-9-19(27(29)32)8-6-17-4-2-1-3-5-17)25(20)30(26(21)28(33)34)13-18-7-11-23-24(12-18)36-16-35-23/h1-12,20-21,25-26,31H,13-16H2,(H,33,34)/b8-6+/t20-,21-,25+,26-/m0/s1	JUBZNFCZFZOAAP-KURLUARPSA-N	486.179086572							
BRD-K63090665	LSM-12267		54660760	InChI=1S/C25H25FN4O3/c26-17-3-1-16(2-4-17)18-5-6-21-23-22(19(14-31)20(29-23)13-30(21)25(18)33)24(32)28-12-9-15-7-10-27-11-8-15/h1-8,10-11,19-20,22-23,29,31H,9,12-14H2,(H,28,32)/t19-,20-,22+,23+/m1/s1	FVDKOQJIZWFRLQ-SCPDWHHUSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H](N2)[C@H]1C(=O)NCCc5ccncc5	BroadT	BRD-K63090665	BRD-K63090665-001-01-4	Broad Institute of MIT and Harvard	BRD-K63090665			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H](N2)[C@H]1C(=O)NCCc1ccncc1	InChI=1S/C25H25FN4O3/c26-17-3-1-16(2-4-17)18-5-6-21-23-22(19(14-31)20(29-23)13-30(21)25(18)33)24(32)28-12-9-15-7-10-27-11-8-15/h1-8,10-11,19-20,22-23,29,31H,9,12-14H2,(H,28,32)/t19-,20-,22+,23+/m1/s1	FVDKOQJIZWFRLQ-SCPDWHHUSA-N	448.1910689							100893
BRD-K80204570	LSM-13327		54661004	InChI=1S/C29H30N4O4/c1-2-25(35)33-24-15-32-23(8-7-21(29(32)37)17-9-11-30-12-10-17)27(33)26(22(24)16-34)28(36)31-20-13-18-5-3-4-6-19(18)14-20/h3-12,20,22,24,26-27,34H,2,13-16H2,1H3,(H,31,36)/t22-,24-,26+,27+/m1/s1	SUYOEXJQLWDMBI-CIOIWQPASA-N	CCC(=O)N1[C@@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@H]1[C@H]([C@@H]2CO)C(=O)NC5Cc6ccccc6C5	BroadT	BRD-K80204570	BRD-K80204570-001-01-4	Broad Institute of MIT and Harvard	BRD-K80204570			CCC(=O)N1[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NC1Cc2ccccc2C1	InChI=1S/C29H30N4O4/c1-2-25(35)33-24-15-32-23(8-7-21(29(32)37)17-9-11-30-12-10-17)27(33)26(22(24)16-34)28(36)31-20-13-18-5-3-4-6-19(18)14-20/h3-12,20,22,24,26-27,34H,2,13-16H2,1H3,(H,31,36)/t22-,24-,26+,27+/m1/s1	SUYOEXJQLWDMBI-CIOIWQPASA-N	498.22670548							101966
BRD-K32027259	LSM-10369		54660896	InChI=1S/C25H28N4O4S/c1-3-11-28-21-17(18(14-30)22(28)23(31)27-25-26-10-12-34-25)13-29-19(21)9-8-16(24(29)32)15-6-4-5-7-20(15)33-2/h4-10,12,17-18,21-22,30H,3,11,13-14H2,1-2H3,(H,26,27,31)/t17-,18-,21+,22-/m0/s1	FBORFXHKEDCJEC-HXHBTQRASA-N	CCCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@H]12)C(=O)Nc5nccs5	BroadT	BRD-K32027259	BRD-K32027259-001-01-6	Broad Institute of MIT and Harvard	BRD-K32027259			CCCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@H]12)C(=O)Nc1nccs1	InChI=1S/C25H28N4O4S/c1-3-11-28-21-17(18(14-30)22(28)23(31)27-25-26-10-12-34-25)13-29-19(21)9-8-16(24(29)32)15-6-4-5-7-20(15)33-2/h4-10,12,17-18,21-22,30H,3,11,13-14H2,1-2H3,(H,26,27,31)/t17-,18-,21+,22-/m0/s1	FBORFXHKEDCJEC-HXHBTQRASA-N	480.183126106							98990
BRD-K51036109	LSM-11544		54660759	InChI=1S/C25H30N4O5S/c1-35(33,34)29-22-19(14-28-21(22)7-6-18(25(28)32)17-4-2-3-5-17)20(15-30)23(29)24(31)27-13-10-16-8-11-26-12-9-16/h4,6-9,11-12,19-20,22-23,30H,2-3,5,10,13-15H2,1H3,(H,27,31)/t19-,20-,22+,23-/m0/s1	BCVWPOWNMNUOMW-RLBLXZPPSA-N	CS(=O)(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@H]12)C(=O)NCCc5ccncc5	BroadT	BRD-K51036109	BRD-K51036109-001-01-5	Broad Institute of MIT and Harvard	BRD-K51036109			CS(=O)(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]12)C(=O)NCCc1ccncc1	InChI=1S/C25H30N4O5S/c1-35(33,34)29-22-19(14-28-21(22)7-6-18(25(28)32)17-4-2-3-5-17)20(15-30)23(29)24(31)27-13-10-16-8-11-26-12-9-16/h4,6-9,11-12,19-20,22-23,30H,2-3,5,10,13-15H2,1H3,(H,27,31)/t19-,20-,22+,23-/m0/s1	BCVWPOWNMNUOMW-RLBLXZPPSA-N	498.19369079							100167
BRD-K34332181	LSM-10497		54660747	InChI=1S/C24H28ClN3O3/c25-19-8-3-2-7-16(19)13-28-22-17(14-27-20(22)9-6-10-21(27)30)18(15-29)23(28)24(31)26-11-4-1-5-12-26/h2-3,6-10,17-18,22-23,29H,1,4-5,11-15H2/t17-,18-,22+,23-/m0/s1	VQCZTXNNKFBGGK-JRSMBCBASA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N(Cc4ccccc4Cl)[C@@H]1C(=O)N5CCCCC5	BroadT	BRD-K34332181	BRD-K34332181-001-01-1	Broad Institute of MIT and Harvard	BRD-K34332181			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N(Cc2ccccc2Cl)[C@@H]1C(=O)N1CCCCC1	InChI=1S/C24H28ClN3O3/c25-19-8-3-2-7-16(19)13-28-22-17(14-27-20(22)9-6-10-21(27)30)18(15-29)23(28)24(31)26-11-4-1-5-12-26/h2-3,6-10,17-18,22-23,29H,1,4-5,11-15H2/t17-,18-,22+,23-/m0/s1	VQCZTXNNKFBGGK-JRSMBCBASA-N	441.181919496							99118
BRD-K50694553	LSM-11516		54660849	InChI=1S/C26H28FN3O4/c1-28(2)26(34)23-19(14-31)18-13-29-21(12-11-16(24(29)32)15-7-3-4-8-15)22(18)30(23)25(33)17-9-5-6-10-20(17)27/h5-7,9-12,18-19,22-23,31H,3-4,8,13-14H2,1-2H3/t18-,19-,22+,23-/m0/s1	QRPMBXIBVHHSCR-LBVMUVSTSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@@H]2N1C(=O)c5ccccc5F	BroadT	BRD-K50694553	BRD-K50694553-001-01-3	Broad Institute of MIT and Harvard	BRD-K50694553			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]2N1C(=O)c1ccccc1F	InChI=1S/C26H28FN3O4/c1-28(2)26(34)23-19(14-31)18-13-29-21(12-11-16(24(29)32)15-7-3-4-8-15)22(18)30(23)25(33)17-9-5-6-10-20(17)27/h5-7,9-12,18-19,22-23,31H,3-4,8,13-14H2,1-2H3/t18-,19-,22+,23-/m0/s1	QRPMBXIBVHHSCR-LBVMUVSTSA-N	465.206384606							100137
BRD-M97057852	LSM-45090		54661026	InChI=1S/C22H28N4O4S/c1-3-4-14-5-6-16-20-19(21(28)24-7-9-30-2)15(13-27)17(11-26(16)22(14)29)25(20)12-18-23-8-10-31-18/h3-6,8,10,15,17,19-20,27H,7,9,11-13H2,1-2H3,(H,24,28)/t15-,17-,19+,20+/m1/s1	YAZSZKUPWYSKIW-BEKAIBRUSA-N	COCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]1N2Cc4nccs4)C=CC	BroadT	BRD-M97057852	BRD-M97057852-001-01-4	Broad Institute of MIT and Harvard	BRD-M97057852		COCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]1N2Cc1nccs1.COCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]1N2Cc1nccs1	COCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]1N2Cc1nccs1.COCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]1N2Cc1nccs1	InChI=1S/2C22H28N4O4S/c2*1-3-4-14-5-6-16-20-19(21(28)24-7-9-30-2)15(13-27)17(11-26(16)22(14)29)25(20)12-18-23-8-10-31-18/h2*3-6,8,10,15,17,19-20,27H,7,9,11-13H2,1-2H3,(H,24,28)/b4-3+;4-3-/t2*15-,17-,19+,20+/m11/s1	QVJUFKVGYWDMAL-MGMHOQGXSA-N	444.183126106							103327
BRD-K67583114	LSM-12542		54660752	InChI=1S/C19H19F2N3O3/c20-11-4-10(5-12(21)6-11)7-22-19(27)17-13(9-25)14-8-24-15(18(17)23-14)2-1-3-16(24)26/h1-6,13-14,17-18,23,25H,7-9H2,(H,22,27)/t13-,14-,17+,18+/m0/s1	ZFBXTHNADMEDJT-LBTBCDHLSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H](N2)[C@@H]1C(=O)NCc4cc(F)cc(F)c4	BroadT	BRD-K67583114	BRD-K67583114-001-01-1	Broad Institute of MIT and Harvard	BRD-K67583114			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H](N2)[C@@H]1C(=O)NCc1cc(F)cc(F)c1	InChI=1S/C19H19F2N3O3/c20-11-4-10(5-12(21)6-11)7-22-19(27)17-13(9-25)14-8-24-15(18(17)23-14)2-1-3-16(24)26/h1-6,13-14,17-18,23,25H,7-9H2,(H,22,27)/t13-,14-,17+,18+/m0/s1	ZFBXTHNADMEDJT-LBTBCDHLSA-N	375.139447898							101173
BRD-K42953652	LSM-11035		54660818	InChI=1S/C28H28N4O4/c1-17(34)32-24-15-31-23(9-8-21(27(31)35)19-7-4-11-29-13-19)26(32)25(22(24)16-33)28(36)30-12-10-18-5-2-3-6-20(18)14-30/h2-9,11,13,22,24-26,33H,10,12,14-16H2,1H3/t22-,24-,25+,26+/m1/s1	KMPCXPGJDHNPDW-BPHNFWMXSA-N	CC(=O)N1[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]1[C@H]([C@@H]2CO)C(=O)N5CCc6ccccc6C5	BroadT	BRD-K42953652	BRD-K42953652-001-01-4	Broad Institute of MIT and Harvard	BRD-K42953652			CC(=O)N1[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N1CCc2ccccc2C1	InChI=1S/C28H28N4O4/c1-17(34)32-24-15-31-23(9-8-21(27(31)35)19-7-4-11-29-13-19)26(32)25(22(24)16-33)28(36)30-12-10-18-5-2-3-6-20(18)14-30/h2-9,11,13,22,24-26,33H,10,12,14-16H2,1H3/t22-,24-,25+,26+/m1/s1	KMPCXPGJDHNPDW-BPHNFWMXSA-N	484.211055416							99656
BRD-K93123387	LSM-43500		54660786	InChI=1S/C28H29N3O3/c1-18(20-10-6-3-7-11-20)29-27(33)25-22(17-32)23-16-31-24(26(25)30-23)15-14-21(28(31)34)13-12-19-8-4-2-5-9-19/h2-15,18,22-23,25-26,30,32H,16-17H2,1H3,(H,29,33)/b13-12+/t18-,22+,23+,25-,26-/m0/s1	FIIWKRFZHSLQJE-HIMRGKGJSA-N	C[C@H](NC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@@H]1N2)c5ccccc5	BroadT	BRD-K93123387	BRD-K93123387-001-01-4	Broad Institute of MIT and Harvard	BRD-K93123387			C[C@H](NC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]1N2)c1ccccc1	InChI=1S/C28H29N3O3/c1-18(20-10-6-3-7-11-20)29-27(33)25-22(17-32)23-16-31-24(26(25)30-23)15-14-21(28(31)34)13-12-19-8-4-2-5-9-19/h2-15,18,22-23,25-26,30,32H,16-17H2,1H3,(H,29,33)/b13-12+/t18-,22+,23+,25-,26-/m0/s1	FIIWKRFZHSLQJE-HIMRGKGJSA-N	455.220891818							
MLS005000215	LSM-9693	BRD-K20790586	54660652	InChI=1S/C24H29F2N5O4/c1-29(2)10-4-9-27-23(34)21-15(13-32)19-12-30-18(5-3-6-20(30)33)22(21)31(19)24(35)28-17-11-14(25)7-8-16(17)26/h3,5-8,11,15,19,21-22,32H,4,9-10,12-13H2,1-2H3,(H,27,34)(H,28,35)/t15-,19-,21+,22+/m0/s1	CIBCEUNPWMQAQP-RGGPELTISA-N	CN(C)CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]1N2C(=O)Nc4cc(F)ccc4F	BroadT	BRD-K20790586	BRD-K20790586-001-01-7	Broad Institute of MIT and Harvard	BRD-K20790586			CN(C)CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2C(=O)Nc1cc(F)ccc1F	InChI=1S/C24H29F2N5O4/c1-29(2)10-4-9-27-23(34)21-15(13-32)19-12-30-18(5-3-6-20(30)33)22(21)31(19)24(35)28-17-11-14(25)7-8-16(17)26/h3,5-8,11,15,19,21-22,32H,4,9-10,12-13H2,1-2H3,(H,27,34)(H,28,35)/t15-,19-,21+,22+/m0/s1	CIBCEUNPWMQAQP-RGGPELTISA-N	489.218760858							98314
BRD-K89226093	LSM-13921		54660697	InChI=1S/C23H26F3N3O3/c1-14(15-6-3-2-4-7-15)27-22(32)20-16(13-30)18-12-29-17(8-5-9-19(29)31)21(20)28(18)11-10-23(24,25)26/h2-9,14,16,18,20-21,30H,10-13H2,1H3,(H,27,32)/t14-,16+,18+,20-,21-/m0/s1	LOVSINJIWNBKBE-SJRSHZEHSA-N	C[C@H](NC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]1N2CCC(F)(F)F)c4ccccc4	BroadT	BRD-K89226093	BRD-K89226093-001-01-6	Broad Institute of MIT and Harvard	BRD-K89226093			C[C@H](NC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2CCC(F)(F)F)c1ccccc1	InChI=1S/C23H26F3N3O3/c1-14(15-6-3-2-4-7-15)27-22(32)20-16(13-30)18-12-29-17(8-5-9-19(29)31)21(20)28(18)11-10-23(24,25)26/h2-9,14,16,18,20-21,30H,10-13H2,1H3,(H,27,32)/t14-,16+,18+,20-,21-/m0/s1	LOVSINJIWNBKBE-SJRSHZEHSA-N	449.192626322							102574
BRD-K15400899	LSM-9349		54660962	InChI=1S/C25H33N5O3/c31-17-20-19-16-29-21(8-6-9-22(29)32)23(19)30(15-18-7-2-3-10-26-18)24(20)25(33)27-11-14-28-12-4-1-5-13-28/h2-3,6-10,19-20,23-24,31H,1,4-5,11-17H2,(H,27,33)/t19-,20-,23+,24-/m1/s1	KUOHVPUFFVLNET-MYSJAJEPSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N(Cc4ccccn4)[C@H]1C(=O)NCCN5CCCCC5	BroadT	BRD-K15400899	BRD-K15400899-001-01-2	Broad Institute of MIT and Harvard	BRD-K15400899			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N(Cc2ccccn2)[C@H]1C(=O)NCCN1CCCCC1	InChI=1S/C25H33N5O3/c31-17-20-19-16-29-21(8-6-9-22(29)32)23(19)30(15-18-7-2-3-10-26-18)24(20)25(33)27-11-14-28-12-4-1-5-13-28/h2-3,6-10,19-20,23-24,31H,1,4-5,11-17H2,(H,27,33)/t19-,20-,23+,24-/m1/s1	KUOHVPUFFVLNET-MYSJAJEPSA-N	451.258339966							97970
BRD-K07609594	LSM-43447		54660798	InChI=1S/C28H36N4O4/c1-30-25-22(23(19-33)26(30)27(34)29-12-5-13-31-14-16-36-17-15-31)18-32-24(25)11-10-21(28(32)35)9-8-20-6-3-2-4-7-20/h2-4,6-11,22-23,25-26,33H,5,12-19H2,1H3,(H,29,34)/b9-8+/t22-,23-,25+,26-/m1/s1	LTCABXOBQOXXRS-MDDGOGIGSA-N	CN1[C@H]([C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]12)\C=C\c4ccccc4)C(=O)NCCCN5CCOCC5	BroadT	BRD-K07609594	BRD-K07609594-001-01-6	Broad Institute of MIT and Harvard	BRD-K07609594			CN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]12)C(=O)NCCCN1CCOCC1	InChI=1S/C28H36N4O4/c1-30-25-22(23(19-33)26(30)27(34)29-12-5-13-31-14-16-36-17-15-31)18-32-24(25)11-10-21(28(32)35)9-8-20-6-3-2-4-7-20/h2-4,6-11,22-23,25-26,33H,5,12-19H2,1H3,(H,29,34)/b9-8+/t22-,23-,25+,26-/m1/s1	LTCABXOBQOXXRS-MDDGOGIGSA-N	492.273655672							
BRD-K02511275	LSM-8590		54660754	InChI=1S/C26H26ClN3O4/c1-34-22-9-5-3-7-16(22)17-10-11-21-23-18(13-30(21)26(17)33)19(14-31)24(29-23)25(32)28-12-15-6-2-4-8-20(15)27/h2-11,18-19,23-24,29,31H,12-14H2,1H3,(H,28,32)/t18-,19-,23+,24-/m0/s1	HIRFHYYIFOJILK-TWXAQOBRSA-N	COc1ccccc1C2=CC=C3[C@@H]4N[C@@H]([C@@H](CO)[C@@H]4CN3C2=O)C(=O)NCc5ccccc5Cl	BroadT	BRD-K02511275	BRD-K02511275-001-01-5	Broad Institute of MIT and Harvard	BRD-K02511275			COc1ccccc1-c1ccc2[C@@H]3N[C@@H]([C@@H](CO)[C@@H]3Cn2c1=O)C(=O)NCc1ccccc1Cl	InChI=1S/C26H26ClN3O4/c1-34-22-9-5-3-7-16(22)17-10-11-21-23-18(13-30(21)26(17)33)19(14-31)24(29-23)25(32)28-12-15-6-2-4-8-20(15)27/h2-11,18-19,23-24,29,31H,12-14H2,1H3,(H,28,32)/t18-,19-,23+,24-/m0/s1	HIRFHYYIFOJILK-TWXAQOBRSA-N	479.161184052							97211
BRD-K04366697	LSM-8694		54660793	InChI=1S/C24H20FN3O5/c25-14-5-3-4-13(10-14)15-7-8-19-20-16(11-27(19)22(15)30)17(12-29)21(24(32)33)28(20)23(31)18-6-1-2-9-26-18/h1-10,16-17,20-21,29H,11-12H2,(H,32,33)/t16-,17-,20+,21-/m0/s1	PPTZIPDIUOVGPF-PZBISTMVSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@@H]2N([C@@H]1C(=O)O)C(=O)c5ccccn5	BroadT	BRD-K04366697	BRD-K04366697-001-01-2	Broad Institute of MIT and Harvard	BRD-K04366697			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]2N([C@@H]1C(O)=O)C(=O)c1ccccn1	InChI=1S/C24H20FN3O5/c25-14-5-3-4-13(10-14)15-7-8-19-20-16(11-27(19)22(15)30)17(12-29)21(24(32)33)28(20)23(31)18-6-1-2-9-26-18/h1-10,16-17,20-21,29H,11-12H2,(H,32,33)/t16-,17-,20+,21-/m0/s1	PPTZIPDIUOVGPF-PZBISTMVSA-N	449.13869897							97315
BRD-K62044515	LSM-12194		54660637	InChI=1S/C21H26N4O4/c26-11-15-17-10-24-16(5-4-6-18(24)27)20(25(17)9-14-12-29-13-22-14)19(15)21(28)23-7-2-1-3-8-23/h4-6,12-13,15,17,19-20,26H,1-3,7-11H2/t15-,17-,19+,20+/m0/s1	PJVBFVCJEZYLHS-SMMRIJLZSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)N4CCCCC4)N2Cc5cocn5	BroadT	BRD-K62044515	BRD-K62044515-001-01-4	Broad Institute of MIT and Harvard	BRD-K62044515			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)N1CCCCC1)N2Cc1cocn1	InChI=1S/C21H26N4O4/c26-11-15-17-10-24-16(5-4-6-18(24)27)20(25(17)9-14-12-29-13-22-14)19(15)21(28)23-7-2-1-3-8-23/h4-6,12-13,15,17,19-20,26H,1-3,7-11H2/t15-,17-,19+,20+/m0/s1	PJVBFVCJEZYLHS-SMMRIJLZSA-N	398.195405352							100820
BRD-K93116089	LSM-14988		54661034	InChI=1S/C26H27FN4O4/c27-16-4-1-3-15(9-16)19-7-8-21-24-23(25(33)29-17-5-2-6-17)20(12-32)22(11-31(21)26(19)34)30(24)10-18-13-35-14-28-18/h1,3-4,7-9,13-14,17,20,22-24,32H,2,5-6,10-12H2,(H,29,33)/t20-,22-,23+,24+/m1/s1	UTTHWALNPQWSTE-AZOUXBGGSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@@H]([C@H]1C(=O)NC5CCC5)N2Cc6cocn6	BroadT	BRD-K93116089	BRD-K93116089-001-01-9	Broad Institute of MIT and Harvard	BRD-K93116089			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]([C@H]1C(=O)NC1CCC1)N2Cc1cocn1	InChI=1S/C26H27FN4O4/c27-16-4-1-3-15(9-16)19-7-8-21-24-23(25(33)29-17-5-2-6-17)20(12-32)22(11-31(21)26(19)34)30(24)10-18-13-35-14-28-18/h1,3-4,7-9,13-14,17,20,22-24,32H,2,5-6,10-12H2,(H,29,33)/t20-,22-,23+,24+/m1/s1	UTTHWALNPQWSTE-AZOUXBGGSA-N	478.201633584							103644
BRD-K10689551	LSM-9074		54660961	InChI=1S/C25H33N5O3/c31-17-20-19-16-29-21(8-6-9-22(29)32)23(19)30(15-18-7-2-3-10-26-18)24(20)25(33)27-11-14-28-12-4-1-5-13-28/h2-3,6-10,19-20,23-24,31H,1,4-5,11-17H2,(H,27,33)/t19-,20-,23+,24-/m0/s1	KUOHVPUFFVLNET-JVODISISSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N(Cc4ccccn4)[C@@H]1C(=O)NCCN5CCCCC5	BroadT	BRD-K10689551	BRD-K10689551-001-01-4	Broad Institute of MIT and Harvard	BRD-K10689551			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N(Cc2ccccn2)[C@@H]1C(=O)NCCN1CCCCC1	InChI=1S/C25H33N5O3/c31-17-20-19-16-29-21(8-6-9-22(29)32)23(19)30(15-18-7-2-3-10-26-18)24(20)25(33)27-11-14-28-12-4-1-5-13-28/h2-3,6-10,19-20,23-24,31H,1,4-5,11-17H2,(H,27,33)/t19-,20-,23+,24-/m0/s1	KUOHVPUFFVLNET-JVODISISSA-N	451.258339966							97695
BRD-K40050963	LSM-10870		54660822	InChI=1S/C27H30N4O4/c1-35-23-7-3-2-5-19(23)15-31-25-20(16-30-22(25)6-4-8-24(30)33)21(17-32)26(31)27(34)29-14-11-18-9-12-28-13-10-18/h2-10,12-13,20-21,25-26,32H,11,14-17H2,1H3,(H,29,34)/t20-,21-,25+,26-/m1/s1	SNUVNVMLNYTLKH-YTFNCPKPSA-N	COc1ccccc1CN2[C@H]([C@H](CO)[C@H]3CN4C(=O)C=CC=C4[C@@H]23)C(=O)NCCc5ccncc5	BroadT	BRD-K40050963	BRD-K40050963-001-01-5	Broad Institute of MIT and Harvard	BRD-K40050963			COc1ccccc1CN1[C@H]([C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]12)C(=O)NCCc1ccncc1	InChI=1S/C27H30N4O4/c1-35-23-7-3-2-5-19(23)15-31-25-20(16-30-22(25)6-4-8-24(30)33)21(17-32)26(31)27(34)29-14-11-18-9-12-28-13-10-18/h2-10,12-13,20-21,25-26,32H,11,14-17H2,1H3,(H,29,34)/t20-,21-,25+,26-/m1/s1	SNUVNVMLNYTLKH-YTFNCPKPSA-N	474.22670548							99491
BRD-M22555785	LSM-45014		54660968	InChI=1S/C21H21FN2O6S/c1-2-5-12-8-9-15-19-18(21(27)28)13(11-25)16(10-23(15)20(12)26)24(19)31(29,30)17-7-4-3-6-14(17)22/h2-9,13,16,18-19,25H,10-11H2,1H3,(H,27,28)/t13-,16-,18+,19+/m1/s1	YSPVRUAWSOLRRU-OLQIXAPSSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3S(=O)(=O)c4ccccc4F)C(=O)O	BroadT	BRD-M22555785	BRD-M22555785-001-01-9	Broad Institute of MIT and Harvard	BRD-M22555785		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(O)=O)[C@H]2N3S(=O)(=O)c2ccccc2F)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(O)=O)[C@H]2N3S(=O)(=O)c2ccccc2F)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(O)=O)[C@H]2N3S(=O)(=O)c2ccccc2F)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(O)=O)[C@H]2N3S(=O)(=O)c2ccccc2F)c1=O	InChI=1S/2C21H21FN2O6S/c2*1-2-5-12-8-9-15-19-18(21(27)28)13(11-25)16(10-23(15)20(12)26)24(19)31(29,30)17-7-4-3-6-14(17)22/h2*2-9,13,16,18-19,25H,10-11H2,1H3,(H,27,28)/b5-2+;5-2-/t2*13-,16-,18+,19+/m11/s1	FZXWICNJJBUHOD-FWVUMGCLSA-N	448.110435302							103251
BRD-K36725752	LSM-10651		54660750	InChI=1S/C31H35N3O3/c35-20-25-27-19-34-26(16-15-24(31(34)37)22-11-5-2-6-12-22)29(28(25)30(36)32-23-13-7-8-14-23)33(27)18-17-21-9-3-1-4-10-21/h1-6,9-12,15-16,23,25,27-29,35H,7-8,13-14,17-20H2,(H,32,36)/t25-,27-,28+,29+/m0/s1	BONPOAJFWRGMIG-ANHREMPLSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@H]([C@@H]1C(=O)NC4CCCC4)N2CCc5ccccc5)c6ccccc6	BroadT	BRD-K36725752	BRD-K36725752-001-01-3	Broad Institute of MIT and Harvard	BRD-K36725752			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]([C@@H]1C(=O)NC1CCCC1)N2CCc1ccccc1	InChI=1S/C31H35N3O3/c35-20-25-27-19-34-26(16-15-24(31(34)37)22-11-5-2-6-12-22)29(28(25)30(36)32-23-13-7-8-14-23)33(27)18-17-21-9-3-1-4-10-21/h1-6,9-12,15-16,23,25,27-29,35H,7-8,13-14,17-20H2,(H,32,36)/t25-,27-,28+,29+/m0/s1	BONPOAJFWRGMIG-ANHREMPLSA-N	497.26784201							99272
BRD-K60308664	LSM-12074		54661022	InChI=1S/C25H24FN3O4/c1-33-25(32)23-19(14-30)18-13-28-21(22(18)29(23)12-15-8-10-27-11-9-15)7-6-17(24(28)31)16-4-2-3-5-20(16)26/h2-11,18-19,22-23,30H,12-14H2,1H3/t18-,19-,22+,23-/m1/s1	SOHXSUHWQBDTJV-PJIZGREPSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]2N1Cc5ccncc5	BroadT	BRD-K60308664	BRD-K60308664-001-01-4	Broad Institute of MIT and Harvard	BRD-K60308664			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]2N1Cc1ccncc1	InChI=1S/C25H24FN3O4/c1-33-25(32)23-19(14-30)18-13-28-21(22(18)29(23)12-15-8-10-27-11-9-15)7-6-17(24(28)31)16-4-2-3-5-20(16)26/h2-11,18-19,22-23,30H,12-14H2,1H3/t18-,19-,22+,23-/m1/s1	SOHXSUHWQBDTJV-PJIZGREPSA-N	449.175084478							100700
BRD-K59977049	LSM-12054		54660952	InChI=1S/C25H24ClN5O4/c1-14(33)31-22-18(11-30-21(22)7-6-17(25(30)35)16-8-27-13-28-9-16)19(12-32)23(31)24(34)29-10-15-4-2-3-5-20(15)26/h2-9,13,18-19,22-23,32H,10-12H2,1H3,(H,29,34)/t18-,19-,22+,23-/m0/s1	NRDXZHALSORZQF-LBVMUVSTSA-N	CC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@H]12)C(=O)NCc5ccccc5Cl	BroadT	BRD-K59977049	BRD-K59977049-001-01-5	Broad Institute of MIT and Harvard	BRD-K59977049			CC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@H]12)C(=O)NCc1ccccc1Cl	InChI=1S/C25H24ClN5O4/c1-14(33)31-22-18(11-30-21(22)7-6-17(25(30)35)16-8-27-13-28-9-16)19(12-32)23(31)24(34)29-10-15-4-2-3-5-20(15)26/h2-9,13,18-19,22-23,32H,10-12H2,1H3,(H,29,34)/t18-,19-,22+,23-/m0/s1	NRDXZHALSORZQF-LBVMUVSTSA-N	493.151682008							100680
BRD-K90073570	LSM-14974		54660721	InChI=1S/C24H27F3N4O4/c25-24(26,27)5-7-30-20-17(18(14-32)21(30)23(34)29-8-10-35-11-9-29)13-31-19(20)4-3-16(22(31)33)15-2-1-6-28-12-15/h1-4,6,12,17-18,20-21,32H,5,7-11,13-14H2/t17-,18-,20+,21-/m0/s1	FOQMOMHPOVABOQ-MMKMLUHNSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]2N(CCC(F)(F)F)[C@@H]1C(=O)N5CCOCC5	BroadT	BRD-K90073570	BRD-K90073570-001-01-1	Broad Institute of MIT and Harvard	BRD-K90073570			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]2N(CCC(F)(F)F)[C@@H]1C(=O)N1CCOCC1	InChI=1S/C24H27F3N4O4/c25-24(26,27)5-7-30-20-17(18(14-32)21(30)23(34)29-8-10-35-11-9-29)13-31-19(20)4-3-16(22(31)33)15-2-1-6-28-12-15/h1-4,6,12,17-18,20-21,32H,5,7-11,13-14H2/t17-,18-,20+,21-/m0/s1	FOQMOMHPOVABOQ-MMKMLUHNSA-N	492.198439984							103630
BRD-K39685946	LSM-10843		54660924	InChI=1S/C24H30F3N3O3/c25-24(26,27)9-10-29-19-12-30-18(8-7-16(23(30)33)15-3-1-2-4-15)21(29)20(17(19)13-31)22(32)28-11-14-5-6-14/h3,7-8,14,17,19-21,31H,1-2,4-6,9-13H2,(H,28,32)/t17-,19-,20+,21+/m1/s1	AMCQVYASXAVENJ-PBASOCQRSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@@H]([C@H]1C(=O)NCC5CC5)N2CCC(F)(F)F	BroadT	BRD-K39685946	BRD-K39685946-001-01-3	Broad Institute of MIT and Harvard	BRD-K39685946			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]([C@H]1C(=O)NCC1CC1)N2CCC(F)(F)F	InChI=1S/C24H30F3N3O3/c25-24(26,27)9-10-29-19-12-30-18(8-7-16(23(30)33)15-3-1-2-4-15)21(29)20(17(19)13-31)22(32)28-11-14-5-6-14/h3,7-8,14,17,19-21,31H,1-2,4-6,9-13H2,(H,28,32)/t17-,19-,20+,21+/m1/s1	AMCQVYASXAVENJ-PBASOCQRSA-N	465.22392645							99464
BRD-K60027289	LSM-12058		54660830	InChI=1S/C28H36N4O4/c1-30(2)14-6-13-29-27(35)25-21(17-33)23-16-31-22(26(25)32(23)24(34)15-18-9-10-18)12-11-20(28(31)36)19-7-4-3-5-8-19/h3-5,7-8,11-12,18,21,23,25-26,33H,6,9-10,13-17H2,1-2H3,(H,29,35)/t21-,23-,25+,26+/m0/s1	ZADPRABAISSLKD-AAOIWRJWSA-N	CN(C)CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@H]1N2C(=O)CC5CC5	BroadT	BRD-K60027289	BRD-K60027289-001-01-5	Broad Institute of MIT and Harvard	BRD-K60027289			CN(C)CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]1N2C(=O)CC1CC1	InChI=1S/C28H36N4O4/c1-30(2)14-6-13-29-27(35)25-21(17-33)23-16-31-22(26(25)32(23)24(34)15-18-9-10-18)12-11-20(28(31)36)19-7-4-3-5-8-19/h3-5,7-8,11-12,18,21,23,25-26,33H,6,9-10,13-17H2,1-2H3,(H,29,35)/t21-,23-,25+,26+/m0/s1	ZADPRABAISSLKD-AAOIWRJWSA-N	492.273655672							100684
BRD-K28841686	LSM-10178		54660888	InChI=1S/C25H27N3O5/c1-33-25(32)23-19(14-29)18-13-27-20(9-8-17(24(27)31)16-6-2-3-7-16)22(18)28(23)21(30)11-15-5-4-10-26-12-15/h4-6,8-10,12,18-19,22-23,29H,2-3,7,11,13-14H2,1H3/t18-,19-,22+,23-/m0/s1	MVZYZZDTAGMQFB-LBVMUVSTSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@@H]2N1C(=O)Cc5cccnc5	BroadT	BRD-K28841686	BRD-K28841686-001-01-9	Broad Institute of MIT and Harvard	BRD-K28841686			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]2N1C(=O)Cc1cccnc1	InChI=1S/C25H27N3O5/c1-33-25(32)23-19(14-29)18-13-27-20(9-8-17(24(27)31)16-6-2-3-7-16)22(18)28(23)21(30)11-15-5-4-10-26-12-15/h4-6,8-10,12,18-19,22-23,29H,2-3,7,11,13-14H2,1H3/t18-,19-,22+,23-/m0/s1	MVZYZZDTAGMQFB-LBVMUVSTSA-N	449.195070994							98799
BRD-M91803535	LSM-45081		54660911	InChI=1S/C25H29F3N4O3/c1-2-3-17-4-5-19-22-21(23(34)30-12-8-16-6-10-29-11-7-16)18(15-33)20(14-32(19)24(17)35)31(22)13-9-25(26,27)28/h2-7,10-11,18,20-22,33H,8-9,12-15H2,1H3,(H,30,34)/t18-,20-,21+,22+/m0/s1	GMFBTTQFVVUQAX-VXSCBNMQSA-N	CC=CC1=CC=C2[C@@H]3[C@@H]([C@@H](CO)[C@H](CN2C1=O)N3CCC(F)(F)F)C(=O)NCCc4ccncc4	BroadT	BRD-M91803535	BRD-M91803535-001-01-2	Broad Institute of MIT and Harvard	BRD-M91803535		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCc4ccncc4)[C@@H]2N3CCC(F)(F)F)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCc4ccncc4)[C@@H]2N3CCC(F)(F)F)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCc4ccncc4)[C@@H]2N3CCC(F)(F)F)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCCc4ccncc4)[C@@H]2N3CCC(F)(F)F)c1=O	InChI=1S/2C25H29F3N4O3/c2*1-2-3-17-4-5-19-22-21(23(34)30-12-8-16-6-10-29-11-7-16)18(15-33)20(14-32(19)24(17)35)31(22)13-9-25(26,27)28/h2*2-7,10-11,18,20-22,33H,8-9,12-15H2,1H3,(H,30,34)/b3-2+;3-2-/t2*18-,20-,21+,22+/m00/s1	ADTLNXINPWOAFZ-PWGLSNLWSA-N	490.219175428							103318
BRD-M32778103	LSM-45026		54660979	InChI=1S/C28H29N5O4/c1-3-7-19-10-11-23-24-20(15-32(23)27(19)36)21(16-34)25(33(24)28(37)22-14-29-12-13-30-22)26(35)31-17(2)18-8-5-4-6-9-18/h3-14,17,20-21,24-25,34H,15-16H2,1-2H3,(H,31,35)/t17-,20-,21-,24+,25-/m1/s1	GAGDVGIWPFJCDU-WVJYQVJNSA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3C(=O)c4cnccn4)C(=O)N[C@H](C)c5ccccc5	BroadT	BRD-M32778103	BRD-M32778103-001-01-0	Broad Institute of MIT and Harvard	BRD-M32778103		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N[C@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N[C@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@H]23)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N[C@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N[C@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@H]23)c1=O	InChI=1S/2C28H29N5O4/c2*1-3-7-19-10-11-23-24-20(15-32(23)27(19)36)21(16-34)25(33(24)28(37)22-14-29-12-13-30-22)26(35)31-17(2)18-8-5-4-6-9-18/h2*3-14,17,20-21,24-25,34H,15-16H2,1-2H3,(H,31,35)/b7-3+;7-3-/t2*17-,20-,21-,24+,25-/m11/s1	UURQJTAZHVTRJQ-NVCLPCFHSA-N	499.221954458							103263
BRD-K61764820	LSM-12172		54660832	InChI=1S/C26H29N5O4/c32-14-21-20-13-30-22(5-4-19(25(30)33)17-6-8-27-9-7-17)23(20)31(12-18-15-35-16-28-18)24(21)26(34)29-10-2-1-3-11-29/h4-9,15-16,20-21,23-24,32H,1-3,10-14H2/t20-,21-,23+,24-/m1/s1	KRPKJWJGWXBFEA-CJTFWIGWSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@H]2N(Cc5cocn5)[C@H]1C(=O)N6CCCCC6	BroadT	BRD-K61764820	BRD-K61764820-001-01-8	Broad Institute of MIT and Harvard	BRD-K61764820			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]2N(Cc2cocn2)[C@H]1C(=O)N1CCCCC1	InChI=1S/C26H29N5O4/c32-14-21-20-13-30-22(5-4-19(25(30)33)17-6-8-27-9-7-17)23(20)31(12-18-15-35-16-28-18)24(21)26(34)29-10-2-1-3-11-29/h4-9,15-16,20-21,23-24,32H,1-3,10-14H2/t20-,21-,23+,24-/m1/s1	KRPKJWJGWXBFEA-CJTFWIGWSA-N	475.221954458							100798
BRD-K50298819	LSM-11489		54660730	InChI=1S/C24H33N3O4/c28-14-18-17-13-26-19(7-4-8-20(26)29)22(17)27(21(30)11-15-9-10-15)23(18)24(31)25-12-16-5-2-1-3-6-16/h4,7-8,15-18,22-23,28H,1-3,5-6,9-14H2,(H,25,31)/t17-,18-,22+,23-/m0/s1	ZDTYRDGQWDVLBB-JRSMBCBASA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N([C@@H]1C(=O)NCC4CCCCC4)C(=O)CC5CC5	BroadT	BRD-K50298819	BRD-K50298819-001-01-3	Broad Institute of MIT and Harvard	BRD-K50298819			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N([C@@H]1C(=O)NCC1CCCCC1)C(=O)CC1CC1	InChI=1S/C24H33N3O4/c28-14-18-17-13-26-19(7-4-8-20(26)29)22(17)27(21(30)11-15-9-10-15)23(18)24(31)25-12-16-5-2-1-3-6-16/h4,7-8,15-18,22-23,28H,1-3,5-6,9-14H2,(H,25,31)/t17-,18-,22+,23-/m0/s1	ZDTYRDGQWDVLBB-JRSMBCBASA-N	427.247106566							100110
BRD-K94823396	LSM-14243		54660910	InChI=1S/C21H21N3O5/c25-10-14-16-9-23-15(4-3-13(20(23)27)11-5-7-22-8-6-11)18(17(14)21(28)29)24(16)19(26)12-1-2-12/h3-8,12,14,16-18,25H,1-2,9-10H2,(H,28,29)/t14-,16-,17+,18+/m1/s1	YHZGHLFVBXATHQ-BGTYHANMSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@@H]([C@H]1C(=O)O)N2C(=O)C5CC5	BroadT	BRD-K94823396	BRD-K94823396-001-01-7	Broad Institute of MIT and Harvard	BRD-K94823396			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]([C@H]1C(O)=O)N2C(=O)C1CC1	InChI=1S/C21H21N3O5/c25-10-14-16-9-23-15(4-3-13(20(23)27)11-5-7-22-8-6-11)18(17(14)21(28)29)24(16)19(26)12-1-2-12/h3-8,12,14,16-18,25H,1-2,9-10H2,(H,28,29)/t14-,16-,17+,18+/m1/s1	YHZGHLFVBXATHQ-BGTYHANMSA-N	395.148120802							102897
BRD-K34739003	LSM-14798		54660655	InChI=1S/C19H26N2O5/c1-25-19(24)18-14(11-22)13-10-20-15(3-2-4-16(20)23)17(13)21(18)9-12-5-7-26-8-6-12/h2-4,12-14,17-18,22H,5-11H2,1H3/t13-,14-,17+,18-/m1/s1	HJKBIQDSPUJSJY-KJWYOANISA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@H]2N1CC4CCOCC4	BroadT	BRD-K34739003	BRD-K34739003-001-01-3	Broad Institute of MIT and Harvard	BRD-K34739003			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@H]2N1CC1CCOCC1	InChI=1S/C19H26N2O5/c1-25-19(24)18-14(11-22)13-10-20-15(3-2-4-16(20)23)17(13)21(18)9-12-5-7-26-8-6-12/h2-4,12-14,17-18,22H,5-11H2,1H3/t13-,14-,17+,18-/m1/s1	HJKBIQDSPUJSJY-KJWYOANISA-N	362.184171952							103454
BRD-K39581664	LSM-10832		54660742	InChI=1S/C24H25N3O5S/c1-31-15-5-3-4-14(10-15)16-6-7-19-21-17(11-26(19)23(16)29)18(13-28)22(24(30)32-2)27(21)12-20-25-8-9-33-20/h3-10,17-18,21-22,28H,11-13H2,1-2H3/t17-,18-,21+,22-/m1/s1	VROAXWWRWFQWDA-RPHTVSPISA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccc(OC)c4)[C@H]2N1Cc5nccs5	BroadT	BRD-K39581664	BRD-K39581664-001-01-4	Broad Institute of MIT and Harvard	BRD-K39581664			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cccc(OC)c4)c3=O)[C@H]2N1Cc1nccs1	InChI=1S/C24H25N3O5S/c1-31-15-5-3-4-14(10-15)16-6-7-19-21-17(11-26(19)23(16)29)18(13-28)22(24(30)32-2)27(21)12-20-25-8-9-33-20/h3-10,17-18,21-22,28H,11-13H2,1-2H3/t17-,18-,21+,22-/m1/s1	VROAXWWRWFQWDA-RPHTVSPISA-N	467.15149162							99453
BRD-K11002182	LSM-9098		54660884	InChI=1S/C25H31N3O5/c1-5-11-27-20-13-28-19(22(27)21(18(20)14-29)25(32)33-4)10-9-17(24(28)31)15-7-6-8-16(12-15)23(30)26(2)3/h6-10,12,18,20-22,29H,5,11,13-14H2,1-4H3/t18-,20-,21+,22+/m1/s1	JSPRJWABJIXCIR-YJMBLLCNSA-N	CCCN1[C@@H]2CN3C(=CC=C(C3=O)c4cccc(c4)C(=O)N(C)C)[C@H]1[C@H]([C@@H]2CO)C(=O)OC	BroadT	BRD-K11002182	BRD-K11002182-001-01-6	Broad Institute of MIT and Harvard	BRD-K11002182			CCCN1[C@@H]2Cn3c(ccc(-c4cccc(c4)C(=O)N(C)C)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)OC	InChI=1S/C25H31N3O5/c1-5-11-27-20-13-28-19(22(27)21(18(20)14-29)25(32)33-4)10-9-17(24(28)31)15-7-6-8-16(12-15)23(30)26(2)3/h6-10,12,18,20-22,29H,5,11,13-14H2,1-4H3/t18-,20-,21+,22+/m1/s1	JSPRJWABJIXCIR-YJMBLLCNSA-N	453.226371122							97719
BRD-K50388099	LSM-43478		54660883	InChI=1S/C30H31N3O3/c1-32-26-17-33-25(14-13-20(30(33)36)12-11-19-7-3-2-4-8-19)28(32)27(24(26)18-34)29(35)31-23-15-21-9-5-6-10-22(21)16-23/h2-14,23-24,26-28,34H,15-18H2,1H3,(H,31,35)/b12-11+/t24-,26-,27+,28+/m0/s1	LNRZCHBKBRYYMV-YDQUQSOGSA-N	CN1[C@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NC5Cc6ccccc6C5	BroadT	BRD-K50388099	BRD-K50388099-001-01-3	Broad Institute of MIT and Harvard	BRD-K50388099			CN1[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NC1Cc2ccccc2C1	InChI=1S/C30H31N3O3/c1-32-26-17-33-25(14-13-20(30(33)36)12-11-19-7-3-2-4-8-19)28(32)27(24(26)18-34)29(35)31-23-15-21-9-5-6-10-22(21)16-23/h2-14,23-24,26-28,34H,15-18H2,1H3,(H,31,35)/b12-11+/t24-,26-,27+,28+/m0/s1	LNRZCHBKBRYYMV-YDQUQSOGSA-N	481.236541882							
BRD-K84381175	LSM-13586		54660794	InChI=1S/C24H20FN3O5/c25-14-5-3-4-13(10-14)15-7-8-19-20-16(11-27(19)22(15)30)17(12-29)21(24(32)33)28(20)23(31)18-6-1-2-9-26-18/h1-10,16-17,20-21,29H,11-12H2,(H,32,33)/t16-,17-,20+,21-/m1/s1	PPTZIPDIUOVGPF-SGLNWRHMSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@H]2N([C@H]1C(=O)O)C(=O)c5ccccn5	BroadT	BRD-K84381175	BRD-K84381175-001-01-5	Broad Institute of MIT and Harvard	BRD-K84381175			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]2N([C@H]1C(O)=O)C(=O)c1ccccn1	InChI=1S/C24H20FN3O5/c25-14-5-3-4-13(10-14)15-7-8-19-20-16(11-27(19)22(15)30)17(12-29)21(24(32)33)28(20)23(31)18-6-1-2-9-26-18/h1-10,16-17,20-21,29H,11-12H2,(H,32,33)/t16-,17-,20+,21-/m1/s1	PPTZIPDIUOVGPF-SGLNWRHMSA-N	449.13869897							102230
BRD-K42516959	LSM-11005		54660848	InChI=1S/C26H28FN3O4/c1-28(2)26(34)23-19(14-31)18-13-29-21(12-11-16(24(29)32)15-7-3-4-8-15)22(18)30(23)25(33)17-9-5-6-10-20(17)27/h5-7,9-12,18-19,22-23,31H,3-4,8,13-14H2,1-2H3/t18-,19-,22+,23-/m1/s1	QRPMBXIBVHHSCR-PJIZGREPSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@H]2N1C(=O)c5ccccc5F	BroadT	BRD-K42516959	BRD-K42516959-001-01-9	Broad Institute of MIT and Harvard	BRD-K42516959			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]2N1C(=O)c1ccccc1F	InChI=1S/C26H28FN3O4/c1-28(2)26(34)23-19(14-31)18-13-29-21(12-11-16(24(29)32)15-7-3-4-8-15)22(18)30(23)25(33)17-9-5-6-10-20(17)27/h5-7,9-12,18-19,22-23,31H,3-4,8,13-14H2,1-2H3/t18-,19-,22+,23-/m1/s1	QRPMBXIBVHHSCR-PJIZGREPSA-N	465.206384606							99626
BRD-K15990364	LSM-9388		54660880	InChI=1S/C27H36N4O4/c1-29-24-21(22(17-32)25(29)26(33)28-11-14-30-12-4-3-5-13-30)16-31-23(24)10-9-20(27(31)34)18-7-6-8-19(15-18)35-2/h6-10,15,21-22,24-25,32H,3-5,11-14,16-17H2,1-2H3,(H,28,33)/t21-,22-,24+,25-/m0/s1	AVDNHTGKAVTISS-HFOXQMJASA-N	COc1cccc(c1)C2=CC=C3[C@H]4[C@@H](CN3C2=O)[C@H](CO)[C@H](N4C)C(=O)NCCN5CCCCC5	BroadT	BRD-K15990364	BRD-K15990364-001-01-8	Broad Institute of MIT and Harvard	BRD-K15990364			COc1cccc(c1)-c1ccc2[C@H]3[C@@H](Cn2c1=O)[C@H](CO)[C@H](N3C)C(=O)NCCN1CCCCC1	InChI=1S/C27H36N4O4/c1-29-24-21(22(17-32)25(29)26(33)28-11-14-30-12-4-3-5-13-30)16-31-23(24)10-9-20(27(31)34)18-7-6-8-19(15-18)35-2/h6-10,15,21-22,24-25,32H,3-5,11-14,16-17H2,1-2H3,(H,28,33)/t21-,22-,24+,25-/m0/s1	AVDNHTGKAVTISS-HFOXQMJASA-N	480.273655672							98009
BRD-K35809598	LSM-10579		54660788	InChI=1S/C17H19N3O4S/c1-24-17(23)15-10(9-21)12-7-19-11(3-2-4-14(19)22)16(15)20(12)8-13-18-5-6-25-13/h2-6,10,12,15-16,21H,7-9H2,1H3/t10-,12-,15+,16+/m0/s1	AQWQARACBBXMKO-GDJRKYJOSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]1N2Cc4nccs4	BroadT	BRD-K35809598	BRD-K35809598-001-01-4	Broad Institute of MIT and Harvard	BRD-K35809598			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2Cc1nccs1	InChI=1S/C17H19N3O4S/c1-24-17(23)15-10(9-21)12-7-19-11(3-2-4-14(19)22)16(15)20(12)8-13-18-5-6-25-13/h2-6,10,12,15-16,21H,7-9H2,1H3/t10-,12-,15+,16+/m0/s1	AQWQARACBBXMKO-GDJRKYJOSA-N	361.109626808							99200
BRD-K92313046	LSM-14094		54660995	InChI=1S/C25H29F3N4O3/c26-25(27,28)8-13-31-20-14-32-19(5-4-17(23(32)34)16-6-9-29-10-7-16)22(31)21(18(20)15-33)24(35)30-11-2-1-3-12-30/h4-7,9-10,18,20-22,33H,1-3,8,11-15H2/t18-,20-,21+,22+/m1/s1	DKHQAGHBVQSALK-YJMBLLCNSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@@H]([C@H]1C(=O)N5CCCCC5)N2CCC(F)(F)F	BroadT	BRD-K92313046	BRD-K92313046-001-01-5	Broad Institute of MIT and Harvard	BRD-K92313046			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]([C@H]1C(=O)N1CCCCC1)N2CCC(F)(F)F	InChI=1S/C25H29F3N4O3/c26-25(27,28)8-13-31-20-14-32-19(5-4-17(23(32)34)16-6-9-29-10-7-16)22(31)21(18(20)15-33)24(35)30-11-2-1-3-12-30/h4-7,9-10,18,20-22,33H,1-3,8,11-15H2/t18-,20-,21+,22+/m1/s1	DKHQAGHBVQSALK-YJMBLLCNSA-N	490.219175428							102748
BRD-K97103850	LSM-14395		54660689	InChI=1S/C21H21F4N3O3/c22-13-4-1-3-12(7-13)8-28-18-14(9-27-16(18)5-2-6-17(27)30)15(10-29)19(28)20(31)26-11-21(23,24)25/h1-7,14-15,18-19,29H,8-11H2,(H,26,31)/t14-,15-,18+,19-/m0/s1	LKWCVEYJHHUNKM-SAKMYQHLSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N(Cc4cccc(F)c4)[C@@H]1C(=O)NCC(F)(F)F	BroadT	BRD-K97103850	BRD-K97103850-001-01-0	Broad Institute of MIT and Harvard	BRD-K97103850			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N(Cc2cccc(F)c2)[C@@H]1C(=O)NCC(F)(F)F	InChI=1S/C21H21F4N3O3/c22-13-4-1-3-12(7-13)8-28-18-14(9-27-16(18)5-2-6-17(27)30)15(10-29)19(28)20(31)26-11-21(23,24)25/h1-7,14-15,18-19,29H,8-11H2,(H,26,31)/t14-,15-,18+,19-/m0/s1	LKWCVEYJHHUNKM-SAKMYQHLSA-N	439.151904362							103049
BRD-K88903268	LSM-13894		54660834	InChI=1S/C27H28FN5O3/c28-18-5-3-17(4-6-18)20-7-8-23-24-21(13-32(23)27(20)36)22(14-34)25(33(24)12-16-1-2-16)26(35)30-11-19-9-10-29-15-31-19/h3-10,15-16,21-22,24-25,34H,1-2,11-14H2,(H,30,35)/t21-,22-,24+,25-/m0/s1	URDKMROJZUNSLX-HFOXQMJASA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]2N(CC5CC5)[C@@H]1C(=O)NCc6ccncn6	BroadT	BRD-K88903268	BRD-K88903268-001-01-0	Broad Institute of MIT and Harvard	BRD-K88903268			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]2N(CC2CC2)[C@@H]1C(=O)NCc1ccncn1	InChI=1S/C27H28FN5O3/c28-18-5-3-17(4-6-18)20-7-8-23-24-21(13-32(23)27(20)36)22(14-34)25(33(24)12-16-1-2-16)26(35)30-11-19-9-10-29-15-31-19/h3-10,15-16,21-22,24-25,34H,1-2,11-14H2,(H,30,35)/t21-,22-,24+,25-/m0/s1	URDKMROJZUNSLX-HFOXQMJASA-N	489.217618006							102547
BRD-K15460493	LSM-9355		54660899	InChI=1S/C25H29FN2O4/c26-17-8-6-16(7-9-17)18-10-11-20-23-22(25(31)32)19(14-29)21(13-28(20)24(18)30)27(23)12-15-4-2-1-3-5-15/h6-11,15,19,21-23,29H,1-5,12-14H2,(H,31,32)/t19-,21-,22+,23+/m0/s1	CWPRWIPOMXTHMO-KZKAQZJJSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]([C@@H]1C(=O)O)N2CC5CCCCC5	BroadT	BRD-K15460493	BRD-K15460493-001-01-6	Broad Institute of MIT and Harvard	BRD-K15460493			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]([C@@H]1C(O)=O)N2CC1CCCCC1	InChI=1S/C25H29FN2O4/c26-17-8-6-16(7-9-17)18-10-11-20-23-22(25(31)32)19(14-29)21(13-28(20)24(18)30)27(23)12-15-4-2-1-3-5-15/h6-11,15,19,21-23,29H,1-5,12-14H2,(H,31,32)/t19-,21-,22+,23+/m0/s1	CWPRWIPOMXTHMO-KZKAQZJJSA-N	440.211135628							97976
BRD-K04262969	LSM-8690		54660857	InChI=1S/C25H29N3O3/c29-15-19-21-14-27-20(6-3-7-22(27)30)24(28(21)12-16-8-9-16)23(19)25(31)26-11-10-17-4-1-2-5-18(17)13-26/h1-7,16,19,21,23-24,29H,8-15H2/t19-,21-,23+,24+/m1/s1	MQRDGSKRUJYVOI-ZXMXYHOLSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)N4CCc5ccccc5C4)N2CC6CC6	BroadT	BRD-K04262969	BRD-K04262969-001-01-4	Broad Institute of MIT and Harvard	BRD-K04262969			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)N1CCc3ccccc3C1)N2CC1CC1	InChI=1S/C25H29N3O3/c29-15-19-21-14-27-20(6-3-7-22(27)30)24(28(21)12-16-8-9-16)23(19)25(31)26-11-10-17-4-1-2-5-18(17)13-26/h1-7,16,19,21,23-24,29H,8-15H2/t19-,21-,23+,24+/m1/s1	MQRDGSKRUJYVOI-ZXMXYHOLSA-N	419.220891818							97311
BRD-K50727748	LSM-11518		54661019	InChI=1S/C27H34N4O5/c1-15(2)29-27(35)31-23-20(21(14-32)24(31)25(33)28-12-16-4-5-16)13-30-22(23)11-10-19(26(30)34)17-6-8-18(36-3)9-7-17/h6-11,15-16,20-21,23-24,32H,4-5,12-14H2,1-3H3,(H,28,33)(H,29,35)/t20-,21-,23+,24-/m1/s1	KGEBAFQSPNEEIE-CJTFWIGWSA-N	COc1ccc(cc1)C2=CC=C3[C@@H]4[C@H](CN3C2=O)[C@@H](CO)[C@@H](N4C(=O)NC(C)C)C(=O)NCC5CC5	BroadT	BRD-K50727748	BRD-K50727748-001-01-7	Broad Institute of MIT and Harvard	BRD-K50727748			COc1ccc(cc1)-c1ccc2[C@@H]3[C@H](Cn2c1=O)[C@@H](CO)[C@@H](N3C(=O)NC(C)C)C(=O)NCC1CC1	InChI=1S/C27H34N4O5/c1-15(2)29-27(35)31-23-20(21(14-32)24(31)25(33)28-12-16-4-5-16)13-30-22(23)11-10-19(26(30)34)17-6-8-18(36-3)9-7-17/h6-11,15-16,20-21,23-24,32H,4-5,12-14H2,1-3H3,(H,28,33)(H,29,35)/t20-,21-,23+,24-/m1/s1	KGEBAFQSPNEEIE-CJTFWIGWSA-N	494.252920228							100139
BRD-K41325905	LSM-10937		54660950	InChI=1S/C26H29N3O4/c30-14-19-21-13-28-20(6-3-7-22(28)31)25(29(21)23(32)10-15-8-9-15)24(19)26(33)27-18-11-16-4-1-2-5-17(16)12-18/h1-7,15,18-19,21,24-25,30H,8-14H2,(H,27,33)/t19-,21-,24+,25+/m1/s1	WBLJESZVKDDCFM-WOLFRULKSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)NC4Cc5ccccc5C4)N2C(=O)CC6CC6	BroadT	BRD-K41325905	BRD-K41325905-001-01-1	Broad Institute of MIT and Harvard	BRD-K41325905			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NC1Cc3ccccc3C1)N2C(=O)CC1CC1	InChI=1S/C26H29N3O4/c30-14-19-21-13-28-20(6-3-7-22(28)31)25(29(21)23(32)10-15-8-9-15)24(19)26(33)27-18-11-16-4-1-2-5-17(16)12-18/h1-7,15,18-19,21,24-25,30H,8-14H2,(H,27,33)/t19-,21-,24+,25+/m1/s1	WBLJESZVKDDCFM-WOLFRULKSA-N	447.215806438							99558
BRD-K18571495	LSM-9548		54596123	InChI=1S/C22H27N3O6S/c1-14-6-3-4-8-18(14)32(29,30)25-17-12-24-16(7-5-9-19(24)27)21(25)20(15(17)13-26)22(28)23-10-11-31-2/h3-9,15,17,20-21,26H,10-13H2,1-2H3,(H,23,28)/t15-,17-,20+,21+/m0/s1	MTAIFDHMXJWVCS-YHEJVBIMSA-N	COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]1N2S(=O)(=O)c4ccccc4C	BroadT	BRD-K18571495	BRD-K18571495-001-01-5	Broad Institute of MIT and Harvard	BRD-K18571495			COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2S(=O)(=O)c1ccccc1C	InChI=1S/C22H27N3O6S/c1-14-6-3-4-8-18(14)32(29,30)25-17-12-24-16(7-5-9-19(24)27)21(25)20(15(17)13-26)22(28)23-10-11-31-2/h3-9,15,17,20-21,26H,10-13H2,1-2H3,(H,23,28)/t15-,17-,20+,21+/m0/s1	MTAIFDHMXJWVCS-YHEJVBIMSA-N	461.162056304							98169
BRD-K39801870	LSM-10852		54660807	InChI=1S/C26H26N4O5/c1-35-15-22(32)30-23-19(20(14-31)24(30)25(33)28-17-7-3-2-4-8-17)13-29-21(23)10-9-18(26(29)34)16-6-5-11-27-12-16/h2-12,19-20,23-24,31H,13-15H2,1H3,(H,28,33)/t19-,20-,23+,24-/m1/s1	ZBGRYIWHFJMRFQ-MYSJAJEPSA-N	COCC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]12)C(=O)Nc5ccccc5	BroadT	BRD-K39801870	BRD-K39801870-001-01-6	Broad Institute of MIT and Harvard	BRD-K39801870			COCC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]12)C(=O)Nc1ccccc1	InChI=1S/C26H26N4O5/c1-35-15-22(32)30-23-19(20(14-31)24(30)25(33)28-17-7-3-2-4-8-17)13-29-21(23)10-9-18(26(29)34)16-6-5-11-27-12-16/h2-12,19-20,23-24,31H,13-15H2,1H3,(H,28,33)/t19-,20-,23+,24-/m1/s1	ZBGRYIWHFJMRFQ-MYSJAJEPSA-N	474.190319972							99473
BRD-K59283736	LSM-12009		54661018	InChI=1S/C27H34N4O5/c1-15(2)29-27(35)31-23-20(21(14-32)24(31)25(33)28-12-16-4-5-16)13-30-22(23)11-10-19(26(30)34)17-6-8-18(36-3)9-7-17/h6-11,15-16,20-21,23-24,32H,4-5,12-14H2,1-3H3,(H,28,33)(H,29,35)/t20-,21-,23+,24-/m0/s1	KGEBAFQSPNEEIE-ZQRMPTRQSA-N	COc1ccc(cc1)C2=CC=C3[C@H]4[C@@H](CN3C2=O)[C@H](CO)[C@H](N4C(=O)NC(C)C)C(=O)NCC5CC5	BroadT	BRD-K59283736	BRD-K59283736-001-01-6	Broad Institute of MIT and Harvard	BRD-K59283736			COc1ccc(cc1)-c1ccc2[C@H]3[C@@H](Cn2c1=O)[C@H](CO)[C@H](N3C(=O)NC(C)C)C(=O)NCC1CC1	InChI=1S/C27H34N4O5/c1-15(2)29-27(35)31-23-20(21(14-32)24(31)25(33)28-12-16-4-5-16)13-30-22(23)11-10-19(26(30)34)17-6-8-18(36-3)9-7-17/h6-11,15-16,20-21,23-24,32H,4-5,12-14H2,1-3H3,(H,28,33)(H,29,35)/t20-,21-,23+,24-/m0/s1	KGEBAFQSPNEEIE-ZQRMPTRQSA-N	494.252920228							100635
BRD-M30664582	LSM-45020		54660930	InChI=1S/C27H33N3O3/c1-2-8-19-13-14-23-24-21(16-29(23)27(19)33)22(17-31)25(30(24)15-18-9-6-7-10-18)26(32)28-20-11-4-3-5-12-20/h2-5,8,11-14,18,21-22,24-25,31H,6-7,9-10,15-17H2,1H3,(H,28,32)/t21-,22-,24+,25-/m0/s1	QEPNFHJXKIVVNT-HFOXQMJASA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3CC4CCCC4)C(=O)Nc5ccccc5	BroadT	BRD-M30664582	BRD-M30664582-001-01-4	Broad Institute of MIT and Harvard	BRD-M30664582		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)Nc4ccccc4)N(CC4CCCC4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)Nc4ccccc4)N(CC4CCCC4)[C@@H]23)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)Nc4ccccc4)N(CC4CCCC4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)Nc4ccccc4)N(CC4CCCC4)[C@@H]23)c1=O	InChI=1S/2C27H33N3O3/c2*1-2-8-19-13-14-23-24-21(16-29(23)27(19)33)22(17-31)25(30(24)15-18-9-6-7-10-18)26(32)28-20-11-4-3-5-12-20/h2*2-5,8,11-14,18,21-22,24-25,31H,6-7,9-10,15-17H2,1H3,(H,28,32)/b8-2+;8-2-/t2*21-,22-,24+,25-/m00/s1	JGMZPIIESMRTQR-CJRGDIJNSA-N	447.252191946							103257
BRD-M00964333	LSM-44996		54660988	InChI=1S/C28H29N5O4/c1-3-7-19-10-11-23-24-20(15-32(23)27(19)36)21(16-34)25(33(24)28(37)22-14-29-12-13-30-22)26(35)31-17(2)18-8-5-4-6-9-18/h3-14,17,20-21,24-25,34H,15-16H2,1-2H3,(H,31,35)/t17-,20-,21-,24+,25-/m0/s1	GAGDVGIWPFJCDU-DDNPLQQISA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3C(=O)c4cnccn4)C(=O)N[C@@H](C)c5ccccc5	BroadT	BRD-M00964333	BRD-M00964333-001-01-6	Broad Institute of MIT and Harvard	BRD-M00964333		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N[C@@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N[C@@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@@H]23)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N[C@@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N[C@@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@@H]23)c1=O	InChI=1S/2C28H29N5O4/c2*1-3-7-19-10-11-23-24-20(15-32(23)27(19)36)21(16-34)25(33(24)28(37)22-14-29-12-13-30-22)26(35)31-17(2)18-8-5-4-6-9-18/h2*3-14,17,20-21,24-25,34H,15-16H2,1-2H3,(H,31,35)/b7-3+;7-3-/t2*17-,20-,21-,24+,25-/m00/s1	UURQJTAZHVTRJQ-JOKLHDHKSA-N	499.221954458							103233
BRD-K47664103	LSM-11332		54660825	InChI=1S/C25H30N4O4/c30-16-18-20-15-28-19(9-6-10-21(28)31)23(29(20)25(33)17-7-2-1-3-8-17)22(18)24(32)26-11-14-27-12-4-5-13-27/h1-3,6-10,18,20,22-23,30H,4-5,11-16H2,(H,26,32)/t18-,20-,22+,23+/m1/s1	PKPWMBUSHHCIMQ-SQMBMXPBSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)NCCN4CCCC4)N2C(=O)c5ccccc5	BroadT	BRD-K47664103	BRD-K47664103-001-01-7	Broad Institute of MIT and Harvard	BRD-K47664103			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NCCN1CCCC1)N2C(=O)c1ccccc1	InChI=1S/C25H30N4O4/c30-16-18-20-15-28-19(9-6-10-21(28)31)23(29(20)25(33)17-7-2-1-3-8-17)22(18)24(32)26-11-14-27-12-4-5-13-27/h1-3,6-10,18,20,22-23,30H,4-5,11-16H2,(H,26,32)/t18-,20-,22+,23+/m1/s1	PKPWMBUSHHCIMQ-SQMBMXPBSA-N	450.22670548							99953
BRD-K32185509	LSM-10379		54660723	InChI=1S/C28H36N4O4/c1-2-13-29-28(36)32-23-17-31-22(9-6-10-24(31)34)26(32)25(21(23)18-33)27(35)30-14-11-20(12-15-30)16-19-7-4-3-5-8-19/h3-10,20-21,23,25-26,33H,2,11-18H2,1H3,(H,29,36)/t21-,23-,25+,26+/m0/s1	VALQRGDBSGWYJJ-AAOIWRJWSA-N	CCCNC(=O)N1[C@H]2CN3C(=O)C=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)N4CCC(Cc5ccccc5)CC4	BroadT	BRD-K32185509	BRD-K32185509-001-01-0	Broad Institute of MIT and Harvard	BRD-K32185509			CCCNC(=O)N1[C@H]2Cn3c(cccc3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N1CCC(Cc2ccccc2)CC1	InChI=1S/C28H36N4O4/c1-2-13-29-28(36)32-23-17-31-22(9-6-10-24(31)34)26(32)25(21(23)18-33)27(35)30-14-11-20(12-15-30)16-19-7-4-3-5-8-19/h3-10,20-21,23,25-26,33H,2,11-18H2,1H3,(H,29,36)/t21-,23-,25+,26+/m0/s1	VALQRGDBSGWYJJ-AAOIWRJWSA-N	492.273655672							99000
BRD-M11500571	LSM-45004		54660940	InChI=1S/C22H29N3O4/c1-3-5-14-8-9-17-19-15(11-24(17)22(14)29)16(12-26)20(21(28)23-4-2)25(19)18(27)10-13-6-7-13/h3,5,8-9,13,15-16,19-20,26H,4,6-7,10-12H2,1-2H3,(H,23,28)/t15-,16-,19+,20-/m1/s1	HKPODECSJAYGRS-YAJHFMINSA-N	CCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@H]2N1C(=O)CC4CC4)C=CC	BroadT	BRD-M11500571	BRD-M11500571-001-01-6	Broad Institute of MIT and Harvard	BRD-M11500571		CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@H]2N1C(=O)CC1CC1)\C=C\C.CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@H]2N1C(=O)CC1CC1)\C=C/C	CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@H]2N1C(=O)CC1CC1)\C=C\C.CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@H]2N1C(=O)CC1CC1)\C=C/C	InChI=1S/2C22H29N3O4/c2*1-3-5-14-8-9-17-19-15(11-24(17)22(14)29)16(12-26)20(21(28)23-4-2)25(19)18(27)10-13-6-7-13/h2*3,5,8-9,13,15-16,19-20,26H,4,6-7,10-12H2,1-2H3,(H,23,28)/b5-3+;5-3-/t2*15-,16-,19+,20-/m11/s1	WJPBQSJCBLTDGD-KOZPCGFNSA-N	399.215806438							103241
BRD-K19938940	LSM-9637		54660656	InChI=1S/C19H26N2O5/c1-25-19(24)18-14(11-22)13-10-20-15(3-2-4-16(20)23)17(13)21(18)9-12-5-7-26-8-6-12/h2-4,12-14,17-18,22H,5-11H2,1H3/t13-,14-,17+,18-/m0/s1	HJKBIQDSPUJSJY-ZZCKCESHSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N1CC4CCOCC4	BroadT	BRD-K19938940	BRD-K19938940-001-01-6	Broad Institute of MIT and Harvard	BRD-K19938940			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@@H]2N1CC1CCOCC1	InChI=1S/C19H26N2O5/c1-25-19(24)18-14(11-22)13-10-20-15(3-2-4-16(20)23)17(13)21(18)9-12-5-7-26-8-6-12/h2-4,12-14,17-18,22H,5-11H2,1H3/t13-,14-,17+,18-/m0/s1	HJKBIQDSPUJSJY-ZZCKCESHSA-N	362.184171952							98258
BRD-K20044426	LSM-9646		54660863	InChI=1S/C25H27N3O5/c29-14-18-20-13-27-19(10-9-17(24(27)31)15-6-2-1-3-7-15)23(22(18)25(32)33)28(20)21(30)12-16-8-4-5-11-26-16/h4-6,8-11,18,20,22-23,29H,1-3,7,12-14H2,(H,32,33)/t18-,20-,22+,23+/m0/s1	OUKGSGKLYXRNMA-NEKRIBJYSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C4=CCCCC4)C3=O)[C@H]([C@@H]1C(=O)O)N2C(=O)Cc5ccccn5	BroadT	BRD-K20044426	BRD-K20044426-001-01-3	Broad Institute of MIT and Harvard	BRD-K20044426			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]([C@@H]1C(O)=O)N2C(=O)Cc1ccccn1	InChI=1S/C25H27N3O5/c29-14-18-20-13-27-19(10-9-17(24(27)31)15-6-2-1-3-7-15)23(22(18)25(32)33)28(20)21(30)12-16-8-4-5-11-26-16/h4-6,8-11,18,20,22-23,29H,1-3,7,12-14H2,(H,32,33)/t18-,20-,22+,23+/m0/s1	OUKGSGKLYXRNMA-NEKRIBJYSA-N	449.195070994							98267
BRD-K10662075	LSM-9070		54660837	InChI=1S/C25H25F2N5O3/c1-30(2)25(35)23-19(12-33)18-11-31-21(6-4-17(24(31)34)15-8-28-13-29-9-15)22(18)32(23)10-14-7-16(26)3-5-20(14)27/h3-9,13,18-19,22-23,33H,10-12H2,1-2H3/t18-,19-,22+,23-/m0/s1	GNOSXJXTVJBPTF-LBVMUVSTSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@@H]2N1Cc5cc(F)ccc5F	BroadT	BRD-K10662075	BRD-K10662075-001-01-8	Broad Institute of MIT and Harvard	BRD-K10662075			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@@H]2N1Cc1cc(F)ccc1F	InChI=1S/C25H25F2N5O3/c1-30(2)25(35)23-19(12-33)18-11-31-21(6-4-17(24(31)34)15-8-28-13-29-9-15)22(18)32(23)10-14-7-16(26)3-5-20(14)27/h3-9,13,18-19,22-23,33H,10-12H2,1-2H3/t18-,19-,22+,23-/m0/s1	GNOSXJXTVJBPTF-LBVMUVSTSA-N	481.19254611							97691
BRD-M66254575	LSM-45056		54660799	InChI=1S/C24H28N2O4/c1-3-7-17-10-11-20-21-18(14-26(20)23(17)28)19(15-27)22(24(29)30-2)25(21)13-12-16-8-5-4-6-9-16/h3-11,18-19,21-22,27H,12-15H2,1-2H3/t18-,19-,21+,22-/m1/s1	BOAJGZQCXTZFHN-KRXUUXHPSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@H]2N1CCc4ccccc4)C=CC	BroadT	BRD-M66254575	BRD-M66254575-001-01-0	Broad Institute of MIT and Harvard	BRD-M66254575		COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]2N1CCc1ccccc1.COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@H]2N1CCc1ccccc1)\C=C/C	COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]2N1CCc1ccccc1.COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@H]2N1CCc1ccccc1)\C=C/C	InChI=1S/2C24H28N2O4/c2*1-3-7-17-10-11-20-21-18(14-26(20)23(17)28)19(15-27)22(24(29)30-2)25(21)13-12-16-8-5-4-6-9-16/h2*3-11,18-19,21-22,27H,12-15H2,1-2H3/b7-3+;7-3-/t2*18-,19-,21+,22-/m11/s1	HWXVAOXZBVDFCJ-PNJOTBKASA-N	408.204907396							103293
BRD-K11144279	LSM-43448		54660762	InChI=1S/C28H28N4O4/c1-30(2)28(36)25-22(17-33)21-16-31-23(24(21)32(25)27(35)20-9-6-14-29-15-20)13-12-19(26(31)34)11-10-18-7-4-3-5-8-18/h3-15,21-22,24-25,33H,16-17H2,1-2H3/b11-10+/t21-,22-,24+,25-/m0/s1	JLXJOKBWOBKOCH-BCDWKAIYSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@@H]2N1C(=O)c5cccnc5	BroadT	BRD-K11144279	BRD-K11144279-001-01-0	Broad Institute of MIT and Harvard	BRD-K11144279			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]2N1C(=O)c1cccnc1	InChI=1S/C28H28N4O4/c1-30(2)28(36)25-22(17-33)21-16-31-23(24(21)32(25)27(35)20-9-6-14-29-15-20)13-12-19(26(31)34)11-10-18-7-4-3-5-8-18/h3-15,21-22,24-25,33H,16-17H2,1-2H3/b11-10+/t21-,22-,24+,25-/m0/s1	JLXJOKBWOBKOCH-BCDWKAIYSA-N	484.211055416							
BRD-K08799867	LSM-8961		54660819	InChI=1S/C24H30N6O4/c1-28(2)23(33)20-17(12-31)19-11-29-18(8-7-16(22(29)32)14-9-25-13-26-10-14)21(20)30(19)24(34)27-15-5-3-4-6-15/h7-10,13,15,17,19-21,31H,3-6,11-12H2,1-2H3,(H,27,34)/t17-,19-,20+,21+/m0/s1	IOQXCYVHGHXSII-MJUUVYJYSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@H]1N2C(=O)NC5CCCC5	BroadT	BRD-K08799867	BRD-K08799867-001-01-4	Broad Institute of MIT and Harvard	BRD-K08799867			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@H]1N2C(=O)NC1CCCC1	InChI=1S/C24H30N6O4/c1-28(2)23(33)20-17(12-31)19-11-29-18(8-7-16(22(29)32)14-9-25-13-26-10-14)21(20)30(19)24(34)27-15-5-3-4-6-15/h7-10,13,15,17,19-21,31H,3-6,11-12H2,1-2H3,(H,27,34)/t17-,19-,20+,21+/m0/s1	IOQXCYVHGHXSII-MJUUVYJYSA-N	466.2328535							97582
BRD-K86124549	LSM-13703		54660840	InChI=1S/C27H33N3O5/c1-34-23-5-3-2-4-18(23)19-8-9-21-25-24(27(33)28-10-12-35-13-11-28)20(16-31)22(15-30(21)26(19)32)29(25)14-17-6-7-17/h2-5,8-9,17,20,22,24-25,31H,6-7,10-16H2,1H3/t20-,22-,24+,25+/m0/s1	ZZGFZYXZJHIJMZ-MMTHZHQFSA-N	COc1ccccc1C2=CC=C3[C@@H]4[C@@H]([C@@H](CO)[C@H](CN3C2=O)N4CC5CC5)C(=O)N6CCOCC6	BroadT	BRD-K86124549	BRD-K86124549-001-01-6	Broad Institute of MIT and Harvard	BRD-K86124549			COc1ccccc1-c1ccc2[C@@H]3[C@@H]([C@@H](CO)[C@H](Cn2c1=O)N3CC1CC1)C(=O)N1CCOCC1	InChI=1S/C27H33N3O5/c1-34-23-5-3-2-4-18(23)19-8-9-21-25-24(27(33)28-10-12-35-13-11-28)20(16-31)22(15-30(21)26(19)32)29(25)14-17-6-7-17/h2-5,8-9,17,20,22,24-25,31H,6-7,10-16H2,1H3/t20-,22-,24+,25+/m0/s1	ZZGFZYXZJHIJMZ-MMTHZHQFSA-N	479.242021186							102351
BRD-K39550135	LSM-10831		54660692	InChI=1S/C23H26N4O5/c28-11-17-16-10-26-18(7-6-15(22(26)30)14-8-24-12-25-9-14)19(16)27(20(17)23(31)32)21(29)13-4-2-1-3-5-13/h6-9,12-13,16-17,19-20,28H,1-5,10-11H2,(H,31,32)/t16-,17-,19+,20-/m1/s1	QRMANUUKSUBTTM-IZBJGVDFSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@H]2N([C@H]1C(=O)O)C(=O)C5CCCCC5	BroadT	BRD-K39550135	BRD-K39550135-001-01-0	Broad Institute of MIT and Harvard	BRD-K39550135			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@H]2N([C@H]1C(O)=O)C(=O)C1CCCCC1	InChI=1S/C23H26N4O5/c28-11-17-16-10-26-18(7-6-15(22(26)30)14-8-24-12-25-9-14)19(16)27(20(17)23(31)32)21(29)13-4-2-1-3-5-13/h6-9,12-13,16-17,19-20,28H,1-5,10-11H2,(H,31,32)/t16-,17-,19+,20-/m1/s1	QRMANUUKSUBTTM-IZBJGVDFSA-N	438.190319972							99452
BRD-K28027757	LSM-10127		54660681	InChI=1S/C26H27N5O5/c1-15(33)31-22-12-30-21(7-6-19(26(30)35)17-10-27-14-28-11-17)24(31)23(20(22)13-32)25(34)29-9-16-4-3-5-18(8-16)36-2/h3-8,10-11,14,20,22-24,32H,9,12-13H2,1-2H3,(H,29,34)/t20-,22-,23+,24+/m1/s1	ICWHUNLLRZPXIM-AZOUXBGGSA-N	COc1cccc(CNC(=O)[C@H]2[C@H](CO)[C@H]3CN4C(=CC=C(C4=O)c5cncnc5)[C@@H]2N3C(=O)C)c1	BroadT	BRD-K28027757	BRD-K28027757-001-01-9	Broad Institute of MIT and Harvard	BRD-K28027757			COc1cccc(CNC(=O)[C@H]2[C@H](CO)[C@H]3Cn4c(ccc(-c5cncnc5)c4=O)[C@@H]2N3C(C)=O)c1	InChI=1S/C26H27N5O5/c1-15(33)31-22-12-30-21(7-6-19(26(30)35)17-10-27-14-28-11-17)24(31)23(20(22)13-32)25(34)29-9-16-4-3-5-18(8-16)36-2/h3-8,10-11,14,20,22-24,32H,9,12-13H2,1-2H3,(H,29,34)/t20-,22-,23+,24+/m1/s1	ICWHUNLLRZPXIM-AZOUXBGGSA-N	489.201219014							98748
BRD-K84471959	LSM-13593		54660733	InChI=1S/C26H32N6O3/c1-3-11-31-22-14-32-21(7-6-19(26(32)35)17-5-4-9-27-12-17)24(31)23(20(22)15-33)25(34)28-10-8-18-13-30(2)16-29-18/h4-7,9,12-13,16,20,22-24,33H,3,8,10-11,14-15H2,1-2H3,(H,28,34)/t20-,22-,23+,24+/m1/s1	HJZHDZIYUXDLGN-AZOUXBGGSA-N	CCCN1[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCc5cn(C)cn5	BroadT	BRD-K84471959	BRD-K84471959-001-01-6	Broad Institute of MIT and Harvard	BRD-K84471959			CCCN1[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCc1cn(C)cn1	InChI=1S/C26H32N6O3/c1-3-11-31-22-14-32-21(7-6-19(26(32)35)17-5-4-9-27-12-17)24(31)23(20(22)15-33)25(34)28-10-8-18-13-30(2)16-29-18/h4-7,9,12-13,16,20,22-24,33H,3,8,10-11,14-15H2,1-2H3,(H,28,34)/t20-,22-,23+,24+/m1/s1	HJZHDZIYUXDLGN-AZOUXBGGSA-N	476.253588944							102237
BRD-K81636483	LSM-13410		54660974	InChI=1S/C21H25N3O5S/c1-13(14-7-4-3-5-8-14)22-21(27)20-16(12-25)15-11-23-17(9-6-10-18(23)26)19(15)24(20)30(2,28)29/h3-10,13,15-16,19-20,25H,11-12H2,1-2H3,(H,22,27)/t13-,15-,16-,19+,20-/m1/s1	LURAPRBVZDLHCY-RFXCRVDXSA-N	C[C@@H](NC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@H]2N1S(=O)(=O)C)c4ccccc4	BroadT	BRD-K81636483	BRD-K81636483-001-01-2	Broad Institute of MIT and Harvard	BRD-K81636483			C[C@@H](NC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@H]2N1S(C)(=O)=O)c1ccccc1	InChI=1S/C21H25N3O5S/c1-13(14-7-4-3-5-8-14)22-21(27)20-16(12-25)15-11-23-17(9-6-10-18(23)26)19(15)24(20)30(2,28)29/h3-10,13,15-16,19-20,25H,11-12H2,1-2H3,(H,22,27)/t13-,15-,16-,19+,20-/m1/s1	LURAPRBVZDLHCY-RFXCRVDXSA-N	431.15149162							102050
BRD-K47681666	LSM-11333		54660718	InChI=1S/C25H29N3O3/c1-15(16-7-3-2-4-8-16)26-24(30)23-20(14-29)19-13-28-21(22(19)27-23)12-11-18(25(28)31)17-9-5-6-10-17/h2-4,7-9,11-12,15,19-20,22-23,27,29H,5-6,10,13-14H2,1H3,(H,26,30)/t15-,19+,20+,22-,23+/m0/s1	DEERBQNZFWMEPS-OLHFQXMRSA-N	C[C@H](NC(=O)[C@@H]1N[C@H]2[C@H](CN3C(=O)C(=CC=C23)C4=CCCC4)[C@H]1CO)c5ccccc5	BroadT	BRD-K47681666	BRD-K47681666-001-01-0	Broad Institute of MIT and Harvard	BRD-K47681666			C[C@H](NC(=O)[C@@H]1N[C@H]2[C@H](Cn3c2ccc(C2=CCCC2)c3=O)[C@H]1CO)c1ccccc1	InChI=1S/C25H29N3O3/c1-15(16-7-3-2-4-8-16)26-24(30)23-20(14-29)19-13-28-21(22(19)27-23)12-11-18(25(28)31)17-9-5-6-10-17/h2-4,7-9,11-12,15,19-20,22-23,27,29H,5-6,10,13-14H2,1H3,(H,26,30)/t15-,19+,20+,22-,23+/m0/s1	DEERBQNZFWMEPS-OLHFQXMRSA-N	419.220891818							99954
BRD-K80666761	LSM-13361		54660826	InChI=1S/C25H30N4O4/c30-16-18-20-15-28-19(9-6-10-21(28)31)23(29(20)25(33)17-7-2-1-3-8-17)22(18)24(32)26-11-14-27-12-4-5-13-27/h1-3,6-10,18,20,22-23,30H,4-5,11-16H2,(H,26,32)/t18-,20-,22+,23+/m0/s1	PKPWMBUSHHCIMQ-NEKRIBJYSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)NCCN4CCCC4)N2C(=O)c5ccccc5	BroadT	BRD-K80666761	BRD-K80666761-001-01-3	Broad Institute of MIT and Harvard	BRD-K80666761			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NCCN1CCCC1)N2C(=O)c1ccccc1	InChI=1S/C25H30N4O4/c30-16-18-20-15-28-19(9-6-10-21(28)31)23(29(20)25(33)17-7-2-1-3-8-17)22(18)24(32)26-11-14-27-12-4-5-13-27/h1-3,6-10,18,20,22-23,30H,4-5,11-16H2,(H,26,32)/t18-,20-,22+,23+/m0/s1	PKPWMBUSHHCIMQ-NEKRIBJYSA-N	450.22670548							102000
BRD-K56917655	LSM-11871		54660997	InChI=1S/C29H31N5O3/c35-18-23-25-17-34-24(11-10-22(29(34)37)20-7-1-2-8-20)27(33(25)16-19-6-5-12-30-14-19)26(23)28(36)32-15-21-9-3-4-13-31-21/h3-7,9-14,23,25-27,35H,1-2,8,15-18H2,(H,32,36)/t23-,25-,26+,27+/m1/s1	DPJGOJUVSBIVRD-ZDEZRRDYSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@@H]([C@H]1C(=O)NCc4ccccn4)N2Cc5cccnc5)C6=CCCC6	BroadT	BRD-K56917655	BRD-K56917655-001-01-9	Broad Institute of MIT and Harvard	BRD-K56917655			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]([C@H]1C(=O)NCc1ccccn1)N2Cc1cccnc1	InChI=1S/C29H31N5O3/c35-18-23-25-17-34-24(11-10-22(29(34)37)20-7-1-2-8-20)27(33(25)16-19-6-5-12-30-14-19)26(23)28(36)32-15-21-9-3-4-13-31-21/h3-7,9-14,23,25-27,35H,1-2,8,15-18H2,(H,32,36)/t23-,25-,26+,27+/m1/s1	DPJGOJUVSBIVRD-ZDEZRRDYSA-N	497.242689902							100497
CHEMBL3182338	LSM-43477	BRD-K48374441	54660649	InChI=1S/C27H31N3O6/c1-35-17-23(32)30-22-15-29-21(10-9-19(26(29)33)8-7-18-5-3-2-4-6-18)25(30)24(20(22)16-31)27(34)28-11-13-36-14-12-28/h2-10,20,22,24-25,31H,11-17H2,1H3/b8-7+/t20-,22-,24+,25+/m1/s1	XMUOPSKEXGVNOG-JHYZPPOBSA-N	COCC(=O)N1[C@@H]2CN3C(=O)C(=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)N4CCOCC4)\C=C\c5ccccc5	BroadT	BRD-K48374441	BRD-K48374441-001-01-3	Broad Institute of MIT and Harvard	BRD-K48374441			COCC(=O)N1[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N1CCOCC1	InChI=1S/C27H31N3O6/c1-35-17-23(32)30-22-15-29-21(10-9-19(26(29)33)8-7-18-5-3-2-4-6-18)25(30)24(20(22)16-31)27(34)28-11-13-36-14-12-28/h2-10,20,22,24-25,31H,11-17H2,1H3/b8-7+/t20-,22-,24+,25+/m1/s1	XMUOPSKEXGVNOG-JHYZPPOBSA-N	493.221285742							
BRD-K90381642	LSM-13997		54660908	InChI=1S/C19H19FN2O6S/c1-29(27,28)22-16-13(14(9-23)17(22)19(25)26)8-21-15(16)7-6-12(18(21)24)10-2-4-11(20)5-3-10/h2-7,13-14,16-17,23H,8-9H2,1H3,(H,25,26)/t13-,14-,16+,17-/m0/s1	PCISDUIZPJCQMU-DIECFANBSA-N	CS(=O)(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]12)C(=O)O	BroadT	BRD-K90381642	BRD-K90381642-001-01-2	Broad Institute of MIT and Harvard	BRD-K90381642			CS(=O)(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]12)C(O)=O	InChI=1S/C19H19FN2O6S/c1-29(27,28)22-16-13(14(9-23)17(22)19(25)26)8-21-15(16)7-6-12(18(21)24)10-2-4-11(20)5-3-10/h2-7,13-14,16-17,23H,8-9H2,1H3,(H,25,26)/t13-,14-,16+,17-/m0/s1	PCISDUIZPJCQMU-DIECFANBSA-N	422.094785238							102650
BRD-K15023392	LSM-9330		54660889	InChI=1S/C25H27N3O5/c1-33-25(32)23-19(14-29)18-13-27-20(9-8-17(24(27)31)16-6-2-3-7-16)22(18)28(23)21(30)11-15-5-4-10-26-12-15/h4-6,8-10,12,18-19,22-23,29H,2-3,7,11,13-14H2,1H3/t18-,19-,22+,23-/m1/s1	MVZYZZDTAGMQFB-PJIZGREPSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@H]2N1C(=O)Cc5cccnc5	BroadT	BRD-K15023392	BRD-K15023392-001-01-4	Broad Institute of MIT and Harvard	BRD-K15023392			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]2N1C(=O)Cc1cccnc1	InChI=1S/C25H27N3O5/c1-33-25(32)23-19(14-29)18-13-27-20(9-8-17(24(27)31)16-6-2-3-7-16)22(18)28(23)21(30)11-15-5-4-10-26-12-15/h4-6,8-10,12,18-19,22-23,29H,2-3,7,11,13-14H2,1H3/t18-,19-,22+,23-/m1/s1	MVZYZZDTAGMQFB-PJIZGREPSA-N	449.195070994							97951
BRD-K42634310	LSM-11016		54660698	InChI=1S/C23H26F3N3O3/c1-14(15-6-3-2-4-7-15)27-22(32)20-16(13-30)18-12-29-17(8-5-9-19(29)31)21(20)28(18)11-10-23(24,25)26/h2-9,14,16,18,20-21,30H,10-13H2,1H3,(H,27,32)/t14-,16+,18+,20-,21-/m1/s1	LOVSINJIWNBKBE-VSBLDFDESA-N	C[C@@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]1N2CCC(F)(F)F)c4ccccc4	BroadT	BRD-K42634310	BRD-K42634310-001-01-4	Broad Institute of MIT and Harvard	BRD-K42634310			C[C@@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2CCC(F)(F)F)c1ccccc1	InChI=1S/C23H26F3N3O3/c1-14(15-6-3-2-4-7-15)27-22(32)20-16(13-30)18-12-29-17(8-5-9-19(29)31)21(20)28(18)11-10-23(24,25)26/h2-9,14,16,18,20-21,30H,10-13H2,1H3,(H,27,32)/t14-,16+,18+,20-,21-/m1/s1	LOVSINJIWNBKBE-VSBLDFDESA-N	449.192626322							99637
BRD-M22248829	LSM-45012		54660711	InChI=1S/C22H28N4O4/c1-3-5-14-6-7-18-19-16(10-25(18)22(14)29)17(11-27)20(21(28)23-8-4-2)26(19)9-15-12-30-13-24-15/h3,5-7,12-13,16-17,19-20,27H,4,8-11H2,1-2H3,(H,23,28)/t16-,17-,19+,20-/m1/s1	UIYBGHYPRRSBHH-IZBJGVDFSA-N	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@H]2N1Cc4cocn4)C=CC	BroadT	BRD-M22248829	BRD-M22248829-001-01-9	Broad Institute of MIT and Harvard	BRD-M22248829		CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]2N1Cc1cocn1.CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]2N1Cc1cocn1	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]2N1Cc1cocn1.CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]2N1Cc1cocn1	InChI=1S/2C22H28N4O4/c2*1-3-5-14-6-7-18-19-16(10-25(18)22(14)29)17(11-27)20(21(28)23-8-4-2)26(19)9-15-12-30-13-24-15/h2*3,5-7,12-13,16-17,19-20,27H,4,8-11H2,1-2H3,(H,23,28)/b5-3+;5-3-/t2*16-,17-,19+,20-/m11/s1	GOSQUEMGCNFWKR-GTHUXJDQSA-N	412.211055416							103249
BRD-M97925630	LSM-45092		54660779	InChI=1S/C22H30N2O5/c1-3-4-15-5-6-17-20-19(22(27)28-2)16(13-25)18(12-24(17)21(15)26)23(20)11-14-7-9-29-10-8-14/h3-6,14,16,18-20,25H,7-13H2,1-2H3/t16-,18-,19+,20+/m0/s1	YYKXHGZVSNLVER-IJXRJRJASA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]1N2CC4CCOCC4)C=CC	BroadT	BRD-M97925630	BRD-M97925630-001-01-1	Broad Institute of MIT and Harvard	BRD-M97925630		COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1N2CC1CCOCC1.COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@H]1N2CC1CCOCC1)\C=C/C	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1N2CC1CCOCC1.COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@H]1N2CC1CCOCC1)\C=C/C	InChI=1S/2C22H30N2O5/c2*1-3-4-15-5-6-17-20-19(22(27)28-2)16(13-25)18(12-24(17)21(15)26)23(20)11-14-7-9-29-10-8-14/h2*3-6,14,16,18-20,25H,7-13H2,1-2H3/b4-3+;4-3-/t2*16-,18-,19+,20+/m00/s1	CWELBPBUWGSKQY-WQNARRNSSA-N	402.21547208							103329
BRD-K77908171	LSM-13193		54660907	InChI=1S/C19H19FN2O6S/c1-29(27,28)22-16-13(14(9-23)17(22)19(25)26)8-21-15(16)7-6-12(18(21)24)10-2-4-11(20)5-3-10/h2-7,13-14,16-17,23H,8-9H2,1H3,(H,25,26)/t13-,14-,16+,17-/m1/s1	PCISDUIZPJCQMU-TXCZRRACSA-N	CS(=O)(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]12)C(=O)O	BroadT	BRD-K77908171	BRD-K77908171-001-01-8	Broad Institute of MIT and Harvard	BRD-K77908171			CS(=O)(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]12)C(O)=O	InChI=1S/C19H19FN2O6S/c1-29(27,28)22-16-13(14(9-23)17(22)19(25)26)8-21-15(16)7-6-12(18(21)24)10-2-4-11(20)5-3-10/h2-7,13-14,16-17,23H,8-9H2,1H3,(H,25,26)/t13-,14-,16+,17-/m1/s1	PCISDUIZPJCQMU-TXCZRRACSA-N	422.094785238							101831
BRD-M72906282	LSM-45061		54660639	InChI=1S/C23H29N5O5S/c1-3-5-14-8-9-17-21-20(22(30)25-15-6-4-7-15)16(12-29)18(10-27(17)23(14)31)28(21)34(32,33)19-11-26(2)13-24-19/h3,5,8-9,11,13,15-16,18,20-21,29H,4,6-7,10,12H2,1-2H3,(H,25,30)/t16-,18-,20+,21+/m0/s1	FBXKHEMXYYDERF-XIGKFDRGSA-N	CC=CC1=CC=C2[C@@H]3[C@@H]([C@@H](CO)[C@H](CN2C1=O)N3S(=O)(=O)c4cn(C)cn4)C(=O)NC5CCC5	BroadT	BRD-M72906282	BRD-M72906282-001-01-1	Broad Institute of MIT and Harvard	BRD-M72906282		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NC4CCC4)[C@@H]2N3S(=O)(=O)c2ncn(C)c2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NC4CCC4)[C@@H]2N3S(=O)(=O)c2ncn(C)c2)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NC4CCC4)[C@@H]2N3S(=O)(=O)c2ncn(C)c2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NC4CCC4)[C@@H]2N3S(=O)(=O)c2ncn(C)c2)c1=O	InChI=1S/2C23H29N5O5S/c2*1-3-5-14-8-9-17-21-20(22(30)25-15-6-4-7-15)16(12-29)18(10-27(17)23(14)31)28(21)34(32,33)19-11-26(2)13-24-19/h2*3,5,8-9,11,13,15-16,18,20-21,29H,4,6-7,10,12H2,1-2H3,(H,25,30)/b5-3+;5-3-/t2*16-,18-,20+,21+/m00/s1	MAYPJGPMDPCVRU-CZAFTZQFSA-N	487.188939768							103298
BRD-K72798501	LSM-12888		54660893	InChI=1S/C26H27N5O5/c1-29(2)26(35)22-18(14-32)21-13-30-20(23(22)31(21)25(34)19-12-27-10-11-28-19)9-8-17(24(30)33)15-4-6-16(36-3)7-5-15/h4-12,18,21-23,32H,13-14H2,1-3H3/t18-,21-,22+,23+/m0/s1	BKGRDMUHEKXYSB-XSEFMFLKSA-N	COc1ccc(cc1)C2=CC=C3[C@@H]4[C@@H]([C@@H](CO)[C@H](CN3C2=O)N4C(=O)c5cnccn5)C(=O)N(C)C	BroadT	BRD-K72798501	BRD-K72798501-001-01-9	Broad Institute of MIT and Harvard	BRD-K72798501			COc1ccc(cc1)-c1ccc2[C@@H]3[C@@H]([C@@H](CO)[C@H](Cn2c1=O)N3C(=O)c1cnccn1)C(=O)N(C)C	InChI=1S/C26H27N5O5/c1-29(2)26(35)22-18(14-32)21-13-30-20(23(22)31(21)25(34)19-12-27-10-11-28-19)9-8-17(24(30)33)15-4-6-16(36-3)7-5-15/h4-12,18,21-23,32H,13-14H2,1-3H3/t18-,21-,22+,23+/m0/s1	BKGRDMUHEKXYSB-XSEFMFLKSA-N	489.201219014							101525
BRD-K28668737	LSM-10169		54660998	InChI=1S/C27H37N5O4/c1-2-11-31-24-21(17-32-23(24)5-4-20(27(32)35)19-6-9-28-10-7-19)22(18-33)25(31)26(34)29-8-3-12-30-13-15-36-16-14-30/h4-7,9-10,21-22,24-25,33H,2-3,8,11-18H2,1H3,(H,29,34)/t21-,22-,24+,25-/m0/s1	DECXYAQNRLUUJQ-HFOXQMJASA-N	CCCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]12)c4ccncc4)C(=O)NCCCN5CCOCC5	BroadT	BRD-K28668737	BRD-K28668737-001-01-5	Broad Institute of MIT and Harvard	BRD-K28668737			CCCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]12)C(=O)NCCCN1CCOCC1	InChI=1S/C27H37N5O4/c1-2-11-31-24-21(17-32-23(24)5-4-20(27(32)35)19-6-9-28-10-7-19)22(18-33)25(31)26(34)29-8-3-12-30-13-15-36-16-14-30/h4-7,9-10,21-22,24-25,33H,2-3,8,11-18H2,1H3,(H,29,34)/t21-,22-,24+,25-/m0/s1	DECXYAQNRLUUJQ-HFOXQMJASA-N	495.284554714							98790
BRD-K04985042	LSM-8731		54661024	InChI=1S/C25H33N3O6/c1-33-15-21(30)28-22-18(19(14-29)23(28)25(32)26-9-11-34-12-10-26)13-27-20(22)8-7-17(24(27)31)16-5-3-2-4-6-16/h5,7-8,18-19,22-23,29H,2-4,6,9-15H2,1H3/t18-,19-,22+,23-/m1/s1	OPCBHRVVWMXJRO-PJIZGREPSA-N	COCC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]12)C4=CCCCC4)C(=O)N5CCOCC5	BroadT	BRD-K04985042	BRD-K04985042-001-01-1	Broad Institute of MIT and Harvard	BRD-K04985042			COCC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]12)C(=O)N1CCOCC1	InChI=1S/C25H33N3O6/c1-33-15-21(30)28-22-18(19(14-29)23(28)25(32)26-9-11-34-12-10-26)13-27-20(22)8-7-17(24(27)31)16-5-3-2-4-6-16/h5,7-8,18-19,22-23,29H,2-4,6,9-15H2,1H3/t18-,19-,22+,23-/m1/s1	OPCBHRVVWMXJRO-PJIZGREPSA-N	471.236935806							97352
BRD-K83529035	LSM-13535		54660953	InChI=1S/C24H26N2O5/c1-31-24(30)22-18(13-27)17-12-25-19(21(17)26(22)20(28)11-14-7-8-14)10-9-16(23(25)29)15-5-3-2-4-6-15/h2-6,9-10,14,17-18,21-22,27H,7-8,11-13H2,1H3/t17-,18-,21+,22-/m0/s1	GLQBIINCSVPTPJ-HXHBTQRASA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N1C(=O)CC4CC4)c5ccccc5	BroadT	BRD-K83529035	BRD-K83529035-001-01-0	Broad Institute of MIT and Harvard	BRD-K83529035			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]2N1C(=O)CC1CC1	InChI=1S/C24H26N2O5/c1-31-24(30)22-18(13-27)17-12-25-19(21(17)26(22)20(28)11-14-7-8-14)10-9-16(23(25)29)15-5-3-2-4-6-15/h2-6,9-10,14,17-18,21-22,27H,7-8,11-13H2,1H3/t17-,18-,21+,22-/m0/s1	GLQBIINCSVPTPJ-HXHBTQRASA-N	422.184171952							102177
BRD-K88709513	LSM-13882		54660920	InChI=1S/C28H29FN4O3/c29-20-5-1-3-18(11-20)12-31-27(35)25-22(16-34)24-15-33-23(26(25)32(24)14-17-6-7-17)9-8-21(28(33)36)19-4-2-10-30-13-19/h1-5,8-11,13,17,22,24-26,34H,6-7,12,14-16H2,(H,31,35)/t22-,24-,25+,26+/m1/s1	BFDAKIJRIQBPOO-BPHNFWMXSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]([C@H]1C(=O)NCc5cccc(F)c5)N2CC6CC6	BroadT	BRD-K88709513	BRD-K88709513-001-01-4	Broad Institute of MIT and Harvard	BRD-K88709513			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]([C@H]1C(=O)NCc1cccc(F)c1)N2CC1CC1	InChI=1S/C28H29FN4O3/c29-20-5-1-3-18(11-20)12-31-27(35)25-22(16-34)24-15-33-23(26(25)32(24)14-17-6-7-17)9-8-21(28(33)36)19-4-2-10-30-13-19/h1-5,8-11,13,17,22,24-26,34H,6-7,12,14-16H2,(H,31,35)/t22-,24-,25+,26+/m1/s1	BFDAKIJRIQBPOO-BPHNFWMXSA-N	488.222369028							102535
BRD-K46575753	LSM-11272		54660784	InChI=1S/C27H35N3O4/c1-28(2)27(33)25-22(16-31)21-15-29-23(24(21)30(25)14-17-6-4-5-7-17)13-12-20(26(29)32)18-8-10-19(34-3)11-9-18/h8-13,17,21-22,24-25,31H,4-7,14-16H2,1-3H3/t21-,22-,24+,25-/m1/s1	BQGNOLIJCHASHD-YQIMAOPZSA-N	COc1ccc(cc1)C2=CC=C3[C@@H]4[C@H](CN3C2=O)[C@@H](CO)[C@@H](N4CC5CCCC5)C(=O)N(C)C	BroadT	BRD-K46575753	BRD-K46575753-001-01-9	Broad Institute of MIT and Harvard	BRD-K46575753			COc1ccc(cc1)-c1ccc2[C@@H]3[C@H](Cn2c1=O)[C@@H](CO)[C@@H](N3CC1CCCC1)C(=O)N(C)C	InChI=1S/C27H35N3O4/c1-28(2)27(33)25-22(16-31)21-15-29-23(24(21)30(25)14-17-6-4-5-7-17)13-12-20(26(29)32)18-8-10-19(34-3)11-9-18/h8-13,17,21-22,24-25,31H,4-7,14-16H2,1-3H3/t21-,22-,24+,25-/m1/s1	BQGNOLIJCHASHD-YQIMAOPZSA-N	465.26275663							99893
BRD-K16425314	LSM-9422		54660774	InChI=1S/C26H25FN4O4/c27-17-9-7-16(8-10-17)13-29-26(35)24-19(15-32)21-14-30-20(5-3-6-22(30)33)25(24)31(21)23(34)12-18-4-1-2-11-28-18/h1-11,19,21,24-25,32H,12-15H2,(H,29,35)/t19-,21-,24+,25+/m0/s1	URFCUUZYVKRCRT-VFXZHPAVSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)NCc4ccc(F)cc4)N2C(=O)Cc5ccccn5	BroadT	BRD-K16425314	BRD-K16425314-001-01-5	Broad Institute of MIT and Harvard	BRD-K16425314			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NCc1ccc(F)cc1)N2C(=O)Cc1ccccn1	InChI=1S/C26H25FN4O4/c27-17-9-7-16(8-10-17)13-29-26(35)24-19(15-32)21-14-30-20(5-3-6-22(30)33)25(24)31(21)23(34)12-18-4-1-2-11-28-18/h1-11,19,21,24-25,32H,12-15H2,(H,29,35)/t19-,21-,24+,25+/m0/s1	URFCUUZYVKRCRT-VFXZHPAVSA-N	476.18598352							98043
BRD-K85790491	LSM-13684		54660658	InChI=1S/C27H33N3O4/c1-28(2)27(33)24-20(16-31)22-15-30-21(13-12-19(26(30)32)17-8-4-5-9-17)25(24)29(22)14-18-10-6-7-11-23(18)34-3/h6-8,10-13,20,22,24-25,31H,4-5,9,14-16H2,1-3H3/t20-,22-,24+,25+/m0/s1	CAYQEZITEZQLOQ-MMTHZHQFSA-N	COc1ccccc1CN2[C@H]3CN4C(=CC=C(C5=CCCC5)C4=O)[C@@H]2[C@@H]([C@H]3CO)C(=O)N(C)C	BroadT	BRD-K85790491	BRD-K85790491-001-01-3	Broad Institute of MIT and Harvard	BRD-K85790491			COc1ccccc1CN1[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N(C)C	InChI=1S/C27H33N3O4/c1-28(2)27(33)24-20(16-31)22-15-30-21(13-12-19(26(30)32)17-8-4-5-9-17)25(24)29(22)14-18-10-6-7-11-23(18)34-3/h6-8,10-13,20,22,24-25,31H,4-5,9,14-16H2,1-3H3/t20-,22-,24+,25+/m0/s1	CAYQEZITEZQLOQ-MMTHZHQFSA-N	463.247106566							102332
BRD-K75394059	LSM-13040		54660734	InChI=1S/C26H29F2N3O3/c1-30-22-13-31-21(8-7-19(26(31)34)16-5-3-2-4-6-16)24(30)23(20(22)14-32)25(33)29-12-15-9-17(27)11-18(28)10-15/h5,7-11,20,22-24,32H,2-4,6,12-14H2,1H3,(H,29,33)/t20-,22-,23+,24+/m1/s1	MBUIMBFODARIMW-AZOUXBGGSA-N	CN1[C@@H]2CN3C(=O)C(=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)NCc4cc(F)cc(F)c4)C5=CCCCC5	BroadT	BRD-K75394059	BRD-K75394059-001-01-0	Broad Institute of MIT and Harvard	BRD-K75394059			CN1[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc1cc(F)cc(F)c1	InChI=1S/C26H29F2N3O3/c1-30-22-13-31-21(8-7-19(26(31)34)16-5-3-2-4-6-16)24(30)23(20(22)14-32)25(33)29-12-15-9-17(27)11-18(28)10-15/h5,7-11,20,22-24,32H,2-4,6,12-14H2,1H3,(H,29,33)/t20-,22-,23+,24+/m1/s1	MBUIMBFODARIMW-AZOUXBGGSA-N	469.217698218							101677
BRD-K88363359	LSM-13862		54660864	InChI=1S/C24H29N3O6S/c1-33-20-6-4-3-5-15(20)16-9-10-19-21-17(12-26(19)24(16)30)18(13-28)22(27(21)34(2,31)32)23(29)25-11-14-7-8-14/h3-6,9-10,14,17-18,21-22,28H,7-8,11-13H2,1-2H3,(H,25,29)/t17-,18-,21+,22-/m1/s1	WJZKQLYLFQXOJV-RPHTVSPISA-N	COc1ccccc1C2=CC=C3[C@@H]4[C@H](CN3C2=O)[C@@H](CO)[C@@H](N4S(=O)(=O)C)C(=O)NCC5CC5	BroadT	BRD-K88363359	BRD-K88363359-001-01-7	Broad Institute of MIT and Harvard	BRD-K88363359			COc1ccccc1-c1ccc2[C@@H]3[C@H](Cn2c1=O)[C@@H](CO)[C@@H](N3S(C)(=O)=O)C(=O)NCC1CC1	InChI=1S/C24H29N3O6S/c1-33-20-6-4-3-5-15(20)16-9-10-19-21-17(12-26(19)24(16)30)18(13-28)22(27(21)34(2,31)32)23(29)25-11-14-7-8-14/h3-6,9-10,14,17-18,21-22,28H,7-8,11-13H2,1-2H3,(H,25,29)/t17-,18-,21+,22-/m1/s1	WJZKQLYLFQXOJV-RPHTVSPISA-N	487.177706368							102513
BRD-M40384033	LSM-45031		54660809	InChI=1S/C25H24F2N4O3S/c1-2-3-14-4-7-20-21-17(12-30(20)24(14)34)18(13-32)22(23(33)29-25-28-8-9-35-25)31(21)11-15-10-16(26)5-6-19(15)27/h2-10,17-18,21-22,32H,11-13H2,1H3,(H,28,29,33)/t17-,18-,21+,22-/m0/s1	ZDIAMMWGBAVDPO-HXHBTQRASA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3Cc4cc(F)ccc4F)C(=O)Nc5nccs5	BroadT	BRD-M40384033	BRD-M40384033-001-01-2	Broad Institute of MIT and Harvard	BRD-M40384033		C\C=C\c1ccc2[C@H]3[C@@H](Cn2c1=O)[C@H](CO)[C@H](N3Cc1cc(F)ccc1F)C(=O)Nc1nccs1.C\C=C/c1ccc2[C@H]3[C@@H](Cn2c1=O)[C@H](CO)[C@H](N3Cc1cc(F)ccc1F)C(=O)Nc1nccs1	C\C=C\c1ccc2[C@H]3[C@@H](Cn2c1=O)[C@H](CO)[C@H](N3Cc1cc(F)ccc1F)C(=O)Nc1nccs1.C\C=C/c1ccc2[C@H]3[C@@H](Cn2c1=O)[C@H](CO)[C@H](N3Cc1cc(F)ccc1F)C(=O)Nc1nccs1	InChI=1S/2C25H24F2N4O3S/c2*1-2-3-14-4-7-20-21-17(12-30(20)24(14)34)18(13-32)22(23(33)29-25-28-8-9-35-25)31(21)11-15-10-16(26)5-6-19(15)27/h2*2-10,17-18,21-22,32H,11-13H2,1H3,(H,28,29,33)/b3-2+;3-2-/t2*17-,18-,21+,22-/m00/s1	LROWCOSISYCRIQ-VPMYRVTJSA-N	498.153717758							103268
BRD-K00484200	LSM-8461		54660821	InChI=1S/C27H30N4O4/c1-35-23-7-3-2-5-19(23)15-31-25-20(16-30-22(25)6-4-8-24(30)33)21(17-32)26(31)27(34)29-14-11-18-9-12-28-13-10-18/h2-10,12-13,20-21,25-26,32H,11,14-17H2,1H3,(H,29,34)/t20-,21-,25+,26-/m0/s1	SNUVNVMLNYTLKH-MSNAGZIKSA-N	COc1ccccc1CN2[C@@H]([C@@H](CO)[C@@H]3CN4C(=O)C=CC=C4[C@H]23)C(=O)NCCc5ccncc5	BroadT	BRD-K00484200	BRD-K00484200-001-01-7	Broad Institute of MIT and Harvard	BRD-K00484200			COc1ccccc1CN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]12)C(=O)NCCc1ccncc1	InChI=1S/C27H30N4O4/c1-35-23-7-3-2-5-19(23)15-31-25-20(16-30-22(25)6-4-8-24(30)33)21(17-32)26(31)27(34)29-14-11-18-9-12-28-13-10-18/h2-10,12-13,20-21,25-26,32H,11,14-17H2,1H3,(H,29,34)/t20-,21-,25+,26-/m0/s1	SNUVNVMLNYTLKH-MSNAGZIKSA-N	474.22670548							97082
BRD-K79968414	LSM-13309		54660684	InChI=1S/C25H30N4O4/c1-28(2)24(32)15-6-3-5-14(11-15)17-9-10-20-22-21(23(31)26-16-7-4-8-16)18(13-30)19(27-22)12-29(20)25(17)33/h3,5-6,9-11,16,18-19,21-22,27,30H,4,7-8,12-13H2,1-2H3,(H,26,31)/t18-,19-,21+,22+/m0/s1	NFKFSUDWHJDXEV-SEIRJHJZSA-N	CN(C)C(=O)c1cccc(c1)C2=CC=C3[C@H]4N[C@@H](CN3C2=O)[C@H](CO)[C@H]4C(=O)NC5CCC5	BroadT	BRD-K79968414	BRD-K79968414-001-01-7	Broad Institute of MIT and Harvard	BRD-K79968414			CN(C)C(=O)c1cccc(c1)-c1ccc2[C@H]3N[C@@H](Cn2c1=O)[C@H](CO)[C@H]3C(=O)NC1CCC1	InChI=1S/C25H30N4O4/c1-28(2)24(32)15-6-3-5-14(11-15)17-9-10-20-22-21(23(31)26-16-7-4-8-16)18(13-30)19(27-22)12-29(20)25(17)33/h3,5-6,9-11,16,18-19,21-22,27,30H,4,7-8,12-13H2,1-2H3,(H,26,31)/t18-,19-,21+,22+/m0/s1	NFKFSUDWHJDXEV-SEIRJHJZSA-N	450.22670548							101948
BRD-K63435201	LSM-12291		54660972	InChI=1S/C21H25N3O5S/c1-13(14-7-4-3-5-8-14)22-21(27)20-16(12-25)15-11-23-17(9-6-10-18(23)26)19(15)24(20)30(2,28)29/h3-10,13,15-16,19-20,25H,11-12H2,1-2H3,(H,22,27)/t13-,15+,16+,19-,20+/m0/s1	LURAPRBVZDLHCY-FQCQXKDLSA-N	C[C@H](NC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@H]2N1S(=O)(=O)C)c4ccccc4	BroadT	BRD-K63435201	BRD-K63435201-001-01-2	Broad Institute of MIT and Harvard	BRD-K63435201			C[C@H](NC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@H]2N1S(C)(=O)=O)c1ccccc1	InChI=1S/C21H25N3O5S/c1-13(14-7-4-3-5-8-14)22-21(27)20-16(12-25)15-11-23-17(9-6-10-18(23)26)19(15)24(20)30(2,28)29/h3-10,13,15-16,19-20,25H,11-12H2,1-2H3,(H,22,27)/t13-,15+,16+,19-,20+/m0/s1	LURAPRBVZDLHCY-FQCQXKDLSA-N	431.15149162							100917
BRD-K26148755	LSM-10013		54660909	InChI=1S/C21H21N3O5/c25-10-14-16-9-23-15(4-3-13(20(23)27)11-5-7-22-8-6-11)18(17(14)21(28)29)24(16)19(26)12-1-2-12/h3-8,12,14,16-18,25H,1-2,9-10H2,(H,28,29)/t14-,16-,17+,18+/m0/s1	YHZGHLFVBXATHQ-DZJNRPSUSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@H]([C@@H]1C(=O)O)N2C(=O)C5CC5	BroadT	BRD-K26148755	BRD-K26148755-001-01-7	Broad Institute of MIT and Harvard	BRD-K26148755			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]([C@@H]1C(O)=O)N2C(=O)C1CC1	InChI=1S/C21H21N3O5/c25-10-14-16-9-23-15(4-3-13(20(23)27)11-5-7-22-8-6-11)18(17(14)21(28)29)24(16)19(26)12-1-2-12/h3-8,12,14,16-18,25H,1-2,9-10H2,(H,28,29)/t14-,16-,17+,18+/m0/s1	YHZGHLFVBXATHQ-DZJNRPSUSA-N	395.148120802							98634
BRD-K96150242	LSM-14328		54660756	InChI=1S/C25H32N4O5/c1-4-12-27-25(33)29-19-13-28-18(22(29)21(17(19)14-30)23(31)26-5-2)11-10-16(24(28)32)15-8-6-7-9-20(15)34-3/h6-11,17,19,21-22,30H,4-5,12-14H2,1-3H3,(H,26,31)(H,27,33)/t17-,19-,21+,22+/m1/s1	RDJLSMVLUOAMPE-IVOMFYJKSA-N	CCCNC(=O)N1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@H]1[C@H]([C@@H]2CO)C(=O)NCC	BroadT	BRD-K96150242	BRD-K96150242-001-01-9	Broad Institute of MIT and Harvard	BRD-K96150242			CCCNC(=O)N1[C@@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCC	InChI=1S/C25H32N4O5/c1-4-12-27-25(33)29-19-13-28-18(22(29)21(17(19)14-30)23(31)26-5-2)11-10-16(24(28)32)15-8-6-7-9-20(15)34-3/h6-11,17,19,21-22,30H,4-5,12-14H2,1-3H3,(H,26,31)(H,27,33)/t17-,19-,21+,22+/m1/s1	RDJLSMVLUOAMPE-IVOMFYJKSA-N	468.237270164							102982
BRD-M23876883	LSM-45016		54660874	InChI=1S/C23H26ClN3O5S/c1-3-6-14-9-10-19-20-16(12-26(19)23(14)30)17(13-28)21(27(20)33(2,31)32)22(29)25-11-15-7-4-5-8-18(15)24/h3-10,16-17,20-21,28H,11-13H2,1-2H3,(H,25,29)/t16-,17-,20+,21-/m1/s1	GLXDGGACPBJUPS-SGLNWRHMSA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3S(=O)(=O)C)C(=O)NCc4ccccc4Cl	BroadT	BRD-M23876883	BRD-M23876883-001-01-9	Broad Institute of MIT and Harvard	BRD-M23876883		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4ccccc4Cl)N(S(C)(=O)=O)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4ccccc4Cl)N(S(C)(=O)=O)[C@H]23)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4ccccc4Cl)N(S(C)(=O)=O)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCc4ccccc4Cl)N(S(C)(=O)=O)[C@H]23)c1=O	InChI=1S/2C23H26ClN3O5S/c2*1-3-6-14-9-10-19-20-16(12-26(19)23(14)30)17(13-28)21(27(20)33(2,31)32)22(29)25-11-15-7-4-5-8-18(15)24/h2*3-10,16-17,20-21,28H,11-13H2,1-2H3,(H,25,29)/b6-3+;6-3-/t2*16-,17-,20+,21-/m11/s1	UCSZHFMIVXFQBI-IJDOWDPKSA-N	491.128169362							103253
BRD-K02927581	LSM-8616		54661033	InChI=1S/C26H25FN4O4/c1-2-28-24(33)22-18(14-32)21-13-30-20(23(22)31(21)26(35)19-5-3-4-12-29-19)11-10-17(25(30)34)15-6-8-16(27)9-7-15/h3-12,18,21-23,32H,2,13-14H2,1H3,(H,28,33)/t18-,21-,22+,23+/m0/s1	SQYOPUXXKNICGN-XSEFMFLKSA-N	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]1N2C(=O)c5ccccn5	BroadT	BRD-K02927581	BRD-K02927581-001-01-2	Broad Institute of MIT and Harvard	BRD-K02927581			CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]1N2C(=O)c1ccccn1	InChI=1S/C26H25FN4O4/c1-2-28-24(33)22-18(14-32)21-13-30-20(23(22)31(21)26(35)19-5-3-4-12-29-19)11-10-17(25(30)34)15-6-8-16(27)9-7-15/h3-12,18,21-23,32H,2,13-14H2,1H3,(H,28,33)/t18-,21-,22+,23+/m0/s1	SQYOPUXXKNICGN-XSEFMFLKSA-N	476.18598352							97237
BRD-K95047072	LSM-14256		54660871	InChI=1S/C24H29N3O3/c28-15-19-18-14-27-20(10-5-11-21(27)29)22(18)26(13-12-16-6-2-1-3-7-16)23(19)24(30)25-17-8-4-9-17/h1-3,5-7,10-11,17-19,22-23,28H,4,8-9,12-15H2,(H,25,30)/t18-,19-,22+,23-/m0/s1	TURNTDXZFQQILD-LBVMUVSTSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N(CCc4ccccc4)[C@@H]1C(=O)NC5CCC5	BroadT	BRD-K95047072	BRD-K95047072-001-01-3	Broad Institute of MIT and Harvard	BRD-K95047072			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N(CCc2ccccc2)[C@@H]1C(=O)NC1CCC1	InChI=1S/C24H29N3O3/c28-15-19-18-14-27-20(10-5-11-21(27)29)22(18)26(13-12-16-6-2-1-3-7-16)23(19)24(30)25-17-8-4-9-17/h1-3,5-7,10-11,17-19,22-23,28H,4,8-9,12-15H2,(H,25,30)/t18-,19-,22+,23-/m0/s1	TURNTDXZFQQILD-LBVMUVSTSA-N	407.220891818							102910
BRD-K85462489	LSM-13653		54660646	InChI=1S/C25H36N4O4/c30-16-19-20-15-29-21(8-7-18(25(29)32)17-5-2-1-3-6-17)23(27-20)22(19)24(31)26-9-4-10-28-11-13-33-14-12-28/h5,7-8,19-20,22-23,27,30H,1-4,6,9-16H2,(H,26,31)/t19-,20-,22+,23+/m0/s1	QXIHUUSMHZUCPE-JFJDKTSWSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H](N2)[C@@H]1C(=O)NCCCN4CCOCC4)C5=CCCCC5	BroadT	BRD-K85462489	BRD-K85462489-001-01-3	Broad Institute of MIT and Harvard	BRD-K85462489			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H](N2)[C@@H]1C(=O)NCCCN1CCOCC1	InChI=1S/C25H36N4O4/c30-16-19-20-15-29-21(8-7-18(25(29)32)17-5-2-1-3-6-17)23(27-20)22(19)24(31)26-9-4-10-28-11-13-33-14-12-28/h5,7-8,19-20,22-23,27,30H,1-4,6,9-16H2,(H,26,31)/t19-,20-,22+,23+/m0/s1	QXIHUUSMHZUCPE-JFJDKTSWSA-N	456.273655672							102300
BRD-K51961561	LSM-11608		54660744	InChI=1S/C19H19FN2O4/c1-26-19(25)16-12(9-23)14-8-22-15(17(16)21-14)7-6-11(18(22)24)10-4-2-3-5-13(10)20/h2-7,12,14,16-17,21,23H,8-9H2,1H3/t12-,14-,16+,17+/m1/s1	NXPHSKBMFHKARG-IRWJRLHMSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]1N2	BroadT	BRD-K51961561	BRD-K51961561-001-01-5	Broad Institute of MIT and Harvard	BRD-K51961561			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]1N2	InChI=1S/C19H19FN2O4/c1-26-19(25)16-12(9-23)14-8-22-15(17(16)21-14)7-6-11(18(22)24)10-4-2-3-5-13(10)20/h2-7,12,14,16-17,21,23H,8-9H2,1H3/t12-,14-,16+,17+/m1/s1	NXPHSKBMFHKARG-IRWJRLHMSA-N	358.132885308							100231
BRD-K54014179	LSM-11715		54660868	InChI=1S/C30H34N4O3/c1-32-26-18-34-25(8-7-23(29(34)36)22-9-13-31-14-10-22)28(32)27(24(26)19-35)30(37)33-15-11-21(12-16-33)17-20-5-3-2-4-6-20/h2-10,13-14,21,24,26-28,35H,11-12,15-19H2,1H3/t24-,26-,27+,28+/m0/s1	QUSLSSXBBMTUKA-GDWZEYGFSA-N	CN1[C@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@@H]1[C@@H]([C@H]2CO)C(=O)N5CCC(Cc6ccccc6)CC5	BroadT	BRD-K54014179	BRD-K54014179-001-01-4	Broad Institute of MIT and Harvard	BRD-K54014179			CN1[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N1CCC(Cc2ccccc2)CC1	InChI=1S/C30H34N4O3/c1-32-26-18-34-25(8-7-23(29(34)36)22-9-13-31-14-10-22)28(32)27(24(26)19-35)30(37)33-15-11-21(12-16-33)17-20-5-3-2-4-6-20/h2-10,13-14,21,24,26-28,35H,11-12,15-19H2,1H3/t24-,26-,27+,28+/m0/s1	QUSLSSXBBMTUKA-GDWZEYGFSA-N	498.263090988							100340
BRD-K31183432	LSM-10313		54660719	InChI=1S/C25H29N3O3/c1-15(16-7-3-2-4-8-16)26-24(30)23-20(14-29)19-13-28-21(22(19)27-23)12-11-18(25(28)31)17-9-5-6-10-17/h2-4,7-9,11-12,15,19-20,22-23,27,29H,5-6,10,13-14H2,1H3,(H,26,30)/t15-,19+,20+,22-,23+/m1/s1	DEERBQNZFWMEPS-GKOPTACNSA-N	C[C@@H](NC(=O)[C@H]1N[C@@H]2[C@@H](CN3C(=O)C(=CC=C23)C4=CCCC4)[C@@H]1CO)c5ccccc5	BroadT	BRD-K31183432	BRD-K31183432-001-01-8	Broad Institute of MIT and Harvard	BRD-K31183432			C[C@@H](NC(=O)[C@H]1N[C@@H]2[C@@H](Cn3c2ccc(C2=CCCC2)c3=O)[C@@H]1CO)c1ccccc1	InChI=1S/C25H29N3O3/c1-15(16-7-3-2-4-8-16)26-24(30)23-20(14-29)19-13-28-21(22(19)27-23)12-11-18(25(28)31)17-9-5-6-10-17/h2-4,7-9,11-12,15,19-20,22-23,27,29H,5-6,10,13-14H2,1H3,(H,26,30)/t15-,19+,20+,22-,23+/m1/s1	DEERBQNZFWMEPS-GKOPTACNSA-N	419.220891818							98934
BRD-K26252750	LSM-10020		54660862	InChI=1S/C25H27N3O5/c29-14-18-20-13-27-19(10-9-17(24(27)31)15-6-2-1-3-7-15)23(22(18)25(32)33)28(20)21(30)12-16-8-4-5-11-26-16/h4-6,8-11,18,20,22-23,29H,1-3,7,12-14H2,(H,32,33)/t18-,20-,22+,23+/m1/s1	OUKGSGKLYXRNMA-SQMBMXPBSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C4=CCCCC4)C3=O)[C@@H]([C@H]1C(=O)O)N2C(=O)Cc5ccccn5	BroadT	BRD-K26252750	BRD-K26252750-001-01-2	Broad Institute of MIT and Harvard	BRD-K26252750			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]([C@H]1C(O)=O)N2C(=O)Cc1ccccn1	InChI=1S/C25H27N3O5/c29-14-18-20-13-27-19(10-9-17(24(27)31)15-6-2-1-3-7-15)23(22(18)25(32)33)28(20)21(30)12-16-8-4-5-11-26-16/h4-6,8-11,18,20,22-23,29H,1-3,7,12-14H2,(H,32,33)/t18-,20-,22+,23+/m1/s1	OUKGSGKLYXRNMA-SQMBMXPBSA-N	449.195070994							98641
CHEMBL3188404	LSM-43494	BRD-K74832096	54660650	InChI=1S/C27H31N3O6/c1-35-17-23(32)30-22-15-29-21(10-9-19(26(29)33)8-7-18-5-3-2-4-6-18)25(30)24(20(22)16-31)27(34)28-11-13-36-14-12-28/h2-10,20,22,24-25,31H,11-17H2,1H3/b8-7+/t20-,22-,24+,25+/m0/s1	XMUOPSKEXGVNOG-ZTDKDPLASA-N	COCC(=O)N1[C@H]2CN3C(=O)C(=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)N4CCOCC4)\C=C\c5ccccc5	BroadT	BRD-K74832096	BRD-K74832096-001-01-5	Broad Institute of MIT and Harvard	BRD-K74832096			COCC(=O)N1[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)N1CCOCC1	InChI=1S/C27H31N3O6/c1-35-17-23(32)30-22-15-29-21(10-9-19(26(29)33)8-7-18-5-3-2-4-6-18)25(30)24(20(22)16-31)27(34)28-11-13-36-14-12-28/h2-10,20,22,24-25,31H,11-17H2,1H3/b8-7+/t20-,22-,24+,25+/m0/s1	XMUOPSKEXGVNOG-ZTDKDPLASA-N	493.221285742							
BRD-M12187987	LSM-45005		54660675	InChI=1S/C23H25N3O5/c1-2-3-14-5-6-17-21-20(15(11-27)16(25-21)10-26(17)23(14)29)22(28)24-9-13-4-7-18-19(8-13)31-12-30-18/h2-8,15-16,20-21,25,27H,9-12H2,1H3,(H,24,28)/t15-,16-,20+,21+/m0/s1	ZLAIHPPUWVVFMW-LVNJIZSUSA-N	CC=CC1=CC=C2[C@H]3N[C@@H](CN2C1=O)[C@H](CO)[C@H]3C(=O)NCc4ccc5OCOc5c4	BroadT	BRD-M12187987	BRD-M12187987-001-01-9	Broad Institute of MIT and Harvard	BRD-M12187987		C\C=C\c1ccc2[C@H]3N[C@@H](Cn2c1=O)[C@H](CO)[C@H]3C(=O)NCc1ccc2OCOc2c1.C\C=C/c1ccc2[C@H]3N[C@@H](Cn2c1=O)[C@H](CO)[C@H]3C(=O)NCc1ccc2OCOc2c1	C\C=C\c1ccc2[C@H]3N[C@@H](Cn2c1=O)[C@H](CO)[C@H]3C(=O)NCc1ccc2OCOc2c1.C\C=C/c1ccc2[C@H]3N[C@@H](Cn2c1=O)[C@H](CO)[C@H]3C(=O)NCc1ccc2OCOc2c1	InChI=1S/2C23H25N3O5/c2*1-2-3-14-5-6-17-21-20(15(11-27)16(25-21)10-26(17)23(14)29)22(28)24-9-13-4-7-18-19(8-13)31-12-30-18/h2*2-8,15-16,20-21,25,27H,9-12H2,1H3,(H,24,28)/b3-2+;3-2-/t2*15-,16-,20+,21+/m00/s1	IHPZOKOAQWUWOA-WCBVMZGTSA-N	423.17942093							103242
BRD-K98990727	LSM-14505		54660901	InChI=1S/C16H23N3O3/c1-3-7-17-16(22)15-11(9-20)10-8-19-12(14(10)18(15)2)5-4-6-13(19)21/h4-6,10-11,14-15,20H,3,7-9H2,1-2H3,(H,17,22)/t10-,11-,14+,15-/m1/s1	MRYDESPSWZCGBB-HKCMKHECSA-N	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@H]2N1C	BroadT	BRD-K98990727	BRD-K98990727-001-01-0	Broad Institute of MIT and Harvard	BRD-K98990727			CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@H]2N1C	InChI=1S/C16H23N3O3/c1-3-7-17-16(22)15-11(9-20)10-8-19-12(14(10)18(15)2)5-4-6-13(19)21/h4-6,10-11,14-15,20H,3,7-9H2,1-2H3,(H,17,22)/t10-,11-,14+,15-/m1/s1	MRYDESPSWZCGBB-HKCMKHECSA-N	305.173941626							103160
MLS005000165	LSM-11360	BRD-K48138407	54660682	InChI=1S/C26H27N5O5/c1-15(33)31-22-12-30-21(7-6-19(26(30)35)17-10-27-14-28-11-17)24(31)23(20(22)13-32)25(34)29-9-16-4-3-5-18(8-16)36-2/h3-8,10-11,14,20,22-24,32H,9,12-13H2,1-2H3,(H,29,34)/t20-,22-,23+,24+/m0/s1	ICWHUNLLRZPXIM-IQFVJIFQSA-N	COc1cccc(CNC(=O)[C@@H]2[C@@H](CO)[C@@H]3CN4C(=CC=C(C4=O)c5cncnc5)[C@H]2N3C(=O)C)c1	BroadT	BRD-K48138407	BRD-K48138407-001-01-4	Broad Institute of MIT and Harvard	BRD-K48138407			COc1cccc(CNC(=O)[C@@H]2[C@@H](CO)[C@@H]3Cn4c(ccc(-c5cncnc5)c4=O)[C@H]2N3C(C)=O)c1	InChI=1S/C26H27N5O5/c1-15(33)31-22-12-30-21(7-6-19(26(30)35)17-10-27-14-28-11-17)24(31)23(20(22)13-32)25(34)29-9-16-4-3-5-18(8-16)36-2/h3-8,10-11,14,20,22-24,32H,9,12-13H2,1-2H3,(H,29,34)/t20-,22-,23+,24+/m0/s1	ICWHUNLLRZPXIM-IQFVJIFQSA-N	489.201219014							99981
BRD-K42862966	LSM-11031		54660992	InChI=1S/C20H24N4O4/c1-3-6-23-17-14(15(10-25)18(23)20(27)28-2)9-24-16(17)5-4-13(19(24)26)12-7-21-11-22-8-12/h4-5,7-8,11,14-15,17-18,25H,3,6,9-10H2,1-2H3/t14-,15-,17+,18-/m1/s1	XIODHUUFDRNNKZ-XYVMCAHJSA-N	CCCN1[C@H]([C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]12)c4cncnc4)C(=O)OC	BroadT	BRD-K42862966	BRD-K42862966-001-01-8	Broad Institute of MIT and Harvard	BRD-K42862966			CCCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@@H]12)C(=O)OC	InChI=1S/C20H24N4O4/c1-3-6-23-17-14(15(10-25)18(23)20(27)28-2)9-24-16(17)5-4-13(19(24)26)12-7-21-11-22-8-12/h4-5,7-8,11,14-15,17-18,25H,3,6,9-10H2,1-2H3/t14-,15-,17+,18-/m1/s1	XIODHUUFDRNNKZ-XYVMCAHJSA-N	384.179755288							99652
BRD-K96352830	LSM-14340		54660724	InChI=1S/C28H36N4O4/c1-2-13-29-28(36)32-23-17-31-22(9-6-10-24(31)34)26(32)25(21(23)18-33)27(35)30-14-11-20(12-15-30)16-19-7-4-3-5-8-19/h3-10,20-21,23,25-26,33H,2,11-18H2,1H3,(H,29,36)/t21-,23-,25+,26+/m1/s1	VALQRGDBSGWYJJ-KUSCKROYSA-N	CCCNC(=O)N1[C@@H]2CN3C(=O)C=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)N4CCC(Cc5ccccc5)CC4	BroadT	BRD-K96352830	BRD-K96352830-001-01-9	Broad Institute of MIT and Harvard	BRD-K96352830			CCCNC(=O)N1[C@@H]2Cn3c(cccc3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N1CCC(Cc2ccccc2)CC1	InChI=1S/C28H36N4O4/c1-2-13-29-28(36)32-23-17-31-22(9-6-10-24(31)34)26(32)25(21(23)18-33)27(35)30-14-11-20(12-15-30)16-19-7-4-3-5-8-19/h3-10,20-21,23,25-26,33H,2,11-18H2,1H3,(H,29,36)/t21-,23-,25+,26+/m1/s1	VALQRGDBSGWYJJ-KUSCKROYSA-N	492.273655672							102994
BRD-K58493574	LSM-11958		54660866	InChI=1S/C26H33FN4O3/c1-3-10-30-23-19(20(16-32)24(30)26(34)29-13-11-28(2)12-14-29)15-31-22(23)9-8-18(25(31)33)17-6-4-5-7-21(17)27/h4-9,19-20,23-24,32H,3,10-16H2,1-2H3/t19-,20-,23+,24-/m0/s1	USYUKGCDRIQXPK-JVODISISSA-N	CCCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]12)C(=O)N5CCN(C)CC5	BroadT	BRD-K58493574	BRD-K58493574-001-01-7	Broad Institute of MIT and Harvard	BRD-K58493574			CCCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]12)C(=O)N1CCN(C)CC1	InChI=1S/C26H33FN4O3/c1-3-10-30-23-19(20(16-32)24(30)26(34)29-13-11-28(2)12-14-29)15-31-22(23)9-8-18(25(31)33)17-6-4-5-7-21(17)27/h4-9,19-20,23-24,32H,3,10-16H2,1-2H3/t19-,20-,23+,24-/m0/s1	USYUKGCDRIQXPK-JVODISISSA-N	468.253669156							100584
BRD-K26604645	LSM-10041		54660791	InChI=1S/C24H31N5O3/c30-15-19-18-14-29-20(7-6-17(24(29)32)16-5-4-8-25-13-16)21(18)27-22(19)23(31)26-9-12-28-10-2-1-3-11-28/h4-8,13,18-19,21-22,27,30H,1-3,9-12,14-15H2,(H,26,31)/t18-,19-,21+,22-/m1/s1	FYGMFPVOHAHUKR-KRXUUXHPSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H]2N[C@H]1C(=O)NCCN4CCCCC4)c5cccnc5	BroadT	BRD-K26604645	BRD-K26604645-001-01-3	Broad Institute of MIT and Harvard	BRD-K26604645			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]2N[C@H]1C(=O)NCCN1CCCCC1	InChI=1S/C24H31N5O3/c30-15-19-18-14-29-20(7-6-17(24(29)32)16-5-4-8-25-13-16)21(18)27-22(19)23(31)26-9-12-28-10-2-1-3-11-28/h4-8,13,18-19,21-22,27,30H,1-3,9-12,14-15H2,(H,26,31)/t18-,19-,21+,22-/m1/s1	FYGMFPVOHAHUKR-KRXUUXHPSA-N	437.242689902							98662
BRD-K16347954	LSM-9415		54660748	InChI=1S/C27H30N4O5/c32-16-20-22-15-30-21(6-5-19(26(30)34)17-3-1-2-4-17)24(23(20)27(35)29-11-13-36-14-12-29)31(22)25(33)18-7-9-28-10-8-18/h3,5-10,20,22-24,32H,1-2,4,11-16H2/t20-,22-,23+,24+/m0/s1	COTUBAWVYSPTNF-IQFVJIFQSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@H]([C@@H]1C(=O)N4CCOCC4)N2C(=O)c5ccncc5)C6=CCCC6	BroadT	BRD-K16347954	BRD-K16347954-001-01-6	Broad Institute of MIT and Harvard	BRD-K16347954			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]([C@@H]1C(=O)N1CCOCC1)N2C(=O)c1ccncc1	InChI=1S/C27H30N4O5/c32-16-20-22-15-30-21(6-5-19(26(30)34)17-3-1-2-4-17)24(23(20)27(35)29-11-13-36-14-12-29)31(22)25(33)18-7-9-28-10-8-18/h3,5-10,20,22-24,32H,1-2,4,11-16H2/t20-,22-,23+,24+/m0/s1	COTUBAWVYSPTNF-IQFVJIFQSA-N	490.2216201							98036
BRD-K71353154	LSM-12789		54660751	InChI=1S/C31H35N3O3/c35-20-25-27-19-34-26(16-15-24(31(34)37)22-11-5-2-6-12-22)29(28(25)30(36)32-23-13-7-8-14-23)33(27)18-17-21-9-3-1-4-10-21/h1-6,9-12,15-16,23,25,27-29,35H,7-8,13-14,17-20H2,(H,32,36)/t25-,27-,28+,29+/m1/s1	BONPOAJFWRGMIG-RXIOLPMVSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@@H]([C@H]1C(=O)NC4CCCC4)N2CCc5ccccc5)c6ccccc6	BroadT	BRD-K71353154	BRD-K71353154-001-01-4	Broad Institute of MIT and Harvard	BRD-K71353154			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]([C@H]1C(=O)NC1CCCC1)N2CCc1ccccc1	InChI=1S/C31H35N3O3/c35-20-25-27-19-34-26(16-15-24(31(34)37)22-11-5-2-6-12-22)29(28(25)30(36)32-23-13-7-8-14-23)33(27)18-17-21-9-3-1-4-10-21/h1-6,9-12,15-16,23,25,27-29,35H,7-8,13-14,17-20H2,(H,32,36)/t25-,27-,28+,29+/m1/s1	BONPOAJFWRGMIG-RXIOLPMVSA-N	497.26784201							101426
BRD-K84121492	LSM-13572		54660695	InChI=1S/C25H24N4O6/c1-34-20-6-4-3-5-14(20)15-7-8-19-21-16(12-28(19)23(15)31)17(13-30)22(25(33)35-2)29(21)24(32)18-11-26-9-10-27-18/h3-11,16-17,21-22,30H,12-13H2,1-2H3/t16-,17-,21+,22-/m0/s1	PJQVGEWXXVLMPO-QPAOKJHLSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@@H]2N1C(=O)c5cnccn5	BroadT	BRD-K84121492	BRD-K84121492-001-01-1	Broad Institute of MIT and Harvard	BRD-K84121492			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@@H]2N1C(=O)c1cnccn1	InChI=1S/C25H24N4O6/c1-34-20-6-4-3-5-14(20)15-7-8-19-21-16(12-28(19)23(15)31)17(13-30)22(25(33)35-2)29(21)24(32)18-11-26-9-10-27-18/h3-11,16-17,21-22,30H,12-13H2,1-2H3/t16-,17-,21+,22-/m0/s1	PJQVGEWXXVLMPO-QPAOKJHLSA-N	476.169584528							102214
BRD-K46922721	LSM-11289		54660991	InChI=1S/C20H24N4O4/c1-3-6-23-17-14(15(10-25)18(23)20(27)28-2)9-24-16(17)5-4-13(19(24)26)12-7-21-11-22-8-12/h4-5,7-8,11,14-15,17-18,25H,3,6,9-10H2,1-2H3/t14-,15-,17+,18-/m0/s1	XIODHUUFDRNNKZ-ONIAQPFYSA-N	CCCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]12)c4cncnc4)C(=O)OC	BroadT	BRD-K46922721	BRD-K46922721-001-01-2	Broad Institute of MIT and Harvard	BRD-K46922721			CCCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@H]12)C(=O)OC	InChI=1S/C20H24N4O4/c1-3-6-23-17-14(15(10-25)18(23)20(27)28-2)9-24-16(17)5-4-13(19(24)26)12-7-21-11-22-8-12/h4-5,7-8,11,14-15,17-18,25H,3,6,9-10H2,1-2H3/t14-,15-,17+,18-/m0/s1	XIODHUUFDRNNKZ-ONIAQPFYSA-N	384.179755288							99910
BRD-K83744912	LSM-13547		54660696	InChI=1S/C25H24N4O6/c1-34-20-6-4-3-5-14(20)15-7-8-19-21-16(12-28(19)23(15)31)17(13-30)22(25(33)35-2)29(21)24(32)18-11-26-9-10-27-18/h3-11,16-17,21-22,30H,12-13H2,1-2H3/t16-,17-,21+,22-/m1/s1	PJQVGEWXXVLMPO-FTIBCMOBSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@H]2N1C(=O)c5cnccn5	BroadT	BRD-K83744912	BRD-K83744912-001-01-3	Broad Institute of MIT and Harvard	BRD-K83744912			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@H]2N1C(=O)c1cnccn1	InChI=1S/C25H24N4O6/c1-34-20-6-4-3-5-14(20)15-7-8-19-21-16(12-28(19)23(15)31)17(13-30)22(25(33)35-2)29(21)24(32)18-11-26-9-10-27-18/h3-11,16-17,21-22,30H,12-13H2,1-2H3/t16-,17-,21+,22-/m1/s1	PJQVGEWXXVLMPO-FTIBCMOBSA-N	476.169584528							102189
BRD-K69344898	LSM-12657		54660669	InChI=1S/C25H27N5O3S/c31-14-18-20-12-30-19(4-3-17(25(30)33)16-5-7-26-8-6-16)23(29(20)13-21-27-9-10-34-21)22(18)24(32)28-11-15-1-2-15/h3-10,15,18,20,22-23,31H,1-2,11-14H2,(H,28,32)/t18-,20-,22+,23+/m0/s1	HSQWCVQVATZDQW-NEKRIBJYSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@H]([C@@H]1C(=O)NCC5CC5)N2Cc6nccs6	BroadT	BRD-K69344898	BRD-K69344898-001-01-8	Broad Institute of MIT and Harvard	BRD-K69344898			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]([C@@H]1C(=O)NCC1CC1)N2Cc1nccs1	InChI=1S/C25H27N5O3S/c31-14-18-20-12-30-19(4-3-17(25(30)33)16-5-7-26-8-6-16)23(29(20)13-21-27-9-10-34-21)22(18)24(32)28-11-15-1-2-15/h3-10,15,18,20,22-23,31H,1-2,11-14H2,(H,28,32)/t18-,20-,22+,23+/m0/s1	HSQWCVQVATZDQW-NEKRIBJYSA-N	477.183460464							101291
BRD-K83077741	LSM-13507		54660638	InChI=1S/C21H26N4O4/c26-11-15-17-10-24-16(5-4-6-18(24)27)20(25(17)9-14-12-29-13-22-14)19(15)21(28)23-7-2-1-3-8-23/h4-6,12-13,15,17,19-20,26H,1-3,7-11H2/t15-,17-,19+,20+/m1/s1	PJVBFVCJEZYLHS-BEKAIBRUSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)N4CCCCC4)N2Cc5cocn5	BroadT	BRD-K83077741	BRD-K83077741-001-01-5	Broad Institute of MIT and Harvard	BRD-K83077741			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)N1CCCCC1)N2Cc1cocn1	InChI=1S/C21H26N4O4/c26-11-15-17-10-24-16(5-4-6-18(24)27)20(25(17)9-14-12-29-13-22-14)19(15)21(28)23-7-2-1-3-8-23/h4-6,12-13,15,17,19-20,26H,1-3,7-11H2/t15-,17-,19+,20+/m1/s1	PJVBFVCJEZYLHS-BEKAIBRUSA-N	398.195405352							102148
BRD-M55020616	LSM-45047		54660802	InChI=1S/C24H28N2O4/c1-3-7-17-10-11-20-21-18(14-26(20)23(17)28)19(15-27)22(24(29)30-2)25(21)13-12-16-8-5-4-6-9-16/h3-11,18-19,21-22,27H,12-15H2,1-2H3/t18-,19-,21+,22-/m0/s1	BOAJGZQCXTZFHN-MPJJRAAHSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N1CCc4ccccc4)C=CC	BroadT	BRD-M55020616	BRD-M55020616-001-01-9	Broad Institute of MIT and Harvard	BRD-M55020616		COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]2N1CCc1ccccc1.COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@@H]2N1CCc1ccccc1)\C=C/C	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]2N1CCc1ccccc1.COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@@H]2N1CCc1ccccc1)\C=C/C	InChI=1S/2C24H28N2O4/c2*1-3-7-17-10-11-20-21-18(14-26(20)23(17)28)19(15-27)22(24(29)30-2)25(21)13-12-16-8-5-4-6-9-16/h2*3-11,18-19,21-22,27H,12-15H2,1-2H3/b7-3+;7-3-/t2*18-,19-,21+,22-/m00/s1	HWXVAOXZBVDFCJ-PMBOPSJOSA-N	408.204907396							103284
BRD-M95429326	LSM-45088		54660736	InChI=1S/C24H26FN3O4/c1-4-5-14-8-11-18-21-20(24(32)26(2)3)17(13-29)19(12-27(18)22(14)30)28(21)23(31)15-6-9-16(25)10-7-15/h4-11,17,19-21,29H,12-13H2,1-3H3/t17-,19-,20+,21+/m1/s1	QHTBDTJLVQLHTQ-PBASOCQRSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3C(=O)c4ccc(F)cc4)C(=O)N(C)C	BroadT	BRD-M95429326	BRD-M95429326-001-01-5	Broad Institute of MIT and Harvard	BRD-M95429326		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N(C)C)[C@H]2N3C(=O)c2ccc(F)cc2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N(C)C)[C@H]2N3C(=O)c2ccc(F)cc2)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N(C)C)[C@H]2N3C(=O)c2ccc(F)cc2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N(C)C)[C@H]2N3C(=O)c2ccc(F)cc2)c1=O	InChI=1S/2C24H26FN3O4/c2*1-4-5-14-8-11-18-21-20(24(32)26(2)3)17(13-29)19(12-27(18)22(14)30)28(21)23(31)15-6-9-16(25)10-7-15/h2*4-11,17,19-21,29H,12-13H2,1-3H3/b5-4+;5-4-/t2*17-,19-,20+,21+/m11/s1	MWRJRRDCKGAZGY-ROFVPFGISA-N	439.190734542							103325
BRD-K47070211	LSM-11301		54660936	InChI=1S/C26H25N5O4/c32-14-19-18-13-30-21(6-3-7-22(30)33)23(18)31(26(35)20-12-27-8-9-28-20)24(19)25(34)29-17-10-15-4-1-2-5-16(15)11-17/h1-9,12,17-19,23-24,32H,10-11,13-14H2,(H,29,34)/t18-,19-,23+,24-/m1/s1	UFMLPCAJUBVDJE-PBIIQAGSSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N([C@H]1C(=O)NC4Cc5ccccc5C4)C(=O)c6cnccn6	BroadT	BRD-K47070211	BRD-K47070211-001-01-6	Broad Institute of MIT and Harvard	BRD-K47070211			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N([C@H]1C(=O)NC1Cc2ccccc2C1)C(=O)c1cnccn1	InChI=1S/C26H25N5O4/c32-14-19-18-13-30-21(6-3-7-22(30)33)23(18)31(26(35)20-12-27-8-9-28-20)24(19)25(34)29-17-10-15-4-1-2-5-16(15)11-17/h1-9,12,17-19,23-24,32H,10-11,13-14H2,(H,29,34)/t18-,19-,23+,24-/m1/s1	UFMLPCAJUBVDJE-PBIIQAGSSA-N	471.19065433							99922
BRD-K32910761	LSM-10428		54660906	InChI=1S/C22H21FN4O3S/c1-26-17-10-27-16(6-5-14(21(27)30)12-3-2-4-13(23)9-12)19(26)18(15(17)11-28)20(29)25-22-24-7-8-31-22/h2-9,15,17-19,28H,10-11H2,1H3,(H,24,25,29)/t15-,17-,18+,19+/m1/s1	CVDFBNGMHHTSQY-YSHGAJCASA-N	CN1[C@@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@H]1[C@H]([C@@H]2CO)C(=O)Nc5nccs5	BroadT	BRD-K32910761	BRD-K32910761-001-01-4	Broad Institute of MIT and Harvard	BRD-K32910761			CN1[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)Nc1nccs1	InChI=1S/C22H21FN4O3S/c1-26-17-10-27-16(6-5-14(21(27)30)12-3-2-4-13(23)9-12)19(26)18(15(17)11-28)20(29)25-22-24-7-8-31-22/h2-9,15,17-19,28H,10-11H2,1H3,(H,24,25,29)/t15-,17-,18+,19+/m1/s1	CVDFBNGMHHTSQY-YSHGAJCASA-N	440.131839462							99049
BRD-K64302818	LSM-12352		54660683	InChI=1S/C25H30N4O4/c1-28(2)24(32)15-6-3-5-14(11-15)17-9-10-20-22-21(23(31)26-16-7-4-8-16)18(13-30)19(27-22)12-29(20)25(17)33/h3,5-6,9-11,16,18-19,21-22,27,30H,4,7-8,12-13H2,1-2H3,(H,26,31)/t18-,19-,21+,22+/m1/s1	NFKFSUDWHJDXEV-WKDRNLAYSA-N	CN(C)C(=O)c1cccc(c1)C2=CC=C3[C@@H]4N[C@H](CN3C2=O)[C@@H](CO)[C@@H]4C(=O)NC5CCC5	BroadT	BRD-K64302818	BRD-K64302818-001-01-8	Broad Institute of MIT and Harvard	BRD-K64302818			CN(C)C(=O)c1cccc(c1)-c1ccc2[C@@H]3N[C@H](Cn2c1=O)[C@@H](CO)[C@@H]3C(=O)NC1CCC1	InChI=1S/C25H30N4O4/c1-28(2)24(32)15-6-3-5-14(11-15)17-9-10-20-22-21(23(31)26-16-7-4-8-16)18(13-30)19(27-22)12-29(20)25(17)33/h3,5-6,9-11,16,18-19,21-22,27,30H,4,7-8,12-13H2,1-2H3,(H,26,31)/t18-,19-,21+,22+/m1/s1	NFKFSUDWHJDXEV-WKDRNLAYSA-N	450.22670548							100979
BRD-K17223851	LSM-9467		54660674	InChI=1S/C23H27N3O5/c1-30-15-4-2-14(3-5-15)16-6-7-19-20-17(12-26(19)22(16)28)18(13-27)21(24-20)23(29)25-8-10-31-11-9-25/h2-7,17-18,20-21,24,27H,8-13H2,1H3/t17-,18-,20+,21-/m1/s1	RQVCODLPKQRLQQ-RMVXJAJNSA-N	COc1ccc(cc1)C2=CC=C3[C@H]4N[C@H]([C@H](CO)[C@H]4CN3C2=O)C(=O)N5CCOCC5	BroadT	BRD-K17223851	BRD-K17223851-001-01-2	Broad Institute of MIT and Harvard	BRD-K17223851			COc1ccc(cc1)-c1ccc2[C@H]3N[C@H]([C@H](CO)[C@H]3Cn2c1=O)C(=O)N1CCOCC1	InChI=1S/C23H27N3O5/c1-30-15-4-2-14(3-5-15)16-6-7-19-20-17(12-26(19)22(16)28)18(13-27)21(24-20)23(29)25-8-10-31-11-9-25/h2-7,17-18,20-21,24,27H,8-13H2,1H3/t17-,18-,20+,21-/m1/s1	RQVCODLPKQRLQQ-RMVXJAJNSA-N	425.195070994							98088
CHEMBL3186779	LSM-43455	BRD-K20555710	54660729	InChI=1S/C30H32N4O3/c35-19-24-26-18-34-25(14-13-22(30(34)37)12-11-20-6-2-1-3-7-20)28(33(26)17-21-9-10-21)27(24)29(36)32-16-23-8-4-5-15-31-23/h1-8,11-15,21,24,26-28,35H,9-10,16-19H2,(H,32,36)/b12-11+/t24-,26-,27+,28+/m0/s1	PXBRKQJFGKGCEB-YDQUQSOGSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@H]([C@@H]1C(=O)NCc4ccccn4)N2CC5CC5)\C=C\c6ccccc6	BroadT	BRD-K20555710	BRD-K20555710-001-01-3	Broad Institute of MIT and Harvard	BRD-K20555710			OC[C@H]1[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]([C@@H]1C(=O)NCc1ccccn1)N2CC1CC1	InChI=1S/C30H32N4O3/c35-19-24-26-18-34-25(14-13-22(30(34)37)12-11-20-6-2-1-3-7-20)28(33(26)17-21-9-10-21)27(24)29(36)32-16-23-8-4-5-15-31-23/h1-8,11-15,21,24,26-28,35H,9-10,16-19H2,(H,32,36)/b12-11+/t24-,26-,27+,28+/m0/s1	PXBRKQJFGKGCEB-YDQUQSOGSA-N	496.247440924							
BRD-M02207845	LSM-44997		54660739	InChI=1S/C24H26FN3O4/c1-4-5-14-8-11-18-21-20(24(32)26(2)3)17(13-29)19(12-27(18)22(14)30)28(21)23(31)15-6-9-16(25)10-7-15/h4-11,17,19-21,29H,12-13H2,1-3H3/t17-,19-,20+,21+/m0/s1	QHTBDTJLVQLHTQ-MJUUVYJYSA-N	CC=CC1=CC=C2[C@@H]3[C@@H]([C@@H](CO)[C@H](CN2C1=O)N3C(=O)c4ccc(F)cc4)C(=O)N(C)C	BroadT	BRD-M02207845	BRD-M02207845-001-01-9	Broad Institute of MIT and Harvard	BRD-M02207845		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N(C)C)[C@@H]2N3C(=O)c2ccc(F)cc2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N(C)C)[C@@H]2N3C(=O)c2ccc(F)cc2)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N(C)C)[C@@H]2N3C(=O)c2ccc(F)cc2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N(C)C)[C@@H]2N3C(=O)c2ccc(F)cc2)c1=O	InChI=1S/2C24H26FN3O4/c2*1-4-5-14-8-11-18-21-20(24(32)26(2)3)17(13-29)19(12-27(18)22(14)30)28(21)23(31)15-6-9-16(25)10-7-15/h2*4-11,17,19-21,29H,12-13H2,1-3H3/b5-4+;5-4-/t2*17-,19-,20+,21+/m00/s1	MWRJRRDCKGAZGY-GGYVRXRWSA-N	439.190734542							103234
BRD-K88196769	LSM-13847		54660856	InChI=1S/C25H29N3O3/c29-15-19-21-14-27-20(6-3-7-22(27)30)24(28(21)12-16-8-9-16)23(19)25(31)26-11-10-17-4-1-2-5-18(17)13-26/h1-7,16,19,21,23-24,29H,8-15H2/t19-,21-,23+,24+/m0/s1	MQRDGSKRUJYVOI-NAMDQGSHSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)N4CCc5ccccc5C4)N2CC6CC6	BroadT	BRD-K88196769	BRD-K88196769-001-01-5	Broad Institute of MIT and Harvard	BRD-K88196769			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)N1CCc3ccccc3C1)N2CC1CC1	InChI=1S/C25H29N3O3/c29-15-19-21-14-27-20(6-3-7-22(27)30)24(28(21)12-16-8-9-16)23(19)25(31)26-11-10-17-4-1-2-5-18(17)13-26/h1-7,16,19,21,23-24,29H,8-15H2/t19-,21-,23+,24+/m0/s1	MQRDGSKRUJYVOI-NAMDQGSHSA-N	419.220891818							102498
BRD-K30456673	LSM-10265		54660886	InChI=1S/C20H26F3N3O4/c21-20(22,23)11-24-19(29)17-13(10-27)15-9-25-14(2-1-3-16(25)28)18(17)26(15)8-12-4-6-30-7-5-12/h1-3,12-13,15,17-18,27H,4-11H2,(H,24,29)/t13-,15-,17+,18+/m0/s1	JCHPDHQIJOTZMY-OXXUSNJHSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)NCC(F)(F)F)N2CC4CCOCC4	BroadT	BRD-K30456673	BRD-K30456673-001-01-7	Broad Institute of MIT and Harvard	BRD-K30456673			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NCC(F)(F)F)N2CC1CCOCC1	InChI=1S/C20H26F3N3O4/c21-20(22,23)11-24-19(29)17-13(10-27)15-9-25-14(2-1-3-16(25)28)18(17)26(15)8-12-4-6-30-7-5-12/h1-3,12-13,15,17-18,27H,4-11H2,(H,24,29)/t13-,15-,17+,18+/m0/s1	JCHPDHQIJOTZMY-OXXUSNJHSA-N	429.187540942							98886
BRD-K57579117	LSM-43482		54660797	InChI=1S/C28H36N4O4/c1-30-25-22(23(19-33)26(30)27(34)29-12-5-13-31-14-16-36-17-15-31)18-32-24(25)11-10-21(28(32)35)9-8-20-6-3-2-4-7-20/h2-4,6-11,22-23,25-26,33H,5,12-19H2,1H3,(H,29,34)/b9-8+/t22-,23-,25+,26-/m0/s1	LTCABXOBQOXXRS-SPVBLJCLSA-N	CN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]12)\C=C\c4ccccc4)C(=O)NCCCN5CCOCC5	BroadT	BRD-K57579117	BRD-K57579117-001-01-8	Broad Institute of MIT and Harvard	BRD-K57579117			CN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]12)C(=O)NCCCN1CCOCC1	InChI=1S/C28H36N4O4/c1-30-25-22(23(19-33)26(30)27(34)29-12-5-13-31-14-16-36-17-15-31)18-32-24(25)11-10-21(28(32)35)9-8-20-6-3-2-4-7-20/h2-4,6-11,22-23,25-26,33H,5,12-19H2,1H3,(H,29,34)/b9-8+/t22-,23-,25+,26-/m0/s1	LTCABXOBQOXXRS-SPVBLJCLSA-N	492.273655672							
BRD-K13183999	LSM-9219		54660867	InChI=1S/C26H33FN4O3/c1-3-10-30-23-19(20(16-32)24(30)26(34)29-13-11-28(2)12-14-29)15-31-22(23)9-8-18(25(31)33)17-6-4-5-7-21(17)27/h4-9,19-20,23-24,32H,3,10-16H2,1-2H3/t19-,20-,23+,24-/m1/s1	USYUKGCDRIQXPK-MYSJAJEPSA-N	CCCN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]12)C(=O)N5CCN(C)CC5	BroadT	BRD-K13183999	BRD-K13183999-001-01-5	Broad Institute of MIT and Harvard	BRD-K13183999			CCCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]12)C(=O)N1CCN(C)CC1	InChI=1S/C26H33FN4O3/c1-3-10-30-23-19(20(16-32)24(30)26(34)29-13-11-28(2)12-14-29)15-31-22(23)9-8-18(25(31)33)17-6-4-5-7-21(17)27/h4-9,19-20,23-24,32H,3,10-16H2,1-2H3/t19-,20-,23+,24-/m1/s1	USYUKGCDRIQXPK-MYSJAJEPSA-N	468.253669156							97840
BRD-K54219003	LSM-11727		54660653	InChI=1S/C24H20FN3O5/c25-17-6-2-1-5-14(17)15-7-8-18-21-20(24(32)33)16(12-29)19(11-27(18)23(15)31)28(21)22(30)13-4-3-9-26-10-13/h1-10,16,19-21,29H,11-12H2,(H,32,33)/t16-,19-,20+,21+/m0/s1	UZVKIEFCDOWORH-VRXWPRPYSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]([C@@H]1C(=O)O)N2C(=O)c5cccnc5	BroadT	BRD-K54219003	BRD-K54219003-001-01-1	Broad Institute of MIT and Harvard	BRD-K54219003			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]([C@@H]1C(O)=O)N2C(=O)c1cccnc1	InChI=1S/C24H20FN3O5/c25-17-6-2-1-5-14(17)15-7-8-18-21-20(24(32)33)16(12-29)19(11-27(18)23(15)31)28(21)22(30)13-4-3-9-26-10-13/h1-10,16,19-21,29H,11-12H2,(H,32,33)/t16-,19-,20+,21+/m0/s1	UZVKIEFCDOWORH-VRXWPRPYSA-N	449.13869897							100352
BRD-K26715911	LSM-10049		54660785	InChI=1S/C27H35N3O4/c1-28(2)27(33)25-22(16-31)21-15-29-23(24(21)30(25)14-17-6-4-5-7-17)13-12-20(26(29)32)18-8-10-19(34-3)11-9-18/h8-13,17,21-22,24-25,31H,4-7,14-16H2,1-3H3/t21-,22-,24+,25-/m0/s1	BQGNOLIJCHASHD-HFOXQMJASA-N	COc1ccc(cc1)C2=CC=C3[C@H]4[C@@H](CN3C2=O)[C@H](CO)[C@H](N4CC5CCCC5)C(=O)N(C)C	BroadT	BRD-K26715911	BRD-K26715911-001-01-4	Broad Institute of MIT and Harvard	BRD-K26715911			COc1ccc(cc1)-c1ccc2[C@H]3[C@@H](Cn2c1=O)[C@H](CO)[C@H](N3CC1CCCC1)C(=O)N(C)C	InChI=1S/C27H35N3O4/c1-28(2)27(33)25-22(16-31)21-15-29-23(24(21)30(25)14-17-6-4-5-7-17)13-12-20(26(29)32)18-8-10-19(34-3)11-9-18/h8-13,17,21-22,24-25,31H,4-7,14-16H2,1-3H3/t21-,22-,24+,25-/m0/s1	BQGNOLIJCHASHD-HFOXQMJASA-N	465.26275663							98670
BRD-K15958865	LSM-9383		54660996	InChI=1S/C29H31N5O3/c35-18-23-25-17-34-24(11-10-22(29(34)37)20-7-1-2-8-20)27(33(25)16-19-6-5-12-30-14-19)26(23)28(36)32-15-21-9-3-4-13-31-21/h3-7,9-14,23,25-27,35H,1-2,8,15-18H2,(H,32,36)/t23-,25-,26+,27+/m0/s1	DPJGOJUVSBIVRD-ALLMYJPZSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@H]([C@@H]1C(=O)NCc4ccccn4)N2Cc5cccnc5)C6=CCCC6	BroadT	BRD-K15958865	BRD-K15958865-001-01-9	Broad Institute of MIT and Harvard	BRD-K15958865			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]([C@@H]1C(=O)NCc1ccccn1)N2Cc1cccnc1	InChI=1S/C29H31N5O3/c35-18-23-25-17-34-24(11-10-22(29(34)37)20-7-1-2-8-20)27(33(25)16-19-6-5-12-30-14-19)26(23)28(36)32-15-21-9-3-4-13-31-21/h3-7,9-14,23,25-27,35H,1-2,8,15-18H2,(H,32,36)/t23-,25-,26+,27+/m0/s1	DPJGOJUVSBIVRD-ALLMYJPZSA-N	497.242689902							98004
BRD-K33258928	LSM-10448		54660673	InChI=1S/C23H27N3O5/c1-30-15-4-2-14(3-5-15)16-6-7-19-20-17(12-26(19)22(16)28)18(13-27)21(24-20)23(29)25-8-10-31-11-9-25/h2-7,17-18,20-21,24,27H,8-13H2,1H3/t17-,18-,20+,21-/m0/s1	RQVCODLPKQRLQQ-MMKMLUHNSA-N	COc1ccc(cc1)C2=CC=C3[C@@H]4N[C@@H]([C@@H](CO)[C@@H]4CN3C2=O)C(=O)N5CCOCC5	BroadT	BRD-K33258928	BRD-K33258928-001-01-7	Broad Institute of MIT and Harvard	BRD-K33258928			COc1ccc(cc1)-c1ccc2[C@@H]3N[C@@H]([C@@H](CO)[C@@H]3Cn2c1=O)C(=O)N1CCOCC1	InChI=1S/C23H27N3O5/c1-30-15-4-2-14(3-5-15)16-6-7-19-20-17(12-26(19)22(16)28)18(13-27)21(24-20)23(29)25-8-10-31-11-9-25/h2-7,17-18,20-21,24,27H,8-13H2,1H3/t17-,18-,20+,21-/m0/s1	RQVCODLPKQRLQQ-MMKMLUHNSA-N	425.195070994							99069
BRD-K25761622	LSM-9992		54660898	InChI=1S/C27H34N4O3S/c32-17-20-22-15-31-21(10-9-19(26(31)33)18-7-3-1-4-8-18)25(30(22)16-23-28-11-14-35-23)24(20)27(34)29-12-5-2-6-13-29/h7,9-11,14,20,22,24-25,32H,1-6,8,12-13,15-17H2/t20-,22-,24+,25+/m0/s1	FBECFQSMPRXHSL-MMTHZHQFSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@H]([C@@H]1C(=O)N4CCCCC4)N2Cc5nccs5)C6=CCCCC6	BroadT	BRD-K25761622	BRD-K25761622-001-01-9	Broad Institute of MIT and Harvard	BRD-K25761622			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]([C@@H]1C(=O)N1CCCCC1)N2Cc1nccs1	InChI=1S/C27H34N4O3S/c32-17-20-22-15-31-21(10-9-19(26(31)33)18-7-3-1-4-8-18)25(30(22)16-23-28-11-14-35-23)24(20)27(34)29-12-5-2-6-13-29/h7,9-11,14,20,22,24-25,32H,1-6,8,12-13,15-17H2/t20-,22-,24+,25+/m0/s1	FBECFQSMPRXHSL-MMTHZHQFSA-N	494.235161678							98613
BRD-K67489890	LSM-12536		54660728	InChI=1S/C26H35N3O3/c30-16-21-20-15-28-22(11-10-19(25(28)31)18-6-2-3-7-18)23(20)29(14-17-8-9-17)24(21)26(32)27-12-4-1-5-13-27/h6,10-11,17,20-21,23-24,30H,1-5,7-9,12-16H2/t20-,21-,23+,24-/m1/s1	JLGYBICAMNQLPS-CJTFWIGWSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H]2N(CC4CC4)[C@H]1C(=O)N5CCCCC5)C6=CCCC6	BroadT	BRD-K67489890	BRD-K67489890-001-01-1	Broad Institute of MIT and Harvard	BRD-K67489890			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]2N(CC2CC2)[C@H]1C(=O)N1CCCCC1	InChI=1S/C26H35N3O3/c30-16-21-20-15-28-22(11-10-19(25(28)31)18-6-2-3-7-18)23(20)29(14-17-8-9-17)24(21)26(32)27-12-4-1-5-13-27/h6,10-11,17,20-21,23-24,30H,1-5,7-9,12-16H2/t20-,21-,23+,24-/m1/s1	JLGYBICAMNQLPS-CJTFWIGWSA-N	437.26784201							101167
BRD-K92347680	LSM-14096		54660764	InChI=1S/C27H33FN4O4/c1-2-12-29-27(36)32-23-20(21(16-33)24(32)26(35)30-13-4-3-5-14-30)15-31-22(23)11-10-19(25(31)34)17-6-8-18(28)9-7-17/h6-11,20-21,23-24,33H,2-5,12-16H2,1H3,(H,29,36)/t20-,21-,23+,24-/m1/s1	VKYOLVDQZLNZRC-CJTFWIGWSA-N	CCCNC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]12)c4ccc(F)cc4)C(=O)N5CCCCC5	BroadT	BRD-K92347680	BRD-K92347680-001-01-4	Broad Institute of MIT and Harvard	BRD-K92347680			CCCNC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]12)C(=O)N1CCCCC1	InChI=1S/C27H33FN4O4/c1-2-12-29-27(36)32-23-20(21(16-33)24(32)26(35)30-13-4-3-5-14-30)15-31-22(23)11-10-19(25(31)34)17-6-8-18(28)9-7-17/h6-11,20-21,23-24,33H,2-5,12-16H2,1H3,(H,29,36)/t20-,21-,23+,24-/m1/s1	VKYOLVDQZLNZRC-CJTFWIGWSA-N	496.248583776							102750
BRD-K33341138	LSM-10453		54660960	InChI=1S/C25H30N4O4/c1-15(2)26-25(33)29-22-18(13-28-20(22)8-5-9-21(28)31)19(14-30)23(29)24(32)27-11-10-16-6-3-4-7-17(16)12-27/h3-9,15,18-19,22-23,30H,10-14H2,1-2H3,(H,26,33)/t18-,19-,22+,23-/m0/s1	GPOFJZHTSDGPCB-LBVMUVSTSA-N	CC(C)NC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]12)C(=O)N4CCc5ccccc5C4	BroadT	BRD-K33341138	BRD-K33341138-001-01-7	Broad Institute of MIT and Harvard	BRD-K33341138			CC(C)NC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]12)C(=O)N1CCc2ccccc2C1	InChI=1S/C25H30N4O4/c1-15(2)26-25(33)29-22-18(13-28-20(22)8-5-9-21(28)31)19(14-30)23(29)24(32)27-11-10-16-6-3-4-7-17(16)12-27/h3-9,15,18-19,22-23,30H,10-14H2,1-2H3,(H,26,33)/t18-,19-,22+,23-/m0/s1	GPOFJZHTSDGPCB-LBVMUVSTSA-N	450.22670548							99074
BRD-K52719892	LSM-11647		54660978	InChI=1S/C25H31FN4O4/c1-15(32)30-22-19(20(14-31)23(30)24(33)27-10-5-11-28(2)3)13-29-21(22)9-8-18(25(29)34)16-6-4-7-17(26)12-16/h4,6-9,12,19-20,22-23,31H,5,10-11,13-14H2,1-3H3,(H,27,33)/t19-,20-,22+,23-/m1/s1	KVNOQKWAHHZEJM-YXPKMTABSA-N	CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@H]2N1C(=O)C	BroadT	BRD-K52719892	BRD-K52719892-001-01-6	Broad Institute of MIT and Harvard	BRD-K52719892			CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]2N1C(C)=O	InChI=1S/C25H31FN4O4/c1-15(32)30-22-19(20(14-31)23(30)24(33)27-10-5-11-28(2)3)13-29-21(22)9-8-18(25(29)34)16-6-4-7-17(26)12-16/h4,6-9,12,19-20,22-23,31H,5,10-11,13-14H2,1-3H3,(H,27,33)/t19-,20-,22+,23-/m1/s1	KVNOQKWAHHZEJM-YXPKMTABSA-N	470.232933712							100272
BRD-K39892211	LSM-10859		54661023	InChI=1S/C25H24FN3O4/c1-33-25(32)23-19(14-30)18-13-28-21(22(18)29(23)12-15-8-10-27-11-9-15)7-6-17(24(28)31)16-4-2-3-5-20(16)26/h2-11,18-19,22-23,30H,12-14H2,1H3/t18-,19-,22+,23-/m0/s1	SOHXSUHWQBDTJV-LBVMUVSTSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]2N1Cc5ccncc5	BroadT	BRD-K39892211	BRD-K39892211-001-01-3	Broad Institute of MIT and Harvard	BRD-K39892211			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]2N1Cc1ccncc1	InChI=1S/C25H24FN3O4/c1-33-25(32)23-19(14-30)18-13-28-21(22(18)29(23)12-15-8-10-27-11-9-15)7-6-17(24(28)31)16-4-2-3-5-20(16)26/h2-11,18-19,22-23,30H,12-14H2,1H3/t18-,19-,22+,23-/m0/s1	SOHXSUHWQBDTJV-LBVMUVSTSA-N	449.175084478							99480
BRD-M03805540	LSM-44998		54660927	InChI=1S/C27H33N3O3/c1-2-8-19-13-14-23-24-21(16-29(23)27(19)33)22(17-31)25(30(24)15-18-9-6-7-10-18)26(32)28-20-11-4-3-5-12-20/h2-5,8,11-14,18,21-22,24-25,31H,6-7,9-10,15-17H2,1H3,(H,28,32)/t21-,22-,24+,25-/m1/s1	QEPNFHJXKIVVNT-YQIMAOPZSA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3CC4CCCC4)C(=O)Nc5ccccc5	BroadT	BRD-M03805540	BRD-M03805540-001-01-7	Broad Institute of MIT and Harvard	BRD-M03805540		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)Nc4ccccc4)N(CC4CCCC4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)Nc4ccccc4)N(CC4CCCC4)[C@H]23)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)Nc4ccccc4)N(CC4CCCC4)[C@H]23)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)Nc4ccccc4)N(CC4CCCC4)[C@H]23)c1=O	InChI=1S/2C27H33N3O3/c2*1-2-8-19-13-14-23-24-21(16-29(23)27(19)33)22(17-31)25(30(24)15-18-9-6-7-10-18)26(32)28-20-11-4-3-5-12-20/h2*2-5,8,11-14,18,21-22,24-25,31H,6-7,9-10,15-17H2,1H3,(H,28,32)/b8-2+;8-2-/t2*21-,22-,24+,25-/m11/s1	JGMZPIIESMRTQR-ZIUDJAMWSA-N	447.252191946							103235
BRD-K86291677	LSM-13713		54660657	InChI=1S/C27H33N3O4/c1-28(2)27(33)24-20(16-31)22-15-30-21(13-12-19(26(30)32)17-8-4-5-9-17)25(24)29(22)14-18-10-6-7-11-23(18)34-3/h6-8,10-13,20,22,24-25,31H,4-5,9,14-16H2,1-3H3/t20-,22-,24+,25+/m1/s1	CAYQEZITEZQLOQ-KAKDDGLXSA-N	COc1ccccc1CN2[C@@H]3CN4C(=CC=C(C5=CCCC5)C4=O)[C@H]2[C@H]([C@@H]3CO)C(=O)N(C)C	BroadT	BRD-K86291677	BRD-K86291677-001-01-7	Broad Institute of MIT and Harvard	BRD-K86291677			COc1ccccc1CN1[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)N(C)C	InChI=1S/C27H33N3O4/c1-28(2)27(33)24-20(16-31)22-15-30-21(13-12-19(26(30)32)17-8-4-5-9-17)25(24)29(22)14-18-10-6-7-11-23(18)34-3/h6-8,10-13,20,22,24-25,31H,4-5,9,14-16H2,1-3H3/t20-,22-,24+,25+/m1/s1	CAYQEZITEZQLOQ-KAKDDGLXSA-N	463.247106566							102361
BRD-M04224464	LSM-45000		54660937	InChI=1S/C22H29N3O4/c1-3-5-14-8-9-17-19-15(11-24(17)22(14)29)16(12-26)20(21(28)23-4-2)25(19)18(27)10-13-6-7-13/h3,5,8-9,13,15-16,19-20,26H,4,6-7,10-12H2,1-2H3,(H,23,28)/t15-,16-,19+,20-/m0/s1	HKPODECSJAYGRS-FEHORTKBSA-N	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N1C(=O)CC4CC4)C=CC	BroadT	BRD-M04224464	BRD-M04224464-001-01-2	Broad Institute of MIT and Harvard	BRD-M04224464		CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@@H]2N1C(=O)CC1CC1)\C=C\C.CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@@H]2N1C(=O)CC1CC1)\C=C/C	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@@H]2N1C(=O)CC1CC1)\C=C\C.CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(=O)c(ccc3[C@@H]2N1C(=O)CC1CC1)\C=C/C	InChI=1S/2C22H29N3O4/c2*1-3-5-14-8-9-17-19-15(11-24(17)22(14)29)16(12-26)20(21(28)23-4-2)25(19)18(27)10-13-6-7-13/h2*3,5,8-9,13,15-16,19-20,26H,4,6-7,10-12H2,1-2H3,(H,23,28)/b5-3+;5-3-/t2*15-,16-,19+,20-/m00/s1	WJPBQSJCBLTDGD-TWHSYTAYSA-N	399.215806438							103237
BRD-K56327795	LSM-11836		54660887	InChI=1S/C20H26F3N3O4/c21-20(22,23)11-24-19(29)17-13(10-27)15-9-25-14(2-1-3-16(25)28)18(17)26(15)8-12-4-6-30-7-5-12/h1-3,12-13,15,17-18,27H,4-11H2,(H,24,29)/t13-,15-,17+,18+/m1/s1	JCHPDHQIJOTZMY-WCZJQEMASA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)NCC(F)(F)F)N2CC4CCOCC4	BroadT	BRD-K56327795	BRD-K56327795-001-01-2	Broad Institute of MIT and Harvard	BRD-K56327795			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NCC(F)(F)F)N2CC1CCOCC1	InChI=1S/C20H26F3N3O4/c21-20(22,23)11-24-19(29)17-13(10-27)15-9-25-14(2-1-3-16(25)28)18(17)26(15)8-12-4-6-30-7-5-12/h1-3,12-13,15,17-18,27H,4-11H2,(H,24,29)/t13-,15-,17+,18+/m1/s1	JCHPDHQIJOTZMY-WCZJQEMASA-N	429.187540942							131203
BRD-K81476029	LSM-13403		54660836	InChI=1S/C25H25F2N5O3/c1-30(2)25(35)23-19(12-33)18-11-31-21(6-4-17(24(31)34)15-8-28-13-29-9-15)22(18)32(23)10-14-7-16(26)3-5-20(14)27/h3-9,13,18-19,22-23,33H,10-12H2,1-2H3/t18-,19-,22+,23-/m1/s1	GNOSXJXTVJBPTF-PJIZGREPSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@H]2N1Cc5cc(F)ccc5F	BroadT	BRD-K81476029	BRD-K81476029-001-01-4	Broad Institute of MIT and Harvard	BRD-K81476029			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@H]2N1Cc1cc(F)ccc1F	InChI=1S/C25H25F2N5O3/c1-30(2)25(35)23-19(12-33)18-11-31-21(6-4-17(24(31)34)15-8-28-13-29-9-15)22(18)32(23)10-14-7-16(26)3-5-20(14)27/h3-9,13,18-19,22-23,33H,10-12H2,1-2H3/t18-,19-,22+,23-/m1/s1	GNOSXJXTVJBPTF-PJIZGREPSA-N	481.19254611							102043
BRD-K15679280	LSM-9366		54660831	InChI=1S/C28H36N4O4/c1-30(2)14-6-13-29-27(35)25-21(17-33)23-16-31-22(26(25)32(23)24(34)15-18-9-10-18)12-11-20(28(31)36)19-7-4-3-5-8-19/h3-5,7-8,11-12,18,21,23,25-26,33H,6,9-10,13-17H2,1-2H3,(H,29,35)/t21-,23-,25+,26+/m1/s1	ZADPRABAISSLKD-KUSCKROYSA-N	CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@@H]1N2C(=O)CC5CC5	BroadT	BRD-K15679280	BRD-K15679280-001-01-8	Broad Institute of MIT and Harvard	BRD-K15679280			CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]1N2C(=O)CC1CC1	InChI=1S/C28H36N4O4/c1-30(2)14-6-13-29-27(35)25-21(17-33)23-16-31-22(26(25)32(23)24(34)15-18-9-10-18)12-11-20(28(31)36)19-7-4-3-5-8-19/h3-5,7-8,11-12,18,21,23,25-26,33H,6,9-10,13-17H2,1-2H3,(H,29,35)/t21-,23-,25+,26+/m1/s1	ZADPRABAISSLKD-KUSCKROYSA-N	492.273655672							97987
BRD-K22177698	LSM-9771		54660693	InChI=1S/C21H24N4O4S/c26-11-13-15-10-24-14(6-3-7-16(24)27)18(25(15)20(29)12-4-1-2-5-12)17(13)19(28)23-21-22-8-9-30-21/h3,6-9,12-13,15,17-18,26H,1-2,4-5,10-11H2,(H,22,23,28)/t13-,15-,17+,18+/m1/s1	WZQJIBXYFKEECF-WCZJQEMASA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)Nc4nccs4)N2C(=O)C5CCCC5	BroadT	BRD-K22177698	BRD-K22177698-001-01-0	Broad Institute of MIT and Harvard	BRD-K22177698			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)Nc1nccs1)N2C(=O)C1CCCC1	InChI=1S/C21H24N4O4S/c26-11-13-15-10-24-14(6-3-7-16(24)27)18(25(15)20(29)12-4-1-2-5-12)17(13)19(28)23-21-22-8-9-30-21/h3,6-9,12-13,15,17-18,26H,1-2,4-5,10-11H2,(H,22,23,28)/t13-,15-,17+,18+/m1/s1	WZQJIBXYFKEECF-WCZJQEMASA-N	428.151825978							98392
BRD-K93906979	LSM-14189		54661021	InChI=1S/C28H29N3O3/c1-29-25-22(16-31-24(25)12-11-21(27(31)33)19-8-3-2-4-9-19)23(17-32)26(29)28(34)30-14-13-18-7-5-6-10-20(18)15-30/h2-12,22-23,25-26,32H,13-17H2,1H3/t22-,23-,25+,26-/m1/s1	YSTNLTHHZDJVRS-VHCQPULKSA-N	CN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@@H]12)C(=O)N5CCc6ccccc6C5	BroadT	BRD-K93906979	BRD-K93906979-001-01-6	Broad Institute of MIT and Harvard	BRD-K93906979			CN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]12)C(=O)N1CCc2ccccc2C1	InChI=1S/C28H29N3O3/c1-29-25-22(16-31-24(25)12-11-21(27(31)33)19-8-3-2-4-9-19)23(17-32)26(29)28(34)30-14-13-18-7-5-6-10-20(18)15-30/h2-12,22-23,25-26,32H,13-17H2,1H3/t22-,23-,25+,26-/m1/s1	YSTNLTHHZDJVRS-VHCQPULKSA-N	455.220891818							102843
BRD-K86758801	LSM-13745		54660745	InChI=1S/C19H19FN2O4/c1-26-19(25)16-12(9-23)14-8-22-15(17(16)21-14)7-6-11(18(22)24)10-4-2-3-5-13(10)20/h2-7,12,14,16-17,21,23H,8-9H2,1H3/t12-,14-,16+,17+/m0/s1	NXPHSKBMFHKARG-GUDXXQAFSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]1N2	BroadT	BRD-K86758801	BRD-K86758801-001-01-4	Broad Institute of MIT and Harvard	BRD-K86758801			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]1N2	InChI=1S/C19H19FN2O4/c1-26-19(25)16-12(9-23)14-8-22-15(17(16)21-14)7-6-11(18(22)24)10-4-2-3-5-13(10)20/h2-7,12,14,16-17,21,23H,8-9H2,1H3/t12-,14-,16+,17+/m0/s1	NXPHSKBMFHKARG-GUDXXQAFSA-N	358.132885308							102394
BRD-K26511533	LSM-10034		54660648	InChI=1S/C21H23N3O3/c25-11-16-15-10-24-17(6-3-7-18(24)26)19(15)23-20(16)21(27)22-14-8-12-4-1-2-5-13(12)9-14/h1-7,14-16,19-20,23,25H,8-11H2,(H,22,27)/t15-,16-,19+,20-/m0/s1	WRJPWVKEXURTAG-FEHORTKBSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N[C@@H]1C(=O)NC4Cc5ccccc5C4	BroadT	BRD-K26511533	BRD-K26511533-001-01-5	Broad Institute of MIT and Harvard	BRD-K26511533			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N[C@@H]1C(=O)NC1Cc2ccccc2C1	InChI=1S/C21H23N3O3/c25-11-16-15-10-24-17(6-3-7-18(24)26)19(15)23-20(16)21(27)22-14-8-12-4-1-2-5-13(12)9-14/h1-7,14-16,19-20,23,25H,8-11H2,(H,22,27)/t15-,16-,19+,20-/m0/s1	WRJPWVKEXURTAG-FEHORTKBSA-N	365.173941626							98655
BRD-K23781896	LSM-9865		54660897	InChI=1S/C27H34N4O3S/c32-17-20-22-15-31-21(10-9-19(26(31)33)18-7-3-1-4-8-18)25(30(22)16-23-28-11-14-35-23)24(20)27(34)29-12-5-2-6-13-29/h7,9-11,14,20,22,24-25,32H,1-6,8,12-13,15-17H2/t20-,22-,24+,25+/m1/s1	FBECFQSMPRXHSL-KAKDDGLXSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@@H]([C@H]1C(=O)N4CCCCC4)N2Cc5nccs5)C6=CCCCC6	BroadT	BRD-K23781896	BRD-K23781896-001-01-8	Broad Institute of MIT and Harvard	BRD-K23781896			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]([C@H]1C(=O)N1CCCCC1)N2Cc1nccs1	InChI=1S/C27H34N4O3S/c32-17-20-22-15-31-21(10-9-19(26(31)33)18-7-3-1-4-8-18)25(30(22)16-23-28-11-14-35-23)24(20)27(34)29-12-5-2-6-13-29/h7,9-11,14,20,22,24-25,32H,1-6,8,12-13,15-17H2/t20-,22-,24+,25+/m1/s1	FBECFQSMPRXHSL-KAKDDGLXSA-N	494.235161678							98486
BRD-K19917828	LSM-9635		54661017	InChI=1S/C25H28N6O3S/c32-13-19-18-12-30-20(6-5-17(24(30)34)16-9-26-14-27-10-16)21(18)31(11-15-3-1-2-4-15)22(19)23(33)29-25-28-7-8-35-25/h5-10,14-15,18-19,21-22,32H,1-4,11-13H2,(H,28,29,33)/t18-,19-,21+,22-/m1/s1	HGHULLBDNZJMJU-KRXUUXHPSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@H]2N(CC5CCCC5)[C@H]1C(=O)Nc6nccs6	BroadT	BRD-K19917828	BRD-K19917828-001-01-7	Broad Institute of MIT and Harvard	BRD-K19917828			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@H]2N(CC2CCCC2)[C@H]1C(=O)Nc1nccs1	InChI=1S/C25H28N6O3S/c32-13-19-18-12-30-20(6-5-17(24(30)34)16-9-26-14-27-10-16)21(18)31(11-15-3-1-2-4-15)22(19)23(33)29-25-28-7-8-35-25/h5-10,14-15,18-19,21-22,32H,1-4,11-13H2,(H,28,29,33)/t18-,19-,21+,22-/m1/s1	HGHULLBDNZJMJU-KRXUUXHPSA-N	492.194359506							98256
BRD-K05323441	LSM-8744		54660699	InChI=1S/C23H26F3N3O3/c1-14(15-6-3-2-4-7-15)27-22(32)20-16(13-30)18-12-29-17(8-5-9-19(29)31)21(20)28(18)11-10-23(24,25)26/h2-9,14,16,18,20-21,30H,10-13H2,1H3,(H,27,32)/t14-,16-,18-,20+,21+/m1/s1	LOVSINJIWNBKBE-GROZNQBWSA-N	C[C@@H](NC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]1N2CCC(F)(F)F)c4ccccc4	BroadT	BRD-K05323441	BRD-K05323441-001-01-1	Broad Institute of MIT and Harvard	BRD-K05323441			C[C@@H](NC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2CCC(F)(F)F)c1ccccc1	InChI=1S/C23H26F3N3O3/c1-14(15-6-3-2-4-7-15)27-22(32)20-16(13-30)18-12-29-17(8-5-9-19(29)31)21(20)28(18)11-10-23(24,25)26/h2-9,14,16,18,20-21,30H,10-13H2,1H3,(H,27,32)/t14-,16-,18-,20+,21+/m1/s1	LOVSINJIWNBKBE-GROZNQBWSA-N	449.192626322							97365
BRD-M33077182	LSM-45027		54660845	InChI=1S/C26H32N4O3/c1-2-8-18-10-11-21-24-23(26(33)28-13-6-3-7-14-28)20(17-31)22(16-30(21)25(18)32)29(24)15-19-9-4-5-12-27-19/h2,4-5,8-12,20,22-24,31H,3,6-7,13-17H2,1H3/t20-,22-,23+,24+/m0/s1	ARIBYWLZPORNAU-IQFVJIFQSA-N	CC=CC1=CC=C2[C@@H]3[C@@H]([C@@H](CO)[C@H](CN2C1=O)N3Cc4ccccn4)C(=O)N5CCCCC5	BroadT	BRD-M33077182	BRD-M33077182-001-01-0	Broad Institute of MIT and Harvard	BRD-M33077182		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N4CCCCC4)[C@@H]2N3Cc2ccccn2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N4CCCCC4)[C@@H]2N3Cc2ccccn2)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N4CCCCC4)[C@@H]2N3Cc2ccccn2)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N4CCCCC4)[C@@H]2N3Cc2ccccn2)c1=O	InChI=1S/2C26H32N4O3/c2*1-2-8-18-10-11-21-24-23(26(33)28-13-6-3-7-14-28)20(17-31)22(16-30(21)25(18)32)29(24)15-19-9-4-5-12-27-19/h2*2,4-5,8-12,20,22-24,31H,3,6-7,13-17H2,1H3/b8-2+;8-2-/t2*20-,22-,23+,24+/m00/s1	DZORKODRLHXEMH-IXJFYMQMSA-N	448.247440924							103264
BRD-K20428479	LSM-9674		54660710	InChI=1S/C22H23FN2O5/c1-3-18(27)25-17-10-24-16(20(25)19(15(17)11-26)22(29)30-2)9-8-14(21(24)28)12-4-6-13(23)7-5-12/h4-9,15,17,19-20,26H,3,10-11H2,1-2H3/t15-,17-,19+,20+/m1/s1	HISNYEFWMKAJQA-BEKAIBRUSA-N	CCC(=O)N1[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]1[C@H]([C@@H]2CO)C(=O)OC	BroadT	BRD-K20428479	BRD-K20428479-001-01-4	Broad Institute of MIT and Harvard	BRD-K20428479			CCC(=O)N1[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)OC	InChI=1S/C22H23FN2O5/c1-3-18(27)25-17-10-24-16(20(25)19(15(17)11-26)22(29)30-2)9-8-14(21(24)28)12-4-6-13(23)7-5-12/h4-9,15,17,19-20,26H,3,10-11H2,1-2H3/t15-,17-,19+,20+/m1/s1	HISNYEFWMKAJQA-BEKAIBRUSA-N	414.159100056							98295
BRD-K93876350	LSM-14186		54660783	InChI=1S/C26H27N3O4/c1-28-22-14-29-21(13-12-19(26(29)32)16-8-10-18(33-2)11-9-16)24(28)23(20(22)15-30)25(31)27-17-6-4-3-5-7-17/h3-13,20,22-24,30H,14-15H2,1-2H3,(H,27,31)/t20-,22-,23+,24+/m0/s1	NFYJHTUTLOTQBL-IQFVJIFQSA-N	COc1ccc(cc1)C2=CC=C3[C@@H]4[C@@H]([C@@H](CO)[C@H](CN3C2=O)N4C)C(=O)Nc5ccccc5	BroadT	BRD-K93876350	BRD-K93876350-001-01-0	Broad Institute of MIT and Harvard	BRD-K93876350			COc1ccc(cc1)-c1ccc2[C@@H]3[C@@H]([C@@H](CO)[C@H](Cn2c1=O)N3C)C(=O)Nc1ccccc1	InChI=1S/C26H27N3O4/c1-28-22-14-29-21(13-12-19(26(29)32)16-8-10-18(33-2)11-9-16)24(28)23(20(22)15-30)25(31)27-17-6-4-3-5-7-17/h3-13,20,22-24,30H,14-15H2,1-2H3,(H,27,31)/t20-,22-,23+,24+/m0/s1	NFYJHTUTLOTQBL-IQFVJIFQSA-N	445.200156374							102840
BRD-K97173328	LSM-14400		54660727	InChI=1S/C26H35N3O3/c30-16-21-20-15-28-22(11-10-19(25(28)31)18-6-2-3-7-18)23(20)29(14-17-8-9-17)24(21)26(32)27-12-4-1-5-13-27/h6,10-11,17,20-21,23-24,30H,1-5,7-9,12-16H2/t20-,21-,23+,24-/m0/s1	JLGYBICAMNQLPS-ZQRMPTRQSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N(CC4CC4)[C@@H]1C(=O)N5CCCCC5)C6=CCCC6	BroadT	BRD-K97173328	BRD-K97173328-001-01-7	Broad Institute of MIT and Harvard	BRD-K97173328			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]2N(CC2CC2)[C@@H]1C(=O)N1CCCCC1	InChI=1S/C26H35N3O3/c30-16-21-20-15-28-22(11-10-19(25(28)31)18-6-2-3-7-18)23(20)29(14-17-8-9-17)24(21)26(32)27-12-4-1-5-13-27/h6,10-11,17,20-21,23-24,30H,1-5,7-9,12-16H2/t20-,21-,23+,24-/m0/s1	JLGYBICAMNQLPS-ZQRMPTRQSA-N	437.26784201							103054
MLS005000169	LSM-28118	BRD-K14217441	54660665	InChI=1S/C25H31N5O4S/c1-28(2)13-20(32)30-21-17(18(14-31)22(30)23(33)27-25-26-10-11-35-25)12-29-19(21)9-8-16(24(29)34)15-6-4-3-5-7-15/h6,8-11,17-18,21-22,31H,3-5,7,12-14H2,1-2H3,(H,26,27,33)/t17-,18-,21+,22-/m0/s1	ZANSJMBDKCDFCX-HXHBTQRASA-N	CN(C)CC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C4=CCCCC4)C3=O)[C@H]12)C(=O)Nc5nccs5	BroadT	BRD-K14217441	BRD-K14217441-001-01-4	Broad Institute of MIT and Harvard	BRD-K14217441			CN(C)CC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]12)C(=O)Nc1nccs1	InChI=1S/C25H31N5O4S/c1-28(2)13-20(32)30-21-17(18(14-31)22(30)23(33)27-25-26-10-11-35-25)12-29-19(21)9-8-16(24(29)34)15-6-4-3-5-7-15/h6,8-11,17-18,21-22,31H,3-5,7,12-14H2,1-2H3,(H,26,27,33)/t17-,18-,21+,22-/m0/s1	ZANSJMBDKCDFCX-HXHBTQRASA-N	497.209675212							116663
BRD-K66480544	LSM-12477		54661013	InChI=1S/C28H32N4O4/c33-16-23-22-15-31-24(7-4-8-25(31)34)26(22)32(14-21-17-36-18-29-21)27(23)28(35)30-11-9-20(10-12-30)13-19-5-2-1-3-6-19/h1-8,17-18,20,22-23,26-27,33H,9-16H2/t22-,23-,26+,27-/m1/s1	YCNDEIYRXZASMY-JUIYCPNDSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N(Cc4cocn4)[C@H]1C(=O)N5CCC(Cc6ccccc6)CC5	BroadT	BRD-K66480544	BRD-K66480544-001-01-1	Broad Institute of MIT and Harvard	BRD-K66480544			OC[C@@H]1[C@H]2Cn3c(=O)cccc3[C@H]2N(Cc2ncoc2)[C@H]1C(=O)N1CCC(CC1)Cc1ccccc1	InChI=1S/C28H32N4O4/c33-16-23-22-15-31-24(7-4-8-25(31)34)26(22)32(14-21-17-36-18-29-21)27(23)28(35)30-11-9-20(10-12-30)13-19-5-2-1-3-6-19/h1-8,17-18,20,22-23,26-27,33H,9-16H2/t22-,23-,26+,27-/m1/s1	YCNDEIYRXZASMY-JUIYCPNDSA-N	488.242355544							101108
BRD-K03346718	LSM-8641		54660766	InChI=1S/C25H25N3O6S/c1-15-6-3-4-8-21(15)35(32,33)28-20-13-27-19(23(28)22(18(20)14-29)25(31)34-2)10-9-17(24(27)30)16-7-5-11-26-12-16/h3-12,18,20,22-23,29H,13-14H2,1-2H3/t18-,20-,22+,23+/m0/s1	IMWJJLFBFPCGES-NEKRIBJYSA-N	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]1N2S(=O)(=O)c5ccccc5C	BroadT	BRD-K03346718	BRD-K03346718-001-01-0	Broad Institute of MIT and Harvard	BRD-K03346718			COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]1N2S(=O)(=O)c1ccccc1C	InChI=1S/C25H25N3O6S/c1-15-6-3-4-8-21(15)35(32,33)28-20-13-27-19(23(28)22(18(20)14-29)25(31)34-2)10-9-17(24(27)30)16-7-5-11-26-12-16/h3-12,18,20,22-23,29H,13-14H2,1-2H3/t18-,20-,22+,23+/m0/s1	IMWJJLFBFPCGES-NEKRIBJYSA-N	495.14640624							97262
BRD-K68844146	LSM-12630		54660824	InChI=1S/C26H25FN2O5/c1-34-17-7-4-6-15(11-17)18-9-10-21-24-23(26(32)33)19(14-30)22(13-29(21)25(18)31)28(24)12-16-5-2-3-8-20(16)27/h2-11,19,22-24,30H,12-14H2,1H3,(H,32,33)/t19-,22-,23+,24+/m1/s1	MDNKBVDDURCBLA-JFTIXFDTSA-N	COc1cccc(c1)C2=CC=C3[C@H]4[C@H]([C@H](CO)[C@@H](CN3C2=O)N4Cc5ccccc5F)C(=O)O	BroadT	BRD-K68844146	BRD-K68844146-001-01-8	Broad Institute of MIT and Harvard	BRD-K68844146			COc1cccc(c1)-c1ccc2[C@H]3[C@H]([C@H](CO)[C@@H](Cn2c1=O)N3Cc1ccccc1F)C(O)=O	InChI=1S/C26H25FN2O5/c1-34-17-7-4-6-15(11-17)18-9-10-21-24-23(26(32)33)19(14-30)22(13-29(21)25(18)31)28(24)12-16-5-2-3-8-20(16)27/h2-11,19,22-24,30H,12-14H2,1H3,(H,32,33)/t19-,22-,23+,24+/m1/s1	MDNKBVDDURCBLA-JFTIXFDTSA-N	464.17475012							101263
BRD-K76276139	LSM-13094		54660999	InChI=1S/C27H37N5O4/c1-2-11-31-24-21(17-32-23(24)5-4-20(27(32)35)19-6-9-28-10-7-19)22(18-33)25(31)26(34)29-8-3-12-30-13-15-36-16-14-30/h4-7,9-10,21-22,24-25,33H,2-3,8,11-18H2,1H3,(H,29,34)/t21-,22-,24+,25-/m1/s1	DECXYAQNRLUUJQ-YQIMAOPZSA-N	CCCN1[C@H]([C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]12)c4ccncc4)C(=O)NCCCN5CCOCC5	BroadT	BRD-K76276139	BRD-K76276139-001-01-2	Broad Institute of MIT and Harvard	BRD-K76276139			CCCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]12)C(=O)NCCCN1CCOCC1	InChI=1S/C27H37N5O4/c1-2-11-31-24-21(17-32-23(24)5-4-20(27(32)35)19-6-9-28-10-7-19)22(18-33)25(31)26(34)29-8-3-12-30-13-15-36-16-14-30/h4-7,9-10,21-22,24-25,33H,2-3,8,11-18H2,1H3,(H,29,34)/t21-,22-,24+,25-/m1/s1	DECXYAQNRLUUJQ-YQIMAOPZSA-N	495.284554714							101732
BRD-K13649454	LSM-9251		54660973	InChI=1S/C21H25N3O5S/c1-13(14-7-4-3-5-8-14)22-21(27)20-16(12-25)15-11-23-17(9-6-10-18(23)26)19(15)24(20)30(2,28)29/h3-10,13,15-16,19-20,25H,11-12H2,1-2H3,(H,22,27)/t13-,15+,16+,19-,20+/m1/s1	LURAPRBVZDLHCY-NPACWLSJSA-N	C[C@@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N1S(=O)(=O)C)c4ccccc4	BroadT	BRD-K13649454	BRD-K13649454-001-01-3	Broad Institute of MIT and Harvard	BRD-K13649454			C[C@@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@@H]2N1S(C)(=O)=O)c1ccccc1	InChI=1S/C21H25N3O5S/c1-13(14-7-4-3-5-8-14)22-21(27)20-16(12-25)15-11-23-17(9-6-10-18(23)26)19(15)24(20)30(2,28)29/h3-10,13,15-16,19-20,25H,11-12H2,1-2H3,(H,22,27)/t13-,15+,16+,19-,20+/m1/s1	LURAPRBVZDLHCY-NPACWLSJSA-N	431.15149162							97872
BRD-K81365479	LSM-13396		54596116	InChI=1S/C22H27N3O6S/c1-14-6-3-4-8-18(14)32(29,30)25-17-12-24-16(7-5-9-19(24)27)21(25)20(15(17)13-26)22(28)23-10-11-31-2/h3-9,15,17,20-21,26H,10-13H2,1-2H3,(H,23,28)/t15-,17-,20+,21+/m1/s1	MTAIFDHMXJWVCS-SLWXAUBPSA-N	COCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]1N2S(=O)(=O)c4ccccc4C	BroadT	BRD-K81365479	BRD-K81365479-001-01-4	Broad Institute of MIT and Harvard	BRD-K81365479			COCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2S(=O)(=O)c1ccccc1C	InChI=1S/C22H27N3O6S/c1-14-6-3-4-8-18(14)32(29,30)25-17-12-24-16(7-5-9-19(24)27)21(25)20(15(17)13-26)22(28)23-10-11-31-2/h3-9,15,17,20-21,26H,10-13H2,1-2H3,(H,23,28)/t15-,17-,20+,21+/m1/s1	MTAIFDHMXJWVCS-SLWXAUBPSA-N	461.162056304							102036
BRD-K35801103	LSM-10577		54661002	InChI=1S/C29H30N4O4/c34-17-23-22-16-32-24(9-8-21(29(32)37)19-4-2-1-3-5-19)25(22)33(28(36)20-6-7-20)26(23)27(35)31-15-12-18-10-13-30-14-11-18/h1-5,8-11,13-14,20,22-23,25-26,34H,6-7,12,15-17H2,(H,31,35)/t22-,23-,25+,26-/m1/s1	OYSHQHUZVWGKJD-VHCQPULKSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@H]2N([C@H]1C(=O)NCCc5ccncc5)C(=O)C6CC6	BroadT	BRD-K35801103	BRD-K35801103-001-01-9	Broad Institute of MIT and Harvard	BRD-K35801103			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]2N([C@H]1C(=O)NCCc1ccncc1)C(=O)C1CC1	InChI=1S/C29H30N4O4/c34-17-23-22-16-32-24(9-8-21(29(32)37)19-4-2-1-3-5-19)25(22)33(28(36)20-6-7-20)26(23)27(35)31-15-12-18-10-13-30-14-11-18/h1-5,8-11,13-14,20,22-23,25-26,34H,6-7,12,15-17H2,(H,31,35)/t22-,23-,25+,26-/m1/s1	OYSHQHUZVWGKJD-VHCQPULKSA-N	498.22670548							99198
CHEMBL2361657	LSM-45085	BRD-M94242351	54660659	InChI=1S/C28H31N3O4/c1-2-5-18-10-11-23-24-21(15-30(23)26(18)33)22(16-32)25(31(24)27(34)19-8-9-19)28(35)29-13-12-17-6-3-4-7-20(17)14-29/h2-7,10-11,19,21-22,24-25,32H,8-9,12-16H2,1H3/t21-,22-,24+,25-/m0/s1	KWDFMNKBUPRJCJ-HFOXQMJASA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3C(=O)C4CC4)C(=O)N5CCc6ccccc6C5	BroadT	BRD-M94242351	BRD-M94242351-001-01-1	Broad Institute of MIT and Harvard	BRD-M94242351		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N4CCc5ccccc5C4)N(C(=O)C4CC4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N4CCc5ccccc5C4)N(C(=O)C4CC4)[C@@H]23)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N4CCc5ccccc5C4)N(C(=O)C4CC4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N4CCc5ccccc5C4)N(C(=O)C4CC4)[C@@H]23)c1=O	InChI=1S/2C28H31N3O4/c2*1-2-5-18-10-11-23-24-21(15-30(23)26(18)33)22(16-32)25(31(24)27(34)19-8-9-19)28(35)29-13-12-17-6-3-4-7-20(17)14-29/h2*2-7,10-11,19,21-22,24-25,32H,8-9,12-16H2,1H3/b5-2+;5-2-/t2*21-,22-,24+,25-/m00/s1	LXQGCCZCUUVADU-YARPSLNSSA-N	473.231456502							103322
BRD-K16009699	LSM-9390		54660865	InChI=1S/C24H29N3O6S/c1-33-20-6-4-3-5-15(20)16-9-10-19-21-17(12-26(19)24(16)30)18(13-28)22(27(21)34(2,31)32)23(29)25-11-14-7-8-14/h3-6,9-10,14,17-18,21-22,28H,7-8,11-13H2,1-2H3,(H,25,29)/t17-,18-,21+,22-/m0/s1	WJZKQLYLFQXOJV-HXHBTQRASA-N	COc1ccccc1C2=CC=C3[C@H]4[C@@H](CN3C2=O)[C@H](CO)[C@H](N4S(=O)(=O)C)C(=O)NCC5CC5	BroadT	BRD-K16009699	BRD-K16009699-001-01-2	Broad Institute of MIT and Harvard	BRD-K16009699			COc1ccccc1-c1ccc2[C@H]3[C@@H](Cn2c1=O)[C@H](CO)[C@H](N3S(C)(=O)=O)C(=O)NCC1CC1	InChI=1S/C24H29N3O6S/c1-33-20-6-4-3-5-15(20)16-9-10-19-21-17(12-26(19)24(16)30)18(13-28)22(27(21)34(2,31)32)23(29)25-11-14-7-8-14/h3-6,9-10,14,17-18,21-22,28H,7-8,11-13H2,1-2H3,(H,25,29)/t17-,18-,21+,22-/m0/s1	WJZKQLYLFQXOJV-HXHBTQRASA-N	487.177706368							98011
BRD-M31016039	LSM-45022		54660812	InChI=1S/C25H24F2N4O3S/c1-2-3-14-4-7-20-21-17(12-30(20)24(14)34)18(13-32)22(23(33)29-25-28-8-9-35-25)31(21)11-15-10-16(26)5-6-19(15)27/h2-10,17-18,21-22,32H,11-13H2,1H3,(H,28,29,33)/t17-,18-,21+,22-/m1/s1	ZDIAMMWGBAVDPO-RPHTVSPISA-N	CC=CC1=CC=C2[C@@H]3[C@H](CN2C1=O)[C@@H](CO)[C@@H](N3Cc4cc(F)ccc4F)C(=O)Nc5nccs5	BroadT	BRD-M31016039	BRD-M31016039-001-01-5	Broad Institute of MIT and Harvard	BRD-M31016039		C\C=C\c1ccc2[C@@H]3[C@H](Cn2c1=O)[C@@H](CO)[C@@H](N3Cc1cc(F)ccc1F)C(=O)Nc1nccs1.C\C=C/c1ccc2[C@@H]3[C@H](Cn2c1=O)[C@@H](CO)[C@@H](N3Cc1cc(F)ccc1F)C(=O)Nc1nccs1	C\C=C\c1ccc2[C@@H]3[C@H](Cn2c1=O)[C@@H](CO)[C@@H](N3Cc1cc(F)ccc1F)C(=O)Nc1nccs1.C\C=C/c1ccc2[C@@H]3[C@H](Cn2c1=O)[C@@H](CO)[C@@H](N3Cc1cc(F)ccc1F)C(=O)Nc1nccs1	InChI=1S/2C25H24F2N4O3S/c2*1-2-3-14-4-7-20-21-17(12-30(20)24(14)34)18(13-32)22(23(33)29-25-28-8-9-35-25)31(21)11-15-10-16(26)5-6-19(15)27/h2*2-10,17-18,21-22,32H,11-13H2,1H3,(H,28,29,33)/b3-2+;3-2-/t2*17-,18-,21+,22-/m11/s1	LROWCOSISYCRIQ-VHWLEYGISA-N	498.153717758							103259
BRD-K31290842	LSM-10321		54660761	InChI=1S/C25H25FN4O3/c26-17-3-1-16(2-4-17)18-5-6-21-23-22(19(14-31)20(29-23)13-30(21)25(18)33)24(32)28-12-9-15-7-10-27-11-8-15/h1-8,10-11,19-20,22-23,29,31H,9,12-14H2,(H,28,32)/t19-,20-,22+,23+/m0/s1	FVDKOQJIZWFRLQ-JFJDKTSWSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H](N2)[C@@H]1C(=O)NCCc5ccncc5	BroadT	BRD-K31290842	BRD-K31290842-001-01-5	Broad Institute of MIT and Harvard	BRD-K31290842			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H](N2)[C@@H]1C(=O)NCCc1ccncc1	InChI=1S/C25H25FN4O3/c26-17-3-1-16(2-4-17)18-5-6-21-23-22(19(14-31)20(29-23)13-30(21)25(18)33)24(32)28-12-9-15-7-10-27-11-8-15/h1-8,10-11,19-20,22-23,29,31H,9,12-14H2,(H,28,32)/t19-,20-,22+,23+/m0/s1	FVDKOQJIZWFRLQ-JFJDKTSWSA-N	448.1910689							98942
BRD-K02734624	LSM-8607		54660815	InChI=1S/C26H35N5O4/c1-29(2)11-5-10-27-25(33)23-20(14-32)22-13-31-21(24(23)30(22)12-18-15-35-16-28-18)9-8-19(26(31)34)17-6-3-4-7-17/h6,8-9,15-16,20,22-24,32H,3-5,7,10-14H2,1-2H3,(H,27,33)/t20-,22-,23+,24+/m1/s1	GJSDPDSQBZFABN-AZOUXBGGSA-N	CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@@H]1N2Cc5cocn5	BroadT	BRD-K02734624	BRD-K02734624-001-01-1	Broad Institute of MIT and Harvard	BRD-K02734624			CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]1N2Cc1cocn1	InChI=1S/C26H35N5O4/c1-29(2)11-5-10-27-25(33)23-20(14-32)22-13-31-21(24(23)30(22)12-18-15-35-16-28-18)9-8-19(26(31)34)17-6-3-4-7-17/h6,8-9,15-16,20,22-24,32H,3-5,7,10-14H2,1-2H3,(H,27,33)/t20-,22-,23+,24+/m1/s1	GJSDPDSQBZFABN-AZOUXBGGSA-N	481.26890465							97228
MLS005000171	LSM-8719	BRD-K04687955	54660687	InChI=1S/C26H26N4O5/c31-14-18-20-13-29-19(4-1-5-23(29)32)25(30(20)12-17-3-2-8-27-10-17)24(18)26(33)28-11-16-6-7-21-22(9-16)35-15-34-21/h1-10,18,20,24-25,31H,11-15H2,(H,28,33)/t18-,20-,24+,25+/m0/s1	NQAPPCYATWXMBW-GCAWGGIMSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)NCc4ccc5OCOc5c4)N2Cc6cccnc6	BroadT	BRD-K04687955	BRD-K04687955-001-01-8	Broad Institute of MIT and Harvard	BRD-K04687955			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NCc1ccc3OCOc3c1)N2Cc1cccnc1	InChI=1S/C26H26N4O5/c31-14-18-20-13-29-19(4-1-5-23(29)32)25(30(20)12-17-3-2-8-27-10-17)24(18)26(33)28-11-16-6-7-21-22(9-16)35-15-34-21/h1-10,18,20,24-25,31H,11-15H2,(H,28,33)/t18-,20-,24+,25+/m0/s1	NQAPPCYATWXMBW-GCAWGGIMSA-N	474.190319972							97340
BRD-M19115046	LSM-45010		54660768	InChI=1S/C26H32N6O4/c1-2-5-16-8-9-21-22-19(13-31(21)25(16)35)20(14-33)23(24(34)28-12-18-10-11-27-15-29-18)32(22)26(36)30-17-6-3-4-7-17/h2,5,8-11,15,17,19-20,22-23,33H,3-4,6-7,12-14H2,1H3,(H,28,34)(H,30,36)/t19-,20-,22+,23-/m0/s1	NIAAUHDJHRCSBO-RLBLXZPPSA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3C(=O)NC4CCCC4)C(=O)NCc5ccncn5	BroadT	BRD-M19115046	BRD-M19115046-001-01-2	Broad Institute of MIT and Harvard	BRD-M19115046		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCc4ccncn4)N(C(=O)NC4CCCC4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCc4ccncn4)N(C(=O)NC4CCCC4)[C@@H]23)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCc4ccncn4)N(C(=O)NC4CCCC4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCc4ccncn4)N(C(=O)NC4CCCC4)[C@@H]23)c1=O	InChI=1S/2C26H32N6O4/c2*1-2-5-16-8-9-21-22-19(13-31(21)25(16)35)20(14-33)23(24(34)28-12-18-10-11-27-15-29-18)32(22)26(36)30-17-6-3-4-7-17/h2*2,5,8-11,15,17,19-20,22-23,33H,3-4,6-7,12-14H2,1H3,(H,28,34)(H,30,36)/b5-2+;5-2-/t2*19-,20-,22+,23-/m00/s1	SIZLOKOVAXLSOF-FVRSGQABSA-N	492.248503564							103247
BRD-K13870698	LSM-9267		54660654	InChI=1S/C24H20FN3O5/c25-17-6-2-1-5-14(17)15-7-8-18-21-20(24(32)33)16(12-29)19(11-27(18)23(15)31)28(21)22(30)13-4-3-9-26-10-13/h1-10,16,19-21,29H,11-12H2,(H,32,33)/t16-,19-,20+,21+/m1/s1	UZVKIEFCDOWORH-DBOLQNLKSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]([C@H]1C(=O)O)N2C(=O)c5cccnc5	BroadT	BRD-K13870698	BRD-K13870698-001-01-1	Broad Institute of MIT and Harvard	BRD-K13870698			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]([C@H]1C(O)=O)N2C(=O)c1cccnc1	InChI=1S/C24H20FN3O5/c25-17-6-2-1-5-14(17)15-7-8-18-21-20(24(32)33)16(12-29)19(11-27(18)23(15)31)28(21)22(30)13-4-3-9-26-10-13/h1-10,16,19-21,29H,11-12H2,(H,32,33)/t16-,19-,20+,21+/m1/s1	UZVKIEFCDOWORH-DBOLQNLKSA-N	449.13869897							97888
BRD-K72072919	LSM-12844		54660651	InChI=1S/C24H29F2N5O4/c1-29(2)10-4-9-27-23(34)21-15(13-32)19-12-30-18(5-3-6-20(30)33)22(21)31(19)24(35)28-17-11-14(25)7-8-16(17)26/h3,5-8,11,15,19,21-22,32H,4,9-10,12-13H2,1-2H3,(H,27,34)(H,28,35)/t15-,19-,21+,22+/m1/s1	CIBCEUNPWMQAQP-VVBCARDSSA-N	CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]1N2C(=O)Nc4cc(F)ccc4F	BroadT	BRD-K72072919	BRD-K72072919-001-01-5	Broad Institute of MIT and Harvard	BRD-K72072919			CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2C(=O)Nc1cc(F)ccc1F	InChI=1S/C24H29F2N5O4/c1-29(2)10-4-9-27-23(34)21-15(13-32)19-12-30-18(5-3-6-20(30)33)22(21)31(19)24(35)28-17-11-14(25)7-8-16(17)26/h3,5-8,11,15,19,21-22,32H,4,9-10,12-13H2,1-2H3,(H,27,34)(H,28,35)/t15-,19-,21+,22+/m1/s1	CIBCEUNPWMQAQP-VVBCARDSSA-N	489.218760858							101481
BRD-M10589662	LSM-45003		54660776	InChI=1S/C22H30N2O5/c1-3-4-15-5-6-17-20-19(22(27)28-2)16(13-25)18(12-24(17)21(15)26)23(20)11-14-7-9-29-10-8-14/h3-6,14,16,18-20,25H,7-13H2,1-2H3/t16-,18-,19+,20+/m1/s1	YYKXHGZVSNLVER-LMCOJAPRSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]1N2CC4CCOCC4)C=CC	BroadT	BRD-M10589662	BRD-M10589662-001-01-0	Broad Institute of MIT and Harvard	BRD-M10589662		COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1N2CC1CCOCC1.COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@@H]1N2CC1CCOCC1)\C=C/C	COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1N2CC1CCOCC1.COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(=O)c(ccc3[C@@H]1N2CC1CCOCC1)\C=C/C	InChI=1S/2C22H30N2O5/c2*1-3-4-15-5-6-17-20-19(22(27)28-2)16(13-25)18(12-24(17)21(15)26)23(20)11-14-7-9-29-10-8-14/h2*3-6,14,16,18-20,25H,7-13H2,1-2H3/b4-3+;4-3-/t2*16-,18-,19+,20+/m11/s1	CWELBPBUWGSKQY-LQZWCTDHSA-N	402.21547208							103240
BRD-K14659422	LSM-9318		54660949	InChI=1S/C26H29N3O4/c30-14-19-21-13-28-20(6-3-7-22(28)31)25(29(21)23(32)10-15-8-9-15)24(19)26(33)27-18-11-16-4-1-2-5-17(16)12-18/h1-7,15,18-19,21,24-25,30H,8-14H2,(H,27,33)/t19-,21-,24+,25+/m0/s1	WBLJESZVKDDCFM-VFXZHPAVSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)NC4Cc5ccccc5C4)N2C(=O)CC6CC6	BroadT	BRD-K14659422	BRD-K14659422-001-01-0	Broad Institute of MIT and Harvard	BRD-K14659422			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NC1Cc3ccccc3C1)N2C(=O)CC1CC1	InChI=1S/C26H29N3O4/c30-14-19-21-13-28-20(6-3-7-22(28)31)25(29(21)23(32)10-15-8-9-15)24(19)26(33)27-18-11-16-4-1-2-5-17(16)12-18/h1-7,15,18-19,21,24-25,30H,8-14H2,(H,27,33)/t19-,21-,24+,25+/m0/s1	WBLJESZVKDDCFM-VFXZHPAVSA-N	447.215806438							97939
BRD-M77258496	LSM-45065		54660842	InChI=1S/C26H32N4O3/c1-2-8-18-10-11-21-24-23(26(33)28-13-6-3-7-14-28)20(17-31)22(16-30(21)25(18)32)29(24)15-19-9-4-5-12-27-19/h2,4-5,8-12,20,22-24,31H,3,6-7,13-17H2,1H3/t20-,22-,23+,24+/m1/s1	ARIBYWLZPORNAU-AZOUXBGGSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3Cc4ccccn4)C(=O)N5CCCCC5	BroadT	BRD-M77258496	BRD-M77258496-001-01-4	Broad Institute of MIT and Harvard	BRD-M77258496		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N4CCCCC4)[C@H]2N3Cc2ccccn2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N4CCCCC4)[C@H]2N3Cc2ccccn2)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N4CCCCC4)[C@H]2N3Cc2ccccn2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)N4CCCCC4)[C@H]2N3Cc2ccccn2)c1=O	InChI=1S/2C26H32N4O3/c2*1-2-8-18-10-11-21-24-23(26(33)28-13-6-3-7-14-28)20(17-31)22(16-30(21)25(18)32)29(24)15-19-9-4-5-12-27-19/h2*2,4-5,8-12,20,22-24,31H,3,6-7,13-17H2,1H3/b8-2+;8-2-/t2*20-,22-,23+,24+/m11/s1	DZORKODRLHXEMH-CNCLTPOQSA-N	448.247440924							103302
BRD-K00766524	LSM-8483		54660782	InChI=1S/C26H27N3O4/c1-28-22-14-29-21(13-12-19(26(29)32)16-8-10-18(33-2)11-9-16)24(28)23(20(22)15-30)25(31)27-17-6-4-3-5-7-17/h3-13,20,22-24,30H,14-15H2,1-2H3,(H,27,31)/t20-,22-,23+,24+/m1/s1	NFYJHTUTLOTQBL-AZOUXBGGSA-N	COc1ccc(cc1)C2=CC=C3[C@H]4[C@H]([C@H](CO)[C@@H](CN3C2=O)N4C)C(=O)Nc5ccccc5	BroadT	BRD-K00766524	BRD-K00766524-001-01-6	Broad Institute of MIT and Harvard	BRD-K00766524			COc1ccc(cc1)-c1ccc2[C@H]3[C@H]([C@H](CO)[C@@H](Cn2c1=O)N3C)C(=O)Nc1ccccc1	InChI=1S/C26H27N3O4/c1-28-22-14-29-21(13-12-19(26(29)32)16-8-10-18(33-2)11-9-16)24(28)23(20(22)15-30)25(31)27-17-6-4-3-5-7-17/h3-13,20,22-24,30H,14-15H2,1-2H3,(H,27,31)/t20-,22-,23+,24+/m1/s1	NFYJHTUTLOTQBL-AZOUXBGGSA-N	445.200156374							97104
BRD-M58317392	LSM-45049		54660850	InChI=1S/C30H31N3O4/c1-3-8-21-13-16-24-28-27(23(18-34)25(17-32(24)30(21)37)33(28)26(35)4-2)29(36)31-22-14-11-20(12-15-22)19-9-6-5-7-10-19/h3,5-16,23,25,27-28,34H,4,17-18H2,1-2H3,(H,31,36)/t23-,25-,27+,28+/m0/s1	HNSAWDAWFZSFQJ-FRRISVFZSA-N	CCC(=O)N1[C@H]2CN3C(=O)C(=CC=C3[C@@H]1[C@@H]([C@H]2CO)C(=O)Nc4ccc(cc4)c5ccccc5)C=CC	BroadT	BRD-M58317392	BRD-M58317392-001-01-6	Broad Institute of MIT and Harvard	BRD-M58317392		CCC(=O)N1[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1[C@H](C(=O)Nc1ccc(cc1)-c1ccccc1)[C@H]2CO.CCC(=O)N1[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]1[C@H](C(=O)Nc1ccc(cc1)-c1ccccc1)[C@H]2CO	CCC(=O)N1[C@H]2Cn3c(=O)c(\C=C\C)ccc3[C@@H]1[C@H](C(=O)Nc1ccc(cc1)-c1ccccc1)[C@H]2CO.CCC(=O)N1[C@H]2Cn3c(=O)c(\C=C/C)ccc3[C@@H]1[C@H](C(=O)Nc1ccc(cc1)-c1ccccc1)[C@H]2CO	InChI=1S/2C30H31N3O4/c2*1-3-8-21-13-16-24-28-27(23(18-34)25(17-32(24)30(21)37)33(28)26(35)4-2)29(36)31-22-14-11-20(12-15-22)19-9-6-5-7-10-19/h2*3,5-16,23,25,27-28,34H,4,17-18H2,1-2H3,(H,31,36)/b8-3+;8-3-/t2*23-,25-,27+,28+/m00/s1	NIJCPLGBNZYRBS-RPYJAHALSA-N	497.231456502							103286
BRD-K24746925	LSM-9930		54660790	InChI=1S/C27H27F2N3O3/c1-2-31-23-14-32-22(12-11-19(27(32)35)18-5-3-4-6-21(18)29)25(31)24(20(23)15-33)26(34)30-13-16-7-9-17(28)10-8-16/h3-12,20,23-25,33H,2,13-15H2,1H3,(H,30,34)/t20-,23-,24+,25+/m0/s1	YKOAUFLNNKQPQT-MNPDLOSFSA-N	CCN1[C@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc5ccc(F)cc5	BroadT	BRD-K24746925	BRD-K24746925-001-01-5	Broad Institute of MIT and Harvard	BRD-K24746925			CCN1[C@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCc1ccc(F)cc1	InChI=1S/C27H27F2N3O3/c1-2-31-23-14-32-22(12-11-19(27(32)35)18-5-3-4-6-21(18)29)25(31)24(20(23)15-33)26(34)30-13-16-7-9-17(28)10-8-16/h3-12,20,23-25,33H,2,13-15H2,1H3,(H,30,34)/t20-,23-,24+,25+/m0/s1	YKOAUFLNNKQPQT-MNPDLOSFSA-N	479.202048154							98551
BRD-K15457570	LSM-9354		54660895	InChI=1S/C25H28N4O4S/c1-3-11-28-21-17(18(14-30)22(28)23(31)27-25-26-10-12-34-25)13-29-19(21)9-8-16(24(29)32)15-6-4-5-7-20(15)33-2/h4-10,12,17-18,21-22,30H,3,11,13-14H2,1-2H3,(H,26,27,31)/t17-,18-,21+,22-/m1/s1	FBORFXHKEDCJEC-RPHTVSPISA-N	CCCN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccccc4OC)[C@@H]12)C(=O)Nc5nccs5	BroadT	BRD-K15457570	BRD-K15457570-001-01-8	Broad Institute of MIT and Harvard	BRD-K15457570			CCCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@@H]12)C(=O)Nc1nccs1	InChI=1S/C25H28N4O4S/c1-3-11-28-21-17(18(14-30)22(28)23(31)27-25-26-10-12-34-25)13-29-19(21)9-8-16(24(29)32)15-6-4-5-7-20(15)33-2/h4-10,12,17-18,21-22,30H,3,11,13-14H2,1-2H3,(H,26,27,31)/t17-,18-,21+,22-/m1/s1	FBORFXHKEDCJEC-RPHTVSPISA-N	480.183126106							97975
BRD-K73288268	LSM-12915		54660749	InChI=1S/C27H30N4O5/c32-16-20-22-15-30-21(6-5-19(26(30)34)17-3-1-2-4-17)24(23(20)27(35)29-11-13-36-14-12-29)31(22)25(33)18-7-9-28-10-8-18/h3,5-10,20,22-24,32H,1-2,4,11-16H2/t20-,22-,23+,24+/m1/s1	COTUBAWVYSPTNF-AZOUXBGGSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@@H]([C@H]1C(=O)N4CCOCC4)N2C(=O)c5ccncc5)C6=CCCC6	BroadT	BRD-K73288268	BRD-K73288268-001-01-3	Broad Institute of MIT and Harvard	BRD-K73288268			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]([C@H]1C(=O)N1CCOCC1)N2C(=O)c1ccncc1	InChI=1S/C27H30N4O5/c32-16-20-22-15-30-21(6-5-19(26(30)34)17-3-1-2-4-17)24(23(20)27(35)29-11-13-36-14-12-29)31(22)25(33)18-7-9-28-10-8-18/h3,5-10,20,22-24,32H,1-2,4,11-16H2/t20-,22-,23+,24+/m1/s1	COTUBAWVYSPTNF-AZOUXBGGSA-N	490.2216201							101552
BRD-K25706980	LSM-9988		54660670	InChI=1S/C25H27N5O3S/c31-14-18-20-12-30-19(4-3-17(25(30)33)16-5-7-26-8-6-16)23(29(20)13-21-27-9-10-34-21)22(18)24(32)28-11-15-1-2-15/h3-10,15,18,20,22-23,31H,1-2,11-14H2,(H,28,32)/t18-,20-,22+,23+/m1/s1	HSQWCVQVATZDQW-SQMBMXPBSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@@H]([C@H]1C(=O)NCC5CC5)N2Cc6nccs6	BroadT	BRD-K25706980	BRD-K25706980-001-01-0	Broad Institute of MIT and Harvard	BRD-K25706980			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]([C@H]1C(=O)NCC1CC1)N2Cc1nccs1	InChI=1S/C25H27N5O3S/c31-14-18-20-12-30-19(4-3-17(25(30)33)16-5-7-26-8-6-16)23(29(20)13-21-27-9-10-34-21)22(18)24(32)28-11-15-1-2-15/h3-10,15,18,20,22-23,31H,1-2,11-14H2,(H,28,32)/t18-,20-,22+,23+/m1/s1	HSQWCVQVATZDQW-SQMBMXPBSA-N	477.183460464							98609
BRD-K68279832	LSM-12589		54660795	InChI=1S/C23H25F2N3O3/c24-14-7-8-17(25)13(9-14)10-28-19-11-27-18(5-2-6-20(27)30)22(28)21(16(19)12-29)23(31)26-15-3-1-4-15/h2,5-9,15-16,19,21-22,29H,1,3-4,10-12H2,(H,26,31)/t16-,19-,21+,22+/m0/s1	GICHBVCHVQBVRX-NTSGDEEZSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)NC4CCC4)N2Cc5cc(F)ccc5F	BroadT	BRD-K68279832	BRD-K68279832-001-01-6	Broad Institute of MIT and Harvard	BRD-K68279832			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NC1CCC1)N2Cc1cc(F)ccc1F	InChI=1S/C23H25F2N3O3/c24-14-7-8-17(25)13(9-14)10-28-19-11-27-18(5-2-6-20(27)30)22(28)21(16(19)12-29)23(31)26-15-3-1-4-15/h2,5-9,15-16,19,21-22,29H,1,3-4,10-12H2,(H,26,31)/t16-,19-,21+,22+/m0/s1	GICHBVCHVQBVRX-NTSGDEEZSA-N	429.18639809							101220
BRD-K76028541	LSM-13079		54660672	InChI=1S/C25H28N6O4/c1-29-12-17(27-15-29)10-11-26-24(34)23-19(14-32)18-13-30-20(8-5-9-21(30)33)22(18)31(23)25(35)28-16-6-3-2-4-7-16/h2-9,12,15,18-19,22-23,32H,10-11,13-14H2,1H3,(H,26,34)(H,28,35)/t18-,19-,22+,23-/m1/s1	WOLKNTYXBIJULP-PJIZGREPSA-N	Cn1cnc(CCNC(=O)[C@H]2[C@H](CO)[C@H]3CN4C(=O)C=CC=C4[C@H]3N2C(=O)Nc5ccccc5)c1	BroadT	BRD-K76028541	BRD-K76028541-001-01-9	Broad Institute of MIT and Harvard	BRD-K76028541			Cn1cnc(CCNC(=O)[C@H]2[C@H](CO)[C@H]3Cn4c(cccc4=O)[C@H]3N2C(=O)Nc2ccccc2)c1	InChI=1S/C25H28N6O4/c1-29-12-17(27-15-29)10-11-26-24(34)23-19(14-32)18-13-30-20(8-5-9-21(30)33)22(18)31(23)25(35)28-16-6-3-2-4-7-16/h2-9,12,15,18-19,22-23,32H,10-11,13-14H2,1H3,(H,26,34)(H,28,35)/t18-,19-,22+,23-/m1/s1	WOLKNTYXBIJULP-PJIZGREPSA-N	476.217203436							101717
BRD-K35083768	LSM-10539		54660645	InChI=1S/C25H36N4O4/c30-16-19-20-15-29-21(8-7-18(25(29)32)17-5-2-1-3-6-17)23(27-20)22(19)24(31)26-9-4-10-28-11-13-33-14-12-28/h5,7-8,19-20,22-23,27,30H,1-4,6,9-16H2,(H,26,31)/t19-,20-,22+,23+/m1/s1	QXIHUUSMHZUCPE-SCPDWHHUSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H](N2)[C@H]1C(=O)NCCCN4CCOCC4)C5=CCCCC5	BroadT	BRD-K35083768	BRD-K35083768-001-01-0	Broad Institute of MIT and Harvard	BRD-K35083768			OC[C@@H]1[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H](N2)[C@H]1C(=O)NCCCN1CCOCC1	InChI=1S/C25H36N4O4/c30-16-19-20-15-29-21(8-7-18(25(29)32)17-5-2-1-3-6-17)23(27-20)22(19)24(31)26-9-4-10-28-11-13-33-14-12-28/h5,7-8,19-20,22-23,27,30H,1-4,6,9-16H2,(H,26,31)/t19-,20-,22+,23+/m1/s1	QXIHUUSMHZUCPE-SCPDWHHUSA-N	456.273655672							99160
BRD-K16310506-001-01-7	LSM-28119	BRD-K16310506	54660635	InChI=1S/C22H27N3O3/c1-3-23-21(27)20-17(13-26)16-12-25-18(19(16)24(20)4-2)11-10-15(22(25)28)14-8-6-5-7-9-14/h5-11,16-17,19-20,26H,3-4,12-13H2,1-2H3,(H,23,27)/t16-,17-,19+,20-/m0/s1	OSVRRGSOHNMBSG-XEYPJELSSA-N	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N1CC)c4ccccc4	BroadT	BRD-K16310506	BRD-K16310506-001-01-7	Broad Institute of MIT and Harvard	BRD-K16310506			CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]2N1CC	InChI=1S/C22H27N3O3/c1-3-23-21(27)20-17(13-26)16-12-25-18(19(16)24(20)4-2)11-10-15(22(25)28)14-8-6-5-7-9-14/h5-11,16-17,19-20,26H,3-4,12-13H2,1-2H3,(H,23,27)/t16-,17-,19+,20-/m0/s1	OSVRRGSOHNMBSG-XEYPJELSSA-N	381.205241754							116664
BRD-K63853782	LSM-12321		54660700	InChI=1S/C23H26F3N3O3/c1-14(15-6-3-2-4-7-15)27-22(32)20-16(13-30)18-12-29-17(8-5-9-19(29)31)21(20)28(18)11-10-23(24,25)26/h2-9,14,16,18,20-21,30H,10-13H2,1H3,(H,27,32)/t14-,16-,18-,20+,21+/m0/s1	LOVSINJIWNBKBE-NNPDCFOJSA-N	C[C@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@H]1N2CCC(F)(F)F)c4ccccc4	BroadT	BRD-K63853782	BRD-K63853782-001-01-3	Broad Institute of MIT and Harvard	BRD-K63853782			C[C@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2CCC(F)(F)F)c1ccccc1	InChI=1S/C23H26F3N3O3/c1-14(15-6-3-2-4-7-15)27-22(32)20-16(13-30)18-12-29-17(8-5-9-19(29)31)21(20)28(18)11-10-23(24,25)26/h2-9,14,16,18,20-21,30H,10-13H2,1H3,(H,27,32)/t14-,16-,18-,20+,21+/m0/s1	LOVSINJIWNBKBE-NNPDCFOJSA-N	449.192626322							100948
BRD-K81468789	LSM-13402		54660839	InChI=1S/C25H31FN4O5/c1-14(2)28-25(34)30-20-12-29-19(8-7-17(24(29)33)15-5-4-6-16(26)11-15)22(30)21(18(20)13-31)23(32)27-9-10-35-3/h4-8,11,14,18,20-22,31H,9-10,12-13H2,1-3H3,(H,27,32)(H,28,34)/t18-,20-,21+,22+/m0/s1	RKZCTJVPZQLRIW-VXSCBNMQSA-N	COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@H]1N2C(=O)NC(C)C	BroadT	BRD-K81468789	BRD-K81468789-001-01-1	Broad Institute of MIT and Harvard	BRD-K81468789			COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]1N2C(=O)NC(C)C	InChI=1S/C25H31FN4O5/c1-14(2)28-25(34)30-20-12-29-19(8-7-17(24(29)33)15-5-4-6-16(26)11-15)22(30)21(18(20)13-31)23(32)27-9-10-35-3/h4-8,11,14,18,20-22,31H,9-10,12-13H2,1-3H3,(H,27,32)(H,28,34)/t18-,20-,21+,22+/m0/s1	RKZCTJVPZQLRIW-VXSCBNMQSA-N	486.227848332							102042
BRD-K21473123	LSM-9731		54660946	InChI=1S/C26H28N4O3/c1-16(17-6-4-3-5-7-17)28-25(32)24-21(15-31)20-14-30-22(23(20)29(24)2)9-8-19(26(30)33)18-10-12-27-13-11-18/h3-13,16,20-21,23-24,31H,14-15H2,1-2H3,(H,28,32)/t16-,20+,21+,23-,24+/m1/s1	XRCXBUPUCMDVHO-PJVFYWIPSA-N	C[C@@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@@H]2N1C)c5ccccc5	BroadT	BRD-K21473123	BRD-K21473123-001-01-9	Broad Institute of MIT and Harvard	BRD-K21473123			C[C@@H](NC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]2N1C)c1ccccc1	InChI=1S/C26H28N4O3/c1-16(17-6-4-3-5-7-17)28-25(32)24-21(15-31)20-14-30-22(23(20)29(24)2)9-8-19(26(30)33)18-10-12-27-13-11-18/h3-13,16,20-21,23-24,31H,14-15H2,1-2H3,(H,28,32)/t16-,20+,21+,23-,24+/m1/s1	XRCXBUPUCMDVHO-PJVFYWIPSA-N	444.216140796							98352
BRD-M44900776	LSM-45035		54660678	InChI=1S/C23H25N3O5/c1-2-3-14-5-6-17-21-20(15(11-27)16(25-21)10-26(17)23(14)29)22(28)24-9-13-4-7-18-19(8-13)31-12-30-18/h2-8,15-16,20-21,25,27H,9-12H2,1H3,(H,24,28)/t15-,16-,20+,21+/m1/s1	ZLAIHPPUWVVFMW-RFZJPIJTSA-N	CC=CC1=CC=C2[C@@H]3N[C@H](CN2C1=O)[C@@H](CO)[C@@H]3C(=O)NCc4ccc5OCOc5c4	BroadT	BRD-M44900776	BRD-M44900776-001-01-2	Broad Institute of MIT and Harvard	BRD-M44900776		C\C=C\c1ccc2[C@@H]3N[C@H](Cn2c1=O)[C@@H](CO)[C@@H]3C(=O)NCc1ccc2OCOc2c1.C\C=C/c1ccc2[C@@H]3N[C@H](Cn2c1=O)[C@@H](CO)[C@@H]3C(=O)NCc1ccc2OCOc2c1	C\C=C\c1ccc2[C@@H]3N[C@H](Cn2c1=O)[C@@H](CO)[C@@H]3C(=O)NCc1ccc2OCOc2c1.C\C=C/c1ccc2[C@@H]3N[C@H](Cn2c1=O)[C@@H](CO)[C@@H]3C(=O)NCc1ccc2OCOc2c1	InChI=1S/2C23H25N3O5/c2*1-2-3-14-5-6-17-21-20(15(11-27)16(25-21)10-26(17)23(14)29)22(28)24-9-13-4-7-18-19(8-13)31-12-30-18/h2*2-8,15-16,20-21,25,27H,9-12H2,1H3,(H,24,28)/b3-2+;3-2-/t2*15-,16-,20+,21+/m11/s1	IHPZOKOAQWUWOA-LDHVLNSKSA-N	423.17942093							103272
BRD-K69506839	LSM-12669		54661020	InChI=1S/C28H29N3O3/c1-29-25-22(16-31-24(25)12-11-21(27(31)33)19-8-3-2-4-9-19)23(17-32)26(29)28(34)30-14-13-18-7-5-6-10-20(18)15-30/h2-12,22-23,25-26,32H,13-17H2,1H3/t22-,23-,25+,26-/m0/s1	YSTNLTHHZDJVRS-LJCOXQHRSA-N	CN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@H]12)C(=O)N5CCc6ccccc6C5	BroadT	BRD-K69506839	BRD-K69506839-001-01-4	Broad Institute of MIT and Harvard	BRD-K69506839			CN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]12)C(=O)N1CCc2ccccc2C1	InChI=1S/C28H29N3O3/c1-29-25-22(16-31-24(25)12-11-21(27(31)33)19-8-3-2-4-9-19)23(17-32)26(29)28(34)30-14-13-18-7-5-6-10-20(18)15-30/h2-12,22-23,25-26,32H,13-17H2,1H3/t22-,23-,25+,26-/m0/s1	YSTNLTHHZDJVRS-LJCOXQHRSA-N	455.220891818							101303
BRD-K79106006	LSM-13260		54660922	InChI=1S/C17H23N3O3/c1-19-13-8-20-12(3-2-4-14(20)22)16(19)15(11(13)9-21)17(23)18-7-10-5-6-10/h2-4,10-11,13,15-16,21H,5-9H2,1H3,(H,18,23)/t11-,13-,15+,16+/m1/s1	INXWNUBULGNKSP-OYNZBZHQSA-N	CN1[C@@H]2CN3C(=O)C=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)NCC4CC4	BroadT	BRD-K79106006	BRD-K79106006-001-01-8	Broad Institute of MIT and Harvard	BRD-K79106006			CN1[C@@H]2Cn3c(cccc3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCC1CC1	InChI=1S/C17H23N3O3/c1-19-13-8-20-12(3-2-4-14(20)22)16(19)15(11(13)9-21)17(23)18-7-10-5-6-10/h2-4,10-11,13,15-16,21H,5-9H2,1H3,(H,18,23)/t11-,13-,15+,16+/m1/s1	INXWNUBULGNKSP-OYNZBZHQSA-N	317.173941626							101899
BRD-K46185480	LSM-11243		54660690	InChI=1S/C21H21F4N3O3/c22-13-4-1-3-12(7-13)8-28-18-14(9-27-16(18)5-2-6-17(27)30)15(10-29)19(28)20(31)26-11-21(23,24)25/h1-7,14-15,18-19,29H,8-11H2,(H,26,31)/t14-,15-,18+,19-/m1/s1	LKWCVEYJHHUNKM-VVWQDTPRSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N(Cc4cccc(F)c4)[C@H]1C(=O)NCC(F)(F)F	BroadT	BRD-K46185480	BRD-K46185480-001-01-7	Broad Institute of MIT and Harvard	BRD-K46185480			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N(Cc2cccc(F)c2)[C@H]1C(=O)NCC(F)(F)F	InChI=1S/C21H21F4N3O3/c22-13-4-1-3-12(7-13)8-28-18-14(9-27-16(18)5-2-6-17(27)30)15(10-29)19(28)20(31)26-11-21(23,24)25/h1-7,14-15,18-19,29H,8-11H2,(H,26,31)/t14-,15-,18+,19-/m1/s1	LKWCVEYJHHUNKM-VVWQDTPRSA-N	439.151904362							99864
BRD-M45755366	LSM-45038		54660706	InChI=1S/C24H28ClN3O3/c1-3-6-16-9-10-19-22-21(23(30)26-4-2)18(14-29)20(13-28(19)24(16)31)27(22)12-15-7-5-8-17(25)11-15/h3,5-11,18,20-22,29H,4,12-14H2,1-2H3,(H,26,30)/t18-,20-,21+,22+/m0/s1	MZSYIDBVYNJBAP-VXSCBNMQSA-N	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]1N2Cc4cccc(Cl)c4)C=CC	BroadT	BRD-M45755366	BRD-M45755366-001-01-5	Broad Institute of MIT and Harvard	BRD-M45755366		CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]1N2Cc1cccc(Cl)c1.CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]1N2Cc1cccc(Cl)c1	CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]1N2Cc1cccc(Cl)c1.CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]1N2Cc1cccc(Cl)c1	InChI=1S/2C24H28ClN3O3/c2*1-3-6-16-9-10-19-22-21(23(30)26-4-2)18(14-29)20(13-28(19)24(16)31)27(22)12-15-7-5-8-17(25)11-15/h2*3,5-11,18,20-22,29H,4,12-14H2,1-2H3,(H,26,30)/b6-3+;6-3-/t2*18-,20-,21+,22+/m00/s1	DDLCGIHGNSZQJS-IHRDRCOGSA-N	441.181919496							103275
BRD-K32436461	LSM-10398		54661016	InChI=1S/C28H30N4O4/c33-15-23-22-14-31-24(12-11-21(28(31)35)18-7-3-1-4-8-18)25(22)32(13-20-16-36-17-29-20)26(23)27(34)30-19-9-5-2-6-10-19/h2,5-7,9-12,16-17,22-23,25-26,33H,1,3-4,8,13-15H2,(H,30,34)/t22-,23-,25+,26-/m0/s1	NLGBQKPPTNRTKJ-LJCOXQHRSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N(Cc4cocn4)[C@@H]1C(=O)Nc5ccccc5)C6=CCCCC6	BroadT	BRD-K32436461	BRD-K32436461-001-01-3	Broad Institute of MIT and Harvard	BRD-K32436461			OC[C@H]1[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@@H]2N(Cc2cocn2)[C@@H]1C(=O)Nc1ccccc1	InChI=1S/C28H30N4O4/c33-15-23-22-14-31-24(12-11-21(28(31)35)18-7-3-1-4-8-18)25(22)32(13-20-16-36-17-29-20)26(23)27(34)30-19-9-5-2-6-10-19/h2,5-7,9-12,16-17,22-23,25-26,33H,1,3-4,8,13-15H2,(H,30,34)/t22-,23-,25+,26-/m0/s1	NLGBQKPPTNRTKJ-LJCOXQHRSA-N	486.22670548							99019
BRD-K98641517	LSM-43505		54660993	InChI=1S/C28H31N5O3/c1-2-14-32-25-22(23(17-34)26(32)27(35)30-15-21-12-13-29-18-31-21)16-33-24(25)11-10-20(28(33)36)9-8-19-6-4-3-5-7-19/h3-13,18,22-23,25-26,34H,2,14-17H2,1H3,(H,30,35)/b9-8+/t22-,23-,25+,26-/m1/s1	HXYTZOMMTUQQOD-MDDGOGIGSA-N	CCCN1[C@H]([C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]12)\C=C\c4ccccc4)C(=O)NCc5ccncn5	BroadT	BRD-K98641517	BRD-K98641517-001-01-3	Broad Institute of MIT and Harvard	BRD-K98641517			CCCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]12)C(=O)NCc1ccncn1	InChI=1S/C28H31N5O3/c1-2-14-32-25-22(23(17-34)26(32)27(35)30-15-21-12-13-29-18-31-21)16-33-24(25)11-10-20(28(33)36)9-8-19-6-4-3-5-7-19/h3-13,18,22-23,25-26,34H,2,14-17H2,1H3,(H,30,35)/b9-8+/t22-,23-,25+,26-/m1/s1	HXYTZOMMTUQQOD-MDDGOGIGSA-N	485.242689902							
BRD-K89399567	LSM-13935		54660890	InChI=1S/C30H28N4O3/c35-19-24-26-18-33-25(7-4-8-27(33)36)29(34(26)17-20-13-15-31-16-14-20)28(24)30(37)32-23-11-9-22(10-12-23)21-5-2-1-3-6-21/h1-16,24,26,28-29,35H,17-19H2,(H,32,37)/t24-,26-,28+,29+/m0/s1	QNNNGHWPHFGBDZ-QNEBNACWSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)Nc4ccc(cc4)c5ccccc5)N2Cc6ccncc6	BroadT	BRD-K89399567	BRD-K89399567-001-01-8	Broad Institute of MIT and Harvard	BRD-K89399567			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)Nc1ccc(cc1)-c1ccccc1)N2Cc1ccncc1	InChI=1S/C30H28N4O3/c35-19-24-26-18-33-25(7-4-8-27(33)36)29(34(26)17-20-13-15-31-16-14-20)28(24)30(37)32-23-11-9-22(10-12-23)21-5-2-1-3-6-21/h1-16,24,26,28-29,35H,17-19H2,(H,32,37)/t24-,26-,28+,29+/m0/s1	QNNNGHWPHFGBDZ-QNEBNACWSA-N	492.216140796							102588
BRD-K23703347	LSM-9856		54660796	InChI=1S/C23H25F2N3O3/c24-14-7-8-17(25)13(9-14)10-28-19-11-27-18(5-2-6-20(27)30)22(28)21(16(19)12-29)23(31)26-15-3-1-4-15/h2,5-9,15-16,19,21-22,29H,1,3-4,10-12H2,(H,26,31)/t16-,19-,21+,22+/m1/s1	GICHBVCHVQBVRX-MWRLGJARSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)NC4CCC4)N2Cc5cc(F)ccc5F	BroadT	BRD-K23703347	BRD-K23703347-001-01-7	Broad Institute of MIT and Harvard	BRD-K23703347			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NC1CCC1)N2Cc1cc(F)ccc1F	InChI=1S/C23H25F2N3O3/c24-14-7-8-17(25)13(9-14)10-28-19-11-27-18(5-2-6-20(27)30)22(28)21(16(19)12-29)23(31)26-15-3-1-4-15/h2,5-9,15-16,19,21-22,29H,1,3-4,10-12H2,(H,26,31)/t16-,19-,21+,22+/m1/s1	GICHBVCHVQBVRX-MWRLGJARSA-N	429.18639809							98477
BRD-M30758753	LSM-45021		54660703	InChI=1S/C24H28ClN3O3/c1-3-6-16-9-10-19-22-21(23(30)26-4-2)18(14-29)20(13-28(19)24(16)31)27(22)12-15-7-5-8-17(25)11-15/h3,5-11,18,20-22,29H,4,12-14H2,1-2H3,(H,26,30)/t18-,20-,21+,22+/m1/s1	MZSYIDBVYNJBAP-YJMBLLCNSA-N	CCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]1N2Cc4cccc(Cl)c4)C=CC	BroadT	BRD-M30758753	BRD-M30758753-001-01-7	Broad Institute of MIT and Harvard	BRD-M30758753		CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]1N2Cc1cccc(Cl)c1.CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]1N2Cc1cccc(Cl)c1	CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\C)c3=O)[C@@H]1N2Cc1cccc(Cl)c1.CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C/C)c3=O)[C@@H]1N2Cc1cccc(Cl)c1	InChI=1S/2C24H28ClN3O3/c2*1-3-6-16-9-10-19-22-21(23(30)26-4-2)18(14-29)20(13-28(19)24(16)31)27(22)12-15-7-5-8-17(25)11-15/h2*3,5-11,18,20-22,29H,4,12-14H2,1-2H3,(H,26,30)/b6-3+;6-3-/t2*18-,20-,21+,22+/m11/s1	DDLCGIHGNSZQJS-WMNJRWIKSA-N	441.181919496							103258
BRD-K78121324	LSM-13207		54660691	InChI=1S/C23H26N4O5/c28-11-17-16-10-26-18(7-6-15(22(26)30)14-8-24-12-25-9-14)19(16)27(20(17)23(31)32)21(29)13-4-2-1-3-5-13/h6-9,12-13,16-17,19-20,28H,1-5,10-11H2,(H,31,32)/t16-,17-,19+,20-/m0/s1	QRMANUUKSUBTTM-XEYPJELSSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4cncnc4)[C@@H]2N([C@@H]1C(=O)O)C(=O)C5CCCCC5	BroadT	BRD-K78121324	BRD-K78121324-001-01-3	Broad Institute of MIT and Harvard	BRD-K78121324			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@@H]2N([C@@H]1C(O)=O)C(=O)C1CCCCC1	InChI=1S/C23H26N4O5/c28-11-17-16-10-26-18(7-6-15(22(26)30)14-8-24-12-25-9-14)19(16)27(20(17)23(31)32)21(29)13-4-2-1-3-5-13/h6-9,12-13,16-17,19-20,28H,1-5,10-11H2,(H,31,32)/t16-,17-,19+,20-/m0/s1	QRMANUUKSUBTTM-XEYPJELSSA-N	438.190319972							101845
BRD-K73428213	LSM-12927		54660935	InChI=1S/C26H25N5O4/c32-14-19-18-13-30-21(6-3-7-22(30)33)23(18)31(26(35)20-12-27-8-9-28-20)24(19)25(34)29-17-10-15-4-1-2-5-16(15)11-17/h1-9,12,17-19,23-24,32H,10-11,13-14H2,(H,29,34)/t18-,19-,23+,24-/m0/s1	UFMLPCAJUBVDJE-TWXAQOBRSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N([C@@H]1C(=O)NC4Cc5ccccc5C4)C(=O)c6cnccn6	BroadT	BRD-K73428213	BRD-K73428213-001-01-1	Broad Institute of MIT and Harvard	BRD-K73428213			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N([C@@H]1C(=O)NC1Cc2ccccc2C1)C(=O)c1cnccn1	InChI=1S/C26H25N5O4/c32-14-19-18-13-30-21(6-3-7-22(30)33)23(18)31(26(35)20-12-27-8-9-28-20)24(19)25(34)29-17-10-15-4-1-2-5-16(15)11-17/h1-9,12,17-19,23-24,32H,10-11,13-14H2,(H,29,34)/t18-,19-,23+,24-/m0/s1	UFMLPCAJUBVDJE-TWXAQOBRSA-N	471.19065433							101564
BRD-M66672790	LSM-45057		54661006	InChI=1S/C24H33N3O4/c1-3-7-17-10-11-19-22-21(23(30)25-12-16-8-5-4-6-9-16)18(14-28)20(27(22)15(2)29)13-26(19)24(17)31/h3,7,10-11,16,18,20-22,28H,4-6,8-9,12-14H2,1-2H3,(H,25,30)/t18-,20-,21+,22+/m1/s1	NJGAJUNFGSSUAO-YJMBLLCNSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3C(=O)C)C(=O)NCC4CCCCC4	BroadT	BRD-M66672790	BRD-M66672790-001-01-2	Broad Institute of MIT and Harvard	BRD-M66672790		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCC4CCCCC4)[C@H]2N3C(C)=O)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCC4CCCCC4)[C@H]2N3C(C)=O)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCC4CCCCC4)[C@H]2N3C(C)=O)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NCC4CCCCC4)[C@H]2N3C(C)=O)c1=O	InChI=1S/2C24H33N3O4/c2*1-3-7-17-10-11-19-22-21(23(30)25-12-16-8-5-4-6-9-16)18(14-28)20(27(22)15(2)29)13-26(19)24(17)31/h2*3,7,10-11,16,18,20-22,28H,4-6,8-9,12-14H2,1-2H3,(H,25,30)/b7-3+;7-3-/t2*18-,20-,21+,22+/m11/s1	MTFSLJXEIRKOKM-XSGFGFKGSA-N	427.247106566							103294
BRD-M49151292	LSM-45039		54660853	InChI=1S/C30H31N3O4/c1-3-8-21-13-16-24-28-27(23(18-34)25(17-32(24)30(21)37)33(28)26(35)4-2)29(36)31-22-14-11-20(12-15-22)19-9-6-5-7-10-19/h3,5-16,23,25,27-28,34H,4,17-18H2,1-2H3,(H,31,36)/t23-,25-,27+,28+/m1/s1	HNSAWDAWFZSFQJ-VXGLHPTQSA-N	CCC(=O)N1[C@@H]2CN3C(=O)C(=CC=C3[C@H]1[C@H]([C@@H]2CO)C(=O)Nc4ccc(cc4)c5ccccc5)C=CC	BroadT	BRD-M49151292	BRD-M49151292-001-01-2	Broad Institute of MIT and Harvard	BRD-M49151292		CCC(=O)N1[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1[C@@H](C(=O)Nc1ccc(cc1)-c1ccccc1)[C@@H]2CO.CCC(=O)N1[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]1[C@@H](C(=O)Nc1ccc(cc1)-c1ccccc1)[C@@H]2CO	CCC(=O)N1[C@@H]2Cn3c(=O)c(\C=C\C)ccc3[C@H]1[C@@H](C(=O)Nc1ccc(cc1)-c1ccccc1)[C@@H]2CO.CCC(=O)N1[C@@H]2Cn3c(=O)c(\C=C/C)ccc3[C@H]1[C@@H](C(=O)Nc1ccc(cc1)-c1ccccc1)[C@@H]2CO	InChI=1S/2C30H31N3O4/c2*1-3-8-21-13-16-24-28-27(23(18-34)25(17-32(24)30(21)37)33(28)26(35)4-2)29(36)31-22-14-11-20(12-15-22)19-9-6-5-7-10-19/h2*3,5-16,23,25,27-28,34H,4,17-18H2,1-2H3,(H,31,36)/b8-3+;8-3-/t2*23-,25-,27+,28+/m11/s1	NIJCPLGBNZYRBS-ATTHFJLZSA-N	497.231456502							103276
BRD-K32759520	LSM-10415		54660933	InChI=1S/C23H29N5O3/c29-12-17-18-11-28-19(7-6-16(23(28)31)15-9-24-13-25-10-15)21(27-18)20(17)22(30)26-8-14-4-2-1-3-5-14/h6-7,9-10,13-14,17-18,20-21,27,29H,1-5,8,11-12H2,(H,26,30)/t17-,18-,20+,21+/m1/s1	CMFJQPXRJRRAOF-QCFAMHMHSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H](N2)[C@H]1C(=O)NCC4CCCCC4)c5cncnc5	BroadT	BRD-K32759520	BRD-K32759520-001-01-7	Broad Institute of MIT and Harvard	BRD-K32759520			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@H](N2)[C@H]1C(=O)NCC1CCCCC1	InChI=1S/C23H29N5O3/c29-12-17-18-11-28-19(7-6-16(23(28)31)15-9-24-13-25-10-15)21(27-18)20(17)22(30)26-8-14-4-2-1-3-5-14/h6-7,9-10,13-14,17-18,20-21,27,29H,1-5,8,11-12H2,(H,26,30)/t17-,18-,20+,21+/m1/s1	CMFJQPXRJRRAOF-QCFAMHMHSA-N	423.227039838							99036
BRD-K42614769	LSM-11013		54661005	InChI=1S/C29H30N4O4/c1-2-25(35)33-24-15-32-23(8-7-21(29(32)37)17-9-11-30-12-10-17)27(33)26(22(24)16-34)28(36)31-20-13-18-5-3-4-6-19(18)14-20/h3-12,20,22,24,26-27,34H,2,13-16H2,1H3,(H,31,36)/t22-,24-,26+,27+/m0/s1	SUYOEXJQLWDMBI-SVPNHEPISA-N	CCC(=O)N1[C@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@@H]1[C@@H]([C@H]2CO)C(=O)NC5Cc6ccccc6C5	BroadT	BRD-K42614769	BRD-K42614769-001-01-2	Broad Institute of MIT and Harvard	BRD-K42614769			CCC(=O)N1[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NC1Cc2ccccc2C1	InChI=1S/C29H30N4O4/c1-2-25(35)33-24-15-32-23(8-7-21(29(32)37)17-9-11-30-12-10-17)27(33)26(22(24)16-34)28(36)31-20-13-18-5-3-4-6-19(18)14-20/h3-12,20,22,24,26-27,34H,2,13-16H2,1H3,(H,31,36)/t22-,24-,26+,27+/m0/s1	SUYOEXJQLWDMBI-SVPNHEPISA-N	498.22670548							99634
BRD-K31295191	LSM-10323		54660926	InChI=1S/C27H30N2O6/c1-33-27(32)25-20(14-30)19-13-28-21(9-8-18(26(28)31)17-5-3-2-4-6-17)24(19)29(25)12-16-7-10-22-23(11-16)35-15-34-22/h5,7-11,19-20,24-25,30H,2-4,6,12-15H2,1H3/t19-,20-,24+,25-/m1/s1	ONPKFTYLPVPFLT-KYXKYNKESA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@H]2N1Cc4ccc5OCOc5c4)C6=CCCCC6	BroadT	BRD-K31295191	BRD-K31295191-001-01-1	Broad Institute of MIT and Harvard	BRD-K31295191			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]2N1Cc1ccc2OCOc2c1	InChI=1S/C27H30N2O6/c1-33-27(32)25-20(14-30)19-13-28-21(9-8-18(26(28)31)17-5-3-2-4-6-17)24(19)29(25)12-16-7-10-22-23(11-16)35-15-34-22/h5,7-11,19-20,24-25,30H,2-4,6,12-15H2,1H3/t19-,20-,24+,25-/m1/s1	ONPKFTYLPVPFLT-KYXKYNKESA-N	478.2103867							98944
BRD-K81752795	LSM-13422		54660835	InChI=1S/C27H28FN5O3/c28-18-5-3-17(4-6-18)20-7-8-23-24-21(13-32(23)27(20)36)22(14-34)25(33(24)12-16-1-2-16)26(35)30-11-19-9-10-29-15-31-19/h3-10,15-16,21-22,24-25,34H,1-2,11-14H2,(H,30,35)/t21-,22-,24+,25-/m1/s1	URDKMROJZUNSLX-YQIMAOPZSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@H]2N(CC5CC5)[C@H]1C(=O)NCc6ccncn6	BroadT	BRD-K81752795	BRD-K81752795-001-01-0	Broad Institute of MIT and Harvard	BRD-K81752795			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]2N(CC2CC2)[C@H]1C(=O)NCc1ccncn1	InChI=1S/C27H28FN5O3/c28-18-5-3-17(4-6-18)20-7-8-23-24-21(13-32(23)27(20)36)22(14-34)25(33(24)12-16-1-2-16)26(35)30-11-19-9-10-29-15-31-19/h3-10,15-16,21-22,24-25,34H,1-2,11-14H2,(H,30,35)/t21-,22-,24+,25-/m1/s1	URDKMROJZUNSLX-YQIMAOPZSA-N	489.217618006							102062
BRD-K39431644	LSM-10823		54660758	InChI=1S/C25H30N4O5S/c1-35(33,34)29-22-19(14-28-21(22)7-6-18(25(28)32)17-4-2-3-5-17)20(15-30)23(29)24(31)27-13-10-16-8-11-26-12-9-16/h4,6-9,11-12,19-20,22-23,30H,2-3,5,10,13-15H2,1H3,(H,27,31)/t19-,20-,22+,23-/m1/s1	BCVWPOWNMNUOMW-YXPKMTABSA-N	CS(=O)(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@@H]12)C(=O)NCCc5ccncc5	BroadT	BRD-K39431644	BRD-K39431644-001-01-7	Broad Institute of MIT and Harvard	BRD-K39431644			CS(=O)(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]12)C(=O)NCCc1ccncc1	InChI=1S/C25H30N4O5S/c1-35(33,34)29-22-19(14-28-21(22)7-6-18(25(28)32)17-4-2-3-5-17)20(15-30)23(29)24(31)27-13-10-16-8-11-26-12-9-16/h4,6-9,11-12,19-20,22-23,30H,2-3,5,10,13-15H2,1H3,(H,27,31)/t19-,20-,22+,23-/m1/s1	BCVWPOWNMNUOMW-YXPKMTABSA-N	498.19369079							99444
BRD-K18412690	LSM-9539		54660720	InChI=1S/C25H29N3O3/c1-15(16-7-3-2-4-8-16)26-24(30)23-20(14-29)19-13-28-21(22(19)27-23)12-11-18(25(28)31)17-9-5-6-10-17/h2-4,7-9,11-12,15,19-20,22-23,27,29H,5-6,10,13-14H2,1H3,(H,26,30)/t15-,19-,20-,22+,23-/m0/s1	DEERBQNZFWMEPS-DEPRQGDXSA-N	C[C@H](NC(=O)[C@H]1N[C@@H]2[C@@H](CN3C(=O)C(=CC=C23)C4=CCCC4)[C@@H]1CO)c5ccccc5	BroadT	BRD-K18412690	BRD-K18412690-001-01-5	Broad Institute of MIT and Harvard	BRD-K18412690			C[C@H](NC(=O)[C@H]1N[C@@H]2[C@@H](Cn3c2ccc(C2=CCCC2)c3=O)[C@@H]1CO)c1ccccc1	InChI=1S/C25H29N3O3/c1-15(16-7-3-2-4-8-16)26-24(30)23-20(14-29)19-13-28-21(22(19)27-23)12-11-18(25(28)31)17-9-5-6-10-17/h2-4,7-9,11-12,15,19-20,22-23,27,29H,5-6,10,13-14H2,1H3,(H,26,30)/t15-,19-,20-,22+,23-/m0/s1	DEERBQNZFWMEPS-DEPRQGDXSA-N	419.220891818							98160
BRD-K59893315	LSM-12046		54660709	InChI=1S/C22H23FN2O5/c1-3-18(27)25-17-10-24-16(20(25)19(15(17)11-26)22(29)30-2)9-8-14(21(24)28)12-4-6-13(23)7-5-12/h4-9,15,17,19-20,26H,3,10-11H2,1-2H3/t15-,17-,19+,20+/m0/s1	HISNYEFWMKAJQA-SMMRIJLZSA-N	CCC(=O)N1[C@H]2CN3C(=CC=C(C3=O)c4ccc(F)cc4)[C@@H]1[C@@H]([C@H]2CO)C(=O)OC	BroadT	BRD-K59893315	BRD-K59893315-001-01-1	Broad Institute of MIT and Harvard	BRD-K59893315			CCC(=O)N1[C@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)OC	InChI=1S/C22H23FN2O5/c1-3-18(27)25-17-10-24-16(20(25)19(15(17)11-26)22(29)30-2)9-8-14(21(24)28)12-4-6-13(23)7-5-12/h4-9,15,17,19-20,26H,3,10-11H2,1-2H3/t15-,17-,19+,20+/m0/s1	HISNYEFWMKAJQA-SMMRIJLZSA-N	414.159100056							100672
BRD-M54407015	LSM-45045		54660827	InChI=1S/C19H25N3O3/c1-2-4-11-7-8-15-16-13(9-22(15)19(11)25)14(10-23)17(21-16)18(24)20-12-5-3-6-12/h2,4,7-8,12-14,16-17,21,23H,3,5-6,9-10H2,1H3,(H,20,24)/t13-,14-,16+,17-/m1/s1	AQJORRFMBMOBOI-TXCZRRACSA-N	CC=CC1=CC=C2[C@H]3N[C@H]([C@H](CO)[C@H]3CN2C1=O)C(=O)NC4CCC4	BroadT	BRD-M54407015	BRD-M54407015-001-01-6	Broad Institute of MIT and Harvard	BRD-M54407015		C\C=C\c1ccc2[C@H]3N[C@@H](C(=O)NC4CCC4)[C@H](CO)[C@H]3Cn2c1=O.OC[C@@H]1[C@H]2Cn3c(=O)c(ccc3[C@H]2N[C@H]1C(=O)NC1CCC1)\C=C/C	C\C=C\c1ccc2[C@H]3N[C@@H](C(=O)NC4CCC4)[C@H](CO)[C@H]3Cn2c1=O.OC[C@@H]1[C@H]2Cn3c(=O)c(ccc3[C@H]2N[C@H]1C(=O)NC1CCC1)\C=C/C	InChI=1S/2C19H25N3O3/c2*1-2-4-11-7-8-15-16-13(9-22(15)19(11)25)14(10-23)17(21-16)18(24)20-12-5-3-6-12/h2*2,4,7-8,12-14,16-17,21,23H,3,5-6,9-10H2,1H3,(H,20,24)/b4-2+;4-2-/t2*13-,14-,16+,17-/m11/s1	GQOYXRHDZAOOFT-OMAUUQPDSA-N	343.18959169							103282
BRD-K54585147	LSM-11740		54660859	InChI=1S/C27H26FN3O3/c28-22-8-4-3-7-18(22)19-9-10-23-24-20(14-31(23)26(19)33)21(15-32)25(29-24)27(34)30-12-11-16-5-1-2-6-17(16)13-30/h1-10,20-21,24-25,29,32H,11-15H2/t20-,21-,24+,25-/m0/s1	FZFLVCQZKXFTSN-MHOPESGUSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@@H]2N[C@@H]1C(=O)N5CCc6ccccc6C5	BroadT	BRD-K54585147	BRD-K54585147-001-01-2	Broad Institute of MIT and Harvard	BRD-K54585147			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@@H]2N[C@@H]1C(=O)N1CCc2ccccc2C1	InChI=1S/C27H26FN3O3/c28-22-8-4-3-7-18(22)19-9-10-23-24-20(14-31(23)26(19)33)21(15-32)25(29-24)27(34)30-12-11-16-5-1-2-6-17(16)13-30/h1-10,20-21,24-25,29,32H,11-15H2/t20-,21-,24+,25-/m0/s1	FZFLVCQZKXFTSN-MHOPESGUSA-N	459.195819922							100365
BRD-K19882533	LSM-9632		54660841	InChI=1S/C27H33N3O5/c1-34-23-5-3-2-4-18(23)19-8-9-21-25-24(27(33)28-10-12-35-13-11-28)20(16-31)22(15-30(21)26(19)32)29(25)14-17-6-7-17/h2-5,8-9,17,20,22,24-25,31H,6-7,10-16H2,1H3/t20-,22-,24+,25+/m1/s1	ZZGFZYXZJHIJMZ-KAKDDGLXSA-N	COc1ccccc1C2=CC=C3[C@H]4[C@H]([C@H](CO)[C@@H](CN3C2=O)N4CC5CC5)C(=O)N6CCOCC6	BroadT	BRD-K19882533	BRD-K19882533-001-01-9	Broad Institute of MIT and Harvard	BRD-K19882533			COc1ccccc1-c1ccc2[C@H]3[C@H]([C@H](CO)[C@@H](Cn2c1=O)N3CC1CC1)C(=O)N1CCOCC1	InChI=1S/C27H33N3O5/c1-34-23-5-3-2-4-18(23)19-8-9-21-25-24(27(33)28-10-12-35-13-11-28)20(16-31)22(15-30(21)26(19)32)29(25)14-17-6-7-17/h2-5,8-9,17,20,22,24-25,31H,6-7,10-16H2,1H3/t20-,22-,24+,25+/m1/s1	ZZGFZYXZJHIJMZ-KAKDDGLXSA-N	479.242021186							98253
MLS005000179	LSM-13533	BRD-K83477078	54661003	InChI=1S/C29H30N4O4/c34-17-23-22-16-32-24(9-8-21(29(32)37)19-4-2-1-3-5-19)25(22)33(28(36)20-6-7-20)26(23)27(35)31-15-12-18-10-13-30-14-11-18/h1-5,8-11,13-14,20,22-23,25-26,34H,6-7,12,15-17H2,(H,31,35)/t22-,23-,25+,26-/m0/s1	OYSHQHUZVWGKJD-LJCOXQHRSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4)[C@@H]2N([C@@H]1C(=O)NCCc5ccncc5)C(=O)C6CC6	BroadT	BRD-K83477078	BRD-K83477078-001-01-0	Broad Institute of MIT and Harvard	BRD-K83477078			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@@H]2N([C@@H]1C(=O)NCCc1ccncc1)C(=O)C1CC1	InChI=1S/C29H30N4O4/c34-17-23-22-16-32-24(9-8-21(29(32)37)19-4-2-1-3-5-19)25(22)33(28(36)20-6-7-20)26(23)27(35)31-15-12-18-10-13-30-14-11-18/h1-5,8-11,13-14,20,22-23,25-26,34H,6-7,12,15-17H2,(H,31,35)/t22-,23-,25+,26-/m0/s1	OYSHQHUZVWGKJD-LJCOXQHRSA-N	498.22670548							102175
BRD-K95622068	LSM-14292		54660732	InChI=1S/C26H32N6O3/c1-3-11-31-22-14-32-21(7-6-19(26(32)35)17-5-4-9-27-12-17)24(31)23(20(22)15-33)25(34)28-10-8-18-13-30(2)16-29-18/h4-7,9,12-13,16,20,22-24,33H,3,8,10-11,14-15H2,1-2H3,(H,28,34)/t20-,22-,23+,24+/m0/s1	HJZHDZIYUXDLGN-IQFVJIFQSA-N	CCCN1[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCc5cn(C)cn5	BroadT	BRD-K95622068	BRD-K95622068-001-01-9	Broad Institute of MIT and Harvard	BRD-K95622068			CCCN1[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)NCCc1cn(C)cn1	InChI=1S/C26H32N6O3/c1-3-11-31-22-14-32-21(7-6-19(26(32)35)17-5-4-9-27-12-17)24(31)23(20(22)15-33)25(34)28-10-8-18-13-30(2)16-29-18/h4-7,9,12-13,16,20,22-24,33H,3,8,10-11,14-15H2,1-2H3,(H,28,34)/t20-,22-,23+,24+/m0/s1	HJZHDZIYUXDLGN-IQFVJIFQSA-N	476.253588944							102946
BRD-K90640851	LSM-14012		54660746	InChI=1S/C24H28ClN3O3/c25-19-8-3-2-7-16(19)13-28-22-17(14-27-20(22)9-6-10-21(27)30)18(15-29)23(28)24(31)26-11-4-1-5-12-26/h2-3,6-10,17-18,22-23,29H,1,4-5,11-15H2/t17-,18-,22+,23-/m1/s1	VQCZTXNNKFBGGK-FJDVCKPCSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N(Cc4ccccc4Cl)[C@H]1C(=O)N5CCCCC5	BroadT	BRD-K90640851	BRD-K90640851-001-01-7	Broad Institute of MIT and Harvard	BRD-K90640851			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N(Cc2ccccc2Cl)[C@H]1C(=O)N1CCCCC1	InChI=1S/C24H28ClN3O3/c25-19-8-3-2-7-16(19)13-28-22-17(14-27-20(22)9-6-10-21(27)30)18(15-29)23(28)24(31)26-11-4-1-5-12-26/h2-3,6-10,17-18,22-23,29H,1,4-5,11-15H2/t17-,18-,22+,23-/m1/s1	VQCZTXNNKFBGGK-FJDVCKPCSA-N	441.181919496							102665
CHEMBL3187550	LSM-43465	BRD-K31290914	54660686	InChI=1S/C27H28N4O3/c32-17-22-21-16-31-23(9-8-20(27(31)34)7-6-18-4-2-1-3-5-18)24(21)30-25(22)26(33)29-15-12-19-10-13-28-14-11-19/h1-11,13-14,21-22,24-25,30,32H,12,15-17H2,(H,29,33)/b7-6+/t21-,22-,24+,25-/m1/s1	XODDPLRMWVREGP-LVRNKHJESA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(\C=C\c4ccccc4)C3=O)[C@H]2N[C@H]1C(=O)NCCc5ccncc5	BroadT	BRD-K31290914	BRD-K31290914-001-01-8	Broad Institute of MIT and Harvard	BRD-K31290914			OC[C@@H]1[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]2N[C@H]1C(=O)NCCc1ccncc1	InChI=1S/C27H28N4O3/c32-17-22-21-16-31-23(9-8-20(27(31)34)7-6-18-4-2-1-3-5-18)24(21)30-25(22)26(33)29-15-12-19-10-13-28-14-11-19/h1-11,13-14,21-22,24-25,30,32H,12,15-17H2,(H,29,33)/b7-6+/t21-,22-,24+,25-/m1/s1	XODDPLRMWVREGP-LVRNKHJESA-N	456.216140796							
BRD-K85126547	LSM-13631		54660726	InChI=1S/C26H31FN4O4/c1-14(2)28-26(35)31-22-18(19(13-32)23(31)24(33)29-15-6-5-7-15)12-30-21(22)11-10-17(25(30)34)16-8-3-4-9-20(16)27/h3-4,8-11,14-15,18-19,22-23,32H,5-7,12-13H2,1-2H3,(H,28,35)(H,29,33)/t18-,19-,22+,23-/m0/s1	LYKIZZQLQMQPAT-LBVMUVSTSA-N	CC(C)NC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]12)C(=O)NC5CCC5	BroadT	BRD-K85126547	BRD-K85126547-001-01-4	Broad Institute of MIT and Harvard	BRD-K85126547			CC(C)NC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]12)C(=O)NC1CCC1	InChI=1S/C26H31FN4O4/c1-14(2)28-26(35)31-22-18(19(13-32)23(31)24(33)29-15-6-5-7-15)12-30-21(22)11-10-17(25(30)34)16-8-3-4-9-20(16)27/h3-4,8-11,14-15,18-19,22-23,32H,5-7,12-13H2,1-2H3,(H,28,35)(H,29,33)/t18-,19-,22+,23-/m0/s1	LYKIZZQLQMQPAT-LBVMUVSTSA-N	482.232933712							102278
BRD-K58600416	LSM-11966		54660816	InChI=1S/C26H35N5O4/c1-29(2)11-5-10-27-25(33)23-20(14-32)22-13-31-21(24(23)30(22)12-18-15-35-16-28-18)9-8-19(26(31)34)17-6-3-4-7-17/h6,8-9,15-16,20,22-24,32H,3-5,7,10-14H2,1-2H3,(H,27,33)/t20-,22-,23+,24+/m0/s1	GJSDPDSQBZFABN-IQFVJIFQSA-N	CN(C)CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@H]1N2Cc5cocn5	BroadT	BRD-K58600416	BRD-K58600416-001-01-9	Broad Institute of MIT and Harvard	BRD-K58600416			CN(C)CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]1N2Cc1cocn1	InChI=1S/C26H35N5O4/c1-29(2)11-5-10-27-25(33)23-20(14-32)22-13-31-21(24(23)30(22)12-18-15-35-16-28-18)9-8-19(26(31)34)17-6-3-4-7-17/h6,8-9,15-16,20,22-24,32H,3-5,7,10-14H2,1-2H3,(H,27,33)/t20-,22-,23+,24+/m0/s1	GJSDPDSQBZFABN-IQFVJIFQSA-N	481.26890465							100592
BRD-K61152698	LSM-12129		54660948	InChI=1S/C26H28N4O3/c1-16(17-6-4-3-5-7-17)28-25(32)24-21(15-31)20-14-30-22(23(20)29(24)2)9-8-19(26(30)33)18-10-12-27-13-11-18/h3-13,16,20-21,23-24,31H,14-15H2,1-2H3,(H,28,32)/t16-,20+,21+,23-,24+/m0/s1	XRCXBUPUCMDVHO-QXGZYIMISA-N	C[C@H](NC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@H]2N1C)c5ccccc5	BroadT	BRD-K61152698	BRD-K61152698-001-01-5	Broad Institute of MIT and Harvard	BRD-K61152698			C[C@H](NC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]2N1C)c1ccccc1	InChI=1S/C26H28N4O3/c1-16(17-6-4-3-5-7-17)28-25(32)24-21(15-31)20-14-30-22(23(20)29(24)2)9-8-19(26(30)33)18-10-12-27-13-11-18/h3-13,16,20-21,23-24,31H,14-15H2,1-2H3,(H,28,32)/t16-,20+,21+,23-,24+/m0/s1	XRCXBUPUCMDVHO-QXGZYIMISA-N	444.216140796							100755
BRD-K08624646	LSM-8950		54660944	InChI=1S/C24H28FN3O3/c25-15-6-4-5-14(11-15)17-9-10-20-21-18(12-28(20)24(17)31)19(13-29)22(27-21)23(30)26-16-7-2-1-3-8-16/h4-6,9-11,16,18-19,21-22,27,29H,1-3,7-8,12-13H2,(H,26,30)/t18-,19-,21+,22-/m1/s1	VBHCGIGHTBBWQL-KRXUUXHPSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H]2N[C@H]1C(=O)NC4CCCCC4)c5cccc(F)c5	BroadT	BRD-K08624646	BRD-K08624646-001-01-2	Broad Institute of MIT and Harvard	BRD-K08624646			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@H]2N[C@H]1C(=O)NC1CCCCC1	InChI=1S/C24H28FN3O3/c25-15-6-4-5-14(11-15)17-9-10-20-21-18(12-28(20)24(17)31)19(13-29)22(27-21)23(30)26-16-7-2-1-3-8-16/h4-6,9-11,16,18-19,21-22,27,29H,1-3,7-8,12-13H2,(H,26,30)/t18-,19-,21+,22-/m1/s1	VBHCGIGHTBBWQL-KRXUUXHPSA-N	425.211469986							97571
BRD-K29827452	LSM-10238		54660892	InChI=1S/C25H32N2O5/c1-32-25(31)21-18(14-28)20-13-26-19(12-11-17(24(26)30)15-7-5-6-8-15)22(21)27(20)23(29)16-9-3-2-4-10-16/h7,11-12,16,18,20-22,28H,2-6,8-10,13-14H2,1H3/t18-,20-,21+,22+/m1/s1	FAIHTTLOGWXJOT-YJMBLLCNSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]1N2C(=O)C4CCCCC4)C5=CCCC5	BroadT	BRD-K29827452	BRD-K29827452-001-01-9	Broad Institute of MIT and Harvard	BRD-K29827452			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]1N2C(=O)C1CCCCC1	InChI=1S/C25H32N2O5/c1-32-25(31)21-18(14-28)20-13-26-19(12-11-17(24(26)30)15-7-5-6-8-15)22(21)27(20)23(29)16-9-3-2-4-10-16/h7,11-12,16,18,20-22,28H,2-6,8-10,13-14H2,1H3/t18-,20-,21+,22+/m1/s1	FAIHTTLOGWXJOT-YJMBLLCNSA-N	440.231122144							98859
BRD-M94512770	LSM-45086		54660985	InChI=1S/C28H29N5O4/c1-3-7-19-10-11-23-24-20(15-32(23)27(19)36)21(16-34)25(33(24)28(37)22-14-29-12-13-30-22)26(35)31-17(2)18-8-5-4-6-9-18/h3-14,17,20-21,24-25,34H,15-16H2,1-2H3,(H,31,35)/t17-,20+,21+,24-,25+/m1/s1	GAGDVGIWPFJCDU-SBFQEZKYSA-N	CC=CC1=CC=C2[C@H]3[C@@H](CN2C1=O)[C@H](CO)[C@H](N3C(=O)c4cnccn4)C(=O)N[C@H](C)c5ccccc5	BroadT	BRD-M94512770	BRD-M94512770-001-01-0	Broad Institute of MIT and Harvard	BRD-M94512770		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N[C@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N[C@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@@H]23)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N[C@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@@H]23)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)N[C@H](C)c4ccccc4)N(C(=O)c4nccnc4)[C@@H]23)c1=O	InChI=1S/2C28H29N5O4/c2*1-3-7-19-10-11-23-24-20(15-32(23)27(19)36)21(16-34)25(33(24)28(37)22-14-29-12-13-30-22)26(35)31-17(2)18-8-5-4-6-9-18/h2*3-14,17,20-21,24-25,34H,15-16H2,1-2H3,(H,31,35)/b7-3+;7-3-/t2*17-,20+,21+,24-,25+/m11/s1	UURQJTAZHVTRJQ-MYKHNXKGSA-N	499.221954458							103323
BRD-M98484762	LSM-45093		54660965	InChI=1S/C21H21FN2O6S/c1-2-5-12-8-9-15-19-18(21(27)28)13(11-25)16(10-23(15)20(12)26)24(19)31(29,30)17-7-4-3-6-14(17)22/h2-9,13,16,18-19,25H,10-11H2,1H3,(H,27,28)/t13-,16-,18+,19+/m0/s1	YSPVRUAWSOLRRU-PTKHLAPESA-N	CC=CC1=CC=C2[C@@H]3[C@@H]([C@@H](CO)[C@H](CN2C1=O)N3S(=O)(=O)c4ccccc4F)C(=O)O	BroadT	BRD-M98484762	BRD-M98484762-001-01-8	Broad Institute of MIT and Harvard	BRD-M98484762		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(O)=O)[C@@H]2N3S(=O)(=O)c2ccccc2F)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(O)=O)[C@@H]2N3S(=O)(=O)c2ccccc2F)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(O)=O)[C@@H]2N3S(=O)(=O)c2ccccc2F)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(O)=O)[C@@H]2N3S(=O)(=O)c2ccccc2F)c1=O	InChI=1S/2C21H21FN2O6S/c2*1-2-5-12-8-9-15-19-18(21(27)28)13(11-25)16(10-23(15)20(12)26)24(19)31(29,30)17-7-4-3-6-14(17)22/h2*2-9,13,16,18-19,25H,10-11H2,1H3,(H,27,28)/b5-2+;5-2-/t2*13-,16-,18+,19+/m00/s1	FZXWICNJJBUHOD-PZQBUFLKSA-N	448.110435302							103330
BRD-K92439564	LSM-14099		54660671	InChI=1S/C25H28N6O4/c1-29-12-17(27-15-29)10-11-26-24(34)23-19(14-32)18-13-30-20(8-5-9-21(30)33)22(18)31(23)25(35)28-16-6-3-2-4-7-16/h2-9,12,15,18-19,22-23,32H,10-11,13-14H2,1H3,(H,26,34)(H,28,35)/t18-,19-,22+,23-/m0/s1	WOLKNTYXBIJULP-LBVMUVSTSA-N	Cn1cnc(CCNC(=O)[C@@H]2[C@@H](CO)[C@@H]3CN4C(=O)C=CC=C4[C@@H]3N2C(=O)Nc5ccccc5)c1	BroadT	BRD-K92439564	BRD-K92439564-001-01-0	Broad Institute of MIT and Harvard	BRD-K92439564			Cn1cnc(CCNC(=O)[C@@H]2[C@@H](CO)[C@@H]3Cn4c(cccc4=O)[C@@H]3N2C(=O)Nc2ccccc2)c1	InChI=1S/C25H28N6O4/c1-29-12-17(27-15-29)10-11-26-24(34)23-19(14-32)18-13-30-20(8-5-9-21(30)33)22(18)31(23)25(35)28-16-6-3-2-4-7-16/h2-9,12,15,18-19,22-23,32H,10-11,13-14H2,1H3,(H,26,34)(H,28,35)/t18-,19-,22+,23-/m0/s1	WOLKNTYXBIJULP-LBVMUVSTSA-N	476.217203436							102753
BRD-M59406954	LSM-45051		54660642	InChI=1S/C23H29N5O5S/c1-3-5-14-8-9-17-21-20(22(30)25-15-6-4-7-15)16(12-29)18(10-27(17)23(14)31)28(21)34(32,33)19-11-26(2)13-24-19/h3,5,8-9,11,13,15-16,18,20-21,29H,4,6-7,10,12H2,1-2H3,(H,25,30)/t16-,18-,20+,21+/m1/s1	FBXKHEMXYYDERF-LMQGHGSNSA-N	CC=CC1=CC=C2[C@H]3[C@H]([C@H](CO)[C@@H](CN2C1=O)N3S(=O)(=O)c4cn(C)cn4)C(=O)NC5CCC5	BroadT	BRD-M59406954	BRD-M59406954-001-01-6	Broad Institute of MIT and Harvard	BRD-M59406954		C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NC4CCC4)[C@H]2N3S(=O)(=O)c2ncn(C)c2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NC4CCC4)[C@H]2N3S(=O)(=O)c2ncn(C)c2)c1=O	C\C=C\c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NC4CCC4)[C@H]2N3S(=O)(=O)c2ncn(C)c2)c1=O.C\C=C/c1ccc2n(C[C@@H]3[C@@H](CO)[C@H](C(=O)NC4CCC4)[C@H]2N3S(=O)(=O)c2ncn(C)c2)c1=O	InChI=1S/2C23H29N5O5S/c2*1-3-5-14-8-9-17-21-20(22(30)25-15-6-4-7-15)16(12-29)18(10-27(17)23(14)31)28(21)34(32,33)19-11-26(2)13-24-19/h2*3,5,8-9,11,13,15-16,18,20-21,29H,4,6-7,10,12H2,1-2H3,(H,25,30)/b5-3+;5-3-/t2*16-,18-,20+,21+/m11/s1	MAYPJGPMDPCVRU-HNCSKEEBSA-N	487.188939768							103288
BRD-K71087530	LSM-12768		54660904	InChI=1S/C23H27N3O3/c27-14-17-18-13-26-19(10-9-16(22(26)28)15-7-3-1-4-8-15)21(24-18)20(17)23(29)25-11-5-2-6-12-25/h1,3-4,7-10,17-18,20-21,24,27H,2,5-6,11-14H2/t17-,18-,20+,21+/m1/s1	JIIRQJXSNNBKIS-QCFAMHMHSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H](N2)[C@H]1C(=O)N4CCCCC4)c5ccccc5	BroadT	BRD-K71087530	BRD-K71087530-001-01-3	Broad Institute of MIT and Harvard	BRD-K71087530			OC[C@@H]1[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H](N2)[C@H]1C(=O)N1CCCCC1	InChI=1S/C23H27N3O3/c27-14-17-18-13-26-19(10-9-16(22(26)28)15-7-3-1-4-8-15)21(24-18)20(17)23(29)25-11-5-2-6-12-25/h1,3-4,7-10,17-18,20-21,24,27H,2,5-6,11-14H2/t17-,18-,20+,21+/m1/s1	JIIRQJXSNNBKIS-QCFAMHMHSA-N	393.205241754							101405
BRD-K00951345	LSM-8494		54660860	InChI=1S/C19H25N3O4/c1-20(2)19(26)17-13(10-23)12-9-21-14(7-4-8-15(21)24)16(12)22(17)18(25)11-5-3-6-11/h4,7-8,11-13,16-17,23H,3,5-6,9-10H2,1-2H3/t12-,13-,16+,17-/m0/s1	BHHDRXNUGFHOLE-CLROSIBMSA-N	CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N1C(=O)C4CCC4	BroadT	BRD-K00951345	BRD-K00951345-001-01-1	Broad Institute of MIT and Harvard	BRD-K00951345			CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@@H]2N1C(=O)C1CCC1	InChI=1S/C19H25N3O4/c1-20(2)19(26)17-13(10-23)12-9-21-14(7-4-8-15(21)24)16(12)22(17)18(25)11-5-3-6-11/h4,7-8,11-13,16-17,23H,3,5-6,9-10H2,1-2H3/t12-,13-,16+,17-/m0/s1	BHHDRXNUGFHOLE-CLROSIBMSA-N	359.18450631							97115
BRD-K69332942	LSM-12656		54660919	InChI=1S/C28H29FN4O3/c29-20-5-1-3-18(11-20)12-31-27(35)25-22(16-34)24-15-33-23(26(25)32(24)14-17-6-7-17)9-8-21(28(33)36)19-4-2-10-30-13-19/h1-5,8-11,13,17,22,24-26,34H,6-7,12,14-16H2,(H,31,35)/t22-,24-,25+,26+/m0/s1	BFDAKIJRIQBPOO-ADXHGGABSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]([C@@H]1C(=O)NCc5cccc(F)c5)N2CC6CC6	BroadT	BRD-K69332942	BRD-K69332942-001-01-9	Broad Institute of MIT and Harvard	BRD-K69332942			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]([C@@H]1C(=O)NCc1cccc(F)c1)N2CC1CC1	InChI=1S/C28H29FN4O3/c29-20-5-1-3-18(11-20)12-31-27(35)25-22(16-34)24-15-33-23(26(25)32(24)14-17-6-7-17)9-8-21(28(33)36)19-4-2-10-30-13-19/h1-5,8-11,13,17,22,24-26,34H,6-7,12,14-16H2,(H,31,35)/t22-,24-,25+,26+/m0/s1	BFDAKIJRIQBPOO-ADXHGGABSA-N	488.222369028							101290
BRD-K42758410	LSM-11029		54660905	InChI=1S/C22H21FN4O3S/c1-26-17-10-27-16(6-5-14(21(27)30)12-3-2-4-13(23)9-12)19(26)18(15(17)11-28)20(29)25-22-24-7-8-31-22/h2-9,15,17-19,28H,10-11H2,1H3,(H,24,25,29)/t15-,17-,18+,19+/m0/s1	CVDFBNGMHHTSQY-GDAAHCPNSA-N	CN1[C@H]2CN3C(=CC=C(C3=O)c4cccc(F)c4)[C@@H]1[C@@H]([C@H]2CO)C(=O)Nc5nccs5	BroadT	BRD-K42758410	BRD-K42758410-001-01-0	Broad Institute of MIT and Harvard	BRD-K42758410			CN1[C@H]2Cn3c(ccc(-c4cccc(F)c4)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)Nc1nccs1	InChI=1S/C22H21FN4O3S/c1-26-17-10-27-16(6-5-14(21(27)30)12-3-2-4-13(23)9-12)19(26)18(15(17)11-28)20(29)25-22-24-7-8-31-22/h2-9,15,17-19,28H,10-11H2,1H3,(H,24,25,29)/t15-,17-,18+,19+/m0/s1	CVDFBNGMHHTSQY-GDAAHCPNSA-N	440.131839462							99650
BRD-K41761456	LSM-10966		54660881	InChI=1S/C27H36N4O4/c1-29-24-21(22(17-32)25(29)26(33)28-11-14-30-12-4-3-5-13-30)16-31-23(24)10-9-20(27(31)34)18-7-6-8-19(15-18)35-2/h6-10,15,21-22,24-25,32H,3-5,11-14,16-17H2,1-2H3,(H,28,33)/t21-,22-,24+,25-/m1/s1	AVDNHTGKAVTISS-YQIMAOPZSA-N	COc1cccc(c1)C2=CC=C3[C@@H]4[C@H](CN3C2=O)[C@@H](CO)[C@@H](N4C)C(=O)NCCN5CCCCC5	BroadT	BRD-K41761456	BRD-K41761456-001-01-0	Broad Institute of MIT and Harvard	BRD-K41761456			COc1cccc(c1)-c1ccc2[C@@H]3[C@H](Cn2c1=O)[C@@H](CO)[C@@H](N3C)C(=O)NCCN1CCCCC1	InChI=1S/C27H36N4O4/c1-29-24-21(22(17-32)25(29)26(33)28-11-14-30-12-4-3-5-13-30)16-31-23(24)10-9-20(27(31)34)18-7-6-8-19(15-18)35-2/h6-10,15,21-22,24-25,32H,3-5,11-14,16-17H2,1-2H3,(H,28,33)/t21-,22-,24+,25-/m1/s1	AVDNHTGKAVTISS-YQIMAOPZSA-N	480.273655672							99587
BRD-M77861050	LSM-45067		54661009	InChI=1S/C24H33N3O4/c1-3-7-17-10-11-19-22-21(23(30)25-12-16-8-5-4-6-9-16)18(14-28)20(27(22)15(2)29)13-26(19)24(17)31/h3,7,10-11,16,18,20-22,28H,4-6,8-9,12-14H2,1-2H3,(H,25,30)/t18-,20-,21+,22+/m0/s1	NJGAJUNFGSSUAO-VXSCBNMQSA-N	CC=CC1=CC=C2[C@@H]3[C@@H]([C@@H](CO)[C@H](CN2C1=O)N3C(=O)C)C(=O)NCC4CCCCC4	BroadT	BRD-M77861050	BRD-M77861050-001-01-3	Broad Institute of MIT and Harvard	BRD-M77861050		C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCC4CCCCC4)[C@@H]2N3C(C)=O)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCC4CCCCC4)[C@@H]2N3C(C)=O)c1=O	C\C=C\c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCC4CCCCC4)[C@@H]2N3C(C)=O)c1=O.C\C=C/c1ccc2n(C[C@H]3[C@H](CO)[C@@H](C(=O)NCC4CCCCC4)[C@@H]2N3C(C)=O)c1=O	InChI=1S/2C24H33N3O4/c2*1-3-7-17-10-11-19-22-21(23(30)25-12-16-8-5-4-6-9-16)18(14-28)20(27(22)15(2)29)13-26(19)24(17)31/h2*3,7,10-11,16,18,20-22,28H,4-6,8-9,12-14H2,1-2H3,(H,25,30)/b7-3+;7-3-/t2*18-,20-,21+,22+/m00/s1	MTFSLJXEIRKOKM-NLPWMXNUSA-N	427.247106566							103304
BRD-K46670060	LSM-11277		54660731	InChI=1S/C24H33N3O4/c28-14-18-17-13-26-19(7-4-8-20(26)29)22(17)27(21(30)11-15-9-10-15)23(18)24(31)25-12-16-5-2-1-3-6-16/h4,7-8,15-18,22-23,28H,1-3,5-6,9-14H2,(H,25,31)/t17-,18-,22+,23-/m1/s1	ZDTYRDGQWDVLBB-FJDVCKPCSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@H]2N([C@H]1C(=O)NCC4CCCCC4)C(=O)CC5CC5	BroadT	BRD-K46670060	BRD-K46670060-001-01-6	Broad Institute of MIT and Harvard	BRD-K46670060			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N([C@H]1C(=O)NCC1CCCCC1)C(=O)CC1CC1	InChI=1S/C24H33N3O4/c28-14-18-17-13-26-19(7-4-8-20(26)29)22(17)27(21(30)11-15-9-10-15)23(18)24(31)25-12-16-5-2-1-3-6-16/h4,7-8,15-18,22-23,28H,1-3,5-6,9-14H2,(H,25,31)/t17-,18-,22+,23-/m1/s1	ZDTYRDGQWDVLBB-FJDVCKPCSA-N	427.247106566							99898
BRD-K19358815	LSM-9594		54660934	InChI=1S/C23H29N5O3/c29-12-17-18-11-28-19(7-6-16(23(28)31)15-9-24-13-25-10-15)21(27-18)20(17)22(30)26-8-14-4-2-1-3-5-14/h6-7,9-10,13-14,17-18,20-21,27,29H,1-5,8,11-12H2,(H,26,30)/t17-,18-,20+,21+/m0/s1	CMFJQPXRJRRAOF-FMWKFLBASA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H](N2)[C@@H]1C(=O)NCC4CCCCC4)c5cncnc5	BroadT	BRD-K19358815	BRD-K19358815-001-01-9	Broad Institute of MIT and Harvard	BRD-K19358815			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cncnc4)c3=O)[C@@H](N2)[C@@H]1C(=O)NCC1CCCCC1	InChI=1S/C23H29N5O3/c29-12-17-18-11-28-19(7-6-16(23(28)31)15-9-24-13-25-10-15)21(27-18)20(17)22(30)26-8-14-4-2-1-3-5-14/h6-7,9-10,13-14,17-18,20-21,27,29H,1-5,8,11-12H2,(H,26,30)/t17-,18-,20+,21+/m0/s1	CMFJQPXRJRRAOF-FMWKFLBASA-N	423.227039838							98215
BRD-K15232561	LSM-9343		54660722	InChI=1S/C24H27F3N4O4/c25-24(26,27)5-7-30-20-17(18(14-32)21(30)23(34)29-8-10-35-11-9-29)13-31-19(20)4-3-16(22(31)33)15-2-1-6-28-12-15/h1-4,6,12,17-18,20-21,32H,5,7-11,13-14H2/t17-,18-,20+,21-/m1/s1	FOQMOMHPOVABOQ-RMVXJAJNSA-N	OC[C@@H]1[C@H]2CN3C(=CC=C(C3=O)c4cccnc4)[C@H]2N(CCC(F)(F)F)[C@H]1C(=O)N5CCOCC5	BroadT	BRD-K15232561	BRD-K15232561-001-01-6	Broad Institute of MIT and Harvard	BRD-K15232561			OC[C@@H]1[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]2N(CCC(F)(F)F)[C@H]1C(=O)N1CCOCC1	InChI=1S/C24H27F3N4O4/c25-24(26,27)5-7-30-20-17(18(14-32)21(30)23(34)29-8-10-35-11-9-29)13-31-19(20)4-3-16(22(31)33)15-2-1-6-28-12-15/h1-4,6,12,17-18,20-21,32H,5,7-11,13-14H2/t17-,18-,20+,21-/m1/s1	FOQMOMHPOVABOQ-RMVXJAJNSA-N	492.198439984							97964
BRD-K11402657	LSM-9122		54660805	InChI=1S/C30H37N3O3/c1-2-14-32-27-24(17-33-26(27)13-12-23(30(33)36)19-8-4-3-5-9-19)25(18-34)28(32)29(35)31-22-15-20-10-6-7-11-21(20)16-22/h6-8,10-13,22,24-25,27-28,34H,2-5,9,14-18H2,1H3,(H,31,35)/t24-,25-,27+,28-/m0/s1	OSYNMQZPZHDZRS-KWNVVKLJSA-N	CCCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]12)C4=CCCCC4)C(=O)NC5Cc6ccccc6C5	BroadT	BRD-K11402657	BRD-K11402657-001-01-4	Broad Institute of MIT and Harvard	BRD-K11402657			CCCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]12)C(=O)NC1Cc2ccccc2C1	InChI=1S/C30H37N3O3/c1-2-14-32-27-24(17-33-26(27)13-12-23(30(33)36)19-8-4-3-5-9-19)25(18-34)28(32)29(35)31-22-15-20-10-6-7-11-21(20)16-22/h6-8,10-13,22,24-25,27-28,34H,2-5,9,14-18H2,1H3,(H,31,35)/t24-,25-,27+,28-/m0/s1	OSYNMQZPZHDZRS-KWNVVKLJSA-N	487.283492074							97743
BRD-K93200353	LSM-14145		54596118	InChI=1S/C22H24FN3O6S/c23-15-4-1-2-6-18(15)33(30,31)26-17-12-25-16(5-3-7-19(25)28)21(26)20(14(17)13-27)22(29)24-8-10-32-11-9-24/h1-7,14,17,20-21,27H,8-13H2/t14-,17-,20+,21+/m0/s1	YMYITTQDNPCSPN-JGMDCFHESA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@H]([C@@H]1C(=O)N4CCOCC4)N2S(=O)(=O)c5ccccc5F	BroadT	BRD-K93200353	BRD-K93200353-001-01-0	Broad Institute of MIT and Harvard	BRD-K93200353			OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)N1CCOCC1)N2S(=O)(=O)c1ccccc1F	InChI=1S/C22H24FN3O6S/c23-15-4-1-2-6-18(15)33(30,31)26-17-12-25-16(5-3-7-19(25)28)21(26)20(14(17)13-27)22(29)24-8-10-32-11-9-24/h1-7,14,17,20-21,27H,8-13H2/t14-,17-,20+,21+/m0/s1	YMYITTQDNPCSPN-JGMDCFHESA-N	477.136984408							102799
BRD-K75609900	LSM-13052		54660958	InChI=1S/C27H33N3O4/c1-3-29-24-21(15-30-23(24)12-11-20(27(30)33)18-8-4-5-9-18)22(16-31)25(29)26(32)28-14-17-7-6-10-19(13-17)34-2/h6-8,10-13,21-22,24-25,31H,3-5,9,14-16H2,1-2H3,(H,28,32)/t21-,22-,24+,25-/m0/s1	NBNQALGKJVWNKP-HFOXQMJASA-N	CCN1[C@@H]([C@@H](CO)[C@@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@H]12)C(=O)NCc5cccc(OC)c5	BroadT	BRD-K75609900	BRD-K75609900-001-01-2	Broad Institute of MIT and Harvard	BRD-K75609900			CCN1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]12)C(=O)NCc1cccc(OC)c1	InChI=1S/C27H33N3O4/c1-3-29-24-21(15-30-23(24)12-11-20(27(30)33)18-8-4-5-9-18)22(16-31)25(29)26(32)28-14-17-7-6-10-19(13-17)34-2/h6-8,10-13,21-22,24-25,31H,3-5,9,14-16H2,1-2H3,(H,28,32)/t21-,22-,24+,25-/m0/s1	NBNQALGKJVWNKP-HFOXQMJASA-N	463.247106566							101689
BRD-K08520424	LSM-8943		54660765	InChI=1S/C27H33FN4O4/c1-2-12-29-27(36)32-23-20(21(16-33)24(32)26(35)30-13-4-3-5-14-30)15-31-22(23)11-10-19(25(31)34)17-6-8-18(28)9-7-17/h6-11,20-21,23-24,33H,2-5,12-16H2,1H3,(H,29,36)/t20-,21-,23+,24-/m0/s1	VKYOLVDQZLNZRC-ZQRMPTRQSA-N	CCCNC(=O)N1[C@@H]([C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]12)c4ccc(F)cc4)C(=O)N5CCCCC5	BroadT	BRD-K08520424	BRD-K08520424-001-01-0	Broad Institute of MIT and Harvard	BRD-K08520424			CCCNC(=O)N1[C@@H]([C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccc(F)cc4)c3=O)[C@H]12)C(=O)N1CCCCC1	InChI=1S/C27H33FN4O4/c1-2-12-29-27(36)32-23-20(21(16-33)24(32)26(35)30-13-4-3-5-14-30)15-31-22(23)11-10-19(25(31)34)17-6-8-18(28)9-7-17/h6-11,20-21,23-24,33H,2-5,12-16H2,1H3,(H,29,36)/t20-,21-,23+,24-/m0/s1	VKYOLVDQZLNZRC-ZQRMPTRQSA-N	496.248583776							97564
BRD-K14096157	LSM-9279		54596141	InChI=1S/C22H24FN3O6S/c23-15-4-1-2-6-18(15)33(30,31)26-17-12-25-16(5-3-7-19(25)28)21(26)20(14(17)13-27)22(29)24-8-10-32-11-9-24/h1-7,14,17,20-21,27H,8-13H2/t14-,17-,20+,21+/m1/s1	YMYITTQDNPCSPN-LPNJYYIDSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)N4CCOCC4)N2S(=O)(=O)c5ccccc5F	BroadT	BRD-K14096157	BRD-K14096157-001-01-6	Broad Institute of MIT and Harvard	BRD-K14096157			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)N1CCOCC1)N2S(=O)(=O)c1ccccc1F	InChI=1S/C22H24FN3O6S/c23-15-4-1-2-6-18(15)33(30,31)26-17-12-25-16(5-3-7-19(25)28)21(26)20(14(17)13-27)22(29)24-8-10-32-11-9-24/h1-7,14,17,20-21,27H,8-13H2/t14-,17-,20+,21+/m1/s1	YMYITTQDNPCSPN-LPNJYYIDSA-N	477.136984408							97900
BRD-K24748809	LSM-9931		54660959	InChI=1S/C25H30N4O4/c1-15(2)26-25(33)29-22-18(13-28-20(22)8-5-9-21(28)31)19(14-30)23(29)24(32)27-11-10-16-6-3-4-7-17(16)12-27/h3-9,15,18-19,22-23,30H,10-14H2,1-2H3,(H,26,33)/t18-,19-,22+,23-/m1/s1	GPOFJZHTSDGPCB-PJIZGREPSA-N	CC(C)NC(=O)N1[C@H]([C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]12)C(=O)N4CCc5ccccc5C4	BroadT	BRD-K24748809	BRD-K24748809-001-01-2	Broad Institute of MIT and Harvard	BRD-K24748809			CC(C)NC(=O)N1[C@H]([C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]12)C(=O)N1CCc2ccccc2C1	InChI=1S/C25H30N4O4/c1-15(2)26-25(33)29-22-18(13-28-20(22)8-5-9-21(28)31)19(14-30)23(29)24(32)27-11-10-16-6-3-4-7-17(16)12-27/h3-9,15,18-19,22-23,30H,10-14H2,1-2H3,(H,26,33)/t18-,19-,22+,23-/m1/s1	GPOFJZHTSDGPCB-PJIZGREPSA-N	450.22670548							98552
BRD-K95138368	LSM-43502		54660963	InChI=1S/C29H30N4O4/c1-2-14-31-27(35)25-22(18-34)24-17-32-23(26(25)33(24)29(37)21-12-15-30-16-13-21)11-10-20(28(32)36)9-8-19-6-4-3-5-7-19/h3-13,15-16,22,24-26,34H,2,14,17-18H2,1H3,(H,31,35)/b9-8+/t22-,24-,25+,26+/m1/s1	QXUUMNXHRNLNCE-NOXKIEJESA-N	CCCNC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C(=CC=C3[C@@H]1N2C(=O)c4ccncc4)\C=C\c5ccccc5	BroadT	BRD-K95138368	BRD-K95138368-001-01-3	Broad Institute of MIT and Harvard	BRD-K95138368			CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@@H]1N2C(=O)c1ccncc1	InChI=1S/C29H30N4O4/c1-2-14-31-27(35)25-22(18-34)24-17-32-23(26(25)33(24)29(37)21-12-15-30-16-13-21)11-10-20(28(32)36)9-8-19-6-4-3-5-7-19/h3-13,15-16,22,24-26,34H,2,14,17-18H2,1H3,(H,31,35)/b9-8+/t22-,24-,25+,26+/m1/s1	QXUUMNXHRNLNCE-NOXKIEJESA-N	498.22670548							
BRD-K32183200	LSM-10378		54660775	InChI=1S/C26H25FN4O4/c27-17-9-7-16(8-10-17)13-29-26(35)24-19(15-32)21-14-30-20(5-3-6-22(30)33)25(24)31(21)23(34)12-18-4-1-2-11-28-18/h1-11,19,21,24-25,32H,12-15H2,(H,29,35)/t19-,21-,24+,25+/m1/s1	URFCUUZYVKRCRT-WOLFRULKSA-N	OC[C@@H]1[C@H]2CN3C(=O)C=CC=C3[C@@H]([C@H]1C(=O)NCc4ccc(F)cc4)N2C(=O)Cc5ccccn5	BroadT	BRD-K32183200	BRD-K32183200-001-01-7	Broad Institute of MIT and Harvard	BRD-K32183200			OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NCc1ccc(F)cc1)N2C(=O)Cc1ccccn1	InChI=1S/C26H25FN4O4/c27-17-9-7-16(8-10-17)13-29-26(35)24-19(15-32)21-14-30-20(5-3-6-22(30)33)25(24)31(21)23(34)12-18-4-1-2-11-28-18/h1-11,19,21,24-25,32H,12-15H2,(H,29,35)/t19-,21-,24+,25+/m1/s1	URFCUUZYVKRCRT-WOLFRULKSA-N	476.18598352							98999
BRD-K97955841	LSM-43504		54660964	InChI=1S/C29H30N4O4/c1-2-14-31-27(35)25-22(18-34)24-17-32-23(26(25)33(24)29(37)21-12-15-30-16-13-21)11-10-20(28(32)36)9-8-19-6-4-3-5-7-19/h3-13,15-16,22,24-26,34H,2,14,17-18H2,1H3,(H,31,35)/b9-8+/t22-,24-,25+,26+/m0/s1	QXUUMNXHRNLNCE-DDSVFJFCSA-N	CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]1N2C(=O)c4ccncc4)\C=C\c5ccccc5	BroadT	BRD-K97955841	BRD-K97955841-001-01-5	Broad Institute of MIT and Harvard	BRD-K97955841			CCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]1N2C(=O)c1ccncc1	InChI=1S/C29H30N4O4/c1-2-14-31-27(35)25-22(18-34)24-17-32-23(26(25)33(24)29(37)21-12-15-30-16-13-21)11-10-20(28(32)36)9-8-19-6-4-3-5-7-19/h3-13,15-16,22,24-26,34H,2,14,17-18H2,1H3,(H,31,35)/b9-8+/t22-,24-,25+,26+/m0/s1	QXUUMNXHRNLNCE-DDSVFJFCSA-N	498.22670548							
BRD-K50381033	LSM-11497		54660994	InChI=1S/C25H29F3N4O3/c26-25(27,28)8-13-31-20-14-32-19(5-4-17(23(32)34)16-6-9-29-10-7-16)22(31)21(18(20)15-33)24(35)30-11-2-1-3-12-30/h4-7,9-10,18,20-22,33H,1-3,8,11-15H2/t18-,20-,21+,22+/m0/s1	DKHQAGHBVQSALK-VXSCBNMQSA-N	OC[C@H]1[C@@H]2CN3C(=CC=C(C3=O)c4ccncc4)[C@H]([C@@H]1C(=O)N5CCCCC5)N2CCC(F)(F)F	BroadT	BRD-K50381033	BRD-K50381033-001-01-7	Broad Institute of MIT and Harvard	BRD-K50381033			OC[C@H]1[C@@H]2Cn3c(ccc(-c4ccncc4)c3=O)[C@H]([C@@H]1C(=O)N1CCCCC1)N2CCC(F)(F)F	InChI=1S/C25H29F3N4O3/c26-25(27,28)8-13-31-20-14-32-19(5-4-17(23(32)34)16-6-9-29-10-7-16)22(31)21(18(20)15-33)24(35)30-11-2-1-3-12-30/h4-7,9-10,18,20-22,33H,1-3,8,11-15H2/t18-,20-,21+,22+/m0/s1	DKHQAGHBVQSALK-VXSCBNMQSA-N	490.219175428							100118
BRD-K41527436	LSM-10948		54660823	InChI=1S/C26H25FN2O5/c1-34-17-7-4-6-15(11-17)18-9-10-21-24-23(26(32)33)19(14-30)22(13-29(21)25(18)31)28(24)12-16-5-2-3-8-20(16)27/h2-11,19,22-24,30H,12-14H2,1H3,(H,32,33)/t19-,22-,23+,24+/m0/s1	MDNKBVDDURCBLA-ZMUKGBGYSA-N	COc1cccc(c1)C2=CC=C3[C@@H]4[C@@H]([C@@H](CO)[C@H](CN3C2=O)N4Cc5ccccc5F)C(=O)O	BroadT	BRD-K41527436	BRD-K41527436-001-01-0	Broad Institute of MIT and Harvard	BRD-K41527436			COc1cccc(c1)-c1ccc2[C@@H]3[C@@H]([C@@H](CO)[C@H](Cn2c1=O)N3Cc1ccccc1F)C(O)=O	InChI=1S/C26H25FN2O5/c1-34-17-7-4-6-15(11-17)18-9-10-21-24-23(26(32)33)19(14-30)22(13-29(21)25(18)31)28(24)12-16-5-2-3-8-20(16)27/h2-11,19,22-24,30H,12-14H2,1H3,(H,32,33)/t19-,22-,23+,24+/m0/s1	MDNKBVDDURCBLA-ZMUKGBGYSA-N	464.17475012							99569
BRD-K39032190	LSM-10794		54660717	InChI=1S/C25H29N3O3/c1-15(16-7-3-2-4-8-16)26-24(30)23-20(14-29)19-13-28-21(22(19)27-23)12-11-18(25(28)31)17-9-5-6-10-17/h2-4,7-9,11-12,15,19-20,22-23,27,29H,5-6,10,13-14H2,1H3,(H,26,30)/t15-,19-,20-,22+,23-/m1/s1	DEERBQNZFWMEPS-WCSRJGBQSA-N	C[C@@H](NC(=O)[C@@H]1N[C@H]2[C@H](CN3C(=O)C(=CC=C23)C4=CCCC4)[C@H]1CO)c5ccccc5	BroadT	BRD-K39032190	BRD-K39032190-001-01-1	Broad Institute of MIT and Harvard	BRD-K39032190			C[C@@H](NC(=O)[C@@H]1N[C@H]2[C@H](Cn3c2ccc(C2=CCCC2)c3=O)[C@H]1CO)c1ccccc1	InChI=1S/C25H29N3O3/c1-15(16-7-3-2-4-8-16)26-24(30)23-20(14-29)19-13-28-21(22(19)27-23)12-11-18(25(28)31)17-9-5-6-10-17/h2-4,7-9,11-12,15,19-20,22-23,27,29H,5-6,10,13-14H2,1H3,(H,26,30)/t15-,19-,20-,22+,23-/m1/s1	DEERBQNZFWMEPS-WCSRJGBQSA-N	419.220891818							99415
BRD-K13245569	LSM-43450		54660918	InChI=1S/C29H36N4O3/c1-30-13-15-31(16-14-30)29(36)27-24(19-34)23-18-32-25(26(23)33(27)17-21-7-8-21)12-11-22(28(32)35)10-9-20-5-3-2-4-6-20/h2-6,9-12,21,23-24,26-27,34H,7-8,13-19H2,1H3/b10-9+/t23-,24-,26+,27-/m1/s1	BARBWXSVHSAMRQ-HJLMAQGISA-N	CN1CCN(CC1)C(=O)[C@H]2[C@H](CO)[C@H]3CN4C(=O)C(=CC=C4[C@H]3N2CC5CC5)\C=C\c6ccccc6	BroadT	BRD-K13245569	BRD-K13245569-001-01-2	Broad Institute of MIT and Harvard	BRD-K13245569			CN1CCN(CC1)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]2N1CC1CC1	InChI=1S/C29H36N4O3/c1-30-13-15-31(16-14-30)29(36)27-24(19-34)23-18-32-25(26(23)33(27)17-21-7-8-21)12-11-22(28(32)35)10-9-20-5-3-2-4-6-20/h2-6,9-12,21,23-24,26-27,34H,7-8,13-19H2,1H3/b10-9+/t23-,24-,26+,27-/m1/s1	BARBWXSVHSAMRQ-HJLMAQGISA-N	488.278741052							
BRD-K02861439	LSM-8613		54660885	InChI=1S/C25H31N3O5/c1-5-11-27-20-13-28-19(22(27)21(18(20)14-29)25(32)33-4)10-9-17(24(28)31)15-7-6-8-16(12-15)23(30)26(2)3/h6-10,12,18,20-22,29H,5,11,13-14H2,1-4H3/t18-,20-,21+,22+/m0/s1	JSPRJWABJIXCIR-VXSCBNMQSA-N	CCCN1[C@H]2CN3C(=CC=C(C3=O)c4cccc(c4)C(=O)N(C)C)[C@@H]1[C@@H]([C@H]2CO)C(=O)OC	BroadT	BRD-K02861439	BRD-K02861439-001-01-7	Broad Institute of MIT and Harvard	BRD-K02861439			CCCN1[C@H]2Cn3c(ccc(-c4cccc(c4)C(=O)N(C)C)c3=O)[C@@H]1[C@@H]([C@H]2CO)C(=O)OC	InChI=1S/C25H31N3O5/c1-5-11-27-20-13-28-19(22(27)21(18(20)14-29)25(32)33-4)10-9-17(24(28)31)15-7-6-8-16(12-15)23(30)26(2)3/h6-10,12,18,20-22,29H,5,11,13-14H2,1-4H3/t18-,20-,21+,22+/m0/s1	JSPRJWABJIXCIR-VXSCBNMQSA-N	453.226371122							97234
BRD-K31720784	LSM-10353		54660789	InChI=1S/C27H27F2N3O3/c1-2-31-23-14-32-22(12-11-19(27(32)35)18-5-3-4-6-21(18)29)25(31)24(20(23)15-33)26(34)30-13-16-7-9-17(28)10-8-16/h3-12,20,23-25,33H,2,13-15H2,1H3,(H,30,34)/t20-,23-,24+,25+/m1/s1	YKOAUFLNNKQPQT-GATIMQMVSA-N	CCN1[C@@H]2CN3C(=CC=C(C3=O)c4ccccc4F)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc5ccc(F)cc5	BroadT	BRD-K31720784	BRD-K31720784-001-01-1	Broad Institute of MIT and Harvard	BRD-K31720784			CCN1[C@@H]2Cn3c(ccc(-c4ccccc4F)c3=O)[C@H]1[C@H]([C@@H]2CO)C(=O)NCc1ccc(F)cc1	InChI=1S/C27H27F2N3O3/c1-2-31-23-14-32-22(12-11-19(27(32)35)18-5-3-4-6-21(18)29)25(31)24(20(23)15-33)26(34)30-13-16-7-9-17(28)10-8-16/h3-12,20,23-25,33H,2,13-15H2,1H3,(H,30,34)/t20-,23-,24+,25+/m1/s1	YKOAUFLNNKQPQT-GATIMQMVSA-N	479.202048154							98974
BRD-M52804417	LSM-45042		54661029	InChI=1S/C22H28N4O4S/c1-3-4-14-5-6-16-20-19(21(28)24-7-9-30-2)15(13-27)17(11-26(16)22(14)29)25(20)12-18-23-8-10-31-18/h3-6,8,10,15,17,19-20,27H,7,9,11-13H2,1-2H3,(H,24,28)/t15-,17-,19+,20+/m0/s1	YAZSZKUPWYSKIW-SMMRIJLZSA-N	COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C(=CC=C3[C@H]1N2Cc4nccs4)C=CC	BroadT	BRD-M52804417	BRD-M52804417-001-01-0	Broad Institute of MIT and Harvard	BRD-M52804417		COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]1N2Cc1nccs1.COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]1N2Cc1nccs1	COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\C)c3=O)[C@H]1N2Cc1nccs1.COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C/C)c3=O)[C@H]1N2Cc1nccs1	InChI=1S/2C22H28N4O4S/c2*1-3-4-14-5-6-16-20-19(21(28)24-7-9-30-2)15(13-27)17(11-26(16)22(14)29)25(20)12-18-23-8-10-31-18/h2*3-6,8,10,15,17,19-20,27H,7,9,11-13H2,1-2H3,(H,24,28)/b4-3+;4-3-/t2*15-,17-,19+,20+/m00/s1	QVJUFKVGYWDMAL-SXGXYQQXSA-N	444.183126106							103279
BRD-K92210276	LSM-14092		54660957	InChI=1S/C27H33N3O4/c1-3-29-24-21(15-30-23(24)12-11-20(27(30)33)18-8-4-5-9-18)22(16-31)25(29)26(32)28-14-17-7-6-10-19(13-17)34-2/h6-8,10-13,21-22,24-25,31H,3-5,9,14-16H2,1-2H3,(H,28,32)/t21-,22-,24+,25-/m1/s1	NBNQALGKJVWNKP-YQIMAOPZSA-N	CCN1[C@H]([C@H](CO)[C@H]2CN3C(=CC=C(C4=CCCC4)C3=O)[C@@H]12)C(=O)NCc5cccc(OC)c5	BroadT	BRD-K92210276	BRD-K92210276-001-01-4	Broad Institute of MIT and Harvard	BRD-K92210276			CCN1[C@H]([C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]12)C(=O)NCc1cccc(OC)c1	InChI=1S/C27H33N3O4/c1-3-29-24-21(15-30-23(24)12-11-20(27(30)33)18-8-4-5-9-18)22(16-31)25(29)26(32)28-14-17-7-6-10-19(13-17)34-2/h6-8,10-13,21-22,24-25,31H,3-5,9,14-16H2,1-2H3,(H,28,32)/t21-,22-,24+,25-/m1/s1	NBNQALGKJVWNKP-YQIMAOPZSA-N	463.247106566							102746
BRD-K91892860	LSM-14076		54596130	InChI=1S/C21H25N3O5S/c1-13-6-4-7-14(10-13)30(28,29)24-17-11-23-16(8-5-9-18(23)26)20(24)19(15(17)12-25)21(27)22(2)3/h4-10,15,17,19-20,25H,11-12H2,1-3H3/t15-,17-,19+,20+/m1/s1	DIVLOMPALFPCBT-BEKAIBRUSA-N	CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]1N2S(=O)(=O)c4cccc(C)c4	BroadT	BRD-K91892860	BRD-K91892860-001-01-2	Broad Institute of MIT and Harvard	BRD-K91892860			CN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2S(=O)(=O)c1cccc(C)c1	InChI=1S/C21H25N3O5S/c1-13-6-4-7-14(10-13)30(28,29)24-17-11-23-16(8-5-9-18(23)26)20(24)19(15(17)12-25)21(27)22(2)3/h4-10,15,17,19-20,25H,11-12H2,1-3H3/t15-,17-,19+,20+/m1/s1	DIVLOMPALFPCBT-BEKAIBRUSA-N	431.15149162							102730
BRD-K66064682	LSM-43488		54660702	InChI=1S/C28H26N2O6/c31-15-21-20-14-29-22(10-9-19(27(29)32)8-6-17-4-2-1-3-5-17)25(20)30(26(21)28(33)34)13-18-7-11-23-24(12-18)36-16-35-23/h1-12,20-21,25-26,31H,13-16H2,(H,33,34)/b8-6+/t20-,21-,25+,26-/m1/s1	JUBZNFCZFZOAAP-BFJLJVCSSA-N	OC[C@@H]1[C@H]2CN3C(=O)C(=CC=C3[C@H]2N(Cc4ccc5OCOc5c4)[C@H]1C(=O)O)\C=C\c6ccccc6	BroadT	BRD-K66064682	BRD-K66064682-001-01-5	Broad Institute of MIT and Harvard	BRD-K66064682			OC[C@@H]1[C@H]2Cn3c(=O)c(\C=C\c4ccccc4)ccc3[C@H]2N(Cc2ccc3OCOc3c2)[C@H]1C(O)=O	InChI=1S/C28H26N2O6/c31-15-21-20-14-29-22(10-9-19(27(29)32)8-6-17-4-2-1-3-5-17)25(20)30(26(21)28(33)34)13-18-7-11-23-24(12-18)36-16-35-23/h1-12,20-21,25-26,31H,13-16H2,(H,33,34)/b8-6+/t20-,21-,25+,26-/m1/s1	JUBZNFCZFZOAAP-BFJLJVCSSA-N	486.179086572							
BRD-K46393778	LSM-11260		54660787	InChI=1S/C17H19N3O4S/c1-24-17(23)15-10(9-21)12-7-19-11(3-2-4-14(19)22)16(15)20(12)8-13-18-5-6-25-13/h2-6,10,12,15-16,21H,7-9H2,1H3/t10-,12-,15+,16+/m1/s1	AQWQARACBBXMKO-RPCMGYBJSA-N	COC(=O)[C@H]1[C@H](CO)[C@H]2CN3C(=O)C=CC=C3[C@@H]1N2Cc4nccs4	BroadT	BRD-K46393778	BRD-K46393778-001-01-8	Broad Institute of MIT and Harvard	BRD-K46393778			COC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2Cc1nccs1	InChI=1S/C17H19N3O4S/c1-24-17(23)15-10(9-21)12-7-19-11(3-2-4-14(19)22)16(15)20(12)8-13-18-5-6-25-13/h2-6,10,12,15-16,21H,7-9H2,1H3/t10-,12-,15+,16+/m1/s1	AQWQARACBBXMKO-RPCMGYBJSA-N	361.109626808							99881
BRD-K24175855	LSM-9891		54661012	InChI=1S/C28H32N4O4/c33-16-23-22-15-31-24(7-4-8-25(31)34)26(22)32(14-21-17-36-18-29-21)27(23)28(35)30-11-9-20(10-12-30)13-19-5-2-1-3-6-19/h1-8,17-18,20,22-23,26-27,33H,9-16H2/t22-,23-,26+,27-/m0/s1	YCNDEIYRXZASMY-IDJLGEMNSA-N	OC[C@H]1[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N(Cc4cocn4)[C@@H]1C(=O)N5CCC(Cc6ccccc6)CC5	BroadT	BRD-K24175855	BRD-K24175855-001-01-1	Broad Institute of MIT and Harvard	BRD-K24175855			OC[C@H]1[C@@H]2Cn3c(=O)cccc3[C@@H]2N(Cc2ncoc2)[C@@H]1C(=O)N1CCC(CC1)Cc1ccccc1	InChI=1S/C28H32N4O4/c33-16-23-22-15-31-24(7-4-8-25(31)34)26(22)32(14-21-17-36-18-29-21)27(23)28(35)30-11-9-20(10-12-30)13-19-5-2-1-3-6-19/h1-8,17-18,20,22-23,26-27,33H,9-16H2/t22-,23-,26+,27-/m0/s1	YCNDEIYRXZASMY-IDJLGEMNSA-N	488.242355544							98512
BRD-K04078927	LSM-8680		54660792	InChI=1S/C24H31N5O3/c30-15-19-18-14-29-20(7-6-17(24(29)32)16-5-4-8-25-13-16)21(18)27-22(19)23(31)26-9-12-28-10-2-1-3-11-28/h4-8,13,18-19,21-22,27,30H,1-3,9-12,14-15H2,(H,26,31)/t18-,19-,21+,22-/m0/s1	FYGMFPVOHAHUKR-MPJJRAAHSA-N	OC[C@H]1[C@@H]2CN3C(=O)C(=CC=C3[C@@H]2N[C@@H]1C(=O)NCCN4CCCCC4)c5cccnc5	BroadT	BRD-K04078927	BRD-K04078927-001-01-5	Broad Institute of MIT and Harvard	BRD-K04078927			OC[C@H]1[C@@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@@H]2N[C@@H]1C(=O)NCCN1CCCCC1	InChI=1S/C24H31N5O3/c30-15-19-18-14-29-20(7-6-17(24(29)32)16-5-4-8-25-13-16)21(18)27-22(19)23(31)26-9-12-28-10-2-1-3-11-28/h4-8,13,18-19,21-22,27,30H,1-3,9-12,14-15H2,(H,26,31)/t18-,19-,21+,22-/m0/s1	FYGMFPVOHAHUKR-MPJJRAAHSA-N	437.242689902							97301
N-(2-{[2-(Trifluoromethyl)-4-quinolyl]thio}ethyl)methanesulfonamide	LSM-28120	SID26730979, BRD-K68747298	2822023	InChI=1S/C13H13F3N2O2S2/c1-22(19,20)17-6-7-21-11-8-12(13(14,15)16)18-10-5-3-2-4-9(10)11/h2-5,8,17H,6-7H2,1H3	MOZLNBUXNKZTJA-UHFFFAOYSA-N	CS(=O)(=O)NCCSc1cc(nc2ccccc12)C(F)(F)F	BroadT	BRD-K68747298	BRD-K68747298-001-05-0	Maybridge	KM 07834			CS(=O)(=O)NCCSc1cc(nc2ccccc12)C(F)(F)F	InChI=1S/C13H13F3N2O2S2/c1-22(19,20)17-6-7-21-11-8-12(13(14,15)16)18-10-5-3-2-4-9(10)11/h2-5,8,17H,6-7H2,1H3	MOZLNBUXNKZTJA-UHFFFAOYSA-N	350.037053656							116665
(Quinolin-2-ylsulfanyl)-acetic acid (4-hydroxy-benzylidene)-hydrazide	LSM-28121	BRD-K51269222	5331420	InChI=1S/C18H15N3O2S/c22-15-8-5-13(6-9-15)11-19-21-17(23)12-24-18-10-7-14-3-1-2-4-16(14)20-18/h1-11,22H,12H2,(H,21,23)	VRXRARQBURXCSM-UHFFFAOYSA-N	Oc1ccc(C=NNC(=O)CSc2ccc3ccccc3n2)cc1	BroadT	BRD-K51269222	BRD-K51269222-001-05-5	Asinex Ltd.	BAS 00400222			Oc1ccc(C=NNC(=O)CSc2ccc3ccccc3n2)cc1	InChI=1S/C18H15N3O2S/c22-15-8-5-13(6-9-15)11-19-21-17(23)12-24-18-10-7-14-3-1-2-4-16(14)20-18/h1-11,22H,12H2,(H,21,23)	VRXRARQBURXCSM-UHFFFAOYSA-N	337.08849744							
1-(4-Amino-1,2,5-oxadiazol-3-yl)-5-(azepan-1-ylmethyl)-n-[(2-ethoxyphenyl)methylideneamino]triazole-4-carboxamide	LSM-6604	BRD-K48388979	1036002	InChI=1S/C21H27N9O3/c1-2-32-17-10-6-5-9-15(17)13-23-25-21(31)18-16(14-29-11-7-3-4-8-12-29)30(28-24-18)20-19(22)26-33-27-20/h5-6,9-10,13H,2-4,7-8,11-12,14H2,1H3,(H2,22,26)(H,25,31)	DOVIZHGISHYASN-UHFFFAOYSA-N	CCOc1ccccc1C=NNC(=O)c2nnn(c2CN3CCCCCC3)c4nonc4N	BroadT	BRD-K48388979	BRD-K48388979-001-06-2	ChemDiv Inc.	8009-4465			CCOc1ccccc1C=NNC(=O)c1nnn(c1CN1CCCCCC1)-c1nonc1N	InChI=1S/C21H27N9O3/c1-2-32-17-10-6-5-9-15(17)13-23-25-21(31)18-16(14-29-11-7-3-4-8-12-29)30(28-24-18)20-19(22)26-33-27-20/h5-6,9-10,13H,2-4,7-8,11-12,14H2,1H3,(H2,22,26)(H,25,31)	DOVIZHGISHYASN-UHFFFAOYSA-N	453.223685814							95272
AH-034/11365905	LSM-28122	SID17504640, BRD-K72094145	762771	InChI=1S/C15H14N2O3/c1-11-2-6-13(7-3-11)16-10-15(18)12-4-8-14(9-5-12)17(19)20/h2-9,16H,10H2,1H3	VLWGLZKRJULNKK-UHFFFAOYSA-N	Cc1ccc(NCC(=O)c2ccc(cc2)[N+](=O)[O-])cc1	BroadT	BRD-K72094145	BRD-K72094145-001-05-6	ChemBridge Corporation	5249186			Cc1ccc(NCC(=O)c2ccc(cc2)[N+]([O-])=O)cc1	InChI=1S/C15H14N2O3/c1-11-2-6-13(7-3-11)16-10-15(18)12-4-8-14(9-5-12)17(19)20/h2-9,16H,10H2,1H3	VLWGLZKRJULNKK-UHFFFAOYSA-N	270.100442328							116667
ZINC00179119	LSM-15421	BRD-K45558870	4991157	InChI=1S/C18H11N5O2/c19-10-11-9-16-17(14-3-1-2-4-15(14)21-16)22(18(11)20)12-5-7-13(8-6-12)23(24)25/h1-9H,(H2,20,21)/p+1	WQWZXDYPFLOXKI-UHFFFAOYSA-O	Nc1c(cc2[nH]c3ccccc3c2[n+]1c4ccc(cc4)[N+](=O)[O-])C#N	BroadT	BRD-K45558870	BRD-K45558870-003-05-1	ChemBridge Corporation	6035915		Cl	Nc1c(cc2[nH]c3ccccc3c2[n+]1-c1ccc(cc1)[N+]([O-])=O)C#N.Cl	InChI=1S/C18H11N5O2.ClH/c19-10-11-9-16-17(14-3-1-2-4-15(14)21-16)22(18(11)20)12-5-7-13(8-6-12)23(24)25;/h1-9H,(H2,20,21);1H/p+1	JHVSIKPGDRGFNU-UHFFFAOYSA-O	330.099099674							104063, 104063
1-Benzyl-3-(tert-butyl)-n-{5-[(dimethylamino)sulfonyl]-2-methylphenyl}-1H-pyrazole-5-carboxamide	LSM-28123	SID26731036, BRD-K06778813	2812921	InChI=1S/C24H30N4O3S/c1-17-12-13-19(32(30,31)27(5)6)14-20(17)25-23(29)21-15-22(24(2,3)4)26-28(21)16-18-10-8-7-9-11-18/h7-15H,16H2,1-6H3,(H,25,29)	YLGUYRMWTBHSPZ-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)c2cc(nn2Cc3ccccc3)C(C)(C)C)c1	BroadT	BRD-K06778813	BRD-K06778813-001-05-6	Maybridge	HTS 06224			CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)c2cc(nn2Cc2ccccc2)C(C)(C)C)c1	InChI=1S/C24H30N4O3S/c1-17-12-13-19(32(30,31)27(5)6)14-20(17)25-23(29)21-15-22(24(2,3)4)26-28(21)16-18-10-8-7-9-11-18/h7-15H,16H2,1-6H3,(H,25,29)	YLGUYRMWTBHSPZ-UHFFFAOYSA-N	454.20386155							116668
MLS000059196	LSM-28124	SID4258617, BRD-K05299321	756386	InChI=1S/C16H17N3O/c1-11-6-4-5-7-15(11)19-16-14(9-17)13(10-20-3)8-12(2)18-16/h4-8H,10H2,1-3H3,(H,18,19)	IMDGJVXCNFBHOK-UHFFFAOYSA-N	COCc1cc(C)nc(Nc2ccccc2C)c1C#N	BroadT	BRD-K05299321	BRD-K05299321-001-05-9	ChemBridge Corporation	5376834			COCc1cc(C)nc(Nc2ccccc2C)c1C#N	InChI=1S/C16H17N3O/c1-11-6-4-5-7-15(11)19-16-14(9-17)13(10-20-3)8-12(2)18-16/h4-8H,10H2,1-3H3,(H,18,19)	IMDGJVXCNFBHOK-UHFFFAOYSA-N	267.137162194							116669
AC1LHZET	LSM-28125	BRD-K01989649	871872	InChI=1S/C17H12N4O4/c22-17(13-2-1-9-18-10-13)20-19-11-15-7-8-16(25-15)12-3-5-14(6-4-12)21(23)24/h1-11H,(H,20,22)	OHKQJEGTOCPDIP-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)c2oc(C=NNC(=O)c3cccnc3)cc2	BroadT	BRD-K01989649	BRD-K01989649-001-05-4	InterBioScreen Ltd.	STOCK2S-94015			[O-][N+](=O)c1ccc(cc1)-c1ccc(C=NNC(=O)c2cccnc2)o1	InChI=1S/C17H12N4O4/c22-17(13-2-1-9-18-10-13)20-19-11-15-7-8-16(25-15)12-3-5-14(6-4-12)21(23)24/h1-11H,(H,20,22)	OHKQJEGTOCPDIP-UHFFFAOYSA-N	336.085854904							116670
AC1MD2VO	LSM-28126	SID17508473, BRD-A65548975	2830027	InChI=1S/C12H12Cl3FN4O4S/c1-24-6-2-3-7(8(4-6)20(22)23)17-11(25)19-10(12(13,14)15)18-9(21)5-16/h2-4,10H,5H2,1H3,(H,18,21)(H2,17,19,25)	MTIKLEXJGDGAHT-UHFFFAOYSA-N	COc1ccc(N=C(S)NC(NC(=O)CF)C(Cl)(Cl)Cl)c(c1)[N+](=O)[O-]	BroadT	BRD-A65548975	BRD-A65548975-001-05-7	Asinex Ltd.	BAS 00157598			COc1ccc(N=C(S)NC(NC(=O)CF)C(Cl)(Cl)Cl)c(c1)[N+]([O-])=O	InChI=1S/C12H12Cl3FN4O4S/c1-24-6-2-3-7(8(4-6)20(22)23)17-11(25)19-10(12(13,14)15)18-9(21)5-16/h2-4,10H,5H2,1H3,(H,18,21)(H2,17,19,25)	MTIKLEXJGDGAHT-UHFFFAOYSA-N	431.962886924							116671
ST50832722	LSM-28127	SID3712541, BRD-A63916482	2998063	InChI=1S/C13H17N3O2S/c1-9-6-15(7-10(2)18-9)8-11-5-12(17)16-3-4-19-13(16)14-11/h3-5,9-10H,6-8H2,1-2H3	SSKDEIZZNPPARC-UHFFFAOYSA-N	CC1CN(CC2=CC(=O)N3C=CSC3=N2)CC(C)O1	BroadT	BRD-A63916482	BRD-A63916482-001-05-4	Enamine Ltd.	T0516-6979			CC1CN(Cc2cc(=O)n3ccsc3n2)CC(C)O1	InChI=1S/C13H17N3O2S/c1-9-6-15(7-10(2)18-9)8-11-5-12(17)16-3-4-19-13(16)14-11/h3-5,9-10H,6-8H2,1-2H3	SSKDEIZZNPPARC-UHFFFAOYSA-N	279.104147504							116672
AC1LO8NB	LSM-28128	SID49827119, BRD-K84990868	1216489	InChI=1S/C18H12BrNO4/c19-16-10-9-15(24-16)18(22)23-14-8-4-7-13(11-14)20-17(21)12-5-2-1-3-6-12/h1-11H,(H,20,21)	USRVFRIBEXPUAU-UHFFFAOYSA-N	Brc1oc(cc1)C(=O)Oc2cccc(NC(=O)c3ccccc3)c2	BroadT	BRD-K84990868	BRD-K84990868-001-06-4	Specs	AK-918/11684002			Brc1ccc(o1)C(=O)Oc1cccc(NC(=O)c2ccccc2)c1	InChI=1S/C18H12BrNO4/c19-16-10-9-15(24-16)18(22)23-14-8-4-7-13(11-14)20-17(21)12-5-2-1-3-6-12/h1-11H,(H,20,21)	USRVFRIBEXPUAU-UHFFFAOYSA-N	384.994970474							116673
AC1OA2I3	LSM-28129	BRD-K01813539	6797244	InChI=1S/C16H12N4O3S/c21-15-7-6-11(8-14(15)20(22)23)9-17-19-16-18-13(10-24-16)12-4-2-1-3-5-12/h1-10,21H,(H,18,19)	NJULNNGLUDWOBK-UHFFFAOYSA-N	Oc1ccc(C=NNc2nc(cs2)c3ccccc3)cc1[N+](=O)[O-]	BroadT	BRD-K01813539	BRD-K01813539-001-05-9	ChemBridge Corporation	6348534			Oc1ccc(C=NNc2nc(cs2)-c2ccccc2)cc1[N+]([O-])=O	InChI=1S/C16H12N4O3S/c21-15-7-6-11(8-14(15)20(22)23)9-17-19-16-18-13(10-24-16)12-4-2-1-3-5-12/h1-10,21H,(H,18,19)	NJULNNGLUDWOBK-UHFFFAOYSA-N	340.063010974							
BDBM52845	LSM-28130	BRD-K46343728	51517462	InChI=1S/C18H15NO3/c1-11-3-6-13(7-4-11)16(20)10-15-18(21)22-17-8-5-12(2)9-14(17)19-15/h3-9H,10H2,1-2H3	WUPHRUUYVWKJCW-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)CC2=Nc3cc(C)ccc3OC2=O	BroadT	BRD-K46343728	BRD-K46343728-001-06-3	InterBioScreen Ltd.	STOCK3S-03794			Cc1ccc(cc1)C(=O)Cc1nc2cc(C)ccc2oc1=O	InChI=1S/C18H15NO3/c1-11-3-6-13(7-4-11)16(20)10-15-18(21)22-17-8-5-12(2)9-14(17)19-15/h3-9H,10H2,1-2H3	WUPHRUUYVWKJCW-UHFFFAOYSA-N	293.10519335							116675
[3-(2-Chloro-benzyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]-phenyl-amine	LSM-28131	SID844489, BRD-K27614646	646817	InChI=1S/C17H13ClN6/c18-14-9-5-4-6-12(14)10-24-17-15(22-23-24)16(19-11-20-17)21-13-7-2-1-3-8-13/h1-9,11H,10H2,(H,19,20,21)	ZQJNMASSVHKBGN-UHFFFAOYSA-N	Clc1ccccc1Cn2nnc3c(Nc4ccccc4)ncnc23	BroadT	BRD-K27614646	BRD-K27614646-001-05-1	Asinex Ltd.	ASN 07369385			Clc1ccccc1Cn1nnc2c(Nc3ccccc3)ncnc12	InChI=1S/C17H13ClN6/c18-14-9-5-4-6-12(14)10-24-17-15(22-23-24)16(19-11-20-17)21-13-7-2-1-3-8-13/h1-9,11H,10H2,(H,19,20,21)	ZQJNMASSVHKBGN-UHFFFAOYSA-N	336.089022186							116676
4-(2,6-Dimethylphenoxy)-2-phenyl-5-(phenylsulfonyl)pyrimidine	LSM-28132	SID85281152, SID17411376, BRD-K53212904	3767519	InChI=1S/C24H20N2O3S/c1-17-10-9-11-18(2)22(17)29-24-21(30(27,28)20-14-7-4-8-15-20)16-25-23(26-24)19-12-5-3-6-13-19/h3-16H,1-2H3	RHIMXBAPHQHSSP-UHFFFAOYSA-N	Cc1cccc(C)c1Oc2nc(ncc2S(=O)(=O)c3ccccc3)c4ccccc4	BroadT	BRD-K53212904	BRD-K53212904-001-08-2	Key Organics Ltd.	8N-592S			Cc1cccc(C)c1Oc1nc(ncc1S(=O)(=O)c1ccccc1)-c1ccccc1	InChI=1S/C24H20N2O3S/c1-17-10-9-11-18(2)22(17)29-24-21(30(27,28)20-14-7-4-8-15-20)16-25-23(26-24)19-12-5-3-6-13-19/h3-16H,1-2H3	RHIMXBAPHQHSSP-UHFFFAOYSA-N	416.11946321							116677
MLS001199123	LSM-28133	SID24387507, SID49649664, BRD-K59740392	16010945	InChI=1S/C20H26N4O4/c1-13(2)28-9-5-8-21-19(25)12-23-20(26)18-11-15-10-16(27-4)6-7-17(15)24(18)14(3)22-23/h6-7,10-11,13H,5,8-9,12H2,1-4H3,(H,21,25)	YOXJIWHWNSXDPS-UHFFFAOYSA-N	COc1ccc2c(c1)cc3C(=O)N(CC(=O)NCCCOC(C)C)N=C(C)n23	BroadT	BRD-K59740392	BRD-K59740392-001-05-1	ChemDiv Inc.	C786-3411			COc1ccc2c(cc3n2c(C)nn(CC(=O)NCCCOC(C)C)c3=O)c1	InChI=1S/C20H26N4O4/c1-13(2)28-9-5-8-21-19(25)12-23-20(26)18-11-15-10-16(27-4)6-7-17(15)24(18)14(3)22-23/h6-7,10-11,13H,5,8-9,12H2,1-4H3,(H,21,25)	YOXJIWHWNSXDPS-UHFFFAOYSA-N	386.195405352							116678
MLS000565767	LSM-28134	SID14745204, BRD-K99731722	2114718	InChI=1S/C18H19N3OS/c1-4-9-21-12(2)10-14(13(21)3)17(22)11-23-18-19-15-7-5-6-8-16(15)20-18/h4-8,10H,1,9,11H2,2-3H3,(H,19,20)	QQWLRTCPDKLDOE-UHFFFAOYSA-N	Cc1cc(C(=O)CSc2nc3ccccc3[nH]2)c(C)n1CC=C	BroadT	BRD-K99731722	BRD-K99731722-001-06-1	Enamine Ltd.	T5272134			Cc1cc(C(=O)CSc2nc3ccccc3[nH]2)c(C)n1CC=C	InChI=1S/C18H19N3OS/c1-4-9-21-12(2)10-14(13(21)3)17(22)11-23-18-19-15-7-5-6-8-16(15)20-18/h4-8,10H,1,9,11H2,2-3H3,(H,19,20)	QQWLRTCPDKLDOE-UHFFFAOYSA-N	325.124882948							116679
MLS000686795	LSM-28135	SID24819327, SID87344634, BRD-A15680534	4559992	InChI=1S/C30H31FN4O3/c1-38-27-11-6-19(16-20(27)18-34-12-14-35(15-13-34)22-9-7-21(31)8-10-22)28-29-24(17-26(33-28)30(36)37)23-4-2-3-5-25(23)32-29/h2-11,16,26,28,32-33H,12-15,17-18H2,1H3,(H,36,37)	NMHUDCOGYBAHCI-UHFFFAOYSA-N	COc1ccc(cc1CN2CCN(CC2)c3ccc(F)cc3)C4NC(Cc5c4[nH]c6ccccc56)C(=O)O	BroadT	BRD-A15680534	BRD-A15680534-001-12-9	ChemDiv Inc.	R052-0815			COc1ccc(cc1CN1CCN(CC1)c1ccc(F)cc1)C1NC(Cc2c1[nH]c1ccccc21)C(O)=O	InChI=1S/C30H31FN4O3/c1-38-27-11-6-19(16-20(27)18-34-12-14-35(15-13-34)22-9-7-21(31)8-10-22)28-29-24(17-26(33-28)30(36)37)23-4-2-3-5-25(23)32-29/h2-11,16,26,28,32-33H,12-15,17-18H2,1H3,(H,36,37)	NMHUDCOGYBAHCI-UHFFFAOYSA-N	514.238019092							116680
1G-376S	LSM-28136	SID17409980, BRD-K30142736	3530306	InChI=1S/C19H16N2OS/c1-2-12-20-18(22)15-8-10-16(11-9-15)19-21-17(13-23-19)14-6-4-3-5-7-14/h2-11,13H,1,12H2,(H,20,22)	IQEYRZRUHRUFEW-UHFFFAOYSA-N	C=CCNC(=O)c1ccc(cc1)c2nc(cs2)c3ccccc3	BroadT	BRD-K30142736	BRD-K30142736-001-05-9	Key Organics Ltd.	1G-376S			C=CCNC(=O)c1ccc(cc1)-c1nc(cs1)-c1ccccc1	InChI=1S/C19H16N2OS/c1-2-12-20-18(22)15-8-10-16(11-9-15)19-21-17(13-23-19)14-6-4-3-5-7-14/h2-11,13H,1,12H2,(H,20,22)	IQEYRZRUHRUFEW-UHFFFAOYSA-N	320.098333842							116681
MLS000058074	LSM-28137	BRD-K57156445	2089356	InChI=1S/C18H25N3O4/c1-4-9-18(10-5-2)16(23)21(17(24)20-18)12-15(22)19-13-7-6-8-14(11-13)25-3/h6-8,11H,4-5,9-10,12H2,1-3H3,(H,19,22)(H,20,24)	BSCJGOVRDFHXFF-UHFFFAOYSA-N	CCCC1(CCC)NC(=O)N(CC(=O)Nc2cccc(OC)c2)C1=O	BroadT	BRD-K57156445	BRD-K57156445-001-05-9	Enamine Ltd.	T5269075			CCCC1(CCC)NC(=O)N(CC(=O)Nc2cccc(OC)c2)C1=O	InChI=1S/C18H25N3O4/c1-4-9-18(10-5-2)16(23)21(17(24)20-18)12-15(22)19-13-7-6-8-14(11-13)25-3/h6-8,11H,4-5,9-10,12H2,1-3H3,(H,19,22)(H,20,24)	BSCJGOVRDFHXFF-UHFFFAOYSA-N	347.18450631							116682
BRD-A07393848	LSM-28138			InChI=1S/C24H23NO8/c1-30-10-9-25-20(14-3-5-15(6-4-14)24(29)31-2)19(22(27)23(25)28)21(26)16-7-8-17-18(13-16)33-12-11-32-17/h3-8,13,19-20H,9-12H2,1-2H3	ZROSETFGOOADCZ-UHFFFAOYSA-N	COCCN1C(C(C(=O)c2ccc3OCCOc3c2)C(=O)C1=O)c4ccc(cc4)C(=O)OC	BroadT	BRD-A07393848	BRD-A07393848-001-05-4	InterBioScreen Ltd.	STOCK4S-08507			COCCN1C(C(C(=O)c2ccc3OCCOc3c2)C(=O)C1=O)c1ccc(cc1)C(=O)OC	InChI=1S/C24H23NO8/c1-30-10-9-25-20(14-3-5-15(6-4-14)24(29)31-2)19(22(27)23(25)28)21(26)16-7-8-17-18(13-16)33-12-11-32-17/h3-8,13,19-20H,9-12H2,1-2H3	ZROSETFGOOADCZ-UHFFFAOYSA-N	453.142366706							116683
ASN 05551434	LSM-28139	SID845197, BRD-A28188436	647539	InChI=1S/C20H29FN6/c1-15(2)19(20-22-23-24-27(20)16-7-3-4-8-16)26-13-11-25(12-14-26)18-10-6-5-9-17(18)21/h5-6,9-10,15-16,19H,3-4,7-8,11-14H2,1-2H3	ZCHBJHCXZAOMIR-UHFFFAOYSA-N	CC(C)C(N1CCN(CC1)c2ccccc2F)c3nnnn3C4CCCC4	BroadT	BRD-A28188436	BRD-A28188436-001-05-1	Asinex Ltd.	ASN 05551434			CC(C)C(N1CCN(CC1)c1ccccc1F)c1nnnn1C1CCCC1	InChI=1S/C20H29FN6/c1-15(2)19(20-22-23-24-27(20)16-7-3-4-8-16)26-13-11-25(12-14-26)18-10-6-5-9-17(18)21/h5-6,9-10,15-16,19H,3-4,7-8,11-14H2,1-2H3	ZCHBJHCXZAOMIR-UHFFFAOYSA-N	372.243773188							116684
AC1OBA35	LSM-28140	BRD-K48538526	6842803	InChI=1S/C16H20BrN3O2/c1-11-9-13(5-6-15(11)17)20-16(21)14(12(2)19-20)10-18-7-4-8-22-3/h5-6,9-10,21H,4,7-8H2,1-3H3	RJXYYAGWGKPDTM-UHFFFAOYSA-N	COCCCN=Cc1c(C)nn(c1O)c2ccc(Br)c(C)c2	BroadT	BRD-K48538526	BRD-K48538526-001-05-2	Specs	AP-970/41851300			COCCCN=Cc1c(C)nn(c1O)-c1ccc(Br)c(C)c1	InChI=1S/C16H20BrN3O2/c1-11-9-13(5-6-15(11)17)20-16(21)14(12(2)19-20)10-18-7-4-8-22-3/h5-6,9-10,21H,4,7-8H2,1-3H3	RJXYYAGWGKPDTM-UHFFFAOYSA-N	365.07388951							
N-(7-Chloro-4-quinazolinyl)-n-(2-furylmethyl)amine	LSM-28141	SID14739984, BRD-K77732949	1490550	InChI=1S/C13H10ClN3O/c14-9-3-4-11-12(6-9)16-8-17-13(11)15-7-10-2-1-5-18-10/h1-6,8H,7H2,(H,15,16,17)	VWTCONAFMPUDRV-UHFFFAOYSA-N	Clc1ccc2c(NCc3occc3)ncnc2c1	BroadT	BRD-K77732949	BRD-K77732949-001-05-4	Key Organics Ltd.	12N-831			Clc1ccc2c(NCc3ccco3)ncnc2c1	InChI=1S/C13H10ClN3O/c14-9-3-4-11-12(6-9)16-8-17-13(11)15-7-10-2-1-5-18-10/h1-6,8H,7H2,(H,15,16,17)	VWTCONAFMPUDRV-UHFFFAOYSA-N	259.05123968							116686
AC1NEG04	LSM-28142	SID24784747, BRD-K53624331	4591629	InChI=1S/C19H24N4O4S/c1-27-11-7-20-17(25)13-5-6-14-15(12-13)21-19(28)23(18(14)26)10-3-9-22-8-2-4-16(22)24/h5-6,12H,2-4,7-11H2,1H3,(H,20,25)(H,21,28)	ZZOOBZYFZJNQAB-UHFFFAOYSA-N	COCCNC(=O)c1ccc2C(=O)N(CCCN3CCCC3=O)C(=S)Nc2c1	BroadT	BRD-K53624331	BRD-K53624331-001-05-7	ChemDiv Inc.	K284-1567			COCCNC(=O)c1ccc2c(c1)[nH]c(=S)n(CCCN1CCCC1=O)c2=O	InChI=1S/C19H24N4O4S/c1-27-11-7-20-17(25)13-5-6-14-15(12-13)21-19(28)23(18(14)26)10-3-9-22-8-2-4-16(22)24/h5-6,12H,2-4,7-11H2,1H3,(H,20,25)(H,21,28)	ZZOOBZYFZJNQAB-UHFFFAOYSA-N	404.151825978							116687
N-[(5-Bromofuran-2-yl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-6-carboxamide	LSM-28143	BRD-K08737305	1237232	InChI=1S/C14H11BrN2O4/c15-13-4-2-10(21-13)8-16-17-14(18)9-1-3-11-12(7-9)20-6-5-19-11/h1-4,7-8H,5-6H2,(H,17,18)	PFEWOUJKCIQNHM-UHFFFAOYSA-N	Brc1oc(C=NNC(=O)c2ccc3OCCOc3c2)cc1	BroadT	BRD-K08737305	BRD-K08737305-001-06-3	Specs	AG-205/07662026			Brc1ccc(C=NNC(=O)c2ccc3OCCOc3c2)o1	InChI=1S/C14H11BrN2O4/c15-13-4-2-10(21-13)8-16-17-14(18)9-1-3-11-12(7-9)20-6-5-19-11/h1-4,7-8H,5-6H2,(H,17,18)	PFEWOUJKCIQNHM-UHFFFAOYSA-N	349.990219452							116688
MLS000776213	LSM-44255	SID26670612, BRD-K80132640	5895333	InChI=1S/C25H20N2O5/c1-32-17-12-10-16(11-13-17)15-27-23(28)19-7-3-2-6-18(19)21(24(27)29)14-26-22-9-5-4-8-20(22)25(30)31/h2-14,26H,15H2,1H3,(H,30,31)/b21-14-	ZERNVEIBAJRATR-STZFKDTASA-N	COc1ccc(CN2C(=O)\C(=C/Nc3ccccc3C(=O)O)\c4ccccc4C2=O)cc1	BroadT	BRD-K80132640	BRD-K80132640-001-05-4	Enamine Ltd.	T0511-3469			COc1ccc(CN2C(=O)\C(=C/Nc3ccccc3C(O)=O)c3ccccc3C2=O)cc1	InChI=1S/C25H20N2O5/c1-32-17-12-10-16(11-13-17)15-27-23(28)19-7-3-2-6-18(19)21(24(27)29)14-26-22-9-5-4-8-20(22)25(30)31/h2-14,26H,15H2,1H3,(H,30,31)/b21-14-	ZERNVEIBAJRATR-STZFKDTASA-N	428.13722176							
4-(4-Pyrrolidin-1-yl-quinazolin-2-ylamino)-phenol	LSM-15422	BRD-K87744949	655252	InChI=1S/C18H18N4O/c23-14-9-7-13(8-10-14)19-18-20-16-6-2-1-5-15(16)17(21-18)22-11-3-4-12-22/h1-2,5-10,23H,3-4,11-12H2,(H,19,20,21)	NVPSCBQVMTWTEQ-UHFFFAOYSA-N	Oc1ccc(Nc2nc(N3CCCC3)c4ccccc4n2)cc1	BroadT	BRD-K87744949	BRD-K87744949-003-09-5	Asinex Ltd.	BAS 04913588		Cl	Oc1ccc(Nc2nc(N3CCCC3)c3ccccc3n2)cc1.Cl	InChI=1S/C18H18N4O.ClH/c23-14-9-7-13(8-10-14)19-18-20-16-6-2-1-5-15(16)17(21-18)22-11-3-4-12-22;/h1-2,5-10,23H,3-4,11-12H2,(H,19,20,21);1H	VUXVPOKZPFOKOI-UHFFFAOYSA-N	306.148061236							104064, 104064
AC1MPOHJ	LSM-28145	SID17513071, BRD-A83427528	3414134	InChI=1S/C18H17F3N2O4/c1-2-27-15(25)17(18(19,20)21,12-6-4-3-5-7-12)23-16(26)22-13-8-10-14(24)11-9-13/h3-11,24H,2H2,1H3,(H2,22,23,26)	XNQRDTCMTZHLJL-UHFFFAOYSA-N	CCOC(=O)C(NC(=O)Nc1ccc(O)cc1)(c2ccccc2)C(F)(F)F	BroadT	BRD-A83427528	BRD-A83427528-001-05-4	InterBioScreen Ltd.	STOCK3S-14363			CCOC(=O)C(NC(=O)Nc1ccc(O)cc1)(c1ccccc1)C(F)(F)F	InChI=1S/C18H17F3N2O4/c1-2-27-15(25)17(18(19,20)21,12-6-4-3-5-7-12)23-16(26)22-13-8-10-14(24)11-9-13/h3-11,24H,2H2,1H3,(H2,22,23,26)	XNQRDTCMTZHLJL-UHFFFAOYSA-N	382.114041644							116690
AC1MQKUO	LSM-28146	SID24790046, BRD-A28953915	3503385	InChI=1S/C17H19ClN8O4S2/c1-7-10(18)4-25(21-7)8(2)13(27)19-11-14(28)26-12(16(29)30)9(5-31-15(11)26)6-32-17-20-22-23-24(17)3/h4,8,11,15H,5-6H2,1-3H3,(H,19,27)(H,29,30)	FTBJSGFGEYXEHS-UHFFFAOYSA-N	CC(C(=O)NC1C2SCC(=C(N2C1=O)C(=O)O)CSc3nnnn3C)n4cc(Cl)c(C)n4	BroadT	BRD-A28953915	BRD-A28953915-001-06-6	ChemDiv Inc.	D052-0039			CC(C(=O)NC1C2SCC(CSc3nnnn3C)=C(N2C1=O)C(O)=O)n1cc(Cl)c(C)n1	InChI=1S/C17H19ClN8O4S2/c1-7-10(18)4-25(21-7)8(2)13(27)19-11-14(28)26-12(16(29)30)9(5-31-15(11)26)6-32-17-20-22-23-24(17)3/h4,8,11,15H,5-6H2,1-3H3,(H,19,27)(H,29,30)	FTBJSGFGEYXEHS-UHFFFAOYSA-N	498.065920258							116691
MLS000113157	LSM-28147	SID7974438, BRD-K05563675	2923325	InChI=1S/C15H20N2O2/c1-2-18-14-6-5-7-15(12-14)19-11-4-3-9-17-10-8-16-13-17/h5-8,10,12-13H,2-4,9,11H2,1H3	RSLYNSPZRITMBV-UHFFFAOYSA-N	CCOc1cccc(OCCCCn2ccnc2)c1	BroadT	BRD-K05563675	BRD-K05563675-001-05-0	ChemBridge Corporation	7010633			CCOc1cccc(OCCCCn2ccnc2)c1	InChI=1S/C15H20N2O2/c1-2-18-14-6-5-7-15(12-14)19-11-4-3-9-17-10-8-16-13-17/h5-8,10,12-13H,2-4,9,11H2,1H3	RSLYNSPZRITMBV-UHFFFAOYSA-N	260.1524779							116692
1-(3,5-Dimethylphenyl)-3-(3-ethoxypropyl)thiourea	LSM-28148	SID22415840, BRD-K91528640	2171176	InChI=1S/C14H22N2OS/c1-4-17-7-5-6-15-14(18)16-13-9-11(2)8-12(3)10-13/h8-10H,4-7H2,1-3H3,(H2,15,16,18)	NVQUWDLHPINZKL-UHFFFAOYSA-N	CCOCCCN=C(S)Nc1cc(C)cc(C)c1	BroadT	BRD-K91528640	BRD-K91528640-001-06-8	ChemBridge Corporation	6881657			CCOCCCN=C(S)Nc1cc(C)cc(C)c1	InChI=1S/C14H22N2OS/c1-4-17-7-5-6-15-14(18)16-13-9-11(2)8-12(3)10-13/h8-10H,4-7H2,1-3H3,(H2,15,16,18)	NVQUWDLHPINZKL-UHFFFAOYSA-N	266.145284034							116693
SMR000035575	LSM-28149	SID7967013, SID862050, BRD-K32152869	663277	InChI=1S/C16H16N4/c17-10-13-15(11-6-8-19-9-7-11)12-4-2-1-3-5-14(12)20-16(13)18/h6-9H,1-5H2,(H2,18,20)	NZPZJNXVCNJHSB-UHFFFAOYSA-N	Nc1nc2CCCCCc2c(c3ccncc3)c1C#N	BroadT	BRD-K32152869	BRD-K32152869-001-06-3	ChemDiv Inc.	6233-0536			Nc1nc2CCCCCc2c(-c2ccncc2)c1C#N	InChI=1S/C16H16N4/c17-10-13-15(11-6-8-19-9-7-11)12-4-2-1-3-5-14(12)20-16(13)18/h6-9H,1-5H2,(H2,18,20)	NZPZJNXVCNJHSB-UHFFFAOYSA-N	264.137496552							116694
MLS000851345	LSM-28150	SID26728195, BRD-K76811756	2805943	InChI=1S/C13H11ClN2O4/c1-15(2)10-7-11(20-13(17)12(10)14)8-3-5-9(6-4-8)16(18)19/h3-7H,1-2H3	YLGLLBKYWYGNFU-UHFFFAOYSA-N	CN(C)C1=C(Cl)C(=O)OC(=C1)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K76811756	BRD-K76811756-001-06-7	Maybridge	CD 11156			CN(C)c1cc(oc(=O)c1Cl)-c1ccc(cc1)[N+]([O-])=O	InChI=1S/C13H11ClN2O4/c1-15(2)10-7-11(20-13(17)12(10)14)8-3-5-9(6-4-8)16(18)19/h3-7H,1-2H3	YLGLLBKYWYGNFU-UHFFFAOYSA-N	294.040734562							116695
SMR000148565	LSM-28151	SID14741399, BRD-K27307478	1630498	InChI=1S/C19H15Cl2N5O3S2/c1-3-29-18(28)15-9(2)12(7-22)17(31-15)23-14(27)8-30-19-24-16(25-26-19)11-5-4-10(20)6-13(11)21/h4-6H,3,8H2,1-2H3,(H,23,27)(H,24,25,26)	NIAUUAXMPNTHHO-UHFFFAOYSA-N	CCOC(=O)c1sc(NC(=O)CSc2n[nH]c(n2)c3ccc(Cl)cc3Cl)c(C#N)c1C	BroadT	BRD-K27307478	BRD-K27307478-001-06-3	InterBioScreen Ltd.	STOCK4S-64693			CCOC(=O)c1sc(NC(=O)CSc2n[nH]c(n2)-c2ccc(Cl)cc2Cl)c(C#N)c1C	InChI=1S/C19H15Cl2N5O3S2/c1-3-29-18(28)15-9(2)12(7-22)17(31-15)23-14(27)8-30-19-24-16(25-26-19)11-5-4-10(20)6-13(11)21/h4-6H,3,8H2,1-2H3,(H,23,27)(H,24,25,26)	NIAUUAXMPNTHHO-UHFFFAOYSA-N	494.99933619							131285
AC1NLYRZ	LSM-28152	BRD-K08470920	4968034	InChI=1S/C17H15N5O/c23-17(14-6-8-18-9-7-14)22-21-15(12-16-19-10-11-20-16)13-4-2-1-3-5-13/h1-11H,12H2,(H,19,20)(H,22,23)	RQBHYALYYSCIKB-UHFFFAOYSA-N	O=C(NN=C(Cc1ncc[nH]1)c2ccccc2)c3ccncc3	BroadT	BRD-K08470920	BRD-K08470920-001-07-4	Enamine Ltd.	T5325241			O=C(NN=C(Cc1ncc[nH]1)c1ccccc1)c1ccncc1	InChI=1S/C17H15N5O/c23-17(14-6-8-18-9-7-14)22-21-15(12-16-19-10-11-20-16)13-4-2-1-3-5-13/h1-11H,12H2,(H,19,20)(H,22,23)	RQBHYALYYSCIKB-UHFFFAOYSA-N	305.12766015							116699
MLS000724950	LSM-28153	SID22402110, BRD-K33945151	2049848	InChI=1S/C7H5Cl2N3S/c8-3-1-2-4(9)6-5(3)11-7(12-10)13-6/h1-2H,10H2,(H,11,12)	RRAGSBRZTNXWEH-UHFFFAOYSA-N	NNc1nc2c(Cl)ccc(Cl)c2s1	BroadT	BRD-K33945151	BRD-K33945151-001-06-6	Life Chemicals Inc.	F1908-0021			NNc1nc2c(Cl)ccc(Cl)c2s1	InChI=1S/C7H5Cl2N3S/c8-3-1-2-4(9)6-5(3)11-7(12-10)13-6/h1-2H,10H2,(H,11,12)	RRAGSBRZTNXWEH-UHFFFAOYSA-N	232.9581233							116700
MLS000715636	LSM-28154	SID24789648, BRD-K88812384	973196	InChI=1S/C14H12N2OS2/c1-16(10-4-6-11(17)7-5-10)14-15-12(9-19-14)13-3-2-8-18-13/h2-9,17H,1H3	NCAMZKLUFXWNFH-UHFFFAOYSA-N	CN(c1ccc(O)cc1)c2nc(cs2)c3cccs3	BroadT	BRD-K88812384	BRD-K88812384-001-05-3	Asinex Ltd.	BAS 08770424			CN(c1nc(cs1)-c1cccs1)c1ccc(O)cc1	InChI=1S/C14H12N2OS2/c1-16(10-4-6-11(17)7-5-10)14-15-12(9-19-14)13-3-2-8-18-13/h2-9,17H,1H3	NCAMZKLUFXWNFH-UHFFFAOYSA-N	288.039104404							116701
Ethyl 7-(3-hydroxyphenyl)-5-phenyl-4,7,8-trihydro-1,2,4-triazolo[1,5-a]pyrimid ine-6-carboxylate	LSM-28155	SID26660418, BRD-A59063358	5711281	InChI=1S/C20H18N4O3/c1-2-27-19(26)16-17(13-7-4-3-5-8-13)23-20-21-12-22-24(20)18(16)14-9-6-10-15(25)11-14/h3-12,18,25H,2H2,1H3,(H,21,22,23)	WRSLSOTXAGNVCZ-UHFFFAOYSA-N	CCOC(=O)C1=C(Nc2ncnn2C1c3cccc(O)c3)c4ccccc4	BroadT	BRD-A59063358	BRD-A59063358-001-06-0	InterBioScreen Ltd.	STOCK5S-26237			CCOC(=O)C1=C(Nc2ncnn2C1c1cccc(O)c1)c1ccccc1	InChI=1S/C20H18N4O3/c1-2-27-19(26)16-17(13-7-4-3-5-8-13)23-20-21-12-22-24(20)18(16)14-9-6-10-15(25)11-14/h3-12,18,25H,2H2,1H3,(H,21,22,23)	WRSLSOTXAGNVCZ-UHFFFAOYSA-N	362.137890476							116702
7-Methyl-3-(morpholinomethyl)-2-phenylimidazo[1,2-a]pyridine	LSM-28156	SID17411114, BRD-K02461940	4356160	InChI=1S/C19H21N3O/c1-15-7-8-22-17(14-21-9-11-23-12-10-21)19(20-18(22)13-15)16-5-3-2-4-6-16/h2-8,13H,9-12,14H2,1H3	XWRNYKBJTXUZEB-UHFFFAOYSA-N	Cc1ccn2c(CN3CCOCC3)c(nc2c1)c4ccccc4	BroadT	BRD-K02461940	BRD-K02461940-001-05-9	Key Organics Ltd.	2P-040			Cc1ccn2c(CN3CCOCC3)c(nc2c1)-c1ccccc1	InChI=1S/C19H21N3O/c1-15-7-8-22-17(14-21-9-11-23-12-10-21)19(20-18(22)13-15)16-5-3-2-4-6-16/h2-8,13H,9-12,14H2,1H3	XWRNYKBJTXUZEB-UHFFFAOYSA-N	307.168462322							116703
T0508-9196	LSM-28157	SID3714845, BRD-K45116142	2355260	InChI=1S/C11H10O5S/c12-8(10-2-1-5-17-10)6-16-11(13)9-7-14-3-4-15-9/h1-2,5,7H,3-4,6H2	BCSWVRMHYRIERT-UHFFFAOYSA-N	O=C(COC(=O)C1=COCCO1)c2cccs2	BroadT	BRD-K45116142	BRD-K45116142-001-06-2	Enamine Ltd.	T0508-9196			O=C(COC(=O)C1=COCCO1)c1cccs1	InChI=1S/C11H10O5S/c12-8(10-2-1-5-17-10)6-16-11(13)9-7-14-3-4-15-9/h1-2,5,7H,3-4,6H2	BCSWVRMHYRIERT-UHFFFAOYSA-N	254.02489411							116704
MLS000582168	LSM-28158	SID17413221, BRD-A29265374	2965319	InChI=1S/C25H26ClNO3/c1-17(2)30-21-11-8-18(9-12-21)16-27-25(29)15-22(19-6-4-3-5-7-19)23-14-20(26)10-13-24(23)28/h3-14,17,22,28H,15-16H2,1-2H3,(H,27,29)	GKTLATIRVIDXLX-UHFFFAOYSA-N	CC(C)Oc1ccc(CNC(=O)CC(c2ccccc2)c3cc(Cl)ccc3O)cc1	BroadT	BRD-A29265374	BRD-A29265374-001-07-6	ChemBridge Corporation	7921459			CC(C)Oc1ccc(CNC(=O)CC(c2ccccc2)c2cc(Cl)ccc2O)cc1	InChI=1S/C25H26ClNO3/c1-17(2)30-21-11-8-18(9-12-21)16-27-25(29)15-22(19-6-4-3-5-7-19)23-14-20(26)10-13-24(23)28/h3-14,17,22,28H,15-16H2,1-2H3,(H,27,29)	GKTLATIRVIDXLX-UHFFFAOYSA-N	423.160121412							116705
STK208590	LSM-28159	SID24785895, BRD-K86015660	1259978	InChI=1S/C15H11N5O4S/c21-13(17-12-3-1-2-8-16-12)9-25-15-19-18-14(24-15)10-4-6-11(7-5-10)20(22)23/h1-8H,9H2,(H,16,17,21)	WWUYWTAPPDQRGR-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)c2oc(SCC(=O)Nc3ccccn3)nn2	BroadT	BRD-K86015660	BRD-K86015660-001-05-0	ChemBridge Corporation	7914907			[O-][N+](=O)c1ccc(cc1)-c1nnc(SCC(=O)Nc2ccccn2)o1	InChI=1S/C15H11N5O4S/c21-13(17-12-3-1-2-8-16-12)9-25-15-19-18-14(24-15)10-4-6-11(7-5-10)20(22)23/h1-8H,9H2,(H,16,17,21)	WWUYWTAPPDQRGR-UHFFFAOYSA-N	357.053174572							116706
4-Oxo-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-6-yl 4-chlorobenzoate	LSM-28160	SID26729268, BRD-K18593575	2816456	InChI=1S/C24H16ClNO3/c25-18-11-9-17(10-12-18)24(28)29-22-19-8-4-7-16-13-14-26(21(16)19)23(27)20(22)15-5-2-1-3-6-15/h1-12H,13-14H2	GDWDRDMFADNWJR-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)OC2=C(C(=O)N3CCc4cccc2c34)c5ccccc5	BroadT	BRD-K18593575	BRD-K18593575-001-05-3	Maybridge	HTS 12592			Clc1ccc(cc1)C(=O)Oc1c(-c2ccccc2)c(=O)n2CCc3cccc1c23	InChI=1S/C24H16ClNO3/c25-18-11-9-17(10-12-18)24(28)29-22-19-8-4-7-16-13-14-26(21(16)19)23(27)20(22)15-5-2-1-3-6-15/h1-12H,13-14H2	GDWDRDMFADNWJR-UHFFFAOYSA-N	401.081871092							116707
SMR000172752	LSM-28161	SID17508646, BRD-K38084360	859639	InChI=1S/C16H16ClNO2S/c1-3-12-8-13(16(21-12)18-14(19)9-17)15(20)11-6-4-10(2)5-7-11/h4-8H,3,9H2,1-2H3,(H,18,19)	RUOYSSXJCXTPGP-UHFFFAOYSA-N	CCc1cc(C(=O)c2ccc(C)cc2)c(NC(=O)CCl)s1	BroadT	BRD-K38084360	BRD-K38084360-001-08-2	Asinex Ltd.	ASN 04364384			CCc1cc(C(=O)c2ccc(C)cc2)c(NC(=O)CCl)s1	InChI=1S/C16H16ClNO2S/c1-3-12-8-13(16(21-12)18-14(19)9-17)15(20)11-6-4-10(2)5-7-11/h4-8H,3,9H2,1-2H3,(H,18,19)	RUOYSSXJCXTPGP-UHFFFAOYSA-N	321.059027162							116708
MLS000559937	LSM-28162	SID26662355, BRD-K55165131	1983011	InChI=1S/C23H25N5/c1-16-21(17-10-6-5-7-11-17)22-26-19(23(2,3)4)14-20(28(22)27-16)25-15-18-12-8-9-13-24-18/h5-14,25H,15H2,1-4H3	GHODFTLMWOCFDA-UHFFFAOYSA-N	Cc1nn2c(NCc3ccccn3)cc(nc2c1c4ccccc4)C(C)(C)C	BroadT	BRD-K55165131	BRD-K55165131-001-08-5	InterBioScreen Ltd.	STOCK5S-08244			Cc1nn2c(NCc3ccccn3)cc(nc2c1-c1ccccc1)C(C)(C)C	InChI=1S/C23H25N5/c1-16-21(17-10-6-5-7-11-17)22-26-19(23(2,3)4)14-20(28(22)27-16)25-15-18-12-8-9-13-24-18/h5-14,25H,15H2,1-4H3	GHODFTLMWOCFDA-UHFFFAOYSA-N	371.21099585							116709
1-(3,5-Dichlorophenyl)-3-phenylurea	LSM-28163	SID14731779, BRD-K63959957	742703	InChI=1S/C13H10Cl2N2O/c14-9-6-10(15)8-12(7-9)17-13(18)16-11-4-2-1-3-5-11/h1-8H,(H2,16,17,18)	HXAALNHUNDFNAG-UHFFFAOYSA-N	Clc1cc(Cl)cc(NC(=O)Nc2ccccc2)c1	BroadT	BRD-K63959957	BRD-K63959957-001-07-4	ChemBridge Corporation	5402880			Clc1cc(Cl)cc(NC(=O)Nc2ccccc2)c1	InChI=1S/C13H10Cl2N2O/c14-9-6-10(15)8-12(7-9)17-13(18)16-11-4-2-1-3-5-11/h1-8H,(H2,16,17,18)	HXAALNHUNDFNAG-UHFFFAOYSA-N	280.01701838							116710
MLS000762637	LSM-28164	SID26665681, BRD-K64730551	1385839	InChI=1S/C11H11N3O3S/c1-16-8-6-4-3-5-7(8)9-13-14-10(18-9)12-11(15)17-2/h3-6H,1-2H3,(H,12,14,15)	WQGDSKJYDVQOTF-UHFFFAOYSA-N	COC(=O)Nc1nnc(s1)c2ccccc2OC	BroadT	BRD-K64730551	BRD-K64730551-001-05-2	InterBioScreen Ltd.	STOCK5S-20823			COC(=O)Nc1nnc(s1)-c1ccccc1OC	InChI=1S/C11H11N3O3S/c1-16-8-6-4-3-5-7(8)9-13-14-10(18-9)12-11(15)17-2/h3-6H,1-2H3,(H,12,14,15)	WQGDSKJYDVQOTF-UHFFFAOYSA-N	265.052111932							116711
MLS000538252	LSM-28165	SID14739693, BRD-K16193965	1244750	InChI=1S/C20H18F2N2O3S/c21-14-8-10-15(11-9-14)28(25,26)19-20(24-12-4-1-5-13-24)27-18(23-19)16-6-2-3-7-17(16)22/h2-3,6-11H,1,4-5,12-13H2	JUCSIFZNOGBBAE-UHFFFAOYSA-N	Fc1ccc(cc1)S(=O)(=O)c2nc(oc2N3CCCCC3)c4ccccc4F	BroadT	BRD-K16193965	BRD-K16193965-001-06-0	ChemBridge Corporation	7917879			Fc1ccc(cc1)S(=O)(=O)c1nc(oc1N1CCCCC1)-c1ccccc1F	InChI=1S/C20H18F2N2O3S/c21-14-8-10-15(11-9-14)28(25,26)19-20(24-12-4-1-5-13-24)27-18(23-19)16-6-2-3-7-17(16)22/h2-3,6-11H,1,4-5,12-13H2	JUCSIFZNOGBBAE-UHFFFAOYSA-N	404.100619546							116712
AC1OAM0Q	LSM-28166	BRD-K99907703	6831792	InChI=1S/C14H15NO2S/c1-3-7-15-9-13-14(16)11-8-10(17-4-2)5-6-12(11)18-13/h3,5-6,8-9,16H,1,4,7H2,2H3	QURVTODAYUIBOK-UHFFFAOYSA-N	CCOc1ccc2sc(C=NCC=C)c(O)c2c1	BroadT	BRD-K99907703	BRD-K99907703-001-03-7	Specs	AK-968/11164793			CCOc1ccc2sc(C=NCC=C)c(O)c2c1	InChI=1S/C14H15NO2S/c1-3-7-15-9-13-14(16)11-8-10(17-4-2)5-6-12(11)18-13/h3,5-6,8-9,16H,1,4,7H2,2H3	QURVTODAYUIBOK-UHFFFAOYSA-N	261.08234942							
BAS 07779020	LSM-28167	SID24790249, BRD-K68578522	939011	InChI=1S/C13H11N5OS/c1-8-4-2-3-5-10(8)18-12(16-17-13(18)20)9-6-7-11(19)15-14-9/h2-7H,1H3,(H,15,19)(H,17,20)	PVZLLBHIXDSOIG-UHFFFAOYSA-N	Cc1ccccc1n2c(S)nnc2c3ccc(O)nn3	BroadT	BRD-K68578522	BRD-K68578522-001-05-7	Asinex Ltd.	BAS 07779020			Cc1ccccc1-n1c(S)nnc1-c1ccc(O)nn1	InChI=1S/C13H11N5OS/c1-8-4-2-3-5-10(8)18-12(16-17-13(18)20)9-6-7-11(19)15-14-9/h2-7H,1H3,(H,15,19)(H,17,20)	PVZLLBHIXDSOIG-UHFFFAOYSA-N	285.068430712							116714
ASN 05923425	LSM-28168	SID849922, BRD-K69269694	652434	InChI=1S/C18H17N5O2S2/c1-3-25-11-6-7-12-14(9-11)27-17(20-12)22-15(24)10-26-18-21-13-5-4-8-19-16(13)23(18)2/h4-9H,3,10H2,1-2H3,(H,20,22,24)	CXSSCPPYFDIMTE-UHFFFAOYSA-N	CCOc1ccc2nc(NC(=O)CSc3nc4cccnc4n3C)sc2c1	BroadT	BRD-K69269694	BRD-K69269694-001-06-2	Asinex Ltd.	ASN 05923425			CCOc1ccc2nc(NC(=O)CSc3nc4cccnc4n3C)sc2c1	InChI=1S/C18H17N5O2S2/c1-3-25-11-6-7-12-14(9-11)27-17(20-12)22-15(24)10-26-18-21-13-5-4-8-19-16(13)23(18)2/h4-9H,3,10H2,1-2H3,(H,20,22,24)	CXSSCPPYFDIMTE-UHFFFAOYSA-N	399.082366214							116715
MLS000084752	LSM-28169	SID4251215, BRD-K22318020	1040497	InChI=1S/C21H28N2O3S/c1-16(2)18-6-9-21(24)19(14-18)15-22-10-12-23(13-11-22)27(25,26)20-7-4-17(3)5-8-20/h4-9,14,16,24H,10-13,15H2,1-3H3	IYJLDWAHRRCHFK-UHFFFAOYSA-N	CC(C)c1ccc(O)c(CN2CCN(CC2)S(=O)(=O)c3ccc(C)cc3)c1	BroadT	BRD-K22318020	BRD-K22318020-001-05-0	ChemDiv Inc.	0727-0007			CC(C)c1ccc(O)c(CN2CCN(CC2)S(=O)(=O)c2ccc(C)cc2)c1	InChI=1S/C21H28N2O3S/c1-16(2)18-6-9-21(24)19(14-18)15-22-10-12-23(13-11-22)27(25,26)20-7-4-17(3)5-8-20/h4-9,14,16,24H,10-13,15H2,1-3H3	IYJLDWAHRRCHFK-UHFFFAOYSA-N	388.182063466							116716
ST51005413	LSM-4948	BRD-K90735586, SID3714916	5398113	InChI=1S/C10H9N5/c1-2-4-8(5-3-1)9-6-7-15-10(11-9)12-13-14-15/h1-6H,7H2,(H,11,12,14)	WTFRYRFNRVFFEJ-UHFFFAOYSA-N	C1C=C(Nc2nnnn12)c3ccccc3	BroadT	BRD-K90735586	BRD-K90735586-001-06-6	Enamine Ltd.	T0500-1754			C1C=C(Nc2nnnn12)c1ccccc1	InChI=1S/C10H9N5/c1-2-4-8(5-3-1)9-6-7-15-10(11-9)12-13-14-15/h1-6H,7H2,(H,11,12,14)	WTFRYRFNRVFFEJ-UHFFFAOYSA-N	199.085795338							94312
2-{[(2-Oxo-1,3-benzothiazol-3(2H)-yl)acetyl]amino}benzoic acid	LSM-28170	SID847812, BRD-K00704636	650227	InChI=1S/C16H12N2O4S/c19-14(17-11-6-2-1-5-10(11)15(20)21)9-18-12-7-3-4-8-13(12)23-16(18)22/h1-8H,9H2,(H,17,19)(H,20,21)	PWWSVIPEGABCJG-UHFFFAOYSA-N	OC(=O)c1ccccc1NC(=O)CN2C(=O)Sc3ccccc23	BroadT	BRD-K00704636	BRD-K00704636-001-05-3	Asinex Ltd.	BAS 04948707			OC(=O)c1ccccc1NC(=O)Cn1c2ccccc2sc1=O	InChI=1S/C16H12N2O4S/c19-14(17-11-6-2-1-5-10(11)15(20)21)9-18-12-7-3-4-8-13(12)23-16(18)22/h1-8H,9H2,(H,17,19)(H,20,21)	PWWSVIPEGABCJG-UHFFFAOYSA-N	328.051777574							116717
AC1NA1OL	LSM-15423	BRD-K70502791	4370194	InChI=1S/C22H30N2O3/c1-22(2,3)24-21(25)16-27-19-11-10-18(14-20(19)26-4)15-23-13-12-17-8-6-5-7-9-17/h5-11,14,23H,12-13,15-16H2,1-4H3,(H,24,25)	IPHMCOQJRMKMMF-UHFFFAOYSA-N	COc1cc(CNCCc2ccccc2)ccc1OCC(=O)NC(C)(C)C	BroadT	BRD-K70502791	BRD-K70502791-003-05-3	Specs	AP-970/42168132		Cl	COc1cc(CNCCc2ccccc2)ccc1OCC(=O)NC(C)(C)C.Cl	InChI=1S/C22H30N2O3.ClH/c1-22(2,3)24-21(25)16-27-19-11-10-18(14-20(19)26-4)15-23-13-12-17-8-6-5-7-9-17;/h5-11,14,23H,12-13,15-16H2,1-4H3,(H,24,25);1H	MGNCMHGCNFJOBS-UHFFFAOYSA-N	370.22564284							104065, 104065
ST50109775	LSM-28171	SID24829950, BRD-K93351403	747966	InChI=1S/C14H11ClN2S/c15-11-4-6-13(7-5-11)18-10-12-9-17-8-2-1-3-14(17)16-12/h1-9H,10H2	PIRPQJDQZWBMJH-UHFFFAOYSA-N	Clc1ccc(SCc2cn3ccccc3n2)cc1	BroadT	BRD-K93351403	BRD-K93351403-001-05-2	Enamine Ltd.	T0500-2369			Clc1ccc(SCc2cn3ccccc3n2)cc1	InChI=1S/C14H11ClN2S/c15-11-4-6-13(7-5-11)18-10-12-9-17-8-2-1-3-14(17)16-12/h1-9H,10H2	PIRPQJDQZWBMJH-UHFFFAOYSA-N	274.033146772							116718
AC1NK6DP	LSM-28172	SID49721981, BRD-A70344413	4908403	InChI=1S/C21H26N4O4/c1-14-12-23(13-15(2)29-14)21(27)17-11-16-19(24(17)9-6-10-28-3)22-18-7-4-5-8-25(18)20(16)26/h4-5,7-8,11,14-15H,6,9-10,12-13H2,1-3H3	CKKZKAVZXSCDGM-UHFFFAOYSA-N	COCCCn1c2N=C3C=CC=CN3C(=O)c2cc1C(=O)N4CC(C)OC(C)C4	BroadT	BRD-A70344413	BRD-A70344413-001-05-4	ChemBridge Corporation	9125452			COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)N1CC(C)OC(C)C1	InChI=1S/C21H26N4O4/c1-14-12-23(13-15(2)29-14)21(27)17-11-16-19(24(17)9-6-10-28-3)22-18-7-4-5-8-25(18)20(16)26/h4-5,7-8,11,14-15H,6,9-10,12-13H2,1-3H3	CKKZKAVZXSCDGM-UHFFFAOYSA-N	398.195405352							116719
F0750-0327	LSM-43687	SID24779559, BRD-K78469924	6060466	InChI=1S/C18H16N2O5S/c1-24-13-7-10(8-14(25-2)16(13)22)9-15-17(23)20-18(26-15)19-11-3-5-12(21)6-4-11/h3-9,21-22H,1-2H3,(H,19,20,23)/b15-9-	PCLFSFQEDFZNSB-DHDCSXOGSA-N	COc1cc(\C=C\2/SC(=NC2=O)Nc3ccc(O)cc3)cc(OC)c1O	BroadT	BRD-K78469924	BRD-K78469924-001-07-7	Life Chemicals Inc.	F0750-0327			COc1cc(cc(OC)c1O)\C=C1/SC(Nc2ccc(O)cc2)=NC1=O	InChI=1S/C18H16N2O5S/c1-24-13-7-10(8-14(25-2)16(13)22)9-15-17(23)20-18(26-15)19-11-3-5-12(21)6-4-11/h3-9,21-22H,1-2H3,(H,19,20,23)/b15-9-	PCLFSFQEDFZNSB-DHDCSXOGSA-N	372.077992322							
MLS000540745	LSM-28173	SID17386076, BRD-A22690528	11948754	InChI=1S/C22H20N2O5S/c1-14-7-9-16(10-8-14)30(27,28)23-13-22-12-11-17(29-22)18-19(22)21(26)24(20(18)25)15-5-3-2-4-6-15/h2-12,17-19,23H,13H2,1H3	XHMROGGYPWRSMX-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NCC23OC(C=C2)C4C3C(=O)N(C4=O)c5ccccc5	BroadT	BRD-A22690528	BRD-A22690528-001-06-9	Specs	AG-205/08624006			Cc1ccc(cc1)S(=O)(=O)NCC12OC(C=C1)C1C2C(=O)N(C1=O)c1ccccc1	InChI=1S/C22H20N2O5S/c1-14-7-9-16(10-8-14)30(27,28)23-13-22-12-11-17(29-22)18-19(22)21(26)24(20(18)25)15-5-3-2-4-6-15/h2-12,17-19,23H,13H2,1H3	XHMROGGYPWRSMX-UHFFFAOYSA-N	424.10929245							116720
AC1LJAGP	LSM-28174	SID47201661, BRD-K11108971	919877	InChI=1S/C17H17N3OS/c1-2-21-15-10-8-14(9-11-15)16-18-19-17(22)20(16)12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3,(H,19,22)	GBHZFUVNXPAEKT-UHFFFAOYSA-N	CCOc1ccc(cc1)c2nnc(S)n2Cc3ccccc3	BroadT	BRD-K11108971	BRD-K11108971-001-05-7	Vitas-M Laboratory Ltd.	STK069575			CCOc1ccc(cc1)-c1nnc(S)n1Cc1ccccc1	InChI=1S/C17H17N3OS/c1-2-21-15-10-8-14(9-11-15)16-18-19-17(22)20(16)12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3,(H,19,22)	GBHZFUVNXPAEKT-UHFFFAOYSA-N	311.109232884							116721
MLS000518589	LSM-28175	SID26732453, BRD-K73712830	16060394	InChI=1S/C22H13ClF3NO6S/c23-13-6-2-1-5-12(13)18-11-16(29)20-15(28)10-9-14(21(20)32-18)27-34(30,31)19-8-4-3-7-17(19)33-22(24,25)26/h1-11,27-28H	IKLZZXGYISJRGG-UHFFFAOYSA-N	Oc1ccc(NS(=O)(=O)c2ccccc2OC(F)(F)F)c3OC(=CC(=O)c13)c4ccccc4Cl	BroadT	BRD-K73712830	BRD-K73712830-001-05-2	University of Kansas CMLD	KUC101156N			Oc1ccc(NS(=O)(=O)c2ccccc2OC(F)(F)F)c2oc(cc(=O)c12)-c1ccccc1Cl	InChI=1S/C22H13ClF3NO6S/c23-13-6-2-1-5-12(13)18-11-16(29)20-15(28)10-9-14(21(20)32-18)27-34(30,31)19-8-4-3-7-17(19)33-22(24,25)26/h1-11,27-28H	IKLZZXGYISJRGG-UHFFFAOYSA-N	511.010420146							116722
AK-968/41926184	LSM-44256	SID17406702, BRD-K90364292	1001206	InChI=1S/C20H25N3O5S/c1-7-27-20(26)17-12(4)16(19(25)28-11(2)3)18(29-17)22-15(24)9-8-14-10-21-23(6)13(14)5/h8-11H,7H2,1-6H3,(H,22,24)/b9-8+	SZBCJUOOURRSEM-CMDGGOBGSA-N	CCOC(=O)c1sc(NC(=O)\C=C\c2cnn(C)c2C)c(C(=O)OC(C)C)c1C	BroadT	BRD-K90364292	BRD-K90364292-001-05-2	Specs	AK-968/41926184			CCOC(=O)c1sc(NC(=O)\C=C\c2cnn(C)c2C)c(C(=O)OC(C)C)c1C	InChI=1S/C20H25N3O5S/c1-7-27-20(26)17-12(4)16(19(25)28-11(2)3)18(29-17)22-15(24)9-8-14-10-21-23(6)13(14)5/h8-11H,7H2,1-6H3,(H,22,24)/b9-8+	SZBCJUOOURRSEM-CMDGGOBGSA-N	419.15149162							
ASN 04449796	LSM-28177	SID852237, BRD-K21319911	654849	InChI=1S/C20H23N5O4/c1-4-28-17-10-9-14(11-18(17)29-5-2)20-22-24-25(23-20)13-19(26)21-15-7-6-8-16(12-15)27-3/h6-12H,4-5,13H2,1-3H3,(H,21,26)	QEVITPSZBNZUJS-UHFFFAOYSA-N	CCOc1ccc(cc1OCC)c2nnn(CC(=O)Nc3cccc(OC)c3)n2	BroadT	BRD-K21319911	BRD-K21319911-001-06-9	Asinex Ltd.	ASN 04449796			CCOc1ccc(cc1OCC)-c1nnn(CC(=O)Nc2cccc(OC)c2)n1	InChI=1S/C20H23N5O4/c1-4-28-17-10-9-14(11-18(17)29-5-2)20-22-24-25(23-20)13-19(26)21-15-7-6-8-16(12-15)27-3/h6-12H,4-5,13H2,1-3H3,(H,21,26)	QEVITPSZBNZUJS-UHFFFAOYSA-N	397.175004266							116724
MLS000080621	LSM-28178	SID856932, BRD-K32230403	658285	InChI=1S/C13H12N2O3S/c1-17-9-4-3-8-7-15(13-14-5-6-19-13)12(16)10(8)11(9)18-2/h3-6H,7H2,1-2H3	UJNTWVLYYAUMHD-UHFFFAOYSA-N	COc1ccc2CN(C(=O)c2c1OC)c3nccs3	BroadT	BRD-K32230403	BRD-K32230403-001-05-2	InterBioScreen Ltd.	STOCK1S-41169			COc1ccc2CN(C(=O)c2c1OC)c1nccs1	InChI=1S/C13H12N2O3S/c1-17-9-4-3-8-7-15(13-14-5-6-19-13)12(16)10(8)11(9)18-2/h3-6H,7H2,1-2H3	UJNTWVLYYAUMHD-UHFFFAOYSA-N	276.056862954							116725
SMR000029534	LSM-28179	SID4251199, BRD-A07172053	3244916	InChI=1S/C18H22N4O2/c1-12-3-8-17-14(9-12)10-22(21-17)11-18(24)20-16-6-4-15(5-7-16)19-13(2)23/h4-7,10,12H,3,8-9,11H2,1-2H3,(H,19,23)(H,20,24)	JTTJZVICOZMDME-UHFFFAOYSA-N	CC1CCc2nn(CC(=O)Nc3ccc(NC(=O)C)cc3)cc2C1	BroadT	BRD-A07172053	BRD-A07172053-001-02-9	ChemDiv Inc.	C881-0769			CC1CCc2nn(CC(=O)Nc3ccc(NC(C)=O)cc3)cc2C1	InChI=1S/C18H22N4O2/c1-12-3-8-17-14(9-12)10-22(21-17)11-18(24)20-16-6-4-15(5-7-16)19-13(2)23/h4-7,10,12H,3,8-9,11H2,1-2H3,(H,19,23)(H,20,24)	JTTJZVICOZMDME-UHFFFAOYSA-N	326.174275984							116726
MLS000716896	LSM-28180	SID24809359, BRD-K81556831	4404530	InChI=1S/C16H9F3N6O2S2/c17-16(18,19)13-24-25-15(29-13)21-10(26)7-28-14-22-11(8-4-2-1-3-5-8)9(6-20)12(27)23-14/h1-5H,7H2,(H,21,25,26)(H,22,23,27)	CQEQGGXCAPZJAB-UHFFFAOYSA-N	Oc1nc(SCC(=O)Nc2nnc(s2)C(F)(F)F)nc(c3ccccc3)c1C#N	BroadT	BRD-K81556831	BRD-K81556831-001-06-0	Asinex Ltd.	ASN 12239689			Oc1nc(SCC(=O)Nc2nnc(s2)C(F)(F)F)nc(-c2ccccc2)c1C#N	InChI=1S/C16H9F3N6O2S2/c17-16(18,19)13-24-25-15(29-13)21-10(26)7-28-14-22-11(8-4-2-1-3-5-8)9(6-20)12(27)23-14/h1-5H,7H2,(H,21,25,26)(H,22,23,27)	CQEQGGXCAPZJAB-UHFFFAOYSA-N	438.018049568							116727
AC1LDN5Y	LSM-15424	BRD-A03433391	621982	InChI=1S/C11H11N3O3S/c1-7-6-12-11(18-7)13-10(15)8-3-2-4-9(5-8)14(16)17/h2-5,7H,6H2,1H3,(H,12,13,15)	ABXKIZOXAIJTAX-UHFFFAOYSA-N	CC1CN=C(NC(=O)c2cccc(c2)[N+](=O)[O-])S1	BroadT	BRD-A03433391	BRD-A03433391-003-05-9	Asinex Ltd.	BAS 02066887		Cl	CC1CN=C(NC(=O)c2cccc(c2)[N+]([O-])=O)S1.Cl	InChI=1S/C11H11N3O3S.ClH/c1-7-6-12-11(18-7)13-10(15)8-3-2-4-9(5-8)14(16)17;/h2-5,7H,6H2,1H3,(H,12,13,15);1H	SYXCVGGTVAIMSG-UHFFFAOYSA-N	265.052111932							104066, 104066
T6066540	LSM-28181	SID17517018, BRD-A10487276	4224748	InChI=1S/C21H24BrN3O2/c22-18-8-3-1-6-16(18)20-23-19-9-4-2-7-17(19)21(26)25(20)11-5-10-24-12-14-27-15-13-24/h1-4,6-9,20,23H,5,10-15H2	XKZUXXSJJHVVCD-UHFFFAOYSA-N	Brc1ccccc1C2Nc3ccccc3C(=O)N2CCCN4CCOCC4	BroadT	BRD-A10487276	BRD-A10487276-001-05-0	Enamine Ltd.	T5288826			Brc1ccccc1C1Nc2ccccc2C(=O)N1CCCN1CCOCC1	InChI=1S/C21H24BrN3O2/c22-18-8-3-1-6-16(18)20-23-19-9-4-2-7-17(19)21(26)25(20)11-5-10-24-12-14-27-15-13-24/h1-4,6-9,20,23H,5,10-15H2	XKZUXXSJJHVVCD-UHFFFAOYSA-N	429.105189638							116728
N-(4-Fluoro-phenyl)-4-[(tetrahydro-furan-2-ylmethyl)-sulfamoyl]-benzamide	LSM-28182	SID852472, BRD-A90401814	655091	InChI=1S/C18H19FN2O4S/c19-14-5-7-15(8-6-14)21-18(22)13-3-9-17(10-4-13)26(23,24)20-12-16-2-1-11-25-16/h3-10,16,20H,1-2,11-12H2,(H,21,22)	NXRCPBCWHVVKGP-UHFFFAOYSA-N	Fc1ccc(NC(=O)c2ccc(cc2)S(=O)(=O)NCC3CCCO3)cc1	BroadT	BRD-A90401814	BRD-A90401814-001-05-3	Asinex Ltd.	ASN 05061842			Fc1ccc(NC(=O)c2ccc(cc2)S(=O)(=O)NCC2CCCO2)cc1	InChI=1S/C18H19FN2O4S/c19-14-5-7-15(8-6-14)21-18(22)13-3-9-17(10-4-13)26(23,24)20-12-16-2-1-11-25-16/h3-10,16,20H,1-2,11-12H2,(H,21,22)	NXRCPBCWHVVKGP-UHFFFAOYSA-N	378.104955998							116729
AC1MIU67	LSM-15425	BRD-K03212522	3101651	InChI=1S/C10H10Cl2N6/c1-6-15-17-10(18(6)13)16-14-5-7-8(11)3-2-4-9(7)12/h2-5H,13H2,1H3,(H,16,17)	NEYXANVILPQNLA-UHFFFAOYSA-N	Cc1nnc(NN=Cc2c(Cl)cccc2Cl)n1N	BroadT	BRD-K03212522	BRD-K03212522-003-05-7	Asinex Ltd.	BAS 00345814		Cl	Cc1nnc(NN=Cc2c(Cl)cccc2Cl)n1N.Cl	InChI=1S/C10H10Cl2N6.ClH/c1-6-15-17-10(18(6)13)16-14-5-7-8(11)3-2-4-9(7)12;/h2-5H,13H2,1H3,(H,16,17);1H	FROAEKOELGRQCM-UHFFFAOYSA-N	284.0343998							104067
SMR000130144	LSM-28183	SID14732845, BRD-A28848457	5134713	InChI=1S/C20H23N3O4/c1-13-4-6-15(7-5-13)19(23-18(25)12-21-14(2)24)20(26)22-16-8-10-17(27-3)11-9-16/h4-11,19H,12H2,1-3H3,(H,21,24)(H,22,26)(H,23,25)	LBXLJNVLJXWKRS-UHFFFAOYSA-N	COc1ccc(NC(=O)C(NC(=O)CNC(=O)C)c2ccc(C)cc2)cc1	BroadT	BRD-A28848457	BRD-A28848457-001-06-2	ChemDiv Inc.	C094-0297			COc1ccc(NC(=O)C(NC(=O)CNC(C)=O)c2ccc(C)cc2)cc1	InChI=1S/C20H23N3O4/c1-13-4-6-15(7-5-13)19(23-18(25)12-21-14(2)24)20(26)22-16-8-10-17(27-3)11-9-16/h4-11,19H,12H2,1-3H3,(H,21,24)(H,22,26)(H,23,25)	LBXLJNVLJXWKRS-UHFFFAOYSA-N	369.168856246							116730
MLS000027151	LSM-28184	SID87337570, SID848851, BRD-A20871416	651315	InChI=1S/C23H22N4O3/c1-13-5-7-15(8-6-13)27-23-20(14(2)26-27)21(18(12-24)22(25)30-23)17-11-16(28-3)9-10-19(17)29-4/h5-11,21H,25H2,1-4H3	MSXJWRXYCOCVOS-UHFFFAOYSA-N	COc1ccc(OC)c(c1)C2C(=C(N)Oc3c2c(C)nn3c4ccc(C)cc4)C#N	BroadT	BRD-A20871416	BRD-A20871416-001-06-2	Asinex Ltd.	BAS 01104353			COc1ccc(OC)c(c1)C1c2c(C)nn(c2OC(N)=C1C#N)-c1ccc(C)cc1	InChI=1S/C23H22N4O3/c1-13-5-7-15(8-6-13)27-23-20(14(2)26-27)21(18(12-24)22(25)30-23)17-11-16(28-3)9-10-19(17)29-4/h5-11,21H,25H2,1-4H3	MSXJWRXYCOCVOS-UHFFFAOYSA-N	402.169190604							116731
MLS000882825	LSM-28185	SID26732166, BRD-K31755025	16746346	InChI=1S/C30H28FNO2/c1-19-7-6-10-25-28(19)30(34)32(18-21-8-4-3-5-9-21)29(25)24-15-16-27(31)26(17-24)23-13-11-22(12-14-23)20(2)33/h3-6,8-17,19,25,28-29H,7,18H2,1-2H3/t19-,25+,28+,29+/m1/s1	DNDVOBNXWAHKHM-WFGXUNSGSA-N	C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc3ccccc3)[C@H]2c4ccc(F)c(c4)c5ccc(cc5)C(=O)C	BroadT	BRD-K31755025	BRD-K31755025-001-06-5	University of Kansas CMLD	KUC101278N			C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc1ccccc1)[C@H]2c1ccc(F)c(c1)-c1ccc(cc1)C(C)=O	InChI=1S/C30H28FNO2/c1-19-7-6-10-25-28(19)30(34)32(18-21-8-4-3-5-9-21)29(25)24-15-16-27(31)26(17-24)23-13-11-22(12-14-23)20(2)33/h3-6,8-17,19,25,28-29H,7,18H2,1-2H3/t19-,25+,28+,29+/m1/s1	DNDVOBNXWAHKHM-WFGXUNSGSA-N	453.210407346							116732
CHEMBL1083672	LSM-15426	BRD-A22578298	2770390	InChI=1S/C30H33N3O4/c1-2-7-22-8-3-4-13-27(22)37-21-24(34)20-32-16-14-31(15-17-32)18-19-33-29(35)25-11-5-9-23-10-6-12-26(28(23)25)30(33)36/h2-6,8-13,24,34H,1,7,14-21H2	YRMGKUZRKWDWIE-UHFFFAOYSA-N	OC(COc1ccccc1CC=C)CN2CCN(CCN3C(=O)c4cccc5cccc(C3=O)c45)CC2	BroadT	BRD-A22578298	BRD-A22578298-003-05-2	ChemBridge Corporation	6277676		Cl	OC(COc1ccccc1CC=C)CN1CCN(CCN2C(=O)c3cccc4cccc(C2=O)c34)CC1.Cl	InChI=1S/C30H33N3O4.ClH/c1-2-7-22-8-3-4-13-27(22)37-21-24(34)20-32-16-14-31(15-17-32)18-19-33-29(35)25-11-5-9-23-10-6-12-26(28(23)25)30(33)36;/h2-6,8-13,24,34H,1,7,14-21H2;1H	NSJPASQMJUSERP-UHFFFAOYSA-N	499.247106566							104068, 104068
1-(5-Ethyl-2,4-dihydroxyphenyl)-2-(2-fluorophenoxy)ethanone	LSM-28186	SID7973291, BRD-K33727174	886160	InChI=1S/C16H15FO4/c1-2-10-7-11(14(19)8-13(10)18)15(20)9-21-16-6-4-3-5-12(16)17/h3-8,18-19H,2,9H2,1H3	UIPCORYGHWFKKA-UHFFFAOYSA-N	CCc1cc(C(=O)COc2ccccc2F)c(O)cc1O	BroadT	BRD-K33727174	BRD-K33727174-001-05-3	ChemBridge Corporation	6643695			CCc1cc(C(=O)COc2ccccc2F)c(O)cc1O	InChI=1S/C16H15FO4/c1-2-10-7-11(14(19)8-13(10)18)15(20)9-21-16-6-4-3-5-12(16)17/h3-8,18-19H,2,9H2,1H3	UIPCORYGHWFKKA-UHFFFAOYSA-N	290.09543716							116733
SMR000220652	LSM-28187	SID17513812, BRD-A61598056	3271684	InChI=1S/C23H24N4O3S/c1-23(2)9-14-15(11-30-23)18(16-6-4-8-29-16)27-22-17(14)19-20(31-22)21(26-12-25-19)24-10-13-5-3-7-28-13/h4,6,8,12-13H,3,5,7,9-11H2,1-2H3,(H,24,25,26)	DORNVAFGAGAUGV-UHFFFAOYSA-N	CC1(C)Cc2c(CO1)c(nc3sc4c(NCC5CCCO5)ncnc4c23)c6occc6	BroadT	BRD-A61598056	BRD-A61598056-001-05-8	InterBioScreen Ltd.	STOCK4S-50125			CC1(C)Cc2c(CO1)c(nc1sc3c(NCC4CCCO4)ncnc3c21)-c1ccco1	InChI=1S/C23H24N4O3S/c1-23(2)9-14-15(11-30-23)18(16-6-4-8-29-16)27-22-17(14)19-20(31-22)21(26-12-25-19)24-10-13-5-3-7-28-13/h4,6,8,12-13H,3,5,7,9-11H2,1-2H3,(H,24,25,26)	DORNVAFGAGAUGV-UHFFFAOYSA-N	436.156911358							116734
AC1LDAV7	LSM-28188	SID862841, BRD-A81151172	664074	InChI=1S/C16H17NO3S2/c18-16(13-5-2-1-3-6-13)17(11-15-7-4-9-21-15)14-8-10-22(19,20)12-14/h1-7,9,14H,8,10-12H2	LCKKXPPMKDFICM-UHFFFAOYSA-N	O=C(N(Cc1cccs1)C2CCS(=O)(=O)C2)c3ccccc3	BroadT	BRD-A81151172	BRD-A81151172-001-05-1	InterBioScreen Ltd.	STOCK4S-54582			O=C(N(Cc1cccs1)C1CCS(=O)(=O)C1)c1ccccc1	InChI=1S/C16H17NO3S2/c18-16(13-5-2-1-3-6-13)17(11-15-7-4-9-21-15)14-8-10-22(19,20)12-14/h1-7,9,14H,8,10-12H2	LCKKXPPMKDFICM-UHFFFAOYSA-N	335.064984794							131286
SMR000022603	LSM-28189	SID26724835, SID4244755, BRD-K66376719	3239310	InChI=1S/C26H30ClN5O3/c27-21-6-3-7-22(17-21)31-15-13-30(14-16-31)11-4-10-28-24(33)18-29-25(34)19-32-12-9-20-5-1-2-8-23(20)26(32)35/h1-3,5-9,12,17H,4,10-11,13-16,18-19H2,(H,28,33)(H,29,34)	QXNDGEQWUVIXRO-UHFFFAOYSA-N	Clc1cccc(c1)N2CCN(CCCNC(=O)CNC(=O)CN3C=Cc4ccccc4C3=O)CC2	BroadT	BRD-K66376719	BRD-K66376719-001-05-1	ChemDiv Inc.	C168-0121			Clc1cccc(c1)N1CCN(CCCNC(=O)CNC(=O)Cn2ccc3ccccc3c2=O)CC1	InChI=1S/C26H30ClN5O3/c27-21-6-3-7-22(17-21)31-15-13-30(14-16-31)11-4-10-28-24(33)18-29-25(34)19-32-12-9-20-5-1-2-8-23(20)26(32)35/h1-3,5-9,12,17H,4,10-11,13-16,18-19H2,(H,28,33)(H,29,34)	QXNDGEQWUVIXRO-UHFFFAOYSA-N	495.20371758							116737
ST51034636	LSM-28190	SID14735217, BRD-K01093546	9550639	InChI=1S/C18H17N5/c1-12-3-6-14(7-4-12)10-19-17-18-22-20-11-23(18)16-9-13(2)5-8-15(16)21-17/h3-9,11H,10H2,1-2H3,(H,19,21)	IOYIWROOEYGVMH-UHFFFAOYSA-N	Cc1ccc(CNc2nc3ccc(C)cc3n4cnnc24)cc1	BroadT	BRD-K01093546	BRD-K01093546-001-04-2	ChemDiv Inc.	C301-1514			Cc1ccc(CNc2nc3ccc(C)cc3n3cnnc23)cc1	InChI=1S/C18H17N5/c1-12-3-6-14(7-4-12)10-19-17-18-22-20-11-23(18)16-9-13(2)5-8-15(16)21-17/h3-9,11H,10H2,1-2H3,(H,19,21)	IOYIWROOEYGVMH-UHFFFAOYSA-N	303.148395594							116738
MLS000122396	LSM-15427	BRD-K33157926	1439015	InChI=1S/C19H22ClN5O/c20-18-10-4-1-6-15(18)12-24(13-17-9-5-11-26-17)14-19-21-22-23-25(19)16-7-2-3-8-16/h1,4-6,9-11,16H,2-3,7-8,12-14H2	OKRUNHSVYVBMBF-UHFFFAOYSA-N	Clc1ccccc1CN(Cc2occc2)Cc3nnnn3C4CCCC4	BroadT	BRD-K33157926	BRD-K33157926-003-07-6	Asinex Ltd.	ASN 05087468		Cl	Clc1ccccc1CN(Cc1ccco1)Cc1nnnn1C1CCCC1.Cl	InChI=1S/C19H22ClN5O.ClH/c20-18-10-4-1-6-15(18)12-24(13-17-9-5-11-26-17)14-19-21-22-23-25(19)16-7-2-3-8-16;/h1,4-6,9-11,16H,2-3,7-8,12-14H2;1H	IRPXIRZTYOVJIY-UHFFFAOYSA-N	371.151288084							104069, 104069
CBMICRO_025450	LSM-28191	SID7974493, BRD-K11931139	872287	InChI=1S/C17H18N4/c1-12(2)15-11-7-8-13(3)16(15)21-17(18-19-20-21)14-9-5-4-6-10-14/h4-12H,1-3H3	GHLIFTSCRSQYIY-UHFFFAOYSA-N	CC(C)c1cccc(C)c1n2nnnc2c3ccccc3	BroadT	BRD-K11931139	BRD-K11931139-001-05-1	ChemBridge Corporation	5576411			CC(C)c1cccc(C)c1-n1nnnc1-c1ccccc1	InChI=1S/C17H18N4/c1-12(2)15-11-7-8-13(3)16(15)21-17(18-19-20-21)14-9-5-4-6-10-14/h4-12H,1-3H3	GHLIFTSCRSQYIY-UHFFFAOYSA-N	278.153146616							116739
MLS000087136	LSM-28192	SID4242313, BRD-K03178156	3237184	InChI=1S/C23H21ClN4O4/c1-14-10-22(26-28(14)13-15-4-7-17(24)8-5-15)25-23(29)18-12-20(32-27-18)16-6-9-19(30-2)21(11-16)31-3/h4-12H,13H2,1-3H3,(H,25,26,29)	AAXMQQXWRPGRCS-UHFFFAOYSA-N	COc1ccc(cc1OC)c2onc(c2)C(=O)Nc3cc(C)n(Cc4ccc(Cl)cc4)n3	BroadT	BRD-K03178156	BRD-K03178156-001-05-7	ChemDiv Inc.	C226-1133			COc1ccc(cc1OC)-c1cc(no1)C(=O)Nc1cc(C)n(Cc2ccc(Cl)cc2)n1	InChI=1S/C23H21ClN4O4/c1-14-10-22(26-28(14)13-15-4-7-17(24)8-5-15)25-23(29)18-12-20(32-27-18)16-6-9-19(30-2)21(11-16)31-3/h4-12H,13H2,1-3H3,(H,25,26,29)	AAXMQQXWRPGRCS-UHFFFAOYSA-N	452.125132902							116740
SMR000198697	LSM-28193	SID17506562, BRD-K90562592	1184248	InChI=1S/C21H26N2O4S/c1-3-27-21(25)19-17(16-6-4-15(2)5-7-16)14-28-20(19)22-18(24)8-9-23-10-12-26-13-11-23/h4-7,14H,3,8-13H2,1-2H3,(H,22,24)	IVVTYJWBIJOMGI-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)CCN2CCOCC2)scc1c3ccc(C)cc3	BroadT	BRD-K90562592	BRD-K90562592-001-06-6	ChemBridge Corporation	7570232			CCOC(=O)c1c(NC(=O)CCN2CCOCC2)scc1-c1ccc(C)cc1	InChI=1S/C21H26N2O4S/c1-3-27-21(25)19-17(16-6-4-15(2)5-7-16)14-28-20(19)22-18(24)8-9-23-10-12-26-13-11-23/h4-7,14H,3,8-13H2,1-2H3,(H,22,24)	IVVTYJWBIJOMGI-UHFFFAOYSA-N	402.161328022							116741
AC1LQJKW	LSM-15577	BRD-K92015673	1377179	InChI=1S/C19H25N3O2/c1-15-17(23-2)8-7-16(19(15)24-3)14-21-10-12-22(13-11-21)18-6-4-5-9-20-18/h4-9H,10-14H2,1-3H3	YQJNGUIVACYDCQ-UHFFFAOYSA-N	COc1ccc(CN2CCN(CC2)c3ccccn3)c(OC)c1C	BroadT	BRD-K92015673	BRD-K92015673-034-09-0	ChemBridge Corporation	5266759		OC(=O)C(=O)O	COc1ccc(CN2CCN(CC2)c2ccccn2)c(OC)c1C.OC(=O)C(=O)O	InChI=1S/C19H25N3O2.C2H2O4/c1-15-17(23-2)8-7-16(19(15)24-3)14-21-10-12-22(13-11-21)18-6-4-5-9-20-18;3-1(4)2(5)6/h4-9H,10-14H2,1-3H3;(H,3,4)(H,5,6)	MLVBYNSTNLVOOE-UHFFFAOYSA-N	327.19467707							104213, 104213
AM-807/14144016	LSM-28194	BRD-K34394171	670414	InChI=1S/C13H16N4O2S/c1-18-7-9-10-12(17-16-9)19-11(15)8(6-14)13(10)2-4-20-5-3-13/h8,15H,2-5,7H2,1H3,(H,16,17)	SGSPXWSHOCVIHS-UHFFFAOYSA-N	COCc1[nH]nc2OC(=N)C(C#N)C3(CCSCC3)c12	BroadT	BRD-K34394171	BRD-K34394171-001-07-0	ChemBridge Corporation	7904123			COCc1n[nH]c2OC(N)=C(C#N)C3(CCSCC3)c12	InChI=1S/C13H16N4O2S/c1-18-7-9-10-12(17-16-9)19-11(15)8(6-14)13(10)2-4-20-5-3-13/h2-5,7,15H2,1H3,(H,16,17)	WNXWUQRVNFZHIJ-UHFFFAOYSA-N	292.099396482							
AC1LEFJG	LSM-28195	SID7976403, BRD-K99735928	711403	InChI=1S/C15H21N3O2/c1-16-15(19)14-10-11-9-12(20-4)5-6-13(11)18(14)8-7-17(2)3/h5-6,9-10H,7-8H2,1-4H3,(H,16,19)	XZIUKDLQCFKQSU-UHFFFAOYSA-N	CNC(=O)c1cc2cc(OC)ccc2n1CCN(C)C	BroadT	BRD-K99735928	BRD-K99735928-001-05-6	ChemBridge Corporation	6048822			CNC(=O)c1cc2cc(OC)ccc2n1CCN(C)C	InChI=1S/C15H21N3O2/c1-16-15(19)14-10-11-9-12(20-4)5-6-13(11)18(14)8-7-17(2)3/h5-6,9-10H,7-8H2,1-4H3,(H,16,19)	XZIUKDLQCFKQSU-UHFFFAOYSA-N	275.163376942							116743
BAS 12915064	LSM-28196	SID49680967, BRD-K08665105	3163624	InChI=1S/C16H11ClN4O3S2/c17-12-2-1-10(7-11(12)15(23)24)19-13(22)8-25-16-21-20-14(26-16)9-3-5-18-6-4-9/h1-7H,8H2,(H,19,22)(H,23,24)	IPWPZEUDOVPHLI-UHFFFAOYSA-N	OC(=O)c1cc(NC(=O)CSc2nnc(s2)c3ccncc3)ccc1Cl	BroadT	BRD-K08665105	BRD-K08665105-001-06-8	Asinex Ltd.	BAS 12915064			OC(=O)c1cc(NC(=O)CSc2nnc(s2)-c2ccncc2)ccc1Cl	InChI=1S/C16H11ClN4O3S2/c17-12-2-1-10(7-11(12)15(23)24)19-13(22)8-25-16-21-20-14(26-16)9-3-5-18-6-4-9/h1-7H,8H2,(H,19,22)(H,23,24)	IPWPZEUDOVPHLI-UHFFFAOYSA-N	405.996109342							116744
5-(2-Ethoxyphenyl)-1,3,4-oxadiazole-2-thiol	LSM-28197	SID14734300, BRD-K35805682	2235547	InChI=1S/C10H10N2O2S/c1-2-13-8-6-4-3-5-7(8)9-11-12-10(15)14-9/h3-6H,2H2,1H3,(H,12,15)	VTXLLACKNPVAJW-UHFFFAOYSA-N	CCOc1ccccc1c2oc(S)nn2	BroadT	BRD-K35805682	BRD-K35805682-001-05-0	ChemBridge Corporation	7975596			CCOc1ccccc1-c1nnc(S)o1	InChI=1S/C10H10N2O2S/c1-2-13-8-6-4-3-5-7(8)9-11-12-10(15)14-9/h3-6H,2H2,1H3,(H,12,15)	VTXLLACKNPVAJW-UHFFFAOYSA-N	222.04629827							116745
AC1LYT4I	LSM-15605	BRD-K79200788	1884092	InChI=1S/C28H37N2O2/c1-6-29(7-2)18-19-30-22(5)20-25(23-10-14-26(15-11-23)31-8-3)21-28(30)24-12-16-27(17-13-24)32-9-4/h10-17,20-21H,6-9,18-19H2,1-5H3/q+1	TXSMRDKQYDZAOK-UHFFFAOYSA-N	CCOc1ccc(cc1)c2cc(C)[n+](CCN(CC)CC)c(c2)c3ccc(OCC)cc3	BroadT	BRD-K79200788	BRD-K79200788-009-10-7	InterBioScreen Ltd.	STOCK3S-89226		OCl(=O)(=O)=O	CCOc1ccc(cc1)-c1cc(C)[n+](CCN(CC)CC)c(c1)-c1ccc(OCC)cc1.OCl(=O)(=O)=O	InChI=1S/C28H37N2O2.ClHO4/c1-6-29(7-2)18-19-30-22(5)20-25(23-10-14-26(15-11-23)31-8-3)21-28(30)24-12-16-27(17-13-24)32-9-4;2-1(3,4)5/h10-17,20-21H,6-9,18-19H2,1-5H3;(H,2,3,4,5)/q+1;	BFUSLBQAPFZGJE-UHFFFAOYSA-N	433.285503444							104240, 104240
SMR000217588	LSM-28198	SID17512739, BRD-K33916146	3429565	InChI=1S/C30H24N2O5S/c1-2-37-30(36)27-24(21-13-11-20(12-14-21)19-7-4-3-5-8-19)18-38-29(27)31-28(35)22-9-6-10-23(17-22)32-25(33)15-16-26(32)34/h3-14,17-18H,2,15-16H2,1H3,(H,31,35)	OZOZNSALZZUQSJ-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)c2cccc(c2)N3C(=O)CCC3=O)scc1c4ccc(cc4)c5ccccc5	BroadT	BRD-K33916146	BRD-K33916146-001-05-7	InterBioScreen Ltd.	STOCK2S-94770			CCOC(=O)c1c(NC(=O)c2cccc(c2)N2C(=O)CCC2=O)scc1-c1ccc(cc1)-c1ccccc1	InChI=1S/C30H24N2O5S/c1-2-37-30(36)27-24(21-13-11-20(12-14-21)19-7-4-3-5-8-19)18-38-29(27)31-28(35)22-9-6-10-23(17-22)32-25(33)15-16-26(32)34/h3-14,17-18H,2,15-16H2,1H3,(H,31,35)	OZOZNSALZZUQSJ-UHFFFAOYSA-N	524.140592578							116746
AC1LUTEB	LSM-28199	SID17515484, BRD-K02200885	1589778	InChI=1S/C17H18N2OS/c1-13-6-2-5-9-16(13)20-10-11-21-12-17-18-14-7-3-4-8-15(14)19-17/h2-9H,10-12H2,1H3,(H,18,19)	PFVBTKVGGOKVPL-UHFFFAOYSA-N	Cc1ccccc1OCCSCc2nc3ccccc3[nH]2	BroadT	BRD-K02200885	BRD-K02200885-001-05-8	Life Chemicals Inc.	F1626-0094			Cc1ccccc1OCCSCc1nc2ccccc2[nH]1	InChI=1S/C17H18N2OS/c1-13-6-2-5-9-16(13)20-10-11-21-12-17-18-14-7-3-4-8-15(14)19-17/h2-9H,10-12H2,1H3,(H,18,19)	PFVBTKVGGOKVPL-UHFFFAOYSA-N	298.113983906							116747
MLS000043196	LSM-28200	SID4245293, SID51088165, BRD-K80775267	998899	InChI=1S/C25H27N3O4/c29-19-8-9-22-21(15-19)20-7-4-10-28(24(20)25(31)32-22)23(30)17-27-13-11-26(12-14-27)16-18-5-2-1-3-6-18/h1-3,5-6,8-9,15,29H,4,7,10-14,16-17H2	STJDQUHURWGTBV-UHFFFAOYSA-N	Oc1ccc2OC(=O)C3=C(CCCN3C(=O)CN4CCN(Cc5ccccc5)CC4)c2c1	BroadT	BRD-K80775267	BRD-K80775267-001-11-0	ChemDiv Inc.	5605-0002			Oc1ccc2oc(=O)c3N(CCCc3c2c1)C(=O)CN1CCN(Cc2ccccc2)CC1	InChI=1S/C25H27N3O4/c29-19-8-9-22-21(15-19)20-7-4-10-28(24(20)25(31)32-22)23(30)17-27-13-11-26(12-14-27)16-18-5-2-1-3-6-18/h1-3,5-6,8-9,15,29H,4,7,10-14,16-17H2	STJDQUHURWGTBV-UHFFFAOYSA-N	433.200156374							116748
AC1NMQWB	LSM-28201	BRD-K97398770	5014505	InChI=1S/C15H12N4O3/c1-10-8-14(17-13-5-3-2-4-12(10)13)18-16-9-11-6-7-15(22-11)19(20)21/h2-9H,1H3,(H,17,18)	NNWFDORZRKRZBL-UHFFFAOYSA-N	Cc1cc(NN=Cc2oc(cc2)[N+](=O)[O-])nc3ccccc13	BroadT	BRD-K97398770	BRD-K97398770-001-05-4	Enamine Ltd.	T0510-8221			Cc1cc(NN=Cc2ccc(o2)[N+]([O-])=O)nc2ccccc12	InChI=1S/C15H12N4O3/c1-10-8-14(17-13-5-3-2-4-12(10)13)18-16-9-11-6-7-15(22-11)19(20)21/h2-9H,1H3,(H,17,18)	NNWFDORZRKRZBL-UHFFFAOYSA-N	296.090940284							116749
ASN 04373725	LSM-28202	SID26668055, SID847565, BRD-K74965657	649970	InChI=1S/C23H30N6O3S/c1-4-12-29-19-20(26(2)23(32)27(3)21(19)31)25-22(29)33-15-18(30)24-16-10-6-7-11-17(16)28-13-8-5-9-14-28/h6-7,10-11H,4-5,8-9,12-15H2,1-3H3,(H,24,30)	NNILYJTZTWGWRW-UHFFFAOYSA-N	CCCn1c(SCC(=O)Nc2ccccc2N3CCCCC3)nc4N(C)C(=O)N(C)C(=O)c14	BroadT	BRD-K74965657	BRD-K74965657-001-05-5	Asinex Ltd.	ASN 04373725			CCCn1c(SCC(=O)Nc2ccccc2N2CCCCC2)nc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C23H30N6O3S/c1-4-12-29-19-20(26(2)23(32)27(3)21(19)31)25-22(29)33-15-18(30)24-16-10-6-7-11-17(16)28-13-8-5-9-14-28/h6-7,10-11H,4-5,8-9,12-15H2,1-3H3,(H,24,30)	NNILYJTZTWGWRW-UHFFFAOYSA-N	470.21000957							116750
1,1-Dimethyl-3-(3-morpholin-4-ylpropyl)-3-(naphthalen-1-ylmethyl)urea	LSM-28203	SID26661225, BRD-K15352874	3438105	InChI=1S/C21H29N3O2/c1-22(2)21(25)24(12-6-11-23-13-15-26-16-14-23)17-19-9-5-8-18-7-3-4-10-20(18)19/h3-5,7-10H,6,11-17H2,1-2H3	VEMRWNJNCOGHAG-UHFFFAOYSA-N	CN(C)C(=O)N(CCCN1CCOCC1)Cc2cccc3ccccc23	BroadT	BRD-K15352874	BRD-K15352874-001-04-8	InterBioScreen Ltd.	STOCK5S-08873			CN(C)C(=O)N(CCCN1CCOCC1)Cc1cccc2ccccc12	InChI=1S/C21H29N3O2/c1-22(2)21(25)24(12-6-11-23-13-15-26-16-14-23)17-19-9-5-8-18-7-3-4-10-20(18)19/h3-5,7-10H,6,11-17H2,1-2H3	VEMRWNJNCOGHAG-UHFFFAOYSA-N	355.225977198							116751
SMR000155572	LSM-28204	SID14743906, BRD-A44938643	4571028	InChI=1S/C24H21FN4O2S/c1-15-14-21-26-27-24(29(21)19-7-3-2-6-18(15)19)32-20-8-4-5-13-28(23(20)31)22(30)16-9-11-17(25)12-10-16/h2-3,6-7,9-12,14,20H,4-5,8,13H2,1H3	RIWDNPWRWRQCDB-UHFFFAOYSA-N	Cc1cc2nnc(SC3CCCCN(C(=O)c4ccc(F)cc4)C3=O)n2c5ccccc15	BroadT	BRD-A44938643	BRD-A44938643-001-05-8	Enamine Ltd.	T0505-1541			Cc1cc2nnc(SC3CCCCN(C(=O)c4ccc(F)cc4)C3=O)n2c2ccccc12	InChI=1S/C24H21FN4O2S/c1-15-14-21-26-27-24(29(21)19-7-3-2-6-18(15)19)32-20-8-4-5-13-28(23(20)31)22(30)16-9-11-17(25)12-10-16/h2-3,6-7,9-12,14,20H,4-5,8,13H2,1H3	RIWDNPWRWRQCDB-UHFFFAOYSA-N	448.136924842							116752
ST50806633	LSM-28205	SID4249783, BRD-K03015649	3243685	InChI=1S/C18H19N5O/c1-12-8-13(2)10-15(9-12)23-17(19)16(21-22-23)18(24)20-11-14-6-4-3-5-7-14/h3-10H,11,19H2,1-2H3,(H,20,24)	FPHXYZBWMXSJJD-UHFFFAOYSA-N	Cc1cc(C)cc(c1)n2nnc(C(=O)NCc3ccccc3)c2N	BroadT	BRD-K03015649	BRD-K03015649-001-05-6	ChemDiv Inc.	K236-0062			Cc1cc(C)cc(c1)-n1nnc(C(=O)NCc2ccccc2)c1N	InChI=1S/C18H19N5O/c1-12-8-13(2)10-15(9-12)23-17(19)16(21-22-23)18(24)20-11-14-6-4-3-5-7-14/h3-10H,11,19H2,1-2H3,(H,20,24)	FPHXYZBWMXSJJD-UHFFFAOYSA-N	321.158960278							116753
SMR000143741	LSM-44257	SID14736565, BRD-K59770045	5740565	InChI=1S/C22H18N2O7/c1-13(25)30-21-11-16(23-19-7-5-4-6-18(19)21)9-8-15-10-17(29-3)12-20(24(27)28)22(15)31-14(2)26/h4-12H,1-3H3/b9-8+	ULCXTEUAQBVMFX-CMDGGOBGSA-N	COc1cc(\C=C\c2cc(OC(=O)C)c3ccccc3n2)c(OC(=O)C)c(c1)[N+](=O)[O-]	BroadT	BRD-K59770045	BRD-K59770045-001-05-9	ChemBridge Corporation	7925258			COc1cc(\C=C\c2cc(OC(C)=O)c3ccccc3n2)c(OC(C)=O)c(c1)[N+]([O-])=O	InChI=1S/C22H18N2O7/c1-13(25)30-21-11-16(23-19-7-5-4-6-18(19)21)9-8-15-10-17(29-3)12-20(24(27)28)22(15)31-14(2)26/h4-12H,1-3H3/b9-8+	ULCXTEUAQBVMFX-CMDGGOBGSA-N	422.111400936							
SMR000093110	LSM-28207	DNDI1417773, BRD-K00458318	4219491	InChI=1S/C22H23N3O3/c1-15-12-21(25-8-10-28-11-9-25)24-20-7-6-17(14-19(15)20)23-22(26)16-4-3-5-18(13-16)27-2/h3-7,12-14H,8-11H2,1-2H3,(H,23,26)	BAZRAAMGZKIEJC-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Nc2ccc3nc(cc(C)c3c2)N4CCOCC4	BroadT	BRD-K00458318	BRD-K00458318-001-04-4	ChemDiv Inc.	C095-0158			COc1cccc(c1)C(=O)Nc1ccc2nc(cc(C)c2c1)N1CCOCC1	InChI=1S/C22H23N3O3/c1-15-12-21(25-8-10-28-11-9-25)24-20-7-6-17(14-19(15)20)23-22(26)16-4-3-5-18(13-16)27-2/h3-7,12-14H,8-11H2,1-2H3,(H,23,26)	BAZRAAMGZKIEJC-UHFFFAOYSA-N	377.173941626							116755
STK637646	LSM-28208	SID859106, BRD-A54152388	660407	InChI=1S/C17H18N2O5S2/c1-4-24-14(20)9-25-17-11(8-18)15(21)19-16(26-17)10-5-6-12(22-2)13(7-10)23-3/h5-7,16H,4,9H2,1-3H3,(H,19,21)	WQUZEDLZKAXQDZ-UHFFFAOYSA-N	CCOC(=O)CSC1=C(C#N)C(=O)NC(S1)c2ccc(OC)c(OC)c2	BroadT	BRD-A54152388	BRD-A54152388-001-05-2	InterBioScreen Ltd.	STOCK2S-95408			CCOC(=O)CSC1=C(C#N)C(=O)NC(S1)c1ccc(OC)c(OC)c1	InChI=1S/C17H18N2O5S2/c1-4-24-14(20)9-25-17-11(8-18)15(21)19-16(26-17)10-5-6-12(22-2)13(7-10)23-3/h5-7,16H,4,9H2,1-3H3,(H,19,21)	WQUZEDLZKAXQDZ-UHFFFAOYSA-N	394.065713076							116756
AC1OAYAW	LSM-28209	SID22400659, BRD-K73711782	6837239	InChI=1S/C12H12N2O3S/c1-2-17-9-5-7(3-4-8(9)15)6-10-11(13)14-12(16)18-10/h3-6,15H,2H2,1H3,(H2,13,14,16)/b10-6-	OVJVVTLPOZCJIU-POHAHGRESA-N	CCOc1cc(\C=C\2/SC(=O)N=C2N)ccc1O	BroadT	BRD-K73711782	BRD-K73711782-001-05-2	Life Chemicals Inc.	F1740-0343			CCOc1cc(\C=C2SC(=O)N=C/2N)ccc1O	InChI=1S/C12H12N2O3S/c1-2-17-9-5-7(3-4-8(9)15)6-10-11(13)14-12(16)18-10/h3-6,15H,2H2,1H3,(H2,13,14,16)/b10-6-	OVJVVTLPOZCJIU-POHAHGRESA-N	264.056862954							
AMBCB93498458	LSM-28210	SID24782188, BRD-A77497678	16187798	InChI=1S/C25H27FN4O/c1-4-30-15-18(16(2)28-30)14-29-12-11-20-19-7-5-6-8-22(19)27-24(20)25(29)17-9-10-21(26)23(13-17)31-3/h5-10,13,15,25,27H,4,11-12,14H2,1-3H3	DPXMBHSCQSNZNF-UHFFFAOYSA-N	CCn1cc(CN2CCc3c([nH]c4ccccc34)C2c5ccc(F)c(OC)c5)c(C)n1	BroadT	BRD-A77497678	BRD-A77497678-001-05-3	ChemBridge Corporation	93498458			CCn1cc(CN2CCc3c([nH]c4ccccc34)C2c2ccc(F)c(OC)c2)c(C)n1	InChI=1S/C25H27FN4O/c1-4-30-15-18(16(2)28-30)14-29-12-11-20-19-7-5-6-8-22(19)27-24(20)25(29)17-9-10-21(26)23(13-17)31-3/h5-10,13,15,25,27H,4,11-12,14H2,1-3H3	DPXMBHSCQSNZNF-UHFFFAOYSA-N	418.216889724							116758
SMR000036032	LSM-28211	SID856512, BRD-K77758003	657871	InChI=1S/C18H18N2O3S/c1-11-7-8-15(23-11)17-12-5-3-4-6-14(12)20-18(13(17)9-19)24-10-16(21)22-2/h7-8H,3-6,10H2,1-2H3	JGDDLGRMLWKQSF-UHFFFAOYSA-N	COC(=O)CSc1nc2CCCCc2c(c3oc(C)cc3)c1C#N	BroadT	BRD-K77758003	BRD-K77758003-001-05-2	InterBioScreen Ltd.	STOCK1S-19752			COC(=O)CSc1nc2CCCCc2c(-c2ccc(C)o2)c1C#N	InChI=1S/C18H18N2O3S/c1-11-7-8-15(23-11)17-12-5-3-4-6-14(12)20-18(13(17)9-19)24-10-16(21)22-2/h7-8H,3-6,10H2,1-2H3	JGDDLGRMLWKQSF-UHFFFAOYSA-N	342.103813146							116759
MLS-0069430.0001	LSM-44258	SID14736554, SID48410158, BRD-K24778510	5511900	InChI=1S/C12H10N2O3S2/c15-10(16)7-14-11(17)9(19-12(14)18)6-13-8-4-2-1-3-5-8/h1-6,13H,7H2,(H,15,16)/b9-6+	DVVLESVKJXGQMK-RMKNXTFCSA-N	OC(=O)CN1C(=S)S\C(=C\Nc2ccccc2)\C1=O	BroadT	BRD-K24778510	BRD-K24778510-001-05-0	ChemBridge Corporation	5160602			OC(=O)CN1C(=S)S\C(=C\Nc2ccccc2)C1=O	InChI=1S/C12H10N2O3S2/c15-10(16)7-14-11(17)9(19-12(14)18)6-13-8-4-2-1-3-5-8/h1-6,13H,7H2,(H,15,16)/b9-6+	DVVLESVKJXGQMK-RMKNXTFCSA-N	294.01328358							
SMR000005653	LSM-28213	SID847005, BRD-A87575410	649400	InChI=1S/C24H25FN6S/c25-20-8-10-21(11-9-20)29-14-16-30(17-15-29)23(22-7-4-18-32-22)24-26-27-28-31(24)13-12-19-5-2-1-3-6-19/h1-11,18,23H,12-17H2	GEKYGCMWODMRGE-UHFFFAOYSA-N	Fc1ccc(cc1)N2CCN(CC2)C(c3cccs3)c4nnnn4CCc5ccccc5	BroadT	BRD-A87575410	BRD-A87575410-001-05-7	Asinex Ltd.	ASN 05834200			Fc1ccc(cc1)N1CCN(CC1)C(c1cccs1)c1nnnn1CCc1ccccc1	InChI=1S/C24H25FN6S/c25-20-8-10-21(11-9-20)29-14-16-30(17-15-29)23(22-7-4-18-32-22)24-26-27-28-31(24)13-12-19-5-2-1-3-6-19/h1-11,18,23H,12-17H2	GEKYGCMWODMRGE-UHFFFAOYSA-N	448.18454375							116761
HMS2421C11	LSM-28214	BRD-K67505366	11957147	InChI=1S/C17H19Cl2N5O4/c1-11(10-23-12(2)8-16(22-23)24(26)27)20-21-17(25)4-3-7-28-15-6-5-13(18)9-14(15)19/h5-6,8-9H,3-4,7,10H2,1-2H3,(H,21,25)	UZIDADWZHBNOIU-UHFFFAOYSA-N	CC(=NNC(=O)CCCOc1ccc(Cl)cc1Cl)Cn2nc(cc2C)[N+](=O)[O-]	BroadT	BRD-K67505366	BRD-K67505366-001-05-0	Specs	AK-968/11566686			CC(Cn1nc(cc1C)[N+]([O-])=O)=NNC(=O)CCCOc1ccc(Cl)cc1Cl	InChI=1S/C17H19Cl2N5O4/c1-11(10-23-12(2)8-16(22-23)24(26)27)20-21-17(25)4-3-7-28-15-6-5-13(18)9-14(15)19/h5-6,8-9H,3-4,7,10H2,1-2H3,(H,21,25)	UZIDADWZHBNOIU-UHFFFAOYSA-N	427.081409558							116762
AP-853/42160194	LSM-28215	SID847826, BRD-K31805891	650240	InChI=1S/C16H13ClN4O2S/c17-12-1-3-13(4-2-12)19-14(22)7-10-24-16-21-20-15(23-16)11-5-8-18-9-6-11/h1-6,8-9H,7,10H2,(H,19,22)	ZAYBSMBHEHVNSU-UHFFFAOYSA-N	Clc1ccc(NC(=O)CCSc2oc(nn2)c3ccncc3)cc1	BroadT	BRD-K31805891	BRD-K31805891-001-07-7	Asinex Ltd.	BAS 06981906			Clc1ccc(NC(=O)CCSc2nnc(o2)-c2ccncc2)cc1	InChI=1S/C16H13ClN4O2S/c17-12-1-3-13(4-2-12)19-14(22)7-10-24-16-21-20-15(23-16)11-5-8-18-9-6-11/h1-6,8-9H,7,10H2,(H,19,22)	ZAYBSMBHEHVNSU-UHFFFAOYSA-N	360.044774096							116763
SMR000029979	LSM-28216	SID4249806, BRD-A60150264	3243704	InChI=1S/C24H31FN4O/c25-21-8-10-22(11-9-21)28-13-15-29(16-14-28)23(20-7-4-12-26-17-20)18-27-24(30)19-5-2-1-3-6-19/h4,7-12,17,19,23H,1-3,5-6,13-16,18H2,(H,27,30)	XTFONEFLPIUPRW-UHFFFAOYSA-N	Fc1ccc(cc1)N2CCN(CC2)C(CNC(=O)C3CCCCC3)c4cccnc4	BroadT	BRD-A60150264	BRD-A60150264-001-06-5	ChemDiv Inc.	E155-0289			Fc1ccc(cc1)N1CCN(CC1)C(CNC(=O)C1CCCCC1)c1cccnc1	InChI=1S/C24H31FN4O/c25-21-8-10-22(11-9-21)28-13-15-29(16-14-28)23(20-7-4-12-26-17-20)18-27-24(30)19-5-2-1-3-6-19/h4,7-12,17,19,23H,1-3,5-6,13-16,18H2,(H,27,30)	XTFONEFLPIUPRW-UHFFFAOYSA-N	410.248189852							116764
SMR000006653	LSM-28217	BRD-A43273686	647492	InChI=1S/C18H17ClN2O5S/c1-11-2-3-12(6-14(11)19)20-17(22)8-27(24)9-18(23)21-13-4-5-15-16(7-13)26-10-25-15/h2-7H,8-10H2,1H3,(H,20,22)(H,21,23)	ONWGECLABFTDEZ-UHFFFAOYSA-N	Cc1ccc(NC(=O)CS(=O)CC(=O)Nc2ccc3OCOc3c2)cc1Cl	BroadT	BRD-A43273686	BRD-A43273686-001-05-9	Asinex Ltd.	ASN 06408785			Cc1ccc(NC(=O)CS(=O)CC(=O)Nc2ccc3OCOc3c2)cc1Cl	InChI=1S/C18H17ClN2O5S/c1-11-2-3-12(6-14(11)19)20-17(22)8-27(24)9-18(23)21-13-4-5-15-16(7-13)26-10-25-15/h2-7H,8-10H2,1H3,(H,20,22)(H,21,23)	ONWGECLABFTDEZ-UHFFFAOYSA-N	408.054670064							116765
CHEMDIV2_006826	LSM-28218	SID22411791, BRD-K22167068	6619696	InChI=1S/C24H22N2O3S/c1-15-6-7-20-18(12-15)22-19(24(28)29-20)13-21(30-22)23(27)25-9-11-26-10-8-16-4-2-3-5-17(16)14-26/h2-7,12-13H,8-11,14H2,1H3,(H,25,27)	PWEOZCBEVAXSOH-UHFFFAOYSA-N	Cc1ccc2OC(=O)c3cc(sc3c2c1)C(=O)NCCN4CCc5ccccc5C4	BroadT	BRD-K22167068	BRD-K22167068-001-04-7	ChemDiv Inc.	C593-1258			Cc1ccc2oc(=O)c3cc(sc3c2c1)C(=O)NCCN1CCc2ccccc2C1	InChI=1S/C24H22N2O3S/c1-15-6-7-20-18(12-15)22-19(24(28)29-20)13-21(30-22)23(27)25-9-11-26-10-8-16-4-2-3-5-17(16)14-26/h2-7,12-13H,8-11,14H2,1H3,(H,25,27)	PWEOZCBEVAXSOH-UHFFFAOYSA-N	418.135113274							116766
MLS000586404	LSM-44259	SID17510019, BRD-K05789599	5714141	InChI=1S/C23H24O5/c1-25-19-9-5-15(13-21(19)27-3)11-17-7-8-18(23(17)24)12-16-6-10-20(26-2)22(14-16)28-4/h5-6,9-14H,7-8H2,1-4H3/b17-11+,18-12+	NADUQCROZYTGPH-JYFOCSDGSA-N	COc1ccc(\C=C\2/CC\C(=C/c3ccc(OC)c(OC)c3)\C2=O)cc1OC	BroadT	BRD-K05789599	BRD-K05789599-001-11-2	ChemDiv Inc.	C151-0172			COc1ccc(cc1OC)\C=C1/CC\C(C1=O)=C/c1ccc(OC)c(OC)c1	InChI=1S/C23H24O5/c1-25-19-9-5-15(13-21(19)27-3)11-17-7-8-18(23(17)24)12-16-6-10-20(26-2)22(14-16)28-4/h5-6,9-14H,7-8H2,1-4H3/b17-11+,18-12+	NADUQCROZYTGPH-JYFOCSDGSA-N	380.162373868							
SMR000124404	LSM-28220	SID14723080, BRD-A73116009	3226283	InChI=1S/C20H24N4O6S2/c1-14-6-11-18(29-14)19-21-20(30-22-19)15-5-4-12-24(13-15)32(27,28)17-9-7-16(8-10-17)31(25,26)23(2)3/h6-11,15H,4-5,12-13H2,1-3H3	ADOYZNXTCFFSDX-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCCC(C2)c3onc(n3)c4oc(C)cc4	BroadT	BRD-A73116009	BRD-A73116009-001-05-3	Asinex Ltd.	ASN 06941488			CN(C)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N1CCCC(C1)c1nc(no1)-c1ccc(C)o1	InChI=1S/C20H24N4O6S2/c1-14-6-11-18(29-14)19-21-20(30-22-19)15-5-4-12-24(13-15)32(27,28)17-9-7-16(8-10-17)31(25,26)23(2)3/h6-11,15H,4-5,12-13H2,1-3H3	ADOYZNXTCFFSDX-UHFFFAOYSA-N	480.113725908							116768
SMR000006569	LSM-28221	SID851764, BRD-A05792319	654357	InChI=1S/C15H17NO3S2/c1-10(2)13(19-15(18)12-6-4-8-21-12)14(17)16-9-11-5-3-7-20-11/h3-8,10,13H,9H2,1-2H3,(H,16,17)	YRMWNJJGZIIGOS-UHFFFAOYSA-N	CC(C)C(OC(=O)c1cccs1)C(=O)NCc2cccs2	BroadT	BRD-A05792319	BRD-A05792319-001-05-9	Asinex Ltd.	ASN 06396492			CC(C)C(OC(=O)c1cccs1)C(=O)NCc1cccs1	InChI=1S/C15H17NO3S2/c1-10(2)13(19-15(18)12-6-4-8-21-12)14(17)16-9-11-5-3-7-20-11/h3-8,10,13H,9H2,1-2H3,(H,16,17)	YRMWNJJGZIIGOS-UHFFFAOYSA-N	323.064984794							116769
MLS000071286	LSM-28222	SID856275, BRD-K54894818	657650	InChI=1S/C24H35N5O/c25-17-21-20-9-12-29(19-7-3-1-4-8-19)18-22(20)24(27-10-5-2-6-11-27)26-23(21)28-13-15-30-16-14-28/h19H,1-16,18H2	LMHRUVOWZDZKLT-UHFFFAOYSA-N	N#Cc1c2CCN(Cc2c(nc1N3CCOCC3)N4CCCCC4)C5CCCCC5	BroadT	BRD-K54894818	BRD-K54894818-001-05-7	InterBioScreen Ltd.	STOCK1S-07736			N#Cc1c(nc(N2CCCCC2)c2CN(CCc12)C1CCCCC1)N1CCOCC1	InChI=1S/C24H35N5O/c25-17-21-20-9-12-29(19-7-3-1-4-8-19)18-22(20)24(27-10-5-2-6-11-27)26-23(21)28-13-15-30-16-14-28/h19H,1-16,18H2	LMHRUVOWZDZKLT-UHFFFAOYSA-N	409.28416079							116770
MLS000573251	LSM-28223	SID17433553, BRD-K56378267	1349192	InChI=1S/C19H15N3O2S2/c23-17(13-6-2-1-3-7-13)20-14-8-4-9-15(12-14)21-19(25)22-18(24)16-10-5-11-26-16/h1-12H,(H,20,23)(H2,21,22,24,25)	FOHIIVAKMDSIAO-UHFFFAOYSA-N	O=C(Nc1cccc(NC(=S)NC(=O)c2cccs2)c1)c3ccccc3	BroadT	BRD-K56378267	BRD-K56378267-001-05-5	ChemBridge Corporation	6359898			O=C(NC(=S)Nc1cccc(NC(=O)c2ccccc2)c1)c1cccs1	InChI=1S/C19H15N3O2S2/c23-17(13-6-2-1-3-7-13)20-14-8-4-9-15(12-14)21-19(25)22-18(24)16-10-5-11-26-16/h1-12H,(H,20,23)(H2,21,22,24,25)	FOHIIVAKMDSIAO-UHFFFAOYSA-N	381.06056813							116771
ZINC00537894	LSM-28224	SID17401510, BRD-K18907742	941420	InChI=1S/C18H20N4O2/c1-12-3-2-4-13-14(12)15-16(21-13)17(20-11-19-15)22-7-5-18(6-8-22)23-9-10-24-18/h2-4,11,21H,5-10H2,1H3	RUZOSZRGIFVEIM-UHFFFAOYSA-N	Cc1cccc2[nH]c3c(ncnc3c12)N4CCC5(CC4)OCCO5	BroadT	BRD-K18907742	BRD-K18907742-001-06-1	InterBioScreen Ltd.	STOCK4S-46869			Cc1cccc2[nH]c3c(ncnc3c12)N1CCC2(CC1)OCCO2	InChI=1S/C18H20N4O2/c1-12-3-2-4-13-14(12)15-16(21-13)17(20-11-19-15)22-7-5-18(6-8-22)23-9-10-24-18/h2-4,11,21H,5-10H2,1H3	RUZOSZRGIFVEIM-UHFFFAOYSA-N	324.15862592							116772
T0509-2103	LSM-28225	SID24825033, BRD-K84062932	4130492	InChI=1S/C16H14N2OS/c1-18-9-8-17-16(18)20-11-15(19)14-7-6-12-4-2-3-5-13(12)10-14/h2-10H,11H2,1H3	YTSHBFIBNUVZDE-UHFFFAOYSA-N	Cn1ccnc1SCC(=O)c2ccc3ccccc3c2	BroadT	BRD-K84062932	BRD-K84062932-001-05-6	Enamine Ltd.	T0509-2103			Cn1ccnc1SCC(=O)c1ccc2ccccc2c1	InChI=1S/C16H14N2OS/c1-18-9-8-17-16(18)20-11-15(19)14-7-6-12-4-2-3-5-13(12)10-14/h2-10H,11H2,1H3	YTSHBFIBNUVZDE-UHFFFAOYSA-N	282.082683778							116773
GNF-PF-1577	LSM-28226	GNF-PF-1577, BRD-K19936344	2764493	InChI=1S/C16H14ClN7/c17-13-2-1-3-14(21-13)23-4-6-24(7-5-23)16-12(10-19)8-11(9-18)15(20)22-16/h1-3,8H,4-7H2,(H2,20,22)	LUXHROLGPZZXIX-UHFFFAOYSA-N	Nc1nc(N2CCN(CC2)c3cccc(Cl)n3)c(cc1C#N)C#N	BroadT	BRD-K19936344	BRD-K19936344-001-07-9	Key Organics Ltd.	9H-921			Nc1nc(N2CCN(CC2)c2cccc(Cl)n2)c(cc1C#N)C#N	InChI=1S/C16H14ClN7/c17-13-2-1-3-14(21-13)23-4-6-24(7-5-23)16-12(10-19)8-11(9-18)15(20)22-16/h1-3,8H,4-7H2,(H2,20,22)	LUXHROLGPZZXIX-UHFFFAOYSA-N	339.099921228							116774
1-(1,3-Benzodioxol-5-yl)-3-[4-(4-hydroxyphenyl)piperazin-1-yl]pyrrolidine-2,5-dione	LSM-28227	SID24795183, BRD-A44866212	2996992	InChI=1S/C21H21N3O5/c25-16-4-1-14(2-5-16)22-7-9-23(10-8-22)17-12-20(26)24(21(17)27)15-3-6-18-19(11-15)29-13-28-18/h1-6,11,17,25H,7-10,12-13H2	HCDXVMSPZKAKIN-UHFFFAOYSA-N	Oc1ccc(cc1)N2CCN(CC2)C3CC(=O)N(C3=O)c4ccc5OCOc5c4	BroadT	BRD-A44866212	BRD-A44866212-001-05-2	ChemBridge Corporation	9018527			Oc1ccc(cc1)N1CCN(CC1)C1CC(=O)N(C1=O)c1ccc2OCOc2c1	InChI=1S/C21H21N3O5/c25-16-4-1-14(2-5-16)22-7-9-23(10-8-22)17-12-20(26)24(21(17)27)15-3-6-18-19(11-15)29-13-28-18/h1-6,11,17,25H,7-10,12-13H2	HCDXVMSPZKAKIN-UHFFFAOYSA-N	395.148120802							116775
MLS000084244	LSM-28228	SID865542, BRD-K87484986	666801	InChI=1S/C19H21FN8/c20-14-4-6-15(7-5-14)23-19-25-16(24-18(21)26-19)13-27-9-11-28(12-10-27)17-3-1-2-8-22-17/h1-8H,9-13H2,(H3,21,23,24,25,26)	YHQWJNLLOVRYIG-UHFFFAOYSA-N	Nc1nc(CN2CCN(CC2)c3ccccn3)nc(Nc4ccc(F)cc4)n1	BroadT	BRD-K87484986	BRD-K87484986-001-06-2	InterBioScreen Ltd.	STOCK5S-48154			Nc1nc(CN2CCN(CC2)c2ccccn2)nc(Nc2ccc(F)cc2)n1	InChI=1S/C19H21FN8/c20-14-4-6-15(7-5-14)23-19-25-16(24-18(21)26-19)13-27-9-11-28(12-10-27)17-3-1-2-8-22-17/h1-8H,9-13H2,(H3,21,23,24,25,26)	YHQWJNLLOVRYIG-UHFFFAOYSA-N	380.187320952							116776
AC1LDJGI	LSM-28229	SID846662, BRD-K77981296	649057	InChI=1S/C19H21N3O5S2/c1-14-11-18-19(12-15(14)2)22(13-20-18)29(25,26)17-5-3-16(4-6-17)28(23,24)21-7-9-27-10-8-21/h3-6,11-13H,7-10H2,1-2H3	XCJFOMBEECLTFB-UHFFFAOYSA-N	Cc1cc2ncn(c2cc1C)S(=O)(=O)c3ccc(cc3)S(=O)(=O)N4CCOCC4	BroadT	BRD-K77981296	BRD-K77981296-001-05-6	Asinex Ltd.	ASN 06482807			Cc1cc2ncn(c2cc1C)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N1CCOCC1	InChI=1S/C19H21N3O5S2/c1-14-11-18-19(12-15(14)2)22(13-20-18)29(25,26)17-5-3-16(4-6-17)28(23,24)21-7-9-27-10-8-21/h3-6,11-13H,7-10H2,1-2H3	XCJFOMBEECLTFB-UHFFFAOYSA-N	435.092262182							116777
MLS001008024	LSM-28230	SID47201887, BRD-K47802438	2675737	InChI=1S/C17H12BrNO3/c1-10-7-16(20)22-15-9-13(5-6-14(10)15)19-17(21)11-3-2-4-12(18)8-11/h2-9H,1H3,(H,19,21)	DKXLQYVXEXBDNJ-UHFFFAOYSA-N	CC1=CC(=O)Oc2cc(NC(=O)c3cccc(Br)c3)ccc12	BroadT	BRD-K47802438	BRD-K47802438-001-05-0	ChemBridge Corporation	7946657			Cc1cc(=O)oc2cc(NC(=O)c3cccc(Br)c3)ccc12	InChI=1S/C17H12BrNO3/c1-10-7-16(20)22-15-9-13(5-6-14(10)15)19-17(21)11-3-2-4-12(18)8-11/h2-9H,1H3,(H,19,21)	DKXLQYVXEXBDNJ-UHFFFAOYSA-N	357.000055854							116778
SMR000045856	LSM-28231	SID863553, BRD-K73443093	664804	InChI=1S/C15H13ClN6/c1-3-13-19-15-11-7-18-22(14(11)17-8-21(15)20-13)12-6-10(16)5-4-9(12)2/h4-8H,3H2,1-2H3	WOSJPJAVCIJXAY-UHFFFAOYSA-N	CCc1nc2c3cnn(c4cc(Cl)ccc4C)c3ncn2n1	BroadT	BRD-K73443093	BRD-K73443093-001-06-4	InterBioScreen Ltd.	STOCK4S-80830			CCc1nc2c3cnn(-c4cc(Cl)ccc4C)c3ncn2n1	InChI=1S/C15H13ClN6/c1-3-13-19-15-11-7-18-22(14(11)17-8-21(15)20-13)12-6-10(16)5-4-9(12)2/h4-8H,3H2,1-2H3	WOSJPJAVCIJXAY-UHFFFAOYSA-N	312.089022186							116779
SMR000080988	LSM-28232	SID4263169, BRD-K16361400	2227136	InChI=1S/C22H19N3O4/c1-14-9-15(2)11-18(10-14)28-13-20(26)23-17-6-3-5-16(12-17)21-24-25-22(29-21)19-7-4-8-27-19/h3-12H,13H2,1-2H3,(H,23,26)	BMUWSFTUTHJQBY-UHFFFAOYSA-N	Cc1cc(C)cc(OCC(=O)Nc2cccc(c2)c3oc(nn3)c4occc4)c1	BroadT	BRD-K16361400	BRD-K16361400-001-06-6	ChemBridge Corporation	7952226			Cc1cc(C)cc(OCC(=O)Nc2cccc(c2)-c2nnc(o2)-c2ccco2)c1	InChI=1S/C22H19N3O4/c1-14-9-15(2)11-18(10-14)28-13-20(26)23-17-6-3-5-16(12-17)21-24-25-22(29-21)19-7-4-8-27-19/h3-12H,13H2,1-2H3,(H,23,26)	BMUWSFTUTHJQBY-UHFFFAOYSA-N	389.137556118							116780
T0512-1021	LSM-44260	SID24828637, BRD-K66317793	2406836	InChI=1S/C22H25NO6/c1-26-18-13-17(14-19(27-2)22(18)28-3)9-10-21(25)29-15-20(24)23-12-11-16-7-5-4-6-8-16/h4-10,13-14H,11-12,15H2,1-3H3,(H,23,24)/b10-9+	MWDAWGRNAJTQCS-MDZDMXLPSA-N	COc1cc(\C=C\C(=O)OCC(=O)NCCc2ccccc2)cc(OC)c1OC	BroadT	BRD-K66317793	BRD-K66317793-001-05-4	Enamine Ltd.	T0512-1021			COc1cc(\C=C\C(=O)OCC(=O)NCCc2ccccc2)cc(OC)c1OC	InChI=1S/C22H25NO6/c1-26-18-13-17(14-19(27-2)22(18)28-3)9-10-21(25)29-15-20(24)23-12-11-16-7-5-4-6-8-16/h4-10,13-14H,11-12,15H2,1-3H3,(H,23,24)/b10-9+	MWDAWGRNAJTQCS-MDZDMXLPSA-N	399.16818753							
MLS000586962	LSM-28234	SID22411959, BRD-A59693942	4085972	InChI=1S/C24H29NO2S/c1-18-9-10-21-20(15-18)22(16-24(27-21)12-5-6-13-24)28-17-23(26)25-14-11-19-7-3-2-4-8-19/h2-4,7-10,15,22H,5-6,11-14,16-17H2,1H3,(H,25,26)	VTXLZSURMFOLII-UHFFFAOYSA-N	Cc1ccc2OC3(CCCC3)CC(SCC(=O)NCCc4ccccc4)c2c1	BroadT	BRD-A59693942	BRD-A59693942-001-04-2	ChemDiv Inc.	K788-8177			Cc1ccc2OC3(CCCC3)CC(SCC(=O)NCCc3ccccc3)c2c1	InChI=1S/C24H29NO2S/c1-18-9-10-21-20(15-18)22(16-24(27-21)12-5-6-13-24)28-17-23(26)25-14-11-19-7-3-2-4-8-19/h2-4,7-10,15,22H,5-6,11-14,16-17H2,1H3,(H,25,26)	VTXLZSURMFOLII-UHFFFAOYSA-N	395.191899868							116782
SMR000154444	LSM-28235	SID14747164, BRD-K32996612	2085690	InChI=1S/C22H19N3O4/c1-3-13-7-6-10-15-17(11-23-19(13)15)18(26)12-29-22(28)20-14-8-4-5-9-16(14)21(27)25(2)24-20/h4-11,23H,3,12H2,1-2H3	CXSORLPSCHPMMN-UHFFFAOYSA-N	CCc1cccc2c(c[nH]c12)C(=O)COC(=O)C3=NN(C)C(=O)c4ccccc34	BroadT	BRD-K32996612	BRD-K32996612-001-05-5	Enamine Ltd.	T5263217			CCc1cccc2c(c[nH]c12)C(=O)COC(=O)c1nn(C)c(=O)c2ccccc12	InChI=1S/C22H19N3O4/c1-3-13-7-6-10-15-17(11-23-19(13)15)18(26)12-29-22(28)20-14-8-4-5-9-16(14)21(27)25(2)24-20/h4-11,23H,3,12H2,1-2H3	CXSORLPSCHPMMN-UHFFFAOYSA-N	389.137556118							116783
AC1LCUIC	LSM-28236	SID853581, BRD-A60864273	656240	InChI=1S/C23H27N7O2S2/c1-3-20(22-25-26-27-30(22)16-34(31,32)18-10-8-17(2)9-11-18)28-12-14-29(15-13-28)23-24-19-6-4-5-7-21(19)33-23/h4-11,20H,3,12-16H2,1-2H3	GYKMEFCRUFUXED-UHFFFAOYSA-N	CCC(N1CCN(CC1)c2nc3ccccc3s2)c4nnnn4CS(=O)(=O)c5ccc(C)cc5	BroadT	BRD-A60864273	BRD-A60864273-001-06-0	Asinex Ltd.	ASN 04936416			CCC(N1CCN(CC1)c1nc2ccccc2s1)c1nnnn1CS(=O)(=O)c1ccc(C)cc1	InChI=1S/C23H27N7O2S2/c1-3-20(22-25-26-27-30(22)16-34(31,32)18-10-8-17(2)9-11-18)28-12-14-29(15-13-28)23-24-19-6-4-5-7-21(19)33-23/h4-11,20H,3,12-16H2,1-2H3	GYKMEFCRUFUXED-UHFFFAOYSA-N	497.166764554							116784
MLS000575049	LSM-42983	BRD-K02715134, SID17433538, SID87544500	2286888	InChI=1S/C24H22N2O4S2/c1-16(14-17-6-3-2-4-7-17)15-20-22(28)26(24(31)32-20)13-5-8-21(27)25-19-11-9-18(10-12-19)23(29)30/h2-4,6-7,9-12,14-15H,5,8,13H2,1H3,(H,25,27)(H,29,30)/b16-14+,20-15-	MZEGQCZARRMPMR-GEZYKDBCSA-N	C\C(=C/c1ccccc1)\C=C\2/SC(=S)N(CCCC(=O)Nc3ccc(cc3)C(=O)O)C2=O	BroadT	BRD-K02715134	BRD-K02715134-001-07-0	ChemBridge Corporation	6792999			CC(=C/c1ccccc1)\C=C1/SC(=S)N(CCCC(=O)Nc2ccc(cc2)C(O)=O)C1=O	InChI=1S/C24H22N2O4S2/c1-16(14-17-6-3-2-4-7-17)15-20-22(28)26(24(31)32-20)13-5-8-21(27)25-19-11-9-18(10-12-19)23(29)30/h2-4,6-7,9-12,14-15H,5,8,13H2,1H3,(H,25,27)(H,29,30)/b16-14+,20-15-	MZEGQCZARRMPMR-GEZYKDBCSA-N	466.102098584							
SMR000141258	LSM-28237	SID14746312, BRD-A61936006	2888779	InChI=1S/C21H16Cl2N2O/c22-15-10-11-16(18(23)12-15)20-24-19-9-5-4-8-17(19)21(26)25(20)13-14-6-2-1-3-7-14/h1-12,20,24H,13H2	JXYJXIFBZNKALM-UHFFFAOYSA-N	Clc1ccc(C2Nc3ccccc3C(=O)N2Cc4ccccc4)c(Cl)c1	BroadT	BRD-A61936006	BRD-A61936006-001-05-1	ChemBridge Corporation	6164181			Clc1ccc(C2Nc3ccccc3C(=O)N2Cc2ccccc2)c(Cl)c1	InChI=1S/C21H16Cl2N2O/c22-15-10-11-16(18(23)12-15)20-24-19-9-5-4-8-17(19)21(26)25(20)13-14-6-2-1-3-7-14/h1-12,20,24H,13H2	JXYJXIFBZNKALM-UHFFFAOYSA-N	382.063968572							116785
SMR000061331	LSM-28238	SID3711225, BRD-K17052560	2353955	InChI=1S/C20H19N3O3/c1-13-11-14(2)23(22-13)17-6-3-15(4-7-17)20(24)21-16-5-8-18-19(12-16)26-10-9-25-18/h3-8,11-12H,9-10H2,1-2H3,(H,21,24)	IGBVPGOCCRFKOF-UHFFFAOYSA-N	Cc1cc(C)n(n1)c2ccc(cc2)C(=O)Nc3ccc4OCCOc4c3	BroadT	BRD-K17052560	BRD-K17052560-001-05-8	Enamine Ltd.	T0508-7410			Cc1cc(C)n(n1)-c1ccc(cc1)C(=O)Nc1ccc2OCCOc2c1	InChI=1S/C20H19N3O3/c1-13-11-14(2)23(22-13)17-6-3-15(4-7-17)20(24)21-16-5-8-18-19(12-16)26-10-9-25-18/h3-8,11-12H,9-10H2,1-2H3,(H,21,24)	IGBVPGOCCRFKOF-UHFFFAOYSA-N	349.142641498							116786
MLS000689999	LSM-44261	SID24787086, BRD-K63363121	2277079	InChI=1S/C19H15N3O6S/c1-11-3-2-4-13(7-11)20-17(24)10-21-18(25)16(29-19(21)26)9-12-5-6-15(23)14(8-12)22(27)28/h2-9,23H,10H2,1H3,(H,20,24)/b16-9-	MNJOBZVDZSUCLN-SXGWCWSVSA-N	Cc1cccc(NC(=O)CN2C(=O)S\C(=C/c3ccc(O)c(c3)[N+](=O)[O-])\C2=O)c1	BroadT	BRD-K63363121	BRD-K63363121-001-05-4	ChemBridge Corporation	6736013			Cc1cccc(NC(=O)CN2C(=O)S\C(=C/c3ccc(O)c(c3)[N+]([O-])=O)C2=O)c1	InChI=1S/C19H15N3O6S/c1-11-3-2-4-13(7-11)20-17(24)10-21-18(25)16(29-19(21)26)9-12-5-6-15(23)14(8-12)22(27)28/h2-9,23H,10H2,1H3,(H,20,24)/b16-9-	MNJOBZVDZSUCLN-SXGWCWSVSA-N	413.06815592							
SMR000067909	LSM-28240	SID3711807, BRD-K86696905	2997779	InChI=1S/C22H20F2N4O5/c23-22(24)32-17-6-5-14(11-18(17)33-22)25-20(29)13-28-16-4-2-1-3-15(16)26-19(28)12-21(30)27-7-9-31-10-8-27/h1-6,11H,7-10,12-13H2,(H,25,29)	AKABMFCZDGAJDL-UHFFFAOYSA-N	FC1(F)Oc2ccc(NC(=O)Cn3c(CC(=O)N4CCOCC4)nc5ccccc35)cc2O1	BroadT	BRD-K86696905	BRD-K86696905-001-05-2	Enamine Ltd.	T5331479			FC1(F)Oc2ccc(NC(=O)Cn3c(CC(=O)N4CCOCC4)nc4ccccc34)cc2O1	InChI=1S/C22H20F2N4O5/c23-22(24)32-17-6-5-14(11-18(17)33-22)25-20(29)13-28-16-4-2-1-3-15(16)26-19(28)12-21(30)27-7-9-31-10-8-27/h1-6,11H,7-10,12-13H2,(H,25,29)	AKABMFCZDGAJDL-UHFFFAOYSA-N	458.14017618							116788
AC1MSS0L	LSM-28241	BRD-K83724719	3539184	InChI=1S/C17H12ClN3O2/c18-16-13(9-12-3-1-2-4-15(12)20-16)10-19-21-14-7-5-11(6-8-14)17(22)23/h1-10,21H,(H,22,23)	IEFQXBVSDWMOGI-UHFFFAOYSA-N	OC(=O)c1ccc(NN=Cc2cc3ccccc3nc2Cl)cc1	BroadT	BRD-K83724719	BRD-K83724719-001-05-1	InterBioScreen Ltd.	STOCK5S-21142			OC(=O)c1ccc(NN=Cc2cc3ccccc3nc2Cl)cc1	InChI=1S/C17H12ClN3O2/c18-16-13(9-12-3-1-2-4-15(12)20-16)10-19-21-14-7-5-11(6-8-14)17(22)23/h1-10,21H,(H,22,23)	IEFQXBVSDWMOGI-UHFFFAOYSA-N	325.061804364							116789
MLS000077219	LSM-28242	SID850319, BRD-A39803589	652834	InChI=1S/C26H29FN6O3/c1-35-22-14-18-13-20(26(34)28-21(18)15-23(22)36-2)24(32-11-5-3-4-6-12-32)25-29-30-31-33(25)16-17-7-9-19(27)10-8-17/h7-10,13-15,24H,3-6,11-12,16H2,1-2H3,(H,28,34)	CLUIEZZJGGDIBJ-UHFFFAOYSA-N	COc1cc2cc(C(N3CCCCCC3)c4nnnn4Cc5ccc(F)cc5)c(O)nc2cc1OC	BroadT	BRD-A39803589	BRD-A39803589-001-07-3	Asinex Ltd.	ASN 04190133			COc1cc2cc(C(N3CCCCCC3)c3nnnn3Cc3ccc(F)cc3)c(O)nc2cc1OC	InChI=1S/C26H29FN6O3/c1-35-22-14-18-13-20(26(34)28-21(18)15-23(22)36-2)24(32-11-5-3-4-6-12-32)25-29-30-31-33(25)16-17-7-9-19(27)10-8-17/h7-10,13-15,24H,3-6,11-12,16H2,1-2H3,(H,28,34)	CLUIEZZJGGDIBJ-UHFFFAOYSA-N	492.228517048							116790
BAS 06900202	LSM-28243	SID14721922, BRD-K10047494	1086325	InChI=1S/C16H22N4OS/c1-16(2,3)19-14(21)13-12(17)10-7-9-8-20(4)6-5-11(9)18-15(10)22-13/h7H,5-6,8,17H2,1-4H3,(H,19,21)	MXAWWWLKTMPTOC-UHFFFAOYSA-N	CN1CCc2nc3sc(C(=O)NC(C)(C)C)c(N)c3cc2C1	BroadT	BRD-K10047494	BRD-K10047494-001-07-2	Asinex Ltd.	BAS 06900202			CN1CCc2nc3sc(C(=O)NC(C)(C)C)c(N)c3cc2C1	InChI=1S/C16H22N4OS/c1-16(2,3)19-14(21)13-12(17)10-7-9-8-20(4)6-5-11(9)18-15(10)22-13/h7H,5-6,8,17H2,1-4H3,(H,19,21)	MXAWWWLKTMPTOC-UHFFFAOYSA-N	318.151432054							116791
MLS000086333	LSM-28244	SID4243157, BRD-K80536391	2158923	InChI=1S/C25H24N4O5S/c1-3-29(17-18-9-5-4-6-10-18)35(31,32)20-15-13-19(14-16-20)23(30)26-25-28-27-24(34-25)21-11-7-8-12-22(21)33-2/h4-16H,3,17H2,1-2H3,(H,26,28,30)	BKZDAHHUBCFASF-UHFFFAOYSA-N	CCN(Cc1ccccc1)S(=O)(=O)c2ccc(cc2)C(=O)Nc3oc(nn3)c4ccccc4OC	BroadT	BRD-K80536391	BRD-K80536391-001-07-3	ChemDiv Inc.	C079-0086			CCN(Cc1ccccc1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(o1)-c1ccccc1OC	InChI=1S/C25H24N4O5S/c1-3-29(17-18-9-5-4-6-10-18)35(31,32)20-15-13-19(14-16-20)23(30)26-25-28-27-24(34-25)21-11-7-8-12-22(21)33-2/h4-16H,3,17H2,1-2H3,(H,26,28,30)	BKZDAHHUBCFASF-UHFFFAOYSA-N	492.146740598							116792
SMR000034172	LSM-28245	SID859237, BRD-K68835408	660540	InChI=1S/C18H23N3O4/c1-3-24-18(23)17-16(13-6-4-5-7-14(13)25-17)19-15(22)12-21-10-8-20(2)9-11-21/h4-7H,3,8-12H2,1-2H3,(H,19,22)	SIOZQNMWDFVKAB-UHFFFAOYSA-N	CCOC(=O)c1oc2ccccc2c1NC(=O)CN3CCN(C)CC3	BroadT	BRD-K68835408	BRD-K68835408-001-07-6	InterBioScreen Ltd.	STOCK2S-98890			CCOC(=O)c1oc2ccccc2c1NC(=O)CN1CCN(C)CC1	InChI=1S/C18H23N3O4/c1-3-24-18(23)17-16(13-6-4-5-7-14(13)25-17)19-15(22)12-21-10-8-20(2)9-11-21/h4-7H,3,8-12H2,1-2H3,(H,19,22)	SIOZQNMWDFVKAB-UHFFFAOYSA-N	345.168856246							116793
1-(3,5-Dichlorophenyl)-3-morpholinodihydro-1H-pyrrole-2,5-dione	LSM-28246	SID7977235, BRD-A99133670	2853236	InChI=1S/C14H14Cl2N2O3/c15-9-5-10(16)7-11(6-9)18-13(19)8-12(14(18)20)17-1-3-21-4-2-17/h5-7,12H,1-4,8H2	RGIPJBFUQNKTGH-UHFFFAOYSA-N	Clc1cc(Cl)cc(c1)N2C(=O)CC(N3CCOCC3)C2=O	BroadT	BRD-A99133670	BRD-A99133670-001-05-6	ChemBridge Corporation	5566704			Clc1cc(Cl)cc(c1)N1C(=O)CC(N2CCOCC2)C1=O	InChI=1S/C14H14Cl2N2O3/c15-9-5-10(16)7-11(6-9)18-13(19)8-12(14(18)20)17-1-3-21-4-2-17/h5-7,12H,1-4,8H2	RGIPJBFUQNKTGH-UHFFFAOYSA-N	328.038147748							116794
34800-26-5	LSM-28247	SID3714213, BRD-K79145400	854410	InChI=1S/C9H7BrN2OS2/c1-5(13)11-9-12-6(4-14-9)7-2-3-8(10)15-7/h2-4H,1H3,(H,11,12,13)	PRHFTISODISOTF-UHFFFAOYSA-N	CC(=O)Nc1nc(cs1)c2ccc(Br)s2	BroadT	BRD-K79145400	BRD-K79145400-001-05-9	Enamine Ltd.	T0513-3054			CC(=O)Nc1nc(cs1)-c1ccc(Br)s1	InChI=1S/C9H7BrN2OS2/c1-5(13)11-9-12-6(4-14-9)7-2-3-8(10)15-7/h2-4H,1H3,(H,11,12,13)	PRHFTISODISOTF-UHFFFAOYSA-N	301.918316844							116795
SMR000095082	LSM-28248	SID7967740, BRD-K55920831	5309006	InChI=1S/C24H33N5O2/c1-4-11-28-13-15-29(16-14-28)12-7-10-25-23(30)21-17-19-22(26(21)2)18-8-5-6-9-20(18)27(3)24(19)31/h5-6,8-9,17H,4,7,10-16H2,1-3H3,(H,25,30)	CJHAIGOYALWBAG-UHFFFAOYSA-N	CCCN1CCN(CCCNC(=O)c2cc3C(=O)N(C)c4ccccc4c3n2C)CC1	BroadT	BRD-K55920831	BRD-K55920831-001-04-5	ChemDiv Inc.	C593-0574			CCCN1CCN(CCCNC(=O)c2cc3c(n2C)c2ccccc2n(C)c3=O)CC1	InChI=1S/C24H33N5O2/c1-4-11-28-13-15-29(16-14-28)12-7-10-25-23(30)21-17-19-22(26(21)2)18-8-5-6-9-20(18)27(3)24(19)31/h5-6,8-9,17H,4,7,10-16H2,1-3H3,(H,25,30)	CJHAIGOYALWBAG-UHFFFAOYSA-N	423.263425346							116796
MLS000119701	LSM-28249	SID24838895, SID26514113, SID7968041, BRD-K03983258	5309189	InChI=1S/C25H32N6OS/c1-19-8-14-29(15-9-19)18-20-4-6-22(7-5-20)26-23(32)21-10-16-31(17-11-21)25-28-27-24(33-25)30-12-2-3-13-30/h2-7,12-13,19,21H,8-11,14-18H2,1H3,(H,26,32)	GJJFKEYOWCANIT-UHFFFAOYSA-N	CC1CCN(Cc2ccc(NC(=O)C3CCN(CC3)c4nnc(s4)n5cccc5)cc2)CC1	BroadT	BRD-K03983258	BRD-K03983258-001-04-0	ChemDiv Inc.	C857-0221			CC1CCN(Cc2ccc(NC(=O)C3CCN(CC3)c3nnc(s3)-n3cccc3)cc2)CC1	InChI=1S/C25H32N6OS/c1-19-8-14-29(15-9-19)18-20-4-6-22(7-5-20)26-23(32)21-10-16-31(17-11-21)25-28-27-24(33-25)30-12-2-3-13-30/h2-7,12-13,19,21H,8-11,14-18H2,1H3,(H,26,32)	GJJFKEYOWCANIT-UHFFFAOYSA-N	464.235830394							116797
AC1OB3XG	LSM-28250	SID865468, BRD-A90048458	6839707	InChI=1S/C22H16FN3O3/c23-16-9-3-1-7-14(16)21-18-19(15-8-2-4-10-17(15)27)24-25-20(18)22(28)26(21)12-13-6-5-11-29-13/h1-11,21,27H,12H2,(H,24,25)	DMWKCTYPPKGTNM-UHFFFAOYSA-N	Oc1ccccc1c2[nH]nc3C(=O)N(Cc4occc4)C(c5ccccc5F)c23	BroadT	BRD-A90048458	BRD-A90048458-001-05-3	InterBioScreen Ltd.	STOCK5S-42590			Oc1ccccc1-c1[nH]nc2C(=O)N(Cc3ccco3)C(c12)c1ccccc1F	InChI=1S/C22H16FN3O3/c23-16-9-3-1-7-14(16)21-18-19(15-8-2-4-10-17(15)27)24-25-20(18)22(28)26(21)12-13-6-5-11-29-13/h1-11,21,27H,12H2,(H,24,25)	DMWKCTYPPKGTNM-UHFFFAOYSA-N	389.117569602							
N-(4-Methoxyphenyl)-2-(2-methylpropyl)quinoline-4-carboxamide	LSM-28251	SID49644697, BRD-K40504896	856140	InChI=1S/C21H22N2O2/c1-14(2)12-16-13-19(18-6-4-5-7-20(18)22-16)21(24)23-15-8-10-17(25-3)11-9-15/h4-11,13-14H,12H2,1-3H3,(H,23,24)	YYPIRLSZECYZHW-UHFFFAOYSA-N	COc1ccc(NC(=O)c2cc(CC(C)C)nc3ccccc23)cc1	BroadT	BRD-K40504896	BRD-K40504896-001-06-2	Asinex Ltd.	ASN 01365685			COc1ccc(NC(=O)c2cc(CC(C)C)nc3ccccc23)cc1	InChI=1S/C21H22N2O2/c1-14(2)12-16-13-19(18-6-4-5-7-20(18)22-16)21(24)23-15-8-10-17(25-3)11-9-15/h4-11,13-14H,12H2,1-3H3,(H,23,24)	YYPIRLSZECYZHW-UHFFFAOYSA-N	334.168127964							116799
EN300-03292	LSM-28252	SID14744198, BRD-K20573972	2454972	InChI=1S/C16H16N4OS/c21-15-13-12-9-5-2-6-10-19(12)16(22)17-14(13)18-20(15)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,17,18,22)	QUUZUIMRZFXPLL-UHFFFAOYSA-N	SC1=NC2=NN(C(=O)C2=C3CCCCCN13)c4ccccc4	BroadT	BRD-K20573972	BRD-K20573972-001-05-0	Enamine Ltd.	T0512-2399			Sc1nc2nn(-c3ccccc3)c(=O)c2c2CCCCCn12	InChI=1S/C16H16N4OS/c21-15-13-12-9-5-2-6-10-19(12)16(22)17-14(13)18-20(15)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,17,18,22)	QUUZUIMRZFXPLL-UHFFFAOYSA-N	312.104481862							116800
SMR000064088	LSM-28253	SID3712905, BRD-K48187965	2085246	InChI=1S/C21H23N3O3/c1-15-9-7-8-12-18(15)27-14-13-19(25)22-20-16(2)23(3)24(21(20)26)17-10-5-4-6-11-17/h4-12H,13-14H2,1-3H3,(H,22,25)	HUXLEDBLUZPPEI-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)NC(=O)CCOc2ccccc2C)c3ccccc3	BroadT	BRD-K48187965	BRD-K48187965-001-05-6	Enamine Ltd.	T5262827			Cc1c(NC(=O)CCOc2ccccc2C)c(=O)n(-c2ccccc2)n1C	InChI=1S/C21H23N3O3/c1-15-9-7-8-12-18(15)27-14-13-19(25)22-20-16(2)23(3)24(21(20)26)17-10-5-4-6-11-17/h4-12H,13-14H2,1-3H3,(H,22,25)	HUXLEDBLUZPPEI-UHFFFAOYSA-N	365.173941626							116801
SMR000004701	LSM-28254	SID850447, BRD-K52543745	652968	InChI=1S/C22H21N5O2S2/c1-27-20(12-23-21-24-18(13-30-21)15-7-4-3-5-8-15)25-26-22(27)31-14-19(28)16-9-6-10-17(11-16)29-2/h3-11,13H,12,14H2,1-2H3,(H,23,24)	CLJCLMSXOJHAFL-UHFFFAOYSA-N	COc1cccc(c1)C(=O)CSc2nnc(CNc3nc(cs3)c4ccccc4)n2C	BroadT	BRD-K52543745	BRD-K52543745-001-05-0	Asinex Ltd.	ASN 05446787			COc1cccc(c1)C(=O)CSc1nnc(CNc2nc(cs2)-c2ccccc2)n1C	InChI=1S/C22H21N5O2S2/c1-27-20(12-23-21-24-18(13-30-21)15-7-4-3-5-8-15)25-26-22(27)31-14-19(28)16-9-6-10-17(11-16)29-2/h3-11,13H,12,14H2,1-2H3,(H,23,24)	CLJCLMSXOJHAFL-UHFFFAOYSA-N	451.113666342							116802
F0451-4609	LSM-28255	SID49642990, BRD-K13233317	682562	InChI=1S/C18H15NO4/c1-2-22-18(21)13-7-5-8-14(10-13)19-17(20)16-11-12-6-3-4-9-15(12)23-16/h3-11H,2H2,1H3,(H,19,20)	IANBWWKJDIHYFC-UHFFFAOYSA-N	CCOC(=O)c1cccc(NC(=O)c2oc3ccccc3c2)c1	BroadT	BRD-K13233317	BRD-K13233317-001-05-4	Asinex Ltd.	BAS 00838391			CCOC(=O)c1cccc(NC(=O)c2cc3ccccc3o2)c1	InChI=1S/C18H15NO4/c1-2-22-18(21)13-7-5-8-14(10-13)19-17(20)16-11-12-6-3-4-9-15(12)23-16/h3-11H,2H2,1H3,(H,19,20)	IANBWWKJDIHYFC-UHFFFAOYSA-N	309.10010797							116803
1,3,4-Thiadiazole-2(3H)-thione, 5-(naphthalenylamino)-	LSM-28256	SID26727430, BRD-K49681141	2730997	InChI=1S/C12H9N3S2/c16-12-15-14-11(17-12)13-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H,13,14)(H,15,16)	KVUKMOJONYGVNE-UHFFFAOYSA-N	Sc1nnc(Nc2cccc3ccccc23)s1	BroadT	BRD-K49681141	BRD-K49681141-001-05-4	Maybridge	S 00985			Sc1nnc(Nc2cccc3ccccc23)s1	InChI=1S/C12H9N3S2/c16-12-15-14-11(17-12)13-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H,13,14)(H,15,16)	KVUKMOJONYGVNE-UHFFFAOYSA-N	259.023788698							116804
MLS000029264	LSM-28257	SID848738, BRD-K38805192	325656	InChI=1S/C12H13N3O2S2/c1-17-8-5-3-7(4-6-8)14-11(16)9-10(13)15-12(18-2)19-9/h3-6H,13H2,1-2H3,(H,14,16)	JLAJOZJWUBPJDB-UHFFFAOYSA-N	COc1ccc(NC(=O)c2sc(SC)nc2N)cc1	BroadT	BRD-K38805192	BRD-K38805192-001-07-6	Asinex Ltd.	BAS 02225821			COc1ccc(NC(=O)c2sc(SC)nc2N)cc1	InChI=1S/C12H13N3O2S2/c1-17-8-5-3-7(4-6-8)14-11(16)9-10(13)15-12(18-2)19-9/h3-6H,13H2,1-2H3,(H,14,16)	JLAJOZJWUBPJDB-UHFFFAOYSA-N	295.044918066							116805
AC1MHBKP	LSM-28258	SID3715773, BRD-A80267939	2999347	InChI=1S/C16H14N4O3S/c1-10(18-15(22)13-6-4-8-23-13)14(21)20-16-19-12(9-24-16)11-5-2-3-7-17-11/h2-10H,1H3,(H,18,22)(H,19,20,21)	WCQJJOIGIVFMKQ-UHFFFAOYSA-N	CC(NC(=O)c1occc1)C(=O)Nc2nc(cs2)c3ccccn3	BroadT	BRD-A80267939	BRD-A80267939-001-05-0	Enamine Ltd.	T5329596			CC(NC(=O)c1ccco1)C(=O)Nc1nc(cs1)-c1ccccn1	InChI=1S/C16H14N4O3S/c1-10(18-15(22)13-6-4-8-23-13)14(21)20-16-19-12(9-24-16)11-5-2-3-7-17-11/h2-10H,1H3,(H,18,22)(H,19,20,21)	WCQJJOIGIVFMKQ-UHFFFAOYSA-N	342.078661038							116806
MLS000703367	LSM-28259	SID24801051, BRD-A08024323	3120415	InChI=1S/C23H20N2O2S/c1-15(2)21(23(26)27)28-22-19(14-24)18(16-9-5-3-6-10-16)13-20(25-22)17-11-7-4-8-12-17/h3-13,15,21H,1-2H3,(H,26,27)	SFXNLOPHCQYBNS-UHFFFAOYSA-N	CC(C)C(Sc1nc(cc(c2ccccc2)c1C#N)c3ccccc3)C(=O)O	BroadT	BRD-A08024323	BRD-A08024323-001-07-4	Asinex Ltd.	BAS 00851099			CC(C)C(Sc1nc(cc(-c2ccccc2)c1C#N)-c1ccccc1)C(O)=O	InChI=1S/C23H20N2O2S/c1-15(2)21(23(26)27)28-22-19(14-24)18(16-9-5-3-6-10-16)13-20(25-22)17-11-7-4-8-12-17/h3-13,15,21H,1-2H3,(H,26,27)	SFXNLOPHCQYBNS-UHFFFAOYSA-N	388.12454859							116807
STK260046	LSM-28260	SID842971, BRD-K75742859	645249	InChI=1S/C16H14N4O3/c1-23-16(22)11-6-8-12(9-7-11)17-15(21)10-20-14-5-3-2-4-13(14)18-19-20/h2-9H,10H2,1H3,(H,17,21)	VVVHNZQEZTWYFA-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=O)Cn2nnc3ccccc23)cc1	BroadT	BRD-K75742859	BRD-K75742859-001-05-3	Asinex Ltd.	BAS 00867729			COC(=O)c1ccc(NC(=O)Cn2nnc3ccccc23)cc1	InChI=1S/C16H14N4O3/c1-23-16(22)11-6-8-12(9-7-11)17-15(21)10-20-14-5-3-2-4-13(14)18-19-20/h2-9H,10H2,1H3,(H,17,21)	VVVHNZQEZTWYFA-UHFFFAOYSA-N	310.106590348							116808
N-{[5-(1H-Benzimidazol-2-yl)-2-chlorophenyl]carbamothioyl}-2,6-dimethoxybenzamide	LSM-28261	SID22403079, BRD-K65956118	1842115	InChI=1S/C23H19ClN4O3S/c1-30-18-8-5-9-19(31-2)20(18)22(29)28-23(32)27-17-12-13(10-11-14(17)24)21-25-15-6-3-4-7-16(15)26-21/h3-12H,1-2H3,(H,25,26)(H2,27,28,29,32)	XEYZCRMGWIHVAN-UHFFFAOYSA-N	COc1cccc(OC)c1C(=O)NC(=S)Nc2cc(ccc2Cl)c3nc4ccccc4[nH]3	BroadT	BRD-K65956118	BRD-K65956118-001-05-8	InterBioScreen Ltd.	STOCK5S-35363			COc1cccc(OC)c1C(=O)NC(=S)Nc1cc(ccc1Cl)-c1nc2ccccc2[nH]1	InChI=1S/C23H19ClN4O3S/c1-30-18-8-5-9-19(31-2)20(18)22(29)28-23(32)27-17-12-13(10-11-14(17)24)21-25-15-6-3-4-7-16(15)26-21/h3-12H,1-2H3,(H,25,26)(H2,27,28,29,32)	XEYZCRMGWIHVAN-UHFFFAOYSA-N	466.086638908							131287
N-(2,4-Dimethylphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine	LSM-28262	SID49641708, BRD-K13990903	223735	InChI=1S/C14H15N5/c1-9-4-5-12(10(2)6-9)18-13-11-7-17-19(3)14(11)16-8-15-13/h4-8H,1-3H3,(H,15,16,18)	MLFYHTPQBJNHKT-UHFFFAOYSA-N	Cc1ccc(Nc2ncnc3c2cnn3C)c(C)c1	BroadT	BRD-K13990903	BRD-K13990903-001-05-9	Asinex Ltd.	BAS 02224783			Cc1ccc(Nc2ncnc3n(C)ncc23)c(C)c1	InChI=1S/C14H15N5/c1-9-4-5-12(10(2)6-9)18-13-11-7-17-19(3)14(11)16-8-15-13/h4-8H,1-3H3,(H,15,16,18)	MLFYHTPQBJNHKT-UHFFFAOYSA-N	253.13274553							116811
SMR000047023	LSM-28263	SID864537, BRD-K11246735	665780	InChI=1S/C13H11N5OS/c14-12-16-13(15-11(19)10-7-4-8-20-10)17-18(12)9-5-2-1-3-6-9/h1-8H,(H3,14,15,16,17,19)	ZMKAVYADZYBOFM-UHFFFAOYSA-N	Nc1nc(NC(=O)c2cccs2)nn1c3ccccc3	BroadT	BRD-K11246735	BRD-K11246735-001-06-0	InterBioScreen Ltd.	STOCK5S-21386			Nc1nc(NC(=O)c2cccs2)nn1-c1ccccc1	InChI=1S/C13H11N5OS/c14-12-16-13(15-11(19)10-7-4-8-20-10)17-18(12)9-5-2-1-3-6-9/h1-8H,(H3,14,15,16,17,19)	ZMKAVYADZYBOFM-UHFFFAOYSA-N	285.068430712							116812
SMR000012530	LSM-28264	SID850269, BRD-A70425433	652786	InChI=1S/C22H22ClN3O3/c23-14-6-7-18-17(13-14)15-3-1-4-16(20(15)24-18)21(27)25-8-10-26(11-9-25)22(28)19-5-2-12-29-19/h2,5-7,12-13,16,24H,1,3-4,8-11H2	FRSZNZNJHSDBGI-UHFFFAOYSA-N	Clc1ccc2[nH]c3C(CCCc3c2c1)C(=O)N4CCN(CC4)C(=O)c5occc5	BroadT	BRD-A70425433	BRD-A70425433-001-06-5	Asinex Ltd.	BAS 03662633			Clc1ccc2[nH]c3C(CCCc3c2c1)C(=O)N1CCN(CC1)C(=O)c1ccco1	InChI=1S/C22H22ClN3O3/c23-14-6-7-18-17(13-14)15-3-1-4-16(20(15)24-18)21(27)25-8-10-26(11-9-25)22(28)19-5-2-12-29-19/h2,5-7,12-13,16,24H,1,3-4,8-11H2	FRSZNZNJHSDBGI-UHFFFAOYSA-N	411.134969304							116813
AC1M0UP1	LSM-28265	SID22406395, BRD-K84014387	2083729	InChI=1S/C26H23NO5/c1-2-31-21-11-9-17(10-12-21)26(30)27-15-25(29)32-16-24(28)20-8-7-19-13-18-5-3-4-6-22(18)23(19)14-20/h3-12,14H,2,13,15-16H2,1H3,(H,27,30)	RBKZERXXLBFHKS-UHFFFAOYSA-N	CCOc1ccc(cc1)C(=O)NCC(=O)OCC(=O)c2ccc3Cc4ccccc4c3c2	BroadT	BRD-K84014387	BRD-K84014387-001-05-7	Enamine Ltd.	T5226556			CCOc1ccc(cc1)C(=O)NCC(=O)OCC(=O)c1ccc2Cc3ccccc3-c2c1	InChI=1S/C26H23NO5/c1-2-31-21-11-9-17(10-12-21)26(30)27-15-25(29)32-16-24(28)20-8-7-19-13-18-5-3-4-6-22(18)23(19)14-20/h3-12,14H,2,13,15-16H2,1H3,(H,27,30)	RBKZERXXLBFHKS-UHFFFAOYSA-N	429.157622846							116814
AC1MEDI7	LSM-28266	BRD-K82543160	2876684	InChI=1S/C15H13BrN2O2/c1-10-3-2-4-12(9-10)15(19)20-18-14(17)11-5-7-13(16)8-6-11/h2-9H,1H3,(H2,17,18)	HPZKKTINIGQDIZ-UHFFFAOYSA-N	Cc1cccc(c1)C(=O)ONC(=N)c2ccc(Br)cc2	BroadT	BRD-K82543160	BRD-K82543160-001-05-0	ChemBridge Corporation	5924878			Cc1cccc(c1)C(=O)ONC(=N)c1ccc(Br)cc1	InChI=1S/C15H13BrN2O2/c1-10-3-2-4-12(9-10)15(19)20-18-14(17)11-5-7-13(16)8-6-11/h2-9H,1H3,(H2,17,18)	HPZKKTINIGQDIZ-UHFFFAOYSA-N	332.016040276							116815
N'-(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-2-(naphthalen-1-yl)acetohydrazide	LSM-28267	SID22402167, BRD-K47001216	7197210	InChI=1S/C18H16N6O/c1-24-18-15(10-21-24)17(19-11-20-18)23-22-16(25)9-13-7-4-6-12-5-2-3-8-14(12)13/h2-8,10-11H,9H2,1H3,(H,22,25)(H,19,20,23)	XBCOAVSXMZFRMQ-UHFFFAOYSA-N	Cn1ncc2c(NNC(=O)Cc3cccc4ccccc34)ncnc12	BroadT	BRD-K47001216	BRD-K47001216-001-05-7	Life Chemicals Inc.	F1852-0193			Cn1ncc2c(NNC(=O)Cc3cccc4ccccc34)ncnc12	InChI=1S/C18H16N6O/c1-24-18-15(10-21-24)17(19-11-20-18)23-22-16(25)9-13-7-4-6-12-5-2-3-8-14(12)13/h2-8,10-11H,9H2,1H3,(H,22,25)(H,19,20,23)	XBCOAVSXMZFRMQ-UHFFFAOYSA-N	332.138559192							116816
67914-97-0	LSM-28268	SID22414613, BRD-K63041482	689098	InChI=1S/C13H20N2O/c1-11(2)14-7-9-15(10-8-14)12-3-5-13(16)6-4-12/h3-6,11,16H,7-10H2,1-2H3	BMBPGRMBBHKAEP-UHFFFAOYSA-N	CC(C)N1CCN(CC1)c2ccc(O)cc2	BroadT	BRD-K63041482	BRD-K63041482-001-05-9	Specs	AN-907/14236005			CC(C)N1CCN(CC1)c1ccc(O)cc1	InChI=1S/C13H20N2O/c1-11(2)14-7-9-15(10-8-14)12-3-5-13(16)6-4-12/h3-6,11,16H,7-10H2,1-2H3	BMBPGRMBBHKAEP-UHFFFAOYSA-N	220.15756328							116817
AC1NT3RD	LSM-44262	SID24805025, BRD-A17550915	5344213	InChI=1S/C14H15NO2S3/c1-9-4-6-19-11(9)7-12-13(16)15(14(18)20-12)8-10-3-2-5-17-10/h4,6-7,10H,2-3,5,8H2,1H3/b12-7-	PJPVQHJGBFTRDK-GHXNOFRVSA-N	Cc1ccsc1\C=C\2/SC(=S)N(CC3CCCO3)C2=O	BroadT	BRD-A17550915	BRD-A17550915-001-05-5	Asinex Ltd.	BAS 01151841			Cc1ccsc1\C=C1/SC(=S)N(CC2CCCO2)C1=O	InChI=1S/C14H15NO2S3/c1-9-4-6-19-11(9)7-12-13(16)15(14(18)20-12)8-10-3-2-5-17-10/h4,6-7,10H,2-3,5,8H2,1H3/b12-7-	PJPVQHJGBFTRDK-GHXNOFRVSA-N	325.0264908							
MLS000587108	LSM-15428	BRD-K29364079	1606033	InChI=1S/C11H15BrN2OS/c1-2-5-15-10-4-3-9(12)6-8(10)7-16-11(13)14/h3-4,6H,2,5,7H2,1H3,(H3,13,14)	RNTOYPHAKLFIHA-UHFFFAOYSA-N	CCCOc1ccc(Br)cc1CSC(=N)N	BroadT	BRD-K29364079	BRD-K29364079-003-06-1	InterBioScreen Ltd.	STOCK2S-03620		Cl	CCCOc1ccc(Br)cc1CSC(N)=N.Cl	InChI=1S/C11H15BrN2OS.ClH/c1-2-5-15-10-4-3-9(12)6-8(10)7-16-11(13)14;/h3-4,6H,2,5,7H2,1H3,(H3,13,14);1H	MMCGRTGPJAFNLN-UHFFFAOYSA-N	302.00884641							104070, 104070
AC1MMBWP	LSM-28270	SID4241339, BRD-A71928124	3236329	InChI=1S/C18H20N4O3/c1-4-22-10-15(11(2)20-22)16-9-17(25-21-16)18(24)19-14-7-5-6-13(8-14)12(3)23/h5-8,10,17H,4,9H2,1-3H3,(H,19,24)	ZSPSZLNZRNRKAI-UHFFFAOYSA-N	CCn1cc(C2=NOC(C2)C(=O)Nc3cccc(c3)C(=O)C)c(C)n1	BroadT	BRD-A71928124	BRD-A71928124-001-05-3	ChemDiv Inc.	C715-0405			CCn1cc(C2=NOC(C2)C(=O)Nc2cccc(c2)C(C)=O)c(C)n1	InChI=1S/C18H20N4O3/c1-4-22-10-15(11(2)20-22)16-9-17(25-21-16)18(24)19-14-7-5-6-13(8-14)12(3)23/h5-8,10,17H,4,9H2,1-3H3,(H,19,24)	ZSPSZLNZRNRKAI-UHFFFAOYSA-N	340.15354054							116819
AC1LXKIB	LSM-44263	SID26660402, BRD-K17614275	1830754	InChI=1S/C13H11BrClNS/c1-8-10(3-2-6-15)13(17)11-7-9(14)4-5-12(11)16-8/h2,4-7H,3H2,1H3,(H,16,17)/b6-2+	BHHIXHMAWNNRDI-QHHAFSJGSA-N	Cc1nc2ccc(Br)cc2c(S)c1C\C=C\Cl	BroadT	BRD-K17614275	BRD-K17614275-001-05-1	InterBioScreen Ltd.	STOCK1S-25674			Cc1nc2ccc(Br)cc2c(S)c1C\C=C\Cl	InChI=1S/C13H11BrClNS/c1-8-10(3-2-6-15)13(17)11-7-9(14)4-5-12(11)16-8/h2,4-7H,3H2,1H3,(H,16,17)/b6-2+	BHHIXHMAWNNRDI-QHHAFSJGSA-N	326.948410362							
AC1MLXGD	LSM-28272	DNDI1383301, BRD-K30214574	3230059	InChI=1S/C23H24FN5/c1-28(2)13-7-12-25-22-15-20(17-8-4-3-5-9-17)26-23-16-21(27-29(22)23)18-10-6-11-19(24)14-18/h3-6,8-11,14-16,25H,7,12-13H2,1-2H3	DGZNIXGYVXEUIZ-UHFFFAOYSA-N	CN(C)CCCNc1cc(nc2cc(nn12)c3cccc(F)c3)c4ccccc4	BroadT	BRD-K30214574	BRD-K30214574-001-06-9	Asinex Ltd.	ASN 08736377			CN(C)CCCNc1cc(nc2cc(nn12)-c1cccc(F)c1)-c1ccccc1	InChI=1S/C23H24FN5/c1-28(2)13-7-12-25-22-15-20(17-8-4-3-5-9-17)26-23-16-21(27-29(22)23)18-10-6-11-19(24)14-18/h3-6,8-11,14-16,25H,7,12-13H2,1-2H3	DGZNIXGYVXEUIZ-UHFFFAOYSA-N	389.201574018							116821
AC1LSLWW	LSM-28273	SID24780835, BRD-K17831908	1441213	InChI=1S/C23H26N4O3/c1-28-17-7-5-16(6-8-17)20-15-21-24-19-4-2-3-18(19)22(27(21)25-20)26-11-9-23(10-12-26)29-13-14-30-23/h5-8,15H,2-4,9-14H2,1H3	NDJRQAYOONYZHS-UHFFFAOYSA-N	COc1ccc(cc1)c2cc3nc4CCCc4c(N5CCC6(CC5)OCCO6)n3n2	BroadT	BRD-K17831908	BRD-K17831908-001-05-6	Asinex Ltd.	ASN 08735174			COc1ccc(cc1)-c1cc2nc3CCCc3c(N3CCC4(CC3)OCCO4)n2n1	InChI=1S/C23H26N4O3/c1-28-17-7-5-16(6-8-17)20-15-21-24-19-4-2-3-18(19)22(27(21)25-20)26-11-9-23(10-12-26)29-13-14-30-23/h5-8,15H,2-4,9-14H2,1H3	NDJRQAYOONYZHS-UHFFFAOYSA-N	406.200490732							116822
MLS000720154	LSM-28274	BRD-K70251764	3965509	InChI=1S/C17H14N2O3/c1-21-13-8-7-11-9-14(16(18)20)17(22-15(11)10-13)19-12-5-3-2-4-6-12/h2-10H,1H3,(H2,18,20)	OFQBVHWSWBTCOR-UHFFFAOYSA-N	COc1ccc2C=C(C(=O)N)C(=Nc3ccccc3)Oc2c1	BroadT	BRD-K70251764	BRD-K70251764-001-07-0	ChemDiv Inc.	1391-0665			COc1ccc2cc(C(N)=O)c(=Nc3ccccc3)oc2c1	InChI=1S/C17H14N2O3/c1-21-13-8-7-11-9-14(16(18)20)17(22-15(11)10-13)19-12-5-3-2-4-6-12/h2-10H,1H3,(H2,18,20)	OFQBVHWSWBTCOR-UHFFFAOYSA-N	294.100442328							116823
BRD-A91759029	LSM-28275			InChI=1S/C25H26N4O5/c1-31-16-8-5-7-14(11-16)22-21-17(9-6-10-18(21)30)26-25-27-24(28-29(22)25)15-12-19(32-2)23(34-4)20(13-15)33-3/h5,7-8,11-13,21-22H,6,9-10H2,1-4H3	XCCGRPBTRMJBHY-UHFFFAOYSA-N	COc1cccc(c1)C2C3C(=O)CCCC3=Nc4nc(nn24)c5cc(OC)c(OC)c(OC)c5	BroadT	BRD-A91759029	BRD-A91759029-001-05-4	ChemDiv Inc.	5225-4085			COc1cccc(c1)C1C2C(=O)CCCC2=Nc2nc(nn12)-c1cc(OC)c(OC)c(OC)c1	InChI=1S/C25H26N4O5/c1-31-16-8-5-7-14(11-16)22-21-17(9-6-10-18(21)30)26-25-27-24(28-29(22)25)15-12-19(32-2)23(34-4)20(13-15)33-3/h5,7-8,11-13,21-22H,6,9-10H2,1-4H3	XCCGRPBTRMJBHY-UHFFFAOYSA-N	462.190319972							116824
SMR000027894	LSM-28276	SID24838278, SID4250202, BRD-K14147733	3244048	InChI=1S/C26H31ClN4O3/c1-2-31-23-10-4-3-9-22(23)24(18-26(31)33)34-19-25(32)28-11-6-12-29-13-15-30(16-14-29)21-8-5-7-20(27)17-21/h3-5,7-10,17-18H,2,6,11-16,19H2,1H3,(H,28,32)	CCOPWNUUIGRDLJ-UHFFFAOYSA-N	CCN1C(=O)C=C(OCC(=O)NCCCN2CCN(CC2)c3cccc(Cl)c3)c4ccccc14	BroadT	BRD-K14147733	BRD-K14147733-001-05-1	ChemDiv Inc.	C547-0577			CCn1c2ccccc2c(OCC(=O)NCCCN2CCN(CC2)c2cccc(Cl)c2)cc1=O	InChI=1S/C26H31ClN4O3/c1-2-31-23-10-4-3-9-22(23)24(18-26(31)33)34-19-25(32)28-11-6-12-29-13-15-30(16-14-29)21-8-5-7-20(27)17-21/h3-5,7-10,17-18H,2,6,11-16,19H2,1H3,(H,28,32)	CCOPWNUUIGRDLJ-UHFFFAOYSA-N	482.208468602							116825
SMR000016740	LSM-28277	SID4247879, BRD-K12524396	3242029	InChI=1S/C18H14ClN5O2/c1-26-14-7-4-6-13(9-14)24-17-16(21-22-24)18(25)23(11-20-17)10-12-5-2-3-8-15(12)19/h2-9,11H,10H2,1H3	DKEADSCJUXYXOE-UHFFFAOYSA-N	COc1cccc(c1)n2nnc3C(=O)N(Cc4ccccc4Cl)C=Nc23	BroadT	BRD-K12524396	BRD-K12524396-001-07-7	Life Chemicals Inc.	F0656-1031			COc1cccc(c1)-n1nnc2c1ncn(Cc1ccccc1Cl)c2=O	InChI=1S/C18H14ClN5O2/c1-26-14-7-4-6-13(9-14)24-17-16(21-22-24)18(25)23(11-20-17)10-12-5-2-3-8-15(12)19/h2-9,11H,10H2,1H3	DKEADSCJUXYXOE-UHFFFAOYSA-N	367.083602448							116826
ZINC00269059	LSM-28278	SID7974171, BRD-K79380055	777936	InChI=1S/C13H11NOS/c15-12-7-8-16-11-6-2-4-9-3-1-5-10(14-12)13(9)11/h1-6H,7-8H2,(H,14,15)	DPKIUHXJZFUQLC-UHFFFAOYSA-N	O=C1CCSc2cccc3cccc(N1)c23	BroadT	BRD-K79380055	BRD-K79380055-001-05-0	ChemBridge Corporation	6873731			O=C1CCSc2cccc3cccc(N1)c23	InChI=1S/C13H11NOS/c15-12-7-8-16-11-6-2-4-9-3-1-5-10(14-12)13(9)11/h1-6H,7-8H2,(H,14,15)	DPKIUHXJZFUQLC-UHFFFAOYSA-N	229.056134672							116827
T0517-2408	LSM-28279	SID24832592, BRD-K69621820	2398606	InChI=1S/C13H16N2O2S/c1-9(2)8-18-13-15-14-12(17-13)10-4-6-11(16-3)7-5-10/h4-7,9H,8H2,1-3H3	FVYHWIBDYLBPNW-UHFFFAOYSA-N	COc1ccc(cc1)c2oc(SCC(C)C)nn2	BroadT	BRD-K69621820	BRD-K69621820-001-06-1	Enamine Ltd.	T0517-2408			COc1ccc(cc1)-c1nnc(SCC(C)C)o1	InChI=1S/C13H16N2O2S/c1-9(2)8-18-13-15-14-12(17-13)10-4-6-11(16-3)7-5-10/h4-7,9H,8H2,1-3H3	FVYHWIBDYLBPNW-UHFFFAOYSA-N	264.093248462							116828
SB-216763	LSM-1161	SB-216763, BRD-K59184148	176158	InChI=1S/C19H12Cl2N2O2/c1-23-9-13(11-4-2-3-5-15(11)23)17-16(18(24)22-19(17)25)12-7-6-10(20)8-14(12)21/h2-9H,1H3,(H,22,24,25)	JCSGFHVFHSKIJH-UHFFFAOYSA-N	Cn1cc(C2=C(C(=O)NC2=O)c3ccc(Cl)cc3Cl)c4ccccc14	BroadT	BRD-K59184148	BRD-K59184148-001-10-9	Sigma-Aldrich	S3442			Cn1cc(C2=C(C(=O)NC2=O)c2ccc(Cl)cc2Cl)c2ccccc12	InChI=1S/C19H12Cl2N2O2/c1-23-9-13(11-4-2-3-5-15(11)23)17-16(18(24)22-19(17)25)12-7-6-10(20)8-14(12)21/h2-9H,1H3,(H,22,24,25)	JCSGFHVFHSKIJH-UHFFFAOYSA-N	370.027583064							91421, 91421
F1757-0115	LSM-28280	SID14739412, BRD-A62994228	2951206	InChI=1S/C22H27FN2O3/c1-2-22(27)17-3-9-21(10-4-17)28-16-20(26)15-24-11-13-25(14-12-24)19-7-5-18(23)6-8-19/h3-10,20,26H,2,11-16H2,1H3	MNTWOTUEQFPHDH-UHFFFAOYSA-N	CCC(=O)c1ccc(OCC(O)CN2CCN(CC2)c3ccc(F)cc3)cc1	BroadT	BRD-A62994228	BRD-A62994228-001-05-1	ChemBridge Corporation	7743023			CCC(=O)c1ccc(OCC(O)CN2CCN(CC2)c2ccc(F)cc2)cc1	InChI=1S/C22H27FN2O3/c1-2-22(27)17-3-9-21(10-4-17)28-16-20(26)15-24-11-13-25(14-12-24)19-7-5-18(23)6-8-19/h3-10,20,26H,2,11-16H2,1H3	MNTWOTUEQFPHDH-UHFFFAOYSA-N	386.200570944							116829
AC1NDXSA	LSM-28281	SID49735050, BRD-K84744232	4583349	InChI=1S/C16H14FN3O3S/c1-9-2-3-10(8-11(9)17)18-13(21)4-6-20-15(22)14-12(5-7-24-14)19-16(20)23/h2-3,5,7-8H,4,6H2,1H3,(H,18,21)(H,19,23)	OZFGCUYQWRVYFG-UHFFFAOYSA-N	Cc1ccc(NC(=O)CCN2C(=O)Nc3ccsc3C2=O)cc1F	BroadT	BRD-K84744232	BRD-K84744232-001-05-6	ChemDiv Inc.	C172-0724			Cc1ccc(NC(=O)CCn2c(=O)[nH]c3ccsc3c2=O)cc1F	InChI=1S/C16H14FN3O3S/c1-9-2-3-10(8-11(9)17)18-13(21)4-6-20-15(22)14-12(5-7-24-14)19-16(20)23/h2-3,5,7-8H,4,6H2,1H3,(H,18,21)(H,19,23)	OZFGCUYQWRVYFG-UHFFFAOYSA-N	347.073990228							116830
AC1LZZ3D	LSM-28282	SID26663938, BRD-K14600468	2012002	InChI=1S/C20H23ClN4OS/c1-3-4-9-22-20-23-18-17(15-8-10-24(2)12-16(15)27-18)19(26)25(20)14-7-5-6-13(21)11-14/h5-7,11H,3-4,8-10,12H2,1-2H3,(H,22,23)	YJZZHJOWLMDHPY-UHFFFAOYSA-N	CCCCNC1=Nc2sc3CN(C)CCc3c2C(=O)N1c4cccc(Cl)c4	BroadT	BRD-K14600468	BRD-K14600468-001-05-0	InterBioScreen Ltd.	STOCK4S-47841			CCCCNc1nc2sc3CN(C)CCc3c2c(=O)n1-c1cccc(Cl)c1	InChI=1S/C20H23ClN4OS/c1-3-4-9-22-20-23-18-17(15-8-10-24(2)12-16(15)27-18)19(26)25(20)14-7-5-6-13(21)11-14/h5-7,11H,3-4,8-10,12H2,1-2H3,(H,22,23)	YJZZHJOWLMDHPY-UHFFFAOYSA-N	402.128109796							116831
2-(Acetylamino)-5-propylthiophene-3-carboxamide	LSM-28283	SID4263452, BRD-K30298785	1246587	InChI=1S/C10H14N2O2S/c1-3-4-7-5-8(9(11)14)10(15-7)12-6(2)13/h5H,3-4H2,1-2H3,(H2,11,14)(H,12,13)	PBVVGHBRUOMYLW-UHFFFAOYSA-N	CCCc1cc(C(=O)N)c(NC(=O)C)s1	BroadT	BRD-K30298785	BRD-K30298785-001-07-5	ChemBridge Corporation	7947363			CCCc1cc(C(N)=O)c(NC(C)=O)s1	InChI=1S/C10H14N2O2S/c1-3-4-7-5-8(9(11)14)10(15-7)12-6(2)13/h5H,3-4H2,1-2H3,(H2,11,14)(H,12,13)	PBVVGHBRUOMYLW-UHFFFAOYSA-N	226.077598398							116832
N-(4-Methyl-2-nitrophenyl)furan-2-carboxamide	LSM-28284	SID24789459, BRD-K96722583	2837048	InChI=1S/C12H10N2O4/c1-8-4-5-9(10(7-8)14(16)17)13-12(15)11-3-2-6-18-11/h2-7H,1H3,(H,13,15)	XKAAMUXWHOHBAT-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2occc2)c(c1)[N+](=O)[O-]	BroadT	BRD-K96722583	BRD-K96722583-001-05-3	Asinex Ltd.	BAS 00784592			Cc1ccc(NC(=O)c2ccco2)c(c1)[N+]([O-])=O	InChI=1S/C12H10N2O4/c1-8-4-5-9(10(7-8)14(16)17)13-12(15)11-3-2-6-18-11/h2-7H,1H3,(H,13,15)	XKAAMUXWHOHBAT-UHFFFAOYSA-N	246.06405682							116833
AC1NQ86X	LSM-28285	BRD-K31682973	5216927	InChI=1S/C14H11Cl2F2N3O/c1-8(9-2-4-11(5-3-9)22-14(17)18)20-21-13-12(16)6-10(15)7-19-13/h2-7,14H,1H3,(H,19,21)	HVIPQVMDUIGIKT-UHFFFAOYSA-N	CC(=NNc1ncc(Cl)cc1Cl)c2ccc(OC(F)F)cc2	BroadT	BRD-K31682973	BRD-K31682973-001-05-5	Enamine Ltd.	T5249700			CC(=NNc1ncc(Cl)cc1Cl)c1ccc(OC(F)F)cc1	InChI=1S/C14H11Cl2F2N3O/c1-8(9-2-4-11(5-3-9)22-14(17)18)20-21-13-12(16)6-10(15)7-19-13/h2-7,14H,1H3,(H,19,21)	HVIPQVMDUIGIKT-UHFFFAOYSA-N	345.024723822							116834
SMR000314930	LSM-28286	SID24814300, BRD-K56198113	16034238	InChI=1S/C23H36N4O5S2/c1-3-5-10-25(4-2)11-6-9-24-22(28)17-27-20-16-19(7-8-21(20)33-18-23(27)29)34(30,31)26-12-14-32-15-13-26/h7-8,16H,3-6,9-15,17-18H2,1-2H3,(H,24,28)	DPIGXTLKHMMHAB-UHFFFAOYSA-N	CCCCN(CC)CCCNC(=O)CN1C(=O)CSc2ccc(cc12)S(=O)(=O)N3CCOCC3	BroadT	BRD-K56198113	BRD-K56198113-001-05-3	ChemDiv Inc.	K786-5958			CCCCN(CC)CCCNC(=O)CN1C(=O)CSc2ccc(cc12)S(=O)(=O)N1CCOCC1	InChI=1S/C23H36N4O5S2/c1-3-5-10-25(4-2)11-6-9-24-22(28)17-27-20-16-19(7-8-21(20)33-18-23(27)29)34(30,31)26-12-14-32-15-13-26/h7-8,16H,3-6,9-15,17-18H2,1-2H3,(H,24,28)	DPIGXTLKHMMHAB-UHFFFAOYSA-N	512.212711672							116835
T5338750	LSM-28287	SID26669757, BRD-A36650137	4885334	InChI=1S/C26H27N3O2/c1-20(28-16-18-29(19-17-28)26(31)22-12-6-3-7-13-22)25(30)27-24-15-9-8-14-23(24)21-10-4-2-5-11-21/h2-15,20H,16-19H2,1H3,(H,27,30)	KQLMVEHHUCOXRS-UHFFFAOYSA-N	CC(N1CCN(CC1)C(=O)c2ccccc2)C(=O)Nc3ccccc3c4ccccc4	BroadT	BRD-A36650137	BRD-A36650137-001-06-0	Enamine Ltd.	T5338750			CC(N1CCN(CC1)C(=O)c1ccccc1)C(=O)Nc1ccccc1-c1ccccc1	InChI=1S/C26H27N3O2/c1-20(28-16-18-29(19-17-28)26(31)22-12-6-3-7-13-22)25(30)27-24-15-9-8-14-23(24)21-10-4-2-5-11-21/h2-15,20H,16-19H2,1H3,(H,27,30)	KQLMVEHHUCOXRS-UHFFFAOYSA-N	413.210327134							116836
T5246927	LSM-44264	SID22407988, BRD-K18494151	5797485	InChI=1S/C18H21N3O/c22-18(21-14-7-3-1-2-4-8-14)12-11-15-13-19-16-9-5-6-10-17(16)20-15/h5-6,9-14H,1-4,7-8H2,(H,21,22)/b12-11+	QYPYBORVOYFBNI-VAWYXSNFSA-N	O=C(NC1CCCCCC1)\C=C\c2cnc3ccccc3n2	BroadT	BRD-K18494151	BRD-K18494151-001-05-6	Enamine Ltd.	T5246927			O=C(NC1CCCCCC1)\C=C\c1cnc2ccccc2n1	InChI=1S/C18H21N3O/c22-18(21-14-7-3-1-2-4-8-14)12-11-15-13-19-16-9-5-6-10-17(16)20-15/h5-6,9-14H,1-4,7-8H2,(H,21,22)/b12-11+	QYPYBORVOYFBNI-VAWYXSNFSA-N	295.168462322							
MLS000555289	LSM-28289	SID17407801, BRD-K45124851	1143706	InChI=1S/C28H27FN6O2/c29-24-15-7-6-14-23(24)28-31-33-35(32-28)19-27(37)34(18-26(36)30-17-20-9-2-1-3-10-20)25-16-8-12-21-11-4-5-13-22(21)25/h1-3,6-10,12,14-16H,4-5,11,13,17-19H2,(H,30,36)	XRDAYMKOYLVYFR-UHFFFAOYSA-N	Fc1ccccc1c2nnn(CC(=O)N(CC(=O)NCc3ccccc3)c4cccc5CCCCc45)n2	BroadT	BRD-K45124851	BRD-K45124851-001-06-7	Asinex Ltd.	ASN 04502238			Fc1ccccc1-c1nnn(CC(=O)N(CC(=O)NCc2ccccc2)c2cccc3CCCCc23)n1	InChI=1S/C28H27FN6O2/c29-24-15-7-6-14-23(24)28-31-33-35(32-28)19-27(37)34(18-26(36)30-17-20-9-2-1-3-10-20)25-16-8-12-21-11-4-5-13-22(21)25/h1-3,6-10,12,14-16H,4-5,11,13,17-19H2,(H,30,36)	XRDAYMKOYLVYFR-UHFFFAOYSA-N	498.217952364							116838
ZINC00049760	LSM-28290	SID26662710, BRD-K31105720	683642	InChI=1S/C13H14N2OS/c1-8-5-9(2)15-13(11(8)6-14)17-7-12(16)10-3-4-10/h5,10H,3-4,7H2,1-2H3	NCSWTPOBHFZEFU-UHFFFAOYSA-N	Cc1cc(C)c(C#N)c(SCC(=O)C2CC2)n1	BroadT	BRD-K31105720	BRD-K31105720-001-05-3	InterBioScreen Ltd.	STOCK1S-20776			Cc1cc(C)c(C#N)c(SCC(=O)C2CC2)n1	InChI=1S/C13H14N2OS/c1-8-5-9(2)15-13(11(8)6-14)17-7-12(16)10-3-4-10/h5,10H,3-4,7H2,1-2H3	NCSWTPOBHFZEFU-UHFFFAOYSA-N	246.082683778							116839
T5634445	LSM-44265	SID17414950, BRD-K07376515	1331044	InChI=1S/C13H14N2OS2/c1-7-5-9(8(2)15(7)10-3-4-10)6-11-12(16)14-13(17)18-11/h5-6,10H,3-4H2,1-2H3,(H,14,16,17)/b11-6-	LFYRFCRFKSGEMR-WDZFZDKYSA-N	Cc1cc(\C=C\2/SC(=S)NC2=O)c(C)n1C3CC3	BroadT	BRD-K07376515	BRD-K07376515-001-05-9	ChemBridge Corporation	7067454			Cc1cc(\C=C2/SC(=S)NC2=O)c(C)n1C1CC1	InChI=1S/C13H14N2OS2/c1-7-5-9(8(2)15(7)10-3-4-10)6-11-12(16)14-13(17)18-11/h5-6,10H,3-4H2,1-2H3,(H,14,16,17)/b11-6-	LFYRFCRFKSGEMR-WDZFZDKYSA-N	278.054754468							
MLS000583919	LSM-28292	SID17510726, BRD-K29227387	5067422	InChI=1S/C11H11FN2O3/c1-11(2)6-17-10(13-11)7-3-4-8(12)9(5-7)14(15)16/h3-5H,6H2,1-2H3	YTCYEKCFTMOMEJ-UHFFFAOYSA-N	CC1(C)COC(=N1)c2ccc(F)c(c2)[N+](=O)[O-]	BroadT	BRD-K29227387	BRD-K29227387-001-05-3	ChemDiv Inc.	K783-4405			CC1(C)COC(=N1)c1ccc(F)c(c1)[N+]([O-])=O	InChI=1S/C11H11FN2O3/c1-11(2)6-17-10(13-11)7-3-4-8(12)9(5-7)14(15)16/h3-5H,6H2,1-2H3	YTCYEKCFTMOMEJ-UHFFFAOYSA-N	238.075370432							116841
GNF-PF-2564	LSM-28293	GNF-PF-2564, BRD-K82327174	3737943	InChI=1S/C22H26N4O2S2/c1-3-26-21(28)19-16-10-12-25(2)13-17(16)30-20(19)24-22(26)29-14-18(27)23-11-9-15-7-5-4-6-8-15/h4-8H,3,9-14H2,1-2H3,(H,23,27)	CVXKZFZOXXAXPZ-UHFFFAOYSA-N	CCN1C(=O)c2c3CCN(C)Cc3sc2N=C1SCC(=O)NCCc4ccccc4	BroadT	BRD-K82327174	BRD-K82327174-001-05-2	InterBioScreen Ltd.	STOCK4S-11539			CCn1c(SCC(=O)NCCc2ccccc2)nc2sc3CN(C)CCc3c2c1=O	InChI=1S/C22H26N4O2S2/c1-3-26-21(28)19-16-10-12-25(2)13-17(16)30-20(19)24-22(26)29-14-18(27)23-11-9-15-7-5-4-6-8-15/h4-8H,3,9-14H2,1-2H3,(H,23,27)	CVXKZFZOXXAXPZ-UHFFFAOYSA-N	442.149717492							116842
AG-690/36983070	LSM-28294	SID17387763, BRD-K96276519	804433	InChI=1S/C13H10FN3OS/c1-8-6-12(18)17(16-8)13-15-11(7-19-13)9-2-4-10(14)5-3-9/h2-5,7H,6H2,1H3	NGSWSSYWGRGCNV-UHFFFAOYSA-N	CC1=NN(C(=O)C1)c2nc(cs2)c3ccc(F)cc3	BroadT	BRD-K96276519	BRD-K96276519-001-06-7	Specs	AG-690/36983070			CC1=NN(C(=O)C1)c1nc(cs1)-c1ccc(F)cc1	InChI=1S/C13H10FN3OS/c1-8-6-12(18)17(16-8)13-15-11(7-19-13)9-2-4-10(14)5-3-9/h2-5,7H,6H2,1H3	NGSWSSYWGRGCNV-UHFFFAOYSA-N	275.05286086							116843
MLS000046145	LSM-28295	SID4250302, BRD-K61919649	3244136	InChI=1S/C15H12F3NO3/c1-7-3-13(20)22-8(2)14(7)15(21)19-6-10-11(17)4-9(16)5-12(10)18/h3-5H,6H2,1-2H3,(H,19,21)	ALIHKYQHSUEULO-UHFFFAOYSA-N	CC1=C(C(=O)NCc2c(F)cc(F)cc2F)C(=CC(=O)O1)C	BroadT	BRD-K61919649	BRD-K61919649-001-05-8	ChemDiv Inc.	K784-7342			Cc1cc(=O)oc(C)c1C(=O)NCc1c(F)cc(F)cc1F	InChI=1S/C15H12F3NO3/c1-7-3-13(20)22-8(2)14(7)15(21)19-6-10-11(17)4-9(16)5-12(10)18/h3-5H,6H2,1-2H3,(H,19,21)	ALIHKYQHSUEULO-UHFFFAOYSA-N	311.076927854							116844
6-Amino-4-(2-ethoxy-4-hydroxyphenyl)-3-propyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile	LSM-28296	BRD-A19917108	3245454	InChI=1S/C18H20N4O3/c1-3-5-13-16-15(11-7-6-10(23)8-14(11)24-4-2)12(9-19)17(20)25-18(16)22-21-13/h6-8,12,15,20,23H,3-5H2,1-2H3,(H,21,22)	GEIBAYIOFZJPCA-UHFFFAOYSA-N	CCCc1[nH]nc2OC(=N)C(C#N)C(c12)c1ccc(O)cc1OCC	BroadT	BRD-A19917108	BRD-A19917108-001-06-9	ChemDiv Inc.	8009-9378			CCCc1n[nH]c2OC(N)=C(C#N)C(c12)c1ccc(O)cc1OCC	InChI=1S/C18H20N4O3/c1-3-5-13-16-15(11-7-6-10(23)8-14(11)24-4-2)12(9-19)17(20)25-18(16)22-21-13/h6-8,15,23H,3-5,20H2,1-2H3,(H,21,22)	MVBPOVMTXWFKKY-UHFFFAOYSA-N	340.15354054							
MLS000044836	LSM-28297	SID4244441, BRD-K96777352	3239036	InChI=1S/C14H12N2OS2/c1-2-16(10-6-4-3-5-7-10)14-15-11-8-9-18-12(11)13(17)19-14/h3-9H,2H2,1H3	NFCRWKNWRAOKQC-UHFFFAOYSA-N	CCN(C1=Nc2ccsc2C(=O)S1)c3ccccc3	BroadT	BRD-K96777352	BRD-K96777352-001-06-4	ChemDiv Inc.	C200-1586			CCN(c1ccccc1)c1nc2ccsc2c(=O)s1	InChI=1S/C14H12N2OS2/c1-2-16(10-6-4-3-5-7-10)14-15-11-8-9-18-12(11)13(17)19-14/h3-9H,2H2,1H3	NFCRWKNWRAOKQC-UHFFFAOYSA-N	288.039104404							116846
2N-514S	LSM-28298	SID17402502, BRD-K46932325	4271806	InChI=1S/C18H11F3N2O2/c19-18(20,21)14-11-15(24)23(13-9-5-2-6-10-13)22-16(14)17(25)12-7-3-1-4-8-12/h1-11H	WQTJIKOELXSWGM-UHFFFAOYSA-N	FC(F)(F)C1=CC(=O)N(N=C1C(=O)c2ccccc2)c3ccccc3	BroadT	BRD-K46932325	BRD-K46932325-001-05-2	Key Organics Ltd.	2N-514S			FC(F)(F)c1cc(=O)n(nc1C(=O)c1ccccc1)-c1ccccc1	InChI=1S/C18H11F3N2O2/c19-18(20,21)14-11-15(24)23(13-9-5-2-6-10-13)22-16(14)17(25)12-7-3-1-4-8-12/h1-11H	WQTJIKOELXSWGM-UHFFFAOYSA-N	344.077262212							131288
AC1LYYUQ	LSM-44266	SID26662708, BRD-K87015873	1910761	InChI=1S/C16H13N3/c1-12-9-14(8-7-13(10-17)11-18)19(2)16-6-4-3-5-15(12)16/h3-9H,1-2H3/b14-8+	VIAUQUMBQHPXAE-RIYZIHGNSA-N	CN1\C(=C\C=C(C#N)C#N)\C=C(C)c2ccccc12	BroadT	BRD-K87015873	BRD-K87015873-001-05-2	InterBioScreen Ltd.	STOCK1S-08390			CN1c2ccccc2C(C)=C\C1=C/C=C(C#N)C#N	InChI=1S/C16H13N3/c1-12-9-14(8-7-13(10-17)11-18)19(2)16-6-4-3-5-15(12)16/h3-9H,1-2H3/b14-8+	VIAUQUMBQHPXAE-RIYZIHGNSA-N	247.110947446							
AQ-360/42570780	LSM-28300	SID22414331, BRD-A66034301	3271554	InChI=1S/C23H24N2O4/c26-21(24-15-14-16-8-2-1-3-9-16)19-12-6-7-13-20(19)25-22(27)17-10-4-5-11-18(17)23(28)29/h1-9,12-13,17-18H,10-11,14-15H2,(H,24,26)(H,25,27)(H,28,29)	KWJZSNHRUQYPRV-UHFFFAOYSA-N	OC(=O)C1CC=CCC1C(=O)Nc2ccccc2C(=O)NCCc3ccccc3	BroadT	BRD-A66034301	BRD-A66034301-001-05-2	Specs	AQ-360/42570780			OC(=O)C1CC=CCC1C(=O)Nc1ccccc1C(=O)NCCc1ccccc1	InChI=1S/C23H24N2O4/c26-21(24-15-14-16-8-2-1-3-9-16)19-12-6-7-13-20(19)25-22(27)17-10-4-5-11-18(17)23(28)29/h1-9,12-13,17-18H,10-11,14-15H2,(H,24,26)(H,25,27)(H,28,29)	KWJZSNHRUQYPRV-UHFFFAOYSA-N	392.173607268							116850
SMR000026216	LSM-28301	SID24838617, SID4252175, BRD-K46265074	3245762	InChI=1S/C26H32N4O3/c1-28-21-12-6-5-11-19(21)23-20(25(32)27-14-8-16-29-15-7-13-22(29)31)17-30(26(33)24(23)28)18-9-3-2-4-10-18/h5-6,11-12,17-18H,2-4,7-10,13-16H2,1H3,(H,27,32)	NHPXICYPOACOOF-UHFFFAOYSA-N	Cn1c2C(=O)N(C=C(C(=O)NCCCN3CCCC3=O)c2c4ccccc14)C5CCCCC5	BroadT	BRD-K46265074	BRD-K46265074-001-05-0	ChemDiv Inc.	C329-0660			Cn1c2ccccc2c2c(cn(C3CCCCC3)c(=O)c12)C(=O)NCCCN1CCCC1=O	InChI=1S/C26H32N4O3/c1-28-21-12-6-5-11-19(21)23-20(25(32)27-14-8-16-29-15-7-13-22(29)31)17-30(26(33)24(23)28)18-9-3-2-4-10-18/h5-6,11-12,17-18H,2-4,7-10,13-16H2,1H3,(H,27,32)	NHPXICYPOACOOF-UHFFFAOYSA-N	448.247440924							116851
T0509-4933	LSM-28302	SID3714843, BRD-K32698573	2998981	InChI=1S/C12H11N3OS/c1-3-11(16-6-1)9-17-8-10-7-15-5-2-4-13-12(15)14-10/h1-7H,8-9H2	IXSXGQYKFGAUOB-UHFFFAOYSA-N	C(SCc1cn2cccnc2n1)c3occc3	BroadT	BRD-K32698573	BRD-K32698573-001-06-2	Enamine Ltd.	T0509-4933			C(SCc1ccco1)c1cn2cccnc2n1	InChI=1S/C12H11N3OS/c1-3-11(16-6-1)9-17-8-10-7-15-5-2-4-13-12(15)14-10/h1-7H,8-9H2	IXSXGQYKFGAUOB-UHFFFAOYSA-N	245.062282692							116852
ST50677680	LSM-28303	SID4244532, BRD-K58526537	3239116	InChI=1S/C23H22N4O4/c1-15-6-4-5-7-17(15)13-27-14-18(12-24-27)25-23(28)19-11-21(31-26-19)16-8-9-20(29-2)22(10-16)30-3/h4-12,14H,13H2,1-3H3,(H,25,28)	DXCMUDWXIWURQG-UHFFFAOYSA-N	COc1ccc(cc1OC)c2onc(c2)C(=O)Nc3cnn(Cc4ccccc4C)c3	BroadT	BRD-K58526537	BRD-K58526537-001-05-1	ChemDiv Inc.	C226-1127			COc1ccc(cc1OC)-c1cc(no1)C(=O)Nc1cnn(Cc2ccccc2C)c1	InChI=1S/C23H22N4O4/c1-15-6-4-5-7-17(15)13-27-14-18(12-24-27)25-23(28)19-11-21(31-26-19)16-8-9-20(29-2)22(10-16)30-3/h4-12,14H,13H2,1-3H3,(H,25,28)	DXCMUDWXIWURQG-UHFFFAOYSA-N	418.164105224							116853
MLS000334031	LSM-44267	SID22402963, BRD-K11659036	2109969	InChI=1S/C24H19NO3/c1-16-7-5-9-18(13-16)25-23(26)21-12-4-3-11-20(21)22(24(25)27)15-17-8-6-10-19(14-17)28-2/h3-15H,1-2H3/b22-15-	LWJYCGCUKJOZSM-JCMHNJIXSA-N	COc1cccc(\C=C\2/C(=O)N(C(=O)c3ccccc23)c4cccc(C)c4)c1	BroadT	BRD-K11659036	BRD-K11659036-001-05-2	Enamine Ltd.	T5240151			COc1cccc(\C=C2/C(=O)N(C(=O)c3ccccc23)c2cccc(C)c2)c1	InChI=1S/C24H19NO3/c1-16-7-5-9-18(13-16)25-23(26)21-12-4-3-11-20(21)22(24(25)27)15-17-8-6-10-19(14-17)28-2/h3-15H,1-2H3/b22-15-	LWJYCGCUKJOZSM-JCMHNJIXSA-N	369.136493478							
CHEMDIV3_012865	LSM-28305	SID24822892, BRD-K56499794	4158327	InChI=1S/C13H9N3OS/c1-9-4-2-3-5-11(9)16-12(17)8-18-13(16)10(6-14)7-15/h2-5H,8H2,1H3	JSJJZYVAUBHMLJ-UHFFFAOYSA-N	Cc1ccccc1N2C(=O)CSC2=C(C#N)C#N	BroadT	BRD-K56499794	BRD-K56499794-001-06-9	ChemDiv Inc.	K291-0192			Cc1ccccc1N1C(=O)CSC1=C(C#N)C#N	InChI=1S/C13H9N3OS/c1-9-4-2-3-5-11(9)16-12(17)8-18-13(16)10(6-14)7-15/h2-5H,8H2,1H3	JSJJZYVAUBHMLJ-UHFFFAOYSA-N	255.046632628							116855
1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine	LSM-4100	BRD-K93331292, SID85248363, SID99495608	3025945	InChI=1S/C13H10N4O4S/c14-13-15-11-3-1-2-4-12(11)16(13)22(20,21)10-7-5-9(6-8-10)17(18)19/h1-8H,(H2,14,15)	AISUMVRDEXUUBA-UHFFFAOYSA-N	Nc1nc2ccccc2n1S(=O)(=O)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-K93331292	BRD-K93331292-001-01-7	Sanford-Burnham Medical Research Institute	193696-93-8 MLS-0425617			Nc1nc2ccccc2n1S(=O)(=O)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C13H10N4O4S/c14-13-15-11-3-1-2-4-12(11)16(13)22(20,21)10-7-5-9(6-8-10)17(18)19/h1-8H,(H2,14,15)	AISUMVRDEXUUBA-UHFFFAOYSA-N	318.04227553							93634
AC1LM6WW	LSM-28306	BRD-K39449880	1098733	InChI=1S/C16H15N5O3S/c1-23-13-7-6-10(8-14(13)24-2)9-17-19-16(22)18-11-4-3-5-12-15(11)21-25-20-12/h3-9H,1-2H3,(H2,18,19,22)	ZTSACJMBBKLKFK-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)Nc2cccc3nsnc23)cc1OC	BroadT	BRD-K39449880	BRD-K39449880-001-06-1	Asinex Ltd.	BAS 00365561			COc1ccc(C=NNC(=O)Nc2cccc3nsnc23)cc1OC	InChI=1S/C16H15N5O3S/c1-23-13-7-6-10(8-14(13)24-2)9-17-19-16(22)18-11-4-3-5-12-15(11)21-25-20-12/h3-9H,1-2H3,(H2,18,19,22)	ZTSACJMBBKLKFK-UHFFFAOYSA-N	357.08956008							116856
AC1LD69V	LSM-28307	SID860628, BRD-A72021882	661906	InChI=1S/C20H16N4/c1-23-17-8-4-2-6-15(17)19-22-16-7-3-5-9-18(16)24(19)20(23)14-10-12-21-13-11-14/h2-13,20H,1H3	HHDYYTVALIONSZ-UHFFFAOYSA-N	CN1C(c2ccncc2)n3c(nc4ccccc34)c5ccccc15	BroadT	BRD-A72021882	BRD-A72021882-001-07-4	InterBioScreen Ltd.	STOCK3S-83114			CN1C(c2ccncc2)n2c(nc3ccccc23)-c2ccccc12	InChI=1S/C20H16N4/c1-23-17-8-4-2-6-15(17)19-22-16-7-3-5-9-18(16)24(19)20(23)14-10-12-21-13-11-14/h2-13,20H,1H3	HHDYYTVALIONSZ-UHFFFAOYSA-N	312.137496552							116857
SMR000032700	LSM-28308	SID26670584, SID4246006, BRD-K53318310	3240405	InChI=1S/C25H28N4O5S/c1-15(2)16-3-5-18(6-4-16)28-35(33,34)19-7-8-22-20(13-19)23(30)21(14-27-22)25(32)29-11-9-17(10-12-29)24(26)31/h3-8,13-15,17,28H,9-12H2,1-2H3,(H2,26,31)(H,27,30)	HRQMMHRMQOAVIA-UHFFFAOYSA-N	CC(C)c1ccc(NS(=O)(=O)c2ccc3ncc(C(=O)N4CCC(CC4)C(=O)N)c(O)c3c2)cc1	BroadT	BRD-K53318310	BRD-K53318310-001-05-1	ChemDiv Inc.	K788-1247			CC(C)c1ccc(NS(=O)(=O)c2ccc3ncc(C(=O)N4CCC(CC4)C(N)=O)c(O)c3c2)cc1	InChI=1S/C25H28N4O5S/c1-15(2)16-3-5-18(6-4-16)28-35(33,34)19-7-8-22-20(13-19)23(30)21(14-27-22)25(32)29-11-9-17(10-12-29)24(26)31/h3-8,13-15,17,28H,9-12H2,1-2H3,(H2,26,31)(H,27,30)	HRQMMHRMQOAVIA-UHFFFAOYSA-N	496.178040726							116858
ASN 00925694	LSM-28309	SID14723667, BRD-K84916115	856373	InChI=1S/C13H8FNOS/c14-10-5-3-9(4-6-10)11-8-15-13(16-11)12-2-1-7-17-12/h1-8H	CRICFIBKOMWSAE-UHFFFAOYSA-N	Fc1ccc(cc1)c2oc(nc2)c3cccs3	BroadT	BRD-K84916115	BRD-K84916115-001-05-2	Asinex Ltd.	ASN 00925694			Fc1ccc(cc1)-c1cnc(o1)-c1cccs1	InChI=1S/C13H8FNOS/c14-10-5-3-9(4-6-10)11-8-15-13(16-11)12-2-1-7-17-12/h1-8H	CRICFIBKOMWSAE-UHFFFAOYSA-N	245.031062776							116859
4-[2-(1-Methyl-1H-benzoimidazol-2-yl)-ethyl]-phenylamine	LSM-28310	SID24780653, BRD-K47129240	746140	InChI=1S/C16H17N3/c1-19-15-5-3-2-4-14(15)18-16(19)11-8-12-6-9-13(17)10-7-12/h2-7,9-10H,8,11,17H2,1H3	UYYUYDDKLNGZQL-UHFFFAOYSA-N	Cn1c(CCc2ccc(N)cc2)nc3ccccc13	BroadT	BRD-K47129240	BRD-K47129240-001-05-6	Asinex Ltd.	BAS 03422527			Cn1c(CCc2ccc(N)cc2)nc2ccccc12	InChI=1S/C16H17N3/c1-19-15-5-3-2-4-14(15)18-16(19)11-8-12-6-9-13(17)10-7-12/h2-7,9-10H,8,11,17H2,1H3	UYYUYDDKLNGZQL-UHFFFAOYSA-N	251.142247574							116860
2,5-Dimethoxy-n-(4-phenoxyphenyl)benzenesulfonamide	LSM-28311	SID14734727, BRD-K29566043	1298117	InChI=1S/C20H19NO5S/c1-24-18-12-13-19(25-2)20(14-18)27(22,23)21-15-8-10-17(11-9-15)26-16-6-4-3-5-7-16/h3-14,21H,1-2H3	JBXNZHSGLGZVPI-UHFFFAOYSA-N	COc1ccc(OC)c(c1)S(=O)(=O)Nc2ccc(Oc3ccccc3)cc2	BroadT	BRD-K29566043	BRD-K29566043-001-05-0	ChemBridge Corporation	7821931			COc1ccc(OC)c(c1)S(=O)(=O)Nc1ccc(Oc2ccccc2)cc1	InChI=1S/C20H19NO5S/c1-24-18-12-13-19(25-2)20(14-18)27(22,23)21-15-8-10-17(11-9-15)26-16-6-4-3-5-7-16/h3-14,21H,1-2H3	JBXNZHSGLGZVPI-UHFFFAOYSA-N	385.098393408							116861
4-Methyl-n-[phenyl(propan-2-yl)-	LSM-28312	SID26731372, BRD-A38465968	264704	InChI=1S/C16H19NO2S2/c1-13(2)20(15-7-5-4-6-8-15)17-21(18,19)16-11-9-14(3)10-12-16/h4-13H,1-3H3	DWNRUURVBUPQSB-UHFFFAOYSA-N	CC(C)S(=NS(=O)(=O)c1ccc(C)cc1)c2ccccc2	BroadT	BRD-A38465968	BRD-A38465968-001-05-7	Maybridge	BTB 15070			CC(C)S(=NS(=O)(=O)c1ccc(C)cc1)c1ccccc1	InChI=1S/C16H19NO2S2/c1-13(2)20(15-7-5-4-6-8-15)17-21(18,19)16-11-9-14(3)10-12-16/h4-13H,1-3H3	DWNRUURVBUPQSB-UHFFFAOYSA-N	321.085720238							
ZINC00424484	LSM-28313	SID29215076, SID4250605, BRD-K52175401	49824446	InChI=1S/C17H14N4O2S/c1-23-12-6-4-5-11(9-12)14-10-24-17-19-18-16(21(17)20-14)13-7-2-3-8-15(13)22/h2-9,22H,10H2,1H3	BJKWXSCCROOKPS-UHFFFAOYSA-N	COc1cccc(c1)C2=Nn3c(SC2)nnc3c4ccccc4O	BroadT	BRD-K52175401	BRD-K52175401-001-05-6	ChemDiv Inc.	K243-0280			COc1cccc(c1)C1=Nn2c(SC1)nnc2-c1ccccc1O	InChI=1S/C17H14N4O2S/c1-23-12-6-4-5-11(9-12)14-10-24-17-19-18-16(21(17)20-14)13-7-2-3-8-15(13)22/h2-9,22H,10H2,1H3	BJKWXSCCROOKPS-UHFFFAOYSA-N	338.083746418							
BAS 05509756	LSM-28314	SID24797193, BRD-K48179806	1080244	InChI=1S/C16H16FN3O2/c17-12-4-6-13(7-5-12)21-11-15-19-14(10-18)16(22-15)20-8-2-1-3-9-20/h4-7H,1-3,8-9,11H2	UTLVWJSMKNNXBA-UHFFFAOYSA-N	Fc1ccc(OCc2oc(N3CCCCC3)c(n2)C#N)cc1	BroadT	BRD-K48179806	BRD-K48179806-001-05-6	Asinex Ltd.	BAS 05509756			Fc1ccc(OCc2nc(C#N)c(o2)N2CCCCC2)cc1	InChI=1S/C16H16FN3O2/c17-12-4-6-13(7-5-12)21-11-15-19-14(10-18)16(22-15)20-8-2-1-3-9-20/h4-7H,1-3,8-9,11H2	UTLVWJSMKNNXBA-UHFFFAOYSA-N	301.122654982							116863
AC1LHPX3	LSM-15578	BRD-K20014102	867244	InChI=1S/C13H18ClNO/c1-11-5-4-6-12(14)13(11)16-10-9-15-7-2-3-8-15/h4-6H,2-3,7-10H2,1H3	VKIYIHWONRLGDU-UHFFFAOYSA-N	Cc1cccc(Cl)c1OCCN2CCCC2	BroadT	BRD-K20014102	BRD-K20014102-034-05-9	ChemBridge Corporation	5470071		OC(=O)C(=O)O	Cc1cccc(Cl)c1OCCN1CCCC1.OC(=O)C(=O)O	InChI=1S/C13H18ClNO.C2H2O4/c1-11-5-4-6-12(14)13(11)16-10-9-15-7-2-3-8-15;3-1(4)2(5)6/h4-6H,2-3,7-10H2,1H3;(H,3,4)(H,5,6)	LPPUMADFQBKVCR-UHFFFAOYSA-N	239.107691916							104214, 104214
SMR000039126	LSM-28315	SID856871, BRD-K80889362	658229	InChI=1S/C19H19N3O3S2/c1-21-9-8-13-14(10-21)27-17-16(13)18(24)22(12-6-4-3-5-7-12)19(20-17)26-11-15(23)25-2/h3-7H,8-11H2,1-2H3	HPFNNMYQYRUSQR-UHFFFAOYSA-N	COC(=O)CSC1=Nc2sc3CN(C)CCc3c2C(=O)N1c4ccccc4	BroadT	BRD-K80889362	BRD-K80889362-001-05-5	InterBioScreen Ltd.	STOCK1S-34544			COC(=O)CSc1nc2sc3CN(C)CCc3c2c(=O)n1-c1ccccc1	InChI=1S/C19H19N3O3S2/c1-21-9-8-13-14(10-21)27-17-16(13)18(24)22(12-6-4-3-5-7-12)19(20-17)26-11-15(23)25-2/h3-7H,8-11H2,1-2H3	HPFNNMYQYRUSQR-UHFFFAOYSA-N	401.086782878							116864
ZINC03559848	LSM-28316	SID22409721, BRD-K46420619	2677149	InChI=1S/C19H19N3O6/c1-2-28-19(25)14-3-7-15(8-4-14)21-17(23)11-12-20-18(24)13-5-9-16(10-6-13)22(26)27/h3-10H,2,11-12H2,1H3,(H,20,24)(H,21,23)	SDTXNBFKDMNMDO-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)CCNC(=O)c2ccc(cc2)[N+](=O)[O-])cc1	BroadT	BRD-K46420619	BRD-K46420619-001-05-3	Enamine Ltd.	Z31999224			CCOC(=O)c1ccc(NC(=O)CCNC(=O)c2ccc(cc2)[N+]([O-])=O)cc1	InChI=1S/C19H19N3O6/c1-2-28-19(25)14-3-7-15(8-4-14)21-17(23)11-12-20-18(24)13-5-9-16(10-6-13)22(26)27/h3-10H,2,11-12H2,1H3,(H,20,24)(H,21,23)	SDTXNBFKDMNMDO-UHFFFAOYSA-N	385.127385358							116865
Ethyl 3-({[(benzyloxy)imino]methyl}amino)-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxylate	LSM-28317	SID14730013, BRD-K11989972	2765717	InChI=1S/C20H22N4O3S/c1-4-26-20(25)18-17(16-15(24(2)3)10-11-21-19(16)28-18)22-13-23-27-12-14-8-6-5-7-9-14/h5-11,13H,4,12H2,1-3H3,(H,22,23)	LLBPKAIWBYHSTJ-UHFFFAOYSA-N	CCOC(=O)c1sc2nccc(N(C)C)c2c1N=CNOCc3ccccc3	BroadT	BRD-K11989972	BRD-K11989972-001-05-9	Key Organics Ltd.	10M-081			CCOC(=O)c1sc2nccc(N(C)C)c2c1N=CNOCc1ccccc1	InChI=1S/C20H22N4O3S/c1-4-26-20(25)18-17(16-15(24(2)3)10-11-21-19(16)28-18)22-13-23-27-12-14-8-6-5-7-9-14/h5-11,13H,4,12H2,1-3H3,(H,22,23)	LLBPKAIWBYHSTJ-UHFFFAOYSA-N	398.141261294							116866
SMR000207514	LSM-28318	SID17504848, BRD-K54117412	4402099	InChI=1S/C19H14N4O2S/c20-11-15-17(13-7-3-1-4-8-13)22-19(23-18(15)25)26-12-16(24)21-14-9-5-2-6-10-14/h1-10H,12H2,(H,21,24)(H,22,23,25)	VNGPFKQOTPZXFR-UHFFFAOYSA-N	Oc1nc(SCC(=O)Nc2ccccc2)nc(c3ccccc3)c1C#N	BroadT	BRD-K54117412	BRD-K54117412-001-04-6	ChemDiv Inc.	3736-0023			Oc1nc(SCC(=O)Nc2ccccc2)nc(-c2ccccc2)c1C#N	InChI=1S/C19H14N4O2S/c20-11-15-17(13-7-3-1-4-8-13)22-19(23-18(15)25)26-12-16(24)21-14-9-5-2-6-10-14/h1-10H,12H2,(H,21,24)(H,22,23,25)	VNGPFKQOTPZXFR-UHFFFAOYSA-N	362.083746418							116867
ST50061723	LSM-28319	BRD-K00381334	1943171	InChI=1S/C13H15BrN4S2/c14-11-7-6-10(20-11)8-15-18-12(16-17-13(18)19)9-4-2-1-3-5-9/h6-9H,1-5H2,(H,17,19)	YNCSZKXHXVCFKK-UHFFFAOYSA-N	Sc1nnc(C2CCCCC2)n1N=Cc3ccc(Br)s3	BroadT	BRD-K00381334	BRD-K00381334-001-07-1	ChemBridge Corporation	7175739			Sc1nnc(C2CCCCC2)n1N=Cc1ccc(Br)s1	InChI=1S/C13H15BrN4S2/c14-11-7-6-10(20-11)8-15-18-12(16-17-13(18)19)9-4-2-1-3-5-9/h6-9H,1-5H2,(H,17,19)	YNCSZKXHXVCFKK-UHFFFAOYSA-N	369.9921505							116868
SMR000131471	LSM-28320	SID14737362, BRD-K84168746	9551015	InChI=1S/C17H29N3O2S/c1-3-5-10-20(11-6-4-2)12-9-18-16(21)14-19-17(22)15-8-7-13-23-15/h7-8,13H,3-6,9-12,14H2,1-2H3,(H,18,21)(H,19,22)	JVAVLEGVDDSMOE-UHFFFAOYSA-N	CCCCN(CCCC)CCNC(=O)CNC(=O)c1cccs1	BroadT	BRD-K84168746	BRD-K84168746-001-06-5	ChemDiv Inc.	K786-3875			CCCCN(CCCC)CCNC(=O)CNC(=O)c1cccs1	InChI=1S/C17H29N3O2S/c1-3-5-10-20(11-6-4-2)12-9-18-16(21)14-19-17(22)15-8-7-13-23-15/h7-8,13H,3-6,9-12,14H2,1-2H3,(H,18,21)(H,19,22)	JVAVLEGVDDSMOE-UHFFFAOYSA-N	339.198047888							116869
OPREA1_621726	LSM-28321	SID24786710, BRD-A88420094	16001492	InChI=1S/C20H23N3O4/c24-20(21-11-10-15-5-2-1-3-6-15)16-8-9-18(19(13-16)23(25)26)22-14-17-7-4-12-27-17/h1-3,5-6,8-9,13,17,22H,4,7,10-12,14H2,(H,21,24)	RMKCKRIEOFMFOH-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1NCC2CCCO2)C(=O)NCCc3ccccc3	BroadT	BRD-A88420094	BRD-A88420094-001-05-8	ChemDiv Inc.	K781-5870			[O-][N+](=O)c1cc(ccc1NCC1CCCO1)C(=O)NCCc1ccccc1	InChI=1S/C20H23N3O4/c24-20(21-11-10-15-5-2-1-3-6-15)16-8-9-18(19(13-16)23(25)26)22-14-17-7-4-12-27-17/h1-3,5-6,8-9,13,17,22H,4,7,10-12,14H2,(H,21,24)	RMKCKRIEOFMFOH-UHFFFAOYSA-N	369.168856246							116870
MLS001210509	LSM-28322	SID49643223, BRD-K53811464	1719457	InChI=1S/C19H9N3O8/c23-17-14-7-12(21(27)28)5-10-6-13(22(29)30)8-15(16(10)14)18(24)20(17)11-3-1-2-9(4-11)19(25)26/h1-8H,(H,25,26)	NIPZTHWSGKAQER-UHFFFAOYSA-N	OC(=O)c1cccc(c1)N2C(=O)c3cc(cc4cc(cc(C2=O)c34)[N+](=O)[O-])[N+](=O)[O-]	BroadT	BRD-K53811464	BRD-K53811464-001-05-9	Asinex Ltd.	BAS 00331813			OC(=O)c1cccc(c1)N1C(=O)c2cc(cc3cc(cc(C1=O)c23)[N+]([O-])=O)[N+]([O-])=O	InChI=1S/C19H9N3O8/c23-17-14-7-12(21(27)28)5-10-6-13(22(29)30)8-15(16(10)14)18(24)20(17)11-3-1-2-9(4-11)19(25)26/h1-8H,(H,25,26)	NIPZTHWSGKAQER-UHFFFAOYSA-N	407.038964278							116871
SMR000016016	LSM-28323	SID4248306, BRD-A43459761	3242397	InChI=1S/C20H24N4O2S/c1-3-13-8-6-7-11-24(13)16(25)12-27-20-22-17-14-9-4-5-10-15(14)21-18(17)19(26)23(20)2/h4-5,9-10,13,26H,3,6-8,11-12H2,1-2H3	FPOSQCUJYPDCLB-UHFFFAOYSA-N	CCC1CCCCN1C(=O)CSc2nc3c4ccccc4nc3c(O)n2C	BroadT	BRD-A43459761	BRD-A43459761-001-06-0	Life Chemicals Inc.	F0580-0006			CCC1CCCCN1C(=O)CSc1nc2c(nc3ccccc23)c(O)n1C	InChI=1S/C20H24N4O2S/c1-3-13-8-6-7-11-24(13)16(25)12-27-20-22-17-14-9-4-5-10-15(14)21-18(17)19(26)23(20)2/h4-5,9-10,13,26H,3,6-8,11-12H2,1-2H3	FPOSQCUJYPDCLB-UHFFFAOYSA-N	384.161996738							
MLS001179013	LSM-28324	SID47195235, BRD-A67724155	11840103	InChI=1S/C17H23NO/c1-11-14-9-13(17(14,2)3)10-15(11)18-16(19)12-7-5-4-6-8-12/h4-8,11,13-15H,9-10H2,1-3H3,(H,18,19)/t11-,13?,14?,15?/m0/s1	UYWLHAPTZKHACA-WXPVAWKNSA-N	C[C@@H]1C(CC2CC1C2(C)C)NC(=O)c3ccccc3	BroadT	BRD-A67724155	BRD-A67724155-001-06-2	Specs	AN-970/40920586			C[C@H]1C2CC(CC1NC(=O)c1ccccc1)C2(C)C	InChI=1S/C17H23NO/c1-11-14-9-13(17(14,2)3)10-15(11)18-16(19)12-7-5-4-6-8-12/h4-8,11,13-15H,9-10H2,1-3H3,(H,18,19)/t11-,13?,14?,15?/m0/s1	UYWLHAPTZKHACA-WXPVAWKNSA-N	257.177964366							116873
AC1NT6HU	LSM-44268	SID24806488, BRD-A37220162	5346344	InChI=1S/C14H12N4O2S/c1-8-10(7-11-12(19)16-14(21)15-11)13(20)18(17-8)9-5-3-2-4-6-9/h2-7,10H,1H3,(H2,15,16,19,21)/b11-7-	UFKNVXBWMBITCM-XFFZJAGNSA-N	CC1=NN(C(=O)C1\C=C\2/NC(=S)NC2=O)c3ccccc3	BroadT	BRD-A37220162	BRD-A37220162-001-05-1	ChemBridge Corporation	6021001			CC1=NN(C(=O)C1\C=C1/NC(=S)NC1=O)c1ccccc1	InChI=1S/C14H12N4O2S/c1-8-10(7-11-12(19)16-14(21)15-11)13(20)18(17-8)9-5-3-2-4-6-9/h2-7,10H,1H3,(H2,15,16,19,21)/b11-7-	UFKNVXBWMBITCM-XFFZJAGNSA-N	300.068096354							
MLS000063231	LSM-28326	SID4261531, BRD-A17471686	2947772	InChI=1S/C14H14ClN3O3S/c15-9-3-5-10(6-4-9)21-8-12-17-18-14(22-12)16-13(19)11-2-1-7-20-11/h3-6,11H,1-2,7-8H2,(H,16,18,19)	ONXNENGRKIRMCB-UHFFFAOYSA-N	Clc1ccc(OCc2nnc(NC(=O)C3CCCO3)s2)cc1	BroadT	BRD-A17471686	BRD-A17471686-001-05-1	ChemBridge Corporation	7685368			Clc1ccc(OCc2nnc(NC(=O)C3CCCO3)s2)cc1	InChI=1S/C14H14ClN3O3S/c15-9-3-5-10(6-4-9)21-8-12-17-18-14(22-12)16-13(19)11-2-1-7-20-11/h3-6,11H,1-2,7-8H2,(H,16,18,19)	ONXNENGRKIRMCB-UHFFFAOYSA-N	339.044439738							116875
HMS2612C22	LSM-44269	BRD-K18583604	12005036	InChI=1S/C22H24ClN5O3/c23-20-9-3-1-7-19(20)16-26-12-14-27(15-13-26)17-22(29)25-24-11-5-8-18-6-2-4-10-21(18)28(30)31/h1-11H,12-17H2,(H,25,29)/b8-5-,24-11?	RUVZFQTYGRCFAU-WNRXLXBKSA-N	[O-][N+](=O)c1ccccc1\C=C/C=NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2	BroadT	BRD-K18583604	BRD-K18583604-001-05-9	ChemDiv Inc.	3254-2669			[O-][N+](=O)c1ccccc1\C=C/C=NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	InChI=1S/C22H24ClN5O3/c23-20-9-3-1-7-19(20)16-26-12-14-27(15-13-26)17-22(29)25-24-11-5-8-18-6-2-4-10-21(18)28(30)31/h1-11H,12-17H2,(H,25,29)/b8-5-,24-11?	RUVZFQTYGRCFAU-WNRXLXBKSA-N	441.156767388							
N-[4-(Tert-butyl)phenyl]-n'-(3-pyridinylmethyl)thiourea	LSM-28328	SID26727769, BRD-K94041209	2730137	InChI=1S/C17H21N3S/c1-17(2,3)14-6-8-15(9-7-14)20-16(21)19-12-13-5-4-10-18-11-13/h4-11H,12H2,1-3H3,(H2,19,20,21)	YDKKJFPEPKBMPC-UHFFFAOYSA-N	CC(C)(C)c1ccc(NC(=NCc2cccnc2)S)cc1	BroadT	BRD-K94041209	BRD-K94041209-001-05-4	Maybridge	RJF 00420			CC(C)(C)c1ccc(NC(S)=NCc2cccnc2)cc1	InChI=1S/C17H21N3S/c1-17(2,3)14-6-8-15(9-7-14)20-16(21)19-12-13-5-4-10-18-11-13/h4-11H,12H2,1-3H3,(H2,19,20,21)	YDKKJFPEPKBMPC-UHFFFAOYSA-N	299.145618392							116877
Methyl 5-(2-amino-1,3-thiazol-4-yl)-2,4-dimethyl-1H-pyrrole-3-carboxylate	LSM-28329	SID24836466, BRD-K15351460	1228659	InChI=1S/C11H13N3O2S/c1-5-8(10(15)16-3)6(2)13-9(5)7-4-17-11(12)14-7/h4,13H,1-3H3,(H2,12,14)	CCWIILKSNVTARS-UHFFFAOYSA-N	COC(=O)c1c(C)[nH]c(c1C)c2csc(N)n2	BroadT	BRD-K15351460	BRD-K15351460-001-05-7	Enamine Ltd.	T5239773			COC(=O)c1c(C)[nH]c(-c2csc(N)n2)c1C	InChI=1S/C11H13N3O2S/c1-5-8(10(15)16-3)6(2)13-9(5)7-4-17-11(12)14-7/h4,13H,1-3H3,(H2,12,14)	CCWIILKSNVTARS-UHFFFAOYSA-N	251.072847376							116878
AC1MFZXS	LSM-28330	SID49725997, BRD-A01183300	2928283	InChI=1S/C23H27N5O3/c1-14-6-4-10-27-20(14)26-21-18(23(27)30)12-17(19(24)28(21)15-7-2-3-8-15)22(29)25-13-16-9-5-11-31-16/h4,6,10,12,15-16,24H,2-3,5,7-9,11,13H2,1H3,(H,25,29)	GGMIFFPFTQSWTL-UHFFFAOYSA-N	CC1=CC=CN2C(=O)C3=C(N=C12)N(C4CCCC4)C(=N)C(=C3)C(=O)NCC5CCCO5	BroadT	BRD-A01183300	BRD-A01183300-001-05-6	Asinex Ltd.	BAS 04995974			Cc1cccn2c1nc1n(C3CCCC3)c(=N)c(cc1c2=O)C(=O)NCC1CCCO1	InChI=1S/C23H27N5O3/c1-14-6-4-10-27-20(14)26-21-18(23(27)30)12-17(19(24)28(21)15-7-2-3-8-15)22(29)25-13-16-9-5-11-31-16/h4,6,10,12,15-16,24H,2-3,5,7-9,11,13H2,1H3,(H,25,29)	GGMIFFPFTQSWTL-UHFFFAOYSA-N	421.211389774							116879
AC1LRSIK	LSM-28331	SID24807816, BRD-K34576826	1452726	InChI=1S/C18H20N4O2/c23-17(13-6-2-1-3-7-13)22-16-10-9-14(12-20-16)21-18(24)15-8-4-5-11-19-15/h4-5,8-13H,1-3,6-7H2,(H,21,24)(H,20,22,23)	NMMJDUGVQCXDDF-UHFFFAOYSA-N	O=C(Nc1ccc(NC(=O)c2ccccn2)cn1)C3CCCCC3	BroadT	BRD-K34576826	BRD-K34576826-001-05-5	Asinex Ltd.	ASN 05803922			O=C(Nc1ccc(NC(=O)c2ccccn2)cn1)C1CCCCC1	InChI=1S/C18H20N4O2/c23-17(13-6-2-1-3-7-13)22-16-10-9-14(12-20-16)21-18(24)15-8-4-5-11-19-15/h4-5,8-13H,1-3,6-7H2,(H,21,24)(H,20,22,23)	NMMJDUGVQCXDDF-UHFFFAOYSA-N	324.15862592							116880
MLS000333215	LSM-28332	SID26663840, BRD-K20492973	4268417	InChI=1S/C11H21N7O3/c1-17(2)6-3-4-14-11-15-9(12)8(18(20)21)10(16-11)13-5-7-19/h19H,3-7H2,1-2H3,(H4,12,13,14,15,16)	XLCMMYQQNBEXRV-UHFFFAOYSA-N	CN(C)CCCNc1nc(N)c(c(NCCO)n1)[N+](=O)[O-]	BroadT	BRD-K20492973	BRD-K20492973-001-06-0	InterBioScreen Ltd.	STOCK4S-39112			CN(C)CCCNc1nc(N)c(c(NCCO)n1)[N+]([O-])=O	InChI=1S/C11H21N7O3/c1-17(2)6-3-4-14-11-15-9(12)8(18(20)21)10(16-11)13-5-7-19/h19H,3-7H2,1-2H3,(H4,12,13,14,15,16)	XLCMMYQQNBEXRV-UHFFFAOYSA-N	299.170587602							116881
SMR000032994	LSM-28333	SID4250155, BRD-K55478468	3244007	InChI=1S/C24H26N4O3S/c1-5-27-15-25-22-20(23(27)29)16(2)21(32-22)24(30)28(14-19-7-6-12-31-19)13-17-8-10-18(11-9-17)26(3)4/h6-12,15H,5,13-14H2,1-4H3	HSNLMXNAMXJLIR-UHFFFAOYSA-N	CCN1C=Nc2sc(C(=O)N(Cc3occc3)Cc4ccc(cc4)N(C)C)c(C)c2C1=O	BroadT	BRD-K55478468	BRD-K55478468-001-06-9	ChemDiv Inc.	K840-0333			CCn1cnc2sc(C(=O)N(Cc3ccco3)Cc3ccc(cc3)N(C)C)c(C)c2c1=O	InChI=1S/C24H26N4O3S/c1-5-27-15-25-22-20(23(27)29)16(2)21(32-22)24(30)28(14-19-7-6-12-31-19)13-17-8-10-18(11-9-17)26(3)4/h6-12,15H,5,13-14H2,1-4H3	HSNLMXNAMXJLIR-UHFFFAOYSA-N	450.172561422							116882
AC1LP6OY	LSM-28334	BRD-K13978427	1282232	InChI=1S/C22H20ClN5O/c1-16-11-19(12-26-27-14-24-25-15-27)17(2)28(16)21-7-9-22(10-8-21)29-13-18-3-5-20(23)6-4-18/h3-12,14-15H,13H2,1-2H3	JAMPQIXPGFUGOH-UHFFFAOYSA-N	Cc1cc(C=Nn2cnnc2)c(C)n1c3ccc(OCc4ccc(Cl)cc4)cc3	BroadT	BRD-K13978427	BRD-K13978427-001-07-7	ChemBridge Corporation	6760287			Cc1cc(C=Nn2cnnc2)c(C)n1-c1ccc(OCc2ccc(Cl)cc2)cc1	InChI=1S/C22H20ClN5O/c1-16-11-19(12-26-27-14-24-25-15-27)17(2)28(16)21-7-9-22(10-8-21)29-13-18-3-5-20(23)6-4-18/h3-12,14-15H,13H2,1-2H3	JAMPQIXPGFUGOH-UHFFFAOYSA-N	405.13563802							116883
STK293693	LSM-28335	SID24840616, BRD-K20807541	2083498	InChI=1S/C17H26N2O5S/c1-13(2)6-7-18-17(20)14-4-5-15(23-3)16(12-14)25(21,22)19-8-10-24-11-9-19/h4-5,12-13H,6-11H2,1-3H3,(H,18,20)	KSMBCWURLSZHNG-UHFFFAOYSA-N	COc1ccc(cc1S(=O)(=O)N2CCOCC2)C(=O)NCCC(C)C	BroadT	BRD-K20807541	BRD-K20807541-001-05-4	Enamine Ltd.	T5261451			COc1ccc(cc1S(=O)(=O)N1CCOCC1)C(=O)NCCC(C)C	InChI=1S/C17H26N2O5S/c1-13(2)6-7-18-17(20)14-4-5-15(23-3)16(12-14)25(21,22)19-8-10-24-11-9-19/h4-5,12-13H,6-11H2,1-3H3,(H,18,20)	KSMBCWURLSZHNG-UHFFFAOYSA-N	370.156242642							116884
ZINC04842333	LSM-28336	SID24795826, BRD-K34395512	2995798	InChI=1S/C22H16N2O3/c25-21(24-14-15-4-3-11-23-13-15)17-9-7-16(8-10-17)19-12-18-5-1-2-6-20(18)27-22(19)26/h1-13H,14H2,(H,24,25)	URSBOPHGBVVHIJ-UHFFFAOYSA-N	O=C(NCc1cccnc1)c2ccc(cc2)C3=Cc4ccccc4OC3=O	BroadT	BRD-K34395512	BRD-K34395512-001-07-5	ChemBridge Corporation	9013128			O=C(NCc1cccnc1)c1ccc(cc1)-c1cc2ccccc2oc1=O	InChI=1S/C22H16N2O3/c25-21(24-14-15-4-3-11-23-13-15)17-9-7-16(8-10-17)19-12-18-5-1-2-6-20(18)27-22(19)26/h1-13H,14H2,(H,24,25)	URSBOPHGBVVHIJ-UHFFFAOYSA-N	356.116092392							116885
2-[3-(4-Fluorophenyl)-1,2,4-oxadiazol-5-yl]-n-(3-methoxyphenyl)benzamide	LSM-28337	SID4257182, BRD-K83077633	2225787	InChI=1S/C22H16FN3O3/c1-28-17-6-4-5-16(13-17)24-21(27)18-7-2-3-8-19(18)22-25-20(26-29-22)14-9-11-15(23)12-10-14/h2-13H,1H3,(H,24,27)	VPNALYOVXYPNKN-UHFFFAOYSA-N	COc1cccc(NC(=O)c2ccccc2c3onc(n3)c4ccc(F)cc4)c1	BroadT	BRD-K83077633	BRD-K83077633-001-05-7	ChemBridge Corporation	7950315			COc1cccc(NC(=O)c2ccccc2-c2nc(no2)-c2ccc(F)cc2)c1	InChI=1S/C22H16FN3O3/c1-28-17-6-4-5-16(13-17)24-21(27)18-7-2-3-8-19(18)22-25-20(26-29-22)14-9-11-15(23)12-10-14/h2-13H,1H3,(H,24,27)	VPNALYOVXYPNKN-UHFFFAOYSA-N	389.117569602							116886
T5227648	LSM-28338	SID24785921, BRD-K48077461	5025746	InChI=1S/C23H31ClN4O3S/c1-4-28(19-8-6-5-7-9-19)32(30,31)20-10-11-21(24)22(16-20)25-23(29)17-27(3)18-12-14-26(2)15-13-18/h5-11,16,18H,4,12-15,17H2,1-3H3,(H,25,29)	PASRFKUBAKATBD-UHFFFAOYSA-N	CCN(c1ccccc1)S(=O)(=O)c2ccc(Cl)c(NC(=O)CN(C)C3CCN(C)CC3)c2	BroadT	BRD-K48077461	BRD-K48077461-001-07-4	Enamine Ltd.	T5227648			CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(NC(=O)CN(C)C2CCN(C)CC2)c1	InChI=1S/C23H31ClN4O3S/c1-4-28(19-8-6-5-7-9-19)32(30,31)20-10-11-21(24)22(16-20)25-23(29)17-27(3)18-12-14-26(2)15-13-18/h5-11,16,18H,4,12-15,17H2,1-3H3,(H,25,29)	PASRFKUBAKATBD-UHFFFAOYSA-N	478.180539292							116887
MLS000051968	LSM-28339	SID4258226, BRD-K49776883	1249855	InChI=1S/C12H16N2O2S/c1-8-3-4-10(5-9(8)2)14-12(16)7-17-6-11(13)15/h3-5H,6-7H2,1-2H3,(H2,13,15)(H,14,16)	AKHAZTNCFSWKCN-UHFFFAOYSA-N	Cc1ccc(NC(=O)CSCC(=O)N)cc1C	BroadT	BRD-K49776883	BRD-K49776883-001-06-2	ChemBridge Corporation	7955468			Cc1ccc(NC(=O)CSCC(N)=O)cc1C	InChI=1S/C12H16N2O2S/c1-8-3-4-10(5-9(8)2)14-12(16)7-17-6-11(13)15/h3-5H,6-7H2,1-2H3,(H2,13,15)(H,14,16)	AKHAZTNCFSWKCN-UHFFFAOYSA-N	252.093248462							116888
3-(3,4-Dimethoxyphenyl)-5,7-dihydroxy-2-methylchromen-4-one	LSM-28340	SID7968008, BRD-K31189414	5309168	InChI=1S/C18H16O6/c1-9-16(10-4-5-13(22-2)14(6-10)23-3)18(21)17-12(20)7-11(19)8-15(17)24-9/h4-8,19-20H,1-3H3	OKMZAQXBYWZWCL-UHFFFAOYSA-N	COc1ccc(cc1OC)C2=C(C)Oc3cc(O)cc(O)c3C2=O	BroadT	BRD-K31189414	BRD-K31189414-001-04-1	ChemDiv Inc.	6737-2438			COc1ccc(cc1OC)-c1c(C)oc2cc(O)cc(O)c2c1=O	InChI=1S/C18H16O6/c1-9-16(10-4-5-13(22-2)14(6-10)23-3)18(21)17-12(20)7-11(19)8-15(17)24-9/h4-8,19-20H,1-3H3	OKMZAQXBYWZWCL-UHFFFAOYSA-N	328.094688232							116889
SMR000249102	LSM-28341	SID22408888, BRD-K99360440	4831440	InChI=1S/C23H22FN3O5S/c1-30-20-12-16(4-7-19(20)32-13-21(28)27-8-10-31-11-9-27)22(29)26-23-25-18(14-33-23)15-2-5-17(24)6-3-15/h2-7,12,14H,8-11,13H2,1H3,(H,25,26,29)	JERNHJKJBJXLTA-UHFFFAOYSA-N	COc1cc(ccc1OCC(=O)N2CCOCC2)C(=O)Nc3nc(cs3)c4ccc(F)cc4	BroadT	BRD-K99360440	BRD-K99360440-001-06-0	Enamine Ltd.	T5292916			COc1cc(ccc1OCC(=O)N1CCOCC1)C(=O)Nc1nc(cs1)-c1ccc(F)cc1	InChI=1S/C23H22FN3O5S/c1-30-20-12-16(4-7-19(20)32-13-21(28)27-8-10-31-11-9-27)22(29)26-23-25-18(14-33-23)15-2-5-17(24)6-3-15/h2-7,12,14H,8-11,13H2,1H3,(H,25,26,29)	JERNHJKJBJXLTA-UHFFFAOYSA-N	471.126419724							116890
MLS000418872	LSM-28342	SID22401582, BRD-K06029752	7120053	InChI=1S/C17H12N2O2S/c1-10-5-4-6-11(9-10)19-16(20)15-14(18-17(19)22)12-7-2-3-8-13(12)21-15/h2-9H,1H3,(H,18,22)	STBCNNBWHZGPPB-UHFFFAOYSA-N	Cc1cccc(c1)N2C(=S)Nc3c(oc4ccccc34)C2=O	BroadT	BRD-K06029752	BRD-K06029752-001-05-7	Life Chemicals Inc.	F1607-0756			Cc1cccc(c1)-n1c(=S)[nH]c2c3ccccc3oc2c1=O	InChI=1S/C17H12N2O2S/c1-10-5-4-6-11(9-10)19-16(20)15-14(18-17(19)22)12-7-2-3-8-13(12)21-15/h2-9H,1H3,(H,18,22)	STBCNNBWHZGPPB-UHFFFAOYSA-N	308.061948334							116891
AC1LGQUN	LSM-28343	SID22412588, BRD-K64984525	850367	InChI=1S/C18H18N4O2/c1-23-15-7-3-13(4-8-15)20-17-11-12-19-18(22-17)21-14-5-9-16(24-2)10-6-14/h3-12H,1-2H3,(H2,19,20,21,22)	CZZKMTODGZXDCD-UHFFFAOYSA-N	COc1ccc(Nc2ccnc(Nc3ccc(OC)cc3)n2)cc1	BroadT	BRD-K64984525	BRD-K64984525-001-05-8	Specs	AP-501/42225928			COc1ccc(Nc2ccnc(Nc3ccc(OC)cc3)n2)cc1	InChI=1S/C18H18N4O2/c1-23-15-7-3-13(4-8-15)20-17-11-12-19-18(22-17)21-14-5-9-16(24-2)10-6-14/h3-12H,1-2H3,(H2,19,20,21,22)	CZZKMTODGZXDCD-UHFFFAOYSA-N	322.142975856							116892
ZINC03346995	LSM-28344	SID22407622, BRD-K24273781	2463739	InChI=1S/C18H16ClN3O2S/c1-9-15(11(3)23)10(2)20-16(9)17(24)22-18-21-14(8-25-18)12-4-6-13(19)7-5-12/h4-8,20H,1-3H3,(H,21,22,24)	HJRCTBNHCHCNBG-UHFFFAOYSA-N	CC(=O)c1c(C)[nH]c(C(=O)Nc2nc(cs2)c3ccc(Cl)cc3)c1C	BroadT	BRD-K24273781	BRD-K24273781-001-05-4	Enamine Ltd.	T5319549			CC(=O)c1c(C)[nH]c(C(=O)Nc2nc(cs2)-c2ccc(Cl)cc2)c1C	InChI=1S/C18H16ClN3O2S/c1-9-15(11(3)23)10(2)20-16(9)17(24)22-18-21-14(8-25-18)12-4-6-13(19)7-5-12/h4-8,20H,1-3H3,(H,21,22,24)	HJRCTBNHCHCNBG-UHFFFAOYSA-N	373.065175182							116893
MLS000102325	LSM-28345	SID7970026, BRD-K87301649	4622527	InChI=1S/C15H17ClN4O2/c1-18-6-8-19(9-7-18)13-10-14(21)20(15(22)17-13)12-4-2-11(16)3-5-12/h2-5,10H,6-9H2,1H3,(H,17,22)	SOGFJQLZLRYRKC-UHFFFAOYSA-N	CN1CCN(CC1)C2=CC(=O)N(C(=O)N2)c3ccc(Cl)cc3	BroadT	BRD-K87301649	BRD-K87301649-001-05-9	Life Chemicals Inc.	F0662-0412			CN1CCN(CC1)c1cc(=O)n(-c2ccc(Cl)cc2)c(=O)[nH]1	InChI=1S/C15H17ClN4O2/c1-18-6-8-19(9-7-18)13-10-14(21)20(15(22)17-13)12-4-2-11(16)3-5-12/h2-5,10H,6-9H2,1H3,(H,17,22)	SOGFJQLZLRYRKC-UHFFFAOYSA-N	320.104003534							116894
F0631-0444	LSM-28346	SID7971015, BRD-A45936853	4393835	InChI=1S/C19H19N5O3S2/c1-12-20-19-24(21-12)18(26)16(29-19)15(14-5-3-11-28-14)22-6-8-23(9-7-22)17(25)13-4-2-10-27-13/h2-5,10-11,15,26H,6-9H2,1H3	HTOVIECVYFLKKU-UHFFFAOYSA-N	Cc1nc2sc(C(N3CCN(CC3)C(=O)c4occc4)c5cccs5)c(O)n2n1	BroadT	BRD-A45936853	BRD-A45936853-001-05-6	Life Chemicals Inc.	F0631-0444			Cc1nc2sc(C(N3CCN(CC3)C(=O)c3ccco3)c3cccs3)c(O)n2n1	InChI=1S/C19H19N5O3S2/c1-12-20-19-24(21-12)18(26)16(29-19)15(14-5-3-11-28-14)22-6-8-23(9-7-22)17(25)13-4-2-10-27-13/h2-5,10-11,15,26H,6-9H2,1H3	HTOVIECVYFLKKU-UHFFFAOYSA-N	429.092930898							116895
SMR000064631	LSM-28347	SID3715274, BRD-A46107175	2999146	InChI=1S/C21H21NO5/c1-22(11-16-13-26-18-5-3-4-6-19(18)27-16)21(23)9-14-12-25-20-10-15(24-2)7-8-17(14)20/h3-8,10,12,16H,9,11,13H2,1-2H3	YGRYTBJASIUBJP-UHFFFAOYSA-N	COc1ccc2c(CC(=O)N(C)CC3COc4ccccc4O3)coc2c1	BroadT	BRD-A46107175	BRD-A46107175-001-05-4	Enamine Ltd.	T5336199			COc1ccc2c(CC(=O)N(C)CC3COc4ccccc4O3)coc2c1	InChI=1S/C21H21NO5/c1-22(11-16-13-26-18-5-3-4-6-19(18)27-16)21(23)9-14-12-25-20-10-15(24-2)7-8-17(14)20/h3-8,10,12,16H,9,11,13H2,1-2H3	YGRYTBJASIUBJP-UHFFFAOYSA-N	367.141972782							116896
SMR000124113	LSM-28348	SID14722839, BRD-K08079946	1430426	InChI=1S/C22H26ClN3O2S/c1-22(2,3)16-4-7-18(8-5-16)29(27,28)26-12-10-15(11-13-26)21-24-19-9-6-17(23)14-20(19)25-21/h4-9,14-15H,10-13H2,1-3H3,(H,24,25)	GNZOGHIBRLASHC-UHFFFAOYSA-N	CC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCC(CC2)c3nc4cc(Cl)ccc4[nH]3	BroadT	BRD-K08079946	BRD-K08079946-001-07-3	Asinex Ltd.	ASN 06580257			CC(C)(C)c1ccc(cc1)S(=O)(=O)N1CCC(CC1)c1nc2cc(Cl)ccc2[nH]1	InChI=1S/C22H26ClN3O2S/c1-22(2,3)16-4-7-18(8-5-16)29(27,28)26-12-10-15(11-13-26)21-24-19-9-6-17(23)14-20(19)25-21/h4-9,14-15H,10-13H2,1-3H3,(H,24,25)	GNZOGHIBRLASHC-UHFFFAOYSA-N	431.143425502							116897
T6017635	LSM-28349	SID24791414, BRD-K04841540	4683977	InChI=1S/C23H24N6O6S/c1-14-5-6-16(11-18(14)36(33,34)26-15-7-9-17(35-4)10-8-15)25-19(30)12-29-13-24-21-20(29)22(31)28(3)23(32)27(21)2/h5-11,13,26H,12H2,1-4H3,(H,25,30)	PNLVXTUTMBHOGP-UHFFFAOYSA-N	COc1ccc(NS(=O)(=O)c2cc(NC(=O)Cn3cnc4N(C)C(=O)N(C)C(=O)c34)ccc2C)cc1	BroadT	BRD-K04841540	BRD-K04841540-001-05-4	Enamine Ltd.	T0519-5740			COc1ccc(NS(=O)(=O)c2cc(NC(=O)Cn3cnc4n(C)c(=O)n(C)c(=O)c34)ccc2C)cc1	InChI=1S/C23H24N6O6S/c1-14-5-6-16(11-18(14)36(33,34)26-15-7-9-17(35-4)10-8-15)25-19(30)12-29-13-24-21-20(29)22(31)28(3)23(32)27(21)2/h5-11,13,26H,12H2,1-4H3,(H,25,30)	PNLVXTUTMBHOGP-UHFFFAOYSA-N	512.147803238							116898
3-[2-(1,3-Benzothiazol-2-yl)hydrazinyl]-1-(4-ethylphenyl)pyrrolidine-2,5-dione	LSM-28350	SID22401366, BRD-A29459123	3628152	InChI=1S/C19H18N4O2S/c1-2-12-7-9-13(10-8-12)23-17(24)11-15(18(23)25)21-22-19-20-14-5-3-4-6-16(14)26-19/h3-10,15,21H,2,11H2,1H3,(H,20,22)	DOISQXLKUHAYKN-UHFFFAOYSA-N	CCc1ccc(cc1)N2C(=O)CC(NNc3nc4ccccc4s3)C2=O	BroadT	BRD-A29459123	BRD-A29459123-001-05-3	InterBioScreen Ltd.	STOCK3S-73164			CCc1ccc(cc1)N1C(=O)CC(NNc2nc3ccccc3s2)C1=O	InChI=1S/C19H18N4O2S/c1-2-12-7-9-13(10-8-12)23-17(24)11-15(18(23)25)21-22-19-20-14-5-3-4-6-16(14)26-19/h3-10,15,21H,2,11H2,1H3,(H,20,22)	DOISQXLKUHAYKN-UHFFFAOYSA-N	366.115046546							116899
SMR000028039	LSM-28351	SID4248787, BRD-K64238993	3242817	InChI=1S/C20H18N2O4S/c1-2-22-15-6-4-3-5-14(15)18(10-20(22)24)27-11-19(23)21-13-7-8-16-17(9-13)26-12-25-16/h3-10H,2,11-12H2,1H3,(H,21,23)	BKYJKWFYEDIXAQ-UHFFFAOYSA-N	CCN1C(=O)C=C(SCC(=O)Nc2ccc3OCOc3c2)c4ccccc14	BroadT	BRD-K64238993	BRD-K64238993-001-05-2	ChemDiv Inc.	C564-0081			CCn1c2ccccc2c(SCC(=O)Nc2ccc3OCOc3c2)cc1=O	InChI=1S/C20H18N2O4S/c1-2-22-15-6-4-3-5-14(15)18(10-20(22)24)27-11-19(23)21-13-7-8-16-17(9-13)26-12-25-16/h3-10H,2,11-12H2,1H3,(H,21,23)	BKYJKWFYEDIXAQ-UHFFFAOYSA-N	382.098727766							116900
Fenbufen	LSM-2258	Fenbufen, CL-82204	3335	InChI=1S/C16H14O3/c17-15(10-11-16(18)19)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9H,10-11H2,(H,18,19)	ZPAKPRAICRBAOD-UHFFFAOYSA-N	OC(=O)CCC(=O)c1ccc(cc1)c2ccccc2	BroadT	BRD-K12513978	BRD-K12513978-001-18-3	Sigma-Aldrich	538515			OC(=O)CCC(=O)c1ccc(cc1)-c1ccccc1	InChI=1S/C16H14O3/c17-15(10-11-16(18)19)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9H,10-11H2,(H,18,19)	ZPAKPRAICRBAOD-UHFFFAOYSA-N	254.094294308							31599
SMR000020312	LSM-28352	SID4244259, BRD-K55431383	3238881	InChI=1S/C12H14N4O2/c1-3-10(17)16-12(13)14-11(15-16)8-4-6-9(18-2)7-5-8/h4-7H,3H2,1-2H3,(H2,13,14,15)	HWMGKKKOPJPABY-UHFFFAOYSA-N	CCC(=O)n1nc(nc1N)c2ccc(OC)cc2	BroadT	BRD-K55431383	BRD-K55431383-001-06-0	ChemDiv Inc.	6103-0119			CCC(=O)n1nc(nc1N)-c1ccc(OC)cc1	InChI=1S/C12H14N4O2/c1-3-10(17)16-12(13)14-11(15-16)8-4-6-9(18-2)7-5-8/h4-7H,3H2,1-2H3,(H2,13,14,15)	HWMGKKKOPJPABY-UHFFFAOYSA-N	246.111675728							116901
SMR000048242	LSM-28353	SID865654, BRD-K03346572	5390059	InChI=1S/C25H25N3O3/c1-2-15-10-11-18-17(13-15)25(24(31)26-18)21-20(19-9-6-12-28(19)25)22(29)27(23(21)30)14-16-7-4-3-5-8-16/h3-5,7-8,10-11,13,19-21H,2,6,9,12,14H2,1H3,(H,26,31)/t19-,20+,21-,25+/m0/s1	RIUIABXROFOCBS-UGCAPWQASA-N	CCc1ccc2NC(=O)[C@]3([C@H]4[C@@H]([C@@H]5CCCN35)C(=O)N(Cc6ccccc6)C4=O)c2c1	BroadT	BRD-K03346572	BRD-K03346572-001-05-6	InterBioScreen Ltd.	STOCK5S-49043			CCc1ccc2NC(=O)[C@]3([C@H]4[C@@H]([C@@H]5CCCN35)C(=O)N(Cc3ccccc3)C4=O)c2c1	InChI=1S/C25H25N3O3/c1-2-15-10-11-18-17(13-15)25(24(31)26-18)21-20(19-9-6-12-28(19)25)22(29)27(23(21)30)14-16-7-4-3-5-8-16/h3-5,7-8,10-11,13,19-21H,2,6,9,12,14H2,1H3,(H,26,31)/t19-,20+,21-,25+/m0/s1	RIUIABXROFOCBS-UGCAPWQASA-N	415.18959169							116902
T5533575	LSM-28354	SID3717908, BRD-K92724741	3000189	InChI=1S/C16H23N3OS/c1-19-3-2-17-15(19)21-10-14(20)18-16-7-11-4-12(8-16)6-13(5-11)9-16/h2-3,11-13H,4-10H2,1H3,(H,18,20)	OLWJJCVFMLQOBB-UHFFFAOYSA-N	Cn1ccnc1SCC(=O)NC23CC4CC(CC(C4)C2)C3	BroadT	BRD-K92724741	BRD-K92724741-001-05-2	Enamine Ltd.	T0506-0821			Cn1ccnc1SCC(=O)NC12CC3CC(CC(C3)C1)C2	InChI=1S/C16H23N3OS/c1-19-3-2-17-15(19)21-10-14(20)18-16-7-11-4-12(8-16)6-13(5-11)9-16/h2-3,11-13H,4-10H2,1H3,(H,18,20)	OLWJJCVFMLQOBB-UHFFFAOYSA-N	305.156183076							116903
AK-968/15252395	LSM-28355	SID24790212, BRD-K52540038	756939	InChI=1S/C17H16FNO2/c18-15-7-3-4-8-16(15)21-12-17(20)19-10-9-13-5-1-2-6-14(13)11-19/h1-8H,9-12H2	YTBNKXZGPDGFHI-UHFFFAOYSA-N	Fc1ccccc1OCC(=O)N2CCc3ccccc3C2	BroadT	BRD-K52540038	BRD-K52540038-001-05-2	Asinex Ltd.	BAS 05986748			Fc1ccccc1OCC(=O)N1CCc2ccccc2C1	InChI=1S/C17H16FNO2/c18-15-7-3-4-8-16(15)21-12-17(20)19-10-9-13-5-1-2-6-14(13)11-19/h1-8H,9-12H2	YTBNKXZGPDGFHI-UHFFFAOYSA-N	285.116506962							116904
STK162442	LSM-44270	SID17510252, BRD-K69361607	6524065	InChI=1S/C21H15F2N3O2/c22-15-7-9-16(10-8-15)25-11-3-5-17(25)12-19-20(27)26(21(28)24-19)13-14-4-1-2-6-18(14)23/h1-12H,13H2,(H,24,28)/b19-12+	NRSLCMVONQCYGR-XDHOZWIPSA-N	Fc1ccc(cc1)n2cccc2\C=C/3\NC(=O)N(Cc4ccccc4F)C3=O	BroadT	BRD-K69361607	BRD-K69361607-001-05-5	ChemDiv Inc.	5762-2380			Fc1ccc(cc1)-n1cccc1\C=C1\NC(=O)N(Cc2ccccc2F)C1=O	InChI=1S/C21H15F2N3O2/c22-15-7-9-16(10-8-15)25-11-3-5-17(25)12-19-20(27)26(21(28)24-19)13-14-4-1-2-6-18(14)23/h1-12H,13H2,(H,24,28)/b19-12+	NRSLCMVONQCYGR-XDHOZWIPSA-N	379.11323315							
ZINC01070630	LSM-28357	SID24794361, BRD-K08773075	1259054	InChI=1S/C16H14BrN3O2/c1-2-3-15(21)19-12-4-5-14-13(7-12)20-16(22-14)10-6-11(17)9-18-8-10/h4-9H,2-3H2,1H3,(H,19,21)	WCGGEMRZKQQJKK-UHFFFAOYSA-N	CCCC(=O)Nc1ccc2oc(nc2c1)c3cncc(Br)c3	BroadT	BRD-K08773075	BRD-K08773075-001-05-8	ChemBridge Corporation	7989233			CCCC(=O)Nc1ccc2oc(nc2c1)-c1cncc(Br)c1	InChI=1S/C16H14BrN3O2/c1-2-3-15(21)19-12-4-5-14-13(7-12)20-16(22-14)10-6-11(17)9-18-8-10/h4-9H,2-3H2,1H3,(H,19,21)	WCGGEMRZKQQJKK-UHFFFAOYSA-N	359.026939318							116906
AC1M6Q9W	LSM-28358	BRD-K85402753	2403394	InChI=1S/C26H24F2N4O4S/c1-15-3-6-19(13-16(15)2)32-21-14-17(23(34)29-10-12-33)9-11-31(21)22(25(32)37)24(35)30-18-4-7-20(8-5-18)36-26(27)28/h3-9,11,13-14,26,33H,10,12H2,1-2H3,(H2-,29,30,34,35,37)/p+1	GJOJUPDTVUNMCX-UHFFFAOYSA-O	Cc1ccc(cc1C)n2c(S)c(C(=O)Nc3ccc(OC(F)F)cc3)[n+]4ccc(cc24)C(=O)NCCO	BroadT	BRD-K85402753	BRD-K85402753-001-07-5	Enamine Ltd.	T0520-2417			Cc1ccc(cc1C)-n1c(S)c(C(=O)Nc2ccc(OC(F)F)cc2)[n+]2ccc(cc12)C(=O)NCCO	InChI=1S/C26H24F2N4O4S/c1-15-3-6-19(13-16(15)2)32-21-14-17(23(34)29-10-12-33)9-11-31(21)22(25(32)37)24(35)30-18-4-7-20(8-5-18)36-26(27)28/h3-9,11,13-14,26,33H,10,12H2,1-2H3,(H2-,29,30,34,35,37)/p+1	GJOJUPDTVUNMCX-UHFFFAOYSA-O	527.15645741							116907
MLS000052063	LSM-28359	SID4265797, BRD-K69827816	2956580	InChI=1S/C23H28ClN3O3/c1-3-15-30-19-8-5-17(6-9-19)23(29)27-13-11-26(12-14-27)21-10-7-18(16-20(21)24)25-22(28)4-2/h5-10,16H,3-4,11-15H2,1-2H3,(H,25,28)	FJLNRDTWGAXPMP-UHFFFAOYSA-N	CCCOc1ccc(cc1)C(=O)N2CCN(CC2)c3ccc(NC(=O)CC)cc3Cl	BroadT	BRD-K69827816	BRD-K69827816-001-05-2	ChemBridge Corporation	7812655			CCCOc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(NC(=O)CC)cc1Cl	InChI=1S/C23H28ClN3O3/c1-3-15-30-19-8-5-17(6-9-19)23(29)27-13-11-26(12-14-27)21-10-7-18(16-20(21)24)25-22(28)4-2/h5-10,16H,3-4,11-15H2,1-2H3,(H,25,28)	FJLNRDTWGAXPMP-UHFFFAOYSA-N	429.181919496							116908
SMR000071577	LSM-28360	SID4264320, BRD-K97698933	1331320	InChI=1S/C22H22N2O3/c1-15-3-8-20-18(13-15)19(22(25)24-9-11-27-12-10-24)14-21(23-20)16-4-6-17(26-2)7-5-16/h3-8,13-14H,9-12H2,1-2H3	DOEHCDRFBSIAMJ-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(C(=O)N3CCOCC3)c4cc(C)ccc4n2	BroadT	BRD-K97698933	BRD-K97698933-001-11-9	ChemBridge Corporation	7086930			COc1ccc(cc1)-c1cc(C(=O)N2CCOCC2)c2cc(C)ccc2n1	InChI=1S/C22H22N2O3/c1-15-3-8-20-18(13-15)19(22(25)24-9-11-27-12-10-24)14-21(23-20)16-4-6-17(26-2)7-5-16/h3-8,13-14H,9-12H2,1-2H3	DOEHCDRFBSIAMJ-UHFFFAOYSA-N	362.163042584							116909
F0018-0060	LSM-28361	SID49640957, BRD-K02251438	733820	InChI=1S/C16H14N2O2S/c1-10-5-6-12(8-11(10)2)13-9-21-16(17-13)18-15(19)14-4-3-7-20-14/h3-9H,1-2H3,(H,17,18,19)	GJNQAOQSUJCTCP-UHFFFAOYSA-N	Cc1ccc(cc1C)c2csc(NC(=O)c3occc3)n2	BroadT	BRD-K02251438	BRD-K02251438-001-05-3	Asinex Ltd.	BAS 07314235			Cc1ccc(cc1C)-c1csc(NC(=O)c2ccco2)n1	InChI=1S/C16H14N2O2S/c1-10-5-6-12(8-11(10)2)13-9-21-16(17-13)18-15(19)14-4-3-7-20-14/h3-9H,1-2H3,(H,17,18,19)	GJNQAOQSUJCTCP-UHFFFAOYSA-N	298.077598398							116910
T5405609	LSM-28362	SID14744189, BRD-K58152686	2618292	InChI=1S/C18H16N4S2/c1-2-22-17(13-8-4-3-5-9-13)20-21-18(22)23-12-16-19-14-10-6-7-11-15(14)24-16/h3-11H,2,12H2,1H3	XNUXHWHEFAEUNK-UHFFFAOYSA-N	CCn1c(SCc2nc3ccccc3s2)nnc1c4ccccc4	BroadT	BRD-K58152686	BRD-K58152686-001-06-3	Enamine Ltd.	ZT-5819657			CCn1c(SCc2nc3ccccc3s2)nnc1-c1ccccc1	InChI=1S/C18H16N4S2/c1-2-22-17(13-8-4-3-5-9-13)20-21-18(22)23-12-16-19-14-10-6-7-11-15(14)24-16/h3-11H,2,12H2,1H3	XNUXHWHEFAEUNK-UHFFFAOYSA-N	352.081637932							116911
MLS000526191	LSM-28363	SID14724701, BRD-A50263896	2802825	InChI=1S/C20H17N3O3/c1-14-12-17(24)23(13-21-14)19(18(25)15-8-4-2-5-9-15)22-20(26)16-10-6-3-7-11-16/h2-13,19H,1H3,(H,22,26)	CBNMUUXYTARFEC-UHFFFAOYSA-N	CC1=CC(=O)N(C=N1)C(NC(=O)c2ccccc2)C(=O)c3ccccc3	BroadT	BRD-A50263896	BRD-A50263896-001-05-6	Asinex Ltd.	BAS 00392651			Cc1cc(=O)n(cn1)C(NC(=O)c1ccccc1)C(=O)c1ccccc1	InChI=1S/C20H17N3O3/c1-14-12-17(24)23(13-21-14)19(18(25)15-8-4-2-5-9-15)22-20(26)16-10-6-3-7-11-16/h2-13,19H,1H3,(H,22,26)	CBNMUUXYTARFEC-UHFFFAOYSA-N	347.126991434							116912
Lobaric acid	LSM-3982	Lobaric-Acid, Lobaric Acid	73157	InChI=1S/C25H28O8/c1-4-6-8-9-15-21(24(28)29)18(27)13-20-23(15)32-19-12-14(31-3)11-16(17(26)10-7-5-2)22(19)25(30)33-20/h11-13,27H,4-10H2,1-3H3,(H,28,29)	JHEWMLHQNRHTQX-UHFFFAOYSA-N	CCCCCc1c2Oc3cc(OC)cc(C(=O)CCCC)c3C(=O)Oc2cc(O)c1C(=O)O	BroadT	BRD-K88849294	BRD-K88849294-001-09-6	InterBioScreen Ltd.	STOCK1N-26239			CCCCCc1c2Oc3cc(OC)cc(C(=O)CCCC)c3C(=O)Oc2cc(O)c1C(O)=O	InChI=1S/C25H28O8/c1-4-6-8-9-15-21(24(28)29)18(27)13-20-23(15)32-19-12-14(31-3)11-16(17(26)10-7-5-2)22(19)25(30)33-20/h11-13,27H,4-10H2,1-3H3,(H,28,29)	JHEWMLHQNRHTQX-UHFFFAOYSA-N	456.178417856							93548
MLS000735488	LSM-28364	SID24786259, BRD-K07077234	16189055	InChI=1S/C21H25N3OS/c25-16-21(9-8-17-4-2-1-3-5-17)10-12-24(13-11-21)15-18-6-7-19-20(14-18)23-26-22-19/h1-7,14,25H,8-13,15-16H2	AAPWYRYSSYTARU-UHFFFAOYSA-N	OCC1(CCc2ccccc2)CCN(Cc3ccc4nsnc4c3)CC1	BroadT	BRD-K07077234	BRD-K07077234-001-05-3	ChemBridge Corporation	31238025			OCC1(CCc2ccccc2)CCN(Cc2ccc3nsnc3c2)CC1	InChI=1S/C21H25N3OS/c25-16-21(9-8-17-4-2-1-3-5-17)10-12-24(13-11-21)15-18-6-7-19-20(14-18)23-26-22-19/h1-7,14,25H,8-13,15-16H2	AAPWYRYSSYTARU-UHFFFAOYSA-N	367.17183314							116913
AH-487/15149240	LSM-44271	SID17415582, BRD-K53087498	1737208	InChI=1S/C19H18ClNO3S/c20-16-5-1-15(2-6-16)12-25-10-9-21-19(22)8-4-14-3-7-17-18(11-14)24-13-23-17/h1-8,11H,9-10,12-13H2,(H,21,22)/b8-4+	XDTDXSUQULVSJL-XBXARRHUSA-N	Clc1ccc(CSCCNC(=O)\C=C\c2ccc3OCOc3c2)cc1	BroadT	BRD-K53087498	BRD-K53087498-001-06-4	ChemBridge Corporation	6384341			Clc1ccc(CSCCNC(=O)\C=C\c2ccc3OCOc3c2)cc1	InChI=1S/C19H18ClNO3S/c20-16-5-1-15(2-6-16)12-25-10-9-21-19(22)8-4-14-3-7-17-18(11-14)24-13-23-17/h1-8,11H,9-10,12-13H2,(H,21,22)/b8-4+	XDTDXSUQULVSJL-XBXARRHUSA-N	375.069591846							
ST50934879	LSM-28366	SID14733812, BRD-K43672748	2168476	InChI=1S/C12H6F5NO2/c1-4-5(2-3-20-4)12(19)18-11-9(16)7(14)6(13)8(15)10(11)17/h2-3H,1H3,(H,18,19)	XCBYXSKHHFELCN-UHFFFAOYSA-N	Cc1occc1C(=O)Nc2c(F)c(F)c(F)c(F)c2F	BroadT	BRD-K43672748	BRD-K43672748-001-05-6	ChemBridge Corporation	7232722			Cc1occc1C(=O)Nc1c(F)c(F)c(F)c(F)c1F	InChI=1S/C12H6F5NO2/c1-4-5(2-3-20-4)12(19)18-11-9(16)7(14)6(13)8(15)10(11)17/h2-3H,1H3,(H,18,19)	XCBYXSKHHFELCN-UHFFFAOYSA-N	291.031869442							131289
MLS000408837	LSM-28367	SID24791838, BRD-K76046852	4595009	InChI=1S/C23H17ClN4O7S/c1-35-17-5-3-16(4-6-17)26-36(33,34)18-7-8-20(21(11-18)28(31)32)27-13-14(12-25-27)23(30)19-10-15(24)2-9-22(19)29/h2-13,26,29H,1H3	MDVQAMMRMRWHPC-UHFFFAOYSA-N	COc1ccc(NS(=O)(=O)c2ccc(c(c2)[N+](=O)[O-])n3cc(cn3)C(=O)c4cc(Cl)ccc4O)cc1	BroadT	BRD-K76046852	BRD-K76046852-001-05-5	Enamine Ltd.	T0512-9084			COc1ccc(NS(=O)(=O)c2ccc(c(c2)[N+]([O-])=O)-n2cc(cn2)C(=O)c2cc(Cl)ccc2O)cc1	InChI=1S/C23H17ClN4O7S/c1-35-17-5-3-16(4-6-17)26-36(33,34)18-7-8-20(21(11-18)28(31)32)27-13-14(12-25-27)23(30)19-10-15(24)2-9-22(19)29/h2-13,26,29H,1H3	MDVQAMMRMRWHPC-UHFFFAOYSA-N	528.050647324							116917
AC1LLC3G	LSM-28368	BRD-K30927752	1082009	InChI=1S/C22H13ClN4O4/c23-16-8-6-14(12-17(16)27(28)29)18-9-7-15(31-18)13-24-22-21(19-4-3-11-30-19)26-10-2-1-5-20(26)25-22/h1-13H	AYBYEPHXICIWIQ-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1Cl)c2oc(C=Nc3nc4ccccn4c3c5occc5)cc2	BroadT	BRD-K30927752	BRD-K30927752-001-05-2	Specs	AG-690/36158020			[O-][N+](=O)c1cc(ccc1Cl)-c1ccc(C=Nc2nc3ccccn3c2-c2ccco2)o1	InChI=1S/C22H13ClN4O4/c23-16-8-6-14(12-17(16)27(28)29)18-9-7-15(31-18)13-24-22-21(19-4-3-11-30-19)26-10-2-1-5-20(26)25-22/h1-13H	AYBYEPHXICIWIQ-UHFFFAOYSA-N	432.062532646							116918
MLS000080812	LSM-28369	SID866129, BRD-K02864397	667388	InChI=1S/C14H9F3N4O3/c1-24-8-4-2-7(3-5-8)9-6-10(14(15,16)17)21-13(18-9)19-11(20-21)12(22)23/h2-6H,1H3,(H,22,23)	DVSYKPQCIYNPSG-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(n3nc(nc3n2)C(=O)O)C(F)(F)F	BroadT	BRD-K02864397	BRD-K02864397-001-05-2	InterBioScreen Ltd.	STOCK5S-60178			COc1ccc(cc1)-c1cc(n2nc(nc2n1)C(O)=O)C(F)(F)F	InChI=1S/C14H9F3N4O3/c1-24-8-4-2-7(3-5-8)9-6-10(14(15,16)17)21-13(18-9)19-11(20-21)12(22)23/h2-6H,1H3,(H,22,23)	DVSYKPQCIYNPSG-UHFFFAOYSA-N	338.062674788							116919
N-[2-(Furan-2-ylmethylsulfanyl)-ethyl]-4-methoxy-benzenesulfonamide	LSM-28370	SID844234, BRD-K13861175	646546	InChI=1S/C14H17NO4S2/c1-18-12-4-6-14(7-5-12)21(16,17)15-8-10-20-11-13-3-2-9-19-13/h2-7,9,15H,8,10-11H2,1H3	USPLJRSUCIQBTC-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)NCCSCc2occc2	BroadT	BRD-K13861175	BRD-K13861175-001-05-3	Asinex Ltd.	BAS 03558551			COc1ccc(cc1)S(=O)(=O)NCCSCc1ccco1	InChI=1S/C14H17NO4S2/c1-18-12-4-6-14(7-5-12)21(16,17)15-8-10-20-11-13-3-2-9-19-13/h2-7,9,15H,8,10-11H2,1H3	USPLJRSUCIQBTC-UHFFFAOYSA-N	327.059899414							116920
1-Benzyl-5-ethyl-1,3,5-triazinane-2-thione	LSM-28371	SID17505968, BRD-K12152993	751669	InChI=1S/C12H17N3S/c1-2-14-9-13-12(16)15(10-14)8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,13,16)	CEOWFRFECJRZCP-UHFFFAOYSA-N	CCN1CN=C(S)N(Cc2ccccc2)C1	BroadT	BRD-K12152993	BRD-K12152993-001-05-8	InterBioScreen Ltd.	STOCK3S-60258			CCN1CN=C(S)N(Cc2ccccc2)C1	InChI=1S/C12H17N3S/c1-2-14-9-13-12(16)15(10-14)8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,13,16)	CEOWFRFECJRZCP-UHFFFAOYSA-N	235.114318264							116921
5-Amino-3-[3-(methylamino)propyl]-1H-pyrazole-4-carbonitrile	LSM-28372	SID3711533, BRD-K97125183	2113258	InChI=1S/C8H13N5/c1-11-4-2-3-7-6(5-9)8(10)13-12-7/h11H,2-4H2,1H3,(H3,10,12,13)	FJYUWIMEBHUCPT-UHFFFAOYSA-N	CNCCCc1n[nH]c(N)c1C#N	BroadT	BRD-K97125183	BRD-K97125183-001-05-2	Enamine Ltd.	T5224624			CNCCCc1n[nH]c(N)c1C#N	InChI=1S/C8H13N5/c1-11-4-2-3-7-6(5-9)8(10)13-12-7/h11H,2-4H2,1H3,(H3,10,12,13)	FJYUWIMEBHUCPT-UHFFFAOYSA-N	179.117095466							116922
SMR000020721	LSM-28373	SID24838665, SID4245622, BRD-K93743095	3240070	InChI=1S/C26H34N6O2S/c1-20-7-8-21(2)32(20)14-11-29-9-12-30(13-10-29)24(33)19-35-26-25(31-15-17-34-18-16-31)27-22-5-3-4-6-23(22)28-26/h3-8H,9-19H2,1-2H3	SYHDAUHOTVVALH-UHFFFAOYSA-N	Cc1ccc(C)n1CCN2CCN(CC2)C(=O)CSc3nc4ccccc4nc3N5CCOCC5	BroadT	BRD-K93743095	BRD-K93743095-001-05-3	ChemDiv Inc.	7472-0163			Cc1ccc(C)n1CCN1CCN(CC1)C(=O)CSc1nc2ccccc2nc1N1CCOCC1	InChI=1S/C26H34N6O2S/c1-20-7-8-21(2)32(20)14-11-29-9-12-30(13-10-29)24(33)19-35-26-25(31-15-17-34-18-16-31)27-22-5-3-4-6-23(22)28-26/h3-8H,9-19H2,1-2H3	SYHDAUHOTVVALH-UHFFFAOYSA-N	494.246395078							116923
654-49-9	LSM-28374	SID14727715, BRD-K43920517	247440	InChI=1S/C8H5F3N2O/c1-4-2-6(8(9,10)11)5(3-12)7(14)13-4/h2H,1H3,(H,13,14)	IMPQPQKUDMOZHV-UHFFFAOYSA-N	Cc1cc(c(C#N)c(O)n1)C(F)(F)F	BroadT	BRD-K43920517	BRD-K43920517-001-05-8	Specs	AI-204/31702007			Cc1cc(c(C#N)c(O)n1)C(F)(F)F	InChI=1S/C8H5F3N2O/c1-4-2-6(8(9,10)11)5(3-12)7(14)13-4/h2H,1H3,(H,13,14)	IMPQPQKUDMOZHV-UHFFFAOYSA-N	202.0353974							116924
SMR000153860	LSM-28375	SID14744830, BRD-K69855419	4878574	InChI=1S/C20H18N4O3/c1-23-16-18(21-17(23)14-8-10-15(27-2)11-9-14)24(20(26)22-19(16)25)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,22,25,26)	LEOPPMHUMJRAHV-UHFFFAOYSA-N	COc1ccc(cc1)c2nc3N(Cc4ccccc4)C(=O)NC(=O)c3n2C	BroadT	BRD-K69855419	BRD-K69855419-001-05-4	Enamine Ltd.	T5311551			COc1ccc(cc1)-c1nc2n(Cc3ccccc3)c(=O)[nH]c(=O)c2n1C	InChI=1S/C20H18N4O3/c1-23-16-18(21-17(23)14-8-10-15(27-2)11-9-14)24(20(26)22-19(16)25)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,22,25,26)	LEOPPMHUMJRAHV-UHFFFAOYSA-N	362.137890476							116925
MLS000674129	LSM-28376	SID24795948, BRD-A29485854	2985590	InChI=1S/C14H12FN3S2/c1-9(10-4-6-11(15)7-5-10)18-13(16-17-14(18)19)12-3-2-8-20-12/h2-9H,1H3,(H,17,19)	BONCYRDOUOIJMP-UHFFFAOYSA-N	CC(c1ccc(F)cc1)n2c(S)nnc2c3cccs3	BroadT	BRD-A29485854	BRD-A29485854-001-06-1	ChemBridge Corporation	7993651			CC(c1ccc(F)cc1)n1c(S)nnc1-c1cccs1	InChI=1S/C14H12FN3S2/c1-9(10-4-6-11(15)7-5-10)18-13(16-17-14(18)19)12-3-2-8-20-12/h2-9H,1H3,(H,17,19)	BONCYRDOUOIJMP-UHFFFAOYSA-N	305.045666994							116926
AC1MYS5N	LSM-28377	SID22408581, BRD-A86343374	3886666	InChI=1S/C13H9Cl2N3O5S/c1-6(12(19)17-11-8(15)4-7(14)5-16-11)23-13(20)9-2-3-10(24-9)18(21)22/h2-6H,1H3,(H,16,17,19)	DIBFLKMIZGLNLP-UHFFFAOYSA-N	CC(OC(=O)c1ccc(s1)[N+](=O)[O-])C(=O)Nc2ncc(Cl)cc2Cl	BroadT	BRD-A86343374	BRD-A86343374-001-06-3	Enamine Ltd.	T5237077			CC(OC(=O)c1ccc(s1)[N+]([O-])=O)C(=O)Nc1ncc(Cl)cc1Cl	InChI=1S/C13H9Cl2N3O5S/c1-6(12(19)17-11-8(15)4-7(14)5-16-11)23-13(20)9-2-3-10(24-9)18(21)22/h2-6H,1H3,(H,16,17,19)	DIBFLKMIZGLNLP-UHFFFAOYSA-N	388.963996528							116927
SMR000186987	LSM-28378	SID17412513, BRD-A52257281	2866159	InChI=1S/C19H17Cl2NO2/c20-15-12-16(19(23)17(21)13-15)18(22-8-10-24-11-9-22)7-6-14-4-2-1-3-5-14/h1-5,12-13,18,23H,8-11H2	QGHJGOPNFRNBTB-UHFFFAOYSA-N	Oc1c(Cl)cc(Cl)cc1C(C#Cc2ccccc2)N3CCOCC3	BroadT	BRD-A52257281	BRD-A52257281-001-06-7	ChemBridge Corporation	5742969			Oc1c(Cl)cc(Cl)cc1C(C#Cc1ccccc1)N1CCOCC1	InChI=1S/C19H17Cl2NO2/c20-15-12-16(19(23)17(21)13-15)18(22-8-10-24-11-9-22)7-6-14-4-2-1-3-5-14/h1-5,12-13,18,23H,8-11H2	QGHJGOPNFRNBTB-UHFFFAOYSA-N	361.063634214							116928
MLS000806994	LSM-44272	SID26726271, BRD-K52531882	1608030	InChI=1S/C20H15NO3S2/c1-13(11-14-5-3-2-4-6-14)12-17-18(22)21(20(25)26-17)16-9-7-15(8-10-16)19(23)24/h2-12H,1H3,(H,23,24)/b13-11+,17-12-	RDOICLHGZLWRBO-YMGXUNRSSA-N	C\C(=C/c1ccccc1)\C=C\2/SC(=S)N(C2=O)c3ccc(cc3)C(=O)O	BroadT	BRD-K52531882	BRD-K52531882-001-05-8	InterBioScreen Ltd.	STOCK3S-68470			CC(=C/c1ccccc1)\C=C1/SC(=S)N(C1=O)c1ccc(cc1)C(O)=O	InChI=1S/C20H15NO3S2/c1-13(11-14-5-3-2-4-6-14)12-17-18(22)21(20(25)26-17)16-9-7-15(8-10-16)19(23)24/h2-12H,1H3,(H,23,24)/b13-11+,17-12-	RDOICLHGZLWRBO-YMGXUNRSSA-N	381.04933473							
SMR000185739	LSM-44273	SID17413787, BRD-K74558312	5339342	InChI=1S/C19H21NO2/c1-12(2)16-8-5-15(6-9-16)7-10-17(21)18-13(3)11-14(4)20-19(18)22/h5-12H,1-4H3,(H,20,22)/b10-7+	YWQPLNUSTKUJNA-JXMROGBWSA-N	CC(C)c1ccc(\C=C\C(=O)c2c(C)cc(C)nc2O)cc1	BroadT	BRD-K74558312	BRD-K74558312-001-06-3	ChemBridge Corporation	5401243			CC(C)c1ccc(cc1)\C=C\C(=O)c1c(C)cc(C)nc1O	InChI=1S/C19H21NO2/c1-12(2)16-8-5-15(6-9-16)7-10-17(21)18-13(3)11-14(4)20-19(18)22/h5-12H,1-4H3,(H,20,22)/b10-7+	YWQPLNUSTKUJNA-JXMROGBWSA-N	295.157228922							
AC1N0AOA	LSM-28381	SID24833058, BRD-A96290944	3959870	InChI=1S/C19H26N4O4S/c1-15-12-23(13-16(2)27-15)28(25,26)18-6-4-17(5-7-18)19(24)21-8-3-10-22-11-9-20-14-22/h4-7,9,11,14-16H,3,8,10,12-13H2,1-2H3,(H,21,24)	XZRLCYJDDBDQPV-UHFFFAOYSA-N	CC1CN(CC(C)O1)S(=O)(=O)c2ccc(cc2)C(=O)NCCCn3ccnc3	BroadT	BRD-A96290944	BRD-A96290944-001-08-1	Enamine Ltd.	T0515-7464			CC1CN(CC(C)O1)S(=O)(=O)c1ccc(cc1)C(=O)NCCCn1ccnc1	InChI=1S/C19H26N4O4S/c1-15-12-23(13-16(2)27-15)28(25,26)18-6-4-17(5-7-18)19(24)21-8-3-10-22-11-9-20-14-22/h4-7,9,11,14-16H,3,8,10,12-13H2,1-2H3,(H,21,24)	XZRLCYJDDBDQPV-UHFFFAOYSA-N	406.167476042							131290
MLS000529506	LSM-28382	SID14727259, BRD-A79843598	3229350	InChI=1S/C23H26N6S/c1-23(2,3)29-22(25-26-27-29)21(19-11-7-13-24-15-19)28(17-20-12-8-14-30-20)16-18-9-5-4-6-10-18/h4-15,21H,16-17H2,1-3H3	SGYJJYITWMLWJY-UHFFFAOYSA-N	CC(C)(C)n1nnnc1C(N(Cc2ccccc2)Cc3cccs3)c4cccnc4	BroadT	BRD-A79843598	BRD-A79843598-001-05-3	Asinex Ltd.	ASN 07887310			CC(C)(C)n1nnnc1C(N(Cc1cccs1)Cc1ccccc1)c1cccnc1	InChI=1S/C23H26N6S/c1-23(2,3)29-22(25-26-27-29)21(19-11-7-13-24-15-19)28(17-20-12-8-14-30-20)16-18-9-5-4-6-10-18/h4-15,21H,16-17H2,1-3H3	SGYJJYITWMLWJY-UHFFFAOYSA-N	418.193965582							116933
SMR000021884	LSM-28383	SID24838833, SID4244696, BRD-A59265510	3239263	InChI=1S/C25H31N3O6/c1-32-18-7-6-17(22(33-2)23(18)34-3)13-26-8-10-27(11-9-26)19(29)14-28-24(30)20-15-4-5-16(12-15)21(20)25(28)31/h4-7,15-16,20-21H,8-14H2,1-3H3	IPEBOPRSUQGGPH-UHFFFAOYSA-N	COc1ccc(CN2CCN(CC2)C(=O)CN3C(=O)C4C5CC(C=C5)C4C3=O)c(OC)c1OC	BroadT	BRD-A59265510	BRD-A59265510-001-05-8	ChemDiv Inc.	C082-0049			COc1ccc(CN2CCN(CC2)C(=O)CN2C(=O)C3C4CC(C=C4)C3C2=O)c(OC)c1OC	InChI=1S/C25H31N3O6/c1-32-18-7-6-17(22(33-2)23(18)34-3)13-26-8-10-27(11-9-26)19(29)14-28-24(30)20-15-4-5-16(12-15)21(20)25(28)31/h4-7,15-16,20-21H,8-14H2,1-3H3	IPEBOPRSUQGGPH-UHFFFAOYSA-N	469.221285742							116934
AC1LDCOS	LSM-28384	SID863672, BRD-A76870143	664927	InChI=1S/C23H24N2O4/c1-15-5-7-18(8-6-15)25(23(27)21-4-3-11-29-21)14-17-12-16-13-19(28-2)9-10-20(16)24-22(17)26/h5-10,12-13,21H,3-4,11,14H2,1-2H3,(H,24,26)	DRLFLUODRXODNK-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(C(=O)C3CCCO3)c4ccc(C)cc4)cc2c1	BroadT	BRD-A76870143	BRD-A76870143-001-05-9	InterBioScreen Ltd.	STOCK4S-85644			COc1ccc2nc(O)c(CN(C(=O)C3CCCO3)c3ccc(C)cc3)cc2c1	InChI=1S/C23H24N2O4/c1-15-5-7-18(8-6-15)25(23(27)21-4-3-11-29-21)14-17-12-16-13-19(28-2)9-10-20(16)24-22(17)26/h5-10,12-13,21H,3-4,11,14H2,1-2H3,(H,24,26)	DRLFLUODRXODNK-UHFFFAOYSA-N	392.173607268							116935
2,6-Diamino-4-(1-phenylethyl)-4H-thiopyran-3,5-dicarbonitrile	LSM-28385	SID844046, BRD-A02033528	646356	InChI=1S/C15H14N4S/c1-9(10-5-3-2-4-6-10)13-11(7-16)14(18)20-15(19)12(13)8-17/h2-6,9,13H,18-19H2,1H3	NOCKQMOIGSIBGQ-UHFFFAOYSA-N	CC(C1C(=C(N)SC(=C1C#N)N)C#N)c2ccccc2	BroadT	BRD-A02033528	BRD-A02033528-001-05-8	Asinex Ltd.	BAS 00865210			CC(C1C(C#N)=C(N)SC(N)=C1C#N)c1ccccc1	InChI=1S/C15H14N4S/c1-9(10-5-3-2-4-6-10)13-11(7-16)14(18)20-15(19)12(13)8-17/h2-6,9,13H,18-19H2,1H3	NOCKQMOIGSIBGQ-UHFFFAOYSA-N	282.093917178							116936
AC1MQF82	LSM-28386	BRD-K55971440	3500834	InChI=1S/C23H24F2N4O3/c1-23(2,3)21-11-18(27-28-21)22(30)29-26-12-14-5-7-19(31-4)15(9-14)13-32-20-8-6-16(24)10-17(20)25/h5-12H,13H2,1-4H3,(H,27,28)(H,29,30)	XQONTDLMUPBAQO-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)c2cc([nH]n2)C(C)(C)C)cc1COc3ccc(F)cc3F	BroadT	BRD-K55971440	BRD-K55971440-001-06-6	ChemDiv Inc.	K089-0132			COc1ccc(C=NNC(=O)c2cc([nH]n2)C(C)(C)C)cc1COc1ccc(F)cc1F	InChI=1S/C23H24F2N4O3/c1-23(2,3)21-11-18(27-28-21)22(30)29-26-12-14-5-7-19(31-4)15(9-14)13-32-20-8-6-16(24)10-17(20)25/h5-12H,13H2,1-4H3,(H,27,28)(H,29,30)	XQONTDLMUPBAQO-UHFFFAOYSA-N	442.181647068							116937
AC1NP5JL	LSM-28387	BRD-K86221339	5124601	InChI=1S/C10H11Cl2N3S/c1-15(2)6-13-10(16)14-7-3-4-8(11)9(12)5-7/h3-6H,1-2H3,(H,14,16)	LTGRZTUZJVLSQM-UHFFFAOYSA-N	CN(C)C=NC(=Nc1ccc(Cl)c(Cl)c1)S	BroadT	BRD-K86221339	BRD-K86221339-001-05-5	Key Organics Ltd.	8D-070			CN(C)C=NC(S)=Nc1ccc(Cl)c(Cl)c1	InChI=1S/C10H11Cl2N3S/c1-15(2)6-13-10(16)14-7-3-4-8(11)9(12)5-7/h3-6H,1-2H3,(H,14,16)	LTGRZTUZJVLSQM-UHFFFAOYSA-N	275.005073492							116938
MLS000391847	LSM-28388	SID22409593, BRD-A58898935	3484134	InChI=1S/C20H23Cl2N3O2/c1-14(23-20(26)24-16-7-8-17(21)18(22)13-16)19(15-5-3-2-4-6-15)25-9-11-27-12-10-25/h2-8,13-14,19H,9-12H2,1H3,(H2,23,24,26)	WJMIMXYRGJRXJX-UHFFFAOYSA-N	CC(NC(=O)Nc1ccc(Cl)c(Cl)c1)C(N2CCOCC2)c3ccccc3	BroadT	BRD-A58898935	BRD-A58898935-001-05-4	Enamine Ltd.	T0504-6635			CC(NC(=O)Nc1ccc(Cl)c(Cl)c1)C(N1CCOCC1)c1ccccc1	InChI=1S/C20H23Cl2N3O2/c1-14(23-20(26)24-16-7-8-17(21)18(22)13-16)19(15-5-3-2-4-6-15)25-9-11-27-12-10-25/h2-8,13-14,19H,9-12H2,1H3,(H2,23,24,26)	WJMIMXYRGJRXJX-UHFFFAOYSA-N	407.116732426							116939
T0515-9452	LSM-28389	SID24791878, BRD-A24460481	4325512	InChI=1S/C26H20N6O4/c1-15-22-23(16-6-5-7-19(14-16)36-2)30-21-9-4-3-8-20(21)27-26(33)25(30)28-24(22)31(29-15)17-10-12-18(13-11-17)32(34)35/h3-14,23H,1-2H3,(H,27,33)	VHHIKDBIOJWYMH-UHFFFAOYSA-N	COc1cccc(c1)C2N3C(=Nc4c2c(C)nn4c5ccc(cc5)[N+](=O)[O-])C(=O)Nc6ccccc36	BroadT	BRD-A24460481	BRD-A24460481-001-06-0	Enamine Ltd.	T0515-9452			COc1cccc(c1)C1N2C(=Nc3c1c(C)nn3-c1ccc(cc1)[N+]([O-])=O)C(=O)Nc1ccccc21	InChI=1S/C26H20N6O4/c1-15-22-23(16-6-5-7-19(14-16)36-2)30-21-9-4-3-8-20(21)27-26(33)25(30)28-24(22)31(29-15)17-10-12-18(13-11-17)32(34)35/h3-14,23H,1-2H3,(H,27,33)	VHHIKDBIOJWYMH-UHFFFAOYSA-N	480.15460318							116940
MLS000807185	LSM-28390	SID24832320, BRD-K19612174	2441420	InChI=1S/C13H10N4OS/c1-8-16-17-13(19-8)15-12(18)11-7-6-9-4-2-3-5-10(9)14-11/h2-7H,1H3,(H,15,17,18)	SBAUBKNEBHOUIA-UHFFFAOYSA-N	Cc1nnc(NC(=O)c2ccc3ccccc3n2)s1	BroadT	BRD-K19612174	BRD-K19612174-001-05-5	Enamine Ltd.	T5306597			Cc1nnc(NC(=O)c2ccc3ccccc3n2)s1	InChI=1S/C13H10N4OS/c1-8-16-17-13(19-8)15-12(18)11-7-6-9-4-2-3-5-10(9)14-11/h2-7H,1H3,(H,15,17,18)	SBAUBKNEBHOUIA-UHFFFAOYSA-N	270.05753167							116941
1-(4-Bromophenyl)-3-(3-methylbutyl)thiourea	LSM-28391	SID17414761, BRD-K62469681	1320694	InChI=1S/C12H17BrN2S/c1-9(2)7-8-14-12(16)15-11-5-3-10(13)4-6-11/h3-6,9H,7-8H2,1-2H3,(H2,14,15,16)	RLFJFXJUHLAJGX-UHFFFAOYSA-N	CC(C)CCN=C(S)Nc1ccc(Br)cc1	BroadT	BRD-K62469681	BRD-K62469681-001-05-2	ChemBridge Corporation	7133230			CC(C)CCN=C(S)Nc1ccc(Br)cc1	InChI=1S/C12H17BrN2S/c1-9(2)7-8-14-12(16)15-11-5-3-10(13)4-6-11/h3-6,9H,7-8H2,1-2H3,(H2,14,15,16)	RLFJFXJUHLAJGX-UHFFFAOYSA-N	300.029581854							116942
5-Amino-3-ethyl-1-phenyl-1H-pyrazole-4-carbonitrile	LSM-28392	SID22403538, BRD-K95870060	899879	InChI=1S/C12H12N4/c1-2-11-10(8-13)12(14)16(15-11)9-6-4-3-5-7-9/h3-7H,2,14H2,1H3	LTRKZIXDSRFKLT-UHFFFAOYSA-N	CCc1nn(c(N)c1C#N)c2ccccc2	BroadT	BRD-K95870060	BRD-K95870060-001-05-3	Specs	AG-826/13532003			CCc1nn(c(N)c1C#N)-c1ccccc1	InChI=1S/C12H12N4/c1-2-11-10(8-13)12(14)16(15-11)9-6-4-3-5-7-9/h3-7H,2,14H2,1H3	LTRKZIXDSRFKLT-UHFFFAOYSA-N	212.106196424							116943
F0912-4068	LSM-28393	SID4243539, BRD-A69006737	3238248	InChI=1S/C25H23N5O4/c1-15-2-4-17(5-3-15)22-21-20(19(14-26)23(27)34-24(21)29-28-22)16-6-8-18(9-7-16)33-25(31)30-10-12-32-13-11-30/h2-9,20H,10-13,27H2,1H3,(H,28,29)	JNPCRCODXQBALQ-UHFFFAOYSA-N	Cc1ccc(cc1)c2[nH]nc3OC(=C(C#N)C(c4ccc(OC(=O)N5CCOCC5)cc4)c23)N	BroadT	BRD-A69006737	BRD-A69006737-001-06-9	ChemDiv Inc.	K638-0081			Cc1ccc(cc1)-c1[nH]nc2OC(N)=C(C#N)C(c12)c1ccc(OC(=O)N2CCOCC2)cc1	InChI=1S/C25H23N5O4/c1-15-2-4-17(5-3-15)22-21-20(19(14-26)23(27)34-24(21)29-28-22)16-6-8-18(9-7-16)33-25(31)30-10-12-32-13-11-30/h2-9,20H,10-13,27H2,1H3,(H,28,29)	JNPCRCODXQBALQ-UHFFFAOYSA-N	457.175004266							116944
SMR000121056	LSM-28394	SID14726468, BRD-K89582314	1441832	InChI=1S/C24H24ClN7/c25-18-5-3-4-17(14-18)21-15-22-28-20-7-2-1-6-19(20)24(32(22)29-21)31-12-10-30(11-13-31)23-16-26-8-9-27-23/h3-5,8-9,14-16H,1-2,6-7,10-13H2	OGFCBIAVPJCCDX-UHFFFAOYSA-N	Clc1cccc(c1)c2cc3nc4CCCCc4c(N5CCN(CC5)c6cnccn6)n3n2	BroadT	BRD-K89582314	BRD-K89582314-001-06-4	Asinex Ltd.	ASN 08737484			Clc1cccc(c1)-c1cc2nc3CCCCc3c(N3CCN(CC3)c3cnccn3)n2n1	InChI=1S/C24H24ClN7/c25-18-5-3-4-17(14-18)21-15-22-28-20-7-2-1-6-19(20)24(32(22)29-21)31-12-10-30(11-13-31)23-16-26-8-9-27-23/h3-5,8-9,14-16H,1-2,6-7,10-13H2	OGFCBIAVPJCCDX-UHFFFAOYSA-N	445.178171548							116945
STK113754	LSM-15579	BRD-A32575745	656308	InChI=1S/C23H30N2O3/c1-18(26)15-24-23(27)21-11-13-25(14-12-21)16-19-7-9-22(10-8-19)28-17-20-5-3-2-4-6-20/h2-10,18,21,26H,11-17H2,1H3,(H,24,27)	PZMYTSMOBROBFO-UHFFFAOYSA-N	CC(O)CNC(=O)C1CCN(Cc2ccc(OCc3ccccc3)cc2)CC1	BroadT	BRD-A32575745	BRD-A32575745-034-06-8	Asinex Ltd.	BAS 11101318		OC(=O)C(=O)O	CC(O)CNC(=O)C1CCN(Cc2ccc(OCc3ccccc3)cc2)CC1.OC(=O)C(=O)O	InChI=1S/C23H30N2O3.C2H2O4/c1-18(26)15-24-23(27)21-11-13-25(14-12-21)16-19-7-9-22(10-8-19)28-17-20-5-3-2-4-6-20;3-1(4)2(5)6/h2-10,18,21,26H,11-17H2,1H3,(H,24,27);(H,3,4)(H,5,6)	LWJVZQHOAPJZGB-UHFFFAOYSA-N	382.22564284							104215, 104215
ZINC00151948	LSM-15429	BRD-K50947019	735553	InChI=1S/C14H11N7S/c1-2-5-12(6-3-1)21-14(17-18-19-21)22-10-11-9-20-8-4-7-15-13(20)16-11/h1-9H,10H2	XBIRJEIWYOSQBA-UHFFFAOYSA-N	C(Sc1nnnn1c2ccccc2)c3cn4cccnc4n3	BroadT	BRD-K50947019	BRD-K50947019-003-06-8	Enamine Ltd.	T0500-7424		Cl	C(Sc1nnnn1-c1ccccc1)c1cn2cccnc2n1.Cl	InChI=1S/C14H11N7S.ClH/c1-2-5-12(6-3-1)21-14(17-18-19-21)22-10-11-9-20-8-4-7-15-13(20)16-11;/h1-9H,10H2;1H	IVUZMCDTJRYYGD-UHFFFAOYSA-N	309.079664112							104071, 104071
N-(2-Methoxyphenyl)-6-(3-methyl-1-benzofuran-2-yl)-1,3,5-triazine-2,4-diamine	LSM-28395	SID14736690, BRD-K18270329	1248279	InChI=1S/C19H17N5O2/c1-11-12-7-3-5-9-14(12)26-16(11)17-22-18(20)24-19(23-17)21-13-8-4-6-10-15(13)25-2/h3-10H,1-2H3,(H3,20,21,22,23,24)	IKJLLENRNMKXGA-UHFFFAOYSA-N	COc1ccccc1Nc2nc(N)nc(n2)c3oc4ccccc4c3C	BroadT	BRD-K18270329	BRD-K18270329-001-06-5	ChemBridge Corporation	7929385			COc1ccccc1Nc1nc(N)nc(n1)-c1oc2ccccc2c1C	InChI=1S/C19H17N5O2/c1-11-12-7-3-5-9-14(12)26-16(11)17-22-18(20)24-19(23-17)21-13-8-4-6-10-15(13)25-2/h3-10H,1-2H3,(H3,20,21,22,23,24)	IKJLLENRNMKXGA-UHFFFAOYSA-N	347.138224834							116946
MLS000684306	LSM-44274	SID24780771, BRD-K16719968	5346271	InChI=1S/C20H22O5/c1-5-25-16-9-7-15(8-10-16)17(21)11-6-14-12-18(22-2)20(24-4)19(13-14)23-3/h6-13H,5H2,1-4H3/b11-6+	UFRWYJPCKJQGLO-IZZDOVSWSA-N	CCOc1ccc(cc1)C(=O)\C=C\c2cc(OC)c(OC)c(OC)c2	BroadT	BRD-K16719968	BRD-K16719968-001-11-9	ChemBridge Corporation	6017260			CCOc1ccc(cc1)C(=O)\C=C\c1cc(OC)c(OC)c(OC)c1	InChI=1S/C20H22O5/c1-5-25-16-9-7-15(8-10-16)17(21)11-6-14-12-18(22-2)20(24-4)19(13-14)23-3/h6-13H,5H2,1-4H3/b11-6+	UFRWYJPCKJQGLO-IZZDOVSWSA-N	342.146723804							
T5426895	LSM-28397	SID852217, BRD-K96727678	654829	InChI=1S/C19H18N2O5S/c1-25-14-8-10-16(11-9-14)27(23,24)21-18-7-3-2-6-17(18)19(22)20-13-15-5-4-12-26-15/h2-12,21H,13H2,1H3,(H,20,22)	UUZROGUPWOOGJA-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccccc2C(=O)NCc3occc3	BroadT	BRD-K96727678	BRD-K96727678-001-06-6	Asinex Ltd.	BAS 06739059			COc1ccc(cc1)S(=O)(=O)Nc1ccccc1C(=O)NCc1ccco1	InChI=1S/C19H18N2O5S/c1-25-14-8-10-16(11-9-14)27(23,24)21-18-7-3-2-6-17(18)19(22)20-13-15-5-4-12-26-15/h2-12,21H,13H2,1H3,(H,20,22)	UUZROGUPWOOGJA-UHFFFAOYSA-N	386.093642386							116948
SMR000031752	LSM-28398	SID4249372, BRD-K28575960	3243334	InChI=1S/C19H24N2O3/c1-4-21(16-9-6-5-7-10-16)12-8-11-20-19(23)18-14(2)13-17(22)24-15(18)3/h5-7,9-10,13H,4,8,11-12H2,1-3H3,(H,20,23)	JQSPHHMGUFYDRZ-UHFFFAOYSA-N	CCN(CCCNC(=O)C1=C(C)OC(=O)C=C1C)c2ccccc2	BroadT	BRD-K28575960	BRD-K28575960-001-05-1	ChemDiv Inc.	K784-7339			CCN(CCCNC(=O)c1c(C)cc(=O)oc1C)c1ccccc1	InChI=1S/C19H24N2O3/c1-4-21(16-9-6-5-7-10-16)12-8-11-20-19(23)18-14(2)13-17(22)24-15(18)3/h5-7,9-10,13H,4,8,11-12H2,1-3H3,(H,20,23)	JQSPHHMGUFYDRZ-UHFFFAOYSA-N	328.178692648							116949
AQ-390/42869069	LSM-28399	SID22414514, BRD-K43143849	982778	InChI=1S/C26H21N3O5S/c1-3-28-22-13-14-23(20-7-4-8-21(24(20)22)26(28)31)35(32,33)29(18-9-11-19(34-2)12-10-18)25(30)17-6-5-15-27-16-17/h4-16H,3H2,1-2H3	YXFFAZSPDIXFRC-UHFFFAOYSA-N	CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)N(C(=O)c4cccnc4)c5ccc(OC)cc5	BroadT	BRD-K43143849	BRD-K43143849-001-05-6	Specs	AQ-390/42869069			CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)N(C(=O)c1cccnc1)c1ccc(OC)cc1	InChI=1S/C26H21N3O5S/c1-3-28-22-13-14-23(20-7-4-8-21(24(20)22)26(28)31)35(32,33)29(18-9-11-19(34-2)12-10-18)25(30)17-6-5-15-27-16-17/h4-16H,3H2,1-2H3	YXFFAZSPDIXFRC-UHFFFAOYSA-N	487.120191492							116950
5-[(4-Methylphenoxy)methyl]-3-phenyl-1,2,4-oxadiazole	LSM-28400	SID24810396, BRD-K70622456	912623	InChI=1S/C16H14N2O2/c1-12-7-9-14(10-8-12)19-11-15-17-16(18-20-15)13-5-3-2-4-6-13/h2-10H,11H2,1H3	QXOWFMYRZSTHIB-UHFFFAOYSA-N	Cc1ccc(OCc2onc(n2)c3ccccc3)cc1	BroadT	BRD-K70622456	BRD-K70622456-001-05-9	ChemDiv Inc.	6687-0190			Cc1ccc(OCc2nc(no2)-c2ccccc2)cc1	InChI=1S/C16H14N2O2/c1-12-7-9-14(10-8-12)19-11-15-17-16(18-20-15)13-5-3-2-4-6-13/h2-10H,11H2,1H3	QXOWFMYRZSTHIB-UHFFFAOYSA-N	266.105527708							116951
SMR000104712	LSM-28401	SID7973809, BRD-K80054646	1081951	InChI=1S/C20H22N2O6S/c1-2-28-20(24)15-6-8-17(9-7-15)21-19(23)16-4-3-5-18(14-16)29(25,26)22-10-12-27-13-11-22/h3-9,14H,2,10-13H2,1H3,(H,21,23)	RSSPJPHEDLPYAN-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)c2cccc(c2)S(=O)(=O)N3CCOCC3)cc1	BroadT	BRD-K80054646	BRD-K80054646-001-05-4	ChemBridge Corporation	5921758			CCOC(=O)c1ccc(NC(=O)c2cccc(c2)S(=O)(=O)N2CCOCC2)cc1	InChI=1S/C20H22N2O6S/c1-2-28-20(24)15-6-8-17(9-7-15)21-19(23)16-4-3-5-18(14-16)29(25,26)22-10-12-27-13-11-22/h3-9,14H,2,10-13H2,1H3,(H,21,23)	RSSPJPHEDLPYAN-UHFFFAOYSA-N	418.119857134							116952
AC1LR54G	LSM-28402	SID26670859, BRD-K86514126	1417926	InChI=1S/C24H22BrNO4/c25-21-15-17(16-30-23(21)28)22(27)26-13-11-20(12-14-26)24(29,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-10,15-16,20,29H,11-14H2	TYWGSOVENKEVHU-UHFFFAOYSA-N	OC(C1CCN(CC1)C(=O)C2=COC(=O)C(=C2)Br)(c3ccccc3)c4ccccc4	BroadT	BRD-K86514126	BRD-K86514126-001-05-0	InterBioScreen Ltd.	STOCK3S-21629			OC(C1CCN(CC1)C(=O)c1coc(=O)c(Br)c1)(c1ccccc1)c1ccccc1	InChI=1S/C24H22BrNO4/c25-21-15-17(16-30-23(21)28)22(27)26-13-11-20(12-14-26)24(29,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-10,15-16,20,29H,11-14H2	TYWGSOVENKEVHU-UHFFFAOYSA-N	467.073220794							116953
AMBCB44976613	LSM-28403	SID49718482, BRD-K74055923	24790206	InChI=1S/C19H23ClN2O3/c1-13-9-15(10-14(2)18(13)20)24-12-16-11-17(21-25-16)19(23)22-7-5-3-4-6-8-22/h9-11H,3-8,12H2,1-2H3	XBOLVMCYOWDKMP-UHFFFAOYSA-N	Cc1cc(OCc2onc(c2)C(=O)N3CCCCCC3)cc(C)c1Cl	BroadT	BRD-K74055923	BRD-K74055923-001-05-3	ChemBridge Corporation	44976613			Cc1cc(OCc2cc(no2)C(=O)N2CCCCCC2)cc(C)c1Cl	InChI=1S/C19H23ClN2O3/c1-13-9-15(10-14(2)18(13)20)24-12-16-11-17(21-25-16)19(23)22-7-5-3-4-6-8-22/h9-11H,3-8,12H2,1-2H3	XBOLVMCYOWDKMP-UHFFFAOYSA-N	362.139720326							116954
T5301152	LSM-28404	SID14747161, BRD-A69017397	4876881	InChI=1S/C20H23ClN4O3/c1-6-28-19(26)16-13(4)24(5)20(27)22-17(16)15-12(3)23-25(18(15)21)14-9-7-11(2)8-10-14/h7-10,17H,6H2,1-5H3,(H,22,27)	YFXVGDYPQPJOFR-UHFFFAOYSA-N	CCOC(=O)C1=C(C)N(C)C(=O)NC1c2c(C)nn(c2Cl)c3ccc(C)cc3	BroadT	BRD-A69017397	BRD-A69017397-001-05-9	Enamine Ltd.	T5301152			CCOC(=O)C1=C(C)N(C)C(=O)NC1c1c(C)nn(c1Cl)-c1ccc(C)cc1	InChI=1S/C20H23ClN4O3/c1-6-28-19(26)16-13(4)24(5)20(27)22-17(16)15-12(3)23-25(18(15)21)14-9-7-11(2)8-10-14/h7-10,17H,6H2,1-5H3,(H,22,27)	YFXVGDYPQPJOFR-UHFFFAOYSA-N	402.145868346							116955
STK247594	LSM-28405	SID842307, BRD-K59223528	644566	InChI=1S/C15H10ClNO2/c1-9-6-7-10(8-13(9)16)17-14(18)11-4-2-3-5-12(11)15(17)19/h2-8H,1H3	QSBKETHUHHJHCB-UHFFFAOYSA-N	Cc1ccc(cc1Cl)N2C(=O)c3ccccc3C2=O	BroadT	BRD-K59223528	BRD-K59223528-001-05-5	Asinex Ltd.	BAS 00920120			Cc1ccc(cc1Cl)N1C(=O)c2ccccc2C1=O	InChI=1S/C15H10ClNO2/c1-9-6-7-10(8-13(9)16)17-14(18)11-4-2-3-5-12(11)15(17)19/h2-8H,1H3	QSBKETHUHHJHCB-UHFFFAOYSA-N	271.04000628							116956
4,6,8-Trimethyl-quinoline-2-thiol	LSM-28406	SID16952819, BRD-K93190824	2442311	InChI=1S/C12H13NS/c1-7-4-9(3)12-10(5-7)8(2)6-11(14)13-12/h4-6H,1-3H3,(H,13,14)	GZLWESBHRVYTQR-UHFFFAOYSA-N	Cc1cc(C)c2nc(S)cc(C)c2c1	BroadT	BRD-K93190824	BRD-K93190824-001-05-5	Enamine Ltd.	T0517-8624			Cc1cc(C)c2nc(S)cc(C)c2c1	InChI=1S/C12H13NS/c1-7-4-9(3)12-10(5-7)8(2)6-11(14)13-12/h4-6H,1-3H3,(H,13,14)	GZLWESBHRVYTQR-UHFFFAOYSA-N	203.076870116							116957
MLS000871787	LSM-28407	SID24783074, BRD-K91025797	16188042	InChI=1S/C14H12N4O4S/c1-7-12(18(20)21)11(17-22-7)13(19)16-14-9(6-15)8-4-2-3-5-10(8)23-14/h2-5H2,1H3,(H,16,19)	MRLCOQNXYQPSLO-UHFFFAOYSA-N	Cc1onc(C(=O)Nc2sc3CCCCc3c2C#N)c1[N+](=O)[O-]	BroadT	BRD-K91025797	BRD-K91025797-001-06-6	ChemDiv Inc.	C582-0855			Cc1onc(C(=O)Nc2sc3CCCCc3c2C#N)c1[N+]([O-])=O	InChI=1S/C14H12N4O4S/c1-7-12(18(20)21)11(17-22-7)13(19)16-14-9(6-15)8-4-2-3-5-10(8)23-14/h2-5H2,1H3,(H,16,19)	MRLCOQNXYQPSLO-UHFFFAOYSA-N	332.057925594							116958
AC1MEJTZ	LSM-28408	SID24804350, BRD-K18782119	2904512	InChI=1S/C19H19N5/c1-13-12-14(2)22-19(21-13)24-18(20)23-17-11-7-6-10-16(17)15-8-4-3-5-9-15/h3-12H,1-2H3,(H3,20,21,22,23,24)	XJLAUUGAEXMSTE-UHFFFAOYSA-N	Cc1cc(C)nc(N=C(N)Nc2ccccc2c3ccccc3)n1	BroadT	BRD-K18782119	BRD-K18782119-001-05-5	Asinex Ltd.	BAS 03181723			Cc1cc(C)nc(N=C(N)Nc2ccccc2-c2ccccc2)n1	InChI=1S/C19H19N5/c1-13-12-14(2)22-19(21-13)24-18(20)23-17-11-7-6-10-16(17)15-8-4-3-5-9-15/h3-12H,1-2H3,(H3,20,21,22,23,24)	XJLAUUGAEXMSTE-UHFFFAOYSA-N	317.164045658							116959
AC1MNXDY	LSM-28409	SID24823200, BRD-A10737121	3334915	InChI=1S/C18H12N4O3S/c19-8-11-13(9-4-1-2-5-10(9)18(23)24)14-15(12-6-3-7-26-12)21-22-17(14)25-16(11)20/h1-7,13H,20H2,(H,21,22)(H,23,24)	MBCDSNRTILSULC-UHFFFAOYSA-N	NC1=C(C#N)C(c2ccccc2C(=O)O)c3c(O1)[nH]nc3c4cccs4	BroadT	BRD-A10737121	BRD-A10737121-001-06-3	ChemDiv Inc.	8012-6787			NC1=C(C#N)C(c2c(O1)[nH]nc2-c1cccs1)c1ccccc1C(O)=O	InChI=1S/C18H12N4O3S/c19-8-11-13(9-4-1-2-5-10(9)18(23)24)14-15(12-6-3-7-26-12)21-22-17(14)25-16(11)20/h1-7,13H,20H2,(H,21,22)(H,23,24)	MBCDSNRTILSULC-UHFFFAOYSA-N	364.063010974							116960
MLS000086123	LSM-28410	SID4250001, BRD-K18451749	3243874	InChI=1S/C26H27N9O/c36-24(33-13-17-35(18-14-33)26-29-9-4-10-30-26)22-19-31-23(21-6-2-1-5-20(21)22)32-11-15-34(16-12-32)25-27-7-3-8-28-25/h1-10,19H,11-18H2	ZGBDOUWUMKSJJF-UHFFFAOYSA-N	O=C(N1CCN(CC1)c2ncccn2)c3cnc(N4CCN(CC4)c5ncccn5)c6ccccc36	BroadT	BRD-K18451749	BRD-K18451749-001-05-5	ChemDiv Inc.	C066-0419			O=C(N1CCN(CC1)c1ncccn1)c1cnc(N2CCN(CC2)c2ncccn2)c2ccccc12	InChI=1S/C26H27N9O/c36-24(33-13-17-35(18-14-33)26-29-9-4-10-30-26)22-19-31-23(21-6-2-1-5-20(21)22)32-11-15-34(16-12-32)25-27-7-3-8-28-25/h1-10,19H,11-18H2	ZGBDOUWUMKSJJF-UHFFFAOYSA-N	481.233856574							116961
SMR000111457	LSM-28411	SID7976614, BRD-K74072469	2247152	InChI=1S/C14H22FNO/c1-14(2,3)16-10-6-7-11-17-13-9-5-4-8-12(13)15/h4-5,8-9,16H,6-7,10-11H2,1-3H3	ZUWLHLMEZNEWFZ-UHFFFAOYSA-N	CC(C)(C)NCCCCOc1ccccc1F	BroadT	BRD-K74072469	BRD-K74072469-001-05-8	ChemBridge Corporation	5521656			CC(C)(C)NCCCCOc1ccccc1F	InChI=1S/C14H22FNO/c1-14(2,3)16-10-6-7-11-17-13-9-5-4-8-12(13)15/h4-5,8-9,16H,6-7,10-11H2,1-3H3	ZUWLHLMEZNEWFZ-UHFFFAOYSA-N	239.168542534							131291
F1105-0139	LSM-28412	SID49680358, BRD-K46028325	2976938	InChI=1S/C16H12N2O4/c1-22-11-4-2-3-9(7-11)14(19)17-10-5-6-12-13(8-10)16(21)18-15(12)20/h2-8H,1H3,(H,17,19)(H,18,20,21)	MEXLAWWGIJKKDH-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Nc2ccc3C(=O)NC(=O)c3c2	BroadT	BRD-K46028325	BRD-K46028325-001-05-9	Life Chemicals Inc.	F1105-0139			COc1cccc(c1)C(=O)Nc1ccc2C(=O)NC(=O)c2c1	InChI=1S/C16H12N2O4/c1-22-11-4-2-3-9(7-11)14(19)17-10-5-6-12-13(8-10)16(21)18-15(12)20/h2-8H,1H3,(H,17,19)(H,18,20,21)	MEXLAWWGIJKKDH-UHFFFAOYSA-N	296.079706884							116964
F0580-0021	LSM-28413	SID24824304, BRD-K09810621	2155551	InChI=1S/C20H18N4O2S/c1-12-7-9-13(10-8-12)21-16(25)11-27-20-23-17-14-5-3-4-6-15(14)22-18(17)19(26)24(20)2/h3-10,26H,11H2,1-2H3,(H,21,25)	OTAWIZZYIJLAMK-UHFFFAOYSA-N	Cc1ccc(NC(=O)CSc2nc3c4ccccc4nc3c(O)n2C)cc1	BroadT	BRD-K09810621	BRD-K09810621-001-04-9	Life Chemicals Inc.	F0580-0021			Cc1ccc(NC(=O)CSc2nc3c(nc4ccccc34)c(O)n2C)cc1	InChI=1S/C20H18N4O2S/c1-12-7-9-13(10-8-12)21-16(25)11-27-20-23-17-14-5-3-4-6-15(14)22-18(17)19(26)24(20)2/h3-10,26H,11H2,1-2H3,(H,21,25)	OTAWIZZYIJLAMK-UHFFFAOYSA-N	378.115046546							
AC1OMU6J	LSM-44275	BRD-A81272231	7478401	InChI=1S/C19H16N2O3/c22-15-8-6-13(7-9-15)10-17-18(23)16(19(24)21-17)12-20-11-14-4-2-1-3-5-14/h1-10,12,16,22H,11H2,(H,21,24)/b17-10-,20-12?	AAVOAHFDNAXPPM-HIUUTUCUSA-N	Oc1ccc(\C=C\2/NC(=O)C(C=NCc3ccccc3)C2=O)cc1	BroadT	BRD-A81272231	BRD-A81272231-001-06-2	ChemBridge Corporation	6043499			Oc1ccc(cc1)\C=C1/NC(=O)C(C=NCc2ccccc2)C1=O	InChI=1S/C19H16N2O3/c22-15-8-6-13(7-9-15)10-17-18(23)16(19(24)21-17)12-20-11-14-4-2-1-3-5-14/h1-10,12,16,22H,11H2,(H,21,24)/b17-10-,20-12?	AAVOAHFDNAXPPM-HIUUTUCUSA-N	320.116092392							
SMR000023622	LSM-28415	SID4250979, BRD-K95635973	3244722	InChI=1S/C14H15N3O2/c18-14(16-10-5-4-8-15-9-10)13-11-6-2-1-3-7-12(11)19-17-13/h4-5,8-9H,1-3,6-7H2,(H,16,18)	SODSBCFRVVPIKS-UHFFFAOYSA-N	O=C(Nc1cccnc1)c2noc3CCCCCc23	BroadT	BRD-K95635973	BRD-K95635973-001-06-4	ChemDiv Inc.	C226-3504			O=C(Nc1cccnc1)c1noc2CCCCCc12	InChI=1S/C14H15N3O2/c18-14(16-10-5-4-8-15-9-10)13-11-6-2-1-3-7-12(11)19-17-13/h4-5,8-9H,1-3,6-7H2,(H,16,18)	SODSBCFRVVPIKS-UHFFFAOYSA-N	257.11642675							116967
ASN 05629260	LSM-28416	SID26726383, SID845345, BRD-K77146507	647688	InChI=1S/C22H23FN4O2S/c1-26-20(16-6-8-17(23)9-7-16)14-24-22(26)30-15-21(28)25-18-4-2-3-5-19(18)27-10-12-29-13-11-27/h2-9,14H,10-13,15H2,1H3,(H,25,28)	MLIMTXWCEUAIBR-UHFFFAOYSA-N	Cn1c(SCC(=O)Nc2ccccc2N3CCOCC3)ncc1c4ccc(F)cc4	BroadT	BRD-K77146507	BRD-K77146507-001-06-9	Asinex Ltd.	ASN 05629260			Cn1c(SCC(=O)Nc2ccccc2N2CCOCC2)ncc1-c1ccc(F)cc1	InChI=1S/C22H23FN4O2S/c1-26-20(16-6-8-17(23)9-7-16)14-24-22(26)30-15-21(28)25-18-4-2-3-5-19(18)27-10-12-29-13-11-27/h2-9,14H,10-13,15H2,1H3,(H,25,28)	MLIMTXWCEUAIBR-UHFFFAOYSA-N	426.152574906							116968
SMR000156132	LSM-28417	SID17407209, BRD-K31788263	11958502	InChI=1S/C21H26N4O2S2/c1-4-5-6-7-12-18(26)25-21-22-14(2)19(29-21)16-13-28-20(24-16)23-15-10-8-9-11-17(15)27-3/h8-11,13H,4-7,12H2,1-3H3,(H,23,24)(H,22,25,26)	MABMFNDGXMALMG-UHFFFAOYSA-N	CCCCCCC(=O)Nc1nc(C)c(s1)c2csc(Nc3ccccc3OC)n2	BroadT	BRD-K31788263	BRD-K31788263-001-05-9	University of California at Davis	CLY_Corr_H11			CCCCCCC(=O)Nc1nc(C)c(s1)-c1csc(Nc2ccccc2OC)n1	InChI=1S/C21H26N4O2S2/c1-4-5-6-7-12-18(26)25-21-22-14(2)19(29-21)16-13-28-20(24-16)23-15-10-8-9-11-17(15)27-3/h8-11,13H,4-7,12H2,1-3H3,(H,23,24)(H,22,25,26)	MABMFNDGXMALMG-UHFFFAOYSA-N	430.149717492							116969
SMR000116536	LSM-28418	SID14724629, BRD-K00293617	1165982	InChI=1S/C18H15FN6OS/c1-24-17(10-25-15-9-5-4-8-14(15)20-23-25)21-22-18(24)27-11-16(26)12-6-2-3-7-13(12)19/h2-9H,10-11H2,1H3	VUDHFUHPZLIZAW-UHFFFAOYSA-N	Cn1c(Cn2nnc3ccccc23)nnc1SCC(=O)c4ccccc4F	BroadT	BRD-K00293617	BRD-K00293617-001-06-8	Asinex Ltd.	ASN 04210896			Cn1c(Cn2nnc3ccccc23)nnc1SCC(=O)c1ccccc1F	InChI=1S/C18H15FN6OS/c1-24-17(10-25-15-9-5-4-8-14(15)20-23-25)21-22-18(24)27-11-16(26)12-6-2-3-7-13(12)19/h2-9H,10-11H2,1H3	VUDHFUHPZLIZAW-UHFFFAOYSA-N	382.10120805							116970
AC1LXJW8	LSM-28419	SID24794908, BRD-K58576780	1830350	InChI=1S/C16H21N3O4S/c1-18-6-8-19(9-7-18)16(24)17-13-10-11(14(20)22-2)4-5-12(13)15(21)23-3/h4-5,10H,6-9H2,1-3H3,(H,17,24)	MJOUQLXHYGATDU-UHFFFAOYSA-N	COC(=O)c1ccc(C(=O)OC)c(NC(=S)N2CCN(C)CC2)c1	BroadT	BRD-K58576780	BRD-K58576780-001-05-0	ChemBridge Corporation	7960715			COC(=O)c1ccc(C(=O)OC)c(NC(=S)N2CCN(C)CC2)c1	InChI=1S/C16H21N3O4S/c1-18-6-8-19(9-7-18)16(24)17-13-10-11(14(20)22-2)4-5-12(13)15(21)23-3/h4-5,10H,6-9H2,1-3H3,(H,17,24)	MJOUQLXHYGATDU-UHFFFAOYSA-N	351.125276872							116971
SMR000066529	LSM-28420	SID3713360, BRD-K40810355	2998383	InChI=1S/C21H20N2O5/c24-20(22-13-19-7-4-12-26-19)14-28-21(25)15-27-18-10-8-17(9-11-18)23-16-5-2-1-3-6-16/h1-12,23H,13-15H2,(H,22,24)	IJTXTUYQRHKQDC-UHFFFAOYSA-N	O=C(COC(=O)COc1ccc(Nc2ccccc2)cc1)NCc3occc3	BroadT	BRD-K40810355	BRD-K40810355-001-05-9	Enamine Ltd.	T5236168			O=C(COC(=O)COc1ccc(Nc2ccccc2)cc1)NCc1ccco1	InChI=1S/C21H20N2O5/c24-20(22-13-19-7-4-12-26-19)14-28-21(25)15-27-18-10-8-17(9-11-18)23-16-5-2-1-3-6-16/h1-12,23H,13-15H2,(H,22,24)	IJTXTUYQRHKQDC-UHFFFAOYSA-N	380.13722176							116972
4,4'-(Ethene-1,1-diyl)diphenol	LSM-28421	SID859273, BRD-K10228739	660572	InChI=1S/C14H12O2/c1-10(11-2-6-13(15)7-3-11)12-4-8-14(16)9-5-12/h2-9,15-16H,1H2	OTJFTLRXGXUHEJ-UHFFFAOYSA-N	Oc1ccc(cc1)C(=C)c2ccc(O)cc2	BroadT	BRD-K10228739	BRD-K10228739-001-06-5	InterBioScreen Ltd.	STOCK2S-95800			Oc1ccc(cc1)C(=C)c1ccc(O)cc1	InChI=1S/C14H12O2/c1-10(11-2-6-13(15)7-3-11)12-4-8-14(16)9-5-12/h2-9,15-16H,1H2	OTJFTLRXGXUHEJ-UHFFFAOYSA-N	212.083729624							116973
F0466-0053	LSM-28422	SID4249540, BRD-K32308159	3243481	InChI=1S/C15H13N3O4/c1-9-7-12(17-22-9)16-15(21)10-3-2-4-11(8-10)18-13(19)5-6-14(18)20/h2-4,7-8H,5-6H2,1H3,(H,16,17,21)	PWQNZSMIVDUAMT-UHFFFAOYSA-N	Cc1onc(NC(=O)c2cccc(c2)N3C(=O)CCC3=O)c1	BroadT	BRD-K32308159	BRD-K32308159-001-05-2	ChemDiv Inc.	3338-0064			Cc1cc(NC(=O)c2cccc(c2)N2C(=O)CCC2=O)no1	InChI=1S/C15H13N3O4/c1-9-7-12(17-22-9)16-15(21)10-3-2-4-11(8-10)18-13(19)5-6-14(18)20/h2-4,7-8H,5-6H2,1H3,(H,16,17,21)	PWQNZSMIVDUAMT-UHFFFAOYSA-N	299.090605926							116974
MLS000662583	LSM-28423	SID24783546, BRD-K83133240	823966	InChI=1S/C16H13FN2O3S/c17-11-2-4-12(5-3-11)18-16(23)19-15(20)10-1-6-13-14(9-10)22-8-7-21-13/h1-6,9H,7-8H2,(H2,18,19,20,23)	YGFFRSMVZBWZAC-UHFFFAOYSA-N	Fc1ccc(NC(=S)NC(=O)c2ccc3OCCOc3c2)cc1	BroadT	BRD-K83133240	BRD-K83133240-001-06-1	ChemBridge Corporation	7497708			Fc1ccc(NC(=S)NC(=O)c2ccc3OCCOc3c2)cc1	InChI=1S/C16H13FN2O3S/c17-11-2-4-12(5-3-11)18-16(23)19-15(20)10-1-6-13-14(9-10)22-8-7-21-13/h1-6,9H,7-8H2,(H2,18,19,20,23)	YGFFRSMVZBWZAC-UHFFFAOYSA-N	332.063091186							116975
4-Amino-n-(4-ethoxyphenyl)benzenesulfonamide	LSM-28424	SID14720451, BRD-K48168251	788027	InChI=1S/C14H16N2O3S/c1-2-19-13-7-5-12(6-8-13)16-20(17,18)14-9-3-11(15)4-10-14/h3-10,16H,2,15H2,1H3	SBPXTHAKRLEODG-UHFFFAOYSA-N	CCOc1ccc(NS(=O)(=O)c2ccc(N)cc2)cc1	BroadT	BRD-K48168251	BRD-K48168251-001-06-7	Asinex Ltd.	BAS 02102356			CCOc1ccc(NS(=O)(=O)c2ccc(N)cc2)cc1	InChI=1S/C14H16N2O3S/c1-2-19-13-7-5-12(6-8-13)16-20(17,18)14-9-3-11(15)4-10-14/h3-10,16H,2,15H2,1H3	SBPXTHAKRLEODG-UHFFFAOYSA-N	292.088163082							116976
ST50890737	LSM-28425	SID4258489, BRD-K38171188	1245136	InChI=1S/C12H14N4OS/c17-12(15-16-7-13-14-8-16)11-6-9-4-2-1-3-5-10(9)18-11/h6-8H,1-5H2,(H,15,17)	CXWWUJNVIVTUIE-UHFFFAOYSA-N	O=C(Nn1cnnc1)c2cc3CCCCCc3s2	BroadT	BRD-K38171188	BRD-K38171188-001-05-3	ChemBridge Corporation	7944512			O=C(Nn1cnnc1)c1cc2CCCCCc2s1	InChI=1S/C12H14N4OS/c17-12(15-16-7-13-14-8-16)11-6-9-4-2-1-3-5-10(9)18-11/h6-8H,1-5H2,(H,15,17)	CXWWUJNVIVTUIE-UHFFFAOYSA-N	262.088831798							116977
MLS000114602	LSM-28426	SID7969225, BRD-A19182343	5309843	InChI=1S/C18H15N5O3S/c24-15-13-9-1-2-10(7-9)14(13)16(25)23(15)12-5-3-11(4-6-12)20-17(26)21-18-22-19-8-27-18/h1-6,8-10,13-14H,7H2,(H2,20,21,22,26)	VCYGYGXZDLJGCA-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)N2C(=O)C3C4CC(C=C4)C3C2=O)Nc5nncs5	BroadT	BRD-A19182343	BRD-A19182343-001-06-5	ChemDiv Inc.	5988-0061			O=C(Nc1nncs1)Nc1ccc(cc1)N1C(=O)C2C3CC(C=C3)C2C1=O	InChI=1S/C18H15N5O3S/c24-15-13-9-1-2-10(7-9)14(13)16(25)23(15)12-5-3-11(4-6-12)20-17(26)21-18-22-19-8-27-18/h1-6,8-10,13-14H,7H2,(H2,20,21,22,26)	VCYGYGXZDLJGCA-UHFFFAOYSA-N	381.08956008							116978
MLS000332634	LSM-28427	SID26725734, BRD-K27559589	754530	InChI=1S/C12H9ClN4O2/c13-9-3-1-8(2-4-9)11(18)16-17-12(19)10-7-14-5-6-15-10/h1-7H,(H,16,18)(H,17,19)	XMRUGQJFSZJSKG-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)NNC(=O)c2cnccn2	BroadT	BRD-K27559589	BRD-K27559589-001-06-5	InterBioScreen Ltd.	STOCK3S-96158			Clc1ccc(cc1)C(=O)NNC(=O)c1cnccn1	InChI=1S/C12H9ClN4O2/c13-9-3-1-8(2-4-9)11(18)16-17-12(19)10-7-14-5-6-15-10/h1-7H,(H,16,18)(H,17,19)	XMRUGQJFSZJSKG-UHFFFAOYSA-N	276.041403278							116979
SMR000019682	LSM-28428	SID4251637, BRD-K28837669	3245297	InChI=1S/C22H23N5O5/c1-14-4-2-6-27-19(14)25-20-17(22(27)30)12-16(18(23)26(20)7-10-31-11-8-28)21(29)24-13-15-5-3-9-32-15/h2-6,9,12,23,28H,7-8,10-11,13H2,1H3,(H,24,29)	FYEXFOBMGHTSRB-UHFFFAOYSA-N	CC1=CC=CN2C(=O)C3=C(N=C12)N(CCOCCO)C(=N)C(=C3)C(=O)NCc4occc4	BroadT	BRD-K28837669	BRD-K28837669-001-05-9	ChemDiv Inc.	5282-1163			Cc1cccn2c1nc1n(CCOCCO)c(=N)c(cc1c2=O)C(=O)NCc1ccco1	InChI=1S/C22H23N5O5/c1-14-4-2-6-27-19(14)25-20-17(22(27)30)12-16(18(23)26(20)7-10-31-11-8-28)21(29)24-13-15-5-3-9-32-15/h2-6,9,12,23,28H,7-8,10-11,13H2,1H3,(H,24,29)	FYEXFOBMGHTSRB-UHFFFAOYSA-N	437.169918886							116980
T5314662	LSM-28429	SID17517371, BRD-A89431052	4879131	InChI=1S/C25H23N3O5/c1-14-10-17(14)25(29)32-13-23-27-28-24(33-23)18-12-20(26-19-7-5-4-6-16(18)19)15-8-9-21(30-2)22(11-15)31-3/h4-9,11-12,14,17H,10,13H2,1-3H3	DMGFPNFNXGWPFK-UHFFFAOYSA-N	COc1ccc(cc1OC)c2cc(c3oc(COC(=O)C4CC4C)nn3)c5ccccc5n2	BroadT	BRD-A89431052	BRD-A89431052-001-05-4	Enamine Ltd.	T5314662			COc1ccc(cc1OC)-c1cc(-c2nnc(COC(=O)C3CC3C)o2)c2ccccc2n1	InChI=1S/C25H23N3O5/c1-14-10-17(14)25(29)32-13-23-27-28-24(33-23)18-12-20(26-19-7-5-4-6-16(18)19)15-8-9-21(30-2)22(11-15)31-3/h4-9,11-12,14,17H,10,13H2,1-3H3	DMGFPNFNXGWPFK-UHFFFAOYSA-N	445.163770866							116981
SMR000015965	LSM-28430	SID7970643, BRD-K38937712	2992148	InChI=1S/C21H23N7O2S/c1-25(14-15-8-5-4-6-9-15)20-24-17-16(18(29)27(3)21(30)26(17)2)28(20)12-13-31-19-22-10-7-11-23-19/h4-11H,12-14H2,1-3H3	PWYPNUCUNLAZFU-UHFFFAOYSA-N	CN(Cc1ccccc1)c2nc3N(C)C(=O)N(C)C(=O)c3n2CCSc4ncccn4	BroadT	BRD-K38937712	BRD-K38937712-001-05-2	Life Chemicals Inc.	F0570-0434			CN(Cc1ccccc1)c1nc2n(C)c(=O)n(C)c(=O)c2n1CCSc1ncccn1	InChI=1S/C21H23N7O2S/c1-25(14-15-8-5-4-6-9-15)20-24-17-16(18(29)27(3)21(30)26(17)2)28(20)12-13-31-19-22-10-7-11-23-19/h4-11H,12-14H2,1-3H3	PWYPNUCUNLAZFU-UHFFFAOYSA-N	437.163393736							116982
T6033684	LSM-28431	SID24826743, BRD-K90520658	2461566	InChI=1S/C15H13F3N2O2/c1-9-3-5-10(6-4-9)13(21)19-11-7-8-12(15(16,17)18)20(2)14(11)22/h3-8H,1-2H3,(H,19,21)	XHKPRPYZXAWAGM-UHFFFAOYSA-N	CN1C(=O)C(=CC=C1C(F)(F)F)NC(=O)c2ccc(C)cc2	BroadT	BRD-K90520658	BRD-K90520658-001-07-3	Enamine Ltd.	T0518-5967			Cc1ccc(cc1)C(=O)Nc1ccc(n(C)c1=O)C(F)(F)F	InChI=1S/C15H13F3N2O2/c1-9-3-5-10(6-4-9)13(21)19-11-7-8-12(15(16,17)18)20(2)14(11)22/h3-8H,1-2H3,(H,19,21)	XHKPRPYZXAWAGM-UHFFFAOYSA-N	310.092912276							116983
AO-799/42007949	LSM-28432	SID17387242, BRD-K45867813	990683	InChI=1S/C26H25N3O5S/c1-5-34-26(31)19-14(2)28-25-21(20(19)15-6-10-17(32-3)11-7-15)22(27)23(35-25)24(30)29-16-8-12-18(33-4)13-9-16/h6-13H,5,27H2,1-4H3,(H,29,30)	GHAXJTROTHGKSD-UHFFFAOYSA-N	CCOC(=O)c1c(C)nc2sc(C(=O)Nc3ccc(OC)cc3)c(N)c2c1c4ccc(OC)cc4	BroadT	BRD-K45867813	BRD-K45867813-001-05-0	Specs	AO-799/42007949			CCOC(=O)c1c(C)nc2sc(C(=O)Nc3ccc(OC)cc3)c(N)c2c1-c1ccc(OC)cc1	InChI=1S/C26H25N3O5S/c1-5-34-26(31)19-14(2)28-25-21(20(19)15-6-10-17(32-3)11-7-15)22(27)23(35-25)24(30)29-16-8-12-18(33-4)13-9-16/h6-13H,5,27H2,1-4H3,(H,29,30)	GHAXJTROTHGKSD-UHFFFAOYSA-N	491.15149162							116984
AK-968/41924723	LSM-28433	SID22412192, BRD-K97019647	843946	InChI=1S/C14H13N3OS/c1-9-5-3-4-6-12(9)17-13(15-16-14(17)19)11-7-8-18-10(11)2/h3-8H,1-2H3,(H,16,19)	XDQUTAWHIOBCFQ-UHFFFAOYSA-N	Cc1occc1c2nnc(S)n2c3ccccc3C	BroadT	BRD-K97019647	BRD-K97019647-001-05-7	Specs	AK-968/41924723			Cc1occc1-c1nnc(S)n1-c1ccccc1C	InChI=1S/C14H13N3OS/c1-9-5-3-4-6-12(9)17-13(15-16-14(17)19)11-7-8-18-10(11)2/h3-8H,1-2H3,(H,16,19)	XDQUTAWHIOBCFQ-UHFFFAOYSA-N	271.077932756							116985
F0642-4334	LSM-28434	SID24816843, BRD-K76009557	7105711	InChI=1S/C10H9F2N3OS/c1-2-8(16)14-15-10-13-9-6(12)3-5(11)4-7(9)17-10/h3-4H,2H2,1H3,(H,13,15)(H,14,16)	ZMGIIGDMINVDNZ-UHFFFAOYSA-N	CCC(=O)NNc1nc2c(F)cc(F)cc2s1	BroadT	BRD-K76009557	BRD-K76009557-001-05-1	Life Chemicals Inc.	F0642-4334			CCC(=O)NNc1nc2c(F)cc(F)cc2s1	InChI=1S/C10H9F2N3OS/c1-2-8(16)14-15-10-13-9-6(12)3-5(11)4-7(9)17-10/h3-4H,2H2,1H3,(H,13,15)(H,14,16)	ZMGIIGDMINVDNZ-UHFFFAOYSA-N	257.043439028							116986
T5248743	LSM-28435	SID24829753, BRD-A32633048	3937438	InChI=1S/C20H25ClN4OS/c1-13(11-26-4)22-20-24-23-19(12-27-20)17-9-14(2)25(15(17)3)10-16-7-5-6-8-18(16)21/h5-9,13H,10-12H2,1-4H3,(H,22,24)	VERXCDZMLMBGMO-UHFFFAOYSA-N	COCC(C)NC1=NN=C(CS1)c2cc(C)n(Cc3ccccc3Cl)c2C	BroadT	BRD-A32633048	BRD-A32633048-001-05-0	Enamine Ltd.	T5248743			COCC(C)NC1=NN=C(CS1)c1cc(C)n(Cc2ccccc2Cl)c1C	InChI=1S/C20H25ClN4OS/c1-13(11-26-4)22-20-24-23-19(12-27-20)17-9-14(2)25(15(17)3)10-16-7-5-6-8-18(16)21/h5-9,13H,10-12H2,1-4H3,(H,22,24)	VERXCDZMLMBGMO-UHFFFAOYSA-N	404.14375986							116987
MLS001012144	LSM-28436	SID26671267, BRD-K11224187	1929802	InChI=1S/C17H17F3N4OS2/c1-2-25-14-8-6-12(7-9-14)21-15(26)23-24-16(27)22-13-5-3-4-11(10-13)17(18,19)20/h3-10H,2H2,1H3,(H2,21,23,26)(H2,22,24,27)	WFNVXQSKBQAFMR-UHFFFAOYSA-N	CCOc1ccc(NC(=NN=C(S)Nc2cccc(c2)C(F)(F)F)S)cc1	BroadT	BRD-K11224187	BRD-K11224187-001-06-0	InterBioScreen Ltd.	STOCK2S-21982			CCOc1ccc(NC(S)=NN=C(S)Nc2cccc(c2)C(F)(F)F)cc1	InChI=1S/C17H17F3N4OS2/c1-2-25-14-8-6-12(7-9-14)21-15(26)23-24-16(27)22-13-5-3-4-11(10-13)17(18,19)20/h3-10H,2H2,1H3,(H2,21,23,26)(H2,22,24,27)	WFNVXQSKBQAFMR-UHFFFAOYSA-N	414.079587184							116988
AC1MGQPJ	LSM-28437	SID7970773, BRD-A17996878	2940041	InChI=1S/C17H18ClN5O/c1-11-8-22(9-12(2)24-11)16-15-7-21-23(17(15)20-10-19-16)14-5-3-13(18)4-6-14/h3-7,10-12H,8-9H2,1-2H3	GYCYUCTVJIWYAD-UHFFFAOYSA-N	CC1CN(CC(C)O1)c2ncnc3c2cnn3c4ccc(Cl)cc4	BroadT	BRD-A17996878	BRD-A17996878-001-04-8	Life Chemicals Inc.	F0521-0133			CC1CN(CC(C)O1)c1ncnc2n(ncc12)-c1ccc(Cl)cc1	InChI=1S/C17H18ClN5O/c1-11-8-22(9-12(2)24-11)16-15-7-21-23(17(15)20-10-19-16)14-5-3-13(18)4-6-14/h3-7,10-12H,8-9H2,1-2H3	GYCYUCTVJIWYAD-UHFFFAOYSA-N	343.119987956							116989
SMR000093911	LSM-28438	SID7966707, BRD-K60728310	5308395	InChI=1S/C22H18N2O4/c1-2-14-5-8-16(9-6-14)23-20(25)15-7-10-18-19(12-15)22(27)24(21(18)26)13-17-4-3-11-28-17/h3-12H,2,13H2,1H3,(H,23,25)	JLXVMDWULWXBFV-UHFFFAOYSA-N	CCc1ccc(NC(=O)c2ccc3C(=O)N(Cc4occc4)C(=O)c3c2)cc1	BroadT	BRD-K60728310	BRD-K60728310-001-04-5	ChemDiv Inc.	C430-0159			CCc1ccc(NC(=O)c2ccc3C(=O)N(Cc4ccco4)C(=O)c3c2)cc1	InChI=1S/C22H18N2O4/c1-2-14-5-8-16(9-6-14)23-20(25)15-7-10-18-19(12-15)22(27)24(21(18)26)13-17-4-3-11-28-17/h3-12H,2,13H2,1H3,(H,23,25)	JLXVMDWULWXBFV-UHFFFAOYSA-N	374.126657076							116990
SMR000021797	LSM-28439	BRD-A69110668, SID4250677	3244453	InChI=1S/C18H16ClFN2O2/c1-2-17(24)22-10-16(23)21-15-8-5-12(19)9-14(15)18(22)11-3-6-13(20)7-4-11/h3-9,18H,2,10H2,1H3,(H,21,23)	UOYNCKOPUNYWCU-UHFFFAOYSA-N	CCC(=O)N1CC(=O)Nc2ccc(Cl)cc2C1c3ccc(F)cc3	BroadT	BRD-A69110668	BRD-A69110668-001-05-4	ChemDiv Inc.	C076-0291			CCC(=O)N1CC(=O)Nc2ccc(Cl)cc2C1c1ccc(F)cc1	InChI=1S/C18H16ClFN2O2/c1-2-17(24)22-10-16(23)21-15-8-5-12(19)9-14(15)18(22)11-3-6-13(20)7-4-11/h3-9,18H,2,10H2,1H3,(H,21,23)	UOYNCKOPUNYWCU-UHFFFAOYSA-N	346.088433682							116991
1-Cyclohexyl-3-(2-ethylphenyl)urea	LSM-28440	SID14731197, BRD-K42504970	853789	InChI=1S/C15H22N2O/c1-2-12-8-6-7-11-14(12)17-15(18)16-13-9-4-3-5-10-13/h6-8,11,13H,2-5,9-10H2,1H3,(H2,16,17,18)	ZUFAXYGISWKBNQ-UHFFFAOYSA-N	CCc1ccccc1NC(=O)NC2CCCCC2	BroadT	BRD-K42504970	BRD-K42504970-001-05-1	ChemBridge Corporation	6112100			CCc1ccccc1NC(=O)NC1CCCCC1	InChI=1S/C15H22N2O/c1-2-12-8-6-7-11-14(12)17-15(18)16-13-9-4-3-5-10-13/h6-8,11,13H,2-5,9-10H2,1H3,(H2,16,17,18)	ZUFAXYGISWKBNQ-UHFFFAOYSA-N	246.173213344							116992
AC1M0UB8	LSM-28441	SID22405731, BRD-K87771507	2083535	InChI=1S/C23H24N2O3S/c1-15-13-22(16(2)25(15)19-7-9-20(28-4)10-8-19)23(27)14-29-21-11-5-18(6-12-21)24-17(3)26/h5-13H,14H2,1-4H3,(H,24,26)	TZKOVSFOMCKHCS-UHFFFAOYSA-N	COc1ccc(cc1)n2c(C)cc(C(=O)CSc3ccc(NC(=O)C)cc3)c2C	BroadT	BRD-K87771507	BRD-K87771507-001-05-4	Enamine Ltd.	T5261487			COc1ccc(cc1)-n1c(C)cc(C(=O)CSc2ccc(NC(C)=O)cc2)c1C	InChI=1S/C23H24N2O3S/c1-15-13-22(16(2)25(15)19-7-9-20(28-4)10-8-19)23(27)14-29-21-11-5-18(6-12-21)24-17(3)26/h5-13H,14H2,1-4H3,(H,24,26)	TZKOVSFOMCKHCS-UHFFFAOYSA-N	408.150763338							116993
BRD-A23540331	LSM-28442			InChI=1S/C15H16FNO4/c1-9(18)12-13(10-3-5-11(16)6-4-10)17(7-8-21-2)15(20)14(12)19/h3-6,12-13H,7-8H2,1-2H3	DKICPXIIQIXYFL-UHFFFAOYSA-N	COCCN1C(C(C(=O)C)C(=O)C1=O)c2ccc(F)cc2	BroadT	BRD-A23540331	BRD-A23540331-001-05-4	Asinex Ltd.	BAS 03321656			COCCN1C(C(C(C)=O)C(=O)C1=O)c1ccc(F)cc1	InChI=1S/C15H16FNO4/c1-9(18)12-13(10-3-5-11(16)6-4-10)17(7-8-21-2)15(20)14(12)19/h3-6,12-13H,7-8H2,1-2H3	DKICPXIIQIXYFL-UHFFFAOYSA-N	293.106336202							116994
AC1M5VPS	LSM-28443	SID22401437, BRD-K52251545	2386323	InChI=1S/C19H22N2O5S2/c22-17(20-14-7-2-1-3-8-14)13-26-19(23)15-9-4-5-10-16(15)21-28(24,25)18-11-6-12-27-18/h4-6,9-12,14,21H,1-3,7-8,13H2,(H,20,22)	JWUYEOWKOMTYAL-UHFFFAOYSA-N	O=C(COC(=O)c1ccccc1NS(=O)(=O)c2cccs2)NC3CCCCC3	BroadT	BRD-K52251545	BRD-K52251545-001-05-2	Enamine Ltd.	T0510-7581			O=C(COC(=O)c1ccccc1NS(=O)(=O)c1cccs1)NC1CCCCC1	InChI=1S/C19H22N2O5S2/c22-17(20-14-7-2-1-3-8-14)13-26-19(23)15-9-4-5-10-16(15)21-28(24,25)18-11-6-12-27-18/h4-6,9-12,14,21H,1-3,7-8,13H2,(H,20,22)	JWUYEOWKOMTYAL-UHFFFAOYSA-N	422.097013204							116995
N-[2-(Benzylsulfanyl)ethyl]-2-[(methylsulfonyl)amino]benzamide	LSM-28444	SID24796874, BRD-K17316170	2229235	InChI=1S/C17H20N2O3S2/c1-24(21,22)19-16-10-6-5-9-15(16)17(20)18-11-12-23-13-14-7-3-2-4-8-14/h2-10,19H,11-13H2,1H3,(H,18,20)	YWFKWHFIOLVJLK-UHFFFAOYSA-N	CS(=O)(=O)Nc1ccccc1C(=O)NCCSCc2ccccc2	BroadT	BRD-K17316170	BRD-K17316170-001-06-7	ChemBridge Corporation	7959499			CS(=O)(=O)Nc1ccccc1C(=O)NCCSCc1ccccc1	InChI=1S/C17H20N2O3S2/c1-24(21,22)19-16-10-6-5-9-15(16)17(20)18-11-12-23-13-14-7-3-2-4-8-14/h2-10,19H,11-13H2,1H3,(H,18,20)	YWFKWHFIOLVJLK-UHFFFAOYSA-N	364.0915339							116996
2-Cyano-2-cyclohexylideneacetamide	LSM-28445	SID26662889, BRD-K04280992	263654	InChI=1S/C9H12N2O/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5H2,(H2,11,12)	HPLVMKGWFQBJOV-UHFFFAOYSA-N	NC(=O)C(=C1CCCCC1)C#N	BroadT	BRD-K04280992	BRD-K04280992-001-05-8	InterBioScreen Ltd.	STOCK1S-61676			NC(=O)C(C#N)=C1CCCCC1	InChI=1S/C9H12N2O/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5H2,(H2,11,12)	HPLVMKGWFQBJOV-UHFFFAOYSA-N	164.094963024							116997
ZINC03241194	LSM-28446	SID24827468, BRD-K62531497	2358682	InChI=1S/C14H9ClFNO3/c15-13-11(2-1-7-17-13)14(19)20-8-12(18)9-3-5-10(16)6-4-9/h1-7H,8H2	UCAQMCXKPORMFI-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)COC(=O)c2cccnc2Cl	BroadT	BRD-K62531497	BRD-K62531497-001-05-3	Enamine Ltd.	T0509-3340			Fc1ccc(cc1)C(=O)COC(=O)c1cccnc1Cl	InChI=1S/C14H9ClFNO3/c15-13-11(2-1-7-17-13)14(19)20-8-12(18)9-3-5-10(16)6-4-9/h1-7H,8H2	UCAQMCXKPORMFI-UHFFFAOYSA-N	293.025499068							116998
AN-689/41741299	LSM-28447	BRD-K23807074	1777758	InChI=1S/C30H23ClN4O3S/c1-37-25-16-12-22(13-17-25)32-27-28(33-23-14-18-26(38-2)19-15-23)35(29(36)20-8-10-21(31)11-9-20)30(39)34(27)24-6-4-3-5-7-24/h3-19H,1-2H3	USQMHIHTNWBJRO-UHFFFAOYSA-N	COc1ccc(cc1)N=C2N(C(=O)c3ccc(Cl)cc3)C(=S)N(C2=Nc4ccc(OC)cc4)c5ccccc5	BroadT	BRD-K23807074	BRD-K23807074-001-06-4	Specs	AN-689/41741299			COc1ccc(cc1)N=C1N(C(=O)c2ccc(Cl)cc2)C(=S)N(C1=Nc1ccc(OC)cc1)c1ccccc1	InChI=1S/C30H23ClN4O3S/c1-37-25-16-12-22(13-17-25)32-27-28(33-23-14-18-26(38-2)19-15-23)35(29(36)20-8-10-21(31)11-9-20)30(39)34(27)24-6-4-3-5-7-24/h3-19H,1-2H3	USQMHIHTNWBJRO-UHFFFAOYSA-N	554.117939036							116999
AP-906/41651019	LSM-28448	SID22404546, BRD-A23522475	4344962	InChI=1S/C19H25N3O4S2/c1-19(2,3)9-5-6-10-11(7-9)27-16(14(10)17(25)26-4)21-13(23)8-12-15(24)22-18(20)28-12/h9,12H,5-8H2,1-4H3,(H,21,23)(H2,20,22,24)	NBJBGYVZDDHBBX-UHFFFAOYSA-N	COC(=O)c1c(NC(=O)CC2SC(=NC2=O)N)sc3CC(CCc13)C(C)(C)C	BroadT	BRD-A23522475	BRD-A23522475-001-05-8	Enamine Ltd.	T0513-3689			COC(=O)c1c(NC(=O)CC2SC(N)=NC2=O)sc2CC(CCc12)C(C)(C)C	InChI=1S/C19H25N3O4S2/c1-19(2,3)9-5-6-10-11(7-9)27-16(14(10)17(25)26-4)21-13(23)8-12-15(24)22-18(20)28-12/h9,12H,5-8H2,1-4H3,(H,21,23)(H2,20,22,24)	NBJBGYVZDDHBBX-UHFFFAOYSA-N	423.12864769							117000
ST50928709	LSM-44276	SID14731871, BRD-K87186428	898593	InChI=1S/C14H14N2O2/c1-10-3-5-12(6-4-10)7-8-14(17)15-13-9-11(2)18-16-13/h3-9H,1-2H3,(H,15,16,17)/b8-7+	KTIRLSQWNNDYJT-BQYQJAHWSA-N	Cc1onc(NC(=O)\C=C\c2ccc(C)cc2)c1	BroadT	BRD-K87186428	BRD-K87186428-001-05-1	ChemBridge Corporation	7280745			Cc1cc(NC(=O)\C=C\c2ccc(C)cc2)no1	InChI=1S/C14H14N2O2/c1-10-3-5-12(6-4-10)7-8-14(17)15-13-9-11(2)18-16-13/h3-9H,1-2H3,(H,15,16,17)/b8-7+	KTIRLSQWNNDYJT-BQYQJAHWSA-N	242.105527708							
SMR000026482	LSM-28450	SID4251724, BRD-K50990533	3245377	InChI=1S/C20H25N3O5S/c1-15(24)23-18-8-10-19(11-9-18)29(26,27)22-14-16-4-6-17(7-5-16)20(25)21-12-3-13-28-2/h4-11,22H,3,12-14H2,1-2H3,(H,21,25)(H,23,24)	DMJKMNFCLJSTML-UHFFFAOYSA-N	COCCCNC(=O)c1ccc(CNS(=O)(=O)c2ccc(NC(=O)C)cc2)cc1	BroadT	BRD-K50990533	BRD-K50990533-001-04-4	ChemDiv Inc.	C382-0407			COCCCNC(=O)c1ccc(CNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1	InChI=1S/C20H25N3O5S/c1-15(24)23-18-8-10-19(11-9-18)29(26,27)22-14-16-4-6-17(7-5-16)20(25)21-12-3-13-28-2/h4-11,22H,3,12-14H2,1-2H3,(H,21,25)(H,23,24)	DMJKMNFCLJSTML-UHFFFAOYSA-N	419.15149162							117002
SMR000096635	LSM-28451	SID24839149, SID7966762, BRD-K05133532	5308427	InChI=1S/C24H28N4O2S/c1-30-20-7-5-6-19(17-20)26-12-14-27(15-13-26)23(29)18-8-9-21-22(16-18)31-24(25-21)28-10-3-2-4-11-28/h5-9,16-17H,2-4,10-15H2,1H3	FFFRXIWAOZKWPF-UHFFFAOYSA-N	COc1cccc(c1)N2CCN(CC2)C(=O)c3ccc4nc(sc4c3)N5CCCCC5	BroadT	BRD-K05133532	BRD-K05133532-001-04-8	ChemDiv Inc.	C858-0840			COc1cccc(c1)N1CCN(CC1)C(=O)c1ccc2nc(sc2c1)N1CCCCC1	InChI=1S/C24H28N4O2S/c1-30-20-7-5-6-19(17-20)26-12-14-27(15-13-26)23(29)18-8-9-21-22(16-18)31-24(25-21)28-10-3-2-4-11-28/h5-9,16-17H,2-4,10-15H2,1H3	FFFRXIWAOZKWPF-UHFFFAOYSA-N	436.193296866							117003
ASN 04362797	LSM-28452	SID24790110, BRD-K70397746	1167955	InChI=1S/C23H15F2N3O3S/c24-15-6-4-13(5-7-15)21-27-19-9-8-16(25)11-18(19)22(28-21)32-12-20(29)26-17-3-1-2-14(10-17)23(30)31/h1-11H,12H2,(H,26,29)(H,30,31)	QOKUVHNXTSLISH-UHFFFAOYSA-N	OC(=O)c1cccc(NC(=O)CSc2nc(nc3ccc(F)cc23)c4ccc(F)cc4)c1	BroadT	BRD-K70397746	BRD-K70397746-001-05-8	Asinex Ltd.	ASN 04362797			OC(=O)c1cccc(NC(=O)CSc2nc(nc3ccc(F)cc23)-c2ccc(F)cc2)c1	InChI=1S/C23H15F2N3O3S/c24-15-6-4-13(5-7-15)21-27-19-9-8-16(25)11-18(19)22(28-21)32-12-20(29)26-17-3-1-2-14(10-17)23(30)31/h1-11H,12H2,(H,26,29)(H,30,31)	QOKUVHNXTSLISH-UHFFFAOYSA-N	451.08021846							117004
MLS000555985	LSM-28453	SID14741021, BRD-K34275675	1005145	InChI=1S/C19H16N4OS2/c20-8-12-7-11-3-1-5-15(11)22-18(12)25-10-17(24)23-19-14(9-21)13-4-2-6-16(13)26-19/h7H,1-6,10H2,(H,23,24)	ZUNCVCXRYKEVJB-UHFFFAOYSA-N	O=C(CSc1nc2CCCc2cc1C#N)Nc3sc4CCCc4c3C#N	BroadT	BRD-K34275675	BRD-K34275675-001-06-4	InterBioScreen Ltd.	STOCK2S-97147			O=C(CSc1nc2CCCc2cc1C#N)Nc1sc2CCCc2c1C#N	InChI=1S/C19H16N4OS2/c20-8-12-7-11-3-1-5-15(11)22-18(12)25-10-17(24)23-19-14(9-21)13-4-2-6-16(13)26-19/h7H,1-6,10H2,(H,23,24)	ZUNCVCXRYKEVJB-UHFFFAOYSA-N	380.076552552							117005
1-(Azepan-1-yl)-2-(4-bromophenyl)ethanone	LSM-28454	SID4257005, BRD-K05018271	875268	InChI=1S/C14H18BrNO/c15-13-7-5-12(6-8-13)11-14(17)16-9-3-1-2-4-10-16/h5-8H,1-4,9-11H2	MDSQYPIECGFRON-UHFFFAOYSA-N	Brc1ccc(CC(=O)N2CCCCCC2)cc1	BroadT	BRD-K05018271	BRD-K05018271-001-05-3	ChemBridge Corporation	6169390			Brc1ccc(CC(=O)N2CCCCCC2)cc1	InChI=1S/C14H18BrNO/c15-13-7-5-12(6-8-13)11-14(17)16-9-3-1-2-4-10-16/h5-8H,1-4,9-11H2	MDSQYPIECGFRON-UHFFFAOYSA-N	295.057176806							117006
2-Methyl-3,7-diphenylpyrazolo[1,5-a]pyrimidine	LSM-28455	SID17386748, BRD-K40173101	830522	InChI=1S/C19H15N3/c1-14-18(16-10-6-3-7-11-16)19-20-13-12-17(22(19)21-14)15-8-4-2-5-9-15/h2-13H,1H3	ZLFMVTBYEJFZAI-UHFFFAOYSA-N	Cc1nn2c(ccnc2c1c3ccccc3)c4ccccc4	BroadT	BRD-K40173101	BRD-K40173101-001-05-9	Specs	AF-665/30621059			Cc1nn2c(ccnc2c1-c1ccccc1)-c1ccccc1	InChI=1S/C19H15N3/c1-14-18(16-10-6-3-7-11-16)19-20-13-12-17(22(19)21-14)15-8-4-2-5-9-15/h2-13H,1H3	ZLFMVTBYEJFZAI-UHFFFAOYSA-N	285.12659751							117007
T5322054	LSM-28456	SID24835727, BRD-K49967730	2507089	InChI=1S/C15H13NO2S2/c1-17-12-6-5-10(8-13(12)18-2)11-9-20-15(16-11)14-4-3-7-19-14/h3-9H,1-2H3	HUIMOYYPZDEASW-UHFFFAOYSA-N	COc1ccc(cc1OC)c2csc(n2)c3cccs3	BroadT	BRD-K49967730	BRD-K49967730-001-05-4	Enamine Ltd.	T5322054			COc1ccc(cc1OC)-c1csc(n1)-c1cccs1	InChI=1S/C15H13NO2S2/c1-17-12-6-5-10(8-13(12)18-2)11-9-20-15(16-11)14-4-3-7-19-14/h3-9H,1-2H3	HUIMOYYPZDEASW-UHFFFAOYSA-N	303.038770046							117008
ST008584	LSM-28457	SID14746876, BRD-K60975481	2164596	InChI=1S/C12H16N2O3/c1-9(15)14-11-5-3-10(4-6-11)12(16)13-7-8-17-2/h3-6H,7-8H2,1-2H3,(H,13,16)(H,14,15)	SLNZOJDVJKGVRO-UHFFFAOYSA-N	COCCNC(=O)c1ccc(NC(=O)C)cc1	BroadT	BRD-K60975481	BRD-K60975481-001-05-2	Enamine Ltd.	T5220788			COCCNC(=O)c1ccc(NC(C)=O)cc1	InChI=1S/C12H16N2O3/c1-9(15)14-11-5-3-10(4-6-11)12(16)13-7-8-17-2/h3-6H,7-8H2,1-2H3,(H,13,16)(H,14,15)	SLNZOJDVJKGVRO-UHFFFAOYSA-N	236.116092392							117009
F0695-0261	LSM-28458	SID14732732, BRD-K77658510	9550275	InChI=1S/C21H17N3O4S2/c1-13-4-5-14(20-23-16-3-2-8-22-21(16)29-20)11-17(13)24-30(25,26)15-6-7-18-19(12-15)28-10-9-27-18/h2-8,11-12,24H,9-10H2,1H3	MRGGLPVOIYGMLU-UHFFFAOYSA-N	Cc1ccc(cc1NS(=O)(=O)c2ccc3OCCOc3c2)c4nc5cccnc5s4	BroadT	BRD-K77658510	BRD-K77658510-001-05-0	Life Chemicals Inc.	F0695-0261			Cc1ccc(cc1NS(=O)(=O)c1ccc2OCCOc2c1)-c1nc2cccnc2s1	InChI=1S/C21H17N3O4S2/c1-13-4-5-14(20-23-16-3-2-8-22-21(16)29-20)11-17(13)24-30(25,26)15-6-7-18-19(12-15)28-10-9-27-18/h2-8,11-12,24H,9-10H2,1H3	MRGGLPVOIYGMLU-UHFFFAOYSA-N	439.066047434							117010
AC1O9OIE	LSM-28459	SID24829524, BRD-K45717650	6789485	InChI=1S/C14H8FN3OS/c1-7-6-20-14(17-7)10(5-16)12-9-4-8(15)2-3-11(9)18-13(12)19/h2-4,6H,1H3,(H,18,19)/b12-10-	LJGHSLYZFGOUGX-BENRWUELSA-N	Cc1csc(n1)\C(=C\2/C(=O)Nc3ccc(F)cc23)\C#N	BroadT	BRD-K45717650	BRD-K45717650-001-06-1	Enamine Ltd.	T0501-9235			Cc1csc(n1)C(\C#N)=C1/C(=O)Nc2ccc(F)cc12	InChI=1S/C14H8FN3OS/c1-7-6-20-14(17-7)10(5-16)12-9-4-8(15)2-3-11(9)18-13(12)19/h2-4,6H,1H3,(H,18,19)/b12-10-	LJGHSLYZFGOUGX-BENRWUELSA-N	285.037210796							
AN-979/42723120	LSM-28460	SID14719277, BRD-A24130466	2993319	InChI=1S/C18H15ClN2O3/c19-12-5-8-15-14(10-12)21-18(24-15)11-3-6-13(7-4-11)20-17(22)16-2-1-9-23-16/h3-8,10,16H,1-2,9H2,(H,20,22)	BXJOSLTZPOCOMF-UHFFFAOYSA-N	Clc1ccc2oc(nc2c1)c3ccc(NC(=O)C4CCCO4)cc3	BroadT	BRD-A24130466	BRD-A24130466-001-05-0	Specs	AN-979/42723120			Clc1ccc2oc(nc2c1)-c1ccc(NC(=O)C2CCCO2)cc1	InChI=1S/C18H15ClN2O3/c19-12-5-8-15-14(10-12)21-18(24-15)11-3-6-13(7-4-11)20-17(22)16-2-1-9-23-16/h3-8,10,16H,1-2,9H2,(H,20,22)	BXJOSLTZPOCOMF-UHFFFAOYSA-N	342.07712007							117012
ZINC01134192	LSM-28461	SID24782728, BRD-K61340669	1308592	InChI=1S/C25H22BrNO3/c26-17-14-15(12-13-20(17)28)23-24-18(8-4-10-21(24)29)27(16-6-2-1-3-7-16)19-9-5-11-22(30)25(19)23/h1-3,6-7,12-14,23,28H,4-5,8-11H2	WYYRSVLMNFELDT-UHFFFAOYSA-N	Oc1ccc(cc1Br)C2C3=C(CCCC3=O)N(C4=C2C(=O)CCC4)c5ccccc5	BroadT	BRD-K61340669	BRD-K61340669-001-05-2	ChemBridge Corporation	7435841			Oc1ccc(cc1Br)C1C2=C(CCCC2=O)N(c2ccccc2)C2=C1C(=O)CCC2	InChI=1S/C25H22BrNO3/c26-17-14-15(12-13-20(17)28)23-24-18(8-4-10-21(24)29)27(16-6-2-1-3-7-16)19-9-5-11-22(30)25(19)23/h1-3,6-7,12-14,23,28H,4-5,8-11H2	WYYRSVLMNFELDT-UHFFFAOYSA-N	463.078306174							117013
AN-329/41561841	LSM-28462	SID22413409, BRD-A04016280	4027649	InChI=1S/C14H17BrN2O2S/c1-9-4-5-10(7-12(9)15)13(18)17-14(20)16-8-11-3-2-6-19-11/h4-5,7,11H,2-3,6,8H2,1H3,(H2,16,17,18,20)	GYFPNLKGCLBUDZ-UHFFFAOYSA-N	Cc1ccc(cc1Br)C(=O)NC(=S)NCC2CCCO2	BroadT	BRD-A04016280	BRD-A04016280-001-06-7	Specs	AN-329/41561841			Cc1ccc(cc1Br)C(=O)NC(=S)NCC1CCCO1	InChI=1S/C14H17BrN2O2S/c1-9-4-5-10(7-12(9)15)13(18)17-14(20)16-8-11-3-2-6-19-11/h4-5,7,11H,2-3,6,8H2,1H3,(H2,16,17,18,20)	GYFPNLKGCLBUDZ-UHFFFAOYSA-N	356.019411094							117014
AC1M55MD	LSM-28463	SID104219311, SID22409885, BRD-K19008962	2322338	InChI=1S/C16H14N4O/c1-11-7-8-13-14(9-11)17-10-15(16(21)18-13)20-19-12-5-3-2-4-6-12/h2-10,19H,1H3,(H,18,20,21)	AUGULEYODXXYMM-UHFFFAOYSA-N	Cc1ccc2NC(=O)C(=NNc3ccccc3)C=Nc2c1	BroadT	BRD-K19008962	BRD-K19008962-001-05-2	Enamine Ltd.	T0504-1219			Cc1ccc2[nH]c(=O)c(cnc2c1)=NNc1ccccc1	InChI=1S/C16H14N4O/c1-11-7-8-13-14(9-11)17-10-15(16(21)18-13)20-19-12-5-3-2-4-6-12/h2-10,19H,1H3,(H,18,20,21)	AUGULEYODXXYMM-UHFFFAOYSA-N	278.116761108							117015
SMR000024191	LSM-28464	BRD-K70642393	3236505	InChI=1S/C16H18N2O4S/c1-5-22-15(20)13-10(2)18(3)16(23-13)17-14(19)11-7-6-8-12(9-11)21-4/h6-9H,5H2,1-4H3	LRGNZPRZUQBJIQ-UHFFFAOYSA-N	CCOC(=O)C1=C(C)N(C)C(=NC(=O)c2cccc(OC)c2)S1	BroadT	BRD-K70642393	BRD-K70642393-001-05-3	ChemDiv Inc.	3338-4155			CCOC(=O)c1sc(=NC(=O)c2cccc(OC)c2)n(C)c1C	InChI=1S/C16H18N2O4S/c1-5-22-15(20)13-10(2)18(3)16(23-13)17-14(19)11-7-6-8-12(9-11)21-4/h6-9H,5H2,1-4H3	LRGNZPRZUQBJIQ-UHFFFAOYSA-N	334.098727766							117016
MLS000076386	LSM-28465	SID848616, BRD-A42719033	651069	InChI=1S/C14H15N3O2S/c1-9-2-4-10(5-3-9)16-12(18)8-11-13(19)17-7-6-15-14(17)20-11/h2-5,11H,6-8H2,1H3,(H,16,18)	RNSVCUZWUDAURS-UHFFFAOYSA-N	Cc1ccc(NC(=O)CC2SC3=NCCN3C2=O)cc1	BroadT	BRD-A42719033	BRD-A42719033-001-05-2	Asinex Ltd.	BAS 08951446			Cc1ccc(NC(=O)CC2SC3=NCCN3C2=O)cc1	InChI=1S/C14H15N3O2S/c1-9-2-4-10(5-3-9)16-12(18)8-11-13(19)17-7-6-15-14(17)20-11/h2-5,11H,6-8H2,1H3,(H,16,18)	RNSVCUZWUDAURS-UHFFFAOYSA-N	289.08849744							117017
ST50294076	LSM-28466	SID49729438, BRD-K49142142	3163460	InChI=1S/C12H10F3N3O3S2/c13-12(14,15)10-17-18-11(22-10)16-9(19)6-7-23(20,21)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,16,18,19)	CCCATGIKOOKEOK-UHFFFAOYSA-N	FC(F)(F)c1nnc(NC(=O)CCS(=O)(=O)c2ccccc2)s1	BroadT	BRD-K49142142	BRD-K49142142-001-06-4	Asinex Ltd.	BAS 12772327			FC(F)(F)c1nnc(NC(=O)CCS(=O)(=O)c2ccccc2)s1	InChI=1S/C12H10F3N3O3S2/c13-12(14,15)10-17-18-11(22-10)16-9(19)6-7-23(20,21)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,16,18,19)	CCCATGIKOOKEOK-UHFFFAOYSA-N	365.01156719							117018
6-(Azepan-1-yl)phenanthridine	LSM-15509	BRD-K08727563	871548	InChI=1S/C19H20N2/c1-2-8-14-21(13-7-1)19-17-11-4-3-9-15(17)16-10-5-6-12-18(16)20-19/h3-6,9-12H,1-2,7-8,13-14H2	KWRPLALZCYOWQM-UHFFFAOYSA-N	C1CCCN(CC1)c2nc3ccccc3c4ccccc24	BroadT	BRD-K08727563	BRD-K08727563-005-05-4	InterBioScreen Ltd.	STOCK2S-95350		I	C1CCCN(CC1)c1nc2ccccc2c2ccccc12.I	InChI=1S/C19H20N2.HI/c1-2-8-14-21(13-7-1)19-17-11-4-3-9-15(17)16-10-5-6-12-18(16)20-19;/h3-6,9-12H,1-2,7-8,13-14H2;1H	MYRIUSPZMUGCLS-UHFFFAOYSA-N	276.16264866							104150, 104150
SMR000113939	LSM-28467	SID14718750, BRD-K20125127	1202611	InChI=1S/C20H21NO3/c1-24-14-10-8-13(9-11-14)21-17-4-2-6-19(22)15(17)12-16-18(21)5-3-7-20(16)23/h8-11H,2-7,12H2,1H3	DAYLYXGTFXGDOM-UHFFFAOYSA-N	COc1ccc(cc1)N2C3=C(CC4=C2CCCC4=O)C(=O)CCC3	BroadT	BRD-K20125127	BRD-K20125127-001-05-3	Specs	AE-842/34027009			COc1ccc(cc1)N1C2=C(CC3=C1CCCC3=O)C(=O)CCC2	InChI=1S/C20H21NO3/c1-24-14-10-8-13(9-11-14)21-17-4-2-6-19(22)15(17)12-16-18(21)5-3-7-20(16)23/h8-11H,2-7,12H2,1H3	DAYLYXGTFXGDOM-UHFFFAOYSA-N	323.152143542							117019
F0683-0337	LSM-28468	SID7970783, BRD-K44140100	5310303	InChI=1S/C19H14ClN5O2/c1-10-5-4-6-11(9-10)25-18-15(23-19(25)27)14(16(21)26)22-17(24-18)12-7-2-3-8-13(12)20/h2-9H,1H3,(H2,21,26)(H,23,27)	VHMKHPSWWIOTKE-UHFFFAOYSA-N	Cc1cccc(c1)n2c(O)nc3c(nc(nc23)c4ccccc4Cl)C(=O)N	BroadT	BRD-K44140100	BRD-K44140100-001-04-8	Life Chemicals Inc.	F0683-0337			Cc1cccc(c1)-n1c(O)nc2c(nc(nc12)-c1ccccc1Cl)C(N)=O	InChI=1S/C19H14ClN5O2/c1-10-5-4-6-11(9-10)25-18-15(23-19(25)27)14(16(21)26)22-17(24-18)12-7-2-3-8-13(12)20/h2-9H,1H3,(H2,21,26)(H,23,27)	VHMKHPSWWIOTKE-UHFFFAOYSA-N	379.083602448							117020
TCMDC-123910	LSM-28469	BRD-K95882038	1449937	InChI=1S/C25H26N4O3/c1-25(2,3)22-19-12-17(14-26-13-16-9-10-20-21(11-16)32-15-31-20)24(30)27-23(19)29(28-22)18-7-5-4-6-8-18/h4-12,26H,13-15H2,1-3H3,(H,27,30)	BFNFGKQFSSNIEE-UHFFFAOYSA-N	CC(C)(C)c1nn(c2ccccc2)c3nc(O)c(CNCc4ccc5OCOc5c4)cc13	BroadT	BRD-K95882038	BRD-K95882038-001-05-7	Asinex Ltd.	ASN 09984034			CC(C)(C)c1nn(-c2ccccc2)c2nc(O)c(CNCc3ccc4OCOc4c3)cc12	InChI=1S/C25H26N4O3/c1-25(2,3)22-19-12-17(14-26-13-16-9-10-20-21(11-16)32-15-31-20)24(30)27-23(19)29(28-22)18-7-5-4-6-8-18/h4-12,26H,13-15H2,1-3H3,(H,27,30)	BFNFGKQFSSNIEE-UHFFFAOYSA-N	430.200490732							
AH-487/42819986	LSM-28470	SID17406609, BRD-K37514286	1008048	InChI=1S/C20H18ClNO3/c1-24-18-11-15(10-17(21)19(18)25-2)20(23)22-12-14-8-5-7-13-6-3-4-9-16(13)14/h3-11H,12H2,1-2H3,(H,22,23)	YZQPPMTUBHYEBE-UHFFFAOYSA-N	COc1cc(cc(Cl)c1OC)C(=O)NCc2cccc3ccccc23	BroadT	BRD-K37514286	BRD-K37514286-001-05-6	Specs	AH-487/42819986			COc1cc(cc(Cl)c1OC)C(=O)NCc1cccc2ccccc12	InChI=1S/C20H18ClNO3/c1-24-18-11-15(10-17(21)19(18)25-2)20(23)22-12-14-8-5-7-13-6-3-4-9-16(13)14/h3-11H,12H2,1-2H3,(H,22,23)	YZQPPMTUBHYEBE-UHFFFAOYSA-N	355.097521156							117022
AC1MWH7X	LSM-28471	SID104219729, SID26662809, BRD-A62272684	3724061	InChI=1S/C24H32N2O2/c1-3-5-15-25(16-6-4-2)17-19(27)18-26-22-13-9-7-11-20(22)24(28)21-12-8-10-14-23(21)26/h7-14,19,27H,3-6,15-18H2,1-2H3	UNRVBUZHKLLCHZ-UHFFFAOYSA-N	CCCCN(CCCC)CC(O)CN1c2ccccc2C(=O)c3ccccc13	BroadT	BRD-A62272684	BRD-A62272684-001-04-2	InterBioScreen Ltd.	STOCK1S-65094			CCCCN(CCCC)CC(O)Cn1c2ccccc2c(=O)c2ccccc12	InChI=1S/C24H32N2O2/c1-3-5-15-25(16-6-4-2)17-19(27)18-26-22-13-9-7-11-20(22)24(28)21-12-8-10-14-23(21)26/h7-14,19,27H,3-6,15-18H2,1-2H3	UNRVBUZHKLLCHZ-UHFFFAOYSA-N	380.246378284							117023
ST50889965	LSM-28472	SID49819232, SID85281153, BRD-K54589752	1261655	InChI=1S/C28H27ClN4O/c1-19-15-20(2)27-23(16-19)24(17-26(31-27)21-7-9-30-10-8-21)28(34)33-13-11-32(12-14-33)18-22-5-3-4-6-25(22)29/h3-10,15-17H,11-14,18H2,1-2H3	GIFWDRNCIBUXRZ-UHFFFAOYSA-N	Cc1cc(C)c2nc(cc(C(=O)N3CCN(Cc4ccccc4Cl)CC3)c2c1)c5ccncc5	BroadT	BRD-K54589752	BRD-K54589752-001-09-3	ChemBridge Corporation	7923712			Cc1cc(C)c2nc(cc(C(=O)N3CCN(Cc4ccccc4Cl)CC3)c2c1)-c1ccncc1	InChI=1S/C28H27ClN4O/c1-19-15-20(2)27-23(16-19)24(17-26(31-27)21-7-9-30-10-8-21)28(34)33-13-11-32(12-14-33)18-22-5-3-4-6-25(22)29/h3-10,15-17H,11-14,18H2,1-2H3	GIFWDRNCIBUXRZ-UHFFFAOYSA-N	470.187339234							117024
MLS000737959	LSM-28473	SID26665837, BRD-K96090553	223812	InChI=1S/C10H8N6O/c11-10-12-8-7(9(17)13-10)14-16(15-8)6-4-2-1-3-5-6/h1-5H,(H3,11,12,13,15,17)	OIAXNBVLMBXWJU-UHFFFAOYSA-N	Nc1nc(O)c2nn(nc2n1)c3ccccc3	BroadT	BRD-K96090553	BRD-K96090553-001-05-1	National Cancer Institute Chemotherapeutic Agents Repository	11826			Nc1nc(O)c2nn(nc2n1)-c1ccccc1	InChI=1S/C10H8N6O/c11-10-12-8-7(9(17)13-10)14-16(15-8)6-4-2-1-3-5-6/h1-5H,(H3,11,12,13,15,17)	OIAXNBVLMBXWJU-UHFFFAOYSA-N	228.075958936							117025
MLS000704121	LSM-28474	SID24797434, BRD-K33707112	1768080	InChI=1S/C11H15N3S2/c1-3-4-6-14-10(12-13-11(14)15)9-8(2)5-7-16-9/h5,7H,3-4,6H2,1-2H3,(H,13,15)	PSVVSLLPQAWRLG-UHFFFAOYSA-N	CCCCn1c(S)nnc1c2sccc2C	BroadT	BRD-K33707112	BRD-K33707112-001-06-8	Specs	AK-968/41924711			CCCCn1c(S)nnc1-c1sccc1C	InChI=1S/C11H15N3S2/c1-3-4-6-14-10(12-13-11(14)15)9-8(2)5-7-16-9/h5,7H,3-4,6H2,1-2H3,(H,13,15)	PSVVSLLPQAWRLG-UHFFFAOYSA-N	253.07073889							117026
CBDIVE_011055	LSM-28475	BRD-K58330963	2837375	InChI=1S/C11H11N7O4/c1-7(6-17-15-11(14-16-17)18(21)22)12-13-10(20)8-4-2-3-5-9(8)19/h2-5,19H,6H2,1H3,(H,13,20)	XGSLUVVSOPYNSC-UHFFFAOYSA-N	CC(=NNC(=O)c1ccccc1O)Cn2nnc(n2)[N+](=O)[O-]	BroadT	BRD-K58330963	BRD-K58330963-001-05-1	InterBioScreen Ltd.	STOCK1S-93535			CC(Cn1nnc(n1)[N+]([O-])=O)=NNC(=O)c1ccccc1O	InChI=1S/C11H11N7O4/c1-7(6-17-15-11(14-16-17)18(21)22)12-13-10(20)8-4-2-3-5-9(8)19/h2-5,19H,6H2,1H3,(H,13,20)	XGSLUVVSOPYNSC-UHFFFAOYSA-N	305.087251902							117027
MLS000072567	LSM-28476	SID851429, BRD-K21283240	573814	InChI=1S/C11H17N3O2/c1-5-9(15)12-11-7(3)13-14(8(11)4)10(16)6-2/h5-6H2,1-4H3,(H,12,15)	NFAOTCNRWDCIRV-UHFFFAOYSA-N	CCC(=O)Nc1c(C)nn(C(=O)CC)c1C	BroadT	BRD-K21283240	BRD-K21283240-001-06-9	Asinex Ltd.	BAS 00632760			CCC(=O)Nc1c(C)nn(C(=O)CC)c1C	InChI=1S/C11H17N3O2/c1-5-9(15)12-11-7(3)13-14(8(11)4)10(16)6-2/h5-6H2,1-4H3,(H,12,15)	NFAOTCNRWDCIRV-UHFFFAOYSA-N	223.132076814							117028
Pyridin-2-ylmethyl n-(3-chlorophenyl)carbamate	LSM-28477	SID857598, BRD-K14444004	232341	InChI=1S/C13H11ClN2O2/c14-10-4-3-6-11(8-10)16-13(17)18-9-12-5-1-2-7-15-12/h1-8H,9H2,(H,16,17)	ZIGYPLJRVSVUIL-UHFFFAOYSA-N	Clc1cccc(NC(=O)OCc2ccccn2)c1	BroadT	BRD-K14444004	BRD-K14444004-001-05-4	InterBioScreen Ltd.	STOCK1S-82393			Clc1cccc(NC(=O)OCc2ccccn2)c1	InChI=1S/C13H11ClN2O2/c14-10-4-3-6-11(8-10)16-13(17)18-9-12-5-1-2-7-15-12/h1-8H,9H2,(H,16,17)	ZIGYPLJRVSVUIL-UHFFFAOYSA-N	262.050905322							117029
BAS 06701710	LSM-28478	SID24790256, BRD-K36607921	1085415	InChI=1S/C18H23N3O3S/c1-13-9-14(2)18(15(3)10-13)25(23,24)21(4)12-17(22)20-11-16-7-5-6-8-19-16/h5-10H,11-12H2,1-4H3,(H,20,22)	CHHGIPFOFFHDOQ-UHFFFAOYSA-N	CN(CC(=O)NCc1ccccn1)S(=O)(=O)c2c(C)cc(C)cc2C	BroadT	BRD-K36607921	BRD-K36607921-001-05-0	Asinex Ltd.	BAS 06701710			CN(CC(=O)NCc1ccccn1)S(=O)(=O)c1c(C)cc(C)cc1C	InChI=1S/C18H23N3O3S/c1-13-9-14(2)18(15(3)10-13)25(23,24)21(4)12-17(22)20-11-16-7-5-6-8-19-16/h5-10H,11-12H2,1-4H3,(H,20,22)	CHHGIPFOFFHDOQ-UHFFFAOYSA-N	361.146012316							117030
MLS000680373	LSM-28479	SID24788826, BRD-K82152586	5083849	InChI=1S/C17H16N4O5S/c22-15(18-17-20-19-16(26-17)14-4-3-11-25-14)12-5-7-13(8-6-12)27(23,24)21-9-1-2-10-21/h3-8,11H,1-2,9-10H2,(H,18,20,22)	JRQNLDYCUYPJAL-UHFFFAOYSA-N	O=C(Nc1oc(nn1)c2occc2)c3ccc(cc3)S(=O)(=O)N4CCCC4	BroadT	BRD-K82152586	BRD-K82152586-001-06-4	Life Chemicals Inc.	F0608-0427			O=C(Nc1nnc(o1)-c1ccco1)c1ccc(cc1)S(=O)(=O)N1CCCC1	InChI=1S/C17H16N4O5S/c22-15(18-17-20-19-16(26-17)14-4-3-11-25-14)12-5-7-13(8-6-12)27(23,24)21-9-1-2-10-21/h3-8,11H,1-2,9-10H2,(H,18,20,22)	JRQNLDYCUYPJAL-UHFFFAOYSA-N	388.084140342							117031
STK568863	LSM-28480	SID862737, BRD-K24177934	663971	InChI=1S/C18H19N5O2S2/c1-3-4-7-10-23-13-14(22(2)16(25)21-15(13)24)20-17(23)27-18-19-11-8-5-6-9-12(11)26-18/h5-6,8-9H,3-4,7,10H2,1-2H3,(H,21,24,25)	IRSCSUYQQBSTMS-UHFFFAOYSA-N	CCCCCn1c(Sc2nc3ccccc3s2)nc4N(C)C(=O)NC(=O)c14	BroadT	BRD-K24177934	BRD-K24177934-001-05-3	InterBioScreen Ltd.	STOCK4S-55282			CCCCCn1c(Sc2nc3ccccc3s2)nc2n(C)c(=O)[nH]c(=O)c12	InChI=1S/C18H19N5O2S2/c1-3-4-7-10-23-13-14(22(2)16(25)21-15(13)24)20-17(23)27-18-19-11-8-5-6-9-12(11)26-18/h5-6,8-9H,3-4,7,10H2,1-2H3,(H,21,24,25)	IRSCSUYQQBSTMS-UHFFFAOYSA-N	401.098016278							117032
MLS000026806	LSM-28481	SID842197, BRD-K37176770	644452	InChI=1S/C25H28N6O/c1-18-8-7-11-20-14-21(25(32)26-24(18)20)16-30(22-12-5-6-13-22)17-23-27-28-29-31(23)15-19-9-3-2-4-10-19/h2-4,7-11,14,22H,5-6,12-13,15-17H2,1H3,(H,26,32)	GKUQGTGAOFCZFJ-UHFFFAOYSA-N	Cc1cccc2cc(CN(Cc3nnnn3Cc4ccccc4)C5CCCC5)c(O)nc12	BroadT	BRD-K37176770	BRD-K37176770-001-05-7	Asinex Ltd.	ASN 04369420			Cc1cccc2cc(CN(Cc3nnnn3Cc3ccccc3)C3CCCC3)c(O)nc12	InChI=1S/C25H28N6O/c1-18-8-7-11-20-14-21(25(32)26-24(18)20)16-30(22-12-5-6-13-22)17-23-27-28-29-31(23)15-19-9-3-2-4-10-19/h2-4,7-11,14,22H,5-6,12-13,15-17H2,1H3,(H,26,32)	GKUQGTGAOFCZFJ-UHFFFAOYSA-N	428.232459576							117033
BRD-A61745192	LSM-28482			InChI=1S/C23H20N2O6/c1-13-12-18(24-31-13)25-20(16-6-4-5-7-17(16)30-3)19(22(27)23(25)28)21(26)14-8-10-15(29-2)11-9-14/h4-12,19-20H,1-3H3	DOLOWUAGPILZPY-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)C2C(N(C(=O)C2=O)c3cc(C)on3)c4ccccc4OC	BroadT	BRD-A61745192	BRD-A61745192-001-05-0	InterBioScreen Ltd.	STOCK3S-81396			COc1ccc(cc1)C(=O)C1C(N(c2cc(C)on2)C(=O)C1=O)c1ccccc1OC	InChI=1S/C23H20N2O6/c1-13-12-18(24-31-13)25-20(16-6-4-5-7-17(16)30-3)19(22(27)23(25)28)21(26)14-8-10-15(29-2)11-9-14/h4-12,19-20H,1-3H3	DOLOWUAGPILZPY-UHFFFAOYSA-N	420.13213638							117034
T0512-5413	LSM-28483	SID22406019, BRD-A26785111	4549382	InChI=1S/C22H28N4O4S2/c1-30-22(29)14-12-9-5-6-10-13(12)31-20(14)26-19(28)17-16(23)15(18(24)27)21(32-17)25-11-7-3-2-4-8-11/h11,17,23,25H,2-10H2,1H3,(H2,24,27)(H,26,28)	AJRMZGJRUZQQIJ-UHFFFAOYSA-N	COC(=O)c1c2CCCCc2sc1NC(=O)C3SC(=C(C(=O)N)C3=N)NC4CCCCC4	BroadT	BRD-A26785111	BRD-A26785111-001-05-8	Enamine Ltd.	T0512-5413			COC(=O)c1c(NC(=O)C2SC(NC3CCCCC3)=C(C(N)=O)C2=N)sc2CCCCc12	InChI=1S/C22H28N4O4S2/c1-30-22(29)14-12-9-5-6-10-13(12)31-20(14)26-19(28)17-16(23)15(18(24)27)21(32-17)25-11-7-3-2-4-8-11/h11,17,23,25H,2-10H2,1H3,(H2,24,27)(H,26,28)	AJRMZGJRUZQQIJ-UHFFFAOYSA-N	476.155196796							
MLS000687552	LSM-44277	SID24806749, BRD-K43899753	787855	InChI=1S/C16H14FN3O/c1-10-7-12(11(2)19-10)8-13(9-18)16(21)20-15-6-4-3-5-14(15)17/h3-8,19H,1-2H3,(H,20,21)/b13-8+	LBGROOQYAQOVFL-MDWZMJQESA-N	Cc1cc(\C=C(/C#N)\C(=O)Nc2ccccc2F)c(C)[nH]1	BroadT	BRD-K43899753	BRD-K43899753-001-05-7	Asinex Ltd.	BAS 02987048			Cc1cc(\C=C(/C#N)C(=O)Nc2ccccc2F)c(C)[nH]1	InChI=1S/C16H14FN3O/c1-10-7-12(11(2)19-10)8-13(9-18)16(21)20-15-6-4-3-5-14(15)17/h3-8,19H,1-2H3,(H,20,21)/b13-8+	LBGROOQYAQOVFL-MDWZMJQESA-N	283.112090298							
ST073473	LSM-28485	BRD-K24557107, SID849323	651812	InChI=1S/C20H17N3O4/c1-22-17(24)14-8-4-9-15(16(14)20(22)27)21-10-5-11-23-18(25)12-6-2-3-7-13(12)19(23)26/h2-4,6-9,21H,5,10-11H2,1H3	VDIAQKCISZOWEH-UHFFFAOYSA-N	CN1C(=O)c2cccc(NCCCN3C(=O)c4ccccc4C3=O)c2C1=O	BroadT	BRD-K24557107	BRD-K24557107-001-05-7	Asinex Ltd.	BAS 02592337			CN1C(=O)c2cccc(NCCCN3C(=O)c4ccccc4C3=O)c2C1=O	InChI=1S/C20H17N3O4/c1-22-17(24)14-8-4-9-15(16(14)20(22)27)21-10-5-11-23-18(25)12-6-2-3-7-13(12)19(23)26/h2-4,6-9,21H,5,10-11H2,1H3	VDIAQKCISZOWEH-UHFFFAOYSA-N	363.121906054							117037
6-Benzyl-2-(tert-butyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrrolo[3,4-d]pyrimidine-5,8-dione	LSM-28486	SID26731145, BRD-K49284178	2813282	InChI=1S/C19H20N4O2/c1-19(2,3)14-9-15-20-16-13(17(24)23(15)21-14)11-22(18(16)25)10-12-7-5-4-6-8-12/h4-9,24H,10-11H2,1-3H3	HCCZYSHZNRQNIN-UHFFFAOYSA-N	CC(C)(C)c1cc2nc3C(=O)N(Cc4ccccc4)Cc3c(O)n2n1	BroadT	BRD-K49284178	BRD-K49284178-001-04-6	Maybridge	HTS 06825			CC(C)(C)c1cc2nc3C(=O)N(Cc4ccccc4)Cc3c(O)n2n1	InChI=1S/C19H20N4O2/c1-19(2,3)14-9-15-20-16-13(17(24)23(15)21-14)11-22(18(16)25)10-12-7-5-4-6-8-12/h4-9,24H,10-11H2,1-3H3	HCCZYSHZNRQNIN-UHFFFAOYSA-N	336.15862592							
MLS000335592	LSM-28487	SID22407967, BRD-K28885573	3881988	InChI=1S/C19H23FN2O/c1-13-12-18(19(23)21-16-6-4-3-5-7-16)14(2)22(13)17-10-8-15(20)9-11-17/h8-12,16H,3-7H2,1-2H3,(H,21,23)	GHKAEQQTNJGAAS-UHFFFAOYSA-N	Cc1cc(C(=O)NC2CCCCC2)c(C)n1c3ccc(F)cc3	BroadT	BRD-K28885573	BRD-K28885573-001-06-1	Enamine Ltd.	T5245532			Cc1cc(C(=O)NC2CCCCC2)c(C)n1-c1ccc(F)cc1	InChI=1S/C19H23FN2O/c1-13-12-18(19(23)21-16-6-4-3-5-7-16)14(2)22(13)17-10-8-15(20)9-11-17/h8-12,16H,3-7H2,1-2H3,(H,21,23)	GHKAEQQTNJGAAS-UHFFFAOYSA-N	314.179441576							117039
SMR000019795	LSM-28488	SID4244359, BRD-K24499852	3238969	InChI=1S/C19H11BrClN3O2/c20-12-7-11(9-22-10-12)18(25)23-13-5-6-17-16(8-13)24-19(26-17)14-3-1-2-4-15(14)21/h1-10H,(H,23,25)	KPIQFMUOSWEVOO-UHFFFAOYSA-N	Clc1ccccc1c2oc3ccc(NC(=O)c4cncc(Br)c4)cc3n2	BroadT	BRD-K24499852	BRD-K24499852-001-07-5	ChemDiv Inc.	5524-0038			Clc1ccccc1-c1nc2cc(NC(=O)c3cncc(Br)c3)ccc2o1	InChI=1S/C19H11BrClN3O2/c20-12-7-11(9-22-10-12)18(25)23-13-5-6-17-16(8-13)24-19(26-17)14-3-1-2-4-15(14)21/h1-10H,(H,23,25)	KPIQFMUOSWEVOO-UHFFFAOYSA-N	426.972316932							117040
MLS000041097	LSM-28489	SID864038, BRD-K16786699	665289	InChI=1S/C20H17NO2/c1-21-12-16-10-14-6-2-4-8-18(14)22-20(16)17(13-21)11-15-7-3-5-9-19(15)23-20/h2-11H,12-13H2,1H3	AEYQPEUDXAQAFL-UHFFFAOYSA-N	CN1CC2=Cc3ccccc3OC24Oc5ccccc5C=C4C1	BroadT	BRD-K16786699	BRD-K16786699-001-05-6	InterBioScreen Ltd.	STOCK4S-98482			CN1CC2=Cc3ccccc3OC22Oc3ccccc3C=C2C1	InChI=1S/C20H17NO2/c1-21-12-16-10-14-6-2-4-8-18(14)22-20(16)17(13-21)11-15-7-3-5-9-19(15)23-20/h2-11H,12-13H2,1H3	AEYQPEUDXAQAFL-UHFFFAOYSA-N	303.125928794							117041
ST50838577	LSM-28490	SID17433337, BRD-K51637673	970792	InChI=1S/C11H10Cl2N4O/c1-17-5-4-10(16-17)15-11(18)14-9-3-2-7(12)6-8(9)13/h2-6H,1H3,(H2,14,15,16,18)	RGCDLOJNNSPNAL-UHFFFAOYSA-N	Cn1ccc(NC(=O)Nc2ccc(Cl)cc2Cl)n1	BroadT	BRD-K51637673	BRD-K51637673-001-05-7	ChemBridge Corporation	7805704			Cn1ccc(NC(=O)Nc2ccc(Cl)cc2Cl)n1	InChI=1S/C11H10Cl2N4O/c1-17-5-4-10(16-17)15-11(18)14-9-3-2-7(12)6-8(9)13/h2-6H,1H3,(H2,14,15,16,18)	RGCDLOJNNSPNAL-UHFFFAOYSA-N	284.0231664							117042
6-Amino-4-(3-furyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile	LSM-28491	BRD-A70045226	3696559	InChI=1S/C14H14N4O2/c1-2-3-10-12-11(8-4-5-19-7-8)9(6-15)13(16)20-14(12)18-17-10/h4-5,7,9,11,16H,2-3H2,1H3,(H,17,18)	OHYGDNRGXFRYOT-UHFFFAOYSA-N	CCCc1[nH]nc2OC(=N)C(C#N)C(c3ccoc3)c12	BroadT	BRD-A70045226	BRD-A70045226-001-07-0	InterBioScreen Ltd.	STOCK1S-86684			CCCc1n[nH]c2OC(N)=C(C#N)C(c3ccoc3)c12	InChI=1S/C14H14N4O2/c1-2-3-10-12-11(8-4-5-19-7-8)9(6-15)13(16)20-14(12)18-17-10/h4-5,7,11H,2-3,16H2,1H3,(H,17,18)	MTHBXTRAXHPTSN-UHFFFAOYSA-N	270.111675728							
MLS000534932	LSM-28492	SID14735927, BRD-K36449943	1190011	InChI=1S/C20H19N5OS/c1-2-12-24-17(26)16-14-10-6-7-11-15(14)27-18(16)25-19(22-23-20(24)25)21-13-8-4-3-5-9-13/h2-5,8-9H,1,6-7,10-12H2,(H,21,22)	DPAVPDMEKWWXGR-UHFFFAOYSA-N	C=CCN1C(=O)c2c3CCCCc3sc2n4c(Nc5ccccc5)nnc14	BroadT	BRD-K36449943	BRD-K36449943-001-06-9	ChemBridge Corporation	7661272			C=CCn1c2nnc(Nc3ccccc3)n2c2sc3CCCCc3c2c1=O	InChI=1S/C20H19N5OS/c1-2-12-24-17(26)16-14-10-6-7-11-15(14)27-18(16)25-19(22-23-20(24)25)21-13-8-4-3-5-9-13/h2-5,8-9H,1,6-7,10-12H2,(H,21,22)	DPAVPDMEKWWXGR-UHFFFAOYSA-N	377.131030968							117044
SMR000264582	LSM-28493	SID22407159, BRD-K33985118	2471579	InChI=1S/C27H24FN3O5S/c1-16-25(17-4-11-21(34-2)12-5-17)30-27(37-16)31-26(33)18-6-13-22(23(14-18)35-3)36-15-24(32)29-20-9-7-19(28)8-10-20/h4-14H,15H2,1-3H3,(H,29,32)(H,30,31,33)	SLKZSBNPGHDFSQ-UHFFFAOYSA-N	COc1ccc(cc1)c2nc(NC(=O)c3ccc(OCC(=O)Nc4ccc(F)cc4)c(OC)c3)sc2C	BroadT	BRD-K33985118	BRD-K33985118-001-05-6	Enamine Ltd.	T5327515			COc1ccc(cc1)-c1nc(NC(=O)c2ccc(OCC(=O)Nc3ccc(F)cc3)c(OC)c2)sc1C	InChI=1S/C27H24FN3O5S/c1-16-25(17-4-11-21(34-2)12-5-17)30-27(37-16)31-26(33)18-6-13-22(23(14-18)35-3)36-15-24(32)29-20-9-7-19(28)8-10-20/h4-14H,15H2,1-3H3,(H,29,32)(H,30,31,33)	SLKZSBNPGHDFSQ-UHFFFAOYSA-N	521.142069788							117045
MLS000707559	LSM-28494	SID22411060, BRD-K16904769	3657896	InChI=1S/C19H19N3O5S3/c23-16-6-5-13(30(25,26)22-7-9-27-10-8-22)11-15(16)20-18(24)12-28-19-21-14-3-1-2-4-17(14)29-19/h1-6,11,23H,7-10,12H2,(H,20,24)	IDOYVYUFPNLSKM-UHFFFAOYSA-N	Oc1ccc(cc1NC(=O)CSc2nc3ccccc3s2)S(=O)(=O)N4CCOCC4	BroadT	BRD-K16904769	BRD-K16904769-001-05-0	Enamine Ltd.	T0505-8073			Oc1ccc(cc1NC(=O)CSc1nc2ccccc2s1)S(=O)(=O)N1CCOCC1	InChI=1S/C19H19N3O5S3/c23-16-6-5-13(30(25,26)22-7-9-27-10-8-22)11-15(16)20-18(24)12-28-19-21-14-3-1-2-4-17(14)29-19/h1-6,11,23H,7-10,12H2,(H,20,24)	IDOYVYUFPNLSKM-UHFFFAOYSA-N	465.048682808							117046
1-(2-Methoxyethyl)-2-[(4-methoxyphenoxy)methyl]-1H-benzimidazole	LSM-28495	SID4262326, BRD-K50905288	2946898	InChI=1S/C18H20N2O3/c1-21-12-11-20-17-6-4-3-5-16(17)19-18(20)13-23-15-9-7-14(22-2)8-10-15/h3-10H,11-13H2,1-2H3	RYQVREBOIVNRLW-UHFFFAOYSA-N	COCCn1c(COc2ccc(OC)cc2)nc3ccccc13	BroadT	BRD-K50905288	BRD-K50905288-001-05-6	ChemBridge Corporation	7674366			COCCn1c(COc2ccc(OC)cc2)nc2ccccc12	InChI=1S/C18H20N2O3/c1-21-12-11-20-17-6-4-3-5-16(17)19-18(20)13-23-15-9-7-14(22-2)8-10-15/h3-10H,11-13H2,1-2H3	RYQVREBOIVNRLW-UHFFFAOYSA-N	312.14739252							131292
SMR000154893	LSM-28496	SID14743915, SID89851740, BRD-A08042366	3981549	InChI=1S/C18H18Cl2N4O2S/c1-11(17(25)23-16-13(20)9-12(19)10-21-16)27-18-22-14-5-3-4-6-15(14)24(18)7-8-26-2/h3-6,9-11H,7-8H2,1-2H3,(H,21,23,25)	LPHZQKMYLPRSMD-UHFFFAOYSA-N	COCCn1c(SC(C)C(=O)Nc2ncc(Cl)cc2Cl)nc3ccccc13	BroadT	BRD-A08042366	BRD-A08042366-001-05-8	Enamine Ltd.	T5279706			COCCn1c(SC(C)C(=O)Nc2ncc(Cl)cc2Cl)nc2ccccc12	InChI=1S/C18H18Cl2N4O2S/c1-11(17(25)23-16-13(20)9-12(19)10-21-16)27-18-22-14-5-3-4-6-15(14)24(18)7-8-26-2/h3-6,9-11H,7-8H2,1-2H3,(H,21,23,25)	LPHZQKMYLPRSMD-UHFFFAOYSA-N	424.052751966							117049
SMR000067537	LSM-28497	SID3717925, BRD-K46642548	2090620	InChI=1S/C16H17ClN2O6S/c17-12-3-5-14(6-4-12)26(22,23)19-8-7-16(21)25-11-15(20)18-10-13-2-1-9-24-13/h1-6,9,19H,7-8,10-11H2,(H,18,20)	JZMUPYRWTGVRHQ-UHFFFAOYSA-N	Clc1ccc(cc1)S(=O)(=O)NCCC(=O)OCC(=O)NCc2occc2	BroadT	BRD-K46642548	BRD-K46642548-001-05-8	Enamine Ltd.	T5269903			Clc1ccc(cc1)S(=O)(=O)NCCC(=O)OCC(=O)NCc1ccco1	InChI=1S/C16H17ClN2O6S/c17-12-3-5-14(6-4-12)26(22,23)19-8-7-16(21)25-11-15(20)18-10-13-2-1-9-24-13/h1-6,9,19H,7-8,10-11H2,(H,18,20)	JZMUPYRWTGVRHQ-UHFFFAOYSA-N	400.049584684							117050
MLS000689253	LSM-28498	SID24814243, SID85176657, BRD-K47706000	6002117	InChI=1S/C22H19ClN4O5S/c23-17-4-3-5-18(15-17)33(31,32)20-8-7-16(14-19(20)27(29)30)22(28)26-12-10-25(11-13-26)21-6-1-2-9-24-21/h1-9,14-15H,10-13H2	QDXGUEAORKHSFK-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1S(=O)(=O)c2cccc(Cl)c2)C(=O)N3CCN(CC3)c4ccccn4	BroadT	BRD-K47706000	BRD-K47706000-001-05-1	ChemDiv Inc.	K673-0329			[O-][N+](=O)c1cc(ccc1S(=O)(=O)c1cccc(Cl)c1)C(=O)N1CCN(CC1)c1ccccn1	InChI=1S/C22H19ClN4O5S/c23-17-4-3-5-18(15-17)33(31,32)20-8-7-16(14-19(20)27(29)30)22(28)26-12-10-25(11-13-26)21-6-1-2-9-24-21/h1-9,14-15H,10-13H2	QDXGUEAORKHSFK-UHFFFAOYSA-N	486.076468148							117051
SMR000120384	LSM-28499	SID14725917, BRD-A23793948	3156405	InChI=1S/C25H20N6O2/c26-12-20-19-8-11-31(24(32)33-14-17-4-2-1-3-5-17)13-21(19)22(18-6-9-30-10-7-18)25(15-27,16-28)23(20)29/h1-10,21-22H,11,13-14,29H2	FRBMZJZAGOSBMK-UHFFFAOYSA-N	NC1=C(C#N)C2=CCN(CC2C(c3ccncc3)C1(C#N)C#N)C(=O)OCc4ccccc4	BroadT	BRD-A23793948	BRD-A23793948-001-05-4	Asinex Ltd.	BAS 07417276			NC1=C(C#N)C2=CCN(CC2C(c2ccncc2)C1(C#N)C#N)C(=O)OCc1ccccc1	InChI=1S/C25H20N6O2/c26-12-20-19-8-11-31(24(32)33-14-17-4-2-1-3-5-17)13-21(19)22(18-6-9-30-10-7-18)25(15-27,16-28)23(20)29/h1-10,21-22H,11,13-14,29H2	FRBMZJZAGOSBMK-UHFFFAOYSA-N	436.16477394							117052
ST50631370	LSM-44278	SID17433644, BRD-K93689376	2187721	InChI=1S/C17H13N3O3S/c1-11(9-12-5-3-2-4-6-12)16(21)19-17-18-14-8-7-13(20(22)23)10-15(14)24-17/h2-10H,1H3,(H,18,19,21)/b11-9+	NCAVOTMEMZFWEF-PKNBQFBNSA-N	C\C(=C/c1ccccc1)\C(=O)Nc2nc3ccc(cc3s2)[N+](=O)[O-]	BroadT	BRD-K93689376	BRD-K93689376-001-05-8	ChemBridge Corporation	7397438			C\C(=C/c1ccccc1)C(=O)Nc1nc2ccc(cc2s1)[N+]([O-])=O	InChI=1S/C17H13N3O3S/c1-11(9-12-5-3-2-4-6-12)16(21)19-17-18-14-8-7-13(20(22)23)10-15(14)24-17/h2-10H,1H3,(H,18,19,21)/b11-9+	NCAVOTMEMZFWEF-PKNBQFBNSA-N	339.067761996							
4-Amino-2,6-dimethyl-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-2,3-dihydropyridazin-3-one	LSM-28501	SID535126, SID26726855, BRD-K70021293	403912	InChI=1S/C16H17N5O/c1-9-4-6-11(7-5-9)12-8-13(19-18-12)14-10(2)20-21(3)16(22)15(14)17/h4-8H,17H2,1-3H3,(H,18,19)	QBYGBWFAFPXSJS-UHFFFAOYSA-N	CN1N=C(C)C(=C(N)C1=O)c2cc([nH]n2)c3ccc(C)cc3	BroadT	BRD-K70021293	BRD-K70021293-001-06-9	Maybridge	BTB 09051			Cc1ccc(cc1)-c1cc(n[nH]1)-c1c(C)nn(C)c(=O)c1N	InChI=1S/C16H17N5O/c1-9-4-6-11(7-5-9)12-8-13(19-18-12)14-10(2)20-21(3)16(22)15(14)17/h4-8H,17H2,1-3H3,(H,18,19)	QBYGBWFAFPXSJS-UHFFFAOYSA-N	295.143310214							117054
ASN 04369059	LSM-28502	SID26667480, SID844362, BRD-K43940105	646682	InChI=1S/C25H24N6OS/c1-18-9-10-23-20(12-18)13-21(25(32)26-23)15-30(16-22-8-5-11-33-22)17-24-27-28-29-31(24)14-19-6-3-2-4-7-19/h2-13H,14-17H2,1H3,(H,26,32)	IRVJESCRLBTULW-UHFFFAOYSA-N	Cc1ccc2nc(O)c(CN(Cc3cccs3)Cc4nnnn4Cc5ccccc5)cc2c1	BroadT	BRD-K43940105	BRD-K43940105-001-05-4	Asinex Ltd.	ASN 04369059			Cc1ccc2nc(O)c(CN(Cc3cccs3)Cc3nnnn3Cc3ccccc3)cc2c1	InChI=1S/C25H24N6OS/c1-18-9-10-23-20(12-18)13-21(25(32)26-23)15-30(16-22-8-5-11-33-22)17-24-27-28-29-31(24)14-19-6-3-2-4-7-19/h2-13H,14-17H2,1H3,(H,26,32)	IRVJESCRLBTULW-UHFFFAOYSA-N	456.173230138							117055
SMR000218230	LSM-28503	SID17506126, BRD-A07548752	4639757	InChI=1S/C23H22ClNO6/c1-12(26)7-18-13(2)17-9-19(24)21(10-20(17)31-23(18)29)30-11-22(28)25-16-6-4-5-15(8-16)14(3)27/h4-6,8-10,12,26H,7,11H2,1-3H3,(H,25,28)	ZEOTTYLCJGDTHS-UHFFFAOYSA-N	CC(O)CC1=C(C)c2cc(Cl)c(OCC(=O)Nc3cccc(c3)C(=O)C)cc2OC1=O	BroadT	BRD-A07548752	BRD-A07548752-001-05-7	InterBioScreen Ltd.	STOCK3S-40073			CC(O)Cc1c(C)c2cc(Cl)c(OCC(=O)Nc3cccc(c3)C(C)=O)cc2oc1=O	InChI=1S/C23H22ClNO6/c1-12(26)7-18-13(2)17-9-19(24)21(10-20(17)31-23(18)29)30-11-22(28)25-16-6-4-5-15(8-16)14(3)27/h4-6,8-10,12,26H,7,11H2,1-3H3,(H,25,28)	ZEOTTYLCJGDTHS-UHFFFAOYSA-N	443.113565144							117056
AC1O9XW3	LSM-28504	SID24803052, BRD-K86497397	6740284	InChI=1S/C21H17N3O2/c1-26-19-13-7-5-11-17(19)23-20-14-8-2-4-10-16(14)22-21(24-20)15-9-3-6-12-18(15)25/h2-13,25H,1H3,(H,22,23,24)	XXDWHCBZRZWMFZ-UHFFFAOYSA-N	COc1ccccc1Nc2nc(nc3ccccc23)c4ccccc4O	BroadT	BRD-K86497397	BRD-K86497397-001-06-8	ChemBridge Corporation	7001336			COc1ccccc1Nc1nc(nc2ccccc12)-c1ccccc1O	InChI=1S/C21H17N3O2/c1-26-19-13-7-5-11-17(19)23-20-14-8-2-4-10-16(14)22-21(24-20)15-9-3-6-12-18(15)25/h2-13,25H,1H3,(H,22,23,24)	XXDWHCBZRZWMFZ-UHFFFAOYSA-N	343.132076814							
AC1LQKQP	LSM-28505	SID14744850, BRD-K24278940	1402540	InChI=1S/C19H18N4O/c1-19(2)16(24)15(17(20)23(19)12-8-4-3-5-9-12)18-21-13-10-6-7-11-14(13)22-18/h3-11H,20H2,1-2H3,(H,21,22)	BCQYVFDKVZDNIE-UHFFFAOYSA-N	CC1(C)N(C(=C(C1=O)c2nc3ccccc3[nH]2)N)c4ccccc4	BroadT	BRD-K24278940	BRD-K24278940-001-06-9	Enamine Ltd.	T0502-4980			CC1(C)N(C(N)=C(c2nc3ccccc3[nH]2)C1=O)c1ccccc1	InChI=1S/C19H18N4O/c1-19(2)16(24)15(17(20)23(19)12-8-4-3-5-9-12)18-21-13-10-6-7-11-14(13)22-18/h3-11H,20H2,1-2H3,(H,21,22)	BCQYVFDKVZDNIE-UHFFFAOYSA-N	318.148061236							117058
SMR000059343	LSM-28506	SID856683, BRD-A57901360	658033	InChI=1S/C17H12N4OS/c18-8-13(9-19)14(12-6-7-23-10-12)15-16(20-21-17(15)22)11-4-2-1-3-5-11/h1-7,10,13-14H,(H2,20,21,22)	VXSSLOQWIIHATK-UHFFFAOYSA-N	Oc1[nH]nc(c2ccccc2)c1C(C(C#N)C#N)c3ccsc3	BroadT	BRD-A57901360	BRD-A57901360-001-04-4	InterBioScreen Ltd.	STOCK1S-24087			Oc1n[nH]c(c1C(C(C#N)C#N)c1ccsc1)-c1ccccc1	InChI=1S/C17H12N4OS/c18-8-13(9-19)14(12-6-7-23-10-12)15-16(20-21-17(15)22)11-4-2-1-3-5-11/h1-7,10,13-14H,(H2,20,21,22)	VXSSLOQWIIHATK-UHFFFAOYSA-N	320.073181734							117059
BRD-A03579949	LSM-28507			InChI=1S/C14H8N4O3S/c15-7-8(13(19)11-5-6-12(22-11)18(20)21)14-16-9-3-1-2-4-10(9)17-14/h1-6,8H,(H,16,17)	LTSNJDPUVBCHMP-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(s1)C(=O)C(C#N)c2nc3ccccc3[nH]2	BroadT	BRD-A03579949	BRD-A03579949-001-06-8	Life Chemicals Inc.	F0193-0311			[O-][N+](=O)c1ccc(s1)C(=O)C(C#N)c1nc2ccccc2[nH]1	InChI=1S/C14H8N4O3S/c15-7-8(13(19)11-5-6-12(22-11)18(20)21)14-16-9-3-1-2-4-10(9)17-14/h1-6,8H,(H,16,17)	LTSNJDPUVBCHMP-UHFFFAOYSA-N	312.031710846							117060
SMR000145584	LSM-44279	SID14742177, BRD-K79741021	1996981	InChI=1S/C27H29N5O3S2/c1-19-12-14-31(15-13-19)27-28-26(33)24(36-27)17-21-18-32(22-9-5-4-6-10-22)29-25(21)20-8-7-11-23(16-20)37(34,35)30(2)3/h4-11,16-19H,12-15H2,1-3H3/b24-17-	ZOFMHSZGAINRQK-ULJHMMPZSA-N	CC1CCN(CC1)C2=NC(=O)\C(=C\c3cn(nc3c4cccc(c4)S(=O)(=O)N(C)C)c5ccccc5)\S2	BroadT	BRD-K79741021	BRD-K79741021-001-05-4	InterBioScreen Ltd.	STOCK5S-09684			CC1CCN(CC1)C1=NC(=O)\C(S1)=C\c1cn(nc1-c1cccc(c1)S(=O)(=O)N(C)C)-c1ccccc1	InChI=1S/C27H29N5O3S2/c1-19-12-14-31(15-13-19)27-28-26(33)24(36-27)17-21-18-32(22-9-5-4-6-10-22)29-25(21)20-8-7-11-23(16-20)37(34,35)30(2)3/h4-11,16-19H,12-15H2,1-3H3/b24-17-	ZOFMHSZGAINRQK-ULJHMMPZSA-N	535.171181218							
436096-79-6	LSM-28509	SID3716292, BRD-K56984911	795881	InChI=1S/C15H18N2/c1-2-13-5-7-14(8-6-13)10-17-12-15-4-3-9-16-11-15/h3-9,11,17H,2,10,12H2,1H3	HPNYVMFOKBZNMG-UHFFFAOYSA-N	CCc1ccc(CNCc2cccnc2)cc1	BroadT	BRD-K56984911	BRD-K56984911-001-05-0	Enamine Ltd.	T5320510			CCc1ccc(CNCc2cccnc2)cc1	InChI=1S/C15H18N2/c1-2-13-5-7-14(8-6-13)10-17-12-15-4-3-9-16-11-15/h3-9,11,17H,2,10,12H2,1H3	HPNYVMFOKBZNMG-UHFFFAOYSA-N	226.146998596							117062
2-(5-Methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-1-phenyl-ethanone	LSM-28510	SID853382, BRD-K82668516	656037	InChI=1S/C11H11N3OS/c1-8-12-11(14-13-8)16-7-10(15)9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,12,13,14)	HPZJBUNBFWPSEH-UHFFFAOYSA-N	Cc1n[nH]c(SCC(=O)c2ccccc2)n1	BroadT	BRD-K82668516	BRD-K82668516-001-05-6	Asinex Ltd.	BAS 01277273			Cc1n[nH]c(SCC(=O)c2ccccc2)n1	InChI=1S/C11H11N3OS/c1-8-12-11(14-13-8)16-7-10(15)9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,12,13,14)	HPZJBUNBFWPSEH-UHFFFAOYSA-N	233.062282692							117063
ASN 07369740	LSM-28511	SID24804956, BRD-K20079322	3228233	InChI=1S/C18H15ClN6/c1-12-20-17(22-15-9-7-14(19)8-10-15)16-18(21-12)25(24-23-16)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,20,21,22)	ZQWFSYVCIKBQRZ-UHFFFAOYSA-N	Cc1nc(Nc2ccc(Cl)cc2)c3nnn(Cc4ccccc4)c3n1	BroadT	BRD-K20079322	BRD-K20079322-001-05-5	Asinex Ltd.	ASN 07369740			Cc1nc(Nc2ccc(Cl)cc2)c2nnn(Cc3ccccc3)c2n1	InChI=1S/C18H15ClN6/c1-12-20-17(22-15-9-7-14(19)8-10-15)16-18(21-12)25(24-23-16)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,20,21,22)	ZQWFSYVCIKBQRZ-UHFFFAOYSA-N	350.10467225							117064
ILP-IV-31	LSM-28512	SID26732678, BRD-K40957415	16746624	InChI=1S/C17H19ClN4O4/c1-17(2,3)26-12(23)8-19-15(24)13-14(21-9-20-13)16(25)22-11-6-4-10(18)5-7-11/h4-7,9H,8H2,1-3H3,(H,19,24)(H,20,21)(H,22,25)	NUHNBOBCXDYEON-UHFFFAOYSA-N	CC(C)(C)OC(=O)CNC(=O)c1[nH]cnc1C(=O)Nc2ccc(Cl)cc2	BroadT	BRD-K40957415	BRD-K40957415-001-05-6	University of Tulsa	ILP-IV-31 AE05_AN05			CC(C)(C)OC(=O)CNC(=O)c1[nH]cnc1C(=O)Nc1ccc(Cl)cc1	InChI=1S/C17H19ClN4O4/c1-17(2,3)26-12(23)8-19-15(24)13-14(21-9-20-13)16(25)22-11-6-4-10(18)5-7-11/h4-7,9H,8H2,1-3H3,(H,19,24)(H,20,21)(H,22,25)	NUHNBOBCXDYEON-UHFFFAOYSA-N	378.109482838							117065
ST50674340	LSM-28513	SID4249103, BRD-K49515243	3243099	InChI=1S/C18H18N2O4S/c1-22-14-6-5-12(10-15(14)23-2)7-8-19-18(21)13-11-16(24-20-13)17-4-3-9-25-17/h3-6,9-11H,7-8H2,1-2H3,(H,19,21)	RALPGQIYDOTOCX-UHFFFAOYSA-N	COc1ccc(CCNC(=O)c2cc(on2)c3cccs3)cc1OC	BroadT	BRD-K49515243	BRD-K49515243-001-06-9	ChemDiv Inc.	C226-1865			COc1ccc(CCNC(=O)c2cc(on2)-c2cccs2)cc1OC	InChI=1S/C18H18N2O4S/c1-22-14-6-5-12(10-15(14)23-2)7-8-19-18(21)13-11-16(24-20-13)17-4-3-9-25-17/h3-6,9-11H,7-8H2,1-2H3,(H,19,21)	RALPGQIYDOTOCX-UHFFFAOYSA-N	358.098727766							117066
10B-060	LSM-44280	SID24824551, BRD-K56604379	5706877	InChI=1S/C13H13N3O4/c1-9-13(16(17)18)12(20-15-9)6-7-14-10-4-3-5-11(8-10)19-2/h3-8,14H,1-2H3/b7-6+	PHDPDISOBZPHKI-VOTSOKGWSA-N	COc1cccc(N\C=C\c2onc(C)c2[N+](=O)[O-])c1	BroadT	BRD-K56604379	BRD-K56604379-001-05-9	Key Organics Ltd.	10B-060			COc1cccc(N\C=C\c2onc(C)c2[N+]([O-])=O)c1	InChI=1S/C13H13N3O4/c1-9-13(16(17)18)12(20-15-9)6-7-14-10-4-3-5-11(8-10)19-2/h3-8,14H,1-2H3/b7-6+	PHDPDISOBZPHKI-VOTSOKGWSA-N	275.090605926							
MLS000730369	LSM-44281	SID24812811, BRD-K16321257	16193804	InChI=1S/C19H18N2O3S/c1-23-14-10-8-13(9-11-14)12-15-18(22)21(19(20-15)25-3)16-6-4-5-7-17(16)24-2/h4-12H,1-3H3/b15-12-	FLLOKSLVUGLBJQ-QINSGFPZSA-N	COc1ccc(\C=C\2/N=C(SC)N(C2=O)c3ccccc3OC)cc1	BroadT	BRD-K16321257	BRD-K16321257-001-05-6	ChemDiv Inc.	C249-0071			COc1ccc(cc1)\C=C1/N=C(SC)N(C1=O)c1ccccc1OC	InChI=1S/C19H18N2O3S/c1-23-14-10-8-13(9-11-14)12-15-18(22)21(19(20-15)25-3)16-6-4-5-7-17(16)24-2/h4-12H,1-3H3/b15-12-	FLLOKSLVUGLBJQ-QINSGFPZSA-N	354.103813146							
5-Nitro-8-(pyrrolidin-1-yl)quinoline	LSM-28516	SID24780440, BRD-K39499464	2829609	InChI=1S/C13H13N3O2/c17-16(18)11-5-6-12(15-8-1-2-9-15)13-10(11)4-3-7-14-13/h3-7H,1-2,8-9H2	DMERJCJHEOTUBG-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(N2CCCC2)c3ncccc13	BroadT	BRD-K39499464	BRD-K39499464-001-05-2	Asinex Ltd.	BAS 06991780			[O-][N+](=O)c1ccc(N2CCCC2)c2ncccc12	InChI=1S/C13H13N3O2/c17-16(18)11-5-6-12(15-8-1-2-9-15)13-10(11)4-3-7-14-13/h3-7H,1-2,8-9H2	DMERJCJHEOTUBG-UHFFFAOYSA-N	243.100776686							117069
MLS000418437	LSM-28517	SID22407117, BRD-K19868254	3959050	InChI=1S/C28H24N2O4S/c1-18-12-13-22(23(17-18)34-2)29(28(33)24-11-5-16-35-24)14-6-15-30-26(31)20-9-3-7-19-8-4-10-21(25(19)20)27(30)32/h3-5,7-13,16-17H,6,14-15H2,1-2H3	KLTGZEDOABHZNI-UHFFFAOYSA-N	COc1cc(C)ccc1N(CCCN2C(=O)c3cccc4cccc(C2=O)c34)C(=O)c5cccs5	BroadT	BRD-K19868254	BRD-K19868254-001-05-6	Enamine Ltd.	T0500-2204			COc1cc(C)ccc1N(CCCN1C(=O)c2cccc3cccc(C1=O)c23)C(=O)c1cccs1	InChI=1S/C28H24N2O4S/c1-18-12-13-22(23(17-18)34-2)29(28(33)24-11-5-16-35-24)14-6-15-30-26(31)20-9-3-7-19-8-4-10-21(25(19)20)27(30)32/h3-5,7-13,16-17H,6,14-15H2,1-2H3	KLTGZEDOABHZNI-UHFFFAOYSA-N	484.145677958							117070
MLS001167010	LSM-28518	SID49677996, BRD-K35388320	1383566	InChI=1S/C19H17NO6/c1-23-15-6-4-11(8-17(15)24-2)14-7-12-3-5-13(25-10-18(20)21)9-16(12)26-19(14)22/h3-9H,10H2,1-2H3,(H2,20,21)	OFOVBRUBBQFQJR-UHFFFAOYSA-N	COc1ccc(cc1OC)C2=Cc3ccc(OCC(=O)N)cc3OC2=O	BroadT	BRD-K35388320	BRD-K35388320-001-06-3	Life Chemicals Inc.	F1862-0148			COc1ccc(cc1OC)-c1cc2ccc(OCC(N)=O)cc2oc1=O	InChI=1S/C19H17NO6/c1-23-15-6-4-11(8-17(15)24-2)14-7-12-3-5-13(25-10-18(20)21)9-16(12)26-19(14)22/h3-9H,10H2,1-2H3,(H2,20,21)	OFOVBRUBBQFQJR-UHFFFAOYSA-N	355.105587274							117071
MLS001210687	LSM-28519	SID49642387, BRD-K15224498	746299	InChI=1S/C15H9ClN2O2/c16-12-5-6-13(14-11(12)4-2-8-18-14)20-15(19)10-3-1-7-17-9-10/h1-9H	TZPKUYDXEWNSDK-UHFFFAOYSA-N	Clc1ccc(OC(=O)c2cccnc2)c3ncccc13	BroadT	BRD-K15224498	BRD-K15224498-001-06-0	Asinex Ltd.	BAS 00917503			Clc1ccc(OC(=O)c2cccnc2)c2ncccc12	InChI=1S/C15H9ClN2O2/c16-12-5-6-13(14-11(12)4-2-8-18-14)20-15(19)10-3-1-7-17-9-10/h1-9H	TZPKUYDXEWNSDK-UHFFFAOYSA-N	284.035255258							117072
BRD-K38589158	LSM-28520			InChI=1S/C16H17NO4/c1-16(2)7-13(18)11(14(19)8-16)9-17-12-6-4-3-5-10(12)15(20)21/h3-6,9,11H,7-8H2,1-2H3,(H,20,21)	QICUJNDCYAGOBK-UHFFFAOYSA-N	CC1(C)CC(=O)C(C=Nc2ccccc2C(=O)O)C(=O)C1	BroadT	BRD-K38589158	BRD-K38589158-001-05-2	ChemDiv Inc.	4401-0040			CC1(C)CC(=O)C(C=Nc2ccccc2C(O)=O)C(=O)C1	InChI=1S/C16H17NO4/c1-16(2)7-13(18)11(14(19)8-16)9-17-12-6-4-3-5-10(12)15(20)21/h3-6,9,11H,7-8H2,1-2H3,(H,20,21)	QICUJNDCYAGOBK-UHFFFAOYSA-N	287.115758034							117073
ST50937494	LSM-28521	SID22416372, BRD-K51719066	1223727	InChI=1S/C17H18BrN3O/c18-15-6-4-14(5-7-15)13-17(22)21-11-9-20(10-12-21)16-3-1-2-8-19-16/h1-8H,9-13H2	WBYSBLWOYOWNTM-UHFFFAOYSA-N	Brc1ccc(CC(=O)N2CCN(CC2)c3ccccn3)cc1	BroadT	BRD-K51719066	BRD-K51719066-001-05-8	ChemBridge Corporation	7306693			Brc1ccc(cc1)CC(=O)N1CCN(CC1)c1ccccn1	InChI=1S/C17H18BrN3O/c18-15-6-4-14(5-7-15)13-17(22)21-11-9-20(10-12-21)16-3-1-2-8-19-16/h1-8H,9-13H2	WBYSBLWOYOWNTM-UHFFFAOYSA-N	359.063324826							117074
4-Allyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol	LSM-28522	SID4264153, BRD-K48954171	802092	InChI=1S/C14H17N3O3S/c1-5-6-17-13(15-16-14(17)21)9-7-10(18-2)12(20-4)11(8-9)19-3/h5,7-8H,1,6H2,2-4H3,(H,16,21)	WYCLSGGCWPZUKL-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)c2nnc(S)n2CC=C	BroadT	BRD-K48954171	BRD-K48954171-001-06-7	ChemBridge Corporation	7495241			COc1cc(cc(OC)c1OC)-c1nnc(S)n1CC=C	InChI=1S/C14H17N3O3S/c1-5-6-17-13(15-16-14(17)21)9-7-10(18-2)12(20-4)11(8-9)19-3/h5,7-8H,1,6H2,2-4H3,(H,16,21)	WYCLSGGCWPZUKL-UHFFFAOYSA-N	307.099062124							117075
MLS000388947	LSM-28523	SID22405741, BRD-A79706495	15945077	InChI=1S/C16H19ClN4O2S2/c1-4-24-16-21-20-15(25-16)19-14(23)12(9(2)3)18-13(22)10-5-7-11(17)8-6-10/h5-9,12H,4H2,1-3H3,(H,18,22)(H,19,20,23)	ZGIHZAVRVCNZBL-UHFFFAOYSA-N	CCSc1nnc(NC(=O)C(NC(=O)c2ccc(Cl)cc2)C(C)C)s1	BroadT	BRD-A79706495	BRD-A79706495-001-05-6	Enamine Ltd.	ZT-2199857			CCSc1nnc(NC(=O)C(NC(=O)c2ccc(Cl)cc2)C(C)C)s1	InChI=1S/C16H19ClN4O2S2/c1-4-24-16-21-20-15(25-16)19-14(23)12(9(2)3)18-13(22)10-5-7-11(17)8-6-10/h5-9,12H,4H2,1-3H3,(H,18,22)(H,19,20,23)	ZGIHZAVRVCNZBL-UHFFFAOYSA-N	398.063794978							117076
N-[5-(4-Tert-butylphenyl)-1,3,4-thiadiazol-2-yl]-4-methylbenzamide	LSM-28524	SID17411550, BRD-K48956057	1123723	InChI=1S/C20H21N3OS/c1-13-5-7-14(8-6-13)17(24)21-19-23-22-18(25-19)15-9-11-16(12-10-15)20(2,3)4/h5-12H,1-4H3,(H,21,23,24)	REDXCVKOQFZGCZ-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)Nc2nnc(s2)c3ccc(cc3)C(C)(C)C	BroadT	BRD-K48956057	BRD-K48956057-001-05-3	Asinex Ltd.	BAS 00599216			Cc1ccc(cc1)C(=O)Nc1nnc(s1)-c1ccc(cc1)C(C)(C)C	InChI=1S/C20H21N3OS/c1-13-5-7-14(8-6-13)17(24)21-19-23-22-18(25-19)15-9-11-16(12-10-15)20(2,3)4/h5-12H,1-4H3,(H,21,23,24)	REDXCVKOQFZGCZ-UHFFFAOYSA-N	351.140533012							117077
BDBM45323	LSM-28525	BRD-A37203562	91896648	InChI=1S/C25H26N4O4S/c1-17-19(16-26-29(17)18-6-3-2-4-7-18)23(30)21-22(20-8-5-15-34-20)28(25(32)24(21)31)10-9-27-11-13-33-14-12-27/h2-8,15-16,21-22H,9-14H2,1H3	VCMWLRUOJIZVSS-UHFFFAOYSA-N	Cc1c(cnn1c2ccccc2)C(=O)C3C(N(CCN4CCOCC4)C(=O)C3=O)c5cccs5	BroadT	BRD-A37203562	BRD-A37203562-001-05-3	InterBioScreen Ltd.	STOCK3S-42968			Cc1c(cnn1-c1ccccc1)C(=O)C1C(N(CCN2CCOCC2)C(=O)C1=O)c1cccs1	InChI=1S/C25H26N4O4S/c1-17-19(16-26-29(17)18-6-3-2-4-7-18)23(30)21-22(20-8-5-15-34-20)28(25(32)24(21)31)10-9-27-11-13-33-14-12-27/h2-8,15-16,21-22H,9-14H2,1H3	VCMWLRUOJIZVSS-UHFFFAOYSA-N	478.167476042							117078
MLS000581830	LSM-28526	SID17505816, BRD-K67207456	54680905	InChI=1S/C17H9F3N2O2S/c18-17(19,20)9-6-10(8-4-2-1-3-5-8)21-16-13(9)14-15(25-16)11(23)7-12(24)22-14/h1-7H,(H2,22,23,24)	FNBUNMGBYSZVCD-UHFFFAOYSA-N	Oc1cc(O)c2sc3nc(cc(c3c2n1)C(F)(F)F)c4ccccc4	BroadT	BRD-K67207456	BRD-K67207456-001-05-4	ChemBridge Corporation	7904199			Oc1cc(O)c2sc3nc(cc(c3c2n1)C(F)(F)F)-c1ccccc1	InChI=1S/C17H9F3N2O2S/c18-17(19,20)9-6-10(8-4-2-1-3-5-8)21-16-13(9)14-15(25-16)11(23)7-12(24)22-14/h1-7H,(H2,22,23,24)	FNBUNMGBYSZVCD-UHFFFAOYSA-N	362.033682838							117079
ZINC00318849	LSM-28527	SID17413032, BRD-K57745505	808132	InChI=1S/C18H19NO3S/c1-13-8-9-14(18(21)22-2)12-16(13)19-17(20)10-11-23-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H,19,20)	BIAYADBCSSMORZ-UHFFFAOYSA-N	COC(=O)c1ccc(C)c(NC(=O)CCSc2ccccc2)c1	BroadT	BRD-K57745505	BRD-K57745505-001-05-6	ChemBridge Corporation	6826180			COC(=O)c1ccc(C)c(NC(=O)CCSc2ccccc2)c1	InChI=1S/C18H19NO3S/c1-13-8-9-14(18(21)22-2)12-16(13)19-17(20)10-11-23-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H,19,20)	BIAYADBCSSMORZ-UHFFFAOYSA-N	329.108564168							117080
ST51033076	LSM-28528	SID24828007, BRD-A95882986	3690998	InChI=1S/C18H20N2S/c21-18(19-13-14-7-2-1-3-8-14)20-17-12-6-10-15-9-4-5-11-16(15)17/h1-5,7-9,11,17H,6,10,12-13H2,(H2,19,20,21)	QMPKYZMMCRCHNT-UHFFFAOYSA-N	S=C(NCc1ccccc1)NC2CCCc3ccccc23	BroadT	BRD-A95882986	BRD-A95882986-001-05-1	Enamine Ltd.	T0512-7086			S=C(NCc1ccccc1)NC1CCCc2ccccc12	InChI=1S/C18H20N2S/c21-18(19-13-14-7-2-1-3-8-14)20-17-12-6-10-15-9-4-5-11-16(15)17/h1-5,7-9,11,17H,6,10,12-13H2,(H2,19,20,21)	QMPKYZMMCRCHNT-UHFFFAOYSA-N	296.13471935							117081
ST50927522	LSM-44282	SID22416424, BRD-K90839997	898352	InChI=1S/C14H12FNOS/c15-12-6-3-11(4-7-12)5-8-14(17)16-10-13-2-1-9-18-13/h1-9H,10H2,(H,16,17)/b8-5+	FHMIMWWQRYDTRF-VMPITWQZSA-N	Fc1ccc(\C=C\C(=O)NCc2cccs2)cc1	BroadT	BRD-K90839997	BRD-K90839997-001-06-9	ChemBridge Corporation	7273567			Fc1ccc(\C=C\C(=O)NCc2cccs2)cc1	InChI=1S/C14H12FNOS/c15-12-6-3-11(4-7-12)5-8-14(17)16-10-13-2-1-9-18-13/h1-9H,10H2,(H,16,17)/b8-5+	FHMIMWWQRYDTRF-VMPITWQZSA-N	261.062362904							
AC1NTVTK	LSM-28530	SID860911, BRD-A63809589	5389469	InChI=1S/C18H17N5O/c1-12-3-5-14(6-4-12)17-11-16(19-18-20-21-22-23(17)18)13-7-9-15(24-2)10-8-13/h3-11,17H,1-2H3,(H,19,20,22)	FJQYKMPHCPKIQF-UHFFFAOYSA-N	COc1ccc(cc1)C2=CC(c3ccc(C)cc3)n4nnnc4N2	BroadT	BRD-A63809589	BRD-A63809589-001-05-3	InterBioScreen Ltd.	STOCK3S-95376			COc1ccc(cc1)C1=CC(c2ccc(C)cc2)n2nnnc2N1	InChI=1S/C18H17N5O/c1-12-3-5-14(6-4-12)17-11-16(19-18-20-21-22-23(17)18)13-7-9-15(24-2)10-8-13/h3-11,17H,1-2H3,(H,19,20,22)	FJQYKMPHCPKIQF-UHFFFAOYSA-N	319.143310214							117083
CHEMBL1488893	LSM-28531	BRD-K06318195, SID7974090	780684	InChI=1S/C21H24N4O/c1-16-8-10-17(11-9-16)20(26)23-21-22-18-6-2-3-7-19(18)25(21)15-14-24-12-4-5-13-24/h2-3,6-11H,4-5,12-15H2,1H3,(H,22,23,26)	ZUUSQINWWMDMMW-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)Nc2nc3ccccc3n2CCN4CCCC4	BroadT	BRD-K06318195	BRD-K06318195-001-06-7	ChemBridge Corporation	6049309			Cc1ccc(cc1)C(=O)Nc1nc2ccccc2n1CCN1CCCC1	InChI=1S/C21H24N4O/c1-16-8-10-17(11-9-16)20(26)23-21-22-18-6-2-3-7-19(18)25(21)15-14-24-12-4-5-13-24/h2-3,6-11H,4-5,12-15H2,1H3,(H,22,23,26)	ZUUSQINWWMDMMW-UHFFFAOYSA-N	348.195011428							117084
ST50205368	LSM-28532	SID4257682, BRD-A09114293	2968920	InChI=1S/C19H21NO3/c1-15(19(21)20-11-13-22-14-12-20)23-18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3	DXIKPLIZDQJDKL-UHFFFAOYSA-N	CC(Oc1ccc(cc1)c2ccccc2)C(=O)N3CCOCC3	BroadT	BRD-A09114293	BRD-A09114293-001-05-2	ChemBridge Corporation	7937278			CC(Oc1ccc(cc1)-c1ccccc1)C(=O)N1CCOCC1	InChI=1S/C19H21NO3/c1-15(19(21)20-11-13-22-14-12-20)23-18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3	DXIKPLIZDQJDKL-UHFFFAOYSA-N	311.152143542							117085
MLS000729634	LSM-28533	SID24810199, BRD-K07137142	16193029	InChI=1S/C23H31N3O3S/c1-2-28-22(27)19-9-11-20(12-10-19)24-23(30)26(18-21-8-7-17-29-21)16-15-25-13-5-3-4-6-14-25/h7-12,17H,2-6,13-16,18H2,1H3,(H,24,30)	JAACPTLVSQHMPO-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=S)N(CCN2CCCCCC2)Cc3occc3)cc1	BroadT	BRD-K07137142	BRD-K07137142-001-05-6	ChemDiv Inc.	C087-0129			CCOC(=O)c1ccc(NC(=S)N(CCN2CCCCCC2)Cc2ccco2)cc1	InChI=1S/C23H31N3O3S/c1-2-28-22(27)19-9-11-20(12-10-19)24-23(30)26(18-21-8-7-17-29-21)16-15-25-13-5-3-4-6-14-25/h7-12,17H,2-6,13-16,18H2,1H3,(H,24,30)	JAACPTLVSQHMPO-UHFFFAOYSA-N	429.208612572							117086
SMR000150273	LSM-28534	SID16952761, BRD-K58543665	2410685	InChI=1S/C22H19N3O5/c26-20-13-25(19-10-4-3-9-18(19)24-20)21(27)14-30-22(28)16-7-1-2-8-17(16)23-12-15-6-5-11-29-15/h1-11,23H,12-14H2,(H,24,26)	IDBQUAYMVJHVGJ-UHFFFAOYSA-N	O=C(COC(=O)c1ccccc1NCc2occc2)N3CC(=O)Nc4ccccc34	BroadT	BRD-K58543665	BRD-K58543665-001-06-8	Enamine Ltd.	T5210499			O=C(COC(=O)c1ccccc1NCc1ccco1)N1CC(=O)Nc2ccccc12	InChI=1S/C22H19N3O5/c26-20-13-25(19-10-4-3-9-18(19)24-20)21(27)14-30-22(28)16-7-1-2-8-17(16)23-12-15-6-5-11-29-15/h1-11,23H,12-14H2,(H,24,26)	IDBQUAYMVJHVGJ-UHFFFAOYSA-N	405.132470738							117087
MLS000673361	LSM-28535	SID24814117, BRD-K83779198	16194229	InChI=1S/C26H31N7O3S2/c27-38(35,36)20-10-8-19(9-11-20)12-14-28-24(34)18-37-26-29-22-7-3-2-6-21(22)25-30-23(31-33(25)26)13-17-32-15-4-1-5-16-32/h2-3,6-11H,1,4-5,12-18H2,(H,28,34)(H2,27,35,36)	UVHQKRMKRABMMB-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(CCNC(=O)CSc2nc3ccccc3c4nc(CCN5CCCCC5)nn24)cc1	BroadT	BRD-K83779198	BRD-K83779198-001-05-5	ChemDiv Inc.	K280-0084			NS(=O)(=O)c1ccc(CCNC(=O)CSc2nc3ccccc3c3nc(CCN4CCCCC4)nn23)cc1	InChI=1S/C26H31N7O3S2/c27-38(35,36)20-10-8-19(9-11-20)12-14-28-24(34)18-37-26-29-22-7-3-2-6-21(22)25-30-23(31-33(25)26)13-17-32-15-4-1-5-16-32/h2-3,6-11H,1,4-5,12-18H2,(H,28,34)(H2,27,35,36)	UVHQKRMKRABMMB-UHFFFAOYSA-N	553.192979302							117088
6345-69-3	LSM-28536	SID24803450, BRD-K34023303	1135856	InChI=1S/C17H13N3O3S2/c21-15(13-3-1-9-23-13)18-11-5-7-12(8-6-11)19-17(24)20-16(22)14-4-2-10-25-14/h1-10H,(H,18,21)(H2,19,20,22,24)	HDCMQOAMCVCDEM-UHFFFAOYSA-N	O=C(Nc1ccc(NC(=S)NC(=O)c2cccs2)cc1)c3occc3	BroadT	BRD-K34023303	BRD-K34023303-001-05-0	Asinex Ltd.	BAS 02722763			O=C(Nc1ccc(NC(=S)NC(=O)c2cccs2)cc1)c1ccco1	InChI=1S/C17H13N3O3S2/c21-15(13-3-1-9-23-13)18-11-5-7-12(8-6-11)19-17(24)20-16(22)14-4-2-10-25-14/h1-10H,(H,18,21)(H2,19,20,22,24)	HDCMQOAMCVCDEM-UHFFFAOYSA-N	371.039832686							117089
T5277874	LSM-28537	SID22411115, BRD-K02116101	3382569	InChI=1S/C22H26N2O9S/c1-6-32-22(27)19-13(7-12(2)3)11-34-20(19)23-18(25)10-33-21(26)14-8-16(30-4)17(31-5)9-15(14)24(28)29/h8-9,11-12H,6-7,10H2,1-5H3,(H,23,25)	NOVKXHLIJDTQLK-UHFFFAOYSA-N	CCOC(=O)c1c(CC(C)C)csc1NC(=O)COC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-]	BroadT	BRD-K02116101	BRD-K02116101-001-05-4	Enamine Ltd.	T5277874			CCOC(=O)c1c(CC(C)C)csc1NC(=O)COC(=O)c1cc(OC)c(OC)cc1[N+]([O-])=O	InChI=1S/C22H26N2O9S/c1-6-32-22(27)19-13(7-12(2)3)11-34-20(19)23-18(25)10-33-21(26)14-8-16(30-4)17(31-5)9-15(14)24(28)29/h8-9,11-12H,6-7,10H2,1-5H3,(H,23,25)	NOVKXHLIJDTQLK-UHFFFAOYSA-N	494.135901122							117090
SMR000047556	LSM-28538	SID865048, BRD-A84728528	666294	InChI=1S/C20H19F3N4O3/c1-29-13-5-2-4-12(8-13)16-9-17(20(21,22)23)27-18(26-16)15(11-25-27)19(28)24-10-14-6-3-7-30-14/h2,4-5,8-9,11,14H,3,6-7,10H2,1H3,(H,24,28)	ONKFNPXZADXJEQ-UHFFFAOYSA-N	COc1cccc(c1)c2cc(n3ncc(C(=O)NCC4CCCO4)c3n2)C(F)(F)F	BroadT	BRD-A84728528	BRD-A84728528-001-05-4	InterBioScreen Ltd.	STOCK5S-34813			COc1cccc(c1)-c1cc(n2ncc(C(=O)NCC3CCCO3)c2n1)C(F)(F)F	InChI=1S/C20H19F3N4O3/c1-29-13-5-2-4-12(8-13)16-9-17(20(21,22)23)27-18(26-16)15(11-25-27)19(28)24-10-14-6-3-7-30-14/h2,4-5,8-9,11,14H,3,6-7,10H2,1H3,(H,24,28)	ONKFNPXZADXJEQ-UHFFFAOYSA-N	420.140925108							117091
CHEMBL1625739	LSM-15430	BRD-A79892139	16194354	InChI=1S/C21H24Cl2N2O2/c1-4-10-24-12-18-20(27-19-9-8-15(22)11-16(19)23)21(26)25(18)17-7-5-6-13(2)14(17)3/h5-9,11,18,20,24H,4,10,12H2,1-3H3	PABJFNUPGAPYHR-UHFFFAOYSA-N	CCCNCC1C(Oc2ccc(Cl)cc2Cl)C(=O)N1c3cccc(C)c3C	BroadT	BRD-A79892139	BRD-A79892139-003-07-8	ChemDiv Inc.	C430-0632		Cl	CCCNCC1C(Oc2ccc(Cl)cc2Cl)C(=O)N1c1cccc(C)c1C.Cl	InChI=1S/C21H24Cl2N2O2.ClH/c1-4-10-24-12-18-20(27-19-9-8-15(22)11-16(19)23)21(26)25(18)17-7-5-6-13(2)14(17)3;/h5-9,11,18,20,24H,4,10,12H2,1-3H3;1H	PMRDBWNSCWMYHT-UHFFFAOYSA-N	406.121483448							104072, 104072
N-(4-Methoxyphenyl)-5-[(4-methylphenyl)methyl]furan-2-carboxamide	LSM-28539	SID14718782, BRD-K14261696	2886776	InChI=1S/C20H19NO3/c1-14-3-5-15(6-4-14)13-18-11-12-19(24-18)20(22)21-16-7-9-17(23-2)10-8-16/h3-12H,13H2,1-2H3,(H,21,22)	BJVUMLSJBYDDKN-UHFFFAOYSA-N	COc1ccc(NC(=O)c2oc(Cc3ccc(C)cc3)cc2)cc1	BroadT	BRD-K14261696	BRD-K14261696-001-05-5	Specs	AJ-292/14556129			COc1ccc(NC(=O)c2ccc(Cc3ccc(C)cc3)o2)cc1	InChI=1S/C20H19NO3/c1-14-3-5-15(6-4-14)13-18-11-12-19(24-18)20(22)21-16-7-9-17(23-2)10-8-16/h3-12H,13H2,1-2H3,(H,21,22)	BJVUMLSJBYDDKN-UHFFFAOYSA-N	321.136493478							117092
ZINC04107496	LSM-28540	SID24815931, BRD-K30738487	3463675	InChI=1S/C14H9FN4O2/c15-11-4-2-1-3-10(11)12(20)17-14-19-18-13(21-14)9-5-7-16-8-6-9/h1-8H,(H,17,19,20)	KPHQVMAYLOKTSV-UHFFFAOYSA-N	Fc1ccccc1C(=O)Nc2oc(nn2)c3ccncc3	BroadT	BRD-K30738487	BRD-K30738487-001-05-5	Life Chemicals Inc.	F0608-1153			Fc1ccccc1C(=O)Nc1nnc(o1)-c1ccncc1	InChI=1S/C14H9FN4O2/c15-11-4-2-1-3-10(11)12(20)17-14-19-18-13(21-14)9-5-7-16-8-6-9/h1-8H,(H,17,19,20)	KPHQVMAYLOKTSV-UHFFFAOYSA-N	284.070953768							117093
T5244313	LSM-28541	SID22410125, BRD-K35848108	3915651	InChI=1S/C24H23ClN2O7S/c1-3-27(16-8-5-4-6-9-16)35(31,32)17-12-13-19(25)20(14-17)26-22(28)15-34-24(30)18-10-7-11-21(33-2)23(18)29/h4-14,29H,3,15H2,1-2H3,(H,26,28)	ZOXPMPMPLQXDNO-UHFFFAOYSA-N	CCN(c1ccccc1)S(=O)(=O)c2ccc(Cl)c(NC(=O)COC(=O)c3cccc(OC)c3O)c2	BroadT	BRD-K35848108	BRD-K35848108-001-05-6	Enamine Ltd.	T5244313			CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(NC(=O)COC(=O)c2cccc(OC)c2O)c1	InChI=1S/C24H23ClN2O7S/c1-3-27(16-8-5-4-6-9-16)35(31,32)17-12-13-19(25)20(14-17)26-22(28)15-34-24(30)18-10-7-11-21(33-2)23(18)29/h4-14,29H,3,15H2,1-2H3,(H,26,28)	ZOXPMPMPLQXDNO-UHFFFAOYSA-N	518.091449496							117094
MLS000102704	LSM-28542	SID7971567, BRD-K69560660	5310503	InChI=1S/C19H20N2O5S2/c1-24-15-6-4-13(5-7-15)19-21-14(12-27-19)11-20-28(22,23)18-10-16(25-2)8-9-17(18)26-3/h4-10,12,20H,11H2,1-3H3	GXZGKEJIKIKOHA-UHFFFAOYSA-N	COc1ccc(cc1)c2nc(CNS(=O)(=O)c3cc(OC)ccc3OC)cs2	BroadT	BRD-K69560660	BRD-K69560660-001-05-6	Life Chemicals Inc.	F0684-0347			COc1ccc(cc1)-c1nc(CNS(=O)(=O)c2cc(OC)ccc2OC)cs1	InChI=1S/C19H20N2O5S2/c1-24-15-6-4-13(5-7-15)19-21-14(12-27-19)11-20-28(22,23)18-10-16(25-2)8-9-17(18)26-3/h4-10,12,20H,11H2,1-3H3	GXZGKEJIKIKOHA-UHFFFAOYSA-N	420.08136314							117095
MLS000592140	LSM-28543	SID17513460, BRD-K29585783	1980951	InChI=1S/C22H20O2/c1-16-10-9-11-17(2)21(16)24-22(23)20(18-12-5-3-6-13-18)19-14-7-4-8-15-19/h3-15,20H,1-2H3	JZUOYRVYBNOGRQ-UHFFFAOYSA-N	Cc1cccc(C)c1OC(=O)C(c2ccccc2)c3ccccc3	BroadT	BRD-K29585783	BRD-K29585783-001-07-0	InterBioScreen Ltd.	STOCK3S-35800			Cc1cccc(C)c1OC(=O)C(c1ccccc1)c1ccccc1	InChI=1S/C22H20O2/c1-16-10-9-11-17(2)21(16)24-22(23)20(18-12-5-3-6-13-18)19-14-7-4-8-15-19/h3-15,20H,1-2H3	JZUOYRVYBNOGRQ-UHFFFAOYSA-N	316.14632988							117096
T0509-8441	LSM-28544	SID24828496, BRD-K58234259	2366372	InChI=1S/C12H17N3S2/c1-2-3-4-5-8-15-11(13-14-12(15)16)10-7-6-9-17-10/h6-7,9H,2-5,8H2,1H3,(H,14,16)	VFXXQDUIKBULRC-UHFFFAOYSA-N	CCCCCCn1c(S)nnc1c2cccs2	BroadT	BRD-K58234259	BRD-K58234259-001-05-8	Enamine Ltd.	T0509-8441			CCCCCCn1c(S)nnc1-c1cccs1	InChI=1S/C12H17N3S2/c1-2-3-4-5-8-15-11(13-14-12(15)16)10-7-6-9-17-10/h6-7,9H,2-5,8H2,1H3,(H,14,16)	VFXXQDUIKBULRC-UHFFFAOYSA-N	267.086388954							117097
AC1M6HUQ	LSM-28545	SID24833466, BRD-K78780487	2373514	InChI=1S/C15H15N5O2S2/c1-7-12(21)18-15(20-19-7)23-6-10-16-13(22)11-8-4-2-3-5-9(8)24-14(11)17-10/h2-6H2,1H3,(H,16,17,22)(H,18,20,21)	KJKHBRAIWVBQQD-UHFFFAOYSA-N	Cc1nnc(SCc2nc(O)c3c4CCCCc4sc3n2)nc1O	BroadT	BRD-K78780487	BRD-K78780487-001-05-0	Enamine Ltd.	T0512-9173			Cc1nnc(SCc2nc(O)c3c4CCCCc4sc3n2)nc1O	InChI=1S/C15H15N5O2S2/c1-7-12(21)18-15(20-19-7)23-6-10-16-13(22)11-8-4-2-3-5-9(8)24-14(11)17-10/h2-6H2,1H3,(H,16,17,22)(H,18,20,21)	KJKHBRAIWVBQQD-UHFFFAOYSA-N	361.06671615							117098
MLS000093640	LSM-28546	SID4244312, BRD-A29599024	3238928	InChI=1S/C20H23NO5/c1-11-16-14(6-7-15-17(16)13(22)9-20(2,3)26-15)25-18(11)19(23)21-10-12-5-4-8-24-12/h6-7,12H,4-5,8-10H2,1-3H3,(H,21,23)	YFHMPUFRVPAYFT-UHFFFAOYSA-N	Cc1c(oc2ccc3OC(C)(C)CC(=O)c3c12)C(=O)NCC4CCCO4	BroadT	BRD-A29599024	BRD-A29599024-001-05-6	ChemDiv Inc.	C795-0468			Cc1c(oc2ccc3OC(C)(C)CC(=O)c3c12)C(=O)NCC1CCCO1	InChI=1S/C20H23NO5/c1-11-16-14(6-7-15-17(16)13(22)9-20(2,3)26-15)25-18(11)19(23)21-10-12-5-4-8-24-12/h6-7,12H,4-5,8-10H2,1-3H3,(H,21,23)	YFHMPUFRVPAYFT-UHFFFAOYSA-N	357.157622846							117099
MLS-0044127.0001	LSM-1377	BRD-A19928752, SID4264118, SID56373686	2977752	InChI=1S/C12H14N4OS/c1-8-3-5-10(6-4-8)18-9(2)11(17)15-12-13-7-14-16-12/h3-7,9H,1-2H3,(H2,13,14,15,16,17)	BQPRBYLILBRUER-UHFFFAOYSA-N	CC(Sc1ccc(C)cc1)C(=O)Nc2nc[nH]n2	BroadT	BRD-A19928752	BRD-A19928752-001-05-7	Sanford-Burnham Medical Research Institute	2-[(4-methylphenyl)thio]-N-4H-1,2,4-triazol-3-ylpropanamide MLS-0044127.0001			CC(Sc1ccc(C)cc1)C(=O)Nc1nc[nH]n1	InChI=1S/C12H14N4OS/c1-8-3-5-10(6-4-8)18-9(2)11(17)15-12-13-7-14-16-12/h3-7,9H,1-2H3,(H2,13,14,15,16,17)	BQPRBYLILBRUER-UHFFFAOYSA-N	262.088831798							91574
MLS000061775	LSM-28547	SID4256569, BRD-K22876403	779290	InChI=1S/C14H16N2O3S2/c17-21(18,14-2-1-11-20-14)15-12-3-5-13(6-4-12)16-7-9-19-10-8-16/h1-6,11,15H,7-10H2	PRTSNNYICAXBIW-UHFFFAOYSA-N	O=S(=O)(Nc1ccc(cc1)N2CCOCC2)c3cccs3	BroadT	BRD-K22876403	BRD-K22876403-001-06-2	ChemBridge Corporation	5807962			O=S(=O)(Nc1ccc(cc1)N1CCOCC1)c1cccs1	InChI=1S/C14H16N2O3S2/c17-21(18,14-2-1-11-20-14)15-12-3-5-13(6-4-12)16-7-9-19-10-8-16/h1-6,11,15H,7-10H2	PRTSNNYICAXBIW-UHFFFAOYSA-N	324.060233772							117100
Ethyl 2-(diisobutoxyphosphoryl)-3,3,3-trifluoro-2-{[(4-methylphenyl)sulphonyl]amino}propanoate	LSM-28548	SID17512255, BRD-A91249015	2779849	InChI=1S/C20H31F3NO7PS/c1-7-29-18(25)19(20(21,22)23,24-33(27,28)17-10-8-16(6)9-11-17)32(26,30-12-14(2)3)31-13-15(4)5/h8-11,14-15,24H,7,12-13H2,1-6H3	KREHTTSFYWSORW-UHFFFAOYSA-N	CCOC(=O)C(NS(=O)(=O)c1ccc(C)cc1)(C(F)(F)F)P(=O)(OCC(C)C)OCC(C)C	BroadT	BRD-A91249015	BRD-A91249015-001-05-2	InterBioScreen Ltd.	STOCK1S-60038			CCOC(=O)C(NS(=O)(=O)c1ccc(C)cc1)(C(F)(F)F)P(=O)(OCC(C)C)OCC(C)C	InChI=1S/C20H31F3NO7PS/c1-7-29-18(25)19(20(21,22)23,24-33(27,28)17-10-8-16(6)9-11-17)32(26,30-12-14(2)3)31-13-15(4)5/h8-11,14-15,24H,7,12-13H2,1-6H3	KREHTTSFYWSORW-UHFFFAOYSA-N	517.151094142							117101
SMR000096634	LSM-28549	SID7966765, BRD-A52434390	5308430	InChI=1S/C18H23N3O2S/c22-17(19-12-14-5-4-10-23-14)13-6-7-15-16(11-13)24-18(20-15)21-8-2-1-3-9-21/h6-7,11,14H,1-5,8-10,12H2,(H,19,22)	BTUSBBIRPZNFDX-UHFFFAOYSA-N	O=C(NCC1CCCO1)c2ccc3nc(sc3c2)N4CCCCC4	BroadT	BRD-A52434390	BRD-A52434390-001-04-5	ChemDiv Inc.	C858-0677			O=C(NCC1CCCO1)c1ccc2nc(sc2c1)N1CCCCC1	InChI=1S/C18H23N3O2S/c22-17(19-12-14-5-4-10-23-14)13-6-7-15-16(11-13)24-18(20-15)21-8-2-1-3-9-21/h6-7,11,14H,1-5,8-10,12H2,(H,19,22)	BTUSBBIRPZNFDX-UHFFFAOYSA-N	345.151097696							117102
3-(2-Propoxybenzyl)-1,3-benzoxazol-2(3H)-one	LSM-28550	SID49641129, BRD-K64129922	2059717	InChI=1S/C17H17NO3/c1-2-11-20-15-9-5-3-7-13(15)12-18-14-8-4-6-10-16(14)21-17(18)19/h3-10H,2,11-12H2,1H3	LXCSCBRELHFMMF-UHFFFAOYSA-N	CCCOc1ccccc1CN2C(=O)Oc3ccccc23	BroadT	BRD-K64129922	BRD-K64129922-001-05-9	Asinex Ltd.	BAS 07247341			CCCOc1ccccc1Cn1c2ccccc2oc1=O	InChI=1S/C17H17NO3/c1-2-11-20-15-9-5-3-7-13(15)12-18-14-8-4-6-10-16(14)21-17(18)19/h3-10H,2,11-12H2,1H3	LXCSCBRELHFMMF-UHFFFAOYSA-N	283.120843414							117103
MLS000528676	LSM-28551	SID16953184, BRD-A02678271	3229070	InChI=1S/C23H24F3N5O/c1-15-12-16-4-2-3-5-20(16)30(15)22(32)14-29-10-8-18(9-11-29)31-21-7-6-17(23(24,25)26)13-19(21)27-28-31/h2-7,13,15,18H,8-12,14H2,1H3	GCPQPOUIAUKDFC-UHFFFAOYSA-N	CC1Cc2ccccc2N1C(=O)CN3CCC(CC3)n4nnc5cc(ccc45)C(F)(F)F	BroadT	BRD-A02678271	BRD-A02678271-001-05-9	Asinex Ltd.	ASN 07876453			CC1Cc2ccccc2N1C(=O)CN1CCC(CC1)n1nnc2cc(ccc12)C(F)(F)F	InChI=1S/C23H24F3N5O/c1-15-12-16-4-2-3-5-20(16)30(15)22(32)14-29-10-8-18(9-11-29)31-21-7-6-17(23(24,25)26)13-19(21)27-28-31/h2-7,13,15,18H,8-12,14H2,1H3	GCPQPOUIAUKDFC-UHFFFAOYSA-N	443.193295038							117104
AC1LHNSP	LSM-28552	SID14731975, BRD-K78512970	866272	InChI=1S/C17H19N3O/c1-3-20-12-19-16-10-14(6-9-17(16)20)18-11-13-4-7-15(21-2)8-5-13/h4-10,12,18H,3,11H2,1-2H3	BTUKXUOJPKBPIP-UHFFFAOYSA-N	CCn1cnc2cc(NCc3ccc(OC)cc3)ccc12	BroadT	BRD-K78512970	BRD-K78512970-001-05-1	ChemBridge Corporation	7957031			CCn1cnc2cc(NCc3ccc(OC)cc3)ccc12	InChI=1S/C17H19N3O/c1-3-20-12-19-16-10-14(6-9-17(16)20)18-11-13-4-7-15(21-2)8-5-13/h4-10,12,18H,3,11H2,1-2H3	BTUKXUOJPKBPIP-UHFFFAOYSA-N	281.152812258							117105
F1633-0012	LSM-28553	SID24780420, BRD-K53488478	3157306	InChI=1S/C19H19NO3/c1-13-8-9-16-15(12-13)18(21)19(22)20(16)10-5-11-23-17-7-4-3-6-14(17)2/h3-4,6-9,12H,5,10-11H2,1-2H3	YNNVFSKNTUAOSB-UHFFFAOYSA-N	Cc1ccc2N(CCCOc3ccccc3C)C(=O)C(=O)c2c1	BroadT	BRD-K53488478	BRD-K53488478-001-05-0	Asinex Ltd.	BAS 08209860			Cc1ccc2N(CCCOc3ccccc3C)C(=O)C(=O)c2c1	InChI=1S/C19H19NO3/c1-13-8-9-16-15(12-13)18(21)19(22)20(16)10-5-11-23-17-7-4-3-6-14(17)2/h3-4,6-9,12H,5,10-11H2,1-2H3	YNNVFSKNTUAOSB-UHFFFAOYSA-N	309.136493478							117106
MLS000334743	LSM-28554	SID22403791, BRD-K02579626	2441963	InChI=1S/C16H17ClN2S/c17-14-10-4-5-11-15(14)19-16(20)18-12-6-9-13-7-2-1-3-8-13/h1-5,7-8,10-11H,6,9,12H2,(H2,18,19,20)	HLESNLDLVYVEGQ-UHFFFAOYSA-N	Clc1ccccc1NC(=S)NCCCc2ccccc2	BroadT	BRD-K02579626	BRD-K02579626-001-05-9	Enamine Ltd.	T5306872			Clc1ccccc1NC(=S)NCCCc1ccccc1	InChI=1S/C16H17ClN2S/c17-14-10-4-5-11-15(14)19-16(20)18-12-6-9-13-7-2-1-3-8-13/h1-5,7-8,10-11H,6,9,12H2,(H2,18,19,20)	HLESNLDLVYVEGQ-UHFFFAOYSA-N	304.080096964							117107
SMR000146144	LSM-28555	SID14742375, BRD-K43673595	3829432	InChI=1S/C15H16N2O3S/c1-2-20-14(19)7-12(18)9-21-15-11(8-16)6-10-4-3-5-13(10)17-15/h6H,2-5,7,9H2,1H3	HVLNOCYDURSSHZ-UHFFFAOYSA-N	CCOC(=O)CC(=O)CSc1nc2CCCc2cc1C#N	BroadT	BRD-K43673595	BRD-K43673595-001-06-6	InterBioScreen Ltd.	STOCK1S-22248			CCOC(=O)CC(=O)CSc1nc2CCCc2cc1C#N	InChI=1S/C15H16N2O3S/c1-2-20-14(19)7-12(18)9-21-15-11(8-16)6-10-4-3-5-13(10)17-15/h6H,2-5,7,9H2,1H3	HVLNOCYDURSSHZ-UHFFFAOYSA-N	304.088163082							117108
MLS000567618	LSM-28556	SID17504618, BRD-K00833124	5287037	InChI=1S/C9H9ClN6/c10-5-1-3-6(4-2-5)13-14-7-8(11)15-16-9(7)12/h1-4H,(H5,11,12,15,16)	AFJGGVKGGIUNFB-UHFFFAOYSA-N	Nc1n[nH]c(N)c1N=Nc2ccc(Cl)cc2	BroadT	BRD-K00833124	BRD-K00833124-001-05-9	Asinex Ltd.	BAS 03242152			Nc1n[nH]c(N)c1N=Nc1ccc(Cl)cc1	InChI=1S/C9H9ClN6/c10-5-1-3-6(4-2-5)13-14-7-8(11)15-16-9(7)12/h1-4H,(H5,11,12,15,16)	AFJGGVKGGIUNFB-UHFFFAOYSA-N	236.057722058							
F0594-0375	LSM-28557	SID4241191, SID87344845, BRD-K02411569	2155776	InChI=1S/C17H14ClN3O2S2/c18-14-8-7-13(25-14)16-19-20-17(23-16)24-10-15(22)21-9-3-5-11-4-1-2-6-12(11)21/h1-2,4,6-8H,3,5,9-10H2	GCKCILOHBDMBLH-UHFFFAOYSA-N	Clc1ccc(s1)c2oc(SCC(=O)N3CCCc4ccccc34)nn2	BroadT	BRD-K02411569	BRD-K02411569-001-05-4	ChemDiv Inc.	C292-0246			Clc1ccc(s1)-c1nnc(SCC(=O)N2CCCc3ccccc23)o1	InChI=1S/C17H14ClN3O2S2/c18-14-8-7-13(25-14)16-19-20-17(23-16)24-10-15(22)21-9-3-5-11-4-1-2-6-12(11)21/h1-2,4,6-8H,3,5,9-10H2	GCKCILOHBDMBLH-UHFFFAOYSA-N	391.021595808							117110
MLS000704566	LSM-28558	BRD-A20047221	4430112	InChI=1S/C18H16FN3O3/c1-12-17(18(23)22(20-12)15-5-3-2-4-6-15)16(11-21(24)25)13-7-9-14(19)10-8-13/h2-10,16,23H,11H2,1H3	LIYNJQCDMODWAP-UHFFFAOYSA-N	Cc1nn(c(O)c1C(C[N+](=O)[O-])c2ccc(F)cc2)c3ccccc3	BroadT	BRD-A20047221	BRD-A20047221-001-07-2	Specs	AP-906/41650366			Cc1nn(c(O)c1C(C[N+]([O-])=O)c1ccc(F)cc1)-c1ccccc1	InChI=1S/C18H16FN3O3/c1-12-17(18(23)22(20-12)15-5-3-2-4-6-15)16(11-21(24)25)13-7-9-14(19)10-8-13/h2-10,16,23H,11H2,1H3	LIYNJQCDMODWAP-UHFFFAOYSA-N	341.117569602							
Ethyl 1-[(4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-2-yl)carbonyl]piperidine-4-carboxylate	LSM-28559	SID49737047, BRD-K44158345	1253448	InChI=1S/C19H19N3O4S/c1-2-26-19(25)12-6-9-21(10-7-12)18(24)14-11-13-16(27-14)20-15-5-3-4-8-22(15)17(13)23/h3-5,8,11-12H,2,6-7,9-10H2,1H3	CCLUIZVVCMQXLS-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC1)C(=O)c2cc3C(=O)N4C=CC=CC4=Nc3s2	BroadT	BRD-K44158345	BRD-K44158345-001-05-2	ChemBridge Corporation	7963550			CCOC(=O)C1CCN(CC1)C(=O)c1cc2c(nc3ccccn3c2=O)s1	InChI=1S/C19H19N3O4S/c1-2-26-19(25)12-6-9-21(10-7-12)18(24)14-11-13-16(27-14)20-15-5-3-4-8-22(15)17(13)23/h3-5,8,11-12H,2,6-7,9-10H2,1H3	CCLUIZVVCMQXLS-UHFFFAOYSA-N	385.109626808							117112
T5743438	LSM-28560	SID17516432, BRD-K47004627	2697826	InChI=1S/C20H24N2OS/c1-16-11-13-22(14-12-16)15-20(23)21-18-9-5-6-10-19(18)24-17-7-3-2-4-8-17/h2-10,16H,11-15H2,1H3,(H,21,23)	LYPDZWFWTRSAIS-UHFFFAOYSA-N	CC1CCN(CC(=O)Nc2ccccc2Sc3ccccc3)CC1	BroadT	BRD-K47004627	BRD-K47004627-001-05-4	Enamine Ltd.	ZT-9943899			CC1CCN(CC(=O)Nc2ccccc2Sc2ccccc2)CC1	InChI=1S/C20H24N2OS/c1-16-11-13-22(14-12-16)15-20(23)21-18-9-5-6-10-19(18)24-17-7-3-2-4-8-17/h2-10,16H,11-15H2,1H3,(H,21,23)	LYPDZWFWTRSAIS-UHFFFAOYSA-N	340.160934098							117113
STK180347	LSM-28561	SID4263471, BRD-K88892681	1256815	InChI=1S/C18H21N3O3/c1-2-17(22)21-11-9-20(10-12-21)15-7-5-14(6-8-15)19-18(23)16-4-3-13-24-16/h3-8,13H,2,9-12H2,1H3,(H,19,23)	NWSLMJAYZDILSI-UHFFFAOYSA-N	CCC(=O)N1CCN(CC1)c2ccc(NC(=O)c3occc3)cc2	BroadT	BRD-K88892681	BRD-K88892681-001-05-5	ChemBridge Corporation	7974902			CCC(=O)N1CCN(CC1)c1ccc(NC(=O)c2ccco2)cc1	InChI=1S/C18H21N3O3/c1-2-17(22)21-11-9-20(10-12-21)15-7-5-14(6-8-15)19-18(23)16-4-3-13-24-16/h3-8,13H,2,9-12H2,1H3,(H,19,23)	NWSLMJAYZDILSI-UHFFFAOYSA-N	327.158291562							117114
AC1MLV8S	LSM-28562	SID24835506, BRD-K28627663	3276076	InChI=1S/C24H28N4O5S/c1-3-28(4-2)34(31,32)17-9-10-22(27-11-13-33-14-12-27)21(15-17)26-24(30)19-16-23(29)25-20-8-6-5-7-18(19)20/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,25,29)(H,26,30)	CDRNXJWUVXRPEC-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)c3cc(O)nc4ccccc34)c1	BroadT	BRD-K28627663	BRD-K28627663-001-05-0	Enamine Ltd.	T5257609			CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)c2cc(O)nc3ccccc23)c1	InChI=1S/C24H28N4O5S/c1-3-28(4-2)34(31,32)17-9-10-22(27-11-13-33-14-12-27)21(15-17)26-24(30)19-16-23(29)25-20-8-6-5-7-18(19)20/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,25,29)(H,26,30)	CDRNXJWUVXRPEC-UHFFFAOYSA-N	484.178040726							117115
AC1MGTWK	LSM-28563	SID24792708, BRD-A56081840	2941437	InChI=1S/C20H22ClNO3/c1-14-11-22(12-15(2)25-14)20(23)17-7-5-6-16(10-17)13-24-19-9-4-3-8-18(19)21/h3-10,14-15H,11-13H2,1-2H3	PNPVKLYBTXEAOU-UHFFFAOYSA-N	CC1CN(CC(C)O1)C(=O)c2cccc(COc3ccccc3Cl)c2	BroadT	BRD-A56081840	BRD-A56081840-001-05-3	ChemBridge Corporation	7511760			CC1CN(CC(C)O1)C(=O)c1cccc(COc2ccccc2Cl)c1	InChI=1S/C20H22ClNO3/c1-14-11-22(12-15(2)25-14)20(23)17-7-5-6-16(10-17)13-24-19-9-4-3-8-18(19)21/h3-10,14-15H,11-13H2,1-2H3	PNPVKLYBTXEAOU-UHFFFAOYSA-N	359.128821284							117116
MLS000034806	LSM-28564	SID844147, BRD-K93462922	646463	InChI=1S/C11H12N4O2/c1-7(16)12-11-13-10(14-15-11)8-5-3-4-6-9(8)17-2/h3-6H,1-2H3,(H2,12,13,14,15,16)	DQTCUSYYXMWFGW-UHFFFAOYSA-N	COc1ccccc1c2n[nH]c(NC(=O)C)n2	BroadT	BRD-K93462922	BRD-K93462922-001-03-4	Asinex Ltd.	BAS 04297528			COc1ccccc1-c1n[nH]c(NC(C)=O)n1	InChI=1S/C11H12N4O2/c1-7(16)12-11-13-10(14-15-11)8-5-3-4-6-9(8)17-2/h3-6H,1-2H3,(H2,12,13,14,15,16)	DQTCUSYYXMWFGW-UHFFFAOYSA-N	232.096025664							117117
T5653763	LSM-28565	SID24834380, BRD-A22625833	3998366	InChI=1S/C20H18N2O4/c1-26-20(25)17(11-13-7-3-2-4-8-13)22-19(24)15-12-18(23)21-16-10-6-5-9-14(15)16/h2-10,12,17H,11H2,1H3,(H,21,23)(H,22,24)	PWBLWVLXMGIXNP-UHFFFAOYSA-N	COC(=O)C(Cc1ccccc1)NC(=O)c2cc(O)nc3ccccc23	BroadT	BRD-A22625833	BRD-A22625833-001-05-7	Enamine Ltd.	T0520-6461			COC(=O)C(Cc1ccccc1)NC(=O)c1cc(O)nc2ccccc12	InChI=1S/C20H18N2O4/c1-26-20(25)17(11-13-7-3-2-4-8-13)22-19(24)15-12-18(23)21-16-10-6-5-9-14(15)16/h2-10,12,17H,11H2,1H3,(H,21,23)(H,22,24)	PWBLWVLXMGIXNP-UHFFFAOYSA-N	350.126657076							117118
MLS000660497	LSM-44283	SID24812329, BRD-K86088195	16193593	InChI=1S/C24H25N3O5/c1-30-19-12-15(13-20(31-2)23(19)32-3)7-10-22(28)25-16-8-9-18-17(14-16)24(29)27-11-5-4-6-21(27)26-18/h7-10,12-14H,4-6,11H2,1-3H3,(H,25,28)/b10-7+	WXTKKVGAQYDMKV-JXMROGBWSA-N	COc1cc(\C=C\C(=O)Nc2ccc3N=C4CCCCN4C(=O)c3c2)cc(OC)c1OC	BroadT	BRD-K86088195	BRD-K86088195-001-05-1	ChemDiv Inc.	C803-0048			COc1cc(\C=C\C(=O)Nc2ccc3nc4CCCCn4c(=O)c3c2)cc(OC)c1OC	InChI=1S/C24H25N3O5/c1-30-19-12-15(13-20(31-2)23(19)32-3)7-10-22(28)25-16-8-9-18-17(14-16)24(29)27-11-5-4-6-21(27)26-18/h7-10,12-14H,4-6,11H2,1-3H3,(H,25,28)/b10-7+	WXTKKVGAQYDMKV-JXMROGBWSA-N	435.17942093							
BAS 00964800	LSM-42943	BRD-K38424085, SID843785, SID87544795, SID89650205	5761203	InChI=1S/C17H18N4O2S/c1-3-4-10-21-13-14(20(2)16(23)19-15(13)22)18-17(21)24-11-12-8-6-5-7-9-12/h3-9H,10-11H2,1-2H3,(H,19,22,23)/b4-3+	TZABDFYHNLGMHW-ONEGZZNKSA-N	C\C=C\Cn1c(SCc2ccccc2)nc3N(C)C(=O)NC(=O)c13	BroadT	BRD-K38424085	BRD-K38424085-001-05-0	Asinex Ltd.	BAS 00964800			C\C=C\Cn1c(SCc2ccccc2)nc2n(C)c(=O)[nH]c(=O)c12	InChI=1S/C17H18N4O2S/c1-3-4-10-21-13-14(20(2)16(23)19-15(13)22)18-17(21)24-11-12-8-6-5-7-9-12/h3-9H,10-11H2,1-2H3,(H,19,22,23)/b4-3+	TZABDFYHNLGMHW-ONEGZZNKSA-N	342.115046546							
MLS000544420	LSM-28567	SID17407054, BRD-K93408918	4302597	InChI=1S/C13H11ClFN5S/c1-7-10(14)11(18-19(7)2)12-16-17-13(21)20(12)9-5-3-8(15)4-6-9/h3-6H,1-2H3,(H,17,21)	MNPQISXNUBUTRX-UHFFFAOYSA-N	Cc1c(Cl)c(nn1C)c2nnc(S)n2c3ccc(F)cc3	BroadT	BRD-K93408918	BRD-K93408918-001-07-4	Specs	AK-968/41169535			Cc1c(Cl)c(nn1C)-c1nnc(S)n1-c1ccc(F)cc1	InChI=1S/C13H11ClFN5S/c1-7-10(14)11(18-19(7)2)12-16-17-13(21)20(12)9-5-3-8(15)4-6-9/h3-6H,1-2H3,(H,17,21)	MNPQISXNUBUTRX-UHFFFAOYSA-N	323.040772002							117120
Adenosine	LSM-28568	Adenosine, Adenoscan, Adenocard, SR-96225	60961	InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1	OIRDTQYFTABQOQ-KQYNXXCUSA-N	Nc1ncnc2c1ncn2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O	BroadT	BRD-K01577834	BRD-K01577834-001-10-2	Sigma-Aldrich	A9251			Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1	OIRDTQYFTABQOQ-KQYNXXCUSA-N	267.096753946							16335
2-[3-[[5-(4-Ethoxyphenyl)-7-methyl-3-oxo-6-(phenylcarbamoyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]phenoxy]acetic acid	LSM-28569	BRD-A85318128	4351577	InChI=1S/C31H27N3O6S/c1-3-39-23-14-12-21(13-15-23)28-27(29(37)33-22-9-5-4-6-10-22)19(2)32-31-34(28)30(38)25(41-31)17-20-8-7-11-24(16-20)40-18-26(35)36/h4-17,28H,3,18H2,1-2H3,(H,33,37)(H,35,36)	PGJHPHPFFIQELK-UHFFFAOYSA-N	CCOc1ccc(cc1)C2N3C(=NC(=C2C(=O)Nc4ccccc4)C)SC(=Cc5cccc(OCC(=O)O)c5)C3=O	BroadT	BRD-A85318128	BRD-A85318128-001-05-7	Specs	AN-648/15596229			CCOc1ccc(cc1)C1C(C(=O)Nc2ccccc2)=C(C)N=c2sc(=Cc3cccc(OCC(O)=O)c3)c(=O)n12	InChI=1S/C31H27N3O6S/c1-3-39-23-14-12-21(13-15-23)28-27(29(37)33-22-9-5-4-6-10-22)19(2)32-31-34(28)30(38)25(41-31)17-20-8-7-11-24(16-20)40-18-26(35)36/h4-17,28H,3,18H2,1-2H3,(H,33,37)(H,35,36)	PGJHPHPFFIQELK-UHFFFAOYSA-N	569.162056304							117121
N-[ethyl(Phenyl)-	LSM-28570	SID26731274, BRD-A44903529	290020	InChI=1S/C15H17NO2S2/c1-3-19(14-7-5-4-6-8-14)16-20(17,18)15-11-9-13(2)10-12-15/h4-12H,3H2,1-2H3	KMANZPQCTGXUSH-UHFFFAOYSA-N	CCS(=NS(=O)(=O)c1ccc(C)cc1)c2ccccc2	BroadT	BRD-A44903529	BRD-A44903529-001-05-1	Maybridge	BTB 15068			CCS(=NS(=O)(=O)c1ccc(C)cc1)c1ccccc1	InChI=1S/C15H17NO2S2/c1-3-19(14-7-5-4-6-8-14)16-20(17,18)15-11-9-13(2)10-12-15/h4-12H,3H2,1-2H3	KMANZPQCTGXUSH-UHFFFAOYSA-N	307.070070174							
3,3'-Methanediylbis([1,2,4]triazolo[4,3-a]pyridine)	LSM-28571	SID3712723, BRD-K25629426	255202	InChI=1S/C13H10N6/c1-3-7-18-10(5-1)14-16-12(18)9-13-17-15-11-6-2-4-8-19(11)13/h1-8H,9H2	HFFOEWOEDWOWKD-UHFFFAOYSA-N	C(c1nnc2ccccn12)c3nnc4ccccn34	BroadT	BRD-K25629426	BRD-K25629426-001-05-7	Enamine Ltd.	T0503-8151			C(c1nnc2ccccn12)c1nnc2ccccn12	InChI=1S/C13H10N6/c1-3-7-18-10(5-1)14-16-12(18)9-13-17-15-11-6-2-4-8-19(11)13/h1-8H,9H2	HFFOEWOEDWOWKD-UHFFFAOYSA-N	250.09669438							117122
MLS000332080	LSM-28572	SID17505836, BRD-K89359276	4860384	InChI=1S/C23H23ClN4O3S/c1-12-16-11-31-23(2,3)10-15(16)17-18-19(32-20(17)26-12)21(30)28(22(27-18)25-7-8-29)14-6-4-5-13(24)9-14/h4-6,9,29H,7-8,10-11H2,1-3H3,(H,25,27)	UCPBPAMCTOWQPS-UHFFFAOYSA-N	Cc1nc2sc3C(=O)N(C(=Nc3c2c4CC(C)(C)OCc14)NCCO)c5cccc(Cl)c5	BroadT	BRD-K89359276	BRD-K89359276-001-05-5	InterBioScreen Ltd.	STOCK5S-29715			Cc1nc2sc3c(nc(NCCO)n(-c4cccc(Cl)c4)c3=O)c2c2CC(C)(C)OCc12	InChI=1S/C23H23ClN4O3S/c1-12-16-11-31-23(2,3)10-15(16)17-18-19(32-20(17)26-12)21(30)28(22(27-18)25-7-8-29)14-6-4-5-13(24)9-14/h4-6,9,29H,7-8,10-11H2,1-3H3,(H,25,27)	UCPBPAMCTOWQPS-UHFFFAOYSA-N	470.117939036							117123
SMR000042441	LSM-28573	SID860553, BRD-A63863910	661837	InChI=1S/C20H22N2O6S/c1-6-27-19(25)16-10(2)21-20-22(18(24)11(3)29-20)17(16)13-7-8-14(28-12(4)23)15(9-13)26-5/h7-9,11,17H,6H2,1-5H3	WOGUMTFKTTWWMP-UHFFFAOYSA-N	CCOC(=O)C1=C(C)N=C2SC(C)C(=O)N2C1c3ccc(OC(=O)C)c(OC)c3	BroadT	BRD-A63863910	BRD-A63863910-001-05-0	InterBioScreen Ltd.	STOCK3S-80955			CCOC(=O)C1=C(C)N=C2SC(C)C(=O)N2C1c1ccc(OC(C)=O)c(OC)c1	InChI=1S/C20H22N2O6S/c1-6-27-19(25)16-10(2)21-20-22(18(24)11(3)29-20)17(16)13-7-8-14(28-12(4)23)15(9-13)26-5/h7-9,11,17H,6H2,1-5H3	WOGUMTFKTTWWMP-UHFFFAOYSA-N	418.119857134							117124
MLS000046509	LSM-28574	SID4247930, BRD-A47567361	3242077	InChI=1S/C22H32N4O3S/c27-20(23-8-5-11-25-9-3-1-2-4-10-25)17-6-7-19-18(16-17)24-21(28)22(30-19)26-12-14-29-15-13-26/h6-7,16,22H,1-5,8-15H2,(H,23,27)(H,24,28)	DNEQSWPVLQJHOO-UHFFFAOYSA-N	O=C(NCCCN1CCCCCC1)c2ccc3SC(N4CCOCC4)C(=O)Nc3c2	BroadT	BRD-A47567361	BRD-A47567361-001-05-2	ChemDiv Inc.	K786-8898			O=C(NCCCN1CCCCCC1)c1ccc2SC(N3CCOCC3)C(=O)Nc2c1	InChI=1S/C22H32N4O3S/c27-20(23-8-5-11-25-9-3-1-2-4-10-25)17-6-7-19-18(16-17)24-21(28)22(30-19)26-12-14-29-15-13-26/h6-7,16,22H,1-5,8-15H2,(H,23,27)(H,24,28)	DNEQSWPVLQJHOO-UHFFFAOYSA-N	432.219511614							117125
STK021511	LSM-44284	SID24792201, BRD-K14612372	5506533	InChI=1S/C21H19ClN4O3S/c22-14-1-5-17(6-2-14)26-20(28)18(19(27)24-21(26)30)13-23-15-3-7-16(8-4-15)25-9-11-29-12-10-25/h1-8,13,23H,9-12H2,(H,24,27,30)/b18-13+	DSTCJHCSWPJKAU-QGOAFFKASA-N	Clc1ccc(cc1)N2C(=S)NC(=O)\C(=C/Nc3ccc(cc3)N4CCOCC4)\C2=O	BroadT	BRD-K14612372	BRD-K14612372-001-06-8	ChemBridge Corporation	7093109			Clc1ccc(cc1)N1C(=S)NC(=O)\C(=C/Nc2ccc(cc2)N2CCOCC2)C1=O	InChI=1S/C21H19ClN4O3S/c22-14-1-5-17(6-2-14)26-20(28)18(19(27)24-21(26)30)13-23-15-3-7-16(8-4-15)25-9-11-29-12-10-25/h1-8,13,23H,9-12H2,(H,24,27,30)/b18-13+	DSTCJHCSWPJKAU-QGOAFFKASA-N	442.086638908							
SMR000068748	LSM-28576	SID3715743, BRD-A77256733	2999338	InChI=1S/C20H23ClN2O3/c1-14-13-16(21)7-8-19(14)26-15(2)20(24)22-17-5-3-4-6-18(17)23-9-11-25-12-10-23/h3-8,13,15H,9-12H2,1-2H3,(H,22,24)	QSYJBBIVXVGYMR-UHFFFAOYSA-N	CC(Oc1ccc(Cl)cc1C)C(=O)Nc2ccccc2N3CCOCC3	BroadT	BRD-A77256733	BRD-A77256733-001-05-6	Enamine Ltd.	ZT-2898565			CC(Oc1ccc(Cl)cc1C)C(=O)Nc1ccccc1N1CCOCC1	InChI=1S/C20H23ClN2O3/c1-14-13-16(21)7-8-19(14)26-15(2)20(24)22-17-5-3-4-6-18(17)23-9-11-25-12-10-23/h3-8,13,15H,9-12H2,1-2H3,(H,22,24)	QSYJBBIVXVGYMR-UHFFFAOYSA-N	374.139720326							117127
MLS001045853	LSM-28577	SID26725425, SID26755996, BRD-A87955826	16745647	InChI=1S/C32H30N2O4/c1-32(38-30(36)17-14-22-8-4-2-5-9-22)29(35)19-25-18-28(24-15-12-23(20-33)13-16-24)34(21-27(25)31(32)37)26-10-6-3-7-11-26/h2,4-5,8-9,12-13,15-16,18-19,21,26H,3,6-7,10-11,14,17H2,1H3	FCBMPROIKFXPAS-UHFFFAOYSA-N	CC1(OC(=O)CCc2ccccc2)C(=O)C=C3C=C(N(C=C3C1=O)C4CCCCC4)c5ccc(cc5)C#N	BroadT	BRD-A87955826	BRD-A87955826-001-06-7	Boston University CMLD	CMLD004073 CMLD004073			CC1(OC(=O)CCc2ccccc2)C(=O)C=C2C=C(N(C=C2C1=O)C1CCCCC1)c1ccc(cc1)C#N	InChI=1S/C32H30N2O4/c1-32(38-30(36)17-14-22-8-4-2-5-9-22)29(35)19-25-18-28(24-15-12-23(20-33)13-16-24)34(21-27(25)31(32)37)26-10-6-3-7-11-26/h2,4-5,8-9,12-13,15-16,18-19,21,26H,3,6-7,10-11,14,17H2,1H3	FCBMPROIKFXPAS-UHFFFAOYSA-N	506.22055746							117128
ZINC02619459	LSM-44285	SID22410851, BRD-K97970672	2081369	InChI=1S/C21H24N2O4/c1-15-5-8-17(9-6-15)22-20(24)14-23(2)21(25)12-7-16-13-18(26-3)10-11-19(16)27-4/h5-13H,14H2,1-4H3,(H,22,24)/b12-7+	BALWREPCBJFBMX-KPKJPENVSA-N	COc1ccc(OC)c(\C=C\C(=O)N(C)CC(=O)Nc2ccc(C)cc2)c1	BroadT	BRD-K97970672	BRD-K97970672-001-05-9	Enamine Ltd.	T5258940			COc1ccc(OC)c(\C=C\C(=O)N(C)CC(=O)Nc2ccc(C)cc2)c1	InChI=1S/C21H24N2O4/c1-15-5-8-17(9-6-15)22-20(24)14-23(2)21(25)12-7-16-13-18(26-3)10-11-19(16)27-4/h5-13H,14H2,1-4H3,(H,22,24)/b12-7+	BALWREPCBJFBMX-KPKJPENVSA-N	368.173607268							
AMBCB41174169	LSM-28579	SID49721023, BRD-A24226290	24791567	InChI=1S/C19H22F2N2O4/c1-2-8-25-14-4-3-7-23(11-14)19(24)18-10-15(27-22-18)12-26-13-5-6-16(20)17(21)9-13/h5-6,9-10,14H,2-4,7-8,11-12H2,1H3	VIVKJJABCCIWRK-UHFFFAOYSA-N	CCCOC1CCCN(C1)C(=O)c2cc(COc3ccc(F)c(F)c3)on2	BroadT	BRD-A24226290	BRD-A24226290-001-05-8	ChemBridge Corporation	41174169			CCCOC1CCCN(C1)C(=O)c1cc(COc2ccc(F)c(F)c2)on1	InChI=1S/C19H22F2N2O4/c1-2-8-25-14-4-3-7-23(11-14)19(24)18-10-15(27-22-18)12-26-13-5-6-16(20)17(21)9-13/h5-6,9-10,14H,2-4,7-8,11-12H2,1H3	VIVKJJABCCIWRK-UHFFFAOYSA-N	380.154763604							117130
MLS000564613	LSM-28580	SID17509200, BRD-K99419441	1675806	InChI=1S/C20H22N4OS/c1-14(2)13-21-20(26)23-22-19(25)11-12-24-17-9-5-3-7-15(17)16-8-4-6-10-18(16)24/h3-10H,1,11-13H2,2H3,(H,22,25)(H2,21,23,26)	YMZXQOZXMNYOEJ-UHFFFAOYSA-N	CC(=C)CN=C(S)NNC(=O)CCn1c2ccccc2c3ccccc13	BroadT	BRD-K99419441	BRD-K99419441-001-05-5	Asinex Ltd.	BAS 00380022			CC(=C)CN=C(S)NNC(=O)CCn1c2ccccc2c2ccccc12	InChI=1S/C20H22N4OS/c1-14(2)13-21-20(26)23-22-19(25)11-12-24-17-9-5-3-7-15(17)16-8-4-6-10-18(16)24/h3-10H,1,11-13H2,2H3,(H,22,25)(H2,21,23,26)	YMZXQOZXMNYOEJ-UHFFFAOYSA-N	366.151432054							117131
AC1M7EO2	LSM-28581	BRD-K39455182	2416671	InChI=1S/C15H15ClN6S/c1-9-4-6-12(7-5-9)22-14(16)13(10(2)20-22)8-17-21-11(3)18-19-15(21)23/h4-8H,1-3H3,(H,19,23)	JEOLTHPUTVBPRV-UHFFFAOYSA-N	Cc1ccc(cc1)n2nc(C)c(C=Nn3c(C)nnc3S)c2Cl	BroadT	BRD-K39455182	BRD-K39455182-001-05-5	Enamine Ltd.	T5212627			Cc1nn(c(Cl)c1C=Nn1c(C)nnc1S)-c1ccc(C)cc1	InChI=1S/C15H15ClN6S/c1-9-4-6-12(7-5-9)22-14(16)13(10(2)20-22)8-17-21-11(3)18-19-15(21)23/h4-8H,1-3H3,(H,19,23)	JEOLTHPUTVBPRV-UHFFFAOYSA-N	346.07674294							117132
2,5-Bis(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)-1,3,4-oxadiazole	LSM-28582	SID26727081, BRD-K12123091	2740693	InChI=1S/C24H22N6O/c1-15-21(17(3)29(27-15)19-11-7-5-8-12-19)23-25-26-24(31-23)22-16(2)28-30(18(22)4)20-13-9-6-10-14-20/h5-14H,1-4H3	WOASUTLIZIBWDW-UHFFFAOYSA-N	Cc1nn(c(C)c1c2oc(nn2)c3c(C)nn(c3C)c4ccccc4)c5ccccc5	BroadT	BRD-K12123091	BRD-K12123091-001-05-0	Maybridge	SEW 04236			Cc1nn(c(C)c1-c1nnc(o1)-c1c(C)nn(c1C)-c1ccccc1)-c1ccccc1	InChI=1S/C24H22N6O/c1-15-21(17(3)29(27-15)19-11-7-5-8-12-19)23-25-26-24(31-23)22-16(2)28-30(18(22)4)20-13-9-6-10-14-20/h5-14H,1-4H3	WOASUTLIZIBWDW-UHFFFAOYSA-N	410.185509384							117133
Dobutamine	LSM-1807	Dobutamine, Dobutrex, Compound 81929	36811	InChI=1S/C18H23NO3/c1-13(2-3-14-4-7-16(20)8-5-14)19-11-10-15-6-9-17(21)18(22)12-15/h4-9,12-13,19-22H,2-3,10-11H2,1H3	JRWZLRBJNMZMFE-UHFFFAOYSA-N	CC(CCc1ccc(O)cc1)NCCc2ccc(O)c(O)c2	BroadT	BRD-A78322124	BRD-A78322124-003-09-0	Prestwick Chemical Inc.	Prestw-352		Cl	CC(CCc1ccc(O)cc1)NCCc1ccc(O)c(O)c1.Cl	InChI=1S/C18H23NO3.ClH/c1-13(2-3-14-4-7-16(20)8-5-14)19-11-10-15-6-9-17(21)18(22)12-15;/h4-9,12-13,19-22H,2-3,10-11H2,1H3;1H	BQKADKWNRWCIJL-UHFFFAOYSA-N	301.167793606							4670, 4670
1-Methyl-4-prop-2-enoxypyrimidin-2-one	LSM-28583	SID26664696, BRD-K47922967	259161	InChI=1S/C8H10N2O2/c1-3-6-12-7-4-5-10(2)8(11)9-7/h3-5H,1,6H2,2H3	MAASMNPMEJWKDV-UHFFFAOYSA-N	CN1C=CC(=NC1=O)OCC=C	BroadT	BRD-K47922967	BRD-K47922967-001-06-3	National Cancer Institute Chemotherapeutic Agents Repository	88814			Cn1ccc(OCC=C)nc1=O	InChI=1S/C8H10N2O2/c1-3-6-12-7-4-5-10(2)8(11)9-7/h3-5H,1,6H2,2H3	MAASMNPMEJWKDV-UHFFFAOYSA-N	166.07422758							117134
1-(2-Fluorophenyl)-4-[(6-nitro-1,3-benzodioxol-5-yl)methyl]piperazine	LSM-28584	SID47198355, BRD-K61597089	1069651	InChI=1S/C18H18FN3O4/c19-14-3-1-2-4-15(14)21-7-5-20(6-8-21)11-13-9-17-18(26-12-25-17)10-16(13)22(23)24/h1-4,9-10H,5-8,11-12H2	NWLSYTXOZRHQNV-UHFFFAOYSA-N	[O-][N+](=O)c1cc2OCOc2cc1CN3CCN(CC3)c4ccccc4F	BroadT	BRD-K61597089	BRD-K61597089-001-05-9	ChemBridge Corporation	5268269			[O-][N+](=O)c1cc2OCOc2cc1CN1CCN(CC1)c1ccccc1F	InChI=1S/C18H18FN3O4/c19-14-3-1-2-4-15(14)21-7-5-20(6-8-21)11-13-9-17-18(26-12-25-17)10-16(13)22(23)24/h1-4,9-10H,5-8,11-12H2	NWLSYTXOZRHQNV-UHFFFAOYSA-N	359.128134286							117135
SMR000200566	LSM-28585	SID17413128, SID87338883, BRD-K17547979	1254616	InChI=1S/C19H19ClN4O5S/c1-28-16-6-5-12(11-15(16)24(26)27)18(25)22-19(30)21-14-4-2-3-13(20)17(14)23-7-9-29-10-8-23/h2-6,11H,7-10H2,1H3,(H2,21,22,25,30)	PWVCXEQGHKHDHR-UHFFFAOYSA-N	COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc2cccc(Cl)c2N3CCOCC3	BroadT	BRD-K17547979	BRD-K17547979-001-05-2	ChemBridge Corporation	7912849			COc1ccc(cc1[N+]([O-])=O)C(=O)NC(=S)Nc1cccc(Cl)c1N1CCOCC1	InChI=1S/C19H19ClN4O5S/c1-28-16-6-5-12(11-15(16)24(26)27)18(25)22-19(30)21-14-4-2-3-13(20)17(14)23-7-9-29-10-8-23/h2-6,11H,7-10H2,1H3,(H2,21,22,25,30)	PWVCXEQGHKHDHR-UHFFFAOYSA-N	450.076468148							117136
MLS000042516	LSM-28586	SID864791, BRD-K33086245	666040	InChI=1S/C8H10N4O/c1-12(2)6-4-3-5-8(7(6)9)11-13-10-5/h3-4H,9H2,1-2H3	ZZSBFYCJHLWUNQ-UHFFFAOYSA-N	CN(C)c1ccc2nonc2c1N	BroadT	BRD-K33086245	BRD-K33086245-001-05-9	InterBioScreen Ltd.	STOCK5S-31227			CN(C)c1ccc2nonc2c1N	InChI=1S/C8H10N4O/c1-12(2)6-4-3-5-8(7(6)9)11-13-10-5/h3-4H,9H2,1-2H3	ZZSBFYCJHLWUNQ-UHFFFAOYSA-N	178.08546098							117137
SMR000097084	LSM-28587	SID7968968, BRD-A06408992	5309698	InChI=1S/C22H34N4O2/c1-18-4-6-19(7-5-18)8-11-26-17-20(16-21(26)27)22(28)23-9-3-10-25-14-12-24(2)13-15-25/h4-7,20H,3,8-17H2,1-2H3,(H,23,28)	CIDMARPQRXSPAU-UHFFFAOYSA-N	CN1CCN(CCCNC(=O)C2CN(CCc3ccc(C)cc3)C(=O)C2)CC1	BroadT	BRD-A06408992	BRD-A06408992-001-04-8	ChemDiv Inc.	K786-8785			CN1CCN(CCCNC(=O)C2CN(CCc3ccc(C)cc3)C(=O)C2)CC1	InChI=1S/C22H34N4O2/c1-18-4-6-19(7-5-18)8-11-26-17-20(16-21(26)27)22(28)23-9-3-10-25-14-12-24(2)13-15-25/h4-7,20H,3,8-17H2,1-2H3,(H,23,28)	CIDMARPQRXSPAU-UHFFFAOYSA-N	386.268176368							117138
Adamantanyl 4-(2-fluorophenyl)piperazinyl ketone	LSM-28588	SID4262941, BRD-K21390826	2930996	InChI=1S/C21H27FN2O/c22-18-3-1-2-4-19(18)23-5-7-24(8-6-23)20(25)21-12-15-9-16(13-21)11-17(10-15)14-21/h1-4,15-17H,5-14H2	YLDHXUJVRLNQAE-UHFFFAOYSA-N	Fc1ccccc1N2CCN(CC2)C(=O)C34CC5CC(CC(C5)C3)C4	BroadT	BRD-K21390826	BRD-K21390826-001-06-4	ChemBridge Corporation	7228224			Fc1ccccc1N1CCN(CC1)C(=O)C12CC3CC(CC(C3)C1)C2	InChI=1S/C21H27FN2O/c22-18-3-1-2-4-19(18)23-5-7-24(8-6-23)20(25)21-12-15-9-16(13-21)11-17(10-15)14-21/h1-4,15-17H,5-14H2	YLDHXUJVRLNQAE-UHFFFAOYSA-N	342.210741704							117139
AC1MB2P4	LSM-28589	BRD-K10080449	2695584	InChI=1S/C17H16N2O4/c1-12-3-2-4-14(7-12)19-17(20)10-23-18-9-13-5-6-15-16(8-13)22-11-21-15/h2-9H,10-11H2,1H3,(H,19,20)	YIWNUCNIUSQNDB-UHFFFAOYSA-N	Cc1cccc(NC(=O)CON=Cc2ccc3OCOc3c2)c1	BroadT	BRD-K10080449	BRD-K10080449-001-06-1	Enamine Ltd.	ZU-4898581			Cc1cccc(NC(=O)CON=Cc2ccc3OCOc3c2)c1	InChI=1S/C17H16N2O4/c1-12-3-2-4-14(7-12)19-17(20)10-23-18-9-13-5-6-15-16(8-13)22-11-21-15/h2-9H,10-11H2,1H3,(H,19,20)	YIWNUCNIUSQNDB-UHFFFAOYSA-N	312.111007012							117140
T5229954	LSM-28590	SID22401714, BRD-K16201880	2097079	InChI=1S/C20H23NO7/c1-6-27-19(23)17-12(3)21-11(2)16(17)13(22)10-28-20(24)18-14(25-4)8-7-9-15(18)26-5/h7-9,21H,6,10H2,1-5H3	HNAIESRUZRPIHU-UHFFFAOYSA-N	CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COC(=O)c2c(OC)cccc2OC	BroadT	BRD-K16201880	BRD-K16201880-001-05-5	Enamine Ltd.	T5229954			CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COC(=O)c1c(OC)cccc1OC	InChI=1S/C20H23NO7/c1-6-27-19(23)17-12(3)21-11(2)16(17)13(22)10-28-20(24)18-14(25-4)8-7-9-15(18)26-5/h7-9,21H,6,10H2,1-5H3	HNAIESRUZRPIHU-UHFFFAOYSA-N	389.147452086							117141
STK133352	LSM-28591	SID17433639, BRD-K09613432	3766420	InChI=1S/C18H18N4O4S/c1-3-16(23)21-18(27)20-13-9-7-12(8-10-13)19-17(24)14-5-4-6-15(11(14)2)22(25)26/h4-10H,3H2,1-2H3,(H,19,24)(H2,20,21,23,27)	KSBSEHKCZSRISC-UHFFFAOYSA-N	CCC(=O)NC(=S)Nc1ccc(NC(=O)c2cccc(c2C)[N+](=O)[O-])cc1	BroadT	BRD-K09613432	BRD-K09613432-001-06-1	ChemBridge Corporation	7400812			CCC(=O)NC(=S)Nc1ccc(NC(=O)c2cccc(c2C)[N+]([O-])=O)cc1	InChI=1S/C18H18N4O4S/c1-3-16(23)21-18(27)20-13-9-7-12(8-10-13)19-17(24)14-5-4-6-15(11(14)2)22(25)26/h4-10H,3H2,1-2H3,(H,19,24)(H2,20,21,23,27)	KSBSEHKCZSRISC-UHFFFAOYSA-N	386.104875786							117142
MLS000388920	LSM-28592	SID22408514, BRD-K40960290	4851382	InChI=1S/C16H14ClN5OS2/c1-10-4-2-5-11(8-10)19-15-21-22-16(25-15)24-9-13(23)20-12-6-3-7-18-14(12)17/h2-8H,9H2,1H3,(H,19,21)(H,20,23)	NSPSNBNOJHUNRE-UHFFFAOYSA-N	Cc1cccc(Nc2nnc(SCC(=O)Nc3cccnc3Cl)s2)c1	BroadT	BRD-K40960290	BRD-K40960290-001-05-0	Enamine Ltd.	ZT-1289277			Cc1cccc(Nc2nnc(SCC(=O)Nc3cccnc3Cl)s2)c1	InChI=1S/C16H14ClN5OS2/c1-10-4-2-5-11(8-10)19-15-21-22-16(25-15)24-9-13(23)20-12-6-3-7-18-14(12)17/h2-8H,9H2,1H3,(H,19,21)(H,20,23)	NSPSNBNOJHUNRE-UHFFFAOYSA-N	391.032829208							117143
MLS000113199	LSM-28593	SID7975749, BRD-K48612418	2581382	InChI=1S/C17H25NO/c1-2-9-16-10-3-4-11-17(16)19-15-8-7-14-18-12-5-6-13-18/h2-4,10-11H,1,5-9,12-15H2	XOSNMLBMTVINPR-UHFFFAOYSA-N	C=CCc1ccccc1OCCCCN2CCCC2	BroadT	BRD-K48612418	BRD-K48612418-001-05-6	ChemBridge Corporation	7018960			C=CCc1ccccc1OCCCCN1CCCC1	InChI=1S/C17H25NO/c1-2-9-16-10-3-4-11-17(16)19-15-8-7-14-18-12-5-6-13-18/h2-4,10-11H,1,5-9,12-15H2	XOSNMLBMTVINPR-UHFFFAOYSA-N	259.19361443							117144
SMR000113524	LSM-28594	SID14727523, BRD-K04719059	9549671	InChI=1S/C21H25BrN4O3S/c1-26-12-18(22)19(24-26)20(27)23-16-2-4-17(5-3-16)30(28,29)25-21-9-13-6-14(10-21)8-15(7-13)11-21/h2-5,12-15,25H,6-11H2,1H3,(H,23,27)	ZEDDYNSGMOKNOV-UHFFFAOYSA-N	Cn1cc(Br)c(n1)C(=O)Nc2ccc(cc2)S(=O)(=O)NC34CC5CC(CC(C5)C3)C4	BroadT	BRD-K04719059	BRD-K04719059-001-04-8	Specs	AK-968/15360078			Cn1cc(Br)c(n1)C(=O)Nc1ccc(cc1)S(=O)(=O)NC12CC3CC(CC(C3)C1)C2	InChI=1S/C21H25BrN4O3S/c1-26-12-18(22)19(24-26)20(27)23-16-2-4-17(5-3-16)30(28,29)25-21-9-13-6-14(10-21)8-15(7-13)11-21/h2-5,12-15,25H,6-11H2,1H3,(H,23,27)	ZEDDYNSGMOKNOV-UHFFFAOYSA-N	492.08307399							117145
AC1MHCWB	LSM-28595	SID3717459, BRD-K97864903	3000008	InChI=1S/C18H17NO4/c20-17(12-22-18(21)13-6-7-13)19-14-8-10-16(11-9-14)23-15-4-2-1-3-5-15/h1-5,8-11,13H,6-7,12H2,(H,19,20)	PAQOYLONVIDZJD-UHFFFAOYSA-N	O=C(COC(=O)C1CC1)Nc2ccc(Oc3ccccc3)cc2	BroadT	BRD-K97864903	BRD-K97864903-001-06-3	Enamine Ltd.	T0512-0450			O=C(COC(=O)C1CC1)Nc1ccc(Oc2ccccc2)cc1	InChI=1S/C18H17NO4/c20-17(12-22-18(21)13-6-7-13)19-14-8-10-16(11-9-14)23-15-4-2-1-3-5-15/h1-5,8-11,13H,6-7,12H2,(H,19,20)	PAQOYLONVIDZJD-UHFFFAOYSA-N	311.115758034							117146
T0520-3987	LSM-28596	SID24834557, BRD-K31960711	3904314	InChI=1S/C22H23ClN2O6/c1-13(2)24(14(3)4)20(26)12-31-22(28)17-8-6-5-7-16(17)21(27)15-9-10-18(23)19(11-15)25(29)30/h5-11,13-14H,12H2,1-4H3	SVAKXJZYTKDMNY-UHFFFAOYSA-N	CC(C)N(C(C)C)C(=O)COC(=O)c1ccccc1C(=O)c2ccc(Cl)c(c2)[N+](=O)[O-]	BroadT	BRD-K31960711	BRD-K31960711-001-06-0	Enamine Ltd.	T0520-3987			CC(C)N(C(C)C)C(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c(c1)[N+]([O-])=O	InChI=1S/C22H23ClN2O6/c1-13(2)24(14(3)4)20(26)12-31-22(28)17-8-6-5-7-16(17)21(27)15-9-10-18(23)19(11-15)25(29)30/h5-11,13-14H,12H2,1-4H3	SVAKXJZYTKDMNY-UHFFFAOYSA-N	446.124464186							117147
AC1O9BK4	LSM-28597	BRD-K54538194	6754229	InChI=1S/C18H15N3O2S/c1-23-15-8-6-12(7-9-15)17(22)21-19-11-14-10-13-4-2-3-5-16(13)20-18(14)24/h2-11H,1H3,(H,20,24)(H,21,22)	OTCHKWIOBAZAOG-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NN=Cc2cc3ccccc3nc2S	BroadT	BRD-K54538194	BRD-K54538194-001-05-4	Specs	AE-848/34780016			COc1ccc(cc1)C(=O)NN=Cc1cc2ccccc2nc1S	InChI=1S/C18H15N3O2S/c1-23-15-8-6-12(7-9-15)17(22)21-19-11-14-10-13-4-2-3-5-16(13)20-18(14)24/h2-11H,1H3,(H,20,24)(H,21,22)	OTCHKWIOBAZAOG-UHFFFAOYSA-N	337.08849744							
AC1LEI82	LSM-28598	BRD-K68208170	686601	InChI=1S/C11H8BrN3OS/c12-10-5-4-8(17-10)7-14-15-11(16)9-3-1-2-6-13-9/h1-7H,(H,15,16)	GLYFDHRNAYDSSU-UHFFFAOYSA-N	Brc1ccc(C=NNC(=O)c2ccccn2)s1	BroadT	BRD-K68208170	BRD-K68208170-001-05-6	InterBioScreen Ltd.	STOCK3S-65655			Brc1ccc(C=NNC(=O)c2ccccn2)s1	InChI=1S/C11H8BrN3OS/c12-10-5-4-8(17-10)7-14-15-11(16)9-3-1-2-6-13-9/h1-7H,(H,15,16)	GLYFDHRNAYDSSU-UHFFFAOYSA-N	308.957145196							117149
MLS001203424	LSM-28599	SID47203658, BRD-K55873363	702724	InChI=1S/C16H15BrN4/c1-21(2)13-6-4-12(5-7-13)20-16-14-9-11(17)3-8-15(14)18-10-19-16/h3-10H,1-2H3,(H,18,19,20)	YJXQXNMNLWGBKZ-UHFFFAOYSA-N	CN(C)c1ccc(Nc2ncnc3ccc(Br)cc23)cc1	BroadT	BRD-K55873363	BRD-K55873363-001-06-7	Asinex Ltd.	BAS 03754871			CN(C)c1ccc(Nc2ncnc3ccc(Br)cc23)cc1	InChI=1S/C16H15BrN4/c1-21(2)13-6-4-12(5-7-13)20-16-14-9-11(17)3-8-15(14)18-10-19-16/h3-10H,1-2H3,(H,18,19,20)	YJXQXNMNLWGBKZ-UHFFFAOYSA-N	342.04800912							117150
F0153-0047	LSM-28600	SID7969886, BRD-A79149747	2863583	InChI=1S/C17H21ClN2O3/c1-10(2)9-23-16(21)14-11(3)20(4)17(22)19-15(14)12-7-5-6-8-13(12)18/h5-8,10,15H,9H2,1-4H3,(H,19,22)	WCWVXPGDIKVTPC-UHFFFAOYSA-N	CC(C)COC(=O)C1=C(C)N(C)C(=O)NC1c2ccccc2Cl	BroadT	BRD-A79149747	BRD-A79149747-001-04-8	Life Chemicals Inc.	F0153-0047			CC(C)COC(=O)C1=C(C)N(C)C(=O)NC1c1ccccc1Cl	InChI=1S/C17H21ClN2O3/c1-10(2)9-23-16(21)14-11(3)20(4)17(22)19-15(14)12-7-5-6-8-13(12)18/h5-8,10,15H,9H2,1-4H3,(H,19,22)	WCWVXPGDIKVTPC-UHFFFAOYSA-N	336.124070262							117151
ST50636429	LSM-28601	SID4260865, BRD-K57224507	2237122	InChI=1S/C17H16N4O2/c1-10-7-11(2)21-16(18-10)9-15(20-21)17(23)19-14-6-4-5-13(8-14)12(3)22/h4-9H,1-3H3,(H,19,23)	VCUDGAYSKNHUEP-UHFFFAOYSA-N	CC(=O)c1cccc(NC(=O)c2cc3nc(C)cc(C)n3n2)c1	BroadT	BRD-K57224507	BRD-K57224507-001-05-0	ChemBridge Corporation	7978898			CC(=O)c1cccc(NC(=O)c2cc3nc(C)cc(C)n3n2)c1	InChI=1S/C17H16N4O2/c1-10-7-11(2)21-16(18-10)9-15(20-21)17(23)19-14-6-4-5-13(8-14)12(3)22/h4-9H,1-3H3,(H,19,23)	VCUDGAYSKNHUEP-UHFFFAOYSA-N	308.127325792							117152
SMR000119838	LSM-28602	SID14722097, SID85273098, BRD-A26761315	3116370	InChI=1S/C26H23ClN2O3S/c1-15(30)17-11-12-20-18(13-17)24-19(26(28-20)16-7-3-2-4-8-16)14-23(25(24)27)33-22-10-6-5-9-21(22)29(31)32/h2-13,19,23-26,28H,14H2,1H3	BGFCFSUMQMMXNS-UHFFFAOYSA-N	CC(=O)c1ccc2NC(C3CC(Sc4ccccc4[N+](=O)[O-])C(Cl)C3c2c1)c5ccccc5	BroadT	BRD-A26761315	BRD-A26761315-001-05-3	Asinex Ltd.	BAS 00714810			CC(=O)c1ccc2NC(C3CC(Sc4ccccc4[N+]([O-])=O)C(Cl)C3c2c1)c1ccccc1	InChI=1S/C26H23ClN2O3S/c1-15(30)17-11-12-20-18(13-17)24-19(26(28-20)16-7-3-2-4-8-16)14-23(25(24)27)33-22-10-6-5-9-21(22)29(31)32/h2-13,19,23-26,28H,14H2,1H3	BGFCFSUMQMMXNS-UHFFFAOYSA-N	478.111791016							117153
AG-690/15429881	LSM-28603	SID17409138, BRD-K41441748	3143405	InChI=1S/C17H17N3O5S/c1-10-8-12(20(22)23)5-6-13(10)18-17(26)19-16(21)11-4-7-14(24-2)15(9-11)25-3/h4-9H,1-3H3,(H2,18,19,21,26)	XUSZBFUXDMYUOG-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)NC(=S)Nc2ccc(cc2C)[N+](=O)[O-]	BroadT	BRD-K41441748	BRD-K41441748-001-05-8	Asinex Ltd.	BAS 02818585			COc1ccc(cc1OC)C(=O)NC(=S)Nc1ccc(cc1C)[N+]([O-])=O	InChI=1S/C17H17N3O5S/c1-10-8-12(20(22)23)5-6-13(10)18-17(26)19-16(21)11-4-7-14(24-2)15(9-11)25-3/h4-9H,1-3H3,(H2,18,19,21,26)	XUSZBFUXDMYUOG-UHFFFAOYSA-N	375.088891364							117154
SMR000063978	LSM-28604	SID3716431, BRD-K43145155	2078656	InChI=1S/C21H18O7/c1-12-15-10-14(24-2)4-6-17(15)28-20(12)21(23)27-11-16(22)13-3-5-18-19(9-13)26-8-7-25-18/h3-6,9-10H,7-8,11H2,1-2H3	FNAIHHDARUKRLP-UHFFFAOYSA-N	COc1ccc2oc(C(=O)OCC(=O)c3ccc4OCCOc4c3)c(C)c2c1	BroadT	BRD-K43145155	BRD-K43145155-001-05-9	Enamine Ltd.	T5256417			COc1ccc2oc(C(=O)OCC(=O)c3ccc4OCCOc4c3)c(C)c2c1	InChI=1S/C21H18O7/c1-12-15-10-14(24-2)4-6-17(15)28-20(12)21(23)27-11-16(22)13-3-5-18-19(9-13)26-8-7-25-18/h3-6,9-10H,7-8,11H2,1-2H3	FNAIHHDARUKRLP-UHFFFAOYSA-N	382.105252916							117155
N-(3-Chloropyridin-2-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide	LSM-15431	BRD-K62423938	938310	InChI=1S/C14H11ClN2O3/c15-10-2-1-5-16-13(10)17-14(18)9-3-4-11-12(8-9)20-7-6-19-11/h1-5,8H,6-7H2,(H,16,17,18)	XLPCOGBRASIGAR-UHFFFAOYSA-N	Clc1cccnc1NC(=O)c2ccc3OCCOc3c2	BroadT	BRD-K62423938	BRD-K62423938-003-05-6	Asinex Ltd.	BAS 03335163		Cl	Clc1cccnc1NC(=O)c1ccc2OCCOc2c1.Cl	InChI=1S/C14H11ClN2O3.ClH/c15-10-2-1-5-16-13(10)17-14(18)9-3-4-11-12(8-9)20-7-6-19-11;/h1-5,8H,6-7H2,(H,16,17,18);1H	SIRARWXUCRSIAL-UHFFFAOYSA-N	290.045819942							104073, 104073
ZINC02651433	LSM-28605	SID22406396, BRD-K25545161	2114703	InChI=1S/C19H17N3O5S2/c1-26-13-5-8-17(27-2)15(9-13)16-10-29-19(20-16)21-18(23)11-28-14-6-3-12(4-7-14)22(24)25/h3-10H,11H2,1-2H3,(H,20,21,23)	UIIUXXJFXUPLSK-UHFFFAOYSA-N	COc1ccc(OC)c(c1)c2csc(NC(=O)CSc3ccc(cc3)[N+](=O)[O-])n2	BroadT	BRD-K25545161	BRD-K25545161-001-05-4	Enamine Ltd.	T5272106			COc1ccc(OC)c(c1)-c1csc(NC(=O)CSc2ccc(cc2)[N+]([O-])=O)n1	InChI=1S/C19H17N3O5S2/c1-26-13-5-8-17(27-2)15(9-13)16-10-29-19(20-16)21-18(23)11-28-14-6-3-12(4-7-14)22(24)25/h3-10H,11H2,1-2H3,(H,20,21,23)	UIIUXXJFXUPLSK-UHFFFAOYSA-N	431.060962054							117156
AQ-776/42801481	LSM-28606	SID22413277, BRD-K11578911	852397	InChI=1S/C17H14F3N3O2/c1-22(2)16(24)25-13-6-3-11(4-7-13)14-10-23-9-12(17(18,19)20)5-8-15(23)21-14/h3-10H,1-2H3	PHLZGTFMDLJGLR-UHFFFAOYSA-N	CN(C)C(=O)Oc1ccc(cc1)c2cn3cc(ccc3n2)C(F)(F)F	BroadT	BRD-K11578911	BRD-K11578911-001-05-4	Specs	AQ-776/42801481			CN(C)C(=O)Oc1ccc(cc1)-c1cn2cc(ccc2n1)C(F)(F)F	InChI=1S/C17H14F3N3O2/c1-22(2)16(24)25-13-6-3-11(4-7-13)14-10-23-9-12(17(18,19)20)5-8-15(23)21-14/h3-10H,1-2H3	PHLZGTFMDLJGLR-UHFFFAOYSA-N	349.103811318							117157
AC1LR9GH	LSM-15231	BRD-K00867459	1364796	InChI=1S/C22H17ClN4O3/c23-18-6-2-1-5-16(18)13-25-19-7-3-4-8-20(19)26(22(25)24)14-21(28)15-9-11-17(12-10-15)27(29)30/h1-12,24H,13-14H2	UIVWGIHEWXLCLW-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)C(=O)CN2C(=N)N(Cc3ccccc3Cl)c4ccccc24	BroadT	BRD-K00867459	BRD-K00867459-004-05-6	ChemBridge Corporation	6036115		Br	[O-][N+](=O)c1ccc(cc1)C(=O)Cn1c2ccccc2n(Cc2ccccc2Cl)c1=N.Br	InChI=1S/C22H17ClN4O3.BrH/c23-18-6-2-1-5-16(18)13-25-19-7-3-4-8-20(19)26(22(25)24)14-21(28)15-9-11-17(12-10-15)27(29)30;/h1-12,24H,13-14H2;1H	PJHJOVBRVDVIFB-UHFFFAOYSA-N	420.098918154							103878, 103878
ZINC03210715	LSM-28607	SID22401154, BRD-K38687539	2330460	InChI=1S/C18H14ClN5OS2/c1-9-11-8-14(15(25)20-18-22-21-16(27-18)10-6-7-10)26-17(11)24(23-9)13-5-3-2-4-12(13)19/h2-5,8,10H,6-7H2,1H3,(H,20,22,25)	XBSBWWYKAUEBDH-UHFFFAOYSA-N	Cc1nn(c2ccccc2Cl)c3sc(cc13)C(=O)Nc4nnc(s4)C5CC5	BroadT	BRD-K38687539	BRD-K38687539-001-05-4	Enamine Ltd.	T0505-2513			Cc1nn(-c2ccccc2Cl)c2sc(cc12)C(=O)Nc1nnc(s1)C1CC1	InChI=1S/C18H14ClN5OS2/c1-9-11-8-14(15(25)20-18-22-21-16(27-18)10-6-7-10)26-17(11)24(23-9)13-5-3-2-4-12(13)19/h2-5,8,10H,6-7H2,1H3,(H,20,22,25)	XBSBWWYKAUEBDH-UHFFFAOYSA-N	415.032829208							117158
MLS000558491	LSM-15432	BRD-K29969234	4025230	InChI=1S/C22H19N5O/c1-2-7-16(8-3-1)21-25-19-17-9-4-5-10-18(17)28-20(19)22(26-21)24-11-6-13-27-14-12-23-15-27/h1-5,7-10,12,14-15H,6,11,13H2,(H,24,25,26)	ZXPRMDFCJHQDNF-UHFFFAOYSA-N	C(CNc1nc(nc2c1oc3ccccc23)c4ccccc4)Cn5ccnc5	BroadT	BRD-K29969234	BRD-K29969234-003-06-9	InterBioScreen Ltd.	STOCK4S-50961		Cl	C(CNc1nc(nc2c3ccccc3oc12)-c1ccccc1)Cn1ccnc1.Cl	InChI=1S/C22H19N5O.ClH/c1-2-7-16(8-3-1)21-25-19-17-9-4-5-10-18(17)28-20(19)22(26-21)24-11-6-13-27-14-12-23-15-27;/h1-5,7-10,12,14-15H,6,11,13H2,(H,24,25,26);1H	QYBNVXGVMFXIPK-UHFFFAOYSA-N	369.158960278							104074, 104074
MLS000691962	LSM-28608	BRD-K28552696	2767358	InChI=1S/C12H12N6S/c1-17(2)8-14-11-15-12-13-6-5-9(18(12)16-11)10-4-3-7-19-10/h3-8H,1-2H3	QUVBYDIHFHODIR-UHFFFAOYSA-N	CN(C)C=Nc1nc2nccc(c3cccs3)n2n1	BroadT	BRD-K28552696	BRD-K28552696-001-06-9	Key Organics Ltd.	11K-054			CN(C)C=Nc1nc2nccc(-c3cccs3)n2n1	InChI=1S/C12H12N6S/c1-17(2)8-14-11-15-12-13-6-5-9(18(12)16-11)10-4-3-7-19-10/h3-8H,1-2H3	QUVBYDIHFHODIR-UHFFFAOYSA-N	272.084415134							117159
3-(Isobutylthio)-1H-1,2,4-triazol-5-amine	LSM-28609	SID24802700, SID26513857, BRD-K75049653	822199	InChI=1S/C6H12N4S/c1-4(2)3-11-6-8-5(7)9-10-6/h4H,3H2,1-2H3,(H3,7,8,9,10)	QRRACGCDDYGSMN-UHFFFAOYSA-N	CC(C)CSc1n[nH]c(N)n1	BroadT	BRD-K75049653	BRD-K75049653-001-05-1	Asinex Ltd.	BAS 03711082			CC(C)CSc1n[nH]c(N)n1	InChI=1S/C6H12N4S/c1-4(2)3-11-6-8-5(7)9-10-6/h4H,3H2,1-2H3,(H3,7,8,9,10)	QRRACGCDDYGSMN-UHFFFAOYSA-N	172.078267114							117160
CHEMBL393826	LSM-28610	SID14739937, BRD-K75606577	1266440	InChI=1S/C18H13FN4OS/c19-12-5-1-2-6-13(12)21-17(24)9-23-16-8-4-3-7-14(16)22-18(23)15-10-25-11-20-15/h1-8,10-11H,9H2,(H,21,24)	KSOXYCXRFKLDEA-UHFFFAOYSA-N	Fc1ccccc1NC(=O)Cn2c(nc3ccccc23)c4cscn4	BroadT	BRD-K75606577	BRD-K75606577-001-06-9	ChemBridge Corporation	7937645			Fc1ccccc1NC(=O)Cn1c(nc2ccccc12)-c1cscn1	InChI=1S/C18H13FN4OS/c19-12-5-1-2-6-13(12)21-17(24)9-23-16-8-4-3-7-14(16)22-18(23)15-10-25-11-20-15/h1-8,10-11H,9H2,(H,21,24)	KSOXYCXRFKLDEA-UHFFFAOYSA-N	352.079409966							117161
BAS 00389977	LSM-28611	SID24806650, BRD-K53456213	820033	InChI=1S/C13H18N4O/c18-13(17-14-9-5-1-2-6-9)12-10-7-3-4-8-11(10)15-16-12/h1-8H2,(H,15,16)(H,17,18)	LYWBRJBDEPWFAP-UHFFFAOYSA-N	O=C(NN=C1CCCC1)c2[nH]nc3CCCCc23	BroadT	BRD-K53456213	BRD-K53456213-001-05-7	Asinex Ltd.	BAS 00389977			O=C(NN=C1CCCC1)c1[nH]nc2CCCCc12	InChI=1S/C13H18N4O/c18-13(17-14-9-5-1-2-6-9)12-10-7-3-4-8-11(10)15-16-12/h1-8H2,(H,15,16)(H,17,18)	LYWBRJBDEPWFAP-UHFFFAOYSA-N	246.148061236							117162
STK322925	LSM-28612	SID7974005, BRD-K51493793	868034	InChI=1S/C13H10FNOS/c14-11-6-4-10(5-7-11)12(16)9-17-13-3-1-2-8-15-13/h1-8H,9H2	UFEDGNOFTXHLIN-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)CSc2ccccn2	BroadT	BRD-K51493793	BRD-K51493793-001-05-0	ChemBridge Corporation	5686075			Fc1ccc(cc1)C(=O)CSc1ccccn1	InChI=1S/C13H10FNOS/c14-11-6-4-10(5-7-11)12(16)9-17-13-3-1-2-8-15-13/h1-8H,9H2	UFEDGNOFTXHLIN-UHFFFAOYSA-N	247.04671284							117163
ZINC00458948	LSM-28613	SID22416227, BRD-A25755902	2908341	InChI=1S/C15H19N3O3S/c1-2-12-5-3-4-10-17(12)15(22)16-14(19)11-6-8-13(9-7-11)18(20)21/h6-9,12H,2-5,10H2,1H3,(H,16,19,22)	FYIZGUYXUWGGRN-UHFFFAOYSA-N	CCC1CCCCN1C(=S)NC(=O)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-A25755902	BRD-A25755902-001-05-5	ChemBridge Corporation	6649691			CCC1CCCCN1C(=S)NC(=O)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C15H19N3O3S/c1-2-12-5-3-4-10-17(12)15(22)16-14(19)11-6-8-13(9-7-11)18(20)21/h6-9,12H,2-5,10H2,1H3,(H,16,19,22)	FYIZGUYXUWGGRN-UHFFFAOYSA-N	321.114712188							117164
BRN 1223645	LSM-28614	SID87544788, SID4263221, BRD-K32634726	891289	InChI=1S/C15H17N3O2S2/c1-10-2-4-11(5-3-10)18-13(16)12(22-15(18)21)14(19)17-6-8-20-9-7-17/h2-5H,6-9,16H2,1H3	DYGKDHWVWSAGOQ-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=S)SC(=C2N)C(=O)N3CCOCC3	BroadT	BRD-K32634726	BRD-K32634726-001-05-5	ChemBridge Corporation	7473870			Cc1ccc(cc1)-n1c(N)c(sc1=S)C(=O)N1CCOCC1	InChI=1S/C15H17N3O2S2/c1-10-2-4-11(5-3-10)18-13(16)12(22-15(18)21)14(19)17-6-8-20-9-7-17/h2-5H,6-9,16H2,1H3	DYGKDHWVWSAGOQ-UHFFFAOYSA-N	335.076218194							117165
MLS000554873	LSM-44286	SID14742060, BRD-K87656666	1549319	InChI=1S/C13H14N2O2/c1-3-17-13(16)12(10-14)5-4-11-6-8-15(2)9-7-11/h4-9H,3H2,1-2H3/b12-5-	AXXFEWVWZFNYQV-XGICHPGQSA-N	CCOC(=O)\C(=C/C=C1C=CN(C)C=C1)\C#N	BroadT	BRD-K87656666	BRD-K87656666-001-05-4	InterBioScreen Ltd.	STOCK2S-98546			CCOC(=O)C(\C#N)=C/C=C1C=CN(C)C=C1	InChI=1S/C13H14N2O2/c1-3-17-13(16)12(10-14)5-4-11-6-8-15(2)9-7-11/h4-9H,3H2,1-2H3/b12-5-	AXXFEWVWZFNYQV-XGICHPGQSA-N	230.105527708							
MLS000089444	LSM-28616	SID4246161, BRD-K23596629	3240540	InChI=1S/C19H15N3OS/c1-13-17(18(23)20-15-10-6-3-7-11-15)24-19-21-16(12-22(13)19)14-8-4-2-5-9-14/h2-12H,1H3,(H,20,23)	WDYZAOGZOXAMCD-UHFFFAOYSA-N	Cc1c(sc2nc(cn12)c3ccccc3)C(=O)Nc4ccccc4	BroadT	BRD-K23596629	BRD-K23596629-001-06-3	ChemDiv Inc.	C540-0064			Cc1c(sc2nc(cn12)-c1ccccc1)C(=O)Nc1ccccc1	InChI=1S/C19H15N3OS/c1-13-17(18(23)20-15-10-6-3-7-11-15)24-19-21-16(12-22(13)19)14-8-4-2-5-9-14/h2-12H,1H3,(H,20,23)	WDYZAOGZOXAMCD-UHFFFAOYSA-N	333.09358282							117167
T0511-9427	LSM-28617	SID24831894, BRD-K54694318	2370496	InChI=1S/C18H26N2O3/c1-20(2)16-11-9-14(10-12-16)18(22)23-13-17(21)19-15-7-5-3-4-6-8-15/h9-12,15H,3-8,13H2,1-2H3,(H,19,21)	VLJKAQPMZUVCPF-UHFFFAOYSA-N	CN(C)c1ccc(cc1)C(=O)OCC(=O)NC2CCCCCC2	BroadT	BRD-K54694318	BRD-K54694318-001-06-4	Enamine Ltd.	T0511-9427			CN(C)c1ccc(cc1)C(=O)OCC(=O)NC1CCCCCC1	InChI=1S/C18H26N2O3/c1-20(2)16-11-9-14(10-12-16)18(22)23-13-17(21)19-15-7-5-3-4-6-8-15/h9-12,15H,3-8,13H2,1-2H3,(H,19,21)	VLJKAQPMZUVCPF-UHFFFAOYSA-N	318.194342712							117168
SMR000006107	LSM-28618	SID50086306, SID845788, BRD-A00650952	648151	InChI=1S/C27H28FN5O3/c28-20-5-3-9-23(17-20)33(25(35)11-10-24(34)31-22-8-4-14-30-18-22)26(19-12-15-29-16-13-19)27(36)32-21-6-1-2-7-21/h3-5,8-9,12-18,21,26H,1-2,6-7,10-11H2,(H,31,34)(H,32,36)	ARZXORPLIISFEG-UHFFFAOYSA-N	Fc1cccc(c1)N(C(C(=O)NC2CCCC2)c3ccncc3)C(=O)CCC(=O)Nc4cccnc4	BroadT	BRD-A00650952	BRD-A00650952-001-05-6	Asinex Ltd.	ASN 06086199			Fc1cccc(c1)N(C(C(=O)NC1CCCC1)c1ccncc1)C(=O)CCC(=O)Nc1cccnc1	InChI=1S/C27H28FN5O3/c28-20-5-3-9-23(17-20)33(25(35)11-10-24(34)31-22-8-4-14-30-18-22)26(19-12-15-29-16-13-19)27(36)32-21-6-1-2-7-21/h3-5,8-9,12-18,21,26H,1-2,6-7,10-11H2,(H,31,34)(H,32,36)	ARZXORPLIISFEG-UHFFFAOYSA-N	489.217618006							117169
F1835-0245	LSM-28619	SID7971831, BRD-K22618462	5310565	InChI=1S/C16H16N6O2S/c23-15(21-6-8-24-9-7-21)11-25-14-4-3-13-18-19-16(22(13)20-14)12-2-1-5-17-10-12/h1-5,10H,6-9,11H2	GWCQIHVMZSGCGM-UHFFFAOYSA-N	O=C(CSc1ccc2nnc(c3cccnc3)n2n1)N4CCOCC4	BroadT	BRD-K22618462	BRD-K22618462-001-04-1	Life Chemicals Inc.	F1835-0245			O=C(CSc1ccc2nnc(-c3cccnc3)n2n1)N1CCOCC1	InChI=1S/C16H16N6O2S/c23-15(21-6-8-24-9-7-21)11-25-14-4-3-13-18-19-16(22(13)20-14)12-2-1-5-17-10-12/h1-5,10H,6-9,11H2	GWCQIHVMZSGCGM-UHFFFAOYSA-N	356.105544502							117170
AC1N9R4H	LSM-28620	SID24829556, BRD-K79590070	4415053	InChI=1S/C13H14BrN5O3S/c1-7(2)12-16-13(18-17-12)23-6-11(20)15-10-4-3-8(19(21)22)5-9(10)14/h3-5,7H,6H2,1-2H3,(H,15,20)(H,16,17,18)	XFTQRQAYSLSXPM-UHFFFAOYSA-N	CC(C)c1n[nH]c(SCC(=O)Nc2ccc(cc2Br)[N+](=O)[O-])n1	BroadT	BRD-K79590070	BRD-K79590070-001-05-5	Enamine Ltd.	T5219512			CC(C)c1n[nH]c(SCC(=O)Nc2ccc(cc2Br)[N+]([O-])=O)n1	InChI=1S/C13H14BrN5O3S/c1-7(2)12-16-13(18-17-12)23-6-11(20)15-10-4-3-8(19(21)22)5-9(10)14/h3-5,7H,6H2,1-2H3,(H,15,20)(H,16,17,18)	XFTQRQAYSLSXPM-UHFFFAOYSA-N	399.000072648							117171
ST057969	LSM-44287	SID22401460, BRD-K06797333	7326464	InChI=1S/C18H17N3O3S/c1-11-3-6-13(7-4-11)19-16(22)10-21-17(23)15(20-18(21)24)9-14-8-5-12(2)25-14/h3-9H,10H2,1-2H3,(H,19,22)(H,20,24)/b15-9+	PSZVWNUEDJXAMD-OQLLNIDSSA-N	Cc1ccc(NC(=O)CN2C(=O)N\C(=C\c3ccc(C)s3)\C2=O)cc1	BroadT	BRD-K06797333	BRD-K06797333-001-05-7	ChemDiv Inc.	4998-0468			Cc1ccc(\C=C2\NC(=O)N(CC(=O)Nc3ccc(C)cc3)C2=O)s1	InChI=1S/C18H17N3O3S/c1-11-3-6-13(7-4-11)19-16(22)10-21-17(23)15(20-18(21)24)9-14-8-5-12(2)25-14/h3-9H,10H2,1-2H3,(H,19,22)(H,20,24)/b15-9+	PSZVWNUEDJXAMD-OQLLNIDSSA-N	355.099062124							
MLS000777323	LSM-28622	BRD-M67056500	3848238	InChI=1S/C22H18N2O2S2/c23-13-16-19(18-11-6-12-27-18)15-9-4-5-10-17(15)24-21(16)28-20(22(25)26)14-7-2-1-3-8-14/h1-3,6-8,11-12,20H,4-5,9-10H2,(H,25,26)	JPYKGCKNTOGHKX-UHFFFAOYSA-N	OC(=O)C(Sc1nc2CCCCc2c(c3cccs3)c1C#N)c4ccccc4	BroadT	BRD-M67056500	BRD-M67056500-001-05-9	InterBioScreen Ltd.	STOCK2S-78554		CCO.OC(=O)C(Sc1nc2CCCCc2c(-c2cccs2)c1C#N)c1ccccc1	CCO.OC(=O)C(Sc1nc2CCCCc2c(-c2cccs2)c1C#N)c1ccccc1	InChI=1S/C22H18N2O2S2.C2H6O/c23-13-16-19(18-11-6-12-27-18)15-9-4-5-10-17(15)24-21(16)28-20(22(25)26)14-7-2-1-3-8-14;1-2-3/h1-3,6-8,11-12,20H,4-5,9-10H2,(H,25,26);3H,2H2,1H3	BIUSYXHBTDZTHR-UHFFFAOYSA-N	406.080969216							117173, 117173
AMBCB20303422	LSM-28623	SID24798855, BRD-A88896838	16190526	InChI=1S/C22H23N3O4S/c1-14-23-24-22(29-14)30-13-20(26)25-9-3-4-18(12-25)21(27)17-6-5-16-11-19(28-2)8-7-15(16)10-17/h5-8,10-11,18H,3-4,9,12-13H2,1-2H3	CFXRXINUUHOBNR-UHFFFAOYSA-N	COc1ccc2cc(ccc2c1)C(=O)C3CCCN(C3)C(=O)CSc4oc(C)nn4	BroadT	BRD-A88896838	BRD-A88896838-001-05-0	ChemBridge Corporation	20303422			COc1ccc2cc(ccc2c1)C(=O)C1CCCN(C1)C(=O)CSc1nnc(C)o1	InChI=1S/C22H23N3O4S/c1-14-23-24-22(29-14)30-13-20(26)25-9-3-4-18(12-25)21(27)17-6-5-16-11-19(28-2)8-7-15(16)10-17/h5-8,10-11,18H,3-4,9,12-13H2,1-2H3	CFXRXINUUHOBNR-UHFFFAOYSA-N	425.140926936							117174
ST045071	LSM-44288	SID7972667, BRD-A64476468	5291857	InChI=1S/C20H16N4O2/c1-12(10-14-8-5-9-25-14)16-15(11-21)19(22)26-20-17(16)18(23-24-20)13-6-3-2-4-7-13/h2-10,16H,22H2,1H3,(H,23,24)/b12-10+	ORRIBHZQKOAYQB-ZRDIBKRKSA-N	C\C(=C/c1occc1)\C2C(=C(N)Oc3[nH]nc(c4ccccc4)c23)C#N	BroadT	BRD-A64476468	BRD-A64476468-001-06-4	ChemBridge Corporation	6669701			C\C(=C/c1ccco1)C1c2c(OC(N)=C1C#N)[nH]nc2-c1ccccc1	InChI=1S/C20H16N4O2/c1-12(10-14-8-5-9-25-14)16-15(11-21)19(22)26-20-17(16)18(23-24-20)13-6-3-2-4-7-13/h2-10,16H,22H2,1H3,(H,23,24)/b12-10+	ORRIBHZQKOAYQB-ZRDIBKRKSA-N	344.127325792							
F1201-0156	LSM-28625	SID22403932, BRD-K07240145	1320859	InChI=1S/C13H10BrN3O3S/c14-10-6-5-9(20-10)12(19)17-13(21)16-8-4-2-1-3-7(8)11(15)18/h1-6H,(H2,15,18)(H2,16,17,19,21)	TUPOAJAVVZVLFC-UHFFFAOYSA-N	NC(=O)c1ccccc1NC(=S)NC(=O)c2oc(Br)cc2	BroadT	BRD-K07240145	BRD-K07240145-001-05-5	ChemBridge Corporation	7135626			NC(=O)c1ccccc1NC(=S)NC(=O)c1ccc(Br)o1	InChI=1S/C13H10BrN3O3S/c14-10-6-5-9(20-10)12(19)17-13(21)16-8-4-2-1-3-7(8)11(15)18/h1-6H,(H2,15,18)(H2,16,17,19,21)	TUPOAJAVVZVLFC-UHFFFAOYSA-N	366.9626245							117176
AC1NCN9N	LSM-28626	SID24810307, BRD-K10717366	4536418	InChI=1S/C20H26N4OS/c25-19-16-13-15(22-20(26)21-14-7-3-1-4-8-14)10-11-17(16)23-18-9-5-2-6-12-24(18)19/h10-11,13-14H,1-9,12H2,(H2,21,22,26)	YZLFGCFMGLVPFF-UHFFFAOYSA-N	O=C1N2CCCCCC2=Nc3ccc(NC(=S)NC4CCCCC4)cc13	BroadT	BRD-K10717366	BRD-K10717366-001-05-9	ChemDiv Inc.	C066-3410			O=c1n2CCCCCc2nc2ccc(NC(=S)NC3CCCCC3)cc12	InChI=1S/C20H26N4OS/c25-19-16-13-15(22-20(26)21-14-7-3-1-4-8-14)10-11-17(16)23-18-9-5-2-6-12-24(18)19/h10-11,13-14H,1-9,12H2,(H2,21,22,26)	YZLFGCFMGLVPFF-UHFFFAOYSA-N	370.182732182							117177
T5843125	LSM-28627	SID7970312, BRD-A03727794	4618463	InChI=1S/C18H27N5O5/c1-6-27-14(24)10-23-13(9-22-7-11(2)28-12(3)8-22)19-16-15(23)17(25)21(5)18(26)20(16)4/h11-12H,6-10H2,1-5H3	LZBHZRCIZJRQGZ-UHFFFAOYSA-N	CCOC(=O)Cn1c(CN2CC(C)OC(C)C2)nc3N(C)C(=O)N(C)C(=O)c13	BroadT	BRD-A03727794	BRD-A03727794-001-05-1	Life Chemicals Inc.	F0634-0464			CCOC(=O)Cn1c(CN2CC(C)OC(C)C2)nc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C18H27N5O5/c1-6-27-14(24)10-23-13(9-22-7-11(2)28-12(3)8-22)19-16-15(23)17(25)21(5)18(26)20(16)4/h11-12H,6-10H2,1-5H3	LZBHZRCIZJRQGZ-UHFFFAOYSA-N	393.201219014							117178
MLS001035476	LSM-28628	SID49816475, BRD-K07795059	2235526	InChI=1S/C16H12N2O3S/c19-13-7-2-4-10-11(13)5-1-6-12(10)17-16(22)18-15(20)14-8-3-9-21-14/h1-9,19H,(H2,17,18,20,22)	LUBYNXKDESUSRO-UHFFFAOYSA-N	Oc1cccc2c(NC(=S)NC(=O)c3occc3)cccc12	BroadT	BRD-K07795059	BRD-K07795059-001-06-0	ChemBridge Corporation	7975549			Oc1cccc2c(NC(=S)NC(=O)c3ccco3)cccc12	InChI=1S/C16H12N2O3S/c19-13-7-2-4-10-11(13)5-1-6-12(10)17-16(22)18-15(20)14-8-3-9-21-14/h1-9,19H,(H2,17,18,20,22)	LUBYNXKDESUSRO-UHFFFAOYSA-N	312.056862954							117179
MLS000834531	LSM-28629	SID24779714, BRD-K18354024	16187129	InChI=1S/C29H33F3N2O6/c30-29(31,32)23-6-4-21(5-7-23)22-16-26(40-27(17-22)37-14-2-1-13-35)28(36)34-11-9-33(10-12-34)18-20-3-8-24-25(15-20)39-19-38-24/h3-8,15-16,22,27,35H,1-2,9-14,17-19H2/t22-,27+/m0/s1	CGWJDORVWUJCPV-WXVAWEFUSA-N	OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)c5ccc(cc5)C(F)(F)F	BroadT	BRD-K18354024	BRD-K18354024-001-07-3	Harvard University	(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)((2R,4R)-2-(4-hydroxybutoxy)-4-(4-(trifluoromethyl)phenyl)-3,4-dihydro-2H-pyran-6-yl)methanone DHPC11_001149			OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N1CCN(Cc2ccc3OCOc3c2)CC1)c1ccc(cc1)C(F)(F)F	InChI=1S/C29H33F3N2O6/c30-29(31,32)23-6-4-21(5-7-23)22-16-26(40-27(17-22)37-14-2-1-13-35)28(36)34-11-9-33(10-12-34)18-20-3-8-24-25(15-20)39-19-38-24/h3-8,15-16,22,27,35H,1-2,9-14,17-19H2/t22-,27+/m0/s1	CGWJDORVWUJCPV-WXVAWEFUSA-N	562.229071396							117180
T5262913	LSM-28630	SID3715787, SID87335902, BRD-A96852979	2999353	InChI=1S/C17H22Cl2N4O2S/c1-4-14(23(2)3)16-21-22-17(25-16)26-10-15(24)20-8-7-11-5-6-12(18)9-13(11)19/h5-6,9,14H,4,7-8,10H2,1-3H3,(H,20,24)	AVLNBITYSNSDNT-UHFFFAOYSA-N	CCC(N(C)C)c1oc(SCC(=O)NCCc2ccc(Cl)cc2Cl)nn1	BroadT	BRD-A96852979	BRD-A96852979-001-05-2	Enamine Ltd.	T5262913			CCC(N(C)C)c1nnc(SCC(=O)NCCc2ccc(Cl)cc2Cl)o1	InChI=1S/C17H22Cl2N4O2S/c1-4-14(23(2)3)16-21-22-17(25-16)26-10-15(24)20-8-7-11-5-6-12(18)9-13(11)19/h5-6,9,14H,4,7-8,10H2,1-3H3,(H,20,24)	AVLNBITYSNSDNT-UHFFFAOYSA-N	416.084052094							117181
1-(4-Methyl-1,2,5-oxadiazol-3-yl)-3-pyridin-3-ylurea	LSM-28631	SID4247422, BRD-K17175094	676595	InChI=1S/C9H9N5O2/c1-6-8(14-16-13-6)12-9(15)11-7-3-2-4-10-5-7/h2-5H,1H3,(H2,11,12,14,15)	NXRCDGIGKSHKAP-UHFFFAOYSA-N	Cc1nonc1NC(=O)Nc2cccnc2	BroadT	BRD-K17175094	BRD-K17175094-001-06-0	ChemDiv Inc.	1956-0005			Cc1nonc1NC(=O)Nc1cccnc1	InChI=1S/C9H9N5O2/c1-6-8(14-16-13-6)12-9(15)11-7-3-2-4-10-5-7/h2-5H,1H3,(H2,11,12,14,15)	NXRCDGIGKSHKAP-UHFFFAOYSA-N	219.075624578							117182
N-(1,3-Benzodioxol-5-yl)-4-methylphthalazin-1-amine	LSM-28632	SID7973095, BRD-K47367431	1417592	InChI=1S/C16H13N3O2/c1-10-12-4-2-3-5-13(12)16(19-18-10)17-11-6-7-14-15(8-11)21-9-20-14/h2-8H,9H2,1H3,(H,17,19)	IBDKKLFMDGNLGZ-UHFFFAOYSA-N	Cc1nnc(Nc2ccc3OCOc3c2)c4ccccc14	BroadT	BRD-K47367431	BRD-K47367431-001-06-9	ChemBridge Corporation	7186138			Cc1nnc(Nc2ccc3OCOc3c2)c2ccccc12	InChI=1S/C16H13N3O2/c1-10-12-4-2-3-5-13(12)16(19-18-10)17-11-6-7-14-15(8-11)21-9-20-14/h2-8H,9H2,1H3,(H,17,19)	IBDKKLFMDGNLGZ-UHFFFAOYSA-N	279.100776686							117183
ZINC04557463	LSM-28633	SID24822423, BRD-K49646690	2916743	InChI=1S/C15H10N2O4/c16-13-11-8-10(17(19)20)6-7-12(11)21-15(13)14(18)9-4-2-1-3-5-9/h1-8H,16H2	WFHQUIDYYGWVLY-UHFFFAOYSA-N	Nc1c(oc2ccc(cc12)[N+](=O)[O-])C(=O)c3ccccc3	BroadT	BRD-K49646690	BRD-K49646690-001-05-2	Asinex Ltd.	BAS 03276967			Nc1c(oc2ccc(cc12)[N+]([O-])=O)C(=O)c1ccccc1	InChI=1S/C15H10N2O4/c16-13-11-8-10(17(19)20)6-7-12(11)21-15(13)14(18)9-4-2-1-3-5-9/h1-8H,16H2	WFHQUIDYYGWVLY-UHFFFAOYSA-N	282.06405682							117184
MLS000032399	LSM-28634	SID850334, BRD-K28467895	652848	InChI=1S/C23H20N2O4/c1-28-19-9-10-21-17(13-19)12-18(22(26)24-21)14-25(15-20-8-5-11-29-20)23(27)16-6-3-2-4-7-16/h2-13H,14-15H2,1H3,(H,24,26)	RVTXRLRQTQOICG-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(Cc3occc3)C(=O)c4ccccc4)cc2c1	BroadT	BRD-K28467895	BRD-K28467895-001-05-1	Asinex Ltd.	ASN 05107610			COc1ccc2nc(O)c(CN(Cc3ccco3)C(=O)c3ccccc3)cc2c1	InChI=1S/C23H20N2O4/c1-28-19-9-10-21-17(13-19)12-18(22(26)24-21)14-25(15-20-8-5-11-29-20)23(27)16-6-3-2-4-7-16/h2-13H,14-15H2,1H3,(H,24,26)	RVTXRLRQTQOICG-UHFFFAOYSA-N	388.14230714							117185
MLS000120231	LSM-28635	BRD-A57584179	5309219	InChI=1S/C18H18N2O4S/c1-20-15-9-13(5-8-16(15)25(23)11-17(20)21)18(22)19-10-12-3-6-14(24-2)7-4-12/h3-9H,10-11H2,1-2H3,(H,19,22)	AQWOKNZRXXHZFI-UHFFFAOYSA-N	COc1ccc(CNC(=O)c2ccc3c(c2)N(C)C(=O)CS3=O)cc1	BroadT	BRD-A57584179	BRD-A57584179-001-04-9	ChemDiv Inc.	K788-8222			COc1ccc(CNC(=O)c2ccc3c(c2)N(C)C(=O)CS3=O)cc1	InChI=1S/C18H18N2O4S/c1-20-15-9-13(5-8-16(15)25(23)11-17(20)21)18(22)19-10-12-3-6-14(24-2)7-4-12/h3-9H,10-11H2,1-2H3,(H,19,22)	AQWOKNZRXXHZFI-UHFFFAOYSA-N	358.098727766							117186
MLS000517964	LSM-28636	SID24707810, SID29215735, BRD-K54710378	16060019	InChI=1S/C26H21BrClN3O4/c1-34-21-8-3-2-7-20(21)22-23(16-5-4-6-18(28)15-16)29-31(19-11-9-17(27)10-12-19)24(22)25(32)30-13-14-35-26(30)33/h2-12,15,22,24H,13-14H2,1H3/t22-,24-/m1/s1	HUGQWZZOCRYXFK-ISKFKSNPSA-N	COc1ccccc1[C@H]2[C@@H](N(N=C2c3cccc(Cl)c3)c4ccc(Br)cc4)C(=O)N5CCOC5=O	BroadT	BRD-K54710378	BRD-K54710378-001-06-5	University of Kansas CMLD	KUC100728N			COc1ccccc1[C@H]1[C@@H](N(N=C1c1cccc(Cl)c1)c1ccc(Br)cc1)C(=O)N1CCOC1=O	InChI=1S/C26H21BrClN3O4/c1-34-21-8-3-2-7-20(21)22-23(16-5-4-6-18(28)15-16)29-31(19-11-9-17(27)10-12-19)24(22)25(32)30-13-14-35-26(30)33/h2-12,15,22,24H,13-14H2,1H3/t22-,24-/m1/s1	HUGQWZZOCRYXFK-ISKFKSNPSA-N	553.040396492							117187
3,3-Dimethyl-1-{[9-(methylthio)-5,6-dihydrothieno[3,4-h]quinazolin-2-yl]thio}butan-2-one	LSM-28637	SID26728578, BRD-K68237297	2820916	InChI=1S/C17H20N2OS3/c1-17(2,3)12(20)9-23-16-18-7-10-5-6-11-8-22-15(21-4)13(11)14(10)19-16/h7-8H,5-6,9H2,1-4H3	ZVUPMFXOKKTVQT-UHFFFAOYSA-N	CSc1scc2CCc3cnc(SCC(=O)C(C)(C)C)nc3c12	BroadT	BRD-K68237297	BRD-K68237297-001-06-1	Maybridge	KM 05111			CSc1scc2CCc3cnc(SCC(=O)C(C)(C)C)nc3-c12	InChI=1S/C17H20N2OS3/c1-17(2,3)12(20)9-23-16-18-7-10-5-6-11-8-22-15(21-4)13(11)14(10)19-16/h7-8H,5-6,9H2,1-4H3	ZVUPMFXOKKTVQT-UHFFFAOYSA-N	364.07377535							117188
2-(2-Furyl)-1,3-thiazolidine-4-carboxylic acid	LSM-28638	SID24788014, BRD-A31192417	2827740	InChI=1S/C8H9NO3S/c10-8(11)5-4-13-7(9-5)6-2-1-3-12-6/h1-3,5,7,9H,4H2,(H,10,11)	VYGBVPOHBURDGB-UHFFFAOYSA-N	OC(=O)C1CSC(N1)c2occc2	BroadT	BRD-A31192417	BRD-A31192417-001-11-9	Asinex Ltd.	BAS 00126169			OC(=O)C1CSC(N1)c1ccco1	InChI=1S/C8H9NO3S/c10-8(11)5-4-13-7(9-5)6-2-1-3-12-6/h1-3,5,7,9H,4H2,(H,10,11)	VYGBVPOHBURDGB-UHFFFAOYSA-N	199.030313848							117189
AC1MFSRW	LSM-28639	SID104219444, SID24795209, BRD-K42937630	2975165	InChI=1S/C22H18N2O4/c1-27-19-10-5-3-8-17(19)23-21(25)14-24-13-16(15-7-2-4-9-18(15)24)22(26)20-11-6-12-28-20/h2-13H,14H2,1H3,(H,23,25)	XFFILBVOIUUCMG-UHFFFAOYSA-N	COc1ccccc1NC(=O)Cn2cc(C(=O)c3occc3)c4ccccc24	BroadT	BRD-K42937630	BRD-K42937630-001-06-3	ChemBridge Corporation	7962079			COc1ccccc1NC(=O)Cn1cc(C(=O)c2ccco2)c2ccccc12	InChI=1S/C22H18N2O4/c1-27-19-10-5-3-8-17(19)23-21(25)14-24-13-16(15-7-2-4-9-18(15)24)22(26)20-11-6-12-28-20/h2-13H,14H2,1H3,(H,23,25)	XFFILBVOIUUCMG-UHFFFAOYSA-N	374.126657076							117190
MLS000871748	LSM-28640	SID24783324, BRD-K56967203	16188120	InChI=1S/C25H25FN4O2/c1-15-20(13-14-23(31)28-21-7-5-6-8-22(21)32-4)17(3)30-25(27-15)24(16(2)29-30)18-9-11-19(26)12-10-18/h5-12H,13-14H2,1-4H3,(H,28,31)	OGJGONTTYUENKH-UHFFFAOYSA-N	COc1ccccc1NC(=O)CCc2c(C)nc3c(c(C)nn3c2C)c4ccc(F)cc4	BroadT	BRD-K56967203	BRD-K56967203-001-05-2	ChemDiv Inc.	C561-0723			COc1ccccc1NC(=O)CCc1c(C)nc2c(c(C)nn2c1C)-c1ccc(F)cc1	InChI=1S/C25H25FN4O2/c1-15-20(13-14-23(31)28-21-7-5-6-8-22(21)32-4)17(3)30-25(27-15)24(16(2)29-30)18-9-11-19(26)12-10-18/h5-12H,13-14H2,1-4H3,(H,28,31)	OGJGONTTYUENKH-UHFFFAOYSA-N	432.19615428							117191
SMR000221645	LSM-28641	SID17505942, SID57299448, BRD-K54874587	2007903	InChI=1S/C23H24N4O3S2/c1-2-30-22(29)20-17-9-12-27(13-16-7-4-3-5-8-16)14-18(17)32-21(20)26-19(28)15-31-23-24-10-6-11-25-23/h3-8,10-11H,2,9,12-15H2,1H3,(H,26,28)	DTWIIKJJMVZEDY-UHFFFAOYSA-N	CCOC(=O)c1c2CCN(Cc3ccccc3)Cc2sc1NC(=O)CSc4ncccn4	BroadT	BRD-K54874587	BRD-K54874587-001-05-8	InterBioScreen Ltd.	STOCK4S-43392			CCOC(=O)c1c(NC(=O)CSc2ncccn2)sc2CN(Cc3ccccc3)CCc12	InChI=1S/C23H24N4O3S2/c1-2-30-22(29)20-17-9-12-27(13-16-7-4-3-5-8-16)14-18(17)32-21(20)26-19(28)15-31-23-24-10-6-11-25-23/h3-8,10-11H,2,9,12-15H2,1H3,(H,26,28)	DTWIIKJJMVZEDY-UHFFFAOYSA-N	468.128982048							117192
MLS000058578	LSM-28642	SID3716783, BRD-K96724187	2547390	InChI=1S/C15H19N5/c1-3-7-13(8-4-1)11-12-16-15-17-18-19-20(15)14-9-5-2-6-10-14/h2,5-7,9-10H,1,3-4,8,11-12H2,(H,16,17,19)	SREKFVYWFHWCJD-UHFFFAOYSA-N	C(CC1=CCCCC1)Nc2nnnn2c3ccccc3	BroadT	BRD-K96724187	BRD-K96724187-001-05-9	Enamine Ltd.	T5339857			C(CC1=CCCCC1)Nc1nnnn1-c1ccccc1	InChI=1S/C15H19N5/c1-3-7-13(8-4-1)11-12-16-15-17-18-19-20(15)14-9-5-2-6-10-14/h2,5-7,9-10H,1,3-4,8,11-12H2,(H,16,17,19)	SREKFVYWFHWCJD-UHFFFAOYSA-N	269.164045658							117193
1-(4-Methoxybenzoyl)-1,2-dihydroquinoline-2-carbonitrile	LSM-28643	SID22412522, BRD-A06899981	280107	InChI=1S/C18H14N2O2/c1-22-16-10-7-14(8-11-16)18(21)20-15(12-19)9-6-13-4-2-3-5-17(13)20/h2-11,15H,1H3	WUJAMDNMCMEVOJ-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)N2C(C=Cc3ccccc23)C#N	BroadT	BRD-A06899981	BRD-A06899981-001-07-4	Specs	AG-777/25006450			COc1ccc(cc1)C(=O)N1C(C=Cc2ccccc12)C#N	InChI=1S/C18H14N2O2/c1-22-16-10-7-14(8-11-16)18(21)20-15(12-19)9-6-13-4-2-3-5-17(13)20/h2-11,15H,1H3	WUJAMDNMCMEVOJ-UHFFFAOYSA-N	290.105527708							117194
1-Benzyl-3-[1-(4-fluoro-benzyl)-5-methyl-2-oxo-1,2-dihydro-pyridin-3-yl]-urea	LSM-28644	SID47204324, BRD-K14348659	3231713	InChI=1S/C21H20FN3O2/c1-15-11-19(24-21(27)23-12-16-5-3-2-4-6-16)20(26)25(13-15)14-17-7-9-18(22)10-8-17/h2-11,13H,12,14H2,1H3,(H2,23,24,27)	LQSAJWOWCPMLDA-UHFFFAOYSA-N	CC1=CN(Cc2ccc(F)cc2)C(=O)C(=C1)NC(=O)NCc3ccccc3	BroadT	BRD-K14348659	BRD-K14348659-001-05-5	Asinex Ltd.	ASN 10013592			Cc1cc(NC(=O)NCc2ccccc2)c(=O)n(Cc2ccc(F)cc2)c1	InChI=1S/C21H20FN3O2/c1-15-11-19(24-21(27)23-12-16-5-3-2-4-6-16)20(26)25(13-15)14-17-7-9-18(22)10-8-17/h2-11,13H,12,14H2,1H3,(H2,23,24,27)	LQSAJWOWCPMLDA-UHFFFAOYSA-N	365.15395511							117195
F0579-0231	LSM-28645	SID4247601, BRD-K11864540	2052841	InChI=1S/C22H19N3O5S2/c1-28-16-5-3-2-4-15(16)25-21(27)20-14(8-9-31-20)24-22(25)32-11-19(26)23-13-6-7-17-18(10-13)30-12-29-17/h2-7,10H,8-9,11-12H2,1H3,(H,23,26)	OVTRWWAFZIYZGF-UHFFFAOYSA-N	COc1ccccc1N2C(=O)C3=C(CCS3)N=C2SCC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K11864540	BRD-K11864540-001-05-7	ChemDiv Inc.	C144-0207			COc1ccccc1-n1c(SCC(=O)Nc2ccc3OCOc3c2)nc2CCSc2c1=O	InChI=1S/C22H19N3O5S2/c1-28-16-5-3-2-4-15(16)25-21(27)20-14(8-9-31-20)24-22(25)32-11-19(26)23-13-6-7-17-18(10-13)30-12-29-17/h2-7,10H,8-9,11-12H2,1H3,(H,23,26)	OVTRWWAFZIYZGF-UHFFFAOYSA-N	469.076612118							117196
F1887-0247	LSM-28646	SID24814260, BRD-K42674811	16194276	InChI=1S/C15H16N6O/c1-9-4-5-12(6-10(9)2)21-15-13(7-18-21)14(16-8-17-15)20-19-11(3)22/h4-8H,1-3H3,(H,19,22)(H,16,17,20)	IUXSMTAUSQVXSU-UHFFFAOYSA-N	CC(=O)NNc1ncnc2c1cnn2c3ccc(C)c(C)c3	BroadT	BRD-K42674811	BRD-K42674811-001-05-5	ChemDiv Inc.	K405-4026			CC(=O)NNc1ncnc2n(ncc12)-c1ccc(C)c(C)c1	InChI=1S/C15H16N6O/c1-9-4-5-12(6-10(9)2)21-15-13(7-18-21)14(16-8-17-15)20-19-11(3)22/h4-8H,1-3H3,(H,19,22)(H,16,17,20)	IUXSMTAUSQVXSU-UHFFFAOYSA-N	296.138559192							117197
AC1LLORF	LSM-15433	BRD-K98102599	1070884	InChI=1S/C20H23BrN2O3S2/c1-5-26-20(25)18-15(11-28-16-7-6-8-27-16)23(4)14-9-13(21)19(24)12(17(14)18)10-22(2)3/h6-9,24H,5,10-11H2,1-4H3	NZDNHRDPEYHJMS-UHFFFAOYSA-N	CCOC(=O)c1c(CSc2cccs2)n(C)c3cc(Br)c(O)c(CN(C)C)c13	BroadT	BRD-K98102599	BRD-K98102599-003-05-4	Asinex Ltd.	BAS 02098854		Cl	CCOC(=O)c1c(CSc2cccs2)n(C)c2cc(Br)c(O)c(CN(C)C)c12.Cl	InChI=1S/C20H23BrN2O3S2.ClH/c1-5-26-20(25)18-15(11-28-16-7-6-8-27-16)23(4)14-9-13(21)19(24)12(17(14)18)10-22(2)3;/h6-9,24H,5,10-11H2,1-4H3;1H	STCBTRNNMANGIR-UHFFFAOYSA-N	482.033346596							104075, 104075
9-Oxo-n-(1-phenylethyl)bicyclo[3.3.1]nonane-3-carboxamide	LSM-28647	SID4261650, BRD-A04843266	2969415	InChI=1S/C18H23NO2/c1-12(13-6-3-2-4-7-13)19-18(21)16-10-14-8-5-9-15(11-16)17(14)20/h2-4,6-7,12,14-16H,5,8-11H2,1H3,(H,19,21)	NDYPFWPCXATQQP-UHFFFAOYSA-N	CC(NC(=O)C1CC2CCCC(C1)C2=O)c3ccccc3	BroadT	BRD-A04843266	BRD-A04843266-001-05-4	ChemBridge Corporation	7939537			CC(NC(=O)C1CC2CCCC(C1)C2=O)c1ccccc1	InChI=1S/C18H23NO2/c1-12(13-6-3-2-4-7-13)19-18(21)16-10-14-8-5-9-15(11-16)17(14)20/h2-4,6-7,12,14-16H,5,8-11H2,1H3,(H,19,21)	NDYPFWPCXATQQP-UHFFFAOYSA-N	285.172878986							117198
MLS000416825	LSM-28648	SID22408852, BRD-K85088680	2461136	InChI=1S/C20H21N3O3S3/c1-14-4-6-15(7-5-14)17-13-28-20(21-17)22-19(24)16-8-10-23(11-9-16)29(25,26)18-3-2-12-27-18/h2-7,12-13,16H,8-11H2,1H3,(H,21,22,24)	KFXBEFOIUWYBHB-UHFFFAOYSA-N	Cc1ccc(cc1)c2csc(NC(=O)C3CCN(CC3)S(=O)(=O)c4cccs4)n2	BroadT	BRD-K85088680	BRD-K85088680-001-06-2	Enamine Ltd.	T5318468			Cc1ccc(cc1)-c1csc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cccs2)n1	InChI=1S/C20H21N3O3S3/c1-14-4-6-15(7-5-14)17-13-28-20(21-17)22-19(24)16-8-10-23(11-9-16)29(25,26)18-3-2-12-27-18/h2-7,12-13,16H,8-11H2,1H3,(H,21,22,24)	KFXBEFOIUWYBHB-UHFFFAOYSA-N	447.074503632							117199
MLS000517075	LSM-28649	SID24827998, BRD-K05276980	3462706	InChI=1S/C13H11BrN2O3/c1-9-2-7-12(13(15-9)16(17)18)19-8-10-3-5-11(14)6-4-10/h2-7H,8H2,1H3	IFDGERBZNBLBRL-UHFFFAOYSA-N	Cc1ccc(OCc2ccc(Br)cc2)c(n1)[N+](=O)[O-]	BroadT	BRD-K05276980	BRD-K05276980-001-03-4	Enamine Ltd.	T0518-1961			Cc1ccc(OCc2ccc(Br)cc2)c(n1)[N+]([O-])=O	InChI=1S/C13H11BrN2O3/c1-9-2-7-12(13(15-9)16(17)18)19-8-10-3-5-11(14)6-4-10/h2-7H,8H2,1H3	IFDGERBZNBLBRL-UHFFFAOYSA-N	321.995304832							117200
STK561508	LSM-28650	SID14741562, BRD-K74380400	1397551	InChI=1S/C18H13ClN4OS/c1-11-15(16(22-24-11)12-7-3-2-4-8-12)17-20-21-18(25)23(17)14-10-6-5-9-13(14)19/h2-10H,1H3,(H,21,25)	AVIUBFYZEGCWIQ-UHFFFAOYSA-N	Cc1onc(c2ccccc2)c1c3nnc(S)n3c4ccccc4Cl	BroadT	BRD-K74380400	BRD-K74380400-001-05-7	InterBioScreen Ltd.	STOCK4S-09085			Cc1onc(c1-c1nnc(S)n1-c1ccccc1Cl)-c1ccccc1	InChI=1S/C18H13ClN4OS/c1-11-15(16(22-24-11)12-7-3-2-4-8-12)17-20-21-18(25)23(17)14-10-6-5-9-13(14)19/h2-10H,1H3,(H,21,25)	AVIUBFYZEGCWIQ-UHFFFAOYSA-N	368.049859476							117201
MLS000103090	LSM-28651	SID7970596, BRD-K36757574	755542	InChI=1S/C15H15N3/c1-2-18-14-6-4-3-5-13(14)17-15(18)11-7-9-12(16)10-8-11/h3-10H,2,16H2,1H3	IRTDEAMFWIIOHK-UHFFFAOYSA-N	CCn1c(nc2ccccc12)c3ccc(N)cc3	BroadT	BRD-K36757574	BRD-K36757574-001-05-3	Life Chemicals Inc.	F1115-0211			CCn1c(nc2ccccc12)-c1ccc(N)cc1	InChI=1S/C15H15N3/c1-2-18-14-6-4-3-5-13(14)17-15(18)11-7-9-12(16)10-8-11/h3-10H,2,16H2,1H3	IRTDEAMFWIIOHK-UHFFFAOYSA-N	237.12659751							117202
SMR000022324	LSM-28652	SID4251033, BRD-K94849813	3244769	InChI=1S/C22H21F3N4O/c1-30-18-9-5-6-16(14-18)19-15-20(22(23,24)25)27-21(26-19)29-12-10-28(11-13-29)17-7-3-2-4-8-17/h2-9,14-15H,10-13H2,1H3	LVYVUROZBDFRGK-UHFFFAOYSA-N	COc1cccc(c1)c2cc(nc(n2)N3CCN(CC3)c4ccccc4)C(F)(F)F	BroadT	BRD-K94849813	BRD-K94849813-001-05-8	ChemDiv Inc.	C130-0314			COc1cccc(c1)-c1cc(nc(n1)N1CCN(CC1)c1ccccc1)C(F)(F)F	InChI=1S/C22H21F3N4O/c1-30-18-9-5-6-16(14-18)19-15-20(22(23,24)25)27-21(26-19)29-12-10-28(11-13-29)17-7-3-2-4-8-17/h2-9,14-15H,10-13H2,1H3	LVYVUROZBDFRGK-UHFFFAOYSA-N	414.166745932							117203
MLS000520697	LSM-28653	SID14738451, BRD-K40948681	4197752	InChI=1S/C21H25N5O2S/c1-28-17-7-5-16(6-8-17)25-14-12-24(13-15-25)10-3-11-26-20(27)18-4-2-9-22-19(18)23-21(26)29/h2,4-9H,3,10-15H2,1H3,(H,22,23,29)	MTLRKPKUSXGNGX-UHFFFAOYSA-N	COc1ccc(cc1)N2CCN(CCCN3C(=S)Nc4ncccc4C3=O)CC2	BroadT	BRD-K40948681	BRD-K40948681-001-07-8	ChemDiv Inc.	K256-0048			COc1ccc(cc1)N1CCN(CCCn2c(=S)[nH]c3ncccc3c2=O)CC1	InChI=1S/C21H25N5O2S/c1-28-17-7-5-16(6-8-17)25-14-12-24(13-15-25)10-3-11-26-20(27)18-4-2-9-22-19(18)23-21(26)29/h2,4-9H,3,10-15H2,1H3,(H,22,23,29)	MTLRKPKUSXGNGX-UHFFFAOYSA-N	411.17289578							117204
MLS000392762	LSM-44289	SID22409886, BRD-K69809112	2315023	InChI=1S/C11H10N2O2S/c1-8-2-3-9(15-8)4-5-10(14)13-11-12-6-7-16-11/h2-7H,1H3,(H,12,13,14)/b5-4+	WXPPKRVWDCVHPH-SNAWJCMRSA-N	Cc1oc(\C=C\C(=O)Nc2nccs2)cc1	BroadT	BRD-K69809112	BRD-K69809112-001-05-1	Enamine Ltd.	T0503-0641			Cc1ccc(\C=C\C(=O)Nc2nccs2)o1	InChI=1S/C11H10N2O2S/c1-8-2-3-9(15-8)4-5-10(14)13-11-12-6-7-16-11/h2-7H,1H3,(H,12,13,14)/b5-4+	WXPPKRVWDCVHPH-SNAWJCMRSA-N	234.04629827							
SMR000204290	LSM-28655	SID17510394, BRD-A82593237	5210577	InChI=1S/C28H29NO7/c1-32-21-10-12-22(13-11-21)36-26-25(19-6-8-20(9-7-19)28(31)35-4)29(27(26)30)16-15-18-5-14-23(33-2)24(17-18)34-3/h5-14,17,25-26H,15-16H2,1-4H3	NJTVDSRJSONYRA-UHFFFAOYSA-N	COC(=O)c1ccc(cc1)C2C(Oc3ccc(OC)cc3)C(=O)N2CCc4ccc(OC)c(OC)c4	BroadT	BRD-A82593237	BRD-A82593237-001-05-6	ChemDiv Inc.	6786-9290			COC(=O)c1ccc(cc1)C1C(Oc2ccc(OC)cc2)C(=O)N1CCc1ccc(OC)c(OC)c1	InChI=1S/C28H29NO7/c1-32-21-10-12-22(13-11-21)36-26-25(19-6-8-20(9-7-19)28(31)35-4)29(27(26)30)16-15-18-5-14-23(33-2)24(17-18)34-3/h5-14,17,25-26H,15-16H2,1-4H3	NJTVDSRJSONYRA-UHFFFAOYSA-N	491.194402278							117206
AC1O4AX7	LSM-44290	SID24814393, BRD-K40164621	6383755	InChI=1S/C18H16N4O3/c1-12-7-9-13(10-8-12)21-19-11-15-16(23)20-18(25)22(17(15)24)14-5-3-2-4-6-14/h2-11,19,21H,1H3,(H,20,23,25)/b15-11+	KZZUEPFQSWYNCF-RVDMUPIBSA-N	Cc1ccc(NN\C=C\2/C(=O)NC(=O)N(C2=O)c3ccccc3)cc1	BroadT	BRD-K40164621	BRD-K40164621-001-06-7	ChemDiv Inc.	K652-0006			Cc1ccc(NN\C=C2/C(=O)NC(=O)N(C2=O)c2ccccc2)cc1	InChI=1S/C18H16N4O3/c1-12-7-9-13(10-8-12)21-19-11-15-16(23)20-18(25)22(17(15)24)14-5-3-2-4-6-14/h2-11,19,21H,1H3,(H,20,23,25)/b15-11+	KZZUEPFQSWYNCF-RVDMUPIBSA-N	336.122240412							
AC1O9IP4	LSM-28657	BRD-K71036361	6759435	InChI=1S/C25H20N4O3/c1-32-22-14-8-13-19(23(22)30)16-26-29-25(31)24-27-20(17-9-4-2-5-10-17)15-21(28-24)18-11-6-3-7-12-18/h2-16,30H,1H3,(H,29,31)	GLKKKGCVBGIVLP-UHFFFAOYSA-N	COc1cccc(C=NNC(=O)c2nc(cc(n2)c3ccccc3)c4ccccc4)c1O	BroadT	BRD-K71036361	BRD-K71036361-001-07-1	ChemBridge Corporation	5341759			COc1cccc(C=NNC(=O)c2nc(cc(n2)-c2ccccc2)-c2ccccc2)c1O	InChI=1S/C25H20N4O3/c1-32-22-14-8-13-19(23(22)30)16-26-29-25(31)24-27-20(17-9-4-2-5-10-17)15-21(28-24)18-11-6-3-7-12-18/h2-16,30H,1H3,(H,29,31)	GLKKKGCVBGIVLP-UHFFFAOYSA-N	424.15354054							
MLS001239362	LSM-15434	BRD-K86768297	24892613	InChI=1S/C29H34N4O4S2/c1-5-37-25-13-9-14-26-27(25)30-29(38-26)33(20-10-19-31(2)3)28(34)23-15-17-24(18-16-23)39(35,36)32(4)21-22-11-7-6-8-12-22/h6-9,11-18H,5,10,19-21H2,1-4H3	IWWLCALWBJNSIU-UHFFFAOYSA-N	CCOc1cccc2sc(nc12)N(CCCN(C)C)C(=O)c3ccc(cc3)S(=O)(=O)N(C)Cc4ccccc4	BroadT	BRD-K86768297	BRD-K86768297-003-06-9	Life Chemicals Inc.	F2019-1251		Cl	CCOc1cccc2sc(nc12)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N(C)Cc1ccccc1.Cl	InChI=1S/C29H34N4O4S2.ClH/c1-5-37-25-13-9-14-26-27(25)30-29(38-26)33(20-10-19-31(2)3)28(34)23-15-17-24(18-16-23)39(35,36)32(4)21-22-11-7-6-8-12-22;/h6-9,11-18H,5,10,19-21H2,1-4H3;1H	VNVVFKOQTSLNHR-UHFFFAOYSA-N	566.202146988							104076, 104076
T0515-5257	LSM-28658	SID17516334, BRD-K82830713	2416093	InChI=1S/C23H23ClFN3O4/c1-2-3-12-28-20-7-5-4-6-18(20)27-19(23(28)31)10-11-22(30)32-14-21(29)26-15-8-9-17(25)16(24)13-15/h4-9,13H,2-3,10-12,14H2,1H3,(H,26,29)	DFELDJXJONJYET-UHFFFAOYSA-N	CCCCN1C(=O)C(=Nc2ccccc12)CCC(=O)OCC(=O)Nc3ccc(F)c(Cl)c3	BroadT	BRD-K82830713	BRD-K82830713-001-05-3	Enamine Ltd.	T0515-5257			CCCCn1c2ccccc2nc(CCC(=O)OCC(=O)Nc2ccc(F)c(Cl)c2)c1=O	InChI=1S/C23H23ClFN3O4/c1-2-3-12-28-20-7-5-4-6-18(20)27-19(23(28)31)10-11-22(30)32-14-21(29)26-15-8-9-17(25)16(24)13-15/h4-9,13H,2-3,10-12,14H2,1H3,(H,26,29)	DFELDJXJONJYET-UHFFFAOYSA-N	459.136112156							117209
2-Acetylphenanthrene	LSM-28659	SID17387314, BRD-K86411177	80060	InChI=1S/C16H12O/c1-11(17)13-8-9-16-14(10-13)7-6-12-4-2-3-5-15(12)16/h2-10H,1H3	CWILMKDSVMROHT-UHFFFAOYSA-N	CC(=O)c1ccc2c(ccc3ccccc23)c1	BroadT	BRD-K86411177	BRD-K86411177-001-05-7	Specs	AO-638/40897172			CC(=O)c1ccc2c(ccc3ccccc23)c1	InChI=1S/C16H12O/c1-11(17)13-8-9-16-14(10-13)7-6-12-4-2-3-5-15(12)16/h2-10H,1H3	CWILMKDSVMROHT-UHFFFAOYSA-N	220.088815004							117210
2-(Azepan-1-yl)-n-[4-(dimethylsulfamoyl)phenyl]acetamide	LSM-28660	SID49677758, BRD-K68789979	2480370	InChI=1S/C16H25N3O3S/c1-18(2)23(21,22)15-9-7-14(8-10-15)17-16(20)13-19-11-5-3-4-6-12-19/h7-10H,3-6,11-13H2,1-2H3,(H,17,20)	QFPOHLPCXPZHII-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(NC(=O)CN2CCCCCC2)cc1	BroadT	BRD-K68789979	BRD-K68789979-001-05-8	Enamine Ltd.	T5284172			CN(C)S(=O)(=O)c1ccc(NC(=O)CN2CCCCCC2)cc1	InChI=1S/C16H25N3O3S/c1-18(2)23(21,22)15-9-7-14(8-10-15)17-16(20)13-19-11-5-3-4-6-12-19/h7-10H,3-6,11-13H2,1-2H3,(H,17,20)	QFPOHLPCXPZHII-UHFFFAOYSA-N	339.16166238							117211
HMS2686I16	LSM-28661	BRD-K89148288	16195433	InChI=1S/C22H23FN4O3S/c1-14(28)27-10-8-22(9-11-27)13-19(16-12-15(29)6-7-20(16)30-22)25-26-21(31)24-18-5-3-2-4-17(18)23/h2-7,12,29H,8-11,13H2,1H3,(H2,24,26,31)	LVDPHUNEBVLPFQ-UHFFFAOYSA-N	CC(=O)N1CCC2(CC1)CC(=NN=C(S)Nc3ccccc3F)c4cc(O)ccc4O2	BroadT	BRD-K89148288	BRD-K89148288-001-05-8	ChemDiv Inc.	K786-0556			CC(=O)N1CCC2(CC1)CC(=NN=C(S)Nc1ccccc1F)c1cc(O)ccc1O2	InChI=1S/C22H23FN4O3S/c1-14(28)27-10-8-22(9-11-27)13-19(16-12-15(29)6-7-20(16)30-22)25-26-21(31)24-18-5-3-2-4-17(18)23/h2-7,12,29H,8-11,13H2,1H3,(H2,24,26,31)	LVDPHUNEBVLPFQ-UHFFFAOYSA-N	442.147489526							117212
SMR000023706	LSM-28662	SID4249665, BRD-K59761728	3243588	InChI=1S/C24H30N4O4/c1-5-32-24(31)27-12-10-26(11-13-27)22(29)18-15-28(14-16(2)3)23(30)21-20(18)17-8-6-7-9-19(17)25(21)4/h6-9,15-16H,5,10-14H2,1-4H3	FZFFTCXHYOEUBD-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)C2=CN(CC(C)C)C(=O)c3c2c4ccccc4n3C	BroadT	BRD-K59761728	BRD-K59761728-001-05-2	ChemDiv Inc.	C237-0774			CCOC(=O)N1CCN(CC1)C(=O)c1cn(CC(C)C)c(=O)c2n(C)c3ccccc3c12	InChI=1S/C24H30N4O4/c1-5-32-24(31)27-12-10-26(11-13-27)22(29)18-15-28(14-16(2)3)23(30)21-20(18)17-8-6-7-9-19(17)25(21)4/h6-9,15-16H,5,10-14H2,1-4H3	FZFFTCXHYOEUBD-UHFFFAOYSA-N	438.22670548							117213
BAS 07213662	LSM-28663	SID24803414, BRD-K29284774	1088568	InChI=1S/C18H14N4O/c1-22-17-9-7-14(11-16(17)20-21-22)18(23)19-15-8-6-12-4-2-3-5-13(12)10-15/h2-11H,1H3,(H,19,23)	IKDXYEOTMKMCQM-UHFFFAOYSA-N	Cn1nnc2cc(ccc12)C(=O)Nc3ccc4ccccc4c3	BroadT	BRD-K29284774	BRD-K29284774-001-05-5	Asinex Ltd.	BAS 07213662			Cn1nnc2cc(ccc12)C(=O)Nc1ccc2ccccc2c1	InChI=1S/C18H14N4O/c1-22-17-9-7-14(11-16(17)20-21-22)18(23)19-15-8-6-12-4-2-3-5-13(12)10-15/h2-11H,1H3,(H,19,23)	IKDXYEOTMKMCQM-UHFFFAOYSA-N	302.116761108							117214
AC1MMV4J	LSM-44291	SID4251189, BRD-K00395711	3244908	InChI=1S/C13H13NOS/c1-10-8-11(13(15)16-10)9-14(2)12-6-4-3-5-7-12/h3-9H,1-2H3/b11-9-	OSPOLNHPFDNMAQ-LUAWRHEFSA-N	CN(\C=C/1\C=C(C)SC1=O)c2ccccc2	BroadT	BRD-K00395711	BRD-K00395711-001-06-6	ChemDiv Inc.	1726-0134			CN(\C=C1\C=C(C)SC1=O)c1ccccc1	InChI=1S/C13H13NOS/c1-10-8-11(13(15)16-10)9-14(2)12-6-4-3-5-7-12/h3-9H,1-2H3/b11-9-	OSPOLNHPFDNMAQ-LUAWRHEFSA-N	231.071784736							
N-(2-Hydroxy-5-methoxy-1H-indol-3-yl)acetamide	LSM-28665	SID4255507, BRD-K48671385	977457	InChI=1S/C11H12N2O3/c1-6(14)12-10-8-5-7(16-2)3-4-9(8)13-11(10)15/h3-5,13,15H,1-2H3,(H,12,14)	XZABMVNOSCYVBT-UHFFFAOYSA-N	COc1ccc2[nH]c(O)c(NC(=O)C)c2c1	BroadT	BRD-K48671385	BRD-K48671385-001-05-1	ChemBridge Corporation	7751478			COc1ccc2[nH]c(O)c(NC(C)=O)c2c1	InChI=1S/C11H12N2O3/c1-6(14)12-10-8-5-7(16-2)3-4-9(8)13-11(10)15/h3-5,13,15H,1-2H3,(H,12,14)	XZABMVNOSCYVBT-UHFFFAOYSA-N	220.084792264							117216
SMR000129641	LSM-44292	SID17402063, BRD-K24743564	11957277	InChI=1S/C18H15Cl3N6O4/c19-15-3-1-12(8-22-15)10-24-5-6-25(11-13-2-4-16(20)23-9-13)18(24)14(26(28)29)7-17(21)27(30)31/h1-4,7-9H,5-6,10-11H2/b17-7+	ILVKQWNIKHIELN-REZTVBANSA-N	[O-][N+](=O)\C(=C\C(=C1N(Cc2ccc(Cl)nc2)CCN1Cc3ccc(Cl)nc3)[N+](=O)[O-])\Cl	BroadT	BRD-K24743564	BRD-K24743564-001-06-7	ChemDiv Inc.	4872-0729			[O-][N+](=O)C(\Cl)=C\C(=C1N(Cc2ccc(Cl)nc2)CCN1Cc1ccc(Cl)nc1)[N+]([O-])=O	InChI=1S/C18H15Cl3N6O4/c19-15-3-1-12(8-22-15)10-24-5-6-25(11-13-2-4-16(20)23-9-13)18(24)14(26(28)29)7-17(21)27(30)31/h1-4,7-9H,5-6,10-11H2/b17-7+	ILVKQWNIKHIELN-REZTVBANSA-N	484.02203615							
F0526-0618	LSM-15435	BRD-K50702329	5055195	InChI=1S/C18H20N2O3S/c1-12(21)19-17-16(18(22)23-2)14-8-9-20(11-15(14)24-17)10-13-6-4-3-5-7-13/h3-7H,8-11H2,1-2H3,(H,19,21)	LOQMXCXHODKEKF-UHFFFAOYSA-N	COC(=O)c1c2CCN(Cc3ccccc3)Cc2sc1NC(=O)C	BroadT	BRD-K50702329	BRD-K50702329-003-04-7	Life Chemicals Inc.	F0526-0618		Cl	COC(=O)c1c(NC(C)=O)sc2CN(Cc3ccccc3)CCc12.Cl	InChI=1S/C18H20N2O3S.ClH/c1-12(21)19-17-16(18(22)23-2)14-8-9-20(11-15(14)24-17)10-13-6-4-3-5-7-13;/h3-7H,8-11H2,1-2H3,(H,19,21);1H	DMGODGYKNGENID-UHFFFAOYSA-N	344.11946321							104077, 104077
SMR000039124	LSM-28667	SID856929, BRD-K42939978	658282	InChI=1S/C19H22N6/c1-5-6-9-14-12(2)23-25(13(14)3)19-20-18-17(21-22-19)15-10-7-8-11-16(15)24(18)4/h7-8,10-11H,5-6,9H2,1-4H3	JGYUFMKJXJBMCG-UHFFFAOYSA-N	CCCCc1c(C)nn(c1C)c2nnc3c4ccccc4n(C)c3n2	BroadT	BRD-K42939978	BRD-K42939978-001-06-9	InterBioScreen Ltd.	STOCK1S-34386			CCCCc1c(C)nn(c1C)-c1nnc2c3ccccc3n(C)c2n1	InChI=1S/C19H22N6/c1-5-6-9-14-12(2)23-25(13(14)3)19-20-18-17(21-22-19)15-10-7-8-11-16(15)24(18)4/h7-8,10-11H,5-6,9H2,1-4H3	JGYUFMKJXJBMCG-UHFFFAOYSA-N	334.190594764							117218
AC1LDOSE	LSM-28668	BRD-K85434208	671288	InChI=1S/C12H12N2O3/c1-8-3-4-10(17-8)7-13-14-12(15)11-5-6-16-9(11)2/h3-7H,1-2H3,(H,14,15)	JXBRZSRQCRXUML-UHFFFAOYSA-N	Cc1oc(C=NNC(=O)c2ccoc2C)cc1	BroadT	BRD-K85434208	BRD-K85434208-001-05-3	InterBioScreen Ltd.	STOCK3S-28271			Cc1ccc(C=NNC(=O)c2ccoc2C)o1	InChI=1S/C12H12N2O3/c1-8-3-4-10(17-8)7-13-14-12(15)11-5-6-16-9(11)2/h3-7H,1-2H3,(H,14,15)	JXBRZSRQCRXUML-UHFFFAOYSA-N	232.084792264							117219
AC1N5ABW	LSM-28669	BRD-K56384996	4168532	InChI=1S/C16H13N3O2S/c1-10(11-6-7-13-14(8-11)21-9-20-13)18-19-16-17-12-4-2-3-5-15(12)22-16/h2-8H,9H2,1H3,(H,17,19)	ILTZFGLQVVJAHO-UHFFFAOYSA-N	CC(=NNc1nc2ccccc2s1)c3ccc4OCOc4c3	BroadT	BRD-K56384996	BRD-K56384996-001-06-9	Enamine Ltd.	T0508-5446			CC(=NNc1nc2ccccc2s1)c1ccc2OCOc2c1	InChI=1S/C16H13N3O2S/c1-10(11-6-7-13-14(8-11)21-9-20-13)18-19-16-17-12-4-2-3-5-15(12)22-16/h2-8H,9H2,1H3,(H,17,19)	ILTZFGLQVVJAHO-UHFFFAOYSA-N	311.072847376							117220
F1853-0129	LSM-28670	SID24816675, BRD-K95396771	7197245	InChI=1S/C12H9ClN4OS2/c1-7-10(18)17-11(15-14-7)20-12(16-17)19-6-8-3-2-4-9(13)5-8/h2-5H,6H2,1H3	LYTZFYGVCIXOGQ-UHFFFAOYSA-N	CC1=NN=C2SC(=NN2C1=O)SCc3cccc(Cl)c3	BroadT	BRD-K95396771	BRD-K95396771-001-07-5	Life Chemicals Inc.	F1853-0129			Cc1nnc2sc(SCc3cccc(Cl)c3)nn2c1=O	InChI=1S/C12H9ClN4OS2/c1-7-10(18)17-11(15-14-7)20-12(16-17)19-6-8-3-2-4-9(13)5-8/h2-5H,6H2,1H3	LYTZFYGVCIXOGQ-UHFFFAOYSA-N	323.990630038							117221
SMR000060598	LSM-28671	SID3714883, BRD-K07813038	2998993	InChI=1S/C17H22N4/c1-2-10-16-18-19-17(21(16)12-5-1)13-20-11-6-8-14-7-3-4-9-15(14)20/h3-4,7,9H,1-2,5-6,8,10-13H2	VPIIZRMCXVWXNW-UHFFFAOYSA-N	C(N1CCCc2ccccc12)c3nnc4CCCCCn34	BroadT	BRD-K07813038	BRD-K07813038-001-06-7	Enamine Ltd.	T0504-1840			C(N1CCCc2ccccc12)c1nnc2CCCCCn12	InChI=1S/C17H22N4/c1-2-10-16-18-19-17(21(16)12-5-1)13-20-11-6-8-14-7-3-4-9-15(14)20/h3-4,7,9H,1-2,5-6,8,10-13H2	VPIIZRMCXVWXNW-UHFFFAOYSA-N	282.184446744							117222
SMR000037010	LSM-28672	SID858561, BRD-K62640612	612226	InChI=1S/C12H13N3O2/c1-17-12(16)10-7-4-2-3-5-9(7)15-11(14)8(10)6-13/h2-5H2,1H3,(H2,14,15)	KTHIJTUJUXPDDZ-UHFFFAOYSA-N	COC(=O)c1c2CCCCc2nc(N)c1C#N	BroadT	BRD-K62640612	BRD-K62640612-001-05-2	InterBioScreen Ltd.	STOCK2S-50926			COC(=O)c1c2CCCCc2nc(N)c1C#N	InChI=1S/C12H13N3O2/c1-17-12(16)10-7-4-2-3-5-9(7)15-11(14)8(10)6-13/h2-5H2,1H3,(H2,14,15)	KTHIJTUJUXPDDZ-UHFFFAOYSA-N	231.100776686							117223
ZINC00243861	LSM-28673	SID24810839, BRD-K15528357	766872	InChI=1S/C14H15N5OS2/c1-2-5-12-18-19-14(22-12)17-11(20)8-21-13-15-9-6-3-4-7-10(9)16-13/h3-4,6-7H,2,5,8H2,1H3,(H,15,16)(H,17,19,20)	UZUHXOZGUNACKA-UHFFFAOYSA-N	CCCc1nnc(NC(=O)CSc2nc3ccccc3[nH]2)s1	BroadT	BRD-K15528357	BRD-K15528357-001-05-6	Asinex Ltd.	BAS 01313759			CCCc1nnc(NC(=O)CSc2nc3ccccc3[nH]2)s1	InChI=1S/C14H15N5OS2/c1-2-5-12-18-19-14(22-12)17-11(20)8-21-13-15-9-6-3-4-7-10(9)16-13/h3-4,6-7H,2,5,8H2,1H3,(H,15,16)(H,17,19,20)	UZUHXOZGUNACKA-UHFFFAOYSA-N	333.07180153							117224
AC1MUD4V	LSM-28674	BRD-K09109390	3616496	InChI=1S/C20H19N3OS/c1-25-19-10-6-15(7-11-19)13-22-23-20(24)14-21-18-9-8-16-4-2-3-5-17(16)12-18/h2-13,21H,14H2,1H3,(H,23,24)	AREORXJIVORCRV-UHFFFAOYSA-N	CSc1ccc(C=NNC(=O)CNc2ccc3ccccc3c2)cc1	BroadT	BRD-K09109390	BRD-K09109390-001-05-2	ChemDiv Inc.	2181-0226			CSc1ccc(C=NNC(=O)CNc2ccc3ccccc3c2)cc1	InChI=1S/C20H19N3OS/c1-25-19-10-6-15(7-11-19)13-22-23-20(24)14-21-18-9-8-16-4-2-3-5-17(16)12-18/h2-13,21H,14H2,1H3,(H,23,24)	AREORXJIVORCRV-UHFFFAOYSA-N	349.124882948							117225
2-Methyl-n-(2-naphthyl)-3-furamide	LSM-28675	SID7975245, BRD-K37576103	823601	InChI=1S/C16H13NO2/c1-11-15(8-9-19-11)16(18)17-14-7-6-12-4-2-3-5-13(12)10-14/h2-10H,1H3,(H,17,18)	BCQQHBSOPLVZGY-UHFFFAOYSA-N	Cc1occc1C(=O)Nc2ccc3ccccc3c2	BroadT	BRD-K37576103	BRD-K37576103-001-05-6	ChemBridge Corporation	5930698			Cc1occc1C(=O)Nc1ccc2ccccc2c1	InChI=1S/C16H13NO2/c1-11-15(8-9-19-11)16(18)17-14-7-6-12-4-2-3-5-13(12)10-14/h2-10H,1H3,(H,17,18)	BCQQHBSOPLVZGY-UHFFFAOYSA-N	251.094628666							117226
ST50866994	LSM-28676	SID4255064, BRD-K41332920	1246661	InChI=1S/C19H24N2OS/c1-3-6-17-13-16(14-23-17)19(22)21-11-9-20(10-12-21)18-8-5-4-7-15(18)2/h4-5,7-8,13-14H,3,6,9-12H2,1-2H3	NWGUZIIUTPEQKI-UHFFFAOYSA-N	CCCc1cc(cs1)C(=O)N2CCN(CC2)c3ccccc3C	BroadT	BRD-K41332920	BRD-K41332920-001-05-9	ChemBridge Corporation	7947492			CCCc1cc(cs1)C(=O)N1CCN(CC1)c1ccccc1C	InChI=1S/C19H24N2OS/c1-3-6-17-13-16(14-23-17)19(22)21-11-9-20(10-12-21)18-8-5-4-7-15(18)2/h4-5,7-8,13-14H,3,6,9-12H2,1-2H3	NWGUZIIUTPEQKI-UHFFFAOYSA-N	328.160934098							117227
AC1MWRDS	LSM-28677	SID26663909, BRD-A42306277	3803861	InChI=1S/C20H27N3O2/c1-4-20(3)13-14-9-6-7-10-15(14)17-16(20)18(25)23(5-2)19(22-17)21-11-8-12-24/h6-7,9-10,24H,4-5,8,11-13H2,1-3H3,(H,21,22)	AORQFQRMBKGVPL-UHFFFAOYSA-N	CCN1C(=O)C2=C(N=C1NCCCO)c3ccccc3CC2(C)CC	BroadT	BRD-A42306277	BRD-A42306277-001-05-3	InterBioScreen Ltd.	STOCK3S-84678			CCn1c(NCCCO)nc2-c3ccccc3CC(C)(CC)c2c1=O	InChI=1S/C20H27N3O2/c1-4-20(3)13-14-9-6-7-10-15(14)17-16(20)18(25)23(5-2)19(22-17)21-11-8-12-24/h6-7,9-10,24H,4-5,8,11-13H2,1-3H3,(H,21,22)	AORQFQRMBKGVPL-UHFFFAOYSA-N	341.210327134							117228
MLS000040506	LSM-28678	SID861817, BRD-K15897571	663042	InChI=1S/C21H27ClN6O2/c1-3-4-5-9-28-17-18(25(2)21(30)24-19(17)29)23-20(28)27-12-10-26(11-13-27)16-8-6-7-15(22)14-16/h6-8,14H,3-5,9-13H2,1-2H3,(H,24,29,30)	ZWHCMCUJSHPCFE-UHFFFAOYSA-N	CCCCCn1c(nc2N(C)C(=O)NC(=O)c12)N3CCN(CC3)c4cccc(Cl)c4	BroadT	BRD-K15897571	BRD-K15897571-001-06-3	InterBioScreen Ltd.	STOCK4S-18404			CCCCCn1c(nc2n(C)c(=O)[nH]c(=O)c12)N1CCN(CC1)c1cccc(Cl)c1	InChI=1S/C21H27ClN6O2/c1-3-4-5-9-28-17-18(25(2)21(30)24-19(17)29)23-20(28)27-12-10-26(11-13-27)16-8-6-7-15(22)14-16/h6-8,14H,3-5,9-13H2,1-2H3,(H,24,29,30)	ZWHCMCUJSHPCFE-UHFFFAOYSA-N	430.188401874							117229
MLS000698824	LSM-44293	SID24783746, BRD-K76679313	900247	InChI=1S/C14H14N2O3S/c1-8-6-9(4-5-11(8)19-3)7-10-12(17)15-14(20)16(2)13(10)18/h4-7H,1-3H3,(H,15,17,20)/b10-7+	CJSJRXHMLSWSKZ-JXMROGBWSA-N	COc1ccc(\C=C\2/C(=O)NC(=S)N(C)C2=O)cc1C	BroadT	BRD-K76679313	BRD-K76679313-001-05-6	Specs	AH-487/40935474			COc1ccc(\C=C2/C(=O)NC(=S)N(C)C2=O)cc1C	InChI=1S/C14H14N2O3S/c1-8-6-9(4-5-11(8)19-3)7-10-12(17)15-14(20)16(2)13(10)18/h4-7H,1-3H3,(H,15,17,20)/b10-7+	CJSJRXHMLSWSKZ-JXMROGBWSA-N	290.072513018							
MLS000724617	LSM-28680	SID17515108, BRD-K43332892	4178087	InChI=1S/C21H23N3S/c1-14-6-2-4-8-18(14)24-21(25)22-13-15-10-11-20-17(12-15)16-7-3-5-9-19(16)23-20/h2,4,6,8,10-12,23H,3,5,7,9,13H2,1H3,(H2,22,24,25)	HGJLHHKDLAESDK-UHFFFAOYSA-N	Cc1ccccc1N=C(S)NCc2ccc3[nH]c4CCCCc4c3c2	BroadT	BRD-K43332892	BRD-K43332892-001-04-4	Life Chemicals Inc.	F0651-0502			Cc1ccccc1N=C(S)NCc1ccc2[nH]c3CCCCc3c2c1	InChI=1S/C21H23N3S/c1-14-6-2-4-8-18(14)24-21(25)22-13-15-10-11-20-17(12-15)16-7-3-5-9-19(16)23-20/h2,4,6,8,10-12,23H,3,5,7,9,13H2,1H3,(H2,22,24,25)	HGJLHHKDLAESDK-UHFFFAOYSA-N	349.161268456							117231
MLS000697683	LSM-28681	SID26725293, BRD-A50810401	16745530	InChI=1S/C30H50O3/c1-25(2)22-8-11-30(7)24(28(22,5)10-9-23(25)33)21(32)16-19-20-17-26(3,18-31)12-13-27(20,4)14-15-29(19,30)6/h16,20-24,31-33H,8-15,17-18H2,1-7H3/t20-,21?,22+,23+,24?,26+,27-,28+,29+,30-/m1/s1	LOBOMSGBFMNHBJ-RVPNDLLZSA-N	C[C@]1(CO)CC[C@]2(C)CC[C@@]3(C)C(=CC(O)C4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@H]2C1	BroadT	BRD-A50810401	BRD-A50810401-001-05-2	University of North Carolina at Chapel Hill	GA-010			C[C@]1(CO)CC[C@]2(C)CC[C@@]3(C)C(=CC(O)C4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@H]2C1	InChI=1S/C30H50O3/c1-25(2)22-8-11-30(7)24(28(22,5)10-9-23(25)33)21(32)16-19-20-17-26(3,18-31)12-13-27(20,4)14-15-29(19,30)6/h16,20-24,31-33H,8-15,17-18H2,1-7H3/t20-,21?,22+,23+,24?,26+,27-,28+,29+,30-/m1/s1	LOBOMSGBFMNHBJ-RVPNDLLZSA-N	458.37599546							117232
AC1MZ6NU	LSM-28682	SID16952760, BRD-K40594353	3843255	InChI=1S/C22H21N3O2S2/c1-16-11-13-20(14-12-16)29(26,27)25-21(18-8-4-3-5-9-18)24-22(28)23-19-10-6-7-17(2)15-19/h3-15H,1-2H3,(H2,23,24,25,28)	ODQYVFLWNBEQBS-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NC(=NC(=Nc2cccc(C)c2)S)c3ccccc3	BroadT	BRD-K40594353	BRD-K40594353-001-05-1	Enamine Ltd.	T0400-0455			Cc1ccc(cc1)S(=O)(=O)NC(=NC(S)=Nc1cccc(C)c1)c1ccccc1	InChI=1S/C22H21N3O2S2/c1-16-11-13-20(14-12-16)29(26,27)25-21(18-8-4-3-5-9-18)24-22(28)23-19-10-6-7-17(2)15-19/h3-15H,1-2H3,(H2,23,24,25,28)	ODQYVFLWNBEQBS-UHFFFAOYSA-N	423.107518322							117233
AC1MHBAD	LSM-28683	SID3715457, BRD-A43443354	2999218	InChI=1S/C20H28N2O5/c1-15(2)18(21-20(25)27-13-16-9-5-3-6-10-16)19(24)26-14-17(23)22-11-7-4-8-12-22/h3,5-6,9-10,15,18H,4,7-8,11-14H2,1-2H3,(H,21,25)	NKIKANOKTSXHAQ-UHFFFAOYSA-N	CC(C)C(NC(=O)OCc1ccccc1)C(=O)OCC(=O)N2CCCCC2	BroadT	BRD-A43443354	BRD-A43443354-001-06-7	Enamine Ltd.	T0513-0221			CC(C)C(NC(=O)OCc1ccccc1)C(=O)OCC(=O)N1CCCCC1	InChI=1S/C20H28N2O5/c1-15(2)18(21-20(25)27-13-16-9-5-3-6-10-16)19(24)26-14-17(23)22-11-7-4-8-12-22/h3,5-6,9-10,15,18H,4,7-8,11-14H2,1-2H3,(H,21,25)	NKIKANOKTSXHAQ-UHFFFAOYSA-N	376.199822016							117234
SMR000184956	LSM-28684	SID17504647, SID87334928, BRD-K48670554	2835717	InChI=1S/C22H17N5O6/c1-13-5-4-6-15(9-13)23-21-18(26(30)31)10-14(11-19(21)27(32)33)22(29)25-12-20(28)24-16-7-2-3-8-17(16)25/h2-11,23H,12H2,1H3,(H,24,28)	TWYIZGPYZAVPMR-UHFFFAOYSA-N	Cc1cccc(Nc2c(cc(cc2[N+](=O)[O-])C(=O)N3CC(=O)Nc4ccccc34)[N+](=O)[O-])c1	BroadT	BRD-K48670554	BRD-K48670554-001-06-6	ChemBridge Corporation	5232772			Cc1cccc(Nc2c(cc(cc2[N+]([O-])=O)C(=O)N2CC(=O)Nc3ccccc23)[N+]([O-])=O)c1	InChI=1S/C22H17N5O6/c1-13-5-4-6-15(9-13)23-21-18(26(30)31)10-14(11-19(21)27(32)33)22(29)25-12-20(28)24-16-7-2-3-8-17(16)25/h2-11,23H,12H2,1H3,(H,24,28)	TWYIZGPYZAVPMR-UHFFFAOYSA-N	447.117883314							117235
SMR000206585	LSM-28685	SID17509593, BRD-K82234288	3591228	InChI=1S/C25H27N2O6P/c1-29-21-13-12-17(16-22(21)30-2)14-15-26-24-25(34(28,31-3)32-4)27-23(33-24)20-11-7-9-18-8-5-6-10-19(18)20/h5-13,16,26H,14-15H2,1-4H3	UNAWWFGIFCOCSS-UHFFFAOYSA-N	COc1ccc(CCNc2oc(nc2P(=O)(OC)OC)c3cccc4ccccc34)cc1OC	BroadT	BRD-K82234288	BRD-K82234288-001-05-3	ChemDiv Inc.	D055-0111			COc1ccc(CCNc2oc(nc2P(=O)(OC)OC)-c2cccc3ccccc23)cc1OC	InChI=1S/C25H27N2O6P/c1-29-21-13-12-17(16-22(21)30-2)14-15-26-24-25(34(28,31-3)32-4)27-23(33-24)20-11-7-9-18-8-5-6-10-19(18)20/h5-13,16,26H,14-15H2,1-4H3	UNAWWFGIFCOCSS-UHFFFAOYSA-N	482.160673114							117236
MLS000044572	LSM-28686	SID4251776, BRD-K32196020	3245419	InChI=1S/C20H21N3O5S/c1-14-17-12-16(29(25,26)23-8-10-27-11-9-23)5-6-18(17)28-19(14)20(24)22-13-15-4-2-3-7-21-15/h2-7,12H,8-11,13H2,1H3,(H,22,24)	FDQNSADLRWHHRQ-UHFFFAOYSA-N	Cc1c(oc2ccc(cc12)S(=O)(=O)N3CCOCC3)C(=O)NCc4ccccn4	BroadT	BRD-K32196020	BRD-K32196020-001-05-8	ChemDiv Inc.	C153-0566			Cc1c(oc2ccc(cc12)S(=O)(=O)N1CCOCC1)C(=O)NCc1ccccn1	InChI=1S/C20H21N3O5S/c1-14-17-12-16(29(25,26)23-8-10-27-11-9-23)5-6-18(17)28-19(14)20(24)22-13-15-4-2-3-7-21-15/h2-7,12H,8-11,13H2,1H3,(H,22,24)	FDQNSADLRWHHRQ-UHFFFAOYSA-N	415.120191492							117237
MLS000068181	LSM-28687	SID849736, BRD-A65650908	652242	InChI=1S/C19H22N4O2/c1-13-17-10-14(11-20-12-16-8-5-9-25-16)19(24)21-18(17)23(22-13)15-6-3-2-4-7-15/h2-4,6-7,10,16,20H,5,8-9,11-12H2,1H3,(H,21,24)	ARMAKTDXVGGRQV-UHFFFAOYSA-N	Cc1nn(c2ccccc2)c3nc(O)c(CNCC4CCCO4)cc13	BroadT	BRD-A65650908	BRD-A65650908-001-05-3	Asinex Ltd.	ASN 09984106			Cc1nn(-c2ccccc2)c2nc(O)c(CNCC3CCCO3)cc12	InChI=1S/C19H22N4O2/c1-13-17-10-14(11-20-12-16-8-5-9-25-16)19(24)21-18(17)23(22-13)15-6-3-2-4-7-15/h2-4,6-7,10,16,20H,5,8-9,11-12H2,1H3,(H,21,24)	ARMAKTDXVGGRQV-UHFFFAOYSA-N	338.174275984							
T5336580	LSM-28688	SID24828451, BRD-A87588358	4839996	InChI=1S/C17H27N3O2S/c1-4-20(17(23)18-10-7-11-19(2)3)12-14-13-21-15-8-5-6-9-16(15)22-14/h5-6,8-9,14H,4,7,10-13H2,1-3H3,(H,18,23)	PRDJXTKRRPZPCN-UHFFFAOYSA-N	CCN(CC1COc2ccccc2O1)C(=NCCCN(C)C)S	BroadT	BRD-A87588358	BRD-A87588358-001-06-2	Enamine Ltd.	T5336580			CCN(CC1COc2ccccc2O1)C(S)=NCCCN(C)C	InChI=1S/C17H27N3O2S/c1-4-20(17(23)18-10-7-11-19(2)3)12-14-13-21-15-8-5-6-9-16(15)22-14/h5-6,8-9,14H,4,7,10-13H2,1-3H3,(H,18,23)	PRDJXTKRRPZPCN-UHFFFAOYSA-N	337.182397824							117239
MLS001236176	LSM-28689	SID51090410, BRD-A63369517	16614183	InChI=1S/C18H18FN5O2S/c19-12-3-5-13(6-4-12)24-17-15(9-23-24)18(22-11-21-17)27-10-16(25)20-8-14-2-1-7-26-14/h3-6,9,11,14H,1-2,7-8,10H2,(H,20,25)	ABDLIIONBBQBGV-UHFFFAOYSA-N	Fc1ccc(cc1)n2ncc3c(SCC(=O)NCC4CCCO4)ncnc23	BroadT	BRD-A63369517	BRD-A63369517-001-06-3	Life Chemicals Inc.	F1874-0523			Fc1ccc(cc1)-n1ncc2c(SCC(=O)NCC3CCCO3)ncnc12	InChI=1S/C18H18FN5O2S/c19-12-3-5-13(6-4-12)24-17-15(9-23-24)18(22-11-21-17)27-10-16(25)20-8-14-2-1-7-26-14/h3-6,9,11,14H,1-2,7-8,10H2,(H,20,25)	ABDLIIONBBQBGV-UHFFFAOYSA-N	387.116523756							117240
MLS001183497	LSM-44294	SID47200481, BRD-K08453351	5873671	InChI=1S/C14H10O4/c15-10-11-3-1-4-13(9-11)18-14(16)7-6-12-5-2-8-17-12/h1-10H/b7-6+	YPZQOGXDABJTKM-VOTSOKGWSA-N	O=Cc1cccc(OC(=O)\C=C\c2occc2)c1	BroadT	BRD-K08453351	BRD-K08453351-001-05-2	Vitas-M Laboratory Ltd.	STK060478			O=Cc1cccc(OC(=O)\C=C\c2ccco2)c1	InChI=1S/C14H10O4/c15-10-11-3-1-4-13(9-11)18-14(16)7-6-12-5-2-8-17-12/h1-10H/b7-6+	YPZQOGXDABJTKM-VOTSOKGWSA-N	242.0579088							
MLS000393643	LSM-28691	SID22406208, BRD-K39066704	4010113	InChI=1S/C23H19N3O4S/c1-30-22-12-5-4-11-20(22)26-31(28,29)18-9-6-8-17(15-18)24-23(27)21-14-13-16-7-2-3-10-19(16)25-21/h2-15,26H,1H3,(H,24,27)	QEXWIBSUYZXMOH-UHFFFAOYSA-N	COc1ccccc1NS(=O)(=O)c2cccc(NC(=O)c3ccc4ccccc4n3)c2	BroadT	BRD-K39066704	BRD-K39066704-001-05-9	Enamine Ltd.	T5253127			COc1ccccc1NS(=O)(=O)c1cccc(NC(=O)c2ccc3ccccc3n2)c1	InChI=1S/C23H19N3O4S/c1-30-22-12-5-4-11-20(22)26-31(28,29)18-9-6-8-17(15-18)24-23(27)21-14-13-16-7-2-3-10-19(16)25-21/h2-15,26H,1H3,(H,24,27)	QEXWIBSUYZXMOH-UHFFFAOYSA-N	433.109626808							117242
SMR000094186	LSM-28692	SID7965363, BRD-K12881705	5307579	InChI=1S/C21H23FN4O3S/c1-3-29-21(28)26-10-8-13(9-11-26)23-19(27)17-12-15-18(24-25(2)20(15)30-17)14-6-4-5-7-16(14)22/h4-7,12-13H,3,8-11H2,1-2H3,(H,23,27)	DENJRKKPNKSZDF-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)NC(=O)c2cc3c(nn(C)c3s2)c4ccccc4F	BroadT	BRD-K12881705	BRD-K12881705-001-06-9	ChemDiv Inc.	C498-0896			CCOC(=O)N1CCC(CC1)NC(=O)c1cc2c(nn(C)c2s1)-c1ccccc1F	InChI=1S/C21H23FN4O3S/c1-3-29-21(28)26-10-8-13(9-11-26)23-19(27)17-12-15-18(24-25(2)20(15)30-17)14-6-4-5-7-16(14)22/h4-7,12-13H,3,8-11H2,1-2H3,(H,23,27)	DENJRKKPNKSZDF-UHFFFAOYSA-N	430.147489526							117243
MLS000680222	LSM-28693	SID24784660, BRD-K35780847	2155586	InChI=1S/C18H18N4O4S/c1-3-16-20-21-18(26-16)19-17(23)13-9-11-15(12-10-13)27(24,25)22(2)14-7-5-4-6-8-14/h4-12H,3H2,1-2H3,(H,19,21,23)	JYSMMOUAALMTBV-UHFFFAOYSA-N	CCc1oc(NC(=O)c2ccc(cc2)S(=O)(=O)N(C)c3ccccc3)nn1	BroadT	BRD-K35780847	BRD-K35780847-001-07-3	Life Chemicals Inc.	F0593-0033			CCc1nnc(NC(=O)c2ccc(cc2)S(=O)(=O)N(C)c2ccccc2)o1	InChI=1S/C18H18N4O4S/c1-3-16-20-21-18(26-16)19-17(23)13-9-11-15(12-10-13)27(24,25)22(2)14-7-5-4-6-8-14/h4-12H,3H2,1-2H3,(H,19,21,23)	JYSMMOUAALMTBV-UHFFFAOYSA-N	386.104875786							117244
MLS001007821	LSM-28694	SID24828198, BRD-K36571191	2561213	InChI=1S/C16H21NO3/c1-10(2)7-8-17-16(18)15-11(3)13-9-12(19-4)5-6-14(13)20-15/h5-6,9-10H,7-8H2,1-4H3,(H,17,18)	FYTJXQIQFWPZMS-UHFFFAOYSA-N	COc1ccc2oc(C(=O)NCCC(C)C)c(C)c2c1	BroadT	BRD-K36571191	BRD-K36571191-001-06-9	Enamine Ltd.	T5301683			COc1ccc2oc(C(=O)NCCC(C)C)c(C)c2c1	InChI=1S/C16H21NO3/c1-10(2)7-8-17-16(18)15-11(3)13-9-12(19-4)5-6-14(13)20-15/h5-6,9-10H,7-8H2,1-4H3,(H,17,18)	FYTJXQIQFWPZMS-UHFFFAOYSA-N	275.152143542							117245
[5-(3-Dimethylamino-phenyl)-[1,3,4]thiadiazol-2-yl]-methyl-amine	LSM-28695	SID845351, BRD-K03462038	647694	InChI=1S/C11H14N4S/c1-12-11-14-13-10(16-11)8-5-4-6-9(7-8)15(2)3/h4-7H,1-3H3,(H,12,14)	ZFBFXUMZDWANJB-UHFFFAOYSA-N	CNc1nnc(s1)c2cccc(c2)N(C)C	BroadT	BRD-K03462038	BRD-K03462038-001-06-7	Asinex Ltd.	ASN 09858872			CNc1nnc(s1)-c1cccc(c1)N(C)C	InChI=1S/C11H14N4S/c1-12-11-14-13-10(16-11)8-5-4-6-9(7-8)15(2)3/h4-7H,1-3H3,(H,12,14)	ZFBFXUMZDWANJB-UHFFFAOYSA-N	234.093917178							117246
T5330985	LSM-28696	SID24827529, BRD-K81447963	2594907	InChI=1S/C21H25N5OS/c1-5-16-17(6-1)28-21-18(16)20(23-8-3-9-26-10-12-27-13-11-26)24-19(25-21)15-4-2-7-22-14-15/h2,4,7,14H,1,3,5-6,8-13H2,(H,23,24,25)	ULZHKRNCZPNKDI-UHFFFAOYSA-N	C(CNc1nc(nc2sc3CCCc3c12)c4cccnc4)CN5CCOCC5	BroadT	BRD-K81447963	BRD-K81447963-001-06-2	Enamine Ltd.	T5330985			C(CNc1nc(nc2sc3CCCc3c12)-c1cccnc1)CN1CCOCC1	InChI=1S/C21H25N5OS/c1-5-16-17(6-1)28-21-18(16)20(23-8-3-9-26-10-12-27-13-11-26)24-19(25-21)15-4-2-7-22-14-15/h2,4,7,14H,1,3,5-6,8-13H2,(H,23,24,25)	ULZHKRNCZPNKDI-UHFFFAOYSA-N	395.17798116							117247
2-(4-Methylphenyl)-1,3-thiazolane	LSM-28697	SID24815553, BRD-A40662416	2771069	InChI=1S/C10H13NS/c1-8-2-4-9(5-3-8)10-11-6-7-12-10/h2-5,10-11H,6-7H2,1H3	NLKGQUAQKCOAHV-UHFFFAOYSA-N	Cc1ccc(cc1)C2NCCS2	BroadT	BRD-A40662416	BRD-A40662416-001-06-1	Life Chemicals Inc.	F1912-0010			Cc1ccc(cc1)C1NCCS1	InChI=1S/C10H13NS/c1-8-2-4-9(5-3-8)10-11-6-7-12-10/h2-5,10-11H,6-7H2,1H3	NLKGQUAQKCOAHV-UHFFFAOYSA-N	179.076870116							117248
4-Chloro-n-(4-chlorobenzyl)-5-nitro-1H-pyrazole-3-carboxamide	LSM-28698	SID24781701, BRD-K52580889	3620613	InChI=1S/C11H8Cl2N4O3/c12-7-3-1-6(2-4-7)5-14-11(18)9-8(13)10(16-15-9)17(19)20/h1-4H,5H2,(H,14,18)(H,15,16)	APWLSOMMVQHYQM-UHFFFAOYSA-N	[O-][N+](=O)c1[nH]nc(C(=O)NCc2ccc(Cl)cc2)c1Cl	BroadT	BRD-K52580889	BRD-K52580889-001-06-6	Specs	AK-968/40707498			[O-][N+](=O)c1[nH]nc(C(=O)NCc2ccc(Cl)cc2)c1Cl	InChI=1S/C11H8Cl2N4O3/c12-7-3-1-6(2-4-7)5-14-11(18)9-8(13)10(16-15-9)17(19)20/h1-4H,5H2,(H,14,18)(H,15,16)	APWLSOMMVQHYQM-UHFFFAOYSA-N	313.997345576							117249
AMBCB94817059	LSM-28699	SID24799117, BRD-A72144034	16190788	InChI=1S/C21H32N2O3/c1-26-21(25)18-9-7-17(8-10-18)15-22-12-13-23(20(16-22)11-14-24)19-5-3-2-4-6-19/h7-10,19-20,24H,2-6,11-16H2,1H3	RUZGXZYPKSIOKL-UHFFFAOYSA-N	COC(=O)c1ccc(CN2CCN(C(CCO)C2)C3CCCCC3)cc1	BroadT	BRD-A72144034	BRD-A72144034-001-06-3	ChemBridge Corporation	94817059			COC(=O)c1ccc(CN2CCN(C(CCO)C2)C2CCCCC2)cc1	InChI=1S/C21H32N2O3/c1-26-21(25)18-9-7-17(8-10-18)15-22-12-13-23(20(16-22)11-14-24)19-5-3-2-4-6-19/h7-10,19-20,24H,2-6,11-16H2,1H3	RUZGXZYPKSIOKL-UHFFFAOYSA-N	360.241292904							117250
T0520-4919	LSM-28700	SID49724861, BRD-K47310416	4218869	InChI=1S/C20H32N2O/c1-2-3-4-8-13-21-17-20(23)22-14-11-19(12-15-22)16-18-9-6-5-7-10-18/h5-7,9-10,19,21H,2-4,8,11-17H2,1H3	DCQWIQZESRZBCZ-UHFFFAOYSA-N	CCCCCCNCC(=O)N1CCC(Cc2ccccc2)CC1	BroadT	BRD-K47310416	BRD-K47310416-001-05-0	Enamine Ltd.	T0520-4919			CCCCCCNCC(=O)N1CCC(Cc2ccccc2)CC1	InChI=1S/C20H32N2O/c1-2-3-4-8-13-21-17-20(23)22-14-11-19(12-15-22)16-18-9-6-5-7-10-18/h5-7,9-10,19,21H,2-4,8,11-17H2,1H3	DCQWIQZESRZBCZ-UHFFFAOYSA-N	316.251463664							117251
1-[2-(2-Chlorophenoxy)ethoxy]-2-methoxy-4-methylbenzene	LSM-28701	SID17411901, BRD-K10629785	2282834	InChI=1S/C16H17ClO3/c1-12-7-8-15(16(11-12)18-2)20-10-9-19-14-6-4-3-5-13(14)17/h3-8,11H,9-10H2,1-2H3	ADOQAMSUXMQJHL-UHFFFAOYSA-N	COc1cc(C)ccc1OCCOc2ccccc2Cl	BroadT	BRD-K10629785	BRD-K10629785-001-06-7	ChemBridge Corporation	6436155			COc1cc(C)ccc1OCCOc1ccccc1Cl	InChI=1S/C16H17ClO3/c1-12-7-8-15(16(11-12)18-2)20-10-9-19-14-6-4-3-5-13(14)17/h3-8,11H,9-10H2,1-2H3	ADOQAMSUXMQJHL-UHFFFAOYSA-N	292.086622114							117252
SMR000121354	LSM-28702	SID14726763, BRD-A35687268	2886431	InChI=1S/C14H13N3O3/c1-8(18)16-14-15-7-10-11(17-14)5-9(6-12(10)19)13-3-2-4-20-13/h2-4,7,9H,5-6H2,1H3,(H,15,16,17,18)	MCGDILBNDMXNQR-UHFFFAOYSA-N	CC(=O)Nc1ncc2C(=O)CC(Cc2n1)c3occc3	BroadT	BRD-A35687268	BRD-A35687268-001-06-4	Asinex Ltd.	BAS 02101913			CC(=O)Nc1ncc2C(=O)CC(Cc2n1)c1ccco1	InChI=1S/C14H13N3O3/c1-8(18)16-14-15-7-10-11(17-14)5-9(6-12(10)19)13-3-2-4-20-13/h2-4,7,9H,5-6H2,1H3,(H,15,16,17,18)	MCGDILBNDMXNQR-UHFFFAOYSA-N	271.095691306							117253
1-(4-Fluorophenyl)-3-hydroxy-6,6-dimethyl-3-(trifluoromethyl)-3,5,6,7-tetrahydro-1H-indole-2,4-dione	LSM-28703	SID17416288, BRD-A39647267	2962073	InChI=1S/C17H15F4NO3/c1-15(2)7-11-13(12(23)8-15)16(25,17(19,20)21)14(24)22(11)10-5-3-9(18)4-6-10/h3-6,25H,7-8H2,1-2H3	ZHARTMFQCHWLBD-UHFFFAOYSA-N	CC1(C)CC(=O)C2=C(C1)N(C(=O)C2(O)C(F)(F)F)c3ccc(F)cc3	BroadT	BRD-A39647267	BRD-A39647267-001-05-7	ChemBridge Corporation	7904739			CC1(C)CC2=C(C(=O)C1)C(O)(C(=O)N2c1ccc(F)cc1)C(F)(F)F	InChI=1S/C17H15F4NO3/c1-15(2)7-11-13(12(23)8-15)16(25,17(19,20)21)14(24)22(11)10-5-3-9(18)4-6-10/h3-6,25H,7-8H2,1-2H3	ZHARTMFQCHWLBD-UHFFFAOYSA-N	357.09880615							117254
2-(2,6-Dichlorobenzyl)-6-phenyl-5-piperidino-3(2H)-pyridazinone	LSM-28704	SID17409763, BRD-K97802859	3815334	InChI=1S/C22H21Cl2N3O/c23-18-10-7-11-19(24)17(18)15-27-21(28)14-20(26-12-5-2-6-13-26)22(25-27)16-8-3-1-4-9-16/h1,3-4,7-11,14H,2,5-6,12-13,15H2	BWXJBWLAHJFDHA-UHFFFAOYSA-N	Clc1cccc(Cl)c1CN2N=C(C(=CC2=O)N3CCCCC3)c4ccccc4	BroadT	BRD-K97802859	BRD-K97802859-001-08-3	Key Organics Ltd.	2R-1072			Clc1cccc(Cl)c1Cn1nc(-c2ccccc2)c(cc1=O)N1CCCCC1	InChI=1S/C22H21Cl2N3O/c23-18-10-7-11-19(24)17(18)15-27-21(28)14-20(26-12-5-2-6-13-26)22(25-27)16-8-3-1-4-9-16/h1,3-4,7-11,14H,2,5-6,12-13,15H2	BWXJBWLAHJFDHA-UHFFFAOYSA-N	413.106167742							117255
2,2-Dimethyl-n-(4-pyridinyl)-2,3-dihydro-1-benzofuran-7-carboxamide	LSM-28705	SID26730995, BRD-K72154405	2738397	InChI=1S/C16H16N2O2/c1-16(2)10-11-4-3-5-13(14(11)20-16)15(19)18-12-6-8-17-9-7-12/h3-9H,10H2,1-2H3,(H,17,18,19)	KLQXWCKMMSVBEF-UHFFFAOYSA-N	CC1(C)Cc2cccc(C(=O)Nc3ccncc3)c2O1	BroadT	BRD-K72154405	BRD-K72154405-001-06-1	Maybridge	SCR 00501			O=C(Nc1ccncc1)c1cccc2CC(C)(C)Oc12	InChI=1S/C16H16N2O2/c1-16(2)10-11-4-3-5-13(14(11)20-16)15(19)18-12-6-8-17-9-7-12/h3-9H,10H2,1-2H3,(H,17,18,19)	KLQXWCKMMSVBEF-UHFFFAOYSA-N	268.121177772							117256
AC1LSKV7	LSM-28706	BRD-K02567745	1489614	InChI=1S/C12H15N3O/c1-9-5-2-3-6-10(9)14-15-11-7-4-8-13-12(11)16/h2-3,5-6,14H,4,7-8H2,1H3,(H,13,16)	IDMYZZXLGGLCOS-UHFFFAOYSA-N	Cc1ccccc1NN=C2CCCNC2=O	BroadT	BRD-K02567745	BRD-K02567745-001-05-0	Key Organics Ltd.	1L-925			Cc1ccccc1NN=C1CCCNC1=O	InChI=1S/C12H15N3O/c1-9-5-2-3-6-10(9)14-15-11-7-4-8-13-12(11)16/h2-3,5-6,14H,4,7-8H2,1H3,(H,13,16)	IDMYZZXLGGLCOS-UHFFFAOYSA-N	217.12151213							117257
MLS000375001	LSM-28707	SID22406110, BRD-K37338663	1584915	InChI=1S/C16H20N2OS2/c1-4-18(5-2)16(20)21-10-14(19)15-11(3)17-13-9-7-6-8-12(13)15/h6-9,17H,4-5,10H2,1-3H3	DEKNGTYNYQKWRH-UHFFFAOYSA-N	CCN(CC)C(=S)SCC(=O)c1c(C)[nH]c2ccccc12	BroadT	BRD-K37338663	BRD-K37338663-001-05-3	Enamine Ltd.	T0502-1910			CCN(CC)C(=S)SCC(=O)c1c(C)[nH]c2ccccc12	InChI=1S/C16H20N2OS2/c1-4-18(5-2)16(20)21-10-14(19)15-11(3)17-13-9-7-6-8-12(13)15/h6-9,17H,4-5,10H2,1-3H3	DEKNGTYNYQKWRH-UHFFFAOYSA-N	320.10170466							117258
3-Methyl-1,5-di(thiophen-2-yl)pentane-1,5-dione	LSM-28708	SID7975437, BRD-K90936880	1355283	InChI=1S/C14H14O2S2/c1-10(8-11(15)13-4-2-6-17-13)9-12(16)14-5-3-7-18-14/h2-7,10H,8-9H2,1H3	DXRYURZGJQIDLW-UHFFFAOYSA-N	CC(CC(=O)c1cccs1)CC(=O)c2cccs2	BroadT	BRD-K90936880	BRD-K90936880-001-05-5	ChemBridge Corporation	5663332			CC(CC(=O)c1cccs1)CC(=O)c1cccs1	InChI=1S/C14H14O2S2/c1-10(8-11(15)13-4-2-6-17-13)9-12(16)14-5-3-7-18-14/h2-7,10H,8-9H2,1H3	DXRYURZGJQIDLW-UHFFFAOYSA-N	278.043521068							117259
1-P-tolyl-3-(4H-[1,2,4]triazol-3-ylsulfanyl)-pyrrolidine-2,5-dione	LSM-28709	SID14726735, BRD-A15740349	2878813	InChI=1S/C13H12N4O2S/c1-8-2-4-9(5-3-8)17-11(18)6-10(12(17)19)20-13-14-7-15-16-13/h2-5,7,10H,6H2,1H3,(H,14,15,16)	SAPBJHBAACSRFO-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=O)CC(Sc3nc[nH]n3)C2=O	BroadT	BRD-A15740349	BRD-A15740349-001-05-0	Asinex Ltd.	BAS 01306700			Cc1ccc(cc1)N1C(=O)CC(Sc2nc[nH]n2)C1=O	InChI=1S/C13H12N4O2S/c1-8-2-4-9(5-3-8)17-11(18)6-10(12(17)19)20-13-14-7-15-16-13/h2-5,7,10H,6H2,1H3,(H,14,15,16)	SAPBJHBAACSRFO-UHFFFAOYSA-N	288.068096354							117260
2-(3,5-Dimethyl-1H-pyrazol-1-yl)benzonitrile	LSM-28710	SID26728090, BRD-K42376891	2804987	InChI=1S/C12H11N3/c1-9-7-10(2)15(14-9)12-6-4-3-5-11(12)8-13/h3-7H,1-2H3	NLASKPKNIAXNMH-UHFFFAOYSA-N	Cc1cc(C)n(n1)c2ccccc2C#N	BroadT	BRD-K42376891	BRD-K42376891-001-05-0	Maybridge	CD 07945			Cc1cc(C)n(n1)-c1ccccc1C#N	InChI=1S/C12H11N3/c1-9-7-10(2)15(14-9)12-6-4-3-5-11(12)8-13/h3-7H,1-2H3	NLASKPKNIAXNMH-UHFFFAOYSA-N	197.095297382							117261
AC1LDJ7S	LSM-28711	BRD-K23389429	667997	InChI=1S/C17H19N3S/c1-3-16(14-9-5-4-6-10-14)19-20-17(21)18-15-11-7-8-13(2)12-15/h4-12H,3H2,1-2H3,(H2,18,20,21)	YXRSTZXRGIBZBD-UHFFFAOYSA-N	CCC(=NN=C(S)Nc1cccc(C)c1)c2ccccc2	BroadT	BRD-K23389429	BRD-K23389429-001-07-3	Asinex Ltd.	BAS 00484904			CCC(=NN=C(S)Nc1cccc(C)c1)c1ccccc1	InChI=1S/C17H19N3S/c1-3-16(14-9-5-4-6-10-14)19-20-17(21)18-15-11-7-8-13(2)12-15/h4-12H,3H2,1-2H3,(H2,18,20,21)	YXRSTZXRGIBZBD-UHFFFAOYSA-N	297.129968328							117262
STK259522	LSM-28712	SID4259293, BRD-K76141725	1618504	InChI=1S/C25H33N3O3/c1-4-5-18-31-23-12-6-20(7-13-23)24(29)26-21-8-10-22(11-9-21)27-14-16-28(17-15-27)25(30)19(2)3/h6-13,19H,4-5,14-18H2,1-3H3,(H,26,29)	CJSUZXXMBIPCBG-UHFFFAOYSA-N	CCCCOc1ccc(cc1)C(=O)Nc2ccc(cc2)N3CCN(CC3)C(=O)C(C)C	BroadT	BRD-K76141725	BRD-K76141725-001-05-9	ChemBridge Corporation	7721978			CCCCOc1ccc(cc1)C(=O)Nc1ccc(cc1)N1CCN(CC1)C(=O)C(C)C	InChI=1S/C25H33N3O3/c1-4-5-18-31-23-12-6-20(7-13-23)24(29)26-21-8-10-22(11-9-21)27-14-16-28(17-15-27)25(30)19(2)3/h6-13,19H,4-5,14-18H2,1-3H3,(H,26,29)	CJSUZXXMBIPCBG-UHFFFAOYSA-N	423.252191946							117263
SMR000156119	LSM-28713	SID17407207, BRD-K00742408	11958500	InChI=1S/C19H22N4O2S2/c1-11(2)8-16(24)23-19-20-12(3)17(27-19)15-10-26-18(22-15)21-13-6-5-7-14(9-13)25-4/h5-7,9-11H,8H2,1-4H3,(H,21,22)(H,20,23,24)	HPRDWUINIZYOTM-UHFFFAOYSA-N	COc1cccc(Nc2nc(cs2)c3sc(NC(=O)CC(C)C)nc3C)c1	BroadT	BRD-K00742408	BRD-K00742408-001-05-9	University of California at Davis	CLY_Corr_G07			COc1cccc(Nc2nc(cs2)-c2sc(NC(=O)CC(C)C)nc2C)c1	InChI=1S/C19H22N4O2S2/c1-11(2)8-16(24)23-19-20-12(3)17(27-19)15-10-26-18(22-15)21-13-6-5-7-14(9-13)25-4/h5-7,9-11H,8H2,1-4H3,(H,21,22)(H,20,23,24)	HPRDWUINIZYOTM-UHFFFAOYSA-N	402.118417364							117264
N-(2-Quinolinyl)cyclohexanecarboxamide	LSM-28714	SID26730286, BRD-K53213090	2812969	InChI=1S/C16H18N2O/c19-16(13-7-2-1-3-8-13)18-15-11-10-12-6-4-5-9-14(12)17-15/h4-6,9-11,13H,1-3,7-8H2,(H,17,18,19)	DHFLYUQFYGRMEU-UHFFFAOYSA-N	O=C(Nc1ccc2ccccc2n1)C3CCCCC3	BroadT	BRD-K53213090	BRD-K53213090-001-04-3	Maybridge	HTS 06284			O=C(Nc1ccc2ccccc2n1)C1CCCCC1	InChI=1S/C16H18N2O/c19-16(13-7-2-1-3-8-13)18-15-11-10-12-6-4-5-9-14(12)17-15/h4-6,9-11,13H,1-3,7-8H2,(H,17,18,19)	DHFLYUQFYGRMEU-UHFFFAOYSA-N	254.141913216							117265
MLS000034383	LSM-28715	SID26668711, SID848610, BRD-K07485038	651065	InChI=1S/C21H21BrN2O4/c1-2-28-18-7-8-19-15(12-18)11-16(20(26)23-19)13-24(9-10-25)21(27)14-3-5-17(22)6-4-14/h3-8,11-12,25H,2,9-10,13H2,1H3,(H,23,26)	DYYYWXDVHHFXJA-UHFFFAOYSA-N	CCOc1ccc2nc(O)c(CN(CCO)C(=O)c3ccc(Br)cc3)cc2c1	BroadT	BRD-K07485038	BRD-K07485038-001-05-6	Asinex Ltd.	ASN 05108131			CCOc1ccc2nc(O)c(CN(CCO)C(=O)c3ccc(Br)cc3)cc2c1	InChI=1S/C21H21BrN2O4/c1-2-28-18-7-8-19-15(12-18)11-16(20(26)23-19)13-24(9-10-25)21(27)14-3-5-17(22)6-4-14/h3-8,11-12,25H,2,9-10,13H2,1H3,(H,23,26)	DYYYWXDVHHFXJA-UHFFFAOYSA-N	444.068469772							117266
ST50851765	LSM-28716	SID49828174, BRD-K02745204	970866	InChI=1S/C16H22N2O3/c1-2-21-15(19)13-7-9-14(10-8-13)17-16(20)18-11-5-3-4-6-12-18/h7-10H,2-6,11-12H2,1H3,(H,17,20)	MRDBXIHGMCDHLT-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)N2CCCCCC2)cc1	BroadT	BRD-K02745204	BRD-K02745204-001-05-6	Chemical Technologies & Investigations	UZI/1638066			CCOC(=O)c1ccc(NC(=O)N2CCCCCC2)cc1	InChI=1S/C16H22N2O3/c1-2-21-15(19)13-7-9-14(10-8-13)17-16(20)18-11-5-3-4-6-12-18/h7-10H,2-6,11-12H2,1H3,(H,17,20)	MRDBXIHGMCDHLT-UHFFFAOYSA-N	290.163042584							117267
MLS000771752	LSM-28717	SID24832814, BRD-A86600680	4391932	InChI=1S/C17H20ClN3S/c1-21(2)16(13-7-4-3-5-8-13)12-19-17(22)20-15-10-6-9-14(18)11-15/h3-11,16H,12H2,1-2H3,(H2,19,20,22)	WPWDZSOOCOBLJC-UHFFFAOYSA-N	CN(C)C(CN=C(S)Nc1cccc(Cl)c1)c2ccccc2	BroadT	BRD-A86600680	BRD-A86600680-001-05-7	Enamine Ltd.	T5238383			CN(C)C(CN=C(S)Nc1cccc(Cl)c1)c1ccccc1	InChI=1S/C17H20ClN3S/c1-21(2)16(13-7-4-3-5-8-13)12-19-17(22)20-15-10-6-9-14(18)11-15/h3-11,16H,12H2,1-2H3,(H2,19,20,22)	WPWDZSOOCOBLJC-UHFFFAOYSA-N	333.10664607							117268
SMR000170940	LSM-28718	SID17507271, BRD-A82307057	3184521	InChI=1S/C25H31N3O3S/c1-5-17(2)26-25(32)28(12-11-18-9-7-6-8-10-18)16-20-13-19-14-22(30-3)23(31-4)15-21(19)27-24(20)29/h6-10,13-15,17H,5,11-12,16H2,1-4H3,(H,26,32)(H,27,29)	YAZOIIMRVUPEOT-UHFFFAOYSA-N	CCC(C)N=C(S)N(CCc1ccccc1)Cc2cc3cc(OC)c(OC)cc3nc2O	BroadT	BRD-A82307057	BRD-A82307057-001-05-8	Asinex Ltd.	ASN 04259216			CCC(C)N=C(S)N(CCc1ccccc1)Cc1cc2cc(OC)c(OC)cc2nc1O	InChI=1S/C25H31N3O3S/c1-5-17(2)26-25(32)28(12-11-18-9-7-6-8-10-18)16-20-13-19-14-22(30-3)23(31-4)15-21(19)27-24(20)29/h6-10,13-15,17H,5,11-12,16H2,1-4H3,(H,26,32)(H,27,29)	YAZOIIMRVUPEOT-UHFFFAOYSA-N	453.208612572							117269
MLS000540803	LSM-28719	SID17385869, BRD-K34019417	11839061	InChI=1S/C22H26N2O5S/c1-14-7-12-20(15(2)13-14)24-30(28,29)17-10-8-16(9-11-17)23-21(25)18-5-3-4-6-19(18)22(26)27/h7-13,18-19,24H,3-6H2,1-2H3,(H,23,25)(H,26,27)/t18-,19+/m1/s1	BLKPOIYAWPEWFU-MOPGFXCFSA-N	Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)[C@@H]3CCCC[C@@H]3C(=O)O)cc2)c(C)c1	BroadT	BRD-K34019417	BRD-K34019417-001-05-1	Specs	AN-329/41402699			Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)[C@@H]3CCCC[C@@H]3C(O)=O)cc2)c(C)c1	InChI=1S/C22H26N2O5S/c1-14-7-12-20(15(2)13-14)24-30(28,29)17-10-8-16(9-11-17)23-21(25)18-5-3-4-6-19(18)22(26)27/h7-13,18-19,24H,3-6H2,1-2H3,(H,23,25)(H,26,27)/t18-,19+/m1/s1	BLKPOIYAWPEWFU-MOPGFXCFSA-N	430.156242642							117270
MLS000093275	LSM-28720	SID4249338, BRD-K18388078	3243304	InChI=1S/C21H22ClN7/c22-16-4-3-5-17(14-16)28-12-10-27(11-13-28)9-8-23-20-21-26-24-15-29(21)19-7-2-1-6-18(19)25-20/h1-7,14-15H,8-13H2,(H,23,25)	QRXATNXWXUVPJZ-UHFFFAOYSA-N	Clc1cccc(c1)N2CCN(CCNc3nc4ccccc4n5cnnc35)CC2	BroadT	BRD-K18388078	BRD-K18388078-001-05-0	ChemDiv Inc.	C735-0175			Clc1cccc(c1)N1CCN(CCNc2nc3ccccc3n3cnnc23)CC1	InChI=1S/C21H22ClN7/c22-16-4-3-5-17(14-16)28-12-10-27(11-13-28)9-8-23-20-21-26-24-15-29(21)19-7-2-1-6-18(19)25-20/h1-7,14-15H,8-13H2,(H,23,25)	QRXATNXWXUVPJZ-UHFFFAOYSA-N	407.162521484							117271
BRD-K13782363	LSM-28721		54647679	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26+,28-/m0/s1	GERXZWRQFCUSQI-IXMDGTTKSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)NCc5cccc(F)c5)C[C@@H]4c3c2	BroadT	BRD-K13782363	BRD-K13782363-001-01-2	Broad Institute of MIT and Harvard	BRD-K13782363			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cccc(F)c4)O[C@@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26+,28-/m0/s1	GERXZWRQFCUSQI-IXMDGTTKSA-N	556.167950178							117272
BRD-K78347804	LSM-28722		54647688	InChI=1S/C23H27ClN2O4/c1-26(2)16-7-8-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-3-5-15(24)6-4-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19-,21+,23+/m0/s1	MOQWXNTXFGVTQQ-VARILPKDSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(Cl)cc4)C[C@H]3c2c1	BroadT	BRD-K78347804	BRD-K78347804-001-01-3	Broad Institute of MIT and Harvard	BRD-K78347804			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C23H27ClN2O4/c1-26(2)16-7-8-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-3-5-15(24)6-4-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19-,21+,23+/m0/s1	MOQWXNTXFGVTQQ-VARILPKDSA-N	430.165935074							117273
BRD-K91962463	LSM-28723		54647640	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25-,27+,30+/m0/s1	GRQDGDFBWRYOPG-VPCZVLKOSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@H]3c2c1	BroadT	BRD-K91962463	BRD-K91962463-001-01-4	Broad Institute of MIT and Harvard	BRD-K91962463			COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](C[C@H]3c2c1)CC(=O)NCc1ccc(cc1)-c1ccccc1	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25-,27+,30+/m0/s1	GRQDGDFBWRYOPG-VPCZVLKOSA-N	516.226036764							117274
BRD-K73183447	LSM-28724		54647645	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21+,23+,26-/m1/s1	UPMRBEOCYVNRMT-HMMJVGNDSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K73183447	BRD-K73183447-001-01-0	Broad Institute of MIT and Harvard	BRD-K73183447			COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@H](CO)O2)cc1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21+,23+,26-/m1/s1	UPMRBEOCYVNRMT-HMMJVGNDSA-N	483.236935806							117275
BRD-K47160864	LSM-28725		54647571	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29+,32-/m1/s1	NKIFYSADZLZERH-UYEWBUFNSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@@H]4[C@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K47160864	BRD-K47160864-001-01-5	Broad Institute of MIT and Harvard	BRD-K47160864			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29+,32-/m1/s1	NKIFYSADZLZERH-UYEWBUFNSA-N	526.246772208							117276
BRD-K44797874	LSM-28726		54647546	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13-,15-,17+/m0/s1	ILXKPNUBZXTBRO-MOWSHJCCSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K44797874	BRD-K44797874-001-01-5	Broad Institute of MIT and Harvard	BRD-K44797874			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13-,15-,17+/m0/s1	ILXKPNUBZXTBRO-MOWSHJCCSA-N	384.135507198							117277
BRD-K48102350	LSM-28727		54647481	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20+,23+,26-/m1/s1	UWAUWNPQHFTMFN-JJYQKYQYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K48102350	BRD-K48102350-001-01-7	Broad Institute of MIT and Harvard	BRD-K48102350			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20+,23+,26-/m1/s1	UWAUWNPQHFTMFN-JJYQKYQYSA-N	486.196628416							117278
BRD-K86792405	LSM-28728		54647426	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22+,24+,26-/m0/s1	GOWTXMJXNJEOKH-RXDHMRHRSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K86792405	BRD-K86792405-001-01-3	Broad Institute of MIT and Harvard	BRD-K86792405			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22+,24+,26-/m0/s1	GOWTXMJXNJEOKH-RXDHMRHRSA-N	500.29987042							117279
BRD-K81501934	LSM-28729		54647447	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26+,28+/m1/s1	CZQHDZKSVGPVAK-OEZGUAFWSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K81501934	BRD-K81501934-001-01-3	Broad Institute of MIT and Harvard	BRD-K81501934			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26+,28+/m1/s1	CZQHDZKSVGPVAK-OEZGUAFWSA-N	550.150678934							117280
BRD-K64509887	LSM-28730		54647575	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27-,29+,32+/m1/s1	NKIFYSADZLZERH-TUAUZHGTSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@H]4[C@@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K64509887	BRD-K64509887-001-01-4	Broad Institute of MIT and Harvard	BRD-K64509887			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27-,29+,32+/m1/s1	NKIFYSADZLZERH-TUAUZHGTSA-N	526.246772208							117281
BRD-K54453373	LSM-28731		54647431	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22-,24+,26+/m1/s1	GOWTXMJXNJEOKH-GUAAGHCTSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K54453373	BRD-K54453373-001-01-8	Broad Institute of MIT and Harvard	BRD-K54453373			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22-,24+,26+/m1/s1	GOWTXMJXNJEOKH-GUAAGHCTSA-N	500.29987042							117282
BRD-K01351858	LSM-28732		54647524	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22-,25+/m1/s1	AANFNNZNKVIOFO-HWZPKBPFSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4cccc(F)c4)C[C@@H]3c2c1	BroadT	BRD-K01351858	BRD-K01351858-001-01-2	Broad Institute of MIT and Harvard	BRD-K01351858			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cccc(F)c4)O[C@@H]3CO)c2c1	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22-,25+/m1/s1	AANFNNZNKVIOFO-HWZPKBPFSA-N	471.21694929							117283
BRD-K36003376	LSM-28733		54647644	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21+,23+,26-/m0/s1	UPMRBEOCYVNRMT-RLCNXLTRSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K36003376	BRD-K36003376-001-01-1	Broad Institute of MIT and Harvard	BRD-K36003376			COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@@H](CO)O2)cc1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21+,23+,26-/m0/s1	UPMRBEOCYVNRMT-RLCNXLTRSA-N	483.236935806							117284
BRD-K28698418	LSM-28734		54647442	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26+,28-/m0/s1	CZQHDZKSVGPVAK-PJDAHJOFSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K28698418	BRD-K28698418-001-01-8	Broad Institute of MIT and Harvard	BRD-K28698418			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26+,28-/m0/s1	CZQHDZKSVGPVAK-PJDAHJOFSA-N	550.150678934							117285
BRD-K12312755	LSM-28735		54647620	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15-,19+,21+/m1/s1	FNDPGVQZUOXHHT-WAXPWZKESA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K12312755	BRD-K12312755-001-01-5	Broad Institute of MIT and Harvard	BRD-K12312755			OC[C@@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15-,19+,21+/m1/s1	FNDPGVQZUOXHHT-WAXPWZKESA-N	427.126716642							117286
BRD-K67430561	LSM-28736		54647410	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20+,22+,25-/m0/s1	IZLHCVQHHLSMHG-PMTIONAUSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K67430561	BRD-K67430561-001-01-3	Broad Institute of MIT and Harvard	BRD-K67430561			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20+,22+,25-/m0/s1	IZLHCVQHHLSMHG-PMTIONAUSA-N	442.246772208							117287
BRD-K20951097	LSM-28737		54647693	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15+,17-,20-/m1/s1	PIWWRJKYNWMMLJ-YBLQJDFOSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K20951097	BRD-K20951097-001-01-7	Broad Institute of MIT and Harvard	BRD-K20951097			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15+,17-,20-/m1/s1	PIWWRJKYNWMMLJ-YBLQJDFOSA-N	442.17155652							117288
BRD-K11782435	LSM-28738		54647586	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21+,23-,26-/m1/s1	OSBPWUGUGZAKLO-YDOBTQPPSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K11782435	BRD-K11782435-001-01-8	Broad Institute of MIT and Harvard	BRD-K11782435			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21+,23-,26-/m1/s1	OSBPWUGUGZAKLO-YDOBTQPPSA-N	471.273321314							117289
BRD-K41814083	LSM-28739		54647649	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21-,23+,26+/m1/s1	UPMRBEOCYVNRMT-BCHMZHATSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K41814083	BRD-K41814083-001-01-8	Broad Institute of MIT and Harvard	BRD-K41814083			COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@H](CO)O2)cc1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21-,23+,26+/m1/s1	UPMRBEOCYVNRMT-BCHMZHATSA-N	483.236935806							117290
BRD-K42529194	LSM-28740		54647554	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17-,19-,22+/m0/s1	POXOUGQYINQDTJ-MNNBHYOVSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K42529194	BRD-K42529194-001-01-7	Broad Institute of MIT and Harvard	BRD-K42529194			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17-,19-,22+/m0/s1	POXOUGQYINQDTJ-MNNBHYOVSA-N	417.226371122							117291
MLS003129970	LSM-28741	BRD-K64299311, SID121282541, SID131444059	51358835	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26-,28+/m0/s1	XHFXJTPXFPIUNX-IXQFDHPPSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NCc5ccc(Cl)cc5)C[C@H]4c3c2	BroadT	BRD-K64299311	BRD-K64299311-001-02-6	Broad Institute of MIT and Harvard	BRD-K64299311			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26-,28+/m0/s1	XHFXJTPXFPIUNX-IXQFDHPPSA-N	572.138399688							117292
BRD-K63155804	LSM-28742		54647495	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m0/s1	XVGJFJFVLUTQTK-PMTIONAUSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K63155804	BRD-K63155804-001-01-7	Broad Institute of MIT and Harvard	BRD-K63155804			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m0/s1	XVGJFJFVLUTQTK-PMTIONAUSA-N	451.210721058							117293
BRD-K90746817	LSM-28743		54647605	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22-,24+,26+/m1/s1	OBJFROVCRIKTIC-GUAAGHCTSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCCC5)cc34	BroadT	BRD-K90746817	BRD-K90746817-001-01-5	Broad Institute of MIT and Harvard	BRD-K90746817			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22-,24+,26+/m1/s1	OBJFROVCRIKTIC-GUAAGHCTSA-N	494.252920228							117294
BRD-K10698156	LSM-28744		54647677	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26-,28+/m1/s1	GERXZWRQFCUSQI-XILASOBOSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NCc5cccc(F)c5)C[C@@H]4c3c2	BroadT	BRD-K10698156	BRD-K10698156-001-01-4	Broad Institute of MIT and Harvard	BRD-K10698156			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cccc(F)c4)O[C@@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26-,28+/m1/s1	GERXZWRQFCUSQI-XILASOBOSA-N	556.167950178							117295
MLS003130002	LSM-28745	BRD-K87779720, SID99358542	46903370	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25+,27-,29-/m1/s1	AJAMEWYBAUQISK-FLMHHTSDSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)NCCc5ccccc5)C[C@H]4c3c2	BroadT	BRD-K87779720	BRD-K87779720-001-02-5	Broad Institute of MIT and Harvard	BRD-K87779720			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCCc4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25+,27-,29-/m1/s1	AJAMEWYBAUQISK-FLMHHTSDSA-N	552.193022074							117296
BRD-K23578173	LSM-28746		54647584	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21+,23+,26-/m0/s1	OSBPWUGUGZAKLO-RLCNXLTRSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K23578173	BRD-K23578173-001-01-2	Broad Institute of MIT and Harvard	BRD-K23578173			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21+,23+,26-/m0/s1	OSBPWUGUGZAKLO-RLCNXLTRSA-N	471.273321314							117297
BRD-K86964464	LSM-28747		54647407	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22-,25+,27+/m1/s1	DFSRPXMSRAMRJF-RYFPDZNGSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@H](CO)O2	BroadT	BRD-K86964464	BRD-K86964464-001-01-6	Broad Institute of MIT and Harvard	BRD-K86964464			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22-,25+,27+/m1/s1	DFSRPXMSRAMRJF-RYFPDZNGSA-N	509.25258587							117298
CHEMBL2361477	LSM-28748	BRD-K62892366, SID131444072	54647683	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26+,28+/m0/s1	GERXZWRQFCUSQI-HVZNUZIDSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)NCc5cccc(F)c5)C[C@H]4c3c2	BroadT	BRD-K62892366	BRD-K62892366-001-01-6	Broad Institute of MIT and Harvard	BRD-K62892366			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cccc(F)c4)O[C@@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26+,28+/m0/s1	GERXZWRQFCUSQI-HVZNUZIDSA-N	556.167950178							117299
BRD-K26704304	LSM-28749		54647401	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22-,25-,27+/m0/s1	DFSRPXMSRAMRJF-YSDDDFLKSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@H](CO)O2	BroadT	BRD-K26704304	BRD-K26704304-001-01-3	Broad Institute of MIT and Harvard	BRD-K26704304			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22-,25-,27+/m0/s1	DFSRPXMSRAMRJF-YSDDDFLKSA-N	509.25258587							117300
BRD-K61366105	LSM-28750		54647608	InChI=1S/C21H22FNO7S/c1-28-20(25)10-14-9-17-16-8-13(4-7-18(16)30-21(17)19(11-24)29-14)23-31(26,27)15-5-2-12(22)3-6-15/h2-8,14,17,19,21,23-24H,9-11H2,1H3/t14-,17-,19-,21+/m0/s1	KRPAMDJISYPLOJ-HIUUTZCYSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K61366105	BRD-K61366105-001-01-8	Broad Institute of MIT and Harvard	BRD-K61366105			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C21H22FNO7S/c1-28-20(25)10-14-9-17-16-8-13(4-7-18(16)30-21(17)19(11-24)29-14)23-31(26,27)15-5-2-12(22)3-6-15/h2-8,14,17,19,21,23-24H,9-11H2,1H3/t14-,17-,19-,21+/m0/s1	KRPAMDJISYPLOJ-HIUUTZCYSA-N	451.110100944							117301
BRD-K72685049	LSM-28751		54647536	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25-,27-/m1/s1	IOAZXSSJEHBWSP-MBHFTIIHSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K72685049	BRD-K72685049-001-01-7	Broad Institute of MIT and Harvard	BRD-K72685049			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25-,27-/m1/s1	IOAZXSSJEHBWSP-MBHFTIIHSA-N	544.147963662							117302
BRD-K67284043	LSM-28752		54647650	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20-,24-,27+/m1/s1	LBWAYGFZRYCTOK-UZTLAZMVSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K67284043	BRD-K67284043-001-01-2	Broad Institute of MIT and Harvard	BRD-K67284043			OC[C@H]1O[C@H](C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21)CC(=O)NCc1ccc2OCOc2c1	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20-,24-,27+/m1/s1	LBWAYGFZRYCTOK-UZTLAZMVSA-N	494.20530132							117303
BRD-K12531686	LSM-28753		54647424	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22-,24-,26+/m1/s1	GOWTXMJXNJEOKH-DFICYWPVSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K12531686	BRD-K12531686-001-01-4	Broad Institute of MIT and Harvard	BRD-K12531686			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22-,24-,26+/m1/s1	GOWTXMJXNJEOKH-DFICYWPVSA-N	500.29987042							117304
BRD-K28535931	LSM-28754		54647444	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26-,28-/m1/s1	CZQHDZKSVGPVAK-UKTDVOJESA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K28535931	BRD-K28535931-001-01-0	Broad Institute of MIT and Harvard	BRD-K28535931			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26-,28-/m1/s1	CZQHDZKSVGPVAK-UKTDVOJESA-N	550.150678934							117305
BRD-K37971917	LSM-28755		54647514	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21+,23-,25-/m0/s1	MCJXNBRGFCMFNB-PYTYSOFPSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K37971917	BRD-K37971917-001-01-4	Broad Institute of MIT and Harvard	BRD-K37971917			OC[C@@H]1O[C@H](CC(=O)NC2CCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21+,23-,25-/m0/s1	MCJXNBRGFCMFNB-PYTYSOFPSA-N	465.226371122							117306
BRD-K18621941	LSM-28756		54647559	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17-,19+,22+/m0/s1	POXOUGQYINQDTJ-RNCHUUSHSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K18621941	BRD-K18621941-001-01-8	Broad Institute of MIT and Harvard	BRD-K18621941			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17-,19+,22+/m0/s1	POXOUGQYINQDTJ-RNCHUUSHSA-N	417.226371122							117307
BRD-K49215099	LSM-28757		54647408	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20-,22-,25+/m1/s1	IZLHCVQHHLSMHG-HWZPKBPFSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K49215099	BRD-K49215099-001-01-2	Broad Institute of MIT and Harvard	BRD-K49215099			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20-,22-,25+/m1/s1	IZLHCVQHHLSMHG-HWZPKBPFSA-N	442.246772208							117308
BRD-K85720719	LSM-28758		54647441	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26-,28+/m0/s1	CZQHDZKSVGPVAK-UCAWGOPWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K85720719	BRD-K85720719-001-01-6	Broad Institute of MIT and Harvard	BRD-K85720719			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26-,28+/m0/s1	CZQHDZKSVGPVAK-UCAWGOPWSA-N	550.150678934							117309
BRD-K15515777	LSM-28759		54647413	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20+,22-,25-/m0/s1	IZLHCVQHHLSMHG-GPYREICYSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K15515777	BRD-K15515777-001-01-4	Broad Institute of MIT and Harvard	BRD-K15515777			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20+,22-,25-/m0/s1	IZLHCVQHHLSMHG-GPYREICYSA-N	442.246772208							117310
BRD-K89767945	LSM-28760		54647515	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21-,23+,25+/m0/s1	MCJXNBRGFCMFNB-FEGXGRLVSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K89767945	BRD-K89767945-001-01-9	Broad Institute of MIT and Harvard	BRD-K89767945			OC[C@H]1O[C@H](CC(=O)NC2CCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21-,23+,25+/m0/s1	MCJXNBRGFCMFNB-FEGXGRLVSA-N	465.226371122							117311
MLS003128978	LSM-28761	BRD-K82919339	46904103	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16+,18-,20-/m1/s1	KXSIODNMTPRENB-IHMNZUQTSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K82919339	BRD-K82919339-001-02-5	Broad Institute of MIT and Harvard	BRD-K82919339			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16+,18-,20-/m1/s1	KXSIODNMTPRENB-IHMNZUQTSA-N	404.194736636							117312
BRD-K08442552	LSM-28762		54647599	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22-,24-,26+/m0/s1	OBJFROVCRIKTIC-IFPZXYOKSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCCC5)cc34	BroadT	BRD-K08442552	BRD-K08442552-001-01-1	Broad Institute of MIT and Harvard	BRD-K08442552			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22-,24-,26+/m0/s1	OBJFROVCRIKTIC-IFPZXYOKSA-N	494.252920228							117313
BRD-K31462164	LSM-28763		54647684	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26+,28+/m1/s1	GERXZWRQFCUSQI-DZXBDMBVSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)NCc5cccc(F)c5)C[C@@H]4c3c2	BroadT	BRD-K31462164	BRD-K31462164-001-01-0	Broad Institute of MIT and Harvard	BRD-K31462164			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cccc(F)c4)O[C@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26+,28+/m1/s1	GERXZWRQFCUSQI-DZXBDMBVSA-N	556.167950178							117314
BRD-K47062996	LSM-28764		54647403	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22+,25+,27-/m1/s1	DFSRPXMSRAMRJF-ISSPKVJFSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@H](CO)O2	BroadT	BRD-K47062996	BRD-K47062996-001-01-4	Broad Institute of MIT and Harvard	BRD-K47062996			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22+,25+,27-/m1/s1	DFSRPXMSRAMRJF-ISSPKVJFSA-N	509.25258587							117315
BRD-K81082552	LSM-28765		54647607	InChI=1S/C21H22FNO7S/c1-28-20(25)10-14-9-17-16-8-13(4-7-18(16)30-21(17)19(11-24)29-14)23-31(26,27)15-5-2-12(22)3-6-15/h2-8,14,17,19,21,23-24H,9-11H2,1H3/t14-,17-,19-,21+/m1/s1	KRPAMDJISYPLOJ-QTRJSKNGSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K81082552	BRD-K81082552-001-01-5	Broad Institute of MIT and Harvard	BRD-K81082552			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C21H22FNO7S/c1-28-20(25)10-14-9-17-16-8-13(4-7-18(16)30-21(17)19(11-24)29-14)23-31(26,27)15-5-2-12(22)3-6-15/h2-8,14,17,19,21,23-24H,9-11H2,1H3/t14-,17-,19-,21+/m1/s1	KRPAMDJISYPLOJ-QTRJSKNGSA-N	451.110100944							117316
BRD-K07812227	LSM-28766		54647663	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19+,21-,24-/m0/s1	NDUFHUOGHUIKBH-PMSBSAKUSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCCN4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K07812227	BRD-K07812227-001-01-1	Broad Institute of MIT and Harvard	BRD-K07812227			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCCN4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19+,21-,24-/m0/s1	NDUFHUOGHUIKBH-PMSBSAKUSA-N	461.25258587							117317
BRD-K64447917	LSM-28767		54647570	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29+,32-/m0/s1	NKIFYSADZLZERH-CPKYPALVSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@H]4[C@@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K64447917	BRD-K64447917-001-01-1	Broad Institute of MIT and Harvard	BRD-K64447917			OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29+,32-/m0/s1	NKIFYSADZLZERH-CPKYPALVSA-N	526.246772208							117318
BRD-K39584933	LSM-28768		54647698	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19-,21-,24+/m0/s1	LQLAETCVZWZFIB-JBIZMDSKSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K39584933	BRD-K39584933-001-01-3	Broad Institute of MIT and Harvard	BRD-K39584933			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19-,21-,24+/m0/s1	LQLAETCVZWZFIB-JBIZMDSKSA-N	428.231122144							117319
MLS003128979	LSM-28769	BRD-K79688948, SID99359542	46904104	InChI=1S/C22H25NO8S/c1-28-14-4-3-5-16(9-14)32(26,27)23-13-6-7-19-17(8-13)18-10-15(11-21(25)29-2)30-20(12-24)22(18)31-19/h3-9,15,18,20,22-24H,10-12H2,1-2H3/t15-,18-,20-,22+/m1/s1	XGRVZSSSNYUCOS-HBPKQZLHSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@@H](CO)O1	BroadT	BRD-K79688948	BRD-K79688948-001-02-4	Broad Institute of MIT and Harvard	BRD-K79688948			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@@H](CO)O1	InChI=1S/C22H25NO8S/c1-28-14-4-3-5-16(9-14)32(26,27)23-13-6-7-19-17(8-13)18-10-15(11-21(25)29-2)30-20(12-24)22(18)31-19/h3-9,15,18,20,22-24H,10-12H2,1-2H3/t15-,18-,20-,22+/m1/s1	XGRVZSSSNYUCOS-HBPKQZLHSA-N	463.13008746							117320
BRD-K13898728	LSM-28770		54647632	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19+,21+/m0/s1	IMSLJZJFFZYXRC-ICSUOEFDSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K13898728	BRD-K13898728-001-01-6	Broad Institute of MIT and Harvard	BRD-K13898728			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccncc4)O[C@@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19+,21+/m0/s1	IMSLJZJFFZYXRC-ICSUOEFDSA-N	447.14640624							117321
BRD-K32423836	LSM-28771		54647473	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19+,22-/m1/s1	HRBYSLULMJVYNQ-TXDFXGTJSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K32423836	BRD-K32423836-001-01-9	Broad Institute of MIT and Harvard	BRD-K32423836			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19+,22-/m1/s1	HRBYSLULMJVYNQ-TXDFXGTJSA-N	418.2103867							117322
BRD-K91843292	LSM-28772		54647448	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20-,24-,26+/m1/s1	UYPIQWDIZXMNDJ-FNVZBELISA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K91843292	BRD-K91843292-001-01-3	Broad Institute of MIT and Harvard	BRD-K91843292			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20-,24-,26+/m1/s1	UYPIQWDIZXMNDJ-FNVZBELISA-N	506.196548204							117323
BRD-K61259788	LSM-28773		54647565	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20+,22-,25-/m1/s1	CMSFJVGZZAIMOJ-DPQLKAKJSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCCc4ccccc4)C[C@H]3c2c1	BroadT	BRD-K61259788	BRD-K61259788-001-01-9	Broad Institute of MIT and Harvard	BRD-K61259788			COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](C[C@H]3c2c1)CC(=O)NCCc1ccccc1	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20+,22-,25-/m1/s1	CMSFJVGZZAIMOJ-DPQLKAKJSA-N	454.2103867							117324
BRD-K92825272	LSM-28774		54647558	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17+,19-,22-/m0/s1	POXOUGQYINQDTJ-VYXPOXFGSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K92825272	BRD-K92825272-001-01-3	Broad Institute of MIT and Harvard	BRD-K92825272			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17+,19-,22-/m0/s1	POXOUGQYINQDTJ-VYXPOXFGSA-N	417.226371122							117325
BRD-K32913479	LSM-28775		54647528	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22-,25-/m1/s1	AANFNNZNKVIOFO-DPQLKAKJSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4cccc(F)c4)C[C@H]3c2c1	BroadT	BRD-K32913479	BRD-K32913479-001-01-1	Broad Institute of MIT and Harvard	BRD-K32913479			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cccc(F)c4)O[C@@H]3CO)c2c1	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22-,25-/m1/s1	AANFNNZNKVIOFO-DPQLKAKJSA-N	471.21694929							117326
BRD-K46195730	LSM-28776		54647691	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15-,17-,20+/m0/s1	PIWWRJKYNWMMLJ-NUADTHGBSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K46195730	BRD-K46195730-001-01-4	Broad Institute of MIT and Harvard	BRD-K46195730			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15-,17-,20+/m0/s1	PIWWRJKYNWMMLJ-NUADTHGBSA-N	442.17155652							117327
BRD-K52047117	LSM-15147		54647489	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19+,23-,26-/m1/s1	WTUFVLVPXRCGPW-ZOFLEUFXSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc5OCOc5c4)C[C@H]3c2c1	BroadT	BRD-K52047117	BRD-K52047117-001-01-1	Broad Institute of MIT and Harvard	BRD-K52047117			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc5OCOc5c4)O[C@@H]3CO)c2c1	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19+,23-,26-/m1/s1	WTUFVLVPXRCGPW-ZOFLEUFXSA-N	497.216200362							103803
BRD-K91060460	LSM-28777		54647581	InChI=1S/C23H23F3N2O6/c1-32-20(30)10-15-9-17-16-8-14(6-7-18(16)34-21(17)19(11-29)33-15)28-22(31)27-13-4-2-12(3-5-13)23(24,25)26/h2-8,15,17,19,21,29H,9-11H2,1H3,(H2,27,28,31)/t15-,17-,19+,21+/m1/s1	MSQUSFAFSKSPPL-DOSUHQCWSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	BroadT	BRD-K91060460	BRD-K91060460-001-01-0	Broad Institute of MIT and Harvard	BRD-K91060460			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C23H23F3N2O6/c1-32-20(30)10-15-9-17-16-8-14(6-7-18(16)34-21(17)19(11-29)33-15)28-22(31)27-13-4-2-12(3-5-13)23(24,25)26/h2-8,15,17,19,21,29H,9-11H2,1H3,(H2,27,28,31)/t15-,17-,19+,21+/m1/s1	MSQUSFAFSKSPPL-DOSUHQCWSA-N	480.150821076							117328
BRD-K21180458	LSM-28778		54647478	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20-,23-,26+/m1/s1	UWAUWNPQHFTMFN-SNMOHMLRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K21180458	BRD-K21180458-001-01-5	Broad Institute of MIT and Harvard	BRD-K21180458			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20-,23-,26+/m1/s1	UWAUWNPQHFTMFN-SNMOHMLRSA-N	486.196628416							117329
BRD-K41063113	LSM-28779		54647506	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16-,19-/m0/s1	YUNRHRZDARIPJN-YIYSPXCVSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)N(C)C)C[C@@H]3c2c1	BroadT	BRD-K41063113	BRD-K41063113-001-01-6	Broad Institute of MIT and Harvard	BRD-K41063113			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16-,19-/m0/s1	YUNRHRZDARIPJN-YIYSPXCVSA-N	378.179086572							117330
BRD-K50689779	LSM-28780		54647452	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20+,24-,26-/m0/s1	UYPIQWDIZXMNDJ-DZVUWMEYSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K50689779	BRD-K50689779-001-01-1	Broad Institute of MIT and Harvard	BRD-K50689779			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20+,24-,26-/m0/s1	UYPIQWDIZXMNDJ-DZVUWMEYSA-N	506.196548204							117331
BRD-K72843176	LSM-28781		54647544	InChI=1S/C23H25F3N2O7S/c1-33-14-3-2-4-16(8-14)36(31,32)28-13-5-6-19-17(7-13)18-9-15(34-20(11-29)22(18)35-19)10-21(30)27-12-23(24,25)26/h2-8,15,18,20,22,28-29H,9-12H2,1H3,(H,27,30)/t15-,18+,20-,22-/m0/s1	MZKZWNSKYYIKNG-OPMXSGTGSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]4c3c2	BroadT	BRD-K72843176	BRD-K72843176-001-01-7	Broad Institute of MIT and Harvard	BRD-K72843176			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](C[C@@H]3c2c1)CC(=O)NCC(F)(F)F	InChI=1S/C23H25F3N2O7S/c1-33-14-3-2-4-16(8-14)36(31,32)28-13-5-6-19-17(7-13)18-9-15(34-20(11-29)22(18)35-19)10-21(30)27-12-23(24,25)26/h2-8,15,18,20,22,28-29H,9-12H2,1H3,(H,27,30)/t15-,18+,20-,22-/m0/s1	MZKZWNSKYYIKNG-OPMXSGTGSA-N	530.13345645							117332
BRD-K94205659	LSM-28782		54647485	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20-,23+,26+/m1/s1	UWAUWNPQHFTMFN-ZCXMQSQVSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K94205659	BRD-K94205659-001-01-9	Broad Institute of MIT and Harvard	BRD-K94205659			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20-,23+,26+/m1/s1	UWAUWNPQHFTMFN-ZCXMQSQVSA-N	486.196628416							117333
BRD-K21470524	LSM-28783		54647656	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20-,24+,27+/m0/s1	LBWAYGFZRYCTOK-RVEVFCQESA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K21470524	BRD-K21470524-001-01-0	Broad Institute of MIT and Harvard	BRD-K21470524			OC[C@H]1O[C@@H](C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21)CC(=O)NCc1ccc2OCOc2c1	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20-,24+,27+/m0/s1	LBWAYGFZRYCTOK-RVEVFCQESA-N	494.20530132							117334
BRD-K34519170	LSM-28784		54647437	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25-,27-/m0/s1	RQEGAPRBBMLFLJ-OGMXRKNYSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K34519170	BRD-K34519170-001-01-6	Broad Institute of MIT and Harvard	BRD-K34519170			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25-,27-/m0/s1	RQEGAPRBBMLFLJ-OGMXRKNYSA-N	560.118413172							117335
BRD-K18861574-001-01-4	LSM-28785	BRD-K18861574	54647685	InChI=1S/C23H27ClN2O4/c1-26(2)16-7-8-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-3-5-15(24)6-4-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19-,21-,23+/m1/s1	MOQWXNTXFGVTQQ-LHWDRQQYSA-N	CN(C)c1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(Cl)cc4)C[C@@H]3c2c1	BroadT	BRD-K18861574	BRD-K18861574-001-01-4	Broad Institute of MIT and Harvard	BRD-K18861574			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C23H27ClN2O4/c1-26(2)16-7-8-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-3-5-15(24)6-4-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19-,21-,23+/m1/s1	MOQWXNTXFGVTQQ-LHWDRQQYSA-N	430.165935074							117336
BRD-K49999779	LSM-28786		54647538	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25+,27+/m0/s1	IOAZXSSJEHBWSP-MUUNGVPUSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K49999779	BRD-K49999779-001-01-8	Broad Institute of MIT and Harvard	BRD-K49999779			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25+,27+/m0/s1	IOAZXSSJEHBWSP-MUUNGVPUSA-N	544.147963662							117337
BRD-K27008344	LSM-28787		54647700	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19+,21+,24-/m1/s1	LQLAETCVZWZFIB-OFYLTFBOSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K27008344	BRD-K27008344-001-01-0	Broad Institute of MIT and Harvard	BRD-K27008344			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19+,21+,24-/m1/s1	LQLAETCVZWZFIB-OFYLTFBOSA-N	428.231122144							117338
BRD-K91297952	LSM-28788		54647699	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19+,21+,24-/m0/s1	LQLAETCVZWZFIB-FCMRVMJTSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K91297952	BRD-K91297952-001-01-3	Broad Institute of MIT and Harvard	BRD-K91297952			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19+,21+,24-/m0/s1	LQLAETCVZWZFIB-FCMRVMJTSA-N	428.231122144							117339
BRD-K05868476	LSM-28789		54647621	InChI=1S/C22H24N2O6/c1-28-21(27)11-15-10-17-16-9-14(24-20(26)8-13-4-6-23-7-5-13)2-3-18(16)30-22(17)19(12-25)29-15/h2-7,9,15,17,19,22,25H,8,10-12H2,1H3,(H,24,26)/t15-,17-,19-,22+/m1/s1	WSHDHBDWIVSZGZ-AWGCWCAXSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	BroadT	BRD-K05868476	BRD-K05868476-001-01-3	Broad Institute of MIT and Harvard	BRD-K05868476			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-21(27)11-15-10-17-16-9-14(24-20(26)8-13-4-6-23-7-5-13)2-3-18(16)30-22(17)19(12-25)29-15/h2-7,9,15,17,19,22,25H,8,10-12H2,1H3,(H,24,26)/t15-,17-,19-,22+/m1/s1	WSHDHBDWIVSZGZ-AWGCWCAXSA-N	412.163436508							117340
BRD-K72700187	LSM-28790		54647637	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25+,27+,30-/m1/s1	GRQDGDFBWRYOPG-LWQGNWNJSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@H]3c2c1	BroadT	BRD-K72700187	BRD-K72700187-001-01-6	Broad Institute of MIT and Harvard	BRD-K72700187			COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](C[C@H]3c2c1)CC(=O)NCc1ccc(cc1)-c1ccccc1	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25+,27+,30-/m1/s1	GRQDGDFBWRYOPG-LWQGNWNJSA-N	516.226036764							117341
BRD-K33122655	LSM-28791		54647579	InChI=1S/C23H23F3N2O6/c1-32-20(30)10-15-9-17-16-8-14(6-7-18(16)34-21(17)19(11-29)33-15)28-22(31)27-13-4-2-12(3-5-13)23(24,25)26/h2-8,15,17,19,21,29H,9-11H2,1H3,(H2,27,28,31)/t15-,17+,19-,21-/m0/s1	MSQUSFAFSKSPPL-MRCYXTNMSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	BroadT	BRD-K33122655	BRD-K33122655-001-01-4	Broad Institute of MIT and Harvard	BRD-K33122655			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C23H23F3N2O6/c1-32-20(30)10-15-9-17-16-8-14(6-7-18(16)34-21(17)19(11-29)33-15)28-22(31)27-13-4-2-12(3-5-13)23(24,25)26/h2-8,15,17,19,21,29H,9-11H2,1H3,(H2,27,28,31)/t15-,17+,19-,21-/m0/s1	MSQUSFAFSKSPPL-MRCYXTNMSA-N	480.150821076							117342
BRD-K98723391	LSM-28792		54647585	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21+,23+,26-/m1/s1	OSBPWUGUGZAKLO-HMMJVGNDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K98723391	BRD-K98723391-001-01-0	Broad Institute of MIT and Harvard	BRD-K98723391			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21+,23+,26-/m1/s1	OSBPWUGUGZAKLO-HMMJVGNDSA-N	471.273321314							117343
BRD-K76904668	LSM-28793		54647521	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m0/s1	MZEYKMYWBLWBBR-GPYREICYSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K76904668	BRD-K76904668-001-01-8	Broad Institute of MIT and Harvard	BRD-K76904668			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m0/s1	MZEYKMYWBLWBBR-GPYREICYSA-N	451.210721058							117344
BRD-K80897487	LSM-28794		54647458	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17+,19-,21-/m1/s1	ZQPIRYHZQRYESG-UKHYVGRKSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K80897487	BRD-K80897487-001-01-7	Broad Institute of MIT and Harvard	BRD-K80897487			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17+,19-,21-/m1/s1	ZQPIRYHZQRYESG-UKHYVGRKSA-N	417.226371122							117345
BRD-K79887921	LSM-28795		54647523	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m1/s1	MZEYKMYWBLWBBR-NARIEAHCSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K79887921	BRD-K79887921-001-01-5	Broad Institute of MIT and Harvard	BRD-K79887921			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m1/s1	MZEYKMYWBLWBBR-NARIEAHCSA-N	451.210721058							117346
MLS003130016	LSM-28796	BRD-K32418104, SID99358553	46903381	InChI=1S/C27H27FN4O5/c28-21-6-1-2-7-22(21)32-27(35)31-16-8-9-23-19(11-16)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-17-5-3-4-10-29-17/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20-,24+,26+/m1/s1	RSFFUNGNZPVVNQ-ODQDCYGBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K32418104	BRD-K32418104-001-02-2	Broad Institute of MIT and Harvard	BRD-K32418104			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H27FN4O5/c28-21-6-1-2-7-22(21)32-27(35)31-16-8-9-23-19(11-16)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-17-5-3-4-10-29-17/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20-,24+,26+/m1/s1	RSFFUNGNZPVVNQ-ODQDCYGBSA-N	506.196548204							117347
BRD-K14416602	LSM-28797		54647412	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20+,22-,25-/m1/s1	IZLHCVQHHLSMHG-DPQLKAKJSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K14416602	BRD-K14416602-001-01-7	Broad Institute of MIT and Harvard	BRD-K14416602			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20+,22-,25-/m1/s1	IZLHCVQHHLSMHG-DPQLKAKJSA-N	442.246772208							117348
BRD-K60850201	LSM-28798		54647541	InChI=1S/C23H25F3N2O7S/c1-33-14-3-2-4-16(8-14)36(31,32)28-13-5-6-19-17(7-13)18-9-15(34-20(11-29)22(18)35-19)10-21(30)27-12-23(24,25)26/h2-8,15,18,20,22,28-29H,9-12H2,1H3,(H,27,30)/t15-,18-,20-,22+/m0/s1	MZKZWNSKYYIKNG-DKWQAAHISA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NCC(F)(F)F)C[C@H]4c3c2	BroadT	BRD-K60850201	BRD-K60850201-001-01-5	Broad Institute of MIT and Harvard	BRD-K60850201			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](C[C@H]3c2c1)CC(=O)NCC(F)(F)F	InChI=1S/C23H25F3N2O7S/c1-33-14-3-2-4-16(8-14)36(31,32)28-13-5-6-19-17(7-13)18-9-15(34-20(11-29)22(18)35-19)10-21(30)27-12-23(24,25)26/h2-8,15,18,20,22,28-29H,9-12H2,1H3,(H,27,30)/t15-,18-,20-,22+/m0/s1	MZKZWNSKYYIKNG-DKWQAAHISA-N	530.13345645							117349
BRD-K03855997	LSM-28799		54647658	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19-,21-,24+/m1/s1	NDUFHUOGHUIKBH-ISYUWZRGSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCCN4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K03855997	BRD-K03855997-001-01-2	Broad Institute of MIT and Harvard	BRD-K03855997			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCCN4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19-,21-,24+/m1/s1	NDUFHUOGHUIKBH-ISYUWZRGSA-N	461.25258587							117350
BRD-K92640680	LSM-28800		54647567	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20-,22+,25+/m0/s1	CMSFJVGZZAIMOJ-FZIATNMDSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCCc4ccccc4)C[C@H]3c2c1	BroadT	BRD-K92640680	BRD-K92640680-001-01-2	Broad Institute of MIT and Harvard	BRD-K92640680			COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](C[C@H]3c2c1)CC(=O)NCCc1ccccc1	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20-,22+,25+/m0/s1	CMSFJVGZZAIMOJ-FZIATNMDSA-N	454.2103867							117351
BRD-K86587289	LSM-28801		54647457	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17+,19+,21-/m1/s1	ZQPIRYHZQRYESG-ZWVMGRIOSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K86587289	BRD-K86587289-001-01-8	Broad Institute of MIT and Harvard	BRD-K86587289			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17+,19+,21-/m1/s1	ZQPIRYHZQRYESG-ZWVMGRIOSA-N	417.226371122							117352
MLS003130018	LSM-28802	SID99358555, BRD-K22062326	46903383	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-4-5-18-16(7-14)17-8-15(29-19(12-25)21(17)30-18)9-20(26)23-11-13-3-2-6-22-10-13/h2-7,10,15,17,19,21,24-25H,8-9,11-12H2,1H3,(H,23,26)/t15-,17-,19+,21+/m0/s1	ZBWSKZQVBMVWMS-ICSUOEFDSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cccnc4)C[C@H]3c2c1	BroadT	BRD-K22062326	BRD-K22062326-001-02-2	Broad Institute of MIT and Harvard	BRD-K22062326			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cccnc4)O[C@@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-4-5-18-16(7-14)17-8-15(29-19(12-25)21(17)30-18)9-20(26)23-11-13-3-2-6-22-10-13/h2-7,10,15,17,19,21,24-25H,8-9,11-12H2,1H3,(H,23,26)/t15-,17-,19+,21+/m0/s1	ZBWSKZQVBMVWMS-ICSUOEFDSA-N	447.14640624							117353
BRD-K46701848	LSM-28803		54647505	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16-,19-/m1/s1	YUNRHRZDARIPJN-MGPHVCOZSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)N(C)C)C[C@H]3c2c1	BroadT	BRD-K46701848	BRD-K46701848-001-01-8	Broad Institute of MIT and Harvard	BRD-K46701848			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16-,19-/m1/s1	YUNRHRZDARIPJN-MGPHVCOZSA-N	378.179086572							117354
BRD-K86155400	LSM-28804		54647669	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,23-/m1/s1	CLWRRFDHWRUPJJ-MRKDIWJRSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccccn4)C[C@H]3c2c1	BroadT	BRD-K86155400	BRD-K86155400-001-01-8	Broad Institute of MIT and Harvard	BRD-K86155400			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccccn4)O[C@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,23-/m1/s1	CLWRRFDHWRUPJJ-MRKDIWJRSA-N	441.189985614							117355
BRD-K75887263	LSM-28805		54647564	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20+,22+,25-/m1/s1	CMSFJVGZZAIMOJ-XOQZDTPSSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCCc4ccccc4)C[C@H]3c2c1	BroadT	BRD-K75887263	BRD-K75887263-001-01-5	Broad Institute of MIT and Harvard	BRD-K75887263			COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](C[C@H]3c2c1)CC(=O)NCCc1ccccc1	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20+,22+,25-/m1/s1	CMSFJVGZZAIMOJ-XOQZDTPSSA-N	454.2103867							117356
BRD-K96164740	LSM-28806		54647454	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20-,24+,26+/m1/s1	UYPIQWDIZXMNDJ-ODQDCYGBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K96164740	BRD-K96164740-001-01-7	Broad Institute of MIT and Harvard	BRD-K96164740			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20-,24+,26+/m1/s1	UYPIQWDIZXMNDJ-ODQDCYGBSA-N	506.196548204							117357
BRD-K99982687	LSM-28807		54647450	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20+,24+,26-/m1/s1	UYPIQWDIZXMNDJ-SNXCTZGFSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K99982687	BRD-K99982687-001-01-4	Broad Institute of MIT and Harvard	BRD-K99982687			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20+,24+,26-/m1/s1	UYPIQWDIZXMNDJ-SNXCTZGFSA-N	506.196548204							117358
BRD-K47092271	LSM-28808		54647661	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19+,21+,24-/m1/s1	NDUFHUOGHUIKBH-OFYLTFBOSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCCN4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K47092271	BRD-K47092271-001-01-7	Broad Institute of MIT and Harvard	BRD-K47092271			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCCN4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19+,21+,24-/m1/s1	NDUFHUOGHUIKBH-OFYLTFBOSA-N	461.25258587							117359
BRD-K08647020	LSM-28809		54647482	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20+,23-,26-/m1/s1	UWAUWNPQHFTMFN-ZBYDKNLWSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K08647020	BRD-K08647020-001-01-9	Broad Institute of MIT and Harvard	BRD-K08647020			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20+,23-,26-/m1/s1	UWAUWNPQHFTMFN-ZBYDKNLWSA-N	486.196628416							117360
BRD-K48029682	LSM-28810		54647630	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19-,21-/m1/s1	IMSLJZJFFZYXRC-UKHYVGRKSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K48029682	BRD-K48029682-001-01-1	Broad Institute of MIT and Harvard	BRD-K48029682			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccncc4)O[C@@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19-,21-/m1/s1	IMSLJZJFFZYXRC-UKHYVGRKSA-N	447.14640624							117361
BRD-K12640996	LSM-28811		54647519	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m1/s1	MZEYKMYWBLWBBR-XOQZDTPSSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K12640996	BRD-K12640996-001-01-8	Broad Institute of MIT and Harvard	BRD-K12640996			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m1/s1	MZEYKMYWBLWBBR-XOQZDTPSSA-N	451.210721058							117362
MLS003130381	LSM-28812	BRD-K07029108, SID99359380	46903944	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16-,18-,20+/m1/s1	KXSIODNMTPRENB-ODZKNYGOSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K07029108	BRD-K07029108-001-02-4	Broad Institute of MIT and Harvard	BRD-K07029108			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16-,18-,20+/m1/s1	KXSIODNMTPRENB-ODZKNYGOSA-N	404.194736636							117363
BRD-K94273044	LSM-28813		54647552	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13-,15+,17+/m1/s1	ILXKPNUBZXTBRO-ZAUVIXRXSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K94273044	BRD-K94273044-001-01-1	Broad Institute of MIT and Harvard	BRD-K94273044			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13-,15+,17+/m1/s1	ILXKPNUBZXTBRO-ZAUVIXRXSA-N	384.135507198							117364
BRD-K89805365	LSM-28814		54647551	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13-,15+,17+/m0/s1	ILXKPNUBZXTBRO-QDFMMOOJSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K89805365	BRD-K89805365-001-01-8	Broad Institute of MIT and Harvard	BRD-K89805365			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13-,15+,17+/m0/s1	ILXKPNUBZXTBRO-QDFMMOOJSA-N	384.135507198							117365
BRD-K99097591	LSM-28815		54647466	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16+,20-,22-/m1/s1	IVKRNFCOUULTQI-SQKDIAQBSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	BroadT	BRD-K99097591	BRD-K99097591-001-01-6	Broad Institute of MIT and Harvard	BRD-K99097591			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16+,20-,22-/m1/s1	IVKRNFCOUULTQI-SQKDIAQBSA-N	443.185649162							117366
BRD-K44339278	LSM-28816		54647600	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22+,24+,26-/m0/s1	OBJFROVCRIKTIC-RXDHMRHRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCCC5)cc34	BroadT	BRD-K44339278	BRD-K44339278-001-01-8	Broad Institute of MIT and Harvard	BRD-K44339278			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22+,24+,26-/m0/s1	OBJFROVCRIKTIC-RXDHMRHRSA-N	494.252920228							117367
BRD-K39348592	LSM-28817		54647673	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m1/s1	CLWRRFDHWRUPJJ-DUCQWWKISA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccccn4)C[C@@H]3c2c1	BroadT	BRD-K39348592	BRD-K39348592-001-01-5	Broad Institute of MIT and Harvard	BRD-K39348592			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccn4)O[C@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m1/s1	CLWRRFDHWRUPJJ-DUCQWWKISA-N	441.189985614							117368
BRD-K50133846	LSM-28818		54647694	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15+,17-,20-/m0/s1	PIWWRJKYNWMMLJ-IDVHHABFSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K50133846	BRD-K50133846-001-01-9	Broad Institute of MIT and Harvard	BRD-K50133846			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15+,17-,20-/m0/s1	PIWWRJKYNWMMLJ-IDVHHABFSA-N	442.17155652							117369
BRD-K65663356	LSM-28819		54647449	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20-,24-,26+/m0/s1	UYPIQWDIZXMNDJ-IHJBEOSKSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K65663356	BRD-K65663356-001-01-0	Broad Institute of MIT and Harvard	BRD-K65663356			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20-,24-,26+/m0/s1	UYPIQWDIZXMNDJ-IHJBEOSKSA-N	506.196548204							117370
BRD-K33757887	LSM-28820		54647634	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25-,27-,30+/m1/s1	GRQDGDFBWRYOPG-HUPNWNGMSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@@H]3c2c1	BroadT	BRD-K33757887	BRD-K33757887-001-01-7	Broad Institute of MIT and Harvard	BRD-K33757887			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](C[C@@H]3c2c1)CC(=O)NCc1ccc(cc1)-c1ccccc1	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25-,27-,30+/m1/s1	GRQDGDFBWRYOPG-HUPNWNGMSA-N	516.226036764							117371
BRD-K78007953	LSM-28821		54647488	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19+,23+,26-/m1/s1	WTUFVLVPXRCGPW-ZJIQKZQBSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc5OCOc5c4)C[C@H]3c2c1	BroadT	BRD-K78007953	BRD-K78007953-001-01-2	Broad Institute of MIT and Harvard	BRD-K78007953			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc5OCOc5c4)O[C@H]3CO)c2c1	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19+,23+,26-/m1/s1	WTUFVLVPXRCGPW-ZJIQKZQBSA-N	497.216200362							117372
BRD-K53146097	LSM-28822		54647597	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20-,22+,24+/m1/s1	UITZQDWRSZBATF-OITMPTDNSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K53146097	BRD-K53146097-001-01-4	Broad Institute of MIT and Harvard	BRD-K53146097			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20-,22+,24+/m1/s1	UITZQDWRSZBATF-OITMPTDNSA-N	472.166807326							117373
BRD-K95577144	LSM-28823		54647517	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,25+/m1/s1	MZEYKMYWBLWBBR-HWZPKBPFSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K95577144	BRD-K95577144-001-01-3	Broad Institute of MIT and Harvard	BRD-K95577144			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,25+/m1/s1	MZEYKMYWBLWBBR-HWZPKBPFSA-N	451.210721058							117374
BRD-K48665080	LSM-28824		54647420	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18+,22-,24-/m1/s1	HFXZOAOZNJYYEY-KLYAEHFASA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K48665080	BRD-K48665080-001-01-0	Broad Institute of MIT and Harvard	BRD-K48665080			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18+,22-,24-/m1/s1	HFXZOAOZNJYYEY-KLYAEHFASA-N	469.201299226							117375
BRD-K12271646	LSM-28825		54647561	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20-,22-,25+/m1/s1	CMSFJVGZZAIMOJ-HWZPKBPFSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCCc4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K12271646	BRD-K12271646-001-01-6	Broad Institute of MIT and Harvard	BRD-K12271646			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](C[C@@H]3c2c1)CC(=O)NCCc1ccccc1	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20-,22-,25+/m1/s1	CMSFJVGZZAIMOJ-HWZPKBPFSA-N	454.2103867							117376
BRD-K81888673	LSM-28826		54647633	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19+,21+/m1/s1	IMSLJZJFFZYXRC-DOSUHQCWSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K81888673	BRD-K81888673-001-01-9	Broad Institute of MIT and Harvard	BRD-K81888673			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccncc4)O[C@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19+,21+/m1/s1	IMSLJZJFFZYXRC-DOSUHQCWSA-N	447.14640624							117377
BRD-K16257584	LSM-28827		54647681	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26-,28-/m1/s1	GERXZWRQFCUSQI-BTBRWJRTSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)NCc5cccc(F)c5)C[C@H]4c3c2	BroadT	BRD-K16257584	BRD-K16257584-001-01-5	Broad Institute of MIT and Harvard	BRD-K16257584			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cccc(F)c4)O[C@@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26-,28-/m1/s1	GERXZWRQFCUSQI-BTBRWJRTSA-N	556.167950178							117378
BRD-K04238122	LSM-28828		54647602	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22+,24-,26-/m1/s1	OBJFROVCRIKTIC-FWSIMYTDSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCCC5)cc34	BroadT	BRD-K04238122	BRD-K04238122-001-01-8	Broad Institute of MIT and Harvard	BRD-K04238122			OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22+,24-,26-/m1/s1	OBJFROVCRIKTIC-FWSIMYTDSA-N	494.252920228							117379
BRD-K73695595	LSM-28829		54647675	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17+,19-,21-/m0/s1	BVQWYDMOVFWUGX-MRCYXTNMSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@H](CO)O1	BroadT	BRD-K73695595	BRD-K73695595-001-02-1	Broad Institute of MIT and Harvard	BRD-K73695595			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17+,19-,21-/m0/s1	BVQWYDMOVFWUGX-MRCYXTNMSA-N	412.163436508							117380
BRD-K75844518	LSM-28830		54647510	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21-,23-,25+/m0/s1	MCJXNBRGFCMFNB-YALMDMJRSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K75844518	BRD-K75844518-001-01-9	Broad Institute of MIT and Harvard	BRD-K75844518			OC[C@@H]1O[C@H](CC(=O)NC2CCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21-,23-,25+/m0/s1	MCJXNBRGFCMFNB-YALMDMJRSA-N	465.226371122							117381
BRD-K86232678	LSM-28831		54647549	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13+,15-,17-/m1/s1	ILXKPNUBZXTBRO-HQHYIBOGSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K86232678	BRD-K86232678-001-01-0	Broad Institute of MIT and Harvard	BRD-K86232678			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13+,15-,17-/m1/s1	ILXKPNUBZXTBRO-HQHYIBOGSA-N	384.135507198							117382
BRD-K52310606	LSM-28832		54647628	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19+,21-/m0/s1	IMSLJZJFFZYXRC-RWCSOYMTSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K52310606	BRD-K52310606-001-01-1	Broad Institute of MIT and Harvard	BRD-K52310606			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccncc4)O[C@@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19+,21-/m0/s1	IMSLJZJFFZYXRC-RWCSOYMTSA-N	447.14640624							117383
BRD-K65315551	LSM-28833		54647429	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22+,24-,26-/m0/s1	GOWTXMJXNJEOKH-YXOQKGKWSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K65315551	BRD-K65315551-001-01-0	Broad Institute of MIT and Harvard	BRD-K65315551			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22+,24-,26-/m0/s1	GOWTXMJXNJEOKH-YXOQKGKWSA-N	500.29987042							117384
BRD-K16940345	LSM-28834		54647616	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15+,19+,21-/m1/s1	FNDPGVQZUOXHHT-UZSHKEKKSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K16940345	BRD-K16940345-001-01-6	Broad Institute of MIT and Harvard	BRD-K16940345			OC[C@@H]1O[C@@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15+,19+,21-/m1/s1	FNDPGVQZUOXHHT-UZSHKEKKSA-N	427.126716642							117385
BRD-K91469267	LSM-28835		54647471	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19-,22+/m0/s1	HRBYSLULMJVYNQ-MNNBHYOVSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K91469267	BRD-K91469267-001-01-8	Broad Institute of MIT and Harvard	BRD-K91469267			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19-,22+/m0/s1	HRBYSLULMJVYNQ-MNNBHYOVSA-N	418.2103867							117386
BRD-K22720379	LSM-28836		54647573	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29-,32-/m0/s1	NKIFYSADZLZERH-GDKZVSLFSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@H]4[C@@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K22720379	BRD-K22720379-001-01-3	Broad Institute of MIT and Harvard	BRD-K22720379			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29-,32-/m0/s1	NKIFYSADZLZERH-GDKZVSLFSA-N	526.246772208							117387
BRD-K77638937	LSM-28837		54647617	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15+,19-,21-/m1/s1	FNDPGVQZUOXHHT-DIZIXXEVSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K77638937	BRD-K77638937-001-01-6	Broad Institute of MIT and Harvard	BRD-K77638937			OC[C@H]1O[C@@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15+,19-,21-/m1/s1	FNDPGVQZUOXHHT-DIZIXXEVSA-N	427.126716642							117388
BRD-K12741517	LSM-28838		54647659	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19-,21-,24+/m0/s1	NDUFHUOGHUIKBH-JBIZMDSKSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCCN4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K12741517	BRD-K12741517-001-01-4	Broad Institute of MIT and Harvard	BRD-K12741517			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCCN4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19-,21-,24+/m0/s1	NDUFHUOGHUIKBH-JBIZMDSKSA-N	461.25258587							117389
BRD-K39449566	LSM-28839		54647440	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26-,28+/m1/s1	CZQHDZKSVGPVAK-DFQMGKBUSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K39449566	BRD-K39449566-001-01-3	Broad Institute of MIT and Harvard	BRD-K39449566			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26-,28+/m1/s1	CZQHDZKSVGPVAK-DFQMGKBUSA-N	550.150678934							117390
MLS003130021	LSM-28840	SID99358558, BRD-K86577310	46903386	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20-,22+,24+/m1/s1	CJNJMLGGDUQPOS-OITMPTDNSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K86577310	BRD-K86577310-001-02-0	Broad Institute of MIT and Harvard	BRD-K86577310			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20-,22+,24+/m1/s1	CJNJMLGGDUQPOS-OITMPTDNSA-N	488.161721946							117391
BRD-K04650671	LSM-28841		54647531	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22+,25+/m1/s1	AANFNNZNKVIOFO-NARIEAHCSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cccc(F)c4)C[C@@H]3c2c1	BroadT	BRD-K04650671	BRD-K04650671-001-01-9	Broad Institute of MIT and Harvard	BRD-K04650671			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cccc(F)c4)O[C@H]3CO)c2c1	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22+,25+/m1/s1	AANFNNZNKVIOFO-NARIEAHCSA-N	471.21694929							117392
BRD-K69393995	LSM-28842		54647609	InChI=1S/C21H22FNO7S/c1-28-20(25)10-14-9-17-16-8-13(4-7-18(16)30-21(17)19(11-24)29-14)23-31(26,27)15-5-2-12(22)3-6-15/h2-8,14,17,19,21,23-24H,9-11H2,1H3/t14-,17+,19+,21-/m1/s1	KRPAMDJISYPLOJ-CUYZEOOHSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K69393995	BRD-K69393995-001-01-7	Broad Institute of MIT and Harvard	BRD-K69393995			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C21H22FNO7S/c1-28-20(25)10-14-9-17-16-8-13(4-7-18(16)30-21(17)19(11-24)29-14)23-31(26,27)15-5-2-12(22)3-6-15/h2-8,14,17,19,21,23-24H,9-11H2,1H3/t14-,17+,19+,21-/m1/s1	KRPAMDJISYPLOJ-CUYZEOOHSA-N	451.110100944							117393
BRD-K27067020	LSM-28843		54647419	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18+,22+,24-/m1/s1	HFXZOAOZNJYYEY-CXJARPSQSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K27067020	BRD-K27067020-001-01-7	Broad Institute of MIT and Harvard	BRD-K27067020			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18+,22+,24-/m1/s1	HFXZOAOZNJYYEY-CXJARPSQSA-N	469.201299226							117394
BRD-K00048155	LSM-28844		54647629	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19+,21-/m1/s1	IMSLJZJFFZYXRC-ZWVMGRIOSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K00048155	BRD-K00048155-001-01-5	Broad Institute of MIT and Harvard	BRD-K00048155			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccncc4)O[C@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19+,21-/m1/s1	IMSLJZJFFZYXRC-ZWVMGRIOSA-N	447.14640624							117395
BRD-K46942548	LSM-28845		54647648	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21-,23+,26+/m0/s1	UPMRBEOCYVNRMT-UAHYIAQRSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K46942548	BRD-K46942548-001-01-1	Broad Institute of MIT and Harvard	BRD-K46942548			COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@@H](CO)O2)cc1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21-,23+,26+/m0/s1	UPMRBEOCYVNRMT-UAHYIAQRSA-N	483.236935806							117396
BRD-K05181466	LSM-28846		54647425	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22-,24-,26+/m0/s1	GOWTXMJXNJEOKH-IFPZXYOKSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K05181466	BRD-K05181466-001-01-3	Broad Institute of MIT and Harvard	BRD-K05181466			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22-,24-,26+/m0/s1	GOWTXMJXNJEOKH-IFPZXYOKSA-N	500.29987042							117397
BRD-K69035249	LSM-28847		54647445	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26-,28-/m0/s1	CZQHDZKSVGPVAK-HYRFHYEVSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K69035249	BRD-K69035249-001-01-8	Broad Institute of MIT and Harvard	BRD-K69035249			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26-,28-/m0/s1	CZQHDZKSVGPVAK-HYRFHYEVSA-N	550.150678934							117398
BRD-K18003296	LSM-28848		54647464	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16+,20+,22-/m0/s1	IVKRNFCOUULTQI-VGOBXOCWSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	BroadT	BRD-K18003296	BRD-K18003296-001-01-0	Broad Institute of MIT and Harvard	BRD-K18003296			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16+,20+,22-/m0/s1	IVKRNFCOUULTQI-VGOBXOCWSA-N	443.185649162							117399
BRD-K56415410	LSM-28849		54647678	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26-,28+/m0/s1	GERXZWRQFCUSQI-IXQFDHPPSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NCc5cccc(F)c5)C[C@H]4c3c2	BroadT	BRD-K56415410	BRD-K56415410-001-01-0	Broad Institute of MIT and Harvard	BRD-K56415410			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cccc(F)c4)O[C@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26-,28+/m0/s1	GERXZWRQFCUSQI-IXQFDHPPSA-N	556.167950178							117400
BRD-K52989901	LSM-28850		54647689	InChI=1S/C23H27ClN2O4/c1-26(2)16-7-8-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-3-5-15(24)6-4-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19-,21+,23+/m1/s1	MOQWXNTXFGVTQQ-YZBYQZESSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(Cl)cc4)C[C@@H]3c2c1	BroadT	BRD-K52989901	BRD-K52989901-001-01-4	Broad Institute of MIT and Harvard	BRD-K52989901			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C23H27ClN2O4/c1-26(2)16-7-8-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-3-5-15(24)6-4-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19-,21+,23+/m1/s1	MOQWXNTXFGVTQQ-YZBYQZESSA-N	430.165935074							117401
BRD-K23669327	LSM-28851		54647646	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21+,23-,26-/m1/s1	UPMRBEOCYVNRMT-YDOBTQPPSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K23669327	BRD-K23669327-001-01-4	Broad Institute of MIT and Harvard	BRD-K23669327			COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@@H](CO)O2)cc1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21+,23-,26-/m1/s1	UPMRBEOCYVNRMT-YDOBTQPPSA-N	483.236935806							117402
BRD-K31483891	LSM-28852		54647480	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20+,23+,26-/m0/s1	UWAUWNPQHFTMFN-YESOXSADSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K31483891	BRD-K31483891-001-01-6	Broad Institute of MIT and Harvard	BRD-K31483891			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20+,23+,26-/m0/s1	UWAUWNPQHFTMFN-YESOXSADSA-N	486.196628416							117403
BRD-K83818372	LSM-28853		54647502	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14-,16-,19+/m0/s1	YUNRHRZDARIPJN-BCRCDCHUSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)N(C)C)C[C@H]3c2c1	BroadT	BRD-K83818372	BRD-K83818372-001-01-8	Broad Institute of MIT and Harvard	BRD-K83818372			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14-,16-,19+/m0/s1	YUNRHRZDARIPJN-BCRCDCHUSA-N	378.179086572							117404
BRD-K96485138	LSM-28854		54647590	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20-,22-,24+/m1/s1	UITZQDWRSZBATF-QSOCRCLWSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K96485138	BRD-K96485138-001-01-6	Broad Institute of MIT and Harvard	BRD-K96485138			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20-,22-,24+/m1/s1	UITZQDWRSZBATF-QSOCRCLWSA-N	472.166807326							117405
BRD-K65796649	LSM-28855		54647427	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22+,24+,26-/m1/s1	GOWTXMJXNJEOKH-GRTAZNFBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K65796649	BRD-K65796649-001-01-5	Broad Institute of MIT and Harvard	BRD-K65796649			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22+,24+,26-/m1/s1	GOWTXMJXNJEOKH-GRTAZNFBSA-N	500.29987042							117406
BRD-K15882320	LSM-28856		54647576	InChI=1S/C23H23F3N2O6/c1-32-20(30)10-15-9-17-16-8-14(6-7-18(16)34-21(17)19(11-29)33-15)28-22(31)27-13-4-2-12(3-5-13)23(24,25)26/h2-8,15,17,19,21,29H,9-11H2,1H3,(H2,27,28,31)/t15-,17-,19-,21+/m1/s1	MSQUSFAFSKSPPL-WELBPKCISA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	BroadT	BRD-K15882320	BRD-K15882320-001-01-0	Broad Institute of MIT and Harvard	BRD-K15882320			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C23H23F3N2O6/c1-32-20(30)10-15-9-17-16-8-14(6-7-18(16)34-21(17)19(11-29)33-15)28-22(31)27-13-4-2-12(3-5-13)23(24,25)26/h2-8,15,17,19,21,29H,9-11H2,1H3,(H2,27,28,31)/t15-,17-,19-,21+/m1/s1	MSQUSFAFSKSPPL-WELBPKCISA-N	480.150821076							117407
BRD-K67403750	LSM-28857		54647432	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25-,27+/m1/s1	RQEGAPRBBMLFLJ-BQGNDZODSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K67403750	BRD-K67403750-001-01-1	Broad Institute of MIT and Harvard	BRD-K67403750			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25-,27+/m1/s1	RQEGAPRBBMLFLJ-BQGNDZODSA-N	560.118413172							117408
BRD-K24997610	LSM-28858		54647509	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21-,23-,25+/m1/s1	MCJXNBRGFCMFNB-YTAKYCMFSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K24997610	BRD-K24997610-001-01-4	Broad Institute of MIT and Harvard	BRD-K24997610			OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21-,23-,25+/m1/s1	MCJXNBRGFCMFNB-YTAKYCMFSA-N	465.226371122							117409
BRD-K17790291	LSM-28859		54647525	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22-,25+/m0/s1	AANFNNZNKVIOFO-XZFMWLAQSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4cccc(F)c4)C[C@H]3c2c1	BroadT	BRD-K17790291	BRD-K17790291-001-01-8	Broad Institute of MIT and Harvard	BRD-K17790291			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cccc(F)c4)O[C@H]3CO)c2c1	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22-,25+/m0/s1	AANFNNZNKVIOFO-XZFMWLAQSA-N	471.21694929							117410
BRD-K85392247	LSM-28860		54647500	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m1/s1	XVGJFJFVLUTQTK-NARIEAHCSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K85392247	BRD-K85392247-001-01-5	Broad Institute of MIT and Harvard	BRD-K85392247			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m1/s1	XVGJFJFVLUTQTK-NARIEAHCSA-N	451.210721058							117411
BRD-K97562463	LSM-28861		54647491	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19-,23+,26+/m0/s1	WTUFVLVPXRCGPW-NFWWLHENSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc5OCOc5c4)C[C@H]3c2c1	BroadT	BRD-K97562463	BRD-K97562463-001-01-6	Broad Institute of MIT and Harvard	BRD-K97562463			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc5OCOc5c4)O[C@@H]3CO)c2c1	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19-,23+,26+/m0/s1	WTUFVLVPXRCGPW-NFWWLHENSA-N	497.216200362							117412
BRD-K96567801	LSM-28862		54647409	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20-,22-,25+/m0/s1	IZLHCVQHHLSMHG-XZFMWLAQSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K96567801	BRD-K96567801-001-01-7	Broad Institute of MIT and Harvard	BRD-K96567801			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20-,22-,25+/m0/s1	IZLHCVQHHLSMHG-XZFMWLAQSA-N	442.246772208							117413
BRD-K04722226	LSM-28863		54647652	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20+,24+,27-/m0/s1	LBWAYGFZRYCTOK-NNMBSPQGSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K04722226	BRD-K04722226-001-01-6	Broad Institute of MIT and Harvard	BRD-K04722226			OC[C@H]1O[C@@H](C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21)CC(=O)NCc1ccc2OCOc2c1	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20+,24+,27-/m0/s1	LBWAYGFZRYCTOK-NNMBSPQGSA-N	494.20530132							117414
BRD-K86208187	LSM-28864		54647533	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25-,27+/m0/s1	IOAZXSSJEHBWSP-WHTZKJIOSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K86208187	BRD-K86208187-001-01-4	Broad Institute of MIT and Harvard	BRD-K86208187			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25-,27+/m0/s1	IOAZXSSJEHBWSP-WHTZKJIOSA-N	544.147963662							117415
BRD-K03305572	LSM-28865		54647626	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19-,21+/m1/s1	IMSLJZJFFZYXRC-WELBPKCISA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K03305572	BRD-K03305572-001-01-1	Broad Institute of MIT and Harvard	BRD-K03305572			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccncc4)O[C@@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19-,21+/m1/s1	IMSLJZJFFZYXRC-WELBPKCISA-N	447.14640624							117416
BRD-K75807957	LSM-28866		54647494	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,25+/m0/s1	XVGJFJFVLUTQTK-XZFMWLAQSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K75807957	BRD-K75807957-001-01-4	Broad Institute of MIT and Harvard	BRD-K75807957			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,25+/m0/s1	XVGJFJFVLUTQTK-XZFMWLAQSA-N	451.210721058							117417
BRD-K77663497	LSM-28867		54647682	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26-,28-/m0/s1	GERXZWRQFCUSQI-FMWRLIIDSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NCc5cccc(F)c5)C[C@@H]4c3c2	BroadT	BRD-K77663497	BRD-K77663497-001-01-6	Broad Institute of MIT and Harvard	BRD-K77663497			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cccc(F)c4)O[C@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26-,28-/m0/s1	GERXZWRQFCUSQI-FMWRLIIDSA-N	556.167950178							117418
BRD-K16705729	LSM-28868		54647400	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22-,25-,27+/m1/s1	DFSRPXMSRAMRJF-GKYRZQBGSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@@H](CO)O2	BroadT	BRD-K16705729	BRD-K16705729-001-01-9	Broad Institute of MIT and Harvard	BRD-K16705729			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22-,25-,27+/m1/s1	DFSRPXMSRAMRJF-GKYRZQBGSA-N	509.25258587							117419
BRD-K90133770	LSM-28869		54647601	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22+,24+,26-/m1/s1	OBJFROVCRIKTIC-GRTAZNFBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCCC5)cc34	BroadT	BRD-K90133770	BRD-K90133770-001-01-1	Broad Institute of MIT and Harvard	BRD-K90133770			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22+,24+,26-/m1/s1	OBJFROVCRIKTIC-GRTAZNFBSA-N	494.252920228							117420
BRD-K99728124	LSM-28870		54647443	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26+,28-/m1/s1	CZQHDZKSVGPVAK-HAGKMHAYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K99728124	BRD-K99728124-001-01-2	Broad Institute of MIT and Harvard	BRD-K99728124			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26+,28-/m1/s1	CZQHDZKSVGPVAK-HAGKMHAYSA-N	550.150678934							117421
BRD-K53706972	LSM-28871		54647593	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20+,22+,24-/m1/s1	UITZQDWRSZBATF-HLPIXKIESA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K53706972	BRD-K53706972-001-01-5	Broad Institute of MIT and Harvard	BRD-K53706972			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20+,22+,24-/m1/s1	UITZQDWRSZBATF-HLPIXKIESA-N	472.166807326							117422
BRD-K66419338	LSM-28872		54647666	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,23+/m1/s1	CLWRRFDHWRUPJJ-WVVHNUNQSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccccn4)C[C@@H]3c2c1	BroadT	BRD-K66419338	BRD-K66419338-001-01-9	Broad Institute of MIT and Harvard	BRD-K66419338			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccn4)O[C@@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,23+/m1/s1	CLWRRFDHWRUPJJ-WVVHNUNQSA-N	441.189985614							117423
BRD-K49050984-001-01-1	LSM-28873	BRD-K49050984	54647676	InChI=1S/C19H26N2O6/c1-21(2)9-17(23)20-11-4-5-15-13(6-11)14-7-12(8-18(24)25-3)26-16(10-22)19(14)27-15/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14-,16-,19+/m1/s1	IMIOHDVFACJXOK-QNDNMDDASA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	BroadT	BRD-K49050984	BRD-K49050984-001-02-9	Broad Institute of MIT and Harvard	BRD-K49050984			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	InChI=1S/C19H26N2O6/c1-21(2)9-17(23)20-11-4-5-15-13(6-11)14-7-12(8-18(24)25-3)26-16(10-22)19(14)27-15/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14-,16-,19+/m1/s1	IMIOHDVFACJXOK-QNDNMDDASA-N	378.179086572							117424
BRD-K14813155	LSM-28874		54647625	InChI=1S/C22H24N2O6/c1-28-21(27)11-15-10-17-16-9-14(24-20(26)8-13-4-6-23-7-5-13)2-3-18(16)30-22(17)19(12-25)29-15/h2-7,9,15,17,19,22,25H,8,10-12H2,1H3,(H,24,26)/t15-,17-,19+,22+/m0/s1	WSHDHBDWIVSZGZ-RNCHUUSHSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	BroadT	BRD-K14813155	BRD-K14813155-001-01-6	Broad Institute of MIT and Harvard	BRD-K14813155			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-21(27)11-15-10-17-16-9-14(24-20(26)8-13-4-6-23-7-5-13)2-3-18(16)30-22(17)19(12-25)29-15/h2-7,9,15,17,19,22,25H,8,10-12H2,1H3,(H,24,26)/t15-,17-,19+,22+/m0/s1	WSHDHBDWIVSZGZ-RNCHUUSHSA-N	412.163436508							117425
BRD-K46737746	LSM-28875		54647587	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21+,23-,26-/m0/s1	OSBPWUGUGZAKLO-OXPRRSNCSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K46737746	BRD-K46737746-001-01-5	Broad Institute of MIT and Harvard	BRD-K46737746			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21+,23-,26-/m0/s1	OSBPWUGUGZAKLO-OXPRRSNCSA-N	471.273321314							117426
BRD-K55855103	LSM-28876		54647606	InChI=1S/C18H26N2O4/c1-19(2)11-5-6-15-13(7-11)14-8-12(9-17(22)20(3)4)23-16(10-21)18(14)24-15/h5-7,12,14,16,18,21H,8-10H2,1-4H3/t12-,14-,16-,18+/m1/s1	NLXCGGAGMQYKJV-BQUDOFGOSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	BroadT	BRD-K55855103	BRD-K55855103-001-01-0	Broad Institute of MIT and Harvard	BRD-K55855103			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	InChI=1S/C18H26N2O4/c1-19(2)11-5-6-15-13(7-11)14-8-12(9-17(22)20(3)4)23-16(10-21)18(14)24-15/h5-7,12,14,16,18,21H,8-10H2,1-4H3/t12-,14-,16-,18+/m1/s1	NLXCGGAGMQYKJV-BQUDOFGOSA-N	334.189257332							117427
BRD-K87853964	LSM-28877		54647492	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19-,23+,26+/m1/s1	WTUFVLVPXRCGPW-ZNYLKJNCSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc5OCOc5c4)C[C@@H]3c2c1	BroadT	BRD-K87853964	BRD-K87853964-001-01-5	Broad Institute of MIT and Harvard	BRD-K87853964			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc5OCOc5c4)O[C@H]3CO)c2c1	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19-,23+,26+/m1/s1	WTUFVLVPXRCGPW-ZNYLKJNCSA-N	497.216200362							117428
BRD-K22380647	LSM-28878		54647624	InChI=1S/C22H24N2O6/c1-28-21(27)11-15-10-17-16-9-14(24-20(26)8-13-4-6-23-7-5-13)2-3-18(16)30-22(17)19(12-25)29-15/h2-7,9,15,17,19,22,25H,8,10-12H2,1H3,(H,24,26)/t15-,17+,19-,22-/m0/s1	WSHDHBDWIVSZGZ-VYXPOXFGSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	BroadT	BRD-K22380647	BRD-K22380647-001-01-2	Broad Institute of MIT and Harvard	BRD-K22380647			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-21(27)11-15-10-17-16-9-14(24-20(26)8-13-4-6-23-7-5-13)2-3-18(16)30-22(17)19(12-25)29-15/h2-7,9,15,17,19,22,25H,8,10-12H2,1H3,(H,24,26)/t15-,17+,19-,22-/m0/s1	WSHDHBDWIVSZGZ-VYXPOXFGSA-N	412.163436508							117429
BRD-K08300592	LSM-28879		54647697	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19-,21-,24+/m1/s1	LQLAETCVZWZFIB-ISYUWZRGSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K08300592	BRD-K08300592-001-01-3	Broad Institute of MIT and Harvard	BRD-K08300592			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19-,21-,24+/m1/s1	LQLAETCVZWZFIB-ISYUWZRGSA-N	428.231122144							117430
BRD-K91615044	LSM-28880		54647455	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17-,19-,21+/m0/s1	ZQPIRYHZQRYESG-WRGRXTPVSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K91615044	BRD-K91615044-001-01-6	Broad Institute of MIT and Harvard	BRD-K91615044			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17-,19-,21+/m0/s1	ZQPIRYHZQRYESG-WRGRXTPVSA-N	417.226371122							117431
BRD-K25646425	LSM-28881		54647474	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19-,22-/m1/s1	HRBYSLULMJVYNQ-MDDDDHJVSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K25646425	BRD-K25646425-001-01-1	Broad Institute of MIT and Harvard	BRD-K25646425			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19-,22-/m1/s1	HRBYSLULMJVYNQ-MDDDDHJVSA-N	418.2103867							117432
BRD-K78747341	LSM-28882		54647453	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20-,24+,26+/m0/s1	UYPIQWDIZXMNDJ-DCCOOJGFSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K78747341	BRD-K78747341-001-01-4	Broad Institute of MIT and Harvard	BRD-K78747341			OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20-,24+,26+/m0/s1	UYPIQWDIZXMNDJ-DCCOOJGFSA-N	506.196548204							117433
BRD-K47673408	LSM-28883		54647566	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20+,22-,25-/m0/s1	CMSFJVGZZAIMOJ-GPYREICYSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCCc4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K47673408	BRD-K47673408-001-01-0	Broad Institute of MIT and Harvard	BRD-K47673408			COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](C[C@@H]3c2c1)CC(=O)NCCc1ccccc1	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20+,22-,25-/m0/s1	CMSFJVGZZAIMOJ-GPYREICYSA-N	454.2103867							117434
BRD-K88313926	LSM-28884		54647574	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27-,29+,32+/m0/s1	NKIFYSADZLZERH-JSENQENOSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@@H]4[C@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K88313926	BRD-K88313926-001-01-6	Broad Institute of MIT and Harvard	BRD-K88313926			OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27-,29+,32+/m0/s1	NKIFYSADZLZERH-JSENQENOSA-N	526.246772208							117435
BRD-K85284710	LSM-28885		54647451	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20+,24-,26-/m1/s1	UYPIQWDIZXMNDJ-DJKZJWHWSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K85284710	BRD-K85284710-001-01-2	Broad Institute of MIT and Harvard	BRD-K85284710			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H27FN4O5/c28-21-3-1-2-4-22(21)32-27(35)31-17-5-6-23-19(11-17)20-12-18(36-24(15-33)26(20)37-23)13-25(34)30-14-16-7-9-29-10-8-16/h1-11,18,20,24,26,33H,12-15H2,(H,30,34)(H2,31,32,35)/t18-,20+,24-,26-/m1/s1	UYPIQWDIZXMNDJ-DJKZJWHWSA-N	506.196548204							117436
BRD-K58286708	LSM-28886		54647596	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20-,22+,24+/m0/s1	UITZQDWRSZBATF-HYWXBTQMSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K58286708	BRD-K58286708-001-01-4	Broad Institute of MIT and Harvard	BRD-K58286708			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20-,22+,24+/m0/s1	UITZQDWRSZBATF-HYWXBTQMSA-N	472.166807326							117437
BRD-K96627018	LSM-28887		54647631	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19-,21-/m0/s1	IMSLJZJFFZYXRC-MRCYXTNMSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K96627018	BRD-K96627018-001-01-8	Broad Institute of MIT and Harvard	BRD-K96627018			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccncc4)O[C@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19-,21-/m0/s1	IMSLJZJFFZYXRC-MRCYXTNMSA-N	447.14640624							117438
BRD-K25388406	LSM-15124		54647490	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19+,23-,26-/m0/s1	WTUFVLVPXRCGPW-RJOXYXJUSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc5OCOc5c4)C[C@@H]3c2c1	BroadT	BRD-K25388406	BRD-K25388406-001-01-3	Broad Institute of MIT and Harvard	BRD-K25388406			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc5OCOc5c4)O[C@H]3CO)c2c1	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19+,23-,26-/m0/s1	WTUFVLVPXRCGPW-RJOXYXJUSA-N	497.216200362							103780
BRD-K29061997	LSM-28888		54647479	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20-,23-,26+/m0/s1	UWAUWNPQHFTMFN-AHNRGXKQSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K29061997	BRD-K29061997-001-01-7	Broad Institute of MIT and Harvard	BRD-K29061997			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20-,23-,26+/m0/s1	UWAUWNPQHFTMFN-AHNRGXKQSA-N	486.196628416							117439
BRD-K59930979	LSM-28889		54647598	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22-,24-,26+/m1/s1	OBJFROVCRIKTIC-DFICYWPVSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCCC5)cc34	BroadT	BRD-K59930979	BRD-K59930979-001-01-8	Broad Institute of MIT and Harvard	BRD-K59930979			OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22-,24-,26+/m1/s1	OBJFROVCRIKTIC-DFICYWPVSA-N	494.252920228							117440
BRD-K93567937	LSM-28890		54647667	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,23+/m0/s1	CLWRRFDHWRUPJJ-LUFCQUEKSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccn4)C[C@H]3c2c1	BroadT	BRD-K93567937	BRD-K93567937-001-01-7	Broad Institute of MIT and Harvard	BRD-K93567937			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccn4)O[C@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,23+/m0/s1	CLWRRFDHWRUPJJ-LUFCQUEKSA-N	441.189985614							117441
BRD-K38345640	LSM-28891		54647657	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20-,24+,27+/m1/s1	LBWAYGFZRYCTOK-GVVXZHHHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K38345640	BRD-K38345640-001-01-4	Broad Institute of MIT and Harvard	BRD-K38345640			OC[C@@H]1O[C@H](C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21)CC(=O)NCc1ccc2OCOc2c1	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20-,24+,27+/m1/s1	LBWAYGFZRYCTOK-GVVXZHHHSA-N	494.20530132							117442
BRD-K51051798-001-01-0	LSM-28892	BRD-K51051798	54647686	InChI=1S/C23H27ClN2O4/c1-26(2)16-7-8-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-3-5-15(24)6-4-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19+,21-,23-/m1/s1	MOQWXNTXFGVTQQ-GUBFDYSESA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(Cl)cc4)C[C@H]3c2c1	BroadT	BRD-K51051798	BRD-K51051798-001-01-0	Broad Institute of MIT and Harvard	BRD-K51051798			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C23H27ClN2O4/c1-26(2)16-7-8-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-3-5-15(24)6-4-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19+,21-,23-/m1/s1	MOQWXNTXFGVTQQ-GUBFDYSESA-N	430.165935074							117443
BRD-K31844308	LSM-28893		54647668	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,23-/m0/s1	CLWRRFDHWRUPJJ-MVIJMRCYSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccccn4)C[C@@H]3c2c1	BroadT	BRD-K31844308	BRD-K31844308-001-01-6	Broad Institute of MIT and Harvard	BRD-K31844308			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccn4)O[C@@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,23-/m0/s1	CLWRRFDHWRUPJJ-MVIJMRCYSA-N	441.189985614							117444
BRD-K66013406	LSM-28894		54647674	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15-,19-,21+/m1/s1	YVFPRJXGACQPOR-CKJDJMSUSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	BroadT	BRD-K66013406	BRD-K66013406-001-01-7	Broad Institute of MIT and Harvard	BRD-K66013406			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15-,19-,21+/m1/s1	YVFPRJXGACQPOR-CKJDJMSUSA-N	430.154014676							117445
MLS003129069	LSM-28895	BRD-K19590405, SID99359674	46904236	InChI=1S/C22H24N2O6/c1-28-21(27)11-15-10-17-16-9-14(24-20(26)8-13-4-6-23-7-5-13)2-3-18(16)30-22(17)19(12-25)29-15/h2-7,9,15,17,19,22,25H,8,10-12H2,1H3,(H,24,26)/t15-,17+,19-,22-/m1/s1	WSHDHBDWIVSZGZ-MDDDDHJVSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	BroadT	BRD-K19590405	BRD-K19590405-001-02-1	Broad Institute of MIT and Harvard	BRD-K19590405			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-21(27)11-15-10-17-16-9-14(24-20(26)8-13-4-6-23-7-5-13)2-3-18(16)30-22(17)19(12-25)29-15/h2-7,9,15,17,19,22,25H,8,10-12H2,1H3,(H,24,26)/t15-,17+,19-,22-/m1/s1	WSHDHBDWIVSZGZ-MDDDDHJVSA-N	412.163436508							117446
BRD-K81801123	LSM-28896		54647636	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25+,27+,30-/m0/s1	GRQDGDFBWRYOPG-MFYQUPDPSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@@H]3c2c1	BroadT	BRD-K81801123	BRD-K81801123-001-01-8	Broad Institute of MIT and Harvard	BRD-K81801123			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](C[C@@H]3c2c1)CC(=O)NCc1ccc(cc1)-c1ccccc1	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25+,27+,30-/m0/s1	GRQDGDFBWRYOPG-MFYQUPDPSA-N	516.226036764							117447
BRD-K39962926	LSM-28897		54647436	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25-,27-/m1/s1	RQEGAPRBBMLFLJ-MBHFTIIHSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K39962926	BRD-K39962926-001-01-0	Broad Institute of MIT and Harvard	BRD-K39962926			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25-,27-/m1/s1	RQEGAPRBBMLFLJ-MBHFTIIHSA-N	560.118413172							117448
BRD-K83916197	LSM-28898		54647421	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18+,22-,24-/m0/s1	HFXZOAOZNJYYEY-YDGOEMPPSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K83916197	BRD-K83916197-001-01-3	Broad Institute of MIT and Harvard	BRD-K83916197			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18+,22-,24-/m0/s1	HFXZOAOZNJYYEY-YDGOEMPPSA-N	469.201299226							117449
BRD-K70721203	LSM-28899		54647522	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m0/s1	MZEYKMYWBLWBBR-FZIATNMDSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K70721203	BRD-K70721203-001-01-4	Broad Institute of MIT and Harvard	BRD-K70721203			OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m0/s1	MZEYKMYWBLWBBR-FZIATNMDSA-N	451.210721058							117450
BRD-K90694955	LSM-28900		54647655	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20+,24-,27-/m0/s1	LBWAYGFZRYCTOK-YCEIVECKSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K90694955	BRD-K90694955-001-01-9	Broad Institute of MIT and Harvard	BRD-K90694955			OC[C@@H]1O[C@@H](C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21)CC(=O)NCc1ccc2OCOc2c1	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20+,24-,27-/m0/s1	LBWAYGFZRYCTOK-YCEIVECKSA-N	494.20530132							117451
BRD-K28596340	LSM-28901		54647545	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13-,15-,17+/m1/s1	ILXKPNUBZXTBRO-MDRZDLKXSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K28596340	BRD-K28596340-001-01-7	Broad Institute of MIT and Harvard	BRD-K28596340			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13-,15-,17+/m1/s1	ILXKPNUBZXTBRO-MDRZDLKXSA-N	384.135507198							117452
BRD-K62147342	LSM-28902		54647456	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17+,19+,21-/m0/s1	ZQPIRYHZQRYESG-RWCSOYMTSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K62147342	BRD-K62147342-001-01-4	Broad Institute of MIT and Harvard	BRD-K62147342			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17+,19+,21-/m0/s1	ZQPIRYHZQRYESG-RWCSOYMTSA-N	417.226371122							117453
BRD-K93836438	LSM-28903		54647504	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16+,19-/m0/s1	YUNRHRZDARIPJN-AXJQOJOCSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)N(C)C)C[C@@H]3c2c1	BroadT	BRD-K93836438	BRD-K93836438-001-01-0	Broad Institute of MIT and Harvard	BRD-K93836438			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16+,19-/m0/s1	YUNRHRZDARIPJN-AXJQOJOCSA-N	378.179086572							117454
BRD-K36031198	LSM-28904		54647653	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20+,24+,27-/m1/s1	LBWAYGFZRYCTOK-GRQFOZIHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K36031198	BRD-K36031198-001-01-8	Broad Institute of MIT and Harvard	BRD-K36031198			OC[C@@H]1O[C@H](C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21)CC(=O)NCc1ccc2OCOc2c1	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20+,24+,27-/m1/s1	LBWAYGFZRYCTOK-GRQFOZIHSA-N	494.20530132							117455
BRD-K81949875	LSM-28905		54647690	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15-,17-,20+/m1/s1	PIWWRJKYNWMMLJ-PCFVDWANSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K81949875	BRD-K81949875-001-01-5	Broad Institute of MIT and Harvard	BRD-K81949875			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15-,17-,20+/m1/s1	PIWWRJKYNWMMLJ-PCFVDWANSA-N	442.17155652							117456
BRD-K67783817	LSM-28906		54647518	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,25+/m0/s1	MZEYKMYWBLWBBR-XZFMWLAQSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K67783817	BRD-K67783817-001-01-7	Broad Institute of MIT and Harvard	BRD-K67783817			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,25+/m0/s1	MZEYKMYWBLWBBR-XZFMWLAQSA-N	451.210721058							117457
BRD-K47326075	LSM-28907		54647611	InChI=1S/C21H22FNO7S/c1-28-20(25)10-14-9-17-16-8-13(4-7-18(16)30-21(17)19(11-24)29-14)23-31(26,27)15-5-2-12(22)3-6-15/h2-8,14,17,19,21,23-24H,9-11H2,1H3/t14-,17-,19+,21+/m0/s1	KRPAMDJISYPLOJ-QBGRRASTSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K47326075	BRD-K47326075-001-01-7	Broad Institute of MIT and Harvard	BRD-K47326075			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C21H22FNO7S/c1-28-20(25)10-14-9-17-16-8-13(4-7-18(16)30-21(17)19(11-24)29-14)23-31(26,27)15-5-2-12(22)3-6-15/h2-8,14,17,19,21,23-24H,9-11H2,1H3/t14-,17-,19+,21+/m0/s1	KRPAMDJISYPLOJ-QBGRRASTSA-N	451.110100944							117458
BRD-K96981233	LSM-28908		54647642	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21-,23-,26+/m1/s1	UPMRBEOCYVNRMT-INZVZTLUSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K96981233	BRD-K96981233-001-01-8	Broad Institute of MIT and Harvard	BRD-K96981233			COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@@H](CO)O2)cc1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21-,23-,26+/m1/s1	UPMRBEOCYVNRMT-INZVZTLUSA-N	483.236935806							117459
MLS003130013	LSM-28909	BRD-K06576075, SID121282543	51358837	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29+,31-,33-/m0/s1	BHEWHBNGLCOXBN-RWIDMMHGSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K06576075	BRD-K06576075-001-02-4	Broad Institute of MIT and Harvard	BRD-K06576075			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29+,31-,33-/m0/s1	BHEWHBNGLCOXBN-RWIDMMHGSA-N	618.183600242							117460
BRD-K84601599	LSM-28910		54647612	InChI=1S/C21H22FNO7S/c1-28-20(25)10-14-9-17-16-8-13(4-7-18(16)30-21(17)19(11-24)29-14)23-31(26,27)15-5-2-12(22)3-6-15/h2-8,14,17,19,21,23-24H,9-11H2,1H3/t14-,17-,19+,21+/m1/s1	KRPAMDJISYPLOJ-DYZHCLJRSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K84601599	BRD-K84601599-001-01-4	Broad Institute of MIT and Harvard	BRD-K84601599			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C21H22FNO7S/c1-28-20(25)10-14-9-17-16-8-13(4-7-18(16)30-21(17)19(11-24)29-14)23-31(26,27)15-5-2-12(22)3-6-15/h2-8,14,17,19,21,23-24H,9-11H2,1H3/t14-,17-,19+,21+/m1/s1	KRPAMDJISYPLOJ-DYZHCLJRSA-N	451.110100944							117461
BRD-K51175229	LSM-28911		54647513	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21+,23-,25-/m1/s1	MCJXNBRGFCMFNB-RIPRBREISA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K51175229	BRD-K51175229-001-01-6	Broad Institute of MIT and Harvard	BRD-K51175229			OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21+,23-,25-/m1/s1	MCJXNBRGFCMFNB-RIPRBREISA-N	465.226371122							117462
BRD-K13761649	LSM-28912		54647539	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25+,27+/m1/s1	IOAZXSSJEHBWSP-BQLGRQSHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K13761649	BRD-K13761649-001-01-2	Broad Institute of MIT and Harvard	BRD-K13761649			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25+,27+/m1/s1	IOAZXSSJEHBWSP-BQLGRQSHSA-N	544.147963662							117463
BRD-K90157100	LSM-28913		54647468	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16-,20+,22+/m0/s1	IVKRNFCOUULTQI-MFYXDEDASA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	BroadT	BRD-K90157100	BRD-K90157100-001-01-1	Broad Institute of MIT and Harvard	BRD-K90157100			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16-,20+,22+/m0/s1	IVKRNFCOUULTQI-MFYXDEDASA-N	443.185649162							117464
BRD-K71537757	LSM-28914		54647438	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25+,27+/m0/s1	RQEGAPRBBMLFLJ-MUUNGVPUSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K71537757	BRD-K71537757-001-01-3	Broad Institute of MIT and Harvard	BRD-K71537757			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25+,27+/m0/s1	RQEGAPRBBMLFLJ-MUUNGVPUSA-N	560.118413172							117465
BRD-K15008902	LSM-28915		54647459	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17+,19-,21-/m0/s1	ZQPIRYHZQRYESG-MRCYXTNMSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K15008902	BRD-K15008902-001-01-8	Broad Institute of MIT and Harvard	BRD-K15008902			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17+,19-,21-/m0/s1	ZQPIRYHZQRYESG-MRCYXTNMSA-N	417.226371122							117466
BRD-K09137343	LSM-28916		54647622	InChI=1S/C22H24N2O6/c1-28-21(27)11-15-10-17-16-9-14(24-20(26)8-13-4-6-23-7-5-13)2-3-18(16)30-22(17)19(12-25)29-15/h2-7,9,15,17,19,22,25H,8,10-12H2,1H3,(H,24,26)/t15-,17-,19-,22+/m0/s1	WSHDHBDWIVSZGZ-MNNBHYOVSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	BroadT	BRD-K09137343	BRD-K09137343-001-01-0	Broad Institute of MIT and Harvard	BRD-K09137343			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-21(27)11-15-10-17-16-9-14(24-20(26)8-13-4-6-23-7-5-13)2-3-18(16)30-22(17)19(12-25)29-15/h2-7,9,15,17,19,22,25H,8,10-12H2,1H3,(H,24,26)/t15-,17-,19-,22+/m0/s1	WSHDHBDWIVSZGZ-MNNBHYOVSA-N	412.163436508							117467
BRD-K06367273	LSM-28917		54647556	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17+,19+,22-/m0/s1	POXOUGQYINQDTJ-YZYYZOEUSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K06367273	BRD-K06367273-001-01-0	Broad Institute of MIT and Harvard	BRD-K06367273			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17+,19+,22-/m0/s1	POXOUGQYINQDTJ-YZYYZOEUSA-N	417.226371122							117468
BRD-K08982277	LSM-28918		54647497	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m1/s1	XVGJFJFVLUTQTK-DPQLKAKJSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K08982277	BRD-K08982277-001-01-0	Broad Institute of MIT and Harvard	BRD-K08982277			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m1/s1	XVGJFJFVLUTQTK-DPQLKAKJSA-N	451.210721058							117469
BRD-K17128952	LSM-28919		54647562	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20-,22-,25+/m0/s1	CMSFJVGZZAIMOJ-XZFMWLAQSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCCc4ccccc4)C[C@H]3c2c1	BroadT	BRD-K17128952	BRD-K17128952-001-01-1	Broad Institute of MIT and Harvard	BRD-K17128952			COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](C[C@H]3c2c1)CC(=O)NCCc1ccccc1	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20-,22-,25+/m0/s1	CMSFJVGZZAIMOJ-XZFMWLAQSA-N	454.2103867							117470
BRD-K10288935	LSM-28920		54647701	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19+,21-,24-/m1/s1	LQLAETCVZWZFIB-RMIRKMSDSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K10288935	BRD-K10288935-001-01-2	Broad Institute of MIT and Harvard	BRD-K10288935			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19+,21-,24-/m1/s1	LQLAETCVZWZFIB-RMIRKMSDSA-N	428.231122144							117471
BRD-K00542622	LSM-28921		54647399	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19-,21+,24+/m1/s1	LQLAETCVZWZFIB-GOSIJUEPSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K00542622	BRD-K00542622-001-01-2	Broad Institute of MIT and Harvard	BRD-K00542622			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19-,21+,24+/m1/s1	LQLAETCVZWZFIB-GOSIJUEPSA-N	428.231122144							117472
BRD-K72773309	LSM-28922		54647542	InChI=1S/C23H25F3N2O7S/c1-33-14-3-2-4-16(8-14)36(31,32)28-13-5-6-19-17(7-13)18-9-15(34-20(11-29)22(18)35-19)10-21(30)27-12-23(24,25)26/h2-8,15,18,20,22,28-29H,9-12H2,1H3,(H,27,30)/t15-,18+,20+,22-/m1/s1	MZKZWNSKYYIKNG-LAKFJOCUSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]4c3c2	BroadT	BRD-K72773309	BRD-K72773309-001-01-6	Broad Institute of MIT and Harvard	BRD-K72773309			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](C[C@H]3c2c1)CC(=O)NCC(F)(F)F	InChI=1S/C23H25F3N2O7S/c1-33-14-3-2-4-16(8-14)36(31,32)28-13-5-6-19-17(7-13)18-9-15(34-20(11-29)22(18)35-19)10-21(30)27-12-23(24,25)26/h2-8,15,18,20,22,28-29H,9-12H2,1H3,(H,27,30)/t15-,18+,20+,22-/m1/s1	MZKZWNSKYYIKNG-LAKFJOCUSA-N	530.13345645							117473
BRD-K89399989	LSM-28923		54647417	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18-,22-,24+/m0/s1	HFXZOAOZNJYYEY-GODDJFOZSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K89399989	BRD-K89399989-001-01-8	Broad Institute of MIT and Harvard	BRD-K89399989			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18-,22-,24+/m0/s1	HFXZOAOZNJYYEY-GODDJFOZSA-N	469.201299226							117474
BRD-K09414286	LSM-28924		54647613	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15-,19-,21+/m1/s1	FNDPGVQZUOXHHT-CKJDJMSUSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K09414286	BRD-K09414286-001-01-2	Broad Institute of MIT and Harvard	BRD-K09414286			OC[C@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15-,19-,21+/m1/s1	FNDPGVQZUOXHHT-CKJDJMSUSA-N	427.126716642							117475
BRD-K01643633	LSM-28925		54647465	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16+,20+,22-/m1/s1	IVKRNFCOUULTQI-BJKXHWDHSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	BroadT	BRD-K01643633	BRD-K01643633-001-01-4	Broad Institute of MIT and Harvard	BRD-K01643633			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16+,20+,22-/m1/s1	IVKRNFCOUULTQI-BJKXHWDHSA-N	443.185649162							117476
BRD-K26232524	LSM-28926		54647560	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17-,19+,22+/m1/s1	POXOUGQYINQDTJ-XUAYLNFESA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K26232524	BRD-K26232524-001-01-9	Broad Institute of MIT and Harvard	BRD-K26232524			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17-,19+,22+/m1/s1	POXOUGQYINQDTJ-XUAYLNFESA-N	417.226371122							117477
BRD-K76114616	LSM-28927		54647512	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21+,23+,25-/m1/s1	MCJXNBRGFCMFNB-IQKBUIRBSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K76114616	BRD-K76114616-001-01-7	Broad Institute of MIT and Harvard	BRD-K76114616			OC[C@@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21+,23+,25-/m1/s1	MCJXNBRGFCMFNB-IQKBUIRBSA-N	465.226371122							117478
BRD-K75710031	LSM-28928		54647664	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19-,21+,24+/m0/s1	NDUFHUOGHUIKBH-NOOBJOLFSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCCN4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K75710031	BRD-K75710031-001-01-0	Broad Institute of MIT and Harvard	BRD-K75710031			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCCN4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19-,21+,24+/m0/s1	NDUFHUOGHUIKBH-NOOBJOLFSA-N	461.25258587							117479
BRD-K86039224	LSM-28929		54647680	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26+,28-/m1/s1	GERXZWRQFCUSQI-HWMSKCLUSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NCc5cccc(F)c5)C[C@H]4c3c2	BroadT	BRD-K86039224	BRD-K86039224-001-01-8	Broad Institute of MIT and Harvard	BRD-K86039224			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cccc(F)c4)O[C@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-20-6-3-7-22(12-20)39(34,35)31-19-8-9-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-4-2-5-18(29)10-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26+,28-/m1/s1	GERXZWRQFCUSQI-HWMSKCLUSA-N	556.167950178							117480
BRD-K66408914	LSM-28930		54647484	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20-,23+,26+/m0/s1	UWAUWNPQHFTMFN-DOYXTRFRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K66408914	BRD-K66408914-001-01-4	Broad Institute of MIT and Harvard	BRD-K66408914			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20-,23+,26+/m0/s1	UWAUWNPQHFTMFN-DOYXTRFRSA-N	486.196628416							117481
MLS003128958	LSM-28931	SID99359522, BRD-K37975228	46904084	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17-,19-,21+/m1/s1	BVQWYDMOVFWUGX-WELBPKCISA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K37975228	BRD-K37975228-001-02-7	Broad Institute of MIT and Harvard	BRD-K37975228			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17-,19-,21+/m1/s1	BVQWYDMOVFWUGX-WELBPKCISA-N	412.163436508							117482
BRD-K75135426	LSM-28932		54647618	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15+,19-,21-/m0/s1	FNDPGVQZUOXHHT-FPDBKICDSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K75135426	BRD-K75135426-001-01-3	Broad Institute of MIT and Harvard	BRD-K75135426			OC[C@@H]1O[C@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15+,19-,21-/m0/s1	FNDPGVQZUOXHHT-FPDBKICDSA-N	427.126716642							117483
BRD-K32949071	LSM-28933		54647547	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13+,15+,17-/m0/s1	ILXKPNUBZXTBRO-IYDIDCQVSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K32949071	BRD-K32949071-001-01-7	Broad Institute of MIT and Harvard	BRD-K32949071			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13+,15+,17-/m0/s1	ILXKPNUBZXTBRO-IYDIDCQVSA-N	384.135507198							117484
BRD-K02637850	LSM-28934		54647568	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20-,22+,25+/m1/s1	CMSFJVGZZAIMOJ-NARIEAHCSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCCc4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K02637850	BRD-K02637850-001-01-1	Broad Institute of MIT and Harvard	BRD-K02637850			COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](C[C@@H]3c2c1)CC(=O)NCCc1ccccc1	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20-,22+,25+/m1/s1	CMSFJVGZZAIMOJ-NARIEAHCSA-N	454.2103867							117485
BRD-K02844551	LSM-28935		54647627	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19-,21+/m0/s1	IMSLJZJFFZYXRC-WRGRXTPVSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K02844551	BRD-K02844551-001-01-5	Broad Institute of MIT and Harvard	BRD-K02844551			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccncc4)O[C@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-14-2-3-18-16(8-14)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-13-4-6-22-7-5-13/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19-,21+/m0/s1	IMSLJZJFFZYXRC-WRGRXTPVSA-N	447.14640624							117486
BRD-K43969492	LSM-28936		54647411	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20+,22+,25-/m1/s1	IZLHCVQHHLSMHG-XOQZDTPSSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K43969492	BRD-K43969492-001-01-3	Broad Institute of MIT and Harvard	BRD-K43969492			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20+,22+,25-/m1/s1	IZLHCVQHHLSMHG-XOQZDTPSSA-N	442.246772208							117487
BRD-K57404319	LSM-28937		54647430	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22-,24+,26+/m0/s1	GOWTXMJXNJEOKH-LFSKCEFNSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K57404319	BRD-K57404319-001-01-5	Broad Institute of MIT and Harvard	BRD-K57404319			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22-,24+,26+/m0/s1	GOWTXMJXNJEOKH-LFSKCEFNSA-N	500.29987042							117488
BRD-K64602559	LSM-28938		54647418	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18+,22+,24-/m0/s1	HFXZOAOZNJYYEY-YAFQURIPSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K64602559	BRD-K64602559-001-01-4	Broad Institute of MIT and Harvard	BRD-K64602559			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18+,22+,24-/m0/s1	HFXZOAOZNJYYEY-YAFQURIPSA-N	469.201299226							117489
BRD-K20737562	LSM-28939		54647470	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19-,22+/m1/s1	HRBYSLULMJVYNQ-AWGCWCAXSA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K20737562	BRD-K20737562-001-01-6	Broad Institute of MIT and Harvard	BRD-K20737562			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19-,22+/m1/s1	HRBYSLULMJVYNQ-AWGCWCAXSA-N	418.2103867							117490
BRD-K35668999	LSM-28940		54647572	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29-,32-/m1/s1	NKIFYSADZLZERH-YPRDRKMQSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@@H]4[C@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K35668999	BRD-K35668999-001-01-9	Broad Institute of MIT and Harvard	BRD-K35668999			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29-,32-/m1/s1	NKIFYSADZLZERH-YPRDRKMQSA-N	526.246772208							117491
BRD-K58491882	LSM-28941		54647660	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19+,21+,24-/m0/s1	NDUFHUOGHUIKBH-FCMRVMJTSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCCN4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K58491882	BRD-K58491882-001-01-8	Broad Institute of MIT and Harvard	BRD-K58491882			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCCN4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19+,21+,24-/m0/s1	NDUFHUOGHUIKBH-FCMRVMJTSA-N	461.25258587							117492
BRD-K77950699	LSM-28942		54647595	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20+,22-,24-/m0/s1	UITZQDWRSZBATF-ZDUIBRFZSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K77950699	BRD-K77950699-001-01-3	Broad Institute of MIT and Harvard	BRD-K77950699			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20+,22-,24-/m0/s1	UITZQDWRSZBATF-ZDUIBRFZSA-N	472.166807326							117493
BRD-K30358777	LSM-28943		54647647	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21+,23-,26-/m0/s1	UPMRBEOCYVNRMT-OXPRRSNCSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K30358777	BRD-K30358777-001-01-0	Broad Institute of MIT and Harvard	BRD-K30358777			COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@H](CO)O2)cc1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21+,23-,26-/m0/s1	UPMRBEOCYVNRMT-OXPRRSNCSA-N	483.236935806							117494
MLS003129988	LSM-28944	BRD-K62418398, SID99358529	46903357	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19-,23-,26+/m1/s1	WTUFVLVPXRCGPW-XIQVDPCESA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc5OCOc5c4)C[C@@H]3c2c1	BroadT	BRD-K62418398	BRD-K62418398-001-02-0	Broad Institute of MIT and Harvard	BRD-K62418398			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc5OCOc5c4)O[C@@H]3CO)c2c1	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19-,23-,26+/m1/s1	WTUFVLVPXRCGPW-XIQVDPCESA-N	497.216200362							117495
BRD-K00078503	LSM-28945		54647416	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18-,22-,24+/m1/s1	HFXZOAOZNJYYEY-MJHBTERZSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K00078503	BRD-K00078503-001-01-1	Broad Institute of MIT and Harvard	BRD-K00078503			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18-,22-,24+/m1/s1	HFXZOAOZNJYYEY-MJHBTERZSA-N	469.201299226							117496
BRD-K57045425	LSM-28946		54647643	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21-,23-,26+/m0/s1	UPMRBEOCYVNRMT-MDJJAXGLSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K57045425	BRD-K57045425-001-01-7	Broad Institute of MIT and Harvard	BRD-K57045425			COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@H](CO)O2)cc1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-6-9-22-20(10-17)21-11-19(34-23(15-30)26(21)35-22)12-24(31)27-13-16-4-7-18(33-3)8-5-16/h4-10,19,21,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t19-,21-,23-,26+/m0/s1	UPMRBEOCYVNRMT-MDJJAXGLSA-N	483.236935806							117497
BRD-K56895780	LSM-28947		54647548	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13+,15+,17-/m1/s1	ILXKPNUBZXTBRO-RKHKHNFPSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K56895780	BRD-K56895780-001-01-5	Broad Institute of MIT and Harvard	BRD-K56895780			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13+,15+,17-/m1/s1	ILXKPNUBZXTBRO-RKHKHNFPSA-N	384.135507198							117498
BRD-K82539366	LSM-28948		54647503	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16+,19-/m1/s1	YUNRHRZDARIPJN-BDOZRKEQSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)N(C)C)C[C@H]3c2c1	BroadT	BRD-K82539366	BRD-K82539366-001-01-9	Broad Institute of MIT and Harvard	BRD-K82539366			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16+,19-/m1/s1	YUNRHRZDARIPJN-BDOZRKEQSA-N	378.179086572							117499
BRD-K70652938	LSM-28949		54647428	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22+,24-,26-/m1/s1	GOWTXMJXNJEOKH-FWSIMYTDSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K70652938	BRD-K70652938-001-01-3	Broad Institute of MIT and Harvard	BRD-K70652938			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H40N4O5/c32-17-24-26-22(15-20(35-24)16-25(33)28-10-13-31-11-4-1-5-12-31)21-14-19(8-9-23(21)36-26)30-27(34)29-18-6-2-3-7-18/h8-9,14,18,20,22,24,26,32H,1-7,10-13,15-17H2,(H,28,33)(H2,29,30,34)/t20-,22+,24-,26-/m1/s1	GOWTXMJXNJEOKH-FWSIMYTDSA-N	500.29987042							117500
BRD-K38574421	LSM-28950		54647695	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15-,17+,20+/m0/s1	PIWWRJKYNWMMLJ-BQCJVYABSA-N	OC[C@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K38574421	BRD-K38574421-001-01-4	Broad Institute of MIT and Harvard	BRD-K38574421			OC[C@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15-,17+,20+/m0/s1	PIWWRJKYNWMMLJ-BQCJVYABSA-N	442.17155652							117501
BRD-K67131822	LSM-28951		54647467	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16+,20-,22-/m0/s1	IVKRNFCOUULTQI-NEDPJEHSSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	BroadT	BRD-K67131822	BRD-K67131822-001-01-2	Broad Institute of MIT and Harvard	BRD-K67131822			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16+,20-,22-/m0/s1	IVKRNFCOUULTQI-NEDPJEHSSA-N	443.185649162							117502
CHEMBL3187437	LSM-28952	BRD-K87926172	54647577	InChI=1S/C23H23F3N2O6/c1-32-20(30)10-15-9-17-16-8-14(6-7-18(16)34-21(17)19(11-29)33-15)28-22(31)27-13-4-2-12(3-5-13)23(24,25)26/h2-8,15,17,19,21,29H,9-11H2,1H3,(H2,27,28,31)/t15-,17-,19-,21+/m0/s1	MSQUSFAFSKSPPL-WRGRXTPVSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	BroadT	BRD-K87926172	BRD-K87926172-001-01-7	Broad Institute of MIT and Harvard	BRD-K87926172			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C23H23F3N2O6/c1-32-20(30)10-15-9-17-16-8-14(6-7-18(16)34-21(17)19(11-29)33-15)28-22(31)27-13-4-2-12(3-5-13)23(24,25)26/h2-8,15,17,19,21,29H,9-11H2,1H3,(H2,27,28,31)/t15-,17-,19-,21+/m0/s1	MSQUSFAFSKSPPL-WRGRXTPVSA-N	480.150821076							117503
BRD-K57517066	LSM-28953		54647508	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14-,16+,19+/m1/s1	YUNRHRZDARIPJN-FYHWNKSOSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)N(C)C)C[C@@H]3c2c1	BroadT	BRD-K57517066	BRD-K57517066-001-01-9	Broad Institute of MIT and Harvard	BRD-K57517066			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14-,16+,19+/m1/s1	YUNRHRZDARIPJN-FYHWNKSOSA-N	378.179086572							117504
BRD-K18101567	LSM-28954		54647526	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22+,25-/m0/s1	AANFNNZNKVIOFO-PMTIONAUSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cccc(F)c4)C[C@@H]3c2c1	BroadT	BRD-K18101567	BRD-K18101567-001-01-4	Broad Institute of MIT and Harvard	BRD-K18101567			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cccc(F)c4)O[C@@H]3CO)c2c1	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22+,25-/m0/s1	AANFNNZNKVIOFO-PMTIONAUSA-N	471.21694929							117505
BRD-K70093308	LSM-28955		54647496	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m1/s1	XVGJFJFVLUTQTK-XOQZDTPSSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K70093308	BRD-K70093308-001-01-2	Broad Institute of MIT and Harvard	BRD-K70093308			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m1/s1	XVGJFJFVLUTQTK-XOQZDTPSSA-N	451.210721058							117506
BRD-K30173420	LSM-28956		54647651	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20-,24-,27+/m0/s1	LBWAYGFZRYCTOK-AKNOZPSNSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K30173420	BRD-K30173420-001-01-4	Broad Institute of MIT and Harvard	BRD-K30173420			OC[C@@H]1O[C@@H](C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21)CC(=O)NCc1ccc2OCOc2c1	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20-,24-,27+/m0/s1	LBWAYGFZRYCTOK-AKNOZPSNSA-N	494.20530132							117507
BRD-K32522318	LSM-28957		54647592	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20+,22+,24-/m0/s1	UITZQDWRSZBATF-ZUAOHOGDSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K32522318	BRD-K32522318-001-01-5	Broad Institute of MIT and Harvard	BRD-K32522318			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20+,22+,24-/m0/s1	UITZQDWRSZBATF-ZUAOHOGDSA-N	472.166807326							117508
BRD-K67533212	LSM-28958		54647493	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,25+/m1/s1	XVGJFJFVLUTQTK-HWZPKBPFSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K67533212	BRD-K67533212-001-01-7	Broad Institute of MIT and Harvard	BRD-K67533212			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,25+/m1/s1	XVGJFJFVLUTQTK-HWZPKBPFSA-N	451.210721058							117509
BRD-K06218527	LSM-28959		54647603	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22+,24-,26-/m0/s1	OBJFROVCRIKTIC-YXOQKGKWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCCC5)cc34	BroadT	BRD-K06218527	BRD-K06218527-001-01-9	Broad Institute of MIT and Harvard	BRD-K06218527			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22+,24-,26-/m0/s1	OBJFROVCRIKTIC-YXOQKGKWSA-N	494.252920228							117510
BRD-K19523047	LSM-28960		54647610	InChI=1S/C21H22FNO7S/c1-28-20(25)10-14-9-17-16-8-13(4-7-18(16)30-21(17)19(11-24)29-14)23-31(26,27)15-5-2-12(22)3-6-15/h2-8,14,17,19,21,23-24H,9-11H2,1H3/t14-,17+,19-,21-/m1/s1	KRPAMDJISYPLOJ-JLGOVJKGSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K19523047	BRD-K19523047-001-01-8	Broad Institute of MIT and Harvard	BRD-K19523047			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C21H22FNO7S/c1-28-20(25)10-14-9-17-16-8-13(4-7-18(16)30-21(17)19(11-24)29-14)23-31(26,27)15-5-2-12(22)3-6-15/h2-8,14,17,19,21,23-24H,9-11H2,1H3/t14-,17+,19-,21-/m1/s1	KRPAMDJISYPLOJ-JLGOVJKGSA-N	451.110100944							117511
BRD-K40939137	LSM-28961		54647422	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18-,22+,24+/m0/s1	HFXZOAOZNJYYEY-IGSZLMQBSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K40939137	BRD-K40939137-001-01-0	Broad Institute of MIT and Harvard	BRD-K40939137			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18-,22+,24+/m0/s1	HFXZOAOZNJYYEY-IGSZLMQBSA-N	469.201299226							117512
BRD-K25877713	LSM-28962		54647665	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19-,21+,24+/m1/s1	NDUFHUOGHUIKBH-GOSIJUEPSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCCN4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K25877713	BRD-K25877713-001-01-3	Broad Institute of MIT and Harvard	BRD-K25877713			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCCN4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19-,21+,24+/m1/s1	NDUFHUOGHUIKBH-GOSIJUEPSA-N	461.25258587							117513
BRD-K25718133	LSM-28963		54647406	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22-,25+,27+/m0/s1	DFSRPXMSRAMRJF-ZTQIFVIOSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@@H](CO)O2	BroadT	BRD-K25718133	BRD-K25718133-001-01-1	Broad Institute of MIT and Harvard	BRD-K25718133			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22-,25+,27+/m0/s1	DFSRPXMSRAMRJF-ZTQIFVIOSA-N	509.25258587							117514
MLS003129064	LSM-28964	BRD-K58208155	46904232	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13-,15-,17+/m0/s1	LRUFLDYNMXBWAO-MOWSHJCCSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1	BroadT	BRD-K58208155	BRD-K58208155-001-02-4	Broad Institute of MIT and Harvard	BRD-K58208155			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13-,15-,17+/m0/s1	LRUFLDYNMXBWAO-MOWSHJCCSA-N	321.157622846							117515
BRD-K96491664	LSM-28965		54647671	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,23-/m0/s1	CLWRRFDHWRUPJJ-IRLNJFMJSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccn4)C[C@@H]3c2c1	BroadT	BRD-K96491664	BRD-K96491664-001-01-6	Broad Institute of MIT and Harvard	BRD-K96491664			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccn4)O[C@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,23-/m0/s1	CLWRRFDHWRUPJJ-IRLNJFMJSA-N	441.189985614							117516
BRD-K66762690	LSM-28966		54647641	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25-,27+,30+/m1/s1	GRQDGDFBWRYOPG-YWOMOVTDSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@@H]3c2c1	BroadT	BRD-K66762690	BRD-K66762690-001-01-4	Broad Institute of MIT and Harvard	BRD-K66762690			COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](C[C@@H]3c2c1)CC(=O)NCc1ccc(cc1)-c1ccccc1	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25-,27+,30+/m1/s1	GRQDGDFBWRYOPG-YWOMOVTDSA-N	516.226036764							117517
BRD-K54769228	LSM-28967		54647532	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25-,27+/m1/s1	IOAZXSSJEHBWSP-BQGNDZODSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K54769228	BRD-K54769228-001-01-4	Broad Institute of MIT and Harvard	BRD-K54769228			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25-,27+/m1/s1	IOAZXSSJEHBWSP-BQGNDZODSA-N	544.147963662							117518
BRD-K46152990	LSM-28968		54647623	InChI=1S/C22H24N2O6/c1-28-21(27)11-15-10-17-16-9-14(24-20(26)8-13-4-6-23-7-5-13)2-3-18(16)30-22(17)19(12-25)29-15/h2-7,9,15,17,19,22,25H,8,10-12H2,1H3,(H,24,26)/t15-,17+,19+,22-/m1/s1	WSHDHBDWIVSZGZ-TXDFXGTJSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	BroadT	BRD-K46152990	BRD-K46152990-001-01-0	Broad Institute of MIT and Harvard	BRD-K46152990			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-21(27)11-15-10-17-16-9-14(24-20(26)8-13-4-6-23-7-5-13)2-3-18(16)30-22(17)19(12-25)29-15/h2-7,9,15,17,19,22,25H,8,10-12H2,1H3,(H,24,26)/t15-,17+,19+,22-/m1/s1	WSHDHBDWIVSZGZ-TXDFXGTJSA-N	412.163436508							117519
BRD-K74918080	LSM-28969		54647511	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21+,23+,25-/m0/s1	MCJXNBRGFCMFNB-VUHNXCBZSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K74918080	BRD-K74918080-001-01-0	Broad Institute of MIT and Harvard	BRD-K74918080			OC[C@H]1O[C@H](CC(=O)NC2CCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21+,23+,25-/m0/s1	MCJXNBRGFCMFNB-VUHNXCBZSA-N	465.226371122							117520
BRD-K70683012	LSM-28970		54647475	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19-,22-/m0/s1	HRBYSLULMJVYNQ-VYXPOXFGSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K70683012	BRD-K70683012-001-01-7	Broad Institute of MIT and Harvard	BRD-K70683012			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19-,22-/m0/s1	HRBYSLULMJVYNQ-VYXPOXFGSA-N	418.2103867							117521
BRD-K91423144	LSM-28971		54647530	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22+,25+/m0/s1	AANFNNZNKVIOFO-FZIATNMDSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cccc(F)c4)C[C@H]3c2c1	BroadT	BRD-K91423144	BRD-K91423144-001-01-4	Broad Institute of MIT and Harvard	BRD-K91423144			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cccc(F)c4)O[C@@H]3CO)c2c1	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20-,22+,25+/m0/s1	AANFNNZNKVIOFO-FZIATNMDSA-N	471.21694929							117522
BRD-K69569958	LSM-28972		54647499	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m0/s1	XVGJFJFVLUTQTK-FZIATNMDSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K69569958	BRD-K69569958-001-01-7	Broad Institute of MIT and Harvard	BRD-K69569958			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m0/s1	XVGJFJFVLUTQTK-FZIATNMDSA-N	451.210721058							117523
BRD-K53639581	LSM-28973		54647614	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15-,19-,21+/m0/s1	FNDPGVQZUOXHHT-QDTKGZOSSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K53639581	BRD-K53639581-001-01-1	Broad Institute of MIT and Harvard	BRD-K53639581			OC[C@@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15-,19-,21+/m0/s1	FNDPGVQZUOXHHT-QDTKGZOSSA-N	427.126716642							117524
CHEMBL2359778	LSM-28974	BRD-K58607444, SID131443813	54647439	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25+,27+/m1/s1	RQEGAPRBBMLFLJ-BQLGRQSHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K58607444	BRD-K58607444-001-01-0	Broad Institute of MIT and Harvard	BRD-K58607444			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25+,27+/m1/s1	RQEGAPRBBMLFLJ-BQLGRQSHSA-N	560.118413172							117525
BRD-K69435400	LSM-28975		54647687	InChI=1S/C23H27ClN2O4/c1-26(2)16-7-8-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-3-5-15(24)6-4-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19+,21-,23-/m0/s1	MOQWXNTXFGVTQQ-FTJYFCJYSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(Cl)cc4)C[C@@H]3c2c1	BroadT	BRD-K69435400	BRD-K69435400-001-01-5	Broad Institute of MIT and Harvard	BRD-K69435400			CN(C)c1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C23H27ClN2O4/c1-26(2)16-7-8-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-3-5-15(24)6-4-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19+,21-,23-/m0/s1	MOQWXNTXFGVTQQ-FTJYFCJYSA-N	430.165935074							117526
BRD-K39925250	LSM-28976		54647540	InChI=1S/C23H25F3N2O7S/c1-33-14-3-2-4-16(8-14)36(31,32)28-13-5-6-19-17(7-13)18-9-15(34-20(11-29)22(18)35-19)10-21(30)27-12-23(24,25)26/h2-8,15,18,20,22,28-29H,9-12H2,1H3,(H,27,30)/t15-,18-,20-,22+/m1/s1	MZKZWNSKYYIKNG-HBPKQZLHSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]4c3c2	BroadT	BRD-K39925250	BRD-K39925250-001-01-3	Broad Institute of MIT and Harvard	BRD-K39925250			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](C[C@@H]3c2c1)CC(=O)NCC(F)(F)F	InChI=1S/C23H25F3N2O7S/c1-33-14-3-2-4-16(8-14)36(31,32)28-13-5-6-19-17(7-13)18-9-15(34-20(11-29)22(18)35-19)10-21(30)27-12-23(24,25)26/h2-8,15,18,20,22,28-29H,9-12H2,1H3,(H,27,30)/t15-,18-,20-,22+/m1/s1	MZKZWNSKYYIKNG-HBPKQZLHSA-N	530.13345645							117527
CHEMBL2356539	LSM-28977	BRD-K79020643, SID131444011	54647635	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25-,27-,30+/m0/s1	GRQDGDFBWRYOPG-BKVCSMAQSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@H]3c2c1	BroadT	BRD-K79020643	BRD-K79020643-001-01-0	Broad Institute of MIT and Harvard	BRD-K79020643			COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](C[C@H]3c2c1)CC(=O)NCc1ccc(cc1)-c1ccccc1	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25-,27-,30+/m0/s1	GRQDGDFBWRYOPG-BKVCSMAQSA-N	516.226036764							117528
BRD-K73780763	LSM-28978		54647435	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25+,27-/m1/s1	RQEGAPRBBMLFLJ-DJOAJLSESA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K73780763	BRD-K73780763-001-01-9	Broad Institute of MIT and Harvard	BRD-K73780763			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25+,27-/m1/s1	RQEGAPRBBMLFLJ-DJOAJLSESA-N	560.118413172							117529
BRD-K74245698	LSM-28979		54647537	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25-,27-/m0/s1	IOAZXSSJEHBWSP-OGMXRKNYSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K74245698	BRD-K74245698-001-01-2	Broad Institute of MIT and Harvard	BRD-K74245698			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25-,27-/m0/s1	IOAZXSSJEHBWSP-OGMXRKNYSA-N	544.147963662							117530
BRD-K94582694	LSM-28980		54647446	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26+,28+/m0/s1	CZQHDZKSVGPVAK-PWGWJTMSSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K94582694	BRD-K94582694-001-01-8	Broad Institute of MIT and Harvard	BRD-K94582694			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27ClN2O7/c30-18-4-1-16(2-5-18)13-31-27(34)12-20-11-22-21-10-19(6-8-23(21)39-28(22)26(14-33)38-20)32-29(35)17-3-7-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26+,28+/m0/s1	CZQHDZKSVGPVAK-PWGWJTMSSA-N	550.150678934							117531
BRD-K17889110	LSM-28981		54647404	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22+,25-,27-/m1/s1	DFSRPXMSRAMRJF-IIKILRQQSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@@H](CO)O2	BroadT	BRD-K17889110	BRD-K17889110-001-01-7	Broad Institute of MIT and Harvard	BRD-K17889110			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22+,25-,27-/m1/s1	DFSRPXMSRAMRJF-IIKILRQQSA-N	509.25258587							117532
BRD-K66248685	LSM-28982		54647460	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17-,19+,21+/m0/s1	ZQPIRYHZQRYESG-ICSUOEFDSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K66248685	BRD-K66248685-001-01-1	Broad Institute of MIT and Harvard	BRD-K66248685			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17-,19+,21+/m0/s1	ZQPIRYHZQRYESG-ICSUOEFDSA-N	417.226371122							117533
BRD-K82362034	LSM-28983		54647615	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15+,19+,21-/m0/s1	FNDPGVQZUOXHHT-GYBPZWCXSA-N	OC[C@H]1O[C@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K82362034	BRD-K82362034-001-01-8	Broad Institute of MIT and Harvard	BRD-K82362034			OC[C@H]1O[C@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15+,19+,21-/m0/s1	FNDPGVQZUOXHHT-GYBPZWCXSA-N	427.126716642							117534
BRD-K77713205	LSM-28984		54647696	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15-,17+,20+/m1/s1	PIWWRJKYNWMMLJ-HMPASCQOSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K77713205	BRD-K77713205-001-01-2	Broad Institute of MIT and Harvard	BRD-K77713205			OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15-,17+,20+/m1/s1	PIWWRJKYNWMMLJ-HMPASCQOSA-N	442.17155652							117535
BRD-K54250149	LSM-28985		54647469	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16-,20+,22+/m1/s1	IVKRNFCOUULTQI-ZTVUFDKISA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	BroadT	BRD-K54250149	BRD-K54250149-001-01-1	Broad Institute of MIT and Harvard	BRD-K54250149			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16-,20+,22+/m1/s1	IVKRNFCOUULTQI-ZTVUFDKISA-N	443.185649162							117536
BRD-K81669067	LSM-28986		54647498	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m0/s1	XVGJFJFVLUTQTK-GPYREICYSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K81669067	BRD-K81669067-001-01-7	Broad Institute of MIT and Harvard	BRD-K81669067			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-17-3-1-2-8-26-17)19-10-16(6-7-21(19)33-25)28-24(31)9-15-4-5-15/h1-3,6-8,10,15,18,20,22,25,29H,4-5,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m0/s1	XVGJFJFVLUTQTK-GPYREICYSA-N	451.210721058							117537
BRD-K93503664	LSM-28987		54647543	InChI=1S/C23H25F3N2O7S/c1-33-14-3-2-4-16(8-14)36(31,32)28-13-5-6-19-17(7-13)18-9-15(34-20(11-29)22(18)35-19)10-21(30)27-12-23(24,25)26/h2-8,15,18,20,22,28-29H,9-12H2,1H3,(H,27,30)/t15-,18+,20-,22-/m1/s1	MZKZWNSKYYIKNG-SNDIGXPUSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]4c3c2	BroadT	BRD-K93503664	BRD-K93503664-001-01-1	Broad Institute of MIT and Harvard	BRD-K93503664			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](C[C@H]3c2c1)CC(=O)NCC(F)(F)F	InChI=1S/C23H25F3N2O7S/c1-33-14-3-2-4-16(8-14)36(31,32)28-13-5-6-19-17(7-13)18-9-15(34-20(11-29)22(18)35-19)10-21(30)27-12-23(24,25)26/h2-8,15,18,20,22,28-29H,9-12H2,1H3,(H,27,30)/t15-,18+,20-,22-/m1/s1	MZKZWNSKYYIKNG-SNDIGXPUSA-N	530.13345645							117538
BRD-K25844701	LSM-28988		54647578	InChI=1S/C23H23F3N2O6/c1-32-20(30)10-15-9-17-16-8-14(6-7-18(16)34-21(17)19(11-29)33-15)28-22(31)27-13-4-2-12(3-5-13)23(24,25)26/h2-8,15,17,19,21,29H,9-11H2,1H3,(H2,27,28,31)/t15-,17+,19+,21-/m1/s1	MSQUSFAFSKSPPL-ZWVMGRIOSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	BroadT	BRD-K25844701	BRD-K25844701-001-01-7	Broad Institute of MIT and Harvard	BRD-K25844701			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C23H23F3N2O6/c1-32-20(30)10-15-9-17-16-8-14(6-7-18(16)34-21(17)19(11-29)33-15)28-22(31)27-13-4-2-12(3-5-13)23(24,25)26/h2-8,15,17,19,21,29H,9-11H2,1H3,(H2,27,28,31)/t15-,17+,19+,21-/m1/s1	MSQUSFAFSKSPPL-ZWVMGRIOSA-N	480.150821076							117539
BRD-K43911180	LSM-28989		54647397	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19+,21-,24-/m0/s1	LQLAETCVZWZFIB-PMSBSAKUSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K43911180	BRD-K43911180-001-01-2	Broad Institute of MIT and Harvard	BRD-K43911180			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19+,21-,24-/m0/s1	LQLAETCVZWZFIB-PMSBSAKUSA-N	428.231122144							117540
BRD-K43789905	LSM-28990		54647483	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20+,23-,26-/m0/s1	UWAUWNPQHFTMFN-PLDOSFOGSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K43789905	BRD-K43789905-001-01-6	Broad Institute of MIT and Harvard	BRD-K43789905			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H28F2N2O5/c27-16-3-5-21(28)15(8-16)12-29-24(32)11-18-10-20-19-9-17(30-25(33)7-14-1-2-14)4-6-22(19)35-26(20)23(13-31)34-18/h3-6,8-9,14,18,20,23,26,31H,1-2,7,10-13H2,(H,29,32)(H,30,33)/t18-,20+,23-,26-/m0/s1	UWAUWNPQHFTMFN-PLDOSFOGSA-N	486.196628416							117541
BRD-K37698302	LSM-28991		54647670	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,23-/m1/s1	CLWRRFDHWRUPJJ-RWSUSOHTSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccccn4)C[C@H]3c2c1	BroadT	BRD-K37698302	BRD-K37698302-001-01-6	Broad Institute of MIT and Harvard	BRD-K37698302			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccccn4)O[C@@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,23-/m1/s1	CLWRRFDHWRUPJJ-RWSUSOHTSA-N	441.189985614							117542
BRD-K43316594	LSM-28992		54647402	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22+,25+,27-/m0/s1	DFSRPXMSRAMRJF-JBGAWVPVSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@@H](CO)O2	BroadT	BRD-K43316594	BRD-K43316594-001-01-4	Broad Institute of MIT and Harvard	BRD-K43316594			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22+,25+,27-/m0/s1	DFSRPXMSRAMRJF-JBGAWVPVSA-N	509.25258587							117543
BRD-K32403186	LSM-28993		54647580	InChI=1S/C23H23F3N2O6/c1-32-20(30)10-15-9-17-16-8-14(6-7-18(16)34-21(17)19(11-29)33-15)28-22(31)27-13-4-2-12(3-5-13)23(24,25)26/h2-8,15,17,19,21,29H,9-11H2,1H3,(H2,27,28,31)/t15-,17-,19+,21+/m0/s1	MSQUSFAFSKSPPL-ICSUOEFDSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	BroadT	BRD-K32403186	BRD-K32403186-001-01-7	Broad Institute of MIT and Harvard	BRD-K32403186			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C23H23F3N2O6/c1-32-20(30)10-15-9-17-16-8-14(6-7-18(16)34-21(17)19(11-29)33-15)28-22(31)27-13-4-2-12(3-5-13)23(24,25)26/h2-8,15,17,19,21,29H,9-11H2,1H3,(H2,27,28,31)/t15-,17-,19+,21+/m0/s1	MSQUSFAFSKSPPL-ICSUOEFDSA-N	480.150821076							117544
MLS003129056	LSM-28994	BRD-K68530167, SID99359663	46904225	InChI=1S/C22H25NO8S/c1-28-14-4-3-5-16(9-14)32(26,27)23-13-6-7-19-17(8-13)18-10-15(11-21(25)29-2)30-20(12-24)22(18)31-19/h3-9,15,18,20,22-24H,10-12H2,1-2H3/t15-,18+,20-,22-/m1/s1	XGRVZSSSNYUCOS-SNDIGXPUSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@@H](CO)O1	BroadT	BRD-K68530167	BRD-K68530167-001-02-5	Broad Institute of MIT and Harvard	BRD-K68530167			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4cccc(OC)c4)cc23)[C@@H](CO)O1	InChI=1S/C22H25NO8S/c1-28-14-4-3-5-16(9-14)32(26,27)23-13-6-7-19-17(8-13)18-10-15(11-21(25)29-2)30-20(12-24)22(18)31-19/h3-9,15,18,20,22-24H,10-12H2,1-2H3/t15-,18+,20-,22-/m1/s1	XGRVZSSSNYUCOS-SNDIGXPUSA-N	463.13008746							117545
CHEMBL2362298	LSM-28995	BRD-K73387470, SID131443807	54647433	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25-,27+/m0/s1	RQEGAPRBBMLFLJ-WHTZKJIOSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K73387470	BRD-K73387470-001-01-7	Broad Institute of MIT and Harvard	BRD-K73387470			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23-,25-,27+/m0/s1	RQEGAPRBBMLFLJ-WHTZKJIOSA-N	560.118413172							117546
BRD-K50685439	LSM-28996		54647594	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20+,22-,24-/m1/s1	UITZQDWRSZBATF-LWSJSWBQSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K50685439	BRD-K50685439-001-01-1	Broad Institute of MIT and Harvard	BRD-K50685439			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20+,22-,24-/m1/s1	UITZQDWRSZBATF-LWSJSWBQSA-N	472.166807326							117547
BRD-K32916996	LSM-28997		54647529	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22-,25-/m0/s1	AANFNNZNKVIOFO-GPYREICYSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4cccc(F)c4)C[C@@H]3c2c1	BroadT	BRD-K32916996	BRD-K32916996-001-01-8	Broad Institute of MIT and Harvard	BRD-K32916996			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cccc(F)c4)O[C@H]3CO)c2c1	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22-,25-/m0/s1	AANFNNZNKVIOFO-GPYREICYSA-N	471.21694929							117548
BRD-K62372121	LSM-28998		54647583	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21-,23-,26+/m0/s1	OSBPWUGUGZAKLO-MDJJAXGLSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K62372121	BRD-K62372121-001-01-5	Broad Institute of MIT and Harvard	BRD-K62372121			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21-,23-,26+/m0/s1	OSBPWUGUGZAKLO-MDJJAXGLSA-N	471.273321314							117549
BRD-K50851442	LSM-28999		54647486	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19-,23-,26+/m0/s1	WTUFVLVPXRCGPW-ONBIGUJKSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc5OCOc5c4)C[C@H]3c2c1	BroadT	BRD-K50851442	BRD-K50851442-001-01-4	Broad Institute of MIT and Harvard	BRD-K50851442			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc5OCOc5c4)O[C@H]3CO)c2c1	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19-,23-,26+/m0/s1	WTUFVLVPXRCGPW-ONBIGUJKSA-N	497.216200362							117550
BRD-K52049165	LSM-29000		54647423	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18-,22+,24+/m1/s1	HFXZOAOZNJYYEY-SDZNXMPUSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K52049165	BRD-K52049165-001-01-8	Broad Institute of MIT and Harvard	BRD-K52049165			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O5/c26-19-3-1-2-4-20(19)29-25(32)28-15-7-8-21-17(9-15)18-10-16(33-22(13-30)24(18)34-21)11-23(31)27-12-14-5-6-14/h1-4,7-9,14,16,18,22,24,30H,5-6,10-13H2,(H,27,31)(H2,28,29,32)/t16-,18-,22+,24+/m1/s1	HFXZOAOZNJYYEY-SDZNXMPUSA-N	469.201299226							117551
BRD-K18296708	LSM-29001		54647692	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15+,17+,20-/m1/s1	PIWWRJKYNWMMLJ-GKTLAZJLSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K18296708	BRD-K18296708-001-01-2	Broad Institute of MIT and Harvard	BRD-K18296708			OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C21H25F3N2O5/c22-21(23,24)10-25-18(28)8-13-7-15-14-6-12(26-19(29)5-11-1-2-11)3-4-16(14)31-20(15)17(9-27)30-13/h3-4,6,11,13,15,17,20,27H,1-2,5,7-10H2,(H,25,28)(H,26,29)/t13-,15+,17+,20-/m1/s1	PIWWRJKYNWMMLJ-GKTLAZJLSA-N	442.17155652							117552
BRD-K32925057	LSM-29002		54647555	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17+,19+,22-/m1/s1	POXOUGQYINQDTJ-TXDFXGTJSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K32925057	BRD-K32925057-001-01-5	Broad Institute of MIT and Harvard	BRD-K32925057			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17+,19+,22-/m1/s1	POXOUGQYINQDTJ-TXDFXGTJSA-N	417.226371122							117553
BRD-K90325960	LSM-29003		54647477	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19+,22+/m1/s1	HRBYSLULMJVYNQ-XUAYLNFESA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K90325960	BRD-K90325960-001-01-3	Broad Institute of MIT and Harvard	BRD-K90325960			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19+,22+/m1/s1	HRBYSLULMJVYNQ-XUAYLNFESA-N	418.2103867							117554
BRD-K40228218	LSM-29004		54647527	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22+,25-/m1/s1	AANFNNZNKVIOFO-XOQZDTPSSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cccc(F)c4)C[C@H]3c2c1	BroadT	BRD-K40228218	BRD-K40228218-001-01-0	Broad Institute of MIT and Harvard	BRD-K40228218			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cccc(F)c4)O[C@H]3CO)c2c1	InChI=1S/C25H30FN3O5/c1-29(2)13-24(32)28-17-6-7-21-19(9-17)20-10-18(33-22(14-30)25(20)34-21)11-23(31)27-12-15-4-3-5-16(26)8-15/h3-9,18,20,22,25,30H,10-14H2,1-2H3,(H,27,31)(H,28,32)/t18-,20+,22+,25-/m1/s1	AANFNNZNKVIOFO-XOQZDTPSSA-N	471.21694929							117555
BRD-K20068050	LSM-29005		54647639	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25+,27-,30-/m0/s1	GRQDGDFBWRYOPG-ZOMOEZKFSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@@H]3c2c1	BroadT	BRD-K20068050	BRD-K20068050-001-01-5	Broad Institute of MIT and Harvard	BRD-K20068050			COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](C[C@@H]3c2c1)CC(=O)NCc1ccc(cc1)-c1ccccc1	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25+,27-,30-/m0/s1	GRQDGDFBWRYOPG-ZOMOEZKFSA-N	516.226036764							117556
BRD-K99300752	LSM-29006		54647563	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20+,22+,25-/m0/s1	CMSFJVGZZAIMOJ-PMTIONAUSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCCc4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K99300752	BRD-K99300752-001-01-9	Broad Institute of MIT and Harvard	BRD-K99300752			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](C[C@@H]3c2c1)CC(=O)NCCc1ccccc1	InChI=1S/C25H30N2O6/c1-31-15-24(30)27-17-7-8-21-19(11-17)20-12-18(32-22(14-28)25(20)33-21)13-23(29)26-10-9-16-5-3-2-4-6-16/h2-8,11,18,20,22,25,28H,9-10,12-15H2,1H3,(H,26,29)(H,27,30)/t18-,20+,22+,25-/m0/s1	CMSFJVGZZAIMOJ-PMTIONAUSA-N	454.2103867							117557
BRD-K04695511	LSM-29007		54647405	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22+,25-,27-/m0/s1	DFSRPXMSRAMRJF-BUZLNKNLSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)NC5CCCC5)cc34)[C@H](CO)O2	BroadT	BRD-K04695511	BRD-K04695511-001-01-8	Broad Institute of MIT and Harvard	BRD-K04695511			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C28H35N3O6/c1-35-23-9-5-2-6-17(23)15-29-26(33)14-20-13-22-21-12-19(31-28(34)30-18-7-3-4-8-18)10-11-24(21)37-27(22)25(16-32)36-20/h2,5-6,9-12,18,20,22,25,27,32H,3-4,7-8,13-16H2,1H3,(H,29,33)(H2,30,31,34)/t20-,22+,25-,27-/m0/s1	DFSRPXMSRAMRJF-BUZLNKNLSA-N	509.25258587							117558
BRD-K25675728	LSM-29008		54647672	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m0/s1	CLWRRFDHWRUPJJ-VSCJKUSUSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccccn4)C[C@H]3c2c1	BroadT	BRD-K25675728	BRD-K25675728-001-01-4	Broad Institute of MIT and Harvard	BRD-K25675728			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccn4)O[C@@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-14-5-6-19-17(8-14)18-9-16(31-20(12-27)23(18)32-19)10-21(28)25-11-15-4-2-3-7-24-15/h2-8,16,18,20,23,27H,9-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m0/s1	CLWRRFDHWRUPJJ-VSCJKUSUSA-N	441.189985614							117559
BRD-K51566146	LSM-29009		54647589	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21-,23+,26+/m1/s1	OSBPWUGUGZAKLO-BCHMZHATSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K51566146	BRD-K51566146-001-01-6	Broad Institute of MIT and Harvard	BRD-K51566146			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21-,23+,26+/m1/s1	OSBPWUGUGZAKLO-BCHMZHATSA-N	471.273321314							117560
BRD-K96958073	LSM-29010		54647557	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17+,19-,22-/m1/s1	POXOUGQYINQDTJ-MDDDDHJVSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K96958073	BRD-K96958073-001-01-9	Broad Institute of MIT and Harvard	BRD-K96958073			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17+,19-,22-/m1/s1	POXOUGQYINQDTJ-MDDDDHJVSA-N	417.226371122							117561
BRD-K08113936	LSM-29011		54647476	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19+,22+/m0/s1	HRBYSLULMJVYNQ-RNCHUUSHSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K08113936	BRD-K08113936-001-01-5	Broad Institute of MIT and Harvard	BRD-K08113936			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17-,19+,22+/m0/s1	HRBYSLULMJVYNQ-RNCHUUSHSA-N	418.2103867							117562
BRD-K64823749	LSM-29012		54647535	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25+,27-/m1/s1	IOAZXSSJEHBWSP-DJOAJLSESA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K64823749	BRD-K64823749-001-01-7	Broad Institute of MIT and Harvard	BRD-K64823749			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25+,27-/m1/s1	IOAZXSSJEHBWSP-DJOAJLSESA-N	544.147963662							117563
MLS003129058	LSM-29013	BRD-K87241988	46904227	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15-,19-,21+/m0/s1	YVFPRJXGACQPOR-QDTKGZOSSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	BroadT	BRD-K87241988	BRD-K87241988-001-02-3	Broad Institute of MIT and Harvard	BRD-K87241988			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C22H23FN2O6/c1-29-20(27)10-13-9-15-14-8-12(6-7-18(14)31-21(15)19(11-26)30-13)24-22(28)25-17-5-3-2-4-16(17)23/h2-8,13,15,19,21,26H,9-11H2,1H3,(H2,24,25,28)/t13-,15-,19-,21+/m0/s1	YVFPRJXGACQPOR-QDTKGZOSSA-N	430.154014676							117564
BRD-K90359063	LSM-29014		54647434	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25+,27-/m0/s1	RQEGAPRBBMLFLJ-NOGZMFEUSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K90359063	BRD-K90359063-001-01-8	Broad Institute of MIT and Harvard	BRD-K90359063			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26ClFN2O6S/c28-17-3-1-16(2-4-17)14-30-26(33)13-20-12-23-22-11-19(7-10-24(22)37-27(23)25(15-32)36-20)31-38(34,35)21-8-5-18(29)6-9-21/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25+,27-/m0/s1	RQEGAPRBBMLFLJ-NOGZMFEUSA-N	560.118413172							117565
BRD-K36515664	LSM-29015		54647462	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16-,20-,22+/m1/s1	IVKRNFCOUULTQI-YKHKRFOZSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	BroadT	BRD-K36515664	BRD-K36515664-001-01-5	Broad Institute of MIT and Harvard	BRD-K36515664			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16-,20-,22+/m1/s1	IVKRNFCOUULTQI-YKHKRFOZSA-N	443.185649162							117566
BRD-K93130549	LSM-29016		54647604	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22-,24+,26+/m0/s1	OBJFROVCRIKTIC-LFSKCEFNSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCCC5)cc34	BroadT	BRD-K93130549	BRD-K93130549-001-01-4	Broad Institute of MIT and Harvard	BRD-K93130549			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C27H34N4O5/c32-16-24-26-22(12-20(35-24)13-25(33)29-15-17-5-4-10-28-14-17)21-11-19(8-9-23(21)36-26)31-27(34)30-18-6-2-1-3-7-18/h4-5,8-11,14,18,20,22,24,26,32H,1-3,6-7,12-13,15-16H2,(H,29,33)(H2,30,31,34)/t20-,22-,24+,26+/m0/s1	OBJFROVCRIKTIC-LFSKCEFNSA-N	494.252920228							117567
BRD-K72932441	LSM-29017		54647619	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15-,19+,21+/m0/s1	FNDPGVQZUOXHHT-JGBZDWQXSA-N	OC[C@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K72932441	BRD-K72932441-001-01-7	Broad Institute of MIT and Harvard	BRD-K72932441			OC[C@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C22H21NO8/c24-9-19-21-15(7-13(30-19)8-20(25)26)14-6-12(2-4-16(14)31-21)23-22(27)11-1-3-17-18(5-11)29-10-28-17/h1-6,13,15,19,21,24H,7-10H2,(H,23,27)(H,25,26)/t13-,15-,19+,21+/m0/s1	FNDPGVQZUOXHHT-JGBZDWQXSA-N	427.126716642							117568
BRD-K94962552	LSM-29018		54647520	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m1/s1	MZEYKMYWBLWBBR-DPQLKAKJSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K94962552	BRD-K94962552-001-01-3	Broad Institute of MIT and Harvard	BRD-K94962552			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-5-7-26-8-6-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-1-2-15/h3-8,10,15,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m1/s1	MZEYKMYWBLWBBR-DPQLKAKJSA-N	451.210721058							117569
BRD-K15968719	LSM-29019		54647398	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19-,21+,24+/m0/s1	LQLAETCVZWZFIB-NOOBJOLFSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K15968719	BRD-K15968719-001-01-6	Broad Institute of MIT and Harvard	BRD-K15968719			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C24H32N2O5/c27-14-21-24-19(12-17(30-21)13-23(29)26-8-2-1-3-9-26)18-11-16(6-7-20(18)31-24)25-22(28)10-15-4-5-15/h6-7,11,15,17,19,21,24,27H,1-5,8-10,12-14H2,(H,25,28)/t17-,19-,21+,24+/m0/s1	LQLAETCVZWZFIB-NOOBJOLFSA-N	428.231122144							117570
BRD-K34445019	LSM-29020		54647662	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19+,21-,24-/m1/s1	NDUFHUOGHUIKBH-RMIRKMSDSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCCN4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K34445019	BRD-K34445019-001-01-9	Broad Institute of MIT and Harvard	BRD-K34445019			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCCN4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C24H35N3O6/c1-31-15-23(30)26-16-5-6-20-18(11-16)19-12-17(32-21(14-28)24(19)33-20)13-22(29)25-7-10-27-8-3-2-4-9-27/h5-6,11,17,19,21,24,28H,2-4,7-10,12-15H2,1H3,(H,25,29)(H,26,30)/t17-,19+,21-,24-/m1/s1	NDUFHUOGHUIKBH-RMIRKMSDSA-N	461.25258587							117571
BRD-K02759046	LSM-29021		54647463	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16-,20-,22+/m0/s1	IVKRNFCOUULTQI-OZOIZYBVSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	BroadT	BRD-K02759046	BRD-K02759046-001-01-8	Broad Institute of MIT and Harvard	BRD-K02759046			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-14-10-16-15-9-13(7-8-19(15)32-22(16)20(12-28)31-14)25-23(30)26-18-6-4-3-5-17(18)24/h3-9,14,16,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t14-,16-,20-,22+/m0/s1	IVKRNFCOUULTQI-OZOIZYBVSA-N	443.185649162							117572
BRD-K02180800	LSM-29022		54647638	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25+,27-,30-/m1/s1	GRQDGDFBWRYOPG-LIOQXTORSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@H]3c2c1	BroadT	BRD-K02180800	BRD-K02180800-001-01-3	Broad Institute of MIT and Harvard	BRD-K02180800			COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](C[C@H]3c2c1)CC(=O)NCc1ccc(cc1)-c1ccccc1	InChI=1S/C30H32N2O6/c1-36-18-29(35)32-22-11-12-26-24(13-22)25-14-23(37-27(17-33)30(25)38-26)15-28(34)31-16-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-13,23,25,27,30,33H,14-18H2,1H3,(H,31,34)(H,32,35)/t23-,25+,27-,30-/m1/s1	GRQDGDFBWRYOPG-LIOQXTORSA-N	516.226036764							117573
BRD-K47456612	LSM-29023		54647507	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14-,16+,19+/m0/s1	YUNRHRZDARIPJN-UETVFIHBSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)N(C)C)C[C@H]3c2c1	BroadT	BRD-K47456612	BRD-K47456612-001-01-2	Broad Institute of MIT and Harvard	BRD-K47456612			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14-,16+,19+/m0/s1	YUNRHRZDARIPJN-UETVFIHBSA-N	378.179086572							117574
BRD-K44833533	LSM-29024		54647534	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25+,27-/m0/s1	IOAZXSSJEHBWSP-NOGZMFEUSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K44833533	BRD-K44833533-001-01-1	Broad Institute of MIT and Harvard	BRD-K44833533			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H26F2N2O6S/c28-17-4-7-21(8-5-17)38(34,35)31-19-6-9-24-22(11-19)23-12-20(36-25(15-32)27(23)37-24)13-26(33)30-14-16-2-1-3-18(29)10-16/h1-11,20,23,25,27,31-32H,12-15H2,(H,30,33)/t20-,23+,25+,27-/m0/s1	IOAZXSSJEHBWSP-NOGZMFEUSA-N	544.147963662							117575
BRD-K67626012	LSM-29025		54647654	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20+,24-,27-/m1/s1	LBWAYGFZRYCTOK-NGJNWXRCSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K67626012	BRD-K67626012-001-01-1	Broad Institute of MIT and Harvard	BRD-K67626012			OC[C@H]1O[C@H](C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21)CC(=O)NCc1ccc2OCOc2c1	InChI=1S/C27H30N2O7/c30-13-24-27-20(19-9-17(4-6-21(19)36-27)29-26(32)8-15-1-2-15)10-18(35-24)11-25(31)28-12-16-3-5-22-23(7-16)34-14-33-22/h3-7,9,15,18,20,24,27,30H,1-2,8,10-14H2,(H,28,31)(H,29,32)/t18-,20+,24-,27-/m1/s1	LBWAYGFZRYCTOK-NGJNWXRCSA-N	494.20530132							117576
BRD-K94347944	LSM-29026		54647415	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20-,22+,25+/m1/s1	IZLHCVQHHLSMHG-NARIEAHCSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K94347944	BRD-K94347944-001-01-4	Broad Institute of MIT and Harvard	BRD-K94347944			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20-,22+,25+/m1/s1	IZLHCVQHHLSMHG-NARIEAHCSA-N	442.246772208							117577
BRD-K16739515	LSM-29027		54647582	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21-,23-,26+/m1/s1	OSBPWUGUGZAKLO-INZVZTLUSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K16739515	BRD-K16739515-001-01-6	Broad Institute of MIT and Harvard	BRD-K16739515			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21-,23-,26+/m1/s1	OSBPWUGUGZAKLO-INZVZTLUSA-N	471.273321314							117578
BRD-K49988555	LSM-15144		54647487	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19+,23+,26-/m0/s1	WTUFVLVPXRCGPW-NNUFSEJXSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc5OCOc5c4)C[C@@H]3c2c1	BroadT	BRD-K49988555	BRD-K49988555-001-01-1	Broad Institute of MIT and Harvard	BRD-K49988555			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc5OCOc5c4)O[C@@H]3CO)c2c1	InChI=1S/C26H31N3O7/c1-29(2)12-25(32)28-16-4-6-20-18(8-16)19-9-17(35-23(13-30)26(19)36-20)10-24(31)27-11-15-3-5-21-22(7-15)34-14-33-21/h3-8,17,19,23,26,30H,9-14H2,1-2H3,(H,27,31)(H,28,32)/t17-,19+,23+,26-/m0/s1	WTUFVLVPXRCGPW-NNUFSEJXSA-N	497.216200362							103800
BRD-K18128277	LSM-29028		54647550	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13+,15-,17-/m0/s1	ILXKPNUBZXTBRO-QOOGKBOQSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K18128277	BRD-K18128277-001-01-8	Broad Institute of MIT and Harvard	BRD-K18128277			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C17H24N2O6S/c1-19(2)16(21)8-11-7-13-12-6-10(18-26(3,22)23)4-5-14(12)25-17(13)15(9-20)24-11/h4-6,11,13,15,17-18,20H,7-9H2,1-3H3/t11-,13+,15-,17-/m0/s1	ILXKPNUBZXTBRO-QOOGKBOQSA-N	384.135507198							117579
BRD-K52863921	LSM-29029		54647414	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20-,22+,25+/m0/s1	IZLHCVQHHLSMHG-FZIATNMDSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K52863921	BRD-K52863921-001-01-7	Broad Institute of MIT and Harvard	BRD-K52863921			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C25H34N2O5/c28-14-22-25-20(12-18(31-22)13-24(30)26-16-4-2-1-3-5-16)19-11-17(8-9-21(19)32-25)27-23(29)10-15-6-7-15/h8-9,11,15-16,18,20,22,25,28H,1-7,10,12-14H2,(H,26,30)(H,27,29)/t18-,20-,22+,25+/m0/s1	IZLHCVQHHLSMHG-FZIATNMDSA-N	442.246772208							117580
BRD-K01030150	LSM-29030		54647591	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20-,22-,24+/m0/s1	UITZQDWRSZBATF-LGCHTUQSSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K01030150	BRD-K01030150-001-01-7	Broad Institute of MIT and Harvard	BRD-K01030150			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20-,22-,24+/m0/s1	UITZQDWRSZBATF-LGCHTUQSSA-N	472.166807326							117581
BRD-K92349794	LSM-29031		54647569	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27-,29-,32+/m1/s1	NKIFYSADZLZERH-BCENPMRZSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@H]4[C@@H]1Oc5ccc(NC(=O)CC6CC6)cc45	BroadT	BRD-K92349794	BRD-K92349794-001-01-3	Broad Institute of MIT and Harvard	BRD-K92349794			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-32-27(26-15-24(12-13-28(26)39-32)34-31(37)14-20-6-7-20)16-25(38-29)17-30(36)33-18-21-8-10-23(11-9-21)22-4-2-1-3-5-22/h1-5,8-13,15,20,25,27,29,32,35H,6-7,14,16-19H2,(H,33,36)(H,34,37)/t25-,27-,29-,32+/m1/s1	NKIFYSADZLZERH-BCENPMRZSA-N	526.246772208							117582
BRD-K79732056	LSM-29032		54647588	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21-,23+,26+/m0/s1	OSBPWUGUGZAKLO-UAHYIAQRSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K79732056	BRD-K79732056-001-01-0	Broad Institute of MIT and Harvard	BRD-K79732056			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H37N3O5/c30-16-23-26-21(14-19(33-23)15-24(31)27-8-11-29-9-2-1-3-10-29)20-13-18(6-7-22(20)34-26)28-25(32)12-17-4-5-17/h6-7,13,17,19,21,23,26,30H,1-5,8-12,14-16H2,(H,27,31)(H,28,32)/t19-,21-,23+,26+/m0/s1	OSBPWUGUGZAKLO-UAHYIAQRSA-N	471.273321314							117583
BRD-K66324291	LSM-29033		54647501	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14-,16-,19+/m1/s1	YUNRHRZDARIPJN-QNDNMDDASA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)N(C)C)C[C@@H]3c2c1	BroadT	BRD-K66324291	BRD-K66324291-001-01-6	Broad Institute of MIT and Harvard	BRD-K66324291			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C19H26N2O6/c1-21(2)18(24)8-12-7-14-13-6-11(20-17(23)10-25-3)4-5-15(13)27-19(14)16(9-22)26-12/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14-,16-,19+/m1/s1	YUNRHRZDARIPJN-QNDNMDDASA-N	378.179086572							117584
BRD-K81370109	LSM-29034		54647461	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17-,19+,21+/m1/s1	ZQPIRYHZQRYESG-DOSUHQCWSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K81370109	BRD-K81370109-001-01-2	Broad Institute of MIT and Harvard	BRD-K81370109			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C22H31N3O5/c1-25(2)20(27)11-15-10-17-16-9-14(24-22(28)23-13-5-3-4-6-13)7-8-18(16)30-21(17)19(12-26)29-15/h7-9,13,15,17,19,21,26H,3-6,10-12H2,1-2H3,(H2,23,24,28)/t15-,17-,19+,21+/m1/s1	ZQPIRYHZQRYESG-DOSUHQCWSA-N	417.226371122							117585
BRD-K89863047	LSM-29035		54647516	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21-,23+,25+/m1/s1	MCJXNBRGFCMFNB-ASASOQJESA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K89863047	BRD-K89863047-001-01-3	Broad Institute of MIT and Harvard	BRD-K89863047			OC[C@@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(13-19(33-23)14-24(31)27-16-8-4-5-9-16)20-12-18(10-11-22(20)34-25)29-26(32)28-17-6-2-1-3-7-17/h1-3,6-7,10-12,16,19,21,23,25,30H,4-5,8-9,13-15H2,(H,27,31)(H2,28,29,32)/t19-,21-,23+,25+/m1/s1	MCJXNBRGFCMFNB-ASASOQJESA-N	465.226371122							117586
BRD-K32079609	LSM-29036		54647553	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17-,19-,22+/m1/s1	POXOUGQYINQDTJ-AWGCWCAXSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K32079609	BRD-K32079609-001-01-4	Broad Institute of MIT and Harvard	BRD-K32079609			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C22H31N3O5/c1-25(2)11-21(28)24-14-5-6-18-16(7-14)17-8-15(29-19(12-26)22(17)30-18)9-20(27)23-10-13-3-4-13/h5-7,13,15,17,19,22,26H,3-4,8-12H2,1-2H3,(H,23,27)(H,24,28)/t15-,17-,19-,22+/m1/s1	POXOUGQYINQDTJ-AWGCWCAXSA-N	417.226371122							117587
BRD-K53326976	LSM-29037		54647472	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19+,22-/m0/s1	HRBYSLULMJVYNQ-YZYYZOEUSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K53326976	BRD-K53326976-001-01-8	Broad Institute of MIT and Harvard	BRD-K53326976			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C22H30N2O6/c1-28-7-6-23-20(26)11-15-10-17-16-9-14(24-21(27)8-13-2-3-13)4-5-18(16)30-22(17)19(12-25)29-15/h4-5,9,13,15,17,19,22,25H,2-3,6-8,10-12H2,1H3,(H,23,26)(H,24,27)/t15-,17+,19+,22-/m0/s1	HRBYSLULMJVYNQ-YZYYZOEUSA-N	418.2103867							117588
BRD-K29953802	LSM-10241		54657779	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17+,18+,19-/m0/s1	MNYFKSZVIZZWBR-MANSERQUSA-N	O[C@H]1CN[C@@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COC1	BroadT	BRD-K29953802	BRD-K29953802-001-01-0	Broad Institute of MIT and Harvard	BRD-K29953802			O[C@H]1CN[C@@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17+,18+,19-/m0/s1	MNYFKSZVIZZWBR-MANSERQUSA-N	360.204907396							98862
BRD-K78316354	LSM-13218		54657582	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24-,25+,26-/m1/s1	VMOCTUISBGPURH-FXSWLTOZSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@@H]2N(Cc4cccc(c4)c5ccncc5)C1	BroadT	BRD-K78316354	BRD-K78316354-001-01-2	Broad Institute of MIT and Harvard	BRD-K78316354			O[C@H]1COC[C@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@@H]2N(Cc2cccc(c2)-c2ccncc2)C1	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24-,25+,26-/m1/s1	VMOCTUISBGPURH-FXSWLTOZSA-N	481.25767125							101857
CHEMBL2130573	LSM-13290	BRD-K79615119, SID131454088	54657643	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18-,19+,22-/m0/s1	QICYWJCDSALLPT-VWNVYAMZSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3C(=O)Nc4ccc5OCOc5c4)O2	BroadT	BRD-K79615119	BRD-K79615119-001-01-2	Broad Institute of MIT and Harvard	BRD-K79615119			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)Nc2ccc3OCOc3c2)O1	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18-,19+,22-/m0/s1	QICYWJCDSALLPT-VWNVYAMZSA-N	490.242749468							101929
BRD-K44925462	LSM-11163		54657656	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21+,22+,24-/m1/s1	ADXBMBRYFBFALA-HOUBMWHVSA-N	COc1ccccc1CNC(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3C(=O)Nc4ccc(F)cc4)O2	BroadT	BRD-K44925462	BRD-K44925462-001-01-0	Broad Institute of MIT and Harvard	BRD-K44925462			COc1ccccc1CNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)Nc2ccc(F)cc2)O1	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21+,22+,24-/m1/s1	ADXBMBRYFBFALA-HOUBMWHVSA-N	501.227513974							99784
BRD-K43421680	LSM-11070		54657545	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22+,23-,24+/m1/s1	QYSMODXJNCJWNA-JCTDHXFVSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K43421680	BRD-K43421680-001-01-7	Broad Institute of MIT and Harvard	BRD-K43421680			C[C@@H](NC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22+,23-,24+/m1/s1	QYSMODXJNCJWNA-JCTDHXFVSA-N	501.203048864							99691
MLS003650109	LSM-11256	BRD-K46352899	53382758	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9-,10-,11+/m1/s1	FKMAUGDURCCEJG-DBIOUOCHSA-N	COC(=O)C[C@H]1CC[C@H]2NC[C@@H](O)COC[C@@H]2O1	BroadT	BRD-K46352899	BRD-K46352899-001-03-4	Broad Institute of MIT and Harvard	BRD-K46352899			COC(=O)C[C@H]1CC[C@H]2NC[C@@H](O)COC[C@@H]2O1	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9-,10-,11+/m1/s1	FKMAUGDURCCEJG-DBIOUOCHSA-N	259.141972782							99877
SA-1973507	LSM-6829	BRD-K35468722	54657689	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30-,31-,32+/m0/s1	HJQSQTAMFLANGO-AIGPYBJDSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]2N(Cc5ccc(Oc6ccccc6)cc5)C1	BroadT	BRD-K35468722	BRD-K35468722-001-01-8	Broad Institute of MIT and Harvard	BRD-K35468722			O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]2N(Cc2ccc(Oc3ccccc3)cc2)C1	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30-,31-,32+/m0/s1	HJQSQTAMFLANGO-AIGPYBJDSA-N	542.278072336							95450
BRD-K51068004	LSM-11549		54657497	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17-,18+,19-/m0/s1	HLMLEGKKEQKEEG-OKYOBFRVSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)Nc3nccs3)CC[C@H]2N(Cc4cc(F)cc(F)c4)C1	BroadT	BRD-K51068004	BRD-K51068004-001-01-4	Broad Institute of MIT and Harvard	BRD-K51068004			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)Nc3nccs3)CC[C@H]2N(Cc2cc(F)cc(F)c2)C1	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17-,18+,19-/m0/s1	HLMLEGKKEQKEEG-OKYOBFRVSA-N	453.1533834							100172
BRD-K01055635	LSM-8501		54657536	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22+,23-,24+/m0/s1	QYSMODXJNCJWNA-JYZZCPHSSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K01055635	BRD-K01055635-001-01-9	Broad Institute of MIT and Harvard	BRD-K01055635			C[C@H](NC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22+,23-,24+/m0/s1	QYSMODXJNCJWNA-JYZZCPHSSA-N	501.203048864							97122
BRD-K90871122	LSM-14021		54657670	InChI=1S/C23H31FN2O5/c24-17-6-4-16(5-7-17)23(29)26-13-18(27)14-30-15-21-20(26)9-8-19(31-21)12-22(28)25-10-2-1-3-11-25/h4-7,18-21,27H,1-3,8-15H2/t18-,19-,20-,21+/m0/s1	HWBWJNULPIZKLY-XSDIEEQYSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@@H]2N(C1)C(=O)c4ccc(F)cc4	BroadT	BRD-K90871122	BRD-K90871122-001-01-1	Broad Institute of MIT and Harvard	BRD-K90871122			O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@@H]2N(C1)C(=O)c1ccc(F)cc1	InChI=1S/C23H31FN2O5/c24-17-6-4-16(5-7-17)23(29)26-13-18(27)14-30-15-21-20(26)9-8-19(31-21)12-22(28)25-10-2-1-3-11-25/h4-7,18-21,27H,1-3,8-15H2/t18-,19-,20-,21+/m0/s1	HWBWJNULPIZKLY-XSDIEEQYSA-N	434.221700312							102674
BRD-K15804688	LSM-9376		54657622	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15-,16+,17-/m1/s1	XUIBJKJBLJUMMA-WCXIOVBPSA-N	CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)C3CCCC3)O1	BroadT	BRD-K15804688	BRD-K15804688-001-01-0	Broad Institute of MIT and Harvard	BRD-K15804688			CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)C2CCCC2)O1	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15-,16+,17-/m1/s1	XUIBJKJBLJUMMA-WCXIOVBPSA-N	368.231122144							97997
BRD-K06780475	LSM-8830		54657682	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17+,19+,20-/m0/s1	VRNJYJIECLSBHX-CUDHKJQZSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@H]2N(Cc4nccs4)C1	BroadT	BRD-K06780475	BRD-K06780475-001-01-0	Broad Institute of MIT and Harvard	BRD-K06780475			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@H]2N(Cc2nccs2)C1	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17+,19+,20-/m0/s1	VRNJYJIECLSBHX-CUDHKJQZSA-N	465.148904806							97451
BRD-K12484704	LSM-9173		54657543	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22-,23+,24-/m1/s1	QYSMODXJNCJWNA-JYTHNSPOSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K12484704	BRD-K12484704-001-01-4	Broad Institute of MIT and Harvard	BRD-K12484704			C[C@@H](NC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22-,23+,24-/m1/s1	QYSMODXJNCJWNA-JYTHNSPOSA-N	501.203048864							97794
BRD-K22052171	LSM-9763		54657766	InChI=1S/C29H37FN2O6S/c30-25-8-4-5-9-28(25)39(35,36)32-18-23(33)19-37-20-27-26(32)11-10-24(38-27)17-29(34)31-14-12-22(13-15-31)16-21-6-2-1-3-7-21/h1-9,22-24,26-27,33H,10-20H2/t23-,24+,26-,27+/m1/s1	SAJFZBDCMOWFNB-PTJMHOJZSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]2N(C1)S(=O)(=O)c5ccccc5F	BroadT	BRD-K22052171	BRD-K22052171-001-01-1	Broad Institute of MIT and Harvard	BRD-K22052171			O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]2N(C1)S(=O)(=O)c1ccccc1F	InChI=1S/C29H37FN2O6S/c30-25-8-4-5-9-28(25)39(35,36)32-18-23(33)19-37-20-27-26(32)11-10-24(38-27)17-29(34)31-14-12-22(13-15-31)16-21-6-2-1-3-7-21/h1-9,22-24,26-27,33H,10-20H2/t23-,24+,26-,27+/m1/s1	SAJFZBDCMOWFNB-PTJMHOJZSA-N	560.235635814							98384
MLS003650143	LSM-14080	BRD-K92000256, SID125305436	53382792	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17-,19-,20+/m1/s1	VRNJYJIECLSBHX-LFGUQSLTSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@H]2N(Cc4nccs4)C1	BroadT	BRD-K92000256	BRD-K92000256-001-01-3	Broad Institute of MIT and Harvard	BRD-K92000256			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@H]2N(Cc2nccs2)C1	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17-,19-,20+/m1/s1	VRNJYJIECLSBHX-LFGUQSLTSA-N	465.148904806							102734
BRD-K26484692	LSM-10032		54657725	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15+,16-,17+/m0/s1	WSFSIZCPNKDEIH-VVLHAWIVSA-N	O[C@H]1CN[C@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COC1	BroadT	BRD-K26484692	BRD-K26484692-001-01-2	Broad Institute of MIT and Harvard	BRD-K26484692			O[C@H]1CN[C@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COC1	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15+,16-,17+/m0/s1	WSFSIZCPNKDEIH-VVLHAWIVSA-N	355.247106566							98653
BRD-K62995317	LSM-12261		54657522	InChI=1S/C15H26N2O6/c1-2-5-16-15(21)17-7-10(18)8-22-9-13-12(17)4-3-11(23-13)6-14(19)20/h10-13,18H,2-9H2,1H3,(H,16,21)(H,19,20)/t10-,11-,12-,13+/m0/s1	DUBDZBJJIAHCBK-ZDEQEGDKSA-N	CCCNC(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)O)CC[C@H]12	BroadT	BRD-K62995317	BRD-K62995317-001-01-7	Broad Institute of MIT and Harvard	BRD-K62995317			CCCNC(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(O)=O)CC[C@H]12	InChI=1S/C15H26N2O6/c1-2-5-16-15(21)17-7-10(18)8-22-9-13-12(17)4-3-11(23-13)6-14(19)20/h10-13,18H,2-9H2,1H3,(H,16,21)(H,19,20)/t10-,11-,12-,13+/m0/s1	DUBDZBJJIAHCBK-ZDEQEGDKSA-N	330.179086572							100887
BRD-K64930062	LSM-12394		54657733	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22-,23+,24-/m0/s1	QCHQNBIYSRQADD-XQUALCHDSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCCc3ccncc3)CC[C@H]2N(Cc4cccc(c4)C(F)(F)F)C1	BroadT	BRD-K64930062	BRD-K64930062-001-01-9	Broad Institute of MIT and Harvard	BRD-K64930062			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCCc3ccncc3)CC[C@H]2N(Cc2cccc(c2)C(F)(F)F)C1	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22-,23+,24-/m0/s1	QCHQNBIYSRQADD-XQUALCHDSA-N	507.234491134							101021
BRD-K75693278	LSM-13056		54657732	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22+,23+,24-/m0/s1	QCHQNBIYSRQADD-KEZOAJOQSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCCc3ccncc3)CC[C@H]2N(Cc4cccc(c4)C(F)(F)F)C1	BroadT	BRD-K75693278	BRD-K75693278-001-01-0	Broad Institute of MIT and Harvard	BRD-K75693278			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCCc3ccncc3)CC[C@H]2N(Cc2cccc(c2)C(F)(F)F)C1	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22+,23+,24-/m0/s1	QCHQNBIYSRQADD-KEZOAJOQSA-N	507.234491134							101693
BRD-K44420259	LSM-11133		54657560	InChI=1S/C22H31ClN2O6S/c23-16-5-4-6-19(11-16)32(28,29)25-13-17(26)14-30-15-21-20(25)8-7-18(31-21)12-22(27)24-9-2-1-3-10-24/h4-6,11,17-18,20-21,26H,1-3,7-10,12-15H2/t17-,18+,20+,21-/m0/s1	WUWHFUUUQPRUMO-ZSXPUABSSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K44420259	BRD-K44420259-001-01-9	Broad Institute of MIT and Harvard	BRD-K44420259			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H31ClN2O6S/c23-16-5-4-6-19(11-16)32(28,29)25-13-17(26)14-30-15-21-20(25)8-7-18(31-21)12-22(27)24-9-2-1-3-10-24/h4-6,11,17-18,20-21,26H,1-3,7-10,12-15H2/t17-,18+,20+,21-/m0/s1	WUWHFUUUQPRUMO-ZSXPUABSSA-N	486.159135132							99754
BRD-K24621485	LSM-9922		54657758	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14+,17-,18+/m0/s1	ZCDZHCWZNJFIKB-IHETXDGRSA-N	CNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc3ccc(Cl)c(Cl)c3)O1	BroadT	BRD-K24621485	BRD-K24621485-001-01-2	Broad Institute of MIT and Harvard	BRD-K24621485			CNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc2ccc(Cl)c(Cl)c2)O1	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14+,17-,18+/m0/s1	ZCDZHCWZNJFIKB-IHETXDGRSA-N	416.126962752							98543
BRD-K85605624	LSM-13662		54657731	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22+,23-,24+/m1/s1	QCHQNBIYSRQADD-QPXUXIHVSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCCc3ccncc3)CC[C@H]2N(Cc4cccc(c4)C(F)(F)F)C1	BroadT	BRD-K85605624	BRD-K85605624-001-01-3	Broad Institute of MIT and Harvard	BRD-K85605624			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCCc3ccncc3)CC[C@H]2N(Cc2cccc(c2)C(F)(F)F)C1	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22+,23-,24+/m1/s1	QCHQNBIYSRQADD-QPXUXIHVSA-N	507.234491134							102309
CHEMBL2355873	LSM-14118	BRD-K92795064, SID131454052	54657608	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26+,27-,30+/m0/s1	OJBHRHOQEWVARJ-DEJVGURISA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@@H]2N(Cc5ccc6OCOc6c5)C1	BroadT	BRD-K92795064	BRD-K92795064-001-01-0	Broad Institute of MIT and Harvard	BRD-K92795064			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26+,27-,30+/m0/s1	OJBHRHOQEWVARJ-DEJVGURISA-N	530.241686828							102772
BRD-K95567178	LSM-14288		54657756	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14-,17-,18+/m0/s1	ZCDZHCWZNJFIKB-DFEHZGFQSA-N	CNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc3ccc(Cl)c(Cl)c3)O1	BroadT	BRD-K95567178	BRD-K95567178-001-01-3	Broad Institute of MIT and Harvard	BRD-K95567178			CNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc2ccc(Cl)c(Cl)c2)O1	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14-,17-,18+/m0/s1	ZCDZHCWZNJFIKB-DFEHZGFQSA-N	416.126962752							102942
BRD-K70821391	LSM-12750		54657780	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17+,18-,19+/m1/s1	MNYFKSZVIZZWBR-HCXYKTFWSA-N	O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COC1	BroadT	BRD-K70821391	BRD-K70821391-001-01-4	Broad Institute of MIT and Harvard	BRD-K70821391			O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17+,18-,19+/m1/s1	MNYFKSZVIZZWBR-HCXYKTFWSA-N	360.204907396							101387
BRD-K94029810	LSM-14192		54657701	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14-,16+,17-/m0/s1	XTMFCURZJJHNFP-DIECFANBSA-N	CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)c3ccccn3)O1	BroadT	BRD-K94029810	BRD-K94029810-001-01-9	Broad Institute of MIT and Harvard	BRD-K94029810			CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)c2ccccn2)O1	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14-,16+,17-/m0/s1	XTMFCURZJJHNFP-DIECFANBSA-N	377.195070994							102846
BRD-K79564569	LSM-13288		54657714	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17-,22-,23+/m0/s1	NLZWENHPOORBAO-BSWISCRUSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@@H]2N(C1)C(=O)c4ccccc4F	BroadT	BRD-K79564569	BRD-K79564569-001-01-7	Broad Institute of MIT and Harvard	BRD-K79564569			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@@H]2N(C1)C(=O)c1ccccc1F	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17-,22-,23+/m0/s1	NLZWENHPOORBAO-BSWISCRUSA-N	524.128105604							101927
BRD-K74245085	LSM-12972		54657481	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9-,10+,11-/m1/s1	FKMAUGDURCCEJG-CHWFTXMASA-N	COC(=O)C[C@H]1CC[C@@H]2NC[C@@H](O)COC[C@H]2O1	BroadT	BRD-K74245085	BRD-K74245085-001-01-3	Broad Institute of MIT and Harvard	BRD-K74245085			COC(=O)C[C@H]1CC[C@@H]2NC[C@@H](O)COC[C@H]2O1	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9-,10+,11-/m1/s1	FKMAUGDURCCEJG-CHWFTXMASA-N	259.141972782							101609
BRD-K63818532	LSM-12315		54657614	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21-,23+,24-/m0/s1	VYCGBAYEGCCJIH-ZQRMPTRQSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@H]2N(Cc4cc(F)ccc4F)C1	BroadT	BRD-K63818532	BRD-K63818532-001-01-9	Broad Institute of MIT and Harvard	BRD-K63818532			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@H]2N(Cc2cc(F)ccc2F)C1	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21-,23+,24-/m0/s1	VYCGBAYEGCCJIH-ZQRMPTRQSA-N	494.178391538							100942
BRD-K10327449	LSM-9056		54657712	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17+,22-,23+/m0/s1	NLZWENHPOORBAO-VQDLLJBESA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@@H]2N(C1)C(=O)c4ccccc4F	BroadT	BRD-K10327449	BRD-K10327449-001-01-7	Broad Institute of MIT and Harvard	BRD-K10327449			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@@H]2N(C1)C(=O)c1ccccc1F	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17+,22-,23+/m0/s1	NLZWENHPOORBAO-VQDLLJBESA-N	524.128105604							97677
BRD-K04326190	LSM-8693		54657649	InChI=1S/C22H27FN4O6S/c23-15-2-1-3-19(8-15)34(30,31)27-11-17(28)12-32-13-21-20(27)5-4-18(33-21)9-22(29)25-10-16-6-7-24-14-26-16/h1-3,6-8,14,17-18,20-21,28H,4-5,9-13H2,(H,25,29)/t17-,18+,20-,21+/m1/s1	FPMJOPUHYZGMQU-JYRKZWEQSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccncn3)CC[C@H]2N(C1)S(=O)(=O)c4cccc(F)c4	BroadT	BRD-K04326190	BRD-K04326190-001-01-8	Broad Institute of MIT and Harvard	BRD-K04326190			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccncn3)CC[C@H]2N(C1)S(=O)(=O)c1cccc(F)c1	InChI=1S/C22H27FN4O6S/c23-15-2-1-3-19(8-15)34(30,31)27-11-17(28)12-32-13-21-20(27)5-4-18(33-21)9-22(29)25-10-16-6-7-24-14-26-16/h1-3,6-8,14,17-18,20-21,28H,4-5,9-13H2,(H,25,29)/t17-,18+,20-,21+/m1/s1	FPMJOPUHYZGMQU-JYRKZWEQSA-N	494.163533514							97314
BRD-K14302652	LSM-9291		54657744	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26+,28-,29+/m0/s1	LOPBZILAZMWERO-IXGYBEARSA-N	Cc1cccc(c1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)Nc4ccc(cc4)c5ccccc5)CC[C@H]23	BroadT	BRD-K14302652	BRD-K14302652-001-01-8	Broad Institute of MIT and Harvard	BRD-K14302652			Cc1cccc(c1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@H]12	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26+,28-,29+/m0/s1	LOPBZILAZMWERO-IXGYBEARSA-N	550.213757518							97912
BRD-K35371149	LSM-10550		54657546	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22-,23-,24+/m0/s1	QYSMODXJNCJWNA-DUTKYMQFSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K35371149	BRD-K35371149-001-01-9	Broad Institute of MIT and Harvard	BRD-K35371149			C[C@H](NC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22-,23-,24+/m0/s1	QYSMODXJNCJWNA-DUTKYMQFSA-N	501.203048864							99171
CHEMBL2360806	LSM-8653	BRD-K03568952, SID131453938	54657494	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17-,18+,19-/m1/s1	HLMLEGKKEQKEEG-AKHDSKFASA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)Nc3nccs3)CC[C@@H]2N(Cc4cc(F)cc(F)c4)C1	BroadT	BRD-K03568952	BRD-K03568952-001-01-4	Broad Institute of MIT and Harvard	BRD-K03568952			O[C@H]1COC[C@H]2O[C@@H](CC(=O)Nc3nccs3)CC[C@@H]2N(Cc2cc(F)cc(F)c2)C1	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17-,18+,19-/m1/s1	HLMLEGKKEQKEEG-AKHDSKFASA-N	453.1533834							97274
BRD-K95208083	LSM-14263		54657716	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17-,22-,23+/m1/s1	NLZWENHPOORBAO-UOGRCSNTSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@H]2N(C1)C(=O)c4ccccc4F	BroadT	BRD-K95208083	BRD-K95208083-001-01-8	Broad Institute of MIT and Harvard	BRD-K95208083			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@H]2N(C1)C(=O)c1ccccc1F	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17-,22-,23+/m1/s1	NLZWENHPOORBAO-UOGRCSNTSA-N	524.128105604							102917
BRD-K53187535	LSM-11672		54657505	InChI=1S/C24H32N2O7/c27-17-11-26(24(29)15-5-8-20-21(9-15)32-14-31-20)19-7-6-18(33-22(19)13-30-12-17)10-23(28)25-16-3-1-2-4-16/h5,8-9,16-19,22,27H,1-4,6-7,10-14H2,(H,25,28)/t17-,18-,19+,22-/m0/s1	JZHWTQAESVMWQB-VWNVYAMZSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NC3CCCC3)CC[C@H]2N(C1)C(=O)c4ccc5OCOc5c4	BroadT	BRD-K53187535	BRD-K53187535-001-01-8	Broad Institute of MIT and Harvard	BRD-K53187535			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NC3CCCC3)CC[C@H]2N(C1)C(=O)c1ccc2OCOc2c1	InChI=1S/C24H32N2O7/c27-17-11-26(24(29)15-5-8-20-21(9-15)32-14-31-20)19-7-6-18(33-22(19)13-30-12-17)10-23(28)25-16-3-1-2-4-16/h5,8-9,16-19,22,27H,1-4,6-7,10-14H2,(H,25,28)/t17-,18-,19+,22-/m0/s1	JZHWTQAESVMWQB-VWNVYAMZSA-N	460.220951384							100297
CHEMBL2362736	LSM-13976	BRD-K89958315, SID131454194	54657748	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26+,28+,29-/m1/s1	LOPBZILAZMWERO-FUCIELGGSA-N	Cc1cccc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)Nc4ccc(cc4)c5ccccc5)CC[C@H]23	BroadT	BRD-K89958315	BRD-K89958315-001-01-6	Broad Institute of MIT and Harvard	BRD-K89958315			Cc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@H]12	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26+,28+,29-/m1/s1	LOPBZILAZMWERO-FUCIELGGSA-N	550.213757518							102629
BRD-K48624606	LSM-11390		54657666	InChI=1S/C23H31FN2O5/c24-17-6-4-16(5-7-17)23(29)26-13-18(27)14-30-15-21-20(26)9-8-19(31-21)12-22(28)25-10-2-1-3-11-25/h4-7,18-21,27H,1-3,8-15H2/t18-,19-,20-,21+/m1/s1	HWBWJNULPIZKLY-NCYKPQTJSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)C(=O)c4ccc(F)cc4	BroadT	BRD-K48624606	BRD-K48624606-001-01-2	Broad Institute of MIT and Harvard	BRD-K48624606			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)C(=O)c1ccc(F)cc1	InChI=1S/C23H31FN2O5/c24-17-6-4-16(5-7-17)23(29)26-13-18(27)14-30-15-21-20(26)9-8-19(31-21)12-22(28)25-10-2-1-3-11-25/h4-7,18-21,27H,1-3,8-15H2/t18-,19-,20-,21+/m1/s1	HWBWJNULPIZKLY-NCYKPQTJSA-N	434.221700312							100011
BRD-K63000292	LSM-12262		54657604	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26-,27+,30-/m1/s1	OJBHRHOQEWVARJ-KMFVSHEXSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@@H]2N(Cc5ccc6OCOc6c5)C1	BroadT	BRD-K63000292	BRD-K63000292-001-01-4	Broad Institute of MIT and Harvard	BRD-K63000292			O[C@H]1COC[C@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26-,27+,30-/m1/s1	OJBHRHOQEWVARJ-KMFVSHEXSA-N	530.241686828							100888
BRD-K75413841	LSM-13044		54657773	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17-,18+,19-/m0/s1	LJZGTTWSAOWWCB-OKYOBFRVSA-N	CCC(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@@H]12	BroadT	BRD-K75413841	BRD-K75413841-001-01-1	Broad Institute of MIT and Harvard	BRD-K75413841			CCC(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@@H]12	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17-,18+,19-/m0/s1	LJZGTTWSAOWWCB-OKYOBFRVSA-N	426.196628416							101681
BRD-K57087594	LSM-11889		54657706	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13-,14-,15+/m0/s1	JDRFUATZRDBDCA-ZQDZILKHSA-N	CN1C[C@H](O)COC[C@H]2O[C@H](CC(=O)NC3CCC3)CC[C@H]12	BroadT	BRD-K57087594	BRD-K57087594-001-01-4	Broad Institute of MIT and Harvard	BRD-K57087594			CN1C[C@H](O)COC[C@H]2O[C@H](CC(=O)NC3CCC3)CC[C@H]12	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13-,14-,15+/m0/s1	JDRFUATZRDBDCA-ZQDZILKHSA-N	312.204907396							100515
BRD-K26193607	LSM-10016		54657515	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17+,18+,19-/m0/s1	LOZCXWBJFMLABO-MANSERQUSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K26193607	BRD-K26193607-001-01-3	Broad Institute of MIT and Harvard	BRD-K26193607			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(CCC(F)(F)F)C1	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17+,18+,19-/m0/s1	LOZCXWBJFMLABO-MANSERQUSA-N	436.25489222							98637
BRD-K30837577	LSM-10288		54657537	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22+,23+,24-/m0/s1	QYSMODXJNCJWNA-QNBQWMASSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K30837577	BRD-K30837577-001-01-5	Broad Institute of MIT and Harvard	BRD-K30837577			C[C@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22+,23+,24-/m0/s1	QYSMODXJNCJWNA-QNBQWMASSA-N	501.203048864							98909
BRD-K09388341	LSM-8994		54657610	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21+,23+,24-/m0/s1	VYCGBAYEGCCJIH-SCDRESIJSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@H]2N(Cc4cc(F)ccc4F)C1	BroadT	BRD-K09388341	BRD-K09388341-001-01-1	Broad Institute of MIT and Harvard	BRD-K09388341			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@H]2N(Cc2cc(F)ccc2F)C1	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21+,23+,24-/m0/s1	VYCGBAYEGCCJIH-SCDRESIJSA-N	494.178391538							97615
BRD-K51583960	LSM-11583		54657678	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20+,21-,22+/m1/s1	UTTUQCGEIXLGEI-MBDNFAEBSA-N	O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2COC1	BroadT	BRD-K51583960	BRD-K51583960-001-01-4	Broad Institute of MIT and Harvard	BRD-K51583960			O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@H]2COC1	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20+,21-,22+/m1/s1	UTTUQCGEIXLGEI-MBDNFAEBSA-N	396.204907396							100206
BRD-K72502177	LSM-12877		54657760	InChI=1S/C25H36ClN3O5/c26-18-6-8-19(9-7-18)28-25(32)29-14-20(30)15-33-16-23-22(29)11-10-21(34-23)12-24(31)27-13-17-4-2-1-3-5-17/h6-9,17,20-23,30H,1-5,10-16H2,(H,27,31)(H,28,32)/t20-,21+,22+,23-/m1/s1	SYCYKHHPUCXRJT-WZYRSQIMSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)C(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K72502177	BRD-K72502177-001-01-8	Broad Institute of MIT and Harvard	BRD-K72502177			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)C(=O)Nc1ccc(Cl)cc1	InChI=1S/C25H36ClN3O5/c26-18-6-8-19(9-7-18)28-25(32)29-14-20(30)15-33-16-23-22(29)11-10-21(34-23)12-24(31)27-13-17-4-2-1-3-5-17/h6-9,17,20-23,30H,1-5,10-16H2,(H,27,31)(H,28,32)/t20-,21+,22+,23-/m1/s1	SYCYKHHPUCXRJT-WZYRSQIMSA-N	493.234348992							101514
BRD-K05856102	LSM-8773		54657490	InChI=1S/C22H39N3O5/c1-23-6-8-24(9-7-23)22(27)12-19-2-3-20-21(30-19)16-29-15-18(26)14-25(20)13-17-4-10-28-11-5-17/h17-21,26H,2-16H2,1H3/t18-,19+,20+,21-/m1/s1	MTMISLSQWFYTRE-IVAOSVALSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3CC4CCOCC4)O2	BroadT	BRD-K05856102	BRD-K05856102-001-01-0	Broad Institute of MIT and Harvard	BRD-K05856102			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2CC2CCOCC2)O1	InChI=1S/C22H39N3O5/c1-23-6-8-24(9-7-23)22(27)12-19-2-3-20-21(30-19)16-29-15-18(26)14-25(20)13-17-4-10-28-11-5-17/h17-21,26H,2-16H2,1H3/t18-,19+,20+,21-/m1/s1	MTMISLSQWFYTRE-IVAOSVALSA-N	425.288971378							97394
BRD-K42986817	LSM-11041		54657541	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22+,23+,24-/m0/s1	QYSMODXJNCJWNA-RUWBUGSCSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K42986817	BRD-K42986817-001-01-6	Broad Institute of MIT and Harvard	BRD-K42986817			C[C@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22+,23+,24-/m0/s1	QYSMODXJNCJWNA-RUWBUGSCSA-N	501.203048864							99662
BRD-K71504944	LSM-12799		54657609	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26+,27+,30-/m0/s1	OJBHRHOQEWVARJ-TXQUNOLYSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@H]2N(Cc5ccc6OCOc6c5)C1	BroadT	BRD-K71504944	BRD-K71504944-001-01-7	Broad Institute of MIT and Harvard	BRD-K71504944			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26+,27+,30-/m0/s1	OJBHRHOQEWVARJ-TXQUNOLYSA-N	530.241686828							101436
BRD-K58033375	LSM-11933		54657623	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15+,16-,17+/m1/s1	XUIBJKJBLJUMMA-TWMKSMIVSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)C3CCCC3)O1	BroadT	BRD-K58033375	BRD-K58033375-001-01-2	Broad Institute of MIT and Harvard	BRD-K58033375			CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)C2CCCC2)O1	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15+,16-,17+/m1/s1	XUIBJKJBLJUMMA-TWMKSMIVSA-N	368.231122144							100559
BRD-K47574438	LSM-11328		54657524	InChI=1S/C15H26N2O6/c1-2-5-16-15(21)17-7-10(18)8-22-9-13-12(17)4-3-11(23-13)6-14(19)20/h10-13,18H,2-9H2,1H3,(H,16,21)(H,19,20)/t10-,11-,12-,13+/m1/s1	DUBDZBJJIAHCBK-LPWJVIDDSA-N	CCCNC(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)O)CC[C@@H]12	BroadT	BRD-K47574438	BRD-K47574438-001-01-4	Broad Institute of MIT and Harvard	BRD-K47574438			CCCNC(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(O)=O)CC[C@@H]12	InChI=1S/C15H26N2O6/c1-2-5-16-15(21)17-7-10(18)8-22-9-13-12(17)4-3-11(23-13)6-14(19)20/h10-13,18H,2-9H2,1H3,(H,16,21)(H,19,20)/t10-,11-,12-,13+/m1/s1	DUBDZBJJIAHCBK-LPWJVIDDSA-N	330.179086572							99949
CHEMBL2362834	LSM-6832	SA-1973497, SID131454141, BRD-K45356824	54657695	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30-,31-,32+/m1/s1	HJQSQTAMFLANGO-JMSBNOGBSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@H]2N(Cc5ccc(Oc6ccccc6)cc5)C1	BroadT	BRD-K45356824	BRD-K45356824-001-01-0	Broad Institute of MIT and Harvard	BRD-K45356824			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@H]2N(Cc2ccc(Oc3ccccc3)cc2)C1	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30-,31-,32+/m1/s1	HJQSQTAMFLANGO-JMSBNOGBSA-N	542.278072336							95453
BRD-K90431990	LSM-13999		54657594	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25+,27+,29-/m1/s1	PLPDORRRKBPITR-NKLDQQJQSA-N	COc1ccccc1NC(=O)N2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)N4CCC(Cc5ccccc5)CC4)CC[C@H]23	BroadT	BRD-K90431990	BRD-K90431990-001-01-3	Broad Institute of MIT and Harvard	BRD-K90431990			COc1ccccc1NC(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]12	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25+,27+,29-/m1/s1	PLPDORRRKBPITR-NKLDQQJQSA-N	551.299536062							102652
BRD-K47752932	LSM-11337		54657702	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14-,16-,17+/m1/s1	XTMFCURZJJHNFP-SRABZTEZSA-N	CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c3ccccn3)O1	BroadT	BRD-K47752932	BRD-K47752932-001-01-7	Broad Institute of MIT and Harvard	BRD-K47752932			CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c2ccccn2)O1	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14-,16-,17+/m1/s1	XTMFCURZJJHNFP-SRABZTEZSA-N	377.195070994							99958
BRD-K78914942	LSM-13247		54657663	InChI=1S/C23H27NO8S/c25-16-13-24(21-11-8-19(12-23(26)27)32-22(21)15-30-14-16)33(28,29)20-9-6-18(7-10-20)31-17-4-2-1-3-5-17/h1-7,9-10,16,19,21-22,25H,8,11-15H2,(H,26,27)/t16-,19-,21+,22-/m0/s1	WUYMKGAOXGWOLL-VHHKXPHXSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)O)CC[C@H]2N(C1)S(=O)(=O)c3ccc(Oc4ccccc4)cc3	BroadT	BRD-K78914942	BRD-K78914942-001-01-3	Broad Institute of MIT and Harvard	BRD-K78914942			O[C@@H]1COC[C@@H]2O[C@H](CC(O)=O)CC[C@H]2N(C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1	InChI=1S/C23H27NO8S/c25-16-13-24(21-11-8-19(12-23(26)27)32-22(21)15-30-14-16)33(28,29)20-9-6-18(7-10-20)31-17-4-2-1-3-5-17/h1-7,9-10,16,19,21-22,25H,8,11-15H2,(H,26,27)/t16-,19-,21+,22-/m0/s1	WUYMKGAOXGWOLL-VHHKXPHXSA-N	477.145737524							101886
BRD-K52662613	LSM-11645		54657569	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22+,23+,24-/m1/s1	JSQZMBUYZHIIMM-AYVPJYCDSA-N	COc1ccc(CN2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)NCCN4CCCC4)CC[C@H]23)cc1	BroadT	BRD-K52662613	BRD-K52662613-001-01-6	Broad Institute of MIT and Harvard	BRD-K52662613			COc1ccc(CN2C[C@@H](O)COC[C@H]3O[C@H](CC(=O)NCCN4CCCC4)CC[C@H]23)cc1	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22+,23+,24-/m1/s1	JSQZMBUYZHIIMM-AYVPJYCDSA-N	461.288971378							100270
BRD-K77786391	LSM-13183		54657486	InChI=1S/C22H39N3O5/c1-23-6-8-24(9-7-23)22(27)12-19-2-3-20-21(30-19)16-29-15-18(26)14-25(20)13-17-4-10-28-11-5-17/h17-21,26H,2-16H2,1H3/t18-,19-,20+,21-/m1/s1	MTMISLSQWFYTRE-MXEMCNAFSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3CC4CCOCC4)O2	BroadT	BRD-K77786391	BRD-K77786391-001-01-2	Broad Institute of MIT and Harvard	BRD-K77786391			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2CC2CCOCC2)O1	InChI=1S/C22H39N3O5/c1-23-6-8-24(9-7-23)22(27)12-19-2-3-20-21(30-19)16-29-15-18(26)14-25(20)13-17-4-10-28-11-5-17/h17-21,26H,2-16H2,1H3/t18-,19-,20+,21-/m1/s1	MTMISLSQWFYTRE-MXEMCNAFSA-N	425.288971378							101821
BRD-K52207968	LSM-11623		54657521	InChI=1S/C15H26N2O6/c1-2-5-16-15(21)17-7-10(18)8-22-9-13-12(17)4-3-11(23-13)6-14(19)20/h10-13,18H,2-9H2,1H3,(H,16,21)(H,19,20)/t10-,11+,12-,13+/m1/s1	DUBDZBJJIAHCBK-XQHKEYJVSA-N	CCCNC(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)O)CC[C@@H]12	BroadT	BRD-K52207968	BRD-K52207968-001-01-1	Broad Institute of MIT and Harvard	BRD-K52207968			CCCNC(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(O)=O)CC[C@@H]12	InChI=1S/C15H26N2O6/c1-2-5-16-15(21)17-7-10(18)8-22-9-13-12(17)4-3-11(23-13)6-14(19)20/h10-13,18H,2-9H2,1H3,(H,16,21)(H,19,20)/t10-,11+,12-,13+/m1/s1	DUBDZBJJIAHCBK-XQHKEYJVSA-N	330.179086572							100248
CHEMBL2354536	LSM-6819	BRD-K07339740, SID131454138	54657692	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30+,31+,32-/m1/s1	HJQSQTAMFLANGO-CDFDACKPSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]2N(Cc5ccc(Oc6ccccc6)cc5)C1	BroadT	BRD-K07339740	BRD-K07339740-001-01-3	Broad Institute of MIT and Harvard	BRD-K07339740			O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]2N(Cc2ccc(Oc3ccccc3)cc2)C1	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30+,31+,32-/m1/s1	HJQSQTAMFLANGO-CDFDACKPSA-N	542.278072336							95440
BRD-K23558120	LSM-9843		54657713	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17+,22+,23-/m0/s1	NLZWENHPOORBAO-QOKUDNMUSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@H]2N(C1)C(=O)c4ccccc4F	BroadT	BRD-K23558120	BRD-K23558120-001-01-8	Broad Institute of MIT and Harvard	BRD-K23558120			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@H]2N(C1)C(=O)c1ccccc1F	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17+,22+,23-/m0/s1	NLZWENHPOORBAO-QOKUDNMUSA-N	524.128105604							98464
BRD-K55596430	LSM-11794		54657562	InChI=1S/C22H31ClN2O6S/c23-16-5-4-6-19(11-16)32(28,29)25-13-17(26)14-30-15-21-20(25)8-7-18(31-21)12-22(27)24-9-2-1-3-10-24/h4-6,11,17-18,20-21,26H,1-3,7-10,12-15H2/t17-,18-,20-,21+/m1/s1	WUWHFUUUQPRUMO-UKAVVXHISA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K55596430	BRD-K55596430-001-01-4	Broad Institute of MIT and Harvard	BRD-K55596430			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H31ClN2O6S/c23-16-5-4-6-19(11-16)32(28,29)25-13-17(26)14-30-15-21-20(25)8-7-18(31-21)12-22(27)24-9-2-1-3-10-24/h4-6,11,17-18,20-21,26H,1-3,7-10,12-15H2/t17-,18-,20-,21+/m1/s1	WUWHFUUUQPRUMO-UKAVVXHISA-N	486.159135132							100419
BRD-K69496558-001-01-7	LSM-29038	BRD-K69496558	54657474	InChI=1S/C19H28N2O6S/c1-28(24,25)21-11-15(22)12-26-13-18-17(21)8-7-16(27-18)9-19(23)20-10-14-5-3-2-4-6-14/h2-6,15-18,22H,7-13H2,1H3,(H,20,23)/t15-,16+,17+,18-/m1/s1	CRYMYAPOZVNFQJ-VSZNYVQBSA-N	CS(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)NCc3ccccc3)CC[C@H]12	BroadT	BRD-K69496558	BRD-K69496558-001-01-7	Broad Institute of MIT and Harvard	BRD-K69496558			CS(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)NCc3ccccc3)CC[C@H]12	InChI=1S/C19H28N2O6S/c1-28(24,25)21-11-15(22)12-26-13-18-17(21)8-7-16(27-18)9-19(23)20-10-14-5-3-2-4-6-14/h2-6,15-18,22H,7-13H2,1H3,(H,20,23)/t15-,16+,17+,18-/m1/s1	CRYMYAPOZVNFQJ-VSZNYVQBSA-N	412.166807326							117589
BRD-K40597368	LSM-10909		54657480	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9+,10+,11-/m0/s1	FKMAUGDURCCEJG-ZDCRXTMVSA-N	COC(=O)C[C@H]1CC[C@H]2NC[C@H](O)COC[C@@H]2O1	BroadT	BRD-K40597368	BRD-K40597368-001-01-6	Broad Institute of MIT and Harvard	BRD-K40597368			COC(=O)C[C@H]1CC[C@H]2NC[C@H](O)COC[C@@H]2O1	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9+,10+,11-/m0/s1	FKMAUGDURCCEJG-ZDCRXTMVSA-N	259.141972782							99530
BRD-K91686310	LSM-14059		54657653	InChI=1S/C22H27FN4O6S/c23-15-2-1-3-19(8-15)34(30,31)27-11-17(28)12-32-13-21-20(27)5-4-18(33-21)9-22(29)25-10-16-6-7-24-14-26-16/h1-3,6-8,14,17-18,20-21,28H,4-5,9-13H2,(H,25,29)/t17-,18-,20-,21+/m1/s1	FPMJOPUHYZGMQU-UKAVVXHISA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccncn3)CC[C@H]2N(C1)S(=O)(=O)c4cccc(F)c4	BroadT	BRD-K91686310	BRD-K91686310-001-01-4	Broad Institute of MIT and Harvard	BRD-K91686310			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccncn3)CC[C@H]2N(C1)S(=O)(=O)c1cccc(F)c1	InChI=1S/C22H27FN4O6S/c23-15-2-1-3-19(8-15)34(30,31)27-11-17(28)12-32-13-21-20(27)5-4-18(33-21)9-22(29)25-10-16-6-7-24-14-26-16/h1-3,6-8,14,17-18,20-21,28H,4-5,9-13H2,(H,25,29)/t17-,18-,20-,21+/m1/s1	FPMJOPUHYZGMQU-UKAVVXHISA-N	494.163533514							102712
BRD-K61260096	LSM-12138		54657688	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17-,19+,20-/m0/s1	VRNJYJIECLSBHX-XEYPJELSSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccccc3Cl)CC[C@H]2N(Cc4nccs4)C1	BroadT	BRD-K61260096	BRD-K61260096-001-01-4	Broad Institute of MIT and Harvard	BRD-K61260096			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccccc3Cl)CC[C@H]2N(Cc2nccs2)C1	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17-,19+,20-/m0/s1	VRNJYJIECLSBHX-XEYPJELSSA-N	465.148904806							100764
BRD-K85955502	LSM-13695		54657645	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18-,19-,22+/m0/s1	QICYWJCDSALLPT-ZVVDCOBXSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3C(=O)Nc4ccc5OCOc5c4)O2	BroadT	BRD-K85955502	BRD-K85955502-001-01-9	Broad Institute of MIT and Harvard	BRD-K85955502			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)Nc2ccc3OCOc3c2)O1	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18-,19-,22+/m0/s1	QICYWJCDSALLPT-ZVVDCOBXSA-N	490.242749468							102343
BRD-K64622657	LSM-12376		54657485	InChI=1S/C22H39N3O5/c1-23-6-8-24(9-7-23)22(27)12-19-2-3-20-21(30-19)16-29-15-18(26)14-25(20)13-17-4-10-28-11-5-17/h17-21,26H,2-16H2,1H3/t18-,19+,20+,21-/m0/s1	MTMISLSQWFYTRE-BQJUDKOJSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3CC4CCOCC4)O2	BroadT	BRD-K64622657	BRD-K64622657-001-01-3	Broad Institute of MIT and Harvard	BRD-K64622657			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2CC2CCOCC2)O1	InChI=1S/C22H39N3O5/c1-23-6-8-24(9-7-23)22(27)12-19-2-3-20-21(30-19)16-29-15-18(26)14-25(20)13-17-4-10-28-11-5-17/h17-21,26H,2-16H2,1H3/t18-,19+,20+,21-/m0/s1	MTMISLSQWFYTRE-BQJUDKOJSA-N	425.288971378							101003
BRD-K50186544	LSM-11482		54657592	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14+,15-,18+/m1/s1	YFRMSEXFMHDWES-FSZRXZPDSA-N	O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COC1	BroadT	BRD-K50186544	BRD-K50186544-001-01-2	Broad Institute of MIT and Harvard	BRD-K50186544			O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COC1	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14+,15-,18+/m1/s1	YFRMSEXFMHDWES-FSZRXZPDSA-N	378.179086572							100103
BRD-K51759637	LSM-11593		54657534	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22-,23-,24+/m0/s1	QYSMODXJNCJWNA-DROZZWDISA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K51759637	BRD-K51759637-001-01-3	Broad Institute of MIT and Harvard	BRD-K51759637			C[C@H](NC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22-,23-,24+/m0/s1	QYSMODXJNCJWNA-DROZZWDISA-N	501.203048864							100216
BRD-K22080587	LSM-9765		54657726	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15-,16-,17+/m0/s1	WSFSIZCPNKDEIH-LUKYLMHMSA-N	O[C@H]1CN[C@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COC1	BroadT	BRD-K22080587	BRD-K22080587-001-01-0	Broad Institute of MIT and Harvard	BRD-K22080587			O[C@H]1CN[C@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COC1	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15-,16-,17+/m0/s1	WSFSIZCPNKDEIH-LUKYLMHMSA-N	355.247106566							98386
CHEMBL2362018	LSM-13097	BRD-K76352755, SID131454050	54657606	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26-,27+,30-/m0/s1	OJBHRHOQEWVARJ-MHTMXISKSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@H]2N(Cc5ccc6OCOc6c5)C1	BroadT	BRD-K76352755	BRD-K76352755-001-01-4	Broad Institute of MIT and Harvard	BRD-K76352755			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26-,27+,30-/m0/s1	OJBHRHOQEWVARJ-MHTMXISKSA-N	530.241686828							101735
BRD-K51256476	LSM-11563		54657511	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20+,21-,22+/m0/s1	TWGHTEGHSVIJBR-LNRXMEIDSA-N	Cn1cnc(CCNC(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3C(=O)Nc4ccc(cc4)C(F)(F)F)O2)c1	BroadT	BRD-K51256476	BRD-K51256476-001-01-4	Broad Institute of MIT and Harvard	BRD-K51256476			Cn1cnc(CCNC(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3C(=O)Nc3ccc(cc3)C(F)(F)F)O2)c1	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20+,21-,22+/m0/s1	TWGHTEGHSVIJBR-LNRXMEIDSA-N	539.235553774							100186
BRD-K75322905	LSM-13035		54657738	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25-,26+,27-/m0/s1	WTHWQCPYZWPYSX-NFGXINMFSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@H]2N(C1)C(=O)c5cccnc5	BroadT	BRD-K75322905	BRD-K75322905-001-01-7	Broad Institute of MIT and Harvard	BRD-K75322905			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@H]2N(C1)C(=O)c1cccnc1	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25-,26+,27-/m0/s1	WTHWQCPYZWPYSX-NFGXINMFSA-N	501.226371122							101672
BRD-K58856256	LSM-11985		54657571	InChI=1S/C26H36N4O5/c31-22-14-30(13-21-15-34-18-27-21)24-7-6-23(35-25(24)17-33-16-22)10-26(32)28-20-8-9-29(12-20)11-19-4-2-1-3-5-19/h1-5,15,18,20,22-25,31H,6-14,16-17H2,(H,28,32)/t20-,22-,23-,24-,25+/m1/s1	PSFFUTLOGKFPDU-MRPKTGBJSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]2N(Cc5cocn5)C1	BroadT	BRD-K58856256	BRD-K58856256-001-01-0	Broad Institute of MIT and Harvard	BRD-K58856256			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC[C@H]2N(Cc2cocn2)C1	InChI=1S/C26H36N4O5/c31-22-14-30(13-21-15-34-18-27-21)24-7-6-23(35-25(24)17-33-16-22)10-26(32)28-20-8-9-29(12-20)11-19-4-2-1-3-5-19/h1-5,15,18,20,22-25,31H,6-14,16-17H2,(H,28,32)/t20-,22-,23-,24-,25+/m1/s1	PSFFUTLOGKFPDU-MRPKTGBJSA-N	484.268570292							100611
BRD-K12411600	LSM-9168		54657612	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21-,23+,24-/m1/s1	VYCGBAYEGCCJIH-CJTFWIGWSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@@H]2N(Cc4cc(F)ccc4F)C1	BroadT	BRD-K12411600	BRD-K12411600-001-01-2	Broad Institute of MIT and Harvard	BRD-K12411600			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@@H]2N(Cc2cc(F)ccc2F)C1	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21-,23+,24-/m1/s1	VYCGBAYEGCCJIH-CJTFWIGWSA-N	494.178391538							97789
BRD-K66356233	LSM-12471		54657616	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21-,23-,24+/m1/s1	VYCGBAYEGCCJIH-KOVSNXQUSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@H]2N(Cc4cc(F)ccc4F)C1	BroadT	BRD-K66356233	BRD-K66356233-001-01-9	Broad Institute of MIT and Harvard	BRD-K66356233			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@H]2N(Cc2cc(F)ccc2F)C1	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21-,23-,24+/m1/s1	VYCGBAYEGCCJIH-KOVSNXQUSA-N	494.178391538							101102
BRD-K32931486	LSM-10430		54657660	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21-,22+,24-/m1/s1	ADXBMBRYFBFALA-PIATZUFCSA-N	COc1ccccc1CNC(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3C(=O)Nc4ccc(F)cc4)O2	BroadT	BRD-K32931486	BRD-K32931486-001-01-4	Broad Institute of MIT and Harvard	BRD-K32931486			COc1ccccc1CNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)Nc2ccc(F)cc2)O1	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21-,22+,24-/m1/s1	ADXBMBRYFBFALA-PIATZUFCSA-N	501.227513974							99051
BRD-K89056622	LSM-13907		54657476	InChI=1S/C19H28N2O6S/c1-28(24,25)21-11-15(22)12-26-13-18-17(21)8-7-16(27-18)9-19(23)20-10-14-5-3-2-4-6-14/h2-6,15-18,22H,7-13H2,1H3,(H,20,23)/t15-,16+,17-,18+/m0/s1	CRYMYAPOZVNFQJ-XWTMOSNGSA-N	CS(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3ccccc3)CC[C@H]12	BroadT	BRD-K89056622	BRD-K89056622-001-01-7	Broad Institute of MIT and Harvard	BRD-K89056622			CS(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3ccccc3)CC[C@H]12	InChI=1S/C19H28N2O6S/c1-28(24,25)21-11-15(22)12-26-13-18-17(21)8-7-16(27-18)9-19(23)20-10-14-5-3-2-4-6-14/h2-6,15-18,22H,7-13H2,1H3,(H,20,23)/t15-,16+,17-,18+/m0/s1	CRYMYAPOZVNFQJ-XWTMOSNGSA-N	412.166807326							102560
BRD-K09292709	LSM-8989		54657548	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22-,23+,24-/m0/s1	QYSMODXJNCJWNA-LVTPPWGZSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K09292709	BRD-K09292709-001-01-1	Broad Institute of MIT and Harvard	BRD-K09292709			C[C@H](NC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22-,23+,24-/m0/s1	QYSMODXJNCJWNA-LVTPPWGZSA-N	501.203048864							97610
BRD-K27915767	LSM-10115		54657503	InChI=1S/C24H32N2O7/c27-17-11-26(24(29)15-5-8-20-21(9-15)32-14-31-20)19-7-6-18(33-22(19)13-30-12-17)10-23(28)25-16-3-1-2-4-16/h5,8-9,16-19,22,27H,1-4,6-7,10-14H2,(H,25,28)/t17-,18+,19-,22+/m1/s1	JZHWTQAESVMWQB-MOXWOTFGSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NC3CCCC3)CC[C@H]2N(C1)C(=O)c4ccc5OCOc5c4	BroadT	BRD-K27915767	BRD-K27915767-001-01-4	Broad Institute of MIT and Harvard	BRD-K27915767			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NC3CCCC3)CC[C@H]2N(C1)C(=O)c1ccc2OCOc2c1	InChI=1S/C24H32N2O7/c27-17-11-26(24(29)15-5-8-20-21(9-15)32-14-31-20)19-7-6-18(33-22(19)13-30-12-17)10-23(28)25-16-3-1-2-4-16/h5,8-9,16-19,22,27H,1-4,6-7,10-14H2,(H,25,28)/t17-,18+,19-,22+/m1/s1	JZHWTQAESVMWQB-MOXWOTFGSA-N	460.220951384							98736
BRD-K21572481	LSM-9739		54657741	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25-,26-,27+/m1/s1	WTHWQCPYZWPYSX-CWTOASCOSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@H]2N(C1)C(=O)c5cccnc5	BroadT	BRD-K21572481	BRD-K21572481-001-01-4	Broad Institute of MIT and Harvard	BRD-K21572481			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@H]2N(C1)C(=O)c1cccnc1	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25-,26-,27+/m1/s1	WTHWQCPYZWPYSX-CWTOASCOSA-N	501.226371122							98360
BRD-K09458434	LSM-9004		54657697	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14-,16+,17-/m1/s1	XTMFCURZJJHNFP-TXCZRRACSA-N	CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c3ccccn3)O1	BroadT	BRD-K09458434	BRD-K09458434-001-01-0	Broad Institute of MIT and Harvard	BRD-K09458434			CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c2ccccn2)O1	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14-,16+,17-/m1/s1	XTMFCURZJJHNFP-TXCZRRACSA-N	377.195070994							97625
BRD-K15752270	LSM-9373		54657675	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20+,21+,22-/m0/s1	UTTUQCGEIXLGEI-CBPXPLCBSA-N	O[C@H]1CN[C@@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2COC1	BroadT	BRD-K15752270	BRD-K15752270-001-01-5	Broad Institute of MIT and Harvard	BRD-K15752270			O[C@H]1CN[C@@H]2CC[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@H]2COC1	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20+,21+,22-/m0/s1	UTTUQCGEIXLGEI-CBPXPLCBSA-N	396.204907396							97994
BRD-K51457407	LSM-11576		54657687	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17+,19+,20-/m1/s1	VRNJYJIECLSBHX-LCLWPZTBSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccccc3Cl)CC[C@@H]2N(Cc4nccs4)C1	BroadT	BRD-K51457407	BRD-K51457407-001-01-2	Broad Institute of MIT and Harvard	BRD-K51457407			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccccc3Cl)CC[C@@H]2N(Cc2nccs2)C1	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17+,19+,20-/m1/s1	VRNJYJIECLSBHX-LCLWPZTBSA-N	465.148904806							100199
BRD-K31830150	LSM-10360		54657736	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25+,26-,27+/m1/s1	WTHWQCPYZWPYSX-RAVGUYNFSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@H]2N(C1)C(=O)c5cccnc5	BroadT	BRD-K31830150	BRD-K31830150-001-01-4	Broad Institute of MIT and Harvard	BRD-K31830150			O[C@H]1COC[C@@H]2O[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@H]2N(C1)C(=O)c1cccnc1	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25+,26-,27+/m1/s1	WTHWQCPYZWPYSX-RAVGUYNFSA-N	501.226371122							98981
BRD-K02055666	LSM-8557		54657642	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18+,19-,22+/m0/s1	QICYWJCDSALLPT-LMVRJCEZSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3C(=O)Nc4ccc5OCOc5c4)O2	BroadT	BRD-K02055666	BRD-K02055666-001-01-0	Broad Institute of MIT and Harvard	BRD-K02055666			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)Nc2ccc3OCOc3c2)O1	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18+,19-,22+/m0/s1	QICYWJCDSALLPT-LMVRJCEZSA-N	490.242749468							97178
BRD-K82669795	LSM-13477		54657482	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9+,10-,11+/m0/s1	FKMAUGDURCCEJG-ZRUFSTJUSA-N	COC(=O)C[C@H]1CC[C@@H]2NC[C@H](O)COC[C@H]2O1	BroadT	BRD-K82669795	BRD-K82669795-001-01-5	Broad Institute of MIT and Harvard	BRD-K82669795			COC(=O)C[C@H]1CC[C@@H]2NC[C@H](O)COC[C@H]2O1	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9+,10-,11+/m0/s1	FKMAUGDURCCEJG-ZRUFSTJUSA-N	259.141972782							102117
BRD-K49070267	LSM-11410		54657619	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15-,16-,17+/m0/s1	XUIBJKJBLJUMMA-LUKYLMHMSA-N	CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)C3CCCC3)O1	BroadT	BRD-K49070267	BRD-K49070267-001-01-7	Broad Institute of MIT and Harvard	BRD-K49070267			CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)C2CCCC2)O1	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15-,16-,17+/m0/s1	XUIBJKJBLJUMMA-LUKYLMHMSA-N	368.231122144							100031
BRD-K48360530	LSM-11371		54657557	InChI=1S/C22H31ClN2O6S/c23-16-5-4-6-19(11-16)32(28,29)25-13-17(26)14-30-15-21-20(25)8-7-18(31-21)12-22(27)24-9-2-1-3-10-24/h4-6,11,17-18,20-21,26H,1-3,7-10,12-15H2/t17-,18-,20+,21-/m0/s1	WUWHFUUUQPRUMO-MMKMLUHNSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K48360530	BRD-K48360530-001-01-4	Broad Institute of MIT and Harvard	BRD-K48360530			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H31ClN2O6S/c23-16-5-4-6-19(11-16)32(28,29)25-13-17(26)14-30-15-21-20(25)8-7-18(31-21)12-22(27)24-9-2-1-3-10-24/h4-6,11,17-18,20-21,26H,1-3,7-10,12-15H2/t17-,18-,20+,21-/m0/s1	WUWHFUUUQPRUMO-MMKMLUHNSA-N	486.159135132							99992
BRD-K20281332	LSM-9667		54657790	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19-,20+,21-/m0/s1	QGGFARYSPQJNIH-BURNTYAHSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2CC3CCCC3)O1	BroadT	BRD-K20281332	BRD-K20281332-001-01-4	Broad Institute of MIT and Harvard	BRD-K20281332			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2CC2CCCC2)O1	InChI=1S/C22H41N3O4/c1-24(2)11-5-10-23-22(27)12-19-8-9-20-21(29-19)16-28-15-18(26)14-25(20)13-17-6-3-4-7-17/h17-21,26H,3-16H2,1-2H3,(H,23,27)/t18-,19-,20+,21-/m0/s1	QGGFARYSPQJNIH-BURNTYAHSA-N	411.309706822							98288
BRD-K66577472	LSM-12482		54657718	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17-,22+,23-/m1/s1	NLZWENHPOORBAO-ROEJJBDBSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@@H]2N(C1)C(=O)c4ccccc4F	BroadT	BRD-K66577472	BRD-K66577472-001-01-0	Broad Institute of MIT and Harvard	BRD-K66577472			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@@H]2N(C1)C(=O)c1ccccc1F	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17-,22+,23-/m1/s1	NLZWENHPOORBAO-ROEJJBDBSA-N	524.128105604							101113
BRD-K41120089	LSM-10930		54657771	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17+,18-,19+/m0/s1	LJZGTTWSAOWWCB-ZSYWTGECSA-N	CCC(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@H]12	BroadT	BRD-K41120089	BRD-K41120089-001-01-4	Broad Institute of MIT and Harvard	BRD-K41120089			CCC(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@H]12	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17+,18-,19+/m0/s1	LJZGTTWSAOWWCB-ZSYWTGECSA-N	426.196628416							99551
BRD-K50716931	LSM-11517		54657492	InChI=1S/C26H34N4O6/c1-16-25(17(2)36-28-16)27-26(33)30-13-20(31)14-34-15-23-22(30)8-7-21(35-23)11-24(32)29-10-9-18-5-3-4-6-19(18)12-29/h3-6,20-23,31H,7-15H2,1-2H3,(H,27,33)/t20-,21+,22-,23+/m1/s1	SVQJPVUULHSFBY-ACESQOTJSA-N	Cc1onc(C)c1NC(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)N4CCc5ccccc5C4)CC[C@@H]23	BroadT	BRD-K50716931	BRD-K50716931-001-01-7	Broad Institute of MIT and Harvard	BRD-K50716931			Cc1noc(C)c1NC(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]12	InChI=1S/C26H34N4O6/c1-16-25(17(2)36-28-16)27-26(33)30-13-20(31)14-34-15-23-22(30)8-7-21(35-23)11-24(32)29-10-9-18-5-3-4-6-19(18)12-29/h3-6,20-23,31H,7-15H2,1-2H3,(H,27,33)/t20-,21+,22-,23+/m1/s1	SVQJPVUULHSFBY-ACESQOTJSA-N	498.247834848							100138
BRD-K09542523	LSM-9009		54657552	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12-,13-,14+/m1/s1	HDTRYUIMSWCRLO-SYQHCUMBSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c3cn(C)cn3)O1	BroadT	BRD-K09542523	BRD-K09542523-001-01-3	Broad Institute of MIT and Harvard	BRD-K09542523			COC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c2cn(C)cn2)O1	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12-,13-,14+/m1/s1	HDTRYUIMSWCRLO-SYQHCUMBSA-N	403.14132086							97630
BRD-K60994920	LSM-12119		54657563	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22-,23-,24+/m1/s1	JSQZMBUYZHIIMM-BUZMGHMJSA-N	COc1ccc(CN2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)NCCN4CCCC4)CC[C@@H]23)cc1	BroadT	BRD-K60994920	BRD-K60994920-001-01-1	Broad Institute of MIT and Harvard	BRD-K60994920			COc1ccc(CN2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)NCCN4CCCC4)CC[C@@H]23)cc1	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22-,23-,24+/m1/s1	JSQZMBUYZHIIMM-BUZMGHMJSA-N	461.288971378							100745
BRD-K65482654	LSM-12424		54657630	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24+,25+,26-/m0/s1	JKLIXGQQXOXZKK-QUMGSSFMSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NC3Cc4ccccc4C3)CC[C@H]2N(C1)C(=O)Cc5ccccc5	BroadT	BRD-K65482654	BRD-K65482654-001-01-4	Broad Institute of MIT and Harvard	BRD-K65482654			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NC3Cc4ccccc4C3)CC[C@H]2N(C1)C(=O)Cc1ccccc1	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24+,25+,26-/m0/s1	JKLIXGQQXOXZKK-QUMGSSFMSA-N	478.246772208							101051
BRD-K13693445	LSM-9254		54657580	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24+,25-,26+/m1/s1	VMOCTUISBGPURH-ZJSPYRCASA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@H]2N(Cc4cccc(c4)c5ccncc5)C1	BroadT	BRD-K13693445	BRD-K13693445-001-01-3	Broad Institute of MIT and Harvard	BRD-K13693445			O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@H]2N(Cc2cccc(c2)-c2ccncc2)C1	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24+,25-,26+/m1/s1	VMOCTUISBGPURH-ZJSPYRCASA-N	481.25767125							97875
BRD-K25159388	LSM-9958		54657567	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22-,23-,24+/m0/s1	JSQZMBUYZHIIMM-TWDDROGUSA-N	COc1ccc(CN2C[C@H](O)COC[C@H]3O[C@H](CC(=O)NCCN4CCCC4)CC[C@H]23)cc1	BroadT	BRD-K25159388	BRD-K25159388-001-01-0	Broad Institute of MIT and Harvard	BRD-K25159388			COc1ccc(CN2C[C@H](O)COC[C@H]3O[C@H](CC(=O)NCCN4CCCC4)CC[C@H]23)cc1	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22-,23-,24+/m0/s1	JSQZMBUYZHIIMM-TWDDROGUSA-N	461.288971378							98579
BRD-K75455321	LSM-13047		54657554	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12+,13-,14+/m1/s1	HDTRYUIMSWCRLO-RQJABVFESA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c3cn(C)cn3)O1	BroadT	BRD-K75455321	BRD-K75455321-001-01-1	Broad Institute of MIT and Harvard	BRD-K75455321			COC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c2cn(C)cn2)O1	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12+,13-,14+/m1/s1	HDTRYUIMSWCRLO-RQJABVFESA-N	403.14132086							101684
BRD-K03669312	LSM-8656		54657696	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14+,16+,17-/m1/s1	XTMFCURZJJHNFP-YQFWSFKMSA-N	CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c3ccccn3)O1	BroadT	BRD-K03669312	BRD-K03669312-001-01-5	Broad Institute of MIT and Harvard	BRD-K03669312			CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c2ccccn2)O1	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14+,16+,17-/m1/s1	XTMFCURZJJHNFP-YQFWSFKMSA-N	377.195070994							97277
BRD-K29253390	LSM-10196		54657549	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12+,13-,14+/m0/s1	HDTRYUIMSWCRLO-RFQIPJPRSA-N	COC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c3cn(C)cn3)O1	BroadT	BRD-K29253390	BRD-K29253390-001-01-3	Broad Institute of MIT and Harvard	BRD-K29253390			COC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c2cn(C)cn2)O1	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12+,13-,14+/m0/s1	HDTRYUIMSWCRLO-RFQIPJPRSA-N	403.14132086							98817
BRD-K98054202	LSM-14456		54657498	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17-,18-,19+/m1/s1	HLMLEGKKEQKEEG-MKXGPGLRSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)Nc3nccs3)CC[C@H]2N(Cc4cc(F)cc(F)c4)C1	BroadT	BRD-K98054202	BRD-K98054202-001-01-9	Broad Institute of MIT and Harvard	BRD-K98054202			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)Nc3nccs3)CC[C@H]2N(Cc2cc(F)cc(F)c2)C1	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17-,18-,19+/m1/s1	HLMLEGKKEQKEEG-MKXGPGLRSA-N	453.1533834							103111
BRD-K26631510	LSM-10045		54657651	InChI=1S/C22H27FN4O6S/c23-15-2-1-3-19(8-15)34(30,31)27-11-17(28)12-32-13-21-20(27)5-4-18(33-21)9-22(29)25-10-16-6-7-24-14-26-16/h1-3,6-8,14,17-18,20-21,28H,4-5,9-13H2,(H,25,29)/t17-,18+,20+,21-/m1/s1	FPMJOPUHYZGMQU-YXYSEUPNSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccncn3)CC[C@@H]2N(C1)S(=O)(=O)c4cccc(F)c4	BroadT	BRD-K26631510	BRD-K26631510-001-01-8	Broad Institute of MIT and Harvard	BRD-K26631510			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccncn3)CC[C@@H]2N(C1)S(=O)(=O)c1cccc(F)c1	InChI=1S/C22H27FN4O6S/c23-15-2-1-3-19(8-15)34(30,31)27-11-17(28)12-32-13-21-20(27)5-4-18(33-21)9-22(29)25-10-16-6-7-24-14-26-16/h1-3,6-8,14,17-18,20-21,28H,4-5,9-13H2,(H,25,29)/t17-,18+,20+,21-/m1/s1	FPMJOPUHYZGMQU-YXYSEUPNSA-N	494.163533514							98666
BRD-K70392319	LSM-12722		54657739	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25-,26-,27+/m0/s1	WTHWQCPYZWPYSX-YIPNQBBMSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@@H]2N(C1)C(=O)c5cccnc5	BroadT	BRD-K70392319	BRD-K70392319-001-01-5	Broad Institute of MIT and Harvard	BRD-K70392319			O[C@@H]1COC[C@H]2O[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]2N(C1)C(=O)c1cccnc1	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25-,26-,27+/m0/s1	WTHWQCPYZWPYSX-YIPNQBBMSA-N	501.226371122							101358
BRD-K56764633	LSM-11861		54657685	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17-,19+,20-/m1/s1	VRNJYJIECLSBHX-IZBJGVDFSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@@H]2N(Cc4nccs4)C1	BroadT	BRD-K56764633	BRD-K56764633-001-01-2	Broad Institute of MIT and Harvard	BRD-K56764633			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@@H]2N(Cc2nccs2)C1	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17-,19+,20-/m1/s1	VRNJYJIECLSBHX-IZBJGVDFSA-N	465.148904806							100487
BRD-K18400716	LSM-9536		54657634	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17+,18+,19-/m0/s1	OUTWOBHUWTVFCP-MANSERQUSA-N	CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc3ccc(cc3)C(F)(F)F)O1	BroadT	BRD-K18400716	BRD-K18400716-001-01-0	Broad Institute of MIT and Harvard	BRD-K18400716			CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc2ccc(cc2)C(F)(F)F)O1	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17+,18+,19-/m0/s1	OUTWOBHUWTVFCP-MANSERQUSA-N	430.207942028							98157
BRD-K80278608	LSM-13334		54657499	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17-,18-,19+/m0/s1	HLMLEGKKEQKEEG-CADBVGFASA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)Nc3nccs3)CC[C@@H]2N(Cc4cc(F)cc(F)c4)C1	BroadT	BRD-K80278608	BRD-K80278608-001-01-4	Broad Institute of MIT and Harvard	BRD-K80278608			O[C@@H]1COC[C@H]2O[C@H](CC(=O)Nc3nccs3)CC[C@@H]2N(Cc2cc(F)cc(F)c2)C1	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17-,18-,19+/m0/s1	HLMLEGKKEQKEEG-CADBVGFASA-N	453.1533834							101973
BRD-K80496944	LSM-13350		54657674	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20-,21+,22-/m0/s1	UTTUQCGEIXLGEI-KJJMTIBFSA-N	O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2COC1	BroadT	BRD-K80496944	BRD-K80496944-001-01-5	Broad Institute of MIT and Harvard	BRD-K80496944			O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@H]2COC1	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20-,21+,22-/m0/s1	UTTUQCGEIXLGEI-KJJMTIBFSA-N	396.204907396							101989
BRD-K31415071	LSM-10330		54657575	InChI=1S/C25H37N3O6/c29-20-16-28(25(31)19-5-2-1-3-6-19)22-8-7-21(34-23(22)18-33-17-20)15-24(30)26-9-4-10-27-11-13-32-14-12-27/h1-3,5-6,20-23,29H,4,7-18H2,(H,26,30)/t20-,21-,22+,23-/m1/s1	AMMWEOQELITDAS-BXXSPATCSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCCCN3CCOCC3)CC[C@@H]2N(C1)C(=O)c4ccccc4	BroadT	BRD-K31415071	BRD-K31415071-001-01-0	Broad Institute of MIT and Harvard	BRD-K31415071			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCCCN3CCOCC3)CC[C@@H]2N(C1)C(=O)c1ccccc1	InChI=1S/C25H37N3O6/c29-20-16-28(25(31)19-5-2-1-3-6-19)22-8-7-21(34-23(22)18-33-17-20)15-24(30)26-9-4-10-27-11-13-32-14-12-27/h1-3,5-6,20-23,29H,4,7-18H2,(H,26,30)/t20-,21-,22+,23-/m1/s1	AMMWEOQELITDAS-BXXSPATCSA-N	475.268235934							98951
BRD-K03448064	LSM-8649		54657533	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22+,23+,24-/m1/s1	QYSMODXJNCJWNA-OPBLACEUSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K03448064	BRD-K03448064-001-01-4	Broad Institute of MIT and Harvard	BRD-K03448064			C[C@@H](NC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22+,23+,24-/m1/s1	QYSMODXJNCJWNA-OPBLACEUSA-N	501.203048864							97270
BRD-K12365616	LSM-9163		54657668	InChI=1S/C23H31FN2O5/c24-17-6-4-16(5-7-17)23(29)26-13-18(27)14-30-15-21-20(26)9-8-19(31-21)12-22(28)25-10-2-1-3-11-25/h4-7,18-21,27H,1-3,8-15H2/t18-,19+,20-,21+/m0/s1	HWBWJNULPIZKLY-JSXRDJHFSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@@H]2N(C1)C(=O)c4ccc(F)cc4	BroadT	BRD-K12365616	BRD-K12365616-001-01-2	Broad Institute of MIT and Harvard	BRD-K12365616			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@@H]2N(C1)C(=O)c1ccc(F)cc1	InChI=1S/C23H31FN2O5/c24-17-6-4-16(5-7-17)23(29)26-13-18(27)14-30-15-21-20(26)9-8-19(31-21)12-22(28)25-10-2-1-3-11-25/h4-7,18-21,27H,1-3,8-15H2/t18-,19+,20-,21+/m0/s1	HWBWJNULPIZKLY-JSXRDJHFSA-N	434.221700312							97784
BRD-K97194666	LSM-14402		54657778	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17-,18-,19+/m1/s1	MNYFKSZVIZZWBR-MKXGPGLRSA-N	O[C@@H]1CN[C@@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COC1	BroadT	BRD-K97194666	BRD-K97194666-001-01-3	Broad Institute of MIT and Harvard	BRD-K97194666			O[C@@H]1CN[C@@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17-,18-,19+/m1/s1	MNYFKSZVIZZWBR-MKXGPGLRSA-N	360.204907396							103056
BRD-K32897268	LSM-10427		54657786	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17-,18-,19+/m1/s1	GXFSXISHSMAVNQ-MKXGPGLRSA-N	COCCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c3cc(Cl)cc(Cl)c3)O1	BroadT	BRD-K32897268	BRD-K32897268-001-01-1	Broad Institute of MIT and Harvard	BRD-K32897268			COCCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c2cc(Cl)cc(Cl)c2)O1	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17-,18-,19+/m1/s1	GXFSXISHSMAVNQ-MKXGPGLRSA-N	474.132442056							99048
BRD-K95154332	LSM-14260		54657745	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26-,28+,29-/m0/s1	LOPBZILAZMWERO-KGKLHAENSA-N	Cc1cccc(c1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)Nc4ccc(cc4)c5ccccc5)CC[C@@H]23	BroadT	BRD-K95154332	BRD-K95154332-001-01-3	Broad Institute of MIT and Harvard	BRD-K95154332			Cc1cccc(c1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]12	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26-,28+,29-/m0/s1	LOPBZILAZMWERO-KGKLHAENSA-N	550.213757518							102914
BRD-K74894470	LSM-13019		54657493	InChI=1S/C26H34N4O6/c1-16-25(17(2)36-28-16)27-26(33)30-13-20(31)14-34-15-23-22(30)8-7-21(35-23)11-24(32)29-10-9-18-5-3-4-6-19(18)12-29/h3-6,20-23,31H,7-15H2,1-2H3,(H,27,33)/t20-,21-,22-,23+/m1/s1	SVQJPVUULHSFBY-ODAXIHTASA-N	Cc1onc(C)c1NC(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)N4CCc5ccccc5C4)CC[C@@H]23	BroadT	BRD-K74894470	BRD-K74894470-001-01-1	Broad Institute of MIT and Harvard	BRD-K74894470			Cc1noc(C)c1NC(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]12	InChI=1S/C26H34N4O6/c1-16-25(17(2)36-28-16)27-26(33)30-13-20(31)14-34-15-23-22(30)8-7-21(35-23)11-24(32)29-10-9-18-5-3-4-6-19(18)12-29/h3-6,20-23,31H,7-15H2,1-2H3,(H,27,33)/t20-,21-,22-,23+/m1/s1	SVQJPVUULHSFBY-ODAXIHTASA-N	498.247834848							101656
BRD-K78483792	LSM-13227		54657727	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15+,16+,17-/m0/s1	WSFSIZCPNKDEIH-HZMVEIRTSA-N	O[C@H]1CN[C@@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2COC1	BroadT	BRD-K78483792	BRD-K78483792-001-01-0	Broad Institute of MIT and Harvard	BRD-K78483792			O[C@H]1CN[C@@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2COC1	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15+,16+,17-/m0/s1	WSFSIZCPNKDEIH-HZMVEIRTSA-N	355.247106566							101866
BRD-K59340545	LSM-12016		54657597	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25-,27-,29+/m1/s1	PLPDORRRKBPITR-VSUKXTEZSA-N	COc1ccccc1NC(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)N4CCC(Cc5ccccc5)CC4)CC[C@@H]23	BroadT	BRD-K59340545	BRD-K59340545-001-01-5	Broad Institute of MIT and Harvard	BRD-K59340545			COc1ccccc1NC(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]12	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25-,27-,29+/m1/s1	PLPDORRRKBPITR-VSUKXTEZSA-N	551.299536062							100642
BRD-K89986699	LSM-13979		54657734	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22+,23+,24-/m1/s1	QCHQNBIYSRQADD-NAVOZUGXSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCCc3ccncc3)CC[C@@H]2N(Cc4cccc(c4)C(F)(F)F)C1	BroadT	BRD-K89986699	BRD-K89986699-001-01-3	Broad Institute of MIT and Harvard	BRD-K89986699			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCCc3ccncc3)CC[C@@H]2N(Cc2cccc(c2)C(F)(F)F)C1	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22+,23+,24-/m1/s1	QCHQNBIYSRQADD-NAVOZUGXSA-N	507.234491134							102632
MLS003650114	LSM-10820	BRD-K39405368, SID125305407	53382763	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21+,23-,24+/m0/s1	VYCGBAYEGCCJIH-SGKWCMOWSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@@H]2N(Cc4cc(F)ccc4F)C1	BroadT	BRD-K39405368	BRD-K39405368-001-01-5	Broad Institute of MIT and Harvard	BRD-K39405368			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@@H]2N(Cc2cc(F)ccc2F)C1	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21+,23-,24+/m0/s1	VYCGBAYEGCCJIH-SGKWCMOWSA-N	494.178391538							99441
BRD-K48945537	LSM-11408		54657742	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25+,26+,27-/m0/s1	WTHWQCPYZWPYSX-YAOOYPAMSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@H]2N(C1)C(=O)c5cccnc5	BroadT	BRD-K48945537	BRD-K48945537-001-01-5	Broad Institute of MIT and Harvard	BRD-K48945537			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@H]2N(C1)C(=O)c1cccnc1	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25+,26+,27-/m0/s1	WTHWQCPYZWPYSX-YAOOYPAMSA-N	501.226371122							100029
BRD-K10211010	LSM-9049		54657602	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26-,27-,30+/m0/s1	OJBHRHOQEWVARJ-NJBJSMFESA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@@H]2N(Cc5ccc6OCOc6c5)C1	BroadT	BRD-K10211010	BRD-K10211010-001-01-2	Broad Institute of MIT and Harvard	BRD-K10211010			O[C@@H]1COC[C@H]2O[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26-,27-,30+/m0/s1	OJBHRHOQEWVARJ-NJBJSMFESA-N	530.241686828							97670
BRD-K07100440	LSM-8846		54657703	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14+,16-,17+/m1/s1	XTMFCURZJJHNFP-WTTBNOFXSA-N	CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c3ccccn3)O1	BroadT	BRD-K07100440	BRD-K07100440-001-01-2	Broad Institute of MIT and Harvard	BRD-K07100440			CCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c2ccccn2)O1	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14+,16-,17+/m1/s1	XTMFCURZJJHNFP-WTTBNOFXSA-N	377.195070994							97467
BRD-K70852733	LSM-12751		54657531	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21-,23-,24+/m1/s1	LCHNJAZNAXXEPD-KOVSNXQUSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCN(CC3)c4ccccc4)CC[C@H]2N(C1)C(=O)c5cnccn5	BroadT	BRD-K70852733	BRD-K70852733-001-01-6	Broad Institute of MIT and Harvard	BRD-K70852733			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21-,23-,24+/m1/s1	LCHNJAZNAXXEPD-KOVSNXQUSA-N	495.248169206							101388
BRD-K86755654	LSM-13743		54657770	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17+,18+,19-/m1/s1	LJZGTTWSAOWWCB-YDZRNGNQSA-N	CCC(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@H]12	BroadT	BRD-K86755654	BRD-K86755654-001-01-8	Broad Institute of MIT and Harvard	BRD-K86755654			CCC(=O)N1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@H]12	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17+,18+,19-/m1/s1	LJZGTTWSAOWWCB-YDZRNGNQSA-N	426.196628416							102392
BRD-K68148111	LSM-12581		54657620	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15-,16+,17-/m0/s1	XUIBJKJBLJUMMA-NXOAAHMSSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)C3CCCC3)O1	BroadT	BRD-K68148111	BRD-K68148111-001-01-5	Broad Institute of MIT and Harvard	BRD-K68148111			CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)C2CCCC2)O1	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15-,16+,17-/m0/s1	XUIBJKJBLJUMMA-NXOAAHMSSA-N	368.231122144							101212
BRD-K24769439	LSM-9933		54657573	InChI=1S/C25H37N3O6/c29-20-16-28(25(31)19-5-2-1-3-6-19)22-8-7-21(34-23(22)18-33-17-20)15-24(30)26-9-4-10-27-11-13-32-14-12-27/h1-3,5-6,20-23,29H,4,7-18H2,(H,26,30)/t20-,21+,22-,23+/m1/s1	AMMWEOQELITDAS-ACESQOTJSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCCCN3CCOCC3)CC[C@H]2N(C1)C(=O)c4ccccc4	BroadT	BRD-K24769439	BRD-K24769439-001-01-6	Broad Institute of MIT and Harvard	BRD-K24769439			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCCCN3CCOCC3)CC[C@H]2N(C1)C(=O)c1ccccc1	InChI=1S/C25H37N3O6/c29-20-16-28(25(31)19-5-2-1-3-6-19)22-8-7-21(34-23(22)18-33-17-20)15-24(30)26-9-4-10-27-11-13-32-14-12-27/h1-3,5-6,20-23,29H,4,7-18H2,(H,26,30)/t20-,21+,22-,23+/m1/s1	AMMWEOQELITDAS-ACESQOTJSA-N	475.268235934							98554
BRD-K92656786	LSM-14107		54657508	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20+,21-,22+/m1/s1	TWGHTEGHSVIJBR-MBDNFAEBSA-N	Cn1cnc(CCNC(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3C(=O)Nc4ccc(cc4)C(F)(F)F)O2)c1	BroadT	BRD-K92656786	BRD-K92656786-001-01-1	Broad Institute of MIT and Harvard	BRD-K92656786			Cn1cnc(CCNC(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3C(=O)Nc3ccc(cc3)C(F)(F)F)O2)c1	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20+,21-,22+/m1/s1	TWGHTEGHSVIJBR-MBDNFAEBSA-N	539.235553774							102761
BRD-K49998237	LSM-11469		54657613	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21+,23+,24-/m1/s1	VYCGBAYEGCCJIH-AWAHEQQVSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@@H]2N(Cc4cc(F)ccc4F)C1	BroadT	BRD-K49998237	BRD-K49998237-001-01-6	Broad Institute of MIT and Harvard	BRD-K49998237			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@@H]2N(Cc2cc(F)ccc2F)C1	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21+,23+,24-/m1/s1	VYCGBAYEGCCJIH-AWAHEQQVSA-N	494.178391538							100090
BRD-K12388484	LSM-9165		54657636	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17-,18+,19-/m0/s1	OUTWOBHUWTVFCP-OKYOBFRVSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc3ccc(cc3)C(F)(F)F)O1	BroadT	BRD-K12388484	BRD-K12388484-001-01-3	Broad Institute of MIT and Harvard	BRD-K12388484			CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc2ccc(cc2)C(F)(F)F)O1	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17-,18+,19-/m0/s1	OUTWOBHUWTVFCP-OKYOBFRVSA-N	430.207942028							97786
BRD-K84218095	LSM-13577		54657721	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15+,16+,17-/m1/s1	WSFSIZCPNKDEIH-LTIDMASMSA-N	O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COC1	BroadT	BRD-K84218095	BRD-K84218095-001-01-6	Broad Institute of MIT and Harvard	BRD-K84218095			O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COC1	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15+,16+,17-/m1/s1	WSFSIZCPNKDEIH-LTIDMASMSA-N	355.247106566							102221
BRD-K93852877	LSM-14185		54657576	InChI=1S/C25H37N3O6/c29-20-16-28(25(31)19-5-2-1-3-6-19)22-8-7-21(34-23(22)18-33-17-20)15-24(30)26-9-4-10-27-11-13-32-14-12-27/h1-3,5-6,20-23,29H,4,7-18H2,(H,26,30)/t20-,21-,22-,23+/m1/s1	AMMWEOQELITDAS-ODAXIHTASA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCCCN3CCOCC3)CC[C@H]2N(C1)C(=O)c4ccccc4	BroadT	BRD-K93852877	BRD-K93852877-001-01-5	Broad Institute of MIT and Harvard	BRD-K93852877			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCCCN3CCOCC3)CC[C@H]2N(C1)C(=O)c1ccccc1	InChI=1S/C25H37N3O6/c29-20-16-28(25(31)19-5-2-1-3-6-19)22-8-7-21(34-23(22)18-33-17-20)15-24(30)26-9-4-10-27-11-13-32-14-12-27/h1-3,5-6,20-23,29H,4,7-18H2,(H,26,30)/t20-,21-,22-,23+/m1/s1	AMMWEOQELITDAS-ODAXIHTASA-N	475.268235934							102839
BRD-K75813018	LSM-13065		54657754	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14+,17-,18+/m1/s1	ZCDZHCWZNJFIKB-NONVJHHQSA-N	CNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc3ccc(Cl)c(Cl)c3)O1	BroadT	BRD-K75813018	BRD-K75813018-001-01-9	Broad Institute of MIT and Harvard	BRD-K75813018			CNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc2ccc(Cl)c(Cl)c2)O1	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14+,17-,18+/m1/s1	ZCDZHCWZNJFIKB-NONVJHHQSA-N	416.126962752							101702
BRD-K77774562	LSM-13182		54657520	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17-,18+,19-/m0/s1	LOZCXWBJFMLABO-OKYOBFRVSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K77774562	BRD-K77774562-001-01-1	Broad Institute of MIT and Harvard	BRD-K77774562			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(CCC(F)(F)F)C1	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17-,18+,19-/m0/s1	LOZCXWBJFMLABO-OKYOBFRVSA-N	436.25489222							101820
BRD-K97981711	LSM-14450		54657583	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24-,25-,26+/m1/s1	VMOCTUISBGPURH-POTDNYQPSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@H]2N(Cc4cccc(c4)c5ccncc5)C1	BroadT	BRD-K97981711	BRD-K97981711-001-01-8	Broad Institute of MIT and Harvard	BRD-K97981711			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@H]2N(Cc2cccc(c2)-c2ccncc2)C1	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24-,25-,26+/m1/s1	VMOCTUISBGPURH-POTDNYQPSA-N	481.25767125							103105
BRD-K26583430	LSM-10039		54657617	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15-,16-,17+/m1/s1	XUIBJKJBLJUMMA-VQHPVUNQSA-N	CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)C3CCCC3)O1	BroadT	BRD-K26583430	BRD-K26583430-001-01-8	Broad Institute of MIT and Harvard	BRD-K26583430			CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)C2CCCC2)O1	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15-,16-,17+/m1/s1	XUIBJKJBLJUMMA-VQHPVUNQSA-N	368.231122144							98660
BRD-K27161555	LSM-10070		54657542	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22+,23+,24-/m1/s1	QYSMODXJNCJWNA-ADWPFFDDSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K27161555	BRD-K27161555-001-01-1	Broad Institute of MIT and Harvard	BRD-K27161555			C[C@@H](NC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22+,23+,24-/m1/s1	QYSMODXJNCJWNA-ADWPFFDDSA-N	501.203048864							98691
BRD-K28636199	LSM-10162		54657572	InChI=1S/C25H37N3O6/c29-20-16-28(25(31)19-5-2-1-3-6-19)22-8-7-21(34-23(22)18-33-17-20)15-24(30)26-9-4-10-27-11-13-32-14-12-27/h1-3,5-6,20-23,29H,4,7-18H2,(H,26,30)/t20-,21-,22+,23-/m0/s1	AMMWEOQELITDAS-GPJHCHHRSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCCCN3CCOCC3)CC[C@H]2N(C1)C(=O)c4ccccc4	BroadT	BRD-K28636199	BRD-K28636199-001-01-3	Broad Institute of MIT and Harvard	BRD-K28636199			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCCCN3CCOCC3)CC[C@H]2N(C1)C(=O)c1ccccc1	InChI=1S/C25H37N3O6/c29-20-16-28(25(31)19-5-2-1-3-6-19)22-8-7-21(34-23(22)18-33-17-20)15-24(30)26-9-4-10-27-11-13-32-14-12-27/h1-3,5-6,20-23,29H,4,7-18H2,(H,26,30)/t20-,21-,22+,23-/m0/s1	AMMWEOQELITDAS-GPJHCHHRSA-N	475.268235934							98783
BRD-K16323731	LSM-9410		54657644	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18-,19-,22+/m1/s1	QICYWJCDSALLPT-YXTQBTIXSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3C(=O)Nc4ccc5OCOc5c4)O2	BroadT	BRD-K16323731	BRD-K16323731-001-01-7	Broad Institute of MIT and Harvard	BRD-K16323731			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)Nc2ccc3OCOc3c2)O1	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18-,19-,22+/m1/s1	QICYWJCDSALLPT-YXTQBTIXSA-N	490.242749468							98031
BRD-K80398603	LSM-13342		54657784	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17+,18-,19+/m1/s1	GXFSXISHSMAVNQ-HCXYKTFWSA-N	COCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c3cc(Cl)cc(Cl)c3)O1	BroadT	BRD-K80398603	BRD-K80398603-001-01-5	Broad Institute of MIT and Harvard	BRD-K80398603			COCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c2cc(Cl)cc(Cl)c2)O1	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17+,18-,19+/m1/s1	GXFSXISHSMAVNQ-HCXYKTFWSA-N	474.132442056							101981
BRD-K91143067	LSM-14035		54657544	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22+,23-,24+/m1/s1	QYSMODXJNCJWNA-RNBKDOAQSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K91143067	BRD-K91143067-001-01-1	Broad Institute of MIT and Harvard	BRD-K91143067			C[C@@H](NC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22+,23-,24+/m1/s1	QYSMODXJNCJWNA-RNBKDOAQSA-N	501.203048864							102688
BRD-K20197338	LSM-9660		54657749	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26-,28-,29+/m0/s1	LOPBZILAZMWERO-ZSLRCHCDSA-N	Cc1cccc(c1)S(=O)(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)Nc4ccc(cc4)c5ccccc5)CC[C@H]23	BroadT	BRD-K20197338	BRD-K20197338-001-01-6	Broad Institute of MIT and Harvard	BRD-K20197338			Cc1cccc(c1)S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@H]12	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26-,28-,29+/m0/s1	LOPBZILAZMWERO-ZSLRCHCDSA-N	550.213757518							98281
BRD-K30697829	LSM-10275		54657669	InChI=1S/C23H31FN2O5/c24-17-6-4-16(5-7-17)23(29)26-13-18(27)14-30-15-21-20(26)9-8-19(31-21)12-22(28)25-10-2-1-3-11-25/h4-7,18-21,27H,1-3,8-15H2/t18-,19+,20+,21-/m1/s1	HWBWJNULPIZKLY-IVAOSVALSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@@H]2N(C1)C(=O)c4ccc(F)cc4	BroadT	BRD-K30697829	BRD-K30697829-001-01-9	Broad Institute of MIT and Harvard	BRD-K30697829			O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@@H]2N(C1)C(=O)c1ccc(F)cc1	InChI=1S/C23H31FN2O5/c24-17-6-4-16(5-7-17)23(29)26-13-18(27)14-30-15-21-20(26)9-8-19(31-21)12-22(28)25-10-2-1-3-11-25/h4-7,18-21,27H,1-3,8-15H2/t18-,19+,20+,21-/m1/s1	HWBWJNULPIZKLY-IVAOSVALSA-N	434.221700312							98896
BRD-K07164057	LSM-8850		54657538	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22-,23+,24-/m0/s1	QYSMODXJNCJWNA-FPVDIDMMSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K07164057	BRD-K07164057-001-01-2	Broad Institute of MIT and Harvard	BRD-K07164057			C[C@H](NC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22-,23+,24-/m0/s1	QYSMODXJNCJWNA-FPVDIDMMSA-N	501.203048864							97471
BRD-K01971712	LSM-8551		54657590	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14-,15+,18-/m1/s1	YFRMSEXFMHDWES-ZXFNITATSA-N	O[C@@H]1CN[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COC1	BroadT	BRD-K01971712	BRD-K01971712-001-01-3	Broad Institute of MIT and Harvard	BRD-K01971712			O[C@@H]1CN[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COC1	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14-,15+,18-/m1/s1	YFRMSEXFMHDWES-ZXFNITATSA-N	378.179086572							97172
BRD-K03235359	LSM-8633		54657679	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20-,21+,22-/m1/s1	UTTUQCGEIXLGEI-YUMYIRISSA-N	O[C@@H]1CN[C@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2COC1	BroadT	BRD-K03235359	BRD-K03235359-001-01-9	Broad Institute of MIT and Harvard	BRD-K03235359			O[C@@H]1CN[C@H]2CC[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@@H]2COC1	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20-,21+,22-/m1/s1	UTTUQCGEIXLGEI-YUMYIRISSA-N	396.204907396							97254
BRD-K48035058	LSM-11350		54657550	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12-,13-,14+/m0/s1	HDTRYUIMSWCRLO-XDQVBPFNSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c3cn(C)cn3)O1	BroadT	BRD-K48035058	BRD-K48035058-001-01-4	Broad Institute of MIT and Harvard	BRD-K48035058			COC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2S(=O)(=O)c2cn(C)cn2)O1	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12-,13-,14+/m0/s1	HDTRYUIMSWCRLO-XDQVBPFNSA-N	403.14132086							99971
BRD-K11604106	LSM-9134		54657658	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21-,22-,24+/m1/s1	ADXBMBRYFBFALA-AZKZNFPZSA-N	COc1ccccc1CNC(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3C(=O)Nc4ccc(F)cc4)O2	BroadT	BRD-K11604106	BRD-K11604106-001-01-2	Broad Institute of MIT and Harvard	BRD-K11604106			COc1ccccc1CNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)Nc2ccc(F)cc2)O1	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21-,22-,24+/m1/s1	ADXBMBRYFBFALA-AZKZNFPZSA-N	501.227513974							97755
BRD-K11359987	LSM-9119		54657517	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17+,18-,19+/m1/s1	LOZCXWBJFMLABO-HCXYKTFWSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K11359987	BRD-K11359987-001-01-7	Broad Institute of MIT and Harvard	BRD-K11359987			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(CCC(F)(F)F)C1	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17+,18-,19+/m1/s1	LOZCXWBJFMLABO-HCXYKTFWSA-N	436.25489222							97740
BRD-K96625837	LSM-14358		54657765	InChI=1S/C29H37FN2O6S/c30-25-8-4-5-9-28(25)39(35,36)32-18-23(33)19-37-20-27-26(32)11-10-24(38-27)17-29(34)31-14-12-22(13-15-31)16-21-6-2-1-3-7-21/h1-9,22-24,26-27,33H,10-20H2/t23-,24+,26-,27+/m0/s1	SAJFZBDCMOWFNB-AEZNDSDVSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]2N(C1)S(=O)(=O)c5ccccc5F	BroadT	BRD-K96625837	BRD-K96625837-001-01-1	Broad Institute of MIT and Harvard	BRD-K96625837			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]2N(C1)S(=O)(=O)c1ccccc1F	InChI=1S/C29H37FN2O6S/c30-25-8-4-5-9-28(25)39(35,36)32-18-23(33)19-37-20-27-26(32)11-10-24(38-27)17-29(34)31-14-12-22(13-15-31)16-21-6-2-1-3-7-21/h1-9,22-24,26-27,33H,10-20H2/t23-,24+,26-,27+/m0/s1	SAJFZBDCMOWFNB-AEZNDSDVSA-N	560.235635814							103012
CHEMBL2359475	LSM-10048	SID131454140, BRD-K26676775	54657694	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30-,31+,32-/m0/s1	HJQSQTAMFLANGO-ZKKLFSJWSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCc4ccccc4C3)CC[C@H]2N(Cc5ccc(Oc6ccccc6)cc5)C1	BroadT	BRD-K26676775	BRD-K26676775-001-01-3	Broad Institute of MIT and Harvard	BRD-K26676775			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCc4ccccc4C3)CC[C@H]2N(Cc2ccc(Oc3ccccc3)cc2)C1	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30-,31+,32-/m0/s1	HJQSQTAMFLANGO-ZKKLFSJWSA-N	542.278072336							98669
BRD-K28883735	LSM-10183		54657587	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14-,15-,18+/m1/s1	YFRMSEXFMHDWES-ADAWSYLGSA-N	O[C@@H]1CN[C@@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COC1	BroadT	BRD-K28883735	BRD-K28883735-001-01-2	Broad Institute of MIT and Harvard	BRD-K28883735			O[C@@H]1CN[C@@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COC1	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14-,15-,18+/m1/s1	YFRMSEXFMHDWES-ADAWSYLGSA-N	378.179086572							98804
BRD-K49283955	LSM-11425		54657627	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24-,25-,26+/m1/s1	JKLIXGQQXOXZKK-POTDNYQPSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NC3Cc4ccccc4C3)CC[C@H]2N(C1)C(=O)Cc5ccccc5	BroadT	BRD-K49283955	BRD-K49283955-001-01-3	Broad Institute of MIT and Harvard	BRD-K49283955			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NC3Cc4ccccc4C3)CC[C@H]2N(C1)C(=O)Cc1ccccc1	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24-,25-,26+/m1/s1	JKLIXGQQXOXZKK-POTDNYQPSA-N	478.246772208							100046
BRD-K17750548	LSM-9497		54657523	InChI=1S/C15H26N2O6/c1-2-5-16-15(21)17-7-10(18)8-22-9-13-12(17)4-3-11(23-13)6-14(19)20/h10-13,18H,2-9H2,1H3,(H,16,21)(H,19,20)/t10-,11+,12-,13+/m0/s1	DUBDZBJJIAHCBK-QNWHQSFQSA-N	CCCNC(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)O)CC[C@H]12	BroadT	BRD-K17750548	BRD-K17750548-001-01-3	Broad Institute of MIT and Harvard	BRD-K17750548			CCCNC(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(O)=O)CC[C@H]12	InChI=1S/C15H26N2O6/c1-2-5-16-15(21)17-7-10(18)8-22-9-13-12(17)4-3-11(23-13)6-14(19)20/h10-13,18H,2-9H2,1H3,(H,16,21)(H,19,20)/t10-,11+,12-,13+/m0/s1	DUBDZBJJIAHCBK-QNWHQSFQSA-N	330.179086572							98118
BRD-K79260617	LSM-13273		54657532	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21+,23-,24+/m1/s1	LCHNJAZNAXXEPD-JSRBNTPPSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCN(CC3)c4ccccc4)CC[C@H]2N(C1)C(=O)c5cnccn5	BroadT	BRD-K79260617	BRD-K79260617-001-01-4	Broad Institute of MIT and Harvard	BRD-K79260617			O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21+,23-,24+/m1/s1	LCHNJAZNAXXEPD-JSRBNTPPSA-N	495.248169206							101912
BRD-K76369294	LSM-13100		54657566	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22+,23-,24+/m1/s1	JSQZMBUYZHIIMM-ONTLXTELSA-N	COc1ccc(CN2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)NCCN4CCCC4)CC[C@@H]23)cc1	BroadT	BRD-K76369294	BRD-K76369294-001-01-6	Broad Institute of MIT and Harvard	BRD-K76369294			COc1ccc(CN2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)NCCN4CCCC4)CC[C@@H]23)cc1	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22+,23-,24+/m1/s1	JSQZMBUYZHIIMM-ONTLXTELSA-N	461.288971378							101738
BRD-K52577250	LSM-11640		54657707	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13+,14-,15+/m0/s1	JDRFUATZRDBDCA-LJISPDSOSA-N	CN1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@H]12	BroadT	BRD-K52577250	BRD-K52577250-001-01-4	Broad Institute of MIT and Harvard	BRD-K52577250			CN1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@H]12	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13+,14-,15+/m0/s1	JDRFUATZRDBDCA-LJISPDSOSA-N	312.204907396							100265
BRD-K13883913	LSM-9268		54657500	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17+,18-,19+/m0/s1	HLMLEGKKEQKEEG-ZSYWTGECSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)Nc3nccs3)CC[C@@H]2N(Cc4cc(F)cc(F)c4)C1	BroadT	BRD-K13883913	BRD-K13883913-001-01-3	Broad Institute of MIT and Harvard	BRD-K13883913			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)Nc3nccs3)CC[C@@H]2N(Cc2cc(F)cc(F)c2)C1	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17+,18-,19+/m0/s1	HLMLEGKKEQKEEG-ZSYWTGECSA-N	453.1533834							97889
BRD-K23618054	LSM-9849		54657635	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17-,18-,19+/m0/s1	OUTWOBHUWTVFCP-CADBVGFASA-N	CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc3ccc(cc3)C(F)(F)F)O1	BroadT	BRD-K23618054	BRD-K23618054-001-01-0	Broad Institute of MIT and Harvard	BRD-K23618054			CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc2ccc(cc2)C(F)(F)F)O1	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17-,18-,19+/m0/s1	OUTWOBHUWTVFCP-CADBVGFASA-N	430.207942028							98470
BRD-K65988431	LSM-12455		54657561	InChI=1S/C22H31ClN2O6S/c23-16-5-4-6-19(11-16)32(28,29)25-13-17(26)14-30-15-21-20(25)8-7-18(31-21)12-22(27)24-9-2-1-3-10-24/h4-6,11,17-18,20-21,26H,1-3,7-10,12-15H2/t17-,18+,20-,21+/m0/s1	WUWHFUUUQPRUMO-IZZBFERCSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K65988431	BRD-K65988431-001-01-0	Broad Institute of MIT and Harvard	BRD-K65988431			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H31ClN2O6S/c23-16-5-4-6-19(11-16)32(28,29)25-13-17(26)14-30-15-21-20(25)8-7-18(31-21)12-22(27)24-9-2-1-3-10-24/h4-6,11,17-18,20-21,26H,1-3,7-10,12-15H2/t17-,18+,20-,21+/m0/s1	WUWHFUUUQPRUMO-IZZBFERCSA-N	486.159135132							101083
CHEMBL2143366	LSM-10607	BRD-K36130407, SID131454205	54657759	InChI=1S/C25H36ClN3O5/c26-18-6-8-19(9-7-18)28-25(32)29-14-20(30)15-33-16-23-22(29)11-10-21(34-23)12-24(31)27-13-17-4-2-1-3-5-17/h6-9,17,20-23,30H,1-5,10-16H2,(H,27,31)(H,28,32)/t20-,21+,22-,23+/m1/s1	SYCYKHHPUCXRJT-ACESQOTJSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)C(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K36130407	BRD-K36130407-001-01-5	Broad Institute of MIT and Harvard	BRD-K36130407			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)C(=O)Nc1ccc(Cl)cc1	InChI=1S/C25H36ClN3O5/c26-18-6-8-19(9-7-18)28-25(32)29-14-20(30)15-33-16-23-22(29)11-10-21(34-23)12-24(31)27-13-17-4-2-1-3-5-17/h6-9,17,20-23,30H,1-5,10-16H2,(H,27,31)(H,28,32)/t20-,21+,22-,23+/m1/s1	SYCYKHHPUCXRJT-ACESQOTJSA-N	493.234348992							99228
BRD-K79199685	LSM-13268		54657483	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9-,10+,11-/m0/s1	FKMAUGDURCCEJG-MMWGEVLESA-N	COC(=O)C[C@@H]1CC[C@H]2NC[C@H](O)COC[C@@H]2O1	BroadT	BRD-K79199685	BRD-K79199685-001-01-1	Broad Institute of MIT and Harvard	BRD-K79199685			COC(=O)C[C@@H]1CC[C@H]2NC[C@H](O)COC[C@@H]2O1	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9-,10+,11-/m0/s1	FKMAUGDURCCEJG-MMWGEVLESA-N	259.141972782							101907
BRD-K83132555	LSM-13510		54657783	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17-,18+,19-/m1/s1	GXFSXISHSMAVNQ-AKHDSKFASA-N	COCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c3cc(Cl)cc(Cl)c3)O1	BroadT	BRD-K83132555	BRD-K83132555-001-01-3	Broad Institute of MIT and Harvard	BRD-K83132555			COCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c2cc(Cl)cc(Cl)c2)O1	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17-,18+,19-/m1/s1	GXFSXISHSMAVNQ-AKHDSKFASA-N	474.132442056							102151
BRD-K82727027	LSM-13479		54657683	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17-,19-,20+/m0/s1	VRNJYJIECLSBHX-QGZVKYPTSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccccc3Cl)CC[C@@H]2N(Cc4nccs4)C1	BroadT	BRD-K82727027	BRD-K82727027-001-01-1	Broad Institute of MIT and Harvard	BRD-K82727027			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccccc3Cl)CC[C@@H]2N(Cc2nccs2)C1	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17-,19-,20+/m0/s1	VRNJYJIECLSBHX-QGZVKYPTSA-N	465.148904806							102119
BRD-K33776933	LSM-10476		54657648	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18+,19+,22-/m1/s1	QICYWJCDSALLPT-MDPIYQRISA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3C(=O)Nc4ccc5OCOc5c4)O2	BroadT	BRD-K33776933	BRD-K33776933-001-01-1	Broad Institute of MIT and Harvard	BRD-K33776933			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)Nc2ccc3OCOc3c2)O1	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18+,19+,22-/m1/s1	QICYWJCDSALLPT-MDPIYQRISA-N	490.242749468							99097
BRD-K24855340	LSM-9940		54657628	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24+,25-,26+/m1/s1	JKLIXGQQXOXZKK-ZJSPYRCASA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NC3Cc4ccccc4C3)CC[C@H]2N(C1)C(=O)Cc5ccccc5	BroadT	BRD-K24855340	BRD-K24855340-001-01-1	Broad Institute of MIT and Harvard	BRD-K24855340			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NC3Cc4ccccc4C3)CC[C@H]2N(C1)C(=O)Cc1ccccc1	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24+,25-,26+/m1/s1	JKLIXGQQXOXZKK-ZJSPYRCASA-N	478.246772208							98561
BRD-K22563530	LSM-9796		54657711	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13+,14+,15-/m1/s1	JDRFUATZRDBDCA-CBBWQLFWSA-N	CN1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)NC3CCC3)CC[C@H]12	BroadT	BRD-K22563530	BRD-K22563530-001-01-3	Broad Institute of MIT and Harvard	BRD-K22563530			CN1C[C@@H](O)COC[C@H]2O[C@H](CC(=O)NC3CCC3)CC[C@H]12	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13+,14+,15-/m1/s1	JDRFUATZRDBDCA-CBBWQLFWSA-N	312.204907396							98417
BRD-K85322309	LSM-13647		54657547	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22-,23-,24+/m1/s1	QYSMODXJNCJWNA-UZKJWJASSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K85322309	BRD-K85322309-001-01-7	Broad Institute of MIT and Harvard	BRD-K85322309			C[C@@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21+,22-,23-,24+/m1/s1	QYSMODXJNCJWNA-UZKJWJASSA-N	501.203048864							102294
BRD-K62473229	LSM-12224		54657715	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17+,22-,23+/m1/s1	NLZWENHPOORBAO-RZRCNZQPSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@H]2N(C1)C(=O)c4ccccc4F	BroadT	BRD-K62473229	BRD-K62473229-001-01-2	Broad Institute of MIT and Harvard	BRD-K62473229			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@H]2N(C1)C(=O)c1ccccc1F	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17+,22-,23+/m1/s1	NLZWENHPOORBAO-RZRCNZQPSA-N	524.128105604							100850
BRD-K36678339-001-01-6	LSM-29039	BRD-K36678339	54657495	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17+,18+,19-/m1/s1	HLMLEGKKEQKEEG-YDZRNGNQSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)Nc3nccs3)CC[C@@H]2N(Cc4cc(F)cc(F)c4)C1	BroadT	BRD-K36678339	BRD-K36678339-001-01-6	Broad Institute of MIT and Harvard	BRD-K36678339			O[C@H]1COC[C@H]2O[C@H](CC(=O)Nc3nccs3)CC[C@@H]2N(Cc2cc(F)cc(F)c2)C1	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17+,18+,19-/m1/s1	HLMLEGKKEQKEEG-YDZRNGNQSA-N	453.1533834							117590
BRD-K35060373	LSM-10536		54657665	InChI=1S/C23H27NO8S/c25-16-13-24(21-11-8-19(12-23(26)27)32-22(21)15-30-14-16)33(28,29)20-9-6-18(7-10-20)31-17-4-2-1-3-5-17/h1-7,9-10,16,19,21-22,25H,8,11-15H2,(H,26,27)/t16-,19+,21+,22-/m1/s1	WUYMKGAOXGWOLL-JJJJLYANSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)O)CC[C@@H]2N(C1)S(=O)(=O)c3ccc(Oc4ccccc4)cc3	BroadT	BRD-K35060373	BRD-K35060373-001-01-5	Broad Institute of MIT and Harvard	BRD-K35060373			O[C@H]1COC[C@H]2O[C@H](CC(O)=O)CC[C@@H]2N(C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1	InChI=1S/C23H27NO8S/c25-16-13-24(21-11-8-19(12-23(26)27)32-22(21)15-30-14-16)33(28,29)20-9-6-18(7-10-20)31-17-4-2-1-3-5-17/h1-7,9-10,16,19,21-22,25H,8,11-15H2,(H,26,27)/t16-,19+,21+,22-/m1/s1	WUYMKGAOXGWOLL-JJJJLYANSA-N	477.145737524							99157
BRD-K47551852	LSM-11325		54657605	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26-,27-,30+/m1/s1	OJBHRHOQEWVARJ-LCQQBMRFSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@H]2N(Cc5ccc6OCOc6c5)C1	BroadT	BRD-K47551852	BRD-K47551852-001-01-9	Broad Institute of MIT and Harvard	BRD-K47551852			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26-,27-,30+/m1/s1	OJBHRHOQEWVARJ-LCQQBMRFSA-N	530.241686828							99946
BRD-K68782403	LSM-12627		54657772	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17+,18+,19-/m0/s1	LJZGTTWSAOWWCB-MANSERQUSA-N	CCC(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@@H]12	BroadT	BRD-K68782403	BRD-K68782403-001-01-8	Broad Institute of MIT and Harvard	BRD-K68782403			CCC(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@@H]12	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17+,18+,19-/m0/s1	LJZGTTWSAOWWCB-MANSERQUSA-N	426.196628416							101260
BRD-K80686274	LSM-13362		54657589	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14-,15-,18+/m0/s1	YFRMSEXFMHDWES-YRBFXIGRSA-N	O[C@H]1CN[C@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COC1	BroadT	BRD-K80686274	BRD-K80686274-001-01-1	Broad Institute of MIT and Harvard	BRD-K80686274			O[C@H]1CN[C@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COC1	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14-,15-,18+/m0/s1	YFRMSEXFMHDWES-YRBFXIGRSA-N	378.179086572							102001
BRD-K83859302	LSM-13554		54657491	InChI=1S/C26H34N4O6/c1-16-25(17(2)36-28-16)27-26(33)30-13-20(31)14-34-15-23-22(30)8-7-21(35-23)11-24(32)29-10-9-18-5-3-4-6-19(18)12-29/h3-6,20-23,31H,7-15H2,1-2H3,(H,27,33)/t20-,21-,22-,23+/m0/s1	SVQJPVUULHSFBY-CWBXHPNXSA-N	Cc1onc(C)c1NC(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)N4CCc5ccccc5C4)CC[C@H]23	BroadT	BRD-K83859302	BRD-K83859302-001-01-7	Broad Institute of MIT and Harvard	BRD-K83859302			Cc1noc(C)c1NC(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)N3CCc4ccccc4C3)CC[C@H]12	InChI=1S/C26H34N4O6/c1-16-25(17(2)36-28-16)27-26(33)30-13-20(31)14-34-15-23-22(30)8-7-21(35-23)11-24(32)29-10-9-18-5-3-4-6-19(18)12-29/h3-6,20-23,31H,7-15H2,1-2H3,(H,27,33)/t20-,21-,22-,23+/m0/s1	SVQJPVUULHSFBY-CWBXHPNXSA-N	498.247834848							102196
BRD-K98945308	LSM-14501		54657652	InChI=1S/C22H27FN4O6S/c23-15-2-1-3-19(8-15)34(30,31)27-11-17(28)12-32-13-21-20(27)5-4-18(33-21)9-22(29)25-10-16-6-7-24-14-26-16/h1-3,6-8,14,17-18,20-21,28H,4-5,9-13H2,(H,25,29)/t17-,18-,20-,21+/m0/s1	FPMJOPUHYZGMQU-JYAXBFRTSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccncn3)CC[C@@H]2N(C1)S(=O)(=O)c4cccc(F)c4	BroadT	BRD-K98945308	BRD-K98945308-001-01-1	Broad Institute of MIT and Harvard	BRD-K98945308			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccncn3)CC[C@@H]2N(C1)S(=O)(=O)c1cccc(F)c1	InChI=1S/C22H27FN4O6S/c23-15-2-1-3-19(8-15)34(30,31)27-11-17(28)12-32-13-21-20(27)5-4-18(33-21)9-22(29)25-10-16-6-7-24-14-26-16/h1-3,6-8,14,17-18,20-21,28H,4-5,9-13H2,(H,25,29)/t17-,18-,20-,21+/m0/s1	FPMJOPUHYZGMQU-JYAXBFRTSA-N	494.163533514							103156
BRD-K32330804	LSM-10390		54657525	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21-,23-,24+/m0/s1	LCHNJAZNAXXEPD-HIGZBPRKSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCN(CC3)c4ccccc4)CC[C@@H]2N(C1)C(=O)c5cnccn5	BroadT	BRD-K32330804	BRD-K32330804-001-01-4	Broad Institute of MIT and Harvard	BRD-K32330804			O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21-,23-,24+/m0/s1	LCHNJAZNAXXEPD-HIGZBPRKSA-N	495.248169206							99011
BRD-K35158088	LSM-10542		54657581	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24-,25+,26-/m0/s1	VMOCTUISBGPURH-SSUZURRFSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@H]2N(Cc4cccc(c4)c5ccncc5)C1	BroadT	BRD-K35158088	BRD-K35158088-001-01-3	Broad Institute of MIT and Harvard	BRD-K35158088			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@H]2N(Cc2cccc(c2)-c2ccncc2)C1	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24-,25+,26-/m0/s1	VMOCTUISBGPURH-SSUZURRFSA-N	481.25767125							99163
BRD-K44756290	LSM-11150		54657704	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13-,14+,15-/m1/s1	JDRFUATZRDBDCA-APIJFGDWSA-N	CN1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@H]12	BroadT	BRD-K44756290	BRD-K44756290-001-01-7	Broad Institute of MIT and Harvard	BRD-K44756290			CN1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@H]12	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13-,14+,15-/m1/s1	JDRFUATZRDBDCA-APIJFGDWSA-N	312.204907396							99771
BRD-K41430135	LSM-10945		54657776	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17+,18-,19+/m0/s1	MNYFKSZVIZZWBR-ZSYWTGECSA-N	O[C@H]1CN[C@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COC1	BroadT	BRD-K41430135	BRD-K41430135-001-01-1	Broad Institute of MIT and Harvard	BRD-K41430135			O[C@H]1CN[C@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17+,18-,19+/m0/s1	MNYFKSZVIZZWBR-ZSYWTGECSA-N	360.204907396							99566
BRD-K61788733	LSM-12174		54657664	InChI=1S/C23H27NO8S/c25-16-13-24(21-11-8-19(12-23(26)27)32-22(21)15-30-14-16)33(28,29)20-9-6-18(7-10-20)31-17-4-2-1-3-5-17/h1-7,9-10,16,19,21-22,25H,8,11-15H2,(H,26,27)/t16-,19+,21+,22-/m0/s1	WUYMKGAOXGWOLL-MQYXYMALSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)O)CC[C@H]2N(C1)S(=O)(=O)c3ccc(Oc4ccccc4)cc3	BroadT	BRD-K61788733	BRD-K61788733-001-01-3	Broad Institute of MIT and Harvard	BRD-K61788733			O[C@@H]1COC[C@@H]2O[C@@H](CC(O)=O)CC[C@H]2N(C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1	InChI=1S/C23H27NO8S/c25-16-13-24(21-11-8-19(12-23(26)27)32-22(21)15-30-14-16)33(28,29)20-9-6-18(7-10-20)31-17-4-2-1-3-5-17/h1-7,9-10,16,19,21-22,25H,8,11-15H2,(H,26,27)/t16-,19+,21+,22-/m0/s1	WUYMKGAOXGWOLL-MQYXYMALSA-N	477.145737524							100800
BRD-K51363657	LSM-11572		54657737	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25+,26-,27+/m0/s1	WTHWQCPYZWPYSX-YYGZZXRFSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@@H]2N(C1)C(=O)c5cccnc5	BroadT	BRD-K51363657	BRD-K51363657-001-01-9	Broad Institute of MIT and Harvard	BRD-K51363657			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]2N(C1)C(=O)c1cccnc1	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25+,26-,27+/m0/s1	WTHWQCPYZWPYSX-YYGZZXRFSA-N	501.226371122							100195
BRD-K84240784	LSM-14956		54657489	InChI=1S/C22H39N3O5/c1-23-6-8-24(9-7-23)22(27)12-19-2-3-20-21(30-19)16-29-15-18(26)14-25(20)13-17-4-10-28-11-5-17/h17-21,26H,2-16H2,1H3/t18-,19-,20-,21+/m1/s1	MTMISLSQWFYTRE-NCYKPQTJSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3CC4CCOCC4)O2	BroadT	BRD-K84240784	BRD-K84240784-001-01-6	Broad Institute of MIT and Harvard	BRD-K84240784			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2CC2CCOCC2)O1	InChI=1S/C22H39N3O5/c1-23-6-8-24(9-7-23)22(27)12-19-2-3-20-21(30-19)16-29-15-18(26)14-25(20)13-17-4-10-28-11-5-17/h17-21,26H,2-16H2,1H3/t18-,19-,20-,21+/m1/s1	MTMISLSQWFYTRE-NCYKPQTJSA-N	425.288971378							103612
CHEMBL2359109	LSM-10316	BRD-K31224309, SID131454051	54657607	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26+,27-,30+/m1/s1	OJBHRHOQEWVARJ-BXAWWBQVSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@H]2N(Cc5ccc6OCOc6c5)C1	BroadT	BRD-K31224309	BRD-K31224309-001-01-0	Broad Institute of MIT and Harvard	BRD-K31224309			O[C@H]1COC[C@@H]2O[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26+,27-,30+/m1/s1	OJBHRHOQEWVARJ-BXAWWBQVSA-N	530.241686828							98937
BRD-K46587586	LSM-11273		54657710	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13+,14-,15+/m1/s1	JDRFUATZRDBDCA-BARDWOONSA-N	CN1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)NC3CCC3)CC[C@@H]12	BroadT	BRD-K46587586	BRD-K46587586-001-01-7	Broad Institute of MIT and Harvard	BRD-K46587586			CN1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)NC3CCC3)CC[C@@H]12	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13+,14-,15+/m1/s1	JDRFUATZRDBDCA-BARDWOONSA-N	312.204907396							99894
BRD-K70810261	LSM-12749		54657479	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9+,10-,11+/m1/s1	FKMAUGDURCCEJG-YTWAJWBKSA-N	COC(=O)C[C@@H]1CC[C@H]2NC[C@@H](O)COC[C@@H]2O1	BroadT	BRD-K70810261	BRD-K70810261-001-01-4	Broad Institute of MIT and Harvard	BRD-K70810261			COC(=O)C[C@@H]1CC[C@H]2NC[C@@H](O)COC[C@@H]2O1	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9+,10-,11+/m1/s1	FKMAUGDURCCEJG-YTWAJWBKSA-N	259.141972782							101386
BRD-K29286627	LSM-10202		54657527	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21-,23+,24-/m1/s1	LCHNJAZNAXXEPD-CJTFWIGWSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)N3CCN(CC3)c4ccccc4)CC[C@@H]2N(C1)C(=O)c5cnccn5	BroadT	BRD-K29286627	BRD-K29286627-001-01-8	Broad Institute of MIT and Harvard	BRD-K29286627			O[C@H]1COC[C@H]2O[C@@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21-,23+,24-/m1/s1	LCHNJAZNAXXEPD-CJTFWIGWSA-N	495.248169206							98823
BRD-K91487294	LSM-14048		54657640	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17-,18+,19-/m1/s1	OUTWOBHUWTVFCP-AKHDSKFASA-N	CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc3ccc(cc3)C(F)(F)F)O1	BroadT	BRD-K91487294	BRD-K91487294-001-01-7	Broad Institute of MIT and Harvard	BRD-K91487294			CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc2ccc(cc2)C(F)(F)F)O1	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17-,18+,19-/m1/s1	OUTWOBHUWTVFCP-AKHDSKFASA-N	430.207942028							102701
BRD-K74889356-001-01-0	LSM-29040	BRD-K74889356	54657475	InChI=1S/C19H28N2O6S/c1-28(24,25)21-11-15(22)12-26-13-18-17(21)8-7-16(27-18)9-19(23)20-10-14-5-3-2-4-6-14/h2-6,15-18,22H,7-13H2,1H3,(H,20,23)/t15-,16+,17-,18+/m1/s1	CRYMYAPOZVNFQJ-XDNAFOTISA-N	CS(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)NCc3ccccc3)CC[C@@H]12	BroadT	BRD-K74889356	BRD-K74889356-001-01-0	Broad Institute of MIT and Harvard	BRD-K74889356			CS(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)NCc3ccccc3)CC[C@@H]12	InChI=1S/C19H28N2O6S/c1-28(24,25)21-11-15(22)12-26-13-18-17(21)8-7-16(27-18)9-19(23)20-10-14-5-3-2-4-6-14/h2-6,15-18,22H,7-13H2,1H3,(H,20,23)/t15-,16+,17-,18+/m1/s1	CRYMYAPOZVNFQJ-XDNAFOTISA-N	412.166807326							117591
BRD-K18238232	LSM-9520		54657535	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22-,23-,24+/m1/s1	QYSMODXJNCJWNA-PNBSKESLSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K18238232	BRD-K18238232-001-01-9	Broad Institute of MIT and Harvard	BRD-K18238232			C[C@@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22-,23-,24+/m1/s1	QYSMODXJNCJWNA-PNBSKESLSA-N	501.203048864							98141
BRD-K24717178	LSM-9928		54657570	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22+,23+,24-/m0/s1	JSQZMBUYZHIIMM-RBVMOCNTSA-N	COc1ccc(CN2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)NCCN4CCCC4)CC[C@@H]23)cc1	BroadT	BRD-K24717178	BRD-K24717178-001-01-0	Broad Institute of MIT and Harvard	BRD-K24717178			COc1ccc(CN2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)NCCN4CCCC4)CC[C@@H]23)cc1	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22+,23+,24-/m0/s1	JSQZMBUYZHIIMM-RBVMOCNTSA-N	461.288971378							98549
BRD-K35558120	LSM-10562		54657615	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21-,23-,24+/m0/s1	VYCGBAYEGCCJIH-HIGZBPRKSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@@H]2N(Cc4cc(F)ccc4F)C1	BroadT	BRD-K35558120	BRD-K35558120-001-01-4	Broad Institute of MIT and Harvard	BRD-K35558120			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@@H]2N(Cc2cc(F)ccc2F)C1	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21-,23-,24+/m0/s1	VYCGBAYEGCCJIH-HIGZBPRKSA-N	494.178391538							99183
BRD-K38672372	LSM-10773		54657661	InChI=1S/C23H27NO8S/c25-16-13-24(21-11-8-19(12-23(26)27)32-22(21)15-30-14-16)33(28,29)20-9-6-18(7-10-20)31-17-4-2-1-3-5-17/h1-7,9-10,16,19,21-22,25H,8,11-15H2,(H,26,27)/t16-,19-,21-,22+/m1/s1	WUYMKGAOXGWOLL-OJWCNPDFSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)O)CC[C@H]2N(C1)S(=O)(=O)c3ccc(Oc4ccccc4)cc3	BroadT	BRD-K38672372	BRD-K38672372-001-01-5	Broad Institute of MIT and Harvard	BRD-K38672372			O[C@H]1COC[C@@H]2O[C@@H](CC(O)=O)CC[C@H]2N(C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1	InChI=1S/C23H27NO8S/c25-16-13-24(21-11-8-19(12-23(26)27)32-22(21)15-30-14-16)33(28,29)20-9-6-18(7-10-20)31-17-4-2-1-3-5-17/h1-7,9-10,16,19,21-22,25H,8,11-15H2,(H,26,27)/t16-,19-,21-,22+/m1/s1	WUYMKGAOXGWOLL-OJWCNPDFSA-N	477.145737524							99394
BRD-K07569193	LSM-8880		54657729	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22-,23-,24+/m1/s1	QCHQNBIYSRQADD-YCAMKHIRSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCCc3ccncc3)CC[C@H]2N(Cc4cccc(c4)C(F)(F)F)C1	BroadT	BRD-K07569193	BRD-K07569193-001-01-7	Broad Institute of MIT and Harvard	BRD-K07569193			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCCc3ccncc3)CC[C@H]2N(Cc2cccc(c2)C(F)(F)F)C1	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22-,23-,24+/m1/s1	QCHQNBIYSRQADD-YCAMKHIRSA-N	507.234491134							97501
BRD-K34706062-001-01-0	LSM-29041	BRD-K34706062	54657496	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17+,18-,19+/m1/s1	HLMLEGKKEQKEEG-HCXYKTFWSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)Nc3nccs3)CC[C@H]2N(Cc4cc(F)cc(F)c4)C1	BroadT	BRD-K34706062	BRD-K34706062-001-01-0	Broad Institute of MIT and Harvard	BRD-K34706062			O[C@H]1COC[C@@H]2O[C@H](CC(=O)Nc3nccs3)CC[C@H]2N(Cc2cc(F)cc(F)c2)C1	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17+,18-,19+/m1/s1	HLMLEGKKEQKEEG-HCXYKTFWSA-N	453.1533834							117592
BRD-K28460793	LSM-10151		54657677	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20-,21-,22+/m1/s1	UTTUQCGEIXLGEI-YSFYHYPLSA-N	O[C@@H]1CN[C@@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2COC1	BroadT	BRD-K28460793	BRD-K28460793-001-01-8	Broad Institute of MIT and Harvard	BRD-K28460793			O[C@@H]1CN[C@@H]2CC[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@H]2COC1	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20-,21-,22+/m1/s1	UTTUQCGEIXLGEI-YSFYHYPLSA-N	396.204907396							98772
BRD-K14206468	LSM-9283		54657502	InChI=1S/C24H32N2O7/c27-17-11-26(24(29)15-5-8-20-21(9-15)32-14-31-20)19-7-6-18(33-22(19)13-30-12-17)10-23(28)25-16-3-1-2-4-16/h5,8-9,16-19,22,27H,1-4,6-7,10-14H2,(H,25,28)/t17-,18+,19-,22+/m0/s1	JZHWTQAESVMWQB-LMVRJCEZSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NC3CCCC3)CC[C@@H]2N(C1)C(=O)c4ccc5OCOc5c4	BroadT	BRD-K14206468	BRD-K14206468-001-01-5	Broad Institute of MIT and Harvard	BRD-K14206468			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NC3CCCC3)CC[C@@H]2N(C1)C(=O)c1ccc2OCOc2c1	InChI=1S/C24H32N2O7/c27-17-11-26(24(29)15-5-8-20-21(9-15)32-14-31-20)19-7-6-18(33-22(19)13-30-12-17)10-23(28)25-16-3-1-2-4-16/h5,8-9,16-19,22,27H,1-4,6-7,10-14H2,(H,25,28)/t17-,18+,19-,22+/m0/s1	JZHWTQAESVMWQB-LMVRJCEZSA-N	460.220951384							97904
BRD-K20433775	LSM-9675		54657676	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20+,21-,22+/m0/s1	UTTUQCGEIXLGEI-LNRXMEIDSA-N	O[C@H]1CN[C@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2COC1	BroadT	BRD-K20433775	BRD-K20433775-001-01-5	Broad Institute of MIT and Harvard	BRD-K20433775			O[C@H]1CN[C@H]2CC[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@@H]2COC1	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20+,21-,22+/m0/s1	UTTUQCGEIXLGEI-LNRXMEIDSA-N	396.204907396							98296
BRD-K90987254	LSM-14031		54657641	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18+,19-,22+/m1/s1	QICYWJCDSALLPT-MOXWOTFGSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3C(=O)Nc4ccc5OCOc5c4)O2	BroadT	BRD-K90987254	BRD-K90987254-001-01-5	Broad Institute of MIT and Harvard	BRD-K90987254			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)Nc2ccc3OCOc3c2)O1	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18+,19-,22+/m1/s1	QICYWJCDSALLPT-MOXWOTFGSA-N	490.242749468							102684
BRD-K88821227	LSM-13887		54657510	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20+,21+,22-/m1/s1	TWGHTEGHSVIJBR-CLAROIROSA-N	Cn1cnc(CCNC(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3C(=O)Nc4ccc(cc4)C(F)(F)F)O2)c1	BroadT	BRD-K88821227	BRD-K88821227-001-01-4	Broad Institute of MIT and Harvard	BRD-K88821227			Cn1cnc(CCNC(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3C(=O)Nc3ccc(cc3)C(F)(F)F)O2)c1	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20+,21+,22-/m1/s1	TWGHTEGHSVIJBR-CLAROIROSA-N	539.235553774							102540
BRD-K50868745	LSM-11532		54657574	InChI=1S/C25H37N3O6/c29-20-16-28(25(31)19-5-2-1-3-6-19)22-8-7-21(34-23(22)18-33-17-20)15-24(30)26-9-4-10-27-11-13-32-14-12-27/h1-3,5-6,20-23,29H,4,7-18H2,(H,26,30)/t20-,21+,22-,23+/m0/s1	AMMWEOQELITDAS-GSPCLOLRSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCCCN3CCOCC3)CC[C@@H]2N(C1)C(=O)c4ccccc4	BroadT	BRD-K50868745	BRD-K50868745-001-01-2	Broad Institute of MIT and Harvard	BRD-K50868745			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCCCN3CCOCC3)CC[C@@H]2N(C1)C(=O)c1ccccc1	InChI=1S/C25H37N3O6/c29-20-16-28(25(31)19-5-2-1-3-6-19)22-8-7-21(34-23(22)18-33-17-20)15-24(30)26-9-4-10-27-11-13-32-14-12-27/h1-3,5-6,20-23,29H,4,7-18H2,(H,26,30)/t20-,21+,22-,23+/m0/s1	AMMWEOQELITDAS-GSPCLOLRSA-N	475.268235934							100155
BRD-K89885223	LSM-13970		54657618	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15+,16+,17-/m1/s1	XUIBJKJBLJUMMA-LTIDMASMSA-N	CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)C3CCCC3)O1	BroadT	BRD-K89885223	BRD-K89885223-001-01-2	Broad Institute of MIT and Harvard	BRD-K89885223			CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)C2CCCC2)O1	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15+,16+,17-/m1/s1	XUIBJKJBLJUMMA-LTIDMASMSA-N	368.231122144							102623
BRD-K64873832	LSM-12391		54657565	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22-,23+,24-/m0/s1	JSQZMBUYZHIIMM-XGAJZPNHSA-N	COc1ccc(CN2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)NCCN4CCCC4)CC[C@@H]23)cc1	BroadT	BRD-K64873832	BRD-K64873832-001-01-0	Broad Institute of MIT and Harvard	BRD-K64873832			COc1ccc(CN2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)NCCN4CCCC4)CC[C@@H]23)cc1	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22-,23+,24-/m0/s1	JSQZMBUYZHIIMM-XGAJZPNHSA-N	461.288971378							101018
BRD-K75368232	LSM-13037		54657751	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14-,17-,18+/m1/s1	ZCDZHCWZNJFIKB-DTDBQYNISA-N	CNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc3ccc(Cl)c(Cl)c3)O1	BroadT	BRD-K75368232	BRD-K75368232-001-01-4	Broad Institute of MIT and Harvard	BRD-K75368232			CNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc2ccc(Cl)c(Cl)c2)O1	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14-,17-,18+/m1/s1	ZCDZHCWZNJFIKB-DTDBQYNISA-N	416.126962752							101674
BRD-K99902401	LSM-14567		54657650	InChI=1S/C22H27FN4O6S/c23-15-2-1-3-19(8-15)34(30,31)27-11-17(28)12-32-13-21-20(27)5-4-18(33-21)9-22(29)25-10-16-6-7-24-14-26-16/h1-3,6-8,14,17-18,20-21,28H,4-5,9-13H2,(H,25,29)/t17-,18+,20-,21+/m0/s1	FPMJOPUHYZGMQU-IZZBFERCSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccncn3)CC[C@@H]2N(C1)S(=O)(=O)c4cccc(F)c4	BroadT	BRD-K99902401	BRD-K99902401-001-01-7	Broad Institute of MIT and Harvard	BRD-K99902401			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccncn3)CC[C@@H]2N(C1)S(=O)(=O)c1cccc(F)c1	InChI=1S/C22H27FN4O6S/c23-15-2-1-3-19(8-15)34(30,31)27-11-17(28)12-32-13-21-20(27)5-4-18(33-21)9-22(29)25-10-16-6-7-24-14-26-16/h1-3,6-8,14,17-18,20-21,28H,4-5,9-13H2,(H,25,29)/t17-,18+,20-,21+/m0/s1	FPMJOPUHYZGMQU-IZZBFERCSA-N	494.163533514							103223
BRD-K30684242	LSM-10273		54657646	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18+,19+,22-/m0/s1	QICYWJCDSALLPT-JYLXEMOASA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3C(=O)Nc4ccc5OCOc5c4)O2	BroadT	BRD-K30684242	BRD-K30684242-001-01-6	Broad Institute of MIT and Harvard	BRD-K30684242			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)Nc2ccc3OCOc3c2)O1	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18+,19+,22-/m0/s1	QICYWJCDSALLPT-JYLXEMOASA-N	490.242749468							98894
BRD-K42677417	LSM-11018		54657747	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26+,28-,29+/m1/s1	LOPBZILAZMWERO-GEEWNISJSA-N	Cc1cccc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)Nc4ccc(cc4)c5ccccc5)CC[C@@H]23	BroadT	BRD-K42677417	BRD-K42677417-001-01-5	Broad Institute of MIT and Harvard	BRD-K42677417			Cc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]12	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26+,28-,29+/m1/s1	LOPBZILAZMWERO-GEEWNISJSA-N	550.213757518							99639
BRD-K64418359	LSM-12360		54657555	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12-,13+,14-/m1/s1	HDTRYUIMSWCRLO-YIYPIFLZSA-N	COC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2S(=O)(=O)c3cn(C)cn3)O1	BroadT	BRD-K64418359	BRD-K64418359-001-01-7	Broad Institute of MIT and Harvard	BRD-K64418359			COC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2S(=O)(=O)c2cn(C)cn2)O1	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12-,13+,14-/m1/s1	HDTRYUIMSWCRLO-YIYPIFLZSA-N	403.14132086							100987
BRD-K13757679	LSM-9260		54657629	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24-,25+,26-/m0/s1	JKLIXGQQXOXZKK-SSUZURRFSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NC3Cc4ccccc4C3)CC[C@H]2N(C1)C(=O)Cc5ccccc5	BroadT	BRD-K13757679	BRD-K13757679-001-01-3	Broad Institute of MIT and Harvard	BRD-K13757679			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NC3Cc4ccccc4C3)CC[C@H]2N(C1)C(=O)Cc1ccccc1	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24-,25+,26-/m0/s1	JKLIXGQQXOXZKK-SSUZURRFSA-N	478.246772208							97881
BRD-K54179080	LSM-11724		54657591	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14+,15+,18-/m1/s1	YFRMSEXFMHDWES-LDDOYCOJSA-N	O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COC1	BroadT	BRD-K54179080	BRD-K54179080-001-01-3	Broad Institute of MIT and Harvard	BRD-K54179080			O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COC1	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14+,15+,18-/m1/s1	YFRMSEXFMHDWES-LDDOYCOJSA-N	378.179086572							100349
BRD-K07269289	LSM-8856		54657595	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25+,27-,29+/m0/s1	PLPDORRRKBPITR-IKQRCTNISA-N	COc1ccccc1NC(=O)N2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)N4CCC(Cc5ccccc5)CC4)CC[C@H]23	BroadT	BRD-K07269289	BRD-K07269289-001-01-9	Broad Institute of MIT and Harvard	BRD-K07269289			COc1ccccc1NC(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]12	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25+,27-,29+/m0/s1	PLPDORRRKBPITR-IKQRCTNISA-N	551.299536062							97477
BRD-K43031910	LSM-11044		54657709	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13-,14+,15-/m0/s1	JDRFUATZRDBDCA-XQLPTFJDSA-N	CN1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)NC3CCC3)CC[C@@H]12	BroadT	BRD-K43031910	BRD-K43031910-001-01-6	Broad Institute of MIT and Harvard	BRD-K43031910			CN1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)NC3CCC3)CC[C@@H]12	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13-,14+,15-/m0/s1	JDRFUATZRDBDCA-XQLPTFJDSA-N	312.204907396							99665
BRD-K02460212	LSM-8587		54657686	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17+,19-,20+/m0/s1	VRNJYJIECLSBHX-KVPLUYHFSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@@H]2N(Cc4nccs4)C1	BroadT	BRD-K02460212	BRD-K02460212-001-01-1	Broad Institute of MIT and Harvard	BRD-K02460212			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@@H]2N(Cc2nccs2)C1	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17+,19-,20+/m0/s1	VRNJYJIECLSBHX-KVPLUYHFSA-N	465.148904806							97208
CHEMBL3186769	LSM-11083	BRD-K43570134	54657603	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26+,27+,30-/m1/s1	OJBHRHOQEWVARJ-HOSLJWMQSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@@H]2N(Cc5ccc6OCOc6c5)C1	BroadT	BRD-K43570134	BRD-K43570134-001-01-3	Broad Institute of MIT and Harvard	BRD-K43570134			O[C@H]1COC[C@H]2O[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]2N(Cc2ccc3OCOc3c2)C1	InChI=1S/C31H34N2O6/c34-25-17-33(16-21-6-13-28-29(14-21)38-20-37-28)27-12-11-26(39-30(27)19-36-18-25)15-31(35)32-24-9-7-23(8-10-24)22-4-2-1-3-5-22/h1-10,13-14,25-27,30,34H,11-12,15-20H2,(H,32,35)/t25-,26+,27+,30-/m1/s1	OJBHRHOQEWVARJ-HOSLJWMQSA-N	530.241686828							99704
BRD-K80223377	LSM-13330		54657530	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21-,23+,24-/m0/s1	LCHNJAZNAXXEPD-ZQRMPTRQSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCN(CC3)c4ccccc4)CC[C@H]2N(C1)C(=O)c5cnccn5	BroadT	BRD-K80223377	BRD-K80223377-001-01-9	Broad Institute of MIT and Harvard	BRD-K80223377			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21-,23+,24-/m0/s1	LCHNJAZNAXXEPD-ZQRMPTRQSA-N	495.248169206							101969
BRD-K53407305	LSM-11686		54657769	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17-,18-,19+/m0/s1	LJZGTTWSAOWWCB-CADBVGFASA-N	CCC(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@H]12	BroadT	BRD-K53407305	BRD-K53407305-001-01-8	Broad Institute of MIT and Harvard	BRD-K53407305			CCC(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@H]12	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17-,18-,19+/m0/s1	LJZGTTWSAOWWCB-CADBVGFASA-N	426.196628416							100311
BRD-K64136010	LSM-12345		54657621	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15+,16-,17+/m0/s1	XUIBJKJBLJUMMA-VVLHAWIVSA-N	CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)C3CCCC3)O1	BroadT	BRD-K64136010	BRD-K64136010-001-01-6	Broad Institute of MIT and Harvard	BRD-K64136010			CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)C2CCCC2)O1	InChI=1S/C19H32N2O5/c1-20(2)18(23)9-15-7-8-16-17(26-15)12-25-11-14(22)10-21(16)19(24)13-5-3-4-6-13/h13-17,22H,3-12H2,1-2H3/t14-,15+,16-,17+/m0/s1	XUIBJKJBLJUMMA-VVLHAWIVSA-N	368.231122144							100972
BRD-K08616215	LSM-8949		54657504	InChI=1S/C24H32N2O7/c27-17-11-26(24(29)15-5-8-20-21(9-15)32-14-31-20)19-7-6-18(33-22(19)13-30-12-17)10-23(28)25-16-3-1-2-4-16/h5,8-9,16-19,22,27H,1-4,6-7,10-14H2,(H,25,28)/t17-,18-,19-,22+/m1/s1	JZHWTQAESVMWQB-YXTQBTIXSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NC3CCCC3)CC[C@H]2N(C1)C(=O)c4ccc5OCOc5c4	BroadT	BRD-K08616215	BRD-K08616215-001-01-9	Broad Institute of MIT and Harvard	BRD-K08616215			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NC3CCCC3)CC[C@H]2N(C1)C(=O)c1ccc2OCOc2c1	InChI=1S/C24H32N2O7/c27-17-11-26(24(29)15-5-8-20-21(9-15)32-14-31-20)19-7-6-18(33-22(19)13-30-12-17)10-23(28)25-16-3-1-2-4-16/h5,8-9,16-19,22,27H,1-4,6-7,10-14H2,(H,25,28)/t17-,18-,19-,22+/m1/s1	JZHWTQAESVMWQB-YXTQBTIXSA-N	460.220951384							97570
BRD-K22787051	LSM-9813		54657516	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17-,18-,19+/m1/s1	LOZCXWBJFMLABO-MKXGPGLRSA-N	O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K22787051	BRD-K22787051-001-01-7	Broad Institute of MIT and Harvard	BRD-K22787051			O[C@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(CCC(F)(F)F)C1	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17-,18-,19+/m1/s1	LOZCXWBJFMLABO-MKXGPGLRSA-N	436.25489222							98434
BRD-K04574057	LSM-8706		54657509	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20-,21-,22+/m0/s1	TWGHTEGHSVIJBR-MYGLTJDJSA-N	Cn1cnc(CCNC(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3C(=O)Nc4ccc(cc4)C(F)(F)F)O2)c1	BroadT	BRD-K04574057	BRD-K04574057-001-01-5	Broad Institute of MIT and Harvard	BRD-K04574057			Cn1cnc(CCNC(=O)C[C@@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3C(=O)Nc3ccc(cc3)C(F)(F)F)O2)c1	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20-,21-,22+/m0/s1	TWGHTEGHSVIJBR-MYGLTJDJSA-N	539.235553774							97327
BRD-K99103407	LSM-14513		54657579	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24-,25-,26+/m0/s1	VMOCTUISBGPURH-ASDGIDEWSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@@H]2N(Cc4cccc(c4)c5ccncc5)C1	BroadT	BRD-K99103407	BRD-K99103407-001-01-6	Broad Institute of MIT and Harvard	BRD-K99103407			O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@@H]2N(Cc2cccc(c2)-c2ccncc2)C1	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24-,25-,26+/m0/s1	VMOCTUISBGPURH-ASDGIDEWSA-N	481.25767125							103168
BRD-K58560613	LSM-11963		54657750	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26-,28+,29-/m1/s1	LOPBZILAZMWERO-PPTZAKONSA-N	Cc1cccc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)Nc4ccc(cc4)c5ccccc5)CC[C@H]23	BroadT	BRD-K58560613	BRD-K58560613-001-01-6	Broad Institute of MIT and Harvard	BRD-K58560613			Cc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@H]12	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26-,28+,29-/m1/s1	LOPBZILAZMWERO-PPTZAKONSA-N	550.213757518							100589
BRD-K89010697	LSM-13905		54657514	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17-,18-,19+/m0/s1	LOZCXWBJFMLABO-CADBVGFASA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K89010697	BRD-K89010697-001-01-4	Broad Institute of MIT and Harvard	BRD-K89010697			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(CCC(F)(F)F)C1	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17-,18-,19+/m0/s1	LOZCXWBJFMLABO-CADBVGFASA-N	436.25489222							102558
BRD-K90163207	LSM-13991		54657755	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14+,17+,18-/m1/s1	ZCDZHCWZNJFIKB-IDCJVQTKSA-N	CNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc3ccc(Cl)c(Cl)c3)O1	BroadT	BRD-K90163207	BRD-K90163207-001-01-1	Broad Institute of MIT and Harvard	BRD-K90163207			CNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc2ccc(Cl)c(Cl)c2)O1	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14+,17+,18-/m1/s1	ZCDZHCWZNJFIKB-IDCJVQTKSA-N	416.126962752							102644
BRD-K60636255	LSM-12092		54657781	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17-,18+,19-/m0/s1	MNYFKSZVIZZWBR-OKYOBFRVSA-N	O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COC1	BroadT	BRD-K60636255	BRD-K60636255-001-01-3	Broad Institute of MIT and Harvard	BRD-K60636255			O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17-,18+,19-/m0/s1	MNYFKSZVIZZWBR-OKYOBFRVSA-N	360.204907396							100718
BRD-K06083657	LSM-8780		54657785	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17-,18-,19+/m0/s1	GXFSXISHSMAVNQ-CADBVGFASA-N	COCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c3cc(Cl)cc(Cl)c3)O1	BroadT	BRD-K06083657	BRD-K06083657-001-01-9	Broad Institute of MIT and Harvard	BRD-K06083657			COCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c2cc(Cl)cc(Cl)c2)O1	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17-,18-,19+/m0/s1	GXFSXISHSMAVNQ-CADBVGFASA-N	474.132442056							97401
BRD-K56206243	LSM-11826		54657478	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9+,10+,11-/m1/s1	FKMAUGDURCCEJG-VPOLOUISSA-N	COC(=O)C[C@@H]1CC[C@@H]2NC[C@@H](O)COC[C@H]2O1	BroadT	BRD-K56206243	BRD-K56206243-001-01-6	Broad Institute of MIT and Harvard	BRD-K56206243			COC(=O)C[C@@H]1CC[C@@H]2NC[C@@H](O)COC[C@H]2O1	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9+,10+,11-/m1/s1	FKMAUGDURCCEJG-VPOLOUISSA-N	259.141972782							100451
BRD-K78487432	LSM-13228		54657763	InChI=1S/C25H36ClN3O5/c26-18-6-8-19(9-7-18)28-25(32)29-14-20(30)15-33-16-23-22(29)11-10-21(34-23)12-24(31)27-13-17-4-2-1-3-5-17/h6-9,17,20-23,30H,1-5,10-16H2,(H,27,31)(H,28,32)/t20-,21+,22-,23+/m0/s1	SYCYKHHPUCXRJT-GSPCLOLRSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)C(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K78487432	BRD-K78487432-001-01-7	Broad Institute of MIT and Harvard	BRD-K78487432			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)C(=O)Nc1ccc(Cl)cc1	InChI=1S/C25H36ClN3O5/c26-18-6-8-19(9-7-18)28-25(32)29-14-20(30)15-33-16-23-22(29)11-10-21(34-23)12-24(31)27-13-17-4-2-1-3-5-17/h6-9,17,20-23,30H,1-5,10-16H2,(H,27,31)(H,28,32)/t20-,21+,22-,23+/m0/s1	SYCYKHHPUCXRJT-GSPCLOLRSA-N	493.234348992							101867
BRD-K91771673	LSM-14068		54657539	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22-,23+,24-/m1/s1	QYSMODXJNCJWNA-PBBBXTDZSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K91771673	BRD-K91771673-001-01-5	Broad Institute of MIT and Harvard	BRD-K91771673			C[C@@H](NC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22-,23+,24-/m1/s1	QYSMODXJNCJWNA-PBBBXTDZSA-N	501.203048864							102722
BRD-K77909743	LSM-13194		54657680	InChI=1S/C22H34ClN3O6S/c1-25(2)11-3-10-24-22(28)12-18-6-9-20-21(32-18)15-31-14-17(27)13-26(20)33(29,30)19-7-4-16(23)5-8-19/h4-5,7-8,17-18,20-21,27H,3,6,9-15H2,1-2H3,(H,24,28)/t17-,18+,20-,21+/m1/s1	NJKGITFUOGWCFU-JYRKZWEQSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c3ccc(Cl)cc3)O1	BroadT	BRD-K77909743	BRD-K77909743-001-01-5	Broad Institute of MIT and Harvard	BRD-K77909743			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)O1	InChI=1S/C22H34ClN3O6S/c1-25(2)11-3-10-24-22(28)12-18-6-9-20-21(32-18)15-31-14-17(27)13-26(20)33(29,30)19-7-4-16(23)5-8-19/h4-5,7-8,17-18,20-21,27H,3,6,9-15H2,1-2H3,(H,24,28)/t17-,18+,20-,21+/m1/s1	NJKGITFUOGWCFU-JYRKZWEQSA-N	503.185684238							101832
BRD-K77287734	LSM-13154		54657551	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12+,13+,14-/m0/s1	HDTRYUIMSWCRLO-DGAVXFQQSA-N	COC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2S(=O)(=O)c3cn(C)cn3)O1	BroadT	BRD-K77287734	BRD-K77287734-001-01-7	Broad Institute of MIT and Harvard	BRD-K77287734			COC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2S(=O)(=O)c2cn(C)cn2)O1	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12+,13+,14-/m0/s1	HDTRYUIMSWCRLO-DGAVXFQQSA-N	403.14132086							101792
BRD-K45375659	LSM-11193		54657586	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14+,15+,18-/m0/s1	YFRMSEXFMHDWES-BORJPKMPSA-N	O[C@H]1CN[C@@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COC1	BroadT	BRD-K45375659	BRD-K45375659-001-01-0	Broad Institute of MIT and Harvard	BRD-K45375659			O[C@H]1CN[C@@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COC1	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14+,15+,18-/m0/s1	YFRMSEXFMHDWES-BORJPKMPSA-N	378.179086572							99814
BRD-K03262953	LSM-8638		54657637	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17+,18+,19-/m1/s1	OUTWOBHUWTVFCP-YDZRNGNQSA-N	CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc3ccc(cc3)C(F)(F)F)O1	BroadT	BRD-K03262953	BRD-K03262953-001-01-3	Broad Institute of MIT and Harvard	BRD-K03262953			CN(C)C(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc2ccc(cc2)C(F)(F)F)O1	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17+,18+,19-/m1/s1	OUTWOBHUWTVFCP-YDZRNGNQSA-N	430.207942028							97259
BRD-K09203309	LSM-8985		54657764	InChI=1S/C25H36ClN3O5/c26-18-6-8-19(9-7-18)28-25(32)29-14-20(30)15-33-16-23-22(29)11-10-21(34-23)12-24(31)27-13-17-4-2-1-3-5-17/h6-9,17,20-23,30H,1-5,10-16H2,(H,27,31)(H,28,32)/t20-,21-,22+,23-/m0/s1	SYCYKHHPUCXRJT-GPJHCHHRSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)C(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K09203309	BRD-K09203309-001-01-2	Broad Institute of MIT and Harvard	BRD-K09203309			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)C(=O)Nc1ccc(Cl)cc1	InChI=1S/C25H36ClN3O5/c26-18-6-8-19(9-7-18)28-25(32)29-14-20(30)15-33-16-23-22(29)11-10-21(34-23)12-24(31)27-13-17-4-2-1-3-5-17/h6-9,17,20-23,30H,1-5,10-16H2,(H,27,31)(H,28,32)/t20-,21-,22+,23-/m0/s1	SYCYKHHPUCXRJT-GPJHCHHRSA-N	493.234348992							97606
BRD-K50366616	LSM-11496		54657722	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15-,16+,17-/m0/s1	WSFSIZCPNKDEIH-NXOAAHMSSA-N	O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2COC1	BroadT	BRD-K50366616	BRD-K50366616-001-01-3	Broad Institute of MIT and Harvard	BRD-K50366616			O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2COC1	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15-,16+,17-/m0/s1	WSFSIZCPNKDEIH-NXOAAHMSSA-N	355.247106566							100117
BRD-K06619089	LSM-8815		54657526	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21+,23+,24-/m0/s1	LCHNJAZNAXXEPD-SCDRESIJSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCN(CC3)c4ccccc4)CC[C@H]2N(C1)C(=O)c5cnccn5	BroadT	BRD-K06619089	BRD-K06619089-001-01-8	Broad Institute of MIT and Harvard	BRD-K06619089			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21+,23+,24-/m0/s1	LCHNJAZNAXXEPD-SCDRESIJSA-N	495.248169206							97436
BRD-K44699604	LSM-11146		54657782	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17-,18+,19-/m1/s1	MNYFKSZVIZZWBR-AKHDSKFASA-N	O[C@@H]1CN[C@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COC1	BroadT	BRD-K44699604	BRD-K44699604-001-01-0	Broad Institute of MIT and Harvard	BRD-K44699604			O[C@@H]1CN[C@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17-,18+,19-/m1/s1	MNYFKSZVIZZWBR-AKHDSKFASA-N	360.204907396							99767
BRD-K86780816	LSM-13747		54657777	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17+,18+,19-/m1/s1	MNYFKSZVIZZWBR-YDZRNGNQSA-N	O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COC1	BroadT	BRD-K86780816	BRD-K86780816-001-01-1	Broad Institute of MIT and Harvard	BRD-K86780816			O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17+,18+,19-/m1/s1	MNYFKSZVIZZWBR-YDZRNGNQSA-N	360.204907396							102396
BRD-K74341727	LSM-12980		54657655	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21-,22+,24-/m0/s1	ADXBMBRYFBFALA-YCSHWKNNSA-N	COc1ccccc1CNC(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3C(=O)Nc4ccc(F)cc4)O2	BroadT	BRD-K74341727	BRD-K74341727-001-01-4	Broad Institute of MIT and Harvard	BRD-K74341727			COc1ccccc1CNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)Nc2ccc(F)cc2)O1	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21-,22+,24-/m0/s1	ADXBMBRYFBFALA-YCSHWKNNSA-N	501.227513974							101617
BRD-K14758616	LSM-9320		54657684	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17+,19-,20+/m1/s1	VRNJYJIECLSBHX-BWPNAZKDSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccccc3Cl)CC[C@H]2N(Cc4nccs4)C1	BroadT	BRD-K14758616	BRD-K14758616-001-01-6	Broad Institute of MIT and Harvard	BRD-K14758616			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccccc3Cl)CC[C@H]2N(Cc2nccs2)C1	InChI=1S/C22H28ClN3O4S/c23-18-4-2-1-3-15(18)10-25-21(28)9-17-5-6-19-20(30-17)14-29-13-16(27)11-26(19)12-22-24-7-8-31-22/h1-4,7-8,16-17,19-20,27H,5-6,9-14H2,(H,25,28)/t16-,17+,19-,20+/m1/s1	VRNJYJIECLSBHX-BWPNAZKDSA-N	465.148904806							97941
BRD-K35510956	LSM-10559		54657647	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18-,19+,22-/m1/s1	QICYWJCDSALLPT-NXWNEQKCSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@H](O)CN3C(=O)Nc4ccc5OCOc5c4)O2	BroadT	BRD-K35510956	BRD-K35510956-001-01-4	Broad Institute of MIT and Harvard	BRD-K35510956			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)Nc2ccc3OCOc3c2)O1	InChI=1S/C24H34N4O7/c1-26-6-8-27(9-7-26)23(30)11-18-3-4-19-22(35-18)14-32-13-17(29)12-28(19)24(31)25-16-2-5-20-21(10-16)34-15-33-20/h2,5,10,17-19,22,29H,3-4,6-9,11-15H2,1H3,(H,25,31)/t17-,18-,19+,22-/m1/s1	QICYWJCDSALLPT-NXWNEQKCSA-N	490.242749468							99180
BRD-K06470746	LSM-8806		54657624	InChI=1S/C25H38N4O5/c30-20-16-29(25(32)8-13-28-11-2-1-3-12-28)22-5-4-21(34-23(22)18-33-17-20)14-24(31)27-15-19-6-9-26-10-7-19/h6-7,9-10,20-23,30H,1-5,8,11-18H2,(H,27,31)/t20-,21-,22+,23-/m0/s1	VASBZAZXGIOICB-GPJHCHHRSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccncc3)CC[C@H]2N(C1)C(=O)CCN4CCCCC4	BroadT	BRD-K06470746	BRD-K06470746-001-01-1	Broad Institute of MIT and Harvard	BRD-K06470746			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccncc3)CC[C@H]2N(C1)C(=O)CCN1CCCCC1	InChI=1S/C25H38N4O5/c30-20-16-29(25(32)8-13-28-11-2-1-3-12-28)22-5-4-21(34-23(22)18-33-17-20)14-24(31)27-15-19-6-9-26-10-7-19/h6-7,9-10,20-23,30H,1-5,8,11-18H2,(H,27,31)/t20-,21-,22+,23-/m0/s1	VASBZAZXGIOICB-GPJHCHHRSA-N	474.284220356							97427
BRD-K61952473	LSM-12184		54657717	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17+,22+,23-/m1/s1	NLZWENHPOORBAO-YHFSLCLQSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@@H]2N(C1)C(=O)c4ccccc4F	BroadT	BRD-K61952473	BRD-K61952473-001-01-9	Broad Institute of MIT and Harvard	BRD-K61952473			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@@H]2N(C1)C(=O)c1ccccc1F	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17+,22+,23-/m1/s1	NLZWENHPOORBAO-YHFSLCLQSA-N	524.128105604							100810
BRD-K74553461	LSM-12995		54657775	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17-,18-,19+/m0/s1	MNYFKSZVIZZWBR-CADBVGFASA-N	O[C@H]1CN[C@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COC1	BroadT	BRD-K74553461	BRD-K74553461-001-01-4	Broad Institute of MIT and Harvard	BRD-K74553461			O[C@H]1CN[C@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2COC1	InChI=1S/C20H28N2O4/c23-16-10-21-18-6-5-17(26-19(18)13-25-12-16)9-20(24)22-8-7-14-3-1-2-4-15(14)11-22/h1-4,16-19,21,23H,5-13H2/t16-,17-,18-,19+/m0/s1	MNYFKSZVIZZWBR-CADBVGFASA-N	360.204907396							101632
BRD-K47261397	LSM-11316		54657673	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20-,21-,22+/m0/s1	UTTUQCGEIXLGEI-MYGLTJDJSA-N	O[C@H]1CN[C@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2COC1	BroadT	BRD-K47261397	BRD-K47261397-001-01-7	Broad Institute of MIT and Harvard	BRD-K47261397			O[C@H]1CN[C@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@@H]2COC1	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20-,21-,22+/m0/s1	UTTUQCGEIXLGEI-MYGLTJDJSA-N	396.204907396							99937
BRD-K08446710	LSM-8938		54657719	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17-,22+,23-/m0/s1	NLZWENHPOORBAO-ODYPEACGSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@H]2N(C1)C(=O)c4ccccc4F	BroadT	BRD-K08446710	BRD-K08446710-001-01-1	Broad Institute of MIT and Harvard	BRD-K08446710			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)CC[C@H]2N(C1)C(=O)c1ccccc1F	InChI=1S/C25H27Cl2FN2O5/c26-19-7-5-15(9-20(19)27)11-29-24(32)10-17-6-8-22-23(35-17)14-34-13-16(31)12-30(22)25(33)18-3-1-2-4-21(18)28/h1-5,7,9,16-17,22-23,31H,6,8,10-14H2,(H,29,32)/t16-,17-,22+,23-/m0/s1	NLZWENHPOORBAO-ODYPEACGSA-N	524.128105604							97559
BRD-K91156247	LSM-14036		54657657	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21+,22-,24+/m1/s1	ADXBMBRYFBFALA-GBAAUQCPSA-N	COc1ccccc1CNC(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3C(=O)Nc4ccc(F)cc4)O2	BroadT	BRD-K91156247	BRD-K91156247-001-01-6	Broad Institute of MIT and Harvard	BRD-K91156247			COc1ccccc1CNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)Nc2ccc(F)cc2)O1	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21+,22-,24+/m1/s1	ADXBMBRYFBFALA-GBAAUQCPSA-N	501.227513974							102689
BRD-K95545045	LSM-14286		54657705	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13+,14+,15-/m0/s1	JDRFUATZRDBDCA-YJNKXOJESA-N	CN1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@@H]12	BroadT	BRD-K95545045	BRD-K95545045-001-01-0	Broad Institute of MIT and Harvard	BRD-K95545045			CN1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@@H]12	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13+,14+,15-/m0/s1	JDRFUATZRDBDCA-YJNKXOJESA-N	312.204907396							102940
BRD-K61284851	LSM-12140		54657488	InChI=1S/C22H39N3O5/c1-23-6-8-24(9-7-23)22(27)12-19-2-3-20-21(30-19)16-29-15-18(26)14-25(20)13-17-4-10-28-11-5-17/h17-21,26H,2-16H2,1H3/t18-,19-,20+,21-/m0/s1	MTMISLSQWFYTRE-BURNTYAHSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3CC4CCOCC4)O2	BroadT	BRD-K61284851	BRD-K61284851-001-01-9	Broad Institute of MIT and Harvard	BRD-K61284851			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2CC2CCOCC2)O1	InChI=1S/C22H39N3O5/c1-23-6-8-24(9-7-23)22(27)12-19-2-3-20-21(30-19)16-29-15-18(26)14-25(20)13-17-4-10-28-11-5-17/h17-21,26H,2-16H2,1H3/t18-,19-,20+,21-/m0/s1	MTMISLSQWFYTRE-BURNTYAHSA-N	425.288971378							100766
BRD-K51257364	LSM-11564		54657767	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17-,18+,19-/m1/s1	LJZGTTWSAOWWCB-AKHDSKFASA-N	CCC(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@H]12	BroadT	BRD-K51257364	BRD-K51257364-001-01-7	Broad Institute of MIT and Harvard	BRD-K51257364			CCC(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@H]12	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17-,18+,19-/m1/s1	LJZGTTWSAOWWCB-AKHDSKFASA-N	426.196628416							100187
BRD-K65465954	LSM-12421		54657708	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13-,14-,15+/m1/s1	JDRFUATZRDBDCA-TUVASFSCSA-N	CN1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@@H]12	BroadT	BRD-K65465954	BRD-K65465954-001-01-6	Broad Institute of MIT and Harvard	BRD-K65465954			CN1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)NC3CCC3)CC[C@@H]12	InChI=1S/C16H28N2O4/c1-18-8-12(19)9-21-10-15-14(18)6-5-13(22-15)7-16(20)17-11-3-2-4-11/h11-15,19H,2-10H2,1H3,(H,17,20)/t12-,13-,14-,15+/m1/s1	JDRFUATZRDBDCA-TUVASFSCSA-N	312.204907396							101048
BRD-K75416754	LSM-13045		54657556	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12-,13+,14-/m0/s1	HDTRYUIMSWCRLO-FQUUOJAGSA-N	COC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2S(=O)(=O)c3cn(C)cn3)O1	BroadT	BRD-K75416754	BRD-K75416754-001-01-9	Broad Institute of MIT and Harvard	BRD-K75416754			COC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2S(=O)(=O)c2cn(C)cn2)O1	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12-,13+,14-/m0/s1	HDTRYUIMSWCRLO-FQUUOJAGSA-N	403.14132086							101682
BRD-K87838816	LSM-13815		54657639	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17-,18-,19+/m1/s1	OUTWOBHUWTVFCP-MKXGPGLRSA-N	CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc3ccc(cc3)C(F)(F)F)O1	BroadT	BRD-K87838816	BRD-K87838816-001-01-6	Broad Institute of MIT and Harvard	BRD-K87838816			CN(C)C(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc2ccc(cc2)C(F)(F)F)O1	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17-,18-,19+/m1/s1	OUTWOBHUWTVFCP-MKXGPGLRSA-N	430.207942028							102464
BRD-K43649826	LSM-11091		54657540	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22+,23-,24+/m0/s1	QYSMODXJNCJWNA-KAVIJBJXSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)Nc3cccc(Cl)c3)O1)c4ccccc4	BroadT	BRD-K43649826	BRD-K43649826-001-01-8	Broad Institute of MIT and Harvard	BRD-K43649826			C[C@H](NC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)Nc2cccc(Cl)c2)O1)c1ccccc1	InChI=1S/C26H32ClN3O5/c1-17(18-6-3-2-4-7-18)28-25(32)13-22-10-11-23-24(35-22)16-34-15-21(31)14-30(23)26(33)29-20-9-5-8-19(27)12-20/h2-9,12,17,21-24,31H,10-11,13-16H2,1H3,(H,28,32)(H,29,33)/t17-,21-,22+,23-,24+/m0/s1	QYSMODXJNCJWNA-KAVIJBJXSA-N	501.203048864							99712
BRD-K19971276	LSM-9641		54657487	InChI=1S/C22H39N3O5/c1-23-6-8-24(9-7-23)22(27)12-19-2-3-20-21(30-19)16-29-15-18(26)14-25(20)13-17-4-10-28-11-5-17/h17-21,26H,2-16H2,1H3/t18-,19+,20-,21+/m1/s1	MTMISLSQWFYTRE-MHTWAQMVSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3CC4CCOCC4)O2	BroadT	BRD-K19971276	BRD-K19971276-001-01-1	Broad Institute of MIT and Harvard	BRD-K19971276			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2CC2CCOCC2)O1	InChI=1S/C22H39N3O5/c1-23-6-8-24(9-7-23)22(27)12-19-2-3-20-21(30-19)16-29-15-18(26)14-25(20)13-17-4-10-28-11-5-17/h17-21,26H,2-16H2,1H3/t18-,19+,20-,21+/m1/s1	MTMISLSQWFYTRE-MHTWAQMVSA-N	425.288971378							98262
BRD-K79064338	LSM-13258		54657724	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15-,16-,17+/m1/s1	WSFSIZCPNKDEIH-VQHPVUNQSA-N	O[C@@H]1CN[C@@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2COC1	BroadT	BRD-K79064338	BRD-K79064338-001-01-8	Broad Institute of MIT and Harvard	BRD-K79064338			O[C@@H]1CN[C@@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2COC1	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15-,16-,17+/m1/s1	WSFSIZCPNKDEIH-VQHPVUNQSA-N	355.247106566							101897
BRD-K75843415	LSM-13067		54657789	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17+,18+,19-/m1/s1	GXFSXISHSMAVNQ-YDZRNGNQSA-N	COCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c3cc(Cl)cc(Cl)c3)O1	BroadT	BRD-K75843415	BRD-K75843415-001-01-5	Broad Institute of MIT and Harvard	BRD-K75843415			COCCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2C(=O)c2cc(Cl)cc(Cl)c2)O1	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17+,18+,19-/m1/s1	GXFSXISHSMAVNQ-YDZRNGNQSA-N	474.132442056							101704
BRD-K60362139	LSM-12078		54657662	InChI=1S/C23H27NO8S/c25-16-13-24(21-11-8-19(12-23(26)27)32-22(21)15-30-14-16)33(28,29)20-9-6-18(7-10-20)31-17-4-2-1-3-5-17/h1-7,9-10,16,19,21-22,25H,8,11-15H2,(H,26,27)/t16-,19-,21+,22-/m1/s1	WUYMKGAOXGWOLL-ZKMOHVOUSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)O)CC[C@@H]2N(C1)S(=O)(=O)c3ccc(Oc4ccccc4)cc3	BroadT	BRD-K60362139	BRD-K60362139-001-01-8	Broad Institute of MIT and Harvard	BRD-K60362139			O[C@H]1COC[C@H]2O[C@@H](CC(O)=O)CC[C@@H]2N(C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1	InChI=1S/C23H27NO8S/c25-16-13-24(21-11-8-19(12-23(26)27)32-22(21)15-30-14-16)33(28,29)20-9-6-18(7-10-20)31-17-4-2-1-3-5-17/h1-7,9-10,16,19,21-22,25H,8,11-15H2,(H,26,27)/t16-,19-,21+,22-/m1/s1	WUYMKGAOXGWOLL-ZKMOHVOUSA-N	477.145737524							100704
BRD-K83826027	LSM-13551		54657672	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20+,21+,22-/m1/s1	UTTUQCGEIXLGEI-CLAROIROSA-N	O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2COC1	BroadT	BRD-K83826027	BRD-K83826027-001-01-0	Broad Institute of MIT and Harvard	BRD-K83826027			O[C@@H]1CN[C@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@@H]2COC1	InChI=1S/C23H28N2O4/c26-19-13-24-21-11-10-20(29-22(21)15-28-14-19)12-23(27)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19-22,24,26H,10-15H2,(H,25,27)/t19-,20+,21+,22-/m1/s1	UTTUQCGEIXLGEI-CLAROIROSA-N	396.204907396							102193
BRD-K48306168	LSM-11367		54657599	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25+,27+,29-/m0/s1	PLPDORRRKBPITR-RCZLLDMCSA-N	COc1ccccc1NC(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)N4CCC(Cc5ccccc5)CC4)CC[C@@H]23	BroadT	BRD-K48306168	BRD-K48306168-001-01-6	Broad Institute of MIT and Harvard	BRD-K48306168			COc1ccccc1NC(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]12	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25+,27+,29-/m0/s1	PLPDORRRKBPITR-RCZLLDMCSA-N	551.299536062							99988
BRD-K38797319	LSM-10780		54657611	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21+,23-,24+/m1/s1	VYCGBAYEGCCJIH-JSRBNTPPSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@H]2N(Cc4cc(F)ccc4F)C1	BroadT	BRD-K38797319	BRD-K38797319-001-01-6	Broad Institute of MIT and Harvard	BRD-K38797319			O[C@H]1COC[C@@H]2O[C@H](CC(=O)NCc3ccc(Cl)cc3)CC[C@H]2N(Cc2cc(F)ccc2F)C1	InChI=1S/C25H29ClF2N2O4/c26-18-3-1-16(2-4-18)11-29-25(32)10-21-6-8-23-24(34-21)15-33-14-20(31)13-30(23)12-17-9-19(27)5-7-22(17)28/h1-5,7,9,20-21,23-24,31H,6,8,10-15H2,(H,29,32)/t20-,21+,23-,24+/m1/s1	VYCGBAYEGCCJIH-JSRBNTPPSA-N	494.178391538							99401
BRD-K55875111	LSM-11813		54657699	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14-,16-,17+/m0/s1	XTMFCURZJJHNFP-NXNVCVFFSA-N	CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c3ccccn3)O1	BroadT	BRD-K55875111	BRD-K55875111-001-01-8	Broad Institute of MIT and Harvard	BRD-K55875111			CCNC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c2ccccn2)O1	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14-,16-,17+/m0/s1	XTMFCURZJJHNFP-NXNVCVFFSA-N	377.195070994							100438
BRD-K75633187	LSM-13054		54657723	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15+,16-,17+/m1/s1	WSFSIZCPNKDEIH-TWMKSMIVSA-N	O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2COC1	BroadT	BRD-K75633187	BRD-K75633187-001-01-6	Broad Institute of MIT and Harvard	BRD-K75633187			O[C@@H]1CN[C@@H]2CC[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2COC1	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15+,16-,17+/m1/s1	WSFSIZCPNKDEIH-TWMKSMIVSA-N	355.247106566							101691
BRD-K31566137	LSM-10342		54657671	InChI=1S/C23H31FN2O5/c24-17-6-4-16(5-7-17)23(29)26-13-18(27)14-30-15-21-20(26)9-8-19(31-21)12-22(28)25-10-2-1-3-11-25/h4-7,18-21,27H,1-3,8-15H2/t18-,19-,20+,21-/m0/s1	HWBWJNULPIZKLY-BURNTYAHSA-N	O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)C(=O)c4ccc(F)cc4	BroadT	BRD-K31566137	BRD-K31566137-001-01-2	Broad Institute of MIT and Harvard	BRD-K31566137			O[C@@H]1COC[C@@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)C(=O)c1ccc(F)cc1	InChI=1S/C23H31FN2O5/c24-17-6-4-16(5-7-17)23(29)26-13-18(27)14-30-15-21-20(26)9-8-19(31-21)12-22(28)25-10-2-1-3-11-25/h4-7,18-21,27H,1-3,8-15H2/t18-,19-,20+,21-/m0/s1	HWBWJNULPIZKLY-BURNTYAHSA-N	434.221700312							98963
BRD-K63072081	LSM-12266		54657564	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22+,23-,24+/m0/s1	JSQZMBUYZHIIMM-KELGSRBJSA-N	COc1ccc(CN2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)NCCN4CCCC4)CC[C@H]23)cc1	BroadT	BRD-K63072081	BRD-K63072081-001-01-8	Broad Institute of MIT and Harvard	BRD-K63072081			COc1ccc(CN2C[C@H](O)COC[C@H]3O[C@@H](CC(=O)NCCN4CCCC4)CC[C@H]23)cc1	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22+,23-,24+/m0/s1	JSQZMBUYZHIIMM-KELGSRBJSA-N	461.288971378							100892
BRD-K97595524	LSM-14424		54657528	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21+,23-,24+/m0/s1	LCHNJAZNAXXEPD-SGKWCMOWSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCN(CC3)c4ccccc4)CC[C@@H]2N(C1)C(=O)c5cnccn5	BroadT	BRD-K97595524	BRD-K97595524-001-01-3	Broad Institute of MIT and Harvard	BRD-K97595524			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21+,23-,24+/m0/s1	LCHNJAZNAXXEPD-SGKWCMOWSA-N	495.248169206							103079
BRD-K23050218	LSM-9825		54657632	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24-,25-,26+/m0/s1	JKLIXGQQXOXZKK-ASDGIDEWSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NC3Cc4ccccc4C3)CC[C@@H]2N(C1)C(=O)Cc5ccccc5	BroadT	BRD-K23050218	BRD-K23050218-001-01-9	Broad Institute of MIT and Harvard	BRD-K23050218			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NC3Cc4ccccc4C3)CC[C@@H]2N(C1)C(=O)Cc1ccccc1	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24-,25-,26+/m0/s1	JKLIXGQQXOXZKK-ASDGIDEWSA-N	478.246772208							98446
BRD-K65240553	LSM-12407		54657577	InChI=1S/C25H37N3O6/c29-20-16-28(25(31)19-5-2-1-3-6-19)22-8-7-21(34-23(22)18-33-17-20)15-24(30)26-9-4-10-27-11-13-32-14-12-27/h1-3,5-6,20-23,29H,4,7-18H2,(H,26,30)/t20-,21-,22-,23+/m0/s1	AMMWEOQELITDAS-CWBXHPNXSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCCCN3CCOCC3)CC[C@@H]2N(C1)C(=O)c4ccccc4	BroadT	BRD-K65240553	BRD-K65240553-001-01-8	Broad Institute of MIT and Harvard	BRD-K65240553			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCCCN3CCOCC3)CC[C@@H]2N(C1)C(=O)c1ccccc1	InChI=1S/C25H37N3O6/c29-20-16-28(25(31)19-5-2-1-3-6-19)22-8-7-21(34-23(22)18-33-17-20)15-24(30)26-9-4-10-27-11-13-32-14-12-27/h1-3,5-6,20-23,29H,4,7-18H2,(H,26,30)/t20-,21-,22-,23+/m0/s1	AMMWEOQELITDAS-CWBXHPNXSA-N	475.268235934							101034
CHEMBL2356215	LSM-11738	BRD-K54546524, SID131454189	54657743	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26-,28-,29+/m1/s1	LOPBZILAZMWERO-HTCHUFIESA-N	Cc1cccc(c1)S(=O)(=O)N2C[C@@H](O)COC[C@@H]3O[C@@H](CC(=O)Nc4ccc(cc4)c5ccccc5)CC[C@@H]23	BroadT	BRD-K54546524	BRD-K54546524-001-01-7	Broad Institute of MIT and Harvard	BRD-K54546524			Cc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]12	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26-,28-,29+/m1/s1	LOPBZILAZMWERO-HTCHUFIESA-N	550.213757518							100363
BRD-K55561254	LSM-11792		54657593	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14+,15-,18+/m0/s1	YFRMSEXFMHDWES-JTOWHCCKSA-N	O[C@H]1CN[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COC1	BroadT	BRD-K55561254	BRD-K55561254-001-01-1	Broad Institute of MIT and Harvard	BRD-K55561254			O[C@H]1CN[C@H]2CC[C@H](CC(=O)NCc3ccc4OCOc4c3)O[C@@H]2COC1	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14+,15-,18+/m0/s1	YFRMSEXFMHDWES-JTOWHCCKSA-N	378.179086572							100417
BRD-K74671783	LSM-13005		54657757	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14-,17+,18-/m1/s1	ZCDZHCWZNJFIKB-KJWYOANISA-N	CNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc3ccc(Cl)c(Cl)c3)O1	BroadT	BRD-K74671783	BRD-K74671783-001-01-5	Broad Institute of MIT and Harvard	BRD-K74671783			CNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc2ccc(Cl)c(Cl)c2)O1	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14-,17+,18-/m1/s1	ZCDZHCWZNJFIKB-KJWYOANISA-N	416.126962752							101642
BRD-K43703651	LSM-11093		54657698	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14+,16+,17-/m0/s1	XTMFCURZJJHNFP-ABFRBSLYSA-N	CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)c3ccccn3)O1	BroadT	BRD-K43703651	BRD-K43703651-001-01-3	Broad Institute of MIT and Harvard	BRD-K43703651			CCNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)c2ccccn2)O1	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14+,16+,17-/m0/s1	XTMFCURZJJHNFP-ABFRBSLYSA-N	377.195070994							99714
BRD-K20876879	LSM-9701		54657720	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15-,16+,17-/m1/s1	WSFSIZCPNKDEIH-WCXIOVBPSA-N	O[C@@H]1CN[C@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COC1	BroadT	BRD-K20876879	BRD-K20876879-001-01-0	Broad Institute of MIT and Harvard	BRD-K20876879			O[C@@H]1CN[C@H]2CC[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2COC1	InChI=1S/C18H33N3O4/c22-14-11-20-16-5-4-15(25-17(16)13-24-12-14)10-18(23)19-6-9-21-7-2-1-3-8-21/h14-17,20,22H,1-13H2,(H,19,23)/t14-,15-,16+,17-/m1/s1	WSFSIZCPNKDEIH-WCXIOVBPSA-N	355.247106566							98322
BRD-K95487462	LSM-14280		54657768	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17-,18-,19+/m1/s1	LJZGTTWSAOWWCB-MKXGPGLRSA-N	CCC(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@@H]12	BroadT	BRD-K95487462	BRD-K95487462-001-01-9	Broad Institute of MIT and Harvard	BRD-K95487462			CCC(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@@H]12	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17-,18-,19+/m1/s1	LJZGTTWSAOWWCB-MKXGPGLRSA-N	426.196628416							102934
BRD-K82234732	LSM-13454		54657578	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24+,25+,26-/m0/s1	VMOCTUISBGPURH-QUMGSSFMSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@H]2N(Cc4cccc(c4)c5ccncc5)C1	BroadT	BRD-K82234732	BRD-K82234732-001-01-4	Broad Institute of MIT and Harvard	BRD-K82234732			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@H]2N(Cc2cccc(c2)-c2ccncc2)C1	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24+,25+,26-/m0/s1	VMOCTUISBGPURH-QUMGSSFMSA-N	481.25767125							102094
BRD-K29326853	LSM-10206		54657513	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20+,21+,22-/m0/s1	TWGHTEGHSVIJBR-CBPXPLCBSA-N	Cn1cnc(CCNC(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3C(=O)Nc4ccc(cc4)C(F)(F)F)O2)c1	BroadT	BRD-K29326853	BRD-K29326853-001-01-7	Broad Institute of MIT and Harvard	BRD-K29326853			Cn1cnc(CCNC(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3C(=O)Nc3ccc(cc3)C(F)(F)F)O2)c1	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20+,21+,22-/m0/s1	TWGHTEGHSVIJBR-CBPXPLCBSA-N	539.235553774							98827
BRD-K06891569	LSM-8837		54657762	InChI=1S/C25H36ClN3O5/c26-18-6-8-19(9-7-18)28-25(32)29-14-20(30)15-33-16-23-22(29)11-10-21(34-23)12-24(31)27-13-17-4-2-1-3-5-17/h6-9,17,20-23,30H,1-5,10-16H2,(H,27,31)(H,28,32)/t20-,21+,22+,23-/m0/s1	SYCYKHHPUCXRJT-AFXVXQJMSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)C(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K06891569	BRD-K06891569-001-01-2	Broad Institute of MIT and Harvard	BRD-K06891569			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@H]2N(C1)C(=O)Nc1ccc(Cl)cc1	InChI=1S/C25H36ClN3O5/c26-18-6-8-19(9-7-18)28-25(32)29-14-20(30)15-33-16-23-22(29)11-10-21(34-23)12-24(31)27-13-17-4-2-1-3-5-17/h6-9,17,20-23,30H,1-5,10-16H2,(H,27,31)(H,28,32)/t20-,21+,22+,23-/m0/s1	SYCYKHHPUCXRJT-AFXVXQJMSA-N	493.234348992							97458
BRD-K63933178	LSM-12329		54657625	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24+,25-,26+/m0/s1	JKLIXGQQXOXZKK-ROXDYWFKSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NC3Cc4ccccc4C3)CC[C@@H]2N(C1)C(=O)Cc5ccccc5	BroadT	BRD-K63933178	BRD-K63933178-001-01-5	Broad Institute of MIT and Harvard	BRD-K63933178			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NC3Cc4ccccc4C3)CC[C@@H]2N(C1)C(=O)Cc1ccccc1	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24+,25-,26+/m0/s1	JKLIXGQQXOXZKK-ROXDYWFKSA-N	478.246772208							100956
BRD-K58475709	LSM-11956		54657585	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24+,25-,26+/m0/s1	VMOCTUISBGPURH-ROXDYWFKSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@@H]2N(Cc4cccc(c4)c5ccncc5)C1	BroadT	BRD-K58475709	BRD-K58475709-001-01-2	Broad Institute of MIT and Harvard	BRD-K58475709			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCOCC3)CC[C@@H]2N(Cc2cccc(c2)-c2ccncc2)C1	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24+,25-,26+/m0/s1	VMOCTUISBGPURH-ROXDYWFKSA-N	481.25767125							100582
BRD-K65012833	LSM-12399		54657638	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17+,18-,19+/m1/s1	OUTWOBHUWTVFCP-HCXYKTFWSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc3ccc(cc3)C(F)(F)F)O1	BroadT	BRD-K65012833	BRD-K65012833-001-01-3	Broad Institute of MIT and Harvard	BRD-K65012833			CN(C)C(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc2ccc(cc2)C(F)(F)F)O1	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17+,18-,19+/m1/s1	OUTWOBHUWTVFCP-HCXYKTFWSA-N	430.207942028							101026
BRD-K91729331	LSM-14063		54657633	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17+,18-,19+/m0/s1	OUTWOBHUWTVFCP-ZSYWTGECSA-N	CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc3ccc(cc3)C(F)(F)F)O1	BroadT	BRD-K91729331	BRD-K91729331-001-01-7	Broad Institute of MIT and Harvard	BRD-K91729331			CN(C)C(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2Cc2ccc(cc2)C(F)(F)F)O1	InChI=1S/C21H29F3N2O4/c1-25(2)20(28)9-17-7-8-18-19(30-17)13-29-12-16(27)11-26(18)10-14-3-5-15(6-4-14)21(22,23)24/h3-6,16-19,27H,7-13H2,1-2H3/t16-,17+,18-,19+/m0/s1	OUTWOBHUWTVFCP-ZSYWTGECSA-N	430.207942028							102716
BRD-K83390709	LSM-13524		54657529	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21+,23+,24-/m1/s1	LCHNJAZNAXXEPD-AWAHEQQVSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCN(CC3)c4ccccc4)CC[C@@H]2N(C1)C(=O)c5cnccn5	BroadT	BRD-K83390709	BRD-K83390709-001-01-2	Broad Institute of MIT and Harvard	BRD-K83390709			O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCN(CC3)c3ccccc3)CC[C@@H]2N(C1)C(=O)c1cnccn1	InChI=1S/C26H33N5O5/c32-20-16-31(26(34)22-15-27-8-9-28-22)23-7-6-21(36-24(23)18-35-17-20)14-25(33)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-5,8-9,15,20-21,23-24,32H,6-7,10-14,16-18H2/t20-,21+,23+,24-/m1/s1	LCHNJAZNAXXEPD-AWAHEQQVSA-N	495.248169206							102165
BRD-K20159808	LSM-9656		54657477	InChI=1S/C19H28N2O6S/c1-28(24,25)21-11-15(22)12-26-13-18-17(21)8-7-16(27-18)9-19(23)20-10-14-5-3-2-4-6-14/h2-6,15-18,22H,7-13H2,1H3,(H,20,23)/t15-,16-,17+,18-/m1/s1	CRYMYAPOZVNFQJ-ZJPYXAASSA-N	CS(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3ccccc3)CC[C@H]12	BroadT	BRD-K20159808	BRD-K20159808-001-01-7	Broad Institute of MIT and Harvard	BRD-K20159808			CS(=O)(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3ccccc3)CC[C@H]12	InChI=1S/C19H28N2O6S/c1-28(24,25)21-11-15(22)12-26-13-18-17(21)8-7-16(27-18)9-19(23)20-10-14-5-3-2-4-6-14/h2-6,15-18,22H,7-13H2,1H3,(H,20,23)/t15-,16-,17+,18-/m1/s1	CRYMYAPOZVNFQJ-ZJPYXAASSA-N	412.166807326							98277
BRD-K93880770	LSM-14187		54657761	InChI=1S/C25H36ClN3O5/c26-18-6-8-19(9-7-18)28-25(32)29-14-20(30)15-33-16-23-22(29)11-10-21(34-23)12-24(31)27-13-17-4-2-1-3-5-17/h6-9,17,20-23,30H,1-5,10-16H2,(H,27,31)(H,28,32)/t20-,21-,22+,23-/m1/s1	SYCYKHHPUCXRJT-BXXSPATCSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)C(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K93880770	BRD-K93880770-001-01-4	Broad Institute of MIT and Harvard	BRD-K93880770			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(C1)C(=O)Nc1ccc(Cl)cc1	InChI=1S/C25H36ClN3O5/c26-18-6-8-19(9-7-18)28-25(32)29-14-20(30)15-33-16-23-22(29)11-10-21(34-23)12-24(31)27-13-17-4-2-1-3-5-17/h6-9,17,20-23,30H,1-5,10-16H2,(H,27,31)(H,28,32)/t20-,21-,22+,23-/m1/s1	SYCYKHHPUCXRJT-BXXSPATCSA-N	493.234348992							102841
BRD-K64285892	LSM-12350		54657774	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17+,18-,19+/m1/s1	LJZGTTWSAOWWCB-HCXYKTFWSA-N	CCC(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@@H]12	BroadT	BRD-K64285892	BRD-K64285892-001-01-4	Broad Institute of MIT and Harvard	BRD-K64285892			CCC(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)NCc3cc(F)cc(F)c3)CC[C@@H]12	InChI=1S/C21H28F2N2O5/c1-2-21(28)25-10-16(26)11-29-12-19-18(25)4-3-17(30-19)8-20(27)24-9-13-5-14(22)7-15(23)6-13/h5-7,16-19,26H,2-4,8-12H2,1H3,(H,24,27)/t16-,17+,18-,19+/m1/s1	LJZGTTWSAOWWCB-HCXYKTFWSA-N	426.196628416							100977
BRD-K18639483	LSM-9550		54657568	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22-,23+,24-/m1/s1	JSQZMBUYZHIIMM-CAUSLRQDSA-N	COc1ccc(CN2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)NCCN4CCCC4)CC[C@H]23)cc1	BroadT	BRD-K18639483	BRD-K18639483-001-01-4	Broad Institute of MIT and Harvard	BRD-K18639483			COc1ccc(CN2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)NCCN4CCCC4)CC[C@H]23)cc1	InChI=1S/C25H39N3O5/c1-31-21-6-4-19(5-7-21)15-28-16-20(29)17-32-18-24-23(28)9-8-22(33-24)14-25(30)26-10-13-27-11-2-3-12-27/h4-7,20,22-24,29H,2-3,8-18H2,1H3,(H,26,30)/t20-,22-,23+,24-/m1/s1	JSQZMBUYZHIIMM-CAUSLRQDSA-N	461.288971378							98171
BRD-K16964495	LSM-9456		54657740	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25-,26+,27-/m1/s1	WTHWQCPYZWPYSX-JVYGEBFASA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)CC[C@@H]2N(C1)C(=O)c5cccnc5	BroadT	BRD-K16964495	BRD-K16964495-001-01-4	Broad Institute of MIT and Harvard	BRD-K16964495			O[C@H]1COC[C@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]2N(C1)C(=O)c1cccnc1	InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25-,26+,27-/m1/s1	WTHWQCPYZWPYSX-JVYGEBFASA-N	501.226371122							98077
BRD-K12575545	LSM-9178		54657654	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21+,22-,24+/m0/s1	ADXBMBRYFBFALA-HYVLGVRCSA-N	COc1ccccc1CNC(=O)C[C@H]2CC[C@H]3[C@@H](COC[C@@H](O)CN3C(=O)Nc4ccc(F)cc4)O2	BroadT	BRD-K12575545	BRD-K12575545-001-01-2	Broad Institute of MIT and Harvard	BRD-K12575545			COc1ccccc1CNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)Nc2ccc(F)cc2)O1	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21+,22-,24+/m0/s1	ADXBMBRYFBFALA-HYVLGVRCSA-N	501.227513974							97799
BRD-K38643780	LSM-10771		54657787	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17-,18+,19-/m0/s1	GXFSXISHSMAVNQ-OKYOBFRVSA-N	COCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)c3cc(Cl)cc(Cl)c3)O1	BroadT	BRD-K38643780	BRD-K38643780-001-01-2	Broad Institute of MIT and Harvard	BRD-K38643780			COCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)c2cc(Cl)cc(Cl)c2)O1	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17-,18+,19-/m0/s1	GXFSXISHSMAVNQ-OKYOBFRVSA-N	474.132442056							99392
BRD-K85797809	LSM-13685		54657753	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14+,17+,18-/m0/s1	ZCDZHCWZNJFIKB-JFTQMJAMSA-N	CNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc3ccc(Cl)c(Cl)c3)O1	BroadT	BRD-K85797809	BRD-K85797809-001-01-5	Broad Institute of MIT and Harvard	BRD-K85797809			CNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc2ccc(Cl)c(Cl)c2)O1	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14+,17+,18-/m0/s1	ZCDZHCWZNJFIKB-JFTQMJAMSA-N	416.126962752							102333
BRD-K96555842	LSM-14352		54657598	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25+,27-,29+/m1/s1	PLPDORRRKBPITR-IMBSVQIASA-N	COc1ccccc1NC(=O)N2C[C@@H](O)COC[C@@H]3O[C@H](CC(=O)N4CCC(Cc5ccccc5)CC4)CC[C@@H]23	BroadT	BRD-K96555842	BRD-K96555842-001-01-3	Broad Institute of MIT and Harvard	BRD-K96555842			COc1ccccc1NC(=O)N1C[C@@H](O)COC[C@@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]12	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25+,27-,29+/m1/s1	PLPDORRRKBPITR-IMBSVQIASA-N	551.299536062							103006
BRD-K80169513	LSM-13321		54657746	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26+,28+,29-/m0/s1	LOPBZILAZMWERO-MFACLRLHSA-N	Cc1cccc(c1)S(=O)(=O)N2C[C@H](O)COC[C@@H]3O[C@@H](CC(=O)Nc4ccc(cc4)c5ccccc5)CC[C@@H]23	BroadT	BRD-K80169513	BRD-K80169513-001-01-9	Broad Institute of MIT and Harvard	BRD-K80169513			Cc1cccc(c1)S(=O)(=O)N1C[C@H](O)COC[C@@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]12	InChI=1S/C30H34N2O6S/c1-21-6-5-9-27(16-21)39(35,36)32-18-25(33)19-37-20-29-28(32)15-14-26(38-29)17-30(34)31-24-12-10-23(11-13-24)22-7-3-2-4-8-22/h2-13,16,25-26,28-29,33H,14-15,17-20H2,1H3,(H,31,34)/t25-,26+,28+,29-/m0/s1	LOPBZILAZMWERO-MFACLRLHSA-N	550.213757518							101960
BRD-K04229162	LSM-8686		54657700	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14+,16-,17+/m0/s1	XTMFCURZJJHNFP-HDEZJCGLSA-N	CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c3ccccn3)O1	BroadT	BRD-K04229162	BRD-K04229162-001-01-8	Broad Institute of MIT and Harvard	BRD-K04229162			CCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c2ccccn2)O1	InChI=1S/C19H27N3O5/c1-2-20-18(24)9-14-6-7-16-17(27-14)12-26-11-13(23)10-22(16)19(25)15-5-3-4-8-21-15/h3-5,8,13-14,16-17,23H,2,6-7,9-12H2,1H3,(H,20,24)/t13-,14+,16-,17+/m0/s1	XTMFCURZJJHNFP-HDEZJCGLSA-N	377.195070994							97307
SCHEMBL16980374	LSM-6846	SA-1973509, BRD-K66555347	54657693	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30+,31+,32-/m0/s1	HJQSQTAMFLANGO-NEFBLYCDSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@H]2N(Cc5ccc(Oc6ccccc6)cc5)C1	BroadT	BRD-K66555347	BRD-K66555347-001-01-9	Broad Institute of MIT and Harvard	BRD-K66555347			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@H]2N(Cc2ccc(Oc3ccccc3)cc2)C1	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30+,31+,32-/m0/s1	HJQSQTAMFLANGO-NEFBLYCDSA-N	542.278072336							95467
BRD-K60637442	LSM-12093		54657518	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17+,18+,19-/m1/s1	LOZCXWBJFMLABO-YDZRNGNQSA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K60637442	BRD-K60637442-001-01-5	Broad Institute of MIT and Harvard	BRD-K60637442			O[C@H]1COC[C@H]2O[C@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(CCC(F)(F)F)C1	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17+,18+,19-/m1/s1	LOZCXWBJFMLABO-YDZRNGNQSA-N	436.25489222							100719
BRD-K94390774	LSM-14217		54657728	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22-,23+,24-/m1/s1	QCHQNBIYSRQADD-JLLPCOHGSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCCc3ccncc3)CC[C@@H]2N(Cc4cccc(c4)C(F)(F)F)C1	BroadT	BRD-K94390774	BRD-K94390774-001-01-9	Broad Institute of MIT and Harvard	BRD-K94390774			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NCCc3ccncc3)CC[C@@H]2N(Cc2cccc(c2)C(F)(F)F)C1	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22-,23+,24-/m1/s1	QCHQNBIYSRQADD-JLLPCOHGSA-N	507.234491134							102871
BRD-K04701379	LSM-8720		54657752	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14-,17+,18-/m0/s1	ZCDZHCWZNJFIKB-ZZCKCESHSA-N	CNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc3ccc(Cl)c(Cl)c3)O1	BroadT	BRD-K04701379	BRD-K04701379-001-01-5	Broad Institute of MIT and Harvard	BRD-K04701379			CNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2Cc2ccc(Cl)c(Cl)c2)O1	InChI=1S/C19H26Cl2N2O4/c1-22-19(25)7-14-3-5-17-18(27-14)11-26-10-13(24)9-23(17)8-12-2-4-15(20)16(21)6-12/h2,4,6,13-14,17-18,24H,3,5,7-11H2,1H3,(H,22,25)/t13-,14-,17+,18-/m0/s1	ZCDZHCWZNJFIKB-ZZCKCESHSA-N	416.126962752							97341
BRD-K39481055	LSM-10827		54657512	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20-,21-,22+/m1/s1	TWGHTEGHSVIJBR-YSFYHYPLSA-N	Cn1cnc(CCNC(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3C(=O)Nc4ccc(cc4)C(F)(F)F)O2)c1	BroadT	BRD-K39481055	BRD-K39481055-001-01-4	Broad Institute of MIT and Harvard	BRD-K39481055			Cn1cnc(CCNC(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@H](O)CN3C(=O)Nc3ccc(cc3)C(F)(F)F)O2)c1	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20-,21-,22+/m1/s1	TWGHTEGHSVIJBR-YSFYHYPLSA-N	539.235553774							99448
BRD-K67655178	LSM-12545		54657600	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25-,27-,29+/m0/s1	PLPDORRRKBPITR-SEGPTPNXSA-N	COc1ccccc1NC(=O)N2C[C@H](O)COC[C@H]3O[C@H](CC(=O)N4CCC(Cc5ccccc5)CC4)CC[C@H]23	BroadT	BRD-K67655178	BRD-K67655178-001-01-0	Broad Institute of MIT and Harvard	BRD-K67655178			COc1ccccc1NC(=O)N1C[C@H](O)COC[C@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]12	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25-,27-,29+/m0/s1	PLPDORRRKBPITR-SEGPTPNXSA-N	551.299536062							101176
BRD-K15392449	LSM-9348		54657735	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22-,23-,24+/m0/s1	QCHQNBIYSRQADD-NEWJYFPISA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCCc3ccncc3)CC[C@@H]2N(Cc4cccc(c4)C(F)(F)F)C1	BroadT	BRD-K15392449	BRD-K15392449-001-01-6	Broad Institute of MIT and Harvard	BRD-K15392449			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NCCc3ccncc3)CC[C@@H]2N(Cc2cccc(c2)C(F)(F)F)C1	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22-,23-,24+/m0/s1	QCHQNBIYSRQADD-NEWJYFPISA-N	507.234491134							97969
BRD-K04745699	LSM-8722		54657626	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24+,25+,26-/m1/s1	JKLIXGQQXOXZKK-KEVKATSASA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)NC3Cc4ccccc4C3)CC[C@@H]2N(C1)C(=O)Cc5ccccc5	BroadT	BRD-K04745699	BRD-K04745699-001-01-5	Broad Institute of MIT and Harvard	BRD-K04745699			O[C@H]1COC[C@H]2O[C@H](CC(=O)NC3Cc4ccccc4C3)CC[C@@H]2N(C1)C(=O)Cc1ccccc1	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24+,25+,26-/m1/s1	JKLIXGQQXOXZKK-KEVKATSASA-N	478.246772208							97343
BRD-K14886982	LSM-9324		54657584	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24+,25+,26-/m1/s1	VMOCTUISBGPURH-KEVKATSASA-N	O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@@H]2N(Cc4cccc(c4)c5ccncc5)C1	BroadT	BRD-K14886982	BRD-K14886982-001-01-1	Broad Institute of MIT and Harvard	BRD-K14886982			O[C@H]1COC[C@H]2O[C@H](CC(=O)N3CCOCC3)CC[C@@H]2N(Cc2cccc(c2)-c2ccncc2)C1	InChI=1S/C27H35N3O5/c31-23-17-30(16-20-2-1-3-22(14-20)21-6-8-28-9-7-21)25-5-4-24(35-26(25)19-34-18-23)15-27(32)29-10-12-33-13-11-29/h1-3,6-9,14,23-26,31H,4-5,10-13,15-19H2/t23-,24+,25+,26-/m1/s1	VMOCTUISBGPURH-KEVKATSASA-N	481.25767125							97945
BRD-K37849751	LSM-10721		54657659	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21+,22+,24-/m0/s1	ADXBMBRYFBFALA-NXYDZRKXSA-N	COc1ccccc1CNC(=O)C[C@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3C(=O)Nc4ccc(F)cc4)O2	BroadT	BRD-K37849751	BRD-K37849751-001-01-1	Broad Institute of MIT and Harvard	BRD-K37849751			COc1ccccc1CNC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2C(=O)Nc2ccc(F)cc2)O1	InChI=1S/C26H32FN3O6/c1-34-23-5-3-2-4-17(23)13-28-25(32)12-21-10-11-22-24(36-21)16-35-15-20(31)14-30(22)26(33)29-19-8-6-18(27)7-9-19/h2-9,20-22,24,31H,10-16H2,1H3,(H,28,32)(H,29,33)/t20-,21+,22+,24-/m0/s1	ADXBMBRYFBFALA-NXYDZRKXSA-N	501.227513974							99342
BRD-K68614469	LSM-12612		54657484	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9-,10-,11+/m0/s1	FKMAUGDURCCEJG-XWLWVQCSSA-N	COC(=O)C[C@@H]1CC[C@@H]2NC[C@H](O)COC[C@H]2O1	BroadT	BRD-K68614469	BRD-K68614469-001-01-4	Broad Institute of MIT and Harvard	BRD-K68614469			COC(=O)C[C@@H]1CC[C@@H]2NC[C@H](O)COC[C@H]2O1	InChI=1S/C12H21NO5/c1-16-12(15)4-9-2-3-10-11(18-9)7-17-6-8(14)5-13-10/h8-11,13-14H,2-7H2,1H3/t8-,9-,10-,11+/m0/s1	FKMAUGDURCCEJG-XWLWVQCSSA-N	259.141972782							101244
BRD-K96640402	LSM-14362		54657507	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20-,21+,22-/m0/s1	TWGHTEGHSVIJBR-KJJMTIBFSA-N	Cn1cnc(CCNC(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3C(=O)Nc4ccc(cc4)C(F)(F)F)O2)c1	BroadT	BRD-K96640402	BRD-K96640402-001-01-5	Broad Institute of MIT and Harvard	BRD-K96640402			Cn1cnc(CCNC(=O)C[C@@H]2CC[C@@H]3[C@H](COC[C@@H](O)CN3C(=O)Nc3ccc(cc3)C(F)(F)F)O2)c1	InChI=1S/C25H32F3N5O5/c1-32-11-18(30-15-32)8-9-29-23(35)10-20-6-7-21-22(38-20)14-37-13-19(34)12-33(21)24(36)31-17-4-2-16(3-5-17)25(26,27)28/h2-5,11,15,19-22,34H,6-10,12-14H2,1H3,(H,29,35)(H,31,36)/t19-,20-,21+,22-/m0/s1	TWGHTEGHSVIJBR-KJJMTIBFSA-N	539.235553774							103016
BRD-K42142217	LSM-10986		54657588	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14-,15+,18-/m0/s1	YFRMSEXFMHDWES-AFIMGQEJSA-N	O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COC1	BroadT	BRD-K42142217	BRD-K42142217-001-01-2	Broad Institute of MIT and Harvard	BRD-K42142217			O[C@H]1CN[C@@H]2CC[C@@H](CC(=O)NCc3ccc4OCOc4c3)O[C@H]2COC1	InChI=1S/C19H26N2O6/c22-13-8-20-15-3-2-14(27-18(15)10-24-9-13)6-19(23)21-7-12-1-4-16-17(5-12)26-11-25-16/h1,4-5,13-15,18,20,22H,2-3,6-11H2,(H,21,23)/t13-,14-,15+,18-/m0/s1	YFRMSEXFMHDWES-AFIMGQEJSA-N	378.179086572							99607
BRD-K84976438	LSM-13619		54657730	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22+,23-,24+/m0/s1	QCHQNBIYSRQADD-UARRHKHWSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCCc3ccncc3)CC[C@@H]2N(Cc4cccc(c4)C(F)(F)F)C1	BroadT	BRD-K84976438	BRD-K84976438-001-01-5	Broad Institute of MIT and Harvard	BRD-K84976438			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCCc3ccncc3)CC[C@@H]2N(Cc2cccc(c2)C(F)(F)F)C1	InChI=1S/C26H32F3N3O4/c27-26(28,29)20-3-1-2-19(12-20)14-32-15-21(33)16-35-17-24-23(32)5-4-22(36-24)13-25(34)31-11-8-18-6-9-30-10-7-18/h1-3,6-7,9-10,12,21-24,33H,4-5,8,11,13-17H2,(H,31,34)/t21-,22+,23-,24+/m0/s1	QCHQNBIYSRQADD-UARRHKHWSA-N	507.234491134							131223
BRD-K38126560	LSM-10738		54657667	InChI=1S/C23H31FN2O5/c24-17-6-4-16(5-7-17)23(29)26-13-18(27)14-30-15-21-20(26)9-8-19(31-21)12-22(28)25-10-2-1-3-11-25/h4-7,18-21,27H,1-3,8-15H2/t18-,19+,20-,21+/m1/s1	HWBWJNULPIZKLY-MHTWAQMVSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)C(=O)c4ccc(F)cc4	BroadT	BRD-K38126560	BRD-K38126560-001-01-4	Broad Institute of MIT and Harvard	BRD-K38126560			O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)C(=O)c1ccc(F)cc1	InChI=1S/C23H31FN2O5/c24-17-6-4-16(5-7-17)23(29)26-13-18(27)14-30-15-21-20(26)9-8-19(31-21)12-22(28)25-10-2-1-3-11-25/h4-7,18-21,27H,1-3,8-15H2/t18-,19+,20-,21+/m1/s1	HWBWJNULPIZKLY-MHTWAQMVSA-N	434.221700312							99359
BRD-K05543055	LSM-8755		54657596	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25-,27+,29-/m1/s1	PLPDORRRKBPITR-MCXWQWDOSA-N	COc1ccccc1NC(=O)N2C[C@@H](O)COC[C@H]3O[C@@H](CC(=O)N4CCC(Cc5ccccc5)CC4)CC[C@H]23	BroadT	BRD-K05543055	BRD-K05543055-001-01-1	Broad Institute of MIT and Harvard	BRD-K05543055			COc1ccccc1NC(=O)N1C[C@@H](O)COC[C@H]2O[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]12	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25-,27+,29-/m1/s1	PLPDORRRKBPITR-MCXWQWDOSA-N	551.299536062							97376
BRD-K84455184	LSM-13591		54657501	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17+,18+,19-/m0/s1	HLMLEGKKEQKEEG-MANSERQUSA-N	O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)Nc3nccs3)CC[C@H]2N(Cc4cc(F)cc(F)c4)C1	BroadT	BRD-K84455184	BRD-K84455184-001-01-6	Broad Institute of MIT and Harvard	BRD-K84455184			O[C@@H]1COC[C@@H]2O[C@@H](CC(=O)Nc3nccs3)CC[C@H]2N(Cc2cc(F)cc(F)c2)C1	InChI=1S/C21H25F2N3O4S/c22-14-5-13(6-15(23)7-14)9-26-10-16(27)11-29-12-19-18(26)2-1-17(30-19)8-20(28)25-21-24-3-4-31-21/h3-7,16-19,27H,1-2,8-12H2,(H,24,25,28)/t16-,17+,18+,19-/m0/s1	HLMLEGKKEQKEEG-MANSERQUSA-N	453.1533834							102235
BRD-K99874282	LSM-14564		54657788	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17+,18-,19+/m0/s1	GXFSXISHSMAVNQ-ZSYWTGECSA-N	COCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c3cc(Cl)cc(Cl)c3)O1	BroadT	BRD-K99874282	BRD-K99874282-001-01-2	Broad Institute of MIT and Harvard	BRD-K99874282			COCCNC(=O)C[C@H]1CC[C@H]2[C@@H](COC[C@@H](O)CN2C(=O)c2cc(Cl)cc(Cl)c2)O1	InChI=1S/C21H28Cl2N2O6/c1-29-5-4-24-20(27)9-17-2-3-18-19(31-17)12-30-11-16(26)10-25(18)21(28)13-6-14(22)8-15(23)7-13/h6-8,16-19,26H,2-5,9-12H2,1H3,(H,24,27)/t16-,17+,18-,19+/m0/s1	GXFSXISHSMAVNQ-ZSYWTGECSA-N	474.132442056							103220
BRD-K32581454-001-01-5	LSM-6827	BRD-K32581454	54657690	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30-,31+,32-/m1/s1	HJQSQTAMFLANGO-ZHKQUFGTSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]2N(Cc5ccc(Oc6ccccc6)cc5)C1	BroadT	BRD-K32581454	BRD-K32581454-001-01-5	Broad Institute of MIT and Harvard	BRD-K32581454			O[C@H]1COC[C@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]2N(Cc2ccc(Oc3ccccc3)cc2)C1	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30-,31+,32-/m1/s1	HJQSQTAMFLANGO-ZHKQUFGTSA-N	542.278072336							95448
BRD-K94222931	LSM-14204		54657519	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17+,18-,19+/m0/s1	LOZCXWBJFMLABO-ZSYWTGECSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(CCC(F)(F)F)C1	BroadT	BRD-K94222931	BRD-K94222931-001-01-4	Broad Institute of MIT and Harvard	BRD-K94222931			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)NCC3CCCCC3)CC[C@@H]2N(CCC(F)(F)F)C1	InChI=1S/C21H35F3N2O4/c22-21(23,24)8-9-26-12-16(27)13-29-14-19-18(26)7-6-17(30-19)10-20(28)25-11-15-4-2-1-3-5-15/h15-19,27H,1-14H2,(H,25,28)/t16-,17+,18-,19+/m0/s1	LOZCXWBJFMLABO-ZSYWTGECSA-N	436.25489222							102858
BRD-K97894266	LSM-14444		54657681	InChI=1S/C22H34ClN3O6S/c1-25(2)11-3-10-24-22(28)12-18-6-9-20-21(32-18)15-31-14-17(27)13-26(20)33(29,30)19-7-4-16(23)5-8-19/h4-5,7-8,17-18,20-21,27H,3,6,9-15H2,1-2H3,(H,24,28)/t17-,18-,20+,21-/m0/s1	NJKGITFUOGWCFU-MMKMLUHNSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2S(=O)(=O)c3ccc(Cl)cc3)O1	BroadT	BRD-K97894266	BRD-K97894266-001-01-2	Broad Institute of MIT and Harvard	BRD-K97894266			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H]2[C@H](COC[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)O1	InChI=1S/C22H34ClN3O6S/c1-25(2)11-3-10-24-22(28)12-18-6-9-20-21(32-18)15-31-14-17(27)13-26(20)33(29,30)19-7-4-16(23)5-8-19/h4-5,7-8,17-18,20-21,27H,3,6,9-15H2,1-2H3,(H,24,28)/t17-,18-,20+,21-/m0/s1	NJKGITFUOGWCFU-MMKMLUHNSA-N	503.185684238							103099
BRD-K84636160	LSM-13601		54657506	InChI=1S/C24H32N2O7/c27-17-11-26(24(29)15-5-8-20-21(9-15)32-14-31-20)19-7-6-18(33-22(19)13-30-12-17)10-23(28)25-16-3-1-2-4-16/h5,8-9,16-19,22,27H,1-4,6-7,10-14H2,(H,25,28)/t17-,18-,19-,22+/m0/s1	JZHWTQAESVMWQB-ZVVDCOBXSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)NC3CCCC3)CC[C@@H]2N(C1)C(=O)c4ccc5OCOc5c4	BroadT	BRD-K84636160	BRD-K84636160-001-01-9	Broad Institute of MIT and Harvard	BRD-K84636160			O[C@@H]1COC[C@H]2O[C@H](CC(=O)NC3CCCC3)CC[C@@H]2N(C1)C(=O)c1ccc2OCOc2c1	InChI=1S/C24H32N2O7/c27-17-11-26(24(29)15-5-8-20-21(9-15)32-14-31-20)19-7-6-18(33-22(19)13-30-12-17)10-23(28)25-16-3-1-2-4-16/h5,8-9,16-19,22,27H,1-4,6-7,10-14H2,(H,25,28)/t17-,18-,19-,22+/m0/s1	JZHWTQAESVMWQB-ZVVDCOBXSA-N	460.220951384							102245
BRD-K18542345	LSM-9545		54657601	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25-,27+,29-/m0/s1	PLPDORRRKBPITR-WLIZDUGGSA-N	COc1ccccc1NC(=O)N2C[C@H](O)COC[C@@H]3O[C@H](CC(=O)N4CCC(Cc5ccccc5)CC4)CC[C@@H]23	BroadT	BRD-K18542345	BRD-K18542345-001-01-8	Broad Institute of MIT and Harvard	BRD-K18542345			COc1ccccc1NC(=O)N1C[C@H](O)COC[C@@H]2O[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]12	InChI=1S/C31H41N3O6/c1-38-28-10-6-5-9-26(28)32-31(37)34-19-24(35)20-39-21-29-27(34)12-11-25(40-29)18-30(36)33-15-13-23(14-16-33)17-22-7-3-2-4-8-22/h2-10,23-25,27,29,35H,11-21H2,1H3,(H,32,37)/t24-,25-,27+,29-/m0/s1	PLPDORRRKBPITR-WLIZDUGGSA-N	551.299536062							98166
BRD-K06161868	LSM-8786		54657558	InChI=1S/C22H31ClN2O6S/c23-16-5-4-6-19(11-16)32(28,29)25-13-17(26)14-30-15-21-20(25)8-7-18(31-21)12-22(27)24-9-2-1-3-10-24/h4-6,11,17-18,20-21,26H,1-3,7-10,12-15H2/t17-,18+,20-,21+/m1/s1	WUWHFUUUQPRUMO-JYRKZWEQSA-N	O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K06161868	BRD-K06161868-001-01-8	Broad Institute of MIT and Harvard	BRD-K06161868			O[C@H]1COC[C@@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@H]2N(C1)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H31ClN2O6S/c23-16-5-4-6-19(11-16)32(28,29)25-13-17(26)14-30-15-21-20(25)8-7-18(31-21)12-22(27)24-9-2-1-3-10-24/h4-6,11,17-18,20-21,26H,1-3,7-10,12-15H2/t17-,18+,20-,21+/m1/s1	WUWHFUUUQPRUMO-JYRKZWEQSA-N	486.159135132							97407
SCHEMBL16980379	LSM-6818	BRD-K03652504	54657691	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30+,31-,32+/m0/s1	HJQSQTAMFLANGO-WREQKUGYSA-N	O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]2N(Cc5ccc(Oc6ccccc6)cc5)C1	BroadT	BRD-K03652504	BRD-K03652504-001-01-9	Broad Institute of MIT and Harvard	BRD-K03652504			O[C@@H]1COC[C@H]2O[C@@H](CC(=O)N3CCc4ccccc4C3)CC[C@@H]2N(Cc2ccc(Oc3ccccc3)cc2)C1	InChI=1S/C33H38N2O5/c36-27-21-35(19-24-10-12-29(13-11-24)39-28-8-2-1-3-9-28)31-15-14-30(40-32(31)23-38-22-27)18-33(37)34-17-16-25-6-4-5-7-26(25)20-34/h1-13,27,30-32,36H,14-23H2/t27-,30+,31-,32+/m0/s1	HJQSQTAMFLANGO-WREQKUGYSA-N	542.278072336							95439
BRD-K88617912	LSM-13876		54657559	InChI=1S/C22H31ClN2O6S/c23-16-5-4-6-19(11-16)32(28,29)25-13-17(26)14-30-15-21-20(25)8-7-18(31-21)12-22(27)24-9-2-1-3-10-24/h4-6,11,17-18,20-21,26H,1-3,7-10,12-15H2/t17-,18-,20-,21+/m0/s1	WUWHFUUUQPRUMO-JYAXBFRTSA-N	O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K88617912	BRD-K88617912-001-01-6	Broad Institute of MIT and Harvard	BRD-K88617912			O[C@@H]1COC[C@H]2O[C@H](CC(=O)N3CCCCC3)CC[C@@H]2N(C1)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H31ClN2O6S/c23-16-5-4-6-19(11-16)32(28,29)25-13-17(26)14-30-15-21-20(25)8-7-18(31-21)12-22(27)24-9-2-1-3-10-24/h4-6,11,17-18,20-21,26H,1-3,7-10,12-15H2/t17-,18-,20-,21+/m0/s1	WUWHFUUUQPRUMO-JYAXBFRTSA-N	486.159135132							102529
BRD-K24932095	LSM-9944		54657553	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12+,13+,14-/m1/s1	HDTRYUIMSWCRLO-ZOBORPQBSA-N	COC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2S(=O)(=O)c3cn(C)cn3)O1	BroadT	BRD-K24932095	BRD-K24932095-001-01-5	Broad Institute of MIT and Harvard	BRD-K24932095			COC(=O)C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2S(=O)(=O)c2cn(C)cn2)O1	InChI=1S/C16H25N3O7S/c1-18-7-15(17-10-18)27(22,23)19-6-11(20)8-25-9-14-13(19)4-3-12(26-14)5-16(21)24-2/h7,10-14,20H,3-6,8-9H2,1-2H3/t11-,12+,13+,14-/m1/s1	HDTRYUIMSWCRLO-ZOBORPQBSA-N	403.14132086							98565
BRD-K47228813	LSM-11313		54657631	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24-,25+,26-/m1/s1	JKLIXGQQXOXZKK-FXSWLTOZSA-N	O[C@H]1COC[C@H]2O[C@@H](CC(=O)NC3Cc4ccccc4C3)CC[C@@H]2N(C1)C(=O)Cc5ccccc5	BroadT	BRD-K47228813	BRD-K47228813-001-01-2	Broad Institute of MIT and Harvard	BRD-K47228813			O[C@H]1COC[C@H]2O[C@@H](CC(=O)NC3Cc4ccccc4C3)CC[C@@H]2N(C1)C(=O)Cc1ccccc1	InChI=1S/C28H34N2O5/c31-23-16-30(28(33)12-19-6-2-1-3-7-19)25-11-10-24(35-26(25)18-34-17-23)15-27(32)29-22-13-20-8-4-5-9-21(20)14-22/h1-9,22-26,31H,10-18H2,(H,29,32)/t23-,24-,25+,26-/m1/s1	JKLIXGQQXOXZKK-FXSWLTOZSA-N	478.246772208							99934
BRD-K18236913-001-01-9	LSM-8154	BRD-K18236913	44505607	InChI=1S/C24H34N6O6/c1-16-11-29(17(2)13-31)23(32)5-4-8-30-19(10-25-27-30)14-34-22(16)12-28(3)24(33)26-18-6-7-20-21(9-18)36-15-35-20/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3,(H,26,33)/t16-,17+,22+/m0/s1	PARFVHOUOBIHJG-GSHUGGBRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K18236913	BRD-K18236913-001-02-7	Broad Institute of MIT and Harvard	BRD-K18236913			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H34N6O6/c1-16-11-29(17(2)13-31)23(32)5-4-8-30-19(10-25-27-30)14-34-22(16)12-28(3)24(33)26-18-6-7-20-21(9-18)36-15-35-20/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3,(H,26,33)/t16-,17+,22+/m0/s1	PARFVHOUOBIHJG-GSHUGGBRSA-N	502.253982868							96775
BRD-K77836949	LSM-8362		44505768	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17+,19-/m1/s1	UOJDQXZVAPFQKD-ZIFCJYIRSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K77836949	BRD-K77836949-001-01-2	Broad Institute of MIT and Harvard	BRD-K77836949			CC(C)COC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)9-26(17(4)12-27)20(28)7-6-8-25-10-18(14-30-19)22-23-25/h10,15-17,19,27H,6-9,11-14H2,1-5H3/t16-,17+,19-/m1/s1	UOJDQXZVAPFQKD-ZIFCJYIRSA-N	439.279469334							96983
MLS003129718	LSM-8174	BRD-K25595086	44505356	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	QVHCTLOUCAXGOY-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K25595086	BRD-K25595086-001-02-8	Broad Institute of MIT and Harvard	BRD-K25595086			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H35N5O5S/c1-19-14-31(20(2)17-32)26(33)9-6-12-30-15-23(27-28-30)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,32H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	QVHCTLOUCAXGOY-FHAGJXEFSA-N	529.23588996							96795
MLS003129518	LSM-8347	BRD-K72195772, SID99357900	44494078	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18+,21+/m1/s1	NJZPXWDDBMYIMJ-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K72195772	BRD-K72195772-001-02-8	Broad Institute of MIT and Harvard	BRD-K72195772			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)5-4-10-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-8-23-9-7-19/h6-9,11,17-18,21,29H,4-5,10,12-16H2,1-3H3/t17-,18+,21+/m1/s1	NJZPXWDDBMYIMJ-LQWHRVPQSA-N	430.269239008							96968
MLS003130222	LSM-8260	BRD-K50146767	44505476	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18+,22+/m0/s1	GQDZDOSXBZGUQJ-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K50146767	BRD-K50146767-001-02-4	Broad Institute of MIT and Harvard	BRD-K50146767			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18+,22+/m0/s1	GQDZDOSXBZGUQJ-NJNPRVFISA-N	445.26890465							96881
BRD-K06162576	LSM-8126		44488707	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16-/m1/s1	WAHUPRWPWKVPJH-IIAWOOMASA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K06162576	BRD-K06162576-001-01-9	Broad Institute of MIT and Harvard	BRD-K06162576			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16-/m1/s1	WAHUPRWPWKVPJH-IIAWOOMASA-N	353.242689902							96747
MLS003129574	LSM-8309	BRD-K64100337	44505203	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26-/m0/s1	WJAIMBKFVIKGAD-VRUMLPLGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K64100337	BRD-K64100337-001-02-6	Broad Institute of MIT and Harvard	BRD-K64100337			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26-/m0/s1	WJAIMBKFVIKGAD-VRUMLPLGSA-N	541.337652926							96930
BRD-K41574893	LSM-8232		44506013	InChI=1S/C22H38N6O4/c1-16-11-28(17(2)14-29)21(30)9-6-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)23-18-7-4-5-8-18/h12,16-18,20,29H,4-11,13-15H2,1-3H3,(H,23,31)/t16-,17-,20-/m0/s1	NHKODMKPZBXGEI-ZWOKBUDYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K41574893	BRD-K41574893-001-01-8	Broad Institute of MIT and Harvard	BRD-K41574893			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H38N6O4/c1-16-11-28(17(2)14-29)21(30)9-6-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)23-18-7-4-5-8-18/h12,16-18,20,29H,4-11,13-15H2,1-3H3,(H,23,31)/t16-,17-,20-/m0/s1	NHKODMKPZBXGEI-ZWOKBUDYSA-N	450.295453756							96853
BRD-K67669478	LSM-8326		44490869	InChI=1S/C23H35N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,29H,7,10-11,13-17H2,1-3H3/t18-,19-,22-/m0/s1	AYVSZOBZIZEFEA-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K67669478	BRD-K67669478-001-01-8	Broad Institute of MIT and Harvard	BRD-K67669478			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,29H,7,10-11,13-17H2,1-3H3/t18-,19-,22-/m0/s1	AYVSZOBZIZEFEA-IPJJNNNSSA-N	429.27399003							96947
BRD-K27371551	LSM-8183		44505188	InChI=1S/C23H33N5O5/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-19(24-25-27)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	NWYXEXAEFWIOJN-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K27371551	BRD-K27371551-001-01-0	Broad Institute of MIT and Harvard	BRD-K27371551			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33N5O5/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-19(24-25-27)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	NWYXEXAEFWIOJN-WFXMLNOXSA-N	459.248169206							96804
BRD-K61823824	LSM-8298		44504998	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)9-25(16(4)12-26)19(27)7-6-8-24-10-17(13-29-18)21-22-24/h10,14-16,18,26H,6-9,11-13H2,1-5H3/t15-,16+,18-/m1/s1	FYUBIBUWDYYNKH-SOLBZPMBSA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K61823824	BRD-K61823824-001-01-8	Broad Institute of MIT and Harvard	BRD-K61823824			CC(C)OC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)9-25(16(4)12-26)19(27)7-6-8-24-10-17(13-29-18)21-22-24/h10,14-16,18,26H,6-9,11-13H2,1-5H3/t15-,16+,18-/m1/s1	FYUBIBUWDYYNKH-SOLBZPMBSA-N	425.26381927							96919
BRD-K04518829	LSM-8122		44505231	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)9-6-10-29-22(17-32-23)12-25-26-29/h5,7-8,11-12,19-20,23,30H,6,9-10,13-17H2,1-4H3/t19-,20+,23-/m0/s1	JFBDPIUUNLHCPK-MZKRTTBSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K04518829	BRD-K04518829-001-01-9	Broad Institute of MIT and Harvard	BRD-K04518829			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)9-6-10-29-22(17-32-23)12-25-26-29/h5,7-8,11-12,19-20,23,30H,6,9-10,13-17H2,1-4H3/t19-,20+,23-/m0/s1	JFBDPIUUNLHCPK-MZKRTTBSSA-N	443.289640094							96743
BRD-K96698997	LSM-8419		44495958	InChI=1S/C28H37N5O6S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-23(29-30-32)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22-,27-/m1/s1	SYWTUHWEQAODFK-VHFRWLAGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K96698997	BRD-K96698997-001-01-4	Broad Institute of MIT and Harvard	BRD-K96698997			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N5O6S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-23(29-30-32)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22-,27-/m1/s1	SYWTUHWEQAODFK-VHFRWLAGSA-N	571.246454644							97040
BRD-K96708215	LSM-8420		44505865	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17+,22-/m0/s1	FSJQCDSATLDVBC-JKSBSHDWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K96708215	BRD-K96708215-001-01-7	Broad Institute of MIT and Harvard	BRD-K96708215			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17+,22-/m0/s1	FSJQCDSATLDVBC-JKSBSHDWSA-N	497.196045386							97041
MLS003129220	LSM-8133	BRD-K08754235	44505796	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)5-4-10-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-8-6-18(24)7-9-19/h6-9,12,16-17,21,31H,4-5,10-11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21+/m0/s1	IBNJZESYQXVKKB-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K08754235	BRD-K08754235-001-02-2	Broad Institute of MIT and Harvard	BRD-K08754235			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)5-4-10-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-8-6-18(24)7-9-19/h6-9,12,16-17,21,31H,4-5,10-11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21+/m0/s1	IBNJZESYQXVKKB-CSODHUTKSA-N	476.254731796							96754
MLS003129712	LSM-8329	BRD-K68665543, SID99358156	44505980	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24-/m1/s1	DZRIWTKXHLXUTO-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K68665543	BRD-K68665543-001-02-4	Broad Institute of MIT and Harvard	BRD-K68665543			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19+,24-/m1/s1	DZRIWTKXHLXUTO-YDIMBITNSA-N	510.259068248							96950
MLS003129676	LSM-8251	BRD-K48005659	44505171	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20+/m0/s1	JYOVEVCXPRGJRX-SQGPQFPESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K48005659	BRD-K48005659-001-02-8	Broad Institute of MIT and Harvard	BRD-K48005659			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20+/m0/s1	JYOVEVCXPRGJRX-SQGPQFPESA-N	497.210818064							96872
BRD-K37556799	LSM-8218		44505198	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25-/m0/s1	JATGFWCPGFHVCF-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K37556799	BRD-K37556799-001-01-6	Broad Institute of MIT and Harvard	BRD-K37556799			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20-,25-/m0/s1	JATGFWCPGFHVCF-RLSLOFABSA-N	509.26381927							96839
MLS003129142	LSM-8151	BRD-K16079243, SID99357482	44504986	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22-/m0/s1	MESWQEBVROHANN-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K16079243	BRD-K16079243-001-02-4	Broad Institute of MIT and Harvard	BRD-K16079243			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22-/m0/s1	MESWQEBVROHANN-JQVVWYNYSA-N	457.26890465							96772
BRD-K15234779	LSM-8147		44489816	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20+,25-/m1/s1	VRVGAAPGNIASDT-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K15234779	BRD-K15234779-001-01-0	Broad Institute of MIT and Harvard	BRD-K15234779			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20+,25-/m1/s1	VRVGAAPGNIASDT-OHUGHZGNSA-N	500.31110382							96768
MLS003129193	LSM-8157	BRD-K18942395	44505202	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26-/m0/s1	WJAIMBKFVIKGAD-MCEYFSPLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K18942395	BRD-K18942395-001-02-7	Broad Institute of MIT and Harvard	BRD-K18942395			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26-/m0/s1	WJAIMBKFVIKGAD-MCEYFSPLSA-N	541.337652926							96778
MLS003129728	LSM-8393	SID99358171, BRD-K87004592	44504928	InChI=1S/C22H33N5O5S/c1-17-13-26(18(2)15-28)22(29)10-7-11-27-19(12-23-24-27)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,28H,7,10-11,13-16H2,1-3H3/t17-,18-,21-/m0/s1	YDFSFENEUSKTIZ-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K87004592	BRD-K87004592-001-02-3	Broad Institute of MIT and Harvard	BRD-K87004592			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H33N5O5S/c1-17-13-26(18(2)15-28)22(29)10-7-11-27-19(12-23-24-27)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,28H,7,10-11,13-16H2,1-3H3/t17-,18-,21-/m0/s1	YDFSFENEUSKTIZ-WFXMLNOXSA-N	479.220239896							97014
BRD-K33576455	LSM-8199		44505906	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)6-5-11-29-22(17-32-23)12-25-26-29/h7-10,12,19-20,23,30H,5-6,11,13-17H2,1-4H3/t19-,20+,23-/m1/s1	WGPDLCVCGOLGPE-ZRCGQRJVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K33576455	BRD-K33576455-001-01-3	Broad Institute of MIT and Harvard	BRD-K33576455			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)6-5-11-29-22(17-32-23)12-25-26-29/h7-10,12,19-20,23,30H,5-6,11,13-17H2,1-4H3/t19-,20+,23-/m1/s1	WGPDLCVCGOLGPE-ZRCGQRJVSA-N	443.289640094							96820
BRD-K34522271	LSM-8205		44504916	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22-/m0/s1	DGDOMSZWPVXBGZ-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K34522271	BRD-K34522271-001-01-8	Broad Institute of MIT and Harvard	BRD-K34522271			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22-/m0/s1	DGDOMSZWPVXBGZ-IPJJNNNSSA-N	493.23588996							96826
MLS003130331	LSM-8193	BRD-K31866446, SID99359227	44505379	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20+/m1/s1	JYOVEVCXPRGJRX-UWVAXJGDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K31866446	BRD-K31866446-001-02-0	Broad Institute of MIT and Harvard	BRD-K31866446			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17+,20+/m1/s1	JYOVEVCXPRGJRX-UWVAXJGDSA-N	497.210818064							96814
MLS003129929	LSM-8164	BRD-K21682170	44505792	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)5-4-10-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-8-6-18(24)7-9-19/h6-9,12,16-17,21,31H,4-5,10-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21+/m0/s1	IBNJZESYQXVKKB-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K21682170	BRD-K21682170-001-02-5	Broad Institute of MIT and Harvard	BRD-K21682170			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)5-4-10-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-8-6-18(24)7-9-19/h6-9,12,16-17,21,31H,4-5,10-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21+/m0/s1	IBNJZESYQXVKKB-XGHQBKJUSA-N	476.254731796							96785
MLS003129277	LSM-8155	SID99357541, BRD-K18391257	44487405	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25-/m0/s1	KFMYUMLTCHBBFY-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K18391257	BRD-K18391257-001-02-4	Broad Institute of MIT and Harvard	BRD-K18391257			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25-/m0/s1	KFMYUMLTCHBBFY-RLSLOFABSA-N	529.23588996							96776
MLS003130256	LSM-8371	BRD-K80185984, SID99359045	44505588	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25-/m1/s1	GHLJLHKVBJDFKH-TYBLODHISA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K80185984	BRD-K80185984-001-02-3	Broad Institute of MIT and Harvard	BRD-K80185984			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25-/m1/s1	GHLJLHKVBJDFKH-TYBLODHISA-N	551.285617354							96992
BRD-K50580743	LSM-8263		44488166	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18-,23-/m1/s1	ZLSVBQPGKZIPOU-PMAPCBKXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K50580743	BRD-K50580743-001-01-5	Broad Institute of MIT and Harvard	BRD-K50580743			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18-,23-/m1/s1	ZLSVBQPGKZIPOU-PMAPCBKXSA-N	473.26381927							96884
MLS003129298	LSM-8159	BRD-K19712135, SID99357559	44492056	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22-,26+/m0/s1	HFDOIJULVRDPRU-AOJNWGRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K19712135	BRD-K19712135-001-02-8	Broad Institute of MIT and Harvard	BRD-K19712135			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22-,26+/m0/s1	HFDOIJULVRDPRU-AOJNWGRGSA-N	541.337652926							96780
BRD-K71254735	LSM-8342		44505032	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20-,23-/m0/s1	MEJUTVOAQGGYHA-JTAQYXEDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K71254735	BRD-K71254735-001-01-2	Broad Institute of MIT and Harvard	BRD-K71254735			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20-,23-/m0/s1	MEJUTVOAQGGYHA-JTAQYXEDSA-N	443.289640094							96963
MLS003129332	LSM-8305	BRD-K63017817, SID99357590	44485739	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25-/m1/s1	KFMYUMLTCHBBFY-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K63017817	BRD-K63017817-001-02-2	Broad Institute of MIT and Harvard	BRD-K63017817			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25-/m1/s1	KFMYUMLTCHBBFY-OHUGHZGNSA-N	529.23588996							96926
BRD-K78633583	LSM-8367		44488159	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22-,26-/m0/s1	HFDOIJULVRDPRU-MCEYFSPLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K78633583	BRD-K78633583-001-01-3	Broad Institute of MIT and Harvard	BRD-K78633583			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22-,26-/m0/s1	HFDOIJULVRDPRU-MCEYFSPLSA-N	541.337652926							96988
BRD-K62427254	LSM-8302		44505478	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22+/m0/s1	HYDPWGICXZADLJ-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K62427254	BRD-K62427254-001-01-6	Broad Institute of MIT and Harvard	BRD-K62427254			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22+/m0/s1	HYDPWGICXZADLJ-NJNPRVFISA-N	445.26890465							96923
MLS003129655	LSM-8402	BRD-K89595887, SID99358056	44505974	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,20+/m0/s1	NSEOCVGIAYKUAZ-ABSDTBQOSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K89595887	BRD-K89595887-001-02-2	Broad Institute of MIT and Harvard	BRD-K89595887			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17-,20+/m0/s1	NSEOCVGIAYKUAZ-ABSDTBQOSA-N	444.248503564							97023
BRD-K48279074	LSM-8255		44505245	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19+,23-/m1/s1	GEARZFJDEYGDIT-SELNLUPBSA-N	COc1cccc(CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K48279074	BRD-K48279074-001-01-8	Broad Institute of MIT and Harvard	BRD-K48279074			COc1cccc(CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)c1	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19+,23-/m1/s1	GEARZFJDEYGDIT-SELNLUPBSA-N	459.284554714							96876
BRD-K11022796	LSM-8141		44496389	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)10-7-11-27-13-19(24-25-27)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-4H3/t17-,18-,21-/m0/s1	WYMIJPVEWZCEGL-WFXMLNOXSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K11022796	BRD-K11022796-001-01-2	Broad Institute of MIT and Harvard	BRD-K11022796			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)10-7-11-27-13-19(24-25-27)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-4H3/t17-,18-,21-/m0/s1	WYMIJPVEWZCEGL-WFXMLNOXSA-N	509.23080458							96762
MLS003129134	LSM-8404	BRD-K90534988, SID99357475	44505975	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19-,24-/m1/s1	DZRIWTKXHLXUTO-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(on2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K90534988	BRD-K90534988-001-02-6	Broad Institute of MIT and Harvard	BRD-K90534988			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C26H34N6O5/c1-18-14-31(19(2)16-33)25(34)10-7-11-32-21(13-27-29-32)17-36-24(18)15-30(3)26(35)22-12-23(37-28-22)20-8-5-4-6-9-20/h4-6,8-9,12-13,18-19,24,33H,7,10-11,14-17H2,1-3H3/t18-,19-,24-/m1/s1	DZRIWTKXHLXUTO-KHCICDEESA-N	510.259068248							97025
BRD-K89063992	LSM-8401		44505652	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19+,23-/m0/s1	RQWMQWHENJCHFR-YYDVJCTNSA-N	COc1cccc(CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)c1	BroadT	BRD-K89063992	BRD-K89063992-001-01-5	Broad Institute of MIT and Harvard	BRD-K89063992			COc1cccc(CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)c1	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19+,23-/m0/s1	RQWMQWHENJCHFR-YYDVJCTNSA-N	459.284554714							97022
BRD-K26653603	LSM-8179		44505625	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18-,23-/m0/s1	BKRQCUCZQROLSQ-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K26653603	BRD-K26653603-001-01-0	Broad Institute of MIT and Harvard	BRD-K26653603			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18-,23-/m0/s1	BKRQCUCZQROLSQ-BSRJHKFKSA-N	516.269632932							96800
MLS003129353	LSM-8253	BRD-K48140215, SID99357663	44505851	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22+/m0/s1	YYALKDZNPSDWDC-NPPFBWRTSA-N	COc1cccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)c1	BroadT	BRD-K48140215	BRD-K48140215-001-02-0	Broad Institute of MIT and Harvard	BRD-K48140215			COc1cccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)c1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)9-6-10-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-5-8-21(11-19)34-4/h5,7-8,11,13,17-18,22,31H,6,9-10,12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22+/m0/s1	YYALKDZNPSDWDC-NPPFBWRTSA-N	488.274718312							96874
BRD-K88299492	LSM-8396		44498550	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19+,22-/m0/s1	ZIMKOTFORJXDIC-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K88299492	BRD-K88299492-001-01-1	Broad Institute of MIT and Harvard	BRD-K88299492			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19+,22-/m0/s1	ZIMKOTFORJXDIC-JQVVWYNYSA-N	435.320940222							97017
MLS003129589	LSM-8378	BRD-K82494568, SID99357957	44489806	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22+/m0/s1	YRBTUIBMTXMQGX-NNMXDRDESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K82494568	BRD-K82494568-001-02-1	Broad Institute of MIT and Harvard	BRD-K82494568			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22+/m0/s1	YRBTUIBMTXMQGX-NNMXDRDESA-N	473.26381927							96999
MLS003130230	LSM-8241	SID99359023, BRD-K43852369	44505542	InChI=1S/C28H37N5O5S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-25(16-29-30-33)20-38-27(21)18-31(3)39(36,37)26-13-11-24(12-14-26)23-8-5-4-6-9-23/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22+,27-/m1/s1	BKQPNZMATHQHFX-UMTXDNHDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K43852369	BRD-K43852369-001-02-9	Broad Institute of MIT and Harvard	BRD-K43852369			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N5O5S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-25(16-29-30-33)20-38-27(21)18-31(3)39(36,37)26-13-11-24(12-14-26)23-8-5-4-6-9-23/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22+,27-/m1/s1	BKQPNZMATHQHFX-UMTXDNHDSA-N	555.251540024							96862
MLS003129620	LSM-8285	BRD-K57882732, SID99358030	44489805	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15-,17+/m0/s1	CMMUKIKJYLMGMW-YQQAZPJKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K57882732	BRD-K57882732-001-02-9	Broad Institute of MIT and Harvard	BRD-K57882732			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15-,17+/m0/s1	CMMUKIKJYLMGMW-YQQAZPJKSA-N	463.240639154							96906
BRD-K30312461	LSM-8189		44487414	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21+,25-/m1/s1	WYPGSQIBOYUSAK-TYBLODHISA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K30312461	BRD-K30312461-001-01-8	Broad Institute of MIT and Harvard	BRD-K30312461			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N7O5/c1-20-15-35(21(2)18-36)27(37)11-7-13-34-16-23(31-32-34)19-39-25(20)17-33(3)28(38)30-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14,16,20-21,25,36H,7,11,13,15,17-19H2,1-3H3,(H,30,38)/t20-,21+,25-/m1/s1	WYPGSQIBOYUSAK-TYBLODHISA-N	551.285617354							96810
BRD-K04882719	LSM-8123		44505766	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)9-24(15(3)12-25)18(26)7-6-8-23-10-16(13-29-17)20-21-23/h10,14-15,17,25H,5-9,11-13H2,1-4H3/t14-,15+,17-/m1/s1	OBJUKURLMFMQOH-HLLBOEOZSA-N	CCOC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K04882719	BRD-K04882719-001-01-2	Broad Institute of MIT and Harvard	BRD-K04882719			CCOC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)9-24(15(3)12-25)18(26)7-6-8-23-10-16(13-29-17)20-21-23/h10,14-15,17,25H,5-9,11-13H2,1-4H3/t14-,15+,17-/m1/s1	OBJUKURLMFMQOH-HLLBOEOZSA-N	411.248169206							96744
BRD-K56379049	LSM-8280		44498146	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20+,25-/m1/s1	OLIWWUKSUJJEPA-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K56379049	BRD-K56379049-001-01-7	Broad Institute of MIT and Harvard	BRD-K56379049			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3cccnc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O3/c1-19-14-31(20(2)17-33)26(34)7-5-11-32-23(13-28-29-32)18-35-25(19)16-30(3)15-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12-13,19-20,25,33H,5,7,11,14-18H2,1-3H3/t19-,20+,25-/m1/s1	OLIWWUKSUJJEPA-OHUGHZGNSA-N	480.284889072							96901
BRD-K38618007	LSM-8220		44505599	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)5-4-10-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-8-6-18(24)7-9-19/h6-9,12,16-17,21,31H,4-5,10-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21-/m0/s1	IBNJZESYQXVKKB-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K38618007	BRD-K38618007-001-01-1	Broad Institute of MIT and Harvard	BRD-K38618007			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)5-4-10-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-8-6-18(24)7-9-19/h6-9,12,16-17,21,31H,4-5,10-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21-/m0/s1	IBNJZESYQXVKKB-FIKGOQFSSA-N	476.254731796							96841
MLS003129421	LSM-8389	SID121282490, BRD-K86466947	44504955	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17-,20+/m1/s1	JYOVEVCXPRGJRX-HLIPFELVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K86466947	BRD-K86466947-001-02-7	Broad Institute of MIT and Harvard	BRD-K86466947			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17-,20+/m1/s1	JYOVEVCXPRGJRX-HLIPFELVSA-N	497.210818064							97010
BRD-K64649802	LSM-8313		44505856	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17+,22-/m1/s1	FSJQCDSATLDVBC-HYFFOGBASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K64649802	BRD-K64649802-001-01-0	Broad Institute of MIT and Harvard	BRD-K64649802			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17+,22-/m1/s1	FSJQCDSATLDVBC-HYFFOGBASA-N	497.196045386							96934
BRD-K66186977	LSM-8320		44488708	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20-,25-/m0/s1	PJEXWGOYWCOKCP-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K66186977	BRD-K66186977-001-01-0	Broad Institute of MIT and Harvard	BRD-K66186977			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20-,25-/m0/s1	PJEXWGOYWCOKCP-RLSLOFABSA-N	480.284889072							96941
BRD-K79561347	LSM-8368		44505876	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18+,21-/m1/s1	QSHHTQCGWZKCKD-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K79561347	BRD-K79561347-001-01-2	Broad Institute of MIT and Harvard	BRD-K79561347			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18+,21-/m1/s1	QSHHTQCGWZKCKD-LVCYWYKZSA-N	430.269239008							96989
MLS003129222	LSM-8213	BRD-K36691793, SID99357425	44505996	InChI=1S/C23H33N5O5/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-19(12-24-25-28)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18-,21-/m1/s1	VVYGNONDBDDRFX-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K36691793	BRD-K36691793-001-02-6	Broad Institute of MIT and Harvard	BRD-K36691793			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33N5O5/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-19(12-24-25-28)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18-,21-/m1/s1	VVYGNONDBDDRFX-DBXWQHBBSA-N	459.248169206							96834
MLS003129738	LSM-8139	BRD-K10486333, SID99358181	44491446	InChI=1S/C22H33N5O5S/c1-17-12-27(18(2)15-28)22(29)10-7-11-26-13-19(23-24-26)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,28H,7,10-12,14-16H2,1-3H3/t17-,18+,21+/m1/s1	BDEMCWTZQNVVEU-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K10486333	BRD-K10486333-001-02-8	Broad Institute of MIT and Harvard	BRD-K10486333			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H33N5O5S/c1-17-12-27(18(2)15-28)22(29)10-7-11-26-13-19(23-24-26)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,28H,7,10-12,14-16H2,1-3H3/t17-,18+,21+/m1/s1	BDEMCWTZQNVVEU-LQWHRVPQSA-N	479.220239896							96760
MLS003129323	LSM-8171	BRD-K24321898, SID99357582	44505844	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m0/s1	QOPMKJNNAFOQDN-XGHQBKJUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K24321898	BRD-K24321898-001-02-8	Broad Institute of MIT and Harvard	BRD-K24321898			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21+/m0/s1	QOPMKJNNAFOQDN-XGHQBKJUSA-N	526.251538196							96792
MLS003130355	LSM-8116	BRD-K02811477	44484511	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26+/m0/s1	OIASBGFOQSUHIL-AOJNWGRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K02811477	BRD-K02811477-001-02-3	Broad Institute of MIT and Harvard	BRD-K02811477			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26+/m0/s1	OIASBGFOQSUHIL-AOJNWGRGSA-N	541.337652926							96737
BRD-K57250790	LSM-8284		44493078	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28-/m0/s1	CUSMSBFNEHNGNQ-LXWOLXCRSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K57250790	BRD-K57250790-001-01-0	Broad Institute of MIT and Harvard	BRD-K57250790			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28-/m0/s1	CUSMSBFNEHNGNQ-LXWOLXCRSA-N	521.300204778							96905
BRD-K61998715	LSM-8301		44505262	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18+,22-/m0/s1	QZCZRKJJOTUXQW-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K61998715	BRD-K61998715-001-01-0	Broad Institute of MIT and Harvard	BRD-K61998715			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18+,22-/m0/s1	QZCZRKJJOTUXQW-SVMVAKDDSA-N	497.261374598							96922
BRD-K03354008	LSM-8119		44506060	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18+,22-/m0/s1	GQDZDOSXBZGUQJ-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K03354008	BRD-K03354008-001-01-3	Broad Institute of MIT and Harvard	BRD-K03354008			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18+,22-/m0/s1	GQDZDOSXBZGUQJ-SVMVAKDDSA-N	445.26890465							96740
BRD-K45630356	LSM-8245		44490306	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18-,23-/m0/s1	ZLSVBQPGKZIPOU-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K45630356	BRD-K45630356-001-01-4	Broad Institute of MIT and Harvard	BRD-K45630356			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18-,23-/m0/s1	ZLSVBQPGKZIPOU-BSRJHKFKSA-N	473.26381927							96866
MLS003129158	LSM-8208	BRD-K34966059	44504930	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17+,21+/m1/s1	HYLLQKBLPQWSSO-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K34966059	BRD-K34966059-001-02-3	Broad Institute of MIT and Harvard	BRD-K34966059			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)8-5-9-27-12-19(24-25-27)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10,12,16-17,21,29H,5,8-9,11,13-15H2,1-3H3/t16-,17+,21+/m1/s1	HYLLQKBLPQWSSO-WWMYMODYSA-N	497.210818064							96829
CHEMBL2355312	LSM-8195	BRD-K32854531, SID85813172	44506067	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18+,22-/m1/s1	DXNYPMFBKGSJNE-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K32854531	BRD-K32854531-001-01-3	Broad Institute of MIT and Harvard	BRD-K32854531			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18+,22-/m1/s1	DXNYPMFBKGSJNE-KGVIQGDOSA-N	497.261374598							96816
BRD-K60047946	LSM-8289		44505060	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28-/m1/s1	WVGLRASGSLBUCZ-MVOZIGHISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K60047946	BRD-K60047946-001-01-8	Broad Institute of MIT and Harvard	BRD-K60047946			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28-/m1/s1	WVGLRASGSLBUCZ-MVOZIGHISA-N	521.300204778							96910
MLS003129707	LSM-8192	BRD-K31147195, SID99358153	44505834	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15+,19+/m0/s1	RMZGJSLXUIRDMP-QMTMVMCOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K31147195	BRD-K31147195-001-02-8	Broad Institute of MIT and Harvard	BRD-K31147195			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cnnn2CCCC1=O	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15+,19+/m0/s1	RMZGJSLXUIRDMP-QMTMVMCOSA-N	477.26996729							96813
BRD-K16120913	LSM-8152		44485757	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17+,22-/m1/s1	DEGZSTUNWMGQCY-HYFFOGBASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K16120913	BRD-K16120913-001-01-7	Broad Institute of MIT and Harvard	BRD-K16120913			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17+,22-/m1/s1	DEGZSTUNWMGQCY-HYFFOGBASA-N	502.253982868							96773
BRD-K54628954	LSM-8276		44488703	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20-,25-/m0/s1	XVJRXGRWNAMAGP-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K54628954	BRD-K54628954-001-01-2	Broad Institute of MIT and Harvard	BRD-K54628954			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H36N6O4/c1-19-14-33(20(2)17-34)26(35)12-7-13-32-15-22(29-30-32)18-37-25(19)16-31(3)27(36)28-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,34H,7,12-14,16-18H2,1-3H3,(H,28,36)/t19-,20-,25-/m0/s1	XVJRXGRWNAMAGP-RLSLOFABSA-N	508.279803692							96897
BRD-K44746563	LSM-8242		44505605	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21-/m0/s1	DVUZCPZOEGBIKA-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K44746563	BRD-K44746563-001-01-8	Broad Institute of MIT and Harvard	BRD-K44746563			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21-/m0/s1	DVUZCPZOEGBIKA-FIKGOQFSSA-N	526.251538196							96863
MLS003129524	LSM-8221	BRD-K38706806	44505997	InChI=1S/C23H39N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h12,17-19,21,29H,4-11,13-16H2,1-3H3/t17-,18+,21-/m0/s1	UQDZIKNGRITESQ-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K38706806	BRD-K38706806-001-02-5	Broad Institute of MIT and Harvard	BRD-K38706806			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H39N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h12,17-19,21,29H,4-11,13-16H2,1-3H3/t17-,18+,21-/m0/s1	UQDZIKNGRITESQ-UEXGIBASSA-N	449.300204778							96842
BRD-K02563170	LSM-8114		44506052	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28+/m1/s1	PZMMCWSZGDQDET-IWHLBADBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K02563170	BRD-K02563170-001-01-2	Broad Institute of MIT and Harvard	BRD-K02563170			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28+/m1/s1	PZMMCWSZGDQDET-IWHLBADBSA-N	505.305290158							96735
BRD-K26682747	LSM-8180		44505859	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18+,23-/m0/s1	BKRQCUCZQROLSQ-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K26682747	BRD-K26682747-001-01-6	Broad Institute of MIT and Harvard	BRD-K26682747			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18+,23-/m0/s1	BKRQCUCZQROLSQ-IXFSTUDKSA-N	516.269632932							96801
MLS003129586	LSM-8261	BRD-K50325214	44505958	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)9-6-10-28-18(11-24-25-28)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,11,16-17,20,29H,6,9-10,12-15H2,1-3H3/t16-,17+,20+/m0/s1	MFABSAUNVKQXNQ-SQGPQFPESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K50325214	BRD-K50325214-001-02-3	Broad Institute of MIT and Harvard	BRD-K50325214			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)9-6-10-28-18(11-24-25-28)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,11,16-17,20,29H,6,9-10,12-15H2,1-3H3/t16-,17+,20+/m0/s1	MFABSAUNVKQXNQ-SQGPQFPESA-N	497.210818064							96882
BRD-K41779994	LSM-8233		44496822	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)10-7-11-27-13-19(24-25-27)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-4H3/t17-,18+,21-/m0/s1	WYMIJPVEWZCEGL-UEXGIBASSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K41779994	BRD-K41779994-001-01-1	Broad Institute of MIT and Harvard	BRD-K41779994			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)10-7-11-27-13-19(24-25-27)16-34-21(17)14-26(3)35(31,32)22-9-6-5-8-20(22)33-4/h5-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-4H3/t17-,18+,21-/m0/s1	WYMIJPVEWZCEGL-UEXGIBASSA-N	509.23080458							96854
BRD-K42790744	LSM-8235		44498559	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20-,23-/m1/s1	XSAFYGBYABXFOO-TXTKFYIRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K42790744	BRD-K42790744-001-01-0	Broad Institute of MIT and Harvard	BRD-K42790744			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20-,23-/m1/s1	XSAFYGBYABXFOO-TXTKFYIRSA-N	443.289640094							96856
BRD-K51106827	LSM-8265		44505659	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20+,23-/m1/s1	XSAFYGBYABXFOO-ZRCGQRJVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K51106827	BRD-K51106827-001-01-7	Broad Institute of MIT and Harvard	BRD-K51106827			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20+,23-/m1/s1	XSAFYGBYABXFOO-ZRCGQRJVSA-N	443.289640094							96886
BRD-K72801689	LSM-8349		44491456	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)9-6-10-29-12-18(26-27-29)15-34-21(16)13-28(3)23(33)25-20-8-5-4-7-19(20)24/h4-5,7-8,12,16-17,21,31H,6,9-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21-/m0/s1	UGDLKAPALXLDHQ-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K72801689	BRD-K72801689-001-01-5	Broad Institute of MIT and Harvard	BRD-K72801689			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)9-6-10-29-12-18(26-27-29)15-34-21(16)13-28(3)23(33)25-20-8-5-4-7-19(20)24/h4-5,7-8,12,16-17,21,31H,6,9-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21-/m0/s1	UGDLKAPALXLDHQ-FIKGOQFSSA-N	476.254731796							96970
BRD-K40750649	LSM-8230		44488168	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20+,25+/m1/s1	VRVGAAPGNIASDT-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K40750649	BRD-K40750649-001-01-2	Broad Institute of MIT and Harvard	BRD-K40750649			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H40N6O4/c1-19-13-32(20(2)17-33)26(34)6-5-9-31-15-22(27-28-31)18-36-25(19)16-29(3)14-21-7-8-23-24(12-21)35-11-10-30(23)4/h7-8,12,15,19-20,25,33H,5-6,9-11,13-14,16-18H2,1-4H3/t19-,20+,25+/m1/s1	VRVGAAPGNIASDT-RNHFSVANSA-N	500.31110382							96851
BRD-K09253654	LSM-8134		44483914	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19+,22-/m0/s1	AIVZVDBTBOXKNA-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K09253654	BRD-K09253654-001-01-8	Broad Institute of MIT and Harvard	BRD-K09253654			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19+,22-/m0/s1	AIVZVDBTBOXKNA-JQVVWYNYSA-N	429.27399003							96755
MLS003129199	LSM-8175	BRD-K25660189, SID99357410	44505183	InChI=1S/C23H33N5O5/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-19(12-24-25-28)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18+,21+/m1/s1	VVYGNONDBDDRFX-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K25660189	BRD-K25660189-001-02-6	Broad Institute of MIT and Harvard	BRD-K25660189			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33N5O5/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-19(12-24-25-28)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18+,21+/m1/s1	VVYGNONDBDDRFX-LQWHRVPQSA-N	459.248169206							96796
BRD-K71625503	LSM-8345		44505643	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)9-6-10-29-22(17-32-23)12-25-26-29/h5,7-8,11-12,19-20,23,30H,6,9-10,13-17H2,1-4H3/t19-,20+,23-/m1/s1	JFBDPIUUNLHCPK-ZRCGQRJVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(C)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K71625503	BRD-K71625503-001-01-3	Broad Institute of MIT and Harvard	BRD-K71625503			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(C)c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)9-6-10-29-22(17-32-23)12-25-26-29/h5,7-8,11-12,19-20,23,30H,6,9-10,13-17H2,1-4H3/t19-,20+,23-/m1/s1	JFBDPIUUNLHCPK-ZRCGQRJVSA-N	443.289640094							96966
MLS003129612	LSM-8106	BRD-K01594666, SID99358022	44505773	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	SUQKGVARFDJMIR-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K01594666	BRD-K01594666-001-02-7	Broad Institute of MIT and Harvard	BRD-K01594666			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)12-7-13-31-15-22(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,15,19-20,25,33H,7,12-14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	SUQKGVARFDJMIR-FHAGJXEFSA-N	509.26381927							96727
BRD-K24075340	LSM-8170		44505809	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21-/m0/s1	HYHIJLYQTCYSKX-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K24075340	BRD-K24075340-001-01-6	Broad Institute of MIT and Harvard	BRD-K24075340			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21-/m0/s1	HYHIJLYQTCYSKX-UEXGIBASSA-N	458.264153628							96791
BRD-K37081092	LSM-8216		44495966	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18+,21+/m0/s1	QXBLKCOAOVMUQM-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K37081092	BRD-K37081092-001-01-9	Broad Institute of MIT and Harvard	BRD-K37081092			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18+,21+/m0/s1	QXBLKCOAOVMUQM-WAOWUJCRSA-N	430.269239008							96837
BRD-K64825005	LSM-8315		44506091	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19+,23-/m1/s1	RQWMQWHENJCHFR-SELNLUPBSA-N	COc1cccc(CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)c1	BroadT	BRD-K64825005	BRD-K64825005-001-01-1	Broad Institute of MIT and Harvard	BRD-K64825005			COc1cccc(CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)c1	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19+,23-/m1/s1	RQWMQWHENJCHFR-SELNLUPBSA-N	459.284554714							96936
BRD-K80564983	LSM-8372		44505413	InChI=1S/C22H38N6O4/c1-16-11-28(17(2)14-29)21(30)9-6-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)23-18-7-4-5-8-18/h12,16-18,20,29H,4-11,13-15H2,1-3H3,(H,23,31)/t16-,17+,20-/m1/s1	NHKODMKPZBXGEI-FUHIMQAGSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K80564983	BRD-K80564983-001-01-2	Broad Institute of MIT and Harvard	BRD-K80564983			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H38N6O4/c1-16-11-28(17(2)14-29)21(30)9-6-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)23-18-7-4-5-8-18/h12,16-18,20,29H,4-11,13-15H2,1-3H3,(H,23,31)/t16-,17+,20-/m1/s1	NHKODMKPZBXGEI-FUHIMQAGSA-N	450.295453756							96993
MLS003130236	LSM-8145	BRD-K14989228, SID121282582	44505113	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22+/m1/s1	DGDOMSZWPVXBGZ-KNKQGSTJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K14989228	BRD-K14989228-001-02-5	Broad Institute of MIT and Harvard	BRD-K14989228			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22+/m1/s1	DGDOMSZWPVXBGZ-KNKQGSTJSA-N	493.23588996							96766
BRD-K53193506	LSM-8270		44505905	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18+,22+/m1/s1	ZTOSEQHRKGCZOZ-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K53193506	BRD-K53193506-001-01-1	Broad Institute of MIT and Harvard	BRD-K53193506			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18+,22+/m1/s1	ZTOSEQHRKGCZOZ-FGSXEWAUSA-N	497.261374598							96891
BRD-K01795516	LSM-8107		44505039	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22-/m0/s1	HYDPWGICXZADLJ-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K01795516	BRD-K01795516-001-01-4	Broad Institute of MIT and Harvard	BRD-K01795516			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22-/m0/s1	HYDPWGICXZADLJ-SPEDKVCISA-N	445.26890465							96728
BRD-K54455139	LSM-8274		44486371	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20-,24-/m0/s1	ATOJIXFYNQCGDG-SKPFHBQLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K54455139	BRD-K54455139-001-01-8	Broad Institute of MIT and Harvard	BRD-K54455139			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20-,24-/m0/s1	ATOJIXFYNQCGDG-SKPFHBQLSA-N	501.295119398							96895
MLS003129482	LSM-8212	BRD-K36674158, SID99357817	44504971	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26-/m1/s1	MSGDIDWYZNYHQU-TVZXLZGTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K36674158	BRD-K36674158-001-02-1	Broad Institute of MIT and Harvard	BRD-K36674158			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26-/m1/s1	MSGDIDWYZNYHQU-TVZXLZGTSA-N	541.337652926							96833
BRD-K69158405	LSM-8334		44505258	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18-,22-/m0/s1	ZTOSEQHRKGCZOZ-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K69158405	BRD-K69158405-001-01-8	Broad Institute of MIT and Harvard	BRD-K69158405			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18-,22-/m0/s1	ZTOSEQHRKGCZOZ-SPEDKVCISA-N	497.261374598							96955
MLS003129629	LSM-8185	BRD-K28055782, SID99358038	44505394	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26-/m0/s1	MSGDIDWYZNYHQU-VRUMLPLGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K28055782	BRD-K28055782-001-02-7	Broad Institute of MIT and Harvard	BRD-K28055782			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22+,26-/m0/s1	MSGDIDWYZNYHQU-VRUMLPLGSA-N	541.337652926							96806
BRD-K61485275	LSM-8296		44485079	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	PJEXWGOYWCOKCP-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K61485275	BRD-K61485275-001-01-0	Broad Institute of MIT and Harvard	BRD-K61485275			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3cccnc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O3/c1-19-13-32(20(2)17-33)26(34)7-5-11-31-15-23(28-29-31)18-35-25(19)16-30(3)14-21-8-9-22-6-4-10-27-24(22)12-21/h4,6,8-10,12,15,19-20,25,33H,5,7,11,13-14,16-18H2,1-3H3/t19-,20-,25+/m1/s1	PJEXWGOYWCOKCP-FHAGJXEFSA-N	480.284889072							96917
MLS003130254	LSM-8405	BRD-K91743203, SID99359043	44505725	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)6-5-11-28-20(16-33-22)12-24-25-28/h7-10,12,18-19,22,29H,5-6,11,13-16H2,1-4H3/t18-,19+,22+/m1/s1	PBQVTRJHSYIUGU-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K91743203	BRD-K91743203-001-02-1	Broad Institute of MIT and Harvard	BRD-K91743203			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)6-5-11-28-20(16-33-22)12-24-25-28/h7-10,12,18-19,22,29H,5-6,11,13-16H2,1-4H3/t18-,19+,22+/m1/s1	PBQVTRJHSYIUGU-DXIQSLLYSA-N	493.23588996							97026
BRD-K94817443	LSM-8411		44486973	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16-/m0/s1	WAHUPRWPWKVPJH-DZKIICNBSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K94817443	BRD-K94817443-001-01-2	Broad Institute of MIT and Harvard	BRD-K94817443			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16-/m0/s1	WAHUPRWPWKVPJH-DZKIICNBSA-N	353.242689902							97032
BRD-K23001296	LSM-8169		44505871	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18-,21-/m1/s1	BVMGYWBUQYFDAA-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K23001296	BRD-K23001296-001-01-7	Broad Institute of MIT and Harvard	BRD-K23001296			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18-,21-/m1/s1	BVMGYWBUQYFDAA-DBXWQHBBSA-N	430.269239008							96790
MLS003129157	LSM-8105	BRD-K00977230, SID99357495	44504982	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26-/m0/s1	MSGDIDWYZNYHQU-MCEYFSPLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K00977230	BRD-K00977230-001-02-2	Broad Institute of MIT and Harvard	BRD-K00977230			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26-/m0/s1	MSGDIDWYZNYHQU-MCEYFSPLSA-N	541.337652926							96726
BRD-K71283713	LSM-8343		44491459	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19+,22+/m0/s1	AIVZVDBTBOXKNA-NNMXDRDESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K71283713	BRD-K71283713-001-01-7	Broad Institute of MIT and Harvard	BRD-K71283713			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19+,22+/m0/s1	AIVZVDBTBOXKNA-NNMXDRDESA-N	429.27399003							96964
MLS003129438	LSM-8158	BRD-K19526326	44505800	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)5-4-10-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-8-6-18(24)7-9-19/h6-9,12,16-17,21,31H,4-5,10-11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21+/m1/s1	IBNJZESYQXVKKB-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K19526326	BRD-K19526326-001-02-1	Broad Institute of MIT and Harvard	BRD-K19526326			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)5-4-10-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-8-6-18(24)7-9-19/h6-9,12,16-17,21,31H,4-5,10-11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21+/m1/s1	IBNJZESYQXVKKB-WWMYMODYSA-N	476.254731796							96779
SCHEMBL17487100	LSM-8177	BRD-K26087938	44504985	InChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	AHKBAATWJXKTGZ-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K26087938	BRD-K26087938-001-01-7	Broad Institute of MIT and Harvard	BRD-K26087938			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	AHKBAATWJXKTGZ-WFXMLNOXSA-N	449.300204778							96798
BRD-K36959991	LSM-8215		44498557	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)9-6-10-29-22(17-32-23)12-25-26-29/h5,7-8,11-12,19-20,23,30H,6,9-10,13-17H2,1-4H3/t19-,20-,23-/m1/s1	JFBDPIUUNLHCPK-TXTKFYIRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(C)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K36959991	BRD-K36959991-001-01-9	Broad Institute of MIT and Harvard	BRD-K36959991			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(C)c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)9-6-10-29-22(17-32-23)12-25-26-29/h5,7-8,11-12,19-20,23,30H,6,9-10,13-17H2,1-4H3/t19-,20-,23-/m1/s1	JFBDPIUUNLHCPK-TXTKFYIRSA-N	443.289640094							96836
BRD-K12440008	LSM-8142		44505594	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)5-4-10-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-8-6-18(24)7-9-19/h6-9,12,16-17,21,31H,4-5,10-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21-/m1/s1	IBNJZESYQXVKKB-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K12440008	BRD-K12440008-001-01-9	Broad Institute of MIT and Harvard	BRD-K12440008			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)5-4-10-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-8-6-18(24)7-9-19/h6-9,12,16-17,21,31H,4-5,10-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21-/m1/s1	IBNJZESYQXVKKB-CBGDNZLLSA-N	476.254731796							96763
BRD-K48241951	LSM-8254		44491463	InChI=1S/C17H31N5O3/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-25-16(13)10-20(3)4/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16-/m1/s1	PFQPPSPXSKCUPO-IIAWOOMASA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K48241951	BRD-K48241951-001-01-6	Broad Institute of MIT and Harvard	BRD-K48241951			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O3/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-25-16(13)10-20(3)4/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16-/m1/s1	PFQPPSPXSKCUPO-IIAWOOMASA-N	353.242689902							96875
MLS003129459	LSM-8391	BRD-K86770334	44505325	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22+/m1/s1	DGDOMSZWPVXBGZ-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K86770334	BRD-K86770334-001-02-3	Broad Institute of MIT and Harvard	BRD-K86770334			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22+/m1/s1	DGDOMSZWPVXBGZ-DXIQSLLYSA-N	493.23588996							97012
MLS003129213	LSM-8118	BRD-K03321770	44504989	InChI=1S/C23H33N5O5/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-19(24-25-27)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21+/m0/s1	NWYXEXAEFWIOJN-BBTUJRGHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K03321770	BRD-K03321770-001-02-6	Broad Institute of MIT and Harvard	BRD-K03321770			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33N5O5/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-19(24-25-27)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21+/m0/s1	NWYXEXAEFWIOJN-BBTUJRGHSA-N	459.248169206							96739
BRD-K56987347	LSM-8283		44505070	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)6-5-11-29-22(17-32-23)12-25-26-29/h7-10,12,19-20,23,30H,5-6,11,13-17H2,1-4H3/t19-,20-,23-/m0/s1	WGPDLCVCGOLGPE-JTAQYXEDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K56987347	BRD-K56987347-001-01-6	Broad Institute of MIT and Harvard	BRD-K56987347			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)6-5-11-29-22(17-32-23)12-25-26-29/h7-10,12,19-20,23,30H,5-6,11,13-17H2,1-4H3/t19-,20-,23-/m0/s1	WGPDLCVCGOLGPE-JTAQYXEDSA-N	443.289640094							96904
MLS003129450	LSM-8365	BRD-K78395012	44505978	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,20+/m1/s1	NSEOCVGIAYKUAZ-UWVAXJGDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K78395012	BRD-K78395012-001-02-8	Broad Institute of MIT and Harvard	BRD-K78395012			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,20+/m1/s1	NSEOCVGIAYKUAZ-UWVAXJGDSA-N	444.248503564							96986
MLS003130250	LSM-8201	BRD-K33760789, SID99359040	44505336	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18-,22-/m0/s1	QVFRXOMYJDWMPT-SPEDKVCISA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K33760789	BRD-K33760789-001-02-8	Broad Institute of MIT and Harvard	BRD-K33760789			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18-,22-/m0/s1	QVFRXOMYJDWMPT-SPEDKVCISA-N	509.23080458							96822
BRD-K79876173	LSM-8370		44486972	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17-,22+/m0/s1	ATJIIPBEGAKQFE-PNLZDCPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K79876173	BRD-K79876173-001-01-3	Broad Institute of MIT and Harvard	BRD-K79876173			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17-,22+/m0/s1	ATJIIPBEGAKQFE-PNLZDCPESA-N	497.196045386							96991
MLS003129390	LSM-8153	BRD-K16769896, SID99357693	44504984	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26-/m1/s1	MSGDIDWYZNYHQU-XLGIIRLISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K16769896	BRD-K16769896-001-02-0	Broad Institute of MIT and Harvard	BRD-K16769896			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)6-5-11-35-25(16-29-30-35)20-39-26(21)18-32(4)28(38)23-7-9-24(10-8-23)33-14-12-31(3)13-15-33/h7-10,16,21-22,26,36H,5-6,11-15,17-20H2,1-4H3/t21-,22-,26-/m1/s1	MSGDIDWYZNYHQU-XLGIIRLISA-N	541.337652926							96774
BRD-K21363211	LSM-8163		44506096	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13-,15-/m1/s1	FOLOUAULJSJVDY-UMVBOHGHSA-N	CNC[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K21363211	BRD-K21363211-001-01-5	Broad Institute of MIT and Harvard	BRD-K21363211			CNC[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13-,15-/m1/s1	FOLOUAULJSJVDY-UMVBOHGHSA-N	339.227039838							96784
BRD-K83829186	LSM-8381		44495971	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18-,22-/m0/s1	DMKVVNQLOZTLAB-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K83829186	BRD-K83829186-001-01-1	Broad Institute of MIT and Harvard	BRD-K83829186			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18-,22-/m0/s1	DMKVVNQLOZTLAB-SPEDKVCISA-N	497.261374598							97002
BRD-K50510764	LSM-8262		44506066	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22-/m0/s1	KWAFQNIHTBJTFB-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K50510764	BRD-K50510764-001-01-6	Broad Institute of MIT and Harvard	BRD-K50510764			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22-/m0/s1	KWAFQNIHTBJTFB-SPEDKVCISA-N	497.261374598							96883
BRD-K02291788	LSM-8112		44492057	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22-,26-/m1/s1	HFDOIJULVRDPRU-XLGIIRLISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K02291788	BRD-K02291788-001-01-4	Broad Institute of MIT and Harvard	BRD-K02291788			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22-,26-/m1/s1	HFDOIJULVRDPRU-XLGIIRLISA-N	541.337652926							96733
BRD-K46033477	LSM-8248		44504935	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22-/m0/s1	AWVASGRLDZTAAI-SPEDKVCISA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K46033477	BRD-K46033477-001-01-4	Broad Institute of MIT and Harvard	BRD-K46033477			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22-/m0/s1	AWVASGRLDZTAAI-SPEDKVCISA-N	509.23080458							96869
MLS003129637	LSM-8312	BRD-K64560329	44505623	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15+,19+/m1/s1	RMZGJSLXUIRDMP-VCBZYWHSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3cnnn3CCCC1=O	BroadT	BRD-K64560329	BRD-K64560329-001-02-1	Broad Institute of MIT and Harvard	BRD-K64560329			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cnnn2CCCC1=O	InChI=1S/C22H35N7O5/c1-14-10-28(15(2)12-30)20(31)7-6-8-29-18(9-23-26-29)13-33-19(14)11-27(5)22(32)24-21-16(3)25-34-17(21)4/h9,14-15,19,30H,6-8,10-13H2,1-5H3,(H,24,32)/t14-,15+,19+/m1/s1	RMZGJSLXUIRDMP-VCBZYWHSSA-N	477.26996729							96933
BRD-K72915114	LSM-8350		44505879	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18-,21+/m0/s1	BVMGYWBUQYFDAA-BBTUJRGHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K72915114	BRD-K72915114-001-01-8	Broad Institute of MIT and Harvard	BRD-K72915114			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18-,21+/m0/s1	BVMGYWBUQYFDAA-BBTUJRGHSA-N	430.269239008							96971
BRD-K81778946	LSM-8376		44496827	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20+,25-/m0/s1	PZGTZQIYRXDXGV-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K81778946	BRD-K81778946-001-01-3	Broad Institute of MIT and Harvard	BRD-K81778946			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20+,25-/m0/s1	PZGTZQIYRXDXGV-DFIYOIEZSA-N	509.26381927							96997
BRD-K02063190	LSM-8110		44493065	InChI=1S/C28H37N5O6S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-23(29-30-32)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22-,27-/m0/s1	SYWTUHWEQAODFK-BERHBOFZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K02063190	BRD-K02063190-001-01-9	Broad Institute of MIT and Harvard	BRD-K02063190			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N5O6S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-23(29-30-32)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22-,27-/m0/s1	SYWTUHWEQAODFK-BERHBOFZSA-N	571.246454644							96731
BRD-K87438596	LSM-8395		44488165	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18+,23-/m0/s1	ZLSVBQPGKZIPOU-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K87438596	BRD-K87438596-001-01-1	Broad Institute of MIT and Harvard	BRD-K87438596			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18+,23-/m0/s1	ZLSVBQPGKZIPOU-IXFSTUDKSA-N	473.26381927							97016
BRD-K85736239	LSM-8386		44483908	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15+,17-/m0/s1	CMMUKIKJYLMGMW-UXLLHSPISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K85736239	BRD-K85736239-001-01-3	Broad Institute of MIT and Harvard	BRD-K85736239			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15+,17-/m0/s1	CMMUKIKJYLMGMW-UXLLHSPISA-N	463.240639154							97007
MLS003129552	LSM-8256	BRD-K48336086, SID99357927	44504950	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16+/m1/s1	KPZGSTQZFNZEDR-YCPHGPKFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K48336086	BRD-K48336086-001-02-0	Broad Institute of MIT and Harvard	BRD-K48336086			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O5S/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-27-16(13)10-20(3)28(4,25)26/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16+/m1/s1	KPZGSTQZFNZEDR-YCPHGPKFSA-N	417.204589832							96877
MLS003130253	LSM-8149	BRD-K15713104	44505833	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m1/s1	QOPMKJNNAFOQDN-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K15713104	BRD-K15713104-001-02-7	Broad Institute of MIT and Harvard	BRD-K15713104			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m1/s1	QOPMKJNNAFOQDN-WWMYMODYSA-N	526.251538196							96770
MLS003129119	LSM-8354	BRD-K75090853	44505965	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17-,20+/m0/s1	JYOVEVCXPRGJRX-ABSDTBQOSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K75090853	BRD-K75090853-001-02-0	Broad Institute of MIT and Harvard	BRD-K75090853			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32FN5O5S/c1-16-11-28(17(2)14-29)22(30)9-6-10-27-12-18(24-25-27)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,12,16-17,20,29H,6,9-11,13-15H2,1-3H3/t16-,17-,20+/m0/s1	JYOVEVCXPRGJRX-ABSDTBQOSA-N	497.210818064							96975
MLS003129577	LSM-8228	BRD-K40294449	44505602	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21+/m1/s1	APDMZOWNVCUUKT-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K40294449	BRD-K40294449-001-02-1	Broad Institute of MIT and Harvard	BRD-K40294449			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21+/m1/s1	APDMZOWNVCUUKT-LQWHRVPQSA-N	464.31110382							96849
BRD-K65147077	LSM-8317		44485080	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16+/m1/s1	WAHUPRWPWKVPJH-FMKPAKJESA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K65147077	BRD-K65147077-001-01-2	Broad Institute of MIT and Harvard	BRD-K65147077			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O3/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-25-16(13)10-20(3)4/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16+/m1/s1	WAHUPRWPWKVPJH-FMKPAKJESA-N	353.242689902							96938
MLS003129493	LSM-8117	BRD-K03155021, SID99357826	44505339	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22+/m0/s1	AWVASGRLDZTAAI-NJNPRVFISA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K03155021	BRD-K03155021-001-02-5	Broad Institute of MIT and Harvard	BRD-K03155021			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22+/m0/s1	AWVASGRLDZTAAI-NJNPRVFISA-N	509.23080458							96738
BRD-K70905242	LSM-8341		44494487	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18+,22-/m0/s1	QPXXSBPXMIWUTR-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K70905242	BRD-K70905242-001-01-6	Broad Institute of MIT and Harvard	BRD-K70905242			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)5-4-10-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-8-21(30)9-7-19/h6-9,11,17-18,22,29-30H,4-5,10,12-16H2,1-3H3/t17-,18+,22-/m0/s1	QPXXSBPXMIWUTR-SVMVAKDDSA-N	445.26890465							96962
BRD-K37526858	LSM-8217		44506084	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28-/m1/s1	WVGLRASGSLBUCZ-AWVRMFGXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K37526858	BRD-K37526858-001-01-7	Broad Institute of MIT and Harvard	BRD-K37526858			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28-/m1/s1	WVGLRASGSLBUCZ-AWVRMFGXSA-N	521.300204778							96838
BRD-K46322935	LSM-8249		44505634	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19+,22+/m0/s1	ZIMKOTFORJXDIC-NNMXDRDESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K46322935	BRD-K46322935-001-01-7	Broad Institute of MIT and Harvard	BRD-K46322935			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19+,22+/m0/s1	ZIMKOTFORJXDIC-NNMXDRDESA-N	435.320940222							96870
BRD-K04465546	LSM-8121		44505642	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28-/m0/s1	YAZCQYURBLEIHO-JWZKTCGFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K04465546	BRD-K04465546-001-01-5	Broad Institute of MIT and Harvard	BRD-K04465546			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28-/m0/s1	YAZCQYURBLEIHO-JWZKTCGFSA-N	505.305290158							96742
SCHEMBL17487106	LSM-8243	BRD-K44843438	44485750	InChI=1S/C24H35N5O5/c1-18-12-29(19(2)15-30)23(31)10-7-11-28-13-21(25-26-28)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m0/s1	STPKXVJXGDPGFM-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)OCc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K44843438	BRD-K44843438-001-01-6	Broad Institute of MIT and Harvard	BRD-K44843438			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)OCc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-18-12-29(19(2)15-30)23(31)10-7-11-28-13-21(25-26-28)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m0/s1	STPKXVJXGDPGFM-IPJJNNNSSA-N	473.26381927							96864
MLS003129908	LSM-8355	BRD-K75152103, SID99358402	44505935	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18-,22-/m1/s1	QVFRXOMYJDWMPT-JBYIUTFZSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K75152103	BRD-K75152103-001-02-6	Broad Institute of MIT and Harvard	BRD-K75152103			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18-,22-/m1/s1	QVFRXOMYJDWMPT-JBYIUTFZSA-N	509.23080458							96976
MLS003129334	LSM-8138	BRD-K10232830	44504931	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18+,22+/m1/s1	QVFRXOMYJDWMPT-FGSXEWAUSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K10232830	BRD-K10232830-001-02-4	Broad Institute of MIT and Harvard	BRD-K10232830			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18+,22+/m1/s1	QVFRXOMYJDWMPT-FGSXEWAUSA-N	509.23080458							96759
BRD-K60734771	LSM-8292		44505810	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21-/m1/s1	DVUZCPZOEGBIKA-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K60734771	BRD-K60734771-001-01-1	Broad Institute of MIT and Harvard	BRD-K60734771			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21-/m1/s1	DVUZCPZOEGBIKA-CBGDNZLLSA-N	526.251538196							96913
MLS003129695	LSM-8264	BRD-K51106788	44497251	InChI=1S/C23H33N5O5/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-19(24-25-27)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21+/m1/s1	NWYXEXAEFWIOJN-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K51106788	BRD-K51106788-001-02-2	Broad Institute of MIT and Harvard	BRD-K51106788			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33N5O5/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-19(24-25-27)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21+/m1/s1	NWYXEXAEFWIOJN-OPYAIIAOSA-N	459.248169206							96885
MLS003129647	LSM-8137	BRD-K09615275	44491455	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)9-6-10-29-12-18(26-27-29)15-34-21(16)13-28(3)23(33)25-20-8-5-4-7-19(20)24/h4-5,7-8,12,16-17,21,31H,6,9-11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21+/m1/s1	UGDLKAPALXLDHQ-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K09615275	BRD-K09615275-001-02-5	Broad Institute of MIT and Harvard	BRD-K09615275			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)9-6-10-29-12-18(26-27-29)15-34-21(16)13-28(3)23(33)25-20-8-5-4-7-19(20)24/h4-5,7-8,12,16-17,21,31H,6,9-11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21+/m1/s1	UGDLKAPALXLDHQ-WWMYMODYSA-N	476.254731796							96758
MLS003129656	LSM-8383	BRD-K84505894	44485065	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22+/m1/s1	VOGIWUFDXLFNKS-KNKQGSTJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K84505894	BRD-K84505894-001-02-7	Broad Institute of MIT and Harvard	BRD-K84505894			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22+/m1/s1	VOGIWUFDXLFNKS-KNKQGSTJSA-N	473.26381927							97004
MLS003129216	LSM-8278	BRD-K55910052, SID99357422	44504920	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22+/m0/s1	DGDOMSZWPVXBGZ-CNNODRBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K55910052	BRD-K55910052-001-02-2	Broad Institute of MIT and Harvard	BRD-K55910052			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22+/m0/s1	DGDOMSZWPVXBGZ-CNNODRBYSA-N	493.23588996							96899
BRD-K78513625	LSM-8366		44505550	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22-/m1/s1	IKCPXJXAZOQLMC-KGVIQGDOSA-N	COc1ccc(OC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)cc1	BroadT	BRD-K78513625	BRD-K78513625-001-01-7	Broad Institute of MIT and Harvard	BRD-K78513625			COc1ccc(OC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)cc1	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22-/m1/s1	IKCPXJXAZOQLMC-KGVIQGDOSA-N	489.25873389							96987
BRD-K92841050	LSM-8408		44505028	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28-/m1/s1	YAZCQYURBLEIHO-AWVRMFGXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K92841050	BRD-K92841050-001-01-8	Broad Institute of MIT and Harvard	BRD-K92841050			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O3/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-27(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28-/m1/s1	YAZCQYURBLEIHO-AWVRMFGXSA-N	505.305290158							97029
MLS003129742	LSM-8287	BRD-K58310742, SID99358185	44505966	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22-/m1/s1	IZYFSJYDPLTURU-JBYIUTFZSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K58310742	BRD-K58310742-001-02-8	Broad Institute of MIT and Harvard	BRD-K58310742			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22-/m1/s1	IZYFSJYDPLTURU-JBYIUTFZSA-N	509.23080458							96908
MLS003129747	LSM-8113	BRD-K02419152	44505747	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,20+/m0/s1	NSEOCVGIAYKUAZ-SQGPQFPESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K02419152	BRD-K02419152-001-02-7	Broad Institute of MIT and Harvard	BRD-K02419152			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H32N6O4/c1-16-11-28(17(2)14-29)21(30)5-4-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,12,16-17,20,29H,4-5,10-11,13-15H2,1-3H3/t16-,17+,20+/m0/s1	NSEOCVGIAYKUAZ-SQGPQFPESA-N	444.248503564							96734
MLS003129384	LSM-8259	BRD-K49676673, SID99357687	44505428	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26+/m1/s1	WJAIMBKFVIKGAD-DRLORSAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K49676673	BRD-K49676673-001-02-7	Broad Institute of MIT and Harvard	BRD-K49676673			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26+/m1/s1	WJAIMBKFVIKGAD-DRLORSAXSA-N	541.337652926							96880
MLS003129519	LSM-8279	BRD-K56349799, SID99357901	44505555	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25-/m1/s1	WIMCLPXWPPGBKL-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K56349799	BRD-K56349799-001-02-0	Broad Institute of MIT and Harvard	BRD-K56349799			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25-/m1/s1	WIMCLPXWPPGBKL-OHUGHZGNSA-N	509.26381927							96900
MLS003129280	LSM-8182	BRD-K27117623, SID99357544	44505803	InChI=1S/C24H34N6O6/c1-16-11-29(17(2)13-31)23(32)5-4-8-30-19(10-25-27-30)14-34-22(16)12-28(3)24(33)26-18-6-7-20-21(9-18)36-15-35-20/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3,(H,26,33)/t16-,17+,22-/m1/s1	PARFVHOUOBIHJG-HYFFOGBASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K27117623	BRD-K27117623-001-02-9	Broad Institute of MIT and Harvard	BRD-K27117623			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H34N6O6/c1-16-11-29(17(2)13-31)23(32)5-4-8-30-19(10-25-27-30)14-34-22(16)12-28(3)24(33)26-18-6-7-20-21(9-18)36-15-35-20/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3,(H,26,33)/t16-,17+,22-/m1/s1	PARFVHOUOBIHJG-HYFFOGBASA-N	502.253982868							96803
MLS003129671	LSM-8223	BRD-K39299017	44488152	InChI=1S/C22H33N5O5S/c1-17-12-27(18(2)15-28)22(29)10-7-11-26-13-19(23-24-26)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,28H,7,10-12,14-16H2,1-3H3/t17-,18+,21+/m0/s1	BDEMCWTZQNVVEU-WAOWUJCRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K39299017	BRD-K39299017-001-02-5	Broad Institute of MIT and Harvard	BRD-K39299017			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H33N5O5S/c1-17-12-27(18(2)15-28)22(29)10-7-11-26-13-19(23-24-26)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,28H,7,10-12,14-16H2,1-3H3/t17-,18+,21+/m0/s1	BDEMCWTZQNVVEU-WAOWUJCRSA-N	479.220239896							96844
BRD-K14997413	LSM-8146		44494941	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28-/m1/s1	CUSMSBFNEHNGNQ-AWVRMFGXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K14997413	BRD-K14997413-001-01-5	Broad Institute of MIT and Harvard	BRD-K14997413			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28-/m1/s1	CUSMSBFNEHNGNQ-AWVRMFGXSA-N	521.300204778							96767
MLS003129145	LSM-8303	BRD-K62558637, SID99357485	44505627	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18-,23+/m0/s1	BKRQCUCZQROLSQ-IUKKYPGJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K62558637	BRD-K62558637-001-02-4	Broad Institute of MIT and Harvard	BRD-K62558637			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18-,23+/m0/s1	BKRQCUCZQROLSQ-IUKKYPGJSA-N	516.269632932							96924
BRD-K61553312	LSM-8297		44505436	InChI=1S/C25H38N6O6/c1-17-12-31(18(2)15-32)24(33)7-6-10-30-13-19(27-28-30)16-37-23(17)14-29(3)25(34)26-21-9-8-20(35-4)11-22(21)36-5/h8-9,11,13,17-18,23,32H,6-7,10,12,14-16H2,1-5H3,(H,26,34)/t17-,18+,23-/m0/s1	DZDKJIRUSJXCKT-IXFSTUDKSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)c(OC)c1	BroadT	BRD-K61553312	BRD-K61553312-001-01-0	Broad Institute of MIT and Harvard	BRD-K61553312			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)c(OC)c1	InChI=1S/C25H38N6O6/c1-17-12-31(18(2)15-32)24(33)7-6-10-30-13-19(27-28-30)16-37-23(17)14-29(3)25(34)26-21-9-8-20(35-4)11-22(21)36-5/h8-9,11,13,17-18,23,32H,6-7,10,12,14-16H2,1-5H3,(H,26,34)/t17-,18+,23-/m0/s1	DZDKJIRUSJXCKT-IXFSTUDKSA-N	518.285282996							96918
BRD-K34800739	LSM-8207		44505880	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18+,21-/m0/s1	BVMGYWBUQYFDAA-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K34800739	BRD-K34800739-001-01-4	Broad Institute of MIT and Harvard	BRD-K34800739			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18+,21-/m0/s1	BVMGYWBUQYFDAA-UEXGIBASSA-N	430.269239008							96828
BRD-K22177912	LSM-8165		44491464	InChI=1S/C17H31N5O3/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-25-16(13)10-20(3)4/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16-/m0/s1	PFQPPSPXSKCUPO-DZKIICNBSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K22177912	BRD-K22177912-001-01-0	Broad Institute of MIT and Harvard	BRD-K22177912			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O3/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-25-16(13)10-20(3)4/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14-,16-/m0/s1	PFQPPSPXSKCUPO-DZKIICNBSA-N	353.242689902							96786
MLS003129159	LSM-29042	BRD-K82120908	44505205	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21+/m1/s1	VTXUSJLMEZRIOV-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K82120908	BRD-K82120908-001-02-1	Broad Institute of MIT and Harvard	BRD-K82120908			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17+,21+/m1/s1	VTXUSJLMEZRIOV-WWMYMODYSA-N	476.254731796							117593
BRD-K21305828	LSM-8162		44505624	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17-,22-/m1/s1	FSJQCDSATLDVBC-DRSNIGMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K21305828	BRD-K21305828-001-01-1	Broad Institute of MIT and Harvard	BRD-K21305828			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17-,22-/m1/s1	FSJQCDSATLDVBC-DRSNIGMVSA-N	497.196045386							96783
MLS003129128	LSM-8339	BRD-K70274124, SID99357469	44505175	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21-/m1/s1	OOPGLCWBUZVAMU-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K70274124	BRD-K70274124-001-02-8	Broad Institute of MIT and Harvard	BRD-K70274124			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)5-4-10-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-8-6-18(23)7-9-20/h6-9,11,16-17,21,29H,4-5,10,12-15H2,1-3H3/t16-,17-,21-/m1/s1	OOPGLCWBUZVAMU-CBGDNZLLSA-N	497.210818064							96960
BRD-K42435091	LSM-8234		44489272	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19+,22-/m1/s1	AIVZVDBTBOXKNA-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K42435091	BRD-K42435091-001-01-1	Broad Institute of MIT and Harvard	BRD-K42435091			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19+,22-/m1/s1	AIVZVDBTBOXKNA-XQBPLPMBSA-N	429.27399003							96855
BRD-K88495921	LSM-8397		44486975	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20+,24-/m0/s1	ATOJIXFYNQCGDG-ROKPMTFOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K88495921	BRD-K88495921-001-01-6	Broad Institute of MIT and Harvard	BRD-K88495921			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20+,24-/m0/s1	ATOJIXFYNQCGDG-ROKPMTFOSA-N	501.295119398							97018
MLS003129239	LSM-8156	BRD-K18699770	44488153	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15+,17+/m0/s1	CMMUKIKJYLMGMW-ZMSDIMECSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K18699770	BRD-K18699770-001-02-8	Broad Institute of MIT and Harvard	BRD-K18699770			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15+,17+/m0/s1	CMMUKIKJYLMGMW-ZMSDIMECSA-N	463.240639154							96777
BRD-K82396235	LSM-8377		44505227	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)9-6-10-29-22(17-32-23)12-25-26-29/h5,7-8,11-12,19-20,23,30H,6,9-10,13-17H2,1-4H3/t19-,20-,23-/m0/s1	JFBDPIUUNLHCPK-JTAQYXEDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K82396235	BRD-K82396235-001-01-3	Broad Institute of MIT and Harvard	BRD-K82396235			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)9-6-10-29-22(17-32-23)12-25-26-29/h5,7-8,11-12,19-20,23,30H,6,9-10,13-17H2,1-4H3/t19-,20-,23-/m0/s1	JFBDPIUUNLHCPK-JTAQYXEDSA-N	443.289640094							96998
MLS003129917	LSM-8109	BRD-K01916633, SID99358410	44505404	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20+,25-/m1/s1	PZGTZQIYRXDXGV-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K01916633	BRD-K01916633-001-02-2	Broad Institute of MIT and Harvard	BRD-K01916633			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)9-6-12-32-23(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,33H,6,9,12,15-18H2,1-3H3/t19-,20+,25-/m1/s1	PZGTZQIYRXDXGV-OHUGHZGNSA-N	509.26381927							96730
MLS003129335	LSM-8290	SID99357646, BRD-K60321290	44505571	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22+/m0/s1	IKCPXJXAZOQLMC-NJNPRVFISA-N	COc1ccc(OC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)cc1	BroadT	BRD-K60321290	BRD-K60321290-001-02-7	Broad Institute of MIT and Harvard	BRD-K60321290			COc1ccc(OC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)cc1	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22+/m0/s1	IKCPXJXAZOQLMC-NJNPRVFISA-N	489.25873389							96911
BRD-K30398452	LSM-8190		44505857	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18-,23-/m1/s1	BKRQCUCZQROLSQ-PMAPCBKXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K30398452	BRD-K30398452-001-01-8	Broad Institute of MIT and Harvard	BRD-K30398452			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18-,23-/m1/s1	BKRQCUCZQROLSQ-PMAPCBKXSA-N	516.269632932							96811
BRD-K42989496	LSM-8238		44505815	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)6-5-11-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-9-21(34-4)10-8-19/h7-10,13,17-18,22,31H,5-6,11-12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22-/m1/s1	OFOUXQSPHPQRAF-KGVIQGDOSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)cc1	BroadT	BRD-K42989496	BRD-K42989496-001-01-8	Broad Institute of MIT and Harvard	BRD-K42989496			COc1ccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)cc1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)6-5-11-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-9-21(34-4)10-8-19/h7-10,13,17-18,22,31H,5-6,11-12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22-/m1/s1	OFOUXQSPHPQRAF-KGVIQGDOSA-N	488.274718312							96859
MLS003129138	LSM-8417	BRD-K96218183, SID99357479	44488158	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22-/m0/s1	YRBTUIBMTXMQGX-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K96218183	BRD-K96218183-001-02-3	Broad Institute of MIT and Harvard	BRD-K96218183			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22-/m0/s1	YRBTUIBMTXMQGX-JQVVWYNYSA-N	473.26381927							97038
BRD-K88628885	LSM-8398		44506055	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20+,23-/m1/s1	MEJUTVOAQGGYHA-ZRCGQRJVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K88628885	BRD-K88628885-001-01-6	Broad Institute of MIT and Harvard	BRD-K88628885			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20+,23-/m1/s1	MEJUTVOAQGGYHA-ZRCGQRJVSA-N	443.289640094							97019
BRD-K42982250	LSM-8237		44505757	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22-/m1/s1	IKCPXJXAZOQLMC-JBYIUTFZSA-N	COc1ccc(OC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)cc1	BroadT	BRD-K42982250	BRD-K42982250-001-01-9	Broad Institute of MIT and Harvard	BRD-K42982250			COc1ccc(OC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)cc1	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22-/m1/s1	IKCPXJXAZOQLMC-JBYIUTFZSA-N	489.25873389							96858
BRD-K26188625	LSM-8178		44498140	InChI=1S/C22H38N6O4/c1-16-11-28(17(2)14-29)21(30)9-6-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)23-18-7-4-5-8-18/h12,16-18,20,29H,4-11,13-15H2,1-3H3,(H,23,31)/t16-,17+,20-/m0/s1	NHKODMKPZBXGEI-QKLQHJQFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K26188625	BRD-K26188625-001-01-1	Broad Institute of MIT and Harvard	BRD-K26188625			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H38N6O4/c1-16-11-28(17(2)14-29)21(30)9-6-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)23-18-7-4-5-8-18/h12,16-18,20,29H,4-11,13-15H2,1-3H3,(H,23,31)/t16-,17+,20-/m0/s1	NHKODMKPZBXGEI-QKLQHJQFSA-N	450.295453756							96799
MLS003129211	LSM-8325	BRD-K67314051, SID99357419	44484526	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17-,22+/m1/s1	DEGZSTUNWMGQCY-YVHKJVDXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K67314051	BRD-K67314051-001-02-4	Broad Institute of MIT and Harvard	BRD-K67314051			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34N6O6/c1-16-10-30(17(2)13-31)23(32)5-4-8-29-11-19(26-27-29)14-34-22(16)12-28(3)24(33)25-18-6-7-20-21(9-18)36-15-35-20/h6-7,9,11,16-17,22,31H,4-5,8,10,12-15H2,1-3H3,(H,25,33)/t16-,17-,22+/m1/s1	DEGZSTUNWMGQCY-YVHKJVDXSA-N	502.253982868							96946
BRD-K36726271	LSM-8214		44505846	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21-/m1/s1	VTXUSJLMEZRIOV-CBGDNZLLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K36726271	BRD-K36726271-001-01-3	Broad Institute of MIT and Harvard	BRD-K36726271			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21-/m1/s1	VTXUSJLMEZRIOV-CBGDNZLLSA-N	476.254731796							96835
BRD-K75869048	LSM-8357		44505885	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22-/m0/s1	KWAFQNIHTBJTFB-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K75869048	BRD-K75869048-001-01-5	Broad Institute of MIT and Harvard	BRD-K75869048			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22-/m0/s1	KWAFQNIHTBJTFB-SVMVAKDDSA-N	497.261374598							96978
MLS003129931	LSM-8115	BRD-K02707544, SID99358423	44487411	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19+,24+/m1/s1	BWTMYHAPSQQINJ-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K02707544	BRD-K02707544-001-02-2	Broad Institute of MIT and Harvard	BRD-K02707544			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C26H36N6O4/c1-18-13-32(19(2)16-33)25(34)6-5-10-31-14-22(27-28-31)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-12,14,18-19,24,33H,5-6,10,13,15-17H2,1-4H3/t18-,19+,24+/m1/s1	BWTMYHAPSQQINJ-IMWIBFENSA-N	496.279803692							96736
BRD-K92186740	LSM-8406		44505219	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18+,21+/m1/s1	QSHHTQCGWZKCKD-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K92186740	BRD-K92186740-001-01-4	Broad Institute of MIT and Harvard	BRD-K92186740			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18+,21+/m1/s1	QSHHTQCGWZKCKD-LQWHRVPQSA-N	430.269239008							97027
BRD-K33384411	LSM-8196		44505239	InChI=1S/C25H37N5O5/c1-18-13-29(19(2)16-31)25(32)5-4-8-30-21(12-26-27-30)17-35-24(18)15-28(3)14-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11-12,18-19,24,31H,4-5,8-10,13-17H2,1-3H3/t18-,19-,24-/m0/s1	KKGFASYBCNAVFA-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K33384411	BRD-K33384411-001-01-5	Broad Institute of MIT and Harvard	BRD-K33384411			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H37N5O5/c1-18-13-29(19(2)16-31)25(32)5-4-8-30-21(12-26-27-30)17-35-24(18)15-28(3)14-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11-12,18-19,24,31H,4-5,8-10,13-17H2,1-3H3/t18-,19-,24-/m0/s1	KKGFASYBCNAVFA-JXQFQVJHSA-N	487.279469334							96817
BRD-K81042289	LSM-8375		44505665	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18-,22-/m1/s1	QZCZRKJJOTUXQW-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K81042289	BRD-K81042289-001-01-9	Broad Institute of MIT and Harvard	BRD-K81042289			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18-,22-/m1/s1	QZCZRKJJOTUXQW-JBYIUTFZSA-N	497.261374598							96996
BRD-K36289461	LSM-8211		44498558	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19+,23+/m0/s1	RQWMQWHENJCHFR-YCRNBWNJSA-N	COc1cccc(CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)c1	BroadT	BRD-K36289461	BRD-K36289461-001-01-2	Broad Institute of MIT and Harvard	BRD-K36289461			COc1cccc(CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)c1	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)9-6-10-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-7-5-8-22(11-20)32-4/h5,7-8,11,14,18-19,23,30H,6,9-10,12-13,15-17H2,1-4H3/t18-,19+,23+/m0/s1	RQWMQWHENJCHFR-YCRNBWNJSA-N	459.284554714							96832
MLS003129578	LSM-8209	BRD-K35103917, SID99357946	44505604	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)6-5-11-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-9-21(34-4)10-8-19/h7-10,13,17-18,22,31H,5-6,11-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22+/m0/s1	OFOUXQSPHPQRAF-NPPFBWRTSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)cc1	BroadT	BRD-K35103917	BRD-K35103917-001-02-4	Broad Institute of MIT and Harvard	BRD-K35103917			COc1ccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)cc1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)6-5-11-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-9-21(34-4)10-8-19/h7-10,13,17-18,22,31H,5-6,11-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22+/m0/s1	OFOUXQSPHPQRAF-NPPFBWRTSA-N	488.274718312							96830
MLS003130357	LSM-8359	BRD-K76100122, SID99359244	44505328	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19-,21+/m1/s1	BGKHIKCFNCIYGU-SBHAEUEKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K76100122	BRD-K76100122-001-02-1	Broad Institute of MIT and Harvard	BRD-K76100122			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19-,21+/m1/s1	BGKHIKCFNCIYGU-SBHAEUEKSA-N	493.23588996							96980
BRD-K33933950	LSM-8202		44488167	InChI=1S/C17H31N5O3/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-25-16(13)10-20(3)4/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16-/m0/s1	PFQPPSPXSKCUPO-LZWOXQAQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K33933950	BRD-K33933950-001-01-6	Broad Institute of MIT and Harvard	BRD-K33933950			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O3/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-25-16(13)10-20(3)4/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16-/m0/s1	PFQPPSPXSKCUPO-LZWOXQAQSA-N	353.242689902							96823
MLS003129765	LSM-8330	BRD-K68741898	44505553	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19+/m0/s1	MNAJUJYQFCFYAB-YQVWRLOYSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K68741898	BRD-K68741898-001-02-4	Broad Institute of MIT and Harvard	BRD-K68741898			CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C21H37N5O5/c1-15(2)13-31-21(29)24(5)11-19-16(3)10-25(17(4)12-27)20(28)7-6-8-26-18(14-30-19)9-22-23-26/h9,15-17,19,27H,6-8,10-14H2,1-5H3/t16-,17+,19+/m0/s1	MNAJUJYQFCFYAB-YQVWRLOYSA-N	439.279469334							96951
MLS003129477	LSM-8421	BRD-K96743424	44505000	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25-/m0/s1	WIMCLPXWPPGBKL-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K96743424	BRD-K96743424-001-02-9	Broad Institute of MIT and Harvard	BRD-K96743424			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20+,25-/m0/s1	WIMCLPXWPPGBKL-DFIYOIEZSA-N	509.26381927							97042
MLS003129711	LSM-8111	BRD-K02257023, SID99358155	44504994	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22-/m1/s1	MESWQEBVROHANN-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K02257023	BRD-K02257023-001-02-8	Broad Institute of MIT and Harvard	BRD-K02257023			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22-/m1/s1	MESWQEBVROHANN-XQBPLPMBSA-N	457.26890465							96732
BRD-K82521114	LSM-8379		44486367	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17-,22-/m0/s1	ATJIIPBEGAKQFE-HOIFWPIMSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K82521114	BRD-K82521114-001-01-2	Broad Institute of MIT and Harvard	BRD-K82521114			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17-,22-/m0/s1	ATJIIPBEGAKQFE-HOIFWPIMSA-N	497.196045386							97000
BRD-K88876691	LSM-8399		44505764	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)9-24(15(3)12-25)18(26)7-6-8-23-10-16(13-29-17)20-21-23/h10,14-15,17,25H,5-9,11-13H2,1-4H3/t14-,15+,17-/m0/s1	OBJUKURLMFMQOH-UXLLHSPISA-N	CCOC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K88876691	BRD-K88876691-001-01-5	Broad Institute of MIT and Harvard	BRD-K88876691			CCOC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)9-24(15(3)12-25)18(26)7-6-8-23-10-16(13-29-17)20-21-23/h10,14-15,17,25H,5-9,11-13H2,1-4H3/t14-,15+,17-/m0/s1	OBJUKURLMFMQOH-UXLLHSPISA-N	411.248169206							97020
BRD-K14738608	LSM-8144		44505065	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20+,24-/m0/s1	XBPVHNZVBFLVIV-ROKPMTFOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K14738608	BRD-K14738608-001-01-8	Broad Institute of MIT and Harvard	BRD-K14738608			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc2cnnn2CCCC1=O	InChI=1S/C26H39N5O5/c1-19-14-30(20(2)17-32)25(33)9-5-10-31-22(13-27-28-31)18-36-24(19)16-29(3)15-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,13,19-20,24,32H,5-6,9-12,14-18H2,1-3H3/t19-,20+,24-/m0/s1	XBPVHNZVBFLVIV-ROKPMTFOSA-N	501.295119398							96765
MLS003129191	LSM-8282	BRD-K56711030	44505999	InChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18-,21+/m0/s1	AHKBAATWJXKTGZ-BBTUJRGHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K56711030	BRD-K56711030-001-02-0	Broad Institute of MIT and Harvard	BRD-K56711030			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18-,21+/m0/s1	AHKBAATWJXKTGZ-BBTUJRGHSA-N	449.300204778							96903
BRD-K07452532	LSM-6798		44505244	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19-,24-/m0/s1	DSHPDBIZJLDJKA-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K07452532	BRD-K07452532-001-01-6	Broad Institute of MIT and Harvard	BRD-K07452532			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19-,24-/m0/s1	DSHPDBIZJLDJKA-JXQFQVJHSA-N	487.279469334							95419
BRD-K97399889	LSM-8423		44491445	InChI=1S/C22H33N5O5S/c1-17-12-27(18(2)15-28)22(29)10-7-11-26-13-19(23-24-26)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,28H,7,10-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	BDEMCWTZQNVVEU-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K97399889	BRD-K97399889-001-01-9	Broad Institute of MIT and Harvard	BRD-K97399889			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H33N5O5S/c1-17-12-27(18(2)15-28)22(29)10-7-11-26-13-19(23-24-26)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,28H,7,10-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	BDEMCWTZQNVVEU-WFXMLNOXSA-N	479.220239896							97044
BRD-K53241640	LSM-8271		44505765	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)9-25(16(4)12-26)19(27)7-6-8-24-10-17(13-29-18)21-22-24/h10,14-16,18,26H,6-9,11-13H2,1-5H3/t15-,16+,18-/m0/s1	FYUBIBUWDYYNKH-JZXOWHBKSA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K53241640	BRD-K53241640-001-01-5	Broad Institute of MIT and Harvard	BRD-K53241640			CC(C)OC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)9-25(16(4)12-26)19(27)7-6-8-24-10-17(13-29-18)21-22-24/h10,14-16,18,26H,6-9,11-13H2,1-5H3/t15-,16+,18-/m0/s1	FYUBIBUWDYYNKH-JZXOWHBKSA-N	425.26381927							96892
MLS003129326	LSM-8247	BRD-K45937204, SID99357585	44504988	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m1/s1	MESWQEBVROHANN-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K45937204	BRD-K45937204-001-02-5	Broad Institute of MIT and Harvard	BRD-K45937204			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m1/s1	MESWQEBVROHANN-WOIUINJBSA-N	457.26890465							96868
MLS003129137	LSM-8337	BRD-K69565703, SID99357478	44505995	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24-/m0/s1	KMYKLRXROVKHNJ-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K69565703	BRD-K69565703-001-02-1	Broad Institute of MIT and Harvard	BRD-K69565703			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3ccn(C)c3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H36N6O4/c1-18-14-31(19(2)16-33)25(34)6-5-10-32-22(13-27-28-32)17-36-24(18)15-30(4)26(35)21-8-7-20-9-11-29(3)23(20)12-21/h7-9,11-13,18-19,24,33H,5-6,10,14-17H2,1-4H3/t18-,19-,24-/m0/s1	KMYKLRXROVKHNJ-JXQFQVJHSA-N	496.279803692							96958
MLS003129358	LSM-8198	BRD-K33480200	44505881	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18-,21+/m1/s1	BVMGYWBUQYFDAA-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K33480200	BRD-K33480200-001-02-4	Broad Institute of MIT and Harvard	BRD-K33480200			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18-,21+/m1/s1	BVMGYWBUQYFDAA-OPYAIIAOSA-N	430.269239008							96819
MLS003129641	LSM-8335	BRD-K69492024, SID99358046	44497244	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22+/m0/s1	DGDOMSZWPVXBGZ-NNMXDRDESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K69492024	BRD-K69492024-001-02-0	Broad Institute of MIT and Harvard	BRD-K69492024			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22+/m0/s1	DGDOMSZWPVXBGZ-NNMXDRDESA-N	493.23588996							96956
MLS003129096	LSM-8124	BRD-K05098996, SID99359701	44495957	InChI=1S/C28H37N5O6S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-23(29-30-32)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22-,27+/m0/s1	SYWTUHWEQAODFK-BCQCSXDESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K05098996	BRD-K05098996-001-02-6	Broad Institute of MIT and Harvard	BRD-K05098996			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N5O6S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-23(29-30-32)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22-,27+/m0/s1	SYWTUHWEQAODFK-BCQCSXDESA-N	571.246454644							96745
BRD-K07278381	LSM-8128		44505118	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22-/m1/s1	DGDOMSZWPVXBGZ-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K07278381	BRD-K07278381-001-01-7	Broad Institute of MIT and Harvard	BRD-K07278381			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)12-28(19(3)15-29)23(30)6-5-11-27-13-20(16-33-22)24-25-27/h7-10,13,18-19,22,29H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22-/m1/s1	DGDOMSZWPVXBGZ-XQBPLPMBSA-N	493.23588996							96749
BRD-K95761590	LSM-8415		44496833	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22+/m0/s1	YNSZNIPNNMZZOV-NPPFBWRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K95761590	BRD-K95761590-001-01-2	Broad Institute of MIT and Harvard	BRD-K95761590			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22+/m0/s1	YNSZNIPNNMZZOV-NPPFBWRTSA-N	445.26890465							97036
MLS003129805	LSM-8388	SID99358285, BRD-K86033856	44489268	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22+/m1/s1	YRBTUIBMTXMQGX-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K86033856	BRD-K86033856-001-02-4	Broad Institute of MIT and Harvard	BRD-K86033856			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)13-28(19(3)15-30)23(31)6-5-11-29-20(16-33-22)12-25-26-29/h7-10,12,18-19,22,30H,5-6,11,13-16H2,1-4H3/t18-,19+,22+/m1/s1	YRBTUIBMTXMQGX-DXIQSLLYSA-N	473.26381927							97009
MLS003129254	LSM-8300	BRD-K61984373	44505760	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22+/m0/s1	IKCPXJXAZOQLMC-NPPFBWRTSA-N	COc1ccc(OC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)cc1	BroadT	BRD-K61984373	BRD-K61984373-001-02-1	Broad Institute of MIT and Harvard	BRD-K61984373			COc1ccc(OC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3)cc1	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22+/m0/s1	IKCPXJXAZOQLMC-NPPFBWRTSA-N	489.25873389							96921
BRD-K47247219	LSM-8250		44505180	InChI=1S/C23H33N5O5/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-19(24-25-27)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	NWYXEXAEFWIOJN-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K47247219	BRD-K47247219-001-01-2	Broad Institute of MIT and Harvard	BRD-K47247219			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33N5O5/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-19(24-25-27)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	NWYXEXAEFWIOJN-DBXWQHBBSA-N	459.248169206							96871
BRD-K99681782	LSM-8426		44505898	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22-/m1/s1	YNSZNIPNNMZZOV-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K99681782	BRD-K99681782-001-01-6	Broad Institute of MIT and Harvard	BRD-K99681782			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)5-4-10-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-8-21(30)9-7-19/h6-9,13,17-18,22,29-30H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22-/m1/s1	YNSZNIPNNMZZOV-JBYIUTFZSA-N	445.26890465							97047
BRD-K05684908	LSM-6797		44505891	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19-,24+/m0/s1	DSHPDBIZJLDJKA-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K05684908	BRD-K05684908-001-01-2	Broad Institute of MIT and Harvard	BRD-K05684908			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19-,24+/m0/s1	DSHPDBIZJLDJKA-AXHZCLLHSA-N	487.279469334							95418
MLS003129772	LSM-8416	BRD-K95805172, SID99358256	44485063	InChI=1S/C24H35N5O5/c1-18-12-29(19(2)15-30)23(31)10-7-11-28-13-21(25-26-28)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22+/m1/s1	STPKXVJXGDPGFM-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)OCc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K95805172	BRD-K95805172-001-02-1	Broad Institute of MIT and Harvard	BRD-K95805172			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)OCc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-18-12-29(19(2)15-30)23(31)10-7-11-28-13-21(25-26-28)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22+/m1/s1	STPKXVJXGDPGFM-DXIQSLLYSA-N	473.26381927							97037
MLS003130215	LSM-8324	BRD-K67217705, SID99359010	44505603	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26-/m1/s1	WJAIMBKFVIKGAD-XLGIIRLISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K67217705	BRD-K67217705-001-02-9	Broad Institute of MIT and Harvard	BRD-K67217705			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26-/m1/s1	WJAIMBKFVIKGAD-XLGIIRLISA-N	541.337652926							96945
BRD-K67896259	LSM-8327		44493583	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28-/m1/s1	CUSMSBFNEHNGNQ-MVOZIGHISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K67896259	BRD-K67896259-001-01-2	Broad Institute of MIT and Harvard	BRD-K67896259			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23-,28-/m1/s1	CUSMSBFNEHNGNQ-MVOZIGHISA-N	521.300204778							96948
BRD-K56654013	LSM-8281		44504954	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16-/m0/s1	PUHFBKBPROGAIN-DZKIICNBSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K56654013	BRD-K56654013-001-01-5	Broad Institute of MIT and Harvard	BRD-K56654013			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16-/m0/s1	PUHFBKBPROGAIN-DZKIICNBSA-N	417.204589832							96902
BRD-K86573519	LSM-8390		44505899	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19+,23-/m0/s1	GEARZFJDEYGDIT-YYDVJCTNSA-N	COc1cccc(CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)c1	BroadT	BRD-K86573519	BRD-K86573519-001-01-0	Broad Institute of MIT and Harvard	BRD-K86573519			COc1cccc(CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)c1	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19+,23-/m0/s1	GEARZFJDEYGDIT-YYDVJCTNSA-N	459.284554714							97011
MLS003129440	LSM-8373	BRD-K80819715, SID99357781	44485047	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25-/m0/s1	KFMYUMLTCHBBFY-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K80819715	BRD-K80819715-001-02-3	Broad Institute of MIT and Harvard	BRD-K80819715			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25-/m0/s1	KFMYUMLTCHBBFY-DFIYOIEZSA-N	529.23588996							96994
MLS003129383	LSM-8226	BRD-K40060703, SID99357686	44505727	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22+/m1/s1	AWVASGRLDZTAAI-FGSXEWAUSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K40060703	BRD-K40060703-001-02-7	Broad Institute of MIT and Harvard	BRD-K40060703			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22+/m1/s1	AWVASGRLDZTAAI-FGSXEWAUSA-N	509.23080458							96847
CHEMBL2356207	LSM-8332	BRD-K68988758, SID85799822	44493080	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22+/m0/s1	QAXWADXATYBNKX-NPPFBWRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K68988758	BRD-K68988758-001-01-2	Broad Institute of MIT and Harvard	BRD-K68988758			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22+/m0/s1	QAXWADXATYBNKX-NPPFBWRTSA-N	497.261374598							96953
MLS003129717	LSM-8414	BRD-K95323755	44485753	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22+/m0/s1	VOGIWUFDXLFNKS-CNNODRBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K95323755	BRD-K95323755-001-02-0	Broad Institute of MIT and Harvard	BRD-K95323755			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19-,22+/m0/s1	VOGIWUFDXLFNKS-CNNODRBYSA-N	473.26381927							97035
MLS003129568	LSM-23969	BRD-K77120024	44491453	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m1/s1	DTQFALQSFDATTM-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K77120024	BRD-K77120024-001-02-7	Broad Institute of MIT and Harvard	BRD-K77120024			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)9-6-10-32-12-18(29-30-32)15-37-21(16)13-31(3)23(36)28-20-8-5-4-7-19(20)24(25,26)27/h4-5,7-8,12,16-17,21,34H,6,9-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m1/s1	DTQFALQSFDATTM-WWMYMODYSA-N	526.251538196							112559
MLS003129539	LSM-8392	BRD-K86956630	44491448	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15+,17+/m1/s1	CMMUKIKJYLMGMW-VYDXJSESSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K86956630	BRD-K86956630-001-02-9	Broad Institute of MIT and Harvard	BRD-K86956630			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H32F3N5O4/c1-14-9-28(15(2)12-29)19(31)5-4-8-27-10-16(24-25-27)13-32-17(14)11-26(3)18(30)6-7-20(21,22)23/h10,14-15,17,29H,4-9,11-13H2,1-3H3/t14-,15+,17+/m1/s1	CMMUKIKJYLMGMW-VYDXJSESSA-N	463.240639154							97013
BRD-K85807048	LSM-8387		44505901	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18+,22-/m1/s1	ZTOSEQHRKGCZOZ-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K85807048	BRD-K85807048-001-01-3	Broad Institute of MIT and Harvard	BRD-K85807048			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18+,22-/m1/s1	ZTOSEQHRKGCZOZ-KGVIQGDOSA-N	497.261374598							97008
BRD-K38594532	LSM-6805		44506075	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19+,24+/m0/s1	DSHPDBIZJLDJKA-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K38594532	BRD-K38594532-001-01-8	Broad Institute of MIT and Harvard	BRD-K38594532			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19+,24+/m0/s1	DSHPDBIZJLDJKA-XLNZFTOWSA-N	487.279469334							95426
MLS003129599	LSM-8275	BRD-K54522558	44496401	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22+/m1/s1	ZODITPIVHHGZAH-FGSXEWAUSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K54522558	BRD-K54522558-001-02-5	Broad Institute of MIT and Harvard	BRD-K54522558			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22+/m1/s1	ZODITPIVHHGZAH-FGSXEWAUSA-N	488.274718312							96896
BRD-K22609494	LSM-8167		44505807	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)6-5-11-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-9-21(34-4)10-8-19/h7-10,13,17-18,22,31H,5-6,11-12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22-/m0/s1	OFOUXQSPHPQRAF-SVMVAKDDSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)cc1	BroadT	BRD-K22609494	BRD-K22609494-001-01-8	Broad Institute of MIT and Harvard	BRD-K22609494			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)nn3)cc1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)6-5-11-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-9-21(34-4)10-8-19/h7-10,13,17-18,22,31H,5-6,11-12,14-16H2,1-4H3,(H,25,33)/t17-,18+,22-/m0/s1	OFOUXQSPHPQRAF-SVMVAKDDSA-N	488.274718312							96788
BRD-K66001964	LSM-8319		44506071	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18-,22-/m0/s1	DXNYPMFBKGSJNE-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K66001964	BRD-K66001964-001-01-6	Broad Institute of MIT and Harvard	BRD-K66001964			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18-,22-/m0/s1	DXNYPMFBKGSJNE-SPEDKVCISA-N	497.261374598							96940
BRD-K33961669	LSM-8203		44505787	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21-/m0/s1	APDMZOWNVCUUKT-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K33961669	BRD-K33961669-001-01-9	Broad Institute of MIT and Harvard	BRD-K33961669			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21-/m0/s1	APDMZOWNVCUUKT-UEXGIBASSA-N	464.31110382							96824
MLS003129613	LSM-8132	BRD-K08464293	44506039	InChI=1S/C23H41N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h12,18-20,22,29H,4-11,13-17H2,1-3H3/t18-,19+,22+/m1/s1	OPQMCYKWZYLZJV-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K08464293	BRD-K08464293-001-02-7	Broad Institute of MIT and Harvard	BRD-K08464293			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H41N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h12,18-20,22,29H,4-11,13-17H2,1-3H3/t18-,19+,22+/m1/s1	OPQMCYKWZYLZJV-DXIQSLLYSA-N	435.320940222							96753
BRD-K15953261	LSM-8150		44488160	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22+,26-/m0/s1	HFDOIJULVRDPRU-VRUMLPLGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K15953261	BRD-K15953261-001-01-0	Broad Institute of MIT and Harvard	BRD-K15953261			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22+,26-/m0/s1	HFDOIJULVRDPRU-VRUMLPLGSA-N	541.337652926							96771
BRD-K10991887	LSM-8140		44505066	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)6-5-11-29-22(17-32-23)12-25-26-29/h7-10,12,19-20,23,30H,5-6,11,13-17H2,1-4H3/t19-,20-,23-/m1/s1	WGPDLCVCGOLGPE-TXTKFYIRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K10991887	BRD-K10991887-001-01-9	Broad Institute of MIT and Harvard	BRD-K10991887			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)14-27(4)15-23-19(2)13-28(20(3)16-30)24(31)6-5-11-29-22(17-32-23)12-25-26-29/h7-10,12,19-20,23,30H,5-6,11,13-17H2,1-4H3/t19-,20-,23-/m1/s1	WGPDLCVCGOLGPE-TXTKFYIRSA-N	443.289640094							96761
BRD-K00863274	LSM-8104		44484538	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19-,23-/m1/s1	AIDUMHXRFRBIIP-DNVFCKCGSA-N	COc1ccccc1CN(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K00863274	BRD-K00863274-001-01-3	Broad Institute of MIT and Harvard	BRD-K00863274			COc1ccccc1CN(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19-,23-/m1/s1	AIDUMHXRFRBIIP-DNVFCKCGSA-N	459.284554714							96725
MLS003129234	LSM-8410	BRD-K93980445, SID99357436	44494936	InChI=1S/C20H36N6O4/c1-14(2)22-20(29)24(5)11-18-15(3)10-25(16(4)12-27)19(28)7-6-8-26-17(13-30-18)9-21-23-26/h9,14-16,18,27H,6-8,10-13H2,1-5H3,(H,22,29)/t15-,16-,18-/m1/s1	NAXYJFNCLMAYPS-JFIYKMOQSA-N	CC(C)NC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K93980445	BRD-K93980445-001-02-5	Broad Institute of MIT and Harvard	BRD-K93980445			CC(C)NC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C20H36N6O4/c1-14(2)22-20(29)24(5)11-18-15(3)10-25(16(4)12-27)19(28)7-6-8-26-17(13-30-18)9-21-23-26/h9,14-16,18,27H,6-8,10-13H2,1-5H3,(H,22,29)/t15-,16-,18-/m1/s1	NAXYJFNCLMAYPS-JFIYKMOQSA-N	424.279803692							97031
MLS003129412	LSM-8135	BRD-K09324395, SID99357711	44505831	InChI=1S/C27H36N6O4/c1-19-15-32(20(2)17-34)26(35)12-7-13-33-22(14-28-30-33)18-37-25(19)16-31(3)27(36)29-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,34H,7,12-13,15-18H2,1-3H3,(H,29,36)/t19-,20+,25-/m0/s1	BDQCUWSGKZTQJJ-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K09324395	BRD-K09324395-001-02-9	Broad Institute of MIT and Harvard	BRD-K09324395			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H36N6O4/c1-19-15-32(20(2)17-34)26(35)12-7-13-33-22(14-28-30-33)18-37-25(19)16-31(3)27(36)29-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,34H,7,12-13,15-18H2,1-3H3,(H,29,36)/t19-,20+,25-/m0/s1	BDQCUWSGKZTQJJ-DFIYOIEZSA-N	508.279803692							96756
MLS003129249	LSM-8425	BRD-K99470298	44505558	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22+/m1/s1	IKCPXJXAZOQLMC-FGSXEWAUSA-N	COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)cc1	BroadT	BRD-K99470298	BRD-K99470298-001-02-9	Broad Institute of MIT and Harvard	BRD-K99470298			COc1ccc(OC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@@H](C)CO)nn3)cc1	InChI=1S/C24H35N5O6/c1-17-12-29(18(2)15-30)23(31)6-5-11-28-13-19(25-26-28)16-34-22(17)14-27(3)24(32)35-21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,30H,5-6,11-12,14-16H2,1-4H3/t17-,18+,22+/m1/s1	IKCPXJXAZOQLMC-FGSXEWAUSA-N	489.25873389							97046
BRD-K75710654	LSM-8356		44505572	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)9-24(15(3)12-25)18(26)7-6-8-23-10-16(13-29-17)20-21-23/h10,14-15,17,25H,5-9,11-13H2,1-4H3/t14-,15-,17-/m1/s1	OBJUKURLMFMQOH-BFYDXBDKSA-N	CCOC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K75710654	BRD-K75710654-001-01-6	Broad Institute of MIT and Harvard	BRD-K75710654			CCOC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)9-24(15(3)12-25)18(26)7-6-8-23-10-16(13-29-17)20-21-23/h10,14-15,17,25H,5-9,11-13H2,1-4H3/t14-,15-,17-/m1/s1	OBJUKURLMFMQOH-BFYDXBDKSA-N	411.248169206							96977
MLS003130212	LSM-8322	BRD-K66848791, SID99359007	44504967	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)9-6-10-28-18(11-24-25-28)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,11,16-17,20,29H,6,9-10,12-15H2,1-3H3/t16-,17-,20-/m0/s1	MFABSAUNVKQXNQ-ZWOKBUDYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3cnnn3CCCC1=O	BroadT	BRD-K66848791	BRD-K66848791-001-02-7	Broad Institute of MIT and Harvard	BRD-K66848791			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)9-6-10-28-18(11-24-25-28)15-33-20(16)13-26(3)34(31,32)21-8-5-4-7-19(21)23/h4-5,7-8,11,16-17,20,29H,6,9-10,12-15H2,1-3H3/t16-,17-,20-/m0/s1	MFABSAUNVKQXNQ-ZWOKBUDYSA-N	497.210818064							96943
MLS003129478	LSM-8363	BRD-K77873562, SID99357813	44505414	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26+/m1/s1	WJAIMBKFVIKGAD-UFPGJGBJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K77873562	BRD-K77873562-001-02-9	Broad Institute of MIT and Harvard	BRD-K77873562			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22+,26+/m1/s1	WJAIMBKFVIKGAD-UFPGJGBJSA-N	541.337652926							96984
BRD-K74472944	LSM-8353		44497254	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21-/m0/s1	APDMZOWNVCUUKT-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K74472944	BRD-K74472944-001-01-4	Broad Institute of MIT and Harvard	BRD-K74472944			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21-/m0/s1	APDMZOWNVCUUKT-WFXMLNOXSA-N	464.31110382							96974
BRD-K39767907	LSM-8225		44505033	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18+,22-/m1/s1	GQDZDOSXBZGUQJ-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K39767907	BRD-K39767907-001-01-6	Broad Institute of MIT and Harvard	BRD-K39767907			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O4/c1-17-12-27(18(2)15-29)23(31)8-5-9-28-20(11-24-25-28)16-32-22(17)14-26(3)13-19-6-4-7-21(30)10-19/h4,6-7,10-11,17-18,22,29-30H,5,8-9,12-16H2,1-3H3/t17-,18+,22-/m1/s1	GQDZDOSXBZGUQJ-KGVIQGDOSA-N	445.26890465							96846
MLS003129286	LSM-8407	BRD-K92541860, SID99357549	44505973	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17-,20-/m0/s1	IGJDKOMBBXSAPT-ZWOKBUDYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K92541860	BRD-K92541860-001-02-2	Broad Institute of MIT and Harvard	BRD-K92541860			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32N6O4/c1-16-12-27(17(2)14-29)21(30)5-4-10-28-19(11-24-25-28)15-32-20(16)13-26(3)22(31)18-6-8-23-9-7-18/h6-9,11,16-17,20,29H,4-5,10,12-15H2,1-3H3/t16-,17-,20-/m0/s1	IGJDKOMBBXSAPT-ZWOKBUDYSA-N	444.248503564							97028
MLS003130359	LSM-8294	SID99359246, BRD-K61044449	44504923	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)6-5-11-28-20(16-33-22)12-24-25-28/h7-10,12,18-19,22,29H,5-6,11,13-16H2,1-4H3/t18-,19-,22+/m1/s1	PBQVTRJHSYIUGU-KNKQGSTJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K61044449	BRD-K61044449-001-02-4	Broad Institute of MIT and Harvard	BRD-K61044449			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O5S/c1-17-7-9-21(10-8-17)34(31,32)26(4)14-22-18(2)13-27(19(3)15-29)23(30)6-5-11-28-20(16-33-22)12-24-25-28/h7-10,12,18-19,22,29H,5-6,11,13-16H2,1-4H3/t18-,19-,22+/m1/s1	PBQVTRJHSYIUGU-KNKQGSTJSA-N	493.23588996							96915
BRD-K40241713	LSM-8227		44484522	InChI=1S/C24H35N5O5/c1-18-12-29(19(2)15-30)23(31)10-7-11-28-13-21(25-26-28)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m1/s1	STPKXVJXGDPGFM-WOIUINJBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)OCc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K40241713	BRD-K40241713-001-01-3	Broad Institute of MIT and Harvard	BRD-K40241713			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)OCc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-18-12-29(19(2)15-30)23(31)10-7-11-28-13-21(25-26-28)17-33-22(18)14-27(3)24(32)34-16-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19-,22-/m1/s1	STPKXVJXGDPGFM-WOIUINJBSA-N	473.26381927							96848
MLS003129485	LSM-8328	BRD-K68458302, SID99357819	44505421	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26+/m0/s1	WJAIMBKFVIKGAD-AOJNWGRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cnnn4CCCC1=O	BroadT	BRD-K68458302	BRD-K68458302-001-02-5	Broad Institute of MIT and Harvard	BRD-K68458302			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C28H43N7O4/c1-21-17-34(22(2)19-36)27(37)8-7-15-35-25(16-29-31-35)20-39-26(21)18-32(3)28(38)30-23-9-11-24(12-10-23)33-13-5-4-6-14-33/h9-12,16,21-22,26,36H,4-8,13-15,17-20H2,1-3H3,(H,30,38)/t21-,22-,26+/m0/s1	WJAIMBKFVIKGAD-AOJNWGRGSA-N	541.337652926							96949
BRD-K76086682	LSM-8358		44506089	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28-/m0/s1	WVGLRASGSLBUCZ-LXWOLXCRSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K76086682	BRD-K76086682-001-01-6	Broad Institute of MIT and Harvard	BRD-K76086682			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O4/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-25(30-31-33)21-37-28(22)19-32(3)17-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28-/m0/s1	WVGLRASGSLBUCZ-LXWOLXCRSA-N	521.300204778							96979
MLS003130245	LSM-8181	BRD-K26733240, SID99359035	44505347	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)8-5-9-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10-11,16-17,21,29H,5,8-9,12-15H2,1-3H3/t16-,17+,21+/m1/s1	KYGBGAWZQIYPEA-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K26733240	BRD-K26733240-001-02-7	Broad Institute of MIT and Harvard	BRD-K26733240			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cnnn2CCCC1=O	InChI=1S/C22H32FN5O5S/c1-16-12-27(17(2)14-29)22(30)8-5-9-28-19(11-24-25-28)15-33-21(16)13-26(3)34(31,32)20-7-4-6-18(23)10-20/h4,6-7,10-11,16-17,21,29H,5,8-9,12-15H2,1-3H3/t16-,17+,21+/m1/s1	KYGBGAWZQIYPEA-WWMYMODYSA-N	497.210818064							96802
MLS003129215	LSM-8316	BRD-K65064082	44505828	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m1/s1	DVUZCPZOEGBIKA-WWMYMODYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K65064082	BRD-K65064082-001-02-0	Broad Institute of MIT and Harvard	BRD-K65064082			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m1/s1	DVUZCPZOEGBIKA-WWMYMODYSA-N	526.251538196							96937
BRD-K63180587	LSM-8306		44489814	InChI=1S/C17H31N5O3/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-25-16(13)10-20(3)4/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16-/m1/s1	PFQPPSPXSKCUPO-IJEWVQPXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2cnnn2CCCC1=O	BroadT	BRD-K63180587	BRD-K63180587-001-01-8	Broad Institute of MIT and Harvard	BRD-K63180587			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2cnnn2CCCC1=O	InChI=1S/C17H31N5O3/c1-13-9-21(14(2)11-23)17(24)6-5-7-22-15(8-18-19-22)12-25-16(13)10-20(3)4/h8,13-14,16,23H,5-7,9-12H2,1-4H3/t13-,14+,16-/m1/s1	PFQPPSPXSKCUPO-IJEWVQPXSA-N	353.242689902							96927
BRD-K64649217-001-01-9	LSM-29043	BRD-K64649217	44487421	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17+,22-/m0/s1	ATJIIPBEGAKQFE-JKSBSHDWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K64649217	BRD-K64649217-001-01-9	Broad Institute of MIT and Harvard	BRD-K64649217			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17+,22-/m0/s1	ATJIIPBEGAKQFE-JKSBSHDWSA-N	497.196045386							117594
BRD-K45735142	LSM-6782		44505046	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19-,24-/m1/s1	DSHPDBIZJLDJKA-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K45735142	BRD-K45735142-001-01-0	Broad Institute of MIT and Harvard	BRD-K45735142			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H37N5O5/c1-18-12-30(19(2)16-31)25(32)5-4-8-29-14-21(26-27-29)17-35-24(18)15-28(3)13-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11,14,18-19,24,31H,4-5,8-10,12-13,15-17H2,1-3H3/t18-,19-,24-/m1/s1	DSHPDBIZJLDJKA-KHCICDEESA-N	487.279469334							95403
MLS003129591	LSM-8160	BRD-K20617704	44505606	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m0/s1	DVUZCPZOEGBIKA-CSODHUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K20617704	BRD-K20617704-001-02-7	Broad Institute of MIT and Harvard	BRD-K20617704			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)5-4-10-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-8-6-18(7-9-19)24(25,26)27/h6-9,12,16-17,21,34H,4-5,10-11,13-15H2,1-3H3,(H,28,36)/t16-,17+,21+/m0/s1	DVUZCPZOEGBIKA-CSODHUTKSA-N	526.251538196							96781
MLS003129693	LSM-8267	BRD-K52240583, SID99358142	44504937	InChI=1S/C22H33N5O5S/c1-17-13-26(18(2)15-28)22(29)10-7-11-27-19(12-23-24-27)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,28H,7,10-11,13-16H2,1-3H3/t17-,18-,21+/m1/s1	YDFSFENEUSKTIZ-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K52240583	BRD-K52240583-001-02-5	Broad Institute of MIT and Harvard	BRD-K52240583			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H33N5O5S/c1-17-13-26(18(2)15-28)22(29)10-7-11-27-19(12-23-24-27)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,28H,7,10-11,13-16H2,1-3H3/t17-,18-,21+/m1/s1	YDFSFENEUSKTIZ-OPYAIIAOSA-N	479.220239896							96888
BRD-K97207863	LSM-8422		44506011	InChI=1S/C22H38N6O4/c1-16-11-28(17(2)14-29)21(30)9-6-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)23-18-7-4-5-8-18/h12,16-18,20,29H,4-11,13-15H2,1-3H3,(H,23,31)/t16-,17-,20-/m1/s1	NHKODMKPZBXGEI-MBOZVWFJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K97207863	BRD-K97207863-001-01-4	Broad Institute of MIT and Harvard	BRD-K97207863			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H38N6O4/c1-16-11-28(17(2)14-29)21(30)9-6-10-27-12-19(24-25-27)15-32-20(16)13-26(3)22(31)23-18-7-4-5-8-18/h12,16-18,20,29H,4-11,13-15H2,1-3H3,(H,23,31)/t16-,17-,20-/m1/s1	NHKODMKPZBXGEI-MBOZVWFJSA-N	450.295453756							97043
MLS003129753	LSM-8222	BRD-K39158408, SID121282525	44505998	InChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18-,21+/m1/s1	AHKBAATWJXKTGZ-OPYAIIAOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K39158408	BRD-K39158408-001-02-0	Broad Institute of MIT and Harvard	BRD-K39158408			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18-,21+/m1/s1	AHKBAATWJXKTGZ-OPYAIIAOSA-N	449.300204778							96843
MLS003129778	LSM-8338	BRD-K69930474, SID99358261	44486341	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25-/m1/s1	KFMYUMLTCHBBFY-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K69930474	BRD-K69930474-001-02-4	Broad Institute of MIT and Harvard	BRD-K69930474			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20-,25-/m1/s1	KFMYUMLTCHBBFY-UMEGOILYSA-N	529.23588996							96959
MLS003129139	LSM-8143	BRD-K13879491, SID99357480	44486342	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25+/m1/s1	KFMYUMLTCHBBFY-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K13879491	BRD-K13879491-001-02-9	Broad Institute of MIT and Harvard	BRD-K13879491			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C26H35N5O5S/c1-19-15-30(20(2)17-32)26(33)9-6-12-31-23(14-27-28-31)18-36-25(19)16-29(3)37(34,35)24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13-14,19-20,25,32H,6,9,12,15-18H2,1-3H3/t19-,20+,25+/m1/s1	KFMYUMLTCHBBFY-RNHFSVANSA-N	529.23588996							96764
BRD-K77901830	LSM-8364		44505019	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28-/m0/s1	PZMMCWSZGDQDET-LXWOLXCRSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K77901830	BRD-K77901830-001-01-6	Broad Institute of MIT and Harvard	BRD-K77901830			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28-/m0/s1	PZMMCWSZGDQDET-LXWOLXCRSA-N	505.305290158							96985
BRD-K69511939	LSM-8336		44506064	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22-/m1/s1	KWAFQNIHTBJTFB-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K69511939	BRD-K69511939-001-01-3	Broad Institute of MIT and Harvard	BRD-K69511939			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22-/m1/s1	KWAFQNIHTBJTFB-KGVIQGDOSA-N	497.261374598							96957
MLS003129776	LSM-8210	BRD-K35964632	44505560	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)10-23(15(3)12-25)18(26)7-6-8-24-16(13-29-17)9-20-21-24/h9,14-15,17,25H,5-8,10-13H2,1-4H3/t14-,15+,17+/m0/s1	LAJDOZVBLFDPKV-ZMSDIMECSA-N	CCOC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K35964632	BRD-K35964632-001-02-3	Broad Institute of MIT and Harvard	BRD-K35964632			CCOC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)10-23(15(3)12-25)18(26)7-6-8-24-16(13-29-17)9-20-21-24/h9,14-15,17,25H,5-8,10-13H2,1-4H3/t14-,15+,17+/m0/s1	LAJDOZVBLFDPKV-ZMSDIMECSA-N	411.248169206							96831
MLS003129129	LSM-8269	BRD-K52862624, SID99357470	44505181	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22+/m1/s1	MESWQEBVROHANN-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K52862624	BRD-K52862624-001-02-7	Broad Institute of MIT and Harvard	BRD-K52862624			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C24H35N5O4/c1-18-14-28(19(2)16-30)23(31)10-7-11-29-21(13-25-26-29)17-33-22(18)15-27(3)24(32)12-20-8-5-4-6-9-20/h4-6,8-9,13,18-19,22,30H,7,10-12,14-17H2,1-3H3/t18-,19+,22+/m1/s1	MESWQEBVROHANN-DXIQSLLYSA-N	457.26890465							96890
BRD-K27772696	LSM-8184		44505661	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18+,22+/m0/s1	ZTOSEQHRKGCZOZ-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K27772696	BRD-K27772696-001-01-5	Broad Institute of MIT and Harvard	BRD-K27772696			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)9-6-10-31-13-20(28-29-31)16-35-22(17)14-30(3)12-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,13,17-18,22,33H,6,9-12,14-16H2,1-3H3/t17-,18+,22+/m0/s1	ZTOSEQHRKGCZOZ-NJNPRVFISA-N	497.261374598							96805
BRD-K96390133	LSM-8418		44505909	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20-,23-/m0/s1	XSAFYGBYABXFOO-JTAQYXEDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K96390133	BRD-K96390133-001-01-3	Broad Institute of MIT and Harvard	BRD-K96390133			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20-,23-/m0/s1	XSAFYGBYABXFOO-JTAQYXEDSA-N	443.289640094							97039
BRD-K71353148	LSM-8344		44505660	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18+,22+/m0/s1	QZCZRKJJOTUXQW-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K71353148	BRD-K71353148-001-01-3	Broad Institute of MIT and Harvard	BRD-K71353148			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)9-6-10-32-20(11-28-29-32)16-35-22(17)14-30(3)13-19-7-4-5-8-21(19)24(25,26)27/h4-5,7-8,11,17-18,22,33H,6,9-10,12-16H2,1-3H3/t17-,18+,22+/m0/s1	QZCZRKJJOTUXQW-NJNPRVFISA-N	497.261374598							96965
BRD-K09584843	LSM-8136		44495970	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22-/m0/s1	QAXWADXATYBNKX-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K09584843	BRD-K09584843-001-01-8	Broad Institute of MIT and Harvard	BRD-K09584843			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)5-4-10-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-8-20(9-7-19)24(25,26)27/h6-9,13,17-18,22,33H,4-5,10-12,14-16H2,1-3H3/t17-,18-,22-/m0/s1	QAXWADXATYBNKX-SPEDKVCISA-N	497.261374598							96757
BRD-K01876557	LSM-8108		44494080	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	QXBLKCOAOVMUQM-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K01876557	BRD-K01876557-001-01-2	Broad Institute of MIT and Harvard	BRD-K01876557			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1	QXBLKCOAOVMUQM-DBXWQHBBSA-N	430.269239008							96729
MLS003129190	LSM-8258	BRD-K49457424, SID99357401	44505195	InChI=1S/C23H33N5O5/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-19(12-24-25-28)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18+,21-/m1/s1	VVYGNONDBDDRFX-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K49457424	BRD-K49457424-001-02-4	Broad Institute of MIT and Harvard	BRD-K49457424			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33N5O5/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-19(12-24-25-28)16-32-21(17)14-26(3)23(31)33-20-8-5-4-6-9-20/h4-6,8-9,12,17-18,21,29H,7,10-11,13-16H2,1-3H3/t17-,18+,21-/m1/s1	VVYGNONDBDDRFX-LVCYWYKZSA-N	459.248169206							96879
MLS003129114	LSM-8219	BRD-K38587340	44505751	InChI=1S/C23H39N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h12,17-19,21,29H,4-11,13-16H2,1-3H3/t17-,18+,21+/m1/s1	UQDZIKNGRITESQ-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCc3cnnn3CCCC1=O	BroadT	BRD-K38587340	BRD-K38587340-001-02-2	Broad Institute of MIT and Harvard	BRD-K38587340			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCc2cnnn2CCCC1=O	InChI=1S/C23H39N5O4/c1-17-13-27(18(2)15-29)22(30)10-7-11-28-20(12-24-25-28)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h12,17-19,21,29H,4-11,13-16H2,1-3H3/t17-,18+,21+/m1/s1	UQDZIKNGRITESQ-LQWHRVPQSA-N	449.300204778							96840
MLS003129648	LSM-8331	BRD-K68746558, SID99358050	44505596	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)5-4-10-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-8-6-18(24)7-9-19/h6-9,12,16-17,21,31H,4-5,10-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21+/m1/s1	IBNJZESYQXVKKB-LZJOCLMNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K68746558	BRD-K68746558-001-02-4	Broad Institute of MIT and Harvard	BRD-K68746558			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)5-4-10-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-8-6-18(24)7-9-19/h6-9,12,16-17,21,31H,4-5,10-11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21+/m1/s1	IBNJZESYQXVKKB-LZJOCLMNSA-N	476.254731796							96952
BRD-K07912534	LSM-8130		44490873	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18+,23+/m0/s1	ZLSVBQPGKZIPOU-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K07912534	BRD-K07912534-001-01-7	Broad Institute of MIT and Harvard	BRD-K07912534			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-10-29(18(2)14-30)24(31)5-4-8-28-12-20(25-26-28)15-32-23(17)13-27(3)11-19-6-7-21-22(9-19)34-16-33-21/h6-7,9,12,17-18,23,30H,4-5,8,10-11,13-16H2,1-3H3/t17-,18+,23+/m0/s1	ZLSVBQPGKZIPOU-YZZKKUAISA-N	473.26381927							96751
MLS003129208	LSM-8374	BRD-K80995081	44505072	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13+,15+/m1/s1	FOLOUAULJSJVDY-IPYPFGDCSA-N	CNC[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K80995081	BRD-K80995081-001-02-7	Broad Institute of MIT and Harvard	BRD-K80995081			CNC[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C16H29N5O3/c1-12-9-20(13(2)10-22)16(23)5-4-6-21-14(7-18-19-21)11-24-15(12)8-17-3/h7,12-13,15,17,22H,4-6,8-11H2,1-3H3/t12-,13+,15+/m1/s1	FOLOUAULJSJVDY-IPYPFGDCSA-N	339.227039838							96995
BRD-K22598343	LSM-8166		44506045	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18+,21-/m1/s1	BVMGYWBUQYFDAA-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K22598343	BRD-K22598343-001-01-6	Broad Institute of MIT and Harvard	BRD-K22598343			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18+,21-/m1/s1	BVMGYWBUQYFDAA-LVCYWYKZSA-N	430.269239008							96787
BRD-K25180881	LSM-8173		44506054	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22+/m0/s1	KWAFQNIHTBJTFB-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K25180881	BRD-K25180881-001-01-8	Broad Institute of MIT and Harvard	BRD-K25180881			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H34F3N5O3/c1-17-11-32(18(2)15-33)23(34)8-5-9-31-13-21(28-29-31)16-35-22(17)14-30(3)12-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10,13,17-18,22,33H,5,8-9,11-12,14-16H2,1-3H3/t17-,18+,22+/m0/s1	KWAFQNIHTBJTFB-NJNPRVFISA-N	497.261374598							96794
MLS003129672	LSM-8351	BRD-K73170797	44485747	InChI=1S/C23H33N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18+,21+/m1/s1	KNHKBBCFGVHHOP-LQWHRVPQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K73170797	BRD-K73170797-001-02-1	Broad Institute of MIT and Harvard	BRD-K73170797			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,29H,7,10-12,14-16H2,1-3H3/t17-,18+,21+/m1/s1	KNHKBBCFGVHHOP-LQWHRVPQSA-N	443.253254586							96972
MLS003129377	LSM-8129	BRD-K07833219	44505136	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22+/m1/s1	AWVASGRLDZTAAI-HMFYCAOWSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3	BroadT	BRD-K07833219	BRD-K07833219-001-02-5	Broad Institute of MIT and Harvard	BRD-K07833219			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C23H35N5O6S/c1-17-12-28(18(2)15-29)23(30)6-5-11-27-13-19(24-25-27)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,13,17-18,22,29H,5-6,11-12,14-16H2,1-4H3/t17-,18-,22+/m1/s1	AWVASGRLDZTAAI-HMFYCAOWSA-N	509.23080458							96750
SCHEMBL17487107	LSM-8369	BRD-K79676802	44505782	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)9-24(15(3)12-25)18(26)7-6-8-23-10-16(13-29-17)20-21-23/h10,14-15,17,25H,5-9,11-13H2,1-4H3/t14-,15-,17-/m0/s1	OBJUKURLMFMQOH-ZOBUZTSGSA-N	CCOC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	BroadT	BRD-K79676802	BRD-K79676802-001-01-6	Broad Institute of MIT and Harvard	BRD-K79676802			CCOC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C19H33N5O5/c1-5-28-19(27)22(4)11-17-14(2)9-24(15(3)12-25)18(26)7-6-8-23-10-16(13-29-17)20-21-23/h10,14-15,17,25H,5-9,11-13H2,1-4H3/t14-,15-,17-/m0/s1	OBJUKURLMFMQOH-ZOBUZTSGSA-N	411.248169206							96990
MLS003129106	LSM-8176	BRD-K26048698	44490304	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22-,26+/m1/s1	HFDOIJULVRDPRU-DRLORSAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N3CCCCC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K26048698	BRD-K26048698-001-02-7	Broad Institute of MIT and Harvard	BRD-K26048698			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)8-7-15-34-17-24(30-31-34)20-39-26(21)18-32(3)28(38)29-23-9-11-25(12-10-23)33-13-5-4-6-14-33/h9-12,17,21-22,26,36H,4-8,13-16,18-20H2,1-3H3,(H,29,38)/t21-,22-,26+/m1/s1	HFDOIJULVRDPRU-DRLORSAXSA-N	541.337652926							96797
BRD-K77140830	LSM-8361		44504963	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16-/m1/s1	PUHFBKBPROGAIN-IIAWOOMASA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K77140830	BRD-K77140830-001-01-1	Broad Institute of MIT and Harvard	BRD-K77140830			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14-,16-/m1/s1	PUHFBKBPROGAIN-IIAWOOMASA-N	417.204589832							96982
MLS003129633	LSM-8314	BRD-K64788035, SID99358041	44505853	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18-,23+/m1/s1	BKRQCUCZQROLSQ-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K64788035	BRD-K64788035-001-02-3	Broad Institute of MIT and Harvard	BRD-K64788035			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C25H36N6O6/c1-17-12-31(18(2)15-32)24(33)5-4-8-30-13-20(27-28-30)16-37-23(17)14-29(3)25(34)26-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11,13,17-18,23,32H,4-5,8-10,12,14-16H2,1-3H3,(H,26,34)/t17-,18-,23+/m1/s1	BKRQCUCZQROLSQ-PNCHPQGNSA-N	516.269632932							96935
MLS003129422	LSM-8244	BRD-K45028867	44485056	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26+/m1/s1	OIASBGFOQSUHIL-DRLORSAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K45028867	BRD-K45028867-001-02-1	Broad Institute of MIT and Harvard	BRD-K45028867			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22-,26+/m1/s1	OIASBGFOQSUHIL-DRLORSAXSA-N	541.337652926							96865
BRD-K48805168	LSM-8257		44505827	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21-/m1/s1	HYHIJLYQTCYSKX-DBXWQHBBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K48805168	BRD-K48805168-001-01-7	Broad Institute of MIT and Harvard	BRD-K48805168			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H34N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h4-6,8-9,13,17-18,21,30H,7,10-12,14-16H2,1-3H3,(H,24,32)/t17-,18-,21-/m1/s1	HYHIJLYQTCYSKX-DBXWQHBBSA-N	458.264153628							96878
BRD-K84836616	LSM-8384		44505888	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18+,22-/m0/s1	DXNYPMFBKGSJNE-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K84836616	BRD-K84836616-001-01-5	Broad Institute of MIT and Harvard	BRD-K84836616			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)8-5-9-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-4-7-20(10-19)24(25,26)27/h4,6-7,10-11,17-18,22,33H,5,8-9,12-16H2,1-3H3/t17-,18+,22-/m0/s1	DXNYPMFBKGSJNE-SVMVAKDDSA-N	497.261374598							97005
BRD-K05671817	LSM-8125		44505872	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18-,21-/m0/s1	BVMGYWBUQYFDAA-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K05671817	BRD-K05671817-001-01-9	Broad Institute of MIT and Harvard	BRD-K05671817			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc2cnnn2CCCC1=O	InChI=1S/C22H34N6O3/c1-17-12-27(18(2)15-29)22(30)7-5-9-28-20(11-24-25-28)16-31-21(17)14-26(3)13-19-6-4-8-23-10-19/h4,6,8,10-11,17-18,21,29H,5,7,9,12-16H2,1-3H3/t17-,18-,21-/m0/s1	BVMGYWBUQYFDAA-WFXMLNOXSA-N	430.269239008							96746
BRD-K60644933	LSM-8291		44488162	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19-,22-/m0/s1	AIVZVDBTBOXKNA-IPJJNNNSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K60644933	BRD-K60644933-001-01-7	Broad Institute of MIT and Harvard	BRD-K60644933			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h4-6,8-9,14,18-19,22,29H,7,10-13,15-17H2,1-3H3/t18-,19-,22-/m0/s1	AIVZVDBTBOXKNA-IPJJNNNSSA-N	429.27399003							96912
BRD-K51296348	LSM-8266		44488151	InChI=1S/C22H33N5O5S/c1-17-12-27(18(2)15-28)22(29)10-7-11-26-13-19(23-24-26)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,28H,7,10-12,14-16H2,1-3H3/t17-,18+,21-/m1/s1	BDEMCWTZQNVVEU-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K51296348	BRD-K51296348-001-01-6	Broad Institute of MIT and Harvard	BRD-K51296348			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H33N5O5S/c1-17-12-27(18(2)15-28)22(29)10-7-11-26-13-19(23-24-26)16-32-21(17)14-25(3)33(30,31)20-8-5-4-6-9-20/h4-6,8-9,13,17-18,21,28H,7,10-12,14-16H2,1-3H3/t17-,18+,21-/m1/s1	BDEMCWTZQNVVEU-LVCYWYKZSA-N	479.220239896							96887
BRD-K29128208	LSM-8187		44504987	InChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18+,21-/m0/s1	AHKBAATWJXKTGZ-UEXGIBASSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K29128208	BRD-K29128208-001-01-9	Broad Institute of MIT and Harvard	BRD-K29128208			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H39N5O4/c1-17-12-28(18(2)15-29)22(30)10-7-11-27-13-20(24-25-27)16-32-21(17)14-26(3)23(31)19-8-5-4-6-9-19/h13,17-19,21,29H,4-12,14-16H2,1-3H3/t17-,18+,21-/m0/s1	AHKBAATWJXKTGZ-UEXGIBASSA-N	449.300204778							96808
BRD-K53488735	LSM-8272		44486373	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19-,23-/m0/s1	AIDUMHXRFRBIIP-YDHSSHFGSA-N	COc1ccccc1CN(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K53488735	BRD-K53488735-001-01-8	Broad Institute of MIT and Harvard	BRD-K53488735			COc1ccccc1CN(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C24H37N5O4/c1-18-12-29(19(2)16-30)24(31)10-7-11-28-14-21(25-26-28)17-33-23(18)15-27(3)13-20-8-5-6-9-22(20)32-4/h5-6,8-9,14,18-19,23,30H,7,10-13,15-17H2,1-4H3/t18-,19-,23-/m0/s1	AIDUMHXRFRBIIP-YDHSSHFGSA-N	459.284554714							96893
BRD-K48053776	LSM-8252		44505883	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22+/m1/s1	HYDPWGICXZADLJ-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K48053776	BRD-K48053776-001-01-8	Broad Institute of MIT and Harvard	BRD-K48053776			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22+/m1/s1	HYDPWGICXZADLJ-HMFYCAOWSA-N	445.26890465							96873
MLS003129789	LSM-8385	SID99358269, BRD-K84992272	44505949	InChI=1S/C28H37N5O5S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-25(16-29-30-33)20-38-27(21)18-31(3)39(36,37)26-13-11-24(12-14-26)23-8-5-4-6-9-23/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22+,27+/m1/s1	BKQPNZMATHQHFX-VHSZZVNMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)c3ccccc3)OCc4cnnn4CCCC1=O	BroadT	BRD-K84992272	BRD-K84992272-001-02-9	Broad Institute of MIT and Harvard	BRD-K84992272			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)-c2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N5O5S/c1-21-17-32(22(2)19-34)28(35)10-7-15-33-25(16-29-30-33)20-38-27(21)18-31(3)39(36,37)26-13-11-24(12-14-26)23-8-5-4-6-9-23/h4-6,8-9,11-14,16,21-22,27,34H,7,10,15,17-20H2,1-3H3/t21-,22+,27+/m1/s1	BKQPNZMATHQHFX-VHSZZVNMSA-N	555.251540024							97006
BRD-K67197636	LSM-8323		44495967	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	QXBLKCOAOVMUQM-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K67197636	BRD-K67197636-001-01-9	Broad Institute of MIT and Harvard	BRD-K67197636			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)5-4-10-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-8-23-9-7-19/h6-9,13,17-18,21,29H,4-5,10-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	QXBLKCOAOVMUQM-WFXMLNOXSA-N	430.269239008							96944
BRD-K58010565	LSM-8286		44505628	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19+,22+/m1/s1	ZIMKOTFORJXDIC-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K58010565	BRD-K58010565-001-01-0	Broad Institute of MIT and Harvard	BRD-K58010565			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H41N5O3/c1-18-12-28(19(2)16-29)23(30)10-7-11-27-14-21(24-25-27)17-31-22(18)15-26(3)13-20-8-5-4-6-9-20/h14,18-20,22,29H,4-13,15-17H2,1-3H3/t18-,19+,22+/m1/s1	ZIMKOTFORJXDIC-DXIQSLLYSA-N	435.320940222							96907
BRD-K87010407	LSM-8394		44486348	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22+,26-/m1/s1	OIASBGFOQSUHIL-TVZXLZGTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N3CCN(C)CC3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K87010407	BRD-K87010407-001-01-7	Broad Institute of MIT and Harvard	BRD-K87010407			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H43N7O4/c1-21-16-35(22(2)19-36)27(37)6-5-11-34-17-24(29-30-34)20-39-26(21)18-32(4)28(38)23-7-9-25(10-8-23)33-14-12-31(3)13-15-33/h7-10,17,21-22,26,36H,5-6,11-16,18-20H2,1-4H3/t21-,22+,26-/m1/s1	OIASBGFOQSUHIL-TVZXLZGTSA-N	541.337652926							97015
BRD-K22865069	LSM-8168		44505584	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21-,25-/m1/s1	GHLJLHKVBJDFKH-DNRQZRRGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K22865069	BRD-K22865069-001-01-1	Broad Institute of MIT and Harvard	BRD-K22865069			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21-,25-/m1/s1	GHLJLHKVBJDFKH-DNRQZRRGSA-N	551.285617354							96789
BRD-K69011607	LSM-8333		44505622	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21-/m0/s1	VTXUSJLMEZRIOV-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K69011607	BRD-K69011607-001-01-5	Broad Institute of MIT and Harvard	BRD-K69011607			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33FN6O4/c1-16-11-30(17(2)14-31)22(32)8-5-9-29-12-20(26-27-29)15-34-21(16)13-28(3)23(33)25-19-7-4-6-18(24)10-19/h4,6-7,10,12,16-17,21,31H,5,8-9,11,13-15H2,1-3H3,(H,25,33)/t16-,17-,21-/m0/s1	VTXUSJLMEZRIOV-FIKGOQFSSA-N	476.254731796							96954
BRD-K40458025	LSM-8229		44506083	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19-,23-/m0/s1	GEARZFJDEYGDIT-YDHSSHFGSA-N	COc1cccc(CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K40458025	BRD-K40458025-001-01-6	Broad Institute of MIT and Harvard	BRD-K40458025			COc1cccc(CN(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)c1	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19-,23-/m0/s1	GEARZFJDEYGDIT-YDHSSHFGSA-N	459.284554714							96850
BRD-K63989441	LSM-8308		44505001	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25-/m0/s1	JATGFWCPGFHVCF-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K63989441	BRD-K63989441-001-01-8	Broad Institute of MIT and Harvard	BRD-K63989441			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C27H35N5O5/c1-19-14-32(20(2)17-33)26(34)9-6-12-31-15-23(28-29-31)18-36-25(19)16-30(3)27(35)37-24-11-10-21-7-4-5-8-22(21)13-24/h4-5,7-8,10-11,13,15,19-20,25,33H,6,9,12,14,16-18H2,1-3H3/t19-,20+,25-/m0/s1	JATGFWCPGFHVCF-DFIYOIEZSA-N	509.26381927							96929
BRD-K59995645	LSM-8288		44505213	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28+/m0/s1	PZMMCWSZGDQDET-UXWDXCIHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K59995645	BRD-K59995645-001-01-5	Broad Institute of MIT and Harvard	BRD-K59995645			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23-,28+/m0/s1	PZMMCWSZGDQDET-UXWDXCIHSA-N	505.305290158							96909
BRD-K61045425	LSM-8295		44486977	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13+,15+/m0/s1	DOGJCEWMCMFHOH-GZBFAFLISA-N	CNC[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K61045425	BRD-K61045425-001-01-1	Broad Institute of MIT and Harvard	BRD-K61045425			CNC[C@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@H](C)CO)nn2	InChI=1S/C16H29N5O3/c1-12-8-21(13(2)10-22)16(23)5-4-6-20-9-14(18-19-20)11-24-15(12)7-17-3/h9,12-13,15,17,22H,4-8,10-11H2,1-3H3/t12-,13+,15+/m0/s1	DOGJCEWMCMFHOH-GZBFAFLISA-N	339.227039838							96916
MLS003129124	LSM-8382	BRD-K84277608	44505532	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19+,21+/m1/s1	BGKHIKCFNCIYGU-DYXWJJEUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K84277608	BRD-K84277608-001-02-0	Broad Institute of MIT and Harvard	BRD-K84277608			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O5S/c1-17-8-5-6-9-22(17)34(31,32)26(4)14-21-18(2)12-28(19(3)15-29)23(30)10-7-11-27-13-20(16-33-21)24-25-27/h5-6,8-9,13,18-19,21,29H,7,10-12,14-16H2,1-4H3/t18-,19+,21+/m1/s1	BGKHIKCFNCIYGU-DYXWJJEUSA-N	493.23588996							97003
MLS003129178	LSM-8424	BRD-K98758861	44497248	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22-/m0/s1	IZYFSJYDPLTURU-SPEDKVCISA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K98758861	BRD-K98758861-001-02-5	Broad Institute of MIT and Harvard	BRD-K98758861			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)9-6-10-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-8-5-7-20(11-21)33-4/h5,7-8,11-12,17-18,22,29H,6,9-10,13-16H2,1-4H3/t17-,18-,22-/m0/s1	IZYFSJYDPLTURU-SPEDKVCISA-N	509.23080458							97045
BRD-K30937833	LSM-8191		44488163	InChI=1S/C23H35N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,29H,7,10-11,13-17H2,1-3H3/t18-,19+,22-/m1/s1	AYVSZOBZIZEFEA-XQBPLPMBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K30937833	BRD-K30937833-001-01-3	Broad Institute of MIT and Harvard	BRD-K30937833			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,29H,7,10-11,13-17H2,1-3H3/t18-,19+,22-/m1/s1	AYVSZOBZIZEFEA-XQBPLPMBSA-N	429.27399003							96812
BRD-K33968993	LSM-8204		44495444	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18+,22-/m1/s1	DMKVVNQLOZTLAB-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K33968993	BRD-K33968993-001-01-1	Broad Institute of MIT and Harvard	BRD-K33968993			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18+,22-/m1/s1	DMKVVNQLOZTLAB-KGVIQGDOSA-N	497.261374598							96825
BRD-K54834493	LSM-8277		44505257	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20+,23+/m1/s1	XSAFYGBYABXFOO-QTEQDKRBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K54834493	BRD-K54834493-001-01-4	Broad Institute of MIT and Harvard	BRD-K54834493			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-9-21(10-8-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)6-5-11-28-14-22(17-32-23)25-26-28/h7-10,14,19-20,23,30H,5-6,11-13,15-17H2,1-4H3/t19-,20+,23+/m1/s1	XSAFYGBYABXFOO-QTEQDKRBSA-N	443.289640094							96898
MLS003129602	LSM-8148	BRD-K15489726, SID99358013	44506006	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25+/m0/s1	GHLJLHKVBJDFKH-BPYKYCOYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K15489726	BRD-K15489726-001-02-2	Broad Institute of MIT and Harvard	BRD-K15489726			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25+/m0/s1	GHLJLHKVBJDFKH-BPYKYCOYSA-N	551.285617354							96769
MLS003129122	LSM-8206	BRD-K34556006	44497710	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18+,22+/m0/s1	QVFRXOMYJDWMPT-NJNPRVFISA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K34556006	BRD-K34556006-001-02-6	Broad Institute of MIT and Harvard	BRD-K34556006			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H35N5O6S/c1-17-13-27(18(2)15-29)23(30)6-5-11-28-19(12-24-25-28)16-34-22(17)14-26(3)35(31,32)21-9-7-20(33-4)8-10-21/h7-10,12,17-18,22,29H,5-6,11,13-16H2,1-4H3/t17-,18+,22+/m0/s1	QVFRXOMYJDWMPT-NJNPRVFISA-N	509.23080458							96827
CHEMBL2145374	LSM-8304	BRD-K62853937, SID85812565	44505460	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18-,23+/m0/s1	NYFKVVDOCVTYTM-IUKKYPGJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K62853937	BRD-K62853937-001-01-8	Broad Institute of MIT and Harvard	BRD-K62853937			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H36N6O6/c1-17-13-30(18(2)15-32)24(33)5-4-8-31-20(12-26-28-31)16-37-23(17)14-29(3)25(34)27-19-6-7-21-22(11-19)36-10-9-35-21/h6-7,11-12,17-18,23,32H,4-5,8-10,13-16H2,1-3H3,(H,27,34)/t17-,18-,23+/m0/s1	NYFKVVDOCVTYTM-IUKKYPGJSA-N	516.269632932							96925
BRD-K45740917	LSM-8246		44505043	InChI=1S/C25H37N5O5/c1-18-13-29(19(2)16-31)25(32)5-4-8-30-21(12-26-27-30)17-35-24(18)15-28(3)14-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11-12,18-19,24,31H,4-5,8-10,13-17H2,1-3H3/t18-,19+,24-/m0/s1	KKGFASYBCNAVFA-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K45740917	BRD-K45740917-001-01-3	Broad Institute of MIT and Harvard	BRD-K45740917			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H37N5O5/c1-18-13-29(19(2)16-31)25(32)5-4-8-30-21(12-26-27-30)17-35-24(18)15-28(3)14-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11-12,18-19,24,31H,4-5,8-10,13-17H2,1-3H3/t18-,19+,24-/m0/s1	KKGFASYBCNAVFA-GLDPYIMESA-N	487.279469334							96867
MLS003129206	LSM-8310	BRD-K64418254, SID85813048, SID99357416	44505943	InChI=1S/C28H37N5O5S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-25(29-30-32)20-38-27(21)18-31(3)39(36,37)26-13-11-24(12-14-26)23-8-5-4-6-9-23/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22+,27+/m0/s1	KKXDONJUIJKAIN-OREGWCPLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K64418254	BRD-K64418254-001-02-1	Broad Institute of MIT and Harvard	BRD-K64418254			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N5O5S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-25(29-30-32)20-38-27(21)18-31(3)39(36,37)26-13-11-24(12-14-26)23-8-5-4-6-9-23/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22+,27+/m0/s1	KKXDONJUIJKAIN-OREGWCPLSA-N	555.251540024							96931
SCHEMBL17487093	LSM-8299	BRD-K61900762	44485049	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15+,18-/m0/s1	HEIBNMHSSNMFIU-DAYGRLMNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K61900762	BRD-K61900762-001-01-8	Broad Institute of MIT and Harvard	BRD-K61900762			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C20H33N5O4/c1-14-9-25(15(2)12-26)19(27)5-4-8-24-10-17(21-22-24)13-29-18(14)11-23(3)20(28)16-6-7-16/h10,14-16,18,26H,4-9,11-13H2,1-3H3/t14-,15+,18-/m0/s1	HEIBNMHSSNMFIU-DAYGRLMNSA-N	407.253254586							96920
MLS003129796	LSM-24048	BRD-K75008101	44505583	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25-/m0/s1	GHLJLHKVBJDFKH-BKSPAHHJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K75008101	BRD-K75008101-001-02-2	Broad Institute of MIT and Harvard	BRD-K75008101			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O	InChI=1S/C28H37N7O5/c1-20-16-34(21(2)18-36)27(37)11-7-13-35-23(15-30-32-35)19-39-25(20)17-33(3)28(38)31-22-8-6-9-24(14-22)40-26-10-4-5-12-29-26/h4-6,8-10,12,14-15,20-21,25,36H,7,11,13,16-19H2,1-3H3,(H,31,38)/t20-,21+,25-/m0/s1	GHLJLHKVBJDFKH-BKSPAHHJSA-N	551.285617354							112638
BRD-K77053712	LSM-8360		44505836	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21-/m0/s1	QOPMKJNNAFOQDN-FIKGOQFSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K77053712	BRD-K77053712-001-01-9	Broad Institute of MIT and Harvard	BRD-K77053712			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H33F3N6O4/c1-16-11-33(17(2)14-34)22(35)8-5-9-32-12-20(29-30-32)15-37-21(16)13-31(3)23(36)28-19-7-4-6-18(10-19)24(25,26)27/h4,6-7,10,12,16-17,21,34H,5,8-9,11,13-15H2,1-3H3,(H,28,36)/t16-,17-,21-/m0/s1	QOPMKJNNAFOQDN-FIKGOQFSSA-N	526.251538196							96981
BRD-K54061956	LSM-8273		54631254	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22-,28-/m1/s1	UVZKFWVLTKDOOG-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K54061956	BRD-K54061956-001-01-4	Broad Institute of MIT and Harvard	BRD-K54061956			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)OCc2cn(CCCC1=O)nn2	InChI=1S/C30H41N7O4/c1-21-15-37(22(2)19-38)29(39)9-6-14-36-17-25(33-34-36)20-41-28(21)18-35(3)16-23-10-12-24(13-11-23)30(40)32-27-8-5-4-7-26(27)31/h4-5,7-8,10-13,17,21-22,28,38H,6,9,14-16,18-20,31H2,1-3H3,(H,32,40)/t21-,22-,28-/m1/s1	UVZKFWVLTKDOOG-DQCZWYHMSA-N	563.322002862							96894
BRD-K43160803	LSM-8239		44498145	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28-/m0/s1	PZMMCWSZGDQDET-JWZKTCGFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)c3ccccc3)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K43160803	BRD-K43160803-001-01-3	Broad Institute of MIT and Harvard	BRD-K43160803			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)-c2ccccc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C29H39N5O3/c1-22-16-34(23(2)20-35)29(36)10-7-15-33-18-27(30-31-33)21-37-28(22)19-32(3)17-24-11-13-26(14-12-24)25-8-5-4-6-9-25/h4-6,8-9,11-14,18,22-23,28,35H,7,10,15-17,19-21H2,1-3H3/t22-,23+,28-/m0/s1	PZMMCWSZGDQDET-JWZKTCGFSA-N	505.305290158							96860
BRD-K39464795	LSM-8224		44485763	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17-,22+/m1/s1	ATJIIPBEGAKQFE-YVHKJVDXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K39464795	BRD-K39464795-001-01-5	Broad Institute of MIT and Harvard	BRD-K39464795			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H33Cl2N5O3/c1-16-10-30(17(2)14-31)23(32)5-4-8-29-12-19(26-27-29)15-33-22(16)13-28(3)11-18-6-7-20(24)21(25)9-18/h6-7,9,12,16-17,22,31H,4-5,8,10-11,13-15H2,1-3H3/t16-,17-,22+/m1/s1	ATJIIPBEGAKQFE-YVHKJVDXSA-N	497.196045386							96845
MLS003129266	LSM-8103	BRD-K00480552	44494071	InChI=1S/C28H37N5O6S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-23(29-30-32)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22+,27+/m1/s1	SYWTUHWEQAODFK-VHSZZVNMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc4cn(CCCC1=O)nn4	BroadT	BRD-K00480552	BRD-K00480552-001-02-7	Broad Institute of MIT and Harvard	BRD-K00480552			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C28H37N5O6S/c1-21-16-33(22(2)19-34)28(35)10-7-15-32-17-23(29-30-32)20-38-27(21)18-31(3)40(36,37)26-13-11-25(12-14-26)39-24-8-5-4-6-9-24/h4-6,8-9,11-14,17,21-22,27,34H,7,10,15-16,18-20H2,1-3H3/t21-,22+,27+/m1/s1	SYWTUHWEQAODFK-VHSZZVNMSA-N	571.246454644							96724
BRD-K93972090	LSM-8409		44505814	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)6-5-11-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-9-21(34-4)10-8-19/h7-10,13,17-18,22,31H,5-6,11-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22-/m1/s1	OFOUXQSPHPQRAF-JBYIUTFZSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)cc1	BroadT	BRD-K93972090	BRD-K93972090-001-01-2	Broad Institute of MIT and Harvard	BRD-K93972090			COc1ccc(NC(=O)N(C)C[C@H]2OCc3cn(CCCC(=O)N(C[C@H]2C)[C@H](C)CO)nn3)cc1	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)6-5-11-29-13-20(26-27-29)16-35-22(17)14-28(3)24(33)25-19-7-9-21(34-4)10-8-19/h7-10,13,17-18,22,31H,5-6,11-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22-/m1/s1	OFOUXQSPHPQRAF-JBYIUTFZSA-N	488.274718312							97030
BRD-K06492185	LSM-8127		44505778	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)9-25(16(4)12-26)19(27)7-6-8-24-10-17(13-29-18)21-22-24/h10,14-16,18,26H,6-9,11-13H2,1-5H3/t15-,16-,18-/m1/s1	FYUBIBUWDYYNKH-JFIYKMOQSA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	BroadT	BRD-K06492185	BRD-K06492185-001-01-3	Broad Institute of MIT and Harvard	BRD-K06492185			CC(C)OC(=O)N(C)C[C@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@H](C)CO)nn2	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)9-25(16(4)12-26)19(27)7-6-8-24-10-17(13-29-18)21-22-24/h10,14-16,18,26H,6-9,11-13H2,1-5H3/t15-,16-,18-/m1/s1	FYUBIBUWDYYNKH-JFIYKMOQSA-N	425.26381927							96748
BRD-K63270352	LSM-8307		44505228	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20+,23-/m0/s1	MEJUTVOAQGGYHA-MZKRTTBSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K63270352	BRD-K63270352-001-01-0	Broad Institute of MIT and Harvard	BRD-K63270352			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20+,23-/m0/s1	MEJUTVOAQGGYHA-MZKRTTBSSA-N	443.289640094							96928
MLS003129494	LSM-8120	BRD-K03937518, SID99357827	44487415	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22+/m1/s1	VOGIWUFDXLFNKS-DXIQSLLYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K03937518	BRD-K03937518-001-02-6	Broad Institute of MIT and Harvard	BRD-K03937518			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H35N5O5/c1-17-7-9-21(10-8-17)34-24(32)27(4)14-22-18(2)12-29(19(3)15-30)23(31)6-5-11-28-13-20(16-33-22)25-26-28/h7-10,13,18-19,22,30H,5-6,11-12,14-16H2,1-4H3/t18-,19+,22+/m1/s1	VOGIWUFDXLFNKS-DXIQSLLYSA-N	473.26381927							96741
BRD-K08185175	LSM-8131		44505252	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19-,23-/m1/s1	GEARZFJDEYGDIT-DNVFCKCGSA-N	COc1cccc(CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)c1	BroadT	BRD-K08185175	BRD-K08185175-001-01-3	Broad Institute of MIT and Harvard	BRD-K08185175			COc1cccc(CN(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@H]2C)[C@H](C)CO)c1	InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19-,23-/m1/s1	GEARZFJDEYGDIT-DNVFCKCGSA-N	459.284554714							96752
BRD-K29285912	LSM-8188		44497256	InChI=1S/C25H37N5O5/c1-18-13-29(19(2)16-31)25(32)5-4-8-30-21(12-26-27-30)17-35-24(18)15-28(3)14-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11-12,18-19,24,31H,4-5,8-10,13-17H2,1-3H3/t18-,19+,24-/m1/s1	KKGFASYBCNAVFA-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCCOc3c2)OCc4cnnn4CCCC1=O	BroadT	BRD-K29285912	BRD-K29285912-001-01-4	Broad Institute of MIT and Harvard	BRD-K29285912			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cnnn2CCCC1=O	InChI=1S/C25H37N5O5/c1-18-13-29(19(2)16-31)25(32)5-4-8-30-21(12-26-27-30)17-35-24(18)15-28(3)14-20-6-7-22-23(11-20)34-10-9-33-22/h6-7,11-12,18-19,24,31H,4-5,8-10,13-17H2,1-3H3/t18-,19+,24-/m1/s1	KKGFASYBCNAVFA-YDIMBITNSA-N	487.279469334							96809
BRD-K28927944	LSM-8186		44505802	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21-/m1/s1	APDMZOWNVCUUKT-LVCYWYKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K28927944	BRD-K28927944-001-01-4	Broad Institute of MIT and Harvard	BRD-K28927944			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H40N6O4/c1-17-12-29(18(2)15-30)22(31)10-7-11-28-13-20(25-26-28)16-33-21(17)14-27(3)23(32)24-19-8-5-4-6-9-19/h13,17-19,21,30H,4-12,14-16H2,1-3H3,(H,24,32)/t17-,18+,21-/m1/s1	APDMZOWNVCUUKT-LVCYWYKZSA-N	464.31110382							96807
BRD-K71741980	LSM-8346		44495441	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28-/m0/s1	CUSMSBFNEHNGNQ-JWZKTCGFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc4cnnn4CCCC1=O	BroadT	BRD-K71741980	BRD-K71741980-001-01-0	Broad Institute of MIT and Harvard	BRD-K71741980			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O	InChI=1S/C29H39N5O4/c1-22-17-33(23(2)20-35)29(36)10-7-15-34-25(16-30-31-34)21-37-28(22)19-32(3)18-24-11-13-27(14-12-24)38-26-8-5-4-6-9-26/h4-6,8-9,11-14,16,22-23,28,35H,7,10,15,17-21H2,1-3H3/t22-,23+,28-/m0/s1	CUSMSBFNEHNGNQ-JWZKTCGFSA-N	521.300204778							96967
MLS003129348	LSM-8413	BRD-K95105171, SID99357658	44505581	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25-/m1/s1	WIMCLPXWPPGBKL-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc4cnnn4CCCC1=O	BroadT	BRD-K95105171	BRD-K95105171-001-02-7	Broad Institute of MIT and Harvard	BRD-K95105171			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O	InChI=1S/C27H35N5O5/c1-19-15-31(20(2)17-33)26(34)12-7-13-32-22(14-28-29-32)18-36-25(19)16-30(3)27(35)37-24-11-6-9-21-8-4-5-10-23(21)24/h4-6,8-11,14,19-20,25,33H,7,12-13,15-18H2,1-3H3/t19-,20-,25-/m1/s1	WIMCLPXWPPGBKL-UMEGOILYSA-N	509.26381927							97034
BRD-K83456424	LSM-8380		44505631	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22-/m0/s1	ZODITPIVHHGZAH-SPEDKVCISA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3cn(CCCC(=O)N(C[C@@H]2C)[C@@H](C)CO)nn3	BroadT	BRD-K83456424	BRD-K83456424-001-01-5	Broad Institute of MIT and Harvard	BRD-K83456424			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO)nn2	InChI=1S/C24H36N6O5/c1-17-12-30(18(2)15-31)23(32)10-7-11-29-13-19(26-27-29)16-35-22(17)14-28(3)24(33)25-20-8-5-6-9-21(20)34-4/h5-6,8-9,13,17-18,22,31H,7,10-12,14-16H2,1-4H3,(H,25,33)/t17-,18-,22-/m0/s1	ZODITPIVHHGZAH-SPEDKVCISA-N	488.274718312							97001
BRD-K52718919	LSM-8268		44492585	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18+,22-/m0/s1	DMKVVNQLOZTLAB-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc3cnnn3CCCC1=O	BroadT	BRD-K52718919	BRD-K52718919-001-01-7	Broad Institute of MIT and Harvard	BRD-K52718919			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(F)(F)F)OCc2cnnn2CCCC1=O	InChI=1S/C24H34F3N5O3/c1-17-12-31(18(2)15-33)23(34)5-4-10-32-21(11-28-29-32)16-35-22(17)14-30(3)13-19-6-8-20(9-7-19)24(25,26)27/h6-9,11,17-18,22,33H,4-5,10,12-16H2,1-3H3/t17-,18+,22-/m0/s1	DMKVVNQLOZTLAB-SVMVAKDDSA-N	497.261374598							96889
BRD-K33755346	LSM-8200		44505023	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	QSHHTQCGWZKCKD-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K33755346	BRD-K33755346-001-01-6	Broad Institute of MIT and Harvard	BRD-K33755346			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc2cn(CCCC1=O)nn2	InChI=1S/C22H34N6O3/c1-17-11-28(18(2)15-29)22(30)7-5-9-27-13-20(24-25-27)16-31-21(17)14-26(3)12-19-6-4-8-23-10-19/h4,6,8,10,13,17-18,21,29H,5,7,9,11-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	QSHHTQCGWZKCKD-WFXMLNOXSA-N	430.269239008							96821
BRD-K70681322	LSM-8340		44505740	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16-/m1/s1	PUHFBKBPROGAIN-IJEWVQPXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2cn(CCCC1=O)nn2	BroadT	BRD-K70681322	BRD-K70681322-001-01-6	Broad Institute of MIT and Harvard	BRD-K70681322			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2cn(CCCC1=O)nn2	InChI=1S/C17H31N5O5S/c1-13-8-22(14(2)11-23)17(24)6-5-7-21-9-15(18-19-21)12-27-16(13)10-20(3)28(4,25)26/h9,13-14,16,23H,5-8,10-12H2,1-4H3/t13-,14+,16-/m1/s1	PUHFBKBPROGAIN-IJEWVQPXSA-N	417.204589832							96961
BRD-K32040163	LSM-8194		44505041	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22-/m1/s1	HYDPWGICXZADLJ-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K32040163	BRD-K32040163-001-01-4	Broad Institute of MIT and Harvard	BRD-K32040163			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C23H35N5O4/c1-17-11-28(18(2)15-29)23(31)8-5-9-27-13-20(24-25-27)16-32-22(17)14-26(3)12-19-6-4-7-21(30)10-19/h4,6-7,10,13,17-18,22,29-30H,5,8-9,11-12,14-16H2,1-3H3/t17-,18-,22-/m1/s1	HYDPWGICXZADLJ-JBYIUTFZSA-N	445.26890465							96815
BRD-K40958081	LSM-8231		44505863	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17-,22-/m0/s1	FSJQCDSATLDVBC-HOIFWPIMSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc3cnnn3CCCC1=O	BroadT	BRD-K40958081	BRD-K40958081-001-01-6	Broad Institute of MIT and Harvard	BRD-K40958081			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)OCc2cnnn2CCCC1=O	InChI=1S/C23H33Cl2N5O3/c1-16-11-29(17(2)14-31)23(32)5-4-8-30-19(10-26-27-30)15-33-22(16)13-28(3)12-18-6-7-20(24)21(25)9-18/h6-7,9-10,16-17,22,31H,4-5,8,11-15H2,1-3H3/t16-,17-,22-/m0/s1	FSJQCDSATLDVBC-HOIFWPIMSA-N	497.196045386							96852
BRD-K33394674	LSM-8197		44491458	InChI=1S/C23H35N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,29H,7,10-11,13-17H2,1-3H3/t18-,19+,22-/m0/s1	AYVSZOBZIZEFEA-JQVVWYNYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCc3cnnn3CCCC1=O	BroadT	BRD-K33394674	BRD-K33394674-001-01-6	Broad Institute of MIT and Harvard	BRD-K33394674			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCc2cnnn2CCCC1=O	InChI=1S/C23H35N5O3/c1-18-13-27(19(2)16-29)23(30)10-7-11-28-21(12-24-25-28)17-31-22(18)15-26(3)14-20-8-5-4-6-9-20/h4-6,8-9,12,18-19,22,29H,7,10-11,13-17H2,1-3H3/t18-,19+,22-/m0/s1	AYVSZOBZIZEFEA-JQVVWYNYSA-N	429.27399003							96818
BRD-K74109371	LSM-8352		44506070	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20-,23-/m1/s1	MEJUTVOAQGGYHA-TXTKFYIRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(C)c2)OCc3cn(CCCC1=O)nn3	BroadT	BRD-K74109371	BRD-K74109371-001-01-4	Broad Institute of MIT and Harvard	BRD-K74109371			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(C)c2)OCc2cn(CCCC1=O)nn2	InChI=1S/C24H37N5O3/c1-18-7-5-8-21(11-18)13-27(4)15-23-19(2)12-29(20(3)16-30)24(31)9-6-10-28-14-22(17-32-23)25-26-28/h5,7-8,11,14,19-20,23,30H,6,9-10,12-13,15-17H2,1-4H3/t19-,20-,23-/m1/s1	MEJUTVOAQGGYHA-TXTKFYIRSA-N	443.289640094							96973
BRD-K24204732	LSM-29044		44619516	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33-/m1/s1	NGSMHOKAGHIENU-HYHRRZRMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K24204732	BRD-K24204732-001-01-8	Broad Institute of MIT and Harvard	BRD-K24204732			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27+,33-/m1/s1	NGSMHOKAGHIENU-HYHRRZRMSA-N	623.404669846001							117595
BRD-K36064145	LSM-29045		44490949	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20-,24+/m1/s1	JFWSYQFTTWMPPF-FIXDAVPBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K36064145	BRD-K36064145-001-01-3	Broad Institute of MIT and Harvard	BRD-K36064145			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20-,24+/m1/s1	JFWSYQFTTWMPPF-FIXDAVPBSA-N	545.307656074							117596
BRD-K37092508	LSM-29046		44616992	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24+,29-/m1/s1	YZLWJGCKUGDXHR-IDCDSMMUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K37092508	BRD-K37092508-001-01-4	Broad Institute of MIT and Harvard	BRD-K37092508			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24+,29-/m1/s1	YZLWJGCKUGDXHR-IDCDSMMUSA-N	560.393770804							117597
BRD-K32471649	LSM-29047		54614725	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24+,29+/m0/s1	XPIAMQJKSFNCJS-PHBCIFJZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K32471649	BRD-K32471649-001-01-5	Broad Institute of MIT and Harvard	BRD-K32471649			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24+,29+/m0/s1	XPIAMQJKSFNCJS-PHBCIFJZSA-N	603.2978215							117598
CHEMBL3186105	LSM-29048	BRD-K22478004	54614753	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28-/m0/s1	KDWFAOIYLGHTDK-WENLUUPESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	BroadT	BRD-K22478004	BRD-K22478004-001-01-1	Broad Institute of MIT and Harvard	BRD-K22478004			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28-/m0/s1	KDWFAOIYLGHTDK-WENLUUPESA-N	579.277834984							117599
BRD-K36042673	LSM-29049		44490913	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m0/s1	LQSMEYMBJWSEPC-WYNJNVBPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K36042673	BRD-K36042673-001-01-9	Broad Institute of MIT and Harvard	BRD-K36042673			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m0/s1	LQSMEYMBJWSEPC-WYNJNVBPSA-N	525.320271506							117600
BRD-K26817071	LSM-15027		54614768	InChI=1S/C26H45N3O6S/c1-7-13-28(5)17-25-19(2)16-29(20(3)18-30)26(31)23-15-22(27-36(6,32)33)11-12-24(23)35-21(4)10-8-9-14-34-25/h11-12,15,19-21,25,27,30H,7-10,13-14,16-18H2,1-6H3/t19-,20-,21-,25+/m1/s1	ZOEMVRGQCOXOOR-YCFYUYSTSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K26817071	BRD-K26817071-001-01-4	Broad Institute of MIT and Harvard	BRD-K26817071			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C26H45N3O6S/c1-7-13-28(5)17-25-19(2)16-29(20(3)18-30)26(31)23-15-22(27-36(6,32)33)11-12-24(23)35-21(4)10-8-9-14-34-25/h11-12,15,19-21,25,27,30H,7-10,13-14,16-18H2,1-6H3/t19-,20-,21-,25+/m1/s1	ZOEMVRGQCOXOOR-YCFYUYSTSA-N	527.30290688							103683
BRD-K26196953	LSM-29050		54614763	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22+,23-,28+/m1/s1	NMRMJZSCUHLPQY-KRHPZPPWSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)CC3CC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K26196953	BRD-K26196953-001-01-6	Broad Institute of MIT and Harvard	BRD-K26196953			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)CC3CC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22+,23-,28+/m1/s1	NMRMJZSCUHLPQY-KRHPZPPWSA-N	546.37812074							117601
BRD-K31059159	LSM-29051		49843211	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23-,24+,29+/m1/s1	IMDGVULVCKQBDZ-CHCBTGSZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K31059159	BRD-K31059159-001-01-1	Broad Institute of MIT and Harvard	BRD-K31059159			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23-,24+,29+/m1/s1	IMDGVULVCKQBDZ-CHCBTGSZSA-N	539.33592157							117602
BRD-K34095629	LSM-15133		44619203	InChI=1S/C33H47FN4O5/c1-22-18-38(23(2)21-39)32(40)29-17-28(36-33(41)35-27-12-10-26(34)11-13-27)14-15-30(29)43-24(3)7-5-6-16-42-31(22)20-37(4)19-25-8-9-25/h10-15,17,22-25,31,39H,5-9,16,18-21H2,1-4H3,(H2,35,36,41)/t22-,23+,24-,31+/m1/s1	STYUMYTXFXXJJW-WDCHQWTNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc3C1=O	BroadT	BRD-K34095629	BRD-K34095629-001-01-4	Broad Institute of MIT and Harvard	BRD-K34095629			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C33H47FN4O5/c1-22-18-38(23(2)21-39)32(40)29-17-28(36-33(41)35-27-12-10-26(34)11-13-27)14-15-30(29)43-24(3)7-5-6-16-42-31(22)20-37(4)19-25-8-9-25/h10-15,17,22-25,31,39H,5-9,16,18-21H2,1-4H3,(H2,35,36,41)/t22-,23+,24-,31+/m1/s1	STYUMYTXFXXJJW-WDCHQWTNSA-N	598.353048844							103789
BRD-K25495404	LSM-29052		44490956	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24-,29+/m1/s1	QUSLWNNTNFDPAB-XTGAJNFRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K25495404	BRD-K25495404-001-01-8	Broad Institute of MIT and Harvard	BRD-K25495404			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24-,29+/m1/s1	QUSLWNNTNFDPAB-XTGAJNFRSA-N	545.382871762							117603
BRD-K39052671	LSM-29053		44617764	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m1/s1	IDICBOGPMQOFGC-VUKRRIEASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K39052671	BRD-K39052671-001-01-7	Broad Institute of MIT and Harvard	BRD-K39052671			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32-/m1/s1	IDICBOGPMQOFGC-VUKRRIEASA-N	616.326085168							117604
BRD-K28029070	LSM-29054		54614778	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22+,27-/m0/s1	AOLQWFIMADKXQA-FEEANGJJSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K28029070	BRD-K28029070-001-01-5	Broad Institute of MIT and Harvard	BRD-K28029070			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22+,27-/m0/s1	AOLQWFIMADKXQA-FEEANGJJSA-N	511.304621442							117605
BRD-K28299335	LSM-29055		44616562	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24+,29-/m0/s1	CWMFJYTZROJEEY-OODISRMCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K28299335	BRD-K28299335-001-01-5	Broad Institute of MIT and Harvard	BRD-K28299335			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23-,24+,29-/m0/s1	CWMFJYTZROJEEY-OODISRMCSA-N	622.33420518							117606
BRD-K27416453	LSM-29056		44494970	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24+/m0/s1	PQNWFIFCFFWMJI-AZXNSQLWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K27416453	BRD-K27416453-001-01-2	Broad Institute of MIT and Harvard	BRD-K27416453			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24+/m0/s1	PQNWFIFCFFWMJI-AZXNSQLWSA-N	449.325356886							117607
BRD-K31533112	LSM-29057		54614790	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21+,27+/m0/s1	QNMRQELCDYNENZ-FRUANSSVSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K31533112	BRD-K31533112-001-01-1	Broad Institute of MIT and Harvard	BRD-K31533112			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20-,21+,27+/m0/s1	QNMRQELCDYNENZ-FRUANSSVSA-N	544.306098652							117608
BRD-K32723442	LSM-29058		54614726	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29+/m0/s1	XPIAMQJKSFNCJS-HNFJUSDZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K32723442	BRD-K32723442-001-01-8	Broad Institute of MIT and Harvard	BRD-K32723442			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24-,29+/m0/s1	XPIAMQJKSFNCJS-HNFJUSDZSA-N	603.2978215							117609
BRD-K23316636	LSM-29059		54614757	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20+,24+/m1/s1	ORDOAKKGIRZCMJ-FDGPYGQJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K23316636	BRD-K23316636-001-01-8	Broad Institute of MIT and Harvard	BRD-K23316636			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20+,24+/m1/s1	ORDOAKKGIRZCMJ-FDGPYGQJSA-N	513.287256816							117610
BRD-K26481999	LSM-29060		54614765	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23-,28+/m1/s1	DKJIIKWCTXJSNY-IZXSZHORSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K26481999	BRD-K26481999-001-01-8	Broad Institute of MIT and Harvard	BRD-K26481999			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23-,28+/m1/s1	DKJIIKWCTXJSNY-IZXSZHORSA-N	561.287256816							117611
BRD-K25322276	LSM-29061		54614760	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24-,29+/m1/s1	PRCUBQSECBZBSK-HZTMJRFTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K25322276	BRD-K25322276-001-01-9	Broad Institute of MIT and Harvard	BRD-K25322276			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24-,29+/m1/s1	PRCUBQSECBZBSK-HZTMJRFTSA-N	575.30290688							117612
BRD-K20447569	LSM-29062		44618645	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17+,18-,22-/m1/s1	GOTBAIXNEHVFNA-WYADAEROSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K20447569	BRD-K20447569-001-01-5	Broad Institute of MIT and Harvard	BRD-K20447569			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17+,18-,22-/m1/s1	GOTBAIXNEHVFNA-WYADAEROSA-N	485.255956688							117613
BRD-K34929471	LSM-29063		44490860	InChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16+,17+,21+/m0/s1	XRGBJGDCXQTJDT-BIZBXSGISA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(N)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K34929471	BRD-K34929471-001-01-3	Broad Institute of MIT and Harvard	BRD-K34929471			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(N)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16+,17+,21+/m0/s1	XRGBJGDCXQTJDT-BIZBXSGISA-N	407.278406694							117614
BRD-K38719699	LSM-29064		44501067	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22+,23+,29+/m0/s1	PSEUFYCSFOBFBF-KAMGSVSWSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K38719699	BRD-K38719699-001-01-0	Broad Institute of MIT and Harvard	BRD-K38719699			COc1ccc(NC(=O)Nc2ccc3O[C@H](C)CCCCO[C@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22+,23+,29+/m0/s1	PSEUFYCSFOBFBF-KAMGSVSWSA-N	570.341735232							117615
BRD-K38977317	LSM-29065		44504035	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,29+/m0/s1	MEJMTXOOFVGIJM-KAMGSVSWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K38977317	BRD-K38977317-001-01-6	Broad Institute of MIT and Harvard	BRD-K38977317			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23+,29+/m0/s1	MEJMTXOOFVGIJM-KAMGSVSWSA-N	593.293485048							117616
BRD-K36910796	LSM-15073		44503610	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30+/m0/s1	RSKGZFLSRBPJST-RZDWVWPCSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K36910796	BRD-K36910796-001-01-9	Broad Institute of MIT and Harvard	BRD-K36910796			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30+/m0/s1	RSKGZFLSRBPJST-RZDWVWPCSA-N	617.41523453							103729
BRD-K28269391	LSM-29066		54614780	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28-/m1/s1	KDWFAOIYLGHTDK-SITKICAQSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	BroadT	BRD-K28269391	BRD-K28269391-001-01-9	Broad Institute of MIT and Harvard	BRD-K28269391			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28-/m1/s1	KDWFAOIYLGHTDK-SITKICAQSA-N	579.277834984							117617
BRD-K37658621	LSM-29067		49843216	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25+,26+,32+/m1/s1	JCVAFPCEYZSYDX-UJFVLINRSA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K37658621	BRD-K37658621-001-01-4	Broad Institute of MIT and Harvard	BRD-K37658621			COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25+,26+,32+/m1/s1	JCVAFPCEYZSYDX-UJFVLINRSA-N	612.388685424							117618
BRD-K25658788	LSM-29068		44620188	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24+,25-,31+/m0/s1	HLAXWBUNQRUQJP-TXHDDHBJSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	BroadT	BRD-K25658788	BRD-K25658788-001-01-7	Broad Institute of MIT and Harvard	BRD-K25658788			COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24+,25-,31+/m0/s1	HLAXWBUNQRUQJP-TXHDDHBJSA-N	555.367221698							117619
BRD-K27139040	LSM-29069		54614772	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23-,24+,29-/m1/s1	IMDGVULVCKQBDZ-IDCDSMMUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K27139040	BRD-K27139040-001-01-0	Broad Institute of MIT and Harvard	BRD-K27139040			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23-,24+,29-/m1/s1	IMDGVULVCKQBDZ-IDCDSMMUSA-N	539.33592157							117620
BRD-K24659381	LSM-29070		44487554	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28+/m1/s1	OWRRZEUGKXIWTQ-KRHPZPPWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K24659381	BRD-K24659381-001-01-7	Broad Institute of MIT and Harvard	BRD-K24659381			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28+/m1/s1	OWRRZEUGKXIWTQ-KRHPZPPWSA-N	540.331170548							117621
BRD-K21652644-001-01-8	LSM-29071	BRD-K21652644	44495456	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23-,24-,29-/m1/s1	VOOFHSDUWYITSP-RWJVBYDYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K21652644	BRD-K21652644-001-01-8	Broad Institute of MIT and Harvard	BRD-K21652644			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23-,24-,29-/m1/s1	VOOFHSDUWYITSP-RWJVBYDYSA-N	603.2978215							117622
BRD-K22193148	LSM-29072		54614752	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23-,28+/m1/s1	BJJOMMAJAORXGV-KRHPZPPWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K22193148	BRD-K22193148-001-01-3	Broad Institute of MIT and Harvard	BRD-K22193148			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23-,28+/m1/s1	BJJOMMAJAORXGV-KRHPZPPWSA-N	595.329121628							117623
BRD-K31987278	LSM-29073		44494906	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23+,24+,28+/m0/s1	FCDOAUZTELHSSL-GOIZPCHYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K31987278	BRD-K31987278-001-01-9	Broad Institute of MIT and Harvard	BRD-K31987278			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23+,24+,28+/m0/s1	FCDOAUZTELHSSL-GOIZPCHYSA-N	548.393770804							117624
BRD-K25709301	LSM-29074		54614761	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24-,30-/m1/s1	XIVCQDXGZVVHDO-UTSVKBTJSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K25709301	BRD-K25709301-001-01-6	Broad Institute of MIT and Harvard	BRD-K25709301			COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(NS(C)(=O)=O)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24-,30-/m1/s1	XIVCQDXGZVVHDO-UTSVKBTJSA-N	605.313471564							117625
BRD-K28694162	LSM-29075		54614781	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22+,23-,30+/m1/s1	SIEZSLVXLUPDNY-QMXNRGECSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K28694162	BRD-K28694162-001-01-5	Broad Institute of MIT and Harvard	BRD-K28694162			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22+,23-,30+/m1/s1	SIEZSLVXLUPDNY-QMXNRGECSA-N	598.336649852							117626
BRD-K30022119	LSM-29076		44498079	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33+/m0/s1	LFCBJIZGBQWHQM-ZJXZHUIYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K30022119	BRD-K30022119-001-01-9	Broad Institute of MIT and Harvard	BRD-K30022119			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33+/m0/s1	LFCBJIZGBQWHQM-ZJXZHUIYSA-N	602.346820612							117627
BRD-K38189984	LSM-29077		44494977	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24+,29+/m0/s1	ZQLCRBSTGDSWQO-PHBCIFJZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K38189984	BRD-K38189984-001-01-0	Broad Institute of MIT and Harvard	BRD-K38189984			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H46N4O4/c1-22-18-34(23(2)21-35)30(36)27-17-26(32(4)5)10-11-28(27)38-24(3)9-7-8-16-37-29(22)20-33(6)19-25-12-14-31-15-13-25/h10-15,17,22-24,29,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24+,29+/m0/s1	ZQLCRBSTGDSWQO-PHBCIFJZSA-N	526.351905992							117628
BRD-K23954220	LSM-29078		44496022	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22-,27+/m0/s1	JMPHEZKYQLUQMM-GHIUXRNCSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K23954220	BRD-K23954220-001-01-8	Broad Institute of MIT and Harvard	BRD-K23954220			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22-,27+/m0/s1	JMPHEZKYQLUQMM-GHIUXRNCSA-N	517.351571634							117629
BRD-K31337291	LSM-29079		54614787	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33-/m1/s1	FHYFYPZRCDKSKV-GLPSKGHJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K31337291	BRD-K31337291-001-01-0	Broad Institute of MIT and Harvard	BRD-K31337291			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33-/m1/s1	FHYFYPZRCDKSKV-GLPSKGHJSA-N	608.393770804							117630
BRD-K27178321	LSM-29080		54614773	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23+,24-,30+/m0/s1	IYJPIDGCXVWPNR-WUBQMYJQSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	BroadT	BRD-K27178321	BRD-K27178321-001-01-8	Broad Institute of MIT and Harvard	BRD-K27178321			COc1ccc(NC(=O)N(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23+,24-,30+/m0/s1	IYJPIDGCXVWPNR-WUBQMYJQSA-N	584.357385296							117631
BRD-K38669793	LSM-29081		44488217	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28+/m0/s1	LQSMEYMBJWSEPC-KKQCDPINSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K38669793	BRD-K38669793-001-01-2	Broad Institute of MIT and Harvard	BRD-K38669793			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28+/m0/s1	LQSMEYMBJWSEPC-KKQCDPINSA-N	525.320271506							117632
BRD-K37657772	LSM-29082		44617756	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21+,22-,26-/m1/s1	KFCLPYACNRFGCM-UXGLMHHASA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	BroadT	BRD-K37657772	BRD-K37657772-001-01-3	Broad Institute of MIT and Harvard	BRD-K37657772			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C27H47N3O4/c1-8-14-29(7)18-26-20(2)17-30(21(3)19-31)27(32)24-16-23(28(5)6)12-13-25(24)34-22(4)11-9-10-15-33-26/h12-13,16,20-22,26,31H,8-11,14-15,17-19H2,1-7H3/t20-,21+,22-,26-/m1/s1	KFCLPYACNRFGCM-UXGLMHHASA-N	477.356657014							117633
BRD-K23112275	LSM-29083		44487393	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20+,21+,27+/m0/s1	PQVSIMSGGSSCRI-ZAACQVCWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K23112275	BRD-K23112275-001-01-7	Broad Institute of MIT and Harvard	BRD-K23112275			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20+,21+,27+/m0/s1	PQVSIMSGGSSCRI-ZAACQVCWSA-N	594.308720542							117634
BRD-K34489277	LSM-29084		44486979	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28-,33-/m0/s1	YHPMBPSGDQLXHP-YENKVUBUSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K34489277	BRD-K34489277-001-01-4	Broad Institute of MIT and Harvard	BRD-K34489277			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28-,33-/m0/s1	YHPMBPSGDQLXHP-YENKVUBUSA-N	610.409420868							117635
BRD-K37830990	LSM-29085		44617748	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27-/m1/s1	OPIQAKQROYPQNZ-MYCJUQKNSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K37830990	BRD-K37830990-001-01-2	Broad Institute of MIT and Harvard	BRD-K37830990			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27-/m1/s1	OPIQAKQROYPQNZ-MYCJUQKNSA-N	565.26218492							117636
BRD-K34595616	LSM-29086		44493113	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32-/m0/s1	LKIIRWUIYHEPDR-GMKFGHRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K34595616	BRD-K34595616-001-01-8	Broad Institute of MIT and Harvard	BRD-K34595616			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32-/m0/s1	LKIIRWUIYHEPDR-GMKFGHRTSA-N	622.37303536							117637
BRD-K31602464	LSM-29087		44492100	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20-,21+,25-/m1/s1	IUWUHICBQVKRRR-NAZDKBRTSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K31602464	BRD-K31602464-001-01-8	Broad Institute of MIT and Harvard	BRD-K31602464			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20-,21+,25-/m1/s1	IUWUHICBQVKRRR-NAZDKBRTSA-N	559.323306138							117638
BRD-K31503053	LSM-29088		54614789	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,27-/m0/s1	QNMRQELCDYNENZ-WFQVPWNOSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K31503053	BRD-K31503053-001-01-5	Broad Institute of MIT and Harvard	BRD-K31503053			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,27-/m0/s1	QNMRQELCDYNENZ-WFQVPWNOSA-N	544.306098652							117639
BRD-K38494391	LSM-29089		44494569	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29+/m1/s1	KAHNNCGHTWSOBA-HZTMJRFTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K38494391	BRD-K38494391-001-01-1	Broad Institute of MIT and Harvard	BRD-K38494391			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29+/m1/s1	KAHNNCGHTWSOBA-HZTMJRFTSA-N	554.346820612							117640
CHEMBL3182925	LSM-29090	BRD-K33939287	49843059	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25+,30+/m1/s1	ZGCRSIABJPRXFC-ZRIOWSNCSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K33939287	BRD-K33939287-001-01-7	Broad Institute of MIT and Harvard	BRD-K33939287			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25+,30+/m1/s1	ZGCRSIABJPRXFC-ZRIOWSNCSA-N	553.351571634							117641
BRD-K26187220	LSM-29091		44620145	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24-,29-/m1/s1	CWMFJYTZROJEEY-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K26187220	BRD-K26187220-001-01-2	Broad Institute of MIT and Harvard	BRD-K26187220			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24-,29-/m1/s1	CWMFJYTZROJEEY-CDLOMYRSSA-N	622.33420518							117642
MLS003128791	LSM-10295	BRD-K30940328, SID99359141	44502225	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23+,24+,30+/m0/s1	IYJPIDGCXVWPNR-QXFFIUSXSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	BroadT	BRD-K30940328	BRD-K30940328-001-01-9	Broad Institute of MIT and Harvard	BRD-K30940328			COc1ccc(NC(=O)N(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23+,24+,30+/m0/s1	IYJPIDGCXVWPNR-QXFFIUSXSA-N	584.357385296							98916
BRD-K24907498	LSM-29092		44487515	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22+,27+/m1/s1	FBKKOHUHBUWDTB-HLIRBWCUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K24907498	BRD-K24907498-001-01-0	Broad Institute of MIT and Harvard	BRD-K24907498			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22+,27+/m1/s1	FBKKOHUHBUWDTB-HLIRBWCUSA-N	526.315520484							117643
BRD-K36170990	LSM-29093		44494617	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23-,24-,29+/m1/s1	VOOFHSDUWYITSP-XTGAJNFRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K36170990	BRD-K36170990-001-01-4	Broad Institute of MIT and Harvard	BRD-K36170990			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23-,24-,29+/m1/s1	VOOFHSDUWYITSP-XTGAJNFRSA-N	603.2978215							117644
BRD-K34931072	LSM-29094		44487511	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20+,24+/m1/s1	LBVOXJOHMPITGR-XUJKJYMVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K34931072	BRD-K34931072-001-01-2	Broad Institute of MIT and Harvard	BRD-K34931072			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19+,20+,24+/m1/s1	LBVOXJOHMPITGR-XUJKJYMVSA-N	609.269556004							117645
BRD-K38165718	LSM-29095		44489331	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24-,29-/m0/s1	QUSLWNNTNFDPAB-MVPDCNEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K38165718	BRD-K38165718-001-01-3	Broad Institute of MIT and Harvard	BRD-K38165718			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24-,29-/m0/s1	QUSLWNNTNFDPAB-MVPDCNEZSA-N	545.382871762							117646
BRD-K29707171	LSM-29096		44487536	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24-,29+/m1/s1	SEDRIVHSDUVLLE-HZTMJRFTSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K29707171	BRD-K29707171-001-01-3	Broad Institute of MIT and Harvard	BRD-K29707171			CC(C)NC(=O)N(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24-,29+/m1/s1	SEDRIVHSDUVLLE-HZTMJRFTSA-N	597.352634274							117647
BRD-K24950073	LSM-29097		44489746	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28-/m0/s1	VTJNXDUZLOWMHH-FPZRTEDSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K24950073	BRD-K24950073-001-01-3	Broad Institute of MIT and Harvard	BRD-K24950073			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28-/m0/s1	VTJNXDUZLOWMHH-FPZRTEDSSA-N	531.367221698							117648
BRD-K31788299	LSM-15032		44485144	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20+,21+,27+/m1/s1	PQVSIMSGGSSCRI-GMAGDTKFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K31788299	BRD-K31788299-001-01-6	Broad Institute of MIT and Harvard	BRD-K31788299			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20+,21+,27+/m1/s1	PQVSIMSGGSSCRI-GMAGDTKFSA-N	594.308720542							103688
BRD-K35635568	LSM-29098		44486407	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28-/m1/s1	OWRRZEUGKXIWTQ-JTNFPWQOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K35635568	BRD-K35635568-001-01-9	Broad Institute of MIT and Harvard	BRD-K35635568			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28-/m1/s1	OWRRZEUGKXIWTQ-JTNFPWQOSA-N	540.331170548							117649
BRD-K34639619-001-01-1	LSM-6804	BRD9619, SD-6-035-A1	44618423	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24-,31+/m0/s1	WIYHORLWMFSPCL-ILSPQUDCSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K34639619	BRD-K34639619-001-01-1	Broad Institute of MIT and Harvard	BRD-K34639619			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23-,24-,31+/m0/s1	WIYHORLWMFSPCL-ILSPQUDCSA-N	569.346486254							95425
BRD-K30566330	LSM-29099		44490395	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20+,21-,26+/m1/s1	UGHRLCJQQBYBPV-MAUQACMESA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K30566330	BRD-K30566330-001-01-8	Broad Institute of MIT and Harvard	BRD-K30566330			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20+,21-,26+/m1/s1	UGHRLCJQQBYBPV-MAUQACMESA-N	512.29987042							117650
BRD-K37454185	LSM-29100		44485121	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28-,33+/m0/s1	YHPMBPSGDQLXHP-ZPBGSLHZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K37454185	BRD-K37454185-001-01-6	Broad Institute of MIT and Harvard	BRD-K37454185			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28-,33+/m0/s1	YHPMBPSGDQLXHP-ZPBGSLHZSA-N	610.409420868							117651
BRD-K37906141	LSM-29101		44617686	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23-,24+,30+/m1/s1	OKIGVZMNGZVCJM-UCTCLUAXSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)N(C)C	BroadT	BRD-K37906141	BRD-K37906141-001-01-8	Broad Institute of MIT and Harvard	BRD-K37906141			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23-,24+,30+/m1/s1	OKIGVZMNGZVCJM-UCTCLUAXSA-N	605.313471564							117652
BRD-K31897694	LSM-29102		44497269	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25-,26+,32-/m0/s1	JCVAFPCEYZSYDX-ZQIYOYMASA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K31897694	BRD-K31897694-001-01-6	Broad Institute of MIT and Harvard	BRD-K31897694			COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25-,26+,32-/m0/s1	JCVAFPCEYZSYDX-ZQIYOYMASA-N	612.388685424							117653
BRD-K27239120-001-01-1	LSM-6802	SD-6-035-A11, BRD9120	49843318	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24-,31-/m0/s1	WIYHORLWMFSPCL-PKWXPSSRSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K27239120	BRD-K27239120-001-01-1	Broad Institute of MIT and Harvard	BRD-K27239120			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-17-35(23(2)20-36)32(37)27-16-26(33(4)5)11-13-28(27)41-24(3)9-7-8-14-38-31(22)19-34(6)18-25-10-12-29-30(15-25)40-21-39-29/h10-13,15-16,22-24,31,36H,7-9,14,17-21H2,1-6H3/t22-,23+,24-,31-/m0/s1	WIYHORLWMFSPCL-PKWXPSSRSA-N	569.346486254							95423
BRD-K38932508	LSM-29103		44495052	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27+/m1/s1	JMPHEZKYQLUQMM-RYBWSMFQSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K38932508	BRD-K38932508-001-01-0	Broad Institute of MIT and Harvard	BRD-K38932508			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27+/m1/s1	JMPHEZKYQLUQMM-RYBWSMFQSA-N	517.351571634							117654
BRD-K35828963	LSM-29104		44619142	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25+,30-/m1/s1	ZGCRSIABJPRXFC-UBRKHCEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K35828963	BRD-K35828963-001-01-1	Broad Institute of MIT and Harvard	BRD-K35828963			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25+,30-/m1/s1	ZGCRSIABJPRXFC-UBRKHCEVSA-N	553.351571634							117655
BRD-K34018387	LSM-29105		54614728	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22-,23+,27-/m1/s1	MTZUJVYQNWSRMQ-IQXSCUCBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K34018387	BRD-K34018387-001-01-8	Broad Institute of MIT and Harvard	BRD-K34018387			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22-,23+,27-/m1/s1	MTZUJVYQNWSRMQ-IQXSCUCBSA-N	598.34002067							117656
BRD-K28691459	LSM-29106		44490933	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20+,21+,26+/m1/s1	UGHRLCJQQBYBPV-FUSMBFRDSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K28691459	BRD-K28691459-001-01-3	Broad Institute of MIT and Harvard	BRD-K28691459			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20+,21+,26+/m1/s1	UGHRLCJQQBYBPV-FUSMBFRDSA-N	512.29987042							117657
BRD-K37724316	LSM-29107		44617559	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24-,29+/m0/s1	CWMFJYTZROJEEY-HNFJUSDZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K37724316	BRD-K37724316-001-01-4	Broad Institute of MIT and Harvard	BRD-K37724316			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24-,29+/m0/s1	CWMFJYTZROJEEY-HNFJUSDZSA-N	622.33420518							117658
BRD-K36713925	LSM-29108		44487550	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19-,23+/m1/s1	HNAHSZOZZNPVNF-KCESLBEFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K36713925	BRD-K36713925-001-01-1	Broad Institute of MIT and Harvard	BRD-K36713925			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19-,23+/m1/s1	HNAHSZOZZNPVNF-KCESLBEFSA-N	499.271606752							117659
BRD-K20690715	LSM-29109		44620558	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33-/m1/s1	FHYFYPZRCDKSKV-JIXXDEQJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K20690715	BRD-K20690715-001-01-3	Broad Institute of MIT and Harvard	BRD-K20690715			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27+,33-/m1/s1	FHYFYPZRCDKSKV-JIXXDEQJSA-N	608.393770804							117660
BRD-K21996934	LSM-29110		44502960	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24+,25+,29-/m0/s1	NSUWFWDPIIGHAU-RTAAPDIRSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K21996934	BRD-K21996934-001-01-8	Broad Institute of MIT and Harvard	BRD-K21996934			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24+,25+,29-/m0/s1	NSUWFWDPIIGHAU-RTAAPDIRSA-N	562.409420868							117661
BRD-K29238078	LSM-29111		44616862	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23-,24+,30-/m1/s1	YDCDOYMHDVYTIM-HTWFIQDWSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K29238078	BRD-K29238078-001-01-3	Broad Institute of MIT and Harvard	BRD-K29238078			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23-,24+,30-/m1/s1	YDCDOYMHDVYTIM-HTWFIQDWSA-N	566.346820612							117662
BRD-K39192716	LSM-29112		44620654	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27-/m0/s1	WPSSTONNMATWEF-WFQVPWNOSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K39192716	BRD-K39192716-001-01-8	Broad Institute of MIT and Harvard	BRD-K39192716			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27-/m0/s1	WPSSTONNMATWEF-WFQVPWNOSA-N	581.23263443							117663
BRD-K29163534	LSM-29113		44484561	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21-,22-,27-/m0/s1	FBKKOHUHBUWDTB-LFYAFONDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K29163534	BRD-K29163534-001-01-1	Broad Institute of MIT and Harvard	BRD-K29163534			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21-,22-,27-/m0/s1	FBKKOHUHBUWDTB-LFYAFONDSA-N	526.315520484							117664
BRD-K36176998	LSM-29114		44486403	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20+,21-,27-/m1/s1	AQPDNHSQVUKPGE-FGCFSOHPSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K36176998	BRD-K36176998-001-01-3	Broad Institute of MIT and Harvard	BRD-K36176998			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20+,21-,27-/m1/s1	AQPDNHSQVUKPGE-FGCFSOHPSA-N	573.352634274							117665
BRD-K35711197	LSM-29115		44504710	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33+/m0/s1	FHYFYPZRCDKSKV-ZJXZHUIYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K35711197	BRD-K35711197-001-01-7	Broad Institute of MIT and Harvard	BRD-K35711197			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33+/m0/s1	FHYFYPZRCDKSKV-ZJXZHUIYSA-N	608.393770804							117666
BRD-K38737333	LSM-29116		44493651	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19-,23-/m1/s1	AHFPIWRBAUHSCU-FZONSQQESA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	BroadT	BRD-K38737333	BRD-K38737333-001-01-4	Broad Institute of MIT and Harvard	BRD-K38737333			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C24H41N3O4/c1-17-15-27(18(2)16-28)24(29)21-13-20(26(5)6)10-11-22(21)31-19(3)9-7-8-12-30-23(17)14-25-4/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18-,19-,23-/m1/s1	AHFPIWRBAUHSCU-FZONSQQESA-N	435.309706822							117667
BRD-K30632097	LSM-29117		44616783	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,28+/m1/s1	DZFCVSNNMFSZPA-CHJPEORGSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K30632097	BRD-K30632097-001-01-1	Broad Institute of MIT and Harvard	BRD-K30632097			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,28+/m1/s1	DZFCVSNNMFSZPA-CHJPEORGSA-N	570.305349724							117668
BRD-K36241360	LSM-29118		44501788	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26+,27+,32+/m0/s1	ZMTJRORPEDZKCY-MYECLKKLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K36241360	BRD-K36241360-001-01-5	Broad Institute of MIT and Harvard	BRD-K36241360			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26+,27+,32+/m0/s1	ZMTJRORPEDZKCY-MYECLKKLSA-N	624.388685424							117669
BRD-K32131036	LSM-29119		44617182	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23-,24+,30+/m1/s1	IYJPIDGCXVWPNR-UCTCLUAXSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)N(C)C)cc1	BroadT	BRD-K32131036	BRD-K32131036-001-01-6	Broad Institute of MIT and Harvard	BRD-K32131036			COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)N(C)C)cc1	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23-,24+,30+/m1/s1	IYJPIDGCXVWPNR-UCTCLUAXSA-N	584.357385296							117670
BRD-K29460044	LSM-29120		44620300	InChI=1S/C31H46FN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23-,24-,30+/m0/s1	ZDQGJCPJPDTJMO-ZUHGBKBGSA-N	CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K29460044	BRD-K29460044-001-01-4	Broad Institute of MIT and Harvard	BRD-K29460044			CCCN(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C31H46FN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23-,24-,30+/m0/s1	ZDQGJCPJPDTJMO-ZUHGBKBGSA-N	607.309135112							117671
BRD-K20969558	LSM-29121		54614748	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25+,26-,32-/m0/s1	IJPCFLZWEMVLEC-FBIDWWCOSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C1=O	BroadT	BRD-K20969558	BRD-K20969558-001-01-1	Broad Institute of MIT and Harvard	BRD-K20969558			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25+,26-,32-/m0/s1	IJPCFLZWEMVLEC-FBIDWWCOSA-N	615.334207008							117672
BRD-K30379413	LSM-29122		44485127	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28+,33+/m0/s1	YHPMBPSGDQLXHP-JDONGJSOSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K30379413	BRD-K30379413-001-01-6	Broad Institute of MIT and Harvard	BRD-K30379413			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27-,28+,33+/m0/s1	YHPMBPSGDQLXHP-JDONGJSOSA-N	610.409420868							117673
BRD-K23628938	LSM-29123		44487457	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20+,21-,27+/m0/s1	AQPDNHSQVUKPGE-ZZWZOVRCSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K23628938	BRD-K23628938-001-01-1	Broad Institute of MIT and Harvard	BRD-K23628938			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20+,21-,27+/m0/s1	AQPDNHSQVUKPGE-ZZWZOVRCSA-N	573.352634274							117674
BRD-K29081238	LSM-15029		54614783	InChI=1S/C29H47N5O6S/c1-7-13-32(5)17-27-21(2)16-34(22(3)19-35)29(36)25-15-24(31-41(37,38)28-18-33(6)20-30-28)11-12-26(25)40-23(4)10-8-9-14-39-27/h11-12,15,18,20-23,27,31,35H,7-10,13-14,16-17,19H2,1-6H3/t21-,22-,23+,27+/m0/s1	IKHNOPCXKIAMPI-OJXRJRMYSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K29081238	BRD-K29081238-001-01-4	Broad Institute of MIT and Harvard	BRD-K29081238			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H47N5O6S/c1-7-13-32(5)17-27-21(2)16-34(22(3)19-35)29(36)25-15-24(31-41(37,38)28-18-33(6)20-30-28)11-12-26(25)40-23(4)10-8-9-14-39-27/h11-12,15,18,20-23,27,31,35H,7-10,13-14,16-17,19H2,1-6H3/t21-,22-,23+,27+/m0/s1	IKHNOPCXKIAMPI-OJXRJRMYSA-N	593.324704964							103685
BRD-K29525414	LSM-29124		44496445	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23-,28-/m0/s1	BJJOMMAJAORXGV-KYALDGGBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K29525414	BRD-K29525414-001-01-6	Broad Institute of MIT and Harvard	BRD-K29525414			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23-,28-/m0/s1	BJJOMMAJAORXGV-KYALDGGBSA-N	595.329121628							117675
BRD-K33783177	LSM-29125		44502477	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28+/m0/s1	XHZKQAVNDGMQPU-TUEWKVEFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K33783177	BRD-K33783177-001-01-2	Broad Institute of MIT and Harvard	BRD-K33783177			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28+/m0/s1	XHZKQAVNDGMQPU-TUEWKVEFSA-N	589.282171436							117676
BRD-K38342865	LSM-29126		44487452	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19-,20+,24+/m0/s1	LBVOXJOHMPITGR-PWSZPPJVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K38342865	BRD-K38342865-001-01-9	Broad Institute of MIT and Harvard	BRD-K38342865			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19-,20+,24+/m0/s1	LBVOXJOHMPITGR-PWSZPPJVSA-N	609.269556004							117677
BRD-K34254821	LSM-29127		44484584	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20-,21+,27-/m0/s1	AQPDNHSQVUKPGE-GRWWNZOSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K34254821	BRD-K34254821-001-01-3	Broad Institute of MIT and Harvard	BRD-K34254821			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20-,21+,27-/m0/s1	AQPDNHSQVUKPGE-GRWWNZOSSA-N	573.352634274							117678
BRD-K27540772	LSM-29128		44489849	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28-/m0/s1	LQSMEYMBJWSEPC-AMZZYFJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K27540772	BRD-K27540772-001-01-3	Broad Institute of MIT and Harvard	BRD-K27540772			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23-,28-/m0/s1	LQSMEYMBJWSEPC-AMZZYFJHSA-N	525.320271506							117679
BRD-K26208451	LSM-29129		44498492	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17+,18+,22-/m0/s1	GOTBAIXNEHVFNA-FBAVSBLXSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K26208451	BRD-K26208451-001-01-6	Broad Institute of MIT and Harvard	BRD-K26208451			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17+,18+,22-/m0/s1	GOTBAIXNEHVFNA-FBAVSBLXSA-N	485.255956688							117680
BRD-K38630090	LSM-29130		54614739	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23+,28+/m0/s1	DKJIIKWCTXJSNY-HIAVRWOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K38630090	BRD-K38630090-001-01-4	Broad Institute of MIT and Harvard	BRD-K38630090			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23+,28+/m0/s1	DKJIIKWCTXJSNY-HIAVRWOZSA-N	561.287256816							117681
BRD-K37213205	LSM-29131		44617675	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22+,23+,27+/m1/s1	MTZUJVYQNWSRMQ-GGLGADRISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K37213205	BRD-K37213205-001-01-2	Broad Institute of MIT and Harvard	BRD-K37213205			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22+,23+,27+/m1/s1	MTZUJVYQNWSRMQ-GGLGADRISA-N	598.34002067							117682
MLS003128793	LSM-10005	BRD-K25997353, SID99359143	44496475	InChI=1S/C28H48N4O5/c1-20-18-32(21(2)19-33)28(35)24-16-23(30-27(34)11-9-14-31(5)6)12-13-25(24)37-22(3)10-7-8-15-36-26(20)17-29-4/h12-13,16,20-22,26,29,33H,7-11,14-15,17-19H2,1-6H3,(H,30,34)/t20-,21+,22-,26+/m0/s1	SBFFLWUBRLNFSF-IMIIHFCZSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K25997353	BRD-K25997353-001-01-4	Broad Institute of MIT and Harvard	BRD-K25997353			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H48N4O5/c1-20-18-32(21(2)19-33)28(35)24-16-23(30-27(34)11-9-14-31(5)6)12-13-25(24)37-22(3)10-7-8-15-36-26(20)17-29-4/h12-13,16,20-22,26,29,33H,7-11,14-15,17-19H2,1-6H3,(H,30,34)/t20-,21+,22-,26+/m0/s1	SBFFLWUBRLNFSF-IMIIHFCZSA-N	520.362470676							98626
BRD-K28522188	LSM-29132		44489744	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22+,27-/m0/s1	FBKKOHUHBUWDTB-HQKZVIGLSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K28522188	BRD-K28522188-001-01-8	Broad Institute of MIT and Harvard	BRD-K28522188			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22+,27-/m0/s1	FBKKOHUHBUWDTB-HQKZVIGLSA-N	526.315520484							117683
BRD-K26570871	LSM-29133		54614767	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27+/m0/s1	OPIQAKQROYPQNZ-ZZWZOVRCSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K26570871	BRD-K26570871-001-01-1	Broad Institute of MIT and Harvard	BRD-K26570871			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27+/m0/s1	OPIQAKQROYPQNZ-ZZWZOVRCSA-N	565.26218492							117684
BRD-K33573676	LSM-29134		44489886	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24-,25-,32+/m1/s1	HBVPERRGRWZCML-XIZCIETRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	BroadT	BRD-K33573676	BRD-K33573676-001-01-3	Broad Institute of MIT and Harvard	BRD-K33573676			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24-,25-,32+/m1/s1	HBVPERRGRWZCML-XIZCIETRSA-N	590.346820612							117685
BRD-K29011844	LSM-29135		44620729	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22-,23+,28+/m1/s1	NMRMJZSCUHLPQY-DHMIZTNRSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)CC3CC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K29011844	BRD-K29011844-001-01-7	Broad Institute of MIT and Harvard	BRD-K29011844			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)CC3CC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C30H50N4O5/c1-20(2)31-30(37)32-25-12-13-27-26(15-25)29(36)34(22(4)19-35)16-21(3)28(18-33(6)17-24-10-11-24)38-14-8-7-9-23(5)39-27/h12-13,15,20-24,28,35H,7-11,14,16-19H2,1-6H3,(H2,31,32,37)/t21-,22-,23+,28+/m1/s1	NMRMJZSCUHLPQY-DHMIZTNRSA-N	546.37812074							117686
BRD-K28598371	LSM-29136		44616999	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22-,23+,27-/m1/s1	XJLXIOLTLBOFKC-IQXSCUCBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K28598371	BRD-K28598371-001-01-5	Broad Institute of MIT and Harvard	BRD-K28598371			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22-,23+,27-/m1/s1	XJLXIOLTLBOFKC-IQXSCUCBSA-N	598.34002067							117687
CHEMBL2360191	LSM-29137	SID85811668, BRD-K21544408	44504570	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21+,28-/m0/s1	DZFCVSNNMFSZPA-SWOUPANUSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K21544408	BRD-K21544408-001-01-3	Broad Institute of MIT and Harvard	BRD-K21544408			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21+,28-/m0/s1	DZFCVSNNMFSZPA-SWOUPANUSA-N	570.305349724							117688
BRD-K31110422	LSM-29138		44503672	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22+,23+,29-/m0/s1	AGSKCAQZMPMVIM-KUFVDZEESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K31110422	BRD-K31110422-001-01-3	Broad Institute of MIT and Harvard	BRD-K31110422			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22+,23+,29-/m0/s1	AGSKCAQZMPMVIM-KUFVDZEESA-N	572.33739878							117689
BRD-K20912596	LSM-29139		54614747	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23-,28+/m0/s1	SKZBTEBCBLPBIZ-WYNJNVBPSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K20912596	BRD-K20912596-001-01-5	Broad Institute of MIT and Harvard	BRD-K20912596			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23-,28+/m0/s1	SKZBTEBCBLPBIZ-WYNJNVBPSA-N	561.287256816							117690
BRD-K35188988	LSM-29140		44490260	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20+,24-/m0/s1	JFWSYQFTTWMPPF-SMOZNVCYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K35188988	BRD-K35188988-001-01-1	Broad Institute of MIT and Harvard	BRD-K35188988			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20+,24-/m0/s1	JFWSYQFTTWMPPF-SMOZNVCYSA-N	545.307656074							117691
BRD-K27373956	LSM-29141		54614774	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23-,28-/m1/s1	DKJIIKWCTXJSNY-TZTMDHJLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K27373956	BRD-K27373956-001-01-7	Broad Institute of MIT and Harvard	BRD-K27373956			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22-,23-,28-/m1/s1	DKJIIKWCTXJSNY-TZTMDHJLSA-N	561.287256816							117692
BRD-K23220745	LSM-29142		44503627	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25+,26+,32+/m0/s1	IJPCFLZWEMVLEC-MQBJWECPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3C1=O	BroadT	BRD-K23220745	BRD-K23220745-001-01-0	Broad Institute of MIT and Harvard	BRD-K23220745			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25+,26+,32+/m0/s1	IJPCFLZWEMVLEC-MQBJWECPSA-N	615.334207008							117693
BRD-K28813194	LSM-29143		54614782	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22-,26+/m1/s1	UJYZNBPSVBHVBP-BILGYAHESA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K28813194	BRD-K28813194-001-01-3	Broad Institute of MIT and Harvard	BRD-K28813194			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21-,22-,26+/m1/s1	UJYZNBPSVBHVBP-BILGYAHESA-N	579.3090549							117694
BRD-K33064989	LSM-29144		44487537	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26-,33+/m1/s1	UBYZDEGPUXBRQE-PIMCHDTMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K33064989	BRD-K33064989-001-01-5	Broad Institute of MIT and Harvard	BRD-K33064989			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26-,33+/m1/s1	UBYZDEGPUXBRQE-PIMCHDTMSA-N	604.362470676							117695
BRD-K23024526	LSM-29145		54614754	InChI=1S/C33H48N4O7/c1-6-14-36(5)19-31-22(2)18-37(23(3)20-38)32(39)27-16-25(10-12-28(27)44-24(4)9-7-8-15-41-31)34-33(40)35-26-11-13-29-30(17-26)43-21-42-29/h10-13,16-17,22-24,31,38H,6-9,14-15,18-21H2,1-5H3,(H2,34,35,40)/t22-,23+,24+,31+/m0/s1	XLNHBFSEXGTYPK-GPYNCYNASA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K23024526	BRD-K23024526-001-01-1	Broad Institute of MIT and Harvard	BRD-K23024526			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H48N4O7/c1-6-14-36(5)19-31-22(2)18-37(23(3)20-38)32(39)27-16-25(10-12-28(27)44-24(4)9-7-8-15-41-31)34-33(40)35-26-11-13-29-30(17-26)43-21-42-29/h10-13,16-17,22-24,31,38H,6-9,14-15,18-21H2,1-5H3,(H2,34,35,40)/t22-,23+,24+,31+/m0/s1	XLNHBFSEXGTYPK-GPYNCYNASA-N	612.352299916							117696
BRD-K24727463	LSM-29146		44483956	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24+,29-/m1/s1	ZJHDPNYYPDHDNF-CAFXQFFASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K24727463	BRD-K24727463-001-01-3	Broad Institute of MIT and Harvard	BRD-K24727463			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24+,29-/m1/s1	ZJHDPNYYPDHDNF-CAFXQFFASA-N	539.33592157							117697
BRD-K35799753	LSM-29147		44620084	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26+,27-,32+/m1/s1	ZCLFEQBFHRMJFK-NIWNGRQCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K35799753	BRD-K35799753-001-01-8	Broad Institute of MIT and Harvard	BRD-K35799753			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26+,27-,32+/m1/s1	ZCLFEQBFHRMJFK-NIWNGRQCSA-N	611.404669846							117698
BRD-K31408750	LSM-29148		44487463	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m0/s1	VTJNXDUZLOWMHH-WYNJNVBPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K31408750	BRD-K31408750-001-01-3	Broad Institute of MIT and Harvard	BRD-K31408750			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m0/s1	VTJNXDUZLOWMHH-WYNJNVBPSA-N	531.367221698							117699
BRD-K39179354	LSM-29149		44617982	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23-,30-/m0/s1	SIEZSLVXLUPDNY-CQWWOBEDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K39179354	BRD-K39179354-001-01-2	Broad Institute of MIT and Harvard	BRD-K39179354			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22-,23-,30-/m0/s1	SIEZSLVXLUPDNY-CQWWOBEDSA-N	598.336649852							117700
BRD-K32706281	LSM-29150		44504321	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26+,27+,32-/m0/s1	ZMTJRORPEDZKCY-XDZDDBEASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K32706281	BRD-K32706281-001-01-7	Broad Institute of MIT and Harvard	BRD-K32706281			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26+,27+,32-/m0/s1	ZMTJRORPEDZKCY-XDZDDBEASA-N	624.388685424							117701
BRD-K37479727	LSM-29151		44486434	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21-,22-,27-/m1/s1	FBKKOHUHBUWDTB-XAYSYOTPSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K37479727	BRD-K37479727-001-01-8	Broad Institute of MIT and Harvard	BRD-K37479727			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21-,22-,27-/m1/s1	FBKKOHUHBUWDTB-XAYSYOTPSA-N	526.315520484							117702
BRD-K35616138	LSM-29152		44487557	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24+,25-,32+/m1/s1	HBVPERRGRWZCML-DXJUBFBHSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	BroadT	BRD-K35616138	BRD-K35616138-001-01-0	Broad Institute of MIT and Harvard	BRD-K35616138			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24+,25-,32+/m1/s1	HBVPERRGRWZCML-DXJUBFBHSA-N	590.346820612							117703
BRD-K29935988	LSM-29153		44493614	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24-,29-/m1/s1	OJAAEAMCTGSNOQ-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K29935988	BRD-K29935988-001-01-3	Broad Institute of MIT and Harvard	BRD-K29935988			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24-,29-/m1/s1	OJAAEAMCTGSNOQ-CDLOMYRSSA-N	575.30290688							117704
BRD-K25496062	LSM-15125		44616413	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25-,30+/m1/s1	KOPUKDVKYXJRIR-GBRARVNLSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K25496062	BRD-K25496062-001-01-9	Broad Institute of MIT and Harvard	BRD-K25496062			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)C(=O)C3CCCCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25-,30+/m1/s1	KOPUKDVKYXJRIR-GBRARVNLSA-N	602.404335488							103781
BRD-K25649458	LSM-29154		44618808	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30+/m0/s1	KOPUKDVKYXJRIR-YDXRHMNESA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K25649458	BRD-K25649458-001-01-5	Broad Institute of MIT and Harvard	BRD-K25649458			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)C(=O)C3CCCCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H54N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h15-16,18,22-26,30,38H,7-14,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24+,25-,30+/m0/s1	KOPUKDVKYXJRIR-YDXRHMNESA-N	602.404335488							117705
BRD-K36796440	LSM-29155		54614734	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33+/m0/s1	LFCBJIZGBQWHQM-CLFOAKAGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K36796440	BRD-K36796440-001-01-2	Broad Institute of MIT and Harvard	BRD-K36796440			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33+/m0/s1	LFCBJIZGBQWHQM-CLFOAKAGSA-N	602.346820612							117706
CHEMBL2361242	LSM-29156	SID85792258, BRD-K29503289	44485806	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24-,25-,32-/m1/s1	HBVPERRGRWZCML-MTCUJEMASA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	BroadT	BRD-K29503289	BRD-K29503289-001-01-5	Broad Institute of MIT and Harvard	BRD-K29503289			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24-,25-,32-/m1/s1	HBVPERRGRWZCML-MTCUJEMASA-N	590.346820612							117707
BRD-K20398543	LSM-29157		44617998	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21+,22-,28-/m0/s1	QZYXNEJVPTWBHC-QBMQIYCRSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K20398543	BRD-K20398543-001-01-1	Broad Institute of MIT and Harvard	BRD-K20398543			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21+,22-,28-/m0/s1	QZYXNEJVPTWBHC-QBMQIYCRSA-N	556.326085168							117708
BRD-K23427500	LSM-29158		49843413	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23+,28+/m1/s1	SKZBTEBCBLPBIZ-FZVPRWPTSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K23427500	BRD-K23427500-001-01-6	Broad Institute of MIT and Harvard	BRD-K23427500			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22+,23+,28+/m1/s1	SKZBTEBCBLPBIZ-FZVPRWPTSA-N	561.287256816							117709
BRD-K21420222	LSM-29159		44619885	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33-/m0/s1	NGSMHOKAGHIENU-IULAASEQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K21420222	BRD-K21420222-001-01-0	Broad Institute of MIT and Harvard	BRD-K21420222			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33-/m0/s1	NGSMHOKAGHIENU-IULAASEQSA-N	623.404669846001							117710
BRD-K27178862	LSM-29160		44504299	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22+,23+,30+/m0/s1	KQLDLPDWVHVVHP-JONNCTARSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K27178862	BRD-K27178862-001-01-3	Broad Institute of MIT and Harvard	BRD-K27178862			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22+,23+,30+/m0/s1	KQLDLPDWVHVVHP-JONNCTARSA-N	619.29273612							117711
BRD-K20426211	LSM-29161		44619083	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20-,24+/m1/s1	ZPGALQDMRVAORJ-ZSTWQFLISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K20426211	BRD-K20426211-001-01-1	Broad Institute of MIT and Harvard	BRD-K20426211			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19+,20-,24+/m1/s1	ZPGALQDMRVAORJ-ZSTWQFLISA-N	609.269556004							117712
BRD-K38692266	LSM-29162		44619342	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27-,28-,34+/m1/s1	NYAGJJIVOVZRJD-XTBAQLHPSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)Cc4ccccc4)cc3C1=O	BroadT	BRD-K38692266	BRD-K38692266-001-01-2	Broad Institute of MIT and Harvard	BRD-K38692266			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C36H48N4O5/c1-26-22-40(27(2)25-41)36(43)32-21-31(38-35(42)20-29-11-6-5-7-12-29)13-14-33(32)45-28(3)10-8-9-19-44-34(26)24-39(4)23-30-15-17-37-18-16-30/h5-7,11-18,21,26-28,34,41H,8-10,19-20,22-25H2,1-4H3,(H,38,42)/t26-,27-,28-,34+/m1/s1	NYAGJJIVOVZRJD-XTBAQLHPSA-N	616.362470676							117713
BRD-K37094091	LSM-29163		44617980	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25-,26-,32-/m0/s1	JCVAFPCEYZSYDX-GMKFGHRTSA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K37094091	BRD-K37094091-001-01-3	Broad Institute of MIT and Harvard	BRD-K37094091			COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(NC(=O)NC(C)C)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C34H52N4O6/c1-23(2)35-34(41)36-28-13-16-31-30(18-28)33(40)38(25(4)22-39)19-24(3)32(43-17-9-8-10-26(5)44-31)21-37(6)20-27-11-14-29(42-7)15-12-27/h11-16,18,23-26,32,39H,8-10,17,19-22H2,1-7H3,(H2,35,36,41)/t24-,25-,26-,32-/m0/s1	JCVAFPCEYZSYDX-GMKFGHRTSA-N	612.388685424							117714
BRD-K32617235	LSM-29164		44490333	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21-,22+,27+/m0/s1	JLURSCHFCUHCJF-HCUOBIAZSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K32617235	BRD-K32617235-001-01-3	Broad Institute of MIT and Harvard	BRD-K32617235			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21-,22+,27+/m0/s1	JLURSCHFCUHCJF-HCUOBIAZSA-N	547.271606752							117715
BRD-K26994486	LSM-29165		44485116	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20-,21-,27+/m0/s1	AQPDNHSQVUKPGE-MSZUUUALSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K26994486	BRD-K26994486-001-01-0	Broad Institute of MIT and Harvard	BRD-K26994486			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H47N5O6/c1-19-16-35(20(2)18-36)29(37)25-15-24(33(6)7)12-13-26(25)40-21(3)11-9-10-14-39-27(19)17-34(8)30(38)31-28-22(4)32-41-23(28)5/h12-13,15,19-21,27,36H,9-11,14,16-18H2,1-8H3,(H,31,38)/t19-,20-,21-,27+/m0/s1	AQPDNHSQVUKPGE-MSZUUUALSA-N	573.352634274							117716
BRD-K26335565	LSM-29166		54614764	InChI=1S/C26H45N3O6S/c1-7-13-28(5)17-25-19(2)16-29(20(3)18-30)26(31)23-15-22(27-36(6,32)33)11-12-24(23)35-21(4)10-8-9-14-34-25/h11-12,15,19-21,25,27,30H,7-10,13-14,16-18H2,1-6H3/t19-,20+,21-,25-/m1/s1	ZOEMVRGQCOXOOR-FBROZUCGSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K26335565	BRD-K26335565-001-01-0	Broad Institute of MIT and Harvard	BRD-K26335565			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H45N3O6S/c1-7-13-28(5)17-25-19(2)16-29(20(3)18-30)26(31)23-15-22(27-36(6,32)33)11-12-24(23)35-21(4)10-8-9-14-34-25/h11-12,15,19-21,25,27,30H,7-10,13-14,16-18H2,1-6H3/t19-,20+,21-,25-/m1/s1	ZOEMVRGQCOXOOR-FBROZUCGSA-N	527.30290688							117717
BRD-K21629471-001-01-4	LSM-29167	BRD-K21629471	54614750	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33-/m1/s1	LFCBJIZGBQWHQM-HYHRRZRMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K21629471	BRD-K21629471-001-01-4	Broad Institute of MIT and Harvard	BRD-K21629471			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27+,33-/m1/s1	LFCBJIZGBQWHQM-HYHRRZRMSA-N	602.346820612							117718
BRD-K26836050	LSM-29168		54614769	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28-/m0/s1	XHZKQAVNDGMQPU-QKFCCHLXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K26836050	BRD-K26836050-001-01-9	Broad Institute of MIT and Harvard	BRD-K26836050			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22-,23+,28-/m0/s1	XHZKQAVNDGMQPU-QKFCCHLXSA-N	589.282171436							117719
BRD-K34197007	LSM-29169		49850002	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23+,29+/m1/s1	AGSKCAQZMPMVIM-NBOGMJGSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K34197007	BRD-K34197007-001-01-0	Broad Institute of MIT and Harvard	BRD-K34197007			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23+,29+/m1/s1	AGSKCAQZMPMVIM-NBOGMJGSSA-N	572.33739878							117720
BRD-K37047627	LSM-29170		44498652	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22+,27+/m1/s1	AOLQWFIMADKXQA-HLIRBWCUSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K37047627	BRD-K37047627-001-01-4	Broad Institute of MIT and Harvard	BRD-K37047627			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22+,27+/m1/s1	AOLQWFIMADKXQA-HLIRBWCUSA-N	511.304621442							117721
BRD-K30727702	LSM-29171		44616827	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27-/m0/s1	WPSSTONNMATWEF-RFACUBCZSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K30727702	BRD-K30727702-001-01-6	Broad Institute of MIT and Harvard	BRD-K30727702			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27-/m0/s1	WPSSTONNMATWEF-RFACUBCZSA-N	581.23263443							117722
BRD-K25322420	LSM-29172		44493140	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23-,24+,29-/m1/s1	GPFIDTWNGXWRJK-IDCDSMMUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K25322420	BRD-K25322420-001-01-4	Broad Institute of MIT and Harvard	BRD-K25322420			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23-,24+,29-/m1/s1	GPFIDTWNGXWRJK-IDCDSMMUSA-N	575.30290688							117723
BRD-K32445732	LSM-29173		49843134	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24+,29+/m1/s1	PRCUBQSECBZBSK-MSCBGTKOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K32445732	BRD-K32445732-001-01-7	Broad Institute of MIT and Harvard	BRD-K32445732			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24+,29+/m1/s1	PRCUBQSECBZBSK-MSCBGTKOSA-N	575.30290688							117724
BRD-K26051127	LSM-29174		44496004	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20+,24-/m1/s1	PQNWFIFCFFWMJI-MTXNFPGFSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K26051127	BRD-K26051127-001-01-4	Broad Institute of MIT and Harvard	BRD-K26051127			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O4/c1-18-15-28(19(2)17-29)25(30)22-14-21(27(6)7)11-12-23(22)32-20(3)10-8-9-13-31-24(18)16-26(4)5/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20+,24-/m1/s1	PQNWFIFCFFWMJI-MTXNFPGFSA-N	449.325356886							117725
BRD-K31884664	LSM-29175		44486426	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,28-/m1/s1	BRKIAEBRDYHMFE-SQVYLTPJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K31884664	BRD-K31884664-001-01-0	Broad Institute of MIT and Harvard	BRD-K31884664			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,28-/m1/s1	BRKIAEBRDYHMFE-SQVYLTPJSA-N	540.331170548							117726
BRD-K25193509	LSM-29176		44486414	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26-,33-/m1/s1	UBYZDEGPUXBRQE-WTRZPYMOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K25193509	BRD-K25193509-001-01-3	Broad Institute of MIT and Harvard	BRD-K25193509			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25+,26-,33-/m1/s1	UBYZDEGPUXBRQE-WTRZPYMOSA-N	604.362470676							117727
BRD-K20497425	LSM-29177		54614744	InChI=1S/C31H46FN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23-,24+,30-/m0/s1	ZDQGJCPJPDTJMO-WAHOFHFDSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K20497425	BRD-K20497425-001-01-4	Broad Institute of MIT and Harvard	BRD-K20497425			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C31H46FN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23-,24+,30-/m0/s1	ZDQGJCPJPDTJMO-WAHOFHFDSA-N	607.309135112							117728
BRD-K31273312	LSM-29178		44617168	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26+,27-,32+/m1/s1	SDZYTDXKXKHZJE-NIWNGRQCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K31273312	BRD-K31273312-001-01-2	Broad Institute of MIT and Harvard	BRD-K31273312			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26+,27-,32+/m1/s1	SDZYTDXKXKHZJE-NIWNGRQCSA-N	624.388685424							117729
BRD-K35383890	LSM-29179		44491508	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27+/m0/s1	HNFJEPMYRFFBAZ-JLFWUPFSSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K35383890	BRD-K35383890-001-01-5	Broad Institute of MIT and Harvard	BRD-K35383890			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H42N4O5/c1-20-18-33(21(2)19-34)28(35)25-16-24(32-29(36)31-23-11-6-5-7-12-23)13-14-26(25)38-22(3)10-8-9-15-37-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,34H,8-10,15,17-19H2,1-4H3,(H2,31,32,36)/t20-,21+,22-,27+/m0/s1	HNFJEPMYRFFBAZ-JLFWUPFSSA-N	526.315520484							117730
BRD-K33510044	LSM-29180		44488754	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22-,23-,27-/m0/s1	LTGDTYHJVMKPBL-FAWUNYRSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K33510044	BRD-K33510044-001-01-0	Broad Institute of MIT and Harvard	BRD-K33510044			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22-,23-,27-/m0/s1	LTGDTYHJVMKPBL-FAWUNYRSSA-N	534.37812074							117731
BRD-K31467596	LSM-29181		54614788	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29-/m0/s1	MEJMTXOOFVGIJM-VCTIXIOLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K31467596	BRD-K31467596-001-01-7	Broad Institute of MIT and Harvard	BRD-K31467596			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29-/m0/s1	MEJMTXOOFVGIJM-VCTIXIOLSA-N	593.293485048							117732
BRD-K23749313	LSM-29182		44490370	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20+,21+,25+/m1/s1	IUWUHICBQVKRRR-VWEIPLKFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K23749313	BRD-K23749313-001-01-0	Broad Institute of MIT and Harvard	BRD-K23749313			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20+,21+,25+/m1/s1	IUWUHICBQVKRRR-VWEIPLKFSA-N	559.323306138							117733
BRD-K38633800	LSM-29183		54614740	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23-,24-,30-/m1/s1	YDCDOYMHDVYTIM-NULUGNBJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K38633800	BRD-K38633800-001-01-9	Broad Institute of MIT and Harvard	BRD-K38633800			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23-,24-,30-/m1/s1	YDCDOYMHDVYTIM-NULUGNBJSA-N	566.346820612							117734
BRD-K21740361	LSM-29184		44494140	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23+,24-,31-/m1/s1	DSXVWRRZDLHRDJ-UMLQYNHOSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K21740361	BRD-K21740361-001-01-2	Broad Institute of MIT and Harvard	BRD-K21740361			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H44N4O5/c1-22-20-37(23(2)21-38)32(39)28-18-26(35-33(40)36-29-14-9-12-25-11-5-6-13-27(25)29)15-16-30(28)42-24(3)10-7-8-17-41-31(22)19-34-4/h5-6,9,11-16,18,22-24,31,34,38H,7-8,10,17,19-21H2,1-4H3,(H2,35,36,40)/t22-,23+,24-,31-/m1/s1	DSXVWRRZDLHRDJ-UMLQYNHOSA-N	576.331170548							117735
BRD-K22139757	LSM-29185		44617655	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24+,30-/m1/s1	JGZXBABAHUXSMS-HTWFIQDWSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K22139757	BRD-K22139757-001-01-8	Broad Institute of MIT and Harvard	BRD-K22139757			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24+,30-/m1/s1	JGZXBABAHUXSMS-HTWFIQDWSA-N	569.346486254							117736
BRD-K32078195	LSM-29186		44494998	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24-,29+/m0/s1	OJAAEAMCTGSNOQ-HNFJUSDZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K32078195	BRD-K32078195-001-01-6	Broad Institute of MIT and Harvard	BRD-K32078195			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23+,24-,29+/m0/s1	OJAAEAMCTGSNOQ-HNFJUSDZSA-N	575.30290688							117737
BRD-K34573818	LSM-29187		49843183	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24+,29+/m1/s1	PRCUBQSECBZBSK-CHCBTGSZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K34573818	BRD-K34573818-001-01-1	Broad Institute of MIT and Harvard	BRD-K34573818			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24+,29+/m1/s1	PRCUBQSECBZBSK-CHCBTGSZSA-N	575.30290688							117738
BRD-K25877330	LSM-29188		54614762	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23-,24-,29-/m1/s1	IMDGVULVCKQBDZ-RWJVBYDYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K25877330	BRD-K25877330-001-01-6	Broad Institute of MIT and Harvard	BRD-K25877330			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,35H,10-12,17,19-21H2,1-6H3/t22-,23-,24-,29-/m1/s1	IMDGVULVCKQBDZ-RWJVBYDYSA-N	539.33592157							117739
BRD-K30121969	LSM-29189		44502328	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28+,33-/m0/s1	XXBVUIDNUVBELT-OVJUEERBSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K30121969	BRD-K30121969-001-01-0	Broad Institute of MIT and Harvard	BRD-K30121969			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H60N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h17-18,21,26-29,33,40H,7-16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28+,33-/m0/s1	XXBVUIDNUVBELT-OVJUEERBSA-N	616.45637106							117740
BRD-K38170103	LSM-29190		44618009	InChI=1S/C31H46FN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23+,24-,30-/m1/s1	ZDQGJCPJPDTJMO-UTSVKBTJSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K38170103	BRD-K38170103-001-01-6	Broad Institute of MIT and Harvard	BRD-K38170103			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C31H46FN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23+,24-,30-/m1/s1	ZDQGJCPJPDTJMO-UTSVKBTJSA-N	607.309135112							117741
BRD-K38073091	LSM-29191		44496010	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19-,20-,26-/m1/s1	YDWJBUOXSRVMJV-QIRMHMFVSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C1=O	BroadT	BRD-K38073091	BRD-K38073091-001-01-6	Broad Institute of MIT and Harvard	BRD-K38073091			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19-,20-,26-/m1/s1	YDWJBUOXSRVMJV-QIRMHMFVSA-N	559.33698421							117742
CHEMBL3186521	LSM-29192	BRD-K24067917	44502363	InChI=1S/C31H46FN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23+,24+,30-/m0/s1	ZDQGJCPJPDTJMO-YTNVWYNJSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K24067917	BRD-K24067917-001-01-6	Broad Institute of MIT and Harvard	BRD-K24067917			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H46FN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23+,24+,30-/m0/s1	ZDQGJCPJPDTJMO-YTNVWYNJSA-N	607.309135112							117743
BRD-K29183384	LSM-29193		54614784	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23+,28+/m0/s1	BJJOMMAJAORXGV-TUEWKVEFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K29183384	BRD-K29183384-001-01-0	Broad Institute of MIT and Harvard	BRD-K29183384			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23+,28+/m0/s1	BJJOMMAJAORXGV-TUEWKVEFSA-N	595.329121628							117744
BRD-K24792153	LSM-29194		44494530	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32+/m0/s1	LKIIRWUIYHEPDR-ZVJSOJQNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K24792153	BRD-K24792153-001-01-2	Broad Institute of MIT and Harvard	BRD-K24792153			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32+/m0/s1	LKIIRWUIYHEPDR-ZVJSOJQNSA-N	622.37303536							117745
BRD-K37740343	LSM-29195		44616910	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24+,30+/m1/s1	XIVCQDXGZVVHDO-UCTCLUAXSA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K37740343	BRD-K37740343-001-01-7	Broad Institute of MIT and Harvard	BRD-K37740343			COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(NS(C)(=O)=O)cc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24+,30+/m1/s1	XIVCQDXGZVVHDO-UCTCLUAXSA-N	605.313471564							117746
BRD-K38380337	LSM-29196		44494421	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25+,30-/m0/s1	OMPYFAIFRLVIFJ-RPQPUBLWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K38380337	BRD-K38380337-001-01-9	Broad Institute of MIT and Harvard	BRD-K38380337			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C33H46F3N3O5/c1-23-19-39(24(2)22-40)32(42)28-18-27(37-31(41)15-16-33(34,35)36)13-14-29(28)44-25(3)10-8-9-17-43-30(23)21-38(4)20-26-11-6-5-7-12-26/h5-7,11-14,18,23-25,30,40H,8-10,15-17,19-22H2,1-4H3,(H,37,41)/t23-,24+,25+,30-/m0/s1	OMPYFAIFRLVIFJ-RPQPUBLWSA-N	621.338956202							117747
BRD-K30511626	LSM-6791		44498246	InChI=1S/C32H47FN4O5/c1-6-16-36(5)20-30-22(2)19-37(23(3)21-38)31(39)28-18-27(35-32(40)34-26-12-10-25(33)11-13-26)14-15-29(28)42-24(4)9-7-8-17-41-30/h10-15,18,22-24,30,38H,6-9,16-17,19-21H2,1-5H3,(H2,34,35,40)/t22-,23-,24-,30+/m1/s1	ZDZLFJDSEKLXNO-KJMNMTOCSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K30511626	BRD-K30511626-001-01-7	Broad Institute of MIT and Harvard	BRD-K30511626			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C32H47FN4O5/c1-6-16-36(5)20-30-22(2)19-37(23(3)21-38)31(39)28-18-27(35-32(40)34-26-12-10-25(33)11-13-26)14-15-29(28)42-24(4)9-7-8-17-41-30/h10-15,18,22-24,30,38H,6-9,16-17,19-21H2,1-5H3,(H2,34,35,40)/t22-,23-,24-,30+/m1/s1	ZDZLFJDSEKLXNO-KJMNMTOCSA-N	586.353048844							95412
BRD-K33873762	LSM-29197		44494389	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22+,28+/m0/s1	GMYAYTAKTSTYEI-CLYWQNBRSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	BroadT	BRD-K33873762	BRD-K33873762-001-01-2	Broad Institute of MIT and Harvard	BRD-K33873762			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O	InChI=1S/C31H43F3N4O5/c1-20-17-38(21(2)19-39)29(40)26-16-25(36-30(41)35-24-11-9-23(10-12-24)31(32,33)34)13-14-27(26)43-22(3)8-6-7-15-42-28(20)18-37(4)5/h9-14,16,20-22,28,39H,6-8,15,17-19H2,1-5H3,(H2,35,36,41)/t20-,21+,22+,28+/m0/s1	GMYAYTAKTSTYEI-CLYWQNBRSA-N	608.318555116							117748
BRD-K30933750	LSM-29198		49843267	InChI=1S/C26H45N3O6S/c1-7-13-28(5)17-25-19(2)16-29(20(3)18-30)26(31)23-15-22(27-36(6,32)33)11-12-24(23)35-21(4)10-8-9-14-34-25/h11-12,15,19-21,25,27,30H,7-10,13-14,16-18H2,1-6H3/t19-,20+,21+,25+/m1/s1	ZOEMVRGQCOXOOR-VWEIPLKFSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K30933750	BRD-K30933750-001-01-1	Broad Institute of MIT and Harvard	BRD-K30933750			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H45N3O6S/c1-7-13-28(5)17-25-19(2)16-29(20(3)18-30)26(31)23-15-22(27-36(6,32)33)11-12-24(23)35-21(4)10-8-9-14-34-25/h11-12,15,19-21,25,27,30H,7-10,13-14,16-18H2,1-6H3/t19-,20+,21+,25+/m1/s1	ZOEMVRGQCOXOOR-VWEIPLKFSA-N	527.30290688							117749
BRD-K36298208	LSM-29199		44490938	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20+,21-,25+/m1/s1	IUWUHICBQVKRRR-QDMVCWPOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K36298208	BRD-K36298208-001-01-1	Broad Institute of MIT and Harvard	BRD-K36298208			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H44F3N3O5/c1-19-16-34(20(2)18-35)27(37)23-15-22(32(4)5)10-11-24(23)39-21(3)9-7-8-14-38-25(19)17-33(6)26(36)12-13-28(29,30)31/h10-11,15,19-21,25,35H,7-9,12-14,16-18H2,1-6H3/t19-,20+,21-,25+/m1/s1	IUWUHICBQVKRRR-QDMVCWPOSA-N	559.323306138							117750
BRD-K35119180	LSM-29200		44487028	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24-,29-/m1/s1	SEDRIVHSDUVLLE-CDLOMYRSSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K35119180	BRD-K35119180-001-01-2	Broad Institute of MIT and Harvard	BRD-K35119180			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24-,29-/m1/s1	SEDRIVHSDUVLLE-CDLOMYRSSA-N	597.352634274							117751
BRD-K29662535	LSM-29201		45480103	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26+,27-,32-/m1/s1	ZCLFEQBFHRMJFK-ZQPSKXNCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K29662535	BRD-K29662535-001-01-1	Broad Institute of MIT and Harvard	BRD-K29662535			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26+,27-,32-/m1/s1	ZCLFEQBFHRMJFK-ZQPSKXNCSA-N	611.404669846							117752
BRD-K20325525-001-01-6	LSM-29202	BRD-K20325525	54614743	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29-/m0/s1	YZLWJGCKUGDXHR-MVPDCNEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K20325525	BRD-K20325525-001-01-6	Broad Institute of MIT and Harvard	BRD-K20325525			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24-,29-/m0/s1	YZLWJGCKUGDXHR-MVPDCNEZSA-N	560.393770804							117753
BRD-K31796953	LSM-29203		44492072	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22-,28-/m1/s1	DYIGNVBEUCFAEB-BUUPBASBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	BroadT	BRD-K31796953	BRD-K31796953-001-01-6	Broad Institute of MIT and Harvard	BRD-K31796953			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O	InChI=1S/C30H43FN4O5/c1-20-17-35(21(2)19-36)29(37)26-16-25(33-30(38)32-24-11-9-23(31)10-12-24)13-14-27(26)40-22(3)8-6-7-15-39-28(20)18-34(4)5/h9-14,16,20-22,28,36H,6-8,15,17-19H2,1-5H3,(H2,32,33,38)/t20-,21+,22-,28-/m1/s1	DYIGNVBEUCFAEB-BUUPBASBSA-N	558.321748716							117754
BRD-K28905117	LSM-29204		44504030	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24+,29+/m0/s1	XPIAMQJKSFNCJS-CMSZEEODSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K28905117	BRD-K28905117-001-01-1	Broad Institute of MIT and Harvard	BRD-K28905117			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24+,29+/m0/s1	XPIAMQJKSFNCJS-CMSZEEODSA-N	603.2978215							117755
BRD-K38538662	LSM-29205		44485096	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19-,20-,24-/m1/s1	LBVOXJOHMPITGR-DBYOASNMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K38538662	BRD-K38538662-001-01-7	Broad Institute of MIT and Harvard	BRD-K38538662			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19-,20-,24-/m1/s1	LBVOXJOHMPITGR-DBYOASNMSA-N	609.269556004							117756
BRD-K37558338	LSM-29206		44490362	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23-,28+/m0/s1	GAZXHMFIMHCKKU-WYNJNVBPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K37558338	BRD-K37558338-001-01-0	Broad Institute of MIT and Harvard	BRD-K37558338			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23-,28+/m0/s1	GAZXHMFIMHCKKU-WYNJNVBPSA-N	576.298155858							117757
BRD-K20600965	LSM-29207		44618415	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24-,29-/m1/s1	YZLWJGCKUGDXHR-RWJVBYDYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K20600965	BRD-K20600965-001-01-9	Broad Institute of MIT and Harvard	BRD-K20600965			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24-,29-/m1/s1	YZLWJGCKUGDXHR-RWJVBYDYSA-N	560.393770804							117758
BRD-K30551445	LSM-29208		44493139	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28-/m1/s1	GOBHPVUGCFRQAG-SITKICAQSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	BroadT	BRD-K30551445	BRD-K30551445-001-01-2	Broad Institute of MIT and Harvard	BRD-K30551445			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C1=O	InChI=1S/C29H42ClN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22+,28-/m1/s1	GOBHPVUGCFRQAG-SITKICAQSA-N	595.248284494							117759
BRD-K38060656	LSM-29209		44496016	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23-,24-,28+/m0/s1	FCDOAUZTELHSSL-HXFQDRMMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K38060656	BRD-K38060656-001-01-0	Broad Institute of MIT and Harvard	BRD-K38060656			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23-,24-,28+/m0/s1	FCDOAUZTELHSSL-HXFQDRMMSA-N	548.393770804							117760
BRD-K36003516	LSM-29210		54614733	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22-,23-,28+/m0/s1	BJJOMMAJAORXGV-KKQCDPINSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K36003516	BRD-K36003516-001-01-2	Broad Institute of MIT and Harvard	BRD-K36003516			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22-,23-,28+/m0/s1	BJJOMMAJAORXGV-KKQCDPINSA-N	595.329121628							117761
BRD-K33956641	LSM-29211		44493611	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m1/s1	LKIIRWUIYHEPDR-XDMKPEOCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K33956641	BRD-K33956641-001-01-2	Broad Institute of MIT and Harvard	BRD-K33956641			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m1/s1	LKIIRWUIYHEPDR-XDMKPEOCSA-N	622.37303536							117762
BRD-K37865727	LSM-29212		54614737	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24-,25-,30-/m1/s1	RSKGZFLSRBPJST-SFOWLQBLSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K37865727	BRD-K37865727-001-01-8	Broad Institute of MIT and Harvard	BRD-K37865727			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24-,25-,30-/m1/s1	RSKGZFLSRBPJST-SFOWLQBLSA-N	617.41523453							117763
CHEMBL2357902	LSM-29213	BRD-K21582416, SID131409736	54614749	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27+/m1/s1	WPSSTONNMATWEF-CVWKGPCHSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K21582416	BRD-K21582416-001-01-3	Broad Institute of MIT and Harvard	BRD-K21582416			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20-,21-,27+/m1/s1	WPSSTONNMATWEF-CVWKGPCHSA-N	581.23263443							117764
BRD-K34688736	LSM-29214		44493102	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19-,20-,26-/m0/s1	YDWJBUOXSRVMJV-RNVDEAKXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C1=O	BroadT	BRD-K34688736	BRD-K34688736-001-01-6	Broad Institute of MIT and Harvard	BRD-K34688736			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19-,20-,26-/m0/s1	YDWJBUOXSRVMJV-RNVDEAKXSA-N	559.33698421							117765
BRD-K33869336	LSM-29215		49843282	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24+,30+/m1/s1	XIVCQDXGZVVHDO-QAAVFVPKSA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K33869336	BRD-K33869336-001-01-7	Broad Institute of MIT and Harvard	BRD-K33869336			COc1ccc(CN(C)C[C@@H]2OCCCC[C@H](C)Oc3ccc(NS(C)(=O)=O)cc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23+,24+,30+/m1/s1	XIVCQDXGZVVHDO-QAAVFVPKSA-N	605.313471564							117766
BRD-K24422491	LSM-29216		44494980	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23-,24+,29+/m0/s1	OJAAEAMCTGSNOQ-PHBCIFJZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K24422491	BRD-K24422491-001-01-7	Broad Institute of MIT and Harvard	BRD-K24422491			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H45N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h6-8,12-15,17,22-24,29,31,34H,9-11,16,18-21H2,1-5H3/t22-,23-,24+,29+/m0/s1	OJAAEAMCTGSNOQ-PHBCIFJZSA-N	575.30290688							117767
BRD-K35863275	LSM-29217		44504034	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28+/m0/s1	XEPWKRSQLBTXFU-TUEWKVEFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K35863275	BRD-K35863275-001-01-1	Broad Institute of MIT and Harvard	BRD-K35863275			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28+/m0/s1	XEPWKRSQLBTXFU-TUEWKVEFSA-N	595.329121628							117768
CHEMBL2361267	LSM-29218	BRD-K31122616, SID131409773	54614786	InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24-,25-,30-/m1/s1	DPWBPPWCHVQSHF-SFOWLQBLSA-N	CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K31122616	BRD-K31122616-001-01-4	Broad Institute of MIT and Harvard	BRD-K31122616			CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24-,25-,30-/m1/s1	DPWBPPWCHVQSHF-SFOWLQBLSA-N	553.351571634							117769
BRD-K35788497	LSM-29219		44617937	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33+/m1/s1	FHYFYPZRCDKSKV-CYNXIGLJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K35788497	BRD-K35788497-001-01-2	Broad Institute of MIT and Harvard	BRD-K35788497			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H52N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,40H,5-12,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33+/m1/s1	FHYFYPZRCDKSKV-CYNXIGLJSA-N	608.393770804							117770
BRD-K33448511	LSM-29220		44494529	InChI=1S/C28H48N4O5/c1-20-18-32(21(2)19-33)28(35)24-16-23(30-27(34)11-9-14-31(5)6)12-13-25(24)37-22(3)10-7-8-15-36-26(20)17-29-4/h12-13,16,20-22,26,29,33H,7-11,14-15,17-19H2,1-6H3,(H,30,34)/t20-,21-,22-,26+/m0/s1	SBFFLWUBRLNFSF-OYSWMMLKSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K33448511	BRD-K33448511-001-01-7	Broad Institute of MIT and Harvard	BRD-K33448511			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H48N4O5/c1-20-18-32(21(2)19-33)28(35)24-16-23(30-27(34)11-9-14-31(5)6)12-13-25(24)37-22(3)10-7-8-15-36-26(20)17-29-4/h12-13,16,20-22,26,29,33H,7-11,14-15,17-19H2,1-6H3,(H,30,34)/t20-,21-,22-,26+/m0/s1	SBFFLWUBRLNFSF-OYSWMMLKSA-N	520.362470676							117771
BRD-K30640165	LSM-6775		44487568	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21-,22+,27+/m1/s1	FBKKOHUHBUWDTB-YHZQYDDPSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K30640165	BRD-K30640165-001-01-1	Broad Institute of MIT and Harvard	BRD-K30640165			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21-,22+,27+/m1/s1	FBKKOHUHBUWDTB-YHZQYDDPSA-N	526.315520484							95396
BRD-K21009787	LSM-29221		44617361	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23-,24+,29-/m0/s1	MOSVBDAIGOGSPE-OODISRMCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K21009787	BRD-K21009787-001-01-8	Broad Institute of MIT and Harvard	BRD-K21009787			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23-,24+,29-/m0/s1	MOSVBDAIGOGSPE-OODISRMCSA-N	581.349857072							117772
BRD-K30258816	LSM-29222		44494526	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,28-/m0/s1	DZFCVSNNMFSZPA-RHYVFGCBSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K30258816	BRD-K30258816-001-01-5	Broad Institute of MIT and Harvard	BRD-K30258816			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H42N4O7/c1-19-16-34(20(2)17-35)29(36)24-13-22(32-30(37)33-23-9-11-26-27(14-23)40-18-39-26)8-10-25(24)41-21(3)7-5-6-12-38-28(19)15-31-4/h8-11,13-14,19-21,28,31,35H,5-7,12,15-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,28-/m0/s1	DZFCVSNNMFSZPA-RHYVFGCBSA-N	570.305349724							117773
BRD-K23923189	LSM-29223		54614759	InChI=1S/C31H46ClN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23-,24+,30-/m0/s1	XCNKIYRWXFRDDY-WAHOFHFDSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K23923189	BRD-K23923189-001-01-2	Broad Institute of MIT and Harvard	BRD-K23923189			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C31H46ClN3O6S/c1-6-16-34(5)20-30-22(2)19-35(23(3)21-36)31(37)28-18-26(33-42(38,39)27-13-10-25(32)11-14-27)12-15-29(28)41-24(4)9-7-8-17-40-30/h10-15,18,22-24,30,33,36H,6-9,16-17,19-21H2,1-5H3/t22-,23-,24+,30-/m0/s1	XCNKIYRWXFRDDY-WAHOFHFDSA-N	623.279584622							117774
BRD-K21412601	LSM-29224		44488197	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24-,29-/m1/s1	QUSLWNNTNFDPAB-CDLOMYRSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K21412601	BRD-K21412601-001-01-8	Broad Institute of MIT and Harvard	BRD-K21412601			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24-,29-/m1/s1	QUSLWNNTNFDPAB-CDLOMYRSSA-N	545.382871762							117775
BRD-K29120026	LSM-29225		44616635	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20+,24+/m1/s1	ORDOAKKGIRZCMJ-XUJKJYMVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K29120026	BRD-K29120026-001-01-6	Broad Institute of MIT and Harvard	BRD-K29120026			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19+,20+,24+/m1/s1	ORDOAKKGIRZCMJ-XUJKJYMVSA-N	513.287256816							117776
BRD-K30589514	LSM-29226		54614785	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24-,29-/m0/s1	YZLWJGCKUGDXHR-UITIVDIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K30589514	BRD-K30589514-001-01-8	Broad Institute of MIT and Harvard	BRD-K30589514			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H52N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h15-16,18,22-25,29,36H,7-14,17,19-21H2,1-6H3,(H,32,38)/t22-,23-,24-,29-/m0/s1	YZLWJGCKUGDXHR-UITIVDIESA-N	560.393770804							117777
BRD-K38273742	LSM-29227		44489902	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25-,26-,31+/m1/s1	SIHQACFNVCTPOW-KUXNCQQFSA-N	CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K38273742	BRD-K38273742-001-01-5	Broad Institute of MIT and Harvard	BRD-K38273742			CC(C)NC(=O)Nc1ccc2O[C@H](C)CCCCO[C@@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25-,26-,31+/m1/s1	SIHQACFNVCTPOW-KUXNCQQFSA-N	582.37812074							117778
BRD-K36778976	LSM-29228		44483930	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24+,29-/m0/s1	QUSLWNNTNFDPAB-OODISRMCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K36778976	BRD-K36778976-001-01-2	Broad Institute of MIT and Harvard	BRD-K36778976			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24+,29-/m0/s1	QUSLWNNTNFDPAB-OODISRMCSA-N	545.382871762							117779
BRD-K34369474	LSM-29229		54614729	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24-/m0/s1	ORDOAKKGIRZCMJ-XHOYROJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K34369474	BRD-K34369474-001-01-9	Broad Institute of MIT and Harvard	BRD-K34369474			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C25H43N3O6S/c1-18-15-28(19(2)17-29)25(30)22-14-21(26(4)5)11-12-23(22)34-20(3)10-8-9-13-33-24(18)16-27(6)35(7,31)32/h11-12,14,18-20,24,29H,8-10,13,15-17H2,1-7H3/t18-,19-,20-,24-/m0/s1	ORDOAKKGIRZCMJ-XHOYROJHSA-N	513.287256816							117780
BRD-K26117128	LSM-29230		44620186	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21-,22+,28+/m0/s1	QZYXNEJVPTWBHC-SXKDZKFMSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K26117128	BRD-K26117128-001-01-2	Broad Institute of MIT and Harvard	BRD-K26117128			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H44N4O6/c1-20-18-34(21(2)19-35)29(36)26-16-24(33-30(37)32-23-9-12-25(38-5)13-10-23)11-14-27(26)40-22(3)8-6-7-15-39-28(20)17-31-4/h9-14,16,20-22,28,31,35H,6-8,15,17-19H2,1-5H3,(H2,32,33,37)/t20-,21-,22+,28+/m0/s1	QZYXNEJVPTWBHC-SXKDZKFMSA-N	556.326085168							117781
BRD-K26790127	LSM-29231		44496906	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26+,27-,32-/m0/s1	ZCLFEQBFHRMJFK-XTQYNZLPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K26790127	BRD-K26790127-001-01-7	Broad Institute of MIT and Harvard	BRD-K26790127			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26+,27-,32-/m0/s1	ZCLFEQBFHRMJFK-XTQYNZLPSA-N	611.404669846							117782
BRD-K25974714	LSM-29232		44619573	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m1/s1	XEPWKRSQLBTXFU-KRHPZPPWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	BroadT	BRD-K25974714	BRD-K25974714-001-01-7	Broad Institute of MIT and Harvard	BRD-K25974714			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h14-15,17,21-24,28,34H,6-13,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28+/m1/s1	XEPWKRSQLBTXFU-KRHPZPPWSA-N	595.329121628							117783
BRD-K21059010	LSM-29233		44619639	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23-,28-/m1/s1	BJJOMMAJAORXGV-JTNFPWQOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K21059010	BRD-K21059010-001-01-2	Broad Institute of MIT and Harvard	BRD-K21059010			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H49N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h14-15,17,21-24,28,31,34H,6-13,16,18-20H2,1-5H3/t21-,22+,23-,28-/m1/s1	BJJOMMAJAORXGV-JTNFPWQOSA-N	595.329121628							117784
BRD-K24453679	LSM-29234		44503847	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28-/m0/s1	XHZKQAVNDGMQPU-FPZRTEDSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K24453679	BRD-K24453679-001-01-6	Broad Institute of MIT and Harvard	BRD-K24453679			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28-/m0/s1	XHZKQAVNDGMQPU-FPZRTEDSSA-N	589.282171436							117785
BRD-K23204014	LSM-29235		44488766	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20-,21+,27-/m0/s1	PQVSIMSGGSSCRI-GRWWNZOSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K23204014	BRD-K23204014-001-01-8	Broad Institute of MIT and Harvard	BRD-K23204014			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20-,21+,27-/m0/s1	PQVSIMSGGSSCRI-GRWWNZOSSA-N	594.308720542							117786
BRD-K26479796	LSM-29236		44618644	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22+,23-,30-/m1/s1	KQLDLPDWVHVVHP-UAXFNLPOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K26479796	BRD-K26479796-001-01-7	Broad Institute of MIT and Harvard	BRD-K26479796			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22+,23-,30-/m1/s1	KQLDLPDWVHVVHP-UAXFNLPOSA-N	619.29273612							117787
BRD-K36063519	LSM-29237		44496031	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22+,27+/m0/s1	JMPHEZKYQLUQMM-HCUOBIAZSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K36063519	BRD-K36063519-001-01-3	Broad Institute of MIT and Harvard	BRD-K36063519			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H47N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h13-14,16,20-23,27,30,33H,5-12,15,17-19H2,1-4H3,(H,31,34)/t20-,21-,22+,27+/m0/s1	JMPHEZKYQLUQMM-HCUOBIAZSA-N	517.351571634							117788
MLS003128703	LSM-10141	BRD-K28282432	44494405	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24+,29-/m0/s1	KAHNNCGHTWSOBA-SEAFADMZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K28282432	BRD-K28282432-001-01-3	Broad Institute of MIT and Harvard	BRD-K28282432			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H46N4O5/c1-22-19-35(23(2)21-36)30(37)27-18-26(33(4)5)15-16-28(27)40-24(3)12-10-11-17-39-29(22)20-34(6)31(38)32-25-13-8-7-9-14-25/h7-9,13-16,18,22-24,29,36H,10-12,17,19-21H2,1-6H3,(H,32,38)/t22-,23+,24+,29-/m0/s1	KAHNNCGHTWSOBA-SEAFADMZSA-N	554.346820612							98762
BRD-K35942122	LSM-29238		44504565	InChI=1S/C33H50N4O6/c1-7-17-36(5)21-31-23(2)20-37(24(3)22-38)32(39)29-19-27(13-16-30(29)43-25(4)10-8-9-18-42-31)35-33(40)34-26-11-14-28(41-6)15-12-26/h11-16,19,23-25,31,38H,7-10,17-18,20-22H2,1-6H3,(H2,34,35,40)/t23-,24+,25+,31-/m0/s1	QAGMOHWNXLCFPJ-UMDYSXRGSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K35942122	BRD-K35942122-001-01-8	Broad Institute of MIT and Harvard	BRD-K35942122			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(OC)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C33H50N4O6/c1-7-17-36(5)21-31-23(2)20-37(24(3)22-38)32(39)29-19-27(13-16-30(29)43-25(4)10-8-9-18-42-31)35-33(40)34-26-11-14-28(41-6)15-12-26/h11-16,19,23-25,31,38H,7-10,17-18,20-22H2,1-6H3,(H2,34,35,40)/t23-,24+,25+,31-/m0/s1	QAGMOHWNXLCFPJ-UMDYSXRGSA-N	598.37303536							117789
BRD-K38610362	LSM-29239		54614738	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32+/m1/s1	OQPYQZIBKYAWRE-ZYMMPZCLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)C4CCCCC4)cc3C1=O	BroadT	BRD-K38610362	BRD-K38610362-001-01-7	Broad Institute of MIT and Harvard	BRD-K38610362			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)C3CCCCC3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-11-6-5-7-12-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-15-17-36-18-16-28/h13-18,20,24-27,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26-,32+/m1/s1	OQPYQZIBKYAWRE-ZYMMPZCLSA-N	622.37303536							117790
BRD-K32280984	LSM-29240		44618445	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30+/m1/s1	DXYWKCBATINIRK-ZRIOWSNCSA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K32280984	BRD-K32280984-001-01-3	Broad Institute of MIT and Harvard	BRD-K32280984			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C33H48N4O6/c1-22(2)34-33(41)35-27-15-16-29-28(18-27)32(40)37(24(4)21-38)19-23(3)30(42-17-11-10-12-25(5)43-29)20-36(6)31(39)26-13-8-7-9-14-26/h7-9,13-16,18,22-25,30,38H,10-12,17,19-21H2,1-6H3,(H2,34,35,41)/t23-,24-,25+,30+/m1/s1	DXYWKCBATINIRK-ZRIOWSNCSA-N	596.357385296							117791
BRD-K36474885	LSM-29241		44486380	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25+,26+,31-/m1/s1	SIHQACFNVCTPOW-SQRAXXTESA-N	CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K36474885	BRD-K36474885-001-01-8	Broad Institute of MIT and Harvard	BRD-K36474885			CC(C)NC(=O)Nc1ccc2O[C@@H](C)CCCCO[C@H](CN(C)Cc3ccccc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C33H50N4O5/c1-23(2)34-33(40)35-28-15-16-30-29(18-28)32(39)37(25(4)22-38)19-24(3)31(41-17-11-10-12-26(5)42-30)21-36(6)20-27-13-8-7-9-14-27/h7-9,13-16,18,23-26,31,38H,10-12,17,19-22H2,1-6H3,(H2,34,35,40)/t24-,25+,26+,31-/m1/s1	SIHQACFNVCTPOW-SQRAXXTESA-N	582.37812074							117792
BRD-K20560768	LSM-29242		54614745	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28+/m1/s1	KDWFAOIYLGHTDK-LLTQPOKBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	BroadT	BRD-K20560768	BRD-K20560768-001-01-4	Broad Institute of MIT and Harvard	BRD-K20560768			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21+,22-,28+/m1/s1	KDWFAOIYLGHTDK-LLTQPOKBSA-N	579.277834984							117793
BRD-K37033753	LSM-29243		54614736	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33-/m1/s1	LFCBJIZGBQWHQM-BXWHCVCYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K37033753	BRD-K37033753-001-01-0	Broad Institute of MIT and Harvard	BRD-K37033753			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26-,27-,33-/m1/s1	LFCBJIZGBQWHQM-BXWHCVCYSA-N	602.346820612							117794
BRD-K28531276	LSM-29244		44485129	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,28+/m0/s1	BRKIAEBRDYHMFE-HIAVRWOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K28531276	BRD-K28531276-001-01-2	Broad Institute of MIT and Harvard	BRD-K28531276			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,28+/m0/s1	BRKIAEBRDYHMFE-HIAVRWOZSA-N	540.331170548							117795
BRD-K28294686	LSM-29245		44619842	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33+/m1/s1	NGSMHOKAGHIENU-CDNUTCOBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K28294686	BRD-K28294686-001-01-1	Broad Institute of MIT and Harvard	BRD-K28294686			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27-,33+/m1/s1	NGSMHOKAGHIENU-CDNUTCOBSA-N	623.404669846001							117796
BRD-K31778735	LSM-29246		44494918	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m0/s1	LKIIRWUIYHEPDR-GSDPCRBASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K31778735	BRD-K31778735-001-01-9	Broad Institute of MIT and Harvard	BRD-K31778735			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m0/s1	LKIIRWUIYHEPDR-GSDPCRBASA-N	622.37303536							117797
BRD-K24143478	LSM-29247		44489297	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22-,23-,28-/m0/s1	GAZXHMFIMHCKKU-AMZZYFJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K24143478	BRD-K24143478-001-01-6	Broad Institute of MIT and Harvard	BRD-K24143478			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22-,23-,28-/m0/s1	GAZXHMFIMHCKKU-AMZZYFJHSA-N	576.298155858							117798
BRD-K23208879	LSM-29248		54614756	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23-,27-/m0/s1	XJLXIOLTLBOFKC-GIRPNKPCSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K23208879	BRD-K23208879-001-01-3	Broad Institute of MIT and Harvard	BRD-K23208879			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23-,27-/m0/s1	XJLXIOLTLBOFKC-GIRPNKPCSA-N	598.34002067							117799
BRD-K32965188	LSM-29249		44490908	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22-,23+,28+/m0/s1	GAZXHMFIMHCKKU-HIAVRWOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K32965188	BRD-K32965188-001-01-3	Broad Institute of MIT and Harvard	BRD-K32965188			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22-,23+,28+/m0/s1	GAZXHMFIMHCKKU-HIAVRWOZSA-N	576.298155858							117800
BRD-K23064726	LSM-29250		54614755	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18+,19-,25+/m1/s1	OIOMLIQJBPNRTR-BBRCJUOPSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K23064726	BRD-K23064726-001-01-5	Broad Institute of MIT and Harvard	BRD-K23064726			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H43N5O6/c1-17-15-33(18(2)16-34)27(35)23-13-22(30-28(36)31-26-20(4)32-39-21(26)5)10-11-24(23)38-19(3)9-7-8-12-37-25(17)14-29-6/h10-11,13,17-19,25,29,34H,7-9,12,14-16H2,1-6H3,(H2,30,31,36)/t17-,18+,19-,25+/m1/s1	OIOMLIQJBPNRTR-BBRCJUOPSA-N	545.321334146							117801
BRD-K22854578	LSM-29251		44619133	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24+,25-,29-/m0/s1	NSUWFWDPIIGHAU-JLMYGFKKSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K22854578	BRD-K22854578-001-01-9	Broad Institute of MIT and Harvard	BRD-K22854578			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H54N4O5/c1-8-16-34(7)21-29-23(2)20-35(24(3)22-36)31(38)27-19-26(32-30(37)13-11-17-33(5)6)14-15-28(27)40-25(4)12-9-10-18-39-29/h14-15,19,23-25,29,36H,8-13,16-18,20-22H2,1-7H3,(H,32,37)/t23-,24+,25-,29-/m0/s1	NSUWFWDPIIGHAU-JLMYGFKKSA-N	562.409420868							117802
BRD-K39027348	LSM-29252		54614741	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20+,24+/m1/s1	ZPGALQDMRVAORJ-FDGPYGQJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K39027348	BRD-K39027348-001-01-2	Broad Institute of MIT and Harvard	BRD-K39027348			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20+,24+/m1/s1	ZPGALQDMRVAORJ-FDGPYGQJSA-N	609.269556004							117803
BRD-K30597925	LSM-29253		44485795	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25-,26-,33-/m1/s1	UBYZDEGPUXBRQE-BWDKEVCWSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K30597925	BRD-K30597925-001-01-4	Broad Institute of MIT and Harvard	BRD-K30597925			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C35H48N4O5/c1-24-21-39(25(2)23-40)34(41)30-20-28(37(4)5)17-18-32(30)44-26(3)12-9-10-19-43-33(24)22-38(6)35(42)36-31-16-11-14-27-13-7-8-15-29(27)31/h7-8,11,13-18,20,24-26,33,40H,9-10,12,19,21-23H2,1-6H3,(H,36,42)/t24-,25-,26-,33-/m1/s1	UBYZDEGPUXBRQE-BWDKEVCWSA-N	604.362470676							117804
BRD-K26904107	LSM-29254		44493110	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22-,23-,28-/m0/s1	SCSZUZCJLHTTSJ-AMZZYFJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K26904107	BRD-K26904107-001-01-8	Broad Institute of MIT and Harvard	BRD-K26904107			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-41(5,37)38)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)29(35)24-12-7-6-8-13-24/h6-8,12-15,17,21-23,28,31,34H,9-11,16,18-20H2,1-5H3/t21-,22-,23-,28-/m0/s1	SCSZUZCJLHTTSJ-AMZZYFJHSA-N	589.282171436							117805
BRD-K22475995	LSM-29255		44489851	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24-,29-/m0/s1	ZJHDPNYYPDHDNF-UITIVDIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K22475995	BRD-K22475995-001-01-8	Broad Institute of MIT and Harvard	BRD-K22475995			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24-,29-/m0/s1	ZJHDPNYYPDHDNF-UITIVDIESA-N	539.33592157							117806
BRD-K31683335	LSM-29256		44620538	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24+,29-/m1/s1	PRCUBQSECBZBSK-CAFXQFFASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K31683335	BRD-K31683335-001-01-5	Broad Institute of MIT and Harvard	BRD-K31683335			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24+,29-/m1/s1	PRCUBQSECBZBSK-CAFXQFFASA-N	575.30290688							117807
BRD-K30257736	LSM-29257		44618035	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26-,27-,32+/m0/s1	SDZYTDXKXKHZJE-GZNUUUAQSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K30257736	BRD-K30257736-001-01-4	Broad Institute of MIT and Harvard	BRD-K30257736			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26-,27-,32+/m0/s1	SDZYTDXKXKHZJE-GZNUUUAQSA-N	624.388685424							117808
BRD-K23435841	LSM-29258		54614758	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20+,24-/m1/s1	ZPGALQDMRVAORJ-MTXNFPGFSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K23435841	BRD-K23435841-001-01-7	Broad Institute of MIT and Harvard	BRD-K23435841			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)41(5,37)38/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20+,24-/m1/s1	ZPGALQDMRVAORJ-MTXNFPGFSA-N	609.269556004							117809
BRD-K27982554	LSM-29259		44502944	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23+,24+,29-/m0/s1	MOSVBDAIGOGSPE-SEAFADMZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K27982554	BRD-K27982554-001-01-1	Broad Institute of MIT and Harvard	BRD-K27982554			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23+,24+,29-/m0/s1	MOSVBDAIGOGSPE-SEAFADMZSA-N	581.349857072							117810
BRD-K32686643	LSM-29260		44487476	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28-,33+/m0/s1	YHPMBPSGDQLXHP-UUZIFAJNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K32686643	BRD-K32686643-001-01-4	Broad Institute of MIT and Harvard	BRD-K32686643			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H54N4O5/c1-26-22-39(27(2)25-40)35(42)31-21-30(36-34(41)16-12-19-37(4)5)17-18-32(31)44-28(3)13-10-11-20-43-33(26)24-38(6)23-29-14-8-7-9-15-29/h7-9,14-15,17-18,21,26-28,33,40H,10-13,16,19-20,22-25H2,1-6H3,(H,36,41)/t26-,27+,28-,33+/m0/s1	YHPMBPSGDQLXHP-UUZIFAJNSA-N	610.409420868							117811
BRD-K34370545	LSM-29261		44494616	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23-,24-,29+/m1/s1	GPFIDTWNGXWRJK-XTGAJNFRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K34370545	BRD-K34370545-001-01-2	Broad Institute of MIT and Harvard	BRD-K34370545			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23-,24-,29+/m1/s1	GPFIDTWNGXWRJK-XTGAJNFRSA-N	575.30290688							117812
BRD-K23085156	LSM-29262		44484595	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25-,30-/m0/s1	OPCOPDBCCFUTHV-SODQHWRNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K23085156	BRD-K23085156-001-01-9	Broad Institute of MIT and Harvard	BRD-K23085156			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25-,30-/m0/s1	OPCOPDBCCFUTHV-SODQHWRNSA-N	525.356657014							117813
BRD-K26373865	LSM-29263		44492610	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23-,24+,29-/m0/s1	GPFIDTWNGXWRJK-OODISRMCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K26373865	BRD-K26373865-001-01-8	Broad Institute of MIT and Harvard	BRD-K26373865			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H45N3O6S/c1-22-19-33(23(2)21-34)30(35)27-18-25(31(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-32(6)40(36,37)26-13-8-7-9-14-26/h7-9,13-16,18,22-24,29,34H,10-12,17,19-21H2,1-6H3/t22-,23-,24+,29-/m0/s1	GPFIDTWNGXWRJK-OODISRMCSA-N	575.30290688							117814
BRD-K30823221	LSM-29264		44501846	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27-/m0/s1	WPSSTONNMATWEF-XTYKIWRDSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K30823221	BRD-K30823221-001-01-5	Broad Institute of MIT and Harvard	BRD-K30823221			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27-/m0/s1	WPSSTONNMATWEF-XTYKIWRDSA-N	581.23263443							117815
BRD-K32403948	LSM-29265		54614724	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33+/m0/s1	NGSMHOKAGHIENU-LIHQSLCGSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K32403948	BRD-K32403948-001-01-6	Broad Institute of MIT and Harvard	BRD-K32403948			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26+,27-,33+/m0/s1	NGSMHOKAGHIENU-LIHQSLCGSA-N	623.404669846001							117816
BRD-K34181077	LSM-29266		44504313	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26+,27+,32-/m0/s1	SDZYTDXKXKHZJE-XDZDDBEASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K34181077	BRD-K34181077-001-01-9	Broad Institute of MIT and Harvard	BRD-K34181077			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-33(41)16-12-19-37(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)34(42)28-14-8-7-9-15-28/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,41)/t25-,26+,27+,32-/m0/s1	SDZYTDXKXKHZJE-XDZDDBEASA-N	624.388685424							117817
BRD-K36815183	LSM-29267		44487021	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,28-/m1/s1	BRKIAEBRDYHMFE-JTNFPWQOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K36815183	BRD-K36815183-001-01-1	Broad Institute of MIT and Harvard	BRD-K36815183			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)30(37)26-17-25(32(4)5)10-11-27(26)39-23(3)9-7-8-16-38-28(21)19-33(6)29(36)24-12-14-31-15-13-24/h10-15,17,21-23,28,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,28-/m1/s1	BRKIAEBRDYHMFE-JTNFPWQOSA-N	540.331170548							117818
BRD-K25075258	LSM-29268		44620663	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22+,23+,29-/m1/s1	PSEUFYCSFOBFBF-KOBSQPAKSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K25075258	BRD-K25075258-001-01-5	Broad Institute of MIT and Harvard	BRD-K25075258			COc1ccc(NC(=O)Nc2ccc3O[C@@H](C)CCCCO[C@H](CN(C)C)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22+,23+,29-/m1/s1	PSEUFYCSFOBFBF-KOBSQPAKSA-N	570.341735232							117819
BRD-K32093012	LSM-29269		44490893	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24-,29+/m0/s1	ZJHDPNYYPDHDNF-HGPRPZRGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K32093012	BRD-K32093012-001-01-6	Broad Institute of MIT and Harvard	BRD-K32093012			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-33(4)5/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23-,24-,29+/m0/s1	ZJHDPNYYPDHDNF-HGPRPZRGSA-N	539.33592157							117820
BRD-K25199508	LSM-29270		44503647	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24+,29+/m0/s1	CWMFJYTZROJEEY-CMSZEEODSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCC(F)(F)F)cc3C1=O	BroadT	BRD-K25199508	BRD-K25199508-001-01-1	Broad Institute of MIT and Harvard	BRD-K25199508			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C32H45F3N4O5/c1-22-18-39(23(2)21-40)31(42)27-17-26(37-30(41)10-13-32(33,34)35)8-9-28(27)44-24(3)7-5-6-16-43-29(22)20-38(4)19-25-11-14-36-15-12-25/h8-9,11-12,14-15,17,22-24,29,40H,5-7,10,13,16,18-21H2,1-4H3,(H,37,41)/t22-,23+,24+,29+/m0/s1	CWMFJYTZROJEEY-CMSZEEODSA-N	622.33420518							117821
BRD-K31169989	LSM-29271		44619301	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29+/m0/s1	MEJMTXOOFVGIJM-LQZKXZFMSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K31169989	BRD-K31169989-001-01-4	Broad Institute of MIT and Harvard	BRD-K31169989			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22+,23-,29+/m0/s1	MEJMTXOOFVGIJM-LQZKXZFMSA-N	593.293485048							117822
BRD-K20853228	LSM-29272		44501845	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19+,23-/m0/s1	QBUCHBBMZJBUJI-LVBDUCALSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K20853228	BRD-K20853228-001-01-7	Broad Institute of MIT and Harvard	BRD-K20853228			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H40F3N3O5/c1-17-15-32(18(2)16-33)25(35)21-13-20(31-24(34)10-11-26(27,28)29)8-9-22(21)37-19(3)7-5-6-12-36-23(17)14-30-4/h8-9,13,17-19,23,30,33H,5-7,10-12,14-16H2,1-4H3,(H,31,34)/t17-,18+,19+,23-/m0/s1	QBUCHBBMZJBUJI-LVBDUCALSA-N	531.29200601							117823
BRD-K26569518	LSM-29273		54614766	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28+/m0/s1	KDWFAOIYLGHTDK-MIUQQGMZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	BroadT	BRD-K26569518	BRD-K26569518-001-01-2	Broad Institute of MIT and Harvard	BRD-K26569518			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O	InChI=1S/C29H42FN3O6S/c1-20-17-33(21(2)19-34)29(35)26-16-24(31-40(36,37)25-12-9-23(30)10-13-25)11-14-27(26)39-22(3)8-6-7-15-38-28(20)18-32(4)5/h9-14,16,20-22,28,31,34H,6-8,15,17-19H2,1-5H3/t20-,21-,22-,28+/m0/s1	KDWFAOIYLGHTDK-MIUQQGMZSA-N	579.277834984							117824
BRD-K21826560	LSM-29274		44492603	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32-/m0/s1	LKIIRWUIYHEPDR-ZQIYOYMASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K21826560	BRD-K21826560-001-01-8	Broad Institute of MIT and Harvard	BRD-K21826560			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25-,26+,32-/m0/s1	LKIIRWUIYHEPDR-ZQIYOYMASA-N	622.37303536							117825
BRD-K34542210	LSM-29275		44491472	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22+,26-/m1/s1	ANVCKVJMNHXGBG-ZUVQJFRASA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K34542210	BRD-K34542210-001-01-0	Broad Institute of MIT and Harvard	BRD-K34542210			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H43N3O6S2/c1-20-17-31(21(2)19-32)28(33)24-16-23(29(4)5)12-13-25(24)37-22(3)10-7-8-14-36-26(20)18-30(6)39(34,35)27-11-9-15-38-27/h9,11-13,15-16,20-22,26,32H,7-8,10,14,17-19H2,1-6H3/t20-,21-,22+,26-/m1/s1	ANVCKVJMNHXGBG-ZUVQJFRASA-N	581.259327506							117826
BRD-K25942808	LSM-29276		44504566	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27+/m0/s1	OPIQAKQROYPQNZ-ZAACQVCWSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K25942808	BRD-K25942808-001-01-1	Broad Institute of MIT and Harvard	BRD-K25942808			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27+/m0/s1	OPIQAKQROYPQNZ-ZAACQVCWSA-N	565.26218492							117827
BRD-K34489843	LSM-29277		44620460	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24+,29+/m0/s1	PRCUBQSECBZBSK-PHBCIFJZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K34489843	BRD-K34489843-001-01-9	Broad Institute of MIT and Harvard	BRD-K34489843			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24+,29+/m0/s1	PRCUBQSECBZBSK-PHBCIFJZSA-N	575.30290688							117828
BRD-K36804307	LSM-29278		54614735	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22-,23+,28-/m1/s1	SKZBTEBCBLPBIZ-SQVYLTPJSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K36804307	BRD-K36804307-001-01-6	Broad Institute of MIT and Harvard	BRD-K36804307			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22-,23+,28-/m1/s1	SKZBTEBCBLPBIZ-SQVYLTPJSA-N	561.287256816							117829
BRD-K26094217	LSM-29279		44501781	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22+,23+,30+/m0/s1	SIEZSLVXLUPDNY-JONNCTARSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc4ccc(cc4C1=O)N(C)C	BroadT	BRD-K26094217	BRD-K26094217-001-01-5	Broad Institute of MIT and Harvard	BRD-K26094217			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H46N4O7/c1-21-17-36(22(2)19-37)31(38)26-16-25(34(4)5)11-13-27(26)43-23(3)9-7-8-14-40-30(21)18-35(6)32(39)33-24-10-12-28-29(15-24)42-20-41-28/h10-13,15-16,21-23,30,37H,7-9,14,17-20H2,1-6H3,(H,33,39)/t21-,22+,23+,30+/m0/s1	SIEZSLVXLUPDNY-JONNCTARSA-N	598.336649852							117830
BRD-K29560103	LSM-29280		44491500	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20-,21+,26+/m0/s1	UGHRLCJQQBYBPV-KWALNSLNSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K29560103	BRD-K29560103-001-01-9	Broad Institute of MIT and Harvard	BRD-K29560103			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H40N4O5/c1-19-17-32(20(2)18-33)28(35)24-15-23(31-27(34)22-10-12-30-13-11-22)8-9-25(24)37-21(3)7-5-6-14-36-26(19)16-29-4/h8-13,15,19-21,26,29,33H,5-7,14,16-18H2,1-4H3,(H,31,34)/t19-,20-,21+,26+/m0/s1	UGHRLCJQQBYBPV-KWALNSLNSA-N	512.29987042							117831
BRD-K31034311	LSM-29281		44487487	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28+/m0/s1	OWRRZEUGKXIWTQ-WYNJNVBPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K31034311	BRD-K31034311-001-01-9	Broad Institute of MIT and Harvard	BRD-K31034311			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23-,28+/m0/s1	OWRRZEUGKXIWTQ-WYNJNVBPSA-N	540.331170548							117832
BRD-K34640380	LSM-29282		54614731	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24-,25+,30+/m0/s1	HYZLHQOJAWWHRH-ZQIPMTRKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K34640380	BRD-K34640380-001-01-6	Broad Institute of MIT and Harvard	BRD-K34640380			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O6S/c1-22-11-14-27(15-12-22)41(37,38)33(7)20-30-23(2)19-34(24(3)21-35)31(36)28-18-26(32(5)6)13-16-29(28)40-25(4)10-8-9-17-39-30/h11-16,18,23-25,30,35H,8-10,17,19-21H2,1-7H3/t23-,24-,25+,30+/m0/s1	HYZLHQOJAWWHRH-ZQIPMTRKSA-N	589.318556944							117833
BRD-K31666797	LSM-29283		54614791	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27-/m0/s1	OPIQAKQROYPQNZ-WFQVPWNOSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K31666797	BRD-K31666797-001-01-1	Broad Institute of MIT and Harvard	BRD-K31666797			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H40FN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21-,27-/m0/s1	OPIQAKQROYPQNZ-WFQVPWNOSA-N	565.26218492							117834
BRD-K21196859	LSM-29284		44617667	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18-,22+/m0/s1	GOTBAIXNEHVFNA-VDNWNZSNSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K21196859	BRD-K21196859-001-01-6	Broad Institute of MIT and Harvard	BRD-K21196859			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18-,22+/m0/s1	GOTBAIXNEHVFNA-VDNWNZSNSA-N	485.255956688							117835
BRD-K28700379	LSM-29285		44504042	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24+,29-/m0/s1	XPIAMQJKSFNCJS-SEAFADMZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	BroadT	BRD-K28700379	BRD-K28700379-001-01-9	Broad Institute of MIT and Harvard	BRD-K28700379			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-30(36)17-25-12-7-6-8-13-25)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)42(5,38)39/h6-8,12-15,18,22-24,29,35H,9-11,16-17,19-21H2,1-5H3,(H,32,36)/t22-,23+,24+,29-/m0/s1	XPIAMQJKSFNCJS-SEAFADMZSA-N	603.2978215							117836
BRD-K34798837	LSM-29286		44618708	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23-,27+/m1/s1	XJLXIOLTLBOFKC-IDIXZGLXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K34798837	BRD-K34798837-001-01-1	Broad Institute of MIT and Harvard	BRD-K34798837			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23-,27+/m1/s1	XJLXIOLTLBOFKC-IDIXZGLXSA-N	598.34002067							117837
BRD-K36795325	LSM-29287		44486988	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19-,23-/m0/s1	HNAHSZOZZNPVNF-YWNPBTLJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K36795325	BRD-K36795325-001-01-4	Broad Institute of MIT and Harvard	BRD-K36795325			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19-,23-/m0/s1	HNAHSZOZZNPVNF-YWNPBTLJSA-N	499.271606752							117838
BRD-K30989303	LSM-29288		44493601	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20+,26-/m1/s1	YDWJBUOXSRVMJV-WWMMDOJLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)onc3C)cc2C1=O	BroadT	BRD-K30989303	BRD-K30989303-001-01-5	Broad Institute of MIT and Harvard	BRD-K30989303			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O	InChI=1S/C29H45N5O6/c1-18-15-34(19(2)17-35)28(36)24-14-23(30-29(37)31-27-21(4)32-40-22(27)5)11-12-25(24)39-20(3)10-8-9-13-38-26(18)16-33(6)7/h11-12,14,18-20,26,35H,8-10,13,15-17H2,1-7H3,(H2,30,31,37)/t18-,19+,20+,26-/m1/s1	YDWJBUOXSRVMJV-WWMMDOJLSA-N	559.33698421							117839
BRD-K20257792-001-01-7	LSM-29289	BRD-K20257792	44618269	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23-,24-,30-/m1/s1	OKIGVZMNGZVCJM-NULUGNBJSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@H]2C)[C@H](C)CO)N(C)C	BroadT	BRD-K20257792	BRD-K20257792-001-01-7	Broad Institute of MIT and Harvard	BRD-K20257792			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23-,24-,30-/m1/s1	OKIGVZMNGZVCJM-NULUGNBJSA-N	605.313471564							117840
BRD-K38571893	LSM-29290		44617665	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29+/m0/s1	MEJMTXOOFVGIJM-FSDPBTBWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K38571893	BRD-K38571893-001-01-9	Broad Institute of MIT and Harvard	BRD-K38571893			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29+/m0/s1	MEJMTXOOFVGIJM-FSDPBTBWSA-N	593.293485048							117841
BRD-K29254503	LSM-29291		44496462	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22+,26-/m1/s1	UJYZNBPSVBHVBP-FYBXHKAZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K29254503	BRD-K29254503-001-01-5	Broad Institute of MIT and Harvard	BRD-K29254503			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C28H45N5O6S/c1-20-15-33(21(2)18-34)28(35)24-14-23(30(4)5)11-12-25(24)39-22(3)10-8-9-13-38-26(20)16-32(7)40(36,37)27-17-31(6)19-29-27/h11-12,14,17,19-22,26,34H,8-10,13,15-16,18H2,1-7H3/t20-,21+,22+,26-/m1/s1	UJYZNBPSVBHVBP-FYBXHKAZSA-N	579.3090549							117842
BRD-K27889081	LSM-29292		54614776	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27-/m1/s1	WPSSTONNMATWEF-MYCJUQKNSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K27889081	BRD-K27889081-001-01-0	Broad Institute of MIT and Harvard	BRD-K27889081			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H40ClN3O6S/c1-19-17-32(20(2)18-33)28(34)25-15-23(31-39(35,36)24-11-8-22(29)9-12-24)10-13-26(25)38-21(3)7-5-6-14-37-27(19)16-30-4/h8-13,15,19-21,27,30-31,33H,5-7,14,16-18H2,1-4H3/t19-,20+,21+,27-/m1/s1	WPSSTONNMATWEF-MYCJUQKNSA-N	581.23263443							117843
BRD-K31367750	LSM-15031		44485146	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20+,21-,27+/m1/s1	PQVSIMSGGSSCRI-RBZJZWSTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K31367750	BRD-K31367750-001-01-1	Broad Institute of MIT and Harvard	BRD-K31367750			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C29H46N4O7S/c1-19-16-33(20(2)18-34)29(35)25-15-24(31(6)7)12-13-26(25)39-21(3)11-9-10-14-38-27(19)17-32(8)41(36,37)28-22(4)30-40-23(28)5/h12-13,15,19-21,27,34H,9-11,14,16-18H2,1-8H3/t19-,20+,21-,27+/m1/s1	PQVSIMSGGSSCRI-RBZJZWSTSA-N	594.308720542							103687
BRD-K23867157	LSM-29293		44617550	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22-,23-,30+/m0/s1	KQLDLPDWVHVVHP-GDCCIXDYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc4ccc(NS(=O)(=O)C)cc4C1=O	BroadT	BRD-K23867157	BRD-K23867157-001-01-9	Broad Institute of MIT and Harvard	BRD-K23867157			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O8S/c1-21-16-34(22(2)19-35)31(36)26-15-25(32-43(5,37)38)10-12-27(26)42-23(3)8-6-7-13-39-30(21)18-33(4)17-24-9-11-28-29(14-24)41-20-40-28/h9-12,14-15,21-23,30,32,35H,6-8,13,16-20H2,1-5H3/t21-,22-,23-,30+/m0/s1	KQLDLPDWVHVVHP-GDCCIXDYSA-N	619.29273612							117844
BRD-K21386594	LSM-29294		44494510	InChI=1S/C30H43N3O5/c1-21-19-33(22(2)20-34)30(36)26-17-25(32-29(35)16-24-11-6-5-7-12-24)13-14-27(26)38-23(3)10-8-9-15-37-28(21)18-31-4/h5-7,11-14,17,21-23,28,31,34H,8-10,15-16,18-20H2,1-4H3,(H,32,35)/t21-,22-,23-,28-/m0/s1	GZRWXBHQPNTACC-AMZZYFJHSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K21386594	BRD-K21386594-001-01-3	Broad Institute of MIT and Harvard	BRD-K21386594			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Cc3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H43N3O5/c1-21-19-33(22(2)20-34)30(36)26-17-25(32-29(35)16-24-11-6-5-7-12-24)13-14-27(26)38-23(3)10-8-9-15-37-28(21)18-31-4/h5-7,11-14,17,21-23,28,31,34H,8-10,15-16,18-20H2,1-4H3,(H,32,35)/t21-,22-,23-,28-/m0/s1	GZRWXBHQPNTACC-AMZZYFJHSA-N	525.320271506							117845
BRD-K27132686	LSM-29295		44483830	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28-/m0/s1	OWRRZEUGKXIWTQ-FPZRTEDSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	BroadT	BRD-K27132686	BRD-K27132686-001-01-4	Broad Institute of MIT and Harvard	BRD-K27132686			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O	InChI=1S/C30H44N4O5/c1-21-18-34(22(2)20-35)29(36)26-17-25(32-30(37)31-24-12-7-6-8-13-24)14-15-27(26)39-23(3)11-9-10-16-38-28(21)19-33(4)5/h6-8,12-15,17,21-23,28,35H,9-11,16,18-20H2,1-5H3,(H2,31,32,37)/t21-,22+,23+,28-/m0/s1	OWRRZEUGKXIWTQ-FPZRTEDSSA-N	540.331170548							117846
BRD-K33197627	LSM-29296		54614727	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24+,30-/m0/s1	XIVCQDXGZVVHDO-WAHOFHFDSA-N	COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K33197627	BRD-K33197627-001-01-1	Broad Institute of MIT and Harvard	BRD-K33197627			COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(NS(C)(=O)=O)cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H47N3O7S/c1-22-18-34(23(2)21-35)31(36)28-17-26(32-42(6,37)38)12-15-29(28)41-24(3)9-7-8-16-40-30(22)20-33(4)19-25-10-13-27(39-5)14-11-25/h10-15,17,22-24,30,32,35H,7-9,16,18-21H2,1-6H3/t22-,23-,24+,30-/m0/s1	XIVCQDXGZVVHDO-WAHOFHFDSA-N	605.313471564							117847
BRD-K25944327	LSM-29297		44485788	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25+,30-/m1/s1	OPCOPDBCCFUTHV-ZASNTINBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K25944327	BRD-K25944327-001-01-9	Broad Institute of MIT and Harvard	BRD-K25944327			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24-,25+,30-/m1/s1	OPCOPDBCCFUTHV-ZASNTINBSA-N	525.356657014							117848
BRD-K23200057	LSM-29298		45480093	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23-,27-/m1/s1	XJLXIOLTLBOFKC-QSGNWFJVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K23200057	BRD-K23200057-001-01-4	Broad Institute of MIT and Harvard	BRD-K23200057			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)41(7,37)38/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23-,27-/m1/s1	XJLXIOLTLBOFKC-QSGNWFJVSA-N	598.34002067							117849
BRD-K22011492	LSM-29299		44617739	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22+,23-,29-/m0/s1	PSEUFYCSFOBFBF-OJNHJINQSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2)cc1	BroadT	BRD-K22011492	BRD-K22011492-001-01-9	Broad Institute of MIT and Harvard	BRD-K22011492			COc1ccc(NC(=O)Nc2ccc3O[C@@H](C)CCCCO[C@@H](CN(C)C)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2)cc1	InChI=1S/C31H46N4O6/c1-21-18-35(22(2)20-36)30(37)27-17-25(33-31(38)32-24-10-13-26(39-6)14-11-24)12-15-28(27)41-23(3)9-7-8-16-40-29(21)19-34(4)5/h10-15,17,21-23,29,36H,7-9,16,18-20H2,1-6H3,(H2,32,33,38)/t21-,22+,23-,29-/m0/s1	PSEUFYCSFOBFBF-OJNHJINQSA-N	570.341735232							117850
BRD-K26924781	LSM-29300		54614770	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33+/m1/s1	LFCBJIZGBQWHQM-CYNXIGLJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K26924781	BRD-K26924781-001-01-9	Broad Institute of MIT and Harvard	BRD-K26924781			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33+/m1/s1	LFCBJIZGBQWHQM-CYNXIGLJSA-N	602.346820612							117851
BRD-K35386584	LSM-29301		44498595	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27-/m1/s1	AOLQWFIMADKXQA-RSOWOKRSSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K35386584	BRD-K35386584-001-01-9	Broad Institute of MIT and Harvard	BRD-K35386584			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22-,27-/m1/s1	AOLQWFIMADKXQA-RSOWOKRSSA-N	511.304621442							117852
BRD-K27228812	LSM-29302		44490338	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20+,24+/m0/s1	JFWSYQFTTWMPPF-PWSZPPJVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	BroadT	BRD-K27228812	BRD-K27228812-001-01-7	Broad Institute of MIT and Harvard	BRD-K27228812			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C1=O	InChI=1S/C27H42F3N3O5/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-25(35)11-12-27(28,29)30)9-10-23(22)38-20(3)8-6-7-13-37-24(18)16-32(4)5/h9-10,14,18-20,24,34H,6-8,11-13,15-17H2,1-5H3,(H,31,35)/t18-,19-,20+,24+/m0/s1	JFWSYQFTTWMPPF-PWSZPPJVSA-N	545.307656074							117853
BRD-K27997230	LSM-29303		44504567	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22+,27-/m0/s1	AOLQWFIMADKXQA-HQKZVIGLSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K27997230	BRD-K27997230-001-01-1	Broad Institute of MIT and Harvard	BRD-K27997230			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O5/c1-20-18-32(21(2)19-33)29(35)25-16-24(31-28(34)23-11-6-5-7-12-23)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-30-4/h5-7,11-14,16,20-22,27,30,33H,8-10,15,17-19H2,1-4H3,(H,31,34)/t20-,21+,22+,27-/m0/s1	AOLQWFIMADKXQA-HQKZVIGLSA-N	511.304621442							117854
BRD-K27902176	LSM-29304		54614777	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30-/m1/s1	RSKGZFLSRBPJST-UBRKHCEVSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K27902176	BRD-K27902176-001-01-7	Broad Institute of MIT and Harvard	BRD-K27902176			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C33H55N5O6/c1-22(2)34-33(42)37(6)20-30-23(3)19-38(24(4)21-39)31(40)28-18-27(36-32(41)35-26-13-8-7-9-14-26)15-16-29(28)44-25(5)12-10-11-17-43-30/h15-16,18,22-26,30,39H,7-14,17,19-21H2,1-6H3,(H,34,42)(H2,35,36,41)/t23-,24+,25+,30-/m1/s1	RSKGZFLSRBPJST-UBRKHCEVSA-N	617.41523453							117855
BRD-K32343246	LSM-29305		44490223	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23+,28+/m0/s1	GAZXHMFIMHCKKU-TUEWKVEFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K32343246	BRD-K32343246-001-01-3	Broad Institute of MIT and Harvard	BRD-K32343246			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H44N4O6S/c1-21-17-33(22(2)20-34)29(35)26-16-25(31-40(5,36)37)9-10-27(26)39-23(3)8-6-7-15-38-28(21)19-32(4)18-24-11-13-30-14-12-24/h9-14,16,21-23,28,31,34H,6-8,15,17-20H2,1-5H3/t21-,22+,23+,28+/m0/s1	GAZXHMFIMHCKKU-TUEWKVEFSA-N	576.298155858							117856
BRD-K23560817	LSM-29306		44498212	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24-,25-,31+/m0/s1	HLAXWBUNQRUQJP-QNBZCSHPSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C)cc1	BroadT	BRD-K23560817	BRD-K23560817-001-01-2	Broad Institute of MIT and Harvard	BRD-K23560817			COc1ccc(CN(C)C[C@H]2OCCCC[C@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C)cc1	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24-,25-,31+/m0/s1	HLAXWBUNQRUQJP-QNBZCSHPSA-N	555.367221698							117857
BRD-K37262314	LSM-29307		45480111	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28-/m1/s1	DKJIIKWCTXJSNY-JTNFPWQOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K37262314	BRD-K37262314-001-01-7	Broad Institute of MIT and Harvard	BRD-K37262314			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O	InChI=1S/C29H43N3O6S/c1-21-18-32(22(2)20-33)29(34)26-17-24(30-39(35,36)25-12-7-6-8-13-25)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-31(4)5/h6-8,12-15,17,21-23,28,30,33H,9-11,16,18-20H2,1-5H3/t21-,22+,23-,28-/m1/s1	DKJIIKWCTXJSNY-JTNFPWQOSA-N	561.287256816							117858
BRD-K34475679	LSM-29308		54614730	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33-/m0/s1	LFCBJIZGBQWHQM-IZPIQJOWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccccc4)cc3C1=O	BroadT	BRD-K34475679	BRD-K34475679-001-01-7	Broad Institute of MIT and Harvard	BRD-K34475679			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H46N4O5/c1-25-21-39(26(2)24-40)35(42)31-20-30(37-34(41)29-11-6-5-7-12-29)13-14-32(31)44-27(3)10-8-9-19-43-33(25)23-38(4)22-28-15-17-36-18-16-28/h5-7,11-18,20,25-27,33,40H,8-10,19,21-24H2,1-4H3,(H,37,41)/t25-,26+,27-,33-/m0/s1	LFCBJIZGBQWHQM-IZPIQJOWSA-N	602.346820612							117859
BRD-K35296094	LSM-29309		54614732	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23-,24+,30-/m0/s1	IYJPIDGCXVWPNR-WAHOFHFDSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C)cc1	BroadT	BRD-K35296094	BRD-K35296094-001-01-3	Broad Institute of MIT and Harvard	BRD-K35296094			COc1ccc(NC(=O)N(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C)cc1	InChI=1S/C32H48N4O6/c1-22-19-36(23(2)21-37)31(38)28-18-26(34(4)5)13-16-29(28)42-24(3)10-8-9-17-41-30(22)20-35(6)32(39)33-25-11-14-27(40-7)15-12-25/h11-16,18,22-24,30,37H,8-10,17,19-21H2,1-7H3,(H,33,39)/t22-,23-,24+,30-/m0/s1	IYJPIDGCXVWPNR-WAHOFHFDSA-N	584.357385296							117860
BRD-K28880788	LSM-29310		44487508	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23+/m1/s1	HNAHSZOZZNPVNF-XQQXVUDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K28880788	BRD-K28880788-001-01-4	Broad Institute of MIT and Harvard	BRD-K28880788			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C24H41N3O6S/c1-17-14-27(18(2)16-28)24(29)21-13-20(25-34(6,30)31)10-11-22(21)33-19(3)9-7-8-12-32-23(17)15-26(4)5/h10-11,13,17-19,23,25,28H,7-9,12,14-16H2,1-6H3/t17-,18+,19+,23+/m1/s1	HNAHSZOZZNPVNF-XQQXVUDOSA-N	499.271606752							117861
BRD-K25200031	LSM-29311		44619284	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29-/m1/s1	LZRQCLPDICKWHD-PZNASWHRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K25200031	BRD-K25200031-001-01-3	Broad Institute of MIT and Harvard	BRD-K25200031			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44ClN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23-,29-/m1/s1	LZRQCLPDICKWHD-PZNASWHRSA-N	609.263934558							117862
BRD-K38258132	LSM-29312		44620005	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18-,22-/m0/s1	GOTBAIXNEHVFNA-ORGXJRBJSA-N	CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K38258132	BRD-K38258132-001-01-4	Broad Institute of MIT and Harvard	BRD-K38258132			CNC[C@@H]1OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17-,18-,22-/m0/s1	GOTBAIXNEHVFNA-ORGXJRBJSA-N	485.255956688							117863
BRD-K38248920	LSM-29313		44484557	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19-,20-,24-/m0/s1	LBVOXJOHMPITGR-XHOYROJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K38248920	BRD-K38248920-001-01-1	Broad Institute of MIT and Harvard	BRD-K38248920			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C27H42F3N3O7S/c1-18-15-33(19(2)17-34)26(36)22-14-21(31-41(5,37)38)9-10-23(22)40-20(3)8-6-7-13-39-24(18)16-32(4)25(35)11-12-27(28,29)30/h9-10,14,18-20,24,31,34H,6-8,11-13,15-17H2,1-5H3/t18-,19-,20-,24-/m0/s1	LBVOXJOHMPITGR-XHOYROJHSA-N	609.269556004							117864
BRD-K25988916	LSM-29314		44619644	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m1/s1	XHZKQAVNDGMQPU-JTNFPWQOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K25988916	BRD-K25988916-001-01-3	Broad Institute of MIT and Harvard	BRD-K25988916			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O7S/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)40-23(3)11-9-10-16-39-28(21)19-32(4)41(5,37)38/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23-,28-/m1/s1	XHZKQAVNDGMQPU-JTNFPWQOSA-N	589.282171436							117865
BRD-K32127177	LSM-29315		54614723	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26+,27-,32+/m0/s1	ZMTJRORPEDZKCY-ACIRYHQQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K32127177	BRD-K32127177-001-01-3	Broad Institute of MIT and Harvard	BRD-K32127177			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C35H52N4O6/c1-25-22-39(26(2)24-40)35(43)30-21-29(36-34(42)28-14-8-7-9-15-28)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-38(6)33(41)16-12-19-37(4)5/h7-9,14-15,17-18,21,25-27,32,40H,10-13,16,19-20,22-24H2,1-6H3,(H,36,42)/t25-,26+,27-,32+/m0/s1	ZMTJRORPEDZKCY-ACIRYHQQSA-N	624.388685424							117866
BRD-K35123860	LSM-29316		44490254	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28-/m0/s1	LQSMEYMBJWSEPC-FPZRTEDSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	BroadT	BRD-K35123860	BRD-K35123860-001-01-1	Broad Institute of MIT and Harvard	BRD-K35123860			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C1=O	InChI=1S/C30H43N3O5/c1-21-18-33(22(2)20-34)30(36)26-17-25(31-29(35)24-12-7-6-8-13-24)14-15-27(26)38-23(3)11-9-10-16-37-28(21)19-32(4)5/h6-8,12-15,17,21-23,28,34H,9-11,16,18-20H2,1-5H3,(H,31,35)/t21-,22+,23+,28-/m0/s1	LQSMEYMBJWSEPC-FPZRTEDSSA-N	525.320271506							117867
BRD-K20836550	LSM-29317		54614746	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24-,29+/m1/s1	PRCUBQSECBZBSK-XTGAJNFRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K20836550	BRD-K20836550-001-01-0	Broad Institute of MIT and Harvard	BRD-K20836550			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23-,24-,29+/m1/s1	PRCUBQSECBZBSK-XTGAJNFRSA-N	575.30290688							117868
BRD-K24487269	LSM-29318		44616580	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,27-/m1/s1	QNMRQELCDYNENZ-FGCFSOHPSA-N	CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K24487269	BRD-K24487269-001-01-0	Broad Institute of MIT and Harvard	BRD-K24487269			CNC[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H41FN4O5/c1-19-17-34(20(2)18-35)28(36)25-15-24(33-29(37)32-23-10-8-22(30)9-11-23)12-13-26(25)39-21(3)7-5-6-14-38-27(19)16-31-4/h8-13,15,19-21,27,31,35H,5-7,14,16-18H2,1-4H3,(H2,32,33,37)/t19-,20+,21-,27-/m1/s1	QNMRQELCDYNENZ-FGCFSOHPSA-N	544.306098652							117869
BRD-K21933068	LSM-29319		54614751	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21-,22+,26-/m0/s1	ZWQRBFIYGZIGKO-IFOBJOEFSA-N	CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K21933068	BRD-K21933068-001-01-9	Broad Institute of MIT and Harvard	BRD-K21933068			CCCN(C)C[C@@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)CCC(F)(F)F)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H46F3N3O5/c1-6-14-34(5)18-26-20(2)17-35(21(3)19-36)28(38)24-16-23(33-27(37)12-13-29(30,31)32)10-11-25(24)40-22(4)9-7-8-15-39-26/h10-11,16,20-22,26,36H,6-9,12-15,17-19H2,1-5H3,(H,33,37)/t20-,21-,22+,26-/m0/s1	ZWQRBFIYGZIGKO-IFOBJOEFSA-N	573.338956202							117870
BRD-K36883526	LSM-29320		49843220	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26-,27+,32+/m1/s1	ZCLFEQBFHRMJFK-WEBZSHJMSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K36883526	BRD-K36883526-001-01-5	Broad Institute of MIT and Harvard	BRD-K36883526			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26-,27+,32+/m1/s1	ZCLFEQBFHRMJFK-WEBZSHJMSA-N	611.404669846							117871
BRD-K36807301	LSM-29321		44617418	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23-,24-,30+/m0/s1	YDCDOYMHDVYTIM-ZUHGBKBGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K36807301	BRD-K36807301-001-01-5	Broad Institute of MIT and Harvard	BRD-K36807301			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C32H46N4O5/c1-22-18-36(23(2)21-37)32(39)28-17-27(34-31(38)26-12-14-33-15-13-26)10-11-29(28)41-24(3)7-5-6-16-40-30(22)20-35(4)19-25-8-9-25/h10-15,17,22-25,30,37H,5-9,16,18-21H2,1-4H3,(H,34,38)/t22-,23-,24-,30+/m0/s1	YDCDOYMHDVYTIM-ZUHGBKBGSA-N	566.346820612							117872
BRD-K24319052	LSM-15122		44618474	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23+,24-,29+/m0/s1	MOSVBDAIGOGSPE-HNFJUSDZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K24319052	BRD-K24319052-001-01-6	Broad Institute of MIT and Harvard	BRD-K24319052			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C30H51N3O6S/c1-22-18-33(23(2)21-34)30(35)27-17-26(31-40(5,36)37)14-15-28(27)39-24(3)11-9-10-16-38-29(22)20-32(4)19-25-12-7-6-8-13-25/h14-15,17,22-25,29,31,34H,6-13,16,18-21H2,1-5H3/t22-,23+,24-,29+/m0/s1	MOSVBDAIGOGSPE-HNFJUSDZSA-N	581.349857072							103778
BRD-K39090122	LSM-29322		54614742	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22+,23-,27+/m0/s1	MTZUJVYQNWSRMQ-NBCVKUGOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C1=O	BroadT	BRD-K39090122	BRD-K39090122-001-01-2	Broad Institute of MIT and Harvard	BRD-K39090122			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C29H50N4O7S/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-41(7,37)38)13-14-26(25)40-23(3)11-8-9-16-39-27(21)19-32(6)28(35)12-10-15-31(4)5/h13-14,17,21-23,27,30,34H,8-12,15-16,18-20H2,1-7H3/t21-,22+,23-,27+/m0/s1	MTZUJVYQNWSRMQ-NBCVKUGOSA-N	598.34002067							117873
BRD-K30492965	LSM-29323		44620192	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17+,18-,22+/m0/s1	GOTBAIXNEHVFNA-RQXXJAGISA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)C)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K30492965	BRD-K30492965-001-01-9	Broad Institute of MIT and Harvard	BRD-K30492965			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H39N3O6S/c1-16-14-26(17(2)15-27)23(28)20-12-19(25-33(5,29)30)9-10-21(20)32-18(3)8-6-7-11-31-22(16)13-24-4/h9-10,12,16-18,22,24-25,27H,6-8,11,13-15H2,1-5H3/t16-,17+,18-,22+/m0/s1	GOTBAIXNEHVFNA-RQXXJAGISA-N	485.255956688							117874
MLS003130320	LSM-9919	BRD-K24565544	44483821	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25+,30-/m0/s1	OPCOPDBCCFUTHV-RPQPUBLWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K24565544	BRD-K24565544-001-01-0	Broad Institute of MIT and Harvard	BRD-K24565544			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H47N3O4/c1-23-19-34(24(2)22-35)31(36)28-18-27(32(4)5)15-16-29(28)38-25(3)12-10-11-17-37-30(23)21-33(6)20-26-13-8-7-9-14-26/h7-9,13-16,18,23-25,30,35H,10-12,17,19-22H2,1-6H3/t23-,24+,25+,30-/m0/s1	OPCOPDBCCFUTHV-RPQPUBLWSA-N	525.356657014							98540
MLS003128716	LSM-10614	BRD-K36165258, SID99358957	44504318	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25+,30-/m0/s1	ZGCRSIABJPRXFC-RPQPUBLWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K36165258	BRD-K36165258-001-01-1	Broad Institute of MIT and Harvard	BRD-K36165258			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24+,25+,30-/m0/s1	ZGCRSIABJPRXFC-RPQPUBLWSA-N	553.351571634							99235
BRD-K26282994	LSM-29324		44616401	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33+/m1/s1	NGSMHOKAGHIENU-ZLFFOLKFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc3ccc(NC(=O)NC4CCCCC4)cc3C1=O	BroadT	BRD-K26282994	BRD-K26282994-001-01-5	Broad Institute of MIT and Harvard	BRD-K26282994			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C1=O	InChI=1S/C35H53N5O5/c1-25-21-40(26(2)24-41)34(42)31-20-30(38-35(43)37-29-11-6-5-7-12-29)13-14-32(31)45-27(3)10-8-9-19-44-33(25)23-39(4)22-28-15-17-36-18-16-28/h13-18,20,25-27,29,33,41H,5-12,19,21-24H2,1-4H3,(H2,37,38,43)/t25-,26-,27+,33+/m1/s1	NGSMHOKAGHIENU-ZLFFOLKFSA-N	623.404669846001							117875
BRD-K30973947	LSM-29325		44487398	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24+,29+/m0/s1	SEDRIVHSDUVLLE-CMSZEEODSA-N	CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K30973947	BRD-K30973947-001-01-1	Broad Institute of MIT and Harvard	BRD-K30973947			CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C32H47N5O6/c1-21(2)34-32(41)36(6)19-29-22(3)18-37(23(4)20-38)31(40)27-17-26(35-30(39)25-12-14-33-15-13-25)10-11-28(27)43-24(5)9-7-8-16-42-29/h10-15,17,21-24,29,38H,7-9,16,18-20H2,1-6H3,(H,34,41)(H,35,39)/t22-,23+,24+,29+/m0/s1	SEDRIVHSDUVLLE-CMSZEEODSA-N	597.352634274							117876
BRD-K28826127	LSM-29326		44485829	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23-,27+/m0/s1	LTGDTYHJVMKPBL-NBCVKUGOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K28826127	BRD-K28826127-001-01-7	Broad Institute of MIT and Harvard	BRD-K28826127			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23-,27+/m0/s1	LTGDTYHJVMKPBL-NBCVKUGOSA-N	534.37812074							117877
BRD-K33702515	LSM-29327		44496423	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23+,29-/m0/s1	AGSKCAQZMPMVIM-DGGNIJSCSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K33702515	BRD-K33702515-001-01-3	Broad Institute of MIT and Harvard	BRD-K33702515			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H45FN4O5/c1-21-18-36(22(2)20-37)30(38)27-17-26(34(4)5)14-15-28(27)41-23(3)9-7-8-16-40-29(21)19-35(6)31(39)33-25-12-10-24(32)11-13-25/h10-15,17,21-23,29,37H,7-9,16,18-20H2,1-6H3,(H,33,39)/t21-,22-,23+,29-/m0/s1	AGSKCAQZMPMVIM-DGGNIJSCSA-N	572.33739878							117878
BRD-K36671227	LSM-29328		44486408	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24+,25-,32-/m1/s1	HBVPERRGRWZCML-PWRUDQNKSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	BroadT	BRD-K36671227	BRD-K36671227-001-01-6	Broad Institute of MIT and Harvard	BRD-K36671227			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3cccc4ccccc34)cc2C1=O	InChI=1S/C34H46N4O5/c1-23-20-38(24(2)22-39)33(40)29-19-27(35-34(41)36-30-15-10-13-26-12-6-7-14-28(26)30)16-17-31(29)43-25(3)11-8-9-18-42-32(23)21-37(4)5/h6-7,10,12-17,19,23-25,32,39H,8-9,11,18,20-22H2,1-5H3,(H2,35,36,41)/t23-,24+,25-,32-/m1/s1	HBVPERRGRWZCML-PWRUDQNKSA-N	590.346820612							117879
BRD-K24343968	LSM-29329		44490455	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21-,22-,29+/m1/s1	BFYBBBSDVFDXJC-GFGAIRHFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	BroadT	BRD-K24343968	BRD-K24343968-001-01-9	Broad Institute of MIT and Harvard	BRD-K24343968			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2C1=O	InChI=1S/C31H44N4O7/c1-20-16-35(21(2)18-36)30(37)25-14-23(32-31(38)33-24-10-12-27-28(15-24)41-19-40-27)9-11-26(25)42-22(3)8-6-7-13-39-29(20)17-34(4)5/h9-12,14-15,20-22,29,36H,6-8,13,16-19H2,1-5H3,(H2,32,33,38)/t20-,21-,22-,29+/m1/s1	BFYBBBSDVFDXJC-GFGAIRHFSA-N	584.320999788							117880
BRD-K28071390	LSM-29330		54614779	InChI=1S/C32H47FN4O5/c1-6-16-36(5)20-30-22(2)19-37(23(3)21-38)31(39)28-18-27(35-32(40)34-26-12-10-25(33)11-13-26)14-15-29(28)42-24(4)9-7-8-17-41-30/h10-15,18,22-24,30,38H,6-9,16-17,19-21H2,1-5H3,(H2,34,35,40)/t22-,23-,24-,30-/m0/s1	ZDZLFJDSEKLXNO-CQUCHYGKSA-N	CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K28071390	BRD-K28071390-001-01-0	Broad Institute of MIT and Harvard	BRD-K28071390			CCCN(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C32H47FN4O5/c1-6-16-36(5)20-30-22(2)19-37(23(3)21-38)31(39)28-18-27(35-32(40)34-26-12-10-25(33)11-13-26)14-15-29(28)42-24(4)9-7-8-17-41-30/h10-15,18,22-24,30,38H,6-9,16-17,19-21H2,1-5H3,(H2,34,35,40)/t22-,23-,24-,30-/m0/s1	ZDZLFJDSEKLXNO-CQUCHYGKSA-N	586.353048844							117881
BRD-K37696710	LSM-29331		44494990	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23+,24-,29+/m0/s1	VOOFHSDUWYITSP-HNFJUSDZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc3ccc(NS(=O)(=O)C)cc3C1=O	BroadT	BRD-K37696710	BRD-K37696710-001-01-6	Broad Institute of MIT and Harvard	BRD-K37696710			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@H](C)Oc2ccc(NS(C)(=O)=O)cc2C1=O	InChI=1S/C31H45N3O7S/c1-22-19-34(23(2)21-35)31(37)27-18-26(32-42(5,38)39)14-15-28(27)41-24(3)11-9-10-16-40-29(22)20-33(4)30(36)17-25-12-7-6-8-13-25/h6-8,12-15,18,22-24,29,32,35H,9-11,16-17,19-21H2,1-5H3/t22-,23+,24-,29+/m0/s1	VOOFHSDUWYITSP-HNFJUSDZSA-N	603.2978215							117882
BRD-K26559753	LSM-29332		44490456	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21-,22-,27+/m1/s1	JLURSCHFCUHCJF-RKGZYEPBSA-N	CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K26559753	BRD-K26559753-001-01-7	Broad Institute of MIT and Harvard	BRD-K26559753			CNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H41N3O6S/c1-20-18-31(21(2)19-32)28(33)25-16-23(30-38(34,35)24-11-6-5-7-12-24)13-14-26(25)37-22(3)10-8-9-15-36-27(20)17-29-4/h5-7,11-14,16,20-22,27,29-30,32H,8-10,15,17-19H2,1-4H3/t20-,21-,22-,27+/m1/s1	JLURSCHFCUHCJF-RKGZYEPBSA-N	547.271606752							117883
BRD-K27035180	LSM-29333		54614771	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29+/m0/s1	MEJMTXOOFVGIJM-UJUOIFIWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K27035180	BRD-K27035180-001-01-0	Broad Institute of MIT and Harvard	BRD-K27035180			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H44FN3O6S/c1-21-18-34(22(2)20-35)30(36)27-17-25(32(4)5)12-15-28(27)40-23(3)9-7-8-16-39-29(21)19-33(6)41(37,38)26-13-10-24(31)11-14-26/h10-15,17,21-23,29,35H,7-9,16,18-20H2,1-6H3/t21-,22-,23+,29+/m0/s1	MEJMTXOOFVGIJM-UJUOIFIWSA-N	593.293485048							117884
BRD-K29597572	LSM-29334		44502777	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m0/s1	IDICBOGPMQOFGC-GSDPCRBASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K29597572	BRD-K29597572-001-01-3	Broad Institute of MIT and Harvard	BRD-K29597572			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H44N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h5-7,11-18,20,24-26,32,40H,8-10,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26+,32-/m0/s1	IDICBOGPMQOFGC-GSDPCRBASA-N	616.326085168							117885
BRD-K20667558	LSM-29335		44502259	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24+,29+/m0/s1	PRCUBQSECBZBSK-CMSZEEODSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	BroadT	BRD-K20667558	BRD-K20667558-001-01-1	Broad Institute of MIT and Harvard	BRD-K20667558			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O	InChI=1S/C30H45N3O6S/c1-21-10-13-26(14-11-21)40(36,37)31-25-12-15-28-27(17-25)30(35)33(23(3)20-34)18-22(2)29(19-32(5)6)38-16-8-7-9-24(4)39-28/h10-15,17,22-24,29,31,34H,7-9,16,18-20H2,1-6H3/t22-,23+,24+,29+/m0/s1	PRCUBQSECBZBSK-CMSZEEODSA-N	575.30290688							117886
BRD-K37324401	LSM-29336		44619936	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25+,30+/m0/s1	ZGCRSIABJPRXFC-ZQIPMTRKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K37324401	BRD-K37324401-001-01-9	Broad Institute of MIT and Harvard	BRD-K37324401			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C32H47N3O5/c1-23-20-35(24(2)22-36)32(38)28-19-27(33(4)5)15-16-29(28)40-25(3)12-10-11-17-39-30(23)21-34(6)31(37)18-26-13-8-7-9-14-26/h7-9,13-16,19,23-25,30,36H,10-12,17-18,20-22H2,1-6H3/t23-,24-,25+,30+/m0/s1	ZGCRSIABJPRXFC-ZQIPMTRKSA-N	553.351571634							117887
BRD-K27620386	LSM-29337		54614775	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24-,25+,31+/m0/s1	HLAXWBUNQRUQJP-CNFUJFEGSA-N	COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C)cc1	BroadT	BRD-K27620386	BRD-K27620386-001-01-1	Broad Institute of MIT and Harvard	BRD-K27620386			COc1ccc(CN(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C)cc1	InChI=1S/C32H49N3O5/c1-23-19-35(24(2)22-36)32(37)29-18-27(33(4)5)13-16-30(29)40-25(3)10-8-9-17-39-31(23)21-34(6)20-26-11-14-28(38-7)15-12-26/h11-16,18,23-25,31,36H,8-10,17,19-22H2,1-7H3/t23-,24-,25+,31+/m0/s1	HLAXWBUNQRUQJP-CNFUJFEGSA-N	555.367221698							117888
BRD-K22694513	LSM-29338		44498641	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23-,24+,30+/m0/s1	OKIGVZMNGZVCJM-GBXOJDCZSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)N(C)C	BroadT	BRD-K22694513	BRD-K22694513-001-01-7	Broad Institute of MIT and Harvard	BRD-K22694513			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C	InChI=1S/C31H47N3O7S/c1-22-19-34(23(2)21-35)31(36)28-18-25(32(4)5)11-16-29(28)41-24(3)10-8-9-17-40-30(22)20-33(6)42(37,38)27-14-12-26(39-7)13-15-27/h11-16,18,22-24,30,35H,8-10,17,19-21H2,1-7H3/t22-,23-,24+,30+/m0/s1	OKIGVZMNGZVCJM-GBXOJDCZSA-N	605.313471564							117889
BRD-K32702774	LSM-29339		44487399	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23+,27-/m0/s1	LTGDTYHJVMKPBL-MTPWMDRRSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	BroadT	BRD-K32702774	BRD-K32702774-001-01-0	Broad Institute of MIT and Harvard	BRD-K32702774			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C29H50N4O5/c1-21-18-33(22(2)20-34)29(36)25-17-24(30-28(35)12-10-15-31(4)5)13-14-26(25)38-23(3)11-8-9-16-37-27(21)19-32(6)7/h13-14,17,21-23,27,34H,8-12,15-16,18-20H2,1-7H3,(H,30,35)/t21-,22+,23+,27-/m0/s1	LTGDTYHJVMKPBL-MTPWMDRRSA-N	534.37812074							117890
BRD-K28414977	LSM-29340		44494555	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32+/m1/s1	LKIIRWUIYHEPDR-IXTDCBFRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(NC(=O)c4ccncc4)cc3C1=O	BroadT	BRD-K28414977	BRD-K28414977-001-01-3	Broad Institute of MIT and Harvard	BRD-K28414977			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C35H50N4O6/c1-24-21-39(25(2)23-40)35(43)30-20-29(37-33(41)27-15-17-36-18-16-27)13-14-31(30)45-26(3)10-8-9-19-44-32(24)22-38(4)34(42)28-11-6-5-7-12-28/h13-18,20,24-26,28,32,40H,5-12,19,21-23H2,1-4H3,(H,37,41)/t24-,25+,26-,32+/m1/s1	LKIIRWUIYHEPDR-IXTDCBFRSA-N	622.37303536							117891
BRD-K29468949	LSM-29341		44490422	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24+,29+/m1/s1	QUSLWNNTNFDPAB-CHCBTGSZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K29468949	BRD-K29468949-001-01-3	Broad Institute of MIT and Harvard	BRD-K29468949			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23-,24+,29+/m1/s1	QUSLWNNTNFDPAB-CHCBTGSZSA-N	545.382871762							117892
MLS003128688	LSM-29342	BRD-K32373560, SID121282566	44494438	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23+,24+,28-/m0/s1	FCDOAUZTELHSSL-KVOKEACQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	BroadT	BRD-K32373560	BRD-K32373560-001-01-8	Broad Institute of MIT and Harvard	BRD-K32373560			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCCN(C)C)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C30H52N4O5/c1-22-19-34(23(2)21-35)30(37)26-18-25(32(6)7)14-15-27(26)39-24(3)12-9-10-17-38-28(22)20-33(8)29(36)13-11-16-31(4)5/h14-15,18,22-24,28,35H,9-13,16-17,19-21H2,1-8H3/t22-,23+,24+,28-/m0/s1	FCDOAUZTELHSSL-KVOKEACQSA-N	548.393770804							117893
BRD-K29138092	LSM-29343		44484598	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22-,27-/m0/s1	FBKKOHUHBUWDTB-RJESQKRESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	BroadT	BRD-K29138092	BRD-K29138092-001-01-7	Broad Institute of MIT and Harvard	BRD-K29138092			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NC(=O)c3ccncc3)cc2C1=O	InChI=1S/C29H42N4O5/c1-20-17-33(21(2)19-34)29(36)25-16-24(31-28(35)23-11-13-30-14-12-23)9-10-26(25)38-22(3)8-6-7-15-37-27(20)18-32(4)5/h9-14,16,20-22,27,34H,6-8,15,17-19H2,1-5H3,(H,31,35)/t20-,21+,22-,27-/m0/s1	FBKKOHUHBUWDTB-RJESQKRESA-N	526.315520484							117894
BRD-K28184331	LSM-29344		44618785	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22-,23-,28+/m0/s1	SKZBTEBCBLPBIZ-KKQCDPINSA-N	CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K28184331	BRD-K28184331-001-01-3	Broad Institute of MIT and Harvard	BRD-K28184331			CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H43N3O6S/c1-20-9-12-25(13-10-20)39(35,36)31-24-11-14-27-26(16-24)29(34)32(22(3)19-33)18-21(2)28(17-30-5)37-15-7-6-8-23(4)38-27/h9-14,16,21-23,28,30-31,33H,6-8,15,17-19H2,1-5H3/t21-,22-,23-,28+/m0/s1	SKZBTEBCBLPBIZ-KKQCDPINSA-N	561.287256816							117895
BRD-K39107553	LSM-29345		44620383	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26+,27+,32-/m0/s1	ZCLFEQBFHRMJFK-XDZDDBEASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc3ccc(NC(=O)CCCN(C)C)cc3C1=O	BroadT	BRD-K39107553	BRD-K39107553-001-01-2	Broad Institute of MIT and Harvard	BRD-K39107553			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O	InChI=1S/C34H53N5O5/c1-25-21-39(26(2)24-40)34(42)30-20-29(36-33(41)11-9-18-37(4)5)12-13-31(30)44-27(3)10-7-8-19-43-32(25)23-38(6)22-28-14-16-35-17-15-28/h12-17,20,25-27,32,40H,7-11,18-19,21-24H2,1-6H3,(H,36,41)/t25-,26+,27+,32-/m0/s1	ZCLFEQBFHRMJFK-XDZDDBEASA-N	611.404669846							117896
MLS003128697	LSM-10153	SID99358943, BRD-K28497936	44490230	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24+,29+/m0/s1	QUSLWNNTNFDPAB-CMSZEEODSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc3ccc(cc3C1=O)N(C)C	BroadT	BRD-K28497936	BRD-K28497936-001-01-8	Broad Institute of MIT and Harvard	BRD-K28497936			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCCCC2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C	InChI=1S/C31H51N3O5/c1-22-19-34(23(2)21-35)31(37)27-18-26(32(4)5)15-16-28(27)39-24(3)12-10-11-17-38-29(22)20-33(6)30(36)25-13-8-7-9-14-25/h15-16,18,22-25,29,35H,7-14,17,19-21H2,1-6H3/t22-,23+,24+,29+/m0/s1	QUSLWNNTNFDPAB-CMSZEEODSA-N	545.382871762							98774
ZINC04980953	LSM-4822	BRD-K03644760, SID99432293	2888950	InChI=1S/C15H8Cl2N2O4/c16-8-5-9(17)7-10(6-8)18-13-11-3-1-2-4-12(11)23-15(20)14(13)19(21)22/h1-7,18H	KMPUYUUZLQNNFX-UHFFFAOYSA-N	[O-][N+](=O)C1=C(Nc2cc(Cl)cc(Cl)c2)c3ccccc3OC1=O	BroadT	BRD-K03644760	BRD-K03644760-001-01-5	InterBioScreen Ltd.	STOCK3S-32439			[O-][N+](=O)c1c(Nc2cc(Cl)cc(Cl)c2)c2ccccc2oc1=O	InChI=1S/C15H8Cl2N2O4/c16-8-5-9(17)7-10(6-8)18-13-11-3-1-2-4-12(11)23-15(20)14(13)19(21)22/h1-7,18H	KMPUYUUZLQNNFX-UHFFFAOYSA-N	349.986112176							94202
AO-081/15245014	LSM-42836	BRD-A82913781, SID85248323	6000533	InChI=1S/C26H22Cl2N2O7S/c1-4-36-25(34)21-13(2)29-26-30(22(21)15-6-5-7-16(11-15)35-3)24(33)19(38-26)10-14-8-17(27)23(18(28)9-14)37-12-20(31)32/h5-11,22H,4,12H2,1-3H3,(H,31,32)/b19-10-	PRKYYRSNDWFECB-GRSHGNNSSA-N	CCOC(=O)C1=C(C)N=C2S\C(=C/c3cc(Cl)c(OCC(=O)O)c(Cl)c3)\C(=O)N2C1c4cccc(OC)c4	BroadT	BRD-A82913781	BRD-A82913781-001-01-5	Sanford-Burnham Medical Research Institute	MLS-0425590.0001			CCOC(=O)C1=C(C)N=c2s\c(=C/c3cc(Cl)c(OCC(O)=O)c(Cl)c3)c(=O)n2C1c1cccc(OC)c1	InChI=1S/C26H22Cl2N2O7S/c1-4-36-25(34)21-13(2)29-26-30(22(21)15-6-5-7-16(11-15)35-3)24(33)19(38-26)10-14-8-17(27)23(18(28)9-14)37-12-20(31)32/h5-11,22H,4,12H2,1-3H3,(H,31,32)/b19-10-	PRKYYRSNDWFECB-GRSHGNNSSA-N	576.052477174							
AC1M43RN	LSM-3363	BRD-K61237522, BRD-K91047982	2275371	InChI=1S/C17H19N3O3/c1-12-5-6-15(13(2)10-12)19-16(21)7-8-17(22)20-18-11-14-4-3-9-23-14/h3-6,9-11H,7-8H2,1-2H3,(H,19,21)(H,20,22)	CSEQFIHKUHSYPC-UHFFFAOYSA-N	Cc1ccc(NC(=O)CCC(=O)NN=Cc2occc2)c(C)c1	BroadT	BRD-K91047982	BRD-K91047982-001-01-6	ChemBridge Corporation	6302217			Cc1ccc(NC(=O)CCC(=O)N\N=C\c2ccco2)c(C)c1	InChI=1S/C17H19N3O3/c1-12-5-6-15(13(2)10-12)19-16(21)7-8-17(22)20-18-11-14-4-3-9-23-14/h3-6,9-11H,7-8H2,1-2H3,(H,19,21)(H,20,22)/b18-11+	CSEQFIHKUHSYPC-WOJGMQOQSA-N	313.142641498							93072
CHEMBL1865584	LSM-4791	SID99432287, BRD-K18025010	46926574	InChI=1S/C16H11NO4S/c1-10-6-8-11(9-7-10)22-15-12-4-2-3-5-13(12)21-16(18)14(15)17(19)20/h2-9H,1H3	AYTFWRLTLWWBCW-UHFFFAOYSA-N	Cc1ccc(SC2=C(C(=O)Oc3ccccc23)[N+](=O)[O-])cc1	BroadT	BRD-K18025010	BRD-K18025010-001-01-8	Broad Institute of MIT and Harvard	mw-A1-18			Cc1ccc(Sc2c([N+]([O-])=O)c(=O)oc3ccccc23)cc1	InChI=1S/C16H11NO4S/c1-10-6-8-11(9-7-10)22-15-12-4-2-3-5-13(12)21-16(18)14(15)17(19)20/h2-9H,1H3	AYTFWRLTLWWBCW-UHFFFAOYSA-N	313.040878532							94171
STK222600	LSM-3535	STK-222600, SID99245569, SID99376529, SID99430908, BRD-K68535470	870371	InChI=1S/C16H16ClN3O/c17-14-6-4-13(5-7-14)16(21)20-11-9-19(10-12-20)15-3-1-2-8-18-15/h1-8H,9-12H2	HJVFVAZFMFYABI-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)N2CCN(CC2)c3ccccn3	BroadT	BRD-K68535470	BRD-K68535470-001-01-8	Vitas-M Laboratory Ltd.	STK222600			Clc1ccc(cc1)C(=O)N1CCN(CC1)c1ccccn1	InChI=1S/C16H16ClN3O/c17-14-6-4-13(5-7-14)16(21)20-11-9-19(10-12-20)15-3-1-2-8-18-15/h1-8H,9-12H2	HJVFVAZFMFYABI-UHFFFAOYSA-N	301.098189872							93205
AC1MG5Y0	LSM-4794	BRD-A16581344, SID87556794	2930928	InChI=1S/C22H25F3N2O/c1-26(14-17-8-3-2-4-9-17)21(28)19-11-7-13-27(16-19)15-18-10-5-6-12-20(18)22(23,24)25/h2-6,8-10,12,19H,7,11,13-16H2,1H3	NXOPRQUIKXFMJJ-UHFFFAOYSA-N	CN(Cc1ccccc1)C(=O)C2CCCN(Cc3ccccc3C(F)(F)F)C2	BroadT	BRD-A16581344	BRD-A16581344-001-01-1	ChemBridge Corporation	7226698			CN(Cc1ccccc1)C(=O)C1CCCN(Cc2ccccc2C(F)(F)F)C1	InChI=1S/C22H25F3N2O/c1-26(14-17-8-3-2-4-9-17)21(28)19-11-7-13-27(16-19)15-18-10-5-6-12-20(18)22(23,24)25/h2-6,8-10,12,19H,7,11,13-16H2,1H3	NXOPRQUIKXFMJJ-UHFFFAOYSA-N	390.19189804							94174
MLS-0435438.0001	LSM-43016	BRD-K87432599, SID87544535	6203183	InChI=1S/C22H18N2O7S2/c25-15-10-13(4-5-14(15)21(28)29)23-19(26)2-1-7-24-20(27)18(33-22(24)32)9-12-3-6-16-17(8-12)31-11-30-16/h3-6,8-10,25H,1-2,7,11H2,(H,23,26)(H,28,29)/b18-9-	GGMMNBODULCFQO-NVMNQCDNSA-N	OC(=O)c1ccc(NC(=O)CCCN2C(=S)S\C(=C/c3ccc4OCOc4c3)\C2=O)cc1O	BroadT	BRD-K87432599	BRD-K87432599-001-01-1	Sanford-Burnham Medical Research Institute	MLS-0435438.0002			OC(=O)c1ccc(NC(=O)CCCN2C(=S)S\C(=C/c3ccc4OCOc4c3)C2=O)cc1O	InChI=1S/C22H18N2O7S2/c25-15-10-13(4-5-14(15)21(28)29)23-19(26)2-1-7-24-20(27)18(33-22(24)32)9-12-3-6-16-17(8-12)31-11-30-16/h3-6,8-10,25H,1-2,7,11H2,(H,23,26)(H,28,29)/b18-9-	GGMMNBODULCFQO-NVMNQCDNSA-N	486.055542316							
Latrunculin B	LSM-43068	BRD-A19248578, SID26756845, SID26756846, SID99222862, Latrunculin-B	6436219	InChI=1S/C20H29NO5S/c1-13-5-3-4-6-14(2)9-18(22)25-16-10-15(8-7-13)26-20(24,11-16)17-12-27-19(23)21-17/h3,5,9,13,15-17,24H,4,6-8,10-12H2,1-2H3,(H,21,23)/b5-3-,14-9-/t13-,15-,16-,17?,20-/m1/s1	NSHPHXHGRHSMIK-IWZLBRJHSA-N	C[C@H]1CC[C@@H]2C[C@H](C[C@@](O)(O2)C3CSC(=O)N3)OC(=O)\C=C(\C)/CC\C=C/1	BroadT	BRD-A19248578	BRD-A19248578-001-03-7	Sigma-Aldrich	L5288-1MG	cjd-a2-10		C[C@H]1CC[C@@H]2C[C@H](C[C@@](O)(O2)C2CSC(=O)N2)OC(=O)\C=C(C)/CC\C=C/1	InChI=1S/C20H29NO5S/c1-13-5-3-4-6-14(2)9-18(22)25-16-10-15(8-7-13)26-20(24,11-16)17-12-27-19(23)21-17/h3,5,9,13,15-17,24H,4,6-8,10-12H2,1-2H3,(H,21,23)/b5-3-,14-9-/t13-,15-,16-,17?,20-/m1/s1	NSHPHXHGRHSMIK-IWZLBRJHSA-N	395.176643728							
CHEMBL565584	LSM-43004	BRD-K33586157, SID85256228	6001181	InChI=1S/C22H19N3O4S3/c1-15-7-9-16(10-8-15)20-17(14-25(23-20)18-5-3-2-4-6-18)13-19-21(26)24(22(30)31-19)11-12-32(27,28)29/h2-10,13-14H,11-12H2,1H3,(H,27,28,29)/b19-13-	XEFPJRJQIDICJP-UYRXBGFRSA-N	Cc1ccc(cc1)c2nn(cc2\C=C\3/SC(=S)N(CCS(=O)(=O)O)C3=O)c4ccccc4	BroadT	BRD-K33586157	BRD-K33586157-001-01-3	Sanford-Burnham Medical Research Institute	MLS-0425637.0001			Cc1ccc(cc1)-c1nn(cc1\C=C1/SC(=S)N(CCS(O)(=O)=O)C1=O)-c1ccccc1	InChI=1S/C22H19N3O4S3/c1-15-7-9-16(10-8-15)20-17(14-25(23-20)18-5-3-2-4-6-18)13-19-21(26)24(22(30)31-19)11-12-32(27,28)29/h2-10,13-14H,11-12H2,1H3,(H,27,28,29)/b19-13-	XEFPJRJQIDICJP-UYRXBGFRSA-N	485.053768188							
CHEMBL461194	LSM-4879	BRD1210, SID48410135	24178170	InChI=1S/C12H10Cl3N3O2/c13-7-2-1-6(10(14)11(7)15)8-5-9(18-17-8)12(20)16-3-4-19/h1-2,5,19H,3-4H2,(H,16,20)(H,17,18)	NQORNRXANZIMLI-UHFFFAOYSA-N	OCCNC(=O)c1cc(n[nH]1)c2ccc(Cl)c(Cl)c2Cl	BroadT	BRD-K54331210	BRD-K54331210-001-02-1	Sanford-Burnham Medical Research Institute	MLS-0146291.0001			OCCNC(=O)c1cc(n[nH]1)-c1ccc(Cl)c(Cl)c1Cl	InChI=1S/C12H10Cl3N3O2/c13-7-2-1-6(10(14)11(7)15)8-5-9(18-17-8)12(20)16-3-4-19/h1-2,5,19H,3-4H2,(H,16,20)(H,17,18)	NQORNRXANZIMLI-UHFFFAOYSA-N	332.98385972							94256
KUC106502N	LSM-4878	BRD-K48716658, SID26671376	3392161	InChI=1S/C11H11ClN6O2/c1-14-11-16-9(13)8(18(19)20)10(17-11)15-7-4-2-3-6(12)5-7/h2-5H,1H3,(H4,13,14,15,16,17)	NOGLUAGKODIFPO-UHFFFAOYSA-N	CNc1nc(N)c(c(Nc2cccc(Cl)c2)n1)[N+](=O)[O-]	BroadT	BRD-K48716658	BRD-K48716658-001-05-4	University of New Mexico MLSC	3392161			CNc1nc(N)c(c(Nc2cccc(Cl)c2)n1)[N+]([O-])=O	InChI=1S/C11H11ClN6O2/c1-14-11-16-9(13)8(18(19)20)10(17-11)15-7-4-2-3-6(12)5-7/h2-5H,1H3,(H4,13,14,15,16,17)	NOGLUAGKODIFPO-UHFFFAOYSA-N	294.063201362							94255
BRD-K96640811	LSM-29346		73707370	InChI=1S/C15H17N3O/c19-15(18-9-2-6-16-8-10-18)14-4-1-3-12-11-17-7-5-13(12)14/h1,3-5,7,11,16H,2,6,8-10H2	UBZQRRLIMHAJAE-UHFFFAOYSA-N	O=C(N1CCCNCC1)c2cccc3cnccc23	BroadT	BRD-K96640811	BRD-K96640811-001-01-0	Broad Institute of MIT and Harvard	TUL_XVIII076	XVIII076		O=C(N1CCCNCC1)c1cccc2cnccc12	InChI=1S/C15H17N3O/c19-15(18-9-2-6-16-8-10-18)14-4-1-3-12-11-17-7-5-13(12)14/h1,3-5,7,11,16H,2,6,8-10H2	UBZQRRLIMHAJAE-UHFFFAOYSA-N	255.137162194							117897
MLS-0315872.0001	LSM-4863	BRD-A60386802, SID56373840	4879425	InChI=1S/C16H15N3O2/c1-2-19-13-9-5-3-7-11(13)16(15(19)20)18-17-12-8-4-6-10-14(12)21-16/h3-10,17-18H,2H2,1H3	LTQXESHHKQUOEG-UHFFFAOYSA-N	CCN1C(=O)C2(NNc3ccccc3O2)c4ccccc14	BroadT	BRD-A60386802	BRD-A60386802-001-01-5	Sanford-Burnham Medical Research Institute	MLS-0315872.0001			CCN1C(=O)C2(NNc3ccccc3O2)c2ccccc12	InChI=1S/C16H15N3O2/c1-2-19-13-9-5-3-7-11(13)16(15(19)20)18-17-12-8-4-6-10-14(12)21-16/h3-10,17-18H,2H2,1H3	LTQXESHHKQUOEG-UHFFFAOYSA-N	281.11642675							94240
ML228	LSM-2978	BRD-K44432556, SID98626463, VU-0418946-1	46742353	InChI=1S/C27H21N5/c1-3-9-21(10-4-1)22-16-14-20(15-17-22)19-29-27-25(23-11-5-2-6-12-23)31-32-26(30-27)24-13-7-8-18-28-24/h1-18H,19H2,(H,29,30,32)	QNRODODTMXCRKU-UHFFFAOYSA-N	C(Nc1nc(nnc1c2ccccc2)c3ccccn3)c4ccc(cc4)c5ccccc5	BroadT	BRD-K44432556	BRD-K44432556-001-01-4	Vanderbilt Screening Center for GPCRs, Ion Channels, and Transporters	VU0418946-1	VU0418946-1		C(Nc1nc(nnc1-c1ccccc1)-c1ccccn1)c1ccc(cc1)-c1ccccc1	InChI=1S/C27H21N5/c1-3-9-21(10-4-1)22-16-14-20(15-17-22)19-29-27-25(23-11-5-2-6-12-23)31-32-26(30-27)24-13-7-8-18-28-24/h1-18H,19H2,(H,29,30,32)	QNRODODTMXCRKU-UHFFFAOYSA-N	415.179695722							92777
STK661558	LSM-2431	BRD-K19146323, SID99245567, STK-661558	1505783	InChI=1S/C20H16Cl3N3O/c21-14-2-3-15-18(12-14)24-6-5-19(15)25-7-9-26(10-8-25)20(27)13-1-4-16(22)17(23)11-13/h1-6,11-12H,7-10H2	AOIWSYFLKMQHLZ-UHFFFAOYSA-N	Clc1ccc2c(ccnc2c1)N3CCN(CC3)C(=O)c4ccc(Cl)c(Cl)c4	BroadT	BRD-K19146323	BRD-K19146323-001-01-3	Vitas-M Laboratory Ltd.	STK661558			Clc1ccc2c(ccnc2c1)N1CCN(CC1)C(=O)c1ccc(Cl)c(Cl)c1	InChI=1S/C20H16Cl3N3O/c21-14-2-3-15-18(12-14)24-6-5-19(15)25-7-9-26(10-8-25)20(27)13-1-4-16(22)17(23)11-13/h1-6,11-12H,7-10H2	AOIWSYFLKMQHLZ-UHFFFAOYSA-N	419.035895292							92353
MLS003179193	LSM-2234	BRD0476, SID99368322, SID99376568, EMF-BCA1-64	46907798	InChI=1S/C35H38N4O8S/c1-22-19-39(23(2)21-40)34(41)27-11-7-13-29(37-35(42)36-28-12-6-9-24-8-4-5-10-26(24)28)33(27)47-32(22)20-38(3)48(43,44)25-14-15-30-31(18-25)46-17-16-45-30/h4-15,18,22-23,32,40H,16-17,19-21H2,1-3H3,(H2,36,37,42)/t22-,23+,32+/m1/s1	YDFFDCBBGWXONN-MODXFSQWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3OCCOc3c2)Oc4c(NC(=O)Nc5cccc6ccccc56)cccc4C1=O	BroadT	BRD-K11540476	BRD-K11540476-001-04-4	Broad Institute of MIT and Harvard	EMF-bca1-64			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3OCCOc3c2)Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C1=O	InChI=1S/C35H38N4O8S/c1-22-19-39(23(2)21-40)34(41)27-11-7-13-29(37-35(42)36-28-12-6-9-24-8-4-5-10-26(24)28)33(27)47-32(22)20-38(3)48(43,44)25-14-15-30-31(18-25)46-17-16-45-30/h4-15,18,22-23,32,40H,16-17,19-21H2,1-3H3,(H2,36,37,42)/t22-,23+,32+/m1/s1	YDFFDCBBGWXONN-MODXFSQWSA-N	674.241034906							92195
MLS-0435528.0001	LSM-4872	SID87544624, BRD-K26367064	2466259	InChI=1S/C23H30N4O3S/c1-24(2)31(29,30)20-10-11-22(26-12-6-7-13-26)21(18-20)23(28)27-16-14-25(15-17-27)19-8-4-3-5-9-19/h3-5,8-11,18H,6-7,12-17H2,1-2H3	HEKAKRIKHWYOMJ-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(c1)C(=O)N3CCN(CC3)c4ccccc4	BroadT	BRD-K26367064	BRD-K26367064-001-01-9	Sanford-Burnham Medical Research Institute	MLS-0435528.0001			CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(c1)C(=O)N1CCN(CC1)c1ccccc1	InChI=1S/C23H30N4O3S/c1-24(2)31(29,30)20-10-11-22(26-12-6-7-13-26)21(18-20)23(28)27-16-14-25(15-17-27)19-8-4-3-5-9-19/h3-5,8-11,18H,6-7,12-17H2,1-2H3	HEKAKRIKHWYOMJ-UHFFFAOYSA-N	442.20386155							94249
STK206352	LSM-6661	BRD-K76565902, SID99245543	2809486	InChI=1S/C18H16ClN3OS/c19-13-3-4-14-15(12-13)20-6-5-16(14)21-7-9-22(10-8-21)18(23)17-2-1-11-24-17/h1-6,11-12H,7-10H2	VDOKGDMLRMELRV-UHFFFAOYSA-N	Clc1ccc2c(ccnc2c1)N3CCN(CC3)C(=O)c4cccs4	BroadT	BRD-K76565902	BRD-K76565902-001-01-3	Vitas-M Laboratory Ltd.	STK206352			Clc1ccc2c(ccnc2c1)N1CCN(CC1)C(=O)c1cccs1	InChI=1S/C18H16ClN3OS/c19-13-3-4-14-15(12-13)20-6-5-16(14)21-7-9-22(10-8-21)18(23)17-2-1-11-24-17/h1-6,11-12H,7-10H2	VDOKGDMLRMELRV-UHFFFAOYSA-N	357.070260562							95309
CHEMBL2139663	LSM-29347	BRD-K61717269, SID87349852	44602352	InChI=1S/C22H19N5/c1-16-10-12-17(13-11-16)15-24-22-20(18-7-3-2-4-8-18)26-27-21(25-22)19-9-5-6-14-23-19/h2-14H,15H2,1H3,(H,24,25,27)	XXSFXQLMBCXBAH-UHFFFAOYSA-N	Cc1ccc(CNc2nc(nnc2c3ccccc3)c4ccccn4)cc1	BroadT	BRD-K61717269	BRD-K61717269-001-01-4	Vanderbilt Screening Center for GPCRs, Ion Channels, and Transporters	BRD-K61717269	VU0409710-1		Cc1ccc(CNc2nc(nnc2-c2ccccc2)-c2ccccn2)cc1	InChI=1S/C22H19N5/c1-16-10-12-17(13-11-16)15-24-22-20(18-7-3-2-4-8-18)26-27-21(25-22)19-9-5-6-14-23-19/h2-14H,15H2,1H3,(H,24,25,27)	XXSFXQLMBCXBAH-UHFFFAOYSA-N	353.164045658							117898
AC1N0AAO	LSM-3682	BRD-K75302809, SID99495770, BRD-K17628612	3913840	InChI=1S/C18H21N3O3/c1-12-4-7-16(13(2)10-12)20-17(22)8-9-18(23)21-19-11-15-6-5-14(3)24-15/h4-7,10-11H,8-9H2,1-3H3,(H,20,22)(H,21,23)	UKDYWCMFIIYJNB-UHFFFAOYSA-N	Cc1oc(C=NNC(=O)CCC(=O)Nc2ccc(C)cc2C)cc1	BroadT	BRD-K17628612	BRD-K17628612-001-01-2	Sigma-Aldrich	R925233			Cc1ccc(\C=N\NC(=O)CCC(=O)Nc2ccc(C)cc2C)o1	InChI=1S/C18H21N3O3/c1-12-4-7-16(13(2)10-12)20-17(22)8-9-18(23)21-19-11-15-6-5-14(3)24-15/h4-7,10-11H,8-9H2,1-3H3,(H,20,22)(H,21,23)/b19-11+	UKDYWCMFIIYJNB-YBFXNURJSA-N	327.158291562							93322
ST50998710	LSM-43133	BRD-K73238422, SID26513898	2258411	InChI=1S/C15H7BrClN3OS/c16-9-6-11-13(18-7-9)20-14(21)12(22-15(20)19-11)5-8-3-1-2-4-10(8)17/h1-7H/b12-5-	VCMZPVCCQDEZRB-XGICHPGQSA-N	Clc1ccccc1\C=C\2/Sc3nc4cc(Br)cnc4n3C2=O	BroadT	BRD-K73238422	BRD-K73238422-001-01-1	Sanford-Burnham Medical Research Institute	MLS-0091944.0001			Clc1ccccc1\C=c1/sc2nc3cc(Br)cnc3n2c1=O	InChI=1S/C15H7BrClN3OS/c16-9-6-11-13(18-7-9)20-14(21)12(22-15(20)19-11)5-8-3-1-2-4-10(8)17/h1-7H/b12-5-	VCMZPVCCQDEZRB-XGICHPGQSA-N	390.918172874							
BRD-K35669573	LSM-29348	TUL_XX023	54596143	InChI=1S/C14H17N3O2S/c1-10-7-16-8-11-3-2-4-13(14(10)11)20(18,19)17-12-5-6-15-9-12/h2-4,7-8,12,15,17H,5-6,9H2,1H3/t12-/m0/s1	ILEDKNBEZITSIP-LBPRGKRZSA-N	Cc1cncc2cccc(c12)S(=O)(=O)N[C@H]3CCNC3	BroadT	BRD-K35669573	BRD-K35669573-001-02-9	Broad Institute of MIT and Harvard	TUL_XX023	XX023		Cc1cncc2cccc(c12)S(=O)(=O)N[C@H]1CCNC1	InChI=1S/C14H17N3O2S/c1-10-7-16-8-11-3-2-4-13(14(10)11)20(18,19)17-12-5-6-15-9-12/h2-4,7-8,12,15,17H,5-6,9H2,1H3/t12-/m0/s1	ILEDKNBEZITSIP-LBPRGKRZSA-N	291.104147504							117899
AC1MVW5E	LSM-4870	BRD-K24346336	3739601	InChI=1S/C11H11FN6O2/c1-14-11-16-9(13)8(18(19)20)10(17-11)15-7-4-2-6(12)3-5-7/h2-5H,1H3,(H4,13,14,15,16,17)	BICVTMNTHCLMTK-UHFFFAOYSA-N	CNc1nc(N)c(c(Nc2ccc(F)cc2)n1)[N+](=O)[O-]	BroadT	BRD-K24346336	BRD-K24346336-001-01-7	University of New Mexico MLSC	3739601			CNc1nc(N)c(c(Nc2ccc(F)cc2)n1)[N+]([O-])=O	InChI=1S/C11H11FN6O2/c1-14-11-16-9(13)8(18(19)20)10(17-11)15-7-4-2-6(12)3-5-7/h2-5H,1H3,(H4,13,14,15,16,17)	BICVTMNTHCLMTK-UHFFFAOYSA-N	278.092751852							94247
CHEMBL349641	LSM-2070	BRD-K04188046, SID56405530, SID85147371	52780	InChI=1S/C11H10N2O3/c14-9-2-1-8(5-10(9)15)11(16)6-13-4-3-12-7-13/h1-5,7,14-15H,6H2	JHQYDDFNYJJOIA-UHFFFAOYSA-N	Oc1ccc(cc1O)C(=O)Cn2ccnc2	BroadT	BRD-K04188046	BRD-K04188046-003-01-4	Sanford-Burnham Medical Research Institute	MLS-0315813.0002		Cl	Oc1ccc(cc1O)C(=O)Cn1ccnc1.Cl	InChI=1S/C11H10N2O3.ClH/c14-9-2-1-8(5-10(9)15)11(16)6-13-4-3-12-7-13;/h1-5,7,14-15H,6H2;1H	YWTRHFTWSLBXIX-UHFFFAOYSA-N	218.0691422							92075, 92075
ZINC11756868	LSM-4650	BRD-K50493736	22693263	InChI=1S/C14H18ClN3/c1-3-9-18(10-4-2)13-11-7-5-6-8-12(11)16-14(15)17-13/h5-8H,3-4,9-10H2,1-2H3	OOAMKODPDGBQOY-UHFFFAOYSA-N	CCCN(CCC)c1nc(Cl)nc2ccccc12	BroadT	BRD-K50493736	BRD-K50493736-001-01-0	Broad Institute of MIT and Harvard	Ran 02	TL-Ran-02		CCCN(CCC)c1nc(Cl)nc2ccccc12	InChI=1S/C14H18ClN3/c1-3-9-18(10-4-2)13-11-7-5-6-8-12(11)16-14(15)17-13/h5-8H,3-4,9-10H2,1-2H3	OOAMKODPDGBQOY-UHFFFAOYSA-N	263.118925316							94050
CHEMBL1728581	LSM-6598	BRD-K44893543, SID89856174	44826047	InChI=1S/C16H13BrN2S/c1-11-2-3-14(13(17)10-11)19-16-5-4-15(20-16)12-6-8-18-9-7-12/h2-10,19H,1H3	ZKFQAAFZJRVIBR-UHFFFAOYSA-N	Cc1ccc(Nc2ccc(s2)c3ccncc3)c(Br)c1	BroadT	BRD-K44893543	BRD-K44893543-001-01-3	ChemDiv Inc.	8015-6589			Cc1ccc(Nc2ccc(s2)-c2ccncc2)c(Br)c1	InChI=1S/C16H13BrN2S/c1-11-2-3-14(13(17)10-11)19-16-5-4-15(20-16)12-6-8-18-9-7-12/h2-10,19H,1H3	ZKFQAAFZJRVIBR-UHFFFAOYSA-N	343.998281726							95267
BRD-K28610502-001-01-0	LSM-29349	BRD-K28610502	44229302	InChI=1S/C18H26N4/c1-3-11-21(12-4-2)17-15-9-5-6-10-16(15)19-18(20-17)22-13-7-8-14-22/h5-6,9-10H,3-4,7-8,11-14H2,1-2H3	OGHCQVZDGSDMAO-UHFFFAOYSA-N	CCCN(CCC)c1nc(nc2ccccc12)N3CCCC3	BroadT	BRD-K28610502	BRD-K28610502-001-01-0	Broad Institute of MIT and Harvard	Ran 05	TL-Ran-06		CCCN(CCC)c1nc(nc2ccccc12)N1CCCC1	InChI=1S/C18H26N4/c1-3-11-21(12-4-2)17-15-9-5-6-10-16(15)19-18(20-17)22-13-7-8-14-22/h5-6,9-10H,3-4,7-8,11-14H2,1-2H3	OGHCQVZDGSDMAO-UHFFFAOYSA-N	298.215746872							117900
MLS-0315868.0001	LSM-4861	BRD-A03946276, SID56373804	3921071	InChI=1S/C14H10N4O4/c19-13-14(17-16-11-3-1-2-4-12(11)22-14)9-7-8(18(20)21)5-6-10(9)15-13/h1-7,16-17H,(H,15,19)	VNYMEPQAFKNDRQ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2NC(=O)C3(NNc4ccccc4O3)c2c1	BroadT	BRD-A03946276	BRD-A03946276-001-01-3	Sanford-Burnham Medical Research Institute	MLS-0315868.0001			[O-][N+](=O)c1ccc2NC(=O)C3(NNc4ccccc4O3)c2c1	InChI=1S/C14H10N4O4/c19-13-14(17-16-11-3-1-2-4-12(11)22-14)9-7-8(18(20)21)5-6-10(9)15-13/h1-7,16-17H,(H,15,19)	VNYMEPQAFKNDRQ-UHFFFAOYSA-N	298.07020484							94238
2-(1-Pyrrolidinyl)-4(3H)-quinazolinone	LSM-4815	BRD-K36977165	821257	InChI=1S/C12H13N3O/c16-11-9-5-1-2-6-10(9)13-12(14-11)15-7-3-4-8-15/h1-2,5-6H,3-4,7-8H2,(H,13,14,16)	KSDABWGBZQUTRR-UHFFFAOYSA-N	O=C1NC(=Nc2ccccc12)N3CCCC3	BroadT	BRD-K36977165	BRD-K36977165-001-01-1	Broad Institute of MIT and Harvard	Ran 14A	TL-Ran-14A		O=c1[nH]c(nc2ccccc12)N1CCCC1	InChI=1S/C12H13N3O/c16-11-9-5-1-2-6-10(9)13-12(14-11)15-7-3-4-8-15/h1-2,5-6H,3-4,7-8H2,(H,13,14,16)	KSDABWGBZQUTRR-UHFFFAOYSA-N	215.105862066							94195
MLS-0435531.0001	LSM-4869	BRD-K16051505, SID87544630	16253428	InChI=1S/C23H19N5OS2/c1-14-7-9-16(10-8-14)18-12-30-22(24-18)25-21(29)13-31-23-27-26-20-11-15(2)17-5-3-4-6-19(17)28(20)23/h3-12H,13H2,1-2H3,(H,24,25,29)	KSBLOCODMPFZJK-UHFFFAOYSA-N	Cc1ccc(cc1)c2csc(NC(=O)CSc3nnc4cc(C)c5ccccc5n34)n2	BroadT	BRD-K16051505	BRD-K16051505-001-01-8	Sanford-Burnham Medical Research Institute	MLS-0435531.0001			Cc1ccc(cc1)-c1csc(NC(=O)CSc2nnc3cc(C)c4ccccc4n23)n1	InChI=1S/C23H19N5OS2/c1-14-7-9-16(10-8-14)18-12-30-22(24-18)25-21(29)13-31-23-27-26-20-11-15(2)17-5-3-4-6-19(17)28(20)23/h3-12H,13H2,1-2H3,(H,24,25,29)	KSBLOCODMPFZJK-UHFFFAOYSA-N	445.103101658							94246
MLS003179190	LSM-3441	EMF-BCA1-57, SID85796266	44489675	InChI=1S/C34H38N4O7S/c1-22-19-38(23(2)21-39)33(40)28-12-8-14-30(36-34(41)35-29-13-7-10-24-9-5-6-11-27(24)29)32(28)45-31(22)20-37(3)46(42,43)26-17-15-25(44-4)16-18-26/h5-18,22-23,31,39H,19-21H2,1-4H3,(H2,35,36,41)/t22-,23+,31+/m1/s1	FXIXTIXYCSOXIT-UDKTZTBJSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3c(NC(=O)Nc4cccc5ccccc45)cccc3C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K64610608	BRD-K64610608-001-02-6	Broad Institute of MIT and Harvard	EMF-bca1-57			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C34H38N4O7S/c1-22-19-38(23(2)21-39)33(40)28-12-8-14-30(36-34(41)35-29-13-7-10-24-9-5-6-11-27(24)29)32(28)45-31(22)20-37(3)46(42,43)26-17-15-25(44-4)16-18-26/h5-18,22-23,31,39H,19-21H2,1-4H3,(H2,35,36,41)/t22-,23+,31+/m1/s1	FXIXTIXYCSOXIT-UDKTZTBJSA-N	646.246120286001							93131
MLS000332706	LSM-4865	BRD-K07161233, SID26664184	3528206	InChI=1S/C11H11FN6O2/c1-14-11-16-9(13)8(18(19)20)10(17-11)15-7-4-2-3-6(12)5-7/h2-5H,1H3,(H4,13,14,15,16,17)	VVVWGFVAXRWEMB-UHFFFAOYSA-N	CNc1nc(N)c(c(Nc2cccc(F)c2)n1)[N+](=O)[O-]	BroadT	BRD-K07161233	BRD-K07161233-001-07-2	University of New Mexico MLSC	3528206			CNc1nc(N)c(c(Nc2cccc(F)c2)n1)[N+]([O-])=O	InChI=1S/C11H11FN6O2/c1-14-11-16-9(13)8(18(19)20)10(17-11)15-7-4-2-3-6(12)5-7/h2-5H,1H3,(H4,13,14,15,16,17)	VVVWGFVAXRWEMB-UHFFFAOYSA-N	278.092751852							94242
MLS-0435437.0001	LSM-42956	BRD-K25375605, SID87544534	6202912	InChI=1S/C23H22N2O7S2/c1-31-17-8-5-13(10-18(17)32-2)11-19-21(28)25(23(33)34-19)9-3-4-20(27)24-14-6-7-15(22(29)30)16(26)12-14/h5-8,10-12,26H,3-4,9H2,1-2H3,(H,24,27)(H,29,30)/b19-11-	PRAFTWYPDIRGEQ-ODLFYWEKSA-N	COc1ccc(\C=C\2/SC(=S)N(CCCC(=O)Nc3ccc(C(=O)O)c(O)c3)C2=O)cc1OC	BroadT	BRD-K25375605	BRD-K25375605-001-01-9	Sanford-Burnham Medical Research Institute	MLS-0435437.0002			COc1ccc(\C=C2/SC(=S)N(CCCC(=O)Nc3ccc(C(O)=O)c(O)c3)C2=O)cc1OC	InChI=1S/C23H22N2O7S2/c1-31-17-8-5-13(10-18(17)32-2)11-19-21(28)25(23(33)34-19)9-3-4-20(27)24-14-6-7-15(22(29)30)16(26)12-14/h5-8,10-12,26H,3-4,9H2,1-2H3,(H,24,27)(H,29,30)/b19-11-	PRAFTWYPDIRGEQ-ODLFYWEKSA-N	502.086842444							
AC1MEVG9	LSM-3935	BRD-K86682249, SID99495583	2861757	InChI=1S/C20H10BrN3O4S/c21-10-7-14-17(22-9-10)24-18(25)16(29-20(24)23-14)8-11-5-6-15(28-11)12-3-1-2-4-13(12)19(26)27/h1-9H,(H,26,27)	NMLOLMOZTQCQJF-UHFFFAOYSA-N	OC(=O)c1ccccc1c2oc(C=C3Sc4nc5cc(Br)cnc5n4C3=O)cc2	BroadT	BRD-K86682249	BRD-K86682249-001-05-7	Sanford-Burnham Medical Research Institute	MLS-0090801.0001			OC(=O)c1ccccc1-c1ccc(C=c2sc3nc4cc(Br)cnc4n3c2=O)o1	InChI=1S/C20H10BrN3O4S/c21-10-7-14-17(22-9-10)24-18(25)16(29-20(24)23-14)8-11-5-6-15(28-11)12-3-1-2-4-13(12)19(26)27/h1-9H,(H,26,27)	NMLOLMOZTQCQJF-UHFFFAOYSA-N	466.95753912							93512
AC1M08Y6	LSM-4783	BRD-K98381590	1993104	InChI=1S/C16H14ClN3/c1-11(12-7-3-2-4-8-12)18-15-13-9-5-6-10-14(13)19-16(17)20-15/h2-11H,1H3,(H,18,19,20)/t11-/m1/s1	RPGHTMMYAWEOGC-LLVKDONJSA-N	C[C@@H](Nc1nc(Cl)nc2ccccc12)c3ccccc3	BroadT	BRD-K98381590	BRD-K98381590-001-01-6	Broad Institute of MIT and Harvard	Ran 07	TL-Ran-07		C[C@@H](Nc1nc(Cl)nc2ccccc12)c1ccccc1	InChI=1S/C16H14ClN3/c1-11(12-7-3-2-4-8-12)18-15-13-9-5-6-10-14(13)19-16(17)20-15/h2-11H,1H3,(H,18,19,20)/t11-/m1/s1	RPGHTMMYAWEOGC-LLVKDONJSA-N	283.087625188							94165
ST50998727	LSM-43130	BRD-K33392208, SID26513896	5341934	InChI=1S/C19H9BrN4O4S/c20-10-7-13-17(21-9-10)23-18(25)16(29-19(23)22-13)8-11-5-6-15(28-11)12-3-1-2-4-14(12)24(26)27/h1-9H/b16-8-	DQOOAEOXHMQCIQ-PXNMLYILSA-N	[O-][N+](=O)c1ccccc1c2oc(\C=C\3/Sc4nc5cc(Br)cnc5n4C3=O)cc2	BroadT	BRD-K33392208	BRD-K33392208-001-01-5	Sanford-Burnham Medical Research Institute	MLS-0091942.0001			[O-][N+](=O)c1ccccc1-c1ccc(\C=c2/sc3nc4cc(Br)cnc4n3c2=O)o1	InChI=1S/C19H9BrN4O4S/c20-10-7-13-17(21-9-10)23-18(25)16(29-19(23)22-13)8-11-5-6-15(28-11)12-3-1-2-4-14(12)24(26)27/h1-9H/b16-8-	DQOOAEOXHMQCIQ-PXNMLYILSA-N	467.952788098							
4-((4-Chlorophenyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one	LSM-4792	BRD-K99705204, SID99432290	3125011	InChI=1S/C16H12ClN3O3/c1-19-13-5-3-2-4-12(13)14(15(16(19)21)20(22)23)18-11-8-6-10(17)7-9-11/h2-9,18H,1H3	UOTFDQYQLUZBMD-UHFFFAOYSA-N	CN1C(=O)C(=C(Nc2ccc(Cl)cc2)c3ccccc13)[N+](=O)[O-]	BroadT	BRD-K99705204	BRD-K99705204-001-01-3	InterBioScreen Ltd.	STOCK5S-10344			Cn1c2ccccc2c(Nc2ccc(Cl)cc2)c([N+]([O-])=O)c1=O	InChI=1S/C16H12ClN3O3/c1-19-13-5-3-2-4-12(13)14(15(16(19)21)20(22)23)18-11-8-6-10(17)7-9-11/h2-9,18H,1H3	UOTFDQYQLUZBMD-UHFFFAOYSA-N	329.056718984							94172
CHEMBL2141722	LSM-3674	VU-0410183-2, SID93621503, SID87692443, BRD-K74710236	44631784	InChI=1S/C20H23N5/c1-20(2,3)12-14-22-19-17(15-9-5-4-6-10-15)24-25-18(23-19)16-11-7-8-13-21-16/h4-11,13H,12,14H2,1-3H3,(H,22,23,25)	VZQQBRATUAQGEU-UHFFFAOYSA-N	CC(C)(C)CCNc1nc(nnc1c2ccccc2)c3ccccn3	BroadT	BRD-K74710236	BRD-K74710236-001-02-2	Vanderbilt Screening Center for GPCRs, Ion Channels, and Transporters	VU0410183-2	VU0410183-2		CC(C)(C)CCNc1nc(nnc1-c1ccccc1)-c1ccccn1	InChI=1S/C20H23N5/c1-20(2,3)12-14-22-19-17(15-9-5-4-6-10-15)24-25-18(23-19)16-11-7-8-13-21-16/h4-11,13H,12,14H2,1-3H3,(H,22,23,25)	VZQQBRATUAQGEU-UHFFFAOYSA-N	333.195345786							93317
BRD-8899	LSM-29350	TUL_XXI056TFA, BRD8899	53245473	InChI=1S/C17H22N4O3S/c1-11-7-18-8-13-4-3-5-16(17(11)13)25(23,24)21-15-6-14(20-10-15)9-19-12(2)22/h3-5,7-8,14-15,20-21H,6,9-10H2,1-2H3,(H,19,22)/t14-,15+/m0/s1	KAAADIFKRHNJHA-LSDHHAIUSA-N	CC(=O)NC[C@@H]1C[C@H](CN1)NS(=O)(=O)c2cccc3cncc(C)c23	BroadT	BRD-K22828899	BRD-K22828899-001-01-5	Broad Institute of MIT and Harvard	TUL_XXI039	XXI039		CC(=O)NC[C@@H]1C[C@H](CN1)NS(=O)(=O)c1cccc2cncc(C)c12	InChI=1S/C17H22N4O3S/c1-11-7-18-8-13-4-3-5-16(17(11)13)25(23,24)21-15-6-14(20-10-15)9-19-12(2)22/h3-5,7-8,14-15,20-21H,6,9-10H2,1-2H3,(H,19,22)/t14-,15+/m0/s1	KAAADIFKRHNJHA-LSDHHAIUSA-N	362.141261294							117901
BRD-K05398757	LSM-29351			InChI=1S/C15H17F2N3O2S/c16-15(17)12-10-19-9-11-3-1-4-13(14(11)12)23(21,22)20-7-2-5-18-6-8-20/h1,3-4,9-10,15,18H,2,5-8H2	CLDKWXXENUAKGX-UHFFFAOYSA-N	FC(F)c1cncc2cccc(c12)S(=O)(=O)N3CCCNCC3	BroadT	BRD-K05398757	BRD-K05398757-001-02-9	Broad Institute of MIT and Harvard	TUL_XXI009	XXI009		FC(F)c1cncc2cccc(c12)S(=O)(=O)N1CCCNCC1	InChI=1S/C15H17F2N3O2S/c16-15(17)12-10-19-9-11-3-1-4-13(14(11)12)23(21,22)20-7-2-5-18-6-8-20/h1,3-4,9-10,15,18H,2,5-8H2	CLDKWXXENUAKGX-UHFFFAOYSA-N	341.100953904							117902
ST51009565	LSM-43132	SID26513917, BRD-K70524666	2300608	InChI=1S/C19H8BrCl2N3O2S/c20-10-5-14-17(23-8-10)25-18(26)16(28-19(25)24-14)7-13-1-2-15(27-13)9-3-11(21)6-12(22)4-9/h1-8H/b16-7-	GIBYLKGNOHXSMJ-APSNUPSMSA-N	Clc1cc(Cl)cc(c1)c2oc(\C=C\3/Sc4nc5cc(Br)cnc5n4C3=O)cc2	BroadT	BRD-K70524666	BRD-K70524666-001-01-2	Sanford-Burnham Medical Research Institute	MLS-0091956.0001			Clc1cc(Cl)cc(c1)-c1ccc(\C=c2/sc3nc4cc(Br)cnc4n3c2=O)o1	InChI=1S/C19H8BrCl2N3O2S/c20-10-5-14-17(23-8-10)25-18(26)16(28-19(25)24-14)7-13-1-2-15(27-13)9-3-11(21)6-12(22)4-9/h1-8H/b16-7-	GIBYLKGNOHXSMJ-APSNUPSMSA-N	490.889765236							
CHEMBL584481	LSM-42926	BRD-K76425827, SID85256225	5932584	InChI=1S/C28H22FN3O5S3/c29-24-9-5-4-6-20(24)18-37-23-12-10-19(11-13-23)26-21(17-32(30-26)22-7-2-1-3-8-22)16-25-27(33)31(28(38)39-25)14-15-40(34,35)36/h1-13,16-17H,14-15,18H2,(H,34,35,36)/b25-16-	YSZRDGCESQUOBE-XYGWBWBKSA-N	OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2c3ccc(OCc4ccccc4F)cc3)c5ccccc5)\C1=O	BroadT	BRD-K76425827	BRD-K76425827-001-01-2	Sanford-Burnham Medical Research Institute	MLS-0425634.0001			OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(OCc3ccccc3F)cc2)-c2ccccc2)C1=O	InChI=1S/C28H22FN3O5S3/c29-24-9-5-4-6-20(24)18-37-23-12-10-19(11-13-23)26-21(17-32(30-26)22-7-2-1-3-8-22)16-25-27(33)31(28(38)39-25)14-15-40(34,35)36/h1-13,16-17H,14-15,18H2,(H,34,35,36)/b25-16-	YSZRDGCESQUOBE-XYGWBWBKSA-N	595.070561104							
Rhodanine derivative, 43	LSM-43129	BRD-K11987803, SID85256227	6166563	InChI=1S/C26H26N4O6S4/c31-25-23(38-26(37)29(25)15-16-39(32,33)34)17-20-18-30(21-7-3-1-4-8-21)27-24(20)19-9-11-22(12-10-19)40(35,36)28-13-5-2-6-14-28/h1,3-4,7-12,17-18H,2,5-6,13-16H2,(H,32,33,34)/b23-17-	CULPOYNTOOOYIX-QJOMJCCJSA-N	OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2c3ccc(cc3)S(=O)(=O)N4CCCCC4)c5ccccc5)\C1=O	BroadT	BRD-K11987803	BRD-K11987803-001-01-7	Sanford-Burnham Medical Research Institute	MLS-0425636.0001			OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(cc2)S(=O)(=O)N2CCCCC2)-c2ccccc2)C1=O	InChI=1S/C26H26N4O6S4/c31-25-23(38-26(37)29(25)15-16-39(32,33)34)17-20-18-30(21-7-3-1-4-8-21)27-24(20)19-9-11-22(12-10-19)40(35,36)28-13-5-2-6-14-28/h1,3-4,7-12,17-18H,2,5-6,13-16H2,(H,32,33,34)/b23-17-	CULPOYNTOOOYIX-QJOMJCCJSA-N	618.073517352							
MLS002699913	LSM-2152	BRD-K14842454, SID99495713, BRD-K07790824	46948707	InChI=1S/C16H21N3O2/c1-11(18-19-16(21)14-5-3-4-6-14)13-7-9-15(10-8-13)17-12(2)20/h7-10,14H,3-6H2,1-2H3,(H,17,20)(H,19,21)	VMSMDDNIQBHEBW-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)C(=NNC(=O)C2CCCC2)C	BroadT	BRD-K14842454	BRD-K14842454-001-01-3	Broad Institute of MIT and Harvard	cjd-pla-42-2	cjd-pla-42-2		CC(=O)Nc1ccc(cc1)C(\C)=N\NC(=O)C1CCCC1	InChI=1S/C16H21N3O2/c1-11(18-19-16(21)14-5-3-4-6-14)13-7-9-15(10-8-13)17-12(2)20/h7-10,14H,3-6H2,1-2H3,(H,17,20)(H,19,21)/b18-11+	VMSMDDNIQBHEBW-WOJGMQOQSA-N	287.163376942							92136
ASN 04482516	LSM-4873	BRD-K32111336, SID87544677	1135867	InChI=1S/C24H19N5O3S2/c1-14-9-16-10-19-20(32-8-7-31-19)11-18(16)29-22(14)27-28-24(29)34-13-21(30)26-23-25-17(12-33-23)15-5-3-2-4-6-15/h2-6,9-12H,7-8,13H2,1H3,(H,25,26,30)	BZWCPMNJOQACEK-UHFFFAOYSA-N	Cc1cc2cc3OCCOc3cc2n4c(SCC(=O)Nc5nc(cs5)c6ccccc6)nnc14	BroadT	BRD-K32111336	BRD-K32111336-001-01-5	Sanford-Burnham Medical Research Institute	MLS-0435554.0001			Cc1cc2cc3OCCOc3cc2n2c(SCC(=O)Nc3nc(cs3)-c3ccccc3)nnc12	InChI=1S/C24H19N5O3S2/c1-14-9-16-10-19-20(32-8-7-31-19)11-18(16)29-22(14)27-28-24(29)34-13-21(30)26-23-25-17(12-33-23)15-5-3-2-4-6-15/h2-6,9-12H,7-8,13H2,1H3,(H,25,26,30)	BZWCPMNJOQACEK-UHFFFAOYSA-N	489.092930898							94250
N2-Methyl-5-nitro-n4-phenylpyrimidine-2,4,6-triamine	LSM-4880	BRD-K54405293	3449329	InChI=1S/C11H12N6O2/c1-13-11-15-9(12)8(17(18)19)10(16-11)14-7-5-3-2-4-6-7/h2-6H,1H3,(H4,12,13,14,15,16)	FOJIGPFBFSLRGR-UHFFFAOYSA-N	CNc1nc(N)c(c(Nc2ccccc2)n1)[N+](=O)[O-]	BroadT	BRD-K54405293	BRD-K54405293-001-01-5	University of New Mexico MLSC	3449329			CNc1nc(N)c(c(Nc2ccccc2)n1)[N+]([O-])=O	InChI=1S/C11H12N6O2/c1-13-11-15-9(12)8(17(18)19)10(16-11)14-7-5-3-2-4-6-7/h2-6H,1H3,(H4,12,13,14,15,16)	FOJIGPFBFSLRGR-UHFFFAOYSA-N	260.102173684							94257
BRD-K18964980	LSM-29352		53245442	InChI=1S/C15H19N3O3S/c1-10-6-16-7-11-3-2-4-14(15(10)11)22(20,21)18-12-5-13(9-19)17-8-12/h2-4,6-7,12-13,17-19H,5,8-9H2,1H3/t12-,13+/m1/s1	RYYWECOTRQGHHB-OLZOCXBDSA-N	Cc1cncc2cccc(c12)S(=O)(=O)N[C@H]3CN[C@H](CO)C3	BroadT	BRD-K18964980	BRD-K18964980-001-01-4	Broad Institute of MIT and Harvard	TUL_XX025TFA	XX025		Cc1cncc2cccc(c12)S(=O)(=O)N[C@H]1CN[C@H](CO)C1	InChI=1S/C15H19N3O3S/c1-10-6-16-7-11-3-2-4-14(15(10)11)22(20,21)18-12-5-13(9-19)17-8-12/h2-4,6-7,12-13,17-19H,5,8-9H2,1H3/t12-,13+/m1/s1	RYYWECOTRQGHHB-OLZOCXBDSA-N	321.114712188							117903
MLS-0435557.0001	LSM-4864	BRD-K06652922, SID87544680	3190055	InChI=1S/C24H19N5O4S2/c1-13-7-15-8-19-20(33-12-32-19)9-18(15)29-22(13)27-28-24(29)35-11-21(30)26-23-25-17(10-34-23)14-3-5-16(31-2)6-4-14/h3-10H,11-12H2,1-2H3,(H,25,26,30)	GERMPJNUXLBCOW-UHFFFAOYSA-N	COc1ccc(cc1)c2csc(NC(=O)CSc3nnc4c(C)cc5cc6OCOc6cc5n34)n2	BroadT	BRD-K06652922	BRD-K06652922-001-01-0	Sanford-Burnham Medical Research Institute	MLS-0435557.0001			COc1ccc(cc1)-c1csc(NC(=O)CSc2nnc3c(C)cc4cc5OCOc5cc4n23)n1	InChI=1S/C24H19N5O4S2/c1-13-7-15-8-19-20(33-12-32-19)9-18(15)29-22(13)27-28-24(29)35-11-21(30)26-23-25-17(10-34-23)14-3-5-16(31-2)6-4-14/h3-10H,11-12H2,1-2H3,(H,25,26,30)	GERMPJNUXLBCOW-UHFFFAOYSA-N	505.087845518							94241
ST50973695	LSM-43131	BRD-K42541148, SID26513883	2243732	InChI=1S/C21H12N2O4S/c24-19-18(28-21-22-15-3-1-2-4-16(15)23(19)21)11-14-9-10-17(27-14)12-5-7-13(8-6-12)20(25)26/h1-11H,(H,25,26)/b18-11-	PBRCPUKRPJYRTF-WQRHYEAKSA-N	OC(=O)c1ccc(cc1)c2oc(\C=C\3/Sc4nc5ccccc5n4C3=O)cc2	BroadT	BRD-K42541148	BRD-K42541148-001-01-9	Sanford-Burnham Medical Research Institute	MLS-0091939.0001			OC(=O)c1ccc(cc1)-c1ccc(\C=c2/sc3nc4ccccc4n3c2=O)o1	InChI=1S/C21H12N2O4S/c24-19-18(28-21-22-15-3-1-2-4-16(15)23(19)21)11-14-9-10-17(27-14)12-5-7-13(8-6-12)20(25)26/h1-11H,(H,25,26)/b18-11-	PBRCPUKRPJYRTF-WQRHYEAKSA-N	388.051777574							
AC1NAL7D	LSM-2802	BRD-K36591038, SID85147372	4453692	InChI=1S/C4HClN4S3/c5-2-3(11-12-9-2)7-4-8-6-1-10-4/h1H	ZHOOKWSKEFQZOG-UHFFFAOYSA-N	ClC1=NSSC1=Nc2nncs2	BroadT	BRD-K36591038	BRD-K36591038-001-04-9	Sanford-Burnham Medical Research Institute	MLS-0390818.0001			Clc1nssc1=Nc1nncs1	InChI=1S/C4HClN4S3/c5-2-3(11-12-9-2)7-4-8-6-1-10-4/h1H	ZHOOKWSKEFQZOG-UHFFFAOYSA-N	235.905185852							92641
MLS003179196	LSM-1356	BRD-A17718497, SID99376525	46912148	InChI=1S/C21H19Cl2N3O/c1-14-13-25(20-8-9-24-19-12-17(23)6-7-18(19)20)10-11-26(14)21(27)15-2-4-16(22)5-3-15/h2-9,12,14H,10-11,13H2,1H3	GLPPUGLLAYNGBF-UHFFFAOYSA-N	CC1CN(CCN1C(=O)c2ccc(Cl)cc2)c3ccnc4cc(Cl)ccc34	BroadT	BRD-A17718497	BRD-A17718497-001-01-3	Broad Institute of MIT and Harvard	BRD-A17718497			CC1CN(CCN1C(=O)c1ccc(Cl)cc1)c1ccnc2cc(Cl)ccc12	InChI=1S/C21H19Cl2N3O/c1-14-13-25(20-8-9-24-19-12-17(23)6-7-18(19)20)10-11-26(14)21(27)15-2-4-16(22)5-3-15/h2-9,12,14H,10-11,13H2,1H3	GLPPUGLLAYNGBF-UHFFFAOYSA-N	399.090517678							91560
CHEMBL607856	LSM-3321	BRD-K59470558	25067484	InChI=1S/C13H14N2O3/c1-2-13-14-5-6-15(13)8-12(18)9-3-4-10(16)11(17)7-9/h3-7,16-17H,2,8H2,1H3	KRFQWVXRVPHWCH-UHFFFAOYSA-N	CCc1nccn1CC(=O)c2ccc(O)c(O)c2	BroadT	BRD-K59470558	BRD-K59470558-003-01-0	Sanford-Burnham Medical Research Institute	MLS-0315848.0001		Cl	CCc1nccn1CC(=O)c1ccc(O)c(O)c1.Cl	InChI=1S/C13H14N2O3.ClH/c1-2-13-14-5-6-15(13)8-12(18)9-3-4-10(16)11(17)7-9;/h3-7,16-17H,2,8H2,1H3;1H	VTSPJLHFXSMCCC-UHFFFAOYSA-N	246.100442328							93042, 93042
MLS-0091943.0001	LSM-42868	BRD-K09191212, SID26513897	5341943	InChI=1S/C23H16N2O4S/c1-12-9-13(2)20-17(10-12)25-21(26)19(30-23(25)24-20)11-14-7-8-18(29-14)15-5-3-4-6-16(15)22(27)28/h3-11H,1-2H3,(H,27,28)/b19-11-	JFRYLPFKWKOMBZ-ODLFYWEKSA-N	Cc1cc(C)c2nc3S\C(=C/c4oc(cc4)c5ccccc5C(=O)O)\C(=O)n3c2c1	BroadT	BRD-K09191212	BRD-K09191212-001-01-5	Sanford-Burnham Medical Research Institute	MLS-0091943.0001			Cc1cc(C)c2nc3s\c(=C/c4ccc(o4)-c4ccccc4C(O)=O)c(=O)n3c2c1	InChI=1S/C23H16N2O4S/c1-12-9-13(2)20-17(10-12)25-21(26)19(30-23(25)24-20)11-14-7-8-18(29-14)15-5-3-4-6-16(15)22(27)28/h3-11H,1-2H3,(H,27,28)/b19-11-	JFRYLPFKWKOMBZ-ODLFYWEKSA-N	416.083077702							
AC1MRA7L	LSM-3181	BRD-K53445087, SID99495715, BRD-K18739469	3464963	InChI=1S/C14H17N3O2/c1-9(16-17-10(2)18)11-5-7-13(8-6-11)15-14(19)12-3-4-12/h5-8,12H,3-4H2,1-2H3,(H,15,19)(H,17,18)	GDOSRNDUIMOPBJ-UHFFFAOYSA-N	CC(=O)NN=C(C)c1ccc(NC(=O)C2CC2)cc1	BroadT	BRD-K18739469	BRD-K18739469-001-01-0	Broad Institute of MIT and Harvard	cjd-pla-48	cjd-pla-48		CC(=O)N\N=C(/C)c1ccc(NC(=O)C2CC2)cc1	InChI=1S/C14H17N3O2/c1-9(16-17-10(2)18)11-5-7-13(8-6-11)15-14(19)12-3-4-12/h5-8,12H,3-4H2,1-2H3,(H,15,19)(H,17,18)/b16-9+	GDOSRNDUIMOPBJ-CXUHLZMHSA-N	259.132076814							92932
MLS-0425579.0001	LSM-42816	BRD-A26962727, SID85248309	5346285	InChI=1S/C26H22Cl2N2O7S/c1-4-36-25(34)21-13(2)29-26-30(22(21)15-7-5-6-8-16(15)27)24(33)19(38-26)11-14-9-17(28)23(18(10-14)35-3)37-12-20(31)32/h5-11,22H,4,12H2,1-3H3,(H,31,32)/b19-11+	ZZZCFNBBQNVYLT-YBFXNURJSA-N	CCOC(=O)C1=C(C)N=C2S\C(=C\c3cc(Cl)c(OCC(=O)O)c(OC)c3)\C(=O)N2C1c4ccccc4Cl	BroadT	BRD-A26962727	BRD-A26962727-001-01-8	Sanford-Burnham Medical Research Institute	MLS-0425579.0001			CCOC(=O)C1=C(C)N=c2s\c(=C\c3cc(Cl)c(OCC(O)=O)c(OC)c3)c(=O)n2C1c1ccccc1Cl	InChI=1S/C26H22Cl2N2O7S/c1-4-36-25(34)21-13(2)29-26-30(22(21)15-7-5-6-8-16(15)27)24(33)19(38-26)11-14-9-17(28)23(18(10-14)35-3)37-12-20(31)32/h5-11,22H,4,12H2,1-3H3,(H,31,32)/b19-11+	ZZZCFNBBQNVYLT-YBFXNURJSA-N	576.052477174							
CHEMBL2130568	LSM-29353	SID87692442, BRD-K08307026	44631783	InChI=1S/C21H23N5/c1-3-9-16(10-4-1)15-23-21-19(17-11-5-2-6-12-17)25-26-20(24-21)18-13-7-8-14-22-18/h2,5-8,11-14,16H,1,3-4,9-10,15H2,(H,23,24,26)	FTHAFMYRINDSEL-UHFFFAOYSA-N	C(Nc1nc(nnc1c2ccccc2)c3ccccn3)C4CCCCC4	BroadT	BRD-K08307026	BRD-K08307026-001-01-4	Vanderbilt Screening Center for GPCRs, Ion Channels, and Transporters	BRD-K08307026	VU0410182-1		C(Nc1nc(nnc1-c1ccccc1)-c1ccccn1)C1CCCCC1	InChI=1S/C21H23N5/c1-3-9-16(10-4-1)15-23-21-19(17-11-5-2-6-12-17)25-26-20(24-21)18-13-7-8-14-22-18/h2,5-8,11-14,16H,1,3-4,9-10,15H2,(H,23,24,26)	FTHAFMYRINDSEL-UHFFFAOYSA-N	345.195345786							117904
CHEMBL610781	LSM-2503	SID57309182, BRD-K23027438	25199538	InChI=1S/C12H12N2O3/c1-8-5-13-14(6-8)7-12(17)9-2-3-10(15)11(16)4-9/h2-6,15-16H,7H2,1H3	QPQYGSJBZGMXHI-UHFFFAOYSA-N	Cc1cnn(CC(=O)c2ccc(O)c(O)c2)c1	BroadT	BRD-K23027438	BRD-K23027438-001-01-1	Sanford-Burnham Medical Research Institute	MLS-0390945.0001			Cc1cnn(CC(=O)c2ccc(O)c(O)c2)c1	InChI=1S/C12H12N2O3/c1-8-5-13-14(6-8)7-12(17)9-2-3-10(15)11(16)4-9/h2-6,15-16H,7H2,1H3	QPQYGSJBZGMXHI-UHFFFAOYSA-N	232.084792264							92405
MLS003179191	LSM-4229	BRD-K98896788, SID99368326	46907806	InChI=1S/C33H35FN4O6S/c1-21-18-38(22(2)20-39)32(40)25-13-9-16-28(36-33(41)35-27-15-8-11-23-10-4-5-12-24(23)27)31(25)44-29(21)19-37(3)45(42,43)30-17-7-6-14-26(30)34/h4-17,21-22,29,39H,18-20H2,1-3H3,(H2,35,36,41)/t21-,22+,29+/m1/s1	ATJMFQQXDOTDTE-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc3c(NC(=O)Nc4cccc5ccccc45)cccc3C1=O	BroadT	BRD-K98896788	BRD-K98896788-001-02-3	Broad Institute of MIT and Harvard	BRD-K98896788			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C1=O	InChI=1S/C33H35FN4O6S/c1-21-18-38(22(2)20-39)32(40)25-13-9-16-28(36-33(41)35-27-15-8-11-23-10-4-5-12-24(23)27)31(25)44-29(21)19-37(3)45(42,43)30-17-7-6-14-26(30)34/h4-17,21-22,29,39H,18-20H2,1-3H3,(H2,35,36,41)/t21-,22+,29+/m1/s1	ATJMFQQXDOTDTE-BXOOBUKZSA-N	634.22613377							93732
ASN 04482680	LSM-3933	SID87544679, BRD-K86631041	1143390	InChI=1S/C23H17N5O3S2/c1-13-7-15-8-18-19(31-12-30-18)9-17(15)28-21(13)26-27-23(28)33-11-20(29)25-22-24-16(10-32-22)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,24,25,29)	VMCNPERZTWTVQD-UHFFFAOYSA-N	Cc1cc2cc3OCOc3cc2n4c(SCC(=O)Nc5nc(cs5)c6ccccc6)nnc14	BroadT	BRD-K86631041	BRD-K86631041-001-01-3	Sanford-Burnham Medical Research Institute	MLS-0435556.0001			Cc1cc2cc3OCOc3cc2n2c(SCC(=O)Nc3nc(cs3)-c3ccccc3)nnc12	InChI=1S/C23H17N5O3S2/c1-13-7-15-8-18-19(31-12-30-18)9-17(15)28-21(13)26-27-23(28)33-11-20(29)25-22-24-16(10-32-22)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,24,25,29)	VMCNPERZTWTVQD-UHFFFAOYSA-N	475.077280834							93510
CHEMBL1619263	LSM-4840	BRD-A80788753	23606608	InChI=1S/C23H29ClFNO2/c1-2-3-12-23(27,19-6-10-21(25)11-7-19)22(17-26-13-15-28-16-14-26)18-4-8-20(24)9-5-18/h4-11,22,27H,2-3,12-17H2,1H3	BTGJJKUUMGGZNO-UHFFFAOYSA-N	CCCCC(O)(C(CN1CCOCC1)c2ccc(Cl)cc2)c3ccc(F)cc3	BroadT	BRD-A80788753	BRD-A80788753-001-01-7	ChemDiv Inc.	D163-0113			CCCCC(O)(C(CN1CCOCC1)c1ccc(Cl)cc1)c1ccc(F)cc1	InChI=1S/C23H29ClFNO2/c1-2-3-12-23(27,19-6-10-21(25)11-7-19)22(17-26-13-15-28-16-14-26)18-4-8-20(24)9-5-18/h4-11,22,27H,2-3,12-17H2,1H3	BTGJJKUUMGGZNO-UHFFFAOYSA-N	405.187085088							94218, 94218
AB00540133	LSM-29354	SID57287582, SID26736105, BRD-K19922318	16749996	InChI=1S/C16H14N2O2S/c1-17(2)15(19)11-6-5-7-12(10-11)18-16(20)13-8-3-4-9-14(13)21-18/h3-10H,1-2H3	TUPPZGFKINLCEX-UHFFFAOYSA-N	CN(C)C(=O)c1cccc(c1)N2Sc3ccccc3C2=O	BroadT	BRD-K19922318	BRD-K19922318-001-01-4	Sanford-Burnham Medical Research Institute	MLS-0390838.0001			CN(C)C(=O)c1cccc(c1)-n1sc2ccccc2c1=O	InChI=1S/C16H14N2O2S/c1-17(2)15(19)11-6-5-7-12(10-11)18-16(20)13-8-3-4-9-14(13)21-18/h3-10H,1-2H3	TUPPZGFKINLCEX-UHFFFAOYSA-N	298.077598398							117905
(3-Chlorophenyl)[4-(7-chloroquinolin-4-yl)piperazin-1-yl]methanone	LSM-3413	SJB-AF-2, SID99376521, BRD-K63511615	1505784	InChI=1S/C20H17Cl2N3O/c21-15-3-1-2-14(12-15)20(26)25-10-8-24(9-11-25)19-6-7-23-18-13-16(22)4-5-17(18)19/h1-7,12-13H,8-11H2	WLHWOEPDMHMNLY-UHFFFAOYSA-N	Clc1cccc(c1)C(=O)N2CCN(CC2)c3ccnc4cc(Cl)ccc34	BroadT	BRD-K63511615	BRD-K63511615-001-01-0	Broad Institute of MIT and Harvard	SJB-af-2			Clc1cccc(c1)C(=O)N1CCN(CC1)c1ccnc2cc(Cl)ccc12	InChI=1S/C20H17Cl2N3O/c21-15-3-1-2-14(12-15)20(26)25-10-8-24(9-11-25)19-6-7-23-18-13-16(22)4-5-17(18)19/h1-7,12-13H,8-11H2	WLHWOEPDMHMNLY-UHFFFAOYSA-N	385.074867614							93110
SCHEMBL2001327	LSM-29355	BRD-K79070828	67243342	InChI=1S/C14H17N3O2S/c1-10-7-16-8-11-3-2-4-13(14(10)11)20(18,19)17-6-5-12(15)9-17/h2-4,7-8,12H,5-6,9,15H2,1H3/t12-/m1/s1	LEVLNVWBEBXEIX-GFCCVEGCSA-N	Cc1cncc2cccc(c12)S(=O)(=O)N3CC[C@@H](N)C3	BroadT	BRD-K79070828	BRD-K79070828-001-01-2	Broad Institute of MIT and Harvard	TUL_XIX029	XIX029		Cc1cncc2cccc(c12)S(=O)(=O)N1CC[C@@H](N)C1	InChI=1S/C14H17N3O2S/c1-10-7-16-8-11-3-2-4-13(14(10)11)20(18,19)17-6-5-12(15)9-17/h2-4,7-8,12H,5-6,9,15H2,1H3/t12-/m1/s1	LEVLNVWBEBXEIX-GFCCVEGCSA-N	291.104147504							117906
N-Benzyl-2-chloroquinazolin-4-amine	LSM-4535	BRD-K11758216	1604254	InChI=1S/C15H12ClN3/c16-15-18-13-9-5-4-8-12(13)14(19-15)17-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,17,18,19)	JXCBIDUKEIBVKZ-UHFFFAOYSA-N	Clc1nc(NCc2ccccc2)c3ccccc3n1	BroadT	BRD-K11758216	BRD-K11758216-001-01-3	Broad Institute of MIT and Harvard	Ran 03	TL-Ran-03		Clc1nc(NCc2ccccc2)c2ccccc2n1	InChI=1S/C15H12ClN3/c16-15-18-13-9-5-4-8-12(13)14(19-15)17-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,17,18,19)	JXCBIDUKEIBVKZ-UHFFFAOYSA-N	269.071975124							93954
BRD-K06585517	LSM-15436		46238405	InChI=1S/C18H27N5/c1-3-11-23(12-4-2)18-20-16-8-6-5-7-15(16)17(21-18)22-13-9-19-10-14-22/h5-8,19H,3-4,9-14H2,1-2H3	BHVFEFOMNRUGLC-UHFFFAOYSA-N	CCCN(CCC)c1nc(N2CCNCC2)c3ccccc3n1	BroadT	BRD-K06585517	BRD-K06585517-003-01-9	Broad Institute of MIT and Harvard	Ran 29	TL-Ran-29	Cl	CCCN(CCC)c1nc(N2CCNCC2)c2ccccc2n1.Cl	InChI=1S/C18H27N5.ClH/c1-3-11-23(12-4-2)18-20-16-8-6-5-7-15(16)17(21-18)22-13-9-19-10-14-22;/h5-8,19H,3-4,9-14H2,1-2H3;1H	JNGLTCDBLHWAPP-UHFFFAOYSA-N	313.226645914							104078
Sirolimus	LSM-43134	Sirolimus		InChI=1S/C51H79NO13/c1-30-16-12-11-13-17-31(2)42(61-8)28-38-21-19-36(7)51(60,65-38)48(57)49(58)52-23-15-14-18-39(52)50(59)64-43(33(4)26-37-20-22-40(53)44(27-37)62-9)29-41(54)32(3)25-35(6)46(56)47(63-10)45(55)34(5)24-30/h11-13,16-17,25,30,32-34,36-40,42-44,46-47,53,56,60H,14-15,18-24,26-29H2,1-10H3/b13-11+,16-12-,31-17+,35-25+/t30-,32-,33-,34-,36-,37+,38+,39+,40-,42+,43+,44-,46-,47+,51-/m1/s1	QFJCIRLUMZQUOT-KADBNGAOSA-N	CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(/C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C/C=C/C=C(\C)/[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N4CCCC[C@H]4C(=O)O2)OC)CC[C@H]1O	BroadT	BRD-K89626439	BRD-K89626439-001-01-0	University of New Mexico MLSC	5284616			CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C/C=C/C=C(C)/[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1O	InChI=1S/C51H79NO13/c1-30-16-12-11-13-17-31(2)42(61-8)28-38-21-19-36(7)51(60,65-38)48(57)49(58)52-23-15-14-18-39(52)50(59)64-43(33(4)26-37-20-22-40(53)44(27-37)62-9)29-41(54)32(3)25-35(6)46(56)47(63-10)45(55)34(5)24-30/h11-13,16-17,25,30,32-34,36-40,42-44,46-47,53,56,60H,14-15,18-24,26-29H2,1-10H3/b13-11+,16-12-,31-17+,35-25+/t30-,32-,33-,34-,36-,37+,38+,39+,40-,42+,43+,44-,46-,47+,51-/m1/s1	QFJCIRLUMZQUOT-KADBNGAOSA-N	913.555141598001							
MLS-0435541.0001	LSM-3553	BRD-K69516039, SID87544640	17460708	InChI=1S/C23H29N3O4S2/c27-23(22-15-17-5-1-2-6-21(17)31-22)24-19-16-18(7-8-20(19)25-9-3-4-10-25)32(28,29)26-11-13-30-14-12-26/h7-8,15-16H,1-6,9-14H2,(H,24,27)	PODUXAQFLMUPKS-UHFFFAOYSA-N	O=C(Nc1cc(ccc1N2CCCC2)S(=O)(=O)N3CCOCC3)c4cc5CCCCc5s4	BroadT	BRD-K69516039	BRD-K69516039-001-01-1	Sanford-Burnham Medical Research Institute	MLS-0435541.0001			O=C(Nc1cc(ccc1N1CCCC1)S(=O)(=O)N1CCOCC1)c1cc2CCCCc2s1	InChI=1S/C23H29N3O4S2/c27-23(22-15-17-5-1-2-6-21(17)31-22)24-19-16-18(7-8-20(19)25-9-3-4-10-25)32(28,29)26-11-13-30-14-12-26/h7-8,15-16H,1-6,9-14H2,(H,24,27)	PODUXAQFLMUPKS-UHFFFAOYSA-N	475.159947818							93219
Rhodanine derivative, 38	LSM-42908	BRD-K91485395, SID85256223	6161281	InChI=1S/C28H22ClN3O5S3/c29-22-10-6-19(7-11-22)18-37-24-12-8-20(9-13-24)26-21(17-32(30-26)23-4-2-1-3-5-23)16-25-27(33)31(28(38)39-25)14-15-40(34,35)36/h1-13,16-17H,14-15,18H2,(H,34,35,36)/b25-16-	UEMVHDDFBLKUGI-XYGWBWBKSA-N	OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2c3ccc(OCc4ccc(Cl)cc4)cc3)c5ccccc5)\C1=O	BroadT	BRD-K91485395	BRD-K91485395-001-01-9	Sanford-Burnham Medical Research Institute	MLS-0425632.0001			OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(OCc3ccc(Cl)cc3)cc2)-c2ccccc2)C1=O	InChI=1S/C28H22ClN3O5S3/c29-22-10-6-19(7-11-22)18-37-24-12-8-20(9-13-24)26-21(17-32(30-26)23-4-2-1-3-5-23)16-25-27(33)31(28(38)39-25)14-15-40(34,35)36/h1-13,16-17H,14-15,18H2,(H,34,35,36)/b25-16-	UEMVHDDFBLKUGI-XYGWBWBKSA-N	611.041010614							
NSC403917	LSM-4816	BRD-K81925089	345945	InChI=1S/C14H20N4/c1-3-9-18(10-4-2)14-16-12-8-6-5-7-11(12)13(15)17-14/h5-8H,3-4,9-10H2,1-2H3,(H2,15,16,17)	MEUZETRTXAIIJM-UHFFFAOYSA-N	CCCN(CCC)c1nc(N)c2ccccc2n1	BroadT	BRD-K81925089	BRD-K81925089-001-01-7	Broad Institute of MIT and Harvard	Ran 30	TL-Ran-30		CCCN(CCC)c1nc(N)c2ccccc2n1	InChI=1S/C14H20N4/c1-3-9-18(10-4-2)14-16-12-8-6-5-7-11(12)13(15)17-14/h5-8H,3-4,9-10H2,1-2H3,(H2,15,16,17)	MEUZETRTXAIIJM-UHFFFAOYSA-N	244.16879668							94196
CHEMBL2142321	LSM-4813	SID98626450, BRD-A51777634	46742339	InChI=1S/C24H27N5/c1-3-9-18(10-4-1)20-14-16-29(17-20)24-22(19-11-5-2-6-12-19)27-28-23(26-24)21-13-7-8-15-25-21/h2,5-8,11-13,15,18,20H,1,3-4,9-10,14,16-17H2	JNMZVPMPLIWXEY-UHFFFAOYSA-N	C1CCC(CC1)C2CCN(C2)c3nc(nnc3c4ccccc4)c5ccccn5	BroadT	BRD-A51777634	BRD-A51777634-001-01-0	Vanderbilt Screening Center for GPCRs, Ion Channels, and Transporters	VU0418933-1	VU0418933-1		C1CN(CC1C1CCCCC1)c1nc(nnc1-c1ccccc1)-c1ccccn1	InChI=1S/C24H27N5/c1-3-9-18(10-4-1)20-14-16-29(17-20)24-22(19-11-5-2-6-12-19)27-28-23(26-24)21-13-7-8-15-25-21/h2,5-8,11-13,15,18,20H,1,3-4,9-10,14,16-17H2	JNMZVPMPLIWXEY-UHFFFAOYSA-N	385.226645914							94193
CHEMBL565810	LSM-42865	BRD-K95253417, SID85256226	5998084	InChI=1S/C28H23N3O5S3/c32-27-25(38-28(37)30(27)15-16-39(33,34)35)17-22-18-31(23-9-5-2-6-10-23)29-26(22)21-11-13-24(14-12-21)36-19-20-7-3-1-4-8-20/h1-14,17-18H,15-16,19H2,(H,33,34,35)/b25-17-	BKKZXYQHBNATKO-UQQQWYQISA-N	OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2c3ccc(OCc4ccccc4)cc3)c5ccccc5)\C1=O	BroadT	BRD-K95253417	BRD-K95253417-001-01-1	Sanford-Burnham Medical Research Institute	MLS-0425635.0001			OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(OCc3ccccc3)cc2)-c2ccccc2)C1=O	InChI=1S/C28H23N3O5S3/c32-27-25(38-28(37)30(27)15-16-39(33,34)35)17-22-18-31(23-9-5-2-6-10-23)29-26(22)21-11-13-24(14-12-21)36-19-20-7-3-1-4-8-20/h1-14,17-18H,15-16,19H2,(H,33,34,35)/b25-17-	BKKZXYQHBNATKO-UQQQWYQISA-N	577.079982936							
MLS003179192	LSM-3532	BRD-K68437527, SID85799159, EMF-BCA1-60	44492462	InChI=1S/C33H35ClN4O6S/c1-21-18-38(22(2)20-39)32(40)27-11-7-13-29(36-33(41)35-28-12-6-9-23-8-4-5-10-26(23)28)31(27)44-30(21)19-37(3)45(42,43)25-16-14-24(34)15-17-25/h4-17,21-22,30,39H,18-20H2,1-3H3,(H2,35,36,41)/t21-,22+,30+/m1/s1	NPOUMSIYVDQJDX-DGIFUFQNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc3c(NC(=O)Nc4cccc5ccccc45)cccc3C1=O	BroadT	BRD-K68437527	BRD-K68437527-001-02-8	Broad Institute of MIT and Harvard	EMF-bca1-60			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C1=O	InChI=1S/C33H35ClN4O6S/c1-21-18-38(22(2)20-39)32(40)27-11-7-13-29(36-33(41)35-28-12-6-9-23-8-4-5-10-26(23)28)31(27)44-30(21)19-37(3)45(42,43)25-16-14-24(34)15-17-25/h4-17,21-22,30,39H,18-20H2,1-3H3,(H2,35,36,41)/t21-,22+,30+/m1/s1	NPOUMSIYVDQJDX-DGIFUFQNSA-N	650.19658328							93203
CID-2858522	LSM-3337	BRD2020, CID 2858522, CHEMBL-374350	2858523	InChI=1S/C28H39N3O3/c1-17-12-22-23(13-18(17)2)31(26(30-22)29-10-9-11-32)16-24(33)19-14-20(27(3,4)5)25(34)21(15-19)28(6,7)8/h12-15,32,34H,9-11,16H2,1-8H3,(H,29,30)	CYCGGKILBWERDJ-UHFFFAOYSA-N	Cc1cc2nc(NCCCO)n(CC(=O)c3cc(c(O)c(c3)C(C)(C)C)C(C)(C)C)c2cc1C	BroadT	BRD-K59962020	BRD-K59962020-004-01-4	Sanford-Burnham Medical Research Institute	MLS-0146295.0001		Br	Cc1cc2nc(NCCCO)n(CC(=O)c3cc(c(O)c(c3)C(C)(C)C)C(C)(C)C)c2cc1C.Br	InChI=1S/C28H39N3O3.BrH/c1-17-12-22-23(13-18(17)2)31(26(30-22)29-10-9-11-32)16-24(33)19-14-20(27(3,4)5)25(34)21(15-19)28(6,7)8;/h12-15,32,34H,9-11,16H2,1-8H3,(H,29,30);1H	INQUHQQVARRKGV-UHFFFAOYSA-N	465.299142138							93053, 93053
CHEMBL567069	LSM-43135	BRD-K91671201, SID85256224	6274486	InChI=1S/C28H22ClN3O5S3/c29-24-9-5-4-6-20(24)18-37-23-12-10-19(11-13-23)26-21(17-32(30-26)22-7-2-1-3-8-22)16-25-27(33)31(28(38)39-25)14-15-40(34,35)36/h1-13,16-17H,14-15,18H2,(H,34,35,36)/b25-16-	WILPFKVTYXJQQV-XYGWBWBKSA-N	OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2c3ccc(OCc4ccccc4Cl)cc3)c5ccccc5)\C1=O	BroadT	BRD-K91671201	BRD-K91671201-001-01-8	Sanford-Burnham Medical Research Institute	MLS-0425633.0001			OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(OCc3ccccc3Cl)cc2)-c2ccccc2)C1=O	InChI=1S/C28H22ClN3O5S3/c29-24-9-5-4-6-20(24)18-37-23-12-10-19(11-13-23)26-21(17-32(30-26)22-7-2-1-3-8-22)16-25-27(33)31(28(38)39-25)14-15-40(34,35)36/h1-13,16-17H,14-15,18H2,(H,34,35,36)/b25-16-	WILPFKVTYXJQQV-XYGWBWBKSA-N	611.041010614							
MLS-0315871.0001	LSM-4862	SID56373839, BRD-A06909528	4879301	InChI=1S/C21H17N3O2/c25-20-21(23-22-17-11-5-7-13-19(17)26-21)16-10-4-6-12-18(16)24(20)14-15-8-2-1-3-9-15/h1-13,22-23H,14H2	JOMQEKIENWKNHV-UHFFFAOYSA-N	O=C1N(Cc2ccccc2)c3ccccc3C14NNc5ccccc5O4	BroadT	BRD-A06909528	BRD-A06909528-001-01-4	Sanford-Burnham Medical Research Institute	MLS-0315871.0001			O=C1N(Cc2ccccc2)c2ccccc2C11NNc2ccccc2O1	InChI=1S/C21H17N3O2/c25-20-21(23-22-17-11-5-7-13-19(17)26-21)16-10-4-6-12-18(16)24(20)14-15-8-2-1-3-9-15/h1-13,22-23H,14H2	JOMQEKIENWKNHV-UHFFFAOYSA-N	343.132076814							94239
MLS-0435542.0001	LSM-1937	SID87544641, BRD-A95937159	24242928	InChI=1S/C22H28N2O5S2/c1-3-15-4-7-20-16(12-15)13-21(30-20)22(25)23-18-14-17(5-6-19(18)28-2)31(26,27)24-8-10-29-11-9-24/h5-6,13-15H,3-4,7-12H2,1-2H3,(H,23,25)	HFHMZZBOHTVBEJ-UHFFFAOYSA-N	CCC1CCc2sc(cc2C1)C(=O)Nc3cc(ccc3OC)S(=O)(=O)N4CCOCC4	BroadT	BRD-A95937159	BRD-A95937159-001-01-3	Sanford-Burnham Medical Research Institute	MLS-0435542.0001			CCC1CCc2sc(cc2C1)C(=O)Nc1cc(ccc1OC)S(=O)(=O)N1CCOCC1	InChI=1S/C22H28N2O5S2/c1-3-15-4-7-20-16(12-15)13-21(30-20)22(25)23-18-14-17(5-6-19(18)28-2)31(26,27)24-8-10-29-11-9-24/h5-6,13-15H,3-4,7-12H2,1-2H3,(H,23,25)	HFHMZZBOHTVBEJ-UHFFFAOYSA-N	464.143963396							91975
MLS-0435534.0001	LSM-3879	BRD-K83620635, SID87544633	16273006	InChI=1S/C21H26ClN3O3S/c1-15-6-5-7-20(16(15)2)24-10-12-25(13-11-24)21(26)18-14-17(8-9-19(18)22)29(27,28)23(3)4/h5-9,14H,10-13H2,1-4H3	KFPUJRPTEYGPLI-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(Cl)c(c1)C(=O)N2CCN(CC2)c3cccc(C)c3C	BroadT	BRD-K83620635	BRD-K83620635-001-01-1	Sanford-Burnham Medical Research Institute	MLS-0435534.0001			CN(C)S(=O)(=O)c1ccc(Cl)c(c1)C(=O)N1CCN(CC1)c1cccc(C)c1C	InChI=1S/C21H26ClN3O3S/c1-15-6-5-7-20(16(15)2)24-10-12-25(13-11-24)21(26)18-14-17(8-9-19(18)22)29(27,28)23(3)4/h5-9,14H,10-13H2,1-4H3	KFPUJRPTEYGPLI-UHFFFAOYSA-N	435.138340122							93465
MLS003271309	LSM-3432	BRD-K64058329, SID85807046	44500012	InChI=1S/C30H36N4O7S/c1-20-17-34(21(2)19-35)29(36)25-11-8-12-26(32-30(37)31-22-9-6-5-7-10-22)28(25)41-27(20)18-33(3)42(38,39)24-15-13-23(40-4)14-16-24/h5-16,20-21,27,35H,17-19H2,1-4H3,(H2,31,32,37)/t20-,21+,27+/m1/s1	FVBMANNWVHBCBY-BUEREQSYSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2Oc3c(NC(=O)Nc4ccccc4)cccc3C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K64058329	BRD-K64058329-001-01-8	Broad Institute of MIT and Harvard	BRD-K64058329			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2c(NC(=O)Nc3ccccc3)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H36N4O7S/c1-20-17-34(21(2)19-35)29(36)25-11-8-12-26(32-30(37)31-22-9-6-5-7-10-22)28(25)41-27(20)18-33(3)42(38,39)24-15-13-23(40-4)14-16-24/h5-16,20-21,27,35H,17-19H2,1-4H3,(H2,31,32,37)/t20-,21+,27+/m1/s1	FVBMANNWVHBCBY-BUEREQSYSA-N	596.230470222							93122
CHEMBL2142877	LSM-29356	BRD-K81795824, SID91890042	45099945	InChI=1S/C23H16N6S/c1-3-9-16(10-4-1)19-15-30-23(25-19)27-22-20(17-11-5-2-6-12-17)28-29-21(26-22)18-13-7-8-14-24-18/h1-15H,(H,25,26,27,29)	SFLIDSZKPUWPJR-UHFFFAOYSA-N	N(c1nc(cs1)c2ccccc2)c3nc(nnc3c4ccccc4)c5ccccn5	BroadT	BRD-K81795824	BRD-K81795824-001-01-4	Vanderbilt Screening Center for GPCRs, Ion Channels, and Transporters	BRD-K81795824	VU0413263-1		N(c1nc(cs1)-c1ccccc1)c1nc(nnc1-c1ccccc1)-c1ccccn1	InChI=1S/C23H16N6S/c1-3-9-16(10-4-1)19-15-30-23(25-19)27-22-20(17-11-5-2-6-12-17)28-29-21(26-22)18-13-7-8-14-24-18/h1-15H,(H,25,26,27,29)	SFLIDSZKPUWPJR-UHFFFAOYSA-N	408.115715262							117907
ZINC05054912	LSM-4871	BRD-K25884242	5132371	InChI=1S/C11H11ClN6O2/c1-14-11-16-9(13)8(18(19)20)10(17-11)15-7-4-2-6(12)3-5-7/h2-5H,1H3,(H4,13,14,15,16,17)	BCKXEJXFSLDULK-UHFFFAOYSA-N	CNc1nc(N)c(c(Nc2ccc(Cl)cc2)n1)[N+](=O)[O-]	BroadT	BRD-K25884242	BRD-K25884242-001-01-9	University of New Mexico MLSC	5132371			CNc1nc(N)c(c(Nc2ccc(Cl)cc2)n1)[N+]([O-])=O	InChI=1S/C11H11ClN6O2/c1-14-11-16-9(13)8(18(19)20)10(17-11)15-7-4-2-6(12)3-5-7/h2-5H,1H3,(H4,13,14,15,16,17)	BCKXEJXFSLDULK-UHFFFAOYSA-N	294.063201362							94248
MLS-0390932.0001	LSM-4875	BRD-K37160541	25181240	InChI=1S/C8H3BrClN3O2S2/c9-4-2-1-3-5(6(4)13(14)15)11-8-7(10)12-17-16-8/h1-3H/b11-8+	BCBIJQMMXLMHSB-DHZHZOJOSA-N	[O-][N+](=O)c1c(Br)cccc1\N=C/2\SSN=C2Cl	BroadT	BRD-K37160541	BRD-K37160541-001-01-8	Sanford-Burnham Medical Research Institute	MLS-0390932.0001			[O-][N+](=O)c1c(Br)cccc1\N=c1\ssnc1Cl	InChI=1S/C8H3BrClN3O2S2/c9-4-2-1-3-5(6(4)13(14)15)11-8-7(10)12-17-16-8/h1-3H/b11-8+	BCBIJQMMXLMHSB-DHZHZOJOSA-N	350.853858056							
CHEMBL1617615	LSM-4884	BRD-K71427192	44176347	InChI=1S/C21H28N4O3/c1-12(2)18(25-19(26)13(3)22)21(28)23-14(4)20(27)24-17-11-7-9-15-8-5-6-10-16(15)17/h5-14,18H,22H2,1-4H3,(H,23,28)(H,24,27)(H,25,26)/t13-,14-,18-/m0/s1	NUXOKPCTWFCPBI-DEYYWGMASA-N	CC(C)[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)Nc1cccc2ccccc12	BroadT	BRD-K71427192	BRD-K71427192-014-01-3	Sanford-Burnham Medical Research Institute	MLS-0412114.0001		OC=O	CC(C)[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)Nc1cccc2ccccc12.OC=O	InChI=1S/C21H28N4O3.CH2O2/c1-12(2)18(25-19(26)13(3)22)21(28)23-14(4)20(27)24-17-11-7-9-15-8-5-6-10-16(15)17;2-1-3/h5-14,18H,22H2,1-4H3,(H,23,28)(H,24,27)(H,25,26);1H,(H,2,3)/t13-,14-,18-;/m0./s1	QHUSMUIDCKEUJE-PTUULJOSSA-N	384.216140796							94261, 94261
AB00540134	LSM-4868	BRD-K15475572, SID26736106, SID57287581	16749997	InChI=1S/C21H16N2O2S/c24-20(22-14-15-7-2-1-3-8-15)16-9-6-10-17(13-16)23-21(25)18-11-4-5-12-19(18)26-23/h1-13H,14H2,(H,22,24)	OVZKCFIPHFFYBJ-UHFFFAOYSA-N	O=C(NCc1ccccc1)c2cccc(c2)N3Sc4ccccc4C3=O	BroadT	BRD-K15475572	BRD-K15475572-001-01-8	Sanford-Burnham Medical Research Institute	MLS-0390837.0001			O=C(NCc1ccccc1)c1cccc(c1)-n1sc2ccccc2c1=O	InChI=1S/C21H16N2O2S/c24-20(22-14-15-7-2-1-3-8-15)16-9-6-10-17(13-16)23-21(25)18-11-4-5-12-19(18)26-23/h1-13H,14H2,(H,22,24)	OVZKCFIPHFFYBJ-UHFFFAOYSA-N	360.093248462							94245
BRD-K38947493	LSM-29357		54639312	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19+,20-/m0/s1	CMUIIZXJLAYAHO-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)C3CCCCC3	BroadT	BRD-K38947493	BRD-K38947493-001-01-5	Broad Institute of MIT and Harvard	BRD-K38947493			OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)C1CCCCC1	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19+,20-/m0/s1	CMUIIZXJLAYAHO-ZCNNSNEGSA-N	437.208134244							117908
BRD-K52685199	LSM-29358		54639288	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16+,17-/m0/s1	MXCNPCNUBRZJFA-UAGQMJEPSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2Cl)C=C[C@H]1NC(=O)C3CC3	BroadT	BRD-K52685199	BRD-K52685199-001-01-9	Broad Institute of MIT and Harvard	BRD-K52685199			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2Cl)C=C[C@H]1NC(=O)C1CC1	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16+,17-/m0/s1	MXCNPCNUBRZJFA-UAGQMJEPSA-N	378.134634946							117909
BRD-K85887470	LSM-29359		54639310	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19-,20-/m0/s1	CMUIIZXJLAYAHO-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)C3CCCCC3	BroadT	BRD-K85887470	BRD-K85887470-001-01-2	Broad Institute of MIT and Harvard	BRD-K85887470			OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)C1CCCCC1	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19-,20-/m0/s1	CMUIIZXJLAYAHO-UFYCRDLUSA-N	437.208134244							117910
BRD-K52854560	LSM-29360		54639362	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9-,10-/m0/s1	FSRWVHNAALREIT-GUBZILKMSA-N	CCC(=O)N[C@H]1C=C[C@@H](CC(=O)OC)O[C@H]1CO	BroadT	BRD-K52854560	BRD-K52854560-001-01-2	Broad Institute of MIT and Harvard	BRD-K52854560			CCC(=O)N[C@H]1C=C[C@@H](CC(=O)OC)O[C@H]1CO	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9-,10-/m0/s1	FSRWVHNAALREIT-GUBZILKMSA-N	257.126322718							117911
BRD-K03902789	LSM-29361		54639258	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20+,22+/m0/s1	YPLZJHKSEUDEKT-CZTZKLFOSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)c4ccccn4)O[C@@H]2CO)cc1	BroadT	BRD-K03902789	BRD-K03902789-001-01-4	Broad Institute of MIT and Harvard	BRD-K03902789			COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)-c3ccccn3)O[C@@H]2CO)cc1	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20+,22+/m0/s1	YPLZJHKSEUDEKT-CZTZKLFOSA-N	452.217203436							117912
BRD-K62017257	LSM-29362		54639419	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14+,15+/m0/s1	OYAPENMSDPHQGH-RRFJBIMHSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	BroadT	BRD-K62017257	BRD-K62017257-001-01-2	Broad Institute of MIT and Harvard	BRD-K62017257			CN(C)C(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14+,15+/m0/s1	OYAPENMSDPHQGH-RRFJBIMHSA-N	338.164185436							117913
BRD-K45289917	LSM-29363		54639309	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19+,20-/m1/s1	CMUIIZXJLAYAHO-HSALFYBXSA-N	OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)C3CCCCC3	BroadT	BRD-K45289917	BRD-K45289917-001-01-1	Broad Institute of MIT and Harvard	BRD-K45289917			OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)C1CCCCC1	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19+,20-/m1/s1	CMUIIZXJLAYAHO-HSALFYBXSA-N	437.208134244							117914
MLS003649995	LSM-29364	BRD-K37165790	53382658	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16+,17+/m0/s1	MXCNPCNUBRZJFA-USXIJHARSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2Cl)C=C[C@H]1NC(=O)C3CC3	BroadT	BRD-K37165790	BRD-K37165790-001-01-5	Broad Institute of MIT and Harvard	BRD-K37165790			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2Cl)C=C[C@H]1NC(=O)C1CC1	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16+,17+/m0/s1	MXCNPCNUBRZJFA-USXIJHARSA-N	378.134634946							117915
BRD-K48052543	LSM-29365		54639172	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18-,19-/m0/s1	RRSRGJAXJRQFPD-WDSOQIARSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K48052543	BRD-K48052543-001-01-2	Broad Institute of MIT and Harvard	BRD-K48052543			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18-,19-/m0/s1	RRSRGJAXJRQFPD-WDSOQIARSA-N	444.173035558							117916
BRD-K36352298	LSM-29366		54639428	InChI=1S/C13H25N5O2/c1-17(2)7-10-8-18(16-15-10)6-5-11-3-4-12(14)13(9-19)20-11/h8,11-13,19H,3-7,9,14H2,1-2H3/t11-,12-,13+/m1/s1	RSSFQYFOHBQLRO-UPJWGTAASA-N	CN(C)Cc1cn(CC[C@H]2CC[C@@H](N)[C@H](CO)O2)nn1	BroadT	BRD-K36352298	BRD-K36352298-001-01-7	Broad Institute of MIT and Harvard	BRD-K36352298			CN(C)Cc1cn(CC[C@H]2CC[C@@H](N)[C@H](CO)O2)nn1	InChI=1S/C13H25N5O2/c1-17(2)7-10-8-18(16-15-10)6-5-11-3-4-12(14)13(9-19)20-11/h8,11-13,19H,3-7,9,14H2,1-2H3/t11-,12-,13+/m1/s1	RSSFQYFOHBQLRO-UPJWGTAASA-N	283.20082509							117917
BRD-K66282601	LSM-29367		54639417	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19+/m1/s1	YXHXOQQNNYPEQC-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(F)cc2)CC[C@H]1NC(=O)NC3CCCC3	BroadT	BRD-K66282601	BRD-K66282601-001-01-1	Broad Institute of MIT and Harvard	BRD-K66282601			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(F)cc2)CC[C@H]1NC(=O)NC1CCCC1	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19+/m1/s1	YXHXOQQNNYPEQC-QRVBRYPASA-N	407.22203467							117918
BRD-K79807180	LSM-29368		54639238	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17-,18+/m0/s1	AGYKQGZRDSIEQP-OKZBNKHCSA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K79807180	BRD-K79807180-001-01-9	Broad Institute of MIT and Harvard	BRD-K79807180			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)C1CCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17-,18+/m0/s1	AGYKQGZRDSIEQP-OKZBNKHCSA-N	395.242021186							117919
BRD-K20368781	LSM-29369		54639478	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25+,26+/m1/s1	CHMWYEVRTWMFCL-RZFJZAQRSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)Nc4ccccc4F	BroadT	BRD-K20368781	BRD-K20368781-001-01-5	Broad Institute of MIT and Harvard	BRD-K20368781			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25+,26+/m1/s1	CHMWYEVRTWMFCL-RZFJZAQRSA-N	489.206384606							117920
BRD-K61315077	LSM-29370		54639384	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15-/m0/s1	VFOAUUBLSWMNNG-KKUMJFAQSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)NCCCN(C)C)O[C@H]1CO	BroadT	BRD-K61315077	BRD-K61315077-001-01-9	Broad Institute of MIT and Harvard	BRD-K61315077			CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)NCCCN(C)C)O[C@H]1CO	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15-/m0/s1	VFOAUUBLSWMNNG-KKUMJFAQSA-N	358.258005608							117921
BRD-K87794979	LSM-29371		54639278	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16-,17+/m0/s1	SFXBWBNLRUAJJR-YESZJQIVSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K87794979	BRD-K87794979-001-01-4	Broad Institute of MIT and Harvard	BRD-K87794979			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16-,17+/m0/s1	SFXBWBNLRUAJJR-YESZJQIVSA-N	395.185649162							117922
BRD-K94088431	LSM-29372		54639342	InChI=1S/C17H27N3O5S/c1-2-26(23,24)19-10-8-14-6-7-15(16(12-21)25-14)20-17(22)11-13-5-3-4-9-18-13/h3-5,9,14-16,19,21H,2,6-8,10-12H2,1H3,(H,20,22)/t14-,15+,16-/m0/s1	ATYYOVKYGVPSBZ-XHSDSOJGSA-N	CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1	BroadT	BRD-K94088431	BRD-K94088431-001-01-4	Broad Institute of MIT and Harvard	BRD-K94088431			CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1	InChI=1S/C17H27N3O5S/c1-2-26(23,24)19-10-8-14-6-7-15(16(12-21)25-14)20-17(22)11-13-5-3-4-9-18-13/h3-5,9,14-16,19,21H,2,6-8,10-12H2,1H3,(H,20,22)/t14-,15+,16-/m0/s1	ATYYOVKYGVPSBZ-XHSDSOJGSA-N	385.167141684							117923
BRD-K55453160	LSM-29373		54639347	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16-,17+/m0/s1	SVHHNONGWSEYCY-YESZJQIVSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K55453160	BRD-K55453160-001-01-4	Broad Institute of MIT and Harvard	BRD-K55453160			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16-,17+/m0/s1	SVHHNONGWSEYCY-YESZJQIVSA-N	378.159100056							117924
BRD-K77814566	LSM-29374		54639320	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20+,21-/m0/s1	AOROBJTWHRZKJU-TYPHKJRUSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CCNC(=O)Cc3ccccn3)O[C@H]2CO	BroadT	BRD-K77814566	BRD-K77814566-001-01-1	Broad Institute of MIT and Harvard	BRD-K77814566			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNC(=O)Cc2ccccn2)O[C@H]1CO	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20+,21-/m0/s1	AOROBJTWHRZKJU-TYPHKJRUSA-N	463.177706368							117925
BRD-K82126187	LSM-29375		54639370	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17-,18+/m1/s1	OCKURQXTXDTUJZ-NXHRZFHOSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2F)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K82126187	BRD-K82126187-001-01-2	Broad Institute of MIT and Harvard	BRD-K82126187			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2F)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17-,18+/m1/s1	OCKURQXTXDTUJZ-NXHRZFHOSA-N	459.1839346							117926
BRD-K62460895	LSM-29376		54639329	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9+,10+/m0/s1	RKZMUCFCOIAGGT-IVZWLZJFSA-N	CCC(=O)N[C@@H]1CC[C@@H](CC(=O)OC)O[C@@H]1CO	BroadT	BRD-K62460895	BRD-K62460895-001-01-2	Broad Institute of MIT and Harvard	BRD-K62460895			CCC(=O)N[C@@H]1CC[C@@H](CC(=O)OC)O[C@@H]1CO	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9+,10+/m0/s1	RKZMUCFCOIAGGT-IVZWLZJFSA-N	259.141972782							117927
BRD-K11089039	LSM-29377		54639245	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17-,19-/m0/s1	UBYVOLAQIVZNTP-IEZWGBDMSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)CC[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K11089039	BRD-K11089039-001-01-8	Broad Institute of MIT and Harvard	BRD-K11089039			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17-,19-/m0/s1	UBYVOLAQIVZNTP-IEZWGBDMSA-N	434.176561688							117928
BRD-K44458042	LSM-29378		54639480	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25-,26+/m0/s1	CHMWYEVRTWMFCL-UCGXPXSYSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)Nc4ccccc4F	BroadT	BRD-K44458042	BRD-K44458042-001-01-1	Broad Institute of MIT and Harvard	BRD-K44458042			OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25-,26+/m0/s1	CHMWYEVRTWMFCL-UCGXPXSYSA-N	489.206384606							117929
BRD-K15273135	LSM-29379		54639436	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16-,18+/m0/s1	BMWSYQFQMBOYKL-XYJFISCASA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)N3CCN(C)CC3)O[C@@H]2CO	BroadT	BRD-K15273135	BRD-K15273135-001-01-7	Broad Institute of MIT and Harvard	BRD-K15273135			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16-,18+/m0/s1	BMWSYQFQMBOYKL-XYJFISCASA-N	441.193356432							117930
MLS003649933	LSM-29380	BRD-K12867546, SID125305245	53382601	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9+,10-/m1/s1	FSRWVHNAALREIT-KXUCPTDWSA-N	CCC(=O)N[C@H]1C=C[C@H](CC(=O)OC)O[C@@H]1CO	BroadT	BRD-K12867546	BRD-K12867546-001-01-2	Broad Institute of MIT and Harvard	BRD-K12867546			CCC(=O)N[C@H]1C=C[C@H](CC(=O)OC)O[C@@H]1CO	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9+,10-/m1/s1	FSRWVHNAALREIT-KXUCPTDWSA-N	257.126322718							117931
BRD-K58844095	LSM-29381		54639215	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23-,24+/m0/s1	YALXHXGZPIMCNA-KMDXXIMOSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)C4CCOCC4	BroadT	BRD-K58844095	BRD-K58844095-001-01-1	Broad Institute of MIT and Harvard	BRD-K58844095			OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23-,24+/m0/s1	YALXHXGZPIMCNA-KMDXXIMOSA-N	450.21547208							117932
BRD-K15160749	LSM-29382		54639196	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21-/m0/s1	LTXSPIFYGNBEMC-WMQCIHAUSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K15160749	BRD-K15160749-001-01-4	Broad Institute of MIT and Harvard	BRD-K15160749			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21-/m0/s1	LTXSPIFYGNBEMC-WMQCIHAUSA-N	485.184811986							117933
BRD-K98513899	LSM-29383		54639348	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16-,17+/m1/s1	SVHHNONGWSEYCY-ZACQAIPSSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K98513899	BRD-K98513899-001-01-2	Broad Institute of MIT and Harvard	BRD-K98513899			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16-,17+/m1/s1	SVHHNONGWSEYCY-ZACQAIPSSA-N	378.159100056							117934
BRD-K97086564	LSM-29384		54639199	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19-,20-/m1/s1	HHODKCKBDGVCKH-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2)C=C[C@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K97086564	BRD-K97086564-001-01-4	Broad Institute of MIT and Harvard	BRD-K97086564			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2)C=C[C@H]1NC(=O)NC1CCCCC1	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19-,20-/m1/s1	HHODKCKBDGVCKH-VAMGGRTRSA-N	401.231456502							117935
BRD-K06251362	LSM-29385		54639360	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9+,10+/m1/s1	FSRWVHNAALREIT-UTLUCORTSA-N	CCC(=O)N[C@H]1C=C[C@H](CC(=O)OC)O[C@H]1CO	BroadT	BRD-K06251362	BRD-K06251362-001-01-8	Broad Institute of MIT and Harvard	BRD-K06251362			CCC(=O)N[C@H]1C=C[C@H](CC(=O)OC)O[C@H]1CO	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9+,10+/m1/s1	FSRWVHNAALREIT-UTLUCORTSA-N	257.126322718							117936
BRD-K47988839	LSM-29386		54639456	InChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24-,26-/m0/s1	XNNPHUWWMNRDCG-GVUKDKGQSA-N	COc1ccccc1NC(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@H]2CO	BroadT	BRD-K47988839	BRD-K47988839-001-01-1	Broad Institute of MIT and Harvard	BRD-K47988839			COc1ccccc1NC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO	InChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24-,26-/m0/s1	XNNPHUWWMNRDCG-GVUKDKGQSA-N	493.25767125							117937
CHEMBL2136852	LSM-29387	BRD-K86805916, SID131435592	54639304	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19+,21-/m0/s1	KSHGYKMGUCEKKM-SCWSEQNSSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3ccccn3)CC[C@H]1NS(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K86805916	BRD-K86805916-001-01-5	Broad Institute of MIT and Harvard	BRD-K86805916			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2ccccn2)CC[C@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19+,21-/m0/s1	KSHGYKMGUCEKKM-SCWSEQNSSA-N	477.123752698							117938
BRD-K08431704	LSM-29388		54639338	InChI=1S/C17H27N3O5S/c1-2-26(23,24)19-10-8-14-6-7-15(16(12-21)25-14)20-17(22)11-13-5-3-4-9-18-13/h3-5,9,14-16,19,21H,2,6-8,10-12H2,1H3,(H,20,22)/t14-,15+,16+/m1/s1	ATYYOVKYGVPSBZ-PMPSAXMXSA-N	CCS(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@H](CO)O1	BroadT	BRD-K08431704	BRD-K08431704-001-01-1	Broad Institute of MIT and Harvard	BRD-K08431704			CCS(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@H](CO)O1	InChI=1S/C17H27N3O5S/c1-2-26(23,24)19-10-8-14-6-7-15(16(12-21)25-14)20-17(22)11-13-5-3-4-9-18-13/h3-5,9,14-16,19,21H,2,6-8,10-12H2,1H3,(H,20,22)/t14-,15+,16+/m1/s1	ATYYOVKYGVPSBZ-PMPSAXMXSA-N	385.167141684							117939
BRD-K42271016	LSM-29389		54639432	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16+,18+/m0/s1	BMWSYQFQMBOYKL-LZLYRXPVSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)N3CCN(C)CC3)O[C@@H]2CO	BroadT	BRD-K42271016	BRD-K42271016-001-01-2	Broad Institute of MIT and Harvard	BRD-K42271016			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16+,18+/m0/s1	BMWSYQFQMBOYKL-LZLYRXPVSA-N	441.193356432							117940
BRD-K56075657	LSM-29390		54639462	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23+/m0/s1	HUTGYGSTODGUGG-YTFSRNRJSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K56075657	BRD-K56075657-001-01-4	Broad Institute of MIT and Harvard	BRD-K56075657			Cc1noc(C)c1NC(=O)N[C@@H]1CC[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23+/m0/s1	HUTGYGSTODGUGG-YTFSRNRJSA-N	478.2216201							117941
BRD-K22940496	LSM-29391		54639356	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18-,20-/m0/s1	BQBXUVFZTSPBJE-QRFRQXIXSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)C(C)C)O[C@H]2CO	BroadT	BRD-K22940496	BRD-K22940496-001-01-5	Broad Institute of MIT and Harvard	BRD-K22940496			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)C(C)C)O[C@H]1CO	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18-,20-/m0/s1	BQBXUVFZTSPBJE-QRFRQXIXSA-N	438.19369079							117942
BRD-K73025852	LSM-29392		54639413	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19-/m1/s1	YXHXOQQNNYPEQC-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(F)cc2)CC[C@H]1NC(=O)NC3CCCC3	BroadT	BRD-K73025852	BRD-K73025852-001-01-1	Broad Institute of MIT and Harvard	BRD-K73025852			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(F)cc2)CC[C@H]1NC(=O)NC1CCCC1	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19-/m1/s1	YXHXOQQNNYPEQC-GUDVDZBRSA-N	407.22203467							117943
BRD-K08730634	LSM-29393		54639388	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15-/m0/s1	VFOAUUBLSWMNNG-ZNMIVQPWSA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CC(=O)NCCCN(C)C)O[C@H]1CO	BroadT	BRD-K08730634	BRD-K08730634-001-01-1	Broad Institute of MIT and Harvard	BRD-K08730634			CC(C)NC(=O)N[C@@H]1CC[C@@H](CC(=O)NCCCN(C)C)O[C@H]1CO	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15-/m0/s1	VFOAUUBLSWMNNG-ZNMIVQPWSA-N	358.258005608							117944
BRD-K11251396	LSM-29394		54639343	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16+,17+/m0/s1	SVHHNONGWSEYCY-GVDBMIGSSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K11251396	BRD-K11251396-001-01-1	Broad Institute of MIT and Harvard	BRD-K11251396			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16+,17+/m0/s1	SVHHNONGWSEYCY-GVDBMIGSSA-N	378.159100056							117945
BRD-K24502602	LSM-29395		54639296	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20+,21-/m0/s1	ZCGNSQNJACZJHF-HBMCJLEFSA-N	OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K24502602	BRD-K24502602-001-01-2	Broad Institute of MIT and Harvard	BRD-K24502602			OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20+,21-/m0/s1	ZCGNSQNJACZJHF-HBMCJLEFSA-N	432.273655672							117946
BRD-K33257311	LSM-29396		54639389	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18+,19+/m0/s1	JFCILRCMDYZKAM-IPMKNSEASA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCC2)C=C[C@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K33257311	BRD-K33257311-001-01-4	Broad Institute of MIT and Harvard	BRD-K33257311			OC[C@H]1O[C@H](CC(=O)NCCN2CCCC2)C=C[C@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18+,19+/m0/s1	JFCILRCMDYZKAM-IPMKNSEASA-N	420.217283648							117947
BRD-K67580046-001-01-0	LSM-29397	BRD-K67580046	54639186	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25-,26+/m1/s1	BTASCBMIIFGVQJ-ARMFNRFLSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@H]2CO	BroadT	BRD-K67580046	BRD-K67580046-001-01-0	Broad Institute of MIT and Harvard	BRD-K67580046			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25-,26+/m1/s1	BTASCBMIIFGVQJ-ARMFNRFLSA-N	498.218842898							117948
BRD-K30220159	LSM-29398		54639469	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23-/m0/s1	HUTGYGSTODGUGG-ZRBLBEILSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K30220159	BRD-K30220159-001-01-0	Broad Institute of MIT and Harvard	BRD-K30220159			Cc1noc(C)c1NC(=O)N[C@@H]1CC[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23-/m0/s1	HUTGYGSTODGUGG-ZRBLBEILSA-N	478.2216201							117949
CHEMBL2359735	LSM-29399	BRD-K06816455, SID131435724	54639435	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16-,18-/m0/s1	BMWSYQFQMBOYKL-BQFCYCMXSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)N3CCN(C)CC3)O[C@H]2CO	BroadT	BRD-K06816455	BRD-K06816455-001-01-6	Broad Institute of MIT and Harvard	BRD-K06816455			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16-,18-/m0/s1	BMWSYQFQMBOYKL-BQFCYCMXSA-N	441.193356432							117950
BRD-K26866198	LSM-29400		54639380	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17+,18-/m0/s1	NDIHUDUSPABKLT-JQHSSLGASA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K26866198	BRD-K26866198-001-01-9	Broad Institute of MIT and Harvard	BRD-K26866198			OC[C@@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17+,18-/m0/s1	NDIHUDUSPABKLT-JQHSSLGASA-N	436.121668702							117951
BRD-K26508889	LSM-29401		54639313	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20+,21+/m0/s1	AOROBJTWHRZKJU-CEWLAPEOSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CCNC(=O)Cc3ccccn3)O[C@@H]2CO	BroadT	BRD-K26508889	BRD-K26508889-001-01-1	Broad Institute of MIT and Harvard	BRD-K26508889			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNC(=O)Cc2ccccn2)O[C@@H]1CO	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20+,21+/m0/s1	AOROBJTWHRZKJU-CEWLAPEOSA-N	463.177706368							117952
BRD-K90934902	LSM-29402		54639235	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17+,18+/m1/s1	AGYKQGZRDSIEQP-SQNIBIBYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K90934902	BRD-K90934902-001-01-3	Broad Institute of MIT and Harvard	BRD-K90934902			OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)C1CCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17+,18+/m1/s1	AGYKQGZRDSIEQP-SQNIBIBYSA-N	395.242021186							117953
BRD-K13488816	LSM-29403		54639396	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18+,19-/m0/s1	JFCILRCMDYZKAM-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCC2)C=C[C@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K13488816	BRD-K13488816-001-01-9	Broad Institute of MIT and Harvard	BRD-K13488816			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCC2)C=C[C@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18+,19-/m0/s1	JFCILRCMDYZKAM-OTWHNJEPSA-N	420.217283648							117954
BRD-K20069402	LSM-29404		54639424	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14-,15+/m1/s1	OYAPENMSDPHQGH-KFWWJZLASA-N	CN(C)C(=O)C[C@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	BroadT	BRD-K20069402	BRD-K20069402-001-01-8	Broad Institute of MIT and Harvard	BRD-K20069402			CN(C)C(=O)C[C@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14-,15+/m1/s1	OYAPENMSDPHQGH-KFWWJZLASA-N	338.164185436							117955
CHEMBL2140028	LSM-29405	BRD-K79555018, SID131435591	54639303	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19+,21-/m1/s1	KSHGYKMGUCEKKM-LKUPVBHCSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3ccccn3)CC[C@@H]1NS(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K79555018	BRD-K79555018-001-01-2	Broad Institute of MIT and Harvard	BRD-K79555018			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2ccccn2)CC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19+,21-/m1/s1	KSHGYKMGUCEKKM-LKUPVBHCSA-N	477.123752698							117956
BRD-K08995282	LSM-29406		54639476	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18+,21-/m0/s1	SPUVHZZOUOXYGN-UEXGIBASSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K08995282	BRD-K08995282-001-01-5	Broad Institute of MIT and Harvard	BRD-K08995282			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18+,21-/m0/s1	SPUVHZZOUOXYGN-UEXGIBASSA-N	441.189985614							117957
BRD-K06842972	LSM-29407		54639408	InChI=1S/C17H25Cl2N3O5S/c1-2-28(25,26)20-6-5-14-3-4-15(16(10-23)27-14)22-17(24)21-13-8-11(18)7-12(19)9-13/h7-9,14-16,20,23H,2-6,10H2,1H3,(H2,21,22,24)/t14-,15+,16-/m1/s1	SSRDXPKUDSQVJV-OWCLPIDISA-N	CCS(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)Nc2cc(Cl)cc(Cl)c2)[C@@H](CO)O1	BroadT	BRD-K06842972	BRD-K06842972-001-01-6	Broad Institute of MIT and Harvard	BRD-K06842972			CCS(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)Nc2cc(Cl)cc(Cl)c2)[C@@H](CO)O1	InChI=1S/C17H25Cl2N3O5S/c1-2-28(25,26)20-6-5-14-3-4-15(16(10-23)27-14)22-17(24)21-13-8-11(18)7-12(19)9-13/h7-9,14-16,20,23H,2-6,10H2,1H3,(H2,21,22,24)/t14-,15+,16-/m1/s1	SSRDXPKUDSQVJV-OWCLPIDISA-N	453.08919704							117958
BRD-K11687039	LSM-29408		54639367	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17+,18+/m1/s1	OCKURQXTXDTUJZ-NJAFHUGGSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2F)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K11687039	BRD-K11687039-001-01-9	Broad Institute of MIT and Harvard	BRD-K11687039			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2F)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17+,18+/m1/s1	OCKURQXTXDTUJZ-NJAFHUGGSA-N	459.1839346							117959
BRD-K97224540	LSM-29409		54639189	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21+/m1/s1	LTXSPIFYGNBEMC-QMMLZNLJSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K97224540	BRD-K97224540-001-01-0	Broad Institute of MIT and Harvard	BRD-K97224540			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21+/m1/s1	LTXSPIFYGNBEMC-QMMLZNLJSA-N	485.184811986							117960
BRD-K87080934	LSM-29410		54639197	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19+,20+/m0/s1	HHODKCKBDGVCKH-XUVXKRRUSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2)C=C[C@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K87080934	BRD-K87080934-001-01-2	Broad Institute of MIT and Harvard	BRD-K87080934			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2)C=C[C@H]1NC(=O)NC1CCCCC1	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19+,20+/m0/s1	HHODKCKBDGVCKH-XUVXKRRUSA-N	401.231456502							117961
BRD-K37336973	LSM-29411		54639273	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12+,13-/m0/s1	GIRVAELHWNMQPN-XQQFMLRXSA-N	CC(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CC2)O[C@H]1CO	BroadT	BRD-K37336973	BRD-K37336973-001-01-1	Broad Institute of MIT and Harvard	BRD-K37336973			CC(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CC2)O[C@H]1CO	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12+,13-/m0/s1	GIRVAELHWNMQPN-XQQFMLRXSA-N	284.173607268							117962
CHEMBL2358825	LSM-29412	BRD-K90918886, SID131435469	54639182	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25+,26+/m0/s1	BTASCBMIIFGVQJ-SKBVVQJISA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@@H]2CO	BroadT	BRD-K90918886	BRD-K90918886-001-01-6	Broad Institute of MIT and Harvard	BRD-K90918886			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@@H]1CO	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25+,26+/m0/s1	BTASCBMIIFGVQJ-SKBVVQJISA-N	498.218842898							117963
BRD-K31952722	LSM-29413		54639426	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14+,15-/m0/s1	OYAPENMSDPHQGH-ZNMIVQPWSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	BroadT	BRD-K31952722	BRD-K31952722-001-01-5	Broad Institute of MIT and Harvard	BRD-K31952722			CN(C)C(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14+,15-/m0/s1	OYAPENMSDPHQGH-ZNMIVQPWSA-N	338.164185436							117964
BRD-K63624341	LSM-29414		54639287	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16+,17-/m1/s1	MXCNPCNUBRZJFA-HYVNUMGLSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)C=C[C@@H]1NC(=O)C3CC3	BroadT	BRD-K63624341	BRD-K63624341-001-01-2	Broad Institute of MIT and Harvard	BRD-K63624341			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16+,17-/m1/s1	MXCNPCNUBRZJFA-HYVNUMGLSA-N	378.134634946							117965
BRD-K37866276	LSM-29415		54639306	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19+,20+/m1/s1	CMUIIZXJLAYAHO-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)C3CCCCC3	BroadT	BRD-K37866276	BRD-K37866276-001-01-1	Broad Institute of MIT and Harvard	BRD-K37866276			OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)C1CCCCC1	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19+,20+/m1/s1	CMUIIZXJLAYAHO-AABGKKOBSA-N	437.208134244							117966
BRD-K05118986-001-01-6	LSM-29416	BRD-K05118986	54639164	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18-,19+/m1/s1	FKDHCSBIQDWEMT-QRQLOZEOSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K05118986	BRD-K05118986-001-01-6	Broad Institute of MIT and Harvard	BRD-K05118986			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18-,19+/m1/s1	FKDHCSBIQDWEMT-QRQLOZEOSA-N	424.176499758							117967
BRD-K30252238	LSM-29417		54639254	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17-,20+/m1/s1	JOZKTRAUEBYZEE-HLIPFELVSA-N	CN(C)Cc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)nn1	BroadT	BRD-K30252238	BRD-K30252238-001-01-8	Broad Institute of MIT and Harvard	BRD-K30252238			CN(C)Cc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)nn1	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17-,20+/m1/s1	JOZKTRAUEBYZEE-HLIPFELVSA-N	446.22776812							117968
BRD-K55135464	LSM-29418		54639334	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9-,10+/m1/s1	RKZMUCFCOIAGGT-BBBLOLIVSA-N	CCC(=O)N[C@@H]1CC[C@H](CC(=O)OC)O[C@H]1CO	BroadT	BRD-K55135464	BRD-K55135464-001-01-0	Broad Institute of MIT and Harvard	BRD-K55135464			CCC(=O)N[C@@H]1CC[C@H](CC(=O)OC)O[C@H]1CO	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9-,10+/m1/s1	RKZMUCFCOIAGGT-BBBLOLIVSA-N	259.141972782							117969
BRD-K61429332-001-01-9	LSM-29419	BRD-K61429332	54639165	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18+,19-/m1/s1	FKDHCSBIQDWEMT-NZSAHSFTSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K61429332	BRD-K61429332-001-01-9	Broad Institute of MIT and Harvard	BRD-K61429332			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18+,19-/m1/s1	FKDHCSBIQDWEMT-NZSAHSFTSA-N	424.176499758							117970
BRD-K12866026	LSM-29420		54639446	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15-,18+/m0/s1	PYWNIQJEFPCHIF-RLFYNMQTSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CC2)CC[C@@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K12866026	BRD-K12866026-001-01-3	Broad Institute of MIT and Harvard	BRD-K12866026			OC[C@H]1O[C@H](CCNC(=O)C2CC2)CC[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15-,18+/m0/s1	PYWNIQJEFPCHIF-RLFYNMQTSA-N	405.189985614							117971
BRD-K72317601	LSM-29421		54639466	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23+/m0/s1	HUTGYGSTODGUGG-RJGXRXQPSA-N	Cc1onc(C)c1NC(=O)N[C@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K72317601	BRD-K72317601-001-01-7	Broad Institute of MIT and Harvard	BRD-K72317601			Cc1noc(C)c1NC(=O)N[C@H]1CC[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23+/m0/s1	HUTGYGSTODGUGG-RJGXRXQPSA-N	478.2216201							117972
BRD-K44760023	LSM-29422		54639467	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23+/m1/s1	HUTGYGSTODGUGG-ZLNRFVROSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K44760023	BRD-K44760023-001-01-3	Broad Institute of MIT and Harvard	BRD-K44760023			Cc1noc(C)c1NC(=O)N[C@@H]1CC[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23+/m1/s1	HUTGYGSTODGUGG-ZLNRFVROSA-N	478.2216201							117973
BRD-K83902026	LSM-29423		54639289	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20+,21+/m0/s1	ZCGNSQNJACZJHF-PWRODBHTSA-N	OC[C@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K83902026	BRD-K83902026-001-01-0	Broad Institute of MIT and Harvard	BRD-K83902026			OC[C@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20+,21+/m0/s1	ZCGNSQNJACZJHF-PWRODBHTSA-N	432.273655672							117974
BRD-K73125678	LSM-29424		54639352	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18+,20+/m1/s1	BQBXUVFZTSPBJE-KPFFTGBYSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CCn3cc(nn3)C(C)C)O[C@H]2CO	BroadT	BRD-K73125678	BRD-K73125678-001-01-1	Broad Institute of MIT and Harvard	BRD-K73125678			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCn2cc(nn2)C(C)C)O[C@H]1CO	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18+,20+/m1/s1	BQBXUVFZTSPBJE-KPFFTGBYSA-N	438.19369079							117975
BRD-K58217579	LSM-29425		54639292	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20-,21-/m1/s1	ZCGNSQNJACZJHF-NJDAHSKKSA-N	OC[C@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K58217579	BRD-K58217579-001-01-5	Broad Institute of MIT and Harvard	BRD-K58217579			OC[C@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20-,21-/m1/s1	ZCGNSQNJACZJHF-NJDAHSKKSA-N	432.273655672							117976
BRD-K14211116	LSM-29426		54639269	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12-,13+/m1/s1	GIRVAELHWNMQPN-UPJWGTAASA-N	CC(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CC2)O[C@H]1CO	BroadT	BRD-K14211116	BRD-K14211116-001-01-1	Broad Institute of MIT and Harvard	BRD-K14211116			CC(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CC2)O[C@H]1CO	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12-,13+/m1/s1	GIRVAELHWNMQPN-UPJWGTAASA-N	284.173607268							117977
BRD-K43484052	LSM-29427		54639190	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21+/m0/s1	LTXSPIFYGNBEMC-IOMROCGXSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K43484052	BRD-K43484052-001-01-5	Broad Institute of MIT and Harvard	BRD-K43484052			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21+/m0/s1	LTXSPIFYGNBEMC-IOMROCGXSA-N	485.184811986							117978
BRD-K41655405	LSM-29428		54639471	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18+,21+/m0/s1	SPUVHZZOUOXYGN-WAOWUJCRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K41655405	BRD-K41655405-001-01-6	Broad Institute of MIT and Harvard	BRD-K41655405			OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18+,21+/m0/s1	SPUVHZZOUOXYGN-WAOWUJCRSA-N	441.189985614							117979
BRD-K50931403	LSM-29429		54639359	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9+,10+/m0/s1	FSRWVHNAALREIT-IVZWLZJFSA-N	CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)OC)O[C@@H]1CO	BroadT	BRD-K50931403	BRD-K50931403-001-01-1	Broad Institute of MIT and Harvard	BRD-K50931403			CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)OC)O[C@@H]1CO	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9+,10+/m0/s1	FSRWVHNAALREIT-IVZWLZJFSA-N	257.126322718							117980
BRD-K44244207	LSM-29430		54639178	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18-,19+/m0/s1	UTHIGKUIGCKQQD-GBESFXJTSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C=C[C@@H]1NC(=O)Nc3ccccc3	BroadT	BRD-K44244207	BRD-K44244207-001-01-6	Broad Institute of MIT and Harvard	BRD-K44244207			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C=C[C@@H]1NC(=O)Nc1ccccc1	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18-,19+/m0/s1	UTHIGKUIGCKQQD-GBESFXJTSA-N	396.179755288							117981
BRD-K85474153	LSM-29431		54639420	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14+,15+/m1/s1	OYAPENMSDPHQGH-ILXRZTDVSA-N	CN(C)C(=O)C[C@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	BroadT	BRD-K85474153	BRD-K85474153-001-01-3	Broad Institute of MIT and Harvard	BRD-K85474153			CN(C)C(=O)C[C@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14+,15+/m1/s1	OYAPENMSDPHQGH-ILXRZTDVSA-N	338.164185436							117982
BRD-K72933250	LSM-29432		54639272	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12-,13+/m0/s1	GIRVAELHWNMQPN-RWMBFGLXSA-N	CC(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CC2)O[C@@H]1CO	BroadT	BRD-K72933250	BRD-K72933250-001-01-5	Broad Institute of MIT and Harvard	BRD-K72933250			CC(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CC2)O[C@@H]1CO	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12-,13+/m0/s1	GIRVAELHWNMQPN-RWMBFGLXSA-N	284.173607268							117983
BRD-K49945344	LSM-29433		54639253	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17-,20+/m0/s1	JOZKTRAUEBYZEE-ABSDTBQOSA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)nn1	BroadT	BRD-K49945344	BRD-K49945344-001-01-7	Broad Institute of MIT and Harvard	BRD-K49945344			CN(C)Cc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)nn1	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17-,20+/m0/s1	JOZKTRAUEBYZEE-ABSDTBQOSA-N	446.22776812							117984
BRD-K08658757	LSM-29434		54639204	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19+,20-/m0/s1	HHODKCKBDGVCKH-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2)C=C[C@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K08658757	BRD-K08658757-001-01-5	Broad Institute of MIT and Harvard	BRD-K08658757			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2)C=C[C@H]1NC(=O)NC1CCCCC1	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19+,20-/m0/s1	HHODKCKBDGVCKH-ZCNNSNEGSA-N	401.231456502							117985
BRD-K28950508	LSM-29435		54639349	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16+,17-/m1/s1	SVHHNONGWSEYCY-IXDOHACOSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K28950508	BRD-K28950508-001-01-4	Broad Institute of MIT and Harvard	BRD-K28950508			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16+,17-/m1/s1	SVHHNONGWSEYCY-IXDOHACOSA-N	378.159100056							117986
BRD-K74445272	LSM-29436		54639231	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22-,23+/m1/s1	UBQLRBWDFCIPMC-MZYLBHOOSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2CO	BroadT	BRD-K74445272	BRD-K74445272-001-01-2	Broad Institute of MIT and Harvard	BRD-K74445272			COc1cccc(c1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22-,23+/m1/s1	UBQLRBWDFCIPMC-MZYLBHOOSA-N	472.166807326							117987
BRD-K86002795	LSM-29437		54639305	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19+,20+/m0/s1	CMUIIZXJLAYAHO-XUVXKRRUSA-N	OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)C3CCCCC3	BroadT	BRD-K86002795	BRD-K86002795-001-01-5	Broad Institute of MIT and Harvard	BRD-K86002795			OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)C1CCCCC1	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19+,20+/m0/s1	CMUIIZXJLAYAHO-XUVXKRRUSA-N	437.208134244							117988
BRD-K66985689	LSM-29438		54639376	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17-,18-/m1/s1	NDIHUDUSPABKLT-KBAYOESNSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K66985689	BRD-K66985689-001-01-4	Broad Institute of MIT and Harvard	BRD-K66985689			OC[C@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17-,18-/m1/s1	NDIHUDUSPABKLT-KBAYOESNSA-N	436.121668702							117989
BRD-K15099225	LSM-29439		54639311	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19-,20+/m0/s1	CMUIIZXJLAYAHO-SLFFLAALSA-N	OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)C3CCCCC3	BroadT	BRD-K15099225	BRD-K15099225-001-01-7	Broad Institute of MIT and Harvard	BRD-K15099225			OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)C1CCCCC1	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19-,20+/m0/s1	CMUIIZXJLAYAHO-SLFFLAALSA-N	437.208134244							117990
BRD-K34117117	LSM-29440		54639218	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23+,24-/m1/s1	YALXHXGZPIMCNA-TZRRMPRUSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)C4CCOCC4	BroadT	BRD-K34117117	BRD-K34117117-001-01-5	Broad Institute of MIT and Harvard	BRD-K34117117			OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23+,24-/m1/s1	YALXHXGZPIMCNA-TZRRMPRUSA-N	450.21547208							117991
BRD-K42769174	LSM-29441		54639394	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18-,19+/m1/s1	JFCILRCMDYZKAM-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCC2)C=C[C@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K42769174	BRD-K42769174-001-01-3	Broad Institute of MIT and Harvard	BRD-K42769174			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCC2)C=C[C@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18-,19+/m1/s1	JFCILRCMDYZKAM-QRVBRYPASA-N	420.217283648							117992
BRD-K13299646	LSM-29442		54639193	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21+/m0/s1	LTXSPIFYGNBEMC-DZFGPLHGSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K13299646	BRD-K13299646-001-01-6	Broad Institute of MIT and Harvard	BRD-K13299646			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21+/m0/s1	LTXSPIFYGNBEMC-DZFGPLHGSA-N	485.184811986							117993
BRD-K13859368	LSM-29443		54639451	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16+,17-/m1/s1	UXNIMKIHWHNNEY-HYVNUMGLSA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K13859368	BRD-K13859368-001-01-3	Broad Institute of MIT and Harvard	BRD-K13859368			OC[C@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16+,17-/m1/s1	UXNIMKIHWHNNEY-HYVNUMGLSA-N	400.14682081							117994
BRD-K46014233	LSM-29444		54639314	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20+,21+/m1/s1	AOROBJTWHRZKJU-GIVPXCGWSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CCNC(=O)Cc3ccccn3)O[C@H]2CO	BroadT	BRD-K46014233	BRD-K46014233-001-01-9	Broad Institute of MIT and Harvard	BRD-K46014233			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCNC(=O)Cc2ccccn2)O[C@H]1CO	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20+,21+/m1/s1	AOROBJTWHRZKJU-GIVPXCGWSA-N	463.177706368							117995
BRD-K61386375	LSM-29445		54639470	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18+,21+/m1/s1	SPUVHZZOUOXYGN-LQWHRVPQSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K61386375	BRD-K61386375-001-01-9	Broad Institute of MIT and Harvard	BRD-K61386375			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18+,21+/m1/s1	SPUVHZZOUOXYGN-LQWHRVPQSA-N	441.189985614							117996
BRD-K73604422	LSM-29446		54639168	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18+,19+/m1/s1	RRSRGJAXJRQFPD-NEWSRXKRSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K73604422	BRD-K73604422-001-01-4	Broad Institute of MIT and Harvard	BRD-K73604422			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18+,19+/m1/s1	RRSRGJAXJRQFPD-NEWSRXKRSA-N	444.173035558							117997
BRD-K47349869	LSM-29447		54639330	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9+,10+/m1/s1	RKZMUCFCOIAGGT-UTLUCORTSA-N	CCC(=O)N[C@H]1CC[C@H](CC(=O)OC)O[C@H]1CO	BroadT	BRD-K47349869	BRD-K47349869-001-01-9	Broad Institute of MIT and Harvard	BRD-K47349869			CCC(=O)N[C@H]1CC[C@H](CC(=O)OC)O[C@H]1CO	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9+,10+/m1/s1	RKZMUCFCOIAGGT-UTLUCORTSA-N	259.141972782							117998
BRD-K28814368	LSM-29448		54639169	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18-,19-/m1/s1	RRSRGJAXJRQFPD-BHIYHBOVSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K28814368	BRD-K28814368-001-01-1	Broad Institute of MIT and Harvard	BRD-K28814368			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18-,19-/m1/s1	RRSRGJAXJRQFPD-BHIYHBOVSA-N	444.173035558							117999
BRD-K73573019	LSM-29449		54639442	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15-,18-/m1/s1	PYWNIQJEFPCHIF-IIDMSEBBSA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K73573019	BRD-K73573019-001-01-0	Broad Institute of MIT and Harvard	BRD-K73573019			OC[C@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15-,18-/m1/s1	PYWNIQJEFPCHIF-IIDMSEBBSA-N	405.189985614							118000
BRD-K69613314	LSM-29450		54639166	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18+,19-/m0/s1	FKDHCSBIQDWEMT-UHOSZYNNSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2Cl)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K69613314	BRD-K69613314-001-01-2	Broad Institute of MIT and Harvard	BRD-K69613314			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2Cl)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18+,19-/m0/s1	FKDHCSBIQDWEMT-UHOSZYNNSA-N	424.176499758							118001
BRD-K10900122	LSM-29451		54639402	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18-,19-/m0/s1	SNSIFAOUIDJYAO-WDSOQIARSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K10900122	BRD-K10900122-001-01-5	Broad Institute of MIT and Harvard	BRD-K10900122			OC[C@@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18-,19-/m0/s1	SNSIFAOUIDJYAO-WDSOQIARSA-N	484.154718468							118002
BRD-K72467884	LSM-29452		54639403	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18-,19+/m0/s1	SNSIFAOUIDJYAO-YTQUADARSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K72467884	BRD-K72467884-001-01-8	Broad Institute of MIT and Harvard	BRD-K72467884			OC[C@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18-,19+/m0/s1	SNSIFAOUIDJYAO-YTQUADARSA-N	484.154718468							118003
BRD-K39979888	LSM-29453		54639207	InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22-,23+/m0/s1	AVWHUTQXLFJWQV-RJGXRXQPSA-N	OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@@H]1NC(=O)c4ccccc4	BroadT	BRD-K39979888	BRD-K39979888-001-01-0	Broad Institute of MIT and Harvard	BRD-K39979888			OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@@H]1NC(=O)c1ccccc1	InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22-,23+/m0/s1	AVWHUTQXLFJWQV-RJGXRXQPSA-N	437.231456502							118004
BRD-K70643771	LSM-29454		54639268	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12-,13-/m1/s1	GIRVAELHWNMQPN-JHJVBQTASA-N	CC(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CC2)O[C@@H]1CO	BroadT	BRD-K70643771	BRD-K70643771-001-01-2	Broad Institute of MIT and Harvard	BRD-K70643771			CC(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CC2)O[C@@H]1CO	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12-,13-/m1/s1	GIRVAELHWNMQPN-JHJVBQTASA-N	284.173607268							118005
CHEMBL2139592	LSM-29455	BRD-K90571714, SID131435586	54639298	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19+,21+/m1/s1	KSHGYKMGUCEKKM-PBEJRMEISA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3ccccn3)CC[C@@H]1NS(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K90571714	BRD-K90571714-001-01-1	Broad Institute of MIT and Harvard	BRD-K90571714			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2ccccn2)CC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19+,21+/m1/s1	KSHGYKMGUCEKKM-PBEJRMEISA-N	477.123752698							118006
BRD-K17940097	LSM-29456		54639194	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21+/m1/s1	LTXSPIFYGNBEMC-UIFIKXQLSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K17940097	BRD-K17940097-001-01-5	Broad Institute of MIT and Harvard	BRD-K17940097			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21+/m1/s1	LTXSPIFYGNBEMC-UIFIKXQLSA-N	485.184811986							118007
BRD-K33897007	LSM-29457		54639355	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18-,20-/m1/s1	BQBXUVFZTSPBJE-YVWKXTFCSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)C(C)C)O[C@@H]2CO	BroadT	BRD-K33897007	BRD-K33897007-001-01-6	Broad Institute of MIT and Harvard	BRD-K33897007			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)C(C)C)O[C@@H]1CO	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18-,20-/m1/s1	BQBXUVFZTSPBJE-YVWKXTFCSA-N	438.19369079							118008
BRD-K89300187	LSM-29458		54639251	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17+,20+/m1/s1	JOZKTRAUEBYZEE-UWVAXJGDSA-N	CN(C)Cc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)nn1	BroadT	BRD-K89300187	BRD-K89300187-001-01-6	Broad Institute of MIT and Harvard	BRD-K89300187			CN(C)Cc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)nn1	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17+,20+/m1/s1	JOZKTRAUEBYZEE-UWVAXJGDSA-N	446.22776812							118009
BRD-K75451592	LSM-29459		54639460	InChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24+,26-/m1/s1	XNNPHUWWMNRDCG-KTIWRFAQSA-N	COc1ccccc1NC(=O)N[C@H]2C=C[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@@H]2CO	BroadT	BRD-K75451592	BRD-K75451592-001-01-2	Broad Institute of MIT and Harvard	BRD-K75451592			COc1ccccc1NC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@@H]1CO	InChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24+,26-/m1/s1	XNNPHUWWMNRDCG-KTIWRFAQSA-N	493.25767125							118010
BRD-K51849151	LSM-29460		54639276	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16-,17-/m1/s1	SFXBWBNLRUAJJR-BRWVUGGUSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K51849151	BRD-K51849151-001-01-8	Broad Institute of MIT and Harvard	BRD-K51849151			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16-,17-/m1/s1	SFXBWBNLRUAJJR-BRWVUGGUSA-N	395.185649162							118011
BRD-K56592061	LSM-29461		54639249	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17+,19-/m0/s1	UBYVOLAQIVZNTP-WDYCEAGBSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)CC[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K56592061	BRD-K56592061-001-01-8	Broad Institute of MIT and Harvard	BRD-K56592061			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17+,19-/m0/s1	UBYVOLAQIVZNTP-WDYCEAGBSA-N	434.176561688							118012
BRD-K75981085	LSM-29462		54639188	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25+,26-/m0/s1	BTASCBMIIFGVQJ-DMDYGQEQSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@H]2CO	BroadT	BRD-K75981085	BRD-K75981085-001-01-2	Broad Institute of MIT and Harvard	BRD-K75981085			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25+,26-/m0/s1	BTASCBMIIFGVQJ-DMDYGQEQSA-N	498.218842898							118013
BRD-K85649685	LSM-29463		54639252	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17-,20-/m1/s1	JOZKTRAUEBYZEE-MBOZVWFJSA-N	CN(C)Cc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)nn1	BroadT	BRD-K85649685	BRD-K85649685-001-01-7	Broad Institute of MIT and Harvard	BRD-K85649685			CN(C)Cc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)nn1	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17-,20-/m1/s1	JOZKTRAUEBYZEE-MBOZVWFJSA-N	446.22776812							118014
BRD-K92544320	LSM-29464		54639315	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20-,21+/m0/s1	AOROBJTWHRZKJU-SESVDKBCSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CCNC(=O)Cc3ccccn3)O[C@@H]2CO	BroadT	BRD-K92544320	BRD-K92544320-001-01-2	Broad Institute of MIT and Harvard	BRD-K92544320			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CCNC(=O)Cc2ccccn2)O[C@@H]1CO	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20-,21+/m0/s1	AOROBJTWHRZKJU-SESVDKBCSA-N	463.177706368							118015
BRD-K83832060	LSM-29465		54639326	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16-,18-/m0/s1	HDVOKISSOHDMNH-BQFCYCMXSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3CC3)CC[C@@H]1NC(=O)c4cccnc4	BroadT	BRD-K83832060	BRD-K83832060-001-01-6	Broad Institute of MIT and Harvard	BRD-K83832060			OC[C@@H]1O[C@H](CCn2cc(nn2)C2CC2)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16-,18-/m0/s1	HDVOKISSOHDMNH-BQFCYCMXSA-N	371.19573971							118016
BRD-K67902591	LSM-29466		54639220	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19+/m1/s1	LVBUYUBXUUEMDY-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K67902591	BRD-K67902591-001-01-5	Broad Institute of MIT and Harvard	BRD-K67902591			OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19+/m1/s1	LVBUYUBXUUEMDY-QYZOEREBSA-N	488.224654732							118017
BRD-K24965236	LSM-29467		54639422	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14-,15-/m0/s1	OYAPENMSDPHQGH-KKUMJFAQSA-N	CN(C)C(=O)C[C@@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	BroadT	BRD-K24965236	BRD-K24965236-001-01-5	Broad Institute of MIT and Harvard	BRD-K24965236			CN(C)C(=O)C[C@@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14-,15-/m0/s1	OYAPENMSDPHQGH-KKUMJFAQSA-N	338.164185436							118018
BRD-K89744662	LSM-29468		54639274	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16+,17+/m0/s1	SFXBWBNLRUAJJR-GVDBMIGSSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K89744662	BRD-K89744662-001-01-9	Broad Institute of MIT and Harvard	BRD-K89744662			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16+,17+/m0/s1	SFXBWBNLRUAJJR-GVDBMIGSSA-N	395.185649162							118019
BRD-K42486632	LSM-29469		54639211	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23+,24+/m0/s1	YALXHXGZPIMCNA-RBZQAINGSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)C4CCOCC4	BroadT	BRD-K42486632	BRD-K42486632-001-01-0	Broad Institute of MIT and Harvard	BRD-K42486632			OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)C1CCOCC1	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23+,24+/m0/s1	YALXHXGZPIMCNA-RBZQAINGSA-N	450.21547208							118020
BRD-K44935022	LSM-29470		54639221	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19+/m1/s1	LVBUYUBXUUEMDY-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K44935022	BRD-K44935022-001-01-2	Broad Institute of MIT and Harvard	BRD-K44935022			OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19+/m1/s1	LVBUYUBXUUEMDY-QRVBRYPASA-N	488.224654732							118021
BRD-K39204079	LSM-29471		54639332	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9-,10-/m0/s1	RKZMUCFCOIAGGT-GUBZILKMSA-N	CCC(=O)N[C@H]1CC[C@@H](CC(=O)OC)O[C@H]1CO	BroadT	BRD-K39204079	BRD-K39204079-001-01-2	Broad Institute of MIT and Harvard	BRD-K39204079			CCC(=O)N[C@H]1CC[C@@H](CC(=O)OC)O[C@H]1CO	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9-,10-/m0/s1	RKZMUCFCOIAGGT-GUBZILKMSA-N	259.141972782							118022
CHEMBL2356734	LSM-29472	BRD-K05222558, SID131435470	54639183	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25+,26+/m1/s1	BTASCBMIIFGVQJ-AFESJLNVSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@H]2CO	BroadT	BRD-K05222558	BRD-K05222558-001-01-4	Broad Institute of MIT and Harvard	BRD-K05222558			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25+,26+/m1/s1	BTASCBMIIFGVQJ-AFESJLNVSA-N	498.218842898							118023
BRD-K99644502	LSM-29473		54639223	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19-/m1/s1	LVBUYUBXUUEMDY-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K99644502	BRD-K99644502-001-01-3	Broad Institute of MIT and Harvard	BRD-K99644502			OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19-/m1/s1	LVBUYUBXUUEMDY-GUDVDZBRSA-N	488.224654732							118024
BRD-K84271229	LSM-29474		54639233	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22+,23-/m0/s1	UBQLRBWDFCIPMC-WWNPGLIZSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2CO	BroadT	BRD-K84271229	BRD-K84271229-001-01-4	Broad Institute of MIT and Harvard	BRD-K84271229			COc1cccc(c1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22+,23-/m0/s1	UBQLRBWDFCIPMC-WWNPGLIZSA-N	472.166807326							118025
BRD-K30171122	LSM-29475		54639226	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19-/m0/s1	LVBUYUBXUUEMDY-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K30171122	BRD-K30171122-001-01-9	Broad Institute of MIT and Harvard	BRD-K30171122			OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19-/m0/s1	LVBUYUBXUUEMDY-OTWHNJEPSA-N	488.224654732							118026
BRD-K26195700	LSM-29476		54639473	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18-,21+/m0/s1	SPUVHZZOUOXYGN-BBTUJRGHSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K26195700	BRD-K26195700-001-01-4	Broad Institute of MIT and Harvard	BRD-K26195700			OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18-,21+/m0/s1	SPUVHZZOUOXYGN-BBTUJRGHSA-N	441.189985614							118027
CHEMBL2132511	LSM-29477	BRD-K97348029, SID131435547	54639260	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20-,22+/m0/s1	YPLZJHKSEUDEKT-RCZSKKKRSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)c4ccccn4)O[C@@H]2CO)cc1	BroadT	BRD-K97348029	BRD-K97348029-001-01-7	Broad Institute of MIT and Harvard	BRD-K97348029			COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)-c3ccccn3)O[C@@H]2CO)cc1	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20-,22+/m0/s1	YPLZJHKSEUDEKT-RCZSKKKRSA-N	452.217203436							118028
BRD-K32520360	LSM-29478		54639438	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16+,18-/m1/s1	BMWSYQFQMBOYKL-SOLBZPMBSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@H](CC(=O)N3CCN(C)CC3)O[C@@H]2CO	BroadT	BRD-K32520360	BRD-K32520360-001-01-6	Broad Institute of MIT and Harvard	BRD-K32520360			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16+,18-/m1/s1	BMWSYQFQMBOYKL-SOLBZPMBSA-N	441.193356432							118029
BRD-K98891210	LSM-29479		54639170	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18-,19+/m1/s1	RRSRGJAXJRQFPD-QRQLOZEOSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K98891210	BRD-K98891210-001-01-4	Broad Institute of MIT and Harvard	BRD-K98891210			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18-,19+/m1/s1	RRSRGJAXJRQFPD-QRQLOZEOSA-N	444.173035558							118030
BRD-K38040305	LSM-29480		54639398	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18+,19+/m1/s1	SNSIFAOUIDJYAO-NEWSRXKRSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K38040305	BRD-K38040305-001-01-7	Broad Institute of MIT and Harvard	BRD-K38040305			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18+,19+/m1/s1	SNSIFAOUIDJYAO-NEWSRXKRSA-N	484.154718468							118031
BRD-K13849122	LSM-29481		54639321	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16+,18+/m0/s1	HDVOKISSOHDMNH-LZLYRXPVSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3CC3)CC[C@H]1NC(=O)c4cccnc4	BroadT	BRD-K13849122	BRD-K13849122-001-01-1	Broad Institute of MIT and Harvard	BRD-K13849122			OC[C@H]1O[C@H](CCn2cc(nn2)C2CC2)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16+,18+/m0/s1	HDVOKISSOHDMNH-LZLYRXPVSA-N	371.19573971							118032
CHEMBL2140332	LSM-29482	BRD-K14780713, SID131435549	54639262	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20-,22-/m1/s1	YPLZJHKSEUDEKT-SYYKKAFVSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)c4ccccn4)O[C@@H]2CO)cc1	BroadT	BRD-K14780713	BRD-K14780713-001-01-2	Broad Institute of MIT and Harvard	BRD-K14780713			COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)-c3ccccn3)O[C@@H]2CO)cc1	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20-,22-/m1/s1	YPLZJHKSEUDEKT-SYYKKAFVSA-N	452.217203436							118033
BRD-K86630280	LSM-29483		54639390	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18+,19+/m1/s1	JFCILRCMDYZKAM-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCC2)C=C[C@@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K86630280	BRD-K86630280-001-01-5	Broad Institute of MIT and Harvard	BRD-K86630280			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCC2)C=C[C@@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18+,19+/m1/s1	JFCILRCMDYZKAM-QYZOEREBSA-N	420.217283648							118034
BRD-K38650960	LSM-29484		54639399	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18-,19+/m1/s1	SNSIFAOUIDJYAO-QRQLOZEOSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K38650960	BRD-K38650960-001-01-9	Broad Institute of MIT and Harvard	BRD-K38650960			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18-,19+/m1/s1	SNSIFAOUIDJYAO-QRQLOZEOSA-N	484.154718468							118035
BRD-K54370483	LSM-29485		54639208	InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22-,23+/m1/s1	AVWHUTQXLFJWQV-ZLNRFVROSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@H]1NC(=O)c4ccccc4	BroadT	BRD-K54370483	BRD-K54370483-001-01-1	Broad Institute of MIT and Harvard	BRD-K54370483			OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@H]1NC(=O)c1ccccc1	InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22-,23+/m1/s1	AVWHUTQXLFJWQV-ZLNRFVROSA-N	437.231456502							118036
BRD-K02078984	LSM-29486		54639430	InChI=1S/C13H25N5O2/c1-17(2)7-10-8-18(16-15-10)6-5-11-3-4-12(14)13(9-19)20-11/h8,11-13,19H,3-7,9,14H2,1-2H3/t11-,12+,13-/m1/s1	RSSFQYFOHBQLRO-FRRDWIJNSA-N	CN(C)Cc1cn(CC[C@H]2CC[C@H](N)[C@@H](CO)O2)nn1	BroadT	BRD-K02078984	BRD-K02078984-001-01-7	Broad Institute of MIT and Harvard	BRD-K02078984			CN(C)Cc1cn(CC[C@H]2CC[C@H](N)[C@@H](CO)O2)nn1	InChI=1S/C13H25N5O2/c1-17(2)7-10-8-18(16-15-10)6-5-11-3-4-12(14)13(9-19)20-11/h8,11-13,19H,3-7,9,14H2,1-2H3/t11-,12+,13-/m1/s1	RSSFQYFOHBQLRO-FRRDWIJNSA-N	283.20082509							118037
BRD-K56799639	LSM-29487		54639372	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17-,18-/m0/s1	OCKURQXTXDTUJZ-SZMVWBNQSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2F)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K56799639	BRD-K56799639-001-01-2	Broad Institute of MIT and Harvard	BRD-K56799639			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2F)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17-,18-/m0/s1	OCKURQXTXDTUJZ-SZMVWBNQSA-N	459.1839346							118038
BRD-K40964045	LSM-29488		54639411	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18+,19+/m0/s1	YXHXOQQNNYPEQC-IPMKNSEASA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(F)cc2)CC[C@H]1NC(=O)NC3CCCC3	BroadT	BRD-K40964045	BRD-K40964045-001-01-9	Broad Institute of MIT and Harvard	BRD-K40964045			OC[C@H]1O[C@H](CC(=O)NCc2ccc(F)cc2)CC[C@H]1NC(=O)NC1CCCC1	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18+,19+/m0/s1	YXHXOQQNNYPEQC-IPMKNSEASA-N	407.22203467							118039
BRD-K13301506	LSM-29489		54639203	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19+,20-/m1/s1	HHODKCKBDGVCKH-HSALFYBXSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2)C=C[C@@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K13301506	BRD-K13301506-001-01-9	Broad Institute of MIT and Harvard	BRD-K13301506			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2)C=C[C@@H]1NC(=O)NC1CCCCC1	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19+,20-/m1/s1	HHODKCKBDGVCKH-HSALFYBXSA-N	401.231456502							118040
BRD-K75036062	LSM-29490		54639294	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20-,21+/m0/s1	ZCGNSQNJACZJHF-PCCBWWKXSA-N	OC[C@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K75036062	BRD-K75036062-001-01-2	Broad Institute of MIT and Harvard	BRD-K75036062			OC[C@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20-,21+/m0/s1	ZCGNSQNJACZJHF-PCCBWWKXSA-N	432.273655672							118041
BRD-K00209945	LSM-29491		54639286	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16-,17+/m1/s1	MXCNPCNUBRZJFA-OIISXLGYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)C=C[C@H]1NC(=O)C3CC3	BroadT	BRD-K00209945	BRD-K00209945-001-01-8	Broad Institute of MIT and Harvard	BRD-K00209945			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)C=C[C@H]1NC(=O)C1CC1	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16-,17+/m1/s1	MXCNPCNUBRZJFA-OIISXLGYSA-N	378.134634946							118042
BRD-K14245433	LSM-29492		54639322	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16+,18+/m1/s1	HDVOKISSOHDMNH-RYRKJORJSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3CC3)CC[C@@H]1NC(=O)c4cccnc4	BroadT	BRD-K14245433	BRD-K14245433-001-01-5	Broad Institute of MIT and Harvard	BRD-K14245433			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2CC2)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16+,18+/m1/s1	HDVOKISSOHDMNH-RYRKJORJSA-N	371.19573971							118043
BRD-K12524155	LSM-29493		54639449	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16+,17+/m1/s1	UXNIMKIHWHNNEY-PVAVHDDUSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K12524155	BRD-K12524155-001-01-1	Broad Institute of MIT and Harvard	BRD-K12524155			OC[C@@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16+,17+/m1/s1	UXNIMKIHWHNNEY-PVAVHDDUSA-N	400.14682081							118044
BRD-K27287379	LSM-29494		54639351	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18+,20+/m0/s1	BQBXUVFZTSPBJE-ILZDJORESA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)C(C)C)O[C@@H]2CO	BroadT	BRD-K27287379	BRD-K27287379-001-01-8	Broad Institute of MIT and Harvard	BRD-K27287379			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)C(C)C)O[C@@H]1CO	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18+,20+/m0/s1	BQBXUVFZTSPBJE-ILZDJORESA-N	438.19369079							118045
BRD-K54262203	LSM-29495		54639464	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23-/m1/s1	HUTGYGSTODGUGG-DNVJHFABSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K54262203	BRD-K54262203-001-01-9	Broad Institute of MIT and Harvard	BRD-K54262203			Cc1noc(C)c1NC(=O)N[C@@H]1CC[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23-/m1/s1	HUTGYGSTODGUGG-DNVJHFABSA-N	478.2216201							118046
BRD-K83934572	LSM-29496		54639395	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18+,19-/m1/s1	JFCILRCMDYZKAM-CEXWTWQISA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCC2)C=C[C@@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K83934572	BRD-K83934572-001-01-1	Broad Institute of MIT and Harvard	BRD-K83934572			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCC2)C=C[C@@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18+,19-/m1/s1	JFCILRCMDYZKAM-CEXWTWQISA-N	420.217283648							118047
BRD-K28623804	LSM-29497		54639192	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21-/m0/s1	LTXSPIFYGNBEMC-YYWHXJBOSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K28623804	BRD-K28623804-001-01-8	Broad Institute of MIT and Harvard	BRD-K28623804			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21-/m0/s1	LTXSPIFYGNBEMC-YYWHXJBOSA-N	485.184811986							118048
BRD-K22508525	LSM-29498		54639474	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18-,21+/m1/s1	SPUVHZZOUOXYGN-OPYAIIAOSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K22508525	BRD-K22508525-001-01-5	Broad Institute of MIT and Harvard	BRD-K22508525			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18-,21+/m1/s1	SPUVHZZOUOXYGN-OPYAIIAOSA-N	441.189985614							118049
BRD-K09655230	LSM-29499		54639248	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17+,19-/m1/s1	UBYVOLAQIVZNTP-HHXXYDBFSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)CC[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K09655230	BRD-K09655230-001-01-7	Broad Institute of MIT and Harvard	BRD-K09655230			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17+,19-/m1/s1	UBYVOLAQIVZNTP-HHXXYDBFSA-N	434.176561688							118050
BRD-K71605668	LSM-29500		54639328	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16+,18-/m0/s1	HDVOKISSOHDMNH-JZXOWHBKSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3CC3)CC[C@H]1NC(=O)c4cccnc4	BroadT	BRD-K71605668	BRD-K71605668-001-01-6	Broad Institute of MIT and Harvard	BRD-K71605668			OC[C@@H]1O[C@H](CCn2cc(nn2)C2CC2)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16+,18-/m0/s1	HDVOKISSOHDMNH-JZXOWHBKSA-N	371.19573971							118051
BRD-K64902833	LSM-29501		54639176	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18-,19-/m1/s1	UTHIGKUIGCKQQD-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C=C[C@H]1NC(=O)Nc3ccccc3	BroadT	BRD-K64902833	BRD-K64902833-001-01-6	Broad Institute of MIT and Harvard	BRD-K64902833			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C=C[C@H]1NC(=O)Nc1ccccc1	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18-,19-/m1/s1	UTHIGKUIGCKQQD-GUDVDZBRSA-N	396.179755288							118052
BRD-K68060538	LSM-29502		54639418	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18+,19-/m0/s1	YXHXOQQNNYPEQC-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(F)cc2)CC[C@H]1NC(=O)NC3CCCC3	BroadT	BRD-K68060538	BRD-K68060538-001-01-7	Broad Institute of MIT and Harvard	BRD-K68060538			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(F)cc2)CC[C@H]1NC(=O)NC1CCCC1	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18+,19-/m0/s1	YXHXOQQNNYPEQC-OTWHNJEPSA-N	407.22203467							118053
CHEMBL2145360	LSM-29503	BRD-K61022988, SID131435551	54639264	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20+,22-/m1/s1	YPLZJHKSEUDEKT-KAGYGMCKSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@H](CCn3cc(nn3)c4ccccn4)O[C@@H]2CO)cc1	BroadT	BRD-K61022988	BRD-K61022988-001-01-9	Broad Institute of MIT and Harvard	BRD-K61022988			COc1ccc(NC(=O)N[C@H]2CC[C@H](CCn3cc(nn3)-c3ccccn3)O[C@@H]2CO)cc1	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20+,22-/m1/s1	YPLZJHKSEUDEKT-KAGYGMCKSA-N	452.217203436							118054
BRD-K64640769	LSM-29504		54639243	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17+,19+/m1/s1	UBYVOLAQIVZNTP-AYBZRNKSSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)CC[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K64640769	BRD-K64640769-001-01-0	Broad Institute of MIT and Harvard	BRD-K64640769			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17+,19+/m1/s1	UBYVOLAQIVZNTP-AYBZRNKSSA-N	434.176561688							118055
BRD-K42126874	LSM-29505		54639227	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22+,23+/m0/s1	UBQLRBWDFCIPMC-MDNUFGMLSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2CO	BroadT	BRD-K42126874	BRD-K42126874-001-01-9	Broad Institute of MIT and Harvard	BRD-K42126874			COc1cccc(c1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22+,23+/m0/s1	UBQLRBWDFCIPMC-MDNUFGMLSA-N	472.166807326							118056
BRD-K52237706	LSM-29506		54639229	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22-,23-/m0/s1	UBQLRBWDFCIPMC-PMVMPFDFSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2CO	BroadT	BRD-K52237706	BRD-K52237706-001-01-5	Broad Institute of MIT and Harvard	BRD-K52237706			COc1cccc(c1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22-,23-/m0/s1	UBQLRBWDFCIPMC-PMVMPFDFSA-N	472.166807326							118057
BRD-K67090705	LSM-29507		54639181	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18+,19-/m0/s1	UTHIGKUIGCKQQD-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C=C[C@H]1NC(=O)Nc3ccccc3	BroadT	BRD-K67090705	BRD-K67090705-001-01-2	Broad Institute of MIT and Harvard	BRD-K67090705			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C=C[C@H]1NC(=O)Nc1ccccc1	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18+,19-/m0/s1	UTHIGKUIGCKQQD-OTWHNJEPSA-N	396.179755288							118058
BRD-K66187822	LSM-29508		54639368	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17-,18-/m1/s1	OCKURQXTXDTUJZ-KBAYOESNSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2F)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K66187822	BRD-K66187822-001-01-5	Broad Institute of MIT and Harvard	BRD-K66187822			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2F)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17-,18-/m1/s1	OCKURQXTXDTUJZ-KBAYOESNSA-N	459.1839346							118059
BRD-K37760996	LSM-29509		54639459	InChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24-,26+/m1/s1	XNNPHUWWMNRDCG-NOOIUNMQSA-N	COc1ccccc1NC(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@H]2CO	BroadT	BRD-K37760996	BRD-K37760996-001-01-5	Broad Institute of MIT and Harvard	BRD-K37760996			COc1ccccc1NC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO	InChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24-,26+/m1/s1	XNNPHUWWMNRDCG-NOOIUNMQSA-N	493.25767125							118060
BRD-K75999096	LSM-29510		54639344	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16-,17-/m1/s1	SVHHNONGWSEYCY-BRWVUGGUSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K75999096	BRD-K75999096-001-01-1	Broad Institute of MIT and Harvard	BRD-K75999096			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16-,17-/m1/s1	SVHHNONGWSEYCY-BRWVUGGUSA-N	378.159100056							118061
BRD-K69241192	LSM-29511		54639200	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19-,20-/m0/s1	HHODKCKBDGVCKH-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2)C=C[C@@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K69241192	BRD-K69241192-001-01-9	Broad Institute of MIT and Harvard	BRD-K69241192			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2)C=C[C@@H]1NC(=O)NC1CCCCC1	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19-,20-/m0/s1	HHODKCKBDGVCKH-UFYCRDLUSA-N	401.231456502							118062
BRD-K82194980	LSM-29512		54639382	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15+/m1/s1	VFOAUUBLSWMNNG-ILXRZTDVSA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)NCCCN(C)C)O[C@H]1CO	BroadT	BRD-K82194980	BRD-K82194980-001-01-9	Broad Institute of MIT and Harvard	BRD-K82194980			CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)NCCCN(C)C)O[C@H]1CO	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15+/m1/s1	VFOAUUBLSWMNNG-ILXRZTDVSA-N	358.258005608							118063
BRD-K67353973	LSM-29513		54639212	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23+,24+/m1/s1	YALXHXGZPIMCNA-SGNDLWITSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)C4CCOCC4	BroadT	BRD-K67353973	BRD-K67353973-001-01-9	Broad Institute of MIT and Harvard	BRD-K67353973			OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23+,24+/m1/s1	YALXHXGZPIMCNA-SGNDLWITSA-N	450.21547208							118064
BRD-K78245984	LSM-29514		54639374	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17+,18+/m0/s1	NDIHUDUSPABKLT-CGTJXYLNSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K78245984	BRD-K78245984-001-01-1	Broad Institute of MIT and Harvard	BRD-K78245984			OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17+,18+/m0/s1	NDIHUDUSPABKLT-CGTJXYLNSA-N	436.121668702							118065
BRD-K42776812	LSM-29515		54639290	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20+,21+/m1/s1	ZCGNSQNJACZJHF-HKBOAZHASA-N	OC[C@@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K42776812	BRD-K42776812-001-01-6	Broad Institute of MIT and Harvard	BRD-K42776812			OC[C@@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20+,21+/m1/s1	ZCGNSQNJACZJHF-HKBOAZHASA-N	432.273655672							118066
BRD-K89328601	LSM-29516		54639410	InChI=1S/C17H25Cl2N3O5S/c1-2-28(25,26)20-6-5-14-3-4-15(16(10-23)27-14)22-17(24)21-13-8-11(18)7-12(19)9-13/h7-9,14-16,20,23H,2-6,10H2,1H3,(H2,21,22,24)/t14-,15+,16-/m0/s1	SSRDXPKUDSQVJV-XHSDSOJGSA-N	CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)Nc2cc(Cl)cc(Cl)c2)[C@H](CO)O1	BroadT	BRD-K89328601	BRD-K89328601-001-01-5	Broad Institute of MIT and Harvard	BRD-K89328601			CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)Nc2cc(Cl)cc(Cl)c2)[C@H](CO)O1	InChI=1S/C17H25Cl2N3O5S/c1-2-28(25,26)20-6-5-14-3-4-15(16(10-23)27-14)22-17(24)21-13-8-11(18)7-12(19)9-13/h7-9,14-16,20,23H,2-6,10H2,1H3,(H2,21,22,24)/t14-,15+,16-/m0/s1	SSRDXPKUDSQVJV-XHSDSOJGSA-N	453.08919704							118067
BRD-K07576726	LSM-29517		54639284	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16-,17-/m0/s1	MXCNPCNUBRZJFA-XIRDDKMYSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2Cl)C=C[C@@H]1NC(=O)C3CC3	BroadT	BRD-K07576726	BRD-K07576726-001-01-8	Broad Institute of MIT and Harvard	BRD-K07576726			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2Cl)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16-,17-/m0/s1	MXCNPCNUBRZJFA-XIRDDKMYSA-N	378.134634946							118068
BRD-K77399094	LSM-29518		54639323	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16-,18-/m1/s1	HDVOKISSOHDMNH-JFIYKMOQSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3CC3)CC[C@H]1NC(=O)c4cccnc4	BroadT	BRD-K77399094	BRD-K77399094-001-01-4	Broad Institute of MIT and Harvard	BRD-K77399094			OC[C@H]1O[C@@H](CCn2cc(nn2)C2CC2)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16-,18-/m1/s1	HDVOKISSOHDMNH-JFIYKMOQSA-N	371.19573971							118069
CHEMBL2143842	LSM-29519	BRD-K62370517, SID131435550	54639263	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20-,22-/m0/s1	YPLZJHKSEUDEKT-VCOUNFBDSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)c4ccccn4)O[C@H]2CO)cc1	BroadT	BRD-K62370517	BRD-K62370517-001-01-1	Broad Institute of MIT and Harvard	BRD-K62370517			COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)-c3ccccn3)O[C@H]2CO)cc1	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20-,22-/m0/s1	YPLZJHKSEUDEKT-VCOUNFBDSA-N	452.217203436							118070
BRD-K19962165	LSM-29520		54639447	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15+,18-/m0/s1	PYWNIQJEFPCHIF-DAYGRLMNSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CC2)CC[C@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K19962165	BRD-K19962165-001-01-4	Broad Institute of MIT and Harvard	BRD-K19962165			OC[C@@H]1O[C@H](CCNC(=O)C2CC2)CC[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15+,18-/m0/s1	PYWNIQJEFPCHIF-DAYGRLMNSA-N	405.189985614							118071
BRD-K37680172	LSM-29521		54639340	InChI=1S/C17H27N3O5S/c1-2-26(23,24)19-10-8-14-6-7-15(16(12-21)25-14)20-17(22)11-13-5-3-4-9-18-13/h3-5,9,14-16,19,21H,2,6-8,10-12H2,1H3,(H,20,22)/t14-,15-,16+/m1/s1	ATYYOVKYGVPSBZ-OAGGEKHMSA-N	CCS(=O)(=O)NCC[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1	BroadT	BRD-K37680172	BRD-K37680172-001-01-1	Broad Institute of MIT and Harvard	BRD-K37680172			CCS(=O)(=O)NCC[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1	InChI=1S/C17H27N3O5S/c1-2-26(23,24)19-10-8-14-6-7-15(16(12-21)25-14)20-17(22)11-13-5-3-4-9-18-13/h3-5,9,14-16,19,21H,2,6-8,10-12H2,1H3,(H,20,22)/t14-,15-,16+/m1/s1	ATYYOVKYGVPSBZ-OAGGEKHMSA-N	385.167141684							118072
CHEMBL2140231	LSM-29522	BRD-K37527826, SID131435588	54639300	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19-,21+/m1/s1	KSHGYKMGUCEKKM-BSIFCXSSSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3ccccn3)CC[C@H]1NS(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K37527826	BRD-K37527826-001-01-4	Broad Institute of MIT and Harvard	BRD-K37527826			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2ccccn2)CC[C@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19-,21+/m1/s1	KSHGYKMGUCEKKM-BSIFCXSSSA-N	477.123752698							118073
BRD-K53499221	LSM-29523		54639468	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23-/m1/s1	HUTGYGSTODGUGG-XPWALMASSA-N	Cc1onc(C)c1NC(=O)N[C@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K53499221	BRD-K53499221-001-01-6	Broad Institute of MIT and Harvard	BRD-K53499221			Cc1noc(C)c1NC(=O)N[C@H]1CC[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23-/m1/s1	HUTGYGSTODGUGG-XPWALMASSA-N	478.2216201							118074
BRD-K10221669	LSM-29524		54639364	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9-,10+/m1/s1	FSRWVHNAALREIT-BBBLOLIVSA-N	CCC(=O)N[C@@H]1C=C[C@H](CC(=O)OC)O[C@H]1CO	BroadT	BRD-K10221669	BRD-K10221669-001-01-5	Broad Institute of MIT and Harvard	BRD-K10221669			CCC(=O)N[C@@H]1C=C[C@H](CC(=O)OC)O[C@H]1CO	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9-,10+/m1/s1	FSRWVHNAALREIT-BBBLOLIVSA-N	257.126322718							118075
BRD-K72997741	LSM-29525		54639391	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18-,19-/m1/s1	JFCILRCMDYZKAM-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCC2)C=C[C@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K72997741	BRD-K72997741-001-01-7	Broad Institute of MIT and Harvard	BRD-K72997741			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCC2)C=C[C@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18-,19-/m1/s1	JFCILRCMDYZKAM-GUDVDZBRSA-N	420.217283648							118076
BRD-K27824953	LSM-29526		54639232	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22+,23-/m1/s1	UBQLRBWDFCIPMC-AKIFATBCSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2CO	BroadT	BRD-K27824953	BRD-K27824953-001-01-2	Broad Institute of MIT and Harvard	BRD-K27824953			COc1cccc(c1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22+,23-/m1/s1	UBQLRBWDFCIPMC-AKIFATBCSA-N	472.166807326							118077
BRD-K47690679	LSM-29527		54639174	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18+,19-/m0/s1	RRSRGJAXJRQFPD-UHOSZYNNSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K47690679	BRD-K47690679-001-01-6	Broad Institute of MIT and Harvard	BRD-K47690679			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18+,19-/m0/s1	RRSRGJAXJRQFPD-UHOSZYNNSA-N	444.173035558							118078
BRD-K57464717	LSM-29528		54639361	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9-,10-/m1/s1	FSRWVHNAALREIT-OPRDCNLKSA-N	CCC(=O)N[C@@H]1C=C[C@H](CC(=O)OC)O[C@@H]1CO	BroadT	BRD-K57464717	BRD-K57464717-001-01-7	Broad Institute of MIT and Harvard	BRD-K57464717			CCC(=O)N[C@@H]1C=C[C@H](CC(=O)OC)O[C@@H]1CO	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9-,10-/m1/s1	FSRWVHNAALREIT-OPRDCNLKSA-N	257.126322718							118079
BRD-K48615268	LSM-29529		54639377	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17-,18+/m0/s1	NDIHUDUSPABKLT-RYQLBKOJSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K48615268	BRD-K48615268-001-01-9	Broad Institute of MIT and Harvard	BRD-K48615268			OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17-,18+/m0/s1	NDIHUDUSPABKLT-RYQLBKOJSA-N	436.121668702							118080
BRD-K20745677	LSM-29530		54639217	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23+,24-/m0/s1	YALXHXGZPIMCNA-VXNXHJTFSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)C4CCOCC4	BroadT	BRD-K20745677	BRD-K20745677-001-01-1	Broad Institute of MIT and Harvard	BRD-K20745677			OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)C1CCOCC1	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23+,24-/m0/s1	YALXHXGZPIMCNA-VXNXHJTFSA-N	450.21547208							118081
BRD-K27226238	LSM-29531		54639324	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16-,18+/m1/s1	HDVOKISSOHDMNH-NUJGCVRESA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3CC3)CC[C@H]1NC(=O)c4cccnc4	BroadT	BRD-K27226238	BRD-K27226238-001-01-7	Broad Institute of MIT and Harvard	BRD-K27226238			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2CC2)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16-,18+/m1/s1	HDVOKISSOHDMNH-NUJGCVRESA-N	371.19573971							118082
BRD-K37459038	LSM-29532		54639247	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17-,19+/m1/s1	UBYVOLAQIVZNTP-SUMDDJOVSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)CC[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K37459038	BRD-K37459038-001-01-4	Broad Institute of MIT and Harvard	BRD-K37459038			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17-,19+/m1/s1	UBYVOLAQIVZNTP-SUMDDJOVSA-N	434.176561688							118083
CHEMBL2360390	LSM-29533	BRD-K09149805, SID131435472	54639185	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25-,26-/m0/s1	BTASCBMIIFGVQJ-RNXOBYDBSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@H]2CO	BroadT	BRD-K09149805	BRD-K09149805-001-01-6	Broad Institute of MIT and Harvard	BRD-K09149805			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25-,26-/m0/s1	BTASCBMIIFGVQJ-RNXOBYDBSA-N	498.218842898							118084
BRD-K81574470	LSM-29534		54639201	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19-,20+/m0/s1	HHODKCKBDGVCKH-SLFFLAALSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2)C=C[C@@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K81574470	BRD-K81574470-001-01-0	Broad Institute of MIT and Harvard	BRD-K81574470			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2)C=C[C@@H]1NC(=O)NC1CCCCC1	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19-,20+/m0/s1	HHODKCKBDGVCKH-SLFFLAALSA-N	401.231456502							118085
BRD-K49584388	LSM-29535		54639455	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16+,17-/m0/s1	UXNIMKIHWHNNEY-UAGQMJEPSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CC2)CC[C@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K49584388	BRD-K49584388-001-01-1	Broad Institute of MIT and Harvard	BRD-K49584388			OC[C@@H]1O[C@H](CCNC(=O)C2CC2)CC[C@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16+,17-/m0/s1	UXNIMKIHWHNNEY-UAGQMJEPSA-N	400.14682081							118086
BRD-K61494613	LSM-29536		54639224	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19-/m0/s1	LVBUYUBXUUEMDY-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K61494613	BRD-K61494613-001-01-3	Broad Institute of MIT and Harvard	BRD-K61494613			OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19-/m0/s1	LVBUYUBXUUEMDY-FHWLQOOXSA-N	488.224654732							118087
BRD-K16251850	LSM-29537		54639216	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23-,24+/m1/s1	YALXHXGZPIMCNA-SMIHKQSGSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)C4CCOCC4	BroadT	BRD-K16251850	BRD-K16251850-001-01-5	Broad Institute of MIT and Harvard	BRD-K16251850			OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)C1CCOCC1	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23-,24+/m1/s1	YALXHXGZPIMCNA-SMIHKQSGSA-N	450.21547208							118088
BRD-K76450447	LSM-29538		54639416	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18+,19-/m1/s1	YXHXOQQNNYPEQC-CEXWTWQISA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(F)cc2)CC[C@@H]1NC(=O)NC3CCCC3	BroadT	BRD-K76450447	BRD-K76450447-001-01-0	Broad Institute of MIT and Harvard	BRD-K76450447			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(F)cc2)CC[C@@H]1NC(=O)NC1CCCC1	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18+,19-/m1/s1	YXHXOQQNNYPEQC-CEXWTWQISA-N	407.22203467							118089
BRD-K50985475	LSM-29539		54639433	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16+,18+/m1/s1	BMWSYQFQMBOYKL-RYRKJORJSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@H](CC(=O)N3CCN(C)CC3)O[C@H]2CO	BroadT	BRD-K50985475	BRD-K50985475-001-01-0	Broad Institute of MIT and Harvard	BRD-K50985475			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16+,18+/m1/s1	BMWSYQFQMBOYKL-RYRKJORJSA-N	441.193356432							118090
BRD-K62288678	LSM-29540		54639239	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17-,18+/m1/s1	AGYKQGZRDSIEQP-KURKYZTESA-N	OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)C3CCC3	BroadT	BRD-K62288678	BRD-K62288678-001-01-0	Broad Institute of MIT and Harvard	BRD-K62288678			OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)C1CCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17-,18+/m1/s1	AGYKQGZRDSIEQP-KURKYZTESA-N	395.242021186							118091
BRD-K51572611	LSM-29541		54639378	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17-,18+/m1/s1	NDIHUDUSPABKLT-NXHRZFHOSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K51572611	BRD-K51572611-001-01-0	Broad Institute of MIT and Harvard	BRD-K51572611			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17-,18+/m1/s1	NDIHUDUSPABKLT-NXHRZFHOSA-N	436.121668702							118092
BRD-K09191014	LSM-29542		54639385	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15+/m0/s1	VFOAUUBLSWMNNG-SOUVJXGZSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	BroadT	BRD-K09191014	BRD-K09191014-001-01-5	Broad Institute of MIT and Harvard	BRD-K09191014			CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15+/m0/s1	VFOAUUBLSWMNNG-SOUVJXGZSA-N	358.258005608							118093
BRD-K63587749	LSM-29543		54639228	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22+,23+/m1/s1	UBQLRBWDFCIPMC-PUHATCMVSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NC3Cc4ccccc4C3)O[C@H]2CO	BroadT	BRD-K63587749	BRD-K63587749-001-01-9	Broad Institute of MIT and Harvard	BRD-K63587749			COc1cccc(c1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22+,23+/m1/s1	UBQLRBWDFCIPMC-PUHATCMVSA-N	472.166807326							118094
BRD-K94441949	LSM-29544		54639341	InChI=1S/C17H27N3O5S/c1-2-26(23,24)19-10-8-14-6-7-15(16(12-21)25-14)20-17(22)11-13-5-3-4-9-18-13/h3-5,9,14-16,19,21H,2,6-8,10-12H2,1H3,(H,20,22)/t14-,15+,16-/m1/s1	ATYYOVKYGVPSBZ-OWCLPIDISA-N	CCS(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1	BroadT	BRD-K94441949	BRD-K94441949-001-01-0	Broad Institute of MIT and Harvard	BRD-K94441949			CCS(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1	InChI=1S/C17H27N3O5S/c1-2-26(23,24)19-10-8-14-6-7-15(16(12-21)25-14)20-17(22)11-13-5-3-4-9-18-13/h3-5,9,14-16,19,21H,2,6-8,10-12H2,1H3,(H,20,22)/t14-,15+,16-/m1/s1	ATYYOVKYGVPSBZ-OWCLPIDISA-N	385.167141684							118095
BRD-K76960970	LSM-29545		54639371	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17+,18-/m1/s1	OCKURQXTXDTUJZ-BPQIPLTHSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2F)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K76960970	BRD-K76960970-001-01-3	Broad Institute of MIT and Harvard	BRD-K76960970			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2F)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17+,18-/m1/s1	OCKURQXTXDTUJZ-BPQIPLTHSA-N	459.1839346							118096
BRD-K97798118	LSM-29546		54639219	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19+/m0/s1	LVBUYUBXUUEMDY-IPMKNSEASA-N	OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K97798118	BRD-K97798118-001-01-5	Broad Institute of MIT and Harvard	BRD-K97798118			OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19+/m0/s1	LVBUYUBXUUEMDY-IPMKNSEASA-N	488.224654732							118097
CHEMBL2139804	LSM-29547	BRD-K11242872, SID131435589	54639301	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19-,21-/m1/s1	KSHGYKMGUCEKKM-OZOXKJRCSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3ccccn3)CC[C@H]1NS(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K11242872	BRD-K11242872-001-01-3	Broad Institute of MIT and Harvard	BRD-K11242872			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2ccccn2)CC[C@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19-,21-/m1/s1	KSHGYKMGUCEKKM-OZOXKJRCSA-N	477.123752698							118098
BRD-K25444802	LSM-29548		54639445	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15-,18-/m0/s1	PYWNIQJEFPCHIF-MPGHIAIKSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CC2)CC[C@@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K25444802	BRD-K25444802-001-01-4	Broad Institute of MIT and Harvard	BRD-K25444802			OC[C@@H]1O[C@H](CCNC(=O)C2CC2)CC[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15-,18-/m0/s1	PYWNIQJEFPCHIF-MPGHIAIKSA-N	405.189985614							118099
BRD-K70949282	LSM-29549		54639363	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9-,10+/m0/s1	FSRWVHNAALREIT-LPEHRKFASA-N	CCC(=O)N[C@H]1C=C[C@@H](CC(=O)OC)O[C@@H]1CO	BroadT	BRD-K70949282	BRD-K70949282-001-01-5	Broad Institute of MIT and Harvard	BRD-K70949282			CCC(=O)N[C@H]1C=C[C@@H](CC(=O)OC)O[C@@H]1CO	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9-,10+/m0/s1	FSRWVHNAALREIT-LPEHRKFASA-N	257.126322718							118100
BRD-K72452130	LSM-29550		54639257	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17+,20-/m0/s1	JOZKTRAUEBYZEE-QKLQHJQFSA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)nn1	BroadT	BRD-K72452130	BRD-K72452130-001-01-2	Broad Institute of MIT and Harvard	BRD-K72452130			CN(C)Cc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)nn1	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17+,20-/m0/s1	JOZKTRAUEBYZEE-QKLQHJQFSA-N	446.22776812							118101
BRD-K40697889	LSM-29551		54639308	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19-,20+/m1/s1	CMUIIZXJLAYAHO-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)C3CCCCC3	BroadT	BRD-K40697889	BRD-K40697889-001-01-4	Broad Institute of MIT and Harvard	BRD-K40697889			OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)C1CCCCC1	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19-,20+/m1/s1	CMUIIZXJLAYAHO-AQNXPRMDSA-N	437.208134244							118102
BRD-K61742182	LSM-29552		54639279	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16-,17+/m1/s1	SFXBWBNLRUAJJR-ZACQAIPSSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K61742182	BRD-K61742182-001-01-6	Broad Institute of MIT and Harvard	BRD-K61742182			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16-,17+/m1/s1	SFXBWBNLRUAJJR-ZACQAIPSSA-N	395.185649162							118103
BRD-K84158675	LSM-29553		54639379	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17+,18-/m1/s1	NDIHUDUSPABKLT-BPQIPLTHSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K84158675	BRD-K84158675-001-01-2	Broad Institute of MIT and Harvard	BRD-K84158675			OC[C@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17+,18-/m1/s1	NDIHUDUSPABKLT-BPQIPLTHSA-N	436.121668702							118104
BRD-K38246370	LSM-29554		54639437	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16-,18+/m1/s1	BMWSYQFQMBOYKL-NUJGCVRESA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)N3CCN(C)CC3)O[C@H]2CO	BroadT	BRD-K38246370	BRD-K38246370-001-01-0	Broad Institute of MIT and Harvard	BRD-K38246370			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16-,18+/m1/s1	BMWSYQFQMBOYKL-NUJGCVRESA-N	441.193356432							118105
BRD-K07196884	LSM-29555		54639237	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17-,18-/m0/s1	AGYKQGZRDSIEQP-BZSNNMDCSA-N	OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K07196884	BRD-K07196884-001-01-3	Broad Institute of MIT and Harvard	BRD-K07196884			OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)C1CCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17-,18-/m0/s1	AGYKQGZRDSIEQP-BZSNNMDCSA-N	395.242021186							118106
BRD-K35953312	LSM-29556		54639365	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9+,10-/m0/s1	FSRWVHNAALREIT-AEJSXWLSSA-N	CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)OC)O[C@H]1CO	BroadT	BRD-K35953312	BRD-K35953312-001-01-5	Broad Institute of MIT and Harvard	BRD-K35953312			CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)OC)O[C@H]1CO	InChI=1S/C12H19NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h4-5,8-10,14H,3,6-7H2,1-2H3,(H,13,15)/t8-,9+,10-/m0/s1	FSRWVHNAALREIT-AEJSXWLSSA-N	257.126322718							118107
BRD-K91588908	LSM-29557		54639381	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15+/m0/s1	VFOAUUBLSWMNNG-RRFJBIMHSA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	BroadT	BRD-K91588908	BRD-K91588908-001-01-0	Broad Institute of MIT and Harvard	BRD-K91588908			CC(C)NC(=O)N[C@@H]1CC[C@@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15+/m0/s1	VFOAUUBLSWMNNG-RRFJBIMHSA-N	358.258005608							118108
BRD-K75243062	LSM-29558		54639242	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17+,19+/m0/s1	UBYVOLAQIVZNTP-KVSKMBFKSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)CC[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K75243062	BRD-K75243062-001-01-4	Broad Institute of MIT and Harvard	BRD-K75243062			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17+,19+/m0/s1	UBYVOLAQIVZNTP-KVSKMBFKSA-N	434.176561688							118109
BRD-K50474387	LSM-29559		54639180	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18+,19-/m1/s1	UTHIGKUIGCKQQD-CEXWTWQISA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C=C[C@@H]1NC(=O)Nc3ccccc3	BroadT	BRD-K50474387	BRD-K50474387-001-01-2	Broad Institute of MIT and Harvard	BRD-K50474387			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C=C[C@@H]1NC(=O)Nc1ccccc1	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18+,19-/m1/s1	UTHIGKUIGCKQQD-CEXWTWQISA-N	396.179755288							118110
BRD-K62256869	LSM-29560		54639383	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15-/m1/s1	VFOAUUBLSWMNNG-RBSFLKMASA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	BroadT	BRD-K62256869	BRD-K62256869-001-01-6	Broad Institute of MIT and Harvard	BRD-K62256869			CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15-/m1/s1	VFOAUUBLSWMNNG-RBSFLKMASA-N	358.258005608							118111
BRD-K15708264	LSM-29561		54639318	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20-,21-/m0/s1	AOROBJTWHRZKJU-JBACZVJFSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CCNC(=O)Cc3ccccn3)O[C@H]2CO	BroadT	BRD-K15708264	BRD-K15708264-001-01-5	Broad Institute of MIT and Harvard	BRD-K15708264			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CCNC(=O)Cc2ccccn2)O[C@H]1CO	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20-,21-/m0/s1	AOROBJTWHRZKJU-JBACZVJFSA-N	463.177706368							118112
BRD-K50600207	LSM-29562		54639246	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17-,19+/m0/s1	UBYVOLAQIVZNTP-VDZJLULYSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)CC[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K50600207	BRD-K50600207-001-01-0	Broad Institute of MIT and Harvard	BRD-K50600207			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17-,19+/m0/s1	UBYVOLAQIVZNTP-VDZJLULYSA-N	434.176561688							118113
BRD-K72183943	LSM-29563		54639366	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17+,18+/m0/s1	OCKURQXTXDTUJZ-CGTJXYLNSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2F)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K72183943	BRD-K72183943-001-01-0	Broad Institute of MIT and Harvard	BRD-K72183943			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2F)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17+,18+/m0/s1	OCKURQXTXDTUJZ-CGTJXYLNSA-N	459.1839346							118114
BRD-K91500340	LSM-29564		54639195	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21-/m1/s1	LTXSPIFYGNBEMC-JRGCBEDISA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K91500340	BRD-K91500340-001-01-1	Broad Institute of MIT and Harvard	BRD-K91500340			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21-/m1/s1	LTXSPIFYGNBEMC-JRGCBEDISA-N	485.184811986							118115
BRD-K60828476	LSM-29565		54639198	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19+,20+/m1/s1	HHODKCKBDGVCKH-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2)C=C[C@@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K60828476	BRD-K60828476-001-01-9	Broad Institute of MIT and Harvard	BRD-K60828476			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2)C=C[C@@H]1NC(=O)NC1CCCCC1	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19+,20+/m1/s1	HHODKCKBDGVCKH-AABGKKOBSA-N	401.231456502							118116
BRD-K50008138	LSM-29566		54639281	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16+,17-/m0/s1	SFXBWBNLRUAJJR-BBWFWOEESA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K50008138	BRD-K50008138-001-01-0	Broad Institute of MIT and Harvard	BRD-K50008138			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16+,17-/m0/s1	SFXBWBNLRUAJJR-BBWFWOEESA-N	395.185649162							118117
BRD-K83183132	LSM-29567		54639282	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16+,17+/m1/s1	MXCNPCNUBRZJFA-PVAVHDDUSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)C=C[C@@H]1NC(=O)C3CC3	BroadT	BRD-K83183132	BRD-K83183132-001-01-8	Broad Institute of MIT and Harvard	BRD-K83183132			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16+,17+/m1/s1	MXCNPCNUBRZJFA-PVAVHDDUSA-N	378.134634946							118118
BRD-K90902537	LSM-29568		54639337	InChI=1S/C17H27N3O5S/c1-2-26(23,24)19-10-8-14-6-7-15(16(12-21)25-14)20-17(22)11-13-5-3-4-9-18-13/h3-5,9,14-16,19,21H,2,6-8,10-12H2,1H3,(H,20,22)/t14-,15+,16+/m0/s1	ATYYOVKYGVPSBZ-ARFHVFGLSA-N	CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1	BroadT	BRD-K90902537	BRD-K90902537-001-01-3	Broad Institute of MIT and Harvard	BRD-K90902537			CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1	InChI=1S/C17H27N3O5S/c1-2-26(23,24)19-10-8-14-6-7-15(16(12-21)25-14)20-17(22)11-13-5-3-4-9-18-13/h3-5,9,14-16,19,21H,2,6-8,10-12H2,1H3,(H,20,22)/t14-,15+,16+/m0/s1	ATYYOVKYGVPSBZ-ARFHVFGLSA-N	385.167141684							118119
BRD-K34482448	LSM-29569		54639431	InChI=1S/C13H25N5O2/c1-17(2)7-10-8-18(16-15-10)6-5-11-3-4-12(14)13(9-19)20-11/h8,11-13,19H,3-7,9,14H2,1-2H3/t11-,12+,13-/m0/s1	RSSFQYFOHBQLRO-XQQFMLRXSA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@@H](N)[C@H](CO)O2)nn1	BroadT	BRD-K34482448	BRD-K34482448-001-01-3	Broad Institute of MIT and Harvard	BRD-K34482448			CN(C)Cc1cn(CC[C@@H]2CC[C@@H](N)[C@H](CO)O2)nn1	InChI=1S/C13H25N5O2/c1-17(2)7-10-8-18(16-15-10)6-5-11-3-4-12(14)13(9-19)20-11/h8,11-13,19H,3-7,9,14H2,1-2H3/t11-,12+,13-/m0/s1	RSSFQYFOHBQLRO-XQQFMLRXSA-N	283.20082509							118120
BRD-K05374764	LSM-29570		54639331	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9-,10-/m1/s1	RKZMUCFCOIAGGT-OPRDCNLKSA-N	CCC(=O)N[C@@H]1CC[C@H](CC(=O)OC)O[C@@H]1CO	BroadT	BRD-K05374764	BRD-K05374764-001-01-3	Broad Institute of MIT and Harvard	BRD-K05374764			CCC(=O)N[C@@H]1CC[C@H](CC(=O)OC)O[C@@H]1CO	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9-,10-/m1/s1	RKZMUCFCOIAGGT-OPRDCNLKSA-N	259.141972782							118121
BRD-K67661742	LSM-29571		54639414	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19-/m0/s1	YXHXOQQNNYPEQC-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(F)cc2)CC[C@@H]1NC(=O)NC3CCCC3	BroadT	BRD-K67661742	BRD-K67661742-001-01-5	Broad Institute of MIT and Harvard	BRD-K67661742			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(F)cc2)CC[C@@H]1NC(=O)NC1CCCC1	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19-/m0/s1	YXHXOQQNNYPEQC-FHWLQOOXSA-N	407.22203467							118122
CHEMBL2144473	LSM-29572	BRD-K43336921, SID131435585	54639297	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19+,21+/m0/s1	KSHGYKMGUCEKKM-LDQXTDLNSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3ccccn3)CC[C@H]1NS(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K43336921	BRD-K43336921-001-01-6	Broad Institute of MIT and Harvard	BRD-K43336921			OC[C@H]1O[C@H](CCn2cc(nn2)-c2ccccn2)CC[C@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19+,21+/m0/s1	KSHGYKMGUCEKKM-LDQXTDLNSA-N	477.123752698							118123
BRD-K54179521	LSM-29573		54639236	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17-,18-/m1/s1	AGYKQGZRDSIEQP-KZNAEPCWSA-N	OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)C3CCC3	BroadT	BRD-K54179521	BRD-K54179521-001-01-0	Broad Institute of MIT and Harvard	BRD-K54179521			OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)C1CCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17-,18-/m1/s1	AGYKQGZRDSIEQP-KZNAEPCWSA-N	395.242021186							118124
BRD-K06310280	LSM-29574		54639397	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18+,19+/m0/s1	SNSIFAOUIDJYAO-QXAKKESOSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K06310280	BRD-K06310280-001-01-1	Broad Institute of MIT and Harvard	BRD-K06310280			OC[C@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18+,19+/m0/s1	SNSIFAOUIDJYAO-QXAKKESOSA-N	484.154718468							118125
BRD-K20501114	LSM-29575		54639423	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14-,15+/m0/s1	OYAPENMSDPHQGH-SOUVJXGZSA-N	CN(C)C(=O)C[C@@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	BroadT	BRD-K20501114	BRD-K20501114-001-01-9	Broad Institute of MIT and Harvard	BRD-K20501114			CN(C)C(=O)C[C@@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14-,15+/m0/s1	OYAPENMSDPHQGH-SOUVJXGZSA-N	338.164185436							118126
BRD-K20798215	LSM-29576		54639477	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25+,26+/m0/s1	CHMWYEVRTWMFCL-HDYLNDSGSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)Nc4ccccc4F	BroadT	BRD-K20798215	BRD-K20798215-001-01-9	Broad Institute of MIT and Harvard	BRD-K20798215			OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25+,26+/m0/s1	CHMWYEVRTWMFCL-HDYLNDSGSA-N	489.206384606							118127
BRD-K67873600	LSM-29577		54639205	InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22-,23-/m1/s1	AVWHUTQXLFJWQV-DNVJHFABSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@H]1NC(=O)c4ccccc4	BroadT	BRD-K67873600	BRD-K67873600-001-01-7	Broad Institute of MIT and Harvard	BRD-K67873600			OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@H]1NC(=O)c1ccccc1	InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22-,23-/m1/s1	AVWHUTQXLFJWQV-DNVJHFABSA-N	437.231456502							118128
BRD-K88970431	LSM-29578		54639325	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16+,18-/m1/s1	HDVOKISSOHDMNH-SOLBZPMBSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3CC3)CC[C@@H]1NC(=O)c4cccnc4	BroadT	BRD-K88970431	BRD-K88970431-001-01-1	Broad Institute of MIT and Harvard	BRD-K88970431			OC[C@H]1O[C@@H](CCn2cc(nn2)C2CC2)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16+,18-/m1/s1	HDVOKISSOHDMNH-SOLBZPMBSA-N	371.19573971							118129
BRD-K02882086	LSM-29579		54639339	InChI=1S/C17H27N3O5S/c1-2-26(23,24)19-10-8-14-6-7-15(16(12-21)25-14)20-17(22)11-13-5-3-4-9-18-13/h3-5,9,14-16,19,21H,2,6-8,10-12H2,1H3,(H,20,22)/t14-,15-,16+/m0/s1	ATYYOVKYGVPSBZ-HRCADAONSA-N	CCS(=O)(=O)NCC[C@@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1	BroadT	BRD-K02882086	BRD-K02882086-001-01-9	Broad Institute of MIT and Harvard	BRD-K02882086			CCS(=O)(=O)NCC[C@@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1	InChI=1S/C17H27N3O5S/c1-2-26(23,24)19-10-8-14-6-7-15(16(12-21)25-14)20-17(22)11-13-5-3-4-9-18-13/h3-5,9,14-16,19,21H,2,6-8,10-12H2,1H3,(H,20,22)/t14-,15-,16+/m0/s1	ATYYOVKYGVPSBZ-HRCADAONSA-N	385.167141684							118130
BRD-K66214486	LSM-29580		54639427	InChI=1S/C13H25N5O2/c1-17(2)7-10-8-18(16-15-10)6-5-11-3-4-12(14)13(9-19)20-11/h8,11-13,19H,3-7,9,14H2,1-2H3/t11-,12-,13+/m0/s1	RSSFQYFOHBQLRO-RWMBFGLXSA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@H](N)[C@@H](CO)O2)nn1	BroadT	BRD-K66214486	BRD-K66214486-001-01-4	Broad Institute of MIT and Harvard	BRD-K66214486			CN(C)Cc1cn(CC[C@@H]2CC[C@H](N)[C@@H](CO)O2)nn1	InChI=1S/C13H25N5O2/c1-17(2)7-10-8-18(16-15-10)6-5-11-3-4-12(14)13(9-19)20-11/h8,11-13,19H,3-7,9,14H2,1-2H3/t11-,12-,13+/m0/s1	RSSFQYFOHBQLRO-RWMBFGLXSA-N	283.20082509							118131
BRD-K02311826	LSM-29581		54639307	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19-,20-/m1/s1	CMUIIZXJLAYAHO-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)C3CCCCC3	BroadT	BRD-K02311826	BRD-K02311826-001-01-4	Broad Institute of MIT and Harvard	BRD-K02311826			OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)C1CCCCC1	InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19-,20-/m1/s1	CMUIIZXJLAYAHO-VAMGGRTRSA-N	437.208134244							118132
BRD-K03599607	LSM-29582		54639255	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17-,20-/m0/s1	JOZKTRAUEBYZEE-ZWOKBUDYSA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)nn1	BroadT	BRD-K03599607	BRD-K03599607-001-01-8	Broad Institute of MIT and Harvard	BRD-K03599607			CN(C)Cc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)nn1	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17-,20-/m0/s1	JOZKTRAUEBYZEE-ZWOKBUDYSA-N	446.22776812							118133
BRD-K06459664	LSM-29583		54639179	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18-,19+/m1/s1	UTHIGKUIGCKQQD-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C=C[C@H]1NC(=O)Nc3ccccc3	BroadT	BRD-K06459664	BRD-K06459664-001-01-2	Broad Institute of MIT and Harvard	BRD-K06459664			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C=C[C@H]1NC(=O)Nc1ccccc1	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18-,19+/m1/s1	UTHIGKUIGCKQQD-QRVBRYPASA-N	396.179755288							118134
BRD-K86845618	LSM-29584		54639333	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9-,10+/m0/s1	RKZMUCFCOIAGGT-LPEHRKFASA-N	CCC(=O)N[C@H]1CC[C@@H](CC(=O)OC)O[C@@H]1CO	BroadT	BRD-K86845618	BRD-K86845618-001-01-2	Broad Institute of MIT and Harvard	BRD-K86845618			CCC(=O)N[C@H]1CC[C@@H](CC(=O)OC)O[C@@H]1CO	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9-,10+/m0/s1	RKZMUCFCOIAGGT-LPEHRKFASA-N	259.141972782							118135
BRD-K80336250	LSM-29585		54639463	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23+/m1/s1	HUTGYGSTODGUGG-VJBWXMMDSA-N	Cc1onc(C)c1NC(=O)N[C@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K80336250	BRD-K80336250-001-01-1	Broad Institute of MIT and Harvard	BRD-K80336250			Cc1noc(C)c1NC(=O)N[C@H]1CC[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23+/m1/s1	HUTGYGSTODGUGG-VJBWXMMDSA-N	478.2216201							118136
BRD-K89932793	LSM-29586		54639293	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20-,21-/m0/s1	ZCGNSQNJACZJHF-ACRUOGEOSA-N	OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K89932793	BRD-K89932793-001-01-2	Broad Institute of MIT and Harvard	BRD-K89932793			OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20-,21-/m0/s1	ZCGNSQNJACZJHF-ACRUOGEOSA-N	432.273655672							118137
BRD-K03262163	LSM-29587		54639241	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17+,18-/m0/s1	AGYKQGZRDSIEQP-KSZLIROESA-N	OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)C3CCC3	BroadT	BRD-K03262163	BRD-K03262163-001-01-9	Broad Institute of MIT and Harvard	BRD-K03262163			OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)C1CCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17+,18-/m0/s1	AGYKQGZRDSIEQP-KSZLIROESA-N	395.242021186							118138
BRD-K35646839	LSM-29588		54639270	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12+,13-/m1/s1	GIRVAELHWNMQPN-FRRDWIJNSA-N	CC(=O)N[C@H]1CC[C@H](CCNC(=O)C2CC2)O[C@@H]1CO	BroadT	BRD-K35646839	BRD-K35646839-001-01-9	Broad Institute of MIT and Harvard	BRD-K35646839			CC(=O)N[C@H]1CC[C@H](CCNC(=O)C2CC2)O[C@@H]1CO	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12+,13-/m1/s1	GIRVAELHWNMQPN-FRRDWIJNSA-N	284.173607268							118139
BRD-K57938735	LSM-29589		54639173	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18-,19+/m0/s1	RRSRGJAXJRQFPD-YTQUADARSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K57938735	BRD-K57938735-001-01-8	Broad Institute of MIT and Harvard	BRD-K57938735			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18-,19+/m0/s1	RRSRGJAXJRQFPD-YTQUADARSA-N	444.173035558							118140
BRD-K00231307	LSM-29590		54639443	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15-,18+/m1/s1	PYWNIQJEFPCHIF-RKVPGOIHSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K00231307	BRD-K00231307-001-01-4	Broad Institute of MIT and Harvard	BRD-K00231307			OC[C@@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15-,18+/m1/s1	PYWNIQJEFPCHIF-RKVPGOIHSA-N	405.189985614							118141
BRD-K86848211	LSM-29591		54639316	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20-,21+/m1/s1	AOROBJTWHRZKJU-NRSPTQNISA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CCNC(=O)Cc3ccccn3)O[C@H]2CO	BroadT	BRD-K86848211	BRD-K86848211-001-01-7	Broad Institute of MIT and Harvard	BRD-K86848211			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CCNC(=O)Cc2ccccn2)O[C@H]1CO	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20-,21+/m1/s1	AOROBJTWHRZKJU-NRSPTQNISA-N	463.177706368							118142
BRD-K11846531	LSM-29592		54639461	InChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24+,26-/m0/s1	XNNPHUWWMNRDCG-FBILRYNDSA-N	COc1ccccc1NC(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@H]2CO	BroadT	BRD-K11846531	BRD-K11846531-001-01-4	Broad Institute of MIT and Harvard	BRD-K11846531			COc1ccccc1NC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO	InChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24+,26-/m0/s1	XNNPHUWWMNRDCG-FBILRYNDSA-N	493.25767125							118143
BRD-K03848296	LSM-29593		54639234	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17+,18+/m0/s1	AGYKQGZRDSIEQP-RCCFBDPRSA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)C3CCC3	BroadT	BRD-K03848296	BRD-K03848296-001-01-5	Broad Institute of MIT and Harvard	BRD-K03848296			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)C1CCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17+,18+/m0/s1	AGYKQGZRDSIEQP-RCCFBDPRSA-N	395.242021186							118144
BRD-K93283197	LSM-29594		54639450	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16-,17+/m1/s1	UXNIMKIHWHNNEY-OIISXLGYSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K93283197	BRD-K93283197-001-01-6	Broad Institute of MIT and Harvard	BRD-K93283197			OC[C@@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16-,17+/m1/s1	UXNIMKIHWHNNEY-OIISXLGYSA-N	400.14682081							118145
BRD-K70090544	LSM-29595		54639327	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16-,18+/m0/s1	HDVOKISSOHDMNH-XYJFISCASA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3CC3)CC[C@@H]1NC(=O)c4cccnc4	BroadT	BRD-K70090544	BRD-K70090544-001-01-2	Broad Institute of MIT and Harvard	BRD-K70090544			OC[C@H]1O[C@H](CCn2cc(nn2)C2CC2)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C19H25N5O3/c25-12-18-16(21-19(26)14-2-1-8-20-10-14)6-5-15(27-18)7-9-24-11-17(22-23-24)13-3-4-13/h1-2,8,10-11,13,15-16,18,25H,3-7,9,12H2,(H,21,26)/t15-,16-,18+/m0/s1	HDVOKISSOHDMNH-XYJFISCASA-N	371.19573971							118146
BRD-K22668106	LSM-29596		54639393	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18-,19+/m0/s1	JFCILRCMDYZKAM-GBESFXJTSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCC2)C=C[C@@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K22668106	BRD-K22668106-001-01-4	Broad Institute of MIT and Harvard	BRD-K22668106			OC[C@H]1O[C@H](CC(=O)NCCN2CCCC2)C=C[C@@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18-,19+/m0/s1	JFCILRCMDYZKAM-GBESFXJTSA-N	420.217283648							118147
BRD-K26766324	LSM-29597		54639210	InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22+,23-/m0/s1	AVWHUTQXLFJWQV-ZRBLBEILSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@H]1NC(=O)c4ccccc4	BroadT	BRD-K26766324	BRD-K26766324-001-01-8	Broad Institute of MIT and Harvard	BRD-K26766324			OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@H]1NC(=O)c1ccccc1	InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22+,23-/m0/s1	AVWHUTQXLFJWQV-ZRBLBEILSA-N	437.231456502							118148
BRD-K49051633	LSM-29598		54639452	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16-,17-/m1/s1	UXNIMKIHWHNNEY-DJIMGWMZSA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K49051633	BRD-K49051633-001-01-4	Broad Institute of MIT and Harvard	BRD-K49051633			OC[C@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16-,17-/m1/s1	UXNIMKIHWHNNEY-DJIMGWMZSA-N	400.14682081							118149
CHEMBL2362067	LSM-29599	BRD-K15259298, SID131435718	54639429	InChI=1S/C13H25N5O2/c1-17(2)7-10-8-18(16-15-10)6-5-11-3-4-12(14)13(9-19)20-11/h8,11-13,19H,3-7,9,14H2,1-2H3/t11-,12-,13-/m0/s1	RSSFQYFOHBQLRO-AVGNSLFASA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@H](N)[C@H](CO)O2)nn1	BroadT	BRD-K15259298	BRD-K15259298-001-01-9	Broad Institute of MIT and Harvard	BRD-K15259298			CN(C)Cc1cn(CC[C@@H]2CC[C@H](N)[C@H](CO)O2)nn1	InChI=1S/C13H25N5O2/c1-17(2)7-10-8-18(16-15-10)6-5-11-3-4-12(14)13(9-19)20-11/h8,11-13,19H,3-7,9,14H2,1-2H3/t11-,12-,13-/m0/s1	RSSFQYFOHBQLRO-AVGNSLFASA-N	283.20082509							118150
BRD-K40838215	LSM-29600		54639259	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20+,22+/m1/s1	YPLZJHKSEUDEKT-CBQOVEMMSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@H](CCn3cc(nn3)c4ccccn4)O[C@H]2CO)cc1	BroadT	BRD-K40838215	BRD-K40838215-001-01-9	Broad Institute of MIT and Harvard	BRD-K40838215			COc1ccc(NC(=O)N[C@H]2CC[C@H](CCn3cc(nn3)-c3ccccn3)O[C@H]2CO)cc1	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20+,22+/m1/s1	YPLZJHKSEUDEKT-CBQOVEMMSA-N	452.217203436							118151
BRD-K50830147	LSM-29601		54639441	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15+,18+/m1/s1	PYWNIQJEFPCHIF-VKJFTORMSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K50830147	BRD-K50830147-001-01-6	Broad Institute of MIT and Harvard	BRD-K50830147			OC[C@@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15+,18+/m1/s1	PYWNIQJEFPCHIF-VKJFTORMSA-N	405.189985614							118152
CHEMBL2135881	LSM-29602	BRD-K40116023, SID131435552	54639265	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20+,22-/m0/s1	YPLZJHKSEUDEKT-DWLFOUALSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)c4ccccn4)O[C@H]2CO)cc1	BroadT	BRD-K40116023	BRD-K40116023-001-01-2	Broad Institute of MIT and Harvard	BRD-K40116023			COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)-c3ccccn3)O[C@H]2CO)cc1	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20+,22-/m0/s1	YPLZJHKSEUDEKT-DWLFOUALSA-N	452.217203436							118153
BRD-K03519778	LSM-29603		54639406	InChI=1S/C17H25Cl2N3O5S/c1-2-28(25,26)20-6-5-14-3-4-15(16(10-23)27-14)22-17(24)21-13-8-11(18)7-12(19)9-13/h7-9,14-16,20,23H,2-6,10H2,1H3,(H2,21,22,24)/t14-,15+,16+/m1/s1	SSRDXPKUDSQVJV-PMPSAXMXSA-N	CCS(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)Nc2cc(Cl)cc(Cl)c2)[C@H](CO)O1	BroadT	BRD-K03519778	BRD-K03519778-001-01-9	Broad Institute of MIT and Harvard	BRD-K03519778			CCS(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)Nc2cc(Cl)cc(Cl)c2)[C@H](CO)O1	InChI=1S/C17H25Cl2N3O5S/c1-2-28(25,26)20-6-5-14-3-4-15(16(10-23)27-14)22-17(24)21-13-8-11(18)7-12(19)9-13/h7-9,14-16,20,23H,2-6,10H2,1H3,(H2,21,22,24)/t14-,15+,16+/m1/s1	SSRDXPKUDSQVJV-PMPSAXMXSA-N	453.08919704							118154
BRD-K68055156	LSM-29604		54639267	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12+,13+/m1/s1	GIRVAELHWNMQPN-AGIUHOORSA-N	CC(=O)N[C@H]1CC[C@H](CCNC(=O)C2CC2)O[C@H]1CO	BroadT	BRD-K68055156	BRD-K68055156-001-01-8	Broad Institute of MIT and Harvard	BRD-K68055156			CC(=O)N[C@H]1CC[C@H](CCNC(=O)C2CC2)O[C@H]1CO	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12+,13+/m1/s1	GIRVAELHWNMQPN-AGIUHOORSA-N	284.173607268							118155
BRD-K42785890	LSM-29605		54639266	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12+,13+/m0/s1	GIRVAELHWNMQPN-YNEHKIRRSA-N	CC(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CC2)O[C@@H]1CO	BroadT	BRD-K42785890	BRD-K42785890-001-01-2	Broad Institute of MIT and Harvard	BRD-K42785890			CC(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CC2)O[C@@H]1CO	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12+,13+/m0/s1	GIRVAELHWNMQPN-YNEHKIRRSA-N	284.173607268							118156
BRD-K66046182	LSM-29606		54639285	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16-,17+/m0/s1	MXCNPCNUBRZJFA-BHYGNILZSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2Cl)C=C[C@@H]1NC(=O)C3CC3	BroadT	BRD-K66046182	BRD-K66046182-001-01-7	Broad Institute of MIT and Harvard	BRD-K66046182			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2Cl)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16-,17+/m0/s1	MXCNPCNUBRZJFA-BHYGNILZSA-N	378.134634946							118157
BRD-K78837609	LSM-29607		54639250	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17+,20+/m0/s1	JOZKTRAUEBYZEE-SQGPQFPESA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)nn1	BroadT	BRD-K78837609	BRD-K78837609-001-01-0	Broad Institute of MIT and Harvard	BRD-K78837609			CN(C)Cc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)nn1	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17+,20+/m0/s1	JOZKTRAUEBYZEE-SQGPQFPESA-N	446.22776812							118158
BRD-K12376164	LSM-29608		54639439	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16+,18-/m0/s1	BMWSYQFQMBOYKL-JZXOWHBKSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)N3CCN(C)CC3)O[C@H]2CO	BroadT	BRD-K12376164	BRD-K12376164-001-01-5	Broad Institute of MIT and Harvard	BRD-K12376164			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16+,18-/m0/s1	BMWSYQFQMBOYKL-JZXOWHBKSA-N	441.193356432							118159
BRD-K92712225	LSM-29609		54639465	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23-/m0/s1	HUTGYGSTODGUGG-VABKMULXSA-N	Cc1onc(C)c1NC(=O)N[C@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K92712225	BRD-K92712225-001-01-1	Broad Institute of MIT and Harvard	BRD-K92712225			Cc1noc(C)c1NC(=O)N[C@H]1CC[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C26H30N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,21-23,31H,12-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23-/m0/s1	HUTGYGSTODGUGG-VABKMULXSA-N	478.2216201							118160
BRD-K66896657	LSM-29610		54639275	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16+,17+/m1/s1	SFXBWBNLRUAJJR-IKGGRYGDSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K66896657	BRD-K66896657-001-01-1	Broad Institute of MIT and Harvard	BRD-K66896657			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16+,17+/m1/s1	SFXBWBNLRUAJJR-IKGGRYGDSA-N	395.185649162							118161
BRD-K26127374	LSM-29611		54639358	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18+,20-/m0/s1	BQBXUVFZTSPBJE-HQRMLTQVSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)C(C)C)O[C@H]2CO	BroadT	BRD-K26127374	BRD-K26127374-001-01-2	Broad Institute of MIT and Harvard	BRD-K26127374			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)C(C)C)O[C@H]1CO	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18+,20-/m0/s1	BQBXUVFZTSPBJE-HQRMLTQVSA-N	438.19369079							118162
MLS003650017	LSM-29612	BRD-K60547079	53382679	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18-,21-/m1/s1	SPUVHZZOUOXYGN-DBXWQHBBSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K60547079	BRD-K60547079-001-01-6	Broad Institute of MIT and Harvard	BRD-K60547079			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18-,21-/m1/s1	SPUVHZZOUOXYGN-DBXWQHBBSA-N	441.189985614							118163
BRD-K22093970	LSM-29613		54639230	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22-,23+/m0/s1	UBQLRBWDFCIPMC-ACIOBRDBSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2CO	BroadT	BRD-K22093970	BRD-K22093970-001-01-8	Broad Institute of MIT and Harvard	BRD-K22093970			COc1cccc(c1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-10,13,18,20,22-23,26-27H,11-12,14-15H2,1H3,(H,25,28)/t20-,22-,23+/m0/s1	UBQLRBWDFCIPMC-ACIOBRDBSA-N	472.166807326							118164
BRD-K50157358	LSM-29614		54639214	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23-,24-/m0/s1	YALXHXGZPIMCNA-HJOGWXRNSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)C4CCOCC4	BroadT	BRD-K50157358	BRD-K50157358-001-01-8	Broad Institute of MIT and Harvard	BRD-K50157358			OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23-,24-/m0/s1	YALXHXGZPIMCNA-HJOGWXRNSA-N	450.21547208							118165
BRD-K40804250	LSM-29615		54639202	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19-,20+/m1/s1	HHODKCKBDGVCKH-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2)C=C[C@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K40804250	BRD-K40804250-001-01-7	Broad Institute of MIT and Harvard	BRD-K40804250			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2)C=C[C@H]1NC(=O)NC1CCCCC1	InChI=1S/C22H31N3O4/c26-15-20-19(25-22(28)24-17-9-5-2-6-10-17)12-11-18(29-20)13-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-12,17-20,26H,2,5-6,9-10,13-15H2,(H,23,27)(H2,24,25,28)/t18-,19-,20+/m1/s1	HHODKCKBDGVCKH-AQNXPRMDSA-N	401.231456502							118166
BRD-K36460068	LSM-29616		54639444	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15+,18-/m1/s1	PYWNIQJEFPCHIF-RVKKMQEKSA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K36460068	BRD-K36460068-001-01-6	Broad Institute of MIT and Harvard	BRD-K36460068			OC[C@H]1O[C@@H](CCNC(=O)C2CC2)CC[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15+,18-/m1/s1	PYWNIQJEFPCHIF-RVKKMQEKSA-N	405.189985614							118167
BRD-K76976010	LSM-29617		54639448	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16+,17+/m0/s1	UXNIMKIHWHNNEY-USXIJHARSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CC2)CC[C@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K76976010	BRD-K76976010-001-01-1	Broad Institute of MIT and Harvard	BRD-K76976010			OC[C@H]1O[C@H](CCNC(=O)C2CC2)CC[C@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16+,17+/m0/s1	UXNIMKIHWHNNEY-USXIJHARSA-N	400.14682081							118168
BRD-K88224221	LSM-29618		54639295	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20+,21-/m1/s1	ZCGNSQNJACZJHF-QHAWAJNXSA-N	OC[C@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K88224221	BRD-K88224221-001-01-7	Broad Institute of MIT and Harvard	BRD-K88224221			OC[C@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20+,21-/m1/s1	ZCGNSQNJACZJHF-QHAWAJNXSA-N	432.273655672							118169
BRD-K92978173	LSM-29619		54639472	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18-,21-/m0/s1	SPUVHZZOUOXYGN-WFXMLNOXSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K92978173	BRD-K92978173-001-01-0	Broad Institute of MIT and Harvard	BRD-K92978173			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18-,21-/m0/s1	SPUVHZZOUOXYGN-WFXMLNOXSA-N	441.189985614							118170
BRD-K88395026	LSM-29620		54639425	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14+,15-/m1/s1	OYAPENMSDPHQGH-QLFBSQMISA-N	CN(C)C(=O)C[C@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	BroadT	BRD-K88395026	BRD-K88395026-001-01-2	Broad Institute of MIT and Harvard	BRD-K88395026			CN(C)C(=O)C[C@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14+,15-/m1/s1	OYAPENMSDPHQGH-QLFBSQMISA-N	338.164185436							118171
CHEMBL2145367	LSM-29621	BRD-K18197334, SID131435548	54639261	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20-,22+/m1/s1	YPLZJHKSEUDEKT-UZKOGDIHSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)c4ccccn4)O[C@H]2CO)cc1	BroadT	BRD-K18197334	BRD-K18197334-001-01-4	Broad Institute of MIT and Harvard	BRD-K18197334			COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)-c3ccccn3)O[C@H]2CO)cc1	InChI=1S/C23H28N6O4/c1-32-17-7-5-16(6-8-17)25-23(31)26-20-10-9-18(33-22(20)15-30)11-13-29-14-21(27-28-29)19-4-2-3-12-24-19/h2-8,12,14,18,20,22,30H,9-11,13,15H2,1H3,(H2,25,26,31)/t18-,20-,22+/m1/s1	YPLZJHKSEUDEKT-UZKOGDIHSA-N	452.217203436							118172
BRD-K07278815	LSM-29622		54639206	InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22-,23-/m0/s1	AVWHUTQXLFJWQV-VABKMULXSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@@H]1NC(=O)c4ccccc4	BroadT	BRD-K07278815	BRD-K07278815-001-01-3	Broad Institute of MIT and Harvard	BRD-K07278815			OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@@H]1NC(=O)c1ccccc1	InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22-,23-/m0/s1	AVWHUTQXLFJWQV-VABKMULXSA-N	437.231456502							118173
BRD-K83095019	LSM-29623		54639283	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16-,17-/m1/s1	MXCNPCNUBRZJFA-DJIMGWMZSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)C=C[C@H]1NC(=O)C3CC3	BroadT	BRD-K83095019	BRD-K83095019-001-01-2	Broad Institute of MIT and Harvard	BRD-K83095019			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)C=C[C@H]1NC(=O)C1CC1	InChI=1S/C19H23ClN2O4/c20-15-4-2-1-3-13(15)10-21-18(24)9-14-7-8-16(17(11-23)26-14)22-19(25)12-5-6-12/h1-4,7-8,12,14,16-17,23H,5-6,9-11H2,(H,21,24)(H,22,25)/t14-,16-,17-/m1/s1	MXCNPCNUBRZJFA-DJIMGWMZSA-N	378.134634946							118174
BRD-K90138084	LSM-29624		54639479	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25-,26-/m0/s1	CHMWYEVRTWMFCL-HRNNMHKYSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)Nc4ccccc4F	BroadT	BRD-K90138084	BRD-K90138084-001-01-1	Broad Institute of MIT and Harvard	BRD-K90138084			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25-,26-/m0/s1	CHMWYEVRTWMFCL-HRNNMHKYSA-N	489.206384606							118175
BRD-K24815102	LSM-29625		54639335	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9+,10-/m1/s1	RKZMUCFCOIAGGT-KXUCPTDWSA-N	CCC(=O)N[C@H]1CC[C@H](CC(=O)OC)O[C@@H]1CO	BroadT	BRD-K24815102	BRD-K24815102-001-01-3	Broad Institute of MIT and Harvard	BRD-K24815102			CCC(=O)N[C@H]1CC[C@H](CC(=O)OC)O[C@@H]1CO	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9+,10-/m1/s1	RKZMUCFCOIAGGT-KXUCPTDWSA-N	259.141972782							118176
BRD-K99660943	LSM-29626		54639354	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18-,20+/m1/s1	BQBXUVFZTSPBJE-POAQFYNOSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)C(C)C)O[C@H]2CO	BroadT	BRD-K99660943	BRD-K99660943-001-01-6	Broad Institute of MIT and Harvard	BRD-K99660943			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)C(C)C)O[C@H]1CO	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18-,20+/m1/s1	BQBXUVFZTSPBJE-POAQFYNOSA-N	438.19369079							118177
BRD-K97170716	LSM-29627		54639475	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18+,21-/m1/s1	SPUVHZZOUOXYGN-LVCYWYKZSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K97170716	BRD-K97170716-001-01-3	Broad Institute of MIT and Harvard	BRD-K97170716			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H27N3O6/c27-13-21-18(26-23(29)9-15-2-1-7-24-11-15)5-4-17(32-21)10-22(28)25-12-16-3-6-19-20(8-16)31-14-30-19/h1-3,6-8,11,17-18,21,27H,4-5,9-10,12-14H2,(H,25,28)(H,26,29)/t17-,18+,21-/m1/s1	SPUVHZZOUOXYGN-LVCYWYKZSA-N	441.189985614							118178
BRD-K55853030	LSM-29628		54639244	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17-,19-/m1/s1	UBYVOLAQIVZNTP-SZVBFZGTSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)CC[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K55853030	BRD-K55853030-001-01-3	Broad Institute of MIT and Harvard	BRD-K55853030			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H24F2N4O4/c22-13-4-6-16(23)18(9-13)27-21(30)26-17-7-5-15(31-19(17)12-28)10-20(29)25-11-14-3-1-2-8-24-14/h1-4,6,8-9,15,17,19,28H,5,7,10-12H2,(H,25,29)(H2,26,27,30)/t15-,17-,19-/m1/s1	UBYVOLAQIVZNTP-SZVBFZGTSA-N	434.176561688							118179
CHEMBL2145047	LSM-29629	BRD-K11003742, SID131435590	54639302	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19-,21-/m0/s1	KSHGYKMGUCEKKM-LRQRDZAKSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3ccccn3)CC[C@@H]1NS(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K11003742	BRD-K11003742-001-01-7	Broad Institute of MIT and Harvard	BRD-K11003742			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2ccccn2)CC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19-,21-/m0/s1	KSHGYKMGUCEKKM-LRQRDZAKSA-N	477.123752698							118180
BRD-K44692299	LSM-29630		54639440	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15+,18+/m0/s1	PYWNIQJEFPCHIF-HDMKZQKVSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CC2)CC[C@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K44692299	BRD-K44692299-001-01-5	Broad Institute of MIT and Harvard	BRD-K44692299			OC[C@H]1O[C@H](CCNC(=O)C2CC2)CC[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C20H27N3O6/c24-10-18-15(5-4-14(29-18)7-8-21-19(25)12-1-2-12)23-20(26)22-13-3-6-16-17(9-13)28-11-27-16/h3,6,9,12,14-15,18,24H,1-2,4-5,7-8,10-11H2,(H,21,25)(H2,22,23,26)/t14-,15+,18+/m0/s1	PYWNIQJEFPCHIF-HDMKZQKVSA-N	405.189985614							118181
BRD-K49282125	LSM-29631		54639291	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20-,21+/m1/s1	ZCGNSQNJACZJHF-NJYVYQBISA-N	OC[C@@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K49282125	BRD-K49282125-001-01-0	Broad Institute of MIT and Harvard	BRD-K49282125			OC[C@@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C23H36N4O4/c28-17-21-20(26-23(30)15-18-5-4-10-24-16-18)7-6-19(31-21)8-11-25-22(29)9-14-27-12-2-1-3-13-27/h4-5,10,16,19-21,28H,1-3,6-9,11-15,17H2,(H,25,29)(H,26,30)/t19-,20-,21+/m1/s1	ZCGNSQNJACZJHF-NJYVYQBISA-N	432.273655672							118182
BRD-K25423830	LSM-29632		54639458	InChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24-,26+/m0/s1	XNNPHUWWMNRDCG-LLZJGCNPSA-N	COc1ccccc1NC(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@@H]2CO	BroadT	BRD-K25423830	BRD-K25423830-001-01-4	Broad Institute of MIT and Harvard	BRD-K25423830			COc1ccccc1NC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@@H]1CO	InChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24-,26+/m0/s1	XNNPHUWWMNRDCG-LLZJGCNPSA-N	493.25767125							118183
BRD-K67563379	LSM-29633		54639345	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16+,17+/m1/s1	SVHHNONGWSEYCY-IKGGRYGDSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K67563379	BRD-K67563379-001-01-3	Broad Institute of MIT and Harvard	BRD-K67563379			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16+,17+/m1/s1	SVHHNONGWSEYCY-IKGGRYGDSA-N	378.159100056							118184
BRD-K86065375	LSM-29634		54639457	InChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24-,26-/m1/s1	XNNPHUWWMNRDCG-QIGHUWCUSA-N	COc1ccccc1NC(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@@H]2CO	BroadT	BRD-K86065375	BRD-K86065375-001-01-0	Broad Institute of MIT and Harvard	BRD-K86065375			COc1ccccc1NC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@@H]1CO	InChI=1S/C28H35N3O5/c1-35-25-10-6-5-9-23(25)29-28(34)30-24-12-11-22(36-26(24)19-32)18-27(33)31-15-13-21(14-16-31)17-20-7-3-2-4-8-20/h2-12,21-22,24,26,32H,13-19H2,1H3,(H2,29,30,34)/t22-,24-,26-/m1/s1	XNNPHUWWMNRDCG-QIGHUWCUSA-N	493.25767125							118185
BRD-K47271260	LSM-29635		54639256	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17+,20-/m1/s1	JOZKTRAUEBYZEE-FUHIMQAGSA-N	CN(C)Cc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)nn1	BroadT	BRD-K47271260	BRD-K47271260-001-01-0	Broad Institute of MIT and Harvard	BRD-K47271260			CN(C)Cc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)nn1	InChI=1S/C21H30N6O5/c1-26(2)10-15-11-27(25-24-15)8-7-16-4-5-17(20(12-28)32-16)23-21(29)22-14-3-6-18-19(9-14)31-13-30-18/h3,6,9,11,16-17,20,28H,4-5,7-8,10,12-13H2,1-2H3,(H2,22,23,29)/t16-,17+,20-/m1/s1	JOZKTRAUEBYZEE-FUHIMQAGSA-N	446.22776812							118186
BRD-K11457257	LSM-29636		54639421	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14-,15-/m1/s1	OYAPENMSDPHQGH-RBSFLKMASA-N	CN(C)C(=O)C[C@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	BroadT	BRD-K11457257	BRD-K11457257-001-01-2	Broad Institute of MIT and Harvard	BRD-K11457257			CN(C)C(=O)C[C@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C17H23FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-6,13-15,21H,7-10H2,1-2H3,(H,19,23)/t13-,14-,15-/m1/s1	OYAPENMSDPHQGH-RBSFLKMASA-N	338.164185436							118187
BRD-K78297750	LSM-29637		54639319	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20+,21-/m1/s1	AOROBJTWHRZKJU-HLAWJBBLSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CCNC(=O)Cc3ccccn3)O[C@@H]2CO	BroadT	BRD-K78297750	BRD-K78297750-001-01-4	Broad Institute of MIT and Harvard	BRD-K78297750			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCNC(=O)Cc2ccccn2)O[C@@H]1CO	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20+,21-/m1/s1	AOROBJTWHRZKJU-HLAWJBBLSA-N	463.177706368							118188
CHEMBL2135450	LSM-29638	BRD-K52175660, SID131435587	54639299	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19-,21+/m0/s1	KSHGYKMGUCEKKM-NBHGPNQESA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3ccccn3)CC[C@@H]1NS(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K52175660	BRD-K52175660-001-01-1	Broad Institute of MIT and Harvard	BRD-K52175660			OC[C@H]1O[C@H](CCn2cc(nn2)-c2ccccn2)CC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C21H24ClN5O4S/c22-15-4-3-5-17(12-15)32(29,30)25-19-8-7-16(31-21(19)14-28)9-11-27-13-20(24-26-27)18-6-1-2-10-23-18/h1-6,10,12-13,16,19,21,25,28H,7-9,11,14H2/t16-,19-,21+/m0/s1	KSHGYKMGUCEKKM-NBHGPNQESA-N	477.123752698							118189
BRD-K13792178	LSM-29639		54639350	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16+,17-/m0/s1	SVHHNONGWSEYCY-BBWFWOEESA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K13792178	BRD-K13792178-001-01-6	Broad Institute of MIT and Harvard	BRD-K13792178			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16+,17-/m0/s1	SVHHNONGWSEYCY-BBWFWOEESA-N	378.159100056							118190
BRD-K87158974	LSM-29640		54639454	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16-,17+/m0/s1	UXNIMKIHWHNNEY-BHYGNILZSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CC2)CC[C@@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K87158974	BRD-K87158974-001-01-7	Broad Institute of MIT and Harvard	BRD-K87158974			OC[C@H]1O[C@H](CCNC(=O)C2CC2)CC[C@@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16-,17+/m0/s1	UXNIMKIHWHNNEY-BHYGNILZSA-N	400.14682081							118191
BRD-K80877725	LSM-29641		54639271	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12-,13-/m0/s1	GIRVAELHWNMQPN-AVGNSLFASA-N	CC(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CC2)O[C@H]1CO	BroadT	BRD-K80877725	BRD-K80877725-001-01-1	Broad Institute of MIT and Harvard	BRD-K80877725			CC(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CC2)O[C@H]1CO	InChI=1S/C14H24N2O4/c1-9(18)16-12-5-4-11(20-13(12)8-17)6-7-15-14(19)10-2-3-10/h10-13,17H,2-8H2,1H3,(H,15,19)(H,16,18)/t11-,12-,13-/m0/s1	GIRVAELHWNMQPN-AVGNSLFASA-N	284.173607268							118192
BRD-K37304120	LSM-29642		54639415	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19+/m0/s1	YXHXOQQNNYPEQC-GBESFXJTSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(F)cc2)CC[C@@H]1NC(=O)NC3CCCC3	BroadT	BRD-K37304120	BRD-K37304120-001-01-1	Broad Institute of MIT and Harvard	BRD-K37304120			OC[C@H]1O[C@H](CC(=O)NCc2ccc(F)cc2)CC[C@@H]1NC(=O)NC1CCCC1	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19+/m0/s1	YXHXOQQNNYPEQC-GBESFXJTSA-N	407.22203467							118193
BRD-K13044705	LSM-29643		54639280	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16+,17-/m1/s1	SFXBWBNLRUAJJR-IXDOHACOSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K13044705	BRD-K13044705-001-01-4	Broad Institute of MIT and Harvard	BRD-K13044705			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16+,17-/m1/s1	SFXBWBNLRUAJJR-IXDOHACOSA-N	395.185649162							118194
BRD-K84178323	LSM-29644		54639171	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18+,19-/m1/s1	RRSRGJAXJRQFPD-NZSAHSFTSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K84178323	BRD-K84178323-001-01-6	Broad Institute of MIT and Harvard	BRD-K84178323			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18+,19-/m1/s1	RRSRGJAXJRQFPD-NZSAHSFTSA-N	444.173035558							118195
BRD-K72648699	LSM-29645		54639387	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15-/m1/s1	VFOAUUBLSWMNNG-QLFBSQMISA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	BroadT	BRD-K72648699	BRD-K72648699-001-01-8	Broad Institute of MIT and Harvard	BRD-K72648699			CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15-/m1/s1	VFOAUUBLSWMNNG-QLFBSQMISA-N	358.258005608							118196
BRD-K74285424	LSM-29646		54639434	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16-,18-/m1/s1	BMWSYQFQMBOYKL-JFIYKMOQSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)N3CCN(C)CC3)O[C@@H]2CO	BroadT	BRD-K74285424	BRD-K74285424-001-01-9	Broad Institute of MIT and Harvard	BRD-K74285424			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	InChI=1S/C20H31N3O6S/c1-22-9-11-23(12-10-22)20(25)13-15-7-8-16(18(14-24)29-15)21-30(26,27)19-6-4-3-5-17(19)28-2/h3-6,15-16,18,21,24H,7-14H2,1-2H3/t15-,16-,18-/m1/s1	BMWSYQFQMBOYKL-JFIYKMOQSA-N	441.193356432							118197
BRD-K12901964-001-01-2	LSM-29647	BRD-K12901964	54639187	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25+,26-/m1/s1	BTASCBMIIFGVQJ-DMTNHVFBSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@@H]2CO	BroadT	BRD-K12901964	BRD-K12901964-001-01-2	Broad Institute of MIT and Harvard	BRD-K12901964			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@@H]1CO	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25+,26-/m1/s1	BTASCBMIIFGVQJ-DMTNHVFBSA-N	498.218842898							118198
BRD-K58846294	LSM-29648		54639317	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20-,21-/m1/s1	AOROBJTWHRZKJU-HMXCVIKNSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CCNC(=O)Cc3ccccn3)O[C@@H]2CO	BroadT	BRD-K58846294	BRD-K58846294-001-01-5	Broad Institute of MIT and Harvard	BRD-K58846294			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CCNC(=O)Cc2ccccn2)O[C@@H]1CO	InChI=1S/C22H29N3O6S/c1-30-17-5-8-19(9-6-17)32(28,29)25-20-10-7-18(31-21(20)15-26)11-13-24-22(27)14-16-4-2-3-12-23-16/h2-6,8-9,12,18,20-21,25-26H,7,10-11,13-15H2,1H3,(H,24,27)/t18-,20-,21-/m1/s1	AOROBJTWHRZKJU-HMXCVIKNSA-N	463.177706368							118199
BRD-K32856496	LSM-29649		54639336	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9+,10-/m0/s1	RKZMUCFCOIAGGT-AEJSXWLSSA-N	CCC(=O)N[C@@H]1CC[C@@H](CC(=O)OC)O[C@H]1CO	BroadT	BRD-K32856496	BRD-K32856496-001-01-1	Broad Institute of MIT and Harvard	BRD-K32856496			CCC(=O)N[C@@H]1CC[C@@H](CC(=O)OC)O[C@H]1CO	InChI=1S/C12H21NO5/c1-3-11(15)13-9-5-4-8(6-12(16)17-2)18-10(9)7-14/h8-10,14H,3-7H2,1-2H3,(H,13,15)/t8-,9+,10-/m0/s1	RKZMUCFCOIAGGT-AEJSXWLSSA-N	259.141972782							118200
BRD-K48860650	LSM-29650		54639412	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18+,19+/m1/s1	YXHXOQQNNYPEQC-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(F)cc2)CC[C@@H]1NC(=O)NC3CCCC3	BroadT	BRD-K48860650	BRD-K48860650-001-01-7	Broad Institute of MIT and Harvard	BRD-K48860650			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(F)cc2)CC[C@@H]1NC(=O)NC1CCCC1	InChI=1S/C21H30FN3O4/c22-15-7-5-14(6-8-15)12-23-20(27)11-17-9-10-18(19(13-26)29-17)25-21(28)24-16-3-1-2-4-16/h5-8,16-19,26H,1-4,9-13H2,(H,23,27)(H2,24,25,28)/t17-,18+,19+/m1/s1	YXHXOQQNNYPEQC-QYZOEREBSA-N	407.22203467							118201
BRD-K91973560	LSM-29651		54639191	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21-/m1/s1	LTXSPIFYGNBEMC-DUXKGJEZSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K91973560	BRD-K91973560-001-01-3	Broad Institute of MIT and Harvard	BRD-K91973560			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4,6,12,17,20-21,29H,1-3,5,7-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21-/m1/s1	LTXSPIFYGNBEMC-DUXKGJEZSA-N	485.184811986							118202
BRD-K56384660	LSM-29652		54639184	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25-,26-/m1/s1	BTASCBMIIFGVQJ-LGPLSSKUSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@@H]2CO	BroadT	BRD-K56384660	BRD-K56384660-001-01-5	Broad Institute of MIT and Harvard	BRD-K56384660			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@@H]1CO	InChI=1S/C27H34N2O5S/c1-20-7-10-24(11-8-20)35(32,33)28-25-12-9-23(34-26(25)19-30)18-27(31)29-15-13-22(14-16-29)17-21-5-3-2-4-6-21/h2-12,22-23,25-26,28,30H,13-19H2,1H3/t23-,25-,26-/m1/s1	BTASCBMIIFGVQJ-LGPLSSKUSA-N	498.218842898							118203
BRD-K08715020	LSM-29653		54639453	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16-,17-/m0/s1	UXNIMKIHWHNNEY-XIRDDKMYSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CC2)CC[C@@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K08715020	BRD-K08715020-001-01-4	Broad Institute of MIT and Harvard	BRD-K08715020			OC[C@@H]1O[C@H](CCNC(=O)C2CC2)CC[C@@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C18H25FN2O5S/c19-13-2-1-3-15(10-13)27(24,25)21-16-7-6-14(26-17(16)11-22)8-9-20-18(23)12-4-5-12/h1-3,10,12,14,16-17,21-22H,4-9,11H2,(H,20,23)/t14-,16-,17-/m0/s1	UXNIMKIHWHNNEY-XIRDDKMYSA-N	400.14682081							118204
BRD-K17303020	LSM-29654		54639222	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19-/m1/s1	LVBUYUBXUUEMDY-CEXWTWQISA-N	OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K17303020	BRD-K17303020-001-01-8	Broad Institute of MIT and Harvard	BRD-K17303020			OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19-/m1/s1	LVBUYUBXUUEMDY-CEXWTWQISA-N	488.224654732							118205
BRD-K89935890	LSM-29655		54639209	InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22+,23-/m1/s1	AVWHUTQXLFJWQV-XPWALMASSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@@H]1NC(=O)c4ccccc4	BroadT	BRD-K89935890	BRD-K89935890-001-01-7	Broad Institute of MIT and Harvard	BRD-K89935890			OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@@H]1NC(=O)c1ccccc1	InChI=1S/C25H31N3O4/c29-18-23-22(26-25(31)19-7-3-1-4-8-19)12-11-21(32-23)17-24(30)28-15-13-27(14-16-28)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/t21-,22+,23-/m1/s1	AVWHUTQXLFJWQV-XPWALMASSA-N	437.231456502							118206
BRD-K73001304	LSM-29656		54639225	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19+/m0/s1	LVBUYUBXUUEMDY-GBESFXJTSA-N	OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K73001304	BRD-K73001304-001-01-6	Broad Institute of MIT and Harvard	BRD-K73001304			OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O5/c23-22(24,25)15-1-3-16(4-2-15)27-21(32)28-18-6-5-17(34-19(18)14-30)7-8-26-20(31)13-29-9-11-33-12-10-29/h1-4,17-19,30H,5-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19+/m0/s1	LVBUYUBXUUEMDY-GBESFXJTSA-N	488.224654732							118207
BRD-K94637240	LSM-29657		54639407	InChI=1S/C17H25Cl2N3O5S/c1-2-28(25,26)20-6-5-14-3-4-15(16(10-23)27-14)22-17(24)21-13-8-11(18)7-12(19)9-13/h7-9,14-16,20,23H,2-6,10H2,1H3,(H2,21,22,24)/t14-,15-,16+/m0/s1	SSRDXPKUDSQVJV-HRCADAONSA-N	CCS(=O)(=O)NCC[C@@H]1CC[C@H](NC(=O)Nc2cc(Cl)cc(Cl)c2)[C@@H](CO)O1	BroadT	BRD-K94637240	BRD-K94637240-001-01-9	Broad Institute of MIT and Harvard	BRD-K94637240			CCS(=O)(=O)NCC[C@@H]1CC[C@H](NC(=O)Nc2cc(Cl)cc(Cl)c2)[C@@H](CO)O1	InChI=1S/C17H25Cl2N3O5S/c1-2-28(25,26)20-6-5-14-3-4-15(16(10-23)27-14)22-17(24)21-13-8-11(18)7-12(19)9-13/h7-9,14-16,20,23H,2-6,10H2,1H3,(H2,21,22,24)/t14-,15-,16+/m0/s1	SSRDXPKUDSQVJV-HRCADAONSA-N	453.08919704							118208
BRD-K07420629	LSM-29658		54639405	InChI=1S/C17H25Cl2N3O5S/c1-2-28(25,26)20-6-5-14-3-4-15(16(10-23)27-14)22-17(24)21-13-8-11(18)7-12(19)9-13/h7-9,14-16,20,23H,2-6,10H2,1H3,(H2,21,22,24)/t14-,15+,16+/m0/s1	SSRDXPKUDSQVJV-ARFHVFGLSA-N	CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)Nc2cc(Cl)cc(Cl)c2)[C@@H](CO)O1	BroadT	BRD-K07420629	BRD-K07420629-001-01-7	Broad Institute of MIT and Harvard	BRD-K07420629			CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)Nc2cc(Cl)cc(Cl)c2)[C@@H](CO)O1	InChI=1S/C17H25Cl2N3O5S/c1-2-28(25,26)20-6-5-14-3-4-15(16(10-23)27-14)22-17(24)21-13-8-11(18)7-12(19)9-13/h7-9,14-16,20,23H,2-6,10H2,1H3,(H2,21,22,24)/t14-,15+,16+/m0/s1	SSRDXPKUDSQVJV-ARFHVFGLSA-N	453.08919704							118209
BRD-K40935524	LSM-29659		54639167	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18+,19+/m0/s1	RRSRGJAXJRQFPD-QXAKKESOSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K40935524	BRD-K40935524-001-01-9	Broad Institute of MIT and Harvard	BRD-K40935524			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C20H29FN2O6S/c21-15-1-4-17(5-2-15)30(26,27)22-10-7-16-3-6-18(19(13-24)29-16)23-20(25)14-8-11-28-12-9-14/h1-2,4-5,14,16,18-19,22,24H,3,6-13H2,(H,23,25)/t16-,18+,19+/m0/s1	RRSRGJAXJRQFPD-QXAKKESOSA-N	444.173035558							118210
BRD-K82394273	LSM-29660		54639404	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18+,19-/m0/s1	SNSIFAOUIDJYAO-UHOSZYNNSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K82394273	BRD-K82394273-001-01-1	Broad Institute of MIT and Harvard	BRD-K82394273			OC[C@@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18+,19-/m0/s1	SNSIFAOUIDJYAO-UHOSZYNNSA-N	484.154718468							118211
BRD-K60728944	LSM-29661		54639386	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15+/m1/s1	VFOAUUBLSWMNNG-KFWWJZLASA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)NCCCN(C)C)O[C@H]1CO	BroadT	BRD-K60728944	BRD-K60728944-001-01-5	Broad Institute of MIT and Harvard	BRD-K60728944			CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)NCCCN(C)C)O[C@H]1CO	InChI=1S/C17H34N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h12-15,22H,5-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15+/m1/s1	VFOAUUBLSWMNNG-KFWWJZLASA-N	358.258005608							118212
BRD-K77697841	LSM-29662		54639401	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18-,19-/m1/s1	SNSIFAOUIDJYAO-BHIYHBOVSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K77697841	BRD-K77697841-001-01-7	Broad Institute of MIT and Harvard	BRD-K77697841			OC[C@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18-,19-/m1/s1	SNSIFAOUIDJYAO-BHIYHBOVSA-N	484.154718468							118213
BRD-K25952063	LSM-29663		54639357	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18+,20-/m1/s1	BQBXUVFZTSPBJE-IMFGXOCKSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CCn3cc(nn3)C(C)C)O[C@@H]2CO	BroadT	BRD-K25952063	BRD-K25952063-001-01-0	Broad Institute of MIT and Harvard	BRD-K25952063			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCn2cc(nn2)C(C)C)O[C@@H]1CO	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18+,20-/m1/s1	BQBXUVFZTSPBJE-IMFGXOCKSA-N	438.19369079							118214
BRD-K68119260	LSM-29664		54639277	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16-,17-/m0/s1	SFXBWBNLRUAJJR-ULQDDVLXSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K68119260	BRD-K68119260-001-01-5	Broad Institute of MIT and Harvard	BRD-K68119260			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C19H26FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-4,15-17,24H,5-12H2,(H2,21,22,26)/t15-,16-,17-/m0/s1	SFXBWBNLRUAJJR-ULQDDVLXSA-N	395.185649162							118215
BRD-K53619784	LSM-29665		54639392	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18-,19-/m0/s1	JFCILRCMDYZKAM-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCC2)C=C[C@@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K53619784	BRD-K53619784-001-01-8	Broad Institute of MIT and Harvard	BRD-K53619784			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCC2)C=C[C@@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C21H29FN4O4/c22-15-3-5-16(6-4-15)24-21(29)25-18-8-7-17(30-19(18)14-27)13-20(28)23-9-12-26-10-1-2-11-26/h3-8,17-19,27H,1-2,9-14H2,(H,23,28)(H2,24,25,29)/t17-,18-,19-/m0/s1	JFCILRCMDYZKAM-FHWLQOOXSA-N	420.217283648							118216
BRD-K41993678	LSM-29666		54639213	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23-,24-/m1/s1	YALXHXGZPIMCNA-WXFUMESZSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)C4CCOCC4	BroadT	BRD-K41993678	BRD-K41993678-001-01-1	Broad Institute of MIT and Harvard	BRD-K41993678			OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)C1CCOCC1	InChI=1S/C26H30N2O5/c29-17-24-23(28-26(31)20-12-14-32-15-13-20)11-10-22(33-24)16-25(30)27-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-11,20,22-24,29H,12-17H2,(H,27,30)(H,28,31)/t22-,23-,24-/m1/s1	YALXHXGZPIMCNA-WXFUMESZSA-N	450.21547208							118217
BRD-K09378334	LSM-29667		54639409	InChI=1S/C17H25Cl2N3O5S/c1-2-28(25,26)20-6-5-14-3-4-15(16(10-23)27-14)22-17(24)21-13-8-11(18)7-12(19)9-13/h7-9,14-16,20,23H,2-6,10H2,1H3,(H2,21,22,24)/t14-,15-,16-/m1/s1	SSRDXPKUDSQVJV-BZUAXINKSA-N	CCS(=O)(=O)NCC[C@H]1CC[C@@H](NC(=O)Nc2cc(Cl)cc(Cl)c2)[C@@H](CO)O1	BroadT	BRD-K09378334	BRD-K09378334-001-01-1	Broad Institute of MIT and Harvard	BRD-K09378334			CCS(=O)(=O)NCC[C@H]1CC[C@@H](NC(=O)Nc2cc(Cl)cc(Cl)c2)[C@@H](CO)O1	InChI=1S/C17H25Cl2N3O5S/c1-2-28(25,26)20-6-5-14-3-4-15(16(10-23)27-14)22-17(24)21-13-8-11(18)7-12(19)9-13/h7-9,14-16,20,23H,2-6,10H2,1H3,(H2,21,22,24)/t14-,15-,16-/m1/s1	SSRDXPKUDSQVJV-BZUAXINKSA-N	453.08919704							118218
BRD-K14451397	LSM-29668		54639400	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18+,19-/m1/s1	SNSIFAOUIDJYAO-NZSAHSFTSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K14451397	BRD-K14451397-001-01-3	Broad Institute of MIT and Harvard	BRD-K14451397			OC[C@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C21H29ClN4O5S/c22-15-3-6-17(7-4-15)32(29,30)24-18-8-5-16(31-19(18)14-27)9-12-26-13-20(23-25-26)21(28)10-1-2-11-21/h3-4,6-7,13,16,18-19,24,27-28H,1-2,5,8-12,14H2/t16-,18+,19-/m1/s1	SNSIFAOUIDJYAO-NZSAHSFTSA-N	484.154718468							118219
BRD-K64222382	LSM-29669		54639353	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18-,20+/m0/s1	BQBXUVFZTSPBJE-XKGZKEIXSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)C(C)C)O[C@@H]2CO	BroadT	BRD-K64222382	BRD-K64222382-001-01-4	Broad Institute of MIT and Harvard	BRD-K64222382			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)C(C)C)O[C@@H]1CO	InChI=1S/C20H30N4O5S/c1-14(2)19-12-24(23-21-19)11-10-16-6-9-18(20(13-25)29-16)22-30(26,27)17-7-4-15(28-3)5-8-17/h4-5,7-8,12,14,16,18,20,22,25H,6,9-11,13H2,1-3H3/t16-,18-,20+/m0/s1	BQBXUVFZTSPBJE-XKGZKEIXSA-N	438.19369079							118220
BRD-K49467822	LSM-29670		54639240	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17+,18-/m1/s1	AGYKQGZRDSIEQP-FGTMMUONSA-N	OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K49467822	BRD-K49467822-001-01-3	Broad Institute of MIT and Harvard	BRD-K49467822			OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)C1CCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)15-3-1-4-15)6-5-16(28-18)13-19(25)21-7-2-8-23-9-11-27-12-10-23/h5-6,15-18,24H,1-4,7-14H2,(H,21,25)(H,22,26)/t16-,17+,18-/m1/s1	AGYKQGZRDSIEQP-FGTMMUONSA-N	395.242021186							118221
BRD-K26200435	LSM-29671		54639346	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16-,17-/m0/s1	SVHHNONGWSEYCY-ULQDDVLXSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K26200435	BRD-K26200435-001-01-4	Broad Institute of MIT and Harvard	BRD-K26200435			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H23FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-5,10,15-17,23H,6-9,11-12H2,(H,21,25)/t15-,16-,17-/m0/s1	SVHHNONGWSEYCY-ULQDDVLXSA-N	378.159100056							118222
BRD-K49415484	LSM-29672		54639369	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17-,18+/m0/s1	OCKURQXTXDTUJZ-RYQLBKOJSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2F)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K49415484	BRD-K49415484-001-01-1	Broad Institute of MIT and Harvard	BRD-K49415484			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2F)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17-,18+/m0/s1	OCKURQXTXDTUJZ-RYQLBKOJSA-N	459.1839346							118223
BRD-K13534347	LSM-29673		54639373	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17+,18-/m0/s1	OCKURQXTXDTUJZ-JQHSSLGASA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2F)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K13534347	BRD-K13534347-001-01-8	Broad Institute of MIT and Harvard	BRD-K13534347			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2F)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H30FN3O6S/c21-16-3-1-2-4-19(16)31(27,28)22-8-7-15-5-6-17(18(14-25)30-15)23-20(26)13-24-9-11-29-12-10-24/h1-4,15,17-18,22,25H,5-14H2,(H,23,26)/t15-,17+,18-/m0/s1	OCKURQXTXDTUJZ-JQHSSLGASA-N	459.1839346							118224
BRD-K55171585	LSM-29674		54639177	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18-,19-/m0/s1	UTHIGKUIGCKQQD-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C=C[C@@H]1NC(=O)Nc3ccccc3	BroadT	BRD-K55171585	BRD-K55171585-001-01-9	Broad Institute of MIT and Harvard	BRD-K55171585			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C=C[C@@H]1NC(=O)Nc1ccccc1	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18-,19-/m0/s1	UTHIGKUIGCKQQD-FHWLQOOXSA-N	396.179755288							118225
BRD-K28790383	LSM-29675		54639375	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17+,18+/m1/s1	NDIHUDUSPABKLT-NJAFHUGGSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K28790383	BRD-K28790383-001-01-4	Broad Institute of MIT and Harvard	BRD-K28790383			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H21FN4O5S/c20-13-1-4-16(5-2-13)30(27,28)24-17-6-3-15(29-18(17)11-25)9-19(26)22-10-14-7-8-21-12-23-14/h1-8,12,15,17-18,24-25H,9-11H2,(H,22,26)/t15-,17+,18+/m1/s1	NDIHUDUSPABKLT-NJAFHUGGSA-N	436.121668702							118226
BRD-K51335814	LSM-29676		54639175	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18+,19+/m1/s1	UTHIGKUIGCKQQD-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C=C[C@@H]1NC(=O)Nc3ccccc3	BroadT	BRD-K51335814	BRD-K51335814-001-01-7	Broad Institute of MIT and Harvard	BRD-K51335814			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C=C[C@@H]1NC(=O)Nc1ccccc1	InChI=1S/C21H24N4O4/c26-14-19-18(25-21(28)24-15-6-2-1-3-7-15)10-9-17(29-19)12-20(27)23-13-16-8-4-5-11-22-16/h1-11,17-19,26H,12-14H2,(H,23,27)(H2,24,25,28)/t17-,18+,19+/m1/s1	UTHIGKUIGCKQQD-QYZOEREBSA-N	396.179755288							118227
BRD-K81288057	LSM-13393		54638328	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21-,22+/m0/s1	INJNPRWYOQJIJD-ILWGZMRPSA-N	OC[C@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NS(=O)(=O)c4ccccc4F	BroadT	BRD-K81288057	BRD-K81288057-001-01-8	Broad Institute of MIT and Harvard	BRD-K81288057			OC[C@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21-,22+/m0/s1	INJNPRWYOQJIJD-ILWGZMRPSA-N	474.173704274							102033
BRD-K04831789	LSM-8727		54638401	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14-,15-/m0/s1	AKLLRXAVVXEIMF-KKUMJFAQSA-N	CN(C)C(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)c2ccc(F)cc2)C=C1	BroadT	BRD-K04831789	BRD-K04831789-001-01-4	Broad Institute of MIT and Harvard	BRD-K04831789			CN(C)C(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)c2ccc(F)cc2)C=C1	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14-,15-/m0/s1	AKLLRXAVVXEIMF-KKUMJFAQSA-N	336.148535372							97348
BRD-K41423295	LSM-14818		54638230	InChI=1S/C15H26N4O3/c16-12-4-3-11(22-13(12)10-20)5-8-19-9-14(17-18-19)15(21)6-1-2-7-15/h9,11-13,20-21H,1-8,10,16H2/t11-,12+,13-/m0/s1	YQJUMYRMLUKMMH-XQQFMLRXSA-N	N[C@@H]1CC[C@@H](CCn2cc(nn2)C3(O)CCCC3)O[C@H]1CO	BroadT	BRD-K41423295	BRD-K41423295-001-01-2	Broad Institute of MIT and Harvard	BRD-K41423295			N[C@@H]1CC[C@@H](CCn2cc(nn2)C2(O)CCCC2)O[C@H]1CO	InChI=1S/C15H26N4O3/c16-12-4-3-11(22-13(12)10-20)5-8-19-9-14(17-18-19)15(21)6-1-2-7-15/h9,11-13,20-21H,1-8,10,16H2/t11-,12+,13-/m0/s1	YQJUMYRMLUKMMH-XQQFMLRXSA-N	310.200490732							103474
CHEMBL2357302	LSM-11399	SID131434561, BRD-K48753787	54638284	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21-/m0/s1	GWEQQAXOIQTOQH-CZGNIMDHSA-N	C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K48753787	BRD-K48753787-001-01-0	Broad Institute of MIT and Harvard	BRD-K48753787			C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21-/m0/s1	GWEQQAXOIQTOQH-CZGNIMDHSA-N	409.200156374							100020
BRD-K47173028	LSM-11310		54638289	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21+/m0/s1	GWEQQAXOIQTOQH-LRGNLBRXSA-N	C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K47173028	BRD-K47173028-001-01-1	Broad Institute of MIT and Harvard	BRD-K47173028			C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21+/m0/s1	GWEQQAXOIQTOQH-LRGNLBRXSA-N	409.200156374							99931
BRD-K71302181	LSM-12786		54638351	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18+,21-/m0/s1	WGFFUWNETOGMCB-UEXGIBASSA-N	OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K71302181	BRD-K71302181-001-01-8	Broad Institute of MIT and Harvard	BRD-K71302181			OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18+,21-/m0/s1	WGFFUWNETOGMCB-UEXGIBASSA-N	478.242749468							101423
BRD-K27198844	LSM-10074		54638475	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17+,18-/m1/s1	ZOURSNKVQGBTHH-FGTMMUONSA-N	COCc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](CO)O2)nn1	BroadT	BRD-K27198844	BRD-K27198844-001-01-4	Broad Institute of MIT and Harvard	BRD-K27198844			COCc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](CO)O2)nn1	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17+,18-/m1/s1	ZOURSNKVQGBTHH-FGTMMUONSA-N	457.193688962							98695
BRD-K70983703	LSM-12761		54638338	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19-,21+/m1/s1	ASLPZONUTGKWLH-SBHAEUEKSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3CCCCC3)CC[C@H]1NC(=O)CN4CCOCC4	BroadT	BRD-K70983703	BRD-K70983703-001-01-5	Broad Institute of MIT and Harvard	BRD-K70983703			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2CCCCC2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19-,21+/m1/s1	ASLPZONUTGKWLH-SBHAEUEKSA-N	435.284554714							101398
BRD-K49781215	LSM-11453		54638336	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19+,21+/m0/s1	ASLPZONUTGKWLH-QKNQBKEWSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3CCCCC3)CC[C@H]1NC(=O)CN4CCOCC4	BroadT	BRD-K49781215	BRD-K49781215-001-01-2	Broad Institute of MIT and Harvard	BRD-K49781215			OC[C@H]1O[C@H](CCn2cc(nn2)C2CCCCC2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19+,21+/m0/s1	ASLPZONUTGKWLH-QKNQBKEWSA-N	435.284554714							100074
BRD-K01241136	LSM-8508		54638301	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15-,16+/m0/s1	ZKSUBHWMVQQNNI-HRCADAONSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H](NC(=O)Nc3c(C)onc3C)[C@@H](CO)O2	BroadT	BRD-K01241136	BRD-K01241136-001-01-9	Broad Institute of MIT and Harvard	BRD-K01241136			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H](NC(=O)Nc2c(C)noc2C)[C@@H](CO)O1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15-,16+/m0/s1	ZKSUBHWMVQQNNI-HRCADAONSA-N	409.232519142							97129
BRD-K56665985	LSM-11854		54638405	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14+,15-/m0/s1	AKLLRXAVVXEIMF-ZNMIVQPWSA-N	CN(C)C(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)c2ccc(F)cc2)C=C1	BroadT	BRD-K56665985	BRD-K56665985-001-01-5	Broad Institute of MIT and Harvard	BRD-K56665985			CN(C)C(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)c2ccc(F)cc2)C=C1	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14+,15-/m0/s1	AKLLRXAVVXEIMF-ZNMIVQPWSA-N	336.148535372							100480
BRD-K19770227	LSM-9624		54638517	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18+,19+/m1/s1	ZAZOOTZCNDNOOW-NEWSRXKRSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](CO)O1	BroadT	BRD-K19770227	BRD-K19770227-001-01-7	Broad Institute of MIT and Harvard	BRD-K19770227			CN(C)CCCNC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](CO)O1	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18+,19+/m1/s1	ZAZOOTZCNDNOOW-NEWSRXKRSA-N	427.214091876							98245
BRD-K48571121	LSM-11385		54638262	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21+/m1/s1	VZUMNNKKGVSTKF-CEQIKUNHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K48571121	BRD-K48571121-001-01-1	Broad Institute of MIT and Harvard	BRD-K48571121			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21+/m1/s1	VZUMNNKKGVSTKF-CEQIKUNHSA-N	475.155491886							100006
BRD-K74964997	LSM-13023		54638384	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15-,16-/m1/s1	LJTZBZLXVQJQJX-BZUAXINKSA-N	COCCNC(=O)C[C@H]1CC[C@@H](NC(=O)NC2CCCCC2)[C@@H](CO)O1	BroadT	BRD-K74964997	BRD-K74964997-001-01-6	Broad Institute of MIT and Harvard	BRD-K74964997			COCCNC(=O)C[C@H]1CC[C@@H](NC(=O)NC2CCCCC2)[C@@H](CO)O1	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15-,16-/m1/s1	LJTZBZLXVQJQJX-BZUAXINKSA-N	371.242021186							101660
BRD-K26003427	LSM-10006		54638398	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14+,15+/m0/s1	AKLLRXAVVXEIMF-RRFJBIMHSA-N	CN(C)C(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)c2ccc(F)cc2)C=C1	BroadT	BRD-K26003427	BRD-K26003427-001-01-2	Broad Institute of MIT and Harvard	BRD-K26003427			CN(C)C(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)c2ccc(F)cc2)C=C1	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14+,15+/m0/s1	AKLLRXAVVXEIMF-RRFJBIMHSA-N	336.148535372							98627
BRD-K16752617	LSM-9440		54638218	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15-,16+/m0/s1	SOYBDXBXTZOLGY-HRCADAONSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccccc2)CC[C@@H]1NC(=O)C3CC3	BroadT	BRD-K16752617	BRD-K16752617-001-01-6	Broad Institute of MIT and Harvard	BRD-K16752617			OC[C@H]1O[C@H](CC(=O)Nc2ccccc2)CC[C@@H]1NC(=O)C1CC1	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15-,16+/m0/s1	SOYBDXBXTZOLGY-HRCADAONSA-N	332.173607268							98061
BRD-K97748079	LSM-14436		54638314	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25+,26+/m1/s1	JXWMWOXWMMUZLT-AFESJLNVSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@H]2CO	BroadT	BRD-K97748079	BRD-K97748079-001-01-7	Broad Institute of MIT and Harvard	BRD-K97748079			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25+,26+/m1/s1	JXWMWOXWMMUZLT-AFESJLNVSA-N	516.229407582							103091
BRD-K71032175	LSM-12763		54638349	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18-,21+/m1/s1	WGFFUWNETOGMCB-OPYAIIAOSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K71032175	BRD-K71032175-001-01-9	Broad Institute of MIT and Harvard	BRD-K71032175			OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18-,21+/m1/s1	WGFFUWNETOGMCB-OPYAIIAOSA-N	478.242749468							101400
BRD-K72299443	LSM-12860		54638259	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21-/m1/s1	VZUMNNKKGVSTKF-QLVMHMETSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K72299443	BRD-K72299443-001-01-9	Broad Institute of MIT and Harvard	BRD-K72299443			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21-/m1/s1	VZUMNNKKGVSTKF-QLVMHMETSA-N	475.155491886							101497
BRD-K79944151	LSM-13307		54638393	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17-,19+/m1/s1	BDFFQCHCBQOAPA-LMMKCTJWSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@H](CCNC(=O)C3CCOCC3)O[C@H]2CO	BroadT	BRD-K79944151	BRD-K79944151-001-01-5	Broad Institute of MIT and Harvard	BRD-K79944151			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17-,19+/m1/s1	BDFFQCHCBQOAPA-LMMKCTJWSA-N	456.193022074							101946
BRD-K02117849	LSM-8563		54638463	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14-,16-/m1/s1	QWCXAENNPFGWBU-IIAWOOMASA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K02117849	BRD-K02117849-001-01-8	Broad Institute of MIT and Harvard	BRD-K02117849			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14-,16-/m1/s1	QWCXAENNPFGWBU-IIAWOOMASA-N	363.17942093							97184
BRD-K44996602	LSM-11167		54638380	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26-/m1/s1	HIZAXMBYTZOIAT-UODIDJSMSA-N	COc1cccc(NC(=O)N[C@H]2C=C[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO)c1	BroadT	BRD-K44996602	BRD-K44996602-001-01-2	Broad Institute of MIT and Harvard	BRD-K44996602			COc1cccc(NC(=O)N[C@H]2C=C[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@@H]2CO)c1	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26-/m1/s1	HIZAXMBYTZOIAT-UODIDJSMSA-N	487.210721058							99788
BRD-K12034032-001-01-0	LSM-29677	BRD-K12034032	54638237	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16+,17-/m1/s1	RNIDAHWWXILMTD-IXDOHACOSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K12034032	BRD-K12034032-001-01-0	Broad Institute of MIT and Harvard	BRD-K12034032			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)NC1CCCCC1	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16+,17-/m1/s1	RNIDAHWWXILMTD-IXDOHACOSA-N	381.226371122							118228
BRD-K40608370	LSM-10911		54638274	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16+,17+/m1/s1	VHNINRJVEBHVBF-IKGGRYGDSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2CO	BroadT	BRD-K40608370	BRD-K40608370-001-01-7	Broad Institute of MIT and Harvard	BRD-K40608370			Cn1cnc(c1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16+,17+/m1/s1	VHNINRJVEBHVBF-IKGGRYGDSA-N	428.209340854							99532
BRD-K21463062	LSM-9729		54638400	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14+,15+/m1/s1	AKLLRXAVVXEIMF-ILXRZTDVSA-N	CN(C)C(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)c2ccc(F)cc2)C=C1	BroadT	BRD-K21463062	BRD-K21463062-001-01-3	Broad Institute of MIT and Harvard	BRD-K21463062			CN(C)C(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)c2ccc(F)cc2)C=C1	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14+,15+/m1/s1	AKLLRXAVVXEIMF-ILXRZTDVSA-N	336.148535372							98350
BRD-K30620974	LSM-10270		54638457	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18-,19-/m0/s1	XLDWFJCTUAPIOT-WDSOQIARSA-N	OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K30620974	BRD-K30620974-001-01-4	Broad Institute of MIT and Harvard	BRD-K30620974			OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18-,19-/m0/s1	XLDWFJCTUAPIOT-WDSOQIARSA-N	471.1839346							98891
BRD-K40225343	LSM-10883		54638354	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19-,20-/m0/s1	ADNYLXRIKBBTKJ-UFYCRDLUSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K40225343	BRD-K40225343-001-01-4	Broad Institute of MIT and Harvard	BRD-K40225343			Cn1cnc(c1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@H]1CO	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19-,20-/m0/s1	ADNYLXRIKBBTKJ-UFYCRDLUSA-N	475.188939768							99504
BRD-K82986138	LSM-13496		54638504	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24-,27+/m0/s1	IKYPBPDRSBKALY-NLJOTIRTSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K82986138	BRD-K82986138-001-01-9	Broad Institute of MIT and Harvard	BRD-K82986138			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24-,27+/m0/s1	IKYPBPDRSBKALY-NLJOTIRTSA-N	518.20530132							102137
BRD-K38542964	LSM-10764		54638273	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16+,17+/m0/s1	VHNINRJVEBHVBF-GVDBMIGSSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2CO	BroadT	BRD-K38542964	BRD-K38542964-001-01-4	Broad Institute of MIT and Harvard	BRD-K38542964			Cn1cnc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16+,17+/m0/s1	VHNINRJVEBHVBF-GVDBMIGSSA-N	428.209340854							99385
BRD-K57166447	LSM-11891		54638219	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15-,16+/m1/s1	SOYBDXBXTZOLGY-OAGGEKHMSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccccc2)CC[C@H]1NC(=O)C3CC3	BroadT	BRD-K57166447	BRD-K57166447-001-01-5	Broad Institute of MIT and Harvard	BRD-K57166447			OC[C@@H]1O[C@@H](CC(=O)Nc2ccccc2)CC[C@H]1NC(=O)C1CC1	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15-,16+/m1/s1	SOYBDXBXTZOLGY-OAGGEKHMSA-N	332.173607268							100517
BRD-K94690761	LSM-14231		54638330	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21+,22-/m1/s1	INJNPRWYOQJIJD-BAGYTPMASA-N	OC[C@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NS(=O)(=O)c4ccccc4F	BroadT	BRD-K94690761	BRD-K94690761-001-01-7	Broad Institute of MIT and Harvard	BRD-K94690761			OC[C@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21+,22-/m1/s1	INJNPRWYOQJIJD-BAGYTPMASA-N	474.173704274							102885
BRD-K09852122	LSM-9031		54638402	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14-,15+/m0/s1	AKLLRXAVVXEIMF-SOUVJXGZSA-N	CN(C)C(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)c2ccc(F)cc2)C=C1	BroadT	BRD-K09852122	BRD-K09852122-001-01-1	Broad Institute of MIT and Harvard	BRD-K09852122			CN(C)C(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)c2ccc(F)cc2)C=C1	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14-,15+/m0/s1	AKLLRXAVVXEIMF-SOUVJXGZSA-N	336.148535372							97652
BRD-K99055802	LSM-14511		54638223	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20+,21+/m1/s1	SKMIIEGWSYGYOW-GIVPXCGWSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NCCc3ccncc3)O[C@H]2CO	BroadT	BRD-K99055802	BRD-K99055802-001-01-9	Broad Institute of MIT and Harvard	BRD-K99055802			COc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCCc2ccncc2)O[C@H]1CO	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20+,21+/m1/s1	SKMIIEGWSYGYOW-GIVPXCGWSA-N	461.162056304							103166
BRD-K78849449	LSM-13243		54638485	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21+/m0/s1	YLLZUOSUTCBCJJ-CEDBRAGKSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K78849449	BRD-K78849449-001-01-9	Broad Institute of MIT and Harvard	BRD-K78849449			C[C@H](NC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21+/m0/s1	YLLZUOSUTCBCJJ-CEDBRAGKSA-N	450.162470874							101882
BRD-K33038714	LSM-10436		54638522	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18+,19-/m1/s1	ZAZOOTZCNDNOOW-NZSAHSFTSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](CO)O1	BroadT	BRD-K33038714	BRD-K33038714-001-01-1	Broad Institute of MIT and Harvard	BRD-K33038714			CN(C)CCCNC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](CO)O1	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18+,19-/m1/s1	ZAZOOTZCNDNOOW-NZSAHSFTSA-N	427.214091876							99057
BRD-K43374517	LSM-11065		54638344	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18+,21+/m0/s1	WGFFUWNETOGMCB-WAOWUJCRSA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K43374517	BRD-K43374517-001-01-7	Broad Institute of MIT and Harvard	BRD-K43374517			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18+,21+/m0/s1	WGFFUWNETOGMCB-WAOWUJCRSA-N	478.242749468							99686
BRD-K27720649	LSM-10099		54638419	InChI=1S/C15H21F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h3-4,9-12,21H,1-2,5-8H2,(H,19,22)(H,20,23)/t10-,11+,12-/m0/s1	QQIOQVYYWJVUEN-TUAOUCFPSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C=C[C@H]1NC(=O)CC2CC2	BroadT	BRD-K27720649	BRD-K27720649-001-01-2	Broad Institute of MIT and Harvard	BRD-K27720649			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C=C[C@H]1NC(=O)CC1CC1	InChI=1S/C15H21F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h3-4,9-12,21H,1-2,5-8H2,(H,19,22)(H,20,23)/t10-,11+,12-/m0/s1	QQIOQVYYWJVUEN-TUAOUCFPSA-N	350.145341772							98720
BRD-K82071478	LSM-13442		54638468	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14+,16-/m0/s1	QWCXAENNPFGWBU-LZWOXQAQSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K82071478	BRD-K82071478-001-01-8	Broad Institute of MIT and Harvard	BRD-K82071478			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14+,16-/m0/s1	QWCXAENNPFGWBU-LZWOXQAQSA-N	363.17942093							102082
BRD-K66640841	LSM-12486		54638424	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16+/m1/s1	IXKFMJFBYVYICU-PMPSAXMXSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2c(C)onc2C)C=C1	BroadT	BRD-K66640841	BRD-K66640841-001-01-0	Broad Institute of MIT and Harvard	BRD-K66640841			CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2c(C)noc2C)C=C1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16+/m1/s1	IXKFMJFBYVYICU-PMPSAXMXSA-N	409.232519142							101117
BRD-K85194284	LSM-13634		54638472	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17-,18+/m1/s1	ZOURSNKVQGBTHH-KURKYZTESA-N	COCc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](CO)O2)nn1	BroadT	BRD-K85194284	BRD-K85194284-001-01-9	Broad Institute of MIT and Harvard	BRD-K85194284			COCc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](CO)O2)nn1	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17-,18+/m1/s1	ZOURSNKVQGBTHH-KURKYZTESA-N	457.193688962							102281
BRD-K09929530	LSM-9038		54638252	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17-,18+/m1/s1	JVYCUASVIANWPE-KURKYZTESA-N	CC(C)NC(=O)NCC[C@H]1CC[C@@H](NC(=O)CCN2CCCCC2)[C@H](CO)O1	BroadT	BRD-K09929530	BRD-K09929530-001-01-3	Broad Institute of MIT and Harvard	BRD-K09929530			CC(C)NC(=O)NCC[C@H]1CC[C@@H](NC(=O)CCN2CCCCC2)[C@H](CO)O1	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17-,18+/m1/s1	JVYCUASVIANWPE-KURKYZTESA-N	398.289305736							97659
BRD-K85055995	LSM-13622		54638247	InChI=1S/C9H15NO4/c1-13-9(12)4-6-2-3-7(10)8(5-11)14-6/h2-3,6-8,11H,4-5,10H2,1H3/t6-,7+,8+/m1/s1	PDEPTYJJYHVXNY-CSMHCCOUSA-N	COC(=O)C[C@@H]1O[C@@H](CO)[C@@H](N)C=C1	BroadT	BRD-K85055995	BRD-K85055995-001-01-2	Broad Institute of MIT and Harvard	BRD-K85055995			COC(=O)C[C@@H]1O[C@@H](CO)[C@@H](N)C=C1	InChI=1S/C9H15NO4/c1-13-9(12)4-6-2-3-7(10)8(5-11)14-6/h2-3,6-8,11H,4-5,10H2,1H3/t6-,7+,8+/m1/s1	PDEPTYJJYHVXNY-CSMHCCOUSA-N	201.10010797							102269
BRD-K49172498	LSM-11418		54638375	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26+/m0/s1	HIZAXMBYTZOIAT-JIMJEQGWSA-N	COc1cccc(NC(=O)N[C@@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO)c1	BroadT	BRD-K49172498	BRD-K49172498-001-01-2	Broad Institute of MIT and Harvard	BRD-K49172498			COc1cccc(NC(=O)N[C@@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@@H]2CO)c1	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26+/m0/s1	HIZAXMBYTZOIAT-JIMJEQGWSA-N	487.210721058							100039
BRD-K08240821	LSM-8925		54638325	InChI=1S/C23H28F2N4O5/c1-33-16-5-3-15(4-6-16)27-23(32)28-19-9-7-17(34-21(19)13-30)10-11-26-22(31)29-20-12-14(24)2-8-18(20)25/h2-6,8,12,17,19,21,30H,7,9-11,13H2,1H3,(H2,26,29,31)(H2,27,28,32)/t17-,19-,21+/m0/s1	CXRYDROHJOKZNG-HFSMHLIXSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@@H]2CO)cc1	BroadT	BRD-K08240821	BRD-K08240821-001-01-4	Broad Institute of MIT and Harvard	BRD-K08240821			COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@@H]2CO)cc1	InChI=1S/C23H28F2N4O5/c1-33-16-5-3-15(4-6-16)27-23(32)28-19-9-7-17(34-21(19)13-30)10-11-26-22(31)29-20-12-14(24)2-8-18(20)25/h2-6,8,12,17,19,21,30H,7,9-11,13H2,1H3,(H2,26,29,31)(H2,27,28,32)/t17-,19-,21+/m0/s1	CXRYDROHJOKZNG-HFSMHLIXSA-N	478.202776436							97546
BRD-K69886508	LSM-12695		54638317	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25-,26+/m0/s1	JXWMWOXWMMUZLT-AYRHNUGRSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@@H]2CO	BroadT	BRD-K69886508	BRD-K69886508-001-01-0	Broad Institute of MIT and Harvard	BRD-K69886508			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@@H]1CO	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25-,26+/m0/s1	JXWMWOXWMMUZLT-AYRHNUGRSA-N	516.229407582							101329
BRD-K18999740	LSM-9565		54638340	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19-,21-/m0/s1	ASLPZONUTGKWLH-ZJOUEHCJSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3CCCCC3)CC[C@@H]1NC(=O)CN4CCOCC4	BroadT	BRD-K18999740	BRD-K18999740-001-01-1	Broad Institute of MIT and Harvard	BRD-K18999740			OC[C@@H]1O[C@H](CCn2cc(nn2)C2CCCCC2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19-,21-/m0/s1	ASLPZONUTGKWLH-ZJOUEHCJSA-N	435.284554714							98186
BRD-K49290616	LSM-11426		54638372	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17-,18+/m1/s1	KXCVLZMSFBFHGZ-KURKYZTESA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K49290616	BRD-K49290616-001-01-9	Broad Institute of MIT and Harvard	BRD-K49290616			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17-,18+/m1/s1	KXCVLZMSFBFHGZ-KURKYZTESA-N	402.170333456							100047
BRD-K50808811	LSM-11528		54638409	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19-,21-/m0/s1	XCDRDXJNPKYISK-ZRCAFCQKSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2CO	BroadT	BRD-K50808811	BRD-K50808811-001-01-7	Broad Institute of MIT and Harvard	BRD-K50808811			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@H]1CO	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19-,21-/m0/s1	XCDRDXJNPKYISK-ZRCAFCQKSA-N	495.132776414							100151
BRD-K03257659	LSM-14687		54638258	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17+,21+/m1/s1	VZUMNNKKGVSTKF-KUDFPVQQSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K03257659	BRD-K03257659-001-01-0	Broad Institute of MIT and Harvard	BRD-K03257659			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17+,21+/m1/s1	VZUMNNKKGVSTKF-KUDFPVQQSA-N	475.155491886							103343
BRD-K83388394	LSM-13523		54638294	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21-/m1/s1	GWEQQAXOIQTOQH-RZXSNQJFSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K83388394	BRD-K83388394-001-01-6	Broad Institute of MIT and Harvard	BRD-K83388394			C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21-/m1/s1	GWEQQAXOIQTOQH-RZXSNQJFSA-N	409.200156374							102164
BRD-K44635753	LSM-11143		54638261	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21+/m0/s1	VZUMNNKKGVSTKF-HZUJVAHNSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K44635753	BRD-K44635753-001-01-3	Broad Institute of MIT and Harvard	BRD-K44635753			OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21+/m0/s1	VZUMNNKKGVSTKF-HZUJVAHNSA-N	475.155491886							99764
BRD-K39728090	LSM-10847		54638256	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17+,18-/m0/s1	JVYCUASVIANWPE-KSZLIROESA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)CCN2CCCCC2)[C@H](CO)O1	BroadT	BRD-K39728090	BRD-K39728090-001-01-5	Broad Institute of MIT and Harvard	BRD-K39728090			CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)CCN2CCCCC2)[C@H](CO)O1	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17+,18-/m0/s1	JVYCUASVIANWPE-KSZLIROESA-N	398.289305736							99468
BRD-K71156053	LSM-12773		54638388	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15+,16-/m1/s1	LJTZBZLXVQJQJX-OWCLPIDISA-N	COCCNC(=O)C[C@H]1CC[C@H](NC(=O)NC2CCCCC2)[C@@H](CO)O1	BroadT	BRD-K71156053	BRD-K71156053-001-01-3	Broad Institute of MIT and Harvard	BRD-K71156053			COCCNC(=O)C[C@H]1CC[C@H](NC(=O)NC2CCCCC2)[C@@H](CO)O1	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15+,16-/m1/s1	LJTZBZLXVQJQJX-OWCLPIDISA-N	371.242021186							101410
BRD-K95982530	LSM-14314		54638369	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17-,18-/m1/s1	KXCVLZMSFBFHGZ-KZNAEPCWSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncn2)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K95982530	BRD-K95982530-001-01-7	Broad Institute of MIT and Harvard	BRD-K95982530			OC[C@H]1O[C@@H](CC(=O)NCc2ccncn2)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17-,18-/m1/s1	KXCVLZMSFBFHGZ-KZNAEPCWSA-N	402.170333456							102968
BRD-K61219693	LSM-12135		54638396	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17+,19-/m1/s1	BDFFQCHCBQOAPA-ZIFCJYIRSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@H](CCNC(=O)C3CCOCC3)O[C@@H]2CO	BroadT	BRD-K61219693	BRD-K61219693-001-01-7	Broad Institute of MIT and Harvard	BRD-K61219693			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17+,19-/m1/s1	BDFFQCHCBQOAPA-ZIFCJYIRSA-N	456.193022074							100761
CHEMBL2361250	LSM-13987	BRD-K90089455, SID131434803	54638524	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20+/m0/s1	JTIOTWTUDVMQPE-XUVXKRRUSA-N	OC[C@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)Nc3ccc(Cl)cc3	BroadT	BRD-K90089455	BRD-K90089455-001-01-7	Broad Institute of MIT and Harvard	BRD-K90089455			OC[C@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20+/m0/s1	JTIOTWTUDVMQPE-XUVXKRRUSA-N	446.172083094							102640
BRD-K52191731-001-01-3	LSM-29678	BRD-K52191731	54638214	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15+,16+/m0/s1	SOYBDXBXTZOLGY-ARFHVFGLSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccccc2)CC[C@H]1NC(=O)C3CC3	BroadT	BRD-K52191731	BRD-K52191731-001-01-3	Broad Institute of MIT and Harvard	BRD-K52191731			OC[C@H]1O[C@H](CC(=O)Nc2ccccc2)CC[C@H]1NC(=O)C1CC1	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15+,16+/m0/s1	SOYBDXBXTZOLGY-ARFHVFGLSA-N	332.173607268							118229
BRD-K99533437	LSM-14542		54638348	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18-,21+/m0/s1	WGFFUWNETOGMCB-BBTUJRGHSA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K99533437	BRD-K99533437-001-01-8	Broad Institute of MIT and Harvard	BRD-K99533437			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18-,21+/m0/s1	WGFFUWNETOGMCB-BBTUJRGHSA-N	478.242749468							103197
BRD-K19303070	LSM-9589		54638254	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17-,18-/m0/s1	JVYCUASVIANWPE-BZSNNMDCSA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@H](NC(=O)CCN2CCCCC2)[C@H](CO)O1	BroadT	BRD-K19303070	BRD-K19303070-001-01-5	Broad Institute of MIT and Harvard	BRD-K19303070			CC(C)NC(=O)NCC[C@@H]1CC[C@H](NC(=O)CCN2CCCCC2)[C@H](CO)O1	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17-,18-/m0/s1	JVYCUASVIANWPE-BZSNNMDCSA-N	398.289305736							98210
BRD-K89114227	LSM-13914		54638246	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18+,21-/m0/s1	WVRHSCPXBJSNMQ-CDXJDZJCSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K89114227	BRD-K89114227-001-01-3	Broad Institute of MIT and Harvard	BRD-K89114227			OC[C@@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18+,21-/m0/s1	WVRHSCPXBJSNMQ-CDXJDZJCSA-N	496.10709956							102567
BRD-K98099906	LSM-14460		54638345	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18+,21+/m1/s1	WGFFUWNETOGMCB-LQWHRVPQSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K98099906	BRD-K98099906-001-01-3	Broad Institute of MIT and Harvard	BRD-K98099906			OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18+,21+/m1/s1	WGFFUWNETOGMCB-LQWHRVPQSA-N	478.242749468							103115
BRD-K39430900	LSM-10822		54638391	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17+,19+/m1/s1	BDFFQCHCBQOAPA-AOIWGVFYSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@H](CCNC(=O)C3CCOCC3)O[C@H]2CO	BroadT	BRD-K39430900	BRD-K39430900-001-01-8	Broad Institute of MIT and Harvard	BRD-K39430900			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17+,19+/m1/s1	BDFFQCHCBQOAPA-AOIWGVFYSA-N	456.193022074							99443
BRD-K99115033	LSM-14515		54638467	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14+,16-/m1/s1	QWCXAENNPFGWBU-IJEWVQPXSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K99115033	BRD-K99115033-001-01-2	Broad Institute of MIT and Harvard	BRD-K99115033			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14+,16-/m1/s1	QWCXAENNPFGWBU-IJEWVQPXSA-N	363.17942093							103170
BRD-K80127972-001-01-1	LSM-29679	BRD-K80127972	54638215	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15+,16+/m1/s1	SOYBDXBXTZOLGY-PMPSAXMXSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccccc2)CC[C@@H]1NC(=O)C3CC3	BroadT	BRD-K80127972	BRD-K80127972-001-01-1	Broad Institute of MIT and Harvard	BRD-K80127972			OC[C@@H]1O[C@@H](CC(=O)Nc2ccccc2)CC[C@@H]1NC(=O)C1CC1	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15+,16+/m1/s1	SOYBDXBXTZOLGY-PMPSAXMXSA-N	332.173607268							118230
BRD-K65437607	LSM-12419		54638319	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25+,26-/m1/s1	JXWMWOXWMMUZLT-DMTNHVFBSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@@H]2CO	BroadT	BRD-K65437607	BRD-K65437607-001-01-6	Broad Institute of MIT and Harvard	BRD-K65437607			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@@H]1CO	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25+,26-/m1/s1	JXWMWOXWMMUZLT-DMTNHVFBSA-N	516.229407582							101046
BRD-K04632406	LSM-8713		54638239	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18+,21+/m0/s1	WVRHSCPXBJSNMQ-YRISNDGFSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K04632406	BRD-K04632406-001-01-9	Broad Institute of MIT and Harvard	BRD-K04632406			OC[C@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18+,21+/m0/s1	WVRHSCPXBJSNMQ-YRISNDGFSA-N	496.10709956							97334
BRD-K55806039	LSM-11808		54638280	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16+,17-/m0/s1	VHNINRJVEBHVBF-BBWFWOEESA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2CO	BroadT	BRD-K55806039	BRD-K55806039-001-01-2	Broad Institute of MIT and Harvard	BRD-K55806039			Cn1cnc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16+,17-/m0/s1	VHNINRJVEBHVBF-BBWFWOEESA-N	428.209340854							100433
BRD-K98062568	LSM-14458		54638406	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19+,21+/m0/s1	XCDRDXJNPKYISK-NYSBEXSLSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@@H]2CO	BroadT	BRD-K98062568	BRD-K98062568-001-01-0	Broad Institute of MIT and Harvard	BRD-K98062568			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@@H]1CO	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19+,21+/m0/s1	XCDRDXJNPKYISK-NYSBEXSLSA-N	495.132776414							103113
BRD-K74550836	LSM-12994		54638335	InChI=1S/C19H27N3O5S/c23-10-17-16(22-19(25)13-4-7-26-8-5-13)2-1-15(27-17)9-18(24)20-6-3-14-11-28-12-21-14/h1-2,11-13,15-17,23H,3-10H2,(H,20,24)(H,22,25)/t15-,16-,17+/m0/s1	QCPIRAQCKOOPTJ-YESZJQIVSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2cscn2)C=C[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K74550836	BRD-K74550836-001-01-8	Broad Institute of MIT and Harvard	BRD-K74550836			OC[C@H]1O[C@H](CC(=O)NCCc2cscn2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C19H27N3O5S/c23-10-17-16(22-19(25)13-4-7-26-8-5-13)2-1-15(27-17)9-18(24)20-6-3-14-11-28-12-21-14/h1-2,11-13,15-17,23H,3-10H2,(H,20,24)(H,22,25)/t15-,16-,17+/m0/s1	QCPIRAQCKOOPTJ-YESZJQIVSA-N	409.167141684							101631
BRD-K63922933	LSM-12327		54638498	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20-,21-/m0/s1	ZTKNNPSVJPUDLJ-JBACZVJFSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K63922933	BRD-K63922933-001-01-4	Broad Institute of MIT and Harvard	BRD-K63922933			OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20-,21-/m0/s1	ZTKNNPSVJPUDLJ-JBACZVJFSA-N	486.129456184							100954
BRD-K13860832	LSM-9266		54638451	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21-,23+/m1/s1	USGDOGGJJOICMT-XPNTWCBSSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@H]1NC(=O)c4cnccn4	BroadT	BRD-K13860832	BRD-K13860832-001-01-9	Broad Institute of MIT and Harvard	BRD-K13860832			OC[C@@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@H]1NC(=O)c1cnccn1	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21-,23+/m1/s1	USGDOGGJJOICMT-XPNTWCBSSA-N	450.22670548							97887
BRD-K07727895	LSM-8894		54638234	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16-,17-/m0/s1	RNIDAHWWXILMTD-ULQDDVLXSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K07727895	BRD-K07727895-001-01-2	Broad Institute of MIT and Harvard	BRD-K07727895			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)NC1CCCCC1	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16-,17-/m0/s1	RNIDAHWWXILMTD-ULQDDVLXSA-N	381.226371122							97515
BRD-K63671514	LSM-12307		54638432	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16+,18+/m1/s1	YJKUDHPPBXQQCK-RYRKJORJSA-N	COc1ccccc1CNC(=O)C[C@@H]2O[C@@H](CO)[C@@H](NC(=O)CN(C)C)C=C2	BroadT	BRD-K63671514	BRD-K63671514-001-01-4	Broad Institute of MIT and Harvard	BRD-K63671514			COc1ccccc1CNC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)CN(C)C)C=C1	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16+,18+/m1/s1	YJKUDHPPBXQQCK-RYRKJORJSA-N	391.210721058							100934
CHEMBL2361745	LSM-9986	BRD-K25646871, SID131434512	54638235	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16-,17+/m0/s1	RNIDAHWWXILMTD-YESZJQIVSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K25646871	BRD-K25646871-001-01-0	Broad Institute of MIT and Harvard	BRD-K25646871			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)NC1CCCCC1	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16-,17+/m0/s1	RNIDAHWWXILMTD-YESZJQIVSA-N	381.226371122							98607
BRD-K29312193	LSM-10203		54638309	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18-,19-/m1/s1	WMHOVAQHNBVIPJ-BHIYHBOVSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K29312193	BRD-K29312193-001-01-6	Broad Institute of MIT and Harvard	BRD-K29312193			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18-,19-/m1/s1	WMHOVAQHNBVIPJ-BHIYHBOVSA-N	467.128169362							98824
BRD-K54964414	LSM-11758		54638415	InChI=1S/C15H21F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h3-4,9-12,21H,1-2,5-8H2,(H,19,22)(H,20,23)/t10-,11-,12-/m0/s1	QQIOQVYYWJVUEN-SRVKXCTJSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C=C[C@@H]1NC(=O)CC2CC2	BroadT	BRD-K54964414	BRD-K54964414-001-01-5	Broad Institute of MIT and Harvard	BRD-K54964414			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C=C[C@@H]1NC(=O)CC1CC1	InChI=1S/C15H21F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h3-4,9-12,21H,1-2,5-8H2,(H,19,22)(H,20,23)/t10-,11-,12-/m0/s1	QQIOQVYYWJVUEN-SRVKXCTJSA-N	350.145341772							100383
BRD-K42743267	LSM-11027		54638412	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19+,21-/m1/s1	XCDRDXJNPKYISK-MFMILTCTSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@@H]2CO	BroadT	BRD-K42743267	BRD-K42743267-001-01-6	Broad Institute of MIT and Harvard	BRD-K42743267			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@@H]1CO	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19+,21-/m1/s1	XCDRDXJNPKYISK-MFMILTCTSA-N	495.132776414							99648
BRD-K99775849	LSM-14558		54638272	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17+,21-/m0/s1	WCJFLIIYNCSVNP-XPIZARPCSA-N	COc1ccccc1c2cn(CC[C@@H]3CC[C@@H](NC(=O)c4cnccn4)[C@H](CO)O3)nn2	BroadT	BRD-K99775849	BRD-K99775849-001-01-7	Broad Institute of MIT and Harvard	BRD-K99775849			COc1ccccc1-c1cn(CC[C@@H]2CC[C@@H](NC(=O)c3cnccn3)[C@H](CO)O2)nn1	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17+,21-/m0/s1	WCJFLIIYNCSVNP-XPIZARPCSA-N	438.201553372							103214
BRD-K80723382	LSM-13364		54638350	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18+,21-/m1/s1	WGFFUWNETOGMCB-LVCYWYKZSA-N	OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K80723382	BRD-K80723382-001-01-1	Broad Institute of MIT and Harvard	BRD-K80723382			OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18+,21-/m1/s1	WGFFUWNETOGMCB-LVCYWYKZSA-N	478.242749468							102003
BRD-K56189188	LSM-11825		54638249	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17+,18+/m0/s1	JVYCUASVIANWPE-RCCFBDPRSA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)CCN2CCCCC2)[C@@H](CO)O1	BroadT	BRD-K56189188	BRD-K56189188-001-01-1	Broad Institute of MIT and Harvard	BRD-K56189188			CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)CCN2CCCCC2)[C@@H](CO)O1	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17+,18+/m0/s1	JVYCUASVIANWPE-RCCFBDPRSA-N	398.289305736							100450
BRD-K76454674	LSM-13105		54638455	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18+,19+/m1/s1	XLDWFJCTUAPIOT-NEWSRXKRSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K76454674	BRD-K76454674-001-01-6	Broad Institute of MIT and Harvard	BRD-K76454674			OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18+,19+/m1/s1	XLDWFJCTUAPIOT-NEWSRXKRSA-N	471.1839346							101743
BRD-K65395273	LSM-12416		54638224	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20-,21-/m1/s1	SKMIIEGWSYGYOW-HMXCVIKNSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2CO	BroadT	BRD-K65395273	BRD-K65395273-001-01-9	Broad Institute of MIT and Harvard	BRD-K65395273			COc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NCCc2ccncc2)O[C@@H]1CO	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20-,21-/m1/s1	SKMIIEGWSYGYOW-HMXCVIKNSA-N	461.162056304							101043
BRD-K26038019	LSM-10007		54638508	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19+/m0/s1	PBTCYEHOLZFKGG-IPMKNSEASA-N	CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	BroadT	BRD-K26038019	BRD-K26038019-001-01-2	Broad Institute of MIT and Harvard	BRD-K26038019			CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19+/m0/s1	PBTCYEHOLZFKGG-IPMKNSEASA-N	387.215806438							98628
BRD-K04009734	LSM-8675		54638365	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18+,19-/m1/s1	VGDFEWNPUKUXSQ-CEXWTWQISA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C=C[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K04009734	BRD-K04009734-001-01-3	Broad Institute of MIT and Harvard	BRD-K04009734			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C=C[C@@H]1NC(=O)c1cccnc1	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18+,19-/m1/s1	VGDFEWNPUKUXSQ-CEXWTWQISA-N	402.22670548							97296
BRD-K92958239	LSM-14130		54638520	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18-,19+/m0/s1	ZAZOOTZCNDNOOW-YTQUADARSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](CO)O1	BroadT	BRD-K92958239	BRD-K92958239-001-01-4	Broad Institute of MIT and Harvard	BRD-K92958239			CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](CO)O1	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18-,19+/m0/s1	ZAZOOTZCNDNOOW-YTQUADARSA-N	427.214091876							102784
BRD-K60151092	LSM-12067		54638360	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18+,19+/m1/s1	VGDFEWNPUKUXSQ-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C=C[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K60151092	BRD-K60151092-001-01-0	Broad Institute of MIT and Harvard	BRD-K60151092			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C=C[C@@H]1NC(=O)c1cccnc1	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18+,19+/m1/s1	VGDFEWNPUKUXSQ-QYZOEREBSA-N	402.22670548							100693
BRD-K26327304	LSM-10025		54638296	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21+/m1/s1	GWEQQAXOIQTOQH-RCOXNQKVSA-N	C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K26327304	BRD-K26327304-001-01-3	Broad Institute of MIT and Harvard	BRD-K26327304			C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21+/m1/s1	GWEQQAXOIQTOQH-RCOXNQKVSA-N	409.200156374							98646
BRD-K90338784	LSM-13996		54638376	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26+/m1/s1	HIZAXMBYTZOIAT-ZNZIZOMTSA-N	COc1cccc(NC(=O)N[C@H]2C=C[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO)c1	BroadT	BRD-K90338784	BRD-K90338784-001-01-0	Broad Institute of MIT and Harvard	BRD-K90338784			COc1cccc(NC(=O)N[C@H]2C=C[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@H]2CO)c1	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26+/m1/s1	HIZAXMBYTZOIAT-ZNZIZOMTSA-N	487.210721058							102649
BRD-K64344970	LSM-12355		54638248	InChI=1S/C9H15NO4/c1-13-9(12)4-6-2-3-7(10)8(5-11)14-6/h2-3,6-8,11H,4-5,10H2,1H3/t6-,7+,8-/m0/s1	PDEPTYJJYHVXNY-RNJXMRFFSA-N	COC(=O)C[C@H]1O[C@@H](CO)[C@H](N)C=C1	BroadT	BRD-K64344970	BRD-K64344970-001-01-4	Broad Institute of MIT and Harvard	BRD-K64344970			COC(=O)C[C@H]1O[C@@H](CO)[C@H](N)C=C1	InChI=1S/C9H15NO4/c1-13-9(12)4-6-2-3-7(10)8(5-11)14-6/h2-3,6-8,11H,4-5,10H2,1H3/t6-,7+,8-/m0/s1	PDEPTYJJYHVXNY-RNJXMRFFSA-N	201.10010797							100982
BRD-K14471942	LSM-9305		54638452	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21+,23-/m1/s1	USGDOGGJJOICMT-FUPPJEDESA-N	OC[C@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@@H]1NC(=O)c4cnccn4	BroadT	BRD-K14471942	BRD-K14471942-001-01-1	Broad Institute of MIT and Harvard	BRD-K14471942			OC[C@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@@H]1NC(=O)c1cnccn1	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21+,23-/m1/s1	USGDOGGJJOICMT-FUPPJEDESA-N	450.22670548							97926
BRD-K49417484	LSM-11431		54638462	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14+,16+/m1/s1	QWCXAENNPFGWBU-YCPHGPKFSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K49417484	BRD-K49417484-001-01-7	Broad Institute of MIT and Harvard	BRD-K49417484			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14+,16+/m1/s1	QWCXAENNPFGWBU-YCPHGPKFSA-N	363.17942093							100052
BRD-K11062991	LSM-9102		54638448	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21+,23+/m1/s1	USGDOGGJJOICMT-GIWBLDEGSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@@H]1NC(=O)c4cnccn4	BroadT	BRD-K11062991	BRD-K11062991-001-01-1	Broad Institute of MIT and Harvard	BRD-K11062991			OC[C@@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@@H]1NC(=O)c1cnccn1	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21+,23+/m1/s1	USGDOGGJJOICMT-GIWBLDEGSA-N	450.22670548							97723
BRD-K24658364	LSM-9925		54638245	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18-,21+/m0/s1	WVRHSCPXBJSNMQ-DJPFJPOOSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K24658364	BRD-K24658364-001-01-0	Broad Institute of MIT and Harvard	BRD-K24658364			OC[C@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18-,21+/m0/s1	WVRHSCPXBJSNMQ-DJPFJPOOSA-N	496.10709956							98546
BRD-K89609393	LSM-13954		54638321	InChI=1S/C23H28F2N4O5/c1-33-16-5-3-15(4-6-16)27-23(32)28-19-9-7-17(34-21(19)13-30)10-11-26-22(31)29-20-12-14(24)2-8-18(20)25/h2-6,8,12,17,19,21,30H,7,9-11,13H2,1H3,(H2,26,29,31)(H2,27,28,32)/t17-,19-,21+/m1/s1	CXRYDROHJOKZNG-QFUCXCTJSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@H]2CO)cc1	BroadT	BRD-K89609393	BRD-K89609393-001-01-0	Broad Institute of MIT and Harvard	BRD-K89609393			COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@H]2CO)cc1	InChI=1S/C23H28F2N4O5/c1-33-16-5-3-15(4-6-16)27-23(32)28-19-9-7-17(34-21(19)13-30)10-11-26-22(31)29-20-12-14(24)2-8-18(20)25/h2-6,8,12,17,19,21,30H,7,9-11,13H2,1H3,(H2,26,29,31)(H2,27,28,32)/t17-,19-,21+/m1/s1	CXRYDROHJOKZNG-QFUCXCTJSA-N	478.202776436							102607
BRD-K33891131	LSM-10481		54638221	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15+,16-/m0/s1	SOYBDXBXTZOLGY-XHSDSOJGSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccccc2)CC[C@H]1NC(=O)C3CC3	BroadT	BRD-K33891131	BRD-K33891131-001-01-8	Broad Institute of MIT and Harvard	BRD-K33891131			OC[C@@H]1O[C@H](CC(=O)Nc2ccccc2)CC[C@H]1NC(=O)C1CC1	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15+,16-/m0/s1	SOYBDXBXTZOLGY-XHSDSOJGSA-N	332.173607268							99102
BRD-K08369728	LSM-8931		54638342	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19+,21-/m1/s1	ASLPZONUTGKWLH-SVFBPWRDSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3CCCCC3)CC[C@@H]1NC(=O)CN4CCOCC4	BroadT	BRD-K08369728	BRD-K08369728-001-01-5	Broad Institute of MIT and Harvard	BRD-K08369728			OC[C@H]1O[C@@H](CCn2cc(nn2)C2CCCCC2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19+,21-/m1/s1	ASLPZONUTGKWLH-SVFBPWRDSA-N	435.284554714							97552
BRD-K19696710	LSM-9620		54638422	InChI=1S/C17H32N2O5S/c1-2-25(22,23)18-11-10-14-8-9-15(16(12-20)24-14)19-17(21)13-6-4-3-5-7-13/h13-16,18,20H,2-12H2,1H3,(H,19,21)/t14-,15+,16-/m0/s1	NFMKQITUWMOCLJ-XHSDSOJGSA-N	CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)C2CCCCC2)[C@H](CO)O1	BroadT	BRD-K19696710	BRD-K19696710-001-01-8	Broad Institute of MIT and Harvard	BRD-K19696710			CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)C2CCCCC2)[C@H](CO)O1	InChI=1S/C17H32N2O5S/c1-2-25(22,23)18-11-10-14-8-9-15(16(12-20)24-14)19-17(21)13-6-4-3-5-7-13/h13-16,18,20H,2-12H2,1H3,(H,19,21)/t14-,15+,16-/m0/s1	NFMKQITUWMOCLJ-XHSDSOJGSA-N	376.203192834							98241
CHEMBL2355882	LSM-14101	BRD-K92493271, SID131434804	54638525	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20+/m1/s1	JTIOTWTUDVMQPE-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)Nc3ccc(Cl)cc3	BroadT	BRD-K92493271	BRD-K92493271-001-01-1	Broad Institute of MIT and Harvard	BRD-K92493271			OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20+/m1/s1	JTIOTWTUDVMQPE-AABGKKOBSA-N	446.172083094							102755
BRD-K57055053	LSM-11885		54638410	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19-,21+/m0/s1	XCDRDXJNPKYISK-PAXLWEDBSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@@H]2CO	BroadT	BRD-K57055053	BRD-K57055053-001-01-5	Broad Institute of MIT and Harvard	BRD-K57055053			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@@H]1CO	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19-,21+/m0/s1	XCDRDXJNPKYISK-PAXLWEDBSA-N	495.132776414							100511
BRD-K21549522	LSM-9737		54638337	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19+,21+/m1/s1	ASLPZONUTGKWLH-DYXWJJEUSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3CCCCC3)CC[C@@H]1NC(=O)CN4CCOCC4	BroadT	BRD-K21549522	BRD-K21549522-001-01-3	Broad Institute of MIT and Harvard	BRD-K21549522			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2CCCCC2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19+,21+/m1/s1	ASLPZONUTGKWLH-DYXWJJEUSA-N	435.284554714							98358
BRD-K01711704	LSM-8543		54638502	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24-,27-/m1/s1	IKYPBPDRSBKALY-FKCDAAJZSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K01711704	BRD-K01711704-001-01-3	Broad Institute of MIT and Harvard	BRD-K01711704			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24-,27-/m1/s1	IKYPBPDRSBKALY-FKCDAAJZSA-N	518.20530132							97164
BRD-K60703313	LSM-12097		54638436	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16-,18+/m1/s1	YJKUDHPPBXQQCK-NUJGCVRESA-N	COc1ccccc1CNC(=O)C[C@@H]2O[C@@H](CO)[C@H](NC(=O)CN(C)C)C=C2	BroadT	BRD-K60703313	BRD-K60703313-001-01-1	Broad Institute of MIT and Harvard	BRD-K60703313			COc1ccccc1CNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)CN(C)C)C=C1	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16-,18+/m1/s1	YJKUDHPPBXQQCK-NUJGCVRESA-N	391.210721058							100723
BRD-K25427024	LSM-9973		54638231	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16+,17+/m0/s1	RNIDAHWWXILMTD-GVDBMIGSSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K25427024	BRD-K25427024-001-01-1	Broad Institute of MIT and Harvard	BRD-K25427024			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)NC1CCCCC1	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16+,17+/m0/s1	RNIDAHWWXILMTD-GVDBMIGSSA-N	381.226371122							98594
BRD-K55013500	LSM-11763		54638305	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18+,19+/m0/s1	WMHOVAQHNBVIPJ-QXAKKESOSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K55013500	BRD-K55013500-001-01-5	Broad Institute of MIT and Harvard	BRD-K55013500			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18+,19+/m0/s1	WMHOVAQHNBVIPJ-QXAKKESOSA-N	467.128169362							100388
BRD-K53359544	LSM-11683		54638430	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16-/m0/s1	IXKFMJFBYVYICU-XHSDSOJGSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Nc2c(C)onc2C)C=C1	BroadT	BRD-K53359544	BRD-K53359544-001-01-2	Broad Institute of MIT and Harvard	BRD-K53359544			CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Nc2c(C)noc2C)C=C1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16-/m0/s1	IXKFMJFBYVYICU-XHSDSOJGSA-N	409.232519142							100308
BRD-K79184162	LSM-13267		54638240	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18+,21+/m1/s1	WVRHSCPXBJSNMQ-MMOPVJDHSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K79184162	BRD-K79184162-001-01-5	Broad Institute of MIT and Harvard	BRD-K79184162			OC[C@@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18+,21+/m1/s1	WVRHSCPXBJSNMQ-MMOPVJDHSA-N	496.10709956							101906
BRD-K76688996	LSM-13124		54638390	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17+,19+/m0/s1	BDFFQCHCBQOAPA-YQVWRLOYSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@@H](CCNC(=O)C3CCOCC3)O[C@@H]2CO	BroadT	BRD-K76688996	BRD-K76688996-001-01-0	Broad Institute of MIT and Harvard	BRD-K76688996			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17+,19+/m0/s1	BDFFQCHCBQOAPA-YQVWRLOYSA-N	456.193022074							101762
BRD-K14159335	LSM-9282		54638464	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14-,16-/m0/s1	QWCXAENNPFGWBU-DZKIICNBSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K14159335	BRD-K14159335-001-01-7	Broad Institute of MIT and Harvard	BRD-K14159335			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14-,16-/m0/s1	QWCXAENNPFGWBU-DZKIICNBSA-N	363.17942093							97903
BRD-K63376220	LSM-12286		54638431	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16+,18+/m0/s1	YJKUDHPPBXQQCK-LZLYRXPVSA-N	COc1ccccc1CNC(=O)C[C@H]2O[C@H](CO)[C@H](NC(=O)CN(C)C)C=C2	BroadT	BRD-K63376220	BRD-K63376220-001-01-5	Broad Institute of MIT and Harvard	BRD-K63376220			COc1ccccc1CNC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)CN(C)C)C=C1	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16+,18+/m0/s1	YJKUDHPPBXQQCK-LZLYRXPVSA-N	391.210721058							100912
BRD-K38011931	LSM-10731		54638489	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21-/m1/s1	YLLZUOSUTCBCJJ-DPDLHNOKSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K38011931	BRD-K38011931-001-01-0	Broad Institute of MIT and Harvard	BRD-K38011931			C[C@@H](NC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21-/m1/s1	YLLZUOSUTCBCJJ-DPDLHNOKSA-N	450.162470874							99352
BRD-K13428252	LSM-9233		54638442	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13+,14-/m1/s1	DUQQDWAUZUWJHX-DDTOSNHZSA-N	NCC[C@H]1CC[C@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	BroadT	BRD-K13428252	BRD-K13428252-001-01-6	Broad Institute of MIT and Harvard	BRD-K13428252			NCC[C@H]1CC[C@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13+,14-/m1/s1	DUQQDWAUZUWJHX-DDTOSNHZSA-N	296.153620752							97854
BRD-K48724570	LSM-11398		54638471	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17-,18-/m1/s1	ZOURSNKVQGBTHH-KZNAEPCWSA-N	COCc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](CO)O2)nn1	BroadT	BRD-K48724570	BRD-K48724570-001-01-2	Broad Institute of MIT and Harvard	BRD-K48724570			COCc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](CO)O2)nn1	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17-,18-/m1/s1	ZOURSNKVQGBTHH-KZNAEPCWSA-N	457.193688962							100019
BRD-K67780021	LSM-12559		54638225	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20-,21-/m0/s1	SKMIIEGWSYGYOW-JBACZVJFSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2CO	BroadT	BRD-K67780021	BRD-K67780021-001-01-5	Broad Institute of MIT and Harvard	BRD-K67780021			COc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCCc2ccncc2)O[C@H]1CO	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20-,21-/m0/s1	SKMIIEGWSYGYOW-JBACZVJFSA-N	461.162056304							101190
BRD-K45711268	LSM-11215		54638449	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21-,23-/m1/s1	USGDOGGJJOICMT-MQSCRBSSSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@H]1NC(=O)c4cnccn4	BroadT	BRD-K45711268	BRD-K45711268-001-01-9	Broad Institute of MIT and Harvard	BRD-K45711268			OC[C@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@H]1NC(=O)c1cnccn1	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21-,23-/m1/s1	USGDOGGJJOICMT-MQSCRBSSSA-N	450.22670548							99836
BRD-K06158553	LSM-8785		54638367	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17+,18+/m0/s1	KXCVLZMSFBFHGZ-RCCFBDPRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K06158553	BRD-K06158553-001-01-4	Broad Institute of MIT and Harvard	BRD-K06158553			OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17+,18+/m0/s1	KXCVLZMSFBFHGZ-RCCFBDPRSA-N	402.170333456							97406
BRD-K01316590	LSM-8514		54638279	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16+,17-/m1/s1	VHNINRJVEBHVBF-IXDOHACOSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2CO	BroadT	BRD-K01316590	BRD-K01316590-001-01-8	Broad Institute of MIT and Harvard	BRD-K01316590			Cn1cnc(c1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16+,17-/m1/s1	VHNINRJVEBHVBF-IXDOHACOSA-N	428.209340854							97135
BRD-K19251038	LSM-9586		54638361	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18-,19-/m1/s1	VGDFEWNPUKUXSQ-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C=C[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K19251038	BRD-K19251038-001-01-7	Broad Institute of MIT and Harvard	BRD-K19251038			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C=C[C@H]1NC(=O)c1cccnc1	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18-,19-/m1/s1	VGDFEWNPUKUXSQ-GUDVDZBRSA-N	402.22670548							98207
BRD-K50611992	LSM-11508		54638503	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24-,27-/m0/s1	IKYPBPDRSBKALY-DPZBCOQUSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K50611992	BRD-K50611992-001-01-6	Broad Institute of MIT and Harvard	BRD-K50611992			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24-,27-/m0/s1	IKYPBPDRSBKALY-DPZBCOQUSA-N	518.20530132							100129
BRD-K85208848	LSM-13638		54638518	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18-,19-/m1/s1	ZAZOOTZCNDNOOW-BHIYHBOVSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](CO)O1	BroadT	BRD-K85208848	BRD-K85208848-001-01-6	Broad Institute of MIT and Harvard	BRD-K85208848			CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](CO)O1	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18-,19-/m1/s1	ZAZOOTZCNDNOOW-BHIYHBOVSA-N	427.214091876							102285
BRD-K53619921	LSM-11692		54638339	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19-,21-/m1/s1	ASLPZONUTGKWLH-SFHLNBCPSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3CCCCC3)CC[C@H]1NC(=O)CN4CCOCC4	BroadT	BRD-K53619921	BRD-K53619921-001-01-2	Broad Institute of MIT and Harvard	BRD-K53619921			OC[C@H]1O[C@@H](CCn2cc(nn2)C2CCCCC2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19-,21-/m1/s1	ASLPZONUTGKWLH-SFHLNBCPSA-N	435.284554714							100317
BRD-K17554130	LSM-9484		54638222	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20+,21+/m0/s1	SKMIIEGWSYGYOW-CEWLAPEOSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2CO	BroadT	BRD-K17554130	BRD-K17554130-001-01-3	Broad Institute of MIT and Harvard	BRD-K17554130			COc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCc2ccncc2)O[C@@H]1CO	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20+,21+/m0/s1	SKMIIEGWSYGYOW-CEWLAPEOSA-N	461.162056304							98105
BRD-K93330237	LSM-14152		54638505	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24-,27+/m1/s1	IKYPBPDRSBKALY-OASJLCFRSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K93330237	BRD-K93330237-001-01-7	Broad Institute of MIT and Harvard	BRD-K93330237			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24-,27+/m1/s1	IKYPBPDRSBKALY-OASJLCFRSA-N	518.20530132							102806
BRD-K88617254	LSM-13875		54638368	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17+,18+/m1/s1	KXCVLZMSFBFHGZ-SQNIBIBYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)CC[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K88617254	BRD-K88617254-001-01-2	Broad Institute of MIT and Harvard	BRD-K88617254			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17+,18+/m1/s1	KXCVLZMSFBFHGZ-SQNIBIBYSA-N	402.170333456							102528
BRD-K97489107	LSM-14421		54638356	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19-,20+/m1/s1	ADNYLXRIKBBTKJ-AQNXPRMDSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K97489107	BRD-K97489107-001-01-4	Broad Institute of MIT and Harvard	BRD-K97489107			Cn1cnc(c1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@H]1CO	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19-,20+/m1/s1	ADNYLXRIKBBTKJ-AQNXPRMDSA-N	475.188939768							103076
BRD-K06650679	LSM-8817		54638323	InChI=1S/C23H28F2N4O5/c1-33-16-5-3-15(4-6-16)27-23(32)28-19-9-7-17(34-21(19)13-30)10-11-26-22(31)29-20-12-14(24)2-8-18(20)25/h2-6,8,12,17,19,21,30H,7,9-11,13H2,1H3,(H2,26,29,31)(H2,27,28,32)/t17-,19-,21-/m0/s1	CXRYDROHJOKZNG-CUWPLCDZSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@H]2CO)cc1	BroadT	BRD-K06650679	BRD-K06650679-001-01-9	Broad Institute of MIT and Harvard	BRD-K06650679			COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@H]2CO)cc1	InChI=1S/C23H28F2N4O5/c1-33-16-5-3-15(4-6-16)27-23(32)28-19-9-7-17(34-21(19)13-30)10-11-26-22(31)29-20-12-14(24)2-8-18(20)25/h2-6,8,12,17,19,21,30H,7,9-11,13H2,1H3,(H2,26,29,31)(H2,27,28,32)/t17-,19-,21-/m0/s1	CXRYDROHJOKZNG-CUWPLCDZSA-N	478.202776436							97438
BRD-K92593565	LSM-14104		54638477	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21-/m0/s1	YLLZUOSUTCBCJJ-MTOHEIAKSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K92593565	BRD-K92593565-001-01-3	Broad Institute of MIT and Harvard	BRD-K92593565			C[C@H](NC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21-/m0/s1	YLLZUOSUTCBCJJ-MTOHEIAKSA-N	450.162470874							102758
BRD-K09454555	LSM-9003		54638490	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21+/m0/s1	YLLZUOSUTCBCJJ-DZLUEKEQSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K09454555	BRD-K09454555-001-01-2	Broad Institute of MIT and Harvard	BRD-K09454555			C[C@H](NC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21+/m0/s1	YLLZUOSUTCBCJJ-DZLUEKEQSA-N	450.162470874							97624
BRD-K23688566	LSM-9854		54638433	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16-,18-/m1/s1	YJKUDHPPBXQQCK-JFIYKMOQSA-N	COc1ccccc1CNC(=O)C[C@@H]2O[C@H](CO)[C@H](NC(=O)CN(C)C)C=C2	BroadT	BRD-K23688566	BRD-K23688566-001-01-4	Broad Institute of MIT and Harvard	BRD-K23688566			COc1ccccc1CNC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)CN(C)C)C=C1	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16-,18-/m1/s1	YJKUDHPPBXQQCK-JFIYKMOQSA-N	391.210721058							98475
BRD-K00314651	LSM-8444		54638316	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25-,26-/m0/s1	JXWMWOXWMMUZLT-RNXOBYDBSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@H]2CO	BroadT	BRD-K00314651	BRD-K00314651-001-01-0	Broad Institute of MIT and Harvard	BRD-K00314651			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25-,26-/m0/s1	JXWMWOXWMMUZLT-RNXOBYDBSA-N	516.229407582							97065
BRD-K91924645	LSM-14078		54638456	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18-,19-/m1/s1	XLDWFJCTUAPIOT-BHIYHBOVSA-N	OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K91924645	BRD-K91924645-001-01-5	Broad Institute of MIT and Harvard	BRD-K91924645			OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18-,19-/m1/s1	XLDWFJCTUAPIOT-BHIYHBOVSA-N	471.1839346							102732
BRD-K35470597	LSM-10557		54638425	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16-/m1/s1	IXKFMJFBYVYICU-BZUAXINKSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Nc2c(C)onc2C)C=C1	BroadT	BRD-K35470597	BRD-K35470597-001-01-6	Broad Institute of MIT and Harvard	BRD-K35470597			CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Nc2c(C)noc2C)C=C1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16-/m1/s1	IXKFMJFBYVYICU-BZUAXINKSA-N	409.232519142							99178
BRD-K52178187	LSM-11619		54638324	InChI=1S/C23H28F2N4O5/c1-33-16-5-3-15(4-6-16)27-23(32)28-19-9-7-17(34-21(19)13-30)10-11-26-22(31)29-20-12-14(24)2-8-18(20)25/h2-6,8,12,17,19,21,30H,7,9-11,13H2,1H3,(H2,26,29,31)(H2,27,28,32)/t17-,19+,21-/m1/s1	CXRYDROHJOKZNG-SLYNCCJLSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@@H]2CO)cc1	BroadT	BRD-K52178187	BRD-K52178187-001-01-9	Broad Institute of MIT and Harvard	BRD-K52178187			COc1ccc(NC(=O)N[C@H]2CC[C@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@@H]2CO)cc1	InChI=1S/C23H28F2N4O5/c1-33-16-5-3-15(4-6-16)27-23(32)28-19-9-7-17(34-21(19)13-30)10-11-26-22(31)29-20-12-14(24)2-8-18(20)25/h2-6,8,12,17,19,21,30H,7,9-11,13H2,1H3,(H2,26,29,31)(H2,27,28,32)/t17-,19+,21-/m1/s1	CXRYDROHJOKZNG-SLYNCCJLSA-N	478.202776436							100243
BRD-K91508497	LSM-14050		54638521	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18-,19+/m1/s1	ZAZOOTZCNDNOOW-QRQLOZEOSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](CO)O1	BroadT	BRD-K91508497	BRD-K91508497-001-01-5	Broad Institute of MIT and Harvard	BRD-K91508497			CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](CO)O1	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18-,19+/m1/s1	ZAZOOTZCNDNOOW-QRQLOZEOSA-N	427.214091876							102703
BRD-K12888055	LSM-9195		54638438	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16+,18-/m0/s1	YJKUDHPPBXQQCK-JZXOWHBKSA-N	COc1ccccc1CNC(=O)C[C@H]2O[C@@H](CO)[C@H](NC(=O)CN(C)C)C=C2	BroadT	BRD-K12888055	BRD-K12888055-001-01-1	Broad Institute of MIT and Harvard	BRD-K12888055			COc1ccccc1CNC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)CN(C)C)C=C1	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16+,18-/m0/s1	YJKUDHPPBXQQCK-JZXOWHBKSA-N	391.210721058							97816
BRD-K60809157	LSM-12108		54638441	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13-,14+/m1/s1	DUQQDWAUZUWJHX-HONMWMINSA-N	NCC[C@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@H](CO)O1	BroadT	BRD-K60809157	BRD-K60809157-001-01-5	Broad Institute of MIT and Harvard	BRD-K60809157			NCC[C@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@H](CO)O1	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13-,14+/m1/s1	DUQQDWAUZUWJHX-HONMWMINSA-N	296.153620752							100734
BRD-K62724755	LSM-12235		54638366	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18+,19-/m0/s1	VGDFEWNPUKUXSQ-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C=C[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K62724755	BRD-K62724755-001-01-0	Broad Institute of MIT and Harvard	BRD-K62724755			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C=C[C@H]1NC(=O)c1cccnc1	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18+,19-/m0/s1	VGDFEWNPUKUXSQ-OTWHNJEPSA-N	402.22670548							100861
BRD-K88391199-001-01-2	LSM-13865	BRD-K88391199	54638439	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13+,14+/m0/s1	DUQQDWAUZUWJHX-ZLKJLUDKSA-N	NCC[C@@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	BroadT	BRD-K88391199	BRD-K88391199-001-01-2	Broad Institute of MIT and Harvard	BRD-K88391199			NCC[C@@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13+,14+/m0/s1	DUQQDWAUZUWJHX-ZLKJLUDKSA-N	296.153620752							131228
BRD-K94726713	LSM-14236		54638426	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16-/m0/s1	IXKFMJFBYVYICU-JYJNAYRXSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2c(C)onc2C)C=C1	BroadT	BRD-K94726713	BRD-K94726713-001-01-8	Broad Institute of MIT and Harvard	BRD-K94726713			CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2c(C)noc2C)C=C1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16-/m0/s1	IXKFMJFBYVYICU-JYJNAYRXSA-N	409.232519142							102890
BRD-K24672629-001-01-2	LSM-29680	BRD-K24672629	54638236	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16-,17+/m1/s1	RNIDAHWWXILMTD-ZACQAIPSSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K24672629	BRD-K24672629-001-01-2	Broad Institute of MIT and Harvard	BRD-K24672629			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)NC1CCCCC1	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16-,17+/m1/s1	RNIDAHWWXILMTD-ZACQAIPSSA-N	381.226371122							118231
BRD-K67319066	LSM-12525		54638480	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21+/m1/s1	YLLZUOSUTCBCJJ-NXXWWENFSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K67319066	BRD-K67319066-001-01-8	Broad Institute of MIT and Harvard	BRD-K67319066			C[C@@H](NC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21+/m1/s1	YLLZUOSUTCBCJJ-NXXWWENFSA-N	450.162470874							101156
BRD-K76366810	LSM-13099		54638244	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18-,21-/m0/s1	WVRHSCPXBJSNMQ-MDKPJZGXSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K76366810	BRD-K76366810-001-01-7	Broad Institute of MIT and Harvard	BRD-K76366810			OC[C@@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18-,21-/m0/s1	WVRHSCPXBJSNMQ-MDKPJZGXSA-N	496.10709956							101737
BRD-K29776425	LSM-10234		54638378	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25-,26+/m0/s1	HIZAXMBYTZOIAT-KKUQBAQOSA-N	COc1cccc(NC(=O)N[C@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO)c1	BroadT	BRD-K29776425	BRD-K29776425-001-01-2	Broad Institute of MIT and Harvard	BRD-K29776425			COc1cccc(NC(=O)N[C@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@@H]2CO)c1	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25-,26+/m0/s1	HIZAXMBYTZOIAT-KKUQBAQOSA-N	487.210721058							98855
BRD-K93240833	LSM-14147		54638493	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20+,21+/m0/s1	ZTKNNPSVJPUDLJ-CEWLAPEOSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K93240833	BRD-K93240833-001-01-6	Broad Institute of MIT and Harvard	BRD-K93240833			OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20+,21+/m0/s1	ZTKNNPSVJPUDLJ-CEWLAPEOSA-N	486.129456184							102801
BRD-K80726792-001-01-8	LSM-13365	BRD-K80726792	54638444	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13-,14-/m0/s1	DUQQDWAUZUWJHX-BPNCWPANSA-N	NCC[C@@H]1CC[C@H](NC(=O)c2ccccc2F)[C@H](CO)O1	BroadT	BRD-K80726792	BRD-K80726792-001-01-8	Broad Institute of MIT and Harvard	BRD-K80726792			NCC[C@@H]1CC[C@H](NC(=O)c2ccccc2F)[C@H](CO)O1	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13-,14-/m0/s1	DUQQDWAUZUWJHX-BPNCWPANSA-N	296.153620752							102004
BRD-K16257721	LSM-9408		54638227	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20-,21+/m1/s1	SKMIIEGWSYGYOW-NRSPTQNISA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NCCc3ccncc3)O[C@H]2CO	BroadT	BRD-K16257721	BRD-K16257721-001-01-9	Broad Institute of MIT and Harvard	BRD-K16257721			COc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NCCc2ccncc2)O[C@H]1CO	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20-,21+/m1/s1	SKMIIEGWSYGYOW-NRSPTQNISA-N	461.162056304							98029
BRD-K85088178	LSM-13627		54638370	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17-,18-/m0/s1	KXCVLZMSFBFHGZ-BZSNNMDCSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncn2)CC[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K85088178	BRD-K85088178-001-01-2	Broad Institute of MIT and Harvard	BRD-K85088178			OC[C@@H]1O[C@H](CC(=O)NCc2ccncn2)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17-,18-/m0/s1	KXCVLZMSFBFHGZ-BZSNNMDCSA-N	402.170333456							102274
BRD-K71752918	LSM-12820		54638486	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21-/m1/s1	YLLZUOSUTCBCJJ-WUHBCXKYSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K71752918	BRD-K71752918-001-01-4	Broad Institute of MIT and Harvard	BRD-K71752918			C[C@@H](NC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21-/m1/s1	YLLZUOSUTCBCJJ-WUHBCXKYSA-N	450.162470874							101457
BRD-K34019494	LSM-10488		54638327	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21+,22+/m1/s1	INJNPRWYOQJIJD-HJNYFJLDSA-N	OC[C@@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NS(=O)(=O)c4ccccc4F	BroadT	BRD-K34019494	BRD-K34019494-001-01-6	Broad Institute of MIT and Harvard	BRD-K34019494			OC[C@@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21+,22+/m1/s1	INJNPRWYOQJIJD-HJNYFJLDSA-N	474.173704274							99109
BRD-K76223260	LSM-13084		54638373	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17+,18-/m1/s1	KXCVLZMSFBFHGZ-FGTMMUONSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncn2)CC[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K76223260	BRD-K76223260-001-01-5	Broad Institute of MIT and Harvard	BRD-K76223260			OC[C@H]1O[C@@H](CC(=O)NCc2ccncn2)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17+,18-/m1/s1	KXCVLZMSFBFHGZ-FGTMMUONSA-N	402.170333456							101722
BRD-K42450605	LSM-11002		54638265	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17+,21+/m0/s1	WCJFLIIYNCSVNP-LUQKVYGDSA-N	COc1ccccc1c2cn(CC[C@@H]3CC[C@@H](NC(=O)c4cnccn4)[C@@H](CO)O3)nn2	BroadT	BRD-K42450605	BRD-K42450605-001-01-9	Broad Institute of MIT and Harvard	BRD-K42450605			COc1ccccc1-c1cn(CC[C@@H]2CC[C@@H](NC(=O)c3cnccn3)[C@@H](CO)O2)nn1	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17+,21+/m0/s1	WCJFLIIYNCSVNP-LUQKVYGDSA-N	438.201553372							99623
BRD-K76644587	LSM-13118		54638283	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21+/m1/s1	GWEQQAXOIQTOQH-DBOLQNLKSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K76644587	BRD-K76644587-001-01-8	Broad Institute of MIT and Harvard	BRD-K76644587			C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21+/m1/s1	GWEQQAXOIQTOQH-DBOLQNLKSA-N	409.200156374							101756
BRD-K37848804	LSM-10720		54638343	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19+,21-/m0/s1	ASLPZONUTGKWLH-ZVDOUQERSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3CCCCC3)CC[C@H]1NC(=O)CN4CCOCC4	BroadT	BRD-K37848804	BRD-K37848804-001-01-0	Broad Institute of MIT and Harvard	BRD-K37848804			OC[C@@H]1O[C@H](CCn2cc(nn2)C2CCCCC2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19+,21-/m0/s1	ASLPZONUTGKWLH-ZVDOUQERSA-N	435.284554714							99341
CHEMBL2362357	LSM-13661	BRD-K85593835, SID131434569	54638292	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21+/m1/s1	GWEQQAXOIQTOQH-OTNPHJDUSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K85593835	BRD-K85593835-001-01-6	Broad Institute of MIT and Harvard	BRD-K85593835			C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21+/m1/s1	GWEQQAXOIQTOQH-OTNPHJDUSA-N	409.200156374							102308
BRD-K51620275	LSM-11586		54638514	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19-/m1/s1	PBTCYEHOLZFKGG-CEXWTWQISA-N	CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	BroadT	BRD-K51620275	BRD-K51620275-001-01-4	Broad Institute of MIT and Harvard	BRD-K51620275			CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19-/m1/s1	PBTCYEHOLZFKGG-CEXWTWQISA-N	387.215806438							100209
BRD-K89386994	LSM-13933		54638509	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19+/m1/s1	PBTCYEHOLZFKGG-QYZOEREBSA-N	CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	BroadT	BRD-K89386994	BRD-K89386994-001-01-8	Broad Institute of MIT and Harvard	BRD-K89386994			CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19+/m1/s1	PBTCYEHOLZFKGG-QYZOEREBSA-N	387.215806438							102586
BRD-K65608865	LSM-12430		54638364	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18-,19+/m1/s1	VGDFEWNPUKUXSQ-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C=C[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K65608865	BRD-K65608865-001-01-9	Broad Institute of MIT and Harvard	BRD-K65608865			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C=C[C@H]1NC(=O)c1cccnc1	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18-,19+/m1/s1	VGDFEWNPUKUXSQ-QRVBRYPASA-N	402.22670548							101057
BRD-K37655007	LSM-10707		54638417	InChI=1S/C15H21F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h3-4,9-12,21H,1-2,5-8H2,(H,19,22)(H,20,23)/t10-,11-,12+/m1/s1	QQIOQVYYWJVUEN-UTUOFQBUSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C=C[C@H]1NC(=O)CC2CC2	BroadT	BRD-K37655007	BRD-K37655007-001-01-4	Broad Institute of MIT and Harvard	BRD-K37655007			OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C=C[C@H]1NC(=O)CC1CC1	InChI=1S/C15H21F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h3-4,9-12,21H,1-2,5-8H2,(H,19,22)(H,20,23)/t10-,11-,12+/m1/s1	QQIOQVYYWJVUEN-UTUOFQBUSA-N	350.145341772							99328
BRD-K08403039	LSM-8936		54638308	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18-,19+/m1/s1	WMHOVAQHNBVIPJ-QRQLOZEOSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K08403039	BRD-K08403039-001-01-6	Broad Institute of MIT and Harvard	BRD-K08403039			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18-,19+/m1/s1	WMHOVAQHNBVIPJ-QRQLOZEOSA-N	467.128169362							97557
BRD-K52954098	LSM-11660		54638494	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20+,21+/m1/s1	ZTKNNPSVJPUDLJ-GIVPXCGWSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K52954098	BRD-K52954098-001-01-1	Broad Institute of MIT and Harvard	BRD-K52954098			OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20+,21+/m1/s1	ZTKNNPSVJPUDLJ-GIVPXCGWSA-N	486.129456184							100285
BRD-K71531260	LSM-12802		54638437	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16+,18-/m1/s1	YJKUDHPPBXQQCK-SOLBZPMBSA-N	COc1ccccc1CNC(=O)C[C@@H]2O[C@H](CO)[C@@H](NC(=O)CN(C)C)C=C2	BroadT	BRD-K71531260	BRD-K71531260-001-01-6	Broad Institute of MIT and Harvard	BRD-K71531260			COc1ccccc1CNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)CN(C)C)C=C1	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16+,18-/m1/s1	YJKUDHPPBXQQCK-SOLBZPMBSA-N	391.210721058							101439
BRD-K79997126	LSM-13313		54638228	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20+,21-/m1/s1	SKMIIEGWSYGYOW-HLAWJBBLSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NCCc3ccncc3)O[C@@H]2CO	BroadT	BRD-K79997126	BRD-K79997126-001-01-5	Broad Institute of MIT and Harvard	BRD-K79997126			COc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCCc2ccncc2)O[C@@H]1CO	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20+,21-/m1/s1	SKMIIEGWSYGYOW-HLAWJBBLSA-N	461.162056304							101952
BRD-K78229216	LSM-13214		54638300	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15-,16-/m0/s1	ZKSUBHWMVQQNNI-JYJNAYRXSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H](NC(=O)Nc3c(C)onc3C)[C@H](CO)O2	BroadT	BRD-K78229216	BRD-K78229216-001-01-5	Broad Institute of MIT and Harvard	BRD-K78229216			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H](NC(=O)Nc2c(C)noc2C)[C@H](CO)O1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15-,16-/m0/s1	ZKSUBHWMVQQNNI-JYJNAYRXSA-N	409.232519142							101852
BRD-K89715659	LSM-13966		54638320	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25+,26-/m0/s1	JXWMWOXWMMUZLT-DMDYGQEQSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@H]2CO	BroadT	BRD-K89715659	BRD-K89715659-001-01-4	Broad Institute of MIT and Harvard	BRD-K89715659			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25+,26-/m0/s1	JXWMWOXWMMUZLT-DMDYGQEQSA-N	516.229407582							102619
BRD-K63618292	LSM-12304		54638310	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18-,19-/m0/s1	WMHOVAQHNBVIPJ-WDSOQIARSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K63618292	BRD-K63618292-001-01-3	Broad Institute of MIT and Harvard	BRD-K63618292			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18-,19-/m0/s1	WMHOVAQHNBVIPJ-WDSOQIARSA-N	467.128169362							100931
BRD-K89994146	LSM-13980		54638421	InChI=1S/C17H32N2O5S/c1-2-25(22,23)18-11-10-14-8-9-15(16(12-20)24-14)19-17(21)13-6-4-3-5-7-13/h13-16,18,20H,2-12H2,1H3,(H,19,21)/t14-,15+,16-/m1/s1	NFMKQITUWMOCLJ-OWCLPIDISA-N	CCS(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)C2CCCCC2)[C@@H](CO)O1	BroadT	BRD-K89994146	BRD-K89994146-001-01-6	Broad Institute of MIT and Harvard	BRD-K89994146			CCS(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)C2CCCCC2)[C@@H](CO)O1	InChI=1S/C17H32N2O5S/c1-2-25(22,23)18-11-10-14-8-9-15(16(12-20)24-14)19-17(21)13-6-4-3-5-7-13/h13-16,18,20H,2-12H2,1H3,(H,19,21)/t14-,15+,16-/m1/s1	NFMKQITUWMOCLJ-OWCLPIDISA-N	376.203192834							102633
BRD-K71779338	LSM-12824		54638251	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17-,18-/m1/s1	JVYCUASVIANWPE-KZNAEPCWSA-N	CC(C)NC(=O)NCC[C@H]1CC[C@@H](NC(=O)CCN2CCCCC2)[C@@H](CO)O1	BroadT	BRD-K71779338	BRD-K71779338-001-01-9	Broad Institute of MIT and Harvard	BRD-K71779338			CC(C)NC(=O)NCC[C@H]1CC[C@@H](NC(=O)CCN2CCCCC2)[C@@H](CO)O1	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17-,18-/m1/s1	JVYCUASVIANWPE-KZNAEPCWSA-N	398.289305736							101461
BRD-K39255658	LSM-10812		54638507	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24+,27-/m0/s1	IKYPBPDRSBKALY-XFAFFCHDSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K39255658	BRD-K39255658-001-01-3	Broad Institute of MIT and Harvard	BRD-K39255658			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24+,27-/m0/s1	IKYPBPDRSBKALY-XFAFFCHDSA-N	518.20530132							99433
BRD-K75353513	LSM-13036		54638304	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15+,16-/m0/s1	ZKSUBHWMVQQNNI-XHSDSOJGSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H](NC(=O)Nc3c(C)onc3C)[C@H](CO)O2	BroadT	BRD-K75353513	BRD-K75353513-001-01-6	Broad Institute of MIT and Harvard	BRD-K75353513			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2c(C)noc2C)[C@H](CO)O1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15+,16-/m0/s1	ZKSUBHWMVQQNNI-XHSDSOJGSA-N	409.232519142							101673
BRD-K77070775	LSM-13142		54638243	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18+,21-/m1/s1	WVRHSCPXBJSNMQ-PLMTUMEDSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K77070775	BRD-K77070775-001-01-7	Broad Institute of MIT and Harvard	BRD-K77070775			OC[C@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18+,21-/m1/s1	WVRHSCPXBJSNMQ-PLMTUMEDSA-N	496.10709956							101780
BRD-K44867089	LSM-11158		54638428	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16+/m1/s1	IXKFMJFBYVYICU-OAGGEKHMSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Nc2c(C)onc2C)C=C1	BroadT	BRD-K44867089	BRD-K44867089-001-01-7	Broad Institute of MIT and Harvard	BRD-K44867089			CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Nc2c(C)noc2C)C=C1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16+/m1/s1	IXKFMJFBYVYICU-OAGGEKHMSA-N	409.232519142							99779
BRD-K67399667	LSM-12532		54638352	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19+,20+/m0/s1	ADNYLXRIKBBTKJ-XUVXKRRUSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K67399667	BRD-K67399667-001-01-3	Broad Institute of MIT and Harvard	BRD-K67399667			Cn1cnc(c1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@@H]1CO	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19+,20+/m0/s1	ADNYLXRIKBBTKJ-XUVXKRRUSA-N	475.188939768							101163
BRD-K10014225	LSM-9043		54638519	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18-,19-/m0/s1	ZAZOOTZCNDNOOW-WDSOQIARSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](CO)O1	BroadT	BRD-K10014225	BRD-K10014225-001-01-1	Broad Institute of MIT and Harvard	BRD-K10014225			CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](CO)O1	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18-,19-/m0/s1	ZAZOOTZCNDNOOW-WDSOQIARSA-N	427.214091876							97664
BRD-K95360473	LSM-14274		54638377	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25-,26-/m0/s1	HIZAXMBYTZOIAT-GSDHBNRESA-N	COc1cccc(NC(=O)N[C@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO)c1	BroadT	BRD-K95360473	BRD-K95360473-001-01-5	Broad Institute of MIT and Harvard	BRD-K95360473			COc1cccc(NC(=O)N[C@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@H]2CO)c1	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25-,26-/m0/s1	HIZAXMBYTZOIAT-GSDHBNRESA-N	487.210721058							102928
BRD-K36618611	LSM-10641		54638362	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18-,19-/m0/s1	VGDFEWNPUKUXSQ-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C=C[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K36618611	BRD-K36618611-001-01-1	Broad Institute of MIT and Harvard	BRD-K36618611			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C=C[C@@H]1NC(=O)c1cccnc1	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18-,19-/m0/s1	VGDFEWNPUKUXSQ-FHWLQOOXSA-N	402.22670548							99262
BRD-K72915790-001-01-9	LSM-12892	BRD-K72915790	54638443	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13-,14-/m1/s1	DUQQDWAUZUWJHX-LERXQTSPSA-N	NCC[C@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	BroadT	BRD-K72915790	BRD-K72915790-001-01-9	Broad Institute of MIT and Harvard	BRD-K72915790			NCC[C@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13-,14-/m1/s1	DUQQDWAUZUWJHX-LERXQTSPSA-N	296.153620752							101529
BRD-K41173255	LSM-10933		54638288	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21-/m0/s1	GWEQQAXOIQTOQH-FIRPJDEBSA-N	C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K41173255	BRD-K41173255-001-01-1	Broad Institute of MIT and Harvard	BRD-K41173255			C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21-/m0/s1	GWEQQAXOIQTOQH-FIRPJDEBSA-N	409.200156374							99554
BRD-K53943507	LSM-11710		54638420	InChI=1S/C17H32N2O5S/c1-2-25(22,23)18-11-10-14-8-9-15(16(12-20)24-14)19-17(21)13-6-4-3-5-7-13/h13-16,18,20H,2-12H2,1H3,(H,19,21)/t14-,15-,16+/m1/s1	NFMKQITUWMOCLJ-OAGGEKHMSA-N	CCS(=O)(=O)NCC[C@H]1CC[C@@H](NC(=O)C2CCCCC2)[C@H](CO)O1	BroadT	BRD-K53943507	BRD-K53943507-001-01-8	Broad Institute of MIT and Harvard	BRD-K53943507			CCS(=O)(=O)NCC[C@H]1CC[C@@H](NC(=O)C2CCCCC2)[C@H](CO)O1	InChI=1S/C17H32N2O5S/c1-2-25(22,23)18-11-10-14-8-9-15(16(12-20)24-14)19-17(21)13-6-4-3-5-7-13/h13-16,18,20H,2-12H2,1H3,(H,19,21)/t14-,15-,16+/m1/s1	NFMKQITUWMOCLJ-OAGGEKHMSA-N	376.203192834							100335
BRD-K55767126	LSM-11807		54638416	InChI=1S/C15H21F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h3-4,9-12,21H,1-2,5-8H2,(H,19,22)(H,20,23)/t10-,11-,12+/m0/s1	QQIOQVYYWJVUEN-SDDRHHMPSA-N	OC[C@H]1O[C@H](CC(=O)NCC(F)(F)F)C=C[C@@H]1NC(=O)CC2CC2	BroadT	BRD-K55767126	BRD-K55767126-001-01-0	Broad Institute of MIT and Harvard	BRD-K55767126			OC[C@H]1O[C@H](CC(=O)NCC(F)(F)F)C=C[C@@H]1NC(=O)CC1CC1	InChI=1S/C15H21F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h3-4,9-12,21H,1-2,5-8H2,(H,19,22)(H,20,23)/t10-,11-,12+/m0/s1	QQIOQVYYWJVUEN-SDDRHHMPSA-N	350.145341772							100432
BRD-K33750632	LSM-10474		54638382	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15+,16+/m0/s1	LJTZBZLXVQJQJX-ARFHVFGLSA-N	COCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)NC2CCCCC2)[C@@H](CO)O1	BroadT	BRD-K33750632	BRD-K33750632-001-01-0	Broad Institute of MIT and Harvard	BRD-K33750632			COCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)NC2CCCCC2)[C@@H](CO)O1	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15+,16+/m0/s1	LJTZBZLXVQJQJX-ARFHVFGLSA-N	371.242021186							99095
BRD-K87755452	LSM-13810		54638287	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21+/m1/s1	GWEQQAXOIQTOQH-SEVLPDGMSA-N	C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K87755452	BRD-K87755452-001-01-1	Broad Institute of MIT and Harvard	BRD-K87755452			C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21+/m1/s1	GWEQQAXOIQTOQH-SEVLPDGMSA-N	409.200156374							102459
BRD-K91730835	LSM-14064		54638478	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21+/m0/s1	YLLZUOSUTCBCJJ-GDVKCFTOSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K91730835	BRD-K91730835-001-01-6	Broad Institute of MIT and Harvard	BRD-K91730835			C[C@H](NC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21+/m0/s1	YLLZUOSUTCBCJJ-GDVKCFTOSA-N	450.162470874							102717
BRD-K27442643	LSM-10084		54638242	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18-,21+/m1/s1	WVRHSCPXBJSNMQ-BLIXFSHQSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K27442643	BRD-K27442643-001-01-9	Broad Institute of MIT and Harvard	BRD-K27442643			OC[C@@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18-,21+/m1/s1	WVRHSCPXBJSNMQ-BLIXFSHQSA-N	496.10709956							98705
BRD-K89699317	LSM-13965		54638459	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18+,19-/m1/s1	XLDWFJCTUAPIOT-NZSAHSFTSA-N	OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K89699317	BRD-K89699317-001-01-4	Broad Institute of MIT and Harvard	BRD-K89699317			OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18+,19-/m1/s1	XLDWFJCTUAPIOT-NZSAHSFTSA-N	471.1839346							102618
BRD-K72347310	LSM-12864		54638435	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16-,18+/m0/s1	YJKUDHPPBXQQCK-XYJFISCASA-N	COc1ccccc1CNC(=O)C[C@H]2O[C@H](CO)[C@@H](NC(=O)CN(C)C)C=C2	BroadT	BRD-K72347310	BRD-K72347310-001-01-6	Broad Institute of MIT and Harvard	BRD-K72347310			COc1ccccc1CNC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)CN(C)C)C=C1	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16-,18+/m0/s1	YJKUDHPPBXQQCK-XYJFISCASA-N	391.210721058							101501
BRD-K72461570	LSM-12875		54638347	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18-,21-/m0/s1	WGFFUWNETOGMCB-WFXMLNOXSA-N	OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K72461570	BRD-K72461570-001-01-0	Broad Institute of MIT and Harvard	BRD-K72461570			OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18-,21-/m0/s1	WGFFUWNETOGMCB-WFXMLNOXSA-N	478.242749468							101512
BRD-K24820558	LSM-9938		54638497	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20-,21-/m1/s1	ZTKNNPSVJPUDLJ-HMXCVIKNSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K24820558	BRD-K24820558-001-01-2	Broad Institute of MIT and Harvard	BRD-K24820558			OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20-,21-/m1/s1	ZTKNNPSVJPUDLJ-HMXCVIKNSA-N	486.129456184							98559
BRD-K22451824	LSM-9790		54638527	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20+/m1/s1	JTIOTWTUDVMQPE-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)Nc3ccc(Cl)cc3	BroadT	BRD-K22451824	BRD-K22451824-001-01-6	Broad Institute of MIT and Harvard	BRD-K22451824			OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20+/m1/s1	JTIOTWTUDVMQPE-AQNXPRMDSA-N	446.172083094							98411
BRD-K90061989	LSM-13984		54638510	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19-/m1/s1	PBTCYEHOLZFKGG-GUDVDZBRSA-N	CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	BroadT	BRD-K90061989	BRD-K90061989-001-01-1	Broad Institute of MIT and Harvard	BRD-K90061989			CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19-/m1/s1	PBTCYEHOLZFKGG-GUDVDZBRSA-N	387.215806438							102637
BRD-K32323656	LSM-10387		54638281	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21-/m1/s1	GWEQQAXOIQTOQH-UMSONDCASA-N	C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K32323656	BRD-K32323656-001-01-8	Broad Institute of MIT and Harvard	BRD-K32323656			C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21-/m1/s1	GWEQQAXOIQTOQH-UMSONDCASA-N	409.200156374							99008
BRD-K86618560	LSM-13732		54638374	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17+,18-/m0/s1	KXCVLZMSFBFHGZ-KSZLIROESA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncn2)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K86618560	BRD-K86618560-001-01-1	Broad Institute of MIT and Harvard	BRD-K86618560			OC[C@@H]1O[C@H](CC(=O)NCc2ccncn2)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17+,18-/m0/s1	KXCVLZMSFBFHGZ-KSZLIROESA-N	402.170333456							102381
BRD-K67716641	LSM-12553		54638306	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18+,19+/m1/s1	WMHOVAQHNBVIPJ-NEWSRXKRSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K67716641	BRD-K67716641-001-01-9	Broad Institute of MIT and Harvard	BRD-K67716641			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18+,19+/m1/s1	WMHOVAQHNBVIPJ-NEWSRXKRSA-N	467.128169362							101184
BRD-K80408402	LSM-13344		54638461	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14+,16+/m0/s1	QWCXAENNPFGWBU-SQWLQELKSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K80408402	BRD-K80408402-001-01-5	Broad Institute of MIT and Harvard	BRD-K80408402			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14+,16+/m0/s1	QWCXAENNPFGWBU-SQWLQELKSA-N	363.17942093							101983
BRD-K60471354	LSM-12082		54638460	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18+,19-/m0/s1	XLDWFJCTUAPIOT-UHOSZYNNSA-N	OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K60471354	BRD-K60471354-001-01-5	Broad Institute of MIT and Harvard	BRD-K60471354			OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18+,19-/m0/s1	XLDWFJCTUAPIOT-UHOSZYNNSA-N	471.1839346							100708
BRD-K36870972	LSM-10658		54638255	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17-,18+/m0/s1	JVYCUASVIANWPE-OKZBNKHCSA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@H](NC(=O)CCN2CCCCC2)[C@@H](CO)O1	BroadT	BRD-K36870972	BRD-K36870972-001-01-1	Broad Institute of MIT and Harvard	BRD-K36870972			CC(C)NC(=O)NCC[C@@H]1CC[C@H](NC(=O)CCN2CCCCC2)[C@@H](CO)O1	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17-,18+/m0/s1	JVYCUASVIANWPE-OKZBNKHCSA-N	398.289305736							99279
BRD-K73044562	LSM-12899		54638313	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25+,26+/m0/s1	JXWMWOXWMMUZLT-SKBVVQJISA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@@H]2CO	BroadT	BRD-K73044562	BRD-K73044562-001-01-3	Broad Institute of MIT and Harvard	BRD-K73044562			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@@H]1CO	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25+,26+/m0/s1	JXWMWOXWMMUZLT-SKBVVQJISA-N	516.229407582							101536
BRD-K12826563	LSM-9188		54638395	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17-,19-/m0/s1	BDFFQCHCBQOAPA-LNLFQRSKSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@@H](CCNC(=O)C3CCOCC3)O[C@H]2CO	BroadT	BRD-K12826563	BRD-K12826563-001-01-6	Broad Institute of MIT and Harvard	BRD-K12826563			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17-,19-/m0/s1	BDFFQCHCBQOAPA-LNLFQRSKSA-N	456.193022074							97809
BRD-K91269653	LSM-14040		54638359	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18+,19+/m0/s1	VGDFEWNPUKUXSQ-IPMKNSEASA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C=C[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K91269653	BRD-K91269653-001-01-4	Broad Institute of MIT and Harvard	BRD-K91269653			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C=C[C@H]1NC(=O)c1cccnc1	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18+,19+/m0/s1	VGDFEWNPUKUXSQ-IPMKNSEASA-N	402.22670548							102693
BRD-K63811860	LSM-12313		54638529	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20-/m1/s1	JTIOTWTUDVMQPE-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)Nc3ccc(Cl)cc3	BroadT	BRD-K63811860	BRD-K63811860-001-01-6	Broad Institute of MIT and Harvard	BRD-K63811860			OC[C@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20-/m1/s1	JTIOTWTUDVMQPE-VAMGGRTRSA-N	446.172083094							100940
BRD-K18683499-001-01-4	LSM-9551	BRD-K18683499	54638445	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13-,14+/m0/s1	DUQQDWAUZUWJHX-LEWSCRJBSA-N	NCC[C@@H]1CC[C@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	BroadT	BRD-K18683499	BRD-K18683499-001-01-4	Broad Institute of MIT and Harvard	BRD-K18683499			NCC[C@@H]1CC[C@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13-,14+/m0/s1	DUQQDWAUZUWJHX-LEWSCRJBSA-N	296.153620752							98172
BRD-K68870366	LSM-12633		54638220	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15+,16-/m1/s1	SOYBDXBXTZOLGY-OWCLPIDISA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccccc2)CC[C@@H]1NC(=O)C3CC3	BroadT	BRD-K68870366	BRD-K68870366-001-01-6	Broad Institute of MIT and Harvard	BRD-K68870366			OC[C@H]1O[C@@H](CC(=O)Nc2ccccc2)CC[C@@H]1NC(=O)C1CC1	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15+,16-/m1/s1	SOYBDXBXTZOLGY-OWCLPIDISA-N	332.173607268							101266
BRD-K50218765	LSM-11485		54638501	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24+,27+/m1/s1	IKYPBPDRSBKALY-DXBVXKBHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K50218765	BRD-K50218765-001-01-5	Broad Institute of MIT and Harvard	BRD-K50218765			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24+,27+/m1/s1	IKYPBPDRSBKALY-DXBVXKBHSA-N	518.20530132							100106
BRD-K65735929	LSM-12434		54638290	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21-/m1/s1	GWEQQAXOIQTOQH-MBPVOVBZSA-N	C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K65735929	BRD-K65735929-001-01-4	Broad Institute of MIT and Harvard	BRD-K65735929			C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21-/m1/s1	GWEQQAXOIQTOQH-MBPVOVBZSA-N	409.200156374							101061
BRD-K46714753	LSM-11280		54638418	InChI=1S/C15H21F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h3-4,9-12,21H,1-2,5-8H2,(H,19,22)(H,20,23)/t10-,11+,12-/m1/s1	QQIOQVYYWJVUEN-GRYCIOLGSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C=C[C@@H]1NC(=O)CC2CC2	BroadT	BRD-K46714753	BRD-K46714753-001-01-4	Broad Institute of MIT and Harvard	BRD-K46714753			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C=C[C@@H]1NC(=O)CC1CC1	InChI=1S/C15H21F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h3-4,9-12,21H,1-2,5-8H2,(H,19,22)(H,20,23)/t10-,11+,12-/m1/s1	QQIOQVYYWJVUEN-GRYCIOLGSA-N	350.145341772							99901
BRD-K57841225	LSM-11927		54638386	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15-,16+/m0/s1	LJTZBZLXVQJQJX-HRCADAONSA-N	COCCNC(=O)C[C@@H]1CC[C@H](NC(=O)NC2CCCCC2)[C@@H](CO)O1	BroadT	BRD-K57841225	BRD-K57841225-001-01-1	Broad Institute of MIT and Harvard	BRD-K57841225			COCCNC(=O)C[C@@H]1CC[C@H](NC(=O)NC2CCCCC2)[C@@H](CO)O1	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15-,16+/m0/s1	LJTZBZLXVQJQJX-HRCADAONSA-N	371.242021186							100553
BRD-K39799535	LSM-10851		54638476	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17+,18-/m0/s1	ZOURSNKVQGBTHH-KSZLIROESA-N	COCc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](CO)O2)nn1	BroadT	BRD-K39799535	BRD-K39799535-001-01-9	Broad Institute of MIT and Harvard	BRD-K39799535			COCc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](CO)O2)nn1	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17+,18-/m0/s1	ZOURSNKVQGBTHH-KSZLIROESA-N	457.193688962							99472
BRD-K84907327	LSM-13615		54638383	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15+,16+/m1/s1	LJTZBZLXVQJQJX-PMPSAXMXSA-N	COCCNC(=O)C[C@H]1CC[C@H](NC(=O)NC2CCCCC2)[C@H](CO)O1	BroadT	BRD-K84907327	BRD-K84907327-001-01-4	Broad Institute of MIT and Harvard	BRD-K84907327			COCCNC(=O)C[C@H]1CC[C@H](NC(=O)NC2CCCCC2)[C@H](CO)O1	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15+,16+/m1/s1	LJTZBZLXVQJQJX-PMPSAXMXSA-N	371.242021186							102261
BRD-K43601041	LSM-11086		54638427	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16+/m0/s1	IXKFMJFBYVYICU-HRCADAONSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Nc2c(C)onc2C)C=C1	BroadT	BRD-K43601041	BRD-K43601041-001-01-8	Broad Institute of MIT and Harvard	BRD-K43601041			CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Nc2c(C)noc2C)C=C1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16+/m0/s1	IXKFMJFBYVYICU-HRCADAONSA-N	409.232519142							99707
MLS003650003	LSM-11569	BRD-K51339020	53382666	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18-,19+/m0/s1	XLDWFJCTUAPIOT-YTQUADARSA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K51339020	BRD-K51339020-001-01-9	Broad Institute of MIT and Harvard	BRD-K51339020			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18-,19+/m0/s1	XLDWFJCTUAPIOT-YTQUADARSA-N	471.1839346							100192
BRD-K03676054	LSM-8657		54638295	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21-/m0/s1	GWEQQAXOIQTOQH-DVWBAYGPSA-N	C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K03676054	BRD-K03676054-001-01-2	Broad Institute of MIT and Harvard	BRD-K03676054			C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21-/m0/s1	GWEQQAXOIQTOQH-DVWBAYGPSA-N	409.200156374							97278
BRD-K69672581	LSM-12679		54638499	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20+,21-/m0/s1	ZTKNNPSVJPUDLJ-TYPHKJRUSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K69672581	BRD-K69672581-001-01-4	Broad Institute of MIT and Harvard	BRD-K69672581			OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20+,21-/m0/s1	ZTKNNPSVJPUDLJ-TYPHKJRUSA-N	486.129456184							101313
CHEMBL2362720	LSM-9894	BRD-K24199200, SID131434810	54638531	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20-/m0/s1	JTIOTWTUDVMQPE-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)Nc3ccc(Cl)cc3	BroadT	BRD-K24199200	BRD-K24199200-001-01-3	Broad Institute of MIT and Harvard	BRD-K24199200			OC[C@@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20-/m0/s1	JTIOTWTUDVMQPE-ZCNNSNEGSA-N	446.172083094							98515
BRD-K07807999	LSM-8899		54638285	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21+/m0/s1	GWEQQAXOIQTOQH-LLUDDFSJSA-N	C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K07807999	BRD-K07807999-001-01-7	Broad Institute of MIT and Harvard	BRD-K07807999			C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21+/m0/s1	GWEQQAXOIQTOQH-LLUDDFSJSA-N	409.200156374							97520
BRD-K44205194	LSM-11125		54638333	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21+,22-/m0/s1	INJNPRWYOQJIJD-NNWRFLSQSA-N	OC[C@@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NS(=O)(=O)c4ccccc4F	BroadT	BRD-K44205194	BRD-K44205194-001-01-2	Broad Institute of MIT and Harvard	BRD-K44205194			OC[C@@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21+,22-/m0/s1	INJNPRWYOQJIJD-NNWRFLSQSA-N	474.173704274							99746
BRD-K64864583	LSM-12390		54638465	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14-,16+/m0/s1	QWCXAENNPFGWBU-OFQRWUPVSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K64864583	BRD-K64864583-001-01-0	Broad Institute of MIT and Harvard	BRD-K64864583			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14-,16+/m0/s1	QWCXAENNPFGWBU-OFQRWUPVSA-N	363.17942093							101017
CHEMBL2356998	LSM-10504	SID131434809, BRD-K34404012	54638530	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20-/m0/s1	JTIOTWTUDVMQPE-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)Nc3ccc(Cl)cc3	BroadT	BRD-K34404012	BRD-K34404012-001-01-3	Broad Institute of MIT and Harvard	BRD-K34404012			OC[C@@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20-/m0/s1	JTIOTWTUDVMQPE-UFYCRDLUSA-N	446.172083094							99125
BRD-K68340318	LSM-12597		54638276	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16-,17-/m0/s1	VHNINRJVEBHVBF-ULQDDVLXSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@H]2CO	BroadT	BRD-K68340318	BRD-K68340318-001-01-9	Broad Institute of MIT and Harvard	BRD-K68340318			Cn1cnc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16-,17-/m0/s1	VHNINRJVEBHVBF-ULQDDVLXSA-N	428.209340854							101229
BRD-K41139858	LSM-10932		54638371	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17-,18+/m0/s1	KXCVLZMSFBFHGZ-OKZBNKHCSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)CC[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K41139858	BRD-K41139858-001-01-3	Broad Institute of MIT and Harvard	BRD-K41139858			OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17-,18+/m0/s1	KXCVLZMSFBFHGZ-OKZBNKHCSA-N	402.170333456							99553
BRD-K31671785	LSM-10347		54638277	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16-,17+/m1/s1	VHNINRJVEBHVBF-ZACQAIPSSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@H]2CO	BroadT	BRD-K31671785	BRD-K31671785-001-01-5	Broad Institute of MIT and Harvard	BRD-K31671785			Cn1cnc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16-,17+/m1/s1	VHNINRJVEBHVBF-ZACQAIPSSA-N	428.209340854							98968
BRD-K30855709	LSM-10290		54638357	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19+,20-/m1/s1	ADNYLXRIKBBTKJ-HSALFYBXSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K30855709	BRD-K30855709-001-01-8	Broad Institute of MIT and Harvard	BRD-K30855709			Cn1cnc(c1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@@H]1CO	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19+,20-/m1/s1	ADNYLXRIKBBTKJ-HSALFYBXSA-N	475.188939768							98911
BRD-K03013810	LSM-8620		54638216	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15-,16-/m1/s1	SOYBDXBXTZOLGY-BZUAXINKSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccccc2)CC[C@H]1NC(=O)C3CC3	BroadT	BRD-K03013810	BRD-K03013810-001-01-3	Broad Institute of MIT and Harvard	BRD-K03013810			OC[C@H]1O[C@@H](CC(=O)Nc2ccccc2)CC[C@H]1NC(=O)C1CC1	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15-,16-/m1/s1	SOYBDXBXTZOLGY-BZUAXINKSA-N	332.173607268							97241
BRD-K54247306	LSM-11728		54638414	InChI=1S/C15H21F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h3-4,9-12,21H,1-2,5-8H2,(H,19,22)(H,20,23)/t10-,11-,12-/m1/s1	QQIOQVYYWJVUEN-IJLUTSLNSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C=C[C@H]1NC(=O)CC2CC2	BroadT	BRD-K54247306	BRD-K54247306-001-01-6	Broad Institute of MIT and Harvard	BRD-K54247306			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C=C[C@H]1NC(=O)CC1CC1	InChI=1S/C15H21F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h3-4,9-12,21H,1-2,5-8H2,(H,19,22)(H,20,23)/t10-,11-,12-/m1/s1	QQIOQVYYWJVUEN-IJLUTSLNSA-N	350.145341772							100353
BRD-K26173688	LSM-10015		54638291	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21-/m0/s1	GWEQQAXOIQTOQH-ZXNZYJFHSA-N	C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K26173688	BRD-K26173688-001-01-7	Broad Institute of MIT and Harvard	BRD-K26173688			C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21-/m0/s1	GWEQQAXOIQTOQH-ZXNZYJFHSA-N	409.200156374							98636
BRD-K15171837	LSM-9335		54638387	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15-,16+/m1/s1	LJTZBZLXVQJQJX-OAGGEKHMSA-N	COCCNC(=O)C[C@H]1CC[C@@H](NC(=O)NC2CCCCC2)[C@H](CO)O1	BroadT	BRD-K15171837	BRD-K15171837-001-01-4	Broad Institute of MIT and Harvard	BRD-K15171837			COCCNC(=O)C[C@H]1CC[C@@H](NC(=O)NC2CCCCC2)[C@H](CO)O1	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15-,16+/m1/s1	LJTZBZLXVQJQJX-OAGGEKHMSA-N	371.242021186							97956
BRD-K61338389	LSM-12141		54638389	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15+,16-/m0/s1	LJTZBZLXVQJQJX-XHSDSOJGSA-N	COCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)NC2CCCCC2)[C@H](CO)O1	BroadT	BRD-K61338389	BRD-K61338389-001-01-4	Broad Institute of MIT and Harvard	BRD-K61338389			COCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)NC2CCCCC2)[C@H](CO)O1	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15+,16-/m0/s1	LJTZBZLXVQJQJX-XHSDSOJGSA-N	371.242021186							100767
BRD-K73876582	LSM-12955		54638469	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17+,18+/m0/s1	ZOURSNKVQGBTHH-RCCFBDPRSA-N	COCc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](CO)O2)nn1	BroadT	BRD-K73876582	BRD-K73876582-001-01-4	Broad Institute of MIT and Harvard	BRD-K73876582			COCc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](CO)O2)nn1	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17+,18+/m0/s1	ZOURSNKVQGBTHH-RCCFBDPRSA-N	457.193688962							101592
BRD-K34549246	LSM-10513		54638326	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21+,22+/m0/s1	INJNPRWYOQJIJD-KSEOMHKRSA-N	OC[C@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NS(=O)(=O)c4ccccc4F	BroadT	BRD-K34549246	BRD-K34549246-001-01-3	Broad Institute of MIT and Harvard	BRD-K34549246			OC[C@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21+,22+/m0/s1	INJNPRWYOQJIJD-KSEOMHKRSA-N	474.173704274							99134
BRD-K59022317	LSM-11996		54638404	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14+,15-/m1/s1	AKLLRXAVVXEIMF-QLFBSQMISA-N	CN(C)C(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)c2ccc(F)cc2)C=C1	BroadT	BRD-K59022317	BRD-K59022317-001-01-5	Broad Institute of MIT and Harvard	BRD-K59022317			CN(C)C(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)c2ccc(F)cc2)C=C1	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14+,15-/m1/s1	AKLLRXAVVXEIMF-QLFBSQMISA-N	336.148535372							100622
BRD-K56904840	LSM-11868		54638229	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20+,21-/m0/s1	SKMIIEGWSYGYOW-TYPHKJRUSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCCc3ccncc3)O[C@H]2CO	BroadT	BRD-K56904840	BRD-K56904840-001-01-3	Broad Institute of MIT and Harvard	BRD-K56904840			COc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCc2ccncc2)O[C@H]1CO	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20+,21-/m0/s1	SKMIIEGWSYGYOW-TYPHKJRUSA-N	461.162056304							100494
BRD-K92061784	LSM-14085		54638263	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17+,21-/m1/s1	VZUMNNKKGVSTKF-LDBYXDLTSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K92061784	BRD-K92061784-001-01-6	Broad Institute of MIT and Harvard	BRD-K92061784			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17+,21-/m1/s1	VZUMNNKKGVSTKF-LDBYXDLTSA-N	475.155491886							102739
BRD-K61083743	LSM-12126		54638403	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14-,15+/m1/s1	AKLLRXAVVXEIMF-KFWWJZLASA-N	CN(C)C(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)c2ccc(F)cc2)C=C1	BroadT	BRD-K61083743	BRD-K61083743-001-01-7	Broad Institute of MIT and Harvard	BRD-K61083743			CN(C)C(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)c2ccc(F)cc2)C=C1	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14-,15+/m1/s1	AKLLRXAVVXEIMF-KFWWJZLASA-N	336.148535372							100752
CHEMBL2355142	LSM-10890	BRD-K40383467, SID131434805	54638526	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20+/m0/s1	JTIOTWTUDVMQPE-SLFFLAALSA-N	OC[C@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)Nc3ccc(Cl)cc3	BroadT	BRD-K40383467	BRD-K40383467-001-01-1	Broad Institute of MIT and Harvard	BRD-K40383467			OC[C@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20+/m0/s1	JTIOTWTUDVMQPE-SLFFLAALSA-N	446.172083094							99511
BRD-K87878143	LSM-13822		54638385	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15-,16-/m0/s1	LJTZBZLXVQJQJX-JYJNAYRXSA-N	COCCNC(=O)C[C@@H]1CC[C@H](NC(=O)NC2CCCCC2)[C@H](CO)O1	BroadT	BRD-K87878143	BRD-K87878143-001-01-6	Broad Institute of MIT and Harvard	BRD-K87878143			COCCNC(=O)C[C@@H]1CC[C@H](NC(=O)NC2CCCCC2)[C@H](CO)O1	InChI=1S/C18H33N3O5/c1-25-10-9-19-17(23)11-14-7-8-15(16(12-22)26-14)21-18(24)20-13-5-3-2-4-6-13/h13-16,22H,2-12H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15-,16-/m0/s1	LJTZBZLXVQJQJX-JYJNAYRXSA-N	371.242021186							102472
BRD-K40506152	LSM-10901		54638484	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21-/m0/s1	YLLZUOSUTCBCJJ-HGWQEYRNSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K40506152	BRD-K40506152-001-01-7	Broad Institute of MIT and Harvard	BRD-K40506152			C[C@H](NC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21-/m0/s1	YLLZUOSUTCBCJJ-HGWQEYRNSA-N	450.162470874							99522
BRD-K22428007	LSM-9786		54638379	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25-,26+/m1/s1	HIZAXMBYTZOIAT-CYXNTTPDSA-N	COc1cccc(NC(=O)N[C@@H]2C=C[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO)c1	BroadT	BRD-K22428007	BRD-K22428007-001-01-3	Broad Institute of MIT and Harvard	BRD-K22428007			COc1cccc(NC(=O)N[C@@H]2C=C[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@H]2CO)c1	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25-,26+/m1/s1	HIZAXMBYTZOIAT-CYXNTTPDSA-N	487.210721058							98407
BRD-K38933129	LSM-10785		54638298	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15+,16+/m1/s1	ZKSUBHWMVQQNNI-PMPSAXMXSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H](NC(=O)Nc3c(C)onc3C)[C@H](CO)O2	BroadT	BRD-K38933129	BRD-K38933129-001-01-7	Broad Institute of MIT and Harvard	BRD-K38933129			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H](NC(=O)Nc2c(C)noc2C)[C@H](CO)O1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15+,16+/m1/s1	ZKSUBHWMVQQNNI-PMPSAXMXSA-N	409.232519142							99406
BRD-K68007071	LSM-12572		54638355	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19-,20+/m0/s1	ADNYLXRIKBBTKJ-SLFFLAALSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K68007071	BRD-K68007071-001-01-1	Broad Institute of MIT and Harvard	BRD-K68007071			Cn1cnc(c1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@@H]1CO	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19-,20+/m0/s1	ADNYLXRIKBBTKJ-SLFFLAALSA-N	475.188939768							101203
BRD-K43151809	LSM-11049		54638318	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25-,26+/m1/s1	JXWMWOXWMMUZLT-ARMFNRFLSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@H]2CO	BroadT	BRD-K43151809	BRD-K43151809-001-01-6	Broad Institute of MIT and Harvard	BRD-K43151809			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25-,26+/m1/s1	JXWMWOXWMMUZLT-ARMFNRFLSA-N	516.229407582							99670
BRD-K80514140	LSM-13352		54638329	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21-,22+/m1/s1	INJNPRWYOQJIJD-FCEUIQTBSA-N	OC[C@@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NS(=O)(=O)c4ccccc4F	BroadT	BRD-K80514140	BRD-K80514140-001-01-7	Broad Institute of MIT and Harvard	BRD-K80514140			OC[C@@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21-,22+/m1/s1	INJNPRWYOQJIJD-FCEUIQTBSA-N	474.173704274							101991
BRD-K31385226	LSM-10328		54638334	InChI=1S/C19H27N3O5S/c23-10-17-16(22-19(25)13-4-7-26-8-5-13)2-1-15(27-17)9-18(24)20-6-3-14-11-28-12-21-14/h1-2,11-13,15-17,23H,3-10H2,(H,20,24)(H,22,25)/t15-,16+,17+/m1/s1	QCPIRAQCKOOPTJ-IKGGRYGDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2cscn2)C=C[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K31385226	BRD-K31385226-001-01-9	Broad Institute of MIT and Harvard	BRD-K31385226			OC[C@@H]1O[C@@H](CC(=O)NCCc2cscn2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C19H27N3O5S/c23-10-17-16(22-19(25)13-4-7-26-8-5-13)2-1-15(27-17)9-18(24)20-6-3-14-11-28-12-21-14/h1-2,11-13,15-17,23H,3-10H2,(H,20,24)(H,22,25)/t15-,16+,17+/m1/s1	QCPIRAQCKOOPTJ-IKGGRYGDSA-N	409.167141684							98949
BRD-K78528600	LSM-13229		54638482	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21+/m0/s1	YLLZUOSUTCBCJJ-FCXXMXSZSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K78528600	BRD-K78528600-001-01-4	Broad Institute of MIT and Harvard	BRD-K78528600			C[C@H](NC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21+/m0/s1	YLLZUOSUTCBCJJ-FCXXMXSZSA-N	450.162470874							101868
BRD-K92758184	LSM-14113		54638473	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17-,18-/m0/s1	ZOURSNKVQGBTHH-BZSNNMDCSA-N	COCc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](CO)O2)nn1	BroadT	BRD-K92758184	BRD-K92758184-001-01-3	Broad Institute of MIT and Harvard	BRD-K92758184			COCc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](CO)O2)nn1	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17-,18-/m0/s1	ZOURSNKVQGBTHH-BZSNNMDCSA-N	457.193688962							102767
BRD-K37552925	LSM-10699		54638474	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17-,18+/m0/s1	ZOURSNKVQGBTHH-OKZBNKHCSA-N	COCc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](CO)O2)nn1	BroadT	BRD-K37552925	BRD-K37552925-001-01-2	Broad Institute of MIT and Harvard	BRD-K37552925			COCc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@@H](CO)O2)nn1	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17-,18+/m0/s1	ZOURSNKVQGBTHH-OKZBNKHCSA-N	457.193688962							99320
BRD-K01070670	LSM-8502		54638322	InChI=1S/C23H28F2N4O5/c1-33-16-5-3-15(4-6-16)27-23(32)28-19-9-7-17(34-21(19)13-30)10-11-26-22(31)29-20-12-14(24)2-8-18(20)25/h2-6,8,12,17,19,21,30H,7,9-11,13H2,1H3,(H2,26,29,31)(H2,27,28,32)/t17-,19-,21-/m1/s1	CXRYDROHJOKZNG-YFVAEKQCSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@@H]2CO)cc1	BroadT	BRD-K01070670	BRD-K01070670-001-01-4	Broad Institute of MIT and Harvard	BRD-K01070670			COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@@H]2CO)cc1	InChI=1S/C23H28F2N4O5/c1-33-16-5-3-15(4-6-16)27-23(32)28-19-9-7-17(34-21(19)13-30)10-11-26-22(31)29-20-12-14(24)2-8-18(20)25/h2-6,8,12,17,19,21,30H,7,9-11,13H2,1H3,(H2,26,29,31)(H2,27,28,32)/t17-,19-,21-/m1/s1	CXRYDROHJOKZNG-YFVAEKQCSA-N	478.202776436							97123
BRD-K91194423	LSM-14038		54638408	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19-,21-/m1/s1	XCDRDXJNPKYISK-QFIXIFRTSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@@H]2CO	BroadT	BRD-K91194423	BRD-K91194423-001-01-3	Broad Institute of MIT and Harvard	BRD-K91194423			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@@H]1CO	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19-,21-/m1/s1	XCDRDXJNPKYISK-QFIXIFRTSA-N	495.132776414							102691
BRD-K09632545	LSM-9016		54638270	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17-,21-/m0/s1	WCJFLIIYNCSVNP-WJPUGNRLSA-N	COc1ccccc1c2cn(CC[C@@H]3CC[C@H](NC(=O)c4cnccn4)[C@H](CO)O3)nn2	BroadT	BRD-K09632545	BRD-K09632545-001-01-6	Broad Institute of MIT and Harvard	BRD-K09632545			COc1ccccc1-c1cn(CC[C@@H]2CC[C@H](NC(=O)c3cnccn3)[C@H](CO)O2)nn1	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17-,21-/m0/s1	WCJFLIIYNCSVNP-WJPUGNRLSA-N	438.201553372							97637
BRD-K26924060	LSM-10061		54638407	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19+,21+/m1/s1	XCDRDXJNPKYISK-JJXUHFIVSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2CO	BroadT	BRD-K26924060	BRD-K26924060-001-01-1	Broad Institute of MIT and Harvard	BRD-K26924060			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@H]1CO	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19+,21+/m1/s1	XCDRDXJNPKYISK-JJXUHFIVSA-N	495.132776414							98682
BRD-K47214596	LSM-11312		54638253	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17+,18-/m1/s1	JVYCUASVIANWPE-FGTMMUONSA-N	CC(C)NC(=O)NCC[C@H]1CC[C@H](NC(=O)CCN2CCCCC2)[C@@H](CO)O1	BroadT	BRD-K47214596	BRD-K47214596-001-01-5	Broad Institute of MIT and Harvard	BRD-K47214596			CC(C)NC(=O)NCC[C@H]1CC[C@H](NC(=O)CCN2CCCCC2)[C@@H](CO)O1	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17+,18-/m1/s1	JVYCUASVIANWPE-FGTMMUONSA-N	398.289305736							99933
BRD-K69498175	LSM-12668		54638297	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15+,16+/m0/s1	ZKSUBHWMVQQNNI-ARFHVFGLSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H](NC(=O)Nc3c(C)onc3C)[C@@H](CO)O2	BroadT	BRD-K69498175	BRD-K69498175-001-01-6	Broad Institute of MIT and Harvard	BRD-K69498175			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2c(C)noc2C)[C@@H](CO)O1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15+,16+/m0/s1	ZKSUBHWMVQQNNI-ARFHVFGLSA-N	409.232519142							101302
BRD-K34798777	LSM-10522		54638266	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17+,21+/m1/s1	WCJFLIIYNCSVNP-KUDFPVQQSA-N	COc1ccccc1c2cn(CC[C@H]3CC[C@H](NC(=O)c4cnccn4)[C@H](CO)O3)nn2	BroadT	BRD-K34798777	BRD-K34798777-001-01-3	Broad Institute of MIT and Harvard	BRD-K34798777			COc1ccccc1-c1cn(CC[C@H]2CC[C@H](NC(=O)c3cnccn3)[C@H](CO)O2)nn1	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17+,21+/m1/s1	WCJFLIIYNCSVNP-KUDFPVQQSA-N	438.201553372							99143
BRD-K96269157	LSM-14336		54638450	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21-,23-/m0/s1	USGDOGGJJOICMT-FUDKSRODSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@@H]1NC(=O)c4cnccn4	BroadT	BRD-K96269157	BRD-K96269157-001-01-0	Broad Institute of MIT and Harvard	BRD-K96269157			OC[C@@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@@H]1NC(=O)c1cnccn1	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21-,23-/m0/s1	USGDOGGJJOICMT-FUDKSRODSA-N	450.22670548							102990
BRD-K42361507	LSM-10994		54638302	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15-,16+/m1/s1	ZKSUBHWMVQQNNI-OAGGEKHMSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H](NC(=O)Nc3c(C)onc3C)[C@H](CO)O2	BroadT	BRD-K42361507	BRD-K42361507-001-01-7	Broad Institute of MIT and Harvard	BRD-K42361507			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H](NC(=O)Nc2c(C)noc2C)[C@H](CO)O1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15-,16+/m1/s1	ZKSUBHWMVQQNNI-OAGGEKHMSA-N	409.232519142							99615
BRD-K77162730	LSM-13147		54638481	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21-/m1/s1	YLLZUOSUTCBCJJ-ZQYQINFJSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K77162730	BRD-K77162730-001-01-6	Broad Institute of MIT and Harvard	BRD-K77162730			C[C@@H](NC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21-/m1/s1	YLLZUOSUTCBCJJ-ZQYQINFJSA-N	450.162470874							101785
BRD-K55331619	LSM-11782		54638331	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21-,22-/m1/s1	INJNPRWYOQJIJD-CEMLEFRQSA-N	OC[C@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NS(=O)(=O)c4ccccc4F	BroadT	BRD-K55331619	BRD-K55331619-001-01-9	Broad Institute of MIT and Harvard	BRD-K55331619			OC[C@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21-,22-/m1/s1	INJNPRWYOQJIJD-CEMLEFRQSA-N	474.173704274							100407
BRD-K75703168	LSM-13057		54638226	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20-,21+/m0/s1	SKMIIEGWSYGYOW-SESVDKBCSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NCCc3ccncc3)O[C@@H]2CO	BroadT	BRD-K75703168	BRD-K75703168-001-01-0	Broad Institute of MIT and Harvard	BRD-K75703168			COc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCCc2ccncc2)O[C@@H]1CO	InChI=1S/C22H27N3O6S/c1-30-17-2-5-19(6-3-17)32(28,29)25-20-7-4-18(31-21(20)15-26)14-22(27)24-13-10-16-8-11-23-12-9-16/h2-9,11-12,18,20-21,25-26H,10,13-15H2,1H3,(H,24,27)/t18-,20-,21+/m0/s1	SKMIIEGWSYGYOW-SESVDKBCSA-N	461.162056304							101694
MLS003649983	LSM-12616	BRD-K68664718	53382646	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21-,23+/m0/s1	USGDOGGJJOICMT-QNWVGRARSA-N	OC[C@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@@H]1NC(=O)c4cnccn4	BroadT	BRD-K68664718	BRD-K68664718-001-01-8	Broad Institute of MIT and Harvard	BRD-K68664718			OC[C@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@@H]1NC(=O)c1cnccn1	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21-,23+/m0/s1	USGDOGGJJOICMT-QNWVGRARSA-N	450.22670548							101248
BRD-K86524002	LSM-13727		54638233	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16-,17-/m1/s1	RNIDAHWWXILMTD-BRWVUGGUSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K86524002	BRD-K86524002-001-01-7	Broad Institute of MIT and Harvard	BRD-K86524002			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)NC1CCCCC1	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16-,17-/m1/s1	RNIDAHWWXILMTD-BRWVUGGUSA-N	381.226371122							102376
BRD-K83095440	LSM-13508		54638381	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26-/m0/s1	HIZAXMBYTZOIAT-NXCFDTQHSA-N	COc1cccc(NC(=O)N[C@@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO)c1	BroadT	BRD-K83095440	BRD-K83095440-001-01-1	Broad Institute of MIT and Harvard	BRD-K83095440			COc1cccc(NC(=O)N[C@@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@H]2CO)c1	InChI=1S/C28H29N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-16,24-26,32H,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26-/m0/s1	HIZAXMBYTZOIAT-NXCFDTQHSA-N	487.210721058							102149
BRD-K41613119	LSM-10956		54638271	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17+,21-/m1/s1	WCJFLIIYNCSVNP-LDBYXDLTSA-N	COc1ccccc1c2cn(CC[C@H]3CC[C@H](NC(=O)c4cnccn4)[C@@H](CO)O3)nn2	BroadT	BRD-K41613119	BRD-K41613119-001-01-2	Broad Institute of MIT and Harvard	BRD-K41613119			COc1ccccc1-c1cn(CC[C@H]2CC[C@H](NC(=O)c3cnccn3)[C@@H](CO)O2)nn1	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17+,21-/m1/s1	WCJFLIIYNCSVNP-LDBYXDLTSA-N	438.201553372							99577
BRD-K97001739	LSM-14385		54638411	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19-,21+/m1/s1	XCDRDXJNPKYISK-VMRPVKRXSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2CO	BroadT	BRD-K97001739	BRD-K97001739-001-01-3	Broad Institute of MIT and Harvard	BRD-K97001739			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@H]1CO	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19-,21+/m1/s1	XCDRDXJNPKYISK-VMRPVKRXSA-N	495.132776414							103039
BRD-K46707636	LSM-11278		54638241	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18-,21-/m1/s1	WVRHSCPXBJSNMQ-HGHGUNKESA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K46707636	BRD-K46707636-001-01-1	Broad Institute of MIT and Harvard	BRD-K46707636			OC[C@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H25ClN2O7S/c23-15-2-5-17(6-3-15)33(28,29)25-18-7-4-16(32-21(18)12-26)9-10-24-22(27)14-1-8-19-20(11-14)31-13-30-19/h1-3,5-6,8,11,16,18,21,25-26H,4,7,9-10,12-13H2,(H,24,27)/t16-,18-,21-/m1/s1	WVRHSCPXBJSNMQ-HGHGUNKESA-N	496.10709956							99899
BRD-K50883617	LSM-11533		54638268	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17-,21+/m1/s1	WCJFLIIYNCSVNP-CEQIKUNHSA-N	COc1ccccc1c2cn(CC[C@H]3CC[C@@H](NC(=O)c4cnccn4)[C@H](CO)O3)nn2	BroadT	BRD-K50883617	BRD-K50883617-001-01-6	Broad Institute of MIT and Harvard	BRD-K50883617			COc1ccccc1-c1cn(CC[C@H]2CC[C@@H](NC(=O)c3cnccn3)[C@H](CO)O2)nn1	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17-,21+/m1/s1	WCJFLIIYNCSVNP-CEQIKUNHSA-N	438.201553372							100156
BRD-K38498572	LSM-10760		54638341	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19-,21+/m0/s1	ASLPZONUTGKWLH-IRFCIJBXSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3CCCCC3)CC[C@@H]1NC(=O)CN4CCOCC4	BroadT	BRD-K38498572	BRD-K38498572-001-01-3	Broad Institute of MIT and Harvard	BRD-K38498572			OC[C@H]1O[C@H](CCn2cc(nn2)C2CCCCC2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19-,21+/m0/s1	ASLPZONUTGKWLH-IRFCIJBXSA-N	435.284554714							99381
BRD-K31812348	LSM-10357		54638257	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17+,21+/m0/s1	VZUMNNKKGVSTKF-LUQKVYGDSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K31812348	BRD-K31812348-001-01-5	Broad Institute of MIT and Harvard	BRD-K31812348			OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17+,21+/m0/s1	VZUMNNKKGVSTKF-LUQKVYGDSA-N	475.155491886							98978
BRD-K78343029	LSM-13219		54638293	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21+/m0/s1	GWEQQAXOIQTOQH-NASSWSRMSA-N	C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K78343029	BRD-K78343029-001-01-1	Broad Institute of MIT and Harvard	BRD-K78343029			C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21+/m0/s1	GWEQQAXOIQTOQH-NASSWSRMSA-N	409.200156374							101858
BRD-K80171496	LSM-13322		54638453	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21+,23-/m0/s1	USGDOGGJJOICMT-XJUOHMSHSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@H]1NC(=O)c4cnccn4	BroadT	BRD-K80171496	BRD-K80171496-001-01-6	Broad Institute of MIT and Harvard	BRD-K80171496			OC[C@@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@H]1NC(=O)c1cnccn1	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21+,23-/m0/s1	USGDOGGJJOICMT-XJUOHMSHSA-N	450.22670548							101961
BRD-K50223932	LSM-11486		54638238	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16+,17-/m0/s1	RNIDAHWWXILMTD-BBWFWOEESA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K50223932	BRD-K50223932-001-01-3	Broad Institute of MIT and Harvard	BRD-K50223932			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)NC1CCCCC1	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16+,17-/m0/s1	RNIDAHWWXILMTD-BBWFWOEESA-N	381.226371122							100107
BRD-K47691029	LSM-11335		54638423	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16+/m0/s1	IXKFMJFBYVYICU-ARFHVFGLSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)Nc2c(C)onc2C)C=C1	BroadT	BRD-K47691029	BRD-K47691029-001-01-1	Broad Institute of MIT and Harvard	BRD-K47691029			CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)Nc2c(C)noc2C)C=C1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16+/m0/s1	IXKFMJFBYVYICU-ARFHVFGLSA-N	409.232519142							99956
BRD-K20310932	LSM-9669		54638454	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18+,19+/m0/s1	XLDWFJCTUAPIOT-QXAKKESOSA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K20310932	BRD-K20310932-001-01-5	Broad Institute of MIT and Harvard	BRD-K20310932			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18+,19+/m0/s1	XLDWFJCTUAPIOT-QXAKKESOSA-N	471.1839346							98290
BRD-K43420611	LSM-11069		54638232	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16+,17+/m1/s1	RNIDAHWWXILMTD-IKGGRYGDSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K43420611	BRD-K43420611-001-01-3	Broad Institute of MIT and Harvard	BRD-K43420611			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)NC1CCCCC1	InChI=1S/C19H31N3O5/c23-13-17-16(21-19(25)20-14-4-2-1-3-5-14)7-6-15(27-17)12-18(24)22-8-10-26-11-9-22/h6-7,14-17,23H,1-5,8-13H2,(H2,20,21,25)/t15-,16+,17+/m1/s1	RNIDAHWWXILMTD-IKGGRYGDSA-N	381.226371122							99690
BRD-K47366586	LSM-11319		54638429	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16-/m1/s1	IXKFMJFBYVYICU-OWCLPIDISA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Nc2c(C)onc2C)C=C1	BroadT	BRD-K47366586	BRD-K47366586-001-01-5	Broad Institute of MIT and Harvard	BRD-K47366586			CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Nc2c(C)noc2C)C=C1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h6-7,14-16,25H,5,8-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16-/m1/s1	IXKFMJFBYVYICU-OWCLPIDISA-N	409.232519142							99940
BRD-K79302166	LSM-13275		54638269	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17-,21-/m1/s1	WCJFLIIYNCSVNP-QLVMHMETSA-N	COc1ccccc1c2cn(CC[C@H]3CC[C@@H](NC(=O)c4cnccn4)[C@@H](CO)O3)nn2	BroadT	BRD-K79302166	BRD-K79302166-001-01-9	Broad Institute of MIT and Harvard	BRD-K79302166			COc1ccccc1-c1cn(CC[C@H]2CC[C@@H](NC(=O)c3cnccn3)[C@@H](CO)O2)nn1	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17-,21-/m1/s1	WCJFLIIYNCSVNP-QLVMHMETSA-N	438.201553372							101914
BRD-K35060817	LSM-10537		54638413	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19+,21-/m0/s1	XCDRDXJNPKYISK-DLVCFXQMSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2CO	BroadT	BRD-K35060817	BRD-K35060817-001-01-9	Broad Institute of MIT and Harvard	BRD-K35060817			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@H]1CO	InChI=1S/C23H27Cl2N3O5/c1-32-20-5-3-2-4-18(20)27-23(31)28-19-9-7-15(33-21(19)13-29)11-22(30)26-12-14-6-8-16(24)17(25)10-14/h2-6,8,10,15,19,21,29H,7,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,19+,21-/m0/s1	XCDRDXJNPKYISK-DLVCFXQMSA-N	495.132776414							99158
BRD-K47881779	LSM-11341		54638353	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19+,20+/m1/s1	ADNYLXRIKBBTKJ-AABGKKOBSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K47881779	BRD-K47881779-001-01-0	Broad Institute of MIT and Harvard	BRD-K47881779			Cn1cnc(c1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@H]1CO	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19+,20+/m1/s1	ADNYLXRIKBBTKJ-AABGKKOBSA-N	475.188939768							99962
BRD-K52369815	LSM-11630		54638278	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16-,17+/m0/s1	VHNINRJVEBHVBF-YESZJQIVSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2CO	BroadT	BRD-K52369815	BRD-K52369815-001-01-4	Broad Institute of MIT and Harvard	BRD-K52369815			Cn1cnc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16-,17+/m0/s1	VHNINRJVEBHVBF-YESZJQIVSA-N	428.209340854							100255
BRD-K84468307	LSM-13592		54638506	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24+,27-/m1/s1	IKYPBPDRSBKALY-ONBPZOJHSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K84468307	BRD-K84468307-001-01-1	Broad Institute of MIT and Harvard	BRD-K84468307			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24+,27-/m1/s1	IKYPBPDRSBKALY-ONBPZOJHSA-N	518.20530132							102236
BRD-K33668351	LSM-10470		54638434	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16-,18-/m0/s1	YJKUDHPPBXQQCK-BQFCYCMXSA-N	COc1ccccc1CNC(=O)C[C@H]2O[C@@H](CO)[C@@H](NC(=O)CN(C)C)C=C2	BroadT	BRD-K33668351	BRD-K33668351-001-01-3	Broad Institute of MIT and Harvard	BRD-K33668351			COc1ccccc1CNC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)CN(C)C)C=C1	InChI=1S/C20H29N3O5/c1-23(2)12-20(26)22-16-9-8-15(28-18(16)13-24)10-19(25)21-11-14-6-4-5-7-17(14)27-3/h4-9,15-16,18,24H,10-13H2,1-3H3,(H,21,25)(H,22,26)/t15-,16-,18-/m0/s1	YJKUDHPPBXQQCK-BQFCYCMXSA-N	391.210721058							99091
BRD-K84143894	LSM-13573		54638495	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20-,21+/m0/s1	ZTKNNPSVJPUDLJ-SESVDKBCSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K84143894	BRD-K84143894-001-01-9	Broad Institute of MIT and Harvard	BRD-K84143894			OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20-,21+/m0/s1	ZTKNNPSVJPUDLJ-SESVDKBCSA-N	486.129456184							102215
BRD-K79410674	LSM-13281		54638399	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14-,15-/m1/s1	AKLLRXAVVXEIMF-RBSFLKMASA-N	CN(C)C(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)c2ccc(F)cc2)C=C1	BroadT	BRD-K79410674	BRD-K79410674-001-01-5	Broad Institute of MIT and Harvard	BRD-K79410674			CN(C)C(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)c2ccc(F)cc2)C=C1	InChI=1S/C17H21FN2O4/c1-20(2)16(22)9-13-7-8-14(15(10-21)24-13)19-17(23)11-3-5-12(18)6-4-11/h3-8,13-15,21H,9-10H2,1-2H3,(H,19,23)/t13-,14-,15-/m1/s1	AKLLRXAVVXEIMF-RBSFLKMASA-N	336.148535372							101920
BRD-K23586462	LSM-9846		54638363	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18-,19+/m0/s1	VGDFEWNPUKUXSQ-GBESFXJTSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C=C[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K23586462	BRD-K23586462-001-01-5	Broad Institute of MIT and Harvard	BRD-K23586462			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C=C[C@@H]1NC(=O)c1cccnc1	InChI=1S/C21H30N4O4/c26-15-19-18(24-21(28)16-5-4-8-22-14-16)7-6-17(29-19)13-20(27)23-9-12-25-10-2-1-3-11-25/h4-8,14,17-19,26H,1-3,9-13,15H2,(H,23,27)(H,24,28)/t17-,18-,19+/m0/s1	VGDFEWNPUKUXSQ-GBESFXJTSA-N	402.22670548							98467
BRD-K54431311-001-01-9	LSM-11733	BRD-K54431311	54638440	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13+,14+/m1/s1	DUQQDWAUZUWJHX-SWHYSGLUSA-N	NCC[C@H]1CC[C@H](NC(=O)c2ccccc2F)[C@H](CO)O1	BroadT	BRD-K54431311	BRD-K54431311-001-01-9	Broad Institute of MIT and Harvard	BRD-K54431311			NCC[C@H]1CC[C@H](NC(=O)c2ccccc2F)[C@H](CO)O1	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13+,14+/m1/s1	DUQQDWAUZUWJHX-SWHYSGLUSA-N	296.153620752							100358
BRD-K39911043	LSM-10864		54638267	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17-,21+/m0/s1	WCJFLIIYNCSVNP-HZUJVAHNSA-N	COc1ccccc1c2cn(CC[C@@H]3CC[C@H](NC(=O)c4cnccn4)[C@@H](CO)O3)nn2	BroadT	BRD-K39911043	BRD-K39911043-001-01-5	Broad Institute of MIT and Harvard	BRD-K39911043			COc1ccccc1-c1cn(CC[C@@H]2CC[C@H](NC(=O)c3cnccn3)[C@@H](CO)O2)nn1	InChI=1S/C22H26N6O4/c1-31-20-5-3-2-4-16(20)19-13-28(27-26-19)11-8-15-6-7-17(21(14-29)32-15)25-22(30)18-12-23-9-10-24-18/h2-5,9-10,12-13,15,17,21,29H,6-8,11,14H2,1H3,(H,25,30)/t15-,17-,21+/m0/s1	WCJFLIIYNCSVNP-HZUJVAHNSA-N	438.201553372							99485
BRD-K37303684	LSM-10681		54638394	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17-,19-/m1/s1	BDFFQCHCBQOAPA-ZHALLVOQSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@H](CCNC(=O)C3CCOCC3)O[C@@H]2CO	BroadT	BRD-K37303684	BRD-K37303684-001-01-1	Broad Institute of MIT and Harvard	BRD-K37303684			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17-,19-/m1/s1	BDFFQCHCBQOAPA-ZHALLVOQSA-N	456.193022074							99302
BRD-K48102470	LSM-11358		54638311	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18+,19-/m1/s1	WMHOVAQHNBVIPJ-NZSAHSFTSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K48102470	BRD-K48102470-001-01-2	Broad Institute of MIT and Harvard	BRD-K48102470			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18+,19-/m1/s1	WMHOVAQHNBVIPJ-NZSAHSFTSA-N	467.128169362							99979
BRD-K47686295	LSM-11334		54638483	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21+/m1/s1	YLLZUOSUTCBCJJ-KYPFXXDHSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K47686295	BRD-K47686295-001-01-8	Broad Institute of MIT and Harvard	BRD-K47686295			C[C@@H](NC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21+/m1/s1	YLLZUOSUTCBCJJ-KYPFXXDHSA-N	450.162470874							99955
CHEMBL2359901	LSM-8703	SID131434559, BRD-K04533640	54638282	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21+/m0/s1	GWEQQAXOIQTOQH-VRXWPRPYSA-N	C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K04533640	BRD-K04533640-001-01-5	Broad Institute of MIT and Harvard	BRD-K04533640			C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21+/m0/s1	GWEQQAXOIQTOQH-VRXWPRPYSA-N	409.200156374							97324
BRD-K76876037	LSM-13132		54638513	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19+/m1/s1	PBTCYEHOLZFKGG-QRVBRYPASA-N	CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	BroadT	BRD-K76876037	BRD-K76876037-001-01-2	Broad Institute of MIT and Harvard	BRD-K76876037			CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19+/m1/s1	PBTCYEHOLZFKGG-QRVBRYPASA-N	387.215806438							101770
BRD-K92134560	LSM-14088		54638515	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19-/m0/s1	PBTCYEHOLZFKGG-OTWHNJEPSA-N	CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	BroadT	BRD-K92134560	BRD-K92134560-001-01-1	Broad Institute of MIT and Harvard	BRD-K92134560			CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19-/m0/s1	PBTCYEHOLZFKGG-OTWHNJEPSA-N	387.215806438							102742
BRD-K22694382	LSM-9807		54638307	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18-,19+/m0/s1	WMHOVAQHNBVIPJ-YTQUADARSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K22694382	BRD-K22694382-001-01-5	Broad Institute of MIT and Harvard	BRD-K22694382			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18-,19+/m0/s1	WMHOVAQHNBVIPJ-YTQUADARSA-N	467.128169362							98428
BRD-K76688397	LSM-13123		54638528	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20-/m1/s1	JTIOTWTUDVMQPE-HSALFYBXSA-N	OC[C@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)Nc3ccc(Cl)cc3	BroadT	BRD-K76688397	BRD-K76688397-001-01-5	Broad Institute of MIT and Harvard	BRD-K76688397			OC[C@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H27ClN4O4/c23-15-4-6-16(7-5-15)26-22(30)27-19-9-8-18(31-20(19)14-28)10-12-25-21(29)13-17-3-1-2-11-24-17/h1-7,11,18-20,28H,8-10,12-14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20-/m1/s1	JTIOTWTUDVMQPE-HSALFYBXSA-N	446.172083094							101761
BRD-K86853253	LSM-13755		54638264	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17+,21-/m0/s1	VZUMNNKKGVSTKF-XPIZARPCSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K86853253	BRD-K86853253-001-01-6	Broad Institute of MIT and Harvard	BRD-K86853253			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17+,21-/m0/s1	VZUMNNKKGVSTKF-XPIZARPCSA-N	475.155491886							102404
BRD-K37752193-001-01-3	LSM-10712	BRD-K37752193	54638446	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13+,14-/m0/s1	DUQQDWAUZUWJHX-GDLCADMTSA-N	NCC[C@@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@H](CO)O1	BroadT	BRD-K37752193	BRD-K37752193-001-01-3	Broad Institute of MIT and Harvard	BRD-K37752193			NCC[C@@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@H](CO)O1	InChI=1S/C15H21FN2O3/c16-12-4-2-1-3-11(12)15(20)18-13-6-5-10(7-8-17)21-14(13)9-19/h1-4,10,13-14,19H,5-9,17H2,(H,18,20)/t10-,13+,14-/m0/s1	DUQQDWAUZUWJHX-GDLCADMTSA-N	296.153620752							99333
BRD-K32233845	LSM-10382		54638392	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17-,19+/m0/s1	BDFFQCHCBQOAPA-JENIJYKNSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@@H](CCNC(=O)C3CCOCC3)O[C@@H]2CO	BroadT	BRD-K32233845	BRD-K32233845-001-01-1	Broad Institute of MIT and Harvard	BRD-K32233845			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17-,19+/m0/s1	BDFFQCHCBQOAPA-JENIJYKNSA-N	456.193022074							99003
BRD-K91787616	LSM-14070		54638217	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15-,16-/m0/s1	SOYBDXBXTZOLGY-JYJNAYRXSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccccc2)CC[C@@H]1NC(=O)C3CC3	BroadT	BRD-K91787616	BRD-K91787616-001-01-1	Broad Institute of MIT and Harvard	BRD-K91787616			OC[C@@H]1O[C@H](CC(=O)Nc2ccccc2)CC[C@@H]1NC(=O)C1CC1	InChI=1S/C18H24N2O4/c21-11-16-15(20-18(23)12-6-7-12)9-8-14(24-16)10-17(22)19-13-4-2-1-3-5-13/h1-5,12,14-16,21H,6-11H2,(H,19,22)(H,20,23)/t14-,15-,16-/m0/s1	SOYBDXBXTZOLGY-JYJNAYRXSA-N	332.173607268							102724
BRD-K21528100	LSM-9734		54638315	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25-,26-/m1/s1	JXWMWOXWMMUZLT-LGPLSSKUSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)N3CCC(Cc4ccccc4)CC3)O[C@@H]2CO	BroadT	BRD-K21528100	BRD-K21528100-001-01-7	Broad Institute of MIT and Harvard	BRD-K21528100			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@@H]1CO	InChI=1S/C27H36N2O6S/c1-34-22-7-10-24(11-8-22)36(32,33)28-25-12-9-23(35-26(25)19-30)18-27(31)29-15-13-21(14-16-29)17-20-5-3-2-4-6-20/h2-8,10-11,21,23,25-26,28,30H,9,12-19H2,1H3/t23-,25-,26-/m1/s1	JXWMWOXWMMUZLT-LGPLSSKUSA-N	516.229407582							98355
BRD-K94765019	LSM-14238		54638275	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16-,17-/m1/s1	VHNINRJVEBHVBF-BRWVUGGUSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)NCC3CCCCC3)O[C@@H]2CO	BroadT	BRD-K94765019	BRD-K94765019-001-01-7	Broad Institute of MIT and Harvard	BRD-K94765019			Cn1cnc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	InChI=1S/C19H32N4O5S/c1-23-11-19(21-13-23)29(26,27)22-16-8-7-15(28-17(16)12-24)9-18(25)20-10-14-5-3-2-4-6-14/h11,13-17,22,24H,2-10,12H2,1H3,(H,20,25)/t15-,16-,17-/m1/s1	VHNINRJVEBHVBF-BRWVUGGUSA-N	428.209340854							102892
BRD-K00801770	LSM-8484		54638286	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21-/m1/s1	GWEQQAXOIQTOQH-QYRPDUKASA-N	C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c3ccccc3	BroadT	BRD-K00801770	BRD-K00801770-001-01-2	Broad Institute of MIT and Harvard	BRD-K00801770			C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1)c1ccccc1	InChI=1S/C23H27N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-12,16,19-21,27H,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21-/m1/s1	GWEQQAXOIQTOQH-QYRPDUKASA-N	409.200156374							97105
BRD-K68370959	LSM-12600		54638303	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15+,16-/m1/s1	ZKSUBHWMVQQNNI-OWCLPIDISA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H](NC(=O)Nc3c(C)onc3C)[C@@H](CO)O2	BroadT	BRD-K68370959	BRD-K68370959-001-01-0	Broad Institute of MIT and Harvard	BRD-K68370959			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H](NC(=O)Nc2c(C)noc2C)[C@@H](CO)O1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15+,16-/m1/s1	ZKSUBHWMVQQNNI-OWCLPIDISA-N	409.232519142							101232
BRD-K73804157	LSM-12949		54638511	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19-/m0/s1	PBTCYEHOLZFKGG-FHWLQOOXSA-N	CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	BroadT	BRD-K73804157	BRD-K73804157-001-01-1	Broad Institute of MIT and Harvard	BRD-K73804157			CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19-/m0/s1	PBTCYEHOLZFKGG-FHWLQOOXSA-N	387.215806438							101586
BRD-K60857329	LSM-12112		54638470	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17+,18+/m1/s1	ZOURSNKVQGBTHH-SQNIBIBYSA-N	COCc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](CO)O2)nn1	BroadT	BRD-K60857329	BRD-K60857329-001-01-7	Broad Institute of MIT and Harvard	BRD-K60857329			COCc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)[C@H](CO)O2)nn1	InChI=1S/C20H26F3N5O4/c1-31-12-15-10-28(27-26-15)9-8-16-6-7-17(18(11-29)32-16)25-19(30)24-14-4-2-13(3-5-14)20(21,22)23/h2-5,10,16-18,29H,6-9,11-12H2,1H3,(H2,24,25,30)/t16-,17+,18+/m1/s1	ZOURSNKVQGBTHH-SQNIBIBYSA-N	457.193688962							100738
BRD-K10951564	LSM-9097		54638358	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19+,20-/m0/s1	ADNYLXRIKBBTKJ-ZCNNSNEGSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K10951564	BRD-K10951564-001-01-3	Broad Institute of MIT and Harvard	BRD-K10951564			Cn1cnc(c1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@H]1CO	InChI=1S/C22H29N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-8,14,16,18-20,24,28H,9-13,15H2,1H3/t18-,19+,20-/m0/s1	ADNYLXRIKBBTKJ-ZCNNSNEGSA-N	475.188939768							97718
BRD-K46796516	LSM-11286		54638260	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21-/m0/s1	VZUMNNKKGVSTKF-WJPUGNRLSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K46796516	BRD-K46796516-001-01-9	Broad Institute of MIT and Harvard	BRD-K46796516			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C23H23F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-8,15,17,21,29H,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21-/m0/s1	VZUMNNKKGVSTKF-WJPUGNRLSA-N	475.155491886							99907
BRD-K19677752	LSM-9619		54638487	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21-/m0/s1	YLLZUOSUTCBCJJ-SKRQURTPSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K19677752	BRD-K19677752-001-01-7	Broad Institute of MIT and Harvard	BRD-K19677752			C[C@H](NC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21-/m0/s1	YLLZUOSUTCBCJJ-SKRQURTPSA-N	450.162470874							98240
BRD-K94688728	LSM-14230		54638491	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21+/m1/s1	YLLZUOSUTCBCJJ-OBUJGBQQSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K94688728	BRD-K94688728-001-01-3	Broad Institute of MIT and Harvard	BRD-K94688728			C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21+/m1/s1	YLLZUOSUTCBCJJ-OBUJGBQQSA-N	450.162470874							102884
BRD-K61541040	LSM-12161		54638346	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18-,21-/m1/s1	WGFFUWNETOGMCB-DBXWQHBBSA-N	OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K61541040	BRD-K61541040-001-01-4	Broad Institute of MIT and Harvard	BRD-K61541040			OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H34N4O7/c28-14-21-18(26-23(30)25-16-2-5-19-20(12-16)33-15-32-19)4-3-17(34-21)13-22(29)24-6-1-7-27-8-10-31-11-9-27/h2,5,12,17-18,21,28H,1,3-4,6-11,13-15H2,(H,24,29)(H2,25,26,30)/t17-,18-,21-/m1/s1	WGFFUWNETOGMCB-DBXWQHBBSA-N	478.242749468							100787
BRD-K02409808	LSM-8583		54638332	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21-,22-/m0/s1	INJNPRWYOQJIJD-BVSLBCMMSA-N	OC[C@@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NS(=O)(=O)c4ccccc4F	BroadT	BRD-K02409808	BRD-K02409808-001-01-8	Broad Institute of MIT and Harvard	BRD-K02409808			OC[C@@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C23H27FN4O4S/c24-20-8-4-5-9-23(20)33(30,31)26-21-11-10-19(32-22(21)16-29)12-13-28-15-18(25-27-28)14-17-6-2-1-3-7-17/h1-9,15,19,21-22,26,29H,10-14,16H2/t19-,21-,22-/m0/s1	INJNPRWYOQJIJD-BVSLBCMMSA-N	474.173704274							97204
BRD-K26840329	LSM-10055		54638479	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21-/m1/s1	YLLZUOSUTCBCJJ-NSGGIEJNSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K26840329	BRD-K26840329-001-01-6	Broad Institute of MIT and Harvard	BRD-K26840329			C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21-/m1/s1	YLLZUOSUTCBCJJ-NSGGIEJNSA-N	450.162470874							98676
BRD-K42679345	LSM-11019		54638299	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15-,16-/m1/s1	ZKSUBHWMVQQNNI-BZUAXINKSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H](NC(=O)Nc3c(C)onc3C)[C@@H](CO)O2	BroadT	BRD-K42679345	BRD-K42679345-001-01-8	Broad Institute of MIT and Harvard	BRD-K42679345			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H](NC(=O)Nc2c(C)noc2C)[C@@H](CO)O1	InChI=1S/C19H31N5O5/c1-12-18(13(2)29-22-12)21-19(27)20-15-5-4-14(28-16(15)11-25)10-17(26)24-8-6-23(3)7-9-24/h14-16,25H,4-11H2,1-3H3,(H2,20,21,27)/t14-,15-,16-/m1/s1	ZKSUBHWMVQQNNI-BZUAXINKSA-N	409.232519142							99640
BRD-K77970970	LSM-13201		54638312	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18+,19-/m0/s1	WMHOVAQHNBVIPJ-UHOSZYNNSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K77970970	BRD-K77970970-001-01-1	Broad Institute of MIT and Harvard	BRD-K77970970			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C21H26ClN3O5S/c22-17-5-1-2-6-20(17)31(28,29)24-11-9-16-7-8-18(19(14-26)30-16)25-21(27)12-15-4-3-10-23-13-15/h1-6,10,13,16,18-19,24,26H,7-9,11-12,14H2,(H,25,27)/t16-,18+,19-/m0/s1	WMHOVAQHNBVIPJ-UHOSZYNNSA-N	467.128169362							101839
BRD-K74594501	LSM-12999		54638397	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17+,19-/m0/s1	BDFFQCHCBQOAPA-SCTDSRPQSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@@H](CCNC(=O)C3CCOCC3)O[C@H]2CO	BroadT	BRD-K74594501	BRD-K74594501-001-01-0	Broad Institute of MIT and Harvard	BRD-K74594501			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	InChI=1S/C21H32N2O7S/c1-28-18-4-2-3-5-20(18)31(26,27)23-17-7-6-16(30-19(17)14-24)8-11-22-21(25)15-9-12-29-13-10-15/h2-5,15-17,19,23-24H,6-14H2,1H3,(H,22,25)/t16-,17+,19-/m0/s1	BDFFQCHCBQOAPA-SCTDSRPQSA-N	456.193022074							101636
BRD-K77831863	LSM-13189		54638496	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20+,21-/m1/s1	ZTKNNPSVJPUDLJ-HLAWJBBLSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K77831863	BRD-K77831863-001-01-5	Broad Institute of MIT and Harvard	BRD-K77831863			OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H27FN2O6S2/c22-17-6-9-19(10-7-17)32(28,29)24-20-11-8-18(30-21(20)14-25)12-13-23-31(26,27)15-16-4-2-1-3-5-16/h1-7,9-10,18,20-21,23-25H,8,11-15H2/t18-,20+,21-/m1/s1	ZTKNNPSVJPUDLJ-HLAWJBBLSA-N	486.129456184							101827
BRD-K72443777	LSM-12873		54638500	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24+,27+/m0/s1	IKYPBPDRSBKALY-CLCZQPDDSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K72443777	BRD-K72443777-001-01-9	Broad Institute of MIT and Harvard	BRD-K72443777			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C29H30N2O7/c32-17-27-24(31-29(34)20-8-13-25-26(14-20)36-18-35-25)12-11-23(38-27)15-28(33)30-16-19-6-9-22(10-7-19)37-21-4-2-1-3-5-21/h1-10,13-14,23-24,27,32H,11-12,15-18H2,(H,30,33)(H,31,34)/t23-,24+,27+/m0/s1	IKYPBPDRSBKALY-CLCZQPDDSA-N	518.20530132							101510
BRD-K73873786	LSM-12954		54638250	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17+,18+/m1/s1	JVYCUASVIANWPE-SQNIBIBYSA-N	CC(C)NC(=O)NCC[C@H]1CC[C@H](NC(=O)CCN2CCCCC2)[C@H](CO)O1	BroadT	BRD-K73873786	BRD-K73873786-001-01-5	Broad Institute of MIT and Harvard	BRD-K73873786			CC(C)NC(=O)NCC[C@H]1CC[C@H](NC(=O)CCN2CCCCC2)[C@H](CO)O1	InChI=1S/C20H38N4O4/c1-15(2)22-20(27)21-10-8-16-6-7-17(18(14-25)28-16)23-19(26)9-13-24-11-4-3-5-12-24/h15-18,25H,3-14H2,1-2H3,(H,23,26)(H2,21,22,27)/t16-,17+,18+/m1/s1	JVYCUASVIANWPE-SQNIBIBYSA-N	398.289305736							101591
BRD-K99567611	LSM-14545		54638523	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18+,19-/m0/s1	ZAZOOTZCNDNOOW-UHOSZYNNSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](CO)O1	BroadT	BRD-K99567611	BRD-K99567611-001-01-4	Broad Institute of MIT and Harvard	BRD-K99567611			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](CO)O1	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18+,19-/m0/s1	ZAZOOTZCNDNOOW-UHOSZYNNSA-N	427.214091876							103200
BRD-K34431359	LSM-10507		54638466	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14-,16+/m1/s1	QWCXAENNPFGWBU-FMKPAKJESA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K34431359	BRD-K34431359-001-01-7	Broad Institute of MIT and Harvard	BRD-K34431359			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C18H25N3O5/c22-12-16-14(20-18(24)15-3-1-2-6-19-15)5-4-13(26-16)11-17(23)21-7-9-25-10-8-21/h1-3,6,13-14,16,22H,4-5,7-12H2,(H,20,24)/t13-,14-,16+/m1/s1	QWCXAENNPFGWBU-FMKPAKJESA-N	363.17942093							99128
BRD-K63798874	LSM-12311		54638447	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21+,23+/m0/s1	USGDOGGJJOICMT-QZNHQXDQSA-N	OC[C@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@H]1NC(=O)c4cnccn4	BroadT	BRD-K63798874	BRD-K63798874-001-01-9	Broad Institute of MIT and Harvard	BRD-K63798874			OC[C@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)C=C[C@H]1NC(=O)c1cnccn1	InChI=1S/C25H30N4O4/c30-17-23-21(28-25(32)22-16-26-10-11-27-22)7-6-20(33-23)15-24(31)29-12-8-19(9-13-29)14-18-4-2-1-3-5-18/h1-7,10-11,16,19-21,23,30H,8-9,12-15,17H2,(H,28,32)/t20-,21+,23+/m0/s1	USGDOGGJJOICMT-QZNHQXDQSA-N	450.22670548							100938
BRD-K43216840	LSM-11055		54638488	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21+/m1/s1	YLLZUOSUTCBCJJ-SKBHOOIQSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K43216840	BRD-K43216840-001-01-8	Broad Institute of MIT and Harvard	BRD-K43216840			C[C@@H](NC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21+/m1/s1	YLLZUOSUTCBCJJ-SKBHOOIQSA-N	450.162470874							99676
BRD-K62814224	LSM-12245		54638516	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18+,19+/m0/s1	ZAZOOTZCNDNOOW-QXAKKESOSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](CO)O1	BroadT	BRD-K62814224	BRD-K62814224-001-01-2	Broad Institute of MIT and Harvard	BRD-K62814224			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](CO)O1	InChI=1S/C20H33N3O5S/c1-15-5-8-17(9-6-15)29(26,27)22-18-10-7-16(28-19(18)14-24)13-20(25)21-11-4-12-23(2)3/h5-6,8-9,16,18-19,22,24H,4,7,10-14H2,1-3H3,(H,21,25)/t16-,18+,19+/m0/s1	ZAZOOTZCNDNOOW-QXAKKESOSA-N	427.214091876							100871
BRD-K14736141	LSM-9319		54638492	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21-/m0/s1	YLLZUOSUTCBCJJ-MEGFKASBSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K14736141	BRD-K14736141-001-01-6	Broad Institute of MIT and Harvard	BRD-K14736141			C[C@H](NC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(F)c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-9,12,15,18,20-21,25-26H,10-11,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21-/m0/s1	YLLZUOSUTCBCJJ-MEGFKASBSA-N	450.162470874							97940
BRD-K84718005	LSM-13607		54638512	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19+/m0/s1	PBTCYEHOLZFKGG-GBESFXJTSA-N	CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	BroadT	BRD-K84718005	BRD-K84718005-001-01-4	Broad Institute of MIT and Harvard	BRD-K84718005			CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	InChI=1S/C21H29N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-8,13,16-19,25H,9-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19+/m0/s1	PBTCYEHOLZFKGG-GBESFXJTSA-N	387.215806438							102252
BRD-K23794511	LSM-9866		54638458	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18-,19+/m1/s1	XLDWFJCTUAPIOT-QRQLOZEOSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K23794511	BRD-K23794511-001-01-6	Broad Institute of MIT and Harvard	BRD-K23794511			OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H30FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-7,16,18-19,24,26H,3,8-15H2,(H,23,27)/t16-,18-,19+/m1/s1	XLDWFJCTUAPIOT-QRQLOZEOSA-N	471.1839346							98487
BRD-K31121304	LSM-29681		54640401	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19+,20+/m1/s1	DSHMBJFFZMCEDJ-HOJAQTOUSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K31121304	BRD-K31121304-001-01-3	Broad Institute of MIT and Harvard	BRD-K31121304			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19+,20+/m1/s1	DSHMBJFFZMCEDJ-HOJAQTOUSA-N	451.157719852							118232
BRD-K90901488	LSM-29682		54640312	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20+,22-/m0/s1	DFXHLBQSDWHRLL-WEYGHZABSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3ccccc3F)CC[C@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K90901488	BRD-K90901488-001-01-4	Broad Institute of MIT and Harvard	BRD-K90901488			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2ccccc2F)CC[C@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20+,22-/m0/s1	DFXHLBQSDWHRLL-WEYGHZABSA-N	473.16299562							118233
BRD-K75192396	LSM-29683		54640226	InChI=1S/C18H25FN2O5S/c19-12-4-7-15(8-5-12)27(24,25)21-16-9-6-14(26-17(16)11-22)10-18(23)20-13-2-1-3-13/h4-5,7-8,13-14,16-17,21-22H,1-3,6,9-11H2,(H,20,23)/t14-,16-,17+/m0/s1	NFGCCTFMVYXSBN-BHYGNILZSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCC2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K75192396	BRD-K75192396-001-01-0	Broad Institute of MIT and Harvard	BRD-K75192396			OC[C@H]1O[C@H](CC(=O)NC2CCC2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C18H25FN2O5S/c19-12-4-7-15(8-5-12)27(24,25)21-16-9-6-14(26-17(16)11-22)10-18(23)20-13-2-1-3-13/h4-5,7-8,13-14,16-17,21-22H,1-3,6,9-11H2,(H,20,23)/t14-,16-,17+/m0/s1	NFGCCTFMVYXSBN-BHYGNILZSA-N	400.14682081							118234
BRD-K45974539	LSM-29684		54640240	InChI=1S/C21H30ClN3O5/c22-15-2-1-3-16(12-15)24-21(28)25-18-5-4-17(30-19(18)13-26)6-9-23-20(27)14-7-10-29-11-8-14/h1-3,12,14,17-19,26H,4-11,13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19+/m0/s1	PBAPATWUXUNVNP-GBESFXJTSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)Nc3cccc(Cl)c3	BroadT	BRD-K45974539	BRD-K45974539-001-01-6	Broad Institute of MIT and Harvard	BRD-K45974539			OC[C@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C21H30ClN3O5/c22-15-2-1-3-16(12-15)24-21(28)25-18-5-4-17(30-19(18)13-26)6-9-23-20(27)14-7-10-29-11-8-14/h1-3,12,14,17-19,26H,4-11,13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19+/m0/s1	PBAPATWUXUNVNP-GBESFXJTSA-N	439.1873988							118235
BRD-K61124142	LSM-29685		54640337	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20+/m0/s1	SDPGYCOKVZGVFV-FFZOFVMBSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K61124142	BRD-K61124142-001-01-6	Broad Institute of MIT and Harvard	BRD-K61124142			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20+/m0/s1	SDPGYCOKVZGVFV-FFZOFVMBSA-N	415.190734542							118236
BRD-K45665532	LSM-29686		54640291	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19-,20+/m1/s1	WDGFJBRIXWVRNV-RLLQIKCJSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)CC[C@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K45665532	BRD-K45665532-001-01-7	Broad Institute of MIT and Harvard	BRD-K45665532			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)CC[C@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19-,20+/m1/s1	WDGFJBRIXWVRNV-RLLQIKCJSA-N	439.214091876							118237
BRD-K04695993	LSM-29687		54640305	InChI=1S/C26H25N3O4/c30-17-24-23(29-26(32)20-12-14-27-15-13-20)11-10-22(33-24)16-25(31)28-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-15,22-24,30H,16-17H2,(H,28,31)(H,29,32)/t22-,23+,24-/m1/s1	WWBREHKQUAGTED-TZRRMPRUSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)c4ccncc4	BroadT	BRD-K04695993	BRD-K04695993-001-01-5	Broad Institute of MIT and Harvard	BRD-K04695993			OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)c1ccncc1	InChI=1S/C26H25N3O4/c30-17-24-23(29-26(32)20-12-14-27-15-13-20)11-10-22(33-24)16-25(31)28-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-15,22-24,30H,16-17H2,(H,28,31)(H,29,32)/t22-,23+,24-/m1/s1	WWBREHKQUAGTED-TZRRMPRUSA-N	443.18450631							118238
BRD-K82176364	LSM-29688		54640272	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19-,21-/m1/s1	GELVUGAWQDMXAC-OZOXKJRCSA-N	Cc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@@H]2CO	BroadT	BRD-K82176364	BRD-K82176364-001-01-2	Broad Institute of MIT and Harvard	BRD-K82176364			Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CCNC(=O)Nc2cc(F)ccc2F)O[C@@H]1CO	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19-,21-/m1/s1	GELVUGAWQDMXAC-OZOXKJRCSA-N	483.163948084							118239
BRD-K30361950	LSM-29689		54640349	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19+,20+/m1/s1	VDBDKUPLXIXHLN-UXPWSPDFSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K30361950	BRD-K30361950-001-01-3	Broad Institute of MIT and Harvard	BRD-K30361950			OC[C@@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19+,20+/m1/s1	VDBDKUPLXIXHLN-UXPWSPDFSA-N	483.17811911							118240
BRD-K65910757	LSM-29690		54640223	InChI=1S/C18H25FN2O5S/c19-12-4-7-15(8-5-12)27(24,25)21-16-9-6-14(26-17(16)11-22)10-18(23)20-13-2-1-3-13/h4-5,7-8,13-14,16-17,21-22H,1-3,6,9-11H2,(H,20,23)/t14-,16+,17+/m1/s1	NFGCCTFMVYXSBN-PVAVHDDUSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCC2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K65910757	BRD-K65910757-001-01-0	Broad Institute of MIT and Harvard	BRD-K65910757			OC[C@@H]1O[C@@H](CC(=O)NC2CCC2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C18H25FN2O5S/c19-12-4-7-15(8-5-12)27(24,25)21-16-9-6-14(26-17(16)11-22)10-18(23)20-13-2-1-3-13/h4-5,7-8,13-14,16-17,21-22H,1-3,6,9-11H2,(H,20,23)/t14-,16+,17+/m1/s1	NFGCCTFMVYXSBN-PVAVHDDUSA-N	400.14682081							118241
BRD-K91726436	LSM-29691		54640163	InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13-/m0/s1	IZNXMLLZVKASMZ-AVGNSLFASA-N	OC[C@@H]1O[C@H](CC(=O)O)C=C[C@@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K91726436	BRD-K91726436-001-01-7	Broad Institute of MIT and Harvard	BRD-K91726436			OC[C@@H]1O[C@H](CC(O)=O)C=C[C@@H]1NC(=O)Nc1ccccc1	InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13-/m0/s1	IZNXMLLZVKASMZ-AVGNSLFASA-N	306.121571696							118242
BRD-K74015591	LSM-29692		54640408	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19+,20-/m0/s1	DSHMBJFFZMCEDJ-SXLOBPIMSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K74015591	BRD-K74015591-001-01-7	Broad Institute of MIT and Harvard	BRD-K74015591			OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19+,20-/m0/s1	DSHMBJFFZMCEDJ-SXLOBPIMSA-N	451.157719852							118243
BRD-K46476470	LSM-29693		54640188	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13+,14-/m0/s1	HFDKIVHAHGCNSH-MJBXVCDLSA-N	COC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@H](CO)O1	BroadT	BRD-K46476470	BRD-K46476470-001-01-2	Broad Institute of MIT and Harvard	BRD-K46476470			COC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@H](CO)O1	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13+,14-/m0/s1	HFDKIVHAHGCNSH-MJBXVCDLSA-N	390.140256392							118244
BRD-K87670244	LSM-29694		54640109	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16-,18+/m1/s1	OWGSILQKVGHWMO-NUJGCVRESA-N	OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K87670244	BRD-K87670244-001-01-5	Broad Institute of MIT and Harvard	BRD-K87670244			OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16-,18+/m1/s1	OWGSILQKVGHWMO-NUJGCVRESA-N	433.151682008							118245
BRD-K94440323	LSM-29695		54640177	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19-,20-/m1/s1	RBLWVJQIFCDULU-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K94440323	BRD-K94440323-001-01-8	Broad Institute of MIT and Harvard	BRD-K94440323			OC[C@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19-,20-/m1/s1	RBLWVJQIFCDULU-VAMGGRTRSA-N	425.288971378							118246
BRD-K46603043	LSM-29696		54640121	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22-,23-/m0/s1	PZEUIISKRRGKSB-PMVMPFDFSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K46603043	BRD-K46603043-001-01-9	Broad Institute of MIT and Harvard	BRD-K46603043			OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22-,23-/m0/s1	PZEUIISKRRGKSB-PMVMPFDFSA-N	491.18901998							118247
BRD-K43989220	LSM-29697		54640391	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13+,14-/m1/s1	PNFPPQXPTKVRON-HZSPNIEDSA-N	NCC[C@H]1CC[C@H](NC(=O)Nc2ccc(F)cc2)[C@@H](CO)O1	BroadT	BRD-K43989220	BRD-K43989220-001-01-0	Broad Institute of MIT and Harvard	BRD-K43989220			NCC[C@H]1CC[C@H](NC(=O)Nc2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13+,14-/m1/s1	PNFPPQXPTKVRON-HZSPNIEDSA-N	311.164519794							118248
BRD-K17474512	LSM-29698		54640159	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22-/m1/s1	GMABBLNRVHCWFG-RZUBCFFCSA-N	OC[C@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)c4ccccn4	BroadT	BRD-K17474512	BRD-K17474512-001-01-2	Broad Institute of MIT and Harvard	BRD-K17474512			OC[C@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22-/m1/s1	GMABBLNRVHCWFG-RZUBCFFCSA-N	421.211389774							118249
BRD-K24978625	LSM-29699		54640245	InChI=1S/C16H28N4O2/c17-14-7-6-13(22-16(14)11-21)8-9-20-10-15(18-19-20)12-4-2-1-3-5-12/h10,12-14,16,21H,1-9,11,17H2/t13-,14+,16-/m0/s1	YDEHNJGPJPHMHH-LZWOXQAQSA-N	N[C@@H]1CC[C@@H](CCn2cc(nn2)C3CCCCC3)O[C@H]1CO	BroadT	BRD-K24978625	BRD-K24978625-001-01-7	Broad Institute of MIT and Harvard	BRD-K24978625			N[C@@H]1CC[C@@H](CCn2cc(nn2)C2CCCCC2)O[C@H]1CO	InChI=1S/C16H28N4O2/c17-14-7-6-13(22-16(14)11-21)8-9-20-10-15(18-19-20)12-4-2-1-3-5-12/h10,12-14,16,21H,1-9,11,17H2/t13-,14+,16-/m0/s1	YDEHNJGPJPHMHH-LZWOXQAQSA-N	308.221226176							118250
BRD-K60454544	LSM-29700		54640288	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19-,20-/m1/s1	WDGFJBRIXWVRNV-MISYRCLQSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)CC[C@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K60454544	BRD-K60454544-001-01-2	Broad Institute of MIT and Harvard	BRD-K60454544			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)CC[C@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19-,20-/m1/s1	WDGFJBRIXWVRNV-MISYRCLQSA-N	439.214091876							118251
CHEMBL2359181	LSM-29701	BRD-K41006887, SID131436520	54640217	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20+,22-/m1/s1	UESSXGKYQCVSOE-PIPMEXSNSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3CCCCC3)CC[C@@H]1NC(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K41006887	BRD-K41006887-001-01-9	Broad Institute of MIT and Harvard	BRD-K41006887			OC[C@H]1O[C@@H](CCn2cc(nn2)C2CCCCC2)CC[C@@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20+,22-/m1/s1	UESSXGKYQCVSOE-PIPMEXSNSA-N	495.180395322							118252
BRD-K15867859	LSM-29702		54640296	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16-/m1/s1	JWFDGUDYVUNEGC-BZUAXINKSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)CC[C@H]1NC(=O)C3CC3	BroadT	BRD-K15867859	BRD-K15867859-001-01-0	Broad Institute of MIT and Harvard	BRD-K15867859			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)CC[C@H]1NC(=O)C1CC1	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16-/m1/s1	JWFDGUDYVUNEGC-BZUAXINKSA-N	347.18450631							118253
BRD-K53221607	LSM-29703		54640131	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9+,10-/m1/s1	YHTHTGTWYCQHDQ-KXUCPTDWSA-N	CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)O)O[C@@H]1CO	BroadT	BRD-K53221607	BRD-K53221607-001-01-8	Broad Institute of MIT and Harvard	BRD-K53221607			CC(C)NC(=O)N[C@H]1C=C[C@H](CC(O)=O)O[C@@H]1CO	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9+,10-/m1/s1	YHTHTGTWYCQHDQ-KXUCPTDWSA-N	272.13722176							118254
BRD-K11282060	LSM-29704		54640135	InChI=1S/C20H27N3O6/c1-27-15-4-2-3-14(11-15)21-20(26)22-17-6-5-16(29-18(17)13-24)12-19(25)23-7-9-28-10-8-23/h2-6,11,16-18,24H,7-10,12-13H2,1H3,(H2,21,22,26)/t16-,17-,18+/m1/s1	DEUGGSUTAOAWFI-KURKYZTESA-N	COc1cccc(NC(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCOCC3)O[C@H]2CO)c1	BroadT	BRD-K11282060	BRD-K11282060-001-01-1	Broad Institute of MIT and Harvard	BRD-K11282060			COc1cccc(NC(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCOCC3)O[C@H]2CO)c1	InChI=1S/C20H27N3O6/c1-27-15-4-2-3-14(11-15)21-20(26)22-17-6-5-16(29-18(17)13-24)12-19(25)23-7-9-28-10-8-23/h2-6,11,16-18,24H,7-10,12-13H2,1H3,(H2,21,22,26)/t16-,17-,18+/m1/s1	DEUGGSUTAOAWFI-KURKYZTESA-N	405.189985614							118255
BRD-K52210941	LSM-29705		54640189	InChI=1S/C17H22FN3O4/c1-21(2)16(23)9-13-6-7-14(15(10-22)25-13)20-17(24)19-12-5-3-4-11(18)8-12/h3-8,13-15,22H,9-10H2,1-2H3,(H2,19,20,24)/t13-,14+,15+/m0/s1	LEYGMNHWBOVNLD-RRFJBIMHSA-N	CN(C)C(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)Nc2cccc(F)c2)C=C1	BroadT	BRD-K52210941	BRD-K52210941-001-01-7	Broad Institute of MIT and Harvard	BRD-K52210941			CN(C)C(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)Nc2cccc(F)c2)C=C1	InChI=1S/C17H22FN3O4/c1-21(2)16(23)9-13-6-7-14(15(10-22)25-13)20-17(24)19-12-5-3-4-11(18)8-12/h3-8,13-15,22H,9-10H2,1-2H3,(H2,19,20,24)/t13-,14+,15+/m0/s1	LEYGMNHWBOVNLD-RRFJBIMHSA-N	351.159434414							118256
BRD-K64173373	LSM-29706		54640119	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22+,23+/m1/s1	PZEUIISKRRGKSB-PUHATCMVSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K64173373	BRD-K64173373-001-01-0	Broad Institute of MIT and Harvard	BRD-K64173373			OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22+,23+/m1/s1	PZEUIISKRRGKSB-PUHATCMVSA-N	491.18901998							118257
BRD-K17582293	LSM-29707		54640300	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16-/m1/s1	JWFDGUDYVUNEGC-OWCLPIDISA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)CC[C@@H]1NC(=O)C3CC3	BroadT	BRD-K17582293	BRD-K17582293-001-01-7	Broad Institute of MIT and Harvard	BRD-K17582293			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)CC[C@@H]1NC(=O)C1CC1	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16-/m1/s1	JWFDGUDYVUNEGC-OWCLPIDISA-N	347.18450631							118258
BRD-K83833383	LSM-29708		54640299	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16+/m1/s1	JWFDGUDYVUNEGC-OAGGEKHMSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)CC[C@H]1NC(=O)C3CC3	BroadT	BRD-K83833383	BRD-K83833383-001-01-4	Broad Institute of MIT and Harvard	BRD-K83833383			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)CC[C@H]1NC(=O)C1CC1	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16+/m1/s1	JWFDGUDYVUNEGC-OAGGEKHMSA-N	347.18450631							118259
BRD-K34258713	LSM-29709		54640212	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14+,16+/m0/s1	DHOFHCIZNIPSHR-SQWLQELKSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)C3CCC3	BroadT	BRD-K34258713	BRD-K34258713-001-01-5	Broad Institute of MIT and Harvard	BRD-K34258713			OC[C@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)C1CCC1	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14+,16+/m0/s1	DHOFHCIZNIPSHR-SQWLQELKSA-N	362.195405352							118260
BRD-K72745710	LSM-29710		54640373	InChI=1S/C15H23N3O3/c16-6-3-12-1-2-13(14(10-19)21-12)18-15(20)9-11-4-7-17-8-5-11/h4-5,7-8,12-14,19H,1-3,6,9-10,16H2,(H,18,20)/t12-,13-,14+/m1/s1	GLKCOTROISWSTI-MCIONIFRSA-N	NCC[C@H]1CC[C@@H](NC(=O)Cc2ccncc2)[C@H](CO)O1	BroadT	BRD-K72745710	BRD-K72745710-001-01-7	Broad Institute of MIT and Harvard	BRD-K72745710			NCC[C@H]1CC[C@@H](NC(=O)Cc2ccncc2)[C@H](CO)O1	InChI=1S/C15H23N3O3/c16-6-3-12-1-2-13(14(10-19)21-12)18-15(20)9-11-4-7-17-8-5-11/h4-5,7-8,12-14,19H,1-3,6,9-10,16H2,(H,18,20)/t12-,13-,14+/m1/s1	GLKCOTROISWSTI-MCIONIFRSA-N	293.173941626							118261
BRD-K14536501	LSM-29711		54640151	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17-,18-/m0/s1	PYJMYSQFCOCJMQ-SZMVWBNQSA-N	CCCc1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)c3ccccc3Cl)[C@H](CO)O2)nn1	BroadT	BRD-K14536501	BRD-K14536501-001-01-4	Broad Institute of MIT and Harvard	BRD-K14536501			CCCc1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)c3ccccc3Cl)[C@H](CO)O2)nn1	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17-,18-/m0/s1	PYJMYSQFCOCJMQ-SZMVWBNQSA-N	442.144153784							118262
BRD-K84988480	LSM-29712		54640316	InChI=1S/C25H26N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-8,11,18-20,23,28H,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20+,23-/m1/s1	MSTFBRZSUKBDPT-ZRCGQRJVSA-N	OC[C@H]1O[C@@H](CC(=O)NC2Cc3ccccc3C2)C=C[C@@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K84988480	BRD-K84988480-001-01-7	Broad Institute of MIT and Harvard	BRD-K84988480			OC[C@H]1O[C@@H](CC(=O)NC2Cc3ccccc3C2)C=C[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H26N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-8,11,18-20,23,28H,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20+,23-/m1/s1	MSTFBRZSUKBDPT-ZRCGQRJVSA-N	450.179086572							118263
BRD-K20542687	LSM-29713		54640256	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20+/m0/s1	CAUJNQQMPJLGLW-SLFFLAALSA-N	OC[C@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K20542687	BRD-K20542687-001-01-0	Broad Institute of MIT and Harvard	BRD-K20542687			OC[C@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20+/m0/s1	CAUJNQQMPJLGLW-SLFFLAALSA-N	430.201633584							118264
BRD-K32431589	LSM-29714		54640284	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17+,19-/m1/s1	BVWTUHQTVRXDSV-ZIFCJYIRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K32431589	BRD-K32431589-001-01-1	Broad Institute of MIT and Harvard	BRD-K32431589			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17+,19-/m1/s1	BVWTUHQTVRXDSV-ZIFCJYIRSA-N	401.175084478							118265
BRD-K11836564-001-01-5	LSM-29715	BRD-K11836564	54640374	InChI=1S/C15H23N3O3/c16-6-3-12-1-2-13(14(10-19)21-12)18-15(20)9-11-4-7-17-8-5-11/h4-5,7-8,12-14,19H,1-3,6,9-10,16H2,(H,18,20)/t12-,13-,14-/m1/s1	GLKCOTROISWSTI-MGPQQGTHSA-N	NCC[C@H]1CC[C@@H](NC(=O)Cc2ccncc2)[C@@H](CO)O1	BroadT	BRD-K11836564	BRD-K11836564-001-01-5	Broad Institute of MIT and Harvard	BRD-K11836564			NCC[C@H]1CC[C@@H](NC(=O)Cc2ccncc2)[C@@H](CO)O1	InChI=1S/C15H23N3O3/c16-6-3-12-1-2-13(14(10-19)21-12)18-15(20)9-11-4-7-17-8-5-11/h4-5,7-8,12-14,19H,1-3,6,9-10,16H2,(H,18,20)/t12-,13-,14-/m1/s1	GLKCOTROISWSTI-MGPQQGTHSA-N	293.173941626							118266
BRD-K48263613	LSM-29716		54640315	InChI=1S/C25H26N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-8,11,18-20,23,28H,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20-,23+/m1/s1	MSTFBRZSUKBDPT-VIZSFHNOSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2Cc3ccccc3C2)C=C[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K48263613	BRD-K48263613-001-01-0	Broad Institute of MIT and Harvard	BRD-K48263613			OC[C@@H]1O[C@@H](CC(=O)NC2Cc3ccccc3C2)C=C[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H26N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-8,11,18-20,23,28H,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20-,23+/m1/s1	MSTFBRZSUKBDPT-VIZSFHNOSA-N	450.179086572							118267
BRD-K27881972	LSM-29717		54640258	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20-/m1/s1	CAUJNQQMPJLGLW-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K27881972	BRD-K27881972-001-01-9	Broad Institute of MIT and Harvard	BRD-K27881972			OC[C@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20-/m1/s1	CAUJNQQMPJLGLW-VAMGGRTRSA-N	430.201633584							118268
BRD-K81385845	LSM-29718		54640381	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17-,18+/m0/s1	DQIDKWUHVOLFRC-OKZBNKHCSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K81385845	BRD-K81385845-001-01-9	Broad Institute of MIT and Harvard	BRD-K81385845			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17-,18+/m0/s1	DQIDKWUHVOLFRC-OKZBNKHCSA-N	395.242021186							118269
BRD-K59851511	LSM-29719		54640187	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13+,14-/m1/s1	HFDKIVHAHGCNSH-HZSPNIEDSA-N	COC(=O)C[C@H]1CC[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@@H](CO)O1	BroadT	BRD-K59851511	BRD-K59851511-001-01-1	Broad Institute of MIT and Harvard	BRD-K59851511			COC(=O)C[C@H]1CC[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@@H](CO)O1	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13+,14-/m1/s1	HFDKIVHAHGCNSH-HZSPNIEDSA-N	390.140256392							118270
BRD-K83875224	LSM-29720		54640383	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17+,18-/m1/s1	DQIDKWUHVOLFRC-FGTMMUONSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K83875224	BRD-K83875224-001-01-8	Broad Institute of MIT and Harvard	BRD-K83875224			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17+,18-/m1/s1	DQIDKWUHVOLFRC-FGTMMUONSA-N	395.242021186							118271
BRD-K02073410	LSM-29721		54640142	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21-,22+/m0/s1	FWLXELJMTMEYKB-FDFHNCONSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K02073410	BRD-K02073410-001-01-2	Broad Institute of MIT and Harvard	BRD-K02073410			Cn1cnc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21-,22+/m0/s1	FWLXELJMTMEYKB-FDFHNCONSA-N	484.178040726							118272
BRD-K31672963	LSM-29722		54640295	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16+/m1/s1	JWFDGUDYVUNEGC-PMPSAXMXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)CC[C@@H]1NC(=O)C3CC3	BroadT	BRD-K31672963	BRD-K31672963-001-01-7	Broad Institute of MIT and Harvard	BRD-K31672963			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)CC[C@@H]1NC(=O)C1CC1	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16+/m1/s1	JWFDGUDYVUNEGC-PMPSAXMXSA-N	347.18450631							118273
BRD-K44052748	LSM-29723		54640405	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19-,20+/m0/s1	DSHMBJFFZMCEDJ-YSIASYRMSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K44052748	BRD-K44052748-001-01-9	Broad Institute of MIT and Harvard	BRD-K44052748			OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19-,20+/m0/s1	DSHMBJFFZMCEDJ-YSIASYRMSA-N	451.157719852							118274
BRD-K23836639	LSM-29724		54640249	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17-,18-/m0/s1	KSBPLIKBKJINFF-SZMVWBNQSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K23836639	BRD-K23836639-001-01-2	Broad Institute of MIT and Harvard	BRD-K23836639			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17-,18-/m0/s1	KSBPLIKBKJINFF-SZMVWBNQSA-N	414.162470874							118275
BRD-K89701103	LSM-29725		54640309	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20-,22+/m0/s1	DFXHLBQSDWHRLL-RBDMOPTHSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3ccccc3F)CC[C@@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K89701103	BRD-K89701103-001-01-6	Broad Institute of MIT and Harvard	BRD-K89701103			OC[C@H]1O[C@H](CCn2cc(nn2)-c2ccccc2F)CC[C@@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20-,22+/m0/s1	DFXHLBQSDWHRLL-RBDMOPTHSA-N	473.16299562							118276
BRD-K21986392	LSM-29726		54640328	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13-,14-/m1/s1	FMDKDGDDTIJRQT-MGPQQGTHSA-N	COC(=O)C[C@H]1CC[C@@H](NC(=O)c2ccccc2)[C@@H](CO)O1	BroadT	BRD-K21986392	BRD-K21986392-001-01-4	Broad Institute of MIT and Harvard	BRD-K21986392			COC(=O)C[C@H]1CC[C@@H](NC(=O)c2ccccc2)[C@@H](CO)O1	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13-,14-/m1/s1	FMDKDGDDTIJRQT-MGPQQGTHSA-N	307.141972782							118277
BRD-K41451401	LSM-29727		54640244	InChI=1S/C16H28N4O2/c17-14-7-6-13(22-16(14)11-21)8-9-20-10-15(18-19-20)12-4-2-1-3-5-12/h10,12-14,16,21H,1-9,11,17H2/t13-,14+,16-/m1/s1	YDEHNJGPJPHMHH-IJEWVQPXSA-N	N[C@H]1CC[C@H](CCn2cc(nn2)C3CCCCC3)O[C@@H]1CO	BroadT	BRD-K41451401	BRD-K41451401-001-01-4	Broad Institute of MIT and Harvard	BRD-K41451401			N[C@H]1CC[C@H](CCn2cc(nn2)C2CCCCC2)O[C@@H]1CO	InChI=1S/C16H28N4O2/c17-14-7-6-13(22-16(14)11-21)8-9-20-10-15(18-19-20)12-4-2-1-3-5-12/h10,12-14,16,21H,1-9,11,17H2/t13-,14+,16-/m1/s1	YDEHNJGPJPHMHH-IJEWVQPXSA-N	308.221226176							118278
BRD-K59484021	LSM-29728		54640255	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20+/m1/s1	CAUJNQQMPJLGLW-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K59484021	BRD-K59484021-001-01-4	Broad Institute of MIT and Harvard	BRD-K59484021			OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20+/m1/s1	CAUJNQQMPJLGLW-AABGKKOBSA-N	430.201633584							118279
BRD-K91018728	LSM-29729		54640289	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19-,20-/m0/s1	WDGFJBRIXWVRNV-IHPCNDPISA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K91018728	BRD-K91018728-001-01-6	Broad Institute of MIT and Harvard	BRD-K91018728			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19-,20-/m0/s1	WDGFJBRIXWVRNV-IHPCNDPISA-N	439.214091876							118280
BRD-K51054674	LSM-29730		54640325	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20+,21-/m0/s1	BEKOLHWPUBERJD-WMQCIHAUSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccccc3F)O[C@H]2CO	BroadT	BRD-K51054674	BRD-K51054674-001-01-3	Broad Institute of MIT and Harvard	BRD-K51054674			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20+,21-/m0/s1	BEKOLHWPUBERJD-WMQCIHAUSA-N	466.157385494							118281
BRD-K84706257	LSM-29731		54640332	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13+,14-/m0/s1	FMDKDGDDTIJRQT-MJBXVCDLSA-N	COC(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccccc2)[C@H](CO)O1	BroadT	BRD-K84706257	BRD-K84706257-001-01-4	Broad Institute of MIT and Harvard	BRD-K84706257			COC(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccccc2)[C@H](CO)O1	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13+,14-/m0/s1	FMDKDGDDTIJRQT-MJBXVCDLSA-N	307.141972782							118282
BRD-K12325488	LSM-29732		54640192	InChI=1S/C17H22FN3O4/c1-21(2)16(23)9-13-6-7-14(15(10-22)25-13)20-17(24)19-12-5-3-4-11(18)8-12/h3-8,13-15,22H,9-10H2,1-2H3,(H2,19,20,24)/t13-,14-,15-/m0/s1	LEYGMNHWBOVNLD-KKUMJFAQSA-N	CN(C)C(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2cccc(F)c2)C=C1	BroadT	BRD-K12325488	BRD-K12325488-001-01-1	Broad Institute of MIT and Harvard	BRD-K12325488			CN(C)C(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2cccc(F)c2)C=C1	InChI=1S/C17H22FN3O4/c1-21(2)16(23)9-13-6-7-14(15(10-22)25-13)20-17(24)19-12-5-3-4-11(18)8-12/h3-8,13-15,22H,9-10H2,1-2H3,(H2,19,20,24)/t13-,14-,15-/m0/s1	LEYGMNHWBOVNLD-KKUMJFAQSA-N	351.159434414							118283
BRD-K83272071	LSM-29733		54640253	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17+,18-/m0/s1	KSBPLIKBKJINFF-JQHSSLGASA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K83272071	BRD-K83272071-001-01-2	Broad Institute of MIT and Harvard	BRD-K83272071			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17+,18-/m0/s1	KSBPLIKBKJINFF-JQHSSLGASA-N	414.162470874							118284
BRD-K58284640	LSM-29734		54640285	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17+,19-/m0/s1	BVWTUHQTVRXDSV-SCTDSRPQSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K58284640	BRD-K58284640-001-01-0	Broad Institute of MIT and Harvard	BRD-K58284640			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17+,19-/m0/s1	BVWTUHQTVRXDSV-SCTDSRPQSA-N	401.175084478							118285
BRD-K55402144	LSM-29735		54640173	InChI=1S/C15H19NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-7,11,13-14,16-17H,8-9H2,1H3,(H,18,19)/t11-,13+,14-/m0/s1	GUDXKJZEBVMQGW-YUTCNCBUSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)O)O[C@H]2CO	BroadT	BRD-K55402144	BRD-K55402144-001-01-2	Broad Institute of MIT and Harvard	BRD-K55402144			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(O)=O)O[C@H]1CO	InChI=1S/C15H19NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-7,11,13-14,16-17H,8-9H2,1H3,(H,18,19)/t11-,13+,14-/m0/s1	GUDXKJZEBVMQGW-YUTCNCBUSA-N	341.093308028							118286
BRD-K99873441	LSM-29736		54640310	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20-,22+/m1/s1	DFXHLBQSDWHRLL-ZNLUXHQJSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3ccccc3F)CC[C@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K99873441	BRD-K99873441-001-01-2	Broad Institute of MIT and Harvard	BRD-K99873441			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2F)CC[C@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20-,22+/m1/s1	DFXHLBQSDWHRLL-ZNLUXHQJSA-N	473.16299562							118287
BRD-K06148621	LSM-29737		54640125	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22+,23-/m0/s1	PZEUIISKRRGKSB-WWNPGLIZSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K06148621	BRD-K06148621-001-01-3	Broad Institute of MIT and Harvard	BRD-K06148621			OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22+,23-/m0/s1	PZEUIISKRRGKSB-WWNPGLIZSA-N	491.18901998							118288
BRD-K45095313	LSM-29738		54640306	InChI=1S/C26H25N3O4/c30-17-24-23(29-26(32)20-12-14-27-15-13-20)11-10-22(33-24)16-25(31)28-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-15,22-24,30H,16-17H2,(H,28,31)(H,29,32)/t22-,23+,24-/m0/s1	WWBREHKQUAGTED-VXNXHJTFSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)c4ccncc4	BroadT	BRD-K45095313	BRD-K45095313-001-01-2	Broad Institute of MIT and Harvard	BRD-K45095313			OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)c1ccncc1	InChI=1S/C26H25N3O4/c30-17-24-23(29-26(32)20-12-14-27-15-13-20)11-10-22(33-24)16-25(31)28-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-15,22-24,30H,16-17H2,(H,28,31)(H,29,32)/t22-,23+,24-/m0/s1	WWBREHKQUAGTED-VXNXHJTFSA-N	443.18450631							118289
BRD-K13401825	LSM-29739		54640379	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17-,18-/m1/s1	DQIDKWUHVOLFRC-KZNAEPCWSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K13401825	BRD-K13401825-001-01-1	Broad Institute of MIT and Harvard	BRD-K13401825			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17-,18-/m1/s1	DQIDKWUHVOLFRC-KZNAEPCWSA-N	395.242021186							118290
BRD-K19227646	LSM-29740		54640206	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20+/m1/s1	OQCXBRWJDZLXCP-XLNTUCKNSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)c2cccnc2)C=C1)c3ccccc3	BroadT	BRD-K19227646	BRD-K19227646-001-01-1	Broad Institute of MIT and Harvard	BRD-K19227646			C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)c2cccnc2)C=C1)c1ccccc1	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20+/m1/s1	OQCXBRWJDZLXCP-XLNTUCKNSA-N	395.18450631							118291
BRD-K39223685	LSM-29741		54640290	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19-,20+/m0/s1	WDGFJBRIXWVRNV-YSIASYRMSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K39223685	BRD-K39223685-001-01-8	Broad Institute of MIT and Harvard	BRD-K39223685			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19-,20+/m0/s1	WDGFJBRIXWVRNV-YSIASYRMSA-N	439.214091876							118292
BRD-K07245666	LSM-29742		54640246	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17+,18+/m1/s1	KSBPLIKBKJINFF-NJAFHUGGSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K07245666	BRD-K07245666-001-01-2	Broad Institute of MIT and Harvard	BRD-K07245666			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17+,18+/m1/s1	KSBPLIKBKJINFF-NJAFHUGGSA-N	414.162470874							118293
BRD-K75980238	LSM-29743		54640331	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13+,14-/m1/s1	FMDKDGDDTIJRQT-HZSPNIEDSA-N	COC(=O)C[C@H]1CC[C@H](NC(=O)c2ccccc2)[C@@H](CO)O1	BroadT	BRD-K75980238	BRD-K75980238-001-01-0	Broad Institute of MIT and Harvard	BRD-K75980238			COC(=O)C[C@H]1CC[C@H](NC(=O)c2ccccc2)[C@@H](CO)O1	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13+,14-/m1/s1	FMDKDGDDTIJRQT-HZSPNIEDSA-N	307.141972782							118294
BRD-K17708304	LSM-29744		54640156	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22-/m1/s1	GMABBLNRVHCWFG-KCZVDYSFSA-N	OC[C@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)c4ccccn4	BroadT	BRD-K17708304	BRD-K17708304-001-01-5	Broad Institute of MIT and Harvard	BRD-K17708304			OC[C@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22-/m1/s1	GMABBLNRVHCWFG-KCZVDYSFSA-N	421.211389774							118295
BRD-K53752646	LSM-29745		54640378	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17+,18+/m1/s1	DQIDKWUHVOLFRC-SQNIBIBYSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K53752646	BRD-K53752646-001-01-5	Broad Institute of MIT and Harvard	BRD-K53752646			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17+,18+/m1/s1	DQIDKWUHVOLFRC-SQNIBIBYSA-N	395.242021186							118296
BRD-K57472585	LSM-29746		54640111	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16-,18-/m0/s1	OWGSILQKVGHWMO-BQFCYCMXSA-N	OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K57472585	BRD-K57472585-001-01-9	Broad Institute of MIT and Harvard	BRD-K57472585			OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16-,18-/m0/s1	OWGSILQKVGHWMO-BQFCYCMXSA-N	433.151682008							118297
BRD-K69817695	LSM-29747		54640139	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21+,22+/m1/s1	FWLXELJMTMEYKB-FSSWDIPSSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K69817695	BRD-K69817695-001-01-8	Broad Institute of MIT and Harvard	BRD-K69817695			Cn1cnc(c1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21+,22+/m1/s1	FWLXELJMTMEYKB-FSSWDIPSSA-N	484.178040726							118298
BRD-K01009153	LSM-29748		54640371	InChI=1S/C15H23N3O3/c16-6-3-12-1-2-13(14(10-19)21-12)18-15(20)9-11-4-7-17-8-5-11/h4-5,7-8,12-14,19H,1-3,6,9-10,16H2,(H,18,20)/t12-,13+,14+/m0/s1	GLKCOTROISWSTI-BFHYXJOUSA-N	NCC[C@@H]1CC[C@@H](NC(=O)Cc2ccncc2)[C@@H](CO)O1	BroadT	BRD-K01009153	BRD-K01009153-001-01-8	Broad Institute of MIT and Harvard	BRD-K01009153			NCC[C@@H]1CC[C@@H](NC(=O)Cc2ccncc2)[C@@H](CO)O1	InChI=1S/C15H23N3O3/c16-6-3-12-1-2-13(14(10-19)21-12)18-15(20)9-11-4-7-17-8-5-11/h4-5,7-8,12-14,19H,1-3,6,9-10,16H2,(H,18,20)/t12-,13+,14+/m0/s1	GLKCOTROISWSTI-BFHYXJOUSA-N	293.173941626							118299
BRD-K69901388	LSM-29749		54640208	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20-/m1/s1	OQCXBRWJDZLXCP-GEALJGNFSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)c2cccnc2)C=C1)c3ccccc3	BroadT	BRD-K69901388	BRD-K69901388-001-01-2	Broad Institute of MIT and Harvard	BRD-K69901388			C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)c2cccnc2)C=C1)c1ccccc1	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20-/m1/s1	OQCXBRWJDZLXCP-GEALJGNFSA-N	395.18450631							118300
BRD-K85641667	LSM-29750		54640351	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19+,20-/m1/s1	VDBDKUPLXIXHLN-LSTHTHJFSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K85641667	BRD-K85641667-001-01-6	Broad Institute of MIT and Harvard	BRD-K85641667			OC[C@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19+,20-/m1/s1	VDBDKUPLXIXHLN-LSTHTHJFSA-N	483.17811911							118301
BRD-K13267677	LSM-29751		54640169	InChI=1S/C15H19NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-7,11,13-14,16-17H,8-9H2,1H3,(H,18,19)/t11-,13-,14-/m0/s1	GUDXKJZEBVMQGW-UBHSHLNASA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)O)O[C@H]2CO	BroadT	BRD-K13267677	BRD-K13267677-001-01-5	Broad Institute of MIT and Harvard	BRD-K13267677			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(O)=O)O[C@H]1CO	InChI=1S/C15H19NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-7,11,13-14,16-17H,8-9H2,1H3,(H,18,19)/t11-,13-,14-/m0/s1	GUDXKJZEBVMQGW-UBHSHLNASA-N	341.093308028							118302
BRD-K77173942	LSM-29752		54640388	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13-,14-/m1/s1	PNFPPQXPTKVRON-MGPQQGTHSA-N	NCC[C@H]1CC[C@@H](NC(=O)Nc2ccc(F)cc2)[C@@H](CO)O1	BroadT	BRD-K77173942	BRD-K77173942-001-01-7	Broad Institute of MIT and Harvard	BRD-K77173942			NCC[C@H]1CC[C@@H](NC(=O)Nc2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13-,14-/m1/s1	PNFPPQXPTKVRON-MGPQQGTHSA-N	311.164519794							118303
BRD-K79318959	LSM-29753		54640184	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13-,14-/m0/s1	HFDKIVHAHGCNSH-IHRRRGAJSA-N	COC(=O)C[C@@H]1CC[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@H](CO)O1	BroadT	BRD-K79318959	BRD-K79318959-001-01-6	Broad Institute of MIT and Harvard	BRD-K79318959			COC(=O)C[C@@H]1CC[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@H](CO)O1	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13-,14-/m0/s1	HFDKIVHAHGCNSH-IHRRRGAJSA-N	390.140256392							118304
BRD-K45537529	LSM-29754		54640334	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20+/m0/s1	SDPGYCOKVZGVFV-PWIZWCRZSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K45537529	BRD-K45537529-001-01-3	Broad Institute of MIT and Harvard	BRD-K45537529			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20+/m0/s1	SDPGYCOKVZGVFV-PWIZWCRZSA-N	415.190734542							118305
BRD-K35897342	LSM-29755		54640382	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17-,18+/m1/s1	DQIDKWUHVOLFRC-KURKYZTESA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K35897342	BRD-K35897342-001-01-8	Broad Institute of MIT and Harvard	BRD-K35897342			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17-,18+/m1/s1	DQIDKWUHVOLFRC-KURKYZTESA-N	395.242021186							118306
BRD-K14909006	LSM-29756		54640421	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24-/m1/s1	GZDPKZCGLLNMKC-ZFGGDYGUSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K14909006	BRD-K14909006-001-01-3	Broad Institute of MIT and Harvard	BRD-K14909006			OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24-/m1/s1	GZDPKZCGLLNMKC-ZFGGDYGUSA-N	496.232184784							118307
BRD-K30285881	LSM-29757		54640342	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17+,18+/m1/s1	HMAQNEDPCLDOSX-JLSDUUJJSA-N	Cc1onc(C)c1NC(=O)N[C@H]2C=C[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2CO	BroadT	BRD-K30285881	BRD-K30285881-001-01-8	Broad Institute of MIT and Harvard	BRD-K30285881			Cc1noc(C)c1NC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@H]1CO	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17+,18+/m1/s1	HMAQNEDPCLDOSX-JLSDUUJJSA-N	482.112375328							118308
BRD-K13564884	LSM-29758		54640387	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13-,14+/m1/s1	PNFPPQXPTKVRON-MCIONIFRSA-N	NCC[C@H]1CC[C@@H](NC(=O)Nc2ccc(F)cc2)[C@H](CO)O1	BroadT	BRD-K13564884	BRD-K13564884-001-01-4	Broad Institute of MIT and Harvard	BRD-K13564884			NCC[C@H]1CC[C@@H](NC(=O)Nc2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13-,14+/m1/s1	PNFPPQXPTKVRON-MCIONIFRSA-N	311.164519794							118309
BRD-K68595406	LSM-29759		54640140	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21-,22-/m1/s1	FWLXELJMTMEYKB-YPAWHYETSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K68595406	BRD-K68595406-001-01-1	Broad Institute of MIT and Harvard	BRD-K68595406			Cn1cnc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21-,22-/m1/s1	FWLXELJMTMEYKB-YPAWHYETSA-N	484.178040726							118310
BRD-K13226207	LSM-29760		54640155	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22+/m1/s1	GMABBLNRVHCWFG-URVUXULASA-N	OC[C@@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)c4ccccn4	BroadT	BRD-K13226207	BRD-K13226207-001-01-0	Broad Institute of MIT and Harvard	BRD-K13226207			OC[C@@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22+/m1/s1	GMABBLNRVHCWFG-URVUXULASA-N	421.211389774							118311
BRD-K68884923	LSM-29761		54640161	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22-/m0/s1	GMABBLNRVHCWFG-VWPQPMDRSA-N	OC[C@@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)c4ccccn4	BroadT	BRD-K68884923	BRD-K68884923-001-01-3	Broad Institute of MIT and Harvard	BRD-K68884923			OC[C@@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22-/m0/s1	GMABBLNRVHCWFG-VWPQPMDRSA-N	421.211389774							118312
BRD-K22595044	LSM-29762		54640348	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19+,20+/m0/s1	VDBDKUPLXIXHLN-PWIZWCRZSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K22595044	BRD-K22595044-001-01-4	Broad Institute of MIT and Harvard	BRD-K22595044			OC[C@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19+,20+/m0/s1	VDBDKUPLXIXHLN-PWIZWCRZSA-N	483.17811911							118313
BRD-K08141534	LSM-29763		54640344	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17-,18+/m0/s1	HMAQNEDPCLDOSX-JCGIZDLHSA-N	Cc1onc(C)c1NC(=O)N[C@H]2C=C[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@@H]2CO	BroadT	BRD-K08141534	BRD-K08141534-001-01-2	Broad Institute of MIT and Harvard	BRD-K08141534			Cc1noc(C)c1NC(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@@H]1CO	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17-,18+/m0/s1	HMAQNEDPCLDOSX-JCGIZDLHSA-N	482.112375328							118314
BRD-K65368100	LSM-29764		54640247	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17+,18+/m0/s1	KSBPLIKBKJINFF-CGTJXYLNSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K65368100	BRD-K65368100-001-01-5	Broad Institute of MIT and Harvard	BRD-K65368100			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17+,18+/m0/s1	KSBPLIKBKJINFF-CGTJXYLNSA-N	414.162470874							118315
BRD-K51779559	LSM-29765		54640134	InChI=1S/C20H27N3O6/c1-27-15-4-2-3-14(11-15)21-20(26)22-17-6-5-16(29-18(17)13-24)12-19(25)23-7-9-28-10-8-23/h2-6,11,16-18,24H,7-10,12-13H2,1H3,(H2,21,22,26)/t16-,17-,18+/m0/s1	DEUGGSUTAOAWFI-OKZBNKHCSA-N	COc1cccc(NC(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCOCC3)O[C@@H]2CO)c1	BroadT	BRD-K51779559	BRD-K51779559-001-01-5	Broad Institute of MIT and Harvard	BRD-K51779559			COc1cccc(NC(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCOCC3)O[C@@H]2CO)c1	InChI=1S/C20H27N3O6/c1-27-15-4-2-3-14(11-15)21-20(26)22-17-6-5-16(29-18(17)13-24)12-19(25)23-7-9-28-10-8-23/h2-6,11,16-18,24H,7-10,12-13H2,1H3,(H2,21,22,26)/t16-,17-,18+/m0/s1	DEUGGSUTAOAWFI-OKZBNKHCSA-N	405.189985614							118316
BRD-K78873216	LSM-29766		54640326	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13+,14+/m0/s1	FMDKDGDDTIJRQT-BFHYXJOUSA-N	COC(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccccc2)[C@@H](CO)O1	BroadT	BRD-K78873216	BRD-K78873216-001-01-0	Broad Institute of MIT and Harvard	BRD-K78873216			COC(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccccc2)[C@@H](CO)O1	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13+,14+/m0/s1	FMDKDGDDTIJRQT-BFHYXJOUSA-N	307.141972782							118317
MLS003649898	LSM-29767	BRD-K32491833	53382566	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13-,14+/m0/s1	FMDKDGDDTIJRQT-MELADBBJSA-N	COC(=O)C[C@@H]1CC[C@H](NC(=O)c2ccccc2)[C@@H](CO)O1	BroadT	BRD-K32491833	BRD-K32491833-001-01-9	Broad Institute of MIT and Harvard	BRD-K32491833			COC(=O)C[C@@H]1CC[C@H](NC(=O)c2ccccc2)[C@@H](CO)O1	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13-,14+/m0/s1	FMDKDGDDTIJRQT-MELADBBJSA-N	307.141972782							118318
BRD-K35413741	LSM-29768		54640338	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20+/m1/s1	SDPGYCOKVZGVFV-AHRSYUTCSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K35413741	BRD-K35413741-001-01-1	Broad Institute of MIT and Harvard	BRD-K35413741			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20+/m1/s1	SDPGYCOKVZGVFV-AHRSYUTCSA-N	415.190734542							118319
BRD-K37942718-001-01-6	LSM-29769	BRD-K37942718	54640389	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13-,14-/m0/s1	PNFPPQXPTKVRON-IHRRRGAJSA-N	NCC[C@@H]1CC[C@H](NC(=O)Nc2ccc(F)cc2)[C@H](CO)O1	BroadT	BRD-K37942718	BRD-K37942718-001-01-6	Broad Institute of MIT and Harvard	BRD-K37942718			NCC[C@@H]1CC[C@H](NC(=O)Nc2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13-,14-/m0/s1	PNFPPQXPTKVRON-IHRRRGAJSA-N	311.164519794							118320
BRD-K74173779	LSM-29770		54640268	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15+,16-/m1/s1	VMTZMCYUUHONMK-OWCLPIDISA-N	Cc1onc(C)c1NC(=O)N[C@H]2C=C[C@H](CC(=O)N3CCCCC3)O[C@@H]2CO	BroadT	BRD-K74173779	BRD-K74173779-001-01-8	Broad Institute of MIT and Harvard	BRD-K74173779			Cc1noc(C)c1NC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15+,16-/m1/s1	VMTZMCYUUHONMK-OWCLPIDISA-N	392.205970036							118321
BRD-K41532285	LSM-29771		54640329	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13-,14-/m0/s1	FMDKDGDDTIJRQT-IHRRRGAJSA-N	COC(=O)C[C@@H]1CC[C@H](NC(=O)c2ccccc2)[C@H](CO)O1	BroadT	BRD-K41532285	BRD-K41532285-001-01-2	Broad Institute of MIT and Harvard	BRD-K41532285			COC(=O)C[C@@H]1CC[C@H](NC(=O)c2ccccc2)[C@H](CO)O1	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13-,14-/m0/s1	FMDKDGDDTIJRQT-IHRRRGAJSA-N	307.141972782							118322
BRD-K67592986	LSM-29772		54640120	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22-,23-/m1/s1	PZEUIISKRRGKSB-YMPZKCBVSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K67592986	BRD-K67592986-001-01-7	Broad Institute of MIT and Harvard	BRD-K67592986			OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22-,23-/m1/s1	PZEUIISKRRGKSB-YMPZKCBVSA-N	491.18901998							118323
BRD-K08693008-001-01-9	LSM-29773	BRD-K08693008	54640215	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20+,22+/m1/s1	UESSXGKYQCVSOE-AGHHOFFYSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3CCCCC3)CC[C@@H]1NC(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K08693008	BRD-K08693008-001-01-9	Broad Institute of MIT and Harvard	BRD-K08693008			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2CCCCC2)CC[C@@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20+,22+/m1/s1	UESSXGKYQCVSOE-AGHHOFFYSA-N	495.180395322							118324
BRD-K22698363	LSM-29774		54640281	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17-,19-/m0/s1	BVWTUHQTVRXDSV-LNLFQRSKSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K22698363	BRD-K22698363-001-01-9	Broad Institute of MIT and Harvard	BRD-K22698363			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17-,19-/m0/s1	BVWTUHQTVRXDSV-LNLFQRSKSA-N	401.175084478							118325
BRD-K48922193	LSM-29775		54640117	InChI=1S/C13H24N2O3/c14-7-6-10-4-5-11(12(8-16)18-10)15-13(17)9-2-1-3-9/h9-12,16H,1-8,14H2,(H,15,17)/t10-,11+,12-/m0/s1	WTINLZZCKOEXLA-TUAOUCFPSA-N	NCC[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@H](CO)O1	BroadT	BRD-K48922193	BRD-K48922193-001-01-9	Broad Institute of MIT and Harvard	BRD-K48922193			NCC[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@H](CO)O1	InChI=1S/C13H24N2O3/c14-7-6-10-4-5-11(12(8-16)18-10)15-13(17)9-2-1-3-9/h9-12,16H,1-8,14H2,(H,15,17)/t10-,11+,12-/m0/s1	WTINLZZCKOEXLA-TUAOUCFPSA-N	256.178692648							118326
BRD-K80109782	LSM-29776		54640292	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19+,20-/m1/s1	WDGFJBRIXWVRNV-YZGWKJHDSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K80109782	BRD-K80109782-001-01-9	Broad Institute of MIT and Harvard	BRD-K80109782			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19+,20-/m1/s1	WDGFJBRIXWVRNV-YZGWKJHDSA-N	439.214091876							118327
BRD-K98976117	LSM-29777		54640276	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19-,21+/m0/s1	GELVUGAWQDMXAC-NBHGPNQESA-N	Cc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@@H]2CO	BroadT	BRD-K98976117	BRD-K98976117-001-01-7	Broad Institute of MIT and Harvard	BRD-K98976117			Cc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CCNC(=O)Nc2cc(F)ccc2F)O[C@@H]1CO	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19-,21+/m0/s1	GELVUGAWQDMXAC-NBHGPNQESA-N	483.163948084							118328
BRD-K29652917	LSM-29778		54640152	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17-,18+/m0/s1	PYJMYSQFCOCJMQ-RYQLBKOJSA-N	CCCc1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)c3ccccc3Cl)[C@@H](CO)O2)nn1	BroadT	BRD-K29652917	BRD-K29652917-001-01-0	Broad Institute of MIT and Harvard	BRD-K29652917			CCCc1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)c3ccccc3Cl)[C@@H](CO)O2)nn1	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17-,18+/m0/s1	PYJMYSQFCOCJMQ-RYQLBKOJSA-N	442.144153784							118329
BRD-K03713632	LSM-29779		54640347	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17+,18-/m0/s1	HMAQNEDPCLDOSX-QGTPRVQTSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2C=C[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2CO	BroadT	BRD-K03713632	BRD-K03713632-001-01-4	Broad Institute of MIT and Harvard	BRD-K03713632			Cc1noc(C)c1NC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@H]1CO	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17+,18-/m0/s1	HMAQNEDPCLDOSX-QGTPRVQTSA-N	482.112375328							118330
BRD-K29628221	LSM-29780		54640243	InChI=1S/C21H30ClN3O5/c22-15-2-1-3-16(12-15)24-21(28)25-18-5-4-17(30-19(18)13-26)6-9-23-20(27)14-7-10-29-11-8-14/h1-3,12,14,17-19,26H,4-11,13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19-/m0/s1	PBAPATWUXUNVNP-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)Nc3cccc(Cl)c3	BroadT	BRD-K29628221	BRD-K29628221-001-01-1	Broad Institute of MIT and Harvard	BRD-K29628221			OC[C@@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C21H30ClN3O5/c22-15-2-1-3-16(12-15)24-21(28)25-18-5-4-17(30-19(18)13-26)6-9-23-20(27)14-7-10-29-11-8-14/h1-3,12,14,17-19,26H,4-11,13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19-/m0/s1	PBAPATWUXUNVNP-FHWLQOOXSA-N	439.1873988							118331
BRD-K45076286	LSM-29781		54640384	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17+,18-/m0/s1	DQIDKWUHVOLFRC-KSZLIROESA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K45076286	BRD-K45076286-001-01-5	Broad Institute of MIT and Harvard	BRD-K45076286			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17+,18-/m0/s1	DQIDKWUHVOLFRC-KSZLIROESA-N	395.242021186							118332
BRD-K73391462	LSM-29782		54640273	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19-,21+/m1/s1	GELVUGAWQDMXAC-BSIFCXSSSA-N	Cc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@H]2CO	BroadT	BRD-K73391462	BRD-K73391462-001-01-9	Broad Institute of MIT and Harvard	BRD-K73391462			Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CCNC(=O)Nc2cc(F)ccc2F)O[C@H]1CO	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19-,21+/m1/s1	GELVUGAWQDMXAC-BSIFCXSSSA-N	483.163948084							118333
BRD-K11433244	LSM-29783		54640386	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13+,14+/m1/s1	PNFPPQXPTKVRON-RDBSUJKOSA-N	NCC[C@H]1CC[C@H](NC(=O)Nc2ccc(F)cc2)[C@H](CO)O1	BroadT	BRD-K11433244	BRD-K11433244-001-01-9	Broad Institute of MIT and Harvard	BRD-K11433244			NCC[C@H]1CC[C@H](NC(=O)Nc2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13+,14+/m1/s1	PNFPPQXPTKVRON-RDBSUJKOSA-N	311.164519794							118334
BRD-K82477786	LSM-29784		54640346	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17+,18-/m1/s1	HMAQNEDPCLDOSX-FHLIZLRMSA-N	Cc1onc(C)c1NC(=O)N[C@H]2C=C[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@@H]2CO	BroadT	BRD-K82477786	BRD-K82477786-001-01-4	Broad Institute of MIT and Harvard	BRD-K82477786			Cc1noc(C)c1NC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@@H]1CO	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17+,18-/m1/s1	HMAQNEDPCLDOSX-FHLIZLRMSA-N	482.112375328							118335
BRD-K73206088	LSM-29785		54640259	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20-/m0/s1	CAUJNQQMPJLGLW-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K73206088	BRD-K73206088-001-01-3	Broad Institute of MIT and Harvard	BRD-K73206088			OC[C@@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20-/m0/s1	CAUJNQQMPJLGLW-UFYCRDLUSA-N	430.201633584							118336
BRD-K88070218	LSM-29786		54640372	InChI=1S/C15H23N3O3/c16-6-3-12-1-2-13(14(10-19)21-12)18-15(20)9-11-4-7-17-8-5-11/h4-5,7-8,12-14,19H,1-3,6,9-10,16H2,(H,18,20)/t12-,13+,14+/m1/s1	GLKCOTROISWSTI-RDBSUJKOSA-N	NCC[C@H]1CC[C@H](NC(=O)Cc2ccncc2)[C@H](CO)O1	BroadT	BRD-K88070218	BRD-K88070218-001-01-9	Broad Institute of MIT and Harvard	BRD-K88070218			NCC[C@H]1CC[C@H](NC(=O)Cc2ccncc2)[C@H](CO)O1	InChI=1S/C15H23N3O3/c16-6-3-12-1-2-13(14(10-19)21-12)18-15(20)9-11-4-7-17-8-5-11/h4-5,7-8,12-14,19H,1-3,6,9-10,16H2,(H,18,20)/t12-,13+,14+/m1/s1	GLKCOTROISWSTI-RDBSUJKOSA-N	293.173941626							118337
BRD-K26765362	LSM-29787		54640138	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21+,22+/m0/s1	FWLXELJMTMEYKB-BHDDXSALSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K26765362	BRD-K26765362-001-01-3	Broad Institute of MIT and Harvard	BRD-K26765362			Cn1cnc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21+,22+/m0/s1	FWLXELJMTMEYKB-BHDDXSALSA-N	484.178040726							118338
BRD-K55169051	LSM-29788		54640322	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20-,21+/m1/s1	BEKOLHWPUBERJD-UIFIKXQLSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccccc3F)O[C@H]2CO	BroadT	BRD-K55169051	BRD-K55169051-001-01-8	Broad Institute of MIT and Harvard	BRD-K55169051			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20-,21+/m1/s1	BEKOLHWPUBERJD-UIFIKXQLSA-N	466.157385494							118339
BRD-K29969800	LSM-29789		54640357	InChI=1S/C20H21F2N5O4/c21-12-1-3-15(22)17(7-12)27-20(30)26-16-4-2-14(31-18(16)10-28)8-19(29)24-9-13-5-6-23-11-25-13/h1-7,11,14,16,18,28H,8-10H2,(H,24,29)(H2,26,27,30)/t14-,16+,18+/m1/s1	MOYKFZGAGJCWIL-HFTRVMKXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K29969800	BRD-K29969800-001-01-8	Broad Institute of MIT and Harvard	BRD-K29969800			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H21F2N5O4/c21-12-1-3-15(22)17(7-12)27-20(30)26-16-4-2-14(31-18(16)10-28)8-19(29)24-9-13-5-6-23-11-25-13/h1-7,11,14,16,18,28H,8-10H2,(H,24,29)(H2,26,27,30)/t14-,16+,18+/m1/s1	MOYKFZGAGJCWIL-HFTRVMKXSA-N	433.156160602							118340
BRD-K77004285	LSM-29790		54640162	InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13-/m1/s1	IZNXMLLZVKASMZ-JHJVBQTASA-N	OC[C@H]1O[C@@H](CC(=O)O)C=C[C@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K77004285	BRD-K77004285-001-01-9	Broad Institute of MIT and Harvard	BRD-K77004285			OC[C@H]1O[C@@H](CC(O)=O)C=C[C@H]1NC(=O)Nc1ccccc1	InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13-/m1/s1	IZNXMLLZVKASMZ-JHJVBQTASA-N	306.121571696							118341
BRD-K45589340	LSM-29791		54640282	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17-,19+/m0/s1	BVWTUHQTVRXDSV-JENIJYKNSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K45589340	BRD-K45589340-001-01-1	Broad Institute of MIT and Harvard	BRD-K45589340			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17-,19+/m0/s1	BVWTUHQTVRXDSV-JENIJYKNSA-N	401.175084478							118342
BRD-K12612468	LSM-29792		54640277	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19+,21-/m0/s1	GELVUGAWQDMXAC-SCWSEQNSSA-N	Cc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@H]2CO	BroadT	BRD-K12612468	BRD-K12612468-001-01-6	Broad Institute of MIT and Harvard	BRD-K12612468			Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNC(=O)Nc2cc(F)ccc2F)O[C@H]1CO	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19+,21-/m0/s1	GELVUGAWQDMXAC-SCWSEQNSSA-N	483.163948084							118343
BRD-K41538715	LSM-29793		54640303	InChI=1S/C26H25N3O4/c30-17-24-23(29-26(32)20-12-14-27-15-13-20)11-10-22(33-24)16-25(31)28-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-15,22-24,30H,16-17H2,(H,28,31)(H,29,32)/t22-,23-,24+/m0/s1	WWBREHKQUAGTED-KMDXXIMOSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)c4ccncc4	BroadT	BRD-K41538715	BRD-K41538715-001-01-9	Broad Institute of MIT and Harvard	BRD-K41538715			OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)c1ccncc1	InChI=1S/C26H25N3O4/c30-17-24-23(29-26(32)20-12-14-27-15-13-20)11-10-22(33-24)16-25(31)28-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-15,22-24,30H,16-17H2,(H,28,31)(H,29,32)/t22-,23-,24+/m0/s1	WWBREHKQUAGTED-KMDXXIMOSA-N	443.18450631							118344
BRD-K82764092	LSM-29794		54640260	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20-/m1/s1	CAUJNQQMPJLGLW-HSALFYBXSA-N	OC[C@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K82764092	BRD-K82764092-001-01-4	Broad Institute of MIT and Harvard	BRD-K82764092			OC[C@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20-/m1/s1	CAUJNQQMPJLGLW-HSALFYBXSA-N	430.201633584							118345
BRD-K60123410	LSM-29795		54640112	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16-,18+/m0/s1	OWGSILQKVGHWMO-XYJFISCASA-N	OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K60123410	BRD-K60123410-001-01-4	Broad Institute of MIT and Harvard	BRD-K60123410			OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16-,18+/m0/s1	OWGSILQKVGHWMO-XYJFISCASA-N	433.151682008							118346
BRD-K80296876	LSM-29796		54640219	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20-,22-/m0/s1	UESSXGKYQCVSOE-XJABCFGWSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3CCCCC3)CC[C@@H]1NC(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K80296876	BRD-K80296876-001-01-1	Broad Institute of MIT and Harvard	BRD-K80296876			OC[C@@H]1O[C@H](CCn2cc(nn2)C2CCCCC2)CC[C@@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20-,22-/m0/s1	UESSXGKYQCVSOE-XJABCFGWSA-N	495.180395322							118347
BRD-K22481359	LSM-29797		54640419	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24+/m0/s1	GZDPKZCGLLNMKC-AWRGLXIESA-N	OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K22481359	BRD-K22481359-001-01-6	Broad Institute of MIT and Harvard	BRD-K22481359			OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24+/m0/s1	GZDPKZCGLLNMKC-AWRGLXIESA-N	496.232184784							118348
BRD-K91387865	LSM-29798		54640335	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20-/m1/s1	SDPGYCOKVZGVFV-NSISKUIASA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K91387865	BRD-K91387865-001-01-8	Broad Institute of MIT and Harvard	BRD-K91387865			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20-/m1/s1	SDPGYCOKVZGVFV-NSISKUIASA-N	415.190734542							118349
BRD-K19755525	LSM-29799		54640307	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20+,22+/m0/s1	DFXHLBQSDWHRLL-UCNVEGJOSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3ccccc3F)CC[C@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K19755525	BRD-K19755525-001-01-7	Broad Institute of MIT and Harvard	BRD-K19755525			OC[C@H]1O[C@H](CCn2cc(nn2)-c2ccccc2F)CC[C@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20+,22+/m0/s1	DFXHLBQSDWHRLL-UCNVEGJOSA-N	473.16299562							118350
BRD-K28764680	LSM-29800		54640314	InChI=1S/C25H26N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-8,11,18-20,23,28H,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20-,23-/m0/s1	MSTFBRZSUKBDPT-JTAQYXEDSA-N	OC[C@@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)C=C[C@@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K28764680	BRD-K28764680-001-01-9	Broad Institute of MIT and Harvard	BRD-K28764680			OC[C@@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)C=C[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H26N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-8,11,18-20,23,28H,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20-,23-/m0/s1	MSTFBRZSUKBDPT-JTAQYXEDSA-N	450.179086572							118351
BRD-K54003455	LSM-29801		54640424	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16+,18+/m1/s1	OWGSILQKVGHWMO-RYRKJORJSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K54003455	BRD-K54003455-001-01-2	Broad Institute of MIT and Harvard	BRD-K54003455			OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16+,18+/m1/s1	OWGSILQKVGHWMO-RYRKJORJSA-N	433.151682008							118352
BRD-K47410882	LSM-29802		54640393	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21+,24+/m0/s1	MKOAEKBYEUHALQ-XVWGUNQUSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)c4ccccc4OC)O[C@@H]2CO	BroadT	BRD-K47410882	BRD-K47410882-001-01-2	Broad Institute of MIT and Harvard	BRD-K47410882			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2ccccc2OC)O[C@@H]1CO	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21+,24+/m0/s1	MKOAEKBYEUHALQ-XVWGUNQUSA-N	502.18860541							118353
BRD-K08939947	LSM-29803		54640252	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17+,18-/m1/s1	KSBPLIKBKJINFF-BPQIPLTHSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K08939947	BRD-K08939947-001-01-0	Broad Institute of MIT and Harvard	BRD-K08939947			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17+,18-/m1/s1	KSBPLIKBKJINFF-BPQIPLTHSA-N	414.162470874							118354
BRD-K89336453	LSM-29804		54640147	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17+,18+/m1/s1	PYJMYSQFCOCJMQ-NJAFHUGGSA-N	CCCc1cn(CC[C@H]2CC[C@H](NS(=O)(=O)c3ccccc3Cl)[C@H](CO)O2)nn1	BroadT	BRD-K89336453	BRD-K89336453-001-01-7	Broad Institute of MIT and Harvard	BRD-K89336453			CCCc1cn(CC[C@H]2CC[C@H](NS(=O)(=O)c3ccccc3Cl)[C@H](CO)O2)nn1	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17+,18+/m1/s1	PYJMYSQFCOCJMQ-NJAFHUGGSA-N	442.144153784							118355
BRD-K18428988	LSM-29805		54640248	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17-,18-/m1/s1	KSBPLIKBKJINFF-KBAYOESNSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K18428988	BRD-K18428988-001-01-2	Broad Institute of MIT and Harvard	BRD-K18428988			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17-,18-/m1/s1	KSBPLIKBKJINFF-KBAYOESNSA-N	414.162470874							118356
BRD-K03344897	LSM-29806		54640153	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17+,18-/m0/s1	PYJMYSQFCOCJMQ-JQHSSLGASA-N	CCCc1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)c3ccccc3Cl)[C@H](CO)O2)nn1	BroadT	BRD-K03344897	BRD-K03344897-001-01-8	Broad Institute of MIT and Harvard	BRD-K03344897			CCCc1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)c3ccccc3Cl)[C@H](CO)O2)nn1	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17+,18-/m0/s1	PYJMYSQFCOCJMQ-JQHSSLGASA-N	442.144153784							118357
BRD-K96898856	LSM-29807		54640141	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21-,22-/m0/s1	FWLXELJMTMEYKB-FKBYEOEOSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K96898856	BRD-K96898856-001-01-0	Broad Institute of MIT and Harvard	BRD-K96898856			Cn1cnc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21-,22-/m0/s1	FWLXELJMTMEYKB-FKBYEOEOSA-N	484.178040726							118358
BRD-K69348766	LSM-29808		54640343	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17-,18-/m0/s1	HMAQNEDPCLDOSX-WBAXXEDZSA-N	Cc1onc(C)c1NC(=O)N[C@H]2C=C[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2CO	BroadT	BRD-K69348766	BRD-K69348766-001-01-8	Broad Institute of MIT and Harvard	BRD-K69348766			Cc1noc(C)c1NC(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@H]1CO	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17-,18-/m0/s1	HMAQNEDPCLDOSX-WBAXXEDZSA-N	482.112375328							118359
BRD-K95068765	LSM-29809		54640304	InChI=1S/C26H25N3O4/c30-17-24-23(29-26(32)20-12-14-27-15-13-20)11-10-22(33-24)16-25(31)28-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-15,22-24,30H,16-17H2,(H,28,31)(H,29,32)/t22-,23-,24+/m1/s1	WWBREHKQUAGTED-SMIHKQSGSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)c4ccncc4	BroadT	BRD-K95068765	BRD-K95068765-001-01-1	Broad Institute of MIT and Harvard	BRD-K95068765			OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)c1ccncc1	InChI=1S/C26H25N3O4/c30-17-24-23(29-26(32)20-12-14-27-15-13-20)11-10-22(33-24)16-25(31)28-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-15,22-24,30H,16-17H2,(H,28,31)(H,29,32)/t22-,23-,24+/m1/s1	WWBREHKQUAGTED-SMIHKQSGSA-N	443.18450631							118360
BRD-K45713337	LSM-29810		54640403	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19-,20-/m1/s1	DSHMBJFFZMCEDJ-MISYRCLQSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K45713337	BRD-K45713337-001-01-2	Broad Institute of MIT and Harvard	BRD-K45713337			OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19-,20-/m1/s1	DSHMBJFFZMCEDJ-MISYRCLQSA-N	451.157719852							118361
BRD-K70935154	LSM-29811		54640380	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17-,18-/m0/s1	DQIDKWUHVOLFRC-BZSNNMDCSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K70935154	BRD-K70935154-001-01-9	Broad Institute of MIT and Harvard	BRD-K70935154			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17-,18-/m0/s1	DQIDKWUHVOLFRC-BZSNNMDCSA-N	395.242021186							118362
BRD-K47370004	LSM-29812		54640313	InChI=1S/C25H26N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-8,11,18-20,23,28H,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20+,23+/m0/s1	MSTFBRZSUKBDPT-MIZPHKNDSA-N	OC[C@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)C=C[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K47370004	BRD-K47370004-001-01-1	Broad Institute of MIT and Harvard	BRD-K47370004			OC[C@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)C=C[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H26N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-8,11,18-20,23,28H,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20+,23+/m0/s1	MSTFBRZSUKBDPT-MIZPHKNDSA-N	450.179086572							118363
BRD-K74537725	LSM-29813		54640149	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17-,18+/m1/s1	PYJMYSQFCOCJMQ-NXHRZFHOSA-N	CCCc1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)c3ccccc3Cl)[C@H](CO)O2)nn1	BroadT	BRD-K74537725	BRD-K74537725-001-01-9	Broad Institute of MIT and Harvard	BRD-K74537725			CCCc1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)c3ccccc3Cl)[C@H](CO)O2)nn1	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17-,18+/m1/s1	PYJMYSQFCOCJMQ-NXHRZFHOSA-N	442.144153784							118364
BRD-K68314790	LSM-29814		54640170	InChI=1S/C15H19NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-7,11,13-14,16-17H,8-9H2,1H3,(H,18,19)/t11-,13-,14+/m0/s1	GUDXKJZEBVMQGW-FPMFFAJLSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)O)O[C@@H]2CO	BroadT	BRD-K68314790	BRD-K68314790-001-01-1	Broad Institute of MIT and Harvard	BRD-K68314790			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(O)=O)O[C@@H]1CO	InChI=1S/C15H19NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-7,11,13-14,16-17H,8-9H2,1H3,(H,18,19)/t11-,13-,14+/m0/s1	GUDXKJZEBVMQGW-FPMFFAJLSA-N	341.093308028							118365
BRD-K13697445	LSM-29815		54640399	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21-,24-/m0/s1	MKOAEKBYEUHALQ-JBUDQFAYSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)c4ccccc4OC)O[C@H]2CO	BroadT	BRD-K13697445	BRD-K13697445-001-01-4	Broad Institute of MIT and Harvard	BRD-K13697445			COc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)-c2ccccc2OC)O[C@H]1CO	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21-,24-/m0/s1	MKOAEKBYEUHALQ-JBUDQFAYSA-N	502.18860541							118366
BRD-K08811598	LSM-29816		54640110	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16+,18-/m1/s1	OWGSILQKVGHWMO-SOLBZPMBSA-N	OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K08811598	BRD-K08811598-001-01-3	Broad Institute of MIT and Harvard	BRD-K08811598			OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16+,18-/m1/s1	OWGSILQKVGHWMO-SOLBZPMBSA-N	433.151682008							118367
CHEMBL3184782	LSM-29817	BRD-K69466030	54640185	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13-,14+/m1/s1	HFDKIVHAHGCNSH-MCIONIFRSA-N	COC(=O)C[C@H]1CC[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@H](CO)O1	BroadT	BRD-K69466030	BRD-K69466030-001-01-8	Broad Institute of MIT and Harvard	BRD-K69466030			COC(=O)C[C@H]1CC[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@H](CO)O1	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13-,14+/m1/s1	HFDKIVHAHGCNSH-MCIONIFRSA-N	390.140256392							118368
BRD-K73479560	LSM-29818		54640418	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24-/m0/s1	GZDPKZCGLLNMKC-HFMPRLQTSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K73479560	BRD-K73479560-001-01-3	Broad Institute of MIT and Harvard	BRD-K73479560			OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24-/m0/s1	GZDPKZCGLLNMKC-HFMPRLQTSA-N	496.232184784							118369
BRD-K13146924	LSM-29819		54640146	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17+,18+/m0/s1	PYJMYSQFCOCJMQ-CGTJXYLNSA-N	CCCc1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)c3ccccc3Cl)[C@@H](CO)O2)nn1	BroadT	BRD-K13146924	BRD-K13146924-001-01-2	Broad Institute of MIT and Harvard	BRD-K13146924			CCCc1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)c3ccccc3Cl)[C@@H](CO)O2)nn1	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17+,18+/m0/s1	PYJMYSQFCOCJMQ-CGTJXYLNSA-N	442.144153784							118370
BRD-K31521981	LSM-29820		54640340	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20-/m0/s1	SDPGYCOKVZGVFV-DBVUQKKJSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K31521981	BRD-K31521981-001-01-4	Broad Institute of MIT and Harvard	BRD-K31521981			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20-/m0/s1	SDPGYCOKVZGVFV-DBVUQKKJSA-N	415.190734542							118371
BRD-K81104218	LSM-29821		54640415	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24+/m0/s1	GZDPKZCGLLNMKC-YZUZCNPQSA-N	OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K81104218	BRD-K81104218-001-01-3	Broad Institute of MIT and Harvard	BRD-K81104218			OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24+/m0/s1	GZDPKZCGLLNMKC-YZUZCNPQSA-N	496.232184784							118372
BRD-K57388326	LSM-29822		54640178	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19-,20-/m0/s1	RBLWVJQIFCDULU-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K57388326	BRD-K57388326-001-01-1	Broad Institute of MIT and Harvard	BRD-K57388326			OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19-,20-/m0/s1	RBLWVJQIFCDULU-UFYCRDLUSA-N	425.288971378							118373
BRD-K64531863	LSM-29823		54640160	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22-/m0/s1	GMABBLNRVHCWFG-ONTIZHBOSA-N	OC[C@@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)c4ccccn4	BroadT	BRD-K64531863	BRD-K64531863-001-01-6	Broad Institute of MIT and Harvard	BRD-K64531863			OC[C@@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22-/m0/s1	GMABBLNRVHCWFG-ONTIZHBOSA-N	421.211389774							118374
BRD-K73929798	LSM-29824		54640308	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20-,22-/m1/s1	DFXHLBQSDWHRLL-NQSCKRDGSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3ccccc3F)CC[C@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K73929798	BRD-K73929798-001-01-1	Broad Institute of MIT and Harvard	BRD-K73929798			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2F)CC[C@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20-,22-/m1/s1	DFXHLBQSDWHRLL-NQSCKRDGSA-N	473.16299562							118375
BRD-K77820762	LSM-29825		54640261	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20-/m0/s1	CAUJNQQMPJLGLW-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K77820762	BRD-K77820762-001-01-0	Broad Institute of MIT and Harvard	BRD-K77820762			OC[C@@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20-/m0/s1	CAUJNQQMPJLGLW-ZCNNSNEGSA-N	430.201633584							118376
BRD-K87640319	LSM-29826		54640148	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17-,18-/m1/s1	PYJMYSQFCOCJMQ-KBAYOESNSA-N	CCCc1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)c3ccccc3Cl)[C@@H](CO)O2)nn1	BroadT	BRD-K87640319	BRD-K87640319-001-01-8	Broad Institute of MIT and Harvard	BRD-K87640319			CCCc1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)c3ccccc3Cl)[C@@H](CO)O2)nn1	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17-,18-/m1/s1	PYJMYSQFCOCJMQ-KBAYOESNSA-N	442.144153784							118377
BRD-K34169251	LSM-29827		54640333	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20+/m1/s1	SDPGYCOKVZGVFV-UXPWSPDFSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K34169251	BRD-K34169251-001-01-2	Broad Institute of MIT and Harvard	BRD-K34169251			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20+/m1/s1	SDPGYCOKVZGVFV-UXPWSPDFSA-N	415.190734542							118378
BRD-K74905843	LSM-29828		54640116	InChI=1S/C13H24N2O3/c14-7-6-10-4-5-11(12(8-16)18-10)15-13(17)9-2-1-3-9/h9-12,16H,1-8,14H2,(H,15,17)/t10-,11-,12-/m1/s1	WTINLZZCKOEXLA-IJLUTSLNSA-N	NCC[C@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1	BroadT	BRD-K74905843	BRD-K74905843-001-01-5	Broad Institute of MIT and Harvard	BRD-K74905843			NCC[C@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1	InChI=1S/C13H24N2O3/c14-7-6-10-4-5-11(12(8-16)18-10)15-13(17)9-2-1-3-9/h9-12,16H,1-8,14H2,(H,15,17)/t10-,11-,12-/m1/s1	WTINLZZCKOEXLA-IJLUTSLNSA-N	256.178692648							118379
BRD-K82729465	LSM-29829		54640320	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20-,21-/m1/s1	BEKOLHWPUBERJD-DUXKGJEZSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccccc3F)O[C@@H]2CO	BroadT	BRD-K82729465	BRD-K82729465-001-01-6	Broad Institute of MIT and Harvard	BRD-K82729465			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20-,21-/m1/s1	BEKOLHWPUBERJD-DUXKGJEZSA-N	466.157385494							118380
BRD-K77869064	LSM-29830		54640129	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9-,10+/m0/s1	YHTHTGTWYCQHDQ-LPEHRKFASA-N	CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)O)O[C@@H]1CO	BroadT	BRD-K77869064	BRD-K77869064-001-01-2	Broad Institute of MIT and Harvard	BRD-K77869064			CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(O)=O)O[C@@H]1CO	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9-,10+/m0/s1	YHTHTGTWYCQHDQ-LPEHRKFASA-N	272.13722176							118381
BRD-K44520987	LSM-29831		54640145	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21+,22-/m0/s1	FWLXELJMTMEYKB-BDTNDASRSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K44520987	BRD-K44520987-001-01-5	Broad Institute of MIT and Harvard	BRD-K44520987			Cn1cnc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21+,22-/m0/s1	FWLXELJMTMEYKB-BDTNDASRSA-N	484.178040726							118382
BRD-K77903467	LSM-29832		54640352	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19-,20-/m1/s1	VDBDKUPLXIXHLN-NSISKUIASA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K77903467	BRD-K77903467-001-01-2	Broad Institute of MIT and Harvard	BRD-K77903467			OC[C@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19-,20-/m1/s1	VDBDKUPLXIXHLN-NSISKUIASA-N	483.17811911							118383
BRD-K97721960	LSM-29833		54640345	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17-,18+/m1/s1	HMAQNEDPCLDOSX-OLMNPRSZSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2C=C[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2CO	BroadT	BRD-K97721960	BRD-K97721960-001-01-6	Broad Institute of MIT and Harvard	BRD-K97721960			Cc1noc(C)c1NC(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@H]1CO	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17-,18+/m1/s1	HMAQNEDPCLDOSX-OLMNPRSZSA-N	482.112375328							118384
BRD-K24284160	LSM-29834		54640211	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19-,20+/m1/s1	OQCXBRWJDZLXCP-NMLACTOBSA-N	C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)c2cccnc2)C=C1)c3ccccc3	BroadT	BRD-K24284160	BRD-K24284160-001-01-1	Broad Institute of MIT and Harvard	BRD-K24284160			C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)c2cccnc2)C=C1)c1ccccc1	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19-,20+/m1/s1	OQCXBRWJDZLXCP-NMLACTOBSA-N	395.18450631							118385
BRD-K88472400	LSM-29835		54640204	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20+/m0/s1	OQCXBRWJDZLXCP-MVJPYGJCSA-N	C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)c2cccnc2)C=C1)c3ccccc3	BroadT	BRD-K88472400	BRD-K88472400-001-01-5	Broad Institute of MIT and Harvard	BRD-K88472400			C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)c2cccnc2)C=C1)c1ccccc1	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20+/m0/s1	OQCXBRWJDZLXCP-MVJPYGJCSA-N	395.18450631							118386
BRD-K94962273	LSM-29836		54640262	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15+,16+/m0/s1	VMTZMCYUUHONMK-ARFHVFGLSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCCCC3)O[C@@H]2CO	BroadT	BRD-K94962273	BRD-K94962273-001-01-1	Broad Institute of MIT and Harvard	BRD-K94962273			Cc1noc(C)c1NC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15+,16+/m0/s1	VMTZMCYUUHONMK-ARFHVFGLSA-N	392.205970036							118387
BRD-K69715817	LSM-29837		54640398	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21-,24-/m1/s1	MKOAEKBYEUHALQ-NYQDVAGCSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)c4ccccc4OC)O[C@@H]2CO	BroadT	BRD-K69715817	BRD-K69715817-001-01-7	Broad Institute of MIT and Harvard	BRD-K69715817			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)-c2ccccc2OC)O[C@@H]1CO	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21-,24-/m1/s1	MKOAEKBYEUHALQ-NYQDVAGCSA-N	502.18860541							118388
BRD-K41031262	LSM-29838		54640250	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17-,18+/m0/s1	KSBPLIKBKJINFF-RYQLBKOJSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K41031262	BRD-K41031262-001-01-2	Broad Institute of MIT and Harvard	BRD-K41031262			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17-,18+/m0/s1	KSBPLIKBKJINFF-RYQLBKOJSA-N	414.162470874							118389
BRD-K19968781	LSM-29839		54640157	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22+/m0/s1	GMABBLNRVHCWFG-JAXLGGSGSA-N	OC[C@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)c4ccccn4	BroadT	BRD-K19968781	BRD-K19968781-001-01-5	Broad Institute of MIT and Harvard	BRD-K19968781			OC[C@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22+/m0/s1	GMABBLNRVHCWFG-JAXLGGSGSA-N	421.211389774							118390
BRD-K72441510	LSM-29840		54640168	InChI=1S/C15H19NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-7,11,13-14,16-17H,8-9H2,1H3,(H,18,19)/t11-,13+,14+/m0/s1	GUDXKJZEBVMQGW-IACUBPJLSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)O)O[C@@H]2CO	BroadT	BRD-K72441510	BRD-K72441510-001-01-5	Broad Institute of MIT and Harvard	BRD-K72441510			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(O)=O)O[C@@H]1CO	InChI=1S/C15H19NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-7,11,13-14,16-17H,8-9H2,1H3,(H,18,19)/t11-,13+,14+/m0/s1	GUDXKJZEBVMQGW-IACUBPJLSA-N	341.093308028							118391
BRD-K64692525	LSM-29841		54640143	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21-,22+/m1/s1	FWLXELJMTMEYKB-VSKRKVRLSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K64692525	BRD-K64692525-001-01-6	Broad Institute of MIT and Harvard	BRD-K64692525			Cn1cnc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21-,22+/m1/s1	FWLXELJMTMEYKB-VSKRKVRLSA-N	484.178040726							118392
BRD-K44494409	LSM-29842		54640404	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19-,20-/m0/s1	DSHMBJFFZMCEDJ-IHPCNDPISA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K44494409	BRD-K44494409-001-01-3	Broad Institute of MIT and Harvard	BRD-K44494409			OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19-,20-/m0/s1	DSHMBJFFZMCEDJ-IHPCNDPISA-N	451.157719852							118393
BRD-K21051792	LSM-29843		54640242	InChI=1S/C21H30ClN3O5/c22-15-2-1-3-16(12-15)24-21(28)25-18-5-4-17(30-19(18)13-26)6-9-23-20(27)14-7-10-29-11-8-14/h1-3,12,14,17-19,26H,4-11,13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19-/m1/s1	PBAPATWUXUNVNP-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)Nc3cccc(Cl)c3	BroadT	BRD-K21051792	BRD-K21051792-001-01-3	Broad Institute of MIT and Harvard	BRD-K21051792			OC[C@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C21H30ClN3O5/c22-15-2-1-3-16(12-15)24-21(28)25-18-5-4-17(30-19(18)13-26)6-9-23-20(27)14-7-10-29-11-8-14/h1-3,12,14,17-19,26H,4-11,13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19-/m1/s1	PBAPATWUXUNVNP-GUDVDZBRSA-N	439.1873988							118394
BRD-K34262858	LSM-29844		54640407	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19+,20-/m1/s1	DSHMBJFFZMCEDJ-YZGWKJHDSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K34262858	BRD-K34262858-001-01-2	Broad Institute of MIT and Harvard	BRD-K34262858			OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19+,20-/m1/s1	DSHMBJFFZMCEDJ-YZGWKJHDSA-N	451.157719852							118395
BRD-K72029544	LSM-29845		54640297	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16-/m0/s1	JWFDGUDYVUNEGC-JYJNAYRXSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)CC[C@@H]1NC(=O)C3CC3	BroadT	BRD-K72029544	BRD-K72029544-001-01-8	Broad Institute of MIT and Harvard	BRD-K72029544			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)CC[C@@H]1NC(=O)C1CC1	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16-/m0/s1	JWFDGUDYVUNEGC-JYJNAYRXSA-N	347.18450631							118396
BRD-K76664579	LSM-29846		54640318	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20+,21+/m1/s1	BEKOLHWPUBERJD-QMMLZNLJSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccccc3F)O[C@H]2CO	BroadT	BRD-K76664579	BRD-K76664579-001-01-6	Broad Institute of MIT and Harvard	BRD-K76664579			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20+,21+/m1/s1	BEKOLHWPUBERJD-QMMLZNLJSA-N	466.157385494							118397
BRD-K98444789	LSM-29847		54640210	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20-/m0/s1	OQCXBRWJDZLXCP-QLIIJSOBSA-N	C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)c2cccnc2)C=C1)c3ccccc3	BroadT	BRD-K98444789	BRD-K98444789-001-01-3	Broad Institute of MIT and Harvard	BRD-K98444789			C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)c2cccnc2)C=C1)c1ccccc1	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20-/m0/s1	OQCXBRWJDZLXCP-QLIIJSOBSA-N	395.18450631							118398
BRD-K92246187	LSM-29848		54640267	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15-,16+/m1/s1	VMTZMCYUUHONMK-OAGGEKHMSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCCCC3)O[C@H]2CO	BroadT	BRD-K92246187	BRD-K92246187-001-01-6	Broad Institute of MIT and Harvard	BRD-K92246187			Cc1noc(C)c1NC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15-,16+/m1/s1	VMTZMCYUUHONMK-OAGGEKHMSA-N	392.205970036							118399
BRD-K62068620	LSM-29849		54640183	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13+,14+/m1/s1	HFDKIVHAHGCNSH-RDBSUJKOSA-N	COC(=O)C[C@H]1CC[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@H](CO)O1	BroadT	BRD-K62068620	BRD-K62068620-001-01-5	Broad Institute of MIT and Harvard	BRD-K62068620			COC(=O)C[C@H]1CC[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@H](CO)O1	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13+,14+/m1/s1	HFDKIVHAHGCNSH-RDBSUJKOSA-N	390.140256392							118400
BRD-K43896262	LSM-29850		54640182	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13+,14+/m0/s1	HFDKIVHAHGCNSH-BFHYXJOUSA-N	COC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@@H](CO)O1	BroadT	BRD-K43896262	BRD-K43896262-001-01-6	Broad Institute of MIT and Harvard	BRD-K43896262			COC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@@H](CO)O1	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13+,14+/m0/s1	HFDKIVHAHGCNSH-BFHYXJOUSA-N	390.140256392							118401
BRD-K40738002	LSM-29851		54640414	InChI=1S/C21H32ClN3O5S/c22-15-6-9-18(10-7-15)31(28,29)23-13-12-17-8-11-19(20(14-26)30-17)25-21(27)24-16-4-2-1-3-5-16/h6-7,9-10,16-17,19-20,23,26H,1-5,8,11-14H2,(H2,24,25,27)/t17-,19+,20-/m0/s1	DFLSSFAMCLDBJA-SXLOBPIMSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K40738002	BRD-K40738002-001-01-8	Broad Institute of MIT and Harvard	BRD-K40738002			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)NC1CCCCC1	InChI=1S/C21H32ClN3O5S/c22-15-6-9-18(10-7-15)31(28,29)23-13-12-17-8-11-19(20(14-26)30-17)25-21(27)24-16-4-2-1-3-5-16/h6-7,9-10,16-17,19-20,23,26H,1-5,8,11-14H2,(H2,24,25,27)/t17-,19+,20-/m0/s1	DFLSSFAMCLDBJA-SXLOBPIMSA-N	473.175119554							118402
BRD-K22672200	LSM-29852		54640123	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22-,23+/m1/s1	PZEUIISKRRGKSB-MZYLBHOOSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K22672200	BRD-K22672200-001-01-1	Broad Institute of MIT and Harvard	BRD-K22672200			OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22-,23+/m1/s1	PZEUIISKRRGKSB-MZYLBHOOSA-N	491.18901998							118403
BRD-K78311779	LSM-29853		54640174	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19+,20+/m0/s1	RBLWVJQIFCDULU-XUVXKRRUSA-N	OC[C@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K78311779	BRD-K78311779-001-01-0	Broad Institute of MIT and Harvard	BRD-K78311779			OC[C@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19+,20+/m0/s1	RBLWVJQIFCDULU-XUVXKRRUSA-N	425.288971378							118404
BRD-K42650945	LSM-29854		54640370	InChI=1S/C21H29N5O5/c1-13-20(14(2)31-26-13)25-21(29)23-9-7-16-5-6-17(18(12-27)30-16)24-19(28)10-15-4-3-8-22-11-15/h3-4,8,11,16-18,27H,5-7,9-10,12H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18-/m0/s1	LEDFMEUSPBTDMF-KSZLIROESA-N	Cc1onc(C)c1NC(=O)NCC[C@@H]2CC[C@@H](NC(=O)Cc3cccnc3)[C@H](CO)O2	BroadT	BRD-K42650945	BRD-K42650945-001-01-3	Broad Institute of MIT and Harvard	BRD-K42650945			Cc1noc(C)c1NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)Cc2cccnc2)[C@H](CO)O1	InChI=1S/C21H29N5O5/c1-13-20(14(2)31-26-13)25-21(29)23-9-7-16-5-6-17(18(12-27)30-16)24-19(28)10-15-4-3-8-22-11-15/h3-4,8,11,16-18,27H,5-7,9-10,12H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18-/m0/s1	LEDFMEUSPBTDMF-KSZLIROESA-N	431.216869078							118405
BRD-K17245631	LSM-29855		54640118	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22+,23+/m0/s1	PZEUIISKRRGKSB-MDNUFGMLSA-N	OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K17245631	BRD-K17245631-001-01-2	Broad Institute of MIT and Harvard	BRD-K17245631			OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22+,23+/m0/s1	PZEUIISKRRGKSB-MDNUFGMLSA-N	491.18901998							118406
BRD-K51087734	LSM-29856		54640413	InChI=1S/C21H32ClN3O5S/c22-15-6-9-18(10-7-15)31(28,29)23-13-12-17-8-11-19(20(14-26)30-17)25-21(27)24-16-4-2-1-3-5-16/h6-7,9-10,16-17,19-20,23,26H,1-5,8,11-14H2,(H2,24,25,27)/t17-,19+,20-/m1/s1	DFLSSFAMCLDBJA-YZGWKJHDSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K51087734	BRD-K51087734-001-01-1	Broad Institute of MIT and Harvard	BRD-K51087734			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)NC1CCCCC1	InChI=1S/C21H32ClN3O5S/c22-15-6-9-18(10-7-15)31(28,29)23-13-12-17-8-11-19(20(14-26)30-17)25-21(27)24-16-4-2-1-3-5-16/h6-7,9-10,16-17,19-20,23,26H,1-5,8,11-14H2,(H2,24,25,27)/t17-,19+,20-/m1/s1	DFLSSFAMCLDBJA-YZGWKJHDSA-N	473.175119554							118407
BRD-K49401787	LSM-29857		54640239	InChI=1S/C21H30ClN3O5/c22-15-2-1-3-16(12-15)24-21(28)25-18-5-4-17(30-19(18)13-26)6-9-23-20(27)14-7-10-29-11-8-14/h1-3,12,14,17-19,26H,4-11,13H2,(H,23,27)(H2,24,25,28)/t17-,18+,19+/m1/s1	PBAPATWUXUNVNP-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)Nc3cccc(Cl)c3	BroadT	BRD-K49401787	BRD-K49401787-001-01-5	Broad Institute of MIT and Harvard	BRD-K49401787			OC[C@@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C21H30ClN3O5/c22-15-2-1-3-16(12-15)24-21(28)25-18-5-4-17(30-19(18)13-26)6-9-23-20(27)14-7-10-29-11-8-14/h1-3,12,14,17-19,26H,4-11,13H2,(H,23,27)(H2,24,25,28)/t17-,18+,19+/m1/s1	PBAPATWUXUNVNP-QYZOEREBSA-N	439.1873988							118408
BRD-K04810287	LSM-29858		54640279	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17+,19+/m1/s1	BVWTUHQTVRXDSV-AOIWGVFYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K04810287	BRD-K04810287-001-01-5	Broad Institute of MIT and Harvard	BRD-K04810287			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17+,19+/m1/s1	BVWTUHQTVRXDSV-AOIWGVFYSA-N	401.175084478							118409
BRD-K42966513	LSM-29859		54640124	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22+,23-/m1/s1	PZEUIISKRRGKSB-AKIFATBCSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K42966513	BRD-K42966513-001-01-5	Broad Institute of MIT and Harvard	BRD-K42966513			OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22+,23-/m1/s1	PZEUIISKRRGKSB-AKIFATBCSA-N	491.18901998							118410
BRD-K82314391	LSM-29860		54640341	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17+,18+/m0/s1	HMAQNEDPCLDOSX-BMGDILEWSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2C=C[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@@H]2CO	BroadT	BRD-K82314391	BRD-K82314391-001-01-6	Broad Institute of MIT and Harvard	BRD-K82314391			Cc1noc(C)c1NC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@@H]1CO	InChI=1S/C21H24Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3-7,14,17-18,28H,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17+,18+/m0/s1	HMAQNEDPCLDOSX-BMGDILEWSA-N	482.112375328							118411
BRD-K75724196	LSM-29861		54640137	InChI=1S/C20H27N3O6/c1-27-15-4-2-3-14(11-15)21-20(26)22-17-6-5-16(29-18(17)13-24)12-19(25)23-7-9-28-10-8-23/h2-6,11,16-18,24H,7-10,12-13H2,1H3,(H2,21,22,26)/t16-,17+,18-/m1/s1	DEUGGSUTAOAWFI-FGTMMUONSA-N	COc1cccc(NC(=O)N[C@H]2C=C[C@H](CC(=O)N3CCOCC3)O[C@@H]2CO)c1	BroadT	BRD-K75724196	BRD-K75724196-001-01-2	Broad Institute of MIT and Harvard	BRD-K75724196			COc1cccc(NC(=O)N[C@H]2C=C[C@H](CC(=O)N3CCOCC3)O[C@@H]2CO)c1	InChI=1S/C20H27N3O6/c1-27-15-4-2-3-14(11-15)21-20(26)22-17-6-5-16(29-18(17)13-24)12-19(25)23-7-9-28-10-8-23/h2-6,11,16-18,24H,7-10,12-13H2,1H3,(H2,21,22,26)/t16-,17+,18-/m1/s1	DEUGGSUTAOAWFI-FGTMMUONSA-N	405.189985614							118412
BRD-K06226868	LSM-29862		54640218	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20-,22-/m1/s1	UESSXGKYQCVSOE-NQSCKRDGSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3CCCCC3)CC[C@H]1NC(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K06226868	BRD-K06226868-001-01-9	Broad Institute of MIT and Harvard	BRD-K06226868			OC[C@H]1O[C@@H](CCn2cc(nn2)C2CCCCC2)CC[C@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20-,22-/m1/s1	UESSXGKYQCVSOE-NQSCKRDGSA-N	495.180395322							118413
BRD-K45472595	LSM-29863		54640270	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19+,21+/m0/s1	GELVUGAWQDMXAC-LDQXTDLNSA-N	Cc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@@H]2CO	BroadT	BRD-K45472595	BRD-K45472595-001-01-2	Broad Institute of MIT and Harvard	BRD-K45472595			Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNC(=O)Nc2cc(F)ccc2F)O[C@@H]1CO	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19+,21+/m0/s1	GELVUGAWQDMXAC-LDQXTDLNSA-N	483.163948084							118414
BRD-K24970278	LSM-29864		54640376	InChI=1S/C15H23N3O3/c16-6-3-12-1-2-13(14(10-19)21-12)18-15(20)9-11-4-7-17-8-5-11/h4-5,7-8,12-14,19H,1-3,6,9-10,16H2,(H,18,20)/t12-,13+,14-/m0/s1	GLKCOTROISWSTI-MJBXVCDLSA-N	NCC[C@@H]1CC[C@@H](NC(=O)Cc2ccncc2)[C@H](CO)O1	BroadT	BRD-K24970278	BRD-K24970278-001-01-4	Broad Institute of MIT and Harvard	BRD-K24970278			NCC[C@@H]1CC[C@@H](NC(=O)Cc2ccncc2)[C@H](CO)O1	InChI=1S/C15H23N3O3/c16-6-3-12-1-2-13(14(10-19)21-12)18-15(20)9-11-4-7-17-8-5-11/h4-5,7-8,12-14,19H,1-3,6,9-10,16H2,(H,18,20)/t12-,13+,14-/m0/s1	GLKCOTROISWSTI-MJBXVCDLSA-N	293.173941626							118415
BRD-K81960205	LSM-29865		54640392	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13+,14-/m0/s1	PNFPPQXPTKVRON-MJBXVCDLSA-N	NCC[C@@H]1CC[C@@H](NC(=O)Nc2ccc(F)cc2)[C@H](CO)O1	BroadT	BRD-K81960205	BRD-K81960205-001-01-3	Broad Institute of MIT and Harvard	BRD-K81960205			NCC[C@@H]1CC[C@@H](NC(=O)Nc2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13+,14-/m0/s1	PNFPPQXPTKVRON-MJBXVCDLSA-N	311.164519794							118416
BRD-K61912055	LSM-29866		54640302	InChI=1S/C26H25N3O4/c30-17-24-23(29-26(32)20-12-14-27-15-13-20)11-10-22(33-24)16-25(31)28-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-15,22-24,30H,16-17H2,(H,28,31)(H,29,32)/t22-,23-,24-/m0/s1	WWBREHKQUAGTED-HJOGWXRNSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)c4ccncc4	BroadT	BRD-K61912055	BRD-K61912055-001-01-9	Broad Institute of MIT and Harvard	BRD-K61912055			OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)c1ccncc1	InChI=1S/C26H25N3O4/c30-17-24-23(29-26(32)20-12-14-27-15-13-20)11-10-22(33-24)16-25(31)28-21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-15,22-24,30H,16-17H2,(H,28,31)(H,29,32)/t22-,23-,24-/m0/s1	WWBREHKQUAGTED-HJOGWXRNSA-N	443.18450631							118417
BRD-K79753227	LSM-29867		54640209	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19-,20+/m0/s1	OQCXBRWJDZLXCP-JOCLIGHLSA-N	C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)c2cccnc2)C=C1)c3ccccc3	BroadT	BRD-K79753227	BRD-K79753227-001-01-0	Broad Institute of MIT and Harvard	BRD-K79753227			C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)c2cccnc2)C=C1)c1ccccc1	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19-,20+/m0/s1	OQCXBRWJDZLXCP-JOCLIGHLSA-N	395.18450631							118418
BRD-K08705996-001-01-5	LSM-29868	BRD-K08705996	54640238	InChI=1S/C21H30ClN3O5/c22-15-2-1-3-16(12-15)24-21(28)25-18-5-4-17(30-19(18)13-26)6-9-23-20(27)14-7-10-29-11-8-14/h1-3,12,14,17-19,26H,4-11,13H2,(H,23,27)(H2,24,25,28)/t17-,18+,19+/m0/s1	PBAPATWUXUNVNP-IPMKNSEASA-N	OC[C@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)Nc3cccc(Cl)c3	BroadT	BRD-K08705996	BRD-K08705996-001-01-5	Broad Institute of MIT and Harvard	BRD-K08705996			OC[C@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C21H30ClN3O5/c22-15-2-1-3-16(12-15)24-21(28)25-18-5-4-17(30-19(18)13-26)6-9-23-20(27)14-7-10-29-11-8-14/h1-3,12,14,17-19,26H,4-11,13H2,(H,23,27)(H2,24,25,28)/t17-,18+,19+/m0/s1	PBAPATWUXUNVNP-IPMKNSEASA-N	439.1873988							118419
BRD-K96448434	LSM-29869		54640265	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15-,16-/m0/s1	VMTZMCYUUHONMK-JYJNAYRXSA-N	Cc1onc(C)c1NC(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCCCC3)O[C@H]2CO	BroadT	BRD-K96448434	BRD-K96448434-001-01-5	Broad Institute of MIT and Harvard	BRD-K96448434			Cc1noc(C)c1NC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15-,16-/m0/s1	VMTZMCYUUHONMK-JYJNAYRXSA-N	392.205970036							118420
BRD-K74091626	LSM-29870		54640298	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16+/m0/s1	JWFDGUDYVUNEGC-HRCADAONSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)CC[C@@H]1NC(=O)C3CC3	BroadT	BRD-K74091626	BRD-K74091626-001-01-7	Broad Institute of MIT and Harvard	BRD-K74091626			OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)CC[C@@H]1NC(=O)C1CC1	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16+/m0/s1	JWFDGUDYVUNEGC-HRCADAONSA-N	347.18450631							118421
BRD-K14246348	LSM-29871		54640336	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20-/m0/s1	SDPGYCOKVZGVFV-VDGAXYAQSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K14246348	BRD-K14246348-001-01-7	Broad Institute of MIT and Harvard	BRD-K14246348			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20-/m0/s1	SDPGYCOKVZGVFV-VDGAXYAQSA-N	415.190734542							118422
BRD-K77834935	LSM-29872		54640416	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24+/m1/s1	GZDPKZCGLLNMKC-DPLHUUCSSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K77834935	BRD-K77834935-001-01-3	Broad Institute of MIT and Harvard	BRD-K77834935			OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24+/m1/s1	GZDPKZCGLLNMKC-DPLHUUCSSA-N	496.232184784							118423
BRD-K91980109	LSM-29873		54640263	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15+,16+/m1/s1	VMTZMCYUUHONMK-PMPSAXMXSA-N	Cc1onc(C)c1NC(=O)N[C@H]2C=C[C@H](CC(=O)N3CCCCC3)O[C@H]2CO	BroadT	BRD-K91980109	BRD-K91980109-001-01-6	Broad Institute of MIT and Harvard	BRD-K91980109			Cc1noc(C)c1NC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15+,16+/m1/s1	VMTZMCYUUHONMK-PMPSAXMXSA-N	392.205970036							118424
BRD-K41888813	LSM-29874		54640207	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19+,20-/m0/s1	OQCXBRWJDZLXCP-OBZTUIKSSA-N	C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)c2cccnc2)C=C1)c3ccccc3	BroadT	BRD-K41888813	BRD-K41888813-001-01-9	Broad Institute of MIT and Harvard	BRD-K41888813			C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)c2cccnc2)C=C1)c1ccccc1	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19+,20-/m0/s1	OQCXBRWJDZLXCP-OBZTUIKSSA-N	395.18450631							118425
BRD-K91043938	LSM-29875		54640321	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20-,21-/m0/s1	BEKOLHWPUBERJD-YYWHXJBOSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccccc3F)O[C@H]2CO	BroadT	BRD-K91043938	BRD-K91043938-001-01-0	Broad Institute of MIT and Harvard	BRD-K91043938			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20-,21-/m0/s1	BEKOLHWPUBERJD-YYWHXJBOSA-N	466.157385494							118426
BRD-K29547381	LSM-29876		54640390	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13-,14+/m0/s1	PNFPPQXPTKVRON-MELADBBJSA-N	NCC[C@@H]1CC[C@H](NC(=O)Nc2ccc(F)cc2)[C@@H](CO)O1	BroadT	BRD-K29547381	BRD-K29547381-001-01-9	Broad Institute of MIT and Harvard	BRD-K29547381			NCC[C@@H]1CC[C@H](NC(=O)Nc2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13-,14+/m0/s1	PNFPPQXPTKVRON-MELADBBJSA-N	311.164519794							118427
BRD-K32906083	LSM-29877		54640166	InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12+,13-/m1/s1	IZNXMLLZVKASMZ-FRRDWIJNSA-N	OC[C@H]1O[C@@H](CC(=O)O)C=C[C@@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K32906083	BRD-K32906083-001-01-3	Broad Institute of MIT and Harvard	BRD-K32906083			OC[C@H]1O[C@@H](CC(O)=O)C=C[C@@H]1NC(=O)Nc1ccccc1	InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12+,13-/m1/s1	IZNXMLLZVKASMZ-FRRDWIJNSA-N	306.121571696							118428
BRD-K84593875	LSM-29878		54640181	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19+,20-/m0/s1	RBLWVJQIFCDULU-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K84593875	BRD-K84593875-001-01-8	Broad Institute of MIT and Harvard	BRD-K84593875			OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19+,20-/m0/s1	RBLWVJQIFCDULU-ZCNNSNEGSA-N	425.288971378							118429
BRD-K18958510	LSM-29879		54640286	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19+,20+/m0/s1	WDGFJBRIXWVRNV-DFQSSKMNSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)CC[C@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K18958510	BRD-K18958510-001-01-5	Broad Institute of MIT and Harvard	BRD-K18958510			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)CC[C@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19+,20+/m0/s1	WDGFJBRIXWVRNV-DFQSSKMNSA-N	439.214091876							118430
BRD-K87161673	LSM-29880		54640301	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16-/m0/s1	JWFDGUDYVUNEGC-XHSDSOJGSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)CC[C@H]1NC(=O)C3CC3	BroadT	BRD-K87161673	BRD-K87161673-001-01-5	Broad Institute of MIT and Harvard	BRD-K87161673			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)CC[C@H]1NC(=O)C1CC1	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16-/m0/s1	JWFDGUDYVUNEGC-XHSDSOJGSA-N	347.18450631							118431
BRD-K01676126	LSM-29881		54640144	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21+,22-/m1/s1	FWLXELJMTMEYKB-BHIFYINESA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K01676126	BRD-K01676126-001-01-8	Broad Institute of MIT and Harvard	BRD-K01676126			Cn1cnc(c1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C24H28N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,14,16,20-22,27,29H,11-13,15H2,1H3,(H,26,30)/t20-,21+,22-/m1/s1	FWLXELJMTMEYKB-BHIFYINESA-N	484.178040726							118432
BRD-K08940439	LSM-29882		54640402	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19+,20+/m0/s1	DSHMBJFFZMCEDJ-DFQSSKMNSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K08940439	BRD-K08940439-001-01-3	Broad Institute of MIT and Harvard	BRD-K08940439			OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19+,20+/m0/s1	DSHMBJFFZMCEDJ-DFQSSKMNSA-N	451.157719852							118433
BRD-K18452866	LSM-29883		54640274	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19+,21-/m1/s1	GELVUGAWQDMXAC-LKUPVBHCSA-N	Cc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@@H]2CO	BroadT	BRD-K18452866	BRD-K18452866-001-01-9	Broad Institute of MIT and Harvard	BRD-K18452866			Cc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@H](CCNC(=O)Nc2cc(F)ccc2F)O[C@@H]1CO	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19+,21-/m1/s1	GELVUGAWQDMXAC-LKUPVBHCSA-N	483.163948084							118434
BRD-K71502099	LSM-29884		54640417	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24-/m1/s1	GZDPKZCGLLNMKC-PQNGQFLHSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K71502099	BRD-K71502099-001-01-4	Broad Institute of MIT and Harvard	BRD-K71502099			OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24-/m1/s1	GZDPKZCGLLNMKC-PQNGQFLHSA-N	496.232184784							118435
BRD-K43548664	LSM-29885		54640339	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20-/m1/s1	SDPGYCOKVZGVFV-LSTHTHJFSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K43548664	BRD-K43548664-001-01-7	Broad Institute of MIT and Harvard	BRD-K43548664			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H26FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-21(28)24-13-15-6-2-1-3-7-15/h1-9,16,19-20,27H,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20-/m1/s1	SDPGYCOKVZGVFV-LSTHTHJFSA-N	415.190734542							118436
BRD-K12571248	LSM-29886		54640283	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17-,19+/m1/s1	BVWTUHQTVRXDSV-LMMKCTJWSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K12571248	BRD-K12571248-001-01-1	Broad Institute of MIT and Harvard	BRD-K12571248			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17-,19+/m1/s1	BVWTUHQTVRXDSV-LMMKCTJWSA-N	401.175084478							118437
BRD-K64753899	LSM-29887		54640126	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9+,10+/m0/s1	YHTHTGTWYCQHDQ-IVZWLZJFSA-N	CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)O)O[C@@H]1CO	BroadT	BRD-K64753899	BRD-K64753899-001-01-4	Broad Institute of MIT and Harvard	BRD-K64753899			CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(O)=O)O[C@@H]1CO	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9+,10+/m0/s1	YHTHTGTWYCQHDQ-IVZWLZJFSA-N	272.13722176							118438
BRD-K22308901	LSM-29888		54640127	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9+,10+/m1/s1	YHTHTGTWYCQHDQ-UTLUCORTSA-N	CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)O)O[C@H]1CO	BroadT	BRD-K22308901	BRD-K22308901-001-01-4	Broad Institute of MIT and Harvard	BRD-K22308901			CC(C)NC(=O)N[C@H]1C=C[C@H](CC(O)=O)O[C@H]1CO	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9+,10+/m1/s1	YHTHTGTWYCQHDQ-UTLUCORTSA-N	272.13722176							118439
BRD-K39328339	LSM-29889		54640323	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20-,21+/m0/s1	BEKOLHWPUBERJD-DZFGPLHGSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccccc3F)O[C@@H]2CO	BroadT	BRD-K39328339	BRD-K39328339-001-01-5	Broad Institute of MIT and Harvard	BRD-K39328339			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20-,21+/m0/s1	BEKOLHWPUBERJD-DZFGPLHGSA-N	466.157385494							118440
BRD-K98432726	LSM-29890		54640275	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19-,21-/m0/s1	GELVUGAWQDMXAC-LRQRDZAKSA-N	Cc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@H]2CO	BroadT	BRD-K98432726	BRD-K98432726-001-01-4	Broad Institute of MIT and Harvard	BRD-K98432726			Cc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CCNC(=O)Nc2cc(F)ccc2F)O[C@H]1CO	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19-,21-/m0/s1	GELVUGAWQDMXAC-LRQRDZAKSA-N	483.163948084							118441
BRD-K51743001	LSM-29891		54640420	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24+/m1/s1	GZDPKZCGLLNMKC-LGVFNWMJSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K51743001	BRD-K51743001-001-01-5	Broad Institute of MIT and Harvard	BRD-K51743001			OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24+/m1/s1	GZDPKZCGLLNMKC-LGVFNWMJSA-N	496.232184784							118442
BRD-K47348275	LSM-29892		54640222	InChI=1S/C18H25FN2O5S/c19-12-4-7-15(8-5-12)27(24,25)21-16-9-6-14(26-17(16)11-22)10-18(23)20-13-2-1-3-13/h4-5,7-8,13-14,16-17,21-22H,1-3,6,9-11H2,(H,20,23)/t14-,16+,17+/m0/s1	NFGCCTFMVYXSBN-USXIJHARSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCC2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K47348275	BRD-K47348275-001-01-9	Broad Institute of MIT and Harvard	BRD-K47348275			OC[C@H]1O[C@H](CC(=O)NC2CCC2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C18H25FN2O5S/c19-12-4-7-15(8-5-12)27(24,25)21-16-9-6-14(26-17(16)11-22)10-18(23)20-13-2-1-3-13/h4-5,7-8,13-14,16-17,21-22H,1-3,6,9-11H2,(H,20,23)/t14-,16+,17+/m0/s1	NFGCCTFMVYXSBN-USXIJHARSA-N	400.14682081							118443
BRD-K31616862	LSM-29893		54640220	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20-,22+/m0/s1	UESSXGKYQCVSOE-RBDMOPTHSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3CCCCC3)CC[C@@H]1NC(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K31616862	BRD-K31616862-001-01-6	Broad Institute of MIT and Harvard	BRD-K31616862			OC[C@H]1O[C@H](CCn2cc(nn2)C2CCCCC2)CC[C@@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20-,22+/m0/s1	UESSXGKYQCVSOE-RBDMOPTHSA-N	495.180395322							118444
BRD-K58835676	LSM-29894		54640203	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20-/m0/s1	OQCXBRWJDZLXCP-KNTRFNDTSA-N	C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)c2cccnc2)C=C1)c3ccccc3	BroadT	BRD-K58835676	BRD-K58835676-001-01-6	Broad Institute of MIT and Harvard	BRD-K58835676			C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)c2cccnc2)C=C1)c1ccccc1	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20-/m0/s1	OQCXBRWJDZLXCP-KNTRFNDTSA-N	395.18450631							118445
BRD-K29338816	LSM-29895		54640311	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20-,22-/m0/s1	DFXHLBQSDWHRLL-XJABCFGWSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3ccccc3F)CC[C@@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K29338816	BRD-K29338816-001-01-8	Broad Institute of MIT and Harvard	BRD-K29338816			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2ccccc2F)CC[C@@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20-,22-/m0/s1	DFXHLBQSDWHRLL-XJABCFGWSA-N	473.16299562							118446
BRD-K99764436	LSM-29896		54640150	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17+,18-/m1/s1	PYJMYSQFCOCJMQ-BPQIPLTHSA-N	CCCc1cn(CC[C@H]2CC[C@H](NS(=O)(=O)c3ccccc3Cl)[C@@H](CO)O2)nn1	BroadT	BRD-K99764436	BRD-K99764436-001-01-0	Broad Institute of MIT and Harvard	BRD-K99764436			CCCc1cn(CC[C@H]2CC[C@H](NS(=O)(=O)c3ccccc3Cl)[C@@H](CO)O2)nn1	InChI=1S/C19H27ClN4O4S/c1-2-5-14-12-24(23-21-14)11-10-15-8-9-17(18(13-25)28-15)22-29(26,27)19-7-4-3-6-16(19)20/h3-4,6-7,12,15,17-18,22,25H,2,5,8-11,13H2,1H3/t15-,17+,18-/m1/s1	PYJMYSQFCOCJMQ-BPQIPLTHSA-N	442.144153784							118447
BRD-K74881104	LSM-29897		54640317	InChI=1S/C25H26N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-8,11,18-20,23,28H,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20+,23-/m0/s1	MSTFBRZSUKBDPT-MZKRTTBSSA-N	OC[C@@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)C=C[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K74881104	BRD-K74881104-001-01-2	Broad Institute of MIT and Harvard	BRD-K74881104			OC[C@@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)C=C[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H26N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-8,11,18-20,23,28H,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20+,23-/m0/s1	MSTFBRZSUKBDPT-MZKRTTBSSA-N	450.179086572							118448
BRD-K71881549	LSM-29898		54640213	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14+,16+/m1/s1	DHOFHCIZNIPSHR-YCPHGPKFSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K71881549	BRD-K71881549-001-01-8	Broad Institute of MIT and Harvard	BRD-K71881549			OC[C@@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)C1CCC1	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14+,16+/m1/s1	DHOFHCIZNIPSHR-YCPHGPKFSA-N	362.195405352							118449
BRD-K61223323	LSM-29899		54640191	InChI=1S/C17H22FN3O4/c1-21(2)16(23)9-13-6-7-14(15(10-22)25-13)20-17(24)19-12-5-3-4-11(18)8-12/h3-8,13-15,22H,9-10H2,1-2H3,(H2,19,20,24)/t13-,14-,15-/m1/s1	LEYGMNHWBOVNLD-RBSFLKMASA-N	CN(C)C(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Nc2cccc(F)c2)C=C1	BroadT	BRD-K61223323	BRD-K61223323-001-01-7	Broad Institute of MIT and Harvard	BRD-K61223323			CN(C)C(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Nc2cccc(F)c2)C=C1	InChI=1S/C17H22FN3O4/c1-21(2)16(23)9-13-6-7-14(15(10-22)25-13)20-17(24)19-12-5-3-4-11(18)8-12/h3-8,13-15,22H,9-10H2,1-2H3,(H2,19,20,24)/t13-,14-,15-/m1/s1	LEYGMNHWBOVNLD-RBSFLKMASA-N	351.159434414							118450
BRD-K00797068	LSM-29900		54640394	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21+,24+/m1/s1	MKOAEKBYEUHALQ-GQOCTPOGSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@H](CCn3cc(nn3)c4ccccc4OC)O[C@H]2CO	BroadT	BRD-K00797068	BRD-K00797068-001-01-3	Broad Institute of MIT and Harvard	BRD-K00797068			COc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@H](CCn2cc(nn2)-c2ccccc2OC)O[C@H]1CO	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21+,24+/m1/s1	MKOAEKBYEUHALQ-GQOCTPOGSA-N	502.18860541							118451
BRD-K35030377	LSM-29901		54640406	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19-,20+/m1/s1	DSHMBJFFZMCEDJ-RLLQIKCJSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K35030377	BRD-K35030377-001-01-4	Broad Institute of MIT and Harvard	BRD-K35030377			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H26FN3O5S/c22-16-1-4-18(5-2-16)31(28,29)25-19-6-3-17(30-20(19)14-26)13-21(27)24-12-9-15-7-10-23-11-8-15/h1-2,4-5,7-8,10-11,17,19-20,25-26H,3,6,9,12-14H2,(H,24,27)/t17-,19-,20+/m1/s1	DSHMBJFFZMCEDJ-RLLQIKCJSA-N	451.157719852							118452
BRD-K15282657	LSM-29902		54640278	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17+,19+/m0/s1	BVWTUHQTVRXDSV-YQVWRLOYSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K15282657	BRD-K15282657-001-01-6	Broad Institute of MIT and Harvard	BRD-K15282657			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17+,19+/m0/s1	BVWTUHQTVRXDSV-YQVWRLOYSA-N	401.175084478							118453
BRD-K19764912	LSM-29903		54640225	InChI=1S/C18H25FN2O5S/c19-12-4-7-15(8-5-12)27(24,25)21-16-9-6-14(26-17(16)11-22)10-18(23)20-13-2-1-3-13/h4-5,7-8,13-14,16-17,21-22H,1-3,6,9-11H2,(H,20,23)/t14-,16-,17-/m0/s1	NFGCCTFMVYXSBN-XIRDDKMYSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCC2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K19764912	BRD-K19764912-001-01-0	Broad Institute of MIT and Harvard	BRD-K19764912			OC[C@@H]1O[C@H](CC(=O)NC2CCC2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C18H25FN2O5S/c19-12-4-7-15(8-5-12)27(24,25)21-16-9-6-14(26-17(16)11-22)10-18(23)20-13-2-1-3-13/h4-5,7-8,13-14,16-17,21-22H,1-3,6,9-11H2,(H,20,23)/t14-,16-,17-/m0/s1	NFGCCTFMVYXSBN-XIRDDKMYSA-N	400.14682081							118454
BRD-K53814023	LSM-29904		54640221	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20+,22-/m0/s1	UESSXGKYQCVSOE-WEYGHZABSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3CCCCC3)CC[C@H]1NC(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K53814023	BRD-K53814023-001-01-6	Broad Institute of MIT and Harvard	BRD-K53814023			OC[C@@H]1O[C@H](CCn2cc(nn2)C2CCCCC2)CC[C@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20+,22-/m0/s1	UESSXGKYQCVSOE-WEYGHZABSA-N	495.180395322							118455
BRD-K62621376	LSM-29905		54640287	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19+,20+/m1/s1	WDGFJBRIXWVRNV-HOJAQTOUSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K62621376	BRD-K62621376-001-01-7	Broad Institute of MIT and Harvard	BRD-K62621376			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19+,20+/m1/s1	WDGFJBRIXWVRNV-HOJAQTOUSA-N	439.214091876							118456
BRD-K12107412	LSM-29906		54640324	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20+,21-/m1/s1	BEKOLHWPUBERJD-JRGCBEDISA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccccc3F)O[C@@H]2CO	BroadT	BRD-K12107412	BRD-K12107412-001-01-4	Broad Institute of MIT and Harvard	BRD-K12107412			COc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20+,21-/m1/s1	BEKOLHWPUBERJD-JRGCBEDISA-N	466.157385494							118457
BRD-K56427898	LSM-29907		54640164	InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13+/m0/s1	IZNXMLLZVKASMZ-RWMBFGLXSA-N	OC[C@H]1O[C@H](CC(=O)O)C=C[C@@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K56427898	BRD-K56427898-001-01-6	Broad Institute of MIT and Harvard	BRD-K56427898			OC[C@H]1O[C@H](CC(O)=O)C=C[C@@H]1NC(=O)Nc1ccccc1	InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13+/m0/s1	IZNXMLLZVKASMZ-RWMBFGLXSA-N	306.121571696							118458
BRD-K99410476	LSM-29908		54640409	InChI=1S/C21H32ClN3O5S/c22-15-6-9-18(10-7-15)31(28,29)23-13-12-17-8-11-19(20(14-26)30-17)25-21(27)24-16-4-2-1-3-5-16/h6-7,9-10,16-17,19-20,23,26H,1-5,8,11-14H2,(H2,24,25,27)/t17-,19+,20+/m0/s1	DFLSSFAMCLDBJA-DFQSSKMNSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K99410476	BRD-K99410476-001-01-1	Broad Institute of MIT and Harvard	BRD-K99410476			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)NC1CCCCC1	InChI=1S/C21H32ClN3O5S/c22-15-6-9-18(10-7-15)31(28,29)23-13-12-17-8-11-19(20(14-26)30-17)25-21(27)24-16-4-2-1-3-5-16/h6-7,9-10,16-17,19-20,23,26H,1-5,8,11-14H2,(H2,24,25,27)/t17-,19+,20+/m0/s1	DFLSSFAMCLDBJA-DFQSSKMNSA-N	473.175119554							118459
BRD-K90686530	LSM-29909		54640396	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21-,24+/m1/s1	MKOAEKBYEUHALQ-JKHABCDFSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)c4ccccc4OC)O[C@H]2CO	BroadT	BRD-K90686530	BRD-K90686530-001-01-9	Broad Institute of MIT and Harvard	BRD-K90686530			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)-c2ccccc2OC)O[C@H]1CO	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21-,24+/m1/s1	MKOAEKBYEUHALQ-JKHABCDFSA-N	502.18860541							118460
BRD-K97257286	LSM-29910		54640410	InChI=1S/C21H32ClN3O5S/c22-15-6-9-18(10-7-15)31(28,29)23-13-12-17-8-11-19(20(14-26)30-17)25-21(27)24-16-4-2-1-3-5-16/h6-7,9-10,16-17,19-20,23,26H,1-5,8,11-14H2,(H2,24,25,27)/t17-,19+,20+/m1/s1	DFLSSFAMCLDBJA-HOJAQTOUSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K97257286	BRD-K97257286-001-01-8	Broad Institute of MIT and Harvard	BRD-K97257286			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)NC1CCCCC1	InChI=1S/C21H32ClN3O5S/c22-15-6-9-18(10-7-15)31(28,29)23-13-12-17-8-11-19(20(14-26)30-17)25-21(27)24-16-4-2-1-3-5-16/h6-7,9-10,16-17,19-20,23,26H,1-5,8,11-14H2,(H2,24,25,27)/t17-,19+,20+/m1/s1	DFLSSFAMCLDBJA-HOJAQTOUSA-N	473.175119554							118461
CHEMBL2359313	LSM-29911	SID131436519, BRD-K63982890	54640216	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20-,22+/m1/s1	UESSXGKYQCVSOE-ZNLUXHQJSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3CCCCC3)CC[C@H]1NC(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K63982890	BRD-K63982890-001-01-9	Broad Institute of MIT and Harvard	BRD-K63982890			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2CCCCC2)CC[C@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20-,22+/m1/s1	UESSXGKYQCVSOE-ZNLUXHQJSA-N	495.180395322							118462
BRD-K77109731	LSM-29912		54640114	InChI=1S/C13H24N2O3/c14-7-6-10-4-5-11(12(8-16)18-10)15-13(17)9-2-1-3-9/h9-12,16H,1-8,14H2,(H,15,17)/t10-,11+,12+/m0/s1	WTINLZZCKOEXLA-QJPTWQEYSA-N	NCC[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1	BroadT	BRD-K77109731	BRD-K77109731-001-01-6	Broad Institute of MIT and Harvard	BRD-K77109731			NCC[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1	InChI=1S/C13H24N2O3/c14-7-6-10-4-5-11(12(8-16)18-10)15-13(17)9-2-1-3-9/h9-12,16H,1-8,14H2,(H,15,17)/t10-,11+,12+/m0/s1	WTINLZZCKOEXLA-QJPTWQEYSA-N	256.178692648							118463
BRD-K84052780	LSM-29913		54640136	InChI=1S/C20H27N3O6/c1-27-15-4-2-3-14(11-15)21-20(26)22-17-6-5-16(29-18(17)13-24)12-19(25)23-7-9-28-10-8-23/h2-6,11,16-18,24H,7-10,12-13H2,1H3,(H2,21,22,26)/t16-,17+,18-/m0/s1	DEUGGSUTAOAWFI-KSZLIROESA-N	COc1cccc(NC(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCOCC3)O[C@H]2CO)c1	BroadT	BRD-K84052780	BRD-K84052780-001-01-9	Broad Institute of MIT and Harvard	BRD-K84052780			COc1cccc(NC(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCOCC3)O[C@H]2CO)c1	InChI=1S/C20H27N3O6/c1-27-15-4-2-3-14(11-15)21-20(26)22-17-6-5-16(29-18(17)13-24)12-19(25)23-7-9-28-10-8-23/h2-6,11,16-18,24H,7-10,12-13H2,1H3,(H2,21,22,26)/t16-,17+,18-/m0/s1	DEUGGSUTAOAWFI-KSZLIROESA-N	405.189985614							118464
BRD-K07614312	LSM-29914		54640257	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20+/m1/s1	CAUJNQQMPJLGLW-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K07614312	BRD-K07614312-001-01-7	Broad Institute of MIT and Harvard	BRD-K07614312			OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20+/m1/s1	CAUJNQQMPJLGLW-AQNXPRMDSA-N	430.201633584							118465
BRD-K23591737	LSM-29915		54640375	InChI=1S/C15H23N3O3/c16-6-3-12-1-2-13(14(10-19)21-12)18-15(20)9-11-4-7-17-8-5-11/h4-5,7-8,12-14,19H,1-3,6,9-10,16H2,(H,18,20)/t12-,13+,14-/m1/s1	GLKCOTROISWSTI-HZSPNIEDSA-N	NCC[C@H]1CC[C@H](NC(=O)Cc2ccncc2)[C@@H](CO)O1	BroadT	BRD-K23591737	BRD-K23591737-001-01-4	Broad Institute of MIT and Harvard	BRD-K23591737			NCC[C@H]1CC[C@H](NC(=O)Cc2ccncc2)[C@@H](CO)O1	InChI=1S/C15H23N3O3/c16-6-3-12-1-2-13(14(10-19)21-12)18-15(20)9-11-4-7-17-8-5-11/h4-5,7-8,12-14,19H,1-3,6,9-10,16H2,(H,18,20)/t12-,13+,14-/m1/s1	GLKCOTROISWSTI-HZSPNIEDSA-N	293.173941626							118466
BRD-K80761625	LSM-29916		54640186	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13-,14+/m0/s1	HFDKIVHAHGCNSH-MELADBBJSA-N	COC(=O)C[C@@H]1CC[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@@H](CO)O1	BroadT	BRD-K80761625	BRD-K80761625-001-01-8	Broad Institute of MIT and Harvard	BRD-K80761625			COC(=O)C[C@@H]1CC[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@@H](CO)O1	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13-,14+/m0/s1	HFDKIVHAHGCNSH-MELADBBJSA-N	390.140256392							118467
BRD-K29571884	LSM-29917		54640113	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16+,18-/m0/s1	OWGSILQKVGHWMO-JZXOWHBKSA-N	OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K29571884	BRD-K29571884-001-01-1	Broad Institute of MIT and Harvard	BRD-K29571884			OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16+,18-/m0/s1	OWGSILQKVGHWMO-JZXOWHBKSA-N	433.151682008							118468
BRD-K37588779	LSM-29918		54640158	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22+/m1/s1	GMABBLNRVHCWFG-SJBKTWHCSA-N	OC[C@@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)c4ccccn4	BroadT	BRD-K37588779	BRD-K37588779-001-01-3	Broad Institute of MIT and Harvard	BRD-K37588779			OC[C@@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22+/m1/s1	GMABBLNRVHCWFG-SJBKTWHCSA-N	421.211389774							118469
BRD-K76350099	LSM-29919		54640353	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19-,20-/m0/s1	VDBDKUPLXIXHLN-VDGAXYAQSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K76350099	BRD-K76350099-001-01-3	Broad Institute of MIT and Harvard	BRD-K76350099			OC[C@@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19-,20-/m0/s1	VDBDKUPLXIXHLN-VDGAXYAQSA-N	483.17811911							118470
BRD-K44512951	LSM-29920		54640327	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13+,14+/m1/s1	FMDKDGDDTIJRQT-RDBSUJKOSA-N	COC(=O)C[C@H]1CC[C@H](NC(=O)c2ccccc2)[C@H](CO)O1	BroadT	BRD-K44512951	BRD-K44512951-001-01-4	Broad Institute of MIT and Harvard	BRD-K44512951			COC(=O)C[C@H]1CC[C@H](NC(=O)c2ccccc2)[C@H](CO)O1	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13+,14+/m1/s1	FMDKDGDDTIJRQT-RDBSUJKOSA-N	307.141972782							118471
BRD-K71499752	LSM-29921		54640254	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20+/m0/s1	CAUJNQQMPJLGLW-XUVXKRRUSA-N	OC[C@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K71499752	BRD-K71499752-001-01-1	Broad Institute of MIT and Harvard	BRD-K71499752			OC[C@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19+,20+/m0/s1	CAUJNQQMPJLGLW-XUVXKRRUSA-N	430.201633584							118472
BRD-K65883179	LSM-29922		54640172	InChI=1S/C15H19NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-7,11,13-14,16-17H,8-9H2,1H3,(H,18,19)/t11-,13+,14-/m1/s1	GUDXKJZEBVMQGW-KWCYVHTRSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)O)O[C@@H]2CO	BroadT	BRD-K65883179	BRD-K65883179-001-01-9	Broad Institute of MIT and Harvard	BRD-K65883179			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@H](CC(O)=O)O[C@@H]1CO	InChI=1S/C15H19NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-7,11,13-14,16-17H,8-9H2,1H3,(H,18,19)/t11-,13+,14-/m1/s1	GUDXKJZEBVMQGW-KWCYVHTRSA-N	341.093308028							118473
BRD-K65813214	LSM-29923		54640205	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19+,20-/m1/s1	OQCXBRWJDZLXCP-XFWGSAIBSA-N	C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)c2cccnc2)C=C1)c3ccccc3	BroadT	BRD-K65813214	BRD-K65813214-001-01-3	Broad Institute of MIT and Harvard	BRD-K65813214			C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)c2cccnc2)C=C1)c1ccccc1	InChI=1S/C22H25N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-11,13,15,18-20,26H,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19+,20-/m1/s1	OQCXBRWJDZLXCP-XFWGSAIBSA-N	395.18450631							118474
BRD-K10989739	LSM-29924		54640412	InChI=1S/C21H32ClN3O5S/c22-15-6-9-18(10-7-15)31(28,29)23-13-12-17-8-11-19(20(14-26)30-17)25-21(27)24-16-4-2-1-3-5-16/h6-7,9-10,16-17,19-20,23,26H,1-5,8,11-14H2,(H2,24,25,27)/t17-,19-,20+/m1/s1	DFLSSFAMCLDBJA-RLLQIKCJSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K10989739	BRD-K10989739-001-01-3	Broad Institute of MIT and Harvard	BRD-K10989739			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)NC1CCCCC1	InChI=1S/C21H32ClN3O5S/c22-15-6-9-18(10-7-15)31(28,29)23-13-12-17-8-11-19(20(14-26)30-17)25-21(27)24-16-4-2-1-3-5-16/h6-7,9-10,16-17,19-20,23,26H,1-5,8,11-14H2,(H2,24,25,27)/t17-,19-,20+/m1/s1	DFLSSFAMCLDBJA-RLLQIKCJSA-N	473.175119554							118475
MLS003649946	LSM-29925	BRD-K95410891	53382613	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13-,14-/m1/s1	HFDKIVHAHGCNSH-MGPQQGTHSA-N	COC(=O)C[C@H]1CC[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@@H](CO)O1	BroadT	BRD-K95410891	BRD-K95410891-001-01-2	Broad Institute of MIT and Harvard	BRD-K95410891			COC(=O)C[C@H]1CC[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)[C@@H](CO)O1	InChI=1S/C17H21F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,12-14,23H,6-9H2,1H3,(H2,21,22,25)/t12-,13-,14-/m1/s1	HFDKIVHAHGCNSH-MGPQQGTHSA-N	390.140256392							118476
BRD-K98578493	LSM-29926		54640377	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17+,18+/m0/s1	DQIDKWUHVOLFRC-RCCFBDPRSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K98578493	BRD-K98578493-001-01-5	Broad Institute of MIT and Harvard	BRD-K98578493			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H33N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h6-7,15-18,24H,1-5,8-14H2,(H,21,25)(H,22,26)/t16-,17+,18+/m0/s1	DQIDKWUHVOLFRC-RCCFBDPRSA-N	395.242021186							118477
BRD-K92503225	LSM-29927		54640385	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13+,14+/m0/s1	PNFPPQXPTKVRON-BFHYXJOUSA-N	NCC[C@@H]1CC[C@@H](NC(=O)Nc2ccc(F)cc2)[C@@H](CO)O1	BroadT	BRD-K92503225	BRD-K92503225-001-01-4	Broad Institute of MIT and Harvard	BRD-K92503225			NCC[C@@H]1CC[C@@H](NC(=O)Nc2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C15H22FN3O3/c16-10-1-3-11(4-2-10)18-15(21)19-13-6-5-12(7-8-17)22-14(13)9-20/h1-4,12-14,20H,5-9,17H2,(H2,18,19,21)/t12-,13+,14+/m0/s1	PNFPPQXPTKVRON-BFHYXJOUSA-N	311.164519794							118478
BRD-K22293608	LSM-29928		54640165	InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13+/m1/s1	IZNXMLLZVKASMZ-UPJWGTAASA-N	OC[C@@H]1O[C@@H](CC(=O)O)C=C[C@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K22293608	BRD-K22293608-001-01-4	Broad Institute of MIT and Harvard	BRD-K22293608			OC[C@@H]1O[C@@H](CC(O)=O)C=C[C@H]1NC(=O)Nc1ccccc1	InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13+/m1/s1	IZNXMLLZVKASMZ-UPJWGTAASA-N	306.121571696							118479
BRD-K78195641	LSM-29929		54640154	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22+/m0/s1	GMABBLNRVHCWFG-TUNNFDKTSA-N	OC[C@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)c4ccccn4	BroadT	BRD-K78195641	BRD-K78195641-001-01-3	Broad Institute of MIT and Harvard	BRD-K78195641			OC[C@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)21-8-4-5-12-24-21)10-9-19(31-22)11-13-28-15-18(26-27-28)14-17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22+/m0/s1	GMABBLNRVHCWFG-TUNNFDKTSA-N	421.211389774							118480
BRD-K60190533	LSM-29930		54640355	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19+,20-/m0/s1	VDBDKUPLXIXHLN-DBVUQKKJSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K60190533	BRD-K60190533-001-01-5	Broad Institute of MIT and Harvard	BRD-K60190533			OC[C@@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19+,20-/m0/s1	VDBDKUPLXIXHLN-DBVUQKKJSA-N	483.17811911							118481
BRD-K29685390	LSM-29931		54640330	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13-,14+/m1/s1	FMDKDGDDTIJRQT-MCIONIFRSA-N	COC(=O)C[C@H]1CC[C@@H](NC(=O)c2ccccc2)[C@H](CO)O1	BroadT	BRD-K29685390	BRD-K29685390-001-01-6	Broad Institute of MIT and Harvard	BRD-K29685390			COC(=O)C[C@H]1CC[C@@H](NC(=O)c2ccccc2)[C@H](CO)O1	InChI=1S/C16H21NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-6,12-14,18H,7-10H2,1H3,(H,17,20)/t12-,13-,14+/m1/s1	FMDKDGDDTIJRQT-MCIONIFRSA-N	307.141972782							118482
BRD-K47980183	LSM-29932		54640269	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15+,16-/m0/s1	VMTZMCYUUHONMK-XHSDSOJGSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCCCC3)O[C@H]2CO	BroadT	BRD-K47980183	BRD-K47980183-001-01-0	Broad Institute of MIT and Harvard	BRD-K47980183			Cc1noc(C)c1NC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15+,16-/m0/s1	VMTZMCYUUHONMK-XHSDSOJGSA-N	392.205970036							118483
BRD-K06296167	LSM-29933		54640176	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19-,20+/m1/s1	RBLWVJQIFCDULU-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K06296167	BRD-K06296167-001-01-0	Broad Institute of MIT and Harvard	BRD-K06296167			OC[C@@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19-,20+/m1/s1	RBLWVJQIFCDULU-AQNXPRMDSA-N	425.288971378							118484
BRD-K68608492	LSM-29934		54640266	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15-,16+/m0/s1	VMTZMCYUUHONMK-HRCADAONSA-N	Cc1onc(C)c1NC(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCCCC3)O[C@@H]2CO	BroadT	BRD-K68608492	BRD-K68608492-001-01-7	Broad Institute of MIT and Harvard	BRD-K68608492			Cc1noc(C)c1NC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15-,16+/m0/s1	VMTZMCYUUHONMK-HRCADAONSA-N	392.205970036							118485
BRD-K24883912	LSM-29935		54640167	InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12+,13-/m0/s1	IZNXMLLZVKASMZ-XQQFMLRXSA-N	OC[C@@H]1O[C@H](CC(=O)O)C=C[C@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K24883912	BRD-K24883912-001-01-1	Broad Institute of MIT and Harvard	BRD-K24883912			OC[C@@H]1O[C@H](CC(O)=O)C=C[C@H]1NC(=O)Nc1ccccc1	InChI=1S/C15H18N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-7,11-13,18H,8-9H2,(H,19,20)(H2,16,17,21)/t11-,12+,13-/m0/s1	IZNXMLLZVKASMZ-XQQFMLRXSA-N	306.121571696							118486
BRD-K71970681	LSM-29936		54640264	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15-,16-/m1/s1	VMTZMCYUUHONMK-BZUAXINKSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCCCC3)O[C@@H]2CO	BroadT	BRD-K71970681	BRD-K71970681-001-01-7	Broad Institute of MIT and Harvard	BRD-K71970681			Cc1noc(C)c1NC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C19H28N4O5/c1-12-18(13(2)28-22-12)21-19(26)20-15-7-6-14(27-16(15)11-24)10-17(25)23-8-4-3-5-9-23/h6-7,14-16,24H,3-5,8-11H2,1-2H3,(H2,20,21,26)/t14-,15-,16-/m1/s1	VMTZMCYUUHONMK-BZUAXINKSA-N	392.205970036							118487
BRD-K64221857	LSM-29937		54640180	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19+,20-/m1/s1	RBLWVJQIFCDULU-HSALFYBXSA-N	OC[C@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K64221857	BRD-K64221857-001-01-2	Broad Institute of MIT and Harvard	BRD-K64221857			OC[C@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19+,20-/m1/s1	RBLWVJQIFCDULU-HSALFYBXSA-N	425.288971378							118488
MLS003650079	LSM-29938	BRD-K68953461, SID125305374	53382730	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20+,22-/m1/s1	DFXHLBQSDWHRLL-PIPMEXSNSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3ccccc3F)CC[C@@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K68953461	BRD-K68953461-001-01-4	Broad Institute of MIT and Harvard	BRD-K68953461			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2F)CC[C@@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C23H25ClFN5O3/c24-15-5-7-16(8-6-15)26-23(32)27-20-10-9-17(33-22(20)14-31)11-12-30-13-21(28-29-30)18-3-1-2-4-19(18)25/h1-8,13,17,20,22,31H,9-12,14H2,(H2,26,27,32)/t17-,20+,22-/m1/s1	DFXHLBQSDWHRLL-PIPMEXSNSA-N	473.16299562							118489
BRD-K14706855	LSM-29939		54640356	InChI=1S/C20H21F2N5O4/c21-12-1-3-15(22)17(7-12)27-20(30)26-16-4-2-14(31-18(16)10-28)8-19(29)24-9-13-5-6-23-11-25-13/h1-7,11,14,16,18,28H,8-10H2,(H,24,29)(H2,26,27,30)/t14-,16+,18+/m0/s1	MOYKFZGAGJCWIL-YXJHDRRASA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K14706855	BRD-K14706855-001-01-5	Broad Institute of MIT and Harvard	BRD-K14706855			OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H21F2N5O4/c21-12-1-3-15(22)17(7-12)27-20(30)26-16-4-2-14(31-18(16)10-28)8-19(29)24-9-13-5-6-23-11-25-13/h1-7,11,14,16,18,28H,8-10H2,(H,24,29)(H2,26,27,30)/t14-,16+,18+/m0/s1	MOYKFZGAGJCWIL-YXJHDRRASA-N	433.156160602							118490
BRD-K41492504	LSM-29940		54640224	InChI=1S/C18H25FN2O5S/c19-12-4-7-15(8-5-12)27(24,25)21-16-9-6-14(26-17(16)11-22)10-18(23)20-13-2-1-3-13/h4-5,7-8,13-14,16-17,21-22H,1-3,6,9-11H2,(H,20,23)/t14-,16-,17-/m1/s1	NFGCCTFMVYXSBN-DJIMGWMZSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCC2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K41492504	BRD-K41492504-001-01-4	Broad Institute of MIT and Harvard	BRD-K41492504			OC[C@H]1O[C@@H](CC(=O)NC2CCC2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C18H25FN2O5S/c19-12-4-7-15(8-5-12)27(24,25)21-16-9-6-14(26-17(16)11-22)10-18(23)20-13-2-1-3-13/h4-5,7-8,13-14,16-17,21-22H,1-3,6,9-11H2,(H,20,23)/t14-,16-,17-/m1/s1	NFGCCTFMVYXSBN-DJIMGWMZSA-N	400.14682081							118491
BRD-K11666748	LSM-29941		54640171	InChI=1S/C15H19NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-7,11,13-14,16-17H,8-9H2,1H3,(H,18,19)/t11-,13-,14+/m1/s1	GUDXKJZEBVMQGW-BNOWGMLFSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)O)O[C@H]2CO	BroadT	BRD-K11666748	BRD-K11666748-001-01-5	Broad Institute of MIT and Harvard	BRD-K11666748			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(O)=O)O[C@H]1CO	InChI=1S/C15H19NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-7,11,13-14,16-17H,8-9H2,1H3,(H,18,19)/t11-,13-,14+/m1/s1	GUDXKJZEBVMQGW-BNOWGMLFSA-N	341.093308028							118492
BRD-K89376872	LSM-29942		54640411	InChI=1S/C21H32ClN3O5S/c22-15-6-9-18(10-7-15)31(28,29)23-13-12-17-8-11-19(20(14-26)30-17)25-21(27)24-16-4-2-1-3-5-16/h6-7,9-10,16-17,19-20,23,26H,1-5,8,11-14H2,(H2,24,25,27)/t17-,19-,20+/m0/s1	DFLSSFAMCLDBJA-YSIASYRMSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)NC3CCCCC3	BroadT	BRD-K89376872	BRD-K89376872-001-01-6	Broad Institute of MIT and Harvard	BRD-K89376872			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)NC1CCCCC1	InChI=1S/C21H32ClN3O5S/c22-15-6-9-18(10-7-15)31(28,29)23-13-12-17-8-11-19(20(14-26)30-17)25-21(27)24-16-4-2-1-3-5-16/h6-7,9-10,16-17,19-20,23,26H,1-5,8,11-14H2,(H2,24,25,27)/t17-,19-,20+/m0/s1	DFLSSFAMCLDBJA-YSIASYRMSA-N	473.175119554							118493
BRD-K23404017	LSM-29943		54640133	InChI=1S/C20H27N3O6/c1-27-15-4-2-3-14(11-15)21-20(26)22-17-6-5-16(29-18(17)13-24)12-19(25)23-7-9-28-10-8-23/h2-6,11,16-18,24H,7-10,12-13H2,1H3,(H2,21,22,26)/t16-,17-,18-/m0/s1	DEUGGSUTAOAWFI-BZSNNMDCSA-N	COc1cccc(NC(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCOCC3)O[C@H]2CO)c1	BroadT	BRD-K23404017	BRD-K23404017-001-01-1	Broad Institute of MIT and Harvard	BRD-K23404017			COc1cccc(NC(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCOCC3)O[C@H]2CO)c1	InChI=1S/C20H27N3O6/c1-27-15-4-2-3-14(11-15)21-20(26)22-17-6-5-16(29-18(17)13-24)12-19(25)23-7-9-28-10-8-23/h2-6,11,16-18,24H,7-10,12-13H2,1H3,(H2,21,22,26)/t16-,17-,18-/m0/s1	DEUGGSUTAOAWFI-BZSNNMDCSA-N	405.189985614							118494
BRD-K76609014	LSM-29944		54640115	InChI=1S/C13H24N2O3/c14-7-6-10-4-5-11(12(8-16)18-10)15-13(17)9-2-1-3-9/h9-12,16H,1-8,14H2,(H,15,17)/t10-,11+,12-/m1/s1	WTINLZZCKOEXLA-GRYCIOLGSA-N	NCC[C@H]1CC[C@H](NC(=O)C2CCC2)[C@@H](CO)O1	BroadT	BRD-K76609014	BRD-K76609014-001-01-4	Broad Institute of MIT and Harvard	BRD-K76609014			NCC[C@H]1CC[C@H](NC(=O)C2CCC2)[C@@H](CO)O1	InChI=1S/C13H24N2O3/c14-7-6-10-4-5-11(12(8-16)18-10)15-13(17)9-2-1-3-9/h9-12,16H,1-8,14H2,(H,15,17)/t10-,11+,12-/m1/s1	WTINLZZCKOEXLA-GRYCIOLGSA-N	256.178692648							118495
BRD-K40548004	LSM-29945		54640354	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19-,20+/m0/s1	VDBDKUPLXIXHLN-FFZOFVMBSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K40548004	BRD-K40548004-001-01-9	Broad Institute of MIT and Harvard	BRD-K40548004			OC[C@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19-,20+/m0/s1	VDBDKUPLXIXHLN-FFZOFVMBSA-N	483.17811911							118496
BRD-K54898824	LSM-29946		54640369	InChI=1S/C21H29N5O5/c1-13-20(14(2)31-26-13)25-21(29)23-9-7-16-5-6-17(18(12-27)30-16)24-19(28)10-15-4-3-8-22-11-15/h3-4,8,11,16-18,27H,5-7,9-10,12H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18-/m1/s1	LEDFMEUSPBTDMF-FGTMMUONSA-N	Cc1onc(C)c1NC(=O)NCC[C@H]2CC[C@H](NC(=O)Cc3cccnc3)[C@@H](CO)O2	BroadT	BRD-K54898824	BRD-K54898824-001-01-9	Broad Institute of MIT and Harvard	BRD-K54898824			Cc1noc(C)c1NC(=O)NCC[C@H]1CC[C@H](NC(=O)Cc2cccnc2)[C@@H](CO)O1	InChI=1S/C21H29N5O5/c1-13-20(14(2)31-26-13)25-21(29)23-9-7-16-5-6-17(18(12-27)30-16)24-19(28)10-15-4-3-8-22-11-15/h3-4,8,11,16-18,27H,5-7,9-10,12H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18-/m1/s1	LEDFMEUSPBTDMF-FGTMMUONSA-N	431.216869078							118497
BRD-K69960043	LSM-29947		54640395	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21-,24+/m0/s1	MKOAEKBYEUHALQ-CODAWKSHSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)c4ccccc4OC)O[C@@H]2CO	BroadT	BRD-K69960043	BRD-K69960043-001-01-5	Broad Institute of MIT and Harvard	BRD-K69960043			COc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)-c2ccccc2OC)O[C@@H]1CO	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21-,24+/m0/s1	MKOAEKBYEUHALQ-CODAWKSHSA-N	502.18860541							118498
BRD-K56344669-001-01-0	LSM-29948	BRD-K56344669	54640237	InChI=1S/C23H34FN3O4/c24-18-6-4-17(5-7-18)23(30)26-20-9-8-19(31-21(20)16-28)10-12-25-22(29)11-15-27-13-2-1-3-14-27/h4-7,19-21,28H,1-3,8-16H2,(H,25,29)(H,26,30)/t19-,20+,21-/m0/s1	WNYASTHCVUIKOZ-HBMCJLEFSA-N	OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K56344669	BRD-K56344669-001-01-0	Broad Institute of MIT and Harvard	BRD-K56344669			OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C23H34FN3O4/c24-18-6-4-17(5-7-18)23(30)26-20-9-8-19(31-21(20)16-28)10-12-25-22(29)11-15-27-13-2-1-3-14-27/h4-7,19-21,28H,1-3,8-16H2,(H,25,29)(H,26,30)/t19-,20+,21-/m0/s1	WNYASTHCVUIKOZ-HBMCJLEFSA-N	435.253334798							118499
BRD-K01045229	LSM-29949		54640400	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21+,24-/m0/s1	MKOAEKBYEUHALQ-UQJUWTFNSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)c4ccccc4OC)O[C@H]2CO	BroadT	BRD-K01045229	BRD-K01045229-001-01-2	Broad Institute of MIT and Harvard	BRD-K01045229			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2ccccc2OC)O[C@H]1CO	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21+,24-/m0/s1	MKOAEKBYEUHALQ-UQJUWTFNSA-N	502.18860541							118500
BRD-K38615567	LSM-29950		54640293	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19+,20-/m0/s1	WDGFJBRIXWVRNV-SXLOBPIMSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)CC[C@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K38615567	BRD-K38615567-001-01-9	Broad Institute of MIT and Harvard	BRD-K38615567			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)CC[C@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H33N3O5S/c25-16-20-19(23-30(27,28)18-7-3-1-4-8-18)10-9-17(29-20)15-21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-8,17,19-20,23,25H,2,5-6,9-16H2,(H,22,26)/t17-,19+,20-/m0/s1	WDGFJBRIXWVRNV-SXLOBPIMSA-N	439.214091876							118501
BRD-K22510845	LSM-29951		54640190	InChI=1S/C17H22FN3O4/c1-21(2)16(23)9-13-6-7-14(15(10-22)25-13)20-17(24)19-12-5-3-4-11(18)8-12/h3-8,13-15,22H,9-10H2,1-2H3,(H2,19,20,24)/t13-,14+,15+/m1/s1	LEYGMNHWBOVNLD-ILXRZTDVSA-N	CN(C)C(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2cccc(F)c2)C=C1	BroadT	BRD-K22510845	BRD-K22510845-001-01-4	Broad Institute of MIT and Harvard	BRD-K22510845			CN(C)C(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2cccc(F)c2)C=C1	InChI=1S/C17H22FN3O4/c1-21(2)16(23)9-13-6-7-14(15(10-22)25-13)20-17(24)19-12-5-3-4-11(18)8-12/h3-8,13-15,22H,9-10H2,1-2H3,(H2,19,20,24)/t13-,14+,15+/m1/s1	LEYGMNHWBOVNLD-ILXRZTDVSA-N	351.159434414							118502
BRD-K16919185	LSM-29952		54640397	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21+,24-/m1/s1	MKOAEKBYEUHALQ-QATBIIFWSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@H](CCn3cc(nn3)c4ccccc4OC)O[C@@H]2CO	BroadT	BRD-K16919185	BRD-K16919185-001-01-3	Broad Institute of MIT and Harvard	BRD-K16919185			COc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@H](CCn2cc(nn2)-c2ccccc2OC)O[C@@H]1CO	InChI=1S/C24H30N4O6S/c1-32-18-6-5-7-19(14-18)35(30,31)26-21-11-10-17(34-24(21)16-29)12-13-28-15-22(25-27-28)20-8-3-4-9-23(20)33-2/h3-9,14-15,17,21,24,26,29H,10-13,16H2,1-2H3/t17-,21+,24-/m1/s1	MKOAEKBYEUHALQ-QATBIIFWSA-N	502.18860541							118503
BRD-K99277076	LSM-29953		54640175	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19+,20+/m1/s1	RBLWVJQIFCDULU-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K99277076	BRD-K99277076-001-01-8	Broad Institute of MIT and Harvard	BRD-K99277076			OC[C@@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19+,20+/m1/s1	RBLWVJQIFCDULU-AABGKKOBSA-N	425.288971378							118504
BRD-K82002014	LSM-29954		54640425	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16-,18-/m1/s1	OWGSILQKVGHWMO-JFIYKMOQSA-N	OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K82002014	BRD-K82002014-001-01-4	Broad Institute of MIT and Harvard	BRD-K82002014			OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16-,18-/m1/s1	OWGSILQKVGHWMO-JFIYKMOQSA-N	433.151682008							118505
BRD-K24554824	LSM-29955		54640294	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16+/m0/s1	JWFDGUDYVUNEGC-ARFHVFGLSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)CC[C@H]1NC(=O)C3CC3	BroadT	BRD-K24554824	BRD-K24554824-001-01-5	Broad Institute of MIT and Harvard	BRD-K24554824			OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)CC[C@H]1NC(=O)C1CC1	InChI=1S/C18H25N3O4/c22-11-16-15(21-18(24)13-1-2-13)4-3-14(25-16)9-17(23)20-10-12-5-7-19-8-6-12/h5-8,13-16,22H,1-4,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16+/m0/s1	JWFDGUDYVUNEGC-ARFHVFGLSA-N	347.18450631							118506
BRD-K82460510	LSM-29956		54640214	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14-,16+/m1/s1	DHOFHCIZNIPSHR-FMKPAKJESA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)C3CCC3	BroadT	BRD-K82460510	BRD-K82460510-001-01-3	Broad Institute of MIT and Harvard	BRD-K82460510			OC[C@@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)C1CCC1	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14-,16+/m1/s1	DHOFHCIZNIPSHR-FMKPAKJESA-N	362.195405352							118507
BRD-K63058274	LSM-29957		54640251	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17-,18+/m1/s1	KSBPLIKBKJINFF-NXHRZFHOSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@H]1NS(=O)(=O)c3cccc(F)c3	BroadT	BRD-K63058274	BRD-K63058274-001-01-4	Broad Institute of MIT and Harvard	BRD-K63058274			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C19H27FN2O5S/c20-14-5-4-6-16(11-14)28(25,26)21-17-8-7-15(27-18(17)13-23)12-19(24)22-9-2-1-3-10-22/h4-6,11,15,17-18,21,23H,1-3,7-10,12-13H2/t15-,17-,18+/m1/s1	KSBPLIKBKJINFF-NXHRZFHOSA-N	414.162470874							118508
BRD-K47338154	LSM-29958		54640130	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9-,10+/m1/s1	YHTHTGTWYCQHDQ-BBBLOLIVSA-N	CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)O)O[C@H]1CO	BroadT	BRD-K47338154	BRD-K47338154-001-01-6	Broad Institute of MIT and Harvard	BRD-K47338154			CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(O)=O)O[C@H]1CO	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9-,10+/m1/s1	YHTHTGTWYCQHDQ-BBBLOLIVSA-N	272.13722176							118509
BRD-K16093370	LSM-29959		54640423	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16+,18+/m0/s1	OWGSILQKVGHWMO-LZLYRXPVSA-N	OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K16093370	BRD-K16093370-001-01-2	Broad Institute of MIT and Harvard	BRD-K16093370			OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16+,18+/m0/s1	OWGSILQKVGHWMO-LZLYRXPVSA-N	433.151682008							118510
BRD-K45343543	LSM-29960		54640271	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19+,21+/m1/s1	GELVUGAWQDMXAC-PBEJRMEISA-N	Cc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@H](CCNC(=O)Nc3cc(F)ccc3F)O[C@H]2CO	BroadT	BRD-K45343543	BRD-K45343543-001-01-8	Broad Institute of MIT and Harvard	BRD-K45343543			Cc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@H](CCNC(=O)Nc2cc(F)ccc2F)O[C@H]1CO	InChI=1S/C22H27F2N3O5S/c1-14-3-2-4-17(11-14)33(30,31)27-19-8-6-16(32-21(19)13-28)9-10-25-22(29)26-20-12-15(23)5-7-18(20)24/h2-5,7,11-12,16,19,21,27-28H,6,8-10,13H2,1H3,(H2,25,26,29)/t16-,19+,21+/m1/s1	GELVUGAWQDMXAC-PBEJRMEISA-N	483.163948084							118511
BRD-K39859838	LSM-29961		54640132	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9+,10-/m0/s1	YHTHTGTWYCQHDQ-AEJSXWLSSA-N	CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)O)O[C@H]1CO	BroadT	BRD-K39859838	BRD-K39859838-001-01-5	Broad Institute of MIT and Harvard	BRD-K39859838			CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(O)=O)O[C@H]1CO	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9+,10-/m0/s1	YHTHTGTWYCQHDQ-AEJSXWLSSA-N	272.13722176							118512
BRD-K20586104	LSM-29962		54640422	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24-/m0/s1	GZDPKZCGLLNMKC-IMSXRSKXSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K20586104	BRD-K20586104-001-01-2	Broad Institute of MIT and Harvard	BRD-K20586104			OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H32N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-6,9,14,20-21,24,31H,7-8,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24-/m0/s1	GZDPKZCGLLNMKC-IMSXRSKXSA-N	496.232184784							118513
BRD-K73839552	LSM-29963		54640128	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9-,10-/m1/s1	YHTHTGTWYCQHDQ-OPRDCNLKSA-N	CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)O)O[C@@H]1CO	BroadT	BRD-K73839552	BRD-K73839552-001-01-8	Broad Institute of MIT and Harvard	BRD-K73839552			CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(O)=O)O[C@@H]1CO	InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9-,10-/m1/s1	YHTHTGTWYCQHDQ-OPRDCNLKSA-N	272.13722176							118514
BRD-K11143221	LSM-29964		54640179	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19-,20+/m0/s1	RBLWVJQIFCDULU-SLFFLAALSA-N	OC[C@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K11143221	BRD-K11143221-001-01-1	Broad Institute of MIT and Harvard	BRD-K11143221			OC[C@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C22H39N3O5/c26-16-20-19(24-22(28)17-8-14-29-15-9-17)5-4-18(30-20)6-10-23-21(27)7-13-25-11-2-1-3-12-25/h17-20,26H,1-16H2,(H,23,27)(H,24,28)/t18-,19-,20+/m0/s1	RBLWVJQIFCDULU-SLFFLAALSA-N	425.288971378							118515
BRD-K97263385	LSM-29965		54640280	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17-,19-/m1/s1	BVWTUHQTVRXDSV-ZHALLVOQSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K97263385	BRD-K97263385-001-01-6	Broad Institute of MIT and Harvard	BRD-K97263385			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C21H24FN3O4/c22-15-5-3-4-14(10-15)12-24-20(27)11-16-7-8-17(19(13-26)29-16)25-21(28)18-6-1-2-9-23-18/h1-6,9-10,16-17,19,26H,7-8,11-13H2,(H,24,27)(H,25,28)/t16-,17-,19-/m1/s1	BVWTUHQTVRXDSV-ZHALLVOQSA-N	401.175084478							118516
BRD-K37120019	LSM-29966		54640122	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22-,23+/m0/s1	PZEUIISKRRGKSB-ACIOBRDBSA-N	OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)CC[C@@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K37120019	BRD-K37120019-001-01-5	Broad Institute of MIT and Harvard	BRD-K37120019			OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H30FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-7,9-10,20,22-23,26,29H,8,11-17H2/t20-,22-,23+/m0/s1	PZEUIISKRRGKSB-ACIOBRDBSA-N	491.18901998							118517
BRD-K60444040	LSM-29967		54640241	InChI=1S/C21H30ClN3O5/c22-15-2-1-3-16(12-15)24-21(28)25-18-5-4-17(30-19(18)13-26)6-9-23-20(27)14-7-10-29-11-8-14/h1-3,12,14,17-19,26H,4-11,13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19+/m1/s1	PBAPATWUXUNVNP-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)Nc3cccc(Cl)c3	BroadT	BRD-K60444040	BRD-K60444040-001-01-2	Broad Institute of MIT and Harvard	BRD-K60444040			OC[C@@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C21H30ClN3O5/c22-15-2-1-3-16(12-15)24-21(28)25-18-5-4-17(30-19(18)13-26)6-9-23-20(27)14-7-10-29-11-8-14/h1-3,12,14,17-19,26H,4-11,13H2,(H,23,27)(H2,24,25,28)/t17-,18-,19+/m1/s1	PBAPATWUXUNVNP-QRVBRYPASA-N	439.1873988							118518
BRD-K19930413	LSM-29968		54640350	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19-,20+/m1/s1	VDBDKUPLXIXHLN-AHRSYUTCSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K19930413	BRD-K19930413-001-01-1	Broad Institute of MIT and Harvard	BRD-K19930413			OC[C@@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H25F4N3O4/c24-18-4-2-1-3-17(18)21(32)28-12-11-16-9-10-19(20(13-31)34-16)30-22(33)29-15-7-5-14(6-8-15)23(25,26)27/h1-8,16,19-20,31H,9-13H2,(H,28,32)(H2,29,30,33)/t16-,19-,20+/m1/s1	VDBDKUPLXIXHLN-AHRSYUTCSA-N	483.17811911							118519
BRD-K29379705	LSM-29969		54640319	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20+,21+/m0/s1	BEKOLHWPUBERJD-IOMROCGXSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccccc3F)O[C@@H]2CO	BroadT	BRD-K29379705	BRD-K29379705-001-01-6	Broad Institute of MIT and Harvard	BRD-K29379705			COc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-16-6-9-18(10-7-16)32(28,29)25-20-11-8-17(31-21(20)14-26)12-22(27)24-13-15-4-2-3-5-19(15)23/h2-7,9-10,17,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t17-,20+,21+/m0/s1	BEKOLHWPUBERJD-IOMROCGXSA-N	466.157385494							118520
BRD-K33805195	LSM-29970		54639699	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20-/m1/s1	VZQKOZAJNGTVKC-RSPOEFSDSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K33805195	BRD-K33805195-001-01-1	Broad Institute of MIT and Harvard	BRD-K33805195			C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20-/m1/s1	VZQKOZAJNGTVKC-RSPOEFSDSA-N	419.242021186							118521
MLS003650000	LSM-29971	BRD-K96101240, SID125305307	53382663	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22+,23+/m0/s1	NCDVBILORYBSFZ-MDNUFGMLSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2CO	BroadT	BRD-K96101240	BRD-K96101240-001-01-4	Broad Institute of MIT and Harvard	BRD-K96101240			COc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCc3ccccc3C2)O[C@@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22+,23+/m0/s1	NCDVBILORYBSFZ-MDNUFGMLSA-N	472.166807326							118522
BRD-K65752097	LSM-29972		54639575	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18+,19+/m1/s1	DCOUIHVSHDCYLI-NEWSRXKRSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K65752097	BRD-K65752097-001-01-5	Broad Institute of MIT and Harvard	BRD-K65752097			OC[C@@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18+,19+/m1/s1	DCOUIHVSHDCYLI-NEWSRXKRSA-N	454.137398978							118523
BRD-K21479004	LSM-29973		54639653	InChI=1S/C16H25ClN2O6S2/c1-2-26(21,22)18-9-8-13-6-7-15(16(11-20)25-13)19-27(23,24)14-5-3-4-12(17)10-14/h3-5,10,13,15-16,18-20H,2,6-9,11H2,1H3/t13-,15+,16-/m0/s1	PCAWZXQDZTWTAN-IMJJTQAJSA-N	CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(Cl)c2)[C@H](CO)O1	BroadT	BRD-K21479004	BRD-K21479004-001-01-0	Broad Institute of MIT and Harvard	BRD-K21479004			CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(Cl)c2)[C@H](CO)O1	InChI=1S/C16H25ClN2O6S2/c1-2-26(21,22)18-9-8-13-6-7-15(16(11-20)25-13)19-27(23,24)14-5-3-4-12(17)10-14/h3-5,10,13,15-16,18-20H,2,6-9,11H2,1H3/t13-,15+,16-/m0/s1	PCAWZXQDZTWTAN-IMJJTQAJSA-N	440.08425563							118524
BRD-K46298074	LSM-29974		54639549	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17+,21-/m0/s1	KQJSIDVYPJWNIL-XPIZARPCSA-N	OC[C@@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K46298074	BRD-K46298074-001-01-0	Broad Institute of MIT and Harvard	BRD-K46298074			OC[C@@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17+,21-/m0/s1	KQJSIDVYPJWNIL-XPIZARPCSA-N	477.17114195							118525
BRD-K31526203	LSM-29975		54639753	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15-,16+/m1/s1	FOYMHNRGVNUWHD-OAGGEKHMSA-N	CCC(=O)N[C@@H]1CC[C@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	BroadT	BRD-K31526203	BRD-K31526203-001-01-5	Broad Institute of MIT and Harvard	BRD-K31526203			CCC(=O)N[C@@H]1CC[C@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15-,16+/m1/s1	FOYMHNRGVNUWHD-OAGGEKHMSA-N	355.247106566							118526
BRD-K80073743	LSM-29976		54639505	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20-,21+/m1/s1	GOYHAEMMGZTJNJ-NRSPTQNISA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K80073743	BRD-K80073743-001-01-5	Broad Institute of MIT and Harvard	BRD-K80073743			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20-,21+/m1/s1	GOYHAEMMGZTJNJ-NRSPTQNISA-N	453.22974194							118527
BRD-K59960811	LSM-29977		54639643	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20-,22+/m0/s1	KDMIEVSCRLGCNO-JAXLGGSGSA-N	Cc1ccccc1S(=O)(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)c4ccc(F)cc4)O[C@@H]2CO	BroadT	BRD-K59960811	BRD-K59960811-001-01-7	Broad Institute of MIT and Harvard	BRD-K59960811			Cc1ccccc1S(=O)(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20-,22+/m0/s1	KDMIEVSCRLGCNO-JAXLGGSGSA-N	474.173704274							118528
BRD-K90806964	LSM-29978		54639564	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16+,17-/m1/s1	LHRABQACLPZHAR-IXDOHACOSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K90806964	BRD-K90806964-001-01-8	Broad Institute of MIT and Harvard	BRD-K90806964			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16+,17-/m1/s1	LHRABQACLPZHAR-IXDOHACOSA-N	379.190734542							118529
BRD-K93774122	LSM-29979		54639587	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20+,21-/m1/s1	TXCGFGBWYOSXMX-QHAWAJNXSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)CC[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K93774122	BRD-K93774122-001-01-4	Broad Institute of MIT and Harvard	BRD-K93774122			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20+,21-/m1/s1	TXCGFGBWYOSXMX-QHAWAJNXSA-N	414.195485564							118530
BRD-K25573760	LSM-29980		54639507	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20-,21-/m0/s1	GOYHAEMMGZTJNJ-JBACZVJFSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K25573760	BRD-K25573760-001-01-0	Broad Institute of MIT and Harvard	BRD-K25573760			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20-,21-/m0/s1	GOYHAEMMGZTJNJ-JBACZVJFSA-N	453.22974194							118531
BRD-K55679243	LSM-29981		54639780	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18+,22+/m0/s1	RAMPQQLLROWEJQ-AQOAWAETSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CCNC(=O)c3ccc4OCOc4c3)O[C@@H]2CO	BroadT	BRD-K55679243	BRD-K55679243-001-01-5	Broad Institute of MIT and Harvard	BRD-K55679243			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CCNC(=O)c2ccc3OCOc3c2)O[C@@H]1CO	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18+,22+/m0/s1	RAMPQQLLROWEJQ-AQOAWAETSA-N	471.200550298							118532
BRD-K04116560	LSM-29982		54639667	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19+,21+/m1/s1	USSZBVMKFITLQI-PBEJRMEISA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3cccnc3)CC[C@@H]1NC(=O)c4ccccc4F	BroadT	BRD-K04116560	BRD-K04116560-001-01-5	Broad Institute of MIT and Harvard	BRD-K04116560			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2cccnc2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19+,21+/m1/s1	USSZBVMKFITLQI-PBEJRMEISA-N	425.186317878							118533
BRD-K20009653	LSM-29983		54639783	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18-,22+/m1/s1	RAMPQQLLROWEJQ-CDMIOBSGSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CCNC(=O)c3ccc4OCOc4c3)O[C@H]2CO	BroadT	BRD-K20009653	BRD-K20009653-001-01-0	Broad Institute of MIT and Harvard	BRD-K20009653			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CCNC(=O)c2ccc3OCOc3c2)O[C@H]1CO	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18-,22+/m1/s1	RAMPQQLLROWEJQ-CDMIOBSGSA-N	471.200550298							118534
BRD-K51196703	LSM-29984		54639565	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16+,17-/m0/s1	LHRABQACLPZHAR-BBWFWOEESA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K51196703	BRD-K51196703-001-01-7	Broad Institute of MIT and Harvard	BRD-K51196703			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16+,17-/m0/s1	LHRABQACLPZHAR-BBWFWOEESA-N	379.190734542							118535
MLS003649979	LSM-29985	SID125305286, BRD-K50788885	53382642	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25+,26-/m1/s1	CHMWYEVRTWMFCL-ZSQFBXSQSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)Nc4ccccc4F	BroadT	BRD-K50788885	BRD-K50788885-001-01-2	Broad Institute of MIT and Harvard	BRD-K50788885			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25+,26-/m1/s1	CHMWYEVRTWMFCL-ZSQFBXSQSA-N	489.206384606							118536
BRD-K64571715	LSM-29986		54639655	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18+,20+/m1/s1	VAIOXDFGBLKFCW-HBFSDRIKSA-N	COc1ccccc1S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NCc3cc(F)cc(F)c3)O[C@H]2CO	BroadT	BRD-K64571715	BRD-K64571715-001-01-2	Broad Institute of MIT and Harvard	BRD-K64571715			COc1ccccc1S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@H]1CO	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18+,20+/m1/s1	VAIOXDFGBLKFCW-HBFSDRIKSA-N	482.132313598							118537
BRD-K03353688	LSM-29987		54639793	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19-,20-/m0/s1	SOXWEHYVEMBZTM-IHPCNDPISA-N	OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K03353688	BRD-K03353688-001-01-2	Broad Institute of MIT and Harvard	BRD-K03353688			OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19-,20-/m0/s1	SOXWEHYVEMBZTM-IHPCNDPISA-N	485.11874753							118538
BRD-K17675924	LSM-29988		54639730	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21-,22+/m0/s1	VIRGWJWOQCDSPY-FDFHNCONSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCNC(=O)CCN3CCCCC3)O[C@@H]2CO)cc1	BroadT	BRD-K17675924	BRD-K17675924-001-01-6	Broad Institute of MIT and Harvard	BRD-K17675924			COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCNC(=O)CCN3CCCCC3)O[C@@H]2CO)cc1	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21-,22+/m0/s1	VIRGWJWOQCDSPY-FDFHNCONSA-N	462.284220356							118539
BRD-K01699883	LSM-29989		54639495	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18+,20+/m0/s1	BZALQHWMPIGLLK-ILZDJORESA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K01699883	BRD-K01699883-001-01-3	Broad Institute of MIT and Harvard	BRD-K01699883			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18+,20+/m0/s1	BZALQHWMPIGLLK-ILZDJORESA-N	468.2184265							118540
BRD-K03886176	LSM-29990		54639688	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20-/m1/s1	VZQKOZAJNGTVKC-GSEOLPGOSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K03886176	BRD-K03886176-001-01-0	Broad Institute of MIT and Harvard	BRD-K03886176			C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20-/m1/s1	VZQKOZAJNGTVKC-GSEOLPGOSA-N	419.242021186							118541
BRD-K98637033	LSM-29991		54639486	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13+,14-/m1/s1	DVRCOHXMQROJRA-HZSPNIEDSA-N	COCC(=O)N[C@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K98637033	BRD-K98637033-001-01-6	Broad Institute of MIT and Harvard	BRD-K98637033			COCC(=O)N[C@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13+,14-/m1/s1	DVRCOHXMQROJRA-HZSPNIEDSA-N	328.199822016							118542
CHEMBL2137258	LSM-29992	BRD-K77591784, SID131435963	54639670	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19-,21-/m0/s1	USSZBVMKFITLQI-LRQRDZAKSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3cccnc3)CC[C@@H]1NC(=O)c4ccccc4F	BroadT	BRD-K77591784	BRD-K77591784-001-01-1	Broad Institute of MIT and Harvard	BRD-K77591784			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2cccnc2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19-,21-/m0/s1	USSZBVMKFITLQI-LRQRDZAKSA-N	425.186317878							118543
BRD-K45683404	LSM-29993		54639598	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16-,17+/m0/s1	FADSLUGYRKRULA-YESZJQIVSA-N	Cc1onc(C)c1NC(=O)N[C@H]2CC[C@@H](CCNC(=O)C3CCOCC3)O[C@@H]2CO	BroadT	BRD-K45683404	BRD-K45683404-001-01-5	Broad Institute of MIT and Harvard	BRD-K45683404			Cc1noc(C)c1NC(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16-,17+/m0/s1	FADSLUGYRKRULA-YESZJQIVSA-N	424.232184784							118544
BRD-K19776718	LSM-29994		54639708	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20+,21-/m1/s1	HGNKQCISEGSFPB-JRGCBEDISA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NCc3ccccc3F)O[C@@H]2CO	BroadT	BRD-K19776718	BRD-K19776718-001-01-0	Broad Institute of MIT and Harvard	BRD-K19776718			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20+,21-/m1/s1	HGNKQCISEGSFPB-JRGCBEDISA-N	448.14682081							118545
BRD-K84388444	LSM-29995		54639517	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17-,19+/m0/s1	DBHQDXKAYSPQOJ-VDZJLULYSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3CC3)CC[C@@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K84388444	BRD-K84388444-001-01-5	Broad Institute of MIT and Harvard	BRD-K84388444			OC[C@H]1O[C@H](CCn2cc(nn2)C2CC2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17-,19+/m0/s1	DBHQDXKAYSPQOJ-VDZJLULYSA-N	424.15805421							118546
BRD-K47170544	LSM-29996		54639758	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19-/m1/s1	NAYAIYZQZRPBRZ-ATZDWAIDSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K47170544	BRD-K47170544-001-01-2	Broad Institute of MIT and Harvard	BRD-K47170544			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NC(=O)c1cccnc1	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19-/m1/s1	NAYAIYZQZRPBRZ-ATZDWAIDSA-N	449.090911602							118547
BRD-K27610371	LSM-29997		54639520	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16+,17+/m1/s1	IMWIUMROKHVEKK-IKGGRYGDSA-N	CC(C)NC(=O)NCC[C@H]1CC[C@H](NC(=O)Nc2ccccc2)[C@H](CO)O1	BroadT	BRD-K27610371	BRD-K27610371-001-01-9	Broad Institute of MIT and Harvard	BRD-K27610371			CC(C)NC(=O)NCC[C@H]1CC[C@H](NC(=O)Nc2ccccc2)[C@H](CO)O1	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16+,17+/m1/s1	IMWIUMROKHVEKK-IKGGRYGDSA-N	378.22670548							118548
BRD-K04269696	LSM-29998		54639515	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17-,19-/m1/s1	DBHQDXKAYSPQOJ-SZVBFZGTSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3CC3)CC[C@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K04269696	BRD-K04269696-001-01-9	Broad Institute of MIT and Harvard	BRD-K04269696			OC[C@H]1O[C@@H](CCn2cc(nn2)C2CC2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17-,19-/m1/s1	DBHQDXKAYSPQOJ-SZVBFZGTSA-N	424.15805421							118549
BRD-K31230200	LSM-29999		54639497	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18-,20-/m1/s1	BZALQHWMPIGLLK-YVWKXTFCSA-N	OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K31230200	BRD-K31230200-001-01-7	Broad Institute of MIT and Harvard	BRD-K31230200			OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18-,20-/m1/s1	BZALQHWMPIGLLK-YVWKXTFCSA-N	468.2184265							118550
BRD-K80469338	LSM-30000		54639559	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16+,17+/m1/s1	LHRABQACLPZHAR-IKGGRYGDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K80469338	BRD-K80469338-001-01-6	Broad Institute of MIT and Harvard	BRD-K80469338			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16+,17+/m1/s1	LHRABQACLPZHAR-IKGGRYGDSA-N	379.190734542							118551
BRD-K24020784	LSM-30001		54639623	InChI=1S/C15H23F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h9-12,21H,1-8H2,(H,19,22)(H,20,23)/t10-,11-,12-/m0/s1	KNGQQLYZZKCBQO-SRVKXCTJSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)CC[C@@H]1NC(=O)CC2CC2	BroadT	BRD-K24020784	BRD-K24020784-001-01-5	Broad Institute of MIT and Harvard	BRD-K24020784			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)CC[C@@H]1NC(=O)CC1CC1	InChI=1S/C15H23F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h9-12,21H,1-8H2,(H,19,22)(H,20,23)/t10-,11-,12-/m0/s1	KNGQQLYZZKCBQO-SRVKXCTJSA-N	352.160991836							118552
BRD-K19411393	LSM-30002		54639659	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18-,20+/m1/s1	VAIOXDFGBLKFCW-GGPKGHCWSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NCc3cc(F)cc(F)c3)O[C@H]2CO	BroadT	BRD-K19411393	BRD-K19411393-001-01-6	Broad Institute of MIT and Harvard	BRD-K19411393			COc1ccccc1S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@H]1CO	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18-,20+/m1/s1	VAIOXDFGBLKFCW-GGPKGHCWSA-N	482.132313598							118553
BRD-K46746774	LSM-30003		54639484	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13-,14+/m0/s1	DVRCOHXMQROJRA-MELADBBJSA-N	COCC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K46746774	BRD-K46746774-001-01-1	Broad Institute of MIT and Harvard	BRD-K46746774			COCC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13-,14+/m0/s1	DVRCOHXMQROJRA-MELADBBJSA-N	328.199822016							118554
BRD-K44177046	LSM-30004		54639487	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13+,14-/m0/s1	DVRCOHXMQROJRA-MJBXVCDLSA-N	COCC(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K44177046	BRD-K44177046-001-01-3	Broad Institute of MIT and Harvard	BRD-K44177046			COCC(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13+,14-/m0/s1	DVRCOHXMQROJRA-MJBXVCDLSA-N	328.199822016							118555
BRD-K94913508	LSM-30005		54639754	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15+,16-/m1/s1	FOYMHNRGVNUWHD-OWCLPIDISA-N	CCC(=O)N[C@H]1CC[C@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	BroadT	BRD-K94913508	BRD-K94913508-001-01-1	Broad Institute of MIT and Harvard	BRD-K94913508			CCC(=O)N[C@H]1CC[C@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15+,16-/m1/s1	FOYMHNRGVNUWHD-OWCLPIDISA-N	355.247106566							118556
BRD-K24047785	LSM-30006		54639617	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14-,15+/m0/s1	XITZEOXYAYTYOD-AEGPPILISA-N	CN(C)C(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccccc2)[C@@H](CO)O1	BroadT	BRD-K24047785	BRD-K24047785-001-01-7	Broad Institute of MIT and Harvard	BRD-K24047785			CN(C)C(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccccc2)[C@@H](CO)O1	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14-,15+/m0/s1	XITZEOXYAYTYOD-AEGPPILISA-N	356.140592578							118557
BRD-K47212522	LSM-30007		54639767	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19-,20-/m0/s1	ORVKPQZRJOTCIB-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K47212522	BRD-K47212522-001-01-8	Broad Institute of MIT and Harvard	BRD-K47212522			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19-,20-/m0/s1	ORVKPQZRJOTCIB-UFYCRDLUSA-N	481.162469046							118558
BRD-K00611112	LSM-30008		54639679	InChI=1S/C22H26N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-13,19-21,24-25H,2,14-15H2,1H3,(H,23,26)/t19-,20-,21+/m0/s1	WANWEHJGGGHASC-PCCBWWKXSA-N	CCS(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)O[C@@H]1CO	BroadT	BRD-K00611112	BRD-K00611112-001-01-2	Broad Institute of MIT and Harvard	BRD-K00611112			CCS(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C22H26N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-13,19-21,24-25H,2,14-15H2,1H3,(H,23,26)/t19-,20-,21+/m0/s1	WANWEHJGGGHASC-PCCBWWKXSA-N	430.156242642							118559
BRD-K53717076	LSM-30009		54639523	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16+,17-/m1/s1	IMWIUMROKHVEKK-IXDOHACOSA-N	CC(C)NC(=O)NCC[C@H]1CC[C@H](NC(=O)Nc2ccccc2)[C@@H](CO)O1	BroadT	BRD-K53717076	BRD-K53717076-001-01-7	Broad Institute of MIT and Harvard	BRD-K53717076			CC(C)NC(=O)NCC[C@H]1CC[C@H](NC(=O)Nc2ccccc2)[C@@H](CO)O1	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16+,17-/m1/s1	IMWIUMROKHVEKK-IXDOHACOSA-N	378.22670548							118560
BRD-K78003637	LSM-30010		54639579	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18-,19+/m0/s1	DCOUIHVSHDCYLI-YTQUADARSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K78003637	BRD-K78003637-001-01-5	Broad Institute of MIT and Harvard	BRD-K78003637			OC[C@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18-,19+/m0/s1	DCOUIHVSHDCYLI-YTQUADARSA-N	454.137398978							118561
BRD-K19672435	LSM-30011		54639639	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16-/m1/s1	ZOKIFIDHVZYURK-OWCLPIDISA-N	CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	BroadT	BRD-K19672435	BRD-K19672435-001-01-3	Broad Institute of MIT and Harvard	BRD-K19672435			CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16-/m1/s1	ZOKIFIDHVZYURK-OWCLPIDISA-N	338.22055746							118562
BRD-K51398207	LSM-30012		54639680	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22+,23+/m1/s1	NCDVBILORYBSFZ-PUHATCMVSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2CO	BroadT	BRD-K51398207	BRD-K51398207-001-01-0	Broad Institute of MIT and Harvard	BRD-K51398207			COc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)N2CCc3ccccc3C2)O[C@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22+,23+/m1/s1	NCDVBILORYBSFZ-PUHATCMVSA-N	472.166807326							118563
BRD-K51181201	LSM-30013		54639537	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18-,19+/m1/s1	JUDGCNLDIJTAJU-LZQZEXGQSA-N	CCCc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3ccccc3F)[C@H](CO)O2)nn1	BroadT	BRD-K51181201	BRD-K51181201-001-01-6	Broad Institute of MIT and Harvard	BRD-K51181201			CCCc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3ccccc3F)[C@H](CO)O2)nn1	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18-,19+/m1/s1	JUDGCNLDIJTAJU-LZQZEXGQSA-N	405.217618006							118564
BRD-K05002317	LSM-30014		54639784	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18+,22-/m1/s1	RAMPQQLLROWEJQ-TVTNDZMWSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CCNC(=O)c3ccc4OCOc4c3)O[C@@H]2CO	BroadT	BRD-K05002317	BRD-K05002317-001-01-2	Broad Institute of MIT and Harvard	BRD-K05002317			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CCNC(=O)c2ccc3OCOc3c2)O[C@@H]1CO	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18+,22-/m1/s1	RAMPQQLLROWEJQ-TVTNDZMWSA-N	471.200550298							118565
BRD-K76706127	LSM-30015		54639700	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20-/m0/s1	VZQKOZAJNGTVKC-FFGOWVMKSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K76706127	BRD-K76706127-001-01-2	Broad Institute of MIT and Harvard	BRD-K76706127			C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20-/m0/s1	VZQKOZAJNGTVKC-FFGOWVMKSA-N	419.242021186							118566
BRD-K03884263	LSM-30016		54639637	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16+/m0/s1	ZOKIFIDHVZYURK-HRCADAONSA-N	CCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	BroadT	BRD-K03884263	BRD-K03884263-001-01-9	Broad Institute of MIT and Harvard	BRD-K03884263			CCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16+/m0/s1	ZOKIFIDHVZYURK-HRCADAONSA-N	338.22055746							118567
BRD-K39498165	LSM-30017		54639647	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20+,22-/m1/s1	KDMIEVSCRLGCNO-RZUBCFFCSA-N	Cc1ccccc1S(=O)(=O)N[C@H]2CC[C@H](CCn3cc(nn3)c4ccc(F)cc4)O[C@@H]2CO	BroadT	BRD-K39498165	BRD-K39498165-001-01-5	Broad Institute of MIT and Harvard	BRD-K39498165			Cc1ccccc1S(=O)(=O)N[C@H]1CC[C@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20+,22-/m1/s1	KDMIEVSCRLGCNO-RZUBCFFCSA-N	474.173704274							118568
BRD-K25177502	LSM-30018		54639775	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17-,18-/m0/s1	ISYSKPLJKWXOBQ-SZMVWBNQSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K25177502	BRD-K25177502-001-01-3	Broad Institute of MIT and Harvard	BRD-K25177502			CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17-,18-/m0/s1	ISYSKPLJKWXOBQ-SZMVWBNQSA-N	411.182791748							118569
BRD-K70198986	LSM-30019		54639496	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18+,20+/m1/s1	BZALQHWMPIGLLK-KPFFTGBYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K70198986	BRD-K70198986-001-01-8	Broad Institute of MIT and Harvard	BRD-K70198986			OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18+,20+/m1/s1	BZALQHWMPIGLLK-KPFFTGBYSA-N	468.2184265							118570
BRD-K11117868	LSM-30020		54639686	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22+,23-/m0/s1	NCDVBILORYBSFZ-WWNPGLIZSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2CO	BroadT	BRD-K11117868	BRD-K11117868-001-01-3	Broad Institute of MIT and Harvard	BRD-K11117868			COc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCc3ccccc3C2)O[C@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22+,23-/m0/s1	NCDVBILORYBSFZ-WWNPGLIZSA-N	472.166807326							118571
BRD-K24166534	LSM-30021		54639718	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17-,18-/m1/s1	HBUPPCLFCIMQJL-KZNAEPCWSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H](NC(=O)Cc3ccccn3)[C@@H](CO)O2	BroadT	BRD-K24166534	BRD-K24166534-001-01-9	Broad Institute of MIT and Harvard	BRD-K24166534			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17-,18-/m1/s1	HBUPPCLFCIMQJL-KZNAEPCWSA-N	390.22670548							118572
BRD-K17209411	LSM-30022		54639760	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19+/m0/s1	NAYAIYZQZRPBRZ-ZYSHUDEJSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K17209411	BRD-K17209411-001-01-4	Broad Institute of MIT and Harvard	BRD-K17209411			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)c1cccnc1	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19+/m0/s1	NAYAIYZQZRPBRZ-ZYSHUDEJSA-N	449.090911602							118573
BRD-K48129913	LSM-30023		54639704	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20-,21-/m1/s1	HGNKQCISEGSFPB-DUXKGJEZSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NCc3ccccc3F)O[C@@H]2CO	BroadT	BRD-K48129913	BRD-K48129913-001-01-0	Broad Institute of MIT and Harvard	BRD-K48129913			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20-,21-/m1/s1	HGNKQCISEGSFPB-DUXKGJEZSA-N	448.14682081							118574
BRD-K09720842	LSM-30024		54639789	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19+,20+/m1/s1	SOXWEHYVEMBZTM-HOJAQTOUSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K09720842	BRD-K09720842-001-01-9	Broad Institute of MIT and Harvard	BRD-K09720842			OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19+,20+/m1/s1	SOXWEHYVEMBZTM-HOJAQTOUSA-N	485.11874753							118575
BRD-K42526449	LSM-30025		54639683	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22-,23+/m0/s1	NCDVBILORYBSFZ-ACIOBRDBSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2CO	BroadT	BRD-K42526449	BRD-K42526449-001-01-6	Broad Institute of MIT and Harvard	BRD-K42526449			COc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCc3ccccc3C2)O[C@@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22-,23+/m0/s1	NCDVBILORYBSFZ-ACIOBRDBSA-N	472.166807326							118576
BRD-K90127324	LSM-30026		54639530	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15-,18-/m1/s1	AWOFXEOJWLHGJO-DDUZABMNSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K90127324	BRD-K90127324-001-01-4	Broad Institute of MIT and Harvard	BRD-K90127324			OC[C@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15-,18-/m1/s1	AWOFXEOJWLHGJO-DDUZABMNSA-N	435.171810666							118577
BRD-K59984972	LSM-30027		54639510	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20+,21-/m0/s1	GOYHAEMMGZTJNJ-TYPHKJRUSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K59984972	BRD-K59984972-001-01-2	Broad Institute of MIT and Harvard	BRD-K59984972			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20+,21-/m0/s1	GOYHAEMMGZTJNJ-TYPHKJRUSA-N	453.22974194							118578
BRD-K72224143	LSM-30028		54639769	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19-,20+/m1/s1	ORVKPQZRJOTCIB-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K72224143	BRD-K72224143-001-01-0	Broad Institute of MIT and Harvard	BRD-K72224143			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19-,20+/m1/s1	ORVKPQZRJOTCIB-AQNXPRMDSA-N	481.162469046							118579
BRD-K37831546	LSM-30029		54639727	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21+,22-/m1/s1	VIRGWJWOQCDSPY-BHIFYINESA-N	COc1ccc(NC(=O)N[C@H]2CC[C@H](CCNC(=O)CCN3CCCCC3)O[C@@H]2CO)cc1	BroadT	BRD-K37831546	BRD-K37831546-001-01-9	Broad Institute of MIT and Harvard	BRD-K37831546			COc1ccc(NC(=O)N[C@H]2CC[C@H](CCNC(=O)CCN3CCCCC3)O[C@@H]2CO)cc1	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21+,22-/m1/s1	VIRGWJWOQCDSPY-BHIFYINESA-N	462.284220356							118580
BRD-K88925664	LSM-30030		54639558	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16+,17+/m0/s1	LHRABQACLPZHAR-GVDBMIGSSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K88925664	BRD-K88925664-001-01-3	Broad Institute of MIT and Harvard	BRD-K88925664			OC[C@H]1O[C@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16+,17+/m0/s1	LHRABQACLPZHAR-GVDBMIGSSA-N	379.190734542							118581
BRD-K96979108	LSM-30031		54639543	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17+,21+/m1/s1	KQJSIDVYPJWNIL-KUDFPVQQSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K96979108	BRD-K96979108-001-01-4	Broad Institute of MIT and Harvard	BRD-K96979108			OC[C@@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17+,21+/m1/s1	KQJSIDVYPJWNIL-KUDFPVQQSA-N	477.17114195							118582
BRD-K75065750	LSM-30032		54639695	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20+/m0/s1	VZQKOZAJNGTVKC-FRYIKTPZSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K75065750	BRD-K75065750-001-01-8	Broad Institute of MIT and Harvard	BRD-K75065750			C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20+/m0/s1	VZQKOZAJNGTVKC-FRYIKTPZSA-N	419.242021186							118583
BRD-K62584372	LSM-30033		54639651	InChI=1S/C16H25ClN2O6S2/c1-2-26(21,22)18-9-8-13-6-7-15(16(11-20)25-13)19-27(23,24)14-5-3-4-12(17)10-14/h3-5,10,13,15-16,18-20H,2,6-9,11H2,1H3/t13-,15+,16-/m1/s1	PCAWZXQDZTWTAN-VNQPRFMTSA-N	CCS(=O)(=O)NCC[C@H]1CC[C@H](NS(=O)(=O)c2cccc(Cl)c2)[C@@H](CO)O1	BroadT	BRD-K62584372	BRD-K62584372-001-01-1	Broad Institute of MIT and Harvard	BRD-K62584372			CCS(=O)(=O)NCC[C@H]1CC[C@H](NS(=O)(=O)c2cccc(Cl)c2)[C@@H](CO)O1	InChI=1S/C16H25ClN2O6S2/c1-2-26(21,22)18-9-8-13-6-7-15(16(11-20)25-13)19-27(23,24)14-5-3-4-12(17)10-14/h3-5,10,13,15-16,18-20H,2,6-9,11H2,1H3/t13-,15+,16-/m1/s1	PCAWZXQDZTWTAN-VNQPRFMTSA-N	440.08425563							118584
BRD-K03662481	LSM-30034		54639556	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13+,14-/m1/s1	JWTJGHMNSRUWKB-HZSPNIEDSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NCC3CC3)O[C@@H]2CO	BroadT	BRD-K03662481	BRD-K03662481-001-01-5	Broad Institute of MIT and Harvard	BRD-K03662481			Cn1cnc(c1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCC2CC2)O[C@@H]1CO	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13+,14-/m1/s1	JWTJGHMNSRUWKB-HZSPNIEDSA-N	384.146740598							118585
BRD-K27915221	LSM-30035		54639585	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20-,21+/m0/s1	TXCGFGBWYOSXMX-PCCBWWKXSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)CC[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K27915221	BRD-K27915221-001-01-4	Broad Institute of MIT and Harvard	BRD-K27915221			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20-,21+/m0/s1	TXCGFGBWYOSXMX-PCCBWWKXSA-N	414.195485564							118586
BRD-K64266251	LSM-30036		54639539	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18-,19-/m0/s1	JUDGCNLDIJTAJU-SNRMKQJTSA-N	CCCc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3ccccc3F)[C@H](CO)O2)nn1	BroadT	BRD-K64266251	BRD-K64266251-001-01-9	Broad Institute of MIT and Harvard	BRD-K64266251			CCCc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3ccccc3F)[C@H](CO)O2)nn1	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18-,19-/m0/s1	JUDGCNLDIJTAJU-SNRMKQJTSA-N	405.217618006							118587
BRD-K07697589	LSM-30037		54639570	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19-,20+/m0/s1	XDZGUUVZSOVFIF-YSIASYRMSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccncc3)O[C@@H]2CO	BroadT	BRD-K07697589	BRD-K07697589-001-01-8	Broad Institute of MIT and Harvard	BRD-K07697589			COc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccncc2)O[C@@H]1CO	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19-,20+/m0/s1	XDZGUUVZSOVFIF-YSIASYRMSA-N	449.162056304							118588
BRD-K54495109	LSM-30038		54639567	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19+,20+/m1/s1	XDZGUUVZSOVFIF-HOJAQTOUSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccncc3)O[C@H]2CO	BroadT	BRD-K54495109	BRD-K54495109-001-01-0	Broad Institute of MIT and Harvard	BRD-K54495109			COc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccncc2)O[C@H]1CO	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19+,20+/m1/s1	XDZGUUVZSOVFIF-HOJAQTOUSA-N	449.162056304							118589
BRD-K64165176	LSM-30039		54639629	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18-,19-/m0/s1	UTNFYOAWBFBPFR-FHWLQOOXSA-N	COc1cccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccncn3)O[C@H]2CO)c1	BroadT	BRD-K64165176	BRD-K64165176-001-01-5	Broad Institute of MIT and Harvard	BRD-K64165176			COc1cccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccncn3)O[C@H]2CO)c1	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18-,19-/m0/s1	UTNFYOAWBFBPFR-FHWLQOOXSA-N	429.201219014							118590
BRD-K84478344	LSM-30040		54639548	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17-,21+/m0/s1	KQJSIDVYPJWNIL-HZUJVAHNSA-N	OC[C@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K84478344	BRD-K84478344-001-01-5	Broad Institute of MIT and Harvard	BRD-K84478344			OC[C@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17-,21+/m0/s1	KQJSIDVYPJWNIL-HZUJVAHNSA-N	477.17114195							118591
BRD-K77401804	LSM-30041		54639578	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18-,19-/m0/s1	DCOUIHVSHDCYLI-WDSOQIARSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K77401804	BRD-K77401804-001-01-9	Broad Institute of MIT and Harvard	BRD-K77401804			OC[C@@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18-,19-/m0/s1	DCOUIHVSHDCYLI-WDSOQIARSA-N	454.137398978							118592
BRD-K85907501	LSM-30042		54639666	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19+,21+/m0/s1	USSZBVMKFITLQI-LDQXTDLNSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3cccnc3)CC[C@H]1NC(=O)c4ccccc4F	BroadT	BRD-K85907501	BRD-K85907501-001-01-1	Broad Institute of MIT and Harvard	BRD-K85907501			OC[C@H]1O[C@H](CCn2cc(nn2)-c2cccnc2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19+,21+/m0/s1	USSZBVMKFITLQI-LDQXTDLNSA-N	425.186317878							118593
BRD-K83755051	LSM-30043		54639602	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16+,17-/m0/s1	FADSLUGYRKRULA-BBWFWOEESA-N	Cc1onc(C)c1NC(=O)N[C@@H]2CC[C@@H](CCNC(=O)C3CCOCC3)O[C@H]2CO	BroadT	BRD-K83755051	BRD-K83755051-001-01-0	Broad Institute of MIT and Harvard	BRD-K83755051			Cc1noc(C)c1NC(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16+,17-/m0/s1	FADSLUGYRKRULA-BBWFWOEESA-N	424.232184784							118594
BRD-K47482563	LSM-30044		54639509	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20+,21-/m1/s1	GOYHAEMMGZTJNJ-HLAWJBBLSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K47482563	BRD-K47482563-001-01-7	Broad Institute of MIT and Harvard	BRD-K47482563			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20+,21-/m1/s1	GOYHAEMMGZTJNJ-HLAWJBBLSA-N	453.22974194							118595
BRD-K75426080	LSM-30045		54639489	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16+,17+/m1/s1	WWDDUWFGCORCPA-IKGGRYGDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)C3CC3	BroadT	BRD-K75426080	BRD-K75426080-001-01-3	Broad Institute of MIT and Harvard	BRD-K75426080			OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)C1CC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16+,17+/m1/s1	WWDDUWFGCORCPA-IKGGRYGDSA-N	383.242021186							118596
BRD-K68330990	LSM-30046		54639762	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19-/m0/s1	NAYAIYZQZRPBRZ-IPELMVKDSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K68330990	BRD-K68330990-001-01-5	Broad Institute of MIT and Harvard	BRD-K68330990			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NC(=O)c1cccnc1	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19-/m0/s1	NAYAIYZQZRPBRZ-IPELMVKDSA-N	449.090911602							118597
BRD-K20809650	LSM-30047		54639649	InChI=1S/C16H25ClN2O6S2/c1-2-26(21,22)18-9-8-13-6-7-15(16(11-20)25-13)19-27(23,24)14-5-3-4-12(17)10-14/h3-5,10,13,15-16,18-20H,2,6-9,11H2,1H3/t13-,15+,16+/m0/s1	PCAWZXQDZTWTAN-NUEKZKHPSA-N	CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(Cl)c2)[C@@H](CO)O1	BroadT	BRD-K20809650	BRD-K20809650-001-01-6	Broad Institute of MIT and Harvard	BRD-K20809650			CCS(=O)(=O)NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2cccc(Cl)c2)[C@@H](CO)O1	InChI=1S/C16H25ClN2O6S2/c1-2-26(21,22)18-9-8-13-6-7-15(16(11-20)25-13)19-27(23,24)14-5-3-4-12(17)10-14/h3-5,10,13,15-16,18-20H,2,6-9,11H2,1H3/t13-,15+,16+/m0/s1	PCAWZXQDZTWTAN-NUEKZKHPSA-N	440.08425563							118598
BRD-K17065706	LSM-30048		54639586	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20-,21+/m1/s1	TXCGFGBWYOSXMX-NJYVYQBISA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K17065706	BRD-K17065706-001-01-4	Broad Institute of MIT and Harvard	BRD-K17065706			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20-,21+/m1/s1	TXCGFGBWYOSXMX-NJYVYQBISA-N	414.195485564							118599
BRD-K11987248	LSM-30049		54639563	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16-,17+/m1/s1	LHRABQACLPZHAR-ZACQAIPSSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K11987248	BRD-K11987248-001-01-0	Broad Institute of MIT and Harvard	BRD-K11987248			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16-,17+/m1/s1	LHRABQACLPZHAR-ZACQAIPSSA-N	379.190734542							118600
BRD-K30292003	LSM-30050		54639546	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17-,21-/m1/s1	KQJSIDVYPJWNIL-QLVMHMETSA-N	OC[C@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K30292003	BRD-K30292003-001-01-7	Broad Institute of MIT and Harvard	BRD-K30292003			OC[C@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17-,21-/m1/s1	KQJSIDVYPJWNIL-QLVMHMETSA-N	477.17114195							118601
BRD-K50677542	LSM-30051		54639621	InChI=1S/C15H23F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h9-12,21H,1-8H2,(H,19,22)(H,20,23)/t10-,11+,12+/m0/s1	KNGQQLYZZKCBQO-QJPTWQEYSA-N	OC[C@H]1O[C@H](CC(=O)NCC(F)(F)F)CC[C@H]1NC(=O)CC2CC2	BroadT	BRD-K50677542	BRD-K50677542-001-01-2	Broad Institute of MIT and Harvard	BRD-K50677542			OC[C@H]1O[C@H](CC(=O)NCC(F)(F)F)CC[C@H]1NC(=O)CC1CC1	InChI=1S/C15H23F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h9-12,21H,1-8H2,(H,19,22)(H,20,23)/t10-,11+,12+/m0/s1	KNGQQLYZZKCBQO-QJPTWQEYSA-N	352.160991836							118602
BRD-K18313650	LSM-30052		54639702	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20+,21+/m0/s1	HGNKQCISEGSFPB-IOMROCGXSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCc3ccccc3F)O[C@@H]2CO	BroadT	BRD-K18313650	BRD-K18313650-001-01-3	Broad Institute of MIT and Harvard	BRD-K18313650			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20+,21+/m0/s1	HGNKQCISEGSFPB-IOMROCGXSA-N	448.14682081							118603
BRD-K82968105	LSM-30053		54639776	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17-,18+/m0/s1	ISYSKPLJKWXOBQ-RYQLBKOJSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K82968105	BRD-K82968105-001-01-6	Broad Institute of MIT and Harvard	BRD-K82968105			CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17-,18+/m0/s1	ISYSKPLJKWXOBQ-RYQLBKOJSA-N	411.182791748							118604
BRD-K10435664	LSM-30054		54639519	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16+,17+/m0/s1	IMWIUMROKHVEKK-GVDBMIGSSA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)Nc2ccccc2)[C@@H](CO)O1	BroadT	BRD-K10435664	BRD-K10435664-001-01-6	Broad Institute of MIT and Harvard	BRD-K10435664			CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)Nc2ccccc2)[C@@H](CO)O1	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16+,17+/m0/s1	IMWIUMROKHVEKK-GVDBMIGSSA-N	378.22670548							118605
BRD-K14719962	LSM-30055		54639573	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19+,20-/m0/s1	XDZGUUVZSOVFIF-SXLOBPIMSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccncc3)O[C@H]2CO	BroadT	BRD-K14719962	BRD-K14719962-001-01-8	Broad Institute of MIT and Harvard	BRD-K14719962			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccncc2)O[C@H]1CO	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19+,20-/m0/s1	XDZGUUVZSOVFIF-SXLOBPIMSA-N	449.162056304							118606
BRD-K81642886	LSM-30056		54639583	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20-,21-/m1/s1	TXCGFGBWYOSXMX-NJDAHSKKSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K81642886	BRD-K81642886-001-01-3	Broad Institute of MIT and Harvard	BRD-K81642886			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20-,21-/m1/s1	TXCGFGBWYOSXMX-NJDAHSKKSA-N	414.195485564							118607
BRD-K32960568	LSM-30057		54639677	InChI=1S/C22H26N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-13,19-21,24-25H,2,14-15H2,1H3,(H,23,26)/t19-,20-,21-/m1/s1	WANWEHJGGGHASC-NJDAHSKKSA-N	CCS(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)O[C@@H]1CO	BroadT	BRD-K32960568	BRD-K32960568-001-01-4	Broad Institute of MIT and Harvard	BRD-K32960568			CCS(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C22H26N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-13,19-21,24-25H,2,14-15H2,1H3,(H,23,26)/t19-,20-,21-/m1/s1	WANWEHJGGGHASC-NJDAHSKKSA-N	430.156242642							118608
BRD-K28314528	LSM-30058		54639632	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18+,19-/m0/s1	UTNFYOAWBFBPFR-OTWHNJEPSA-N	COc1cccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccncn3)O[C@H]2CO)c1	BroadT	BRD-K28314528	BRD-K28314528-001-01-9	Broad Institute of MIT and Harvard	BRD-K28314528			COc1cccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccncn3)O[C@H]2CO)c1	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18+,19-/m0/s1	UTNFYOAWBFBPFR-OTWHNJEPSA-N	429.201219014							118609
BRD-K10911459	LSM-30059		54639740	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13+,14+/m1/s1	YUDVUYFJPOOWEQ-RDBSUJKOSA-N	CCCNC(=O)N[C@H]1CC[C@H](CC(=O)NC2CCC2)O[C@H]1CO	BroadT	BRD-K10911459	BRD-K10911459-001-01-5	Broad Institute of MIT and Harvard	BRD-K10911459			CCCNC(=O)N[C@H]1CC[C@H](CC(=O)NC2CCC2)O[C@H]1CO	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13+,14+/m1/s1	YUDVUYFJPOOWEQ-RDBSUJKOSA-N	327.215806438							118610
BRD-K61595867	LSM-30060		54639788	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19+,20+/m0/s1	SOXWEHYVEMBZTM-DFQSSKMNSA-N	OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K61595867	BRD-K61595867-001-01-0	Broad Institute of MIT and Harvard	BRD-K61595867			OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19+,20+/m0/s1	SOXWEHYVEMBZTM-DFQSSKMNSA-N	485.11874753							118611
BRD-K12343830	LSM-30061		54639663	InChI=1S/C19H29FN4O4/c1-24(2)11-18(26)23-16-8-7-15(28-17(16)12-25)9-10-21-19(27)22-14-5-3-13(20)4-6-14/h3-6,15-17,25H,7-12H2,1-2H3,(H,23,26)(H2,21,22,27)/t15-,16+,17+/m1/s1	HVYAXUQBEQKNPC-IKGGRYGDSA-N	CN(C)CC(=O)N[C@H]1CC[C@H](CCNC(=O)Nc2ccc(F)cc2)O[C@H]1CO	BroadT	BRD-K12343830	BRD-K12343830-001-01-9	Broad Institute of MIT and Harvard	BRD-K12343830			CN(C)CC(=O)N[C@H]1CC[C@H](CCNC(=O)Nc2ccc(F)cc2)O[C@H]1CO	InChI=1S/C19H29FN4O4/c1-24(2)11-18(26)23-16-8-7-15(28-17(16)12-25)9-10-21-19(27)22-14-5-3-13(20)4-6-14/h3-6,15-17,25H,7-12H2,1-2H3,(H,23,26)(H2,21,22,27)/t15-,16+,17+/m1/s1	HVYAXUQBEQKNPC-IKGGRYGDSA-N	396.217283648							118612
BRD-K73442516	LSM-30062		54639694	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20-/m1/s1	VZQKOZAJNGTVKC-BTHPGYMESA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K73442516	BRD-K73442516-001-01-6	Broad Institute of MIT and Harvard	BRD-K73442516			C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20-/m1/s1	VZQKOZAJNGTVKC-BTHPGYMESA-N	419.242021186							118613
BRD-K88720906	LSM-30063		54639555	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13-,14+/m1/s1	JWTJGHMNSRUWKB-MCIONIFRSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NCC3CC3)O[C@H]2CO	BroadT	BRD-K88720906	BRD-K88720906-001-01-6	Broad Institute of MIT and Harvard	BRD-K88720906			Cn1cnc(c1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NCC2CC2)O[C@H]1CO	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13-,14+/m1/s1	JWTJGHMNSRUWKB-MCIONIFRSA-N	384.146740598							118614
BRD-K48389907	LSM-30064		54639785	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18-,22-/m1/s1	RAMPQQLLROWEJQ-RADWXHQJSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CCNC(=O)c3ccc4OCOc4c3)O[C@@H]2CO	BroadT	BRD-K48389907	BRD-K48389907-001-01-8	Broad Institute of MIT and Harvard	BRD-K48389907			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CCNC(=O)c2ccc3OCOc3c2)O[C@@H]1CO	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18-,22-/m1/s1	RAMPQQLLROWEJQ-RADWXHQJSA-N	471.200550298							118615
BRD-K34059927-001-01-9	LSM-30065	BRD-K34059927	54639640	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16-/m0/s1	ZOKIFIDHVZYURK-XHSDSOJGSA-N	CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	BroadT	BRD-K34059927	BRD-K34059927-001-01-9	Broad Institute of MIT and Harvard	BRD-K34059927			CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16-/m0/s1	ZOKIFIDHVZYURK-XHSDSOJGSA-N	338.22055746							118616
BRD-K06355852	LSM-30066		54639526	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16+,17-/m0/s1	IMWIUMROKHVEKK-BBWFWOEESA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)Nc2ccccc2)[C@H](CO)O1	BroadT	BRD-K06355852	BRD-K06355852-001-01-4	Broad Institute of MIT and Harvard	BRD-K06355852			CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)Nc2ccccc2)[C@H](CO)O1	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16+,17-/m0/s1	IMWIUMROKHVEKK-BBWFWOEESA-N	378.22670548							118617
BRD-K12879624	LSM-30067		54639741	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13+,14+/m0/s1	YUDVUYFJPOOWEQ-BFHYXJOUSA-N	CCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)NC2CCC2)O[C@@H]1CO	BroadT	BRD-K12879624	BRD-K12879624-001-01-2	Broad Institute of MIT and Harvard	BRD-K12879624			CCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)NC2CCC2)O[C@@H]1CO	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13+,14+/m0/s1	YUDVUYFJPOOWEQ-BFHYXJOUSA-N	327.215806438							118618
BRD-K77875023	LSM-30068		54639646	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20-,22-/m0/s1	KDMIEVSCRLGCNO-ONTIZHBOSA-N	Cc1ccccc1S(=O)(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)c4ccc(F)cc4)O[C@H]2CO	BroadT	BRD-K77875023	BRD-K77875023-001-01-9	Broad Institute of MIT and Harvard	BRD-K77875023			Cc1ccccc1S(=O)(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@H]1CO	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20-,22-/m0/s1	KDMIEVSCRLGCNO-ONTIZHBOSA-N	474.173704274							118619
BRD-K81779733	LSM-30069		54639773	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17+,18+/m1/s1	ISYSKPLJKWXOBQ-NJAFHUGGSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K81779733	BRD-K81779733-001-01-8	Broad Institute of MIT and Harvard	BRD-K81779733			CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17+,18+/m1/s1	ISYSKPLJKWXOBQ-NJAFHUGGSA-N	411.182791748							118620
BRD-K97183783	LSM-30070		54639528	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15+,18+/m1/s1	AWOFXEOJWLHGJO-XUWXXGDYSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K97183783	BRD-K97183783-001-01-4	Broad Institute of MIT and Harvard	BRD-K97183783			OC[C@@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15+,18+/m1/s1	AWOFXEOJWLHGJO-XUWXXGDYSA-N	435.171810666							118621
BRD-K82683018	LSM-30071		54639518	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17+,19-/m0/s1	DBHQDXKAYSPQOJ-WDYCEAGBSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3CC3)CC[C@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K82683018	BRD-K82683018-001-01-7	Broad Institute of MIT and Harvard	BRD-K82683018			OC[C@@H]1O[C@H](CCn2cc(nn2)C2CC2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17+,19-/m0/s1	DBHQDXKAYSPQOJ-WDYCEAGBSA-N	424.15805421							118622
BRD-K88099511	LSM-30072		54639734	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24-,25+/m0/s1	DSJATXUDYPTXRQ-ZKMPZPQNSA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)c3ccc(cc3)c4ccccc4)[C@@H](CO)O2)nn1	BroadT	BRD-K88099511	BRD-K88099511-001-01-2	Broad Institute of MIT and Harvard	BRD-K88099511			CN(C)Cc1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)c3ccc(cc3)-c3ccccc3)[C@@H](CO)O2)nn1	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24-,25+/m0/s1	DSJATXUDYPTXRQ-ZKMPZPQNSA-N	499.225325276							118623
BRD-K85110576	LSM-30073		54639717	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17+,18+/m1/s1	HBUPPCLFCIMQJL-SQNIBIBYSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H](NC(=O)Cc3ccccn3)[C@H](CO)O2	BroadT	BRD-K85110576	BRD-K85110576-001-01-2	Broad Institute of MIT and Harvard	BRD-K85110576			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@H](CO)O1	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17+,18+/m1/s1	HBUPPCLFCIMQJL-SQNIBIBYSA-N	390.22670548							118624
BRD-K03093950	LSM-30074		54639508	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20-,21+/m0/s1	GOYHAEMMGZTJNJ-SESVDKBCSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K03093950	BRD-K03093950-001-01-5	Broad Institute of MIT and Harvard	BRD-K03093950			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20-,21+/m0/s1	GOYHAEMMGZTJNJ-SESVDKBCSA-N	453.22974194							118625
BRD-K01077691	LSM-30075		54639571	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19-,20+/m1/s1	XDZGUUVZSOVFIF-RLLQIKCJSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccncc3)O[C@H]2CO	BroadT	BRD-K01077691	BRD-K01077691-001-01-4	Broad Institute of MIT and Harvard	BRD-K01077691			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccncc2)O[C@H]1CO	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19-,20+/m1/s1	XDZGUUVZSOVFIF-RLLQIKCJSA-N	449.162056304							118626
BRD-K87447060	LSM-30076		54639631	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18+,19-/m1/s1	UTNFYOAWBFBPFR-CEXWTWQISA-N	COc1cccc(NC(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccncn3)O[C@@H]2CO)c1	BroadT	BRD-K87447060	BRD-K87447060-001-01-9	Broad Institute of MIT and Harvard	BRD-K87447060			COc1cccc(NC(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccncn3)O[C@@H]2CO)c1	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18+,19-/m1/s1	UTNFYOAWBFBPFR-CEXWTWQISA-N	429.201219014							118627
BRD-K96416345	LSM-30077		54639750	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15-,16-/m1/s1	FOYMHNRGVNUWHD-BZUAXINKSA-N	CCC(=O)N[C@@H]1CC[C@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	BroadT	BRD-K96416345	BRD-K96416345-001-01-0	Broad Institute of MIT and Harvard	BRD-K96416345			CCC(=O)N[C@@H]1CC[C@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15-,16-/m1/s1	FOYMHNRGVNUWHD-BZUAXINKSA-N	355.247106566							118628
BRD-K79604175	LSM-30078		54639615	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14-,15-/m1/s1	XITZEOXYAYTYOD-BPLDGKMQSA-N	CN(C)C(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccccc2)[C@@H](CO)O1	BroadT	BRD-K79604175	BRD-K79604175-001-01-7	Broad Institute of MIT and Harvard	BRD-K79604175			CN(C)C(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccccc2)[C@@H](CO)O1	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14-,15-/m1/s1	XITZEOXYAYTYOD-BPLDGKMQSA-N	356.140592578							118629
BRD-K53931904	LSM-30079		54639662	InChI=1S/C19H29FN4O4/c1-24(2)11-18(26)23-16-8-7-15(28-17(16)12-25)9-10-21-19(27)22-14-5-3-13(20)4-6-14/h3-6,15-17,25H,7-12H2,1-2H3,(H,23,26)(H2,21,22,27)/t15-,16+,17+/m0/s1	HVYAXUQBEQKNPC-GVDBMIGSSA-N	CN(C)CC(=O)N[C@@H]1CC[C@@H](CCNC(=O)Nc2ccc(F)cc2)O[C@@H]1CO	BroadT	BRD-K53931904	BRD-K53931904-001-01-2	Broad Institute of MIT and Harvard	BRD-K53931904			CN(C)CC(=O)N[C@@H]1CC[C@@H](CCNC(=O)Nc2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C19H29FN4O4/c1-24(2)11-18(26)23-16-8-7-15(28-17(16)12-25)9-10-21-19(27)22-14-5-3-13(20)4-6-14/h3-6,15-17,25H,7-12H2,1-2H3,(H,23,26)(H2,21,22,27)/t15-,16+,17+/m0/s1	HVYAXUQBEQKNPC-GVDBMIGSSA-N	396.217283648							118630
BRD-K24554242	LSM-30080		54639618	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14-,15+/m1/s1	XITZEOXYAYTYOD-YUELXQCFSA-N	CN(C)C(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccccc2)[C@H](CO)O1	BroadT	BRD-K24554242	BRD-K24554242-001-01-9	Broad Institute of MIT and Harvard	BRD-K24554242			CN(C)C(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccccc2)[C@H](CO)O1	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14-,15+/m1/s1	XITZEOXYAYTYOD-YUELXQCFSA-N	356.140592578							118631
BRD-K19418944	LSM-30081		54639610	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20+,21-/m0/s1	JLSMJUFCCBIUFG-HBMCJLEFSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)C4CCOCC4	BroadT	BRD-K19418944	BRD-K19418944-001-01-5	Broad Institute of MIT and Harvard	BRD-K19418944			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20+,21-/m0/s1	JLSMJUFCCBIUFG-HBMCJLEFSA-N	416.231122144							118632
BRD-K57042334	LSM-30082		54639493	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16-,17+/m1/s1	WWDDUWFGCORCPA-ZACQAIPSSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)C3CC3	BroadT	BRD-K57042334	BRD-K57042334-001-01-4	Broad Institute of MIT and Harvard	BRD-K57042334			OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)C1CC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16-,17+/m1/s1	WWDDUWFGCORCPA-ZACQAIPSSA-N	383.242021186							118633
BRD-K49628278	LSM-30083		54639774	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17-,18-/m1/s1	ISYSKPLJKWXOBQ-KBAYOESNSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K49628278	BRD-K49628278-001-01-9	Broad Institute of MIT and Harvard	BRD-K49628278			CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17-,18-/m1/s1	ISYSKPLJKWXOBQ-KBAYOESNSA-N	411.182791748							118634
BRD-K86268010	LSM-30084		54639590	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12+,13+/m1/s1	CZGVFFSNBHAYON-WXHSDQCUSA-N	COC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccccc2F)C=C1	BroadT	BRD-K86268010	BRD-K86268010-001-01-1	Broad Institute of MIT and Harvard	BRD-K86268010			COC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccccc2F)C=C1	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12+,13+/m1/s1	CZGVFFSNBHAYON-WXHSDQCUSA-N	359.083886196							118635
BRD-K89320330	LSM-30085		54639525	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16-,17+/m0/s1	IMWIUMROKHVEKK-YESZJQIVSA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@H](NC(=O)Nc2ccccc2)[C@@H](CO)O1	BroadT	BRD-K89320330	BRD-K89320330-001-01-0	Broad Institute of MIT and Harvard	BRD-K89320330			CC(C)NC(=O)NCC[C@@H]1CC[C@H](NC(=O)Nc2ccccc2)[C@@H](CO)O1	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16-,17+/m0/s1	IMWIUMROKHVEKK-YESZJQIVSA-N	378.22670548							118636
BRD-K95768123	LSM-30086		54639795	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13+,14+/m0/s1	DVRCOHXMQROJRA-BFHYXJOUSA-N	COCC(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K95768123	BRD-K95768123-001-01-3	Broad Institute of MIT and Harvard	BRD-K95768123			COCC(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13+,14+/m0/s1	DVRCOHXMQROJRA-BFHYXJOUSA-N	328.199822016							118637
BRD-K73475697	LSM-30087		54639481	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13+,14+/m1/s1	DVRCOHXMQROJRA-RDBSUJKOSA-N	COCC(=O)N[C@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K73475697	BRD-K73475697-001-01-7	Broad Institute of MIT and Harvard	BRD-K73475697			COCC(=O)N[C@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13+,14+/m1/s1	DVRCOHXMQROJRA-RDBSUJKOSA-N	328.199822016							118638
BRD-K27726368	LSM-30088		54639604	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20+,21+/m1/s1	JLSMJUFCCBIUFG-HKBOAZHASA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)C4CCOCC4	BroadT	BRD-K27726368	BRD-K27726368-001-01-8	Broad Institute of MIT and Harvard	BRD-K27726368			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20+,21+/m1/s1	JLSMJUFCCBIUFG-HKBOAZHASA-N	416.231122144							118639
BRD-K07160568	LSM-30089		54639747	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13+,14-/m0/s1	YUDVUYFJPOOWEQ-MJBXVCDLSA-N	CCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)NC2CCC2)O[C@H]1CO	BroadT	BRD-K07160568	BRD-K07160568-001-01-2	Broad Institute of MIT and Harvard	BRD-K07160568			CCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)NC2CCC2)O[C@H]1CO	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13+,14-/m0/s1	YUDVUYFJPOOWEQ-MJBXVCDLSA-N	327.215806438							118640
BRD-K06203932	LSM-30090		54639636	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16-/m0/s1	ZOKIFIDHVZYURK-JYJNAYRXSA-N	CCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	BroadT	BRD-K06203932	BRD-K06203932-001-01-0	Broad Institute of MIT and Harvard	BRD-K06203932			CCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16-/m0/s1	ZOKIFIDHVZYURK-JYJNAYRXSA-N	338.22055746							118641
BRD-K26361872	LSM-30091		54639720	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17-,18+/m0/s1	HBUPPCLFCIMQJL-OKZBNKHCSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H](NC(=O)Cc3ccccn3)[C@@H](CO)O2	BroadT	BRD-K26361872	BRD-K26361872-001-01-4	Broad Institute of MIT and Harvard	BRD-K26361872			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17-,18+/m0/s1	HBUPPCLFCIMQJL-OKZBNKHCSA-N	390.22670548							118642
BRD-K53396471	LSM-30092		54639577	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18-,19+/m1/s1	DCOUIHVSHDCYLI-QRQLOZEOSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K53396471	BRD-K53396471-001-01-1	Broad Institute of MIT and Harvard	BRD-K53396471			OC[C@@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18-,19+/m1/s1	DCOUIHVSHDCYLI-QRQLOZEOSA-N	454.137398978							118643
BRD-K87781745	LSM-30093		54639491	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16-,17-/m0/s1	WWDDUWFGCORCPA-ULQDDVLXSA-N	OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)C3CC3	BroadT	BRD-K87781745	BRD-K87781745-001-01-4	Broad Institute of MIT and Harvard	BRD-K87781745			OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)C1CC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16-,17-/m0/s1	WWDDUWFGCORCPA-ULQDDVLXSA-N	383.242021186							118644
BRD-K90808566	LSM-30094		54639574	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18+,19+/m0/s1	DCOUIHVSHDCYLI-QXAKKESOSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K90808566	BRD-K90808566-001-01-6	Broad Institute of MIT and Harvard	BRD-K90808566			OC[C@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18+,19+/m0/s1	DCOUIHVSHDCYLI-QXAKKESOSA-N	454.137398978							118645
BRD-K58445641	LSM-30095		54639739	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24+,25-/m0/s1	DSJATXUDYPTXRQ-CAOCKLPOSA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)c3ccc(cc3)c4ccccc4)[C@H](CO)O2)nn1	BroadT	BRD-K58445641	BRD-K58445641-001-01-6	Broad Institute of MIT and Harvard	BRD-K58445641			CN(C)Cc1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)c3ccc(cc3)-c3ccccc3)[C@H](CO)O2)nn1	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24+,25-/m0/s1	DSJATXUDYPTXRQ-CAOCKLPOSA-N	499.225325276							118646
BRD-K78262424	LSM-30096		54639669	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19-,21+/m1/s1	USSZBVMKFITLQI-BSIFCXSSSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3cccnc3)CC[C@H]1NC(=O)c4ccccc4F	BroadT	BRD-K78262424	BRD-K78262424-001-01-4	Broad Institute of MIT and Harvard	BRD-K78262424			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2cccnc2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19-,21+/m1/s1	USSZBVMKFITLQI-BSIFCXSSSA-N	425.186317878							118647
BRD-K21997380	LSM-30097		54639697	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20-/m0/s1	VZQKOZAJNGTVKC-NBYUQASBSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K21997380	BRD-K21997380-001-01-5	Broad Institute of MIT and Harvard	BRD-K21997380			C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20-/m0/s1	VZQKOZAJNGTVKC-NBYUQASBSA-N	419.242021186							118648
BRD-K76691746	LSM-30098		54639644	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20-,22+/m1/s1	KDMIEVSCRLGCNO-SJBKTWHCSA-N	Cc1ccccc1S(=O)(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)c4ccc(F)cc4)O[C@H]2CO	BroadT	BRD-K76691746	BRD-K76691746-001-01-7	Broad Institute of MIT and Harvard	BRD-K76691746			Cc1ccccc1S(=O)(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@H]1CO	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20-,22+/m1/s1	KDMIEVSCRLGCNO-SJBKTWHCSA-N	474.173704274							118649
BRD-K34604755	LSM-30099		54639725	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21+,22+/m1/s1	VIRGWJWOQCDSPY-FSSWDIPSSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@H](CCNC(=O)CCN3CCCCC3)O[C@H]2CO)cc1	BroadT	BRD-K34604755	BRD-K34604755-001-01-9	Broad Institute of MIT and Harvard	BRD-K34604755			COc1ccc(NC(=O)N[C@H]2CC[C@H](CCNC(=O)CCN3CCCCC3)O[C@H]2CO)cc1	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21+,22+/m1/s1	VIRGWJWOQCDSPY-FSSWDIPSSA-N	462.284220356							118650
BRD-K07390518	LSM-30100		54639714	InChI=1S/C24H26N2O7/c1-30-17-5-2-15(3-6-17)12-25-23(28)11-18-7-8-19(22(13-27)33-18)26-24(29)16-4-9-20-21(10-16)32-14-31-20/h2-10,18-19,22,27H,11-14H2,1H3,(H,25,28)(H,26,29)/t18-,19+,22-/m1/s1	SJKHPSVPSLXDSV-XQBPLPMBSA-N	COc1ccc(CNC(=O)C[C@@H]2O[C@H](CO)[C@@H](NC(=O)c3ccc4OCOc4c3)C=C2)cc1	BroadT	BRD-K07390518	BRD-K07390518-001-01-6	Broad Institute of MIT and Harvard	BRD-K07390518			COc1ccc(CNC(=O)C[C@@H]2O[C@H](CO)[C@@H](NC(=O)c3ccc4OCOc4c3)C=C2)cc1	InChI=1S/C24H26N2O7/c1-30-17-5-2-15(3-6-17)12-25-23(28)11-18-7-8-19(22(13-27)33-18)26-24(29)16-4-9-20-21(10-16)32-14-31-20/h2-10,18-19,22,27H,11-14H2,1H3,(H,25,28)(H,26,29)/t18-,19+,22-/m1/s1	SJKHPSVPSLXDSV-XQBPLPMBSA-N	454.174001192							118651
BRD-K74789550	LSM-30101		54639485	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13-,14+/m1/s1	DVRCOHXMQROJRA-MCIONIFRSA-N	COCC(=O)N[C@@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K74789550	BRD-K74789550-001-01-6	Broad Institute of MIT and Harvard	BRD-K74789550			COCC(=O)N[C@@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13-,14+/m1/s1	DVRCOHXMQROJRA-MCIONIFRSA-N	328.199822016							118652
BRD-K93148720	LSM-30102		54639498	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18-,20-/m0/s1	BZALQHWMPIGLLK-QRFRQXIXSA-N	OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K93148720	BRD-K93148720-001-01-7	Broad Institute of MIT and Harvard	BRD-K93148720			OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18-,20-/m0/s1	BZALQHWMPIGLLK-QRFRQXIXSA-N	468.2184265							118653
BRD-K39206254	LSM-30103		54639582	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20+,21+/m1/s1	TXCGFGBWYOSXMX-HKBOAZHASA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)CC[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K39206254	BRD-K39206254-001-01-4	Broad Institute of MIT and Harvard	BRD-K39206254			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20+,21+/m1/s1	TXCGFGBWYOSXMX-HKBOAZHASA-N	414.195485564							118654
BRD-K81457218	LSM-30104		54639642	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20+,22+/m1/s1	KDMIEVSCRLGCNO-URVUXULASA-N	Cc1ccccc1S(=O)(=O)N[C@H]2CC[C@H](CCn3cc(nn3)c4ccc(F)cc4)O[C@H]2CO	BroadT	BRD-K81457218	BRD-K81457218-001-01-5	Broad Institute of MIT and Harvard	BRD-K81457218			Cc1ccccc1S(=O)(=O)N[C@H]1CC[C@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@H]1CO	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20+,22+/m1/s1	KDMIEVSCRLGCNO-URVUXULASA-N	474.173704274							118655
BRD-K97576000	LSM-30105		54639536	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18-,19-/m1/s1	JUDGCNLDIJTAJU-ATZDWAIDSA-N	CCCc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3ccccc3F)[C@@H](CO)O2)nn1	BroadT	BRD-K97576000	BRD-K97576000-001-01-6	Broad Institute of MIT and Harvard	BRD-K97576000			CCCc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3ccccc3F)[C@@H](CO)O2)nn1	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18-,19-/m1/s1	JUDGCNLDIJTAJU-ATZDWAIDSA-N	405.217618006							118656
BRD-K01222707	LSM-30106		54639778	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17+,18-/m1/s1	ISYSKPLJKWXOBQ-BPQIPLTHSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K01222707	BRD-K01222707-001-01-8	Broad Institute of MIT and Harvard	BRD-K01222707			CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17+,18-/m1/s1	ISYSKPLJKWXOBQ-BPQIPLTHSA-N	411.182791748							118657
BRD-K41322154	LSM-30107		54639698	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20+/m0/s1	VZQKOZAJNGTVKC-OJAHFUOMSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K41322154	BRD-K41322154-001-01-6	Broad Institute of MIT and Harvard	BRD-K41322154			C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20+/m0/s1	VZQKOZAJNGTVKC-OJAHFUOMSA-N	419.242021186							118658
BRD-K18316646	LSM-30108		54639645	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20-,22-/m1/s1	KDMIEVSCRLGCNO-KCZVDYSFSA-N	Cc1ccccc1S(=O)(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)c4ccc(F)cc4)O[C@@H]2CO	BroadT	BRD-K18316646	BRD-K18316646-001-01-3	Broad Institute of MIT and Harvard	BRD-K18316646			Cc1ccccc1S(=O)(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20-,22-/m1/s1	KDMIEVSCRLGCNO-KCZVDYSFSA-N	474.173704274							118659
BRD-K93483334	LSM-30109		54639499	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18-,20+/m0/s1	BZALQHWMPIGLLK-XKGZKEIXSA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K93483334	BRD-K93483334-001-01-6	Broad Institute of MIT and Harvard	BRD-K93483334			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18-,20+/m0/s1	BZALQHWMPIGLLK-XKGZKEIXSA-N	468.2184265							118660
BRD-K04652643	LSM-30110		54639606	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20-,21-/m0/s1	JLSMJUFCCBIUFG-ACRUOGEOSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)C4CCOCC4	BroadT	BRD-K04652643	BRD-K04652643-001-01-0	Broad Institute of MIT and Harvard	BRD-K04652643			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20-,21-/m0/s1	JLSMJUFCCBIUFG-ACRUOGEOSA-N	416.231122144							118661
BRD-K36282114	LSM-30111		54639728	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21-,22-/m1/s1	VIRGWJWOQCDSPY-YPAWHYETSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCNC(=O)CCN3CCCCC3)O[C@@H]2CO)cc1	BroadT	BRD-K36282114	BRD-K36282114-001-01-8	Broad Institute of MIT and Harvard	BRD-K36282114			COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCNC(=O)CCN3CCCCC3)O[C@@H]2CO)cc1	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21-,22-/m1/s1	VIRGWJWOQCDSPY-YPAWHYETSA-N	462.284220356							118662
BRD-K67817697	LSM-30112		54639765	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19+,20+/m1/s1	ORVKPQZRJOTCIB-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K67817697	BRD-K67817697-001-01-8	Broad Institute of MIT and Harvard	BRD-K67817697			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19+,20+/m1/s1	ORVKPQZRJOTCIB-AABGKKOBSA-N	481.162469046							118663
BRD-K68470956	LSM-30113		54639550	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13+,14+/m0/s1	JWTJGHMNSRUWKB-BFHYXJOUSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCC3CC3)O[C@@H]2CO	BroadT	BRD-K68470956	BRD-K68470956-001-01-1	Broad Institute of MIT and Harvard	BRD-K68470956			Cn1cnc(c1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCC2CC2)O[C@@H]1CO	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13+,14+/m0/s1	JWTJGHMNSRUWKB-BFHYXJOUSA-N	384.146740598							118664
BRD-K91577886	LSM-30114		54639553	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13-,14-/m0/s1	JWTJGHMNSRUWKB-IHRRRGAJSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NCC3CC3)O[C@H]2CO	BroadT	BRD-K91577886	BRD-K91577886-001-01-9	Broad Institute of MIT and Harvard	BRD-K91577886			Cn1cnc(c1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCC2CC2)O[C@H]1CO	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13-,14-/m0/s1	JWTJGHMNSRUWKB-IHRRRGAJSA-N	384.146740598							118665
BRD-K45421483	LSM-30115		54639691	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20-/m1/s1	VZQKOZAJNGTVKC-VBSBHUPXSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K45421483	BRD-K45421483-001-01-4	Broad Institute of MIT and Harvard	BRD-K45421483			C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20-/m1/s1	VZQKOZAJNGTVKC-VBSBHUPXSA-N	419.242021186							118666
BRD-K71870778	LSM-30116		54639696	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20+/m1/s1	VZQKOZAJNGTVKC-AFYVEPGGSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K71870778	BRD-K71870778-001-01-3	Broad Institute of MIT and Harvard	BRD-K71870778			C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20+/m1/s1	VZQKOZAJNGTVKC-AFYVEPGGSA-N	419.242021186							118667
BRD-K11631946	LSM-30117		54639535	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18+,19+/m1/s1	JUDGCNLDIJTAJU-MNEFBYGVSA-N	CCCc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3ccccc3F)[C@H](CO)O2)nn1	BroadT	BRD-K11631946	BRD-K11631946-001-01-9	Broad Institute of MIT and Harvard	BRD-K11631946			CCCc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3ccccc3F)[C@H](CO)O2)nn1	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18+,19+/m1/s1	JUDGCNLDIJTAJU-MNEFBYGVSA-N	405.217618006							118668
BRD-K26850845	LSM-30118		54639605	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20-,21-/m1/s1	JLSMJUFCCBIUFG-NJDAHSKKSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)C4CCOCC4	BroadT	BRD-K26850845	BRD-K26850845-001-01-0	Broad Institute of MIT and Harvard	BRD-K26850845			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20-,21-/m1/s1	JLSMJUFCCBIUFG-NJDAHSKKSA-N	416.231122144							118669
BRD-K27881453	LSM-30119		54639743	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13-,14-/m0/s1	YUDVUYFJPOOWEQ-IHRRRGAJSA-N	CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)NC2CCC2)O[C@H]1CO	BroadT	BRD-K27881453	BRD-K27881453-001-01-7	Broad Institute of MIT and Harvard	BRD-K27881453			CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)NC2CCC2)O[C@H]1CO	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13-,14-/m0/s1	YUDVUYFJPOOWEQ-IHRRRGAJSA-N	327.215806438							118670
BRD-K47217000	LSM-30120		54639782	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18-,22+/m0/s1	RAMPQQLLROWEJQ-SGXKBVARSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CCNC(=O)c3ccc4OCOc4c3)O[C@@H]2CO	BroadT	BRD-K47217000	BRD-K47217000-001-01-8	Broad Institute of MIT and Harvard	BRD-K47217000			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CCNC(=O)c2ccc3OCOc3c2)O[C@@H]1CO	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18-,22+/m0/s1	RAMPQQLLROWEJQ-SGXKBVARSA-N	471.200550298							118671
BRD-K26431593	LSM-30121		54639752	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15-,16+/m0/s1	FOYMHNRGVNUWHD-HRCADAONSA-N	CCC(=O)N[C@H]1CC[C@@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	BroadT	BRD-K26431593	BRD-K26431593-001-01-3	Broad Institute of MIT and Harvard	BRD-K26431593			CCC(=O)N[C@H]1CC[C@@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15-,16+/m0/s1	FOYMHNRGVNUWHD-HRCADAONSA-N	355.247106566							118672
BRD-K69387464	LSM-30122		54639709	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20+,21-/m0/s1	HGNKQCISEGSFPB-WMQCIHAUSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCc3ccccc3F)O[C@H]2CO	BroadT	BRD-K69387464	BRD-K69387464-001-01-1	Broad Institute of MIT and Harvard	BRD-K69387464			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20+,21-/m0/s1	HGNKQCISEGSFPB-WMQCIHAUSA-N	448.14682081							118673
BRD-K57468571	LSM-30123		54639580	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18+,19-/m0/s1	DCOUIHVSHDCYLI-UHOSZYNNSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K57468571	BRD-K57468571-001-01-3	Broad Institute of MIT and Harvard	BRD-K57468571			OC[C@@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18+,19-/m0/s1	DCOUIHVSHDCYLI-UHOSZYNNSA-N	454.137398978							118674
BRD-K20028734	LSM-30124		54639614	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14+,15+/m1/s1	XITZEOXYAYTYOD-SNPRPXQTSA-N	CN(C)C(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2)[C@H](CO)O1	BroadT	BRD-K20028734	BRD-K20028734-001-01-3	Broad Institute of MIT and Harvard	BRD-K20028734			CN(C)C(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2)[C@H](CO)O1	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14+,15+/m1/s1	XITZEOXYAYTYOD-SNPRPXQTSA-N	356.140592578							118675
BRD-K96120749	LSM-30125		54639532	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15-,18+/m0/s1	AWOFXEOJWLHGJO-DHSIGJKJSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K96120749	BRD-K96120749-001-01-0	Broad Institute of MIT and Harvard	BRD-K96120749			OC[C@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15-,18+/m0/s1	AWOFXEOJWLHGJO-DHSIGJKJSA-N	435.171810666							118676
BRD-K51454545	LSM-30126		54639501	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18+,20-/m1/s1	BZALQHWMPIGLLK-IMFGXOCKSA-N	OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K51454545	BRD-K51454545-001-01-2	Broad Institute of MIT and Harvard	BRD-K51454545			OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18+,20-/m1/s1	BZALQHWMPIGLLK-IMFGXOCKSA-N	468.2184265							118677
BRD-K12106433	LSM-30127		54639738	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24+,25-/m1/s1	DSJATXUDYPTXRQ-PZUNEJSGSA-N	CN(C)Cc1cn(CC[C@H]2CC[C@H](NS(=O)(=O)c3ccc(cc3)c4ccccc4)[C@@H](CO)O2)nn1	BroadT	BRD-K12106433	BRD-K12106433-001-01-1	Broad Institute of MIT and Harvard	BRD-K12106433			CN(C)Cc1cn(CC[C@H]2CC[C@H](NS(=O)(=O)c3ccc(cc3)-c3ccccc3)[C@@H](CO)O2)nn1	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24+,25-/m1/s1	DSJATXUDYPTXRQ-PZUNEJSGSA-N	499.225325276							118678
BRD-K52017042	LSM-30128		54639648	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20+,22-/m0/s1	KDMIEVSCRLGCNO-VWPQPMDRSA-N	Cc1ccccc1S(=O)(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)c4ccc(F)cc4)O[C@H]2CO	BroadT	BRD-K52017042	BRD-K52017042-001-01-4	Broad Institute of MIT and Harvard	BRD-K52017042			Cc1ccccc1S(=O)(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@H]1CO	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20+,22-/m0/s1	KDMIEVSCRLGCNO-VWPQPMDRSA-N	474.173704274							118679
BRD-K47349976	LSM-30129		54639660	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18+,20-/m1/s1	VAIOXDFGBLKFCW-WSTZPKSXSA-N	COc1ccccc1S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NCc3cc(F)cc(F)c3)O[C@@H]2CO	BroadT	BRD-K47349976	BRD-K47349976-001-01-9	Broad Institute of MIT and Harvard	BRD-K47349976			COc1ccccc1S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@@H]1CO	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18+,20-/m1/s1	VAIOXDFGBLKFCW-WSTZPKSXSA-N	482.132313598							118680
BRD-K40143134	LSM-30130		54639500	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18-,20+/m1/s1	BZALQHWMPIGLLK-POAQFYNOSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K40143134	BRD-K40143134-001-01-2	Broad Institute of MIT and Harvard	BRD-K40143134			OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18-,20+/m1/s1	BZALQHWMPIGLLK-POAQFYNOSA-N	468.2184265							118681
BRD-K05286676	LSM-30131		54639595	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12+,13-/m0/s1	CZGVFFSNBHAYON-UHTWSYAYSA-N	COC(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccccc2F)C=C1	BroadT	BRD-K05286676	BRD-K05286676-001-01-6	Broad Institute of MIT and Harvard	BRD-K05286676			COC(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccccc2F)C=C1	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12+,13-/m0/s1	CZGVFFSNBHAYON-UHTWSYAYSA-N	359.083886196							118682
BRD-K84170953	LSM-30132		54639703	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20+,21+/m1/s1	HGNKQCISEGSFPB-QMMLZNLJSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NCc3ccccc3F)O[C@H]2CO	BroadT	BRD-K84170953	BRD-K84170953-001-01-0	Broad Institute of MIT and Harvard	BRD-K84170953			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20+,21+/m1/s1	HGNKQCISEGSFPB-QMMLZNLJSA-N	448.14682081							118683
BRD-K41025232	LSM-30133		54639608	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20-,21+/m1/s1	JLSMJUFCCBIUFG-NJYVYQBISA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)C4CCOCC4	BroadT	BRD-K41025232	BRD-K41025232-001-01-1	Broad Institute of MIT and Harvard	BRD-K41025232			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20-,21+/m1/s1	JLSMJUFCCBIUFG-NJYVYQBISA-N	416.231122144							118684
BRD-K85546819	LSM-30134		54639627	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18-,19-/m1/s1	UTNFYOAWBFBPFR-GUDVDZBRSA-N	COc1cccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccncn3)O[C@@H]2CO)c1	BroadT	BRD-K85546819	BRD-K85546819-001-01-4	Broad Institute of MIT and Harvard	BRD-K85546819			COc1cccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccncn3)O[C@@H]2CO)c1	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18-,19-/m1/s1	UTNFYOAWBFBPFR-GUDVDZBRSA-N	429.201219014							118685
BRD-K60188481	LSM-30135		54639724	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21+,22+/m0/s1	VIRGWJWOQCDSPY-BHDDXSALSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CCNC(=O)CCN3CCCCC3)O[C@@H]2CO)cc1	BroadT	BRD-K60188481	BRD-K60188481-001-01-1	Broad Institute of MIT and Harvard	BRD-K60188481			COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CCNC(=O)CCN3CCCCC3)O[C@@H]2CO)cc1	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21+,22+/m0/s1	VIRGWJWOQCDSPY-BHDDXSALSA-N	462.284220356							118686
BRD-K23553911	LSM-30136		54639786	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18-,22-/m0/s1	RAMPQQLLROWEJQ-ZJBJCVSYSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CCNC(=O)c3ccc4OCOc4c3)O[C@H]2CO	BroadT	BRD-K23553911	BRD-K23553911-001-01-2	Broad Institute of MIT and Harvard	BRD-K23553911			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CCNC(=O)c2ccc3OCOc3c2)O[C@H]1CO	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18-,22-/m0/s1	RAMPQQLLROWEJQ-ZJBJCVSYSA-N	471.200550298							118687
BRD-K53293966	LSM-30137		54639737	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24-,25-/m0/s1	DSJATXUDYPTXRQ-HVCNVCAESA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)c3ccc(cc3)c4ccccc4)[C@H](CO)O2)nn1	BroadT	BRD-K53293966	BRD-K53293966-001-01-2	Broad Institute of MIT and Harvard	BRD-K53293966			CN(C)Cc1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)c3ccc(cc3)-c3ccccc3)[C@H](CO)O2)nn1	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24-,25-/m0/s1	DSJATXUDYPTXRQ-HVCNVCAESA-N	499.225325276							118688
BRD-K01022714	LSM-30138		54639689	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20+/m1/s1	VZQKOZAJNGTVKC-LMCOJAPRSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K01022714	BRD-K01022714-001-01-3	Broad Institute of MIT and Harvard	BRD-K01022714			C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20+/m1/s1	VZQKOZAJNGTVKC-LMCOJAPRSA-N	419.242021186							118689
BRD-K01691949	LSM-30139		54639504	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20+,21+/m1/s1	GOYHAEMMGZTJNJ-GIVPXCGWSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K01691949	BRD-K01691949-001-01-2	Broad Institute of MIT and Harvard	BRD-K01691949			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20+,21+/m1/s1	GOYHAEMMGZTJNJ-GIVPXCGWSA-N	453.22974194							118690
BRD-K27719710	LSM-30140		54639733	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24+,25+/m1/s1	DSJATXUDYPTXRQ-VJTSUQJLSA-N	CN(C)Cc1cn(CC[C@H]2CC[C@H](NS(=O)(=O)c3ccc(cc3)c4ccccc4)[C@H](CO)O2)nn1	BroadT	BRD-K27719710	BRD-K27719710-001-01-8	Broad Institute of MIT and Harvard	BRD-K27719710			CN(C)Cc1cn(CC[C@H]2CC[C@H](NS(=O)(=O)c3ccc(cc3)-c3ccccc3)[C@H](CO)O2)nn1	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24+,25+/m1/s1	DSJATXUDYPTXRQ-VJTSUQJLSA-N	499.225325276							118691
BRD-K11990377	LSM-30141		54639633	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16+/m0/s1	ZOKIFIDHVZYURK-ARFHVFGLSA-N	CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	BroadT	BRD-K11990377	BRD-K11990377-001-01-7	Broad Institute of MIT and Harvard	BRD-K11990377			CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16+/m0/s1	ZOKIFIDHVZYURK-ARFHVFGLSA-N	338.22055746							118692
BRD-K36099605	LSM-30142		54639682	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22-,23-/m0/s1	NCDVBILORYBSFZ-PMVMPFDFSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2CO	BroadT	BRD-K36099605	BRD-K36099605-001-01-2	Broad Institute of MIT and Harvard	BRD-K36099605			COc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCc3ccccc3C2)O[C@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22-,23-/m0/s1	NCDVBILORYBSFZ-PMVMPFDFSA-N	472.166807326							118693
BRD-K72194126	LSM-30143		54639748	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15+,16+/m0/s1	FOYMHNRGVNUWHD-ARFHVFGLSA-N	CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	BroadT	BRD-K72194126	BRD-K72194126-001-01-6	Broad Institute of MIT and Harvard	BRD-K72194126			CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15+,16+/m0/s1	FOYMHNRGVNUWHD-ARFHVFGLSA-N	355.247106566							118694
BRD-K43159427	LSM-30144		54639492	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16-,17+/m0/s1	WWDDUWFGCORCPA-YESZJQIVSA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)C3CC3	BroadT	BRD-K43159427	BRD-K43159427-001-01-1	Broad Institute of MIT and Harvard	BRD-K43159427			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)C1CC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16-,17+/m0/s1	WWDDUWFGCORCPA-YESZJQIVSA-N	383.242021186							118695
BRD-K95666495	LSM-30145		54639584	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20-,21-/m0/s1	TXCGFGBWYOSXMX-ACRUOGEOSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)CC[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K95666495	BRD-K95666495-001-01-9	Broad Institute of MIT and Harvard	BRD-K95666495			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20-,21-/m0/s1	TXCGFGBWYOSXMX-ACRUOGEOSA-N	414.195485564							118696
BRD-K60631127	LSM-30146		54639594	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12+,13-/m1/s1	CZGVFFSNBHAYON-KGYLQXTDSA-N	COC(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccccc2F)C=C1	BroadT	BRD-K60631127	BRD-K60631127-001-01-0	Broad Institute of MIT and Harvard	BRD-K60631127			COC(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccccc2F)C=C1	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12+,13-/m1/s1	CZGVFFSNBHAYON-KGYLQXTDSA-N	359.083886196							118697
BRD-K44921931	LSM-30147		54639746	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13+,14-/m1/s1	YUDVUYFJPOOWEQ-HZSPNIEDSA-N	CCCNC(=O)N[C@H]1CC[C@H](CC(=O)NC2CCC2)O[C@@H]1CO	BroadT	BRD-K44921931	BRD-K44921931-001-01-2	Broad Institute of MIT and Harvard	BRD-K44921931			CCCNC(=O)N[C@H]1CC[C@H](CC(=O)NC2CCC2)O[C@@H]1CO	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13+,14-/m1/s1	YUDVUYFJPOOWEQ-HZSPNIEDSA-N	327.215806438							118698
BRD-K75178679	LSM-30148		54639576	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18-,19-/m1/s1	DCOUIHVSHDCYLI-BHIYHBOVSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K75178679	BRD-K75178679-001-01-7	Broad Institute of MIT and Harvard	BRD-K75178679			OC[C@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18-,19-/m1/s1	DCOUIHVSHDCYLI-BHIYHBOVSA-N	454.137398978							118699
BRD-K27347421	LSM-30149		54639722	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17+,18-/m1/s1	HBUPPCLFCIMQJL-FGTMMUONSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H](NC(=O)Cc3ccccn3)[C@@H](CO)O2	BroadT	BRD-K27347421	BRD-K27347421-001-01-8	Broad Institute of MIT and Harvard	BRD-K27347421			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17+,18-/m1/s1	HBUPPCLFCIMQJL-FGTMMUONSA-N	390.22670548							118700
BRD-K80888628	LSM-30150		54639794	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19+,20-/m0/s1	SOXWEHYVEMBZTM-SXLOBPIMSA-N	OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K80888628	BRD-K80888628-001-01-6	Broad Institute of MIT and Harvard	BRD-K80888628			OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19+,20-/m0/s1	SOXWEHYVEMBZTM-SXLOBPIMSA-N	485.11874753							118701
BRD-K50603336	LSM-30151		54639625	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18+,19+/m0/s1	UTNFYOAWBFBPFR-IPMKNSEASA-N	COc1cccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccncn3)O[C@@H]2CO)c1	BroadT	BRD-K50603336	BRD-K50603336-001-01-8	Broad Institute of MIT and Harvard	BRD-K50603336			COc1cccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccncn3)O[C@@H]2CO)c1	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18+,19+/m0/s1	UTNFYOAWBFBPFR-IPMKNSEASA-N	429.201219014							118702
BRD-K30318008	LSM-30152		54639612	InChI=1S/C19H28N2O5S/c1-2-27(24,25)21-17-8-7-16(26-18(17)12-22)11-19(23)20-15-9-13-5-3-4-6-14(13)10-15/h3-6,15-18,21-22H,2,7-12H2,1H3,(H,20,23)/t16-,17-,18+/m1/s1	LZGNPRRVNFVBRK-KURKYZTESA-N	CCS(=O)(=O)N[C@@H]1CC[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	BroadT	BRD-K30318008	BRD-K30318008-001-01-5	Broad Institute of MIT and Harvard	BRD-K30318008			CCS(=O)(=O)N[C@@H]1CC[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C19H28N2O5S/c1-2-27(24,25)21-17-8-7-16(26-18(17)12-22)11-19(23)20-15-9-13-5-3-4-6-14(13)10-15/h3-6,15-18,21-22H,2,7-12H2,1H3,(H,20,23)/t16-,17-,18+/m1/s1	LZGNPRRVNFVBRK-KURKYZTESA-N	396.171892706							118703
BRD-K79213964	LSM-30153		54639687	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20-/m0/s1	VZQKOZAJNGTVKC-RNQOJCNYSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K79213964	BRD-K79213964-001-01-2	Broad Institute of MIT and Harvard	BRD-K79213964			C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20-/m0/s1	VZQKOZAJNGTVKC-RNQOJCNYSA-N	419.242021186							118704
BRD-K49981566	LSM-30154		54639613	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14+,15+/m0/s1	XITZEOXYAYTYOD-NWANDNLSSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccccc2)[C@@H](CO)O1	BroadT	BRD-K49981566	BRD-K49981566-001-01-3	Broad Institute of MIT and Harvard	BRD-K49981566			CN(C)C(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccccc2)[C@@H](CO)O1	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14+,15+/m0/s1	XITZEOXYAYTYOD-NWANDNLSSA-N	356.140592578							118705
BRD-K82433264	LSM-30155		54639569	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19-,20-/m0/s1	XDZGUUVZSOVFIF-IHPCNDPISA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccncc3)O[C@H]2CO	BroadT	BRD-K82433264	BRD-K82433264-001-01-8	Broad Institute of MIT and Harvard	BRD-K82433264			COc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccncc2)O[C@H]1CO	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19-,20-/m0/s1	XDZGUUVZSOVFIF-IHPCNDPISA-N	449.162056304							118706
BRD-K30812092	LSM-30156		54639693	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20+/m1/s1	VZQKOZAJNGTVKC-GTAWCEEGSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K30812092	BRD-K30812092-001-01-4	Broad Institute of MIT and Harvard	BRD-K30812092			C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20+/m1/s1	VZQKOZAJNGTVKC-GTAWCEEGSA-N	419.242021186							118707
BRD-K10089296	LSM-30157		54639790	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19-,20+/m1/s1	SOXWEHYVEMBZTM-RLLQIKCJSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K10089296	BRD-K10089296-001-01-7	Broad Institute of MIT and Harvard	BRD-K10089296			OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19-,20+/m1/s1	SOXWEHYVEMBZTM-RLLQIKCJSA-N	485.11874753							118708
BRD-K14255526	LSM-30158		54639744	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13-,14+/m0/s1	YUDVUYFJPOOWEQ-MELADBBJSA-N	CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)NC2CCC2)O[C@@H]1CO	BroadT	BRD-K14255526	BRD-K14255526-001-01-2	Broad Institute of MIT and Harvard	BRD-K14255526			CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)NC2CCC2)O[C@@H]1CO	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13-,14+/m0/s1	YUDVUYFJPOOWEQ-MELADBBJSA-N	327.215806438							118709
BRD-K82506716	LSM-30159		54639626	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18+,19+/m1/s1	UTNFYOAWBFBPFR-QYZOEREBSA-N	COc1cccc(NC(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccncn3)O[C@H]2CO)c1	BroadT	BRD-K82506716	BRD-K82506716-001-01-5	Broad Institute of MIT and Harvard	BRD-K82506716			COc1cccc(NC(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccncn3)O[C@H]2CO)c1	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18+,19+/m1/s1	UTNFYOAWBFBPFR-QYZOEREBSA-N	429.201219014							118710
BRD-K10638173	LSM-30160		54639483	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13-,14-/m0/s1	DVRCOHXMQROJRA-IHRRRGAJSA-N	COCC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K10638173	BRD-K10638173-001-01-9	Broad Institute of MIT and Harvard	BRD-K10638173			COCC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13-,14-/m0/s1	DVRCOHXMQROJRA-IHRRRGAJSA-N	328.199822016							118711
BRD-K43364707	LSM-30161		54639715	InChI=1S/C24H26N2O7/c1-30-17-5-2-15(3-6-17)12-25-23(28)11-18-7-8-19(22(13-27)33-18)26-24(29)16-4-9-20-21(10-16)32-14-31-20/h2-10,18-19,22,27H,11-14H2,1H3,(H,25,28)(H,26,29)/t18-,19+,22-/m0/s1	SJKHPSVPSLXDSV-JQVVWYNYSA-N	COc1ccc(CNC(=O)C[C@H]2O[C@@H](CO)[C@H](NC(=O)c3ccc4OCOc4c3)C=C2)cc1	BroadT	BRD-K43364707	BRD-K43364707-001-01-8	Broad Institute of MIT and Harvard	BRD-K43364707			COc1ccc(CNC(=O)C[C@H]2O[C@@H](CO)[C@H](NC(=O)c3ccc4OCOc4c3)C=C2)cc1	InChI=1S/C24H26N2O7/c1-30-17-5-2-15(3-6-17)12-25-23(28)11-18-7-8-19(22(13-27)33-18)26-24(29)16-4-9-20-21(10-16)32-14-31-20/h2-10,18-19,22,27H,11-14H2,1H3,(H,25,28)(H,26,29)/t18-,19+,22-/m0/s1	SJKHPSVPSLXDSV-JQVVWYNYSA-N	454.174001192							118712
BRD-K33204113	LSM-30162		54639597	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16-,17-/m1/s1	FADSLUGYRKRULA-BRWVUGGUSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2CC[C@H](CCNC(=O)C3CCOCC3)O[C@@H]2CO	BroadT	BRD-K33204113	BRD-K33204113-001-01-6	Broad Institute of MIT and Harvard	BRD-K33204113			Cc1noc(C)c1NC(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16-,17-/m1/s1	FADSLUGYRKRULA-BRWVUGGUSA-N	424.232184784							118713
BRD-K71015709	LSM-30163		54639757	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19+/m1/s1	NAYAIYZQZRPBRZ-MNEFBYGVSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K71015709	BRD-K71015709-001-01-9	Broad Institute of MIT and Harvard	BRD-K71015709			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)c1cccnc1	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19+/m1/s1	NAYAIYZQZRPBRZ-MNEFBYGVSA-N	449.090911602							118714
BRD-K02783902	LSM-30164		54639488	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16+,17+/m0/s1	WWDDUWFGCORCPA-GVDBMIGSSA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)C3CC3	BroadT	BRD-K02783902	BRD-K02783902-001-01-1	Broad Institute of MIT and Harvard	BRD-K02783902			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)C1CC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16+,17+/m0/s1	WWDDUWFGCORCPA-GVDBMIGSSA-N	383.242021186							118715
BRD-K73608149	LSM-30165		54639751	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15-,16-/m0/s1	FOYMHNRGVNUWHD-JYJNAYRXSA-N	CCC(=O)N[C@H]1CC[C@@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	BroadT	BRD-K73608149	BRD-K73608149-001-01-7	Broad Institute of MIT and Harvard	BRD-K73608149			CCC(=O)N[C@H]1CC[C@@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15-,16-/m0/s1	FOYMHNRGVNUWHD-JYJNAYRXSA-N	355.247106566							118716
BRD-K86995890	LSM-30166		54639756	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19+/m0/s1	NAYAIYZQZRPBRZ-KFKAGJAMSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K86995890	BRD-K86995890-001-01-4	Broad Institute of MIT and Harvard	BRD-K86995890			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NC(=O)c1cccnc1	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19+/m0/s1	NAYAIYZQZRPBRZ-KFKAGJAMSA-N	449.090911602							118717
BRD-K54712090	LSM-30167		54639705	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20-,21-/m0/s1	HGNKQCISEGSFPB-YYWHXJBOSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NCc3ccccc3F)O[C@H]2CO	BroadT	BRD-K54712090	BRD-K54712090-001-01-9	Broad Institute of MIT and Harvard	BRD-K54712090			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20-,21-/m0/s1	HGNKQCISEGSFPB-YYWHXJBOSA-N	448.14682081							118718
BRD-K17060750	LSM-30168		54639665	InChI=1S/C19H29FN4O4/c1-24(2)11-18(26)23-16-8-7-15(28-17(16)12-25)9-10-21-19(27)22-14-5-3-13(20)4-6-14/h3-6,15-17,25H,7-12H2,1-2H3,(H,23,26)(H2,21,22,27)/t15-,16+,17-/m0/s1	HVYAXUQBEQKNPC-BBWFWOEESA-N	CN(C)CC(=O)N[C@@H]1CC[C@@H](CCNC(=O)Nc2ccc(F)cc2)O[C@H]1CO	BroadT	BRD-K17060750	BRD-K17060750-001-01-0	Broad Institute of MIT and Harvard	BRD-K17060750			CN(C)CC(=O)N[C@@H]1CC[C@@H](CCNC(=O)Nc2ccc(F)cc2)O[C@H]1CO	InChI=1S/C19H29FN4O4/c1-24(2)11-18(26)23-16-8-7-15(28-17(16)12-25)9-10-21-19(27)22-14-5-3-13(20)4-6-14/h3-6,15-17,25H,7-12H2,1-2H3,(H,23,26)(H2,21,22,27)/t15-,16+,17-/m0/s1	HVYAXUQBEQKNPC-BBWFWOEESA-N	396.217283648							118719
BRD-K38189757	LSM-30169		54639721	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17-,18+/m1/s1	HBUPPCLFCIMQJL-KURKYZTESA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H](NC(=O)Cc3ccccn3)[C@H](CO)O2	BroadT	BRD-K38189757	BRD-K38189757-001-01-5	Broad Institute of MIT and Harvard	BRD-K38189757			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17-,18+/m1/s1	HBUPPCLFCIMQJL-KURKYZTESA-N	390.22670548							118720
BRD-K43271856	LSM-30170		54639603	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20+,21+/m0/s1	JLSMJUFCCBIUFG-PWRODBHTSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)C4CCOCC4	BroadT	BRD-K43271856	BRD-K43271856-001-01-4	Broad Institute of MIT and Harvard	BRD-K43271856			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20+,21+/m0/s1	JLSMJUFCCBIUFG-PWRODBHTSA-N	416.231122144							118721
BRD-K76937233	LSM-30171		54639770	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19+,20-/m1/s1	ORVKPQZRJOTCIB-HSALFYBXSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K76937233	BRD-K76937233-001-01-4	Broad Institute of MIT and Harvard	BRD-K76937233			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19+,20-/m1/s1	ORVKPQZRJOTCIB-HSALFYBXSA-N	481.162469046							118722
BRD-K33953218	LSM-30172		54639540	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18-,19+/m0/s1	JUDGCNLDIJTAJU-ZYSHUDEJSA-N	CCCc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3ccccc3F)[C@@H](CO)O2)nn1	BroadT	BRD-K33953218	BRD-K33953218-001-01-2	Broad Institute of MIT and Harvard	BRD-K33953218			CCCc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3ccccc3F)[C@@H](CO)O2)nn1	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18-,19+/m0/s1	JUDGCNLDIJTAJU-ZYSHUDEJSA-N	405.217618006							118723
BRD-K73462370	LSM-30173		54639561	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16-,17-/m0/s1	LHRABQACLPZHAR-ULQDDVLXSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K73462370	BRD-K73462370-001-01-9	Broad Institute of MIT and Harvard	BRD-K73462370			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16-,17-/m0/s1	LHRABQACLPZHAR-ULQDDVLXSA-N	379.190734542							118724
MLS003649974	LSM-30174	BRD-K42091424	53382637	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20+/m0/s1	VZQKOZAJNGTVKC-IJXRJRJASA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K42091424	BRD-K42091424-001-01-0	Broad Institute of MIT and Harvard	BRD-K42091424			C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20+/m0/s1	VZQKOZAJNGTVKC-IJXRJRJASA-N	419.242021186							118725
BRD-K20030272	LSM-30175		54639591	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12-,13-/m1/s1	CZGVFFSNBHAYON-RAIGVLPGSA-N	COC(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccccc2F)C=C1	BroadT	BRD-K20030272	BRD-K20030272-001-01-7	Broad Institute of MIT and Harvard	BRD-K20030272			COC(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccccc2F)C=C1	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12-,13-/m1/s1	CZGVFFSNBHAYON-RAIGVLPGSA-N	359.083886196							118726
BRD-K38752276	LSM-30176		54639658	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18-,20+/m0/s1	VAIOXDFGBLKFCW-CMKODMSKSA-N	COc1ccccc1S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NCc3cc(F)cc(F)c3)O[C@@H]2CO	BroadT	BRD-K38752276	BRD-K38752276-001-01-2	Broad Institute of MIT and Harvard	BRD-K38752276			COc1ccccc1S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@@H]1CO	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18-,20+/m0/s1	VAIOXDFGBLKFCW-CMKODMSKSA-N	482.132313598							118727
BRD-K81120201	LSM-30177		54639729	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21-,22-/m0/s1	VIRGWJWOQCDSPY-FKBYEOEOSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCNC(=O)CCN3CCCCC3)O[C@H]2CO)cc1	BroadT	BRD-K81120201	BRD-K81120201-001-01-8	Broad Institute of MIT and Harvard	BRD-K81120201			COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCNC(=O)CCN3CCCCC3)O[C@H]2CO)cc1	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21-,22-/m0/s1	VIRGWJWOQCDSPY-FKBYEOEOSA-N	462.284220356							118728
BRD-K19085288	LSM-30178		54639541	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18+,19-/m0/s1	JUDGCNLDIJTAJU-IPELMVKDSA-N	CCCc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3ccccc3F)[C@H](CO)O2)nn1	BroadT	BRD-K19085288	BRD-K19085288-001-01-6	Broad Institute of MIT and Harvard	BRD-K19085288			CCCc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3ccccc3F)[C@H](CO)O2)nn1	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18+,19-/m0/s1	JUDGCNLDIJTAJU-IPELMVKDSA-N	405.217618006							118729
BRD-K03902845	LSM-30179		54639572	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19+,20-/m1/s1	XDZGUUVZSOVFIF-YZGWKJHDSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccncc3)O[C@@H]2CO	BroadT	BRD-K03902845	BRD-K03902845-001-01-6	Broad Institute of MIT and Harvard	BRD-K03902845			COc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccncc2)O[C@@H]1CO	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19+,20-/m1/s1	XDZGUUVZSOVFIF-YZGWKJHDSA-N	449.162056304							118730
BRD-K25226763	LSM-30180		54639652	InChI=1S/C16H25ClN2O6S2/c1-2-26(21,22)18-9-8-13-6-7-15(16(11-20)25-13)19-27(23,24)14-5-3-4-12(17)10-14/h3-5,10,13,15-16,18-20H,2,6-9,11H2,1H3/t13-,15-,16-/m0/s1	PCAWZXQDZTWTAN-BPUTZDHNSA-N	CCS(=O)(=O)NCC[C@@H]1CC[C@H](NS(=O)(=O)c2cccc(Cl)c2)[C@H](CO)O1	BroadT	BRD-K25226763	BRD-K25226763-001-01-2	Broad Institute of MIT and Harvard	BRD-K25226763			CCS(=O)(=O)NCC[C@@H]1CC[C@H](NS(=O)(=O)c2cccc(Cl)c2)[C@H](CO)O1	InChI=1S/C16H25ClN2O6S2/c1-2-26(21,22)18-9-8-13-6-7-15(16(11-20)25-13)19-27(23,24)14-5-3-4-12(17)10-14/h3-5,10,13,15-16,18-20H,2,6-9,11H2,1H3/t13-,15-,16-/m0/s1	PCAWZXQDZTWTAN-BPUTZDHNSA-N	440.08425563							118731
BRD-K72146456	LSM-30181		54639592	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12-,13-/m0/s1	CZGVFFSNBHAYON-DRZSPHRISA-N	COC(=O)C[C@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccccc2F)C=C1	BroadT	BRD-K72146456	BRD-K72146456-001-01-6	Broad Institute of MIT and Harvard	BRD-K72146456			COC(=O)C[C@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccccc2F)C=C1	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12-,13-/m0/s1	CZGVFFSNBHAYON-DRZSPHRISA-N	359.083886196							118732
BRD-K40210962	LSM-30182		54639777	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17-,18+/m1/s1	ISYSKPLJKWXOBQ-NXHRZFHOSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K40210962	BRD-K40210962-001-01-6	Broad Institute of MIT and Harvard	BRD-K40210962			CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17-,18+/m1/s1	ISYSKPLJKWXOBQ-NXHRZFHOSA-N	411.182791748							118733
BRD-K74095559	LSM-30183		54639601	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16+,17-/m1/s1	FADSLUGYRKRULA-IXDOHACOSA-N	Cc1onc(C)c1NC(=O)N[C@H]2CC[C@H](CCNC(=O)C3CCOCC3)O[C@@H]2CO	BroadT	BRD-K74095559	BRD-K74095559-001-01-9	Broad Institute of MIT and Harvard	BRD-K74095559			Cc1noc(C)c1NC(=O)N[C@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16+,17-/m1/s1	FADSLUGYRKRULA-IXDOHACOSA-N	424.232184784							118734
BRD-K62800316	LSM-30184		54639672	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19+,21-/m1/s1	USSZBVMKFITLQI-LKUPVBHCSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3cccnc3)CC[C@@H]1NC(=O)c4ccccc4F	BroadT	BRD-K62800316	BRD-K62800316-001-01-0	Broad Institute of MIT and Harvard	BRD-K62800316			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2cccnc2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19+,21-/m1/s1	USSZBVMKFITLQI-LKUPVBHCSA-N	425.186317878							118735
BRD-K97939219	LSM-30185		54639759	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19-/m0/s1	NAYAIYZQZRPBRZ-SNRMKQJTSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K97939219	BRD-K97939219-001-01-3	Broad Institute of MIT and Harvard	BRD-K97939219			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)c1cccnc1	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19-/m0/s1	NAYAIYZQZRPBRZ-SNRMKQJTSA-N	449.090911602							118736
BRD-K29756429	LSM-30186		54639622	InChI=1S/C15H23F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h9-12,21H,1-8H2,(H,19,22)(H,20,23)/t10-,11-,12-/m1/s1	KNGQQLYZZKCBQO-IJLUTSLNSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)CC[C@H]1NC(=O)CC2CC2	BroadT	BRD-K29756429	BRD-K29756429-001-01-0	Broad Institute of MIT and Harvard	BRD-K29756429			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)CC[C@H]1NC(=O)CC1CC1	InChI=1S/C15H23F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h9-12,21H,1-8H2,(H,19,22)(H,20,23)/t10-,11-,12-/m1/s1	KNGQQLYZZKCBQO-IJLUTSLNSA-N	352.160991836							118737
BRD-K31836496	LSM-30187		54639554	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13-,14+/m0/s1	JWTJGHMNSRUWKB-MELADBBJSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NCC3CC3)O[C@@H]2CO	BroadT	BRD-K31836496	BRD-K31836496-001-01-4	Broad Institute of MIT and Harvard	BRD-K31836496			Cn1cnc(c1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCC2CC2)O[C@@H]1CO	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13-,14+/m0/s1	JWTJGHMNSRUWKB-MELADBBJSA-N	384.146740598							118738
BRD-K06398048	LSM-30188		54639678	InChI=1S/C22H26N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-13,19-21,24-25H,2,14-15H2,1H3,(H,23,26)/t19-,20-,21-/m0/s1	WANWEHJGGGHASC-ACRUOGEOSA-N	CCS(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)O[C@H]1CO	BroadT	BRD-K06398048	BRD-K06398048-001-01-9	Broad Institute of MIT and Harvard	BRD-K06398048			CCS(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C22H26N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-13,19-21,24-25H,2,14-15H2,1H3,(H,23,26)/t19-,20-,21-/m0/s1	WANWEHJGGGHASC-ACRUOGEOSA-N	430.156242642							118739
BRD-K91998226	LSM-30189		54639524	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16-,17-/m0/s1	IMWIUMROKHVEKK-ULQDDVLXSA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@H](NC(=O)Nc2ccccc2)[C@H](CO)O1	BroadT	BRD-K91998226	BRD-K91998226-001-01-6	Broad Institute of MIT and Harvard	BRD-K91998226			CC(C)NC(=O)NCC[C@@H]1CC[C@H](NC(=O)Nc2ccccc2)[C@H](CO)O1	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16-,17-/m0/s1	IMWIUMROKHVEKK-ULQDDVLXSA-N	378.22670548							118740
BRD-K38081867	LSM-30190		54639638	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16+/m1/s1	ZOKIFIDHVZYURK-OAGGEKHMSA-N	CCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	BroadT	BRD-K38081867	BRD-K38081867-001-01-1	Broad Institute of MIT and Harvard	BRD-K38081867			CCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16+/m1/s1	ZOKIFIDHVZYURK-OAGGEKHMSA-N	338.22055746							118741
MLS003649927	LSM-30191	BRD-K38417094	53382595	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12-,13+/m0/s1	CZGVFFSNBHAYON-WCFLWFBJSA-N	COC(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccccc2F)C=C1	BroadT	BRD-K38417094	BRD-K38417094-001-01-2	Broad Institute of MIT and Harvard	BRD-K38417094			COC(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccccc2F)C=C1	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12-,13+/m0/s1	CZGVFFSNBHAYON-WCFLWFBJSA-N	359.083886196							118742
BRD-K23232542	LSM-30192		54639764	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19+,20+/m0/s1	ORVKPQZRJOTCIB-XUVXKRRUSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K23232542	BRD-K23232542-001-01-0	Broad Institute of MIT and Harvard	BRD-K23232542			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19+,20+/m0/s1	ORVKPQZRJOTCIB-XUVXKRRUSA-N	481.162469046							118743
BRD-K22039769	LSM-30193		54639599	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16-,17+/m1/s1	FADSLUGYRKRULA-ZACQAIPSSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2CC[C@H](CCNC(=O)C3CCOCC3)O[C@H]2CO	BroadT	BRD-K22039769	BRD-K22039769-001-01-6	Broad Institute of MIT and Harvard	BRD-K22039769			Cc1noc(C)c1NC(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16-,17+/m1/s1	FADSLUGYRKRULA-ZACQAIPSSA-N	424.232184784							118744
BRD-K78596805	LSM-30194		54639719	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17-,18-/m0/s1	HBUPPCLFCIMQJL-BZSNNMDCSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H](NC(=O)Cc3ccccn3)[C@H](CO)O2	BroadT	BRD-K78596805	BRD-K78596805-001-01-4	Broad Institute of MIT and Harvard	BRD-K78596805			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@H](CO)O1	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17-,18-/m0/s1	HBUPPCLFCIMQJL-BZSNNMDCSA-N	390.22670548							118745
BRD-K41690760	LSM-30195		54639766	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19-,20-/m1/s1	ORVKPQZRJOTCIB-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K41690760	BRD-K41690760-001-01-2	Broad Institute of MIT and Harvard	BRD-K41690760			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19-,20-/m1/s1	ORVKPQZRJOTCIB-VAMGGRTRSA-N	481.162469046							118746
BRD-K23342427	LSM-30196		54639544	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17-,21+/m1/s1	KQJSIDVYPJWNIL-CEQIKUNHSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K23342427	BRD-K23342427-001-01-7	Broad Institute of MIT and Harvard	BRD-K23342427			OC[C@@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17-,21+/m1/s1	KQJSIDVYPJWNIL-CEQIKUNHSA-N	477.17114195							118747
BRD-K95148987	LSM-30197		54639761	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19-/m1/s1	NAYAIYZQZRPBRZ-AYOQOUSVSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K95148987	BRD-K95148987-001-01-3	Broad Institute of MIT and Harvard	BRD-K95148987			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)c1cccnc1	InChI=1S/C21H21Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-8,11,15,18-19,27H,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19-/m1/s1	NAYAIYZQZRPBRZ-AYOQOUSVSA-N	449.090911602							118748
BRD-K89515752	LSM-30198		54639557	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13+,14-/m0/s1	JWTJGHMNSRUWKB-MJBXVCDLSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCC3CC3)O[C@H]2CO	BroadT	BRD-K89515752	BRD-K89515752-001-01-4	Broad Institute of MIT and Harvard	BRD-K89515752			Cn1cnc(c1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCC2CC2)O[C@H]1CO	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13+,14-/m0/s1	JWTJGHMNSRUWKB-MJBXVCDLSA-N	384.146740598							118749
BRD-K75657700	LSM-30199		54639684	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22-,23+/m1/s1	NCDVBILORYBSFZ-MZYLBHOOSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2CO	BroadT	BRD-K75657700	BRD-K75657700-001-01-3	Broad Institute of MIT and Harvard	BRD-K75657700			COc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCc3ccccc3C2)O[C@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22-,23+/m1/s1	NCDVBILORYBSFZ-MZYLBHOOSA-N	472.166807326							118750
BRD-K07870648	LSM-30200		54639529	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15-,18+/m1/s1	AWOFXEOJWLHGJO-SIIHOXLZSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K07870648	BRD-K07870648-001-01-0	Broad Institute of MIT and Harvard	BRD-K07870648			OC[C@@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15-,18+/m1/s1	AWOFXEOJWLHGJO-SIIHOXLZSA-N	435.171810666							118751
BRD-K37763427	LSM-30201		54639726	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21-,22+/m1/s1	VIRGWJWOQCDSPY-VSKRKVRLSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCNC(=O)CCN3CCCCC3)O[C@H]2CO)cc1	BroadT	BRD-K37763427	BRD-K37763427-001-01-8	Broad Institute of MIT and Harvard	BRD-K37763427			COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCNC(=O)CCN3CCCCC3)O[C@H]2CO)cc1	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21-,22+/m1/s1	VIRGWJWOQCDSPY-VSKRKVRLSA-N	462.284220356							118752
BRD-K69879051	LSM-30202		54639650	InChI=1S/C16H25ClN2O6S2/c1-2-26(21,22)18-9-8-13-6-7-15(16(11-20)25-13)19-27(23,24)14-5-3-4-12(17)10-14/h3-5,10,13,15-16,18-20H,2,6-9,11H2,1H3/t13-,15+,16+/m1/s1	PCAWZXQDZTWTAN-KBMXLJTQSA-N	CCS(=O)(=O)NCC[C@H]1CC[C@H](NS(=O)(=O)c2cccc(Cl)c2)[C@H](CO)O1	BroadT	BRD-K69879051	BRD-K69879051-001-01-6	Broad Institute of MIT and Harvard	BRD-K69879051			CCS(=O)(=O)NCC[C@H]1CC[C@H](NS(=O)(=O)c2cccc(Cl)c2)[C@H](CO)O1	InChI=1S/C16H25ClN2O6S2/c1-2-26(21,22)18-9-8-13-6-7-15(16(11-20)25-13)19-27(23,24)14-5-3-4-12(17)10-14/h3-5,10,13,15-16,18-20H,2,6-9,11H2,1H3/t13-,15+,16+/m1/s1	PCAWZXQDZTWTAN-KBMXLJTQSA-N	440.08425563							118753
BRD-K75703503	LSM-30203		54639588	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20+,21-/m0/s1	TXCGFGBWYOSXMX-HBMCJLEFSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K75703503	BRD-K75703503-001-01-4	Broad Institute of MIT and Harvard	BRD-K75703503			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20+,21-/m0/s1	TXCGFGBWYOSXMX-HBMCJLEFSA-N	414.195485564							118754
BRD-K23232523-001-01-3	LSM-30204	BRD-K23232523	54639619	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25-,26+/m1/s1	CHMWYEVRTWMFCL-RCXJIHSJSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)Nc4ccccc4F	BroadT	BRD-K23232523	BRD-K23232523-001-01-3	Broad Institute of MIT and Harvard	BRD-K23232523			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25-,26+/m1/s1	CHMWYEVRTWMFCL-RCXJIHSJSA-N	489.206384606							118755
BRD-K41026056	LSM-30205		54639654	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18+,20+/m0/s1	VAIOXDFGBLKFCW-NLWGTHIKSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCc3cc(F)cc(F)c3)O[C@@H]2CO	BroadT	BRD-K41026056	BRD-K41026056-001-01-2	Broad Institute of MIT and Harvard	BRD-K41026056			COc1ccccc1S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@@H]1CO	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18+,20+/m0/s1	VAIOXDFGBLKFCW-NLWGTHIKSA-N	482.132313598							118756
BRD-K98161738	LSM-30206		54639494	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16+,17-/m1/s1	WWDDUWFGCORCPA-IXDOHACOSA-N	OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)C3CC3	BroadT	BRD-K98161738	BRD-K98161738-001-01-5	Broad Institute of MIT and Harvard	BRD-K98161738			OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@@H]1NC(=O)C1CC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16+,17-/m1/s1	WWDDUWFGCORCPA-IXDOHACOSA-N	383.242021186							118757
BRD-K56776985	LSM-30207		54639624	InChI=1S/C15H23F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h9-12,21H,1-8H2,(H,19,22)(H,20,23)/t10-,11-,12+/m0/s1	KNGQQLYZZKCBQO-SDDRHHMPSA-N	OC[C@H]1O[C@H](CC(=O)NCC(F)(F)F)CC[C@@H]1NC(=O)CC2CC2	BroadT	BRD-K56776985	BRD-K56776985-001-01-0	Broad Institute of MIT and Harvard	BRD-K56776985			OC[C@H]1O[C@H](CC(=O)NCC(F)(F)F)CC[C@@H]1NC(=O)CC1CC1	InChI=1S/C15H23F3N2O4/c16-15(17,18)8-19-13(22)6-10-3-4-11(12(7-21)24-10)20-14(23)5-9-1-2-9/h9-12,21H,1-8H2,(H,19,22)(H,20,23)/t10-,11-,12+/m0/s1	KNGQQLYZZKCBQO-SDDRHHMPSA-N	352.160991836							118758
BRD-K95877349	LSM-30208		54639516	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17-,19-/m0/s1	DBHQDXKAYSPQOJ-IEZWGBDMSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3CC3)CC[C@@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K95877349	BRD-K95877349-001-01-0	Broad Institute of MIT and Harvard	BRD-K95877349			OC[C@@H]1O[C@H](CCn2cc(nn2)C2CC2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17-,19-/m0/s1	DBHQDXKAYSPQOJ-IEZWGBDMSA-N	424.15805421							118759
BRD-K23326916	LSM-30209		54639674	InChI=1S/C17H23FN2O5S/c1-2-26(23,24)20-15-8-7-14(25-16(15)11-21)9-17(22)19-10-12-3-5-13(18)6-4-12/h3-8,14-16,20-21H,2,9-11H2,1H3,(H,19,22)/t14-,15+,16+/m1/s1	UJYSKGJHSGHRSS-PMPSAXMXSA-N	CCS(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccc(F)cc2)O[C@H]1CO	BroadT	BRD-K23326916	BRD-K23326916-001-01-8	Broad Institute of MIT and Harvard	BRD-K23326916			CCS(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccc(F)cc2)O[C@H]1CO	InChI=1S/C17H23FN2O5S/c1-2-26(23,24)20-15-8-7-14(25-16(15)11-21)9-17(22)19-10-12-3-5-13(18)6-4-12/h3-8,14-16,20-21H,2,9-11H2,1H3,(H,19,22)/t14-,15+,16+/m1/s1	UJYSKGJHSGHRSS-PMPSAXMXSA-N	386.131170746							118760
BRD-K45037973	LSM-30210		54639521	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16-,17-/m1/s1	IMWIUMROKHVEKK-BRWVUGGUSA-N	CC(C)NC(=O)NCC[C@H]1CC[C@@H](NC(=O)Nc2ccccc2)[C@@H](CO)O1	BroadT	BRD-K45037973	BRD-K45037973-001-01-5	Broad Institute of MIT and Harvard	BRD-K45037973			CC(C)NC(=O)NCC[C@H]1CC[C@@H](NC(=O)Nc2ccccc2)[C@@H](CO)O1	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16-,17-/m1/s1	IMWIUMROKHVEKK-BRWVUGGUSA-N	378.22670548							118761
BRD-K21897482	LSM-30211		54639596	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16+,17+/m1/s1	FADSLUGYRKRULA-IKGGRYGDSA-N	Cc1onc(C)c1NC(=O)N[C@H]2CC[C@H](CCNC(=O)C3CCOCC3)O[C@H]2CO	BroadT	BRD-K21897482	BRD-K21897482-001-01-4	Broad Institute of MIT and Harvard	BRD-K21897482			Cc1noc(C)c1NC(=O)N[C@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16+,17+/m1/s1	FADSLUGYRKRULA-IKGGRYGDSA-N	424.232184784							118762
BRD-K09337184	LSM-30212		54639522	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16-,17+/m1/s1	IMWIUMROKHVEKK-ZACQAIPSSA-N	CC(C)NC(=O)NCC[C@H]1CC[C@@H](NC(=O)Nc2ccccc2)[C@H](CO)O1	BroadT	BRD-K09337184	BRD-K09337184-001-01-8	Broad Institute of MIT and Harvard	BRD-K09337184			CC(C)NC(=O)NCC[C@H]1CC[C@@H](NC(=O)Nc2ccccc2)[C@H](CO)O1	InChI=1S/C19H30N4O4/c1-13(2)21-18(25)20-11-10-15-8-9-16(17(12-24)27-15)23-19(26)22-14-6-4-3-5-7-14/h3-7,13,15-17,24H,8-12H2,1-2H3,(H2,20,21,25)(H2,22,23,26)/t15-,16-,17+/m1/s1	IMWIUMROKHVEKK-ZACQAIPSSA-N	378.22670548							118763
BRD-K31606237	LSM-30213		54639560	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16-,17-/m1/s1	LHRABQACLPZHAR-BRWVUGGUSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K31606237	BRD-K31606237-001-01-5	Broad Institute of MIT and Harvard	BRD-K31606237			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16-,17-/m1/s1	LHRABQACLPZHAR-BRWVUGGUSA-N	379.190734542							118764
BRD-K21143905	LSM-30214		54639620	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25+,26-/m0/s1	CHMWYEVRTWMFCL-DFCKQENNSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)Nc4ccccc4F	BroadT	BRD-K21143905	BRD-K21143905-001-01-2	Broad Institute of MIT and Harvard	BRD-K21143905			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C28H28FN3O4/c29-23-8-4-5-9-24(23)31-28(35)32-25-15-14-22(36-26(25)18-33)16-27(34)30-17-19-10-12-21(13-11-19)20-6-2-1-3-7-20/h1-15,22,25-26,33H,16-18H2,(H,30,34)(H2,31,32,35)/t22-,25+,26-/m0/s1	CHMWYEVRTWMFCL-DFCKQENNSA-N	489.206384606							118765
BRD-K24263752	LSM-30215		54639779	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17+,18-/m0/s1	ISYSKPLJKWXOBQ-JQHSSLGASA-N	CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K24263752	BRD-K24263752-001-01-9	Broad Institute of MIT and Harvard	BRD-K24263752			CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17+,18-/m0/s1	ISYSKPLJKWXOBQ-JQHSSLGASA-N	411.182791748							118766
BRD-K61134709	LSM-30216		54639712	InChI=1S/C24H26N2O7/c1-30-17-5-2-15(3-6-17)12-25-23(28)11-18-7-8-19(22(13-27)33-18)26-24(29)16-4-9-20-21(10-16)32-14-31-20/h2-10,18-19,22,27H,11-14H2,1H3,(H,25,28)(H,26,29)/t18-,19-,22+/m0/s1	SJKHPSVPSLXDSV-CNNODRBYSA-N	COc1ccc(CNC(=O)C[C@H]2O[C@H](CO)[C@@H](NC(=O)c3ccc4OCOc4c3)C=C2)cc1	BroadT	BRD-K61134709	BRD-K61134709-001-01-0	Broad Institute of MIT and Harvard	BRD-K61134709			COc1ccc(CNC(=O)C[C@H]2O[C@H](CO)[C@@H](NC(=O)c3ccc4OCOc4c3)C=C2)cc1	InChI=1S/C24H26N2O7/c1-30-17-5-2-15(3-6-17)12-25-23(28)11-18-7-8-19(22(13-27)33-18)26-24(29)16-4-9-20-21(10-16)32-14-31-20/h2-10,18-19,22,27H,11-14H2,1H3,(H,25,28)(H,26,29)/t18-,19-,22+/m0/s1	SJKHPSVPSLXDSV-CNNODRBYSA-N	454.174001192							118767
BRD-K84688359	LSM-30217		54639531	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15-,18-/m0/s1	AWOFXEOJWLHGJO-YEWWUXTCSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K84688359	BRD-K84688359-001-01-1	Broad Institute of MIT and Harvard	BRD-K84688359			OC[C@@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15-,18-/m0/s1	AWOFXEOJWLHGJO-YEWWUXTCSA-N	435.171810666							118768
BRD-K49744949-001-01-3	LSM-30218	BRD-K49744949	54639641	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20+,22+/m0/s1	KDMIEVSCRLGCNO-TUNNFDKTSA-N	Cc1ccccc1S(=O)(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)c4ccc(F)cc4)O[C@@H]2CO	BroadT	BRD-K49744949	BRD-K49744949-001-01-3	Broad Institute of MIT and Harvard	BRD-K49744949			Cc1ccccc1S(=O)(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C23H27FN4O4S/c1-16-4-2-3-5-23(16)33(30,31)26-20-11-10-19(32-22(20)15-29)12-13-28-14-21(25-27-28)17-6-8-18(24)9-7-17/h2-9,14,19-20,22,26,29H,10-13,15H2,1H3/t19-,20+,22+/m0/s1	KDMIEVSCRLGCNO-TUNNFDKTSA-N	474.173704274							118769
BRD-K35132745	LSM-30219		54639511	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17+,19+/m0/s1	DBHQDXKAYSPQOJ-KVSKMBFKSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3CC3)CC[C@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K35132745	BRD-K35132745-001-01-3	Broad Institute of MIT and Harvard	BRD-K35132745			OC[C@H]1O[C@H](CCn2cc(nn2)C2CC2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17+,19+/m0/s1	DBHQDXKAYSPQOJ-KVSKMBFKSA-N	424.15805421							118770
BRD-K01360791	LSM-30220		54639512	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17+,19+/m1/s1	DBHQDXKAYSPQOJ-AYBZRNKSSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3CC3)CC[C@@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K01360791	BRD-K01360791-001-01-3	Broad Institute of MIT and Harvard	BRD-K01360791			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2CC2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17+,19+/m1/s1	DBHQDXKAYSPQOJ-AYBZRNKSSA-N	424.15805421							118771
BRD-K40612106	LSM-30221		54639732	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24+,25+/m0/s1	DSJATXUDYPTXRQ-ICDZXHCJSA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)c3ccc(cc3)c4ccccc4)[C@@H](CO)O2)nn1	BroadT	BRD-K40612106	BRD-K40612106-001-01-0	Broad Institute of MIT and Harvard	BRD-K40612106			CN(C)Cc1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)c3ccc(cc3)-c3ccccc3)[C@@H](CO)O2)nn1	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24+,25+/m0/s1	DSJATXUDYPTXRQ-ICDZXHCJSA-N	499.225325276							118772
BRD-K20332819	LSM-30222		54639527	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15+,18+/m0/s1	AWOFXEOJWLHGJO-JCKWVBRZSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K20332819	BRD-K20332819-001-01-7	Broad Institute of MIT and Harvard	BRD-K20332819			OC[C@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15+,18+/m0/s1	AWOFXEOJWLHGJO-JCKWVBRZSA-N	435.171810666							118773
BRD-K77139764	LSM-30223		54639735	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24-,25+/m1/s1	DSJATXUDYPTXRQ-GPXOXTDOSA-N	CN(C)Cc1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)c3ccc(cc3)c4ccccc4)[C@H](CO)O2)nn1	BroadT	BRD-K77139764	BRD-K77139764-001-01-3	Broad Institute of MIT and Harvard	BRD-K77139764			CN(C)Cc1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)c3ccc(cc3)-c3ccccc3)[C@H](CO)O2)nn1	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24-,25+/m1/s1	DSJATXUDYPTXRQ-GPXOXTDOSA-N	499.225325276							118774
BRD-K45318035	LSM-30224		54639538	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18+,19-/m1/s1	JUDGCNLDIJTAJU-AYOQOUSVSA-N	CCCc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3ccccc3F)[C@@H](CO)O2)nn1	BroadT	BRD-K45318035	BRD-K45318035-001-01-5	Broad Institute of MIT and Harvard	BRD-K45318035			CCCc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3ccccc3F)[C@@H](CO)O2)nn1	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18+,19-/m1/s1	JUDGCNLDIJTAJU-AYOQOUSVSA-N	405.217618006							118775
BRD-K99172965-001-01-5	LSM-30225	BRD-K99172965	54639791	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19+,20-/m1/s1	SOXWEHYVEMBZTM-YZGWKJHDSA-N	OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K99172965	BRD-K99172965-001-01-5	Broad Institute of MIT and Harvard	BRD-K99172965			OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19+,20-/m1/s1	SOXWEHYVEMBZTM-YZGWKJHDSA-N	485.11874753							118776
BRD-K96096022	LSM-30226		54639490	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16-,17-/m1/s1	WWDDUWFGCORCPA-BRWVUGGUSA-N	OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)C3CC3	BroadT	BRD-K96096022	BRD-K96096022-001-01-0	Broad Institute of MIT and Harvard	BRD-K96096022			OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NC(=O)C1CC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-19(25)14-2-3-14)5-4-15(27-17)12-18(24)20-6-1-7-22-8-10-26-11-9-22/h14-17,23H,1-13H2,(H,20,24)(H,21,25)/t15-,16-,17-/m1/s1	WWDDUWFGCORCPA-BRWVUGGUSA-N	383.242021186							118777
BRD-K37174896	LSM-30227		54639616	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14-,15-/m0/s1	XITZEOXYAYTYOD-QEJZJMRPSA-N	CN(C)C(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccccc2)[C@H](CO)O1	BroadT	BRD-K37174896	BRD-K37174896-001-01-0	Broad Institute of MIT and Harvard	BRD-K37174896			CN(C)C(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccccc2)[C@H](CO)O1	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14-,15-/m0/s1	XITZEOXYAYTYOD-QEJZJMRPSA-N	356.140592578							118778
BRD-K72435943	LSM-30228		54639547	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17-,21-/m0/s1	KQJSIDVYPJWNIL-WJPUGNRLSA-N	OC[C@@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K72435943	BRD-K72435943-001-01-4	Broad Institute of MIT and Harvard	BRD-K72435943			OC[C@@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17-,21-/m0/s1	KQJSIDVYPJWNIL-WJPUGNRLSA-N	477.17114195							118779
BRD-K49298555	LSM-30229		54639534	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18+,19+/m0/s1	JUDGCNLDIJTAJU-KFKAGJAMSA-N	CCCc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3ccccc3F)[C@@H](CO)O2)nn1	BroadT	BRD-K49298555	BRD-K49298555-001-01-5	Broad Institute of MIT and Harvard	BRD-K49298555			CCCc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3ccccc3F)[C@@H](CO)O2)nn1	InChI=1S/C20H28FN5O3/c1-2-5-14-12-26(25-24-14)11-10-15-8-9-18(19(13-27)29-15)23-20(28)22-17-7-4-3-6-16(17)21/h3-4,6-7,12,15,18-19,27H,2,5,8-11,13H2,1H3,(H2,22,23,28)/t15-,18+,19+/m0/s1	JUDGCNLDIJTAJU-KFKAGJAMSA-N	405.217618006							118780
BRD-K16247913	LSM-30230		54639771	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19+,20-/m0/s1	ORVKPQZRJOTCIB-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K16247913	BRD-K16247913-001-01-8	Broad Institute of MIT and Harvard	BRD-K16247913			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19+,20-/m0/s1	ORVKPQZRJOTCIB-ZCNNSNEGSA-N	481.162469046							118781
BRD-K09587429	LSM-30231		54639701	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20+/m1/s1	VZQKOZAJNGTVKC-MDNKFWRPSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K09587429	BRD-K09587429-001-01-3	Broad Institute of MIT and Harvard	BRD-K09587429			C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20+/m1/s1	VZQKOZAJNGTVKC-MDNKFWRPSA-N	419.242021186							118782
BRD-K14166654	LSM-30232		54639742	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13-,14-/m1/s1	YUDVUYFJPOOWEQ-MGPQQGTHSA-N	CCCNC(=O)N[C@@H]1CC[C@H](CC(=O)NC2CCC2)O[C@@H]1CO	BroadT	BRD-K14166654	BRD-K14166654-001-01-5	Broad Institute of MIT and Harvard	BRD-K14166654			CCCNC(=O)N[C@@H]1CC[C@H](CC(=O)NC2CCC2)O[C@@H]1CO	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13-,14-/m1/s1	YUDVUYFJPOOWEQ-MGPQQGTHSA-N	327.215806438							118783
BRD-K73145196	LSM-30233		54639513	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17-,19+/m1/s1	DBHQDXKAYSPQOJ-SUMDDJOVSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3CC3)CC[C@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K73145196	BRD-K73145196-001-01-2	Broad Institute of MIT and Harvard	BRD-K73145196			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2CC2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17-,19+/m1/s1	DBHQDXKAYSPQOJ-SUMDDJOVSA-N	424.15805421							118784
BRD-K89537738	LSM-30234		54639755	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15+,16-/m0/s1	FOYMHNRGVNUWHD-XHSDSOJGSA-N	CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	BroadT	BRD-K89537738	BRD-K89537738-001-01-7	Broad Institute of MIT and Harvard	BRD-K89537738			CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15+,16-/m0/s1	FOYMHNRGVNUWHD-XHSDSOJGSA-N	355.247106566							118785
BRD-K77101974	LSM-30235		54639656	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18-,20-/m1/s1	VAIOXDFGBLKFCW-QWFCFKBJSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NCc3cc(F)cc(F)c3)O[C@@H]2CO	BroadT	BRD-K77101974	BRD-K77101974-001-01-9	Broad Institute of MIT and Harvard	BRD-K77101974			COc1ccccc1S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@@H]1CO	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18-,20-/m1/s1	VAIOXDFGBLKFCW-QWFCFKBJSA-N	482.132313598							118786
BRD-K95323025	LSM-30236		54639731	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21+,22-/m0/s1	VIRGWJWOQCDSPY-BDTNDASRSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CCNC(=O)CCN3CCCCC3)O[C@H]2CO)cc1	BroadT	BRD-K95323025	BRD-K95323025-001-01-6	Broad Institute of MIT and Harvard	BRD-K95323025			COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CCNC(=O)CCN3CCCCC3)O[C@H]2CO)cc1	InChI=1S/C24H38N4O5/c1-32-19-7-5-18(6-8-19)26-24(31)27-21-10-9-20(33-22(21)17-29)11-13-25-23(30)12-16-28-14-3-2-4-15-28/h5-8,20-22,29H,2-4,9-17H2,1H3,(H,25,30)(H2,26,27,31)/t20-,21+,22-/m0/s1	VIRGWJWOQCDSPY-BDTNDASRSA-N	462.284220356							118787
BRD-K00909602	LSM-30237		54639607	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20-,21+/m0/s1	JLSMJUFCCBIUFG-PCCBWWKXSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)C4CCOCC4	BroadT	BRD-K00909602	BRD-K00909602-001-01-7	Broad Institute of MIT and Harvard	BRD-K00909602			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20-,21+/m0/s1	JLSMJUFCCBIUFG-PCCBWWKXSA-N	416.231122144							118788
BRD-K24499562	LSM-30238		54639542	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17+,21+/m0/s1	KQJSIDVYPJWNIL-LUQKVYGDSA-N	OC[C@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K24499562	BRD-K24499562-001-01-9	Broad Institute of MIT and Harvard	BRD-K24499562			OC[C@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17+,21+/m0/s1	KQJSIDVYPJWNIL-LUQKVYGDSA-N	477.17114195							118789
BRD-K16717067	LSM-30239		54639692	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20-/m0/s1	VZQKOZAJNGTVKC-LEAZDLGRSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K16717067	BRD-K16717067-001-01-4	Broad Institute of MIT and Harvard	BRD-K16717067			C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20-/m0/s1	VZQKOZAJNGTVKC-LEAZDLGRSA-N	419.242021186							118790
BRD-K84077642	LSM-30240		54639609	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20+,21-/m1/s1	JLSMJUFCCBIUFG-QHAWAJNXSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)C4CCOCC4	BroadT	BRD-K84077642	BRD-K84077642-001-01-4	Broad Institute of MIT and Harvard	BRD-K84077642			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C23H32N2O5/c26-15-21-20(24-23(28)17-8-11-29-12-9-17)6-5-19(30-21)13-22(27)25-10-7-16-3-1-2-4-18(16)14-25/h1-4,17,19-21,26H,5-15H2,(H,24,28)/t19-,20+,21-/m1/s1	JLSMJUFCCBIUFG-QHAWAJNXSA-N	416.231122144							118791
BRD-K93374700	LSM-30241		54639675	InChI=1S/C17H23FN2O5S/c1-2-26(23,24)20-15-8-7-14(25-16(15)11-21)9-17(22)19-10-12-3-5-13(18)6-4-12/h3-8,14-16,20-21H,2,9-11H2,1H3,(H,19,22)/t14-,15-,16-/m0/s1	UJYSKGJHSGHRSS-JYJNAYRXSA-N	CCS(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccc(F)cc2)O[C@H]1CO	BroadT	BRD-K93374700	BRD-K93374700-001-01-3	Broad Institute of MIT and Harvard	BRD-K93374700			CCS(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccc(F)cc2)O[C@H]1CO	InChI=1S/C17H23FN2O5S/c1-2-26(23,24)20-15-8-7-14(25-16(15)11-21)9-17(22)19-10-12-3-5-13(18)6-4-12/h3-8,14-16,20-21H,2,9-11H2,1H3,(H,19,22)/t14-,15-,16-/m0/s1	UJYSKGJHSGHRSS-JYJNAYRXSA-N	386.131170746							118792
BRD-K84423439	LSM-30242		54639545	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17+,21-/m1/s1	KQJSIDVYPJWNIL-LDBYXDLTSA-N	OC[C@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K84423439	BRD-K84423439-001-01-7	Broad Institute of MIT and Harvard	BRD-K84423439			OC[C@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(10-14)28-23(31)26-8-7-15-3-5-17(21(11-29)34-15)27-22(30)13-1-6-19-20(9-13)33-12-32-19/h1-2,4,6,9-10,15,17,21,29H,3,5,7-8,11-12H2,(H,27,30)(H2,26,28,31)/t15-,17+,21-/m1/s1	KQJSIDVYPJWNIL-LDBYXDLTSA-N	477.17114195							118793
BRD-K34761198	LSM-30243		54639482	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13-,14-/m1/s1	DVRCOHXMQROJRA-MGPQQGTHSA-N	COCC(=O)N[C@@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K34761198	BRD-K34761198-001-01-2	Broad Institute of MIT and Harvard	BRD-K34761198			COCC(=O)N[C@@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C16H28N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h12-14,19H,2-11H2,1H3,(H,17,20)/t12-,13-,14-/m1/s1	DVRCOHXMQROJRA-MGPQQGTHSA-N	328.199822016							118794
BRD-K48046422	LSM-30244		54639635	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16-/m1/s1	ZOKIFIDHVZYURK-BZUAXINKSA-N	CCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	BroadT	BRD-K48046422	BRD-K48046422-001-01-0	Broad Institute of MIT and Harvard	BRD-K48046422			CCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16-/m1/s1	ZOKIFIDHVZYURK-BZUAXINKSA-N	338.22055746							118795
BRD-K63626200	LSM-30245		54639706	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20-,21+/m0/s1	HGNKQCISEGSFPB-DZFGPLHGSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NCc3ccccc3F)O[C@@H]2CO	BroadT	BRD-K63626200	BRD-K63626200-001-01-7	Broad Institute of MIT and Harvard	BRD-K63626200			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20-,21+/m0/s1	HGNKQCISEGSFPB-DZFGPLHGSA-N	448.14682081							118796
BRD-K87530935	LSM-30246		54639723	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17+,18-/m0/s1	HBUPPCLFCIMQJL-KSZLIROESA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H](NC(=O)Cc3ccccn3)[C@H](CO)O2	BroadT	BRD-K87530935	BRD-K87530935-001-01-5	Broad Institute of MIT and Harvard	BRD-K87530935			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17+,18-/m0/s1	HBUPPCLFCIMQJL-KSZLIROESA-N	390.22670548							118797
BRD-K83815133	LSM-30247		54639713	InChI=1S/C24H26N2O7/c1-30-17-5-2-15(3-6-17)12-25-23(28)11-18-7-8-19(22(13-27)33-18)26-24(29)16-4-9-20-21(10-16)32-14-31-20/h2-10,18-19,22,27H,11-14H2,1H3,(H,25,28)(H,26,29)/t18-,19-,22+/m1/s1	SJKHPSVPSLXDSV-KNKQGSTJSA-N	COc1ccc(CNC(=O)C[C@@H]2O[C@@H](CO)[C@H](NC(=O)c3ccc4OCOc4c3)C=C2)cc1	BroadT	BRD-K83815133	BRD-K83815133-001-01-4	Broad Institute of MIT and Harvard	BRD-K83815133			COc1ccc(CNC(=O)C[C@@H]2O[C@@H](CO)[C@H](NC(=O)c3ccc4OCOc4c3)C=C2)cc1	InChI=1S/C24H26N2O7/c1-30-17-5-2-15(3-6-17)12-25-23(28)11-18-7-8-19(22(13-27)33-18)26-24(29)16-4-9-20-21(10-16)32-14-31-20/h2-10,18-19,22,27H,11-14H2,1H3,(H,25,28)(H,26,29)/t18-,19-,22+/m1/s1	SJKHPSVPSLXDSV-KNKQGSTJSA-N	454.174001192							118798
BRD-K09863466	LSM-30248		54639581	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20+,21+/m0/s1	TXCGFGBWYOSXMX-PWRODBHTSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K09863466	BRD-K09863466-001-01-2	Broad Institute of MIT and Harvard	BRD-K09863466			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20+,21+/m0/s1	TXCGFGBWYOSXMX-PWRODBHTSA-N	414.195485564							118799
BRD-K18139667	LSM-30249		54639533	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15+,18-/m1/s1	AWOFXEOJWLHGJO-QIIPPGSGSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K18139667	BRD-K18139667-001-01-3	Broad Institute of MIT and Harvard	BRD-K18139667			OC[C@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H23F2N5O4/c21-12-1-3-14(22)16(9-12)27-20(30)26-15-4-2-13(31-18(15)11-28)5-6-25-19(29)17-10-23-7-8-24-17/h1,3,7-10,13,15,18,28H,2,4-6,11H2,(H,25,29)(H2,26,27,30)/t13-,15+,18-/m1/s1	AWOFXEOJWLHGJO-QIIPPGSGSA-N	435.171810666							118800
BRD-K60052521	LSM-30250		54639611	InChI=1S/C19H28N2O5S/c1-2-27(24,25)21-17-8-7-16(26-18(17)12-22)11-19(23)20-15-9-13-5-3-4-6-14(13)10-15/h3-6,15-18,21-22H,2,7-12H2,1H3,(H,20,23)/t16-,17+,18+/m0/s1	LZGNPRRVNFVBRK-RCCFBDPRSA-N	CCS(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	BroadT	BRD-K60052521	BRD-K60052521-001-01-1	Broad Institute of MIT and Harvard	BRD-K60052521			CCS(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	InChI=1S/C19H28N2O5S/c1-2-27(24,25)21-17-8-7-16(26-18(17)12-22)11-19(23)20-15-9-13-5-3-4-6-14(13)10-15/h3-6,15-18,21-22H,2,7-12H2,1H3,(H,20,23)/t16-,17+,18+/m0/s1	LZGNPRRVNFVBRK-RCCFBDPRSA-N	396.171892706							118801
BRD-K27049948	LSM-30251		54639551	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13+,14+/m1/s1	JWTJGHMNSRUWKB-RDBSUJKOSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NCC3CC3)O[C@H]2CO	BroadT	BRD-K27049948	BRD-K27049948-001-01-4	Broad Institute of MIT and Harvard	BRD-K27049948			Cn1cnc(c1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCC2CC2)O[C@H]1CO	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13+,14+/m1/s1	JWTJGHMNSRUWKB-RDBSUJKOSA-N	384.146740598							118802
BRD-K81439435	LSM-30252		54639552	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13-,14-/m1/s1	JWTJGHMNSRUWKB-MGPQQGTHSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NCC3CC3)O[C@@H]2CO	BroadT	BRD-K81439435	BRD-K81439435-001-01-0	Broad Institute of MIT and Harvard	BRD-K81439435			Cn1cnc(c1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NCC2CC2)O[C@@H]1CO	InChI=1S/C16H24N4O5S/c1-20-8-16(18-10-20)26(23,24)19-13-5-4-12(25-14(13)9-21)6-15(22)17-7-11-2-3-11/h4-5,8,10-14,19,21H,2-3,6-7,9H2,1H3,(H,17,22)/t12-,13-,14-/m1/s1	JWTJGHMNSRUWKB-MGPQQGTHSA-N	384.146740598							118803
BRD-K14599588	LSM-30253		54639690	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20+/m0/s1	VZQKOZAJNGTVKC-MTFMMBMASA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K14599588	BRD-K14599588-001-01-8	Broad Institute of MIT and Harvard	BRD-K14599588			C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H33N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-6,16,18-20,26H,7-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20+/m0/s1	VZQKOZAJNGTVKC-MTFMMBMASA-N	419.242021186							118804
BRD-K60661821	LSM-30254		54639781	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18+,22+/m1/s1	RAMPQQLLROWEJQ-NRJQMVOHSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CCNC(=O)c3ccc4OCOc4c3)O[C@H]2CO	BroadT	BRD-K60661821	BRD-K60661821-001-01-6	Broad Institute of MIT and Harvard	BRD-K60661821			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CCNC(=O)c2ccc3OCOc3c2)O[C@H]1CO	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18+,22+/m1/s1	RAMPQQLLROWEJQ-NRJQMVOHSA-N	471.200550298							118805
BRD-K69423881	LSM-30255		54639736	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24-,25-/m1/s1	DSJATXUDYPTXRQ-QLBJFCOMSA-N	CN(C)Cc1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)c3ccc(cc3)c4ccccc4)[C@@H](CO)O2)nn1	BroadT	BRD-K69423881	BRD-K69423881-001-01-9	Broad Institute of MIT and Harvard	BRD-K69423881			CN(C)Cc1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)c3ccc(cc3)-c3ccccc3)[C@@H](CO)O2)nn1	InChI=1S/C25H33N5O4S/c1-29(2)16-21-17-30(28-26-21)15-14-22-10-13-24(25(18-31)34-22)27-35(32,33)23-11-8-20(9-12-23)19-6-4-3-5-7-19/h3-9,11-12,17,22,24-25,27,31H,10,13-16,18H2,1-2H3/t22-,24-,25-/m1/s1	DSJATXUDYPTXRQ-QLBJFCOMSA-N	499.225325276							118806
BRD-K74767736	LSM-30256		54639664	InChI=1S/C19H29FN4O4/c1-24(2)11-18(26)23-16-8-7-15(28-17(16)12-25)9-10-21-19(27)22-14-5-3-13(20)4-6-14/h3-6,15-17,25H,7-12H2,1-2H3,(H,23,26)(H2,21,22,27)/t15-,16+,17-/m1/s1	HVYAXUQBEQKNPC-IXDOHACOSA-N	CN(C)CC(=O)N[C@H]1CC[C@H](CCNC(=O)Nc2ccc(F)cc2)O[C@@H]1CO	BroadT	BRD-K74767736	BRD-K74767736-001-01-9	Broad Institute of MIT and Harvard	BRD-K74767736			CN(C)CC(=O)N[C@H]1CC[C@H](CCNC(=O)Nc2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C19H29FN4O4/c1-24(2)11-18(26)23-16-8-7-15(28-17(16)12-25)9-10-21-19(27)22-14-5-3-13(20)4-6-14/h3-6,15-17,25H,7-12H2,1-2H3,(H,23,26)(H2,21,22,27)/t15-,16+,17-/m1/s1	HVYAXUQBEQKNPC-IXDOHACOSA-N	396.217283648							118807
BRD-K97805186	LSM-30257		54639681	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22-,23-/m1/s1	NCDVBILORYBSFZ-YMPZKCBVSA-N	COc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2CO	BroadT	BRD-K97805186	BRD-K97805186-001-01-5	Broad Institute of MIT and Harvard	BRD-K97805186			COc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCc3ccccc3C2)O[C@@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22-,23-/m1/s1	NCDVBILORYBSFZ-YMPZKCBVSA-N	472.166807326							118808
BRD-K37219127	LSM-30258		54639657	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18-,20-/m0/s1	VAIOXDFGBLKFCW-BJLQDIEVSA-N	COc1ccccc1S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NCc3cc(F)cc(F)c3)O[C@H]2CO	BroadT	BRD-K37219127	BRD-K37219127-001-01-4	Broad Institute of MIT and Harvard	BRD-K37219127			COc1ccccc1S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@H]1CO	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18-,20-/m0/s1	VAIOXDFGBLKFCW-BJLQDIEVSA-N	482.132313598							118809
MLS003650094	LSM-30259	BRD-K42697646	53382744	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18+,19-/m1/s1	DCOUIHVSHDCYLI-NZSAHSFTSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K42697646	BRD-K42697646-001-01-6	Broad Institute of MIT and Harvard	BRD-K42697646			OC[C@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H24F2N2O5S/c22-15-7-5-14(6-8-15)21(27)24-12-11-16-9-10-18(19(13-26)30-16)25-31(28,29)20-4-2-1-3-17(20)23/h1-8,16,18-19,25-26H,9-13H2,(H,24,27)/t16-,18+,19-/m1/s1	DCOUIHVSHDCYLI-NZSAHSFTSA-N	454.137398978							118810
BRD-K24124047	LSM-30260		54639710	InChI=1S/C24H26N2O7/c1-30-17-5-2-15(3-6-17)12-25-23(28)11-18-7-8-19(22(13-27)33-18)26-24(29)16-4-9-20-21(10-16)32-14-31-20/h2-10,18-19,22,27H,11-14H2,1H3,(H,25,28)(H,26,29)/t18-,19+,22+/m0/s1	SJKHPSVPSLXDSV-NNMXDRDESA-N	COc1ccc(CNC(=O)C[C@H]2O[C@H](CO)[C@H](NC(=O)c3ccc4OCOc4c3)C=C2)cc1	BroadT	BRD-K24124047	BRD-K24124047-001-01-8	Broad Institute of MIT and Harvard	BRD-K24124047			COc1ccc(CNC(=O)C[C@H]2O[C@H](CO)[C@H](NC(=O)c3ccc4OCOc4c3)C=C2)cc1	InChI=1S/C24H26N2O7/c1-30-17-5-2-15(3-6-17)12-25-23(28)11-18-7-8-19(22(13-27)33-18)26-24(29)16-4-9-20-21(10-16)32-14-31-20/h2-10,18-19,22,27H,11-14H2,1H3,(H,25,28)(H,26,29)/t18-,19+,22+/m0/s1	SJKHPSVPSLXDSV-NNMXDRDESA-N	454.174001192							118811
BRD-K36237864	LSM-30261		54639787	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18+,22-/m0/s1	RAMPQQLLROWEJQ-CECAUBDESA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CCNC(=O)c3ccc4OCOc4c3)O[C@H]2CO	BroadT	BRD-K36237864	BRD-K36237864-001-01-4	Broad Institute of MIT and Harvard	BRD-K36237864			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CCNC(=O)c2ccc3OCOc3c2)O[C@H]1CO	InChI=1S/C24H29N3O7/c1-31-19-5-3-2-4-17(19)26-24(30)27-18-8-7-16(34-22(18)13-28)10-11-25-23(29)15-6-9-20-21(12-15)33-14-32-20/h2-6,9,12,16,18,22,28H,7-8,10-11,13-14H2,1H3,(H,25,29)(H2,26,27,30)/t16-,18+,22-/m0/s1	RAMPQQLLROWEJQ-CECAUBDESA-N	471.200550298							118812
BRD-K74568352	LSM-30262		54639768	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19-,20+/m0/s1	ORVKPQZRJOTCIB-SLFFLAALSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K74568352	BRD-K74568352-001-01-4	Broad Institute of MIT and Harvard	BRD-K74568352			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H23F4N3O4/c24-16-3-1-2-14(10-16)12-28-21(32)11-18-8-9-19(20(13-31)34-18)30-22(33)29-17-6-4-15(5-7-17)23(25,26)27/h1-10,18-20,31H,11-13H2,(H,28,32)(H2,29,30,33)/t18-,19-,20+/m0/s1	ORVKPQZRJOTCIB-SLFFLAALSA-N	481.162469046							118813
BRD-K28347985	LSM-30263		54639634	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16+/m1/s1	ZOKIFIDHVZYURK-PMPSAXMXSA-N	CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	BroadT	BRD-K28347985	BRD-K28347985-001-01-5	Broad Institute of MIT and Harvard	BRD-K28347985			CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	InChI=1S/C18H30N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h8-9,13-16,21H,2-7,10-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16+/m1/s1	ZOKIFIDHVZYURK-PMPSAXMXSA-N	338.22055746							118814
BRD-K34506374	LSM-30264		54639763	InChI=1S/C14H26N2O5S/c1-2-22(19,20)16-12-6-5-11(21-13(12)9-17)7-14(18)15-8-10-3-4-10/h10-13,16-17H,2-9H2,1H3,(H,15,18)/t11-,12+,13-/m0/s1	XDUFBJWVCOBYQZ-XQQFMLRXSA-N	CCS(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCC2CC2)O[C@H]1CO	BroadT	BRD-K34506374	BRD-K34506374-001-01-7	Broad Institute of MIT and Harvard	BRD-K34506374			CCS(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCC2CC2)O[C@H]1CO	InChI=1S/C14H26N2O5S/c1-2-22(19,20)16-12-6-5-11(21-13(12)9-17)7-14(18)15-8-10-3-4-10/h10-13,16-17H,2-9H2,1H3,(H,15,18)/t11-,12+,13-/m0/s1	XDUFBJWVCOBYQZ-XQQFMLRXSA-N	334.156242642							118815
BRD-K25757432	LSM-30265		54639593	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12-,13+/m1/s1	CZGVFFSNBHAYON-RTXFEEFZSA-N	COC(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccccc2F)C=C1	BroadT	BRD-K25757432	BRD-K25757432-001-01-7	Broad Institute of MIT and Harvard	BRD-K25757432			COC(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccccc2F)C=C1	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12-,13+/m1/s1	CZGVFFSNBHAYON-RTXFEEFZSA-N	359.083886196							118816
CHEMBL2144382	LSM-30266	SID131435961, BRD-K94452277	54639668	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19-,21-/m1/s1	USSZBVMKFITLQI-OZOXKJRCSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3cccnc3)CC[C@H]1NC(=O)c4ccccc4F	BroadT	BRD-K94452277	BRD-K94452277-001-01-9	Broad Institute of MIT and Harvard	BRD-K94452277			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2cccnc2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19-,21-/m1/s1	USSZBVMKFITLQI-OZOXKJRCSA-N	425.186317878							118817
BRD-K41327620	LSM-30267		54639661	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18+,20-/m0/s1	VAIOXDFGBLKFCW-NSHGMRRFSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCc3cc(F)cc(F)c3)O[C@H]2CO	BroadT	BRD-K41327620	BRD-K41327620-001-01-1	Broad Institute of MIT and Harvard	BRD-K41327620			COc1ccccc1S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@H]1CO	InChI=1S/C22H24F2N2O6S/c1-31-19-4-2-3-5-21(19)33(29,30)26-18-7-6-17(32-20(18)13-27)11-22(28)25-12-14-8-15(23)10-16(24)9-14/h2-10,17-18,20,26-27H,11-13H2,1H3,(H,25,28)/t17-,18+,20-/m0/s1	VAIOXDFGBLKFCW-NSHGMRRFSA-N	482.132313598							118818
BRD-K12986423	LSM-30268		54639600	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16-,17-/m0/s1	FADSLUGYRKRULA-ULQDDVLXSA-N	Cc1onc(C)c1NC(=O)N[C@H]2CC[C@@H](CCNC(=O)C3CCOCC3)O[C@H]2CO	BroadT	BRD-K12986423	BRD-K12986423-001-01-8	Broad Institute of MIT and Harvard	BRD-K12986423			Cc1noc(C)c1NC(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	InChI=1S/C20H32N4O6/c1-12-18(13(2)30-24-12)23-20(27)22-16-4-3-15(29-17(16)11-25)5-8-21-19(26)14-6-9-28-10-7-14/h14-17,25H,3-11H2,1-2H3,(H,21,26)(H2,22,23,27)/t15-,16-,17-/m0/s1	FADSLUGYRKRULA-ULQDDVLXSA-N	424.232184784							118819
BRD-K98704738	LSM-30269		54639568	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19-,20-/m1/s1	XDZGUUVZSOVFIF-MISYRCLQSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccncc3)O[C@@H]2CO	BroadT	BRD-K98704738	BRD-K98704738-001-01-2	Broad Institute of MIT and Harvard	BRD-K98704738			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccncc2)O[C@@H]1CO	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19-,20-/m1/s1	XDZGUUVZSOVFIF-MISYRCLQSA-N	449.162056304							118820
BRD-K32477623	LSM-30270		54639503	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20+,21+/m0/s1	GOYHAEMMGZTJNJ-CEWLAPEOSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K32477623	BRD-K32477623-001-01-2	Broad Institute of MIT and Harvard	BRD-K32477623			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20+,21+/m0/s1	GOYHAEMMGZTJNJ-CEWLAPEOSA-N	453.22974194							118821
BRD-K68149575	LSM-30271		54639630	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18-,19+/m1/s1	UTNFYOAWBFBPFR-QRVBRYPASA-N	COc1cccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccncn3)O[C@H]2CO)c1	BroadT	BRD-K68149575	BRD-K68149575-001-01-2	Broad Institute of MIT and Harvard	BRD-K68149575			COc1cccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccncn3)O[C@H]2CO)c1	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18-,19+/m1/s1	UTNFYOAWBFBPFR-QRVBRYPASA-N	429.201219014							118822
BRD-K61431055	LSM-30272		54639707	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20-,21+/m1/s1	HGNKQCISEGSFPB-UIFIKXQLSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NCc3ccccc3F)O[C@H]2CO	BroadT	BRD-K61431055	BRD-K61431055-001-01-0	Broad Institute of MIT and Harvard	BRD-K61431055			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C22H25FN2O5S/c1-15-6-9-18(10-7-15)31(28,29)25-20-11-8-17(30-21(20)14-26)12-22(27)24-13-16-4-2-3-5-19(16)23/h2-11,17,20-21,25-26H,12-14H2,1H3,(H,24,27)/t17-,20-,21+/m1/s1	HGNKQCISEGSFPB-UIFIKXQLSA-N	448.14682081							118823
BRD-K23047495	LSM-30273		54639745	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13-,14+/m1/s1	YUDVUYFJPOOWEQ-MCIONIFRSA-N	CCCNC(=O)N[C@@H]1CC[C@H](CC(=O)NC2CCC2)O[C@H]1CO	BroadT	BRD-K23047495	BRD-K23047495-001-01-9	Broad Institute of MIT and Harvard	BRD-K23047495			CCCNC(=O)N[C@@H]1CC[C@H](CC(=O)NC2CCC2)O[C@H]1CO	InChI=1S/C16H29N3O4/c1-2-8-17-16(22)19-13-7-6-12(23-14(13)10-20)9-15(21)18-11-4-3-5-11/h11-14,20H,2-10H2,1H3,(H,18,21)(H2,17,19,22)/t12-,13-,14+/m1/s1	YUDVUYFJPOOWEQ-MCIONIFRSA-N	327.215806438							118824
CHEMBL2132193	LSM-30274	BRD-K32370845, SID131435964	54639671	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19-,21+/m0/s1	USSZBVMKFITLQI-NBHGPNQESA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3cccnc3)CC[C@@H]1NC(=O)c4ccccc4F	BroadT	BRD-K32370845	BRD-K32370845-001-01-1	Broad Institute of MIT and Harvard	BRD-K32370845			OC[C@H]1O[C@H](CCn2cc(nn2)-c2cccnc2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19-,21+/m0/s1	USSZBVMKFITLQI-NBHGPNQESA-N	425.186317878							118825
BRD-K19752998	LSM-30275		54639562	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16-,17+/m0/s1	LHRABQACLPZHAR-YESZJQIVSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K19752998	BRD-K19752998-001-01-2	Broad Institute of MIT and Harvard	BRD-K19752998			OC[C@H]1O[C@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C19H26FN3O4/c20-13-2-1-3-14(8-13)22-19(26)23-16-7-6-15(27-17(16)11-24)9-18(25)21-10-12-4-5-12/h1-3,8,12,15-17,24H,4-7,9-11H2,(H,21,25)(H2,22,23,26)/t15-,16-,17+/m0/s1	LHRABQACLPZHAR-YESZJQIVSA-N	379.190734542							118826
BRD-K49103536	LSM-30276		54639566	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19+,20+/m0/s1	XDZGUUVZSOVFIF-DFQSSKMNSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccncc3)O[C@@H]2CO	BroadT	BRD-K49103536	BRD-K49103536-001-01-1	Broad Institute of MIT and Harvard	BRD-K49103536			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccncc2)O[C@@H]1CO	InChI=1S/C21H27N3O6S/c1-29-16-3-2-4-18(11-16)31(27,28)24-19-6-5-17(30-20(19)14-25)12-21(26)23-13-15-7-9-22-10-8-15/h2-4,7-11,17,19-20,24-25H,5-6,12-14H2,1H3,(H,23,26)/t17-,19+,20+/m0/s1	XDZGUUVZSOVFIF-DFQSSKMNSA-N	449.162056304							118827
BRD-K95709431	LSM-30277		54639589	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12+,13+/m0/s1	CZGVFFSNBHAYON-CYZMBNFOSA-N	COC(=O)C[C@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccccc2F)C=C1	BroadT	BRD-K95709431	BRD-K95709431-001-01-4	Broad Institute of MIT and Harvard	BRD-K95709431			COC(=O)C[C@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccccc2F)C=C1	InChI=1S/C15H18FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-7,10,12-13,17-18H,8-9H2,1H3/t10-,12+,13+/m0/s1	CZGVFFSNBHAYON-CYZMBNFOSA-N	359.083886196							118828
BRD-K96779993	LSM-30278		54639628	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18-,19+/m0/s1	UTNFYOAWBFBPFR-GBESFXJTSA-N	COc1cccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccncn3)O[C@@H]2CO)c1	BroadT	BRD-K96779993	BRD-K96779993-001-01-6	Broad Institute of MIT and Harvard	BRD-K96779993			COc1cccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccncn3)O[C@@H]2CO)c1	InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18-,19+/m0/s1	UTNFYOAWBFBPFR-GBESFXJTSA-N	429.201219014							118829
BRD-K69294714	LSM-30279		54639673	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19+,21-/m0/s1	USSZBVMKFITLQI-SCWSEQNSSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3cccnc3)CC[C@H]1NC(=O)c4ccccc4F	BroadT	BRD-K69294714	BRD-K69294714-001-01-7	Broad Institute of MIT and Harvard	BRD-K69294714			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2cccnc2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H24FN5O3/c23-18-6-2-1-5-17(18)22(30)25-19-8-7-16(31-21(19)14-29)9-11-28-13-20(26-27-28)15-4-3-10-24-12-15/h1-6,10,12-13,16,19,21,29H,7-9,11,14H2,(H,25,30)/t16-,19+,21-/m0/s1	USSZBVMKFITLQI-SCWSEQNSSA-N	425.186317878							118830
BRD-K79829201	LSM-30280		54639772	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17+,18+/m0/s1	ISYSKPLJKWXOBQ-CGTJXYLNSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K79829201	BRD-K79829201-001-01-8	Broad Institute of MIT and Harvard	BRD-K79829201			CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C19H29N3O5S/c1-22(2)12-6-11-20-19(24)13-15-9-10-17(18(14-23)27-15)21-28(25,26)16-7-4-3-5-8-16/h3-5,7-10,15,17-18,21,23H,6,11-14H2,1-2H3,(H,20,24)/t15-,17+,18+/m0/s1	ISYSKPLJKWXOBQ-CGTJXYLNSA-N	411.182791748							118831
BRD-K98944347	LSM-30281		54639685	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22+,23-/m1/s1	NCDVBILORYBSFZ-AKIFATBCSA-N	COc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2CO	BroadT	BRD-K98944347	BRD-K98944347-001-01-7	Broad Institute of MIT and Harvard	BRD-K98944347			COc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)N2CCc3ccccc3C2)O[C@@H]1CO	InChI=1S/C24H28N2O6S/c1-31-19-6-9-21(10-7-19)33(29,30)25-22-11-8-20(32-23(22)16-27)14-24(28)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,20,22-23,25,27H,12-16H2,1H3/t20-,22+,23-/m1/s1	NCDVBILORYBSFZ-AKIFATBCSA-N	472.166807326							118832
BRD-K47694606	LSM-30282		54639749	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15+,16+/m1/s1	FOYMHNRGVNUWHD-PMPSAXMXSA-N	CCC(=O)N[C@H]1CC[C@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	BroadT	BRD-K47694606	BRD-K47694606-001-01-6	Broad Institute of MIT and Harvard	BRD-K47694606			CCC(=O)N[C@H]1CC[C@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	InChI=1S/C18H33N3O4/c1-2-17(23)20-15-7-6-14(25-16(15)13-22)12-18(24)19-8-11-21-9-4-3-5-10-21/h14-16,22H,2-13H2,1H3,(H,19,24)(H,20,23)/t14-,15+,16+/m1/s1	FOYMHNRGVNUWHD-PMPSAXMXSA-N	355.247106566							118833
BRD-K47109712	LSM-30283		54639792	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19-,20-/m1/s1	SOXWEHYVEMBZTM-MISYRCLQSA-N	OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K47109712	BRD-K47109712-001-01-6	Broad Institute of MIT and Harvard	BRD-K47109712			OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H25ClFN3O5S/c22-14-1-5-16(6-2-14)25-21(28)24-12-11-17-7-10-19(20(13-27)31-17)26-32(29,30)18-8-3-15(23)4-9-18/h1-6,8-9,17,19-20,26-27H,7,10-13H2,(H2,24,25,28)/t17-,19-,20-/m1/s1	SOXWEHYVEMBZTM-MISYRCLQSA-N	485.11874753							118834
BRD-K69152679	LSM-30284		54639514	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17+,19-/m1/s1	DBHQDXKAYSPQOJ-HHXXYDBFSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3CC3)CC[C@@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K69152679	BRD-K69152679-001-01-0	Broad Institute of MIT and Harvard	BRD-K69152679			OC[C@H]1O[C@@H](CCn2cc(nn2)C2CC2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C19H25FN4O4S/c20-14-3-6-16(7-4-14)29(26,27)22-17-8-5-15(28-19(17)12-25)9-10-24-11-18(21-23-24)13-1-2-13/h3-4,6-7,11,13,15,17,19,22,25H,1-2,5,8-10,12H2/t15-,17+,19-/m1/s1	DBHQDXKAYSPQOJ-HHXXYDBFSA-N	424.15805421							118835
BRD-K07460436	LSM-30285		54639716	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17+,18+/m0/s1	HBUPPCLFCIMQJL-RCCFBDPRSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H](NC(=O)Cc3ccccn3)[C@@H](CO)O2	BroadT	BRD-K07460436	BRD-K07460436-001-01-6	Broad Institute of MIT and Harvard	BRD-K07460436			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1	InChI=1S/C20H30N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-4,7,16-18,25H,5-6,8-14H2,1H3,(H,22,26)/t16-,17+,18+/m0/s1	HBUPPCLFCIMQJL-RCCFBDPRSA-N	390.22670548							118836
BRD-K38131403	LSM-30286		54639711	InChI=1S/C24H26N2O7/c1-30-17-5-2-15(3-6-17)12-25-23(28)11-18-7-8-19(22(13-27)33-18)26-24(29)16-4-9-20-21(10-16)32-14-31-20/h2-10,18-19,22,27H,11-14H2,1H3,(H,25,28)(H,26,29)/t18-,19-,22-/m0/s1	SJKHPSVPSLXDSV-IPJJNNNSSA-N	COc1ccc(CNC(=O)C[C@H]2O[C@@H](CO)[C@@H](NC(=O)c3ccc4OCOc4c3)C=C2)cc1	BroadT	BRD-K38131403	BRD-K38131403-001-01-5	Broad Institute of MIT and Harvard	BRD-K38131403			COc1ccc(CNC(=O)C[C@H]2O[C@@H](CO)[C@@H](NC(=O)c3ccc4OCOc4c3)C=C2)cc1	InChI=1S/C24H26N2O7/c1-30-17-5-2-15(3-6-17)12-25-23(28)11-18-7-8-19(22(13-27)33-18)26-24(29)16-4-9-20-21(10-16)32-14-31-20/h2-10,18-19,22,27H,11-14H2,1H3,(H,25,28)(H,26,29)/t18-,19-,22-/m0/s1	SJKHPSVPSLXDSV-IPJJNNNSSA-N	454.174001192							118837
BRD-K18856772	LSM-30287		54639676	InChI=1S/C17H23FN2O5S/c1-2-26(23,24)20-15-8-7-14(25-16(15)11-21)9-17(22)19-10-12-3-5-13(18)6-4-12/h3-8,14-16,20-21H,2,9-11H2,1H3,(H,19,22)/t14-,15+,16-/m0/s1	UJYSKGJHSGHRSS-XHSDSOJGSA-N	CCS(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccc(F)cc2)O[C@H]1CO	BroadT	BRD-K18856772	BRD-K18856772-001-01-4	Broad Institute of MIT and Harvard	BRD-K18856772			CCS(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccc(F)cc2)O[C@H]1CO	InChI=1S/C17H23FN2O5S/c1-2-26(23,24)20-15-8-7-14(25-16(15)11-21)9-17(22)19-10-12-3-5-13(18)6-4-12/h3-8,14-16,20-21H,2,9-11H2,1H3,(H,19,22)/t14-,15+,16-/m0/s1	UJYSKGJHSGHRSS-XHSDSOJGSA-N	386.131170746							118838
BRD-K48171978	LSM-30288		54639506	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20-,21-/m1/s1	GOYHAEMMGZTJNJ-HMXCVIKNSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K48171978	BRD-K48171978-001-01-4	Broad Institute of MIT and Harvard	BRD-K48171978			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C22H35N3O5S/c26-17-21-20(24-22(27)12-16-25-14-5-2-6-15-25)10-9-18(30-21)11-13-23-31(28,29)19-7-3-1-4-8-19/h1,3-4,7-8,18,20-21,23,26H,2,5-6,9-17H2,(H,24,27)/t18-,20-,21-/m1/s1	GOYHAEMMGZTJNJ-HMXCVIKNSA-N	453.22974194							118839
CHEMBL2358803	LSM-30289	SID131435792, BRD-K52973286	54639502	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18+,20-/m0/s1	BZALQHWMPIGLLK-HQRMLTQVSA-N	OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K52973286	BRD-K52973286-001-01-3	Broad Institute of MIT and Harvard	BRD-K52973286			OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C22H30F2N4O5/c23-15-2-4-17(24)19(12-15)27-22(31)26-18-5-3-16(33-20(18)14-29)13-21(30)25-6-1-7-28-8-10-32-11-9-28/h2-5,12,16,18,20,29H,1,6-11,13-14H2,(H,25,30)(H2,26,27,31)/t16-,18+,20-/m0/s1	BZALQHWMPIGLLK-HQRMLTQVSA-N	468.2184265							118840
BRD-K57607987	LSM-11914		54646575	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19+,22+,25-/m0/s1	PTZKUMYBXIPSAJ-MNUQHFOJSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cc(F)ccc4F)C[C@@H]3c2c1	BroadT	BRD-K57607987	BRD-K57607987-001-01-4	Broad Institute of MIT and Harvard	BRD-K57607987			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cc(F)ccc4F)O[C@@H]3CO)c2c1	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19+,22+,25-/m0/s1	PTZKUMYBXIPSAJ-MNUQHFOJSA-N	489.207527458							100540
BRD-K39902590	LSM-10862		54646583	InChI=1S/C22H24N2O7/c1-29-14-5-2-12(3-6-14)23-22(28)24-13-4-7-18-16(8-13)17-9-15(10-20(26)27)30-19(11-25)21(17)31-18/h2-8,15,17,19,21,25H,9-11H2,1H3,(H,26,27)(H2,23,24,28)/t15-,17+,19-,21-/m0/s1	WGYNXZDTDZWEBG-MRCYXTNMSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)O)C[C@@H]4c3c2)cc1	BroadT	BRD-K39902590	BRD-K39902590-001-01-1	Broad Institute of MIT and Harvard	BRD-K39902590			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(O)=O)O[C@H]4CO)c3c2)cc1	InChI=1S/C22H24N2O7/c1-29-14-5-2-12(3-6-14)23-22(28)24-13-4-7-18-16(8-13)17-9-15(10-20(26)27)30-19(11-25)21(17)31-18/h2-8,15,17,19,21,25H,9-11H2,1H3,(H,26,27)(H2,23,24,28)/t15-,17+,19-,21-/m0/s1	WGYNXZDTDZWEBG-MRCYXTNMSA-N	428.158351128							99483
BRD-K32381042	LSM-10395		54646690	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23+,25+,27-/m0/s1	QUFPSNAFNYGAMM-BBVYRSAVSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K32381042	BRD-K32381042-001-01-9	Broad Institute of MIT and Harvard	BRD-K32381042			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23+,25+,27-/m0/s1	QUFPSNAFNYGAMM-BBVYRSAVSA-N	589.159133304							99016
BRD-K80362711	LSM-13339		54646591	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25+,27+,29-/m1/s1	AJAMEWYBAUQISK-CMRYXKCBSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NCCc5ccccc5)C[C@H]4c3c2	BroadT	BRD-K80362711	BRD-K80362711-001-01-0	Broad Institute of MIT and Harvard	BRD-K80362711			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCCc4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25+,27+,29-/m1/s1	AJAMEWYBAUQISK-CMRYXKCBSA-N	552.193022074							101978
BRD-K67959996	LSM-12570		54646464	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,21-,24-/m1/s1	QLCUJBUUXYDXPU-QCHQBCSNSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccccc4F)C[C@H]3c2c1	BroadT	BRD-K67959996	BRD-K67959996-001-01-6	Broad Institute of MIT and Harvard	BRD-K67959996			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,21-,24-/m1/s1	QLCUJBUUXYDXPU-QCHQBCSNSA-N	458.185314804							101201
BRD-K46498981	LSM-11267		54646654	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22-,25-,27+/m0/s1	FJJBSMMGLKBUIQ-YSDDDFLKSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)c5cccnc5)cc34)[C@H](CO)O2	BroadT	BRD-K46498981	BRD-K46498981-001-01-8	Broad Institute of MIT and Harvard	BRD-K46498981			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22-,25-,27+/m0/s1	FJJBSMMGLKBUIQ-YSDDDFLKSA-N	503.205635678							99888
BRD-K92650863	LSM-14106		54646455	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23+,25-/m0/s1	OPNBGVGHIKRRPP-VUHNXCBZSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K92650863	BRD-K92650863-001-01-0	Broad Institute of MIT and Harvard	BRD-K92650863			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23+,25-/m0/s1	OPNBGVGHIKRRPP-VUHNXCBZSA-N	468.206050248							102760
BRD-K92023938	LSM-14082		54646649	InChI=1S/C29H31N3O5/c1-18(20-5-3-2-4-6-20)31-28(35)16-22-15-24-23-14-21(32-27(34)13-19-9-11-30-12-10-19)7-8-25(23)37-29(24)26(17-33)36-22/h2-12,14,18,22,24,26,29,33H,13,15-17H2,1H3,(H,31,35)(H,32,34)/t18-,22+,24-,26+,29+/m0/s1	XWECZACFMCVSEP-PXEJVSPGSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K92023938	BRD-K92023938-001-01-1	Broad Institute of MIT and Harvard	BRD-K92023938			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C29H31N3O5/c1-18(20-5-3-2-4-6-20)31-28(35)16-22-15-24-23-14-21(32-27(34)13-19-9-11-30-12-10-19)7-8-25(23)37-29(24)26(17-33)36-22/h2-12,14,18,22,24,26,29,33H,13,15-17H2,1H3,(H,31,35)(H,32,34)/t18-,22+,24-,26+,29+/m0/s1	XWECZACFMCVSEP-PXEJVSPGSA-N	501.226371122							102736
BRD-K09051149	LSM-8976		54646556	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16-,18+,21+/m0/s1	PPHZKQYZEIZDOF-XYPVVTQSSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K09051149	BRD-K09051149-001-01-9	Broad Institute of MIT and Harvard	BRD-K09051149			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16-,18+,21+/m0/s1	PPHZKQYZEIZDOF-XYPVVTQSSA-N	388.199822016							97597
BRD-K26212796	LSM-10019		54646454	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23-,25+/m0/s1	OPNBGVGHIKRRPP-YALMDMJRSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K26212796	BRD-K26212796-001-01-2	Broad Institute of MIT and Harvard	BRD-K26212796			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23-,25+/m0/s1	OPNBGVGHIKRRPP-YALMDMJRSA-N	468.206050248							98640
BRD-K26205424	LSM-10018		54646724	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26-,28-/m0/s1	XHFXJTPXFPIUNX-FMWRLIIDSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NCc5ccc(Cl)cc5)C[C@@H]4c3c2	BroadT	BRD-K26205424	BRD-K26205424-001-01-6	Broad Institute of MIT and Harvard	BRD-K26205424			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26-,28-/m0/s1	XHFXJTPXFPIUNX-FMWRLIIDSA-N	572.138399688							98639
BRD-K37623909	LSM-10703		54646475	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23-,25-,27+/m0/s1	ISBRQPNQXSURAN-AKGJGXJDSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K37623909	BRD-K37623909-001-01-1	Broad Institute of MIT and Harvard	BRD-K37623909			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23-,25-,27+/m0/s1	ISBRQPNQXSURAN-AKGJGXJDSA-N	494.241686828							99324
BRD-K36994929	LSM-10666		54646752	InChI=1S/C19H26N2O6/c1-21(2)9-17(23)20-11-4-5-15-13(6-11)14-7-12(8-18(24)25-3)26-16(10-22)19(14)27-15/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14-,16-,19+/m0/s1	IMIOHDVFACJXOK-BCRCDCHUSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	BroadT	BRD-K36994929	BRD-K36994929-001-01-3	Broad Institute of MIT and Harvard	BRD-K36994929			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	InChI=1S/C19H26N2O6/c1-21(2)9-17(23)20-11-4-5-15-13(6-11)14-7-12(8-18(24)25-3)26-16(10-22)19(14)27-15/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14-,16-,19+/m0/s1	IMIOHDVFACJXOK-BCRCDCHUSA-N	378.179086572							99287
BRD-K66618978	LSM-12484		54646480	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23-,25+,27+/m0/s1	ISBRQPNQXSURAN-VRTJCWFZSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K66618978	BRD-K66618978-001-01-1	Broad Institute of MIT and Harvard	BRD-K66618978			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23-,25+,27+/m0/s1	ISBRQPNQXSURAN-VRTJCWFZSA-N	494.241686828							101115
BRD-K08911251	LSM-8963		54646676	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20+,23-,26-/m1/s1	YCZDHCVCWSKGTE-ZBYDKNLWSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@@H](CO)O2	BroadT	BRD-K08911251	BRD-K08911251-001-01-9	Broad Institute of MIT and Harvard	BRD-K08911251			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20+,23-,26-/m1/s1	YCZDHCVCWSKGTE-ZBYDKNLWSA-N	483.236935806							97584
BRD-K35915475	LSM-10585		54646710	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15-,17+,19+/m0/s1	YSCGDHRCRJHNHR-VGDUNAEUSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K35915475	BRD-K35915475-001-01-7	Broad Institute of MIT and Harvard	BRD-K35915475			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15-,17+,19+/m0/s1	YSCGDHRCRJHNHR-VGDUNAEUSA-N	410.151157262							99206
BRD-K68302437	LSM-12591		54646562	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22+,24-,26-/m1/s1	RXCSFWYPJHKPEM-OLTCJGHMSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)N5CCCCC5)C[C@H]4c3c2	BroadT	BRD-K68302437	BRD-K68302437-001-01-5	Broad Institute of MIT and Harvard	BRD-K68302437			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22+,24-,26-/m1/s1	RXCSFWYPJHKPEM-OLTCJGHMSA-N	516.193022074							101222
BRD-K57072576	LSM-11888		54646687	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22-,24+,27+/m1/s1	AJOHYGOUUFRWKL-YDGNWZKSSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)N4CCc5ccccc5C4)C[C@@H]3c2c1	BroadT	BRD-K57072576	BRD-K57072576-001-01-8	Broad Institute of MIT and Harvard	BRD-K57072576			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22-,24+,27+/m1/s1	AJOHYGOUUFRWKL-YDGNWZKSSA-N	479.242021186							100514
BRD-K31378663	LSM-10327		54646675	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20+,23+,26-/m1/s1	YCZDHCVCWSKGTE-JJYQKYQYSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@H](CO)O2	BroadT	BRD-K31378663	BRD-K31378663-001-01-4	Broad Institute of MIT and Harvard	BRD-K31378663			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20+,23+,26-/m1/s1	YCZDHCVCWSKGTE-JJYQKYQYSA-N	483.236935806							98948
BRD-K20332840	LSM-9670		54646693	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23+,25-,27-/m0/s1	QUFPSNAFNYGAMM-HFFYFMGZSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K20332840	BRD-K20332840-001-01-0	Broad Institute of MIT and Harvard	BRD-K20332840			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23+,25-,27-/m0/s1	QUFPSNAFNYGAMM-HFFYFMGZSA-N	589.159133304							98291
BRD-K07523222	LSM-8876		54646450	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21+,25-,27-/m0/s1	VAJXXPPWCPTEHE-OSHLHTJISA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K07523222	BRD-K07523222-001-01-9	Broad Institute of MIT and Harvard	BRD-K07523222			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21+,25-,27-/m0/s1	VAJXXPPWCPTEHE-OSHLHTJISA-N	508.220951384							97497
BRD-K18187596	LSM-9518		54646519	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29+,31-,33-/m1/s1	BHEWHBNGLCOXBN-WQUCLCEVSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K18187596	BRD-K18187596-001-01-8	Broad Institute of MIT and Harvard	BRD-K18187596			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29+,31-,33-/m1/s1	BHEWHBNGLCOXBN-WQUCLCEVSA-N	618.183600242							98139
BRD-K99517495	LSM-14540		54646631	InChI=1S/C22H22F3N3O5/c23-22(24,25)11-27-19(30)8-14-7-16-15-6-13(28-21(31)12-2-1-5-26-9-12)3-4-17(15)33-20(16)18(10-29)32-14/h1-6,9,14,16,18,20,29H,7-8,10-11H2,(H,27,30)(H,28,31)/t14-,16+,18+,20-/m1/s1	ILIPRRONQGJVHL-VKSDOSABSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)c4cccnc4)cc23	BroadT	BRD-K99517495	BRD-K99517495-001-01-0	Broad Institute of MIT and Harvard	BRD-K99517495			OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C22H22F3N3O5/c23-22(24,25)11-27-19(30)8-14-7-16-15-6-13(28-21(31)12-2-1-5-26-9-12)3-4-17(15)33-20(16)18(10-29)32-14/h1-6,9,14,16,18,20,29H,7-8,10-11H2,(H,27,30)(H,28,31)/t14-,16+,18+,20-/m1/s1	ILIPRRONQGJVHL-VKSDOSABSA-N	465.151155434							103195
BRD-K06790322	LSM-8831		54646718	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23+,26+/m0/s1	LDGCPXKMKGRZSF-UAHYIAQRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K06790322	BRD-K06790322-001-01-4	Broad Institute of MIT and Harvard	BRD-K06790322			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23+,26+/m0/s1	LDGCPXKMKGRZSF-UAHYIAQRSA-N	484.176499758							97452
BRD-K78310246	LSM-13217		54646576	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19+,22+,25-/m1/s1	PTZKUMYBXIPSAJ-ZAZKGPHZSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cc(F)ccc4F)C[C@H]3c2c1	BroadT	BRD-K78310246	BRD-K78310246-001-01-7	Broad Institute of MIT and Harvard	BRD-K78310246			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cc(F)ccc4F)O[C@H]3CO)c2c1	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19+,22+,25-/m1/s1	PTZKUMYBXIPSAJ-ZAZKGPHZSA-N	489.207527458							101856
BRD-K83745732	LSM-13548		54646484	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22+,24+,26+,28-/m0/s1	CGDALBMFLMENHX-PHOYKXCNSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K83745732	BRD-K83745732-001-01-8	Broad Institute of MIT and Harvard	BRD-K83745732			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22+,24+,26+,28-/m0/s1	CGDALBMFLMENHX-PHOYKXCNSA-N	507.273321314							102190
BRD-K69724418	LSM-12686		54646582	InChI=1S/C22H24N2O7/c1-29-14-5-2-12(3-6-14)23-22(28)24-13-4-7-18-16(8-13)17-9-15(10-20(26)27)30-19(11-25)21(17)31-18/h2-8,15,17,19,21,25H,9-11H2,1H3,(H,26,27)(H2,23,24,28)/t15-,17+,19+,21-/m1/s1	WGYNXZDTDZWEBG-ZWVMGRIOSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)O)C[C@H]4c3c2)cc1	BroadT	BRD-K69724418	BRD-K69724418-001-01-2	Broad Institute of MIT and Harvard	BRD-K69724418			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(O)=O)O[C@H]4CO)c3c2)cc1	InChI=1S/C22H24N2O7/c1-29-14-5-2-12(3-6-14)23-22(28)24-13-4-7-18-16(8-13)17-9-15(10-20(26)27)30-19(11-25)21(17)31-18/h2-8,15,17,19,21,25H,9-11H2,1H3,(H,26,27)(H2,23,24,28)/t15-,17+,19+,21-/m1/s1	WGYNXZDTDZWEBG-ZWVMGRIOSA-N	428.158351128							101320
BRD-K35589880	LSM-10566		54646630	InChI=1S/C22H22F3N3O5/c23-22(24,25)11-27-19(30)8-14-7-16-15-6-13(28-21(31)12-2-1-5-26-9-12)3-4-17(15)33-20(16)18(10-29)32-14/h1-6,9,14,16,18,20,29H,7-8,10-11H2,(H,27,30)(H,28,31)/t14-,16-,18-,20+/m0/s1	ILIPRRONQGJVHL-PFSLXQJOSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)c4cccnc4)cc23	BroadT	BRD-K35589880	BRD-K35589880-001-01-9	Broad Institute of MIT and Harvard	BRD-K35589880			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C22H22F3N3O5/c23-22(24,25)11-27-19(30)8-14-7-16-15-6-13(28-21(31)12-2-1-5-26-9-12)3-4-17(15)33-20(16)18(10-29)32-14/h1-6,9,14,16,18,20,29H,7-8,10-11H2,(H,27,30)(H,28,31)/t14-,16-,18-,20+/m0/s1	ILIPRRONQGJVHL-PFSLXQJOSA-N	465.151155434							99187
BRD-K83933044	LSM-13559		54646579	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19-,22+,25+/m0/s1	PTZKUMYBXIPSAJ-CMJNZLRFSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cc(F)ccc4F)C[C@H]3c2c1	BroadT	BRD-K83933044	BRD-K83933044-001-01-3	Broad Institute of MIT and Harvard	BRD-K83933044			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cc(F)ccc4F)O[C@@H]3CO)c2c1	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19-,22+,25+/m0/s1	PTZKUMYBXIPSAJ-CMJNZLRFSA-N	489.207527458							102201
BRD-K25118245-001-01-9	LSM-30290	BRD-K25118245	54646460	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23+,25+/m1/s1	OPNBGVGHIKRRPP-ASASOQJESA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K25118245	BRD-K25118245-001-01-9	Broad Institute of MIT and Harvard	BRD-K25118245			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23+,25+/m1/s1	OPNBGVGHIKRRPP-ASASOQJESA-N	468.206050248							118841
BRD-K38498143	LSM-10759		54646570	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22+,24-,27-/m0/s1	NURZYHIHZDJTSB-QNKJOHNESA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K38498143	BRD-K38498143-001-01-3	Broad Institute of MIT and Harvard	BRD-K38498143			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22+,24-,27-/m0/s1	NURZYHIHZDJTSB-QNKJOHNESA-N	488.205970036							99380
CHEMBL2359061	LSM-11754	BRD-K54822582, SID131443082	54646708	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15+,17-,19-/m1/s1	YSCGDHRCRJHNHR-ZSFPCNDZSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K54822582	BRD-K54822582-001-01-1	Broad Institute of MIT and Harvard	BRD-K54822582			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15+,17-,19-/m1/s1	YSCGDHRCRJHNHR-ZSFPCNDZSA-N	410.151157262							100379
BRD-K79522563	LSM-13287		54646685	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22+,24-,27-/m0/s1	AJOHYGOUUFRWKL-QNKJOHNESA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)N4CCc5ccccc5C4)C[C@@H]3c2c1	BroadT	BRD-K79522563	BRD-K79522563-001-01-1	Broad Institute of MIT and Harvard	BRD-K79522563			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22+,24-,27-/m0/s1	AJOHYGOUUFRWKL-QNKJOHNESA-N	479.242021186							101926
BRD-K67765874	LSM-12556		54646597	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21+,23+,25-/m0/s1	UYFCGOQSYKFWAJ-PFJUQGFLSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)NCC5CC5)C[C@@H]4c3c2	BroadT	BRD-K67765874	BRD-K67765874-001-01-4	Broad Institute of MIT and Harvard	BRD-K67765874			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21+,23+,25-/m0/s1	UYFCGOQSYKFWAJ-PFJUQGFLSA-N	502.17737201							101187
CHEMBL2358438	LSM-9839	SID131443009, BRD-K23407460	54646635	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23+,25+,27-/m0/s1	SNGIXDWGPLKZOT-KCFOJUKOSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K23407460	BRD-K23407460-001-01-6	Broad Institute of MIT and Harvard	BRD-K23407460			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23+,25+,27-/m0/s1	SNGIXDWGPLKZOT-KCFOJUKOSA-N	487.210721058							98460
CHEMBL2143993	LSM-10216	BRD-K29475732, SID131442986	54646612	InChI=1S/C29H29N3O5/c33-17-26-28-24(13-22(36-26)14-27(34)32-11-9-18-4-1-2-5-20(18)16-32)23-12-21(7-8-25(23)37-28)31-29(35)19-6-3-10-30-15-19/h1-8,10,12,15,22,24,26,28,33H,9,11,13-14,16-17H2,(H,31,35)/t22-,24+,26+,28-/m0/s1	AAXDVORIQTTZBB-XABOBXATSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)c6cccnc6)cc45	BroadT	BRD-K29475732	BRD-K29475732-001-01-9	Broad Institute of MIT and Harvard	BRD-K29475732			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C29H29N3O5/c33-17-26-28-24(13-22(36-26)14-27(34)32-11-9-18-4-1-2-5-20(18)16-32)23-12-21(7-8-25(23)37-28)31-29(35)19-6-3-10-30-15-19/h1-8,10,12,15,22,24,26,28,33H,9,11,13-14,16-17H2,(H,31,35)/t22-,24+,26+,28-/m0/s1	AAXDVORIQTTZBB-XABOBXATSA-N	499.210721058							98837
BRD-K46300014	LSM-11253		54646545	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21+,23+,26-/m1/s1	LVKYMQHIUYSGLY-HMMJVGNDSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Cc5ccncc5)cc34)[C@H](CO)O2	BroadT	BRD-K46300014	BRD-K46300014-001-01-7	Broad Institute of MIT and Harvard	BRD-K46300014			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21+,23+,26-/m1/s1	LVKYMQHIUYSGLY-HMMJVGNDSA-N	480.237270164							99874
BRD-K36888933	LSM-10659		54646458	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23-,25-/m0/s1	OPNBGVGHIKRRPP-PYTYSOFPSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K36888933	BRD-K36888933-001-01-1	Broad Institute of MIT and Harvard	BRD-K36888933			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23-,25-/m0/s1	OPNBGVGHIKRRPP-PYTYSOFPSA-N	468.206050248							99280
BRD-K25031780	LSM-9950		54646619	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21+,25-,27-/m1/s1	PHEIPYKARIAFSI-DBXGMPFESA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K25031780	BRD-K25031780-001-01-5	Broad Institute of MIT and Harvard	BRD-K25031780			OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21+,25-,27-/m1/s1	PHEIPYKARIAFSI-DBXGMPFESA-N	517.184900234							98571
BRD-K83301268	LSM-13516		54646615	InChI=1S/C29H29N3O5/c33-17-26-28-24(13-22(36-26)14-27(34)32-11-9-18-4-1-2-5-20(18)16-32)23-12-21(7-8-25(23)37-28)31-29(35)19-6-3-10-30-15-19/h1-8,10,12,15,22,24,26,28,33H,9,11,13-14,16-17H2,(H,31,35)/t22-,24-,26+,28+/m0/s1	AAXDVORIQTTZBB-SFNAGVRGSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)c6cccnc6)cc45	BroadT	BRD-K83301268	BRD-K83301268-001-01-2	Broad Institute of MIT and Harvard	BRD-K83301268			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C29H29N3O5/c33-17-26-28-24(13-22(36-26)14-27(34)32-11-9-18-4-1-2-5-20(18)16-32)23-12-21(7-8-25(23)37-28)31-29(35)19-6-3-10-30-15-19/h1-8,10,12,15,22,24,26,28,33H,9,11,13-14,16-17H2,(H,31,35)/t22-,24-,26+,28+/m0/s1	AAXDVORIQTTZBB-SFNAGVRGSA-N	499.210721058							102157
CHEMBL2356537	LSM-6830	BRD-K35860134, SID131442891	54646517	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29+,31+,33-/m0/s1	BHEWHBNGLCOXBN-SWADQOEESA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K35860134	BRD-K35860134-001-01-8	Broad Institute of MIT and Harvard	BRD-K35860134			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29+,31+,33-/m0/s1	BHEWHBNGLCOXBN-SWADQOEESA-N	618.183600242							95451
BRD-K02275742	LSM-8573		54646756	InChI=1S/C19H26N2O6/c1-21(2)9-17(23)20-11-4-5-15-13(6-11)14-7-12(8-18(24)25-3)26-16(10-22)19(14)27-15/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16-,19-/m0/s1	IMIOHDVFACJXOK-YIYSPXCVSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	BroadT	BRD-K02275742	BRD-K02275742-001-01-2	Broad Institute of MIT and Harvard	BRD-K02275742			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	InChI=1S/C19H26N2O6/c1-21(2)9-17(23)20-11-4-5-15-13(6-11)14-7-12(8-18(24)25-3)26-16(10-22)19(14)27-15/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16-,19-/m0/s1	IMIOHDVFACJXOK-YIYSPXCVSA-N	378.179086572							97194
BRD-K59196623	LSM-12006		54646462	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,21+,24-/m0/s1	QLCUJBUUXYDXPU-GDAJUDPFSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccccc4F)C[C@@H]3c2c1	BroadT	BRD-K59196623	BRD-K59196623-001-01-6	Broad Institute of MIT and Harvard	BRD-K59196623			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,21+,24-/m0/s1	QLCUJBUUXYDXPU-GDAJUDPFSA-N	458.185314804							100632
BRD-K80807816	LSM-13371		54646738	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23-,27-,29+/m1/s1	WERZBRNJFLNQTM-HMISVTBFSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K80807816	BRD-K80807816-001-01-8	Broad Institute of MIT and Harvard	BRD-K80807816			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23-,27-,29+/m1/s1	WERZBRNJFLNQTM-HMISVTBFSA-N	530.20530132							102010
BRD-K63025696	LSM-12263		54646477	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23-,25+,27+/m0/s1	ISBRQPNQXSURAN-DDMNXORRSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K63025696	BRD-K63025696-001-01-3	Broad Institute of MIT and Harvard	BRD-K63025696			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23-,25+,27+/m0/s1	ISBRQPNQXSURAN-DDMNXORRSA-N	494.241686828							100889
BRD-K37510840	LSM-10695		54646476	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23+,25-,27-/m1/s1	ISBRQPNQXSURAN-NZAHZBTPSA-N	C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K37510840	BRD-K37510840-001-01-2	Broad Institute of MIT and Harvard	BRD-K37510840			C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23+,25-,27-/m1/s1	ISBRQPNQXSURAN-NZAHZBTPSA-N	494.241686828							99316
BRD-K58154162	LSM-11939		54646653	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22-,25-,27+/m1/s1	FJJBSMMGLKBUIQ-GKYRZQBGSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)c5cccnc5)cc34)[C@@H](CO)O2	BroadT	BRD-K58154162	BRD-K58154162-001-01-3	Broad Institute of MIT and Harvard	BRD-K58154162			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22-,25-,27+/m1/s1	FJJBSMMGLKBUIQ-GKYRZQBGSA-N	503.205635678							100565
BRD-K27661070	LSM-10094		54646594	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25-,27+,29+/m1/s1	AJAMEWYBAUQISK-DFXUFIHISA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)NCCc5ccccc5)C[C@@H]4c3c2	BroadT	BRD-K27661070	BRD-K27661070-001-01-6	Broad Institute of MIT and Harvard	BRD-K27661070			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCCc4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25-,27+,29+/m1/s1	AJAMEWYBAUQISK-DFXUFIHISA-N	552.193022074							98715
BRD-K37991633	LSM-10729		54646704	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15-,17-,19+/m1/s1	YSCGDHRCRJHNHR-VWMOJTHMSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K37991633	BRD-K37991633-001-01-5	Broad Institute of MIT and Harvard	BRD-K37991633			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15-,17-,19+/m1/s1	YSCGDHRCRJHNHR-VWMOJTHMSA-N	410.151157262							99350
BRD-K82935485	LSM-13494		54646543	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21-,23-,26+/m1/s1	LVKYMQHIUYSGLY-INZVZTLUSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Cc5ccncc5)cc34)[C@@H](CO)O2	BroadT	BRD-K82935485	BRD-K82935485-001-01-5	Broad Institute of MIT and Harvard	BRD-K82935485			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21-,23-,26+/m1/s1	LVKYMQHIUYSGLY-INZVZTLUSA-N	480.237270164							102135
BRD-K91786278	LSM-14069		54646743	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23+,27-,29-/m0/s1	WERZBRNJFLNQTM-IOTICUKNSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K91786278	BRD-K91786278-001-01-2	Broad Institute of MIT and Harvard	BRD-K91786278			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23+,27-,29-/m0/s1	WERZBRNJFLNQTM-IOTICUKNSA-N	530.20530132							102723
BRD-K87089311	LSM-13769		54646605	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19+,21+,23-/m1/s1	GQLDDSCVBIFPRR-CTZMOBNVSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	BroadT	BRD-K87089311	BRD-K87089311-001-01-6	Broad Institute of MIT and Harvard	BRD-K87089311			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19+,21+,23-/m1/s1	GQLDDSCVBIFPRR-CTZMOBNVSA-N	476.161721946							102418
BRD-K82166043	LSM-13451		54646535	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,23-/m0/s1	HQZJCXNXJWTAKA-IRLNJFMJSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4cccnc4)C[C@@H]3c2c1	BroadT	BRD-K82166043	BRD-K82166043-001-01-2	Broad Institute of MIT and Harvard	BRD-K82166043			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cccnc4)O[C@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,23-/m0/s1	HQZJCXNXJWTAKA-IRLNJFMJSA-N	441.189985614							102091
BRD-K77827548	LSM-13188		54646606	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19+,21-,23-/m1/s1	GQLDDSCVBIFPRR-LQOJQYNMSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K77827548	BRD-K77827548-001-01-6	Broad Institute of MIT and Harvard	BRD-K77827548			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19+,21-,23-/m1/s1	GQLDDSCVBIFPRR-LQOJQYNMSA-N	476.161721946							101826
BRD-K79339982	LSM-13278		54646632	InChI=1S/C22H22F3N3O5/c23-22(24,25)11-27-19(30)8-14-7-16-15-6-13(28-21(31)12-2-1-5-26-9-12)3-4-17(15)33-20(16)18(10-29)32-14/h1-6,9,14,16,18,20,29H,7-8,10-11H2,(H,27,30)(H,28,31)/t14-,16+,18-,20-/m1/s1	ILIPRRONQGJVHL-IHMNZUQTSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)c4cccnc4)cc23	BroadT	BRD-K79339982	BRD-K79339982-001-01-3	Broad Institute of MIT and Harvard	BRD-K79339982			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C22H22F3N3O5/c23-22(24,25)11-27-19(30)8-14-7-16-15-6-13(28-21(31)12-2-1-5-26-9-12)3-4-17(15)33-20(16)18(10-29)32-14/h1-6,9,14,16,18,20,29H,7-8,10-11H2,(H,27,30)(H,28,31)/t14-,16+,18-,20-/m1/s1	ILIPRRONQGJVHL-IHMNZUQTSA-N	465.151155434							101917
CHEMBL2354534	LSM-9721	BRD-K21281680, SID131443008	54646634	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21-,23-,25-,27+/m1/s1	SNGIXDWGPLKZOT-DJILIAROSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K21281680	BRD-K21281680-001-01-1	Broad Institute of MIT and Harvard	BRD-K21281680			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21-,23-,25-,27+/m1/s1	SNGIXDWGPLKZOT-DJILIAROSA-N	487.210721058							98342
BRD-K69806016	LSM-12690		54646448	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21+,25+,27-/m1/s1	VAJXXPPWCPTEHE-ZPNKKQCCSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K69806016	BRD-K69806016-001-01-3	Broad Institute of MIT and Harvard	BRD-K69806016			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21+,25+,27-/m1/s1	VAJXXPPWCPTEHE-ZPNKKQCCSA-N	508.220951384							101324
BRD-K16934333	LSM-9451		54646617	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21-,25-,27+/m0/s1	PHEIPYKARIAFSI-GCMLAXDWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K16934333	BRD-K16934333-001-01-3	Broad Institute of MIT and Harvard	BRD-K16934333			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21-,25-,27+/m0/s1	PHEIPYKARIAFSI-GCMLAXDWSA-N	517.184900234							98072
BRD-K03548778	LSM-8652		54646627	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16-,18+,20+/m0/s1	KXSIODNMTPRENB-LBLLVPRASA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K03548778	BRD-K03548778-001-01-8	Broad Institute of MIT and Harvard	BRD-K03548778			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16-,18+,20+/m0/s1	KXSIODNMTPRENB-LBLLVPRASA-N	404.194736636							97273
BRD-K44755254	LSM-11149		54646714	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23+,26-/m0/s1	LDGCPXKMKGRZSF-RLCNXLTRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K44755254	BRD-K44755254-001-01-3	Broad Institute of MIT and Harvard	BRD-K44755254			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23+,26-/m0/s1	LDGCPXKMKGRZSF-RLCNXLTRSA-N	484.176499758							99770
BRD-K92789454	LSM-14116		54646748	InChI=1S/C27H34N4O5/c32-17-24-26-22(14-20(35-24)15-25(33)29-9-12-31-10-2-1-3-11-31)21-13-19(6-7-23(21)36-26)30-27(34)18-5-4-8-28-16-18/h4-8,13,16,20,22,24,26,32H,1-3,9-12,14-15,17H2,(H,29,33)(H,30,34)/t20-,22+,24+,26-/m1/s1	SWOCEPZEXMNKQZ-GRTAZNFBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K92789454	BRD-K92789454-001-01-1	Broad Institute of MIT and Harvard	BRD-K92789454			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H34N4O5/c32-17-24-26-22(14-20(35-24)15-25(33)29-9-12-31-10-2-1-3-11-31)21-13-19(6-7-23(21)36-26)30-27(34)18-5-4-8-28-16-18/h4-8,13,16,20,22,24,26,32H,1-3,9-12,14-15,17H2,(H,29,33)(H,30,34)/t20-,22+,24+,26-/m1/s1	SWOCEPZEXMNKQZ-GRTAZNFBSA-N	494.252920228							102770
BRD-K71259673	LSM-12782		54646443	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28+,30-,32-/m0/s1	MARYDHBQWVLAFX-YTXOVJPBSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K71259673	BRD-K71259673-001-01-5	Broad Institute of MIT and Harvard	BRD-K71259673			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28+,30-,32-/m0/s1	MARYDHBQWVLAFX-YTXOVJPBSA-N	572.252251512							101419
BRD-K28105726	LSM-10132		54646699	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21+,25+,27-/m1/s1	MOISLORHFJLABX-ZPNKKQCCSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K28105726	BRD-K28105726-001-01-1	Broad Institute of MIT and Harvard	BRD-K28105726			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21+,25+,27-/m1/s1	MOISLORHFJLABX-ZPNKKQCCSA-N	524.215866004							98753
CHEMBL2362331	LSM-10109	SID131443046, BRD-K27827760	54646672	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20-,23-,26+/m1/s1	YCZDHCVCWSKGTE-SNMOHMLRSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@@H](CO)O2	BroadT	BRD-K27827760	BRD-K27827760-001-01-8	Broad Institute of MIT and Harvard	BRD-K27827760			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20-,23-,26+/m1/s1	YCZDHCVCWSKGTE-SNMOHMLRSA-N	483.236935806							98730
BRD-K47094330	LSM-11304		54646626	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16+,18-,20-/m0/s1	KXSIODNMTPRENB-HUOQQOJOSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K47094330	BRD-K47094330-001-01-2	Broad Institute of MIT and Harvard	BRD-K47094330			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16+,18-,20-/m0/s1	KXSIODNMTPRENB-HUOQQOJOSA-N	404.194736636							99925
BRD-K91745259	LSM-14065		54646577	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19+,22-,25-/m1/s1	PTZKUMYBXIPSAJ-NDZNVJBZSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4cc(F)ccc4F)C[C@H]3c2c1	BroadT	BRD-K91745259	BRD-K91745259-001-01-1	Broad Institute of MIT and Harvard	BRD-K91745259			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cc(F)ccc4F)O[C@@H]3CO)c2c1	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19+,22-,25-/m1/s1	PTZKUMYBXIPSAJ-NDZNVJBZSA-N	489.207527458							131230
BRD-K13517531	LSM-9239		54646537	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m1/s1	HQZJCXNXJWTAKA-DUCQWWKISA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cccnc4)C[C@@H]3c2c1	BroadT	BRD-K13517531	BRD-K13517531-001-01-9	Broad Institute of MIT and Harvard	BRD-K13517531			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cccnc4)O[C@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m1/s1	HQZJCXNXJWTAKA-DUCQWWKISA-N	441.189985614							97860
BRD-K42074118	LSM-10982		54646563	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22+,24-,26-/m0/s1	RXCSFWYPJHKPEM-SFUHPXFESA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)N5CCCCC5)C[C@@H]4c3c2	BroadT	BRD-K42074118	BRD-K42074118-001-01-7	Broad Institute of MIT and Harvard	BRD-K42074118			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22+,24-,26-/m0/s1	RXCSFWYPJHKPEM-SFUHPXFESA-N	516.193022074							99603
BRD-K66344816	LSM-12470		54646566	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22-,24-,27+/m0/s1	NURZYHIHZDJTSB-MWLAQPAQSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K66344816	BRD-K66344816-001-01-0	Broad Institute of MIT and Harvard	BRD-K66344816			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22-,24-,27+/m0/s1	NURZYHIHZDJTSB-MWLAQPAQSA-N	488.205970036							101101
BRD-K44657322	LSM-11144		54646489	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22-,24+,26-,28-/m0/s1	CGDALBMFLMENHX-KANRPKHKSA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K44657322	BRD-K44657322-001-01-9	Broad Institute of MIT and Harvard	BRD-K44657322			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22-,24+,26-,28-/m0/s1	CGDALBMFLMENHX-KANRPKHKSA-N	507.273321314							99765
BRD-K59519347	LSM-12025		54646712	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23-,26+/m1/s1	LDGCPXKMKGRZSF-INZVZTLUSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K59519347	BRD-K59519347-001-01-4	Broad Institute of MIT and Harvard	BRD-K59519347			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23-,26+/m1/s1	LDGCPXKMKGRZSF-INZVZTLUSA-N	484.176499758							100651
BRD-K27919582	LSM-10116		54646747	InChI=1S/C27H34N4O5/c32-17-24-26-22(14-20(35-24)15-25(33)29-9-12-31-10-2-1-3-11-31)21-13-19(6-7-23(21)36-26)30-27(34)18-5-4-8-28-16-18/h4-8,13,16,20,22,24,26,32H,1-3,9-12,14-15,17H2,(H,29,33)(H,30,34)/t20-,22+,24+,26-/m0/s1	SWOCEPZEXMNKQZ-RXDHMRHRSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K27919582	BRD-K27919582-001-01-9	Broad Institute of MIT and Harvard	BRD-K27919582			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H34N4O5/c32-17-24-26-22(14-20(35-24)15-25(33)29-9-12-31-10-2-1-3-11-31)21-13-19(6-7-23(21)36-26)30-27(34)18-5-4-8-28-16-18/h4-8,13,16,20,22,24,26,32H,1-3,9-12,14-15,17H2,(H,29,33)(H,30,34)/t20-,22+,24+,26-/m0/s1	SWOCEPZEXMNKQZ-RXDHMRHRSA-N	494.252920228							98737
BRD-K99927461	LSM-14570		54646503	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19+,21+,23-/m1/s1	JDHDHCLBKAEOSQ-QXPQREGVSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	BroadT	BRD-K99927461	BRD-K99927461-001-01-1	Broad Institute of MIT and Harvard	BRD-K99927461			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19+,21+,23-/m1/s1	JDHDHCLBKAEOSQ-QXPQREGVSA-N	523.193020246							103226
BRD-K48038858	LSM-11351		54646642	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23-,25+,27+/m1/s1	SNGIXDWGPLKZOT-DPQCAWRDSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K48038858	BRD-K48038858-001-01-0	Broad Institute of MIT and Harvard	BRD-K48038858			C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23-,25+,27+/m1/s1	SNGIXDWGPLKZOT-DPQCAWRDSA-N	487.210721058							99972
BRD-K64409112	LSM-12359		54646549	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21-,23+,26+/m1/s1	LVKYMQHIUYSGLY-BCHMZHATSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Cc5ccncc5)cc34)[C@H](CO)O2	BroadT	BRD-K64409112	BRD-K64409112-001-01-4	Broad Institute of MIT and Harvard	BRD-K64409112			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21-,23+,26+/m1/s1	LVKYMQHIUYSGLY-BCHMZHATSA-N	480.237270164							100986
BRD-K66757832	LSM-12496		54646647	InChI=1S/C29H31N3O5/c1-18(20-5-3-2-4-6-20)31-28(35)16-22-15-24-23-14-21(32-27(34)13-19-9-11-30-12-10-19)7-8-25(23)37-29(24)26(17-33)36-22/h2-12,14,18,22,24,26,29,33H,13,15-17H2,1H3,(H,31,35)(H,32,34)/t18-,22+,24+,26+,29-/m0/s1	XWECZACFMCVSEP-VFSPHUKHSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K66757832	BRD-K66757832-001-01-3	Broad Institute of MIT and Harvard	BRD-K66757832			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C29H31N3O5/c1-18(20-5-3-2-4-6-20)31-28(35)16-22-15-24-23-14-21(32-27(34)13-19-9-11-30-12-10-19)7-8-25(23)37-29(24)26(17-33)36-22/h2-12,14,18,22,24,26,29,33H,13,15-17H2,1H3,(H,31,35)(H,32,34)/t18-,22+,24+,26+,29-/m0/s1	XWECZACFMCVSEP-VFSPHUKHSA-N	501.226371122							101127
BRD-K36081737	LSM-10604		54646552	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16+,18+,21-/m0/s1	PPHZKQYZEIZDOF-QYDULMRYSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K36081737	BRD-K36081737-001-01-1	Broad Institute of MIT and Harvard	BRD-K36081737			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16+,18+,21-/m0/s1	PPHZKQYZEIZDOF-QYDULMRYSA-N	388.199822016							99225
BRD-K75405605	LSM-13043		54646621	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21-,25+,27+/m0/s1	PHEIPYKARIAFSI-ZTUCRWOVSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K75405605	BRD-K75405605-001-01-3	Broad Institute of MIT and Harvard	BRD-K75405605			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21-,25+,27+/m0/s1	PHEIPYKARIAFSI-ZTUCRWOVSA-N	517.184900234							101680
BRD-K09945302	LSM-9042		54646697	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21-,25-,27+/m0/s1	MOISLORHFJLABX-GCMLAXDWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K09945302	BRD-K09945302-001-01-5	Broad Institute of MIT and Harvard	BRD-K09945302			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21-,25-,27+/m0/s1	MOISLORHFJLABX-GCMLAXDWSA-N	524.215866004							97663
BRD-K57345537	LSM-11901		54646521	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29-,31+,33+/m1/s1	BHEWHBNGLCOXBN-IFFLXBFKSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K57345537	BRD-K57345537-001-01-6	Broad Institute of MIT and Harvard	BRD-K57345537			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29-,31+,33+/m1/s1	BHEWHBNGLCOXBN-IFFLXBFKSA-N	618.183600242							100527
BRD-K32240700	LSM-10384		54646742	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23+,27-,29-/m1/s1	WERZBRNJFLNQTM-PEUORWFRSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K32240700	BRD-K32240700-001-01-0	Broad Institute of MIT and Harvard	BRD-K32240700			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23+,27-,29-/m1/s1	WERZBRNJFLNQTM-PEUORWFRSA-N	530.20530132							99005
BRD-K54595917	LSM-11743		54646722	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26+,28-/m1/s1	XHFXJTPXFPIUNX-HWMSKCLUSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NCc5ccc(Cl)cc5)C[C@H]4c3c2	BroadT	BRD-K54595917	BRD-K54595917-001-01-9	Broad Institute of MIT and Harvard	BRD-K54595917			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26+,28-/m1/s1	XHFXJTPXFPIUNX-HWMSKCLUSA-N	572.138399688							100368
BRD-K00598313	LSM-8473		54646609	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19-,21+,23+/m1/s1	GQLDDSCVBIFPRR-ZLTNCQPASA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	BroadT	BRD-K00598313	BRD-K00598313-001-01-8	Broad Institute of MIT and Harvard	BRD-K00598313			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19-,21+,23+/m1/s1	GQLDDSCVBIFPRR-ZLTNCQPASA-N	476.161721946							97094
CHEMBL2361542	LSM-11051	BRD-K43184721, SID131442872	54646498	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19-,21+,24+/m0/s1	KRQAAGOFZVBHDO-NOOBJOLFSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NC4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K43184721	BRD-K43184721-001-01-2	Broad Institute of MIT and Harvard	BRD-K43184721			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NC4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19-,21+,24+/m0/s1	KRQAAGOFZVBHDO-NOOBJOLFSA-N	445.25767125							99672
BRD-K83025131	LSM-13502		54646666	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22-,24-,26+/m0/s1	SGAJFFANPLXWDT-CLKGCZJISA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K83025131	BRD-K83025131-001-01-2	Broad Institute of MIT and Harvard	BRD-K83025131			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22-,24-,26+/m0/s1	SGAJFFANPLXWDT-CLKGCZJISA-N	518.188685622							102143
BRD-K98370172	LSM-14472		54646702	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21-,25+,27+/m0/s1	MOISLORHFJLABX-ZTUCRWOVSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K98370172	BRD-K98370172-001-01-5	Broad Institute of MIT and Harvard	BRD-K98370172			OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21-,25+,27+/m0/s1	MOISLORHFJLABX-ZTUCRWOVSA-N	524.215866004							103127
BRD-K89551737	LSM-13948		54646539	InChI=1S/C24H28N2O6/c1-26(2)15-4-6-19-17(8-15)18-9-16(31-22(12-27)24(18)32-19)10-23(28)25-11-14-3-5-20-21(7-14)30-13-29-20/h3-8,16,18,22,24,27H,9-13H2,1-2H3,(H,25,28)/t16-,18-,22-,24+/m0/s1	XORJDKZTELKQNH-GODDJFOZSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc5OCOc5c4)C[C@H]3c2c1	BroadT	BRD-K89551737	BRD-K89551737-001-01-9	Broad Institute of MIT and Harvard	BRD-K89551737			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc5OCOc5c4)O[C@H]3CO)c2c1	InChI=1S/C24H28N2O6/c1-26(2)15-4-6-19-17(8-15)18-9-16(31-22(12-27)24(18)32-19)10-23(28)25-11-14-3-5-20-21(7-14)30-13-29-20/h3-8,16,18,22,24,27H,9-13H2,1-2H3,(H,25,28)/t16-,18-,22-,24+/m0/s1	XORJDKZTELKQNH-GODDJFOZSA-N	440.194736636							102601
BRD-K02516751	LSM-8591		54646644	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23+,25-,27-/m1/s1	SNGIXDWGPLKZOT-QEJRMIRFSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K02516751	BRD-K02516751-001-01-7	Broad Institute of MIT and Harvard	BRD-K02516751			C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23+,25-,27-/m1/s1	SNGIXDWGPLKZOT-QEJRMIRFSA-N	487.210721058							97212
BRD-K25469705	LSM-9974		54646471	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23-,25-,27+/m0/s1	ISBRQPNQXSURAN-YBUCPTJXSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K25469705	BRD-K25469705-001-01-9	Broad Institute of MIT and Harvard	BRD-K25469705			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23-,25-,27+/m0/s1	ISBRQPNQXSURAN-YBUCPTJXSA-N	494.241686828							98595
BRD-K34898609	LSM-10528		54646445	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28-,30+,32+/m1/s1	MARYDHBQWVLAFX-LCZYSZMCSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K34898609	BRD-K34898609-001-01-5	Broad Institute of MIT and Harvard	BRD-K34898609			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28-,30+,32+/m1/s1	MARYDHBQWVLAFX-LCZYSZMCSA-N	572.252251512							99149
BRD-K81943679	LSM-13429		54646636	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23+,25+,27-/m1/s1	SNGIXDWGPLKZOT-XASBYKNISA-N	C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K81943679	BRD-K81943679-001-01-6	Broad Institute of MIT and Harvard	BRD-K81943679			C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23+,25+,27-/m1/s1	SNGIXDWGPLKZOT-XASBYKNISA-N	487.210721058							102069
BRD-K19549004	LSM-9607		54646659	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22-,25+,27+/m0/s1	FJJBSMMGLKBUIQ-ZTQIFVIOSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)c5cccnc5)cc34)[C@@H](CO)O2	BroadT	BRD-K19549004	BRD-K19549004-001-01-4	Broad Institute of MIT and Harvard	BRD-K19549004			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22-,25+,27+/m0/s1	FJJBSMMGLKBUIQ-ZTQIFVIOSA-N	503.205635678							98228
BRD-K29956297	LSM-10242		54646669	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22+,24-,26-/m0/s1	SGAJFFANPLXWDT-SFUHPXFESA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K29956297	BRD-K29956297-001-01-5	Broad Institute of MIT and Harvard	BRD-K29956297			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22+,24-,26-/m0/s1	SGAJFFANPLXWDT-SFUHPXFESA-N	518.188685622							98863
BRD-K95926324	LSM-14313		54646603	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19-,21-,23+/m0/s1	GQLDDSCVBIFPRR-RAQQXGOJSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	BroadT	BRD-K95926324	BRD-K95926324-001-01-4	Broad Institute of MIT and Harvard	BRD-K95926324			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19-,21-,23+/m0/s1	GQLDDSCVBIFPRR-RAQQXGOJSA-N	476.161721946							102967
BRD-K56916068	LSM-11869		54646507	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19-,21+,23+/m1/s1	JDHDHCLBKAEOSQ-YZBYQZESSA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	BroadT	BRD-K56916068	BRD-K56916068-001-01-2	Broad Institute of MIT and Harvard	BRD-K56916068			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19-,21+,23+/m1/s1	JDHDHCLBKAEOSQ-YZBYQZESSA-N	523.193020246							100495
BRD-K50667779	LSM-11513		54646638	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21-,23+,25+,27-/m1/s1	SNGIXDWGPLKZOT-CBYRCLPRSA-N	C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K50667779	BRD-K50667779-001-01-7	Broad Institute of MIT and Harvard	BRD-K50667779			C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21-,23+,25+,27-/m1/s1	SNGIXDWGPLKZOT-CBYRCLPRSA-N	487.210721058							100134
BRD-K71271296	LSM-12783		54646551	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16-,18-,21+/m0/s1	PPHZKQYZEIZDOF-YZZRYBLGSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K71271296	BRD-K71271296-001-01-7	Broad Institute of MIT and Harvard	BRD-K71271296			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16-,18-,21+/m0/s1	PPHZKQYZEIZDOF-YZZRYBLGSA-N	388.199822016							101420
CHEMBL2362010	LSM-14143	BRD-K93164329, SID131443062	54646688	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23-,25-,27+/m1/s1	QUFPSNAFNYGAMM-UFUIAINPSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K93164329	BRD-K93164329-001-01-9	Broad Institute of MIT and Harvard	BRD-K93164329			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23-,25-,27+/m1/s1	QUFPSNAFNYGAMM-UFUIAINPSA-N	589.159133304							102797
CHEMBL2359438	LSM-9409	BRD-K16306049, SID131442889	54646515	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29-,31-,33+/m1/s1	BHEWHBNGLCOXBN-DUWKQBIGSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K16306049	BRD-K16306049-001-01-9	Broad Institute of MIT and Harvard	BRD-K16306049			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29-,31-,33+/m1/s1	BHEWHBNGLCOXBN-DUWKQBIGSA-N	618.183600242							98030
BRD-K08260539	LSM-8928		54646608	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19-,21+,23+/m0/s1	GQLDDSCVBIFPRR-PZMSFCMUSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K08260539	BRD-K08260539-001-01-5	Broad Institute of MIT and Harvard	BRD-K08260539			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19-,21+,23+/m0/s1	GQLDDSCVBIFPRR-PZMSFCMUSA-N	476.161721946							97549
BRD-K41182633	LSM-10934		54646616	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21-,25-,27+/m1/s1	PHEIPYKARIAFSI-HXMVMFLPSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K41182633	BRD-K41182633-001-01-5	Broad Institute of MIT and Harvard	BRD-K41182633			OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21-,25-,27+/m1/s1	PHEIPYKARIAFSI-HXMVMFLPSA-N	517.184900234							99555
BRD-K28739456	LSM-10172		54646706	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15+,17+,19-/m0/s1	YSCGDHRCRJHNHR-KOJWFEOWSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K28739456	BRD-K28739456-001-01-3	Broad Institute of MIT and Harvard	BRD-K28739456			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15+,17+,19-/m0/s1	YSCGDHRCRJHNHR-KOJWFEOWSA-N	410.151157262							98793
BRD-K87618551	LSM-13800		54646548	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21-,23+,26+/m0/s1	LVKYMQHIUYSGLY-UAHYIAQRSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Cc5ccncc5)cc34)[C@@H](CO)O2	BroadT	BRD-K87618551	BRD-K87618551-001-01-1	Broad Institute of MIT and Harvard	BRD-K87618551			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21-,23+,26+/m0/s1	LVKYMQHIUYSGLY-UAHYIAQRSA-N	480.237270164							102449
BRD-K22307331	LSM-9779		54646728	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20-,22-,24+/m0/s1	SADUCKDCBXEUGG-UYLMIGBBSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K22307331	BRD-K22307331-001-01-6	Broad Institute of MIT and Harvard	BRD-K22307331			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20-,22-,24+/m0/s1	SADUCKDCBXEUGG-UYLMIGBBSA-N	458.241686828							98400
BRD-K28648950	LSM-10164		54646525	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20+,24+,26-/m1/s1	WXTNJIBEBHTDAA-SNXCTZGFSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@H](CO)O2	BroadT	BRD-K28648950	BRD-K28648950-001-01-7	Broad Institute of MIT and Harvard	BRD-K28648950			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20+,24+,26-/m1/s1	WXTNJIBEBHTDAA-SNXCTZGFSA-N	509.216200362							98785
BRD-K85242441	LSM-13641		54646529	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20-,24+,26+/m1/s1	WXTNJIBEBHTDAA-ODQDCYGBSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@H](CO)O2	BroadT	BRD-K85242441	BRD-K85242441-001-01-6	Broad Institute of MIT and Harvard	BRD-K85242441			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20-,24+,26+/m1/s1	WXTNJIBEBHTDAA-ODQDCYGBSA-N	509.216200362							102288
BRD-K86824573	LSM-13750		54646661	InChI=1S/C22H27N3O4/c1-25(2)15-3-4-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-7-23-8-6-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,20-,22+/m1/s1	ISIKKEOWKJPDMG-ZLLBNUPZSA-N	CN(C)c1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K86824573	BRD-K86824573-001-01-0	Broad Institute of MIT and Harvard	BRD-K86824573			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccncc4)O[C@@H]3CO)c2c1	InChI=1S/C22H27N3O4/c1-25(2)15-3-4-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-7-23-8-6-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,20-,22+/m1/s1	ISIKKEOWKJPDMG-ZLLBNUPZSA-N	397.200156374							102399
BRD-K96021399	LSM-14319		54646662	InChI=1S/C22H27N3O4/c1-25(2)15-3-4-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-7-23-8-6-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,20-,22+/m0/s1	ISIKKEOWKJPDMG-JXYHXMIBSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K96021399	BRD-K96021399-001-01-3	Broad Institute of MIT and Harvard	BRD-K96021399			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccncc4)O[C@H]3CO)c2c1	InChI=1S/C22H27N3O4/c1-25(2)15-3-4-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-7-23-8-6-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,20-,22+/m0/s1	ISIKKEOWKJPDMG-JXYHXMIBSA-N	397.200156374							102973
BRD-K07558380	LSM-8877		54646469	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23+,25+,27-/m0/s1	ISBRQPNQXSURAN-KCFOJUKOSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K07558380	BRD-K07558380-001-01-3	Broad Institute of MIT and Harvard	BRD-K07558380			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23+,25+,27-/m0/s1	ISBRQPNQXSURAN-KCFOJUKOSA-N	494.241686828							97498
BRD-K09547783	LSM-9010		54646713	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23-,26+/m0/s1	LDGCPXKMKGRZSF-MDJJAXGLSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K09547783	BRD-K09547783-001-01-7	Broad Institute of MIT and Harvard	BRD-K09547783			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23-,26+/m0/s1	LDGCPXKMKGRZSF-MDJJAXGLSA-N	484.176499758							97631
BRD-K94761446	LSM-14237		54646482	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23+,25-,27-/m0/s1	ISBRQPNQXSURAN-LLAXMMLTSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K94761446	BRD-K94761446-001-01-9	Broad Institute of MIT and Harvard	BRD-K94761446			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23+,25-,27-/m0/s1	ISBRQPNQXSURAN-LLAXMMLTSA-N	494.241686828							102891
BRD-K19056919	LSM-9573		54646755	InChI=1S/C19H26N2O6/c1-21(2)9-17(23)20-11-4-5-15-13(6-11)14-7-12(8-18(24)25-3)26-16(10-22)19(14)27-15/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16-,19-/m1/s1	IMIOHDVFACJXOK-MGPHVCOZSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	BroadT	BRD-K19056919	BRD-K19056919-001-01-4	Broad Institute of MIT and Harvard	BRD-K19056919			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	InChI=1S/C19H26N2O6/c1-21(2)9-17(23)20-11-4-5-15-13(6-11)14-7-12(8-18(24)25-3)26-16(10-22)19(14)27-15/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16-,19-/m1/s1	IMIOHDVFACJXOK-MGPHVCOZSA-N	378.179086572							98194
BRD-K20381303	LSM-9673		54646658	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22+,25-,27-/m0/s1	FJJBSMMGLKBUIQ-BUZLNKNLSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)c5cccnc5)cc34)[C@H](CO)O2	BroadT	BRD-K20381303	BRD-K20381303-001-01-7	Broad Institute of MIT and Harvard	BRD-K20381303			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22+,25-,27-/m0/s1	FJJBSMMGLKBUIQ-BUZLNKNLSA-N	503.205635678							98294
BRD-K65974287	LSM-12453		54646624	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16+,18+,20-/m0/s1	KXSIODNMTPRENB-UQWBFEFOSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K65974287	BRD-K65974287-001-01-5	Broad Institute of MIT and Harvard	BRD-K65974287			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@@H](CO)O1	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16+,18+,20-/m0/s1	KXSIODNMTPRENB-UQWBFEFOSA-N	404.194736636							101081
BRD-K63926219	LSM-12328		54646623	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16-,18-,20+/m0/s1	KXSIODNMTPRENB-PFSLXQJOSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K63926219	BRD-K63926219-001-01-0	Broad Institute of MIT and Harvard	BRD-K63926219			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16-,18-,20+/m0/s1	KXSIODNMTPRENB-PFSLXQJOSA-N	404.194736636							100955
BRD-K80621614	LSM-13358		54646736	InChI=1S/C23H26F2N2O4/c1-27(2)15-4-6-20-17(8-15)18-9-16(30-21(12-28)23(18)31-20)10-22(29)26-11-13-7-14(24)3-5-19(13)25/h3-8,16,18,21,23,28H,9-12H2,1-2H3,(H,26,29)/t16-,18-,21+,23+/m0/s1	PXUWSZVSXCWDJI-JOXJFCDYSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cc(F)ccc4F)C[C@H]3c2c1	BroadT	BRD-K80621614	BRD-K80621614-001-01-7	Broad Institute of MIT and Harvard	BRD-K80621614			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cc(F)ccc4F)O[C@@H]3CO)c2c1	InChI=1S/C23H26F2N2O4/c1-27(2)15-4-6-20-17(8-15)18-9-16(30-21(12-28)23(18)31-20)10-22(29)26-11-13-7-14(24)3-5-19(13)25/h3-8,16,18,21,23,28H,9-12H2,1-2H3,(H,26,29)/t16-,18-,21+,23+/m0/s1	PXUWSZVSXCWDJI-JOXJFCDYSA-N	432.186063732							101997
BRD-K00998404	LSM-8498		54646753	InChI=1S/C19H26N2O6/c1-21(2)9-17(23)20-11-4-5-15-13(6-11)14-7-12(8-18(24)25-3)26-16(10-22)19(14)27-15/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16+,19-/m0/s1	IMIOHDVFACJXOK-AXJQOJOCSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	BroadT	BRD-K00998404	BRD-K00998404-001-01-0	Broad Institute of MIT and Harvard	BRD-K00998404			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	InChI=1S/C19H26N2O6/c1-21(2)9-17(23)20-11-4-5-15-13(6-11)14-7-12(8-18(24)25-3)26-16(10-22)19(14)27-15/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16+,19-/m0/s1	IMIOHDVFACJXOK-AXJQOJOCSA-N	378.179086572							97119
BRD-K77933659	LSM-13197		54646494	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19+,21+,24-/m0/s1	KRQAAGOFZVBHDO-FCMRVMJTSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NC4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K77933659	BRD-K77933659-001-01-7	Broad Institute of MIT and Harvard	BRD-K77933659			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NC4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19+,21+,24-/m0/s1	KRQAAGOFZVBHDO-FCMRVMJTSA-N	445.25767125							101835
BRD-K14573341	LSM-9313		54646486	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22-,24+,26+,28-/m0/s1	CGDALBMFLMENHX-FUICHHCXSA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K14573341	BRD-K14573341-001-01-1	Broad Institute of MIT and Harvard	BRD-K14573341			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22-,24+,26+,28-/m0/s1	CGDALBMFLMENHX-FUICHHCXSA-N	507.273321314							97934
BRD-K33263026	LSM-10449		54646571	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22-,24+,27+/m0/s1	NURZYHIHZDJTSB-ZMQLRHKASA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K33263026	BRD-K33263026-001-01-8	Broad Institute of MIT and Harvard	BRD-K33263026			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22-,24+,27+/m0/s1	NURZYHIHZDJTSB-ZMQLRHKASA-N	488.205970036							99070
BRD-K92897514	LSM-14123		54646655	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22+,25+,27-/m0/s1	FJJBSMMGLKBUIQ-JBGAWVPVSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)c5cccnc5)cc34)[C@@H](CO)O2	BroadT	BRD-K92897514	BRD-K92897514-001-01-0	Broad Institute of MIT and Harvard	BRD-K92897514			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22+,25+,27-/m0/s1	FJJBSMMGLKBUIQ-JBGAWVPVSA-N	503.205635678							102777
BRD-K97758158	LSM-14438		54646557	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16-,18+,21+/m1/s1	PPHZKQYZEIZDOF-GXLIZGDTSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K97758158	BRD-K97758158-001-01-0	Broad Institute of MIT and Harvard	BRD-K97758158			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16-,18+,21+/m1/s1	PPHZKQYZEIZDOF-GXLIZGDTSA-N	388.199822016							103093
BRD-K26077185	LSM-10009		54646483	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23-,25+,27+/m1/s1	ISBRQPNQXSURAN-QURKWHOCSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K26077185	BRD-K26077185-001-01-8	Broad Institute of MIT and Harvard	BRD-K26077185			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23-,25+,27+/m1/s1	ISBRQPNQXSURAN-QURKWHOCSA-N	494.241686828							98630
BRD-K61751605	LSM-12170		54646467	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,21+,24+/m1/s1	QLCUJBUUXYDXPU-TXLPUILGSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccccc4F)C[C@@H]3c2c1	BroadT	BRD-K61751605	BRD-K61751605-001-01-6	Broad Institute of MIT and Harvard	BRD-K61751605			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,21+,24+/m1/s1	QLCUJBUUXYDXPU-TXLPUILGSA-N	458.185314804							100796
BRD-K36150982	LSM-10611		54646481	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23+,25-,27-/m1/s1	ISBRQPNQXSURAN-QEJRMIRFSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K36150982	BRD-K36150982-001-01-6	Broad Institute of MIT and Harvard	BRD-K36150982			C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23+,25-,27-/m1/s1	ISBRQPNQXSURAN-QEJRMIRFSA-N	494.241686828							99232
BRD-K16332856	LSM-9412		54646514	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21-,26+,28+/m0/s1	JRAPIMFHFBSUKE-BJSMQDGRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K16332856	BRD-K16332856-001-01-7	Broad Institute of MIT and Harvard	BRD-K16332856			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21-,26+,28+/m0/s1	JRAPIMFHFBSUKE-BJSMQDGRSA-N	552.170807592							98033
CHEMBL2357643	LSM-8726	BRD-K04776289, SID131442821	54646447	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21-,25-,27+/m0/s1	VAJXXPPWCPTEHE-GCMLAXDWSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K04776289	BRD-K04776289-001-01-6	Broad Institute of MIT and Harvard	BRD-K04776289			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21-,25-,27+/m0/s1	VAJXXPPWCPTEHE-GCMLAXDWSA-N	508.220951384							97347
BRD-K43499440	LSM-11076		54646589	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25-,27-,29+/m0/s1	AJAMEWYBAUQISK-JZRJJGTOSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NCCc5ccccc5)C[C@H]4c3c2	BroadT	BRD-K43499440	BRD-K43499440-001-01-4	Broad Institute of MIT and Harvard	BRD-K43499440			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCCc4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25-,27-,29+/m0/s1	AJAMEWYBAUQISK-JZRJJGTOSA-N	552.193022074							99697
BRD-K96721928	LSM-14370		54646604	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19+,21+,23-/m0/s1	GQLDDSCVBIFPRR-DLBBVRJLSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K96721928	BRD-K96721928-001-01-8	Broad Institute of MIT and Harvard	BRD-K96721928			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19+,21+,23-/m0/s1	GQLDDSCVBIFPRR-DLBBVRJLSA-N	476.161721946							103024
BRD-K03028122	LSM-8622		54646526	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20+,24-,26-/m1/s1	WXTNJIBEBHTDAA-DJKZJWHWSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@@H](CO)O2	BroadT	BRD-K03028122	BRD-K03028122-001-01-4	Broad Institute of MIT and Harvard	BRD-K03028122			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20+,24-,26-/m1/s1	WXTNJIBEBHTDAA-DJKZJWHWSA-N	509.216200362							97243
BRD-K17783155	LSM-9498		54646587	InChI=1S/C29H31N3O5/c33-18-26-29-24(16-22(36-26)17-27(34)31-13-10-19-4-2-1-3-5-19)23-15-21(6-7-25(23)37-29)32-28(35)14-20-8-11-30-12-9-20/h1-9,11-12,15,22,24,26,29,33H,10,13-14,16-18H2,(H,31,34)(H,32,35)/t22-,24+,26-,29-/m0/s1	VAXWNMUXFDPDKL-GEHYGMCHSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K17783155	BRD-K17783155-001-01-8	Broad Institute of MIT and Harvard	BRD-K17783155			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C29H31N3O5/c33-18-26-29-24(16-22(36-26)17-27(34)31-13-10-19-4-2-1-3-5-19)23-15-21(6-7-25(23)37-29)32-28(35)14-20-8-11-30-12-9-20/h1-9,11-12,15,22,24,26,29,33H,10,13-14,16-18H2,(H,31,34)(H,32,35)/t22-,24+,26-,29-/m0/s1	VAXWNMUXFDPDKL-GEHYGMCHSA-N	501.226371122							98119
CHEMBL2361912	LSM-9749	BRD-K21707058, SID131442813	54646439	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28-,30-,32+/m0/s1	MARYDHBQWVLAFX-YGJQFJFHSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K21707058	BRD-K21707058-001-01-9	Broad Institute of MIT and Harvard	BRD-K21707058			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28-,30-,32+/m0/s1	MARYDHBQWVLAFX-YGJQFJFHSA-N	572.252251512							98370
BRD-K88119020	LSM-13842		54646639	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23-,25-,27+/m0/s1	SNGIXDWGPLKZOT-AKGJGXJDSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K88119020	BRD-K88119020-001-01-2	Broad Institute of MIT and Harvard	BRD-K88119020			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23-,25-,27+/m0/s1	SNGIXDWGPLKZOT-AKGJGXJDSA-N	487.210721058							102493
BRD-K97112539	LSM-14396		54646479	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23+,25-,27-/m0/s1	ISBRQPNQXSURAN-DWEXDDMVSA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K97112539	BRD-K97112539-001-01-0	Broad Institute of MIT and Harvard	BRD-K97112539			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23+,25-,27-/m0/s1	ISBRQPNQXSURAN-DWEXDDMVSA-N	494.241686828							103050
BRD-K51186655	LSM-11559		54646470	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23+,25+,27-/m1/s1	ISBRQPNQXSURAN-XASBYKNISA-N	C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K51186655	BRD-K51186655-001-01-6	Broad Institute of MIT and Harvard	BRD-K51186655			C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23+,25+,27-/m1/s1	ISBRQPNQXSURAN-XASBYKNISA-N	494.241686828							100182
BRD-K31703908	LSM-10350		54646650	InChI=1S/C29H31N3O5/c1-18(20-5-3-2-4-6-20)31-28(35)16-22-15-24-23-14-21(32-27(34)13-19-9-11-30-12-10-19)7-8-25(23)37-29(24)26(17-33)36-22/h2-12,14,18,22,24,26,29,33H,13,15-17H2,1H3,(H,31,35)(H,32,34)/t18-,22-,24+,26-,29-/m0/s1	XWECZACFMCVSEP-QYSLXRHESA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K31703908	BRD-K31703908-001-01-8	Broad Institute of MIT and Harvard	BRD-K31703908			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C29H31N3O5/c1-18(20-5-3-2-4-6-20)31-28(35)16-22-15-24-23-14-21(32-27(34)13-19-9-11-30-12-10-19)7-8-25(23)37-29(24)26(17-33)36-22/h2-12,14,18,22,24,26,29,33H,13,15-17H2,1H3,(H,31,35)(H,32,34)/t18-,22-,24+,26-,29-/m0/s1	XWECZACFMCVSEP-QYSLXRHESA-N	501.226371122							98971
BRD-K37753453-001-01-6	LSM-30291	BRD-K37753453	54646437	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22-,25+,27+/m1/s1	ZUHKGHKDCFDVCR-RYFPDZNGSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K37753453	BRD-K37753453-001-01-6	Broad Institute of MIT and Harvard	BRD-K37753453			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22-,25+,27+/m1/s1	ZUHKGHKDCFDVCR-RYFPDZNGSA-N	591.179261962							118842
BRD-K38524184	LSM-10762		54646711	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15-,17+,19+/m1/s1	YSCGDHRCRJHNHR-OVLVRJBISA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K38524184	BRD-K38524184-001-01-6	Broad Institute of MIT and Harvard	BRD-K38524184			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15-,17+,19+/m1/s1	YSCGDHRCRJHNHR-OVLVRJBISA-N	410.151157262							99383
BRD-K53934736	LSM-11709		54646474	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23+,25+,27-/m1/s1	ISBRQPNQXSURAN-CBYRCLPRSA-N	C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K53934736	BRD-K53934736-001-01-0	Broad Institute of MIT and Harvard	BRD-K53934736			C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23+,25+,27-/m1/s1	ISBRQPNQXSURAN-CBYRCLPRSA-N	494.241686828							100334
BRD-K93320447	LSM-14151		54646598	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21+,23+,25-/m1/s1	UYFCGOQSYKFWAJ-PEHPGLIYSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NCC5CC5)C[C@H]4c3c2	BroadT	BRD-K93320447	BRD-K93320447-001-01-4	Broad Institute of MIT and Harvard	BRD-K93320447			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21+,23+,25-/m1/s1	UYFCGOQSYKFWAJ-PEHPGLIYSA-N	502.17737201							102805
BRD-K48431707	LSM-11375		54646513	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21+,26-,28-/m0/s1	JRAPIMFHFBSUKE-HCJMUSFBSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K48431707	BRD-K48431707-001-01-0	Broad Institute of MIT and Harvard	BRD-K48431707			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21+,26-,28-/m0/s1	JRAPIMFHFBSUKE-HCJMUSFBSA-N	552.170807592							99996
BRD-K64997042	LSM-12398		54646628	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16-,18+,20+/m1/s1	KXSIODNMTPRENB-BIJSTVTOSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K64997042	BRD-K64997042-001-01-3	Broad Institute of MIT and Harvard	BRD-K64997042			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16-,18+,20+/m1/s1	KXSIODNMTPRENB-BIJSTVTOSA-N	404.194736636							101025
BRD-K51287451	LSM-11566		54646740	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23+,27+,29-/m0/s1	WERZBRNJFLNQTM-HTMHUVIFSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K51287451	BRD-K51287451-001-01-8	Broad Institute of MIT and Harvard	BRD-K51287451			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23+,27+,29-/m0/s1	WERZBRNJFLNQTM-HTMHUVIFSA-N	530.20530132							100189
BRD-K26792953	LSM-10052		54646671	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22-,24+,26+/m1/s1	SGAJFFANPLXWDT-IXVWUCSXSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K26792953	BRD-K26792953-001-01-2	Broad Institute of MIT and Harvard	BRD-K26792953			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22-,24+,26+/m1/s1	SGAJFFANPLXWDT-IXVWUCSXSA-N	518.188685622							98673
BRD-K52656828	LSM-11644		54646492	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19-,21-,24+/m1/s1	KRQAAGOFZVBHDO-ISYUWZRGSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NC4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K52656828	BRD-K52656828-001-01-9	Broad Institute of MIT and Harvard	BRD-K52656828			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NC4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19-,21-,24+/m1/s1	KRQAAGOFZVBHDO-ISYUWZRGSA-N	445.25767125							100269
BRD-K48714854	LSM-11396		54646567	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22+,24+,27-/m0/s1	NURZYHIHZDJTSB-YRGRZTQCSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K48714854	BRD-K48714854-001-01-0	Broad Institute of MIT and Harvard	BRD-K48714854			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22+,24+,27-/m0/s1	NURZYHIHZDJTSB-YRGRZTQCSA-N	488.205970036							100017
BRD-K33017576	LSM-14795		54646453	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23-,25+/m1/s1	OPNBGVGHIKRRPP-YTAKYCMFSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K33017576	BRD-K33017576-001-01-2	Broad Institute of MIT and Harvard	BRD-K33017576			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23-,25+/m1/s1	OPNBGVGHIKRRPP-YTAKYCMFSA-N	468.206050248							103451
BRD-K11133230	LSM-9108		54646663	InChI=1S/C22H27N3O4/c1-25(2)15-3-4-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-7-23-8-6-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18+,20-,22-/m0/s1	ISIKKEOWKJPDMG-UPSSIMKTSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K11133230	BRD-K11133230-001-01-1	Broad Institute of MIT and Harvard	BRD-K11133230			CN(C)c1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccncc4)O[C@H]3CO)c2c1	InChI=1S/C22H27N3O4/c1-25(2)15-3-4-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-7-23-8-6-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18+,20-,22-/m0/s1	ISIKKEOWKJPDMG-UPSSIMKTSA-N	397.200156374							97729
BRD-K74902280	LSM-13021		54646721	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26+,28-/m0/s1	XHFXJTPXFPIUNX-IXMDGTTKSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)NCc5ccc(Cl)cc5)C[C@@H]4c3c2	BroadT	BRD-K74902280	BRD-K74902280-001-01-2	Broad Institute of MIT and Harvard	BRD-K74902280			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26+,28-/m0/s1	XHFXJTPXFPIUNX-IXMDGTTKSA-N	572.138399688							101658
BRD-K84284503	LSM-13580		54646745	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23-,27+,29+/m1/s1	WERZBRNJFLNQTM-YNXFXDROSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K84284503	BRD-K84284503-001-01-4	Broad Institute of MIT and Harvard	BRD-K84284503			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23-,27+,29+/m1/s1	WERZBRNJFLNQTM-YNXFXDROSA-N	530.20530132							102224
BRD-K59534645	LSM-12026		54646723	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26-,28-/m1/s1	XHFXJTPXFPIUNX-BTBRWJRTSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)NCc5ccc(Cl)cc5)C[C@H]4c3c2	BroadT	BRD-K59534645	BRD-K59534645-001-01-2	Broad Institute of MIT and Harvard	BRD-K59534645			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24+,26-,28-/m1/s1	XHFXJTPXFPIUNX-BTBRWJRTSA-N	572.138399688							100652
BRD-K48562666	LSM-11384		54646559	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22-,24-,26+/m0/s1	RXCSFWYPJHKPEM-CLKGCZJISA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)N5CCCCC5)C[C@H]4c3c2	BroadT	BRD-K48562666	BRD-K48562666-001-01-1	Broad Institute of MIT and Harvard	BRD-K48562666			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22-,24-,26+/m0/s1	RXCSFWYPJHKPEM-CLKGCZJISA-N	516.193022074							100005
BRD-K10666842	LSM-9071		54646497	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19+,21-,24-/m0/s1	KRQAAGOFZVBHDO-PMSBSAKUSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NC4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K10666842	BRD-K10666842-001-01-1	Broad Institute of MIT and Harvard	BRD-K10666842			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NC4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19+,21-,24-/m0/s1	KRQAAGOFZVBHDO-PMSBSAKUSA-N	445.25767125							97692
BRD-K59913769	LSM-12050		54646485	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22-,24-,26-,28+/m0/s1	CGDALBMFLMENHX-VUBFOCLHSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K59913769	BRD-K59913769-001-01-8	Broad Institute of MIT and Harvard	BRD-K59913769			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22-,24-,26-,28+/m0/s1	CGDALBMFLMENHX-VUBFOCLHSA-N	507.273321314							100676
BRD-K48047626	LSM-11353		54646751	InChI=1S/C27H34N4O5/c32-17-24-26-22(14-20(35-24)15-25(33)29-9-12-31-10-2-1-3-11-31)21-13-19(6-7-23(21)36-26)30-27(34)18-5-4-8-28-16-18/h4-8,13,16,20,22,24,26,32H,1-3,9-12,14-15,17H2,(H,29,33)(H,30,34)/t20-,22-,24+,26+/m0/s1	SWOCEPZEXMNKQZ-LFSKCEFNSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K48047626	BRD-K48047626-001-01-2	Broad Institute of MIT and Harvard	BRD-K48047626			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H34N4O5/c32-17-24-26-22(14-20(35-24)15-25(33)29-9-12-31-10-2-1-3-11-31)21-13-19(6-7-23(21)36-26)30-27(34)18-5-4-8-28-16-18/h4-8,13,16,20,22,24,26,32H,1-3,9-12,14-15,17H2,(H,29,33)(H,30,34)/t20-,22-,24+,26+/m0/s1	SWOCEPZEXMNKQZ-LFSKCEFNSA-N	494.252920228							99974
BRD-K80831196	LSM-13373		54646730	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20+,22+,24-/m1/s1	SADUCKDCBXEUGG-HJBWUJCXSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K80831196	BRD-K80831196-001-01-8	Broad Institute of MIT and Harvard	BRD-K80831196			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20+,22+,24-/m1/s1	SADUCKDCBXEUGG-HJBWUJCXSA-N	458.241686828							102012
BRD-K13137954	LSM-9217		54646522	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20-,24-,26+/m1/s1	WXTNJIBEBHTDAA-FNVZBELISA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@@H](CO)O2	BroadT	BRD-K13137954	BRD-K13137954-001-01-4	Broad Institute of MIT and Harvard	BRD-K13137954			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20-,24-,26+/m1/s1	WXTNJIBEBHTDAA-FNVZBELISA-N	509.216200362							97838
BRD-K46184370	LSM-11242		54646645	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21-,23-,25+,27+/m0/s1	SNGIXDWGPLKZOT-VRTJCWFZSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K46184370	BRD-K46184370-001-01-3	Broad Institute of MIT and Harvard	BRD-K46184370			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21-,23-,25+,27+/m0/s1	SNGIXDWGPLKZOT-VRTJCWFZSA-N	487.210721058							99863
BRD-K82004089	LSM-13434		54646705	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15-,17-,19+/m0/s1	YSCGDHRCRJHNHR-YMFLFHJQSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K82004089	BRD-K82004089-001-01-0	Broad Institute of MIT and Harvard	BRD-K82004089			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15-,17-,19+/m0/s1	YSCGDHRCRJHNHR-YMFLFHJQSA-N	410.151157262							102074
BRD-K48849176	LSM-11401		54646622	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21-,25+,27+/m1/s1	PHEIPYKARIAFSI-FALQBERWSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K48849176	BRD-K48849176-001-01-5	Broad Institute of MIT and Harvard	BRD-K48849176			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21-,25+,27+/m1/s1	PHEIPYKARIAFSI-FALQBERWSA-N	517.184900234							100022
BRD-K01632787	LSM-8541		54646668	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22+,24-,26-/m1/s1	SGAJFFANPLXWDT-OLTCJGHMSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K01632787	BRD-K01632787-001-01-1	Broad Institute of MIT and Harvard	BRD-K01632787			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22+,24-,26-/m1/s1	SGAJFFANPLXWDT-OLTCJGHMSA-N	518.188685622							97162
BRD-K26622714	LSM-10043		54646472	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23+,25+,27-/m0/s1	ISBRQPNQXSURAN-YFTGCYBESA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K26622714	BRD-K26622714-001-01-1	Broad Institute of MIT and Harvard	BRD-K26622714			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23+,25+,27-/m0/s1	ISBRQPNQXSURAN-YFTGCYBESA-N	494.241686828							98664
BRD-K52045590	LSM-11613		54646441	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28+,30+,32-/m1/s1	MARYDHBQWVLAFX-XXKKVQIQSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K52045590	BRD-K52045590-001-01-1	Broad Institute of MIT and Harvard	BRD-K52045590			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28+,30+,32-/m1/s1	MARYDHBQWVLAFX-XXKKVQIQSA-N	572.252251512							100236
BRD-K58631614	LSM-11968		54646511	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21+,26+,28-/m1/s1	JRAPIMFHFBSUKE-GGUBSOLTSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K58631614	BRD-K58631614-001-01-4	Broad Institute of MIT and Harvard	BRD-K58631614			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21+,26+,28-/m1/s1	JRAPIMFHFBSUKE-GGUBSOLTSA-N	552.170807592							100594
BRD-K39921641	LSM-10865		54646725	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26+,28+/m0/s1	XHFXJTPXFPIUNX-HVZNUZIDSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)NCc5ccc(Cl)cc5)C[C@H]4c3c2	BroadT	BRD-K39921641	BRD-K39921641-001-01-0	Broad Institute of MIT and Harvard	BRD-K39921641			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26+,28+/m0/s1	XHFXJTPXFPIUNX-HVZNUZIDSA-N	572.138399688							99486
BRD-K79927100	LSM-13305		54646490	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22-,24-,26+,28+/m0/s1	CGDALBMFLMENHX-WIAMOBPISA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K79927100	BRD-K79927100-001-01-2	Broad Institute of MIT and Harvard	BRD-K79927100			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22-,24-,26+,28+/m0/s1	CGDALBMFLMENHX-WIAMOBPISA-N	507.273321314							101944
BRD-K01211710	LSM-8505		54646595	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21-,23-,25+/m1/s1	UYFCGOQSYKFWAJ-VTBBIAPYSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NCC5CC5)C[C@@H]4c3c2	BroadT	BRD-K01211710	BRD-K01211710-001-01-6	Broad Institute of MIT and Harvard	BRD-K01211710			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21-,23-,25+/m1/s1	UYFCGOQSYKFWAJ-VTBBIAPYSA-N	502.17737201							97126
BRD-K86198141	LSM-13709		54646532	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,23-/m0/s1	HQZJCXNXJWTAKA-MVIJMRCYSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cccnc4)C[C@@H]3c2c1	BroadT	BRD-K86198141	BRD-K86198141-001-01-2	Broad Institute of MIT and Harvard	BRD-K86198141			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cccnc4)O[C@@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,23-/m0/s1	HQZJCXNXJWTAKA-MVIJMRCYSA-N	441.189985614							102357
BRD-K40414902	LSM-10893		54646541	InChI=1S/C24H28N2O6/c1-26(2)15-4-6-19-17(8-15)18-9-16(31-22(12-27)24(18)32-19)10-23(28)25-11-14-3-5-20-21(7-14)30-13-29-20/h3-8,16,18,22,24,27H,9-13H2,1-2H3,(H,25,28)/t16-,18-,22+,24+/m0/s1	XORJDKZTELKQNH-IGSZLMQBSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc5OCOc5c4)C[C@H]3c2c1	BroadT	BRD-K40414902	BRD-K40414902-001-01-7	Broad Institute of MIT and Harvard	BRD-K40414902			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc5OCOc5c4)O[C@@H]3CO)c2c1	InChI=1S/C24H28N2O6/c1-26(2)15-4-6-19-17(8-15)18-9-16(31-22(12-27)24(18)32-19)10-23(28)25-11-14-3-5-20-21(7-14)30-13-29-20/h3-8,16,18,22,24,27H,9-13H2,1-2H3,(H,25,28)/t16-,18-,22+,24+/m0/s1	XORJDKZTELKQNH-IGSZLMQBSA-N	440.194736636							99514
BRD-K18932682	LSM-9563		54646449	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21+,25-,27-/m1/s1	VAJXXPPWCPTEHE-DBXGMPFESA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K18932682	BRD-K18932682-001-01-2	Broad Institute of MIT and Harvard	BRD-K18932682			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21+,25-,27-/m1/s1	VAJXXPPWCPTEHE-DBXGMPFESA-N	508.220951384							98184
BRD-K82971022	LSM-13495		54646574	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19-,22-,25+/m0/s1	PTZKUMYBXIPSAJ-DOPDFTPFSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4cc(F)ccc4F)C[C@H]3c2c1	BroadT	BRD-K82971022	BRD-K82971022-001-01-0	Broad Institute of MIT and Harvard	BRD-K82971022			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cc(F)ccc4F)O[C@H]3CO)c2c1	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19-,22-,25+/m0/s1	PTZKUMYBXIPSAJ-DOPDFTPFSA-N	489.207527458							102136
BRD-K59941784	LSM-12051		54646717	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23-,26-/m0/s1	LDGCPXKMKGRZSF-OXPRRSNCSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K59941784	BRD-K59941784-001-01-0	Broad Institute of MIT and Harvard	BRD-K59941784			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23-,26-/m0/s1	LDGCPXKMKGRZSF-OXPRRSNCSA-N	484.176499758							100677
BRD-K49076793	LSM-11412		54646749	InChI=1S/C27H34N4O5/c32-17-24-26-22(14-20(35-24)15-25(33)29-9-12-31-10-2-1-3-11-31)21-13-19(6-7-23(21)36-26)30-27(34)18-5-4-8-28-16-18/h4-8,13,16,20,22,24,26,32H,1-3,9-12,14-15,17H2,(H,29,33)(H,30,34)/t20-,22+,24-,26-/m1/s1	SWOCEPZEXMNKQZ-FWSIMYTDSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K49076793	BRD-K49076793-001-01-7	Broad Institute of MIT and Harvard	BRD-K49076793			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H34N4O5/c32-17-24-26-22(14-20(35-24)15-25(33)29-9-12-31-10-2-1-3-11-31)21-13-19(6-7-23(21)36-26)30-27(34)18-5-4-8-28-16-18/h4-8,13,16,20,22,24,26,32H,1-3,9-12,14-15,17H2,(H,29,33)(H,30,34)/t20-,22+,24-,26-/m1/s1	SWOCEPZEXMNKQZ-FWSIMYTDSA-N	494.252920228							100033
BRD-K02548021	LSM-8597		54646733	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20-,22+,24+/m0/s1	SADUCKDCBXEUGG-YCYVKTGYSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K02548021	BRD-K02548021-001-01-4	Broad Institute of MIT and Harvard	BRD-K02548021			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20-,22+,24+/m0/s1	SADUCKDCBXEUGG-YCYVKTGYSA-N	458.241686828							97218
BRD-K86438619	LSM-13722		54646584	InChI=1S/C22H24N2O7/c1-29-14-5-2-12(3-6-14)23-22(28)24-13-4-7-18-16(8-13)17-9-15(10-20(26)27)30-19(11-25)21(17)31-18/h2-8,15,17,19,21,25H,9-11H2,1H3,(H,26,27)(H2,23,24,28)/t15-,17-,19+,21+/m1/s1	WGYNXZDTDZWEBG-DOSUHQCWSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)O)C[C@@H]4c3c2)cc1	BroadT	BRD-K86438619	BRD-K86438619-001-01-5	Broad Institute of MIT and Harvard	BRD-K86438619			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(O)=O)O[C@H]4CO)c3c2)cc1	InChI=1S/C22H24N2O7/c1-29-14-5-2-12(3-6-14)23-22(28)24-13-4-7-18-16(8-13)17-9-15(10-20(26)27)30-19(11-25)21(17)31-18/h2-8,15,17,19,21,25H,9-11H2,1H3,(H,26,27)(H2,23,24,28)/t15-,17-,19+,21+/m1/s1	WGYNXZDTDZWEBG-DOSUHQCWSA-N	428.158351128							102371
BRD-K25237268	LSM-9963		54646610	InChI=1S/C29H29N3O5/c33-17-26-28-24(13-22(36-26)14-27(34)32-11-9-18-4-1-2-5-20(18)16-32)23-12-21(7-8-25(23)37-28)31-29(35)19-6-3-10-30-15-19/h1-8,10,12,15,22,24,26,28,33H,9,11,13-14,16-17H2,(H,31,35)/t22-,24-,26-,28+/m1/s1	AAXDVORIQTTZBB-HXCADUBKSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)c6cccnc6)cc45	BroadT	BRD-K25237268	BRD-K25237268-001-01-9	Broad Institute of MIT and Harvard	BRD-K25237268			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C29H29N3O5/c33-17-26-28-24(13-22(36-26)14-27(34)32-11-9-18-4-1-2-5-20(18)16-32)23-12-21(7-8-25(23)37-28)31-29(35)19-6-3-10-30-15-19/h1-8,10,12,15,22,24,26,28,33H,9,11,13-14,16-17H2,(H,31,35)/t22-,24-,26-,28+/m1/s1	AAXDVORIQTTZBB-HXCADUBKSA-N	499.210721058							98584
BRD-K43526306	LSM-11080		54646457	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23-,25-/m1/s1	OPNBGVGHIKRRPP-RIPRBREISA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K43526306	BRD-K43526306-001-01-7	Broad Institute of MIT and Harvard	BRD-K43526306			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23-,25-/m1/s1	OPNBGVGHIKRRPP-RIPRBREISA-N	468.206050248							99701
BRD-K01911039	LSM-8549		54646463	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,21+,24-/m1/s1	QLCUJBUUXYDXPU-HZKUWNQRSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccccc4F)C[C@H]3c2c1	BroadT	BRD-K01911039	BRD-K01911039-001-01-5	Broad Institute of MIT and Harvard	BRD-K01911039			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,21+,24-/m1/s1	QLCUJBUUXYDXPU-HZKUWNQRSA-N	458.185314804							97170
BRD-K19865807	LSM-9630		54646456	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23+,25-/m1/s1	OPNBGVGHIKRRPP-IQKBUIRBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K19865807	BRD-K19865807-001-01-3	Broad Institute of MIT and Harvard	BRD-K19865807			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23+,25-/m1/s1	OPNBGVGHIKRRPP-IQKBUIRBSA-N	468.206050248							98251
BRD-K60861723	LSM-12114		54646599	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21+,23-,25-/m1/s1	UYFCGOQSYKFWAJ-NGCSHXQWSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)NCC5CC5)C[C@H]4c3c2	BroadT	BRD-K60861723	BRD-K60861723-001-01-1	Broad Institute of MIT and Harvard	BRD-K60861723			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21+,23-,25-/m1/s1	UYFCGOQSYKFWAJ-NGCSHXQWSA-N	502.17737201							100740
BRD-K71742963	LSM-12819		54646646	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21-,23-,25+,27+/m1/s1	SNGIXDWGPLKZOT-QURKWHOCSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K71742963	BRD-K71742963-001-01-9	Broad Institute of MIT and Harvard	BRD-K71742963			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21-,23-,25+,27+/m1/s1	SNGIXDWGPLKZOT-QURKWHOCSA-N	487.210721058							101456
BRD-K09879686	LSM-9035		54646553	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16+,18+,21-/m1/s1	PPHZKQYZEIZDOF-NHAHXKBOSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K09879686	BRD-K09879686-001-01-2	Broad Institute of MIT and Harvard	BRD-K09879686			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16+,18+,21-/m1/s1	PPHZKQYZEIZDOF-NHAHXKBOSA-N	388.199822016							97656
BRD-K09404826	LSM-8996		54646496	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19+,21-,24-/m1/s1	KRQAAGOFZVBHDO-RMIRKMSDSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NC4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K09404826	BRD-K09404826-001-01-0	Broad Institute of MIT and Harvard	BRD-K09404826			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NC4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19+,21-,24-/m1/s1	KRQAAGOFZVBHDO-RMIRKMSDSA-N	445.25767125							97617
BRD-K71254586	LSM-12781		54646700	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21+,25-,27-/m1/s1	MOISLORHFJLABX-DBXGMPFESA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K71254586	BRD-K71254586-001-01-2	Broad Institute of MIT and Harvard	BRD-K71254586			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21+,25-,27-/m1/s1	MOISLORHFJLABX-DBXGMPFESA-N	524.215866004							101418
BRD-K46920162	LSM-11288		54646691	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23+,25+,27-/m1/s1	QUFPSNAFNYGAMM-WFHOOFKDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K46920162	BRD-K46920162-001-01-2	Broad Institute of MIT and Harvard	BRD-K46920162			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23+,25+,27-/m1/s1	QUFPSNAFNYGAMM-WFHOOFKDSA-N	589.159133304							99909
BRD-K91809691	LSM-14071		54646461	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,21-,24+/m0/s1	QLCUJBUUXYDXPU-QFEHNZAHSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccc4F)C[C@H]3c2c1	BroadT	BRD-K91809691	BRD-K91809691-001-01-1	Broad Institute of MIT and Harvard	BRD-K91809691			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,21-,24+/m0/s1	QLCUJBUUXYDXPU-QFEHNZAHSA-N	458.185314804							102725
BRD-K68047011	LSM-12574		54646750	InChI=1S/C27H34N4O5/c32-17-24-26-22(14-20(35-24)15-25(33)29-9-12-31-10-2-1-3-11-31)21-13-19(6-7-23(21)36-26)30-27(34)18-5-4-8-28-16-18/h4-8,13,16,20,22,24,26,32H,1-3,9-12,14-15,17H2,(H,29,33)(H,30,34)/t20-,22+,24-,26-/m0/s1	SWOCEPZEXMNKQZ-YXOQKGKWSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K68047011	BRD-K68047011-001-01-0	Broad Institute of MIT and Harvard	BRD-K68047011			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H34N4O5/c32-17-24-26-22(14-20(35-24)15-25(33)29-9-12-31-10-2-1-3-11-31)21-13-19(6-7-23(21)36-26)30-27(34)18-5-4-8-28-16-18/h4-8,13,16,20,22,24,26,32H,1-3,9-12,14-15,17H2,(H,29,33)(H,30,34)/t20-,22+,24-,26-/m0/s1	SWOCEPZEXMNKQZ-YXOQKGKWSA-N	494.252920228							101205
BRD-K56977200	LSM-11879		54646468	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23-,25-,27+/m1/s1	ISBRQPNQXSURAN-DJILIAROSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K56977200	BRD-K56977200-001-01-3	Broad Institute of MIT and Harvard	BRD-K56977200			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21-,23-,25-,27+/m1/s1	ISBRQPNQXSURAN-DJILIAROSA-N	494.241686828							100505
CHEMBL2359886	LSM-6824	BRD-K19876534, SID131442890	54646516	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29-,31-,33+/m0/s1	BHEWHBNGLCOXBN-MDCLPFIVSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K19876534	BRD-K19876534-001-01-0	Broad Institute of MIT and Harvard	BRD-K19876534			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29-,31-,33+/m0/s1	BHEWHBNGLCOXBN-MDCLPFIVSA-N	618.183600242							95445
BRD-K66566233	LSM-12481		54646729	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20+,22+,24-/m0/s1	SADUCKDCBXEUGG-AYEZKCMBSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K66566233	BRD-K66566233-001-01-3	Broad Institute of MIT and Harvard	BRD-K66566233			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20+,22+,24-/m0/s1	SADUCKDCBXEUGG-AYEZKCMBSA-N	458.241686828							101112
BRD-K71585748	LSM-12810		54646678	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20-,23+,26+/m0/s1	YCZDHCVCWSKGTE-DOYXTRFRSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@@H](CO)O2	BroadT	BRD-K71585748	BRD-K71585748-001-01-4	Broad Institute of MIT and Harvard	BRD-K71585748			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20-,23+,26+/m0/s1	YCZDHCVCWSKGTE-DOYXTRFRSA-N	483.236935806							101447
BRD-K90556238	LSM-14006		54646554	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16+,18-,21-/m1/s1	PPHZKQYZEIZDOF-HRWHDRTOSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K90556238	BRD-K90556238-001-01-9	Broad Institute of MIT and Harvard	BRD-K90556238			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16+,18-,21-/m1/s1	PPHZKQYZEIZDOF-HRWHDRTOSA-N	388.199822016							102659
BRD-K27993001	LSM-10122		54646528	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20-,24+,26+/m0/s1	WXTNJIBEBHTDAA-DCCOOJGFSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@@H](CO)O2	BroadT	BRD-K27993001	BRD-K27993001-001-01-7	Broad Institute of MIT and Harvard	BRD-K27993001			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20-,24+,26+/m0/s1	WXTNJIBEBHTDAA-DCCOOJGFSA-N	509.216200362							98743
BRD-K68731139	LSM-12620		54646698	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21+,25+,27-/m0/s1	MOISLORHFJLABX-UTMJBXDJSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K68731139	BRD-K68731139-001-01-6	Broad Institute of MIT and Harvard	BRD-K68731139			OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21+,25+,27-/m0/s1	MOISLORHFJLABX-UTMJBXDJSA-N	524.215866004							101252
BRD-K09864793	LSM-9033		54646581	InChI=1S/C22H24N2O7/c1-29-14-5-2-12(3-6-14)23-22(28)24-13-4-7-18-16(8-13)17-9-15(10-20(26)27)30-19(11-25)21(17)31-18/h2-8,15,17,19,21,25H,9-11H2,1H3,(H,26,27)(H2,23,24,28)/t15-,17-,19-,21+/m1/s1	WGYNXZDTDZWEBG-WELBPKCISA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)O)C[C@@H]4c3c2)cc1	BroadT	BRD-K09864793	BRD-K09864793-001-01-4	Broad Institute of MIT and Harvard	BRD-K09864793			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(O)=O)O[C@@H]4CO)c3c2)cc1	InChI=1S/C22H24N2O7/c1-29-14-5-2-12(3-6-14)23-22(28)24-13-4-7-18-16(8-13)17-9-15(10-20(26)27)30-19(11-25)21(17)31-18/h2-8,15,17,19,21,25H,9-11H2,1H3,(H,26,27)(H2,23,24,28)/t15-,17-,19-,21+/m1/s1	WGYNXZDTDZWEBG-WELBPKCISA-N	428.158351128							97654
BRD-K33250410-001-01-9	LSM-30292	BRD-K33250410	54646459	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23+,25+/m0/s1	OPNBGVGHIKRRPP-FEGXGRLVSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K33250410	BRD-K33250410-001-01-9	Broad Institute of MIT and Harvard	BRD-K33250410			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C26H29FN2O5/c27-17-6-1-3-15(9-17)13-28-24(31)12-19-11-21-20-10-18(29-26(32)16-4-2-5-16)7-8-22(20)34-25(21)23(14-30)33-19/h1,3,6-10,16,19,21,23,25,30H,2,4-5,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23+,25+/m0/s1	OPNBGVGHIKRRPP-FEGXGRLVSA-N	468.206050248							118843
BRD-K55134387	LSM-11771		54646651	InChI=1S/C29H31N3O5/c1-18(20-5-3-2-4-6-20)31-28(35)16-22-15-24-23-14-21(32-27(34)13-19-9-11-30-12-10-19)7-8-25(23)37-29(24)26(17-33)36-22/h2-12,14,18,22,24,26,29,33H,13,15-17H2,1H3,(H,31,35)(H,32,34)/t18-,22-,24-,26+,29+/m0/s1	XWECZACFMCVSEP-IELIKYLDSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K55134387	BRD-K55134387-001-01-7	Broad Institute of MIT and Harvard	BRD-K55134387			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C29H31N3O5/c1-18(20-5-3-2-4-6-20)31-28(35)16-22-15-24-23-14-21(32-27(34)13-19-9-11-30-12-10-19)7-8-25(23)37-29(24)26(17-33)36-22/h2-12,14,18,22,24,26,29,33H,13,15-17H2,1H3,(H,31,35)(H,32,34)/t18-,22-,24-,26+,29+/m0/s1	XWECZACFMCVSEP-IELIKYLDSA-N	501.226371122							100396
BRD-K73650939	LSM-12941		54646652	InChI=1S/C29H31N3O5/c1-18(20-5-3-2-4-6-20)31-28(35)16-22-15-24-23-14-21(32-27(34)13-19-9-11-30-12-10-19)7-8-25(23)37-29(24)26(17-33)36-22/h2-12,14,18,22,24,26,29,33H,13,15-17H2,1H3,(H,31,35)(H,32,34)/t18-,22+,24+,26-,29-/m0/s1	XWECZACFMCVSEP-NAZHIZFTSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K73650939	BRD-K73650939-001-01-3	Broad Institute of MIT and Harvard	BRD-K73650939			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C29H31N3O5/c1-18(20-5-3-2-4-6-20)31-28(35)16-22-15-24-23-14-21(32-27(34)13-19-9-11-30-12-10-19)7-8-25(23)37-29(24)26(17-33)36-22/h2-12,14,18,22,24,26,29,33H,13,15-17H2,1H3,(H,31,35)(H,32,34)/t18-,22+,24+,26-,29-/m0/s1	XWECZACFMCVSEP-NAZHIZFTSA-N	501.226371122							101578
BRD-K27948561	LSM-10119		54646500	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19-,21-,23+/m1/s1	JDHDHCLBKAEOSQ-LHWDRQQYSA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	BroadT	BRD-K27948561	BRD-K27948561-001-01-3	Broad Institute of MIT and Harvard	BRD-K27948561			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19-,21-,23+/m1/s1	JDHDHCLBKAEOSQ-LHWDRQQYSA-N	523.193020246							98740
BRD-K85770991	LSM-13680		54646735	InChI=1S/C23H26F2N2O4/c1-27(2)15-4-6-20-17(8-15)18-9-16(30-21(12-28)23(18)31-20)10-22(29)26-11-13-7-14(24)3-5-19(13)25/h3-8,16,18,21,23,28H,9-12H2,1-2H3,(H,26,29)/t16-,18-,21-,23+/m0/s1	PXUWSZVSXCWDJI-DJTDUFQSSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4cc(F)ccc4F)C[C@H]3c2c1	BroadT	BRD-K85770991	BRD-K85770991-001-01-0	Broad Institute of MIT and Harvard	BRD-K85770991			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cc(F)ccc4F)O[C@H]3CO)c2c1	InChI=1S/C23H26F2N2O4/c1-27(2)15-4-6-20-17(8-15)18-9-16(30-21(12-28)23(18)31-20)10-22(29)26-11-13-7-14(24)3-5-19(13)25/h3-8,16,18,21,23,28H,9-12H2,1-2H3,(H,26,29)/t16-,18-,21-,23+/m0/s1	PXUWSZVSXCWDJI-DJTDUFQSSA-N	432.186063732							131224
CHEMBL2359302	LSM-14054	BRD-K91589308, SID131443128	54646754	InChI=1S/C19H26N2O6/c1-21(2)9-17(23)20-11-4-5-15-13(6-11)14-7-12(8-18(24)25-3)26-16(10-22)19(14)27-15/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16+,19-/m1/s1	IMIOHDVFACJXOK-BDOZRKEQSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	BroadT	BRD-K91589308	BRD-K91589308-001-01-4	Broad Institute of MIT and Harvard	BRD-K91589308			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	InChI=1S/C19H26N2O6/c1-21(2)9-17(23)20-11-4-5-15-13(6-11)14-7-12(8-18(24)25-3)26-16(10-22)19(14)27-15/h4-6,12,14,16,19,22H,7-10H2,1-3H3,(H,20,23)/t12-,14+,16+,19-/m1/s1	IMIOHDVFACJXOK-BDOZRKEQSA-N	378.179086572							102707
BRD-K12668859	LSM-9180		54646677	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20+,23-,26-/m0/s1	YCZDHCVCWSKGTE-PLDOSFOGSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@H](CO)O2	BroadT	BRD-K12668859	BRD-K12668859-001-01-5	Broad Institute of MIT and Harvard	BRD-K12668859			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20+,23-,26-/m0/s1	YCZDHCVCWSKGTE-PLDOSFOGSA-N	483.236935806							97801
BRD-K49830011	LSM-11455		54646593	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25-,27+,29+/m0/s1	AJAMEWYBAUQISK-RMBZFECLSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)NCCc5ccccc5)C[C@H]4c3c2	BroadT	BRD-K49830011	BRD-K49830011-001-01-3	Broad Institute of MIT and Harvard	BRD-K49830011			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCCc4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25-,27+,29+/m0/s1	AJAMEWYBAUQISK-RMBZFECLSA-N	552.193022074							100076
BRD-K66413861	LSM-12475		54646709	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15+,17-,19-/m0/s1	YSCGDHRCRJHNHR-PZFZOXMESA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K66413861	BRD-K66413861-001-01-7	Broad Institute of MIT and Harvard	BRD-K66413861			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15+,17-,19-/m0/s1	YSCGDHRCRJHNHR-PZFZOXMESA-N	410.151157262							101106
BRD-K80226949	LSM-13331		54646540	InChI=1S/C24H28N2O6/c1-26(2)15-4-6-19-17(8-15)18-9-16(31-22(12-27)24(18)32-19)10-23(28)25-11-14-3-5-20-21(7-14)30-13-29-20/h3-8,16,18,22,24,27H,9-13H2,1-2H3,(H,25,28)/t16-,18+,22-,24-/m0/s1	XORJDKZTELKQNH-YDGOEMPPSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc5OCOc5c4)C[C@@H]3c2c1	BroadT	BRD-K80226949	BRD-K80226949-001-01-1	Broad Institute of MIT and Harvard	BRD-K80226949			CN(C)c1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc5OCOc5c4)O[C@H]3CO)c2c1	InChI=1S/C24H28N2O6/c1-26(2)15-4-6-19-17(8-15)18-9-16(31-22(12-27)24(18)32-19)10-23(28)25-11-14-3-5-20-21(7-14)30-13-29-20/h3-8,16,18,22,24,27H,9-13H2,1-2H3,(H,25,28)/t16-,18+,22-,24-/m0/s1	XORJDKZTELKQNH-YDGOEMPPSA-N	440.194736636							101970
CHEMBL2359319	LSM-10869	SID131442894, BRD-K40045948	54646520	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29-,31+,33+/m0/s1	BHEWHBNGLCOXBN-KLJTZFATSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K40045948	BRD-K40045948-001-01-5	Broad Institute of MIT and Harvard	BRD-K40045948			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29-,31+,33+/m0/s1	BHEWHBNGLCOXBN-KLJTZFATSA-N	618.183600242							99490
BRD-K61437861	LSM-12153		54646478	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23-,25+,27+/m1/s1	ISBRQPNQXSURAN-DPQCAWRDSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K61437861	BRD-K61437861-001-01-1	Broad Institute of MIT and Harvard	BRD-K61437861			C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23-,25+,27+/m1/s1	ISBRQPNQXSURAN-DPQCAWRDSA-N	494.241686828							100779
BRD-K61885905	LSM-12181		54646686	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22-,24+,27+/m0/s1	AJOHYGOUUFRWKL-ZMQLRHKASA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)N4CCc5ccccc5C4)C[C@H]3c2c1	BroadT	BRD-K61885905	BRD-K61885905-001-01-9	Broad Institute of MIT and Harvard	BRD-K61885905			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCc5ccccc5C4)O[C@@H]3CO)c2c1	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22-,24+,27+/m0/s1	AJOHYGOUUFRWKL-ZMQLRHKASA-N	479.242021186							100807
BRD-K85258806	LSM-13643		54646536	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m0/s1	HQZJCXNXJWTAKA-VSCJKUSUSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cccnc4)C[C@H]3c2c1	BroadT	BRD-K85258806	BRD-K85258806-001-01-1	Broad Institute of MIT and Harvard	BRD-K85258806			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cccnc4)O[C@@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,23+/m0/s1	HQZJCXNXJWTAKA-VSCJKUSUSA-N	441.189985614							102290
BRD-K22345692	LSM-9782		54646674	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20+,23+,26-/m0/s1	YCZDHCVCWSKGTE-YESOXSADSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@@H](CO)O2	BroadT	BRD-K22345692	BRD-K22345692-001-01-9	Broad Institute of MIT and Harvard	BRD-K22345692			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20+,23+,26-/m0/s1	YCZDHCVCWSKGTE-YESOXSADSA-N	483.236935806							98403
BRD-K07373355	LSM-8861		54646695	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23-,25+,27+/m1/s1	QUFPSNAFNYGAMM-RESCMLIYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K07373355	BRD-K07373355-001-01-8	Broad Institute of MIT and Harvard	BRD-K07373355			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23-,25+,27+/m1/s1	QUFPSNAFNYGAMM-RESCMLIYSA-N	589.159133304							97482
BRD-K89697623	LSM-13963		54646694	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23-,25+,27+/m0/s1	QUFPSNAFNYGAMM-JZEPBHRJSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K89697623	BRD-K89697623-001-01-7	Broad Institute of MIT and Harvard	BRD-K89697623			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23-,25+,27+/m0/s1	QUFPSNAFNYGAMM-JZEPBHRJSA-N	589.159133304							102616
BRD-K09521750	LSM-9007		54646451	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21-,25+,27+/m0/s1	VAJXXPPWCPTEHE-ZTUCRWOVSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K09521750	BRD-K09521750-001-01-1	Broad Institute of MIT and Harvard	BRD-K09521750			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21-,25+,27+/m0/s1	VAJXXPPWCPTEHE-ZTUCRWOVSA-N	508.220951384							97628
CHEMBL2358826	LSM-6851	BRD-K75627148, SID131442892	54646518	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29+,31+,33-/m1/s1	BHEWHBNGLCOXBN-VNUFNPPTSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K75627148	BRD-K75627148-001-01-6	Broad Institute of MIT and Harvard	BRD-K75627148			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C33H31FN2O7S/c34-22-8-13-27(14-9-22)44(39,40)36-23-10-15-30-28(16-23)29-17-26(42-31(20-37)33(29)43-30)18-32(38)35-19-21-6-11-25(12-7-21)41-24-4-2-1-3-5-24/h1-16,26,29,31,33,36-37H,17-20H2,(H,35,38)/t26-,29+,31+,33-/m1/s1	BHEWHBNGLCOXBN-VNUFNPPTSA-N	618.183600242							95472
BRD-K00865615	LSM-8487		54646592	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25+,27-,29-/m0/s1	AJAMEWYBAUQISK-ZVYONWCNSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NCCc5ccccc5)C[C@@H]4c3c2	BroadT	BRD-K00865615	BRD-K00865615-001-01-6	Broad Institute of MIT and Harvard	BRD-K00865615			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCCc4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25+,27-,29-/m0/s1	AJAMEWYBAUQISK-ZVYONWCNSA-N	552.193022074							97108
BRD-K12309677	LSM-9161		54646488	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22+,24-,26+,28+/m0/s1	CGDALBMFLMENHX-BKVGYGFLSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K12309677	BRD-K12309677-001-01-6	Broad Institute of MIT and Harvard	BRD-K12309677			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22+,24-,26+,28+/m0/s1	CGDALBMFLMENHX-BKVGYGFLSA-N	507.273321314							97782
BRD-K33544525	LSM-10462		54646546	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21+,23-,26-/m1/s1	LVKYMQHIUYSGLY-YDOBTQPPSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Cc5ccncc5)cc34)[C@@H](CO)O2	BroadT	BRD-K33544525	BRD-K33544525-001-01-7	Broad Institute of MIT and Harvard	BRD-K33544525			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21+,23-,26-/m1/s1	LVKYMQHIUYSGLY-YDOBTQPPSA-N	480.237270164							99083
BRD-K97102829	LSM-14394		54646555	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16+,18-,21-/m0/s1	PPHZKQYZEIZDOF-WTFQOOOSSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K97102829	BRD-K97102829-001-01-0	Broad Institute of MIT and Harvard	BRD-K97102829			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16+,18-,21-/m0/s1	PPHZKQYZEIZDOF-WTFQOOOSSA-N	388.199822016							103048
BRD-K94778363	LSM-14240		54646620	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21+,25-,27-/m0/s1	PHEIPYKARIAFSI-OSHLHTJISA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K94778363	BRD-K94778363-001-01-2	Broad Institute of MIT and Harvard	BRD-K94778363			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21+,25-,27-/m0/s1	PHEIPYKARIAFSI-OSHLHTJISA-N	517.184900234							102894
BRD-K66052559	LSM-12458		54646682	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22+,24+,27-/m0/s1	AJOHYGOUUFRWKL-YRGRZTQCSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)N4CCc5ccccc5C4)C[C@@H]3c2c1	BroadT	BRD-K66052559	BRD-K66052559-001-01-0	Broad Institute of MIT and Harvard	BRD-K66052559			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N4CCc5ccccc5C4)O[C@@H]3CO)c2c1	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22+,24+,27-/m0/s1	AJOHYGOUUFRWKL-YRGRZTQCSA-N	479.242021186							101087
BRD-K71386122	LSM-12793		54646739	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23-,27-,29+/m0/s1	WERZBRNJFLNQTM-AVRHNVJQSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K71386122	BRD-K71386122-001-01-3	Broad Institute of MIT and Harvard	BRD-K71386122			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23-,27-,29+/m0/s1	WERZBRNJFLNQTM-AVRHNVJQSA-N	530.20530132							101430
CHEMBL2138030	LSM-12919	BRD-K73310446, SID131442988	54646614	InChI=1S/C29H29N3O5/c33-17-26-28-24(13-22(36-26)14-27(34)32-11-9-18-4-1-2-5-20(18)16-32)23-12-21(7-8-25(23)37-28)31-29(35)19-6-3-10-30-15-19/h1-8,10,12,15,22,24,26,28,33H,9,11,13-14,16-17H2,(H,31,35)/t22-,24+,26-,28-/m0/s1	AAXDVORIQTTZBB-BQGAEBSMSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)c6cccnc6)cc45	BroadT	BRD-K73310446	BRD-K73310446-001-01-0	Broad Institute of MIT and Harvard	BRD-K73310446			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C29H29N3O5/c33-17-26-28-24(13-22(36-26)14-27(34)32-11-9-18-4-1-2-5-20(18)16-32)23-12-21(7-8-25(23)37-28)31-29(35)19-6-3-10-30-15-19/h1-8,10,12,15,22,24,26,28,33H,9,11,13-14,16-17H2,(H,31,35)/t22-,24+,26-,28-/m0/s1	AAXDVORIQTTZBB-BQGAEBSMSA-N	499.210721058							101556
BRD-K68504618	LSM-12607		54646673	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20-,23-,26+/m0/s1	YCZDHCVCWSKGTE-AHNRGXKQSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@H](CO)O2	BroadT	BRD-K68504618	BRD-K68504618-001-01-7	Broad Institute of MIT and Harvard	BRD-K68504618			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20-,23-,26+/m0/s1	YCZDHCVCWSKGTE-AHNRGXKQSA-N	483.236935806							101239
BRD-K51034923	LSM-11543		54646561	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22+,24+,26-/m1/s1	RXCSFWYPJHKPEM-WUHHYYHUSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)N5CCCCC5)C[C@H]4c3c2	BroadT	BRD-K51034923	BRD-K51034923-001-01-4	Broad Institute of MIT and Harvard	BRD-K51034923			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22+,24+,26-/m1/s1	RXCSFWYPJHKPEM-WUHHYYHUSA-N	516.193022074							100166
BRD-K70899691	LSM-12759		54646657	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22+,25-,27-/m1/s1	FJJBSMMGLKBUIQ-IIKILRQQSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)c5cccnc5)cc34)[C@@H](CO)O2	BroadT	BRD-K70899691	BRD-K70899691-001-01-7	Broad Institute of MIT and Harvard	BRD-K70899691			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22+,25-,27-/m1/s1	FJJBSMMGLKBUIQ-IIKILRQQSA-N	503.205635678							101396
BRD-K34383440	LSM-10501		54646633	InChI=1S/C22H22F3N3O5/c23-22(24,25)11-27-19(30)8-14-7-16-15-6-13(28-21(31)12-2-1-5-26-9-12)3-4-17(15)33-20(16)18(10-29)32-14/h1-6,9,14,16,18,20,29H,7-8,10-11H2,(H,27,30)(H,28,31)/t14-,16+,18-,20-/m0/s1	ILIPRRONQGJVHL-HUOQQOJOSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)c4cccnc4)cc23	BroadT	BRD-K34383440	BRD-K34383440-001-01-1	Broad Institute of MIT and Harvard	BRD-K34383440			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C22H22F3N3O5/c23-22(24,25)11-27-19(30)8-14-7-16-15-6-13(28-21(31)12-2-1-5-26-9-12)3-4-17(15)33-20(16)18(10-29)32-14/h1-6,9,14,16,18,20,29H,7-8,10-11H2,(H,27,30)(H,28,31)/t14-,16+,18-,20-/m0/s1	ILIPRRONQGJVHL-HUOQQOJOSA-N	465.151155434							99122
BRD-K30635390	LSM-10272		54646573	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19-,22-,25+/m1/s1	PTZKUMYBXIPSAJ-NUEVYEGOSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4cc(F)ccc4F)C[C@@H]3c2c1	BroadT	BRD-K30635390	BRD-K30635390-001-01-8	Broad Institute of MIT and Harvard	BRD-K30635390			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cc(F)ccc4F)O[C@@H]3CO)c2c1	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19-,22-,25+/m1/s1	PTZKUMYBXIPSAJ-NUEVYEGOSA-N	489.207527458							98893
BRD-K57022684	LSM-11881		54646440	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28+,30+,32-/m0/s1	MARYDHBQWVLAFX-OVIZOQQBSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K57022684	BRD-K57022684-001-01-2	Broad Institute of MIT and Harvard	BRD-K57022684			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28+,30+,32-/m0/s1	MARYDHBQWVLAFX-OVIZOQQBSA-N	572.252251512							100507
BRD-K97636821	LSM-14428		54646731	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20+,22-,24-/m1/s1	SADUCKDCBXEUGG-USHXRURQSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K97636821	BRD-K97636821-001-01-5	Broad Institute of MIT and Harvard	BRD-K97636821			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20+,22-,24-/m1/s1	SADUCKDCBXEUGG-USHXRURQSA-N	458.241686828							103083
BRD-K86323620	LSM-13714		54646670	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22-,24+,26+/m0/s1	SGAJFFANPLXWDT-TUTLFNSSSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K86323620	BRD-K86323620-001-01-6	Broad Institute of MIT and Harvard	BRD-K86323620			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22-,24+,26+/m0/s1	SGAJFFANPLXWDT-TUTLFNSSSA-N	518.188685622							102362
BRD-K29041589	LSM-10189		54646600	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21+,23-,25-/m0/s1	UYFCGOQSYKFWAJ-XDCBZQCGSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NCC5CC5)C[C@@H]4c3c2	BroadT	BRD-K29041589	BRD-K29041589-001-01-3	Broad Institute of MIT and Harvard	BRD-K29041589			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21+,23-,25-/m0/s1	UYFCGOQSYKFWAJ-XDCBZQCGSA-N	502.17737201							98810
BRD-K97630236	LSM-14426		54646502	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19+,21+,23-/m0/s1	JDHDHCLBKAEOSQ-GBPFJNKXSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	BroadT	BRD-K97630236	BRD-K97630236-001-01-7	Broad Institute of MIT and Harvard	BRD-K97630236			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19+,21+,23-/m0/s1	JDHDHCLBKAEOSQ-GBPFJNKXSA-N	523.193020246							103081
BRD-K42482401	LSM-11004		54646550	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16-,18-,21+/m1/s1	PPHZKQYZEIZDOF-OQBJRAFVSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K42482401	BRD-K42482401-001-01-8	Broad Institute of MIT and Harvard	BRD-K42482401			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C21H28N2O5/c1-23(2)20(26)10-14-9-16-15-8-13(22-19(25)7-12-3-4-12)5-6-17(15)28-21(16)18(11-24)27-14/h5-6,8,12,14,16,18,21,24H,3-4,7,9-11H2,1-2H3,(H,22,25)/t14-,16-,18-,21+/m1/s1	PPHZKQYZEIZDOF-OQBJRAFVSA-N	388.199822016							99625
BRD-K58438506	LSM-11952		54646613	InChI=1S/C29H29N3O5/c33-17-26-28-24(13-22(36-26)14-27(34)32-11-9-18-4-1-2-5-20(18)16-32)23-12-21(7-8-25(23)37-28)31-29(35)19-6-3-10-30-15-19/h1-8,10,12,15,22,24,26,28,33H,9,11,13-14,16-17H2,(H,31,35)/t22-,24+,26-,28-/m1/s1	AAXDVORIQTTZBB-UQCMEGJUSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)c6cccnc6)cc45	BroadT	BRD-K58438506	BRD-K58438506-001-01-5	Broad Institute of MIT and Harvard	BRD-K58438506			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C29H29N3O5/c33-17-26-28-24(13-22(36-26)14-27(34)32-11-9-18-4-1-2-5-20(18)16-32)23-12-21(7-8-25(23)37-28)31-29(35)19-6-3-10-30-15-19/h1-8,10,12,15,22,24,26,28,33H,9,11,13-14,16-17H2,(H,31,35)/t22-,24+,26-,28-/m1/s1	AAXDVORIQTTZBB-UQCMEGJUSA-N	499.210721058							100578
BRD-K71485313	LSM-12798		54646491	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22+,24+,26-,28-/m0/s1	CGDALBMFLMENHX-WOADYHPTSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K71485313	BRD-K71485313-001-01-2	Broad Institute of MIT and Harvard	BRD-K71485313			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22+,24+,26-,28-/m0/s1	CGDALBMFLMENHX-WOADYHPTSA-N	507.273321314							101435
BRD-K63091163	LSM-12268		54646588	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25-,27-,29+/m1/s1	AJAMEWYBAUQISK-AMOMVJEUSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NCCc5ccccc5)C[C@@H]4c3c2	BroadT	BRD-K63091163	BRD-K63091163-001-01-9	Broad Institute of MIT and Harvard	BRD-K63091163			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCCc4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25-,27-,29+/m1/s1	AJAMEWYBAUQISK-AMOMVJEUSA-N	552.193022074							100894
BRD-K80301668	LSM-13335		54646696	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21-,25-,27+/m1/s1	MOISLORHFJLABX-HXMVMFLPSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K80301668	BRD-K80301668-001-01-1	Broad Institute of MIT and Harvard	BRD-K80301668			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21-,25-,27+/m1/s1	MOISLORHFJLABX-HXMVMFLPSA-N	524.215866004							101974
BRD-K06127304	LSM-8783		54646684	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22+,24-,27-/m1/s1	AJOHYGOUUFRWKL-YIPBLFEHSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)N4CCc5ccccc5C4)C[C@H]3c2c1	BroadT	BRD-K06127304	BRD-K06127304-001-01-1	Broad Institute of MIT and Harvard	BRD-K06127304			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCc5ccccc5C4)O[C@@H]3CO)c2c1	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22+,24-,27-/m1/s1	AJOHYGOUUFRWKL-YIPBLFEHSA-N	479.242021186							97404
BRD-K91423746	LSM-14046		54646499	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19-,21+,24+/m1/s1	KRQAAGOFZVBHDO-GOSIJUEPSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NC4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K91423746	BRD-K91423746-001-01-6	Broad Institute of MIT and Harvard	BRD-K91423746			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NC4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19-,21+,24+/m1/s1	KRQAAGOFZVBHDO-GOSIJUEPSA-N	445.25767125							102699
BRD-K44781836	LSM-11153		54646444	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28-,30+,32+/m0/s1	MARYDHBQWVLAFX-WLMIUQNOSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K44781836	BRD-K44781836-001-01-6	Broad Institute of MIT and Harvard	BRD-K44781836			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28-,30+,32+/m0/s1	MARYDHBQWVLAFX-WLMIUQNOSA-N	572.252251512							99774
BRD-K54737430	LSM-11750		54646715	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23+,26-/m1/s1	LDGCPXKMKGRZSF-HMMJVGNDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K54737430	BRD-K54737430-001-01-5	Broad Institute of MIT and Harvard	BRD-K54737430			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23+,26-/m1/s1	LDGCPXKMKGRZSF-HMMJVGNDSA-N	484.176499758							100375
BRD-K43626867	LSM-11090		54646509	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21-,26-,28+/m0/s1	JRAPIMFHFBSUKE-LSQWXYBESA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K43626867	BRD-K43626867-001-01-6	Broad Institute of MIT and Harvard	BRD-K43626867			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21-,26-,28+/m0/s1	JRAPIMFHFBSUKE-LSQWXYBESA-N	552.170807592							99711
BRD-K70550435	LSM-12731		54646602	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19-,21-,23+/m1/s1	GQLDDSCVBIFPRR-WACMXJRTSA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K70550435	BRD-K70550435-001-01-7	Broad Institute of MIT and Harvard	BRD-K70550435			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19-,21-,23+/m1/s1	GQLDDSCVBIFPRR-WACMXJRTSA-N	476.161721946							101367
BRD-K84497718	LSM-13595		54646506	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19-,21+,23+/m0/s1	JDHDHCLBKAEOSQ-VARILPKDSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	BroadT	BRD-K84497718	BRD-K84497718-001-01-3	Broad Institute of MIT and Harvard	BRD-K84497718			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19-,21+,23+/m0/s1	JDHDHCLBKAEOSQ-VARILPKDSA-N	523.193020246							102239
BRD-K72988703	LSM-12897		54646495	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19+,21+,24-/m1/s1	KRQAAGOFZVBHDO-OFYLTFBOSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NC4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K72988703	BRD-K72988703-001-01-2	Broad Institute of MIT and Harvard	BRD-K72988703			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NC4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19+,21+,24-/m1/s1	KRQAAGOFZVBHDO-OFYLTFBOSA-N	445.25767125							101534
BRD-K01310096	LSM-8513		54646493	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19-,21-,24+/m0/s1	KRQAAGOFZVBHDO-JBIZMDSKSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NC4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K01310096	BRD-K01310096-001-01-0	Broad Institute of MIT and Harvard	BRD-K01310096			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NC4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C24H35N3O5/c1-27(2)13-23(30)26-16-8-9-20-18(10-16)19-11-17(31-21(14-28)24(19)32-20)12-22(29)25-15-6-4-3-5-7-15/h8-10,15,17,19,21,24,28H,3-7,11-14H2,1-2H3,(H,25,29)(H,26,30)/t17-,19-,21-,24+/m0/s1	KRQAAGOFZVBHDO-JBIZMDSKSA-N	445.25767125							97134
BRD-K59731570	LSM-12038		54646530	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,23+/m1/s1	HQZJCXNXJWTAKA-WVVHNUNQSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4cccnc4)C[C@@H]3c2c1	BroadT	BRD-K59731570	BRD-K59731570-001-01-3	Broad Institute of MIT and Harvard	BRD-K59731570			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cccnc4)O[C@@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,23+/m1/s1	HQZJCXNXJWTAKA-WVVHNUNQSA-N	441.189985614							100664
BRD-K45090628	LSM-11170		54646660	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22-,25+,27+/m1/s1	FJJBSMMGLKBUIQ-RYFPDZNGSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)c5cccnc5)cc34)[C@H](CO)O2	BroadT	BRD-K45090628	BRD-K45090628-001-01-3	Broad Institute of MIT and Harvard	BRD-K45090628			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22-,25+,27+/m1/s1	FJJBSMMGLKBUIQ-RYFPDZNGSA-N	503.205635678							99791
BRD-K89621861	LSM-13955		54646544	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21+,23+,26-/m0/s1	LVKYMQHIUYSGLY-RLCNXLTRSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Cc5ccncc5)cc34)[C@@H](CO)O2	BroadT	BRD-K89621861	BRD-K89621861-001-01-8	Broad Institute of MIT and Harvard	BRD-K89621861			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21+,23+,26-/m0/s1	LVKYMQHIUYSGLY-RLCNXLTRSA-N	480.237270164							102608
BRD-K03815046	LSM-8667		54646701	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21+,25-,27-/m0/s1	MOISLORHFJLABX-OSHLHTJISA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K03815046	BRD-K03815046-001-01-7	Broad Institute of MIT and Harvard	BRD-K03815046			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21+,25-,27-/m0/s1	MOISLORHFJLABX-OSHLHTJISA-N	524.215866004							97288
BRD-K38786629	LSM-10778		54646625	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16+,18+,20-/m1/s1	KXSIODNMTPRENB-VKSDOSABSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K38786629	BRD-K38786629-001-01-4	Broad Institute of MIT and Harvard	BRD-K38786629			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCC4)cc23)[C@H](CO)O1	InChI=1S/C21H28N2O6/c1-27-19(25)10-14-9-16-15-8-13(23-21(26)22-12-4-2-3-5-12)6-7-17(15)29-20(16)18(11-24)28-14/h6-8,12,14,16,18,20,24H,2-5,9-11H2,1H3,(H2,22,23,26)/t14-,16+,18+,20-/m1/s1	KXSIODNMTPRENB-VKSDOSABSA-N	404.194736636							99399
BRD-K47105955	LSM-11306		54646533	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,23-/m1/s1	HQZJCXNXJWTAKA-MRKDIWJRSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cccnc4)C[C@H]3c2c1	BroadT	BRD-K47105955	BRD-K47105955-001-01-0	Broad Institute of MIT and Harvard	BRD-K47105955			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cccnc4)O[C@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,23-/m1/s1	HQZJCXNXJWTAKA-MRKDIWJRSA-N	441.189985614							99927
BRD-K29201528	LSM-10195		54646558	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22-,24-,26+/m1/s1	RXCSFWYPJHKPEM-DBSKKGOSSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)N5CCCCC5)C[C@@H]4c3c2	BroadT	BRD-K29201528	BRD-K29201528-001-01-7	Broad Institute of MIT and Harvard	BRD-K29201528			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22-,24-,26+/m1/s1	RXCSFWYPJHKPEM-DBSKKGOSSA-N	516.193022074							98816
BRD-K86483825	LSM-13724		54646542	InChI=1S/C24H28N2O6/c1-26(2)15-4-6-19-17(8-15)18-9-16(31-22(12-27)24(18)32-19)10-23(28)25-11-14-3-5-20-21(7-14)30-13-29-20/h3-8,16,18,22,24,27H,9-13H2,1-2H3,(H,25,28)/t16-,18-,22+,24+/m1/s1	XORJDKZTELKQNH-SDZNXMPUSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc5OCOc5c4)C[C@@H]3c2c1	BroadT	BRD-K86483825	BRD-K86483825-001-01-1	Broad Institute of MIT and Harvard	BRD-K86483825			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc5OCOc5c4)O[C@H]3CO)c2c1	InChI=1S/C24H28N2O6/c1-26(2)15-4-6-19-17(8-15)18-9-16(31-22(12-27)24(18)32-19)10-23(28)25-11-14-3-5-20-21(7-14)30-13-29-20/h3-8,16,18,22,24,27H,9-13H2,1-2H3,(H,25,28)/t16-,18-,22+,24+/m1/s1	XORJDKZTELKQNH-SDZNXMPUSA-N	440.194736636							102373
BRD-K36970122	LSM-10665		54646504	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19+,21-,23-/m1/s1	JDHDHCLBKAEOSQ-GUBFDYSESA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	BroadT	BRD-K36970122	BRD-K36970122-001-01-8	Broad Institute of MIT and Harvard	BRD-K36970122			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19+,21-,23-/m1/s1	JDHDHCLBKAEOSQ-GUBFDYSESA-N	523.193020246							99286
BRD-K83544582	LSM-13536		54646547	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21+,23-,26-/m0/s1	LVKYMQHIUYSGLY-OXPRRSNCSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Cc5ccncc5)cc34)[C@H](CO)O2	BroadT	BRD-K83544582	BRD-K83544582-001-01-6	Broad Institute of MIT and Harvard	BRD-K83544582			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	InChI=1S/C26H32N4O5/c1-29-8-10-30(11-9-29)25(33)15-19-14-21-20-13-18(28-24(32)12-17-4-6-27-7-5-17)2-3-22(20)35-26(21)23(16-31)34-19/h2-7,13,19,21,23,26,31H,8-12,14-16H2,1H3,(H,28,32)/t19-,21+,23-,26-/m0/s1	LVKYMQHIUYSGLY-OXPRRSNCSA-N	480.237270164							102178
BRD-K09059649	LSM-8977		54646656	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22+,25+,27-/m1/s1	FJJBSMMGLKBUIQ-ISSPKVJFSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)c5cccnc5)cc34)[C@H](CO)O2	BroadT	BRD-K09059649	BRD-K09059649-001-01-7	Broad Institute of MIT and Harvard	BRD-K09059649			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C28H29N3O6/c1-35-23-7-3-2-5-17(23)15-30-26(33)13-20-12-22-21-11-19(31-28(34)18-6-4-10-29-14-18)8-9-24(21)37-27(22)25(16-32)36-20/h2-11,14,20,22,25,27,32H,12-13,15-16H2,1H3,(H,30,33)(H,31,34)/t20-,22+,25+,27-/m1/s1	FJJBSMMGLKBUIQ-ISSPKVJFSA-N	503.205635678							97598
BRD-K92205342	LSM-14090		54646703	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21-,25+,27+/m1/s1	MOISLORHFJLABX-FALQBERWSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K92205342	BRD-K92205342-001-01-4	Broad Institute of MIT and Harvard	BRD-K92205342			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C28H32N2O8/c31-14-25-27-21(20-10-18(2-4-22(20)38-27)30-28(33)17-5-7-34-8-6-17)11-19(37-25)12-26(32)29-13-16-1-3-23-24(9-16)36-15-35-23/h1-4,9-10,17,19,21,25,27,31H,5-8,11-15H2,(H,29,32)(H,30,33)/t19-,21-,25+,27+/m1/s1	MOISLORHFJLABX-FALQBERWSA-N	524.215866004							102744
BRD-K57207769	LSM-11894		54646487	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22+,24-,26-,28+/m0/s1	CGDALBMFLMENHX-UKPIWMLRSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K57207769	BRD-K57207769-001-01-7	Broad Institute of MIT and Harvard	BRD-K57207769			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C29H37N3O5/c1-18(19-8-4-2-5-9-19)30-27(34)16-22-15-24-23-14-21(32-29(35)31-20-10-6-3-7-11-20)12-13-25(23)37-28(24)26(17-33)36-22/h2,4-5,8-9,12-14,18,20,22,24,26,28,33H,3,6-7,10-11,15-17H2,1H3,(H,30,34)(H2,31,32,35)/t18-,22+,24-,26-,28+/m0/s1	CGDALBMFLMENHX-UKPIWMLRSA-N	507.273321314							100520
BRD-K02089646	LSM-8561		54646578	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19+,22-,25-/m0/s1	PTZKUMYBXIPSAJ-MZIKWEIESA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4cc(F)ccc4F)C[C@@H]3c2c1	BroadT	BRD-K02089646	BRD-K02089646-001-01-4	Broad Institute of MIT and Harvard	BRD-K02089646			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cc(F)ccc4F)O[C@H]3CO)c2c1	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19+,22-,25-/m0/s1	PTZKUMYBXIPSAJ-MZIKWEIESA-N	489.207527458							97182
BRD-K51392039	LSM-11575		54646534	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,23-/m1/s1	HQZJCXNXJWTAKA-RWSUSOHTSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4cccnc4)C[C@H]3c2c1	BroadT	BRD-K51392039	BRD-K51392039-001-01-7	Broad Institute of MIT and Harvard	BRD-K51392039			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cccnc4)O[C@@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,23-/m1/s1	HQZJCXNXJWTAKA-RWSUSOHTSA-N	441.189985614							100198
CHEMBL2134019	LSM-13877	BRD-K88641895, SID131443003	54646629	InChI=1S/C22H22F3N3O5/c23-22(24,25)11-27-19(30)8-14-7-16-15-6-13(28-21(31)12-2-1-5-26-9-12)3-4-17(15)33-20(16)18(10-29)32-14/h1-6,9,14,16,18,20,29H,7-8,10-11H2,(H,27,30)(H,28,31)/t14-,16-,18-,20+/m1/s1	ILIPRRONQGJVHL-ODZKNYGOSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)c4cccnc4)cc23	BroadT	BRD-K88641895	BRD-K88641895-001-01-7	Broad Institute of MIT and Harvard	BRD-K88641895			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C22H22F3N3O5/c23-22(24,25)11-27-19(30)8-14-7-16-15-6-13(28-21(31)12-2-1-5-26-9-12)3-4-17(15)33-20(16)18(10-29)32-14/h1-6,9,14,16,18,20,29H,7-8,10-11H2,(H,27,30)(H,28,31)/t14-,16-,18-,20+/m1/s1	ILIPRRONQGJVHL-ODZKNYGOSA-N	465.151155434							102530
BRD-K38545029	LSM-10765		54646741	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23+,27+,29-/m1/s1	WERZBRNJFLNQTM-ZDOYKXOFSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K38545029	BRD-K38545029-001-01-0	Broad Institute of MIT and Harvard	BRD-K38545029			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23+,27+,29-/m1/s1	WERZBRNJFLNQTM-ZDOYKXOFSA-N	530.20530132							99386
BRD-K56240103	LSM-11830		54646531	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,23+/m0/s1	HQZJCXNXJWTAKA-LUFCQUEKSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4cccnc4)C[C@H]3c2c1	BroadT	BRD-K56240103	BRD-K56240103-001-01-4	Broad Institute of MIT and Harvard	BRD-K56240103			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cccnc4)O[C@H]3CO)c2c1	InChI=1S/C23H27N3O6/c1-30-13-22(29)26-15-4-5-19-17(7-15)18-8-16(31-20(12-27)23(18)32-19)9-21(28)25-11-14-3-2-6-24-10-14/h2-7,10,16,18,20,23,27H,8-9,11-13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,23+/m0/s1	HQZJCXNXJWTAKA-LUFCQUEKSA-N	441.189985614							100455
BRD-K51360326	LSM-11570		54646452	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21-,25+,27+/m1/s1	VAJXXPPWCPTEHE-FALQBERWSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K51360326	BRD-K51360326-001-01-6	Broad Institute of MIT and Harvard	BRD-K51360326			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21-,25+,27+/m1/s1	VAJXXPPWCPTEHE-FALQBERWSA-N	508.220951384							100193
BRD-K89376450	LSM-13931		54646596	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21-,23-,25+/m0/s1	UYFCGOQSYKFWAJ-KRAAZVCLSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NCC5CC5)C[C@H]4c3c2	BroadT	BRD-K89376450	BRD-K89376450-001-01-6	Broad Institute of MIT and Harvard	BRD-K89376450			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21-,23-,25+/m0/s1	UYFCGOQSYKFWAJ-KRAAZVCLSA-N	502.17737201							102584
BRD-K16782770	LSM-9445		54646744	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23-,27+,29+/m0/s1	WERZBRNJFLNQTM-KMQHBQLASA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K16782770	BRD-K16782770-001-01-6	Broad Institute of MIT and Harvard	BRD-K16782770			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C30H30N2O7/c33-16-27-29-23(14-21(38-27)15-28(34)31-11-10-18-4-2-1-3-5-18)22-13-20(7-9-24(22)39-29)32-30(35)19-6-8-25-26(12-19)37-17-36-25/h1-9,12-13,21,23,27,29,33H,10-11,14-17H2,(H,31,34)(H,32,35)/t21-,23-,27+,29+/m0/s1	WERZBRNJFLNQTM-KMQHBQLASA-N	530.20530132							98066
BRD-K25734452	LSM-9989		54646560	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22+,24+,26-/m0/s1	RXCSFWYPJHKPEM-JFXHBBLLSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)N5CCCCC5)C[C@@H]4c3c2	BroadT	BRD-K25734452	BRD-K25734452-001-01-1	Broad Institute of MIT and Harvard	BRD-K25734452			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22+,24+,26-/m0/s1	RXCSFWYPJHKPEM-JFXHBBLLSA-N	516.193022074							98610
BRD-K36418235	LSM-10626		54646611	InChI=1S/C29H29N3O5/c33-17-26-28-24(13-22(36-26)14-27(34)32-11-9-18-4-1-2-5-20(18)16-32)23-12-21(7-8-25(23)37-28)31-29(35)19-6-3-10-30-15-19/h1-8,10,12,15,22,24,26,28,33H,9,11,13-14,16-17H2,(H,31,35)/t22-,24-,26-,28+/m0/s1	AAXDVORIQTTZBB-AJWNWGNMSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)c6cccnc6)cc45	BroadT	BRD-K36418235	BRD-K36418235-001-01-2	Broad Institute of MIT and Harvard	BRD-K36418235			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C29H29N3O5/c33-17-26-28-24(13-22(36-26)14-27(34)32-11-9-18-4-1-2-5-20(18)16-32)23-12-21(7-8-25(23)37-28)31-29(35)19-6-3-10-30-15-19/h1-8,10,12,15,22,24,26,28,33H,9,11,13-14,16-17H2,(H,31,35)/t22-,24-,26-,28+/m0/s1	AAXDVORIQTTZBB-AJWNWGNMSA-N	499.210721058							99247
BRD-K53046450	LSM-11665		54646719	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23+,26+/m1/s1	LDGCPXKMKGRZSF-BCHMZHATSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K53046450	BRD-K53046450-001-01-7	Broad Institute of MIT and Harvard	BRD-K53046450			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21-,23+,26+/m1/s1	LDGCPXKMKGRZSF-BCHMZHATSA-N	484.176499758							100290
BRD-K02445831	LSM-8585		54646586	InChI=1S/C29H31N3O5/c33-18-26-29-24(16-22(36-26)17-27(34)31-13-10-19-4-2-1-3-5-19)23-15-21(6-7-25(23)37-29)32-28(35)14-20-8-11-30-12-9-20/h1-9,11-12,15,22,24,26,29,33H,10,13-14,16-18H2,(H,31,34)(H,32,35)/t22-,24+,26-,29-/m1/s1	VAXWNMUXFDPDKL-PDTKEWMGSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K02445831	BRD-K02445831-001-01-3	Broad Institute of MIT and Harvard	BRD-K02445831			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C29H31N3O5/c33-18-26-29-24(16-22(36-26)17-27(34)31-13-10-19-4-2-1-3-5-19)23-15-21(6-7-25(23)37-29)32-28(35)14-20-8-11-30-12-9-20/h1-9,11-12,15,22,24,26,29,33H,10,13-14,16-18H2,(H,31,34)(H,32,35)/t22-,24+,26-,29-/m1/s1	VAXWNMUXFDPDKL-PDTKEWMGSA-N	501.226371122							97206
BRD-K92079660	LSM-14086		54646473	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23-,25-,27+/m1/s1	ISBRQPNQXSURAN-ACIXWCJESA-N	C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K92079660	BRD-K92079660-001-01-7	Broad Institute of MIT and Harvard	BRD-K92079660			C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H34N2O6/c1-17(18-5-3-2-4-6-18)29-26(32)15-21-14-23-22-13-20(30-28(33)19-9-11-34-12-10-19)7-8-24(22)36-27(23)25(16-31)35-21/h2-8,13,17,19,21,23,25,27,31H,9-12,14-16H2,1H3,(H,29,32)(H,30,33)/t17-,21+,23-,25-,27+/m1/s1	ISBRQPNQXSURAN-ACIXWCJESA-N	494.241686828							102740
BRD-K21629388	LSM-9743		54646692	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23+,25-,27-/m1/s1	QUFPSNAFNYGAMM-WWUYVNTOSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K21629388	BRD-K21629388-001-01-6	Broad Institute of MIT and Harvard	BRD-K21629388			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23+,25-,27-/m1/s1	QUFPSNAFNYGAMM-WWUYVNTOSA-N	589.159133304							98364
BRD-K95899688	LSM-14310		54646707	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15+,17+,19-/m1/s1	YSCGDHRCRJHNHR-FDZBUTDGSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K95899688	BRD-K95899688-001-01-3	Broad Institute of MIT and Harvard	BRD-K95899688			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C19H26N2O6S/c1-28(24,25)21-12-4-5-16-14(6-12)15-7-13(26-17(10-22)19(15)27-16)8-18(23)20-9-11-2-3-11/h4-6,11,13,15,17,19,21-22H,2-3,7-10H2,1H3,(H,20,23)/t13-,15+,17+,19-/m1/s1	YSCGDHRCRJHNHR-FDZBUTDGSA-N	410.151157262							102964
BRD-K45601310	LSM-11213		54646580	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19-,22+,25+/m1/s1	PTZKUMYBXIPSAJ-UALZOGQESA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cc(F)ccc4F)C[C@@H]3c2c1	BroadT	BRD-K45601310	BRD-K45601310-001-01-0	Broad Institute of MIT and Harvard	BRD-K45601310			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cc(F)ccc4F)O[C@H]3CO)c2c1	InChI=1S/C25H29F2N3O5/c1-30(2)12-24(33)29-16-4-6-21-18(8-16)19-9-17(34-22(13-31)25(19)35-21)10-23(32)28-11-14-7-15(26)3-5-20(14)27/h3-8,17,19,22,25,31H,9-13H2,1-2H3,(H,28,32)(H,29,33)/t17-,19-,22+,25+/m1/s1	PTZKUMYBXIPSAJ-UALZOGQESA-N	489.207527458							99834
BRD-K59755197	LSM-12040		54646601	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21-,23+,25+/m0/s1	UYFCGOQSYKFWAJ-FJSLEZNWSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)NCC5CC5)C[C@H]4c3c2	BroadT	BRD-K59755197	BRD-K59755197-001-01-5	Broad Institute of MIT and Harvard	BRD-K59755197			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O7S/c1-32-17-5-7-19(8-6-17)35(30,31)27-16-4-9-22-20(10-16)21-11-18(33-23(14-28)25(21)34-22)12-24(29)26-13-15-2-3-15/h4-10,15,18,21,23,25,27-28H,2-3,11-14H2,1H3,(H,26,29)/t18-,21-,23+,25+/m0/s1	UYFCGOQSYKFWAJ-FJSLEZNWSA-N	502.17737201							100666
BRD-K06852269	LSM-8835		54646538	InChI=1S/C24H28N2O6/c1-26(2)15-4-6-19-17(8-15)18-9-16(31-22(12-27)24(18)32-19)10-23(28)25-11-14-3-5-20-21(7-14)30-13-29-20/h3-8,16,18,22,24,27H,9-13H2,1-2H3,(H,25,28)/t16-,18-,22-,24+/m1/s1	XORJDKZTELKQNH-MJHBTERZSA-N	CN(C)c1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc5OCOc5c4)C[C@@H]3c2c1	BroadT	BRD-K06852269	BRD-K06852269-001-01-7	Broad Institute of MIT and Harvard	BRD-K06852269			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc5OCOc5c4)O[C@@H]3CO)c2c1	InChI=1S/C24H28N2O6/c1-26(2)15-4-6-19-17(8-15)18-9-16(31-22(12-27)24(18)32-19)10-23(28)25-11-14-3-5-20-21(7-14)30-13-29-20/h3-8,16,18,22,24,27H,9-13H2,1-2H3,(H,25,28)/t16-,18-,22-,24+/m1/s1	XORJDKZTELKQNH-MJHBTERZSA-N	440.194736636							97456
BRD-K21163701	LSM-9716		54646510	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21+,26+,28-/m0/s1	JRAPIMFHFBSUKE-BNGZEQNASA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K21163701	BRD-K21163701-001-01-6	Broad Institute of MIT and Harvard	BRD-K21163701			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21+,26+,28-/m0/s1	JRAPIMFHFBSUKE-BNGZEQNASA-N	552.170807592							98337
BRD-K97424742	LSM-14415		54646737	InChI=1S/C23H26F2N2O4/c1-27(2)15-4-6-20-17(8-15)18-9-16(30-21(12-28)23(18)31-20)10-22(29)26-11-13-7-14(24)3-5-19(13)25/h3-8,16,18,21,23,28H,9-12H2,1-2H3,(H,26,29)/t16-,18-,21+,23+/m1/s1	PXUWSZVSXCWDJI-XKAWVMRWSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cc(F)ccc4F)C[C@@H]3c2c1	BroadT	BRD-K97424742	BRD-K97424742-001-01-2	Broad Institute of MIT and Harvard	BRD-K97424742			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cc(F)ccc4F)O[C@H]3CO)c2c1	InChI=1S/C23H26F2N2O4/c1-27(2)15-4-6-20-17(8-15)18-9-16(30-21(12-28)23(18)31-20)10-22(29)26-11-13-7-14(24)3-5-19(13)25/h3-8,16,18,21,23,28H,9-12H2,1-2H3,(H,26,29)/t16-,18-,21+,23+/m1/s1	PXUWSZVSXCWDJI-XKAWVMRWSA-N	432.186063732							103070
BRD-K06624861	LSM-8816		54646565	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22-,24+,26+/m1/s1	RXCSFWYPJHKPEM-IXVWUCSXSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)N5CCCCC5)C[C@@H]4c3c2	BroadT	BRD-K06624861	BRD-K06624861-001-01-2	Broad Institute of MIT and Harvard	BRD-K06624861			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22-,24+,26+/m1/s1	RXCSFWYPJHKPEM-IXVWUCSXSA-N	516.193022074							97437
BRD-K17299182	LSM-9470		54646527	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20+,24-,26-/m0/s1	WXTNJIBEBHTDAA-DZVUWMEYSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@H](CO)O2	BroadT	BRD-K17299182	BRD-K17299182-001-01-2	Broad Institute of MIT and Harvard	BRD-K17299182			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20+,24-,26-/m0/s1	WXTNJIBEBHTDAA-DZVUWMEYSA-N	509.216200362							98091
BRD-K63428678	LSM-12290		54646746	InChI=1S/C27H34N4O5/c32-17-24-26-22(14-20(35-24)15-25(33)29-9-12-31-10-2-1-3-11-31)21-13-19(6-7-23(21)36-26)30-27(34)18-5-4-8-28-16-18/h4-8,13,16,20,22,24,26,32H,1-3,9-12,14-15,17H2,(H,29,33)(H,30,34)/t20-,22-,24-,26+/m1/s1	SWOCEPZEXMNKQZ-DFICYWPVSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K63428678	BRD-K63428678-001-01-1	Broad Institute of MIT and Harvard	BRD-K63428678			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H34N4O5/c32-17-24-26-22(14-20(35-24)15-25(33)29-9-12-31-10-2-1-3-11-31)21-13-19(6-7-23(21)36-26)30-27(34)18-5-4-8-28-16-18/h4-8,13,16,20,22,24,26,32H,1-3,9-12,14-15,17H2,(H,29,33)(H,30,34)/t20-,22-,24-,26+/m1/s1	SWOCEPZEXMNKQZ-DFICYWPVSA-N	494.252920228							100916
BRD-K68120955	LSM-12580		54646640	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21-,23+,25-,27-/m1/s1	SNGIXDWGPLKZOT-NZAHZBTPSA-N	C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K68120955	BRD-K68120955-001-01-3	Broad Institute of MIT and Harvard	BRD-K68120955			C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21-,23+,25-,27-/m1/s1	SNGIXDWGPLKZOT-NZAHZBTPSA-N	487.210721058							101211
BRD-K20065144	LSM-9648		54646585	InChI=1S/C29H31N3O5/c33-18-26-29-24(16-22(36-26)17-27(34)31-13-10-19-4-2-1-3-5-19)23-15-21(6-7-25(23)37-29)32-28(35)14-20-8-11-30-12-9-20/h1-9,11-12,15,22,24,26,29,33H,10,13-14,16-18H2,(H,31,34)(H,32,35)/t22-,24+,26+,29-/m1/s1	VAXWNMUXFDPDKL-XTIYFVLHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K20065144	BRD-K20065144-001-01-9	Broad Institute of MIT and Harvard	BRD-K20065144			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C29H31N3O5/c33-18-26-29-24(16-22(36-26)17-27(34)31-13-10-19-4-2-1-3-5-19)23-15-21(6-7-25(23)37-29)32-28(35)14-20-8-11-30-12-9-20/h1-9,11-12,15,22,24,26,29,33H,10,13-14,16-18H2,(H,31,34)(H,32,35)/t22-,24+,26+,29-/m1/s1	VAXWNMUXFDPDKL-XTIYFVLHSA-N	501.226371122							98269
BRD-K76882503	LSM-13133		54646607	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19+,21-,23-/m0/s1	GQLDDSCVBIFPRR-RZNKLVQRSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	BroadT	BRD-K76882503	BRD-K76882503-001-01-5	Broad Institute of MIT and Harvard	BRD-K76882503			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-10-9-24-22(27)13-16-12-19-18-11-15(25-33(28,29)17-5-3-2-4-6-17)7-8-20(18)32-23(19)21(14-26)31-16/h2-8,11,16,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t16-,19+,21-,23-/m0/s1	GQLDDSCVBIFPRR-RZNKLVQRSA-N	476.161721946							101771
BRD-K27839561	LSM-10110		54646681	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22-,24-,27+/m0/s1	AJOHYGOUUFRWKL-MWLAQPAQSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)N4CCc5ccccc5C4)C[C@H]3c2c1	BroadT	BRD-K27839561	BRD-K27839561-001-01-4	Broad Institute of MIT and Harvard	BRD-K27839561			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22-,24-,27+/m0/s1	AJOHYGOUUFRWKL-MWLAQPAQSA-N	479.242021186							98731
CHEMBL2354393	LSM-11702	BRD-K53873629, SID131443100	54646726	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26+,28+/m1/s1	XHFXJTPXFPIUNX-DZXBDMBVSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)NCc5ccc(Cl)cc5)C[C@@H]4c3c2	BroadT	BRD-K53873629	BRD-K53873629-001-01-0	Broad Institute of MIT and Harvard	BRD-K53873629			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26+,28+/m1/s1	XHFXJTPXFPIUNX-DZXBDMBVSA-N	572.138399688							100327
BRD-K61416896	LSM-12150		54646590	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25+,27+,29-/m0/s1	AJAMEWYBAUQISK-VWGZZBOQSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)NCCc5ccccc5)C[C@@H]4c3c2	BroadT	BRD-K61416896	BRD-K61416896-001-01-4	Broad Institute of MIT and Harvard	BRD-K61416896			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCCc4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C29H32N2O7S/c1-36-21-8-5-9-23(15-21)39(34,35)31-20-10-11-26-24(14-20)25-16-22(37-27(18-32)29(25)38-26)17-28(33)30-13-12-19-6-3-2-4-7-19/h2-11,14-15,22,25,27,29,31-32H,12-13,16-18H2,1H3,(H,30,33)/t22-,25+,27+,29-/m0/s1	AJAMEWYBAUQISK-VWGZZBOQSA-N	552.193022074							100776
BRD-K09444102	LSM-9001		54646618	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21+,25+,27-/m1/s1	PHEIPYKARIAFSI-ZPNKKQCCSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K09444102	BRD-K09444102-001-01-1	Broad Institute of MIT and Harvard	BRD-K09444102			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(10-19(37-25)11-26(33)30-13-16-2-1-7-29-12-16)20-9-18(4-6-22(20)38-27)31-28(34)17-3-5-23-24(8-17)36-15-35-23/h1-9,12,19,21,25,27,32H,10-11,13-15H2,(H,30,33)(H,31,34)/t19-,21+,25+,27-/m1/s1	PHEIPYKARIAFSI-ZPNKKQCCSA-N	517.184900234							97622
BRD-K04267190	LSM-8691		54646512	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21+,26-,28-/m1/s1	JRAPIMFHFBSUKE-ZAESVHBDSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K04267190	BRD-K04267190-001-01-4	Broad Institute of MIT and Harvard	BRD-K04267190			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21+,26-,28-/m1/s1	JRAPIMFHFBSUKE-ZAESVHBDSA-N	552.170807592							97312
BRD-K24050338	LSM-9879		54646569	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22+,24-,27-/m1/s1	NURZYHIHZDJTSB-YIPBLFEHSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K24050338	BRD-K24050338-001-01-3	Broad Institute of MIT and Harvard	BRD-K24050338			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22+,24-,27-/m1/s1	NURZYHIHZDJTSB-YIPBLFEHSA-N	488.205970036							98500
BRD-K19808762	LSM-9625		54646446	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21-,25-,27+/m1/s1	VAJXXPPWCPTEHE-HXMVMFLPSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K19808762	BRD-K19808762-001-01-6	Broad Institute of MIT and Harvard	BRD-K19808762			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H32N2O7/c31-14-25-27-21(12-19(36-25)13-26(32)29-17-4-2-1-3-5-17)20-11-18(7-9-22(20)37-27)30-28(33)16-6-8-23-24(10-16)35-15-34-23/h6-11,17,19,21,25,27,31H,1-5,12-15H2,(H,29,32)(H,30,33)/t19-,21-,25-,27+/m1/s1	VAJXXPPWCPTEHE-HXMVMFLPSA-N	508.220951384							98246
BRD-K25970159	LSM-10002		54646716	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23-,26-/m1/s1	LDGCPXKMKGRZSF-YDOBTQPPSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K25970159	BRD-K25970159-001-01-7	Broad Institute of MIT and Harvard	BRD-K25970159			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C26H29ClN2O5/c27-17-5-3-16(4-6-17)13-28-24(31)12-19-11-21-20-10-18(29-25(32)9-15-1-2-15)7-8-22(20)34-26(21)23(14-30)33-19/h3-8,10,15,19,21,23,26,30H,1-2,9,11-14H2,(H,28,31)(H,29,32)/t19-,21+,23-,26-/m1/s1	LDGCPXKMKGRZSF-YDOBTQPPSA-N	484.176499758							98623
BRD-K69873182	LSM-12693		54646508	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21-,26-,28+/m1/s1	JRAPIMFHFBSUKE-ACEAMVEQSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K69873182	BRD-K69873182-001-01-1	Broad Institute of MIT and Harvard	BRD-K69873182			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H26F2N2O7/c30-17-2-4-22(31)16(7-17)12-32-27(35)11-19-10-21-20-9-18(3-6-23(20)40-28(21)26(13-34)39-19)33-29(36)15-1-5-24-25(8-15)38-14-37-24/h1-9,19,21,26,28,34H,10-14H2,(H,32,35)(H,33,36)/t19-,21-,26-,28+/m1/s1	JRAPIMFHFBSUKE-ACEAMVEQSA-N	552.170807592							101327
BRD-K86379744	LSM-13720		54646667	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22+,24+,26-/m1/s1	SGAJFFANPLXWDT-WUHHYYHUSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K86379744	BRD-K86379744-001-01-9	Broad Institute of MIT and Harvard	BRD-K86379744			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22+,24+,26-/m1/s1	SGAJFFANPLXWDT-WUHHYYHUSA-N	518.188685622							102369
BRD-K09787095	LSM-9025		54646572	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22-,24+,27+/m1/s1	NURZYHIHZDJTSB-YDGNWZKSSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K09787095	BRD-K09787095-001-01-2	Broad Institute of MIT and Harvard	BRD-K09787095			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22-,24+,27+/m1/s1	NURZYHIHZDJTSB-YDGNWZKSSA-N	488.205970036							97646
BRD-K10856568	LSM-9092		54646683	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22+,24+,27-/m1/s1	AJOHYGOUUFRWKL-LQZFSELZSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)N4CCc5ccccc5C4)C[C@H]3c2c1	BroadT	BRD-K10856568	BRD-K10856568-001-01-0	Broad Institute of MIT and Harvard	BRD-K10856568			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22+,24+,27-/m1/s1	AJOHYGOUUFRWKL-LQZFSELZSA-N	479.242021186							97713
BRD-K96079261	LSM-14325		54646648	InChI=1S/C29H31N3O5/c1-18(20-5-3-2-4-6-20)31-28(35)16-22-15-24-23-14-21(32-27(34)13-19-9-11-30-12-10-19)7-8-25(23)37-29(24)26(17-33)36-22/h2-12,14,18,22,24,26,29,33H,13,15-17H2,1H3,(H,31,35)(H,32,34)/t18-,22+,24-,26-,29+/m0/s1	XWECZACFMCVSEP-BLOQNXOGSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K96079261	BRD-K96079261-001-01-6	Broad Institute of MIT and Harvard	BRD-K96079261			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C29H31N3O5/c1-18(20-5-3-2-4-6-20)31-28(35)16-22-15-24-23-14-21(32-27(34)13-19-9-11-30-12-10-19)7-8-25(23)37-29(24)26(17-33)36-22/h2-12,14,18,22,24,26,29,33H,13,15-17H2,1H3,(H,31,35)(H,32,34)/t18-,22+,24-,26-,29+/m0/s1	XWECZACFMCVSEP-BLOQNXOGSA-N	501.226371122							102979
BRD-K72875756	LSM-12891		54646568	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22+,24+,27-/m1/s1	NURZYHIHZDJTSB-LQZFSELZSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K72875756	BRD-K72875756-001-01-7	Broad Institute of MIT and Harvard	BRD-K72875756			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(13-20(35-24)14-25(33)30-15-19-3-1-2-8-29-19)21-12-18(4-5-23(21)36-27)31-26(34)11-17-6-9-28-10-7-17/h1-10,12,20,22,24,27,32H,11,13-16H2,(H,30,33)(H,31,34)/t20-,22+,24+,27-/m1/s1	NURZYHIHZDJTSB-LQZFSELZSA-N	488.205970036							101528
BRD-K67029063	LSM-12509		54646734	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20-,22+,24+/m1/s1	SADUCKDCBXEUGG-NROSNUSPSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K67029063	BRD-K67029063-001-01-6	Broad Institute of MIT and Harvard	BRD-K67029063			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20-,22+,24+/m1/s1	SADUCKDCBXEUGG-NROSNUSPSA-N	458.241686828							101140
BRD-K10210954	LSM-9048		54646564	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22-,24+,26+/m0/s1	RXCSFWYPJHKPEM-TUTLFNSSSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)N5CCCCC5)C[C@H]4c3c2	BroadT	BRD-K10210954	BRD-K10210954-001-01-2	Broad Institute of MIT and Harvard	BRD-K10210954			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C26H32N2O7S/c1-33-18-6-5-7-20(13-18)36(31,32)27-17-8-9-23-21(12-17)22-14-19(34-24(16-29)26(22)35-23)15-25(30)28-10-3-2-4-11-28/h5-9,12-13,19,22,24,26-27,29H,2-4,10-11,14-16H2,1H3/t19-,22-,24+,26+/m0/s1	RXCSFWYPJHKPEM-TUTLFNSSSA-N	516.193022074							97669
BRD-K40389399	LSM-10891		54646466	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,21+,24+/m0/s1	QLCUJBUUXYDXPU-NCPQSORXSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccccc4F)C[C@H]3c2c1	BroadT	BRD-K40389399	BRD-K40389399-001-01-1	Broad Institute of MIT and Harvard	BRD-K40389399			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,21+,24+/m0/s1	QLCUJBUUXYDXPU-NCPQSORXSA-N	458.185314804							99512
CHEMBL2359007	LSM-9126	BRD-K11454759, SID131442875	54646501	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19-,21-,23+/m0/s1	JDHDHCLBKAEOSQ-RAKJYXHLSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	BroadT	BRD-K11454759	BRD-K11454759-001-01-2	Broad Institute of MIT and Harvard	BRD-K11454759			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19-,21-,23+/m0/s1	JDHDHCLBKAEOSQ-RAKJYXHLSA-N	523.193020246							97747
BRD-K13019660	LSM-9208		54646664	InChI=1S/C22H27N3O4/c1-25(2)15-3-4-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-7-23-8-6-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,20+,22+/m0/s1	ISIKKEOWKJPDMG-FDGCKHTNSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K13019660	BRD-K13019660-001-01-9	Broad Institute of MIT and Harvard	BRD-K13019660			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccncc4)O[C@@H]3CO)c2c1	InChI=1S/C22H27N3O4/c1-25(2)15-3-4-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-7-23-8-6-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,20+,22+/m0/s1	ISIKKEOWKJPDMG-FDGCKHTNSA-N	397.200156374							97829
BRD-K01359264	LSM-8520		54646679	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20-,23+,26+/m1/s1	YCZDHCVCWSKGTE-ZCXMQSQVSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)CN(C)C)cc34)[C@H](CO)O2	BroadT	BRD-K01359264	BRD-K01359264-001-01-3	Broad Institute of MIT and Harvard	BRD-K01359264			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	InChI=1S/C26H33N3O6/c1-29(2)14-25(32)28-17-8-9-22-19(10-17)20-11-18(34-23(15-30)26(20)35-22)12-24(31)27-13-16-6-4-5-7-21(16)33-3/h4-10,18,20,23,26,30H,11-15H2,1-3H3,(H,27,31)(H,28,32)/t18-,20-,23+,26+/m1/s1	YCZDHCVCWSKGTE-ZCXMQSQVSA-N	483.236935806							97141
BRD-K98842254	LSM-14495		54646720	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26-,28+/m1/s1	XHFXJTPXFPIUNX-XILASOBOSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NCc5ccc(Cl)cc5)C[C@@H]4c3c2	BroadT	BRD-K98842254	BRD-K98842254-001-01-4	Broad Institute of MIT and Harvard	BRD-K98842254			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C28H29ClN2O7S/c1-36-20-3-2-4-22(12-20)39(34,35)31-19-9-10-25-23(11-19)24-13-21(37-26(16-32)28(24)38-25)14-27(33)30-15-17-5-7-18(29)8-6-17/h2-12,21,24,26,28,31-32H,13-16H2,1H3,(H,30,33)/t21-,24-,26-,28+/m1/s1	XHFXJTPXFPIUNX-XILASOBOSA-N	572.138399688							103150
BRD-K12159290	LSM-9156		54646465	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,21-,24-/m0/s1	QLCUJBUUXYDXPU-JUUKQFNXSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccc4F)C[C@@H]3c2c1	BroadT	BRD-K12159290	BRD-K12159290-001-01-2	Broad Institute of MIT and Harvard	BRD-K12159290			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C24H27FN2O6/c1-31-13-23(30)27-15-6-7-20-17(8-15)18-9-16(32-21(12-28)24(18)33-20)10-22(29)26-11-14-4-2-3-5-19(14)25/h2-8,16,18,21,24,28H,9-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,21-,24-/m0/s1	QLCUJBUUXYDXPU-JUUKQFNXSA-N	458.185314804							97777
BRD-K33799929	LSM-10479		54646505	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19+,21-,23-/m0/s1	JDHDHCLBKAEOSQ-FTJYFCJYSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	BroadT	BRD-K33799929	BRD-K33799929-001-01-9	Broad Institute of MIT and Harvard	BRD-K33799929			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C25H28F3N3O6/c1-35-9-8-29-22(33)12-17-11-19-18-10-16(6-7-20(18)37-23(19)21(13-32)36-17)31-24(34)30-15-4-2-14(3-5-15)25(26,27)28/h2-7,10,17,19,21,23,32H,8-9,11-13H2,1H3,(H,29,33)(H2,30,31,34)/t17-,19+,21-,23-/m0/s1	JDHDHCLBKAEOSQ-FTJYFCJYSA-N	523.193020246							99100
BRD-K76257309	LSM-13088		54646523	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20-,24-,26+/m0/s1	WXTNJIBEBHTDAA-IHJBEOSKSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@H](CO)O2	BroadT	BRD-K76257309	BRD-K76257309-001-01-6	Broad Institute of MIT and Harvard	BRD-K76257309			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20-,24-,26+/m0/s1	WXTNJIBEBHTDAA-IHJBEOSKSA-N	509.216200362							101726
BRD-K46232974	LSM-11246		54646637	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23-,25-,27+/m1/s1	SNGIXDWGPLKZOT-ACIXWCJESA-N	C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K46232974	BRD-K46232974-001-01-0	Broad Institute of MIT and Harvard	BRD-K46232974			C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23-,25-,27+/m1/s1	SNGIXDWGPLKZOT-ACIXWCJESA-N	487.210721058							99867
BRD-K62768599	LSM-12242		54646732	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20+,22-,24-/m0/s1	SADUCKDCBXEUGG-FVSDWULHSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K62768599	BRD-K62768599-001-01-7	Broad Institute of MIT and Harvard	BRD-K62768599			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20+,22-,24-/m0/s1	SADUCKDCBXEUGG-FVSDWULHSA-N	458.241686828							100868
BRD-K87314084	LSM-13784		54646524	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20+,24+,26-/m0/s1	WXTNJIBEBHTDAA-BFAWKISMSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@@H](CO)O2	BroadT	BRD-K87314084	BRD-K87314084-001-01-3	Broad Institute of MIT and Harvard	BRD-K87314084			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C27H31N3O7/c1-29-6-8-30(9-7-29)25(32)13-18-12-20-19-11-17(3-5-21(19)37-26(20)24(14-31)36-18)28-27(33)16-2-4-22-23(10-16)35-15-34-22/h2-5,10-11,18,20,24,26,31H,6-9,12-15H2,1H3,(H,28,33)/t18-,20+,24+,26-/m0/s1	WXTNJIBEBHTDAA-BFAWKISMSA-N	509.216200362							102433
BRD-K63336416	LSM-12281		54646641	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23-,25+,27+/m0/s1	SNGIXDWGPLKZOT-DDMNXORRSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K63336416	BRD-K63336416-001-01-3	Broad Institute of MIT and Harvard	BRD-K63336416			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21+,23-,25+,27+/m0/s1	SNGIXDWGPLKZOT-DDMNXORRSA-N	487.210721058							100907
BRD-K37822854	LSM-10717		54646727	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20-,22-,24+/m1/s1	SADUCKDCBXEUGG-YWWGLXIYSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K37822854	BRD-K37822854-001-01-4	Broad Institute of MIT and Harvard	BRD-K37822854			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C25H34N2O6/c28-15-22-24-20(13-18(32-22)14-23(29)27-8-2-1-3-9-27)19-12-17(4-5-21(19)33-24)26-25(30)16-6-10-31-11-7-16/h4-5,12,16,18,20,22,24,28H,1-3,6-11,13-15H2,(H,26,30)/t18-,20-,22-,24+/m1/s1	SADUCKDCBXEUGG-YWWGLXIYSA-N	458.241686828							99338
BRD-K13558526	LSM-9243		54646665	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22-,24-,26+/m1/s1	SGAJFFANPLXWDT-DBSKKGOSSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K13558526	BRD-K13558526-001-01-0	Broad Institute of MIT and Harvard	BRD-K13558526			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H31FN2O6S/c27-16-6-9-20(10-7-16)36(32,33)29-18-8-11-23-21(12-18)22-13-19(34-24(15-30)26(22)35-23)14-25(31)28-17-4-2-1-3-5-17/h6-12,17,19,22,24,26,29-30H,1-5,13-15H2,(H,28,31)/t19-,22-,24-,26+/m1/s1	SGAJFFANPLXWDT-DBSKKGOSSA-N	518.188685622							97864
BRD-K70231266	LSM-12715		54646643	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21-,23+,25-,27-/m0/s1	SNGIXDWGPLKZOT-DWEXDDMVSA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K70231266	BRD-K70231266-001-01-8	Broad Institute of MIT and Harvard	BRD-K70231266			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29N3O5/c1-17(18-6-3-2-4-7-18)30-26(33)14-21-13-23-22-12-20(31-28(34)19-8-5-11-29-15-19)9-10-24(22)36-27(23)25(16-32)35-21/h2-12,15,17,21,23,25,27,32H,13-14,16H2,1H3,(H,30,33)(H,31,34)/t17-,21-,23+,25-,27-/m0/s1	SNGIXDWGPLKZOT-DWEXDDMVSA-N	487.210721058							101350
CHEMBL2359557	LSM-11363	BRD-K48230737, SID131443063	54646689	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23-,25-,27+/m0/s1	QUFPSNAFNYGAMM-NTYBTQPHSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K48230737	BRD-K48230737-001-01-0	Broad Institute of MIT and Harvard	BRD-K48230737			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H27ClF3N3O5/c30-18-5-1-16(2-6-18)14-34-26(38)13-21-12-23-22-11-20(9-10-24(22)41-27(23)25(15-37)40-21)36-28(39)35-19-7-3-17(4-8-19)29(31,32)33/h1-11,21,23,25,27,37H,12-15H2,(H,34,38)(H2,35,36,39)/t21-,23-,25-,27+/m0/s1	QUFPSNAFNYGAMM-NTYBTQPHSA-N	589.159133304							99984
BRD-K47121420	LSM-11308		54646442	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28+,30-,32-/m1/s1	MARYDHBQWVLAFX-WJDOUZETSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K47121420	BRD-K47121420-001-01-4	Broad Institute of MIT and Harvard	BRD-K47121420			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28+,30-,32-/m1/s1	MARYDHBQWVLAFX-WJDOUZETSA-N	572.252251512							99929
BRD-K40280267	LSM-10888		54646680	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22-,24-,27+/m1/s1	AJOHYGOUUFRWKL-BBVHREJBSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)N4CCc5ccccc5C4)C[C@@H]3c2c1	BroadT	BRD-K40280267	BRD-K40280267-001-01-1	Broad Institute of MIT and Harvard	BRD-K40280267			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N4CCc5ccccc5C4)O[C@@H]3CO)c2c1	InChI=1S/C27H33N3O5/c1-29(2)15-25(32)28-19-7-8-23-21(11-19)22-12-20(34-24(16-31)27(22)35-23)13-26(33)30-10-9-17-5-3-4-6-18(17)14-30/h3-8,11,20,22,24,27,31H,9-10,12-16H2,1-2H3,(H,28,32)/t20-,22-,24-,27+/m1/s1	AJOHYGOUUFRWKL-BBVHREJBSA-N	479.242021186							99509
CHEMBL3182010	LSM-30293	BRD-K13487307	54646438	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28-,30-,32+/m1/s1	MARYDHBQWVLAFX-LOAKGGRCSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K13487307	BRD-K13487307-001-01-7	Broad Institute of MIT and Harvard	BRD-K13487307			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C33H36N2O7/c36-20-30-32-28(27-16-23(8-11-29(27)42-32)35-33(38)22-12-14-39-15-13-22)17-26(41-30)18-31(37)34-19-21-6-9-25(10-7-21)40-24-4-2-1-3-5-24/h1-11,16,22,26,28,30,32,36H,12-15,17-20H2,(H,34,37)(H,35,38)/t26-,28-,30-,32+/m1/s1	MARYDHBQWVLAFX-LOAKGGRCSA-N	572.252251512							118844
BRD-K06836704	LSM-30294		54640978	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21-/m1/s1	YNMAXJORQBUKHH-UMSONDCASA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K06836704	BRD-K06836704-001-01-3	Broad Institute of MIT and Harvard	BRD-K06836704			C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21-/m1/s1	YNMAXJORQBUKHH-UMSONDCASA-N	411.215806438							118845
BRD-K37592272	LSM-30295		54640780	InChI=1S/C28H35N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-14,24-26,32H,2,5-6,15-20H2,(H,29,34)(H,30,33)/t24-,25+,26-/m0/s1	UFNCHKMEJBOGRV-NXCFDTQHSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K37592272	BRD-K37592272-001-01-7	Broad Institute of MIT and Harvard	BRD-K37592272			OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H35N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-14,24-26,32H,2,5-6,15-20H2,(H,29,34)(H,30,33)/t24-,25+,26-/m0/s1	UFNCHKMEJBOGRV-NXCFDTQHSA-N	477.26275663							118846
BRD-K50278697	LSM-30296		54641026	InChI=1S/C14H21FN2O4S/c15-11-3-1-2-4-14(11)22(19,20)17-12-6-5-10(7-8-16)21-13(12)9-18/h1-4,10,12-13,17-18H,5-9,16H2/t10-,12+,13-/m1/s1	JZPUUEAQNKYZBD-KGYLQXTDSA-N	NCC[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2F)[C@@H](CO)O1	BroadT	BRD-K50278697	BRD-K50278697-001-01-2	Broad Institute of MIT and Harvard	BRD-K50278697			NCC[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2F)[C@@H](CO)O1	InChI=1S/C14H21FN2O4S/c15-11-3-1-2-4-14(11)22(19,20)17-12-6-5-10(7-8-16)21-13(12)9-18/h1-4,10,12-13,17-18H,5-9,16H2/t10-,12+,13-/m1/s1	JZPUUEAQNKYZBD-KGYLQXTDSA-N	332.120606062							118847
CHEMBL3184701	LSM-30297	BRD-K49866832	54641024	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14+,15-/m1/s1	MDKMCQYBVAECJP-QLFBSQMISA-N	NCC[C@H]1CC[C@H](NS(=O)(=O)Cc2ccccc2)[C@@H](CO)O1	BroadT	BRD-K49866832	BRD-K49866832-001-01-4	Broad Institute of MIT and Harvard	BRD-K49866832			NCC[C@H]1CC[C@H](NS(=O)(=O)Cc2ccccc2)[C@@H](CO)O1	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14+,15-/m1/s1	MDKMCQYBVAECJP-QLFBSQMISA-N	328.145677958							118848
BRD-K27858225	LSM-30298		54640931	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13+,14+/m0/s1	BRLNHSCHDPURAU-IACUBPJLSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)O)O[C@@H]2CO	BroadT	BRD-K27858225	BRD-K27858225-001-01-2	Broad Institute of MIT and Harvard	BRD-K27858225			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(O)=O)O[C@@H]1CO	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13+,14+/m0/s1	BRLNHSCHDPURAU-IACUBPJLSA-N	343.108958092							118849
BRD-K71716722	LSM-30299		54640754	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19-/m0/s1	SLCLMSLRMDGYCU-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K71716722	BRD-K71716722-001-01-5	Broad Institute of MIT and Harvard	BRD-K71716722			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19-/m0/s1	SLCLMSLRMDGYCU-OTWHNJEPSA-N	472.229740112							118850
BRD-K64137284	LSM-30300		54640994	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20+,21+/m1/s1	DVSDZAFRLPIFCS-GIVPXCGWSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CCNC(=O)C3CCCCC3)O[C@H]2CO	BroadT	BRD-K64137284	BRD-K64137284-001-01-3	Broad Institute of MIT and Harvard	BRD-K64137284			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCNC(=O)C2CCCCC2)O[C@H]1CO	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20+,21+/m1/s1	DVSDZAFRLPIFCS-GIVPXCGWSA-N	438.218842898							118851
BRD-K28982281	LSM-30301		54640770	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20-,23-/m0/s1	KTXYXNLRJUMWJA-JTAQYXEDSA-N	OC[C@@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)CC[C@@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K28982281	BRD-K28982281-001-01-0	Broad Institute of MIT and Harvard	BRD-K28982281			OC[C@@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20-,23-/m0/s1	KTXYXNLRJUMWJA-JTAQYXEDSA-N	452.194736636							118852
BRD-K51365808	LSM-30302		54641027	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16+/m0/s1	UDNDOFJZCBESNN-ARFHVFGLSA-N	CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	BroadT	BRD-K51365808	BRD-K51365808-001-01-2	Broad Institute of MIT and Harvard	BRD-K51365808			CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16+/m0/s1	UDNDOFJZCBESNN-ARFHVFGLSA-N	340.236207524							118853
BRD-K30601921	LSM-30303		54640952	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19-,22-/m1/s1	IYNBDOOKZCJAQL-SFGWALBWSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)c4cccnc4)O[C@@H]2CO	BroadT	BRD-K30601921	BRD-K30601921-001-01-8	Broad Institute of MIT and Harvard	BRD-K30601921			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)-c2cccnc2)O[C@@H]1CO	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19-,22-/m1/s1	IYNBDOOKZCJAQL-SFGWALBWSA-N	452.217203436							118854
BRD-K47415214	LSM-30304		54640920	InChI=1S/C19H28N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h4-5,7,11,14-16,24H,1-3,6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15-,16+/m1/s1	DDEXDZVSNNOFMF-OAGGEKHMSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K47415214	BRD-K47415214-001-01-0	Broad Institute of MIT and Harvard	BRD-K47415214			OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C19H28N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h4-5,7,11,14-16,24H,1-3,6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15-,16+/m1/s1	DDEXDZVSNNOFMF-OAGGEKHMSA-N	408.183126106							118855
BRD-K58680513	LSM-30305		54640878	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19-,20+/m0/s1	DOQFJJOYHUUDAI-YSIASYRMSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K58680513	BRD-K58680513-001-01-3	Broad Institute of MIT and Harvard	BRD-K58680513			OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19-,20+/m0/s1	DOQFJJOYHUUDAI-YSIASYRMSA-N	486.078297998							118856
BRD-K44864058	LSM-30306		54641017	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15-/m0/s1	LJGUQBBKFZFLJA-ZNMIVQPWSA-N	CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCCN(C)C)O[C@H]1CO	BroadT	BRD-K44864058	BRD-K44864058-001-01-1	Broad Institute of MIT and Harvard	BRD-K44864058			CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCCN(C)C)O[C@H]1CO	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15-/m0/s1	LJGUQBBKFZFLJA-ZNMIVQPWSA-N	356.242355544							118857
BRD-K85513726	LSM-30307		54640955	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19-,22+/m0/s1	IYNBDOOKZCJAQL-LQBOVUBWSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)c4cccnc4)O[C@@H]2CO	BroadT	BRD-K85513726	BRD-K85513726-001-01-6	Broad Institute of MIT and Harvard	BRD-K85513726			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)-c2cccnc2)O[C@@H]1CO	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19-,22+/m0/s1	IYNBDOOKZCJAQL-LQBOVUBWSA-N	452.217203436							118858
BRD-K16163479	LSM-30308		54640946	InChI=1S/C22H28N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,19-21,24-25H,2,12-15H2,1H3,(H,23,26)/t19-,20+,21+/m0/s1	DNFBTYFNFJSDKD-PWRODBHTSA-N	CCS(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)O[C@@H]1CO	BroadT	BRD-K16163479	BRD-K16163479-001-01-3	Broad Institute of MIT and Harvard	BRD-K16163479			CCS(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C22H28N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,19-21,24-25H,2,12-15H2,1H3,(H,23,26)/t19-,20+,21+/m0/s1	DNFBTYFNFJSDKD-PWRODBHTSA-N	432.171892706							118859
BRD-K48332223	LSM-30309		54640919	InChI=1S/C19H28N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h4-5,7,11,14-16,24H,1-3,6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15-,16+/m0/s1	DDEXDZVSNNOFMF-HRCADAONSA-N	OC[C@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K48332223	BRD-K48332223-001-01-5	Broad Institute of MIT and Harvard	BRD-K48332223			OC[C@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C19H28N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h4-5,7,11,14-16,24H,1-3,6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15-,16+/m0/s1	DDEXDZVSNNOFMF-HRCADAONSA-N	408.183126106							118860
BRD-K04067194	LSM-30310		54640745	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23-/m1/s1	PFEWRFQNGBURGF-XPWALMASSA-N	Cc1onc(C)c1NC(=O)N[C@H]2C=C[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K04067194	BRD-K04067194-001-01-4	Broad Institute of MIT and Harvard	BRD-K04067194			Cc1noc(C)c1NC(=O)N[C@H]1C=C[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23-/m1/s1	PFEWRFQNGBURGF-XPWALMASSA-N	476.205970036							118861
BRD-K48880196	LSM-30311		54641045	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18-,21+/m0/s1	DNUVWNCDCIVCLB-UQASEVPWSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NC(=O)c4ccccc4F	BroadT	BRD-K48880196	BRD-K48880196-001-01-6	Broad Institute of MIT and Harvard	BRD-K48880196			OC[C@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18-,21+/m0/s1	DNUVWNCDCIVCLB-UQASEVPWSA-N	444.16966474							118862
BRD-K49698948	LSM-30312		54640900	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17+,18-/m1/s1	WYLNQZCZILOHII-FGTMMUONSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K49698948	BRD-K49698948-001-01-2	Broad Institute of MIT and Harvard	BRD-K49698948			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17+,18-/m1/s1	WYLNQZCZILOHII-FGTMMUONSA-N	441.187540942							118863
BRD-K13526564	LSM-30313		54640970	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18+,19+/m1/s1	ZGRBCZVMEMXSST-NEWSRXKRSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K13526564	BRD-K13526564-001-01-0	Broad Institute of MIT and Harvard	BRD-K13526564			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)c1ccncc1	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18+,19+/m1/s1	ZGRBCZVMEMXSST-NEWSRXKRSA-N	453.112519298							118864
BRD-K77978259	LSM-30314		54640777	InChI=1S/C28H35N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-14,24-26,32H,2,5-6,15-20H2,(H,29,34)(H,30,33)/t24-,25-,26+/m0/s1	UFNCHKMEJBOGRV-KKUQBAQOSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K77978259	BRD-K77978259-001-01-6	Broad Institute of MIT and Harvard	BRD-K77978259			OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H35N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-14,24-26,32H,2,5-6,15-20H2,(H,29,34)(H,30,33)/t24-,25-,26+/m0/s1	UFNCHKMEJBOGRV-KKUQBAQOSA-N	477.26275663							118865
BRD-K13257316	LSM-30315		54640894	InChI=1S/C24H26N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,14,16,20-22,27,29H,13,15H2,1H3,(H,26,30)/t20-,21-,22+/m1/s1	RYZOUXVVIYMMJY-VSKRKVRLSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K13257316	BRD-K13257316-001-01-3	Broad Institute of MIT and Harvard	BRD-K13257316			Cn1cnc(c1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C24H26N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,14,16,20-22,27,29H,13,15H2,1H3,(H,26,30)/t20-,21-,22+/m1/s1	RYZOUXVVIYMMJY-VSKRKVRLSA-N	482.162390662							118866
BRD-K81575721	LSM-30316		54640779	InChI=1S/C28H35N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-14,24-26,32H,2,5-6,15-20H2,(H,29,34)(H,30,33)/t24-,25+,26-/m1/s1	UFNCHKMEJBOGRV-UODIDJSMSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K81575721	BRD-K81575721-001-01-4	Broad Institute of MIT and Harvard	BRD-K81575721			OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H35N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-14,24-26,32H,2,5-6,15-20H2,(H,29,34)(H,30,33)/t24-,25+,26-/m1/s1	UFNCHKMEJBOGRV-UODIDJSMSA-N	477.26275663							118867
BRD-K67813189	LSM-30317		54640785	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17-,19+/m1/s1	QKYXERGZTDIPLJ-LMMKCTJWSA-N	CC(C)c1cn(CC[C@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)nn1	BroadT	BRD-K67813189	BRD-K67813189-001-01-2	Broad Institute of MIT and Harvard	BRD-K67813189			CC(C)c1cn(CC[C@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)nn1	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17-,19+/m1/s1	QKYXERGZTDIPLJ-LMMKCTJWSA-N	390.206718964							118868
BRD-K89501960	LSM-30318		54641036	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15+,16+/m1/s1	DMROSRCUXVWXJU-PMPSAXMXSA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	BroadT	BRD-K89501960	BRD-K89501960-001-01-2	Broad Institute of MIT and Harvard	BRD-K89501960			CC(C)NC(=O)N[C@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15+,16+/m1/s1	DMROSRCUXVWXJU-PMPSAXMXSA-N	371.242021186							118869
BRD-K58232861	LSM-30319		54641001	InChI=1S/C17H25FN2O5S/c1-2-26(23,24)20-15-8-7-14(25-16(15)11-21)9-17(22)19-10-12-3-5-13(18)6-4-12/h3-6,14-16,20-21H,2,7-11H2,1H3,(H,19,22)/t14-,15+,16+/m1/s1	AXKSOFKOICMKIG-PMPSAXMXSA-N	CCS(=O)(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccc(F)cc2)O[C@H]1CO	BroadT	BRD-K58232861	BRD-K58232861-001-01-1	Broad Institute of MIT and Harvard	BRD-K58232861			CCS(=O)(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccc(F)cc2)O[C@H]1CO	InChI=1S/C17H25FN2O5S/c1-2-26(23,24)20-15-8-7-14(25-16(15)11-21)9-17(22)19-10-12-3-5-13(18)6-4-12/h3-6,14-16,20-21H,2,7-11H2,1H3,(H,19,22)/t14-,15+,16+/m1/s1	AXKSOFKOICMKIG-PMPSAXMXSA-N	388.14682081							118870
BRD-K40490682	LSM-30320		54640859	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18+,19+/m0/s1	ZJAQJJRCHWWGEL-IPMKNSEASA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K40490682	BRD-K40490682-001-01-3	Broad Institute of MIT and Harvard	BRD-K40490682			OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18+,19+/m0/s1	ZJAQJJRCHWWGEL-IPMKNSEASA-N	420.237270164							118871
BRD-K54790089	LSM-30321		54640809	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23-,24+/m1/s1	RLBPWNWBWPNMOA-SMIHKQSGSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)CC4CC4	BroadT	BRD-K54790089	BRD-K54790089-001-01-8	Broad Institute of MIT and Harvard	BRD-K54790089			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)CC1CC1	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23-,24+/m1/s1	RLBPWNWBWPNMOA-SMIHKQSGSA-N	434.22055746							118872
BRD-K59517185	LSM-30322		54640765	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18+/m1/s1	DTKWTAJBQNGVNM-KURKYZTESA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Cc2cccnc2)C=C1	BroadT	BRD-K59517185	BRD-K59517185-001-01-3	Broad Institute of MIT and Harvard	BRD-K59517185			CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Cc2cccnc2)C=C1	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18+/m1/s1	DTKWTAJBQNGVNM-KURKYZTESA-N	390.22670548							118873
BRD-K14163107	LSM-30323		54640912	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18-/m0/s1	UMDIUEAUIUREDG-BZSNNMDCSA-N	CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	BroadT	BRD-K14163107	BRD-K14163107-001-01-5	Broad Institute of MIT and Harvard	BRD-K14163107			CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18-/m0/s1	UMDIUEAUIUREDG-BZSNNMDCSA-N	377.231456502							118874
BRD-K54742099	LSM-30324		54640998	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20-,21-/m1/s1	DVSDZAFRLPIFCS-HMXCVIKNSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CCNC(=O)C3CCCCC3)O[C@@H]2CO	BroadT	BRD-K54742099	BRD-K54742099-001-01-7	Broad Institute of MIT and Harvard	BRD-K54742099			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CCCCC2)O[C@@H]1CO	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20-,21-/m1/s1	DVSDZAFRLPIFCS-HMXCVIKNSA-N	438.218842898							118875
BRD-K35288606	LSM-30325		54640895	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17+,18+/m0/s1	WYLNQZCZILOHII-RCCFBDPRSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K35288606	BRD-K35288606-001-01-1	Broad Institute of MIT and Harvard	BRD-K35288606			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17+,18+/m0/s1	WYLNQZCZILOHII-RCCFBDPRSA-N	441.187540942							118876
BRD-K13938991	LSM-30326		54641048	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18-,21-/m0/s1	DNUVWNCDCIVCLB-XERREHJYSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NC(=O)c4ccccc4F	BroadT	BRD-K13938991	BRD-K13938991-001-01-0	Broad Institute of MIT and Harvard	BRD-K13938991			OC[C@@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18-,21-/m0/s1	DNUVWNCDCIVCLB-XERREHJYSA-N	444.16966474							118877
BRD-K83645749	LSM-30327		54640928	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15-,16+/m1/s1	LATIXEUUNJKTQG-OAGGEKHMSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K83645749	BRD-K83645749-001-01-1	Broad Institute of MIT and Harvard	BRD-K83645749			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)C1CCOCC1	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15-,16+/m1/s1	LATIXEUUNJKTQG-OAGGEKHMSA-N	352.199822016							118878
BRD-K40103182	LSM-30328		54640903	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24-,25-/m1/s1	HQJSXCNUPDQHFZ-UBFVSLLYSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)c4ccccc4	BroadT	BRD-K40103182	BRD-K40103182-001-01-7	Broad Institute of MIT and Harvard	BRD-K40103182			OC[C@H]1O[C@H](CC[C@H]1NC(=O)c1ccccc1)CC(=O)Nc1ccc(cc1)-c1ccccc1	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24-,25-/m1/s1	HQJSXCNUPDQHFZ-UBFVSLLYSA-N	444.204907396							118879
BRD-K14181473	LSM-30329		54640954	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19-,22-/m0/s1	IYNBDOOKZCJAQL-JLMWRMLUSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)c4cccnc4)O[C@H]2CO	BroadT	BRD-K14181473	BRD-K14181473-001-01-3	Broad Institute of MIT and Harvard	BRD-K14181473			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)-c2cccnc2)O[C@H]1CO	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19-,22-/m0/s1	IYNBDOOKZCJAQL-JLMWRMLUSA-N	452.217203436							118880
BRD-K79730625	LSM-30330		54640752	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19+/m1/s1	SLCLMSLRMDGYCU-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K79730625	BRD-K79730625-001-01-6	Broad Institute of MIT and Harvard	BRD-K79730625			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19+/m1/s1	SLCLMSLRMDGYCU-QRVBRYPASA-N	472.229740112							118881
BRD-K64722080	LSM-30331		54640761	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18+/m1/s1	DTKWTAJBQNGVNM-SQNIBIBYSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2cccnc2)C=C1	BroadT	BRD-K64722080	BRD-K64722080-001-01-8	Broad Institute of MIT and Harvard	BRD-K64722080			CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2cccnc2)C=C1	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18+/m1/s1	DTKWTAJBQNGVNM-SQNIBIBYSA-N	390.22670548							118882
BRD-K44652223	LSM-30332		54640836	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18-,20+/m0/s1	RRAIEYROWAKKHB-CMKODMSKSA-N	CC(C)c1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)Cc3ccccc3)[C@@H](CO)O2)nn1	BroadT	BRD-K44652223	BRD-K44652223-001-01-0	Broad Institute of MIT and Harvard	BRD-K44652223			CC(C)c1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)Cc3ccccc3)[C@@H](CO)O2)nn1	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18-,20+/m0/s1	RRAIEYROWAKKHB-CMKODMSKSA-N	422.19877617							118883
BRD-K94439911	LSM-30333		54640932	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13+,14+/m1/s1	BRLNHSCHDPURAU-XBFCOCLRSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)O)O[C@H]2CO	BroadT	BRD-K94439911	BRD-K94439911-001-01-8	Broad Institute of MIT and Harvard	BRD-K94439911			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CC(O)=O)O[C@H]1CO	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13+,14+/m1/s1	BRLNHSCHDPURAU-XBFCOCLRSA-N	343.108958092							118884
BRD-K73337367	LSM-30334		54641031	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16-/m0/s1	UDNDOFJZCBESNN-JYJNAYRXSA-N	CCC(=O)N[C@H]1CC[C@@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	BroadT	BRD-K73337367	BRD-K73337367-001-01-8	Broad Institute of MIT and Harvard	BRD-K73337367			CCC(=O)N[C@H]1CC[C@@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16-/m0/s1	UDNDOFJZCBESNN-JYJNAYRXSA-N	340.236207524							118885
BRD-K54484272	LSM-30335		54640852	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19-,20+/m1/s1	KCRDNBZRFZAOKR-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K54484272	BRD-K54484272-001-01-5	Broad Institute of MIT and Harvard	BRD-K54484272			OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19-,20+/m1/s1	KCRDNBZRFZAOKR-AQNXPRMDSA-N	465.12221173							118886
BRD-K42855618	LSM-30336		54640827	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15-,16-/m0/s1	CAIOSQFPDHZSIB-JYJNAYRXSA-N	COCc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3c(C)onc3C)[C@H](CO)O2)nn1	BroadT	BRD-K42855618	BRD-K42855618-001-01-4	Broad Institute of MIT and Harvard	BRD-K42855618			COCc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3c(C)noc3C)[C@H](CO)O2)nn1	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15-,16-/m0/s1	CAIOSQFPDHZSIB-JYJNAYRXSA-N	408.212118056							118887
BRD-K83436911	LSM-30337		54640815	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20+,22+/m1/s1	WUPYLLMMUFNJPD-AGHHOFFYSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3ccccc3F)CC[C@@H]1NC(=O)Cc4ccncc4	BroadT	BRD-K83436911	BRD-K83436911-001-01-7	Broad Institute of MIT and Harvard	BRD-K83436911			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2F)CC[C@@H]1NC(=O)Cc1ccncc1	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20+,22+/m1/s1	WUPYLLMMUFNJPD-AGHHOFFYSA-N	439.201967942							118888
BRD-K24529791	LSM-30338		54640846	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19+/m0/s1	AQOAQYOOWGGKER-ZYSHUDEJSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K24529791	BRD-K24529791-001-01-6	Broad Institute of MIT and Harvard	BRD-K24529791			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19+/m0/s1	AQOAQYOOWGGKER-ZYSHUDEJSA-N	451.106561666							118889
BRD-K21176869	LSM-30339		54640748	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19+/m1/s1	SLCLMSLRMDGYCU-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K21176869	BRD-K21176869-001-01-6	Broad Institute of MIT and Harvard	BRD-K21176869			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19+/m1/s1	SLCLMSLRMDGYCU-QYZOEREBSA-N	472.229740112							118890
BRD-K14258088	LSM-30340		54641000	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20+,21-/m0/s1	DVSDZAFRLPIFCS-TYPHKJRUSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CCNC(=O)C3CCCCC3)O[C@H]2CO	BroadT	BRD-K14258088	BRD-K14258088-001-01-6	Broad Institute of MIT and Harvard	BRD-K14258088			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CCCCC2)O[C@H]1CO	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20+,21-/m0/s1	DVSDZAFRLPIFCS-TYPHKJRUSA-N	438.218842898							118891
BRD-K57343972	LSM-30341		54640967	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21+/m1/s1	KEJHSICNFQEVJK-OBUJGBQQSA-N	C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K57343972	BRD-K57343972-001-01-3	Broad Institute of MIT and Harvard	BRD-K57343972			C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21+/m1/s1	KEJHSICNFQEVJK-OBUJGBQQSA-N	448.14682081							118892
BRD-K62418408	LSM-30342		54640996	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20-,21+/m1/s1	DVSDZAFRLPIFCS-NRSPTQNISA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CCNC(=O)C3CCCCC3)O[C@H]2CO	BroadT	BRD-K62418408	BRD-K62418408-001-01-0	Broad Institute of MIT and Harvard	BRD-K62418408			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CCCCC2)O[C@H]1CO	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20-,21+/m1/s1	DVSDZAFRLPIFCS-NRSPTQNISA-N	438.218842898							118893
BRD-K59434830	LSM-30343		54640774	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20+,23-/m0/s1	KTXYXNLRJUMWJA-MZKRTTBSSA-N	OC[C@@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)CC[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K59434830	BRD-K59434830-001-01-0	Broad Institute of MIT and Harvard	BRD-K59434830			OC[C@@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20+,23-/m0/s1	KTXYXNLRJUMWJA-MZKRTTBSSA-N	452.194736636							118894
BRD-K51446586	LSM-30344		54640916	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18-/m0/s1	UMDIUEAUIUREDG-KSZLIROESA-N	CCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	BroadT	BRD-K51446586	BRD-K51446586-001-01-8	Broad Institute of MIT and Harvard	BRD-K51446586			CCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18-/m0/s1	UMDIUEAUIUREDG-KSZLIROESA-N	377.231456502							118895
BRD-K96575636	LSM-30345		54640956	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19+,22-/m1/s1	IYNBDOOKZCJAQL-ZWCUEREDSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CCn3cc(nn3)c4cccnc4)O[C@@H]2CO	BroadT	BRD-K96575636	BRD-K96575636-001-01-1	Broad Institute of MIT and Harvard	BRD-K96575636			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)-c2cccnc2)O[C@@H]1CO	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19+,22-/m1/s1	IYNBDOOKZCJAQL-ZWCUEREDSA-N	452.217203436							118896
BRD-K38972344	LSM-30346		54641019	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14+,15+/m1/s1	MDKMCQYBVAECJP-ILXRZTDVSA-N	NCC[C@H]1CC[C@H](NS(=O)(=O)Cc2ccccc2)[C@H](CO)O1	BroadT	BRD-K38972344	BRD-K38972344-001-01-4	Broad Institute of MIT and Harvard	BRD-K38972344			NCC[C@H]1CC[C@H](NS(=O)(=O)Cc2ccccc2)[C@H](CO)O1	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14+,15+/m1/s1	MDKMCQYBVAECJP-ILXRZTDVSA-N	328.145677958							118897
BRD-K63065496	LSM-30347		54640951	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19+,22+/m0/s1	IYNBDOOKZCJAQL-LRXVAGHRSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)c4cccnc4)O[C@@H]2CO	BroadT	BRD-K63065496	BRD-K63065496-001-01-1	Broad Institute of MIT and Harvard	BRD-K63065496			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2cccnc2)O[C@@H]1CO	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19+,22+/m0/s1	IYNBDOOKZCJAQL-LRXVAGHRSA-N	452.217203436							118898
BRD-K07489055	LSM-30348		54640822	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15+,16+/m0/s1	CAIOSQFPDHZSIB-ARFHVFGLSA-N	COCc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3c(C)onc3C)[C@@H](CO)O2)nn1	BroadT	BRD-K07489055	BRD-K07489055-001-01-5	Broad Institute of MIT and Harvard	BRD-K07489055			COCc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3c(C)noc3C)[C@@H](CO)O2)nn1	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15+,16+/m0/s1	CAIOSQFPDHZSIB-ARFHVFGLSA-N	408.212118056							118899
BRD-K31197843	LSM-30349		54640923	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15+,16+/m0/s1	LATIXEUUNJKTQG-ARFHVFGLSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K31197843	BRD-K31197843-001-01-1	Broad Institute of MIT and Harvard	BRD-K31197843			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)C1CCOCC1	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15+,16+/m0/s1	LATIXEUUNJKTQG-ARFHVFGLSA-N	352.199822016							118900
BRD-K21595913	LSM-30350		54640800	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18+,19-/m1/s1	GHLUFTIHFDMMKJ-CEXWTWQISA-N	CCCc1cn(CC[C@H]2CC[C@H](NC(=O)C3CCCCC3)[C@@H](CO)O2)nn1	BroadT	BRD-K21595913	BRD-K21595913-001-01-3	Broad Institute of MIT and Harvard	BRD-K21595913			CCCc1cn(CC[C@H]2CC[C@H](NC(=O)C3CCCCC3)[C@@H](CO)O2)nn1	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18+,19-/m1/s1	GHLUFTIHFDMMKJ-CEXWTWQISA-N	378.263090988							118901
BRD-K22443456	LSM-30351		54640851	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19+,20+/m1/s1	KCRDNBZRFZAOKR-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K22443456	BRD-K22443456-001-01-8	Broad Institute of MIT and Harvard	BRD-K22443456			OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19+,20+/m1/s1	KCRDNBZRFZAOKR-AABGKKOBSA-N	465.12221173							118902
BRD-K53988836	LSM-30352		54640773	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20+,23-/m1/s1	KTXYXNLRJUMWJA-ZRCGQRJVSA-N	OC[C@H]1O[C@@H](CC(=O)NC2Cc3ccccc3C2)CC[C@@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K53988836	BRD-K53988836-001-01-5	Broad Institute of MIT and Harvard	BRD-K53988836			OC[C@H]1O[C@@H](CC(=O)NC2Cc3ccccc3C2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20+,23-/m1/s1	KTXYXNLRJUMWJA-ZRCGQRJVSA-N	452.194736636							118903
BRD-K68087668	LSM-30353		54640789	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17+,18+/m0/s1	KPQAGDNSAAOMGS-RCCFBDPRSA-N	CN1CCN(CC1)C(=O)C[C@H]2O[C@H](CO)[C@H](NC(=O)Cc3ccccn3)C=C2	BroadT	BRD-K68087668	BRD-K68087668-001-01-2	Broad Institute of MIT and Harvard	BRD-K68087668			CN1CCN(CC1)C(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17+,18+/m0/s1	KPQAGDNSAAOMGS-RCCFBDPRSA-N	388.211055416							118904
BRD-K63487554	LSM-30354		54640948	InChI=1S/C22H28N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,19-21,24-25H,2,12-15H2,1H3,(H,23,26)/t19-,20-,21-/m1/s1	DNFBTYFNFJSDKD-NJDAHSKKSA-N	CCS(=O)(=O)N[C@@H]1CC[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)O[C@@H]1CO	BroadT	BRD-K63487554	BRD-K63487554-001-01-6	Broad Institute of MIT and Harvard	BRD-K63487554			CCS(=O)(=O)N[C@@H]1CC[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C22H28N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,19-21,24-25H,2,12-15H2,1H3,(H,23,26)/t19-,20-,21-/m1/s1	DNFBTYFNFJSDKD-NJDAHSKKSA-N	432.171892706							118905
BRD-K63920153	LSM-30355		54640763	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18-/m0/s1	DTKWTAJBQNGVNM-BZSNNMDCSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2cccnc2)C=C1	BroadT	BRD-K63920153	BRD-K63920153-001-01-1	Broad Institute of MIT and Harvard	BRD-K63920153			CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2cccnc2)C=C1	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18-/m0/s1	DTKWTAJBQNGVNM-BZSNNMDCSA-N	390.22670548							118906
BRD-K33805386	LSM-30356		54640892	InChI=1S/C24H26N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,14,16,20-22,27,29H,13,15H2,1H3,(H,26,30)/t20-,21-,22-/m0/s1	RYZOUXVVIYMMJY-FKBYEOEOSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K33805386	BRD-K33805386-001-01-0	Broad Institute of MIT and Harvard	BRD-K33805386			Cn1cnc(c1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C24H26N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,14,16,20-22,27,29H,13,15H2,1H3,(H,26,30)/t20-,21-,22-/m0/s1	RYZOUXVVIYMMJY-FKBYEOEOSA-N	482.162390662							118907
BRD-K08154407	LSM-30357		54641038	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15-,16+/m1/s1	DMROSRCUXVWXJU-OAGGEKHMSA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	BroadT	BRD-K08154407	BRD-K08154407-001-01-9	Broad Institute of MIT and Harvard	BRD-K08154407			CC(C)NC(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15-,16+/m1/s1	DMROSRCUXVWXJU-OAGGEKHMSA-N	371.242021186							118908
BRD-K93008833	LSM-30358		54641056	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18-,19+/m0/s1	RDGNRWNQTDLRBG-ZYSHUDEJSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NC(=O)c4ccccc4F	BroadT	BRD-K93008833	BRD-K93008833-001-01-7	Broad Institute of MIT and Harvard	BRD-K93008833			OC[C@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18-,19+/m0/s1	RDGNRWNQTDLRBG-ZYSHUDEJSA-N	432.217283648							118909
CHEMBL3181812	LSM-30359	BRD-K09071517	54640759	InChI=1S/C28H31N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-13,16,24-26,32H,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26-/m1/s1	LTCMWRCKDZHFDM-UODIDJSMSA-N	COc1cccc(NC(=O)N[C@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO)c1	BroadT	BRD-K09071517	BRD-K09071517-001-01-1	Broad Institute of MIT and Harvard	BRD-K09071517			COc1cccc(NC(=O)N[C@H]2CC[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@@H]2CO)c1	InChI=1S/C28H31N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-13,16,24-26,32H,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26-/m1/s1	LTCMWRCKDZHFDM-UODIDJSMSA-N	489.226371122							118910
BRD-K07276022	LSM-30360		54641025	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14+,15-/m0/s1	MDKMCQYBVAECJP-ZNMIVQPWSA-N	NCC[C@@H]1CC[C@@H](NS(=O)(=O)Cc2ccccc2)[C@H](CO)O1	BroadT	BRD-K07276022	BRD-K07276022-001-01-6	Broad Institute of MIT and Harvard	BRD-K07276022			NCC[C@@H]1CC[C@@H](NS(=O)(=O)Cc2ccccc2)[C@H](CO)O1	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14+,15-/m0/s1	MDKMCQYBVAECJP-ZNMIVQPWSA-N	328.145677958							118911
BRD-K36644177	LSM-30361		54641014	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15+/m0/s1	LJGUQBBKFZFLJA-SOUVJXGZSA-N	CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	BroadT	BRD-K36644177	BRD-K36644177-001-01-3	Broad Institute of MIT and Harvard	BRD-K36644177			CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15+/m0/s1	LJGUQBBKFZFLJA-SOUVJXGZSA-N	356.242355544							118912
BRD-K11630986	LSM-30362		54640944	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15-,16+/m0/s1	IVJDFQRYYIVNGV-HRCADAONSA-N	CCC(=O)N[C@H]1CC[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@@H]1CO	BroadT	BRD-K11630986	BRD-K11630986-001-01-2	Broad Institute of MIT and Harvard	BRD-K11630986			CCC(=O)N[C@H]1CC[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@@H]1CO	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15-,16+/m0/s1	IVJDFQRYYIVNGV-HRCADAONSA-N	417.187540942							118913
BRD-K75900952	LSM-30363		54640817	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20-,22+/m1/s1	WUPYLLMMUFNJPD-ZNLUXHQJSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3ccccc3F)CC[C@H]1NC(=O)Cc4ccncc4	BroadT	BRD-K75900952	BRD-K75900952-001-01-2	Broad Institute of MIT and Harvard	BRD-K75900952			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2F)CC[C@H]1NC(=O)Cc1ccncc1	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20-,22+/m1/s1	WUPYLLMMUFNJPD-ZNLUXHQJSA-N	439.201967942							118914
BRD-K69274755	LSM-30364		54640899	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17-,18+/m1/s1	WYLNQZCZILOHII-KURKYZTESA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K69274755	BRD-K69274755-001-01-9	Broad Institute of MIT and Harvard	BRD-K69274755			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17-,18+/m1/s1	WYLNQZCZILOHII-KURKYZTESA-N	441.187540942							118915
BRD-K31992830	LSM-30365		54641007	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16+/m1/s1	BTLHSRCDNJLGMU-OAGGEKHMSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NC(=O)Nc2c(C)onc2C)[C@H](CO)O1	BroadT	BRD-K31992830	BRD-K31992830-001-01-0	Broad Institute of MIT and Harvard	BRD-K31992830			CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NC(=O)Nc2c(C)noc2C)[C@H](CO)O1	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16+/m1/s1	BTLHSRCDNJLGMU-OAGGEKHMSA-N	411.248169206							118916
BRD-K39649774	LSM-30366		54640820	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20+,22-/m1/s1	WUPYLLMMUFNJPD-PIPMEXSNSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3ccccc3F)CC[C@@H]1NC(=O)Cc4ccncc4	BroadT	BRD-K39649774	BRD-K39649774-001-01-6	Broad Institute of MIT and Harvard	BRD-K39649774			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2F)CC[C@@H]1NC(=O)Cc1ccncc1	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20+,22-/m1/s1	WUPYLLMMUFNJPD-PIPMEXSNSA-N	439.201967942							118917
BRD-K98087319	LSM-30367		54640942	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15-,16-/m1/s1	IVJDFQRYYIVNGV-BZUAXINKSA-N	CCC(=O)N[C@@H]1CC[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@@H]1CO	BroadT	BRD-K98087319	BRD-K98087319-001-01-9	Broad Institute of MIT and Harvard	BRD-K98087319			CCC(=O)N[C@@H]1CC[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@@H]1CO	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15-,16-/m1/s1	IVJDFQRYYIVNGV-BZUAXINKSA-N	417.187540942							118918
BRD-K43535770	LSM-30368		54640778	InChI=1S/C28H35N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-14,24-26,32H,2,5-6,15-20H2,(H,29,34)(H,30,33)/t24-,25-,26+/m1/s1	UFNCHKMEJBOGRV-CYXNTTPDSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K43535770	BRD-K43535770-001-01-5	Broad Institute of MIT and Harvard	BRD-K43535770			OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H35N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-14,24-26,32H,2,5-6,15-20H2,(H,29,34)(H,30,33)/t24-,25-,26+/m1/s1	UFNCHKMEJBOGRV-CYXNTTPDSA-N	477.26275663							118919
BRD-K04513994	LSM-30369		54640794	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17-,18+/m1/s1	KPQAGDNSAAOMGS-KURKYZTESA-N	CN1CCN(CC1)C(=O)C[C@@H]2O[C@@H](CO)[C@H](NC(=O)Cc3ccccn3)C=C2	BroadT	BRD-K04513994	BRD-K04513994-001-01-9	Broad Institute of MIT and Harvard	BRD-K04513994			CN1CCN(CC1)C(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17-,18+/m1/s1	KPQAGDNSAAOMGS-KURKYZTESA-N	388.211055416							118920
BRD-K35336753	LSM-30370		54640853	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19+,20-/m1/s1	KCRDNBZRFZAOKR-HSALFYBXSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K35336753	BRD-K35336753-001-01-9	Broad Institute of MIT and Harvard	BRD-K35336753			OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19+,20-/m1/s1	KCRDNBZRFZAOKR-HSALFYBXSA-N	465.12221173							118921
BRD-K89366259	LSM-30371		54640997	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20+,21-/m1/s1	DVSDZAFRLPIFCS-HLAWJBBLSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CCNC(=O)C3CCCCC3)O[C@@H]2CO	BroadT	BRD-K89366259	BRD-K89366259-001-01-0	Broad Institute of MIT and Harvard	BRD-K89366259			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCNC(=O)C2CCCCC2)O[C@@H]1CO	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20+,21-/m1/s1	DVSDZAFRLPIFCS-HLAWJBBLSA-N	438.218842898							118922
BRD-K03861440	LSM-30372		54641005	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16-/m0/s1	BTLHSRCDNJLGMU-JYJNAYRXSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NC(=O)Nc2c(C)onc2C)[C@H](CO)O1	BroadT	BRD-K03861440	BRD-K03861440-001-01-3	Broad Institute of MIT and Harvard	BRD-K03861440			CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NC(=O)Nc2c(C)noc2C)[C@H](CO)O1	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16-/m0/s1	BTLHSRCDNJLGMU-JYJNAYRXSA-N	411.248169206							118923
BRD-K97748753	LSM-30373		54641054	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18-,19+/m1/s1	RDGNRWNQTDLRBG-LZQZEXGQSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NC(=O)c4ccccc4F	BroadT	BRD-K97748753	BRD-K97748753-001-01-0	Broad Institute of MIT and Harvard	BRD-K97748753			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18-,19+/m1/s1	RDGNRWNQTDLRBG-LZQZEXGQSA-N	432.217283648							118924
BRD-K95192796	LSM-30374		54640973	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18-,19-/m0/s1	ZGRBCZVMEMXSST-WDSOQIARSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K95192796	BRD-K95192796-001-01-2	Broad Institute of MIT and Harvard	BRD-K95192796			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)c1ccncc1	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18-,19-/m0/s1	ZGRBCZVMEMXSST-WDSOQIARSA-N	453.112519298							118925
BRD-K75584297	LSM-30375		54640907	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24+,25-/m1/s1	HQJSXCNUPDQHFZ-DSNGMDLFSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)c4ccccc4	BroadT	BRD-K75584297	BRD-K75584297-001-01-8	Broad Institute of MIT and Harvard	BRD-K75584297			OC[C@H]1O[C@H](CC[C@@H]1NC(=O)c1ccccc1)CC(=O)Nc1ccc(cc1)-c1ccccc1	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24+,25-/m1/s1	HQJSXCNUPDQHFZ-DSNGMDLFSA-N	444.204907396							118926
BRD-K25138450	LSM-30376		54640810	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23+,24-/m1/s1	RLBPWNWBWPNMOA-TZRRMPRUSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)CC4CC4	BroadT	BRD-K25138450	BRD-K25138450-001-01-7	Broad Institute of MIT and Harvard	BRD-K25138450			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)CC1CC1	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23+,24-/m1/s1	RLBPWNWBWPNMOA-TZRRMPRUSA-N	434.22055746							118927
BRD-K35756640	LSM-30377		54640936	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13+,14-/m1/s1	BRLNHSCHDPURAU-KWCYVHTRSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)O)O[C@@H]2CO	BroadT	BRD-K35756640	BRD-K35756640-001-01-5	Broad Institute of MIT and Harvard	BRD-K35756640			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CC(O)=O)O[C@@H]1CO	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13+,14-/m1/s1	BRLNHSCHDPURAU-KWCYVHTRSA-N	343.108958092							118928
BRD-K07979116	LSM-30378		54640795	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17+,18-/m1/s1	KPQAGDNSAAOMGS-FGTMMUONSA-N	CN1CCN(CC1)C(=O)C[C@@H]2O[C@H](CO)[C@@H](NC(=O)Cc3ccccn3)C=C2	BroadT	BRD-K07979116	BRD-K07979116-001-01-2	Broad Institute of MIT and Harvard	BRD-K07979116			CN1CCN(CC1)C(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17+,18-/m1/s1	KPQAGDNSAAOMGS-FGTMMUONSA-N	388.211055416							118929
BRD-K79322550	LSM-30379		54640742	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23-/m0/s1	PFEWRFQNGBURGF-VABKMULXSA-N	Cc1onc(C)c1NC(=O)N[C@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K79322550	BRD-K79322550-001-01-1	Broad Institute of MIT and Harvard	BRD-K79322550			Cc1noc(C)c1NC(=O)N[C@H]1C=C[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23-/m0/s1	PFEWRFQNGBURGF-VABKMULXSA-N	476.205970036							118930
BRD-K63921431	LSM-30380		54641042	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15+,16-/m0/s1	DMROSRCUXVWXJU-XHSDSOJGSA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	BroadT	BRD-K63921431	BRD-K63921431-001-01-3	Broad Institute of MIT and Harvard	BRD-K63921431			CC(C)NC(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15+,16-/m0/s1	DMROSRCUXVWXJU-XHSDSOJGSA-N	371.242021186							118931
BRD-K23589316	LSM-30381		54640949	InChI=1S/C22H28N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,19-21,24-25H,2,12-15H2,1H3,(H,23,26)/t19-,20-,21+/m0/s1	DNFBTYFNFJSDKD-PCCBWWKXSA-N	CCS(=O)(=O)N[C@H]1CC[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)O[C@@H]1CO	BroadT	BRD-K23589316	BRD-K23589316-001-01-7	Broad Institute of MIT and Harvard	BRD-K23589316			CCS(=O)(=O)N[C@H]1CC[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C22H28N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,19-21,24-25H,2,12-15H2,1H3,(H,23,26)/t19-,20-,21+/m0/s1	DNFBTYFNFJSDKD-PCCBWWKXSA-N	432.171892706							118932
BRD-K47511177	LSM-30382		54641020	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14-,15-/m1/s1	MDKMCQYBVAECJP-RBSFLKMASA-N	NCC[C@H]1CC[C@@H](NS(=O)(=O)Cc2ccccc2)[C@@H](CO)O1	BroadT	BRD-K47511177	BRD-K47511177-001-01-1	Broad Institute of MIT and Harvard	BRD-K47511177			NCC[C@H]1CC[C@@H](NS(=O)(=O)Cc2ccccc2)[C@@H](CO)O1	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14-,15-/m1/s1	MDKMCQYBVAECJP-RBSFLKMASA-N	328.145677958							118933
BRD-K06332513	LSM-30383		54640959	InChI=1S/C19H24FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-6,15-17,24H,7-12H2,(H2,21,22,26)/t15-,16-,17-/m1/s1	TXBZUYXXZRGZTP-BRWVUGGUSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K06332513	BRD-K06332513-001-01-4	Broad Institute of MIT and Harvard	BRD-K06332513			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C19H24FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-6,15-17,24H,7-12H2,(H2,21,22,26)/t15-,16-,17-/m1/s1	TXBZUYXXZRGZTP-BRWVUGGUSA-N	393.169999098							118934
BRD-K69521416	LSM-30384		54640966	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21-/m1/s1	KEJHSICNFQEVJK-DPDLHNOKSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K69521416	BRD-K69521416-001-01-4	Broad Institute of MIT and Harvard	BRD-K69521416			C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21-/m1/s1	KEJHSICNFQEVJK-DPDLHNOKSA-N	448.14682081							118935
BRD-K30977850	LSM-30385		54640805	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23+,24+/m0/s1	RLBPWNWBWPNMOA-RBZQAINGSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)CC4CC4	BroadT	BRD-K30977850	BRD-K30977850-001-01-7	Broad Institute of MIT and Harvard	BRD-K30977850			OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)CC1CC1	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23+,24+/m0/s1	RLBPWNWBWPNMOA-RBZQAINGSA-N	434.22055746							118936
BRD-K09895564	LSM-30386		54640987	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21+/m1/s1	YNMAXJORQBUKHH-OTNPHJDUSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K09895564	BRD-K09895564-001-01-5	Broad Institute of MIT and Harvard	BRD-K09895564			C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21+/m1/s1	YNMAXJORQBUKHH-OTNPHJDUSA-N	411.215806438							118937
BRD-K36544054	LSM-30387		54641053	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18-,19-/m1/s1	RDGNRWNQTDLRBG-ATZDWAIDSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NC(=O)c4ccccc4F	BroadT	BRD-K36544054	BRD-K36544054-001-01-3	Broad Institute of MIT and Harvard	BRD-K36544054			OC[C@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18-,19-/m1/s1	RDGNRWNQTDLRBG-ATZDWAIDSA-N	432.217283648							118938
BRD-K85527716	LSM-30388		54640842	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19+/m1/s1	AQOAQYOOWGGKER-MNEFBYGVSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K85527716	BRD-K85527716-001-01-8	Broad Institute of MIT and Harvard	BRD-K85527716			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19+/m1/s1	AQOAQYOOWGGKER-MNEFBYGVSA-N	451.106561666							118939
BRD-K65464642	LSM-30389		54641052	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18+,19+/m1/s1	RDGNRWNQTDLRBG-MNEFBYGVSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NC(=O)c4ccccc4F	BroadT	BRD-K65464642	BRD-K65464642-001-01-7	Broad Institute of MIT and Harvard	BRD-K65464642			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18+,19+/m1/s1	RDGNRWNQTDLRBG-MNEFBYGVSA-N	432.217283648							118940
BRD-K66954388	LSM-30390		54640790	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17+,18+/m1/s1	KPQAGDNSAAOMGS-SQNIBIBYSA-N	CN1CCN(CC1)C(=O)C[C@@H]2O[C@@H](CO)[C@@H](NC(=O)Cc3ccccn3)C=C2	BroadT	BRD-K66954388	BRD-K66954388-001-01-4	Broad Institute of MIT and Harvard	BRD-K66954388			CN1CCN(CC1)C(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17+,18+/m1/s1	KPQAGDNSAAOMGS-SQNIBIBYSA-N	388.211055416							118941
BRD-K61709556	LSM-30391		54640863	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18-,19+/m1/s1	ZJAQJJRCHWWGEL-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K61709556	BRD-K61709556-001-01-3	Broad Institute of MIT and Harvard	BRD-K61709556			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18-,19+/m1/s1	ZJAQJJRCHWWGEL-QRVBRYPASA-N	420.237270164							118942
CHEMBL2359876	LSM-30392	BRD-K22390389, SID131437294	54640982	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21+/m0/s1	YNMAXJORQBUKHH-LLUDDFSJSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K22390389	BRD-K22390389-001-01-3	Broad Institute of MIT and Harvard	BRD-K22390389			C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21+/m0/s1	YNMAXJORQBUKHH-LLUDDFSJSA-N	411.215806438							118943
BRD-K78196882	LSM-30393		54640980	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21+/m1/s1	YNMAXJORQBUKHH-DBOLQNLKSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K78196882	BRD-K78196882-001-01-9	Broad Institute of MIT and Harvard	BRD-K78196882			C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21+/m1/s1	YNMAXJORQBUKHH-DBOLQNLKSA-N	411.215806438							118944
BRD-K35230457	LSM-30394		54640813	InChI=1S/C13H24N4O2/c1-9(2)12-7-17(16-15-12)6-5-10-3-4-11(14)13(8-18)19-10/h7,9-11,13,18H,3-6,8,14H2,1-2H3/t10-,11+,13-/m1/s1	AIKIVRCBRFVMON-NTZNESFSSA-N	CC(C)c1cn(CC[C@H]2CC[C@H](N)[C@@H](CO)O2)nn1	BroadT	BRD-K35230457	BRD-K35230457-001-01-3	Broad Institute of MIT and Harvard	BRD-K35230457			CC(C)c1cn(CC[C@H]2CC[C@H](N)[C@@H](CO)O2)nn1	InChI=1S/C13H24N4O2/c1-9(2)12-7-17(16-15-12)6-5-10-3-4-11(14)13(8-18)19-10/h7,9-11,13,18H,3-6,8,14H2,1-2H3/t10-,11+,13-/m1/s1	AIKIVRCBRFVMON-NTZNESFSSA-N	268.189926048							118945
BRD-K83708664	LSM-30395		54640992	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21-/m0/s1	YNMAXJORQBUKHH-DVWBAYGPSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K83708664	BRD-K83708664-001-01-8	Broad Institute of MIT and Harvard	BRD-K83708664			C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21-/m0/s1	YNMAXJORQBUKHH-DVWBAYGPSA-N	411.215806438							118946
BRD-K19527338	LSM-30396		54640749	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19-/m1/s1	SLCLMSLRMDGYCU-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K19527338	BRD-K19527338-001-01-7	Broad Institute of MIT and Harvard	BRD-K19527338			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19-/m1/s1	SLCLMSLRMDGYCU-GUDVDZBRSA-N	472.229740112							118947
BRD-K34531548	LSM-30397		54640796	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17+,18-/m0/s1	KPQAGDNSAAOMGS-KSZLIROESA-N	CN1CCN(CC1)C(=O)C[C@H]2O[C@@H](CO)[C@H](NC(=O)Cc3ccccn3)C=C2	BroadT	BRD-K34531548	BRD-K34531548-001-01-6	Broad Institute of MIT and Harvard	BRD-K34531548			CN1CCN(CC1)C(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17+,18-/m0/s1	KPQAGDNSAAOMGS-KSZLIROESA-N	388.211055416							118948
BRD-K79816111	LSM-30398		54640741	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23+/m1/s1	PFEWRFQNGBURGF-VJBWXMMDSA-N	Cc1onc(C)c1NC(=O)N[C@H]2C=C[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K79816111	BRD-K79816111-001-01-4	Broad Institute of MIT and Harvard	BRD-K79816111			Cc1noc(C)c1NC(=O)N[C@H]1C=C[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23+/m1/s1	PFEWRFQNGBURGF-VJBWXMMDSA-N	476.205970036							118949
BRD-K97256018	LSM-30399		54641011	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15+/m1/s1	LJGUQBBKFZFLJA-ILXRZTDVSA-N	CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)NCCCN(C)C)O[C@H]1CO	BroadT	BRD-K97256018	BRD-K97256018-001-01-5	Broad Institute of MIT and Harvard	BRD-K97256018			CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)NCCCN(C)C)O[C@H]1CO	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15+/m1/s1	LJGUQBBKFZFLJA-ILXRZTDVSA-N	356.242355544							118950
BRD-K93186184	LSM-30400		54641055	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18-,19-/m0/s1	RDGNRWNQTDLRBG-SNRMKQJTSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NC(=O)c4ccccc4F	BroadT	BRD-K93186184	BRD-K93186184-001-01-6	Broad Institute of MIT and Harvard	BRD-K93186184			OC[C@@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18-,19-/m0/s1	RDGNRWNQTDLRBG-SNRMKQJTSA-N	432.217283648							118951
BRD-K76518272	LSM-30401		54640882	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18+/m1/s1	MINIXHYBIVPWCS-HFTRVMKXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K76518272	BRD-K76518272-001-01-4	Broad Institute of MIT and Harvard	BRD-K76518272			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18+/m1/s1	MINIXHYBIVPWCS-HFTRVMKXSA-N	402.170333456							118952
BRD-K08514109	LSM-30402		54640866	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22+,23+/m0/s1	RXWWLGBTGKBRLQ-MDNUFGMLSA-N	OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K08514109	BRD-K08514109-001-01-5	Broad Institute of MIT and Harvard	BRD-K08514109			OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22+,23+/m0/s1	RXWWLGBTGKBRLQ-MDNUFGMLSA-N	489.173369916							118953
BRD-K37544873	LSM-30403		54640891	InChI=1S/C24H26N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,14,16,20-22,27,29H,13,15H2,1H3,(H,26,30)/t20-,21-,22-/m1/s1	RYZOUXVVIYMMJY-YPAWHYETSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K37544873	BRD-K37544873-001-01-1	Broad Institute of MIT and Harvard	BRD-K37544873			Cn1cnc(c1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C24H26N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,14,16,20-22,27,29H,13,15H2,1H3,(H,26,30)/t20-,21-,22-/m1/s1	RYZOUXVVIYMMJY-YPAWHYETSA-N	482.162390662							118954
BRD-K69914820	LSM-30404		54640825	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15-,16+/m1/s1	CAIOSQFPDHZSIB-OAGGEKHMSA-N	COCc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3c(C)onc3C)[C@H](CO)O2)nn1	BroadT	BRD-K69914820	BRD-K69914820-001-01-1	Broad Institute of MIT and Harvard	BRD-K69914820			COCc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3c(C)noc3C)[C@H](CO)O2)nn1	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15-,16+/m1/s1	CAIOSQFPDHZSIB-OAGGEKHMSA-N	408.212118056							118955
BRD-K55584718	LSM-30405		54640890	InChI=1S/C24H26N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,14,16,20-22,27,29H,13,15H2,1H3,(H,26,30)/t20-,21+,22+/m1/s1	RYZOUXVVIYMMJY-FSSWDIPSSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K55584718	BRD-K55584718-001-01-3	Broad Institute of MIT and Harvard	BRD-K55584718			Cn1cnc(c1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C24H26N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,14,16,20-22,27,29H,13,15H2,1H3,(H,26,30)/t20-,21+,22+/m1/s1	RYZOUXVVIYMMJY-FSSWDIPSSA-N	482.162390662							118956
BRD-K42108985	LSM-30406		54640855	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19-,20-/m0/s1	KCRDNBZRFZAOKR-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K42108985	BRD-K42108985-001-01-3	Broad Institute of MIT and Harvard	BRD-K42108985			OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19-,20-/m0/s1	KCRDNBZRFZAOKR-UFYCRDLUSA-N	465.12221173							118957
BRD-K82105033	LSM-30407		54640995	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20-,21+/m0/s1	DVSDZAFRLPIFCS-SESVDKBCSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CCNC(=O)C3CCCCC3)O[C@@H]2CO	BroadT	BRD-K82105033	BRD-K82105033-001-01-2	Broad Institute of MIT and Harvard	BRD-K82105033			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CCCCC2)O[C@@H]1CO	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20-,21+/m0/s1	DVSDZAFRLPIFCS-SESVDKBCSA-N	438.218842898							118958
BRD-K54934070	LSM-30408		54640870	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22-,23+/m0/s1	RXWWLGBTGKBRLQ-ACIOBRDBSA-N	OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K54934070	BRD-K54934070-001-01-3	Broad Institute of MIT and Harvard	BRD-K54934070			OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22-,23+/m0/s1	RXWWLGBTGKBRLQ-ACIOBRDBSA-N	489.173369916							118959
BRD-K67609710	LSM-30409		54640803	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18-,19+/m0/s1	GHLUFTIHFDMMKJ-GBESFXJTSA-N	CCCc1cn(CC[C@@H]2CC[C@H](NC(=O)C3CCCCC3)[C@@H](CO)O2)nn1	BroadT	BRD-K67609710	BRD-K67609710-001-01-2	Broad Institute of MIT and Harvard	BRD-K67609710			CCCc1cn(CC[C@@H]2CC[C@H](NC(=O)C3CCCCC3)[C@@H](CO)O2)nn1	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18-,19+/m0/s1	GHLUFTIHFDMMKJ-GBESFXJTSA-N	378.263090988							118960
BRD-K92513859	LSM-30410		54640913	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18+/m0/s1	UMDIUEAUIUREDG-OKZBNKHCSA-N	CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	BroadT	BRD-K92513859	BRD-K92513859-001-01-6	Broad Institute of MIT and Harvard	BRD-K92513859			CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18+/m0/s1	UMDIUEAUIUREDG-OKZBNKHCSA-N	377.231456502							118961
BRD-K44664883	LSM-30411		54640975	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18+,19-/m1/s1	ZGRBCZVMEMXSST-NZSAHSFTSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K44664883	BRD-K44664883-001-01-6	Broad Institute of MIT and Harvard	BRD-K44664883			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)c1ccncc1	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18+,19-/m1/s1	ZGRBCZVMEMXSST-NZSAHSFTSA-N	453.112519298							118962
BRD-K97777287	LSM-30412		54640909	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18+/m0/s1	UMDIUEAUIUREDG-RCCFBDPRSA-N	CCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	BroadT	BRD-K97777287	BRD-K97777287-001-01-4	Broad Institute of MIT and Harvard	BRD-K97777287			CCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18+/m0/s1	UMDIUEAUIUREDG-RCCFBDPRSA-N	377.231456502							118963
BRD-K97241181	LSM-30413		54640762	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18-/m1/s1	DTKWTAJBQNGVNM-KZNAEPCWSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Cc2cccnc2)C=C1	BroadT	BRD-K97241181	BRD-K97241181-001-01-8	Broad Institute of MIT and Harvard	BRD-K97241181			CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Cc2cccnc2)C=C1	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18-/m1/s1	DTKWTAJBQNGVNM-KZNAEPCWSA-N	390.22670548							118964
BRD-K05057860	LSM-30414		54640976	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18+,19-/m0/s1	ZGRBCZVMEMXSST-UHOSZYNNSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K05057860	BRD-K05057860-001-01-7	Broad Institute of MIT and Harvard	BRD-K05057860			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18+,19-/m0/s1	ZGRBCZVMEMXSST-UHOSZYNNSA-N	453.112519298							118965
BRD-K99697617-001-01-3	LSM-30415	BRD-K99697617	54640804	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18+,19-/m0/s1	GHLUFTIHFDMMKJ-OTWHNJEPSA-N	CCCc1cn(CC[C@@H]2CC[C@@H](NC(=O)C3CCCCC3)[C@H](CO)O2)nn1	BroadT	BRD-K99697617	BRD-K99697617-001-01-3	Broad Institute of MIT and Harvard	BRD-K99697617			CCCc1cn(CC[C@@H]2CC[C@@H](NC(=O)C3CCCCC3)[C@H](CO)O2)nn1	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18+,19-/m0/s1	GHLUFTIHFDMMKJ-OTWHNJEPSA-N	378.263090988							118966
BRD-K37269981	LSM-30416		54640812	InChI=1S/C13H24N4O2/c1-9(2)12-7-17(16-15-12)6-5-10-3-4-11(14)13(8-18)19-10/h7,9-11,13,18H,3-6,8,14H2,1-2H3/t10-,11-,13+/m0/s1	AIKIVRCBRFVMON-GMXVVIOVSA-N	CC(C)c1cn(CC[C@@H]2CC[C@H](N)[C@@H](CO)O2)nn1	BroadT	BRD-K37269981	BRD-K37269981-001-01-4	Broad Institute of MIT and Harvard	BRD-K37269981			CC(C)c1cn(CC[C@@H]2CC[C@H](N)[C@@H](CO)O2)nn1	InChI=1S/C13H24N4O2/c1-9(2)12-7-17(16-15-12)6-5-10-3-4-11(14)13(8-18)19-10/h7,9-11,13,18H,3-6,8,14H2,1-2H3/t10-,11-,13+/m0/s1	AIKIVRCBRFVMON-GMXVVIOVSA-N	268.189926048							118967
BRD-K47801291	LSM-30417		54641003	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16+/m0/s1	BTLHSRCDNJLGMU-ARFHVFGLSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2c(C)onc2C)[C@@H](CO)O1	BroadT	BRD-K47801291	BRD-K47801291-001-01-7	Broad Institute of MIT and Harvard	BRD-K47801291			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2c(C)noc2C)[C@@H](CO)O1	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16+/m0/s1	BTLHSRCDNJLGMU-ARFHVFGLSA-N	411.248169206							118968
BRD-K71139459	LSM-30418		54640872	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22+,23-/m1/s1	RXWWLGBTGKBRLQ-AKIFATBCSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K71139459	BRD-K71139459-001-01-9	Broad Institute of MIT and Harvard	BRD-K71139459			OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22+,23-/m1/s1	RXWWLGBTGKBRLQ-AKIFATBCSA-N	489.173369916							118969
BRD-K79264000	LSM-30419		54641023	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14-,15+/m0/s1	MDKMCQYBVAECJP-SOUVJXGZSA-N	NCC[C@@H]1CC[C@H](NS(=O)(=O)Cc2ccccc2)[C@@H](CO)O1	BroadT	BRD-K79264000	BRD-K79264000-001-01-1	Broad Institute of MIT and Harvard	BRD-K79264000			NCC[C@@H]1CC[C@H](NS(=O)(=O)Cc2ccccc2)[C@@H](CO)O1	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14-,15+/m0/s1	MDKMCQYBVAECJP-SOUVJXGZSA-N	328.145677958							118970
BRD-K77482327-001-01-7	LSM-30420	BRD-K77482327	54640984	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21+/m1/s1	YNMAXJORQBUKHH-SEVLPDGMSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K77482327	BRD-K77482327-001-01-7	Broad Institute of MIT and Harvard	BRD-K77482327			C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21+/m1/s1	YNMAXJORQBUKHH-SEVLPDGMSA-N	411.215806438							118971
BRD-K98140933	LSM-30421		54640837	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18-,20+/m1/s1	RRAIEYROWAKKHB-GGPKGHCWSA-N	CC(C)c1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)Cc3ccccc3)[C@H](CO)O2)nn1	BroadT	BRD-K98140933	BRD-K98140933-001-01-2	Broad Institute of MIT and Harvard	BRD-K98140933			CC(C)c1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)Cc3ccccc3)[C@H](CO)O2)nn1	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18-,20+/m1/s1	RRAIEYROWAKKHB-GGPKGHCWSA-N	422.19877617							118972
BRD-K95350313	LSM-30422		54640857	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19+,20-/m0/s1	KCRDNBZRFZAOKR-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K95350313	BRD-K95350313-001-01-0	Broad Institute of MIT and Harvard	BRD-K95350313			OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19+,20-/m0/s1	KCRDNBZRFZAOKR-ZCNNSNEGSA-N	465.12221173							118973
BRD-K74826740	LSM-30423		54640807	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23-,24-/m0/s1	RLBPWNWBWPNMOA-HJOGWXRNSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)CC4CC4	BroadT	BRD-K74826740	BRD-K74826740-001-01-7	Broad Institute of MIT and Harvard	BRD-K74826740			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)CC1CC1	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23-,24-/m0/s1	RLBPWNWBWPNMOA-HJOGWXRNSA-N	434.22055746							118974
BRD-K33760911	LSM-30424		54641057	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18+,19-/m1/s1	RDGNRWNQTDLRBG-AYOQOUSVSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NC(=O)c4ccccc4F	BroadT	BRD-K33760911	BRD-K33760911-001-01-1	Broad Institute of MIT and Harvard	BRD-K33760911			OC[C@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18+,19-/m1/s1	RDGNRWNQTDLRBG-AYOQOUSVSA-N	432.217283648							118975
BRD-K32710535	LSM-30425		54640940	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15-,16+/m1/s1	IVJDFQRYYIVNGV-OAGGEKHMSA-N	CCC(=O)N[C@@H]1CC[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@H]1CO	BroadT	BRD-K32710535	BRD-K32710535-001-01-3	Broad Institute of MIT and Harvard	BRD-K32710535			CCC(=O)N[C@@H]1CC[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@H]1CO	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15-,16+/m1/s1	IVJDFQRYYIVNGV-OAGGEKHMSA-N	417.187540942							118976
BRD-K04508260	LSM-30426		54640834	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18+,20+/m0/s1	RRAIEYROWAKKHB-NLWGTHIKSA-N	CC(C)c1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)Cc3ccccc3)[C@@H](CO)O2)nn1	BroadT	BRD-K04508260	BRD-K04508260-001-01-6	Broad Institute of MIT and Harvard	BRD-K04508260			CC(C)c1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)Cc3ccccc3)[C@@H](CO)O2)nn1	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18+,20+/m0/s1	RRAIEYROWAKKHB-NLWGTHIKSA-N	422.19877617							118977
BRD-K49325049	LSM-30427		54640769	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20-,23-/m1/s1	KTXYXNLRJUMWJA-TXTKFYIRSA-N	OC[C@H]1O[C@@H](CC(=O)NC2Cc3ccccc3C2)CC[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K49325049	BRD-K49325049-001-01-0	Broad Institute of MIT and Harvard	BRD-K49325049			OC[C@H]1O[C@@H](CC(=O)NC2Cc3ccccc3C2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20-,23-/m1/s1	KTXYXNLRJUMWJA-TXTKFYIRSA-N	452.194736636							118978
BRD-K73899643	LSM-30428		54640886	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18+/m1/s1	MINIXHYBIVPWCS-KYJSFNMBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K73899643	BRD-K73899643-001-01-3	Broad Institute of MIT and Harvard	BRD-K73899643			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18+/m1/s1	MINIXHYBIVPWCS-KYJSFNMBSA-N	402.170333456							118979
BRD-K98465548	LSM-30429		54640884	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18-/m0/s1	MINIXHYBIVPWCS-ZVZYQTTQSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K98465548	BRD-K98465548-001-01-0	Broad Institute of MIT and Harvard	BRD-K98465548			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18-/m0/s1	MINIXHYBIVPWCS-ZVZYQTTQSA-N	402.170333456							118980
BRD-K42814713	LSM-30430		54640840	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18+,20-/m1/s1	RRAIEYROWAKKHB-WSTZPKSXSA-N	CC(C)c1cn(CC[C@H]2CC[C@H](NS(=O)(=O)Cc3ccccc3)[C@@H](CO)O2)nn1	BroadT	BRD-K42814713	BRD-K42814713-001-01-5	Broad Institute of MIT and Harvard	BRD-K42814713			CC(C)c1cn(CC[C@H]2CC[C@H](NS(=O)(=O)Cc3ccccc3)[C@@H](CO)O2)nn1	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18+,20-/m1/s1	RRAIEYROWAKKHB-WSTZPKSXSA-N	422.19877617							118981
BRD-K61052964	LSM-30431		54640835	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18+,20+/m1/s1	RRAIEYROWAKKHB-HBFSDRIKSA-N	CC(C)c1cn(CC[C@H]2CC[C@H](NS(=O)(=O)Cc3ccccc3)[C@H](CO)O2)nn1	BroadT	BRD-K61052964	BRD-K61052964-001-01-4	Broad Institute of MIT and Harvard	BRD-K61052964			CC(C)c1cn(CC[C@H]2CC[C@H](NS(=O)(=O)Cc3ccccc3)[C@H](CO)O2)nn1	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18+,20+/m1/s1	RRAIEYROWAKKHB-HBFSDRIKSA-N	422.19877617							118982
BRD-K26079895	LSM-30432		54640911	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18-/m1/s1	UMDIUEAUIUREDG-KZNAEPCWSA-N	CCCNC(=O)N[C@@H]1CC[C@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	BroadT	BRD-K26079895	BRD-K26079895-001-01-5	Broad Institute of MIT and Harvard	BRD-K26079895			CCCNC(=O)N[C@@H]1CC[C@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18-/m1/s1	UMDIUEAUIUREDG-KZNAEPCWSA-N	377.231456502							118983
BRD-K28467592	LSM-30433		54641050	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18+,21-/m0/s1	DNUVWNCDCIVCLB-KLHJMIIUSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NC(=O)c4ccccc4F	BroadT	BRD-K28467592	BRD-K28467592-001-01-6	Broad Institute of MIT and Harvard	BRD-K28467592			OC[C@@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18+,21-/m0/s1	DNUVWNCDCIVCLB-KLHJMIIUSA-N	444.16966474							118984
BRD-K33462260	LSM-30434		54640961	InChI=1S/C19H24FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-6,15-17,24H,7-12H2,(H2,21,22,26)/t15-,16-,17-/m0/s1	TXBZUYXXZRGZTP-ULQDDVLXSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K33462260	BRD-K33462260-001-01-1	Broad Institute of MIT and Harvard	BRD-K33462260			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C19H24FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-6,15-17,24H,7-12H2,(H2,21,22,26)/t15-,16-,17-/m0/s1	TXBZUYXXZRGZTP-ULQDDVLXSA-N	393.169999098							118985
BRD-K10812033	LSM-30435		54640921	InChI=1S/C19H28N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h4-5,7,11,14-16,24H,1-3,6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16-/m1/s1	DDEXDZVSNNOFMF-OWCLPIDISA-N	OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K10812033	BRD-K10812033-001-01-0	Broad Institute of MIT and Harvard	BRD-K10812033			OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C19H28N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h4-5,7,11,14-16,24H,1-3,6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16-/m1/s1	DDEXDZVSNNOFMF-OWCLPIDISA-N	408.183126106							118986
BRD-K95160020	LSM-30436		54640792	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17-,18-/m0/s1	KPQAGDNSAAOMGS-BZSNNMDCSA-N	CN1CCN(CC1)C(=O)C[C@H]2O[C@@H](CO)[C@@H](NC(=O)Cc3ccccn3)C=C2	BroadT	BRD-K95160020	BRD-K95160020-001-01-7	Broad Institute of MIT and Harvard	BRD-K95160020			CN1CCN(CC1)C(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17-,18-/m0/s1	KPQAGDNSAAOMGS-BZSNNMDCSA-N	388.211055416							118987
BRD-K04495110	LSM-30437		54640819	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20-,22+/m0/s1	WUPYLLMMUFNJPD-RBDMOPTHSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3ccccc3F)CC[C@@H]1NC(=O)Cc4ccncc4	BroadT	BRD-K04495110	BRD-K04495110-001-01-8	Broad Institute of MIT and Harvard	BRD-K04495110			OC[C@H]1O[C@H](CCn2cc(nn2)-c2ccccc2F)CC[C@@H]1NC(=O)Cc1ccncc1	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20-,22+/m0/s1	WUPYLLMMUFNJPD-RBDMOPTHSA-N	439.201967942							118988
BRD-K75041300	LSM-30438		54640802	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18-,19-/m0/s1	GHLUFTIHFDMMKJ-FHWLQOOXSA-N	CCCc1cn(CC[C@@H]2CC[C@H](NC(=O)C3CCCCC3)[C@H](CO)O2)nn1	BroadT	BRD-K75041300	BRD-K75041300-001-01-4	Broad Institute of MIT and Harvard	BRD-K75041300			CCCc1cn(CC[C@@H]2CC[C@H](NC(=O)C3CCCCC3)[C@H](CO)O2)nn1	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18-,19-/m0/s1	GHLUFTIHFDMMKJ-FHWLQOOXSA-N	378.263090988							118989
BRD-K52613522	LSM-30439		54640862	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18-,19+/m0/s1	ZJAQJJRCHWWGEL-GBESFXJTSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K52613522	BRD-K52613522-001-01-9	Broad Institute of MIT and Harvard	BRD-K52613522			OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18-,19+/m0/s1	ZJAQJJRCHWWGEL-GBESFXJTSA-N	420.237270164							118990
BRD-K95018971	LSM-30440		54641021	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14-,15+/m1/s1	MDKMCQYBVAECJP-KFWWJZLASA-N	NCC[C@H]1CC[C@@H](NS(=O)(=O)Cc2ccccc2)[C@H](CO)O1	BroadT	BRD-K95018971	BRD-K95018971-001-01-6	Broad Institute of MIT and Harvard	BRD-K95018971			NCC[C@H]1CC[C@@H](NS(=O)(=O)Cc2ccccc2)[C@H](CO)O1	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14-,15+/m1/s1	MDKMCQYBVAECJP-KFWWJZLASA-N	328.145677958							118991
BRD-K08715918	LSM-30441		54640947	InChI=1S/C22H28N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,19-21,24-25H,2,12-15H2,1H3,(H,23,26)/t19-,20+,21+/m1/s1	DNFBTYFNFJSDKD-HKBOAZHASA-N	CCS(=O)(=O)N[C@H]1CC[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)O[C@H]1CO	BroadT	BRD-K08715918	BRD-K08715918-001-01-9	Broad Institute of MIT and Harvard	BRD-K08715918			CCS(=O)(=O)N[C@H]1CC[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C22H28N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,19-21,24-25H,2,12-15H2,1H3,(H,23,26)/t19-,20+,21+/m1/s1	DNFBTYFNFJSDKD-HKBOAZHASA-N	432.171892706							118992
BRD-K35667841	LSM-30442		54640957	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19+,22-/m0/s1	IYNBDOOKZCJAQL-KPLVRAHFSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)c4cccnc4)O[C@H]2CO	BroadT	BRD-K35667841	BRD-K35667841-001-01-1	Broad Institute of MIT and Harvard	BRD-K35667841			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2cccnc2)O[C@H]1CO	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19+,22-/m0/s1	IYNBDOOKZCJAQL-KPLVRAHFSA-N	452.217203436							118993
BRD-K94518115	LSM-30443		54640917	InChI=1S/C19H28N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h4-5,7,11,14-16,24H,1-3,6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16+/m0/s1	DDEXDZVSNNOFMF-ARFHVFGLSA-N	OC[C@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K94518115	BRD-K94518115-001-01-3	Broad Institute of MIT and Harvard	BRD-K94518115			OC[C@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C19H28N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h4-5,7,11,14-16,24H,1-3,6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16+/m0/s1	DDEXDZVSNNOFMF-ARFHVFGLSA-N	408.183126106							118994
BRD-K04568082	LSM-30444		54640758	InChI=1S/C28H31N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-13,16,24-26,32H,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25-,26+/m1/s1	LTCMWRCKDZHFDM-CYXNTTPDSA-N	COc1cccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO)c1	BroadT	BRD-K04568082	BRD-K04568082-001-01-6	Broad Institute of MIT and Harvard	BRD-K04568082			COc1cccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@H]2CO)c1	InChI=1S/C28H31N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-13,16,24-26,32H,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25-,26+/m1/s1	LTCMWRCKDZHFDM-CYXNTTPDSA-N	489.226371122							118995
BRD-K12202458	LSM-30445		54640799	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18-,19+/m1/s1	GHLUFTIHFDMMKJ-QRVBRYPASA-N	CCCc1cn(CC[C@H]2CC[C@@H](NC(=O)C3CCCCC3)[C@H](CO)O2)nn1	BroadT	BRD-K12202458	BRD-K12202458-001-01-8	Broad Institute of MIT and Harvard	BRD-K12202458			CCCc1cn(CC[C@H]2CC[C@@H](NC(=O)C3CCCCC3)[C@H](CO)O2)nn1	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18-,19+/m1/s1	GHLUFTIHFDMMKJ-QRVBRYPASA-N	378.263090988							118996
BRD-K38084509	LSM-30446		54640816	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20-,22-/m1/s1	WUPYLLMMUFNJPD-NQSCKRDGSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3ccccc3F)CC[C@H]1NC(=O)Cc4ccncc4	BroadT	BRD-K38084509	BRD-K38084509-001-01-9	Broad Institute of MIT and Harvard	BRD-K38084509			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2F)CC[C@H]1NC(=O)Cc1ccncc1	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20-,22-/m1/s1	WUPYLLMMUFNJPD-NQSCKRDGSA-N	439.201967942							118997
BRD-K34721572	LSM-30447		54640896	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17+,18+/m1/s1	WYLNQZCZILOHII-SQNIBIBYSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K34721572	BRD-K34721572-001-01-2	Broad Institute of MIT and Harvard	BRD-K34721572			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17+,18+/m1/s1	WYLNQZCZILOHII-SQNIBIBYSA-N	441.187540942							118998
BRD-K06863921	LSM-30448		54640755	InChI=1S/C28H31N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-13,16,24-26,32H,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26+/m1/s1	LTCMWRCKDZHFDM-ZNZIZOMTSA-N	COc1cccc(NC(=O)N[C@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO)c1	BroadT	BRD-K06863921	BRD-K06863921-001-01-4	Broad Institute of MIT and Harvard	BRD-K06863921			COc1cccc(NC(=O)N[C@H]2CC[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@H]2CO)c1	InChI=1S/C28H31N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-13,16,24-26,32H,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26+/m1/s1	LTCMWRCKDZHFDM-ZNZIZOMTSA-N	489.226371122							118999
BRD-K05246869	LSM-30449		54641046	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18-,21+/m1/s1	DNUVWNCDCIVCLB-FPDPHYFHSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NC(=O)c4ccccc4F	BroadT	BRD-K05246869	BRD-K05246869-001-01-7	Broad Institute of MIT and Harvard	BRD-K05246869			OC[C@@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18-,21+/m1/s1	DNUVWNCDCIVCLB-FPDPHYFHSA-N	444.16966474							119000
BRD-K84178479	LSM-30450		54640868	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22-,23-/m1/s1	RXWWLGBTGKBRLQ-YMPZKCBVSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K84178479	BRD-K84178479-001-01-8	Broad Institute of MIT and Harvard	BRD-K84178479			OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22-,23-/m1/s1	RXWWLGBTGKBRLQ-YMPZKCBVSA-N	489.173369916							119001
BRD-K92212152	LSM-30451		54640988	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21-/m0/s1	YNMAXJORQBUKHH-ZXNZYJFHSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K92212152	BRD-K92212152-001-01-9	Broad Institute of MIT and Harvard	BRD-K92212152			C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21-/m0/s1	YNMAXJORQBUKHH-ZXNZYJFHSA-N	411.215806438							119002
BRD-K64356525	LSM-30452		54640875	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19-,20-/m1/s1	DOQFJJOYHUUDAI-MISYRCLQSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K64356525	BRD-K64356525-001-01-8	Broad Institute of MIT and Harvard	BRD-K64356525			OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19-,20-/m1/s1	DOQFJJOYHUUDAI-MISYRCLQSA-N	486.078297998							119003
BRD-K77403813	LSM-30453		54640830	InChI=1S/C15H26N2O5S/c1-2-23(20,21)16-13-7-6-12(22-14(13)11-18)10-15(19)17-8-4-3-5-9-17/h6-7,12-14,16,18H,2-5,8-11H2,1H3/t12-,13+,14+/m1/s1	RUXRIVSLYZEBAJ-RDBSUJKOSA-N	CCS(=O)(=O)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K77403813	BRD-K77403813-001-01-4	Broad Institute of MIT and Harvard	BRD-K77403813			CCS(=O)(=O)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C15H26N2O5S/c1-2-23(20,21)16-13-7-6-12(22-14(13)11-18)10-15(19)17-8-4-3-5-9-17/h6-7,12-14,16,18H,2-5,8-11H2,1H3/t12-,13+,14+/m1/s1	RUXRIVSLYZEBAJ-RDBSUJKOSA-N	346.156242642							119004
BRD-K98639224	LSM-30454		54640905	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24-,25+/m0/s1	HQJSXCNUPDQHFZ-CCDWMCETSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)c4ccccc4	BroadT	BRD-K98639224	BRD-K98639224-001-01-1	Broad Institute of MIT and Harvard	BRD-K98639224			OC[C@H]1O[C@@H](CC[C@@H]1NC(=O)c1ccccc1)CC(=O)Nc1ccc(cc1)-c1ccccc1	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24-,25+/m0/s1	HQJSXCNUPDQHFZ-CCDWMCETSA-N	444.204907396							119005
BRD-K60161601	LSM-30455		54640888	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18-/m0/s1	MINIXHYBIVPWCS-LESCRADOSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K60161601	BRD-K60161601-001-01-3	Broad Institute of MIT and Harvard	BRD-K60161601			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18-/m0/s1	MINIXHYBIVPWCS-LESCRADOSA-N	402.170333456							119006
BRD-K39326623	LSM-30456		54640798	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18+,19+/m1/s1	GHLUFTIHFDMMKJ-QYZOEREBSA-N	CCCc1cn(CC[C@H]2CC[C@H](NC(=O)C3CCCCC3)[C@H](CO)O2)nn1	BroadT	BRD-K39326623	BRD-K39326623-001-01-4	Broad Institute of MIT and Harvard	BRD-K39326623			CCCc1cn(CC[C@H]2CC[C@H](NC(=O)C3CCCCC3)[C@H](CO)O2)nn1	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18+,19+/m1/s1	GHLUFTIHFDMMKJ-QYZOEREBSA-N	378.263090988							119007
BRD-K68731395	LSM-30457		54640880	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19+,20-/m0/s1	DOQFJJOYHUUDAI-SXLOBPIMSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K68731395	BRD-K68731395-001-01-5	Broad Institute of MIT and Harvard	BRD-K68731395			OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19+,20-/m0/s1	DOQFJJOYHUUDAI-SXLOBPIMSA-N	486.078297998							119008
BRD-K60295429	LSM-30458		54641058	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18+,19-/m0/s1	RDGNRWNQTDLRBG-IPELMVKDSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NC(=O)c4ccccc4F	BroadT	BRD-K60295429	BRD-K60295429-001-01-9	Broad Institute of MIT and Harvard	BRD-K60295429			OC[C@@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18+,19-/m0/s1	RDGNRWNQTDLRBG-IPELMVKDSA-N	432.217283648							119009
BRD-K93337444	LSM-30459		54640841	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18+,20-/m0/s1	RRAIEYROWAKKHB-NSHGMRRFSA-N	CC(C)c1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)Cc3ccccc3)[C@H](CO)O2)nn1	BroadT	BRD-K93337444	BRD-K93337444-001-01-1	Broad Institute of MIT and Harvard	BRD-K93337444			CC(C)c1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)Cc3ccccc3)[C@H](CO)O2)nn1	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18+,20-/m0/s1	RRAIEYROWAKKHB-NSHGMRRFSA-N	422.19877617							119010
BRD-K32983008	LSM-30460		54641009	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16-/m0/s1	BTLHSRCDNJLGMU-XHSDSOJGSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2c(C)onc2C)[C@H](CO)O1	BroadT	BRD-K32983008	BRD-K32983008-001-01-4	Broad Institute of MIT and Harvard	BRD-K32983008			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2c(C)noc2C)[C@H](CO)O1	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16-/m0/s1	BTLHSRCDNJLGMU-XHSDSOJGSA-N	411.248169206							119011
BRD-K73494324	LSM-30461		54640979	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21+/m0/s1	YNMAXJORQBUKHH-VRXWPRPYSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K73494324	BRD-K73494324-001-01-9	Broad Institute of MIT and Harvard	BRD-K73494324			C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21+/m0/s1	YNMAXJORQBUKHH-VRXWPRPYSA-N	411.215806438							119012
CHEMBL2144737	LSM-30462	BRD-K56820801, SID131437265	54640953	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19-,22+/m1/s1	IYNBDOOKZCJAQL-JUXOCIIHSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)c4cccnc4)O[C@H]2CO	BroadT	BRD-K56820801	BRD-K56820801-001-01-8	Broad Institute of MIT and Harvard	BRD-K56820801			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)-c2cccnc2)O[C@H]1CO	InChI=1S/C23H28N6O4/c1-32-21-7-3-2-6-18(21)25-23(31)26-19-9-8-17(33-22(19)15-30)10-12-29-14-20(27-28-29)16-5-4-11-24-13-16/h2-7,11,13-14,17,19,22,30H,8-10,12,15H2,1H3,(H2,25,26,31)/t17-,19-,22+/m1/s1	IYNBDOOKZCJAQL-JUXOCIIHSA-N	452.217203436							119013
BRD-K82868643	LSM-30463		54641022	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14-,15-/m0/s1	MDKMCQYBVAECJP-KKUMJFAQSA-N	NCC[C@@H]1CC[C@H](NS(=O)(=O)Cc2ccccc2)[C@H](CO)O1	BroadT	BRD-K82868643	BRD-K82868643-001-01-7	Broad Institute of MIT and Harvard	BRD-K82868643			NCC[C@@H]1CC[C@H](NS(=O)(=O)Cc2ccccc2)[C@H](CO)O1	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14-,15-/m0/s1	MDKMCQYBVAECJP-KKUMJFAQSA-N	328.145677958							119014
BRD-K10784927	LSM-30464		54640933	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13-,14-/m1/s1	BRLNHSCHDPURAU-MRVWCRGKSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)O)O[C@@H]2CO	BroadT	BRD-K10784927	BRD-K10784927-001-01-0	Broad Institute of MIT and Harvard	BRD-K10784927			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CC(O)=O)O[C@@H]1CO	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13-,14-/m1/s1	BRLNHSCHDPURAU-MRVWCRGKSA-N	343.108958092							119015
BRD-K43284834	LSM-30465		54640938	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15+,16+/m0/s1	IVJDFQRYYIVNGV-ARFHVFGLSA-N	CCC(=O)N[C@@H]1CC[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@@H]1CO	BroadT	BRD-K43284834	BRD-K43284834-001-01-4	Broad Institute of MIT and Harvard	BRD-K43284834			CCC(=O)N[C@@H]1CC[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@@H]1CO	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15+,16+/m0/s1	IVJDFQRYYIVNGV-ARFHVFGLSA-N	417.187540942							119016
BRD-K70379342	LSM-30466		54640860	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18-,19-/m1/s1	ZJAQJJRCHWWGEL-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K70379342	BRD-K70379342-001-01-3	Broad Institute of MIT and Harvard	BRD-K70379342			OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18-,19-/m1/s1	ZJAQJJRCHWWGEL-GUDVDZBRSA-N	420.237270164							119017
BRD-K31758107	LSM-30467		54640901	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17+,18-/m0/s1	WYLNQZCZILOHII-KSZLIROESA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K31758107	BRD-K31758107-001-01-1	Broad Institute of MIT and Harvard	BRD-K31758107			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17+,18-/m0/s1	WYLNQZCZILOHII-KSZLIROESA-N	441.187540942							119018
BRD-K79547691	LSM-30468		54640751	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19+/m0/s1	SLCLMSLRMDGYCU-GBESFXJTSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K79547691	BRD-K79547691-001-01-3	Broad Institute of MIT and Harvard	BRD-K79547691			OC[C@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19+/m0/s1	SLCLMSLRMDGYCU-GBESFXJTSA-N	472.229740112							119019
BRD-K41189799	LSM-30469		54640832	InChI=1S/C15H26N2O5S/c1-2-23(20,21)16-13-7-6-12(22-14(13)11-18)10-15(19)17-8-4-3-5-9-17/h6-7,12-14,16,18H,2-5,8-11H2,1H3/t12-,13-,14+/m0/s1	RUXRIVSLYZEBAJ-MELADBBJSA-N	CCS(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K41189799	BRD-K41189799-001-01-0	Broad Institute of MIT and Harvard	BRD-K41189799			CCS(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C15H26N2O5S/c1-2-23(20,21)16-13-7-6-12(22-14(13)11-18)10-15(19)17-8-4-3-5-9-17/h6-7,12-14,16,18H,2-5,8-11H2,1H3/t12-,13-,14+/m0/s1	RUXRIVSLYZEBAJ-MELADBBJSA-N	346.156242642							119020
BRD-K04005364	LSM-30470		54641016	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15-/m1/s1	LJGUQBBKFZFLJA-QLFBSQMISA-N	CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	BroadT	BRD-K04005364	BRD-K04005364-001-01-8	Broad Institute of MIT and Harvard	BRD-K04005364			CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15-/m1/s1	LJGUQBBKFZFLJA-QLFBSQMISA-N	356.242355544							119021
BRD-K10157835	LSM-30471		54640750	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19-/m0/s1	SLCLMSLRMDGYCU-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K10157835	BRD-K10157835-001-01-0	Broad Institute of MIT and Harvard	BRD-K10157835			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18-,19-/m0/s1	SLCLMSLRMDGYCU-FHWLQOOXSA-N	472.229740112							119022
BRD-K17300786	LSM-30472		54640784	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17-,19+/m0/s1	QKYXERGZTDIPLJ-JENIJYKNSA-N	CC(C)c1cn(CC[C@@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)nn1	BroadT	BRD-K17300786	BRD-K17300786-001-01-8	Broad Institute of MIT and Harvard	BRD-K17300786			CC(C)c1cn(CC[C@@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)nn1	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17-,19+/m0/s1	QKYXERGZTDIPLJ-JENIJYKNSA-N	390.206718964							119023
BRD-K78088874	LSM-30473		54640883	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18-/m1/s1	MINIXHYBIVPWCS-QGPMSJSTSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K78088874	BRD-K78088874-001-01-8	Broad Institute of MIT and Harvard	BRD-K78088874			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18-/m1/s1	MINIXHYBIVPWCS-QGPMSJSTSA-N	402.170333456							119024
BRD-K46428124	LSM-30474		54641047	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18-,21-/m1/s1	DNUVWNCDCIVCLB-FQELHTAISA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NC(=O)c4ccccc4F	BroadT	BRD-K46428124	BRD-K46428124-001-01-3	Broad Institute of MIT and Harvard	BRD-K46428124			OC[C@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18-,21-/m1/s1	DNUVWNCDCIVCLB-FQELHTAISA-N	444.16966474							119025
BRD-K97371424	LSM-30475		54640783	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17-,19-/m1/s1	QKYXERGZTDIPLJ-ZHALLVOQSA-N	CC(C)c1cn(CC[C@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)nn1	BroadT	BRD-K97371424	BRD-K97371424-001-01-0	Broad Institute of MIT and Harvard	BRD-K97371424			CC(C)c1cn(CC[C@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)nn1	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17-,19-/m1/s1	QKYXERGZTDIPLJ-ZHALLVOQSA-N	390.206718964							119026
BRD-K79904333	LSM-30476		54641051	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18+,19+/m0/s1	RDGNRWNQTDLRBG-KFKAGJAMSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NC(=O)c4ccccc4F	BroadT	BRD-K79904333	BRD-K79904333-001-01-0	Broad Institute of MIT and Harvard	BRD-K79904333			OC[C@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H29FN4O4/c23-17-6-2-1-5-16(17)21(29)24-18-8-7-15(31-19(18)14-28)9-12-27-13-20(25-26-27)22(30)10-3-4-11-22/h1-2,5-6,13,15,18-19,28,30H,3-4,7-12,14H2,(H,24,29)/t15-,18+,19+/m0/s1	RDGNRWNQTDLRBG-KFKAGJAMSA-N	432.217283648							119027
BRD-K84028274	LSM-30477		54641013	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15-/m0/s1	LJGUQBBKFZFLJA-KKUMJFAQSA-N	CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)NCCCN(C)C)O[C@H]1CO	BroadT	BRD-K84028274	BRD-K84028274-001-01-2	Broad Institute of MIT and Harvard	BRD-K84028274			CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)NCCCN(C)C)O[C@H]1CO	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15-/m0/s1	LJGUQBBKFZFLJA-KKUMJFAQSA-N	356.242355544							119028
BRD-K50216176	LSM-30478		54640960	InChI=1S/C19H24FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-6,15-17,24H,7-12H2,(H2,21,22,26)/t15-,16+,17+/m1/s1	TXBZUYXXZRGZTP-IKGGRYGDSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K50216176	BRD-K50216176-001-01-2	Broad Institute of MIT and Harvard	BRD-K50216176			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C19H24FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-6,15-17,24H,7-12H2,(H2,21,22,26)/t15-,16+,17+/m1/s1	TXBZUYXXZRGZTP-IKGGRYGDSA-N	393.169999098							119029
BRD-K30853940	LSM-30479		54641039	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15-,16-/m1/s1	DMROSRCUXVWXJU-BZUAXINKSA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	BroadT	BRD-K30853940	BRD-K30853940-001-01-2	Broad Institute of MIT and Harvard	BRD-K30853940			CC(C)NC(=O)N[C@@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15-,16-/m1/s1	DMROSRCUXVWXJU-BZUAXINKSA-N	371.242021186							119030
BRD-K01417352	LSM-30480		54641044	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18+,21+/m1/s1	DNUVWNCDCIVCLB-YWMUFLPLSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NC(=O)c4ccccc4F	BroadT	BRD-K01417352	BRD-K01417352-001-01-2	Broad Institute of MIT and Harvard	BRD-K01417352			OC[C@@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18+,21+/m1/s1	DNUVWNCDCIVCLB-YWMUFLPLSA-N	444.16966474							119031
BRD-K36197756	LSM-30481		54640811	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23+,24-/m0/s1	RLBPWNWBWPNMOA-VXNXHJTFSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)CC4CC4	BroadT	BRD-K36197756	BRD-K36197756-001-01-1	Broad Institute of MIT and Harvard	BRD-K36197756			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)CC1CC1	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23+,24-/m0/s1	RLBPWNWBWPNMOA-VXNXHJTFSA-N	434.22055746							119032
BRD-K56595246	LSM-30482		54640926	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15-,16-/m0/s1	LATIXEUUNJKTQG-JYJNAYRXSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K56595246	BRD-K56595246-001-01-9	Broad Institute of MIT and Harvard	BRD-K56595246			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15-,16-/m0/s1	LATIXEUUNJKTQG-JYJNAYRXSA-N	352.199822016							119033
BRD-K24825509	LSM-30483		54640814	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20+,22+/m0/s1	WUPYLLMMUFNJPD-UCNVEGJOSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3ccccc3F)CC[C@H]1NC(=O)Cc4ccncc4	BroadT	BRD-K24825509	BRD-K24825509-001-01-1	Broad Institute of MIT and Harvard	BRD-K24825509			OC[C@H]1O[C@H](CCn2cc(nn2)-c2ccccc2F)CC[C@H]1NC(=O)Cc1ccncc1	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20+,22+/m0/s1	WUPYLLMMUFNJPD-UCNVEGJOSA-N	439.201967942							119034
BRD-K14723547	LSM-30484		54640983	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21-/m1/s1	YNMAXJORQBUKHH-QYRPDUKASA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K14723547	BRD-K14723547-001-01-4	Broad Institute of MIT and Harvard	BRD-K14723547			C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21-/m1/s1	YNMAXJORQBUKHH-QYRPDUKASA-N	411.215806438							119035
BRD-K91506006	LSM-30485		54640844	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19-/m1/s1	AQOAQYOOWGGKER-ATZDWAIDSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K91506006	BRD-K91506006-001-01-3	Broad Institute of MIT and Harvard	BRD-K91506006			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19-/m1/s1	AQOAQYOOWGGKER-ATZDWAIDSA-N	451.106561666							119036
BRD-K44549496	LSM-30486		54640929	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15+,16-/m1/s1	LATIXEUUNJKTQG-OWCLPIDISA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K44549496	BRD-K44549496-001-01-8	Broad Institute of MIT and Harvard	BRD-K44549496			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15+,16-/m1/s1	LATIXEUUNJKTQG-OWCLPIDISA-N	352.199822016							119037
BRD-K90527476	LSM-30487		54640990	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21-/m1/s1	YNMAXJORQBUKHH-RZXSNQJFSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K90527476	BRD-K90527476-001-01-1	Broad Institute of MIT and Harvard	BRD-K90527476			C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20+,21-/m1/s1	YNMAXJORQBUKHH-RZXSNQJFSA-N	411.215806438							119038
BRD-K73659883	LSM-30488		54640935	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13-,14+/m1/s1	BRLNHSCHDPURAU-BNOWGMLFSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)O)O[C@H]2CO	BroadT	BRD-K73659883	BRD-K73659883-001-01-0	Broad Institute of MIT and Harvard	BRD-K73659883			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CC(O)=O)O[C@H]1CO	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13-,14+/m1/s1	BRLNHSCHDPURAU-BNOWGMLFSA-N	343.108958092							119039
BRD-K18176829	LSM-30489		54641033	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16-/m1/s1	UDNDOFJZCBESNN-OWCLPIDISA-N	CCC(=O)N[C@H]1CC[C@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	BroadT	BRD-K18176829	BRD-K18176829-001-01-0	Broad Institute of MIT and Harvard	BRD-K18176829			CCC(=O)N[C@H]1CC[C@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16-/m1/s1	UDNDOFJZCBESNN-OWCLPIDISA-N	340.236207524							119040
BRD-K28730929-001-01-1	LSM-30490	BRD-K28730929	54640963	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21-/m0/s1	KEJHSICNFQEVJK-SKRQURTPSA-N	C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K28730929	BRD-K28730929-001-01-1	Broad Institute of MIT and Harvard	BRD-K28730929			C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21-/m0/s1	KEJHSICNFQEVJK-SKRQURTPSA-N	448.14682081							119041
BRD-K89000000	LSM-30491		54640856	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19-,20+/m0/s1	KCRDNBZRFZAOKR-SLFFLAALSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K89000000	BRD-K89000000-001-01-7	Broad Institute of MIT and Harvard	BRD-K89000000			OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19-,20+/m0/s1	KCRDNBZRFZAOKR-SLFFLAALSA-N	465.12221173							119042
BRD-K43126701	LSM-30492		54640934	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13-,14+/m0/s1	BRLNHSCHDPURAU-FPMFFAJLSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)O)O[C@@H]2CO	BroadT	BRD-K43126701	BRD-K43126701-001-01-7	Broad Institute of MIT and Harvard	BRD-K43126701			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CC(O)=O)O[C@@H]1CO	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13-,14+/m0/s1	BRLNHSCHDPURAU-FPMFFAJLSA-N	343.108958092							119043
BRD-K70109334	LSM-30493		54640753	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19-/m1/s1	SLCLMSLRMDGYCU-CEXWTWQISA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K70109334	BRD-K70109334-001-01-4	Broad Institute of MIT and Harvard	BRD-K70109334			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19-/m1/s1	SLCLMSLRMDGYCU-CEXWTWQISA-N	472.229740112							119044
MLS003650092	LSM-30494	SID125305386, BRD-K34534297	53382742	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19+,20+/m0/s1	DOQFJJOYHUUDAI-DFQSSKMNSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K34534297	BRD-K34534297-001-01-3	Broad Institute of MIT and Harvard	BRD-K34534297			OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19+,20+/m0/s1	DOQFJJOYHUUDAI-DFQSSKMNSA-N	486.078297998							119045
BRD-K64039518	LSM-30495		54640881	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18+/m0/s1	MINIXHYBIVPWCS-YXJHDRRASA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K64039518	BRD-K64039518-001-01-9	Broad Institute of MIT and Harvard	BRD-K64039518			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18+/m0/s1	MINIXHYBIVPWCS-YXJHDRRASA-N	402.170333456							119046
BRD-K30284601	LSM-30496		54640818	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20-,22-/m0/s1	WUPYLLMMUFNJPD-XJABCFGWSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3ccccc3F)CC[C@@H]1NC(=O)Cc4ccncc4	BroadT	BRD-K30284601	BRD-K30284601-001-01-0	Broad Institute of MIT and Harvard	BRD-K30284601			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2ccccc2F)CC[C@@H]1NC(=O)Cc1ccncc1	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20-,22-/m0/s1	WUPYLLMMUFNJPD-XJABCFGWSA-N	439.201967942							119047
BRD-K06863452	LSM-30497		54641018	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14+,15+/m0/s1	MDKMCQYBVAECJP-RRFJBIMHSA-N	NCC[C@@H]1CC[C@@H](NS(=O)(=O)Cc2ccccc2)[C@@H](CO)O1	BroadT	BRD-K06863452	BRD-K06863452-001-01-1	Broad Institute of MIT and Harvard	BRD-K06863452			NCC[C@@H]1CC[C@@H](NS(=O)(=O)Cc2ccccc2)[C@@H](CO)O1	InChI=1S/C15H24N2O4S/c16-9-8-13-6-7-14(15(10-18)21-13)17-22(19,20)11-12-4-2-1-3-5-12/h1-5,13-15,17-18H,6-11,16H2/t13-,14+,15+/m0/s1	MDKMCQYBVAECJP-RRFJBIMHSA-N	328.145677958							119048
BRD-K15609977	LSM-30498		54640746	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23-/m0/s1	PFEWRFQNGBURGF-ZRBLBEILSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K15609977	BRD-K15609977-001-01-3	Broad Institute of MIT and Harvard	BRD-K15609977			Cc1noc(C)c1NC(=O)N[C@@H]1C=C[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23-/m0/s1	PFEWRFQNGBURGF-ZRBLBEILSA-N	476.205970036							119049
BRD-K11844807	LSM-30499		54640838	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18-,20-/m1/s1	RRAIEYROWAKKHB-QWFCFKBJSA-N	CC(C)c1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)Cc3ccccc3)[C@@H](CO)O2)nn1	BroadT	BRD-K11844807	BRD-K11844807-001-01-6	Broad Institute of MIT and Harvard	BRD-K11844807			CC(C)c1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)Cc3ccccc3)[C@@H](CO)O2)nn1	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18-,20-/m1/s1	RRAIEYROWAKKHB-QWFCFKBJSA-N	422.19877617							119050
BRD-K45952474	LSM-30500		54640786	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17-,19-/m0/s1	QKYXERGZTDIPLJ-LNLFQRSKSA-N	CC(C)c1cn(CC[C@@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)nn1	BroadT	BRD-K45952474	BRD-K45952474-001-01-9	Broad Institute of MIT and Harvard	BRD-K45952474			CC(C)c1cn(CC[C@@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)nn1	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17-,19-/m0/s1	QKYXERGZTDIPLJ-LNLFQRSKSA-N	390.206718964							119051
BRD-K34192219	LSM-30501		54640965	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21+/m0/s1	KEJHSICNFQEVJK-DZLUEKEQSA-N	C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K34192219	BRD-K34192219-001-01-5	Broad Institute of MIT and Harvard	BRD-K34192219			C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21+/m0/s1	KEJHSICNFQEVJK-DZLUEKEQSA-N	448.14682081							119052
BRD-K49932469	LSM-30502		54640879	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19+,20-/m1/s1	DOQFJJOYHUUDAI-YZGWKJHDSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K49932469	BRD-K49932469-001-01-4	Broad Institute of MIT and Harvard	BRD-K49932469			OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19+,20-/m1/s1	DOQFJJOYHUUDAI-YZGWKJHDSA-N	486.078297998							119053
BRD-K15940471	LSM-30503		54640858	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18+,19+/m1/s1	ZJAQJJRCHWWGEL-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K15940471	BRD-K15940471-001-01-3	Broad Institute of MIT and Harvard	BRD-K15940471			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18+,19+/m1/s1	ZJAQJJRCHWWGEL-QYZOEREBSA-N	420.237270164							119054
BRD-K36689392	LSM-30504		54640782	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17+,19+/m1/s1	QKYXERGZTDIPLJ-AOIWGVFYSA-N	CC(C)c1cn(CC[C@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)nn1	BroadT	BRD-K36689392	BRD-K36689392-001-01-7	Broad Institute of MIT and Harvard	BRD-K36689392			CC(C)c1cn(CC[C@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)nn1	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17+,19+/m1/s1	QKYXERGZTDIPLJ-AOIWGVFYSA-N	390.206718964							119055
BRD-K64751430	LSM-30505		54640925	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15-,16-/m1/s1	LATIXEUUNJKTQG-BZUAXINKSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K64751430	BRD-K64751430-001-01-4	Broad Institute of MIT and Harvard	BRD-K64751430			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)C1CCOCC1	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15-,16-/m1/s1	LATIXEUUNJKTQG-BZUAXINKSA-N	352.199822016							119056
BRD-K47541706	LSM-30506		54641037	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15-,16+/m0/s1	DMROSRCUXVWXJU-HRCADAONSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	BroadT	BRD-K47541706	BRD-K47541706-001-01-8	Broad Institute of MIT and Harvard	BRD-K47541706			CC(C)NC(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15-,16+/m0/s1	DMROSRCUXVWXJU-HRCADAONSA-N	371.242021186							119057
BRD-K53540914	LSM-30507		54640824	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15-,16-/m1/s1	CAIOSQFPDHZSIB-BZUAXINKSA-N	COCc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3c(C)onc3C)[C@@H](CO)O2)nn1	BroadT	BRD-K53540914	BRD-K53540914-001-01-9	Broad Institute of MIT and Harvard	BRD-K53540914			COCc1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3c(C)noc3C)[C@@H](CO)O2)nn1	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15-,16-/m1/s1	CAIOSQFPDHZSIB-BZUAXINKSA-N	408.212118056							119058
BRD-K30937829	LSM-30508		54641043	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18+,21+/m0/s1	DNUVWNCDCIVCLB-RRMPHLOHSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NC(=O)c4ccccc4F	BroadT	BRD-K30937829	BRD-K30937829-001-01-9	Broad Institute of MIT and Harvard	BRD-K30937829			OC[C@H]1O[C@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18+,21+/m0/s1	DNUVWNCDCIVCLB-RRMPHLOHSA-N	444.16966474							119059
BRD-K96218803	LSM-30509		54640781	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17+,19+/m0/s1	QKYXERGZTDIPLJ-YQVWRLOYSA-N	CC(C)c1cn(CC[C@@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)nn1	BroadT	BRD-K96218803	BRD-K96218803-001-01-5	Broad Institute of MIT and Harvard	BRD-K96218803			CC(C)c1cn(CC[C@@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)nn1	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17+,19+/m0/s1	QKYXERGZTDIPLJ-YQVWRLOYSA-N	390.206718964							119060
BRD-K45712538	LSM-30510		54640922	InChI=1S/C19H28N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h4-5,7,11,14-16,24H,1-3,6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16-/m0/s1	DDEXDZVSNNOFMF-XHSDSOJGSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K45712538	BRD-K45712538-001-01-1	Broad Institute of MIT and Harvard	BRD-K45712538			OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C19H28N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h4-5,7,11,14-16,24H,1-3,6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16-/m0/s1	DDEXDZVSNNOFMF-XHSDSOJGSA-N	408.183126106							119061
BRD-K53748177	LSM-30511		54640981	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21-/m0/s1	YNMAXJORQBUKHH-FIRPJDEBSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K53748177	BRD-K53748177-001-01-0	Broad Institute of MIT and Harvard	BRD-K53748177			C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21-/m0/s1	YNMAXJORQBUKHH-FIRPJDEBSA-N	411.215806438							119062
BRD-K34701680	LSM-30512		54640848	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19-/m1/s1	AQOAQYOOWGGKER-AYOQOUSVSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K34701680	BRD-K34701680-001-01-3	Broad Institute of MIT and Harvard	BRD-K34701680			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19-/m1/s1	AQOAQYOOWGGKER-AYOQOUSVSA-N	451.106561666							119063
BRD-K35681049	LSM-30513		54641049	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18+,21-/m1/s1	DNUVWNCDCIVCLB-FYINFDKHSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NC(=O)c4ccccc4F	BroadT	BRD-K35681049	BRD-K35681049-001-01-2	Broad Institute of MIT and Harvard	BRD-K35681049			OC[C@H]1O[C@@H](CCNC(=O)c2ccc3OCOc3c2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C23H25FN2O6/c24-17-4-2-1-3-16(17)23(29)26-18-7-6-15(32-21(18)12-27)9-10-25-22(28)14-5-8-19-20(11-14)31-13-30-19/h1-5,8,11,15,18,21,27H,6-7,9-10,12-13H2,(H,25,28)(H,26,29)/t15-,18+,21-/m1/s1	DNUVWNCDCIVCLB-FYINFDKHSA-N	444.16966474							119064
BRD-K56520977	LSM-30514		54640927	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15-,16+/m0/s1	LATIXEUUNJKTQG-HRCADAONSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K56520977	BRD-K56520977-001-01-2	Broad Institute of MIT and Harvard	BRD-K56520977			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15-,16+/m0/s1	LATIXEUUNJKTQG-HRCADAONSA-N	352.199822016							119065
BRD-K85395981	LSM-30515		54640986	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21+/m0/s1	YNMAXJORQBUKHH-LRGNLBRXSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K85395981	BRD-K85395981-001-01-8	Broad Institute of MIT and Harvard	BRD-K85395981			C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19-,20-,21+/m0/s1	YNMAXJORQBUKHH-LRGNLBRXSA-N	411.215806438							119066
BRD-K84278600	LSM-30516		54640939	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15+,16+/m1/s1	IVJDFQRYYIVNGV-PMPSAXMXSA-N	CCC(=O)N[C@H]1CC[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@H]1CO	BroadT	BRD-K84278600	BRD-K84278600-001-01-8	Broad Institute of MIT and Harvard	BRD-K84278600			CCC(=O)N[C@H]1CC[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@H]1CO	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15+,16+/m1/s1	IVJDFQRYYIVNGV-PMPSAXMXSA-N	417.187540942							119067
BRD-K91854399	LSM-30517		54641029	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16-/m1/s1	UDNDOFJZCBESNN-BZUAXINKSA-N	CCC(=O)N[C@@H]1CC[C@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	BroadT	BRD-K91854399	BRD-K91854399-001-01-2	Broad Institute of MIT and Harvard	BRD-K91854399			CCC(=O)N[C@@H]1CC[C@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16-/m1/s1	UDNDOFJZCBESNN-BZUAXINKSA-N	340.236207524							119068
BRD-K94915822	LSM-30518		54640793	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17-,18+/m0/s1	KPQAGDNSAAOMGS-OKZBNKHCSA-N	CN1CCN(CC1)C(=O)C[C@H]2O[C@H](CO)[C@@H](NC(=O)Cc3ccccn3)C=C2	BroadT	BRD-K94915822	BRD-K94915822-001-01-5	Broad Institute of MIT and Harvard	BRD-K94915822			CN1CCN(CC1)C(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Cc2ccccn2)C=C1	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17-,18+/m0/s1	KPQAGDNSAAOMGS-OKZBNKHCSA-N	388.211055416							119069
BRD-K79221878	LSM-30519		54640833	InChI=1S/C15H26N2O5S/c1-2-23(20,21)16-13-7-6-12(22-14(13)11-18)10-15(19)17-8-4-3-5-9-17/h6-7,12-14,16,18H,2-5,8-11H2,1H3/t12-,13-,14+/m1/s1	RUXRIVSLYZEBAJ-MCIONIFRSA-N	CCS(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K79221878	BRD-K79221878-001-01-0	Broad Institute of MIT and Harvard	BRD-K79221878			CCS(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C15H26N2O5S/c1-2-23(20,21)16-13-7-6-12(22-14(13)11-18)10-15(19)17-8-4-3-5-9-17/h6-7,12-14,16,18H,2-5,8-11H2,1H3/t12-,13-,14+/m1/s1	RUXRIVSLYZEBAJ-MCIONIFRSA-N	346.156242642							119070
BRD-K22383829	LSM-30520		54640766	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18-/m1/s1	DTKWTAJBQNGVNM-FGTMMUONSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Cc2cccnc2)C=C1	BroadT	BRD-K22383829	BRD-K22383829-001-01-6	Broad Institute of MIT and Harvard	BRD-K22383829			CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Cc2cccnc2)C=C1	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18-/m1/s1	DTKWTAJBQNGVNM-FGTMMUONSA-N	390.22670548							119071
BRD-K24496049	LSM-30521		54640930	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15+,16-/m0/s1	LATIXEUUNJKTQG-XHSDSOJGSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K24496049	BRD-K24496049-001-01-8	Broad Institute of MIT and Harvard	BRD-K24496049			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)C1CCOCC1	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15+,16-/m0/s1	LATIXEUUNJKTQG-XHSDSOJGSA-N	352.199822016							119072
BRD-K11414036	LSM-30522		54640757	InChI=1S/C28H31N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-13,16,24-26,32H,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25-,26+/m0/s1	LTCMWRCKDZHFDM-KKUQBAQOSA-N	COc1cccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO)c1	BroadT	BRD-K11414036	BRD-K11414036-001-01-1	Broad Institute of MIT and Harvard	BRD-K11414036			COc1cccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@@H]2CO)c1	InChI=1S/C28H31N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-13,16,24-26,32H,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25-,26+/m0/s1	LTCMWRCKDZHFDM-KKUQBAQOSA-N	489.226371122							119073
BRD-K21546432	LSM-30523		54640767	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18-/m0/s1	DTKWTAJBQNGVNM-KSZLIROESA-N	CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Cc2cccnc2)C=C1	BroadT	BRD-K21546432	BRD-K21546432-001-01-8	Broad Institute of MIT and Harvard	BRD-K21546432			CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Cc2cccnc2)C=C1	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18-/m0/s1	DTKWTAJBQNGVNM-KSZLIROESA-N	390.22670548							119074
BRD-K35341092	LSM-30524		54641030	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16+/m0/s1	UDNDOFJZCBESNN-HRCADAONSA-N	CCC(=O)N[C@H]1CC[C@@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	BroadT	BRD-K35341092	BRD-K35341092-001-01-9	Broad Institute of MIT and Harvard	BRD-K35341092			CCC(=O)N[C@H]1CC[C@@H](CC(=O)NCC2CCCCC2)O[C@@H]1CO	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16+/m0/s1	UDNDOFJZCBESNN-HRCADAONSA-N	340.236207524							119075
BRD-K95863777	LSM-30525		54640943	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15-,16-/m0/s1	IVJDFQRYYIVNGV-JYJNAYRXSA-N	CCC(=O)N[C@H]1CC[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@H]1CO	BroadT	BRD-K95863777	BRD-K95863777-001-01-1	Broad Institute of MIT and Harvard	BRD-K95863777			CCC(=O)N[C@H]1CC[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@H]1CO	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15-,16-/m0/s1	IVJDFQRYYIVNGV-JYJNAYRXSA-N	417.187540942							119076
BRD-K31666794	LSM-30526		54640969	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18+,19+/m0/s1	ZGRBCZVMEMXSST-QXAKKESOSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K31666794	BRD-K31666794-001-01-4	Broad Institute of MIT and Harvard	BRD-K31666794			OC[C@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18+,19+/m0/s1	ZGRBCZVMEMXSST-QXAKKESOSA-N	453.112519298							119077
BRD-K17482962	LSM-30527		54640801	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18-,19-/m1/s1	GHLUFTIHFDMMKJ-GUDVDZBRSA-N	CCCc1cn(CC[C@H]2CC[C@@H](NC(=O)C3CCCCC3)[C@@H](CO)O2)nn1	BroadT	BRD-K17482962	BRD-K17482962-001-01-0	Broad Institute of MIT and Harvard	BRD-K17482962			CCCc1cn(CC[C@H]2CC[C@@H](NC(=O)C3CCCCC3)[C@@H](CO)O2)nn1	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18-,19-/m1/s1	GHLUFTIHFDMMKJ-GUDVDZBRSA-N	378.263090988							119078
BRD-K05118861	LSM-30528		54640764	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18+/m0/s1	DTKWTAJBQNGVNM-OKZBNKHCSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Cc2cccnc2)C=C1	BroadT	BRD-K05118861	BRD-K05118861-001-01-6	Broad Institute of MIT and Harvard	BRD-K05118861			CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Cc2cccnc2)C=C1	InChI=1S/C20H30N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5-8,13,16-18,25H,4,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18+/m0/s1	DTKWTAJBQNGVNM-OKZBNKHCSA-N	390.22670548							119079
BRD-K33770771	LSM-30529		54641035	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15+,16+/m0/s1	DMROSRCUXVWXJU-ARFHVFGLSA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	BroadT	BRD-K33770771	BRD-K33770771-001-01-9	Broad Institute of MIT and Harvard	BRD-K33770771			CC(C)NC(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15+,16+/m0/s1	DMROSRCUXVWXJU-ARFHVFGLSA-N	371.242021186							119080
BRD-K69438930	LSM-30530		54641002	InChI=1S/C17H25FN2O5S/c1-2-26(23,24)20-15-8-7-14(25-16(15)11-21)9-17(22)19-10-12-3-5-13(18)6-4-12/h3-6,14-16,20-21H,2,7-11H2,1H3,(H,19,22)/t14-,15-,16+/m0/s1	AXKSOFKOICMKIG-HRCADAONSA-N	CCS(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccc(F)cc2)O[C@@H]1CO	BroadT	BRD-K69438930	BRD-K69438930-001-01-8	Broad Institute of MIT and Harvard	BRD-K69438930			CCS(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C17H25FN2O5S/c1-2-26(23,24)20-15-8-7-14(25-16(15)11-21)9-17(22)19-10-12-3-5-13(18)6-4-12/h3-6,14-16,20-21H,2,7-11H2,1H3,(H,19,22)/t14-,15-,16+/m0/s1	AXKSOFKOICMKIG-HRCADAONSA-N	388.14682081							119081
BRD-K62497619	LSM-30531		54640776	InChI=1S/C28H35N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-14,24-26,32H,2,5-6,15-20H2,(H,29,34)(H,30,33)/t24-,25-,26-/m1/s1	UFNCHKMEJBOGRV-TWJOJJKGSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K62497619	BRD-K62497619-001-01-9	Broad Institute of MIT and Harvard	BRD-K62497619			OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H35N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-14,24-26,32H,2,5-6,15-20H2,(H,29,34)(H,30,33)/t24-,25-,26-/m1/s1	UFNCHKMEJBOGRV-TWJOJJKGSA-N	477.26275663							119082
BRD-K23956044	LSM-30532		54640918	InChI=1S/C19H28N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h4-5,7,11,14-16,24H,1-3,6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16+/m1/s1	DDEXDZVSNNOFMF-PMPSAXMXSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K23956044	BRD-K23956044-001-01-7	Broad Institute of MIT and Harvard	BRD-K23956044			OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C19H28N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h4-5,7,11,14-16,24H,1-3,6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16+/m1/s1	DDEXDZVSNNOFMF-PMPSAXMXSA-N	408.183126106							119083
BRD-K43381631	LSM-30533		54640904	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24-,25-/m0/s1	HQJSXCNUPDQHFZ-SDHOMARFSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)c4ccccc4	BroadT	BRD-K43381631	BRD-K43381631-001-01-3	Broad Institute of MIT and Harvard	BRD-K43381631			OC[C@@H]1O[C@@H](CC[C@@H]1NC(=O)c1ccccc1)CC(=O)Nc1ccc(cc1)-c1ccccc1	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24-,25-/m0/s1	HQJSXCNUPDQHFZ-SDHOMARFSA-N	444.204907396							119084
BRD-K48195722	LSM-30534		54641006	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16+/m0/s1	BTLHSRCDNJLGMU-HRCADAONSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NC(=O)Nc2c(C)onc2C)[C@@H](CO)O1	BroadT	BRD-K48195722	BRD-K48195722-001-01-2	Broad Institute of MIT and Harvard	BRD-K48195722			CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NC(=O)Nc2c(C)noc2C)[C@@H](CO)O1	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16+/m0/s1	BTLHSRCDNJLGMU-HRCADAONSA-N	411.248169206							119085
BRD-K22870904	LSM-30535		54640760	InChI=1S/C28H31N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-13,16,24-26,32H,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26-/m0/s1	LTCMWRCKDZHFDM-NXCFDTQHSA-N	COc1cccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO)c1	BroadT	BRD-K22870904	BRD-K22870904-001-01-0	Broad Institute of MIT and Harvard	BRD-K22870904			COc1cccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@H]2CO)c1	InChI=1S/C28H31N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-13,16,24-26,32H,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25+,26-/m0/s1	LTCMWRCKDZHFDM-NXCFDTQHSA-N	489.226371122							119086
BRD-K84199148	LSM-30536		54640797	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18+,19+/m0/s1	GHLUFTIHFDMMKJ-IPMKNSEASA-N	CCCc1cn(CC[C@@H]2CC[C@@H](NC(=O)C3CCCCC3)[C@@H](CO)O2)nn1	BroadT	BRD-K84199148	BRD-K84199148-001-01-5	Broad Institute of MIT and Harvard	BRD-K84199148			CCCc1cn(CC[C@@H]2CC[C@@H](NC(=O)C3CCCCC3)[C@@H](CO)O2)nn1	InChI=1S/C20H34N4O3/c1-2-6-16-13-24(23-22-16)12-11-17-9-10-18(19(14-25)27-17)21-20(26)15-7-4-3-5-8-15/h13,15,17-19,25H,2-12,14H2,1H3,(H,21,26)/t17-,18+,19+/m0/s1	GHLUFTIHFDMMKJ-IPMKNSEASA-N	378.263090988							119087
BRD-K59064238	LSM-30537		54641032	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16+/m1/s1	UDNDOFJZCBESNN-OAGGEKHMSA-N	CCC(=O)N[C@@H]1CC[C@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	BroadT	BRD-K59064238	BRD-K59064238-001-01-3	Broad Institute of MIT and Harvard	BRD-K59064238			CCC(=O)N[C@@H]1CC[C@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15-,16+/m1/s1	UDNDOFJZCBESNN-OAGGEKHMSA-N	340.236207524							119088
BRD-K27726273	LSM-30538		54640847	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19+/m1/s1	AQOAQYOOWGGKER-LZQZEXGQSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K27726273	BRD-K27726273-001-01-2	Broad Institute of MIT and Harvard	BRD-K27726273			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19+/m1/s1	AQOAQYOOWGGKER-LZQZEXGQSA-N	451.106561666							119089
BRD-K45860594	LSM-30539		54641040	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15-,16-/m0/s1	DMROSRCUXVWXJU-JYJNAYRXSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	BroadT	BRD-K45860594	BRD-K45860594-001-01-9	Broad Institute of MIT and Harvard	BRD-K45860594			CC(C)NC(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CCOCC2)O[C@H]1CO	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15-,16-/m0/s1	DMROSRCUXVWXJU-JYJNAYRXSA-N	371.242021186							119090
BRD-K25016708	LSM-30540		54640924	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15+,16+/m1/s1	LATIXEUUNJKTQG-PMPSAXMXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K25016708	BRD-K25016708-001-01-5	Broad Institute of MIT and Harvard	BRD-K25016708			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C18H28N2O5/c21-11-16-15(20-18(23)13-5-7-24-8-6-13)4-3-14(25-16)9-17(22)19-10-12-1-2-12/h3-4,12-16,21H,1-2,5-11H2,(H,19,22)(H,20,23)/t14-,15+,16+/m1/s1	LATIXEUUNJKTQG-PMPSAXMXSA-N	352.199822016							119091
BRD-K26689527	LSM-30541		54640874	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19+,20+/m1/s1	DOQFJJOYHUUDAI-HOJAQTOUSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K26689527	BRD-K26689527-001-01-7	Broad Institute of MIT and Harvard	BRD-K26689527			OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19+,20+/m1/s1	DOQFJJOYHUUDAI-HOJAQTOUSA-N	486.078297998							119092
CHEMBL3187082	LSM-30542	BRD-K49526793	54640906	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24-,25+/m1/s1	HQJSXCNUPDQHFZ-SDHSZQHLSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)c4ccccc4	BroadT	BRD-K49526793	BRD-K49526793-001-01-1	Broad Institute of MIT and Harvard	BRD-K49526793			OC[C@@H]1O[C@H](CC[C@H]1NC(=O)c1ccccc1)CC(=O)Nc1ccc(cc1)-c1ccccc1	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24-,25+/m1/s1	HQJSXCNUPDQHFZ-SDHSZQHLSA-N	444.204907396							119093
BRD-K99827210	LSM-30543		54640821	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20+,22-/m0/s1	WUPYLLMMUFNJPD-WEYGHZABSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3ccccc3F)CC[C@H]1NC(=O)Cc4ccncc4	BroadT	BRD-K99827210	BRD-K99827210-001-01-7	Broad Institute of MIT and Harvard	BRD-K99827210			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2ccccc2F)CC[C@H]1NC(=O)Cc1ccncc1	InChI=1S/C23H26FN5O3/c24-19-4-2-1-3-18(19)21-14-29(28-27-21)12-9-17-5-6-20(22(15-30)32-17)26-23(31)13-16-7-10-25-11-8-16/h1-4,7-8,10-11,14,17,20,22,30H,5-6,9,12-13,15H2,(H,26,31)/t17-,20+,22-/m0/s1	WUPYLLMMUFNJPD-WEYGHZABSA-N	439.201967942							119094
BRD-K79748783	LSM-30544		54640772	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20-,23+/m0/s1	KTXYXNLRJUMWJA-SXWKCWPCSA-N	OC[C@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)CC[C@@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K79748783	BRD-K79748783-001-01-6	Broad Institute of MIT and Harvard	BRD-K79748783			OC[C@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20-,23+/m0/s1	KTXYXNLRJUMWJA-SXWKCWPCSA-N	452.194736636							119095
BRD-K72892670	LSM-30545		54640744	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23+/m1/s1	PFEWRFQNGBURGF-ZLNRFVROSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2C=C[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K72892670	BRD-K72892670-001-01-5	Broad Institute of MIT and Harvard	BRD-K72892670			Cc1noc(C)c1NC(=O)N[C@@H]1C=C[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@H]1CO	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23+/m1/s1	PFEWRFQNGBURGF-ZLNRFVROSA-N	476.205970036							119096
BRD-K45428339	LSM-30546		54641010	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15+/m0/s1	LJGUQBBKFZFLJA-RRFJBIMHSA-N	CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	BroadT	BRD-K45428339	BRD-K45428339-001-01-5	Broad Institute of MIT and Harvard	BRD-K45428339			CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14+,15+/m0/s1	LJGUQBBKFZFLJA-RRFJBIMHSA-N	356.242355544							119097
BRD-K76701247	LSM-30547		54640941	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15+,16-/m1/s1	IVJDFQRYYIVNGV-OWCLPIDISA-N	CCC(=O)N[C@H]1CC[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@@H]1CO	BroadT	BRD-K76701247	BRD-K76701247-001-01-8	Broad Institute of MIT and Harvard	BRD-K76701247			CCC(=O)N[C@H]1CC[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@@H]1CO	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15+,16-/m1/s1	IVJDFQRYYIVNGV-OWCLPIDISA-N	417.187540942							119098
BRD-K01709173	LSM-30548		54641028	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16+/m1/s1	UDNDOFJZCBESNN-PMPSAXMXSA-N	CCC(=O)N[C@H]1CC[C@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	BroadT	BRD-K01709173	BRD-K01709173-001-01-9	Broad Institute of MIT and Harvard	BRD-K01709173			CCC(=O)N[C@H]1CC[C@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16+/m1/s1	UDNDOFJZCBESNN-PMPSAXMXSA-N	340.236207524							119099
BRD-K93516545	LSM-30549		54640854	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19-,20-/m1/s1	KCRDNBZRFZAOKR-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K93516545	BRD-K93516545-001-01-8	Broad Institute of MIT and Harvard	BRD-K93516545			OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19-,20-/m1/s1	KCRDNBZRFZAOKR-VAMGGRTRSA-N	465.12221173							119100
BRD-K07525144	LSM-30550		54640972	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18-,19-/m1/s1	ZGRBCZVMEMXSST-BHIYHBOVSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K07525144	BRD-K07525144-001-01-9	Broad Institute of MIT and Harvard	BRD-K07525144			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18-,19-/m1/s1	ZGRBCZVMEMXSST-BHIYHBOVSA-N	453.112519298							119101
BRD-K06718330	LSM-30551		54640843	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19+/m0/s1	AQOAQYOOWGGKER-KFKAGJAMSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K06718330	BRD-K06718330-001-01-5	Broad Institute of MIT and Harvard	BRD-K06718330			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19+/m0/s1	AQOAQYOOWGGKER-KFKAGJAMSA-N	451.106561666							119102
BRD-K28448768	LSM-30552		54640977	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21-/m0/s1	YNMAXJORQBUKHH-CZGNIMDHSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K28448768	BRD-K28448768-001-01-4	Broad Institute of MIT and Harvard	BRD-K28448768			C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21-/m0/s1	YNMAXJORQBUKHH-CZGNIMDHSA-N	411.215806438							119103
BRD-K20846358	LSM-30553		54640885	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18+/m0/s1	MINIXHYBIVPWCS-QILLFSRXSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K20846358	BRD-K20846358-001-01-3	Broad Institute of MIT and Harvard	BRD-K20846358			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18+/m0/s1	MINIXHYBIVPWCS-QILLFSRXSA-N	402.170333456							119104
BRD-K55209210	LSM-30554		54640743	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23+/m0/s1	PFEWRFQNGBURGF-RJGXRXQPSA-N	Cc1onc(C)c1NC(=O)N[C@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K55209210	BRD-K55209210-001-01-0	Broad Institute of MIT and Harvard	BRD-K55209210			Cc1noc(C)c1NC(=O)N[C@H]1C=C[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22-,23+/m0/s1	PFEWRFQNGBURGF-RJGXRXQPSA-N	476.205970036							119105
BRD-K64215924	LSM-30555		54641041	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15+,16-/m1/s1	DMROSRCUXVWXJU-OWCLPIDISA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	BroadT	BRD-K64215924	BRD-K64215924-001-01-3	Broad Institute of MIT and Harvard	BRD-K64215924			CC(C)NC(=O)N[C@H]1CC[C@H](CCNC(=O)C2CCOCC2)O[C@@H]1CO	InChI=1S/C18H33N3O5/c1-12(2)20-18(24)21-15-4-3-14(26-16(15)11-22)5-8-19-17(23)13-6-9-25-10-7-13/h12-16,22H,3-11H2,1-2H3,(H,19,23)(H2,20,21,24)/t14-,15+,16-/m1/s1	DMROSRCUXVWXJU-OWCLPIDISA-N	371.242021186							119106
BRD-K17136501	LSM-30556		54640873	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22+,23-/m0/s1	RXWWLGBTGKBRLQ-WWNPGLIZSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K17136501	BRD-K17136501-001-01-0	Broad Institute of MIT and Harvard	BRD-K17136501			OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22+,23-/m0/s1	RXWWLGBTGKBRLQ-WWNPGLIZSA-N	489.173369916							119107
BRD-K77082178	LSM-30557		54640908	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24+,25-/m0/s1	HQJSXCNUPDQHFZ-GVAUOCQISA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)c4ccccc4	BroadT	BRD-K77082178	BRD-K77082178-001-01-5	Broad Institute of MIT and Harvard	BRD-K77082178			OC[C@@H]1O[C@@H](CC[C@H]1NC(=O)c1ccccc1)CC(=O)Nc1ccc(cc1)-c1ccccc1	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24+,25-/m0/s1	HQJSXCNUPDQHFZ-GVAUOCQISA-N	444.204907396							119108
BRD-K74651253	LSM-30558		54640791	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17-,18-/m1/s1	KPQAGDNSAAOMGS-KZNAEPCWSA-N	CN1CCN(CC1)C(=O)C[C@@H]2O[C@H](CO)[C@H](NC(=O)Cc3ccccn3)C=C2	BroadT	BRD-K74651253	BRD-K74651253-001-01-8	Broad Institute of MIT and Harvard	BRD-K74651253			CN1CCN(CC1)C(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Cc2ccccn2)C=C1	InChI=1S/C20H28N4O4/c1-23-8-10-24(11-9-23)20(27)13-16-5-6-17(18(14-25)28-16)22-19(26)12-15-4-2-3-7-21-15/h2-7,16-18,25H,8-14H2,1H3,(H,22,26)/t16-,17-,18-/m1/s1	KPQAGDNSAAOMGS-KZNAEPCWSA-N	388.211055416							119109
BRD-K66649343	LSM-30559		54640991	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21+/m1/s1	YNMAXJORQBUKHH-RCOXNQKVSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K66649343	BRD-K66649343-001-01-4	Broad Institute of MIT and Harvard	BRD-K66649343			C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21+/m1/s1	YNMAXJORQBUKHH-RCOXNQKVSA-N	411.215806438							119110
BRD-K14695590	LSM-30560		54640845	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19-/m0/s1	AQOAQYOOWGGKER-SNRMKQJTSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K14695590	BRD-K14695590-001-01-0	Broad Institute of MIT and Harvard	BRD-K14695590			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18-,19-/m0/s1	AQOAQYOOWGGKER-SNRMKQJTSA-N	451.106561666							119111
BRD-K04883778	LSM-30561		54640740	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23+/m0/s1	PFEWRFQNGBURGF-YTFSRNRJSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K04883778	BRD-K04883778-001-01-8	Broad Institute of MIT and Harvard	BRD-K04883778			Cc1noc(C)c1NC(=O)N[C@@H]1C=C[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C26H28N4O5/c1-16-25(17(2)35-30-16)29-26(33)28-22-13-12-21(34-23(22)15-31)14-24(32)27-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,21-23,31H,14-15H2,1-2H3,(H,27,32)(H2,28,29,33)/t21-,22+,23+/m0/s1	PFEWRFQNGBURGF-YTFSRNRJSA-N	476.205970036							119112
BRD-K99413603	LSM-30562		54640945	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15+,16-/m0/s1	IVJDFQRYYIVNGV-XHSDSOJGSA-N	CCC(=O)N[C@@H]1CC[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@H]1CO	BroadT	BRD-K99413603	BRD-K99413603-001-01-1	Broad Institute of MIT and Harvard	BRD-K99413603			CCC(=O)N[C@@H]1CC[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)O[C@H]1CO	InChI=1S/C19H26F3N3O4/c1-2-17(27)25-15-8-7-14(29-16(15)11-26)9-10-23-18(28)24-13-5-3-12(4-6-13)19(20,21)22/h3-6,14-16,26H,2,7-11H2,1H3,(H,25,27)(H2,23,24,28)/t14-,15+,16-/m0/s1	IVJDFQRYYIVNGV-XHSDSOJGSA-N	417.187540942							119113
BRD-K24377650	LSM-30563		54640775	InChI=1S/C28H35N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-14,24-26,32H,2,5-6,15-20H2,(H,29,34)(H,30,33)/t24-,25+,26+/m1/s1	UFNCHKMEJBOGRV-ZNZIZOMTSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K24377650	BRD-K24377650-001-01-0	Broad Institute of MIT and Harvard	BRD-K24377650			OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H35N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-14,24-26,32H,2,5-6,15-20H2,(H,29,34)(H,30,33)/t24-,25+,26+/m1/s1	UFNCHKMEJBOGRV-ZNZIZOMTSA-N	477.26275663							119114
BRD-K93153656	LSM-30564		54640964	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21+/m1/s1	KEJHSICNFQEVJK-SKBHOOIQSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K93153656	BRD-K93153656-001-01-5	Broad Institute of MIT and Harvard	BRD-K93153656			C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21+/m1/s1	KEJHSICNFQEVJK-SKBHOOIQSA-N	448.14682081							119115
BRD-K21449711	LSM-30565		54640871	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22-,23+/m1/s1	RXWWLGBTGKBRLQ-MZYLBHOOSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K21449711	BRD-K21449711-001-01-7	Broad Institute of MIT and Harvard	BRD-K21449711			OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22-,23+/m1/s1	RXWWLGBTGKBRLQ-MZYLBHOOSA-N	489.173369916							119116
BRD-K76713927	LSM-30566		54640914	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18+/m1/s1	UMDIUEAUIUREDG-KURKYZTESA-N	CCCNC(=O)N[C@@H]1CC[C@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	BroadT	BRD-K76713927	BRD-K76713927-001-01-0	Broad Institute of MIT and Harvard	BRD-K76713927			CCCNC(=O)N[C@@H]1CC[C@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18+/m1/s1	UMDIUEAUIUREDG-KURKYZTESA-N	377.231456502							119117
BRD-K47285393	LSM-30567		54640974	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18-,19+/m0/s1	ZGRBCZVMEMXSST-YTQUADARSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K47285393	BRD-K47285393-001-01-0	Broad Institute of MIT and Harvard	BRD-K47285393			OC[C@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)c1ccncc1	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18-,19+/m0/s1	ZGRBCZVMEMXSST-YTQUADARSA-N	453.112519298							119118
BRD-K97962579	LSM-30568		54640910	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18+/m1/s1	UMDIUEAUIUREDG-SQNIBIBYSA-N	CCCNC(=O)N[C@H]1CC[C@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	BroadT	BRD-K97962579	BRD-K97962579-001-01-9	Broad Institute of MIT and Harvard	BRD-K97962579			CCCNC(=O)N[C@H]1CC[C@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18+/m1/s1	UMDIUEAUIUREDG-SQNIBIBYSA-N	377.231456502							119119
BRD-K43192646	LSM-30569		54640869	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22-,23-/m0/s1	RXWWLGBTGKBRLQ-PMVMPFDFSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K43192646	BRD-K43192646-001-01-7	Broad Institute of MIT and Harvard	BRD-K43192646			OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22-,23-/m0/s1	RXWWLGBTGKBRLQ-PMVMPFDFSA-N	489.173369916							119120
BRD-K05071020-001-01-5	LSM-30570	BRD-K05071020	54640985	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21-/m1/s1	YNMAXJORQBUKHH-MBPVOVBZSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K05071020	BRD-K05071020-001-01-5	Broad Institute of MIT and Harvard	BRD-K05071020			C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20+,21-/m1/s1	YNMAXJORQBUKHH-MBPVOVBZSA-N	411.215806438							119121
BRD-K35058762	LSM-30571		54640898	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17-,18+/m0/s1	WYLNQZCZILOHII-OKZBNKHCSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K35058762	BRD-K35058762-001-01-8	Broad Institute of MIT and Harvard	BRD-K35058762			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17-,18+/m0/s1	WYLNQZCZILOHII-OKZBNKHCSA-N	441.187540942							119122
BRD-K01166365	LSM-30572		54640839	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18-,20-/m0/s1	RRAIEYROWAKKHB-BJLQDIEVSA-N	CC(C)c1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)Cc3ccccc3)[C@H](CO)O2)nn1	BroadT	BRD-K01166365	BRD-K01166365-001-01-0	Broad Institute of MIT and Harvard	BRD-K01166365			CC(C)c1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)Cc3ccccc3)[C@H](CO)O2)nn1	InChI=1S/C20H30N4O4S/c1-15(2)19-12-24(23-21-19)11-10-17-8-9-18(20(13-25)28-17)22-29(26,27)14-16-6-4-3-5-7-16/h3-7,12,15,17-18,20,22,25H,8-11,13-14H2,1-2H3/t17-,18-,20-/m0/s1	RRAIEYROWAKKHB-BJLQDIEVSA-N	422.19877617							119123
BRD-K10513366	LSM-30573		54640849	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19-/m0/s1	AQOAQYOOWGGKER-IPELMVKDSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K10513366	BRD-K10513366-001-01-1	Broad Institute of MIT and Harvard	BRD-K10513366			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C21H23Cl2N3O4/c22-16-5-3-13(8-17(16)23)10-25-20(28)9-15-4-6-18(19(12-27)30-15)26-21(29)14-2-1-7-24-11-14/h1-3,5,7-8,11,15,18-19,27H,4,6,9-10,12H2,(H,25,28)(H,26,29)/t15-,18+,19-/m0/s1	AQOAQYOOWGGKER-IPELMVKDSA-N	451.106561666							119124
BRD-K88997070	LSM-30574		54640915	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18-/m1/s1	UMDIUEAUIUREDG-FGTMMUONSA-N	CCCNC(=O)N[C@H]1CC[C@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	BroadT	BRD-K88997070	BRD-K88997070-001-01-0	Broad Institute of MIT and Harvard	BRD-K88997070			CCCNC(=O)N[C@H]1CC[C@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	InChI=1S/C20H31N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-7,16-18,24H,2,8-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18-/m1/s1	UMDIUEAUIUREDG-FGTMMUONSA-N	377.231456502							119125
BRD-K14087001	LSM-30575		54640771	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20-,23+/m1/s1	KTXYXNLRJUMWJA-VIZSFHNOSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2Cc3ccccc3C2)CC[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K14087001	BRD-K14087001-001-01-3	Broad Institute of MIT and Harvard	BRD-K14087001			OC[C@@H]1O[C@@H](CC(=O)NC2Cc3ccccc3C2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20-,23+/m1/s1	KTXYXNLRJUMWJA-VIZSFHNOSA-N	452.194736636							119126
BRD-K48448518	LSM-30576		54640826	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15+,16-/m1/s1	CAIOSQFPDHZSIB-OWCLPIDISA-N	COCc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3c(C)onc3C)[C@@H](CO)O2)nn1	BroadT	BRD-K48448518	BRD-K48448518-001-01-3	Broad Institute of MIT and Harvard	BRD-K48448518			COCc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3c(C)noc3C)[C@@H](CO)O2)nn1	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15+,16-/m1/s1	CAIOSQFPDHZSIB-OWCLPIDISA-N	408.212118056							119127
BRD-K55642725	LSM-30577		54640950	InChI=1S/C22H28N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,19-21,24-25H,2,12-15H2,1H3,(H,23,26)/t19-,20+,21-/m1/s1	DNFBTYFNFJSDKD-QHAWAJNXSA-N	CCS(=O)(=O)N[C@H]1CC[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)O[C@@H]1CO	BroadT	BRD-K55642725	BRD-K55642725-001-01-0	Broad Institute of MIT and Harvard	BRD-K55642725			CCS(=O)(=O)N[C@H]1CC[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C22H28N2O5S/c1-2-30(27,28)24-20-13-12-19(29-21(20)15-25)14-22(26)23-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,19-21,24-25H,2,12-15H2,1H3,(H,23,26)/t19-,20+,21-/m1/s1	DNFBTYFNFJSDKD-QHAWAJNXSA-N	432.171892706							119128
BRD-K51697315	LSM-30578		54640971	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18-,19+/m1/s1	ZGRBCZVMEMXSST-QRQLOZEOSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K51697315	BRD-K51697315-001-01-4	Broad Institute of MIT and Harvard	BRD-K51697315			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C20H24ClN3O5S/c21-15-2-1-3-17(12-15)30(27,28)23-11-8-16-4-5-18(19(13-25)29-16)24-20(26)14-6-9-22-10-7-14/h1-3,6-7,9-10,12,16,18-19,23,25H,4-5,8,11,13H2,(H,24,26)/t16-,18-,19+/m1/s1	ZGRBCZVMEMXSST-QRQLOZEOSA-N	453.112519298							119129
BRD-K26767874	LSM-30579		54640865	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18+,19-/m0/s1	ZJAQJJRCHWWGEL-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K26767874	BRD-K26767874-001-01-0	Broad Institute of MIT and Harvard	BRD-K26767874			OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18+,19-/m0/s1	ZJAQJJRCHWWGEL-OTWHNJEPSA-N	420.237270164							119130
BRD-K10010414	LSM-30580		54640756	InChI=1S/C28H31N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-13,16,24-26,32H,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25-,26-/m1/s1	LTCMWRCKDZHFDM-TWJOJJKGSA-N	COc1cccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO)c1	BroadT	BRD-K10010414	BRD-K10010414-001-01-0	Broad Institute of MIT and Harvard	BRD-K10010414			COc1cccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)O[C@@H]2CO)c1	InChI=1S/C28H31N3O5/c1-35-23-9-5-8-22(16-23)30-28(34)31-25-15-14-24(36-26(25)18-32)17-27(33)29-21-12-10-20(11-13-21)19-6-3-2-4-7-19/h2-13,16,24-26,32H,14-15,17-18H2,1H3,(H,29,33)(H2,30,31,34)/t24-,25-,26-/m1/s1	LTCMWRCKDZHFDM-TWJOJJKGSA-N	489.226371122							119131
BRD-K02781189	LSM-30581		54640902	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24+,25+/m1/s1	HQJSXCNUPDQHFZ-DSITVLBTSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)c4ccccc4	BroadT	BRD-K02781189	BRD-K02781189-001-01-9	Broad Institute of MIT and Harvard	BRD-K02781189			OC[C@@H]1O[C@H](CC[C@@H]1NC(=O)c1ccccc1)CC(=O)Nc1ccc(cc1)-c1ccccc1	InChI=1S/C27H28N2O4/c30-18-25-24(29-27(32)21-9-5-2-6-10-21)16-15-23(33-25)17-26(31)28-22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-14,23-25,30H,15-18H2,(H,28,31)(H,29,32)/t23-,24+,25+/m1/s1	HQJSXCNUPDQHFZ-DSITVLBTSA-N	444.204907396							119132
BRD-K47984776	LSM-30582		54640831	InChI=1S/C15H26N2O5S/c1-2-23(20,21)16-13-7-6-12(22-14(13)11-18)10-15(19)17-8-4-3-5-9-17/h6-7,12-14,16,18H,2-5,8-11H2,1H3/t12-,13-,14-/m0/s1	RUXRIVSLYZEBAJ-IHRRRGAJSA-N	CCS(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K47984776	BRD-K47984776-001-01-5	Broad Institute of MIT and Harvard	BRD-K47984776			CCS(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C15H26N2O5S/c1-2-23(20,21)16-13-7-6-12(22-14(13)11-18)10-15(19)17-8-4-3-5-9-17/h6-7,12-14,16,18H,2-5,8-11H2,1H3/t12-,13-,14-/m0/s1	RUXRIVSLYZEBAJ-IHRRRGAJSA-N	346.156242642							119133
BRD-K43926323	LSM-30583		54640958	InChI=1S/C19H24FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-6,15-17,24H,7-12H2,(H2,21,22,26)/t15-,16+,17+/m0/s1	TXBZUYXXZRGZTP-GVDBMIGSSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)Nc3ccc(F)cc3	BroadT	BRD-K43926323	BRD-K43926323-001-01-8	Broad Institute of MIT and Harvard	BRD-K43926323			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)Nc1ccc(F)cc1	InChI=1S/C19H24FN3O5/c20-13-1-3-14(4-2-13)21-19(26)22-16-6-5-15(28-17(16)12-24)11-18(25)23-7-9-27-10-8-23/h1-6,15-17,24H,7-12H2,(H2,21,22,26)/t15-,16+,17+/m0/s1	TXBZUYXXZRGZTP-GVDBMIGSSA-N	393.169999098							119134
BRD-K34209560	LSM-30584		54641012	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15-/m1/s1	LJGUQBBKFZFLJA-RBSFLKMASA-N	CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	BroadT	BRD-K34209560	BRD-K34209560-001-01-2	Broad Institute of MIT and Harvard	BRD-K34209560			CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)NCCCN(C)C)O[C@@H]1CO	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15-/m1/s1	LJGUQBBKFZFLJA-RBSFLKMASA-N	356.242355544							119135
BRD-K71460915	LSM-30585		54640828	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15-,16+/m0/s1	CAIOSQFPDHZSIB-HRCADAONSA-N	COCc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3c(C)onc3C)[C@@H](CO)O2)nn1	BroadT	BRD-K71460915	BRD-K71460915-001-01-7	Broad Institute of MIT and Harvard	BRD-K71460915			COCc1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3c(C)noc3C)[C@@H](CO)O2)nn1	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15-,16+/m0/s1	CAIOSQFPDHZSIB-HRCADAONSA-N	408.212118056							119136
BRD-K11423211	LSM-30586		54640877	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19-,20-/m0/s1	DOQFJJOYHUUDAI-IHPCNDPISA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K11423211	BRD-K11423211-001-01-9	Broad Institute of MIT and Harvard	BRD-K11423211			OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19-,20-/m0/s1	DOQFJJOYHUUDAI-IHPCNDPISA-N	486.078297998							119137
BRD-K02610196	LSM-30587		54640861	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18-,19-/m0/s1	ZJAQJJRCHWWGEL-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K02610196	BRD-K02610196-001-01-1	Broad Institute of MIT and Harvard	BRD-K02610196			OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18-,19-/m0/s1	ZJAQJJRCHWWGEL-FHWLQOOXSA-N	420.237270164							119138
BRD-K93950127-001-01-5	LSM-30588	BRD-K93950127	54640962	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21+/m0/s1	KEJHSICNFQEVJK-CEDBRAGKSA-N	C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K93950127	BRD-K93950127-001-01-5	Broad Institute of MIT and Harvard	BRD-K93950127			C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21+/m0/s1	KEJHSICNFQEVJK-CEDBRAGKSA-N	448.14682081							119139
BRD-K12984952	LSM-30589		54641008	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16-/m1/s1	BTLHSRCDNJLGMU-OWCLPIDISA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@H](NC(=O)Nc2c(C)onc2C)[C@@H](CO)O1	BroadT	BRD-K12984952	BRD-K12984952-001-01-2	Broad Institute of MIT and Harvard	BRD-K12984952			CN(C)CCCNC(=O)C[C@H]1CC[C@H](NC(=O)Nc2c(C)noc2C)[C@@H](CO)O1	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15+,16-/m1/s1	BTLHSRCDNJLGMU-OWCLPIDISA-N	411.248169206							119140
BRD-K29301364	LSM-30590		54640897	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17-,18-/m0/s1	WYLNQZCZILOHII-BZSNNMDCSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K29301364	BRD-K29301364-001-01-2	Broad Institute of MIT and Harvard	BRD-K29301364			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17-,18-/m0/s1	WYLNQZCZILOHII-BZSNNMDCSA-N	441.187540942							119141
BRD-K99833695	LSM-30591		54640989	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21+/m0/s1	YNMAXJORQBUKHH-NASSWSRMSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K99833695	BRD-K99833695-001-01-9	Broad Institute of MIT and Harvard	BRD-K99833695			C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C23H29N3O4/c1-16(17-7-3-2-4-8-17)25-23(29)14-19-10-11-20(21(15-27)30-19)26-22(28)13-18-9-5-6-12-24-18/h2-9,12,16,19-21,27H,10-11,13-15H2,1H3,(H,25,29)(H,26,28)/t16-,19+,20-,21+/m0/s1	YNMAXJORQBUKHH-NASSWSRMSA-N	411.215806438							119142
BRD-K23461342	LSM-30592		54640823	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15+,16+/m1/s1	CAIOSQFPDHZSIB-PMPSAXMXSA-N	COCc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3c(C)onc3C)[C@H](CO)O2)nn1	BroadT	BRD-K23461342	BRD-K23461342-001-01-7	Broad Institute of MIT and Harvard	BRD-K23461342			COCc1cn(CC[C@H]2CC[C@H](NC(=O)Nc3c(C)noc3C)[C@H](CO)O2)nn1	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15+,16+/m1/s1	CAIOSQFPDHZSIB-PMPSAXMXSA-N	408.212118056							119143
BRD-K26399271	LSM-30593		54640747	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19+/m0/s1	SLCLMSLRMDGYCU-IPMKNSEASA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K26399271	BRD-K26399271-001-01-1	Broad Institute of MIT and Harvard	BRD-K26399271			OC[C@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H31F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-18-8-7-17(33-19(18)14-30)13-20(31)26-9-12-29-10-1-2-11-29/h3-6,17-19,30H,1-2,7-14H2,(H,26,31)(H2,27,28,32)/t17-,18+,19+/m0/s1	SLCLMSLRMDGYCU-IPMKNSEASA-N	472.229740112							119144
BRD-K48207398	LSM-30594		54640968	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21-/m0/s1	KEJHSICNFQEVJK-MEGFKASBSA-N	C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K48207398	BRD-K48207398-001-01-8	Broad Institute of MIT and Harvard	BRD-K48207398			C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21-/m0/s1	KEJHSICNFQEVJK-MEGFKASBSA-N	448.14682081							119145
BRD-K98876398	LSM-30595		54640893	InChI=1S/C24H26N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,14,16,20-22,27,29H,13,15H2,1H3,(H,26,30)/t20-,21-,22+/m0/s1	RYZOUXVVIYMMJY-FDFHNCONSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K98876398	BRD-K98876398-001-01-9	Broad Institute of MIT and Harvard	BRD-K98876398			Cn1cnc(c1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C24H26N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,14,16,20-22,27,29H,13,15H2,1H3,(H,26,30)/t20-,21-,22+/m0/s1	RYZOUXVVIYMMJY-FDFHNCONSA-N	482.162390662							119146
BRD-K37989903	LSM-30596		54640867	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22+,23+/m1/s1	RXWWLGBTGKBRLQ-PUHATCMVSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@@H]1NS(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K37989903	BRD-K37989903-001-01-2	Broad Institute of MIT and Harvard	BRD-K37989903			OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C24H28FN3O5S/c25-18-6-9-21(10-7-18)34(31,32)26-22-11-8-20(33-23(22)17-29)16-24(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20,22-23,26,29H,12-17H2/t20-,22+,23+/m1/s1	RXWWLGBTGKBRLQ-PUHATCMVSA-N	489.173369916							119147
BRD-K18629365	LSM-30597		54640999	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20-,21-/m0/s1	DVSDZAFRLPIFCS-JBACZVJFSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CCNC(=O)C3CCCCC3)O[C@H]2CO	BroadT	BRD-K18629365	BRD-K18629365-001-01-8	Broad Institute of MIT and Harvard	BRD-K18629365			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CCNC(=O)C2CCCCC2)O[C@H]1CO	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20-,21-/m0/s1	DVSDZAFRLPIFCS-JBACZVJFSA-N	438.218842898							119148
BRD-K03901181	LSM-30598		54640808	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23-,24+/m0/s1	RLBPWNWBWPNMOA-KMDXXIMOSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)CC4CC4	BroadT	BRD-K03901181	BRD-K03901181-001-01-0	Broad Institute of MIT and Harvard	BRD-K03901181			OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)CC1CC1	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23-,24+/m0/s1	RLBPWNWBWPNMOA-KMDXXIMOSA-N	434.22055746							119149
BRD-K66821167	LSM-30599		54640788	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17+,19-/m0/s1	QKYXERGZTDIPLJ-SCTDSRPQSA-N	CC(C)c1cn(CC[C@@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)nn1	BroadT	BRD-K66821167	BRD-K66821167-001-01-2	Broad Institute of MIT and Harvard	BRD-K66821167			CC(C)c1cn(CC[C@@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)nn1	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17+,19-/m0/s1	QKYXERGZTDIPLJ-SCTDSRPQSA-N	390.206718964							119150
BRD-K90962922	LSM-30600		54640889	InChI=1S/C24H26N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,14,16,20-22,27,29H,13,15H2,1H3,(H,26,30)/t20-,21+,22+/m0/s1	RYZOUXVVIYMMJY-BHDDXSALSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)Nc3ccc(cc3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K90962922	BRD-K90962922-001-01-0	Broad Institute of MIT and Harvard	BRD-K90962922			Cn1cnc(c1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)O[C@@H]1CO	InChI=1S/C24H26N4O5S/c1-28-14-24(25-16-28)34(31,32)27-21-12-11-20(33-22(21)15-29)13-23(30)26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,14,16,20-22,27,29H,13,15H2,1H3,(H,26,30)/t20-,21+,22+/m0/s1	RYZOUXVVIYMMJY-BHDDXSALSA-N	482.162390662							119151
BRD-K54024474	LSM-30601		54640787	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17+,19-/m1/s1	QKYXERGZTDIPLJ-ZIFCJYIRSA-N	CC(C)c1cn(CC[C@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)nn1	BroadT	BRD-K54024474	BRD-K54024474-001-01-5	Broad Institute of MIT and Harvard	BRD-K54024474			CC(C)c1cn(CC[C@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)nn1	InChI=1S/C20H27FN4O3/c1-13(2)18-11-25(24-23-18)9-8-16-6-7-17(19(12-26)28-16)22-20(27)14-4-3-5-15(21)10-14/h3-5,10-11,13,16-17,19,26H,6-9,12H2,1-2H3,(H,22,27)/t16-,17+,19-/m1/s1	QKYXERGZTDIPLJ-ZIFCJYIRSA-N	390.206718964							119152
BRD-K44537081	LSM-30602		54640850	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19+,20+/m0/s1	KCRDNBZRFZAOKR-XUVXKRRUSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K44537081	BRD-K44537081-001-01-4	Broad Institute of MIT and Harvard	BRD-K44537081			OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H25Cl2N3O4/c23-15-9-14(10-16(24)11-15)22(30)26-8-6-18-4-5-19(20(13-28)31-18)27-21(29)12-17-3-1-2-7-25-17/h1-3,7,9-11,18-20,28H,4-6,8,12-13H2,(H,26,30)(H,27,29)/t18-,19+,20+/m0/s1	KCRDNBZRFZAOKR-XUVXKRRUSA-N	465.12221173							119153
BRD-K50400833	LSM-30603		54640829	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15+,16-/m0/s1	CAIOSQFPDHZSIB-XHSDSOJGSA-N	COCc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3c(C)onc3C)[C@H](CO)O2)nn1	BroadT	BRD-K50400833	BRD-K50400833-001-01-7	Broad Institute of MIT and Harvard	BRD-K50400833			COCc1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3c(C)noc3C)[C@H](CO)O2)nn1	InChI=1S/C18H28N6O5/c1-11-17(12(2)29-22-11)20-18(26)19-15-5-4-14(28-16(15)9-25)6-7-24-8-13(10-27-3)21-23-24/h8,14-16,25H,4-7,9-10H2,1-3H3,(H2,19,20,26)/t14-,15+,16-/m0/s1	CAIOSQFPDHZSIB-XHSDSOJGSA-N	408.212118056							119154
BRD-K82082713	LSM-30604		54640887	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18-/m1/s1	MINIXHYBIVPWCS-UWWQBHOKSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K82082713	BRD-K82082713-001-01-0	Broad Institute of MIT and Harvard	BRD-K82082713			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-4,7-8,11,14,16,18,26H,5-6,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18-/m1/s1	MINIXHYBIVPWCS-UWWQBHOKSA-N	402.170333456							119155
BRD-K71775851	LSM-30605		54640864	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18+,19-/m1/s1	ZJAQJJRCHWWGEL-CEXWTWQISA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K71775851	BRD-K71775851-001-01-4	Broad Institute of MIT and Harvard	BRD-K71775851			OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H32N4O5/c26-15-19-18(24-21(28)14-25-9-11-29-12-10-25)2-1-17(30-19)13-20(27)23-8-5-16-3-6-22-7-4-16/h3-4,6-7,17-19,26H,1-2,5,8-15H2,(H,23,27)(H,24,28)/t17-,18+,19-/m1/s1	ZJAQJJRCHWWGEL-CEXWTWQISA-N	420.237270164							119156
BRD-K42214389	LSM-30606		54640993	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20+,21+/m0/s1	DVSDZAFRLPIFCS-CEWLAPEOSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CCNC(=O)C3CCCCC3)O[C@@H]2CO	BroadT	BRD-K42214389	BRD-K42214389-001-01-1	Broad Institute of MIT and Harvard	BRD-K42214389			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNC(=O)C2CCCCC2)O[C@@H]1CO	InChI=1S/C22H34N2O5S/c1-16-7-10-19(11-8-16)30(27,28)24-20-12-9-18(29-21(20)15-25)13-14-23-22(26)17-5-3-2-4-6-17/h7-8,10-11,17-18,20-21,24-25H,2-6,9,12-15H2,1H3,(H,23,26)/t18-,20+,21+/m0/s1	DVSDZAFRLPIFCS-CEWLAPEOSA-N	438.218842898							119157
BRD-K39863565	LSM-30607		54641015	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15+/m1/s1	LJGUQBBKFZFLJA-KFWWJZLASA-N	CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)NCCCN(C)C)O[C@H]1CO	BroadT	BRD-K39863565	BRD-K39863565-001-01-6	Broad Institute of MIT and Harvard	BRD-K39863565			CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)NCCCN(C)C)O[C@H]1CO	InChI=1S/C17H32N4O4/c1-12(2)19-17(24)20-14-7-6-13(25-15(14)11-22)10-16(23)18-8-5-9-21(3)4/h6-7,12-15,22H,5,8-11H2,1-4H3,(H,18,23)(H2,19,20,24)/t13-,14-,15+/m1/s1	LJGUQBBKFZFLJA-KFWWJZLASA-N	356.242355544							119158
BRD-K78439758	LSM-30608		54640806	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23+,24+/m1/s1	RLBPWNWBWPNMOA-SGNDLWITSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C=C[C@@H]1NC(=O)CC4CC4	BroadT	BRD-K78439758	BRD-K78439758-001-01-4	Broad Institute of MIT and Harvard	BRD-K78439758			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C=C[C@@H]1NC(=O)CC1CC1	InChI=1S/C26H30N2O4/c29-17-24-23(28-26(31)14-18-6-7-18)13-12-22(32-24)15-25(30)27-16-19-8-10-21(11-9-19)20-4-2-1-3-5-20/h1-5,8-13,18,22-24,29H,6-7,14-17H2,(H,27,30)(H,28,31)/t22-,23+,24+/m1/s1	RLBPWNWBWPNMOA-SGNDLWITSA-N	434.22055746							119159
BRD-K99690279	LSM-30609		54640876	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19-,20+/m1/s1	DOQFJJOYHUUDAI-RLLQIKCJSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K99690279	BRD-K99690279-001-01-7	Broad Institute of MIT and Harvard	BRD-K99690279			OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H24Cl2N2O5S/c22-15-10-14(11-16(23)12-15)21(27)24-9-8-17-6-7-19(20(13-26)30-17)25-31(28,29)18-4-2-1-3-5-18/h1-5,10-12,17,19-20,25-26H,6-9,13H2,(H,24,27)/t17-,19-,20+/m1/s1	DOQFJJOYHUUDAI-RLLQIKCJSA-N	486.078297998							119160
BRD-K76202128	LSM-30610		54640937	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13+,14-/m0/s1	BRLNHSCHDPURAU-YUTCNCBUSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)O)O[C@H]2CO	BroadT	BRD-K76202128	BRD-K76202128-001-01-1	Broad Institute of MIT and Harvard	BRD-K76202128			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(O)=O)O[C@H]1CO	InChI=1S/C15H21NO6S/c1-10-2-5-12(6-3-10)23(20,21)16-13-7-4-11(8-15(18)19)22-14(13)9-17/h2-3,5-6,11,13-14,16-17H,4,7-9H2,1H3,(H,18,19)/t11-,13+,14-/m0/s1	BRLNHSCHDPURAU-YUTCNCBUSA-N	343.108958092							119161
BRD-K71538933	LSM-30611		54641004	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16-/m1/s1	BTLHSRCDNJLGMU-BZUAXINKSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NC(=O)Nc2c(C)onc2C)[C@@H](CO)O1	BroadT	BRD-K71538933	BRD-K71538933-001-01-8	Broad Institute of MIT and Harvard	BRD-K71538933			CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NC(=O)Nc2c(C)noc2C)[C@@H](CO)O1	InChI=1S/C19H33N5O5/c1-12-18(13(2)29-23-12)22-19(27)21-15-7-6-14(28-16(15)11-25)10-17(26)20-8-5-9-24(3)4/h14-16,25H,5-11H2,1-4H3,(H,20,26)(H2,21,22,27)/t14-,15-,16-/m1/s1	BTLHSRCDNJLGMU-BZUAXINKSA-N	411.248169206							119162
BRD-K29144638	LSM-30612		54640768	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20+,23+/m0/s1	KTXYXNLRJUMWJA-MIZPHKNDSA-N	OC[C@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)CC[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K29144638	BRD-K29144638-001-01-6	Broad Institute of MIT and Harvard	BRD-K29144638			OC[C@H]1O[C@H](CC(=O)NC2Cc3ccccc3C2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H28N2O6/c28-13-23-20(27-25(30)17-5-8-21-22(11-17)32-14-31-21)7-6-19(33-23)12-24(29)26-18-9-15-3-1-2-4-16(15)10-18/h1-5,8,11,18-20,23,28H,6-7,9-10,12-14H2,(H,26,29)(H,27,30)/t19-,20+,23+/m0/s1	KTXYXNLRJUMWJA-MIZPHKNDSA-N	452.194736636							119163
BRD-K78681155	LSM-30613		54641034	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16-/m0/s1	UDNDOFJZCBESNN-XHSDSOJGSA-N	CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	BroadT	BRD-K78681155	BRD-K78681155-001-01-0	Broad Institute of MIT and Harvard	BRD-K78681155			CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCC2CCCCC2)O[C@H]1CO	InChI=1S/C18H32N2O4/c1-2-17(22)20-15-9-8-14(24-16(15)12-21)10-18(23)19-11-13-6-4-3-5-7-13/h13-16,21H,2-12H2,1H3,(H,19,23)(H,20,22)/t14-,15+,16-/m0/s1	UDNDOFJZCBESNN-XHSDSOJGSA-N	340.236207524							119164
BRD-K35517098	LSM-30614		54638185	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28-/m1/s1	FCGPHHIJUXAVKG-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K35517098	BRD-K35517098-001-01-8	Broad Institute of MIT and Harvard	BRD-K35517098			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28-/m1/s1	FCGPHHIJUXAVKG-RZIGYZOXSA-N	502.246772208							119165
BRD-K28391526	LSM-30615		54638131	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30-/m0/s1	GGYLTZASASDOIP-ZRLASMASSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K28391526	BRD-K28391526-001-01-9	Broad Institute of MIT and Harvard	BRD-K28391526			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30-/m0/s1	GGYLTZASASDOIP-ZRLASMASSA-N	605.255956688							119166
BRD-K12833024	LSM-30616		54638212	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21-,27-/m0/s1	LKZZFECXVBIFRU-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K12833024	BRD-K12833024-001-01-5	Broad Institute of MIT and Harvard	BRD-K12833024			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21-,27-/m0/s1	LKZZFECXVBIFRU-IZVMNLJQSA-N	489.299142138							119167
BRD-K77832645	LSM-30617		54638117	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29-/m1/s1	LHOOKUAZFMTYME-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K77832645	BRD-K77832645-001-01-8	Broad Institute of MIT and Harvard	BRD-K77832645			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29-/m1/s1	LHOOKUAZFMTYME-VDWGHMIBSA-N	536.234492962							119168
BRD-K13679727	LSM-30618		54638173	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20+,25-/m1/s1	KJOWQTUXPGZSAG-OHUGHZGNSA-N	CCOC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K13679727	BRD-K13679727-001-01-1	Broad Institute of MIT and Harvard	BRD-K13679727			CCOC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20+,25-/m1/s1	KJOWQTUXPGZSAG-OHUGHZGNSA-N	507.273321314							119169
BRD-K41603100	LSM-30619		54638155	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30-/m1/s1	AYMJUORULYIZBX-DUELTEGESA-N	COc1ccccc1NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K41603100	BRD-K41603100-001-01-4	Broad Institute of MIT and Harvard	BRD-K41603100			COc1ccccc1NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30-/m1/s1	AYMJUORULYIZBX-DUELTEGESA-N	584.29987042							119170
BRD-K38510068	LSM-30620		56835249	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23-,28+/m1/s1	BIOSPGAGQAHCPR-KRHPZPPWSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K38510068	BRD-K38510068-001-01-6	Broad Institute of MIT and Harvard	BRD-K38510068			CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23-,28+/m1/s1	BIOSPGAGQAHCPR-KRHPZPPWSA-N	548.336255928							119171
BRD-K67716105	LSM-30621		54638093	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	CPFCVXYAQBATNY-IEGUWTFLSA-N	COC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K67716105	BRD-K67716105-001-01-8	Broad Institute of MIT and Harvard	BRD-K67716105			COC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	CPFCVXYAQBATNY-IEGUWTFLSA-N	440.231122144							119172
BRD-K52647340	LSM-30622		54638202	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22-,28+/m0/s1	ZZJDSLIFIRXZTN-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K52647340	BRD-K52647340-001-01-7	Broad Institute of MIT and Harvard	BRD-K52647340			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22-,28+/m0/s1	ZZJDSLIFIRXZTN-RXYILKCJSA-N	501.26275663							119173
BRD-K01367715	LSM-30623		54638049	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29-/m0/s1	UOSMRAYIPQIEAB-KERYWQKISA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K01367715	BRD-K01367715-001-01-1	Broad Institute of MIT and Harvard	BRD-K01367715			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29-/m0/s1	UOSMRAYIPQIEAB-KERYWQKISA-N	552.229407582							119174
BRD-K34541722	LSM-30624		54638134	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29-/m0/s1	KIMVBWBBLXVDQH-KERYWQKISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K34541722	BRD-K34541722-001-01-3	Broad Institute of MIT and Harvard	BRD-K34541722			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29-/m0/s1	KIMVBWBBLXVDQH-KERYWQKISA-N	572.279883904							119175
BRD-K45811188	LSM-30625		56835456	InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22-,28+/m1/s1	NAOMOBPLTHOCBW-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K45811188	BRD-K45811188-001-01-4	Broad Institute of MIT and Harvard	BRD-K45811188			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22-,28+/m1/s1	NAOMOBPLTHOCBW-XJGOYTCSSA-N	522.218842898							119176
BRD-K94014790	LSM-30626		54638034	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-25(26)20-38-29(21)18-32(3)17-23-12-14-24(15-13-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22-,29-/m1/s1	QLSXNEUKVNJNBQ-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K94014790	BRD-K94014790-001-01-5	Broad Institute of MIT and Harvard	BRD-K94014790			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-25(26)20-38-29(21)18-32(3)17-23-12-14-24(15-13-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22-,29-/m1/s1	QLSXNEUKVNJNBQ-IEOSBIPESA-N	516.262422272							119177
BRD-K47804666	LSM-30627		56835279	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	VCVIZFGCRJKFPD-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K47804666	BRD-K47804666-001-01-8	Broad Institute of MIT and Harvard	BRD-K47804666			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	VCVIZFGCRJKFPD-BXOOBUKZSA-N	593.235970172							119178
BRD-K69048559	LSM-30628		56835523	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23+,29+/m0/s1	ULIRFODWPVJJJM-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K69048559	BRD-K69048559-001-01-5	Broad Institute of MIT and Harvard	BRD-K69048559			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23+,29+/m0/s1	ULIRFODWPVJJJM-QFWOEDSFSA-N	539.278406694							119179
BRD-K57937572	LSM-30629		54638158	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	VCVIZFGCRJKFPD-QLVXXPONSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K57937572	BRD-K57937572-001-01-6	Broad Institute of MIT and Harvard	BRD-K57937572			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	VCVIZFGCRJKFPD-QLVXXPONSA-N	593.235970172							119180
BRD-K48519079	LSM-30630		54638129	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30-/m0/s1	GGYLTZASASDOIP-BURCIIJTSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K48519079	BRD-K48519079-001-01-2	Broad Institute of MIT and Harvard	BRD-K48519079			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30-/m0/s1	GGYLTZASASDOIP-BURCIIJTSA-N	605.255956688							119181
BRD-K65183353	LSM-30631		54638170	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23+,29+/m1/s1	PMCUDQOGLWYNQY-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K65183353	BRD-K65183353-001-01-2	Broad Institute of MIT and Harvard	BRD-K65183353			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23+,29+/m1/s1	PMCUDQOGLWYNQY-AFKLWXAFSA-N	516.262422272							119182
BRD-K00423214	LSM-30632		54638075	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23-,28-/m0/s1	BIOSPGAGQAHCPR-AMZZYFJHSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K00423214	BRD-K00423214-001-01-9	Broad Institute of MIT and Harvard	BRD-K00423214			CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23-,28-/m0/s1	BIOSPGAGQAHCPR-AMZZYFJHSA-N	548.336255928							119183
BRD-K50177531	LSM-30633		54638186	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23-,29+/m1/s1	ULIRFODWPVJJJM-SGQNLQFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K50177531	BRD-K50177531-001-01-6	Broad Institute of MIT and Harvard	BRD-K50177531			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23-,29+/m1/s1	ULIRFODWPVJJJM-SGQNLQFHSA-N	539.278406694							119184
BRD-K70941721	LSM-30634		54638036	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19+,24-/m1/s1	WFOXSFCEMNKJBZ-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K70941721	BRD-K70941721-001-01-1	Broad Institute of MIT and Harvard	BRD-K70941721			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19+,24-/m1/s1	WFOXSFCEMNKJBZ-YDIMBITNSA-N	513.22974194							119185
BRD-K09168812	LSM-30635		54638148	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20+,25-/m1/s1	LMVCYSKFVOVAPA-OHUGHZGNSA-N	CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K09168812	BRD-K09168812-001-01-7	Broad Institute of MIT and Harvard	BRD-K09168812			CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20+,25-/m1/s1	LMVCYSKFVOVAPA-OHUGHZGNSA-N	467.278406694							119186
BRD-K07534805	LSM-30636		56835347	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23-,28+/m0/s1	BIOSPGAGQAHCPR-KKQCDPINSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K07534805	BRD-K07534805-001-01-1	Broad Institute of MIT and Harvard	BRD-K07534805			CC(C)[C@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23-,28+/m0/s1	BIOSPGAGQAHCPR-KKQCDPINSA-N	548.336255928							119187
BRD-K10459843	LSM-30637		54638172	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20-,25-/m0/s1	KJOWQTUXPGZSAG-RLSLOFABSA-N	CCOC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K10459843	BRD-K10459843-001-01-0	Broad Institute of MIT and Harvard	BRD-K10459843			CCOC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20-,25-/m0/s1	KJOWQTUXPGZSAG-RLSLOFABSA-N	507.273321314							119188
BRD-K15434241	LSM-30638		54638127	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30-/m1/s1	IDJKSNHJPUPXKA-BOYVUMAVSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K15434241	BRD-K15434241-001-01-6	Broad Institute of MIT and Harvard	BRD-K15434241			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30-/m1/s1	IDJKSNHJPUPXKA-BOYVUMAVSA-N	589.261042068							119189
BRD-K01827055	LSM-30639		56835343	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30+/m0/s1	IDJKSNHJPUPXKA-FVBCXUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K01827055	BRD-K01827055-001-01-2	Broad Institute of MIT and Harvard	BRD-K01827055			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30+/m0/s1	IDJKSNHJPUPXKA-FVBCXUTKSA-N	589.261042068							119190
BRD-K32282076	LSM-30640		54638140	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22-,28-/m1/s1	QXIWLMKZHSHPSY-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K32282076	BRD-K32282076-001-01-8	Broad Institute of MIT and Harvard	BRD-K32282076			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22-,28-/m1/s1	QXIWLMKZHSHPSY-DQCZWYHMSA-N	486.251857588							119191
BRD-K57155690	LSM-30641		54638069	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29-/m1/s1	CPEICJXEUQBQMC-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K57155690	BRD-K57155690-001-01-2	Broad Institute of MIT and Harvard	BRD-K57155690			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29-/m1/s1	CPEICJXEUQBQMC-IEOSBIPESA-N	547.214091876							119192
BRD-K72145393	LSM-30642		54638082	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m1/s1	ULNLJDUAQDCMRA-IEOSBIPESA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K72145393	BRD-K72145393-001-01-4	Broad Institute of MIT and Harvard	BRD-K72145393			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m1/s1	ULNLJDUAQDCMRA-IEOSBIPESA-N	531.273321314							119193
BRD-K39936803	LSM-30643		54638118	InChI=1S/C28H37N3O5S/c1-6-37(34,35)29(4)16-25-19(2)15-31(20(3)17-32)28(33)27-26(22-12-8-7-11-21(22)18-36-25)23-13-9-10-14-24(23)30(27)5/h7-14,19-20,25,32H,6,15-18H2,1-5H3/t19-,20-,25-/m0/s1	DWJGCUYEXVCCPK-RLSLOFABSA-N	CCS(=O)(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K39936803	BRD-K39936803-001-01-2	Broad Institute of MIT and Harvard	BRD-K39936803			CCS(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C28H37N3O5S/c1-6-37(34,35)29(4)16-25-19(2)15-31(20(3)17-32)28(33)27-26(22-12-8-7-11-21(22)18-36-25)23-13-9-10-14-24(23)30(27)5/h7-14,19-20,25,32H,6,15-18H2,1-5H3/t19-,20-,25-/m0/s1	DWJGCUYEXVCCPK-RLSLOFABSA-N	527.245392004							119194
BRD-K62248885	LSM-30644		56835209	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m0/s1	ULNLJDUAQDCMRA-SYZUXVNWSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K62248885	BRD-K62248885-001-01-3	Broad Institute of MIT and Harvard	BRD-K62248885			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m0/s1	ULNLJDUAQDCMRA-SYZUXVNWSA-N	531.273321314							119195
BRD-K81884810	LSM-30645		56835257	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28+/m1/s1	QXIWLMKZHSHPSY-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K81884810	BRD-K81884810-001-01-2	Broad Institute of MIT and Harvard	BRD-K81884810			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28+/m1/s1	QXIWLMKZHSHPSY-WENCSYSZSA-N	486.251857588							119196
BRD-K45723655	LSM-30646		56835294	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30+/m1/s1	GGYLTZASASDOIP-HFZPWKHCSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K45723655	BRD-K45723655-001-01-5	Broad Institute of MIT and Harvard	BRD-K45723655			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30+/m1/s1	GGYLTZASASDOIP-HFZPWKHCSA-N	605.255956688							119197
BRD-K75746738	LSM-30647		54638124	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30-/m0/s1	IDJKSNHJPUPXKA-BBANNHEPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K75746738	BRD-K75746738-001-01-0	Broad Institute of MIT and Harvard	BRD-K75746738			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30-/m0/s1	IDJKSNHJPUPXKA-BBANNHEPSA-N	589.261042068							119198
BRD-K50941200	LSM-30648		54638177	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30-/m0/s1	GTYKJOKWQTUGAM-JYUFKMNQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K50941200	BRD-K50941200-001-01-5	Broad Institute of MIT and Harvard	BRD-K50941200			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30-/m0/s1	GTYKJOKWQTUGAM-JYUFKMNQSA-N	589.261042068							119199
BRD-K74311661	LSM-30649		54638152	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30-/m0/s1	VWHOEYJBVKWJDQ-ZRLASMASSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K74311661	BRD-K74311661-001-01-5	Broad Institute of MIT and Harvard	BRD-K74311661			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30-/m0/s1	VWHOEYJBVKWJDQ-ZRLASMASSA-N	584.29987042							119200
BRD-K17722419	LSM-30650		56835309	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23+,29+/m1/s1	HMXYYXXTDVGKHF-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K17722419	BRD-K17722419-001-01-8	Broad Institute of MIT and Harvard	BRD-K17722419			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23+,29+/m1/s1	HMXYYXXTDVGKHF-AFKLWXAFSA-N	554.289305736							119201
BRD-K07071690	LSM-30651		56835524	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20+,25+/m1/s1	LMVCYSKFVOVAPA-RNHFSVANSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K07071690	BRD-K07071690-001-01-2	Broad Institute of MIT and Harvard	BRD-K07071690			CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20+,25+/m1/s1	LMVCYSKFVOVAPA-RNHFSVANSA-N	467.278406694							119202
BRD-K47618355	LSM-30652		54638153	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30-/m1/s1	VWHOEYJBVKWJDQ-IQLGONJTSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K47618355	BRD-K47618355-001-01-8	Broad Institute of MIT and Harvard	BRD-K47618355			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30-/m1/s1	VWHOEYJBVKWJDQ-IQLGONJTSA-N	584.29987042							119203
BRD-K77324165	LSM-30653		56835335	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24-,29+/m0/s1	IXIIOBNDFUZJEW-NDIVSWGXSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K77324165	BRD-K77324165-001-01-6	Broad Institute of MIT and Harvard	BRD-K77324165			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24-,29+/m0/s1	IXIIOBNDFUZJEW-NDIVSWGXSA-N	589.261042068							119204
BRD-K70886325	LSM-30654		54638178	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30-/m1/s1	GTYKJOKWQTUGAM-BOYVUMAVSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K70886325	BRD-K70886325-001-01-8	Broad Institute of MIT and Harvard	BRD-K70886325			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30-/m1/s1	GTYKJOKWQTUGAM-BOYVUMAVSA-N	589.261042068							119205
BRD-K98164803	LSM-30655		56835332	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19-,24+/m0/s1	LYNAFNWAMBCYIK-AXHZCLLHSA-N	COC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K98164803	BRD-K98164803-001-01-9	Broad Institute of MIT and Harvard	BRD-K98164803			COC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19-,24+/m0/s1	LYNAFNWAMBCYIK-AXHZCLLHSA-N	493.25767125							119206
BRD-K21535473	LSM-30656		56835256	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21+,26+/m1/s1	OXCUXFUTEKJJPF-SWYRRKHMSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K21535473	BRD-K21535473-001-01-1	Broad Institute of MIT and Harvard	BRD-K21535473			CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21+,26+/m1/s1	OXCUXFUTEKJJPF-SWYRRKHMSA-N	520.3049558							119207
BRD-K97666659	LSM-30657		54638113	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24-,29-/m1/s1	IXIIOBNDFUZJEW-NDDXJGTKSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K97666659	BRD-K97666659-001-01-9	Broad Institute of MIT and Harvard	BRD-K97666659			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24-,29-/m1/s1	IXIIOBNDFUZJEW-NDDXJGTKSA-N	589.261042068							119208
BRD-K44984558	LSM-30658		56835488	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29+/m1/s1	LHOOKUAZFMTYME-SGQNLQFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K44984558	BRD-K44984558-001-01-2	Broad Institute of MIT and Harvard	BRD-K44984558			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29+/m1/s1	LHOOKUAZFMTYME-SGQNLQFHSA-N	536.234492962							119209
BRD-K10325583	LSM-30659		56835447	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m0/s1	VWHOEYJBVKWJDQ-DDFCPOBKSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K10325583	BRD-K10325583-001-01-7	Broad Institute of MIT and Harvard	BRD-K10325583			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m0/s1	VWHOEYJBVKWJDQ-DDFCPOBKSA-N	584.29987042							119210
BRD-K99482176	LSM-30660		54638053	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21+,26-/m0/s1	VNUWVQZUCWANNH-UZINWLIJSA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K99482176	BRD-K99482176-001-01-3	Broad Institute of MIT and Harvard	BRD-K99482176			CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21+,26-/m0/s1	VNUWVQZUCWANNH-UZINWLIJSA-N	521.288971378							119211
BRD-K49577636	LSM-30661		56835311	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	VJARKWPJXPJMID-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K49577636	BRD-K49577636-001-01-5	Broad Institute of MIT and Harvard	BRD-K49577636			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	VJARKWPJXPJMID-BXOOBUKZSA-N	609.206419682							119212
BRD-K04559718	LSM-30662		56835261	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29+/m1/s1	KIMVBWBBLXVDQH-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K04559718	BRD-K04559718-001-01-7	Broad Institute of MIT and Harvard	BRD-K04559718			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29+/m1/s1	KIMVBWBBLXVDQH-BXOOBUKZSA-N	572.279883904							119213
BRD-K08075712	LSM-30663		54638064	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22-,29-/m0/s1	RTAWYMNQWKWMFE-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K08075712	BRD-K08075712-001-01-6	Broad Institute of MIT and Harvard	BRD-K08075712			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22-,29-/m0/s1	RTAWYMNQWKWMFE-SYZUXVNWSA-N	557.268984862							119214
BRD-K14268329	LSM-30664		56835477	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	UOSMRAYIPQIEAB-BXOOBUKZSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K14268329	BRD-K14268329-001-01-4	Broad Institute of MIT and Harvard	BRD-K14268329			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	UOSMRAYIPQIEAB-BXOOBUKZSA-N	552.229407582							119215
BRD-K50114736	LSM-30665		54638060	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28-/m1/s1	HMFLWOKWXXLBBI-UMQWNRPGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K50114736	BRD-K50114736-001-01-2	Broad Institute of MIT and Harvard	BRD-K50114736			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28-/m1/s1	HMFLWOKWXXLBBI-UMQWNRPGSA-N	519.253334798							119216
BRD-K16330310	LSM-30666		54638058	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28-/m0/s1	HMFLWOKWXXLBBI-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K16330310	BRD-K16330310-001-01-1	Broad Institute of MIT and Harvard	BRD-K16330310			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28-/m0/s1	HMFLWOKWXXLBBI-GTNJKRJXSA-N	519.253334798							119217
BRD-K17185909	LSM-30667		54638166	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23+,29+/m0/s1	PMCUDQOGLWYNQY-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K17185909	BRD-K17185909-001-01-5	Broad Institute of MIT and Harvard	BRD-K17185909			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23+,29+/m0/s1	PMCUDQOGLWYNQY-QFWOEDSFSA-N	516.262422272							119218
BRD-K92759025	LSM-30668		54638040	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29+/m0/s1	KPHBSGLTBSWVOZ-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K92759025	BRD-K92759025-001-01-4	Broad Institute of MIT and Harvard	BRD-K92759025			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29+/m0/s1	KPHBSGLTBSWVOZ-SBZVUBOMSA-N	536.234492962							119219
BRD-K78249980	LSM-30669		56835449	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29+/m0/s1	VJARKWPJXPJMID-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K78249980	BRD-K78249980-001-01-7	Broad Institute of MIT and Harvard	BRD-K78249980			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29+/m0/s1	VJARKWPJXPJMID-DKGMKSHISA-N	609.206419682							119220
BRD-K30201819	LSM-30670		56835455	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22-,28+/m1/s1	FCGPHHIJUXAVKG-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K30201819	BRD-K30201819-001-01-2	Broad Institute of MIT and Harvard	BRD-K30201819			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22-,28+/m1/s1	FCGPHHIJUXAVKG-XJGOYTCSSA-N	502.246772208							119221
BRD-K47951404	LSM-30671		54638205	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23+,29-/m0/s1	HMXYYXXTDVGKHF-CTWZREHQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K47951404	BRD-K47951404-001-01-4	Broad Institute of MIT and Harvard	BRD-K47951404			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23+,29-/m0/s1	HMXYYXXTDVGKHF-CTWZREHQSA-N	554.289305736							119222
BRD-K84685162	LSM-30672		54638198	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23+,29-/m1/s1	NMPUNVMUZNPCOO-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K84685162	BRD-K84685162-001-01-4	Broad Institute of MIT and Harvard	BRD-K84685162			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23+,29-/m1/s1	NMPUNVMUZNPCOO-RLPNJSHFSA-N	575.245392004							119223
BRD-K32082369	LSM-30673		56835388	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29+/m0/s1	KIMVBWBBLXVDQH-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K32082369	BRD-K32082369-001-01-8	Broad Institute of MIT and Harvard	BRD-K32082369			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29+/m0/s1	KIMVBWBBLXVDQH-DKGMKSHISA-N	572.279883904							119224
BRD-K69698801	LSM-30674		54638151	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30-/m1/s1	VWHOEYJBVKWJDQ-DUELTEGESA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K69698801	BRD-K69698801-001-01-3	Broad Institute of MIT and Harvard	BRD-K69698801			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30-/m1/s1	VWHOEYJBVKWJDQ-DUELTEGESA-N	584.29987042							119225
BRD-K73858940	LSM-30675		56835383	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19+,25+/m0/s1	SZJJHZGBIZRROX-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K73858940	BRD-K73858940-001-01-9	Broad Institute of MIT and Harvard	BRD-K73858940			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(C)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19+,25+/m0/s1	SZJJHZGBIZRROX-OSWQYVSFSA-N	477.26275663							119226
CHEMBL2359183	LSM-30676	BRD-K99522349, SID131434320	54638043	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	VJARKWPJXPJMID-QLVXXPONSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K99522349	BRD-K99522349-001-01-8	Broad Institute of MIT and Harvard	BRD-K99522349			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	VJARKWPJXPJMID-QLVXXPONSA-N	609.206419682							119227
BRD-K96615474	LSM-30677		56835502	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22+,30+/m1/s1	XPWZMLBKMSEGRL-DGIFUFQNSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO)c(OC)c1	BroadT	BRD-K96615474	BRD-K96615474-001-01-0	Broad Institute of MIT and Harvard	BRD-K96615474			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)c(OC)c1	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22+,30+/m1/s1	XPWZMLBKMSEGRL-DGIFUFQNSA-N	561.283885998							119228
BRD-K88467167	LSM-30678		54638070	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23+,28+/m1/s1	BIOSPGAGQAHCPR-DHMIZTNRSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K88467167	BRD-K88467167-001-01-8	Broad Institute of MIT and Harvard	BRD-K88467167			CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23+,28+/m1/s1	BIOSPGAGQAHCPR-DHMIZTNRSA-N	548.336255928							119229
BRD-K34519313	LSM-30679		54638123	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30-/m1/s1	YIOWAERVOJZIKA-IQLGONJTSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K34519313	BRD-K34519313-001-01-4	Broad Institute of MIT and Harvard	BRD-K34519313			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30-/m1/s1	YIOWAERVOJZIKA-IQLGONJTSA-N	569.288971378							119230
BRD-K86285108	LSM-30680		56835415	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30+/m0/s1	JOGVUONFALHXEE-DDFCPOBKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K86285108	BRD-K86285108-001-01-8	Broad Institute of MIT and Harvard	BRD-K86285108			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30+/m0/s1	JOGVUONFALHXEE-DDFCPOBKSA-N	600.240640982							119231
BRD-K99783492	LSM-30681		54638213	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21-,27-/m1/s1	LKZZFECXVBIFRU-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K99783492	BRD-K99783492-001-01-1	Broad Institute of MIT and Harvard	BRD-K99783492			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21-,27-/m1/s1	LKZZFECXVBIFRU-LGVUCKNBSA-N	489.299142138							119232
BRD-K97362312	LSM-30682		54638083	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28+/m0/s1	MCHUCWXKRNBTOC-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K97362312	BRD-K97362312-001-01-4	Broad Institute of MIT and Harvard	BRD-K97362312			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28+/m0/s1	MCHUCWXKRNBTOC-YHGPEZAFSA-N	540.209421066							119233
BRD-K96761342	LSM-30683		54638139	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28-/m1/s1	QXIWLMKZHSHPSY-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K96761342	BRD-K96761342-001-01-2	Broad Institute of MIT and Harvard	BRD-K96761342			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28-/m1/s1	QXIWLMKZHSHPSY-RZIGYZOXSA-N	486.251857588							119234
BRD-K39390441	LSM-30684		56835310	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20+,25+/m1/s1	KJOWQTUXPGZSAG-RNHFSVANSA-N	CCOC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K39390441	BRD-K39390441-001-01-0	Broad Institute of MIT and Harvard	BRD-K39390441			CCOC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20+,25+/m1/s1	KJOWQTUXPGZSAG-RNHFSVANSA-N	507.273321314							119235
BRD-K39913135	LSM-30685		56835512	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19-,24+/m1/s1	SVRUDDLQEWNAQN-IECBHUPTSA-N	CCOC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K39913135	BRD-K39913135-001-01-0	Broad Institute of MIT and Harvard	BRD-K39913135			CCOC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19-,24+/m1/s1	SVRUDDLQEWNAQN-IECBHUPTSA-N	454.246772208							119236
BRD-K52285987	LSM-30686		56835244	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29-/m0/s1	UOSMRAYIPQIEAB-SYZUXVNWSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K52285987	BRD-K52285987-001-01-4	Broad Institute of MIT and Harvard	BRD-K52285987			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29-/m0/s1	UOSMRAYIPQIEAB-SYZUXVNWSA-N	552.229407582							119237
BRD-K48069820	LSM-30687		54638108	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29-/m0/s1	VVAFPBTXPBKEIX-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K48069820	BRD-K48069820-001-01-0	Broad Institute of MIT and Harvard	BRD-K48069820			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29-/m0/s1	VVAFPBTXPBKEIX-BOSRLCDASA-N	526.294391116							119238
BRD-K05000526	LSM-30688		56835330	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23+,29+/m1/s1	ULIRFODWPVJJJM-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K05000526	BRD-K05000526-001-01-3	Broad Institute of MIT and Harvard	BRD-K05000526			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23+,29+/m1/s1	ULIRFODWPVJJJM-AFKLWXAFSA-N	539.278406694							119239
BRD-K72034944	LSM-30689		56835316	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30+/m0/s1	AYMJUORULYIZBX-ZTNZZFSWSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K72034944	BRD-K72034944-001-01-4	Broad Institute of MIT and Harvard	BRD-K72034944			COc1ccccc1NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30+/m0/s1	AYMJUORULYIZBX-ZTNZZFSWSA-N	584.29987042							119240
BRD-K86463534	LSM-30690		56835239	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22-,28-/m0/s1	ZZJDSLIFIRXZTN-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K86463534	BRD-K86463534-001-01-5	Broad Institute of MIT and Harvard	BRD-K86463534			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22-,28-/m0/s1	ZZJDSLIFIRXZTN-VPYPWEPUSA-N	501.26275663							119241
BRD-K44814060	LSM-30691		54638164	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19+,24-/m1/s1	LYNAFNWAMBCYIK-YDIMBITNSA-N	COC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K44814060	BRD-K44814060-001-01-2	Broad Institute of MIT and Harvard	BRD-K44814060			COC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19+,24-/m1/s1	LYNAFNWAMBCYIK-YDIMBITNSA-N	493.25767125							119242
BRD-K40733000	LSM-30692		54638207	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23+,29-/m1/s1	HMXYYXXTDVGKHF-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K40733000	BRD-K40733000-001-01-1	Broad Institute of MIT and Harvard	BRD-K40733000			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23+,29-/m1/s1	HMXYYXXTDVGKHF-RLPNJSHFSA-N	554.289305736							119243
BRD-K04366109	LSM-30693		54638191	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21+,26-/m0/s1	OXCUXFUTEKJJPF-UZINWLIJSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K04366109	BRD-K04366109-001-01-4	Broad Institute of MIT and Harvard	BRD-K04366109			CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21+,26-/m0/s1	OXCUXFUTEKJJPF-UZINWLIJSA-N	520.3049558							119244
BRD-K15259307	LSM-30694		54638121	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30-/m1/s1	YIOWAERVOJZIKA-DUELTEGESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K15259307	BRD-K15259307-001-01-8	Broad Institute of MIT and Harvard	BRD-K15259307			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30-/m1/s1	YIOWAERVOJZIKA-DUELTEGESA-N	569.288971378							119245
BRD-K02781692	LSM-30695		54638195	InChI=1S/C30H36N2O3/c1-22-17-32(23(2)20-33)30(34)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-35-29(22)19-31(3)18-24-11-5-4-6-12-24/h4-16,22-23,29,33H,17-21H2,1-3H3/t22-,23+,29-/m0/s1	BOHOTNADZNISIN-CTWZREHQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K02781692	BRD-K02781692-001-01-9	Broad Institute of MIT and Harvard	BRD-K02781692			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O3/c1-22-17-32(23(2)20-33)30(34)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-35-29(22)19-31(3)18-24-11-5-4-6-12-24/h4-16,22-23,29,33H,17-21H2,1-3H3/t22-,23+,29-/m0/s1	BOHOTNADZNISIN-CTWZREHQSA-N	472.272593032							119246
BRD-K90480740	LSM-30696		54638120	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30+/m1/s1	YIOWAERVOJZIKA-JWUQWVJQSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K90480740	BRD-K90480740-001-01-3	Broad Institute of MIT and Harvard	BRD-K90480740			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30+/m1/s1	YIOWAERVOJZIKA-JWUQWVJQSA-N	569.288971378							119247
BRD-K59856141	LSM-30697		54638079	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29+/m0/s1	ULNLJDUAQDCMRA-DKGMKSHISA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K59856141	BRD-K59856141-001-01-8	Broad Institute of MIT and Harvard	BRD-K59856141			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29+/m0/s1	ULNLJDUAQDCMRA-DKGMKSHISA-N	531.273321314							119248
BRD-K66179451	LSM-30698		54638197	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23-,29+/m1/s1	NMPUNVMUZNPCOO-SGQNLQFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K66179451	BRD-K66179451-001-01-0	Broad Institute of MIT and Harvard	BRD-K66179451			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23-,29+/m1/s1	NMPUNVMUZNPCOO-SGQNLQFHSA-N	575.245392004							119249
BRD-K88140437	LSM-30699		54638162	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19-,24+/m1/s1	LYNAFNWAMBCYIK-IECBHUPTSA-N	COC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K88140437	BRD-K88140437-001-01-5	Broad Institute of MIT and Harvard	BRD-K88140437			COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19-,24+/m1/s1	LYNAFNWAMBCYIK-IECBHUPTSA-N	493.25767125							119250
BRD-K90801819	LSM-30700		56835549	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28-/m0/s1	HMFLWOKWXXLBBI-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K90801819	BRD-K90801819-001-01-6	Broad Institute of MIT and Harvard	BRD-K90801819			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28-/m0/s1	HMFLWOKWXXLBBI-CZBREUMFSA-N	519.253334798							119251
BRD-K23533429	LSM-30701		54638208	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23-,29-/m1/s1	HMXYYXXTDVGKHF-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K23533429	BRD-K23533429-001-01-9	Broad Institute of MIT and Harvard	BRD-K23533429			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23-,29-/m1/s1	HMXYYXXTDVGKHF-VDWGHMIBSA-N	554.289305736							119252
BRD-K62184784	LSM-30702		54638107	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29-/m1/s1	VVAFPBTXPBKEIX-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K62184784	BRD-K62184784-001-01-2	Broad Institute of MIT and Harvard	BRD-K62184784			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29-/m1/s1	VVAFPBTXPBKEIX-RLPNJSHFSA-N	526.294391116							119253
BRD-K57748937	LSM-30703		56835345	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19+,25+/m1/s1	SZJJHZGBIZRROX-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K57748937	BRD-K57748937-001-01-7	Broad Institute of MIT and Harvard	BRD-K57748937			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(C)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19+,25+/m1/s1	SZJJHZGBIZRROX-WYEJZRMESA-N	477.26275663							119254
BRD-K42506600	LSM-30704		54638061	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	RTAWYMNQWKWMFE-QLVXXPONSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K42506600	BRD-K42506600-001-01-3	Broad Institute of MIT and Harvard	BRD-K42506600			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	RTAWYMNQWKWMFE-QLVXXPONSA-N	557.268984862							119255
BRD-K94088690	LSM-30705		56835384	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24+,29+/m0/s1	IXIIOBNDFUZJEW-CTVOUCONSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K94088690	BRD-K94088690-001-01-0	Broad Institute of MIT and Harvard	BRD-K94088690			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24+,29+/m0/s1	IXIIOBNDFUZJEW-CTVOUCONSA-N	589.261042068							119256
BRD-K70158474	LSM-30706		54638056	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21-,26-/m1/s1	VNUWVQZUCWANNH-IPVFLDMMSA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K70158474	BRD-K70158474-001-01-1	Broad Institute of MIT and Harvard	BRD-K70158474			CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21-,26-/m1/s1	VNUWVQZUCWANNH-IPVFLDMMSA-N	521.288971378							119257
BRD-K98535708	LSM-30707		56835296	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19+,24+/m1/s1	LYNAFNWAMBCYIK-IMWIBFENSA-N	COC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K98535708	BRD-K98535708-001-01-6	Broad Institute of MIT and Harvard	BRD-K98535708			COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19+,24+/m1/s1	LYNAFNWAMBCYIK-IMWIBFENSA-N	493.25767125							119258
BRD-K93176491	LSM-30708		56835240	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22-,30-/m0/s1	XPWZMLBKMSEGRL-PWWNZBMUSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO)c(OC)c1	BroadT	BRD-K93176491	BRD-K93176491-001-01-5	Broad Institute of MIT and Harvard	BRD-K93176491			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)c(OC)c1	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22-,30-/m0/s1	XPWZMLBKMSEGRL-PWWNZBMUSA-N	561.283885998							119259
BRD-K76616863	LSM-30709		54638168	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23+,29-/m0/s1	PMCUDQOGLWYNQY-CTWZREHQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K76616863	BRD-K76616863-001-01-1	Broad Institute of MIT and Harvard	BRD-K76616863			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23+,29-/m0/s1	PMCUDQOGLWYNQY-CTWZREHQSA-N	516.262422272							119260
BRD-K06685815	LSM-30710		54638188	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23-,29-/m0/s1	ULIRFODWPVJJJM-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K06685815	BRD-K06685815-001-01-0	Broad Institute of MIT and Harvard	BRD-K06685815			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23-,29-/m0/s1	ULIRFODWPVJJJM-BOSRLCDASA-N	539.278406694							119261
BRD-K83294522	LSM-30711		54638116	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23+,29-/m1/s1	LHOOKUAZFMTYME-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K83294522	BRD-K83294522-001-01-1	Broad Institute of MIT and Harvard	BRD-K83294522			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23+,29-/m1/s1	LHOOKUAZFMTYME-RLPNJSHFSA-N	536.234492962							119262
BRD-K00137579	LSM-30712		54638157	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30-/m1/s1	AYMJUORULYIZBX-IQLGONJTSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K00137579	BRD-K00137579-001-01-4	Broad Institute of MIT and Harvard	BRD-K00137579			COc1ccccc1NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30-/m1/s1	AYMJUORULYIZBX-IQLGONJTSA-N	584.29987042							119263
BRD-K64763786	LSM-30713		56835229	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23+,29+/m1/s1	NMPUNVMUZNPCOO-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K64763786	BRD-K64763786-001-01-9	Broad Institute of MIT and Harvard	BRD-K64763786			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23+,29+/m1/s1	NMPUNVMUZNPCOO-AFKLWXAFSA-N	575.245392004							119264
BRD-K60543885	LSM-30714		54638133	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29+/m1/s1	KIMVBWBBLXVDQH-QLVXXPONSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K60543885	BRD-K60543885-001-01-9	Broad Institute of MIT and Harvard	BRD-K60543885			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29+/m1/s1	KIMVBWBBLXVDQH-QLVXXPONSA-N	572.279883904							119265
BRD-K92725027	LSM-30715		56835278	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30+/m1/s1	GTYKJOKWQTUGAM-QEGDFHJFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K92725027	BRD-K92725027-001-01-3	Broad Institute of MIT and Harvard	BRD-K92725027			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30+/m1/s1	GTYKJOKWQTUGAM-QEGDFHJFSA-N	589.261042068							119266
BRD-K02392990	LSM-30716		56835553	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	CPFCVXYAQBATNY-BSRJHKFKSA-N	COC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K02392990	BRD-K02392990-001-01-4	Broad Institute of MIT and Harvard	BRD-K02392990			COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	CPFCVXYAQBATNY-BSRJHKFKSA-N	440.231122144							119267
BRD-K72602058	LSM-30717		54638085	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28-/m1/s1	MCHUCWXKRNBTOC-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K72602058	BRD-K72602058-001-01-0	Broad Institute of MIT and Harvard	BRD-K72602058			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28-/m1/s1	MCHUCWXKRNBTOC-PHVLTXCSSA-N	540.209421066							119268
BRD-K91683342	LSM-30718		54638102	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19-,25+/m1/s1	SZJJHZGBIZRROX-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K91683342	BRD-K91683342-001-01-3	Broad Institute of MIT and Harvard	BRD-K91683342			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(C)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19-,25+/m1/s1	SZJJHZGBIZRROX-RRQZXNHTSA-N	477.26275663							119269
BRD-K75220555	LSM-30719		54638071	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23-,28-/m0/s1	BIOSPGAGQAHCPR-KYALDGGBSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K75220555	BRD-K75220555-001-01-6	Broad Institute of MIT and Harvard	BRD-K75220555			CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23-,28-/m0/s1	BIOSPGAGQAHCPR-KYALDGGBSA-N	548.336255928							119270
BRD-K28021686	LSM-30720		56835467	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23+/m1/s1	CPFCVXYAQBATNY-PNCHPQGNSA-N	COC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K28021686	BRD-K28021686-001-01-8	Broad Institute of MIT and Harvard	BRD-K28021686			COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23+/m1/s1	CPFCVXYAQBATNY-PNCHPQGNSA-N	440.231122144							119271
BRD-K89216747	LSM-30721		56835537	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28+/m1/s1	MCHUCWXKRNBTOC-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K89216747	BRD-K89216747-001-01-7	Broad Institute of MIT and Harvard	BRD-K89216747			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28+/m1/s1	MCHUCWXKRNBTOC-GGJMMHKRSA-N	540.209421066							119272
BRD-K84671474	LSM-30722		56835551	InChI=1S/C30H36N2O3/c1-22-17-32(23(2)20-33)30(34)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-35-29(22)19-31(3)18-24-11-5-4-6-12-24/h4-16,22-23,29,33H,17-21H2,1-3H3/t22-,23-,29-/m0/s1	BOHOTNADZNISIN-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K84671474	BRD-K84671474-001-01-7	Broad Institute of MIT and Harvard	BRD-K84671474			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O3/c1-22-17-32(23(2)20-33)30(34)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-35-29(22)19-31(3)18-24-11-5-4-6-12-24/h4-16,22-23,29,33H,17-21H2,1-3H3/t22-,23-,29-/m0/s1	BOHOTNADZNISIN-BOSRLCDASA-N	472.272593032							119273
BRD-K17910820	LSM-30723		54638087	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22+,30+/m0/s1	XPWZMLBKMSEGRL-IABYTQIASA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO)c(OC)c1	BroadT	BRD-K17910820	BRD-K17910820-001-01-2	Broad Institute of MIT and Harvard	BRD-K17910820			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)c(OC)c1	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22+,30+/m0/s1	XPWZMLBKMSEGRL-IABYTQIASA-N	561.283885998							119274
BRD-K06772291	LSM-30724		56835397	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23-,29+/m0/s1	NMPUNVMUZNPCOO-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K06772291	BRD-K06772291-001-01-9	Broad Institute of MIT and Harvard	BRD-K06772291			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23-,29+/m0/s1	NMPUNVMUZNPCOO-SBZVUBOMSA-N	575.245392004							119275
BRD-K39291909	LSM-30725		56835543	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22-,28+/m1/s1	QXIWLMKZHSHPSY-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K39291909	BRD-K39291909-001-01-5	Broad Institute of MIT and Harvard	BRD-K39291909			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22-,28+/m1/s1	QXIWLMKZHSHPSY-XJGOYTCSSA-N	486.251857588							119276
BRD-K96295480	LSM-30726		56835338	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29+/m0/s1	VVAFPBTXPBKEIX-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K96295480	BRD-K96295480-001-01-3	Broad Institute of MIT and Harvard	BRD-K96295480			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29+/m0/s1	VVAFPBTXPBKEIX-QFWOEDSFSA-N	526.294391116							119277
BRD-K62659610	LSM-30727		56835463	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23-,29+/m0/s1	ULIRFODWPVJJJM-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K62659610	BRD-K62659610-001-01-3	Broad Institute of MIT and Harvard	BRD-K62659610			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23-,29+/m0/s1	ULIRFODWPVJJJM-SBZVUBOMSA-N	539.278406694							119278
BRD-K73969016	LSM-30728		56835252	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30+/m1/s1	YIOWAERVOJZIKA-HFZPWKHCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K73969016	BRD-K73969016-001-01-3	Broad Institute of MIT and Harvard	BRD-K73969016			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30+/m1/s1	YIOWAERVOJZIKA-HFZPWKHCSA-N	569.288971378							119279
BRD-K40300525	LSM-30729		54638080	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29-/m0/s1	ULNLJDUAQDCMRA-KERYWQKISA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K40300525	BRD-K40300525-001-01-5	Broad Institute of MIT and Harvard	BRD-K40300525			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29-/m0/s1	ULNLJDUAQDCMRA-KERYWQKISA-N	531.273321314							119280
BRD-K17858048	LSM-30730		54638114	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29+/m0/s1	LHOOKUAZFMTYME-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K17858048	BRD-K17858048-001-01-9	Broad Institute of MIT and Harvard	BRD-K17858048			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29+/m0/s1	LHOOKUAZFMTYME-SBZVUBOMSA-N	536.234492962							119281
BRD-K48056188	LSM-30731		56835454	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23+,29+/m0/s1	NMPUNVMUZNPCOO-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K48056188	BRD-K48056188-001-01-3	Broad Institute of MIT and Harvard	BRD-K48056188			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23+,29+/m0/s1	NMPUNVMUZNPCOO-QFWOEDSFSA-N	575.245392004							119282
BRD-K13275816	LSM-30732		54638147	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20+,25-/m0/s1	LMVCYSKFVOVAPA-DFIYOIEZSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K13275816	BRD-K13275816-001-01-0	Broad Institute of MIT and Harvard	BRD-K13275816			CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20+,25-/m0/s1	LMVCYSKFVOVAPA-DFIYOIEZSA-N	467.278406694							119283
BRD-K27028848	LSM-30733		54638141	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30+/m1/s1	JOGVUONFALHXEE-JWUQWVJQSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K27028848	BRD-K27028848-001-01-9	Broad Institute of MIT and Harvard	BRD-K27028848			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30+/m1/s1	JOGVUONFALHXEE-JWUQWVJQSA-N	600.240640982							119284
BRD-K62554329	LSM-30734		56835487	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28+/m1/s1	MCHUCWXKRNBTOC-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K62554329	BRD-K62554329-001-01-8	Broad Institute of MIT and Harvard	BRD-K62554329			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28+/m1/s1	MCHUCWXKRNBTOC-CJYOKPGZSA-N	540.209421066							119285
BRD-K39237487	LSM-30735		56835233	InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22-,28-/m0/s1	NAOMOBPLTHOCBW-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K39237487	BRD-K39237487-001-01-8	Broad Institute of MIT and Harvard	BRD-K39237487			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22-,28-/m0/s1	NAOMOBPLTHOCBW-VPYPWEPUSA-N	522.218842898							119286
BRD-K26612358	LSM-30736		56835527	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23+,29+/m1/s1	LHOOKUAZFMTYME-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K26612358	BRD-K26612358-001-01-3	Broad Institute of MIT and Harvard	BRD-K26612358			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23+,29+/m1/s1	LHOOKUAZFMTYME-AFKLWXAFSA-N	536.234492962							119287
BRD-K05123945	LSM-30737		56835318	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30+/m0/s1	IDJKSNHJPUPXKA-FOUYOVOOSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K05123945	BRD-K05123945-001-01-6	Broad Institute of MIT and Harvard	BRD-K05123945			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30+/m0/s1	IDJKSNHJPUPXKA-FOUYOVOOSA-N	589.261042068							119288
BRD-K44238634	LSM-30738		54638204	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22+,28-/m1/s1	ZZJDSLIFIRXZTN-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K44238634	BRD-K44238634-001-01-1	Broad Institute of MIT and Harvard	BRD-K44238634			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22+,28-/m1/s1	ZZJDSLIFIRXZTN-RZIGYZOXSA-N	501.26275663							119289
BRD-K26720280	LSM-30739		54638068	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29-/m0/s1	CPEICJXEUQBQMC-KERYWQKISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K26720280	BRD-K26720280-001-01-7	Broad Institute of MIT and Harvard	BRD-K26720280			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29-/m0/s1	CPEICJXEUQBQMC-KERYWQKISA-N	547.214091876							119290
BRD-K57346660	LSM-30740		54638209	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21-,27+/m1/s1	LKZZFECXVBIFRU-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K57346660	BRD-K57346660-001-01-3	Broad Institute of MIT and Harvard	BRD-K57346660			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21-,27+/m1/s1	LKZZFECXVBIFRU-GNMOFYLKSA-N	489.299142138							119291
BRD-K48501991	LSM-30741		56835450	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23+,29+/m0/s1	HMXYYXXTDVGKHF-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K48501991	BRD-K48501991-001-01-5	Broad Institute of MIT and Harvard	BRD-K48501991			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23+,29+/m0/s1	HMXYYXXTDVGKHF-QFWOEDSFSA-N	554.289305736							119292
BRD-K52859120	LSM-30742		54638057	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28+/m0/s1	HMFLWOKWXXLBBI-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K52859120	BRD-K52859120-001-01-4	Broad Institute of MIT and Harvard	BRD-K52859120			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28+/m0/s1	HMFLWOKWXXLBBI-YHGPEZAFSA-N	519.253334798							119293
BRD-K13559806	LSM-30743		54638106	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29+/m1/s1	VVAFPBTXPBKEIX-SGQNLQFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K13559806	BRD-K13559806-001-01-9	Broad Institute of MIT and Harvard	BRD-K13559806			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29+/m1/s1	VVAFPBTXPBKEIX-SGQNLQFHSA-N	526.294391116							119294
BRD-K75730049	LSM-30744		54638050	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	UOSMRAYIPQIEAB-UETOGOEVSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K75730049	BRD-K75730049-001-01-8	Broad Institute of MIT and Harvard	BRD-K75730049			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	UOSMRAYIPQIEAB-UETOGOEVSA-N	552.229407582							119295
BRD-K82202634	LSM-30745		56835200	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	CPFCVXYAQBATNY-STSQHVNTSA-N	COC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K82202634	BRD-K82202634-001-01-0	Broad Institute of MIT and Harvard	BRD-K82202634			COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	CPFCVXYAQBATNY-STSQHVNTSA-N	440.231122144							119296
BRD-K93800933	LSM-30746		56835424	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28+/m1/s1	HMFLWOKWXXLBBI-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K93800933	BRD-K93800933-001-01-6	Broad Institute of MIT and Harvard	BRD-K93800933			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28+/m1/s1	HMFLWOKWXXLBBI-CJYOKPGZSA-N	519.253334798							119297
BRD-K32680124	LSM-30747		54638194	InChI=1S/C30H36N2O3/c1-22-17-32(23(2)20-33)30(34)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-35-29(22)19-31(3)18-24-11-5-4-6-12-24/h4-16,22-23,29,33H,17-21H2,1-3H3/t22-,23+,29+/m0/s1	BOHOTNADZNISIN-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K32680124	BRD-K32680124-001-01-5	Broad Institute of MIT and Harvard	BRD-K32680124			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O3/c1-22-17-32(23(2)20-33)30(34)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-35-29(22)19-31(3)18-24-11-5-4-6-12-24/h4-16,22-23,29,33H,17-21H2,1-3H3/t22-,23+,29+/m0/s1	BOHOTNADZNISIN-QFWOEDSFSA-N	472.272593032							119298
BRD-K72156149	LSM-30748		54638193	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21-,26-/m1/s1	OXCUXFUTEKJJPF-IPVFLDMMSA-N	CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K72156149	BRD-K72156149-001-01-8	Broad Institute of MIT and Harvard	BRD-K72156149			CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21-,26-/m1/s1	OXCUXFUTEKJJPF-IPVFLDMMSA-N	520.3049558							119299
BRD-K48372955	LSM-30749		54638163	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19-,24-/m0/s1	LYNAFNWAMBCYIK-JXQFQVJHSA-N	COC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K48372955	BRD-K48372955-001-01-5	Broad Institute of MIT and Harvard	BRD-K48372955			COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19-,24-/m0/s1	LYNAFNWAMBCYIK-JXQFQVJHSA-N	493.25767125							119300
BRD-K74216068	LSM-30750		54638176	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30-/m1/s1	GTYKJOKWQTUGAM-FSGGQHMVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K74216068	BRD-K74216068-001-01-5	Broad Institute of MIT and Harvard	BRD-K74216068			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30-/m1/s1	GTYKJOKWQTUGAM-FSGGQHMVSA-N	589.261042068							119301
BRD-K23610423	LSM-30751		54638160	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	VCVIZFGCRJKFPD-UETOGOEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K23610423	BRD-K23610423-001-01-1	Broad Institute of MIT and Harvard	BRD-K23610423			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	VCVIZFGCRJKFPD-UETOGOEVSA-N	593.235970172							119302
BRD-K45380779	LSM-30752		54638042	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29-/m1/s1	KPHBSGLTBSWVOZ-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K45380779	BRD-K45380779-001-01-5	Broad Institute of MIT and Harvard	BRD-K45380779			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29-/m1/s1	KPHBSGLTBSWVOZ-VDWGHMIBSA-N	536.234492962							119303
BRD-K90040724	LSM-30753		56835542	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20-,25-/m0/s1	LMVCYSKFVOVAPA-RLSLOFABSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K90040724	BRD-K90040724-001-01-5	Broad Institute of MIT and Harvard	BRD-K90040724			CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20-,25-/m0/s1	LMVCYSKFVOVAPA-RLSLOFABSA-N	467.278406694							119304
CHEMBL3188415	LSM-30754	BRD-K79946769	54638078	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23+,28-/m1/s1	BIOSPGAGQAHCPR-SQVYLTPJSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K79946769	BRD-K79946769-001-01-4	Broad Institute of MIT and Harvard	BRD-K79946769			CC(C)[C@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23+,28-/m1/s1	BIOSPGAGQAHCPR-SQVYLTPJSA-N	548.336255928							119305
BRD-K13844473	LSM-30755		56835562	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28+/m1/s1	FCGPHHIJUXAVKG-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K13844473	BRD-K13844473-001-01-7	Broad Institute of MIT and Harvard	BRD-K13844473			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28+/m1/s1	FCGPHHIJUXAVKG-WENCSYSZSA-N	502.246772208							119306
BRD-K03205303	LSM-30756		56835331	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21-,26+/m0/s1	OXCUXFUTEKJJPF-ISJBWFOZSA-N	CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K03205303	BRD-K03205303-001-01-9	Broad Institute of MIT and Harvard	BRD-K03205303			CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21-,26+/m0/s1	OXCUXFUTEKJJPF-ISJBWFOZSA-N	520.3049558							119307
BRD-K40061713	LSM-30757		54638081	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29-/m1/s1	ULNLJDUAQDCMRA-UETOGOEVSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K40061713	BRD-K40061713-001-01-5	Broad Institute of MIT and Harvard	BRD-K40061713			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29-/m1/s1	ULNLJDUAQDCMRA-UETOGOEVSA-N	531.273321314							119308
BRD-K81450614	LSM-30758		56835210	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28-/m0/s1	MCHUCWXKRNBTOC-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K81450614	BRD-K81450614-001-01-0	Broad Institute of MIT and Harvard	BRD-K81450614			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28-/m0/s1	MCHUCWXKRNBTOC-CZBREUMFSA-N	540.209421066							119309
BRD-K40306365	LSM-30759		54638199	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23-,29-/m0/s1	NMPUNVMUZNPCOO-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K40306365	BRD-K40306365-001-01-5	Broad Institute of MIT and Harvard	BRD-K40306365			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23-,29-/m0/s1	NMPUNVMUZNPCOO-BOSRLCDASA-N	575.245392004							119310
BRD-K10092312	LSM-30760		54638111	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24+,29-/m1/s1	IXIIOBNDFUZJEW-UAABGXCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K10092312	BRD-K10092312-001-01-1	Broad Institute of MIT and Harvard	BRD-K10092312			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24+,29-/m1/s1	IXIIOBNDFUZJEW-UAABGXCFSA-N	589.261042068							119311
BRD-K15803157	LSM-30761		54638037	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24-/m0/s1	WFOXSFCEMNKJBZ-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K15803157	BRD-K15803157-001-01-4	Broad Institute of MIT and Harvard	BRD-K15803157			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24-/m0/s1	WFOXSFCEMNKJBZ-JXQFQVJHSA-N	513.22974194							119312
BRD-K33371292	LSM-30762		54638126	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30-/m0/s1	IDJKSNHJPUPXKA-JYUFKMNQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K33371292	BRD-K33371292-001-01-6	Broad Institute of MIT and Harvard	BRD-K33371292			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30-/m0/s1	IDJKSNHJPUPXKA-JYUFKMNQSA-N	589.261042068							119313
BRD-K23430114	LSM-30763		56835352	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21-,27+/m0/s1	LKZZFECXVBIFRU-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K23430114	BRD-K23430114-001-01-8	Broad Institute of MIT and Harvard	BRD-K23430114			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21-,27+/m0/s1	LKZZFECXVBIFRU-NOMHHCBYSA-N	489.299142138							119314
BRD-K63545954	LSM-30764		56835464	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20-,25+/m1/s1	LMVCYSKFVOVAPA-FHAGJXEFSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K63545954	BRD-K63545954-001-01-7	Broad Institute of MIT and Harvard	BRD-K63545954			CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20-,25+/m1/s1	LMVCYSKFVOVAPA-FHAGJXEFSA-N	467.278406694							119315
BRD-K29662589	LSM-30765		56835381	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19+,24+/m0/s1	LYNAFNWAMBCYIK-XLNZFTOWSA-N	COC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K29662589	BRD-K29662589-001-01-6	Broad Institute of MIT and Harvard	BRD-K29662589			COC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19+,24+/m0/s1	LYNAFNWAMBCYIK-XLNZFTOWSA-N	493.25767125							119316
BRD-K61033092	LSM-30766		54638143	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30-/m1/s1	JOGVUONFALHXEE-DUELTEGESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K61033092	BRD-K61033092-001-01-9	Broad Institute of MIT and Harvard	BRD-K61033092			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30-/m1/s1	JOGVUONFALHXEE-DUELTEGESA-N	600.240640982							119317
BRD-K88080911	LSM-30767		56835540	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29-/m0/s1	LHOOKUAZFMTYME-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K88080911	BRD-K88080911-001-01-8	Broad Institute of MIT and Harvard	BRD-K88080911			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29-/m0/s1	LHOOKUAZFMTYME-BOSRLCDASA-N	536.234492962							119318
BRD-K87230984	LSM-30768		54638196	InChI=1S/C30H36N2O3/c1-22-17-32(23(2)20-33)30(34)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-35-29(22)19-31(3)18-24-11-5-4-6-12-24/h4-16,22-23,29,33H,17-21H2,1-3H3/t22-,23-,29-/m1/s1	BOHOTNADZNISIN-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K87230984	BRD-K87230984-001-01-2	Broad Institute of MIT and Harvard	BRD-K87230984			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O3/c1-22-17-32(23(2)20-33)30(34)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-35-29(22)19-31(3)18-24-11-5-4-6-12-24/h4-16,22-23,29,33H,17-21H2,1-3H3/t22-,23-,29-/m1/s1	BOHOTNADZNISIN-VDWGHMIBSA-N	472.272593032							119319
BRD-K98880643	LSM-30769		54638206	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23-,29-/m0/s1	HMXYYXXTDVGKHF-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K98880643	BRD-K98880643-001-01-4	Broad Institute of MIT and Harvard	BRD-K98880643			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23-,29-/m0/s1	HMXYYXXTDVGKHF-BOSRLCDASA-N	554.289305736							119320
BRD-K41305193	LSM-30770		56835373	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29+/m0/s1	VJARKWPJXPJMID-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K41305193	BRD-K41305193-001-01-4	Broad Institute of MIT and Harvard	BRD-K41305193			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29+/m0/s1	VJARKWPJXPJMID-IHMCZWCLSA-N	609.206419682							119321
CHEMBL3187677	LSM-30771	BRD-K28139946	54638063	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	RTAWYMNQWKWMFE-UETOGOEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K28139946	BRD-K28139946-001-01-4	Broad Institute of MIT and Harvard	BRD-K28139946			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	RTAWYMNQWKWMFE-UETOGOEVSA-N	557.268984862							119322
BRD-K85044233	LSM-30772		56835359	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30+/m0/s1	YIOWAERVOJZIKA-DDFCPOBKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K85044233	BRD-K85044233-001-01-8	Broad Institute of MIT and Harvard	BRD-K85044233			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30+/m0/s1	YIOWAERVOJZIKA-DDFCPOBKSA-N	569.288971378							119323
BRD-K19579217	LSM-30773		54638100	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-31(3)17-23-12-14-25(34)15-13-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22+,29-/m1/s1	IFRWHSKAJVBXTO-UETOGOEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K19579217	BRD-K19579217-001-01-4	Broad Institute of MIT and Harvard	BRD-K19579217			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-31(3)17-23-12-14-25(34)15-13-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22+,29-/m1/s1	IFRWHSKAJVBXTO-UETOGOEVSA-N	488.267507652							119324
BRD-K64147309	LSM-30774		54638161	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29-/m0/s1	VCVIZFGCRJKFPD-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K64147309	BRD-K64147309-001-01-3	Broad Institute of MIT and Harvard	BRD-K64147309			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29-/m0/s1	VCVIZFGCRJKFPD-SYZUXVNWSA-N	593.235970172							119325
BRD-K35108166	LSM-30775		54638183	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22-,28+/m0/s1	FCGPHHIJUXAVKG-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K35108166	BRD-K35108166-001-01-3	Broad Institute of MIT and Harvard	BRD-K35108166			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22-,28+/m0/s1	FCGPHHIJUXAVKG-RXYILKCJSA-N	502.246772208							119326
CHEMBL3561930	LSM-30776	BRD-K82628290	54638045	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29-/m0/s1	VJARKWPJXPJMID-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K82628290	BRD-K82628290-001-01-1	Broad Institute of MIT and Harvard	BRD-K82628290			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29-/m0/s1	VJARKWPJXPJMID-SYZUXVNWSA-N	609.206419682							119327
BRD-K58534227	LSM-30777		54638138	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28-/m0/s1	QXIWLMKZHSHPSY-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K58534227	BRD-K58534227-001-01-9	Broad Institute of MIT and Harvard	BRD-K58534227			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28-/m0/s1	QXIWLMKZHSHPSY-TYPXCFOJSA-N	486.251857588							119328
BRD-K09875820	LSM-30778		54638089	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22+,30-/m0/s1	XPWZMLBKMSEGRL-ZQLNOWDWSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO)c(OC)c1	BroadT	BRD-K09875820	BRD-K09875820-001-01-7	Broad Institute of MIT and Harvard	BRD-K09875820			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)c(OC)c1	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22+,30-/m0/s1	XPWZMLBKMSEGRL-ZQLNOWDWSA-N	561.283885998							119329
BRD-K75207324	LSM-30779		56835370	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21-,26+/m0/s1	VNUWVQZUCWANNH-ISJBWFOZSA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K75207324	BRD-K75207324-001-01-3	Broad Institute of MIT and Harvard	BRD-K75207324			CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21-,26+/m0/s1	VNUWVQZUCWANNH-ISJBWFOZSA-N	521.288971378							119330
BRD-K97485863	LSM-30780		56835317	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24+/m0/s1	WFOXSFCEMNKJBZ-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K97485863	BRD-K97485863-001-01-6	Broad Institute of MIT and Harvard	BRD-K97485863			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24+/m0/s1	WFOXSFCEMNKJBZ-AXHZCLLHSA-N	513.22974194							119331
BRD-K54879095	LSM-30781		56835408	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23+,28+/m0/s1	BIOSPGAGQAHCPR-TUEWKVEFSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K54879095	BRD-K54879095-001-01-1	Broad Institute of MIT and Harvard	BRD-K54879095			CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23+,28+/m0/s1	BIOSPGAGQAHCPR-TUEWKVEFSA-N	548.336255928							119332
BRD-K74138110	LSM-30782		54638074	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23-,28-/m1/s1	BIOSPGAGQAHCPR-JTNFPWQOSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K74138110	BRD-K74138110-001-01-9	Broad Institute of MIT and Harvard	BRD-K74138110			CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23-,28-/m1/s1	BIOSPGAGQAHCPR-JTNFPWQOSA-N	548.336255928							119333
BRD-K90625171	LSM-30783		54638210	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21+,27-/m0/s1	LKZZFECXVBIFRU-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K90625171	BRD-K90625171-001-01-1	Broad Institute of MIT and Harvard	BRD-K90625171			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21+,27-/m0/s1	LKZZFECXVBIFRU-ISCCLHIJSA-N	489.299142138							119334
BRD-K58735963	LSM-30784		54638182	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28+/m0/s1	FCGPHHIJUXAVKG-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K58735963	BRD-K58735963-001-01-0	Broad Institute of MIT and Harvard	BRD-K58735963			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28+/m0/s1	FCGPHHIJUXAVKG-PFPZSTESSA-N	502.246772208							119335
BRD-K24070365	LSM-30785		56835234	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-31(3)17-23-12-14-25(34)15-13-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22-,29-/m0/s1	IFRWHSKAJVBXTO-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K24070365	BRD-K24070365-001-01-7	Broad Institute of MIT and Harvard	BRD-K24070365			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-31(3)17-23-12-14-25(34)15-13-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22-,29-/m0/s1	IFRWHSKAJVBXTO-SYZUXVNWSA-N	488.267507652							119336
BRD-K65392908	LSM-30786		56835393	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	RTAWYMNQWKWMFE-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K65392908	BRD-K65392908-001-01-9	Broad Institute of MIT and Harvard	BRD-K65392908			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	RTAWYMNQWKWMFE-BXOOBUKZSA-N	557.268984862							119337
BRD-K62795540	LSM-30787		54638055	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21-,26-/m0/s1	VNUWVQZUCWANNH-WOVHNISZSA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K62795540	BRD-K62795540-001-01-0	Broad Institute of MIT and Harvard	BRD-K62795540			CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21-,26-/m0/s1	VNUWVQZUCWANNH-WOVHNISZSA-N	521.288971378							119338
BRD-K96023136	LSM-30788		56835293	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24+,29+/m1/s1	IXIIOBNDFUZJEW-UQARTHHBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K96023136	BRD-K96023136-001-01-7	Broad Institute of MIT and Harvard	BRD-K96023136			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24+,29+/m1/s1	IXIIOBNDFUZJEW-UQARTHHBSA-N	589.261042068							119339
BRD-K05635176	LSM-30789		56835398	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22-,28+/m1/s1	ZZJDSLIFIRXZTN-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K05635176	BRD-K05635176-001-01-9	Broad Institute of MIT and Harvard	BRD-K05635176			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22-,28+/m1/s1	ZZJDSLIFIRXZTN-XJGOYTCSSA-N	501.26275663							119340
BRD-K43359161	LSM-30790		56835437	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22-,28-/m0/s1	QXIWLMKZHSHPSY-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K43359161	BRD-K43359161-001-01-7	Broad Institute of MIT and Harvard	BRD-K43359161			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22-,28-/m0/s1	QXIWLMKZHSHPSY-VPYPWEPUSA-N	486.251857588							119341
BRD-K68433511	LSM-30791		54638104	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19+,25-/m1/s1	SZJJHZGBIZRROX-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K68433511	BRD-K68433511-001-01-7	Broad Institute of MIT and Harvard	BRD-K68433511			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(C)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19+,25-/m1/s1	SZJJHZGBIZRROX-HHJKRLRDSA-N	477.26275663							119342
BRD-K06886551	LSM-30792		54638211	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21+,27-/m1/s1	LKZZFECXVBIFRU-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K06886551	BRD-K06886551-001-01-2	Broad Institute of MIT and Harvard	BRD-K06886551			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21+,27-/m1/s1	LKZZFECXVBIFRU-PBDKAQRYSA-N	489.299142138							119343
BRD-K45134469	LSM-30793		56835327	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30+/m0/s1	GTYKJOKWQTUGAM-FOUYOVOOSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K45134469	BRD-K45134469-001-01-1	Broad Institute of MIT and Harvard	BRD-K45134469			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30+/m0/s1	GTYKJOKWQTUGAM-FOUYOVOOSA-N	589.261042068							119344
BRD-K61560971	LSM-30794		56835491	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29+/m1/s1	KPHBSGLTBSWVOZ-SGQNLQFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K61560971	BRD-K61560971-001-01-7	Broad Institute of MIT and Harvard	BRD-K61560971			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29+/m1/s1	KPHBSGLTBSWVOZ-SGQNLQFHSA-N	536.234492962							119345
BRD-K37722313	LSM-30795		56835498	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28+/m1/s1	HMFLWOKWXXLBBI-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K37722313	BRD-K37722313-001-01-1	Broad Institute of MIT and Harvard	BRD-K37722313			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28+/m1/s1	HMFLWOKWXXLBBI-GGJMMHKRSA-N	519.253334798							119346
BRD-K85500722	LSM-30796		54638097	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19+,24-/m0/s1	SVRUDDLQEWNAQN-GLDPYIMESA-N	CCOC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K85500722	BRD-K85500722-001-01-7	Broad Institute of MIT and Harvard	BRD-K85500722			CCOC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19+,24-/m0/s1	SVRUDDLQEWNAQN-GLDPYIMESA-N	454.246772208							119347
BRD-K15768601	LSM-30797		54638072	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23+,28-/m0/s1	BIOSPGAGQAHCPR-FPZRTEDSSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K15768601	BRD-K15768601-001-01-1	Broad Institute of MIT and Harvard	BRD-K15768601			CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23+,28-/m0/s1	BIOSPGAGQAHCPR-FPZRTEDSSA-N	548.336255928							119348
BRD-K72709319	LSM-30798		56835361	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19+,24+/m0/s1	WFOXSFCEMNKJBZ-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K72709319	BRD-K72709319-001-01-8	Broad Institute of MIT and Harvard	BRD-K72709319			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19+,24+/m0/s1	WFOXSFCEMNKJBZ-XLNZFTOWSA-N	513.22974194							119349
BRD-K13804959	LSM-30799		56835206	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22+,28+/m1/s1	ZZJDSLIFIRXZTN-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K13804959	BRD-K13804959-001-01-4	Broad Institute of MIT and Harvard	BRD-K13804959			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22+,28+/m1/s1	ZZJDSLIFIRXZTN-WENCSYSZSA-N	501.26275663							119350
BRD-K37637965	LSM-30800		54638125	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30-/m1/s1	IDJKSNHJPUPXKA-FSGGQHMVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K37637965	BRD-K37637965-001-01-2	Broad Institute of MIT and Harvard	BRD-K37637965			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30-/m1/s1	IDJKSNHJPUPXKA-FSGGQHMVSA-N	589.261042068							119351
BRD-K51843685	LSM-30801		56835472	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19+,24+/m1/s1	SVRUDDLQEWNAQN-IMWIBFENSA-N	CCOC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K51843685	BRD-K51843685-001-01-6	Broad Institute of MIT and Harvard	BRD-K51843685			CCOC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19+,24+/m1/s1	SVRUDDLQEWNAQN-IMWIBFENSA-N	454.246772208							119352
BRD-K81277520	LSM-30802		54638159	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29-/m0/s1	VCVIZFGCRJKFPD-KERYWQKISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K81277520	BRD-K81277520-001-01-0	Broad Institute of MIT and Harvard	BRD-K81277520			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29-/m0/s1	VCVIZFGCRJKFPD-KERYWQKISA-N	593.235970172							119353
BRD-K02206127	LSM-30803		54638135	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29-/m1/s1	KIMVBWBBLXVDQH-UETOGOEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K02206127	BRD-K02206127-001-01-2	Broad Institute of MIT and Harvard	BRD-K02206127			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29-/m1/s1	KIMVBWBBLXVDQH-UETOGOEVSA-N	572.279883904							119354
BRD-K69852979-001-01-2	LSM-30804	BRD-K69852979	54638031	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-25(26)20-38-29(21)18-32(3)17-23-12-14-24(15-13-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22-,29+/m0/s1	QLSXNEUKVNJNBQ-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K69852979	BRD-K69852979-001-01-2	Broad Institute of MIT and Harvard	BRD-K69852979			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-25(26)20-38-29(21)18-32(3)17-23-12-14-24(15-13-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22-,29+/m0/s1	QLSXNEUKVNJNBQ-IHMCZWCLSA-N	516.262422272							119355
BRD-K72255851	LSM-30805		56835280	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m1/s1	VWHOEYJBVKWJDQ-HFZPWKHCSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K72255851	BRD-K72255851-001-01-6	Broad Institute of MIT and Harvard	BRD-K72255851			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m1/s1	VWHOEYJBVKWJDQ-HFZPWKHCSA-N	584.29987042							119356
BRD-K23405293	LSM-30806		54638167	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23-,29+/m0/s1	PMCUDQOGLWYNQY-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K23405293	BRD-K23405293-001-01-3	Broad Institute of MIT and Harvard	BRD-K23405293			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23-,29+/m0/s1	PMCUDQOGLWYNQY-SBZVUBOMSA-N	516.262422272							119357
BRD-K43719900	LSM-30807		56835232	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21+,27+/m1/s1	LKZZFECXVBIFRU-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K43719900	BRD-K43719900-001-01-8	Broad Institute of MIT and Harvard	BRD-K43719900			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H39N3O3/c1-20-15-33(21(2)18-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-23(24)19-36-27(20)17-31(3)16-22-13-14-22/h5-12,20-22,27,34H,13-19H2,1-4H3/t20-,21+,27+/m1/s1	LKZZFECXVBIFRU-BUEREQSYSA-N	489.299142138							119358
BRD-K68301602	LSM-30808		54638174	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20-,25-/m1/s1	KJOWQTUXPGZSAG-UMEGOILYSA-N	CCOC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K68301602	BRD-K68301602-001-01-6	Broad Institute of MIT and Harvard	BRD-K68301602			CCOC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20-,25-/m1/s1	KJOWQTUXPGZSAG-UMEGOILYSA-N	507.273321314							119359
BRD-K47108422	LSM-30809		56835486	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29+/m1/s1	ULNLJDUAQDCMRA-QLVXXPONSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K47108422	BRD-K47108422-001-01-9	Broad Institute of MIT and Harvard	BRD-K47108422			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29+/m1/s1	ULNLJDUAQDCMRA-QLVXXPONSA-N	531.273321314							119360
BRD-K87316858	LSM-30810		54638105	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19-,25-/m1/s1	SZJJHZGBIZRROX-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K87316858	BRD-K87316858-001-01-2	Broad Institute of MIT and Harvard	BRD-K87316858			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(C)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19-,25-/m1/s1	SZJJHZGBIZRROX-MPCDZSKCSA-N	477.26275663							119361
BRD-K31977946	LSM-30811		56835427	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22-,30+/m1/s1	XPWZMLBKMSEGRL-WOGZVKCMSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO)c(OC)c1	BroadT	BRD-K31977946	BRD-K31977946-001-01-2	Broad Institute of MIT and Harvard	BRD-K31977946			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@H](C)CO)c(OC)c1	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22-,30+/m1/s1	XPWZMLBKMSEGRL-WOGZVKCMSA-N	561.283885998							119362
BRD-K87433679	LSM-30812		54638066	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29+/m0/s1	CPEICJXEUQBQMC-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K87433679	BRD-K87433679-001-01-2	Broad Institute of MIT and Harvard	BRD-K87433679			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29+/m0/s1	CPEICJXEUQBQMC-DKGMKSHISA-N	547.214091876							119363
BRD-K13673722	LSM-30813		54638169	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23-,29-/m1/s1	PMCUDQOGLWYNQY-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K13673722	BRD-K13673722-001-01-9	Broad Institute of MIT and Harvard	BRD-K13673722			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23-,29-/m1/s1	PMCUDQOGLWYNQY-VDWGHMIBSA-N	516.262422272							119364
BRD-K37527074	LSM-30814		56835563	InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22+,28+/m1/s1	NAOMOBPLTHOCBW-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K37527074	BRD-K37527074-001-01-3	Broad Institute of MIT and Harvard	BRD-K37527074			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22+,28+/m1/s1	NAOMOBPLTHOCBW-WENCSYSZSA-N	522.218842898							119365
BRD-K20348534	LSM-30815		56835372	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30+/m0/s1	JOGVUONFALHXEE-ZTNZZFSWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K20348534	BRD-K20348534-001-01-7	Broad Institute of MIT and Harvard	BRD-K20348534			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30+/m0/s1	JOGVUONFALHXEE-ZTNZZFSWSA-N	600.240640982							119366
BRD-K20171002	LSM-30816		56835448	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29+/m0/s1	VCVIZFGCRJKFPD-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K20171002	BRD-K20171002-001-01-6	Broad Institute of MIT and Harvard	BRD-K20171002			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29+/m0/s1	VCVIZFGCRJKFPD-DKGMKSHISA-N	593.235970172							119367
BRD-K82254412	LSM-30817		54638154	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30+/m1/s1	AYMJUORULYIZBX-JWUQWVJQSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K82254412	BRD-K82254412-001-01-9	Broad Institute of MIT and Harvard	BRD-K82254412			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30+/m1/s1	AYMJUORULYIZBX-JWUQWVJQSA-N	584.29987042							119368
BRD-K86584551	LSM-30818		56835301	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29+/m1/s1	VVAFPBTXPBKEIX-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K86584551	BRD-K86584551-001-01-6	Broad Institute of MIT and Harvard	BRD-K86584551			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29+/m1/s1	VVAFPBTXPBKEIX-AFKLWXAFSA-N	526.294391116							119369
BRD-K97717496	LSM-30819		54638180	InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22+,28-/m1/s1	NAOMOBPLTHOCBW-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K97717496	BRD-K97717496-001-01-7	Broad Institute of MIT and Harvard	BRD-K97717496			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22+,28-/m1/s1	NAOMOBPLTHOCBW-RZIGYZOXSA-N	522.218842898							119370
BRD-K40112492	LSM-30820		54638128	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30+/m1/s1	GGYLTZASASDOIP-JWUQWVJQSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K40112492	BRD-K40112492-001-01-3	Broad Institute of MIT and Harvard	BRD-K40112492			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30+/m1/s1	GGYLTZASASDOIP-JWUQWVJQSA-N	605.255956688							119371
BRD-K44696459	LSM-30821		54638156	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30-/m0/s1	AYMJUORULYIZBX-ZRLASMASSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K44696459	BRD-K44696459-001-01-2	Broad Institute of MIT and Harvard	BRD-K44696459			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30-/m0/s1	AYMJUORULYIZBX-ZRLASMASSA-N	584.29987042							119372
BRD-K19693607	LSM-30822		54638076	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23+,28-/m0/s1	BIOSPGAGQAHCPR-QKFCCHLXSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K19693607	BRD-K19693607-001-01-1	Broad Institute of MIT and Harvard	BRD-K19693607			CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23+,28-/m0/s1	BIOSPGAGQAHCPR-QKFCCHLXSA-N	548.336255928							119373
BRD-K87140555	LSM-30823		54638203	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22+,28-/m0/s1	ZZJDSLIFIRXZTN-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K87140555	BRD-K87140555-001-01-2	Broad Institute of MIT and Harvard	BRD-K87140555			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22+,28-/m0/s1	ZZJDSLIFIRXZTN-TYPXCFOJSA-N	501.26275663							119374
BRD-K76174882	LSM-30824		56835546	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22-,28-/m0/s1	FCGPHHIJUXAVKG-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K76174882	BRD-K76174882-001-01-8	Broad Institute of MIT and Harvard	BRD-K76174882			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22-,28-/m0/s1	FCGPHHIJUXAVKG-VPYPWEPUSA-N	502.246772208							119375
BRD-K28467941	LSM-30825		56835342	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m0/s1	AYMJUORULYIZBX-DDFCPOBKSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K28467941	BRD-K28467941-001-01-4	Broad Institute of MIT and Harvard	BRD-K28467941			COc1ccccc1NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m0/s1	AYMJUORULYIZBX-DDFCPOBKSA-N	584.29987042							119376
BRD-K89179622	LSM-30826		56835490	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23-,29+/m1/s1	PMCUDQOGLWYNQY-SGQNLQFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K89179622	BRD-K89179622-001-01-7	Broad Institute of MIT and Harvard	BRD-K89179622			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23-,29+/m1/s1	PMCUDQOGLWYNQY-SGQNLQFHSA-N	516.262422272							119377
BRD-K98343273	LSM-30827		54638092	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	CPFCVXYAQBATNY-IXFSTUDKSA-N	COC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K98343273	BRD-K98343273-001-01-0	Broad Institute of MIT and Harvard	BRD-K98343273			COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	CPFCVXYAQBATNY-IXFSTUDKSA-N	440.231122144							119378
BRD-K80782159	LSM-30828		56835374	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20-,25+/m0/s1	KJOWQTUXPGZSAG-ZYLNGJIFSA-N	CCOC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K80782159	BRD-K80782159-001-01-8	Broad Institute of MIT and Harvard	BRD-K80782159			CCOC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20-,25+/m0/s1	KJOWQTUXPGZSAG-ZYLNGJIFSA-N	507.273321314							119379
BRD-K79735667	LSM-30829		56835379	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21+,26+/m0/s1	OXCUXFUTEKJJPF-LZCXECNNSA-N	CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K79735667	BRD-K79735667-001-01-4	Broad Institute of MIT and Harvard	BRD-K79735667			CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21+,26+/m0/s1	OXCUXFUTEKJJPF-LZCXECNNSA-N	520.3049558							119380
BRD-K92949288	LSM-30830		56835538	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-25(26)20-38-29(21)18-32(3)17-23-12-14-24(15-13-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22+,29+/m1/s1	QLSXNEUKVNJNBQ-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K92949288	BRD-K92949288-001-01-3	Broad Institute of MIT and Harvard	BRD-K92949288			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-25(26)20-38-29(21)18-32(3)17-23-12-14-24(15-13-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22+,29+/m1/s1	QLSXNEUKVNJNBQ-BXOOBUKZSA-N	516.262422272							119381
BRD-K23051691	LSM-30831		56835471	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29+/m1/s1	CPEICJXEUQBQMC-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K23051691	BRD-K23051691-001-01-3	Broad Institute of MIT and Harvard	BRD-K23051691			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29+/m1/s1	CPEICJXEUQBQMC-BXOOBUKZSA-N	547.214091876							119382
BRD-K06873288	LSM-30832		54638101	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-31(3)17-23-12-14-25(34)15-13-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22-,29-/m1/s1	IFRWHSKAJVBXTO-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K06873288	BRD-K06873288-001-01-0	Broad Institute of MIT and Harvard	BRD-K06873288			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(O)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-31(3)17-23-12-14-25(34)15-13-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22-,29-/m1/s1	IFRWHSKAJVBXTO-IEOSBIPESA-N	488.267507652							119383
CHEMBL3185323	LSM-30833	BRD-K75649446	54638189	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23-,29-/m1/s1	ULIRFODWPVJJJM-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K75649446	BRD-K75649446-001-01-9	Broad Institute of MIT and Harvard	BRD-K75649446			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23-,29-/m1/s1	ULIRFODWPVJJJM-VDWGHMIBSA-N	539.278406694							119384
BRD-K28545166	LSM-30834		56835243	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29-/m0/s1	CPEICJXEUQBQMC-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K28545166	BRD-K28545166-001-01-5	Broad Institute of MIT and Harvard	BRD-K28545166			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29-/m0/s1	CPEICJXEUQBQMC-SYZUXVNWSA-N	547.214091876							119385
BRD-K84821804	LSM-30835		56835535	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29+/m1/s1	ULNLJDUAQDCMRA-BXOOBUKZSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K84821804	BRD-K84821804-001-01-9	Broad Institute of MIT and Harvard	BRD-K84821804			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-39-29(21)18-33(3)31(37)32-24-13-15-25(38-4)16-14-24/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29+/m1/s1	ULNLJDUAQDCMRA-BXOOBUKZSA-N	531.273321314							119386
BRD-K95213130	LSM-30836		54638094	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	CPFCVXYAQBATNY-PMAPCBKXSA-N	COC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K95213130	BRD-K95213130-001-01-1	Broad Institute of MIT and Harvard	BRD-K95213130			COC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	CPFCVXYAQBATNY-PMAPCBKXSA-N	440.231122144							119387
BRD-K42232544	LSM-30837		54638149	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20-,25-/m1/s1	LMVCYSKFVOVAPA-UMEGOILYSA-N	CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K42232544	BRD-K42232544-001-01-5	Broad Institute of MIT and Harvard	BRD-K42232544			CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20-,25-/m1/s1	LMVCYSKFVOVAPA-UMEGOILYSA-N	467.278406694							119388
BRD-K13968264	LSM-30838		54638054	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21+,26-/m1/s1	VNUWVQZUCWANNH-YZIHRLCOSA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K13968264	BRD-K13968264-001-01-7	Broad Institute of MIT and Harvard	BRD-K13968264			CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21+,26-/m1/s1	VNUWVQZUCWANNH-YZIHRLCOSA-N	521.288971378							119389
BRD-K36627718	LSM-30839		56835534	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23+,29+/m1/s1	KPHBSGLTBSWVOZ-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K36627718	BRD-K36627718-001-01-4	Broad Institute of MIT and Harvard	BRD-K36627718			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23+,29+/m1/s1	KPHBSGLTBSWVOZ-AFKLWXAFSA-N	536.234492962							119390
BRD-K73942403	LSM-30840		54638112	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24-,29-/m0/s1	IXIIOBNDFUZJEW-MOMDTQCHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K73942403	BRD-K73942403-001-01-1	Broad Institute of MIT and Harvard	BRD-K73942403			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24-,29-/m0/s1	IXIIOBNDFUZJEW-MOMDTQCHSA-N	589.261042068							119391
BRD-K96977520	LSM-30841		54638184	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28-/m0/s1	FCGPHHIJUXAVKG-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K96977520	BRD-K96977520-001-01-8	Broad Institute of MIT and Harvard	BRD-K96977520			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O5/c1-21-17-32(22(2)19-33)29(34)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-31(3)30(35)37-24-12-5-4-6-13-24/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28-/m0/s1	FCGPHHIJUXAVKG-TYPXCFOJSA-N	502.246772208							119392
BRD-K69175109	LSM-30842		56835403	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	UOSMRAYIPQIEAB-QLVXXPONSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K69175109	BRD-K69175109-001-01-1	Broad Institute of MIT and Harvard	BRD-K69175109			COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	UOSMRAYIPQIEAB-QLVXXPONSA-N	552.229407582							119393
BRD-K60834597	LSM-30843		54638041	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23+,29-/m0/s1	KPHBSGLTBSWVOZ-CTWZREHQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K60834597	BRD-K60834597-001-01-1	Broad Institute of MIT and Harvard	BRD-K60834597			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23+,29-/m0/s1	KPHBSGLTBSWVOZ-CTWZREHQSA-N	536.234492962							119394
BRD-K41396351	LSM-30844		54638201	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22+,28+/m0/s1	ZZJDSLIFIRXZTN-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K41396351	BRD-K41396351-001-01-1	Broad Institute of MIT and Harvard	BRD-K41396351			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h4-16,21-22,28,34H,17-20H2,1-3H3,(H,31,36)/t21-,22+,28+/m0/s1	ZZJDSLIFIRXZTN-PFPZSTESSA-N	501.26275663							119395
BRD-K05474024	LSM-30845		54638048	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29+/m0/s1	UOSMRAYIPQIEAB-IHMCZWCLSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K05474024	BRD-K05474024-001-01-7	Broad Institute of MIT and Harvard	BRD-K05474024			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29+/m0/s1	UOSMRAYIPQIEAB-IHMCZWCLSA-N	552.229407582							119396
BRD-K77504251	LSM-30846		56835212	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19-,24-/m0/s1	SVRUDDLQEWNAQN-JXQFQVJHSA-N	CCOC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K77504251	BRD-K77504251-001-01-8	Broad Institute of MIT and Harvard	BRD-K77504251			CCOC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19-,24-/m0/s1	SVRUDDLQEWNAQN-JXQFQVJHSA-N	454.246772208							119397
BRD-K74500173	LSM-30847		54638035	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24+/m1/s1	WFOXSFCEMNKJBZ-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K74500173	BRD-K74500173-001-01-4	Broad Institute of MIT and Harvard	BRD-K74500173			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24+/m1/s1	WFOXSFCEMNKJBZ-IECBHUPTSA-N	513.22974194							119398
BRD-K30821056	LSM-30848		54638059	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28-/m1/s1	HMFLWOKWXXLBBI-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K30821056	BRD-K30821056-001-01-9	Broad Institute of MIT and Harvard	BRD-K30821056			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-38-28(20)17-33(3)30(37)32-24-11-8-10-23(31)15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28-/m1/s1	HMFLWOKWXXLBBI-PHVLTXCSSA-N	519.253334798							119399
BRD-K56022813	LSM-30849		56835354	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23+,28+/m0/s1	BIOSPGAGQAHCPR-HIAVRWOZSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K56022813	BRD-K56022813-001-01-7	Broad Institute of MIT and Harvard	BRD-K56022813			CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23+,28+/m0/s1	BIOSPGAGQAHCPR-HIAVRWOZSA-N	548.336255928							119400
BRD-K87790666	LSM-30850		54638171	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20+,25-/m0/s1	KJOWQTUXPGZSAG-DFIYOIEZSA-N	CCOC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K87790666	BRD-K87790666-001-01-0	Broad Institute of MIT and Harvard	BRD-K87790666			CCOC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20+,25-/m0/s1	KJOWQTUXPGZSAG-DFIYOIEZSA-N	507.273321314							119401
CHEMBL2357872	LSM-30851	BRD-K82823857, SID131434321	54638044	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	VJARKWPJXPJMID-UETOGOEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K82823857	BRD-K82823857-001-01-3	Broad Institute of MIT and Harvard	BRD-K82823857			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	VJARKWPJXPJMID-UETOGOEVSA-N	609.206419682							119402
BRD-K50240676	LSM-30852		54638175	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30+/m1/s1	GTYKJOKWQTUGAM-ZLRJYYBNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K50240676	BRD-K50240676-001-01-7	Broad Institute of MIT and Harvard	BRD-K50240676			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24-,30+/m1/s1	GTYKJOKWQTUGAM-ZLRJYYBNSA-N	589.261042068							119403
BRD-K93534327	LSM-30853		56835341	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30+/m0/s1	GGYLTZASASDOIP-DDFCPOBKSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K93534327	BRD-K93534327-001-01-5	Broad Institute of MIT and Harvard	BRD-K93534327			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30+/m0/s1	GGYLTZASASDOIP-DDFCPOBKSA-N	605.255956688							119404
BRD-K28399883	LSM-30854		56835319	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30+/m0/s1	YIOWAERVOJZIKA-ZTNZZFSWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K28399883	BRD-K28399883-001-01-9	Broad Institute of MIT and Harvard	BRD-K28399883			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30+/m0/s1	YIOWAERVOJZIKA-ZTNZZFSWSA-N	569.288971378							119405
BRD-K68492420	LSM-30855		56835377	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23-,29+/m0/s1	HMXYYXXTDVGKHF-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K68492420	BRD-K68492420-001-01-3	Broad Institute of MIT and Harvard	BRD-K68492420			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H38N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h5-17,22-23,29,38H,18-21H2,1-4H3,(H,34,40)/t22-,23-,29+/m0/s1	HMXYYXXTDVGKHF-SBZVUBOMSA-N	554.289305736							119406
BRD-K92844788	LSM-30856		54638150	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30+/m1/s1	VWHOEYJBVKWJDQ-JWUQWVJQSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K92844788	BRD-K92844788-001-01-1	Broad Institute of MIT and Harvard	BRD-K92844788			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30+/m1/s1	VWHOEYJBVKWJDQ-JWUQWVJQSA-N	584.29987042							119407
BRD-K27621887	LSM-30857		56835289	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m1/s1	AYMJUORULYIZBX-HFZPWKHCSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K27621887	BRD-K27621887-001-01-3	Broad Institute of MIT and Harvard	BRD-K27621887			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(26-14-8-10-16-28(26)37(32)4)25-13-7-6-12-24(25)21-43-30(22)19-36(3)34(41)35-27-15-9-11-17-29(27)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m1/s1	AYMJUORULYIZBX-HFZPWKHCSA-N	584.29987042							119408
CHEMBL2133962	LSM-30858	BRD-K40760168, SID131434329	54638052	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21-,26+/m1/s1	VNUWVQZUCWANNH-YPCDYVTLSA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K40760168	BRD-K40760168-001-01-2	Broad Institute of MIT and Harvard	BRD-K40760168			CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21-,26+/m1/s1	VNUWVQZUCWANNH-YPCDYVTLSA-N	521.288971378							119409
BRD-K14671808	LSM-30859		54638110	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24-,29+/m1/s1	IXIIOBNDFUZJEW-CWHUZLPRSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K14671808	BRD-K14671808-001-01-9	Broad Institute of MIT and Harvard	BRD-K14671808			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-12-6-11-17-30(22)42(39,40)34(4)19-29-23(2)18-36(24(3)20-37)33(38)32-31(26-14-8-7-13-25(26)21-41-29)27-15-9-10-16-28(27)35(32)5/h6-17,23-24,29,37H,18-21H2,1-5H3/t23-,24-,29+/m1/s1	IXIIOBNDFUZJEW-CWHUZLPRSA-N	589.261042068							119410
BRD-K97839095	LSM-30860		54638033	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-25(26)20-38-29(21)18-32(3)17-23-12-14-24(15-13-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22+,29-/m1/s1	QLSXNEUKVNJNBQ-UETOGOEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K97839095	BRD-K97839095-001-01-4	Broad Institute of MIT and Harvard	BRD-K97839095			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-25(26)20-38-29(21)18-32(3)17-23-12-14-24(15-13-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22+,29-/m1/s1	QLSXNEUKVNJNBQ-UETOGOEVSA-N	516.262422272							119411
BRD-K13352537	LSM-30861		54638038	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24-/m1/s1	WFOXSFCEMNKJBZ-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K13352537	BRD-K13352537-001-01-5	Broad Institute of MIT and Harvard	BRD-K13352537			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24-/m1/s1	WFOXSFCEMNKJBZ-KHCICDEESA-N	513.22974194							119412
BRD-K32595757	LSM-30862		56835262	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23+,28+/m1/s1	BIOSPGAGQAHCPR-FZVPRWPTSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K32595757	BRD-K32595757-001-01-9	Broad Institute of MIT and Harvard	BRD-K32595757			CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23+,28+/m1/s1	BIOSPGAGQAHCPR-FZVPRWPTSA-N	548.336255928							119413
BRD-K48541282	LSM-30863		54638136	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29-/m1/s1	KIMVBWBBLXVDQH-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K48541282	BRD-K48541282-001-01-9	Broad Institute of MIT and Harvard	BRD-K48541282			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29-/m1/s1	KIMVBWBBLXVDQH-IEOSBIPESA-N	572.279883904							119414
BRD-K45959036	LSM-30864		54638051	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29-/m1/s1	UOSMRAYIPQIEAB-IEOSBIPESA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K45959036	BRD-K45959036-001-01-5	Broad Institute of MIT and Harvard	BRD-K45959036			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29-/m1/s1	UOSMRAYIPQIEAB-IEOSBIPESA-N	552.229407582							119415
BRD-K09376957	LSM-30865		54638192	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21+,26-/m1/s1	OXCUXFUTEKJJPF-YZIHRLCOSA-N	CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K09376957	BRD-K09376957-001-01-1	Broad Institute of MIT and Harvard	BRD-K09376957			CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21+,26-/m1/s1	OXCUXFUTEKJJPF-YZIHRLCOSA-N	520.3049558							119416
BRD-K87920761	LSM-30866		54638122	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30-/m0/s1	YIOWAERVOJZIKA-ZRLASMASSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K87920761	BRD-K87920761-001-01-7	Broad Institute of MIT and Harvard	BRD-K87920761			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-26(27)21-42-30(22)19-35(3)18-24-13-15-25(16-14-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30-/m0/s1	YIOWAERVOJZIKA-ZRLASMASSA-N	569.288971378							119417
BRD-K06403738	LSM-30867		54638119	InChI=1S/C28H37N3O5S/c1-6-37(34,35)29(4)16-25-19(2)15-31(20(3)17-32)28(33)27-26(22-12-8-7-11-21(22)18-36-25)23-13-9-10-14-24(23)30(27)5/h7-14,19-20,25,32H,6,15-18H2,1-5H3/t19-,20-,25-/m1/s1	DWJGCUYEXVCCPK-UMEGOILYSA-N	CCS(=O)(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K06403738	BRD-K06403738-001-01-2	Broad Institute of MIT and Harvard	BRD-K06403738			CCS(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C28H37N3O5S/c1-6-37(34,35)29(4)16-25-19(2)15-31(20(3)17-32)28(33)27-26(22-12-8-7-11-21(22)18-36-25)23-13-9-10-14-24(23)30(27)5/h7-14,19-20,25,32H,6,15-18H2,1-5H3/t19-,20-,25-/m1/s1	DWJGCUYEXVCCPK-UMEGOILYSA-N	527.245392004							119418
BRD-K97122937	LSM-30868		54638132	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30-/m1/s1	GGYLTZASASDOIP-IQLGONJTSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K97122937	BRD-K97122937-001-01-7	Broad Institute of MIT and Harvard	BRD-K97122937			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30-/m1/s1	GGYLTZASASDOIP-IQLGONJTSA-N	605.255956688							119419
BRD-K26024910	LSM-30869		56835323	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30+/m0/s1	GGYLTZASASDOIP-ZTNZZFSWSA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K26024910	BRD-K26024910-001-01-2	Broad Institute of MIT and Harvard	BRD-K26024910			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30+/m0/s1	GGYLTZASASDOIP-ZTNZZFSWSA-N	605.255956688							119420
BRD-K29898553	LSM-30870		54638095	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19+,24+/m0/s1	SVRUDDLQEWNAQN-XLNZFTOWSA-N	CCOC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K29898553	BRD-K29898553-001-01-8	Broad Institute of MIT and Harvard	BRD-K29898553			CCOC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19+,24+/m0/s1	SVRUDDLQEWNAQN-XLNZFTOWSA-N	454.246772208							119421
BRD-K33967062	LSM-30871		54638086	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28-/m1/s1	MCHUCWXKRNBTOC-UMQWNRPGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K33967062	BRD-K33967062-001-01-9	Broad Institute of MIT and Harvard	BRD-K33967062			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28-/m1/s1	MCHUCWXKRNBTOC-UMQWNRPGSA-N	540.209421066							119422
BRD-K87593103	LSM-30872		56835313	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29+/m0/s1	VVAFPBTXPBKEIX-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K87593103	BRD-K87593103-001-01-9	Broad Institute of MIT and Harvard	BRD-K87593103			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29+/m0/s1	VVAFPBTXPBKEIX-SBZVUBOMSA-N	526.294391116							119423
BRD-K93874059	LSM-30873		54638088	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22-,30+/m0/s1	XPWZMLBKMSEGRL-MWXNICTNSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO)c(OC)c1	BroadT	BRD-K93874059	BRD-K93874059-001-01-9	Broad Institute of MIT and Harvard	BRD-K93874059			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)c(OC)c1	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22-,30+/m0/s1	XPWZMLBKMSEGRL-MWXNICTNSA-N	561.283885998							119424
BRD-K28953184	LSM-30874		54638200	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23-,29-/m1/s1	NMPUNVMUZNPCOO-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K28953184	BRD-K28953184-001-01-9	Broad Institute of MIT and Harvard	BRD-K28953184			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H37N3O5S/c1-22-18-35(23(2)20-36)32(37)31-30(27-16-10-11-17-28(27)34(31)4)26-15-9-8-12-24(26)21-40-29(22)19-33(3)41(38,39)25-13-6-5-7-14-25/h5-17,22-23,29,36H,18-21H2,1-4H3/t22-,23-,29-/m1/s1	NMPUNVMUZNPCOO-VDWGHMIBSA-N	575.245392004							119425
BRD-K34110797	LSM-30875		54638190	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21-,26+/m1/s1	OXCUXFUTEKJJPF-YPCDYVTLSA-N	CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K34110797	BRD-K34110797-001-01-7	Broad Institute of MIT and Harvard	BRD-K34110797			CC(C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H40N4O4/c1-19(2)31-30(37)32(5)16-26-20(3)15-34(21(4)17-35)29(36)28-27(23-12-8-7-11-22(23)18-38-26)24-13-9-10-14-25(24)33(28)6/h7-14,19-21,26,35H,15-18H2,1-6H3,(H,31,37)/t20-,21-,26+/m1/s1	OXCUXFUTEKJJPF-YPCDYVTLSA-N	520.3049558							119426
BRD-K92008394	LSM-30876		56835346	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29+/m0/s1	KIMVBWBBLXVDQH-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K92008394	BRD-K92008394-001-01-9	Broad Institute of MIT and Harvard	BRD-K92008394			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-14-7-8-15-28(27)37(31)4)26-13-6-5-10-23(26)20-42-29(21)18-36(3)33(41)35-25-12-9-11-24(34)16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29+/m0/s1	KIMVBWBBLXVDQH-IHMCZWCLSA-N	572.279883904							119427
BRD-K46985581	LSM-30877		54638130	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30-/m1/s1	GGYLTZASASDOIP-DUELTEGESA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K46985581	BRD-K46985581-001-01-8	Broad Institute of MIT and Harvard	BRD-K46985581			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-12-8-9-13-29(28)35(32)4)27-11-7-6-10-24(27)21-42-30(22)19-34(3)43(39,40)26-16-14-25(41-5)15-17-26/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30-/m1/s1	GGYLTZASASDOIP-DUELTEGESA-N	605.255956688							119428
BRD-K70087673	LSM-30878		54638115	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23+,29-/m0/s1	LHOOKUAZFMTYME-CTWZREHQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K70087673	BRD-K70087673-001-01-1	Broad Institute of MIT and Harvard	BRD-K70087673			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-13-15-25(16-14-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23+,29-/m0/s1	LHOOKUAZFMTYME-CTWZREHQSA-N	536.234492962							119429
BRD-K78403457	LSM-30879		54638165	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19-,24-/m1/s1	LYNAFNWAMBCYIK-KHCICDEESA-N	COC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K78403457	BRD-K78403457-001-01-4	Broad Institute of MIT and Harvard	BRD-K78403457			COC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C28H35N3O5/c1-18-14-31(19(2)16-32)27(33)26-25(22-12-8-9-13-23(22)30(26)4)21-11-7-6-10-20(21)17-36-24(18)15-29(3)28(34)35-5/h6-13,18-19,24,32H,14-17H2,1-5H3/t18-,19-,24-/m1/s1	LYNAFNWAMBCYIK-KHCICDEESA-N	493.25767125							119430
BRD-K18978916	LSM-30880		56835425	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19-,25+/m0/s1	SZJJHZGBIZRROX-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K18978916	BRD-K18978916-001-01-3	Broad Institute of MIT and Harvard	BRD-K18978916			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(C)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19-,25+/m0/s1	SZJJHZGBIZRROX-XHNVNVPESA-N	477.26275663							119431
BRD-K67022703	LSM-30881		54638047	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29+/m0/s1	UOSMRAYIPQIEAB-DKGMKSHISA-N	COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K67022703	BRD-K67022703-001-01-7	Broad Institute of MIT and Harvard	BRD-K67022703			COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-31(3)39(35,36)25-15-13-24(37-4)14-16-25/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29+/m0/s1	UOSMRAYIPQIEAB-DKGMKSHISA-N	552.229407582							119432
BRD-K66605600	LSM-30882		54638099	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-31(3)17-23-12-14-25(34)15-13-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22+,29-/m0/s1	IFRWHSKAJVBXTO-KERYWQKISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K66605600	BRD-K66605600-001-01-4	Broad Institute of MIT and Harvard	BRD-K66605600			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(O)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-31(3)17-23-12-14-25(34)15-13-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22+,29-/m0/s1	IFRWHSKAJVBXTO-KERYWQKISA-N	488.267507652							119433
BRD-K15157905	LSM-30883		56835409	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21+,26+/m0/s1	VNUWVQZUCWANNH-LZCXECNNSA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K15157905	BRD-K15157905-001-01-0	Broad Institute of MIT and Harvard	BRD-K15157905			CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C30H39N3O5/c1-19(2)38-30(36)31(5)16-26-20(3)15-33(21(4)17-34)29(35)28-27(23-12-8-7-11-22(23)18-37-26)24-13-9-10-14-25(24)32(28)6/h7-14,19-21,26,34H,15-18H2,1-6H3/t20-,21+,26+/m0/s1	VNUWVQZUCWANNH-LZCXECNNSA-N	521.288971378							119434
BRD-K04424176	LSM-30884		54638084	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28-/m0/s1	MCHUCWXKRNBTOC-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K04424176	BRD-K04424176-001-01-9	Broad Institute of MIT and Harvard	BRD-K04424176			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28-/m0/s1	MCHUCWXKRNBTOC-GTNJKRJXSA-N	540.209421066							119435
BRD-K23162004	LSM-30885		54638109	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29-/m1/s1	VVAFPBTXPBKEIX-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K23162004	BRD-K23162004-001-01-0	Broad Institute of MIT and Harvard	BRD-K23162004			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-25(26)21-39-29(22)19-34(3)18-24-13-15-33-16-14-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29-/m1/s1	VVAFPBTXPBKEIX-VDWGHMIBSA-N	526.294391116							119436
BRD-K59124258-001-01-0	LSM-30886	BRD-K59124258	54638046	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29-/m1/s1	VJARKWPJXPJMID-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K59124258	BRD-K59124258-001-01-0	Broad Institute of MIT and Harvard	BRD-K59124258			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36ClN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29-/m1/s1	VJARKWPJXPJMID-IEOSBIPESA-N	609.206419682							119437
BRD-K65152352	LSM-30887		54638062	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22+,29-/m0/s1	RTAWYMNQWKWMFE-KERYWQKISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K65152352	BRD-K65152352-001-01-8	Broad Institute of MIT and Harvard	BRD-K65152352			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22+,29-/m0/s1	RTAWYMNQWKWMFE-KERYWQKISA-N	557.268984862							119438
BRD-K76023734	LSM-30888		54638098	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19+,24-/m1/s1	SVRUDDLQEWNAQN-YDIMBITNSA-N	CCOC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K76023734	BRD-K76023734-001-01-7	Broad Institute of MIT and Harvard	BRD-K76023734			CCOC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19+,24-/m1/s1	SVRUDDLQEWNAQN-YDIMBITNSA-N	454.246772208							119439
BRD-K87930002	LSM-30889		54638137	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28+/m0/s1	QXIWLMKZHSHPSY-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K87930002	BRD-K87930002-001-01-5	Broad Institute of MIT and Harvard	BRD-K87930002			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34N2O4/c1-21-17-32(22(2)19-33)30(35)27-16-10-9-15-26(27)25-14-8-7-13-24(25)20-36-28(21)18-31(3)29(34)23-11-5-4-6-12-23/h4-16,21-22,28,33H,17-20H2,1-3H3/t21-,22+,28+/m0/s1	QXIWLMKZHSHPSY-PFPZSTESSA-N	486.251857588							119440
BRD-K41324679	LSM-30890		54638077	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23-,28-/m1/s1	BIOSPGAGQAHCPR-TZTMDHJLSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K41324679	BRD-K41324679-001-01-8	Broad Institute of MIT and Harvard	BRD-K41324679			CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22-,23-,28-/m1/s1	BIOSPGAGQAHCPR-TZTMDHJLSA-N	548.336255928							119441
BRD-K73452131	LSM-30891		54638145	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30-/m1/s1	JOGVUONFALHXEE-IQLGONJTSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K73452131	BRD-K73452131-001-01-0	Broad Institute of MIT and Harvard	BRD-K73452131			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30-/m1/s1	JOGVUONFALHXEE-IQLGONJTSA-N	600.240640982							119442
BRD-K76431854	LSM-30892		56835376	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30+/m0/s1	VWHOEYJBVKWJDQ-ZTNZZFSWSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K76431854	BRD-K76431854-001-01-6	Broad Institute of MIT and Harvard	BRD-K76431854			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-12-8-9-13-29(28)37(32)4)27-11-7-6-10-24(27)21-43-30(22)19-36(3)34(41)35-25-14-16-26(42-5)17-15-25/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30+/m0/s1	VWHOEYJBVKWJDQ-ZTNZZFSWSA-N	584.29987042							119443
BRD-K54862370	LSM-30893		54638039	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23+,29+/m0/s1	KPHBSGLTBSWVOZ-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K54862370	BRD-K54862370-001-01-3	Broad Institute of MIT and Harvard	BRD-K54862370			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23+,29+/m0/s1	KPHBSGLTBSWVOZ-QFWOEDSFSA-N	536.234492962							119444
BRD-K97654772-001-01-7	LSM-30894	BRD-K97654772	54638032	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-25(26)20-38-29(21)18-32(3)17-23-12-14-24(15-13-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22+,29-/m0/s1	QLSXNEUKVNJNBQ-KERYWQKISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K97654772	BRD-K97654772-001-01-7	Broad Institute of MIT and Harvard	BRD-K97654772			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-25(26)20-38-29(21)18-32(3)17-23-12-14-24(15-13-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22+,29-/m0/s1	QLSXNEUKVNJNBQ-KERYWQKISA-N	516.262422272							119445
BRD-K20072174	LSM-30895		54638096	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19-,24+/m0/s1	SVRUDDLQEWNAQN-AXHZCLLHSA-N	CCOC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K20072174	BRD-K20072174-001-01-8	Broad Institute of MIT and Harvard	BRD-K20072174			CCOC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C26H34N2O5/c1-5-32-26(31)27(4)15-24-18(2)14-28(19(3)16-29)25(30)23-13-9-8-12-22(23)21-11-7-6-10-20(21)17-33-24/h6-13,18-19,24,29H,5,14-17H2,1-4H3/t18-,19-,24+/m0/s1	SVRUDDLQEWNAQN-AXHZCLLHSA-N	454.246772208							119446
BRD-K98810653	LSM-30896		56835208	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23-,29-/m0/s1	PMCUDQOGLWYNQY-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K98810653	BRD-K98810653-001-01-8	Broad Institute of MIT and Harvard	BRD-K98810653			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Oc2ccc(C)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-13-15-25(16-14-21)38-31(36)32(4)18-29-22(2)17-33(23(3)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-24(26)20-37-29/h5-16,22-23,29,34H,17-20H2,1-4H3/t22-,23-,29-/m0/s1	PMCUDQOGLWYNQY-BOSRLCDASA-N	516.262422272							119447
BRD-K46400317	LSM-30897		54638073	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23+,28-/m1/s1	BIOSPGAGQAHCPR-YFUNBVQMSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K46400317	BRD-K46400317-001-01-9	Broad Institute of MIT and Harvard	BRD-K46400317			CC(C)[C@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C32H44N4O4/c1-20(2)23(5)33-32(39)34(6)17-28-21(3)16-36(22(4)18-37)31(38)30-29(25-13-9-8-12-24(25)19-40-28)26-14-10-11-15-27(26)35(30)7/h8-15,20-23,28,37H,16-19H2,1-7H3,(H,33,39)/t21-,22+,23+,28-/m1/s1	BIOSPGAGQAHCPR-YFUNBVQMSA-N	548.336255928							119448
BRD-K60069399	LSM-30898		56835413	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20+,25+/m0/s1	KJOWQTUXPGZSAG-WZOHSFFVSA-N	CCOC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K60069399	BRD-K60069399-001-01-4	Broad Institute of MIT and Harvard	BRD-K60069399			CCOC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C29H37N3O5/c1-6-36-29(35)30(4)16-25-19(2)15-32(20(3)17-33)28(34)27-26(22-12-8-7-11-21(22)18-37-25)23-13-9-10-14-24(23)31(27)5/h7-14,19-20,25,33H,6,15-18H2,1-5H3/t19-,20+,25+/m0/s1	KJOWQTUXPGZSAG-WZOHSFFVSA-N	507.273321314							119449
BRD-K09732051	LSM-30899		56835267	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-25(26)20-38-29(21)18-32(3)17-23-12-14-24(15-13-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22-,29-/m0/s1	QLSXNEUKVNJNBQ-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K09732051	BRD-K09732051-001-01-0	Broad Institute of MIT and Harvard	BRD-K09732051			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-25(26)20-38-29(21)18-32(3)17-23-12-14-24(15-13-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22-,29-/m0/s1	QLSXNEUKVNJNBQ-SYZUXVNWSA-N	516.262422272							119450
BRD-K65597286	LSM-30900		56835254	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30+/m1/s1	IDJKSNHJPUPXKA-QEGDFHJFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K65597286	BRD-K65597286-001-01-5	Broad Institute of MIT and Harvard	BRD-K65597286			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-11-10-13-26(17-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-14-7-6-12-25(27)21-41-30)28-15-8-9-16-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30+/m1/s1	IDJKSNHJPUPXKA-QEGDFHJFSA-N	589.261042068							119451
BRD-K49409924	LSM-30901		56835513	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22-,29+/m0/s1	RTAWYMNQWKWMFE-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K49409924	BRD-K49409924-001-01-2	Broad Institute of MIT and Harvard	BRD-K49409924			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22-,29+/m0/s1	RTAWYMNQWKWMFE-IHMCZWCLSA-N	557.268984862							119452
BRD-K79908599	LSM-30902		56835378	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30+/m0/s1	GTYKJOKWQTUGAM-FVBCXUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K79908599	BRD-K79908599-001-01-0	Broad Institute of MIT and Harvard	BRD-K79908599			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(C)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-22-14-16-26(17-15-22)42(39,40)34(4)19-30-23(2)18-36(24(3)20-37)33(38)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)35(32)5/h6-17,23-24,30,37H,18-21H2,1-5H3/t23-,24+,30+/m0/s1	GTYKJOKWQTUGAM-FVBCXUTKSA-N	589.261042068							119453
BRD-K33453127	LSM-30903		54638181	InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22-,28-/m1/s1	NAOMOBPLTHOCBW-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K33453127	BRD-K33453127-001-01-3	Broad Institute of MIT and Harvard	BRD-K33453127			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22-,28-/m1/s1	NAOMOBPLTHOCBW-DQCZWYHMSA-N	522.218842898							119454
BRD-K67096634	LSM-30904		54638091	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23+/m0/s1	CPFCVXYAQBATNY-IUKKYPGJSA-N	COC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K67096634	BRD-K67096634-001-01-5	Broad Institute of MIT and Harvard	BRD-K67096634			COC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C25H32N2O5/c1-17-13-27(18(2)15-28)24(29)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-32-23(17)14-26(3)25(30)31-4/h5-12,17-18,23,28H,13-16H2,1-4H3/t17-,18-,23+/m0/s1	CPFCVXYAQBATNY-IUKKYPGJSA-N	440.231122144							119455
CHEMBL3188984	LSM-30905	BRD-K46001734	54638187	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23+,29-/m1/s1	ULIRFODWPVJJJM-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K46001734	BRD-K46001734-001-01-0	Broad Institute of MIT and Harvard	BRD-K46001734			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37N3O4/c1-22-18-36(23(2)20-37)33(39)31-30(27-16-10-11-17-28(27)35(31)4)26-15-9-8-14-25(26)21-40-29(22)19-34(3)32(38)24-12-6-5-7-13-24/h5-17,22-23,29,37H,18-21H2,1-4H3/t22-,23+,29-/m1/s1	ULIRFODWPVJJJM-RLPNJSHFSA-N	539.278406694							119456
BRD-K09523238	LSM-30906		54638146	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20-,25+/m0/s1	LMVCYSKFVOVAPA-ZYLNGJIFSA-N	CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K09523238	BRD-K09523238-001-01-9	Broad Institute of MIT and Harvard	BRD-K09523238			CC(C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C27H37N3O4/c1-18(2)28-27(33)29(5)15-25-19(3)14-30(20(4)16-31)26(32)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-34-25/h6-13,18-20,25,31H,14-17H2,1-5H3,(H,28,33)/t19-,20-,25+/m0/s1	LMVCYSKFVOVAPA-ZYLNGJIFSA-N	467.278406694							119457
BRD-K10748141	LSM-30907		56835400	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29+/m1/s1	CPEICJXEUQBQMC-QLVXXPONSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K10748141	BRD-K10748141-001-01-5	Broad Institute of MIT and Harvard	BRD-K10748141			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29+/m1/s1	CPEICJXEUQBQMC-QLVXXPONSA-N	547.214091876							119458
CHEMBL3187090	LSM-30908	BRD-K39613696	54638065	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22-,29-/m1/s1	RTAWYMNQWKWMFE-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K39613696	BRD-K39613696-001-01-7	Broad Institute of MIT and Harvard	BRD-K39613696			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36FN3O4/c1-21-17-37(22(2)19-38)33(40)31-30(27-11-7-8-12-28(27)36(31)4)26-10-6-5-9-24(26)20-41-29(21)18-35(3)32(39)23-13-15-25(34)16-14-23/h5-16,21-22,29,38H,17-20H2,1-4H3/t21-,22-,29-/m1/s1	RTAWYMNQWKWMFE-IEOSBIPESA-N	557.268984862							119459
BRD-K40985311	LSM-30909		54638179	InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22+,28+/m0/s1	NAOMOBPLTHOCBW-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K40985311	BRD-K40985311-001-01-1	Broad Institute of MIT and Harvard	BRD-K40985311			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22+,28+/m0/s1	NAOMOBPLTHOCBW-PFPZSTESSA-N	522.218842898							119460
BRD-K19100834	LSM-30910		56835253	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19+,24+/m1/s1	WFOXSFCEMNKJBZ-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K19100834	BRD-K19100834-001-01-2	Broad Institute of MIT and Harvard	BRD-K19100834			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O5S/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)4)21-11-7-6-10-20(21)17-35-24(18)15-28(3)36(5,33)34/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19+,24+/m1/s1	WFOXSFCEMNKJBZ-IMWIBFENSA-N	513.22974194							119461
BRD-K44042747	LSM-30911		54638142	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30-/m0/s1	JOGVUONFALHXEE-BURCIIJTSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K44042747	BRD-K44042747-001-01-1	Broad Institute of MIT and Harvard	BRD-K44042747			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30-/m0/s1	JOGVUONFALHXEE-BURCIIJTSA-N	600.240640982							119462
BRD-K79937734	LSM-30912		54638090	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22+,30-/m1/s1	XPWZMLBKMSEGRL-VDZJOXJSSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO)c(OC)c1	BroadT	BRD-K79937734	BRD-K79937734-001-01-5	Broad Institute of MIT and Harvard	BRD-K79937734			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)c(OC)c1	InChI=1S/C32H39N3O6/c1-21-17-35(22(2)19-36)31(37)27-13-9-8-12-26(27)25-11-7-6-10-23(25)20-41-30(21)18-34(3)32(38)33-28-15-14-24(39-4)16-29(28)40-5/h6-16,21-22,30,36H,17-20H2,1-5H3,(H,33,38)/t21-,22+,30-/m1/s1	XPWZMLBKMSEGRL-VDZJOXJSSA-N	561.283885998							119463
BRD-K54386075	LSM-30913		54638067	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29+/m0/s1	CPEICJXEUQBQMC-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K54386075	BRD-K54386075-001-01-1	Broad Institute of MIT and Harvard	BRD-K54386075			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-38-29(21)18-32(3)39(36,37)25-14-12-23(16-31)13-15-25/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29+/m0/s1	CPEICJXEUQBQMC-IHMCZWCLSA-N	547.214091876							119464
BRD-K56234278	LSM-30914		54638103	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19+,25-/m0/s1	SZJJHZGBIZRROX-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K56234278	BRD-K56234278-001-01-6	Broad Institute of MIT and Harvard	BRD-K56234278			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(C)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H35N3O4/c1-18-14-31(19(2)16-32)28(34)27-26(23-12-8-9-13-24(23)30(27)5)22-11-7-6-10-21(22)17-35-25(18)15-29(4)20(3)33/h6-13,18-19,25,32H,14-17H2,1-5H3/t18-,19+,25-/m0/s1	SZJJHZGBIZRROX-CEYNDMKZSA-N	477.26275663							119465
BRD-K54732353	LSM-30915		56835375	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29+/m0/s1	VCVIZFGCRJKFPD-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K54732353	BRD-K54732353-001-01-9	Broad Institute of MIT and Harvard	BRD-K54732353			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-11-7-8-12-28(27)35(31)4)26-10-6-5-9-23(26)20-41-29(21)18-34(3)42(39,40)25-15-13-24(33)14-16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29+/m0/s1	VCVIZFGCRJKFPD-IHMCZWCLSA-N	593.235970172							119466
BRD-K54861624	LSM-30916		54638144	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30-/m0/s1	JOGVUONFALHXEE-ZRLASMASSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K54861624	BRD-K54861624-001-01-9	Broad Institute of MIT and Harvard	BRD-K54861624			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-11-7-8-12-29(28)36(32)4)27-10-6-5-9-25(27)21-42-30(22)19-35(3)43(40,41)26-15-13-24(17-34)14-16-26/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30-/m0/s1	JOGVUONFALHXEE-ZRLASMASSA-N	600.240640982							119467
BRD-K16852474	LSM-30917		56835277	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29-/m0/s1	KPHBSGLTBSWVOZ-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K16852474	BRD-K16852474-001-01-6	Broad Institute of MIT and Harvard	BRD-K16852474			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-10-9-12-25(16-21)38(35,36)31(4)18-29-22(2)17-32(23(3)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-11-24(26)20-37-29/h5-16,22-23,29,33H,17-20H2,1-4H3/t22-,23-,29-/m0/s1	KPHBSGLTBSWVOZ-BOSRLCDASA-N	536.234492962							119468
BRD-K33218708	LSM-15131		54619037	InChI=1S/C23H27FN2O4S/c1-16-14-26(17(2)15-27)31(28,29)23-11-9-18(12-21(23)30-22(16)13-25-3)8-10-19-6-4-5-7-20(19)24/h4-7,9,11-12,16-17,22,25,27H,13-15H2,1-3H3/t16-,17-,22+/m1/s1	SJHPEWGCSFZDDK-YVHKJVDXSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc3ccccc3F	BroadT	BRD-K33218708	BRD-K33218708-001-01-7	Broad Institute of MIT and Harvard	BRD-K33218708			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#Cc1ccccc1F	InChI=1S/C23H27FN2O4S/c1-16-14-26(17(2)15-27)31(28,29)23-11-9-18(12-21(23)30-22(16)13-25-3)8-10-19-6-4-5-7-20(19)24/h4-7,9,11-12,16-17,22,25,27H,13-15H2,1-3H3/t16-,17-,22+/m1/s1	SJHPEWGCSFZDDK-YVHKJVDXSA-N	446.167556254							103787
BRD-K38557256	LSM-30918		54619058	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18-,24+/m1/s1	SHPIGGYHGMASQB-GGUMNFRJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K38557256	BRD-K38557256-001-01-9	Broad Institute of MIT and Harvard	BRD-K38557256			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18-,24+/m1/s1	SHPIGGYHGMASQB-GGUMNFRJSA-N	496.248583776							131293
BRD-K87875370	LSM-44295		54619109	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23+,27-/m1/s1	BANHLTBDTXCVOB-LDEKCDIXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K87875370	BRD-K87875370-001-01-6	Broad Institute of MIT and Harvard	BRD-K87875370			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23+,27-/m1/s1	BANHLTBDTXCVOB-LDEKCDIXSA-N	557.255956688							
BRD-K47510632	LSM-30920		54619205	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21+,28+/m1/s1	CBIJUIOTIYQLMH-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K47510632	BRD-K47510632-001-01-2	Broad Institute of MIT and Harvard	BRD-K47510632			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21+,28+/m1/s1	CBIJUIOTIYQLMH-GGJMMHKRSA-N	612.241783834							119472
BRD-K56962879	LSM-30921		54619248	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22+,28+/m1/s1	YAJYINBQFXCAPI-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccc(F)c4	BroadT	BRD-K56962879	BRD-K56962879-001-01-5	Broad Institute of MIT and Harvard	BRD-K56962879			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22+,28+/m1/s1	YAJYINBQFXCAPI-WENCSYSZSA-N	571.251620236							119473
BRD-K94115999	LSM-30922		54619123	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18+,23+/m1/s1	UTNRSLHBUZLCKT-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K94115999	BRD-K94115999-001-01-9	Broad Institute of MIT and Harvard	BRD-K94115999			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18+,23+/m1/s1	UTNRSLHBUZLCKT-STSQHVNTSA-N	471.273321314							119474
MLS003130279	LSM-30923	SID99359065, BRD-K34425014	46903715	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23-,28+/m1/s1	OOYLJRYZMKTJGR-MRJKTFCFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K34425014	BRD-K34425014-001-02-4	Broad Institute of MIT and Harvard	BRD-K34425014			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23-,28+/m1/s1	OOYLJRYZMKTJGR-MRJKTFCFSA-N	538.250143026							119475
BRD-K32893898	LSM-30924		54619089	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19+,25+/m1/s1	BCONNRULZQNARA-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K32893898	BRD-K32893898-001-01-8	Broad Institute of MIT and Harvard	BRD-K32893898			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19+,25+/m1/s1	BCONNRULZQNARA-WYEJZRMESA-N	478.238019092							119476
BRD-K05511449	LSM-30925		54619172	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21+,27+/m1/s1	RUWJTSGBQQPZMY-BUEREQSYSA-N	COc1cccc(c1)c2ccc3c(O[C@@H](CN(C)Cc4ccncc4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K05511449	BRD-K05511449-001-01-3	Broad Institute of MIT and Harvard	BRD-K05511449			COc1cccc(c1)-c1ccc2c(O[C@@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21+,27+/m1/s1	RUWJTSGBQQPZMY-BUEREQSYSA-N	525.22974194							119477
BRD-K97645882	LSM-30926		54619194	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20-,26+/m0/s1	PFCOQLZGWKMRNP-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K97645882	BRD-K97645882-001-01-2	Broad Institute of MIT and Harvard	BRD-K97645882			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20-,26+/m0/s1	PFCOQLZGWKMRNP-CUVVAGTFSA-N	507.273321314							119478
BRD-K84023371	LSM-15058		54619055	InChI=1S/C21H26FN3O3/c1-13-11-25(14(2)12-26)21(27)17-8-15(16-6-4-5-7-18(16)22)9-24-20(17)28-19(13)10-23-3/h4-9,13-14,19,23,26H,10-12H2,1-3H3/t13-,14-,19-/m1/s1	SHRVDEFCKQVYRH-PJIJBLCYSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K84023371	BRD-K84023371-001-01-5	Broad Institute of MIT and Harvard	BRD-K84023371			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C21H26FN3O3/c1-13-11-25(14(2)12-26)21(27)17-8-15(16-6-4-5-7-18(16)22)9-24-20(17)28-19(13)10-23-3/h4-9,13-14,19,23,26H,10-12H2,1-3H3/t13-,14-,19-/m1/s1	SHRVDEFCKQVYRH-PJIJBLCYSA-N	387.195819922							103714
BRD-K70116395	LSM-30927		54619000	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21+,26-/m0/s1	RQONCHIHFCKYAZ-UZINWLIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K70116395	BRD-K70116395-001-01-5	Broad Institute of MIT and Harvard	BRD-K70116395			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21+,26-/m0/s1	RQONCHIHFCKYAZ-UZINWLIJSA-N	541.22465656							119479
BRD-K63304393	LSM-30928		54619067	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22-,27-/m1/s1	UXOYYOHZEHALJU-VHFRWLAGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K63304393	BRD-K63304393-001-01-8	Broad Institute of MIT and Harvard	BRD-K63304393			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22-,27-/m1/s1	UXOYYOHZEHALJU-VHFRWLAGSA-N	518.289305736							119480
BRD-K67342890	LSM-30929		54619173	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28+/m0/s1	WYRLQFCCGHRJLO-RXYILKCJSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@H](CN(C)C(=O)c4ccccn4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K67342890	BRD-K67342890-001-01-2	Broad Institute of MIT and Harvard	BRD-K67342890			COc1ccc(cc1)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28+/m0/s1	WYRLQFCCGHRJLO-RXYILKCJSA-N	563.209006496							119481
BRD-K07501326	LSM-30930		54619069	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18+,23-/m1/s1	UTNRSLHBUZLCKT-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K07501326	BRD-K07501326-001-01-0	Broad Institute of MIT and Harvard	BRD-K07501326			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18+,23-/m1/s1	UTNRSLHBUZLCKT-IEGUWTFLSA-N	471.273321314							119482
BRD-K21077610	LSM-30931		54619113	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19-,25+/m0/s1	BCONNRULZQNARA-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K21077610	BRD-K21077610-001-01-8	Broad Institute of MIT and Harvard	BRD-K21077610			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19-,25+/m0/s1	BCONNRULZQNARA-XHNVNVPESA-N	478.238019092							119483
BRD-K35095050	LSM-43607		54619008	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19+,23-/m0/s1	PJAYKLYFYLNPHZ-OGKFIPCTSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K35095050	BRD-K35095050-001-01-1	Broad Institute of MIT and Harvard	BRD-K35095050			C\C=C\c1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19+,23-/m0/s1	PJAYKLYFYLNPHZ-OGKFIPCTSA-N	466.250143026							
BRD-K70412800	LSM-30932		54619125	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19-,25-/m1/s1	BCONNRULZQNARA-MPCDZSKCSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K70412800	BRD-K70412800-001-01-7	Broad Institute of MIT and Harvard	BRD-K70412800			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19-,25-/m1/s1	BCONNRULZQNARA-MPCDZSKCSA-N	478.238019092							119484
BRD-K21610715	LSM-30933		54619143	InChI=1S/C23H33N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h11-12,16-18,21,24,27H,4-8,13-15H2,1-3H3/t16-,17-,21-/m0/s1	PFFBWYBXOPTHIK-FIKGOQFSSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC3CCCCC3	BroadT	BRD-K21610715	BRD-K21610715-001-01-0	Broad Institute of MIT and Harvard	BRD-K21610715			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CC1CCCCC1	InChI=1S/C23H33N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h11-12,16-18,21,24,27H,4-8,13-15H2,1-3H3/t16-,17-,21-/m0/s1	PFFBWYBXOPTHIK-FIKGOQFSSA-N	399.252191946							119485
CHEMBL2356922	LSM-30934	SID131414402, BRD-K21216961	54619285	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22+,28-/m0/s1	YAJYINBQFXCAPI-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccc(F)c4	BroadT	BRD-K21216961	BRD-K21216961-001-01-7	Broad Institute of MIT and Harvard	BRD-K21216961			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22+,28-/m0/s1	YAJYINBQFXCAPI-TYPXCFOJSA-N	571.251620236							131294
BRD-K47391428	LSM-30935		54619203	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21-,28+/m0/s1	CBIJUIOTIYQLMH-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K47391428	BRD-K47391428-001-01-5	Broad Institute of MIT and Harvard	BRD-K47391428			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21-,28+/m0/s1	CBIJUIOTIYQLMH-YHGPEZAFSA-N	612.241783834							119488
BRD-K73143323	LSM-30936		54619041	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21-,27+/m0/s1	RUWJTSGBQQPZMY-NOMHHCBYSA-N	COc1cccc(c1)c2ccc3c(O[C@H](CN(C)Cc4ccncc4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K73143323	BRD-K73143323-001-01-3	Broad Institute of MIT and Harvard	BRD-K73143323			COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21-,27+/m0/s1	RUWJTSGBQQPZMY-NOMHHCBYSA-N	525.22974194							119489
BRD-K35894044	LSM-30937		54619092	InChI=1S/C23H33N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h11-12,16-18,21,24,27H,4-8,13-15H2,1-3H3/t16-,17-,21-/m1/s1	PFFBWYBXOPTHIK-CBGDNZLLSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC3CCCCC3	BroadT	BRD-K35894044	BRD-K35894044-001-01-6	Broad Institute of MIT and Harvard	BRD-K35894044			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CC1CCCCC1	InChI=1S/C23H33N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h11-12,16-18,21,24,27H,4-8,13-15H2,1-3H3/t16-,17-,21-/m1/s1	PFFBWYBXOPTHIK-CBGDNZLLSA-N	399.252191946							119490
BRD-K88457220	LSM-30938		54619247	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18+,24-/m0/s1	SHPIGGYHGMASQB-RHGYRFJNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K88457220	BRD-K88457220-001-01-4	Broad Institute of MIT and Harvard	BRD-K88457220			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18+,24-/m0/s1	SHPIGGYHGMASQB-RHGYRFJNSA-N	496.248583776							119491
BRD-K71840205	LSM-30939		54619286	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16-,21-/m0/s1	COMCBBHOXAZBGZ-QYWGDWMGSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)c3ccc(F)cc3	BroadT	BRD-K71840205	BRD-K71840205-001-01-9	Broad Institute of MIT and Harvard	BRD-K71840205			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16-,21-/m0/s1	COMCBBHOXAZBGZ-QYWGDWMGSA-N	500.145106248							119492
BRD-K37161540	LSM-30940		54619052	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19+,22-/m0/s1	ZBLNAKCVTQSUGS-JQVVWYNYSA-N	COCC#Cc1cnc2O[C@@H](CN(C)C(=O)CN3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K37161540	BRD-K37161540-001-01-7	Broad Institute of MIT and Harvard	BRD-K37161540			COCC#Cc1cnc2O[C@@H](CN(C)C(=O)CN3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19+,22-/m0/s1	ZBLNAKCVTQSUGS-JQVVWYNYSA-N	488.263484912							119493
BRD-K75784799	LSM-30941		54619157	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14+,18+/m0/s1	GYAQMILCNYFRMN-PMUMKWKESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K75784799	BRD-K75784799-001-01-7	Broad Institute of MIT and Harvard	BRD-K75784799			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc2ncc(Br)cc2C1=O	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14+,18+/m0/s1	GYAQMILCNYFRMN-PMUMKWKESA-N	476.10591792							119494
BRD-K47926785	LSM-30942		54619017	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19-,24-/m0/s1	QSIOMQGNLKPVMQ-JXQFQVJHSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K47926785	BRD-K47926785-001-01-5	Broad Institute of MIT and Harvard	BRD-K47926785			CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19-,24-/m0/s1	QSIOMQGNLKPVMQ-JXQFQVJHSA-N	496.248583776							119495
BRD-K27446479	LSM-30943		54619291	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28-/m1/s1	WYRLQFCCGHRJLO-RZIGYZOXSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@H](CN(C)C(=O)c4ccccn4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K27446479	BRD-K27446479-001-01-9	Broad Institute of MIT and Harvard	BRD-K27446479			COc1ccc(cc1)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28-/m1/s1	WYRLQFCCGHRJLO-RZIGYZOXSA-N	563.209006496							119496
BRD-K30642434	LSM-30944		54619063	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23+,28-/m0/s1	OOYLJRYZMKTJGR-JWZKTCGFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K30642434	BRD-K30642434-001-01-2	Broad Institute of MIT and Harvard	BRD-K30642434			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23+,28-/m0/s1	OOYLJRYZMKTJGR-JWZKTCGFSA-N	538.250143026							119497
CHEMBL2359003	LSM-30945	SID131414294, BRD-K15389388	54619179	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22-,28-/m1/s1	YAJYINBQFXCAPI-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccc(F)c4	BroadT	BRD-K15389388	BRD-K15389388-001-01-5	Broad Institute of MIT and Harvard	BRD-K15389388			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22-,28-/m1/s1	YAJYINBQFXCAPI-DQCZWYHMSA-N	571.251620236							119498
BRD-K25525067	LSM-30946		54619130	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16+,20+/m0/s1	MCOJFHYNZBKTQP-RZQQEMMASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)C#CC3CC3	BroadT	BRD-K25525067	BRD-K25525067-001-01-0	Broad Institute of MIT and Harvard	BRD-K25525067			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16+,20+/m0/s1	MCOJFHYNZBKTQP-RZQQEMMASA-N	470.15452808							119499
BRD-K69701217	LSM-30947		54619228	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21-,28-/m1/s1	CBIJUIOTIYQLMH-UMQWNRPGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K69701217	BRD-K69701217-001-01-3	Broad Institute of MIT and Harvard	BRD-K69701217			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21-,28-/m1/s1	CBIJUIOTIYQLMH-UMQWNRPGSA-N	612.241783834							119500
BRD-K00247543	LSM-30948		54619097	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21-,26+/m0/s1	RQONCHIHFCKYAZ-ISJBWFOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K00247543	BRD-K00247543-001-01-4	Broad Institute of MIT and Harvard	BRD-K00247543			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21-,26+/m0/s1	RQONCHIHFCKYAZ-ISJBWFOZSA-N	541.22465656							119501
BRD-K77958314	LSM-44296		54619253	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23+,27-/m0/s1	BANHLTBDTXCVOB-WEQLOXOTSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K77958314	BRD-K77958314-001-01-1	Broad Institute of MIT and Harvard	BRD-K77958314			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23+,27-/m0/s1	BANHLTBDTXCVOB-WEQLOXOTSA-N	557.255956688							
BRD-K82594742	LSM-30950		54619167	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16+,21+/m1/s1	COMCBBHOXAZBGZ-XFQAVAEZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)c3ccc(F)cc3	BroadT	BRD-K82594742	BRD-K82594742-001-01-9	Broad Institute of MIT and Harvard	BRD-K82594742			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16+,21+/m1/s1	COMCBBHOXAZBGZ-XFQAVAEZSA-N	500.145106248							119503
BRD-K63800697	LSM-30951		54619163	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20-,26+/m0/s1	WLIQRYRMKDXINK-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4ccncc4	BroadT	BRD-K63800697	BRD-K63800697-001-01-8	Broad Institute of MIT and Harvard	BRD-K63800697			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1ccncc1	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20-,26+/m0/s1	WLIQRYRMKDXINK-CUVVAGTFSA-N	516.217283648							119504
BRD-K94005961	LSM-15067		54619129	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20-,25-/m1/s1	ZECMXSZSTQYLBY-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K94005961	BRD-K94005961-001-01-6	Broad Institute of MIT and Harvard	BRD-K94005961			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20-,25-/m1/s1	ZECMXSZSTQYLBY-UMEGOILYSA-N	492.273655672							103723
BRD-K45400577	LSM-30952		54619235	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18+,24+/m1/s1	YKMJVYSWBOXOTH-YTZAWJCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K45400577	BRD-K45400577-001-01-5	Broad Institute of MIT and Harvard	BRD-K45400577			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18+,24+/m1/s1	YKMJVYSWBOXOTH-YTZAWJCFSA-N	528.184268958							119505
BRD-K83941994	LSM-15167		54619252	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28+/m1/s1	PEEJAUXHJGOSQX-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K83941994	BRD-K83941994-001-01-6	Broad Institute of MIT and Harvard	BRD-K83941994			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28+/m1/s1	PEEJAUXHJGOSQX-GGJMMHKRSA-N	537.209755424							103823
BRD-K56161792	LSM-30953		54619274	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21+,28+/m1/s1	ZMKYSZODYJXXSG-GGJMMHKRSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)c4ccccc4OC)c1	BroadT	BRD-K56161792	BRD-K56161792-001-01-8	Broad Institute of MIT and Harvard	BRD-K56161792			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)-c2ccccc2OC)c1	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21+,28+/m1/s1	ZMKYSZODYJXXSG-GGJMMHKRSA-N	583.235221244							119506
BRD-K85232515	LSM-30954		54619141	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23-,28+/m0/s1	OOYLJRYZMKTJGR-UXWDXCIHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K85232515	BRD-K85232515-001-01-8	Broad Institute of MIT and Harvard	BRD-K85232515			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23-,28+/m0/s1	OOYLJRYZMKTJGR-UXWDXCIHSA-N	538.250143026							119507
BRD-K59626557	LSM-30955		54619051	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19-,25-/m0/s1	BCONNRULZQNARA-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K59626557	BRD-K59626557-001-01-2	Broad Institute of MIT and Harvard	BRD-K59626557			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19-,25-/m0/s1	BCONNRULZQNARA-MHPIHPPYSA-N	478.238019092							119508
BRD-K28446462	LSM-30956		54619180	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20-,26-/m0/s1	WLIQRYRMKDXINK-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4ccncc4	BroadT	BRD-K28446462	BRD-K28446462-001-01-7	Broad Institute of MIT and Harvard	BRD-K28446462			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1ccncc1	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20-,26-/m0/s1	WLIQRYRMKDXINK-DYLHXGEVSA-N	516.217283648							119509
BRD-K74096348	LSM-30957		54619184	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21+,25+/m1/s1	XZDMLRGMHLQVSQ-CZSZKKDXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K74096348	BRD-K74096348-001-01-3	Broad Institute of MIT and Harvard	BRD-K74096348			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21+,25+/m1/s1	XZDMLRGMHLQVSQ-CZSZKKDXSA-N	520.268570292							119510
BRD-K96096192	LSM-30958		54619114	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22-,27+/m0/s1	UXOYYOHZEHALJU-BCQCSXDESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K96096192	BRD-K96096192-001-01-4	Broad Institute of MIT and Harvard	BRD-K96096192			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22-,27+/m0/s1	UXOYYOHZEHALJU-BCQCSXDESA-N	518.289305736							119511
BRD-K41729242	LSM-30959		54619283	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19+,25-/m1/s1	BCONNRULZQNARA-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K41729242	BRD-K41729242-001-01-6	Broad Institute of MIT and Harvard	BRD-K41729242			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19+,25-/m1/s1	BCONNRULZQNARA-HHJKRLRDSA-N	478.238019092							119512
BRD-K86694287	LSM-30960		54619261	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19-,24-/m0/s1	AOAVRGNJVMAOBU-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K86694287	BRD-K86694287-001-01-4	Broad Institute of MIT and Harvard	BRD-K86694287			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19-,24-/m0/s1	AOAVRGNJVMAOBU-JXQFQVJHSA-N	516.240640982							119513
BRD-K18165270	LSM-30961		54619042	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20-,26-/m1/s1	PFCOQLZGWKMRNP-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K18165270	BRD-K18165270-001-01-7	Broad Institute of MIT and Harvard	BRD-K18165270			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20-,26-/m1/s1	PFCOQLZGWKMRNP-XMERXJNXSA-N	507.273321314							119514
BRD-K28772163	LSM-30962		54619137	InChI=1S/C23H27FN2O4S/c1-16-14-26(17(2)15-27)31(28,29)23-11-9-18(12-21(23)30-22(16)13-25-3)8-10-19-6-4-5-7-20(19)24/h4-7,9,11-12,16-17,22,25,27H,13-15H2,1-3H3/t16-,17+,22+/m1/s1	SJHPEWGCSFZDDK-JLHGSKIFSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc3ccccc3F	BroadT	BRD-K28772163	BRD-K28772163-001-01-8	Broad Institute of MIT and Harvard	BRD-K28772163			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#Cc1ccccc1F	InChI=1S/C23H27FN2O4S/c1-16-14-26(17(2)15-27)31(28,29)23-11-9-18(12-21(23)30-22(16)13-25-3)8-10-19-6-4-5-7-20(19)24/h4-7,9,11-12,16-17,22,25,27H,13-15H2,1-3H3/t16-,17+,22+/m1/s1	SJHPEWGCSFZDDK-JLHGSKIFSA-N	446.167556254							119515
BRD-K12762764	LSM-30963		54619192	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19-,25-/m1/s1	KFAQLLCHSMBKLV-MPCDZSKCSA-N	COCC#Cc1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K12762764	BRD-K12762764-001-01-0	Broad Institute of MIT and Harvard	BRD-K12762764			COCC#Cc1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19-,25-/m1/s1	KFAQLLCHSMBKLV-MPCDZSKCSA-N	495.236935806							119516
BRD-K48782834	LSM-30964		54619202	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20+,26-/m0/s1	WLIQRYRMKDXINK-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4ccncc4	BroadT	BRD-K48782834	BRD-K48782834-001-01-2	Broad Institute of MIT and Harvard	BRD-K48782834			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1ccncc1	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20+,26-/m0/s1	WLIQRYRMKDXINK-UNVFRBQDSA-N	516.217283648							119517
BRD-K73748146	LSM-30965		54619007	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18+,24+/m0/s1	SHPIGGYHGMASQB-HOOSLVGPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K73748146	BRD-K73748146-001-01-4	Broad Institute of MIT and Harvard	BRD-K73748146			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18+,24+/m0/s1	SHPIGGYHGMASQB-HOOSLVGPSA-N	496.248583776							119518
BRD-K57406954	LSM-15042		44505703	InChI=1S/C28H38N4O3/c1-20-9-7-10-24(13-20)17-31(6)18-26-21(2)16-32(22(3)19-33)28(34)25-14-23(11-8-12-30(4)5)15-29-27(25)35-26/h7,9-10,13-15,21-22,26,33H,12,16-19H2,1-6H3/t21-,22+,26-/m0/s1	ULRIVBOCOZEEJW-VRUMLPLGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(C)c2)Oc3ncc(cc3C1=O)C#CCN(C)C	BroadT	BRD-K57406954	BRD-K57406954-001-01-0	Broad Institute of MIT and Harvard	BRD-K57406954			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(C)c2)Oc2ncc(cc2C1=O)C#CCN(C)C	InChI=1S/C28H38N4O3/c1-20-9-7-10-24(13-20)17-31(6)18-26-21(2)16-32(22(3)19-33)28(34)25-14-23(11-8-12-30(4)5)15-29-27(25)35-26/h7,9-10,13-15,21-22,26,33H,12,16-19H2,1-6H3/t21-,22+,26-/m0/s1	ULRIVBOCOZEEJW-VRUMLPLGSA-N	478.294391116							103698
BRD-K64264170	LSM-30966		54619144	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21+,26+/m0/s1	UWPUNYQEQGJQBN-LZCXECNNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K64264170	BRD-K64264170-001-01-2	Broad Institute of MIT and Harvard	BRD-K64264170			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21+,26+/m0/s1	UWPUNYQEQGJQBN-LZCXECNNSA-N	523.214091876							119519
BRD-K83667863	LSM-30967		54619074	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19+,25-/m1/s1	KFAQLLCHSMBKLV-HHJKRLRDSA-N	COCC#Cc1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K83667863	BRD-K83667863-001-01-5	Broad Institute of MIT and Harvard	BRD-K83667863			COCC#Cc1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19+,25-/m1/s1	KFAQLLCHSMBKLV-HHJKRLRDSA-N	495.236935806							119520
BRD-K69758940	LSM-44297		54619151	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19+,25-/m1/s1	ZTEKSXAQYWYLFD-MIWMZBCHSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K69758940	BRD-K69758940-001-01-7	Broad Institute of MIT and Harvard	BRD-K69758940			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19+,25-/m1/s1	ZTEKSXAQYWYLFD-MIWMZBCHSA-N	533.26381927							
BRD-K93311750	LSM-30969		54619022	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23+,28+/m1/s1	LUSCQGWIOGZNHP-IWHLBADBSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)C#CCC4CCCC4	BroadT	BRD-K93311750	BRD-K93311750-001-01-4	Broad Institute of MIT and Harvard	BRD-K93311750			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC1CCCC1	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23+,28+/m1/s1	LUSCQGWIOGZNHP-IWHLBADBSA-N	604.227693020001							119522
BRD-K25845233	LSM-30970		54619264	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20+,26+/m0/s1	PFCOQLZGWKMRNP-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K25845233	BRD-K25845233-001-01-1	Broad Institute of MIT and Harvard	BRD-K25845233			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20+,26+/m0/s1	PFCOQLZGWKMRNP-OUDXUNEISA-N	507.273321314							119523
BRD-K66328525	LSM-30971		54619233	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18+,22+/m1/s1	LKPBUWUQVMPFSV-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K66328525	BRD-K66328525-001-01-5	Broad Institute of MIT and Harvard	BRD-K66328525			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18+,22+/m1/s1	LKPBUWUQVMPFSV-FGSXEWAUSA-N	517.23588996							119524
BRD-K12764160	LSM-30972		54619027	InChI=1S/C24H37N3O3/c1-7-11-26(6)15-22-18(4)14-27(19(5)16-28)24(29)21-12-20(10-8-9-17(2)3)13-25-23(21)30-22/h12-13,17-19,22,28H,7,9,11,14-16H2,1-6H3/t18-,19-,22+/m0/s1	RJPYWVJCIKXYIX-CNNODRBYSA-N	CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCC(C)C	BroadT	BRD-K12764160	BRD-K12764160-001-01-6	Broad Institute of MIT and Harvard	BRD-K12764160			CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCC(C)C	InChI=1S/C24H37N3O3/c1-7-11-26(6)15-22-18(4)14-27(19(5)16-28)24(29)21-12-20(10-8-9-17(2)3)13-25-23(21)30-22/h12-13,17-19,22,28H,7,9,11,14-16H2,1-6H3/t18-,19-,22+/m0/s1	RJPYWVJCIKXYIX-CNNODRBYSA-N	415.283492074							119525
BRD-K99179079	LSM-30973		54619229	InChI=1S/C24H33N3O5S/c1-16-14-27(17(2)15-28)33(30,31)23-10-9-19(12-21(23)32-22(16)13-25-3)18-7-6-8-20(11-18)24(29)26(4)5/h6-12,16-17,22,25,28H,13-15H2,1-5H3/t16-,17+,22-/m1/s1	BXSLUDILSQPBHO-HYFFOGBASA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3cccc(c3)C(=O)N(C)C	BroadT	BRD-K99179079	BRD-K99179079-001-01-3	Broad Institute of MIT and Harvard	BRD-K99179079			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C24H33N3O5S/c1-16-14-27(17(2)15-28)33(30,31)23-10-9-19(12-21(23)32-22(16)13-25-3)18-7-6-8-20(11-18)24(29)26(4)5/h6-12,16-17,22,25,28H,13-15H2,1-5H3/t16-,17+,22-/m1/s1	BXSLUDILSQPBHO-HYFFOGBASA-N	475.214091876							119526
BRD-K92180676	LSM-30974		54619198	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21+,27-/m1/s1	RUWJTSGBQQPZMY-PBDKAQRYSA-N	COc1cccc(c1)c2ccc3c(O[C@H](CN(C)Cc4ccncc4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K92180676	BRD-K92180676-001-01-5	Broad Institute of MIT and Harvard	BRD-K92180676			COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21+,27-/m1/s1	RUWJTSGBQQPZMY-PBDKAQRYSA-N	525.22974194							119527
BRD-K69330661	LSM-44298		54619168	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19-,23+/m0/s1	BEUJQTDXAJTLJD-DRNXGGFFSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K69330661	BRD-K69330661-001-01-2	Broad Institute of MIT and Harvard	BRD-K69330661			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19-,23+/m0/s1	BEUJQTDXAJTLJD-DRNXGGFFSA-N	472.203192834							
BRD-K77314101	LSM-30976		54619208	InChI=1S/C24H37N3O3/c1-7-11-26(6)15-22-18(4)14-27(19(5)16-28)24(29)21-12-20(10-8-9-17(2)3)13-25-23(21)30-22/h12-13,17-19,22,28H,7,9,11,14-16H2,1-6H3/t18-,19-,22+/m1/s1	RJPYWVJCIKXYIX-KNKQGSTJSA-N	CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CCC(C)C	BroadT	BRD-K77314101	BRD-K77314101-001-01-4	Broad Institute of MIT and Harvard	BRD-K77314101			CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CCC(C)C	InChI=1S/C24H37N3O3/c1-7-11-26(6)15-22-18(4)14-27(19(5)16-28)24(29)21-12-20(10-8-9-17(2)3)13-25-23(21)30-22/h12-13,17-19,22,28H,7,9,11,14-16H2,1-6H3/t18-,19-,22+/m1/s1	RJPYWVJCIKXYIX-KNKQGSTJSA-N	415.283492074							119529
BRD-K02403042	LSM-30977		54619068	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28+/m1/s1	WYRLQFCCGHRJLO-XJGOYTCSSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@@H](CN(C)C(=O)c4ccccn4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K02403042	BRD-K02403042-001-01-7	Broad Institute of MIT and Harvard	BRD-K02403042			COc1ccc(cc1)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28+/m1/s1	WYRLQFCCGHRJLO-XJGOYTCSSA-N	563.209006496							119530
BRD-K05221385	LSM-30978		54619029	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18-,24-/m0/s1	SHPIGGYHGMASQB-XFAGBWLFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K05221385	BRD-K05221385-001-01-5	Broad Institute of MIT and Harvard	BRD-K05221385			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18-,24-/m0/s1	SHPIGGYHGMASQB-XFAGBWLFSA-N	496.248583776							119531
BRD-K33075278	LSM-30979		54619040	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19-,22+/m0/s1	ZBLNAKCVTQSUGS-CNNODRBYSA-N	COCC#Cc1cnc2O[C@H](CN(C)C(=O)CN3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K33075278	BRD-K33075278-001-01-1	Broad Institute of MIT and Harvard	BRD-K33075278			COCC#Cc1cnc2O[C@H](CN(C)C(=O)CN3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19-,22+/m0/s1	ZBLNAKCVTQSUGS-CNNODRBYSA-N	488.263484912							119532
BRD-K28919392	LSM-30980		54619298	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19-,24+/m0/s1	AOAVRGNJVMAOBU-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K28919392	BRD-K28919392-001-01-8	Broad Institute of MIT and Harvard	BRD-K28919392			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19-,24+/m0/s1	AOAVRGNJVMAOBU-AXHZCLLHSA-N	516.240640982							119533
BRD-K04462989	LSM-30981		54619084	InChI=1S/C21H26FN3O3/c1-13-11-25(14(2)12-26)21(27)17-8-15(16-6-4-5-7-18(16)22)9-24-20(17)28-19(13)10-23-3/h4-9,13-14,19,23,26H,10-12H2,1-3H3/t13-,14+,19-/m1/s1	SHRVDEFCKQVYRH-BIENJYKASA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K04462989	BRD-K04462989-001-01-6	Broad Institute of MIT and Harvard	BRD-K04462989			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C21H26FN3O3/c1-13-11-25(14(2)12-26)21(27)17-8-15(16-6-4-5-7-18(16)22)9-24-20(17)28-19(13)10-23-3/h4-9,13-14,19,23,26H,10-12H2,1-3H3/t13-,14+,19-/m1/s1	SHRVDEFCKQVYRH-BIENJYKASA-N	387.195819922							119534
BRD-K84265814	LSM-30982		54619226	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21-,25+/m1/s1	FGDWBZCHFJENJN-OTPAQWSUSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CCc3ccccc3	BroadT	BRD-K84265814	BRD-K84265814-001-01-7	Broad Institute of MIT and Harvard	BRD-K84265814			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CCc1ccccc1	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21-,25+/m1/s1	FGDWBZCHFJENJN-OTPAQWSUSA-N	492.273655672							119535
BRD-K14589361	LSM-30983		54619220	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16-,20-/m0/s1	MCOJFHYNZBKTQP-FTRWYGJKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)C#CC3CC3	BroadT	BRD-K14589361	BRD-K14589361-001-01-2	Broad Institute of MIT and Harvard	BRD-K14589361			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16-,20-/m0/s1	MCOJFHYNZBKTQP-FTRWYGJKSA-N	470.15452808							119536
BRD-K50432649	LSM-30984		54619101	InChI=1S/C23H33N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h11-12,16-18,21,24,27H,4-8,13-15H2,1-3H3/t16-,17+,21-/m0/s1	PFFBWYBXOPTHIK-FVJLSDCUSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC3CCCCC3	BroadT	BRD-K50432649	BRD-K50432649-001-01-4	Broad Institute of MIT and Harvard	BRD-K50432649			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC1CCCCC1	InChI=1S/C23H33N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h11-12,16-18,21,24,27H,4-8,13-15H2,1-3H3/t16-,17+,21-/m0/s1	PFFBWYBXOPTHIK-FVJLSDCUSA-N	399.252191946							119537
MLS003128908	LSM-30985	SID99359343, BRD-K93268593	46903907	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14-,18-/m0/s1	GYAQMILCNYFRMN-DEYYWGMASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K93268593	BRD-K93268593-001-02-5	Broad Institute of MIT and Harvard	BRD-K93268593			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc2ncc(Br)cc2C1=O	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14-,18-/m0/s1	GYAQMILCNYFRMN-DEYYWGMASA-N	476.10591792							119538
BRD-K91098396	LSM-30986		54619176	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21+,25+/m1/s1	FGDWBZCHFJENJN-CZSZKKDXSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCc3ccccc3	BroadT	BRD-K91098396	BRD-K91098396-001-01-9	Broad Institute of MIT and Harvard	BRD-K91098396			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCc1ccccc1	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21+,25+/m1/s1	FGDWBZCHFJENJN-CZSZKKDXSA-N	492.273655672							119539
BRD-K88830558	LSM-30987		54619047	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19+,25+/m0/s1	KFAQLLCHSMBKLV-OSWQYVSFSA-N	COCC#Cc1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K88830558	BRD-K88830558-001-01-4	Broad Institute of MIT and Harvard	BRD-K88830558			COCC#Cc1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19+,25+/m0/s1	KFAQLLCHSMBKLV-OSWQYVSFSA-N	495.236935806							119540
BRD-K81246784	LSM-44299		54619297	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19-,25-/m1/s1	ZTEKSXAQYWYLFD-SCBRMSJUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K81246784	BRD-K81246784-001-01-6	Broad Institute of MIT and Harvard	BRD-K81246784			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19-,25-/m1/s1	ZTEKSXAQYWYLFD-SCBRMSJUSA-N	533.26381927							
BRD-K68041812	LSM-30989		54619197	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21+,25-/m1/s1	XZDMLRGMHLQVSQ-TYBLODHISA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K68041812	BRD-K68041812-001-01-4	Broad Institute of MIT and Harvard	BRD-K68041812			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21+,25-/m1/s1	XZDMLRGMHLQVSQ-TYBLODHISA-N	520.268570292							119542
BRD-K46395222	LSM-30990		54619099	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16-,20+/m1/s1	MCOJFHYNZBKTQP-QINHECLXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)C#CC3CC3	BroadT	BRD-K46395222	BRD-K46395222-001-01-5	Broad Institute of MIT and Harvard	BRD-K46395222			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16-,20+/m1/s1	MCOJFHYNZBKTQP-QINHECLXSA-N	470.15452808							119543
BRD-K66539236	LSM-30991		54619187	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18-,22+/m1/s1	NALQGZGZTMNLHT-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccncc3	BroadT	BRD-K66539236	BRD-K66539236-001-01-7	Broad Institute of MIT and Harvard	BRD-K66539236			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18-,22+/m1/s1	NALQGZGZTMNLHT-HMFYCAOWSA-N	490.224990918							119544
BRD-K27788205	LSM-30992		54619116	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21-,25+/m0/s1	XZDMLRGMHLQVSQ-STWLZBDKSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K27788205	BRD-K27788205-001-01-5	Broad Institute of MIT and Harvard	BRD-K27788205			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21-,25+/m0/s1	XZDMLRGMHLQVSQ-STWLZBDKSA-N	520.268570292							119545
BRD-K27870441	LSM-30993		54619164	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21+,25-/m1/s1	FGDWBZCHFJENJN-TYBLODHISA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCc3ccccc3	BroadT	BRD-K27870441	BRD-K27870441-001-01-5	Broad Institute of MIT and Harvard	BRD-K27870441			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCc1ccccc1	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21+,25-/m1/s1	FGDWBZCHFJENJN-TYBLODHISA-N	492.273655672							119546
BRD-K86265745	LSM-15168		54619271	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20+,27-/m1/s1	CROBQSVNIOLQSN-IOKPGSKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K86265745	BRD-K86265745-001-01-9	Broad Institute of MIT and Harvard	BRD-K86265745			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20+,27-/m1/s1	CROBQSVNIOLQSN-IOKPGSKQSA-N	575.22654834							103824
BRD-K98018160	LSM-30994		54619222	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14+,18+/m1/s1	GYAQMILCNYFRMN-GLJUWKHASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K98018160	BRD-K98018160-001-01-4	Broad Institute of MIT and Harvard	BRD-K98018160			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc2ncc(Br)cc2C1=O	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14+,18+/m1/s1	GYAQMILCNYFRMN-GLJUWKHASA-N	476.10591792							119547
BRD-K34942615	LSM-44300		54619217	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21-,28+/m0/s1	LVQXARYEWHFWNX-UPNVNQCQSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(\C=C\c5ccccc5)cc4C1=O	BroadT	BRD-K34942615	BRD-K34942615-001-01-3	Broad Institute of MIT and Harvard	BRD-K34942615			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21-,28+/m0/s1	LVQXARYEWHFWNX-UPNVNQCQSA-N	543.236935806							
BRD-K31509669	LSM-30996		54619093	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19+,25+/m0/s1	BCONNRULZQNARA-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K31509669	BRD-K31509669-001-01-8	Broad Institute of MIT and Harvard	BRD-K31509669			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19+,25+/m0/s1	BCONNRULZQNARA-OSWQYVSFSA-N	478.238019092							119549
BRD-K85456301	LSM-30997		54619032	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20-,27+/m1/s1	CROBQSVNIOLQSN-DVHCVUMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K85456301	BRD-K85456301-001-01-1	Broad Institute of MIT and Harvard	BRD-K85456301			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20-,27+/m1/s1	CROBQSVNIOLQSN-DVHCVUMVSA-N	575.22654834							119550
BRD-K77906431	LSM-30998		54619098	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18+,24-/m0/s1	YKMJVYSWBOXOTH-RHGYRFJNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K77906431	BRD-K77906431-001-01-8	Broad Institute of MIT and Harvard	BRD-K77906431			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18+,24-/m0/s1	YKMJVYSWBOXOTH-RHGYRFJNSA-N	528.184268958							119551
BRD-K57091606	LSM-30999		54619266	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21+,28-/m1/s1	CBIJUIOTIYQLMH-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K57091606	BRD-K57091606-001-01-2	Broad Institute of MIT and Harvard	BRD-K57091606			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21+,28-/m1/s1	CBIJUIOTIYQLMH-PHVLTXCSSA-N	612.241783834							119552
BRD-K29744282	LSM-44301		54619135	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19+,23+/m1/s1	PJAYKLYFYLNPHZ-PIHFRFDSSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K29744282	BRD-K29744282-001-01-2	Broad Institute of MIT and Harvard	BRD-K29744282			C\C=C\c1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19+,23+/m1/s1	PJAYKLYFYLNPHZ-PIHFRFDSSA-N	466.250143026							
BRD-K48408404	LSM-31001		54619013	InChI=1S/C23H27FN2O4S/c1-16-14-26(17(2)15-27)31(28,29)23-11-9-18(12-21(23)30-22(16)13-25-3)8-10-19-6-4-5-7-20(19)24/h4-7,9,11-12,16-17,22,25,27H,13-15H2,1-3H3/t16-,17+,22+/m0/s1	SJHPEWGCSFZDDK-GSHUGGBRSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc3ccccc3F	BroadT	BRD-K48408404	BRD-K48408404-001-01-4	Broad Institute of MIT and Harvard	BRD-K48408404			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#Cc1ccccc1F	InChI=1S/C23H27FN2O4S/c1-16-14-26(17(2)15-27)31(28,29)23-11-9-18(12-21(23)30-22(16)13-25-3)8-10-19-6-4-5-7-20(19)24/h4-7,9,11-12,16-17,22,25,27H,13-15H2,1-3H3/t16-,17+,22+/m0/s1	SJHPEWGCSFZDDK-GSHUGGBRSA-N	446.167556254							119554
BRD-K38601916	LSM-31002		54619001	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18-,22-/m1/s1	NALQGZGZTMNLHT-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccncc3	BroadT	BRD-K38601916	BRD-K38601916-001-01-7	Broad Institute of MIT and Harvard	BRD-K38601916			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18-,22-/m1/s1	NALQGZGZTMNLHT-JBYIUTFZSA-N	490.224990918							119555
BRD-K77210381	LSM-44302		54619270	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19-,23-/m0/s1	OYGLGTZFOSPOAJ-ZWPRVAANSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K77210381	BRD-K77210381-001-01-5	Broad Institute of MIT and Harvard	BRD-K77210381			C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19-,23-/m0/s1	OYGLGTZFOSPOAJ-ZWPRVAANSA-N	459.219177256							
BRD-K98784811	LSM-31004		54619079	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23+,28+/m0/s1	OOYLJRYZMKTJGR-SXDGJLEOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K98784811	BRD-K98784811-001-01-4	Broad Institute of MIT and Harvard	BRD-K98784811			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23+,28+/m0/s1	OOYLJRYZMKTJGR-SXDGJLEOSA-N	538.250143026							119557
BRD-K53046515	LSM-31005		54619132	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19+,25-/m0/s1	BCONNRULZQNARA-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K53046515	BRD-K53046515-001-01-0	Broad Institute of MIT and Harvard	BRD-K53046515			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19+,25-/m0/s1	BCONNRULZQNARA-CEYNDMKZSA-N	478.238019092							119558
BRD-K73769678	LSM-31006		54619073	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21-,25+/m0/s1	FGDWBZCHFJENJN-STWLZBDKSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCc3ccccc3	BroadT	BRD-K73769678	BRD-K73769678-001-01-6	Broad Institute of MIT and Harvard	BRD-K73769678			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCc1ccccc1	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21-,25+/m0/s1	FGDWBZCHFJENJN-STWLZBDKSA-N	492.273655672							119559
BRD-K44110036	LSM-31007		54619077	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21+,28-/m0/s1	ZMKYSZODYJXXSG-GTNJKRJXSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)c4ccccc4OC)c1	BroadT	BRD-K44110036	BRD-K44110036-001-01-6	Broad Institute of MIT and Harvard	BRD-K44110036			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)-c2ccccc2OC)c1	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21+,28-/m0/s1	ZMKYSZODYJXXSG-GTNJKRJXSA-N	583.235221244							119560
BRD-K13627844	LSM-31008		54619070	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28-/m0/s1	WYRLQFCCGHRJLO-TYPXCFOJSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@@H](CN(C)C(=O)c4ccccn4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K13627844	BRD-K13627844-001-01-8	Broad Institute of MIT and Harvard	BRD-K13627844			COc1ccc(cc1)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28-/m0/s1	WYRLQFCCGHRJLO-TYPXCFOJSA-N	563.209006496							119561
BRD-K54505735	LSM-44303		54619059	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19-,23+/m1/s1	PJAYKLYFYLNPHZ-KHLBRYDPSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K54505735	BRD-K54505735-001-01-8	Broad Institute of MIT and Harvard	BRD-K54505735			C\C=C\c1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19-,23+/m1/s1	PJAYKLYFYLNPHZ-KHLBRYDPSA-N	466.250143026							
BRD-K25328765	LSM-31010		54619015	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23+,28-/m1/s1	OOYLJRYZMKTJGR-AWVRMFGXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K25328765	BRD-K25328765-001-01-4	Broad Institute of MIT and Harvard	BRD-K25328765			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23+,28-/m1/s1	OOYLJRYZMKTJGR-AWVRMFGXSA-N	538.250143026							119563
BRD-K83062056	LSM-31011		54619265	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21-,25-/m1/s1	XZDMLRGMHLQVSQ-DNRQZRRGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K83062056	BRD-K83062056-001-01-6	Broad Institute of MIT and Harvard	BRD-K83062056			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21-,25-/m1/s1	XZDMLRGMHLQVSQ-DNRQZRRGSA-N	520.268570292							119564
BRD-K05535086	LSM-31012		54619181	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21-,28+/m0/s1	ZMKYSZODYJXXSG-YHGPEZAFSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)c4ccccc4OC)c1	BroadT	BRD-K05535086	BRD-K05535086-001-01-0	Broad Institute of MIT and Harvard	BRD-K05535086			COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)-c2ccccc2OC)c1	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21-,28+/m0/s1	ZMKYSZODYJXXSG-YHGPEZAFSA-N	583.235221244							119565
MLS003130050	LSM-31013	BRD-K68328788, SID99358634	46903413	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16-,20+/m0/s1	MCOJFHYNZBKTQP-TWOQFEAHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)C#CC3CC3	BroadT	BRD-K68328788	BRD-K68328788-001-02-3	Broad Institute of MIT and Harvard	BRD-K68328788			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16-,20+/m0/s1	MCOJFHYNZBKTQP-TWOQFEAHSA-N	470.15452808							119566
BRD-K22224629	LSM-31014		54619250	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21-,26+/m0/s1	UWPUNYQEQGJQBN-ISJBWFOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K22224629	BRD-K22224629-001-01-4	Broad Institute of MIT and Harvard	BRD-K22224629			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21-,26+/m0/s1	UWPUNYQEQGJQBN-ISJBWFOZSA-N	523.214091876							119567
BRD-K52908798	LSM-15149		54619080	InChI=1S/C24H33N3O5S/c1-16-14-27(17(2)15-28)33(30,31)23-10-9-19(12-21(23)32-22(16)13-25-3)18-7-6-8-20(11-18)24(29)26(4)5/h6-12,16-17,22,25,28H,13-15H2,1-5H3/t16-,17-,22+/m1/s1	BXSLUDILSQPBHO-YVHKJVDXSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)c3cccc(c3)C(=O)N(C)C	BroadT	BRD-K52908798	BRD-K52908798-001-01-0	Broad Institute of MIT and Harvard	BRD-K52908798			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C24H33N3O5S/c1-16-14-27(17(2)15-28)33(30,31)23-10-9-19(12-21(23)32-22(16)13-25-3)18-7-6-8-20(11-18)24(29)26(4)5/h6-12,16-17,22,25,28H,13-15H2,1-5H3/t16-,17-,22+/m1/s1	BXSLUDILSQPBHO-YVHKJVDXSA-N	475.214091876							103805
BRD-K67832115	LSM-31015		54619033	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28+/m1/s1	PEEJAUXHJGOSQX-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K67832115	BRD-K67832115-001-01-1	Broad Institute of MIT and Harvard	BRD-K67832115			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28+/m1/s1	PEEJAUXHJGOSQX-CJYOKPGZSA-N	537.209755424							119568
BRD-K22420960	LSM-15121		54619119	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22+,27-/m0/s1	UXOYYOHZEHALJU-XXAUWVGASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K22420960	BRD-K22420960-001-01-5	Broad Institute of MIT and Harvard	BRD-K22420960			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22+,27-/m0/s1	UXOYYOHZEHALJU-XXAUWVGASA-N	518.289305736							103777
BRD-K16602560	LSM-31016		54619023	InChI=1S/C24H37N3O3/c1-7-11-26(6)15-22-18(4)14-27(19(5)16-28)24(29)21-12-20(10-8-9-17(2)3)13-25-23(21)30-22/h12-13,17-19,22,28H,7,9,11,14-16H2,1-6H3/t18-,19+,22-/m1/s1	RJPYWVJCIKXYIX-XQBPLPMBSA-N	CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC(C)C	BroadT	BRD-K16602560	BRD-K16602560-001-01-0	Broad Institute of MIT and Harvard	BRD-K16602560			CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC(C)C	InChI=1S/C24H37N3O3/c1-7-11-26(6)15-22-18(4)14-27(19(5)16-28)24(29)21-12-20(10-8-9-17(2)3)13-25-23(21)30-22/h12-13,17-19,22,28H,7,9,11,14-16H2,1-6H3/t18-,19+,22-/m1/s1	RJPYWVJCIKXYIX-XQBPLPMBSA-N	415.283492074							119569
BRD-K91410469	LSM-31017		54619126	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16-,20-/m1/s1	MCOJFHYNZBKTQP-JXXFODFXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)C#CC3CC3	BroadT	BRD-K91410469	BRD-K91410469-001-01-8	Broad Institute of MIT and Harvard	BRD-K91410469			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16-,20-/m1/s1	MCOJFHYNZBKTQP-JXXFODFXSA-N	470.15452808							119570
MLS003130270	LSM-31018	BRD-K19691332, SID131414125, SID99359057	46903707	InChI=1S/C23H36BrN3O5S/c1-17-14-27(18(2)16-28)33(30,31)22-8-7-19(24)13-20(22)32-21(17)15-25(3)23(29)9-12-26-10-5-4-6-11-26/h7-8,13,17-18,21,28H,4-6,9-12,14-16H2,1-3H3/t17-,18-,21+/m0/s1	QFNUSQGYMOISEO-BBTUJRGHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCN2CCCCC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K19691332	BRD-K19691332-001-01-7	Broad Institute of MIT and Harvard	BRD-K19691332			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCN2CCCCC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C23H36BrN3O5S/c1-17-14-27(18(2)16-28)33(30,31)22-8-7-19(24)13-20(22)32-21(17)15-25(3)23(29)9-12-26-10-5-4-6-11-26/h7-8,13,17-18,21,28H,4-6,9-12,14-16H2,1-3H3/t17-,18-,21+/m0/s1	QFNUSQGYMOISEO-BBTUJRGHSA-N	545.155904572							119571
BRD-K20062569	LSM-31019		54619287	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28-/m1/s1	WYRLQFCCGHRJLO-DQCZWYHMSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@H](CN(C)C(=O)c4ccccn4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K20062569	BRD-K20062569-001-01-2	Broad Institute of MIT and Harvard	BRD-K20062569			COc1ccc(cc1)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28-/m1/s1	WYRLQFCCGHRJLO-DQCZWYHMSA-N	563.209006496							119572
BRD-K85413794	LSM-15060		54619048	InChI=1S/C21H26FN3O3/c1-13-11-25(14(2)12-26)21(27)17-8-15(16-6-4-5-7-18(16)22)9-24-20(17)28-19(13)10-23-3/h4-9,13-14,19,23,26H,10-12H2,1-3H3/t13-,14-,19-/m0/s1	SHRVDEFCKQVYRH-NJSLBKSFSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c3ccccc3F	BroadT	BRD-K85413794	BRD-K85413794-001-01-6	Broad Institute of MIT and Harvard	BRD-K85413794			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)-c1ccccc1F	InChI=1S/C21H26FN3O3/c1-13-11-25(14(2)12-26)21(27)17-8-15(16-6-4-5-7-18(16)22)9-24-20(17)28-19(13)10-23-3/h4-9,13-14,19,23,26H,10-12H2,1-3H3/t13-,14-,19-/m0/s1	SHRVDEFCKQVYRH-NJSLBKSFSA-N	387.195819922							103716
BRD-K99259037	LSM-15173		54619273	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20+,27+/m1/s1	CROBQSVNIOLQSN-JVAFGIKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K99259037	BRD-K99259037-001-01-4	Broad Institute of MIT and Harvard	BRD-K99259037			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20+,27+/m1/s1	CROBQSVNIOLQSN-JVAFGIKQSA-N	575.22654834							103829
BRD-K63199400	LSM-15045		54619258	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20-,25+/m1/s1	ZECMXSZSTQYLBY-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K63199400	BRD-K63199400-001-01-3	Broad Institute of MIT and Harvard	BRD-K63199400			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20-,25+/m1/s1	ZECMXSZSTQYLBY-FHAGJXEFSA-N	492.273655672							103701
BRD-K41714444	LSM-44304		54619299	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19+,25+/m1/s1	ZTEKSXAQYWYLFD-RGOJOONDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K41714444	BRD-K41714444-001-01-4	Broad Institute of MIT and Harvard	BRD-K41714444			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19+,25+/m1/s1	ZTEKSXAQYWYLFD-RGOJOONDSA-N	533.26381927							
BRD-K96192558	LSM-31021		54619288	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28+/m1/s1	WYRLQFCCGHRJLO-WENCSYSZSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@@H](CN(C)C(=O)c4ccccn4)[C@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K96192558	BRD-K96192558-001-01-9	Broad Institute of MIT and Harvard	BRD-K96192558			COc1ccc(cc1)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28+/m1/s1	WYRLQFCCGHRJLO-WENCSYSZSA-N	563.209006496							119575
BRD-K86143816	LSM-44305		54619237	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19+,23-/m0/s1	BEUJQTDXAJTLJD-PWDATIAQSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K86143816	BRD-K86143816-001-01-2	Broad Institute of MIT and Harvard	BRD-K86143816			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19+,23-/m0/s1	BEUJQTDXAJTLJD-PWDATIAQSA-N	472.203192834							
BRD-K10785504	LSM-31023		54619292	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23-,28-/m1/s1	OOYLJRYZMKTJGR-MVOZIGHISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K10785504	BRD-K10785504-001-01-8	Broad Institute of MIT and Harvard	BRD-K10785504			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23-,28-/m1/s1	OOYLJRYZMKTJGR-MVOZIGHISA-N	538.250143026							119577
BRD-K04771555	LSM-31024		54619160	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18-,22-/m1/s1	LKPBUWUQVMPFSV-JBYIUTFZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K04771555	BRD-K04771555-001-01-4	Broad Institute of MIT and Harvard	BRD-K04771555			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18-,22-/m1/s1	LKPBUWUQVMPFSV-JBYIUTFZSA-N	517.23588996							119578
BRD-K01263144	LSM-31025		54619110	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18+,22+/m0/s1	NALQGZGZTMNLHT-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccncc3	BroadT	BRD-K01263144	BRD-K01263144-001-01-3	Broad Institute of MIT and Harvard	BRD-K01263144			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18+,22+/m0/s1	NALQGZGZTMNLHT-NJNPRVFISA-N	490.224990918							119579
BRD-K67978098	LSM-44306		54619249	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19+,25+/m0/s1	ZTEKSXAQYWYLFD-XLYQQIHCSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K67978098	BRD-K67978098-001-01-3	Broad Institute of MIT and Harvard	BRD-K67978098			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19+,25+/m0/s1	ZTEKSXAQYWYLFD-XLYQQIHCSA-N	533.26381927							
BRD-K56011618	LSM-31027		54619120	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18+,24+/m1/s1	SHPIGGYHGMASQB-YTZAWJCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K56011618	BRD-K56011618-001-01-7	Broad Institute of MIT and Harvard	BRD-K56011618			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18+,24+/m1/s1	SHPIGGYHGMASQB-YTZAWJCFSA-N	496.248583776							119581
BRD-K68379391	LSM-31028		54619234	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19-,25+/m0/s1	DLWWRBINVHEARI-XHNVNVPESA-N	COc1ccccc1c2cnc3O[C@H](CN(C)C(=O)c4cccnc4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K68379391	BRD-K68379391-001-01-7	Broad Institute of MIT and Harvard	BRD-K68379391			COc1ccccc1-c1cnc2O[C@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19-,25+/m0/s1	DLWWRBINVHEARI-XHNVNVPESA-N	504.237270164							119582
BRD-K03056434	LSM-15018		54619193	InChI=1S/C20H30N2O4S/c1-14-12-22(15(2)13-23)27(24,25)20-9-8-17(16-6-4-5-7-16)10-18(20)26-19(14)11-21-3/h6,8-10,14-15,19,21,23H,4-5,7,11-13H2,1-3H3/t14-,15+,19+/m1/s1	DIFJFYXOESTABI-VCBZYWHSSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C3=CCCC3	BroadT	BRD-K03056434	BRD-K03056434-001-01-8	Broad Institute of MIT and Harvard	BRD-K03056434			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C1=CCCC1	InChI=1S/C20H30N2O4S/c1-14-12-22(15(2)13-23)27(24,25)20-9-8-17(16-6-4-5-7-16)10-18(20)26-19(14)11-21-3/h6,8-10,14-15,19,21,23H,4-5,7,11-13H2,1-3H3/t14-,15+,19+/m1/s1	DIFJFYXOESTABI-VCBZYWHSSA-N	394.19262815							103674
BRD-K38120474	LSM-31029		54619239	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19-,25-/m0/s1	KFAQLLCHSMBKLV-MHPIHPPYSA-N	COCC#Cc1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K38120474	BRD-K38120474-001-01-2	Broad Institute of MIT and Harvard	BRD-K38120474			COCC#Cc1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19-,25-/m0/s1	KFAQLLCHSMBKLV-MHPIHPPYSA-N	495.236935806							119583
BRD-K33194123	LSM-31030		54619088	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18+,23-/m0/s1	UTNRSLHBUZLCKT-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K33194123	BRD-K33194123-001-01-7	Broad Institute of MIT and Harvard	BRD-K33194123			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18+,23-/m0/s1	UTNRSLHBUZLCKT-IXFSTUDKSA-N	471.273321314							119584
BRD-K05602812	LSM-31031		54619153	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20+,26+/m0/s1	WLIQRYRMKDXINK-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4ccncc4	BroadT	BRD-K05602812	BRD-K05602812-001-01-9	Broad Institute of MIT and Harvard	BRD-K05602812			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1ccncc1	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20+,26+/m0/s1	WLIQRYRMKDXINK-OUDXUNEISA-N	516.217283648							119585
BRD-K04928505	LSM-31032		54619276	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16-,21-/m1/s1	COMCBBHOXAZBGZ-WHSLLNHNSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)c3ccc(F)cc3	BroadT	BRD-K04928505	BRD-K04928505-001-01-1	Broad Institute of MIT and Harvard	BRD-K04928505			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16-,21-/m1/s1	COMCBBHOXAZBGZ-WHSLLNHNSA-N	500.145106248							119586
BRD-K72942104	LSM-44307		54619139	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23-,27-/m1/s1	BANHLTBDTXCVOB-RIBPZVQLSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K72942104	BRD-K72942104-001-01-4	Broad Institute of MIT and Harvard	BRD-K72942104			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23-,27-/m1/s1	BANHLTBDTXCVOB-RIBPZVQLSA-N	557.255956688							
BRD-K20673170	LSM-31034		54619251	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28-/m0/s1	WYRLQFCCGHRJLO-VPYPWEPUSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@@H](CN(C)C(=O)c4ccccn4)[C@@H](C)CN([C@@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K20673170	BRD-K20673170-001-01-7	Broad Institute of MIT and Harvard	BRD-K20673170			COc1ccc(cc1)C#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3ccccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22-,28-/m0/s1	WYRLQFCCGHRJLO-VPYPWEPUSA-N	563.209006496							119588
BRD-K32939988	LSM-31035		54619263	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19-,25-/m0/s1	DLWWRBINVHEARI-MHPIHPPYSA-N	COc1ccccc1c2cnc3O[C@@H](CN(C)C(=O)c4cccnc4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K32939988	BRD-K32939988-001-01-0	Broad Institute of MIT and Harvard	BRD-K32939988			COc1ccccc1-c1cnc2O[C@@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19-,25-/m0/s1	DLWWRBINVHEARI-MHPIHPPYSA-N	504.237270164							119589
BRD-K04714488	LSM-31036		54619275	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18+,22+/m1/s1	NALQGZGZTMNLHT-FGSXEWAUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccncc3	BroadT	BRD-K04714488	BRD-K04714488-001-01-6	Broad Institute of MIT and Harvard	BRD-K04714488			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18+,22+/m1/s1	NALQGZGZTMNLHT-FGSXEWAUSA-N	490.224990918							119590
BRD-K56939159	LSM-31037		54619072	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28+/m0/s1	WYRLQFCCGHRJLO-PFPZSTESSA-N	COc1ccc(cc1)C#Cc2ccc3c(O[C@H](CN(C)C(=O)c4ccccn4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K56939159	BRD-K56939159-001-01-4	Broad Institute of MIT and Harvard	BRD-K56939159			COc1ccc(cc1)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C30H33N3O6S/c1-21-18-33(22(2)20-34)40(36,37)29-15-12-24(9-8-23-10-13-25(38-4)14-11-23)17-27(29)39-28(21)19-32(3)30(35)26-7-5-6-16-31-26/h5-7,10-17,21-22,28,34H,18-20H2,1-4H3/t21-,22+,28+/m0/s1	WYRLQFCCGHRJLO-PFPZSTESSA-N	563.209006496							119591
BRD-K94634315	LSM-44308		54619024	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21-,28-/m1/s1	LVQXARYEWHFWNX-WWORJOIISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(\C=C\c5ccccc5)cc4C1=O	BroadT	BRD-K94634315	BRD-K94634315-001-01-6	Broad Institute of MIT and Harvard	BRD-K94634315			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21-,28-/m1/s1	LVQXARYEWHFWNX-WWORJOIISA-N	543.236935806							
BRD-K51163606	LSM-31039		54619262	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14+,18-/m1/s1	GYAQMILCNYFRMN-QWQRMKEZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K51163606	BRD-K51163606-001-01-5	Broad Institute of MIT and Harvard	BRD-K51163606			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc2ncc(Br)cc2C1=O	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14+,18-/m1/s1	GYAQMILCNYFRMN-QWQRMKEZSA-N	476.10591792							119593
BRD-K99131664	LSM-31040		54619201	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18-,24-/m1/s1	YKMJVYSWBOXOTH-QZTZHPFYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K99131664	BRD-K99131664-001-01-5	Broad Institute of MIT and Harvard	BRD-K99131664			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18-,24-/m1/s1	YKMJVYSWBOXOTH-QZTZHPFYSA-N	528.184268958							119594
BRD-K77547131	LSM-31041		54619010	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16+,20-/m1/s1	MCOJFHYNZBKTQP-GQIGUUNPSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)C#CC3CC3	BroadT	BRD-K77547131	BRD-K77547131-001-01-3	Broad Institute of MIT and Harvard	BRD-K77547131			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16+,20-/m1/s1	MCOJFHYNZBKTQP-GQIGUUNPSA-N	470.15452808							119595
BRD-K58993815	LSM-31042		54619244	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16+,21-/m0/s1	COMCBBHOXAZBGZ-MRUHUIDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)c3ccc(F)cc3	BroadT	BRD-K58993815	BRD-K58993815-001-01-5	Broad Institute of MIT and Harvard	BRD-K58993815			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16+,21-/m0/s1	COMCBBHOXAZBGZ-MRUHUIDDSA-N	500.145106248							119596
BRD-K74611044	LSM-31043		54619260	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22+,27+/m1/s1	UXOYYOHZEHALJU-VHSZZVNMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K74611044	BRD-K74611044-001-01-6	Broad Institute of MIT and Harvard	BRD-K74611044			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22+,27+/m1/s1	UXOYYOHZEHALJU-VHSZZVNMSA-N	518.289305736							119597
BRD-K39664334	LSM-31044		54619147	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18+,22-/m1/s1	LKPBUWUQVMPFSV-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K39664334	BRD-K39664334-001-01-8	Broad Institute of MIT and Harvard	BRD-K39664334			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18+,22-/m1/s1	LKPBUWUQVMPFSV-KGVIQGDOSA-N	517.23588996							119598
BRD-K83721789	LSM-31045		54619186	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19-,24+/m0/s1	QSIOMQGNLKPVMQ-AXHZCLLHSA-N	CCCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K83721789	BRD-K83721789-001-01-1	Broad Institute of MIT and Harvard	BRD-K83721789			CCCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19-,24+/m0/s1	QSIOMQGNLKPVMQ-AXHZCLLHSA-N	496.248583776							119599
MLS003130135	LSM-31046	BRD-K18099024	46903534	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18+,24+/m0/s1	YKMJVYSWBOXOTH-HOOSLVGPSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K18099024	BRD-K18099024-001-02-5	Broad Institute of MIT and Harvard	BRD-K18099024			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18+,24+/m0/s1	YKMJVYSWBOXOTH-HOOSLVGPSA-N	528.184268958							119600
BRD-K64618192	LSM-43608		54619218	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19-,23-/m1/s1	PJAYKLYFYLNPHZ-WEDFSILCSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K64618192	BRD-K64618192-001-01-3	Broad Institute of MIT and Harvard	BRD-K64618192			C\C=C\c1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19-,23-/m1/s1	PJAYKLYFYLNPHZ-WEDFSILCSA-N	466.250143026							
BRD-K62841603	LSM-31047		54619145	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18+,22+/m0/s1	LKPBUWUQVMPFSV-NJNPRVFISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K62841603	BRD-K62841603-001-01-6	Broad Institute of MIT and Harvard	BRD-K62841603			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18+,22+/m0/s1	LKPBUWUQVMPFSV-NJNPRVFISA-N	517.23588996							119601
BRD-K00010082	LSM-31048		54619223	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23+,28-/m0/s1	LUSCQGWIOGZNHP-JWZKTCGFSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)C#CCC4CCCC4	BroadT	BRD-K00010082	BRD-K00010082-001-01-3	Broad Institute of MIT and Harvard	BRD-K00010082			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCC1CCCC1	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23+,28-/m0/s1	LUSCQGWIOGZNHP-JWZKTCGFSA-N	604.227693020001							119602
BRD-K22757615	LSM-31049		54619209	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18-,24+/m1/s1	YKMJVYSWBOXOTH-GGUMNFRJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K22757615	BRD-K22757615-001-01-9	Broad Institute of MIT and Harvard	BRD-K22757615			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18-,24+/m1/s1	YKMJVYSWBOXOTH-GGUMNFRJSA-N	528.184268958							119603
BRD-K35051827	LSM-31050		54619268	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19+,25-/m1/s1	DLWWRBINVHEARI-HHJKRLRDSA-N	COc1ccccc1c2cnc3O[C@H](CN(C)C(=O)c4cccnc4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K35051827	BRD-K35051827-001-01-6	Broad Institute of MIT and Harvard	BRD-K35051827			COc1ccccc1-c1cnc2O[C@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19+,25-/m1/s1	DLWWRBINVHEARI-HHJKRLRDSA-N	504.237270164							119604
BRD-K07602825	LSM-31051		54619083	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19-,25+/m1/s1	DLWWRBINVHEARI-RRQZXNHTSA-N	COc1ccccc1c2cnc3O[C@@H](CN(C)C(=O)c4cccnc4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K07602825	BRD-K07602825-001-01-2	Broad Institute of MIT and Harvard	BRD-K07602825			COc1ccccc1-c1cnc2O[C@@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19-,25+/m1/s1	DLWWRBINVHEARI-RRQZXNHTSA-N	504.237270164							119605
BRD-K73689413	LSM-31052		54619182	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20+,25+/m0/s1	ZECMXSZSTQYLBY-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K73689413	BRD-K73689413-001-01-6	Broad Institute of MIT and Harvard	BRD-K73689413			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20+,25+/m0/s1	ZECMXSZSTQYLBY-WZOHSFFVSA-N	492.273655672							119606
CHEMBL2357019	LSM-31053	BRD-K58548487, SID131414304	54619189	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22-,28+/m0/s1	YAJYINBQFXCAPI-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccc(F)c4	BroadT	BRD-K58548487	BRD-K58548487-001-01-4	Broad Institute of MIT and Harvard	BRD-K58548487			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22-,28+/m0/s1	YAJYINBQFXCAPI-RXYILKCJSA-N	571.251620236							119607
BRD-K94034047	LSM-15172		54619034	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20-,27-/m0/s1	CROBQSVNIOLQSN-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K94034047	BRD-K94034047-001-01-4	Broad Institute of MIT and Harvard	BRD-K94034047			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20-,27-/m0/s1	CROBQSVNIOLQSN-OSOCVKALSA-N	575.22654834							103828
CHEMBL2132448	LSM-31054	BRD-K94587952, SID131414342	54619227	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21+,26+/m0/s1	RQONCHIHFCKYAZ-LZCXECNNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K94587952	BRD-K94587952-001-01-4	Broad Institute of MIT and Harvard	BRD-K94587952			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21+,26+/m0/s1	RQONCHIHFCKYAZ-LZCXECNNSA-N	541.22465656							119608
BRD-K09144687	LSM-44309		54619094	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19-,23-/m1/s1	BEUJQTDXAJTLJD-QLTIVBBBSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K09144687	BRD-K09144687-001-01-0	Broad Institute of MIT and Harvard	BRD-K09144687			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19-,23-/m1/s1	BEUJQTDXAJTLJD-QLTIVBBBSA-N	472.203192834							
BRD-K05660087	LSM-31056		54619211	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18-,24-/m0/s1	YKMJVYSWBOXOTH-XFAGBWLFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K05660087	BRD-K05660087-001-01-5	Broad Institute of MIT and Harvard	BRD-K05660087			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18-,24-/m0/s1	YKMJVYSWBOXOTH-XFAGBWLFSA-N	528.184268958							119610
MLS003130276	LSM-44310	SID99359062, BRD-K31210612	46903712	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19+,23+/m0/s1	PJAYKLYFYLNPHZ-FBCKQLBLSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K31210612	BRD-K31210612-001-02-9	Broad Institute of MIT and Harvard	BRD-K31210612			C\C=C\c1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19+,23+/m0/s1	PJAYKLYFYLNPHZ-FBCKQLBLSA-N	466.250143026							
BRD-K19768903	LSM-31058		54619195	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21-,25-/m0/s1	XZDMLRGMHLQVSQ-WATLYSKOSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K19768903	BRD-K19768903-001-01-2	Broad Institute of MIT and Harvard	BRD-K19768903			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21-,25-/m0/s1	XZDMLRGMHLQVSQ-WATLYSKOSA-N	520.268570292							119612
BRD-K17315445	LSM-44311		54619236	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21+,28-/m0/s1	LVQXARYEWHFWNX-OSLPKHIKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(\C=C\c5ccccc5)cc4C1=O	BroadT	BRD-K17315445	BRD-K17315445-001-01-9	Broad Institute of MIT and Harvard	BRD-K17315445			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21+,28-/m0/s1	LVQXARYEWHFWNX-OSLPKHIKSA-N	543.236935806							
BRD-K66856134	LSM-31060		54619243	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16+,20+/m1/s1	MCOJFHYNZBKTQP-GUXCAODWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)C#CC3CC3	BroadT	BRD-K66856134	BRD-K66856134-001-01-8	Broad Institute of MIT and Harvard	BRD-K66856134			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16+,20+/m1/s1	MCOJFHYNZBKTQP-GUXCAODWSA-N	470.15452808							119614
BRD-K02654447	LSM-43606		54619028	InChI=1S/C18H28N2O4S/c1-5-6-15-7-8-18-16(9-15)24-17(10-19-4)13(2)11-20(14(3)12-21)25(18,22)23/h5-9,13-14,17,19,21H,10-12H2,1-4H3/b6-5+/t13-,14+,17+/m0/s1	NUVSEORICCJOQH-HNMAODMESA-N	CNC[C@H]1Oc2cc(\C=C\C)ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K02654447	BRD-K02654447-001-01-6	Broad Institute of MIT and Harvard	BRD-K02654447			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)\C=C\C	InChI=1S/C18H28N2O4S/c1-5-6-15-7-8-18-16(9-15)24-17(10-19-4)13(2)11-20(14(3)12-21)25(18,22)23/h5-9,13-14,17,19,21H,10-12H2,1-4H3/b6-5+/t13-,14+,17+/m0/s1	NUVSEORICCJOQH-HNMAODMESA-N	368.176978086							
BRD-K74116035	LSM-31061		54619280	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18-,22+/m0/s1	NALQGZGZTMNLHT-NPPFBWRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccncc3	BroadT	BRD-K74116035	BRD-K74116035-001-01-7	Broad Institute of MIT and Harvard	BRD-K74116035			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18-,22+/m0/s1	NALQGZGZTMNLHT-NPPFBWRTSA-N	490.224990918							119615
BRD-K87261428	LSM-31062		54619107	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22-,28-/m0/s1	YAJYINBQFXCAPI-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccc(F)c4	BroadT	BRD-K87261428	BRD-K87261428-001-01-1	Broad Institute of MIT and Harvard	BRD-K87261428			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22-,28-/m0/s1	YAJYINBQFXCAPI-VPYPWEPUSA-N	571.251620236							119616
MLS003130053	LSM-31063	BRD-K53121121, SID131414112, SID99358637	46903416	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23-,28-/m1/s1	LUSCQGWIOGZNHP-MVOZIGHISA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C#CCC4CCCC4	BroadT	BRD-K53121121	BRD-K53121121-001-02-5	Broad Institute of MIT and Harvard	BRD-K53121121			COc1ccccc1S(=O)(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CCC1CCCC1	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23-,28-/m1/s1	LUSCQGWIOGZNHP-MVOZIGHISA-N	604.227693020001							119617
BRD-K29840501	LSM-31064		54619190	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19+,25-/m0/s1	KFAQLLCHSMBKLV-CEYNDMKZSA-N	COCC#Cc1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K29840501	BRD-K29840501-001-01-3	Broad Institute of MIT and Harvard	BRD-K29840501			COCC#Cc1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19+,25-/m0/s1	KFAQLLCHSMBKLV-CEYNDMKZSA-N	495.236935806							119618
BRD-K38630470	LSM-31065		54619111	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21-,26-/m0/s1	RQONCHIHFCKYAZ-WOVHNISZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K38630470	BRD-K38630470-001-01-4	Broad Institute of MIT and Harvard	BRD-K38630470			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21-,26-/m0/s1	RQONCHIHFCKYAZ-WOVHNISZSA-N	541.22465656							119619
BRD-K80066561	LSM-31066		54619304	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23+,28+/m1/s1	OOYLJRYZMKTJGR-IWHLBADBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K80066561	BRD-K80066561-001-01-8	Broad Institute of MIT and Harvard	BRD-K80066561			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23+,28+/m1/s1	OOYLJRYZMKTJGR-IWHLBADBSA-N	538.250143026							119620
MLS003130370	LSM-31067	SID99359369, BRD-K46093892	46903933	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19-,24-/m1/s1	QSIOMQGNLKPVMQ-KHCICDEESA-N	CCCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K46093892	BRD-K46093892-001-02-3	Broad Institute of MIT and Harvard	BRD-K46093892			CCCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19-,24-/m1/s1	QSIOMQGNLKPVMQ-KHCICDEESA-N	496.248583776							119621
BRD-K09788251	LSM-44312		54619159	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21+,28+/m1/s1	LVQXARYEWHFWNX-AIUKAKNXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(\C=C\c5ccccc5)cc4C1=O	BroadT	BRD-K09788251	BRD-K09788251-001-01-0	Broad Institute of MIT and Harvard	BRD-K09788251			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21+,28+/m1/s1	LVQXARYEWHFWNX-AIUKAKNXSA-N	543.236935806							
BRD-K23002629	LSM-31069		54619021	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19+,24+/m1/s1	AOAVRGNJVMAOBU-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K23002629	BRD-K23002629-001-01-3	Broad Institute of MIT and Harvard	BRD-K23002629			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19+,24+/m1/s1	AOAVRGNJVMAOBU-IMWIBFENSA-N	516.240640982							119623
CHEMBL2357518	LSM-15104	BRD-K05278519, SID131414261	54619148	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28-/m1/s1	PEEJAUXHJGOSQX-UMQWNRPGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K05278519	BRD-K05278519-001-01-4	Broad Institute of MIT and Harvard	BRD-K05278519			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28-/m1/s1	PEEJAUXHJGOSQX-UMQWNRPGSA-N	537.209755424							103760
BRD-K58408512	LSM-31070		54619301	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20+,26+/m1/s1	WLIQRYRMKDXINK-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4ccncc4	BroadT	BRD-K58408512	BRD-K58408512-001-01-0	Broad Institute of MIT and Harvard	BRD-K58408512			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1ccncc1	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20+,26+/m1/s1	WLIQRYRMKDXINK-GOHWNWGWSA-N	516.217283648							119624
BRD-K54374611	LSM-31071		54619210	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19-,24-/m1/s1	AOAVRGNJVMAOBU-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K54374611	BRD-K54374611-001-01-8	Broad Institute of MIT and Harvard	BRD-K54374611			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19-,24-/m1/s1	AOAVRGNJVMAOBU-KHCICDEESA-N	516.240640982							119625
BRD-K99111770	LSM-44313		54619156	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19+,23-/m0/s1	OYGLGTZFOSPOAJ-TUHWVAOVSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K99111770	BRD-K99111770-001-01-8	Broad Institute of MIT and Harvard	BRD-K99111770			C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19+,23-/m0/s1	OYGLGTZFOSPOAJ-TUHWVAOVSA-N	459.219177256							
BRD-K36325276	LSM-44314		54619230	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21-,28-/m0/s1	LVQXARYEWHFWNX-PYOORFNRSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(\C=C\c5ccccc5)cc4C1=O	BroadT	BRD-K36325276	BRD-K36325276-001-01-9	Broad Institute of MIT and Harvard	BRD-K36325276			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21-,28-/m0/s1	LVQXARYEWHFWNX-PYOORFNRSA-N	543.236935806							
BRD-K88802328	LSM-31074		54619293	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20-,26-/m1/s1	WLIQRYRMKDXINK-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4ccncc4	BroadT	BRD-K88802328	BRD-K88802328-001-01-2	Broad Institute of MIT and Harvard	BRD-K88802328			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1ccncc1	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20-,26-/m1/s1	WLIQRYRMKDXINK-XMERXJNXSA-N	516.217283648							119628
BRD-K53343197	LSM-44315		54619199	InChI=1S/C18H28N2O4S/c1-5-6-15-7-8-18-16(9-15)24-17(10-19-4)13(2)11-20(14(3)12-21)25(18,22)23/h5-9,13-14,17,19,21H,10-12H2,1-4H3/b6-5+/t13-,14+,17+/m1/s1	NUVSEORICCJOQH-GUBLCFBFSA-N	CNC[C@@H]1Oc2cc(\C=C\C)ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K53343197	BRD-K53343197-001-01-6	Broad Institute of MIT and Harvard	BRD-K53343197			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)\C=C\C	InChI=1S/C18H28N2O4S/c1-5-6-15-7-8-18-16(9-15)24-17(10-19-4)13(2)11-20(14(3)12-21)25(18,22)23/h5-9,13-14,17,19,21H,10-12H2,1-4H3/b6-5+/t13-,14+,17+/m1/s1	NUVSEORICCJOQH-GUBLCFBFSA-N	368.176978086							
BRD-K95435237	LSM-15068		54619066	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20+,25+/m1/s1	ZECMXSZSTQYLBY-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K95435237	BRD-K95435237-001-01-2	Broad Institute of MIT and Harvard	BRD-K95435237			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20+,25+/m1/s1	ZECMXSZSTQYLBY-RNHFSVANSA-N	492.273655672							103724
BRD-K93233756	LSM-31076		54619085	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20+,26-/m1/s1	PFCOQLZGWKMRNP-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K93233756	BRD-K93233756-001-01-4	Broad Institute of MIT and Harvard	BRD-K93233756			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20+,26-/m1/s1	PFCOQLZGWKMRNP-BVFVYWQFSA-N	507.273321314							119630
BRD-K03789334	LSM-31077		54619045	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18-,22-/m0/s1	LKPBUWUQVMPFSV-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K03789334	BRD-K03789334-001-01-5	Broad Institute of MIT and Harvard	BRD-K03789334			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18-,22-/m0/s1	LKPBUWUQVMPFSV-SPEDKVCISA-N	517.23588996							119631
BRD-A22502289	LSM-31078		44505314	InChI=1S/C28H36FN3O4/c1-5-6-24(34)12-9-22-13-25-27(30-14-22)36-26(19(2)15-32(28(25)35)20(3)18-33)17-31(4)16-21-7-10-23(29)11-8-21/h7-8,10-11,13-14,19-20,24,26,33-34H,5-6,15-18H2,1-4H3/t19-,20+,24?,26-/m0/s1	YUXSENMZTSZBGU-QUWXJRFASA-N	CCCC(O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-A22502289	BRD-A22502289-001-01-6	Broad Institute of MIT and Harvard	BRD-A22502289			CCCC(O)C#Cc1cnc2O[C@@H](CN(C)Cc3ccc(F)cc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H36FN3O4/c1-5-6-24(34)12-9-22-13-25-27(30-14-22)36-26(19(2)15-32(28(25)35)20(3)18-33)17-31(4)16-21-7-10-23(29)11-8-21/h7-8,10-11,13-14,19-20,24,26,33-34H,5-6,15-18H2,1-4H3/t19-,20+,24?,26-/m0/s1	YUXSENMZTSZBGU-QUWXJRFASA-N	497.268984862							119632
BRD-K76654183	LSM-31079		54619124	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18-,24+/m0/s1	SHPIGGYHGMASQB-LLJLJFOGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K76654183	BRD-K76654183-001-01-5	Broad Institute of MIT and Harvard	BRD-K76654183			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18-,24+/m0/s1	SHPIGGYHGMASQB-LLJLJFOGSA-N	496.248583776							119633
BRD-K20646717	LSM-31080		54619061	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23-,28-/m0/s1	OOYLJRYZMKTJGR-LXWOLXCRSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K20646717	BRD-K20646717-001-01-3	Broad Institute of MIT and Harvard	BRD-K20646717			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C30H38N2O5S/c1-22-19-32(23(2)21-33)38(35,36)29-16-15-26(14-13-24-9-7-8-10-24)17-27(29)37-28(22)20-31(3)30(34)18-25-11-5-4-6-12-25/h4-6,11-12,15-17,22-24,28,33H,7-10,18-21H2,1-3H3/t22-,23-,28-/m0/s1	OOYLJRYZMKTJGR-LXWOLXCRSA-N	538.250143026							119634
MLS003130208	LSM-31081	BRD-K63069046, SID99359003	46903696	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21-,25-/m1/s1	FGDWBZCHFJENJN-DNRQZRRGSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CCc3ccccc3	BroadT	BRD-K63069046	BRD-K63069046-001-02-6	Broad Institute of MIT and Harvard	BRD-K63069046			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)C#CCc1ccccc1	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21-,25-/m1/s1	FGDWBZCHFJENJN-DNRQZRRGSA-N	492.273655672							119635
BRD-K71465204	LSM-31082		54619196	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21-,27+/m1/s1	RUWJTSGBQQPZMY-GNMOFYLKSA-N	COc1cccc(c1)c2ccc3c(O[C@@H](CN(C)Cc4ccncc4)[C@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K71465204	BRD-K71465204-001-01-6	Broad Institute of MIT and Harvard	BRD-K71465204			COc1cccc(c1)-c1ccc2c(O[C@@H](CN(C)Cc3ccncc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21-,27+/m1/s1	RUWJTSGBQQPZMY-GNMOFYLKSA-N	525.22974194							119636
BRD-K53978514	LSM-31083		54619300	InChI=1S/C24H33N3O5S/c1-16-14-27(17(2)15-28)33(30,31)23-10-9-19(12-21(23)32-22(16)13-25-3)18-7-6-8-20(11-18)24(29)26(4)5/h6-12,16-17,22,25,28H,13-15H2,1-5H3/t16-,17+,22+/m0/s1	BXSLUDILSQPBHO-GSHUGGBRSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)c3cccc(c3)C(=O)N(C)C	BroadT	BRD-K53978514	BRD-K53978514-001-01-5	Broad Institute of MIT and Harvard	BRD-K53978514			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C24H33N3O5S/c1-16-14-27(17(2)15-28)33(30,31)23-10-9-19(12-21(23)32-22(16)13-25-3)18-7-6-8-20(11-18)24(29)26(4)5/h6-12,16-17,22,25,28H,13-15H2,1-5H3/t16-,17+,22+/m0/s1	BXSLUDILSQPBHO-GSHUGGBRSA-N	475.214091876							119637
BRD-K78162975	LSM-31084		54619165	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21+,26-/m0/s1	UWPUNYQEQGJQBN-UZINWLIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K78162975	BRD-K78162975-001-01-9	Broad Institute of MIT and Harvard	BRD-K78162975			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21+,26-/m0/s1	UWPUNYQEQGJQBN-UZINWLIJSA-N	523.214091876							119638
BRD-K73080020	LSM-15159		54619020	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23+,28+/m0/s1	LUSCQGWIOGZNHP-SXDGJLEOSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)C#CCC4CCCC4	BroadT	BRD-K73080020	BRD-K73080020-001-01-3	Broad Institute of MIT and Harvard	BRD-K73080020			COc1ccccc1S(=O)(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCC1CCCC1	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23+,28+/m0/s1	LUSCQGWIOGZNHP-SXDGJLEOSA-N	604.227693020001							103815
BRD-K29148593	LSM-44316		54619117	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19+,23-/m1/s1	OYGLGTZFOSPOAJ-BXWBNFEDSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K29148593	BRD-K29148593-001-01-0	Broad Institute of MIT and Harvard	BRD-K29148593			C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19+,23-/m1/s1	OYGLGTZFOSPOAJ-BXWBNFEDSA-N	459.219177256							
BRD-K43628610	LSM-31086		54619031	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14-,18+/m0/s1	GYAQMILCNYFRMN-SUNYJGFJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K43628610	BRD-K43628610-001-01-2	Broad Institute of MIT and Harvard	BRD-K43628610			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc2ncc(Br)cc2C1=O	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14-,18+/m0/s1	GYAQMILCNYFRMN-SUNYJGFJSA-N	476.10591792							119640
BRD-K17923226	LSM-31087		54619100	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23-,28+/m1/s1	LUSCQGWIOGZNHP-MRJKTFCFSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C#CCC4CCCC4	BroadT	BRD-K17923226	BRD-K17923226-001-01-5	Broad Institute of MIT and Harvard	BRD-K17923226			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C#CCC1CCCC1	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23-,28+/m1/s1	LUSCQGWIOGZNHP-MRJKTFCFSA-N	604.227693020001							119641
BRD-K89459607	LSM-31088		54619216	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21-,28-/m0/s1	ZMKYSZODYJXXSG-CZBREUMFSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)c4ccccc4OC)c1	BroadT	BRD-K89459607	BRD-K89459607-001-01-2	Broad Institute of MIT and Harvard	BRD-K89459607			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)-c2ccccc2OC)c1	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21-,28-/m0/s1	ZMKYSZODYJXXSG-CZBREUMFSA-N	583.235221244							119642
BRD-K03143744	LSM-31089		54619004	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18-,24-/m1/s1	SHPIGGYHGMASQB-QZTZHPFYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K03143744	BRD-K03143744-001-01-9	Broad Institute of MIT and Harvard	BRD-K03143744			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18-,24-/m1/s1	SHPIGGYHGMASQB-QZTZHPFYSA-N	496.248583776							119643
BRD-K10639460	LSM-44317		54619078	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21+,28-/m1/s1	LVQXARYEWHFWNX-GMDIBXSSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(\C=C\c5ccccc5)cc4C1=O	BroadT	BRD-K10639460	BRD-K10639460-001-01-9	Broad Institute of MIT and Harvard	BRD-K10639460			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21+,28-/m1/s1	LVQXARYEWHFWNX-GMDIBXSSSA-N	543.236935806							
BRD-K52435112	LSM-15148		54619019	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28-/m0/s1	PEEJAUXHJGOSQX-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K52435112	BRD-K52435112-001-01-3	Broad Institute of MIT and Harvard	BRD-K52435112			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28-/m0/s1	PEEJAUXHJGOSQX-CZBREUMFSA-N	537.209755424							103804
BRD-K37953574	LSM-31091		54619225	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21+,25+/m0/s1	FGDWBZCHFJENJN-BPYKYCOYSA-N	CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCc3ccccc3	BroadT	BRD-K37953574	BRD-K37953574-001-01-6	Broad Institute of MIT and Harvard	BRD-K37953574			CCCNC(=O)N(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCc1ccccc1	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21+,25+/m0/s1	FGDWBZCHFJENJN-BPYKYCOYSA-N	492.273655672							119645
BRD-K47887272	LSM-44318		54619162	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19+,23+/m0/s1	OYGLGTZFOSPOAJ-SUTZMCCXSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K47887272	BRD-K47887272-001-01-9	Broad Institute of MIT and Harvard	BRD-K47887272			C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19+,23+/m0/s1	OYGLGTZFOSPOAJ-SUTZMCCXSA-N	459.219177256							
BRD-K16888026	LSM-31093		54619303	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19+,24-/m1/s1	QSIOMQGNLKPVMQ-YDIMBITNSA-N	CCCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K16888026	BRD-K16888026-001-01-3	Broad Institute of MIT and Harvard	BRD-K16888026			CCCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19+,24-/m1/s1	QSIOMQGNLKPVMQ-YDIMBITNSA-N	496.248583776							119647
BRD-K97886487	LSM-31094		54619121	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20-,25+/m0/s1	ZECMXSZSTQYLBY-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K97886487	BRD-K97886487-001-01-1	Broad Institute of MIT and Harvard	BRD-K97886487			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20-,25+/m0/s1	ZECMXSZSTQYLBY-ZYLNGJIFSA-N	492.273655672							119648
BRD-K13928638	LSM-31095		54619076	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19+,22+/m1/s1	ZBLNAKCVTQSUGS-DXIQSLLYSA-N	COCC#Cc1cnc2O[C@@H](CN(C)C(=O)CN3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K13928638	BRD-K13928638-001-01-0	Broad Institute of MIT and Harvard	BRD-K13928638			COCC#Cc1cnc2O[C@@H](CN(C)C(=O)CN3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19+,22+/m1/s1	ZBLNAKCVTQSUGS-DXIQSLLYSA-N	488.263484912							119649
BRD-K09295309	LSM-31096		54619009	InChI=1S/C24H37N3O3/c1-7-11-26(6)15-22-18(4)14-27(19(5)16-28)24(29)21-12-20(10-8-9-17(2)3)13-25-23(21)30-22/h12-13,17-19,22,28H,7,9,11,14-16H2,1-6H3/t18-,19+,22+/m1/s1	RJPYWVJCIKXYIX-DXIQSLLYSA-N	CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC(C)C	BroadT	BRD-K09295309	BRD-K09295309-001-01-8	Broad Institute of MIT and Harvard	BRD-K09295309			CCCN(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC(C)C	InChI=1S/C24H37N3O3/c1-7-11-26(6)15-22-18(4)14-27(19(5)16-28)24(29)21-12-20(10-8-9-17(2)3)13-25-23(21)30-22/h12-13,17-19,22,28H,7,9,11,14-16H2,1-6H3/t18-,19+,22+/m1/s1	RJPYWVJCIKXYIX-DXIQSLLYSA-N	415.283492074							119650
BRD-K71264152	LSM-31097		54619136	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19+,25+/m0/s1	DLWWRBINVHEARI-OSWQYVSFSA-N	COc1ccccc1c2cnc3O[C@H](CN(C)C(=O)c4cccnc4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K71264152	BRD-K71264152-001-01-5	Broad Institute of MIT and Harvard	BRD-K71264152			COc1ccccc1-c1cnc2O[C@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19+,25+/m0/s1	DLWWRBINVHEARI-OSWQYVSFSA-N	504.237270164							119651
BRD-K21898755	LSM-31098		54619175	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21-,26-/m0/s1	UWPUNYQEQGJQBN-WOVHNISZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K21898755	BRD-K21898755-001-01-2	Broad Institute of MIT and Harvard	BRD-K21898755			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21-,26-/m0/s1	UWPUNYQEQGJQBN-WOVHNISZSA-N	523.214091876							119652
BRD-K58434742	LSM-31099		54619039	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14-,18+/m1/s1	GYAQMILCNYFRMN-LBTNJELSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K58434742	BRD-K58434742-001-01-8	Broad Institute of MIT and Harvard	BRD-K58434742			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc2ncc(Br)cc2C1=O	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14-,18+/m1/s1	GYAQMILCNYFRMN-LBTNJELSSA-N	476.10591792							119653
BRD-K55218950	LSM-15039		54619016	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20+,25-/m1/s1	ZECMXSZSTQYLBY-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K55218950	BRD-K55218950-001-01-5	Broad Institute of MIT and Harvard	BRD-K55218950			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20+,25-/m1/s1	ZECMXSZSTQYLBY-OHUGHZGNSA-N	492.273655672							103695
BRD-K71448503	LSM-15156		54619269	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20-,27-/m1/s1	CROBQSVNIOLQSN-SEXOINJZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K71448503	BRD-K71448503-001-01-0	Broad Institute of MIT and Harvard	BRD-K71448503			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20-,27-/m1/s1	CROBQSVNIOLQSN-SEXOINJZSA-N	575.22654834							103812
BRD-K26257310	LSM-31100		54619049	InChI=1S/C24H33N3O5S/c1-16-14-27(17(2)15-28)33(30,31)23-10-9-19(12-21(23)32-22(16)13-25-3)18-7-6-8-20(11-18)24(29)26(4)5/h6-12,16-17,22,25,28H,13-15H2,1-5H3/t16-,17+,22+/m1/s1	BXSLUDILSQPBHO-JLHGSKIFSA-N	CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)c3cccc(c3)C(=O)N(C)C	BroadT	BRD-K26257310	BRD-K26257310-001-01-4	Broad Institute of MIT and Harvard	BRD-K26257310			CNC[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)-c1cccc(c1)C(=O)N(C)C	InChI=1S/C24H33N3O5S/c1-16-14-27(17(2)15-28)33(30,31)23-10-9-19(12-21(23)32-22(16)13-25-3)18-7-6-8-20(11-18)24(29)26(4)5/h6-12,16-17,22,25,28H,13-15H2,1-5H3/t16-,17+,22+/m1/s1	BXSLUDILSQPBHO-JLHGSKIFSA-N	475.214091876							119654
BRD-K62909525	LSM-31101		54619142	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22+,28+/m0/s1	YAJYINBQFXCAPI-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccc(F)c4	BroadT	BRD-K62909525	BRD-K62909525-001-01-6	Broad Institute of MIT and Harvard	BRD-K62909525			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22+,28+/m0/s1	YAJYINBQFXCAPI-PFPZSTESSA-N	571.251620236							119655
BRD-K56658444	LSM-31102		54619128	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16-,21+/m1/s1	COMCBBHOXAZBGZ-ZOCZFRKYSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)c3ccc(F)cc3	BroadT	BRD-K56658444	BRD-K56658444-001-01-5	Broad Institute of MIT and Harvard	BRD-K56658444			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16-,21+/m1/s1	COMCBBHOXAZBGZ-ZOCZFRKYSA-N	500.145106248							119656
BRD-K03546460	LSM-44319		54619090	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19-,25+/m1/s1	ZTEKSXAQYWYLFD-RRHQFTLISA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K03546460	BRD-K03546460-001-01-5	Broad Institute of MIT and Harvard	BRD-K03546460			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19-,25+/m1/s1	ZTEKSXAQYWYLFD-RRHQFTLISA-N	533.26381927							
BRD-K82571240	LSM-44320		54619087	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19-,23-/m1/s1	OYGLGTZFOSPOAJ-LJKZUOHJSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K82571240	BRD-K82571240-001-01-4	Broad Institute of MIT and Harvard	BRD-K82571240			C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19-,23-/m1/s1	OYGLGTZFOSPOAJ-LJKZUOHJSA-N	459.219177256							
BRD-K29371434	LSM-44321		54619158	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21+,28+/m0/s1	LVQXARYEWHFWNX-CXSXHMDNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(\C=C\c5ccccc5)cc4C1=O	BroadT	BRD-K29371434	BRD-K29371434-001-01-1	Broad Institute of MIT and Harvard	BRD-K29371434			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21+,28+/m0/s1	LVQXARYEWHFWNX-CXSXHMDNSA-N	543.236935806							
BRD-K16717061	LSM-15114		54619060	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19+,24+/m1/s1	QSIOMQGNLKPVMQ-IMWIBFENSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K16717061	BRD-K16717061-001-01-0	Broad Institute of MIT and Harvard	BRD-K16717061			CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19+,24+/m1/s1	QSIOMQGNLKPVMQ-IMWIBFENSA-N	496.248583776							103770
BRD-K52383401	LSM-31106		54619241	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19-,22-/m0/s1	ZBLNAKCVTQSUGS-IPJJNNNSSA-N	COCC#Cc1cnc2O[C@@H](CN(C)C(=O)CN3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K52383401	BRD-K52383401-001-01-5	Broad Institute of MIT and Harvard	BRD-K52383401			COCC#Cc1cnc2O[C@@H](CN(C)C(=O)CN3CCOCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19-,22-/m0/s1	ZBLNAKCVTQSUGS-IPJJNNNSSA-N	488.263484912							119660
BRD-K94802329	LSM-44322		54619152	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19+,23+/m1/s1	OYGLGTZFOSPOAJ-JLUDUOQYSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K94802329	BRD-K94802329-001-01-3	Broad Institute of MIT and Harvard	BRD-K94802329			C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19+,23+/m1/s1	OYGLGTZFOSPOAJ-JLUDUOQYSA-N	459.219177256							
BRD-K71778797	LSM-31108		54619057	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18-,22+/m0/s1	LKPBUWUQVMPFSV-NPPFBWRTSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K71778797	BRD-K71778797-001-01-5	Broad Institute of MIT and Harvard	BRD-K71778797			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18-,22+/m0/s1	LKPBUWUQVMPFSV-NPPFBWRTSA-N	517.23588996							119662
BRD-K86434577-001-01-4	LSM-31109	BRD-K86434577	54618999	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21-,26-/m1/s1	RQONCHIHFCKYAZ-IPVFLDMMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K86434577	BRD-K86434577-001-01-4	Broad Institute of MIT and Harvard	BRD-K86434577			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21-,26-/m1/s1	RQONCHIHFCKYAZ-IPVFLDMMSA-N	541.22465656							119663
BRD-K10588890	LSM-31110		54619166	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19+,25+/m1/s1	KFAQLLCHSMBKLV-WYEJZRMESA-N	COCC#Cc1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K10588890	BRD-K10588890-001-01-8	Broad Institute of MIT and Harvard	BRD-K10588890			COCC#Cc1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19+,25+/m1/s1	KFAQLLCHSMBKLV-WYEJZRMESA-N	495.236935806							119664
BRD-K74040368	LSM-31111		54619053	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18+,22-/m1/s1	NALQGZGZTMNLHT-KGVIQGDOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccncc3	BroadT	BRD-K74040368	BRD-K74040368-001-01-6	Broad Institute of MIT and Harvard	BRD-K74040368			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18+,22-/m1/s1	NALQGZGZTMNLHT-KGVIQGDOSA-N	490.224990918							119665
BRD-K74862734	LSM-31112		54619254	InChI=1S/C23H33N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h11-12,16-18,21,24,27H,4-8,13-15H2,1-3H3/t16-,17+,21-/m1/s1	PFFBWYBXOPTHIK-LLGFUMIMSA-N	CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC3CCCCC3	BroadT	BRD-K74862734	BRD-K74862734-001-01-0	Broad Institute of MIT and Harvard	BRD-K74862734			CNC[C@H]1Oc2ncc(cc2C(=O)N(C[C@H]1C)[C@@H](C)CO)C#CC1CCCCC1	InChI=1S/C23H33N3O3/c1-16-14-26(17(2)15-27)23(28)20-11-19(10-9-18-7-5-4-6-8-18)12-25-22(20)29-21(16)13-24-3/h11-12,16-18,21,24,27H,4-8,13-15H2,1-3H3/t16-,17+,21-/m1/s1	PFFBWYBXOPTHIK-LLGFUMIMSA-N	399.252191946							119666
BRD-K82948689	LSM-44323		54619169	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19-,23-/m0/s1	PJAYKLYFYLNPHZ-LZIWGNDISA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K82948689	BRD-K82948689-001-01-2	Broad Institute of MIT and Harvard	BRD-K82948689			C\C=C\c1ccc2c(O[C@@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19-,23-/m0/s1	PJAYKLYFYLNPHZ-LZIWGNDISA-N	466.250143026							
BRD-K98431950	LSM-31114		54619006	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19+,24+/m0/s1	AOAVRGNJVMAOBU-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K98431950	BRD-K98431950-001-01-3	Broad Institute of MIT and Harvard	BRD-K98431950			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19+,24+/m0/s1	AOAVRGNJVMAOBU-XLNZFTOWSA-N	516.240640982							119668
BRD-K55478267	LSM-31115		54619014	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16-,21+/m0/s1	COMCBBHOXAZBGZ-CKJXQJPGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)c3ccc(F)cc3	BroadT	BRD-K55478267	BRD-K55478267-001-01-3	Broad Institute of MIT and Harvard	BRD-K55478267			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16-,21+/m0/s1	COMCBBHOXAZBGZ-CKJXQJPGSA-N	500.145106248							119669
BRD-K33655272	LSM-31116		54619075	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19-,24+/m1/s1	QSIOMQGNLKPVMQ-IECBHUPTSA-N	CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K33655272	BRD-K33655272-001-01-6	Broad Institute of MIT and Harvard	BRD-K33655272			CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19-,24+/m1/s1	QSIOMQGNLKPVMQ-IECBHUPTSA-N	496.248583776							119670
BRD-K65587364	LSM-44324		54619183	InChI=1S/C26H40N4O4/c1-5-9-21-14-22-25(27-15-21)34-23(19(2)16-30(26(22)33)20(3)18-31)17-28(4)24(32)10-13-29-11-7-6-8-12-29/h5,9,14-15,19-20,23,31H,6-8,10-13,16-18H2,1-4H3/b9-5+/t19-,20-,23+/m0/s1	AUGWLIQQHVFMMW-CTTSRMDDSA-N	C\C=C\c1cnc2O[C@H](CN(C)C(=O)CCN3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K65587364	BRD-K65587364-001-01-1	Broad Institute of MIT and Harvard	BRD-K65587364			C\C=C\c1cnc2O[C@H](CN(C)C(=O)CCN3CCCCC3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C26H40N4O4/c1-5-9-21-14-22-25(27-15-21)34-23(19(2)16-30(26(22)33)20(3)18-31)17-28(4)24(32)10-13-29-11-7-6-8-12-29/h5,9,14-15,19-20,23,31H,6-8,10-13,16-18H2,1-4H3/b9-5+/t19-,20-,23+/m0/s1	AUGWLIQQHVFMMW-CTTSRMDDSA-N	472.3049558							
BRD-K61711624	LSM-31118		54619011	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21-,26+/m1/s1	UWPUNYQEQGJQBN-YPCDYVTLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K61711624	BRD-K61711624-001-01-7	Broad Institute of MIT and Harvard	BRD-K61711624			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21-,26+/m1/s1	UWPUNYQEQGJQBN-YPCDYVTLSA-N	523.214091876							119672
BRD-K78701404	LSM-31119		54619245	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21-,28+/m1/s1	ZMKYSZODYJXXSG-CJYOKPGZSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)c4ccccc4OC)c1	BroadT	BRD-K78701404	BRD-K78701404-001-01-5	Broad Institute of MIT and Harvard	BRD-K78701404			COc1cccc(NC(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)-c2ccccc2OC)c1	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21-,28+/m1/s1	ZMKYSZODYJXXSG-CJYOKPGZSA-N	583.235221244							131296
BRD-K59544784	LSM-31120		54619185	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21+,28+/m0/s1	CBIJUIOTIYQLMH-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K59544784	BRD-K59544784-001-01-2	Broad Institute of MIT and Harvard	BRD-K59544784			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21+,28+/m0/s1	CBIJUIOTIYQLMH-BALWLHIASA-N	612.241783834							119675
BRD-K96687717	LSM-31121		54619213	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20-,26+/m1/s1	PFCOQLZGWKMRNP-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K96687717	BRD-K96687717-001-01-6	Broad Institute of MIT and Harvard	BRD-K96687717			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20-,26+/m1/s1	PFCOQLZGWKMRNP-KYTVRQNUSA-N	507.273321314							119676
BRD-K50891280	LSM-31122		54619207	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21+,25-/m0/s1	FGDWBZCHFJENJN-BKSPAHHJSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCc3ccccc3	BroadT	BRD-K50891280	BRD-K50891280-001-01-5	Broad Institute of MIT and Harvard	BRD-K50891280			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCc1ccccc1	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21+,25-/m0/s1	FGDWBZCHFJENJN-BKSPAHHJSA-N	492.273655672							119677
CHEMBL2356261	LSM-31123	SID131414347, BRD-K10749593	54619232	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23-,28+/m0/s1	LUSCQGWIOGZNHP-UXWDXCIHSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CCC4CCCC4	BroadT	BRD-K10749593	BRD-K10749593-001-01-6	Broad Institute of MIT and Harvard	BRD-K10749593			COc1ccccc1S(=O)(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCC1CCCC1	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23-,28+/m0/s1	LUSCQGWIOGZNHP-UXWDXCIHSA-N	604.227693020001							119678
BRD-K15029434	LSM-31124		54619134	InChI=1S/C21H26FN3O3/c1-13-11-25(14(2)12-26)21(27)17-8-15(16-6-4-5-7-18(16)22)9-24-20(17)28-19(13)10-23-3/h4-9,13-14,19,23,26H,10-12H2,1-3H3/t13-,14+,19-/m0/s1	SHRVDEFCKQVYRH-KSMMKXTCSA-N	CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c3ccccc3F	BroadT	BRD-K15029434	BRD-K15029434-001-01-1	Broad Institute of MIT and Harvard	BRD-K15029434			CNC[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)-c1ccccc1F	InChI=1S/C21H26FN3O3/c1-13-11-25(14(2)12-26)21(27)17-8-15(16-6-4-5-7-18(16)22)9-24-20(17)28-19(13)10-23-3/h4-9,13-14,19,23,26H,10-12H2,1-3H3/t13-,14+,19-/m0/s1	SHRVDEFCKQVYRH-KSMMKXTCSA-N	387.195819922							119679
BRD-K54470262	LSM-31125		54619082	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18+,22-/m0/s1	LKPBUWUQVMPFSV-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K54470262	BRD-K54470262-001-01-6	Broad Institute of MIT and Harvard	BRD-K54470262			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18+,22-/m0/s1	LKPBUWUQVMPFSV-SVMVAKDDSA-N	517.23588996							119680
BRD-K11120091	LSM-31126		54619154	InChI=1S/C20H30N2O4S/c1-14-12-22(15(2)13-23)27(24,25)20-9-8-17(16-6-4-5-7-16)10-18(20)26-19(14)11-21-3/h6,8-10,14-15,19,21,23H,4-5,7,11-13H2,1-3H3/t14-,15+,19+/m0/s1	DIFJFYXOESTABI-QMTMVMCOSA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C3=CCCC3	BroadT	BRD-K11120091	BRD-K11120091-001-01-6	Broad Institute of MIT and Harvard	BRD-K11120091			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCC1	InChI=1S/C20H30N2O4S/c1-14-12-22(15(2)13-23)27(24,25)20-9-8-17(16-6-4-5-7-16)10-18(20)26-19(14)11-21-3/h6,8-10,14-15,19,21,23H,4-5,7,11-13H2,1-3H3/t14-,15+,19+/m0/s1	DIFJFYXOESTABI-QMTMVMCOSA-N	394.19262815							119681
BRD-K63157607	LSM-15152		54619030	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20+,27+/m0/s1	CROBQSVNIOLQSN-ASHZAFPQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K63157607	BRD-K63157607-001-01-2	Broad Institute of MIT and Harvard	BRD-K63157607			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20+,27+/m0/s1	CROBQSVNIOLQSN-ASHZAFPQSA-N	575.22654834							103808
BRD-K11523030	LSM-31127		54619095	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21-,26+/m1/s1	RQONCHIHFCKYAZ-YPCDYVTLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K11523030	BRD-K11523030-001-01-5	Broad Institute of MIT and Harvard	BRD-K11523030			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21-,26+/m1/s1	RQONCHIHFCKYAZ-YPCDYVTLSA-N	541.22465656							119682
BRD-K99736408	LSM-31128		54619091	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19-,25+/m1/s1	BCONNRULZQNARA-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc3ncc(cc3C1=O)c4cccc(F)c4	BroadT	BRD-K99736408	BRD-K99736408-001-01-2	Broad Institute of MIT and Harvard	BRD-K99736408			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccn2)Oc2ncc(cc2C1=O)-c1cccc(F)c1	InChI=1S/C27H31FN4O3/c1-18-14-32(19(2)17-33)27(34)24-12-21(20-7-6-8-22(28)11-20)13-30-26(24)35-25(18)16-31(3)15-23-9-4-5-10-29-23/h4-13,18-19,25,33H,14-17H2,1-3H3/t18-,19-,25+/m1/s1	BCONNRULZQNARA-RRQZXNHTSA-N	478.238019092							119683
CHEMBL2358475	LSM-31129	SID131414396, BRD-K56032186	54619279	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21+,26+/m1/s1	RQONCHIHFCKYAZ-SWYRRKHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K56032186	BRD-K56032186-001-01-5	Broad Institute of MIT and Harvard	BRD-K56032186			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21+,26+/m1/s1	RQONCHIHFCKYAZ-SWYRRKHMSA-N	541.22465656							119684
BRD-K47435423	LSM-31130		54619005	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19-,25+/m0/s1	KFAQLLCHSMBKLV-XHNVNVPESA-N	COCC#Cc1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K47435423	BRD-K47435423-001-01-5	Broad Institute of MIT and Harvard	BRD-K47435423			COCC#Cc1cnc2O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19-,25+/m0/s1	KFAQLLCHSMBKLV-XHNVNVPESA-N	495.236935806							119685
BRD-K77791585	LSM-31131		54619170	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20-,26-/m0/s1	PFCOQLZGWKMRNP-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K77791585	BRD-K77791585-001-01-8	Broad Institute of MIT and Harvard	BRD-K77791585			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20-,26-/m0/s1	PFCOQLZGWKMRNP-DYLHXGEVSA-N	507.273321314							119686
BRD-K52372795	LSM-31132		54619282	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18+,22-/m0/s1	NALQGZGZTMNLHT-SVMVAKDDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccncc3	BroadT	BRD-K52372795	BRD-K52372795-001-01-2	Broad Institute of MIT and Harvard	BRD-K52372795			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18+,22-/m0/s1	NALQGZGZTMNLHT-SVMVAKDDSA-N	490.224990918							119687
BRD-K79501199	LSM-31133		54619112	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20+,26-/m1/s1	WLIQRYRMKDXINK-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4ccncc4	BroadT	BRD-K79501199	BRD-K79501199-001-01-7	Broad Institute of MIT and Harvard	BRD-K79501199			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1ccncc1	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20+,26-/m1/s1	WLIQRYRMKDXINK-BVFVYWQFSA-N	516.217283648							119688
BRD-K04701596	LSM-31134		54619281	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18-,23-/m1/s1	UTNRSLHBUZLCKT-PMAPCBKXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K04701596	BRD-K04701596-001-01-2	Broad Institute of MIT and Harvard	BRD-K04701596			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18-,23-/m1/s1	UTNRSLHBUZLCKT-PMAPCBKXSA-N	471.273321314							119689
BRD-K65598536	LSM-31135		54619259	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21+,28-/m1/s1	ZMKYSZODYJXXSG-PHVLTXCSSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)c4ccccc4OC)c1	BroadT	BRD-K65598536	BRD-K65598536-001-01-1	Broad Institute of MIT and Harvard	BRD-K65598536			COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)-c2ccccc2OC)c1	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21+,28-/m1/s1	ZMKYSZODYJXXSG-PHVLTXCSSA-N	583.235221244							119690
BRD-K11873306	LSM-44325		54619146	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23-,27-/m0/s1	BANHLTBDTXCVOB-HTNFEZCZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc3cc(\C=C\c4ccccc4)ccc3S1(=O)=O	BroadT	BRD-K11873306	BRD-K11873306-001-01-1	Broad Institute of MIT and Harvard	BRD-K11873306			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2cc(\C=C\c3ccccc3)ccc2S1(=O)=O	InChI=1S/C29H39N3O6S/c1-22-18-32(23(2)21-33)39(35,36)28-12-11-25(10-9-24-7-5-4-6-8-24)17-26(28)38-27(22)19-30(3)29(34)20-31-13-15-37-16-14-31/h4-12,17,22-23,27,33H,13-16,18-21H2,1-3H3/b10-9+/t22-,23-,27-/m0/s1	BANHLTBDTXCVOB-HTNFEZCZSA-N	557.255956688							
BRD-K96604397	LSM-44326		54619219	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19-,23+/m1/s1	BEUJQTDXAJTLJD-HUUKXORASA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K96604397	BRD-K96604397-001-01-8	Broad Institute of MIT and Harvard	BRD-K96604397			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19-,23+/m1/s1	BEUJQTDXAJTLJD-HUUKXORASA-N	472.203192834							
BRD-K42643683	LSM-31138		54619155	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14-,18-/m1/s1	GYAQMILCNYFRMN-HBUWYVDXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K42643683	BRD-K42643683-001-01-4	Broad Institute of MIT and Harvard	BRD-K42643683			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc2ncc(Br)cc2C1=O	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14-,18-/m1/s1	GYAQMILCNYFRMN-HBUWYVDXSA-N	476.10591792							119693
BRD-K10182289	LSM-31139		54619149	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18-,24+/m0/s1	YKMJVYSWBOXOTH-LLJLJFOGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K10182289	BRD-K10182289-001-01-9	Broad Institute of MIT and Harvard	BRD-K10182289			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18-,24+/m0/s1	YKMJVYSWBOXOTH-LLJLJFOGSA-N	528.184268958							119694
BRD-K99231888	LSM-31140		54619064	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21-,25+/m1/s1	XZDMLRGMHLQVSQ-OTPAQWSUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K99231888	BRD-K99231888-001-01-3	Broad Institute of MIT and Harvard	BRD-K99231888			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21-,25+/m1/s1	XZDMLRGMHLQVSQ-OTPAQWSUSA-N	520.268570292							119695
BRD-K62566987	LSM-31141		54619025	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22-,27+/m1/s1	UXOYYOHZEHALJU-LOYIFYEOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K62566987	BRD-K62566987-001-01-5	Broad Institute of MIT and Harvard	BRD-K62566987			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22-,27+/m1/s1	UXOYYOHZEHALJU-LOYIFYEOSA-N	518.289305736							119696
BRD-K55939029	LSM-31142		54619294	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16+,21-/m1/s1	COMCBBHOXAZBGZ-VWKPWSFCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)c3ccc(F)cc3	BroadT	BRD-K55939029	BRD-K55939029-001-01-3	Broad Institute of MIT and Harvard	BRD-K55939029			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16+,21-/m1/s1	COMCBBHOXAZBGZ-VWKPWSFCSA-N	500.145106248							119697
BRD-K47906330	LSM-15142		54619065	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19+,24+/m0/s1	QSIOMQGNLKPVMQ-XLNZFTOWSA-N	CCCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K47906330	BRD-K47906330-001-01-7	Broad Institute of MIT and Harvard	BRD-K47906330			CCCC#Cc1cnc2O[C@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19+,24+/m0/s1	QSIOMQGNLKPVMQ-XLNZFTOWSA-N	496.248583776							103798
CHEMBL2359527	LSM-31143	BRD-K28536057, SID131414194	54619081	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23-,28-/m0/s1	LUSCQGWIOGZNHP-LXWOLXCRSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@@H](C)CO)C#CCC4CCCC4	BroadT	BRD-K28536057	BRD-K28536057-001-01-6	Broad Institute of MIT and Harvard	BRD-K28536057			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCC1CCCC1	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23-,28-/m0/s1	LUSCQGWIOGZNHP-LXWOLXCRSA-N	604.227693020001							119698
BRD-K20578716	LSM-15120		54619062	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19+,24-/m0/s1	QSIOMQGNLKPVMQ-GLDPYIMESA-N	CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K20578716	BRD-K20578716-001-01-9	Broad Institute of MIT and Harvard	BRD-K20578716			CCCC#Cc1cnc2O[C@@H](CN(C)C(=O)Nc3cccc(F)c3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H33FN4O4/c1-5-6-7-9-20-12-23-25(29-14-20)36-24(18(2)15-32(26(23)34)19(3)17-33)16-31(4)27(35)30-22-11-8-10-21(28)13-22/h8,10-14,18-19,24,33H,5-6,15-17H2,1-4H3,(H,30,35)/t18-,19+,24-/m0/s1	QSIOMQGNLKPVMQ-GLDPYIMESA-N	496.248583776							103776
BRD-K83276573	LSM-31144		54619255	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21-,26-/m1/s1	UWPUNYQEQGJQBN-IPVFLDMMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K83276573	BRD-K83276573-001-01-6	Broad Institute of MIT and Harvard	BRD-K83276573			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21-,26-/m1/s1	UWPUNYQEQGJQBN-IPVFLDMMSA-N	523.214091876							119699
BRD-K18518644	LSM-31145		54619046	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19+,22-/m1/s1	ZBLNAKCVTQSUGS-XQBPLPMBSA-N	COCC#Cc1cnc2O[C@H](CN(C)C(=O)CN3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	BroadT	BRD-K18518644	BRD-K18518644-001-01-6	Broad Institute of MIT and Harvard	BRD-K18518644			COCC#Cc1cnc2O[C@H](CN(C)C(=O)CN3CCOCC3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19+,22-/m1/s1	ZBLNAKCVTQSUGS-XQBPLPMBSA-N	488.263484912							119700
BRD-K62433889	LSM-31146		54619215	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19+,25-/m0/s1	DLWWRBINVHEARI-CEYNDMKZSA-N	COc1ccccc1c2cnc3O[C@@H](CN(C)C(=O)c4cccnc4)[C@@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K62433889	BRD-K62433889-001-01-7	Broad Institute of MIT and Harvard	BRD-K62433889			COc1ccccc1-c1cnc2O[C@@H](CN(C)C(=O)c3cccnc3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19+,25-/m0/s1	DLWWRBINVHEARI-CEYNDMKZSA-N	504.237270164							119701
BRD-K92666980	LSM-43612		54619138	InChI=1S/C30H34FN3O3/c1-21-17-34(22(2)20-35)30(36)27-15-25(10-9-23-7-5-4-6-8-23)16-32-29(27)37-28(21)19-33(3)18-24-11-13-26(31)14-12-24/h4-16,21-22,28,35H,17-20H2,1-3H3/b10-9+/t21-,22+,28-/m0/s1	ICPSYJLXOFSSIL-JBLYRJRPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K92666980	BRD-K92666980-001-01-4	Broad Institute of MIT and Harvard	BRD-K92666980			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C30H34FN3O3/c1-21-17-34(22(2)20-35)30(36)27-15-25(10-9-23-7-5-4-6-8-23)16-32-29(27)37-28(21)19-33(3)18-24-11-13-26(31)14-12-24/h4-16,21-22,28,35H,17-20H2,1-3H3/b10-9+/t21-,22+,28-/m0/s1	ICPSYJLXOFSSIL-JBLYRJRPSA-N	503.258420178							
BRD-K72767220	LSM-31147		54619003	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19+,22+/m0/s1	ZBLNAKCVTQSUGS-NNMXDRDESA-N	COCC#Cc1cnc2O[C@H](CN(C)C(=O)CN3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K72767220	BRD-K72767220-001-01-4	Broad Institute of MIT and Harvard	BRD-K72767220			COCC#Cc1cnc2O[C@H](CN(C)C(=O)CN3CCOCC3)[C@@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19+,22+/m0/s1	ZBLNAKCVTQSUGS-NNMXDRDESA-N	488.263484912							119702
BRD-K98956010	LSM-31148		54619224	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21+,28-/m0/s1	CBIJUIOTIYQLMH-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K98956010	BRD-K98956010-001-01-7	Broad Institute of MIT and Harvard	BRD-K98956010			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21+,28-/m0/s1	CBIJUIOTIYQLMH-GTNJKRJXSA-N	612.241783834							119703
BRD-K05857639	LSM-31149		54619174	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21+,27-/m0/s1	RUWJTSGBQQPZMY-ISCCLHIJSA-N	COc1cccc(c1)c2ccc3c(O[C@@H](CN(C)Cc4ccncc4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K05857639	BRD-K05857639-001-01-0	Broad Institute of MIT and Harvard	BRD-K05857639			COc1cccc(c1)-c1ccc2c(O[C@@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21+,27-/m0/s1	RUWJTSGBQQPZMY-ISCCLHIJSA-N	525.22974194							119704
BRD-K15045100	LSM-44327		54619096	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19+,23+/m1/s1	BEUJQTDXAJTLJD-LZYJUXAGSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K15045100	BRD-K15045100-001-01-0	Broad Institute of MIT and Harvard	BRD-K15045100			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19+,23+/m1/s1	BEUJQTDXAJTLJD-LZYJUXAGSA-N	472.203192834							
BRD-K16479870	LSM-15113		54619161	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20-,27+/m0/s1	CROBQSVNIOLQSN-OWOAZTCBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K16479870	BRD-K16479870-001-01-8	Broad Institute of MIT and Harvard	BRD-K16479870			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20-,27+/m0/s1	CROBQSVNIOLQSN-OWOAZTCBSA-N	575.22654834							103769
BRD-K77023196	LSM-31151		54619071	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21-,28-/m0/s1	CBIJUIOTIYQLMH-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K77023196	BRD-K77023196-001-01-7	Broad Institute of MIT and Harvard	BRD-K77023196			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21-,28-/m0/s1	CBIJUIOTIYQLMH-CZBREUMFSA-N	612.241783834							119706
CHEMBL2355752	LSM-31152	BRD-K31234009, SID131414292	54619177	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28+/m0/s1	PEEJAUXHJGOSQX-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K31234009	BRD-K31234009-001-01-2	Broad Institute of MIT and Harvard	BRD-K31234009			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28+/m0/s1	PEEJAUXHJGOSQX-YHGPEZAFSA-N	537.209755424							119707
BRD-K01853144	LSM-31153		54619035	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21+,26-/m1/s1	UWPUNYQEQGJQBN-YZIHRLCOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K01853144	BRD-K01853144-001-01-1	Broad Institute of MIT and Harvard	BRD-K01853144			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21+,26-/m1/s1	UWPUNYQEQGJQBN-YZIHRLCOSA-N	523.214091876							119708
BRD-K24538875	LSM-31154		54619178	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22+,27-/m1/s1	UXOYYOHZEHALJU-UMTXDNHDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K24538875	BRD-K24538875-001-01-6	Broad Institute of MIT and Harvard	BRD-K24538875			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22+,27-/m1/s1	UXOYYOHZEHALJU-UMTXDNHDSA-N	518.289305736							119709
BRD-K80455228	LSM-31155		54619038	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19-,25-/m1/s1	DLWWRBINVHEARI-MPCDZSKCSA-N	COc1ccccc1c2cnc3O[C@H](CN(C)C(=O)c4cccnc4)[C@H](C)CN([C@H](C)CO)C(=O)c3c2	BroadT	BRD-K80455228	BRD-K80455228-001-01-8	Broad Institute of MIT and Harvard	BRD-K80455228			COc1ccccc1-c1cnc2O[C@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19-,25-/m1/s1	DLWWRBINVHEARI-MPCDZSKCSA-N	504.237270164							119710
BRD-K88437756	LSM-31156		54619122	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21+,25+/m0/s1	XZDMLRGMHLQVSQ-BPYKYCOYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K88437756	BRD-K88437756-001-01-8	Broad Institute of MIT and Harvard	BRD-K88437756			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21+,25+/m0/s1	XZDMLRGMHLQVSQ-BPYKYCOYSA-N	520.268570292							119711
BRD-K04988998	LSM-31157		54619214	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21-,28-/m1/s1	ZMKYSZODYJXXSG-UMQWNRPGSA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)c4ccccc4OC)c1	BroadT	BRD-K04988998	BRD-K04988998-001-01-9	Broad Institute of MIT and Harvard	BRD-K04988998			COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)-c2ccccc2OC)c1	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21-,28-/m1/s1	ZMKYSZODYJXXSG-UMQWNRPGSA-N	583.235221244							131297
BRD-K91238308	LSM-31158		54619191	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18-,22+/m1/s1	LKPBUWUQVMPFSV-HMFYCAOWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K91238308	BRD-K91238308-001-01-8	Broad Institute of MIT and Harvard	BRD-K91238308			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18-,22+/m1/s1	LKPBUWUQVMPFSV-HMFYCAOWSA-N	517.23588996							119714
BRD-K22458526	LSM-15026		54619105	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20+,25-/m0/s1	ZECMXSZSTQYLBY-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K22458526	BRD-K22458526-001-01-2	Broad Institute of MIT and Harvard	BRD-K22458526			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20+,25-/m0/s1	ZECMXSZSTQYLBY-DFIYOIEZSA-N	492.273655672							103682
BRD-K52872067	LSM-31159		54619127	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19-,25+/m1/s1	KFAQLLCHSMBKLV-RRQZXNHTSA-N	COCC#Cc1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K52872067	BRD-K52872067-001-01-2	Broad Institute of MIT and Harvard	BRD-K52872067			COCC#Cc1cnc2O[C@@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C27H33N3O6/c1-18-13-30(19(2)16-31)27(32)22-10-20(6-5-9-33-4)12-28-26(22)36-25(18)15-29(3)14-21-7-8-23-24(11-21)35-17-34-23/h7-8,10-12,18-19,25,31H,9,13-17H2,1-4H3/t18-,19-,25+/m1/s1	KFAQLLCHSMBKLV-RRQZXNHTSA-N	495.236935806							119715
BRD-K19011391	LSM-31160		54619278	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22-,27-/m0/s1	UXOYYOHZEHALJU-BERHBOFZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K19011391	BRD-K19011391-001-01-6	Broad Institute of MIT and Harvard	BRD-K19011391			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22-,27-/m0/s1	UXOYYOHZEHALJU-BERHBOFZSA-N	518.289305736							119716
BRD-K91548063	LSM-44328		54619296	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19+,23-/m1/s1	PJAYKLYFYLNPHZ-WMANONNTSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K91548063	BRD-K91548063-001-01-5	Broad Institute of MIT and Harvard	BRD-K91548063			C\C=C\c1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19+,23-/m1/s1	PJAYKLYFYLNPHZ-WMANONNTSA-N	466.250143026							
BRD-K88702379	LSM-44329		54619272	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19-,25+/m0/s1	ZTEKSXAQYWYLFD-DCXAYUOHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K88702379	BRD-K88702379-001-01-2	Broad Institute of MIT and Harvard	BRD-K88702379			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19-,25+/m0/s1	ZTEKSXAQYWYLFD-DCXAYUOHSA-N	533.26381927							
BRD-K11672886	LSM-31163		54619054	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19-,24+/m1/s1	AOAVRGNJVMAOBU-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K11672886	BRD-K11672886-001-01-5	Broad Institute of MIT and Harvard	BRD-K11672886			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19-,24+/m1/s1	AOAVRGNJVMAOBU-IECBHUPTSA-N	516.240640982							119719
BRD-K43390655	LSM-44330		54619240	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19+,23+/m0/s1	BEUJQTDXAJTLJD-DJHUDNPDSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K43390655	BRD-K43390655-001-01-5	Broad Institute of MIT and Harvard	BRD-K43390655			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19+,23+/m0/s1	BEUJQTDXAJTLJD-DJHUDNPDSA-N	472.203192834							
MLS003128974	LSM-31165	BRD-K87689816, SID99359537	46904099	InChI=1S/C23H36BrN3O5S/c1-17-14-27(18(2)16-28)33(30,31)22-8-7-19(24)13-20(22)32-21(17)15-25(3)23(29)9-12-26-10-5-4-6-11-26/h7-8,13,17-18,21,28H,4-6,9-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	QFNUSQGYMOISEO-WFXMLNOXSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCN2CCCCC2)Oc3cc(Br)ccc3S1(=O)=O	BroadT	BRD-K87689816	BRD-K87689816-001-01-3	Broad Institute of MIT and Harvard	BRD-K87689816			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCN2CCCCC2)Oc2cc(Br)ccc2S1(=O)=O	InChI=1S/C23H36BrN3O5S/c1-17-14-27(18(2)16-28)33(30,31)22-8-7-19(24)13-20(22)32-21(17)15-25(3)23(29)9-12-26-10-5-4-6-11-26/h7-8,13,17-18,21,28H,4-6,9-12,14-16H2,1-3H3/t17-,18-,21-/m0/s1	QFNUSQGYMOISEO-WFXMLNOXSA-N	545.155904572							119721
BRD-K25916267	LSM-31166		54619206	InChI=1S/C24H37N3O3/c1-7-11-26(6)15-22-18(4)14-27(19(5)16-28)24(29)21-12-20(10-8-9-17(2)3)13-25-23(21)30-22/h12-13,17-19,22,28H,7,9,11,14-16H2,1-6H3/t18-,19+,22+/m0/s1	RJPYWVJCIKXYIX-NNMXDRDESA-N	CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCC(C)C	BroadT	BRD-K25916267	BRD-K25916267-001-01-9	Broad Institute of MIT and Harvard	BRD-K25916267			CCCN(C)C[C@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@H](C)CO)C#CCC(C)C	InChI=1S/C24H37N3O3/c1-7-11-26(6)15-22-18(4)14-27(19(5)16-28)24(29)21-12-20(10-8-9-17(2)3)13-25-23(21)30-22/h12-13,17-19,22,28H,7,9,11,14-16H2,1-6H3/t18-,19+,22+/m0/s1	RJPYWVJCIKXYIX-NNMXDRDESA-N	415.283492074							119722
BRD-K01278504	LSM-31167		54619221	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18+,24-/m1/s1	YKMJVYSWBOXOTH-NXMSCROESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4cncnc4	BroadT	BRD-K01278504	BRD-K01278504-001-01-5	Broad Institute of MIT and Harvard	BRD-K01278504			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1cncnc1	InChI=1S/C26H29FN4O5S/c1-17-13-31(18(2)15-32)37(34,35)25-8-7-19(21-11-28-16-29-12-21)10-23(25)36-24(17)14-30(3)26(33)20-5-4-6-22(27)9-20/h4-12,16-18,24,32H,13-15H2,1-3H3/t17-,18+,24-/m1/s1	YKMJVYSWBOXOTH-NXMSCROESA-N	528.184268958							119723
BRD-K71824916	LSM-31168		54619242	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18-,22-/m0/s1	NALQGZGZTMNLHT-SPEDKVCISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)c3ccncc3	BroadT	BRD-K71824916	BRD-K71824916-001-01-3	Broad Institute of MIT and Harvard	BRD-K71824916			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CN(C)C)Oc2cc(ccc2S1(=O)=O)-c1ccncc1	InChI=1S/C24H34N4O5S/c1-17-13-28(18(2)16-29)34(31,32)23-7-6-20(19-8-10-25-11-9-19)12-21(23)33-22(17)14-27(5)24(30)15-26(3)4/h6-12,17-18,22,29H,13-16H2,1-5H3/t17-,18-,22-/m0/s1	NALQGZGZTMNLHT-SPEDKVCISA-N	490.224990918							119724
BRD-K97901556	LSM-31169		54619131	InChI=1S/C23H27FN2O4S/c1-16-14-26(17(2)15-27)31(28,29)23-11-9-18(12-21(23)30-22(16)13-25-3)8-10-19-6-4-5-7-20(19)24/h4-7,9,11-12,16-17,22,25,27H,13-15H2,1-3H3/t16-,17-,22+/m0/s1	SJHPEWGCSFZDDK-PNLZDCPESA-N	CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc3ccccc3F	BroadT	BRD-K97901556	BRD-K97901556-001-01-4	Broad Institute of MIT and Harvard	BRD-K97901556			CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO)C#Cc1ccccc1F	InChI=1S/C23H27FN2O4S/c1-16-14-26(17(2)15-27)31(28,29)23-11-9-18(12-21(23)30-22(16)13-25-3)8-10-19-6-4-5-7-20(19)24/h4-7,9,11-12,16-17,22,25,27H,13-15H2,1-3H3/t16-,17-,22+/m0/s1	SJHPEWGCSFZDDK-PNLZDCPESA-N	446.167556254							119725
MLS003130304	LSM-31170	BRD-K88357881, SID99359208	46903820	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19+,25+/m1/s1	DLWWRBINVHEARI-WYEJZRMESA-N	COc1ccccc1c2cnc3O[C@@H](CN(C)C(=O)c4cccnc4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2	BroadT	BRD-K88357881	BRD-K88357881-001-02-4	Broad Institute of MIT and Harvard	BRD-K88357881			COc1ccccc1-c1cnc2O[C@@H](CN(C)C(=O)c3cccnc3)[C@H](C)CN([C@@H](C)CO)C(=O)c2c1	InChI=1S/C28H32N4O5/c1-18-15-32(19(2)17-33)28(35)23-12-21(22-9-5-6-10-24(22)36-4)14-30-26(23)37-25(18)16-31(3)27(34)20-8-7-11-29-13-20/h5-14,18-19,25,33H,15-17H2,1-4H3/t18-,19+,25+/m1/s1	DLWWRBINVHEARI-WYEJZRMESA-N	504.237270164							119726
BRD-K57079327	LSM-15041		54619012	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28+/m0/s1	PEEJAUXHJGOSQX-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K57079327	BRD-K57079327-001-01-5	Broad Institute of MIT and Harvard	BRD-K57079327			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28+/m0/s1	PEEJAUXHJGOSQX-BALWLHIASA-N	537.209755424							103697
BRD-K25822126	LSM-31171		54619200	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19-,22+/m1/s1	ZBLNAKCVTQSUGS-KNKQGSTJSA-N	COCC#Cc1cnc2O[C@@H](CN(C)C(=O)CN3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K25822126	BRD-K25822126-001-01-0	Broad Institute of MIT and Harvard	BRD-K25822126			COCC#Cc1cnc2O[C@@H](CN(C)C(=O)CN3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19-,22+/m1/s1	ZBLNAKCVTQSUGS-KNKQGSTJSA-N	488.263484912							119727
BRD-K41597374	LSM-31172		54619267	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20+,27-/m0/s1	CROBQSVNIOLQSN-VKIDHGPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc3cc(ccc3S1(=O)=O)C#CC4CCCC4	BroadT	BRD-K41597374	BRD-K41597374-001-01-7	Broad Institute of MIT and Harvard	BRD-K41597374			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1	InChI=1S/C29H35F2N3O5S/c1-19-16-34(20(2)18-35)40(37,38)28-13-10-22(9-8-21-6-4-5-7-21)14-26(28)39-27(19)17-33(3)29(36)32-25-15-23(30)11-12-24(25)31/h10-15,19-21,27,35H,4-7,16-18H2,1-3H3,(H,32,36)/t19-,20+,27-/m0/s1	CROBQSVNIOLQSN-VKIDHGPPSA-N	575.22654834							119728
BRD-K48671182-001-01-5	LSM-31173	BRD-K48671182	54619018	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20-,26+/m1/s1	WLIQRYRMKDXINK-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc3ncc(cc3C1=O)C#Cc4ccncc4	BroadT	BRD-K48671182	BRD-K48671182-001-01-5	Broad Institute of MIT and Harvard	BRD-K48671182			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccc2F)Oc2ncc(cc2C1=O)C#Cc1ccncc1	InChI=1S/C29H29FN4O4/c1-19-16-34(20(2)18-35)29(37)24-14-22(9-8-21-10-12-31-13-11-21)15-32-27(24)38-26(19)17-33(3)28(36)23-6-4-5-7-25(23)30/h4-7,10-15,19-20,26,35H,16-18H2,1-3H3/t19-,20-,26+/m1/s1	WLIQRYRMKDXINK-KYTVRQNUSA-N	516.217283648							119729
BRD-K60688287	LSM-31174		54619231	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21+,27+/m0/s1	RUWJTSGBQQPZMY-FYQCMVGJSA-N	COc1cccc(c1)c2ccc3c(O[C@H](CN(C)Cc4ccncc4)[C@@H](C)CN([C@H](C)CO)S3(=O)=O)c2	BroadT	BRD-K60688287	BRD-K60688287-001-01-6	Broad Institute of MIT and Harvard	BRD-K60688287			COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)Cc3ccncc3)[C@@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C28H35N3O5S/c1-20-16-31(21(2)19-32)37(33,34)28-9-8-24(23-6-5-7-25(14-23)35-4)15-26(28)36-27(20)18-30(3)17-22-10-12-29-13-11-22/h5-15,20-21,27,32H,16-19H2,1-4H3/t20-,21+,27+/m0/s1	RUWJTSGBQQPZMY-FYQCMVGJSA-N	525.22974194							119730
BRD-K75944637	LSM-31175		54619150	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19+,24-/m1/s1	AOAVRGNJVMAOBU-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K75944637	BRD-K75944637-001-01-3	Broad Institute of MIT and Harvard	BRD-K75944637			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19+,24-/m1/s1	AOAVRGNJVMAOBU-YDIMBITNSA-N	516.240640982							119731
BRD-K09464310	LSM-31176		54619026	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21+,25-/m0/s1	XZDMLRGMHLQVSQ-BKSPAHHJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc3ncc(cc3C1=O)C#CC4(O)CCCC4	BroadT	BRD-K09464310	BRD-K09464310-001-01-7	Broad Institute of MIT and Harvard	BRD-K09464310			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2cccnc2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1	InChI=1S/C29H36N4O5/c1-20-17-33(21(2)19-34)28(36)24-13-23(8-11-29(37)9-4-5-10-29)16-31-27(24)38-25(20)18-32(3)26(35)14-22-7-6-12-30-15-22/h6-7,12-13,15-16,20-21,25,34,37H,4-5,9-10,14,17-19H2,1-3H3/t20-,21+,25-/m0/s1	XZDMLRGMHLQVSQ-BKSPAHHJSA-N	520.268570292							119732
BRD-K24393110	LSM-31177		54619295	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20-,25-/m0/s1	ZECMXSZSTQYLBY-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K24393110	BRD-K24393110-001-01-1	Broad Institute of MIT and Harvard	BRD-K24393110			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C28H36N4O4/c1-19-16-32(20(2)18-33)28(35)24-14-23(22-7-5-4-6-8-22)15-30-27(24)36-25(19)17-31(3)26(34)13-21-9-11-29-12-10-21/h7,9-12,14-15,19-20,25,33H,4-6,8,13,16-18H2,1-3H3/t19-,20-,25-/m0/s1	ZECMXSZSTQYLBY-RLSLOFABSA-N	492.273655672							119733
BRD-K16429826	LSM-31178		54619043	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18-,23+/m1/s1	UTNRSLHBUZLCKT-PNCHPQGNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K16429826	BRD-K16429826-001-01-8	Broad Institute of MIT and Harvard	BRD-K16429826			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18-,23+/m1/s1	UTNRSLHBUZLCKT-PNCHPQGNSA-N	471.273321314							119734
BRD-K96970199	LSM-44331		54619238	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19-,23-/m0/s1	BEUJQTDXAJTLJD-PKZJSCAISA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K96970199	BRD-K96970199-001-01-3	Broad Institute of MIT and Harvard	BRD-K96970199			C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19-,23-/m0/s1	BEUJQTDXAJTLJD-PKZJSCAISA-N	472.203192834							
BRD-K54332342	LSM-44332		54619103	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19+,25-/m0/s1	ZTEKSXAQYWYLFD-WLUBDSDSSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)Oc3ncc(\C=C\c4ccccc4)cc3C1=O	BroadT	BRD-K54332342	BRD-K54332342-001-01-2	Broad Institute of MIT and Harvard	BRD-K54332342			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C29H35N5O5/c1-18-15-34(19(2)17-35)28(36)24-13-23(12-11-22-9-7-6-8-10-22)14-30-27(24)38-25(18)16-33(5)29(37)31-26-20(3)32-39-21(26)4/h6-14,18-19,25,35H,15-17H2,1-5H3,(H,31,37)/b12-11+/t18-,19+,25-/m0/s1	ZTEKSXAQYWYLFD-WLUBDSDSSA-N	533.26381927							
BRD-K69968541	LSM-31181		54619290	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19+,24-/m0/s1	AOAVRGNJVMAOBU-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCC2)Oc3cc(ccc3S1(=O)=O)c4cccnc4	BroadT	BRD-K69968541	BRD-K69968541-001-01-5	Broad Institute of MIT and Harvard	BRD-K69968541			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCC2)Oc2cc(ccc2S1(=O)=O)-c1cccnc1	InChI=1S/C26H36N4O5S/c1-18-15-30(19(2)17-31)36(33,34)25-11-10-20(21-7-6-12-27-14-21)13-23(25)35-24(18)16-29(3)26(32)28-22-8-4-5-9-22/h6-7,10-14,18-19,22,24,31H,4-5,8-9,15-17H2,1-3H3,(H,28,32)/t18-,19+,24-/m0/s1	AOAVRGNJVMAOBU-GLDPYIMESA-N	516.240640982							119737
CHEMBL2142052	LSM-31182	BRD-K51298794, SID131414393	54619277	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21+,26-/m1/s1	RQONCHIHFCKYAZ-YZIHRLCOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4ccncc4	BroadT	BRD-K51298794	BRD-K51298794-001-01-1	Broad Institute of MIT and Harvard	BRD-K51298794			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1	InChI=1S/C28H35N3O6S/c1-20-17-31(21(2)19-32)38(34,35)27-7-6-23(5-4-22-8-12-29-13-9-22)16-25(27)37-26(20)18-30(3)28(33)24-10-14-36-15-11-24/h6-9,12-13,16,20-21,24,26,32H,10-11,14-15,17-19H2,1-3H3/t20-,21+,26-/m1/s1	RQONCHIHFCKYAZ-YZIHRLCOSA-N	541.22465656							119738
BRD-K19103931	LSM-31183		54619188	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21-,25-/m0/s1	FGDWBZCHFJENJN-WATLYSKOSA-N	CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCc3ccccc3	BroadT	BRD-K19103931	BRD-K19103931-001-01-8	Broad Institute of MIT and Harvard	BRD-K19103931			CCCNC(=O)N(C)C[C@@H]1Oc2ncc(cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)C#CCc1ccccc1	InChI=1S/C28H36N4O4/c1-5-14-29-28(35)31(4)18-25-20(2)17-32(21(3)19-33)27(34)24-15-23(16-30-26(24)36-25)13-9-12-22-10-7-6-8-11-22/h6-8,10-11,15-16,20-21,25,33H,5,12,14,17-19H2,1-4H3,(H,29,35)/t20-,21-,25-/m0/s1	FGDWBZCHFJENJN-WATLYSKOSA-N	492.273655672							119739
MLS003128915	LSM-31184	SID99359350, BRD-K92518554	46903914	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14+,18-/m0/s1	GYAQMILCNYFRMN-IYOUNJFTSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K92518554	BRD-K92518554-001-02-1	Broad Institute of MIT and Harvard	BRD-K92518554			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc2ncc(Br)cc2C1=O	InChI=1S/C21H25BrN4O4/c1-13-10-26(14(2)12-27)20(28)16-8-15(22)9-24-19(16)30-18(13)11-25(3)21(29)17-6-4-5-7-23-17/h4-9,13-14,18,27H,10-12H2,1-3H3/t13-,14+,18-/m0/s1	GYAQMILCNYFRMN-IYOUNJFTSA-N	476.10591792							119740
BRD-K23701005	LSM-31185		54619036	InChI=1S/C19H28BrN3O3/c1-12-8-23(13(2)11-24)19(25)16-6-15(20)7-21-18(16)26-17(12)10-22(3)9-14-4-5-14/h6-7,12-14,17,24H,4-5,8-11H2,1-3H3/t12-,13-,17-/m1/s1	RZLJZRNIDXVDGS-PBFPGSCMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc3ncc(Br)cc3C1=O	BroadT	BRD-K23701005	BRD-K23701005-001-01-4	Broad Institute of MIT and Harvard	BRD-K23701005			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)Oc2ncc(Br)cc2C1=O	InChI=1S/C19H28BrN3O3/c1-12-8-23(13(2)11-24)19(25)16-6-15(20)7-21-18(16)26-17(12)10-22(3)9-14-4-5-14/h6-7,12-14,17,24H,4-5,8-11H2,1-3H3/t12-,13-,17-/m1/s1	RZLJZRNIDXVDGS-PBFPGSCMSA-N	425.131404386							119741
CHEMBL2356582	LSM-31186	BRD-K59701963, SID131414219	54619106	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23+,28-/m1/s1	LUSCQGWIOGZNHP-AWVRMFGXSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@@H](C)CO)C#CCC4CCCC4	BroadT	BRD-K59701963	BRD-K59701963-001-01-1	Broad Institute of MIT and Harvard	BRD-K59701963			COc1ccccc1S(=O)(=O)N(C)C[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO)C#CCC1CCCC1	InChI=1S/C30H40N2O7S2/c1-22-19-32(23(2)21-33)41(36,37)30-17-16-25(13-9-12-24-10-5-6-11-24)18-27(30)39-28(22)20-31(3)40(34,35)29-15-8-7-14-26(29)38-4/h7-8,14-18,22-24,28,33H,5-6,10-12,19-21H2,1-4H3/t22-,23+,28-/m1/s1	LUSCQGWIOGZNHP-AWVRMFGXSA-N	604.227693020001							119742
BRD-K31644794	LSM-31187		54619050	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20+,26+/m1/s1	PFCOQLZGWKMRNP-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K31644794	BRD-K31644794-001-01-1	Broad Institute of MIT and Harvard	BRD-K31644794			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20+,26+/m1/s1	PFCOQLZGWKMRNP-GOHWNWGWSA-N	507.273321314							119743
BRD-K91490116	LSM-31188		54619133	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21+,26+/m1/s1	UWPUNYQEQGJQBN-SWYRRKHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc3cc(ccc3S1(=O)=O)c4ccccc4C	BroadT	BRD-K91490116	BRD-K91490116-001-01-7	Broad Institute of MIT and Harvard	BRD-K91490116			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccccn2)Oc2cc(ccc2S1(=O)=O)-c1ccccc1C	InChI=1S/C28H33N3O5S/c1-19-9-5-6-10-23(19)22-12-13-27-25(15-22)36-26(17-30(4)28(33)24-11-7-8-14-29-24)20(2)16-31(21(3)18-32)37(27,34)35/h5-15,20-21,26,32H,16-18H2,1-4H3/t20-,21+,26+/m1/s1	UWPUNYQEQGJQBN-SWYRRKHMSA-N	523.214091876							119744
BRD-K84151275	LSM-31189		54619289	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16+,20-/m0/s1	MCOJFHYNZBKTQP-YRNRMSPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)C#CC3CC3	BroadT	BRD-K84151275	BRD-K84151275-001-01-1	Broad Institute of MIT and Harvard	BRD-K84151275			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)C#CC1CC1	InChI=1S/C21H30N2O6S2/c1-15-12-23(16(2)14-24)31(27,28)21-10-9-18(8-7-17-5-6-17)11-19(21)29-20(15)13-22(3)30(4,25)26/h9-11,15-17,20,24H,5-6,12-14H2,1-4H3/t15-,16+,20-/m0/s1	MCOJFHYNZBKTQP-YRNRMSPPSA-N	470.15452808							119745
BRD-K77355185	LSM-31190		54619140	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18+,24-/m1/s1	SHPIGGYHGMASQB-NXMSCROESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K77355185	BRD-K77355185-001-01-6	Broad Institute of MIT and Harvard	BRD-K77355185			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C27H33FN4O4/c1-17-14-32(18(2)16-33)26(34)23-11-20(19-7-4-5-8-19)13-29-25(23)36-24(17)15-31(3)27(35)30-22-10-6-9-21(28)12-22/h6-7,9-13,17-18,24,33H,4-5,8,14-16H2,1-3H3,(H,30,35)/t17-,18+,24-/m1/s1	SHPIGGYHGMASQB-NXMSCROESA-N	496.248583776							119746
BRD-K92144098	LSM-31191		54619246	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22-,28+/m1/s1	YAJYINBQFXCAPI-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccc(F)c4	BroadT	BRD-K92144098	BRD-K92144098-001-01-1	Broad Institute of MIT and Harvard	BRD-K92144098			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22-,28+/m1/s1	YAJYINBQFXCAPI-XJGOYTCSSA-N	571.251620236							119747
BRD-K57969360	LSM-44333		54619104	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19-,23+/m0/s1	OYGLGTZFOSPOAJ-PYEMCDTOSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K57969360	BRD-K57969360-001-01-5	Broad Institute of MIT and Harvard	BRD-K57969360			C\C=C\c1ccc2c(O[C@H](CN(C)Cc3ccccn3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19-,23+/m0/s1	OYGLGTZFOSPOAJ-PYEMCDTOSA-N	459.219177256							
BRD-K84748056	LSM-31193		54619044	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20+,26-/m0/s1	PFCOQLZGWKMRNP-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(=O)O)Oc3ncc(cc3C1=O)C4=CCCCC4	BroadT	BRD-K84748056	BRD-K84748056-001-01-9	Broad Institute of MIT and Harvard	BRD-K84748056			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ncc(cc2C1=O)C1=CCCCC1	InChI=1S/C29H37N3O5/c1-19-15-32(20(2)18-33)28(34)25-13-24(22-7-5-4-6-8-22)14-30-27(25)37-26(19)17-31(3)16-21-9-11-23(12-10-21)29(35)36/h7,9-14,19-20,26,33H,4-6,8,15-18H2,1-3H3,(H,35,36)/t19-,20+,26-/m0/s1	PFCOQLZGWKMRNP-UNVFRBQDSA-N	507.273321314							119749
BRD-K44194970	LSM-31194		54619257	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16+,21+/m0/s1	COMCBBHOXAZBGZ-GCKMJXCFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)Oc2cc(ccc2S1(=O)=O)c3ccc(F)cc3	BroadT	BRD-K44194970	BRD-K44194970-001-01-8	Broad Institute of MIT and Harvard	BRD-K44194970			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)Oc2cc(ccc2S1(=O)=O)-c1ccc(F)cc1	InChI=1S/C22H29FN2O6S2/c1-15-12-25(16(2)14-26)33(29,30)22-10-7-18(17-5-8-19(23)9-6-17)11-20(22)31-21(15)13-24(3)32(4,27)28/h5-11,15-16,21,26H,12-14H2,1-4H3/t15-,16+,21+/m0/s1	COMCBBHOXAZBGZ-GCKMJXCFSA-N	500.145106248							119750
BRD-K99962919	LSM-44334		54619102	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19-,23+/m1/s1	OYGLGTZFOSPOAJ-RZIZJVLDSA-N	C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K99962919	BRD-K99962919-001-01-6	Broad Institute of MIT and Harvard	BRD-K99962919			C\C=C\c1ccc2c(O[C@@H](CN(C)Cc3ccccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H33N3O4S/c1-5-8-20-10-11-24-22(13-20)31-23(16-26(4)15-21-9-6-7-12-25-21)18(2)14-27(19(3)17-28)32(24,29)30/h5-13,18-19,23,28H,14-17H2,1-4H3/b8-5+/t18-,19-,23+/m1/s1	OYGLGTZFOSPOAJ-RZIZJVLDSA-N	459.219177256							
BRD-K59913416	LSM-44335		54619302	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21-,28+/m1/s1	LVQXARYEWHFWNX-AARMAHPWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc4ncc(\C=C\c5ccccc5)cc4C1=O	BroadT	BRD-K59913416	BRD-K59913416-001-01-5	Broad Institute of MIT and Harvard	BRD-K59913416			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2ncc(\C=C\c3ccccc3)cc2C1=O	InChI=1S/C31H33N3O6/c1-20-16-34(21(2)18-35)31(37)25-13-23(10-9-22-7-5-4-6-8-22)15-32-29(25)40-28(20)17-33(3)30(36)24-11-12-26-27(14-24)39-19-38-26/h4-15,20-21,28,35H,16-19H2,1-3H3/b10-9+/t20-,21-,28+/m1/s1	LVQXARYEWHFWNX-AARMAHPWSA-N	543.236935806							
BRD-K10623075	LSM-31197		54619115	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18-,23-/m0/s1	UTNRSLHBUZLCKT-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K10623075	BRD-K10623075-001-01-0	Broad Institute of MIT and Harvard	BRD-K10623075			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18-,23-/m0/s1	UTNRSLHBUZLCKT-BSRJHKFKSA-N	471.273321314							119753
BRD-K39441628	LSM-31198		54619171	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21+,28+/m0/s1	ZMKYSZODYJXXSG-BALWLHIASA-N	COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)c4ccccc4OC)c1	BroadT	BRD-K39441628	BRD-K39441628-001-01-6	Broad Institute of MIT and Harvard	BRD-K39441628			COc1cccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@@H]2C)[C@H](C)CO)-c2ccccc2OC)c1	InChI=1S/C30H37N3O7S/c1-20-17-33(21(2)19-34)41(36,37)29-14-13-22(25-11-6-7-12-26(25)39-5)15-27(29)40-28(20)18-32(3)30(35)31-23-9-8-10-24(16-23)38-4/h6-16,20-21,28,34H,17-19H2,1-5H3,(H,31,35)/t20-,21+,28+/m0/s1	ZMKYSZODYJXXSG-BALWLHIASA-N	583.235221244							119754
BRD-K45415253	LSM-31199		54619118	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22+,27+/m0/s1	UXOYYOHZEHALJU-OREGWCPLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc3ncc(cc3C1=O)C#CC4CCCCC4	BroadT	BRD-K45415253	BRD-K45415253-001-01-4	Broad Institute of MIT and Harvard	BRD-K45415253			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccn2)Oc2ncc(cc2C1=O)C#CC1CCCCC1	InChI=1S/C30H38N4O4/c1-21-18-34(22(2)20-35)30(37)26-15-24(13-12-23-9-5-4-6-10-23)17-32-29(26)38-27(21)19-33(3)28(36)16-25-11-7-8-14-31-25/h7-8,11,14-15,17,21-23,27,35H,4-6,9-10,16,18-20H2,1-3H3/t21-,22+,27+/m0/s1	UXOYYOHZEHALJU-OREGWCPLSA-N	518.289305736							119755
BRD-K97620396	LSM-31200		54619002	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18+,23+/m0/s1	UTNRSLHBUZLCKT-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K97620396	BRD-K97620396-001-01-4	Broad Institute of MIT and Harvard	BRD-K97620396			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18+,23+/m0/s1	UTNRSLHBUZLCKT-YZZKKUAISA-N	471.273321314							119756
BRD-K72394925	LSM-31201		54619212	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22+,28-/m1/s1	YAJYINBQFXCAPI-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc3cc(ccc3S1(=O)=O)C#Cc4cccc(F)c4	BroadT	BRD-K72394925	BRD-K72394925-001-01-5	Broad Institute of MIT and Harvard	BRD-K72394925			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1	InChI=1S/C30H38FN3O5S/c1-21-18-34(22(2)20-35)40(37,38)29-15-14-24(13-12-23-8-7-9-25(31)16-23)17-27(29)39-28(21)19-33(3)30(36)32-26-10-5-4-6-11-26/h7-9,14-17,21-22,26,28,35H,4-6,10-11,18-20H2,1-3H3,(H,32,36)/t21-,22+,28-/m1/s1	YAJYINBQFXCAPI-RZIGYZOXSA-N	571.251620236							119757
BRD-K27011412	LSM-44336		54619256	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19+,23-/m1/s1	BEUJQTDXAJTLJD-XPKHAYSGSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K27011412	BRD-K27011412-001-01-1	Broad Institute of MIT and Harvard	BRD-K27011412			C\C=C\c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C25H32N2O5S/c1-5-9-20-12-13-24-22(14-20)32-23(16-26(4)25(29)21-10-7-6-8-11-21)18(2)15-27(19(3)17-28)33(24,30)31/h5-14,18-19,23,28H,15-17H2,1-4H3/b9-5+/t18-,19+,23-/m1/s1	BEUJQTDXAJTLJD-XPKHAYSGSA-N	472.203192834							
BRD-K05586628	LSM-31203		54619204	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19-,22-/m1/s1	ZBLNAKCVTQSUGS-WOIUINJBSA-N	COCC#Cc1cnc2O[C@H](CN(C)C(=O)CN3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	BroadT	BRD-K05586628	BRD-K05586628-001-01-8	Broad Institute of MIT and Harvard	BRD-K05586628			COCC#Cc1cnc2O[C@H](CN(C)C(=O)CN3CCOCC3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1	InChI=1S/C25H36N4O6/c1-18-14-29(19(2)17-30)25(32)21-12-20(6-5-9-33-4)13-26-24(21)35-22(18)15-27(3)23(31)16-28-7-10-34-11-8-28/h12-13,18-19,22,30H,7-11,14-17H2,1-4H3/t18-,19-,22-/m1/s1	ZBLNAKCVTQSUGS-WOIUINJBSA-N	488.263484912							119759
BRD-K36340167	LSM-31204		54619108	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21-,28+/m1/s1	CBIJUIOTIYQLMH-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C(=O)N(C)C	BroadT	BRD-K36340167	BRD-K36340167-001-01-0	Broad Institute of MIT and Harvard	BRD-K36340167			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2F)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C(=O)N(C)C	InChI=1S/C31H37FN4O6S/c1-20-17-36(21(2)19-37)43(40,41)29-15-14-24(22-10-12-23(13-11-22)30(38)34(3)4)16-27(29)42-28(20)18-35(5)31(39)33-26-9-7-6-8-25(26)32/h6-16,20-21,28,37H,17-19H2,1-5H3,(H,33,39)/t20-,21-,28+/m1/s1	CBIJUIOTIYQLMH-CJYOKPGZSA-N	612.241783834							119760
BRD-K02375958	LSM-15099		54619056	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28-/m1/s1	PEEJAUXHJGOSQX-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc3cc(ccc3S1(=O)=O)c4ccc(cc4)C#N	BroadT	BRD-K02375958	BRD-K02375958-001-01-9	Broad Institute of MIT and Harvard	BRD-K02375958			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)Oc2cc(ccc2S1(=O)=O)-c1ccc(cc1)C#N	InChI=1S/C29H32FN3O4S/c1-20-16-33(21(2)19-34)38(35,36)29-12-11-25(24-9-7-22(15-31)8-10-24)14-27(29)37-28(20)18-32(3)17-23-5-4-6-26(30)13-23/h4-14,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28-/m1/s1	PEEJAUXHJGOSQX-PHVLTXCSSA-N	537.209755424							103755
BRD-K46401136	LSM-44337		54619284	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19-,23+/m0/s1	PJAYKLYFYLNPHZ-UTRJGMHOSA-N	C\C=C\c1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	BroadT	BRD-K46401136	BRD-K46401136-001-01-6	Broad Institute of MIT and Harvard	BRD-K46401136			C\C=C\c1ccc2c(O[C@H](CN(C)CC3CCOCC3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1	InChI=1S/C24H38N2O5S/c1-5-6-20-7-8-24-22(13-20)31-23(16-25(4)15-21-9-11-30-12-10-21)18(2)14-26(19(3)17-27)32(24,28)29/h5-8,13,18-19,21,23,27H,9-12,14-17H2,1-4H3/b6-5+/t18-,19-,23+/m0/s1	PJAYKLYFYLNPHZ-UTRJGMHOSA-N	466.250143026							
BRD-K60751806	LSM-31206		54619086	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18-,23+/m0/s1	UTNRSLHBUZLCKT-IUKKYPGJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc3ncc(cc3C1=O)C4=CCCC4	BroadT	BRD-K60751806	BRD-K60751806-001-01-4	Broad Institute of MIT and Harvard	BRD-K60751806			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C1=CCCC1	InChI=1S/C26H37N3O5/c1-17-14-29(18(2)16-30)26(32)22-12-21(19-6-4-5-7-19)13-27-24(22)34-23(17)15-28(3)25(31)20-8-10-33-11-9-20/h6,12-13,17-18,20,23,30H,4-5,7-11,14-16H2,1-3H3/t17-,18-,23+/m0/s1	UTNRSLHBUZLCKT-IUKKYPGJSA-N	471.273321314							119762
AC1NPIQ0	LSM-31207	BRD-K54100265	5159025	InChI=1S/C22H25N5O2/c1-3-27-16(2)24-20-14-18(6-9-21(20)27)22(28)25-23-15-17-4-7-19(8-5-17)26-10-12-29-13-11-26/h4-9,14-15H,3,10-13H2,1-2H3,(H,25,28)	KCLNYCJMIPWOSG-UHFFFAOYSA-N	CCn1c(C)nc2cc(ccc12)C(=O)NN=Cc3ccc(cc3)N4CCOCC4	BroadT	BRD-K54100265	BRD-K54100265-001-05-7	Enamine Ltd.	T0516-7610			CCn1c(C)nc2cc(ccc12)C(=O)NN=Cc1ccc(cc1)N1CCOCC1	InChI=1S/C22H25N5O2/c1-3-27-16(2)24-20-14-18(6-9-21(20)27)22(28)25-23-15-17-4-7-19(8-5-17)26-10-12-29-13-11-26/h4-9,14-15H,3,10-13H2,1-2H3,(H,25,28)	KCLNYCJMIPWOSG-UHFFFAOYSA-N	391.20082509							119763
SMR000107513	LSM-31208	BRD-A64849281, SID26668839, SID7978445	2908945	InChI=1S/C26H27FN6O2/c1-16-23-24(21(14-28)25(29)35-26(23)31-30-16)17-3-8-22(34-2)18(13-17)15-32-9-11-33(12-10-32)20-6-4-19(27)5-7-20/h3-8,13,24H,9-12,15,29H2,1-2H3,(H,30,31)	RMRMZYPGKLMUFK-UHFFFAOYSA-N	COc1ccc(cc1CN2CCN(CC2)c3ccc(F)cc3)C4C(=C(N)Oc5[nH]nc(C)c45)C#N	BroadT	BRD-A64849281	BRD-A64849281-001-06-7	ChemBridge Corporation	6660053			COc1ccc(cc1CN1CCN(CC1)c1ccc(F)cc1)C1c2c(C)n[nH]c2OC(N)=C1C#N	InChI=1S/C26H27FN6O2/c1-16-23-24(21(14-28)25(29)35-26(23)31-30-16)17-3-8-22(34-2)18(13-17)15-32-9-11-33(12-10-32)20-6-4-19(27)5-7-20/h3-8,13,24H,9-12,15,29H2,1-2H3,(H,30,31)	RMRMZYPGKLMUFK-UHFFFAOYSA-N	474.217952364							119764
MLS000698064	LSM-31209	BRD-K13445266, SID22413492	844740	InChI=1S/C14H14BrN3O/c1-9-12(15)13(17(2)16-9)14(19)18-8-7-10-5-3-4-6-11(10)18/h3-6H,7-8H2,1-2H3	SDCXDURISJTESF-UHFFFAOYSA-N	Cc1nn(C)c(C(=O)N2CCc3ccccc23)c1Br	BroadT	BRD-K13445266	BRD-K13445266-001-06-3	Specs	AK-968/41926782			Cc1nn(C)c(C(=O)N2CCc3ccccc23)c1Br	InChI=1S/C14H14BrN3O/c1-9-12(15)13(17(2)16-9)14(19)18-8-7-10-5-3-4-6-11(10)18/h3-6H,7-8H2,1-2H3	SDCXDURISJTESF-UHFFFAOYSA-N	319.032024698							119765
CHEMDIV1_027257	LSM-31210	BRD-A36428246	3366541	InChI=1S/C21H20N4O3S/c1-13-3-2-10-24(12-13)19-18(14-4-8-16(9-5-14)25(27)28)17(11-22)20(29)23-21(19,26)15-6-7-15/h2-5,8-10,12,15,18-19,23,26H,6-7H2,1H3/p+1	NTWXZQUNPKISHY-UHFFFAOYSA-O	Cc1ccc[n+](c1)C2C(C(=C(S)NC2(O)C3CC3)C#N)c4ccc(cc4)[N+](=O)[O-]	BroadT	BRD-A36428246	BRD-A36428246-001-05-1	ChemDiv Inc.	8001-1531			Cc1ccc[n+](c1)C1C(c2ccc(cc2)[N+]([O-])=O)C(C#N)=C(S)NC1(O)C1CC1	InChI=1S/C21H20N4O3S/c1-13-3-2-10-24(12-13)19-18(14-4-8-16(9-5-14)25(27)28)17(11-22)20(29)23-21(19,26)15-6-7-15/h2-5,8-10,12,15,18-19,23,26H,6-7H2,1H3/p+1	NTWXZQUNPKISHY-UHFFFAOYSA-O	409.133436262							119766
MLS001126280	LSM-31211	BRD-A27056524, SID24400348, SID49724018	16021974	InChI=1S/C25H26N4O4/c1-16-10-11-20-19(13-16)22-23(27(20)2)24(31)29(17-7-4-3-5-8-17)25(32)28(22)15-21(30)26-14-18-9-6-12-33-18/h3-5,7-8,10-11,13,18H,6,9,12,14-15H2,1-2H3,(H,26,30)	FGROBDPEVPAEOQ-UHFFFAOYSA-N	Cc1ccc2c(c1)c3N(CC(=O)NCC4CCCO4)C(=O)N(C(=O)c3n2C)c5ccccc5	BroadT	BRD-A27056524	BRD-A27056524-001-05-4	ChemDiv Inc.	E737-0495			Cc1ccc2n(C)c3c(n(CC(=O)NCC4CCCO4)c(=O)n(-c4ccccc4)c3=O)c2c1	InChI=1S/C25H26N4O4/c1-16-10-11-20-19(13-16)22-23(27(20)2)24(31)29(17-7-4-3-5-8-17)25(32)28(22)15-21(30)26-14-18-9-6-12-33-18/h3-5,7-8,10-11,13,18H,6,9,12,14-15H2,1-2H3,(H,26,30)	FGROBDPEVPAEOQ-UHFFFAOYSA-N	446.195405352							119767
MLS000409278	LSM-31212	SID24791843, BRD-K71414336	4878046	InChI=1S/C19H21N5O3S2/c1-13(25)20-15-9-7-14(8-10-15)18-12-28-19(23-22-18)21-16-5-4-6-17(11-16)29(26,27)24(2)3/h4-11H,12H2,1-3H3,(H,20,25)(H,21,23)	FRWUUIXIPUZZSW-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cccc(NC2=NN=C(CS2)c3ccc(NC(=O)C)cc3)c1	BroadT	BRD-K71414336	BRD-K71414336-001-05-6	Enamine Ltd.	T5308192			CN(C)S(=O)(=O)c1cccc(NC2=NN=C(CS2)c2ccc(NC(C)=O)cc2)c1	InChI=1S/C19H21N5O3S2/c1-13(25)20-15-9-7-14(8-10-15)18-12-28-19(23-22-18)21-16-5-4-6-17(11-16)29(26,27)24(2)3/h4-11H,12H2,1-3H3,(H,20,25)(H,21,23)	FRWUUIXIPUZZSW-UHFFFAOYSA-N	431.108580962							119768
T5281433	LSM-44338	SID24791203, BRD-K29771129	5787451	InChI=1S/C19H21N3O7/c1-21-17(20)16(18(25)22(2)19(21)26)13(23)10-29-15(24)8-6-11-5-7-12(27-3)9-14(11)28-4/h5-9H,10,20H2,1-4H3/b8-6+	WAFUPYSATWFWHR-SOFGYWHQSA-N	COc1ccc(\C=C\C(=O)OCC(=O)C2=C(N)N(C)C(=O)N(C)C2=O)c(OC)c1	BroadT	BRD-K29771129	BRD-K29771129-001-05-3	Enamine Ltd.	T5281433			COc1ccc(\C=C\C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(OC)c1	InChI=1S/C19H21N3O7/c1-21-17(20)16(18(25)22(2)19(21)26)13(23)10-29-15(24)8-6-11-5-7-12(27-3)9-14(11)28-4/h5-9H,10,20H2,1-4H3/b8-6+	WAFUPYSATWFWHR-SOFGYWHQSA-N	403.137950042							
MLS000583320	LSM-31214	BRD-K67809808, SID17506455	2972622	InChI=1S/C20H21N3O2/c1-20(2,3)17-8-4-15(5-9-17)12-22-13-19(21-14-22)16-6-10-18(11-7-16)23(24)25/h4-11,13-14H,12H2,1-3H3	OONQICAXMKRCAH-UHFFFAOYSA-N	CC(C)(C)c1ccc(Cn2cnc(c2)c3ccc(cc3)[N+](=O)[O-])cc1	BroadT	BRD-K67809808	BRD-K67809808-001-05-2	ChemBridge Corporation	7953222			CC(C)(C)c1ccc(Cn2cnc(c2)-c2ccc(cc2)[N+]([O-])=O)cc1	InChI=1S/C20H21N3O2/c1-20(2,3)17-8-4-15(5-9-17)12-22-13-19(21-14-22)16-6-10-18(11-7-16)23(24)25/h4-11,13-14H,12H2,1-3H3	OONQICAXMKRCAH-UHFFFAOYSA-N	335.163376942							119770
MLS000678991	LSM-31215	BRD-A71590475, SID24816559	5087076	InChI=1S/C20H24N4S/c1-14-5-7-15(8-6-14)18-13-19(24(22-18)20(25)21-2)16-9-11-17(12-10-16)23(3)4/h5-12,19H,13H2,1-4H3,(H,21,25)	DRGNTWYQJADYTL-UHFFFAOYSA-N	CN=C(S)N1N=C(CC1c2ccc(cc2)N(C)C)c3ccc(C)cc3	BroadT	BRD-A71590475	BRD-A71590475-001-05-6	Life Chemicals Inc.	F0769-0016			CN=C(S)N1N=C(CC1c1ccc(cc1)N(C)C)c1ccc(C)cc1	InChI=1S/C20H24N4S/c1-14-5-7-15(8-6-14)18-13-19(24(22-18)20(25)21-2)16-9-11-17(12-10-16)23(3)4/h5-12,19H,13H2,1-4H3,(H,21,25)	DRGNTWYQJADYTL-UHFFFAOYSA-N	352.172167498							119771
T0516-3016	LSM-31216	SID14745273, BRD-K89933563	2434594	InChI=1S/C21H22N2O4/c1-26-17-8-5-7-16(12-17)23-20(24)14-27-21(25)11-4-6-15-13-22-19-10-3-2-9-18(15)19/h2-3,5,7-10,12-13,22H,4,6,11,14H2,1H3,(H,23,24)	PZIRXMUAWSDESS-UHFFFAOYSA-N	COc1cccc(NC(=O)COC(=O)CCCc2c[nH]c3ccccc23)c1	BroadT	BRD-K89933563	BRD-K89933563-001-05-9	Enamine Ltd.	T0516-3016			COc1cccc(NC(=O)COC(=O)CCCc2c[nH]c3ccccc23)c1	InChI=1S/C21H22N2O4/c1-26-17-8-5-7-16(12-17)23-20(24)14-27-21(25)11-4-6-15-13-22-19-10-3-2-9-18(15)19/h2-3,5,7-10,12-13,22H,4,6,11,14H2,1H3,(H,23,24)	PZIRXMUAWSDESS-UHFFFAOYSA-N	366.157957204							119772
4-Chloro-n-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-benzamide	LSM-31217	SID843327, BRD-A13082766	645618	InChI=1S/C16H14ClNO3/c17-12-7-5-11(6-8-12)16(19)18-9-13-10-20-14-3-1-2-4-15(14)21-13/h1-8,13H,9-10H2,(H,18,19)	VQEGHBUQNBKNNQ-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)NCC2COc3ccccc3O2	BroadT	BRD-A13082766	BRD-A13082766-001-06-1	Asinex Ltd.	BAS 01914103			Clc1ccc(cc1)C(=O)NCC1COc2ccccc2O1	InChI=1S/C16H14ClNO3/c17-12-7-5-11(6-8-12)16(19)18-9-13-10-20-14-3-1-2-4-15(14)21-13/h1-8,13H,9-10H2,(H,18,19)	VQEGHBUQNBKNNQ-UHFFFAOYSA-N	303.066221028							119773
AC1MF6XX	LSM-31218	BRD-K86086888, SID24793111	2914707	InChI=1S/C16H23N3O/c1-2-3-8-15-13-7-5-4-6-12(13)14(11-17)16(19-15)18-9-10-20/h20H,2-10H2,1H3,(H,18,19)	HKUVCNAAVYKKAI-UHFFFAOYSA-N	CCCCc1nc(NCCO)c(C#N)c2CCCCc12	BroadT	BRD-K86086888	BRD-K86086888-001-06-5	ChemBridge Corporation	6807104			CCCCc1nc(NCCO)c(C#N)c2CCCCc12	InChI=1S/C16H23N3O/c1-2-3-8-15-13-7-5-4-6-12(13)14(11-17)16(19-15)18-9-10-20/h20H,2-10H2,1H3,(H,18,19)	HKUVCNAAVYKKAI-UHFFFAOYSA-N	273.184112386							119774
AC1LEKSW	LSM-31219	BRD-K53491881	687859	InChI=1S/C13H13N3O2/c1-9(11-4-3-6-14-8-11)15-16-13(17)12-5-7-18-10(12)2/h3-8H,1-2H3,(H,16,17)	XWVWSDQVXIXDPB-UHFFFAOYSA-N	CC(=NNC(=O)c1ccoc1C)c2cccnc2	BroadT	BRD-K53491881	BRD-K53491881-001-05-5	InterBioScreen Ltd.	STOCK3S-68070			CC(=NNC(=O)c1ccoc1C)c1cccnc1	InChI=1S/C13H13N3O2/c1-9(11-4-3-6-14-8-11)15-16-13(17)12-5-7-18-10(12)2/h3-8H,1-2H3,(H,16,17)	XWVWSDQVXIXDPB-UHFFFAOYSA-N	243.100776686							119775
BRD-A95970093	LSM-31220	BRD-A95970093		InChI=1S/C14H13F3N2O3/c15-14(16,17)12(21)8-5-3-6-10(8)18-19-13(22)9-4-1-2-7-11(9)20/h1-2,4,7-8,20H,3,5-6H2,(H,19,22)	KLNYWYJEFXGVNC-UHFFFAOYSA-N	Oc1ccccc1C(=O)NN=C2CCCC2C(=O)C(F)(F)F	BroadT	BRD-A95970093	BRD-A95970093-001-07-0	InterBioScreen Ltd.	STOCK2S-16519			Oc1ccccc1C(=O)NN=C1CCCC1C(=O)C(F)(F)F	InChI=1S/C14H13F3N2O3/c15-14(16,17)12(21)8-5-3-6-10(8)18-19-13(22)9-4-1-2-7-11(9)20/h1-2,4,7-8,20H,3,5-6H2,(H,19,22)	KLNYWYJEFXGVNC-UHFFFAOYSA-N	314.087826896							119776
4-(4-Chloro-phenyl)-5-p-tolyloxymethyl-4H-[1,2,4]triazole-3-thiol	LSM-31221	BRD-K11905754, SID47202938	769937	InChI=1S/C16H14ClN3OS/c1-11-2-8-14(9-3-11)21-10-15-18-19-16(22)20(15)13-6-4-12(17)5-7-13/h2-9H,10H2,1H3,(H,19,22)	DKWOJXUFYZVFNU-UHFFFAOYSA-N	Cc1ccc(OCc2nnc(S)n2c3ccc(Cl)cc3)cc1	BroadT	BRD-K11905754	BRD-K11905754-001-05-9	Asinex Ltd.	BAS 01256974			Cc1ccc(OCc2nnc(S)n2-c2ccc(Cl)cc2)cc1	InChI=1S/C16H14ClN3OS/c1-11-2-8-14(9-3-11)21-10-15-18-19-16(22)20(15)13-6-4-12(17)5-7-13/h2-9H,10H2,1H3,(H,19,22)	DKWOJXUFYZVFNU-UHFFFAOYSA-N	331.054610498							119777
AC1NSQEE	LSM-31222	BRD-K60662039, SID24810000	5338135	InChI=1S/C18H15N3O2/c1-2-21-14-10-6-3-7-11(14)16(22)15(18(21)23)17-19-12-8-4-5-9-13(12)20-17/h3-10,22H,2H2,1H3,(H,19,20)	BASIMYUONZEVGG-UHFFFAOYSA-N	CCN1C(=O)C(=C(O)c2ccccc12)c3nc4ccccc4[nH]3	BroadT	BRD-K60662039	BRD-K60662039-001-04-6	Asinex Ltd.	BAS 00141361			CCn1c2ccccc2c(O)c(-c2nc3ccccc3[nH]2)c1=O	InChI=1S/C18H15N3O2/c1-2-21-14-10-6-3-7-11(14)16(22)15(18(21)23)17-19-12-8-4-5-9-13(12)20-17/h3-10,22H,2H2,1H3,(H,19,20)	BASIMYUONZEVGG-UHFFFAOYSA-N	305.11642675							
262856-01-9	LSM-31223	BRD-K94427708, SID26727052	6797687	InChI=1S/C12H9Cl2NO3S/c1-2-18-12(17)9-10(16)15-11(19-9)7-4-3-6(13)5-8(7)14/h3-5,16H,2H2,1H3	REQSKIDVCSYJER-UHFFFAOYSA-N	CCOC(=O)c1sc(nc1O)c2ccc(Cl)cc2Cl	BroadT	BRD-K94427708	BRD-K94427708-001-05-1	Maybridge	SPB 02521			CCOC(=O)c1sc(nc1O)-c1ccc(Cl)cc1Cl	InChI=1S/C12H9Cl2NO3S/c1-2-18-12(17)9-10(16)15-11(19-9)7-4-3-6(13)5-8(7)14/h3-5,16H,2H2,1H3	REQSKIDVCSYJER-UHFFFAOYSA-N	316.968019268							
SMR000170987	LSM-31224	SID17507597, BRD-K15924535	1135561	InChI=1S/C25H27N5O3S2/c1-17-11-13-29(14-12-17)35(32,33)21-9-7-20(8-10-21)26-23(31)16-34-25-28-27-24-18(2)15-19-5-3-4-6-22(19)30(24)25/h3-10,15,17H,11-14,16H2,1-2H3,(H,26,31)	UODXGIVANRWFTM-UHFFFAOYSA-N	CC1CCN(CC1)S(=O)(=O)c2ccc(NC(=O)CSc3nnc4c(C)cc5ccccc5n34)cc2	BroadT	BRD-K15924535	BRD-K15924535-001-05-2	Asinex Ltd.	ASN 04480658			CC1CCN(CC1)S(=O)(=O)c1ccc(NC(=O)CSc2nnc3c(C)cc4ccccc4n23)cc1	InChI=1S/C25H27N5O3S2/c1-17-11-13-29(14-12-17)35(32,33)21-9-7-20(8-10-21)26-23(31)16-34-25-28-27-24-18(2)15-19-5-3-4-6-22(19)30(24)25/h3-10,15,17H,11-14,16H2,1-2H3,(H,26,31)	UODXGIVANRWFTM-UHFFFAOYSA-N	509.155531154							119780
AC1LFUHM	LSM-31225	BRD-K28853245	760177	InChI=1S/C16H19N3O2/c1-3-19(4-2)14-9-7-13(8-10-14)12-17-18-16(20)15-6-5-11-21-15/h5-12H,3-4H2,1-2H3,(H,18,20)	NUFJVJRIKWMAHU-UHFFFAOYSA-N	CCN(CC)c1ccc(C=NNC(=O)c2occc2)cc1	BroadT	BRD-K28853245	BRD-K28853245-001-05-9	ChemBridge Corporation	5276210			CCN(CC)c1ccc(C=NNC(=O)c2ccco2)cc1	InChI=1S/C16H19N3O2/c1-3-19(4-2)14-9-7-13(8-10-14)12-17-18-16(20)15-6-5-11-21-15/h5-12H,3-4H2,1-2H3,(H,18,20)	NUFJVJRIKWMAHU-UHFFFAOYSA-N	285.147726878							119781
SMR000026493	LSM-31226	BRD-A69648159, SID4251089, SID87340899	3244819	InChI=1S/C22H25N3O5S/c1-4-14(3)24-22(27)19-13-23-20-11-10-17(12-18(20)21(19)26)31(28,29)25-15-6-8-16(9-7-15)30-5-2/h6-14,25H,4-5H2,1-3H3,(H,23,26)(H,24,27)	LBCKGKHGGGKUBU-UHFFFAOYSA-N	CCOc1ccc(NS(=O)(=O)c2ccc3ncc(C(=O)NC(C)CC)c(O)c3c2)cc1	BroadT	BRD-A69648159	BRD-A69648159-001-05-9	ChemDiv Inc.	C385-0388			CCOc1ccc(NS(=O)(=O)c2ccc3ncc(C(=O)NC(C)CC)c(O)c3c2)cc1	InChI=1S/C22H25N3O5S/c1-4-14(3)24-22(27)19-13-23-20-11-10-17(12-18(20)21(19)26)31(28,29)25-15-6-8-16(9-7-15)30-5-2/h6-14,25H,4-5H2,1-3H3,(H,23,26)(H,24,27)	LBCKGKHGGGKUBU-UHFFFAOYSA-N	443.15149162							119782
STK292702	LSM-31227	BRD-K41331757, SID7972211	2225645	InChI=1S/C13H11NO4/c1-8-9(6-7-18-8)12(15)14-11-5-3-2-4-10(11)13(16)17/h2-7H,1H3,(H,14,15)(H,16,17)	MDRZZFBPVFJTIQ-UHFFFAOYSA-N	Cc1occc1C(=O)Nc2ccccc2C(=O)O	BroadT	BRD-K41331757	BRD-K41331757-001-06-7	ChemBridge Corporation	5929040			Cc1occc1C(=O)Nc1ccccc1C(O)=O	InChI=1S/C13H11NO4/c1-8-9(6-7-18-8)12(15)14-11-5-3-2-4-10(11)13(16)17/h2-7H,1H3,(H,14,15)(H,16,17)	MDRZZFBPVFJTIQ-UHFFFAOYSA-N	245.068807842							119783
MLS000674912	LSM-31228	BRD-K19245310, SID24795589	2185494	InChI=1S/C16H21N3O2S/c1-2-21-12-8-9-13-14(10-12)22-16(18-13)19-15(20)17-11-6-4-3-5-7-11/h8-11H,2-7H2,1H3,(H2,17,18,19,20)	QKSMMTXJKVNQMY-UHFFFAOYSA-N	CCOc1ccc2nc(NC(=O)NC3CCCCC3)sc2c1	BroadT	BRD-K19245310	BRD-K19245310-001-11-7	ChemBridge Corporation	7357653			CCOc1ccc2nc(NC(=O)NC3CCCCC3)sc2c1	InChI=1S/C16H21N3O2S/c1-2-21-12-8-9-13-14(10-12)22-16(18-13)19-15(20)17-11-6-4-3-5-7-11/h8-11H,2-7H2,1H3,(H2,17,18,19,20)	QKSMMTXJKVNQMY-UHFFFAOYSA-N	319.135447632							119784
T0517-3378	LSM-31229	BRD-K52735829, SID22402743	4045999	InChI=1S/C28H25ClN4O3S/c29-24-13-5-3-12-22(24)26-18-23(21-11-4-6-14-25(21)32-26)28(34)31-19-9-8-10-20(17-19)37(35,36)33-27-15-2-1-7-16-30-27/h3-6,8-14,17-18H,1-2,7,15-16H2,(H,30,33)(H,31,34)	HSFIJDNIFROEOJ-UHFFFAOYSA-N	Clc1ccccc1c2cc(C(=O)Nc3cccc(c3)S(=O)(=O)NC4=NCCCCC4)c5ccccc5n2	BroadT	BRD-K52735829	BRD-K52735829-001-05-1	Enamine Ltd.	T0517-3378			Clc1ccccc1-c1cc(C(=O)Nc2cccc(c2)S(=O)(=O)NC2=NCCCCC2)c2ccccc2n1	InChI=1S/C28H25ClN4O3S/c29-24-13-5-3-12-22(24)26-18-23(21-11-4-6-14-25(21)32-26)28(34)31-19-9-8-10-20(17-19)37(35,36)33-27-15-2-1-7-16-30-27/h3-6,8-14,17-18H,1-2,7,15-16H2,(H,30,33)(H,31,34)	HSFIJDNIFROEOJ-UHFFFAOYSA-N	532.1335891							119785
T5791939	LSM-31230	SID49681000, BRD-K83459401	6491564	InChI=1S/C17H17N3O2S2/c1-10-4-6-12(7-5-10)18-14(21)9-23-17-19-15-13(8-11(2)24-15)16(22)20(17)3/h4-8H,9H2,1-3H3,(H,18,21)	ABBQHFLHBVNVMX-UHFFFAOYSA-N	CN1C(=Nc2sc(C)cc2C1=O)SCC(=O)Nc3ccc(C)cc3	BroadT	BRD-K83459401	BRD-K83459401-001-05-7	Asinex Ltd.	ASN 12344219			Cc1cc2c(nc(SCC(=O)Nc3ccc(C)cc3)n(C)c2=O)s1	InChI=1S/C17H17N3O2S2/c1-10-4-6-12(7-5-10)18-14(21)9-23-17-19-15-13(8-11(2)24-15)16(22)20(17)3/h4-8H,9H2,1-3H3,(H,18,21)	ABBQHFLHBVNVMX-UHFFFAOYSA-N	359.076218194							119786
MLS000707906	LSM-31231	SID24807743, BRD-K39081386	1451433	InChI=1S/C15H19N3O2S/c1-15(2,3)11-7-5-10(6-8-11)13-17-18-14(21-13)16-12(19)9-20-4/h5-8H,9H2,1-4H3,(H,16,18,19)	HXEITSCBQYERQP-UHFFFAOYSA-N	COCC(=O)Nc1nnc(s1)c2ccc(cc2)C(C)(C)C	BroadT	BRD-K39081386	BRD-K39081386-001-05-3	Asinex Ltd.	ASN 05667144			COCC(=O)Nc1nnc(s1)-c1ccc(cc1)C(C)(C)C	InChI=1S/C15H19N3O2S/c1-15(2,3)11-7-5-10(6-8-11)13-17-18-14(21-13)16-12(19)9-20-4/h5-8H,9H2,1-4H3,(H,16,18,19)	HXEITSCBQYERQP-UHFFFAOYSA-N	305.119797568							119787
AC1LH2R5	LSM-31232	BRD-K23062575	831221	InChI=1S/C16H16N4O5/c21-16(13-3-1-2-4-14(13)20(22)23)18-17-11-12-5-6-15(25-12)19-7-9-24-10-8-19/h1-6,11H,7-10H2,(H,18,21)	GTFMHBZLVDXJST-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1C(=O)NN=Cc2oc(cc2)N3CCOCC3	BroadT	BRD-K23062575	BRD-K23062575-001-05-2	Specs	AG-205/33133006			[O-][N+](=O)c1ccccc1C(=O)NN=Cc1ccc(o1)N1CCOCC1	InChI=1S/C16H16N4O5/c21-16(13-3-1-2-4-14(13)20(22)23)18-17-11-12-5-6-15(25-12)19-7-9-24-10-8-19/h1-6,11H,7-10H2,(H,18,21)	GTFMHBZLVDXJST-UHFFFAOYSA-N	344.112069652							119788
Reticuline N-Oxide	LSM-4485	BRD-A82394575, SID26725290	13020032	InChI=1S/C19H23NO5/c1-20(23)7-6-13-10-19(25-3)17(22)11-14(13)15(20)8-12-4-5-18(24-2)16(21)9-12/h4-5,9-11,15,21-22H,6-8H2,1-3H3/t15-,20?/m0/s1	JLMWCKYUUMRSRK-OOJLDXBWSA-N	COc1ccc(C[C@H]2c3cc(O)c(OC)cc3CC[N+]2(C)[O-])cc1O	BroadT	BRD-A82394575	BRD-A82394575-001-06-7	University of North Carolina at Chapel Hill	Reticuline N-oxide LL-54			COc1ccc(C[C@H]2c3cc(O)c(OC)cc3CC[N+]2(C)[O-])cc1O	InChI=1S/C19H23NO5/c1-20(23)7-6-13-10-19(25-3)17(22)11-14(13)15(20)8-12-4-5-18(24-2)16(21)9-12/h4-5,9-11,15,21-22H,6-8H2,1-3H3/t15-,20?/m0/s1	JLMWCKYUUMRSRK-OOJLDXBWSA-N	345.157622846							93907
AC1OB3FX	LSM-44339	BRD-K11307720	6871884	InChI=1S/C19H14N2O5S2/c22-14-7-3-1-6-13(14)10-20-21-18(25)16(28-19(21)27)9-12-5-2-4-8-15(12)26-11-17(23)24/h1-10,22H,11H2,(H,23,24)/b16-9-,20-10?	CRDWIYRLVMASMZ-LOXCBTPESA-N	OC(=O)COc1ccccc1\C=C\2/SC(=S)N(N=Cc3ccccc3O)C2=O	BroadT	BRD-K11307720	BRD-K11307720-001-05-9	Specs	AG-690/11629266			OC(=O)COc1ccccc1\C=C1/SC(=S)N(N=Cc2ccccc2O)C1=O	InChI=1S/C19H14N2O5S2/c22-14-7-3-1-6-13(14)10-20-21-18(25)16(28-19(21)27)9-12-5-2-4-8-15(12)26-11-17(23)24/h1-10,22H,11H2,(H,23,24)/b16-9-,20-10?	CRDWIYRLVMASMZ-LOXCBTPESA-N	414.034412948							
MLS000569768	LSM-31234	BRD-K47631316, SID14743942	2425146	InChI=1S/C19H19N3O5S2/c1-26-14-5-6-16-17(12-14)28-19(20-16)21-18(23)13-3-2-4-15(11-13)29(24,25)22-7-9-27-10-8-22/h2-6,11-12H,7-10H2,1H3,(H,20,21,23)	GRPFFRUWJFDTTI-UHFFFAOYSA-N	COc1ccc2nc(NC(=O)c3cccc(c3)S(=O)(=O)N4CCOCC4)sc2c1	BroadT	BRD-K47631316	BRD-K47631316-001-06-8	Enamine Ltd.	T5220513			COc1ccc2nc(NC(=O)c3cccc(c3)S(=O)(=O)N3CCOCC3)sc2c1	InChI=1S/C19H19N3O5S2/c1-26-14-5-6-16-17(12-14)28-19(20-16)21-18(23)13-3-2-4-15(11-13)29(24,25)22-7-9-27-10-8-22/h2-6,11-12H,7-10H2,1H3,(H,20,21,23)	GRPFFRUWJFDTTI-UHFFFAOYSA-N	433.076612118							119790
MLS000673751	LSM-31235	BRD-K94037108, SID24804050	5348940	InChI=1S/C11H9N5O/c1-7-10(11(17)16-13-7)15-14-9-5-3-2-4-8(9)6-12/h2-5H,1H3,(H2,13,16,17)	HCBZDKLRXHEABD-UHFFFAOYSA-N	Cc1n[nH]c(O)c1N=Nc2ccccc2C#N	BroadT	BRD-K94037108	BRD-K94037108-001-04-7	ChemBridge Corporation	6175236			Cc1n[nH]c(O)c1N=Nc1ccccc1C#N	InChI=1S/C11H9N5O/c1-7-10(11(17)16-13-7)15-14-9-5-3-2-4-8(9)6-12/h2-5H,1H3,(H2,13,16,17)	HCBZDKLRXHEABD-UHFFFAOYSA-N	227.080709958							
ZINC04974057	LSM-44340	SID24784297, BRD-K15343767	2263078	InChI=1S/C17H12N2O4/c18-9-12(17(21)19-13-2-4-14(20)5-3-13)7-11-1-6-15-16(8-11)23-10-22-15/h1-8,20H,10H2,(H,19,21)/b12-7-	GRVPLNXGNWRXNH-GHXNOFRVSA-N	Oc1ccc(NC(=O)\C(=C/c2ccc3OCOc3c2)\C#N)cc1	BroadT	BRD-K15343767	BRD-K15343767-001-06-2	Asinex Ltd.	BAS 01976362			Oc1ccc(NC(=O)C(=C/c2ccc3OCOc3c2)\C#N)cc1	InChI=1S/C17H12N2O4/c18-9-12(17(21)19-13-2-4-14(20)5-3-13)7-11-1-6-15-16(8-11)23-10-22-15/h1-8,20H,10H2,(H,19,21)/b12-7-	GRVPLNXGNWRXNH-GHXNOFRVSA-N	308.079706884							
F2019-0815	LSM-15437	BRD-K82839033	24892414	InChI=1S/C30H34N4O3S2/c1-4-22-12-17-26-28(21-22)38-30(31-26)33(19-8-18-32(2)3)29(35)24-13-15-25(16-14-24)39(36,37)34-20-7-10-23-9-5-6-11-27(23)34/h5-6,9,11-17,21H,4,7-8,10,18-20H2,1-3H3	WXUASCZMBUYHBV-UHFFFAOYSA-N	CCc1ccc2nc(sc2c1)N(CCCN(C)C)C(=O)c3ccc(cc3)S(=O)(=O)N4CCCc5ccccc45	BroadT	BRD-K82839033	BRD-K82839033-003-08-7	Life Chemicals Inc.	F2019-0815		Cl	CCc1ccc2nc(sc2c1)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N1CCCc2ccccc12.Cl	InChI=1S/C30H34N4O3S2.ClH/c1-4-22-12-17-26-28(21-22)38-30(31-26)33(19-8-18-32(2)3)29(35)24-13-15-25(16-14-24)39(36,37)34-20-7-10-23-9-5-6-11-27(23)34;/h5-6,9,11-17,21H,4,7-8,10,18-20H2,1-3H3;1H	XMDFKTGGHXSXLD-UHFFFAOYSA-N	562.207232368							104079, 104079
SMR000031906	LSM-31237	BRD-K39396484, SID4245104	3239612	InChI=1S/C23H23ClN2O6S/c1-15-19-14-18(33(28,29)26-9-7-23(8-10-26)30-11-12-31-23)5-6-20(19)32-21(15)22(27)25-17-4-2-3-16(24)13-17/h2-6,13-14H,7-12H2,1H3,(H,25,27)	XDUJAEWHWWAHGJ-UHFFFAOYSA-N	Cc1c(oc2ccc(cc12)S(=O)(=O)N3CCC4(CC3)OCCO4)C(=O)Nc5cccc(Cl)c5	BroadT	BRD-K39396484	BRD-K39396484-001-05-6	ChemDiv Inc.	K786-1413			Cc1c(oc2ccc(cc12)S(=O)(=O)N1CCC2(CC1)OCCO2)C(=O)Nc1cccc(Cl)c1	InChI=1S/C23H23ClN2O6S/c1-15-19-14-18(33(28,29)26-9-7-23(8-10-26)30-11-12-31-23)5-6-20(19)32-21(15)22(27)25-17-4-2-3-16(24)13-17/h2-6,13-14H,7-12H2,1H3,(H,25,27)	XDUJAEWHWWAHGJ-UHFFFAOYSA-N	490.096534876							119793
CDS1_001529	LSM-31238	BRD-K13091682	3768734	InChI=1S/C22H17ClFN3O/c1-15-4-3-11-27-20(13-25-28-14-16-5-2-6-19(24)12-16)21(26-22(15)27)17-7-9-18(23)10-8-17/h2-13H,14H2,1H3	KDYRYTYEZDBVKN-UHFFFAOYSA-N	Cc1cccn2c(C=NOCc3cccc(F)c3)c(nc12)c4ccc(Cl)cc4	BroadT	BRD-K13091682	BRD-K13091682-001-06-1	Key Organics Ltd.	8P-680S			Cc1cccn2c(C=NOCc3cccc(F)c3)c(nc12)-c1ccc(Cl)cc1	InChI=1S/C22H17ClFN3O/c1-15-4-3-11-27-20(13-25-28-14-16-5-2-6-19(24)12-16)21(26-22(15)27)17-7-9-18(23)10-8-17/h2-13H,14H2,1H3	KDYRYTYEZDBVKN-UHFFFAOYSA-N	393.104418104							119794
AC1NEXBU	LSM-15438	BRD-A45014336	4624615	InChI=1S/C19H26N2O4/c1-3-20-6-8-21(9-7-20)12-15(22)13-24-16-4-5-17-14(2)10-19(23)25-18(17)11-16/h4-5,10-11,15,22H,3,6-9,12-13H2,1-2H3	CLDQJIAOGPECPO-UHFFFAOYSA-N	CCN1CCN(CC(O)COc2ccc3C(=CC(=O)Oc3c2)C)CC1	BroadT	BRD-A45014336	BRD-A45014336-003-06-3	Enamine Ltd.	T0512-7587		Cl	CCN1CCN(CC(O)COc2ccc3c(C)cc(=O)oc3c2)CC1.Cl	InChI=1S/C19H26N2O4.ClH/c1-3-20-6-8-21(9-7-20)12-15(22)13-24-16-4-5-17-14(2)10-19(23)25-18(17)11-16;/h4-5,10-11,15,22H,3,6-9,12-13H2,1-2H3;1H	KQUFFRCTFITWSP-UHFFFAOYSA-N	346.189257332							104080, 104080
N-[2-(1H-Benzimidazol-2-yl)ethyl]-3,5-dinitrobenzamide	LSM-31239	BRD-K80233876, SID17511466	1556384	InChI=1S/C16H13N5O5/c22-16(10-7-11(20(23)24)9-12(8-10)21(25)26)17-6-5-15-18-13-3-1-2-4-14(13)19-15/h1-4,7-9H,5-6H2,(H,17,22)(H,18,19)	XHFWWPFWSUJCDP-UHFFFAOYSA-N	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NCCc2nc3ccccc3[nH]2	BroadT	BRD-K80233876	BRD-K80233876-001-05-5	InterBioScreen Ltd.	STOCK2S-64835			[O-][N+](=O)c1cc(cc(c1)[N+]([O-])=O)C(=O)NCCc1nc2ccccc2[nH]1	InChI=1S/C16H13N5O5/c22-16(10-7-11(20(23)24)9-12(8-10)21(25)26)17-6-5-15-18-13-3-1-2-4-14(13)19-15/h1-4,7-9H,5-6H2,(H,17,22)(H,18,19)	XHFWWPFWSUJCDP-UHFFFAOYSA-N	355.091668566							119795
1-(Cyclohexylmethyl)-4-phenylpiperazine	LSM-31240	SID47198640, BRD-K12359218	743404	InChI=1S/C17H26N2/c1-3-7-16(8-4-1)15-18-11-13-19(14-12-18)17-9-5-2-6-10-17/h2,5-6,9-10,16H,1,3-4,7-8,11-15H2	PMEZNKKHVUVRIR-UHFFFAOYSA-N	C(C1CCCCC1)N2CCN(CC2)c3ccccc3	BroadT	BRD-K12359218	BRD-K12359218-001-07-4	ChemBridge Corporation	5428004			C(C1CCCCC1)N1CCN(CC1)c1ccccc1	InChI=1S/C17H26N2/c1-3-7-16(8-4-1)15-18-11-13-19(14-12-18)17-9-5-2-6-10-17/h2,5-6,9-10,16H,1,3-4,7-8,11-15H2	PMEZNKKHVUVRIR-UHFFFAOYSA-N	258.209598852							119796
7W-0342	LSM-31241	BRD-K69872823	1485631	InChI=1S/C11H12N4O4/c1-3-19-10(18)7-5-12-11(13-9(7)17)15-8(16)4-6(2)14-15/h4-5,16H,3H2,1-2H3,(H,12,13,17)	LOLAYERTFOYXRJ-UHFFFAOYSA-N	CCOC(=O)c1cnc(nc1O)n2nc(C)cc2O	BroadT	BRD-K69872823	BRD-K69872823-001-05-9	Key Organics Ltd.	7W-0342			CCOC(=O)c1cnc(nc1O)-n1nc(C)cc1O	InChI=1S/C11H12N4O4/c1-3-19-10(18)7-5-12-11(13-9(7)17)15-8(16)4-6(2)14-15/h4-5,16H,3H2,1-2H3,(H,12,13,17)	LOLAYERTFOYXRJ-UHFFFAOYSA-N	264.085854904							
T5234985	LSM-31242	BRD-K39794286, SID26670095	2100932	InChI=1S/C13H10BrN3O5/c14-8-3-1-2-4-9(8)16-10(18)6-22-12(20)7-5-15-13(21)17-11(7)19/h1-5H,6H2,(H,16,18)(H2,15,17,19,21)	CEHDVRLOYYUQEZ-UHFFFAOYSA-N	Oc1ncc(C(=O)OCC(=O)Nc2ccccc2Br)c(O)n1	BroadT	BRD-K39794286	BRD-K39794286-001-06-0	Enamine Ltd.	T5234985			Oc1ncc(C(=O)OCC(=O)Nc2ccccc2Br)c(O)n1	InChI=1S/C13H10BrN3O5/c14-8-3-1-2-4-9(8)16-10(18)6-22-12(20)7-5-15-13(21)17-11(7)19/h1-5H,6H2,(H,16,18)(H2,15,17,19,21)	CEHDVRLOYYUQEZ-UHFFFAOYSA-N	366.98038305							119798
SMR000130961	LSM-31243	BRD-K08174111, SID14732254	9550241	InChI=1S/C21H20N2O2/c1-22(15-17-9-4-2-5-10-17)20(24)16-23-14-8-13-19(23)21(25)18-11-6-3-7-12-18/h2-14H,15-16H2,1H3	MMTSMGPWDUNAGV-UHFFFAOYSA-N	CN(Cc1ccccc1)C(=O)Cn2cccc2C(=O)c3ccccc3	BroadT	BRD-K08174111	BRD-K08174111-001-05-5	ChemDiv Inc.	C856-0241			CN(Cc1ccccc1)C(=O)Cn1cccc1C(=O)c1ccccc1	InChI=1S/C21H20N2O2/c1-22(15-17-9-4-2-5-10-17)20(24)16-23-14-8-13-19(23)21(25)18-11-6-3-7-12-18/h2-14H,15-16H2,1H3	MMTSMGPWDUNAGV-UHFFFAOYSA-N	332.1524779							119799
MLS000111394	LSM-31244	BRD-K37379978, SID7972019	747934	InChI=1S/C14H14ClNO3S/c1-9-8-12(10(2)13(15)14(9)17)16-20(18,19)11-6-4-3-5-7-11/h3-8,16-17H,1-2H3	SDSUWSPCHAFZNZ-UHFFFAOYSA-N	Cc1cc(NS(=O)(=O)c2ccccc2)c(C)c(Cl)c1O	BroadT	BRD-K37379978	BRD-K37379978-001-06-5	ChemBridge Corporation	6631349			Cc1cc(NS(=O)(=O)c2ccccc2)c(C)c(Cl)c1O	InChI=1S/C14H14ClNO3S/c1-9-8-12(10(2)13(15)14(9)17)16-20(18,19)11-6-4-3-5-7-11/h3-8,16-17H,1-2H3	SDSUWSPCHAFZNZ-UHFFFAOYSA-N	311.038291718							119800
N-[[3-(4-Methoxyphenyl)-1-phenylpyrazol-4-yl]methylideneamino]benzenesulfonamide	LSM-31245	BRD-K16560691	1364036	InChI=1S/C23H20N4O3S/c1-30-21-14-12-18(13-15-21)23-19(17-27(25-23)20-8-4-2-5-9-20)16-24-26-31(28,29)22-10-6-3-7-11-22/h2-17,26H,1H3	LXKBZGWGSXHUIO-UHFFFAOYSA-N	COc1ccc(cc1)c2nn(cc2C=NNS(=O)(=O)c3ccccc3)c4ccccc4	BroadT	BRD-K16560691	BRD-K16560691-001-07-9	ChemBridge Corporation	5747571			COc1ccc(cc1)-c1nn(cc1C=NNS(=O)(=O)c1ccccc1)-c1ccccc1	InChI=1S/C23H20N4O3S/c1-30-21-14-12-18(13-15-21)23-19(17-27(25-23)20-8-4-2-5-9-20)16-24-26-31(28,29)22-10-6-3-7-11-22/h2-17,26H,1H3	LXKBZGWGSXHUIO-UHFFFAOYSA-N	432.12561123							119801
F0611-0609	LSM-31246	SID4248340, BRD-K47858507	3242428	InChI=1S/C18H24N2O3/c1-4-12(5-2)17(21)19-9-8-14-10-13-6-7-15(23-3)11-16(13)20-18(14)22/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,19,21)(H,20,22)	REMNSMNPGOVCLT-UHFFFAOYSA-N	CCC(CC)C(=O)NCCc1cc2ccc(OC)cc2nc1O	BroadT	BRD-K47858507	BRD-K47858507-001-05-8	ChemDiv Inc.	C279-0557			CCC(CC)C(=O)NCCc1cc2ccc(OC)cc2nc1O	InChI=1S/C18H24N2O3/c1-4-12(5-2)17(21)19-9-8-14-10-13-6-7-15(23-3)11-16(13)20-18(14)22/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,19,21)(H,20,22)	REMNSMNPGOVCLT-UHFFFAOYSA-N	316.178692648							119802
STK114999	LSM-31247	SID49641928, BRD-K92806245	1096453	InChI=1S/C17H16ClN3O/c1-21-15(12-5-3-2-4-6-12)11-20-17(21)19-10-13-9-14(18)7-8-16(13)22/h2-9,11,22H,10H2,1H3,(H,19,20)	DDKNQLXCEDHYBP-UHFFFAOYSA-N	Cn1c(NCc2cc(Cl)ccc2O)ncc1c3ccccc3	BroadT	BRD-K92806245	BRD-K92806245-001-05-8	Asinex Ltd.	BAS 11099827			Cn1c(NCc2cc(Cl)ccc2O)ncc1-c1ccccc1	InChI=1S/C17H16ClN3O/c1-21-15(12-5-3-2-4-6-12)11-20-17(21)19-10-13-9-14(18)7-8-16(13)22/h2-9,11,22H,10H2,1H3,(H,19,20)	DDKNQLXCEDHYBP-UHFFFAOYSA-N	313.098189872							119803
SMR000113360	LSM-44341	SID14727836, BRD-A64985224	9549693	InChI=1S/C16H18N2O3/c1-10(7-11(2)19)18-15(16(20)21)8-12-9-17-14-6-4-3-5-13(12)14/h3-7,9,15,17-18H,8H2,1-2H3,(H,20,21)/b10-7-	HEBNEQXWFBLWSC-YFHOEESVSA-N	CC(=O)\C=C(\C)/NC(Cc1c[nH]c2ccccc12)C(=O)O	BroadT	BRD-A64985224	BRD-A64985224-001-05-1	Specs	AG-690/33350051			CC(=O)\C=C(\C)NC(Cc1c[nH]c2ccccc12)C(O)=O	InChI=1S/C16H18N2O3/c1-10(7-11(2)19)18-15(16(20)21)8-12-9-17-14-6-4-3-5-13(12)14/h3-7,9,15,17-18H,8H2,1-2H3,(H,20,21)/b10-7-	HEBNEQXWFBLWSC-YFHOEESVSA-N	286.131742456							
5,6-Dimethyl-1-octyl-1H-1,3-benzimidazol-4-ylamine	LSM-31249	BRD-K65427501, SID17411451	5183036	InChI=1S/C17H27N3/c1-4-5-6-7-8-9-10-20-12-19-17-15(20)11-13(2)14(3)16(17)18/h11-12H,4-10,18H2,1-3H3	WRFSDGVWYLMDCA-UHFFFAOYSA-N	CCCCCCCCn1cnc2c(N)c(C)c(C)cc12	BroadT	BRD-K65427501	BRD-K65427501-001-05-5	Key Organics Ltd.	5J-367S			CCCCCCCCn1cnc2c(N)c(C)c(C)cc12	InChI=1S/C17H27N3/c1-4-5-6-7-8-9-10-20-12-19-17-15(20)11-13(2)14(3)16(17)18/h11-12H,4-10,18H2,1-3H3	WRFSDGVWYLMDCA-UHFFFAOYSA-N	273.220497894							119805
ZINC04387599	LSM-31250	BRD-K77354492, SID24788908	2929786	InChI=1S/C20H15N3O5/c1-22-19(27)14-6-5-12(10-15(14)20(22)28)21-18(26)11-3-2-4-13(9-11)23-16(24)7-8-17(23)25/h2-6,9-10H,7-8H2,1H3,(H,21,26)	VRCAFJHRQGTCBG-UHFFFAOYSA-N	CN1C(=O)c2ccc(NC(=O)c3cccc(c3)N4C(=O)CCC4=O)cc2C1=O	BroadT	BRD-K77354492	BRD-K77354492-001-05-8	ChemBridge Corporation	7188193			CN1C(=O)c2ccc(NC(=O)c3cccc(c3)N3C(=O)CCC3=O)cc2C1=O	InChI=1S/C20H15N3O5/c1-22-19(27)14-6-5-12(10-15(14)20(22)28)21-18(26)11-3-2-4-13(9-11)23-16(24)7-8-17(23)25/h2-6,9-10H,7-8H2,1H3,(H,21,26)	VRCAFJHRQGTCBG-UHFFFAOYSA-N	377.10117061							119806
STK091813	LSM-31251	BRD-K87385385, SID4259617	784721	InChI=1S/C17H17NO/c1-18-16-10-6-5-9-14(16)15(11-12-19)17(18)13-7-3-2-4-8-13/h2-10,19H,11-12H2,1H3	GVDVAPWUZYDSMV-UHFFFAOYSA-N	Cn1c(c(CCO)c2ccccc12)c3ccccc3	BroadT	BRD-K87385385	BRD-K87385385-001-05-0	ChemBridge Corporation	5107556			Cn1c(c(CCO)c2ccccc12)-c1ccccc1	InChI=1S/C17H17NO/c1-18-16-10-6-5-9-14(16)15(11-12-19)17(18)13-7-3-2-4-8-13/h2-10,19H,11-12H2,1H3	GVDVAPWUZYDSMV-UHFFFAOYSA-N	251.131014174							119807
ST041402	LSM-31252	BRD-K00083518	668499	InChI=1S/C18H21N5S/c1-18(2,3)14-9-7-13(8-10-14)16-20-21-17(24)23(16)19-12-15-6-5-11-22(15)4/h5-12H,1-4H3,(H,21,24)	GGKUFTYXGKDNBZ-UHFFFAOYSA-N	Cn1cccc1C=Nn2c(S)nnc2c3ccc(cc3)C(C)(C)C	BroadT	BRD-K00083518	BRD-K00083518-001-06-3	ChemBridge Corporation	6625797			Cn1cccc1C=Nn1c(S)nnc1-c1ccc(cc1)C(C)(C)C	InChI=1S/C18H21N5S/c1-18(2,3)14-9-7-13(8-10-14)16-20-21-17(24)23(16)19-12-15-6-5-11-22(15)4/h5-12H,1-4H3,(H,21,24)	GGKUFTYXGKDNBZ-UHFFFAOYSA-N	339.151766412							119808
ST50178897	LSM-44342	SID24791908, BRD-K50718861	2517760	InChI=1S/C16H11NO3/c18-15(19)9-7-11-6-8-14-13(10-11)16(20-17-14)12-4-2-1-3-5-12/h1-10H,(H,18,19)/b9-7+	FCMHXGNYHDXIPU-VQHVLOKHSA-N	OC(=O)\C=C\c1ccc2noc(c3ccccc3)c2c1	BroadT	BRD-K50718861	BRD-K50718861-001-06-6	Enamine Ltd.	T5333580			OC(=O)\C=C\c1ccc2noc(-c3ccccc3)c2c1	InChI=1S/C16H11NO3/c18-15(19)9-7-11-6-8-14-13(10-11)16(20-17-14)12-4-2-1-3-5-12/h1-10H,(H,18,19)/b9-7+	FCMHXGNYHDXIPU-VQHVLOKHSA-N	265.073893222							
F1420-0679	LSM-31254	BRD-K07496812, SID4265282, SID7971202	1296934	InChI=1S/C16H17N3O3S3/c1-3-19(4-2)25(21,22)11-7-8-12-14(10-11)24-16(17-12)18-15(20)13-6-5-9-23-13/h5-10H,3-4H2,1-2H3,(H,17,18,20)	OANLUKCMEUTECM-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc2nc(NC(=O)c3cccs3)sc2c1	BroadT	BRD-K07496812	BRD-K07496812-001-05-5	Life Chemicals Inc.	F1420-0679			CCN(CC)S(=O)(=O)c1ccc2nc(NC(=O)c3cccs3)sc2c1	InChI=1S/C16H17N3O3S3/c1-3-19(4-2)25(21,22)11-7-8-12-14(10-11)24-16(17-12)18-15(20)13-6-5-9-23-13/h5-10H,3-4H2,1-2H3,(H,17,18,20)	OANLUKCMEUTECM-UHFFFAOYSA-N	395.043203504							119810
AC1LQKDM	LSM-31255	BRD-K34815008, SID26670790, SID87544583	1402326	InChI=1S/C18H12Cl2N6S/c19-13-7-4-8-14(20)12(13)10-21-26-17(24-25-18(26)27)16-9-15(22-23-16)11-5-2-1-3-6-11/h1-10H,(H,22,23)(H,25,27)	FEXGDGJDKCAICW-UHFFFAOYSA-N	Sc1nnc(c2cc([nH]n2)c3ccccc3)n1N=Cc4c(Cl)cccc4Cl	BroadT	BRD-K34815008	BRD-K34815008-001-06-5	InterBioScreen Ltd.	STOCK5S-25186			Sc1nnc(-c2cc([nH]n2)-c2ccccc2)n1N=Cc1c(Cl)cccc1Cl	InChI=1S/C18H12Cl2N6S/c19-13-7-4-8-14(20)12(13)10-21-26-17(24-25-18(26)27)16-9-15(22-23-16)11-5-2-1-3-6-11/h1-10H,(H,22,23)(H,25,27)	FEXGDGJDKCAICW-UHFFFAOYSA-N	414.022120554							119811
MLS000778097	LSM-31256	BRD-K55815187, SID26671482	1926360	InChI=1S/C17H11BrClNO3/c18-9-5-6-14-11(7-9)16(10-3-1-2-4-13(10)19)12(8-15(21)22)17(23)20-14/h1-7H,8H2,(H,20,23)(H,21,22)	OUGAENAXKVEKBM-UHFFFAOYSA-N	OC(=O)Cc1c(O)nc2ccc(Br)cc2c1c3ccccc3Cl	BroadT	BRD-K55815187	BRD-K55815187-001-05-4	InterBioScreen Ltd.	STOCK2S-54978			OC(=O)Cc1c(O)nc2ccc(Br)cc2c1-c1ccccc1Cl	InChI=1S/C17H11BrClNO3/c18-9-5-6-14-11(7-9)16(10-3-1-2-4-13(10)19)12(8-15(21)22)17(23)20-14/h1-7H,8H2,(H,20,23)(H,21,22)	OUGAENAXKVEKBM-UHFFFAOYSA-N	390.961083532							119812
N'-(3-nitrobenzoyl)pyridine-2-carbohydrazide	LSM-31257	BRD-K83820627, SID24823877	3651410	InChI=1S/C13H10N4O4/c18-12(9-4-3-5-10(8-9)17(20)21)15-16-13(19)11-6-1-2-7-14-11/h1-8H,(H,15,18)(H,16,19)	AJGFPENPQSUXJX-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C(=O)NNC(=O)c2ccccn2	BroadT	BRD-K83820627	BRD-K83820627-001-05-8	ChemDiv Inc.	K781-2716			[O-][N+](=O)c1cccc(c1)C(=O)NNC(=O)c1ccccn1	InChI=1S/C13H10N4O4/c18-12(9-4-3-5-10(8-9)17(20)21)15-16-13(19)11-6-1-2-7-14-11/h1-8H,(H,15,18)(H,16,19)	AJGFPENPQSUXJX-UHFFFAOYSA-N	286.07020484							119813
GNF-PF-2718	LSM-31258	BRD-K77024507, GNF-PF-2718	16190103	InChI=1S/C20H23N3O2S/c1-23(14-17-12-13-26-15-17)20(24)11-10-19-22-21-18(25-19)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,12-13,15H,5,8-11,14H2,1H3	CRTYULCQVPKUPC-UHFFFAOYSA-N	CN(Cc1ccsc1)C(=O)CCc2oc(CCCc3ccccc3)nn2	BroadT	BRD-K77024507	BRD-K77024507-001-05-0	ChemBridge Corporation	91683016			CN(Cc1ccsc1)C(=O)CCc1nnc(CCCc2ccccc2)o1	InChI=1S/C20H23N3O2S/c1-23(14-17-12-13-26-15-17)20(24)11-10-19-22-21-18(25-19)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,12-13,15H,5,8-11,14H2,1H3	CRTYULCQVPKUPC-UHFFFAOYSA-N	369.151097696							119814
MLS000048858	LSM-31259	BRD-K04939366, SID3716719	2365088	InChI=1S/C17H15N3O3S/c21-16(10-24-17-19-12-3-1-2-4-13(12)20-17)18-11-5-6-14-15(9-11)23-8-7-22-14/h1-6,9H,7-8,10H2,(H,18,21)(H,19,20)	JKBYSPZCJCSSQW-UHFFFAOYSA-N	O=C(CSc1nc2ccccc2[nH]1)Nc3ccc4OCCOc4c3	BroadT	BRD-K04939366	BRD-K04939366-001-05-7	Enamine Ltd.	T0509-7637			O=C(CSc1nc2ccccc2[nH]1)Nc1ccc2OCCOc2c1	InChI=1S/C17H15N3O3S/c21-16(10-24-17-19-12-3-1-2-4-13(12)20-17)18-11-5-6-14-15(9-11)23-8-7-22-14/h1-6,9H,7-8,10H2,(H,18,21)(H,19,20)	JKBYSPZCJCSSQW-UHFFFAOYSA-N	341.08341206							119815
MLS000727499	LSM-31260	BRD-K11004561, SID24783063	1192552	InChI=1S/C23H20N4O2/c1-2-29-23(28)22-26-20-11-7-6-10-19(20)21(27-22)25-18-14-12-17(13-15-18)24-16-8-4-3-5-9-16/h3-15,24H,2H2,1H3,(H,25,26,27)	UNOMFBSHXIYLIY-UHFFFAOYSA-N	CCOC(=O)c1nc(Nc2ccc(Nc3ccccc3)cc2)c4ccccc4n1	BroadT	BRD-K11004561	BRD-K11004561-001-05-4	ChemDiv Inc.	5847-0458			CCOC(=O)c1nc(Nc2ccc(Nc3ccccc3)cc2)c2ccccc2n1	InChI=1S/C23H20N4O2/c1-2-29-23(28)22-26-20-11-7-6-10-19(20)21(27-22)25-18-14-12-17(13-15-18)24-16-8-4-3-5-9-16/h3-15,24H,2H2,1H3,(H,25,26,27)	UNOMFBSHXIYLIY-UHFFFAOYSA-N	384.15862592							119816
SMR000025357	LSM-31261	BRD-K39087168, SID4251707	3245360	InChI=1S/C20H26N2O4S/c1-14-17(27(24,25)16-12-6-5-7-13-16)18(22(21-14)20(2,3)4)26-19(23)15-10-8-9-11-15/h5-7,12-13,15H,8-11H2,1-4H3	BWPUVXPZSNGMBD-UHFFFAOYSA-N	Cc1nn(c(OC(=O)C2CCCC2)c1S(=O)(=O)c3ccccc3)C(C)(C)C	BroadT	BRD-K39087168	BRD-K39087168-001-04-7	ChemDiv Inc.	C263-0002			Cc1nn(c(OC(=O)C2CCCC2)c1S(=O)(=O)c1ccccc1)C(C)(C)C	InChI=1S/C20H26N2O4S/c1-14-17(27(24,25)16-12-6-5-7-13-16)18(22(21-14)20(2,3)4)26-19(23)15-10-8-9-11-15/h5-7,12-13,15H,8-11H2,1-4H3	BWPUVXPZSNGMBD-UHFFFAOYSA-N	390.161328022							119817
MLS000588665	LSM-31262	BRD-K49368687, SID17511877, SID85747722, SID87347070	1935947	InChI=1S/C28H26N4O4S2/c33-37(34,21-14-6-2-7-15-21)26-25-27(30-24-19-11-10-18-23(24)29-25)32(20-12-4-1-5-13-20)28(26)31-38(35,36)22-16-8-3-9-17-22/h2-3,6-11,14-20,31H,1,4-5,12-13H2	LJYSHLYMYQNADO-UHFFFAOYSA-N	O=S(=O)(Nc1c(c2nc3ccccc3nc2n1C4CCCCC4)S(=O)(=O)c5ccccc5)c6ccccc6	BroadT	BRD-K49368687	BRD-K49368687-001-07-4	InterBioScreen Ltd.	STOCK2S-81724			O=S(=O)(Nc1c(c2nc3ccccc3nc2n1C1CCCCC1)S(=O)(=O)c1ccccc1)c1ccccc1	InChI=1S/C28H26N4O4S2/c33-37(34,21-14-6-2-7-15-21)26-25-27(30-24-19-11-10-18-23(24)29-25)32(20-12-4-1-5-13-20)28(26)31-38(35,36)22-16-8-3-9-17-22/h2-3,6-11,14-20,31H,1,4-5,12-13H2	LJYSHLYMYQNADO-UHFFFAOYSA-N	546.139546732							119818
BDBM94537	LSM-31263	BRD-A95683194	91899529	InChI=1S/C18H13ClO4/c1-10-2-4-11(5-3-10)15(20)14-16(21)18(22)23-17(14)12-6-8-13(19)9-7-12/h2-9,14,17H,1H3	GYQXZEPRFQVJPO-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)C2C(OC(=O)C2=O)c3ccc(Cl)cc3	BroadT	BRD-A95683194	BRD-A95683194-001-05-1	ChemDiv Inc.	5340-1804			Cc1ccc(cc1)C(=O)C1C(OC(=O)C1=O)c1ccc(Cl)cc1	InChI=1S/C18H13ClO4/c1-10-2-4-11(5-3-10)15(20)14-16(21)18(22)23-17(14)12-6-8-13(19)9-7-12/h2-9,14,17H,1H3	GYQXZEPRFQVJPO-UHFFFAOYSA-N	328.050236606							119819
T5346502	LSM-31264	BRD-K97985992, SID3716284	2999544	InChI=1S/C21H22N4O3S2/c1-2-3-11-25-18-10-9-16(30(22,26)27)12-17(18)24-21(25)29-14-20-23-13-19(28-20)15-7-5-4-6-8-15/h4-10,12-13H,2-3,11,14H2,1H3,(H2,22,26,27)	GSHRPDGNRLXSDB-UHFFFAOYSA-N	CCCCn1c(SCc2oc(cn2)c3ccccc3)nc4cc(ccc14)S(=O)(=O)N	BroadT	BRD-K97985992	BRD-K97985992-001-05-0	Enamine Ltd.	T5346502			CCCCn1c(SCc2ncc(o2)-c2ccccc2)nc2cc(ccc12)S(N)(=O)=O	InChI=1S/C21H22N4O3S2/c1-2-3-11-25-18-10-9-16(30(22,26)27)12-17(18)24-21(25)29-14-20-23-13-19(28-20)15-7-5-4-6-8-15/h4-10,12-13H,2-3,11,14H2,1H3,(H2,22,26,27)	GSHRPDGNRLXSDB-UHFFFAOYSA-N	442.113331984							119820
AO-476/43250139	LSM-31265	BRD-K64535513, SID24786853	7309417	InChI=1S/C10H9N5O3/c11-9-8(10(16)15-14-9)13-12-5-1-2-6-7(3-5)18-4-17-6/h1-3H,4H2,(H4,11,14,15,16)	HIABFNYQXWBULB-UHFFFAOYSA-N	Nc1n[nH]c(O)c1N=Nc2ccc3OCOc3c2	BroadT	BRD-K64535513	BRD-K64535513-001-05-2	Specs	AO-476/43250139			Nc1n[nH]c(O)c1N=Nc1ccc2OCOc2c1	InChI=1S/C10H9N5O3/c11-9-8(10(16)15-14-9)13-12-5-1-2-6-7(3-5)18-4-17-6/h1-3H,4H2,(H4,11,14,15,16)	HIABFNYQXWBULB-UHFFFAOYSA-N	247.070539198							
2-(Difluoromethyl)benzo[h]chromen-4-one	LSM-31266	BRD-K29711480, SID124360550, SID7977301	2849147	InChI=1S/C14H8F2O2/c15-14(16)12-7-11(17)10-6-5-8-3-1-2-4-9(8)13(10)18-12/h1-7,14H	KNUJYYIPVGGTID-UHFFFAOYSA-N	FC(F)C1=CC(=O)c2ccc3ccccc3c2O1	BroadT	BRD-K29711480	BRD-K29711480-001-06-0	ChemBridge Corporation	5490186			FC(F)c1cc(=O)c2ccc3ccccc3c2o1	InChI=1S/C14H8F2O2/c15-14(16)12-7-11(17)10-6-5-8-3-1-2-4-9(8)13(10)18-12/h1-7,14H	KNUJYYIPVGGTID-UHFFFAOYSA-N	246.049235896							119822
SMR000066537	LSM-31267	BRD-K00804254, SID3716049	2999455	InChI=1S/C19H23N5O2S/c1-13-11-17(18(25)12-27-19-20-21-22-23(19)3)14(2)24(13)10-9-15-5-7-16(26-4)8-6-15/h5-8,11H,9-10,12H2,1-4H3	RTWHSJKDYVQEKV-UHFFFAOYSA-N	COc1ccc(CCn2c(C)cc(C(=O)CSc3nnnn3C)c2C)cc1	BroadT	BRD-K00804254	BRD-K00804254-001-05-2	Enamine Ltd.	T5236269			COc1ccc(CCn2c(C)cc(C(=O)CSc3nnnn3C)c2C)cc1	InChI=1S/C19H23N5O2S/c1-13-11-17(18(25)12-27-19-20-21-22-23(19)3)14(2)24(13)10-9-15-5-7-16(26-4)8-6-15/h5-8,11H,9-10,12H2,1-4H3	RTWHSJKDYVQEKV-UHFFFAOYSA-N	385.157245716							119823
MLS000104338	LSM-31268	BRD-A14878925, SID7972100	2834991	InChI=1S/C15H12O5/c16-10-6-3-7-11-12(10)14(18)13(17)8-4-1-2-5-9(8)15(14,19)20-11/h1-2,4-5,18-19H,3,6-7H2	RQRSZYHVVUHFRF-UHFFFAOYSA-N	OC12OC3=C(C(=O)CCC3)C1(O)C(=O)c4ccccc24	BroadT	BRD-A14878925	BRD-A14878925-001-06-9	ChemBridge Corporation	5224601			OC12OC3=C(C(=O)CCC3)C1(O)C(=O)c1ccccc21	InChI=1S/C15H12O5/c16-10-6-3-7-11-12(10)14(18)13(17)8-4-1-2-5-9(8)15(14,19)20-11/h1-2,4-5,18-19H,3,6-7H2	RQRSZYHVVUHFRF-UHFFFAOYSA-N	272.068473484							119824
ST50841905	LSM-31269	BRD-K86716312, SID24781202	3846584	InChI=1S/C18H22N2O4S/c1-14(2)15-5-7-16(8-6-15)25(22,23)20-11-9-19(10-12-20)18(21)17-4-3-13-24-17/h3-8,13-14H,9-12H2,1-2H3	AXINTJCSUMNFQA-UHFFFAOYSA-N	CC(C)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(=O)c3occc3	BroadT	BRD-K86716312	BRD-K86716312-001-06-3	ChemDiv Inc.	K940-3806			CC(C)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccco1	InChI=1S/C18H22N2O4S/c1-14(2)15-5-7-16(8-6-15)25(22,23)20-11-9-19(10-12-20)18(21)17-4-3-13-24-17/h3-8,13-14H,9-12H2,1-2H3	AXINTJCSUMNFQA-UHFFFAOYSA-N	362.130027894							119825
3-(P-methoxybenzoyl)indole	LSM-31270	BRD-K77046858, SID7977396	211017	InChI=1S/C16H13NO2/c1-19-12-8-6-11(7-9-12)16(18)14-10-17-15-5-3-2-4-13(14)15/h2-10,17H,1H3	KLNHIIYKFBCQQB-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)c2c[nH]c3ccccc23	BroadT	BRD-K77046858	BRD-K77046858-001-05-8	ChemBridge Corporation	5106601			COc1ccc(cc1)C(=O)c1c[nH]c2ccccc12	InChI=1S/C16H13NO2/c1-19-12-8-6-11(7-9-12)16(18)14-10-17-15-5-3-2-4-13(14)15/h2-10,17H,1H3	KLNHIIYKFBCQQB-UHFFFAOYSA-N	251.094628666							119826
ZINC02668860	LSM-31271	BRD-K06492501, SID24830644	2130250	InChI=1S/C11H13N3OS/c1-2-7-12-10(15)14-11-13-8-5-3-4-6-9(8)16-11/h3-6H,2,7H2,1H3,(H2,12,13,14,15)	XYONTECNGQBAIV-UHFFFAOYSA-N	CCCNC(=O)Nc1nc2ccccc2s1	BroadT	BRD-K06492501	BRD-K06492501-001-05-1	Enamine Ltd.	T0514-6582			CCCNC(=O)Nc1nc2ccccc2s1	InChI=1S/C11H13N3OS/c1-2-7-12-10(15)14-11-13-8-5-3-4-6-9(8)16-11/h3-6H,2,7H2,1H3,(H2,12,13,14,15)	XYONTECNGQBAIV-UHFFFAOYSA-N	235.077932756							119827
5-(3,5-Dimethoxyphenyl)-3-phenyl-1,2,4-oxadiazole	LSM-31272	BRD-K89199943, SID4263827	868065	InChI=1S/C16H14N2O3/c1-19-13-8-12(9-14(10-13)20-2)16-17-15(18-21-16)11-6-4-3-5-7-11/h3-10H,1-2H3	LPHMGGGPTYTPEH-UHFFFAOYSA-N	COc1cc(OC)cc(c1)c2onc(n2)c3ccccc3	BroadT	BRD-K89199943	BRD-K89199943-001-05-8	ChemBridge Corporation	5687156			COc1cc(OC)cc(c1)-c1nc(no1)-c1ccccc1	InChI=1S/C16H14N2O3/c1-19-13-8-12(9-14(10-13)20-2)16-17-15(18-21-16)11-6-4-3-5-7-11/h3-10H,1-2H3	LPHMGGGPTYTPEH-UHFFFAOYSA-N	282.100442328							119828
MLS001238046	LSM-31273	BRD-A68913459, SID51085513	4083470	InChI=1S/C19H22N4O6S/c1-13-3-2-8-23(11-13)30(25,26)15-6-4-14(5-7-15)17(24)20-19-22-21-18(29-19)16-12-27-9-10-28-16/h4-7,12-13H,2-3,8-11H2,1H3,(H,20,22,24)	WASWTIOEXMNZOY-UHFFFAOYSA-N	CC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)Nc3oc(nn3)C4=COCCO4	BroadT	BRD-A68913459	BRD-A68913459-001-06-3	Life Chemicals Inc.	F0608-0204			CC1CCCN(C1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(o1)C1=COCCO1	InChI=1S/C19H22N4O6S/c1-13-3-2-8-23(11-13)30(25,26)15-6-4-14(5-7-15)17(24)20-19-22-21-18(29-19)16-12-27-9-10-28-16/h4-7,12-13H,2-3,8-11H2,1H3,(H,20,22,24)	WASWTIOEXMNZOY-UHFFFAOYSA-N	434.126005154							119829
ZINC03330158	LSM-31274	BRD-K66939340, SID24835944	2446182	InChI=1S/C15H12N6OS2/c1-10-4-2-3-5-12(10)21-15(17-18-19-21)24-9-11-8-13(22)20-6-7-23-14(20)16-11/h2-8H,9H2,1H3	AVLLZEDGRZHCTI-UHFFFAOYSA-N	Cc1ccccc1n2nnnc2SCC3=CC(=O)N4C=CSC4=N3	BroadT	BRD-K66939340	BRD-K66939340-001-05-3	Enamine Ltd.	T0518-0056			Cc1ccccc1-n1nnnc1SCc1cc(=O)n2ccsc2n1	InChI=1S/C15H12N6OS2/c1-10-4-2-3-5-12(10)21-15(17-18-19-21)24-9-11-8-13(22)20-6-7-23-14(20)16-11/h2-8H,9H2,1H3	AVLLZEDGRZHCTI-UHFFFAOYSA-N	356.051400444							119830
2-(4-Chloro-benzenesulfonyl)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid	LSM-31275	BRD-A80057650, SID24834199	4205458	InChI=1S/C16H14ClNO4S/c17-13-5-7-14(8-6-13)23(21,22)18-10-12-4-2-1-3-11(12)9-15(18)16(19)20/h1-8,15H,9-10H2,(H,19,20)	MWFNHAUXOMDUFH-UHFFFAOYSA-N	OC(=O)C1Cc2ccccc2CN1S(=O)(=O)c3ccc(Cl)cc3	BroadT	BRD-A80057650	BRD-A80057650-001-05-2	Enamine Ltd.	T0509-1219			OC(=O)C1Cc2ccccc2CN1S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C16H14ClNO4S/c17-13-5-7-14(8-6-13)23(21,22)18-10-12-4-2-1-3-11(12)9-15(18)16(19)20/h1-8,15H,9-10H2,(H,19,20)	MWFNHAUXOMDUFH-UHFFFAOYSA-N	351.033206338							119831
ST077737	LSM-31276	BRD-A35495382, SID17508664	3089986	InChI=1S/C17H17Cl3N2O2/c1-11-3-7-13(8-4-11)21-16(17(18,19)20)22-15(23)12-5-9-14(24-2)10-6-12/h3-10,16,21H,1-2H3,(H,22,23)	QMHLSTUDRCXMAA-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NC(Nc2ccc(C)cc2)C(Cl)(Cl)Cl	BroadT	BRD-A35495382	BRD-A35495382-001-05-5	Asinex Ltd.	BAS 00084576			COc1ccc(cc1)C(=O)NC(Nc1ccc(C)cc1)C(Cl)(Cl)Cl	InChI=1S/C17H17Cl3N2O2/c1-11-3-7-13(8-4-11)21-16(17(18,19)20)22-15(23)12-5-9-14(24-2)10-6-12/h3-10,16,21H,1-2H3,(H,22,23)	QMHLSTUDRCXMAA-UHFFFAOYSA-N	386.035560934							119832
AC1MXD58	LSM-31277	BRD-A94420133, SID22401336	3813724	InChI=1S/C20H18N4O2/c21-11-18(12-22)16(14-7-3-1-4-8-14)25-20-10-6-2-5-9-15(20)19(18,13-23)17(24)26-20/h1,3-4,7-8,15-16,24H,2,5-6,9-10H2	DSWYUGSSEJEZIF-UHFFFAOYSA-N	N=C1OC23CCCCCC2C1(C#N)C(C#N)(C#N)C(O3)c4ccccc4	BroadT	BRD-A94420133	BRD-A94420133-001-05-3	InterBioScreen Ltd.	STOCK3S-88297			N=C1OC23CCCCCC2C1(C#N)C(C#N)(C#N)C(O3)c1ccccc1	InChI=1S/C20H18N4O2/c21-11-18(12-22)16(14-7-3-1-4-8-14)25-20-10-6-2-5-9-15(20)19(18,13-23)17(24)26-20/h1,3-4,7-8,15-16,24H,2,5-6,9-10H2	DSWYUGSSEJEZIF-UHFFFAOYSA-N	346.142975856							119833
ST069086	LSM-31278	BRD-K25351976, SID24811357	2855171	InChI=1S/C15H14ClN3O3/c16-12-3-1-11(2-4-12)15(20)18-10-9-17-13-5-7-14(8-6-13)19(21)22/h1-8,17H,9-10H2,(H,18,20)	PUMSPUNCRYXTSF-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NCCNC(=O)c2ccc(Cl)cc2)cc1	BroadT	BRD-K25351976	BRD-K25351976-001-05-2	ChemDiv Inc.	8007-4537			[O-][N+](=O)c1ccc(NCCNC(=O)c2ccc(Cl)cc2)cc1	InChI=1S/C15H14ClN3O3/c16-12-3-1-11(2-4-12)15(20)18-10-9-17-13-5-7-14(8-6-13)19(21)22/h1-8,17H,9-10H2,(H,18,20)	PUMSPUNCRYXTSF-UHFFFAOYSA-N	319.072369048							119834
Methyl 1H-indazole-3-carboxylate	LSM-31279	BRD-K76600600, SID856097	657476	InChI=1S/C9H8N2O2/c1-13-9(12)8-6-4-2-3-5-7(6)10-11-8/h2-5H,1H3,(H,10,11)	KWTCVAHCQGKXAZ-UHFFFAOYSA-N	COC(=O)c1[nH]nc2ccccc12	BroadT	BRD-K76600600	BRD-K76600600-001-06-2	InterBioScreen Ltd.	STOCK1S-01885			COC(=O)c1[nH]nc2ccccc12	InChI=1S/C9H8N2O2/c1-13-9(12)8-6-4-2-3-5-7(6)10-11-8/h2-5H,1H3,(H,10,11)	KWTCVAHCQGKXAZ-UHFFFAOYSA-N	176.058577516							119835
MLS000417632	LSM-44343	SID24791276, BRD-K25746333	5886407	InChI=1S/C20H16N4O2/c1-26-16-9-5-6-14(12-16)10-11-18-22-19-17(20(25)23-18)13-21-24(19)15-7-3-2-4-8-15/h2-13H,1H3,(H,22,23,25)/b11-10+	ULTRGZWWFOUMRD-ZHACJKMWSA-N	COc1cccc(\C=C\c2nc(O)c3cnn(c4ccccc4)c3n2)c1	BroadT	BRD-K25746333	BRD-K25746333-001-05-1	Enamine Ltd.	T0511-5774			COc1cccc(\C=C\c2nc(O)c3cnn(-c4ccccc4)c3n2)c1	InChI=1S/C20H16N4O2/c1-26-16-9-5-6-14(12-16)10-11-18-22-19-17(20(25)23-18)13-21-24(19)15-7-3-2-4-8-15/h2-13H,1H3,(H,22,23,25)/b11-10+	ULTRGZWWFOUMRD-ZHACJKMWSA-N	344.127325792							
AMBCB79478683	LSM-31281	BRD-K26748243, SID49732221	24793046	InChI=1S/C18H20N2O2S/c1-4-5-13-6-7-15-14(10-13)12(2)17(22-15)18(21)20(3)11-16-19-8-9-23-16/h6-10H,4-5,11H2,1-3H3	GSWAFJJYOAKYDQ-UHFFFAOYSA-N	CCCc1ccc2oc(C(=O)N(C)Cc3nccs3)c(C)c2c1	BroadT	BRD-K26748243	BRD-K26748243-001-06-3	ChemBridge Corporation	79478683			CCCc1ccc2oc(C(=O)N(C)Cc3nccs3)c(C)c2c1	InChI=1S/C18H20N2O2S/c1-4-5-13-6-7-15-14(10-13)12(2)17(22-15)18(21)20(3)11-16-19-8-9-23-16/h6-10H,4-5,11H2,1-3H3	GSWAFJJYOAKYDQ-UHFFFAOYSA-N	328.12454859							119837
SMR000075319	LSM-6371	Importazole, SID4258030	2949965	InChI=1S/C20H22N4/c1-15(16-9-3-2-4-10-16)21-19-17-11-5-6-12-18(17)22-20(23-19)24-13-7-8-14-24/h2-6,9-12,15H,7-8,13-14H2,1H3,(H,21,22,23)	HKGJEZIGDHFJFL-UHFFFAOYSA-N	CC(Nc1nc(nc2ccccc12)N3CCCC3)c4ccccc4	BroadT	BRD-A02481876	BRD-A02481876-001-08-1	ChemBridge Corporation	7725466			CC(Nc1nc(nc2ccccc12)N1CCCC1)c1ccccc1	InChI=1S/C20H22N4/c1-15(16-9-3-2-4-10-16)21-19-17-11-5-6-12-18(17)22-20(23-19)24-13-7-8-14-24/h2-6,9-12,15H,7-8,13-14H2,1H3,(H,21,22,23)	HKGJEZIGDHFJFL-UHFFFAOYSA-N	318.184446744							95107
3,4-Dichloro-n-(4-chloro-3-methyl-5-isoxazolyl)benzenecarboxamide	LSM-31282	BRD-K04531886, SID24819533	1488701	InChI=1S/C11H7Cl3N2O2/c1-5-9(14)11(18-16-5)15-10(17)6-2-3-7(12)8(13)4-6/h2-4H,1H3,(H,15,17)	MWELORGSKQVOFZ-UHFFFAOYSA-N	Cc1noc(NC(=O)c2ccc(Cl)c(Cl)c2)c1Cl	BroadT	BRD-K04531886	BRD-K04531886-001-06-1	Key Organics Ltd.	9M-027			Cc1noc(NC(=O)c2ccc(Cl)c(Cl)c2)c1Cl	InChI=1S/C11H7Cl3N2O2/c1-5-9(14)11(18-16-5)15-10(17)6-2-3-7(12)8(13)4-6/h2-4H,1H3,(H,15,17)	MWELORGSKQVOFZ-UHFFFAOYSA-N	303.957310614							119838
ILP-IV-16	LSM-31283	BRD-K37029442, SID26732674	16746620	InChI=1S/C28H26N4O4/c1-19-9-8-14-22(15-19)31-26(33)24-25(30-18-29-24)27(34)32-23(16-20-10-4-2-5-11-20)28(35)36-17-21-12-6-3-7-13-21/h2-15,18,23H,16-17H2,1H3,(H,29,30)(H,31,33)(H,32,34)/t23-/m0/s1	JHRQHLQSBFCUSQ-QHCPKHFHSA-N	Cc1cccc(NC(=O)c2[nH]cnc2C(=O)N[C@@H](Cc3ccccc3)C(=O)OCc4ccccc4)c1	BroadT	BRD-K37029442	BRD-K37029442-001-05-6	University of Tulsa	ILP-IV-16 AE03_AN08			Cc1cccc(NC(=O)c2[nH]cnc2C(=O)N[C@@H](Cc2ccccc2)C(=O)OCc2ccccc2)c1	InChI=1S/C28H26N4O4/c1-19-9-8-14-22(15-19)31-26(33)24-25(30-18-29-24)27(34)32-23(16-20-10-4-2-5-11-20)28(35)36-17-21-12-6-3-7-13-21/h2-15,18,23H,16-17H2,1H3,(H,29,30)(H,31,33)(H,32,34)/t23-/m0/s1	JHRQHLQSBFCUSQ-QHCPKHFHSA-N	482.195405352							119839
MLS000759793	LSM-31284	BRD-K55780532, SID26670577, SID99303190	2385808	InChI=1S/C24H17N5O3S2/c30-23(27-17-5-7-18(8-6-17)34(31,32)29-24-26-13-14-33-24)20-15-22(16-9-11-25-12-10-16)28-21-4-2-1-3-19(20)21/h1-15H,(H,26,29)(H,27,30)	VBLSKDCBYBLTKM-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)S(=O)(=O)Nc2nccs2)c3cc(nc4ccccc34)c5ccncc5	BroadT	BRD-K55780532	BRD-K55780532-001-05-2	Enamine Ltd.	T0510-7307			O=C(Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)c1cc(nc2ccccc12)-c1ccncc1	InChI=1S/C24H17N5O3S2/c30-23(27-17-5-7-18(8-6-17)34(31,32)29-24-26-13-14-33-24)20-15-22(16-9-11-25-12-10-16)28-21-4-2-1-3-19(20)21/h1-15H,(H,26,29)(H,27,30)	VBLSKDCBYBLTKM-UHFFFAOYSA-N	487.077280834							119840
SMR000063430	LSM-31285	BRD-K83966071, SID3715019	2999044	InChI=1S/C20H20N4O3S/c1-27-10-5-9-23-16-18(21-17(23)15-8-11-28-13-15)24(20(26)22-19(16)25)12-14-6-3-2-4-7-14/h2-4,6-8,11,13H,5,9-10,12H2,1H3,(H,22,25,26)	QQVGDCDFDWZVKR-UHFFFAOYSA-N	COCCCn1c(nc2N(Cc3ccccc3)C(=O)NC(=O)c12)c4ccsc4	BroadT	BRD-K83966071	BRD-K83966071-001-05-0	Enamine Ltd.	T5236747			COCCCn1c(nc2n(Cc3ccccc3)c(=O)[nH]c(=O)c12)-c1ccsc1	InChI=1S/C20H20N4O3S/c1-27-10-5-9-23-16-18(21-17(23)15-8-11-28-13-15)24(20(26)22-19(16)25)12-14-6-3-2-4-7-14/h2-4,6-8,11,13H,5,9-10,12H2,1H3,(H,22,25,26)	QQVGDCDFDWZVKR-UHFFFAOYSA-N	396.12561123							119841
MLS000705022	LSM-44344	SID22412028, BRD-K79204912	1794512	InChI=1S/C22H16N2O5S/c1-28-18-9-5-4-8-16(18)24-20(25)19(30-22(24)23)12-13-10-11-17(29-13)14-6-2-3-7-15(14)21(26)27/h2-12,23H,1H3,(H,26,27)/b19-12-,23-22?	PNFZUCFQPLNPLV-OCFWRVAFSA-N	COc1ccccc1N2C(=N)S\C(=C/c3oc(cc3)c4ccccc4C(=O)O)\C2=O	BroadT	BRD-K79204912	BRD-K79204912-001-05-5	Specs	AN-465/15401034			COc1ccccc1N1C(=N)S\C(=C/c2ccc(o2)-c2ccccc2C(O)=O)C1=O	InChI=1S/C22H16N2O5S/c1-28-18-9-5-4-8-16(18)24-20(25)19(30-22(24)23)12-13-10-11-17(29-13)14-6-2-3-7-15(14)21(26)27/h2-12,23H,1H3,(H,26,27)/b19-12-,23-22?	PNFZUCFQPLNPLV-OCFWRVAFSA-N	420.077992322							
N1-(3,5-Dichlorophenyl)-2-({4-methyl-5-[4-methyl-2-(5-methylisoxazol-3-yl)-1,3-thiazol-5-yl]-4H-1,2,4-triazol-3-yl}thio)acetamide	LSM-31287	BRD-K78211834, SID26730390	2745782	InChI=1S/C19H16Cl2N6O2S2/c1-9-4-14(26-29-9)18-22-10(2)16(31-18)17-24-25-19(27(17)3)30-8-15(28)23-13-6-11(20)5-12(21)7-13/h4-7H,8H2,1-3H3,(H,23,28)	TUORKXFFOJJSQV-UHFFFAOYSA-N	Cc1onc(c1)c2nc(C)c(s2)c3nnc(SCC(=O)Nc4cc(Cl)cc(Cl)c4)n3C	BroadT	BRD-K78211834	BRD-K78211834-001-05-6	Maybridge	SPB 05322			Cc1cc(no1)-c1nc(C)c(s1)-c1nnc(SCC(=O)Nc2cc(Cl)cc(Cl)c2)n1C	InChI=1S/C19H16Cl2N6O2S2/c1-9-4-14(26-29-9)18-22-10(2)16(31-18)17-24-25-19(27(17)3)30-8-15(28)23-13-6-11(20)5-12(21)7-13/h4-7H,8H2,1-3H3,(H,23,28)	TUORKXFFOJJSQV-UHFFFAOYSA-N	494.015320612							119843
2-(3-Thienyl)-3-(4-toluidino)acrylonitrile	LSM-44345	SID14729978, BRD-K35879814	2766392	InChI=1S/C14H12N2S/c1-11-2-4-14(5-3-11)16-9-13(8-15)12-6-7-17-10-12/h2-7,9-10,16H,1H3/b13-9-	MUMLJJBCDLNKTP-LCYFTJDESA-N	Cc1ccc(N\C=C(\C#N)/c2ccsc2)cc1	BroadT	BRD-K35879814	BRD-K35879814-001-06-4	Key Organics Ltd.	11B-088			Cc1ccc(N\C=C(\C#N)c2ccsc2)cc1	InChI=1S/C14H12N2S/c1-11-2-4-14(5-3-11)16-9-13(8-15)12-6-7-17-10-12/h2-7,9-10,16H,1H3/b13-9-	MUMLJJBCDLNKTP-LCYFTJDESA-N	240.072119094							
AC1M0HZH	LSM-31289	BRD-K39516553	2025828	InChI=1S/C24H22N6O4/c1-32-11-10-29-14-25-22-20(24(29)31)21-23(28-17-7-5-4-6-16(17)27-21)30(22)26-13-15-8-9-18(33-2)19(12-15)34-3/h4-9,12-14H,10-11H2,1-3H3	WEGVHOHGSOBPQG-UHFFFAOYSA-N	COCCN1C=Nc2c(C1=O)c3nc4ccccc4nc3n2N=Cc5ccc(OC)c(OC)c5	BroadT	BRD-K39516553	BRD-K39516553-001-05-5	InterBioScreen Ltd.	STOCK4S-55457			COCCn1cnc2n(N=Cc3ccc(OC)c(OC)c3)c3nc4ccccc4nc3c2c1=O	InChI=1S/C24H22N6O4/c1-32-11-10-29-14-25-22-20(24(29)31)21-23(28-17-7-5-4-6-16(17)27-21)30(22)26-13-15-8-9-18(33-2)19(12-15)34-3/h4-9,12-14H,10-11H2,1-3H3	WEGVHOHGSOBPQG-UHFFFAOYSA-N	458.170253244							119845
SMR000151890	LSM-31290	BRD-K59970200, SID14746598	3346590	InChI=1S/C26H22ClN3O5S/c27-22-10-9-20(36(33,34)29-12-14-35-15-13-29)17-23(22)28-26(32)25(31)24-21(18-6-2-1-3-7-18)16-19-8-4-5-11-30(19)24/h1-11,16-17H,12-15H2,(H,28,32)	JHLOJAPUTPOUTJ-UHFFFAOYSA-N	Clc1ccc(cc1NC(=O)C(=O)c2c(cc3ccccn23)c4ccccc4)S(=O)(=O)N5CCOCC5	BroadT	BRD-K59970200	BRD-K59970200-001-05-6	Enamine Ltd.	T0508-3376			Clc1ccc(cc1NC(=O)C(=O)c1c(cc2ccccn12)-c1ccccc1)S(=O)(=O)N1CCOCC1	InChI=1S/C26H22ClN3O5S/c27-22-10-9-20(36(33,34)29-12-14-35-15-13-29)17-23(22)28-26(32)25(31)24-21(18-6-2-1-3-7-18)16-19-8-4-5-11-30(19)24/h1-11,16-17H,12-15H2,(H,28,32)	JHLOJAPUTPOUTJ-UHFFFAOYSA-N	523.096869234							119846
MLS001126886	LSM-31291	BRD-K91655763, SID49737667	24794299	InChI=1S/C22H24N2O5/c1-26-15-9-11-24(12-10-15)22(25)19-13-16(29-23-19)14-28-21-8-7-20(27-2)17-5-3-4-6-18(17)21/h3-8,13,15H,9-12,14H2,1-2H3	PDPJEZFKQLNMMN-UHFFFAOYSA-N	COC1CCN(CC1)C(=O)c2cc(COc3ccc(OC)c4ccccc34)on2	BroadT	BRD-K91655763	BRD-K91655763-001-05-2	ChemBridge Corporation	46311710			COC1CCN(CC1)C(=O)c1cc(COc2ccc(OC)c3ccccc23)on1	InChI=1S/C22H24N2O5/c1-26-15-9-11-24(12-10-15)22(25)19-13-16(29-23-19)14-28-21-8-7-20(27-2)17-5-3-4-6-18(17)21/h3-8,13,15H,9-12,14H2,1-2H3	PDPJEZFKQLNMMN-UHFFFAOYSA-N	396.168521888							119847
SMR000067167	LSM-31292	BRD-K28268716, SID24840169, SID3711620	2079570	InChI=1S/C24H25N3O4S2/c1-2-27-21-6-4-3-5-19(21)20-15-17(7-9-22(20)27)25-23(28)16-18-8-10-24(32-18)33(29,30)26-11-13-31-14-12-26/h3-10,15H,2,11-14,16H2,1H3,(H,25,28)	NIOKPYGYASQXRY-UHFFFAOYSA-N	CCn1c2ccccc2c3cc(NC(=O)Cc4ccc(s4)S(=O)(=O)N5CCOCC5)ccc13	BroadT	BRD-K28268716	BRD-K28268716-001-05-0	Enamine Ltd.	T5256773			CCn1c2ccccc2c2cc(NC(=O)Cc3ccc(s3)S(=O)(=O)N3CCOCC3)ccc12	InChI=1S/C24H25N3O4S2/c1-2-27-21-6-4-3-5-19(21)20-15-17(7-9-22(20)27)25-23(28)16-18-8-10-24(32-18)33(29,30)26-11-13-31-14-12-26/h3-10,15H,2,11-14,16H2,1H3,(H,25,28)	NIOKPYGYASQXRY-UHFFFAOYSA-N	483.12864769							119848
ST50631651	LSM-31293	BRD-K82145108, SID17433388	1241849	InChI=1S/C18H13N3O3S/c1-10-5-4-8-13-15(10)20-18(25-13)19-14(22)9-21-16(23)11-6-2-3-7-12(11)17(21)24/h2-8H,9H2,1H3,(H,19,20,22)	MDNSDWBRMYCHDV-UHFFFAOYSA-N	Cc1cccc2sc(NC(=O)CN3C(=O)c4ccccc4C3=O)nc12	BroadT	BRD-K82145108	BRD-K82145108-001-06-7	ChemBridge Corporation	7908794			Cc1cccc2sc(NC(=O)CN3C(=O)c4ccccc4C3=O)nc12	InChI=1S/C18H13N3O3S/c1-10-5-4-8-13-15(10)20-18(25-13)19-14(22)9-21-16(23)11-6-2-3-7-12(11)17(21)24/h2-8H,9H2,1H3,(H,19,20,22)	MDNSDWBRMYCHDV-UHFFFAOYSA-N	351.067761996							119849
AC1MBKCT	LSM-31294	BRD-K97391170, SID26730992	2726951	InChI=1S/C13H9ClF3N3O3/c1-6-19-9(10(22-6)13(15,16)17)11(18)20-23-12(21)7-4-2-3-5-8(7)14/h2-5H,1H3,(H2,18,20)	XSISUOFEWZODMR-UHFFFAOYSA-N	Cc1oc(c(n1)C(=N)NOC(=O)c2ccccc2Cl)C(F)(F)F	BroadT	BRD-K97391170	BRD-K97391170-001-05-5	Maybridge	RF 04263			Cc1nc(C(=N)NOC(=O)c2ccccc2Cl)c(o1)C(F)(F)F	InChI=1S/C13H9ClF3N3O3/c1-6-19-9(10(22-6)13(15,16)17)11(18)20-23-12(21)7-4-2-3-5-8(7)14/h2-5H,1H3,(H2,18,20)	XSISUOFEWZODMR-UHFFFAOYSA-N	347.028453488							119850
Methyl 4-({[2-(pyridin-2-yl)quinolin-4-yl]carbonyl}amino)benzoate	LSM-31295	BRD-K39400123, SID24795178	2220860	InChI=1S/C23H17N3O3/c1-29-23(28)15-9-11-16(12-10-15)25-22(27)18-14-21(20-8-4-5-13-24-20)26-19-7-3-2-6-17(18)19/h2-14H,1H3,(H,25,27)	VFQDDYXCRYCRRK-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=O)c2cc(nc3ccccc23)c4ccccn4)cc1	BroadT	BRD-K39400123	BRD-K39400123-001-05-3	ChemBridge Corporation	7922385			COC(=O)c1ccc(NC(=O)c2cc(nc3ccccc23)-c2ccccn2)cc1	InChI=1S/C23H17N3O3/c1-29-23(28)15-9-11-16(12-10-15)25-22(27)18-14-21(20-8-4-5-13-24-20)26-19-7-3-2-6-17(18)19/h2-14H,1H3,(H,25,27)	VFQDDYXCRYCRRK-UHFFFAOYSA-N	383.126991434							119851
2-(3-Nitrophenyl)-5-phenyl-1,3,4-oxadiazole	LSM-31296	BRD-K63354944, SID24804403	577329	InChI=1S/C14H9N3O3/c18-17(19)12-8-4-7-11(9-12)14-16-15-13(20-14)10-5-2-1-3-6-10/h1-9H	PPAQPCTUYHOPLY-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)c2oc(nn2)c3ccccc3	BroadT	BRD-K63354944	BRD-K63354944-001-06-6	Asinex Ltd.	BAS 01842835			[O-][N+](=O)c1cccc(c1)-c1nnc(o1)-c1ccccc1	InChI=1S/C14H9N3O3/c18-17(19)12-8-4-7-11(9-12)14-16-15-13(20-14)10-5-2-1-3-6-10/h1-9H	PPAQPCTUYHOPLY-UHFFFAOYSA-N	267.064391178							119852
SMR000006944	LSM-31297	BRD-A82976259, SID853268	655920	InChI=1S/C22H27N3O3/c1-15-8-6-11-18(16(15)2)23-21(26)17-9-7-13-25(14-17)22(27)24-19-10-4-5-12-20(19)28-3/h4-6,8,10-12,17H,7,9,13-14H2,1-3H3,(H,23,26)(H,24,27)	LMAQDESVPXCBAL-UHFFFAOYSA-N	COc1ccccc1NC(=O)N2CCCC(C2)C(=O)Nc3cccc(C)c3C	BroadT	BRD-A82976259	BRD-A82976259-001-05-6	Asinex Ltd.	ASN 06574157			COc1ccccc1NC(=O)N1CCCC(C1)C(=O)Nc1cccc(C)c1C	InChI=1S/C22H27N3O3/c1-15-8-6-11-18(16(15)2)23-21(26)17-9-7-13-25(14-17)22(27)24-19-10-4-5-12-20(19)28-3/h4-6,8,10-12,17H,7,9,13-14H2,1-3H3,(H,23,26)(H,24,27)	LMAQDESVPXCBAL-UHFFFAOYSA-N	381.205241754							119853
5-Octyl-1H-1,2,4-triazol-3-yl hydrosulfide	LSM-31298	BRD-K97935314, SID14728418	1772270	InChI=1S/C10H19N3S/c1-2-3-4-5-6-7-8-9-11-10(14)13-12-9/h2-8H2,1H3,(H2,11,12,13,14)	OTAAOINHVFMIDG-UHFFFAOYSA-N	CCCCCCCCc1n[nH]c(S)n1	BroadT	BRD-K97935314	BRD-K97935314-001-05-6	Specs	AL-281/40633772			CCCCCCCCc1n[nH]c(S)n1	InChI=1S/C10H19N3S/c1-2-3-4-5-6-7-8-9-11-10(14)13-12-9/h2-8H2,1H3,(H2,11,12,13,14)	OTAAOINHVFMIDG-UHFFFAOYSA-N	213.129968328							119854
AC1MPDTV	LSM-31299	BRD-K98251998	3433687	InChI=1S/C16H14N4O2/c21-15(8-13-9-16(22)20-18-13)19-17-10-12-6-3-5-11-4-1-2-7-14(11)12/h1-7,9-10H,8H2,(H,19,21)(H2,18,20,22)	PJDUKSBRWQYPCT-UHFFFAOYSA-N	Oc1cc(CC(=O)NN=Cc2cccc3ccccc23)[nH]n1	BroadT	BRD-K98251998	BRD-K98251998-001-06-8	ChemDiv Inc.	2357-3739			Oc1cc(CC(=O)NN=Cc2cccc3ccccc23)[nH]n1	InChI=1S/C16H14N4O2/c21-15(8-13-9-16(22)20-18-13)19-17-10-12-6-3-5-11-4-1-2-7-14(11)12/h1-7,9-10H,8H2,(H,19,21)(H2,18,20,22)	PJDUKSBRWQYPCT-UHFFFAOYSA-N	294.111675728							119855
4-(2-Methylimidazo[1,2-a]pyridin-3-yl)pyrimidine-2-thiol	LSM-31300	BRD-K95798946, SID26729257	2745456	InChI=1S/C12H10N4S/c1-8-11(9-5-6-13-12(17)15-9)16-7-3-2-4-10(16)14-8/h2-7H,1H3,(H,13,15,17)	JXIYNECIGZSIKR-UHFFFAOYSA-N	Cc1nc2ccccn2c1c3ccnc(S)n3	BroadT	BRD-K95798946	BRD-K95798946-001-06-4	Maybridge	SPB 04780			Cc1nc2ccccn2c1-c1ccnc(S)n1	InChI=1S/C12H10N4S/c1-8-11(9-5-6-13-12(17)15-9)16-7-3-2-4-10(16)14-8/h2-7H,1H3,(H,13,15,17)	JXIYNECIGZSIKR-UHFFFAOYSA-N	242.06261705							119856
STK847144	LSM-31301	BRD-K15300571, SID17414805	1294727	InChI=1S/C16H20N6OS2/c1-11-2-4-12(5-3-11)18-15-20-13(19-14(17)21-15)10-25-16(24)22-6-8-23-9-7-22/h2-5H,6-10H2,1H3,(H3,17,18,19,20,21)	RAQZMPPWMZKMIJ-UHFFFAOYSA-N	Cc1ccc(Nc2nc(N)nc(CSC(=S)N3CCOCC3)n2)cc1	BroadT	BRD-K15300571	BRD-K15300571-001-05-0	ChemBridge Corporation	7316738			Cc1ccc(Nc2nc(N)nc(CSC(=S)N3CCOCC3)n2)cc1	InChI=1S/C16H20N6OS2/c1-11-2-4-12(5-3-11)18-15-20-13(19-14(17)21-15)10-25-16(24)22-6-8-23-9-7-22/h2-5H,6-10H2,1H3,(H3,17,18,19,20,21)	RAQZMPPWMZKMIJ-UHFFFAOYSA-N	376.1140007							119857
AC1NW9OU	LSM-31302	BRD-K92012390, SID24786866	5725516	InChI=1S/C16H11N5O/c22-16-14(12-7-3-4-8-13(12)18-16)19-21-15-11-6-2-1-5-10(11)9-17-20-15/h1-9,18,22H	PSMRGDTVEWXOBS-UHFFFAOYSA-N	Oc1[nH]c2ccccc2c1N=Nc3nncc4ccccc34	BroadT	BRD-K92012390	BRD-K92012390-001-05-6	Asinex Ltd.	BAS 00529069			Oc1[nH]c2ccccc2c1N=Nc1nncc2ccccc12	InChI=1S/C16H11N5O/c22-16-14(12-7-3-4-8-13(12)18-16)19-21-15-11-6-2-1-5-10(11)9-17-20-15/h1-9,18,22H	PSMRGDTVEWXOBS-UHFFFAOYSA-N	289.096360022							
AC1LJ9Y3	LSM-31303	BRD-K11297155	919625	InChI=1S/C16H25N3O2/c1-6-19(7-2)14-10-8-13(9-11-14)12-17-18-15(20)21-16(3,4)5/h8-12H,6-7H2,1-5H3,(H,18,20)	REVNKPWSAVELMP-UHFFFAOYSA-N	CCN(CC)c1ccc(C=NNC(=O)OC(C)(C)C)cc1	BroadT	BRD-K11297155	BRD-K11297155-001-06-4	InterBioScreen Ltd.	STOCK2S-09038			CCN(CC)c1ccc(C=NNC(=O)OC(C)(C)C)cc1	InChI=1S/C16H25N3O2/c1-6-19(7-2)14-10-8-13(9-11-14)12-17-18-15(20)21-16(3,4)5/h8-12H,6-7H2,1-5H3,(H,18,20)	REVNKPWSAVELMP-UHFFFAOYSA-N	291.19467707							119859
MLS000041845	LSM-31304	BRD-K36095954, SID863531	664783	InChI=1S/C18H14FN3O2/c1-23-16-5-3-2-4-14(16)17-22-15(10-20)18(24-17)21-11-12-6-8-13(19)9-7-12/h2-9,21H,11H2,1H3	ULBWRFXUHUOWPV-UHFFFAOYSA-N	COc1ccccc1c2oc(NCc3ccc(F)cc3)c(n2)C#N	BroadT	BRD-K36095954	BRD-K36095954-001-06-6	InterBioScreen Ltd.	STOCK4S-78236			COc1ccccc1-c1nc(C#N)c(NCc2ccc(F)cc2)o1	InChI=1S/C18H14FN3O2/c1-23-16-5-3-2-4-14(16)17-22-15(10-20)18(24-17)21-11-12-6-8-13(19)9-7-12/h2-9,21H,11H2,1H3	ULBWRFXUHUOWPV-UHFFFAOYSA-N	323.107004918							119860
MLS000331071	LSM-31305	BRD-K72296840, SID17511500	4898779	InChI=1S/C25H20N6/c1-15-8-7-9-16(14-15)31-23(26)21(24-29-19-12-5-6-13-20(19)30(24)2)22-25(31)28-18-11-4-3-10-17(18)27-22/h3-14H,26H2,1-2H3	QZHDUTXPFKRMQI-UHFFFAOYSA-N	Cc1cccc(c1)n2c(N)c(c3nc4ccccc4n3C)c5nc6ccccc6nc25	BroadT	BRD-K72296840	BRD-K72296840-001-07-1	InterBioScreen Ltd.	STOCK5S-56286			Cc1cccc(c1)-n1c(N)c(-c2nc3ccccc3n2C)c2nc3ccccc3nc12	InChI=1S/C25H20N6/c1-15-8-7-9-16(14-15)31-23(26)21(24-29-19-12-5-6-13-20(19)30(24)2)22-25(31)28-18-11-4-3-10-17(18)27-22/h3-14H,26H2,1-2H3	QZHDUTXPFKRMQI-UHFFFAOYSA-N	404.1749447							119861
MLS001033156	LSM-31306	BRD-K18178356, SID24825844	3994136	InChI=1S/C17H16FN3S/c1-11-6-5-9-15(12(11)2)19-17-21-20-16(10-22-17)13-7-3-4-8-14(13)18/h3-9H,10H2,1-2H3,(H,19,21)	GCYLOSBHOCQBTH-UHFFFAOYSA-N	Cc1cccc(NC2=NN=C(CS2)c3ccccc3F)c1C	BroadT	BRD-K18178356	BRD-K18178356-001-05-8	Enamine Ltd.	T5210964			Cc1cccc(NC2=NN=C(CS2)c2ccccc2F)c1C	InChI=1S/C17H16FN3S/c1-11-6-5-9-15(12(11)2)19-17-21-20-16(10-22-17)13-7-3-4-8-14(13)18/h3-9H,10H2,1-2H3,(H,19,21)	GCYLOSBHOCQBTH-UHFFFAOYSA-N	313.104896432							119862
MLS001033418	LSM-31307	BRD-K86845405	2421499	InChI=1S/C11H8FN5/c12-7-2-1-3-8(4-7)16-10-9-5-15-17-11(9)14-6-13-10/h1-6H,(H2,13,14,15,16,17)	MOPUQFYNNVMCTC-UHFFFAOYSA-N	Fc1cccc(Nc2[nH]cnc3nncc23)c1	BroadT	BRD-K86845405	BRD-K86845405-001-07-6	Enamine Ltd.	T0515-7254			Fc1cccc(Nc2[nH]cnc3nncc23)c1	InChI=1S/C11H8FN5/c12-7-2-1-3-8(4-7)16-10-9-5-15-17-11(9)14-6-13-10/h1-6H,(H2,13,14,15,16,17)	MOPUQFYNNVMCTC-UHFFFAOYSA-N	229.076373506							119863
F1021-1012	LSM-31308	BRD-K86721033, SID853007	655650	InChI=1S/C15H15ClN2O2/c16-12-6-7-13(14-11(12)5-4-8-17-14)20-15(19)18-9-2-1-3-10-18/h4-8H,1-3,9-10H2	WAAFTEIZXWCELE-UHFFFAOYSA-N	Clc1ccc(OC(=O)N2CCCCC2)c3ncccc13	BroadT	BRD-K86721033	BRD-K86721033-001-05-3	Asinex Ltd.	BAS 02106927			Clc1ccc(OC(=O)N2CCCCC2)c2ncccc12	InChI=1S/C15H15ClN2O2/c16-12-6-7-13(14-11(12)5-4-8-17-14)20-15(19)18-9-2-1-3-10-18/h4-8H,1-3,9-10H2	WAAFTEIZXWCELE-UHFFFAOYSA-N	290.08220545							119864
AC1LDG2E	LSM-15580	BRD-K71089225	666474	InChI=1S/C25H25N3O3/c29-24(18-26-13-15-27(16-14-26)25(30)23-10-5-17-31-23)28-21-8-3-1-6-19(21)11-12-20-7-2-4-9-22(20)28/h1-10,17H,11-16,18H2	YBLOACJHCBCWET-UHFFFAOYSA-N	O=C(CN1CCN(CC1)C(=O)c2occc2)N3c4ccccc4CCc5ccccc35	BroadT	BRD-K71089225	BRD-K71089225-034-06-9	InterBioScreen Ltd.	STOCK5S-40550		OC(=O)C(=O)O	O=C(CN1CCN(CC1)C(=O)c1ccco1)N1c2ccccc2CCc2ccccc12.OC(=O)C(=O)O	InChI=1S/C25H25N3O3.C2H2O4/c29-24(18-26-13-15-27(16-14-26)25(30)23-10-5-17-31-23)28-21-8-3-1-6-19(21)11-12-20-7-2-4-9-22(20)28;3-1(4)2(5)6/h1-10,17H,11-16,18H2;(H,3,4)(H,5,6)	KZVXAJPRVLFFGE-UHFFFAOYSA-N	415.18959169							104216, 104216
MLS000936131	LSM-31309	BRD-K06399794, SID49715447	15996038	InChI=1S/C24H20FN3O4S/c1-13-4-6-15(11-18(13)25)26-22(29)14-5-8-17-19(10-14)27-24(33)28(23(17)30)20-9-7-16(31-2)12-21(20)32-3/h4-12H,1-3H3,(H,26,29)(H,27,33)	FFLSCKNQLIYUMN-UHFFFAOYSA-N	COc1ccc(N2C(=S)Nc3cc(ccc3C2=O)C(=O)Nc4ccc(C)c(F)c4)c(OC)c1	BroadT	BRD-K06399794	BRD-K06399794-001-06-2	ChemDiv Inc.	A0061519			COc1ccc(c(OC)c1)-n1c(=S)[nH]c2cc(ccc2c1=O)C(=O)Nc1ccc(C)c(F)c1	InChI=1S/C24H20FN3O4S/c1-13-4-6-15(11-18(13)25)26-22(29)14-5-8-17-19(10-14)27-24(33)28(23(17)30)20-9-7-16(31-2)12-21(20)32-3/h4-12H,1-3H3,(H,26,29)(H,27,33)	FFLSCKNQLIYUMN-UHFFFAOYSA-N	465.11585504							119865
F0916-4622	LSM-31310	BRD-K71737889, SID14732409	5067304	InChI=1S/C23H25N3O4S/c1-2-30-21(27)16-31-23-24-20-9-8-18(25-10-12-29-13-11-25)14-19(20)22(28)26(23)15-17-6-4-3-5-7-17/h3-9,14H,2,10-13,15-16H2,1H3	WUSGLHPQYXIUHS-UHFFFAOYSA-N	CCOC(=O)CSC1=Nc2ccc(cc2C(=O)N1Cc3ccccc3)N4CCOCC4	BroadT	BRD-K71737889	BRD-K71737889-001-05-1	ChemDiv Inc.	K284-2575			CCOC(=O)CSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)N1CCOCC1	InChI=1S/C23H25N3O4S/c1-2-30-21(27)16-31-23-24-20-9-8-18(25-10-12-29-13-11-25)14-19(20)22(28)26(23)15-17-6-4-3-5-7-17/h3-9,14H,2,10-13,15-16H2,1H3	WUSGLHPQYXIUHS-UHFFFAOYSA-N	439.156577							119866
MLS000849702	LSM-31311	BRD-K05122615, SID26670426	16682647	InChI=1S/C19H19N3O3/c1-11-3-6-17-14(7-11)10-25-19-15-5-4-13(8-16(15)21-22(17)19)18(24)20-12(2)9-23/h3-8,12,23H,9-10H2,1-2H3,(H,20,24)/t12-/m0/s1	COSCCPQWPLNIIT-LBPRGKRZSA-N	C[C@@H](CO)NC(=O)c1ccc2c3OCc4cc(C)ccc4n3nc2c1	BroadT	BRD-K05122615	BRD-K05122615-001-05-8	University of California at Davis	JDB-014			C[C@@H](CO)NC(=O)c1ccc2c3OCc4cc(C)ccc4-n3nc2c1	InChI=1S/C19H19N3O3/c1-11-3-6-17-14(7-11)10-25-19-15-5-4-13(8-16(15)21-22(17)19)18(24)20-12(2)9-23/h3-8,12,23H,9-10H2,1-2H3,(H,20,24)/t12-/m0/s1	COSCCPQWPLNIIT-LBPRGKRZSA-N	337.142641498							119867
MLS000763143	LSM-44346	SID26665922, BRD-K21784579	1870241	InChI=1S/C23H16N4O3/c24-13-18(22(28)25-14-15-7-2-1-3-8-15)20-16-9-4-5-10-17(16)21(26-20)27-23(29)19-11-6-12-30-19/h1-12H,14H2,(H,25,28)(H,26,27,29)/b20-18-	ZKTDZLWZNGWASN-ZZEZOPTASA-N	O=C(NCc1ccccc1)\C(=C\2/N=C(NC(=O)c3occc3)c4ccccc24)\C#N	BroadT	BRD-K21784579	BRD-K21784579-001-06-7	InterBioScreen Ltd.	STOCK5S-44475			O=C(NCc1ccccc1)C(\C#N)=C1/N=C(NC(=O)c2ccco2)c2ccccc12	InChI=1S/C23H16N4O3/c24-13-18(22(28)25-14-15-7-2-1-3-8-15)20-16-9-4-5-10-17(16)21(26-20)27-23(29)19-11-6-12-30-19/h1-12H,14H2,(H,25,28)(H,26,27,29)/b20-18-	ZKTDZLWZNGWASN-ZZEZOPTASA-N	396.122240412							
MLS000057848	LSM-31313	BRD-K92312193, SID3714300	2998745	InChI=1S/C21H18N2O3S/c1-13-10-18(14(2)22(13)11-15-6-5-9-27-15)19(24)12-23-20(25)16-7-3-4-8-17(16)21(23)26/h3-10H,11-12H2,1-2H3	YNMPPRWDPOEBOZ-UHFFFAOYSA-N	Cc1cc(C(=O)CN2C(=O)c3ccccc3C2=O)c(C)n1Cc4cccs4	BroadT	BRD-K92312193	BRD-K92312193-001-05-9	Enamine Ltd.	Z18271361			Cc1cc(C(=O)CN2C(=O)c3ccccc3C2=O)c(C)n1Cc1cccs1	InChI=1S/C21H18N2O3S/c1-13-10-18(14(2)22(13)11-15-6-5-9-27-15)19(24)12-23-20(25)16-7-3-4-8-17(16)21(23)26/h3-10H,11-12H2,1-2H3	YNMPPRWDPOEBOZ-UHFFFAOYSA-N	378.103813146							119869
F0612-0090	LSM-31314	BRD-A03997826, SID4241856	3236774	InChI=1S/C15H19N5O2S4/c1-4-20-12(22)11-9(6-8(3)25-11)16-14(20)24-7-10(21)17-13-18-19-15(26-13)23-5-2/h8H,4-7H2,1-3H3,(H,17,18,21)	GPRJQOQOYLDMRI-UHFFFAOYSA-N	CCSc1nnc(NC(=O)CSC2=NC3=C(SC(C)C3)C(=O)N2CC)s1	BroadT	BRD-A03997826	BRD-A03997826-001-05-2	ChemDiv Inc.	C280-0090			CCSc1nnc(NC(=O)CSc2nc3CC(C)Sc3c(=O)n2CC)s1	InChI=1S/C15H19N5O2S4/c1-4-20-12(22)11-9(6-8(3)25-11)16-14(20)24-7-10(21)17-13-18-19-15(26-13)23-5-2/h8H,4-7H2,1-3H3,(H,17,18,21)	GPRJQOQOYLDMRI-UHFFFAOYSA-N	429.042157658							119870
F0014-0240	LSM-31315	BRD-K05409106, SID7971778	4564556	InChI=1S/C12H11N3OS2/c1-3-9(16)15-12-14-8-5-4-7-10(11(8)18-12)17-6(2)13-7/h4-5H,3H2,1-2H3,(H,14,15,16)	RCLVMXFRPRHIAC-UHFFFAOYSA-N	CCC(=O)Nc1nc2ccc3nc(C)sc3c2s1	BroadT	BRD-K05409106	BRD-K05409106-001-05-5	Life Chemicals Inc.	F0014-0240			CCC(=O)Nc1nc2ccc3nc(C)sc3c2s1	InChI=1S/C12H11N3OS2/c1-3-9(16)15-12-14-8-5-4-7-10(11(8)18-12)17-6(2)13-7/h4-5H,3H2,1-2H3,(H,14,15,16)	RCLVMXFRPRHIAC-UHFFFAOYSA-N	277.034353382							119871
MLS000326863	LSM-31316	SID17411182, BRD-A01528713	3724708	InChI=1S/C17H15ClF4N2O2/c18-12-6-4-11(5-7-12)9-24(10-15(25)17(20,21)22)16(26)23-14-3-1-2-13(19)8-14/h1-8,15,25H,9-10H2,(H,23,26)	OXCANWVRLOKZDW-UHFFFAOYSA-N	OC(CN(Cc1ccc(Cl)cc1)C(=O)Nc2cccc(F)c2)C(F)(F)F	BroadT	BRD-A01528713	BRD-A01528713-001-05-3	Key Organics Ltd.	8P-934			OC(CN(Cc1ccc(Cl)cc1)C(=O)Nc1cccc(F)c1)C(F)(F)F	InChI=1S/C17H15ClF4N2O2/c18-12-6-4-11(5-7-12)9-24(10-15(25)17(20,21)22)16(26)23-14-3-1-2-13(19)8-14/h1-8,15,25H,9-10H2,(H,23,26)	OXCANWVRLOKZDW-UHFFFAOYSA-N	390.07581825							119872
N-[(4-Bromo-5-methylfuran-2-yl)methylideneamino]-2-(2-methyl-n-methylsulfonylanilino)acetamide	LSM-31317	BRD-K15291808	3128298	InChI=1S/C16H18BrN3O4S/c1-11-6-4-5-7-15(11)20(25(3,22)23)10-16(21)19-18-9-13-8-14(17)12(2)24-13/h4-9H,10H2,1-3H3,(H,19,21)	XYIQTYNJHFDTPY-UHFFFAOYSA-N	Cc1oc(C=NNC(=O)CN(c2ccccc2C)S(=O)(=O)C)cc1Br	BroadT	BRD-K15291808	BRD-K15291808-001-06-4	Asinex Ltd.	BAS 01243867			Cc1oc(C=NNC(=O)CN(c2ccccc2C)S(C)(=O)=O)cc1Br	InChI=1S/C16H18BrN3O4S/c1-11-6-4-5-7-15(11)20(25(3,22)23)10-16(21)19-18-9-13-8-14(17)12(2)24-13/h4-9H,10H2,1-3H3,(H,19,21)	XYIQTYNJHFDTPY-UHFFFAOYSA-N	427.020139376							119873
F1607-1010	LSM-31318	BRD-K39491844, SID17515434	2151650	InChI=1S/C25H28FN3OS/c1-24(2,3)19-9-5-18(6-10-19)22(30)29-23(31)21(17-7-11-20(26)12-8-17)27-25(29)13-15-28(4)16-14-25/h5-12H,13-16H2,1-4H3	NQRAENRXDKBACU-UHFFFAOYSA-N	CN1CCC2(CC1)N=C(C(=S)N2C(=O)c3ccc(cc3)C(C)(C)C)c4ccc(F)cc4	BroadT	BRD-K39491844	BRD-K39491844-001-06-8	Life Chemicals Inc.	F1607-1010			CN1CCC2(CC1)N=C(C(=S)N2C(=O)c1ccc(cc1)C(C)(C)C)c1ccc(F)cc1	InChI=1S/C25H28FN3OS/c1-24(2,3)19-9-5-18(6-10-19)22(30)29-23(31)21(17-7-11-20(26)12-8-17)27-25(29)13-15-28(4)16-14-25/h5-12H,13-16H2,1-4H3	NQRAENRXDKBACU-UHFFFAOYSA-N	437.193711436							119874
STK393542	LSM-31319	BRD-K73443280, SID853264	565804	InChI=1S/C12H11N3O2S/c1-8-7-9(2)15(13-8)12-10-5-3-4-6-11(10)18(16,17)14-12/h3-7H,1-2H3	MHSYGIYISFNELB-UHFFFAOYSA-N	Cc1cc(C)n(n1)C2=NS(=O)(=O)c3ccccc23	BroadT	BRD-K73443280	BRD-K73443280-001-05-9	Asinex Ltd.	BAS 01366980			Cc1cc(C)n(n1)C1=NS(=O)(=O)c2ccccc12	InChI=1S/C12H11N3O2S/c1-8-7-9(2)15(13-8)12-10-5-3-4-6-11(10)18(16,17)14-12/h3-7H,1-2H3	MHSYGIYISFNELB-UHFFFAOYSA-N	261.057197312							119875
N-(2-Fluorophenyl)-n'-(2-piperidinophenyl)urea	LSM-31320	BRD-K02210445, SID26726728	2814224	InChI=1S/C18H20FN3O/c19-14-8-2-3-9-15(14)20-18(23)21-16-10-4-5-11-17(16)22-12-6-1-7-13-22/h2-5,8-11H,1,6-7,12-13H2,(H2,20,21,23)	RPPKURVOLUUZJI-UHFFFAOYSA-N	Fc1ccccc1NC(=O)Nc2ccccc2N3CCCCC3	BroadT	BRD-K02210445	BRD-K02210445-001-05-0	Maybridge	HTS 08439			Fc1ccccc1NC(=O)Nc1ccccc1N1CCCCC1	InChI=1S/C18H20FN3O/c19-14-8-2-3-9-15(14)20-18(23)21-16-10-4-5-11-17(16)22-12-6-1-7-13-22/h2-5,8-11H,1,6-7,12-13H2,(H2,20,21,23)	RPPKURVOLUUZJI-UHFFFAOYSA-N	313.15904049							119876
SMR000241410	LSM-31321	BRD-K85636571, SID17516705	2105472	InChI=1S/C19H20N4O3S3/c1-4-27-19-22-21-18(28-19)20-17(24)14-6-5-7-16(12-14)29(25,26)23(3)15-10-8-13(2)9-11-15/h5-12H,4H2,1-3H3,(H,20,21,24)	ZHXMHIXLYABNRL-UHFFFAOYSA-N	CCSc1nnc(NC(=O)c2cccc(c2)S(=O)(=O)N(C)c3ccc(C)cc3)s1	BroadT	BRD-K85636571	BRD-K85636571-001-06-0	Enamine Ltd.	T5260916			CCSc1nnc(NC(=O)c2cccc(c2)S(=O)(=O)N(C)c2ccc(C)cc2)s1	InChI=1S/C19H20N4O3S3/c1-4-27-19-22-21-18(28-19)20-17(24)14-6-5-7-16(12-14)29(25,26)23(3)15-10-8-13(2)9-11-15/h5-12H,4H2,1-3H3,(H,20,21,24)	ZHXMHIXLYABNRL-UHFFFAOYSA-N	448.06975261							119877
MLS000558410	LSM-44347	SID17408266, BRD-K99650219	5768774	InChI=1S/C22H15N3O2S/c1-14-4-9-18-19(11-14)25-21(24-18)16(13-23)12-15-5-7-17(8-6-15)27-22(26)20-3-2-10-28-20/h2-12H,1H3,(H,24,25)/b16-12-	QXYPVJXRFOEQBR-VBKFSLOCSA-N	Cc1ccc2[nH]c(nc2c1)\C(=C/c3ccc(OC(=O)c4cccs4)cc3)\C#N	BroadT	BRD-K99650219	BRD-K99650219-001-07-1	Asinex Ltd.	BAS 05283074			Cc1ccc2[nH]c(nc2c1)C(=C/c1ccc(OC(=O)c2cccs2)cc1)\C#N	InChI=1S/C22H15N3O2S/c1-14-4-9-18-19(11-14)25-21(24-18)16(13-23)12-15-5-7-17(8-6-15)27-22(26)20-3-2-10-28-20/h2-12H,1H3,(H,24,25)/b16-12-	QXYPVJXRFOEQBR-VBKFSLOCSA-N	385.08849744							
SMR000026554	LSM-31323	BRD-K63189715, SID4243280	3238023	InChI=1S/C8H13N3O/c12-8-5-7(10-11-8)6-1-3-9-4-2-6/h5-6,9H,1-4H2,(H2,10,11,12)	ZEIPMWRDENQLAY-UHFFFAOYSA-N	Oc1cc([nH]n1)C2CCNCC2	BroadT	BRD-K63189715	BRD-K63189715-001-06-3	ChemDiv Inc.	C429-0038			Oc1cc([nH]n1)C1CCNCC1	InChI=1S/C8H13N3O/c12-8-5-7(10-11-8)6-1-3-9-4-2-6/h5-6,9H,1-4H2,(H2,10,11,12)	ZEIPMWRDENQLAY-UHFFFAOYSA-N	167.105862066							119879
AC1MLRQW	LSM-15439	BRD-K44061011	3226616	InChI=1S/C20H26N2O/c1-16(2)13-14-21-15-19(23)22-20(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,16,20-21H,13-15H2,1-2H3,(H,22,23)	OYIJAAHWFPOJPJ-UHFFFAOYSA-N	CC(C)CCNCC(=O)NC(c1ccccc1)c2ccccc2	BroadT	BRD-K44061011	BRD-K44061011-003-07-3	Asinex Ltd.	ASN 06976839		Cl	CC(C)CCNCC(=O)NC(c1ccccc1)c1ccccc1.Cl	InChI=1S/C20H26N2O.ClH/c1-16(2)13-14-21-15-19(23)22-20(17-9-5-3-6-10-17)18-11-7-4-8-12-18;/h3-12,16,20-21H,13-15H2,1-2H3,(H,22,23);1H	QWMPKMZHNITILL-UHFFFAOYSA-N	310.204513472							104081, 104081
ZINC00843046	LSM-31324	BRD-K88135858	6751814	InChI=1S/C14H11BrN4O2S/c1-7-9(5-16)13(17)22-12(7)14(21)19-18-6-8-2-3-11(20)10(15)4-8/h2-4,6,20H,17H2,1H3,(H,19,21)	VUVMTYDFRBVXAN-UHFFFAOYSA-N	Cc1c(C#N)c(N)sc1C(=O)NN=Cc2ccc(O)c(Br)c2	BroadT	BRD-K88135858	BRD-K88135858-001-05-6	Asinex Ltd.	BAS 00883878			Cc1c(sc(N)c1C#N)C(=O)NN=Cc1ccc(O)c(Br)c1	InChI=1S/C14H11BrN4O2S/c1-7-9(5-16)13(17)22-12(7)14(21)19-18-6-8-2-3-11(20)10(15)4-8/h2-4,6,20H,17H2,1H3,(H,19,21)	VUVMTYDFRBVXAN-UHFFFAOYSA-N	377.978608922							
AO-476/43250143	LSM-31325	BRD-K95500860, SID17388567	7313804	InChI=1S/C15H12F3N5O/c1-8-6-9(2)23-13(19-8)12(14(24)22-23)21-20-11-5-3-4-10(7-11)15(16,17)18/h3-7H,1-2H3,(H,22,24)	FQVAFGRKZUFQLS-UHFFFAOYSA-N	CC1=NC2=C(N=Nc3cccc(c3)C(F)(F)F)C(=O)NN2C(=C1)C	BroadT	BRD-K95500860	BRD-K95500860-001-05-8	Specs	AO-476/43250143			Cc1cc(C)n2[nH]c(=O)c(N=Nc3cccc(c3)C(F)(F)F)c2n1	InChI=1S/C15H12F3N5O/c1-8-6-9(2)23-13(19-8)12(14(24)22-23)21-20-11-5-3-4-10(7-11)15(16,17)18/h3-7H,1-2H3,(H,22,24)	FQVAFGRKZUFQLS-UHFFFAOYSA-N	335.099394654							119881
AC1MORHN	LSM-31326	BRD-K44994529	3348122	InChI=1S/C27H21N3O2/c1-19-12-14-22(15-13-19)29-25-17-16-24(21-10-6-3-7-11-21)28-30(25)27(32)23(26(29)31)18-20-8-4-2-5-9-20/h2-17H,18H2,1H3/p+1	QJAKIKKJMJHLET-UHFFFAOYSA-O	Cc1ccc(cc1)-n1c2ccc(n[n+]2c(O)c(Cc2ccccc2)c1=O)-c1ccccc1	BroadT	BRD-K44994529	BRD-K44994529-001-06-6	Specs	AE-406/41056288			Cc1ccc(cc1)-[n+]1c(O)c(Cc2ccccc2)c(=O)n2nc(ccc12)-c1ccccc1	InChI=1S/C27H21N3O2/c1-19-12-14-22(15-13-19)29-25-17-16-24(21-10-6-3-7-11-21)28-30(25)27(32)23(26(29)31)18-20-8-4-2-5-9-20/h2-17H,18H2,1H3/p+1	QJAKIKKJMJHLET-UHFFFAOYSA-O	420.171201974							119882
ASN 05294214	LSM-31327	BRD-A09988375, SID847759	650168	InChI=1S/C27H28FN5O3/c28-22-13-5-4-12-21(22)26(27(35)29-19-9-2-1-3-10-19)32(17-20-11-8-16-36-20)25(34)18-33-24-15-7-6-14-23(24)30-31-33/h4-8,11-16,19,26H,1-3,9-10,17-18H2,(H,29,35)	YCQRDFYHFNERSC-UHFFFAOYSA-N	Fc1ccccc1C(N(Cc2occc2)C(=O)Cn3nnc4ccccc34)C(=O)NC5CCCCC5	BroadT	BRD-A09988375	BRD-A09988375-001-05-0	Asinex Ltd.	ASN 05294214			Fc1ccccc1C(N(Cc1ccco1)C(=O)Cn1nnc2ccccc12)C(=O)NC1CCCCC1	InChI=1S/C27H28FN5O3/c28-22-13-5-4-12-21(22)26(27(35)29-19-9-2-1-3-10-19)32(17-20-11-8-16-36-20)25(34)18-33-24-15-7-6-14-23(24)30-31-33/h4-8,11-16,19,26H,1-3,9-10,17-18H2,(H,29,35)	YCQRDFYHFNERSC-UHFFFAOYSA-N	489.217618006							119883
8-(3,5-Dimethyl-1H-pyrazol-1-yl)quinoline	LSM-31328	BRD-K37906761, SID4265189	773777	InChI=1S/C14H13N3/c1-10-9-11(2)17(16-10)13-7-3-5-12-6-4-8-15-14(12)13/h3-9H,1-2H3	BSSICVUIJQVDJZ-UHFFFAOYSA-N	Cc1cc(C)n(n1)c2cccc3cccnc23	BroadT	BRD-K37906761	BRD-K37906761-001-05-8	ChemBridge Corporation	5175185			Cc1cc(C)n(n1)-c1cccc2cccnc12	InChI=1S/C14H13N3/c1-10-9-11(2)17(16-10)13-7-3-5-12-6-4-8-15-14(12)13/h3-9H,1-2H3	BSSICVUIJQVDJZ-UHFFFAOYSA-N	223.110947446							119884
N-(5-Chloro-2,4-dimethoxyphenyl)-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propanamide	LSM-31329	BRD-K93806272, SID4246921	3241202	InChI=1S/C20H20ClN3O4/c1-12-4-6-13(7-5-12)20-23-19(28-24-20)9-8-18(25)22-15-10-14(21)16(26-2)11-17(15)27-3/h4-7,10-11H,8-9H2,1-3H3,(H,22,25)	IJDXGSUBOKJXAF-UHFFFAOYSA-N	COc1cc(OC)c(NC(=O)CCc2onc(n2)c3ccc(C)cc3)cc1Cl	BroadT	BRD-K93806272	BRD-K93806272-001-05-3	ChemDiv Inc.	C289-0499			COc1cc(OC)c(NC(=O)CCc2nc(no2)-c2ccc(C)cc2)cc1Cl	InChI=1S/C20H20ClN3O4/c1-12-4-6-13(7-5-12)20-23-19(28-24-20)9-8-18(25)22-15-10-14(21)16(26-2)11-17(15)27-3/h4-7,10-11H,8-9H2,1-3H3,(H,22,25)	IJDXGSUBOKJXAF-UHFFFAOYSA-N	401.11423386							119885
AC1LD2KN	LSM-31330	BRD-A59449038, SID858928	660234	InChI=1S/C16H18N2O3S2/c1-4-21-15(20)12-10(3)17-16-18(11(19)6-8-23-16)13(12)14-9(2)5-7-22-14/h5,7,13H,4,6,8H2,1-3H3	YMVAKWSISAHGDV-UHFFFAOYSA-N	CCOC(=O)C1=C(C)N=C2SCCC(=O)N2C1c3sccc3C	BroadT	BRD-A59449038	BRD-A59449038-001-05-1	InterBioScreen Ltd.	STOCK2S-81651			CCOC(=O)C1=C(C)N=C2SCCC(=O)N2C1c1sccc1C	InChI=1S/C16H18N2O3S2/c1-4-21-15(20)12-10(3)17-16-18(11(19)6-8-23-16)13(12)14-9(2)5-7-22-14/h5,7,13H,4,6,8H2,1-3H3	YMVAKWSISAHGDV-UHFFFAOYSA-N	350.075883836							119886
MLS001029587	LSM-15232	BRD-K62547690	921742	InChI=1S/C13H12N3O3S/c1-9(17)14-6-7-15-12(8-20-13(14)15)10-2-4-11(5-3-10)16(18)19/h2-5,8H,6-7H2,1H3/q+1	ICMZPORYJMYECY-UHFFFAOYSA-N	CC(=O)N1CC[n+]2c(csc12)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-K62547690	BRD-K62547690-004-05-8	InterBioScreen Ltd.	STOCK2S-45560		Br	CC(=O)N1CC[n+]2c1scc2-c1ccc(cc1)[N+]([O-])=O.Br	InChI=1S/C13H12N3O3S.BrH/c1-9(17)14-6-7-15-12(8-20-13(14)15)10-2-4-11(5-3-10)16(18)19;/h2-5,8H,6-7H2,1H3;1H/q+1;	MPWCRWMXBMTQCJ-UHFFFAOYSA-N	290.059936964							103879, 103879
SMR000064751	LSM-31331	BRD-K46306128, SID3717093	2562124	InChI=1S/C20H21N3O3/c1-2-6-16(7-3-1)25-14-15-26-20-19(23-10-12-24-13-11-23)21-17-8-4-5-9-18(17)22-20/h1-9H,10-15H2	ALFAINUKBRWQPH-UHFFFAOYSA-N	C(COc1nc2ccccc2nc1N3CCOCC3)Oc4ccccc4	BroadT	BRD-K46306128	BRD-K46306128-001-06-6	Enamine Ltd.	T5343246			C(COc1nc2ccccc2nc1N1CCOCC1)Oc1ccccc1	InChI=1S/C20H21N3O3/c1-2-6-16(7-3-1)25-14-15-26-20-19(23-10-12-24-13-11-23)21-17-8-4-5-9-18(17)22-20/h1-9H,10-15H2	ALFAINUKBRWQPH-UHFFFAOYSA-N	351.158291562							119887
MLS000389086	LSM-31332	BRD-K29178949, SID22411523	2371973	InChI=1S/C18H17N3OS/c1-2-22-15-8-6-14(7-9-15)20-18(23)21-17-5-3-4-13-12-19-11-10-16(13)17/h3-12H,2H2,1H3,(H2,20,21,23)	VLNSVTSRPOFHBE-UHFFFAOYSA-N	CCOc1ccc(NC(=Nc2cccc3cnccc23)S)cc1	BroadT	BRD-K29178949	BRD-K29178949-001-05-9	Enamine Ltd.	T0512-8251			CCOc1ccc(NC(S)=Nc2cccc3cnccc23)cc1	InChI=1S/C18H17N3OS/c1-2-22-15-8-6-14(7-9-15)20-18(23)21-17-5-3-4-13-12-19-11-10-16(13)17/h3-12H,2H2,1H3,(H2,20,21,23)	VLNSVTSRPOFHBE-UHFFFAOYSA-N	323.109232884							119888
BRD-K67142640	LSM-31333	BRD-K67142640		InChI=1S/C19H21N3O2/c1-12-17(13-7-5-4-6-8-13)18(22-21-12)20-11-14-15(23)9-19(2,3)10-16(14)24/h4-8,11,14H,9-10H2,1-3H3,(H,21,22)/b20-11+	APWDKGYMBHLHFT-RGVLZGJSSA-N	Cc1n[nH]c(\N=C\C2C(=O)CC(C)(C)CC2=O)c1c3ccccc3	BroadT	BRD-K67142640	BRD-K67142640-001-02-7	InterBioScreen Ltd.	STOCK5S-45787			Cc1n[nH]c(\N=C\C2C(=O)CC(C)(C)CC2=O)c1-c1ccccc1	InChI=1S/C19H21N3O2/c1-12-17(13-7-5-4-6-8-13)18(22-21-12)20-11-14-15(23)9-19(2,3)10-16(14)24/h4-8,11,14H,9-10H2,1-3H3,(H,21,22)/b20-11+	APWDKGYMBHLHFT-RGVLZGJSSA-N	323.163376942							
3,5-Dimethyl-2,6-bis(4-methylphenyl)piperidin-4-one	LSM-31334	BRD-A69097282, SID26663393	3123755	InChI=1S/C21H25NO/c1-13-5-9-17(10-6-13)19-15(3)21(23)16(4)20(22-19)18-11-7-14(2)8-12-18/h5-12,15-16,19-20,22H,1-4H3	ORKDRKWSOGIHNW-UHFFFAOYSA-N	CC1C(NC(C(C)C1=O)c2ccc(C)cc2)c3ccc(C)cc3	BroadT	BRD-A69097282	BRD-A69097282-001-05-9	InterBioScreen Ltd.	STOCK2S-96559			CC1C(NC(C(C)C1=O)c1ccc(C)cc1)c1ccc(C)cc1	InChI=1S/C21H25NO/c1-13-5-9-17(10-6-13)19-15(3)21(23)16(4)20(22-19)18-11-7-14(2)8-12-18/h5-12,15-16,19-20,22H,1-4H3	ORKDRKWSOGIHNW-UHFFFAOYSA-N	307.19361443							119890
N-(3-Chlorophenyl)-4-(9H-fluoren-9-yl)tetrahydro-1(2H)-pyrazinecarboxamide	LSM-31335	SID26728300	2814681	InChI=1S/C24H22ClN3O/c25-17-6-5-7-18(16-17)26-24(29)28-14-12-27(13-15-28)23-21-10-3-1-8-19(21)20-9-2-4-11-22(20)23/h1-11,16,23H,12-15H2,(H,26,29)	WQVCTQFONPCJLZ-UHFFFAOYSA-N	Clc1cccc(NC(=O)N2CCN(CC2)C3c4ccccc4c5ccccc35)c1	BroadT	BRD-K75806288	BRD-K75806288-001-05-7	Maybridge	HTS 09197			Clc1cccc(NC(=O)N2CCN(CC2)C2c3ccccc3-c3ccccc23)c1	InChI=1S/C24H22ClN3O/c25-17-6-5-7-18(16-17)26-24(29)28-14-12-27(13-15-28)23-21-10-3-1-8-19(21)20-9-2-4-11-22(20)23/h1-11,16,23H,12-15H2,(H,26,29)	WQVCTQFONPCJLZ-UHFFFAOYSA-N	403.145140064							119891
2-Methyl-n-(2-{1-[2-(4-methylphenoxy)ethyl]benzimidazol-2-yl}ethyl)propanamide	LSM-31336	BRD-K40088786, SID17406636	993360	InChI=1S/C22H27N3O2/c1-16(2)22(26)23-13-12-21-24-19-6-4-5-7-20(19)25(21)14-15-27-18-10-8-17(3)9-11-18/h4-11,16H,12-15H2,1-3H3,(H,23,26)	CJVQRFZCPZIECX-UHFFFAOYSA-N	CC(C)C(=O)NCCc1nc2ccccc2n1CCOc3ccc(C)cc3	BroadT	BRD-K40088786	BRD-K40088786-001-05-1	Specs	AP-906/42697877			CC(C)C(=O)NCCc1nc2ccccc2n1CCOc1ccc(C)cc1	InChI=1S/C22H27N3O2/c1-16(2)22(26)23-13-12-21-24-19-6-4-5-7-20(19)25(21)14-15-27-18-10-8-17(3)9-11-18/h4-11,16H,12-15H2,1-3H3,(H,23,26)	CJVQRFZCPZIECX-UHFFFAOYSA-N	365.210327134							119892
BDBM69224	LSM-31337	BRD-A55020151	91897803	InChI=1S/C15H16N4OS/c1-15(2)6-9-12(10(20)7-15)13(11-4-3-5-21-11)19-14(18-9)16-8-17-19/h3-5,8,12-13H,6-7H2,1-2H3	NYAWKGHPYMRXCW-UHFFFAOYSA-N	CC1(C)CC(=O)C2C(c3cccs3)n4ncnc4N=C2C1	BroadT	BRD-A55020151	BRD-A55020151-001-06-3	Asinex Ltd.	BAS 06911248			CC1(C)CC(=O)C2C(c3cccs3)n3ncnc3N=C2C1	InChI=1S/C15H16N4OS/c1-15(2)6-9-12(10(20)7-15)13(11-4-3-5-21-11)19-14(18-9)16-8-17-19/h3-5,8,12-13H,6-7H2,1-2H3	NYAWKGHPYMRXCW-UHFFFAOYSA-N	300.104481862							119893
T5310221	LSM-31338	BRD-K26680822, SID14745523	4878352	InChI=1S/C21H23N3O2/c1-21(2,3)16-4-6-17(7-5-16)23-20(25)14-26-19-10-8-18(9-11-19)24-13-12-22-15-24/h4-13,15H,14H2,1-3H3,(H,23,25)	NZFCFDWXPKNCBN-UHFFFAOYSA-N	CC(C)(C)c1ccc(NC(=O)COc2ccc(cc2)n3ccnc3)cc1	BroadT	BRD-K26680822	BRD-K26680822-001-06-7	Enamine Ltd.	T5310221			CC(C)(C)c1ccc(NC(=O)COc2ccc(cc2)-n2ccnc2)cc1	InChI=1S/C21H23N3O2/c1-21(2,3)16-4-6-17(7-5-16)23-20(25)14-26-19-10-8-18(9-11-19)24-13-12-22-15-24/h4-13,15H,14H2,1-3H3,(H,23,25)	NZFCFDWXPKNCBN-UHFFFAOYSA-N	349.179027006							119894
Ethyl 5-hydroxy-1,2-dimethyl-4,6-dinitro-1H-indole-3-carboxylate	LSM-31339	BRD-K83307202, SID26671065	1421158	InChI=1S/C13H13N3O7/c1-4-23-13(18)9-6(2)14(3)7-5-8(15(19)20)12(17)11(10(7)9)16(21)22/h5,17H,4H2,1-3H3	PBNUPOARCGPMPA-UHFFFAOYSA-N	CCOC(=O)c1c(C)n(C)c2cc(c(O)c(c12)[N+](=O)[O-])[N+](=O)[O-]	BroadT	BRD-K83307202	BRD-K83307202-001-05-9	InterBioScreen Ltd.	STOCK1S-09306			CCOC(=O)c1c(C)n(C)c2cc(c(O)c([N+]([O-])=O)c12)[N+]([O-])=O	InChI=1S/C13H13N3O7/c1-4-23-13(18)9-6(2)14(3)7-5-8(15(19)20)12(17)11(10(7)9)16(21)22/h5,17H,4H2,1-3H3	PBNUPOARCGPMPA-UHFFFAOYSA-N	323.075349786							119895
BRD-A12830281	LSM-31340	BRD-A12830281		InChI=1S/C15H13ClF3N3O2/c1-9-12(20-8-11(16)13(23)15(17,18)19)14(24)22(21(9)2)10-6-4-3-5-7-10/h3-8,11H,1-2H3	NOQGFDAJCNDPKM-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)N=CC(Cl)C(=O)C(F)(F)F)c2ccccc2	BroadT	BRD-A12830281	BRD-A12830281-001-05-2	Enamine Ltd.	T0503-2689			Cc1c(N=CC(Cl)C(=O)C(F)(F)F)c(=O)n(-c2ccccc2)n1C	InChI=1S/C15H13ClF3N3O2/c1-9-12(20-8-11(16)13(23)15(17,18)19)14(24)22(21(9)2)10-6-4-3-5-7-10/h3-8,11H,1-2H3	NOQGFDAJCNDPKM-UHFFFAOYSA-N	359.064838996							119896
3-Nitro-benzoic acid n'-(2,4,6-trichloro-phenyl)-hydrazide	LSM-31341	BRD-K32195266, SID17509032	3099153	InChI=1S/C13H8Cl3N3O3/c14-8-5-10(15)12(11(16)6-8)17-18-13(20)7-2-1-3-9(4-7)19(21)22/h1-6,17H,(H,18,20)	AWRCFPCUTJOIKR-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C(=O)NNc2c(Cl)cc(Cl)cc2Cl	BroadT	BRD-K32195266	BRD-K32195266-001-06-1	Asinex Ltd.	BAS 00316061			[O-][N+](=O)c1cccc(c1)C(=O)NNc1c(Cl)cc(Cl)cc1Cl	InChI=1S/C13H8Cl3N3O3/c14-8-5-10(15)12(11(16)6-8)17-18-13(20)7-2-1-3-9(4-7)19(21)22/h1-6,17H,(H,18,20)	AWRCFPCUTJOIKR-UHFFFAOYSA-N	358.963124276							119897
ZINC02282862	LSM-31342	BRD-K99331869	6803818	InChI=1S/C15H15N3O4S/c1-22-11-5-2-4-10(14(11)20)8-17-18-13(19)9-16-15(21)12-6-3-7-23-12/h2-8,20H,9H2,1H3,(H,16,21)(H,18,19)	GUGRJRXPFDZVJT-UHFFFAOYSA-N	COc1cccc(C=NNC(=O)CNC(=O)c2cccs2)c1O	BroadT	BRD-K99331869	BRD-K99331869-001-07-1	InterBioScreen Ltd.	STOCK1S-77017			COc1cccc(C=NNC(=O)CNC(=O)c2cccs2)c1O	InChI=1S/C15H15N3O4S/c1-22-11-5-2-4-10(14(11)20)8-17-18-13(19)9-16-15(21)12-6-3-7-23-12/h2-8,20H,9H2,1H3,(H,16,21)(H,18,19)	GUGRJRXPFDZVJT-UHFFFAOYSA-N	333.07832668							
MLS001125449	LSM-31343	BRD-K45091989, SID49737369	1494312	InChI=1S/C22H22ClN3O2/c1-25-12-14-26(15-13-25)19-8-6-18(7-9-19)24-22(27)21-11-10-20(28-21)16-2-4-17(23)5-3-16/h2-11H,12-15H2,1H3,(H,24,27)	QONRQALSXOAURD-UHFFFAOYSA-N	CN1CCN(CC1)c2ccc(NC(=O)c3oc(cc3)c4ccc(Cl)cc4)cc2	BroadT	BRD-K45091989	BRD-K45091989-001-06-3	ChemBridge Corporation	7652573			CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)-c2ccc(Cl)cc2)cc1	InChI=1S/C22H22ClN3O2/c1-25-12-14-26(15-13-25)19-8-6-18(7-9-19)24-22(27)21-11-10-20(28-21)16-2-4-17(23)5-3-16/h2-11H,12-15H2,1H3,(H,24,27)	QONRQALSXOAURD-UHFFFAOYSA-N	395.140054684							119899
MLS001124247	LSM-31344	BRD-K19969409, SID24399605, SID49730457	16021249	InChI=1S/C22H23BrN4O5S/c1-31-20-8-7-17(13-21(20)32-2)33(29,30)27-11-9-26(10-12-27)22(28)19-14-18(24-25-19)15-3-5-16(23)6-4-15/h3-8,13-14H,9-12H2,1-2H3,(H,24,25)	RXXUHNKUUKIHHZ-UHFFFAOYSA-N	COc1ccc(cc1OC)S(=O)(=O)N2CCN(CC2)C(=O)c3cc([nH]n3)c4ccc(Br)cc4	BroadT	BRD-K19969409	BRD-K19969409-001-05-6	ChemDiv Inc.	E687-0349			COc1ccc(cc1OC)S(=O)(=O)N1CCN(CC1)C(=O)c1cc([nH]n1)-c1ccc(Br)cc1	InChI=1S/C22H23BrN4O5S/c1-31-20-8-7-17(13-21(20)32-2)33(29,30)27-11-9-26(10-12-27)22(28)19-14-18(24-25-19)15-3-5-16(23)6-4-15/h3-8,13-14H,9-12H2,1-2H3,(H,24,25)	RXXUHNKUUKIHHZ-UHFFFAOYSA-N	534.057253166							119900
MLS000860639	LSM-31345	BRD-K88538240, SID26726539	2814376	InChI=1S/C21H27N3O3S/c1-4-17-13-18(20(26)15-5-7-16(27-3)8-6-15)21(28-17)22-19(25)14-24-11-9-23(2)10-12-24/h5-8,13H,4,9-12,14H2,1-3H3,(H,22,25)	PGLUPFDXMXYLKD-UHFFFAOYSA-N	CCc1cc(C(=O)c2ccc(OC)cc2)c(NC(=O)CN3CCN(C)CC3)s1	BroadT	BRD-K88538240	BRD-K88538240-001-06-6	Maybridge	HTS 08688			CCc1cc(C(=O)c2ccc(OC)cc2)c(NC(=O)CN2CCN(C)CC2)s1	InChI=1S/C21H27N3O3S/c1-4-17-13-18(20(26)15-5-7-16(27-3)8-6-15)21(28-17)22-19(25)14-24-11-9-23(2)10-12-24/h5-8,13H,4,9-12,14H2,1-3H3,(H,22,25)	PGLUPFDXMXYLKD-UHFFFAOYSA-N	401.177312444							119901
N-(4-Chlorophenyl)-n-ethyl-6-(isopropylamino)-4-(trifluoromethyl)nicotinamide	LSM-31346	SID26730741	2727043	InChI=1S/C18H19ClF3N3O/c1-4-25(13-7-5-12(19)6-8-13)17(26)14-10-23-16(24-11(2)3)9-15(14)18(20,21)22/h5-11H,4H2,1-3H3,(H,23,24)	FSMWWOWLPLWAIA-UHFFFAOYSA-N	CCN(C(=O)c1cnc(NC(C)C)cc1C(F)(F)F)c2ccc(Cl)cc2	BroadT	BRD-K30863464	BRD-K30863464-001-05-8	Maybridge	RF 04446			CCN(C(=O)c1cnc(NC(C)C)cc1C(F)(F)F)c1ccc(Cl)cc1	InChI=1S/C18H19ClF3N3O/c1-4-25(13-7-5-12(19)6-8-13)17(26)14-10-23-16(24-11(2)3)9-15(14)18(20,21)22/h5-11H,4H2,1-3H3,(H,23,24)	FSMWWOWLPLWAIA-UHFFFAOYSA-N	385.116874568							119902
MLS000779999	LSM-43615	BRD-K36314834	1894310	InChI=1S/C23H20NO3/c25-21(20-8-9-22-23(16-20)27-15-14-26-22)17-24-12-10-19(11-13-24)7-6-18-4-2-1-3-5-18/h1-13,16H,14-15,17H2/q+1/b7-6+	OJKCNTHDYHCWIV-VOTSOKGWSA-N	O=C(C[n+]1ccc(\C=C\c2ccccc2)cc1)c3ccc4OCCOc4c3	BroadT	BRD-K36314834	BRD-K36314834-004-06-1	InterBioScreen Ltd.	STOCK1S-04270		Br	O=C(C[n+]1ccc(\C=C\c2ccccc2)cc1)c1ccc2OCCOc2c1.Br	InChI=1S/C23H20NO3.BrH/c25-21(20-8-9-22-23(16-20)27-15-14-26-22)17-24-12-10-19(11-13-24)7-6-18-4-2-1-3-5-18;/h1-13,16H,14-15,17H2;1H/q+1;/b7-6+;	ZRJVMJROYYLVHQ-UHDJGPCESA-N	358.14431851							, 
MLS000531624	LSM-31347	BRD-K56054222, SID103023207, SID14738954	972980	InChI=1S/C16H14N2O2S/c1-20-14-4-2-3-12(9-14)17-16-18-15(10-21-16)11-5-7-13(19)8-6-11/h2-10,19H,1H3,(H,17,18)	IFCQEPWFSBLITN-UHFFFAOYSA-N	COc1cccc(Nc2nc(cs2)c3ccc(O)cc3)c1	BroadT	BRD-K56054222	BRD-K56054222-001-09-8	ChemBridge Corporation	7874229			COc1cccc(Nc2nc(cs2)-c2ccc(O)cc2)c1	InChI=1S/C16H14N2O2S/c1-20-14-4-2-3-12(9-14)17-16-18-15(10-21-16)11-5-7-13(19)8-6-11/h2-10,19H,1H3,(H,17,18)	IFCQEPWFSBLITN-UHFFFAOYSA-N	298.077598398							119903
ZINC00224057	LSM-15440	BRD-K06573818	758980	InChI=1S/C13H17N3S/c1-9-7-11-12(14-8-15-13(11)17-9)16-10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3,(H,14,15,16)	JPZZUSOFXUSHBG-UHFFFAOYSA-N	Cc1cc2c(NC3CCCCC3)ncnc2s1	BroadT	BRD-K06573818	BRD-K06573818-003-05-2	ChemBridge Corporation	7956555		Cl	Cc1cc2c(NC3CCCCC3)ncnc2s1.Cl	InChI=1S/C13H17N3S.ClH/c1-9-7-11-12(14-8-15-13(11)17-9)16-10-5-3-2-4-6-10;/h7-8,10H,2-6H2,1H3,(H,14,15,16);1H	YKPNOQDWFFDBQA-UHFFFAOYSA-N	247.114318264							104082, 104082
AC1OA0A4	LSM-31348	BRD-K31348453, SID845249	6742828	InChI=1S/C18H19N3O2/c1-2-23-16-9-11(7-8-15(16)22)17-12-5-3-4-6-14(12)21-18(20)13(17)10-19/h7-9,22H,2-6H2,1H3,(H2,20,21)	LESHKYOXMGUUAJ-UHFFFAOYSA-N	CCOc1cc(ccc1O)c2c3CCCCc3nc(N)c2C#N	BroadT	BRD-K31348453	BRD-K31348453-001-05-2	Asinex Ltd.	BAS 00801654			CCOc1cc(ccc1O)-c1c2CCCCc2nc(N)c1C#N	InChI=1S/C18H19N3O2/c1-2-23-16-9-11(7-8-15(16)22)17-12-5-3-4-6-14(12)21-18(20)13(17)10-19/h7-9,22H,2-6H2,1H3,(H2,20,21)	LESHKYOXMGUUAJ-UHFFFAOYSA-N	309.147726878							
BRD-A68123879	LSM-44348		15945102	InChI=1S/C26H31N5O3S/c1-5-16-34-22-14-10-20(11-15-22)27-25(33)23-17-24(32)28-26(35-23)30-29-18(2)6-7-19-8-12-21(13-9-19)31(3)4/h6-15,23H,5,16-17H2,1-4H3,(H,27,33)(H,28,30,32)/b7-6+,29-18?	IFHKKRVUCWHOFP-UWLYSBJASA-N	CCCOc1ccc(NC(=O)C2CC(=O)N=C(NN=C(C)\C=C\c3ccc(cc3)N(C)C)S2)cc1	BroadT	BRD-A68123879	BRD-A68123879-001-05-3	ChemDiv Inc.	4507-0380			CCCOc1ccc(NC(=O)C2CC(=O)N=C(NN=C(C)\C=C\c3ccc(cc3)N(C)C)S2)cc1	InChI=1S/C26H31N5O3S/c1-5-16-34-22-14-10-20(11-15-22)27-25(33)23-17-24(32)28-26(35-23)30-29-18(2)6-7-19-8-12-21(13-9-19)31(3)4/h6-15,23H,5,16-17H2,1-4H3,(H,27,33)(H,28,30,32)/b7-6+,29-18?	IFHKKRVUCWHOFP-UWLYSBJASA-N	493.214760592							
AC1ME9J7	LSM-31350	BRD-K87580376	2851498	InChI=1S/C24H28N8O3/c33-32(34)19-9-7-18(8-10-19)21-12-11-20(35-21)17-25-29-22-26-23(30-13-3-1-4-14-30)28-24(27-22)31-15-5-2-6-16-31/h7-12,17H,1-6,13-16H2,(H,26,27,28,29)	ITGQRXDFZKKNJK-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)c2oc(C=NNc3nc(nc(n3)N4CCCCC4)N5CCCCC5)cc2	BroadT	BRD-K87580376	BRD-K87580376-001-04-0	Asinex Ltd.	BAS 00137462			[O-][N+](=O)c1ccc(cc1)-c1ccc(C=NNc2nc(nc(n2)N2CCCCC2)N2CCCCC2)o1	InChI=1S/C24H28N8O3/c33-32(34)19-9-7-18(8-10-19)21-12-11-20(35-21)17-25-29-22-26-23(30-13-3-1-4-14-30)28-24(27-22)31-15-5-2-6-16-31/h7-12,17H,1-6,13-16H2,(H,26,27,28,29)	ITGQRXDFZKKNJK-UHFFFAOYSA-N	476.228436836							119906
ST50676696	LSM-31351	BRD-K25426017, SID4240760	3235827	InChI=1S/C14H11N3O3/c18-14(16-9-10-3-1-5-15-8-10)11-7-13(20-17-11)12-4-2-6-19-12/h1-8H,9H2,(H,16,18)	NZMDZPXWHISYGX-UHFFFAOYSA-N	O=C(NCc1cccnc1)c2cc(on2)c3occc3	BroadT	BRD-K25426017	BRD-K25426017-001-06-1	ChemDiv Inc.	C226-1711			O=C(NCc1cccnc1)c1cc(on1)-c1ccco1	InChI=1S/C14H11N3O3/c18-14(16-9-10-3-1-5-15-8-10)11-7-13(20-17-11)12-4-2-6-19-12/h1-8H,9H2,(H,16,18)	NZMDZPXWHISYGX-UHFFFAOYSA-N	269.080041242							119907
STK323804	LSM-31352	BRD-K06834318, SID17432123	953635	InChI=1S/C16H14N2O3S/c19-15(12-6-7-13-14(8-12)21-10-20-13)18-16(22)17-9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H2,17,18,19,22)	BQGFVPVBPAIIPR-UHFFFAOYSA-N	O=C(NC(=S)NCc1ccccc1)c2ccc3OCOc3c2	BroadT	BRD-K06834318	BRD-K06834318-001-05-7	ChemBridge Corporation	7854860			O=C(NC(=S)NCc1ccccc1)c1ccc2OCOc2c1	InChI=1S/C16H14N2O3S/c19-15(12-6-7-13-14(8-12)21-10-20-13)18-16(22)17-9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H2,17,18,19,22)	BQGFVPVBPAIIPR-UHFFFAOYSA-N	314.072513018							119908
F0656-1165	LSM-31353	BRD-K82401173, SID7971900	5310583	InChI=1S/C23H22N6O3/c1-2-32-18-11-9-17(10-12-18)29-22-21(25-26-29)23(31)27(15-24-22)14-20(30)28-13-5-7-16-6-3-4-8-19(16)28/h3-4,6,8-12,15H,2,5,7,13-14H2,1H3	JHXHUBRDXYJIRT-UHFFFAOYSA-N	CCOc1ccc(cc1)n2nnc3C(=O)N(CC(=O)N4CCCc5ccccc45)C=Nc23	BroadT	BRD-K82401173	BRD-K82401173-001-05-6	Life Chemicals Inc.	F0656-1165			CCOc1ccc(cc1)-n1nnc2c1ncn(CC(=O)N1CCCc3ccccc13)c2=O	InChI=1S/C23H22N6O3/c1-2-32-18-11-9-17(10-12-18)29-22-21(25-26-29)23(31)27(15-24-22)14-20(30)28-13-5-7-16-6-3-4-8-19(16)28/h3-4,6,8-12,15H,2,5,7,13-14H2,1H3	JHXHUBRDXYJIRT-UHFFFAOYSA-N	430.175338624							119909
N-(3,4-Dimethylphenyl)-2-[(1-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide	LSM-31354	BRD-K55072060, SID14719069	3344345	InChI=1S/C18H18N4OS/c1-13-8-9-15(10-14(13)2)20-17(23)11-24-18-19-12-22(21-18)16-6-4-3-5-7-16/h3-10,12H,11H2,1-2H3,(H,20,23)	CWBPXDVAGWTBGR-UHFFFAOYSA-N	Cc1ccc(NC(=O)CSc2ncn(n2)c3ccccc3)cc1C	BroadT	BRD-K55072060	BRD-K55072060-001-05-4	Specs	AM-879/42240805			Cc1ccc(NC(=O)CSc2ncn(n2)-c2ccccc2)cc1C	InChI=1S/C18H18N4OS/c1-13-8-9-15(10-14(13)2)20-17(23)11-24-18-19-12-22(21-18)16-6-4-3-5-7-16/h3-10,12H,11H2,1-2H3,(H,20,23)	CWBPXDVAGWTBGR-UHFFFAOYSA-N	338.120131926							119910
AO-476/43250325	LSM-31355	BRD-K78983822, SID17388381	1234436	InChI=1S/C23H19N5O3/c1-4-31-22(30)20-26-28(18-8-6-5-7-15(18)3)23-25-19(16-11-9-14(2)10-12-16)17(13-24)21(29)27(20)23/h5-12H,4H2,1-3H3	WNACGRHPAGFFFN-UHFFFAOYSA-N	CCOC(=O)C1=NN(C2=NC(=C(C#N)C(=O)N12)c3ccc(C)cc3)c4ccccc4C	BroadT	BRD-K78983822	BRD-K78983822-001-05-4	Specs	AO-476/43250325			CCOC(=O)c1nn(-c2ccccc2C)c2nc(-c3ccc(C)cc3)c(C#N)c(=O)n12	InChI=1S/C23H19N5O3/c1-4-31-22(30)20-26-28(18-8-6-5-7-15(18)3)23-25-19(16-11-9-14(2)10-12-16)17(13-24)21(29)27(20)23/h5-12H,4H2,1-3H3	WNACGRHPAGFFFN-UHFFFAOYSA-N	413.148789518							119911
MLS000849680	LSM-31356	BRD-K29458940, SID26670217	16682627	InChI=1S/C18H16ClN3O2/c1-10(2)20-17(23)11-3-5-14-15(8-11)21-22-16-6-4-13(19)7-12(16)9-24-18(14)22/h3-8,10H,9H2,1-2H3,(H,20,23)	KHAMQGKCFWSRSR-UHFFFAOYSA-N	CC(C)NC(=O)c1ccc2c3OCc4cc(Cl)ccc4n3nc2c1	BroadT	BRD-K29458940	BRD-K29458940-001-05-4	University of California at Davis	JDB-021			CC(C)NC(=O)c1ccc2c3OCc4cc(Cl)ccc4-n3nc2c1	InChI=1S/C18H16ClN3O2/c1-10(2)20-17(23)11-3-5-14-15(8-11)21-22-16-6-4-13(19)7-12(16)9-24-18(14)22/h3-8,10H,9H2,1-2H3,(H,20,23)	KHAMQGKCFWSRSR-UHFFFAOYSA-N	341.093104492							119912
AC1OAB54	LSM-31357	BRD-A25869984, SID26658429	6801971	InChI=1S/C15H12FN3O3/c16-12-4-2-1-3-10(12)13-8-14(18-17-13)11-7-9(19(21)22)5-6-15(11)20/h1-7,13,17,20H,8H2	OKWVXVZNZAVFBE-UHFFFAOYSA-N	Oc1ccc(cc1C2=NNC(C2)c3ccccc3F)[N+](=O)[O-]	BroadT	BRD-A25869984	BRD-A25869984-001-05-5	InterBioScreen Ltd.	STOCK2S-80587			Oc1ccc(cc1C1=NNC(C1)c1ccccc1F)[N+]([O-])=O	InChI=1S/C15H12FN3O3/c16-12-4-2-1-3-10(12)13-8-14(18-17-13)11-7-9(19(21)22)5-6-15(11)20/h1-7,13,17,20H,8H2	OKWVXVZNZAVFBE-UHFFFAOYSA-N	301.086269474							
STK223377	LSM-44349	SID24792279, BRD-K70408591	5735910	InChI=1S/C17H14FNO2/c1-12(20)19-16-4-2-3-14(11-16)17(21)10-7-13-5-8-15(18)9-6-13/h2-11H,1H3,(H,19,20)/b10-7+	GRFCLYLDLHMARH-JXMROGBWSA-N	CC(=O)Nc1cccc(c1)C(=O)\C=C\c2ccc(F)cc2	BroadT	BRD-K70408591	BRD-K70408591-001-05-9	ChemBridge Corporation	7089380			CC(=O)Nc1cccc(c1)C(=O)\C=C\c1ccc(F)cc1	InChI=1S/C17H14FNO2/c1-12(20)19-16-4-2-3-14(11-16)17(21)10-7-13-5-8-15(18)9-6-13/h2-11H,1H3,(H,19,20)/b10-7+	GRFCLYLDLHMARH-JXMROGBWSA-N	283.100856898							
SMR000012050	LSM-31359	BRD-K73995655, SID844796	54682906	InChI=1S/C16H13N3O3S/c20-13-10-5-1-3-9-4-2-7-19(12(9)10)15(22)11(13)14(21)18-16-17-6-8-23-16/h1,3,5-6,8,20H,2,4,7H2,(H,17,18,21)	NTLLMIRIELGOBW-UHFFFAOYSA-N	OC1=C(C(=O)Nc2nccs2)C(=O)N3CCCc4cccc1c34	BroadT	BRD-K73995655	BRD-K73995655-001-03-0	Asinex Ltd.	BAS 03189462			Oc1c(C(=O)Nc2nccs2)c(=O)n2CCCc3cccc1c23	InChI=1S/C16H13N3O3S/c20-13-10-5-1-3-9-4-2-7-19(12(9)10)15(22)11(13)14(21)18-16-17-6-8-23-16/h1,3,5-6,8,20H,2,4,7H2,(H,17,18,21)	NTLLMIRIELGOBW-UHFFFAOYSA-N	327.067761996							131298
SMR000063726	LSM-31360	BRD-K48516290, SID24839942, SID3717294	2104695	InChI=1S/C21H22F2N4O3S2/c22-13-5-6-15(23)17(11-13)32(28,29)26-20-19-14-3-1-2-4-16(14)31-21(19)25-18(24-20)12-27-7-9-30-10-8-27/h5-6,11H,1-4,7-10,12H2,(H,24,25,26)	HDYBLZRIPDHFTL-UHFFFAOYSA-N	Fc1ccc(F)c(c1)S(=O)(=O)Nc2nc(CN3CCOCC3)nc4sc5CCCCc5c24	BroadT	BRD-K48516290	BRD-K48516290-001-05-2	Enamine Ltd.	T5250816			Fc1ccc(F)c(c1)S(=O)(=O)Nc1nc(CN2CCOCC2)nc2sc3CCCCc3c12	InChI=1S/C21H22F2N4O3S2/c22-13-5-6-15(23)17(11-13)32(28,29)26-20-19-14-3-1-2-4-16(14)31-21(19)25-18(24-20)12-27-7-9-30-10-8-27/h5-6,11H,1-4,7-10,12H2,(H,24,25,26)	HDYBLZRIPDHFTL-UHFFFAOYSA-N	480.110138384							119917
AC1MWDW5	LSM-31361	BRD-K72071403, SID26665666	3747674	InChI=1S/C13H17N5OS2/c1-3-14-12(20)17-16-11(19)8-21-13-15-9-6-4-5-7-10(9)18(13)2/h4-7H,3,8H2,1-2H3,(H,16,19)(H2,14,17,20)	HEFMVHKKBJXDAX-UHFFFAOYSA-N	CCN=C(S)NNC(=O)CSc1nc2ccccc2n1C	BroadT	BRD-K72071403	BRD-K72071403-001-05-1	InterBioScreen Ltd.	STOCK3S-59775			CCN=C(S)NNC(=O)CSc1nc2ccccc2n1C	InChI=1S/C13H17N5OS2/c1-3-14-12(20)17-16-11(19)8-21-13-15-9-6-4-5-7-10(9)18(13)2/h4-7H,3,8H2,1-2H3,(H,16,19)(H2,14,17,20)	HEFMVHKKBJXDAX-UHFFFAOYSA-N	323.087451594							119918
4-({3-[(2-Methoxyphenyl)carbamoyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl}amino)-4-oxobutanoic acid	LSM-31362	BRD-K62967214, SID26658489	1915036	InChI=1S/C21H24N2O5S/c1-28-15-9-6-5-8-14(15)22-20(27)19-13-7-3-2-4-10-16(13)29-21(19)23-17(24)11-12-18(25)26/h5-6,8-9H,2-4,7,10-12H2,1H3,(H,22,27)(H,23,24)(H,25,26)	DFGDSWGIYUFWQJ-UHFFFAOYSA-N	COc1ccccc1NC(=O)c2c3CCCCCc3sc2NC(=O)CCC(=O)O	BroadT	BRD-K62967214	BRD-K62967214-001-06-9	InterBioScreen Ltd.	STOCK2S-04744			COc1ccccc1NC(=O)c1c(NC(=O)CCC(O)=O)sc2CCCCCc12	InChI=1S/C21H24N2O5S/c1-28-15-9-6-5-8-14(15)22-20(27)19-13-7-3-2-4-10-16(13)29-21(19)23-17(24)11-12-18(25)26/h5-6,8-9H,2-4,7,10-12H2,1H3,(H,22,27)(H,23,24)(H,25,26)	DFGDSWGIYUFWQJ-UHFFFAOYSA-N	416.140592578							119919
CBMICRO_025216	LSM-31363	BRD-K02675272, SID14735771	6614526	InChI=1S/C16H19N3O2/c1-5-21-16(20)14-11(3)15(17-12(14)4)19-18-13-9-7-6-8-10(13)2/h6-9,17H,5H2,1-4H3	PXUQZPRBLNBYBX-UHFFFAOYSA-N	CCOC(=O)c1c(C)[nH]c(N=Nc2ccccc2C)c1C	BroadT	BRD-K02675272	BRD-K02675272-001-05-2	ChemBridge Corporation	5572674			CCOC(=O)c1c(C)[nH]c(N=Nc2ccccc2C)c1C	InChI=1S/C16H19N3O2/c1-5-21-16(20)14-11(3)15(17-12(14)4)19-18-13-9-7-6-8-10(13)2/h6-9,17H,5H2,1-4H3	PXUQZPRBLNBYBX-UHFFFAOYSA-N	285.147726878							
3-(Methylsulfanyl)-5-[4-(trifluoromethyl)phenyl]-4H-1,2,4-triazole	LSM-31364	BRD-K94476572, SID26729104	2743576	InChI=1S/C10H8F3N3S/c1-17-9-14-8(15-16-9)6-2-4-7(5-3-6)10(11,12)13/h2-5H,1H3,(H,14,15,16)	GTRWSTBFARSWCZ-UHFFFAOYSA-N	CSc1n[nH]c(n1)c2ccc(cc2)C(F)(F)F	BroadT	BRD-K94476572	BRD-K94476572-001-05-1	Maybridge	SPB 01427			CSc1n[nH]c(n1)-c1ccc(cc1)C(F)(F)F	InChI=1S/C10H8F3N3S/c1-17-9-14-8(15-16-9)6-2-4-7(5-3-6)10(11,12)13/h2-5H,1H3,(H,14,15,16)	GTRWSTBFARSWCZ-UHFFFAOYSA-N	259.039102576							119921
ST4093299	LSM-31365	SID24793171, BRD-K39566424	715141	InChI=1S/C10H9BrN2O2S2/c1-7-2-4-9(12-6-7)13-17(14,15)10-5-3-8(11)16-10/h2-6H,1H3,(H,12,13)	GDIMZIOJMARTTP-UHFFFAOYSA-N	Cc1ccc(NS(=O)(=O)c2ccc(Br)s2)nc1	BroadT	BRD-K39566424	BRD-K39566424-001-05-7	ChemBridge Corporation	7956653			Cc1ccc(NS(=O)(=O)c2ccc(Br)s2)nc1	InChI=1S/C10H9BrN2O2S2/c1-7-2-4-9(12-6-7)13-17(14,15)10-5-3-8(11)16-10/h2-6H,1H3,(H,12,13)	GDIMZIOJMARTTP-UHFFFAOYSA-N	331.928881528							119922
T0508-3638	LSM-31366	BRD-K76588081, SID17431877	5397222	InChI=1S/C14H9N3O3S/c18-11-8(5-7-3-1-2-4-10(7)15-11)6-9-12(19)16-14(21)17-13(9)20/h1-6H,(H,15,18)(H2,16,17,19,20,21)	SEEZKTOCLICXGJ-UHFFFAOYSA-N	Oc1nc2ccccc2cc1C=C3C(=O)NC(=S)NC3=O	BroadT	BRD-K76588081	BRD-K76588081-001-05-9	ChemBridge Corporation	6963004			Oc1nc2ccccc2cc1C=C1C(=O)NC(=S)NC1=O	InChI=1S/C14H9N3O3S/c18-11-8(5-7-3-1-2-4-10(7)15-11)6-9-12(19)16-14(21)17-13(9)20/h1-6H,(H,15,18)(H2,16,17,19,20,21)	SEEZKTOCLICXGJ-UHFFFAOYSA-N	299.036461868							119923
AC1N6FOT	LSM-31367	BRD-K28733696	4259234	InChI=1S/C19H18N4O3/c1-13(14-5-4-6-16(11-14)23(25)26)21-22-19(24)10-9-15-12-20-18-8-3-2-7-17(15)18/h2-8,11-12,20H,9-10H2,1H3,(H,22,24)	KUAHGGVXXPXFME-UHFFFAOYSA-N	CC(=NNC(=O)CCc1c[nH]c2ccccc12)c3cccc(c3)[N+](=O)[O-]	BroadT	BRD-K28733696	BRD-K28733696-001-05-7	ChemDiv Inc.	2098-0133			CC(=NNC(=O)CCc1c[nH]c2ccccc12)c1cccc(c1)[N+]([O-])=O	InChI=1S/C19H18N4O3/c1-13(14-5-4-6-16(11-14)23(25)26)21-22-19(24)10-9-15-12-20-18-8-3-2-7-17(15)18/h2-8,11-12,20H,9-10H2,1H3,(H,22,24)	KUAHGGVXXPXFME-UHFFFAOYSA-N	350.137890476							119924
SMR000031874	LSM-31368	BRD-A99687212, SID24839465, SID4243760	3238442	InChI=1S/C27H33N5O2/c1-3-30(23-10-6-8-21(2)18-23)15-7-13-29-26(33)19-25(31-17-14-28-20-31)27(34)32-16-12-22-9-4-5-11-24(22)32/h4-6,8-11,14,17-18,20,25H,3,7,12-13,15-16,19H2,1-2H3,(H,29,33)	BHJFKUFPYBTSNB-UHFFFAOYSA-N	CCN(CCCNC(=O)CC(C(=O)N1CCc2ccccc12)n3ccnc3)c4cccc(C)c4	BroadT	BRD-A99687212	BRD-A99687212-001-05-6	ChemDiv Inc.	K786-0729			CCN(CCCNC(=O)CC(C(=O)N1CCc2ccccc12)n1ccnc1)c1cccc(C)c1	InChI=1S/C27H33N5O2/c1-3-30(23-10-6-8-21(2)18-23)15-7-13-29-26(33)19-25(31-17-14-28-20-31)27(34)32-16-12-22-9-4-5-11-24(22)32/h4-6,8-11,14,17-18,20,25H,3,7,12-13,15-16,19H2,1-2H3,(H,29,33)	BHJFKUFPYBTSNB-UHFFFAOYSA-N	459.263425346							119925
(3,4-Dimethoxy-benzyl)-[3-(pyrimidin-2-ylsulfanyl)-propyl]-amine	LSM-15441	BRD-K98598055	6498220	InChI=1S/C16H21N3O2S/c1-20-14-6-5-13(11-15(14)21-2)12-17-7-4-10-22-16-18-8-3-9-19-16/h3,5-6,8-9,11,17H,4,7,10,12H2,1-2H3	IACZANRWZYQFOD-UHFFFAOYSA-N	COc1ccc(CNCCCSc2ncccn2)cc1OC	BroadT	BRD-K98598055	BRD-K98598055-003-05-0	Asinex Ltd.	ASN 13829579		Cl	COc1ccc(CNCCCSc2ncccn2)cc1OC.Cl	InChI=1S/C16H21N3O2S.ClH/c1-20-14-6-5-13(11-15(14)21-2)12-17-7-4-10-22-16-18-8-3-9-19-16;/h3,5-6,8-9,11,17H,4,7,10,12H2,1-2H3;1H	UMMHOGOVQWTVBO-UHFFFAOYSA-N	319.135447632							104083, 104083
AC1LXMKB	LSM-44350	SID26666336, BRD-K84517695	1832154	InChI=1S/C22H21N5O3S/c1-25-11-13-26(14-12-25)21-19(22(28)27-10-6-5-9-20(27)24-21)15-18(16-23)31(29,30)17-7-3-2-4-8-17/h2-10,15H,11-14H2,1H3/b18-15+	CFFGQTVSSJLVLZ-OBGWFSINSA-N	CN1CCN(CC1)C2=C(\C=C(/C#N)\S(=O)(=O)c3ccccc3)C(=O)N4C=CC=CC4=N2	BroadT	BRD-K84517695	BRD-K84517695-001-05-6	InterBioScreen Ltd.	STOCK3S-45434			CN1CCN(CC1)c1nc2ccccn2c(=O)c1\C=C(/C#N)S(=O)(=O)c1ccccc1	InChI=1S/C22H21N5O3S/c1-25-11-13-26(14-12-25)21-19(22(28)27-10-6-5-9-20(27)24-21)15-18(16-23)31(29,30)17-7-3-2-4-8-17/h2-10,15H,11-14H2,1H3/b18-15+	CFFGQTVSSJLVLZ-OBGWFSINSA-N	435.136510272							
AC1MFHWF	LSM-31370	BRD-K22775880, SID17507975	2871969	InChI=1S/C15H20N6O3/c1-5-24-14-18-12(17-13(19-14)20-15(2,3)4)16-10-6-8-11(9-7-10)21(22)23/h6-9H,5H2,1-4H3,(H2,16,17,18,19,20)	WOIMXMDDOXEIMH-UHFFFAOYSA-N	CCOc1nc(Nc2ccc(cc2)[N+](=O)[O-])nc(NC(C)(C)C)n1	BroadT	BRD-K22775880	BRD-K22775880-001-05-0	Asinex Ltd.	BAS 01056862			CCOc1nc(Nc2ccc(cc2)[N+]([O-])=O)nc(NC(C)(C)C)n1	InChI=1S/C15H20N6O3/c1-5-24-14-18-12(17-13(19-14)20-15(2,3)4)16-10-6-8-11(9-7-10)21(22)23/h6-9H,5H2,1-4H3,(H2,16,17,18,19,20)	WOIMXMDDOXEIMH-UHFFFAOYSA-N	332.15968856							119927
AC1NJPFV	LSM-31371	BRD-K61053165, SID16952678	4875681	InChI=1S/C16H17N3O2S3/c1-4-21-13-6-5-11(7-14(13)20-3)15-17-12(8-22-15)9-23-16-19-18-10(2)24-16/h5-8H,4,9H2,1-3H3	FQQDZAYAVCRXJU-UHFFFAOYSA-N	CCOc1ccc(cc1OC)c2nc(CSc3nnc(C)s3)cs2	BroadT	BRD-K61053165	BRD-K61053165-001-05-0	Enamine Ltd.	T5295605			CCOc1ccc(cc1OC)-c1nc(CSc2nnc(C)s2)cs1	InChI=1S/C16H17N3O2S3/c1-4-21-13-6-5-11(7-14(13)20-3)15-17-12(8-22-15)9-23-16-19-18-10(2)24-16/h5-8H,4,9H2,1-3H3	FQQDZAYAVCRXJU-UHFFFAOYSA-N	379.048288884							119928
AF-399/15335307	LSM-31372	SID17505234, BRD-K23286105	5761414	InChI=1S/C16H13N5OS/c1-8-9(2)23-16-12(8)14(17-7-18-16)21-20-13-10-5-3-4-6-11(10)19-15(13)22/h3-7,19,22H,1-2H3	VVJGAJMVPRSHSR-UHFFFAOYSA-N	Cc1sc2ncnc(N=Nc3c(O)[nH]c4ccccc34)c2c1C	BroadT	BRD-K23286105	BRD-K23286105-001-05-6	Asinex Ltd.	BAS 01025965			Cc1sc2ncnc(N=Nc3c(O)[nH]c4ccccc34)c2c1C	InChI=1S/C16H13N5OS/c1-8-9(2)23-16-12(8)14(17-7-18-16)21-20-13-10-5-3-4-6-11(10)19-15(13)22/h3-7,19,22H,1-2H3	VVJGAJMVPRSHSR-UHFFFAOYSA-N	323.084080776							
3-Bromo-5-ethoxy-n-(4-fluorophenyl)-4-methoxybenzamide	LSM-31373	BRD-K55612106, SID22400698	1008046	InChI=1S/C16H15BrFNO3/c1-3-22-14-9-10(8-13(17)15(14)21-2)16(20)19-12-6-4-11(18)5-7-12/h4-9H,3H2,1-2H3,(H,19,20)	KPFNCQBDQIVSJG-UHFFFAOYSA-N	CCOc1cc(cc(Br)c1OC)C(=O)Nc2ccc(F)cc2	BroadT	BRD-K55612106	BRD-K55612106-001-05-3	Specs	AH-487/42819978			CCOc1cc(cc(Br)c1OC)C(=O)Nc1ccc(F)cc1	InChI=1S/C16H15BrFNO3/c1-3-22-14-9-10(8-13(17)15(14)21-2)16(20)19-12-6-4-11(18)5-7-12/h4-9H,3H2,1-2H3,(H,19,20)	KPFNCQBDQIVSJG-UHFFFAOYSA-N	367.02193415							119930
ST50110775	LSM-31374	BRD-A77440546, SID17514317	4899674	InChI=1S/C25H26N2O5S2/c1-10(2)8-14(24(30)31)27-22(28)17-12-9-13(18(17)23(27)29)19-16(12)15(11-6-4-3-5-7-11)20-21(33-19)26-25(32)34-20/h3-7,10,12-19H,8-9H2,1-2H3,(H,26,32)(H,30,31)	IVPGAULDPUIBKM-UHFFFAOYSA-N	CC(C)CC(N1C(=O)C2C3CC(C4C3Sc5nc(O)sc5C4c6ccccc6)C2C1=O)C(=O)O	BroadT	BRD-A77440546	BRD-A77440546-001-05-3	Life Chemicals Inc.	F1734-0072			CC(C)CC(N1C(=O)C2C3CC(C4C3Sc3nc(O)sc3C4c3ccccc3)C2C1=O)C(O)=O	InChI=1S/C25H26N2O5S2/c1-10(2)8-14(24(30)31)27-22(28)17-12-9-13(18(17)23(27)29)19-16(12)15(11-6-4-3-5-7-11)20-21(33-19)26-25(32)34-20/h3-7,10,12-19H,8-9H2,1-2H3,(H,26,32)(H,30,31)	IVPGAULDPUIBKM-UHFFFAOYSA-N	498.128313332							119931
SMR000156056	LSM-31375	BRD-K71501826, SID17407360	11958583	InChI=1S/C19H16N4O2S2/c1-11-5-7-13(8-6-11)21-18-22-14(10-26-18)16-12(2)20-19(27-16)23-17(24)15-4-3-9-25-15/h3-10H,1-2H3,(H,21,22)(H,20,23,24)	PRPLQLOOOBDCSV-UHFFFAOYSA-N	Cc1ccc(Nc2nc(cs2)c3sc(NC(=O)c4occc4)nc3C)cc1	BroadT	BRD-K71501826	BRD-K71501826-001-05-7	University of California at Davis	CLY_Corr_A05			Cc1nc(NC(=O)c2ccco2)sc1-c1csc(Nc2ccc(C)cc2)n1	InChI=1S/C19H16N4O2S2/c1-11-5-7-13(8-6-11)21-18-22-14(10-26-18)16-12(2)20-19(27-16)23-17(24)15-4-3-9-25-15/h3-10H,1-2H3,(H,21,22)(H,20,23,24)	PRPLQLOOOBDCSV-UHFFFAOYSA-N	396.071467172							119932
MLS000087028	LSM-31376	BRD-K80622162, SID4250791	3244552	InChI=1S/C13H13BrN2O2/c1-8(2)15-13(17)11-7-12(18-16-11)9-3-5-10(14)6-4-9/h3-8H,1-2H3,(H,15,17)	IJWSBPAAGDPLBR-UHFFFAOYSA-N	CC(C)NC(=O)c1cc(on1)c2ccc(Br)cc2	BroadT	BRD-K80622162	BRD-K80622162-001-05-2	ChemDiv Inc.	C226-0491			CC(C)NC(=O)c1cc(on1)-c1ccc(Br)cc1	InChI=1S/C13H13BrN2O2/c1-8(2)15-13(17)11-7-12(18-16-11)9-3-5-10(14)6-4-9/h3-8H,1-2H3,(H,15,17)	IJWSBPAAGDPLBR-UHFFFAOYSA-N	308.016040276							119933
BDBM53286	LSM-31377	BRD-A53381587	91897113	InChI=1S/C21H16BrNO5/c1-12-7-8-16(28-12)19(24)17-18(13-4-2-5-14(22)10-13)23(21(26)20(17)25)11-15-6-3-9-27-15/h2-10,17-18H,11H2,1H3	CMPPBELXEZZMGQ-UHFFFAOYSA-N	Cc1oc(cc1)C(=O)C2C(N(Cc3occc3)C(=O)C2=O)c4cccc(Br)c4	BroadT	BRD-A53381587	BRD-A53381587-001-07-3	ChemBridge Corporation	7318476			Cc1ccc(o1)C(=O)C1C(N(Cc2ccco2)C(=O)C1=O)c1cccc(Br)c1	InChI=1S/C21H16BrNO5/c1-12-7-8-16(28-12)19(24)17-18(13-4-2-5-14(22)10-13)23(21(26)20(17)25)11-15-6-3-9-27-15/h2-10,17-18H,11H2,1H3	CMPPBELXEZZMGQ-UHFFFAOYSA-N	441.021185222							119934
MLS000420607	LSM-31378	BRD-A59683007, SID26732020	16746215	InChI=1S/C24H22BrFN4O4/c25-18-6-1-15(2-7-18)11-24(32)29-21(13-23(27)31)17-5-10-20(22(12-17)30(33)34)28-14-16-3-8-19(26)9-4-16/h1-10,12,21,28H,11,13-14H2,(H2,27,31)(H,29,32)	IIRGMCJEZDOTOB-UHFFFAOYSA-N	NC(=O)CC(NC(=O)Cc1ccc(Br)cc1)c2ccc(NCc3ccc(F)cc3)c(c2)[N+](=O)[O-]	BroadT	BRD-A59683007	BRD-A59683007-001-06-0	University of California at Davis	X2-R13-R233			NC(=O)CC(NC(=O)Cc1ccc(Br)cc1)c1ccc(NCc2ccc(F)cc2)c(c1)[N+]([O-])=O	InChI=1S/C24H22BrFN4O4/c25-18-6-1-15(2-7-18)11-24(32)29-21(13-23(27)31)17-5-10-20(22(12-17)30(33)34)28-14-16-3-8-19(26)9-4-16/h1-10,12,21,28H,11,13-14H2,(H2,27,31)(H,29,32)	IIRGMCJEZDOTOB-UHFFFAOYSA-N	528.080846024							119935
AC1MDZ4D	LSM-31379	BRD-K44012257, SID26726681	2819092	InChI=1S/C16H14FN5O2/c1-9-7-10(2)22-15(20-9)12(8-19-22)14(18)21-24-16(23)11-5-3-4-6-13(11)17/h3-8H,1-2H3,(H2,18,21)	MEYBRRDRZNYOBF-UHFFFAOYSA-N	Cc1cc(C)n2ncc(C(=N)NOC(=O)c3ccccc3F)c2n1	BroadT	BRD-K44012257	BRD-K44012257-001-05-7	Maybridge	KM 00793			Cc1cc(C)n2ncc(C(=N)NOC(=O)c3ccccc3F)c2n1	InChI=1S/C16H14FN5O2/c1-9-7-10(2)22-15(20-9)12(8-19-22)14(18)21-24-16(23)11-5-3-4-6-13(11)17/h3-8H,1-2H3,(H2,18,21)	MEYBRRDRZNYOBF-UHFFFAOYSA-N	327.113152938							119936
ST060533	LSM-31380	BRD-K52261313, SID4264242	2187895	InChI=1S/C11H15NO2S/c1-9-4-2-3-5-10(9)12-11(14)8-15-7-6-13/h2-5,13H,6-8H2,1H3,(H,12,14)	DWVBORWVKUNRGX-UHFFFAOYSA-N	Cc1ccccc1NC(=O)CSCCO	BroadT	BRD-K52261313	BRD-K52261313-001-06-9	ChemBridge Corporation	7403154			Cc1ccccc1NC(=O)CSCCO	InChI=1S/C11H15NO2S/c1-9-4-2-3-5-10(9)12-11(14)8-15-7-6-13/h2-5,13H,6-8H2,1H3,(H,12,14)	DWVBORWVKUNRGX-UHFFFAOYSA-N	225.08234942							119937
2-[2-(4-Hydroxy-3-methoxybenzylidene)hydrazino]-2-oxo-n-(3-pyridinylmethyl)acetamide	LSM-31381	BRD-K58985886	6848231	InChI=1S/C16H16N4O4/c1-24-14-7-11(4-5-13(14)21)10-19-20-16(23)15(22)18-9-12-3-2-6-17-8-12/h2-8,10,21H,9H2,1H3,(H,18,22)(H,20,23)	UUWHVSDJFZGFDC-UHFFFAOYSA-N	COc1cc(C=NNC(=O)C(=O)NCc2cccnc2)ccc1O	BroadT	BRD-K58985886	BRD-K58985886-001-05-6	Asinex Ltd.	BAS 00366424			COc1cc(C=NNC(=O)C(=O)NCc2cccnc2)ccc1O	InChI=1S/C16H16N4O4/c1-24-14-7-11(4-5-13(14)21)10-19-20-16(23)15(22)18-9-12-3-2-6-17-8-12/h2-8,10,21H,9H2,1H3,(H,18,22)(H,20,23)	UUWHVSDJFZGFDC-UHFFFAOYSA-N	328.117155032							
CHEMBL1622565	LSM-15234	BRD-K91011325	829570	InChI=1S/C17H15ClN2S/c1-2-3-15-10-13(8-9-19-15)17-20-16(11-21-17)12-4-6-14(18)7-5-12/h4-11H,2-3H2,1H3	QAIDAYZZJYOOJH-UHFFFAOYSA-N	CCCc1cc(ccn1)c2nc(cs2)c3ccc(Cl)cc3	BroadT	BRD-K91011325	BRD-K91011325-004-06-1	Asinex Ltd.	BAS 02374427		Br	CCCc1cc(ccn1)-c1nc(cs1)-c1ccc(Cl)cc1.Br	InChI=1S/C17H15ClN2S.BrH/c1-2-3-15-10-13(8-9-19-15)17-20-16(11-21-17)12-4-6-14(18)7-5-12;/h4-11H,2-3H2,1H3;1H	GIJWAZLJXHCDKU-UHFFFAOYSA-N	314.0644469							103881, 103881
BRD-K21982562	LSM-44351	SID47198601	54742265	InChI=1S/C15H11BrO4/c1-9-8-13(18)14(15(19)20-9)12(17)7-6-10-4-2-3-5-11(10)16/h2-8,18H,1H3/b7-6+	ZIJPAMQADXGOFI-VOTSOKGWSA-N	CC1=CC(=C(C(=O)\C=C\c2ccccc2Br)C(=O)O1)O	BroadT	BRD-K21982562	BRD-K21982562-001-05-8	ChemBridge Corporation	5309307			Cc1cc(O)c(C(=O)\C=C\c2ccccc2Br)c(=O)o1	InChI=1S/C15H11BrO4/c1-9-8-13(18)14(15(19)20-9)12(17)7-6-10-4-2-3-5-11(10)16/h2-8,18H,1H3/b7-6+	ZIJPAMQADXGOFI-VOTSOKGWSA-N	333.984071432							
AC1NM02X	LSM-15581	BRD-K01850737	4968904	InChI=1S/C24H31FN4O4S/c1-18-10-11-21(15-22(18)34(32,33)29-12-5-3-4-6-13-29)27-24(31)17-28(2)16-23(30)26-20-9-7-8-19(25)14-20/h7-11,14-15H,3-6,12-13,16-17H2,1-2H3,(H,26,30)(H,27,31)	GQZRGBIEEIXVGI-UHFFFAOYSA-N	CN(CC(=O)Nc1cccc(F)c1)CC(=O)Nc2ccc(C)c(c2)S(=O)(=O)N3CCCCCC3	BroadT	BRD-K01850737	BRD-K01850737-034-06-0	Enamine Ltd.	T5328750		OC(=O)C(=O)O	CN(CC(=O)Nc1cccc(F)c1)CC(=O)Nc1ccc(C)c(c1)S(=O)(=O)N1CCCCCC1.OC(=O)C(=O)O	InChI=1S/C24H31FN4O4S.C2H2O4/c1-18-10-11-21(15-22(18)34(32,33)29-12-5-3-4-6-13-29)27-24(31)17-28(2)16-23(30)26-20-9-7-8-19(25)14-20;3-1(4)2(5)6/h7-11,14-15H,3-6,12-13,16-17H2,1-2H3,(H,26,30)(H,27,31);(H,3,4)(H,5,6)	ZZXBAGANHVZNIF-UHFFFAOYSA-N	490.205004402							104217, 104217
SMR000118720	LSM-31383	BRD-A57353172, SID14721276	3211750	InChI=1S/C22H29N3O5S/c1-29-13-11-25(19(26)15-23-21(27)17-9-5-12-30-17)20(18-10-6-14-31-18)22(28)24-16-7-3-2-4-8-16/h5-6,9-10,12,14,16,20H,2-4,7-8,11,13,15H2,1H3,(H,23,27)(H,24,28)	ITRKVJJQWKYLQN-UHFFFAOYSA-N	COCCN(C(C(=O)NC1CCCCC1)c2cccs2)C(=O)CNC(=O)c3occc3	BroadT	BRD-A57353172	BRD-A57353172-001-05-3	Asinex Ltd.	ASN 05585046			COCCN(C(C(=O)NC1CCCCC1)c1cccs1)C(=O)CNC(=O)c1ccco1	InChI=1S/C22H29N3O5S/c1-29-13-11-25(19(26)15-23-21(27)17-9-5-12-30-17)20(18-10-6-14-31-18)22(28)24-16-7-3-2-4-8-16/h5-6,9-10,12,14,16,20H,2-4,7-8,11,13,15H2,1H3,(H,23,27)(H,24,28)	ITRKVJJQWKYLQN-UHFFFAOYSA-N	447.182791748							119940
AO-476/43250136	LSM-31384	BRD-K43352598, SID24786957	7313803	InChI=1S/C10H10N6O2/c11-9-8(10(12)16-15-9)14-13-5-1-2-6-7(3-5)18-4-17-6/h1-3H,4H2,(H5,11,12,15,16)	HQNMHDJCGMVDTP-UHFFFAOYSA-N	Nc1n[nH]c(N)c1N=Nc2ccc3OCOc3c2	BroadT	BRD-K43352598	BRD-K43352598-001-06-4	Specs	AO-476/43250136			Nc1n[nH]c(N)c1N=Nc1ccc2OCOc2c1	InChI=1S/C10H10N6O2/c11-9-8(10(12)16-15-9)14-13-5-1-2-6-7(3-5)18-4-17-6/h1-3H,4H2,(H5,11,12,15,16)	HQNMHDJCGMVDTP-UHFFFAOYSA-N	246.08652362							
4-[(3-Methoxybenzoyl)amino]benzoic acid	LSM-31385	BRD-K33705415, SID4245689	3240131	InChI=1S/C15H13NO4/c1-20-13-4-2-3-11(9-13)14(17)16-12-7-5-10(6-8-12)15(18)19/h2-9H,1H3,(H,16,17)(H,18,19)	RQVMZOVULUDLRS-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Nc2ccc(cc2)C(=O)O	BroadT	BRD-K33705415	BRD-K33705415-001-05-8	ChemDiv Inc.	1937-0229			COc1cccc(c1)C(=O)Nc1ccc(cc1)C(O)=O	InChI=1S/C15H13NO4/c1-20-13-4-2-3-11(9-13)14(17)16-12-7-5-10(6-8-12)15(18)19/h2-9H,1H3,(H,16,17)(H,18,19)	RQVMZOVULUDLRS-UHFFFAOYSA-N	271.084457906							119942
3-[3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]-n-(3-methylphenyl)propanamide	LSM-31386	BRD-K00243272, SID864418	665665	InChI=1S/C19H19N3O3/c1-13-4-3-5-15(12-13)20-17(23)10-11-18-21-19(22-25-18)14-6-8-16(24-2)9-7-14/h3-9,12H,10-11H2,1-2H3,(H,20,23)	YVXLCSZPZTXZJA-UHFFFAOYSA-N	COc1ccc(cc1)c2noc(CCC(=O)Nc3cccc(C)c3)n2	BroadT	BRD-K00243272	BRD-K00243272-001-05-1	InterBioScreen Ltd.	STOCK5S-15094			COc1ccc(cc1)-c1noc(CCC(=O)Nc2cccc(C)c2)n1	InChI=1S/C19H19N3O3/c1-13-4-3-5-15(12-13)20-17(23)10-11-18-21-19(22-25-18)14-6-8-16(24-2)9-7-14/h3-9,12H,10-11H2,1-2H3,(H,20,23)	YVXLCSZPZTXZJA-UHFFFAOYSA-N	337.142641498							119943
SMR000025799	LSM-31387	BRD-K53774433, SID4249988	3243862	InChI=1S/C21H23BrN2O5S/c1-13-2-5-17(29-13)12-23-19(25)7-9-30(27,28)18-11-16(22)10-15-6-8-24(20(15)18)21(26)14-3-4-14/h2,5,10-11,14H,3-4,6-9,12H2,1H3,(H,23,25)	ZJSBTGFSUSSADM-UHFFFAOYSA-N	Cc1oc(CNC(=O)CCS(=O)(=O)c2cc(Br)cc3CCN(C(=O)C4CC4)c23)cc1	BroadT	BRD-K53774433	BRD-K53774433-001-05-7	ChemDiv Inc.	C300-0209			Cc1ccc(CNC(=O)CCS(=O)(=O)c2cc(Br)cc3CCN(C(=O)C4CC4)c23)o1	InChI=1S/C21H23BrN2O5S/c1-13-2-5-17(29-13)12-23-19(25)7-9-30(27,28)18-11-16(22)10-15-6-8-24(20(15)18)21(26)14-3-4-14/h2,5,10-11,14H,3-4,6-9,12H2,1H3,(H,23,25)	ZJSBTGFSUSSADM-UHFFFAOYSA-N	494.051105146							119944
ST044815	LSM-31388	BRD-K63163033, SID843407	645695	InChI=1S/C11H11NO4/c1-14-6-3-4-8-7(5-6)9(12)10(16-8)11(13)15-2/h3-5H,12H2,1-2H3	AWDFMQCVWGJQCY-UHFFFAOYSA-N	COC(=O)c1oc2ccc(OC)cc2c1N	BroadT	BRD-K63163033	BRD-K63163033-001-06-3	Asinex Ltd.	BAS 01507278			COC(=O)c1oc2ccc(OC)cc2c1N	InChI=1S/C11H11NO4/c1-14-6-3-4-8-7(5-6)9(12)10(16-8)11(13)15-2/h3-5H,12H2,1-2H3	AWDFMQCVWGJQCY-UHFFFAOYSA-N	221.068807842							119945
MLS000689907	LSM-31389	BRD-K82662168, SID24793728	1346745	InChI=1S/C16H15BrN2O3S/c1-10-2-7-14(20)13(8-10)18-16(23)19-15(21)9-22-12-5-3-11(17)4-6-12/h2-8,20H,9H2,1H3,(H2,18,19,21,23)	LHTCPJYUVYTPMM-UHFFFAOYSA-N	Cc1ccc(O)c(NC(=S)NC(=O)COc2ccc(Br)cc2)c1	BroadT	BRD-K82662168	BRD-K82662168-001-05-0	ChemBridge Corporation	6621321			Cc1ccc(O)c(NC(=S)NC(=O)COc2ccc(Br)cc2)c1	InChI=1S/C16H15BrN2O3S/c1-10-2-7-14(20)13(8-10)18-16(23)19-15(21)9-22-12-5-3-11(17)4-6-12/h2-8,20H,9H2,1H3,(H2,18,19,21,23)	LHTCPJYUVYTPMM-UHFFFAOYSA-N	393.99867565							119946
MLS000058569	LSM-31390	BRD-A50837272, SID3714271	2998734	InChI=1S/C18H25NO5S2/c1-12(2)9-19(14-6-7-26(22,23)11-14)17(20)10-24-18(21)16-8-13-4-3-5-15(13)25-16/h8,12,14H,3-7,9-11H2,1-2H3	RDUQAOLDJRZPCF-UHFFFAOYSA-N	CC(C)CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)c2cc3CCCc3s2	BroadT	BRD-A50837272	BRD-A50837272-001-05-1	Enamine Ltd.	T5339763			CC(C)CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)c1cc2CCCc2s1	InChI=1S/C18H25NO5S2/c1-12(2)9-19(14-6-7-26(22,23)11-14)17(20)10-24-18(21)16-8-13-4-3-5-15(13)25-16/h8,12,14H,3-7,9-11H2,1-2H3	RDUQAOLDJRZPCF-UHFFFAOYSA-N	399.11741429							119947
ST50113480	LSM-31391	BRD-K36027285, SID17515017	4395446	InChI=1S/C12H16ClN3OS/c1-12(2,3)14-11(18)16-15-10(17)8-6-4-5-7-9(8)13/h4-7H,1-3H3,(H,15,17)(H2,14,16,18)	WBWZXEJWTHZRLM-UHFFFAOYSA-N	CC(C)(C)NC(=NNC(=O)c1ccccc1Cl)S	BroadT	BRD-K36027285	BRD-K36027285-001-05-1	Life Chemicals Inc.	F0486-2128			CC(C)(C)NC(S)=NNC(=O)c1ccccc1Cl	InChI=1S/C12H16ClN3OS/c1-12(2,3)14-11(18)16-15-10(17)8-6-4-5-7-9(8)13/h4-7H,1-3H3,(H,15,17)(H2,14,16,18)	WBWZXEJWTHZRLM-UHFFFAOYSA-N	285.070260562							119948
MLS000097673	LSM-31392	BRD-K91923964, SID3715216	2369751	InChI=1S/C17H17NO4/c1-11-9-14(12(2)22-11)17(20)21-10-16(19)18-8-7-13-5-3-4-6-15(13)18/h3-6,9H,7-8,10H2,1-2H3	HOHANYNHRBYPMC-UHFFFAOYSA-N	Cc1oc(C)c(c1)C(=O)OCC(=O)N2CCc3ccccc23	BroadT	BRD-K91923964	BRD-K91923964-001-06-9	Enamine Ltd.	T0509-9527			Cc1cc(C(=O)OCC(=O)N2CCc3ccccc23)c(C)o1	InChI=1S/C17H17NO4/c1-11-9-14(12(2)22-11)17(20)21-10-16(19)18-8-7-13-5-3-4-6-15(13)18/h3-6,9H,7-8,10H2,1-2H3	HOHANYNHRBYPMC-UHFFFAOYSA-N	299.115758034							119949
ST51013222	LSM-31393	SID17513964, BRD-K09460582	4637398	InChI=1S/C18H18N2O2S/c1-22-12-7-5-6-11(10-12)16-19-17(21)15-13-8-3-2-4-9-14(13)23-18(15)20-16/h5-7,10H,2-4,8-9H2,1H3,(H,19,20,21)	OHQNHGDOKOMLFS-UHFFFAOYSA-N	COc1cccc(c1)c2nc(O)c3c4CCCCCc4sc3n2	BroadT	BRD-K09460582	BRD-K09460582-001-07-3	InterBioScreen Ltd.	STOCK4S-65086			COc1cccc(c1)-c1nc(O)c2c3CCCCCc3sc2n1	InChI=1S/C18H18N2O2S/c1-22-12-7-5-6-11(10-12)16-19-17(21)15-13-8-3-2-4-9-14(13)23-18(15)20-16/h5-7,10H,2-4,8-9H2,1H3,(H,19,20,21)	OHQNHGDOKOMLFS-UHFFFAOYSA-N	326.108898526							119950
STK223418	LSM-31394	SID14720459, BRD-K31780647	804634	InChI=1S/C16H15NO5/c1-10(18)22-14-8-3-11(9-15(14)21-2)16(20)17-12-4-6-13(19)7-5-12/h3-9,19H,1-2H3,(H,17,20)	NRAXYEOTGBQZLX-UHFFFAOYSA-N	COc1cc(ccc1OC(=O)C)C(=O)Nc2ccc(O)cc2	BroadT	BRD-K31780647	BRD-K31780647-001-05-3	Asinex Ltd.	BAS 02225038			COc1cc(ccc1OC(C)=O)C(=O)Nc1ccc(O)cc1	InChI=1S/C16H15NO5/c1-10(18)22-14-8-3-11(9-15(14)21-2)16(20)17-12-4-6-13(19)7-5-12/h3-9,19H,1-2H3,(H,17,20)	NRAXYEOTGBQZLX-UHFFFAOYSA-N	301.09502259							119951
ST50573378	LSM-31395	BRD-K86750448, SID846615	649011	InChI=1S/C18H18N2O4/c1-11(2)17(21)19-13-5-3-4-12(8-13)18(22)20-14-6-7-15-16(9-14)24-10-23-15/h3-9,11H,10H2,1-2H3,(H,19,21)(H,20,22)	CHSPYYSZHDKNRC-UHFFFAOYSA-N	CC(C)C(=O)Nc1cccc(c1)C(=O)Nc2ccc3OCOc3c2	BroadT	BRD-K86750448	BRD-K86750448-001-05-1	Asinex Ltd.	BAS 07857040			CC(C)C(=O)Nc1cccc(c1)C(=O)Nc1ccc2OCOc2c1	InChI=1S/C18H18N2O4/c1-11(2)17(21)19-13-5-3-4-12(8-13)18(22)20-14-6-7-15-16(9-14)24-10-23-15/h3-9,11H,10H2,1-2H3,(H,19,21)(H,20,22)	CHSPYYSZHDKNRC-UHFFFAOYSA-N	326.126657076							119952
MLS001201651	LSM-31396	BRD-K49733350, SID51085329	4318135	InChI=1S/C14H14N4O4S/c19-13(16-14-15-3-8-23-14)10-1-2-11(12(9-10)18(20)21)17-4-6-22-7-5-17/h1-3,8-9H,4-7H2,(H,15,16,19)	SOBIZCJDCBPXTI-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1N2CCOCC2)C(=O)Nc3nccs3	BroadT	BRD-K49733350	BRD-K49733350-001-06-7	Life Chemicals Inc.	F1272-0005			[O-][N+](=O)c1cc(ccc1N1CCOCC1)C(=O)Nc1nccs1	InChI=1S/C14H14N4O4S/c19-13(16-14-15-3-8-23-14)10-1-2-11(12(9-10)18(20)21)17-4-6-22-7-5-17/h1-3,8-9H,4-7H2,(H,15,16,19)	SOBIZCJDCBPXTI-UHFFFAOYSA-N	334.073575658							119953
MLS000517729	LSM-31397	BRD-K69350688, SID26731793	16746014	InChI=1S/C15H24O5/c1-18-15(19-2)9-13(16)8-14(17)11-20-10-12-6-4-3-5-7-12/h3-7,13-17H,8-11H2,1-2H3/t13-,14+/m0/s1	JKQSWJHBQZFSJX-UONOGXRCSA-N	COC(C[C@@H](O)C[C@@H](O)COCc1ccccc1)OC	BroadT	BRD-K69350688	BRD-K69350688-001-04-3	Memorial Sloan-Kettering Cancer Center	(-)-(2R,4S)-1-Benzyloxy-6,6-dimethoxy-hexane-2,4-diol DST_PK1_DIHRHS			COC(C[C@@H](O)C[C@@H](O)COCc1ccccc1)OC	InChI=1S/C15H24O5/c1-18-15(19-2)9-13(16)8-14(17)11-20-10-12-6-4-3-5-7-12/h3-7,13-17H,8-11H2,1-2H3/t13-,14+/m0/s1	JKQSWJHBQZFSJX-UONOGXRCSA-N	284.162373868							119954
MLS001106149	LSM-31398	BRD-K02484256, SID49737374	24794137	InChI=1S/C20H26N2O4/c1-14-4-5-17(10-15(14)2)25-13-18-11-19(21-26-18)20(23)22(3)12-16-6-8-24-9-7-16/h4-5,10-11,16H,6-9,12-13H2,1-3H3	CPFFNBBHIQYZGP-UHFFFAOYSA-N	CN(CC1CCOCC1)C(=O)c2cc(COc3ccc(C)c(C)c3)on2	BroadT	BRD-K02484256	BRD-K02484256-001-05-9	ChemBridge Corporation	61899589			CN(CC1CCOCC1)C(=O)c1cc(COc2ccc(C)c(C)c2)on1	InChI=1S/C20H26N2O4/c1-14-4-5-17(10-15(14)2)25-13-18-11-19(21-26-18)20(23)22(3)12-16-6-8-24-9-7-16/h4-5,10-11,16H,6-9,12-13H2,1-3H3	CPFFNBBHIQYZGP-UHFFFAOYSA-N	358.189257332							119955
AC1MU24I	LSM-31399	BRD-A68842442	3634125	InChI=1S/C24H20ClN5O3S/c1-33-23(32)22(28-26-19-15-9-8-14-18(19)25)34-24-29-27-21(20(31)16-10-4-2-5-11-16)30(24)17-12-6-3-7-13-17/h2-15,20,26,31H,1H3	CPVQHCRYMVLZRE-UHFFFAOYSA-N	COC(=O)C(=NNc1ccccc1Cl)Sc2nnc(C(O)c3ccccc3)n2c4ccccc4	BroadT	BRD-A68842442	BRD-A68842442-001-05-6	InterBioScreen Ltd.	STOCK3S-51137			COC(=O)C(Sc1nnc(C(O)c2ccccc2)n1-c1ccccc1)=NNc1ccccc1Cl	InChI=1S/C24H20ClN5O3S/c1-33-23(32)22(28-26-19-15-9-8-14-18(19)25)34-24-29-27-21(20(31)16-10-4-2-5-11-16)30(24)17-12-6-3-7-13-17/h2-15,20,26,31H,1H3	CPVQHCRYMVLZRE-UHFFFAOYSA-N	493.09753795							119956
F0676-0305	LSM-31400	BRD-A56345662, SID4251717	3245370	InChI=1S/C18H18FN5O2S/c19-13-5-3-12(4-6-13)18-22-21-15-7-8-17(23-24(15)18)27-11-16(25)20-10-14-2-1-9-26-14/h3-8,14H,1-2,9-11H2,(H,20,25)	FNSCVHFAASWCPL-UHFFFAOYSA-N	Fc1ccc(cc1)c2nnc3ccc(SCC(=O)NCC4CCCO4)nn23	BroadT	BRD-A56345662	BRD-A56345662-001-05-7	ChemDiv Inc.	C742-0305			Fc1ccc(cc1)-c1nnc2ccc(SCC(=O)NCC3CCCO3)nn12	InChI=1S/C18H18FN5O2S/c19-13-5-3-12(4-6-13)18-22-21-15-7-8-17(23-24(15)18)27-11-16(25)20-10-14-2-1-9-26-14/h3-8,14H,1-2,9-11H2,(H,20,25)	FNSCVHFAASWCPL-UHFFFAOYSA-N	387.116523756							119957
AC1NTZZL	LSM-31401	BRD-K62833799, SID3715997	5391770	InChI=1S/C18H14N2O3/c1-2-11-7-12-17(8-16(11)21)23-9-15(18(12)22)20-10-19-13-5-3-4-6-14(13)20/h3-10,21H,2H2,1H3	KHSMWQLOSRGSON-UHFFFAOYSA-N	CCc1cc2C(=O)C(=COc2cc1O)n3cnc4ccccc34	BroadT	BRD-K62833799	BRD-K62833799-001-05-8	Enamine Ltd.	T0509-2192			CCc1cc2c(cc1O)occ(-n1cnc3ccccc13)c2=O	InChI=1S/C18H14N2O3/c1-2-11-7-12-17(8-16(11)21)23-9-15(18(12)22)20-10-19-13-5-3-4-6-14(13)20/h3-10,21H,2H2,1H3	KHSMWQLOSRGSON-UHFFFAOYSA-N	306.100442328							119958
9M-315S	LSM-31402	BRD-A29734477	5525151	InChI=1S/C22H17FO4S/c1-25-16-7-3-14(4-8-16)22-21(27-17-9-5-15(23)6-10-17)19-12-11-18(26-2)13-20(19)28(22)24/h3-13H,1-2H3	LUHKAFLEPLFVGB-UHFFFAOYSA-N	COc1ccc(cc1)C2=C(Oc3ccc(F)cc3)c4ccc(OC)cc4S2=O	BroadT	BRD-A29734477	BRD-A29734477-001-05-1	Key Organics Ltd.	9M-315S			COc1ccc(cc1)-c1c(Oc2ccc(F)cc2)c2ccc(OC)cc2s1=O	InChI=1S/C22H17FO4S/c1-25-16-7-3-14(4-8-16)22-21(27-17-9-5-15(23)6-10-17)19-12-11-18(26-2)13-20(19)28(22)24/h3-13H,1-2H3	LUHKAFLEPLFVGB-UHFFFAOYSA-N	396.083157914							119959
STK570209	LSM-31403	BRD-K65529782, SID863969	665224	InChI=1S/C14H14N4O/c1-8-4-5-10-7-11-13(15-9(2)19)17-18(3)14(11)16-12(10)6-8/h4-7H,1-3H3,(H,15,17,19)	OQTKGYZKQDDSHB-UHFFFAOYSA-N	CC(=O)Nc1nn(C)c2nc3cc(C)ccc3cc12	BroadT	BRD-K65529782	BRD-K65529782-001-05-8	InterBioScreen Ltd.	STOCK4S-99512			CC(=O)Nc1nn(C)c2nc3cc(C)ccc3cc12	InChI=1S/C14H14N4O/c1-8-4-5-10-7-11-13(15-9(2)19)17-18(3)14(11)16-12(10)6-8/h4-7H,1-3H3,(H,15,17,19)	OQTKGYZKQDDSHB-UHFFFAOYSA-N	254.116761108							119960
MLS000335890	LSM-31404	BRD-K29218981, SID17516177	4651019	InChI=1S/C14H12N2O5S/c17-12(15-8-10-4-2-1-3-5-10)9-21-14(18)11-6-7-13(22-11)16(19)20/h1-7H,8-9H2,(H,15,17)	VIEYFPWEDRGBIV-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(s1)C(=O)OCC(=O)NCc2ccccc2	BroadT	BRD-K29218981	BRD-K29218981-001-05-2	Enamine Ltd.	T5251826			[O-][N+](=O)c1ccc(s1)C(=O)OCC(=O)NCc1ccccc1	InChI=1S/C14H12N2O5S/c17-12(15-8-10-4-2-1-3-5-10)9-21-14(18)11-6-7-13(22-11)16(19)20/h1-7H,8-9H2,(H,15,17)	VIEYFPWEDRGBIV-UHFFFAOYSA-N	320.046692194							119961
GNF-PF-4791	LSM-31405	BRD-K52620056, GNF-PF-4791, MMV666079	865238	InChI=1S/C19H17N3/c1-10-4-7-13-9-14-17(20)16-11(2)5-6-12(3)18(16)22-19(14)21-15(13)8-10/h4-9H,1-3H3,(H2,20,21,22)	MLCOGORERKDZTI-UHFFFAOYSA-N	Cc1ccc2cc3c(N)c4c(C)ccc(C)c4nc3nc2c1	BroadT	BRD-K52620056	BRD-K52620056-001-04-2	Asinex Ltd.	ASN 02538344			Cc1ccc2cc3c(N)c4c(C)ccc(C)c4nc3nc2c1	InChI=1S/C19H17N3/c1-10-4-7-13-9-14-17(20)16-11(2)5-6-12(3)18(16)22-19(14)21-15(13)8-10/h4-9H,1-3H3,(H2,20,21,22)	MLCOGORERKDZTI-UHFFFAOYSA-N	287.142247574							119962
N,N'-Ethylenedi-m-toluidine	LSM-31406	BRD-K04371719, SID14724131	81493	InChI=1S/C16H20N2/c1-13-5-3-7-15(11-13)17-9-10-18-16-8-4-6-14(2)12-16/h3-8,11-12,17-18H,9-10H2,1-2H3	WXEZZUDLDARSKV-UHFFFAOYSA-N	Cc1cccc(NCCNc2cccc(C)c2)c1	BroadT	BRD-K04371719	BRD-K04371719-001-06-5	Asinex Ltd.	BAS 01125795			Cc1cccc(NCCNc2cccc(C)c2)c1	InChI=1S/C16H20N2/c1-13-5-3-7-15(11-13)17-9-10-18-16-8-4-6-14(2)12-16/h3-8,11-12,17-18H,9-10H2,1-2H3	WXEZZUDLDARSKV-UHFFFAOYSA-N	240.16264866							119963
5-Bromo-n-[4-(4-methylpiperazin-1-yl)phenyl]furan-2-carboxamide	LSM-31407	BRD-K74035204, SID49724363	1017517	InChI=1S/C16H18BrN3O2/c1-19-8-10-20(11-9-19)13-4-2-12(3-5-13)18-16(21)14-6-7-15(17)22-14/h2-7H,8-11H2,1H3,(H,18,21)	FRBBRTZSUHKCCB-UHFFFAOYSA-N	CN1CCN(CC1)c2ccc(NC(=O)c3oc(Br)cc3)cc2	BroadT	BRD-K74035204	BRD-K74035204-001-06-3	ChemBridge Corporation	7655257			CN1CCN(CC1)c1ccc(NC(=O)c2ccc(Br)o2)cc1	InChI=1S/C16H18BrN3O2/c1-19-8-10-20(11-9-19)13-4-2-12(3-5-13)18-16(21)14-6-7-15(17)22-14/h2-7H,8-11H2,1H3,(H,18,21)	FRBBRTZSUHKCCB-UHFFFAOYSA-N	363.058239446							119964
SMR000066944	LSM-31408	BRD-K08388529, SID3711321	2116482	InChI=1S/C20H21N5O4S/c1-14(26)24-9-11-25(12-10-24)30(28,29)16-6-4-5-15(13-16)19(27)23-20-21-17-7-2-3-8-18(17)22-20/h2-8,13H,9-12H2,1H3,(H2,21,22,23,27)	LASJEFQNBBFWDM-UHFFFAOYSA-N	CC(=O)N1CCN(CC1)S(=O)(=O)c2cccc(c2)C(=O)Nc3nc4ccccc4[nH]3	BroadT	BRD-K08388529	BRD-K08388529-001-05-7	Enamine Ltd.	T5244995			CC(=O)N1CCN(CC1)S(=O)(=O)c1cccc(c1)C(=O)Nc1nc2ccccc2[nH]1	InChI=1S/C20H21N5O4S/c1-14(26)24-9-11-25(12-10-24)30(28,29)16-6-4-5-15(13-16)19(27)23-20-21-17-7-2-3-8-18(17)22-20/h2-8,13H,9-12H2,1H3,(H2,21,22,23,27)	LASJEFQNBBFWDM-UHFFFAOYSA-N	427.131424892							119965
AMBCB27893463	LSM-31409	BRD-A23340824, SID24800679	16192348	InChI=1S/C24H26ClN3O3/c1-30-20-8-9-21(22(13-20)31-2)24(29)17-5-3-11-27(15-17)16-19-6-4-12-28(19)23-10-7-18(25)14-26-23/h4,6-10,12-14,17H,3,5,11,15-16H2,1-2H3	VMPRULWEVWCPNB-UHFFFAOYSA-N	COc1ccc(C(=O)C2CCCN(Cc3cccn3c4ccc(Cl)cn4)C2)c(OC)c1	BroadT	BRD-A23340824	BRD-A23340824-001-06-1	ChemBridge Corporation	27893463			COc1ccc(C(=O)C2CCCN(Cc3cccn3-c3ccc(Cl)cn3)C2)c(OC)c1	InChI=1S/C24H26ClN3O3/c1-30-20-8-9-21(22(13-20)31-2)24(29)17-5-3-11-27(15-17)16-19-6-4-12-28(19)23-10-7-18(25)14-26-23/h4,6-10,12-14,17H,3,5,11,15-16H2,1-2H3	VMPRULWEVWCPNB-UHFFFAOYSA-N	439.166269432							119966
SMR000194198	LSM-31410	BRD-K67104687, SID17506584	2886334	InChI=1S/C24H21N9/c1-31(2)19-15-13-18(14-16-19)17-22(23-25-27-29-32(23)20-9-5-3-6-10-20)24-26-28-30-33(24)21-11-7-4-8-12-21/h3-17H,1-2H3	GWPVLAMALAXBBS-UHFFFAOYSA-N	CN(C)c1ccc(C=C(c2nnnn2c3ccccc3)c4nnnn4c5ccccc5)cc1	BroadT	BRD-K67104687	BRD-K67104687-001-05-4	ChemBridge Corporation	6110297			CN(C)c1ccc(C=C(c2nnnn2-c2ccccc2)c2nnnn2-c2ccccc2)cc1	InChI=1S/C24H21N9/c1-31(2)19-15-13-18(14-16-19)17-22(23-25-27-29-32(23)20-9-5-3-6-10-20)24-26-28-30-33(24)21-11-7-4-8-12-21/h3-17H,1-2H3	GWPVLAMALAXBBS-UHFFFAOYSA-N	435.191991762							119967
1-(4-Bromophenyl)-3-(2-fluorophenyl)thiourea	LSM-31411	BRD-K38248167, SID17433832	976402	InChI=1S/C13H10BrFN2S/c14-9-5-7-10(8-6-9)16-13(18)17-12-4-2-1-3-11(12)15/h1-8H,(H2,16,17,18)	OTFSLGRMDQRXQJ-UHFFFAOYSA-N	Fc1ccccc1N=C(S)Nc2ccc(Br)cc2	BroadT	BRD-K38248167	BRD-K38248167-001-06-2	ChemBridge Corporation	7723034			Fc1ccccc1N=C(S)Nc1ccc(Br)cc1	InChI=1S/C13H10BrFN2S/c14-9-5-7-10(8-6-9)16-13(18)17-12-4-2-1-3-11(12)15/h1-8H,(H2,16,17,18)	OTFSLGRMDQRXQJ-UHFFFAOYSA-N	323.97320983							119968
MLS000561458	LSM-31412	BRD-A04510218, SID17407410	11958633	InChI=1S/C29H30N4O4/c34-28(30-18-8-7-11-22-9-3-1-4-10-22)29-21-32(19-23-12-5-2-6-13-23)20-26(29)27(31-37-29)24-14-16-25(17-15-24)33(35)36/h1-6,9-10,12-17,26H,7-8,11,18-21H2,(H,30,34)	AJVHLBIZFWJCAE-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)C2=NOC3(CN(Cc4ccccc4)CC23)C(=O)NCCCCc5ccccc5	BroadT	BRD-A04510218	BRD-A04510218-001-05-8	University of California at Davis	CLY_NIH_B02			[O-][N+](=O)c1ccc(cc1)C1=NOC2(CN(Cc3ccccc3)CC12)C(=O)NCCCCc1ccccc1	InChI=1S/C29H30N4O4/c34-28(30-18-8-7-11-22-9-3-1-4-10-22)29-21-32(19-23-12-5-2-6-13-23)20-26(29)27(31-37-29)24-14-16-25(17-15-24)33(35)36/h1-6,9-10,12-17,26H,7-8,11,18-21H2,(H,30,34)	AJVHLBIZFWJCAE-UHFFFAOYSA-N	498.22670548							119969
AQ-750/41791610	LSM-31413	BRD-K30594227, SID4242902, SID87341107	3237694	InChI=1S/C20H23N3O2S/c1-6-13-14(9-21)19(26-10-15-11(2)23-25-12(15)3)22-16-7-20(4,5)8-17(24)18(13)16/h6-8,10H2,1-5H3	KWLXUCWSOPMBFC-UHFFFAOYSA-N	CCc1c(C#N)c(SCc2c(C)onc2C)nc3CC(C)(C)CC(=O)c13	BroadT	BRD-K30594227	BRD-K30594227-001-05-7	ChemDiv Inc.	5867-2115			CCc1c(C#N)c(SCc2c(C)noc2C)nc2CC(C)(C)CC(=O)c12	InChI=1S/C20H23N3O2S/c1-6-13-14(9-21)19(26-10-15-11(2)23-25-12(15)3)22-16-7-20(4,5)8-17(24)18(13)16/h6-8,10H2,1-5H3	KWLXUCWSOPMBFC-UHFFFAOYSA-N	369.151097696							119970
F0593-0105	LSM-31414	BRD-K70876639, SID24816030	4647380	InChI=1S/C17H24N4O7S/c1-25-10-8-21(9-11-26-2)29(23,24)14-6-4-13(5-7-14)16(22)18-17-20-19-15(28-17)12-27-3/h4-7H,8-12H2,1-3H3,(H,18,20,22)	ZJVDIRBVFGOAPS-UHFFFAOYSA-N	COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)Nc2oc(COC)nn2	BroadT	BRD-K70876639	BRD-K70876639-001-05-1	Life Chemicals Inc.	F0593-0105			COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(COC)o1	InChI=1S/C17H24N4O7S/c1-25-10-8-21(9-11-26-2)29(23,24)14-6-4-13(5-7-14)16(22)18-17-20-19-15(28-17)12-27-3/h4-7H,8-12H2,1-3H3,(H,18,20,22)	ZJVDIRBVFGOAPS-UHFFFAOYSA-N	428.136569838							119971
3L-577S	LSM-31415	BRD-K04488512	3842739	InChI=1S/C11H11ClN2OS/c1-14-11(15)6-9(13-14)7-16-10-4-2-8(12)3-5-10/h2-6,15H,7H2,1H3	SKNXMYGKUCMKBA-UHFFFAOYSA-N	Cn1nc(CSc2ccc(Cl)cc2)cc1O	BroadT	BRD-K04488512	BRD-K04488512-001-06-6	Key Organics Ltd.	3L-577S			Cn1nc(CSc2ccc(Cl)cc2)cc1O	InChI=1S/C11H11ClN2OS/c1-14-11(15)6-9(13-14)7-16-10-4-2-8(12)3-5-10/h2-6,15H,7H2,1H3	SKNXMYGKUCMKBA-UHFFFAOYSA-N	254.028061392							
AC1LOZC1	LSM-44352	SID26663551, BRD-K00505499	1275683	InChI=1S/C22H20N4O/c1-15-12-18(17(3)25(15)20-10-7-11-23-14-20)13-21-16(2)24-26(22(21)27)19-8-5-4-6-9-19/h4-14H,1-3H3/b21-13-	REBPHPLMEBXQFT-BKUYFWCQSA-N	CC1=NN(C(=O)/C/1=C\c2cc(C)n(c2C)c3cccnc3)c4ccccc4	BroadT	BRD-K00505499	BRD-K00505499-001-06-8	InterBioScreen Ltd.	STOCK2S-56055			CC1=NN(C(=O)C\1=C/c1cc(C)n(c1C)-c1cccnc1)c1ccccc1	InChI=1S/C22H20N4O/c1-15-12-18(17(3)25(15)20-10-7-11-23-14-20)13-21-16(2)24-26(22(21)27)19-8-5-4-6-9-19/h4-14H,1-3H3/b21-13-	REBPHPLMEBXQFT-BKUYFWCQSA-N	356.1637113							
MLS001239174	LSM-31417	BRD-K36464765, SID51085697	3624880	InChI=1S/C11H8N4O6S/c16-9(7-1-2-8(22-7)15(17)18)12-11-14-13-10(21-11)6-5-19-3-4-20-6/h1-2,5H,3-4H2,(H,12,14,16)	RBQJOQGIUQMPNT-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(s1)C(=O)Nc2oc(nn2)C3=COCCO3	BroadT	BRD-K36464765	BRD-K36464765-001-06-3	Life Chemicals Inc.	F0608-0164			[O-][N+](=O)c1ccc(s1)C(=O)Nc1nnc(o1)C1=COCCO1	InChI=1S/C11H8N4O6S/c16-9(7-1-2-8(22-7)15(17)18)12-11-14-13-10(21-11)6-5-19-3-4-20-6/h1-2,5H,3-4H2,(H,12,14,16)	RBQJOQGIUQMPNT-UHFFFAOYSA-N	324.016454706							119974
CHEMBL243813	LSM-31418	BRD-K73540839	409920	InChI=1S/C14H11NO2/c1-17-12-8-4-7-11-13(12)14(16)9-5-2-3-6-10(9)15-11/h2-8H,1H3,(H,15,16)	NSKBTSFWBPFPMI-UHFFFAOYSA-N	COc1cccc2nc3ccccc3c(O)c12	BroadT	BRD-K73540839	BRD-K73540839-001-05-8	Specs	AP-782/41885433			COc1cccc2nc3ccccc3c(O)c12	InChI=1S/C14H11NO2/c1-17-12-8-4-7-11-13(12)14(16)9-5-2-3-6-10(9)15-11/h2-8H,1H3,(H,15,16)	NSKBTSFWBPFPMI-UHFFFAOYSA-N	225.078978602							119975
SMR000242457	LSM-44353	SID17517149, BRD-K27221973	2413169	InChI=1S/C24H20ClNO5S/c1-30-21-14-16(6-12-20(21)27)7-13-24(29)31-15-23(28)26-19-4-2-3-5-22(19)32-18-10-8-17(25)9-11-18/h2-14,27H,15H2,1H3,(H,26,28)/b13-7+	HBRNOSWZLULCKS-NTUHNPAUSA-N	COc1cc(\C=C\C(=O)OCC(=O)Nc2ccccc2Sc3ccc(Cl)cc3)ccc1O	BroadT	BRD-K27221973	BRD-K27221973-001-06-6	Enamine Ltd.	T0515-4287			COc1cc(\C=C\C(=O)OCC(=O)Nc2ccccc2Sc2ccc(Cl)cc2)ccc1O	InChI=1S/C24H20ClNO5S/c1-30-21-14-16(6-12-20(21)27)7-13-24(29)31-15-23(28)26-19-4-2-3-5-22(19)32-18-10-8-17(25)9-11-18/h2-14,27H,15H2,1H3,(H,26,28)/b13-7+	HBRNOSWZLULCKS-NTUHNPAUSA-N	469.07507115							
AC1MD0X0	LSM-31420	BRD-A50701104, SID14731355	2829153	InChI=1S/C23H25NO3/c1-15(2)12-17-8-10-18(11-9-17)16(3)23(26)27-14-22(25)20-13-24-21-7-5-4-6-19(20)21/h4-11,13,15-16,24H,12,14H2,1-3H3	VMFHPBILVMKRFS-UHFFFAOYSA-N	CC(C)Cc1ccc(cc1)C(C)C(=O)OCC(=O)c2c[nH]c3ccccc23	BroadT	BRD-A50701104	BRD-A50701104-001-05-3	ChemBridge Corporation	5132954			CC(C)Cc1ccc(cc1)C(C)C(=O)OCC(=O)c1c[nH]c2ccccc12	InChI=1S/C23H25NO3/c1-15(2)12-17-8-10-18(11-9-17)16(3)23(26)27-14-22(25)20-13-24-21-7-5-4-6-19(20)21/h4-11,13,15-16,24H,12,14H2,1-3H3	VMFHPBILVMKRFS-UHFFFAOYSA-N	363.18344367							119977
ZINC00209999	LSM-31421	BRD-K21203629, SID47201506	755425	InChI=1S/C19H23NO2/c1-15(2)20(14-17-7-5-4-6-8-17)19(21)13-16-9-11-18(22-3)12-10-16/h4-12,15H,13-14H2,1-3H3	XXZBZQLVWSUCLM-UHFFFAOYSA-N	COc1ccc(CC(=O)N(Cc2ccccc2)C(C)C)cc1	BroadT	BRD-K21203629	BRD-K21203629-001-05-0	Vitas-M Laboratory Ltd.	STK182894			COc1ccc(CC(=O)N(Cc2ccccc2)C(C)C)cc1	InChI=1S/C19H23NO2/c1-15(2)20(14-17-7-5-4-6-8-17)19(21)13-16-9-11-18(22-3)12-10-16/h4-12,15H,13-14H2,1-3H3	XXZBZQLVWSUCLM-UHFFFAOYSA-N	297.172878986							119978
T5346865	LSM-31422	BRD-K62533881, SID24831957	2570923	InChI=1S/C20H21N3O3S/c1-14-6-2-4-8-17(14)21-20(24)15-10-12-23(13-11-15)19-16-7-3-5-9-18(16)27(25,26)22-19/h2-9,15H,10-13H2,1H3,(H,21,24)	BXCIIPOBOKAOGF-UHFFFAOYSA-N	Cc1ccccc1NC(=O)C2CCN(CC2)C3=NS(=O)(=O)c4ccccc34	BroadT	BRD-K62533881	BRD-K62533881-001-05-3	Enamine Ltd.	T5346865			Cc1ccccc1NC(=O)C1CCN(CC1)C1=NS(=O)(=O)c2ccccc12	InChI=1S/C20H21N3O3S/c1-14-6-2-4-8-17(14)21-20(24)15-10-12-23(13-11-15)19-16-7-3-5-9-18(16)27(25,26)22-19/h2-9,15H,10-13H2,1H3,(H,21,24)	BXCIIPOBOKAOGF-UHFFFAOYSA-N	383.130362252							119979
T5239770	LSM-31423	BRD-A87494167, SID14745912	3886672	InChI=1S/C17H18F3N3O2S/c18-17(19,20)11-5-4-6-12(9-11)21-14(24)10-13-15(25)22-16(26-13)23-7-2-1-3-8-23/h4-6,9,13H,1-3,7-8,10H2,(H,21,24)	YFQAKEJZJFOMGC-UHFFFAOYSA-N	FC(F)(F)c1cccc(NC(=O)CC2SC(=NC2=O)N3CCCCC3)c1	BroadT	BRD-A87494167	BRD-A87494167-001-06-4	Enamine Ltd.	T5239770			FC(F)(F)c1cccc(NC(=O)CC2SC(=NC2=O)N2CCCCC2)c1	InChI=1S/C17H18F3N3O2S/c18-17(19,20)11-5-4-6-12(9-11)21-14(24)10-13-15(25)22-16(26-13)23-7-2-1-3-8-23/h4-6,9,13H,1-3,7-8,10H2,(H,21,24)	YFQAKEJZJFOMGC-UHFFFAOYSA-N	385.107182136							119980
CHEMDIV2_008384	LSM-31424	BRD-K13619800, SID24815383	6620526	InChI=1S/C23H21N3OS/c1-3-19-18-11-15(2)6-8-21(18)28-22-9-7-17(12-20(22)26-19)23(27)25-14-16-5-4-10-24-13-16/h4-13H,3,14H2,1-2H3,(H,25,27)	URDKQQIMLBJZOD-UHFFFAOYSA-N	CCC1=Nc2cc(ccc2Sc3ccc(C)cc13)C(=O)NCc4cccnc4	BroadT	BRD-K13619800	BRD-K13619800-001-07-4	ChemDiv Inc.	K788-0665			CCC1=Nc2cc(ccc2Sc2ccc(C)cc12)C(=O)NCc1cccnc1	InChI=1S/C23H21N3OS/c1-3-19-18-11-15(2)6-8-21(18)28-22-9-7-17(12-20(22)26-19)23(27)25-14-16-5-4-10-24-13-16/h4-13H,3,14H2,1-2H3,(H,25,27)	URDKQQIMLBJZOD-UHFFFAOYSA-N	387.140533012							119981
ZINC03303252	LSM-31425	BRD-K74694052, SID22406962	3651522	InChI=1S/C24H21N3O4/c1-16-25-20-14-17(12-13-21(20)27(16)18-8-4-3-5-9-18)24(29)31-15-23(28)26-19-10-6-7-11-22(19)30-2/h3-14H,15H2,1-2H3,(H,26,28)	NJBFYOFRRRGHAV-UHFFFAOYSA-N	COc1ccccc1NC(=O)COC(=O)c2ccc3c(c2)nc(C)n3c4ccccc4	BroadT	BRD-K74694052	BRD-K74694052-001-05-2	Enamine Ltd.	T5213110			COc1ccccc1NC(=O)COC(=O)c1ccc2n(c(C)nc2c1)-c1ccccc1	InChI=1S/C24H21N3O4/c1-16-25-20-14-17(12-13-21(20)27(16)18-8-4-3-5-9-18)24(29)31-15-23(28)26-19-10-6-7-11-22(19)30-2/h3-14H,15H2,1-2H3,(H,26,28)	NJBFYOFRRRGHAV-UHFFFAOYSA-N	415.153206182							119982
F1853-0114	LSM-31426	BRD-K21648400, SID17514829	7197240	InChI=1S/C12H9ClN4OS2/c1-7-10(18)17-11(15-14-7)20-12(16-17)19-6-8-2-4-9(13)5-3-8/h2-5H,6H2,1H3	CVALHODZKLPIKF-UHFFFAOYSA-N	CC1=NN=C2SC(=NN2C1=O)SCc3ccc(Cl)cc3	BroadT	BRD-K21648400	BRD-K21648400-001-05-1	Life Chemicals Inc.	F1853-0114			Cc1nnc2sc(SCc3ccc(Cl)cc3)nn2c1=O	InChI=1S/C12H9ClN4OS2/c1-7-10(18)17-11(15-14-7)20-12(16-17)19-6-8-2-4-9(13)5-3-8/h2-5H,6H2,1H3	CVALHODZKLPIKF-UHFFFAOYSA-N	323.990630038							119983
2H-397S	LSM-31427	BRD-K75094875, SID17409591	4209635	InChI=1S/C11H10Cl2N4O/c1-6-15-10(11(18)14-2)16-17(6)9-5-7(12)3-4-8(9)13/h3-5H,1-2H3,(H,14,18)	DDHBUSGSZZMBFV-UHFFFAOYSA-N	CNC(=O)c1nc(C)n(n1)c2cc(Cl)ccc2Cl	BroadT	BRD-K75094875	BRD-K75094875-001-05-9	Key Organics Ltd.	2H-397S			CNC(=O)c1nc(C)n(n1)-c1cc(Cl)ccc1Cl	InChI=1S/C11H10Cl2N4O/c1-6-15-10(11(18)14-2)16-17(6)9-5-7(12)3-4-8(9)13/h3-5H,1-2H3,(H,14,18)	DDHBUSGSZZMBFV-UHFFFAOYSA-N	284.0231664							119984
2,4-Dichloro-6-[(1,3-thiazol-2-ylimino)methyl]phenol	LSM-31428	BRD-K24235529	6739300	InChI=1S/C10H6Cl2N2OS/c11-7-3-6(9(15)8(12)4-7)5-14-10-13-1-2-16-10/h1-5,15H	RRAFJUHCKWCFLN-UHFFFAOYSA-N	Oc1c(Cl)cc(Cl)cc1C=Nc2nccs2	BroadT	BRD-K24235529	BRD-K24235529-001-05-0	InterBioScreen Ltd.	STOCK3S-38030			Oc1c(Cl)cc(Cl)cc1C=Nc1nccs1	InChI=1S/C10H6Cl2N2OS/c11-7-3-6(9(15)8(12)4-7)5-14-10-13-1-2-16-10/h1-5,15H	RRAFJUHCKWCFLN-UHFFFAOYSA-N	271.957788942							
F0769-0010	LSM-31429	BRD-A27844016, SID17414695	2952532	InChI=1S/C19H21N3OS/c1-13-4-6-14(7-5-13)17-12-18(22(21-17)19(24)20-2)15-8-10-16(23-3)11-9-15/h4-11,18H,12H2,1-3H3,(H,20,24)	XIJKEYVMOYKQGK-UHFFFAOYSA-N	CNC(=S)N1N=C(CC1c2ccc(OC)cc2)c3ccc(C)cc3	BroadT	BRD-A27844016	BRD-A27844016-001-05-8	ChemBridge Corporation	7759884			CNC(=S)N1N=C(CC1c1ccc(OC)cc1)c1ccc(C)cc1	InChI=1S/C19H21N3OS/c1-13-4-6-14(7-5-13)17-12-18(22(21-17)19(24)20-2)15-8-10-16(23-3)11-9-15/h4-11,18H,12H2,1-3H3,(H,20,24)	XIJKEYVMOYKQGK-UHFFFAOYSA-N	339.140533012							119986
MLS000582597	LSM-31430	BRD-K01627964, SID17509595	4651152	InChI=1S/C22H21N2O4P/c1-26-29(25,27-2)22-21(23-15-16-9-4-3-5-10-16)28-20(24-22)19-14-8-12-17-11-6-7-13-18(17)19/h3-14,23H,15H2,1-2H3	KZDVVIYQKAFCIA-UHFFFAOYSA-N	COP(=O)(OC)c1nc(oc1NCc2ccccc2)c3cccc4ccccc34	BroadT	BRD-K01627964	BRD-K01627964-001-06-5	ChemDiv Inc.	D055-0108			COP(=O)(OC)c1nc(oc1NCc1ccccc1)-c1cccc2ccccc12	InChI=1S/C22H21N2O4P/c1-26-29(25,27-2)22-21(23-15-16-9-4-3-5-10-16)28-20(24-22)19-14-8-12-17-11-6-7-13-18(17)19/h3-14,23H,15H2,1-2H3	KZDVVIYQKAFCIA-UHFFFAOYSA-N	408.123893682							119987
AC1LEI30	LSM-44354	SID14740920, BRD-K31466024	736420	InChI=1S/C13H11NO/c1-10(15)6-8-12-9-7-11-4-2-3-5-13(11)14-12/h2-9H,1H3/b8-6+	ZFAXBDTVRSPYNB-SOFGYWHQSA-N	CC(=O)\C=C\c1ccc2ccccc2n1	BroadT	BRD-K31466024	BRD-K31466024-001-05-2	InterBioScreen Ltd.	STOCK1S-09144			CC(=O)\C=C\c1ccc2ccccc2n1	InChI=1S/C13H11NO/c1-10(15)6-8-12-9-7-11-4-2-3-5-13(11)14-12/h2-9H,1H3/b8-6+	ZFAXBDTVRSPYNB-SOFGYWHQSA-N	197.084063982							
ST50985583	LSM-31432	BRD-K40358491, SID24814879	5371486	InChI=1S/C10H9ClN4O/c1-6-9(10(16)15-12-6)14-13-8-4-2-7(11)3-5-8/h2-5H,1H3,(H2,12,15,16)	MMQOLYRBIMAWCR-UHFFFAOYSA-N	Cc1n[nH]c(O)c1N=Nc2ccc(Cl)cc2	BroadT	BRD-K40358491	BRD-K40358491-001-05-4	ChemDiv Inc.	3565-0675			Cc1n[nH]c(O)c1N=Nc1ccc(Cl)cc1	InChI=1S/C10H9ClN4O/c1-6-9(10(16)15-12-6)14-13-8-4-2-7(11)3-5-8/h2-5H,1H3,(H2,12,15,16)	MMQOLYRBIMAWCR-UHFFFAOYSA-N	236.046488658							
MLS000583865	LSM-31433	BRD-K45833502, SID17509569, SID85176656	12004883	InChI=1S/C24H22ClN3O5S/c25-20-8-4-5-9-22(20)34(32,33)23-11-10-19(16-21(23)28(30)31)24(29)27-14-12-26(13-15-27)17-18-6-2-1-3-7-18/h1-11,16H,12-15,17H2	PLEPZKJLVYQJMF-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1S(=O)(=O)c2ccccc2Cl)C(=O)N3CCN(Cc4ccccc4)CC3	BroadT	BRD-K45833502	BRD-K45833502-001-05-8	ChemDiv Inc.	K781-2792			[O-][N+](=O)c1cc(ccc1S(=O)(=O)c1ccccc1Cl)C(=O)N1CCN(Cc2ccccc2)CC1	InChI=1S/C24H22ClN3O5S/c25-20-8-4-5-9-22(20)34(32,33)23-11-10-19(16-21(23)28(30)31)24(29)27-14-12-26(13-15-27)17-18-6-2-1-3-7-18/h1-11,16H,12-15,17H2	PLEPZKJLVYQJMF-UHFFFAOYSA-N	499.096869234							119990
AC1NEXQJ	LSM-31434	BRD-A80081229, SID14719211	4599680	InChI=1S/C14H14N4O2/c1-9-12(6-15,7-16)13(8-17)10-4-2-3-5-14(10,19-9)20-11(13)18/h9-10,18H,2-5H2,1H3	RASWCAKLSZMKOI-UHFFFAOYSA-N	CC1OC23CCCCC2C(C#N)(C(=N)O3)C1(C#N)C#N	BroadT	BRD-A80081229	BRD-A80081229-001-05-4	Specs	AG-205/13578188			CC1OC23CCCCC2C(C#N)(C(=N)O3)C1(C#N)C#N	InChI=1S/C14H14N4O2/c1-9-12(6-15,7-16)13(8-17)10-4-2-3-5-14(10,19-9)20-11(13)18/h9-10,18H,2-5H2,1H3	RASWCAKLSZMKOI-UHFFFAOYSA-N	270.111675728							119991
ST020782	LSM-31435	BRD-K27909962, SID24809113	679296	InChI=1S/C15H15N3O/c1-9-6-7-13(19-9)14-10-4-2-3-5-12(10)18-15(17)11(14)8-16/h6-7H,2-5H2,1H3,(H2,17,18)	CTSKFMRSRFSGHX-UHFFFAOYSA-N	Cc1oc(cc1)c2c3CCCCc3nc(N)c2C#N	BroadT	BRD-K27909962	BRD-K27909962-001-05-1	Asinex Ltd.	BAS 00609471			Cc1ccc(o1)-c1c2CCCCc2nc(N)c1C#N	InChI=1S/C15H15N3O/c1-9-6-7-13(19-9)14-10-4-2-3-5-12(10)18-15(17)11(14)8-16/h6-7H,2-5H2,1H3,(H2,17,18)	CTSKFMRSRFSGHX-UHFFFAOYSA-N	253.12151213							119992
MLS000543823	LSM-31436	BRD-A71833059, SID17401325	4668964	InChI=1S/C9H10N4O4/c10-2-6-1-7(13(16)17)3-11-9(6)12-4-8(15)5-14/h1,3,8,14-15H,4-5H2,(H,11,12)	BGKVIAKFOYSKOZ-UHFFFAOYSA-N	OCC(O)CNc1ncc(cc1C#N)[N+](=O)[O-]	BroadT	BRD-A71833059	BRD-A71833059-001-06-2	Specs	AH-262/37093035			OCC(O)CNc1ncc(cc1C#N)[N+]([O-])=O	InChI=1S/C9H10N4O4/c10-2-6-1-7(13(16)17)3-11-9(6)12-4-8(15)5-14/h1,3,8,14-15H,4-5H2,(H,11,12)	BGKVIAKFOYSKOZ-UHFFFAOYSA-N	238.07020484							119993
AM-807/41929662	LSM-31437	BRD-K21467089, SID47204209	845666	InChI=1S/C11H11FN4S/c12-8-3-1-2-7(4-8)6-17-11-15-9(13)5-10(14)16-11/h1-5H,6H2,(H4,13,14,15,16)	UDUYIQIRGNLDKA-UHFFFAOYSA-N	Nc1cc(N)nc(SCc2cccc(F)c2)n1	BroadT	BRD-K21467089	BRD-K21467089-001-06-2	Asinex Ltd.	BAS 07418399			Nc1cc(N)nc(SCc2cccc(F)c2)n1	InChI=1S/C11H11FN4S/c12-8-3-1-2-7(4-8)6-17-11-15-9(13)5-10(14)16-11/h1-5H,6H2,(H4,13,14,15,16)	UDUYIQIRGNLDKA-UHFFFAOYSA-N	250.068845282							119994
AC1OA1YY	LSM-31438	BRD-K36961619	6744631	InChI=1S/C10H10N4O2/c1-7-5-9(14-16-7)10(15)13-12-6-8-3-2-4-11-8/h2-6,11H,1H3,(H,13,15)	FNJJJDZORXBLNA-UHFFFAOYSA-N	Cc1onc(c1)C(=O)NN=Cc2ccc[nH]2	BroadT	BRD-K36961619	BRD-K36961619-001-05-8	Specs	AK-968/41026836			Cc1cc(no1)C(=O)NN=Cc1ccc[nH]1	InChI=1S/C10H10N4O2/c1-7-5-9(14-16-7)10(15)13-12-6-8-3-2-4-11-8/h2-6,11H,1H3,(H,13,15)	FNJJJDZORXBLNA-UHFFFAOYSA-N	218.0803756							
3-Methoxy-n-(2,3,4-trifluorophenyl)benzamide	LSM-31439	BRD-K94771818, SID14745710	2111618	InChI=1S/C14H10F3NO2/c1-20-9-4-2-3-8(7-9)14(19)18-11-6-5-10(15)12(16)13(11)17/h2-7H,1H3,(H,18,19)	IVPFPQXQQLRYFS-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Nc2ccc(F)c(F)c2F	BroadT	BRD-K94771818	BRD-K94771818-001-06-7	Enamine Ltd.	T5241911			COc1cccc(c1)C(=O)Nc1ccc(F)c(F)c1F	InChI=1S/C14H10F3NO2/c1-20-9-4-2-3-8(7-9)14(19)18-11-6-5-10(15)12(16)13(11)17/h2-7H,1H3,(H,18,19)	IVPFPQXQQLRYFS-UHFFFAOYSA-N	281.06636317							119996
ASN 07200885	LSM-31440	BRD-K76351135, SID17508003	1434023	InChI=1S/C22H22ClN7O2S/c1-29(2)33(31,32)17-11-9-16(10-12-17)24-21-19-22(26-20(25-21)14-7-8-14)30(28-27-19)13-15-5-3-4-6-18(15)23/h3-6,9-12,14H,7-8,13H2,1-2H3,(H,24,25,26)	OWCNMPULVFDBBD-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(Nc2nc(nc3c2nnn3Cc4ccccc4Cl)C5CC5)cc1	BroadT	BRD-K76351135	BRD-K76351135-001-06-6	Asinex Ltd.	ASN 07200885			CN(C)S(=O)(=O)c1ccc(Nc2nc(nc3n(Cc4ccccc4Cl)nnc23)C2CC2)cc1	InChI=1S/C22H22ClN7O2S/c1-29(2)33(31,32)17-11-9-16(10-12-17)24-21-19-22(26-20(25-21)14-7-8-14)30(28-27-19)13-15-5-3-4-6-18(15)23/h3-6,9-12,14H,7-8,13H2,1-2H3,(H,24,25,26)	OWCNMPULVFDBBD-UHFFFAOYSA-N	483.124421414							119997
2-{[3-Cyano-6-(4-methylphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-n-(4-methoxyphenyl)acetamide	LSM-31441	BRD-K38607769, SID17407047	1051489	InChI=1S/C23H18F3N3O2S/c1-14-3-5-15(6-4-14)20-11-19(23(24,25)26)18(12-27)22(29-20)32-13-21(30)28-16-7-9-17(31-2)10-8-16/h3-11H,13H2,1-2H3,(H,28,30)	GLNJUZAIPKMZOH-UHFFFAOYSA-N	COc1ccc(NC(=O)CSc2nc(cc(c2C#N)C(F)(F)F)c3ccc(C)cc3)cc1	BroadT	BRD-K38607769	BRD-K38607769-001-05-3	Specs	AF-399/41703362			COc1ccc(NC(=O)CSc2nc(cc(c2C#N)C(F)(F)F)-c2ccc(C)cc2)cc1	InChI=1S/C23H18F3N3O2S/c1-14-3-5-15(6-4-14)20-11-19(23(24,25)26)18(12-27)22(29-20)32-13-21(30)28-16-7-9-17(31-2)10-8-16/h3-11H,13H2,1-2H3,(H,28,30)	GLNJUZAIPKMZOH-UHFFFAOYSA-N	457.107182136							119998
2-(4,5-Dihydro-1H-imidazol-2-ylsulfanyl)-n-(4-methylphenyl)acetamide	LSM-15442	BRD-K81220870	1711726	InChI=1S/C12H15N3OS/c1-9-2-4-10(5-3-9)15-11(16)8-17-12-13-6-7-14-12/h2-5H,6-8H2,1H3,(H,13,14)(H,15,16)	CHQVJNYCKRTYRO-UHFFFAOYSA-N	Cc1ccc(NC(=O)CSC2=NCCN2)cc1	BroadT	BRD-K81220870	BRD-K81220870-003-05-3	Life Chemicals Inc.	F0832-0059		Cl	Cc1ccc(NC(=O)CSC2=NCCN2)cc1.Cl	InChI=1S/C12H15N3OS.ClH/c1-9-2-4-10(5-3-9)15-11(16)8-17-12-13-6-7-14-12;/h2-5H,6-8H2,1H3,(H,13,14)(H,15,16);1H	LFLRHANNPUHTHU-UHFFFAOYSA-N	249.09358282							104084, 104084
F0608-0473	LSM-31442	BRD-A42579861, SID51090332	4536912	InChI=1S/C19H20N4O5S/c1-13-5-2-3-11-23(13)29(25,26)15-9-7-14(8-10-15)17(24)20-19-22-21-18(28-19)16-6-4-12-27-16/h4,6-10,12-13H,2-3,5,11H2,1H3,(H,20,22,24)	CYTYQVPACRJHSZ-UHFFFAOYSA-N	CC1CCCCN1S(=O)(=O)c2ccc(cc2)C(=O)Nc3oc(nn3)c4occc4	BroadT	BRD-A42579861	BRD-A42579861-001-05-7	Life Chemicals Inc.	F0608-0473			CC1CCCCN1S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(o1)-c1ccco1	InChI=1S/C19H20N4O5S/c1-13-5-2-3-11-23(13)29(25,26)15-9-7-14(8-10-15)17(24)20-19-22-21-18(28-19)16-6-4-12-27-16/h4,6-10,12-13H,2-3,5,11H2,1H3,(H,20,22,24)	CYTYQVPACRJHSZ-UHFFFAOYSA-N	416.11544047							119999
SMR000105751	LSM-31443	SID7975552, BRD-K38710631	737233	InChI=1S/C14H13N3O2/c1-19-9-11-7-14(18)17-13(15-11)8-12(16-17)10-5-3-2-4-6-10/h2-8,18H,9H2,1H3	KRXGTCHGUODPAZ-UHFFFAOYSA-N	COCc1cc(O)n2nc(cc2n1)c3ccccc3	BroadT	BRD-K38710631	BRD-K38710631-001-05-1	ChemBridge Corporation	6073484			COCc1cc(O)n2nc(cc2n1)-c1ccccc1	InChI=1S/C14H13N3O2/c1-19-9-11-7-14(18)17-13(15-11)8-12(16-17)10-5-3-2-4-6-10/h2-8,18H,9H2,1H3	KRXGTCHGUODPAZ-UHFFFAOYSA-N	255.100776686							
BRD-A88381870	LSM-44355	BRD-A88381870		InChI=1S/C21H18N2O4/c24-17(12-11-15-7-3-1-4-8-15)18-19(25)22-21(27)23(20(18)26)14-13-16-9-5-2-6-10-16/h1-12,18H,13-14H2,(H,22,25,27)/b12-11+	AWFNTRWBUVOYPF-VAWYXSNFSA-N	O=C(\C=C\c1ccccc1)C2C(=O)NC(=O)N(CCc3ccccc3)C2=O	BroadT	BRD-A88381870	BRD-A88381870-001-05-2	InterBioScreen Ltd.	STOCK5S-54502			O=C(\C=C\c1ccccc1)C1C(=O)NC(=O)N(CCc2ccccc2)C1=O	InChI=1S/C21H18N2O4/c24-17(12-11-15-7-3-1-4-8-15)18-19(25)22-21(27)23(20(18)26)14-13-16-9-5-2-6-10-16/h1-12,18H,13-14H2,(H,22,25,27)/b12-11+	AWFNTRWBUVOYPF-VAWYXSNFSA-N	362.126657076							
AN-979/41971068	LSM-44356	SID22411929, BRD-K98189856	6020348	InChI=1S/C18H17NO3/c1-13(20)19-16-10-7-14(8-11-16)17(21)12-9-15-5-3-4-6-18(15)22-2/h3-12H,1-2H3,(H,19,20)/b12-9+	ASDDMCAZRJHKBL-FMIVXFBMSA-N	COc1ccccc1\C=C\C(=O)c2ccc(NC(=O)C)cc2	BroadT	BRD-K98189856	BRD-K98189856-001-05-3	Specs	AN-979/41971068			COc1ccccc1\C=C\C(=O)c1ccc(NC(C)=O)cc1	InChI=1S/C18H17NO3/c1-13(20)19-16-10-7-14(8-11-16)17(21)12-9-15-5-3-4-6-18(15)22-2/h3-12H,1-2H3,(H,19,20)/b12-9+	ASDDMCAZRJHKBL-FMIVXFBMSA-N	295.120843414							
ZINC8690888	LSM-31446	BRD-K74329400, SID17510671	52098032	InChI=1S/C15H14N4O5S2/c1-3-26(22,23)15-18-19-12(16)9(13(21)17-14(19)25-15)6-8-4-5-10(20)11(7-8)24-2/h4-7,16,20H,3H2,1-2H3/b9-6+,16-12?	VJQIYEAWOKQGCL-OCFSITRASA-N	CCS(=O)(=O)C1=NN2C(=NC(=O)\C(=C\c3ccc(O)c(OC)c3)\C2=N)S1	BroadT	BRD-K74329400	BRD-K74329400-001-05-4	ChemDiv Inc.	C356-0567			CCS(=O)(=O)C1=NN2C(S1)=NC(=O)\C(=C\c1ccc(O)c(OC)c1)C2=N	InChI=1S/C15H14N4O5S2/c1-3-26(22,23)15-18-19-12(16)9(13(21)17-14(19)25-15)6-8-4-5-10(20)11(7-8)24-2/h4-7,16,20H,3H2,1-2H3/b9-6+,16-12?	VJQIYEAWOKQGCL-OCFSITRASA-N	394.040560968							
AC1OALNB	LSM-31447	BRD-K91189798, SID49828585	6831619	InChI=1S/C23H19N5O6S/c1-13(29)24-14-6-9-16(10-7-14)35(33,34)28-22-21(26-18-4-2-3-5-19(18)27-22)25-15-8-11-20(30)17(12-15)23(31)32/h2-12,30H,1H3,(H,24,29)(H,25,26)(H,27,28)(H,31,32)	QKJBNXQNGGHPGN-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nc3ccccc3nc2Nc4ccc(O)c(c4)C(=O)O	BroadT	BRD-K91189798	BRD-K91189798-001-05-1	InterBioScreen Ltd.	STOCK1S-58670			CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1ccc(O)c(c1)C(O)=O	InChI=1S/C23H19N5O6S/c1-13(29)24-14-6-9-16(10-7-14)35(33,34)28-22-21(26-18-4-2-3-5-19(18)27-22)25-15-8-11-20(30)17(12-15)23(31)32/h2-12,30H,1H3,(H,24,29)(H,25,26)(H,27,28)(H,31,32)	QKJBNXQNGGHPGN-UHFFFAOYSA-N	493.105604068							
AC1MLULI	LSM-31448	BRD-K73697974, SID24804549	3228823	InChI=1S/C21H24FN5O2/c1-29-17-8-6-16(7-9-17)14-27-20(23-24-25-27)15-26-12-10-21(28,11-13-26)18-4-2-3-5-19(18)22/h2-9,28H,10-15H2,1H3	ABOHGGKWMDDIIV-UHFFFAOYSA-N	COc1ccc(Cn2nnnc2CN3CCC(O)(CC3)c4ccccc4F)cc1	BroadT	BRD-K73697974	BRD-K73697974-001-05-1	Asinex Ltd.	ASN 07834552			COc1ccc(Cn2nnnc2CN2CCC(O)(CC2)c2ccccc2F)cc1	InChI=1S/C21H24FN5O2/c1-29-17-8-6-16(7-9-17)14-27-20(23-24-25-27)15-26-12-10-21(28,11-13-26)18-4-2-3-5-19(18)22/h2-9,28H,10-15H2,1H3	ABOHGGKWMDDIIV-UHFFFAOYSA-N	397.191403258							120005
MLS000420672	LSM-31449	BRD-A47428621, SID26732046	16746239	InChI=1S/C25H25BrN4O5/c1-35-20-9-2-16(3-10-20)12-13-28-21-11-6-18(14-23(21)30(33)34)22(15-24(27)31)29-25(32)17-4-7-19(26)8-5-17/h2-11,14,22,28H,12-13,15H2,1H3,(H2,27,31)(H,29,32)	DYNKWWYXPRMXOF-UHFFFAOYSA-N	COc1ccc(CCNc2ccc(cc2[N+](=O)[O-])C(CC(=O)N)NC(=O)c3ccc(Br)cc3)cc1	BroadT	BRD-A47428621	BRD-A47428621-001-07-9	University of California at Davis	X2-R17-R221			COc1ccc(CCNc2ccc(cc2[N+]([O-])=O)C(CC(N)=O)NC(=O)c2ccc(Br)cc2)cc1	InChI=1S/C25H25BrN4O5/c1-35-20-9-2-16(3-10-20)12-13-28-21-11-6-18(14-23(21)30(33)34)22(15-24(27)31)29-25(32)17-4-7-19(26)8-5-17/h2-11,14,22,28H,12-13,15H2,1H3,(H2,27,31)(H,29,32)	DYNKWWYXPRMXOF-UHFFFAOYSA-N	540.10083254							120006
AC1LYMPV	LSM-31450	SID26660378, BRD-K58996625	1878990	InChI=1S/C17H14N4O2S/c22-15(19-10-13-8-4-5-9-18-13)16(23)21-17-20-14(11-24-17)12-6-2-1-3-7-12/h1-9,11H,10H2,(H,19,22)(H,20,21,23)	XXMMONHXVMMSHK-UHFFFAOYSA-N	O=C(NCc1ccccn1)C(=O)Nc2nc(cs2)c3ccccc3	BroadT	BRD-K58996625	BRD-K58996625-001-05-9	InterBioScreen Ltd.	STOCK1S-30020			O=C(NCc1ccccn1)C(=O)Nc1nc(cs1)-c1ccccc1	InChI=1S/C17H14N4O2S/c22-15(19-10-13-8-4-5-9-18-13)16(23)21-17-20-14(11-24-17)12-6-2-1-3-7-12/h1-9,11H,10H2,(H,19,22)(H,20,21,23)	XXMMONHXVMMSHK-UHFFFAOYSA-N	338.083746418							120007
MLS000587240	LSM-31451	SID17512365, BRD-K68575551	213331	InChI=1S/C18H15NO2/c1-13-7-12-17(14-5-3-2-4-6-14)19(13)16-10-8-15(9-11-16)18(20)21/h2-12H,1H3,(H,20,21)	HBCZMEBBIJRTOC-UHFFFAOYSA-N	Cc1ccc(c2ccccc2)n1c3ccc(cc3)C(=O)O	BroadT	BRD-K68575551	BRD-K68575551-001-06-5	InterBioScreen Ltd.	STOCK2S-44355			Cc1ccc(-c2ccccc2)n1-c1ccc(cc1)C(O)=O	InChI=1S/C18H15NO2/c1-13-7-12-17(14-5-3-2-4-6-14)19(13)16-10-8-15(9-11-16)18(20)21/h2-12H,1H3,(H,20,21)	HBCZMEBBIJRTOC-UHFFFAOYSA-N	277.11027873							120008
AC1NR5ST	LSM-44357	DNDI1417952, BRD-M01343043	5285252	InChI=1S/C22H16Cl2N2O/c23-18-7-3-1-5-13(18)11-14-9-10-16-20(15-6-2-4-8-19(15)24)17(12-25)22(26)27-21(14)16/h1-8,11,20H,9-10,26H2/b14-11+	PHVJIUXRWPYOJS-SDNWHVSQSA-N	NC1=C(C#N)C(C2=C(O1)\C(=C\c3ccccc3Cl)\CC2)c4ccccc4Cl	BroadT	BRD-M01343043	BRD-M01343043-001-05-4	InterBioScreen Ltd.	STOCK1S-15958		CCO.NC1=C(C#N)C(C2=C(O1)\C(CC2)=C\c1ccccc1Cl)c1ccccc1Cl	CCO.NC1=C(C#N)C(C2=C(O1)\C(CC2)=C\c1ccccc1Cl)c1ccccc1Cl	InChI=1S/C22H16Cl2N2O.C2H6O/c23-18-7-3-1-5-13(18)11-14-9-10-16-20(15-6-2-4-8-19(15)24)17(12-25)22(26)27-21(14)16;1-2-3/h1-8,11,20H,9-10,26H2;3H,2H2,1H3/b14-11+;	ADCNYPCMZJMRFF-JHGYPSGKSA-N	394.063968572							, 
MLS000682294	LSM-31453	SID24813800, BRD-K07540687	16194150	InChI=1S/C14H13ClN2O4/c1-21-13-4-2-3-9(14(13)18)8-16-12-6-5-10(17(19)20)7-11(12)15/h2-7,16,18H,8H2,1H3	RTLZOBRZHORAJW-UHFFFAOYSA-N	COc1cccc(CNc2ccc(cc2Cl)[N+](=O)[O-])c1O	BroadT	BRD-K07540687	BRD-K07540687-001-06-0	ChemDiv Inc.	K630-0014			COc1cccc(CNc2ccc(cc2Cl)[N+]([O-])=O)c1O	InChI=1S/C14H13ClN2O4/c1-21-13-4-2-3-9(14(13)18)8-16-12-6-5-10(17(19)20)7-11(12)15/h2-7,16,18H,8H2,1H3	RTLZOBRZHORAJW-UHFFFAOYSA-N	308.056384626							120010
6-(4-Methylpiperidin-1-yl)-7H-purine	LSM-44358	BRD-K42453497	756692	InChI=1S/C11H15N5/c1-8-2-4-16(5-3-8)11-9-10(13-6-12-9)14-7-15-11/h6-8H,2-5H2,1H3,(H,12,13,14,15)	OUNRAWGIKYOXGG-UHFFFAOYSA-N	CC1CCN(CC1)c2[nH]cnc3ncnc23	BroadT	BRD-K42453497	BRD-K42453497-001-05-5	Life Chemicals Inc.	F0578-0106			CC1CCN(CC1)c1[nH]cnc2ncnc12	InChI=1S/C11H15N5/c1-8-2-4-16(5-3-8)11-9-10(13-6-12-9)14-7-15-11/h6-8H,2-5H2,1H3,(H,12,13,14,15)	OUNRAWGIKYOXGG-UHFFFAOYSA-N	217.13274553							
ST50936530	LSM-31455	SID24782390, BRD-A97270959	2971387	InChI=1S/C15H16BrNO2/c1-9-4-5-10(2)12(8-9)11(3)17-15(18)13-6-7-14(16)19-13/h4-8,11H,1-3H3,(H,17,18)	WQWSRQOIGLOXTM-UHFFFAOYSA-N	CC(NC(=O)c1oc(Br)cc1)c2cc(C)ccc2C	BroadT	BRD-A97270959	BRD-A97270959-001-05-0	ChemBridge Corporation	7948660			CC(NC(=O)c1ccc(Br)o1)c1cc(C)ccc1C	InChI=1S/C15H16BrNO2/c1-9-4-5-10(2)12(8-9)11(3)17-15(18)13-6-7-14(16)19-13/h4-8,11H,1-3H3,(H,17,18)	WQWSRQOIGLOXTM-UHFFFAOYSA-N	321.036441362							120012
AC1MKVZJ	LSM-31456	BRD-A04691170, SID49643439	3210615	InChI=1S/C19H22Cl2N2O3/c1-19(2,3)22-18(25)17(13-6-8-14(21)9-7-13)23(16(24)11-20)12-15-5-4-10-26-15/h4-10,17H,11-12H2,1-3H3,(H,22,25)	IAPJRCFFOMMGON-UHFFFAOYSA-N	CC(C)(C)NC(=O)C(N(Cc1occc1)C(=O)CCl)c2ccc(Cl)cc2	BroadT	BRD-A04691170	BRD-A04691170-001-06-0	Asinex Ltd.	ASN 05561945			CC(C)(C)NC(=O)C(N(Cc1ccco1)C(=O)CCl)c1ccc(Cl)cc1	InChI=1S/C19H22Cl2N2O3/c1-19(2,3)22-18(25)17(13-6-8-14(21)9-7-13)23(16(24)11-20)12-15-5-4-10-26-15/h4-10,17H,11-12H2,1-3H3,(H,22,25)	IAPJRCFFOMMGON-UHFFFAOYSA-N	396.100748004							120013
SMR000220401	LSM-44359	SID17504945, BRD-K66912462	1737171	InChI=1S/C21H19N3OS/c1-13-8-9-16(10-14(13)2)22-21-23-20(25)19(26-21)11-15-12-24(3)18-7-5-4-6-17(15)18/h4-12H,1-3H3,(H,22,23,25)/b19-11-	JZEFBZMLAJEBMC-ODLFYWEKSA-N	Cc1ccc(NC2=NC(=O)\C(=C\c3cn(C)c4ccccc34)\S2)cc1C	BroadT	BRD-K66912462	BRD-K66912462-001-04-5	InterBioScreen Ltd.	STOCK4S-68711			Cc1ccc(NC2=NC(=O)\C(S2)=C\c2cn(C)c3ccccc23)cc1C	InChI=1S/C21H19N3OS/c1-13-8-9-16(10-14(13)2)22-21-23-20(25)19(26-21)11-15-12-24(3)18-7-5-4-6-17(15)18/h4-12H,1-3H3,(H,22,23,25)/b19-11-	JZEFBZMLAJEBMC-ODLFYWEKSA-N	361.124882948							
AMBCB54877035	LSM-31458	SID49736878, BRD-A39031631	24793911	InChI=1S/C23H27ClN2O2/c24-21-5-1-3-19(13-21)20-4-2-6-22(14-20)25-23(27)18-7-10-26(11-8-18)15-17-9-12-28-16-17/h1-6,13-14,17-18H,7-12,15-16H2,(H,25,27)	KCTKQIJFSAJZNG-UHFFFAOYSA-N	Clc1cccc(c1)c2cccc(NC(=O)C3CCN(CC4CCOC4)CC3)c2	BroadT	BRD-A39031631	BRD-A39031631-001-05-3	ChemBridge Corporation	54877035			Clc1cccc(c1)-c1cccc(NC(=O)C2CCN(CC3CCOC3)CC2)c1	InChI=1S/C23H27ClN2O2/c24-21-5-1-3-19(13-21)20-4-2-6-22(14-20)25-23(27)18-7-10-26(11-8-18)15-17-9-12-28-16-17/h1-6,13-14,17-18H,7-12,15-16H2,(H,25,27)	KCTKQIJFSAJZNG-UHFFFAOYSA-N	398.176105834							120015
AC1NI9DD	LSM-31459	BRD-K54979104	4852566	InChI=1S/C19H18N4O2/c1-2-25-18(24)12-17(14-8-4-3-5-9-14)22-23-19-15-10-6-7-11-16(15)20-13-21-19/h3-11,13H,2,12H2,1H3,(H,20,21,23)	LUPPDGTURPREON-UHFFFAOYSA-N	CCOC(=O)CC(=NNc1ncnc2ccccc12)c3ccccc3	BroadT	BRD-K54979104	BRD-K54979104-001-06-7	Enamine Ltd.	T5394213			CCOC(=O)CC(=NNc1ncnc2ccccc12)c1ccccc1	InChI=1S/C19H18N4O2/c1-2-25-18(24)12-17(14-8-4-3-5-9-14)22-23-19-15-10-6-7-11-16(15)20-13-21-19/h3-11,13H,2,12H2,1H3,(H,20,21,23)	LUPPDGTURPREON-UHFFFAOYSA-N	334.142975856							120016
SMR000029349	LSM-31460	SID4244674, BRD-K81782447	3239246	InChI=1S/C20H23N5O2/c1-15-6-8-16(9-7-15)25-19-17(12-22-25)20(27)24(14-21-19)13-18(26)23-10-4-2-3-5-11-23/h6-9,12,14H,2-5,10-11,13H2,1H3	AYDJCJLWNASLKU-UHFFFAOYSA-N	Cc1ccc(cc1)n2ncc3C(=O)N(CC(=O)N4CCCCCC4)C=Nc23	BroadT	BRD-K81782447	BRD-K81782447-001-05-0	ChemDiv Inc.	C801-0129			Cc1ccc(cc1)-n1ncc2c1ncn(CC(=O)N1CCCCCC1)c2=O	InChI=1S/C20H23N5O2/c1-15-6-8-16(9-7-15)25-19-17(12-22-25)20(27)24(14-21-19)13-18(26)23-10-4-2-3-5-11-23/h6-9,12,14H,2-5,10-11,13H2,1H3	AYDJCJLWNASLKU-UHFFFAOYSA-N	365.185175026							120017
MLS000860958	LSM-2484	SID26729740, BRD-K21788104	2824173	InChI=1S/C16H12N4O2S/c21-14(11-5-2-1-3-6-11)19-20-15(22)13-10-23-16(18-13)12-7-4-8-17-9-12/h1-10H,(H,19,21)(H,20,22)	IULXYATWZVFRIR-UHFFFAOYSA-N	O=C(NNC(=O)c1csc(n1)c2cccnc2)c3ccccc3	BroadT	BRD-K21788104	BRD-K21788104-001-08-8	Maybridge	MWP 00339			O=C(NNC(=O)c1ccccc1)c1csc(n1)-c1cccnc1	InChI=1S/C16H12N4O2S/c21-14(11-5-2-1-3-6-11)19-20-15(22)13-10-23-16(18-13)12-7-4-8-17-9-12/h1-10H,(H,19,21)(H,20,22)	IULXYATWZVFRIR-UHFFFAOYSA-N	324.068096354							92391
ZINC03314121	LSM-31461	BRD-K75679095, SID14745382	2429889	InChI=1S/C16H13ClN2O3/c17-15-12(5-3-8-18-15)16(21)22-10-14(20)19-9-7-11-4-1-2-6-13(11)19/h1-6,8H,7,9-10H2	NJMVXXUOYZYXGF-UHFFFAOYSA-N	Clc1ncccc1C(=O)OCC(=O)N2CCc3ccccc23	BroadT	BRD-K75679095	BRD-K75679095-001-05-1	Enamine Ltd.	T0516-0391			Clc1ncccc1C(=O)OCC(=O)N1CCc2ccccc12	InChI=1S/C16H13ClN2O3/c17-15-12(5-3-8-18-15)16(21)22-10-14(20)19-9-7-11-4-1-2-6-13(11)19/h1-6,8H,7,9-10H2	NJMVXXUOYZYXGF-UHFFFAOYSA-N	316.061470006							120018
ST50985145	LSM-31462	BRD-K50127933, SID14735296	4440356	InChI=1S/C15H14N4O2/c20-15-11-3-1-2-4-12(11)16-13-5-6-14(17-19(13)15)18-7-9-21-10-8-18/h1-6H,7-10H2	KRPNMJXQNSRRPZ-UHFFFAOYSA-N	O=C1N2N=C(C=CC2=Nc3ccccc13)N4CCOCC4	BroadT	BRD-K50127933	BRD-K50127933-001-05-6	ChemDiv Inc.	D012-0170			O=c1c2ccccc2nc2ccc(nn12)N1CCOCC1	InChI=1S/C15H14N4O2/c20-15-11-3-1-2-4-12(11)16-13-5-6-14(17-19(13)15)18-7-9-21-10-8-18/h1-6H,7-10H2	KRPNMJXQNSRRPZ-UHFFFAOYSA-N	282.111675728							120019
MLS000911540	LSM-31463	BRD-K90094729, SID26731879	16746084	InChI=1S/C20H29N7O3S/c1-12(2)16(10-28)24-20-25-18(17-19(26-20)27(11-23-17)13(3)4)22-9-14-5-7-15(8-6-14)31(21,29)30/h5-8,11-13,16,28H,9-10H2,1-4H3,(H2,21,29,30)(H2,22,24,25,26)/t16-/m0/s1	NJODIZOLKGNJRX-INIZCTEOSA-N	CC(C)[C@H](CO)Nc1nc(NCc2ccc(cc2)S(=O)(=O)N)c3ncn(C(C)C)c3n1	BroadT	BRD-K90094729	BRD-K90094729-001-08-2	Dana Farber Cancer Institute	AMY001-021			CC(C)[C@H](CO)Nc1nc(NCc2ccc(cc2)S(N)(=O)=O)c2ncn(C(C)C)c2n1	InChI=1S/C20H29N7O3S/c1-12(2)16(10-28)24-20-25-18(17-19(26-20)27(11-23-17)13(3)4)22-9-14-5-7-15(8-6-14)31(21,29)30/h5-8,11-13,16,28H,9-10H2,1-4H3,(H2,21,29,30)(H2,22,24,25,26)/t16-/m0/s1	NJODIZOLKGNJRX-INIZCTEOSA-N	447.205258548							120020
AC1M0WAT	LSM-31464	BRD-K30103771, SID26661617	2036026	InChI=1S/C22H14ClNO3/c23-17-8-6-15(7-9-17)21(25)20-19(14-4-2-1-3-5-14)13-18-12-16(22(26)27)10-11-24(18)20/h1-13H,(H,26,27)	ZLKYMLBXPNYVNV-UHFFFAOYSA-N	OC(=O)c1ccn2c(C(=O)c3ccc(Cl)cc3)c(cc2c1)c4ccccc4	BroadT	BRD-K30103771	BRD-K30103771-001-05-7	InterBioScreen Ltd.	STOCK4S-83826			OC(=O)c1ccn2c(C(=O)c3ccc(Cl)cc3)c(cc2c1)-c1ccccc1	InChI=1S/C22H14ClNO3/c23-17-8-6-15(7-9-17)21(25)20-19(14-4-2-1-3-5-14)13-18-12-16(22(26)27)10-11-24(18)20/h1-13H,(H,26,27)	ZLKYMLBXPNYVNV-UHFFFAOYSA-N	375.066221028							120021
1-[(Diethylamino)carbonyl]-4-methoxypyridinium	LSM-45208		3239834	InChI=1S/C24H20B.C11H17N2O2/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-4-12(5-2)11(14)13-8-6-10(15-3)7-9-13/h1-20H;6-9H,4-5H2,1-3H3/q-1;+1	NWHIILWDTYZIBX-UHFFFAOYSA-N	CCN(CC)C(=O)[n+]1ccc(OC)cc1.c2ccc(cc2)[B-](c3ccccc3)(c4ccccc4)c5ccccc5	BroadT	BRD-K63169405	BRD-K63169405-246-04-6	ChemDiv Inc.	2346-0066		c1ccc(cc1)[B-](c2ccccc2)(c3ccccc3)c4ccccc4	CCN(CC)C(=O)[n+]1ccc(OC)cc1.c1ccc(cc1)[B-](c2ccccc2)(c3ccccc3)c4ccccc4	InChI=1S/C24H20B.C11H17N2O2/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-4-12(5-2)11(14)13-8-6-10(15-3)7-9-13/h1-20H;6-9H,4-5H2,1-3H3/q-1;+1	NWHIILWDTYZIBX-UHFFFAOYSA-N	528.294808944							
SMR000061862	LSM-31465	SID3717455, BRD-K12578029	1927137	InChI=1S/C20H17N7O/c21-12-14-17-19(26-16-9-5-4-8-15(16)25-17)27(18(14)22)11-10-23-20(28)24-13-6-2-1-3-7-13/h1-9H,10-11,22H2,(H2,23,24,28)	NRSOPYNZUNZZCK-UHFFFAOYSA-N	Nc1c(C#N)c2nc3ccccc3nc2n1CCNC(=O)Nc4ccccc4	BroadT	BRD-K12578029	BRD-K12578029-001-06-0	Enamine Ltd.	T0511-8841			Nc1c(C#N)c2nc3ccccc3nc2n1CCNC(=O)Nc1ccccc1	InChI=1S/C20H17N7O/c21-12-14-17-19(26-16-9-5-4-8-15(16)25-17)27(18(14)22)11-10-23-20(28)24-13-6-2-1-3-7-13/h1-9H,10-11,22H2,(H2,23,24,28)	NRSOPYNZUNZZCK-UHFFFAOYSA-N	371.149458234							120022
BAS 01053386	LSM-31466	BRD-A39900448, SID47202711	5480018	InChI=1S/C15H16O3/c1-8-3-4-10-11(5-8)14-12(16)6-9(2)7-13(14)18-15(10)17/h6-8,16H,3-5H2,1-2H3	WPWQMODURBITKV-UHFFFAOYSA-N	CC1CCC2=C(C1)c3c(O)cc(C)cc3OC2=O	BroadT	BRD-A39900448	BRD-A39900448-001-05-2	Asinex Ltd.	BAS 01053386			CC1CCc2c(C1)c1c(O)cc(C)cc1oc2=O	InChI=1S/C15H16O3/c1-8-3-4-10-11(5-8)14-12(16)6-9(2)7-13(14)18-15(10)17/h6-8,16H,3-5H2,1-2H3	WPWQMODURBITKV-UHFFFAOYSA-N	244.109944372							120023
MLS000032326	LSM-31467	BRD-K91197462, SID26667787, SID849169	651638	InChI=1S/C25H28N2O8/c1-6-33-19-14-17(27-25(29)18-9-8-10-35-18)20(34-7-2)13-16(19)26-24(28)15-11-21(30-3)23(32-5)22(12-15)31-4/h8-14H,6-7H2,1-5H3,(H,26,28)(H,27,29)	MRGSFNBCDBQOIV-UHFFFAOYSA-N	CCOc1cc(NC(=O)c2cc(OC)c(OC)c(OC)c2)c(OCC)cc1NC(=O)c3occc3	BroadT	BRD-K91197462	BRD-K91197462-001-05-9	Asinex Ltd.	ASN 03067805			CCOc1cc(NC(=O)c2cc(OC)c(OC)c(OC)c2)c(OCC)cc1NC(=O)c1ccco1	InChI=1S/C25H28N2O8/c1-6-33-19-14-17(27-25(29)18-9-8-10-35-18)20(34-7-2)13-16(19)26-24(28)15-11-21(30-3)23(32-5)22(12-15)31-4/h8-14H,6-7H2,1-5H3,(H,26,28)(H,27,29)	MRGSFNBCDBQOIV-UHFFFAOYSA-N	484.184565876							120024
AC1LCNAI	LSM-31468	BRD-K75148160, SID850409	652931	InChI=1S/C21H24N2O6S/c1-28-19-12-15-11-16(21(25)22-18(15)13-20(19)29-2)14-23(9-6-10-24)30(26,27)17-7-4-3-5-8-17/h3-5,7-8,11-13,24H,6,9-10,14H2,1-2H3,(H,22,25)	MKVDPYYJPSFPTG-UHFFFAOYSA-N	COc1cc2cc(CN(CCCO)S(=O)(=O)c3ccccc3)c(O)nc2cc1OC	BroadT	BRD-K75148160	BRD-K75148160-001-05-7	Asinex Ltd.	ASN 04366585			COc1cc2cc(CN(CCCO)S(=O)(=O)c3ccccc3)c(O)nc2cc1OC	InChI=1S/C21H24N2O6S/c1-28-19-12-15-11-16(21(25)22-18(15)13-20(19)29-2)14-23(9-6-10-24)30(26,27)17-7-4-3-5-8-17/h3-5,7-8,11-13,24H,6,9-10,14H2,1-2H3,(H,22,25)	MKVDPYYJPSFPTG-UHFFFAOYSA-N	432.135507198							120025
SMR000261370	LSM-44360	SID22408051, BRD-K46970272	15945244	InChI=1S/C27H22N2O3S/c30-24(28-19-9-2-1-3-10-19)17-32-27(31)25-21-12-4-5-14-23(21)29-26-18(8-6-13-22(25)26)16-20-11-7-15-33-20/h1-5,7,9-12,14-16H,6,8,13,17H2,(H,28,30)/b18-16-	CGYIUMHUNJWRHG-VLGSPTGOSA-N	O=C(COC(=O)c1c2CCC\C(=C\c3cccs3)\c2nc4ccccc14)Nc5ccccc5	BroadT	BRD-K46970272	BRD-K46970272-001-07-1	Enamine Ltd.	T0514-9893			O=C(COC(=O)c1c2CCC\C(=C\c3cccs3)c2nc2ccccc12)Nc1ccccc1	InChI=1S/C27H22N2O3S/c30-24(28-19-9-2-1-3-10-19)17-32-27(31)25-21-12-4-5-14-23(21)29-26-18(8-6-13-22(25)26)16-20-11-7-15-33-20/h1-5,7,9-12,14-16H,6,8,13,17H2,(H,28,30)/b18-16-	CGYIUMHUNJWRHG-VLGSPTGOSA-N	454.135113274							
AC1M6LYW	LSM-31470	BRD-K97692908	2401030	InChI=1S/C18H18N4O/c1-3-22-13(2)20-16-11-15(9-10-17(16)22)18(23)21-19-12-14-7-5-4-6-8-14/h4-12H,3H2,1-2H3,(H,21,23)	XKHSWYNYZXJJHD-UHFFFAOYSA-N	CCn1c(C)nc2cc(ccc12)C(=O)NN=Cc3ccccc3	BroadT	BRD-K97692908	BRD-K97692908-001-05-5	Enamine Ltd.	T0514-8993			CCn1c(C)nc2cc(ccc12)C(=O)NN=Cc1ccccc1	InChI=1S/C18H18N4O/c1-3-22-13(2)20-16-11-15(9-10-17(16)22)18(23)21-19-12-14-7-5-4-6-8-14/h4-12H,3H2,1-2H3,(H,21,23)	XKHSWYNYZXJJHD-UHFFFAOYSA-N	306.148061236							120027
SMR000106463	LSM-31471	BRD-K32251128, SID7974228	1339819	InChI=1S/C20H14ClN3O3/c21-15-7-3-13(4-8-15)12-18(25)22-16-9-5-14(6-10-16)19-23-24-20(27-19)17-2-1-11-26-17/h1-11H,12H2,(H,22,25)	ROWDABZTEOITHO-UHFFFAOYSA-N	Clc1ccc(CC(=O)Nc2ccc(cc2)c3oc(nn3)c4occc4)cc1	BroadT	BRD-K32251128	BRD-K32251128-001-05-2	ChemBridge Corporation	6502191			Clc1ccc(CC(=O)Nc2ccc(cc2)-c2nnc(o2)-c2ccco2)cc1	InChI=1S/C20H14ClN3O3/c21-15-7-3-13(4-8-15)12-18(25)22-16-9-5-14(6-10-16)19-23-24-20(27-19)17-2-1-11-26-17/h1-11H,12H2,(H,22,25)	ROWDABZTEOITHO-UHFFFAOYSA-N	379.072369048							120028
AC1O2QT2	LSM-44361	SID24781057, BRD-K25517783	6258408	InChI=1S/C20H16N4O/c1-14-18(20(25)22-21-14)12-16-13-24(17-10-6-3-7-11-17)23-19(16)15-8-4-2-5-9-15/h2-13H,1H3,(H,22,25)/b18-12-	DGSFFYVACCJJGR-PDGQHHTCSA-N	CC1=NNC(=O)/C/1=C\c2cn(nc2c3ccccc3)c4ccccc4	BroadT	BRD-K25517783	BRD-K25517783-001-09-3	Enamine Ltd.	T0503-1408			CC1=NNC(=O)C\1=C/c1cn(nc1-c1ccccc1)-c1ccccc1	InChI=1S/C20H16N4O/c1-14-18(20(25)22-21-14)12-16-13-24(17-10-6-3-7-11-17)23-19(16)15-8-4-2-5-9-15/h2-13H,1H3,(H,22,25)/b18-12-	DGSFFYVACCJJGR-PDGQHHTCSA-N	328.132411172							
F0590-0320	LSM-31473	BRD-K60507129, SID4250451	3244257	InChI=1S/C25H29N3O5S/c1-3-33-25(30)27-14-12-26(13-15-27)24(29)18-34(31,32)23-17-28(22-11-7-6-10-21(22)23)16-20-9-5-4-8-19(20)2/h4-11,17H,3,12-16,18H2,1-2H3	WZWQLHZHDBNBMN-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)CS(=O)(=O)c2cn(Cc3ccccc3C)c4ccccc24	BroadT	BRD-K60507129	BRD-K60507129-001-05-1	ChemDiv Inc.	C189-0320			CCOC(=O)N1CCN(CC1)C(=O)CS(=O)(=O)c1cn(Cc2ccccc2C)c2ccccc12	InChI=1S/C25H29N3O5S/c1-3-33-25(30)27-14-12-26(13-15-27)24(29)18-34(31,32)23-17-28(22-11-7-6-10-21(22)23)16-20-9-5-4-8-19(20)2/h4-11,17H,3,12-16,18H2,1-2H3	WZWQLHZHDBNBMN-UHFFFAOYSA-N	483.182791748							120030
T5300389	LSM-31474	BRD-K25846934, SID24827169	4876712	InChI=1S/C13H13N5O/c19-12(5-7-18-8-6-14-9-18)17-13-15-10-3-1-2-4-11(10)16-13/h1-4,6,8-9H,5,7H2,(H2,15,16,17,19)	BLYZZTHKYSHFFC-UHFFFAOYSA-N	O=C(CCn1ccnc1)Nc2nc3ccccc3[nH]2	BroadT	BRD-K25846934	BRD-K25846934-001-05-2	Enamine Ltd.	T5300389			O=C(CCn1ccnc1)Nc1nc2ccccc2[nH]1	InChI=1S/C13H13N5O/c19-12(5-7-18-8-6-14-9-18)17-13-15-10-3-1-2-4-11(10)16-13/h1-4,6,8-9H,5,7H2,(H2,15,16,17,19)	BLYZZTHKYSHFFC-UHFFFAOYSA-N	255.112010086							120031
AC1LIP3I	LSM-31475	BRD-K92791036, SID14736295	935379	InChI=1S/C16H15N3O2S/c1-12-7-9-14(10-8-12)22(20,21)19-11-15(16(17)18-19)13-5-3-2-4-6-13/h2-11H,1H3,(H2,17,18)	SMLVSUHYMGECDU-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)n2cc(c(N)n2)c3ccccc3	BroadT	BRD-K92791036	BRD-K92791036-001-06-3	ChemBridge Corporation	7938567			Cc1ccc(cc1)S(=O)(=O)n1cc(c(N)n1)-c1ccccc1	InChI=1S/C16H15N3O2S/c1-12-7-9-14(10-8-12)22(20,21)19-11-15(16(17)18-19)13-5-3-2-4-6-13/h2-11H,1H3,(H2,17,18)	SMLVSUHYMGECDU-UHFFFAOYSA-N	313.08849744							120032
N-[5-(4-Methoxybenzyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide	LSM-31476	BRD-K95499061, SID14724103	1409689	InChI=1S/C15H13N3O3S/c1-20-11-6-4-10(5-7-11)9-13-17-18-15(22-13)16-14(19)12-3-2-8-21-12/h2-8H,9H2,1H3,(H,16,18,19)	AKILLFQNTLYQHV-UHFFFAOYSA-N	COc1ccc(Cc2nnc(NC(=O)c3occc3)s2)cc1	BroadT	BRD-K95499061	BRD-K95499061-001-05-0	Asinex Ltd.	BAS 05023673			COc1ccc(Cc2nnc(NC(=O)c3ccco3)s2)cc1	InChI=1S/C15H13N3O3S/c1-20-11-6-4-10(5-7-11)9-13-17-18-15(22-13)16-14(19)12-3-2-8-21-12/h2-8H,9H2,1H3,(H,16,18,19)	AKILLFQNTLYQHV-UHFFFAOYSA-N	315.067761996							120033
2-Chloro-n-ethyl-n-phenylpropanamide	LSM-31477	BRD-A97759891, SID24825728	3817326	InChI=1S/C11H14ClNO/c1-3-13(11(14)9(2)12)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3	GGSOFYRMISJWQI-UHFFFAOYSA-N	CCN(C(=O)C(C)Cl)c1ccccc1	BroadT	BRD-A97759891	BRD-A97759891-001-05-3	Enamine Ltd.	T5287841			CCN(C(=O)C(C)Cl)c1ccccc1	InChI=1S/C11H14ClNO/c1-3-13(11(14)9(2)12)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3	GGSOFYRMISJWQI-UHFFFAOYSA-N	211.076391788							120034
MLS000523423	LSM-31478	BRD-A21584932, SID14720779	3185256	InChI=1S/C20H32N2O4S2/c1-3-17(2)21-27(23,24)18-8-10-19(11-9-18)28(25,26)22-15-7-14-20(16-22)12-5-4-6-13-20/h8-11,17,21H,3-7,12-16H2,1-2H3	CTTJGUVBPGOYCP-UHFFFAOYSA-N	CCC(C)NS(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCCC3(CCCCC3)C2	BroadT	BRD-A21584932	BRD-A21584932-001-05-7	Asinex Ltd.	ASN 04364234			CCC(C)NS(=O)(=O)c1ccc(cc1)S(=O)(=O)N1CCCC2(CCCCC2)C1	InChI=1S/C20H32N2O4S2/c1-3-17(2)21-27(23,24)18-8-10-19(11-9-18)28(25,26)22-15-7-14-20(16-22)12-5-4-6-13-20/h8-11,17,21H,3-7,12-16H2,1-2H3	CTTJGUVBPGOYCP-UHFFFAOYSA-N	428.180348904							120035
ZINC00551306	LSM-31479	BRD-K76620631, SID26663821	949776	InChI=1S/C17H12FN3O2/c1-22-12-8-6-11(7-9-12)20-17-15(10-19)21-16(23-17)13-4-2-3-5-14(13)18/h2-9,20H,1H3	PMVMZHXCYPLPCF-UHFFFAOYSA-N	COc1ccc(Nc2oc(nc2C#N)c3ccccc3F)cc1	BroadT	BRD-K76620631	BRD-K76620631-001-05-5	InterBioScreen Ltd.	STOCK3S-44013			COc1ccc(Nc2oc(nc2C#N)-c2ccccc2F)cc1	InChI=1S/C17H12FN3O2/c1-22-12-8-6-11(7-9-12)20-17-15(10-19)21-16(23-17)13-4-2-3-5-14(13)18/h2-9,20H,1H3	PMVMZHXCYPLPCF-UHFFFAOYSA-N	309.091354854							120036
AM-879/40839358	LSM-31480	BRD-K91895574, SID22417017	712366	InChI=1S/C15H19N3O3S/c1-5-18(6-2)12-8-7-10(21-12)9-11-13(19)16(3)15(22)17(4)14(11)20/h7-9H,5-6H2,1-4H3	PRJQIMOPFUKMQG-UHFFFAOYSA-N	CCN(CC)c1oc(C=C2C(=O)N(C)C(=S)N(C)C2=O)cc1	BroadT	BRD-K91895574	BRD-K91895574-001-05-3	ChemBridge Corporation	6320754			CCN(CC)c1ccc(C=C2C(=O)N(C)C(=S)N(C)C2=O)o1	InChI=1S/C15H19N3O3S/c1-5-18(6-2)12-8-7-10(21-12)9-11-13(19)16(3)15(22)17(4)14(11)20/h7-9H,5-6H2,1-4H3	PRJQIMOPFUKMQG-UHFFFAOYSA-N	321.114712188							120037
MLS000583958	LSM-31481	BRD-A21168039, SID17509715	12004952	InChI=1S/C20H28Cl2N2O4/c1-27-18(28-2)13-24(17(25)12-21)19(14-8-10-15(22)11-9-14)20(26)23-16-6-4-3-5-7-16/h8-11,16,18-19H,3-7,12-13H2,1-2H3,(H,23,26)	CNFMQRQCIJHJNG-UHFFFAOYSA-N	COC(CN(C(C(=O)NC1CCCCC1)c2ccc(Cl)cc2)C(=O)CCl)OC	BroadT	BRD-A21168039	BRD-A21168039-001-07-7	ChemDiv Inc.	K784-3630			COC(CN(C(C(=O)NC1CCCCC1)c1ccc(Cl)cc1)C(=O)CCl)OC	InChI=1S/C20H28Cl2N2O4/c1-27-18(28-2)13-24(17(25)12-21)19(14-8-10-15(22)11-9-14)20(26)23-16-6-4-3-5-7-16/h8-11,16,18-19H,3-7,12-13H2,1-2H3,(H,23,26)	CNFMQRQCIJHJNG-UHFFFAOYSA-N	430.142612816							120038
MLS000392188	LSM-31482	BRD-A81552806, SID22406761	3303189	InChI=1S/C15H14N2O5S/c1-10(11-5-3-2-4-6-11)16-13(18)9-22-15(19)12-7-8-14(23-12)17(20)21/h2-8,10H,9H2,1H3,(H,16,18)	NHJYQKGRAJXZSA-UHFFFAOYSA-N	CC(NC(=O)COC(=O)c1ccc(s1)[N+](=O)[O-])c2ccccc2	BroadT	BRD-A81552806	BRD-A81552806-001-06-2	Enamine Ltd.	T0515-5027			CC(NC(=O)COC(=O)c1ccc(s1)[N+]([O-])=O)c1ccccc1	InChI=1S/C15H14N2O5S/c1-10(11-5-3-2-4-6-11)16-13(18)9-22-15(19)12-7-8-14(23-12)17(20)21/h2-8,10H,9H2,1H3,(H,16,18)	NHJYQKGRAJXZSA-UHFFFAOYSA-N	334.062342258							120039
CBDIVE_015226	LSM-15443	BRD-A63590986	2769784	InChI=1S/C21H28N2O2/c1-2-18-8-10-21(11-9-18)25-17-20(24)16-22-12-14-23(15-13-22)19-6-4-3-5-7-19/h3-11,20,24H,2,12-17H2,1H3	YKVWVMYXYVXVLF-UHFFFAOYSA-N	CCc1ccc(OCC(O)CN2CCN(CC2)c3ccccc3)cc1	BroadT	BRD-A63590986	BRD-A63590986-003-06-2	Enamine Ltd.	T0501-2700		Cl	CCc1ccc(OCC(O)CN2CCN(CC2)c2ccccc2)cc1.Cl	InChI=1S/C21H28N2O2.ClH/c1-2-18-8-10-21(11-9-18)25-17-20(24)16-22-12-14-23(15-13-22)19-6-4-3-5-7-19;/h3-11,20,24H,2,12-17H2,1H3;1H	AVUWPLVUIQKQKM-UHFFFAOYSA-N	340.215078156							104085, 104085
SMR000004437	LSM-31483	BRD-A27407220, SID851468	654044	InChI=1S/C24H24N6O3/c1-15-5-4-6-17-12-18(24(31)25-21(15)17)22(29-9-2-3-10-29)23-26-27-28-30(23)13-16-7-8-19-20(11-16)33-14-32-19/h4-8,11-12,22H,2-3,9-10,13-14H2,1H3,(H,25,31)	RYCAEYBFASCZEV-UHFFFAOYSA-N	Cc1cccc2cc(C(N3CCCC3)c4nnnn4Cc5ccc6OCOc6c5)c(O)nc12	BroadT	BRD-A27407220	BRD-A27407220-001-05-6	Asinex Ltd.	ASN 05340593			Cc1cccc2cc(C(N3CCCC3)c3nnnn3Cc3ccc4OCOc4c3)c(O)nc12	InChI=1S/C24H24N6O3/c1-15-5-4-6-17-12-18(24(31)25-21(15)17)22(29-9-2-3-10-29)23-26-27-28-30(23)13-16-7-8-19-20(11-16)33-14-32-19/h4-8,11-12,22H,2-3,9-10,13-14H2,1H3,(H,25,31)	RYCAEYBFASCZEV-UHFFFAOYSA-N	444.190988688							120040
10H-538S	LSM-31484	BRD-K40367360, SID17402904	2765291	InChI=1S/C18H9Cl2FN2O/c19-15-7-6-14(9-16(15)20)24-18-12(10-22)3-8-17(23-18)11-1-4-13(21)5-2-11/h1-9H	DIPMIJOELRXPKR-UHFFFAOYSA-N	Fc1ccc(cc1)c2ccc(C#N)c(Oc3ccc(Cl)c(Cl)c3)n2	BroadT	BRD-K40367360	BRD-K40367360-001-05-3	Key Organics Ltd.	10H-538S			Fc1ccc(cc1)-c1ccc(C#N)c(Oc2ccc(Cl)c(Cl)c2)n1	InChI=1S/C18H9Cl2FN2O/c19-15-7-6-14(9-16(15)20)24-18-12(10-22)3-8-17(23-18)11-1-4-13(21)5-2-11/h1-9H	DIPMIJOELRXPKR-UHFFFAOYSA-N	358.007596548							120041
MLS000060343	LSM-31485	BRD-K01285236, SID3714946	2110903	InChI=1S/C8H6F3N3S/c1-3-2-4(8(9,10)11)5-6(13-3)14-7(12)15-5/h2H,1H3,(H2,12,13,14)	MIHOXIANEPXGEH-UHFFFAOYSA-N	Cc1cc(c2sc(N)nc2n1)C(F)(F)F	BroadT	BRD-K01285236	BRD-K01285236-001-05-6	Enamine Ltd.	T5241034			Cc1cc(c2sc(N)nc2n1)C(F)(F)F	InChI=1S/C8H6F3N3S/c1-3-2-4(8(9,10)11)5-6(13-3)14-7(12)15-5/h2H,1H3,(H2,12,13,14)	MIHOXIANEPXGEH-UHFFFAOYSA-N	233.023452512							120042
TCMDC-123629	LSM-31486	BRD-K77316284, TCMDC-123629	5022519	InChI=1S/C19H17BrN2O3/c20-14-6-7-17(23)16(9-14)18(24)13-8-12(10-21)19(25)22(11-13)15-4-2-1-3-5-15/h6-9,11,15,23H,1-5H2	WTAVOSVJMMSCTR-UHFFFAOYSA-N	Oc1ccc(Br)cc1C(=O)C2=CN(C3CCCCC3)C(=O)C(=C2)C#N	BroadT	BRD-K77316284	BRD-K77316284-001-05-9	Enamine Ltd.	T0516-7527			Oc1ccc(Br)cc1C(=O)c1cc(C#N)c(=O)n(c1)C1CCCCC1	InChI=1S/C19H17BrN2O3/c20-14-6-7-17(23)16(9-14)18(24)13-8-12(10-21)19(25)22(11-13)15-4-2-1-3-5-15/h6-9,11,15,23H,1-5H2	WTAVOSVJMMSCTR-UHFFFAOYSA-N	400.042255024							120043
AC1LQA3H	LSM-31487	BRD-K06166879	1345904	InChI=1S/C16H15BrFN3O2S/c1-22-14-7-10(8-20-21-16(19)24)6-12(17)15(14)23-9-11-4-2-3-5-13(11)18/h2-8H,9H2,1H3,(H3,19,21,24)	DWEHQOULYWLDKU-UHFFFAOYSA-N	COc1cc(C=NN=C(N)S)cc(Br)c1OCc2ccccc2F	BroadT	BRD-K06166879	BRD-K06166879-001-05-5	ChemBridge Corporation	6246408			COc1cc(C=NN=C(N)S)cc(Br)c1OCc1ccccc1F	InChI=1S/C16H15BrFN3O2S/c1-22-14-7-10(8-20-21-16(19)24)6-12(17)15(14)23-9-11-4-2-3-5-13(11)18/h2-8H,9H2,1H3,(H3,19,21,24)	DWEHQOULYWLDKU-UHFFFAOYSA-N	411.00523824							120044
ST086703	LSM-31488	BRD-K09328667, SID24821207	3150898	InChI=1S/C11H11N3O3S/c1-14-6-12-13-11(14)18-5-10(17)7-2-3-8(15)9(16)4-7/h2-4,6,15-16H,5H2,1H3	RNNHFMFZRVGMNL-UHFFFAOYSA-N	Cn1cnnc1SCC(=O)c2ccc(O)c(O)c2	BroadT	BRD-K09328667	BRD-K09328667-001-05-4	Asinex Ltd.	BAS 04848947			Cn1cnnc1SCC(=O)c1ccc(O)c(O)c1	InChI=1S/C11H11N3O3S/c1-14-6-12-13-11(14)18-5-10(17)7-2-3-8(15)9(16)4-7/h2-4,6,15-16H,5H2,1H3	RNNHFMFZRVGMNL-UHFFFAOYSA-N	265.052111932							120045
AC1LWIQR	LSM-44362	SID17505167, BRD-K00877314	1731145	InChI=1S/C17H19N3OS/c1-5-20-13-8-6-11(2)10-12(13)7-9-14(20)15-16(21)19(4)17(22)18(15)3/h6-10H,5H2,1-4H3/b15-14+	HJBYUXZWKCKZLP-CCEZHUSRSA-N	CCN1\C(=C/2\N(C)C(=S)N(C)C2=O)\C=Cc3cc(C)ccc13	BroadT	BRD-K00877314	BRD-K00877314-001-05-6	Asinex Ltd.	BAS 00336532			CCN1C(\C=Cc2cc(C)ccc12)=C1\N(C)C(=S)N(C)C1=O	InChI=1S/C17H19N3OS/c1-5-20-13-8-6-11(2)10-12(13)7-9-14(20)15-16(21)19(4)17(22)18(15)3/h6-10H,5H2,1-4H3/b15-14+	HJBYUXZWKCKZLP-CCEZHUSRSA-N	313.124882948							
366022-33-5	LSM-31490	BRD-K56836463, SID24824478	1472839	InChI=1S/C13H6F4N2O/c14-8-3-1-7(2-4-8)11-5-10(13(15,16)17)9(6-18)12(20)19-11/h1-5H,(H,19,20)	JGPWZOMOEKOIMO-UHFFFAOYSA-N	Oc1nc(cc(c1C#N)C(F)(F)F)c2ccc(F)cc2	BroadT	BRD-K56836463	BRD-K56836463-001-05-4	Key Organics Ltd.	2T-0865			Oc1nc(cc(c1C#N)C(F)(F)F)-c1ccc(F)cc1	InChI=1S/C13H6F4N2O/c14-8-3-1-7(2-4-8)11-5-10(13(15,16)17)9(6-18)12(20)19-11/h1-5H,(H,19,20)	JGPWZOMOEKOIMO-UHFFFAOYSA-N	282.041625632							120047
MLS000586764	LSM-31491	BRD-K66541472, SID22400622	15944700	InChI=1S/C20H13Cl2N3O3S/c21-13-7-14(22)9-15(8-13)23-18(26)12-3-1-11(2-4-12)10-25-19(27)17-16(5-6-29-17)24-20(25)28/h1-9H,10H2,(H,23,26)(H,24,28)	GYDOEUQAVKHYAM-UHFFFAOYSA-N	Clc1cc(Cl)cc(NC(=O)c2ccc(CN3C(=O)Nc4ccsc4C3=O)cc2)c1	BroadT	BRD-K66541472	BRD-K66541472-001-05-7	ChemDiv Inc.	C203-0063			Clc1cc(Cl)cc(NC(=O)c2ccc(Cn3c(=O)[nH]c4ccsc4c3=O)cc2)c1	InChI=1S/C20H13Cl2N3O3S/c21-13-7-14(22)9-15(8-13)23-18(26)12-3-1-11(2-4-12)10-25-19(27)17-16(5-6-29-17)24-20(25)28/h1-9H,10H2,(H,23,26)(H,24,28)	GYDOEUQAVKHYAM-UHFFFAOYSA-N	445.005467416							120048
AC1LJE7P	LSM-31492	BRD-K22216962	949243	InChI=1S/C13H13N5O4/c1-8(9-2-4-11(5-3-9)18(21)22)14-16-12(19)6-10-7-13(20)17-15-10/h2-5,7H,6H2,1H3,(H,16,19)(H2,15,17,20)	SVNGKQKCQKQFIE-UHFFFAOYSA-N	CC(=NNC(=O)Cc1cc(O)[nH]n1)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K22216962	BRD-K22216962-001-06-4	InterBioScreen Ltd.	STOCK3S-17482			CC(=NNC(=O)Cc1cc(O)[nH]n1)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C13H13N5O4/c1-8(9-2-4-11(5-3-9)18(21)22)14-16-12(19)6-10-7-13(20)17-15-10/h2-5,7H,6H2,1H3,(H,16,19)(H2,15,17,20)	SVNGKQKCQKQFIE-UHFFFAOYSA-N	303.096753946							120049
ST051654	LSM-31493	BRD-K66352426, SID17506944	573373	InChI=1S/C16H14FNOS2/c1-2-19-13-7-8-14-15(9-13)21-16(18-14)20-10-11-3-5-12(17)6-4-11/h3-9H,2,10H2,1H3	TWVLWRDAHHQANL-UHFFFAOYSA-N	CCOc1ccc2nc(SCc3ccc(F)cc3)sc2c1	BroadT	BRD-K66352426	BRD-K66352426-001-05-6	ChemBridge Corporation	6545316			CCOc1ccc2nc(SCc3ccc(F)cc3)sc2c1	InChI=1S/C16H14FNOS2/c1-2-19-13-7-8-14-15(9-13)21-16(18-14)20-10-11-3-5-12(17)6-4-11/h3-9H,2,10H2,1H3	TWVLWRDAHHQANL-UHFFFAOYSA-N	319.050083658							120050
2-(1,5-Dimethyl-1H-pyrazol-4-yl)quinoline-4-carboxylic acid	LSM-31494	BRD-K99939253, SID24781405	3164943	InChI=1S/C15H13N3O2/c1-9-12(8-16-18(9)2)14-7-11(15(19)20)10-5-3-4-6-13(10)17-14/h3-8H,1-2H3,(H,19,20)	HIAGTHWYOVNDNJ-UHFFFAOYSA-N	Cc1c(cnn1C)c2cc(C(=O)O)c3ccccc3n2	BroadT	BRD-K99939253	BRD-K99939253-001-05-9	Asinex Ltd.	BAS 13527864			Cc1c(cnn1C)-c1cc(C(O)=O)c2ccccc2n1	InChI=1S/C15H13N3O2/c1-9-12(8-16-18(9)2)14-7-11(15(19)20)10-5-3-4-6-13(10)17-14/h3-8H,1-2H3,(H,19,20)	HIAGTHWYOVNDNJ-UHFFFAOYSA-N	267.100776686							120051
MLS000091360	LSM-31495	BRD-K63271817, SID4244648	3239217	InChI=1S/C20H19N3O5/c1-25-15-5-2-13(3-6-15)20-22-19(28-23-20)9-8-18(24)21-14-4-7-16-17(12-14)27-11-10-26-16/h2-7,12H,8-11H2,1H3,(H,21,24)	OOGRKBDFVXQLBW-UHFFFAOYSA-N	COc1ccc(cc1)c2noc(CCC(=O)Nc3ccc4OCCOc4c3)n2	BroadT	BRD-K63271817	BRD-K63271817-001-05-8	ChemDiv Inc.	C320-0030			COc1ccc(cc1)-c1noc(CCC(=O)Nc2ccc3OCCOc3c2)n1	InChI=1S/C20H19N3O5/c1-25-15-5-2-13(3-6-15)20-22-19(28-23-20)9-8-18(24)21-14-4-7-16-17(12-14)27-11-10-26-16/h2-7,12H,8-11H2,1H3,(H,21,24)	OOGRKBDFVXQLBW-UHFFFAOYSA-N	381.132470738							120052
Ethyl 2-(4-chlorophenyl)-5-methyl-4-oxo-1,2,3,4-tetrahydrothieno[3,4-d]pyrimidine-7-carboxylate	LSM-31496	BRD-A64153357, SID17401594	3733246	InChI=1S/C16H15ClN2O3S/c1-3-22-16(21)13-12-11(8(2)23-13)15(20)19-14(18-12)9-4-6-10(17)7-5-9/h4-7,14,18H,3H2,1-2H3,(H,19,20)	GCWBXEZDJQNRGP-UHFFFAOYSA-N	CCOC(=O)c1sc(C)c2C(=O)NC(Nc12)c3ccc(Cl)cc3	BroadT	BRD-A64153357	BRD-A64153357-001-05-5	InterBioScreen Ltd.	STOCK2S-24364			CCOC(=O)c1sc(C)c2c1NC(NC2=O)c1ccc(Cl)cc1	InChI=1S/C16H15ClN2O3S/c1-3-22-16(21)13-12-11(8(2)23-13)15(20)19-14(18-12)9-4-6-10(17)7-5-9/h4-7,14,18H,3H2,1-2H3,(H,19,20)	GCWBXEZDJQNRGP-UHFFFAOYSA-N	350.04919076							120053
3,4-Dimethyl-n-(8-quinolinyl)benzamide	LSM-31497	BRD-K22244754, SID47199307	835411	InChI=1S/C18H16N2O/c1-12-8-9-15(11-13(12)2)18(21)20-16-7-3-5-14-6-4-10-19-17(14)16/h3-11H,1-2H3,(H,20,21)	ISAYRDBWTLRBCC-UHFFFAOYSA-N	Cc1ccc(cc1C)C(=O)Nc2cccc3cccnc23	BroadT	BRD-K22244754	BRD-K22244754-001-05-0	Specs	AN-652/11332616			Cc1ccc(cc1C)C(=O)Nc1cccc2cccnc12	InChI=1S/C18H16N2O/c1-12-8-9-15(11-13(12)2)18(21)20-16-7-3-5-14-6-4-10-19-17(14)16/h3-11H,1-2H3,(H,20,21)	ISAYRDBWTLRBCC-UHFFFAOYSA-N	276.126263152							120054
SMR000002767	LSM-31498	BRD-K72484719, SID843159	645437	InChI=1S/C24H23N5O3S2/c25-22(31)21-17-9-4-10-18(17)34-23(21)26-20(30)14-33-24-28-27-19(12-15-6-2-1-3-7-15)29(24)13-16-8-5-11-32-16/h1-3,5-8,11H,4,9-10,12-14H2,(H2,25,31)(H,26,30)	LAVBGWSTOQSBDM-UHFFFAOYSA-N	NC(=O)c1c2CCCc2sc1NC(=O)CSc3nnc(Cc4ccccc4)n3Cc5occc5	BroadT	BRD-K72484719	BRD-K72484719-001-05-5	Asinex Ltd.	ASN 03940049			NC(=O)c1c(NC(=O)CSc2nnc(Cc3ccccc3)n2Cc2ccco2)sc2CCCc12	InChI=1S/C24H23N5O3S2/c25-22(31)21-17-9-4-10-18(17)34-23(21)26-20(30)14-33-24-28-27-19(12-15-6-2-1-3-7-15)29(24)13-16-8-5-11-32-16/h1-3,5-8,11H,4,9-10,12-14H2,(H2,25,31)(H,26,30)	LAVBGWSTOQSBDM-UHFFFAOYSA-N	493.124231026							120055
BDBM61849	LSM-31499	BRD-A68526335	40619697	InChI=1S/C15H15N5OS2/c1-9-4-3-5-11(6-9)18-14-19-20-15(23-14)22-8-13(21)12(7-16)10(2)17/h3-6,12,17H,8H2,1-2H3,(H,18,19)	JTHSAOIOQHKUAK-UHFFFAOYSA-N	CC(=N)C(C#N)C(=O)CSc1nnc(Nc2cccc(C)c2)s1	BroadT	BRD-A68526335	BRD-A68526335-001-06-3	Enamine Ltd.	ZT-1907980			CC(=N)C(C#N)C(=O)CSc1nnc(Nc2cccc(C)c2)s1	InChI=1S/C15H15N5OS2/c1-9-4-3-5-11(6-9)18-14-19-20-15(23-14)22-8-13(21)12(7-16)10(2)17/h3-6,12,17H,8H2,1-2H3,(H,18,19)	JTHSAOIOQHKUAK-UHFFFAOYSA-N	345.07180153							120056
MLS000581018	LSM-31500	BRD-K80482221, SID17504800, SID24274881	1206972	InChI=1S/C21H17NO4S/c1-12-4-6-13(7-5-12)19-22-20-18(21(23)26-19)15(11-27-20)14-8-9-16(24-2)17(10-14)25-3/h4-11H,1-3H3	GVDZSWDAOUSYSV-UHFFFAOYSA-N	COc1ccc(cc1OC)c2csc3N=C(OC(=O)c23)c4ccc(C)cc4	BroadT	BRD-K80482221	BRD-K80482221-001-05-0	InterBioScreen Ltd.	STOCK4S-92932			COc1ccc(cc1OC)-c1csc2nc(oc(=O)c12)-c1ccc(C)cc1	InChI=1S/C21H17NO4S/c1-12-4-6-13(7-5-12)19-22-20-18(21(23)26-19)15(11-27-20)14-8-9-16(24-2)17(10-14)25-3/h4-11H,1-3H3	GVDZSWDAOUSYSV-UHFFFAOYSA-N	379.087828724							120057
MLS000121074	LSM-44363	SID17388211, BRD-K53821452	1933074	InChI=1S/C18H19N3O4S2/c1-24-14-7-5-12(10-15(14)25-2)6-8-16(22)19-18(26)21-20-17(23)11-13-4-3-9-27-13/h3-10H,11H2,1-2H3,(H,20,23)(H2,19,21,22,26)/b8-6+	VQECAMFJPYUKFW-SOFGYWHQSA-N	COc1ccc(\C=C\C(=O)NC(=S)NNC(=O)Cc2cccs2)cc1OC	BroadT	BRD-K53821452	BRD-K53821452-001-06-0	Asinex Ltd.	BAS 01555789			COc1ccc(\C=C\C(=O)NC(=S)NNC(=O)Cc2cccs2)cc1OC	InChI=1S/C18H19N3O4S2/c1-24-14-7-5-12(10-15(14)25-2)6-8-16(22)19-18(26)21-20-17(23)11-13-4-3-9-27-13/h3-10H,11H2,1-2H3,(H,20,23)(H2,19,21,22,26)/b8-6+	VQECAMFJPYUKFW-SOFGYWHQSA-N	405.081697498							
2-(5-Benzyl-4-methyl-6-oxo-1,6-dihydro-pyrimidin-2-ylsulfanyl)-hexanoic acid	LSM-31502	BRD-A65806553, SID49643497	2929069	InChI=1S/C18H22N2O3S/c1-3-4-10-15(17(22)23)24-18-19-12(2)14(16(21)20-18)11-13-8-6-5-7-9-13/h5-9,15H,3-4,10-11H2,1-2H3,(H,22,23)(H,19,20,21)	CQKPUBAOCCCNJW-UHFFFAOYSA-N	CCCCC(Sc1nc(C)c(Cc2ccccc2)c(O)n1)C(=O)O	BroadT	BRD-A65806553	BRD-A65806553-001-05-9	Asinex Ltd.	BAS 04934435			CCCCC(Sc1nc(C)c(Cc2ccccc2)c(O)n1)C(O)=O	InChI=1S/C18H22N2O3S/c1-3-4-10-15(17(22)23)24-18-19-12(2)14(16(21)20-18)11-13-8-6-5-7-9-13/h5-9,15H,3-4,10-11H2,1-2H3,(H,22,23)(H,19,20,21)	CQKPUBAOCCCNJW-UHFFFAOYSA-N	346.135113274							120059
MLS000701200	LSM-31503	BRD-K16885048, SID22412162	852542	InChI=1S/C17H19N5O/c1-4-19-17-15(10-18)21-16(12(2)20-17)11-22(13(3)23)14-8-6-5-7-9-14/h5-9H,4,11H2,1-3H3,(H,19,20)	PYXLLRIFIPALBS-UHFFFAOYSA-N	CCNc1nc(C)c(CN(C(=O)C)c2ccccc2)nc1C#N	BroadT	BRD-K16885048	BRD-K16885048-001-07-0	Specs	AQ-917/42754466			CCNc1nc(C)c(CN(C(C)=O)c2ccccc2)nc1C#N	InChI=1S/C17H19N5O/c1-4-19-17-15(10-18)21-16(12(2)20-17)11-22(13(3)23)14-8-6-5-7-9-14/h5-9H,4,11H2,1-3H3,(H,19,20)	PYXLLRIFIPALBS-UHFFFAOYSA-N	309.158960278							120060
AC1M3DAX	LSM-31504	BRD-K80940089, SID4263595	2187750	InChI=1S/C16H23NO2S/c18-10-11-20-12-16(19)17-15-8-6-14(7-9-15)13-4-2-1-3-5-13/h6-9,13,18H,1-5,10-12H2,(H,17,19)	MLMYFSLCGJWPBN-UHFFFAOYSA-N	OCCSCC(=O)Nc1ccc(cc1)C2CCCCC2	BroadT	BRD-K80940089	BRD-K80940089-001-05-8	ChemBridge Corporation	7398397			OCCSCC(=O)Nc1ccc(cc1)C1CCCCC1	InChI=1S/C16H23NO2S/c18-10-11-20-12-16(19)17-15-8-6-14(7-9-15)13-4-2-1-3-5-13/h6-9,13,18H,1-5,10-12H2,(H,17,19)	MLMYFSLCGJWPBN-UHFFFAOYSA-N	293.144949676							120061
AC1OA066	LSM-31505	BRD-K41876347	6742720	InChI=1S/C11H14BrNO4/c12-9-1-2-10(17)8(3-9)4-13-11(5-14,6-15)7-16/h1-4,14-17H,5-7H2	VYXIAZMAMSTAGX-UHFFFAOYSA-N	OCC(CO)(CO)N=Cc1cc(Br)ccc1O	BroadT	BRD-K41876347	BRD-K41876347-001-05-0	ChemBridge Corporation	5404196			OCC(CO)(CO)N=Cc1cc(Br)ccc1O	InChI=1S/C11H14BrNO4/c12-9-1-2-10(17)8(3-9)4-13-11(5-14,6-15)7-16/h1-4,14-17H,5-7H2	VYXIAZMAMSTAGX-UHFFFAOYSA-N	303.010620538							
MLS001034834	LSM-31506	BRD-K65823297, SID49732619	1305287	InChI=1S/C25H19ClN4O3S/c26-18-9-11-19(12-10-18)34(32,33)21-16-20-24(28-22-8-4-5-14-29(22)25(20)31)30(23(21)27)15-13-17-6-2-1-3-7-17/h1-12,14,16,27H,13,15H2	QLHJQNXXGKSYLT-UHFFFAOYSA-N	Clc1ccc(cc1)S(=O)(=O)C2=CC3=C(N=C4C=CC=CN4C3=O)N(CCc5ccccc5)C2=N	BroadT	BRD-K65823297	BRD-K65823297-001-07-9	ChemBridge Corporation	7398701			Clc1ccc(cc1)S(=O)(=O)c1cc2c(nc3ccccn3c2=O)n(CCc2ccccc2)c1=N	InChI=1S/C25H19ClN4O3S/c26-18-9-11-19(12-10-18)34(32,33)21-16-20-24(28-22-8-4-5-14-29(22)25(20)31)30(23(21)27)15-13-17-6-2-1-3-7-17/h1-12,14,16,27H,13,15H2	QLHJQNXXGKSYLT-UHFFFAOYSA-N	490.086638908							120063
ASN 02833901	LSM-31507	BRD-K24125966, SID26668119, SID853289	655941	InChI=1S/C24H26N6O2S2/c1-15-7-8-19(10-16(15)2)27-22(31)14-34-24-29-28-21(30(24)12-20-6-5-9-32-20)13-33-23-25-17(3)11-18(4)26-23/h5-11H,12-14H2,1-4H3,(H,27,31)	HDTKRFUNEJLITR-UHFFFAOYSA-N	Cc1cc(C)nc(SCc2nnc(SCC(=O)Nc3ccc(C)c(C)c3)n2Cc4occc4)n1	BroadT	BRD-K24125966	BRD-K24125966-001-05-3	Asinex Ltd.	ASN 02833901			Cc1cc(C)nc(SCc2nnc(SCC(=O)Nc3ccc(C)c(C)c3)n2Cc2ccco2)n1	InChI=1S/C24H26N6O2S2/c1-15-7-8-19(10-16(15)2)27-22(31)14-34-24-29-28-21(30(24)12-20-6-5-9-32-20)13-33-23-25-17(3)11-18(4)26-23/h5-11H,12-14H2,1-4H3,(H,27,31)	HDTKRFUNEJLITR-UHFFFAOYSA-N	494.155865512							120064
ST082387	LSM-44364	SID24272413, SID49665245, BRD-K26786741	5291322	InChI=1S/C21H13N3O3/c22-12-13(20-23-17-7-3-4-8-18(17)24-20)11-14-9-10-19(27-14)15-5-1-2-6-16(15)21(25)26/h1-11H,(H,23,24)(H,25,26)/b13-11+	OXMPHBICAHAOIC-ACCUITESSA-N	OC(=O)c1ccccc1c2oc(\C=C(/C#N)\c3nc4ccccc4[nH]3)cc2	BroadT	BRD-K26786741	BRD-K26786741-001-05-2	Asinex Ltd.	BAS 01857013			OC(=O)c1ccccc1-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1	InChI=1S/C21H13N3O3/c22-12-13(20-23-17-7-3-4-8-18(17)24-20)11-14-9-10-19(27-14)15-5-1-2-6-16(15)21(25)26/h1-11H,(H,23,24)(H,25,26)/b13-11+	OXMPHBICAHAOIC-ACCUITESSA-N	355.095691306							
MLS001239370	LSM-15444	BRD-K18043221	24892066	InChI=1S/C25H31BrN4O3S2/c1-28(2)14-7-17-30(25-27-22-13-10-20(26)18-23(22)34-25)24(31)19-8-11-21(12-9-19)35(32,33)29-15-5-3-4-6-16-29/h8-13,18H,3-7,14-17H2,1-2H3	FKTZJXIWJXXAPE-UHFFFAOYSA-N	CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N2CCCCCC2)c3nc4ccc(Br)cc4s3	BroadT	BRD-K18043221	BRD-K18043221-003-05-3	Life Chemicals Inc.	F2019-0678		Cl	CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N1CCCCCC1)c1nc2ccc(Br)cc2s1.Cl	InChI=1S/C25H31BrN4O3S2.ClH/c1-28(2)14-7-17-30(25-27-22-13-10-20(26)18-23(22)34-25)24(31)19-8-11-21(12-9-19)35(32,33)29-15-5-3-4-6-16-29;/h8-13,18H,3-7,14-17H2,1-2H3;1H	HUBFNNSAPNLQLR-UHFFFAOYSA-N	578.102094872							104086, 104086
BRD-K59099734	LSM-11999		54646165	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19+,21+,23-/m1/s1	SOARVSRWKWCBLL-QXPQREGVSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@H](CO)O2	BroadT	BRD-K59099734	BRD-K59099734-001-01-8	Broad Institute of MIT and Harvard	BRD-K59099734			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCC4)cc23)[C@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19+,21+,23-/m1/s1	SOARVSRWKWCBLL-QXPQREGVSA-N	443.242021186							100625
BRD-K41885374	LSM-10972		54646256	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21+,25+,27-/m1/s1	FEEKZGTVSGSFLP-ZPNKKQCCSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K41885374	BRD-K41885374-001-01-6	Broad Institute of MIT and Harvard	BRD-K41885374			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21+,25+,27-/m1/s1	FEEKZGTVSGSFLP-ZPNKKQCCSA-N	517.184900234							99593
BRD-K26095155	LSM-10010		54646345	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22-,24-,26+/m0/s1	OQZDFPDHTDCUCP-IFPZXYOKSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)N5CCN(C)CC5)C[C@H]4c3c2)cc1	BroadT	BRD-K26095155	BRD-K26095155-001-01-6	Broad Institute of MIT and Harvard	BRD-K26095155			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)N5CCN(C)CC5)O[C@H]4CO)c3c2)cc1	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22-,24-,26+/m0/s1	OQZDFPDHTDCUCP-IFPZXYOKSA-N	510.247834848							98631
BRD-K25577594	LSM-9984		54646418	InChI=1S/C28H28FN3O5/c29-19-3-1-2-18(10-19)15-31-26(34)14-21-13-23-22-12-20(32-27(35)11-17-6-8-30-9-7-17)4-5-24(22)37-28(23)25(16-33)36-21/h1-10,12,21,23,25,28,33H,11,13-16H2,(H,31,34)(H,32,35)/t21-,23+,25-,28-/m1/s1	JTKPUOMASGTZAW-YZDMAOCNSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K25577594	BRD-K25577594-001-01-3	Broad Institute of MIT and Harvard	BRD-K25577594			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H28FN3O5/c29-19-3-1-2-18(10-19)15-31-26(34)14-21-13-23-22-12-20(32-27(35)11-17-6-8-30-9-7-17)4-5-24(22)37-28(23)25(16-33)36-21/h1-10,12,21,23,25,28,33H,11,13-16H2,(H,31,34)(H,32,35)/t21-,23+,25-,28-/m1/s1	JTKPUOMASGTZAW-YZDMAOCNSA-N	505.201299226							98605
BRD-K82768800	LSM-13483		54646332	InChI=1S/C23H35N3O4/c1-25(2)16-6-7-20-18(12-16)19-13-17(29-21(15-27)23(19)30-20)14-22(28)24-8-11-26-9-4-3-5-10-26/h6-7,12,17,19,21,23,27H,3-5,8-11,13-15H2,1-2H3,(H,24,28)/t17-,19+,21+,23-/m1/s1	HWEAQBDEOFZYHR-QXPQREGVSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCCN4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K82768800	BRD-K82768800-001-01-8	Broad Institute of MIT and Harvard	BRD-K82768800			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCCN4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C23H35N3O4/c1-25(2)16-6-7-20-18(12-16)19-13-17(29-21(15-27)23(19)30-20)14-22(28)24-8-11-26-9-4-3-5-10-26/h6-7,12,17,19,21,23,27H,3-5,8-11,13-15H2,1-2H3,(H,24,28)/t17-,19+,21+,23-/m1/s1	HWEAQBDEOFZYHR-QXPQREGVSA-N	417.26275663							102123
BRD-K10491285	LSM-9060		54646321	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)30-12-10-18-5-2-1-3-6-18)22-13-20(8-9-24(22)36-27)31-28(34)19-7-4-11-29-16-19/h1-9,11,13,16,21,23,25,27,32H,10,12,14-15,17H2,(H,30,33)(H,31,34)/t21-,23+,25+,27-/m1/s1	ZFEMWODPVTXMHX-WFHOOFKDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K10491285	BRD-K10491285-001-01-8	Broad Institute of MIT and Harvard	BRD-K10491285			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)30-12-10-18-5-2-1-3-6-18)22-13-20(8-9-24(22)36-27)31-28(34)19-7-4-11-29-16-19/h1-9,11,13,16,21,23,25,27,32H,10,12,14-15,17H2,(H,30,33)(H,31,34)/t21-,23+,25+,27-/m1/s1	ZFEMWODPVTXMHX-WFHOOFKDSA-N	487.210721058							97681
BRD-K91811806	LSM-14072		54646136	InChI=1S/C30H30N2O8/c1-36-23-5-3-2-4-18(23)14-31-28(34)13-20-12-22-21-11-19(7-9-24(21)40-29(22)27(15-33)39-20)32-30(35)17-6-8-25-26(10-17)38-16-37-25/h2-11,20,22,27,29,33H,12-16H2,1H3,(H,31,34)(H,32,35)/t20-,22-,27-,29+/m1/s1	IQCMSFSSZNINGU-VHGAITISSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@@H](CO)O2	BroadT	BRD-K91811806	BRD-K91811806-001-01-9	Broad Institute of MIT and Harvard	BRD-K91811806			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C30H30N2O8/c1-36-23-5-3-2-4-18(23)14-31-28(34)13-20-12-22-21-11-19(7-9-24(21)40-29(22)27(15-33)39-20)32-30(35)17-6-8-25-26(10-17)38-16-37-25/h2-11,20,22,27,29,33H,12-16H2,1H3,(H,31,34)(H,32,35)/t20-,22-,27-,29+/m1/s1	IQCMSFSSZNINGU-VHGAITISSA-N	546.20021594							102726
BRD-K66205522	LSM-12467		54646221	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25+,27-,29-/m1/s1	MRJCPWMBHXTRFB-SYBYNBCQSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@H]3c2c1	BroadT	BRD-K66205522	BRD-K66205522-001-01-8	Broad Institute of MIT and Harvard	BRD-K66205522			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@@H]3CO)c2c1	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25+,27-,29-/m1/s1	MRJCPWMBHXTRFB-SYBYNBCQSA-N	488.231122144							101098
BRD-K56417931	LSM-11842		54646205	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19-,21-/m0/s1	JZVGIVMTJSWJDH-MRCYXTNMSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccn4)C[C@@H]3c2c1	BroadT	BRD-K56417931	BRD-K56417931-001-01-6	Broad Institute of MIT and Harvard	BRD-K56417931			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccn4)O[C@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19-,21-/m0/s1	JZVGIVMTJSWJDH-MRCYXTNMSA-N	447.14640624							100468
BRD-K62342148	LSM-12216		54646392	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12-,14+,16+/m1/s1	STSQWNRYWIJNCW-ILHHOCCXSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K62342148	BRD-K62342148-001-01-7	Broad Institute of MIT and Harvard	BRD-K62342148			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12-,14+,16+/m1/s1	STSQWNRYWIJNCW-ILHHOCCXSA-N	371.103872712							100842
BRD-K77093925	LSM-13143		54646314	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26-,28-/m1/s1	UQAGOAYYXRCKNS-SJPQFPLUSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)NCc5ccccc5F)C[C@H]4c3c2	BroadT	BRD-K77093925	BRD-K77093925-001-01-8	Broad Institute of MIT and Harvard	BRD-K77093925			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26-,28-/m1/s1	UQAGOAYYXRCKNS-SJPQFPLUSA-N	556.167950178							101781
BRD-K42536980	LSM-11006		54646126	InChI=1S/C30H30N2O7/c1-17(18-5-3-2-4-6-18)31-28(34)14-21-13-23-22-12-20(8-10-24(22)39-29(23)27(15-33)38-21)32-30(35)19-7-9-25-26(11-19)37-16-36-25/h2-12,17,21,23,27,29,33H,13-16H2,1H3,(H,31,34)(H,32,35)/t17-,21+,23-,27+,29+/m1/s1	PKVMSJKEIKOOIO-LMTPRVGTSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1)c6ccccc6	BroadT	BRD-K42536980	BRD-K42536980-001-01-0	Broad Institute of MIT and Harvard	BRD-K42536980			C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C30H30N2O7/c1-17(18-5-3-2-4-6-18)31-28(34)14-21-13-23-22-12-20(8-10-24(22)39-29(23)27(15-33)38-21)32-30(35)19-7-9-25-26(11-19)37-16-36-25/h2-12,17,21,23,27,29,33H,13-16H2,1H3,(H,31,34)(H,32,35)/t17-,21+,23-,27+,29+/m1/s1	PKVMSJKEIKOOIO-LMTPRVGTSA-N	530.20530132							99627
BRD-K47890395	LSM-11343		54646214	InChI=1S/C16H21NO5/c1-17(2)9-3-4-13-11(5-9)12-6-10(7-15(19)20)21-14(8-18)16(12)22-13/h3-5,10,12,14,16,18H,6-8H2,1-2H3,(H,19,20)/t10-,12-,14-,16+/m0/s1	MUGALHVVQCOZES-YLUJIRGKSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)O)C[C@H]3c2c1	BroadT	BRD-K47890395	BRD-K47890395-001-01-5	Broad Institute of MIT and Harvard	BRD-K47890395			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(O)=O)O[C@H]3CO)c2c1	InChI=1S/C16H21NO5/c1-17(2)9-3-4-13-11(5-9)12-6-10(7-15(19)20)21-14(8-18)16(12)22-13/h3-5,10,12,14,16,18H,6-8H2,1-2H3,(H,19,20)/t10-,12-,14-,16+/m0/s1	MUGALHVVQCOZES-YLUJIRGKSA-N	307.141972782							99964
BRD-K29258520	LSM-10197		54646424	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18+,20+,23-/m1/s1	MRLAOALNSBFOMY-MRKDIWJRSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)N4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K29258520	BRD-K29258520-001-01-5	Broad Institute of MIT and Harvard	BRD-K29258520			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18+,20+,23-/m1/s1	MRLAOALNSBFOMY-MRKDIWJRSA-N	431.242021186							98818
BRD-K51201721	LSM-11560		54646146	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16+,18-,20-/m1/s1	BEWGTMHICYCEOA-IHMNZUQTSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NC4CCCC4)C[C@H]3c2c1	BroadT	BRD-K51201721	BRD-K51201721-001-01-3	Broad Institute of MIT and Harvard	BRD-K51201721			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NC4CCCC4)O[C@@H]3CO)c2c1	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16+,18-,20-/m1/s1	BEWGTMHICYCEOA-IHMNZUQTSA-N	424.166807326							100183
BRD-K94184760	LSM-14200		54646403	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18+,20-,22-,24+/m0/s1	LSNSUZUVRXFZLV-AUPQHMSCSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K94184760	BRD-K94184760-001-01-2	Broad Institute of MIT and Harvard	BRD-K94184760			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1)c1ccccc1	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18+,20-,22-,24+/m0/s1	LSNSUZUVRXFZLV-AUPQHMSCSA-N	410.22055746							102854
BRD-K19529619	LSM-9606		54646381	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19+,21+,23-/m1/s1	ALHQUDNRSCILRO-QXPQREGVSA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K19529619	BRD-K19529619-001-01-3	Broad Institute of MIT and Harvard	BRD-K19529619			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19+,21+,23-/m1/s1	ALHQUDNRSCILRO-QXPQREGVSA-N	445.25767125							98227
BRD-K74291148	LSM-12977		54646412	InChI=1S/C25H30N2O4/c1-26(2)18-7-8-22-20(11-18)21-12-19(30-23(15-28)25(21)31-22)13-24(29)27-10-9-16-5-3-4-6-17(16)14-27/h3-8,11,19,21,23,25,28H,9-10,12-15H2,1-2H3/t19-,21+,23-,25-/m1/s1	QQFBCVYCCQBHCE-RIPRBREISA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)N4CCc5ccccc5C4)C[C@H]3c2c1	BroadT	BRD-K74291148	BRD-K74291148-001-01-2	Broad Institute of MIT and Harvard	BRD-K74291148			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCc5ccccc5C4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O4/c1-26(2)18-7-8-22-20(11-18)21-12-19(30-23(15-28)25(21)31-22)13-24(29)27-10-9-16-5-3-4-6-17(16)14-27/h3-8,11,19,21,23,25,28H,9-10,12-15H2,1-2H3/t19-,21+,23-,25-/m1/s1	QQFBCVYCCQBHCE-RIPRBREISA-N	422.22055746							101614
SCHEMBL16980377	LSM-6821	BRD-K16410418	54646219	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25-,27-,29+/m0/s1	MRJCPWMBHXTRFB-HGAMEBRSSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@H]3c2c1	BroadT	BRD-K16410418	BRD-K16410418-001-01-2	Broad Institute of MIT and Harvard	BRD-K16410418			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@H]3CO)c2c1	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25-,27-,29+/m0/s1	MRJCPWMBHXTRFB-HGAMEBRSSA-N	488.231122144							95442
BRD-K36596745	LSM-10638		54646156	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23+,25+,28-/m0/s1	FBZDSUDTYUQYGJ-BOYVHMQCSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K36596745	BRD-K36596745-001-01-8	Broad Institute of MIT and Harvard	BRD-K36596745			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23+,25+,28-/m0/s1	FBZDSUDTYUQYGJ-BOYVHMQCSA-N	508.268570292							99259
BRD-K06733952	LSM-8827		54646395	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24+,26-/m0/s1	XBPCNRNKOXKUQA-RXDHMRHRSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K06733952	BRD-K06733952-001-01-1	Broad Institute of MIT and Harvard	BRD-K06733952			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24+,26-/m0/s1	XBPCNRNKOXKUQA-RXDHMRHRSA-N	464.231122144							97448
BRD-K94446761	LSM-14218		54646335	InChI=1S/C23H35N3O4/c1-25(2)16-6-7-20-18(12-16)19-13-17(29-21(15-27)23(19)30-20)14-22(28)24-8-11-26-9-4-3-5-10-26/h6-7,12,17,19,21,23,27H,3-5,8-11,13-15H2,1-2H3,(H,24,28)/t17-,19-,21+,23+/m1/s1	HWEAQBDEOFZYHR-YZBYQZESSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCCN4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K94446761	BRD-K94446761-001-01-4	Broad Institute of MIT and Harvard	BRD-K94446761			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCCN4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C23H35N3O4/c1-25(2)16-6-7-20-18(12-16)19-13-17(29-21(15-27)23(19)30-20)14-22(28)24-8-11-26-9-4-3-5-10-26/h6-7,12,17,19,21,23,27H,3-5,8-11,13-15H2,1-2H3,(H,24,28)/t17-,19-,21+,23+/m1/s1	HWEAQBDEOFZYHR-YZBYQZESSA-N	417.26275663							102872
BRD-K23960714	LSM-9876		54646207	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19+,21+/m1/s1	JZVGIVMTJSWJDH-DOSUHQCWSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccccn4)C[C@@H]3c2c1	BroadT	BRD-K23960714	BRD-K23960714-001-01-8	Broad Institute of MIT and Harvard	BRD-K23960714			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccn4)O[C@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19+,21+/m1/s1	JZVGIVMTJSWJDH-DOSUHQCWSA-N	447.14640624							98497
BRD-K12441425	LSM-9171		54646253	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21-,25-,27+/m1/s1	FEEKZGTVSGSFLP-HXMVMFLPSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K12441425	BRD-K12441425-001-01-2	Broad Institute of MIT and Harvard	BRD-K12441425			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21-,25-,27+/m1/s1	FEEKZGTVSGSFLP-HXMVMFLPSA-N	517.184900234							97792
CHEMBL2135063	LSM-31509	SID131442694, BRD-K06457724	54646320	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)30-12-10-18-5-2-1-3-6-18)22-13-20(8-9-24(22)36-27)31-28(34)19-7-4-11-29-16-19/h1-9,11,13,16,21,23,25,27,32H,10,12,14-15,17H2,(H,30,33)(H,31,34)/t21-,23+,25+,27-/m0/s1	ZFEMWODPVTXMHX-BBVYRSAVSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K06457724	BRD-K06457724-001-01-4	Broad Institute of MIT and Harvard	BRD-K06457724			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)30-12-10-18-5-2-1-3-6-18)22-13-20(8-9-24(22)36-27)31-28(34)19-7-4-11-29-16-19/h1-9,11,13,16,21,23,25,27,32H,10,12,14-15,17H2,(H,30,33)(H,31,34)/t21-,23+,25+,27-/m0/s1	ZFEMWODPVTXMHX-BBVYRSAVSA-N	487.210721058							120066
BRD-K97972197	LSM-14449		54646312	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26+,28-/m0/s1	UQAGOAYYXRCKNS-NZIYMESCSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)NCc5ccccc5F)C[C@@H]4c3c2	BroadT	BRD-K97972197	BRD-K97972197-001-01-0	Broad Institute of MIT and Harvard	BRD-K97972197			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26+,28-/m0/s1	UQAGOAYYXRCKNS-NZIYMESCSA-N	556.167950178							103104
BRD-K01594854	LSM-8536		54646194	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17-,19-,21+/m0/s1	BVQWYDMOVFWUGX-WRGRXTPVSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@H](CO)O1	BroadT	BRD-K01594854	BRD-K01594854-001-01-1	Broad Institute of MIT and Harvard	BRD-K01594854			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17-,19-,21+/m0/s1	BVQWYDMOVFWUGX-WRGRXTPVSA-N	412.163436508							97157
BRD-K39148257	LSM-10804		54646273	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25+,27-,29-/m0/s1	FOSRSIPYUZSGIW-KLPDMWAPSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NCCc5ccccc5)C[C@@H]4c3c2)cc1	BroadT	BRD-K39148257	BRD-K39148257-001-01-5	Broad Institute of MIT and Harvard	BRD-K39148257			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)NCCc5ccccc5)O[C@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25+,27-,29-/m0/s1	FOSRSIPYUZSGIW-KLPDMWAPSA-N	531.236935806							99425
BRD-K11631766	LSM-9137		54646347	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22+,24+,26-/m1/s1	OQZDFPDHTDCUCP-GRTAZNFBSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)N5CCN(C)CC5)C[C@H]4c3c2)cc1	BroadT	BRD-K11631766	BRD-K11631766-001-01-6	Broad Institute of MIT and Harvard	BRD-K11631766			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)N5CCN(C)CC5)O[C@H]4CO)c3c2)cc1	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22+,24+,26-/m1/s1	OQZDFPDHTDCUCP-GRTAZNFBSA-N	510.247834848							97758
BRD-K32799329	LSM-10418		54646286	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20+,24-,26-/m1/s1	GAKFIKLLFOVZGV-DJKZJWHWSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K32799329	BRD-K32799329-001-01-6	Broad Institute of MIT and Harvard	BRD-K32799329			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20+,24-,26-/m1/s1	GAKFIKLLFOVZGV-DJKZJWHWSA-N	497.232599354							99039
BRD-K22500599	LSM-9792		54646324	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24-,26-,28+/m0/s1	AJGJMULVCJFZBU-AJWNWGNMSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K22500599	BRD-K22500599-001-01-3	Broad Institute of MIT and Harvard	BRD-K22500599			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24-,26-,28+/m0/s1	AJGJMULVCJFZBU-AJWNWGNMSA-N	506.241686828							98413
BRD-K48927563	LSM-11407		54646127	InChI=1S/C30H30N2O7/c1-17(18-5-3-2-4-6-18)31-28(34)14-21-13-23-22-12-20(8-10-24(22)39-29(23)27(15-33)38-21)32-30(35)19-7-9-25-26(11-19)37-16-36-25/h2-12,17,21,23,27,29,33H,13-16H2,1H3,(H,31,34)(H,32,35)/t17-,21+,23+,27-,29-/m1/s1	PKVMSJKEIKOOIO-VFVMRXBTSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1)c6ccccc6	BroadT	BRD-K48927563	BRD-K48927563-001-01-0	Broad Institute of MIT and Harvard	BRD-K48927563			C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C30H30N2O7/c1-17(18-5-3-2-4-6-18)31-28(34)14-21-13-23-22-12-20(8-10-24(22)39-29(23)27(15-33)38-21)32-30(35)19-7-9-25-26(11-19)37-16-36-25/h2-12,17,21,23,27,29,33H,13-16H2,1H3,(H,31,34)(H,32,35)/t17-,21+,23+,27-,29-/m1/s1	PKVMSJKEIKOOIO-VFVMRXBTSA-N	530.20530132							100028
BRD-K96707093	LSM-14367		54646144	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16+,18+,20-/m0/s1	BEWGTMHICYCEOA-UQWBFEFOSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NC4CCCC4)C[C@@H]3c2c1	BroadT	BRD-K96707093	BRD-K96707093-001-01-6	Broad Institute of MIT and Harvard	BRD-K96707093			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NC4CCCC4)O[C@@H]3CO)c2c1	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16+,18+,20-/m0/s1	BEWGTMHICYCEOA-UQWBFEFOSA-N	424.166807326							103021
BRD-K54161818	LSM-11722		54646427	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18-,20+,23+/m0/s1	MRLAOALNSBFOMY-VSCJKUSUSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)N4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K54161818	BRD-K54161818-001-01-0	Broad Institute of MIT and Harvard	BRD-K54161818			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18-,20+,23+/m0/s1	MRLAOALNSBFOMY-VSCJKUSUSA-N	431.242021186							100347
BRD-K13185593	LSM-9220		54646240	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23-,25-,27+/m0/s1	FWDZHOQSJMEDFJ-NTYBTQPHSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NCc5ccccn5)C[C@H]4c3c2)cc1	BroadT	BRD-K13185593	BRD-K13185593-001-01-0	Broad Institute of MIT and Harvard	BRD-K13185593			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NCc5ccccn5)O[C@H]4CO)c3c2)cc1	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23-,25-,27+/m0/s1	FWDZHOQSJMEDFJ-NTYBTQPHSA-N	518.21653472							97841
BRD-K36209664	LSM-10616		54646211	InChI=1S/C24H23F3N2O7/c25-24(26,27)10-28-21(31)8-14-7-16-15-6-13(2-4-17(15)36-22(16)20(9-30)35-14)29-23(32)12-1-3-18-19(5-12)34-11-33-18/h1-6,14,16,20,22,30H,7-11H2,(H,28,31)(H,29,32)/t14-,16+,20-,22-/m0/s1	IXBLMXNUAYKSQM-NEDPJEHSSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K36209664	BRD-K36209664-001-01-5	Broad Institute of MIT and Harvard	BRD-K36209664			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C24H23F3N2O7/c25-24(26,27)10-28-21(31)8-14-7-16-15-6-13(2-4-17(15)36-22(16)20(9-30)35-14)29-23(32)12-1-3-18-19(5-12)34-11-33-18/h1-6,14,16,20,22,30H,7-11H2,(H,28,31)(H,29,32)/t14-,16+,20-,22-/m0/s1	IXBLMXNUAYKSQM-NEDPJEHSSA-N	508.145735696							99237
BRD-K98042112	LSM-14455		54646430	InChI=1S/C28H35N3O6/c1-35-20-10-7-18(8-11-20)30-28(34)31-19-9-12-24-22(13-19)23-14-21(36-25(16-32)27(23)37-24)15-26(33)29-17-5-3-2-4-6-17/h7-13,17,21,23,25,27,32H,2-6,14-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25-,27+/m0/s1	ATPIYVGDEBDNGC-NTYBTQPHSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NC5CCCCC5)C[C@H]4c3c2)cc1	BroadT	BRD-K98042112	BRD-K98042112-001-01-3	Broad Institute of MIT and Harvard	BRD-K98042112			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NC5CCCCC5)O[C@H]4CO)c3c2)cc1	InChI=1S/C28H35N3O6/c1-35-20-10-7-18(8-11-20)30-28(34)31-19-9-12-24-22(13-19)23-14-21(36-25(16-32)27(23)37-24)15-26(33)29-17-5-3-2-4-6-17/h7-13,17,21,23,25,27,32H,2-6,14-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25-,27+/m0/s1	ATPIYVGDEBDNGC-NTYBTQPHSA-N	509.25258587							103110
BRD-K42083897	LSM-10983		54646257	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21+,25-,27-/m1/s1	FEEKZGTVSGSFLP-DBXGMPFESA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K42083897	BRD-K42083897-001-01-5	Broad Institute of MIT and Harvard	BRD-K42083897			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21+,25-,27-/m1/s1	FEEKZGTVSGSFLP-DBXGMPFESA-N	517.184900234							99604
BRD-K80576525	LSM-13356		54646196	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17+,19+,21-/m1/s1	BVQWYDMOVFWUGX-ZWVMGRIOSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@H](CO)O1	BroadT	BRD-K80576525	BRD-K80576525-001-01-1	Broad Institute of MIT and Harvard	BRD-K80576525			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17+,19+,21-/m1/s1	BVQWYDMOVFWUGX-ZWVMGRIOSA-N	412.163436508							101995
BRD-K72739597-001-01-8	LSM-12881	BRD-K72739597	54646311	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26-,28+/m0/s1	UQAGOAYYXRCKNS-YFRXONQNSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NCc5ccccc5F)C[C@H]4c3c2	BroadT	BRD-K72739597	BRD-K72739597-001-01-8	Broad Institute of MIT and Harvard	BRD-K72739597			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26-,28+/m0/s1	UQAGOAYYXRCKNS-YFRXONQNSA-N	556.167950178							101518
BRD-K84994827	LSM-13620		54646225	InChI=1S/C26H32N4O5/c31-15-23-25-21(12-19(34-23)13-24(32)28-14-16-7-9-27-10-8-16)20-11-18(5-6-22(20)35-25)30-26(33)29-17-3-1-2-4-17/h5-11,17,19,21,23,25,31H,1-4,12-15H2,(H,28,32)(H2,29,30,33)/t19-,21-,23-,25+/m1/s1	CSQKNNUUWCECGY-YTAKYCMFSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K84994827	BRD-K84994827-001-01-7	Broad Institute of MIT and Harvard	BRD-K84994827			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C26H32N4O5/c31-15-23-25-21(12-19(34-23)13-24(32)28-14-16-7-9-27-10-8-16)20-11-18(5-6-22(20)35-25)30-26(33)29-17-3-1-2-4-17/h5-11,17,19,21,23,25,31H,1-4,12-15H2,(H,28,32)(H2,29,30,33)/t19-,21-,23-,25+/m1/s1	CSQKNNUUWCECGY-YTAKYCMFSA-N	480.237270164							102267
BRD-K01335708	LSM-8518		54646396	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24+,26-/m1/s1	XBPCNRNKOXKUQA-GRTAZNFBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K01335708	BRD-K01335708-001-01-7	Broad Institute of MIT and Harvard	BRD-K01335708			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24+,26-/m1/s1	XBPCNRNKOXKUQA-GRTAZNFBSA-N	464.231122144							97139
BRD-K02813113	LSM-8610		54646316	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26+,28+/m0/s1	UQAGOAYYXRCKNS-QUPYCJFYSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)NCc5ccccc5F)C[C@H]4c3c2	BroadT	BRD-K02813113	BRD-K02813113-001-01-1	Broad Institute of MIT and Harvard	BRD-K02813113			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26+,28+/m0/s1	UQAGOAYYXRCKNS-QUPYCJFYSA-N	556.167950178							97231
BRD-K58227367	LSM-11944		54646175	InChI=1S/C22H27F3N2O6/c23-22(24,25)11-26-19(29)9-14-8-16-15-7-13(27-21(30)12-3-5-31-6-4-12)1-2-17(15)33-20(16)18(10-28)32-14/h1-2,7,12,14,16,18,20,28H,3-6,8-11H2,(H,26,29)(H,27,30)/t14-,16-,18-,20+/m0/s1	QSBPACLFOOFXHF-PFSLXQJOSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)C4CCOCC4)cc23	BroadT	BRD-K58227367	BRD-K58227367-001-01-0	Broad Institute of MIT and Harvard	BRD-K58227367			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C22H27F3N2O6/c23-22(24,25)11-26-19(29)9-14-8-16-15-7-13(27-21(30)12-3-5-31-6-4-12)1-2-17(15)33-20(16)18(10-28)32-14/h1-2,7,12,14,16,18,20,28H,3-6,8-11H2,(H,26,29)(H,27,30)/t14-,16-,18-,20+/m0/s1	QSBPACLFOOFXHF-PFSLXQJOSA-N	472.182121204							100570
BRD-K07986943	LSM-8909		54646357	InChI=1S/C28H27F3N4O5/c29-28(30,31)17-3-5-18(6-4-17)34-27(38)35-19-7-8-23-21(10-19)22-11-20(39-24(15-36)26(22)40-23)12-25(37)33-14-16-2-1-9-32-13-16/h1-10,13,20,22,24,26,36H,11-12,14-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24+,26+/m0/s1	IMICHJYMUCZKDW-LFSKCEFNSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K07986943	BRD-K07986943-001-01-6	Broad Institute of MIT and Harvard	BRD-K07986943			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)17-3-5-18(6-4-17)34-27(38)35-19-7-8-23-21(10-19)22-11-20(39-24(15-36)26(22)40-23)12-25(37)33-14-16-2-1-9-32-13-16/h1-10,13,20,22,24,26,36H,11-12,14-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24+,26+/m0/s1	IMICHJYMUCZKDW-LFSKCEFNSA-N	556.193354604							97530
BRD-K26799408	LSM-10053		54646169	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19-,21+,23+/m1/s1	SOARVSRWKWCBLL-YZBYQZESSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@H](CO)O2	BroadT	BRD-K26799408	BRD-K26799408-001-01-8	Broad Institute of MIT and Harvard	BRD-K26799408			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCC4)cc23)[C@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19-,21+,23+/m1/s1	SOARVSRWKWCBLL-YZBYQZESSA-N	443.242021186							98674
BRD-K52373488	LSM-11631		54646260	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21-,25+,27+/m1/s1	FEEKZGTVSGSFLP-FALQBERWSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K52373488	BRD-K52373488-001-01-2	Broad Institute of MIT and Harvard	BRD-K52373488			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21-,25+,27+/m1/s1	FEEKZGTVSGSFLP-FALQBERWSA-N	517.184900234							100256
BRD-K33666425	LSM-10469		54646341	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21+,24-,26-/m0/s1	UVPONYOZSFJNDG-YPLHNQGHSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K33666425	BRD-K33666425-001-01-9	Broad Institute of MIT and Harvard	BRD-K33666425			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21+,24-,26-/m0/s1	UVPONYOZSFJNDG-YPLHNQGHSA-N	516.2071931							99090
BRD-K14649905	LSM-9315		54646155	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23-,25-,28+/m0/s1	FBZDSUDTYUQYGJ-CRZMAGMNSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K14649905	BRD-K14649905-001-01-7	Broad Institute of MIT and Harvard	BRD-K14649905			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23-,25-,28+/m0/s1	FBZDSUDTYUQYGJ-CRZMAGMNSA-N	508.268570292							97936
BRD-K68103836	LSM-12578		54646370	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28-,31+/m1/s1	BRDKARYWUSDFKE-GMOQGOKBSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@@H]3c2c1	BroadT	BRD-K68103836	BRD-K68103836-001-01-4	Broad Institute of MIT and Harvard	BRD-K68103836			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(cc4)-c4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28-,31+/m1/s1	BRDKARYWUSDFKE-GMOQGOKBSA-N	529.25767125							101209
BRD-K58719548	LSM-11975		54646325	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24+,26+,28-/m0/s1	AJGJMULVCJFZBU-XABOBXATSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K58719548	BRD-K58719548-001-01-8	Broad Institute of MIT and Harvard	BRD-K58719548			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24+,26+,28-/m0/s1	AJGJMULVCJFZBU-XABOBXATSA-N	506.241686828							100601
BRD-K78792702	LSM-13239		54646408	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18-,20-,22+,24+/m1/s1	LSNSUZUVRXFZLV-RZLXXJEVSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K78792702	BRD-K78792702-001-01-3	Broad Institute of MIT and Harvard	BRD-K78792702			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1)c1ccccc1	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18-,20-,22+,24+/m1/s1	LSNSUZUVRXFZLV-RZLXXJEVSA-N	410.22055746							101878
BRD-K84832762	LSM-13612		54646147	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16+,18-,20-/m0/s1	BEWGTMHICYCEOA-HUOQQOJOSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NC4CCCC4)C[C@@H]3c2c1	BroadT	BRD-K84832762	BRD-K84832762-001-01-6	Broad Institute of MIT and Harvard	BRD-K84832762			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NC4CCCC4)O[C@H]3CO)c2c1	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16+,18-,20-/m0/s1	BEWGTMHICYCEOA-HUOQQOJOSA-N	424.166807326							102258
BRD-K39007840	LSM-10792		54646379	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19-,21-,23+/m0/s1	ALHQUDNRSCILRO-RAKJYXHLSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K39007840	BRD-K39007840-001-01-7	Broad Institute of MIT and Harvard	BRD-K39007840			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19-,21-,23+/m0/s1	ALHQUDNRSCILRO-RAKJYXHLSA-N	445.25767125							99413
BRD-K24427824	LSM-9908		54646305	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25-,27+,30+/m1/s1	ZUSAVEKAEPAMKG-YWOMOVTDSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Cc6ccncc6)cc45	BroadT	BRD-K24427824	BRD-K24427824-001-01-4	Broad Institute of MIT and Harvard	BRD-K24427824			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25-,27+,30+/m1/s1	ZUSAVEKAEPAMKG-YWOMOVTDSA-N	513.226371122							98529
BRD-K08593711	LSM-8948		54646209	InChI=1S/C24H23F3N2O7/c25-24(26,27)10-28-21(31)8-14-7-16-15-6-13(2-4-17(15)36-22(16)20(9-30)35-14)29-23(32)12-1-3-18-19(5-12)34-11-33-18/h1-6,14,16,20,22,30H,7-11H2,(H,28,31)(H,29,32)/t14-,16-,20-,22+/m0/s1	IXBLMXNUAYKSQM-OZOIZYBVSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K08593711	BRD-K08593711-001-01-9	Broad Institute of MIT and Harvard	BRD-K08593711			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C24H23F3N2O7/c25-24(26,27)10-28-21(31)8-14-7-16-15-6-13(2-4-17(15)36-22(16)20(9-30)35-14)29-23(32)12-1-3-18-19(5-12)34-11-33-18/h1-6,14,16,20,22,30H,7-11H2,(H,28,31)(H,29,32)/t14-,16-,20-,22+/m0/s1	IXBLMXNUAYKSQM-OZOIZYBVSA-N	508.145735696							97569
BRD-K52403446	LSM-11633		54646318	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)30-12-10-18-5-2-1-3-6-18)22-13-20(8-9-24(22)36-27)31-28(34)19-7-4-11-29-16-19/h1-9,11,13,16,21,23,25,27,32H,10,12,14-15,17H2,(H,30,33)(H,31,34)/t21-,23-,25-,27+/m1/s1	ZFEMWODPVTXMHX-UFUIAINPSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K52403446	BRD-K52403446-001-01-8	Broad Institute of MIT and Harvard	BRD-K52403446			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)30-12-10-18-5-2-1-3-6-18)22-13-20(8-9-24(22)36-27)31-28(34)19-7-4-11-29-16-19/h1-9,11,13,16,21,23,25,27,32H,10,12,14-15,17H2,(H,30,33)(H,31,34)/t21-,23-,25-,27+/m1/s1	ZFEMWODPVTXMHX-UFUIAINPSA-N	487.210721058							100258
BRD-K36671795	LSM-10646		54646301	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25+,27+,30-/m1/s1	ZUSAVEKAEPAMKG-LWQGNWNJSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Cc6ccncc6)cc45	BroadT	BRD-K36671795	BRD-K36671795-001-01-8	Broad Institute of MIT and Harvard	BRD-K36671795			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25+,27+,30-/m1/s1	ZUSAVEKAEPAMKG-LWQGNWNJSA-N	513.226371122							99267
BRD-K16030225	LSM-9391		54646185	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22-,25+,27+/m1/s1	FSAONXZLMNAVLZ-RYFPDZNGSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCOCC5)cc34)[C@H](CO)O2	BroadT	BRD-K16030225	BRD-K16030225-001-01-1	Broad Institute of MIT and Harvard	BRD-K16030225			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22-,25+,27+/m1/s1	FSAONXZLMNAVLZ-RYFPDZNGSA-N	510.236601448							98012
BRD-K10225826	LSM-9050		54646180	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22+,25+,27-/m0/s1	FSAONXZLMNAVLZ-JBGAWVPVSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCOCC5)cc34)[C@@H](CO)O2	BroadT	BRD-K10225826	BRD-K10225826-001-01-6	Broad Institute of MIT and Harvard	BRD-K10225826			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22+,25+,27-/m0/s1	FSAONXZLMNAVLZ-JBGAWVPVSA-N	510.236601448							97671
BRD-K46473681	LSM-11266		54646359	InChI=1S/C22H27N3O4/c1-25(2)15-6-7-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-3-4-8-23-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,20-,22+/m0/s1	PSRJUTPUZRNONK-JXYHXMIBSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccn4)C[C@H]3c2c1	BroadT	BRD-K46473681	BRD-K46473681-001-01-4	Broad Institute of MIT and Harvard	BRD-K46473681			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccn4)O[C@H]3CO)c2c1	InChI=1S/C22H27N3O4/c1-25(2)15-6-7-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-3-4-8-23-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,20-,22+/m0/s1	PSRJUTPUZRNONK-JXYHXMIBSA-N	397.200156374							99887
BRD-K02544589	LSM-8594		54646385	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19-,21+,23+/m1/s1	ALHQUDNRSCILRO-YZBYQZESSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K02544589	BRD-K02544589-001-01-7	Broad Institute of MIT and Harvard	BRD-K02544589			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19-,21+,23+/m1/s1	ALHQUDNRSCILRO-YZBYQZESSA-N	445.25767125							97215
BRD-K60804903	LSM-12106		54646416	InChI=1S/C28H28FN3O5/c29-19-3-1-2-18(10-19)15-31-26(34)14-21-13-23-22-12-20(32-27(35)11-17-6-8-30-9-7-17)4-5-24(22)37-28(23)25(16-33)36-21/h1-10,12,21,23,25,28,33H,11,13-16H2,(H,31,34)(H,32,35)/t21-,23+,25+,28-/m0/s1	JTKPUOMASGTZAW-BOYVHMQCSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K60804903	BRD-K60804903-001-01-3	Broad Institute of MIT and Harvard	BRD-K60804903			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H28FN3O5/c29-19-3-1-2-18(10-19)15-31-26(34)14-21-13-23-22-12-20(32-27(35)11-17-6-8-30-9-7-17)4-5-24(22)37-28(23)25(16-33)36-21/h1-10,12,21,23,25,28,33H,11,13-16H2,(H,31,34)(H,32,35)/t21-,23+,25+,28-/m0/s1	JTKPUOMASGTZAW-BOYVHMQCSA-N	505.201299226							100732
BRD-K90957289	LSM-14028		54646154	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23-,25-,28+/m1/s1	FBZDSUDTYUQYGJ-FNIBFVHZSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K90957289	BRD-K90957289-001-01-7	Broad Institute of MIT and Harvard	BRD-K90957289			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23-,25-,28+/m1/s1	FBZDSUDTYUQYGJ-FNIBFVHZSA-N	508.268570292							102681
BRD-K86771738	LSM-13746		54646132	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21+,23-,25-/m1/s1	CCIDSNZUNACLPU-RIPRBREISA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K86771738	BRD-K86771738-001-01-5	Broad Institute of MIT and Harvard	BRD-K86771738			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21+,23-,25-/m1/s1	CCIDSNZUNACLPU-RIPRBREISA-N	465.226371122							102395
BRD-K85774994	LSM-13682		54646338	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21+,24+,26-/m0/s1	UVPONYOZSFJNDG-RDCZCFFCSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K85774994	BRD-K85774994-001-01-9	Broad Institute of MIT and Harvard	BRD-K85774994			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21+,24+,26-/m0/s1	UVPONYOZSFJNDG-RDCZCFFCSA-N	516.2071931							102330
BRD-K34869284	LSM-10526		54646142	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16-,18-,20+/m1/s1	BEWGTMHICYCEOA-ODZKNYGOSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NC4CCCC4)C[C@@H]3c2c1	BroadT	BRD-K34869284	BRD-K34869284-001-01-8	Broad Institute of MIT and Harvard	BRD-K34869284			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NC4CCCC4)O[C@@H]3CO)c2c1	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16-,18-,20+/m1/s1	BEWGTMHICYCEOA-ODZKNYGOSA-N	424.166807326							99147
BRD-K71611609	LSM-12812		54646226	InChI=1S/C26H32N4O5/c31-15-23-25-21(12-19(34-23)13-24(32)28-14-16-7-9-27-10-8-16)20-11-18(5-6-22(20)35-25)30-26(33)29-17-3-1-2-4-17/h5-11,17,19,21,23,25,31H,1-4,12-15H2,(H,28,32)(H2,29,30,33)/t19-,21-,23-,25+/m0/s1	CSQKNNUUWCECGY-YALMDMJRSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K71611609	BRD-K71611609-001-01-6	Broad Institute of MIT and Harvard	BRD-K71611609			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C26H32N4O5/c31-15-23-25-21(12-19(34-23)13-24(32)28-14-16-7-9-27-10-8-16)20-11-18(5-6-22(20)35-25)30-26(33)29-17-3-1-2-4-17/h5-11,17,19,21,23,25,31H,1-4,12-15H2,(H,28,32)(H2,29,30,33)/t19-,21-,23-,25+/m0/s1	CSQKNNUUWCECGY-YALMDMJRSA-N	480.237270164							101449
BRD-K10501200	LSM-9061		54646343	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21-,24+,26+/m1/s1	UVPONYOZSFJNDG-HUZKPYMCSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K10501200	BRD-K10501200-001-01-6	Broad Institute of MIT and Harvard	BRD-K10501200			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21-,24+,26+/m1/s1	UVPONYOZSFJNDG-HUZKPYMCSA-N	516.2071931							97682
BRD-K39236054	LSM-10809		54646369	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18-,20+,22+/m1/s1	LWPDCVYPXSZOFH-MDRHQERFSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(Cl)cc4)C[C@@H]3c2c1	BroadT	BRD-K39236054	BRD-K39236054-001-01-3	Broad Institute of MIT and Harvard	BRD-K39236054			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18-,20+,22+/m1/s1	LWPDCVYPXSZOFH-MDRHQERFSA-N	480.11218494							99430
BRD-K43006764	LSM-11042		54646291	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22-,25-,27+/m0/s1	ZUHKGHKDCFDVCR-YSDDDFLKSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K43006764	BRD-K43006764-001-01-5	Broad Institute of MIT and Harvard	BRD-K43006764			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22-,25-,27+/m0/s1	ZUHKGHKDCFDVCR-YSDDDFLKSA-N	591.179261962							99663
BRD-K01825565	LSM-8548		54646432	InChI=1S/C28H35N3O6/c1-35-20-10-7-18(8-11-20)30-28(34)31-19-9-12-24-22(13-19)23-14-21(36-25(16-32)27(23)37-24)15-26(33)29-17-5-3-2-4-6-17/h7-13,17,21,23,25,27,32H,2-6,14-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23+,25-,27-/m0/s1	ATPIYVGDEBDNGC-HFFYFMGZSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NC5CCCCC5)C[C@@H]4c3c2)cc1	BroadT	BRD-K01825565	BRD-K01825565-001-01-9	Broad Institute of MIT and Harvard	BRD-K01825565			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)NC5CCCCC5)O[C@H]4CO)c3c2)cc1	InChI=1S/C28H35N3O6/c1-35-20-10-7-18(8-11-20)30-28(34)31-19-9-12-24-22(13-19)23-14-21(36-25(16-32)27(23)37-24)15-26(33)29-17-5-3-2-4-6-17/h7-13,17,21,23,25,27,32H,2-6,14-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23+,25-,27-/m0/s1	ATPIYVGDEBDNGC-HFFYFMGZSA-N	509.25258587							97169
BRD-K14261052	LSM-9288		54646284	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20+,24+,26-/m0/s1	GAKFIKLLFOVZGV-BFAWKISMSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K14261052	BRD-K14261052-001-01-2	Broad Institute of MIT and Harvard	BRD-K14261052			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20+,24+,26-/m0/s1	GAKFIKLLFOVZGV-BFAWKISMSA-N	497.232599354							97909
BRD-K08508488	LSM-8942		54646131	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21+,23+,25-/m1/s1	CCIDSNZUNACLPU-IQKBUIRBSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K08508488	BRD-K08508488-001-01-8	Broad Institute of MIT and Harvard	BRD-K08508488			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21+,23+,25-/m1/s1	CCIDSNZUNACLPU-IQKBUIRBSA-N	465.226371122							97563
BRD-K56916873	LSM-11870		54646431	InChI=1S/C28H35N3O6/c1-35-20-10-7-18(8-11-20)30-28(34)31-19-9-12-24-22(13-19)23-14-21(36-25(16-32)27(23)37-24)15-26(33)29-17-5-3-2-4-6-17/h7-13,17,21,23,25,27,32H,2-6,14-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23+,25-,27-/m1/s1	ATPIYVGDEBDNGC-WWUYVNTOSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)NC5CCCCC5)C[C@H]4c3c2)cc1	BroadT	BRD-K56916873	BRD-K56916873-001-01-7	Broad Institute of MIT and Harvard	BRD-K56916873			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)NC5CCCCC5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C28H35N3O6/c1-35-20-10-7-18(8-11-20)30-28(34)31-19-9-12-24-22(13-19)23-14-21(36-25(16-32)27(23)37-24)15-26(33)29-17-5-3-2-4-6-17/h7-13,17,21,23,25,27,32H,2-6,14-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23+,25-,27-/m1/s1	ATPIYVGDEBDNGC-WWUYVNTOSA-N	509.25258587							100496
BRD-K09085062	LSM-8981		54646402	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18-,20-,22-,24+/m0/s1	LSNSUZUVRXFZLV-ZXXWCBILSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K09085062	BRD-K09085062-001-01-0	Broad Institute of MIT and Harvard	BRD-K09085062			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1)c1ccccc1	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18-,20-,22-,24+/m0/s1	LSNSUZUVRXFZLV-ZXXWCBILSA-N	410.22055746							97602
BRD-K00892322	LSM-8488		54646426	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18+,20-,23-/m0/s1	MRLAOALNSBFOMY-IRLNJFMJSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)N4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K00892322	BRD-K00892322-001-01-4	Broad Institute of MIT and Harvard	BRD-K00892322			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18+,20-,23-/m0/s1	MRLAOALNSBFOMY-IRLNJFMJSA-N	431.242021186							97109
BRD-K13697129	LSM-9255		54646333	InChI=1S/C23H35N3O4/c1-25(2)16-6-7-20-18(12-16)19-13-17(29-21(15-27)23(19)30-20)14-22(28)24-8-11-26-9-4-3-5-10-26/h6-7,12,17,19,21,23,27H,3-5,8-11,13-15H2,1-2H3,(H,24,28)/t17-,19+,21-,23-/m1/s1	HWEAQBDEOFZYHR-GUBFDYSESA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCCN4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K13697129	BRD-K13697129-001-01-7	Broad Institute of MIT and Harvard	BRD-K13697129			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCCN4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C23H35N3O4/c1-25(2)16-6-7-20-18(12-16)19-13-17(29-21(15-27)23(19)30-20)14-22(28)24-8-11-26-9-4-3-5-10-26/h6-7,12,17,19,21,23,27H,3-5,8-11,13-15H2,1-2H3,(H,24,28)/t17-,19+,21-,23-/m1/s1	HWEAQBDEOFZYHR-GUBFDYSESA-N	417.26275663							97876
BRD-K32782699	LSM-10416		54646177	InChI=1S/C22H27F3N2O6/c23-22(24,25)11-26-19(29)9-14-8-16-15-7-13(27-21(30)12-3-5-31-6-4-12)1-2-17(15)33-20(16)18(10-28)32-14/h1-2,7,12,14,16,18,20,28H,3-6,8-11H2,(H,26,29)(H,27,30)/t14-,16-,18+,20+/m1/s1	QSBPACLFOOFXHF-BIJSTVTOSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)C4CCOCC4)cc23	BroadT	BRD-K32782699	BRD-K32782699-001-01-4	Broad Institute of MIT and Harvard	BRD-K32782699			OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C22H27F3N2O6/c23-22(24,25)11-26-19(29)9-14-8-16-15-7-13(27-21(30)12-3-5-31-6-4-12)1-2-17(15)33-20(16)18(10-28)32-14/h1-2,7,12,14,16,18,20,28H,3-6,8-11H2,(H,26,29)(H,27,30)/t14-,16-,18+,20+/m1/s1	QSBPACLFOOFXHF-BIJSTVTOSA-N	472.182121204							99037
BRD-K06559861	LSM-8813		54646200	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19-,21+/m1/s1	JZVGIVMTJSWJDH-WELBPKCISA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccccn4)C[C@@H]3c2c1	BroadT	BRD-K06559861	BRD-K06559861-001-01-0	Broad Institute of MIT and Harvard	BRD-K06559861			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccn4)O[C@@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19-,21+/m1/s1	JZVGIVMTJSWJDH-WELBPKCISA-N	447.14640624							97434
BRD-K34015625	LSM-10487		54646168	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19-,21+,23+/m0/s1	SOARVSRWKWCBLL-VARILPKDSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@@H](CO)O2	BroadT	BRD-K34015625	BRD-K34015625-001-01-6	Broad Institute of MIT and Harvard	BRD-K34015625			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCC4)cc23)[C@@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19-,21+,23+/m0/s1	SOARVSRWKWCBLL-VARILPKDSA-N	443.242021186							99108
CHEMBL2359916	LSM-8908	SID131442597, BRD-K07967120	54646223	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25-,27+,29+/m0/s1	MRJCPWMBHXTRFB-IBNCXQOKSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@H]3c2c1	BroadT	BRD-K07967120	BRD-K07967120-001-01-1	Broad Institute of MIT and Harvard	BRD-K07967120			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@@H]3CO)c2c1	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25-,27+,29+/m0/s1	MRJCPWMBHXTRFB-IBNCXQOKSA-N	488.231122144							97529
BRD-K37060179	LSM-10670		54646296	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22-,25+,27+/m0/s1	ZUHKGHKDCFDVCR-ZTQIFVIOSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K37060179	BRD-K37060179-001-01-9	Broad Institute of MIT and Harvard	BRD-K37060179			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22-,25+,27+/m0/s1	ZUHKGHKDCFDVCR-ZTQIFVIOSA-N	591.179261962							99291
BRD-K18713590	LSM-9552		54646201	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19+,21-/m0/s1	JZVGIVMTJSWJDH-RWCSOYMTSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccccn4)C[C@@H]3c2c1	BroadT	BRD-K18713590	BRD-K18713590-001-01-7	Broad Institute of MIT and Harvard	BRD-K18713590			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccn4)O[C@@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19+,21-/m0/s1	JZVGIVMTJSWJDH-RWCSOYMTSA-N	447.14640624							98173
BRD-K86516784	LSM-13725		54646166	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19+,21-,23-/m1/s1	SOARVSRWKWCBLL-GUBFDYSESA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@@H](CO)O2	BroadT	BRD-K86516784	BRD-K86516784-001-01-7	Broad Institute of MIT and Harvard	BRD-K86516784			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCC4)cc23)[C@@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19+,21-,23-/m1/s1	SOARVSRWKWCBLL-GUBFDYSESA-N	443.242021186							102374
BRD-K15476875	LSM-9356		54646433	InChI=1S/C28H35N3O6/c1-35-20-10-7-18(8-11-20)30-28(34)31-19-9-12-24-22(13-19)23-14-21(36-25(16-32)27(23)37-24)15-26(33)29-17-5-3-2-4-6-17/h7-13,17,21,23,25,27,32H,2-6,14-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25+,27+/m0/s1	ATPIYVGDEBDNGC-JZEPBHRJSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)NC5CCCCC5)C[C@H]4c3c2)cc1	BroadT	BRD-K15476875	BRD-K15476875-001-01-0	Broad Institute of MIT and Harvard	BRD-K15476875			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NC5CCCCC5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C28H35N3O6/c1-35-20-10-7-18(8-11-20)30-28(34)31-19-9-12-24-22(13-19)23-14-21(36-25(16-32)27(23)37-24)15-26(33)29-17-5-3-2-4-6-17/h7-13,17,21,23,25,27,32H,2-6,14-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25+,27+/m0/s1	ATPIYVGDEBDNGC-JZEPBHRJSA-N	509.25258587							97977
BRD-K79750489	LSM-13295		54646267	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23-,25+,27+/m0/s1	VIZOEWJOWGMLTK-JZEPBHRJSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K79750489	BRD-K79750489-001-01-9	Broad Institute of MIT and Harvard	BRD-K79750489			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23-,25+,27+/m0/s1	VIZOEWJOWGMLTK-JZEPBHRJSA-N	508.268570292							101934
BRD-K65077386	LSM-12402		54646151	InChI=1S/C24H30N2O4/c1-26(2)17-8-9-21-19(12-17)20-13-18(29-22(15-27)24(20)30-21)14-23(28)25-11-10-16-6-4-3-5-7-16/h3-9,12,18,20,22,24,27H,10-11,13-15H2,1-2H3,(H,25,28)/t18-,20-,22-,24+/m0/s1	VTJOJCWIVRUFJE-UYLMIGBBSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCCc4ccccc4)C[C@H]3c2c1	BroadT	BRD-K65077386	BRD-K65077386-001-01-7	Broad Institute of MIT and Harvard	BRD-K65077386			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCCc4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C24H30N2O4/c1-26(2)17-8-9-21-19(12-17)20-13-18(29-22(15-27)24(20)30-21)14-23(28)25-11-10-16-6-4-3-5-7-16/h3-9,12,18,20,22,24,27H,10-11,13-15H2,1-2H3,(H,25,28)/t18-,20-,22-,24+/m0/s1	VTJOJCWIVRUFJE-UYLMIGBBSA-N	410.22055746							101029
BRD-K12362628	LSM-9162		54646294	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22+,25-,27-/m1/s1	ZUHKGHKDCFDVCR-IIKILRQQSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K12362628	BRD-K12362628-001-01-5	Broad Institute of MIT and Harvard	BRD-K12362628			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22+,25-,27-/m1/s1	ZUHKGHKDCFDVCR-IIKILRQQSA-N	591.179261962							97783
BRD-K91359405	LSM-14042		54646118	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15+,17+,20-/m1/s1	ZWJVDCAUIXXXGX-GKTLAZJLSA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)COC)cc23)[C@H](CO)O1	BroadT	BRD-K91359405	BRD-K91359405-001-01-4	Broad Institute of MIT and Harvard	BRD-K91359405			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)COC)cc23)[C@H](CO)O1	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15+,17+,20-/m1/s1	ZWJVDCAUIXXXGX-GKTLAZJLSA-N	392.194736636							102695
BRD-K86894923	LSM-13759		54646302	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25+,27-,30-/m1/s1	ZUSAVEKAEPAMKG-LIOQXTORSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Cc6ccncc6)cc45	BroadT	BRD-K86894923	BRD-K86894923-001-01-0	Broad Institute of MIT and Harvard	BRD-K86894923			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25+,27-,30-/m1/s1	ZUSAVEKAEPAMKG-LIOQXTORSA-N	513.226371122							102408
BRD-K50641952	LSM-11509		54646203	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19+,21-/m1/s1	JZVGIVMTJSWJDH-ZWVMGRIOSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccccn4)C[C@H]3c2c1	BroadT	BRD-K50641952	BRD-K50641952-001-01-1	Broad Institute of MIT and Harvard	BRD-K50641952			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccccn4)O[C@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19+,21-/m1/s1	JZVGIVMTJSWJDH-ZWVMGRIOSA-N	447.14640624							100130
BRD-K11721480	LSM-9139		54646174	InChI=1S/C22H27F3N2O6/c23-22(24,25)11-26-19(29)9-14-8-16-15-7-13(27-21(30)12-3-5-31-6-4-12)1-2-17(15)33-20(16)18(10-28)32-14/h1-2,7,12,14,16,18,20,28H,3-6,8-11H2,(H,26,29)(H,27,30)/t14-,16-,18-,20+/m1/s1	QSBPACLFOOFXHF-ODZKNYGOSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)C4CCOCC4)cc23	BroadT	BRD-K11721480	BRD-K11721480-001-01-0	Broad Institute of MIT and Harvard	BRD-K11721480			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C22H27F3N2O6/c23-22(24,25)11-26-19(29)9-14-8-16-15-7-13(27-21(30)12-3-5-31-6-4-12)1-2-17(15)33-20(16)18(10-28)32-14/h1-2,7,12,14,16,18,20,28H,3-6,8-11H2,(H,26,29)(H,27,30)/t14-,16-,18-,20+/m1/s1	QSBPACLFOOFXHF-ODZKNYGOSA-N	472.182121204							97760
BRD-K41550080-001-01-1	LSM-31510	BRD-K41550080	54646297	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22-,24+,26+/m1/s1	QQFSWHWRRZLIPD-GUAAGHCTSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K41550080	BRD-K41550080-001-01-1	Broad Institute of MIT and Harvard	BRD-K41550080			COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@H](CO)O2)cc1	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22-,24+,26+/m1/s1	QQFSWHWRRZLIPD-GUAAGHCTSA-N	480.226036764							120067
BRD-K80686631	LSM-13363		54646179	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22-,25-,27+/m0/s1	FSAONXZLMNAVLZ-YSDDDFLKSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCOCC5)cc34)[C@H](CO)O2	BroadT	BRD-K80686631	BRD-K80686631-001-01-9	Broad Institute of MIT and Harvard	BRD-K80686631			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22-,25-,27+/m0/s1	FSAONXZLMNAVLZ-YSDDDFLKSA-N	510.236601448							102002
BRD-K67094066	LSM-12514		54646246	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23-,25+,27+/m1/s1	FWDZHOQSJMEDFJ-RESCMLIYSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)NCc5ccccn5)C[C@@H]4c3c2)cc1	BroadT	BRD-K67094066	BRD-K67094066-001-01-7	Broad Institute of MIT and Harvard	BRD-K67094066			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NCc5ccccn5)O[C@H]4CO)c3c2)cc1	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23-,25+,27+/m1/s1	FWDZHOQSJMEDFJ-RESCMLIYSA-N	518.21653472							101145
BRD-K66689236	LSM-12490		54646288	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20-,24+,26+/m0/s1	GAKFIKLLFOVZGV-DCCOOJGFSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K66689236	BRD-K66689236-001-01-0	Broad Institute of MIT and Harvard	BRD-K66689236			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20-,24+,26+/m0/s1	GAKFIKLLFOVZGV-DCCOOJGFSA-N	497.232599354							101121
BRD-K20517870	LSM-9679		54646230	InChI=1S/C26H32N4O5/c31-15-23-25-21(12-19(34-23)13-24(32)28-14-16-7-9-27-10-8-16)20-11-18(5-6-22(20)35-25)30-26(33)29-17-3-1-2-4-17/h5-11,17,19,21,23,25,31H,1-4,12-15H2,(H,28,32)(H2,29,30,33)/t19-,21-,23+,25+/m1/s1	CSQKNNUUWCECGY-ASASOQJESA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K20517870	BRD-K20517870-001-01-9	Broad Institute of MIT and Harvard	BRD-K20517870			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C26H32N4O5/c31-15-23-25-21(12-19(34-23)13-24(32)28-14-16-7-9-27-10-8-16)20-11-18(5-6-22(20)35-25)30-26(33)29-17-3-1-2-4-17/h5-11,17,19,21,23,25,31H,1-4,12-15H2,(H,28,32)(H2,29,30,33)/t19-,21-,23+,25+/m1/s1	CSQKNNUUWCECGY-ASASOQJESA-N	480.237270164							98300
BRD-K40971145	LSM-10921		54646376	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28+,31+/m0/s1	BRDKARYWUSDFKE-XYKPQQNDSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@H]3c2c1	BroadT	BRD-K40971145	BRD-K40971145-001-01-3	Broad Institute of MIT and Harvard	BRD-K40971145			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(cc4)-c4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28+,31+/m0/s1	BRDKARYWUSDFKE-XYKPQQNDSA-N	529.25767125							99542
BRD-K67851959	LSM-12565		54646398	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24-,26-/m0/s1	XBPCNRNKOXKUQA-YXOQKGKWSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K67851959	BRD-K67851959-001-01-0	Broad Institute of MIT and Harvard	BRD-K67851959			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24-,26-/m0/s1	XBPCNRNKOXKUQA-YXOQKGKWSA-N	464.231122144							101196
BRD-K77125349	LSM-13146		54646307	InChI=1S/C29H31N3O6/c1-36-24-5-3-2-4-19(24)16-31-27(34)15-21-14-23-22-13-20(32-28(35)12-18-8-10-30-11-9-18)6-7-25(22)38-29(23)26(17-33)37-21/h2-11,13,21,23,26,29,33H,12,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,26+,29-/m1/s1	ZGXOXQUBSYKGRY-MJMMSJOPSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Cc5ccncc5)cc34)[C@H](CO)O2	BroadT	BRD-K77125349	BRD-K77125349-001-01-6	Broad Institute of MIT and Harvard	BRD-K77125349			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	InChI=1S/C29H31N3O6/c1-36-24-5-3-2-4-19(24)16-31-27(34)15-21-14-23-22-13-20(32-28(35)12-18-8-10-30-11-9-18)6-7-25(22)38-29(23)26(17-33)37-21/h2-11,13,21,23,26,29,33H,12,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,26+,29-/m1/s1	ZGXOXQUBSYKGRY-MJMMSJOPSA-N	517.221285742							101784
BRD-K89379568	LSM-13932		54646363	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18-,20-,22+/m0/s1	LWPDCVYPXSZOFH-JXYHXMIBSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(Cl)cc4)C[C@H]3c2c1	BroadT	BRD-K89379568	BRD-K89379568-001-01-9	Broad Institute of MIT and Harvard	BRD-K89379568			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18-,20-,22+/m0/s1	LWPDCVYPXSZOFH-JXYHXMIBSA-N	480.11218494							102585
BRD-K47064511	LSM-11300		54646261	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23-,25-,27+/m1/s1	VIZOEWJOWGMLTK-UFUIAINPSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K47064511	BRD-K47064511-001-01-6	Broad Institute of MIT and Harvard	BRD-K47064511			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23-,25-,27+/m1/s1	VIZOEWJOWGMLTK-UFUIAINPSA-N	508.268570292							99921
BRD-K40708745	LSM-10915		54646410	InChI=1S/C25H30N2O4/c1-26(2)18-7-8-22-20(11-18)21-12-19(30-23(15-28)25(21)31-22)13-24(29)27-10-9-16-5-3-4-6-17(16)14-27/h3-8,11,19,21,23,25,28H,9-10,12-15H2,1-2H3/t19-,21-,23-,25+/m0/s1	QQFBCVYCCQBHCE-YALMDMJRSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)N4CCc5ccccc5C4)C[C@H]3c2c1	BroadT	BRD-K40708745	BRD-K40708745-001-01-3	Broad Institute of MIT and Harvard	BRD-K40708745			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O4/c1-26(2)18-7-8-22-20(11-18)21-12-19(30-23(15-28)25(21)31-22)13-24(29)27-10-9-16-5-3-4-6-17(16)14-27/h3-8,11,19,21,23,25,28H,9-10,12-15H2,1-2H3/t19-,21-,23-,25+/m0/s1	QQFBCVYCCQBHCE-YALMDMJRSA-N	422.22055746							99536
BRD-K10654753	LSM-9068		54646236	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22-,24+,26-,28-/m0/s1	HZCFRKFPOJNJBV-KFWJVWFGSA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K10654753	BRD-K10654753-001-01-4	Broad Institute of MIT and Harvard	BRD-K10654753			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22-,24+,26-,28-/m0/s1	HZCFRKFPOJNJBV-KFWJVWFGSA-N	569.21375569							97689
BRD-K62299351	LSM-12211		54646340	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21+,24-,26-/m1/s1	UVPONYOZSFJNDG-LTOPPJTRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K62299351	BRD-K62299351-001-01-1	Broad Institute of MIT and Harvard	BRD-K62299351			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21+,24-,26-/m1/s1	UVPONYOZSFJNDG-LTOPPJTRSA-N	516.2071931							100837
BRD-K75964914	LSM-13074		54646158	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23+,25-,28-/m1/s1	FBZDSUDTYUQYGJ-YZDMAOCNSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K75964914	BRD-K75964914-001-01-5	Broad Institute of MIT and Harvard	BRD-K75964914			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23+,25-,28-/m1/s1	FBZDSUDTYUQYGJ-YZDMAOCNSA-N	508.268570292							101711
BRD-K33065959	LSM-10442		54646262	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23-,25-,27+/m0/s1	VIZOEWJOWGMLTK-NTYBTQPHSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K33065959	BRD-K33065959-001-01-8	Broad Institute of MIT and Harvard	BRD-K33065959			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23-,25-,27+/m0/s1	VIZOEWJOWGMLTK-NTYBTQPHSA-N	508.268570292							99063
BRD-K44777226	LSM-11152		54646239	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23-,25-,27+/m1/s1	FWDZHOQSJMEDFJ-UFUIAINPSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NCc5ccccn5)C[C@@H]4c3c2)cc1	BroadT	BRD-K44777226	BRD-K44777226-001-01-2	Broad Institute of MIT and Harvard	BRD-K44777226			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NCc5ccccn5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23-,25-,27+/m1/s1	FWDZHOQSJMEDFJ-UFUIAINPSA-N	518.21653472							99773
BRD-K94924347	LSM-14249		54646368	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18-,20+,22+/m0/s1	LWPDCVYPXSZOFH-FDGCKHTNSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(Cl)cc4)C[C@H]3c2c1	BroadT	BRD-K94924347	BRD-K94924347-001-01-3	Broad Institute of MIT and Harvard	BRD-K94924347			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18-,20+,22+/m0/s1	LWPDCVYPXSZOFH-FDGCKHTNSA-N	480.11218494							102903
BRD-K59248941	LSM-12008		54646317	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26+,28+/m1/s1	UQAGOAYYXRCKNS-MSUVVHHUSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)NCc5ccccc5F)C[C@@H]4c3c2	BroadT	BRD-K59248941	BRD-K59248941-001-01-0	Broad Institute of MIT and Harvard	BRD-K59248941			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26+,28+/m1/s1	UQAGOAYYXRCKNS-MSUVVHHUSA-N	556.167950178							100634
BRD-K24329506	LSM-9903		54646389	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12+,14-,16-/m1/s1	STSQWNRYWIJNCW-HTWGDNNSSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K24329506	BRD-K24329506-001-01-7	Broad Institute of MIT and Harvard	BRD-K24329506			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12+,14-,16-/m1/s1	STSQWNRYWIJNCW-HTWGDNNSSA-N	371.103872712							98524
BRD-K38493380	LSM-10758		54646282	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20-,24-,26+/m1/s1	GAKFIKLLFOVZGV-FNVZBELISA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K38493380	BRD-K38493380-001-01-6	Broad Institute of MIT and Harvard	BRD-K38493380			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20-,24-,26+/m1/s1	GAKFIKLLFOVZGV-FNVZBELISA-N	497.232599354							99379
BRD-K18024110	LSM-9511		54646272	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25+,27-,29-/m1/s1	FOSRSIPYUZSGIW-SYBYNBCQSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)NCCc5ccccc5)C[C@H]4c3c2)cc1	BroadT	BRD-K18024110	BRD-K18024110-001-01-0	Broad Institute of MIT and Harvard	BRD-K18024110			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)NCCc5ccccc5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25+,27-,29-/m1/s1	FOSRSIPYUZSGIW-SYBYNBCQSA-N	531.236935806							98132
BRD-K61655210	LSM-12167		54646170	InChI=1S/C20H20FNO7S/c21-11-1-4-14(5-2-11)30(26,27)22-12-3-6-17-15(7-12)16-8-13(9-19(24)25)28-18(10-23)20(16)29-17/h1-7,13,16,18,20,22-23H,8-10H2,(H,24,25)/t13-,16-,18-,20+/m1/s1	BOKKRFULVUTARF-WGYMDGOUSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23	BroadT	BRD-K61655210	BRD-K61655210-001-01-6	Broad Institute of MIT and Harvard	BRD-K61655210			OC[C@H]1O[C@H](C[C@H]2[C@@H]1Oc1ccc(cc21)NS(=O)(=O)c1ccc(F)cc1)CC(O)=O	InChI=1S/C20H20FNO7S/c21-11-1-4-14(5-2-11)30(26,27)22-12-3-6-17-15(7-12)16-8-13(9-19(24)25)28-18(10-23)20(16)29-17/h1-7,13,16,18,20,22-23H,8-10H2,(H,24,25)/t13-,16-,18-,20+/m1/s1	BOKKRFULVUTARF-WGYMDGOUSA-N	437.09445088							100793
BRD-K13131627	LSM-9216		54646355	InChI=1S/C28H27F3N4O5/c29-28(30,31)17-3-5-18(6-4-17)34-27(38)35-19-7-8-23-21(10-19)22-11-20(39-24(15-36)26(22)40-23)12-25(37)33-14-16-2-1-9-32-13-16/h1-10,13,20,22,24,26,36H,11-12,14-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24+,26-/m1/s1	IMICHJYMUCZKDW-GRTAZNFBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K13131627	BRD-K13131627-001-01-4	Broad Institute of MIT and Harvard	BRD-K13131627			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)17-3-5-18(6-4-17)34-27(38)35-19-7-8-23-21(10-19)22-11-20(39-24(15-36)26(22)40-23)12-25(37)33-14-16-2-1-9-32-13-16/h1-10,13,20,22,24,26,36H,11-12,14-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24+,26-/m1/s1	IMICHJYMUCZKDW-GRTAZNFBSA-N	556.193354604							97837
BRD-K77631079	LSM-13174		54646172	InChI=1S/C20H20FNO7S/c21-11-1-4-14(5-2-11)30(26,27)22-12-3-6-17-15(7-12)16-8-13(9-19(24)25)28-18(10-23)20(16)29-17/h1-7,13,16,18,20,22-23H,8-10H2,(H,24,25)/t13-,16-,18+,20+/m0/s1	BOKKRFULVUTARF-XGJBHWFVSA-N	OC[C@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23	BroadT	BRD-K77631079	BRD-K77631079-001-01-9	Broad Institute of MIT and Harvard	BRD-K77631079			OC[C@H]1O[C@@H](C[C@@H]2[C@H]1Oc1ccc(cc21)NS(=O)(=O)c1ccc(F)cc1)CC(O)=O	InChI=1S/C20H20FNO7S/c21-11-1-4-14(5-2-11)30(26,27)22-12-3-6-17-15(7-12)16-8-13(9-19(24)25)28-18(10-23)20(16)29-17/h1-7,13,16,18,20,22-23H,8-10H2,(H,24,25)/t13-,16-,18+,20+/m0/s1	BOKKRFULVUTARF-XGJBHWFVSA-N	437.09445088							101812
BRD-K51894281	LSM-11604		54646245	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23-,25+,27+/m0/s1	FWDZHOQSJMEDFJ-JZEPBHRJSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)NCc5ccccn5)C[C@H]4c3c2)cc1	BroadT	BRD-K51894281	BRD-K51894281-001-01-7	Broad Institute of MIT and Harvard	BRD-K51894281			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NCc5ccccn5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23-,25+,27+/m0/s1	FWDZHOQSJMEDFJ-JZEPBHRJSA-N	518.21653472							100227
BRD-K07017100	LSM-8843		54646292	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22+,25+,27-/m0/s1	ZUHKGHKDCFDVCR-JBGAWVPVSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K07017100	BRD-K07017100-001-01-9	Broad Institute of MIT and Harvard	BRD-K07017100			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22+,25+,27-/m0/s1	ZUHKGHKDCFDVCR-JBGAWVPVSA-N	591.179261962							97464
BRD-K37369665	LSM-10686		54646191	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26-,28-/m0/s1	CRNISVWSFUFTQR-BXFJNEMGSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@H](CO)O2	BroadT	BRD-K37369665	BRD-K37369665-001-01-5	Broad Institute of MIT and Harvard	BRD-K37369665			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26-,28-/m0/s1	CRNISVWSFUFTQR-BXFJNEMGSA-N	556.167950178							99307
BRD-K51825814	LSM-11599		54646232	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22-,24-,26-,28+/m0/s1	HZCFRKFPOJNJBV-VDXPONGZSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K51825814	BRD-K51825814-001-01-7	Broad Institute of MIT and Harvard	BRD-K51825814			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22-,24-,26-,28+/m0/s1	HZCFRKFPOJNJBV-VDXPONGZSA-N	569.21375569							100222
BRD-K63585449	LSM-12300		54646349	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22+,24-,26-/m0/s1	OQZDFPDHTDCUCP-YXOQKGKWSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)N5CCN(C)CC5)C[C@@H]4c3c2)cc1	BroadT	BRD-K63585449	BRD-K63585449-001-01-6	Broad Institute of MIT and Harvard	BRD-K63585449			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)N5CCN(C)CC5)O[C@H]4CO)c3c2)cc1	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22+,24-,26-/m0/s1	OQZDFPDHTDCUCP-YXOQKGKWSA-N	510.247834848							100927
BRD-K86344535	LSM-13717		54646199	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17-,19+,21+/m1/s1	BVQWYDMOVFWUGX-DOSUHQCWSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@H](CO)O1	BroadT	BRD-K86344535	BRD-K86344535-001-01-6	Broad Institute of MIT and Harvard	BRD-K86344535			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17-,19+,21+/m1/s1	BVQWYDMOVFWUGX-DOSUHQCWSA-N	412.163436508							102365
BRD-K76087404	LSM-13081		54646133	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21+,23-,25-/m0/s1	CCIDSNZUNACLPU-PYTYSOFPSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K76087404	BRD-K76087404-001-01-1	Broad Institute of MIT and Harvard	BRD-K76087404			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21+,23-,25-/m0/s1	CCIDSNZUNACLPU-PYTYSOFPSA-N	465.226371122							101719
BRD-K45124535	LSM-11174		54646263	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23+,25+,27-/m0/s1	VIZOEWJOWGMLTK-BBVYRSAVSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K45124535	BRD-K45124535-001-01-2	Broad Institute of MIT and Harvard	BRD-K45124535			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23+,25+,27-/m0/s1	VIZOEWJOWGMLTK-BBVYRSAVSA-N	508.268570292							99795
BRD-K40263565	LSM-10886		54646120	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15+,17-,20-/m0/s1	ZWJVDCAUIXXXGX-IDVHHABFSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)COC)cc23)[C@H](CO)O1	BroadT	BRD-K40263565	BRD-K40263565-001-01-6	Broad Institute of MIT and Harvard	BRD-K40263565			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)COC)cc23)[C@H](CO)O1	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15+,17-,20-/m0/s1	ZWJVDCAUIXXXGX-IDVHHABFSA-N	392.194736636							99507
BRD-K97520136-001-01-1	LSM-31511	BRD-K97520136	54646298	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25-,27-,30+/m1/s1	ZUSAVEKAEPAMKG-HUPNWNGMSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Cc6ccncc6)cc45	BroadT	BRD-K97520136	BRD-K97520136-001-01-1	Broad Institute of MIT and Harvard	BRD-K97520136			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25-,27-,30+/m1/s1	ZUSAVEKAEPAMKG-HUPNWNGMSA-N	513.226371122							120068
BRD-K27263987	LSM-10076		54646176	InChI=1S/C22H27F3N2O6/c23-22(24,25)11-26-19(29)9-14-8-16-15-7-13(27-21(30)12-3-5-31-6-4-12)1-2-17(15)33-20(16)18(10-28)32-14/h1-2,7,12,14,16,18,20,28H,3-6,8-11H2,(H,26,29)(H,27,30)/t14-,16-,18+,20+/m0/s1	QSBPACLFOOFXHF-LBLLVPRASA-N	OC[C@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)C4CCOCC4)cc23	BroadT	BRD-K27263987	BRD-K27263987-001-01-3	Broad Institute of MIT and Harvard	BRD-K27263987			OC[C@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C22H27F3N2O6/c23-22(24,25)11-26-19(29)9-14-8-16-15-7-13(27-21(30)12-3-5-31-6-4-12)1-2-17(15)33-20(16)18(10-28)32-14/h1-2,7,12,14,16,18,20,28H,3-6,8-11H2,(H,26,29)(H,27,30)/t14-,16-,18+,20+/m0/s1	QSBPACLFOOFXHF-LBLLVPRASA-N	472.182121204							98697
BRD-K12868556	LSM-9192		54646299	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25-,27-,30+/m0/s1	ZUSAVEKAEPAMKG-BKVCSMAQSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Cc6ccncc6)cc45	BroadT	BRD-K12868556	BRD-K12868556-001-01-7	Broad Institute of MIT and Harvard	BRD-K12868556			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25-,27-,30+/m0/s1	ZUSAVEKAEPAMKG-BKVCSMAQSA-N	513.226371122							97813
BRD-K21047238	LSM-9710		54646327	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24+,26-,28-/m1/s1	AJGJMULVCJFZBU-UQCMEGJUSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K21047238	BRD-K21047238-001-01-3	Broad Institute of MIT and Harvard	BRD-K21047238			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24+,26-,28-/m1/s1	AJGJMULVCJFZBU-UQCMEGJUSA-N	506.241686828							98331
BRD-K18748400	LSM-9554		54646217	InChI=1S/C16H21NO5/c1-17(2)9-3-4-13-11(5-9)12-6-10(7-15(19)20)21-14(8-18)16(12)22-13/h3-5,10,12,14,16,18H,6-8H2,1-2H3,(H,19,20)/t10-,12-,14+,16+/m1/s1	MUGALHVVQCOZES-ILHHOCCXSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)O)C[C@@H]3c2c1	BroadT	BRD-K18748400	BRD-K18748400-001-01-3	Broad Institute of MIT and Harvard	BRD-K18748400			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(O)=O)O[C@H]3CO)c2c1	InChI=1S/C16H21NO5/c1-17(2)9-3-4-13-11(5-9)12-6-10(7-15(19)20)21-14(8-18)16(12)22-13/h3-5,10,12,14,16,18H,6-8H2,1-2H3,(H,19,20)/t10-,12-,14+,16+/m1/s1	MUGALHVVQCOZES-ILHHOCCXSA-N	307.141972782							98175
BRD-K90982895	LSM-14030		54646171	InChI=1S/C20H20FNO7S/c21-11-1-4-14(5-2-11)30(26,27)22-12-3-6-17-15(7-12)16-8-13(9-19(24)25)28-18(10-23)20(16)29-17/h1-7,13,16,18,20,22-23H,8-10H2,(H,24,25)/t13-,16-,18-,20+/m0/s1	BOKKRFULVUTARF-JQIPDMGMSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23	BroadT	BRD-K90982895	BRD-K90982895-001-01-1	Broad Institute of MIT and Harvard	BRD-K90982895			OC[C@@H]1O[C@@H](C[C@@H]2[C@H]1Oc1ccc(cc21)NS(=O)(=O)c1ccc(F)cc1)CC(O)=O	InChI=1S/C20H20FNO7S/c21-11-1-4-14(5-2-11)30(26,27)22-12-3-6-17-15(7-12)16-8-13(9-19(24)25)28-18(10-23)20(16)29-17/h1-7,13,16,18,20,22-23H,8-10H2,(H,24,25)/t13-,16-,18-,20+/m0/s1	BOKKRFULVUTARF-JQIPDMGMSA-N	437.09445088							102683
BRD-K99383477	LSM-14534		54646406	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18+,20+,22-,24-/m1/s1	LSNSUZUVRXFZLV-MOXAOEEZSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K99383477	BRD-K99383477-001-01-9	Broad Institute of MIT and Harvard	BRD-K99383477			C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1)c1ccccc1	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18+,20+,22-,24-/m1/s1	LSNSUZUVRXFZLV-MOXAOEEZSA-N	410.22055746							103189
BRD-K65485797	LSM-12425		54646249	InChI=1S/C29H28FN3O7/c30-21-3-1-2-4-22(21)33-29(36)32-17-6-8-23-19(10-17)20-11-18(39-26(14-34)28(20)40-23)12-27(35)31-13-16-5-7-24-25(9-16)38-15-37-24/h1-10,18,20,26,28,34H,11-15H2,(H,31,35)(H2,32,33,36)/t18-,20+,26+,28-/m1/s1	QUTKLMAKSFRFCA-PNCJJDQKSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K65485797	BRD-K65485797-001-01-5	Broad Institute of MIT and Harvard	BRD-K65485797			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H28FN3O7/c30-21-3-1-2-4-22(21)33-29(36)32-17-6-8-23-19(10-17)20-11-18(39-26(14-34)28(20)40-23)12-27(35)31-13-16-5-7-24-25(9-16)38-15-37-24/h1-10,18,20,26,28,34H,11-15H2,(H,31,35)(H2,32,33,36)/t18-,20+,26+,28-/m1/s1	QUTKLMAKSFRFCA-PNCJJDQKSA-N	549.191128466							101052
BRD-K30438246	LSM-10263		54646308	InChI=1S/C29H31N3O6/c1-36-24-5-3-2-4-19(24)16-31-27(34)15-21-14-23-22-13-20(32-28(35)12-18-8-10-30-11-9-18)6-7-25(22)38-29(23)26(17-33)37-21/h2-11,13,21,23,26,29,33H,12,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,26-,29-/m1/s1	ZGXOXQUBSYKGRY-WKPJDCFISA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Cc5ccncc5)cc34)[C@@H](CO)O2	BroadT	BRD-K30438246	BRD-K30438246-001-01-3	Broad Institute of MIT and Harvard	BRD-K30438246			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	InChI=1S/C29H31N3O6/c1-36-24-5-3-2-4-19(24)16-31-27(34)15-21-14-23-22-13-20(32-28(35)12-18-8-10-30-11-9-18)6-7-25(22)38-29(23)26(17-33)37-21/h2-11,13,21,23,26,29,33H,12,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,26-,29-/m1/s1	ZGXOXQUBSYKGRY-WKPJDCFISA-N	517.221285742							98884
BRD-K45501379	LSM-11206		54646183	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22+,25-,27-/m0/s1	FSAONXZLMNAVLZ-BUZLNKNLSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCOCC5)cc34)[C@H](CO)O2	BroadT	BRD-K45501379	BRD-K45501379-001-01-0	Broad Institute of MIT and Harvard	BRD-K45501379			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22+,25-,27-/m0/s1	FSAONXZLMNAVLZ-BUZLNKNLSA-N	510.236601448							99827
BRD-K16075454	LSM-9396		54646336	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21-,24-,26+/m1/s1	UVPONYOZSFJNDG-UNMCOINBSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K16075454	BRD-K16075454-001-01-8	Broad Institute of MIT and Harvard	BRD-K16075454			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21-,24-,26+/m1/s1	UVPONYOZSFJNDG-UNMCOINBSA-N	516.2071931							98017
BRD-K37654434	LSM-10706		54646278	InChI=1S/C20H28N2O4/c1-22(2)13-5-6-17-15(7-13)16-8-14(25-18(11-23)20(16)26-17)9-19(24)21-10-12-3-4-12/h5-7,12,14,16,18,20,23H,3-4,8-11H2,1-2H3,(H,21,24)/t14-,16+,18+,20-/m1/s1	JLJMCVQNTFDIRA-VKSDOSABSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K37654434	BRD-K37654434-001-01-0	Broad Institute of MIT and Harvard	BRD-K37654434			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C20H28N2O4/c1-22(2)13-5-6-17-15(7-13)16-8-14(25-18(11-23)20(16)26-17)9-19(24)21-10-12-3-4-12/h5-7,12,14,16,18,20,23H,3-4,8-11H2,1-2H3,(H,21,24)/t14-,16+,18+,20-/m1/s1	JLJMCVQNTFDIRA-VKSDOSABSA-N	360.204907396							99327
BRD-K74823284	LSM-13014		54646361	InChI=1S/C22H27N3O4/c1-25(2)15-6-7-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-3-4-8-23-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,20+,22+/m0/s1	PSRJUTPUZRNONK-FDGCKHTNSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccccn4)C[C@H]3c2c1	BroadT	BRD-K74823284	BRD-K74823284-001-01-6	Broad Institute of MIT and Harvard	BRD-K74823284			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccn4)O[C@@H]3CO)c2c1	InChI=1S/C22H27N3O4/c1-25(2)15-6-7-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-3-4-8-23-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,20+,22+/m0/s1	PSRJUTPUZRNONK-FDGCKHTNSA-N	397.200156374							101651
BRD-K43396185	LSM-11066		54646275	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25-,27+,29+/m1/s1	FOSRSIPYUZSGIW-UXLOVFDUSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)NCCc5ccccc5)C[C@@H]4c3c2)cc1	BroadT	BRD-K43396185	BRD-K43396185-001-01-1	Broad Institute of MIT and Harvard	BRD-K43396185			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NCCc5ccccc5)O[C@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25-,27+,29+/m1/s1	FOSRSIPYUZSGIW-UXLOVFDUSA-N	531.236935806							99687
BRD-K98869108	LSM-14497		54646125	InChI=1S/C30H30N2O7/c1-17(18-5-3-2-4-6-18)31-28(34)14-21-13-23-22-12-20(8-10-24(22)39-29(23)27(15-33)38-21)32-30(35)19-7-9-25-26(11-19)37-16-36-25/h2-12,17,21,23,27,29,33H,13-16H2,1H3,(H,31,34)(H,32,35)/t17-,21-,23+,27-,29-/m1/s1	PKVMSJKEIKOOIO-QCDCGYHRSA-N	C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1)c6ccccc6	BroadT	BRD-K98869108	BRD-K98869108-001-01-5	Broad Institute of MIT and Harvard	BRD-K98869108			C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C30H30N2O7/c1-17(18-5-3-2-4-6-18)31-28(34)14-21-13-23-22-12-20(8-10-24(22)39-29(23)27(15-33)38-21)32-30(35)19-7-9-25-26(11-19)37-16-36-25/h2-12,17,21,23,27,29,33H,13-16H2,1H3,(H,31,34)(H,32,35)/t17-,21-,23+,27-,29-/m1/s1	PKVMSJKEIKOOIO-QCDCGYHRSA-N	530.20530132							103152
BRD-K36899442	LSM-10660		54646248	InChI=1S/C29H28FN3O7/c30-21-3-1-2-4-22(21)33-29(36)32-17-6-8-23-19(10-17)20-11-18(39-26(14-34)28(20)40-23)12-27(35)31-13-16-5-7-24-25(9-16)38-15-37-24/h1-10,18,20,26,28,34H,11-15H2,(H,31,35)(H2,32,33,36)/t18-,20-,26-,28+/m0/s1	QUTKLMAKSFRFCA-NOXYHNFTSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K36899442	BRD-K36899442-001-01-2	Broad Institute of MIT and Harvard	BRD-K36899442			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H28FN3O7/c30-21-3-1-2-4-22(21)33-29(36)32-17-6-8-23-19(10-17)20-11-18(39-26(14-34)28(20)40-23)12-27(35)31-13-16-5-7-24-25(9-16)38-15-37-24/h1-10,18,20,26,28,34H,11-15H2,(H,31,35)(H2,32,33,36)/t18-,20-,26-,28+/m0/s1	QUTKLMAKSFRFCA-NOXYHNFTSA-N	549.191128466							99281
BRD-K84239628	LSM-13579		54646227	InChI=1S/C26H32N4O5/c31-15-23-25-21(12-19(34-23)13-24(32)28-14-16-7-9-27-10-8-16)20-11-18(5-6-22(20)35-25)30-26(33)29-17-3-1-2-4-17/h5-11,17,19,21,23,25,31H,1-4,12-15H2,(H,28,32)(H2,29,30,33)/t19-,21+,23-,25-/m1/s1	CSQKNNUUWCECGY-RIPRBREISA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K84239628	BRD-K84239628-001-01-8	Broad Institute of MIT and Harvard	BRD-K84239628			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C26H32N4O5/c31-15-23-25-21(12-19(34-23)13-24(32)28-14-16-7-9-27-10-8-16)20-11-18(5-6-22(20)35-25)30-26(33)29-17-3-1-2-4-17/h5-11,17,19,21,23,25,31H,1-4,12-15H2,(H,28,32)(H2,29,30,33)/t19-,21+,23-,25-/m1/s1	CSQKNNUUWCECGY-RIPRBREISA-N	480.237270164							102223
BRD-K97364711	LSM-14411		54646157	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23+,25+,28-/m1/s1	FBZDSUDTYUQYGJ-IBFWWDTPSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K97364711	BRD-K97364711-001-01-7	Broad Institute of MIT and Harvard	BRD-K97364711			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23+,25+,28-/m1/s1	FBZDSUDTYUQYGJ-IBFWWDTPSA-N	508.268570292							103065
BRD-K51998640	LSM-11611		54646358	InChI=1S/C22H27N3O4/c1-25(2)15-6-7-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-3-4-8-23-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,20-,22+/m1/s1	PSRJUTPUZRNONK-ZLLBNUPZSA-N	CN(C)c1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccccn4)C[C@@H]3c2c1	BroadT	BRD-K51998640	BRD-K51998640-001-01-2	Broad Institute of MIT and Harvard	BRD-K51998640			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccn4)O[C@@H]3CO)c2c1	InChI=1S/C22H27N3O4/c1-25(2)15-6-7-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-3-4-8-23-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,20-,22+/m1/s1	PSRJUTPUZRNONK-ZLLBNUPZSA-N	397.200156374							100234
BRD-K23293459	LSM-9834		54646140	InChI=1S/C30H30N2O8/c1-36-23-5-3-2-4-18(23)14-31-28(34)13-20-12-22-21-11-19(7-9-24(21)40-29(22)27(15-33)39-20)32-30(35)17-6-8-25-26(10-17)38-16-37-25/h2-11,20,22,27,29,33H,12-16H2,1H3,(H,31,34)(H,32,35)/t20-,22+,27-,29-/m0/s1	IQCMSFSSZNINGU-DEZBDVBPSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@H](CO)O2	BroadT	BRD-K23293459	BRD-K23293459-001-01-3	Broad Institute of MIT and Harvard	BRD-K23293459			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C30H30N2O8/c1-36-23-5-3-2-4-18(23)14-31-28(34)13-20-12-22-21-11-19(7-9-24(21)40-29(22)27(15-33)39-20)32-30(35)17-6-8-25-26(10-17)38-16-37-25/h2-11,20,22,27,29,33H,12-16H2,1H3,(H,31,34)(H,32,35)/t20-,22+,27-,29-/m0/s1	IQCMSFSSZNINGU-DEZBDVBPSA-N	546.20021594							98455
BRD-K37020290	LSM-10669		54646228	InChI=1S/C26H32N4O5/c31-15-23-25-21(12-19(34-23)13-24(32)28-14-16-7-9-27-10-8-16)20-11-18(5-6-22(20)35-25)30-26(33)29-17-3-1-2-4-17/h5-11,17,19,21,23,25,31H,1-4,12-15H2,(H,28,32)(H2,29,30,33)/t19-,21+,23-,25-/m0/s1	CSQKNNUUWCECGY-PYTYSOFPSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K37020290	BRD-K37020290-001-01-7	Broad Institute of MIT and Harvard	BRD-K37020290			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C26H32N4O5/c31-15-23-25-21(12-19(34-23)13-24(32)28-14-16-7-9-27-10-8-16)20-11-18(5-6-22(20)35-25)30-26(33)29-17-3-1-2-4-17/h5-11,17,19,21,23,25,31H,1-4,12-15H2,(H,28,32)(H2,29,30,33)/t19-,21+,23-,25-/m0/s1	CSQKNNUUWCECGY-PYTYSOFPSA-N	480.237270164							99290
BRD-K13059597	LSM-9209		54646283	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20-,24-,26+/m0/s1	GAKFIKLLFOVZGV-IHJBEOSKSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K13059597	BRD-K13059597-001-01-3	Broad Institute of MIT and Harvard	BRD-K13059597			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20-,24-,26+/m0/s1	GAKFIKLLFOVZGV-IHJBEOSKSA-N	497.232599354							97830
BRD-K06086334	LSM-8781		54646390	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12+,14-,16-/m0/s1	STSQWNRYWIJNCW-MXZCIGPVSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K06086334	BRD-K06086334-001-01-3	Broad Institute of MIT and Harvard	BRD-K06086334			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12+,14-,16-/m0/s1	STSQWNRYWIJNCW-MXZCIGPVSA-N	371.103872712							97402
BRD-K43650237	LSM-11092		54646122	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15-,17+,20+/m1/s1	ZWJVDCAUIXXXGX-HMPASCQOSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)COC)cc23)[C@H](CO)O1	BroadT	BRD-K43650237	BRD-K43650237-001-01-9	Broad Institute of MIT and Harvard	BRD-K43650237			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)COC)cc23)[C@H](CO)O1	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15-,17+,20+/m1/s1	ZWJVDCAUIXXXGX-HMPASCQOSA-N	392.194736636							99713
BRD-K36360168	LSM-10624		54646195	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17+,19+,21-/m0/s1	BVQWYDMOVFWUGX-RWCSOYMTSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K36360168	BRD-K36360168-001-01-7	Broad Institute of MIT and Harvard	BRD-K36360168			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17+,19+,21-/m0/s1	BVQWYDMOVFWUGX-RWCSOYMTSA-N	412.163436508							99245
BRD-K16506804	LSM-9427		54646415	InChI=1S/C25H30N2O4/c1-26(2)18-7-8-22-20(11-18)21-12-19(30-23(15-28)25(21)31-22)13-24(29)27-10-9-16-5-3-4-6-17(16)14-27/h3-8,11,19,21,23,25,28H,9-10,12-15H2,1-2H3/t19-,21-,23+,25+/m1/s1	QQFBCVYCCQBHCE-ASASOQJESA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)N4CCc5ccccc5C4)C[C@@H]3c2c1	BroadT	BRD-K16506804	BRD-K16506804-001-01-9	Broad Institute of MIT and Harvard	BRD-K16506804			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O4/c1-26(2)18-7-8-22-20(11-18)21-12-19(30-23(15-28)25(21)31-22)13-24(29)27-10-9-16-5-3-4-6-17(16)14-27/h3-8,11,19,21,23,25,28H,9-10,12-15H2,1-2H3/t19-,21-,23+,25+/m1/s1	QQFBCVYCCQBHCE-ASASOQJESA-N	422.22055746							98048
BRD-K35995762	LSM-10594		54646423	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18+,20+,23-/m0/s1	MRLAOALNSBFOMY-MVIJMRCYSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)N4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K35995762	BRD-K35995762-001-01-1	Broad Institute of MIT and Harvard	BRD-K35995762			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18+,20+,23-/m0/s1	MRLAOALNSBFOMY-MVIJMRCYSA-N	431.242021186							99215
BRD-K23058957	LSM-9827		54646303	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25+,27-,30-/m0/s1	ZUSAVEKAEPAMKG-ZOMOEZKFSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Cc6ccncc6)cc45	BroadT	BRD-K23058957	BRD-K23058957-001-01-7	Broad Institute of MIT and Harvard	BRD-K23058957			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25+,27-,30-/m0/s1	ZUSAVEKAEPAMKG-ZOMOEZKFSA-N	513.226371122							98448
BRD-K85684641	LSM-13672		54646268	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23-,25+,27+/m1/s1	VIZOEWJOWGMLTK-RESCMLIYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K85684641	BRD-K85684641-001-01-7	Broad Institute of MIT and Harvard	BRD-K85684641			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23-,25+,27+/m1/s1	VIZOEWJOWGMLTK-RESCMLIYSA-N	508.268570292							102319
BRD-K20148542	LSM-9655		54646271	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25+,27+,29-/m1/s1	FOSRSIPYUZSGIW-KYYACDKCSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NCCc5ccccc5)C[C@H]4c3c2)cc1	BroadT	BRD-K20148542	BRD-K20148542-001-01-1	Broad Institute of MIT and Harvard	BRD-K20148542			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)NCCc5ccccc5)O[C@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25+,27+,29-/m1/s1	FOSRSIPYUZSGIW-KYYACDKCSA-N	531.236935806							98276
BRD-K38998914	LSM-10790		54646167	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19+,21-,23-/m0/s1	SOARVSRWKWCBLL-FTJYFCJYSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@H](CO)O2	BroadT	BRD-K38998914	BRD-K38998914-001-01-9	Broad Institute of MIT and Harvard	BRD-K38998914			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCC4)cc23)[C@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19+,21-,23-/m0/s1	SOARVSRWKWCBLL-FTJYFCJYSA-N	443.242021186							99411
BRD-K84098240	LSM-13568		54646383	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19+,21-,23-/m0/s1	ALHQUDNRSCILRO-FTJYFCJYSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1	BroadT	BRD-K84098240	BRD-K84098240-001-01-6	Broad Institute of MIT and Harvard	BRD-K84098240			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@H](CO)O1	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19+,21-,23-/m0/s1	ALHQUDNRSCILRO-FTJYFCJYSA-N	445.25767125							102210
BRD-K57218099	LSM-11896		54646192	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26+,28+/m0/s1	CRNISVWSFUFTQR-QUPYCJFYSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@@H](CO)O2	BroadT	BRD-K57218099	BRD-K57218099-001-01-5	Broad Institute of MIT and Harvard	BRD-K57218099			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26+,28+/m0/s1	CRNISVWSFUFTQR-QUPYCJFYSA-N	556.167950178							100522
CHEMBL2356253	LSM-9759	BRD-K22002407, SID131442684	54646310	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26-,28+/m1/s1	UQAGOAYYXRCKNS-GUSOMZPTSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NCc5ccccc5F)C[C@@H]4c3c2	BroadT	BRD-K22002407	BRD-K22002407-001-01-2	Broad Institute of MIT and Harvard	BRD-K22002407			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26-,28+/m1/s1	UQAGOAYYXRCKNS-GUSOMZPTSA-N	556.167950178							98380
BRD-K24992635	LSM-9947		54646413	InChI=1S/C25H30N2O4/c1-26(2)18-7-8-22-20(11-18)21-12-19(30-23(15-28)25(21)31-22)13-24(29)27-10-9-16-5-3-4-6-17(16)14-27/h3-8,11,19,21,23,25,28H,9-10,12-15H2,1-2H3/t19-,21+,23-,25-/m0/s1	QQFBCVYCCQBHCE-PYTYSOFPSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)N4CCc5ccccc5C4)C[C@@H]3c2c1	BroadT	BRD-K24992635	BRD-K24992635-001-01-6	Broad Institute of MIT and Harvard	BRD-K24992635			CN(C)c1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O4/c1-26(2)18-7-8-22-20(11-18)21-12-19(30-23(15-28)25(21)31-22)13-24(29)27-10-9-16-5-3-4-6-17(16)14-27/h3-8,11,19,21,23,25,28H,9-10,12-15H2,1-2H3/t19-,21+,23-,25-/m0/s1	QQFBCVYCCQBHCE-PYTYSOFPSA-N	422.22055746							98568
BRD-K57766779	LSM-11925		54646181	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22+,25+,27-/m1/s1	FSAONXZLMNAVLZ-ISSPKVJFSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCOCC5)cc34)[C@H](CO)O2	BroadT	BRD-K57766779	BRD-K57766779-001-01-0	Broad Institute of MIT and Harvard	BRD-K57766779			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22+,25+,27-/m1/s1	FSAONXZLMNAVLZ-ISSPKVJFSA-N	510.236601448							100551
BRD-K64700664	LSM-12383		54646365	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18+,20+,22-/m1/s1	LWPDCVYPXSZOFH-DCZASFAJSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(Cl)cc4)C[C@H]3c2c1	BroadT	BRD-K64700664	BRD-K64700664-001-01-8	Broad Institute of MIT and Harvard	BRD-K64700664			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18+,20+,22-/m1/s1	LWPDCVYPXSZOFH-DCZASFAJSA-N	480.11218494							101010
BRD-K06912584	LSM-8840		54646129	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21-,23-,25+/m1/s1	CCIDSNZUNACLPU-YTAKYCMFSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K06912584	BRD-K06912584-001-01-7	Broad Institute of MIT and Harvard	BRD-K06912584			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21-,23-,25+/m1/s1	CCIDSNZUNACLPU-YTAKYCMFSA-N	465.226371122							97461
BRD-K39177148	LSM-10808		54646252	InChI=1S/C29H28FN3O7/c30-21-3-1-2-4-22(21)33-29(36)32-17-6-8-23-19(10-17)20-11-18(39-26(14-34)28(20)40-23)12-27(35)31-13-16-5-7-24-25(9-16)38-15-37-24/h1-10,18,20,26,28,34H,11-15H2,(H,31,35)(H2,32,33,36)/t18-,20-,26+,28+/m1/s1	QUTKLMAKSFRFCA-XZTJJTLLSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K39177148	BRD-K39177148-001-01-7	Broad Institute of MIT and Harvard	BRD-K39177148			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H28FN3O7/c30-21-3-1-2-4-22(21)33-29(36)32-17-6-8-23-19(10-17)20-11-18(39-26(14-34)28(20)40-23)12-27(35)31-13-16-5-7-24-25(9-16)38-15-37-24/h1-10,18,20,26,28,34H,11-15H2,(H,31,35)(H2,32,33,36)/t18-,20-,26+,28+/m1/s1	QUTKLMAKSFRFCA-XZTJJTLLSA-N	549.191128466							99429
BRD-K07616985	LSM-8887		54646309	InChI=1S/C29H31N3O6/c1-36-24-5-3-2-4-19(24)16-31-27(34)15-21-14-23-22-13-20(32-28(35)12-18-8-10-30-11-9-18)6-7-25(22)38-29(23)26(17-33)37-21/h2-11,13,21,23,26,29,33H,12,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,26-,29-/m0/s1	ZGXOXQUBSYKGRY-OMUOKKHMSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Cc5ccncc5)cc34)[C@H](CO)O2	BroadT	BRD-K07616985	BRD-K07616985-001-01-8	Broad Institute of MIT and Harvard	BRD-K07616985			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1	InChI=1S/C29H31N3O6/c1-36-24-5-3-2-4-19(24)16-31-27(34)15-21-14-23-22-13-20(32-28(35)12-18-8-10-30-11-9-18)6-7-25(22)38-29(23)26(17-33)37-21/h2-11,13,21,23,26,29,33H,12,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,26-,29-/m0/s1	ZGXOXQUBSYKGRY-OMUOKKHMSA-N	517.221285742							97508
BRD-K17450769	LSM-9477		54646287	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20+,24-,26-/m0/s1	GAKFIKLLFOVZGV-DZVUWMEYSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K17450769	BRD-K17450769-001-01-2	Broad Institute of MIT and Harvard	BRD-K17450769			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20+,24-,26-/m0/s1	GAKFIKLLFOVZGV-DZVUWMEYSA-N	497.232599354							98098
BRD-K36618304	LSM-10640		54646153	InChI=1S/C24H30N2O4/c1-26(2)17-8-9-21-19(12-17)20-13-18(29-22(15-27)24(20)30-21)14-23(28)25-11-10-16-6-4-3-5-7-16/h3-9,12,18,20,22,24,27H,10-11,13-15H2,1-2H3,(H,25,28)/t18-,20-,22+,24+/m1/s1	VTJOJCWIVRUFJE-NROSNUSPSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCCc4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K36618304	BRD-K36618304-001-01-3	Broad Institute of MIT and Harvard	BRD-K36618304			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCCc4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C24H30N2O4/c1-26(2)17-8-9-21-19(12-17)20-13-18(29-22(15-27)24(20)30-21)14-23(28)25-11-10-16-6-4-3-5-7-16/h3-9,12,18,20,22,24,27H,10-11,13-15H2,1-2H3,(H,25,28)/t18-,20-,22+,24+/m1/s1	VTJOJCWIVRUFJE-NROSNUSPSA-N	410.22055746							99261
BRD-K93691156	LSM-14176		54646435	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15-,17-,20+/m1/s1	ZWJVDCAUIXXXGX-PCFVDWANSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)COC)cc23)[C@@H](CO)O1	BroadT	BRD-K93691156	BRD-K93691156-001-01-9	Broad Institute of MIT and Harvard	BRD-K93691156			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)COC)cc23)[C@@H](CO)O1	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15-,17-,20+/m1/s1	ZWJVDCAUIXXXGX-PCFVDWANSA-N	392.194736636							102830
BRD-K95133676	LSM-14258		54646138	InChI=1S/C30H30N2O8/c1-36-23-5-3-2-4-18(23)14-31-28(34)13-20-12-22-21-11-19(7-9-24(21)40-29(22)27(15-33)39-20)32-30(35)17-6-8-25-26(10-17)38-16-37-25/h2-11,20,22,27,29,33H,12-16H2,1H3,(H,31,34)(H,32,35)/t20-,22+,27+,29-/m0/s1	IQCMSFSSZNINGU-MFJYUDLCSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@@H](CO)O2	BroadT	BRD-K95133676	BRD-K95133676-001-01-1	Broad Institute of MIT and Harvard	BRD-K95133676			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C30H30N2O8/c1-36-23-5-3-2-4-18(23)14-31-28(34)13-20-12-22-21-11-19(7-9-24(21)40-29(22)27(15-33)39-20)32-30(35)17-6-8-25-26(10-17)38-16-37-25/h2-11,20,22,27,29,33H,12-16H2,1H3,(H,31,34)(H,32,35)/t20-,22+,27+,29-/m0/s1	IQCMSFSSZNINGU-MFJYUDLCSA-N	546.20021594							102912
BRD-K38589987	LSM-10769		54646161	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23-,25+,28+/m1/s1	FBZDSUDTYUQYGJ-NDZQKZDNSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K38589987	BRD-K38589987-001-01-8	Broad Institute of MIT and Harvard	BRD-K38589987			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23-,25+,28+/m1/s1	FBZDSUDTYUQYGJ-NDZQKZDNSA-N	508.268570292							99390
BRD-K67348888	LSM-12529		54646279	InChI=1S/C20H28N2O4/c1-22(2)13-5-6-17-15(7-13)16-8-14(25-18(11-23)20(16)26-17)9-19(24)21-10-12-3-4-12/h5-7,12,14,16,18,20,23H,3-4,8-11H2,1-2H3,(H,21,24)/t14-,16+,18-,20-/m1/s1	JLJMCVQNTFDIRA-IHMNZUQTSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K67348888	BRD-K67348888-001-01-3	Broad Institute of MIT and Harvard	BRD-K67348888			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C20H28N2O4/c1-22(2)13-5-6-17-15(7-13)16-8-14(25-18(11-23)20(16)26-17)9-19(24)21-10-12-3-4-12/h5-7,12,14,16,18,20,23H,3-4,8-11H2,1-2H3,(H,21,24)/t14-,16+,18-,20-/m1/s1	JLJMCVQNTFDIRA-IHMNZUQTSA-N	360.204907396							101160
BRD-K53959928	LSM-11711		54646353	InChI=1S/C28H27F3N4O5/c29-28(30,31)17-3-5-18(6-4-17)34-27(38)35-19-7-8-23-21(10-19)22-11-20(39-24(15-36)26(22)40-23)12-25(37)33-14-16-2-1-9-32-13-16/h1-10,13,20,22,24,26,36H,11-12,14-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24-,26+/m0/s1	IMICHJYMUCZKDW-IFPZXYOKSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K53959928	BRD-K53959928-001-01-5	Broad Institute of MIT and Harvard	BRD-K53959928			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)17-3-5-18(6-4-17)34-27(38)35-19-7-8-23-21(10-19)22-11-20(39-24(15-36)26(22)40-23)12-25(37)33-14-16-2-1-9-32-13-16/h1-10,13,20,22,24,26,36H,11-12,14-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24-,26+/m0/s1	IMICHJYMUCZKDW-IFPZXYOKSA-N	556.193354604							100336
BRD-K50938873	LSM-11536		54646339	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21+,24+,26-/m1/s1	UVPONYOZSFJNDG-ZHRNDHIYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K50938873	BRD-K50938873-001-01-7	Broad Institute of MIT and Harvard	BRD-K50938873			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21+,24+,26-/m1/s1	UVPONYOZSFJNDG-ZHRNDHIYSA-N	516.2071931							100159
BRD-K68178066	LSM-12584		54646135	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21-,23+,25+/m1/s1	CCIDSNZUNACLPU-ASASOQJESA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K68178066	BRD-K68178066-001-01-7	Broad Institute of MIT and Harvard	BRD-K68178066			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21-,23+,25+/m1/s1	CCIDSNZUNACLPU-ASASOQJESA-N	465.226371122							101215
BRD-K09845534	LSM-9030		54646212	InChI=1S/C24H23F3N2O7/c25-24(26,27)10-28-21(31)8-14-7-16-15-6-13(2-4-17(15)36-22(16)20(9-30)35-14)29-23(32)12-1-3-18-19(5-12)34-11-33-18/h1-6,14,16,20,22,30H,7-11H2,(H,28,31)(H,29,32)/t14-,16-,20+,22+/m1/s1	IXBLMXNUAYKSQM-ZTVUFDKISA-N	OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K09845534	BRD-K09845534-001-01-7	Broad Institute of MIT and Harvard	BRD-K09845534			OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C24H23F3N2O7/c25-24(26,27)10-28-21(31)8-14-7-16-15-6-13(2-4-17(15)36-22(16)20(9-30)35-14)29-23(32)12-1-3-18-19(5-12)34-11-33-18/h1-6,14,16,20,22,30H,7-11H2,(H,28,31)(H,29,32)/t14-,16-,20+,22+/m1/s1	IXBLMXNUAYKSQM-ZTVUFDKISA-N	508.145735696							97651
BRD-K72966614	LSM-12894		54646164	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19+,21+,23-/m0/s1	SOARVSRWKWCBLL-GBPFJNKXSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@@H](CO)O2	BroadT	BRD-K72966614	BRD-K72966614-001-01-6	Broad Institute of MIT and Harvard	BRD-K72966614			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCC4)cc23)[C@@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19+,21+,23-/m0/s1	SOARVSRWKWCBLL-GBPFJNKXSA-N	443.242021186							101531
BRD-K90848748	LSM-14020		54646215	InChI=1S/C16H21NO5/c1-17(2)9-3-4-13-11(5-9)12-6-10(7-15(19)20)21-14(8-18)16(12)22-13/h3-5,10,12,14,16,18H,6-8H2,1-2H3,(H,19,20)/t10-,12+,14+,16-/m1/s1	MUGALHVVQCOZES-IFXMJZAHSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)O)C[C@H]3c2c1	BroadT	BRD-K90848748	BRD-K90848748-001-01-3	Broad Institute of MIT and Harvard	BRD-K90848748			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(O)=O)O[C@H]3CO)c2c1	InChI=1S/C16H21NO5/c1-17(2)9-3-4-13-11(5-9)12-6-10(7-15(19)20)21-14(8-18)16(12)22-13/h3-5,10,12,14,16,18H,6-8H2,1-2H3,(H,19,20)/t10-,12+,14+,16-/m1/s1	MUGALHVVQCOZES-IFXMJZAHSA-N	307.141972782							102673
BRD-K21796872	LSM-9752		54646419	InChI=1S/C28H28FN3O5/c29-19-3-1-2-18(10-19)15-31-26(34)14-21-13-23-22-12-20(32-27(35)11-17-6-8-30-9-7-17)4-5-24(22)37-28(23)25(16-33)36-21/h1-10,12,21,23,25,28,33H,11,13-16H2,(H,31,34)(H,32,35)/t21-,23+,25-,28-/m0/s1	JTKPUOMASGTZAW-JWVZEJEHSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K21796872	BRD-K21796872-001-01-6	Broad Institute of MIT and Harvard	BRD-K21796872			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H28FN3O5/c29-19-3-1-2-18(10-19)15-31-26(34)14-21-13-23-22-12-20(32-27(35)11-17-6-8-30-9-7-17)4-5-24(22)37-28(23)25(16-33)36-21/h1-10,12,21,23,25,28,33H,11,13-16H2,(H,31,34)(H,32,35)/t21-,23+,25-,28-/m0/s1	JTKPUOMASGTZAW-JWVZEJEHSA-N	505.201299226							98373
BRD-K96557209-001-01-6	LSM-31512	BRD-K96557209	54646319	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)30-12-10-18-5-2-1-3-6-18)22-13-20(8-9-24(22)36-27)31-28(34)19-7-4-11-29-16-19/h1-9,11,13,16,21,23,25,27,32H,10,12,14-15,17H2,(H,30,33)(H,31,34)/t21-,23-,25-,27+/m0/s1	ZFEMWODPVTXMHX-NTYBTQPHSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K96557209	BRD-K96557209-001-01-6	Broad Institute of MIT and Harvard	BRD-K96557209			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)30-12-10-18-5-2-1-3-6-18)22-13-20(8-9-24(22)36-27)31-28(34)19-7-4-11-29-16-19/h1-9,11,13,16,21,23,25,27,32H,10,12,14-15,17H2,(H,30,33)(H,31,34)/t21-,23-,25-,27+/m0/s1	ZFEMWODPVTXMHX-NTYBTQPHSA-N	487.210721058							120069
BRD-K63523728	LSM-12297		54646178	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22-,25-,27+/m1/s1	FSAONXZLMNAVLZ-GKYRZQBGSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCOCC5)cc34)[C@@H](CO)O2	BroadT	BRD-K63523728	BRD-K63523728-001-01-9	Broad Institute of MIT and Harvard	BRD-K63523728			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22-,25-,27+/m1/s1	FSAONXZLMNAVLZ-GKYRZQBGSA-N	510.236601448							100924
BRD-K40959762	LSM-10920		54646266	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23+,25-,27-/m0/s1	VIZOEWJOWGMLTK-HFFYFMGZSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K40959762	BRD-K40959762-001-01-0	Broad Institute of MIT and Harvard	BRD-K40959762			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23+,25-,27-/m0/s1	VIZOEWJOWGMLTK-HFFYFMGZSA-N	508.268570292							99541
BRD-K02876750	LSM-8614		54646149	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16-,18+,20+/m1/s1	BEWGTMHICYCEOA-BIJSTVTOSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NC4CCCC4)C[C@@H]3c2c1	BroadT	BRD-K02876750	BRD-K02876750-001-01-6	Broad Institute of MIT and Harvard	BRD-K02876750			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NC4CCCC4)O[C@H]3CO)c2c1	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16-,18+,20+/m1/s1	BEWGTMHICYCEOA-BIJSTVTOSA-N	424.166807326							97235
BRD-K89599747	LSM-13952		54646386	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12-,14-,16+/m1/s1	STSQWNRYWIJNCW-AEKOTVAKSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K89599747	BRD-K89599747-001-01-6	Broad Institute of MIT and Harvard	BRD-K89599747			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12-,14-,16+/m1/s1	STSQWNRYWIJNCW-AEKOTVAKSA-N	371.103872712							102605
BRD-K19742528	LSM-9622		54646328	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24+,26-,28-/m0/s1	AJGJMULVCJFZBU-BQGAEBSMSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K19742528	BRD-K19742528-001-01-2	Broad Institute of MIT and Harvard	BRD-K19742528			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24+,26-,28-/m0/s1	AJGJMULVCJFZBU-BQGAEBSMSA-N	506.241686828							98243
BRD-K14509209	LSM-9310		54646323	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24-,26-,28+/m1/s1	AJGJMULVCJFZBU-HXCADUBKSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K14509209	BRD-K14509209-001-01-6	Broad Institute of MIT and Harvard	BRD-K14509209			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24-,26-,28+/m1/s1	AJGJMULVCJFZBU-HXCADUBKSA-N	506.241686828							97931
BRD-K62117749	LSM-12197		54646399	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24+,26+/m0/s1	XBPCNRNKOXKUQA-LFSKCEFNSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K62117749	BRD-K62117749-001-01-6	Broad Institute of MIT and Harvard	BRD-K62117749			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24+,26+/m0/s1	XBPCNRNKOXKUQA-LFSKCEFNSA-N	464.231122144							100823
BRD-K65913932	LSM-12448		54646348	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22+,24-,26-/m1/s1	OQZDFPDHTDCUCP-FWSIMYTDSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)N5CCN(C)CC5)C[C@H]4c3c2)cc1	BroadT	BRD-K65913932	BRD-K65913932-001-01-2	Broad Institute of MIT and Harvard	BRD-K65913932			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)N5CCN(C)CC5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22+,24-,26-/m1/s1	OQZDFPDHTDCUCP-FWSIMYTDSA-N	510.247834848							101076
BRD-K02206783	LSM-8568		54646163	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19-,21-,23+/m0/s1	SOARVSRWKWCBLL-RAKJYXHLSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@H](CO)O2	BroadT	BRD-K02206783	BRD-K02206783-001-01-7	Broad Institute of MIT and Harvard	BRD-K02206783			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCC4)cc23)[C@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19-,21-,23+/m0/s1	SOARVSRWKWCBLL-RAKJYXHLSA-N	443.242021186							97189
BRD-K57476317	LSM-11905		54646159	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23+,25-,28-/m0/s1	FBZDSUDTYUQYGJ-JWVZEJEHSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K57476317	BRD-K57476317-001-01-5	Broad Institute of MIT and Harvard	BRD-K57476317			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23+,25-,28-/m0/s1	FBZDSUDTYUQYGJ-JWVZEJEHSA-N	508.268570292							100531
BRD-K75061326	LSM-13025		54646351	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22-,24+,26+/m1/s1	OQZDFPDHTDCUCP-GUAAGHCTSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)N5CCN(C)CC5)C[C@@H]4c3c2)cc1	BroadT	BRD-K75061326	BRD-K75061326-001-01-2	Broad Institute of MIT and Harvard	BRD-K75061326			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)N5CCN(C)CC5)O[C@H]4CO)c3c2)cc1	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22-,24+,26+/m1/s1	OQZDFPDHTDCUCP-GUAAGHCTSA-N	510.247834848							101662
BRD-K24977302	LSM-9945		54646334	InChI=1S/C23H35N3O4/c1-25(2)16-6-7-20-18(12-16)19-13-17(29-21(15-27)23(19)30-20)14-22(28)24-8-11-26-9-4-3-5-10-26/h6-7,12,17,19,21,23,27H,3-5,8-11,13-15H2,1-2H3,(H,24,28)/t17-,19-,21+,23+/m0/s1	HWEAQBDEOFZYHR-VARILPKDSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCCN4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K24977302	BRD-K24977302-001-01-9	Broad Institute of MIT and Harvard	BRD-K24977302			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCCN4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C23H35N3O4/c1-25(2)16-6-7-20-18(12-16)19-13-17(29-21(15-27)23(19)30-20)14-22(28)24-8-11-26-9-4-3-5-10-26/h6-7,12,17,19,21,23,27H,3-5,8-11,13-15H2,1-2H3,(H,24,28)/t17-,19-,21+,23+/m0/s1	HWEAQBDEOFZYHR-VARILPKDSA-N	417.26275663							98566
BRD-K97235918	LSM-14404		54646134	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21-,23+,25+/m0/s1	CCIDSNZUNACLPU-FEGXGRLVSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K97235918	BRD-K97235918-001-01-0	Broad Institute of MIT and Harvard	BRD-K97235918			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21-,23+,25+/m0/s1	CCIDSNZUNACLPU-FEGXGRLVSA-N	465.226371122							103058
BRD-K24242444	LSM-9896		54646378	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19-,21-,23+/m1/s1	ALHQUDNRSCILRO-LHWDRQQYSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K24242444	BRD-K24242444-001-01-7	Broad Institute of MIT and Harvard	BRD-K24242444			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19-,21-,23+/m1/s1	ALHQUDNRSCILRO-LHWDRQQYSA-N	445.25767125							98517
BRD-K33881003	LSM-10480		54646417	InChI=1S/C28H28FN3O5/c29-19-3-1-2-18(10-19)15-31-26(34)14-21-13-23-22-12-20(32-27(35)11-17-6-8-30-9-7-17)4-5-24(22)37-28(23)25(16-33)36-21/h1-10,12,21,23,25,28,33H,11,13-16H2,(H,31,34)(H,32,35)/t21-,23+,25+,28-/m1/s1	JTKPUOMASGTZAW-IBFWWDTPSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K33881003	BRD-K33881003-001-01-4	Broad Institute of MIT and Harvard	BRD-K33881003			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H28FN3O5/c29-19-3-1-2-18(10-19)15-31-26(34)14-21-13-23-22-12-20(32-27(35)11-17-6-8-30-9-7-17)4-5-24(22)37-28(23)25(16-33)36-21/h1-10,12,21,23,25,28,33H,11,13-16H2,(H,31,34)(H,32,35)/t21-,23+,25+,28-/m1/s1	JTKPUOMASGTZAW-IBFWWDTPSA-N	505.201299226							99101
BRD-K62657501	LSM-12232		54646202	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19-,21+/m0/s1	JZVGIVMTJSWJDH-WRGRXTPVSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccn4)C[C@H]3c2c1	BroadT	BRD-K62657501	BRD-K62657501-001-01-9	Broad Institute of MIT and Harvard	BRD-K62657501			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccn4)O[C@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19-,21+/m0/s1	JZVGIVMTJSWJDH-WRGRXTPVSA-N	447.14640624							100858
BRD-K53914319	LSM-11705		54646182	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22+,25-,27-/m1/s1	FSAONXZLMNAVLZ-IIKILRQQSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCOCC5)cc34)[C@@H](CO)O2	BroadT	BRD-K53914319	BRD-K53914319-001-01-7	Broad Institute of MIT and Harvard	BRD-K53914319			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22+,25-,27-/m1/s1	FSAONXZLMNAVLZ-IIKILRQQSA-N	510.236601448							100330
BRD-K51266459	LSM-11565		54646190	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26-,28-/m1/s1	CRNISVWSFUFTQR-SJPQFPLUSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@@H](CO)O2	BroadT	BRD-K51266459	BRD-K51266459-001-01-4	Broad Institute of MIT and Harvard	BRD-K51266459			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26-,28-/m1/s1	CRNISVWSFUFTQR-SJPQFPLUSA-N	556.167950178							100188
BRD-K51368089	LSM-11573		54646145	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16+,18+,20-/m1/s1	BEWGTMHICYCEOA-VKSDOSABSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NC4CCCC4)C[C@H]3c2c1	BroadT	BRD-K51368089	BRD-K51368089-001-01-6	Broad Institute of MIT and Harvard	BRD-K51368089			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NC4CCCC4)O[C@H]3CO)c2c1	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16+,18+,20-/m1/s1	BEWGTMHICYCEOA-VKSDOSABSA-N	424.166807326							100196
BRD-K94554079	LSM-14222		54646150	InChI=1S/C24H30N2O4/c1-26(2)17-8-9-21-19(12-17)20-13-18(29-22(15-27)24(20)30-21)14-23(28)25-11-10-16-6-4-3-5-7-16/h3-9,12,18,20,22,24,27H,10-11,13-15H2,1-2H3,(H,25,28)/t18-,20-,22-,24+/m1/s1	VTJOJCWIVRUFJE-YWWGLXIYSA-N	CN(C)c1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCCc4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K94554079	BRD-K94554079-001-01-2	Broad Institute of MIT and Harvard	BRD-K94554079			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCCc4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C24H30N2O4/c1-26(2)17-8-9-21-19(12-17)20-13-18(29-22(15-27)24(20)30-21)14-23(28)25-11-10-16-6-4-3-5-7-16/h3-9,12,18,20,22,24,27H,10-11,13-15H2,1-2H3,(H,25,28)/t18-,20-,22-,24+/m1/s1	VTJOJCWIVRUFJE-YWWGLXIYSA-N	410.22055746							102876
BRD-K23701529	LSM-9855		54646421	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18-,20-,23+/m1/s1	MRLAOALNSBFOMY-WVVHNUNQSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)N4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K23701529	BRD-K23701529-001-01-1	Broad Institute of MIT and Harvard	BRD-K23701529			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18-,20-,23+/m1/s1	MRLAOALNSBFOMY-WVVHNUNQSA-N	431.242021186							98476
BRD-K10768305	LSM-9080		54646206	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19+,21+/m0/s1	JZVGIVMTJSWJDH-ICSUOEFDSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccccn4)C[C@H]3c2c1	BroadT	BRD-K10768305	BRD-K10768305-001-01-5	Broad Institute of MIT and Harvard	BRD-K10768305			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccccn4)O[C@@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17-,19+,21+/m0/s1	JZVGIVMTJSWJDH-ICSUOEFDSA-N	447.14640624							97701
BRD-K29809218	LSM-10237		54646422	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18-,20-,23+/m0/s1	MRLAOALNSBFOMY-LUFCQUEKSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)N4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K29809218	BRD-K29809218-001-01-2	Broad Institute of MIT and Harvard	BRD-K29809218			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18-,20-,23+/m0/s1	MRLAOALNSBFOMY-LUFCQUEKSA-N	431.242021186							98858
BRD-K85200143	LSM-13636		54646344	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22-,24-,26+/m1/s1	OQZDFPDHTDCUCP-DFICYWPVSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)N5CCN(C)CC5)C[C@@H]4c3c2)cc1	BroadT	BRD-K85200143	BRD-K85200143-001-01-5	Broad Institute of MIT and Harvard	BRD-K85200143			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)N5CCN(C)CC5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22-,24-,26+/m1/s1	OQZDFPDHTDCUCP-DFICYWPVSA-N	510.247834848							102283
BRD-K58052247	LSM-11935		54646295	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22+,25-,27-/m0/s1	ZUHKGHKDCFDVCR-BUZLNKNLSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K58052247	BRD-K58052247-001-01-8	Broad Institute of MIT and Harvard	BRD-K58052247			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22+,25-,27-/m0/s1	ZUHKGHKDCFDVCR-BUZLNKNLSA-N	591.179261962							100561
BRD-K84856528	LSM-13614		54646121	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15-,17+,20+/m0/s1	ZWJVDCAUIXXXGX-BQCJVYABSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)COC)cc23)[C@@H](CO)O1	BroadT	BRD-K84856528	BRD-K84856528-001-01-0	Broad Institute of MIT and Harvard	BRD-K84856528			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)COC)cc23)[C@@H](CO)O1	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15-,17+,20+/m0/s1	ZWJVDCAUIXXXGX-BQCJVYABSA-N	392.194736636							102260
BRD-K38121247	LSM-10735		54646254	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21-,25-,27+/m0/s1	FEEKZGTVSGSFLP-GCMLAXDWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K38121247	BRD-K38121247-001-01-6	Broad Institute of MIT and Harvard	BRD-K38121247			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21-,25-,27+/m0/s1	FEEKZGTVSGSFLP-GCMLAXDWSA-N	517.184900234							99356
BRD-K96190924	LSM-14331		54646346	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22+,24+,26-/m0/s1	OQZDFPDHTDCUCP-RXDHMRHRSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)N5CCN(C)CC5)C[C@@H]4c3c2)cc1	BroadT	BRD-K96190924	BRD-K96190924-001-01-0	Broad Institute of MIT and Harvard	BRD-K96190924			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)N5CCN(C)CC5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22+,24+,26-/m0/s1	OQZDFPDHTDCUCP-RXDHMRHRSA-N	510.247834848							102985
BRD-K52780420	LSM-11649		54646322	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)30-12-10-18-5-2-1-3-6-18)22-13-20(8-9-24(22)36-27)31-28(34)19-7-4-11-29-16-19/h1-9,11,13,16,21,23,25,27,32H,10,12,14-15,17H2,(H,30,33)(H,31,34)/t21-,23-,25+,27+/m0/s1	ZFEMWODPVTXMHX-JZEPBHRJSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K52780420	BRD-K52780420-001-01-9	Broad Institute of MIT and Harvard	BRD-K52780420			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)30-12-10-18-5-2-1-3-6-18)22-13-20(8-9-24(22)36-27)31-28(34)19-7-4-11-29-16-19/h1-9,11,13,16,21,23,25,27,32H,10,12,14-15,17H2,(H,30,33)(H,31,34)/t21-,23-,25+,27+/m0/s1	ZFEMWODPVTXMHX-JZEPBHRJSA-N	487.210721058							100274
CHEMBL2356673	LSM-13408	BRD-K81582767, SID131442567	54646193	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26+,28+/m1/s1	CRNISVWSFUFTQR-MSUVVHHUSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@H](CO)O2	BroadT	BRD-K81582767	BRD-K81582767-001-01-5	Broad Institute of MIT and Harvard	BRD-K81582767			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26+,28+/m1/s1	CRNISVWSFUFTQR-MSUVVHHUSA-N	556.167950178							102048
BRD-K82758569	LSM-13481		54646411	InChI=1S/C25H30N2O4/c1-26(2)18-7-8-22-20(11-18)21-12-19(30-23(15-28)25(21)31-22)13-24(29)27-10-9-16-5-3-4-6-17(16)14-27/h3-8,11,19,21,23,25,28H,9-10,12-15H2,1-2H3/t19-,21+,23+,25-/m1/s1	QQFBCVYCCQBHCE-IQKBUIRBSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)N4CCc5ccccc5C4)C[C@H]3c2c1	BroadT	BRD-K82758569	BRD-K82758569-001-01-0	Broad Institute of MIT and Harvard	BRD-K82758569			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O4/c1-26(2)18-7-8-22-20(11-18)21-12-19(30-23(15-28)25(21)31-22)13-24(29)27-10-9-16-5-3-4-6-17(16)14-27/h3-8,11,19,21,23,25,28H,9-10,12-15H2,1-2H3/t19-,21+,23+,25-/m1/s1	QQFBCVYCCQBHCE-IQKBUIRBSA-N	422.22055746							102121
BRD-K36467636	LSM-10631		54646360	InChI=1S/C22H27N3O4/c1-25(2)15-6-7-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-3-4-8-23-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18+,20-,22-/m0/s1	PSRJUTPUZRNONK-UPSSIMKTSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccccn4)C[C@@H]3c2c1	BroadT	BRD-K36467636	BRD-K36467636-001-01-4	Broad Institute of MIT and Harvard	BRD-K36467636			CN(C)c1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccn4)O[C@H]3CO)c2c1	InChI=1S/C22H27N3O4/c1-25(2)15-6-7-19-17(9-15)18-10-16(28-20(13-26)22(18)29-19)11-21(27)24-12-14-5-3-4-8-23-14/h3-9,16,18,20,22,26H,10-13H2,1-2H3,(H,24,27)/t16-,18+,20-,22-/m0/s1	PSRJUTPUZRNONK-UPSSIMKTSA-N	397.200156374							99252
BRD-K73809982	LSM-14918		54646313	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26+,28-/m1/s1	UQAGOAYYXRCKNS-BYAUNOKSSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NCc5ccccc5F)C[C@H]4c3c2	BroadT	BRD-K73809982	BRD-K73809982-001-01-1	Broad Institute of MIT and Harvard	BRD-K73809982			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26+,28-/m1/s1	UQAGOAYYXRCKNS-BYAUNOKSSA-N	556.167950178							103574
BRD-K73558711	LSM-12936		54646270	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25-,27-,29+/m0/s1	FOSRSIPYUZSGIW-HGAMEBRSSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NCCc5ccccc5)C[C@H]4c3c2)cc1	BroadT	BRD-K73558711	BRD-K73558711-001-01-2	Broad Institute of MIT and Harvard	BRD-K73558711			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NCCc5ccccc5)O[C@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25-,27-,29+/m0/s1	FOSRSIPYUZSGIW-HGAMEBRSSA-N	531.236935806							101573
BRD-K64551656	LSM-12372		54646128	InChI=1S/C30H30N2O7/c1-17(18-5-3-2-4-6-18)31-28(34)14-21-13-23-22-12-20(8-10-24(22)39-29(23)27(15-33)38-21)32-30(35)19-7-9-25-26(11-19)37-16-36-25/h2-12,17,21,23,27,29,33H,13-16H2,1H3,(H,31,34)(H,32,35)/t17-,21-,23-,27+,29+/m1/s1	PKVMSJKEIKOOIO-OQSCFJKJSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1)c6ccccc6	BroadT	BRD-K64551656	BRD-K64551656-001-01-5	Broad Institute of MIT and Harvard	BRD-K64551656			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C30H30N2O7/c1-17(18-5-3-2-4-6-18)31-28(34)14-21-13-23-22-12-20(8-10-24(22)39-29(23)27(15-33)38-21)32-30(35)19-7-9-25-26(11-19)37-16-36-25/h2-12,17,21,23,27,29,33H,13-16H2,1H3,(H,31,34)(H,32,35)/t17-,21-,23-,27+,29+/m1/s1	PKVMSJKEIKOOIO-OQSCFJKJSA-N	530.20530132							100999
BRD-K12187358	LSM-9157		54646401	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18-,20-,22-,24+/m1/s1	LSNSUZUVRXFZLV-CDSBBMBDSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K12187358	BRD-K12187358-001-01-2	Broad Institute of MIT and Harvard	BRD-K12187358			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1)c1ccccc1	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18-,20-,22-,24+/m1/s1	LSNSUZUVRXFZLV-CDSBBMBDSA-N	410.22055746							97778
BRD-K82246602	LSM-13455		54646375	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28-,31-/m0/s1	BRDKARYWUSDFKE-SSMOCFHSSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@@H]3c2c1	BroadT	BRD-K82246602	BRD-K82246602-001-01-5	Broad Institute of MIT and Harvard	BRD-K82246602			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(cc4)-c4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28-,31-/m0/s1	BRDKARYWUSDFKE-SSMOCFHSSA-N	529.25767125							102095
BRD-K20469405	LSM-9677		54646210	InChI=1S/C24H23F3N2O7/c25-24(26,27)10-28-21(31)8-14-7-16-15-6-13(2-4-17(15)36-22(16)20(9-30)35-14)29-23(32)12-1-3-18-19(5-12)34-11-33-18/h1-6,14,16,20,22,30H,7-11H2,(H,28,31)(H,29,32)/t14-,16+,20+,22-/m1/s1	IXBLMXNUAYKSQM-BJKXHWDHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K20469405	BRD-K20469405-001-01-7	Broad Institute of MIT and Harvard	BRD-K20469405			OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C24H23F3N2O7/c25-24(26,27)10-28-21(31)8-14-7-16-15-6-13(2-4-17(15)36-22(16)20(9-30)35-14)29-23(32)12-1-3-18-19(5-12)34-11-33-18/h1-6,14,16,20,22,30H,7-11H2,(H,28,31)(H,29,32)/t14-,16+,20+,22-/m1/s1	IXBLMXNUAYKSQM-BJKXHWDHSA-N	508.145735696							98298
BRD-K88968998	LSM-13901		54646258	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21+,25-,27-/m0/s1	FEEKZGTVSGSFLP-OSHLHTJISA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K88968998	BRD-K88968998-001-01-0	Broad Institute of MIT and Harvard	BRD-K88968998			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21+,25-,27-/m0/s1	FEEKZGTVSGSFLP-OSHLHTJISA-N	517.184900234							102554
BRD-K22123421	LSM-9768		54646380	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19+,21+,23-/m0/s1	ALHQUDNRSCILRO-GBPFJNKXSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K22123421	BRD-K22123421-001-01-8	Broad Institute of MIT and Harvard	BRD-K22123421			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19+,21+,23-/m0/s1	ALHQUDNRSCILRO-GBPFJNKXSA-N	445.25767125							98389
BRD-K25094041	LSM-9954		54646405	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18-,20+,22-,24-/m0/s1	LSNSUZUVRXFZLV-KGELDTGKSA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K25094041	BRD-K25094041-001-01-8	Broad Institute of MIT and Harvard	BRD-K25094041			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1)c1ccccc1	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18-,20+,22-,24-/m0/s1	LSNSUZUVRXFZLV-KGELDTGKSA-N	410.22055746							98575
BRD-K63843509	LSM-12320		54646394	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24-,26+/m0/s1	XBPCNRNKOXKUQA-IFPZXYOKSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K63843509	BRD-K63843509-001-01-6	Broad Institute of MIT and Harvard	BRD-K63843509			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24-,26+/m0/s1	XBPCNRNKOXKUQA-IFPZXYOKSA-N	464.231122144							100947
CHEMBL2361558	LSM-14308	SID131442594, BRD-K95880106	54646220	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25+,27+,29-/m1/s1	MRJCPWMBHXTRFB-KYYACDKCSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@H]3c2c1	BroadT	BRD-K95880106	BRD-K95880106-001-01-7	Broad Institute of MIT and Harvard	BRD-K95880106			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@H]3CO)c2c1	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25+,27+,29-/m1/s1	MRJCPWMBHXTRFB-KYYACDKCSA-N	488.231122144							102962
BRD-K19084671	LSM-9576		54646342	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21-,24+,26+/m0/s1	UVPONYOZSFJNDG-FBNDAJROSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K19084671	BRD-K19084671-001-01-4	Broad Institute of MIT and Harvard	BRD-K19084671			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21-,24+,26+/m0/s1	UVPONYOZSFJNDG-FBNDAJROSA-N	516.2071931							98197
BRD-K55681488	LSM-11801		54646326	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24+,26+,28-/m1/s1	AJGJMULVCJFZBU-PWKYGKGFSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K55681488	BRD-K55681488-001-01-5	Broad Institute of MIT and Harvard	BRD-K55681488			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24+,26+,28-/m1/s1	AJGJMULVCJFZBU-PWKYGKGFSA-N	506.241686828							100426
BRD-K99915395	LSM-14569		54646409	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18+,20+,22-,24-/m0/s1	LSNSUZUVRXFZLV-PSKGUGQPSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K99915395	BRD-K99915395-001-01-7	Broad Institute of MIT and Harvard	BRD-K99915395			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1)c1ccccc1	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18+,20+,22-,24-/m0/s1	LSNSUZUVRXFZLV-PSKGUGQPSA-N	410.22055746							103225
BRD-K15318079	LSM-9345		54646436	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15-,17-,20+/m0/s1	ZWJVDCAUIXXXGX-NUADTHGBSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)COC)cc23)[C@H](CO)O1	BroadT	BRD-K15318079	BRD-K15318079-001-01-8	Broad Institute of MIT and Harvard	BRD-K15318079			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)COC)cc23)[C@H](CO)O1	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15-,17-,20+/m0/s1	ZWJVDCAUIXXXGX-NUADTHGBSA-N	392.194736636							97966
BRD-K20822925	LSM-9696		54646208	InChI=1S/C24H23F3N2O7/c25-24(26,27)10-28-21(31)8-14-7-16-15-6-13(2-4-17(15)36-22(16)20(9-30)35-14)29-23(32)12-1-3-18-19(5-12)34-11-33-18/h1-6,14,16,20,22,30H,7-11H2,(H,28,31)(H,29,32)/t14-,16-,20-,22+/m1/s1	IXBLMXNUAYKSQM-YKHKRFOZSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23	BroadT	BRD-K20822925	BRD-K20822925-001-01-8	Broad Institute of MIT and Harvard	BRD-K20822925			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C24H23F3N2O7/c25-24(26,27)10-28-21(31)8-14-7-16-15-6-13(2-4-17(15)36-22(16)20(9-30)35-14)29-23(32)12-1-3-18-19(5-12)34-11-33-18/h1-6,14,16,20,22,30H,7-11H2,(H,28,31)(H,29,32)/t14-,16-,20-,22+/m1/s1	IXBLMXNUAYKSQM-YKHKRFOZSA-N	508.145735696							98317
BRD-K46003436	LSM-11231		54646293	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22+,25+,27-/m1/s1	ZUHKGHKDCFDVCR-ISSPKVJFSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K46003436	BRD-K46003436-001-01-7	Broad Institute of MIT and Harvard	BRD-K46003436			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22+,25+,27-/m1/s1	ZUHKGHKDCFDVCR-ISSPKVJFSA-N	591.179261962							99852
BRD-K20604601	LSM-9682		54646304	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25-,27+,30+/m0/s1	ZUSAVEKAEPAMKG-VPCZVLKOSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Cc6ccncc6)cc45	BroadT	BRD-K20604601	BRD-K20604601-001-01-1	Broad Institute of MIT and Harvard	BRD-K20604601			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25-,27+,30+/m0/s1	ZUSAVEKAEPAMKG-VPCZVLKOSA-N	513.226371122							98303
BRD-K91449148	LSM-14047		54646356	InChI=1S/C28H27F3N4O5/c29-28(30,31)17-3-5-18(6-4-17)34-27(38)35-19-7-8-23-21(10-19)22-11-20(39-24(15-36)26(22)40-23)12-25(37)33-14-16-2-1-9-32-13-16/h1-10,13,20,22,24,26,36H,11-12,14-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24-,26-/m0/s1	IMICHJYMUCZKDW-YXOQKGKWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K91449148	BRD-K91449148-001-01-5	Broad Institute of MIT and Harvard	BRD-K91449148			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)17-3-5-18(6-4-17)34-27(38)35-19-7-8-23-21(10-19)22-11-20(39-24(15-36)26(22)40-23)12-25(37)33-14-16-2-1-9-32-13-16/h1-10,13,20,22,24,26,36H,11-12,14-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24-,26-/m0/s1	IMICHJYMUCZKDW-YXOQKGKWSA-N	556.193354604							102700
BRD-K71249580	LSM-12780		54646382	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19+,21-,23-/m1/s1	ALHQUDNRSCILRO-GUBFDYSESA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K71249580	BRD-K71249580-001-01-8	Broad Institute of MIT and Harvard	BRD-K71249580			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19+,21-,23-/m1/s1	ALHQUDNRSCILRO-GUBFDYSESA-N	445.25767125							101417
BRD-K27679491	LSM-10095		54646229	InChI=1S/C26H32N4O5/c31-15-23-25-21(12-19(34-23)13-24(32)28-14-16-7-9-27-10-8-16)20-11-18(5-6-22(20)35-25)30-26(33)29-17-3-1-2-4-17/h5-11,17,19,21,23,25,31H,1-4,12-15H2,(H,28,32)(H2,29,30,33)/t19-,21-,23+,25+/m0/s1	CSQKNNUUWCECGY-FEGXGRLVSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K27679491	BRD-K27679491-001-01-9	Broad Institute of MIT and Harvard	BRD-K27679491			OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C26H32N4O5/c31-15-23-25-21(12-19(34-23)13-24(32)28-14-16-7-9-27-10-8-16)20-11-18(5-6-22(20)35-25)30-26(33)29-17-3-1-2-4-17/h5-11,17,19,21,23,25,31H,1-4,12-15H2,(H,28,32)(H2,29,30,33)/t19-,21-,23+,25+/m0/s1	CSQKNNUUWCECGY-FEGXGRLVSA-N	480.237270164							98716
BRD-K65766198	LSM-12439		54646143	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16-,18-,20+/m0/s1	BEWGTMHICYCEOA-PFSLXQJOSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NC4CCCC4)C[C@H]3c2c1	BroadT	BRD-K65766198	BRD-K65766198-001-01-3	Broad Institute of MIT and Harvard	BRD-K65766198			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NC4CCCC4)O[C@H]3CO)c2c1	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16-,18-,20+/m0/s1	BEWGTMHICYCEOA-PFSLXQJOSA-N	424.166807326							101067
BRD-K66131980	LSM-12460		54646235	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22+,24-,26+,28+/m0/s1	HZCFRKFPOJNJBV-BQDCVZTHSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K66131980	BRD-K66131980-001-01-1	Broad Institute of MIT and Harvard	BRD-K66131980			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22+,24-,26+,28+/m0/s1	HZCFRKFPOJNJBV-BQDCVZTHSA-N	569.21375569							131207
BRD-K40173185	LSM-10880		54646274	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25-,27+,29+/m0/s1	FOSRSIPYUZSGIW-IBNCXQOKSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)NCCc5ccccc5)C[C@H]4c3c2)cc1	BroadT	BRD-K40173185	BRD-K40173185-001-01-7	Broad Institute of MIT and Harvard	BRD-K40173185			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NCCc5ccccc5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25-,27+,29+/m0/s1	FOSRSIPYUZSGIW-IBNCXQOKSA-N	531.236935806							99501
BRD-K64021372	LSM-12336		54646124	InChI=1S/C30H30N2O7/c1-17(18-5-3-2-4-6-18)31-28(34)14-21-13-23-22-12-20(8-10-24(22)39-29(23)27(15-33)38-21)32-30(35)19-7-9-25-26(11-19)37-16-36-25/h2-12,17,21,23,27,29,33H,13-16H2,1H3,(H,31,34)(H,32,35)/t17-,21+,23+,27+,29-/m1/s1	PKVMSJKEIKOOIO-FQTZSRFZSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1)c6ccccc6	BroadT	BRD-K64021372	BRD-K64021372-001-01-2	Broad Institute of MIT and Harvard	BRD-K64021372			C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C30H30N2O7/c1-17(18-5-3-2-4-6-18)31-28(34)14-21-13-23-22-12-20(8-10-24(22)39-29(23)27(15-33)38-21)32-30(35)19-7-9-25-26(11-19)37-16-36-25/h2-12,17,21,23,27,29,33H,13-16H2,1H3,(H,31,34)(H,32,35)/t17-,21+,23+,27+,29-/m1/s1	PKVMSJKEIKOOIO-FQTZSRFZSA-N	530.20530132							100963
BRD-K22318001	LSM-9780		54646130	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21-,23-,25+/m0/s1	CCIDSNZUNACLPU-YALMDMJRSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K22318001	BRD-K22318001-001-01-2	Broad Institute of MIT and Harvard	BRD-K22318001			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C26H31N3O5/c30-15-23-25-21(12-19(33-23)13-24(31)28-17-6-2-1-3-7-17)20-11-18(8-9-22(20)34-25)29-26(32)16-5-4-10-27-14-16/h4-5,8-11,14,17,19,21,23,25,30H,1-3,6-7,12-13,15H2,(H,28,31)(H,29,32)/t19-,21-,23-,25+/m0/s1	CCIDSNZUNACLPU-YALMDMJRSA-N	465.226371122							98401
BRD-K24338558	LSM-9904		54646173	InChI=1S/C20H20FNO7S/c21-11-1-4-14(5-2-11)30(26,27)22-12-3-6-17-15(7-12)16-8-13(9-19(24)25)28-18(10-23)20(16)29-17/h1-7,13,16,18,20,22-23H,8-10H2,(H,24,25)/t13-,16-,18+,20+/m1/s1	BOKKRFULVUTARF-GNYRAKODSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23	BroadT	BRD-K24338558	BRD-K24338558-001-01-5	Broad Institute of MIT and Harvard	BRD-K24338558			OC[C@@H]1O[C@H](C[C@H]2[C@@H]1Oc1ccc(cc21)NS(=O)(=O)c1ccc(F)cc1)CC(O)=O	InChI=1S/C20H20FNO7S/c21-11-1-4-14(5-2-11)30(26,27)22-12-3-6-17-15(7-12)16-8-13(9-19(24)25)28-18(10-23)20(16)29-17/h1-7,13,16,18,20,22-23H,8-10H2,(H,24,25)/t13-,16-,18+,20+/m1/s1	BOKKRFULVUTARF-GNYRAKODSA-N	437.09445088							98525
BRD-K93468393	LSM-14160		54646397	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24-,26-/m1/s1	XBPCNRNKOXKUQA-FWSIMYTDSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K93468393	BRD-K93468393-001-01-5	Broad Institute of MIT and Harvard	BRD-K93468393			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24-,26-/m1/s1	XBPCNRNKOXKUQA-FWSIMYTDSA-N	464.231122144							102814
BRD-K84047740	LSM-13564		54646251	InChI=1S/C29H28FN3O7/c30-21-3-1-2-4-22(21)33-29(36)32-17-6-8-23-19(10-17)20-11-18(39-26(14-34)28(20)40-23)12-27(35)31-13-16-5-7-24-25(9-16)38-15-37-24/h1-10,18,20,26,28,34H,11-15H2,(H,31,35)(H2,32,33,36)/t18-,20+,26-,28-/m0/s1	QUTKLMAKSFRFCA-QARCYOLKSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K84047740	BRD-K84047740-001-01-8	Broad Institute of MIT and Harvard	BRD-K84047740			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H28FN3O7/c30-21-3-1-2-4-22(21)33-29(36)32-17-6-8-23-19(10-17)20-11-18(39-26(14-34)28(20)40-23)12-27(35)31-13-16-5-7-24-25(9-16)38-15-37-24/h1-10,18,20,26,28,34H,11-15H2,(H,31,35)(H2,32,33,36)/t18-,20+,26-,28-/m0/s1	QUTKLMAKSFRFCA-QARCYOLKSA-N	549.191128466							102206
BRD-K56167818	LSM-11823		54646264	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23+,25+,27-/m1/s1	VIZOEWJOWGMLTK-WFHOOFKDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K56167818	BRD-K56167818-001-01-5	Broad Institute of MIT and Harvard	BRD-K56167818			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23+,25+,27-/m1/s1	VIZOEWJOWGMLTK-WFHOOFKDSA-N	508.268570292							100448
BRD-K84120458	LSM-13571		54646247	InChI=1S/C29H28FN3O7/c30-21-3-1-2-4-22(21)33-29(36)32-17-6-8-23-19(10-17)20-11-18(39-26(14-34)28(20)40-23)12-27(35)31-13-16-5-7-24-25(9-16)38-15-37-24/h1-10,18,20,26,28,34H,11-15H2,(H,31,35)(H2,32,33,36)/t18-,20-,26-,28+/m1/s1	QUTKLMAKSFRFCA-NAPMWBMBSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K84120458	BRD-K84120458-001-01-5	Broad Institute of MIT and Harvard	BRD-K84120458			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H28FN3O7/c30-21-3-1-2-4-22(21)33-29(36)32-17-6-8-23-19(10-17)20-11-18(39-26(14-34)28(20)40-23)12-27(35)31-13-16-5-7-24-25(9-16)38-15-37-24/h1-10,18,20,26,28,34H,11-15H2,(H,31,35)(H2,32,33,36)/t18-,20-,26-,28+/m1/s1	QUTKLMAKSFRFCA-NAPMWBMBSA-N	549.191128466							102213
BRD-K71963262	LSM-12839		54646371	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28-,31+/m0/s1	BRDKARYWUSDFKE-CWFQFANUSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@H]3c2c1	BroadT	BRD-K71963262	BRD-K71963262-001-01-9	Broad Institute of MIT and Harvard	BRD-K71963262			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(cc4)-c4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28-,31+/m0/s1	BRDKARYWUSDFKE-CWFQFANUSA-N	529.25767125							101476
BRD-K72785431	LSM-12885		54646362	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18-,20-,22+/m1/s1	LWPDCVYPXSZOFH-ZLLBNUPZSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(Cl)cc4)C[C@@H]3c2c1	BroadT	BRD-K72785431	BRD-K72785431-001-01-1	Broad Institute of MIT and Harvard	BRD-K72785431			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18-,20-,22+/m1/s1	LWPDCVYPXSZOFH-ZLLBNUPZSA-N	480.11218494							101522
BRD-K02638906	LSM-8601		54646250	InChI=1S/C29H28FN3O7/c30-21-3-1-2-4-22(21)33-29(36)32-17-6-8-23-19(10-17)20-11-18(39-26(14-34)28(20)40-23)12-27(35)31-13-16-5-7-24-25(9-16)38-15-37-24/h1-10,18,20,26,28,34H,11-15H2,(H,31,35)(H2,32,33,36)/t18-,20+,26-,28-/m1/s1	QUTKLMAKSFRFCA-DHUZCCQOSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K02638906	BRD-K02638906-001-01-3	Broad Institute of MIT and Harvard	BRD-K02638906			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C29H28FN3O7/c30-21-3-1-2-4-22(21)33-29(36)32-17-6-8-23-19(10-17)20-11-18(39-26(14-34)28(20)40-23)12-27(35)31-13-16-5-7-24-25(9-16)38-15-37-24/h1-10,18,20,26,28,34H,11-15H2,(H,31,35)(H2,32,33,36)/t18-,20+,26-,28-/m1/s1	QUTKLMAKSFRFCA-DHUZCCQOSA-N	549.191128466							97222
BRD-K27066819	LSM-10068		54646186	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26-,28+/m1/s1	CRNISVWSFUFTQR-GUSOMZPTSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@@H](CO)O2	BroadT	BRD-K27066819	BRD-K27066819-001-01-4	Broad Institute of MIT and Harvard	BRD-K27066819			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26-,28+/m1/s1	CRNISVWSFUFTQR-GUSOMZPTSA-N	556.167950178							98689
BRD-K39674306	LSM-10842		54646434	InChI=1S/C28H35N3O6/c1-35-20-10-7-18(8-11-20)30-28(34)31-19-9-12-24-22(13-19)23-14-21(36-25(16-32)27(23)37-24)15-26(33)29-17-5-3-2-4-6-17/h7-13,17,21,23,25,27,32H,2-6,14-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25+,27+/m1/s1	ATPIYVGDEBDNGC-RESCMLIYSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)NC5CCCCC5)C[C@@H]4c3c2)cc1	BroadT	BRD-K39674306	BRD-K39674306-001-01-1	Broad Institute of MIT and Harvard	BRD-K39674306			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NC5CCCCC5)O[C@H]4CO)c3c2)cc1	InChI=1S/C28H35N3O6/c1-35-20-10-7-18(8-11-20)30-28(34)31-19-9-12-24-22(13-19)23-14-21(36-25(16-32)27(23)37-24)15-26(33)29-17-5-3-2-4-6-17/h7-13,17,21,23,25,27,32H,2-6,14-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25+,27+/m1/s1	ATPIYVGDEBDNGC-RESCMLIYSA-N	509.25258587							99463
BRD-K96061818	LSM-14323		54646388	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12+,14+,16-/m1/s1	STSQWNRYWIJNCW-IFXMJZAHSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K96061818	BRD-K96061818-001-01-2	Broad Institute of MIT and Harvard	BRD-K96061818			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12+,14+,16-/m1/s1	STSQWNRYWIJNCW-IFXMJZAHSA-N	371.103872712							102977
BRD-K16149503	LSM-9401		54646160	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23-,25+,28+/m0/s1	FBZDSUDTYUQYGJ-GUAPPOABSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K16149503	BRD-K16149503-001-01-2	Broad Institute of MIT and Harvard	BRD-K16149503			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-28-23(16-21(36-25)17-26(34)30-10-13-32-11-2-1-3-12-32)22-15-20(4-5-24(22)37-28)31-27(35)14-19-6-8-29-9-7-19/h4-9,15,21,23,25,28,33H,1-3,10-14,16-18H2,(H,30,34)(H,31,35)/t21-,23-,25+,28+/m0/s1	FBZDSUDTYUQYGJ-GUAPPOABSA-N	508.268570292							98022
BRD-K61519793	LSM-12157		54646222	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25+,27-,29-/m0/s1	MRJCPWMBHXTRFB-KLPDMWAPSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@@H]3c2c1	BroadT	BRD-K61519793	BRD-K61519793-001-01-9	Broad Institute of MIT and Harvard	BRD-K61519793			CN(C)c1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@H]3CO)c2c1	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25+,27-,29-/m0/s1	MRJCPWMBHXTRFB-KLPDMWAPSA-N	488.231122144							100783
BRD-K60697955	LSM-12095		54646414	InChI=1S/C25H30N2O4/c1-26(2)18-7-8-22-20(11-18)21-12-19(30-23(15-28)25(21)31-22)13-24(29)27-10-9-16-5-3-4-6-17(16)14-27/h3-8,11,19,21,23,25,28H,9-10,12-15H2,1-2H3/t19-,21-,23+,25+/m0/s1	QQFBCVYCCQBHCE-FEGXGRLVSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)N4CCc5ccccc5C4)C[C@H]3c2c1	BroadT	BRD-K60697955	BRD-K60697955-001-01-8	Broad Institute of MIT and Harvard	BRD-K60697955			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCc5ccccc5C4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O4/c1-26(2)18-7-8-22-20(11-18)21-12-19(30-23(15-28)25(21)31-22)13-24(29)27-10-9-16-5-3-4-6-17(16)14-27/h3-8,11,19,21,23,25,28H,9-10,12-15H2,1-2H3/t19-,21-,23+,25+/m0/s1	QQFBCVYCCQBHCE-FEGXGRLVSA-N	422.22055746							100721
BRD-K46319090	LSM-11254		54646244	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23+,25-,27-/m0/s1	FWDZHOQSJMEDFJ-HFFYFMGZSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NCc5ccccn5)C[C@@H]4c3c2)cc1	BroadT	BRD-K46319090	BRD-K46319090-001-01-4	Broad Institute of MIT and Harvard	BRD-K46319090			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)NCc5ccccn5)O[C@H]4CO)c3c2)cc1	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23+,25-,27-/m0/s1	FWDZHOQSJMEDFJ-HFFYFMGZSA-N	518.21653472							99875
BRD-K54971989	LSM-11759		54646265	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23+,25-,27-/m1/s1	VIZOEWJOWGMLTK-WWUYVNTOSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K54971989	BRD-K54971989-001-01-5	Broad Institute of MIT and Harvard	BRD-K54971989			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H36N4O5/c33-18-25-27-23(16-21(36-25)17-26(34)29-11-14-32-12-5-2-6-13-32)22-15-20(9-10-24(22)37-27)31-28(35)30-19-7-3-1-4-8-19/h1,3-4,7-10,15,21,23,25,27,33H,2,5-6,11-14,16-18H2,(H,29,34)(H2,30,31,35)/t21-,23+,25-,27-/m1/s1	VIZOEWJOWGMLTK-WWUYVNTOSA-N	508.268570292							100384
BRD-K53665713	LSM-11694		54646425	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18+,20-,23-/m1/s1	MRLAOALNSBFOMY-RWSUSOHTSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)N4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K53665713	BRD-K53665713-001-01-7	Broad Institute of MIT and Harvard	BRD-K53665713			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18+,20-,23-/m1/s1	MRLAOALNSBFOMY-RWSUSOHTSA-N	431.242021186							100319
BRD-K88487973	LSM-13869		54646152	InChI=1S/C24H30N2O4/c1-26(2)17-8-9-21-19(12-17)20-13-18(29-22(15-27)24(20)30-21)14-23(28)25-11-10-16-6-4-3-5-7-16/h3-9,12,18,20,22,24,27H,10-11,13-15H2,1-2H3,(H,25,28)/t18-,20-,22+,24+/m0/s1	VTJOJCWIVRUFJE-YCYVKTGYSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCCc4ccccc4)C[C@H]3c2c1	BroadT	BRD-K88487973	BRD-K88487973-001-01-0	Broad Institute of MIT and Harvard	BRD-K88487973			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCCc4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C24H30N2O4/c1-26(2)17-8-9-21-19(12-17)20-13-18(29-22(15-27)24(20)30-21)14-23(28)25-11-10-16-6-4-3-5-7-16/h3-9,12,18,20,22,24,27H,10-11,13-15H2,1-2H3,(H,25,28)/t18-,20-,22+,24+/m0/s1	VTJOJCWIVRUFJE-YCYVKTGYSA-N	410.22055746							102521
BRD-K05207940	LSM-8738		54646384	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19-,21+,23+/m0/s1	ALHQUDNRSCILRO-VARILPKDSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K05207940	BRD-K05207940-001-01-2	Broad Institute of MIT and Harvard	BRD-K05207940			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)NC4CCCCC4)cc23)[C@@H](CO)O1	InChI=1S/C24H35N3O5/c1-2-10-25-22(29)13-17-12-19-18-11-16(27-24(30)26-15-6-4-3-5-7-15)8-9-20(18)32-23(19)21(14-28)31-17/h8-9,11,15,17,19,21,23,28H,2-7,10,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t17-,19-,21+,23+/m0/s1	ALHQUDNRSCILRO-VARILPKDSA-N	445.25767125							97359
BRD-K88095357	LSM-13839		54646373	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28+,31-/m1/s1	BRDKARYWUSDFKE-LJJPEMRYSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@H]3c2c1	BroadT	BRD-K88095357	BRD-K88095357-001-01-7	Broad Institute of MIT and Harvard	BRD-K88095357			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(cc4)-c4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28+,31-/m1/s1	BRDKARYWUSDFKE-LJJPEMRYSA-N	529.25767125							102490
CHEMBL2361449	LSM-10364	SID131442511, BRD-K31903015	54646137	InChI=1S/C30H30N2O8/c1-36-23-5-3-2-4-18(23)14-31-28(34)13-20-12-22-21-11-19(7-9-24(21)40-29(22)27(15-33)39-20)32-30(35)17-6-8-25-26(10-17)38-16-37-25/h2-11,20,22,27,29,33H,12-16H2,1H3,(H,31,34)(H,32,35)/t20-,22-,27-,29+/m0/s1	IQCMSFSSZNINGU-KNILCCFISA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@H](CO)O2	BroadT	BRD-K31903015	BRD-K31903015-001-01-4	Broad Institute of MIT and Harvard	BRD-K31903015			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C30H30N2O8/c1-36-23-5-3-2-4-18(23)14-31-28(34)13-20-12-22-21-11-19(7-9-24(21)40-29(22)27(15-33)39-20)32-30(35)17-6-8-25-26(10-17)38-16-37-25/h2-11,20,22,27,29,33H,12-16H2,1H3,(H,31,34)(H,32,35)/t20-,22-,27-,29+/m0/s1	IQCMSFSSZNINGU-KNILCCFISA-N	546.20021594							98985
BRD-K72375447	LSM-12869		54646237	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22-,24-,26+,28+/m0/s1	HZCFRKFPOJNJBV-IFGFJRRUSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K72375447	BRD-K72375447-001-01-3	Broad Institute of MIT and Harvard	BRD-K72375447			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22-,24-,26+,28+/m0/s1	HZCFRKFPOJNJBV-IFGFJRRUSA-N	569.21375569							101506
BRD-K98998964	LSM-14508		54646407	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18-,20-,22+,24+/m0/s1	LSNSUZUVRXFZLV-GFUUYCAGSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K98998964	BRD-K98998964-001-01-5	Broad Institute of MIT and Harvard	BRD-K98998964			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1)c1ccccc1	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18-,20-,22+,24+/m0/s1	LSNSUZUVRXFZLV-GFUUYCAGSA-N	410.22055746							103163
BRD-K52012504	LSM-11612		54646337	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21-,24-,26+/m0/s1	UVPONYOZSFJNDG-YKNOVDGGSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K52012504	BRD-K52012504-001-01-6	Broad Institute of MIT and Harvard	BRD-K52012504			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H30F2N2O6/c28-17-1-3-22(29)16(9-17)13-30-25(33)12-19-11-21-20-10-18(31-27(34)15-5-7-35-8-6-15)2-4-23(20)37-26(21)24(14-32)36-19/h1-4,9-10,15,19,21,24,26,32H,5-8,11-14H2,(H,30,33)(H,31,34)/t19-,21-,24-,26+/m0/s1	UVPONYOZSFJNDG-YKNOVDGGSA-N	516.2071931							100235
BRD-K86154664	LSM-13705		54646204	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19-,21-/m1/s1	JZVGIVMTJSWJDH-UKHYVGRKSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccccn4)C[C@H]3c2c1	BroadT	BRD-K86154664	BRD-K86154664-001-01-2	Broad Institute of MIT and Harvard	BRD-K86154664			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccccn4)O[C@@H]3CO)c2c1	InChI=1S/C21H25N3O6S/c1-31(27,28)24-13-5-6-18-16(8-13)17-9-15(29-19(12-25)21(17)30-18)10-20(26)23-11-14-4-2-3-7-22-14/h2-8,15,17,19,21,24-25H,9-12H2,1H3,(H,23,26)/t15-,17+,19-,21-/m1/s1	JZVGIVMTJSWJDH-UKHYVGRKSA-N	447.14640624							102353
BRD-K86997557	LSM-13766		54646139	InChI=1S/C30H30N2O8/c1-36-23-5-3-2-4-18(23)14-31-28(34)13-20-12-22-21-11-19(7-9-24(21)40-29(22)27(15-33)39-20)32-30(35)17-6-8-25-26(10-17)38-16-37-25/h2-11,20,22,27,29,33H,12-16H2,1H3,(H,31,34)(H,32,35)/t20-,22+,27-,29-/m1/s1	IQCMSFSSZNINGU-ZNGJXQNXSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@@H](CO)O2	BroadT	BRD-K86997557	BRD-K86997557-001-01-4	Broad Institute of MIT and Harvard	BRD-K86997557			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C30H30N2O8/c1-36-23-5-3-2-4-18(23)14-31-28(34)13-20-12-22-21-11-19(7-9-24(21)40-29(22)27(15-33)39-20)32-30(35)17-6-8-25-26(10-17)38-16-37-25/h2-11,20,22,27,29,33H,12-16H2,1H3,(H,31,34)(H,32,35)/t20-,22+,27-,29-/m1/s1	IQCMSFSSZNINGU-ZNGJXQNXSA-N	546.20021594							102415
BRD-K52356070	LSM-11629		54646277	InChI=1S/C20H28N2O4/c1-22(2)13-5-6-17-15(7-13)16-8-14(25-18(11-23)20(16)26-17)9-19(24)21-10-12-3-4-12/h5-7,12,14,16,18,20,23H,3-4,8-11H2,1-2H3,(H,21,24)/t14-,16-,18-,20+/m0/s1	JLJMCVQNTFDIRA-PFSLXQJOSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@H]3c2c1	BroadT	BRD-K52356070	BRD-K52356070-001-01-1	Broad Institute of MIT and Harvard	BRD-K52356070			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C20H28N2O4/c1-22(2)13-5-6-17-15(7-13)16-8-14(25-18(11-23)20(16)26-17)9-19(24)21-10-12-3-4-12/h5-7,12,14,16,18,20,23H,3-4,8-11H2,1-2H3,(H,21,24)/t14-,16-,18-,20+/m0/s1	JLJMCVQNTFDIRA-PFSLXQJOSA-N	360.204907396							100254
BRD-K71031872	LSM-12762		54646224	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25-,27+,29+/m1/s1	MRJCPWMBHXTRFB-UXLOVFDUSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@@H]3c2c1	BroadT	BRD-K71031872	BRD-K71031872-001-01-7	Broad Institute of MIT and Harvard	BRD-K71031872			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@H]3CO)c2c1	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25-,27+,29+/m1/s1	MRJCPWMBHXTRFB-UXLOVFDUSA-N	488.231122144							101399
BRD-K82989800	LSM-13497		54646141	InChI=1S/C30H30N2O8/c1-36-23-5-3-2-4-18(23)14-31-28(34)13-20-12-22-21-11-19(7-9-24(21)40-29(22)27(15-33)39-20)32-30(35)17-6-8-25-26(10-17)38-16-37-25/h2-11,20,22,27,29,33H,12-16H2,1H3,(H,31,34)(H,32,35)/t20-,22-,27+,29+/m1/s1	IQCMSFSSZNINGU-NFSGWUAQSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34)[C@H](CO)O2	BroadT	BRD-K82989800	BRD-K82989800-001-01-0	Broad Institute of MIT and Harvard	BRD-K82989800			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C30H30N2O8/c1-36-23-5-3-2-4-18(23)14-31-28(34)13-20-12-22-21-11-19(7-9-24(21)40-29(22)27(15-33)39-20)32-30(35)17-6-8-25-26(10-17)38-16-37-25/h2-11,20,22,27,29,33H,12-16H2,1H3,(H,31,34)(H,32,35)/t20-,22-,27+,29+/m1/s1	IQCMSFSSZNINGU-NFSGWUAQSA-N	546.20021594							102138
BRD-K87340398	LSM-13785		54646300	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25+,27+,30-/m0/s1	ZUSAVEKAEPAMKG-MFYQUPDPSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Cc6ccncc6)cc45	BroadT	BRD-K87340398	BRD-K87340398-001-01-9	Broad Institute of MIT and Harvard	BRD-K87340398			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C30H31N3O5/c34-18-27-30-25(15-23(37-27)16-29(36)33-12-9-20-3-1-2-4-21(20)17-33)24-14-22(5-6-26(24)38-30)32-28(35)13-19-7-10-31-11-8-19/h1-8,10-11,14,23,25,27,30,34H,9,12-13,15-18H2,(H,32,35)/t23-,25+,27+,30-/m0/s1	ZUSAVEKAEPAMKG-MFYQUPDPSA-N	513.226371122							102434
BRD-K96922741	LSM-14379		54646243	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23+,25-,27-/m1/s1	FWDZHOQSJMEDFJ-WWUYVNTOSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)NCc5ccccn5)C[C@H]4c3c2)cc1	BroadT	BRD-K96922741	BRD-K96922741-001-01-7	Broad Institute of MIT and Harvard	BRD-K96922741			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)NCc5ccccn5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23+,25-,27-/m1/s1	FWDZHOQSJMEDFJ-WWUYVNTOSA-N	518.21653472							103033
BRD-K96625719	LSM-14357		54646241	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23+,25+,27-/m0/s1	FWDZHOQSJMEDFJ-BBVYRSAVSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)NCc5ccccn5)C[C@@H]4c3c2)cc1	BroadT	BRD-K96625719	BRD-K96625719-001-01-4	Broad Institute of MIT and Harvard	BRD-K96625719			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)NCc5ccccn5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23+,25+,27-/m0/s1	FWDZHOQSJMEDFJ-BBVYRSAVSA-N	518.21653472							103011
BRD-K48911375	LSM-11405		54646429	InChI=1S/C28H35N3O6/c1-35-20-10-7-18(8-11-20)30-28(34)31-19-9-12-24-22(13-19)23-14-21(36-25(16-32)27(23)37-24)15-26(33)29-17-5-3-2-4-6-17/h7-13,17,21,23,25,27,32H,2-6,14-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25-,27+/m1/s1	ATPIYVGDEBDNGC-UFUIAINPSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NC5CCCCC5)C[C@@H]4c3c2)cc1	BroadT	BRD-K48911375	BRD-K48911375-001-01-2	Broad Institute of MIT and Harvard	BRD-K48911375			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NC5CCCCC5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C28H35N3O6/c1-35-20-10-7-18(8-11-20)30-28(34)31-19-9-12-24-22(13-19)23-14-21(36-25(16-32)27(23)37-24)15-26(33)29-17-5-3-2-4-6-17/h7-13,17,21,23,25,27,32H,2-6,14-16H2,1H3,(H,29,33)(H2,30,31,34)/t21-,23-,25-,27+/m1/s1	ATPIYVGDEBDNGC-UFUIAINPSA-N	509.25258587							100026
CHEMBL2355186	LSM-8441	BRD-K00259552, SID131442607	54646233	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22-,24+,26+,28-/m0/s1	HZCFRKFPOJNJBV-LZOAQGMCSA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K00259552	BRD-K00259552-001-01-7	Broad Institute of MIT and Harvard	BRD-K00259552			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22-,24+,26+,28-/m0/s1	HZCFRKFPOJNJBV-LZOAQGMCSA-N	569.21375569							97062
BRD-K61496587	LSM-12155		54646364	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18+,20+,22-/m0/s1	LWPDCVYPXSZOFH-ZMUPPCTCSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(Cl)cc4)C[C@@H]3c2c1	BroadT	BRD-K61496587	BRD-K61496587-001-01-0	Broad Institute of MIT and Harvard	BRD-K61496587			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18+,20+,22-/m0/s1	LWPDCVYPXSZOFH-ZMUPPCTCSA-N	480.11218494							100781
BRD-K87850000	LSM-13818		54646269	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25-,27-,29+/m1/s1	FOSRSIPYUZSGIW-ACEYUQJJSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NCCc5ccccc5)C[C@@H]4c3c2)cc1	BroadT	BRD-K87850000	BRD-K87850000-001-01-7	Broad Institute of MIT and Harvard	BRD-K87850000			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NCCc5ccccc5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-37-22-10-7-20(8-11-22)32-30(36)33-21-9-12-26-24(15-21)25-16-23(38-27(18-34)29(25)39-26)17-28(35)31-14-13-19-5-3-2-4-6-19/h2-12,15,23,25,27,29,34H,13-14,16-18H2,1H3,(H,31,35)(H2,32,33,36)/t23-,25-,27-,29+/m1/s1	FOSRSIPYUZSGIW-ACEYUQJJSA-N	531.236935806							102468
BRD-K60983473	LSM-12117		54646281	InChI=1S/C20H28N2O4/c1-22(2)13-5-6-17-15(7-13)16-8-14(25-18(11-23)20(16)26-17)9-19(24)21-10-12-3-4-12/h5-7,12,14,16,18,20,23H,3-4,8-11H2,1-2H3,(H,21,24)/t14-,16-,18+,20+/m1/s1	JLJMCVQNTFDIRA-BIJSTVTOSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K60983473	BRD-K60983473-001-01-5	Broad Institute of MIT and Harvard	BRD-K60983473			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C20H28N2O4/c1-22(2)13-5-6-17-15(7-13)16-8-14(25-18(11-23)20(16)26-17)9-19(24)21-10-12-3-4-12/h5-7,12,14,16,18,20,23H,3-4,8-11H2,1-2H3,(H,21,24)/t14-,16-,18+,20+/m1/s1	JLJMCVQNTFDIRA-BIJSTVTOSA-N	360.204907396							100743
BRD-K17686770	LSM-9493		54646234	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22+,24-,26-,28+/m0/s1	HZCFRKFPOJNJBV-ZTXNXLIXSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K17686770	BRD-K17686770-001-01-8	Broad Institute of MIT and Harvard	BRD-K17686770			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22+,24-,26-,28+/m0/s1	HZCFRKFPOJNJBV-ZTXNXLIXSA-N	569.21375569							98114
BRD-K50587003	LSM-11505		54646404	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18+,20-,22+,24+/m0/s1	LSNSUZUVRXFZLV-HYJVDKBFSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K50587003	BRD-K50587003-001-01-5	Broad Institute of MIT and Harvard	BRD-K50587003			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1)c1ccccc1	InChI=1S/C24H30N2O4/c1-15(16-7-5-4-6-8-16)25-23(28)13-18-12-20-19-11-17(26(2)3)9-10-21(19)30-24(20)22(14-27)29-18/h4-11,15,18,20,22,24,27H,12-14H2,1-3H3,(H,25,28)/t15-,18+,20-,22+,24+/m0/s1	LSNSUZUVRXFZLV-HYJVDKBFSA-N	410.22055746							100126
BRD-K00436546	LSM-8455		54646372	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28+,31-/m0/s1	BRDKARYWUSDFKE-FLOWCNPBSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@@H]3c2c1	BroadT	BRD-K00436546	BRD-K00436546-001-01-0	Broad Institute of MIT and Harvard	BRD-K00436546			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(cc4)-c4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28+,31-/m0/s1	BRDKARYWUSDFKE-FLOWCNPBSA-N	529.25767125							97076
BRD-K53067088	LSM-11666		54646377	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28+,31+/m1/s1	BRDKARYWUSDFKE-UCMKUVFTSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@@H]3c2c1	BroadT	BRD-K53067088	BRD-K53067088-001-01-3	Broad Institute of MIT and Harvard	BRD-K53067088			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(cc4)-c4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26-,28+,31+/m1/s1	BRDKARYWUSDFKE-UCMKUVFTSA-N	529.25767125							100291
BRD-K04371509	LSM-8697		54646148	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16-,18+,20+/m0/s1	BEWGTMHICYCEOA-LBLLVPRASA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NC4CCCC4)C[C@H]3c2c1	BroadT	BRD-K04371509	BRD-K04371509-001-01-0	Broad Institute of MIT and Harvard	BRD-K04371509			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NC4CCCC4)O[C@@H]3CO)c2c1	InChI=1S/C20H28N2O6S/c1-29(25,26)22-13-6-7-17-15(8-13)16-9-14(27-18(11-23)20(16)28-17)10-19(24)21-12-4-2-3-5-12/h6-8,12,14,16,18,20,22-23H,2-5,9-11H2,1H3,(H,21,24)/t14-,16-,18+,20+/m0/s1	BEWGTMHICYCEOA-LBLLVPRASA-N	424.166807326							97318
BRD-K39900015	LSM-10861		54646162	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19-,21-,23+/m1/s1	SOARVSRWKWCBLL-LHWDRQQYSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@@H](CO)O2	BroadT	BRD-K39900015	BRD-K39900015-001-01-2	Broad Institute of MIT and Harvard	BRD-K39900015			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCC4)cc23)[C@@H](CO)O1	InChI=1S/C24H33N3O5/c1-26-7-9-27(10-8-26)22(29)13-17-12-19-18-11-16(25-24(30)15-3-2-4-15)5-6-20(18)32-23(19)21(14-28)31-17/h5-6,11,15,17,19,21,23,28H,2-4,7-10,12-14H2,1H3,(H,25,30)/t17-,19-,21-,23+/m1/s1	SOARVSRWKWCBLL-LHWDRQQYSA-N	443.242021186							99482
BRD-K59611835	LSM-12032		54646366	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18+,20-,22-/m1/s1	LWPDCVYPXSZOFH-HOQQESESSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(Cl)cc4)C[C@H]3c2c1	BroadT	BRD-K59611835	BRD-K59611835-001-01-8	Broad Institute of MIT and Harvard	BRD-K59611835			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(Cl)cc4)O[C@@H]3CO)c2c1	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18+,20-,22-/m1/s1	LWPDCVYPXSZOFH-HOQQESESSA-N	480.11218494							100658
BRD-K76269493	LSM-13092		54646117	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15+,17+,20-/m0/s1	ZWJVDCAUIXXXGX-XEQBAVFLSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)COC)cc23)[C@@H](CO)O1	BroadT	BRD-K76269493	BRD-K76269493-001-01-7	Broad Institute of MIT and Harvard	BRD-K76269493			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)COC)cc23)[C@@H](CO)O1	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15+,17+,20-/m0/s1	ZWJVDCAUIXXXGX-XEQBAVFLSA-N	392.194736636							101730
BRD-K89567872	LSM-13949		54646189	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26+,28-/m1/s1	CRNISVWSFUFTQR-BYAUNOKSSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@H](CO)O2	BroadT	BRD-K89567872	BRD-K89567872-001-01-0	Broad Institute of MIT and Harvard	BRD-K89567872			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26+,28-/m1/s1	CRNISVWSFUFTQR-BYAUNOKSSA-N	556.167950178							102602
BRD-K61339519	LSM-12142		54646216	InChI=1S/C16H21NO5/c1-17(2)9-3-4-13-11(5-9)12-6-10(7-15(19)20)21-14(8-18)16(12)22-13/h3-5,10,12,14,16,18H,6-8H2,1-2H3,(H,19,20)/t10-,12+,14-,16-/m1/s1	MUGALHVVQCOZES-HTWGDNNSSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)O)C[C@H]3c2c1	BroadT	BRD-K61339519	BRD-K61339519-001-01-5	Broad Institute of MIT and Harvard	BRD-K61339519			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(O)=O)O[C@@H]3CO)c2c1	InChI=1S/C16H21NO5/c1-17(2)9-3-4-13-11(5-9)12-6-10(7-15(19)20)21-14(8-18)16(12)22-13/h3-5,10,12,14,16,18H,6-8H2,1-2H3,(H,19,20)/t10-,12+,14-,16-/m1/s1	MUGALHVVQCOZES-HTWGDNNSSA-N	307.141972782							100768
BRD-K68323967	LSM-12595		54646231	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22+,24+,26+,28-/m0/s1	HZCFRKFPOJNJBV-BEYJYYPNSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K68323967	BRD-K68323967-001-01-9	Broad Institute of MIT and Harvard	BRD-K68323967			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22+,24+,26+,28-/m0/s1	HZCFRKFPOJNJBV-BEYJYYPNSA-N	569.21375569							101227
BRD-K11088254	LSM-9105		54646213	InChI=1S/C16H21NO5/c1-17(2)9-3-4-13-11(5-9)12-6-10(7-15(19)20)21-14(8-18)16(12)22-13/h3-5,10,12,14,16,18H,6-8H2,1-2H3,(H,19,20)/t10-,12-,14-,16+/m1/s1	MUGALHVVQCOZES-AEKOTVAKSA-N	CN(C)c1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)O)C[C@@H]3c2c1	BroadT	BRD-K11088254	BRD-K11088254-001-01-8	Broad Institute of MIT and Harvard	BRD-K11088254			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(O)=O)O[C@@H]3CO)c2c1	InChI=1S/C16H21NO5/c1-17(2)9-3-4-13-11(5-9)12-6-10(7-15(19)20)21-14(8-18)16(12)22-13/h3-5,10,12,14,16,18H,6-8H2,1-2H3,(H,19,20)/t10-,12-,14-,16+/m1/s1	MUGALHVVQCOZES-AEKOTVAKSA-N	307.141972782							97726
BRD-K27935463	LSM-10118		54646374	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28-,31-/m1/s1	BRDKARYWUSDFKE-FZYTTXFFSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(cc4)c5ccccc5)C[C@H]3c2c1	BroadT	BRD-K27935463	BRD-K27935463-001-01-9	Broad Institute of MIT and Harvard	BRD-K27935463			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(cc4)-c4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C31H35N3O5/c1-34(2)18-30(37)33-23-12-13-27-25(14-23)26-15-24(38-28(19-35)31(26)39-27)16-29(36)32-17-20-8-10-22(11-9-20)21-6-4-3-5-7-21/h3-14,24,26,28,31,35H,15-19H2,1-2H3,(H,32,36)(H,33,37)/t24-,26+,28-,31-/m1/s1	BRDKARYWUSDFKE-FZYTTXFFSA-N	529.25767125							98739
BRD-K82249256	LSM-13456		54646259	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21-,25+,27+/m0/s1	FEEKZGTVSGSFLP-ZTUCRWOVSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K82249256	BRD-K82249256-001-01-8	Broad Institute of MIT and Harvard	BRD-K82249256			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21-,25+,27+/m0/s1	FEEKZGTVSGSFLP-ZTUCRWOVSA-N	517.184900234							102096
BRD-K98834499	LSM-14494		54646119	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15+,17-,20-/m1/s1	ZWJVDCAUIXXXGX-YBLQJDFOSA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)COC)cc23)[C@@H](CO)O1	BroadT	BRD-K98834499	BRD-K98834499-001-01-6	Broad Institute of MIT and Harvard	BRD-K98834499			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)COC)cc23)[C@@H](CO)O1	InChI=1S/C20H28N2O6/c1-3-6-21-18(24)9-13-8-15-14-7-12(22-19(25)11-26-2)4-5-16(14)28-20(15)17(10-23)27-13/h4-5,7,13,15,17,20,23H,3,6,8-11H2,1-2H3,(H,21,24)(H,22,25)/t13-,15+,17-,20-/m1/s1	ZWJVDCAUIXXXGX-YBLQJDFOSA-N	392.194736636							103149
BRD-K97468443	LSM-14418		54646255	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21+,25+,27-/m0/s1	FEEKZGTVSGSFLP-UTMJBXDJSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K97468443	BRD-K97468443-001-01-1	Broad Institute of MIT and Harvard	BRD-K97468443			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C28H27N3O7/c32-14-25-27-21(11-19(37-25)12-26(33)30-13-18-3-1-2-8-29-18)20-10-17(5-7-22(20)38-27)31-28(34)16-4-6-23-24(9-16)36-15-35-23/h1-10,19,21,25,27,32H,11-15H2,(H,30,33)(H,31,34)/t19-,21+,25+,27-/m0/s1	FEEKZGTVSGSFLP-UTMJBXDJSA-N	517.184900234							103073
BRD-K99339232	LSM-14531		54646289	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20-,24+,26+/m1/s1	GAKFIKLLFOVZGV-ODQDCYGBSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K99339232	BRD-K99339232-001-01-7	Broad Institute of MIT and Harvard	BRD-K99339232			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20-,24+,26+/m1/s1	GAKFIKLLFOVZGV-ODQDCYGBSA-N	497.232599354							103186
BRD-K96238295	LSM-14333		54646331	InChI=1S/C23H35N3O4/c1-25(2)16-6-7-20-18(12-16)19-13-17(29-21(15-27)23(19)30-20)14-22(28)24-8-11-26-9-4-3-5-10-26/h6-7,12,17,19,21,23,27H,3-5,8-11,13-15H2,1-2H3,(H,24,28)/t17-,19-,21-,23+/m1/s1	HWEAQBDEOFZYHR-LHWDRQQYSA-N	CN(C)c1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCCN4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K96238295	BRD-K96238295-001-01-8	Broad Institute of MIT and Harvard	BRD-K96238295			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCCN4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C23H35N3O4/c1-25(2)16-6-7-20-18(12-16)19-13-17(29-21(15-27)23(19)30-20)14-22(28)24-8-11-26-9-4-3-5-10-26/h6-7,12,17,19,21,23,27H,3-5,8-11,13-15H2,1-2H3,(H,24,28)/t17-,19-,21-,23+/m1/s1	HWEAQBDEOFZYHR-LHWDRQQYSA-N	417.26275663							102987
BRD-K11724909	LSM-9140		54646187	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26-,28+/m0/s1	CRNISVWSFUFTQR-YFRXONQNSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@H](CO)O2	BroadT	BRD-K11724909	BRD-K11724909-001-01-7	Broad Institute of MIT and Harvard	BRD-K11724909			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23-,26-,28+/m0/s1	CRNISVWSFUFTQR-YFRXONQNSA-N	556.167950178							97761
BRD-K82370171	LSM-13462		54646184	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22-,25+,27+/m0/s1	FSAONXZLMNAVLZ-ZTQIFVIOSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCOCC5)cc34)[C@@H](CO)O2	BroadT	BRD-K82370171	BRD-K82370171-001-01-4	Broad Institute of MIT and Harvard	BRD-K82370171			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	InChI=1S/C28H34N2O7/c1-34-23-5-3-2-4-18(23)15-29-26(32)14-20-13-22-21-12-19(30-28(33)17-8-10-35-11-9-17)6-7-24(21)37-27(22)25(16-31)36-20/h2-7,12,17,20,22,25,27,31H,8-11,13-16H2,1H3,(H,29,32)(H,30,33)/t20-,22-,25+,27+/m0/s1	FSAONXZLMNAVLZ-ZTQIFVIOSA-N	510.236601448							102102
BRD-K03735855	LSM-8662		54646123	InChI=1S/C30H30N2O7/c1-17(18-5-3-2-4-6-18)31-28(34)14-21-13-23-22-12-20(8-10-24(22)39-29(23)27(15-33)38-21)32-30(35)19-7-9-25-26(11-19)37-16-36-25/h2-12,17,21,23,27,29,33H,13-16H2,1H3,(H,31,34)(H,32,35)/t17-,21-,23-,27-,29+/m1/s1	PKVMSJKEIKOOIO-PEPHUQDDSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1)c6ccccc6	BroadT	BRD-K03735855	BRD-K03735855-001-01-7	Broad Institute of MIT and Harvard	BRD-K03735855			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C30H30N2O7/c1-17(18-5-3-2-4-6-18)31-28(34)14-21-13-23-22-12-20(8-10-24(22)39-29(23)27(15-33)38-21)32-30(35)19-7-9-25-26(11-19)37-16-36-25/h2-12,17,21,23,27,29,33H,13-16H2,1H3,(H,31,34)(H,32,35)/t17-,21-,23-,27-,29+/m1/s1	PKVMSJKEIKOOIO-PEPHUQDDSA-N	530.20530132							97283
BRD-K32480492	LSM-10400		54646400	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24+,26+/m1/s1	XBPCNRNKOXKUQA-GUAAGHCTSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K32480492	BRD-K32480492-001-01-4	Broad Institute of MIT and Harvard	BRD-K32480492			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24+,26+/m1/s1	XBPCNRNKOXKUQA-GUAAGHCTSA-N	464.231122144							99021
BRD-K06373442	LSM-8798		54646188	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26+,28-/m0/s1	CRNISVWSFUFTQR-NZIYMESCSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34)[C@@H](CO)O2	BroadT	BRD-K06373442	BRD-K06373442-001-01-4	Broad Institute of MIT and Harvard	BRD-K06373442			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C28H29FN2O7S/c1-36-24-5-3-2-4-17(24)15-30-27(33)14-20-13-23-22-12-19(8-11-25(22)38-28(23)26(16-32)37-20)31-39(34,35)21-9-6-18(29)7-10-21/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26+,28-/m0/s1	CRNISVWSFUFTQR-NZIYMESCSA-N	556.167950178							97419
BRD-K72373843	LSM-12868		54646428	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18-,20+,23+/m1/s1	MRLAOALNSBFOMY-DUCQWWKISA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)N4CCCCC4)C[C@@H]3c2c1	BroadT	BRD-K72373843	BRD-K72373843-001-01-8	Broad Institute of MIT and Harvard	BRD-K72373843			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C23H33N3O5/c1-25(2)13-21(28)24-15-6-7-19-17(10-15)18-11-16(30-20(14-27)23(18)31-19)12-22(29)26-8-4-3-5-9-26/h6-7,10,16,18,20,23,27H,3-5,8-9,11-14H2,1-2H3,(H,24,28)/t16-,18-,20+,23+/m1/s1	MRLAOALNSBFOMY-DUCQWWKISA-N	431.242021186							101505
BRD-K08432506	LSM-8937		54646329	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24-,26+,28+/m0/s1	AJGJMULVCJFZBU-SFNAGVRGSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K08432506	BRD-K08432506-001-01-9	Broad Institute of MIT and Harvard	BRD-K08432506			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24-,26+,28+/m0/s1	AJGJMULVCJFZBU-SFNAGVRGSA-N	506.241686828							97558
BRD-K69696272	LSM-12681		54646285	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20+,24+,26-/m1/s1	GAKFIKLLFOVZGV-SNXCTZGFSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K69696272	BRD-K69696272-001-01-7	Broad Institute of MIT and Harvard	BRD-K69696272			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C27H32FN3O5/c28-21-8-4-5-9-22(21)31-27(34)30-17-10-11-23-19(12-17)20-13-18(35-24(15-32)26(20)36-23)14-25(33)29-16-6-2-1-3-7-16/h4-5,8-12,16,18,20,24,26,32H,1-3,6-7,13-15H2,(H,29,33)(H2,30,31,34)/t18-,20+,24+,26-/m1/s1	GAKFIKLLFOVZGV-SNXCTZGFSA-N	497.232599354							101315
BRD-K30613842	LSM-10269		54646315	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26-,28-/m0/s1	UQAGOAYYXRCKNS-BXFJNEMGSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NCc5ccccc5F)C[C@@H]4c3c2	BroadT	BRD-K30613842	BRD-K30613842-001-01-9	Broad Institute of MIT and Harvard	BRD-K30613842			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccccc4F)O[C@H]3CO)c2c1	InChI=1S/C28H29FN2O7S/c1-36-19-6-4-7-21(12-19)39(34,35)31-18-9-10-25-22(11-18)23-13-20(37-26(16-32)28(23)38-25)14-27(33)30-15-17-5-2-3-8-24(17)29/h2-12,20,23,26,28,31-32H,13-16H2,1H3,(H,30,33)/t20-,23+,26-,28-/m0/s1	UQAGOAYYXRCKNS-BXFJNEMGSA-N	556.167950178							98890
BRD-K77621546	LSM-13172		54646387	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12+,14+,16-/m0/s1	STSQWNRYWIJNCW-SFXCNKRSSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K77621546	BRD-K77621546-001-01-5	Broad Institute of MIT and Harvard	BRD-K77621546			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12+,14+,16-/m0/s1	STSQWNRYWIJNCW-SFXCNKRSSA-N	371.103872712							101810
BRD-K94878334	LSM-14246		54646198	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17-,19+,21+/m0/s1	BVQWYDMOVFWUGX-ICSUOEFDSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K94878334	BRD-K94878334-001-01-6	Broad Institute of MIT and Harvard	BRD-K94878334			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17-,19+,21+/m0/s1	BVQWYDMOVFWUGX-ICSUOEFDSA-N	412.163436508							102900
BRD-K23775758	LSM-9864		54646306	InChI=1S/C29H31N3O6/c1-36-24-5-3-2-4-19(24)16-31-27(34)15-21-14-23-22-13-20(32-28(35)12-18-8-10-30-11-9-18)6-7-25(22)38-29(23)26(17-33)37-21/h2-11,13,21,23,26,29,33H,12,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,26+,29-/m0/s1	ZGXOXQUBSYKGRY-WFGDJLRYSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Cc5ccncc5)cc34)[C@@H](CO)O2	BroadT	BRD-K23775758	BRD-K23775758-001-01-7	Broad Institute of MIT and Harvard	BRD-K23775758			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@@H](CO)O1	InChI=1S/C29H31N3O6/c1-36-24-5-3-2-4-19(24)16-31-27(34)15-21-14-23-22-13-20(32-28(35)12-18-8-10-30-11-9-18)6-7-25(22)38-29(23)26(17-33)37-21/h2-11,13,21,23,26,29,33H,12,14-17H2,1H3,(H,31,34)(H,32,35)/t21-,23+,26+,29-/m0/s1	ZGXOXQUBSYKGRY-WFGDJLRYSA-N	517.221285742							98485
BRD-K10120618	LSM-9046		54646238	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22+,24+,26-,28-/m0/s1	HZCFRKFPOJNJBV-PPBMLJEXSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K10120618	BRD-K10120618-001-01-1	Broad Institute of MIT and Harvard	BRD-K10120618			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C30H30F3N3O5/c1-17(18-5-3-2-4-6-18)34-27(38)15-22-14-24-23-13-21(11-12-25(23)41-28(24)26(16-37)40-22)36-29(39)35-20-9-7-19(8-10-20)30(31,32)33/h2-13,17,22,24,26,28,37H,14-16H2,1H3,(H,34,38)(H2,35,36,39)/t17-,22+,24+,26-,28-/m0/s1	HZCFRKFPOJNJBV-PPBMLJEXSA-N	569.21375569							97667
BRD-K16063494	LSM-9394		54646352	InChI=1S/C28H27F3N4O5/c29-28(30,31)17-3-5-18(6-4-17)34-27(38)35-19-7-8-23-21(10-19)22-11-20(39-24(15-36)26(22)40-23)12-25(37)33-14-16-2-1-9-32-13-16/h1-10,13,20,22,24,26,36H,11-12,14-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24-,26+/m1/s1	IMICHJYMUCZKDW-DFICYWPVSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K16063494	BRD-K16063494-001-01-6	Broad Institute of MIT and Harvard	BRD-K16063494			OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)17-3-5-18(6-4-17)34-27(38)35-19-7-8-23-21(10-19)22-11-20(39-24(15-36)26(22)40-23)12-25(37)33-14-16-2-1-9-32-13-16/h1-10,13,20,22,24,26,36H,11-12,14-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24-,26+/m1/s1	IMICHJYMUCZKDW-DFICYWPVSA-N	556.193354604							98015
BRD-K68536005	LSM-12609		54646290	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22-,25-,27+/m1/s1	ZUHKGHKDCFDVCR-GKYRZQBGSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K68536005	BRD-K68536005-001-01-0	Broad Institute of MIT and Harvard	BRD-K68536005			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C29H26F5N3O5/c30-17-3-7-23(31)15(9-17)13-35-26(39)12-20-11-22-21-10-19(6-8-24(21)42-27(22)25(14-38)41-20)37-28(40)36-18-4-1-16(2-5-18)29(32,33)34/h1-10,20,22,25,27,38H,11-14H2,(H,35,39)(H2,36,37,40)/t20-,22-,25-,27+/m1/s1	ZUHKGHKDCFDVCR-GKYRZQBGSA-N	591.179261962							101241
BRD-K15980298	LSM-9386		54646391	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12-,14+,16+/m0/s1	STSQWNRYWIJNCW-PNEXNCLXSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K15980298	BRD-K15980298-001-01-0	Broad Institute of MIT and Harvard	BRD-K15980298			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C16H21NO7S/c1-22-15(19)7-10-6-12-11-5-9(17-25(2,20)21)3-4-13(11)24-16(12)14(8-18)23-10/h3-5,10,12,14,16-18H,6-8H2,1-2H3/t10-,12-,14+,16+/m0/s1	STSQWNRYWIJNCW-PNEXNCLXSA-N	371.103872712							98007
BRD-K69438871	LSM-12662		54646197	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17+,19-,21-/m1/s1	BVQWYDMOVFWUGX-UKHYVGRKSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@@H](CO)O1	BroadT	BRD-K69438871	BRD-K69438871-001-01-9	Broad Institute of MIT and Harvard	BRD-K69438871			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4)cc23)[C@@H](CO)O1	InChI=1S/C22H24N2O6/c1-28-20(26)11-15-10-17-16-9-14(24-22(27)23-13-5-3-2-4-6-13)7-8-18(16)30-21(17)19(12-25)29-15/h2-9,15,17,19,21,25H,10-12H2,1H3,(H2,23,24,27)/t15-,17+,19-,21-/m1/s1	BVQWYDMOVFWUGX-UKHYVGRKSA-N	412.163436508							101296
BRD-K62846431	LSM-12250		54646242	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23+,25+,27-/m1/s1	FWDZHOQSJMEDFJ-WFHOOFKDSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NCc5ccccn5)C[C@H]4c3c2)cc1	BroadT	BRD-K62846431	BRD-K62846431-001-01-3	Broad Institute of MIT and Harvard	BRD-K62846431			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)NCc5ccccn5)O[C@H]4CO)c3c2)cc1	InChI=1S/C28H30N4O6/c1-36-20-8-5-17(6-9-20)31-28(35)32-18-7-10-24-22(12-18)23-13-21(37-25(16-33)27(23)38-24)14-26(34)30-15-19-4-2-3-11-29-19/h2-12,21,23,25,27,33H,13-16H2,1H3,(H,30,34)(H2,31,32,35)/t21-,23+,25+,27-/m1/s1	FWDZHOQSJMEDFJ-WFHOOFKDSA-N	518.21653472							100876
BRD-K00349278	LSM-8448		54646393	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24-,26+/m1/s1	XBPCNRNKOXKUQA-DFICYWPVSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K00349278	BRD-K00349278-001-01-9	Broad Institute of MIT and Harvard	BRD-K00349278			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-26-22(14-20(33-24)15-25(31)28-12-11-17-5-2-1-3-6-17)21-13-19(9-10-23(21)34-26)29-27(32)18-7-4-8-18/h1-3,5-6,9-10,13,18,20,22,24,26,30H,4,7-8,11-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24-,26+/m1/s1	XBPCNRNKOXKUQA-DFICYWPVSA-N	464.231122144							97069
BRD-K30891382	LSM-10292		54646350	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22-,24+,26+/m0/s1	OQZDFPDHTDCUCP-LFSKCEFNSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)N5CCN(C)CC5)C[C@H]4c3c2)cc1	BroadT	BRD-K30891382	BRD-K30891382-001-01-7	Broad Institute of MIT and Harvard	BRD-K30891382			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)N5CCN(C)CC5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C27H34N4O6/c1-30-9-11-31(12-10-30)25(33)15-20-14-22-21-13-18(5-8-23(21)37-26(22)24(16-32)36-20)29-27(34)28-17-3-6-19(35-2)7-4-17/h3-8,13,20,22,24,26,32H,9-12,14-16H2,1-2H3,(H2,28,29,34)/t20-,22-,24+,26+/m0/s1	OQZDFPDHTDCUCP-LFSKCEFNSA-N	510.247834848							98913
BRD-K95647562	LSM-14294		54646367	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18+,20-,22-/m0/s1	LWPDCVYPXSZOFH-UPSSIMKTSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(Cl)cc4)C[C@@H]3c2c1	BroadT	BRD-K95647562	BRD-K95647562-001-01-7	Broad Institute of MIT and Harvard	BRD-K95647562			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1	InChI=1S/C22H25ClN2O6S/c1-32(28,29)25-15-6-7-19-17(8-15)18-9-16(30-20(12-26)22(18)31-19)10-21(27)24-11-13-2-4-14(23)5-3-13/h2-8,16,18,20,22,25-26H,9-12H2,1H3,(H,24,27)/t16-,18+,20-,22-/m0/s1	LWPDCVYPXSZOFH-UPSSIMKTSA-N	480.11218494							102948
BRD-K82736385	LSM-13480		54646420	InChI=1S/C28H28FN3O5/c29-19-3-1-2-18(10-19)15-31-26(34)14-21-13-23-22-12-20(32-27(35)11-17-6-8-30-9-7-17)4-5-24(22)37-28(23)25(16-33)36-21/h1-10,12,21,23,25,28,33H,11,13-16H2,(H,31,34)(H,32,35)/t21-,23-,25+,28+/m0/s1	JTKPUOMASGTZAW-GUAPPOABSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K82736385	BRD-K82736385-001-01-8	Broad Institute of MIT and Harvard	BRD-K82736385			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H28FN3O5/c29-19-3-1-2-18(10-19)15-31-26(34)14-21-13-23-22-12-20(32-27(35)11-17-6-8-30-9-7-17)4-5-24(22)37-28(23)25(16-33)36-21/h1-10,12,21,23,25,28,33H,11,13-16H2,(H,31,34)(H,32,35)/t21-,23-,25+,28+/m0/s1	JTKPUOMASGTZAW-GUAPPOABSA-N	505.201299226							102120
BRD-K80059205	LSM-13316		54646276	InChI=1S/C20H28N2O4/c1-22(2)13-5-6-17-15(7-13)16-8-14(25-18(11-23)20(16)26-17)9-19(24)21-10-12-3-4-12/h5-7,12,14,16,18,20,23H,3-4,8-11H2,1-2H3,(H,21,24)/t14-,16-,18-,20+/m1/s1	JLJMCVQNTFDIRA-ODZKNYGOSA-N	CN(C)c1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K80059205	BRD-K80059205-001-01-5	Broad Institute of MIT and Harvard	BRD-K80059205			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCC4CC4)O[C@@H]3CO)c2c1	InChI=1S/C20H28N2O4/c1-22(2)13-5-6-17-15(7-13)16-8-14(25-18(11-23)20(16)26-17)9-19(24)21-10-12-3-4-12/h5-7,12,14,16,18,20,23H,3-4,8-11H2,1-2H3,(H,21,24)/t14-,16-,18-,20+/m1/s1	JLJMCVQNTFDIRA-ODZKNYGOSA-N	360.204907396							101955
BRD-K71732099	LSM-12818		54646330	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24-,26+,28+/m1/s1	AJGJMULVCJFZBU-GJPOJPNFSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCOCC6)cc45	BroadT	BRD-K71732099	BRD-K71732099-001-01-7	Broad Institute of MIT and Harvard	BRD-K71732099			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C29H34N2O6/c32-17-26-28-24(14-22(36-26)15-27(33)31-10-7-18-3-1-2-4-20(18)16-31)23-13-21(5-6-25(23)37-28)30-29(34)19-8-11-35-12-9-19/h1-6,13,19,22,24,26,28,32H,7-12,14-17H2,(H,30,34)/t22-,24-,26+,28+/m1/s1	AJGJMULVCJFZBU-GJPOJPNFSA-N	506.241686828							101455
BRD-K98463649	LSM-14477		54646280	InChI=1S/C20H28N2O4/c1-22(2)13-5-6-17-15(7-13)16-8-14(25-18(11-23)20(16)26-17)9-19(24)21-10-12-3-4-12/h5-7,12,14,16,18,20,23H,3-4,8-11H2,1-2H3,(H,21,24)/t14-,16+,18-,20-/m0/s1	JLJMCVQNTFDIRA-HUOQQOJOSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCC4CC4)C[C@@H]3c2c1	BroadT	BRD-K98463649	BRD-K98463649-001-01-3	Broad Institute of MIT and Harvard	BRD-K98463649			CN(C)c1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCC4CC4)O[C@H]3CO)c2c1	InChI=1S/C20H28N2O4/c1-22(2)13-5-6-17-15(7-13)16-8-14(25-18(11-23)20(16)26-17)9-19(24)21-10-12-3-4-12/h5-7,12,14,16,18,20,23H,3-4,8-11H2,1-2H3,(H,21,24)/t14-,16+,18-,20-/m0/s1	JLJMCVQNTFDIRA-HUOQQOJOSA-N	360.204907396							103132
BRD-K99723587	LSM-14555		54646354	InChI=1S/C28H27F3N4O5/c29-28(30,31)17-3-5-18(6-4-17)34-27(38)35-19-7-8-23-21(10-19)22-11-20(39-24(15-36)26(22)40-23)12-25(37)33-14-16-2-1-9-32-13-16/h1-10,13,20,22,24,26,36H,11-12,14-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24+,26-/m0/s1	IMICHJYMUCZKDW-RXDHMRHRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K99723587	BRD-K99723587-001-01-3	Broad Institute of MIT and Harvard	BRD-K99723587			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)17-3-5-18(6-4-17)34-27(38)35-19-7-8-23-21(10-19)22-11-20(39-24(15-36)26(22)40-23)12-25(37)33-14-16-2-1-9-32-13-16/h1-10,13,20,22,24,26,36H,11-12,14-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24+,26-/m0/s1	IMICHJYMUCZKDW-RXDHMRHRSA-N	556.193354604							131232
BRD-K57064803	LSM-6841		54646218	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25-,27-,29+/m1/s1	MRJCPWMBHXTRFB-ACEYUQJJSA-N	CN(C)c1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@@H]3c2c1	BroadT	BRD-K57064803	BRD-K57064803-001-01-0	Broad Institute of MIT and Harvard	BRD-K57064803			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@@H]3CO)c2c1	InChI=1S/C29H32N2O5/c1-31(2)20-10-13-26-24(14-20)25-15-23(35-27(18-32)29(25)36-26)16-28(33)30-17-19-8-11-22(12-9-19)34-21-6-4-3-5-7-21/h3-14,23,25,27,29,32H,15-18H2,1-2H3,(H,30,33)/t23-,25-,27-,29+/m1/s1	MRJCPWMBHXTRFB-ACEYUQJJSA-N	488.231122144							95462
BRD-K91849632	LSM-14074		54637845	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21-,26-/m1/s1	NRKUZRFIJSCRHL-IPVFLDMMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K91849632	BRD-K91849632-001-01-9	Broad Institute of MIT and Harvard	BRD-K91849632			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21-,26-/m1/s1	NRKUZRFIJSCRHL-IPVFLDMMSA-N	579.251540024							102728
BRD-K17903303	LSM-9505		54637861	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27-/m1/s1	VHVNEVJWYRMESY-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K17903303	BRD-K17903303-001-01-3	Broad Institute of MIT and Harvard	BRD-K17903303			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27-/m1/s1	VHVNEVJWYRMESY-PBDKAQRYSA-N	487.247106566							98126
BRD-K58098983	LSM-11937		54637971	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24+,30+/m0/s1	VTQGPDBOURHJNB-QXFFIUSXSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K58098983	BRD-K58098983-001-01-9	Broad Institute of MIT and Harvard	BRD-K58098983			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24+,30+/m0/s1	VTQGPDBOURHJNB-QXFFIUSXSA-N	514.283157716							100563
BRD-K59324394	LSM-12013		54638016	InChI=1S/C31H42N4O4/c1-21-17-35(22(2)19-36)31(38)30-29(25-13-9-10-14-26(25)34(30)6)24-12-8-7-11-23(24)20-39-27(21)18-33(5)28(37)15-16-32(3)4/h7-14,21-22,27,36H,15-20H2,1-6H3/t21-,22-,27+/m1/s1	UPHSEAQPRHOHRJ-LOYIFYEOSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K59324394	BRD-K59324394-001-01-1	Broad Institute of MIT and Harvard	BRD-K59324394			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H42N4O4/c1-21-17-35(22(2)19-36)31(38)30-29(25-13-9-10-14-26(25)34(30)6)24-12-8-7-11-23(24)20-39-27(21)18-33(5)28(37)15-16-32(3)4/h7-14,21-22,27,36H,15-20H2,1-6H3/t21-,22-,27+/m1/s1	UPHSEAQPRHOHRJ-LOYIFYEOSA-N	534.320605864							100639
BRD-K07462139	LSM-8870		56835264	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-31(3)17-23-9-8-11-25(34)15-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22-,29-/m0/s1	WRXJNAGTDQYTEO-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K07462139	BRD-K07462139-001-01-2	Broad Institute of MIT and Harvard	BRD-K07462139			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(O)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-31(3)17-23-9-8-11-25(34)15-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22-,29-/m0/s1	WRXJNAGTDQYTEO-SYZUXVNWSA-N	488.267507652							97491
CHEMBL2361356	LSM-12022	BRD-K59453266, SID131434185	54637908	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24-,30-/m0/s1	BENJSVFNXVDSQO-JYUFKMNQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K59453266	BRD-K59453266-001-01-3	Broad Institute of MIT and Harvard	BRD-K59453266			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24-,30-/m0/s1	BENJSVFNXVDSQO-JYUFKMNQSA-N	553.294056758							100648
BRD-K07479774	LSM-8871		56835453	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25+,31+/m0/s1	WVFRUYXRTWIHMU-DTTPJGKXSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K07479774	BRD-K07479774-001-01-6	Broad Institute of MIT and Harvard	BRD-K07479774			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25+,31+/m0/s1	WVFRUYXRTWIHMU-DTTPJGKXSA-N	582.320605864							97492
BRD-K99026889	LSM-14509		56835429	InChI=1S/C31H42N4O4/c1-21-17-35(22(2)19-36)31(38)30-29(25-13-9-10-14-26(25)34(30)6)24-12-8-7-11-23(24)20-39-27(21)18-33(5)28(37)15-16-32(3)4/h7-14,21-22,27,36H,15-20H2,1-6H3/t21-,22-,27+/m0/s1	UPHSEAQPRHOHRJ-BCQCSXDESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K99026889	BRD-K99026889-001-01-6	Broad Institute of MIT and Harvard	BRD-K99026889			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H42N4O4/c1-21-17-35(22(2)19-36)31(38)30-29(25-13-9-10-14-26(25)34(30)6)24-12-8-7-11-23(24)20-39-27(21)18-33(5)28(37)15-16-32(3)4/h7-14,21-22,27,36H,15-20H2,1-6H3/t21-,22-,27+/m0/s1	UPHSEAQPRHOHRJ-BCQCSXDESA-N	534.320605864							103164
BRD-K53467073	LSM-11689		56835470	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28+/m1/s1	SHOKCNHESYLQAS-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K53467073	BRD-K53467073-001-01-2	Broad Institute of MIT and Harvard	BRD-K53467073			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28+/m1/s1	SHOKCNHESYLQAS-GGJMMHKRSA-N	556.179870576							100314
CHEMBL2360032	LSM-12596	BRD-K68327489, SID134962002	56835268	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-32(3)17-23-9-8-11-25(31)15-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22-,29-/m0/s1	ZIZYGTWNPVBARE-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K68327489	BRD-K68327489-001-01-9	Broad Institute of MIT and Harvard	BRD-K68327489			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-32(3)17-23-9-8-11-25(31)15-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22-,29-/m0/s1	ZIZYGTWNPVBARE-SYZUXVNWSA-N	490.2631712							101228
BRD-K50404714	LSM-11499		54637938	InChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19+,24-/m1/s1	BZAPUCLBFKATKI-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K50404714	BRD-K50404714-001-01-3	Broad Institute of MIT and Harvard	BRD-K50404714			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19+,24-/m1/s1	BZAPUCLBFKATKI-YDIMBITNSA-N	581.217126508							100120
BRD-K38865695	LSM-10782		54637987	InChI=1S/C24H32N2O3/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-29-23(17)14-25(3)4/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	ICBPOKCISFMJKJ-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K38865695	BRD-K38865695-001-01-5	Broad Institute of MIT and Harvard	BRD-K38865695			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C24H32N2O3/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-29-23(17)14-25(3)4/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	ICBPOKCISFMJKJ-IXFSTUDKSA-N	396.241292904							99403
BRD-K39321814	LSM-10813		56835351	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22-,27+/m0/s1	QLIZXZIZGKFZES-BCQCSXDESA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K39321814	BRD-K39321814-001-01-4	Broad Institute of MIT and Harvard	BRD-K39321814			CC(C)COC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22-,27+/m0/s1	QLIZXZIZGKFZES-BCQCSXDESA-N	535.304621442							99434
BRD-K27363274	LSM-10080		56835510	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28+/m0/s1	BXWHKXPVJGEBOL-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K27363274	BRD-K27363274-001-01-3	Broad Institute of MIT and Harvard	BRD-K27363274			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28+/m0/s1	BXWHKXPVJGEBOL-RXYILKCJSA-N	540.273655672							98701
BRD-K29136476	LSM-10194		56835504	InChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20+,26+/m1/s1	ROXJHZXKWGUYER-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K29136476	BRD-K29136476-001-01-7	Broad Institute of MIT and Harvard	BRD-K29136476			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20+,26+/m1/s1	ROXJHZXKWGUYER-GOHWNWGWSA-N	528.175263524							98815
BRD-K51072560	LSM-11550		56835344	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30+/m0/s1	LTECXWQWCPQLLD-ZTNZZFSWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K51072560	BRD-K51072560-001-01-2	Broad Institute of MIT and Harvard	BRD-K51072560			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30+/m0/s1	LTECXWQWCPQLLD-ZTNZZFSWSA-N	569.288971378							100173
BRD-K39063656	LSM-10797		54637932	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28-/m1/s1	APRVPIVHITUHLQ-UMQWNRPGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K39063656	BRD-K39063656-001-01-3	Broad Institute of MIT and Harvard	BRD-K39063656			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28-/m1/s1	APRVPIVHITUHLQ-UMQWNRPGSA-N	540.209421066							99418
CHEMBL2357440	LSM-11484	BRD-K50195301, SID131434251	54637974	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24-,30-/m0/s1	VTQGPDBOURHJNB-PUMORYBASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K50195301	BRD-K50195301-001-01-6	Broad Institute of MIT and Harvard	BRD-K50195301			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24-,30-/m0/s1	VTQGPDBOURHJNB-PUMORYBASA-N	514.283157716							100105
CHEMBL2355475	LSM-31513	SID131434114, BRD-K14087339	54637837	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24+,31-/m0/s1	GHOSBDATJBJZOG-JLELKNTQSA-N	COc1ccc(CNC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K14087339	BRD-K14087339-001-01-6	Broad Institute of MIT and Harvard	BRD-K14087339			COc1ccc(CNC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24+,31-/m0/s1	GHOSBDATJBJZOG-JLELKNTQSA-N	598.315520484							120070
BRD-K96522480	LSM-14347		56835511	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22-,28+/m1/s1	FOMDXHZXOKRLRD-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K96522480	BRD-K96522480-001-01-0	Broad Institute of MIT and Harvard	BRD-K96522480			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22-,28+/m1/s1	FOMDXHZXOKRLRD-XJGOYTCSSA-N	507.309706822							103001
BRD-K02306470	LSM-8575		54637951	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28+/m1/s1	BXWHKXPVJGEBOL-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K02306470	BRD-K02306470-001-01-3	Broad Institute of MIT and Harvard	BRD-K02306470			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28+/m1/s1	BXWHKXPVJGEBOL-XJGOYTCSSA-N	540.273655672							97196
CHEMBL2362549	LSM-14003	BRD-K90528929, SID134961989	56835255	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29+/m1/s1	HIWUQZOVKTUVHW-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K90528929	BRD-K90528929-001-01-2	Broad Institute of MIT and Harvard	BRD-K90528929			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29+/m1/s1	HIWUQZOVKTUVHW-BXOOBUKZSA-N	572.279883904							102656
BRD-K51832753	LSM-11601		56835481	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20-,27+/m0/s1	LBGXIXNVJUEMSO-OWOAZTCBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K51832753	BRD-K51832753-001-01-6	Broad Institute of MIT and Harvard	BRD-K51832753			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20-,27+/m0/s1	LBGXIXNVJUEMSO-OWOAZTCBSA-N	558.284220356							100224
BRD-K29280435	LSM-10201		56835360	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25-,31+/m0/s1	WVFRUYXRTWIHMU-TXHDDHBJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K29280435	BRD-K29280435-001-01-3	Broad Institute of MIT and Harvard	BRD-K29280435			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25-,31+/m0/s1	WVFRUYXRTWIHMU-TXHDDHBJSA-N	582.320605864							98822
BRD-K83468907	LSM-13531		54637997	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28-/m1/s1	PCQGWFREXHAZIT-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K83468907	BRD-K83468907-001-01-6	Broad Institute of MIT and Harvard	BRD-K83468907			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28-/m1/s1	PCQGWFREXHAZIT-RZIGYZOXSA-N	593.235970172							102173
CHEMBL2360348	LSM-10857	BRD-K39844985, SID134962092	56835358	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-14-7-8-15-28(27)35(31)4)26-13-6-5-10-23(26)20-41-29(21)18-34(3)42(39,40)25-12-9-11-24(33)16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29+/m0/s1	QBEIQJOXWRLXRW-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K39844985	BRD-K39844985-001-01-8	Broad Institute of MIT and Harvard	BRD-K39844985			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-14-7-8-15-28(27)35(31)4)26-13-6-5-10-23(26)20-41-29(21)18-34(3)42(39,40)25-12-9-11-24(33)16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29+/m0/s1	QBEIQJOXWRLXRW-IHMCZWCLSA-N	593.235970172							99478
BRD-K65222708	LSM-12406		54637927	InChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20+,26-/m0/s1	ROXJHZXKWGUYER-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K65222708	BRD-K65222708-001-01-0	Broad Institute of MIT and Harvard	BRD-K65222708			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20+,26-/m0/s1	ROXJHZXKWGUYER-UNVFRBQDSA-N	528.175263524							101033
BRD-K40141271	LSM-10879		54638010	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22+,28-/m1/s1	KEOFNYFHDQHRAV-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K40141271	BRD-K40141271-001-01-9	Broad Institute of MIT and Harvard	BRD-K40141271			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22+,28-/m1/s1	KEOFNYFHDQHRAV-RZIGYZOXSA-N	473.26784201							99500
BRD-K26576471	LSM-10038		54637977	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24-,30-/m1/s1	VTQGPDBOURHJNB-UTSVKBTJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K26576471	BRD-K26576471-001-01-2	Broad Institute of MIT and Harvard	BRD-K26576471			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24-,30-/m1/s1	VTQGPDBOURHJNB-UTSVKBTJSA-N	514.283157716							98659
BRD-K25542589	LSM-9980		56835321	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25-,31+/m0/s1	WVFRUYXRTWIHMU-QNBZCSHPSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K25542589	BRD-K25542589-001-01-4	Broad Institute of MIT and Harvard	BRD-K25542589			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25-,31+/m0/s1	WVFRUYXRTWIHMU-QNBZCSHPSA-N	582.320605864							98601
BRD-K85068586	LSM-13624		56835246	InChI=1S/C27H36N2O3/c1-19-14-29(20(2)17-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-22(23)18-32-26(19)16-28(3)15-21-12-13-21/h4-11,19-21,26,30H,12-18H2,1-3H3/t19-,20-,26-/m0/s1	XOTAGUVNSWBDBY-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K85068586	BRD-K85068586-001-01-0	Broad Institute of MIT and Harvard	BRD-K85068586			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H36N2O3/c1-19-14-29(20(2)17-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-22(23)18-32-26(19)16-28(3)15-21-12-13-21/h4-11,19-21,26,30H,12-18H2,1-3H3/t19-,20-,26-/m0/s1	XOTAGUVNSWBDBY-DYLHXGEVSA-N	436.272593032							102271
BRD-K97185232	LSM-14401		56835466	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20-,26+/m0/s1	YAQCSVWFCUIVLJ-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K97185232	BRD-K97185232-001-01-6	Broad Institute of MIT and Harvard	BRD-K97185232			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20-,26+/m0/s1	YAQCSVWFCUIVLJ-CUVVAGTFSA-N	503.278406694							103055
CHEMBL3183232	LSM-9626	BRD-K19815647	56835303	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21+,27+/m1/s1	XFTZCOPLMXQWPM-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K19815647	BRD-K19815647-001-01-2	Broad Institute of MIT and Harvard	BRD-K19815647			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21+,27+/m1/s1	XFTZCOPLMXQWPM-BUEREQSYSA-N	581.20181263							98247
BRD-K05032830	LSM-8733		54637955	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20+,27-/m0/s1	LBGXIXNVJUEMSO-VKIDHGPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K05032830	BRD-K05032830-001-01-7	Broad Institute of MIT and Harvard	BRD-K05032830			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20+,27-/m0/s1	LBGXIXNVJUEMSO-VKIDHGPPSA-N	558.284220356							97354
BRD-K07253943	LSM-8855		54637894	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27-/m0/s1	QWRJLEHIBFFHOL-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K07253943	BRD-K07253943-001-01-1	Broad Institute of MIT and Harvard	BRD-K07253943			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27-/m0/s1	QWRJLEHIBFFHOL-ISCCLHIJSA-N	540.209421066							97476
CHEMBL2358082	LSM-9507	BRD-K17910135, SID131434281	54638004	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20+,26-/m0/s1	YAQCSVWFCUIVLJ-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K17910135	BRD-K17910135-001-01-2	Broad Institute of MIT and Harvard	BRD-K17910135			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20+,26-/m0/s1	YAQCSVWFCUIVLJ-UNVFRBQDSA-N	503.278406694							98128
BRD-K94161851	LSM-14197		54637996	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28-/m0/s1	PCQGWFREXHAZIT-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K94161851	BRD-K94161851-001-01-0	Broad Institute of MIT and Harvard	BRD-K94161851			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28-/m0/s1	PCQGWFREXHAZIT-TYPXCFOJSA-N	593.235970172							102851
BRD-K25068941	LSM-9952		56835282	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21+,26+/m1/s1	IEBNCDQMHLDDBS-SWYRRKHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K25068941	BRD-K25068941-001-01-3	Broad Institute of MIT and Harvard	BRD-K25068941			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21+,26+/m1/s1	IEBNCDQMHLDDBS-SWYRRKHMSA-N	481.294056758							98573
CHEMBL2358155	LSM-13567	BRD-K84079653, SID134962126	56835392	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22+,27+/m0/s1	QLIZXZIZGKFZES-OREGWCPLSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K84079653	BRD-K84079653-001-01-6	Broad Institute of MIT and Harvard	BRD-K84079653			CC(C)COC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22+,27+/m0/s1	QLIZXZIZGKFZES-OREGWCPLSA-N	535.304621442							102209
BRD-K70756309	LSM-12743		56835485	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28+/m1/s1	HSJIFMVKIOATEF-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K70756309	BRD-K70756309-001-01-3	Broad Institute of MIT and Harvard	BRD-K70756309			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28+/m1/s1	HSJIFMVKIOATEF-CJYOKPGZSA-N	569.250141198							101379
BRD-K23603287	LSM-9848		56835520	InChI=1S/C31H38N2O4/c1-22-17-33(23(2)20-34)31(35)29-15-8-7-14-28(29)27-13-6-5-11-25(27)21-37-30(22)19-32(3)18-24-10-9-12-26(16-24)36-4/h5-16,22-23,30,34H,17-21H2,1-4H3/t22-,23-,30-/m0/s1	JYPGTBVWUBFVKL-ZRLASMASSA-N	COc1cccc(CN(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K23603287	BRD-K23603287-001-01-1	Broad Institute of MIT and Harvard	BRD-K23603287			COc1cccc(CN(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)c1	InChI=1S/C31H38N2O4/c1-22-17-33(23(2)20-34)31(35)29-15-8-7-14-28(29)27-13-6-5-11-25(27)21-37-30(22)19-32(3)18-24-10-9-12-26(16-24)36-4/h5-16,22-23,30,34H,17-21H2,1-4H3/t22-,23-,30-/m0/s1	JYPGTBVWUBFVKL-ZRLASMASSA-N	502.283157716							98469
BRD-K60065591	LSM-12060		56835539	InChI=1S/C24H32N2O5S/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-31-23(17)14-25(3)32(4,29)30/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	UZINPKAPIFGTKL-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K60065591	BRD-K60065591-001-01-8	Broad Institute of MIT and Harvard	BRD-K60065591			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C24H32N2O5S/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-31-23(17)14-25(3)32(4,29)30/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	UZINPKAPIFGTKL-BSRJHKFKSA-N	460.203192834							100686
BRD-K70657810	LSM-12739		56835493	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23-,28+/m1/s1	RCQCJVVJEHACDL-MRJKTFCFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K70657810	BRD-K70657810-001-01-5	Broad Institute of MIT and Harvard	BRD-K70657810			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23-,28+/m1/s1	RCQCJVVJEHACDL-MRJKTFCFSA-N	536.234492962							101375
BRD-K38663221	LSM-10772		54637842	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21+,26-/m0/s1	NRKUZRFIJSCRHL-UZINWLIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K38663221	BRD-K38663221-001-01-7	Broad Institute of MIT and Harvard	BRD-K38663221			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21+,26-/m0/s1	NRKUZRFIJSCRHL-UZINWLIJSA-N	579.251540024							99393
BRD-K85197047	LSM-13635		54637854	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21-,26-/m0/s1	OMNPDJXLWRDGEE-WOVHNISZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K85197047	BRD-K85197047-001-01-0	Broad Institute of MIT and Harvard	BRD-K85197047			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21-,26-/m0/s1	OMNPDJXLWRDGEE-WOVHNISZSA-N	581.20181263							102282
BRD-K08750028	LSM-8959		54637887	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22+,27-/m1/s1	QLIZXZIZGKFZES-UMTXDNHDSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K08750028	BRD-K08750028-001-01-3	Broad Institute of MIT and Harvard	BRD-K08750028			CC(C)COC(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22+,27-/m1/s1	QLIZXZIZGKFZES-UMTXDNHDSA-N	535.304621442							97580
BRD-K63686806	LSM-12308		56835207	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22-,28-/m0/s1	KEOFNYFHDQHRAV-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K63686806	BRD-K63686806-001-01-9	Broad Institute of MIT and Harvard	BRD-K63686806			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22-,28-/m0/s1	KEOFNYFHDQHRAV-VPYPWEPUSA-N	473.26784201							100935
BRD-K50737884	LSM-11520		56835287	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19+,25+/m1/s1	GOHLAUSVLSRLLT-WYEJZRMESA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K50737884	BRD-K50737884-001-01-0	Broad Institute of MIT and Harvard	BRD-K50737884			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19+,25+/m1/s1	GOHLAUSVLSRLLT-WYEJZRMESA-N	450.251857588							100141
BRD-K13587575	LSM-9245		54637864	InChI=1S/C31H38N2O4/c1-22-17-33(23(2)20-34)31(35)29-15-8-7-14-28(29)27-13-6-5-11-25(27)21-37-30(22)19-32(3)18-24-10-9-12-26(16-24)36-4/h5-16,22-23,30,34H,17-21H2,1-4H3/t22-,23+,30-/m1/s1	JYPGTBVWUBFVKL-DUELTEGESA-N	COc1cccc(CN(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K13587575	BRD-K13587575-001-01-9	Broad Institute of MIT and Harvard	BRD-K13587575			COc1cccc(CN(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)c1	InChI=1S/C31H38N2O4/c1-22-17-33(23(2)20-34)31(35)29-15-8-7-14-28(29)27-13-6-5-11-25(27)21-37-30(22)19-32(3)18-24-10-9-12-26(16-24)36-4/h5-16,22-23,30,34H,17-21H2,1-4H3/t22-,23+,30-/m1/s1	JYPGTBVWUBFVKL-DUELTEGESA-N	502.283157716							97866
BRD-K47036878	LSM-11299		54637989	InChI=1S/C24H32N2O3/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-29-23(17)14-25(3)4/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	ICBPOKCISFMJKJ-PMAPCBKXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K47036878	BRD-K47036878-001-01-1	Broad Institute of MIT and Harvard	BRD-K47036878			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C24H32N2O3/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-29-23(17)14-25(3)4/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	ICBPOKCISFMJKJ-PMAPCBKXSA-N	396.241292904							99920
BRD-K51776699	LSM-11595		54638005	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20+,26-/m1/s1	YAQCSVWFCUIVLJ-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K51776699	BRD-K51776699-001-01-2	Broad Institute of MIT and Harvard	BRD-K51776699			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20+,26-/m1/s1	YAQCSVWFCUIVLJ-BVFVYWQFSA-N	503.278406694							100218
BRD-K25564095	LSM-9982		56835442	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28-/m0/s1	HTGRXZBGTMWDTQ-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K25564095	BRD-K25564095-001-01-5	Broad Institute of MIT and Harvard	BRD-K25564095			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28-/m0/s1	HTGRXZBGTMWDTQ-CZBREUMFSA-N	504.242435756							98603
BRD-K30785989	LSM-10283		54637948	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28-/m1/s1	SHOKCNHESYLQAS-UMQWNRPGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K30785989	BRD-K30785989-001-01-8	Broad Institute of MIT and Harvard	BRD-K30785989			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28-/m1/s1	SHOKCNHESYLQAS-UMQWNRPGSA-N	556.179870576							98904
BRD-K67374281	LSM-12531		54637859	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27+/m0/s1	VHVNEVJWYRMESY-FYQCMVGJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K67374281	BRD-K67374281-001-01-2	Broad Institute of MIT and Harvard	BRD-K67374281			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27+/m0/s1	VHVNEVJWYRMESY-FYQCMVGJSA-N	487.247106566							101162
CHEMBL2361784	LSM-10748	BRD-K38304289, SID131434142	54637865	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21+,28+/m0/s1	HSJIFMVKIOATEF-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K38304289	BRD-K38304289-001-01-7	Broad Institute of MIT and Harvard	BRD-K38304289			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21+,28+/m0/s1	HSJIFMVKIOATEF-BALWLHIASA-N	569.250141198							99369
BRD-K10682047	LSM-9073		54637895	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27-/m1/s1	QWRJLEHIBFFHOL-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K10682047	BRD-K10682047-001-01-1	Broad Institute of MIT and Harvard	BRD-K10682047			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27-/m1/s1	QWRJLEHIBFFHOL-PBDKAQRYSA-N	540.209421066							97694
BRD-K67123444	LSM-12515		54638023	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-32(3)17-23-9-8-11-25(31)15-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22+,29+/m0/s1	ZIZYGTWNPVBARE-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K67123444	BRD-K67123444-001-01-7	Broad Institute of MIT and Harvard	BRD-K67123444			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-32(3)17-23-9-8-11-25(31)15-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22+,29+/m0/s1	ZIZYGTWNPVBARE-DKGMKSHISA-N	490.2631712							101146
BRD-K17402942	LSM-9474		54637957	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20-,27-/m0/s1	LBGXIXNVJUEMSO-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K17402942	BRD-K17402942-001-01-3	Broad Institute of MIT and Harvard	BRD-K17402942			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20-,27-/m0/s1	LBGXIXNVJUEMSO-OSOCVKALSA-N	558.284220356							98095
BRD-K93011030	LSM-14136		54637953	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28-/m0/s1	BXWHKXPVJGEBOL-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K93011030	BRD-K93011030-001-01-2	Broad Institute of MIT and Harvard	BRD-K93011030			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28-/m0/s1	BXWHKXPVJGEBOL-VPYPWEPUSA-N	540.273655672							102790
BRD-K47006988	LSM-11295		54637921	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29-/m1/s1	HIWUQZOVKTUVHW-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K47006988	BRD-K47006988-001-01-1	Broad Institute of MIT and Harvard	BRD-K47006988			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29-/m1/s1	HIWUQZOVKTUVHW-IEOSBIPESA-N	572.279883904							99916
BRD-K11517399	LSM-9131		54638000	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19-,25+/m0/s1	GOHLAUSVLSRLLT-XHNVNVPESA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K11517399	BRD-K11517399-001-01-2	Broad Institute of MIT and Harvard	BRD-K11517399			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19-,25+/m0/s1	GOHLAUSVLSRLLT-XHNVNVPESA-N	450.251857588							97752
BRD-K17661785	LSM-9491		56835242	InChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20-,26-/m0/s1	ROXJHZXKWGUYER-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K17661785	BRD-K17661785-001-01-4	Broad Institute of MIT and Harvard	BRD-K17661785			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20-,26-/m0/s1	ROXJHZXKWGUYER-DYLHXGEVSA-N	528.175263524							98112
BRD-K33454337	LSM-10457		54637848	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29-/m0/s1	GTRXSASKUSVSHJ-KERYWQKISA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K33454337	BRD-K33454337-001-01-7	Broad Institute of MIT and Harvard	BRD-K33454337			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29-/m0/s1	GTRXSASKUSVSHJ-KERYWQKISA-N	552.229407582							99078
BRD-K55897144	LSM-11816		54637882	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18+,24-/m0/s1	PBZGESVUNIXUSB-RHGYRFJNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K55897144	BRD-K55897144-001-01-3	Broad Institute of MIT and Harvard	BRD-K55897144			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(C)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18+,24-/m0/s1	PBZGESVUNIXUSB-RHGYRFJNSA-N	424.236207524							100441
BRD-K00930335	LSM-8491		54638012	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23+,28+/m0/s1	RCQCJVVJEHACDL-SXDGJLEOSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K00930335	BRD-K00930335-001-01-7	Broad Institute of MIT and Harvard	BRD-K00930335			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23+,28+/m0/s1	RCQCJVVJEHACDL-SXDGJLEOSA-N	536.234492962							97112
BRD-K25473383	LSM-9976		54638026	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-32(3)17-23-9-8-11-25(31)15-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22-,29-/m1/s1	ZIZYGTWNPVBARE-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K25473383	BRD-K25473383-001-01-0	Broad Institute of MIT and Harvard	BRD-K25473383			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-32(3)17-23-9-8-11-25(31)15-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22-,29-/m1/s1	ZIZYGTWNPVBARE-IEOSBIPESA-N	490.2631712							98597
BRD-K71944426	LSM-12838		54637898	InChI=1S/C27H36N2O3/c1-19-14-29(20(2)17-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-22(23)18-32-26(19)16-28(3)15-21-12-13-21/h4-11,19-21,26,30H,12-18H2,1-3H3/t19-,20-,26+/m0/s1	XOTAGUVNSWBDBY-CUVVAGTFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K71944426	BRD-K71944426-001-01-2	Broad Institute of MIT and Harvard	BRD-K71944426			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H36N2O3/c1-19-14-29(20(2)17-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-22(23)18-32-26(19)16-28(3)15-21-12-13-21/h4-11,19-21,26,30H,12-18H2,1-3H3/t19-,20-,26+/m0/s1	XOTAGUVNSWBDBY-CUVVAGTFSA-N	436.272593032							101475
BRD-K41996639	LSM-10979		54637988	InChI=1S/C24H32N2O3/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-29-23(17)14-25(3)4/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	ICBPOKCISFMJKJ-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K41996639	BRD-K41996639-001-01-2	Broad Institute of MIT and Harvard	BRD-K41996639			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C24H32N2O3/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-29-23(17)14-25(3)4/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	ICBPOKCISFMJKJ-IEGUWTFLSA-N	396.241292904							99600
BRD-K08482401	LSM-8941		56835557	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23-,28-/m0/s1	RCQCJVVJEHACDL-LXWOLXCRSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K08482401	BRD-K08482401-001-01-0	Broad Institute of MIT and Harvard	BRD-K08482401			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23-,28-/m0/s1	RCQCJVVJEHACDL-LXWOLXCRSA-N	536.234492962							97562
BRD-K30226385	LSM-10254		56835382	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30+/m0/s1	DEQYHGFYIZKXEQ-DDFCPOBKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K30226385	BRD-K30226385-001-01-3	Broad Institute of MIT and Harvard	BRD-K30226385			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30+/m0/s1	DEQYHGFYIZKXEQ-DDFCPOBKSA-N	600.240640982							98875
BRD-K14228330	LSM-9286		54637954	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28-/m1/s1	BXWHKXPVJGEBOL-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K14228330	BRD-K14228330-001-01-5	Broad Institute of MIT and Harvard	BRD-K14228330			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28-/m1/s1	BXWHKXPVJGEBOL-DQCZWYHMSA-N	540.273655672							97907
CHEMBL2358261	LSM-11148	BRD-K44752364, SID134962114	56835380	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29+/m0/s1	HIWUQZOVKTUVHW-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K44752364	BRD-K44752364-001-01-7	Broad Institute of MIT and Harvard	BRD-K44752364			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29+/m0/s1	HIWUQZOVKTUVHW-DKGMKSHISA-N	572.279883904							99769
BRD-K82083906	LSM-13443		54637978	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24+,30-/m1/s1	VTQGPDBOURHJNB-HTWFIQDWSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K82083906	BRD-K82083906-001-01-5	Broad Institute of MIT and Harvard	BRD-K82083906			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24+,30-/m1/s1	VTQGPDBOURHJNB-HTWFIQDWSA-N	514.283157716							102083
BRD-K12827775	LSM-9189		54637890	InChI=1S/C24H32N2O5S/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-31-23(17)14-25(3)32(4,29)30/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	UZINPKAPIFGTKL-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K12827775	BRD-K12827775-001-01-8	Broad Institute of MIT and Harvard	BRD-K12827775			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C24H32N2O5S/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-31-23(17)14-25(3)32(4,29)30/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23-/m0/s1	UZINPKAPIFGTKL-IXFSTUDKSA-N	460.203192834							97810
BRD-K49111930	LSM-11414		54637855	InChI=1S/C31H36N2O5/c1-21-15-33(22(2)18-34)31(35)27-11-7-6-10-26(27)25-9-5-4-8-24(25)19-36-30(21)17-32(3)16-23-12-13-28-29(14-23)38-20-37-28/h4-14,21-22,30,34H,15-20H2,1-3H3/t21-,22+,30+/m0/s1	VTMUWCMJICVSQX-IABYTQIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K49111930	BRD-K49111930-001-01-6	Broad Institute of MIT and Harvard	BRD-K49111930			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-15-33(22(2)18-34)31(35)27-11-7-6-10-26(27)25-9-5-4-8-24(25)19-36-30(21)17-32(3)16-23-12-13-28-29(14-23)38-20-37-28/h4-14,21-22,30,34H,15-20H2,1-3H3/t21-,22+,30+/m0/s1	VTMUWCMJICVSQX-IABYTQIASA-N	516.262422272							100035
BRD-K32833573	LSM-10422		54637871	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19+,26-/m0/s1	SNXQORXMPHKSCQ-ANSQWYIGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K32833573	BRD-K32833573-001-01-6	Broad Institute of MIT and Harvard	BRD-K32833573			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19+,26-/m0/s1	SNXQORXMPHKSCQ-ANSQWYIGSA-N	520.268570292							99043
BRD-K23724349	LSM-9858		56835401	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20-,25+/m1/s1	JTQSYHMCCHKQKK-FHAGJXEFSA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K23724349	BRD-K23724349-001-01-1	Broad Institute of MIT and Harvard	BRD-K23724349			CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20-,25+/m1/s1	JTQSYHMCCHKQKK-FHAGJXEFSA-N	468.262422272							98479
BRD-K22518694	LSM-9794		54637992	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30-/m1/s1	FNKQMQRSMOAQIH-DUELTEGESA-N	COc1cccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45)c1	BroadT	BRD-K22518694	BRD-K22518694-001-01-9	Broad Institute of MIT and Harvard	BRD-K22518694			COc1cccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c2ccccc32)c1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30-/m1/s1	FNKQMQRSMOAQIH-DUELTEGESA-N	584.29987042							98415
BRD-K85742570	LSM-13679		54637965	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25-,31-/m0/s1	WVFRUYXRTWIHMU-PBANKSGMSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K85742570	BRD-K85742570-001-01-8	Broad Institute of MIT and Harvard	BRD-K85742570			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25-,31-/m0/s1	WVFRUYXRTWIHMU-PBANKSGMSA-N	582.320605864							102326
BRD-K19114437	LSM-9579		56835559	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27+/m1/s1	VHVNEVJWYRMESY-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K19114437	BRD-K19114437-001-01-4	Broad Institute of MIT and Harvard	BRD-K19114437			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27+/m1/s1	VHVNEVJWYRMESY-GNMOFYLKSA-N	487.247106566							98200
BRD-K70036333	LSM-12705		56835544	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m0/s1	QWRJLEHIBFFHOL-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K70036333	BRD-K70036333-001-01-0	Broad Institute of MIT and Harvard	BRD-K70036333			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m0/s1	QWRJLEHIBFFHOL-IZVMNLJQSA-N	540.209421066							101340
BRD-K78122632	LSM-13208		54637846	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29+/m0/s1	GTRXSASKUSVSHJ-IHMCZWCLSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K78122632	BRD-K78122632-001-01-8	Broad Institute of MIT and Harvard	BRD-K78122632			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29+/m0/s1	GTRXSASKUSVSHJ-IHMCZWCLSA-N	552.229407582							101846
BRD-K02944060	LSM-8619		56835474	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22-,27+/m1/s1	RFSXMDVZFWHRJB-RYBWSMFQSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K02944060	BRD-K02944060-001-01-7	Broad Institute of MIT and Harvard	BRD-K02944060			CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22-,27+/m1/s1	RFSXMDVZFWHRJB-RYBWSMFQSA-N	495.309706822							97240
CHEMBL2357920	LSM-12057	BRD-K60019754, SID131434201	54637924	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-32(3)17-23-12-14-25(31)15-13-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22+,29-/m0/s1	KXTDYBDROYGOSG-KERYWQKISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K60019754	BRD-K60019754-001-01-8	Broad Institute of MIT and Harvard	BRD-K60019754			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-32(3)17-23-12-14-25(31)15-13-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22+,29-/m0/s1	KXTDYBDROYGOSG-KERYWQKISA-N	490.2631712							100683
BRD-K63631822	LSM-12305		54637970	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25-,31-/m1/s1	WVFRUYXRTWIHMU-GTEDWBNGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K63631822	BRD-K63631822-001-01-5	Broad Institute of MIT and Harvard	BRD-K63631822			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25-,31-/m1/s1	WVFRUYXRTWIHMU-GTEDWBNGSA-N	582.320605864							100932
BRD-K22479833	LSM-9791		56835307	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25-,31+/m1/s1	WVFRUYXRTWIHMU-FXIKWKPTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K22479833	BRD-K22479833-001-01-6	Broad Institute of MIT and Harvard	BRD-K22479833			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25-,31+/m1/s1	WVFRUYXRTWIHMU-FXIKWKPTSA-N	582.320605864							98412
BRD-K51662742	LSM-11589		54637850	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29-/m1/s1	GTRXSASKUSVSHJ-IEOSBIPESA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K51662742	BRD-K51662742-001-01-1	Broad Institute of MIT and Harvard	BRD-K51662742			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29-/m1/s1	GTRXSASKUSVSHJ-IEOSBIPESA-N	552.229407582							100212
BRD-K18306851	LSM-9525		54637962	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28-/m1/s1	HTGRXZBGTMWDTQ-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K18306851	BRD-K18306851-001-01-4	Broad Institute of MIT and Harvard	BRD-K18306851			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28-/m1/s1	HTGRXZBGTMWDTQ-PHVLTXCSSA-N	504.242435756							98146
BRD-K61929092	LSM-12183		54637984	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22-,27-/m0/s1	RFSXMDVZFWHRJB-RJESQKRESA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K61929092	BRD-K61929092-001-01-8	Broad Institute of MIT and Harvard	BRD-K61929092			CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22-,27-/m0/s1	RFSXMDVZFWHRJB-RJESQKRESA-N	495.309706822							100809
BRD-K64127467	LSM-12343		54638019	InChI=1S/C31H42N4O4/c1-21-17-35(22(2)19-36)31(38)30-29(25-13-9-10-14-26(25)34(30)6)24-12-8-7-11-23(24)20-39-27(21)18-33(5)28(37)15-16-32(3)4/h7-14,21-22,27,36H,15-20H2,1-6H3/t21-,22-,27-/m0/s1	UPHSEAQPRHOHRJ-BERHBOFZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K64127467	BRD-K64127467-001-01-3	Broad Institute of MIT and Harvard	BRD-K64127467			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H42N4O4/c1-21-17-35(22(2)19-36)31(38)30-29(25-13-9-10-14-26(25)34(30)6)24-12-8-7-11-23(24)20-39-27(21)18-33(5)28(37)15-16-32(3)4/h7-14,21-22,27,36H,15-20H2,1-6H3/t21-,22-,27-/m0/s1	UPHSEAQPRHOHRJ-BERHBOFZSA-N	534.320605864							100970
BRD-K13515789	LSM-9238		54638030	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21-,27-/m1/s1	XFTZCOPLMXQWPM-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K13515789	BRD-K13515789-001-01-2	Broad Institute of MIT and Harvard	BRD-K13515789			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21-,27-/m1/s1	XFTZCOPLMXQWPM-LGVUCKNBSA-N	581.20181263							97859
BRD-K96538394	LSM-14349		54637897	InChI=1S/C27H36N2O3/c1-19-14-29(20(2)17-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-22(23)18-32-26(19)16-28(3)15-21-12-13-21/h4-11,19-21,26,30H,12-18H2,1-3H3/t19-,20+,26+/m0/s1	XOTAGUVNSWBDBY-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K96538394	BRD-K96538394-001-01-1	Broad Institute of MIT and Harvard	BRD-K96538394			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H36N2O3/c1-19-14-29(20(2)17-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-22(23)18-32-26(19)16-28(3)15-21-12-13-21/h4-11,19-21,26,30H,12-18H2,1-3H3/t19-,20+,26+/m0/s1	XOTAGUVNSWBDBY-OUDXUNEISA-N	436.272593032							103003
BRD-K70202431	LSM-12714		54637879	InChI=1S/C33H39N3O5S/c1-23-18-36(24(2)20-37)33(38)32-31(28-16-10-11-17-29(28)35(32)4)27-15-9-8-14-26(27)21-41-30(23)19-34(3)42(39,40)22-25-12-6-5-7-13-25/h5-17,23-24,30,37H,18-22H2,1-4H3/t23-,24-,30-/m0/s1	LJWHPXFZVGGEPZ-JYUFKMNQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)Cc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K70202431	BRD-K70202431-001-01-9	Broad Institute of MIT and Harvard	BRD-K70202431			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-23-18-36(24(2)20-37)33(38)32-31(28-16-10-11-17-29(28)35(32)4)27-15-9-8-14-26(27)21-41-30(23)19-34(3)42(39,40)22-25-12-6-5-7-13-25/h5-17,23-24,30,37H,18-22H2,1-4H3/t23-,24-,30-/m0/s1	LJWHPXFZVGGEPZ-JYUFKMNQSA-N	589.261042068							101349
BRD-K43604368	LSM-11087		54637903	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23+,29-/m1/s1	VHDWJFVGOVHSLC-RLPNJSHFSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K43604368	BRD-K43604368-001-01-7	Broad Institute of MIT and Harvard	BRD-K43604368			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23+,29-/m1/s1	VHDWJFVGOVHSLC-RLPNJSHFSA-N	605.255956688							99708
CHEMBL2362555	LSM-12368	BRD-K64520484, SID134962062	56835328	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29+/m0/s1	HIWUQZOVKTUVHW-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K64520484	BRD-K64520484-001-01-8	Broad Institute of MIT and Harvard	BRD-K64520484			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29+/m0/s1	HIWUQZOVKTUVHW-IHMCZWCLSA-N	572.279883904							100995
BRD-K71357056	LSM-12790		54637929	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28+/m0/s1	APRVPIVHITUHLQ-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K71357056	BRD-K71357056-001-01-4	Broad Institute of MIT and Harvard	BRD-K71357056			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28+/m0/s1	APRVPIVHITUHLQ-BALWLHIASA-N	540.209421066							101427
BRD-K83335786	LSM-13520		54637968	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25-,31-/m0/s1	WVFRUYXRTWIHMU-OSYMNAPVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K83335786	BRD-K83335786-001-01-3	Broad Institute of MIT and Harvard	BRD-K83335786			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25-,31-/m0/s1	WVFRUYXRTWIHMU-OSYMNAPVSA-N	582.320605864							102161
BRD-K21683946	LSM-9748		54637847	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29+/m0/s1	GTRXSASKUSVSHJ-DKGMKSHISA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K21683946	BRD-K21683946-001-01-8	Broad Institute of MIT and Harvard	BRD-K21683946			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29+/m0/s1	GTRXSASKUSVSHJ-DKGMKSHISA-N	552.229407582							98369
BRD-K20251969	LSM-9664		54637873	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22+,28+/m0/s1	FOMDXHZXOKRLRD-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K20251969	BRD-K20251969-001-01-7	Broad Institute of MIT and Harvard	BRD-K20251969			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22+,28+/m0/s1	FOMDXHZXOKRLRD-PFPZSTESSA-N	507.309706822							98285
CHEMBL2361075	LSM-8460	BRD-K00478394, SID131434211	54637934	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30-/m0/s1	DEQYHGFYIZKXEQ-BURCIIJTSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K00478394	BRD-K00478394-001-01-5	Broad Institute of MIT and Harvard	BRD-K00478394			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30-/m0/s1	DEQYHGFYIZKXEQ-BURCIIJTSA-N	600.240640982							97081
BRD-K97805274	LSM-14440		56835457	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	GTRXSASKUSVSHJ-QLVXXPONSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K97805274	BRD-K97805274-001-01-8	Broad Institute of MIT and Harvard	BRD-K97805274			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	GTRXSASKUSVSHJ-QLVXXPONSA-N	552.229407582							103095
BRD-K35886478	LSM-10584		54637911	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21+,26-/m0/s1	IEBNCDQMHLDDBS-UZINWLIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K35886478	BRD-K35886478-001-01-7	Broad Institute of MIT and Harvard	BRD-K35886478			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21+,26-/m0/s1	IEBNCDQMHLDDBS-UZINWLIJSA-N	481.294056758							99205
BRD-K72529818	LSM-12878		54637935	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30-/m1/s1	DEQYHGFYIZKXEQ-DUELTEGESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K72529818	BRD-K72529818-001-01-6	Broad Institute of MIT and Harvard	BRD-K72529818			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30-/m1/s1	DEQYHGFYIZKXEQ-DUELTEGESA-N	600.240640982							101515
BRD-K69318356	LSM-12655		54637979	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22-,27+/m0/s1	RFSXMDVZFWHRJB-JLFWUPFSSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K69318356	BRD-K69318356-001-01-7	Broad Institute of MIT and Harvard	BRD-K69318356			CC(C)[C@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22-,27+/m0/s1	RFSXMDVZFWHRJB-JLFWUPFSSA-N	495.309706822							101289
BRD-K53528245	LSM-11691		54637869	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19+,26+/m0/s1	SNXQORXMPHKSCQ-GNBJCERTSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K53528245	BRD-K53528245-001-01-4	Broad Institute of MIT and Harvard	BRD-K53528245			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19+,26+/m0/s1	SNXQORXMPHKSCQ-GNBJCERTSA-N	520.268570292							100316
BRD-K20965564	LSM-9706		56835251	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20+,27+/m1/s1	LBGXIXNVJUEMSO-JVAFGIKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K20965564	BRD-K20965564-001-01-1	Broad Institute of MIT and Harvard	BRD-K20965564			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20+,27+/m1/s1	LBGXIXNVJUEMSO-JVAFGIKQSA-N	558.284220356							98327
BRD-K87311987	LSM-13783		54637851	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21-,26+/m1/s1	OMNPDJXLWRDGEE-YPCDYVTLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K87311987	BRD-K87311987-001-01-7	Broad Institute of MIT and Harvard	BRD-K87311987			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21-,26+/m1/s1	OMNPDJXLWRDGEE-YPCDYVTLSA-N	581.20181263							102432
BRD-K37316418	LSM-10682		54637913	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21-,26-/m1/s1	IEBNCDQMHLDDBS-IPVFLDMMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K37316418	BRD-K37316418-001-01-6	Broad Institute of MIT and Harvard	BRD-K37316418			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21-,26-/m1/s1	IEBNCDQMHLDDBS-IPVFLDMMSA-N	481.294056758							99303
BRD-K40507170	LSM-10902		54637942	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20-,25+/m0/s1	JTQSYHMCCHKQKK-ZYLNGJIFSA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K40507170	BRD-K40507170-001-01-3	Broad Institute of MIT and Harvard	BRD-K40507170			CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20-,25+/m0/s1	JTQSYHMCCHKQKK-ZYLNGJIFSA-N	468.262422272							99523
BRD-K36553386	LSM-10636		54637862	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m1/s1	VHVNEVJWYRMESY-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K36553386	BRD-K36553386-001-01-3	Broad Institute of MIT and Harvard	BRD-K36553386			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m1/s1	VHVNEVJWYRMESY-LGVUCKNBSA-N	487.247106566							99257
BRD-K16110862	LSM-9397		54638013	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23+,28-/m0/s1	RCQCJVVJEHACDL-JWZKTCGFSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K16110862	BRD-K16110862-001-01-9	Broad Institute of MIT and Harvard	BRD-K16110862			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23+,28-/m0/s1	RCQCJVVJEHACDL-JWZKTCGFSA-N	536.234492962							98018
BRD-K21364577	LSM-9725		54637986	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22+,27-/m1/s1	RFSXMDVZFWHRJB-RRHHDSEZSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K21364577	BRD-K21364577-001-01-1	Broad Institute of MIT and Harvard	BRD-K21364577			CC(C)[C@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22+,27-/m1/s1	RFSXMDVZFWHRJB-RRHHDSEZSA-N	495.309706822							98346
BRD-K06401240	LSM-8801		54637949	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-31(3)17-23-9-8-11-25(34)15-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22+,29-/m1/s1	WRXJNAGTDQYTEO-UETOGOEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K06401240	BRD-K06401240-001-01-7	Broad Institute of MIT and Harvard	BRD-K06401240			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-31(3)17-23-9-8-11-25(34)15-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22+,29-/m1/s1	WRXJNAGTDQYTEO-UETOGOEVSA-N	488.267507652							97422
BRD-K96688934	LSM-14366		54637904	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23-,29-/m0/s1	VHDWJFVGOVHSLC-BOSRLCDASA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K96688934	BRD-K96688934-001-01-1	Broad Institute of MIT and Harvard	BRD-K96688934			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23-,29-/m0/s1	VHDWJFVGOVHSLC-BOSRLCDASA-N	605.255956688							103020
BRD-K15895141	LSM-9379		54637880	InChI=1S/C33H39N3O5S/c1-23-18-36(24(2)20-37)33(38)32-31(28-16-10-11-17-29(28)35(32)4)27-15-9-8-14-26(27)21-41-30(23)19-34(3)42(39,40)22-25-12-6-5-7-13-25/h5-17,23-24,30,37H,18-22H2,1-4H3/t23-,24-,30-/m1/s1	LJWHPXFZVGGEPZ-BOYVUMAVSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)Cc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K15895141	BRD-K15895141-001-01-9	Broad Institute of MIT and Harvard	BRD-K15895141			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-23-18-36(24(2)20-37)33(38)32-31(28-16-10-11-17-29(28)35(32)4)27-15-9-8-14-26(27)21-41-30(23)19-34(3)42(39,40)22-25-12-6-5-7-13-25/h5-17,23-24,30,37H,18-22H2,1-4H3/t23-,24-,30-/m1/s1	LJWHPXFZVGGEPZ-BOYVUMAVSA-N	589.261042068							98000
BRD-K27647724	LSM-10093		54637990	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30+/m1/s1	FNKQMQRSMOAQIH-JWUQWVJQSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45)c1	BroadT	BRD-K27647724	BRD-K27647724-001-01-5	Broad Institute of MIT and Harvard	BRD-K27647724			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c2ccccc32)c1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30+/m1/s1	FNKQMQRSMOAQIH-JWUQWVJQSA-N	584.29987042							98714
BRD-K45745416	LSM-11219		56835260	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21+,26+/m1/s1	NRKUZRFIJSCRHL-SWYRRKHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K45745416	BRD-K45745416-001-01-8	Broad Institute of MIT and Harvard	BRD-K45745416			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21+,26+/m1/s1	NRKUZRFIJSCRHL-SWYRRKHMSA-N	579.251540024							99840
CHEMBL2361179	LSM-9530	SID131434297, BRD-K18327813	54638020	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-14-7-8-15-28(27)35(31)4)26-13-6-5-10-23(26)20-41-29(21)18-34(3)42(39,40)25-12-9-11-24(33)16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	QBEIQJOXWRLXRW-QLVXXPONSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K18327813	BRD-K18327813-001-01-7	Broad Institute of MIT and Harvard	BRD-K18327813			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-14-7-8-15-28(27)35(31)4)26-13-6-5-10-23(26)20-41-29(21)18-34(3)42(39,40)25-12-9-11-24(33)16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	QBEIQJOXWRLXRW-QLVXXPONSA-N	593.235970172							98151
CHEMBL2356856	LSM-11208	BRD-K45542432, SID134961981	56835247	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-32(3)17-23-12-14-25(31)15-13-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22-,29-/m0/s1	KXTDYBDROYGOSG-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K45542432	BRD-K45542432-001-01-9	Broad Institute of MIT and Harvard	BRD-K45542432			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-32(3)17-23-12-14-25(31)15-13-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22-,29-/m0/s1	KXTDYBDROYGOSG-SYZUXVNWSA-N	490.2631712							99829
BRD-K85258684	LSM-13642		54637972	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24+,30+/m0/s1	VTQGPDBOURHJNB-GBXOJDCZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K85258684	BRD-K85258684-001-01-8	Broad Institute of MIT and Harvard	BRD-K85258684			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24+,30+/m0/s1	VTQGPDBOURHJNB-GBXOJDCZSA-N	514.283157716							102289
BRD-K11031937	LSM-9101		54637982	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22+,27+/m0/s1	RFSXMDVZFWHRJB-HCUOBIAZSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K11031937	BRD-K11031937-001-01-3	Broad Institute of MIT and Harvard	BRD-K11031937			CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22+,27+/m0/s1	RFSXMDVZFWHRJB-HCUOBIAZSA-N	495.309706822							97722
BRD-K35189425	LSM-10544		54637980	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22+,27+/m0/s1	RFSXMDVZFWHRJB-HRGDABNKSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K35189425	BRD-K35189425-001-01-0	Broad Institute of MIT and Harvard	BRD-K35189425			CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22+,27+/m0/s1	RFSXMDVZFWHRJB-HRGDABNKSA-N	495.309706822							99165
BRD-K87079453	LSM-13768		56835339	InChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19+,24+/m0/s1	BZAPUCLBFKATKI-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K87079453	BRD-K87079453-001-01-5	Broad Institute of MIT and Harvard	BRD-K87079453			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19+,24+/m0/s1	BZAPUCLBFKATKI-XLNZFTOWSA-N	581.217126508							102417
BRD-K99159184	LSM-14520		56835402	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22-,27+/m1/s1	RFSXMDVZFWHRJB-RKGZYEPBSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K99159184	BRD-K99159184-001-01-7	Broad Institute of MIT and Harvard	BRD-K99159184			CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22-,27+/m1/s1	RFSXMDVZFWHRJB-RKGZYEPBSA-N	495.309706822							103175
BRD-K59709493	LSM-12036		54637900	InChI=1S/C27H36N2O3/c1-19-14-29(20(2)17-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-22(23)18-32-26(19)16-28(3)15-21-12-13-21/h4-11,19-21,26,30H,12-18H2,1-3H3/t19-,20+,26-/m1/s1	XOTAGUVNSWBDBY-BVFVYWQFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K59709493	BRD-K59709493-001-01-3	Broad Institute of MIT and Harvard	BRD-K59709493			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H36N2O3/c1-19-14-29(20(2)17-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-22(23)18-32-26(19)16-28(3)15-21-12-13-21/h4-11,19-21,26,30H,12-18H2,1-3H3/t19-,20+,26-/m1/s1	XOTAGUVNSWBDBY-BVFVYWQFSA-N	436.272593032							100662
BRD-K84388104	LSM-13587		56835284	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23+,29+/m1/s1	VHDWJFVGOVHSLC-AFKLWXAFSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K84388104	BRD-K84388104-001-01-6	Broad Institute of MIT and Harvard	BRD-K84388104			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23+,29+/m1/s1	VHDWJFVGOVHSLC-AFKLWXAFSA-N	605.255956688							102231
BRD-K39248781	LSM-10811		54637917	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30-/m1/s1	LTECXWQWCPQLLD-IQLGONJTSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K39248781	BRD-K39248781-001-01-8	Broad Institute of MIT and Harvard	BRD-K39248781			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30-/m1/s1	LTECXWQWCPQLLD-IQLGONJTSA-N	569.288971378							99432
BRD-K08094365	LSM-8917		56835364	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21+,26+/m0/s1	OMNPDJXLWRDGEE-LZCXECNNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K08094365	BRD-K08094365-001-01-7	Broad Institute of MIT and Harvard	BRD-K08094365			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21+,26+/m0/s1	OMNPDJXLWRDGEE-LZCXECNNSA-N	581.20181263							97538
BRD-K61113746	LSM-12127		54637994	InChI=1S/C26H33N3O3/c1-17-14-29(18(2)15-30)26(31)25-24(21-11-7-8-12-22(21)28(25)4)20-10-6-5-9-19(20)16-32-23(17)13-27-3/h5-12,17-18,23,27,30H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	NEAMIVWIATVNNI-PMAPCBKXSA-N	CNC[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K61113746	BRD-K61113746-001-01-9	Broad Institute of MIT and Harvard	BRD-K61113746			CNC[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C26H33N3O3/c1-17-14-29(18(2)15-30)26(31)25-24(21-11-7-8-12-22(21)28(25)4)20-10-6-5-9-19(20)16-32-23(17)13-27-3/h5-12,17-18,23,27,30H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	NEAMIVWIATVNNI-PMAPCBKXSA-N	435.252191946							100753
BRD-K35928056	LSM-10586		54637961	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28-/m0/s1	HTGRXZBGTMWDTQ-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K35928056	BRD-K35928056-001-01-7	Broad Institute of MIT and Harvard	BRD-K35928056			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28-/m0/s1	HTGRXZBGTMWDTQ-GTNJKRJXSA-N	504.242435756							99207
BRD-K58360282	LSM-11949		54637959	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28+/m0/s1	HTGRXZBGTMWDTQ-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K58360282	BRD-K58360282-001-01-1	Broad Institute of MIT and Harvard	BRD-K58360282			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28+/m0/s1	HTGRXZBGTMWDTQ-BALWLHIASA-N	504.242435756							100575
BRD-K05745800	LSM-8769		56835420	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28+/m1/s1	APRVPIVHITUHLQ-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K05745800	BRD-K05745800-001-01-0	Broad Institute of MIT and Harvard	BRD-K05745800			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28+/m1/s1	APRVPIVHITUHLQ-CJYOKPGZSA-N	540.209421066							97390
BRD-K16229712	LSM-9405		56835515	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19-,26+/m1/s1	SNXQORXMPHKSCQ-UDCNLSRBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K16229712	BRD-K16229712-001-01-9	Broad Institute of MIT and Harvard	BRD-K16229712			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19-,26+/m1/s1	SNXQORXMPHKSCQ-UDCNLSRBSA-N	520.268570292							98026
CHEMBL2358078	LSM-9971	BRD-K25385069, SID131434117	54637840	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24+,31+/m0/s1	GHOSBDATJBJZOG-BKZGZDJESA-N	COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K25385069	BRD-K25385069-001-01-7	Broad Institute of MIT and Harvard	BRD-K25385069			COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24+,31+/m0/s1	GHOSBDATJBJZOG-BKZGZDJESA-N	598.315520484							98592
BRD-K39768328	LSM-10849		54637945	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28+/m0/s1	SHOKCNHESYLQAS-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K39768328	BRD-K39768328-001-01-5	Broad Institute of MIT and Harvard	BRD-K39768328			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28+/m0/s1	SHOKCNHESYLQAS-BALWLHIASA-N	556.179870576							99470
BRD-K18822535	LSM-9558		54637973	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24-,30+/m0/s1	VTQGPDBOURHJNB-ZUHGBKBGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K18822535	BRD-K18822535-001-01-4	Broad Institute of MIT and Harvard	BRD-K18822535			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24-,30+/m0/s1	VTQGPDBOURHJNB-ZUHGBKBGSA-N	514.283157716							98179
BRD-K17263374	LSM-9468		54637883	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18+,24-/m1/s1	PBZGESVUNIXUSB-NXMSCROESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K17263374	BRD-K17263374-001-01-6	Broad Institute of MIT and Harvard	BRD-K17263374			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(C)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18+,24-/m1/s1	PBZGESVUNIXUSB-NXMSCROESA-N	424.236207524							98089
BRD-K45265806	LSM-11183		56835348	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28+/m0/s1	PCQGWFREXHAZIT-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K45265806	BRD-K45265806-001-01-5	Broad Institute of MIT and Harvard	BRD-K45265806			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28+/m0/s1	PCQGWFREXHAZIT-RXYILKCJSA-N	593.235970172							99804
BRD-K90028787	LSM-13983		54637881	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18-,24+/m0/s1	PBZGESVUNIXUSB-LLJLJFOGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K90028787	BRD-K90028787-001-01-4	Broad Institute of MIT and Harvard	BRD-K90028787			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(C)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18-,24+/m0/s1	PBZGESVUNIXUSB-LLJLJFOGSA-N	424.236207524							102636
BRD-K63591202	LSM-12301		54638018	InChI=1S/C31H42N4O4/c1-21-17-35(22(2)19-36)31(38)30-29(25-13-9-10-14-26(25)34(30)6)24-12-8-7-11-23(24)20-39-27(21)18-33(5)28(37)15-16-32(3)4/h7-14,21-22,27,36H,15-20H2,1-6H3/t21-,22+,27-/m1/s1	UPHSEAQPRHOHRJ-UMTXDNHDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K63591202	BRD-K63591202-001-01-1	Broad Institute of MIT and Harvard	BRD-K63591202			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H42N4O4/c1-21-17-35(22(2)19-36)31(38)30-29(25-13-9-10-14-26(25)34(30)6)24-12-8-7-11-23(24)20-39-27(21)18-33(5)28(37)15-16-32(3)4/h7-14,21-22,27,36H,15-20H2,1-6H3/t21-,22+,27-/m1/s1	UPHSEAQPRHOHRJ-UMTXDNHDSA-N	534.320605864							100928
BRD-K62008506	LSM-12191		54637909	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24-,30-/m1/s1	BENJSVFNXVDSQO-BOYVUMAVSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K62008506	BRD-K62008506-001-01-0	Broad Institute of MIT and Harvard	BRD-K62008506			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24-,30-/m1/s1	BENJSVFNXVDSQO-BOYVUMAVSA-N	553.294056758							100817
BRD-K55667009	LSM-11800		54637964	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25-,31+/m1/s1	WVFRUYXRTWIHMU-BHUVWSLTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K55667009	BRD-K55667009-001-01-4	Broad Institute of MIT and Harvard	BRD-K55667009			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25-,31+/m1/s1	WVFRUYXRTWIHMU-BHUVWSLTSA-N	582.320605864							100425
BRD-K39006362	LSM-10791		54637960	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28+/m0/s1	HTGRXZBGTMWDTQ-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K39006362	BRD-K39006362-001-01-7	Broad Institute of MIT and Harvard	BRD-K39006362			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28+/m0/s1	HTGRXZBGTMWDTQ-YHGPEZAFSA-N	504.242435756							99412
BRD-K56483755	LSM-11845		56835320	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24+,30+/m1/s1	BENJSVFNXVDSQO-QEGDFHJFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K56483755	BRD-K56483755-001-01-1	Broad Institute of MIT and Harvard	BRD-K56483755			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24+,30+/m1/s1	BENJSVFNXVDSQO-QEGDFHJFSA-N	553.294056758							100471
BRD-K49860242	LSM-11456		54637888	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22-,27-/m0/s1	QLIZXZIZGKFZES-BERHBOFZSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K49860242	BRD-K49860242-001-01-1	Broad Institute of MIT and Harvard	BRD-K49860242			CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22-,27-/m0/s1	QLIZXZIZGKFZES-BERHBOFZSA-N	535.304621442							100077
BRD-K18296113	LSM-9523		54637946	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28-/m0/s1	SHOKCNHESYLQAS-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K18296113	BRD-K18296113-001-01-1	Broad Institute of MIT and Harvard	BRD-K18296113			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28-/m0/s1	SHOKCNHESYLQAS-GTNJKRJXSA-N	556.179870576							98144
BRD-K62595167	LSM-12228		56835550	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22-,27-/m0/s1	RFSXMDVZFWHRJB-LFYAFONDSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K62595167	BRD-K62595167-001-01-6	Broad Institute of MIT and Harvard	BRD-K62595167			CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22-,27-/m0/s1	RFSXMDVZFWHRJB-LFYAFONDSA-N	495.309706822							100854
BRD-K75749796	LSM-13062		56835423	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22+,27+/m1/s1	RFSXMDVZFWHRJB-YHZQYDDPSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K75749796	BRD-K75749796-001-01-3	Broad Institute of MIT and Harvard	BRD-K75749796			CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22+,27+/m1/s1	RFSXMDVZFWHRJB-YHZQYDDPSA-N	495.309706822							101699
CHEMBL2361312	LSM-12950	SID131434276, BRD-K73824371	54637999	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19+,25+/m0/s1	GOHLAUSVLSRLLT-OSWQYVSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K73824371	BRD-K73824371-001-01-9	Broad Institute of MIT and Harvard	BRD-K73824371			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19+,25+/m0/s1	GOHLAUSVLSRLLT-OSWQYVSFSA-N	450.251857588							101587
BRD-K11877130	LSM-9147		56835334	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30+/m0/s1	DEQYHGFYIZKXEQ-ZTNZZFSWSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K11877130	BRD-K11877130-001-01-4	Broad Institute of MIT and Harvard	BRD-K11877130			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30+/m0/s1	DEQYHGFYIZKXEQ-ZTNZZFSWSA-N	600.240640982							97768
BRD-K45442578	LSM-11198		56835226	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19+,26+/m1/s1	SNXQORXMPHKSCQ-MVYHEMRASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K45442578	BRD-K45442578-001-01-6	Broad Institute of MIT and Harvard	BRD-K45442578			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19+,26+/m1/s1	SNXQORXMPHKSCQ-MVYHEMRASA-N	520.268570292							99819
BRD-K99718824	LSM-14554		56835451	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m0/s1	FNKQMQRSMOAQIH-DDFCPOBKSA-N	COc1cccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45)c1	BroadT	BRD-K99718824	BRD-K99718824-001-01-6	Broad Institute of MIT and Harvard	BRD-K99718824			COc1cccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c2ccccc32)c1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m0/s1	FNKQMQRSMOAQIH-DDFCPOBKSA-N	584.29987042							103209
BRD-K72204100	LSM-12852		54637867	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21+,28-/m0/s1	HSJIFMVKIOATEF-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K72204100	BRD-K72204100-001-01-3	Broad Institute of MIT and Harvard	BRD-K72204100			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21+,28-/m0/s1	HSJIFMVKIOATEF-GTNJKRJXSA-N	569.250141198							101489
BRD-K04669648	LSM-8716		54637926	InChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20+,26+/m0/s1	ROXJHZXKWGUYER-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K04669648	BRD-K04669648-001-01-9	Broad Institute of MIT and Harvard	BRD-K04669648			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20+,26+/m0/s1	ROXJHZXKWGUYER-OUDXUNEISA-N	528.175263524							97337
BRD-K70284803-001-01-7	LSM-31514	BRD-K70284803	54637853	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21+,26-/m1/s1	OMNPDJXLWRDGEE-YZIHRLCOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K70284803	BRD-K70284803-001-01-7	Broad Institute of MIT and Harvard	BRD-K70284803			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21+,26-/m1/s1	OMNPDJXLWRDGEE-YZIHRLCOSA-N	581.20181263							120071
BRD-K87913872	LSM-13826		56835536	InChI=1S/C24H32N2O5S/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-31-23(17)14-25(3)32(4,29)30/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	UZINPKAPIFGTKL-STSQHVNTSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K87913872	BRD-K87913872-001-01-8	Broad Institute of MIT and Harvard	BRD-K87913872			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C24H32N2O5S/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-31-23(17)14-25(3)32(4,29)30/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23+/m1/s1	UZINPKAPIFGTKL-STSQHVNTSA-N	460.203192834							102476
CHEMBL2362365	LSM-8427	BRD-K00043782, SID134962090	56835356	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24-,31+/m0/s1	GHOSBDATJBJZOG-ISTJGCCRSA-N	COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K00043782	BRD-K00043782-001-01-7	Broad Institute of MIT and Harvard	BRD-K00043782			COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24-,31+/m0/s1	GHOSBDATJBJZOG-ISTJGCCRSA-N	598.315520484							97048
CHEMBL2358983	LSM-13786	SID134962105, BRD-K87357593	56835371	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21-,27+/m0/s1	XFTZCOPLMXQWPM-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K87357593	BRD-K87357593-001-01-6	Broad Institute of MIT and Harvard	BRD-K87357593			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21-,27+/m0/s1	XFTZCOPLMXQWPM-NOMHHCBYSA-N	581.20181263							102435
BRD-K37357048	LSM-10685		54637839	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24-,31-/m1/s1	GHOSBDATJBJZOG-OVMXQCPESA-N	COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K37357048	BRD-K37357048-001-01-8	Broad Institute of MIT and Harvard	BRD-K37357048			COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24-,31-/m1/s1	GHOSBDATJBJZOG-OVMXQCPESA-N	598.315520484							99306
CHEMBL3185277	LSM-8863	BRD-K07400331	56835314	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30+/m0/s1	FNKQMQRSMOAQIH-ZTNZZFSWSA-N	COc1cccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45)c1	BroadT	BRD-K07400331	BRD-K07400331-001-01-8	Broad Institute of MIT and Harvard	BRD-K07400331			COc1cccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c2ccccc32)c1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30+/m0/s1	FNKQMQRSMOAQIH-ZTNZZFSWSA-N	584.29987042							97484
BRD-K66199575	LSM-12466		56835350	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28+/m1/s1	BXWHKXPVJGEBOL-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K66199575	BRD-K66199575-001-01-9	Broad Institute of MIT and Harvard	BRD-K66199575			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28+/m1/s1	BXWHKXPVJGEBOL-WENCSYSZSA-N	540.273655672							131208
BRD-K99985506	LSM-14575		54637875	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22+,28-/m0/s1	FOMDXHZXOKRLRD-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K99985506	BRD-K99985506-001-01-6	Broad Institute of MIT and Harvard	BRD-K99985506			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22+,28-/m0/s1	FOMDXHZXOKRLRD-TYPXCFOJSA-N	507.309706822							103231
BRD-K33303625	LSM-10450		54637916	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30-/m0/s1	LTECXWQWCPQLLD-ZRLASMASSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K33303625	BRD-K33303625-001-01-7	Broad Institute of MIT and Harvard	BRD-K33303625			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30-/m0/s1	LTECXWQWCPQLLD-ZRLASMASSA-N	569.288971378							99071
BRD-K15224350	LSM-9341		54637915	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30-/m1/s1	LTECXWQWCPQLLD-DUELTEGESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K15224350	BRD-K15224350-001-01-8	Broad Institute of MIT and Harvard	BRD-K15224350			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30-/m1/s1	LTECXWQWCPQLLD-DUELTEGESA-N	569.288971378							97962
BRD-K73658839	LSM-12942		54638008	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22+,28+/m0/s1	KEOFNYFHDQHRAV-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K73658839	BRD-K73658839-001-01-7	Broad Institute of MIT and Harvard	BRD-K73658839			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22+,28+/m0/s1	KEOFNYFHDQHRAV-PFPZSTESSA-N	473.26784201							101579
BRD-K65300017	LSM-12408		54637878	InChI=1S/C33H39N3O5S/c1-23-18-36(24(2)20-37)33(38)32-31(28-16-10-11-17-29(28)35(32)4)27-15-9-8-14-26(27)21-41-30(23)19-34(3)42(39,40)22-25-12-6-5-7-13-25/h5-17,23-24,30,37H,18-22H2,1-4H3/t23-,24+,30-/m1/s1	LJWHPXFZVGGEPZ-FSGGQHMVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)Cc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K65300017	BRD-K65300017-001-01-0	Broad Institute of MIT and Harvard	BRD-K65300017			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-23-18-36(24(2)20-37)33(38)32-31(28-16-10-11-17-29(28)35(32)4)27-15-9-8-14-26(27)21-41-30(23)19-34(3)42(39,40)22-25-12-6-5-7-13-25/h5-17,23-24,30,37H,18-22H2,1-4H3/t23-,24+,30-/m1/s1	LJWHPXFZVGGEPZ-FSGGQHMVSA-N	589.261042068							101035
BRD-K70243592	LSM-12717		56835324	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23-,29+/m0/s1	VHDWJFVGOVHSLC-SBZVUBOMSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K70243592	BRD-K70243592-001-01-8	Broad Institute of MIT and Harvard	BRD-K70243592			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23-,29+/m0/s1	VHDWJFVGOVHSLC-SBZVUBOMSA-N	605.255956688							101352
BRD-K15651660	LSM-9365		56835221	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19-,25+/m1/s1	GOHLAUSVLSRLLT-RRQZXNHTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K15651660	BRD-K15651660-001-01-7	Broad Institute of MIT and Harvard	BRD-K15651660			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19-,25+/m1/s1	GOHLAUSVLSRLLT-RRQZXNHTSA-N	450.251857588							97986
BRD-K79027739	LSM-13256		54637912	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21+,26-/m1/s1	IEBNCDQMHLDDBS-YZIHRLCOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K79027739	BRD-K79027739-001-01-0	Broad Institute of MIT and Harvard	BRD-K79027739			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21+,26-/m1/s1	IEBNCDQMHLDDBS-YZIHRLCOSA-N	481.294056758							101895
BRD-K32532498	LSM-10403		54637889	InChI=1S/C24H32N2O5S/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-31-23(17)14-25(3)32(4,29)30/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23+/m0/s1	UZINPKAPIFGTKL-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K32532498	BRD-K32532498-001-01-6	Broad Institute of MIT and Harvard	BRD-K32532498			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C24H32N2O5S/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-31-23(17)14-25(3)32(4,29)30/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23+/m0/s1	UZINPKAPIFGTKL-YZZKKUAISA-N	460.203192834							99024
BRD-K62951188	LSM-12255		54638001	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19+,25-/m0/s1	GOHLAUSVLSRLLT-CEYNDMKZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K62951188	BRD-K62951188-001-01-6	Broad Institute of MIT and Harvard	BRD-K62951188			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19+,25-/m0/s1	GOHLAUSVLSRLLT-CEYNDMKZSA-N	450.251857588							100881
BRD-K87878159	LSM-13823		56835497	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22+,27+/m1/s1	RFSXMDVZFWHRJB-HLIRBWCUSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K87878159	BRD-K87878159-001-01-7	Broad Institute of MIT and Harvard	BRD-K87878159			CC(C)[C@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22+,27+/m1/s1	RFSXMDVZFWHRJB-HLIRBWCUSA-N	495.309706822							102473
BRD-K98695146	LSM-14487		56835422	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27+/m1/s1	QWRJLEHIBFFHOL-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K98695146	BRD-K98695146-001-01-8	Broad Institute of MIT and Harvard	BRD-K98695146			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27+/m1/s1	QWRJLEHIBFFHOL-GNMOFYLKSA-N	540.209421066							103142
BRD-K31042078	LSM-10301		56835406	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20+,27+/m0/s1	LBGXIXNVJUEMSO-ASHZAFPQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K31042078	BRD-K31042078-001-01-5	Broad Institute of MIT and Harvard	BRD-K31042078			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20+,27+/m0/s1	LBGXIXNVJUEMSO-ASHZAFPQSA-N	558.284220356							98922
BRD-K85124606	LSM-13630		54637933	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30+/m1/s1	DEQYHGFYIZKXEQ-JWUQWVJQSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K85124606	BRD-K85124606-001-01-7	Broad Institute of MIT and Harvard	BRD-K85124606			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30+/m1/s1	DEQYHGFYIZKXEQ-JWUQWVJQSA-N	600.240640982							102277
BRD-K26779385	LSM-10050		56835216	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19-,26-/m0/s1	SNXQORXMPHKSCQ-DGUDUIIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K26779385	BRD-K26779385-001-01-7	Broad Institute of MIT and Harvard	BRD-K26779385			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19-,26-/m0/s1	SNXQORXMPHKSCQ-DGUDUIIESA-N	520.268570292							98671
BRD-K14493775	LSM-9308		56835426	InChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20-,26+/m1/s1	ROXJHZXKWGUYER-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K14493775	BRD-K14493775-001-01-7	Broad Institute of MIT and Harvard	BRD-K14493775			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20-,26+/m1/s1	ROXJHZXKWGUYER-KYTVRQNUSA-N	528.175263524							97929
BRD-K28812281	LSM-10176		56835531	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24+,30+/m0/s1	BENJSVFNXVDSQO-FVBCXUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K28812281	BRD-K28812281-001-01-9	Broad Institute of MIT and Harvard	BRD-K28812281			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24+,30+/m0/s1	BENJSVFNXVDSQO-FVBCXUTKSA-N	553.294056758							98797
CHEMBL2354729	LSM-11591	BRD-K51712294, SID131434183	54637906	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24+,30-/m0/s1	BENJSVFNXVDSQO-BBANNHEPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K51712294	BRD-K51712294-001-01-6	Broad Institute of MIT and Harvard	BRD-K51712294			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24+,30-/m0/s1	BENJSVFNXVDSQO-BBANNHEPSA-N	553.294056758							100214
CHEMBL2359343	LSM-14193	BRD-K94032641, SID131434196	54637919	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29-/m1/s1	HIWUQZOVKTUVHW-UETOGOEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K94032641	BRD-K94032641-001-01-8	Broad Institute of MIT and Harvard	BRD-K94032641			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22+,29-/m1/s1	HIWUQZOVKTUVHW-UETOGOEVSA-N	572.279883904							102847
BRD-K65416492	LSM-12417		56835305	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m1/s1	FNKQMQRSMOAQIH-HFZPWKHCSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45)c1	BroadT	BRD-K65416492	BRD-K65416492-001-01-8	Broad Institute of MIT and Harvard	BRD-K65416492			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c2ccccc32)c1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m1/s1	FNKQMQRSMOAQIH-HFZPWKHCSA-N	584.29987042							101044
BRD-K42968051	LSM-11039		54638015	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23-,28-/m1/s1	RCQCJVVJEHACDL-MVOZIGHISA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K42968051	BRD-K42968051-001-01-9	Broad Institute of MIT and Harvard	BRD-K42968051			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23-,28-/m1/s1	RCQCJVVJEHACDL-MVOZIGHISA-N	536.234492962							99660
BRD-K75733071	LSM-13060		54637925	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-32(3)17-23-12-14-25(31)15-13-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22-,29-/m1/s1	KXTDYBDROYGOSG-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K75733071	BRD-K75733071-001-01-3	Broad Institute of MIT and Harvard	BRD-K75733071			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-32(3)17-23-12-14-25(31)15-13-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22-,29-/m1/s1	KXTDYBDROYGOSG-IEOSBIPESA-N	490.2631712							101697
BRD-K83033340	LSM-13504		54638028	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21+,27-/m0/s1	XFTZCOPLMXQWPM-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K83033340	BRD-K83033340-001-01-3	Broad Institute of MIT and Harvard	BRD-K83033340			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21+,27-/m0/s1	XFTZCOPLMXQWPM-ISCCLHIJSA-N	581.20181263							102145
BRD-K75252623	LSM-13033		56835333	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21-,26+/m0/s1	OMNPDJXLWRDGEE-ISJBWFOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K75252623	BRD-K75252623-001-01-7	Broad Institute of MIT and Harvard	BRD-K75252623			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21-,26+/m0/s1	OMNPDJXLWRDGEE-ISJBWFOZSA-N	581.20181263							101670
BRD-K12570990	LSM-9177		56835285	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21+,26+/m1/s1	OMNPDJXLWRDGEE-SWYRRKHMSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K12570990	BRD-K12570990-001-01-3	Broad Institute of MIT and Harvard	BRD-K12570990			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21+,26+/m1/s1	OMNPDJXLWRDGEE-SWYRRKHMSA-N	581.20181263							97798
BRD-K41944296	LSM-10976		56835238	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28+/m1/s1	HTGRXZBGTMWDTQ-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K41944296	BRD-K41944296-001-01-6	Broad Institute of MIT and Harvard	BRD-K41944296			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21-,28+/m1/s1	HTGRXZBGTMWDTQ-CJYOKPGZSA-N	504.242435756							99597
BRD-K56950264	LSM-11876		54638029	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21+,27-/m1/s1	XFTZCOPLMXQWPM-PBDKAQRYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K56950264	BRD-K56950264-001-01-3	Broad Institute of MIT and Harvard	BRD-K56950264			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21+,27-/m1/s1	XFTZCOPLMXQWPM-PBDKAQRYSA-N	581.20181263							100502
BRD-K58189273	LSM-11941		56835368	InChI=1S/C31H42N4O4/c1-21-17-35(22(2)19-36)31(38)30-29(25-13-9-10-14-26(25)34(30)6)24-12-8-7-11-23(24)20-39-27(21)18-33(5)28(37)15-16-32(3)4/h7-14,21-22,27,36H,15-20H2,1-6H3/t21-,22+,27+/m0/s1	UPHSEAQPRHOHRJ-OREGWCPLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K58189273	BRD-K58189273-001-01-5	Broad Institute of MIT and Harvard	BRD-K58189273			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H42N4O4/c1-21-17-35(22(2)19-36)31(38)30-29(25-13-9-10-14-26(25)34(30)6)24-12-8-7-11-23(24)20-39-27(21)18-33(5)28(37)15-16-32(3)4/h7-14,21-22,27,36H,15-20H2,1-6H3/t21-,22+,27+/m0/s1	UPHSEAQPRHOHRJ-OREGWCPLSA-N	534.320605864							100567
BRD-K55880295	LSM-11814		54637952	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28-/m1/s1	BXWHKXPVJGEBOL-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K55880295	BRD-K55880295-001-01-6	Broad Institute of MIT and Harvard	BRD-K55880295			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28-/m1/s1	BXWHKXPVJGEBOL-RZIGYZOXSA-N	540.273655672							100439
CHEMBL2362782	LSM-11866	BRD-K56883821, SID131434283	54638006	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20-,26-/m0/s1	YAQCSVWFCUIVLJ-DYLHXGEVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K56883821	BRD-K56883821-001-01-2	Broad Institute of MIT and Harvard	BRD-K56883821			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20-,26-/m0/s1	YAQCSVWFCUIVLJ-DYLHXGEVSA-N	503.278406694							100492
BRD-K61819258	LSM-12176		54637893	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27+/m0/s1	QWRJLEHIBFFHOL-NOMHHCBYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K61819258	BRD-K61819258-001-01-1	Broad Institute of MIT and Harvard	BRD-K61819258			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27+/m0/s1	QWRJLEHIBFFHOL-NOMHHCBYSA-N	540.209421066							100802
BRD-K31284555	LSM-10320		54637892	InChI=1S/C24H32N2O5S/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-31-23(17)14-25(3)32(4,29)30/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	UZINPKAPIFGTKL-PMAPCBKXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K31284555	BRD-K31284555-001-01-5	Broad Institute of MIT and Harvard	BRD-K31284555			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C24H32N2O5S/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-31-23(17)14-25(3)32(4,29)30/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23-/m1/s1	UZINPKAPIFGTKL-PMAPCBKXSA-N	460.203192834							98941
CHEMBL2360745	LSM-8782	BRD-K06096379, SID134962180	56835446	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24-,30-/m0/s1	VTQGPDBOURHJNB-CQUCHYGKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K06096379	BRD-K06096379-001-01-8	Broad Institute of MIT and Harvard	BRD-K06096379			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24-,30-/m0/s1	VTQGPDBOURHJNB-CQUCHYGKSA-N	514.283157716							97403
BRD-K79986209	LSM-13311		54638014	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23+,28-/m1/s1	RCQCJVVJEHACDL-AWVRMFGXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K79986209	BRD-K79986209-001-01-8	Broad Institute of MIT and Harvard	BRD-K79986209			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23+,28-/m1/s1	RCQCJVVJEHACDL-AWVRMFGXSA-N	536.234492962							101950
BRD-K39412479	LSM-10821		54637947	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28-/m1/s1	SHOKCNHESYLQAS-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K39412479	BRD-K39412479-001-01-7	Broad Institute of MIT and Harvard	BRD-K39412479			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28-/m1/s1	SHOKCNHESYLQAS-PHVLTXCSSA-N	556.179870576							99442
CHEMBL2361633	LSM-9082	BRD-K10808435, SID134961984	56835250	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-14-7-8-15-28(27)35(31)4)26-13-6-5-10-23(26)20-41-29(21)18-34(3)42(39,40)25-12-9-11-24(33)16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	QBEIQJOXWRLXRW-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K10808435	BRD-K10808435-001-01-2	Broad Institute of MIT and Harvard	BRD-K10808435			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-14-7-8-15-28(27)35(31)4)26-13-6-5-10-23(26)20-41-29(21)18-34(3)42(39,40)25-12-9-11-24(33)16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	QBEIQJOXWRLXRW-BXOOBUKZSA-N	593.235970172							97703
BRD-K23985677	LSM-9877		54637843	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21+,26-/m1/s1	NRKUZRFIJSCRHL-YZIHRLCOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K23985677	BRD-K23985677-001-01-0	Broad Institute of MIT and Harvard	BRD-K23985677			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21+,26-/m1/s1	NRKUZRFIJSCRHL-YZIHRLCOSA-N	579.251540024							98498
BRD-K91133575	LSM-14034		54637940	InChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19-,24-/m1/s1	BZAPUCLBFKATKI-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K91133575	BRD-K91133575-001-01-7	Broad Institute of MIT and Harvard	BRD-K91133575			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19-,24-/m1/s1	BZAPUCLBFKATKI-KHCICDEESA-N	581.217126508							102687
BRD-K16256442	LSM-9407		54637918	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29+/m1/s1	HIWUQZOVKTUVHW-QLVXXPONSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K16256442	BRD-K16256442-001-01-9	Broad Institute of MIT and Harvard	BRD-K16256442			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29+/m1/s1	HIWUQZOVKTUVHW-QLVXXPONSA-N	572.279883904							98028
BRD-K66357706	LSM-12472		56835469	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22+,28+/m1/s1	KEOFNYFHDQHRAV-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K66357706	BRD-K66357706-001-01-5	Broad Institute of MIT and Harvard	BRD-K66357706			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22+,28+/m1/s1	KEOFNYFHDQHRAV-WENCSYSZSA-N	473.26784201							101103
BRD-K01222176	LSM-8507		56835276	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28-/m0/s1	APRVPIVHITUHLQ-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K01222176	BRD-K01222176-001-01-0	Broad Institute of MIT and Harvard	BRD-K01222176			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28-/m0/s1	APRVPIVHITUHLQ-CZBREUMFSA-N	540.209421066							97128
BRD-K40483165	LSM-10899		56835499	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18+,24+/m1/s1	PBZGESVUNIXUSB-YTZAWJCFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K40483165	BRD-K40483165-001-01-4	Broad Institute of MIT and Harvard	BRD-K40483165			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(C)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18+,24+/m1/s1	PBZGESVUNIXUSB-YTZAWJCFSA-N	424.236207524							99520
BRD-K19275171	LSM-9587		54637998	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28-/m1/s1	PCQGWFREXHAZIT-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K19275171	BRD-K19275171-001-01-3	Broad Institute of MIT and Harvard	BRD-K19275171			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28-/m1/s1	PCQGWFREXHAZIT-DQCZWYHMSA-N	593.235970172							98208
BRD-K63837190	LSM-12318		56835387	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30+/m0/s1	LTECXWQWCPQLLD-DDFCPOBKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K63837190	BRD-K63837190-001-01-2	Broad Institute of MIT and Harvard	BRD-K63837190			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30+/m0/s1	LTECXWQWCPQLLD-DDFCPOBKSA-N	569.288971378							100945
BRD-K92793917	LSM-14117		46912146	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22+,28-/m0/s1	KEOFNYFHDQHRAV-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K92793917	BRD-K92793917-001-01-4	Broad Institute of MIT and Harvard	BRD-K92793917			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22+,28-/m0/s1	KEOFNYFHDQHRAV-TYPXCFOJSA-N	473.26784201							102771
BRD-K05498469	LSM-8751		54638022	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-14-7-8-15-28(27)35(31)4)26-13-6-5-10-23(26)20-41-29(21)18-34(3)42(39,40)25-12-9-11-24(33)16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29-/m1/s1	QBEIQJOXWRLXRW-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K05498469	BRD-K05498469-001-01-8	Broad Institute of MIT and Harvard	BRD-K05498469			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-14-7-8-15-28(27)35(31)4)26-13-6-5-10-23(26)20-41-29(21)18-34(3)42(39,40)25-12-9-11-24(33)16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22-,29-/m1/s1	QBEIQJOXWRLXRW-IEOSBIPESA-N	593.235970172							97372
CHEMBL2361643	LSM-11330	BRD-K47612243, SID131434143	54637866	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28+/m0/s1	HSJIFMVKIOATEF-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K47612243	BRD-K47612243-001-01-7	Broad Institute of MIT and Harvard	BRD-K47612243			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28+/m0/s1	HSJIFMVKIOATEF-YHGPEZAFSA-N	569.250141198							99951
BRD-K00954272	LSM-8495		56835275	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22+,27-/m0/s1	RFSXMDVZFWHRJB-FEEANGJJSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K00954272	BRD-K00954272-001-01-2	Broad Institute of MIT and Harvard	BRD-K00954272			CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22+,27-/m0/s1	RFSXMDVZFWHRJB-FEEANGJJSA-N	495.309706822							97116
BRD-K39597586	LSM-10833		54637856	InChI=1S/C31H36N2O5/c1-21-15-33(22(2)18-34)31(35)27-11-7-6-10-26(27)25-9-5-4-8-24(25)19-36-30(21)17-32(3)16-23-12-13-28-29(14-23)38-20-37-28/h4-14,21-22,30,34H,15-20H2,1-3H3/t21-,22+,30-/m0/s1	VTMUWCMJICVSQX-ZQLNOWDWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K39597586	BRD-K39597586-001-01-5	Broad Institute of MIT and Harvard	BRD-K39597586			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-15-33(22(2)18-34)31(35)27-11-7-6-10-26(27)25-9-5-4-8-24(25)19-36-30(21)17-32(3)16-23-12-13-28-29(14-23)38-20-37-28/h4-14,21-22,30,34H,15-20H2,1-3H3/t21-,22+,30-/m0/s1	VTMUWCMJICVSQX-ZQLNOWDWSA-N	516.262422272							99454
BRD-K53903148-001-01-7	LSM-31515	BRD-K53903148	54637838	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24+,31-/m1/s1	GHOSBDATJBJZOG-ULPIOCOXSA-N	COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K53903148	BRD-K53903148-001-01-7	Broad Institute of MIT and Harvard	BRD-K53903148			COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24+,31-/m1/s1	GHOSBDATJBJZOG-ULPIOCOXSA-N	598.315520484							120072
BRD-K34412442	LSM-10506		54637891	InChI=1S/C24H32N2O5S/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-31-23(17)14-25(3)32(4,29)30/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	UZINPKAPIFGTKL-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K34412442	BRD-K34412442-001-01-6	Broad Institute of MIT and Harvard	BRD-K34412442			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C24H32N2O5S/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-31-23(17)14-25(3)32(4,29)30/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18+,23-/m1/s1	UZINPKAPIFGTKL-IEGUWTFLSA-N	460.203192834							99127
BRD-K19054197	LSM-9572		54637976	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24+,30-/m1/s1	VTQGPDBOURHJNB-DLWGQWRRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K19054197	BRD-K19054197-001-01-2	Broad Institute of MIT and Harvard	BRD-K19054197			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24+,30-/m1/s1	VTQGPDBOURHJNB-DLWGQWRRSA-N	514.283157716							98193
BRD-K32864614	LSM-10423		56835434	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19-,25-/m0/s1	GOHLAUSVLSRLLT-MHPIHPPYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K32864614	BRD-K32864614-001-01-2	Broad Institute of MIT and Harvard	BRD-K32864614			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19-,25-/m0/s1	GOHLAUSVLSRLLT-MHPIHPPYSA-N	450.251857588							99044
BRD-K40123785	LSM-10878		54637944	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20-,25-/m1/s1	JTQSYHMCCHKQKK-UMEGOILYSA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K40123785	BRD-K40123785-001-01-6	Broad Institute of MIT and Harvard	BRD-K40123785			CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20-,25-/m1/s1	JTQSYHMCCHKQKK-UMEGOILYSA-N	468.262422272							99499
BRD-K11787592	LSM-9142		54637991	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30-/m0/s1	FNKQMQRSMOAQIH-BURCIIJTSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45)c1	BroadT	BRD-K11787592	BRD-K11787592-001-01-6	Broad Institute of MIT and Harvard	BRD-K11787592			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c2ccccc32)c1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30-/m0/s1	FNKQMQRSMOAQIH-BURCIIJTSA-N	584.29987042							97763
BRD-K08590382	LSM-8947		56835390	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21+,26+/m0/s1	NRKUZRFIJSCRHL-LZCXECNNSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K08590382	BRD-K08590382-001-01-3	Broad Institute of MIT and Harvard	BRD-K08590382			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21+,26+/m0/s1	NRKUZRFIJSCRHL-LZCXECNNSA-N	579.251540024							97568
BRD-K67037986	LSM-12510		56835396	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25+,31+/m0/s1	WVFRUYXRTWIHMU-CNFUJFEGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K67037986	BRD-K67037986-001-01-3	Broad Institute of MIT and Harvard	BRD-K67037986			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25+,31+/m0/s1	WVFRUYXRTWIHMU-CNFUJFEGSA-N	582.320605864							101141
BRD-K40505314	LSM-10900		56835295	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30+/m1/s1	DEQYHGFYIZKXEQ-HFZPWKHCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K40505314	BRD-K40505314-001-01-4	Broad Institute of MIT and Harvard	BRD-K40505314			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23+,30+/m1/s1	DEQYHGFYIZKXEQ-HFZPWKHCSA-N	600.240640982							99521
BRD-K22650859	LSM-9803		56835399	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28+/m1/s1	SHOKCNHESYLQAS-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K22650859	BRD-K22650859-001-01-1	Broad Institute of MIT and Harvard	BRD-K22650859			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28+/m1/s1	SHOKCNHESYLQAS-CJYOKPGZSA-N	556.179870576							98424
BRD-K50309272	LSM-11490		54637939	InChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19-,24-/m0/s1	BZAPUCLBFKATKI-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K50309272	BRD-K50309272-001-01-8	Broad Institute of MIT and Harvard	BRD-K50309272			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19-,24-/m0/s1	BZAPUCLBFKATKI-JXQFQVJHSA-N	581.217126508							100111
BRD-K05690403	LSM-14694		54637849	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	GTRXSASKUSVSHJ-UETOGOEVSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K05690403	BRD-K05690403-001-01-9	Broad Institute of MIT and Harvard	BRD-K05690403			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	GTRXSASKUSVSHJ-UETOGOEVSA-N	552.229407582							103350
BRD-K83837862	LSM-13553		56835558	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22-,28-/m0/s1	FOMDXHZXOKRLRD-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K83837862	BRD-K83837862-001-01-5	Broad Institute of MIT and Harvard	BRD-K83837862			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22-,28-/m0/s1	FOMDXHZXOKRLRD-VPYPWEPUSA-N	507.309706822							102195
BRD-K85359245	LSM-13649		54637928	InChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20-,26-/m1/s1	ROXJHZXKWGUYER-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K85359245	BRD-K85359245-001-01-6	Broad Institute of MIT and Harvard	BRD-K85359245			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-14-29(20(2)16-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-21(23)17-34-26(19)15-28(3)36(32,33)22-12-13-35-18-22/h4-13,18-20,26,30H,14-17H2,1-3H3/t19-,20-,26-/m1/s1	ROXJHZXKWGUYER-XMERXJNXSA-N	528.175263524							102296
BRD-K85169571	LSM-13633		54637931	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28-/m1/s1	APRVPIVHITUHLQ-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K85169571	BRD-K85169571-001-01-3	Broad Institute of MIT and Harvard	BRD-K85169571			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28-/m1/s1	APRVPIVHITUHLQ-PHVLTXCSSA-N	540.209421066							102280
CHEMBL2360750	LSM-14345	BRD-K96475865, SID134961993	56835259	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28+/m1/s1	PCQGWFREXHAZIT-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K96475865	BRD-K96475865-001-01-6	Broad Institute of MIT and Harvard	BRD-K96475865			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28+/m1/s1	PCQGWFREXHAZIT-WENCSYSZSA-N	593.235970172							102999
BRD-K97448504	LSM-14417		54638011	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22-,28-/m1/s1	KEOFNYFHDQHRAV-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K97448504	BRD-K97448504-001-01-9	Broad Institute of MIT and Harvard	BRD-K97448504			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22-,28-/m1/s1	KEOFNYFHDQHRAV-DQCZWYHMSA-N	473.26784201							103072
BRD-K55743364	LSM-11805		56835385	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20+,26+/m0/s1	YAQCSVWFCUIVLJ-OUDXUNEISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K55743364	BRD-K55743364-001-01-2	Broad Institute of MIT and Harvard	BRD-K55743364			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20+,26+/m0/s1	YAQCSVWFCUIVLJ-OUDXUNEISA-N	503.278406694							100430
BRD-K38942541	LSM-10786		56835412	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21+,27+/m0/s1	XFTZCOPLMXQWPM-FYQCMVGJSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K38942541	BRD-K38942541-001-01-8	Broad Institute of MIT and Harvard	BRD-K38942541			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21+,27+/m0/s1	XFTZCOPLMXQWPM-FYQCMVGJSA-N	581.20181263							99407
BRD-K61342953	LSM-12143		56835473	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28+/m1/s1	APRVPIVHITUHLQ-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K61342953	BRD-K61342953-001-01-2	Broad Institute of MIT and Harvard	BRD-K61342953			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28+/m1/s1	APRVPIVHITUHLQ-GGJMMHKRSA-N	540.209421066							100769
BRD-K63140065	LSM-12269		54637841	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24+,31+/m1/s1	GHOSBDATJBJZOG-OXYPMYLPSA-N	COc1ccc(CNC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K63140065	BRD-K63140065-001-01-3	Broad Institute of MIT and Harvard	BRD-K63140065			COc1ccc(CNC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24+,31+/m1/s1	GHOSBDATJBJZOG-OXYPMYLPSA-N	598.315520484							100895
BRD-K79003015	LSM-13253		56835494	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20+,25+/m1/s1	JTQSYHMCCHKQKK-RNHFSVANSA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K79003015	BRD-K79003015-001-01-6	Broad Institute of MIT and Harvard	BRD-K79003015			CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20+,25+/m1/s1	JTQSYHMCCHKQKK-RNHFSVANSA-N	468.262422272							101892
BRD-K08970510	LSM-8968		54637937	InChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19+,24-/m0/s1	BZAPUCLBFKATKI-GLDPYIMESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K08970510	BRD-K08970510-001-01-2	Broad Institute of MIT and Harvard	BRD-K08970510			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19+,24-/m0/s1	BZAPUCLBFKATKI-GLDPYIMESA-N	581.217126508							97589
CHEMBL3188225	LSM-11122	BRD-K44098776	56835532	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21+,28+/m1/s1	HSJIFMVKIOATEF-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K44098776	BRD-K44098776-001-01-7	Broad Institute of MIT and Harvard	BRD-K44098776			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21+,28+/m1/s1	HSJIFMVKIOATEF-GGJMMHKRSA-N	569.250141198							99743
CHEMBL3561856	LSM-31516	BRD-K81323843	54637852	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21+,26-/m0/s1	OMNPDJXLWRDGEE-UZINWLIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K81323843	BRD-K81323843-001-01-2	Broad Institute of MIT and Harvard	BRD-K81323843			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-16-33(21(2)18-34)30(35)29-28(24-12-7-8-13-25(24)32(29)4)23-11-6-5-10-22(23)19-38-26(20)17-31(3)40(36,37)27-14-9-15-39-27/h5-15,20-21,26,34H,16-19H2,1-4H3/t20-,21+,26-/m0/s1	OMNPDJXLWRDGEE-UZINWLIJSA-N	581.20181263							120073
BRD-K52204603	LSM-11622		56835349	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21-,26+/m0/s1	NRKUZRFIJSCRHL-ISJBWFOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K52204603	BRD-K52204603-001-01-9	Broad Institute of MIT and Harvard	BRD-K52204603			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21-,26+/m0/s1	NRKUZRFIJSCRHL-ISJBWFOZSA-N	579.251540024							131202
BRD-K75614533	LSM-13053		56835241	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28-/m0/s1	SHOKCNHESYLQAS-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K75614533	BRD-K75614533-001-01-7	Broad Institute of MIT and Harvard	BRD-K75614533			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33ClN2O5S/c1-20-16-32(21(2)18-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-37-28(20)17-31(3)38(35,36)24-14-12-23(30)13-15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21-,28-/m0/s1	SHOKCNHESYLQAS-CZBREUMFSA-N	556.179870576							101690
BRD-K80410762	LSM-13346		54637896	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m1/s1	QWRJLEHIBFFHOL-LGVUCKNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K80410762	BRD-K80410762-001-01-5	Broad Institute of MIT and Harvard	BRD-K80410762			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m1/s1	QWRJLEHIBFFHOL-LGVUCKNBSA-N	540.209421066							101985
BRD-K51574318	LSM-11581		54638021	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-14-7-8-15-28(27)35(31)4)26-13-6-5-10-23(26)20-41-29(21)18-34(3)42(39,40)25-12-9-11-24(33)16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	QBEIQJOXWRLXRW-UETOGOEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K51574318	BRD-K51574318-001-01-2	Broad Institute of MIT and Harvard	BRD-K51574318			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-14-7-8-15-28(27)35(31)4)26-13-6-5-10-23(26)20-41-29(21)18-34(3)42(39,40)25-12-9-11-24(33)16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	QBEIQJOXWRLXRW-UETOGOEVSA-N	593.235970172							100204
CHEMBL2355416	LSM-11757	BRD-K54889769, SID134961958	56835224	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29-/m0/s1	GTRXSASKUSVSHJ-SYZUXVNWSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K54889769	BRD-K54889769-001-01-5	Broad Institute of MIT and Harvard	BRD-K54889769			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22-,29-/m0/s1	GTRXSASKUSVSHJ-SYZUXVNWSA-N	552.229407582							100382
BRD-K50665432	LSM-11512		54638025	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-32(3)17-23-9-8-11-25(31)15-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22+,29-/m1/s1	ZIZYGTWNPVBARE-UETOGOEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K50665432	BRD-K50665432-001-01-0	Broad Institute of MIT and Harvard	BRD-K50665432			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-32(3)17-23-9-8-11-25(31)15-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22+,29-/m1/s1	ZIZYGTWNPVBARE-UETOGOEVSA-N	490.2631712							100133
BRD-K18552758	LSM-9546		56835297	InChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19+,24+/m1/s1	BZAPUCLBFKATKI-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K18552758	BRD-K18552758-001-01-7	Broad Institute of MIT and Harvard	BRD-K18552758			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19+,24+/m1/s1	BZAPUCLBFKATKI-IMWIBFENSA-N	581.217126508							98167
BRD-K83266926	LSM-13515		54637899	InChI=1S/C27H36N2O3/c1-19-14-29(20(2)17-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-22(23)18-32-26(19)16-28(3)15-21-12-13-21/h4-11,19-21,26,30H,12-18H2,1-3H3/t19-,20+,26-/m0/s1	XOTAGUVNSWBDBY-UNVFRBQDSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K83266926	BRD-K83266926-001-01-1	Broad Institute of MIT and Harvard	BRD-K83266926			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H36N2O3/c1-19-14-29(20(2)17-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-22(23)18-32-26(19)16-28(3)15-21-12-13-21/h4-11,19-21,26,30H,12-18H2,1-3H3/t19-,20+,26-/m0/s1	XOTAGUVNSWBDBY-UNVFRBQDSA-N	436.272593032							102156
BRD-K25420921	LSM-9972		54637857	InChI=1S/C31H36N2O5/c1-21-15-33(22(2)18-34)31(35)27-11-7-6-10-26(27)25-9-5-4-8-24(25)19-36-30(21)17-32(3)16-23-12-13-28-29(14-23)38-20-37-28/h4-14,21-22,30,34H,15-20H2,1-3H3/t21-,22+,30-/m1/s1	VTMUWCMJICVSQX-VDZJOXJSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K25420921	BRD-K25420921-001-01-0	Broad Institute of MIT and Harvard	BRD-K25420921			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-15-33(22(2)18-34)31(35)27-11-7-6-10-26(27)25-9-5-4-8-24(25)19-36-30(21)17-32(3)16-23-12-13-28-29(14-23)38-20-37-28/h4-14,21-22,30,34H,15-20H2,1-3H3/t21-,22+,30-/m1/s1	VTMUWCMJICVSQX-VDZJOXJSSA-N	516.262422272							98593
BRD-K08246588	LSM-8926		56835522	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28-/m0/s1	HSJIFMVKIOATEF-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K08246588	BRD-K08246588-001-01-4	Broad Institute of MIT and Harvard	BRD-K08246588			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28-/m0/s1	HSJIFMVKIOATEF-CZBREUMFSA-N	569.250141198							97547
CHEMBL2362701	LSM-9567	BRD-K19016650, SID134961932	56835198	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24+,30+/m1/s1	VTQGPDBOURHJNB-QAAVFVPKSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K19016650	BRD-K19016650-001-01-1	Broad Institute of MIT and Harvard	BRD-K19016650			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24+,30+/m1/s1	VTQGPDBOURHJNB-QAAVFVPKSA-N	514.283157716							98188
BRD-K62560708	LSM-12225		56835365	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23+,29+/m0/s1	VHDWJFVGOVHSLC-QFWOEDSFSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K62560708	BRD-K62560708-001-01-6	Broad Institute of MIT and Harvard	BRD-K62560708			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23+,29+/m0/s1	VHDWJFVGOVHSLC-QFWOEDSFSA-N	605.255956688							100851
BRD-K30912278	LSM-10293		56835236	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21-,26+/m1/s1	IEBNCDQMHLDDBS-YPCDYVTLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K30912278	BRD-K30912278-001-01-8	Broad Institute of MIT and Harvard	BRD-K30912278			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21-,26+/m1/s1	IEBNCDQMHLDDBS-YPCDYVTLSA-N	481.294056758							98914
BRD-K51019170	LSM-11542		54637943	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20+,25-/m0/s1	JTQSYHMCCHKQKK-DFIYOIEZSA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K51019170	BRD-K51019170-001-01-5	Broad Institute of MIT and Harvard	BRD-K51019170			CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20+,25-/m0/s1	JTQSYHMCCHKQKK-DFIYOIEZSA-N	468.262422272							100165
BRD-K21959862	LSM-9757		54637950	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-31(3)17-23-9-8-11-25(34)15-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22-,29-/m1/s1	WRXJNAGTDQYTEO-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K21959862	BRD-K21959862-001-01-2	Broad Institute of MIT and Harvard	BRD-K21959862			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(O)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O4/c1-21-16-32(22(2)19-33)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-31(3)17-23-9-8-11-25(34)15-23/h4-15,21-22,29,33-34H,16-20H2,1-3H3/t21-,22-,29-/m1/s1	WRXJNAGTDQYTEO-IEOSBIPESA-N	488.267507652							98378
BRD-K44021875	LSM-11117		54637877	InChI=1S/C33H39N3O5S/c1-23-18-36(24(2)20-37)33(38)32-31(28-16-10-11-17-29(28)35(32)4)27-15-9-8-14-26(27)21-41-30(23)19-34(3)42(39,40)22-25-12-6-5-7-13-25/h5-17,23-24,30,37H,18-22H2,1-4H3/t23-,24+,30-/m0/s1	LJWHPXFZVGGEPZ-BBANNHEPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)Cc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K44021875	BRD-K44021875-001-01-9	Broad Institute of MIT and Harvard	BRD-K44021875			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-23-18-36(24(2)20-37)33(38)32-31(28-16-10-11-17-29(28)35(32)4)27-15-9-8-14-26(27)21-41-30(23)19-34(3)42(39,40)22-25-12-6-5-7-13-25/h5-17,23-24,30,37H,18-22H2,1-4H3/t23-,24+,30-/m0/s1	LJWHPXFZVGGEPZ-BBANNHEPSA-N	589.261042068							99738
BRD-K54876931	LSM-11756		56835530	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28+/m0/s1	BXWHKXPVJGEBOL-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K54876931	BRD-K54876931-001-01-5	Broad Institute of MIT and Harvard	BRD-K54876931			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(26-11-7-8-12-27(26)35(30)4)25-10-6-5-9-24(25)20-40-28(21)18-34(3)31(38)23-13-15-33-16-14-23/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28+/m0/s1	BXWHKXPVJGEBOL-PFPZSTESSA-N	540.273655672							100381
BRD-K77381468	LSM-13159		54637872	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19-,26-/m1/s1	SNXQORXMPHKSCQ-LJKQEARRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K77381468	BRD-K77381468-001-01-0	Broad Institute of MIT and Harvard	BRD-K77381468			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19-,26-/m1/s1	SNXQORXMPHKSCQ-LJKQEARRSA-N	520.268570292							101797
BRD-K51143622	LSM-11554		54637969	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25+,31-/m0/s1	WVFRUYXRTWIHMU-NBTLCYJSSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K51143622	BRD-K51143622-001-01-7	Broad Institute of MIT and Harvard	BRD-K51143622			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25+,31-/m0/s1	WVFRUYXRTWIHMU-NBTLCYJSSA-N	582.320605864							100177
BRD-K59893964	LSM-12047		56835505	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	GTRXSASKUSVSHJ-BXOOBUKZSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K59893964	BRD-K59893964-001-01-5	Broad Institute of MIT and Harvard	BRD-K59893964			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-38-29(21)18-31(3)39(35,36)25-12-9-11-24(16-25)37-4/h5-16,21-22,29,33H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	GTRXSASKUSVSHJ-BXOOBUKZSA-N	552.229407582							100673
BRD-K35404971	LSM-10552		54637985	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22-,27-/m1/s1	RFSXMDVZFWHRJB-RSOWOKRSSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K35404971	BRD-K35404971-001-01-1	Broad Institute of MIT and Harvard	BRD-K35404971			CC(C)[C@@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22-,27-/m1/s1	RFSXMDVZFWHRJB-RSOWOKRSSA-N	495.309706822							99173
BRD-K34320757	LSM-10494		54637923	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-32(3)17-23-12-14-25(31)15-13-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22-,29+/m0/s1	KXTDYBDROYGOSG-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K34320757	BRD-K34320757-001-01-0	Broad Institute of MIT and Harvard	BRD-K34320757			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-32(3)17-23-12-14-25(31)15-13-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22-,29+/m0/s1	KXTDYBDROYGOSG-IHMCZWCLSA-N	490.2631712							99115
BRD-K83547636	LSM-13538		54637902	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23+,29-/m0/s1	VHDWJFVGOVHSLC-CTWZREHQSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K83547636	BRD-K83547636-001-01-5	Broad Institute of MIT and Harvard	BRD-K83547636			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23+,29-/m0/s1	VHDWJFVGOVHSLC-CTWZREHQSA-N	605.255956688							102180
BRD-K75308057	LSM-13034		54637920	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29-/m0/s1	HIWUQZOVKTUVHW-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K75308057	BRD-K75308057-001-01-2	Broad Institute of MIT and Harvard	BRD-K75308057			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H37FN4O4/c1-21-17-38(22(2)19-39)32(40)31-30(27-11-7-8-12-28(27)37(31)4)26-10-6-5-9-23(26)20-42-29(21)18-36(3)33(41)35-25-15-13-24(34)14-16-25/h5-16,21-22,29,39H,17-20H2,1-4H3,(H,35,41)/t21-,22-,29-/m0/s1	HIWUQZOVKTUVHW-SYZUXVNWSA-N	572.279883904							101671
BRD-K79967274	LSM-13308		54637874	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22-,28+/m0/s1	FOMDXHZXOKRLRD-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K79967274	BRD-K79967274-001-01-8	Broad Institute of MIT and Harvard	BRD-K79967274			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22-,28+/m0/s1	FOMDXHZXOKRLRD-RXYILKCJSA-N	507.309706822							101947
BRD-K31933349	LSM-10367		54637958	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20-,27-/m1/s1	LBGXIXNVJUEMSO-SEXOINJZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K31933349	BRD-K31933349-001-01-8	Broad Institute of MIT and Harvard	BRD-K31933349			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20-,27-/m1/s1	LBGXIXNVJUEMSO-SEXOINJZSA-N	558.284220356							98988
BRD-K27951502	LSM-10120		54637941	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20+,25+/m0/s1	JTQSYHMCCHKQKK-WZOHSFFVSA-N	CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K27951502	BRD-K27951502-001-01-9	Broad Institute of MIT and Harvard	BRD-K27951502			CC(C)OC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20+,25+/m0/s1	JTQSYHMCCHKQKK-WZOHSFFVSA-N	468.262422272							98741
CHEMBL2358027	LSM-12704	BRD-K70016992, SID134962141	56835407	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-14-7-8-15-28(27)35(31)4)26-13-6-5-10-23(26)20-41-29(21)18-34(3)42(39,40)25-12-9-11-24(33)16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29+/m0/s1	QBEIQJOXWRLXRW-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K70016992	BRD-K70016992-001-01-4	Broad Institute of MIT and Harvard	BRD-K70016992			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(27-14-7-8-15-28(27)35(31)4)26-13-6-5-10-23(26)20-41-29(21)18-34(3)42(39,40)25-12-9-11-24(33)16-25/h5-16,21-22,29,37H,17-20H2,1-4H3/t21-,22+,29+/m0/s1	QBEIQJOXWRLXRW-DKGMKSHISA-N	593.235970172							101339
BRD-K42902917	LSM-11033		54637870	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19-,26+/m0/s1	SNXQORXMPHKSCQ-LZJCXSABSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K42902917	BRD-K42902917-001-01-2	Broad Institute of MIT and Harvard	BRD-K42902917			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H36N4O5/c1-18-14-33(19(2)16-34)28(35)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-37-26(18)15-32(5)29(36)30-27-20(3)31-38-21(27)4/h6-13,18-19,26,34H,14-17H2,1-5H3,(H,30,36)/t18-,19-,26+/m0/s1	SNXQORXMPHKSCQ-LZJCXSABSA-N	520.268570292							99654
BRD-K04153348	LSM-8684		54637886	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22+,27-/m0/s1	QLIZXZIZGKFZES-XXAUWVGASA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K04153348	BRD-K04153348-001-01-7	Broad Institute of MIT and Harvard	BRD-K04153348			CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22+,27-/m0/s1	QLIZXZIZGKFZES-XXAUWVGASA-N	535.304621442							97305
BRD-K28862107	LSM-10180		56835435	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21-,26-/m0/s1	IEBNCDQMHLDDBS-WOVHNISZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K28862107	BRD-K28862107-001-01-6	Broad Institute of MIT and Harvard	BRD-K28862107			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21-,26-/m0/s1	IEBNCDQMHLDDBS-WOVHNISZSA-N	481.294056758							98801
BRD-K93657737	LSM-14169		54637983	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22+,27-/m0/s1	RFSXMDVZFWHRJB-HQKZVIGLSA-N	CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K93657737	BRD-K93657737-001-01-8	Broad Institute of MIT and Harvard	BRD-K93657737			CC(C)[C@@H](C)NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21+,22+,27-/m0/s1	RFSXMDVZFWHRJB-HQKZVIGLSA-N	495.309706822							102823
BRD-K28018597	LSM-10125		54637905	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23-,29-/m1/s1	VHDWJFVGOVHSLC-VDWGHMIBSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K28018597	BRD-K28018597-001-01-2	Broad Institute of MIT and Harvard	BRD-K28018597			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23-,29-/m1/s1	VHDWJFVGOVHSLC-VDWGHMIBSA-N	605.255956688							98746
BRD-K17375958	LSM-9472		56835292	InChI=1S/C33H39N3O5S/c1-23-18-36(24(2)20-37)33(38)32-31(28-16-10-11-17-29(28)35(32)4)27-15-9-8-14-26(27)21-41-30(23)19-34(3)42(39,40)22-25-12-6-5-7-13-25/h5-17,23-24,30,37H,18-22H2,1-4H3/t23-,24+,30+/m1/s1	LJWHPXFZVGGEPZ-QEGDFHJFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)Cc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K17375958	BRD-K17375958-001-01-2	Broad Institute of MIT and Harvard	BRD-K17375958			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H39N3O5S/c1-23-18-36(24(2)20-37)33(38)32-31(28-16-10-11-17-29(28)35(32)4)27-15-9-8-14-26(27)21-41-30(23)19-34(3)42(39,40)22-25-12-6-5-7-13-25/h5-17,23-24,30,37H,18-22H2,1-4H3/t23-,24+,30+/m1/s1	LJWHPXFZVGGEPZ-QEGDFHJFSA-N	589.261042068							98093
BRD-K11112971	LSM-9107		54637956	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20+,27-/m1/s1	LBGXIXNVJUEMSO-IOKPGSKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K11112971	BRD-K11112971-001-01-8	Broad Institute of MIT and Harvard	BRD-K11112971			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O5/c1-19-15-36(20(2)17-37)32(39)30-29(25-13-9-10-14-26(25)35(30)6)24-12-8-7-11-23(24)18-40-27(19)16-34(5)31(38)28-21(3)33-41-22(28)4/h7-14,19-20,27,37H,15-18H2,1-6H3/t19-,20+,27-/m1/s1	LBGXIXNVJUEMSO-IOKPGSKQSA-N	558.284220356							97728
BRD-K01787550	LSM-8545		56835496	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27+/m1/s1	QWRJLEHIBFFHOL-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K01787550	BRD-K01787550-001-01-8	Broad Institute of MIT and Harvard	BRD-K01787550			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-37-27(20)17-31(3)38(35,36)28-15-9-8-14-26(28)30/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27+/m1/s1	QWRJLEHIBFFHOL-BUEREQSYSA-N	540.209421066							97166
BRD-K71710045	LSM-12816		54637981	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22-,27+/m0/s1	RFSXMDVZFWHRJB-GHIUXRNCSA-N	CC(C)[C@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K71710045	BRD-K71710045-001-01-8	Broad Institute of MIT and Harvard	BRD-K71710045			CC(C)[C@H](C)NC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C29H41N3O4/c1-19(2)22(5)30-29(35)31(6)16-27-20(3)15-32(21(4)17-33)28(34)26-14-10-9-13-25(26)24-12-8-7-11-23(24)18-36-27/h7-14,19-22,27,33H,15-18H2,1-6H3,(H,30,35)/t20-,21-,22-,27+/m0/s1	RFSXMDVZFWHRJB-GHIUXRNCSA-N	495.309706822							101453
BRD-K11609893	LSM-9135		56835201	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22+,28+/m1/s1	FOMDXHZXOKRLRD-WENCSYSZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K11609893	BRD-K11609893-001-01-8	Broad Institute of MIT and Harvard	BRD-K11609893			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22+,28+/m1/s1	FOMDXHZXOKRLRD-WENCSYSZSA-N	507.309706822							97756
BRD-K22814206	LSM-9814		56835300	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30+/m1/s1	LTECXWQWCPQLLD-HFZPWKHCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K22814206	BRD-K22814206-001-01-3	Broad Institute of MIT and Harvard	BRD-K22814206			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30+/m1/s1	LTECXWQWCPQLLD-HFZPWKHCSA-N	569.288971378							98435
CHEMBL2360924	LSM-10623	BRD-K36314330, SID131434270	54637993	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30-/m0/s1	FNKQMQRSMOAQIH-ZRLASMASSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45)c1	BroadT	BRD-K36314330	BRD-K36314330-001-01-7	Broad Institute of MIT and Harvard	BRD-K36314330			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c2ccccc32)c1	InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23-,30-/m0/s1	FNKQMQRSMOAQIH-ZRLASMASSA-N	584.29987042							99244
BRD-K38431902	LSM-10754		56835308	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28+/m1/s1	HTGRXZBGTMWDTQ-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K38431902	BRD-K38431902-001-01-5	Broad Institute of MIT and Harvard	BRD-K38431902			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33FN2O4/c1-20-16-33(21(2)18-34)30(36)27-11-7-6-10-26(27)25-9-5-4-8-23(25)19-37-28(20)17-32(3)29(35)22-12-14-24(31)15-13-22/h4-15,20-21,28,34H,16-19H2,1-3H3/t20-,21+,28+/m1/s1	HTGRXZBGTMWDTQ-GGJMMHKRSA-N	504.242435756							99375
BRD-K49921033	LSM-11464		54637868	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28-/m1/s1	HSJIFMVKIOATEF-UMQWNRPGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K49921033	BRD-K49921033-001-01-4	Broad Institute of MIT and Harvard	BRD-K49921033			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-41-28(20)17-36(3)30(40)35-24-11-8-10-23(15-24)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28-/m1/s1	HSJIFMVKIOATEF-UMQWNRPGSA-N	569.250141198							100085
BRD-K84475927	LSM-13594		54637844	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21-,26-/m0/s1	NRKUZRFIJSCRHL-WOVHNISZSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K84475927	BRD-K84475927-001-01-6	Broad Institute of MIT and Harvard	BRD-K84475927			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N5O5S/c1-20-14-35(21(2)17-36)30(37)29-28(24-12-8-9-13-25(24)34(29)5)23-11-7-6-10-22(23)18-40-26(20)15-33(4)41(38,39)27-16-32(3)19-31-27/h6-13,16,19-21,26,36H,14-15,17-18H2,1-5H3/t20-,21-,26-/m0/s1	NRKUZRFIJSCRHL-WOVHNISZSA-N	579.251540024							102238
BRD-K25878320	LSM-9998		56835548	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18-,24+/m1/s1	PBZGESVUNIXUSB-GGUMNFRJSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K25878320	BRD-K25878320-001-01-6	Broad Institute of MIT and Harvard	BRD-K25878320			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(C)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18-,24+/m1/s1	PBZGESVUNIXUSB-GGUMNFRJSA-N	424.236207524							98619
BRD-K71040278	LSM-12765		54637901	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23-,29+/m1/s1	VHDWJFVGOVHSLC-SGQNLQFHSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K71040278	BRD-K71040278-001-01-8	Broad Institute of MIT and Harvard	BRD-K71040278			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(26-14-8-9-15-27(26)35(32)4)25-13-7-6-12-24(25)21-42-29(22)19-34(3)43(39,40)30-17-11-10-16-28(30)41-5/h6-17,22-23,29,37H,18-21H2,1-5H3/t22-,23-,29+/m1/s1	VHDWJFVGOVHSLC-SGQNLQFHSA-N	605.255956688							101402
BRD-K23455135	LSM-9841		54637884	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18-,24-/m1/s1	PBZGESVUNIXUSB-QZTZHPFYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K23455135	BRD-K23455135-001-01-0	Broad Institute of MIT and Harvard	BRD-K23455135			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(C)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18-,24-/m1/s1	PBZGESVUNIXUSB-QZTZHPFYSA-N	424.236207524							98462
BRD-K54391669	LSM-11731		54637963	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25+,31+/m1/s1	WVFRUYXRTWIHMU-CYOUBLJMSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K54391669	BRD-K54391669-001-01-3	Broad Institute of MIT and Harvard	BRD-K54391669			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24-,25+,31+/m1/s1	WVFRUYXRTWIHMU-CYOUBLJMSA-N	582.320605864							100356
BRD-K46522835	LSM-11268		54637907	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24+,30-/m1/s1	BENJSVFNXVDSQO-FSGGQHMVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K46522835	BRD-K46522835-001-01-3	Broad Institute of MIT and Harvard	BRD-K46522835			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24+,30-/m1/s1	BENJSVFNXVDSQO-FSGGQHMVSA-N	553.294056758							99889
BRD-K33044853	LSM-10438		56835258	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22+,27+/m1/s1	QLIZXZIZGKFZES-VHSZZVNMSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K33044853	BRD-K33044853-001-01-0	Broad Institute of MIT and Harvard	BRD-K33044853			CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22+,27+/m1/s1	QLIZXZIZGKFZES-VHSZZVNMSA-N	535.304621442							99059
BRD-K61796480	LSM-12175		54637995	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28+/m1/s1	PCQGWFREXHAZIT-XJGOYTCSSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K61796480	BRD-K61796480-001-01-1	Broad Institute of MIT and Harvard	BRD-K61796480			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22-,28+/m1/s1	PCQGWFREXHAZIT-XJGOYTCSSA-N	593.235970172							100801
BRD-K76103468	LSM-13082		56835479	InChI=1S/C27H36N2O3/c1-19-14-29(20(2)17-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-22(23)18-32-26(19)16-28(3)15-21-12-13-21/h4-11,19-21,26,30H,12-18H2,1-3H3/t19-,20+,26+/m1/s1	XOTAGUVNSWBDBY-GOHWNWGWSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K76103468	BRD-K76103468-001-01-9	Broad Institute of MIT and Harvard	BRD-K76103468			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)CC2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H36N2O3/c1-19-14-29(20(2)17-30)27(31)25-11-7-6-10-24(25)23-9-5-4-8-22(23)18-32-26(19)16-28(3)15-21-12-13-21/h4-11,19-21,26,30H,12-18H2,1-3H3/t19-,20+,26+/m1/s1	XOTAGUVNSWBDBY-GOHWNWGWSA-N	436.272593032							101720
BRD-K35885715	LSM-10583		54638027	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21-,27+/m1/s1	XFTZCOPLMXQWPM-GNMOFYLKSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K35885715	BRD-K35885715-001-01-2	Broad Institute of MIT and Harvard	BRD-K35885715			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H35N3O5S2/c1-20-15-33(21(2)17-34)30(35)29-28(25-11-7-8-12-26(25)32(29)4)24-10-6-5-9-22(24)18-38-27(20)16-31(3)40(36,37)23-13-14-39-19-23/h5-14,19-21,27,34H,15-18H2,1-4H3/t20-,21-,27+/m1/s1	XFTZCOPLMXQWPM-GNMOFYLKSA-N	581.20181263							99204
BRD-K74556269	LSM-12996		56835433	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18-,24-/m0/s1	PBZGESVUNIXUSB-XFAGBWLFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K74556269	BRD-K74556269-001-01-1	Broad Institute of MIT and Harvard	BRD-K74556269			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(C)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C25H32N2O4/c1-17-13-27(18(2)15-28)25(30)23-12-8-7-11-22(23)21-10-6-5-9-20(21)16-31-24(17)14-26(4)19(3)29/h5-12,17-18,24,28H,13-16H2,1-4H3/t17-,18-,24-/m0/s1	PBZGESVUNIXUSB-XFAGBWLFSA-N	424.236207524							101633
BRD-K81945689	LSM-13430		54637876	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22+,28-/m1/s1	FOMDXHZXOKRLRD-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K81945689	BRD-K81945689-001-01-9	Broad Institute of MIT and Harvard	BRD-K81945689			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H41N3O4/c1-21-17-33(22(2)19-34)29(35)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-37-28(21)18-32(3)30(36)31-24-12-5-4-6-13-24/h7-11,14-16,21-22,24,28,34H,4-6,12-13,17-20H2,1-3H3,(H,31,36)/t21-,22+,28-/m1/s1	FOMDXHZXOKRLRD-RZIGYZOXSA-N	507.309706822							102070
BRD-K97925203	LSM-14447		56835248	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20-,25-/m0/s1	JTQSYHMCCHKQKK-RLSLOFABSA-N	CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K97925203	BRD-K97925203-001-01-0	Broad Institute of MIT and Harvard	BRD-K97925203			CC(C)OC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C27H36N2O5/c1-18(2)34-27(32)28(5)15-25-19(3)14-29(20(4)16-30)26(31)24-13-9-8-12-23(24)22-11-7-6-10-21(22)17-33-25/h6-13,18-20,25,30H,14-17H2,1-5H3/t19-,20-,25-/m0/s1	JTQSYHMCCHKQKK-RLSLOFABSA-N	468.262422272							103102
BRD-K32827537	LSM-10421		54638007	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20-,26-/m1/s1	YAQCSVWFCUIVLJ-XMERXJNXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K32827537	BRD-K32827537-001-01-3	Broad Institute of MIT and Harvard	BRD-K32827537			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20-,26-/m1/s1	YAQCSVWFCUIVLJ-XMERXJNXSA-N	503.278406694							99042
BRD-K91416922	LSM-14045		56835444	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24+,30-/m0/s1	VTQGPDBOURHJNB-WAHOFHFDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K91416922	BRD-K91416922-001-01-6	Broad Institute of MIT and Harvard	BRD-K91416922			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24+,30-/m0/s1	VTQGPDBOURHJNB-WAHOFHFDSA-N	514.283157716							102698
BRD-K57216724	LSM-11895		54637967	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25+,31-/m1/s1	WVFRUYXRTWIHMU-AOHZZOSCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K57216724	BRD-K57216724-001-01-2	Broad Institute of MIT and Harvard	BRD-K57216724			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25+,31-/m1/s1	WVFRUYXRTWIHMU-AOHZZOSCSA-N	582.320605864							100521
BRD-K43980524	LSM-11113		56835389	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28+/m0/s1	PCQGWFREXHAZIT-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K43980524	BRD-K43980524-001-01-2	Broad Institute of MIT and Harvard	BRD-K43980524			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H36FN3O5S/c1-21-17-36(22(2)19-37)32(38)31-30(25-13-7-9-15-27(25)35(31)4)24-12-6-5-11-23(24)20-41-28(21)18-34(3)42(39,40)29-16-10-8-14-26(29)33/h5-16,21-22,28,37H,17-20H2,1-4H3/t21-,22+,28+/m0/s1	PCQGWFREXHAZIT-PFPZSTESSA-N	593.235970172							99734
CHEMBL2362381	LSM-8599	BRD-K02581961, SID134962218	56835484	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24-,30+/m0/s1	BENJSVFNXVDSQO-FOUYOVOOSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K02581961	BRD-K02581961-001-01-7	Broad Institute of MIT and Harvard	BRD-K02581961			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O4/c1-23-19-37(24(2)21-38)34(40)33-32(28-16-10-11-17-29(28)36(33)4)27-15-9-8-14-26(27)22-41-30(23)20-35(3)31(39)18-25-12-6-5-7-13-25/h5-17,23-24,30,38H,18-22H2,1-4H3/t23-,24-,30+/m0/s1	BENJSVFNXVDSQO-FOUYOVOOSA-N	553.294056758							97220
BRD-K78228015	LSM-13213		56835529	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24-,30+/m1/s1	VTQGPDBOURHJNB-IFVFNEAISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K78228015	BRD-K78228015-001-01-0	Broad Institute of MIT and Harvard	BRD-K78228015			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24-,30+/m1/s1	VTQGPDBOURHJNB-IFVFNEAISA-N	514.283157716							101851
CHEMBL2361545	LSM-13475	BRD-K82621995, SID131434301	54638024	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-32(3)17-23-9-8-11-25(31)15-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22+,29-/m0/s1	ZIZYGTWNPVBARE-KERYWQKISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K82621995	BRD-K82621995-001-01-4	Broad Institute of MIT and Harvard	BRD-K82621995			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-36-29(21)18-32(3)17-23-9-8-11-25(31)15-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22+,29-/m0/s1	ZIZYGTWNPVBARE-KERYWQKISA-N	490.2631712							102115
BRD-K05500678	LSM-8752		54637975	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24+,30-/m0/s1	VTQGPDBOURHJNB-YTNVWYNJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K05500678	BRD-K05500678-001-01-8	Broad Institute of MIT and Harvard	BRD-K05500678			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23+,24+,30-/m0/s1	VTQGPDBOURHJNB-YTNVWYNJSA-N	514.283157716							97373
BRD-K29035246	LSM-10188		54637966	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25-,31-/m1/s1	WVFRUYXRTWIHMU-XDAUYTPDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K29035246	BRD-K29035246-001-01-0	Broad Institute of MIT and Harvard	BRD-K29035246			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25-,31-/m1/s1	WVFRUYXRTWIHMU-XDAUYTPDSA-N	582.320605864							98809
BRD-K29427427	LSM-10213		54638009	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22-,28+/m0/s1	KEOFNYFHDQHRAV-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K29427427	BRD-K29427427-001-01-0	Broad Institute of MIT and Harvard	BRD-K29427427			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-11-7-6-10-26(27)25-9-5-4-8-24(25)20-35-28(21)18-31(3)17-23-12-14-30-15-13-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22-,28+/m0/s1	KEOFNYFHDQHRAV-RXYILKCJSA-N	473.26784201							98834
BRD-K75745425	LSM-13061		56835492	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24-,30+/m1/s1	VTQGPDBOURHJNB-KJMNMTOCSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K75745425	BRD-K75745425-001-01-0	Broad Institute of MIT and Harvard	BRD-K75745425			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24-,30+/m1/s1	VTQGPDBOURHJNB-KJMNMTOCSA-N	514.283157716							101698
BRD-K92730269	LSM-14111		54638002	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19+,25-/m1/s1	GOHLAUSVLSRLLT-HHJKRLRDSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K92730269	BRD-K92730269-001-01-0	Broad Institute of MIT and Harvard	BRD-K92730269			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N2O4/c1-18-14-29(19(2)16-30)27(32)24-11-7-6-10-23(24)22-9-5-4-8-21(22)17-33-25(18)15-28(3)26(31)20-12-13-20/h4-11,18-20,25,30H,12-17H2,1-3H3/t18-,19+,25-/m1/s1	GOHLAUSVLSRLLT-HHJKRLRDSA-N	450.251857588							102765
BRD-K69692345	LSM-12680		56835519	InChI=1S/C31H36N2O5/c1-21-15-33(22(2)18-34)31(35)27-11-7-6-10-26(27)25-9-5-4-8-24(25)19-36-30(21)17-32(3)16-23-12-13-28-29(14-23)38-20-37-28/h4-14,21-22,30,34H,15-20H2,1-3H3/t21-,22-,30-/m0/s1	VTMUWCMJICVSQX-PWWNZBMUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K69692345	BRD-K69692345-001-01-9	Broad Institute of MIT and Harvard	BRD-K69692345			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-15-33(22(2)18-34)31(35)27-11-7-6-10-26(27)25-9-5-4-8-24(25)19-36-30(21)17-32(3)16-23-12-13-28-29(14-23)38-20-37-28/h4-14,21-22,30,34H,15-20H2,1-3H3/t21-,22-,30-/m0/s1	VTMUWCMJICVSQX-PWWNZBMUSA-N	516.262422272							101314
BRD-K30347205	LSM-10257		54637922	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-32(3)17-23-12-14-25(31)15-13-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22+,29+/m0/s1	KXTDYBDROYGOSG-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K30347205	BRD-K30347205-001-01-5	Broad Institute of MIT and Harvard	BRD-K30347205			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H35FN2O3/c1-21-16-33(22(2)19-34)30(35)28-11-7-6-10-27(28)26-9-5-4-8-24(26)20-36-29(21)18-32(3)17-23-12-14-25(31)15-13-23/h4-15,21-22,29,34H,16-20H2,1-3H3/t21-,22+,29+/m0/s1	KXTDYBDROYGOSG-DKGMKSHISA-N	490.2631712							98878
BRD-K42712649	LSM-11024		56835231	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25+,31+/m1/s1	WVFRUYXRTWIHMU-HSFWNXDSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K42712649	BRD-K42712649-001-01-0	Broad Institute of MIT and Harvard	BRD-K42712649			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C35H42N4O4/c1-23-19-39(24(2)21-40)34(41)33-32(29-17-11-12-18-30(29)38(33)5)28-16-10-9-15-27(28)22-43-31(23)20-37(4)35(42)36-25(3)26-13-7-6-8-14-26/h6-18,23-25,31,40H,19-22H2,1-5H3,(H,36,42)/t23-,24+,25+,31+/m1/s1	WVFRUYXRTWIHMU-HSFWNXDSSA-N	582.320605864							99645
BRD-K71195237	LSM-12775		54637914	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30-/m0/s1	LTECXWQWCPQLLD-BURCIIJTSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(=O)O)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K71195237	BRD-K71195237-001-01-0	Broad Institute of MIT and Harvard	BRD-K71195237			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(O)=O)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23+,30-/m0/s1	LTECXWQWCPQLLD-BURCIIJTSA-N	569.288971378							101412
BRD-K21209030	LSM-9718		54637863	InChI=1S/C31H38N2O4/c1-22-17-33(23(2)20-34)31(35)29-15-8-7-14-28(29)27-13-6-5-11-25(27)21-37-30(22)19-32(3)18-24-10-9-12-26(16-24)36-4/h5-16,22-23,30,34H,17-21H2,1-4H3/t22-,23+,30+/m0/s1	JYPGTBVWUBFVKL-DDFCPOBKSA-N	COc1cccc(CN(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO)c1	BroadT	BRD-K21209030	BRD-K21209030-001-01-9	Broad Institute of MIT and Harvard	BRD-K21209030			COc1cccc(CN(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)c1	InChI=1S/C31H38N2O4/c1-22-17-33(23(2)20-34)31(35)29-15-8-7-14-28(29)27-13-6-5-11-25(27)21-37-30(22)19-32(3)18-24-10-9-12-26(16-24)36-4/h5-16,22-23,30,34H,17-21H2,1-4H3/t22-,23+,30+/m0/s1	JYPGTBVWUBFVKL-DDFCPOBKSA-N	502.283157716							98339
BRD-K64075070	LSM-12341		54638003	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20-,26+/m1/s1	YAQCSVWFCUIVLJ-KYTVRQNUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K64075070	BRD-K64075070-001-01-3	Broad Institute of MIT and Harvard	BRD-K64075070			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)C2CC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H37N3O4/c1-19-15-33(20(2)17-34)30(36)28-27(24-11-7-8-12-25(24)32(28)4)23-10-6-5-9-22(23)18-37-26(19)16-31(3)29(35)21-13-14-21/h5-12,19-21,26,34H,13-18H2,1-4H3/t19-,20-,26+/m1/s1	YAQCSVWFCUIVLJ-KYTVRQNUSA-N	503.278406694							100968
BRD-K18304318	LSM-9524		54637930	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28-/m0/s1	APRVPIVHITUHLQ-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K18304318	BRD-K18304318-001-01-6	Broad Institute of MIT and Harvard	BRD-K18304318			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33FN2O5S/c1-20-16-32(21(2)18-33)29(34)27-14-7-6-13-26(27)25-12-5-4-9-22(25)19-37-28(20)17-31(3)38(35,36)24-11-8-10-23(30)15-24/h4-15,20-21,28,33H,16-19H2,1-3H3/t20-,21+,28-/m0/s1	APRVPIVHITUHLQ-GTNJKRJXSA-N	540.209421066							98145
BRD-K11880681	LSM-9148		56835202	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23+,28+/m1/s1	RCQCJVVJEHACDL-IWHLBADBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K11880681	BRD-K11880681-001-01-1	Broad Institute of MIT and Harvard	BRD-K11880681			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-21-11-5-10-16-29(21)38(35,36)31(4)18-28-22(2)17-32(23(3)19-33)30(34)27-15-9-8-14-26(27)25-13-7-6-12-24(25)20-37-28/h5-16,22-23,28,33H,17-20H2,1-4H3/t22-,23+,28+/m1/s1	RCQCJVVJEHACDL-IWHLBADBSA-N	536.234492962							97769
BRD-K48575680	LSM-11386		54637936	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30-/m1/s1	DEQYHGFYIZKXEQ-IQLGONJTSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K48575680	BRD-K48575680-001-01-5	Broad Institute of MIT and Harvard	BRD-K48575680			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-25(27)21-42-30(22)19-35(3)43(40,41)26-12-9-10-24(16-26)17-34/h5-16,22-23,30,38H,18-21H2,1-4H3/t22-,23-,30-/m1/s1	DEQYHGFYIZKXEQ-IQLGONJTSA-N	600.240640982							100007
BRD-K83147038	LSM-13511		54637885	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22-,27+/m1/s1	QLIZXZIZGKFZES-LOYIFYEOSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34	BroadT	BRD-K83147038	BRD-K83147038-001-01-8	Broad Institute of MIT and Harvard	BRD-K83147038			CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C31H41N3O5/c1-20(2)18-39-31(37)32(5)16-27-21(3)15-34(22(4)17-35)30(36)29-28(24-12-8-7-11-23(24)19-38-27)25-13-9-10-14-26(25)33(29)6/h7-14,20-22,27,35H,15-19H2,1-6H3/t21-,22-,27+/m1/s1	QLIZXZIZGKFZES-LOYIFYEOSA-N	535.304621442							102152
BRD-K06421369	LSM-8803		54637858	InChI=1S/C30H36N2O5S/c1-22-17-32(23(2)19-33)30(34)28-16-10-9-15-27(28)26-14-8-7-13-25(26)20-37-29(22)18-31(3)38(35,36)21-24-11-5-4-6-12-24/h4-16,22-23,29,33H,17-21H2,1-3H3/t22-,23+,29-/m1/s1	CCIBAFIAEKPPJU-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)Cc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K06421369	BRD-K06421369-001-01-0	Broad Institute of MIT and Harvard	BRD-K06421369			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)Cc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H36N2O5S/c1-22-17-32(23(2)19-33)30(34)28-16-10-9-15-27(28)26-14-8-7-13-25(26)20-37-29(22)18-31(3)38(35,36)21-24-11-5-4-6-12-24/h4-16,22-23,29,33H,17-21H2,1-3H3/t22-,23+,29-/m1/s1	CCIBAFIAEKPPJU-RLPNJSHFSA-N	536.234492962							97424
BRD-K09929560	LSM-9039		56835441	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m0/s1	VHVNEVJWYRMESY-IZVMNLJQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K09929560	BRD-K09929560-001-01-6	Broad Institute of MIT and Harvard	BRD-K09929560			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21-,27-/m0/s1	VHVNEVJWYRMESY-IZVMNLJQSA-N	487.247106566							97660
BRD-K45571747	LSM-11210		54638017	InChI=1S/C31H42N4O4/c1-21-17-35(22(2)19-36)31(38)30-29(25-13-9-10-14-26(25)34(30)6)24-12-8-7-11-23(24)20-39-27(21)18-33(5)28(37)15-16-32(3)4/h7-14,21-22,27,36H,15-20H2,1-6H3/t21-,22+,27-/m0/s1	UPHSEAQPRHOHRJ-XXAUWVGASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K45571747	BRD-K45571747-001-01-8	Broad Institute of MIT and Harvard	BRD-K45571747			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H42N4O4/c1-21-17-35(22(2)19-36)31(38)30-29(25-13-9-10-14-26(25)34(30)6)24-12-8-7-11-23(24)20-39-27(21)18-33(5)28(37)15-16-32(3)4/h7-14,21-22,27,36H,15-20H2,1-6H3/t21-,22+,27-/m0/s1	UPHSEAQPRHOHRJ-XXAUWVGASA-N	534.320605864							99831
BRD-K49877948	LSM-11457		56835461	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24+,30+/m1/s1	VTQGPDBOURHJNB-UCTCLUAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K49877948	BRD-K49877948-001-01-2	Broad Institute of MIT and Harvard	BRD-K49877948			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H38N2O4/c1-22-18-34(23(2)20-35)32(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-38-30(22)19-33(4)31(36)24(3)25-12-6-5-7-13-25/h5-17,22-24,30,35H,18-21H2,1-4H3/t22-,23-,24+,30+/m1/s1	VTQGPDBOURHJNB-UCTCLUAXSA-N	514.283157716							100078
BRD-K56757089	LSM-11859		54637860	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27-/m0/s1	VHVNEVJWYRMESY-ISCCLHIJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K56757089	BRD-K56757089-001-01-5	Broad Institute of MIT and Harvard	BRD-K56757089			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27-/m0/s1	VHVNEVJWYRMESY-ISCCLHIJSA-N	487.247106566							100485
BRD-K16399103	LSM-9418		54637910	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21-,26+/m0/s1	IEBNCDQMHLDDBS-ISJBWFOZSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K16399103	BRD-K16399103-001-01-7	Broad Institute of MIT and Harvard	BRD-K16399103			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCN(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H39N3O4/c1-20-16-31(21(2)18-32)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)19-35-26(20)17-30(5)27(33)14-15-29(3)4/h6-13,20-21,26,32H,14-19H2,1-5H3/t20-,21-,26+/m0/s1	IEBNCDQMHLDDBS-ISJBWFOZSA-N	481.294056758							98039
BRD-K65778880	LSM-12441		56835290	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27+/m1/s1	VHVNEVJWYRMESY-BUEREQSYSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K65778880	BRD-K65778880-001-01-1	Broad Institute of MIT and Harvard	BRD-K65778880			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccncc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H33N3O4/c1-20-16-32(21(2)18-33)29(35)26-11-7-6-10-25(26)24-9-5-4-8-23(24)19-36-27(20)17-31(3)28(34)22-12-14-30-15-13-22/h4-15,20-21,27,33H,16-19H2,1-3H3/t20-,21+,27+/m1/s1	VHVNEVJWYRMESY-BUEREQSYSA-N	487.247106566							101069
BRD-K19826330	LSM-9628		56835561	InChI=1S/C24H32N2O3/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-29-23(17)14-25(3)4/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	ICBPOKCISFMJKJ-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K19826330	BRD-K19826330-001-01-1	Broad Institute of MIT and Harvard	BRD-K19826330			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C24H32N2O3/c1-17-13-26(18(2)15-27)24(28)22-12-8-7-11-21(22)20-10-6-5-9-19(20)16-29-23(17)14-25(3)4/h5-12,17-18,23,27H,13-16H2,1-4H3/t17-,18-,23-/m0/s1	ICBPOKCISFMJKJ-BSRJHKFKSA-N	396.241292904							98249
BRD-K81608755	LSM-31517		54640664	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20+,21-/m1/s1	NLJLXKOEVYKMMF-HLAWJBBLSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2	BroadT	BRD-K81608755	BRD-K81608755-001-01-2	Broad Institute of MIT and Harvard	BRD-K81608755			Cc1ccc(cc1)S(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)c2cccc(F)c2)[C@@H](CO)O1	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20+,21-/m1/s1	NLJLXKOEVYKMMF-HLAWJBBLSA-N	450.162470874							120074
BRD-K88007585-001-01-6	LSM-31518	BRD-K88007585	54640586	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14-,16-/m1/s1	DHOFHCIZNIPSHR-IIAWOOMASA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)C3CCC3	BroadT	BRD-K88007585	BRD-K88007585-001-01-6	Broad Institute of MIT and Harvard	BRD-K88007585			OC[C@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)C1CCC1	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14-,16-/m1/s1	DHOFHCIZNIPSHR-IIAWOOMASA-N	362.195405352							120075
BRD-K30964193	LSM-31519		54640545	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18+,19+/m0/s1	PHXITHQOKRDDQC-WQANXHIZSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K30964193	BRD-K30964193-001-01-1	Broad Institute of MIT and Harvard	BRD-K30964193			C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18+,19+/m0/s1	PHXITHQOKRDDQC-WQANXHIZSA-N	374.22055746							120076
BRD-K90977883	LSM-31520		54640627	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12+,13+/m0/s1	BUQXSKBONOCLOA-YNEHKIRRSA-N	OC[C@H]1O[C@H](CC(=O)O)CC[C@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K90977883	BRD-K90977883-001-01-5	Broad Institute of MIT and Harvard	BRD-K90977883			OC[C@H]1O[C@@H](CC[C@H]1NC(=O)Nc1ccccc1)CC(O)=O	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12+,13+/m0/s1	BUQXSKBONOCLOA-YNEHKIRRSA-N	308.13722176							120077
BRD-K64804596	LSM-31521		54640712	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16-,18-/m1/s1	YRYFLIZLJGNRPZ-JFIYKMOQSA-N	CCCNC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)C3CCCC3)O[C@@H]1CO	BroadT	BRD-K64804596	BRD-K64804596-001-01-1	Broad Institute of MIT and Harvard	BRD-K64804596			CCCNC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)C2CCCC2)O[C@@H]1CO	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16-,18-/m1/s1	YRYFLIZLJGNRPZ-JFIYKMOQSA-N	379.258339966							120078
BRD-K50623282	LSM-31522		54640724	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16+,18-/m0/s1	NKWQDAXEZMPWOL-XCRHUMRWSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K50623282	BRD-K50623282-001-01-0	Broad Institute of MIT and Harvard	BRD-K50623282			OC[C@@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16+,18-/m0/s1	NKWQDAXEZMPWOL-XCRHUMRWSA-N	402.170333456							120079
BRD-K02630367	LSM-31523		54640541	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16+,17-/m0/s1	BVKYPNZNGBYIEE-BBWFWOEESA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K02630367	BRD-K02630367-001-01-2	Broad Institute of MIT and Harvard	BRD-K02630367			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16+,17-/m0/s1	BVKYPNZNGBYIEE-BBWFWOEESA-N	380.17475012							120080
BRD-K43435656	LSM-31524		54640525	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19-,20-/m0/s1	CUFNDCCMTGJSBI-VDGAXYAQSA-N	OC[C@@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)c3ccccc3F	BroadT	BRD-K43435656	BRD-K43435656-001-01-7	Broad Institute of MIT and Harvard	BRD-K43435656			OC[C@@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19-,20-/m0/s1	CUFNDCCMTGJSBI-VDGAXYAQSA-N	415.190734542							120081
BRD-K70154746	LSM-31525		54640657	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14-,15+/m1/s1	QXJDCVBLBQBSAR-YUELXQCFSA-N	COC(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	BroadT	BRD-K70154746	BRD-K70154746-001-01-2	Broad Institute of MIT and Harvard	BRD-K70154746			COC(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14-,15+/m1/s1	QXJDCVBLBQBSAR-YUELXQCFSA-N	371.103872712							120082
BRD-K43375231	LSM-31526		54640430	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17-,18-/m0/s1	CLBFLRMDTNZFIM-BZSNNMDCSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Cc3ccccc3	BroadT	BRD-K43375231	BRD-K43375231-001-01-9	Broad Institute of MIT and Harvard	BRD-K43375231			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Cc1ccccc1	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17-,18-/m0/s1	CLBFLRMDTNZFIM-BZSNNMDCSA-N	376.199822016							120083
BRD-K84939696	LSM-31527		54640683	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22+/m1/s1	BCMJULRZXHZHRC-NTPMHYTDSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CC(=O)N[C@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K84939696	BRD-K84939696-001-01-0	Broad Institute of MIT and Harvard	BRD-K84939696			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CC(=O)N[C@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22+/m1/s1	BCMJULRZXHZHRC-NTPMHYTDSA-N	441.226371122							120084
BRD-K16937802	LSM-31528		54640530	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20-,21-/m0/s1	DVYXTDYPIFUIBC-ACRUOGEOSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)cc1	BroadT	BRD-K16937802	BRD-K16937802-001-01-8	Broad Institute of MIT and Harvard	BRD-K16937802			COc1ccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)cc1	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20-,21-/m0/s1	DVYXTDYPIFUIBC-ACRUOGEOSA-N	430.190400184							120085
BRD-K42385001	LSM-31529		54640485	InChI=1S/C18H20FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-3,6-8,13-15,23H,4-5,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15-/m1/s1	UAJBNBJNFNTHPJ-RBSFLKMASA-N	OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K42385001	BRD-K42385001-001-01-7	Broad Institute of MIT and Harvard	BRD-K42385001			OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H20FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-3,6-8,13-15,23H,4-5,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15-/m1/s1	UAJBNBJNFNTHPJ-RBSFLKMASA-N	393.11585504							120086
BRD-K86638309	LSM-31530		54640633	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12+,13-/m1/s1	BUQXSKBONOCLOA-FRRDWIJNSA-N	OC[C@H]1O[C@@H](CC(=O)O)CC[C@@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K86638309	BRD-K86638309-001-01-5	Broad Institute of MIT and Harvard	BRD-K86638309			OC[C@H]1O[C@H](CC[C@@H]1NC(=O)Nc1ccccc1)CC(O)=O	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12+,13-/m1/s1	BUQXSKBONOCLOA-FRRDWIJNSA-N	308.13722176							120087
BRD-K93698227	LSM-31531		54640438	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23-,25+/m0/s1	VHAZZXZDVYBBQV-UMXIMWEHSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K93698227	BRD-K93698227-001-01-9	Broad Institute of MIT and Harvard	BRD-K93698227			OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23-,25+/m0/s1	VHAZZXZDVYBBQV-UMXIMWEHSA-N	495.196962774							120088
BRD-K31908823	LSM-31532		54640666	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20-,21+/m0/s1	NLJLXKOEVYKMMF-SESVDKBCSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2	BroadT	BRD-K31908823	BRD-K31908823-001-01-5	Broad Institute of MIT and Harvard	BRD-K31908823			Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]1CC[C@H](NC(=O)c2cccc(F)c2)[C@@H](CO)O1	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20-,21+/m0/s1	NLJLXKOEVYKMMF-SESVDKBCSA-N	450.162470874							120089
BRD-K95983807	LSM-31533		54640572	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14-,15-/m1/s1	PJOLWCYMJOXMFX-BPLDGKMQSA-N	COC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(OC)cc2)[C@@H](CO)O1	BroadT	BRD-K95983807	BRD-K95983807-001-01-1	Broad Institute of MIT and Harvard	BRD-K95983807			COC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(OC)cc2)[C@@H](CO)O1	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14-,15-/m1/s1	PJOLWCYMJOXMFX-BPLDGKMQSA-N	373.119522776							120090
BRD-K45677596	LSM-31534		54640635	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14+,15+/m0/s1	PYHXZAPBOUOXMO-RRFJBIMHSA-N	COCCNC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)NC2CCCC2)C=C1	BroadT	BRD-K45677596	BRD-K45677596-001-01-5	Broad Institute of MIT and Harvard	BRD-K45677596			COCCNC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)NC2CCCC2)C=C1	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14+,15+/m0/s1	PYHXZAPBOUOXMO-RRFJBIMHSA-N	355.210721058							120091
BRD-K43872193	LSM-31535		54640552	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19+/m1/s1	PHXITHQOKRDDQC-AXUOBQJMSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)C2CCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K43872193	BRD-K43872193-001-01-1	Broad Institute of MIT and Harvard	BRD-K43872193			C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)C2CCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19+/m1/s1	PHXITHQOKRDDQC-AXUOBQJMSA-N	374.22055746							120092
BRD-K39499927	LSM-31536		54640727	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20-,21+/m1/s1	QXXUXEAVRGHKMM-NJYVYQBISA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K39499927	BRD-K39499927-001-01-2	Broad Institute of MIT and Harvard	BRD-K39499927			OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20-,21+/m1/s1	QXXUXEAVRGHKMM-NJYVYQBISA-N	485.184811986							120093
MLS003650103	LSM-31537	BRD-K85275903, SID125305397	53382753	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19+,20+/m0/s1	JUMQDWHPHZAWJD-PWIZWCRZSA-N	Cc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CCNS(=O)(=O)c3ccccc3F)O[C@@H]2CO	BroadT	BRD-K85275903	BRD-K85275903-001-01-7	Broad Institute of MIT and Harvard	BRD-K85275903			Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNS(=O)(=O)c2ccccc2F)O[C@@H]1CO	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19+,20+/m0/s1	JUMQDWHPHZAWJD-PWIZWCRZSA-N	486.129456184							120094
BRD-K43700313	LSM-31538		54640734	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15+,16+/m1/s1	KYVBJMXDLCPPRO-PMPSAXMXSA-N	CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@H]1CO	BroadT	BRD-K43700313	BRD-K43700313-001-01-9	Broad Institute of MIT and Harvard	BRD-K43700313			CCC(=O)N[C@H]1C=C[C@@H](O[C@H]1CO)CC(=O)NCc1cc(F)cc(F)c1	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15+,16+/m1/s1	KYVBJMXDLCPPRO-PMPSAXMXSA-N	368.154763604							120095
BRD-K29806938	LSM-31539		54640667	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20+,21-/m0/s1	NLJLXKOEVYKMMF-TYPHKJRUSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2	BroadT	BRD-K29806938	BRD-K29806938-001-01-7	Broad Institute of MIT and Harvard	BRD-K29806938			Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)c2cccc(F)c2)[C@H](CO)O1	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20+,21-/m0/s1	NLJLXKOEVYKMMF-TYPHKJRUSA-N	450.162470874							120096
BRD-K92700781	LSM-31540		54640460	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18+,19+/m0/s1	MSXVOGFBDSGFQQ-KFKAGJAMSA-N	OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c3ccccc3F	BroadT	BRD-K92700781	BRD-K92700781-001-01-2	Broad Institute of MIT and Harvard	BRD-K92700781			OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18+,19+/m0/s1	MSXVOGFBDSGFQQ-KFKAGJAMSA-N	423.21694929							120097
BRD-K68618894	LSM-31541		54640462	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18-,19+/m0/s1	MSXVOGFBDSGFQQ-ZYSHUDEJSA-N	OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c3ccccc3F	BroadT	BRD-K68618894	BRD-K68618894-001-01-0	Broad Institute of MIT and Harvard	BRD-K68618894			OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18-,19+/m0/s1	MSXVOGFBDSGFQQ-ZYSHUDEJSA-N	423.21694929							120098
BRD-K86935536	LSM-31542		54640491	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17-,18-/m1/s1	XEUNAZXFOLKMJY-ZTFGCOKTSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)c2ccccc2F)C=C1	BroadT	BRD-K86935536	BRD-K86935536-001-01-0	Broad Institute of MIT and Harvard	BRD-K86935536			CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)c2ccccc2F)C=C1	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17-,18-/m1/s1	XEUNAZXFOLKMJY-ZTFGCOKTSA-N	393.206384606							120099
BRD-K71491645	LSM-31543		54640426	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17+,19-/m0/s1	IVGXTVZUVQFGHY-SCTDSRPQSA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)c3ccc(F)cc3)O[C@H]1CO	BroadT	BRD-K71491645	BRD-K71491645-001-01-9	Broad Institute of MIT and Harvard	BRD-K71491645			CC(C)NC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@H]1CO	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17+,19-/m0/s1	IVGXTVZUVQFGHY-SCTDSRPQSA-N	405.217618006							120100
BRD-K68667113	LSM-31544		54640722	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16-,18-/m0/s1	NKWQDAXEZMPWOL-OWQGQXMQSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K68667113	BRD-K68667113-001-01-2	Broad Institute of MIT and Harvard	BRD-K68667113			OC[C@@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16-,18-/m0/s1	NKWQDAXEZMPWOL-OWQGQXMQSA-N	402.170333456							120101
BRD-K83341545	LSM-31545		54640684	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22-/m0/s1	BCMJULRZXHZHRC-UPSSIMKTSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K83341545	BRD-K83341545-001-01-3	Broad Institute of MIT and Harvard	BRD-K83341545			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22-/m0/s1	BCMJULRZXHZHRC-UPSSIMKTSA-N	441.226371122							120102
BRD-K53088255	LSM-31546		54640716	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16+,18-/m0/s1	YRYFLIZLJGNRPZ-JZXOWHBKSA-N	CCCNC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)C3CCCC3)O[C@H]1CO	BroadT	BRD-K53088255	BRD-K53088255-001-01-6	Broad Institute of MIT and Harvard	BRD-K53088255			CCCNC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)C2CCCC2)O[C@H]1CO	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16+,18-/m0/s1	YRYFLIZLJGNRPZ-JZXOWHBKSA-N	379.258339966							120103
BRD-K54100199	LSM-31547		54640519	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19+,20+/m0/s1	CUFNDCCMTGJSBI-PWIZWCRZSA-N	OC[C@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)c3ccccc3F	BroadT	BRD-K54100199	BRD-K54100199-001-01-7	Broad Institute of MIT and Harvard	BRD-K54100199			OC[C@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19+,20+/m0/s1	CUFNDCCMTGJSBI-PWIZWCRZSA-N	415.190734542							120104
BRD-K89116076	LSM-31548		54640563	InChI=1S/C20H24Cl2N2O6S2/c21-14-5-8-16(9-6-14)31(26,27)23-12-11-15-7-10-18(19(13-25)30-15)24-32(28,29)20-4-2-1-3-17(20)22/h1-6,8-9,15,18-19,23-25H,7,10-13H2/t15-,18+,19-/m0/s1	QAKAPBFRRSNHFG-IPELMVKDSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K89116076	BRD-K89116076-001-01-0	Broad Institute of MIT and Harvard	BRD-K89116076			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C20H24Cl2N2O6S2/c21-14-5-8-16(9-6-14)31(26,27)23-12-11-15-7-10-18(19(13-25)30-15)24-32(28,29)20-4-2-1-3-17(20)22/h1-6,8-9,15,18-19,23-25H,7,10-13H2/t15-,18+,19-/m0/s1	QAKAPBFRRSNHFG-IPELMVKDSA-N	522.045283308							120105
BRD-K23197669	LSM-31549		54640696	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20-,21-/m1/s1	YKQIDJUJSSSEIT-NJDAHSKKSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@@H]2CO)cc1	BroadT	BRD-K23197669	BRD-K23197669-001-01-2	Broad Institute of MIT and Harvard	BRD-K23197669			COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@@H]2CO)cc1	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20-,21-/m1/s1	YKQIDJUJSSSEIT-NJDAHSKKSA-N	495.132776414							120106
BRD-K76521932	LSM-31550		54640665	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20-,21-/m0/s1	NLJLXKOEVYKMMF-JBACZVJFSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2	BroadT	BRD-K76521932	BRD-K76521932-001-01-0	Broad Institute of MIT and Harvard	BRD-K76521932			Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]1CC[C@H](NC(=O)c2cccc(F)c2)[C@H](CO)O1	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20-,21-/m0/s1	NLJLXKOEVYKMMF-JBACZVJFSA-N	450.162470874							120107
BRD-K28926538	LSM-31551		54640581	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17-,19+/m0/s1	IVGXTVZUVQFGHY-JENIJYKNSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)c3ccc(F)cc3)O[C@@H]1CO	BroadT	BRD-K28926538	BRD-K28926538-001-01-8	Broad Institute of MIT and Harvard	BRD-K28926538			CC(C)NC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17-,19+/m0/s1	IVGXTVZUVQFGHY-JENIJYKNSA-N	405.217618006							120108
BRD-K84990603	LSM-31552		54640565	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22+,23+/m1/s1	MGIGDAYWWJNGIV-VJBWXMMDSA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@H]1CO	BroadT	BRD-K84990603	BRD-K84990603-001-01-5	Broad Institute of MIT and Harvard	BRD-K84990603			CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@H]1CO	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22+,23+/m1/s1	MGIGDAYWWJNGIV-VJBWXMMDSA-N	455.242021186							120109
BRD-K52339742	LSM-31553		54640444	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21+/m1/s1	KEJHSICNFQEVJK-NXXWWENFSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K52339742	BRD-K52339742-001-01-5	Broad Institute of MIT and Harvard	BRD-K52339742			C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21+/m1/s1	KEJHSICNFQEVJK-NXXWWENFSA-N	448.14682081							120110
BRD-K01162126	LSM-31554		54640653	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14+,15+/m1/s1	QXJDCVBLBQBSAR-SNPRPXQTSA-N	COC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	BroadT	BRD-K01162126	BRD-K01162126-001-01-9	Broad Institute of MIT and Harvard	BRD-K01162126			COC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14+,15+/m1/s1	QXJDCVBLBQBSAR-SNPRPXQTSA-N	371.103872712							120111
BRD-K28059618	LSM-31555		54640592	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17-,18+/m1/s1	LEANCKNBHBEQEG-KURKYZTESA-N	Cc1onc(C)c1NC(=O)NCC[C@H]2CC[C@@H](NC(=O)Nc3cccc(Cl)c3)[C@H](CO)O2	BroadT	BRD-K28059618	BRD-K28059618-001-01-1	Broad Institute of MIT and Harvard	BRD-K28059618			Cc1noc(C)c1NC(=O)NCC[C@H]1CC[C@@H](NC(=O)Nc2cccc(Cl)c2)[C@H](CO)O1	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17-,18+/m1/s1	LEANCKNBHBEQEG-KURKYZTESA-N	465.177896756							120112
BRD-K79048835	LSM-31556		54640451	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15+,16-/m0/s1	KYVBJMXDLCPPRO-XHSDSOJGSA-N	CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@H]1CO	BroadT	BRD-K79048835	BRD-K79048835-001-01-9	Broad Institute of MIT and Harvard	BRD-K79048835			CCC(=O)N[C@@H]1C=C[C@H](O[C@H]1CO)CC(=O)NCc1cc(F)cc(F)c1	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15+,16-/m0/s1	KYVBJMXDLCPPRO-XHSDSOJGSA-N	368.154763604							120113
CHEMBL2144601	LSM-31557	BRD-K32943037, SID131436919	54640610	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19+,21-/m1/s1	JEWVOUSHTDFCPR-SLYNCCJLSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3ccccn3)CC[C@@H]1NC(=O)c4ccc(F)cc4	BroadT	BRD-K32943037	BRD-K32943037-001-01-3	Broad Institute of MIT and Harvard	BRD-K32943037			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2ccccn2)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19+,21-/m1/s1	JEWVOUSHTDFCPR-SLYNCCJLSA-N	425.186317878							120114
BRD-K37931645	LSM-31558		54640643	InChI=1S/C16H21FN4O2/c17-12-3-1-2-11(8-12)15-9-21(20-19-15)7-6-13-4-5-14(18)16(10-22)23-13/h1-3,8-9,13-14,16,22H,4-7,10,18H2/t13-,14+,16-/m0/s1	BTTZOQWZJWSOIH-LZWOXQAQSA-N	N[C@@H]1CC[C@@H](CCn2cc(nn2)c3cccc(F)c3)O[C@H]1CO	BroadT	BRD-K37931645	BRD-K37931645-001-01-7	Broad Institute of MIT and Harvard	BRD-K37931645			N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2cccc(F)c2)O[C@H]1CO	InChI=1S/C16H21FN4O2/c17-12-3-1-2-11(8-12)15-9-21(20-19-15)7-6-13-4-5-14(18)16(10-22)23-13/h1-3,8-9,13-14,16,22H,4-7,10,18H2/t13-,14+,16-/m0/s1	BTTZOQWZJWSOIH-LZWOXQAQSA-N	320.164854152							120115
BRD-K82805160	LSM-31559		54640707	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20+,21-/m1/s1	RCCDRCNDPSXTFI-HLAWJBBLSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NCc3ccc(F)cc3)O[C@@H]2CO	BroadT	BRD-K82805160	BRD-K82805160-001-01-2	Broad Institute of MIT and Harvard	BRD-K82805160			COc1cccc(c1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20+,21-/m1/s1	RCCDRCNDPSXTFI-HLAWJBBLSA-N	464.14173543							120116
BRD-K95359959	LSM-31560		54640509	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20+/m1/s1	NQVHKOMHSOOYQX-GTAWCEEGSA-N	C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K95359959	BRD-K95359959-001-01-0	Broad Institute of MIT and Harvard	BRD-K95359959			C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20+/m1/s1	NQVHKOMHSOOYQX-GTAWCEEGSA-N	417.226371122							120117
BRD-K21119095	LSM-31561		54640590	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17+,18+/m0/s1	LEANCKNBHBEQEG-RCCFBDPRSA-N	Cc1onc(C)c1NC(=O)NCC[C@@H]2CC[C@@H](NC(=O)Nc3cccc(Cl)c3)[C@@H](CO)O2	BroadT	BRD-K21119095	BRD-K21119095-001-01-2	Broad Institute of MIT and Harvard	BRD-K21119095			Cc1noc(C)c1NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)Nc2cccc(Cl)c2)[C@@H](CO)O1	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17+,18+/m0/s1	LEANCKNBHBEQEG-RCCFBDPRSA-N	465.177896756							120118
BRD-K56120807	LSM-31562		54640680	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22+/m0/s1	BCMJULRZXHZHRC-HKBKIPCKSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K56120807	BRD-K56120807-001-01-7	Broad Institute of MIT and Harvard	BRD-K56120807			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22+/m0/s1	BCMJULRZXHZHRC-HKBKIPCKSA-N	441.226371122							120119
BRD-K81314458	LSM-31563		54640513	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20+/m1/s1	NQVHKOMHSOOYQX-AFYVEPGGSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K81314458	BRD-K81314458-001-01-7	Broad Institute of MIT and Harvard	BRD-K81314458			C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20+/m1/s1	NQVHKOMHSOOYQX-AFYVEPGGSA-N	417.226371122							120120
MLS003649882	LSM-31564	BRD-K00551139, SID125305194	53382550	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13-,14+/m0/s1	GVTOYTHYWUUIIC-MELADBBJSA-N	COC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)c2ccccc2)C=C1	BroadT	BRD-K00551139	BRD-K00551139-001-01-9	Broad Institute of MIT and Harvard	BRD-K00551139			COC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)c2ccccc2)C=C1	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13-,14+/m0/s1	GVTOYTHYWUUIIC-MELADBBJSA-N	305.126322718							120121
BRD-K64349988	LSM-31565		54640470	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19-,20-/m1/s1	JUMQDWHPHZAWJD-NSISKUIASA-N	Cc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CCNS(=O)(=O)c3ccccc3F)O[C@@H]2CO	BroadT	BRD-K64349988	BRD-K64349988-001-01-3	Broad Institute of MIT and Harvard	BRD-K64349988			Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CCNS(=O)(=O)c2ccccc2F)O[C@@H]1CO	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19-,20-/m1/s1	JUMQDWHPHZAWJD-NSISKUIASA-N	486.129456184							120122
BRD-K54132860	LSM-31566		54640631	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13+/m0/s1	BUQXSKBONOCLOA-RWMBFGLXSA-N	OC[C@H]1O[C@H](CC(=O)O)CC[C@@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K54132860	BRD-K54132860-001-01-8	Broad Institute of MIT and Harvard	BRD-K54132860			OC[C@H]1O[C@@H](CC[C@@H]1NC(=O)Nc1ccccc1)CC(O)=O	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13+/m0/s1	BUQXSKBONOCLOA-RWMBFGLXSA-N	308.13722176							120123
BRD-K93624320	LSM-31567		54640576	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14+,15-/m1/s1	PJOLWCYMJOXMFX-VHDGCEQUSA-N	COC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccc(OC)cc2)[C@@H](CO)O1	BroadT	BRD-K93624320	BRD-K93624320-001-01-1	Broad Institute of MIT and Harvard	BRD-K93624320			COC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccc(OC)cc2)[C@@H](CO)O1	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14+,15-/m1/s1	PJOLWCYMJOXMFX-VHDGCEQUSA-N	373.119522776							120124
BRD-K49507197	LSM-31568		54640726	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20+,21+/m1/s1	QXXUXEAVRGHKMM-HKBOAZHASA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K49507197	BRD-K49507197-001-01-3	Broad Institute of MIT and Harvard	BRD-K49507197			OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20+,21+/m1/s1	QXXUXEAVRGHKMM-HKBOAZHASA-N	485.184811986							120125
BRD-K09693670	LSM-31569		54640597	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16+,17+/m0/s1	FBXATGIHHFZDOF-GVDBMIGSSA-N	COCc1cn(CC[C@@H]2CC[C@@H](NC(=O)c3ccncc3)[C@@H](CO)O2)nn1	BroadT	BRD-K09693670	BRD-K09693670-001-01-5	Broad Institute of MIT and Harvard	BRD-K09693670			COCc1cn(CC[C@@H]2CC[C@@H](NC(=O)c3ccncc3)[C@@H](CO)O2)nn1	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16+,17+/m0/s1	FBXATGIHHFZDOF-GVDBMIGSSA-N	375.19065433							120126
BRD-K82324807	LSM-31570		54640540	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16+,17-/m1/s1	BVKYPNZNGBYIEE-IXDOHACOSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K82324807	BRD-K82324807-001-01-3	Broad Institute of MIT and Harvard	BRD-K82324807			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16+,17-/m1/s1	BVKYPNZNGBYIEE-IXDOHACOSA-N	380.17475012							120127
BRD-K44126416	LSM-31571		54640708	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20+,21-/m0/s1	RCCDRCNDPSXTFI-TYPHKJRUSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCc3ccc(F)cc3)O[C@H]2CO	BroadT	BRD-K44126416	BRD-K44126416-001-01-2	Broad Institute of MIT and Harvard	BRD-K44126416			COc1cccc(c1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccc(F)cc2)O[C@H]1CO	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20+,21-/m0/s1	RCCDRCNDPSXTFI-TYPHKJRUSA-N	464.14173543							120128
BRD-K18645499	LSM-31572		54640501	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18-,21+/m1/s1	BPRQWUDNJJKTKY-OPYAIIAOSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K18645499	BRD-K18645499-001-01-3	Broad Institute of MIT and Harvard	BRD-K18645499			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18-,21+/m1/s1	BPRQWUDNJJKTKY-OPYAIIAOSA-N	473.135363228							120129
BRD-K21864149	LSM-31573		54640518	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20+/m1/s1	NQVHKOMHSOOYQX-MDNKFWRPSA-N	C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K21864149	BRD-K21864149-001-01-9	Broad Institute of MIT and Harvard	BRD-K21864149			C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20+/m1/s1	NQVHKOMHSOOYQX-MDNKFWRPSA-N	417.226371122							120130
BRD-K06519744	LSM-31574		54640685	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22+/m0/s1	BCMJULRZXHZHRC-JXYHXMIBSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K06519744	BRD-K06519744-001-01-7	Broad Institute of MIT and Harvard	BRD-K06519744			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22+/m0/s1	BCMJULRZXHZHRC-JXYHXMIBSA-N	441.226371122							120131
BRD-K95927760	LSM-31575		54640546	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19+/m0/s1	PHXITHQOKRDDQC-JEDBISTDSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K95927760	BRD-K95927760-001-01-3	Broad Institute of MIT and Harvard	BRD-K95927760			C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19+/m0/s1	PHXITHQOKRDDQC-JEDBISTDSA-N	374.22055746							120132
BRD-K37253987	LSM-31576		54640489	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18+/m0/s1	XEUNAZXFOLKMJY-BMGDILEWSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)c2ccccc2F)C=C1	BroadT	BRD-K37253987	BRD-K37253987-001-01-2	Broad Institute of MIT and Harvard	BRD-K37253987			CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)c2ccccc2F)C=C1	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18+/m0/s1	XEUNAZXFOLKMJY-BMGDILEWSA-N	393.206384606							120133
BRD-K84362145	LSM-31577		54640689	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22-/m1/s1	BCMJULRZXHZHRC-UYKQMDHISA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CC(=O)N[C@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K84362145	BRD-K84362145-001-01-2	Broad Institute of MIT and Harvard	BRD-K84362145			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CC(=O)N[C@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22-/m1/s1	BCMJULRZXHZHRC-UYKQMDHISA-N	441.226371122							120134
BRD-K79494396	LSM-31578		54640679	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22+/m0/s1	BCMJULRZXHZHRC-FDGCKHTNSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K79494396	BRD-K79494396-001-01-6	Broad Institute of MIT and Harvard	BRD-K79494396			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22+/m0/s1	BCMJULRZXHZHRC-FDGCKHTNSA-N	441.226371122							120135
BRD-K24565713	LSM-31579		54640446	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21+/m0/s1	KEJHSICNFQEVJK-FCXXMXSZSA-N	C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K24565713	BRD-K24565713-001-01-5	Broad Institute of MIT and Harvard	BRD-K24565713			C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21+/m0/s1	KEJHSICNFQEVJK-FCXXMXSZSA-N	448.14682081							120136
BRD-K96322674	LSM-31580		54640440	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23+,25-/m1/s1	VHAZZXZDVYBBQV-NMVJMZGASA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K96322674	BRD-K96322674-001-01-1	Broad Institute of MIT and Harvard	BRD-K96322674			OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23+,25-/m1/s1	VHAZZXZDVYBBQV-NMVJMZGASA-N	495.196962774							120137
MLS003649976	LSM-31581	BRD-K82968130, SID125305283	53382639	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22+,23-/m1/s1	MGIGDAYWWJNGIV-XPWALMASSA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@@H]1CO	BroadT	BRD-K82968130	BRD-K82968130-001-01-5	Broad Institute of MIT and Harvard	BRD-K82968130			CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@@H]1CO	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22+,23-/m1/s1	MGIGDAYWWJNGIV-XPWALMASSA-N	455.242021186							120138
BRD-K99455613	LSM-31582		54640452	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20+/m0/s1	OPJMBNVAUHUOES-XUVXKRRUSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K99455613	BRD-K99455613-001-01-0	Broad Institute of MIT and Harvard	BRD-K99455613			OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20+/m0/s1	OPJMBNVAUHUOES-XUVXKRRUSA-N	410.195405352							120139
BRD-K43966357	LSM-31583		54640548	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19+/m1/s1	PHXITHQOKRDDQC-FCLVOEFKSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)C2CCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K43966357	BRD-K43966357-001-01-3	Broad Institute of MIT and Harvard	BRD-K43966357			C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)C2CCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19+/m1/s1	PHXITHQOKRDDQC-FCLVOEFKSA-N	374.22055746							120140
BRD-K73792260	LSM-31584		54640464	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18+,19-/m1/s1	MSXVOGFBDSGFQQ-AYOQOUSVSA-N	OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c3ccccc3F	BroadT	BRD-K73792260	BRD-K73792260-001-01-2	Broad Institute of MIT and Harvard	BRD-K73792260			OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18+,19-/m1/s1	MSXVOGFBDSGFQQ-AYOQOUSVSA-N	423.21694929							120141
BRD-K39547688	LSM-31585		54640662	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20-,21-/m1/s1	NLJLXKOEVYKMMF-HMXCVIKNSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2	BroadT	BRD-K39547688	BRD-K39547688-001-01-7	Broad Institute of MIT and Harvard	BRD-K39547688			Cc1ccc(cc1)S(=O)(=O)NCC[C@H]1CC[C@@H](NC(=O)c2cccc(F)c2)[C@@H](CO)O1	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20-,21-/m1/s1	NLJLXKOEVYKMMF-HMXCVIKNSA-N	450.162470874							120142
BRD-K94657740	LSM-31586		54640582	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17-,19+/m1/s1	IVGXTVZUVQFGHY-LMMKCTJWSA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)c3ccc(F)cc3)O[C@H]1CO	BroadT	BRD-K94657740	BRD-K94657740-001-01-2	Broad Institute of MIT and Harvard	BRD-K94657740			CC(C)NC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@H]1CO	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17-,19+/m1/s1	IVGXTVZUVQFGHY-LMMKCTJWSA-N	405.217618006							120143
BRD-K40485332	LSM-31587		54640605	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19+,21+/m0/s1	JEWVOUSHTDFCPR-FBBABVLZSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3ccccn3)CC[C@H]1NC(=O)c4ccc(F)cc4	BroadT	BRD-K40485332	BRD-K40485332-001-01-7	Broad Institute of MIT and Harvard	BRD-K40485332			OC[C@H]1O[C@H](CCn2cc(nn2)-c2ccccn2)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19+,21+/m0/s1	JEWVOUSHTDFCPR-FBBABVLZSA-N	425.186317878							120144
BRD-K01774461	LSM-31588		54640599	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16-,17+/m1/s1	FBXATGIHHFZDOF-ZACQAIPSSA-N	COCc1cn(CC[C@H]2CC[C@@H](NC(=O)c3ccncc3)[C@H](CO)O2)nn1	BroadT	BRD-K01774461	BRD-K01774461-001-01-4	Broad Institute of MIT and Harvard	BRD-K01774461			COCc1cn(CC[C@H]2CC[C@@H](NC(=O)c3ccncc3)[C@H](CO)O2)nn1	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16-,17+/m1/s1	FBXATGIHHFZDOF-ZACQAIPSSA-N	375.19065433							120145
BRD-K30053194	LSM-31589		54640455	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20-/m0/s1	OPJMBNVAUHUOES-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K30053194	BRD-K30053194-001-01-2	Broad Institute of MIT and Harvard	BRD-K30053194			OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20-/m0/s1	OPJMBNVAUHUOES-UFYCRDLUSA-N	410.195405352							120146
BRD-K19009595	LSM-31590		54640588	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14-,16+/m0/s1	DHOFHCIZNIPSHR-OFQRWUPVSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K19009595	BRD-K19009595-001-01-4	Broad Institute of MIT and Harvard	BRD-K19009595			OC[C@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)C1CCC1	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14-,16+/m0/s1	DHOFHCIZNIPSHR-OFQRWUPVSA-N	362.195405352							120147
BRD-K91654198	LSM-31591		54640717	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16+,18+/m0/s1	NKWQDAXEZMPWOL-FDQGKXFDSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K91654198	BRD-K91654198-001-01-9	Broad Institute of MIT and Harvard	BRD-K91654198			OC[C@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16+,18+/m0/s1	NKWQDAXEZMPWOL-FDQGKXFDSA-N	402.170333456							120148
BRD-K33689641	LSM-31592		54640567	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22-,23-/m0/s1	MGIGDAYWWJNGIV-VABKMULXSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@H]1CO	BroadT	BRD-K33689641	BRD-K33689641-001-01-9	Broad Institute of MIT and Harvard	BRD-K33689641			CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@H]1CO	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22-,23-/m0/s1	MGIGDAYWWJNGIV-VABKMULXSA-N	455.242021186							120149
BRD-K29246335	LSM-31593		54640479	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18-,20-/m1/s1	KWVYROQUXUCXNL-YVWKXTFCSA-N	COc1cccc(c1)c2cn(CC[C@H]3CC[C@@H](NC(=O)CN(C)C)[C@@H](CO)O3)nn2	BroadT	BRD-K29246335	BRD-K29246335-001-01-5	Broad Institute of MIT and Harvard	BRD-K29246335			COc1cccc(c1)-c1cn(CC[C@H]2CC[C@@H](NC(=O)CN(C)C)[C@@H](CO)O2)nn1	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18-,20-/m1/s1	KWVYROQUXUCXNL-YVWKXTFCSA-N	417.237604522							120150
BRD-K21416096	LSM-31594		54640584	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17-,19-/m0/s1	IVGXTVZUVQFGHY-LNLFQRSKSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)c3ccc(F)cc3)O[C@H]1CO	BroadT	BRD-K21416096	BRD-K21416096-001-01-1	Broad Institute of MIT and Harvard	BRD-K21416096			CC(C)NC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@H]1CO	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17-,19-/m0/s1	IVGXTVZUVQFGHY-LNLFQRSKSA-N	405.217618006							120151
BRD-K14732209	LSM-31595		54640650	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17-,18+/m1/s1	QWOFJLPZBFRYTI-OLMNPRSZSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K14732209	BRD-K14732209-001-01-4	Broad Institute of MIT and Harvard	BRD-K14732209			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17-,18+/m1/s1	QWOFJLPZBFRYTI-OLMNPRSZSA-N	393.206384606							120152
BRD-K17753780	LSM-31596		54640647	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17-,18-/m1/s1	QWOFJLPZBFRYTI-ZTFGCOKTSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K17753780	BRD-K17753780-001-01-4	Broad Institute of MIT and Harvard	BRD-K17753780			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17-,18-/m1/s1	QWOFJLPZBFRYTI-ZTFGCOKTSA-N	393.206384606							120153
BRD-K51342021	LSM-31597		54640515	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20+/m0/s1	NQVHKOMHSOOYQX-OJAHFUOMSA-N	C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K51342021	BRD-K51342021-001-01-2	Broad Institute of MIT and Harvard	BRD-K51342021			C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20+/m0/s1	NQVHKOMHSOOYQX-OJAHFUOMSA-N	417.226371122							120154
BRD-K89108431	LSM-31598		54640486	InChI=1S/C18H20FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-3,6-8,13-15,23H,4-5,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15-/m0/s1	UAJBNBJNFNTHPJ-KKUMJFAQSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K89108431	BRD-K89108431-001-01-7	Broad Institute of MIT and Harvard	BRD-K89108431			OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H20FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-3,6-8,13-15,23H,4-5,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15-/m0/s1	UAJBNBJNFNTHPJ-KKUMJFAQSA-N	393.11585504							120155
BRD-K88988134	LSM-31599		54640472	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19-,20+/m0/s1	JUMQDWHPHZAWJD-FFZOFVMBSA-N	Cc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CCNS(=O)(=O)c3ccccc3F)O[C@@H]2CO	BroadT	BRD-K88988134	BRD-K88988134-001-01-3	Broad Institute of MIT and Harvard	BRD-K88988134			Cc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CCNS(=O)(=O)c2ccccc2F)O[C@@H]1CO	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19-,20+/m0/s1	JUMQDWHPHZAWJD-FFZOFVMBSA-N	486.129456184							120156
BRD-K46742113	LSM-31600		54640674	InChI=1S/C19H31N3O5S/c1-14(2)21-19(24)22-17-9-8-16(27-18(17)12-23)10-11-20-28(25,26)13-15-6-4-3-5-7-15/h3-7,14,16-18,20,23H,8-13H2,1-2H3,(H2,21,22,24)/t16-,17-,18+/m0/s1	WDDVSYGCEMHEAU-OKZBNKHCSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CCNS(=O)(=O)Cc2ccccc2)O[C@@H]1CO	BroadT	BRD-K46742113	BRD-K46742113-001-01-0	Broad Institute of MIT and Harvard	BRD-K46742113			CC(C)NC(=O)N[C@H]1CC[C@@H](CCNS(=O)(=O)Cc2ccccc2)O[C@@H]1CO	InChI=1S/C19H31N3O5S/c1-14(2)21-19(24)22-17-9-8-16(27-18(17)12-23)10-11-20-28(25,26)13-15-6-4-3-5-7-15/h3-7,14,16-18,20,23H,8-13H2,1-2H3,(H2,21,22,24)/t16-,17-,18+/m0/s1	WDDVSYGCEMHEAU-OKZBNKHCSA-N	413.198441812							120157
BRD-K70468140	LSM-31601		54640580	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17-,19-/m1/s1	IVGXTVZUVQFGHY-ZHALLVOQSA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)c3ccc(F)cc3)O[C@@H]1CO	BroadT	BRD-K70468140	BRD-K70468140-001-01-8	Broad Institute of MIT and Harvard	BRD-K70468140			CC(C)NC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17-,19-/m1/s1	IVGXTVZUVQFGHY-ZHALLVOQSA-N	405.217618006							120158
BRD-K15607890	LSM-31602		54640431	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17-,18+/m0/s1	CLBFLRMDTNZFIM-OKZBNKHCSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Cc3ccccc3	BroadT	BRD-K15607890	BRD-K15607890-001-01-1	Broad Institute of MIT and Harvard	BRD-K15607890			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Cc1ccccc1	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17-,18+/m0/s1	CLBFLRMDTNZFIM-OKZBNKHCSA-N	376.199822016							120159
BRD-K08659289	LSM-31603		54640595	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17+,18-/m1/s1	LEANCKNBHBEQEG-FGTMMUONSA-N	Cc1onc(C)c1NC(=O)NCC[C@H]2CC[C@H](NC(=O)Nc3cccc(Cl)c3)[C@@H](CO)O2	BroadT	BRD-K08659289	BRD-K08659289-001-01-0	Broad Institute of MIT and Harvard	BRD-K08659289			Cc1noc(C)c1NC(=O)NCC[C@H]1CC[C@H](NC(=O)Nc2cccc(Cl)c2)[C@@H](CO)O1	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17+,18-/m1/s1	LEANCKNBHBEQEG-FGTMMUONSA-N	465.177896756							120160
BRD-K81288338	LSM-31604		54640499	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18-,21-/m0/s1	BPRQWUDNJJKTKY-WFXMLNOXSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K81288338	BRD-K81288338-001-01-9	Broad Institute of MIT and Harvard	BRD-K81288338			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18-,21-/m0/s1	BPRQWUDNJJKTKY-WFXMLNOXSA-N	473.135363228							120161
BRD-K29784863	LSM-31605		54640661	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20+,21+/m1/s1	NLJLXKOEVYKMMF-GIVPXCGWSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2	BroadT	BRD-K29784863	BRD-K29784863-001-01-5	Broad Institute of MIT and Harvard	BRD-K29784863			Cc1ccc(cc1)S(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)c2cccc(F)c2)[C@H](CO)O1	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20+,21+/m1/s1	NLJLXKOEVYKMMF-GIVPXCGWSA-N	450.162470874							120162
BRD-K69751974	LSM-31606		54640443	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21-/m1/s1	KEJHSICNFQEVJK-NSGGIEJNSA-N	C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K69751974	BRD-K69751974-001-01-1	Broad Institute of MIT and Harvard	BRD-K69751974			C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21-/m1/s1	KEJHSICNFQEVJK-NSGGIEJNSA-N	448.14682081							120163
BRD-K18822985	LSM-31607		54640534	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20+,21-/m0/s1	DVYXTDYPIFUIBC-HBMCJLEFSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)cc1	BroadT	BRD-K18822985	BRD-K18822985-001-01-9	Broad Institute of MIT and Harvard	BRD-K18822985			COc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)cc1	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20+,21-/m0/s1	DVYXTDYPIFUIBC-HBMCJLEFSA-N	430.190400184							120164
BRD-K83752863	LSM-31608		54640709	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16+,18+/m0/s1	YRYFLIZLJGNRPZ-LZLYRXPVSA-N	CCCNC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)C3CCCC3)O[C@@H]1CO	BroadT	BRD-K83752863	BRD-K83752863-001-01-5	Broad Institute of MIT and Harvard	BRD-K83752863			CCCNC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)C2CCCC2)O[C@@H]1CO	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16+,18+/m0/s1	YRYFLIZLJGNRPZ-LZLYRXPVSA-N	379.258339966							120165
BRD-K79352289	LSM-31609		54640480	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18-,20-/m0/s1	KWVYROQUXUCXNL-QRFRQXIXSA-N	COc1cccc(c1)c2cn(CC[C@@H]3CC[C@H](NC(=O)CN(C)C)[C@H](CO)O3)nn2	BroadT	BRD-K79352289	BRD-K79352289-001-01-6	Broad Institute of MIT and Harvard	BRD-K79352289			COc1cccc(c1)-c1cn(CC[C@@H]2CC[C@H](NC(=O)CN(C)C)[C@H](CO)O2)nn1	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18-,20-/m0/s1	KWVYROQUXUCXNL-QRFRQXIXSA-N	417.237604522							120166
BRD-K80495774	LSM-31610		54640487	InChI=1S/C18H20FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-3,6-8,13-15,23H,4-5,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15+/m0/s1	UAJBNBJNFNTHPJ-SOUVJXGZSA-N	OC[C@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K80495774	BRD-K80495774-001-01-2	Broad Institute of MIT and Harvard	BRD-K80495774			OC[C@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H20FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-3,6-8,13-15,23H,4-5,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15+/m0/s1	UAJBNBJNFNTHPJ-SOUVJXGZSA-N	393.11585504							120167
MLS003649937	LSM-31611	BRD-K38904629, SID125305249	53382605	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14+,15+/m0/s1	PJOLWCYMJOXMFX-NWANDNLSSA-N	COC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(OC)cc2)[C@@H](CO)O1	BroadT	BRD-K38904629	BRD-K38904629-001-01-3	Broad Institute of MIT and Harvard	BRD-K38904629			COC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(OC)cc2)[C@@H](CO)O1	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14+,15+/m0/s1	PJOLWCYMJOXMFX-NWANDNLSSA-N	373.119522776							120168
BRD-K98856654	LSM-31612		54640469	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19-,20+/m1/s1	JUMQDWHPHZAWJD-AHRSYUTCSA-N	Cc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CCNS(=O)(=O)c3ccccc3F)O[C@H]2CO	BroadT	BRD-K98856654	BRD-K98856654-001-01-0	Broad Institute of MIT and Harvard	BRD-K98856654			Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CCNS(=O)(=O)c2ccccc2F)O[C@H]1CO	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19-,20+/m1/s1	JUMQDWHPHZAWJD-AHRSYUTCSA-N	486.129456184							120169
BRD-K94514173	LSM-31613		54640474	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19+,20-/m0/s1	JUMQDWHPHZAWJD-DBVUQKKJSA-N	Cc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CCNS(=O)(=O)c3ccccc3F)O[C@H]2CO	BroadT	BRD-K94514173	BRD-K94514173-001-01-1	Broad Institute of MIT and Harvard	BRD-K94514173			Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNS(=O)(=O)c2ccccc2F)O[C@H]1CO	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19+,20-/m0/s1	JUMQDWHPHZAWJD-DBVUQKKJSA-N	486.129456184							120170
BRD-K46588240	LSM-31614		54640495	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18-/m1/s1	XEUNAZXFOLKMJY-FHLIZLRMSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)c2ccccc2F)C=C1	BroadT	BRD-K46588240	BRD-K46588240-001-01-3	Broad Institute of MIT and Harvard	BRD-K46588240			CN(C)CCCNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)c2ccccc2F)C=C1	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18-/m1/s1	XEUNAZXFOLKMJY-FHLIZLRMSA-N	393.206384606							120171
BRD-K17441474	LSM-31615		54640622	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13-,14-/m1/s1	GVTOYTHYWUUIIC-MGPQQGTHSA-N	COC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)c2ccccc2)C=C1	BroadT	BRD-K17441474	BRD-K17441474-001-01-7	Broad Institute of MIT and Harvard	BRD-K17441474			COC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)c2ccccc2)C=C1	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13-,14-/m1/s1	GVTOYTHYWUUIIC-MGPQQGTHSA-N	305.126322718							120172
BRD-K40419401	LSM-31616		54640713	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16-,18-/m0/s1	YRYFLIZLJGNRPZ-BQFCYCMXSA-N	CCCNC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)C3CCCC3)O[C@H]1CO	BroadT	BRD-K40419401	BRD-K40419401-001-01-2	Broad Institute of MIT and Harvard	BRD-K40419401			CCCNC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)C2CCCC2)O[C@H]1CO	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16-,18-/m0/s1	YRYFLIZLJGNRPZ-BQFCYCMXSA-N	379.258339966							120173
BRD-K38046923	LSM-31617		54640686	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22-/m1/s1	BCMJULRZXHZHRC-DCZASFAJSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CC(=O)N[C@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K38046923	BRD-K38046923-001-01-6	Broad Institute of MIT and Harvard	BRD-K38046923			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CC(=O)N[C@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22-/m1/s1	BCMJULRZXHZHRC-DCZASFAJSA-N	441.226371122							120174
BRD-K08233096	LSM-31618		54640526	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19+,20-/m0/s1	CUFNDCCMTGJSBI-DBVUQKKJSA-N	OC[C@@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)c3ccccc3F	BroadT	BRD-K08233096	BRD-K08233096-001-01-7	Broad Institute of MIT and Harvard	BRD-K08233096			OC[C@@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19+,20-/m0/s1	CUFNDCCMTGJSBI-DBVUQKKJSA-N	415.190734542							120175
BRD-K47962810	LSM-31619		54640738	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15-,16+/m1/s1	KYVBJMXDLCPPRO-OAGGEKHMSA-N	CCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@H]1CO	BroadT	BRD-K47962810	BRD-K47962810-001-01-9	Broad Institute of MIT and Harvard	BRD-K47962810			CCC(=O)N[C@@H]1C=C[C@@H](O[C@H]1CO)CC(=O)NCc1cc(F)cc(F)c1	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15-,16+/m1/s1	KYVBJMXDLCPPRO-OAGGEKHMSA-N	368.154763604							120176
BRD-K05269173	LSM-31620		54640677	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22-/m1/s1	BCMJULRZXHZHRC-HOQQESESSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CC(=O)N[C@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K05269173	BRD-K05269173-001-01-0	Broad Institute of MIT and Harvard	BRD-K05269173			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CC(=O)N[C@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22-/m1/s1	BCMJULRZXHZHRC-HOQQESESSA-N	441.226371122							120177
BRD-K82056353	LSM-31621		54640693	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20+,21+/m0/s1	YKQIDJUJSSSEIT-PWRODBHTSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@@H]2CO)cc1	BroadT	BRD-K82056353	BRD-K82056353-001-01-9	Broad Institute of MIT and Harvard	BRD-K82056353			COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@@H]2CO)cc1	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20+,21+/m0/s1	YKQIDJUJSSSEIT-PWRODBHTSA-N	495.132776414							120178
BRD-K23280067	LSM-31622		54640511	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20+/m0/s1	NQVHKOMHSOOYQX-FRYIKTPZSA-N	C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K23280067	BRD-K23280067-001-01-4	Broad Institute of MIT and Harvard	BRD-K23280067			C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20+/m0/s1	NQVHKOMHSOOYQX-FRYIKTPZSA-N	417.226371122							120179
BRD-K16136457	LSM-31623		54640427	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17+,18+/m0/s1	CLBFLRMDTNZFIM-RCCFBDPRSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Cc3ccccc3	BroadT	BRD-K16136457	BRD-K16136457-001-01-5	Broad Institute of MIT and Harvard	BRD-K16136457			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Cc1ccccc1	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17+,18+/m0/s1	CLBFLRMDTNZFIM-RCCFBDPRSA-N	376.199822016							120180
BRD-K36763492	LSM-31624		54640482	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18+,20-/m0/s1	KWVYROQUXUCXNL-HQRMLTQVSA-N	COc1cccc(c1)c2cn(CC[C@@H]3CC[C@@H](NC(=O)CN(C)C)[C@H](CO)O3)nn2	BroadT	BRD-K36763492	BRD-K36763492-001-01-9	Broad Institute of MIT and Harvard	BRD-K36763492			COc1cccc(c1)-c1cn(CC[C@@H]2CC[C@@H](NC(=O)CN(C)C)[C@H](CO)O2)nn1	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18+,20-/m0/s1	KWVYROQUXUCXNL-HQRMLTQVSA-N	417.237604522							120181
BRD-K23556321	LSM-31625		54640620	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13+,14+/m0/s1	GVTOYTHYWUUIIC-BFHYXJOUSA-N	COC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)c2ccccc2)C=C1	BroadT	BRD-K23556321	BRD-K23556321-001-01-9	Broad Institute of MIT and Harvard	BRD-K23556321			COC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)c2ccccc2)C=C1	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13+,14+/m0/s1	GVTOYTHYWUUIIC-BFHYXJOUSA-N	305.126322718							120182
BRD-K38791044	LSM-31626		54640678	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22+/m1/s1	BCMJULRZXHZHRC-MDRHQERFSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CC(=O)N[C@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K38791044	BRD-K38791044-001-01-1	Broad Institute of MIT and Harvard	BRD-K38791044			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CC(=O)N[C@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22+/m1/s1	BCMJULRZXHZHRC-MDRHQERFSA-N	441.226371122							120183
BRD-K04358482	LSM-31627		54640435	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23+,25+/m0/s1	VHAZZXZDVYBBQV-QQKQFIJSSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K04358482	BRD-K04358482-001-01-8	Broad Institute of MIT and Harvard	BRD-K04358482			OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23+,25+/m0/s1	VHAZZXZDVYBBQV-QQKQFIJSSA-N	495.196962774							120184
MLS003649913	LSM-31628	BRD-K94777797	53382581	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14+,15+/m0/s1	QXJDCVBLBQBSAR-NWANDNLSSA-N	COC(=O)C[C@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	BroadT	BRD-K94777797	BRD-K94777797-001-01-0	Broad Institute of MIT and Harvard	BRD-K94777797			COC(=O)C[C@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14+,15+/m0/s1	QXJDCVBLBQBSAR-NWANDNLSSA-N	371.103872712							120185
BRD-K58836556	LSM-31629		54640439	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23-,25+/m1/s1	VHAZZXZDVYBBQV-PFATUAPWSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K58836556	BRD-K58836556-001-01-9	Broad Institute of MIT and Harvard	BRD-K58836556			OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23-,25+/m1/s1	VHAZZXZDVYBBQV-PFATUAPWSA-N	495.196962774							120186
BRD-K40679791	LSM-31630		54640468	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19+,20+/m1/s1	JUMQDWHPHZAWJD-UXPWSPDFSA-N	Cc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@H](CCNS(=O)(=O)c3ccccc3F)O[C@H]2CO	BroadT	BRD-K40679791	BRD-K40679791-001-01-9	Broad Institute of MIT and Harvard	BRD-K40679791			Cc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@H](CCNS(=O)(=O)c2ccccc2F)O[C@H]1CO	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19+,20+/m1/s1	JUMQDWHPHZAWJD-UXPWSPDFSA-N	486.129456184							120187
BRD-K37929710	LSM-31631		54640619	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20+,22-/m0/s1	CDLJASURWSOPPJ-DWLFOUALSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3cccc(F)c3)CC[C@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K37929710	BRD-K37929710-001-01-1	Broad Institute of MIT and Harvard	BRD-K37929710			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2cccc(F)c2)CC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20+,22-/m0/s1	CDLJASURWSOPPJ-DWLFOUALSA-N	494.119081888							120188
BRD-K85909950	LSM-31632		54640506	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20+/m1/s1	NQVHKOMHSOOYQX-LMCOJAPRSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K85909950	BRD-K85909950-001-01-3	Broad Institute of MIT and Harvard	BRD-K85909950			C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20+/m1/s1	NQVHKOMHSOOYQX-LMCOJAPRSA-N	417.226371122							120189
BRD-K12524104	LSM-31633		54640645	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17+,18+/m0/s1	QWOFJLPZBFRYTI-BMGDILEWSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K12524104	BRD-K12524104-001-01-3	Broad Institute of MIT and Harvard	BRD-K12524104			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17+,18+/m0/s1	QWOFJLPZBFRYTI-BMGDILEWSA-N	393.206384606							120190
BRD-K58219783	LSM-31634		54640532	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20-,21+/m1/s1	DVYXTDYPIFUIBC-NJYVYQBISA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)cc1	BroadT	BRD-K58219783	BRD-K58219783-001-01-3	Broad Institute of MIT and Harvard	BRD-K58219783			COc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)cc1	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20-,21+/m1/s1	DVYXTDYPIFUIBC-NJYVYQBISA-N	430.190400184							120191
BRD-K19652287	LSM-31635		54640701	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20+,21+/m1/s1	RCCDRCNDPSXTFI-GIVPXCGWSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NCc3ccc(F)cc3)O[C@H]2CO	BroadT	BRD-K19652287	BRD-K19652287-001-01-4	Broad Institute of MIT and Harvard	BRD-K19652287			COc1cccc(c1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccc(F)cc2)O[C@H]1CO	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20+,21+/m1/s1	RCCDRCNDPSXTFI-GIVPXCGWSA-N	464.14173543							120192
BRD-K58596567	LSM-31636		54640672	InChI=1S/C28H37N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-12,24-26,32H,2,5-6,13-20H2,(H,29,34)(H,30,33)/t24-,25-,26+/m1/s1	OVKJLPKMZNQLNH-CYXNTTPDSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K58596567	BRD-K58596567-001-01-6	Broad Institute of MIT and Harvard	BRD-K58596567			OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H37N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-12,24-26,32H,2,5-6,13-20H2,(H,29,34)(H,30,33)/t24-,25-,26+/m1/s1	OVKJLPKMZNQLNH-CYXNTTPDSA-N	479.278406694							120193
BRD-K32751688	LSM-31637		54640673	InChI=1S/C19H31N3O5S/c1-14(2)21-19(24)22-17-9-8-16(27-18(17)12-23)10-11-20-28(25,26)13-15-6-4-3-5-7-15/h3-7,14,16-18,20,23H,8-13H2,1-2H3,(H2,21,22,24)/t16-,17+,18+/m0/s1	WDDVSYGCEMHEAU-RCCFBDPRSA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CCNS(=O)(=O)Cc2ccccc2)O[C@@H]1CO	BroadT	BRD-K32751688	BRD-K32751688-001-01-2	Broad Institute of MIT and Harvard	BRD-K32751688			CC(C)NC(=O)N[C@@H]1CC[C@@H](CCNS(=O)(=O)Cc2ccccc2)O[C@@H]1CO	InChI=1S/C19H31N3O5S/c1-14(2)21-19(24)22-17-9-8-16(27-18(17)12-23)10-11-20-28(25,26)13-15-6-4-3-5-7-15/h3-7,14,16-18,20,23H,8-13H2,1-2H3,(H2,21,22,24)/t16-,17+,18+/m0/s1	WDDVSYGCEMHEAU-RCCFBDPRSA-N	413.198441812							120194
BRD-K23800773	LSM-31638		54640496	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18-/m0/s1	XEUNAZXFOLKMJY-QGTPRVQTSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)c2ccccc2F)C=C1	BroadT	BRD-K23800773	BRD-K23800773-001-01-4	Broad Institute of MIT and Harvard	BRD-K23800773			CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)c2ccccc2F)C=C1	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18-/m0/s1	XEUNAZXFOLKMJY-QGTPRVQTSA-N	393.206384606							120195
BRD-K50117485	LSM-31639		54640483	InChI=1S/C18H20FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-3,6-8,13-15,23H,4-5,9-10H2,(H,21,25)(H,20,22,24)/t13-,14+,15+/m0/s1	UAJBNBJNFNTHPJ-RRFJBIMHSA-N	OC[C@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K50117485	BRD-K50117485-001-01-8	Broad Institute of MIT and Harvard	BRD-K50117485			OC[C@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H20FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-3,6-8,13-15,23H,4-5,9-10H2,(H,21,25)(H,20,22,24)/t13-,14+,15+/m0/s1	UAJBNBJNFNTHPJ-RRFJBIMHSA-N	393.11585504							120196
BRD-K54111001	LSM-31640		54640568	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22-,23+/m0/s1	MGIGDAYWWJNGIV-RJGXRXQPSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@@H]1CO	BroadT	BRD-K54111001	BRD-K54111001-001-01-2	Broad Institute of MIT and Harvard	BRD-K54111001			CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@@H]1CO	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22-,23+/m0/s1	MGIGDAYWWJNGIV-RJGXRXQPSA-N	455.242021186							120197
BRD-K76628294	LSM-31641		54640642	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14+,15-/m0/s1	PYHXZAPBOUOXMO-ZNMIVQPWSA-N	COCCNC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)NC2CCCC2)C=C1	BroadT	BRD-K76628294	BRD-K76628294-001-01-5	Broad Institute of MIT and Harvard	BRD-K76628294			COCCNC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)NC2CCCC2)C=C1	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14+,15-/m0/s1	PYHXZAPBOUOXMO-ZNMIVQPWSA-N	355.210721058							120198
BRD-K12260399	LSM-31642		54640671	InChI=1S/C28H37N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-12,24-26,32H,2,5-6,13-20H2,(H,29,34)(H,30,33)/t24-,25-,26+/m0/s1	OVKJLPKMZNQLNH-KKUQBAQOSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K12260399	BRD-K12260399-001-01-8	Broad Institute of MIT and Harvard	BRD-K12260399			OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H37N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-12,24-26,32H,2,5-6,13-20H2,(H,29,34)(H,30,33)/t24-,25-,26+/m0/s1	OVKJLPKMZNQLNH-KKUQBAQOSA-N	479.278406694							120199
BRD-K53900606	LSM-31643		54640621	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13+,14+/m1/s1	GVTOYTHYWUUIIC-RDBSUJKOSA-N	COC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)c2ccccc2)C=C1	BroadT	BRD-K53900606	BRD-K53900606-001-01-8	Broad Institute of MIT and Harvard	BRD-K53900606			COC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)c2ccccc2)C=C1	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13+,14+/m1/s1	GVTOYTHYWUUIIC-RDBSUJKOSA-N	305.126322718							120200
BRD-K20984459	LSM-31644		54640502	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18+,21-/m1/s1	BPRQWUDNJJKTKY-LVCYWYKZSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K20984459	BRD-K20984459-001-01-0	Broad Institute of MIT and Harvard	BRD-K20984459			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18+,21-/m1/s1	BPRQWUDNJJKTKY-LVCYWYKZSA-N	473.135363228							120201
BRD-K68732617	LSM-31645		54640466	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18-,19-/m0/s1	MSXVOGFBDSGFQQ-SNRMKQJTSA-N	OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c3ccccc3F	BroadT	BRD-K68732617	BRD-K68732617-001-01-5	Broad Institute of MIT and Harvard	BRD-K68732617			OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18-,19-/m0/s1	MSXVOGFBDSGFQQ-SNRMKQJTSA-N	423.21694929							120202
BRD-K51160592	LSM-31646		54640629	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13-/m1/s1	BUQXSKBONOCLOA-JHJVBQTASA-N	OC[C@H]1O[C@@H](CC(=O)O)CC[C@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K51160592	BRD-K51160592-001-01-7	Broad Institute of MIT and Harvard	BRD-K51160592			OC[C@H]1O[C@H](CC[C@H]1NC(=O)Nc1ccccc1)CC(O)=O	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13-/m1/s1	BUQXSKBONOCLOA-JHJVBQTASA-N	308.13722176							120203
BRD-K02833343	LSM-31647		54640494	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17-,18+/m1/s1	XEUNAZXFOLKMJY-OLMNPRSZSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)c2ccccc2F)C=C1	BroadT	BRD-K02833343	BRD-K02833343-001-01-1	Broad Institute of MIT and Harvard	BRD-K02833343			CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)c2ccccc2F)C=C1	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17-,18+/m1/s1	XEUNAZXFOLKMJY-OLMNPRSZSA-N	393.206384606							120204
BRD-K41707029	LSM-31648		54640612	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20+,22+/m0/s1	CDLJASURWSOPPJ-CZTZKLFOSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3cccc(F)c3)CC[C@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K41707029	BRD-K41707029-001-01-1	Broad Institute of MIT and Harvard	BRD-K41707029			OC[C@H]1O[C@H](CCn2cc(nn2)-c2cccc(F)c2)CC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20+,22+/m0/s1	CDLJASURWSOPPJ-CZTZKLFOSA-N	494.119081888							120205
BRD-K13817284	LSM-31649		54640728	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20+,21-/m1/s1	QXXUXEAVRGHKMM-QHAWAJNXSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K13817284	BRD-K13817284-001-01-2	Broad Institute of MIT and Harvard	BRD-K13817284			OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20+,21-/m1/s1	QXXUXEAVRGHKMM-QHAWAJNXSA-N	485.184811986							120206
BRD-K55460824	LSM-31650		54640450	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21-/m1/s1	KEJHSICNFQEVJK-WUHBCXKYSA-N	C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K55460824	BRD-K55460824-001-01-7	Broad Institute of MIT and Harvard	BRD-K55460824			C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21-/m1/s1	KEJHSICNFQEVJK-WUHBCXKYSA-N	448.14682081							120207
BRD-K40685792	LSM-31651		54640704	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20-,21-/m0/s1	RCCDRCNDPSXTFI-JBACZVJFSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NCc3ccc(F)cc3)O[C@H]2CO	BroadT	BRD-K40685792	BRD-K40685792-001-01-5	Broad Institute of MIT and Harvard	BRD-K40685792			COc1cccc(c1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccc(F)cc2)O[C@H]1CO	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20-,21-/m0/s1	RCCDRCNDPSXTFI-JBACZVJFSA-N	464.14173543							120208
BRD-K95682488	LSM-31652		54640574	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14-,15+/m0/s1	PJOLWCYMJOXMFX-AEGPPILISA-N	COC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(OC)cc2)[C@@H](CO)O1	BroadT	BRD-K95682488	BRD-K95682488-001-01-5	Broad Institute of MIT and Harvard	BRD-K95682488			COC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(OC)cc2)[C@@H](CO)O1	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14-,15+/m0/s1	PJOLWCYMJOXMFX-AEGPPILISA-N	373.119522776							120209
BRD-K68605096	LSM-31653		54640473	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19+,20-/m1/s1	JUMQDWHPHZAWJD-LSTHTHJFSA-N	Cc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@H](CCNS(=O)(=O)c3ccccc3F)O[C@@H]2CO	BroadT	BRD-K68605096	BRD-K68605096-001-01-3	Broad Institute of MIT and Harvard	BRD-K68605096			Cc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@H](CCNS(=O)(=O)c2ccccc2F)O[C@@H]1CO	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19+,20-/m1/s1	JUMQDWHPHZAWJD-LSTHTHJFSA-N	486.129456184							120210
BRD-K85357344	LSM-31654		54640615	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20-,22+/m1/s1	CDLJASURWSOPPJ-UZKOGDIHSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3cccc(F)c3)CC[C@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K85357344	BRD-K85357344-001-01-0	Broad Institute of MIT and Harvard	BRD-K85357344			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2cccc(F)c2)CC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20-,22+/m1/s1	CDLJASURWSOPPJ-UZKOGDIHSA-N	494.119081888							120211
BRD-K03341571	LSM-31655		54640695	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20-,21+/m1/s1	YKQIDJUJSSSEIT-NJYVYQBISA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@H]2CO)cc1	BroadT	BRD-K03341571	BRD-K03341571-001-01-7	Broad Institute of MIT and Harvard	BRD-K03341571			COc1ccc(NC(=O)N[C@@H]2CC[C@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@H]2CO)cc1	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20-,21+/m1/s1	YKQIDJUJSSSEIT-NJYVYQBISA-N	495.132776414							120212
BRD-K64958595	LSM-31656		54640640	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14-,15+/m1/s1	PYHXZAPBOUOXMO-KFWWJZLASA-N	COCCNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)NC2CCCC2)C=C1	BroadT	BRD-K64958595	BRD-K64958595-001-01-6	Broad Institute of MIT and Harvard	BRD-K64958595			COCCNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)NC2CCCC2)C=C1	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14-,15+/m1/s1	PYHXZAPBOUOXMO-KFWWJZLASA-N	355.210721058							120213
BRD-K87209752	LSM-31657		54640554	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18+,19-/m1/s1	PHXITHQOKRDDQC-DQEVTTJGSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)C2CCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K87209752	BRD-K87209752-001-01-6	Broad Institute of MIT and Harvard	BRD-K87209752			C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)C2CCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18+,19-/m1/s1	PHXITHQOKRDDQC-DQEVTTJGSA-N	374.22055746							120214
BRD-K49345010	LSM-31658		54640697	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20-,21-/m0/s1	YKQIDJUJSSSEIT-ACRUOGEOSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@H]2CO)cc1	BroadT	BRD-K49345010	BRD-K49345010-001-01-3	Broad Institute of MIT and Harvard	BRD-K49345010			COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@H]2CO)cc1	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20-,21-/m0/s1	YKQIDJUJSSSEIT-ACRUOGEOSA-N	495.132776414							120215
BRD-K35259368	LSM-31659		54640720	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16-,18+/m1/s1	NKWQDAXEZMPWOL-QBIMZIAESA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K35259368	BRD-K35259368-001-01-0	Broad Institute of MIT and Harvard	BRD-K35259368			OC[C@@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16-,18+/m1/s1	NKWQDAXEZMPWOL-QBIMZIAESA-N	402.170333456							120216
BRD-K41719870	LSM-31660		54640436	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23+,25+/m1/s1	VHAZZXZDVYBBQV-VTZPFEBOSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K41719870	BRD-K41719870-001-01-6	Broad Institute of MIT and Harvard	BRD-K41719870			OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23+,25+/m1/s1	VHAZZXZDVYBBQV-VTZPFEBOSA-N	495.196962774							120217
BRD-K55940699	LSM-31661		54640618	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20+,22-/m1/s1	CDLJASURWSOPPJ-KAGYGMCKSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3cccc(F)c3)CC[C@@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K55940699	BRD-K55940699-001-01-0	Broad Institute of MIT and Harvard	BRD-K55940699			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2cccc(F)c2)CC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20+,22-/m1/s1	CDLJASURWSOPPJ-KAGYGMCKSA-N	494.119081888							120218
BRD-K92927161	LSM-31662		54640531	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20-,21+/m0/s1	DVYXTDYPIFUIBC-PCCBWWKXSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)cc1	BroadT	BRD-K92927161	BRD-K92927161-001-01-1	Broad Institute of MIT and Harvard	BRD-K92927161			COc1ccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)cc1	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20-,21+/m0/s1	DVYXTDYPIFUIBC-PCCBWWKXSA-N	430.190400184							120219
BRD-K13110820	LSM-31663		54640601	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16-,17-/m0/s1	FBXATGIHHFZDOF-ULQDDVLXSA-N	COCc1cn(CC[C@@H]2CC[C@H](NC(=O)c3ccncc3)[C@H](CO)O2)nn1	BroadT	BRD-K13110820	BRD-K13110820-001-01-3	Broad Institute of MIT and Harvard	BRD-K13110820			COCc1cn(CC[C@@H]2CC[C@H](NC(=O)c3ccncc3)[C@H](CO)O2)nn1	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16-,17-/m0/s1	FBXATGIHHFZDOF-ULQDDVLXSA-N	375.19065433							120220
BRD-K60782883	LSM-31664		54640649	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17-,18+/m0/s1	QWOFJLPZBFRYTI-JCGIZDLHSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K60782883	BRD-K60782883-001-01-5	Broad Institute of MIT and Harvard	BRD-K60782883			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17-,18+/m0/s1	QWOFJLPZBFRYTI-JCGIZDLHSA-N	393.206384606							120221
BRD-K78939372	LSM-31665		54640617	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20-,22-/m0/s1	CDLJASURWSOPPJ-VCOUNFBDSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3cccc(F)c3)CC[C@@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K78939372	BRD-K78939372-001-01-9	Broad Institute of MIT and Harvard	BRD-K78939372			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2cccc(F)c2)CC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20-,22-/m0/s1	CDLJASURWSOPPJ-VCOUNFBDSA-N	494.119081888							120222
BRD-K80779045	LSM-31666		54640703	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20-,21-/m1/s1	RCCDRCNDPSXTFI-HMXCVIKNSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NCc3ccc(F)cc3)O[C@@H]2CO	BroadT	BRD-K80779045	BRD-K80779045-001-01-2	Broad Institute of MIT and Harvard	BRD-K80779045			COc1cccc(c1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20-,21-/m1/s1	RCCDRCNDPSXTFI-HMXCVIKNSA-N	464.14173543							120223
BRD-K55018894	LSM-31667		54640638	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14-,15-/m0/s1	PYHXZAPBOUOXMO-KKUMJFAQSA-N	COCCNC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)NC2CCCC2)C=C1	BroadT	BRD-K55018894	BRD-K55018894-001-01-8	Broad Institute of MIT and Harvard	BRD-K55018894			COCCNC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)NC2CCCC2)C=C1	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14-,15-/m0/s1	PYHXZAPBOUOXMO-KKUMJFAQSA-N	355.210721058							120224
BRD-K92479346	LSM-31668		54640475	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18+,20+/m0/s1	KWVYROQUXUCXNL-ILZDJORESA-N	COc1cccc(c1)c2cn(CC[C@@H]3CC[C@@H](NC(=O)CN(C)C)[C@@H](CO)O3)nn2	BroadT	BRD-K92479346	BRD-K92479346-001-01-1	Broad Institute of MIT and Harvard	BRD-K92479346			COc1cccc(c1)-c1cn(CC[C@@H]2CC[C@@H](NC(=O)CN(C)C)[C@@H](CO)O2)nn1	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18+,20+/m0/s1	KWVYROQUXUCXNL-ILZDJORESA-N	417.237604522							120225
BRD-K53552465	LSM-31669		54640729	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20-,21-/m1/s1	QXXUXEAVRGHKMM-NJDAHSKKSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K53552465	BRD-K53552465-001-01-7	Broad Institute of MIT and Harvard	BRD-K53552465			OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20-,21-/m1/s1	QXXUXEAVRGHKMM-NJDAHSKKSA-N	485.184811986							120226
BRD-K45303727	LSM-31670		54640448	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21+/m1/s1	KEJHSICNFQEVJK-KYPFXXDHSA-N	C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K45303727	BRD-K45303727-001-01-0	Broad Institute of MIT and Harvard	BRD-K45303727			C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20+,21+/m1/s1	KEJHSICNFQEVJK-KYPFXXDHSA-N	448.14682081							120227
BRD-K75514760	LSM-31671		54640625	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13+,14-/m1/s1	GVTOYTHYWUUIIC-HZSPNIEDSA-N	COC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)c2ccccc2)C=C1	BroadT	BRD-K75514760	BRD-K75514760-001-01-3	Broad Institute of MIT and Harvard	BRD-K75514760			COC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)c2ccccc2)C=C1	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13+,14-/m1/s1	GVTOYTHYWUUIIC-HZSPNIEDSA-N	305.126322718							120228
BRD-K09131889	LSM-31672		54640659	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14+,15-/m0/s1	QXJDCVBLBQBSAR-CFVMTHIKSA-N	COC(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	BroadT	BRD-K09131889	BRD-K09131889-001-01-3	Broad Institute of MIT and Harvard	BRD-K09131889			COC(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14+,15-/m0/s1	QXJDCVBLBQBSAR-CFVMTHIKSA-N	371.103872712							120229
BRD-K99125195	LSM-31673		54640524	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19-,20-/m1/s1	CUFNDCCMTGJSBI-NSISKUIASA-N	OC[C@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)c3ccccc3F	BroadT	BRD-K99125195	BRD-K99125195-001-01-5	Broad Institute of MIT and Harvard	BRD-K99125195			OC[C@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19-,20-/m1/s1	CUFNDCCMTGJSBI-NSISKUIASA-N	415.190734542							120230
BRD-K51515697	LSM-31674		54640498	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18+,21+/m1/s1	BPRQWUDNJJKTKY-LQWHRVPQSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K51515697	BRD-K51515697-001-01-6	Broad Institute of MIT and Harvard	BRD-K51515697			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18+,21+/m1/s1	BPRQWUDNJJKTKY-LQWHRVPQSA-N	473.135363228							120231
BRD-K99380757	LSM-31675		54640616	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20-,22-/m1/s1	CDLJASURWSOPPJ-SYYKKAFVSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3cccc(F)c3)CC[C@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K99380757	BRD-K99380757-001-01-6	Broad Institute of MIT and Harvard	BRD-K99380757			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2cccc(F)c2)CC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20-,22-/m1/s1	CDLJASURWSOPPJ-SYYKKAFVSA-N	494.119081888							120232
BRD-K47165178	LSM-31676		54640560	InChI=1S/C20H24Cl2N2O6S2/c21-14-5-8-16(9-6-14)31(26,27)23-12-11-15-7-10-18(19(13-25)30-15)24-32(28,29)20-4-2-1-3-17(20)22/h1-6,8-9,15,18-19,23-25H,7,10-13H2/t15-,18-,19-/m1/s1	QAKAPBFRRSNHFG-ATZDWAIDSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K47165178	BRD-K47165178-001-01-5	Broad Institute of MIT and Harvard	BRD-K47165178			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C20H24Cl2N2O6S2/c21-14-5-8-16(9-6-14)31(26,27)23-12-11-15-7-10-18(19(13-25)30-15)24-32(28,29)20-4-2-1-3-17(20)22/h1-6,8-9,15,18-19,23-25H,7,10-13H2/t15-,18-,19-/m1/s1	QAKAPBFRRSNHFG-ATZDWAIDSA-N	522.045283308							120233
BRD-K80225716	LSM-31677		54640706	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20-,21+/m1/s1	RCCDRCNDPSXTFI-NRSPTQNISA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NCc3ccc(F)cc3)O[C@H]2CO	BroadT	BRD-K80225716	BRD-K80225716-001-01-4	Broad Institute of MIT and Harvard	BRD-K80225716			COc1cccc(c1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccc(F)cc2)O[C@H]1CO	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20-,21+/m1/s1	RCCDRCNDPSXTFI-NRSPTQNISA-N	464.14173543							120234
BRD-K66831269	LSM-31678		54640437	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23-,25-/m1/s1	VHAZZXZDVYBBQV-GZGNHOFSSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K66831269	BRD-K66831269-001-01-8	Broad Institute of MIT and Harvard	BRD-K66831269			OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23-,25-/m1/s1	VHAZZXZDVYBBQV-GZGNHOFSSA-N	495.196962774							120235
BRD-K19603900	LSM-31679		54640730	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20-,21-/m0/s1	QXXUXEAVRGHKMM-ACRUOGEOSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K19603900	BRD-K19603900-001-01-4	Broad Institute of MIT and Harvard	BRD-K19603900			OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20-,21-/m0/s1	QXXUXEAVRGHKMM-ACRUOGEOSA-N	485.184811986							120236
BRD-K34414758	LSM-31680		54640691	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22+/m1/s1	BCMJULRZXHZHRC-BUBGKSFDSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CC(=O)N[C@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K34414758	BRD-K34414758-001-01-0	Broad Institute of MIT and Harvard	BRD-K34414758			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CC(=O)N[C@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22+/m1/s1	BCMJULRZXHZHRC-BUBGKSFDSA-N	441.226371122							120237
BRD-K27953820	LSM-31681		54640550	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19+/m0/s1	PHXITHQOKRDDQC-UDTPNQRGSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)C2CCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K27953820	BRD-K27953820-001-01-0	Broad Institute of MIT and Harvard	BRD-K27953820			C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)C2CCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19+/m0/s1	PHXITHQOKRDDQC-UDTPNQRGSA-N	374.22055746							120238
BRD-K03624299	LSM-31682		54640614	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20-,22+/m0/s1	CDLJASURWSOPPJ-RCZSKKKRSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3cccc(F)c3)CC[C@@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K03624299	BRD-K03624299-001-01-7	Broad Institute of MIT and Harvard	BRD-K03624299			OC[C@H]1O[C@H](CCn2cc(nn2)-c2cccc(F)c2)CC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20-,22+/m0/s1	CDLJASURWSOPPJ-RCZSKKKRSA-N	494.119081888							120239
BRD-K90311252	LSM-31683		54640644	InChI=1S/C16H21FN4O2/c17-12-3-1-2-11(8-12)15-9-21(20-19-15)7-6-13-4-5-14(18)16(10-22)23-13/h1-3,8-9,13-14,16,22H,4-7,10,18H2/t13-,14+,16-/m1/s1	BTTZOQWZJWSOIH-IJEWVQPXSA-N	N[C@H]1CC[C@H](CCn2cc(nn2)c3cccc(F)c3)O[C@@H]1CO	BroadT	BRD-K90311252	BRD-K90311252-001-01-0	Broad Institute of MIT and Harvard	BRD-K90311252			N[C@H]1CC[C@H](CCn2cc(nn2)-c2cccc(F)c2)O[C@@H]1CO	InChI=1S/C16H21FN4O2/c17-12-3-1-2-11(8-12)15-9-21(20-19-15)7-6-13-4-5-14(18)16(10-22)23-13/h1-3,8-9,13-14,16,22H,4-7,10,18H2/t13-,14+,16-/m1/s1	BTTZOQWZJWSOIH-IJEWVQPXSA-N	320.164854152							120240
BRD-K35727000	LSM-31684		54640593	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17-,18-/m0/s1	LEANCKNBHBEQEG-BZSNNMDCSA-N	Cc1onc(C)c1NC(=O)NCC[C@@H]2CC[C@H](NC(=O)Nc3cccc(Cl)c3)[C@H](CO)O2	BroadT	BRD-K35727000	BRD-K35727000-001-01-0	Broad Institute of MIT and Harvard	BRD-K35727000			Cc1noc(C)c1NC(=O)NCC[C@@H]1CC[C@H](NC(=O)Nc2cccc(Cl)c2)[C@H](CO)O1	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17-,18-/m0/s1	LEANCKNBHBEQEG-BZSNNMDCSA-N	465.177896756							120241
BRD-K22045035	LSM-31685		54640520	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19+,20+/m1/s1	CUFNDCCMTGJSBI-UXPWSPDFSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)c3ccccc3F	BroadT	BRD-K22045035	BRD-K22045035-001-01-1	Broad Institute of MIT and Harvard	BRD-K22045035			OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19+,20+/m1/s1	CUFNDCCMTGJSBI-UXPWSPDFSA-N	415.190734542							120242
BRD-K11662217	LSM-31686		54640477	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18-,20+/m1/s1	KWVYROQUXUCXNL-POAQFYNOSA-N	COc1cccc(c1)c2cn(CC[C@H]3CC[C@@H](NC(=O)CN(C)C)[C@H](CO)O3)nn2	BroadT	BRD-K11662217	BRD-K11662217-001-01-6	Broad Institute of MIT and Harvard	BRD-K11662217			COc1cccc(c1)-c1cn(CC[C@H]2CC[C@@H](NC(=O)CN(C)C)[C@H](CO)O2)nn1	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18-,20+/m1/s1	KWVYROQUXUCXNL-POAQFYNOSA-N	417.237604522							120243
BRD-K85708426	LSM-31687		54640636	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14+,15+/m1/s1	PYHXZAPBOUOXMO-ILXRZTDVSA-N	COCCNC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)NC2CCCC2)C=C1	BroadT	BRD-K85708426	BRD-K85708426-001-01-5	Broad Institute of MIT and Harvard	BRD-K85708426			COCCNC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)NC2CCCC2)C=C1	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14+,15+/m1/s1	PYHXZAPBOUOXMO-ILXRZTDVSA-N	355.210721058							120244
BRD-K50291875	LSM-31688		54640508	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20+/m0/s1	NQVHKOMHSOOYQX-MTFMMBMASA-N	C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K50291875	BRD-K50291875-001-01-9	Broad Institute of MIT and Harvard	BRD-K50291875			C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20+/m0/s1	NQVHKOMHSOOYQX-MTFMMBMASA-N	417.226371122							120245
BRD-K78647367	LSM-31689		54640668	InChI=1S/C28H37N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-12,24-26,32H,2,5-6,13-20H2,(H,29,34)(H,30,33)/t24-,25+,26+/m0/s1	OVKJLPKMZNQLNH-JIMJEQGWSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K78647367	BRD-K78647367-001-01-5	Broad Institute of MIT and Harvard	BRD-K78647367			OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H37N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-12,24-26,32H,2,5-6,13-20H2,(H,29,34)(H,30,33)/t24-,25+,26+/m0/s1	OVKJLPKMZNQLNH-JIMJEQGWSA-N	479.278406694							120246
BRD-K15322427	LSM-31690		54640670	InChI=1S/C28H37N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-12,24-26,32H,2,5-6,13-20H2,(H,29,34)(H,30,33)/t24-,25-,26-/m0/s1	OVKJLPKMZNQLNH-GSDHBNRESA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K15322427	BRD-K15322427-001-01-9	Broad Institute of MIT and Harvard	BRD-K15322427			OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H37N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-12,24-26,32H,2,5-6,13-20H2,(H,29,34)(H,30,33)/t24-,25-,26-/m0/s1	OVKJLPKMZNQLNH-GSDHBNRESA-N	479.278406694							120247
BRD-K48749255	LSM-31691		54640579	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17+,19+/m1/s1	IVGXTVZUVQFGHY-AOIWGVFYSA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)c3ccc(F)cc3)O[C@H]1CO	BroadT	BRD-K48749255	BRD-K48749255-001-01-1	Broad Institute of MIT and Harvard	BRD-K48749255			CC(C)NC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@H]1CO	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17+,19+/m1/s1	IVGXTVZUVQFGHY-AOIWGVFYSA-N	405.217618006							120248
BRD-K05304510	LSM-31692		54640602	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16-,17+/m0/s1	FBXATGIHHFZDOF-YESZJQIVSA-N	COCc1cn(CC[C@@H]2CC[C@H](NC(=O)c3ccncc3)[C@@H](CO)O2)nn1	BroadT	BRD-K05304510	BRD-K05304510-001-01-7	Broad Institute of MIT and Harvard	BRD-K05304510			COCc1cn(CC[C@@H]2CC[C@H](NC(=O)c3ccncc3)[C@@H](CO)O2)nn1	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16-,17+/m0/s1	FBXATGIHHFZDOF-YESZJQIVSA-N	375.19065433							120249
BRD-K62188824	LSM-31693		54640467	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18+,19-/m0/s1	MSXVOGFBDSGFQQ-IPELMVKDSA-N	OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c3ccccc3F	BroadT	BRD-K62188824	BRD-K62188824-001-01-5	Broad Institute of MIT and Harvard	BRD-K62188824			OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18+,19-/m0/s1	MSXVOGFBDSGFQQ-IPELMVKDSA-N	423.21694929							120250
BRD-K88996418	LSM-31694		54640690	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22+/m0/s1	BCMJULRZXHZHRC-PBNJOUANSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K88996418	BRD-K88996418-001-01-3	Broad Institute of MIT and Harvard	BRD-K88996418			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22+/m0/s1	BCMJULRZXHZHRC-PBNJOUANSA-N	441.226371122							120251
BRD-K19800225	LSM-31695		54640504	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20-/m1/s1	NQVHKOMHSOOYQX-GSEOLPGOSA-N	C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K19800225	BRD-K19800225-001-01-4	Broad Institute of MIT and Harvard	BRD-K19800225			C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20-/m1/s1	NQVHKOMHSOOYQX-GSEOLPGOSA-N	417.226371122							120252
BRD-K37398853	LSM-31696		54640688	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22+/m1/s1	BCMJULRZXHZHRC-ZLLBNUPZSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CC(=O)N[C@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K37398853	BRD-K37398853-001-01-6	Broad Institute of MIT and Harvard	BRD-K37398853			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CC(=O)N[C@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22+/m1/s1	BCMJULRZXHZHRC-ZLLBNUPZSA-N	441.226371122							120253
BRD-K10301055	LSM-31697		54640732	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20+,21-/m0/s1	QXXUXEAVRGHKMM-HBMCJLEFSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K10301055	BRD-K10301055-001-01-7	Broad Institute of MIT and Harvard	BRD-K10301055			OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20+,21-/m0/s1	QXXUXEAVRGHKMM-HBMCJLEFSA-N	485.184811986							120254
CHEMBL2362103	LSM-31698	BRD-K34977825, SID131436992	54640681	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22-/m1/s1	BCMJULRZXHZHRC-QWJIHBKKSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CC(=O)N[C@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K34977825	BRD-K34977825-001-01-5	Broad Institute of MIT and Harvard	BRD-K34977825			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CC(=O)N[C@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22-/m1/s1	BCMJULRZXHZHRC-QWJIHBKKSA-N	441.226371122							120255
BRD-K36575696	LSM-31699		54640698	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20-,21+/m0/s1	YKQIDJUJSSSEIT-PCCBWWKXSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@@H]2CO)cc1	BroadT	BRD-K36575696	BRD-K36575696-001-01-1	Broad Institute of MIT and Harvard	BRD-K36575696			COc1ccc(NC(=O)N[C@H]2CC[C@@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@@H]2CO)cc1	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20-,21+/m0/s1	YKQIDJUJSSSEIT-PCCBWWKXSA-N	495.132776414							120256
BRD-K82217056	LSM-31700		54640623	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13-,14-/m0/s1	GVTOYTHYWUUIIC-IHRRRGAJSA-N	COC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)c2ccccc2)C=C1	BroadT	BRD-K82217056	BRD-K82217056-001-01-7	Broad Institute of MIT and Harvard	BRD-K82217056			COC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)c2ccccc2)C=C1	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13-,14-/m0/s1	GVTOYTHYWUUIIC-IHRRRGAJSA-N	305.126322718							120257
BRD-K52154207	LSM-31701		54640522	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19-,20+/m1/s1	CUFNDCCMTGJSBI-AHRSYUTCSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)c3ccccc3F	BroadT	BRD-K52154207	BRD-K52154207-001-01-6	Broad Institute of MIT and Harvard	BRD-K52154207			OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19-,20+/m1/s1	CUFNDCCMTGJSBI-AHRSYUTCSA-N	415.190734542							120258
BRD-K88282877	LSM-31702		54640676	InChI=1S/C19H31N3O5S/c1-14(2)21-19(24)22-17-9-8-16(27-18(17)12-23)10-11-20-28(25,26)13-15-6-4-3-5-7-15/h3-7,14,16-18,20,23H,8-13H2,1-2H3,(H2,21,22,24)/t16-,17-,18-/m0/s1	WDDVSYGCEMHEAU-BZSNNMDCSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CCNS(=O)(=O)Cc2ccccc2)O[C@H]1CO	BroadT	BRD-K88282877	BRD-K88282877-001-01-2	Broad Institute of MIT and Harvard	BRD-K88282877			CC(C)NC(=O)N[C@H]1CC[C@@H](CCNS(=O)(=O)Cc2ccccc2)O[C@H]1CO	InChI=1S/C19H31N3O5S/c1-14(2)21-19(24)22-17-9-8-16(27-18(17)12-23)10-11-20-28(25,26)13-15-6-4-3-5-7-15/h3-7,14,16-18,20,23H,8-13H2,1-2H3,(H2,21,22,24)/t16-,17-,18-/m0/s1	WDDVSYGCEMHEAU-BZSNNMDCSA-N	413.198441812							120259
BRD-K25470159	LSM-31703		54640711	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16-,18+/m1/s1	YRYFLIZLJGNRPZ-NUJGCVRESA-N	CCCNC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)C3CCCC3)O[C@H]1CO	BroadT	BRD-K25470159	BRD-K25470159-001-01-8	Broad Institute of MIT and Harvard	BRD-K25470159			CCCNC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)C2CCCC2)O[C@H]1CO	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16-,18+/m1/s1	YRYFLIZLJGNRPZ-NUJGCVRESA-N	379.258339966							120260
BRD-K04363234	LSM-31704		54640723	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16-,18+/m0/s1	NKWQDAXEZMPWOL-QANKJYHBSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K04363234	BRD-K04363234-001-01-9	Broad Institute of MIT and Harvard	BRD-K04363234			OC[C@H]1O[C@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16-,18+/m0/s1	NKWQDAXEZMPWOL-QANKJYHBSA-N	402.170333456							120261
BRD-K85168571	LSM-31705		54640658	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14+,15-/m1/s1	QXJDCVBLBQBSAR-VHDGCEQUSA-N	COC(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	BroadT	BRD-K85168571	BRD-K85168571-001-01-5	Broad Institute of MIT and Harvard	BRD-K85168571			COC(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14+,15-/m1/s1	QXJDCVBLBQBSAR-VHDGCEQUSA-N	371.103872712							120262
BRD-K41355839	LSM-31706		54640454	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20-/m1/s1	OPJMBNVAUHUOES-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K41355839	BRD-K41355839-001-01-9	Broad Institute of MIT and Harvard	BRD-K41355839			OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20-/m1/s1	OPJMBNVAUHUOES-VAMGGRTRSA-N	410.195405352							120263
BRD-K73581966	LSM-31707		54640523	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19+,20-/m1/s1	CUFNDCCMTGJSBI-LSTHTHJFSA-N	OC[C@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)c3ccccc3F	BroadT	BRD-K73581966	BRD-K73581966-001-01-6	Broad Institute of MIT and Harvard	BRD-K73581966			OC[C@H]1O[C@@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19+,20-/m1/s1	CUFNDCCMTGJSBI-LSTHTHJFSA-N	415.190734542							120264
BRD-K05786443	LSM-31708		54640646	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17+,18+/m1/s1	QWOFJLPZBFRYTI-JLSDUUJJSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K05786443	BRD-K05786443-001-01-7	Broad Institute of MIT and Harvard	BRD-K05786443			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17+,18+/m1/s1	QWOFJLPZBFRYTI-JLSDUUJJSA-N	393.206384606							120265
BRD-K31390971	LSM-31709		54640663	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20-,21+/m1/s1	NLJLXKOEVYKMMF-NRSPTQNISA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2	BroadT	BRD-K31390971	BRD-K31390971-001-01-6	Broad Institute of MIT and Harvard	BRD-K31390971			Cc1ccc(cc1)S(=O)(=O)NCC[C@H]1CC[C@@H](NC(=O)c2cccc(F)c2)[C@H](CO)O1	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20-,21+/m1/s1	NLJLXKOEVYKMMF-NRSPTQNISA-N	450.162470874							120266
BRD-K44975377	LSM-31710		54640736	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15-,16-/m0/s1	KYVBJMXDLCPPRO-JYJNAYRXSA-N	CCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@H]1CO	BroadT	BRD-K44975377	BRD-K44975377-001-01-9	Broad Institute of MIT and Harvard	BRD-K44975377			CCC(=O)N[C@H]1C=C[C@H](O[C@H]1CO)CC(=O)NCc1cc(F)cc(F)c1	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15-,16-/m0/s1	KYVBJMXDLCPPRO-JYJNAYRXSA-N	368.154763604							120267
BRD-K61451401	LSM-31711		54640529	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20-,21-/m1/s1	DVYXTDYPIFUIBC-NJDAHSKKSA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)cc1	BroadT	BRD-K61451401	BRD-K61451401-001-01-9	Broad Institute of MIT and Harvard	BRD-K61451401			COc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)cc1	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20-,21-/m1/s1	DVYXTDYPIFUIBC-NJDAHSKKSA-N	430.190400184							120268
BRD-K64862162	LSM-31712		54640555	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18-,19+/m0/s1	PHXITHQOKRDDQC-KLIQENQMSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)C2CCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K64862162	BRD-K64862162-001-01-3	Broad Institute of MIT and Harvard	BRD-K64862162			C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)C2CCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18-,19+/m0/s1	PHXITHQOKRDDQC-KLIQENQMSA-N	374.22055746							120269
BRD-K80414383	LSM-31713		54640465	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18-,19-/m1/s1	MSXVOGFBDSGFQQ-ATZDWAIDSA-N	OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c3ccccc3F	BroadT	BRD-K80414383	BRD-K80414383-001-01-6	Broad Institute of MIT and Harvard	BRD-K80414383			OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18-,19-/m1/s1	MSXVOGFBDSGFQQ-ATZDWAIDSA-N	423.21694929							120270
BRD-K60886324	LSM-31714		54640694	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20+,21+/m1/s1	YKQIDJUJSSSEIT-HKBOAZHASA-N	COc1ccc(NC(=O)N[C@H]2CC[C@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@H]2CO)cc1	BroadT	BRD-K60886324	BRD-K60886324-001-01-1	Broad Institute of MIT and Harvard	BRD-K60886324			COc1ccc(NC(=O)N[C@H]2CC[C@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@H]2CO)cc1	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20+,21+/m1/s1	YKQIDJUJSSSEIT-HKBOAZHASA-N	495.132776414							120271
BRD-K53026281	LSM-31715		54640733	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15+,16+/m0/s1	KYVBJMXDLCPPRO-ARFHVFGLSA-N	CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@@H]1CO	BroadT	BRD-K53026281	BRD-K53026281-001-01-4	Broad Institute of MIT and Harvard	BRD-K53026281			CCC(=O)N[C@@H]1C=C[C@H](O[C@@H]1CO)CC(=O)NCc1cc(F)cc(F)c1	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15+,16+/m0/s1	KYVBJMXDLCPPRO-ARFHVFGLSA-N	368.154763604							120272
CHEMBL2362302	LSM-31716	BRD-K24743998, SID131436915	54640606	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19+,21+/m1/s1	JEWVOUSHTDFCPR-LMNJBCLMSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3ccccn3)CC[C@@H]1NC(=O)c4ccc(F)cc4	BroadT	BRD-K24743998	BRD-K24743998-001-01-4	Broad Institute of MIT and Harvard	BRD-K24743998			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2ccccn2)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19+,21+/m1/s1	JEWVOUSHTDFCPR-LMNJBCLMSA-N	425.186317878							120273
BRD-K30172718	LSM-31717		54640457	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20+/m1/s1	OPJMBNVAUHUOES-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K30172718	BRD-K30172718-001-01-7	Broad Institute of MIT and Harvard	BRD-K30172718			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20+/m1/s1	OPJMBNVAUHUOES-AQNXPRMDSA-N	410.195405352							120274
BRD-K23857235	LSM-31718		54640463	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18-,19+/m1/s1	MSXVOGFBDSGFQQ-LZQZEXGQSA-N	OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c3ccccc3F	BroadT	BRD-K23857235	BRD-K23857235-001-01-6	Broad Institute of MIT and Harvard	BRD-K23857235			OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18-,19+/m1/s1	MSXVOGFBDSGFQQ-LZQZEXGQSA-N	423.21694929							120275
BRD-K61363662	LSM-31719		54640503	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18+,21-/m0/s1	BPRQWUDNJJKTKY-UEXGIBASSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K61363662	BRD-K61363662-001-01-0	Broad Institute of MIT and Harvard	BRD-K61363662			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18+,21-/m0/s1	BPRQWUDNJJKTKY-UEXGIBASSA-N	473.135363228							120276
BRD-K91905575	LSM-31720		54640447	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21-/m1/s1	KEJHSICNFQEVJK-ZQYQINFJSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K91905575	BRD-K91905575-001-01-8	Broad Institute of MIT and Harvard	BRD-K91905575			C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21-/m1/s1	KEJHSICNFQEVJK-ZQYQINFJSA-N	448.14682081							120277
BRD-K43820045	LSM-31721		54640715	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16+,18-/m1/s1	YRYFLIZLJGNRPZ-SOLBZPMBSA-N	CCCNC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)C3CCCC3)O[C@@H]1CO	BroadT	BRD-K43820045	BRD-K43820045-001-01-0	Broad Institute of MIT and Harvard	BRD-K43820045			CCCNC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)C2CCCC2)O[C@@H]1CO	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16+,18-/m1/s1	YRYFLIZLJGNRPZ-SOLBZPMBSA-N	379.258339966							120278
BRD-K63856509	LSM-31722		54640718	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16+,18+/m1/s1	NKWQDAXEZMPWOL-SKDZVZGDSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K63856509	BRD-K63856509-001-01-8	Broad Institute of MIT and Harvard	BRD-K63856509			OC[C@@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16+,18+/m1/s1	NKWQDAXEZMPWOL-SKDZVZGDSA-N	402.170333456							120279
BRD-K11610091	LSM-31723		54640434	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17+,18-/m0/s1	CLBFLRMDTNZFIM-KSZLIROESA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Cc3ccccc3	BroadT	BRD-K11610091	BRD-K11610091-001-01-6	Broad Institute of MIT and Harvard	BRD-K11610091			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Cc1ccccc1	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17+,18-/m0/s1	CLBFLRMDTNZFIM-KSZLIROESA-N	376.199822016							120280
BRD-K44713204	LSM-31724		54640626	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13+,14-/m0/s1	GVTOYTHYWUUIIC-MJBXVCDLSA-N	COC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)c2ccccc2)C=C1	BroadT	BRD-K44713204	BRD-K44713204-001-01-3	Broad Institute of MIT and Harvard	BRD-K44713204			COC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)c2ccccc2)C=C1	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13+,14-/m0/s1	GVTOYTHYWUUIIC-MJBXVCDLSA-N	305.126322718							120281
BRD-K59922784	LSM-31725		54640564	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22+,23+/m0/s1	MGIGDAYWWJNGIV-YTFSRNRJSA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@@H]1CO	BroadT	BRD-K59922784	BRD-K59922784-001-01-0	Broad Institute of MIT and Harvard	BRD-K59922784			CC(C)NC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@@H]1CO	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22+,23+/m0/s1	MGIGDAYWWJNGIV-YTFSRNRJSA-N	455.242021186							120282
BRD-K25097691	LSM-31726		54640535	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16+,17+/m0/s1	BVKYPNZNGBYIEE-GVDBMIGSSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K25097691	BRD-K25097691-001-01-4	Broad Institute of MIT and Harvard	BRD-K25097691			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16+,17+/m0/s1	BVKYPNZNGBYIEE-GVDBMIGSSA-N	380.17475012							120283
BRD-K80715600	LSM-31727		54640613	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20+,22+/m1/s1	CDLJASURWSOPPJ-CBQOVEMMSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3cccc(F)c3)CC[C@@H]1NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K80715600	BRD-K80715600-001-01-3	Broad Institute of MIT and Harvard	BRD-K80715600			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2cccc(F)c2)CC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H24ClFN4O4S/c23-16-4-7-19(8-5-16)33(30,31)26-20-9-6-18(32-22(20)14-29)10-11-28-13-21(25-27-28)15-2-1-3-17(24)12-15/h1-5,7-8,12-13,18,20,22,26,29H,6,9-11,14H2/t18-,20+,22+/m1/s1	CDLJASURWSOPPJ-CBQOVEMMSA-N	494.119081888							120284
BRD-K01615696	LSM-31728		54640702	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20+,21+/m0/s1	RCCDRCNDPSXTFI-CEWLAPEOSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCc3ccc(F)cc3)O[C@@H]2CO	BroadT	BRD-K01615696	BRD-K01615696-001-01-6	Broad Institute of MIT and Harvard	BRD-K01615696			COc1cccc(c1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20+,21+/m0/s1	RCCDRCNDPSXTFI-CEWLAPEOSA-N	464.14173543							120285
BRD-K13274297-001-01-1	LSM-31729	BRD-K13274297	54640585	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14+,16-/m1/s1	DHOFHCIZNIPSHR-IJEWVQPXSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K13274297	BRD-K13274297-001-01-1	Broad Institute of MIT and Harvard	BRD-K13274297			OC[C@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)C1CCC1	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14+,16-/m1/s1	DHOFHCIZNIPSHR-IJEWVQPXSA-N	362.195405352							120286
BRD-K17122222	LSM-31730		54640739	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15+,16-/m1/s1	KYVBJMXDLCPPRO-OWCLPIDISA-N	CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@@H]1CO	BroadT	BRD-K17122222	BRD-K17122222-001-01-8	Broad Institute of MIT and Harvard	BRD-K17122222			CCC(=O)N[C@H]1C=C[C@@H](O[C@@H]1CO)CC(=O)NCc1cc(F)cc(F)c1	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15+,16-/m1/s1	KYVBJMXDLCPPRO-OWCLPIDISA-N	368.154763604							120287
BRD-K07482874	LSM-31731		54640516	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20-/m1/s1	NQVHKOMHSOOYQX-RSPOEFSDSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K07482874	BRD-K07482874-001-01-9	Broad Institute of MIT and Harvard	BRD-K07482874			C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20-/m1/s1	NQVHKOMHSOOYQX-RSPOEFSDSA-N	417.226371122							120288
BRD-K76899562	LSM-31732		54640628	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12+,13+/m1/s1	BUQXSKBONOCLOA-AGIUHOORSA-N	OC[C@@H]1O[C@@H](CC(=O)O)CC[C@@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K76899562	BRD-K76899562-001-01-7	Broad Institute of MIT and Harvard	BRD-K76899562			OC[C@@H]1O[C@H](CC[C@@H]1NC(=O)Nc1ccccc1)CC(O)=O	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12+,13+/m1/s1	BUQXSKBONOCLOA-AGIUHOORSA-N	308.13722176							120289
BRD-K81181894	LSM-31733		54640725	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20+,21+/m0/s1	QXXUXEAVRGHKMM-PWRODBHTSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K81181894	BRD-K81181894-001-01-2	Broad Institute of MIT and Harvard	BRD-K81181894			OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20+,21+/m0/s1	QXXUXEAVRGHKMM-PWRODBHTSA-N	485.184811986							120290
BRD-K55392659	LSM-31734		54640656	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14-,15+/m0/s1	QXJDCVBLBQBSAR-AEGPPILISA-N	COC(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	BroadT	BRD-K55392659	BRD-K55392659-001-01-2	Broad Institute of MIT and Harvard	BRD-K55392659			COC(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14-,15+/m0/s1	QXJDCVBLBQBSAR-AEGPPILISA-N	371.103872712							120291
BRD-K21841771	LSM-31735		54640521	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19-,20+/m0/s1	CUFNDCCMTGJSBI-FFZOFVMBSA-N	OC[C@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)c3ccccc3F	BroadT	BRD-K21841771	BRD-K21841771-001-01-2	Broad Institute of MIT and Harvard	BRD-K21841771			OC[C@H]1O[C@H](CCNC(=O)Cc2ccccn2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H26FN3O4/c23-18-7-2-1-6-17(18)22(29)26-19-9-8-16(30-20(19)14-27)10-12-25-21(28)13-15-5-3-4-11-24-15/h1-7,11,16,19-20,27H,8-10,12-14H2,(H,25,28)(H,26,29)/t16-,19-,20+/m0/s1	CUFNDCCMTGJSBI-FFZOFVMBSA-N	415.190734542							120292
BRD-K58088649	LSM-31736		54640570	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22+,23-/m0/s1	MGIGDAYWWJNGIV-ZRBLBEILSA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@H]1CO	BroadT	BRD-K58088649	BRD-K58088649-001-01-6	Broad Institute of MIT and Harvard	BRD-K58088649			CC(C)NC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@H]1CO	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22+,23-/m0/s1	MGIGDAYWWJNGIV-ZRBLBEILSA-N	455.242021186							120293
BRD-K65828139	LSM-31737		54640471	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19-,20-/m0/s1	JUMQDWHPHZAWJD-VDGAXYAQSA-N	Cc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CCNS(=O)(=O)c3ccccc3F)O[C@H]2CO	BroadT	BRD-K65828139	BRD-K65828139-001-01-3	Broad Institute of MIT and Harvard	BRD-K65828139			Cc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CCNS(=O)(=O)c2ccccc2F)O[C@H]1CO	InChI=1S/C21H27FN2O6S2/c1-15-5-4-6-17(13-15)31(26,27)24-19-10-9-16(30-20(19)14-25)11-12-23-32(28,29)21-8-3-2-7-18(21)22/h2-8,13,16,19-20,23-25H,9-12,14H2,1H3/t16-,19-,20-/m0/s1	JUMQDWHPHZAWJD-VDGAXYAQSA-N	486.129456184							120294
BRD-K90052868	LSM-31738		54640551	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19-/m1/s1	PHXITHQOKRDDQC-GRGSLBFTSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)C2CCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K90052868	BRD-K90052868-001-01-6	Broad Institute of MIT and Harvard	BRD-K90052868			C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)C2CCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19-/m1/s1	PHXITHQOKRDDQC-GRGSLBFTSA-N	374.22055746							120295
BRD-K68558540	LSM-31739		54640461	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18+,19+/m1/s1	MSXVOGFBDSGFQQ-MNEFBYGVSA-N	OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c3ccccc3F	BroadT	BRD-K68558540	BRD-K68558540-001-01-6	Broad Institute of MIT and Harvard	BRD-K68558540			OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18+,19+/m1/s1	MSXVOGFBDSGFQQ-MNEFBYGVSA-N	423.21694929							120296
BRD-K25791914	LSM-31740		54640459	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20-/m0/s1	OPJMBNVAUHUOES-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K25791914	BRD-K25791914-001-01-3	Broad Institute of MIT and Harvard	BRD-K25791914			OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20-/m0/s1	OPJMBNVAUHUOES-ZCNNSNEGSA-N	410.195405352							120297
BRD-K56055036	LSM-31741		54640721	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16+,18-/m1/s1	NKWQDAXEZMPWOL-RPVQJOFSSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K56055036	BRD-K56055036-001-01-8	Broad Institute of MIT and Harvard	BRD-K56055036			OC[C@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16+,18-/m1/s1	NKWQDAXEZMPWOL-RPVQJOFSSA-N	402.170333456							120298
BRD-K56488838	LSM-31742		54640507	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20-/m1/s1	NQVHKOMHSOOYQX-VBSBHUPXSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K56488838	BRD-K56488838-001-01-1	Broad Institute of MIT and Harvard	BRD-K56488838			C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20-/m1/s1	NQVHKOMHSOOYQX-VBSBHUPXSA-N	417.226371122							120299
BRD-K19237647	LSM-31743		54640714	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16-,18+/m0/s1	YRYFLIZLJGNRPZ-XYJFISCASA-N	CCCNC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)C3CCCC3)O[C@@H]1CO	BroadT	BRD-K19237647	BRD-K19237647-001-01-9	Broad Institute of MIT and Harvard	BRD-K19237647			CCCNC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)C2CCCC2)O[C@@H]1CO	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16-,18+/m0/s1	YRYFLIZLJGNRPZ-XYJFISCASA-N	379.258339966							120300
BRD-K28006645	LSM-31744		54640428	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17+,18+/m1/s1	CLBFLRMDTNZFIM-SQNIBIBYSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Cc3ccccc3	BroadT	BRD-K28006645	BRD-K28006645-001-01-9	Broad Institute of MIT and Harvard	BRD-K28006645			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Cc1ccccc1	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17+,18+/m1/s1	CLBFLRMDTNZFIM-SQNIBIBYSA-N	376.199822016							120301
BRD-K95443593	LSM-31745		54640651	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17+,18-/m1/s1	QWOFJLPZBFRYTI-FHLIZLRMSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K95443593	BRD-K95443593-001-01-4	Broad Institute of MIT and Harvard	BRD-K95443593			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17+,18-/m1/s1	QWOFJLPZBFRYTI-FHLIZLRMSA-N	393.206384606							120302
CHEMBL2134255	LSM-31746	BRD-K24471810, SID131436918	54640609	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19-,21-/m0/s1	JEWVOUSHTDFCPR-CUWPLCDZSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3ccccn3)CC[C@@H]1NC(=O)c4ccc(F)cc4	BroadT	BRD-K24471810	BRD-K24471810-001-01-8	Broad Institute of MIT and Harvard	BRD-K24471810			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2ccccn2)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19-,21-/m0/s1	JEWVOUSHTDFCPR-CUWPLCDZSA-N	425.186317878							120303
BRD-K40630587	LSM-31747		54640589	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14+,16-/m0/s1	DHOFHCIZNIPSHR-LZWOXQAQSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)C3CCC3	BroadT	BRD-K40630587	BRD-K40630587-001-01-0	Broad Institute of MIT and Harvard	BRD-K40630587			OC[C@@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)C1CCC1	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14+,16-/m0/s1	DHOFHCIZNIPSHR-LZWOXQAQSA-N	362.195405352							120304
BRD-K08427390	LSM-31748		54640514	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20-/m0/s1	NQVHKOMHSOOYQX-NBYUQASBSA-N	C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K08427390	BRD-K08427390-001-01-8	Broad Institute of MIT and Harvard	BRD-K08427390			C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20-/m0/s1	NQVHKOMHSOOYQX-NBYUQASBSA-N	417.226371122							120305
BRD-K14476597	LSM-31749		54640624	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13-,14+/m1/s1	GVTOYTHYWUUIIC-MCIONIFRSA-N	COC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)c2ccccc2)C=C1	BroadT	BRD-K14476597	BRD-K14476597-001-01-8	Broad Institute of MIT and Harvard	BRD-K14476597			COC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)c2ccccc2)C=C1	InChI=1S/C16H19NO5/c1-21-15(19)9-12-7-8-13(14(10-18)22-12)17-16(20)11-5-3-2-4-6-11/h2-8,12-14,18H,9-10H2,1H3,(H,17,20)/t12-,13-,14+/m1/s1	GVTOYTHYWUUIIC-MCIONIFRSA-N	305.126322718							120306
BRD-K59131688	LSM-31750		54640632	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13+/m1/s1	BUQXSKBONOCLOA-UPJWGTAASA-N	OC[C@@H]1O[C@@H](CC(=O)O)CC[C@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K59131688	BRD-K59131688-001-01-5	Broad Institute of MIT and Harvard	BRD-K59131688			OC[C@@H]1O[C@H](CC[C@H]1NC(=O)Nc1ccccc1)CC(O)=O	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13+/m1/s1	BUQXSKBONOCLOA-UPJWGTAASA-N	308.13722176							120307
BRD-K71216961	LSM-31751		54640598	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16+,17+/m1/s1	FBXATGIHHFZDOF-IKGGRYGDSA-N	COCc1cn(CC[C@H]2CC[C@H](NC(=O)c3ccncc3)[C@H](CO)O2)nn1	BroadT	BRD-K71216961	BRD-K71216961-001-01-6	Broad Institute of MIT and Harvard	BRD-K71216961			COCc1cn(CC[C@H]2CC[C@H](NC(=O)c3ccncc3)[C@H](CO)O2)nn1	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16+,17+/m1/s1	FBXATGIHHFZDOF-IKGGRYGDSA-N	375.19065433							120308
BRD-K28247259	LSM-31752		54640500	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18-,21+/m0/s1	BPRQWUDNJJKTKY-BBTUJRGHSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K28247259	BRD-K28247259-001-01-6	Broad Institute of MIT and Harvard	BRD-K28247259			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18-,21+/m0/s1	BPRQWUDNJJKTKY-BBTUJRGHSA-N	473.135363228							120309
BRD-K04968881	LSM-31753		54640517	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20-/m0/s1	NQVHKOMHSOOYQX-FFGOWVMKSA-N	C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K04968881	BRD-K04968881-001-01-1	Broad Institute of MIT and Harvard	BRD-K04968881			C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20-/m0/s1	NQVHKOMHSOOYQX-FFGOWVMKSA-N	417.226371122							120310
BRD-K48717228	LSM-31754		54640478	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18+,20-/m1/s1	KWVYROQUXUCXNL-IMFGXOCKSA-N	COc1cccc(c1)c2cn(CC[C@H]3CC[C@H](NC(=O)CN(C)C)[C@@H](CO)O3)nn2	BroadT	BRD-K48717228	BRD-K48717228-001-01-2	Broad Institute of MIT and Harvard	BRD-K48717228			COc1cccc(c1)-c1cn(CC[C@H]2CC[C@H](NC(=O)CN(C)C)[C@@H](CO)O2)nn1	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18+,20-/m1/s1	KWVYROQUXUCXNL-IMFGXOCKSA-N	417.237604522							120311
BRD-K39715006	LSM-31755		54640484	InChI=1S/C18H20FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-3,6-8,13-15,23H,4-5,9-10H2,(H,21,25)(H,20,22,24)/t13-,14+,15+/m1/s1	UAJBNBJNFNTHPJ-ILXRZTDVSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K39715006	BRD-K39715006-001-01-5	Broad Institute of MIT and Harvard	BRD-K39715006			OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H20FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-3,6-8,13-15,23H,4-5,9-10H2,(H,21,25)(H,20,22,24)/t13-,14+,15+/m1/s1	UAJBNBJNFNTHPJ-ILXRZTDVSA-N	393.11585504							120312
BRD-K60483981	LSM-31756		54640660	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20+,21+/m0/s1	NLJLXKOEVYKMMF-CEWLAPEOSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2	BroadT	BRD-K60483981	BRD-K60483981-001-01-1	Broad Institute of MIT and Harvard	BRD-K60483981			Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)c2cccc(F)c2)[C@@H](CO)O1	InChI=1S/C22H27FN2O5S/c1-15-5-8-19(9-6-15)31(28,29)24-12-11-18-7-10-20(21(14-26)30-18)25-22(27)16-3-2-4-17(23)13-16/h2-6,8-9,13,18,20-21,24,26H,7,10-12,14H2,1H3,(H,25,27)/t18-,20+,21+/m0/s1	NLJLXKOEVYKMMF-CEWLAPEOSA-N	450.162470874							120313
BRD-K73275626	LSM-31757		54640433	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17+,18-/m1/s1	CLBFLRMDTNZFIM-FGTMMUONSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Cc3ccccc3	BroadT	BRD-K73275626	BRD-K73275626-001-01-7	Broad Institute of MIT and Harvard	BRD-K73275626			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)Cc1ccccc1	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17+,18-/m1/s1	CLBFLRMDTNZFIM-FGTMMUONSA-N	376.199822016							120314
BRD-K34335352	LSM-31758		54640604	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16+,17-/m0/s1	FBXATGIHHFZDOF-BBWFWOEESA-N	COCc1cn(CC[C@@H]2CC[C@@H](NC(=O)c3ccncc3)[C@H](CO)O2)nn1	BroadT	BRD-K34335352	BRD-K34335352-001-01-7	Broad Institute of MIT and Harvard	BRD-K34335352			COCc1cn(CC[C@@H]2CC[C@@H](NC(=O)c3ccncc3)[C@H](CO)O2)nn1	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16+,17-/m0/s1	FBXATGIHHFZDOF-BBWFWOEESA-N	375.19065433							120315
BRD-K22071228	LSM-31759		54640547	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19-/m1/s1	PHXITHQOKRDDQC-UTRMSSBJSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K22071228	BRD-K22071228-001-01-4	Broad Institute of MIT and Harvard	BRD-K22071228			C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19-/m1/s1	PHXITHQOKRDDQC-UTRMSSBJSA-N	374.22055746							120316
BRD-K06203116	LSM-31760		54640456	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20+/m0/s1	OPJMBNVAUHUOES-SLFFLAALSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K06203116	BRD-K06203116-001-01-8	Broad Institute of MIT and Harvard	BRD-K06203116			OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20+/m0/s1	OPJMBNVAUHUOES-SLFFLAALSA-N	410.195405352							120317
CHEMBL2134923	LSM-31761	SID131436917, BRD-K90324820	54640608	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19-,21+/m1/s1	JEWVOUSHTDFCPR-QFUCXCTJSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3ccccn3)CC[C@H]1NC(=O)c4ccc(F)cc4	BroadT	BRD-K90324820	BRD-K90324820-001-01-6	Broad Institute of MIT and Harvard	BRD-K90324820			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2ccccn2)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19-,21+/m1/s1	JEWVOUSHTDFCPR-QFUCXCTJSA-N	425.186317878							120318
BRD-K02246294	LSM-31762		54640583	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17+,19-/m1/s1	IVGXTVZUVQFGHY-ZIFCJYIRSA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)c3ccc(F)cc3)O[C@@H]1CO	BroadT	BRD-K02246294	BRD-K02246294-001-01-5	Broad Institute of MIT and Harvard	BRD-K02246294			CC(C)NC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17+,19-/m1/s1	IVGXTVZUVQFGHY-ZIFCJYIRSA-N	405.217618006							120319
BRD-K03421365	LSM-31763		54640655	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14-,15-/m0/s1	QXJDCVBLBQBSAR-QEJZJMRPSA-N	COC(=O)C[C@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	BroadT	BRD-K03421365	BRD-K03421365-001-01-7	Broad Institute of MIT and Harvard	BRD-K03421365			COC(=O)C[C@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14-,15-/m0/s1	QXJDCVBLBQBSAR-QEJZJMRPSA-N	371.103872712							120320
BRD-K43495666	LSM-31764		54640481	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18-,20+/m0/s1	KWVYROQUXUCXNL-XKGZKEIXSA-N	COc1cccc(c1)c2cn(CC[C@@H]3CC[C@H](NC(=O)CN(C)C)[C@@H](CO)O3)nn2	BroadT	BRD-K43495666	BRD-K43495666-001-01-9	Broad Institute of MIT and Harvard	BRD-K43495666			COc1cccc(c1)-c1cn(CC[C@@H]2CC[C@H](NC(=O)CN(C)C)[C@@H](CO)O2)nn1	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18-,20+/m0/s1	KWVYROQUXUCXNL-XKGZKEIXSA-N	417.237604522							120321
CHEMBL2361226	LSM-31765	BRD-K94489270, SID131436817	54640510	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20-/m0/s1	NQVHKOMHSOOYQX-LEAZDLGRSA-N	C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K94489270	BRD-K94489270-001-01-8	Broad Institute of MIT and Harvard	BRD-K94489270			C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19-,20-/m0/s1	NQVHKOMHSOOYQX-LEAZDLGRSA-N	417.226371122							120322
BRD-K30433551	LSM-31766		54640675	InChI=1S/C19H31N3O5S/c1-14(2)21-19(24)22-17-9-8-16(27-18(17)12-23)10-11-20-28(25,26)13-15-6-4-3-5-7-15/h3-7,14,16-18,20,23H,8-13H2,1-2H3,(H2,21,22,24)/t16-,17-,18-/m1/s1	WDDVSYGCEMHEAU-KZNAEPCWSA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CCNS(=O)(=O)Cc2ccccc2)O[C@@H]1CO	BroadT	BRD-K30433551	BRD-K30433551-001-01-3	Broad Institute of MIT and Harvard	BRD-K30433551			CC(C)NC(=O)N[C@@H]1CC[C@H](CCNS(=O)(=O)Cc2ccccc2)O[C@@H]1CO	InChI=1S/C19H31N3O5S/c1-14(2)21-19(24)22-17-9-8-16(27-18(17)12-23)10-11-20-28(25,26)13-15-6-4-3-5-7-15/h3-7,14,16-18,20,23H,8-13H2,1-2H3,(H2,21,22,24)/t16-,17-,18-/m1/s1	WDDVSYGCEMHEAU-KZNAEPCWSA-N	413.198441812							120323
BRD-K50146114	LSM-31767		54640432	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17-,18+/m1/s1	CLBFLRMDTNZFIM-KURKYZTESA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Cc3ccccc3	BroadT	BRD-K50146114	BRD-K50146114-001-01-6	Broad Institute of MIT and Harvard	BRD-K50146114			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Cc1ccccc1	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17-,18+/m1/s1	CLBFLRMDTNZFIM-KURKYZTESA-N	376.199822016							120324
BRD-K49159670	LSM-31768		54640596	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17+,18-/m0/s1	LEANCKNBHBEQEG-KSZLIROESA-N	Cc1onc(C)c1NC(=O)NCC[C@@H]2CC[C@@H](NC(=O)Nc3cccc(Cl)c3)[C@H](CO)O2	BroadT	BRD-K49159670	BRD-K49159670-001-01-9	Broad Institute of MIT and Harvard	BRD-K49159670			Cc1noc(C)c1NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)Nc2cccc(Cl)c2)[C@H](CO)O1	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17+,18-/m0/s1	LEANCKNBHBEQEG-KSZLIROESA-N	465.177896756							120325
MLS003649989	LSM-31769	BRD-K83475223	53382652	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20+/m0/s1	NQVHKOMHSOOYQX-IJXRJRJASA-N	C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K83475223	BRD-K83475223-001-01-8	Broad Institute of MIT and Harvard	BRD-K83475223			C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18-,19+,20+/m0/s1	NQVHKOMHSOOYQX-IJXRJRJASA-N	417.226371122							120326
BRD-K73402542	LSM-31770		54640641	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14+,15-/m1/s1	PYHXZAPBOUOXMO-QLFBSQMISA-N	COCCNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)NC2CCCC2)C=C1	BroadT	BRD-K73402542	BRD-K73402542-001-01-8	Broad Institute of MIT and Harvard	BRD-K73402542			COCCNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)NC2CCCC2)C=C1	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14+,15-/m1/s1	PYHXZAPBOUOXMO-QLFBSQMISA-N	355.210721058							120327
BRD-K00744507	LSM-31771		54640669	InChI=1S/C28H37N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-12,24-26,32H,2,5-6,13-20H2,(H,29,34)(H,30,33)/t24-,25+,26+/m1/s1	OVKJLPKMZNQLNH-ZNZIZOMTSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K00744507	BRD-K00744507-001-01-4	Broad Institute of MIT and Harvard	BRD-K00744507			OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H37N3O4/c32-20-26-25(30-27(33)15-18-31-16-5-2-6-17-31)14-13-24(35-26)19-28(34)29-23-11-9-22(10-12-23)21-7-3-1-4-8-21/h1,3-4,7-12,24-26,32H,2,5-6,13-20H2,(H,29,34)(H,30,33)/t24-,25+,26+/m1/s1	OVKJLPKMZNQLNH-ZNZIZOMTSA-N	479.278406694							120328
BRD-K76829357	LSM-31772		54640630	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13-/m0/s1	BUQXSKBONOCLOA-AVGNSLFASA-N	OC[C@@H]1O[C@H](CC(=O)O)CC[C@@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K76829357	BRD-K76829357-001-01-3	Broad Institute of MIT and Harvard	BRD-K76829357			OC[C@@H]1O[C@@H](CC[C@@H]1NC(=O)Nc1ccccc1)CC(O)=O	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12-,13-/m0/s1	BUQXSKBONOCLOA-AVGNSLFASA-N	308.13722176							120329
BRD-K83547183	LSM-31773		54640543	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18+,19+/m1/s1	PHXITHQOKRDDQC-OAOYMFHYSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)C2CCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K83547183	BRD-K83547183-001-01-2	Broad Institute of MIT and Harvard	BRD-K83547183			C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)C2CCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18+,19+/m1/s1	PHXITHQOKRDDQC-OAOYMFHYSA-N	374.22055746							120330
BRD-K88362336	LSM-31774		54640458	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20-/m1/s1	OPJMBNVAUHUOES-HSALFYBXSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K88362336	BRD-K88362336-001-01-7	Broad Institute of MIT and Harvard	BRD-K88362336			OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20-/m1/s1	OPJMBNVAUHUOES-HSALFYBXSA-N	410.195405352							120331
BRD-K89853033	LSM-31775		54640587	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14-,16-/m0/s1	DHOFHCIZNIPSHR-DZKIICNBSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K89853033	BRD-K89853033-001-01-0	Broad Institute of MIT and Harvard	BRD-K89853033			OC[C@@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)C1CCC1	InChI=1S/C18H26N4O4/c23-11-16-14(22-17(24)12-2-1-3-12)5-4-13(26-16)6-7-21-18(25)15-10-19-8-9-20-15/h8-10,12-14,16,23H,1-7,11H2,(H,21,25)(H,22,24)/t13-,14-,16-/m0/s1	DHOFHCIZNIPSHR-DZKIICNBSA-N	362.195405352							120332
BRD-K83012560	LSM-31776		54640687	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22-/m0/s1	BCMJULRZXHZHRC-ZMUPPCTCSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K83012560	BRD-K83012560-001-01-0	Broad Institute of MIT and Harvard	BRD-K83012560			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22-/m0/s1	BCMJULRZXHZHRC-ZMUPPCTCSA-N	441.226371122							120333
BRD-K72104609	LSM-31777		54640577	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14+,15-/m0/s1	PJOLWCYMJOXMFX-CFVMTHIKSA-N	COC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(OC)cc2)[C@H](CO)O1	BroadT	BRD-K72104609	BRD-K72104609-001-01-1	Broad Institute of MIT and Harvard	BRD-K72104609			COC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(OC)cc2)[C@H](CO)O1	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14+,15-/m0/s1	PJOLWCYMJOXMFX-CFVMTHIKSA-N	373.119522776							120334
BRD-K88583132	LSM-31778		54640544	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18-,19-/m0/s1	PHXITHQOKRDDQC-VLQPXKRTSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)C2CCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K88583132	BRD-K88583132-001-01-4	Broad Institute of MIT and Harvard	BRD-K88583132			C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)C2CCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18-,19-/m0/s1	PHXITHQOKRDDQC-VLQPXKRTSA-N	374.22055746							120335
BRD-K02624294	LSM-31779		54640692	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22-/m0/s1	BCMJULRZXHZHRC-QTUQIOHYSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K02624294	BRD-K02624294-001-01-3	Broad Institute of MIT and Harvard	BRD-K02624294			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22-/m0/s1	BCMJULRZXHZHRC-QTUQIOHYSA-N	441.226371122							120336
BRD-K88559334	LSM-31780		54640512	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20-/m1/s1	NQVHKOMHSOOYQX-BTHPGYMESA-N	C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K88559334	BRD-K88559334-001-01-0	Broad Institute of MIT and Harvard	BRD-K88559334			C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19+,20-/m1/s1	NQVHKOMHSOOYQX-BTHPGYMESA-N	417.226371122							120337
CHEMBL2145153	LSM-31781	SID131436916, BRD-K14404267	54640607	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19-,21+/m0/s1	JEWVOUSHTDFCPR-HFSMHLIXSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3ccccn3)CC[C@@H]1NC(=O)c4ccc(F)cc4	BroadT	BRD-K14404267	BRD-K14404267-001-01-9	Broad Institute of MIT and Harvard	BRD-K14404267			OC[C@H]1O[C@H](CCn2cc(nn2)-c2ccccn2)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19-,21+/m0/s1	JEWVOUSHTDFCPR-HFSMHLIXSA-N	425.186317878							120338
BRD-K96663576	LSM-31782		54640505	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20-/m0/s1	NQVHKOMHSOOYQX-RNQOJCNYSA-N	C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c3ccccc3	BroadT	BRD-K96663576	BRD-K96663576-001-01-7	Broad Institute of MIT and Harvard	BRD-K96663576			C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)CN2CCOCC2)C=C1)c1ccccc1	InChI=1S/C22H31N3O5/c1-16(17-5-3-2-4-6-17)23-21(27)13-18-7-8-19(20(15-26)30-18)24-22(28)14-25-9-11-29-12-10-25/h2-8,16,18-20,26H,9-15H2,1H3,(H,23,27)(H,24,28)/t16-,18+,19-,20-/m0/s1	NQVHKOMHSOOYQX-RNQOJCNYSA-N	417.226371122							120339
BRD-K19039329	LSM-31783		54640493	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17-,18+/m0/s1	XEUNAZXFOLKMJY-JCGIZDLHSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)c2ccccc2F)C=C1	BroadT	BRD-K19039329	BRD-K19039329-001-01-4	Broad Institute of MIT and Harvard	BRD-K19039329			CN(C)CCCNC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)c2ccccc2F)C=C1	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17-,18+/m0/s1	XEUNAZXFOLKMJY-JCGIZDLHSA-N	393.206384606							120340
BRD-K63919349	LSM-31784		54640573	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14-,15-/m0/s1	PJOLWCYMJOXMFX-QEJZJMRPSA-N	COC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(OC)cc2)[C@H](CO)O1	BroadT	BRD-K63919349	BRD-K63919349-001-01-8	Broad Institute of MIT and Harvard	BRD-K63919349			COC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(OC)cc2)[C@H](CO)O1	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14-,15-/m0/s1	PJOLWCYMJOXMFX-QEJZJMRPSA-N	373.119522776							120341
BRD-K81751970	LSM-31785		54640497	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18+,21+/m0/s1	BPRQWUDNJJKTKY-WAOWUJCRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@H]1NC(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K81751970	BRD-K81751970-001-01-9	Broad Institute of MIT and Harvard	BRD-K81751970			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C=C[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C23H24ClN3O6/c24-15-3-1-14(2-4-15)11-25-22(29)10-17-6-7-18(21(12-28)33-17)27-23(30)26-16-5-8-19-20(9-16)32-13-31-19/h1-9,17-18,21,28H,10-13H2,(H,25,29)(H2,26,27,30)/t17-,18+,21+/m0/s1	BPRQWUDNJJKTKY-WAOWUJCRSA-N	473.135363228							120342
BRD-K10011427	LSM-31786		54640634	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12+,13-/m0/s1	BUQXSKBONOCLOA-XQQFMLRXSA-N	OC[C@@H]1O[C@H](CC(=O)O)CC[C@H]1NC(=O)Nc2ccccc2	BroadT	BRD-K10011427	BRD-K10011427-001-01-3	Broad Institute of MIT and Harvard	BRD-K10011427			OC[C@@H]1O[C@@H](CC[C@H]1NC(=O)Nc1ccccc1)CC(O)=O	InChI=1S/C15H20N2O5/c18-9-13-12(7-6-11(22-13)8-14(19)20)17-15(21)16-10-4-2-1-3-5-10/h1-5,11-13,18H,6-9H2,(H,19,20)(H2,16,17,21)/t11-,12+,13-/m0/s1	BUQXSKBONOCLOA-XQQFMLRXSA-N	308.13722176							120343
BRD-K09250623	LSM-31787		54640561	InChI=1S/C20H24Cl2N2O6S2/c21-14-5-8-16(9-6-14)31(26,27)23-12-11-15-7-10-18(19(13-25)30-15)24-32(28,29)20-4-2-1-3-17(20)22/h1-6,8-9,15,18-19,23-25H,7,10-13H2/t15-,18-,19-/m0/s1	QAKAPBFRRSNHFG-SNRMKQJTSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K09250623	BRD-K09250623-001-01-2	Broad Institute of MIT and Harvard	BRD-K09250623			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C20H24Cl2N2O6S2/c21-14-5-8-16(9-6-14)31(26,27)23-12-11-15-7-10-18(19(13-25)30-15)24-32(28,29)20-4-2-1-3-17(20)22/h1-6,8-9,15,18-19,23-25H,7,10-13H2/t15-,18-,19-/m0/s1	QAKAPBFRRSNHFG-SNRMKQJTSA-N	522.045283308							120344
BRD-K94062017	LSM-31788		54640449	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21-/m0/s1	KEJHSICNFQEVJK-HGWQEYRNSA-N	C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K94062017	BRD-K94062017-001-01-1	Broad Institute of MIT and Harvard	BRD-K94062017			C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20-,21-/m0/s1	KEJHSICNFQEVJK-HGWQEYRNSA-N	448.14682081							120345
BRD-K20987582	LSM-31789		54640652	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17+,18-/m0/s1	QWOFJLPZBFRYTI-QGTPRVQTSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K20987582	BRD-K20987582-001-01-3	Broad Institute of MIT and Harvard	BRD-K20987582			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17+,18-/m0/s1	QWOFJLPZBFRYTI-QGTPRVQTSA-N	393.206384606							120346
BRD-K83090041	LSM-31790		54640557	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18+,19-/m0/s1	PHXITHQOKRDDQC-FZDIXFNVSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K83090041	BRD-K83090041-001-01-5	Broad Institute of MIT and Harvard	BRD-K83090041			C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18+,19-/m0/s1	PHXITHQOKRDDQC-FZDIXFNVSA-N	374.22055746							120347
BRD-K57639176	LSM-31791		54640575	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14-,15+/m1/s1	PJOLWCYMJOXMFX-YUELXQCFSA-N	COC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(OC)cc2)[C@H](CO)O1	BroadT	BRD-K57639176	BRD-K57639176-001-01-8	Broad Institute of MIT and Harvard	BRD-K57639176			COC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(OC)cc2)[C@H](CO)O1	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14-,15+/m1/s1	PJOLWCYMJOXMFX-YUELXQCFSA-N	373.119522776							120348
BRD-K38929571	LSM-31792		54640654	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14-,15-/m1/s1	QXJDCVBLBQBSAR-BPLDGKMQSA-N	COC(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	BroadT	BRD-K38929571	BRD-K38929571-001-01-8	Broad Institute of MIT and Harvard	BRD-K38929571			COC(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccc(OC)cc2)C=C1	InChI=1S/C16H21NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-8,12,14-15,17-18H,9-10H2,1-2H3/t12-,14-,15-/m1/s1	QXJDCVBLBQBSAR-BPLDGKMQSA-N	371.103872712							120349
BRD-K46161579	LSM-31793		54640453	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20+/m1/s1	OPJMBNVAUHUOES-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K46161579	BRD-K46161579-001-01-0	Broad Institute of MIT and Harvard	BRD-K46161579			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H26N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-7,9-11,18-20,27H,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20+/m1/s1	OPJMBNVAUHUOES-AABGKKOBSA-N	410.195405352							120350
BRD-K76251351	LSM-31794		54640648	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17-,18-/m0/s1	QWOFJLPZBFRYTI-WBAXXEDZSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K76251351	BRD-K76251351-001-01-6	Broad Institute of MIT and Harvard	BRD-K76251351			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C20H28FN3O4/c21-15-6-2-3-7-16(15)22-20(27)23-17-9-8-14(28-18(17)13-25)12-19(26)24-10-4-1-5-11-24/h2-3,6-7,14,17-18,25H,1,4-5,8-13H2,(H2,22,23,27)/t14-,17-,18-/m0/s1	QWOFJLPZBFRYTI-WBAXXEDZSA-N	393.206384606							120351
CHEMBL2140857	LSM-31795	BRD-K56309946, SID131436920	54640611	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19+,21-/m0/s1	JEWVOUSHTDFCPR-DSKINZAPSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3ccccn3)CC[C@H]1NC(=O)c4ccc(F)cc4	BroadT	BRD-K56309946	BRD-K56309946-001-01-8	Broad Institute of MIT and Harvard	BRD-K56309946			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2ccccn2)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN5O3/c23-16-6-4-15(5-7-16)22(30)25-19-9-8-17(31-21(19)14-29)10-12-28-13-20(26-27-28)18-3-1-2-11-24-18/h1-7,11,13,17,19,21,29H,8-10,12,14H2,(H,25,30)/t17-,19+,21-/m0/s1	JEWVOUSHTDFCPR-DSKINZAPSA-N	425.186317878							120352
BRD-K87343552	LSM-31796		54640637	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14-,15-/m1/s1	PYHXZAPBOUOXMO-RBSFLKMASA-N	COCCNC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)NC2CCCC2)C=C1	BroadT	BRD-K87343552	BRD-K87343552-001-01-5	Broad Institute of MIT and Harvard	BRD-K87343552			COCCNC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)NC2CCCC2)C=C1	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14-,15-/m1/s1	PYHXZAPBOUOXMO-RBSFLKMASA-N	355.210721058							120353
BRD-K75067815	LSM-31797		54640476	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18+,20+/m1/s1	KWVYROQUXUCXNL-KPFFTGBYSA-N	COc1cccc(c1)c2cn(CC[C@H]3CC[C@H](NC(=O)CN(C)C)[C@H](CO)O3)nn2	BroadT	BRD-K75067815	BRD-K75067815-001-01-7	Broad Institute of MIT and Harvard	BRD-K75067815			COc1cccc(c1)-c1cn(CC[C@H]2CC[C@H](NC(=O)CN(C)C)[C@H](CO)O2)nn1	InChI=1S/C21H31N5O4/c1-25(2)13-21(28)22-18-8-7-16(30-20(18)14-27)9-10-26-12-19(23-24-26)15-5-4-6-17(11-15)29-3/h4-6,11-12,16,18,20,27H,7-10,13-14H2,1-3H3,(H,22,28)/t16-,18+,20+/m1/s1	KWVYROQUXUCXNL-KPFFTGBYSA-N	417.237604522							120354
BRD-K66207462	LSM-31798		54640492	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17-,18-/m0/s1	XEUNAZXFOLKMJY-WBAXXEDZSA-N	CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)c2ccccc2F)C=C1	BroadT	BRD-K66207462	BRD-K66207462-001-01-6	Broad Institute of MIT and Harvard	BRD-K66207462			CN(C)CCCNC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)c2ccccc2F)C=C1	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17-,18-/m0/s1	XEUNAZXFOLKMJY-WBAXXEDZSA-N	393.206384606							120355
BRD-K92812209	LSM-31799		54640559	InChI=1S/C20H24Cl2N2O6S2/c21-14-5-8-16(9-6-14)31(26,27)23-12-11-15-7-10-18(19(13-25)30-15)24-32(28,29)20-4-2-1-3-17(20)22/h1-6,8-9,15,18-19,23-25H,7,10-13H2/t15-,18+,19+/m1/s1	QAKAPBFRRSNHFG-MNEFBYGVSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K92812209	BRD-K92812209-001-01-9	Broad Institute of MIT and Harvard	BRD-K92812209			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C20H24Cl2N2O6S2/c21-14-5-8-16(9-6-14)31(26,27)23-12-11-15-7-10-18(19(13-25)30-15)24-32(28,29)20-4-2-1-3-17(20)22/h1-6,8-9,15,18-19,23-25H,7,10-13H2/t15-,18+,19+/m1/s1	QAKAPBFRRSNHFG-MNEFBYGVSA-N	522.045283308							120356
BRD-K72934042	LSM-31800		54640569	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22-,23+/m1/s1	MGIGDAYWWJNGIV-ZLNRFVROSA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@H]1CO	BroadT	BRD-K72934042	BRD-K72934042-001-01-6	Broad Institute of MIT and Harvard	BRD-K72934042			CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@H]1CO	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22-,23+/m1/s1	MGIGDAYWWJNGIV-ZLNRFVROSA-N	455.242021186							120357
BRD-K38403252	LSM-31801		54640731	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20-,21+/m0/s1	QXXUXEAVRGHKMM-PCCBWWKXSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K38403252	BRD-K38403252-001-01-0	Broad Institute of MIT and Harvard	BRD-K38403252			OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H33Cl2N3O4/c24-17-12-16(13-18(25)14-17)23(31)26-8-6-19-4-5-20(21(15-29)32-19)27-22(30)7-11-28-9-2-1-3-10-28/h12-14,19-21,29H,1-11,15H2,(H,26,31)(H,27,30)/t19-,20-,21+/m0/s1	QXXUXEAVRGHKMM-PCCBWWKXSA-N	485.184811986							120358
BRD-K36730085	LSM-31802		54640639	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14-,15+/m0/s1	PYHXZAPBOUOXMO-SOUVJXGZSA-N	COCCNC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)NC2CCCC2)C=C1	BroadT	BRD-K36730085	BRD-K36730085-001-01-1	Broad Institute of MIT and Harvard	BRD-K36730085			COCCNC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)NC2CCCC2)C=C1	InChI=1S/C17H29N3O5/c1-24-9-8-18-16(22)10-13-6-7-14(15(11-21)25-13)20-17(23)19-12-4-2-3-5-12/h6-7,12-15,21H,2-5,8-11H2,1H3,(H,18,22)(H2,19,20,23)/t13-,14-,15+/m0/s1	PYHXZAPBOUOXMO-SOUVJXGZSA-N	355.210721058							120359
BRD-K89333198	LSM-31803		54640594	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17-,18+/m0/s1	LEANCKNBHBEQEG-OKZBNKHCSA-N	Cc1onc(C)c1NC(=O)NCC[C@@H]2CC[C@H](NC(=O)Nc3cccc(Cl)c3)[C@@H](CO)O2	BroadT	BRD-K89333198	BRD-K89333198-001-01-4	Broad Institute of MIT and Harvard	BRD-K89333198			Cc1noc(C)c1NC(=O)NCC[C@@H]1CC[C@H](NC(=O)Nc2cccc(Cl)c2)[C@@H](CO)O1	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17-,18+/m0/s1	LEANCKNBHBEQEG-OKZBNKHCSA-N	465.177896756							120360
BRD-K70735803	LSM-31804		54640490	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18+/m1/s1	XEUNAZXFOLKMJY-JLSDUUJJSA-N	CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)c2ccccc2F)C=C1	BroadT	BRD-K70735803	BRD-K70735803-001-01-8	Broad Institute of MIT and Harvard	BRD-K70735803			CN(C)CCCNC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)c2ccccc2F)C=C1	InChI=1S/C20H28FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-9,14,17-18,25H,5,10-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18+/m1/s1	XEUNAZXFOLKMJY-JLSDUUJJSA-N	393.206384606							120361
BRD-K14795621	LSM-31805		54640719	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16-,18-/m1/s1	NKWQDAXEZMPWOL-MZMPZRCHSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K14795621	BRD-K14795621-001-01-1	Broad Institute of MIT and Harvard	BRD-K14795621			OC[C@H]1O[C@@H](CCNC(=O)c2ccccc2F)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16-,18-/m1/s1	NKWQDAXEZMPWOL-MZMPZRCHSA-N	402.170333456							120362
BRD-K81623965	LSM-31806		54640571	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14+,15+/m1/s1	PJOLWCYMJOXMFX-SNPRPXQTSA-N	COC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccc(OC)cc2)[C@H](CO)O1	BroadT	BRD-K81623965	BRD-K81623965-001-01-7	Broad Institute of MIT and Harvard	BRD-K81623965			COC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccc(OC)cc2)[C@H](CO)O1	InChI=1S/C16H23NO7S/c1-22-11-3-6-13(7-4-11)25(20,21)17-14-8-5-12(9-16(19)23-2)24-15(14)10-18/h3-4,6-7,12,14-15,17-18H,5,8-10H2,1-2H3/t12-,14+,15+/m1/s1	PJOLWCYMJOXMFX-SNPRPXQTSA-N	373.119522776							120363
BRD-K30214445	LSM-31807		54640537	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16-,17-/m0/s1	BVKYPNZNGBYIEE-ULQDDVLXSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K30214445	BRD-K30214445-001-01-7	Broad Institute of MIT and Harvard	BRD-K30214445			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16-,17-/m0/s1	BVKYPNZNGBYIEE-ULQDDVLXSA-N	380.17475012							120364
BRD-K67670670	LSM-31808		54640735	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15-,16-/m1/s1	KYVBJMXDLCPPRO-BZUAXINKSA-N	CCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@@H]1CO	BroadT	BRD-K67670670	BRD-K67670670-001-01-2	Broad Institute of MIT and Harvard	BRD-K67670670			CCC(=O)N[C@@H]1C=C[C@@H](O[C@@H]1CO)CC(=O)NCc1cc(F)cc(F)c1	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15-,16-/m1/s1	KYVBJMXDLCPPRO-BZUAXINKSA-N	368.154763604							120365
BRD-K98095706	LSM-31809		54640682	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22-/m0/s1	BCMJULRZXHZHRC-UZSDIVCKSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K98095706	BRD-K98095706-001-01-3	Broad Institute of MIT and Harvard	BRD-K98095706			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H31N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-11,16,18,20,22,28H,12-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22-/m0/s1	BCMJULRZXHZHRC-UZSDIVCKSA-N	441.226371122							120366
BRD-K26108750	LSM-31810		54640710	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16+,18+/m1/s1	YRYFLIZLJGNRPZ-RYRKJORJSA-N	CCCNC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)C3CCCC3)O[C@H]1CO	BroadT	BRD-K26108750	BRD-K26108750-001-01-6	Broad Institute of MIT and Harvard	BRD-K26108750			CCCNC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)C2CCCC2)O[C@H]1CO	InChI=1S/C19H33N5O3/c1-2-10-20-19(26)21-16-8-7-15(27-18(16)13-25)9-11-24-12-17(22-23-24)14-5-3-4-6-14/h12,14-16,18,25H,2-11,13H2,1H3,(H2,20,21,26)/t15-,16+,18+/m1/s1	YRYFLIZLJGNRPZ-RYRKJORJSA-N	379.258339966							120367
BRD-K94411351	LSM-31811		54640536	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16-,17-/m1/s1	BVKYPNZNGBYIEE-BRWVUGGUSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K94411351	BRD-K94411351-001-01-4	Broad Institute of MIT and Harvard	BRD-K94411351			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16-,17-/m1/s1	BVKYPNZNGBYIEE-BRWVUGGUSA-N	380.17475012							120368
BRD-K88000297	LSM-31812		54640700	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20+,21-/m0/s1	YKQIDJUJSSSEIT-HBMCJLEFSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@H]2CO)cc1	BroadT	BRD-K88000297	BRD-K88000297-001-01-0	Broad Institute of MIT and Harvard	BRD-K88000297			COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@H]2CO)cc1	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20+,21-/m0/s1	YKQIDJUJSSSEIT-HBMCJLEFSA-N	495.132776414							120369
BRD-K30310320	LSM-31813		54640527	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20+,21+/m1/s1	DVYXTDYPIFUIBC-HKBOAZHASA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)cc1	BroadT	BRD-K30310320	BRD-K30310320-001-01-3	Broad Institute of MIT and Harvard	BRD-K30310320			COc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@H](CO)O2)cc1	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20+,21+/m1/s1	DVYXTDYPIFUIBC-HKBOAZHASA-N	430.190400184							120370
BRD-K45013233	LSM-31814		54640566	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22-,23-/m1/s1	MGIGDAYWWJNGIV-DNVJHFABSA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@@H]1CO	BroadT	BRD-K45013233	BRD-K45013233-001-01-2	Broad Institute of MIT and Harvard	BRD-K45013233			CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)O[C@@H]1CO	InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22-,23-/m1/s1	MGIGDAYWWJNGIV-DNVJHFABSA-N	455.242021186							120371
BRD-K56536691	LSM-31815		54640539	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16-,17+/m0/s1	BVKYPNZNGBYIEE-YESZJQIVSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K56536691	BRD-K56536691-001-01-3	Broad Institute of MIT and Harvard	BRD-K56536691			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)CC[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16-,17+/m0/s1	BVKYPNZNGBYIEE-YESZJQIVSA-N	380.17475012							120372
BRD-K35404627	LSM-31816		54640442	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21+/m0/s1	KEJHSICNFQEVJK-GDVKCFTOSA-N	C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K35404627	BRD-K35404627-001-01-9	Broad Institute of MIT and Harvard	BRD-K35404627			C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18-,20+,21+/m0/s1	KEJHSICNFQEVJK-GDVKCFTOSA-N	448.14682081							120373
BRD-K37634338	LSM-31817		54640441	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23+,25-/m0/s1	VHAZZXZDVYBBQV-PWWKTKHKSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K37634338	BRD-K37634338-001-01-9	Broad Institute of MIT and Harvard	BRD-K37634338			OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C27H27F2N3O4/c28-19-8-12-22(29)24(14-19)32-27(35)31-23-13-11-21(36-25(23)16-33)15-26(34)30-20-9-6-18(7-10-20)17-4-2-1-3-5-17/h1-10,12,14,21,23,25,33H,11,13,15-16H2,(H,30,34)(H2,31,32,35)/t21-,23+,25-/m0/s1	VHAZZXZDVYBBQV-PWWKTKHKSA-N	495.196962774							120374
BRD-K11419664	LSM-31818		54640488	InChI=1S/C18H20FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-3,6-8,13-15,23H,4-5,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15+/m1/s1	UAJBNBJNFNTHPJ-KFWWJZLASA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K11419664	BRD-K11419664-001-01-9	Broad Institute of MIT and Harvard	BRD-K11419664			OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H20FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-3,6-8,13-15,23H,4-5,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15+/m1/s1	UAJBNBJNFNTHPJ-KFWWJZLASA-N	393.11585504							120375
BRD-K77519898	LSM-31819		54640538	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16-,17+/m1/s1	BVKYPNZNGBYIEE-ZACQAIPSSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K77519898	BRD-K77519898-001-01-5	Broad Institute of MIT and Harvard	BRD-K77519898			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C19H25FN2O5/c20-14-3-1-2-13(10-14)19(25)21-16-5-4-15(27-17(16)12-23)11-18(24)22-6-8-26-9-7-22/h1-3,10,15-17,23H,4-9,11-12H2,(H,21,25)/t15-,16-,17+/m1/s1	BVKYPNZNGBYIEE-ZACQAIPSSA-N	380.17475012							120376
BRD-K92632379	LSM-31820		54640603	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16+,17-/m1/s1	FBXATGIHHFZDOF-IXDOHACOSA-N	COCc1cn(CC[C@H]2CC[C@H](NC(=O)c3ccncc3)[C@@H](CO)O2)nn1	BroadT	BRD-K92632379	BRD-K92632379-001-01-5	Broad Institute of MIT and Harvard	BRD-K92632379			COCc1cn(CC[C@H]2CC[C@H](NC(=O)c3ccncc3)[C@@H](CO)O2)nn1	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16+,17-/m1/s1	FBXATGIHHFZDOF-IXDOHACOSA-N	375.19065433							120377
BRD-K88836117	LSM-31821		54640578	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17+,19+/m0/s1	IVGXTVZUVQFGHY-YQVWRLOYSA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)c3ccc(F)cc3)O[C@@H]1CO	BroadT	BRD-K88836117	BRD-K88836117-001-01-5	Broad Institute of MIT and Harvard	BRD-K88836117			CC(C)NC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C20H28FN5O3/c1-13(2)22-20(28)23-17-8-7-16(29-19(17)12-27)9-10-26-11-18(24-25-26)14-3-5-15(21)6-4-14/h3-6,11,13,16-17,19,27H,7-10,12H2,1-2H3,(H2,22,23,28)/t16-,17+,19+/m0/s1	IVGXTVZUVQFGHY-YQVWRLOYSA-N	405.217618006							120378
BRD-K20231471	LSM-31822		54640429	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17-,18-/m1/s1	CLBFLRMDTNZFIM-KZNAEPCWSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Cc3ccccc3	BroadT	BRD-K20231471	BRD-K20231471-001-01-0	Broad Institute of MIT and Harvard	BRD-K20231471			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)CC[C@H]1NC(=O)Cc1ccccc1	InChI=1S/C20H28N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-5,16-18,23H,6-14H2,(H,21,24)/t16-,17-,18-/m1/s1	CLBFLRMDTNZFIM-KZNAEPCWSA-N	376.199822016							120379
BRD-K67011787	LSM-31823		54640542	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18-,19-/m1/s1	PHXITHQOKRDDQC-ZWQIFLOQSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K67011787	BRD-K67011787-001-01-9	Broad Institute of MIT and Harvard	BRD-K67011787			C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18-,19-/m1/s1	PHXITHQOKRDDQC-ZWQIFLOQSA-N	374.22055746							120380
BRD-K10776934	LSM-31824		54640445	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21-/m0/s1	KEJHSICNFQEVJK-MTOHEIAKSA-N	C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c3ccccc3	BroadT	BRD-K10776934	BRD-K10776934-001-01-7	Broad Institute of MIT and Harvard	BRD-K10776934			C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1)c1ccccc1	InChI=1S/C22H25FN2O5S/c1-15(16-6-3-2-4-7-16)24-22(27)13-18-10-11-20(21(14-26)30-18)25-31(28,29)19-9-5-8-17(23)12-19/h2-12,15,18,20-21,25-26H,13-14H2,1H3,(H,24,27)/t15-,18+,20-,21-/m0/s1	KEJHSICNFQEVJK-MTOHEIAKSA-N	448.14682081							120381
BRD-K54925224	LSM-31825		54640528	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20+,21+/m0/s1	DVYXTDYPIFUIBC-PWRODBHTSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)cc1	BroadT	BRD-K54925224	BRD-K54925224-001-01-6	Broad Institute of MIT and Harvard	BRD-K54925224			COc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)cc1	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20+,21+/m0/s1	DVYXTDYPIFUIBC-PWRODBHTSA-N	430.190400184							120382
BRD-K94728263	LSM-31826		54640699	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20+,21-/m1/s1	YKQIDJUJSSSEIT-QHAWAJNXSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@@H]2CO)cc1	BroadT	BRD-K94728263	BRD-K94728263-001-01-8	Broad Institute of MIT and Harvard	BRD-K94728263			COc1ccc(NC(=O)N[C@H]2CC[C@H](CCNC(=O)c3cc(Cl)cc(Cl)c3)O[C@@H]2CO)cc1	InChI=1S/C23H27Cl2N3O5/c1-32-18-4-2-17(3-5-18)27-23(31)28-20-7-6-19(33-21(20)13-29)8-9-26-22(30)14-10-15(24)12-16(25)11-14/h2-5,10-12,19-21,29H,6-9,13H2,1H3,(H,26,30)(H2,27,28,31)/t19-,20+,21-/m1/s1	YKQIDJUJSSSEIT-QHAWAJNXSA-N	495.132776414							120383
BRD-K15250089	LSM-31827		54640556	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18-,19+/m1/s1	PHXITHQOKRDDQC-FDPIWHGQSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K15250089	BRD-K15250089-001-01-1	Broad Institute of MIT and Harvard	BRD-K15250089			C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)C2CCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18-,19+/m1/s1	PHXITHQOKRDDQC-FDPIWHGQSA-N	374.22055746							120384
BRD-K43023353	LSM-31828		54640562	InChI=1S/C20H24Cl2N2O6S2/c21-14-5-8-16(9-6-14)31(26,27)23-12-11-15-7-10-18(19(13-25)30-15)24-32(28,29)20-4-2-1-3-17(20)22/h1-6,8-9,15,18-19,23-25H,7,10-13H2/t15-,18+,19-/m1/s1	QAKAPBFRRSNHFG-AYOQOUSVSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K43023353	BRD-K43023353-001-01-7	Broad Institute of MIT and Harvard	BRD-K43023353			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C20H24Cl2N2O6S2/c21-14-5-8-16(9-6-14)31(26,27)23-12-11-15-7-10-18(19(13-25)30-15)24-32(28,29)20-4-2-1-3-17(20)22/h1-6,8-9,15,18-19,23-25H,7,10-13H2/t15-,18+,19-/m1/s1	QAKAPBFRRSNHFG-AYOQOUSVSA-N	522.045283308							120385
BRD-K90649428	LSM-31829		54640558	InChI=1S/C20H24Cl2N2O6S2/c21-14-5-8-16(9-6-14)31(26,27)23-12-11-15-7-10-18(19(13-25)30-15)24-32(28,29)20-4-2-1-3-17(20)22/h1-6,8-9,15,18-19,23-25H,7,10-13H2/t15-,18+,19+/m0/s1	QAKAPBFRRSNHFG-KFKAGJAMSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K90649428	BRD-K90649428-001-01-2	Broad Institute of MIT and Harvard	BRD-K90649428			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C20H24Cl2N2O6S2/c21-14-5-8-16(9-6-14)31(26,27)23-12-11-15-7-10-18(19(13-25)30-15)24-32(28,29)20-4-2-1-3-17(20)22/h1-6,8-9,15,18-19,23-25H,7,10-13H2/t15-,18+,19+/m0/s1	QAKAPBFRRSNHFG-KFKAGJAMSA-N	522.045283308							120386
BRD-K19958830	LSM-31830		54640533	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20+,21-/m1/s1	DVYXTDYPIFUIBC-QHAWAJNXSA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)cc1	BroadT	BRD-K19958830	BRD-K19958830-001-01-7	Broad Institute of MIT and Harvard	BRD-K19958830			COc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)c3cccc(F)c3)[C@@H](CO)O2)cc1	InChI=1S/C23H27FN2O5/c1-30-18-7-5-15(6-8-18)13-25-22(28)12-19-9-10-20(21(14-27)31-19)26-23(29)16-3-2-4-17(24)11-16/h2-8,11,19-21,27H,9-10,12-14H2,1H3,(H,25,28)(H,26,29)/t19-,20+,21-/m1/s1	DVYXTDYPIFUIBC-QHAWAJNXSA-N	430.190400184							120387
BRD-K70200818	LSM-31831		54640737	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15-,16+/m0/s1	KYVBJMXDLCPPRO-HRCADAONSA-N	CCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@@H]1CO	BroadT	BRD-K70200818	BRD-K70200818-001-01-6	Broad Institute of MIT and Harvard	BRD-K70200818			CCC(=O)N[C@H]1C=C[C@H](O[C@@H]1CO)CC(=O)NCc1cc(F)cc(F)c1	InChI=1S/C18H22F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h3-7,14-16,23H,2,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15-,16+/m0/s1	KYVBJMXDLCPPRO-HRCADAONSA-N	368.154763604							120388
BRD-K23614490	LSM-31832		54640705	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20-,21+/m0/s1	RCCDRCNDPSXTFI-SESVDKBCSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NCc3ccc(F)cc3)O[C@@H]2CO	BroadT	BRD-K23614490	BRD-K23614490-001-01-1	Broad Institute of MIT and Harvard	BRD-K23614490			COc1cccc(c1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccc(F)cc2)O[C@@H]1CO	InChI=1S/C22H25FN2O6S/c1-30-17-3-2-4-19(11-17)32(28,29)25-20-10-9-18(31-21(20)14-26)12-22(27)24-13-15-5-7-16(23)8-6-15/h2-11,18,20-21,25-26H,12-14H2,1H3,(H,24,27)/t18-,20-,21+/m0/s1	RCCDRCNDPSXTFI-SESVDKBCSA-N	464.14173543							120389
BRD-K90769476	LSM-31833		54640553	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19-/m0/s1	PHXITHQOKRDDQC-PIKADFDJSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)C2CCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K90769476	BRD-K90769476-001-01-9	Broad Institute of MIT and Harvard	BRD-K90769476			C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)C2CCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19-/m0/s1	PHXITHQOKRDDQC-PIKADFDJSA-N	374.22055746							120390
BRD-K03837143	LSM-31834		54640591	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17-,18-/m1/s1	LEANCKNBHBEQEG-KZNAEPCWSA-N	Cc1onc(C)c1NC(=O)NCC[C@H]2CC[C@@H](NC(=O)Nc3cccc(Cl)c3)[C@@H](CO)O2	BroadT	BRD-K03837143	BRD-K03837143-001-01-3	Broad Institute of MIT and Harvard	BRD-K03837143			Cc1noc(C)c1NC(=O)NCC[C@H]1CC[C@@H](NC(=O)Nc2cccc(Cl)c2)[C@@H](CO)O1	InChI=1S/C21H28ClN5O5/c1-12-19(13(2)32-27-12)26-20(29)23-9-8-16-6-7-17(18(11-28)31-16)25-21(30)24-15-5-3-4-14(22)10-15/h3-5,10,16-18,28H,6-9,11H2,1-2H3,(H2,23,26,29)(H2,24,25,30)/t16-,17-,18-/m1/s1	LEANCKNBHBEQEG-KZNAEPCWSA-N	465.177896756							120391
BRD-K48299239	LSM-31835		54640549	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19-/m0/s1	PHXITHQOKRDDQC-QZHFEQFPSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)C2CCC2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K48299239	BRD-K48299239-001-01-8	Broad Institute of MIT and Harvard	BRD-K48299239			C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)C2CCC2)[C@H](CO)O1)c1ccccc1	InChI=1S/C21H30N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,14,16-19,24H,5,8-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19-/m0/s1	PHXITHQOKRDDQC-QZHFEQFPSA-N	374.22055746							120392
BRD-K08406395	LSM-31836		54640600	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16-,17-/m1/s1	FBXATGIHHFZDOF-BRWVUGGUSA-N	COCc1cn(CC[C@H]2CC[C@@H](NC(=O)c3ccncc3)[C@@H](CO)O2)nn1	BroadT	BRD-K08406395	BRD-K08406395-001-01-7	Broad Institute of MIT and Harvard	BRD-K08406395			COCc1cn(CC[C@H]2CC[C@@H](NC(=O)c3ccncc3)[C@@H](CO)O2)nn1	InChI=1S/C18H25N5O4/c1-26-12-14-10-23(22-21-14)9-6-15-2-3-16(17(11-24)27-15)20-18(25)13-4-7-19-8-5-13/h4-5,7-8,10,15-17,24H,2-3,6,9,11-12H2,1H3,(H,20,25)/t15-,16-,17-/m1/s1	FBXATGIHHFZDOF-BRWVUGGUSA-N	375.19065433							120393
SMR000107960	LSM-31837	BRD-K11437379, SID7973058	2294458	InChI=1S/C18H16N2O2S2/c21-17(16-6-3-11-24-16)20-12-14(13-4-1-2-5-15(13)20)18(23)19-7-9-22-10-8-19/h1-6,11-12H,7-10H2	HPWUCFWGBAPCKY-UHFFFAOYSA-N	O=C(c1cccs1)n2cc(C(=S)N3CCOCC3)c4ccccc24	BroadT	BRD-K11437379	BRD-K11437379-001-05-8	Asinex Ltd.	BAS 04201320			O=C(c1cccs1)n1cc(C(=S)N2CCOCC2)c2ccccc12	InChI=1S/C18H16N2O2S2/c21-17(16-6-3-11-24-16)20-12-14(13-4-1-2-5-15(13)20)18(23)19-7-9-22-10-8-19/h1-6,11-12H,7-10H2	HPWUCFWGBAPCKY-UHFFFAOYSA-N	356.065319152							120394
MLS000334300	LSM-31838	BRD-K57251296, SID22402960	2514149	InChI=1S/C18H15N3O3/c1-12(22)13-6-2-3-7-14(13)20-17(23)11-21-16-9-5-4-8-15(16)19-10-18(21)24/h2-10H,11H2,1H3,(H,20,23)	UCTDQEXXVKXCRS-UHFFFAOYSA-N	CC(=O)c1ccccc1NC(=O)CN2C(=O)C=Nc3ccccc23	BroadT	BRD-K57251296	BRD-K57251296-001-05-8	Enamine Ltd.	T5291212			CC(=O)c1ccccc1NC(=O)Cn1c2ccccc2ncc1=O	InChI=1S/C18H15N3O3/c1-12(22)13-6-2-3-7-14(13)20-17(23)11-21-16-9-5-4-8-15(16)19-10-18(21)24/h2-10H,11H2,1H3,(H,20,23)	UCTDQEXXVKXCRS-UHFFFAOYSA-N	321.11134137							120395
SMR000032252	LSM-31839	BRD-K04443775, SID4250824	3244583	InChI=1S/C17H33N3O3S/c1-2-24(22,23)20-14-8-16(9-15-20)17(21)18-10-7-13-19-11-5-3-4-6-12-19/h16H,2-15H2,1H3,(H,18,21)	GTUGDLCELKWUBX-UHFFFAOYSA-N	CCS(=O)(=O)N1CCC(CC1)C(=O)NCCCN2CCCCCC2	BroadT	BRD-K04443775	BRD-K04443775-001-05-5	ChemDiv Inc.	K786-6537			CCS(=O)(=O)N1CCC(CC1)C(=O)NCCCN1CCCCCC1	InChI=1S/C17H33N3O3S/c1-2-24(22,23)20-14-8-16(9-15-20)17(21)18-10-7-13-19-11-5-3-4-6-12-19/h16H,2-15H2,1H3,(H,18,21)	GTUGDLCELKWUBX-UHFFFAOYSA-N	359.224262636							120396
MLS000717972	LSM-31840	BRD-K19516614, SID24780495	788501	InChI=1S/C17H19NO2/c1-3-20-16-10-8-15(9-11-16)18-12-17(19)14-6-4-13(2)5-7-14/h4-11,18H,3,12H2,1-2H3	DKRCRVBNRGEYMS-UHFFFAOYSA-N	CCOc1ccc(NCC(=O)c2ccc(C)cc2)cc1	BroadT	BRD-K19516614	BRD-K19516614-001-07-2	Asinex Ltd.	BAS 02079137			CCOc1ccc(NCC(=O)c2ccc(C)cc2)cc1	InChI=1S/C17H19NO2/c1-3-20-16-10-8-15(9-11-16)18-12-17(19)14-6-4-13(2)5-7-14/h4-11,18H,3,12H2,1-2H3	DKRCRVBNRGEYMS-UHFFFAOYSA-N	269.141578858							120397
AC1N3VZP	LSM-31841	BRD-K94058780, SID24824014	4071396	InChI=1S/C14H14N6O2S2/c1-20-8-15-19-14(20)23-7-11(21)16-13-18-17-12(24-13)9-5-3-4-6-10(9)22-2/h3-6,8H,7H2,1-2H3,(H,16,18,21)	NBTQRWHHIAHWGI-UHFFFAOYSA-N	COc1ccccc1c2nnc(NC(=O)CSc3nncn3C)s2	BroadT	BRD-K94058780	BRD-K94058780-001-05-5	Life Chemicals Inc.	F0748-0117			COc1ccccc1-c1nnc(NC(=O)CSc2nncn2C)s1	InChI=1S/C14H14N6O2S2/c1-20-8-15-19-14(20)23-7-11(21)16-13-18-17-12(24-13)9-5-3-4-6-10(9)22-2/h3-6,8H,7H2,1-2H3,(H,16,18,21)	NBTQRWHHIAHWGI-UHFFFAOYSA-N	362.061965128							120398
ZINC02858940	LSM-31842	BRD-K89719122, SID17433723	2212288	InChI=1S/C23H19N5O4/c1-32-20-13-7-16(8-14-20)15-24-23-25-21(17-5-3-2-4-6-17)26-27(23)22(29)18-9-11-19(12-10-18)28(30)31/h2-14H,15H2,1H3,(H,24,25,26)	NVXZUKLFCQXBAS-UHFFFAOYSA-N	COc1ccc(CNc2nc(nn2C(=O)c3ccc(cc3)[N+](=O)[O-])c4ccccc4)cc1	BroadT	BRD-K89719122	BRD-K89719122-001-05-6	ChemBridge Corporation	7841687			COc1ccc(CNc2nc(nn2C(=O)c2ccc(cc2)[N+]([O-])=O)-c2ccccc2)cc1	InChI=1S/C23H19N5O4/c1-32-20-13-7-16(8-14-20)15-24-23-25-21(17-5-3-2-4-6-17)26-27(23)22(29)18-9-11-19(12-10-18)28(30)31/h2-14H,15H2,1H3,(H,24,25,26)	NVXZUKLFCQXBAS-UHFFFAOYSA-N	429.143704138							120399
SMR000071260	LSM-31843	BRD-K15378071, SID125240927, SID4258270, SID87340569	1094286	InChI=1S/C21H17N3O3/c1-14-4-10-17(11-5-14)26-13-19(25)23-16-8-6-15(7-9-16)21-24-20-18(27-21)3-2-12-22-20/h2-12H,13H2,1H3,(H,23,25)	PZSJAZISEBOWAH-UHFFFAOYSA-N	Cc1ccc(OCC(=O)Nc2ccc(cc2)c3oc4cccnc4n3)cc1	BroadT	BRD-K15378071	BRD-K15378071-001-06-9	ChemBridge Corporation	6708781			Cc1ccc(OCC(=O)Nc2ccc(cc2)-c2oc3cccnc3n2)cc1	InChI=1S/C21H17N3O3/c1-14-4-10-17(11-5-14)26-13-19(25)23-16-8-6-15(7-9-16)21-24-20-18(27-21)3-2-12-22-20/h2-12H,13H2,1H3,(H,23,25)	PZSJAZISEBOWAH-UHFFFAOYSA-N	359.126991434							120400
1-(2-Fluoro-benzyl)-1H-pyrazol-4-ylamine	LSM-31844	BRD-K18494310, SID24818005	4362222	InChI=1S/C10H10FN3/c11-10-4-2-1-3-8(10)6-14-7-9(12)5-13-14/h1-5,7H,6,12H2	MOBHPISBSWMGDW-UHFFFAOYSA-N	Nc1cnn(Cc2ccccc2F)c1	BroadT	BRD-K18494310	BRD-K18494310-001-05-4	Asinex Ltd.	BAS 07732709			Nc1cnn(Cc2ccccc2F)c1	InChI=1S/C10H10FN3/c11-10-4-2-1-3-8(10)6-14-7-9(12)5-13-14/h1-5,7H,6,12H2	MOBHPISBSWMGDW-UHFFFAOYSA-N	191.08587555							120401
STK191850	LSM-31845	BRD-K06577881, SID17414690	977742	InChI=1S/C19H22N4O2/c1-5-25-18(24)14-11-21-16-10-15(22-23(16)17(14)20)12-6-8-13(9-7-12)19(2,3)4/h6-11H,5,20H2,1-4H3	QDCFAVGZLAOJBQ-UHFFFAOYSA-N	CCOC(=O)c1cnc2cc(nn2c1N)c3ccc(cc3)C(C)(C)C	BroadT	BRD-K06577881	BRD-K06577881-001-05-9	ChemBridge Corporation	7764216			CCOC(=O)c1cnc2cc(nn2c1N)-c1ccc(cc1)C(C)(C)C	InChI=1S/C19H22N4O2/c1-5-25-18(24)14-11-21-16-10-15(22-23(16)17(14)20)12-6-8-13(9-7-12)19(2,3)4/h6-11H,5,20H2,1-4H3	QDCFAVGZLAOJBQ-UHFFFAOYSA-N	338.174275984							120402
SMR000041149	LSM-31846	BRD-K61439686, SID858950	660254	InChI=1S/C20H20N2O6/c1-25-12-7-5-6-11(8-12)19(23)22-17-13-9-15(26-2)16(27-3)10-14(13)21-18(17)20(24)28-4/h5-10,21H,1-4H3,(H,22,23)	UTDXHEHIDDGBFV-UHFFFAOYSA-N	COC(=O)c1[nH]c2cc(OC)c(OC)cc2c1NC(=O)c3cccc(OC)c3	BroadT	BRD-K61439686	BRD-K61439686-001-05-1	InterBioScreen Ltd.	STOCK2S-80015			COC(=O)c1[nH]c2cc(OC)c(OC)cc2c1NC(=O)c1cccc(OC)c1	InChI=1S/C20H20N2O6/c1-25-12-7-5-6-11(8-12)19(23)22-17-13-9-15(26-2)16(27-3)10-14(13)21-18(17)20(24)28-4/h5-10,21H,1-4H3,(H,22,23)	UTDXHEHIDDGBFV-UHFFFAOYSA-N	384.13213638							120403
ZINC03396348	LSM-44365	SID24826387, BRD-K27120020	2514823	InChI=1S/C15H14N2O3S/c1-16(11-13-6-4-10-21-13)15(18)9-8-12-5-2-3-7-14(12)17(19)20/h2-10H,11H2,1H3/b9-8+	VDAHEMUQSNIEPG-CMDGGOBGSA-N	CN(Cc1cccs1)C(=O)\C=C\c2ccccc2[N+](=O)[O-]	BroadT	BRD-K27120020	BRD-K27120020-001-05-5	Enamine Ltd.	T5291404			CN(Cc1cccs1)C(=O)\C=C\c1ccccc1[N+]([O-])=O	InChI=1S/C15H14N2O3S/c1-16(11-13-6-4-10-21-13)15(18)9-8-12-5-2-3-7-14(12)17(19)20/h2-10H,11H2,1H3/b9-8+	VDAHEMUQSNIEPG-CMDGGOBGSA-N	302.072513018							
CHEMBL592869	LSM-2828	SID85147399, BRD-K37393297, SID49665448, SID56373637, SID56405531	715454	InChI=1S/C14H14N2O3S/c1-8-5-9(2)16-14(15-8)20-7-13(19)10-3-4-11(17)12(18)6-10/h3-6,17-18H,7H2,1-2H3	JQXFBAGVXOGSNK-UHFFFAOYSA-N	Cc1cc(C)nc(SCC(=O)c2ccc(O)c(O)c2)n1	BroadT	BRD-K37393297	BRD-K37393297-001-05-2	Sanford-Burnham Medical Research Institute	1-(3,4-Dihydroxy-phenyl)-2-(4,6-dimethyl-pyrimidin-2-ylsulfanyl)-ethanone MLS-0315687			Cc1cc(C)nc(SCC(=O)c2ccc(O)c(O)c2)n1	InChI=1S/C14H14N2O3S/c1-8-5-9(2)16-14(15-8)20-7-13(19)10-3-4-11(17)12(18)6-10/h3-6,17-18H,7H2,1-2H3	JQXFBAGVXOGSNK-UHFFFAOYSA-N	290.072513018							92662
BAS 01247429	LSM-15235	BRD-K31203610	3128437	InChI=1S/C21H19N5O4S2/c1-29-19-12-18(24-20(25-19)30-2)26-32(27,28)16-10-8-15(9-11-16)22-21-23-17(13-31-21)14-6-4-3-5-7-14/h3-13H,1-2H3,(H,22,23)(H,24,25,26)	JHJYBVWCLIATGY-UHFFFAOYSA-N	COc1cc(NS(=O)(=O)c2ccc(Nc3nc(cs3)c4ccccc4)cc2)nc(OC)n1	BroadT	BRD-K31203610	BRD-K31203610-004-05-3	Asinex Ltd.	BAS 01247429		Br	COc1cc(NS(=O)(=O)c2ccc(Nc3nc(cs3)-c3ccccc3)cc2)nc(OC)n1.Br	InChI=1S/C21H19N5O4S2.BrH/c1-29-19-12-18(24-20(25-19)30-2)26-32(27,28)16-10-8-15(9-11-16)22-21-23-17(13-31-21)14-6-4-3-5-7-14;/h3-13H,1-2H3,(H,22,23)(H,24,25,26);1H	GTYBDTCZVVAXJB-UHFFFAOYSA-N	469.087845518							103882, 103882
AC1LELJK	LSM-31848	BRD-K48611791, SID4254772	714083	InChI=1S/C15H19N5O2S/c1-22-13-9-5-4-8-12(13)20-15(17-18-19-20)23-10-14(21)16-11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7,10H2,1H3,(H,16,21)	YLXOPANRFJQCMT-UHFFFAOYSA-N	COc1ccccc1n2nnnc2SCC(=O)NC3CCCC3	BroadT	BRD-K48611791	BRD-K48611791-001-06-3	ChemBridge Corporation	7695108			COc1ccccc1-n1nnnc1SCC(=O)NC1CCCC1	InChI=1S/C15H19N5O2S/c1-22-13-9-5-4-8-12(13)20-15(17-18-19-20)23-10-14(21)16-11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7,10H2,1H3,(H,16,21)	YLXOPANRFJQCMT-UHFFFAOYSA-N	333.125945588							120405
ZINC01166792	LSM-31849	BRD-K92191804, SID7976752	1333937	InChI=1S/C21H19BrN2O4/c1-13-9-14(2)20(17(22)10-13)28-12-19(25)23-15-5-3-6-16(11-15)24-21(26)18-7-4-8-27-18/h3-11H,12H2,1-2H3,(H,23,25)(H,24,26)	JUCUPCWNKKCUDA-UHFFFAOYSA-N	Cc1cc(C)c(OCC(=O)Nc2cccc(NC(=O)c3occc3)c2)c(Br)c1	BroadT	BRD-K92191804	BRD-K92191804-001-06-6	ChemBridge Corporation	6707236			Cc1cc(C)c(OCC(=O)Nc2cccc(NC(=O)c3ccco3)c2)c(Br)c1	InChI=1S/C21H19BrN2O4/c1-13-9-14(2)20(17(22)10-13)28-12-19(25)23-15-5-3-6-16(11-15)24-21(26)18-7-4-8-27-18/h3-11H,12H2,1-2H3,(H,23,25)(H,24,26)	JUCUPCWNKKCUDA-UHFFFAOYSA-N	442.052819708							120406
AC1LD914	LSM-15445	BRD-K79402882	663225	InChI=1S/C17H20N4OS/c1-11(2)7-8-23-17-21-20-16(22-17)14(18)9-12-10-19-15-6-4-3-5-13(12)15/h3-7,10,14,19H,8-9,18H2,1-2H3/t14-/m0/s1	HTPVOZDKIZGALX-AWEZNQCLSA-N	CC(=CCSc1oc(nn1)[C@@H](N)Cc2c[nH]c3ccccc23)C	BroadT	BRD-K79402882	BRD-K79402882-003-06-5	InterBioScreen Ltd.	STOCK4S-30693		Cl	CC(C)=CCSc1nnc(o1)[C@@H](N)Cc1c[nH]c2ccccc12.Cl	InChI=1S/C17H20N4OS.ClH/c1-11(2)7-8-23-17-21-20-16(22-17)14(18)9-12-10-19-15-6-4-3-5-13(12)15;/h3-7,10,14,19H,8-9,18H2,1-2H3;1H/t14-;/m0./s1	DCQGYGMCCRYWHP-UQKRIMTDSA-N	328.13578199							104087, 104087
2-{[5-(1-Benzofuran-2-yl)-4-benzyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide	LSM-31850	BRD-K03995743, SID4265555	2238230	InChI=1S/C19H16N4O2S/c20-17(24)12-26-19-22-21-18(23(19)11-13-6-2-1-3-7-13)16-10-14-8-4-5-9-15(14)25-16/h1-10H,11-12H2,(H2,20,24)	SOZUJDUYRRFOKV-UHFFFAOYSA-N	NC(=O)CSc1nnc(c2oc3ccccc3c2)n1Cc4ccccc4	BroadT	BRD-K03995743	BRD-K03995743-001-05-4	ChemBridge Corporation	7984426			NC(=O)CSc1nnc(-c2cc3ccccc3o2)n1Cc1ccccc1	InChI=1S/C19H16N4O2S/c20-17(24)12-26-19-22-21-18(23(19)11-13-6-2-1-3-7-13)16-10-14-8-4-5-9-15(14)25-16/h1-10H,11-12H2,(H2,20,24)	SOZUJDUYRRFOKV-UHFFFAOYSA-N	364.099396482							120407
6-Amino-4-methyl-3-(4-methylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile	LSM-31851	BRD-A30369394, SID22414310	3339531	InChI=1S/C15H14N4O/c1-8-3-5-10(6-4-8)13-12-9(2)11(7-16)14(17)20-15(12)19-18-13/h3-6,9H,17H2,1-2H3,(H,18,19)	RYWSKZCSEHLKHR-UHFFFAOYSA-N	CC1C(=C(N)Oc2[nH]nc(c3ccc(C)cc3)c12)C#N	BroadT	BRD-A30369394	BRD-A30369394-001-06-1	Specs	AM-807/42003322			CC1c2c(OC(N)=C1C#N)[nH]nc2-c1ccc(C)cc1	InChI=1S/C15H14N4O/c1-8-3-5-10(6-4-8)13-12-9(2)11(7-16)14(17)20-15(12)19-18-13/h3-6,9H,17H2,1-2H3,(H,18,19)	RYWSKZCSEHLKHR-UHFFFAOYSA-N	266.116761108							120408
AC1M5LZ2	LSM-44366	BRD-K83189379	2381062	InChI=1S/C29H24N6O/c1-20(16-22-10-5-3-6-11-22)18-31-33-29(36)25-17-26(23-12-9-15-30-19-23)32-28-27(25)21(2)34-35(28)24-13-7-4-8-14-24/h3-19H,1-2H3,(H,33,36)/b20-16+,31-18?	KMFWGHZDMJGOEA-GMRBBGEBSA-N	C\C(=C/c1ccccc1)\C=NNC(=O)c2cc(nc3c2c(C)nn3c4ccccc4)c5cccnc5	BroadT	BRD-K83189379	BRD-K83189379-001-05-8	Enamine Ltd.	T0513-2969			C\C(C=NNC(=O)c1cc(nc2n(nc(C)c12)-c1ccccc1)-c1cccnc1)=C/c1ccccc1	InChI=1S/C29H24N6O/c1-20(16-22-10-5-3-6-11-22)18-31-33-29(36)25-17-26(23-12-9-15-30-19-23)32-28-27(25)21(2)34-35(28)24-13-7-4-8-14-24/h3-19H,1-2H3,(H,33,36)/b20-16+,31-18?	KMFWGHZDMJGOEA-GMRBBGEBSA-N	472.201159448							
AC1NNCUR	LSM-31853	BRD-A71933035, SID22406104	5024860	InChI=1S/C22H25N3O5/c1-3-16-6-9-18(10-7-16)23-21(26)15(2)30-22(27)17-8-11-19(20(14-17)25(28)29)24-12-4-5-13-24/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,23,26)	JXNLKCNTGZXCNU-UHFFFAOYSA-N	CCc1ccc(NC(=O)C(C)OC(=O)c2ccc(N3CCCC3)c(c2)[N+](=O)[O-])cc1	BroadT	BRD-A71933035	BRD-A71933035-001-05-1	Enamine Ltd.	T0516-6152			CCc1ccc(NC(=O)C(C)OC(=O)c2ccc(N3CCCC3)c(c2)[N+]([O-])=O)cc1	InChI=1S/C22H25N3O5/c1-3-16-6-9-18(10-7-16)23-21(26)15(2)30-22(27)17-8-11-19(20(14-17)25(28)29)24-12-4-5-13-24/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,23,26)	JXNLKCNTGZXCNU-UHFFFAOYSA-N	411.17942093							120410
Ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate	LSM-31854	BRD-K31024887, SID3713146	742041	InChI=1S/C11H12N4O2/c1-2-17-11(16)8-7-14-15(10(8)12)9-5-3-4-6-13-9/h3-7H,2,12H2,1H3	UPTKQJLYDVZTKJ-UHFFFAOYSA-N	CCOC(=O)c1cnn(c1N)c2ccccn2	BroadT	BRD-K31024887	BRD-K31024887-001-05-5	Enamine Ltd.	T0513-8728			CCOC(=O)c1cnn(c1N)-c1ccccn1	InChI=1S/C11H12N4O2/c1-2-17-11(16)8-7-14-15(10(8)12)9-5-3-4-6-13-9/h3-7H,2,12H2,1H3	UPTKQJLYDVZTKJ-UHFFFAOYSA-N	232.096025664							120411
AC1LJMO0	LSM-31855	BRD-K12930517	1027113	InChI=1S/C17H11BrN2O4/c18-12-7-15-14(22-9-23-15)6-11(12)8-19-20-17(21)16-5-10-3-1-2-4-13(10)24-16/h1-8H,9H2,(H,20,21)	RZLAKUPDZHXCCR-UHFFFAOYSA-N	Brc1cc2OCOc2cc1C=NNC(=O)c3oc4ccccc4c3	BroadT	BRD-K12930517	BRD-K12930517-001-05-4	InterBioScreen Ltd.	STOCK2S-53813			Brc1cc2OCOc2cc1C=NNC(=O)c1cc2ccccc2o1	InChI=1S/C17H11BrN2O4/c18-12-7-15-14(22-9-23-15)6-11(12)8-19-20-17(21)16-5-10-3-1-2-4-13(10)24-16/h1-8H,9H2,(H,20,21)	RZLAKUPDZHXCCR-UHFFFAOYSA-N	385.990219452							120412
T5217227	LSM-31856	BRD-K68495784, SID24830019, SID85270891	2403831	InChI=1S/C21H23N3O6S/c1-12(2)18(24-19(26)14-7-15(28-3)9-16(8-14)29-4)21(27)30-11-17(25)23-20-13(10-22)5-6-31-20/h5-9,12,18H,11H2,1-4H3,(H,23,25)(H,24,26)/t18-/m0/s1	ZFQXMQVJWYPPEU-SFHVURJKSA-N	COc1cc(OC)cc(c1)C(=O)N[C@@H](C(C)C)C(=O)OCC(=O)Nc2sccc2C#N	BroadT	BRD-K68495784	BRD-K68495784-001-05-7	Enamine Ltd.	T5217227			COc1cc(OC)cc(c1)C(=O)N[C@@H](C(C)C)C(=O)OCC(=O)Nc1sccc1C#N	InChI=1S/C21H23N3O6S/c1-12(2)18(24-19(26)14-7-15(28-3)9-16(8-14)29-4)21(27)30-11-17(25)23-20-13(10-22)5-6-31-20/h5-9,12,18H,11H2,1-4H3,(H,23,25)(H,24,26)/t18-/m0/s1	ZFQXMQVJWYPPEU-SFHVURJKSA-N	445.130756176							120413
T0503-8906	LSM-31857	BRD-A77292814, SID3715299	2999156	InChI=1S/C12H8N2O2/c13-8-9(10-4-1-2-6-14-10)12(15)11-5-3-7-16-11/h1-7,9H	QSDNWEJECKQAQI-UHFFFAOYSA-N	O=C(C(C#N)c1ccccn1)c2occc2	BroadT	BRD-A77292814	BRD-A77292814-001-09-5	Enamine Ltd.	T0514-3274			O=C(C(C#N)c1ccccn1)c1ccco1	InChI=1S/C12H8N2O2/c13-8-9(10-4-1-2-6-14-10)12(15)11-5-3-7-16-11/h1-7,9H	QSDNWEJECKQAQI-UHFFFAOYSA-N	212.058577516							120414
SMR000026058	LSM-31858	BRD-K07589203, SID4249172	3243161	InChI=1S/C14H20N2O4S/c1-11(17)16-8-6-12-10-13(4-5-14(12)16)21(18,19)15-7-3-9-20-2/h4-5,10,15H,3,6-9H2,1-2H3	HZENCSYHMPFODX-UHFFFAOYSA-N	COCCCNS(=O)(=O)c1ccc2N(CCc2c1)C(=O)C	BroadT	BRD-K07589203	BRD-K07589203-001-05-4	ChemDiv Inc.	C324-2779			COCCCNS(=O)(=O)c1ccc2N(CCc2c1)C(C)=O	InChI=1S/C14H20N2O4S/c1-11(17)16-8-6-12-10-13(4-5-14(12)16)21(18,19)15-7-3-9-20-2/h4-5,10,15H,3,6-9H2,1-2H3	HZENCSYHMPFODX-UHFFFAOYSA-N	312.11437783							120415
AC1MF0TR	LSM-31859	BRD-K36743230	2912035	InChI=1S/C14H12N4O4/c1-9-8-11(2-3-12(9)18(20)21)14(19)22-17-13(15)10-4-6-16-7-5-10/h2-8H,1H3,(H2,15,17)	IWQBFACHNUUVAN-UHFFFAOYSA-N	Cc1cc(ccc1[N+](=O)[O-])C(=O)ONC(=N)c2ccncc2	BroadT	BRD-K36743230	BRD-K36743230-001-06-7	InterBioScreen Ltd.	STOCK4S-07916			Cc1cc(ccc1[N+]([O-])=O)C(=O)ONC(=N)c1ccncc1	InChI=1S/C14H12N4O4/c1-9-8-11(2-3-12(9)18(20)21)14(19)22-17-13(15)10-4-6-16-7-5-10/h2-8H,1H3,(H2,15,17)	IWQBFACHNUUVAN-UHFFFAOYSA-N	300.085854904							120416
SMR000054491	LSM-31860	BRD-K18447546, SID7976379	2195706	InChI=1S/C15H12N4O2S2/c1-2-21-12(20)8-23-15-10(7-17)13(11-4-3-5-22-11)9(6-16)14(18)19-15/h3-5H,2,8H2,1H3,(H2,18,19)	CSBIIVPTPGDRIX-UHFFFAOYSA-N	CCOC(=O)CSc1nc(N)c(C#N)c(c2cccs2)c1C#N	BroadT	BRD-K18447546	BRD-K18447546-001-06-6	ChemBridge Corporation	5230953			CCOC(=O)CSc1nc(N)c(C#N)c(-c2cccs2)c1C#N	InChI=1S/C15H12N4O2S2/c1-2-21-12(20)8-23-15-10(7-17)13(11-4-3-5-22-11)9(6-16)14(18)19-15/h3-5H,2,8H2,1H3,(H2,18,19)	CSBIIVPTPGDRIX-UHFFFAOYSA-N	344.040167044							120417
SMR000248379	LSM-31861	BRD-K25773863, SID17517281	4095030	InChI=1S/C27H26N4O4S/c1-20-10-12-21(13-11-20)26-25(19-31(29-26)23-7-3-2-4-8-23)27(32)28-22-6-5-9-24(18-22)36(33,34)30-14-16-35-17-15-30/h2-13,18-19H,14-17H2,1H3,(H,28,32)	QQXGTKKFPYCAEN-UHFFFAOYSA-N	Cc1ccc(cc1)c2nn(cc2C(=O)Nc3cccc(c3)S(=O)(=O)N4CCOCC4)c5ccccc5	BroadT	BRD-K25773863	BRD-K25773863-001-05-3	Enamine Ltd.	T0505-5294			Cc1ccc(cc1)-c1nn(cc1C(=O)Nc1cccc(c1)S(=O)(=O)N1CCOCC1)-c1ccccc1	InChI=1S/C27H26N4O4S/c1-20-10-12-21(13-11-20)26-25(19-31(29-26)23-7-3-2-4-8-23)27(32)28-22-6-5-9-24(18-22)36(33,34)30-14-16-35-17-15-30/h2-13,18-19H,14-17H2,1H3,(H,28,32)	QQXGTKKFPYCAEN-UHFFFAOYSA-N	502.167476042							120418
SMR000066765	LSM-31862	BRD-A14331394, SID3712725	2998136	InChI=1S/C16H23ClN4O3S/c1-19-9-11-20(12-10-19)16(22)18-15-3-2-8-21(15)25(23,24)14-6-4-13(17)5-7-14/h4-7,15H,2-3,8-12H2,1H3,(H,18,22)	NCFVGHOFJUWJJW-UHFFFAOYSA-N	CN1CCN(CC1)C(=O)NC2CCCN2S(=O)(=O)c3ccc(Cl)cc3	BroadT	BRD-A14331394	BRD-A14331394-001-05-3	Enamine Ltd.	T5241022			CN1CCN(CC1)C(=O)NC1CCCN1S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C16H23ClN4O3S/c1-19-9-11-20(12-10-19)16(22)18-15-3-2-8-21(15)25(23,24)14-6-4-13(17)5-7-14/h4-7,15H,2-3,8-12H2,1H3,(H,18,22)	NCFVGHOFJUWJJW-UHFFFAOYSA-N	386.117939036							120419
SMR000035089	LSM-31863	BRD-A05956997, SID860532	661817	InChI=1S/C24H22N4O3/c1-3-30-19-10-5-4-9-17(19)21-18(13-25)23(26)31-20-12-15(2)28(24(29)22(20)21)14-16-8-6-7-11-27-16/h4-12,21H,3,14,26H2,1-2H3	TZWDPFZKHIIADA-UHFFFAOYSA-N	CCOc1ccccc1C2C(=C(N)OC3=C2C(=O)N(Cc4ccccn4)C(=C3)C)C#N	BroadT	BRD-A05956997	BRD-A05956997-001-05-9	InterBioScreen Ltd.	STOCK3S-83442			CCOc1ccccc1C1C(C#N)=C(N)Oc2cc(C)n(Cc3ccccn3)c(=O)c12	InChI=1S/C24H22N4O3/c1-3-30-19-10-5-4-9-17(19)21-18(13-25)23(26)31-20-12-15(2)28(24(29)22(20)21)14-16-8-6-7-11-27-16/h4-12,21H,3,14,26H2,1-2H3	TZWDPFZKHIIADA-UHFFFAOYSA-N	414.169190604							120420
3-[(4-Bromophenoxy)methyl]-n-(5-methyl-1,2-oxazol-3-yl)benzamide	LSM-31864	BRD-K07164317, SID7965075	1224550	InChI=1S/C18H15BrN2O3/c1-12-9-17(21-24-12)20-18(22)14-4-2-3-13(10-14)11-23-16-7-5-15(19)6-8-16/h2-10H,11H2,1H3,(H,20,21,22)	YPKUSSVTPLQXIX-UHFFFAOYSA-N	Cc1onc(NC(=O)c2cccc(COc3ccc(Br)cc3)c2)c1	BroadT	BRD-K07164317	BRD-K07164317-001-04-2	ChemDiv Inc.	6049-2363			Cc1cc(NC(=O)c2cccc(COc3ccc(Br)cc3)c2)no1	InChI=1S/C18H15BrN2O3/c1-12-9-17(21-24-12)20-18(22)14-4-2-3-13(10-14)11-23-16-7-5-15(19)6-8-16/h2-10H,11H2,1H3,(H,20,21,22)	YPKUSSVTPLQXIX-UHFFFAOYSA-N	386.02660496							120421
ST50225788	LSM-31865	BRD-K75529374, SID17504055	1099325	InChI=1S/C29H28N2O4S2/c1-18-5-7-20(3)28(13-18)30-36(32,33)24-9-11-26-22(16-24)15-23-17-25(10-12-27(23)26)37(34,35)31-29-14-19(2)6-8-21(29)4/h5-14,16-17,30-31H,15H2,1-4H3	ONFKCSBGVQSCGJ-UHFFFAOYSA-N	Cc1ccc(C)c(NS(=O)(=O)c2ccc3c(Cc4cc(ccc34)S(=O)(=O)Nc5cc(C)ccc5C)c2)c1	BroadT	BRD-K75529374	BRD-K75529374-001-04-3	Asinex Ltd.	BAS 00379948			Cc1ccc(C)c(NS(=O)(=O)c2ccc-3c(Cc4cc(ccc-34)S(=O)(=O)Nc3cc(C)ccc3C)c2)c1	InChI=1S/C29H28N2O4S2/c1-18-5-7-20(3)28(13-18)30-36(32,33)24-9-11-26-22(16-24)15-23-17-25(10-12-27(23)26)37(34,35)31-29-14-19(2)6-8-21(29)4/h5-14,16-17,30-31H,15H2,1-4H3	ONFKCSBGVQSCGJ-UHFFFAOYSA-N	532.149048776							120422
MLS000035758	LSM-31866	BRD-K70875838, SID843364, SID87225459	645654	InChI=1S/C20H17N3O2/c1-14-8-10-15(11-9-14)13-23-17-6-3-2-5-16(17)21-20(23)22-19(24)18-7-4-12-25-18/h2-12H,13H2,1H3,(H,21,22,24)	LHERJLPNWIFDNT-UHFFFAOYSA-N	Cc1ccc(Cn2c(NC(=O)c3occc3)nc4ccccc24)cc1	BroadT	BRD-K70875838	BRD-K70875838-001-05-2	Asinex Ltd.	BAS 01044501			Cc1ccc(Cn2c(NC(=O)c3ccco3)nc3ccccc23)cc1	InChI=1S/C20H17N3O2/c1-14-8-10-15(11-9-14)13-23-17-6-3-2-5-16(17)21-20(23)22-19(24)18-7-4-12-25-18/h2-12H,13H2,1H3,(H,21,22,24)	LHERJLPNWIFDNT-UHFFFAOYSA-N	331.132076814							120423
SMR000007928	LSM-31867	BRD-K48994888, SID847362	649759	InChI=1S/C18H21N3O3S/c1-23-15-7-5-13(11-16(15)24-2)14-6-8-17(20-19-14)25-12-18(22)21-9-3-4-10-21/h5-8,11H,3-4,9-10,12H2,1-2H3	VCSBLUOZMMRJMH-UHFFFAOYSA-N	COc1ccc(cc1OC)c2ccc(SCC(=O)N3CCCC3)nn2	BroadT	BRD-K48994888	BRD-K48994888-001-05-9	Asinex Ltd.	ASN 07276831			COc1ccc(cc1OC)-c1ccc(SCC(=O)N2CCCC2)nn1	InChI=1S/C18H21N3O3S/c1-23-15-7-5-13(11-16(15)24-2)14-6-8-17(20-19-14)25-12-18(22)21-9-3-4-10-21/h5-8,11H,3-4,9-10,12H2,1-2H3	VCSBLUOZMMRJMH-UHFFFAOYSA-N	359.130362252							120424
STK520305	LSM-31868	SID846080, BRD-K67344728	648452	InChI=1S/C20H17N5O2/c1-13-10-18-19(11-17(13)22-20(26)14-4-3-9-21-12-14)24-25(23-18)15-5-7-16(27-2)8-6-15/h3-12H,1-2H3,(H,22,26)	MDPOIDZODHXWHQ-UHFFFAOYSA-N	COc1ccc(cc1)n2nc3cc(C)c(NC(=O)c4cccnc4)cc3n2	BroadT	BRD-K67344728	BRD-K67344728-001-05-7	Asinex Ltd.	BAS 03317137			COc1ccc(cc1)-n1nc2cc(C)c(NC(=O)c3cccnc3)cc2n1	InChI=1S/C20H17N5O2/c1-13-10-18-19(11-17(13)22-20(26)14-4-3-9-21-12-14)24-25(23-18)15-5-7-16(27-2)8-6-15/h3-12H,1-2H3,(H,22,26)	MDPOIDZODHXWHQ-UHFFFAOYSA-N	359.138224834							120425
2-Cyano-n-cyclohexyl-3-(4-methylsulfanyl-phenyl)-acrylamide	LSM-44367	SID17508893, BRD-K76617730	763537	InChI=1S/C17H20N2OS/c1-21-16-9-7-13(8-10-16)11-14(12-18)17(20)19-15-5-3-2-4-6-15/h7-11,15H,2-6H2,1H3,(H,19,20)/b14-11+	SMPUOPSPJOHYOK-SDNWHVSQSA-N	CSc1ccc(\C=C(/C#N)\C(=O)NC2CCCCC2)cc1	BroadT	BRD-K76617730	BRD-K76617730-001-05-1	Asinex Ltd.	BAS 01427749			CSc1ccc(cc1)\C=C(/C#N)C(=O)NC1CCCCC1	InChI=1S/C17H20N2OS/c1-21-16-9-7-13(8-10-16)11-14(12-18)17(20)19-15-5-3-2-4-6-15/h7-11,15H,2-6H2,1H3,(H,19,20)/b14-11+	SMPUOPSPJOHYOK-SDNWHVSQSA-N	300.12963397							
2-Benzylsulfanyl-6-oxo-4-phenyl-1,4,5,6-tetrahydro-pyridine-3-carbonitrile	LSM-31870	BRD-A52510783, SID14721007	3142264	InChI=1S/C19H16N2OS/c20-12-17-16(15-9-5-2-6-10-15)11-18(22)21-19(17)23-13-14-7-3-1-4-8-14/h1-10,16H,11,13H2,(H,21,22)	KNKSAQZCBJITEX-UHFFFAOYSA-N	O=C1CC(C(=C(N1)SCc2ccccc2)C#N)c3ccccc3	BroadT	BRD-A52510783	BRD-A52510783-001-05-4	Asinex Ltd.	BAS 02589883			O=C1CC(c2ccccc2)C(C#N)=C(N1)SCc1ccccc1	InChI=1S/C19H16N2OS/c20-12-17-16(15-9-5-2-6-10-15)11-18(22)21-19(17)23-13-14-7-3-1-4-8-14/h1-10,16H,11,13H2,(H,21,22)	KNKSAQZCBJITEX-UHFFFAOYSA-N	320.098333842							120427
MLS001205954	LSM-31871	BRD-K59542165, SID49642398	24746879	InChI=1S/C18H16N2O3S/c1-22-17(21)12-24-18-14-9-5-6-10-15(14)19-16(20-18)11-23-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3	HZNMMECHTLICIS-UHFFFAOYSA-N	COC(=O)CSc1nc(COc2ccccc2)nc3ccccc13	BroadT	BRD-K59542165	BRD-K59542165-001-06-4	Asinex Ltd.	AST 6534030			COC(=O)CSc1nc(COc2ccccc2)nc2ccccc12	InChI=1S/C18H16N2O3S/c1-22-17(21)12-24-18-14-9-5-6-10-15(14)19-16(20-18)11-23-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3	HZNMMECHTLICIS-UHFFFAOYSA-N	340.088163082							120428
SMR000029138	LSM-31872	BRD-K37014934, SID24838340, SID4246302	3240671	InChI=1S/C25H24FN3O3S/c26-19-5-3-17(4-6-19)16-29-21-9-13-33-23(21)14-22(29)25(31)28-10-7-18(8-11-28)24(30)27-15-20-2-1-12-32-20/h1-6,9,12-14,18H,7-8,10-11,15-16H2,(H,27,30)	MBQKISRWBNFPED-UHFFFAOYSA-N	Fc1ccc(Cn2c(cc3sccc23)C(=O)N4CCC(CC4)C(=O)NCc5occc5)cc1	BroadT	BRD-K37014934	BRD-K37014934-001-05-3	ChemDiv Inc.	C779-1732			Fc1ccc(Cn2c(cc3sccc23)C(=O)N2CCC(CC2)C(=O)NCc2ccco2)cc1	InChI=1S/C25H24FN3O3S/c26-19-5-3-17(4-6-19)16-29-21-9-13-33-23(21)14-22(29)25(31)28-10-7-18(8-11-28)24(30)27-15-20-2-1-12-32-20/h1-6,9,12-14,18H,7-8,10-11,15-16H2,(H,27,30)	MBQKISRWBNFPED-UHFFFAOYSA-N	465.152240548							120429
SMR000006320	LSM-31873	BRD-A64761364, SID842355	644613	InChI=1S/C22H23FN4O3S/c1-14-6-11-19(30-14)20(21(28)24-17-4-2-3-5-17)27(22(29)18-13-31-26-25-18)12-15-7-9-16(23)10-8-15/h6-11,13,17,20H,2-5,12H2,1H3,(H,24,28)	PFXVNPUAHLUCNF-UHFFFAOYSA-N	Cc1oc(cc1)C(N(Cc2ccc(F)cc2)C(=O)c3csnn3)C(=O)NC4CCCC4	BroadT	BRD-A64761364	BRD-A64761364-001-05-6	Asinex Ltd.	ASN 06291726			Cc1ccc(o1)C(N(Cc1ccc(F)cc1)C(=O)c1csnn1)C(=O)NC1CCCC1	InChI=1S/C22H23FN4O3S/c1-14-6-11-19(30-14)20(21(28)24-17-4-2-3-5-17)27(22(29)18-13-31-26-25-18)12-15-7-9-16(23)10-8-15/h6-11,13,17,20H,2-5,12H2,1H3,(H,24,28)	PFXVNPUAHLUCNF-UHFFFAOYSA-N	442.147489526							120430
F0646-3966	LSM-31874	BRD-K85888199, SID4241520	3236482	InChI=1S/C13H10FN3O2S2/c1-2-19-11(18)9-6-20-12(16-9)17-13-15-8-4-3-7(14)5-10(8)21-13/h3-6H,2H2,1H3,(H,15,16,17)	PFXBXBZLBKMJQA-UHFFFAOYSA-N	CCOC(=O)c1csc(Nc2nc3ccc(F)cc3s2)n1	BroadT	BRD-K85888199	BRD-K85888199-001-06-9	ChemDiv Inc.	C505-0471			CCOC(=O)c1csc(Nc2nc3ccc(F)cc3s2)n1	InChI=1S/C13H10FN3O2S2/c1-2-19-11(18)9-6-20-12(16-9)17-13-15-8-4-3-7(14)5-10(8)21-13/h3-6H,2H2,1H3,(H,15,16,17)	PFXBXBZLBKMJQA-UHFFFAOYSA-N	323.01984617							120431
ZINC00434878	LSM-31875	BRD-K63892351	6745077	InChI=1S/C15H11BrN4O/c16-12-1-2-14-13(7-12)11(8-18-14)9-19-20-15(21)10-3-5-17-6-4-10/h1-9,18H,(H,20,21)	FGGMPDLIMIWGLB-UHFFFAOYSA-N	Brc1ccc2[nH]cc(C=NNC(=O)c3ccncc3)c2c1	BroadT	BRD-K63892351	BRD-K63892351-001-05-3	ChemBridge Corporation	5753654			Brc1ccc2[nH]cc(C=NNC(=O)c3ccncc3)c2c1	InChI=1S/C15H11BrN4O/c16-12-1-2-14-13(7-12)11(8-18-14)9-19-20-15(21)10-3-5-17-6-4-10/h1-9,18H,(H,20,21)	FGGMPDLIMIWGLB-UHFFFAOYSA-N	342.011623612							
2-Pyren-2-ylacetonitrile	LSM-31876	BRD-K51681402, SID26729589	2825910	InChI=1S/C18H11N/c19-9-8-12-10-15-6-4-13-2-1-3-14-5-7-16(11-12)18(15)17(13)14/h1-7,10-11H,8H2	AXTONQSVCXAXGI-UHFFFAOYSA-N	N#CCc1cc2ccc3cccc4ccc(c1)c2c34	BroadT	BRD-K51681402	BRD-K51681402-001-05-3	Maybridge	NRB 05234			N#CCc1cc2ccc3cccc4ccc(c1)c2c34	InChI=1S/C18H11N/c19-9-8-12-10-15-6-4-13-2-1-3-14-5-7-16(11-12)18(15)17(13)14/h1-7,10-11H,8H2	AXTONQSVCXAXGI-UHFFFAOYSA-N	241.089149362							120433
BRD-A79884839	LSM-31877	BRD-A79884839		InChI=1S/C25H22N2O7/c1-13-11-17(9-10-18(13)32-3)22(28)20-21(15-5-7-16(8-6-15)25(31)33-4)27(24(30)23(20)29)19-12-14(2)34-26-19/h5-12,20-21H,1-4H3	KMPKGSNEMVQEBM-UHFFFAOYSA-N	COC(=O)c1ccc(cc1)C2C(C(=O)c3ccc(OC)c(C)c3)C(=O)C(=O)N2c4cc(C)on4	BroadT	BRD-A79884839	BRD-A79884839-001-05-6	InterBioScreen Ltd.	STOCK3S-85742			COC(=O)c1ccc(cc1)C1C(C(=O)c2ccc(OC)c(C)c2)C(=O)C(=O)N1c1cc(C)on1	InChI=1S/C25H22N2O7/c1-13-11-17(9-10-18(13)32-3)22(28)20-21(15-5-7-16(8-6-15)25(31)33-4)27(24(30)23(20)29)19-12-14(2)34-26-19/h5-12,20-21H,1-4H3	KMPKGSNEMVQEBM-UHFFFAOYSA-N	462.142701064							120434
AC1LF9CM	LSM-31878	BRD-K93126086	749064	InChI=1S/C12H13N3S2/c1-9-8-17-12(15(9)2)14-11(16)13-10-6-4-3-5-7-10/h3-8H,1-2H3,(H,13,16)	KOKFXPFIJLSBNY-UHFFFAOYSA-N	CN1C(=CSC1=NC(=Nc2ccccc2)S)C	BroadT	BRD-K93126086	BRD-K93126086-001-05-2	InterBioScreen Ltd.	STOCK2S-25798			Cc1csc(=NC(S)=Nc2ccccc2)n1C	InChI=1S/C12H13N3S2/c1-9-8-17-12(15(9)2)14-11(16)13-10-6-4-3-5-7-10/h3-8H,1-2H3,(H,13,16)	KOKFXPFIJLSBNY-UHFFFAOYSA-N	263.055088826							120435
BRD-K58469385	LSM-31879	BRD-K58469385		InChI=1S/C17H15ClN2O2/c1-12(11-16(21)13-5-3-2-4-6-13)19-20-17(22)14-7-9-15(18)10-8-14/h2-10H,11H2,1H3,(H,20,22)	WSSPCXRTLQUGQO-UHFFFAOYSA-N	CC(=NNC(=O)c1ccc(Cl)cc1)CC(=O)c2ccccc2	BroadT	BRD-K58469385	BRD-K58469385-001-05-7	Asinex Ltd.	BAS 00728074			CC(CC(=O)c1ccccc1)=NNC(=O)c1ccc(Cl)cc1	InChI=1S/C17H15ClN2O2/c1-12(11-16(21)13-5-3-2-4-6-13)19-20-17(22)14-7-9-15(18)10-8-14/h2-10H,11H2,1H3,(H,20,22)	WSSPCXRTLQUGQO-UHFFFAOYSA-N	314.08220545							120436
F0608-0577	LSM-31880	BRD-K05610303, SID7970730	4047136	InChI=1S/C19H23N3O2/c23-17(14-7-2-1-3-8-14)20-19-22-21-18(24-19)16-11-10-13-6-4-5-9-15(13)12-16/h10-12,14H,1-9H2,(H,20,22,23)	SXHGZODTZKJJSW-UHFFFAOYSA-N	O=C(Nc1oc(nn1)c2ccc3CCCCc3c2)C4CCCCC4	BroadT	BRD-K05610303	BRD-K05610303-001-04-2	Life Chemicals Inc.	F0608-0577			O=C(Nc1nnc(o1)-c1ccc2CCCCc2c1)C1CCCCC1	InChI=1S/C19H23N3O2/c23-17(14-7-2-1-3-8-14)20-19-22-21-18(24-19)16-11-10-13-6-4-5-9-15(13)12-16/h10-12,14H,1-9H2,(H,20,22,23)	SXHGZODTZKJJSW-UHFFFAOYSA-N	325.179027006							120437
SMR000035903	LSM-31881	BRD-K24532680, SID859876	661180	InChI=1S/C22H27N5O/c1-16(2)17-14-21(24-8-5-9-26-10-12-28-13-11-26)27-20-7-4-3-6-19(20)25-22(27)18(17)15-23/h3-4,6-7,14,16,24H,5,8-13H2,1-2H3	YXCNPUIUUCJKHL-UHFFFAOYSA-N	CC(C)c1cc(NCCCN2CCOCC2)n3c4ccccc4nc3c1C#N	BroadT	BRD-K24532680	BRD-K24532680-001-05-5	InterBioScreen Ltd.	STOCK3S-41622			CC(C)c1cc(NCCCN2CCOCC2)n2c(nc3ccccc23)c1C#N	InChI=1S/C22H27N5O/c1-16(2)17-14-21(24-8-5-9-26-10-12-28-13-11-26)27-20-7-4-3-6-19(20)25-22(27)18(17)15-23/h3-4,6-7,14,16,24H,5,8-13H2,1-2H3	YXCNPUIUUCJKHL-UHFFFAOYSA-N	377.221560534							120438
4-Methyl-n-[(2-methylquinolin-4-yl)methyl]-3-nitrobenzamide	LSM-31882	BRD-K46306993, SID24781165	1503195	InChI=1S/C19H17N3O3/c1-12-7-8-14(10-18(12)22(24)25)19(23)20-11-15-9-13(2)21-17-6-4-3-5-16(15)17/h3-10H,11H2,1-2H3,(H,20,23)	VTKCHBQHOZWXJU-UHFFFAOYSA-N	Cc1cc(CNC(=O)c2ccc(C)c(c2)[N+](=O)[O-])c3ccccc3n1	BroadT	BRD-K46306993	BRD-K46306993-001-05-0	ChemDiv Inc.	8015-6323			Cc1cc(CNC(=O)c2ccc(C)c(c2)[N+]([O-])=O)c2ccccc2n1	InChI=1S/C19H17N3O3/c1-12-7-8-14(10-18(12)22(24)25)19(23)20-11-15-9-13(2)21-17-6-4-3-5-16(15)17/h3-10H,11H2,1-2H3,(H,20,23)	VTKCHBQHOZWXJU-UHFFFAOYSA-N	335.126991434							120439
ZINC00547971	LSM-31883	BRD-K71808107	6747993	InChI=1S/C18H17N3O3/c1-2-5-17-20-15-7-4-3-6-14(15)18(24)21(17)19-11-12-8-9-13(22)10-16(12)23/h3-4,6-11,22-23H,2,5H2,1H3	HFDHOXWNDFGXLZ-UHFFFAOYSA-N	CCCC1=Nc2ccccc2C(=O)N1N=Cc3ccc(O)cc3O	BroadT	BRD-K71808107	BRD-K71808107-001-05-6	InterBioScreen Ltd.	STOCK2S-82349			CCCc1nc2ccccc2c(=O)n1N=Cc1ccc(O)cc1O	InChI=1S/C18H17N3O3/c1-2-5-17-20-15-7-4-3-6-14(15)18(24)21(17)19-11-12-8-9-13(22)10-16(12)23/h3-4,6-11,22-23H,2,5H2,1H3	HFDHOXWNDFGXLZ-UHFFFAOYSA-N	323.126991434							
ST50909959	LSM-31884	BRD-K01371603, SID24796491	1219136	InChI=1S/C23H21N5O4/c1-14(29)25-17-5-3-7-19(11-17)27-22(31)16-9-10-21(24-13-16)23(32)28-20-8-4-6-18(12-20)26-15(2)30/h3-13H,1-2H3,(H,25,29)(H,26,30)(H,27,31)(H,28,32)	AYCJLSPBVOOWHU-UHFFFAOYSA-N	CC(=O)Nc1cccc(NC(=O)c2ccc(nc2)C(=O)Nc3cccc(NC(=O)C)c3)c1	BroadT	BRD-K01371603	BRD-K01371603-001-05-9	Specs	AK-968/11217189			CC(=O)Nc1cccc(NC(=O)c2ccc(nc2)C(=O)Nc2cccc(NC(C)=O)c2)c1	InChI=1S/C23H21N5O4/c1-14(29)25-17-5-3-7-19(11-17)27-22(31)16-9-10-21(24-13-16)23(32)28-20-8-4-6-18(12-20)26-15(2)30/h3-13H,1-2H3,(H,25,29)(H,26,30)(H,27,31)(H,28,32)	AYCJLSPBVOOWHU-UHFFFAOYSA-N	431.159354202							120441
SMR000094771	LSM-31885	BRD-K10178088, SID26724681, SID7968238	4906885	InChI=1S/C27H31N5O2/c1-19-16-25(31-14-12-30(13-15-31)18-21-8-6-5-7-9-21)32-27(28-19)26(20(2)29-32)22-10-11-23(33-3)24(17-22)34-4/h5-11,16-17H,12-15,18H2,1-4H3	DQBIMMDGCPNLKL-UHFFFAOYSA-N	COc1ccc(cc1OC)c2c(C)nn3c(cc(C)nc23)N4CCN(Cc5ccccc5)CC4	BroadT	BRD-K10178088	BRD-K10178088-001-04-4	ChemDiv Inc.	C535-0644			COc1ccc(cc1OC)-c1c(C)nn2c(cc(C)nc12)N1CCN(Cc2ccccc2)CC1	InChI=1S/C27H31N5O2/c1-19-16-25(31-14-12-30(13-15-31)18-21-8-6-5-7-9-21)32-27(28-19)26(20(2)29-32)22-10-11-23(33-3)24(17-22)34-4/h5-11,16-17H,12-15,18H2,1-4H3	DQBIMMDGCPNLKL-UHFFFAOYSA-N	457.247775282							120442
MLS000063808	LSM-31886	BRD-K16641781, SID4265039	682205	InChI=1S/C13H9Cl2N3O/c14-10-6-5-9(11(15)7-10)8-19-18-13-4-2-1-3-12(13)16-17-18/h1-7H,8H2	OFKCNDXFHQAWGJ-UHFFFAOYSA-N	Clc1ccc(COn2nnc3ccccc23)c(Cl)c1	BroadT	BRD-K16641781	BRD-K16641781-001-05-2	ChemBridge Corporation	7739033			Clc1ccc(COn2nnc3ccccc23)c(Cl)c1	InChI=1S/C13H9Cl2N3O/c14-10-6-5-9(11(15)7-10)8-19-18-13-4-2-1-3-12(13)16-17-18/h1-7H,8H2	OFKCNDXFHQAWGJ-UHFFFAOYSA-N	293.012267358							120443
AK-968/41923350	LSM-31887	BRD-K29466595, SID22412808	843520	InChI=1S/C14H13N3S2/c1-9-5-3-4-6-12(9)17-13(15-16-14(17)18)11-7-10(2)19-8-11/h3-8H,1-2H3,(H,16,18)	JEPDSTZJDANDNU-UHFFFAOYSA-N	Cc1cc(cs1)c2nnc(S)n2c3ccccc3C	BroadT	BRD-K29466595	BRD-K29466595-001-05-5	Specs	AK-968/41923350			Cc1cc(cs1)-c1nnc(S)n1-c1ccccc1C	InChI=1S/C14H13N3S2/c1-9-5-3-4-6-12(9)17-13(15-16-14(17)18)11-7-10(2)19-8-11/h3-8H,1-2H3,(H,16,18)	JEPDSTZJDANDNU-UHFFFAOYSA-N	287.055088826							120444
AC1O9BJW	LSM-31888	BRD-K82842087, SID4262910	6778135	InChI=1S/C25H21N5O2S2/c26-14-19-17-10-5-7-13-21(17)34-24(19)27-22(32)15-33-25-29-28-23(18-11-4-6-12-20(18)31)30(25)16-8-2-1-3-9-16/h1-4,6,8-9,11-12,31H,5,7,10,13,15H2,(H,27,32)	FUGKYNGSNZCCCZ-UHFFFAOYSA-N	Oc1ccccc1c2nnc(SCC(=O)Nc3sc4CCCCc4c3C#N)n2c5ccccc5	BroadT	BRD-K82842087	BRD-K82842087-001-06-4	ChemBridge Corporation	7928747			Oc1ccccc1-c1nnc(SCC(=O)Nc2sc3CCCCc3c2C#N)n1-c1ccccc1	InChI=1S/C25H21N5O2S2/c26-14-19-17-10-5-7-13-21(17)34-24(19)27-22(32)15-33-25-29-28-23(18-11-4-6-12-20(18)31)30(25)16-8-2-1-3-9-16/h1-4,6,8-9,11-12,31H,5,7,10,13,15H2,(H,27,32)	FUGKYNGSNZCCCZ-UHFFFAOYSA-N	487.113666342							
SMR000026624	LSM-31889	BRD-K12469242, SID4241442	3236415	InChI=1S/C20H21N3O3/c24-18(21-11-10-14-6-2-1-3-7-14)13-23-19-15-8-4-5-9-17(15)26-20(25)16(19)12-22-23/h4-6,8-9,12H,1-3,7,10-11,13H2,(H,21,24)	NYDRSYLCEGRZCT-UHFFFAOYSA-N	O=C(Cn1ncc2C(=O)Oc3ccccc3c12)NCCC4=CCCCC4	BroadT	BRD-K12469242	BRD-K12469242-001-05-5	ChemDiv Inc.	C434-0004			O=C(Cn1ncc2c1c1ccccc1oc2=O)NCCC1=CCCCC1	InChI=1S/C20H21N3O3/c24-18(21-11-10-14-6-2-1-3-7-14)13-23-19-15-8-4-5-9-17(15)26-20(25)16(19)12-22-23/h4-6,8-9,12H,1-3,7,10-11,13H2,(H,21,24)	NYDRSYLCEGRZCT-UHFFFAOYSA-N	351.158291562							120446
SMR000109513	LSM-31890	BRD-K61370861, SID7972346	1189893	InChI=1S/C16H18N2O4S2/c1-21-16(20)14-11(12-3-2-8-23-12)10-24-15(14)17-13(19)9-18-4-6-22-7-5-18/h2-3,8,10H,4-7,9H2,1H3,(H,17,19)	JQZXVCZYFOHPQK-UHFFFAOYSA-N	COC(=O)c1c(NC(=O)CN2CCOCC2)scc1c3cccs3	BroadT	BRD-K61370861	BRD-K61370861-001-06-3	ChemBridge Corporation	7154729			COC(=O)c1c(NC(=O)CN2CCOCC2)scc1-c1cccs1	InChI=1S/C16H18N2O4S2/c1-21-16(20)14-11(12-3-2-8-23-12)10-24-15(14)17-13(19)9-18-4-6-22-7-5-18/h2-3,8,10H,4-7,9H2,1H3,(H,17,19)	JQZXVCZYFOHPQK-UHFFFAOYSA-N	366.070798456							120447
SMR000031309	LSM-31891	BRD-K19118372, SID4246400	3240751	InChI=1S/C18H24N2O6S2/c1-25-13-11-19-27(21,22)17-7-3-15(4-8-17)16-5-9-18(10-6-16)28(23,24)20-12-14-26-2/h3-10,19-20H,11-14H2,1-2H3	OXWJAGUCBGEUKV-UHFFFAOYSA-N	COCCNS(=O)(=O)c1ccc(cc1)c2ccc(cc2)S(=O)(=O)NCCOC	BroadT	BRD-K19118372	BRD-K19118372-001-04-6	ChemDiv Inc.	K691-0197			COCCNS(=O)(=O)c1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCCOC	InChI=1S/C18H24N2O6S2/c1-25-13-11-19-27(21,22)17-7-3-15(4-8-17)16-5-9-18(10-6-16)28(23,24)20-12-14-26-2/h3-10,19-20H,11-14H2,1-2H3	OXWJAGUCBGEUKV-UHFFFAOYSA-N	428.107577888							120448
MLS000041276	LSM-31892	BRD-K65773140, SID864029	665280	InChI=1S/C19H17N5O/c1-3-24-18-15(11-14-10-12(2)4-5-16(14)21-18)17(23-24)22-19(25)13-6-8-20-9-7-13/h4-11H,3H2,1-2H3,(H,22,23,25)	LCPGYLGLIXXEQG-UHFFFAOYSA-N	CCn1nc(NC(=O)c2ccncc2)c3cc4cc(C)ccc4nc13	BroadT	BRD-K65773140	BRD-K65773140-001-06-7	InterBioScreen Ltd.	STOCK4S-95103			CCn1nc(NC(=O)c2ccncc2)c2cc3cc(C)ccc3nc12	InChI=1S/C19H17N5O/c1-3-24-18-15(11-14-10-12(2)4-5-16(14)21-18)17(23-24)22-19(25)13-6-8-20-9-7-13/h4-11H,3H2,1-2H3,(H,22,23,25)	LCPGYLGLIXXEQG-UHFFFAOYSA-N	331.143310214							120449
AC1M3RLC	LSM-15582	BRD-K84266230	2195423	InChI=1S/C20H26N2O2/c1-2-6-18(7-3-1)19-8-4-5-9-20(19)24-17-16-23-15-14-22-12-10-21-11-13-22/h1-9,21H,10-17H2	GOGRYXZITYMYQP-UHFFFAOYSA-N	C(COc1ccccc1c2ccccc2)OCCN3CCNCC3	BroadT	BRD-K84266230	BRD-K84266230-034-05-3	ChemBridge Corporation	7635285		OC(=O)C(=O)O	C(COc1ccccc1-c1ccccc1)OCCN1CCNCC1.OC(=O)C(=O)O	InChI=1S/C20H26N2O2.C2H2O4/c1-2-6-18(7-3-1)19-8-4-5-9-20(19)24-17-16-23-15-14-22-12-10-21-11-13-22;3-1(4)2(5)6/h1-9,21H,10-17H2;(H,3,4)(H,5,6)	XJMBAQNBRZWSQG-UHFFFAOYSA-N	326.199428092							104218, 104218
SMR000031012	LSM-31893	BRD-K06450191, SID4246360	3240716	InChI=1S/C22H27N3O5S/c1-3-28-18-12-16-17(13-19(18)29-4-2)24-22(31)25(21(16)27)10-6-5-9-20(26)23-14-15-8-7-11-30-15/h7-8,11-13H,3-6,9-10,14H2,1-2H3,(H,23,26)(H,24,31)	WSJRHINQHDBEEH-UHFFFAOYSA-N	CCOc1cc2NC(=S)N(CCCCC(=O)NCc3occc3)C(=O)c2cc1OCC	BroadT	BRD-K06450191	BRD-K06450191-001-05-4	ChemDiv Inc.	K284-7613			CCOc1cc2[nH]c(=S)n(CCCCC(=O)NCc3ccco3)c(=O)c2cc1OCC	InChI=1S/C22H27N3O5S/c1-3-28-18-12-16-17(13-19(18)29-4-2)24-22(31)25(21(16)27)10-6-5-9-20(26)23-14-15-8-7-11-30-15/h7-8,11-13H,3-6,9-10,14H2,1-2H3,(H,23,26)(H,24,31)	WSJRHINQHDBEEH-UHFFFAOYSA-N	445.167141684							120450
2-(2-Ethoxyphenyl)-8-oxo-9-phenyl-8,9-dihydro-7H-purine-6-carboxamide	LSM-31894	BRD-K37616496, SID4251639	3245299	InChI=1S/C20H17N5O3/c1-2-28-14-11-7-6-10-13(14)18-22-15(17(21)26)16-19(24-18)25(20(27)23-16)12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H2,21,26)(H,23,27)	MMKCJCTXBHWGHK-UHFFFAOYSA-N	CCOc1ccccc1c2nc(C(=O)N)c3nc(O)n(c4ccccc4)c3n2	BroadT	BRD-K37616496	BRD-K37616496-001-05-5	ChemDiv Inc.	C926-0154			CCOc1ccccc1-c1nc(C(N)=O)c2nc(O)n(-c3ccccc3)c2n1	InChI=1S/C20H17N5O3/c1-2-28-14-11-7-6-10-13(14)18-22-15(17(21)26)16-19(24-18)25(20(27)23-16)12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H2,21,26)(H,23,27)	MMKCJCTXBHWGHK-UHFFFAOYSA-N	375.133139454							120451
STK630715	LSM-31895	BRD-K35288418, SID863569	664820	InChI=1S/C21H22N2O5/c1-26-13-20(24)23(18-6-4-5-7-19(18)28-3)12-15-10-14-11-16(27-2)8-9-17(14)22-21(15)25/h4-11H,12-13H2,1-3H3,(H,22,25)	KCXPKQKLBBJLDC-UHFFFAOYSA-N	COCC(=O)N(Cc1cc2cc(OC)ccc2nc1O)c3ccccc3OC	BroadT	BRD-K35288418	BRD-K35288418-001-05-0	InterBioScreen Ltd.	STOCK4S-79673			COCC(=O)N(Cc1cc2cc(OC)ccc2nc1O)c1ccccc1OC	InChI=1S/C21H22N2O5/c1-26-13-20(24)23(18-6-4-5-7-19(18)28-3)12-15-10-14-11-16(27-2)8-9-17(14)22-21(15)25/h4-11H,12-13H2,1-3H3,(H,22,25)	KCXPKQKLBBJLDC-UHFFFAOYSA-N	382.152871824							120452
SMR000005965	LSM-31896	BRD-K39046749, SID842769	645043	InChI=1S/C19H21N3O4S/c1-4-9-22-18(17-6-5-10-26-17)20-21-19(22)27-12-15(23)14-11-13(24-2)7-8-16(14)25-3/h5-8,10-11H,4,9,12H2,1-3H3	LOCYCRDZJGPBQB-UHFFFAOYSA-N	CCCn1c(SCC(=O)c2cc(OC)ccc2OC)nnc1c3occc3	BroadT	BRD-K39046749	BRD-K39046749-001-05-8	Asinex Ltd.	ASN 05988148			CCCn1c(SCC(=O)c2cc(OC)ccc2OC)nnc1-c1ccco1	InChI=1S/C19H21N3O4S/c1-4-9-22-18(17-6-5-10-26-17)20-21-19(22)27-12-15(23)14-11-13(24-2)7-8-16(14)25-3/h5-8,10-11H,4,9,12H2,1-3H3	LOCYCRDZJGPBQB-UHFFFAOYSA-N	387.125276872							120453
MLS000326357	LSM-31897	BRD-K57724551, SID17402189	1488716	InChI=1S/C14H12ClN3O/c1-18(2)13-7-8-17-14(12(13)9-16)19-11-5-3-10(15)4-6-11/h3-8H,1-2H3	DIKNWBKZSAJDIQ-UHFFFAOYSA-N	CN(C)c1ccnc(Oc2ccc(Cl)cc2)c1C#N	BroadT	BRD-K57724551	BRD-K57724551-001-06-2	Key Organics Ltd.	9M-044			CN(C)c1ccnc(Oc2ccc(Cl)cc2)c1C#N	InChI=1S/C14H12ClN3O/c1-18(2)13-7-8-17-14(12(13)9-16)19-11-5-3-10(15)4-6-11/h3-8H,1-2H3	DIKNWBKZSAJDIQ-UHFFFAOYSA-N	273.066889744							120454
AC1OH1F1	LSM-31898	BRD-K88150784	7204032	InChI=1S/C18H17N5O3/c1-25-14-6-4-13(5-7-14)15-11-20-23-18(21-15)22-19-10-12-3-8-16(24)17(9-12)26-2/h3-11,24H,1-2H3,(H,21,22,23)	IKJGHSGBXOVMMN-UHFFFAOYSA-N	COc1ccc(cc1)c2cnnc(NN=Cc3ccc(O)c(OC)c3)n2	BroadT	BRD-K88150784	BRD-K88150784-001-05-4	ChemDiv Inc.	5617-0329			COc1ccc(cc1)-c1cnnc(NN=Cc2ccc(O)c(OC)c2)n1	InChI=1S/C18H17N5O3/c1-25-14-6-4-13(5-7-14)15-11-20-23-18(21-15)22-19-10-12-3-8-16(24)17(9-12)26-2/h3-11,24H,1-2H3,(H,21,22,23)	IKJGHSGBXOVMMN-UHFFFAOYSA-N	351.133139454							
AC1LM5UQ	LSM-31899	BRD-K35171408	1123682	InChI=1S/C20H15F4N3O2S/c21-18(22)28-14-5-1-12(2-6-14)11-25-17-16(26-20-27(17)9-10-30-20)13-3-7-15(8-4-13)29-19(23)24/h1-8,11,18-19H,9-10H2	LHTCYTITHFDZQG-UHFFFAOYSA-N	FC(F)Oc1ccc(C=Nc2c(nc3SCCn23)c4ccc(OC(F)F)cc4)cc1	BroadT	BRD-K35171408	BRD-K35171408-001-05-0	Asinex Ltd.	BAS 01416895			FC(F)Oc1ccc(C=Nc2c(nc3SCCn23)-c2ccc(OC(F)F)cc2)cc1	InChI=1S/C20H15F4N3O2S/c21-18(22)28-14-5-1-12(2-6-14)11-25-17-16(26-20-27(17)9-10-30-20)13-3-7-15(8-4-13)29-19(23)24/h1-8,11,18-19H,9-10H2	LHTCYTITHFDZQG-UHFFFAOYSA-N	437.08211024							120456
2-Bromo-n'-(3-chlorobenzoyl)benzohydrazide	LSM-31900	BRD-K71213946, SID17415469	1378789	InChI=1S/C14H10BrClN2O2/c15-12-7-2-1-6-11(12)14(20)18-17-13(19)9-4-3-5-10(16)8-9/h1-8H,(H,17,19)(H,18,20)	AHGMTMVXQPAUJV-UHFFFAOYSA-N	Clc1cccc(c1)C(=O)NNC(=O)c2ccccc2Br	BroadT	BRD-K71213946	BRD-K71213946-001-05-4	ChemBridge Corporation	5330690			Clc1cccc(c1)C(=O)NNC(=O)c1ccccc1Br	InChI=1S/C14H10BrClN2O2/c15-12-7-2-1-6-11(12)14(20)18-17-13(19)9-4-3-5-10(16)8-9/h1-8H,(H,17,19)(H,18,20)	AHGMTMVXQPAUJV-UHFFFAOYSA-N	351.96141789							120457
MLS000545635	LSM-31901	BRD-K79147587, SID17401193	1827281	InChI=1S/C13H6N6O4/c14-7-8-5-11(18(20)21)13(12(6-8)19(22)23)17-10-4-2-1-3-9(10)15-16-17/h1-6H	KKBPVHRLGDZJFG-UHFFFAOYSA-N	[O-][N+](=O)c1cc(cc(c1n2nnc3ccccc23)[N+](=O)[O-])C#N	BroadT	BRD-K79147587	BRD-K79147587-001-06-8	Specs	AG-219/11941074			[O-][N+](=O)c1cc(cc(c1-n1nnc2ccccc12)[N+]([O-])=O)C#N	InChI=1S/C13H6N6O4/c14-7-8-5-11(18(20)21)13(12(6-8)19(22)23)17-10-4-2-1-3-9(10)15-16-17/h1-6H	KKBPVHRLGDZJFG-UHFFFAOYSA-N	310.045052732							120458
N-(3,5-Dichlorophenyl)-n'-{2-[(2-furylmethyl)thio]ethyl}urea	LSM-31902	BRD-K29642620, SID26728835	2823304	InChI=1S/C14H14Cl2N2O2S/c15-10-6-11(16)8-12(7-10)18-14(19)17-3-5-21-9-13-2-1-4-20-13/h1-2,4,6-8H,3,5,9H2,(H2,17,18,19)	YNGWGTOZIMTDTA-UHFFFAOYSA-N	Clc1cc(Cl)cc(NC(=O)NCCSCc2occc2)c1	BroadT	BRD-K29642620	BRD-K29642620-001-05-0	Maybridge	KM 10261			Clc1cc(Cl)cc(NC(=O)NCCSCc2ccco2)c1	InChI=1S/C14H14Cl2N2O2S/c15-10-6-11(16)8-12(7-10)18-14(19)17-3-5-21-9-13-2-1-4-20-13/h1-2,4,6-8H,3,5,9H2,(H2,17,18,19)	YNGWGTOZIMTDTA-UHFFFAOYSA-N	344.015303818							120459
Acetone o-([1,1'-biphenyl]-4-ylcarbonyl)oxime	LSM-31903	BRD-K16118844, SID22405084	702521	InChI=1S/C16H15NO2/c1-12(2)17-19-16(18)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-11H,1-2H3	FLCIETSVEMHMGX-UHFFFAOYSA-N	CC(=NOC(=O)c1ccc(cc1)c2ccccc2)C	BroadT	BRD-K16118844	BRD-K16118844-001-05-6	Specs	AN-329/08789010			CC(C)=NOC(=O)c1ccc(cc1)-c1ccccc1	InChI=1S/C16H15NO2/c1-12(2)17-19-16(18)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-11H,1-2H3	FLCIETSVEMHMGX-UHFFFAOYSA-N	253.11027873							120460
AC1N3SGF	LSM-31904	BRD-K23963854, SID24790926	4117513	InChI=1S/C18H21NO5S/c1-13-4-9-17(24-3)16(12-13)19-18(20)10-11-25(21,22)15-7-5-14(23-2)6-8-15/h4-9,12H,10-11H2,1-3H3,(H,19,20)	AKTQZKSTAWVSKJ-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)CCC(=O)Nc2cc(C)ccc2OC	BroadT	BRD-K23963854	BRD-K23963854-001-05-3	ChemDiv Inc.	K978-1512			COc1ccc(cc1)S(=O)(=O)CCC(=O)Nc1cc(C)ccc1OC	InChI=1S/C18H21NO5S/c1-13-4-9-17(24-3)16(12-13)19-18(20)10-11-25(21,22)15-7-5-14(23-2)6-8-15/h4-9,12H,10-11H2,1-3H3,(H,19,20)	AKTQZKSTAWVSKJ-UHFFFAOYSA-N	363.114043472							120461
CHEMBL567850	LSM-31905	BRD-K44707028, SID26514170, SID26514225, SID26514529	2931238	InChI=1S/C17H16N2O4S/c1-22-14-7-8-16(23-2)17(10-14)24(20,21)19-13-9-12-5-3-4-6-15(12)18-11-13/h3-11,19H,1-2H3	JZSPHTPWUXNQGB-UHFFFAOYSA-N	COc1ccc(OC)c(c1)S(=O)(=O)Nc2cnc3ccccc3c2	BroadT	BRD-K44707028	BRD-K44707028-001-05-0	ChemBridge Corporation	7234072			COc1ccc(OC)c(c1)S(=O)(=O)Nc1cnc2ccccc2c1	InChI=1S/C17H16N2O4S/c1-22-14-7-8-16(23-2)17(10-14)24(20,21)19-13-9-12-5-3-4-6-15(12)18-11-13/h3-11,19H,1-2H3	JZSPHTPWUXNQGB-UHFFFAOYSA-N	344.083077702							120462
MLS000088696	LSM-31906	BRD-K53757555, SID4260170	750580	InChI=1S/C16H13FN2OS/c1-11-6-8-12(9-7-11)15-18-19-16(20-15)21-10-13-4-2-3-5-14(13)17/h2-9H,10H2,1H3	SIBQEDIQAPAOSH-UHFFFAOYSA-N	Cc1ccc(cc1)c2oc(SCc3ccccc3F)nn2	BroadT	BRD-K53757555	BRD-K53757555-001-06-2	ChemBridge Corporation	7454155			Cc1ccc(cc1)-c1nnc(SCc2ccccc2F)o1	InChI=1S/C16H13FN2OS/c1-11-6-8-12(9-7-11)15-18-19-16(20-15)21-10-13-4-2-3-5-14(13)17/h2-9H,10H2,1H3	SIBQEDIQAPAOSH-UHFFFAOYSA-N	300.073261946							120463
AC1MKZMM	LSM-31907	BRD-A25993094, SID24790726	3212198	InChI=1S/C24H23ClN6O3/c1-34-14-13-27-24(33)23(17-8-10-18(25)11-9-17)31(19-5-4-12-26-15-19)22(32)16-30-21-7-3-2-6-20(21)28-29-30/h2-12,15,23H,13-14,16H2,1H3,(H,27,33)	WAURPAZAKAXOIR-UHFFFAOYSA-N	COCCNC(=O)C(N(C(=O)Cn1nnc2ccccc12)c3cccnc3)c4ccc(Cl)cc4	BroadT	BRD-A25993094	BRD-A25993094-001-05-0	Asinex Ltd.	ASN 05587373			COCCNC(=O)C(N(C(=O)Cn1nnc2ccccc12)c1cccnc1)c1ccc(Cl)cc1	InChI=1S/C24H23ClN6O3/c1-34-14-13-27-24(33)23(17-8-10-18(25)11-9-17)31(19-5-4-12-26-15-19)22(32)16-30-21-7-3-2-6-20(21)28-29-30/h2-12,15,23H,13-14,16H2,1H3,(H,27,33)	WAURPAZAKAXOIR-UHFFFAOYSA-N	478.152016366							120464
MLS000584231	LSM-31908	BRD-K12473406, SID17509939	4330749	InChI=1S/C16H13Cl2NO3S/c1-11-7-9-12(10-8-11)15(20)19-16(14(17)18)23(21,22)13-5-3-2-4-6-13/h2-10H,1H3,(H,19,20)	SVDUYLJULSXDKI-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)NC(=C(Cl)Cl)S(=O)(=O)c2ccccc2	BroadT	BRD-K12473406	BRD-K12473406-001-07-5	ChemDiv Inc.	1187-0857			Cc1ccc(cc1)C(=O)NC(=C(Cl)Cl)S(=O)(=O)c1ccccc1	InChI=1S/C16H13Cl2NO3S/c1-11-7-9-12(10-8-11)15(20)19-16(14(17)18)23(21,22)13-5-3-2-4-6-13/h2-10H,1H3,(H,19,20)	SVDUYLJULSXDKI-UHFFFAOYSA-N	368.999319396							120465
T5268343	LSM-31909	BRD-K25757224, SID24824669	2078139	InChI=1S/C15H18N2O3/c1-10-14(11(2)20-16-10)9-19-15(18)12-5-7-13(8-6-12)17(3)4/h5-8H,9H2,1-4H3	KCXPSUQLGVGEGL-UHFFFAOYSA-N	CN(C)c1ccc(cc1)C(=O)OCc2c(C)onc2C	BroadT	BRD-K25757224	BRD-K25757224-001-05-0	Enamine Ltd.	T5268343			CN(C)c1ccc(cc1)C(=O)OCc1c(C)noc1C	InChI=1S/C15H18N2O3/c1-10-14(11(2)20-16-10)9-19-15(18)12-5-7-13(8-6-12)17(3)4/h5-8H,9H2,1-4H3	KCXPSUQLGVGEGL-UHFFFAOYSA-N	274.131742456							120466
BRD-K96284156	LSM-44368		16189249	InChI=1S/C14H13N5O3/c1-10-9-13(17-16-10)14(20)18-15-8-2-3-11-4-6-12(7-5-11)19(21)22/h2-9H,1H3,(H,16,17)(H,18,20)/b3-2+,15-8?	NHCNHNRZDRIZPO-OEFVFAILSA-N	Cc1cc([nH]n1)C(=O)NN=C\C=C\c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K96284156	BRD-K96284156-001-05-1	Specs	AK-968/11180063			Cc1cc([nH]n1)C(=O)NN=C\C=C\c1ccc(cc1)[N+]([O-])=O	InChI=1S/C14H13N5O3/c1-10-9-13(17-16-10)14(20)18-15-8-2-3-11-4-6-12(7-5-11)19(21)22/h2-9H,1H3,(H,16,17)(H,18,20)/b3-2+,15-8?	NHCNHNRZDRIZPO-OEFVFAILSA-N	299.101839326							
SMR000036630	LSM-31911	BRD-K02100640, SID865775	667036	InChI=1S/C19H16N6O2S/c1-26-13-6-8-14(9-7-13)27-11-18-23-25-17(21-22-19(25)28-18)10-24-12-20-15-4-2-3-5-16(15)24/h2-9,12H,10-11H2,1H3	FZZWTGRGGPGPLE-UHFFFAOYSA-N	COc1ccc(OCc2nn3c(Cn4cnc5ccccc45)nnc3s2)cc1	BroadT	BRD-K02100640	BRD-K02100640-001-05-6	InterBioScreen Ltd.	STOCK5S-51174			COc1ccc(OCc2nn3c(Cn4cnc5ccccc45)nnc3s2)cc1	InChI=1S/C19H16N6O2S/c1-26-13-6-8-14(9-7-13)27-11-18-23-25-17(21-22-19(25)28-18)10-24-12-20-15-4-2-3-5-16(15)24/h2-9,12H,10-11H2,1H3	FZZWTGRGGPGPLE-UHFFFAOYSA-N	392.105544502							120468
AC1M4OAM	LSM-44369	BRD-K37532736	2286206	InChI=1S/C15H13ClN2O2S/c16-14-8-10-15(11-9-14)21(19,20)18-17-12-4-7-13-5-2-1-3-6-13/h1-12,18H/b7-4+,17-12?	HIIRHKAWDYRMCN-RCYQAAHFSA-N	Clc1ccc(cc1)S(=O)(=O)NN=C\C=C\c2ccccc2	BroadT	BRD-K37532736	BRD-K37532736-001-06-2	ChemBridge Corporation	5821678			Clc1ccc(cc1)S(=O)(=O)NN=C\C=C\c1ccccc1	InChI=1S/C15H13ClN2O2S/c16-14-8-10-15(11-9-14)21(19,20)18-17-12-4-7-13-5-2-1-3-6-13/h1-12,18H/b7-4+,17-12?	HIIRHKAWDYRMCN-RCYQAAHFSA-N	320.038626076							
MLS000064102	LSM-31913	BRD-K71604365, SID4260347	925484	InChI=1S/C11H12N4O/c1-7-3-4-8(2)9(5-7)10(16)15-6-13-14-11(15)12/h3-6H,1-2H3,(H2,12,14)	YZMUEWQJIGOEBX-UHFFFAOYSA-N	Cc1ccc(C)c(c1)C(=O)n2cnnc2N	BroadT	BRD-K71604365	BRD-K71604365-001-04-9	ChemBridge Corporation	7753661			Cc1ccc(C)c(c1)C(=O)n1cnnc1N	InChI=1S/C11H12N4O/c1-7-3-4-8(2)9(5-7)10(16)15-6-13-14-11(15)12/h3-6H,1-2H3,(H2,12,14)	YZMUEWQJIGOEBX-UHFFFAOYSA-N	216.101111044							120470
ST50903327	LSM-31914	BRD-K92210988, SID14730146	2225555	InChI=1S/C14H13BrN2O2/c15-12-6-1-2-7-13(12)19-10-14(18)17-9-11-5-3-4-8-16-11/h1-8H,9-10H2,(H,17,18)	YDKUWFATQAYMQH-UHFFFAOYSA-N	Brc1ccccc1OCC(=O)NCc2ccccn2	BroadT	BRD-K92210988	BRD-K92210988-001-05-4	ChemBridge Corporation	7949573			Brc1ccccc1OCC(=O)NCc1ccccn1	InChI=1S/C14H13BrN2O2/c15-12-6-1-2-7-13(12)19-10-14(18)17-9-11-5-3-4-8-16-11/h1-8H,9-10H2,(H,17,18)	YDKUWFATQAYMQH-UHFFFAOYSA-N	320.016040276							120471
SMR000249904	LSM-31915	BRD-K96493283, SID17516952	12006256	InChI=1S/C25H32N2O6/c1-15(2)17-7-9-19(10-8-17)26-22(28)14-33-25(30)23(16(3)4)27-24(29)18-11-20(31-5)13-21(12-18)32-6/h7-13,15-16,23H,14H2,1-6H3,(H,26,28)(H,27,29)/t23-/m0/s1	NEZVXQGPXYPDSG-QHCPKHFHSA-N	COc1cc(OC)cc(c1)C(=O)N[C@@H](C(C)C)C(=O)OCC(=O)Nc2ccc(cc2)C(C)C	BroadT	BRD-K96493283	BRD-K96493283-001-05-4	Enamine Ltd.	T5272894			COc1cc(OC)cc(c1)C(=O)N[C@@H](C(C)C)C(=O)OCC(=O)Nc1ccc(cc1)C(C)C	InChI=1S/C25H32N2O6/c1-15(2)17-7-9-19(10-8-17)26-22(28)14-33-25(30)23(16(3)4)27-24(29)18-11-20(31-5)13-21(12-18)32-6/h7-13,15-16,23H,14H2,1-6H3,(H,26,28)(H,27,29)/t23-/m0/s1	NEZVXQGPXYPDSG-QHCPKHFHSA-N	456.226036764							120472
SMR000079407	LSM-31916	BRD-K25842662, SID4254554	1263614	InChI=1S/C13H11N5O2S2/c1-8-6-21-12(15-8)16-10(19)7-22-13-18-17-11(20-13)9-2-4-14-5-3-9/h2-6H,7H2,1H3,(H,15,16,19)	VRRUXVDRYAOJMV-UHFFFAOYSA-N	Cc1csc(NC(=O)CSc2oc(nn2)c3ccncc3)n1	BroadT	BRD-K25842662	BRD-K25842662-001-05-9	ChemBridge Corporation	7928421			Cc1csc(NC(=O)CSc2nnc(o2)-c2ccncc2)n1	InChI=1S/C13H11N5O2S2/c1-8-6-21-12(15-8)16-10(19)7-22-13-18-17-11(20-13)9-2-4-14-5-3-9/h2-6H,7H2,1H3,(H,15,16,19)	VRRUXVDRYAOJMV-UHFFFAOYSA-N	333.035416022							120473
SMR000032275	LSM-31917	SID4246295, BRD-K04710685	3240666	InChI=1S/C22H25N3O3/c26-21(15-25-19-8-3-4-9-20(19)28-16-22(25)27)23-11-5-12-24-13-10-17-6-1-2-7-18(17)14-24/h1-4,6-9H,5,10-16H2,(H,23,26)	QNQGZBZEMUQMCU-UHFFFAOYSA-N	O=C(CN1C(=O)COc2ccccc12)NCCCN3CCc4ccccc4C3	BroadT	BRD-K04710685	BRD-K04710685-001-07-2	ChemDiv Inc.	K786-6706			O=C(CN1C(=O)COc2ccccc12)NCCCN1CCc2ccccc2C1	InChI=1S/C22H25N3O3/c26-21(15-25-19-8-3-4-9-20(19)28-16-22(25)27)23-11-5-12-24-13-10-17-6-1-2-7-18(17)14-24/h1-4,6-9H,5,10-16H2,(H,23,26)	QNQGZBZEMUQMCU-UHFFFAOYSA-N	379.18959169							120474
ST070999	LSM-31918	BRD-K12524715, SID4263727	893702	InChI=1S/C17H19NO3/c1-3-12-18-14(7-11-17(19)20)6-10-16(18)13-4-8-15(21-2)9-5-13/h3-6,8-10H,1,7,11-12H2,2H3,(H,19,20)	SGPQZLYYQVUELY-UHFFFAOYSA-N	COc1ccc(cc1)c2ccc(CCC(=O)O)n2CC=C	BroadT	BRD-K12524715	BRD-K12524715-001-05-5	ChemBridge Corporation	7590340			COc1ccc(cc1)-c1ccc(CCC(O)=O)n1CC=C	InChI=1S/C17H19NO3/c1-3-12-18-14(7-11-17(19)20)6-10-16(18)13-4-8-15(21-2)9-5-13/h3-6,8-10H,1,7,11-12H2,2H3,(H,19,20)	SGPQZLYYQVUELY-UHFFFAOYSA-N	285.136493478							120475
MLS000718242	LSM-44370	SID24804563, BRD-K03549232	1462263	InChI=1S/C24H28N4O/c1-19(2)18-28-22-11-7-6-10-21(22)25-24(28)27-16-14-26(15-17-27)23(29)13-12-20-8-4-3-5-9-20/h3-13,19H,14-18H2,1-2H3/b13-12+	QBHTUAJZNQZEGR-OUKQBFOZSA-N	CC(C)Cn1c(nc2ccccc12)N3CCN(CC3)C(=O)\C=C\c4ccccc4	BroadT	BRD-K03549232	BRD-K03549232-001-06-5	Asinex Ltd.	ASN 06355654			CC(C)Cn1c(nc2ccccc12)N1CCN(CC1)C(=O)\C=C\c1ccccc1	InChI=1S/C24H28N4O/c1-19(2)18-28-22-11-7-6-10-21(22)25-24(28)27-16-14-26(15-17-27)23(29)13-12-20-8-4-3-5-9-20/h3-13,19H,14-18H2,1-2H3/b13-12+	QBHTUAJZNQZEGR-OUKQBFOZSA-N	388.226311556							
AK-968/12117380	LSM-31920	SID24820802, BRD-K33951208	841628	InChI=1S/C14H14N4O2S/c15-12(19)11-8-3-1-2-4-10(8)21-14(11)18-13(20)9-7-16-5-6-17-9/h5-7H,1-4H2,(H2,15,19)(H,18,20)	QLVGBOYXFQCZTK-UHFFFAOYSA-N	NC(=O)c1c2CCCCc2sc1NC(=O)c3cnccn3	BroadT	BRD-K33951208	BRD-K33951208-001-05-9	Asinex Ltd.	BAS 03365789			NC(=O)c1c(NC(=O)c2cnccn2)sc2CCCCc12	InChI=1S/C14H14N4O2S/c15-12(19)11-8-3-1-2-4-10(8)21-14(11)18-13(20)9-7-16-5-6-17-9/h5-7H,1-4H2,(H2,15,19)(H,18,20)	QLVGBOYXFQCZTK-UHFFFAOYSA-N	302.083746418							120477
124317-11-9	LSM-31921	SID14728897, BRD-K50036850	3620079	InChI=1S/C21H20O2/c1-17-20(22-15-18-9-4-2-5-10-18)13-8-14-21(17)23-16-19-11-6-3-7-12-19/h2-14H,15-16H2,1H3	BJSONGFQRAVOPD-UHFFFAOYSA-N	Cc1c(OCc2ccccc2)cccc1OCc3ccccc3	BroadT	BRD-K50036850	BRD-K50036850-001-05-8	Boston University CMLD	CMLD001909			Cc1c(OCc2ccccc2)cccc1OCc1ccccc1	InChI=1S/C21H20O2/c1-17-20(22-15-18-9-4-2-5-10-18)13-8-14-21(17)23-16-19-11-6-3-7-12-19/h2-14H,15-16H2,1H3	BJSONGFQRAVOPD-UHFFFAOYSA-N	304.14632988							120478
AC1LMEZF	LSM-31922	SID24806963, BRD-K14961381	54688576	InChI=1S/C28H22N4O4/c33-25-20-13-6-10-18-11-7-15-31(24(18)20)28(36)23(25)26(34)30-32-22(16-17-8-2-1-3-9-17)29-21-14-5-4-12-19(21)27(32)35/h1-6,8-10,12-14,33H,7,11,15-16H2,(H,30,34)	TXIVFPUFTJQESD-UHFFFAOYSA-N	OC1=C(C(=O)NN2C(=Nc3ccccc3C2=O)Cc4ccccc4)C(=O)N5CCCc6cccc1c56	BroadT	BRD-K14961381	BRD-K14961381-001-05-0	Asinex Ltd.	BAS 03189491			Oc1c(C(=O)Nn2c(Cc3ccccc3)nc3ccccc3c2=O)c(=O)n2CCCc3cccc1c23	InChI=1S/C28H22N4O4/c33-25-20-13-6-10-18-11-7-15-31(24(18)20)28(36)23(25)26(34)30-32-22(16-17-8-2-1-3-9-17)29-21-14-5-4-12-19(21)27(32)35/h1-6,8-10,12-14,33H,7,11,15-16H2,(H,30,34)	TXIVFPUFTJQESD-UHFFFAOYSA-N	478.164105224							120479
T0505-0619	LSM-31923	SID17516391, BRD-K47878187	2329604	InChI=1S/C18H18ClN5OS/c1-3-24-11(2)20-15-10-12(8-9-16(15)24)17(25)22-23-18(26)21-14-7-5-4-6-13(14)19/h4-10H,3H2,1-2H3,(H,22,25)(H2,21,23,26)	NNCVEWUIOQOTKU-UHFFFAOYSA-N	CCn1c(C)nc2cc(ccc12)C(=O)NN=C(S)Nc3ccccc3Cl	BroadT	BRD-K47878187	BRD-K47878187-001-05-3	Enamine Ltd.	T0505-0619			CCn1c(C)nc2cc(ccc12)C(=O)NN=C(S)Nc1ccccc1Cl	InChI=1S/C18H18ClN5OS/c1-3-24-11(2)20-15-10-12(8-9-16(15)24)17(25)22-23-18(26)21-14-7-5-4-6-13(14)19/h4-10H,3H2,1-2H3,(H,22,25)(H2,21,23,26)	NNCVEWUIOQOTKU-UHFFFAOYSA-N	387.092058646							120480
SMR000001781	LSM-31924	BRD-K54141118, SID852031	654637	InChI=1S/C16H17N5O3S2/c1-3-14-19-20-15(26-14)17-12(22)9-25-16-21-18-13(24-16)8-23-11-6-4-5-10(2)7-11/h4-7H,3,8-9H2,1-2H3,(H,17,20,22)	JRANBLWALFTCTI-UHFFFAOYSA-N	CCc1nnc(NC(=O)CSc2oc(COc3cccc(C)c3)nn2)s1	BroadT	BRD-K54141118	BRD-K54141118-001-06-8	Asinex Ltd.	ASN 02642261			CCc1nnc(NC(=O)CSc2nnc(COc3cccc(C)c3)o2)s1	InChI=1S/C16H17N5O3S2/c1-3-14-19-20-15(26-14)17-12(22)9-25-16-21-18-13(24-16)8-23-11-6-4-5-10(2)7-11/h4-7H,3,8-9H2,1-2H3,(H,17,20,22)	JRANBLWALFTCTI-UHFFFAOYSA-N	391.077280834							120481
ASN 05557268	LSM-15446	BRD-A20477000	651418	InChI=1S/C20H25ClN6O/c1-3-18(20-22-23-24-27(20)14-17-5-4-12-28-17)25-8-10-26(11-9-25)19-13-16(21)7-6-15(19)2/h4-7,12-13,18H,3,8-11,14H2,1-2H3	SJFXIUUZVGMJJU-UHFFFAOYSA-N	CCC(N1CCN(CC1)c2cc(Cl)ccc2C)c3nnnn3Cc4occc4	BroadT	BRD-A20477000	BRD-A20477000-003-06-6	Asinex Ltd.	ASN 05557268		Cl	CCC(N1CCN(CC1)c1cc(Cl)ccc1C)c1nnnn1Cc1ccco1.Cl	InChI=1S/C20H25ClN6O.ClH/c1-3-18(20-22-23-24-27(20)14-17-5-4-12-28-17)25-8-10-26(11-9-25)19-13-16(21)7-6-15(19)2;/h4-7,12-13,18H,3,8-11,14H2,1-2H3;1H	FQMTZHRXFZDYII-UHFFFAOYSA-N	400.17783719							104088, 104088
SMR000004127	LSM-31925	BRD-K42138859, SID847283	649681	InChI=1S/C23H28N4O3/c1-26(2)11-12-27(23(29)24-15-17-7-5-4-6-8-17)16-19-13-18-14-20(30-3)9-10-21(18)25-22(19)28/h4-10,13-14H,11-12,15-16H2,1-3H3,(H,24,29)(H,25,28)	NBKAPISCVZMGEO-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(CCN(C)C)C(=O)NCc3ccccc3)cc2c1	BroadT	BRD-K42138859	BRD-K42138859-001-05-4	Asinex Ltd.	ASN 05112820			COc1ccc2nc(O)c(CN(CCN(C)C)C(=O)NCc3ccccc3)cc2c1	InChI=1S/C23H28N4O3/c1-26(2)11-12-27(23(29)24-15-17-7-5-4-6-8-17)16-19-13-18-14-20(30-3)9-10-21(18)25-22(19)28/h4-10,13-14H,11-12,15-16H2,1-3H3,(H,24,29)(H,25,28)	NBKAPISCVZMGEO-UHFFFAOYSA-N	408.216140796							120482
MLS000582063	LSM-31926	BRD-K15827385, SID17412912	1252042	InChI=1S/C20H15F3N2O3S/c1-28-15-7-5-13(6-8-15)16-10-17(20(21,22)23)25-19(24-16)29-11-12-3-2-4-14(9-12)18(26)27/h2-10H,11H2,1H3,(H,26,27)	BYHGFIYOZJWIDJ-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(nc(SCc3cccc(c3)C(=O)O)n2)C(F)(F)F	BroadT	BRD-K15827385	BRD-K15827385-001-06-6	ChemBridge Corporation	7961091			COc1ccc(cc1)-c1cc(nc(SCc2cccc(c2)C(O)=O)n1)C(F)(F)F	InChI=1S/C20H15F3N2O3S/c1-28-15-7-5-13(6-8-15)16-10-17(20(21,22)23)25-19(24-16)29-11-12-3-2-4-14(9-12)18(26)27/h2-10H,11H2,1H3,(H,26,27)	BYHGFIYOZJWIDJ-UHFFFAOYSA-N	420.07554765							120483
5-[2-(4-Bromophenyl)-2-oxoethyl]-1,3-diphenyl-2-thioxoimidazolidin-4-one	LSM-31927	BRD-A19912945, SID17512460	3436919	InChI=1S/C23H17BrN2O2S/c24-17-13-11-16(12-14-17)21(27)15-20-22(28)26(19-9-5-2-6-10-19)23(29)25(20)18-7-3-1-4-8-18/h1-14,20H,15H2	ZSJGBXSGVTXCSJ-UHFFFAOYSA-N	Brc1ccc(cc1)C(=O)CC2N(C(=S)N(C2=O)c3ccccc3)c4ccccc4	BroadT	BRD-A19912945	BRD-A19912945-001-05-9	InterBioScreen Ltd.	STOCK1S-56198			Brc1ccc(cc1)C(=O)CC1N(C(=S)N(C1=O)c1ccccc1)c1ccccc1	InChI=1S/C23H17BrN2O2S/c24-17-13-11-16(12-14-17)21(27)15-20-22(28)26(19-9-5-2-6-10-19)23(29)25(20)18-7-3-1-4-8-18/h1-14,20H,15H2	ZSJGBXSGVTXCSJ-UHFFFAOYSA-N	464.019411094							120484
1-[(3,5-Dimethyl-1H-pyrazol-4-yl)sulfonyl]-n-(5-methylpyridin-2-yl)piperidine-4-carboxamide	LSM-31928	BRD-K88543505, SID4242510	3237356	InChI=1S/C17H23N5O3S/c1-11-4-5-15(18-10-11)19-17(23)14-6-8-22(9-7-14)26(24,25)16-12(2)20-21-13(16)3/h4-5,10,14H,6-9H2,1-3H3,(H,20,21)(H,18,19,23)	KWPBJDSYSMROIB-UHFFFAOYSA-N	Cc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c3c(C)n[nH]c3C)nc1	BroadT	BRD-K88543505	BRD-K88543505-001-05-8	ChemDiv Inc.	C324-0893			Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(C)cn1	InChI=1S/C17H23N5O3S/c1-11-4-5-15(18-10-11)19-17(23)14-6-8-22(9-7-14)26(24,25)16-12(2)20-21-13(16)3/h4-5,10,14H,6-9H2,1-3H3,(H,20,21)(H,18,19,23)	KWPBJDSYSMROIB-UHFFFAOYSA-N	377.152160336							120485
BAS 07245846	LSM-31929	BRD-K07025286, SID3717246	1088830	InChI=1S/C22H20FN3O3/c23-19-5-2-1-4-18(19)21(27)24-16-7-9-17(10-8-16)25-11-13-26(14-12-25)22(28)20-6-3-15-29-20/h1-10,15H,11-14H2,(H,24,27)	XGVXTZGBRKMBCU-UHFFFAOYSA-N	Fc1ccccc1C(=O)Nc2ccc(cc2)N3CCN(CC3)C(=O)c4occc4	BroadT	BRD-K07025286	BRD-K07025286-001-05-9	Enamine Ltd.	T5241896			Fc1ccccc1C(=O)Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccco1	InChI=1S/C22H20FN3O3/c23-19-5-2-1-4-18(19)21(27)24-16-7-9-17(10-8-16)25-11-13-26(14-12-25)22(28)20-6-3-15-29-20/h1-10,15H,11-14H2,(H,24,27)	XGVXTZGBRKMBCU-UHFFFAOYSA-N	393.14886973							120486
MLS000559837	LSM-44371	BRD-K53456628	944116	InChI=1S/C16H15N3S/c1-11-3-5-12(6-4-11)15-8-7-14(19(15)2)9-13(10-17)16(18)20/h3-9H,1-2H3,(H2,18,20)/b13-9+	IRQWOJMMSKLDJQ-UKTHLTGXSA-N	Cc1ccc(cc1)c2ccc(\C=C(/C#N)\C(=N)S)n2C	BroadT	BRD-K53456628	BRD-K53456628-001-07-2	InterBioScreen Ltd.	STOCK4S-64923			Cc1ccc(cc1)-c1ccc(\C=C(/C#N)C(S)=N)n1C	InChI=1S/C16H15N3S/c1-11-3-5-12(6-4-11)15-8-7-14(19(15)2)9-13(10-17)16(18)20/h3-9H,1-2H3,(H2,18,20)/b13-9+	IRQWOJMMSKLDJQ-UKTHLTGXSA-N	281.0986682							
AC1MOVWK	LSM-31931	BRD-K17107214	3425572	InChI=1S/C30H27F4N3O5/c1-39-20-9-10-22(27(13-20)41-3)25-14-23(21-6-4-5-7-24(21)36-25)28(38)37-35-15-18-8-11-26(40-2)19(12-18)16-42-17-30(33,34)29(31)32/h4-15,29H,16-17H2,1-3H3,(H,37,38)	WSVVVAIRIWTYGE-UHFFFAOYSA-N	COc1ccc(c(OC)c1)c2cc(C(=O)NN=Cc3ccc(OC)c(COCC(F)(F)C(F)F)c3)c4ccccc4n2	BroadT	BRD-K17107214	BRD-K17107214-001-05-0	Specs	AK-968/41025742			COc1ccc(c(OC)c1)-c1cc(C(=O)NN=Cc2ccc(OC)c(COCC(F)(F)C(F)F)c2)c2ccccc2n1	InChI=1S/C30H27F4N3O5/c1-39-20-9-10-22(27(13-20)41-3)25-14-23(21-6-4-5-7-24(21)36-25)28(38)37-35-15-18-8-11-26(40-2)19(12-18)16-42-17-30(33,34)29(31)32/h4-15,29H,16-17H2,1-3H3,(H,37,38)	WSVVVAIRIWTYGE-UHFFFAOYSA-N	585.188683794							120488
AC1LR00X	LSM-44372	BRD-K01142063	1359975	InChI=1S/C17H13BrN4O2/c18-13(9-12-5-2-1-3-6-12)11-19-22-17(23)15-10-14(20-21-15)16-7-4-8-24-16/h1-11H,(H,20,21)(H,22,23)/b13-9-,19-11?	PCXZMSLUXJTINS-TZVOEULESA-N	Br\C(=C/c1ccccc1)\C=NNC(=O)c2cc([nH]n2)c3occc3	BroadT	BRD-K01142063	BRD-K01142063-001-05-7	ChemBridge Corporation	5978168			Br\C(C=NNC(=O)c1cc([nH]n1)-c1ccco1)=C/c1ccccc1	InChI=1S/C17H13BrN4O2/c18-13(9-12-5-2-1-3-6-12)11-19-22-17(23)15-10-14(20-21-15)16-7-4-8-24-16/h1-11H,(H,20,21)(H,22,23)/b13-9-,19-11?	PCXZMSLUXJTINS-TZVOEULESA-N	384.022188296							
MLS000702089	LSM-31933	BRD-K77892972, SID22405335	848481	InChI=1S/C10H7N3OS/c1-6-5-13-8-7(3-2-4-11-8)9(14)12-10(13)15-6/h2-5H,1H3	UVMANZGFIFOIDD-UHFFFAOYSA-N	CC1=CN2C(=NC(=O)c3cccnc23)S1	BroadT	BRD-K77892972	BRD-K77892972-001-06-4	Specs	AO-095/37340005			Cc1cn2c(nc(=O)c3cccnc23)s1	InChI=1S/C10H7N3OS/c1-6-5-13-8-7(3-2-4-11-8)9(14)12-10(13)15-6/h2-5H,1H3	UVMANZGFIFOIDD-UHFFFAOYSA-N	217.030982564							120490
ASN 06067822	LSM-31934	BRD-K19089958, SID14722847	1459283	InChI=1S/C23H24FN3O3/c1-16-3-2-4-18-13-19(22(28)25-21(16)18)15-27(14-17-5-7-20(24)8-6-17)23(29)26-9-11-30-12-10-26/h2-8,13H,9-12,14-15H2,1H3,(H,25,28)	HXWGMTOGGNPJHB-UHFFFAOYSA-N	Cc1cccc2cc(CN(Cc3ccc(F)cc3)C(=O)N4CCOCC4)c(O)nc12	BroadT	BRD-K19089958	BRD-K19089958-001-05-8	Asinex Ltd.	ASN 06067822			Cc1cccc2cc(CN(Cc3ccc(F)cc3)C(=O)N3CCOCC3)c(O)nc12	InChI=1S/C23H24FN3O3/c1-16-3-2-4-18-13-19(22(28)25-21(16)18)15-27(14-17-5-7-20(24)8-6-17)23(29)26-9-11-30-12-10-26/h2-8,13H,9-12,14-15H2,1H3,(H,25,28)	HXWGMTOGGNPJHB-UHFFFAOYSA-N	409.180169858							120491
T0517-1396	LSM-31935	BRD-K50726251, SID24831211	2478567	InChI=1S/C17H15ClN2O3S2/c1-3-23-17(22)14-9(2)13-15(21)19-12(20-16(13)25-14)8-24-11-7-5-4-6-10(11)18/h4-7H,3,8H2,1-2H3,(H,19,20,21)	CPNXFPOJIRMLBC-UHFFFAOYSA-N	CCOC(=O)c1sc2nc(CSc3ccccc3Cl)nc(O)c2c1C	BroadT	BRD-K50726251	BRD-K50726251-001-05-9	Enamine Ltd.	T0517-1396			CCOC(=O)c1sc2nc(CSc3ccccc3Cl)nc(O)c2c1C	InChI=1S/C17H15ClN2O3S2/c1-3-23-17(22)14-9(2)13-15(21)19-12(20-16(13)25-14)8-24-11-7-5-4-6-10(11)18/h4-7H,3,8H2,1-2H3,(H,19,20,21)	CPNXFPOJIRMLBC-UHFFFAOYSA-N	394.02126145							120492
SMR000034427	LSM-31936	BRD-K64194889, SID857488	658837	InChI=1S/C16H25N3O4S/c1-3-23-16(21)14-13(17)12(11(2)24-14)15(20)18-5-4-6-19-7-9-22-10-8-19/h3-10,17H2,1-2H3,(H,18,20)	VVWCHPIDNVOLMO-UHFFFAOYSA-N	CCOC(=O)c1sc(C)c(C(=O)NCCCN2CCOCC2)c1N	BroadT	BRD-K64194889	BRD-K64194889-001-05-4	InterBioScreen Ltd.	STOCK1S-74112			CCOC(=O)c1sc(C)c(C(=O)NCCCN2CCOCC2)c1N	InChI=1S/C16H25N3O4S/c1-3-23-16(21)14-13(17)12(11(2)24-14)15(20)18-5-4-6-19-7-9-22-10-8-19/h3-10,17H2,1-2H3,(H,18,20)	VVWCHPIDNVOLMO-UHFFFAOYSA-N	355.156577							120493
SMR000092318	LSM-31937	BRD-K85101688, SID7965595	4457834	InChI=1S/C22H18N4O4/c1-28-18-8-5-16(13-19(18)29-2)22-25-20(26-30-22)14-3-6-17(7-4-14)24-21(27)15-9-11-23-12-10-15/h3-13H,1-2H3,(H,24,27)	RSXIBWUIMVLNRR-UHFFFAOYSA-N	COc1ccc(cc1OC)c2onc(n2)c3ccc(NC(=O)c4ccncc4)cc3	BroadT	BRD-K85101688	BRD-K85101688-001-04-0	ChemDiv Inc.	K907-0342			COc1ccc(cc1OC)-c1nc(no1)-c1ccc(NC(=O)c2ccncc2)cc1	InChI=1S/C22H18N4O4/c1-28-18-8-5-16(13-19(18)29-2)22-25-20(26-30-22)14-3-6-17(7-4-14)24-21(27)15-9-11-23-12-10-15/h3-13H,1-2H3,(H,24,27)	RSXIBWUIMVLNRR-UHFFFAOYSA-N	402.132805096							120494
AN-329/42613129	LSM-31938	BRD-K32511780, SID24792566	1226822	InChI=1S/C18H16N2O3S2/c1-20(15-6-3-2-4-7-15)25(22,23)16-11-9-14(10-12-16)19-18(21)17-8-5-13-24-17/h2-13H,1H3,(H,19,21)	IQQMLKILFVGKEQ-UHFFFAOYSA-N	CN(c1ccccc1)S(=O)(=O)c2ccc(NC(=O)c3cccs3)cc2	BroadT	BRD-K32511780	BRD-K32511780-001-05-8	ChemBridge Corporation	7918487			CN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)c2cccs2)cc1	InChI=1S/C18H16N2O3S2/c1-20(15-6-3-2-4-7-15)25(22,23)16-11-9-14(10-12-16)19-18(21)17-8-5-13-24-17/h2-13H,1H3,(H,19,21)	IQQMLKILFVGKEQ-UHFFFAOYSA-N	372.060233772							120495
CID 78446141	LSM-31939	BRD-A14842104	78446141	InChI=1S/C21H28N2O4/c1-7-23(8-2)16-11-9-15(10-12-16)19-17(20(24)26-5)13(3)22-14(4)18(19)21(25)27-6/h9-12,17,19H,7-8H2,1-6H3	ZLRHUXCQAMSFSD-UHFFFAOYSA-N	CCN(CC)c1ccc(cc1)C2C(C(=O)OC)C(=NC(=C2C(=O)OC)C)C	BroadT	BRD-A14842104	BRD-A14842104-001-05-0	Asinex Ltd.	BAS 01862960			CCN(CC)c1ccc(cc1)C1C(C(=O)OC)C(C)=NC(C)=C1C(=O)OC	InChI=1S/C21H28N2O4/c1-7-23(8-2)16-11-9-15(10-12-16)19-17(20(24)26-5)13(3)22-14(4)18(19)21(25)27-6/h9-12,17,19H,7-8H2,1-6H3	ZLRHUXCQAMSFSD-UHFFFAOYSA-N	372.204907396							120496
SMR000159489	LSM-31940	BRD-K38209615, SID17407218	1002907	InChI=1S/C23H16Cl2N4O2/c24-14-10-11-17(19(25)12-14)21-13-18(16-8-4-5-9-20(16)27-21)22(30)28-29-23(31)26-15-6-2-1-3-7-15/h1-13H,(H,28,30)(H2,26,29,31)	RGBGXPAVLXGXON-UHFFFAOYSA-N	Clc1ccc(c(Cl)c1)c2cc(C(=O)NNC(=O)Nc3ccccc3)c4ccccc4n2	BroadT	BRD-K38209615	BRD-K38209615-001-06-2	Specs	AK-968/15603031			Clc1ccc(c(Cl)c1)-c1cc(C(=O)NNC(=O)Nc2ccccc2)c2ccccc2n1	InChI=1S/C23H16Cl2N4O2/c24-14-10-11-17(19(25)12-14)21-13-18(16-8-4-5-9-20(16)27-21)22(30)28-29-23(31)26-15-6-2-1-3-7-15/h1-13H,(H,28,30)(H2,26,29,31)	RGBGXPAVLXGXON-UHFFFAOYSA-N	450.065031212							120497
N-(3,5-Dimethoxyphenyl)-2-(2,2-dimethyl-5-oxo-4-phenyl-2,5-dihydro-1H-imidazol-1-yl)acetamide	LSM-31941	BRD-K89094496, SID24819616	2141008	InChI=1S/C21H23N3O4/c1-21(2)23-19(14-8-6-5-7-9-14)20(26)24(21)13-18(25)22-15-10-16(27-3)12-17(11-15)28-4/h5-12H,13H2,1-4H3,(H,22,25)	RDXMAGZBMFXGQE-UHFFFAOYSA-N	COc1cc(NC(=O)CN2C(=O)C(=NC2(C)C)c3ccccc3)cc(OC)c1	BroadT	BRD-K89094496	BRD-K89094496-001-05-2	ChemDiv Inc.	C924-1136			COc1cc(NC(=O)CN2C(=O)C(=NC2(C)C)c2ccccc2)cc(OC)c1	InChI=1S/C21H23N3O4/c1-21(2)23-19(14-8-6-5-7-9-14)20(26)24(21)13-18(25)22-15-10-16(27-3)12-17(11-15)28-4/h5-12H,13H2,1-4H3,(H,22,25)	RDXMAGZBMFXGQE-UHFFFAOYSA-N	381.168856246							120498
3-Chloro-4-(isopropylsulfonyl)-2-thiophenecarbohydrazide	LSM-31942	BRD-K21753319, SID26726601	2819658	InChI=1S/C8H11ClN2O3S2/c1-4(2)16(13,14)5-3-15-7(6(5)9)8(12)11-10/h3-4H,10H2,1-2H3,(H,11,12)	UFJMBCWOADVTNU-UHFFFAOYSA-N	CC(C)S(=O)(=O)c1csc(C(=O)NN)c1Cl	BroadT	BRD-K21753319	BRD-K21753319-001-05-9	Maybridge	KM 02381			CC(C)S(=O)(=O)c1csc(C(=O)NN)c1Cl	InChI=1S/C8H11ClN2O3S2/c1-4(2)16(13,14)5-3-15-7(6(5)9)8(12)11-10/h3-4H,10H2,1-2H3,(H,11,12)	UFJMBCWOADVTNU-UHFFFAOYSA-N	281.989961322							120499
SMR000093932	LSM-31943	BRD-A46566149, SID7965431	5307618	InChI=1S/C22H19N3O3/c1-2-28-22(27)15-9-11-16(12-10-15)24-20-18-7-3-4-8-19(18)21(26)25(20)17-6-5-13-23-14-17/h3-14,20,24H,2H2,1H3	WUNLPTYESRFQGA-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC2N(C(=O)c3ccccc23)c4cccnc4)cc1	BroadT	BRD-A46566149	BRD-A46566149-001-05-4	ChemDiv Inc.	C430-0395			CCOC(=O)c1ccc(NC2N(C(=O)c3ccccc23)c2cccnc2)cc1	InChI=1S/C22H19N3O3/c1-2-28-22(27)15-9-11-16(12-10-15)24-20-18-7-3-4-8-19(18)21(26)25(20)17-6-5-13-23-14-17/h3-14,20,24H,2H2,1H3	WUNLPTYESRFQGA-UHFFFAOYSA-N	373.142641498							120500
2-(6-Chloropyridin-3-yl)-1H-benzimidazole	LSM-31944	BRD-K02371763, SID26657883	1488390	InChI=1S/C12H8ClN3/c13-11-6-5-8(7-14-11)12-15-9-3-1-2-4-10(9)16-12/h1-7H,(H,15,16)	YCANYPPCSFCTEN-UHFFFAOYSA-N	Clc1ccc(cn1)c2nc3ccccc3[nH]2	BroadT	BRD-K02371763	BRD-K02371763-001-05-4	Enamine Ltd.	EN300-13910			Clc1ccc(cn1)-c1nc2ccccc2[nH]1	InChI=1S/C12H8ClN3/c13-11-6-5-8(7-14-11)12-15-9-3-1-2-4-10(9)16-12/h1-7H,(H,15,16)	YCANYPPCSFCTEN-UHFFFAOYSA-N	229.040674996							120501
ST061364	LSM-44373	SID24807649, BRD-K56149020	839821	InChI=1S/C12H10N2O2/c15-12(6-5-11-4-2-8-16-11)14-10-3-1-7-13-9-10/h1-9H,(H,14,15)/b6-5+	ZETGWKCJXLTOQB-AATRIKPKSA-N	O=C(Nc1cccnc1)\C=C\c2occc2	BroadT	BRD-K56149020	BRD-K56149020-001-05-8	Asinex Ltd.	BAS 00892858			O=C(Nc1cccnc1)\C=C\c1ccco1	InChI=1S/C12H10N2O2/c15-12(6-5-11-4-2-8-16-11)14-10-3-1-7-13-9-10/h1-9H,(H,14,15)/b6-5+	ZETGWKCJXLTOQB-AATRIKPKSA-N	214.07422758							
MLS000675371	LSM-31946	BRD-K22875057, SID24793443	969593	InChI=1S/C16H17NO2S/c1-19-12-6-4-5-11(9-12)17-16(18)14-10-20-15-8-3-2-7-13(14)15/h4-6,9-10H,2-3,7-8H2,1H3,(H,17,18)	HBMDVBUCKJGLSI-UHFFFAOYSA-N	COc1cccc(NC(=O)c2csc3CCCCc23)c1	BroadT	BRD-K22875057	BRD-K22875057-001-05-5	ChemBridge Corporation	7647807			COc1cccc(NC(=O)c2csc3CCCCc23)c1	InChI=1S/C16H17NO2S/c1-19-12-6-4-5-11(9-12)17-16(18)14-10-20-15-8-3-2-7-13(14)15/h4-6,9-10H,2-3,7-8H2,1H3,(H,17,18)	HBMDVBUCKJGLSI-UHFFFAOYSA-N	287.097999484							120503
1-Ethyl-2-mercapto-1H-benzoimidazole-5-sulfonic acid diethylamide	LSM-31947	BRD-K57173429, SID24836592	3427299	InChI=1S/C13H19N3O2S2/c1-4-15(5-2)20(17,18)10-7-8-12-11(9-10)14-13(19)16(12)6-3/h7-9H,4-6H2,1-3H3,(H,14,19)	FBRKJRIPNIJZRZ-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(S)n2CC	BroadT	BRD-K57173429	BRD-K57173429-001-05-4	Enamine Ltd.	T0517-8562			CCN(CC)S(=O)(=O)c1ccc2n(CC)c(S)nc2c1	InChI=1S/C13H19N3O2S2/c1-4-15(5-2)20(17,18)10-7-8-12-11(9-10)14-13(19)16(12)6-3/h7-9H,4-6H2,1-3H3,(H,14,19)	FBRKJRIPNIJZRZ-UHFFFAOYSA-N	313.091868258							120504
ZINC00118491	LSM-31948	BRD-K24525269, SID14726209	718799	InChI=1S/C14H13NO4S/c1-18-14(17)11-8-4-2-6-10(8)20-13(11)15-12(16)9-5-3-7-19-9/h3,5,7H,2,4,6H2,1H3,(H,15,16)	ZMTZGWGREAHCNN-UHFFFAOYSA-N	COC(=O)c1c2CCCc2sc1NC(=O)c3occc3	BroadT	BRD-K24525269	BRD-K24525269-001-06-6	Asinex Ltd.	BAS 01292311			COC(=O)c1c(NC(=O)c2ccco2)sc2CCCc12	InChI=1S/C14H13NO4S/c1-18-14(17)11-8-4-2-6-10(8)20-13(11)15-12(16)9-5-3-7-19-9/h3,5,7H,2,4,6H2,1H3,(H,15,16)	ZMTZGWGREAHCNN-UHFFFAOYSA-N	291.056528596							120505
AC1M2MSH	LSM-31949	BRD-K24864035, SID22406379	2120009	InChI=1S/C25H24N2O5/c1-2-31-22-14-12-21(13-15-22)27-25(30)19-8-10-20(11-9-19)26-23(28)17-32-24(29)16-18-6-4-3-5-7-18/h3-15H,2,16-17H2,1H3,(H,26,28)(H,27,30)	YQPCMSBXQXXFQW-UHFFFAOYSA-N	CCOc1ccc(NC(=O)c2ccc(NC(=O)COC(=O)Cc3ccccc3)cc2)cc1	BroadT	BRD-K24864035	BRD-K24864035-001-05-4	Enamine Ltd.	T5272593			CCOc1ccc(NC(=O)c2ccc(NC(=O)COC(=O)Cc3ccccc3)cc2)cc1	InChI=1S/C25H24N2O5/c1-2-31-22-14-12-21(13-15-22)27-25(30)19-8-10-20(11-9-19)26-23(28)17-32-24(29)16-18-6-4-3-5-7-18/h3-15H,2,16-17H2,1H3,(H,26,28)(H,27,30)	YQPCMSBXQXXFQW-UHFFFAOYSA-N	432.168521888							120506
N-Benzyl-n-(furan-2-ylmethyl)-4-methylbenzenesulfonamide	LSM-31950	BRD-K38017028, SID7974321	718532	InChI=1S/C19H19NO3S/c1-16-9-11-19(12-10-16)24(21,22)20(15-18-8-5-13-23-18)14-17-6-3-2-4-7-17/h2-13H,14-15H2,1H3	NYTGEBIBTPOFKY-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N(Cc2occc2)Cc3ccccc3	BroadT	BRD-K38017028	BRD-K38017028-001-05-2	ChemBridge Corporation	5994075			Cc1ccc(cc1)S(=O)(=O)N(Cc1ccco1)Cc1ccccc1	InChI=1S/C19H19NO3S/c1-16-9-11-19(12-10-16)24(21,22)20(15-18-8-5-13-23-18)14-17-6-3-2-4-7-17/h2-13H,14-15H2,1H3	NYTGEBIBTPOFKY-UHFFFAOYSA-N	341.108564168							120507
MLS000570338	LSM-31951	BRD-K17743313, SID17388495	5636759	InChI=1S/C19H17NO5/c1-20(2)14-5-3-4-12(8-14)19(23)24-11-13-9-18(22)25-17-10-15(21)6-7-16(13)17/h3-10,21H,11H2,1-2H3	PLWWIPLCBQSMCQ-UHFFFAOYSA-N	CN(C)c1cccc(c1)C(=O)OCC2=CC(=O)Oc3cc(O)ccc23	BroadT	BRD-K17743313	BRD-K17743313-001-06-0	Enamine Ltd.	T5237824			CN(C)c1cccc(c1)C(=O)OCc1cc(=O)oc2cc(O)ccc12	InChI=1S/C19H17NO5/c1-20(2)14-5-3-4-12(8-14)19(23)24-11-13-9-18(22)25-17-10-15(21)6-7-16(13)17/h3-10,21H,11H2,1-2H3	PLWWIPLCBQSMCQ-UHFFFAOYSA-N	339.110672654							120508
AC1ND5P0	LSM-31952	BRD-K07662722, SID24837650	4544705	InChI=1S/C22H19N5O3/c1-30-12-11-26-18-20(24-19(26)17-9-7-15(13-23)8-10-17)27(22(29)25-21(18)28)14-16-5-3-2-4-6-16/h2-10H,11-12,14H2,1H3,(H,25,28,29)	IYYXHZZNRSYNIR-UHFFFAOYSA-N	COCCn1c(nc2N(Cc3ccccc3)C(=O)NC(=O)c12)c4ccc(cc4)C#N	BroadT	BRD-K07662722	BRD-K07662722-001-05-1	Enamine Ltd.	T5256406			COCCn1c(nc2n(Cc3ccccc3)c(=O)[nH]c(=O)c12)-c1ccc(cc1)C#N	InChI=1S/C22H19N5O3/c1-30-12-11-26-18-20(24-19(26)17-9-7-15(13-23)8-10-17)27(22(29)25-21(18)28)14-16-5-3-2-4-6-16/h2-10H,11-12,14H2,1H3,(H,25,28,29)	IYYXHZZNRSYNIR-UHFFFAOYSA-N	401.148789518							120509
T0509-3396	LSM-31953	BRD-K06313694, SID22406800	2358736	InChI=1S/C18H15NO3S/c20-15(13-6-2-1-3-7-13)12-22-18(21)11-10-17-19-14-8-4-5-9-16(14)23-17/h1-9H,10-12H2	TURJQVVMDZYPPL-UHFFFAOYSA-N	O=C(CCc1nc2ccccc2s1)OCC(=O)c3ccccc3	BroadT	BRD-K06313694	BRD-K06313694-001-05-6	Enamine Ltd.	T0509-3396			O=C(CCc1nc2ccccc2s1)OCC(=O)c1ccccc1	InChI=1S/C18H15NO3S/c20-15(13-6-2-1-3-7-13)12-22-18(21)11-10-17-19-14-8-4-5-9-16(14)23-17/h1-9H,10-12H2	TURJQVVMDZYPPL-UHFFFAOYSA-N	325.07726404							120510
MLS000871661	LSM-44374	SID24814656, BRD-K21695872	16194440	InChI=1S/C17H12ClN5O3S2/c1-28(25,26)17-21-27-16-20-15(24)11(14(19)23(16)17)9-10-5-4-8-22(10)13-7-3-2-6-12(13)18/h2-9,19H,1H3/b11-9-,19-14?	AXOJXUIKVYEEHL-SKGSMITLSA-N	CS(=O)(=O)C1=NSC2=NC(=O)\C(=C/c3cccn3c4ccccc4Cl)\C(=N)N12	BroadT	BRD-K21695872	BRD-K21695872-001-05-1	ChemDiv Inc.	C370-6086			CS(=O)(=O)C1=NSC2=NC(=O)\C(=C/c3cccn3-c3ccccc3Cl)C(=N)N12	InChI=1S/C17H12ClN5O3S2/c1-28(25,26)17-21-27-16-20-15(24)11(14(19)23(16)17)9-10-5-4-8-22(10)13-7-3-2-6-12(13)18/h2-9,19H,1H3/b11-9-,19-14?	AXOJXUIKVYEEHL-SKGSMITLSA-N	433.007008384							
F1666-0034	LSM-31955	BRD-A03668899, SID850144	618900	InChI=1S/C17H27N3O/c1-2-20-11-13-7-6-8-16(12-20)14(13)18-17(19-15(16)21)9-4-3-5-10-17/h13H,2-12H2,1H3,(H,19,21)	ICFQVBLKMFUCBQ-UHFFFAOYSA-N	CCN1CC2CCCC3(C1)C(=O)NC4(CCCCC4)N=C23	BroadT	BRD-A03668899	BRD-A03668899-001-05-1	Asinex Ltd.	BAS 09667695			CCN1CC2CCCC3(C1)C(=O)NC1(CCCCC1)N=C23	InChI=1S/C17H27N3O/c1-2-20-11-13-7-6-8-16(12-20)14(13)18-17(19-15(16)21)9-4-3-5-10-17/h13H,2-12H2,1H3,(H,19,21)	ICFQVBLKMFUCBQ-UHFFFAOYSA-N	289.215412514							120512
Methyl 4-(5-{[(2-hydroxy-2-phenylethyl)amino]methyl}furan-2-yl)benzoate	LSM-15447	BRD-A36171447	666476	InChI=1S/C21H21NO4/c1-25-21(24)17-9-7-16(8-10-17)20-12-11-18(26-20)13-22-14-19(23)15-5-3-2-4-6-15/h2-12,19,22-23H,13-14H2,1H3	IZCMAOLFFOUIRG-UHFFFAOYSA-N	COC(=O)c1ccc(cc1)c2oc(CNCC(O)c3ccccc3)cc2	BroadT	BRD-A36171447	BRD-A36171447-003-06-8	InterBioScreen Ltd.	STOCK5S-39794		Cl	COC(=O)c1ccc(cc1)-c1ccc(CNCC(O)c2ccccc2)o1.Cl	InChI=1S/C21H21NO4.ClH/c1-25-21(24)17-9-7-16(8-10-17)20-12-11-18(26-20)13-22-14-19(23)15-5-3-2-4-6-15;/h2-12,19,22-23H,13-14H2,1H3;1H	VPHXYEAPLQLQRZ-UHFFFAOYSA-N	351.147058162							104089, 104089
Methyl 8-fluoro-4H-thieno[3,2-c]chromene-2-carboxylate	LSM-31956	BRD-K56384677, SID26727399	2739654	InChI=1S/C13H9FO3S/c1-16-13(15)11-4-7-6-17-10-3-2-8(14)5-9(10)12(7)18-11/h2-5H,6H2,1H3	WKUSYBGGANBUCI-UHFFFAOYSA-N	COC(=O)c1cc2COc3ccc(F)cc3c2s1	BroadT	BRD-K56384677	BRD-K56384677-001-05-7	Maybridge	SEW 01765			COC(=O)c1cc2COc3ccc(F)cc3-c2s1	InChI=1S/C13H9FO3S/c1-16-13(15)11-4-7-6-17-10-3-2-8(14)5-9(10)12(7)18-11/h2-5H,6H2,1H3	WKUSYBGGANBUCI-UHFFFAOYSA-N	264.025643038							120513
2-{5-[(3-Chlorophenyl)thio]-2-thienyl}pyridine	LSM-31957	BRD-K67905771, SID26728579	2820903	InChI=1S/C15H10ClNS2/c16-11-4-3-5-12(10-11)18-15-8-7-14(19-15)13-6-1-2-9-17-13/h1-10H	OVDSJRWWDQHNEL-UHFFFAOYSA-N	Clc1cccc(Sc2ccc(s2)c3ccccn3)c1	BroadT	BRD-K67905771	BRD-K67905771-001-05-1	Maybridge	KM 05085			Clc1cccc(Sc2ccc(s2)-c2ccccn2)c1	InChI=1S/C15H10ClNS2/c16-11-4-3-5-12(10-11)18-15-8-7-14(19-15)13-6-1-2-9-17-13/h1-10H	OVDSJRWWDQHNEL-UHFFFAOYSA-N	302.99431842							120514
N-[3-(Benzylamino)propyl]pyridine-2-carboxamide	LSM-15523	BRD-K62965224	653386	InChI=1S/C16H19N3O/c20-16(15-9-4-5-11-18-15)19-12-6-10-17-13-14-7-2-1-3-8-14/h1-5,7-9,11,17H,6,10,12-13H2,(H,19,20)	GGUVPGZAANNKDU-UHFFFAOYSA-N	O=C(NCCCNCc1ccccc1)c2ccccn2	BroadT	BRD-K62965224	BRD-K62965224-051-07-4	Asinex Ltd.	BAS 05399163		OC(=O)/C=C/C(=O)O	O=C(NCCCNCc1ccccc1)c1ccccn1.OC(=O)/C=C/C(=O)O	InChI=1S/C16H19N3O.C4H4O4/c20-16(15-9-4-5-11-18-15)19-12-6-10-17-13-14-7-2-1-3-8-14;5-3(6)1-2-4(7)8/h1-5,7-9,11,17H,6,10,12-13H2,(H,19,20);1-2H,(H,5,6)(H,7,8)/b;2-1+	RYCAZGBIJDPDEE-WLHGVMLRSA-N	269.152812258							104160, 104160
SMR000032837	LSM-31958	BRD-K35240878, SID4244746	3239302	InChI=1S/C21H22N4O4S/c1-16-5-2-3-6-19(16)30(27,28)15-17-7-8-18(29-17)20(26)24-11-13-25(14-12-24)21-22-9-4-10-23-21/h2-10H,11-15H2,1H3	GWQLLHKETFNQCK-UHFFFAOYSA-N	Cc1ccccc1S(=O)(=O)Cc2oc(cc2)C(=O)N3CCN(CC3)c4ncccn4	BroadT	BRD-K35240878	BRD-K35240878-001-05-4	ChemDiv Inc.	K788-6575			Cc1ccccc1S(=O)(=O)Cc1ccc(o1)C(=O)N1CCN(CC1)c1ncccn1	InChI=1S/C21H22N4O4S/c1-16-5-2-3-6-19(16)30(27,28)15-17-7-8-18(29-17)20(26)24-11-13-25(14-12-24)21-22-9-4-10-23-21/h2-10H,11-15H2,1H3	GWQLLHKETFNQCK-UHFFFAOYSA-N	426.136175914							120515
ASN 04887447	LSM-31959	BRD-K38929751, SID848856	651320	InChI=1S/C17H18N2O4S2/c20-24(21,18-14-5-6-14)15-7-9-16(10-8-15)25(22,23)19-12-11-13-3-1-2-4-17(13)19/h1-4,7-10,14,18H,5-6,11-12H2	IIYVGELJZYVFQO-UHFFFAOYSA-N	O=S(=O)(NC1CC1)c2ccc(cc2)S(=O)(=O)N3CCc4ccccc34	BroadT	BRD-K38929751	BRD-K38929751-001-05-1	Asinex Ltd.	ASN 04887447			O=S(=O)(NC1CC1)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc12	InChI=1S/C17H18N2O4S2/c20-24(21,18-14-5-6-14)15-7-9-16(10-8-15)25(22,23)19-12-11-13-3-1-2-4-17(13)19/h1-4,7-10,14,18H,5-6,11-12H2	IIYVGELJZYVFQO-UHFFFAOYSA-N	378.070798456							120516
SMR000033608	LSM-31960	BRD-K28165749, SID26724792, SID4250126	3243983	InChI=1S/C25H30N4O2/c1-31-23-10-8-22(9-11-23)28-13-15-29(16-14-28)24-12-7-21(17-20(24)18-26)27-25(30)19-5-3-2-4-6-19/h7-12,17,19H,2-6,13-16H2,1H3,(H,27,30)	CXVYOXRNBIRROT-UHFFFAOYSA-N	COc1ccc(cc1)N2CCN(CC2)c3ccc(NC(=O)C4CCCCC4)cc3C#N	BroadT	BRD-K28165749	BRD-K28165749-001-05-9	ChemDiv Inc.	R052-1674			COc1ccc(cc1)N1CCN(CC1)c1ccc(NC(=O)C2CCCCC2)cc1C#N	InChI=1S/C25H30N4O2/c1-31-23-10-8-22(9-11-23)28-13-15-29(16-14-28)24-12-7-21(17-20(24)18-26)27-25(30)19-5-3-2-4-6-19/h7-12,17,19H,2-6,13-16H2,1H3,(H,27,30)	CXVYOXRNBIRROT-UHFFFAOYSA-N	418.23687624							120517
MLS000050218	LSM-31961	BRD-K45282766, SID4256341	2213538	InChI=1S/C27H22N4O4/c32-27(28-19-6-8-20(9-7-19)31-11-15-33-16-12-31)18-5-10-21-22(17-18)30-26(24-4-2-14-35-24)25(29-21)23-3-1-13-34-23/h1-10,13-14,17H,11-12,15-16H2,(H,28,32)	VAWUOZIMUBLOFU-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)N2CCOCC2)c3ccc4nc(c5occc5)c(nc4c3)c6occc6	BroadT	BRD-K45282766	BRD-K45282766-001-05-9	ChemBridge Corporation	7846724			O=C(Nc1ccc(cc1)N1CCOCC1)c1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1	InChI=1S/C27H22N4O4/c32-27(28-19-6-8-20(9-7-19)31-11-15-33-16-12-31)18-5-10-21-22(17-18)30-26(24-4-2-14-35-24)25(29-21)23-3-1-13-34-23/h1-10,13-14,17H,11-12,15-16H2,(H,28,32)	VAWUOZIMUBLOFU-UHFFFAOYSA-N	466.164105224							120518
MLS000568601	LSM-31962	BRD-K50417536, SID17385979	2682644	InChI=1S/C17H16F2N6O4S/c18-15(19)29-11-5-3-10(4-6-11)14-23-24-17(25(14)20)30-9-13(26)22-16(27)21-8-12-2-1-7-28-12/h1-7,15H,8-9,20H2,(H2,21,22,26,27)	RWXZKHSBCIAOEJ-UHFFFAOYSA-N	Nn1c(SCC(=O)NC(=O)NCc2occc2)nnc1c3ccc(OC(F)F)cc3	BroadT	BRD-K50417536	BRD-K50417536-001-05-2	Enamine Ltd.	ZT-9541000			Nn1c(SCC(=O)NC(=O)NCc2ccco2)nnc1-c1ccc(OC(F)F)cc1	InChI=1S/C17H16F2N6O4S/c18-15(19)29-11-5-3-10(4-6-11)14-23-24-17(25(14)20)30-9-13(26)22-16(27)21-8-12-2-1-7-28-12/h1-7,15H,8-9,20H2,(H2,21,22,26,27)	RWXZKHSBCIAOEJ-UHFFFAOYSA-N	438.092180142							120519
MLS000067963	LSM-15448	BRD-A79097167	655973	InChI=1S/C18H17N3O3/c22-15(12-5-6-16-17(9-12)24-11-23-16)10-21-14-4-2-1-3-13(14)20-8-7-19-18(20)21/h1-6,9,15,22H,7-8,10-11H2	AUSZIBBUZHVDLH-UHFFFAOYSA-N	OC(CN1C2=NCCN2c3ccccc13)c4ccc5OCOc5c4	BroadT	BRD-A79097167	BRD-A79097167-003-05-3	Asinex Ltd.	BAS 04207878		Cl	OC(CN1C2=NCCN2c2ccccc12)c1ccc2OCOc2c1.Cl	InChI=1S/C18H17N3O3.ClH/c22-15(12-5-6-16-17(9-12)24-11-23-16)10-21-14-4-2-1-3-13(14)20-8-7-19-18(20)21;/h1-6,9,15,22H,7-8,10-11H2;1H	MGKXIAIKBYFJNY-UHFFFAOYSA-N	323.126991434							104090, 104090
TCMDC-124170	LSM-31963	BRD-K31030467, GNF-PF-5555, TCMDC-124170	5761549	InChI=1S/C18H23NO3/c1-3-4-5-6-12-9-15(20)17-13-7-8-19(2)11-14(13)18(21)22-16(17)10-12/h9-10,20H,3-8,11H2,1-2H3	MEBZGLZNIWIHGA-UHFFFAOYSA-N	CCCCCc1cc(O)c2C3=C(CN(C)CC3)C(=O)Oc2c1	BroadT	BRD-K31030467	BRD-K31030467-001-05-0	Asinex Ltd.	BAS 01053389			CCCCCc1cc(O)c2c3CCN(C)Cc3c(=O)oc2c1	InChI=1S/C18H23NO3/c1-3-4-5-6-12-9-15(20)17-13-7-8-19(2)11-14(13)18(21)22-16(17)10-12/h9-10,20H,3-8,11H2,1-2H3	MEBZGLZNIWIHGA-UHFFFAOYSA-N	301.167793606							120520
AC1MCG0A	LSM-44375	BRD-K82216975	2768718	InChI=1S/C23H22N6O3/c1-16-12-13-24-23(27-16)25-15-20(28-21(30)18-6-4-3-5-7-18)22(31)29-26-14-17-8-10-19(32-2)11-9-17/h3-15H,1-2H3,(H,28,30)(H,29,31)(H,24,25,27)/b20-15+,26-14?	WTAPNQLJGXVTTG-DDRJSLICSA-N	COc1ccc(C=NNC(=O)\C(=C/Nc2nccc(C)n2)\NC(=O)c3ccccc3)cc1	BroadT	BRD-K82216975	BRD-K82216975-001-05-8	Key Organics Ltd.	12F-932			COc1ccc(C=NNC(=O)C(\NC(=O)c2ccccc2)=C/Nc2nccc(C)n2)cc1	InChI=1S/C23H22N6O3/c1-16-12-13-24-23(27-16)25-15-20(28-21(30)18-6-4-3-5-7-18)22(31)29-26-14-17-8-10-19(32-2)11-9-17/h3-15H,1-2H3,(H,28,30)(H,29,31)(H,24,25,27)/b20-15+,26-14?	WTAPNQLJGXVTTG-DDRJSLICSA-N	430.175338624							
2-(2'-Methoxyphenyl)-1H-indole	LSM-31965	2-(2-Methoxyphenyl)-1H-Indole, SID14719292, BRD-K82784817	901191	InChI=1S/C15H13NO/c1-17-15-9-5-3-7-12(15)14-10-11-6-2-4-8-13(11)16-14/h2-10,16H,1H3	GYUBKMFGRAIVMZ-UHFFFAOYSA-N	COc1ccccc1c2cc3ccccc3[nH]2	BroadT	BRD-K82784817	BRD-K82784817-001-06-5	Specs	AI-204/42879112			COc1ccccc1-c1cc2ccccc2[nH]1	InChI=1S/C15H13NO/c1-17-15-9-5-3-7-12(15)14-10-11-6-2-4-8-13(11)16-14/h2-10,16H,1H3	GYUBKMFGRAIVMZ-UHFFFAOYSA-N	223.099714046							120522
CHEMBL1499599	LSM-31966	SID4259864, BRD-K05902089	869579	InChI=1S/C10H13N5/c1-8-11-12-9-4-5-10(13-15(8)9)14-6-2-3-7-14/h4-5H,2-3,6-7H2,1H3	ODRDNKHQIVRNRC-UHFFFAOYSA-N	Cc1nnc2ccc(nn12)N3CCCC3	BroadT	BRD-K05902089	BRD-K05902089-001-05-0	ChemBridge Corporation	5745485			Cc1nnc2ccc(nn12)N1CCCC1	InChI=1S/C10H13N5/c1-8-11-12-9-4-5-10(13-15(8)9)14-6-2-3-7-14/h4-5H,2-3,6-7H2,1H3	ODRDNKHQIVRNRC-UHFFFAOYSA-N	203.117095466							120523
BAS 03615333	LSM-31967	SID24789664, BRD-K48325920	2915728	InChI=1S/C18H23N5O4S/c1-2-28(26,27)22-10-8-21(9-11-22)16-5-6-18(23(24)25)17(12-16)20-14-15-4-3-7-19-13-15/h3-7,12-13,20H,2,8-11,14H2,1H3	FZQUZQSRWWLKFF-UHFFFAOYSA-N	CCS(=O)(=O)N1CCN(CC1)c2ccc(c(NCc3cccnc3)c2)[N+](=O)[O-]	BroadT	BRD-K48325920	BRD-K48325920-001-05-6	Asinex Ltd.	BAS 03615333			CCS(=O)(=O)N1CCN(CC1)c1ccc(c(NCc2cccnc2)c1)[N+]([O-])=O	InChI=1S/C18H23N5O4S/c1-2-28(26,27)22-10-8-21(9-11-22)16-5-6-18(23(24)25)17(12-16)20-14-15-4-3-7-19-13-15/h3-7,12-13,20H,2,8-11,14H2,1H3	FZQUZQSRWWLKFF-UHFFFAOYSA-N	405.147074956							120524
SMR000034840	LSM-31968	BRD-K61485947	663274	InChI=1S/C19H21NO4/c1-3-24-19(23)13-8-10-20(11-9-13)12(2)16-17(21)14-6-4-5-7-15(14)18(16)22/h4-7,13H,3,8-11H2,1-2H3	LJBVQFICKAVNOV-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC1)C(C)=C1C(=O)c2ccccc2C1=O	BroadT	BRD-K61485947	BRD-K61485947-001-06-7	InterBioScreen Ltd.	STOCK4S-28916			CCOC(=O)C1CCN(CC1)C(C)=C1C(=O)c2ccccc2C1=O	InChI=1S/C19H21NO4/c1-3-24-19(23)13-8-10-20(11-9-13)12(2)16-17(21)14-6-4-5-7-15(14)18(16)22/h4-7,13H,3,8-11H2,1-2H3	LJBVQFICKAVNOV-UHFFFAOYSA-N	327.147058162							120525
MLS000099252	LSM-31969	BRD-K67734449, SID4258559	893341	InChI=1S/C17H17N5O/c1-2-12-22-20-17(19-21-22)18-16(23)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-11H,2,12H2,1H3,(H,18,20,23)	USMGJPPGRRWUIT-UHFFFAOYSA-N	CCCn1nnc(NC(=O)c2ccc(cc2)c3ccccc3)n1	BroadT	BRD-K67734449	BRD-K67734449-001-05-7	ChemBridge Corporation	7574354			CCCn1nnc(NC(=O)c2ccc(cc2)-c2ccccc2)n1	InChI=1S/C17H17N5O/c1-2-12-22-20-17(19-21-22)18-16(23)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-11H,2,12H2,1H3,(H,18,20,23)	USMGJPPGRRWUIT-UHFFFAOYSA-N	307.143310214							120526
2-[(2,4-Dimethoxyphenyl)methylidene]-6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione	LSM-31970	BRD-K76921877	4154873	InChI=1S/C15H13N3O4S/c1-8-13(19)16-15-18(17-8)14(20)12(23-15)6-9-4-5-10(21-2)7-11(9)22-3/h4-7H,1-3H3	HZXMJDIKLORSDU-UHFFFAOYSA-N	COc1ccc(C=C2SC3=NC(=O)C(=NN3C2=O)C)c(OC)c1	BroadT	BRD-K76921877	BRD-K76921877-001-06-8	ChemDiv Inc.	5629-1123			COc1ccc(C=c2sc3nc(=O)c(C)nn3c2=O)c(OC)c1	InChI=1S/C15H13N3O4S/c1-8-13(19)16-15-18(17-8)14(20)12(23-15)6-9-4-5-10(21-2)7-11(9)22-3/h4-7H,1-3H3	HZXMJDIKLORSDU-UHFFFAOYSA-N	331.062676616							120527
BDBM45144	LSM-31971	BRD-M39894156	91896635	InChI=1S/C27H26N2O6S/c1-5-35-27(32)19-14(2)29-25-21(20(19)15-6-8-17(9-7-15)26(31)34-4)22(28)24(36-25)23(30)16-10-12-18(33-3)13-11-16/h6-13,19-20H,5,28H2,1-4H3	UCKYDVRVPRFLCP-UHFFFAOYSA-N	CCOC(=O)C1C(c2ccc(cc2)C(=O)OC)c3c(N)c(sc3N=C1C)C(=O)c4ccc(OC)cc4	BroadT	BRD-M39894156	BRD-M39894156-001-05-5	InterBioScreen Ltd.	STOCK3S-29917		CCO.CCOC(=O)C1C(c2c(N=C1C)sc(C(=O)c1ccc(OC)cc1)c2N)c1ccc(cc1)C(=O)OC	CCO.CCOC(=O)C1C(c2c(N=C1C)sc(C(=O)c1ccc(OC)cc1)c2N)c1ccc(cc1)C(=O)OC	InChI=1S/C27H26N2O6S.C2H6O/c1-5-35-27(32)19-14(2)29-25-21(20(19)15-6-8-17(9-7-15)26(31)34-4)22(28)24(36-25)23(30)16-10-12-18(33-3)13-11-16;1-2-3/h6-13,19-20H,5,28H2,1-4H3;3H,2H2,1H3	KBAOAQBOHSOCQL-UHFFFAOYSA-N	506.151157262							120528
MLS000526254	LSM-31972	SID14724799, BRD-A14803952	3116961	InChI=1S/C17H13BrCl2N2O2/c18-11-1-4-13(5-2-11)22-9-10(7-16(22)23)17(24)21-12-3-6-14(19)15(20)8-12/h1-6,8,10H,7,9H2,(H,21,24)	SNHAEGZLEDKSQX-UHFFFAOYSA-N	Clc1ccc(NC(=O)C2CN(C(=O)C2)c3ccc(Br)cc3)cc1Cl	BroadT	BRD-A14803952	BRD-A14803952-001-06-3	Asinex Ltd.	BAS 00731532			Clc1ccc(NC(=O)C2CN(C(=O)C2)c2ccc(Br)cc2)cc1Cl	InChI=1S/C17H13BrCl2N2O2/c18-11-1-4-13(5-2-11)22-9-10(7-16(22)23)17(24)21-12-3-6-14(19)15(20)8-12/h1-6,8,10H,7,9H2,(H,21,24)	SNHAEGZLEDKSQX-UHFFFAOYSA-N	425.953745696							120529
SMR000026261	LSM-31973	SID4250445, BRD-K78972225	3244255	InChI=1S/C20H26N2O3S/c23-20(16-6-7-16)22-13-11-17-14-18(8-9-19(17)22)26(24,25)21-12-10-15-4-2-1-3-5-15/h4,8-9,14,16,21H,1-3,5-7,10-13H2	WYFXMFSDPLZWMW-UHFFFAOYSA-N	O=C(C1CC1)N2CCc3cc(ccc23)S(=O)(=O)NCCC4=CCCCC4	BroadT	BRD-K78972225	BRD-K78972225-001-05-0	ChemDiv Inc.	C361-0597			O=C(C1CC1)N1CCc2cc(ccc12)S(=O)(=O)NCCC1=CCCCC1	InChI=1S/C20H26N2O3S/c23-20(16-6-7-16)22-13-11-17-14-18(8-9-19(17)22)26(24,25)21-12-10-15-4-2-1-3-5-15/h4,8-9,14,16,21H,1-3,5-7,10-13H2	WYFXMFSDPLZWMW-UHFFFAOYSA-N	374.166413402							120530
AC1MRS5E	LSM-31974	SID24810501, BRD-K68916730	3497776	InChI=1S/C14H12N2O4/c17-16(18)12-4-2-11(3-5-12)15-8-10-1-6-13-14(7-10)20-9-19-13/h1-7,15H,8-9H2	PFLKVMJVHVUPMR-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NCc2ccc3OCOc3c2)cc1	BroadT	BRD-K68916730	BRD-K68916730-001-05-7	ChemDiv Inc.	5260-0059			[O-][N+](=O)c1ccc(NCc2ccc3OCOc3c2)cc1	InChI=1S/C14H12N2O4/c17-16(18)12-4-2-11(3-5-12)15-8-10-1-6-13-14(7-10)20-9-19-13/h1-7,15H,8-9H2	PFLKVMJVHVUPMR-UHFFFAOYSA-N	272.079706884							120531
MLS000693152	LSM-44376	SID24808390, BRD-K39597125	5726630	InChI=1S/C18H16N2O/c1-2-20-17(13-12-14-8-4-3-5-9-14)19-16-11-7-6-10-15(16)18(20)21/h3-13H,2H2,1H3/b13-12+	CEGAREJKMWDAQN-OUKQBFOZSA-N	CCN1C(=Nc2ccccc2C1=O)\C=C\c3ccccc3	BroadT	BRD-K39597125	BRD-K39597125-001-11-2	Asinex Ltd.	BAS 01076183			CCn1c(\C=C\c2ccccc2)nc2ccccc2c1=O	InChI=1S/C18H16N2O/c1-2-20-17(13-12-14-8-4-3-5-9-14)19-16-11-7-6-10-15(16)18(20)21/h3-13H,2H2,1H3/b13-12+	CEGAREJKMWDAQN-OUKQBFOZSA-N	276.126263152							
SMR000033257	LSM-31976	BRD-K97298761, SID4246387, SID46500746	3240741	InChI=1S/C26H25N3O6/c1-31-20-11-5-16(6-12-20)13-23(30)27-19-9-7-17(8-10-19)25-28-26(35-29-25)18-14-21(32-2)24(34-4)22(15-18)33-3/h5-12,14-15H,13H2,1-4H3,(H,27,30)	XANXVUBMCHUEIU-UHFFFAOYSA-N	COc1ccc(CC(=O)Nc2ccc(cc2)c3noc(n3)c4cc(OC)c(OC)c(OC)c4)cc1	BroadT	BRD-K97298761	BRD-K97298761-001-05-7	ChemDiv Inc.	K907-0083			COc1ccc(CC(=O)Nc2ccc(cc2)-c2noc(n2)-c2cc(OC)c(OC)c(OC)c2)cc1	InChI=1S/C26H25N3O6/c1-31-20-11-5-16(6-12-20)13-23(30)27-19-9-7-17(8-10-19)25-28-26(35-29-25)18-14-21(32-2)24(34-4)22(15-18)33-3/h5-12,14-15H,13H2,1-4H3,(H,27,30)	XANXVUBMCHUEIU-UHFFFAOYSA-N	475.17433555							120533
MLS000574676	LSM-31977	BRD-K55884477, SID17506530	806942	InChI=1S/C12H9BrN4OS/c13-9-5-8(6-14-7-9)11(18)17-12(19)16-10-3-1-2-4-15-10/h1-7H,(H2,15,16,17,18,19)	YZTOGODODPMNGH-UHFFFAOYSA-N	Brc1cncc(c1)C(=O)NC(=S)Nc2ccccn2	BroadT	BRD-K55884477	BRD-K55884477-001-05-9	ChemBridge Corporation	6713910			Brc1cncc(c1)C(=O)NC(=S)Nc1ccccn1	InChI=1S/C12H9BrN4OS/c13-9-5-8(6-14-7-9)11(18)17-12(19)16-10-3-1-2-4-15-10/h1-7H,(H2,15,16,17,18,19)	YZTOGODODPMNGH-UHFFFAOYSA-N	335.968044238							120534
MLS000680964	LSM-31978	BRD-K40509138, SID22404438	882513	InChI=1S/C16H17NO3/c1-10-5-6-13(16(19)20-4)8-15(10)17-11(2)7-14(9-18)12(17)3/h5-9H,1-4H3	KZXQAAPFOWYLMH-UHFFFAOYSA-N	COC(=O)c1ccc(C)c(c1)n2c(C)cc(C=O)c2C	BroadT	BRD-K40509138	BRD-K40509138-001-06-9	ChemBridge Corporation	6447926			COC(=O)c1ccc(C)c(c1)-n1c(C)cc(C=O)c1C	InChI=1S/C16H17NO3/c1-10-5-6-13(16(19)20-4)8-15(10)17-11(2)7-14(9-18)12(17)3/h5-9H,1-4H3	KZXQAAPFOWYLMH-UHFFFAOYSA-N	271.120843414							120535
STK319486	LSM-31979	BRD-K47028303, SID4250375	3244194	InChI=1S/C15H27N3O5S/c1-3-23-15(20)17-11-9-16(10-12-17)14(19)13-5-7-18(8-6-13)24(21,22)4-2/h13H,3-12H2,1-2H3	CVPXFQSKOYJEPK-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)CC	BroadT	BRD-K47028303	BRD-K47028303-001-05-4	ChemDiv Inc.	K786-6529			CCOC(=O)N1CCN(CC1)C(=O)C1CCN(CC1)S(=O)(=O)CC	InChI=1S/C15H27N3O5S/c1-3-23-15(20)17-11-9-16(10-12-17)14(19)13-5-7-18(8-6-13)24(21,22)4-2/h13H,3-12H2,1-2H3	CVPXFQSKOYJEPK-UHFFFAOYSA-N	361.167141684							120536
AC1M2UJX	LSM-15449	BRD-K02374169	2226376	InChI=1S/C15H13ClN4O/c1-21-13-7-6-9(16)8-12(13)19-15-18-11-5-3-2-4-10(11)14(17)20-15/h2-8H,1H3,(H3,17,18,19,20)	OMGXTBFTOSJKCQ-UHFFFAOYSA-N	COc1ccc(Cl)cc1Nc2nc(N)c3ccccc3n2	BroadT	BRD-K02374169	BRD-K02374169-003-07-0	ChemBridge Corporation	7951262		Cl	COc1ccc(Cl)cc1Nc1nc(N)c2ccccc2n1.Cl	InChI=1S/C15H13ClN4O.ClH/c1-21-13-7-6-9(16)8-12(13)19-15-18-11-5-3-2-4-10(11)14(17)20-15;/h2-8H,1H3,(H3,17,18,19,20);1H	BTGTVBXGRKSMSX-UHFFFAOYSA-N	300.077788786							104091, 104091
MLS000727896	LSM-31980	BRD-A21891180, SID24812607	11451524	InChI=1S/C16H13F3N2O3S/c1-24-11-6-4-10(5-7-11)12-9-15(23,16(17,18)19)21(20-12)14(22)13-3-2-8-25-13/h2-8,23H,9H2,1H3	GJFKNFYTUROQTM-UHFFFAOYSA-N	COc1ccc(cc1)C2=NN(C(=O)c3cccs3)C(O)(C2)C(F)(F)F	BroadT	BRD-A21891180	BRD-A21891180-001-05-5	ChemDiv Inc.	7853-0025			COc1ccc(cc1)C1=NN(C(=O)c2cccs2)C(O)(C1)C(F)(F)F	InChI=1S/C16H13F3N2O3S/c1-24-11-6-4-10(5-7-11)12-9-15(23,16(17,18)19)21(20-12)14(22)13-3-2-8-25-13/h2-8,23H,9H2,1H3	GJFKNFYTUROQTM-UHFFFAOYSA-N	370.059897586							120537
AC1M2RU3	LSM-31981	BRD-K34954550, SID24832630	2124858	InChI=1S/C19H19N3O2S/c1-22-9-8-16-17(11-22)25-19(20-16)21-18(23)12-24-15-7-6-13-4-2-3-5-14(13)10-15/h2-7,10H,8-9,11-12H2,1H3,(H,20,21,23)	HHLJKQAHDAJERX-UHFFFAOYSA-N	CN1CCc2nc(NC(=O)COc3ccc4ccccc4c3)sc2C1	BroadT	BRD-K34954550	BRD-K34954550-001-05-6	Enamine Ltd.	T5252764			CN1CCc2nc(NC(=O)COc3ccc4ccccc4c3)sc2C1	InChI=1S/C19H19N3O2S/c1-22-9-8-16-17(11-22)25-19(20-16)21-18(23)12-24-15-7-6-13-4-2-3-5-14(13)10-15/h2-7,10H,8-9,11-12H2,1H3,(H,20,21,23)	HHLJKQAHDAJERX-UHFFFAOYSA-N	353.119797568							120538
SMR000025406	LSM-31982	BRD-K72890304, SID4248728	3242768	InChI=1S/C21H27FN4OS/c1-28-18-9-7-17(8-10-18)24-21(27)23-11-4-12-25-13-15-26(16-14-25)20-6-3-2-5-19(20)22/h2-3,5-10H,4,11-16H2,1H3,(H2,23,24,27)	WOHOPYMSIBACDV-UHFFFAOYSA-N	CSc1ccc(NC(=O)NCCCN2CCN(CC2)c3ccccc3F)cc1	BroadT	BRD-K72890304	BRD-K72890304-001-05-4	ChemDiv Inc.	C270-0384			CSc1ccc(NC(=O)NCCCN2CCN(CC2)c2ccccc2F)cc1	InChI=1S/C21H27FN4OS/c1-28-18-9-7-17(8-10-18)24-21(27)23-11-4-12-25-13-15-26(16-14-25)20-6-3-2-5-19(20)22/h2-3,5-10H,4,11-16H2,1H3,(H2,23,24,27)	WOHOPYMSIBACDV-UHFFFAOYSA-N	402.188960414							120539
MLS000535522	LSM-31983	BRD-K10105458, SID14731060	1316596	InChI=1S/C19H23FN4OS/c1-4-24-13(2)17(14(3)25)18(21-19(24)26)23-11-9-22(10-12-23)16-7-5-15(20)6-8-16/h5-8H,4,9-12H2,1-3H3	SRAPOMLXLUOQRF-UHFFFAOYSA-N	CCN1C(=C(C(=O)C)C(=NC1=S)N2CCN(CC2)c3ccc(F)cc3)C	BroadT	BRD-K10105458	BRD-K10105458-001-06-4	ChemBridge Corporation	7562747			CCn1c(C)c(C(C)=O)c(nc1=S)N1CCN(CC1)c1ccc(F)cc1	InChI=1S/C19H23FN4OS/c1-4-24-13(2)17(14(3)25)18(21-19(24)26)23-11-9-22(10-12-23)16-7-5-15(20)6-8-16/h5-8H,4,9-12H2,1-3H3	SRAPOMLXLUOQRF-UHFFFAOYSA-N	374.157660286							120540
AC1MDN05	LSM-31984	BRD-K69389910	2813692	InChI=1S/C21H16N4O3S/c26-21(23-22-13-15-9-11-16(12-10-15)25(27)28)14-24-17-5-1-3-7-19(17)29-20-8-4-2-6-18(20)24/h1-13H,14H2,(H,23,26)	YBXHHZVHHDHTOD-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(C=NNC(=O)CN2c3ccccc3Sc4ccccc24)cc1	BroadT	BRD-K69389910	BRD-K69389910-001-05-8	Maybridge	HTS 07510			[O-][N+](=O)c1ccc(C=NNC(=O)CN2c3ccccc3Sc3ccccc23)cc1	InChI=1S/C21H16N4O3S/c26-21(23-22-13-15-9-11-16(12-10-15)25(27)28)14-24-17-5-1-3-7-19(17)29-20-8-4-2-6-18(20)24/h1-13H,14H2,(H,23,26)	YBXHHZVHHDHTOD-UHFFFAOYSA-N	404.094311102							120541
BAS 08977213	LSM-31985	BRD-K35923751, SID14726504	1093135	InChI=1S/C16H15NO2S/c1-12-5-4-6-13(11-12)19-10-9-17-14-7-2-3-8-15(14)20-16(17)18/h2-8,11H,9-10H2,1H3	RERWHIDOAHVXHA-UHFFFAOYSA-N	Cc1cccc(OCCN2C(=O)Sc3ccccc23)c1	BroadT	BRD-K35923751	BRD-K35923751-001-06-5	Asinex Ltd.	BAS 08977213			Cc1cccc(OCCn2c3ccccc3sc2=O)c1	InChI=1S/C16H15NO2S/c1-12-5-4-6-13(11-12)19-10-9-17-14-7-2-3-8-15(14)20-16(17)18/h2-8,11H,9-10H2,1H3	RERWHIDOAHVXHA-UHFFFAOYSA-N	285.08234942							120542
Benzamide, 4-methoxy-n-(5-methyl-3-isoxazolyl)-	LSM-31986	BRD-K60057192, SID7972878	670263	InChI=1S/C12H12N2O3/c1-8-7-11(14-17-8)13-12(15)9-3-5-10(16-2)6-4-9/h3-7H,1-2H3,(H,13,14,15)	NCSMCVZNYCCOGI-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)Nc2cc(C)on2	BroadT	BRD-K60057192	BRD-K60057192-001-05-9	ChemBridge Corporation	6615860			COc1ccc(cc1)C(=O)Nc1cc(C)on1	InChI=1S/C12H12N2O3/c1-8-7-11(14-17-8)13-12(15)9-3-5-10(16-2)6-4-9/h3-7H,1-2H3,(H,13,14,15)	NCSMCVZNYCCOGI-UHFFFAOYSA-N	232.084792264							120543
SMR000093504	LSM-31987	BRD-K46334103, SID7965698	2996853	InChI=1S/C17H23NO3/c1-10-6-8-12(9-7-10)21-17(20)16-11(2)15-13(18-16)4-3-5-14(15)19/h10,12,18H,3-9H2,1-2H3	BJFBZCMAPVQWEQ-UHFFFAOYSA-N	CC1CCC(CC1)OC(=O)c2[nH]c3CCCC(=O)c3c2C	BroadT	BRD-K46334103	BRD-K46334103-001-04-2	ChemDiv Inc.	C276-0908			CC1CCC(CC1)OC(=O)c1[nH]c2CCCC(=O)c2c1C	InChI=1S/C17H23NO3/c1-10-6-8-12(9-7-10)21-17(20)16-11(2)15-13(18-16)4-3-5-14(15)19/h10,12,18H,3-9H2,1-2H3	BJFBZCMAPVQWEQ-UHFFFAOYSA-N	289.167793606							120544
SMR000040587	LSM-31988	BRD-K71554049, SID858177	659529	InChI=1S/C10H11F6N3OS2/c1-3-8(9(11,12)13,10(14,15)16)5(20)17-6-18-19-7(22-6)21-4-2/h3-4H2,1-2H3,(H,17,18,20)	VTTDLMLIADROQK-UHFFFAOYSA-N	CCSc1nnc(NC(=O)C(CC)(C(F)(F)F)C(F)(F)F)s1	BroadT	BRD-K71554049	BRD-K71554049-001-05-7	InterBioScreen Ltd.	STOCK2S-28462			CCSc1nnc(NC(=O)C(CC)(C(F)(F)F)C(F)(F)F)s1	InChI=1S/C10H11F6N3OS2/c1-3-8(9(11,12)13,10(14,15)16)5(20)17-6-18-19-7(22-6)21-4-2/h3-4H2,1-2H3,(H,17,18,20)	VTTDLMLIADROQK-UHFFFAOYSA-N	367.024772582							120545
2-[(1,3-Benzothiazol-2-ylsulfanyl)methyl]-3-bromoimidazo[1,2-a]pyrimidine	LSM-31989	BRD-K42465630, SID17512305	1394754	InChI=1S/C14H9BrN4S2/c15-12-10(17-13-16-6-3-7-19(12)13)8-20-14-18-9-4-1-2-5-11(9)21-14/h1-7H,8H2	FTRJWJWFHCFMSL-UHFFFAOYSA-N	Brc1c(CSc2nc3ccccc3s2)nc4ncccn14	BroadT	BRD-K42465630	BRD-K42465630-001-05-7	InterBioScreen Ltd.	STOCK1S-82062			Brc1c(CSc2nc3ccccc3s2)nc2ncccn12	InChI=1S/C14H9BrN4S2/c15-12-10(17-13-16-6-3-7-19(12)13)8-20-14-18-9-4-1-2-5-11(9)21-14/h1-7H,8H2	FTRJWJWFHCFMSL-UHFFFAOYSA-N	375.945200308							120546
AC1O9YC8	LSM-31990	BRD-K33539506, SID17387372	6740744	InChI=1S/C18H14N2S/c1-12-6-8-13(9-7-12)17-11-21-18(20-17)15-10-19-16-5-3-2-4-14(15)16/h2-11,19H,1H3	MVNXSBSNUVMBEK-UHFFFAOYSA-N	Cc1ccc(cc1)c2csc(n2)c3c[nH]c4ccccc34	BroadT	BRD-K33539506	BRD-K33539506-001-05-1	Specs	AP-048/15614142			Cc1ccc(cc1)-c1csc(n1)-c1c[nH]c2ccccc12	InChI=1S/C18H14N2S/c1-12-6-8-13(9-7-12)17-11-21-18(20-17)15-10-19-16-5-3-2-4-14(15)16/h2-11,19H,1H3	MVNXSBSNUVMBEK-UHFFFAOYSA-N	290.087769158							
SMR000003377	LSM-31991	BRD-A72515205, SID849482	651976	InChI=1S/C21H26N6O3S/c1-21(2,3)27-19(23-24-25-27)18(26-4-8-31-9-5-26)14-10-13-11-16-17(30-7-6-29-16)12-15(13)22-20(14)28/h10-12,18H,4-9H2,1-3H3,(H,22,28)	QOTDCCJXIFWQLX-UHFFFAOYSA-N	CC(C)(C)n1nnnc1C(N2CCSCC2)c3cc4cc5OCCOc5cc4nc3O	BroadT	BRD-A72515205	BRD-A72515205-001-06-7	Asinex Ltd.	ASN 04424314			CC(C)(C)n1nnnc1C(N1CCSCC1)c1cc2cc3OCCOc3cc2nc1O	InChI=1S/C21H26N6O3S/c1-21(2,3)27-19(23-24-25-27)18(26-4-8-31-9-5-26)14-10-13-11-16-17(30-7-6-29-16)12-15(13)22-20(14)28/h10-12,18H,4-9H2,1-3H3,(H,22,28)	QOTDCCJXIFWQLX-UHFFFAOYSA-N	442.178709442							120548
2-Hydroxy-n-(1,3-thiazol-2-yl)nicotinamide	LSM-31992	BRD-K79555196, SID47199164	820192	InChI=1S/C9H7N3O2S/c13-7-6(2-1-3-10-7)8(14)12-9-11-4-5-15-9/h1-5H,(H,10,13)(H,11,12,14)	UBNOMSNBXDRBFA-UHFFFAOYSA-N	Oc1ncccc1C(=O)Nc2nccs2	BroadT	BRD-K79555196	BRD-K79555196-001-05-7	Specs	AO-095/41417104			Oc1ncccc1C(=O)Nc1nccs1	InChI=1S/C9H7N3O2S/c13-7-6(2-1-3-10-7)8(14)12-9-11-4-5-15-9/h1-5H,(H,10,13)(H,11,12,14)	UBNOMSNBXDRBFA-UHFFFAOYSA-N	221.025897184							120549
(3,4-Dihydro-2H-naphthalen-1-ylideneamino) 3-methylbenzoate	LSM-31993	BRD-K49573242	1482814	InChI=1S/C18H17NO2/c1-13-6-4-9-15(12-13)18(20)21-19-17-11-5-8-14-7-2-3-10-16(14)17/h2-4,6-7,9-10,12H,5,8,11H2,1H3	BBZNBHCMNOAMGH-UHFFFAOYSA-N	Cc1cccc(c1)C(=O)ON=C2CCCc3ccccc23	BroadT	BRD-K49573242	BRD-K49573242-001-05-1	Key Organics Ltd.	10R-1127			Cc1cccc(c1)C(=O)ON=C1CCCc2ccccc12	InChI=1S/C18H17NO2/c1-13-6-4-9-15(12-13)18(20)21-19-17-11-5-8-14-7-2-3-10-16(14)17/h2-4,6-7,9-10,12H,5,8,11H2,1H3	BBZNBHCMNOAMGH-UHFFFAOYSA-N	279.125928794							120550
AC1LIEXN	LSM-31994	BRD-K61821542	903000	InChI=1S/C16H14F2N2O/c1-11(13-4-8-15(18)9-5-13)19-20-16(21)10-12-2-6-14(17)7-3-12/h2-9H,10H2,1H3,(H,20,21)	SYIFGDWFDQJKCT-UHFFFAOYSA-N	CC(=NNC(=O)Cc1ccc(F)cc1)c2ccc(F)cc2	BroadT	BRD-K61821542	BRD-K61821542-001-05-4	Specs	AK-968/11492084			CC(=NNC(=O)Cc1ccc(F)cc1)c1ccc(F)cc1	InChI=1S/C16H14F2N2O/c1-11(13-4-8-15(18)9-5-13)19-20-16(21)10-12-2-6-14(17)7-3-12/h2-9H,10H2,1H3,(H,20,21)	SYIFGDWFDQJKCT-UHFFFAOYSA-N	288.107419488							120551
Ethyl 2-(4-fluorophenyl)indolizine-1-carboxylate	LSM-31995	BRD-K94109423, SID17410633	1491186	InChI=1S/C17H14FNO2/c1-2-21-17(20)16-14(12-6-8-13(18)9-7-12)11-19-10-4-3-5-15(16)19/h3-11H,2H2,1H3	LBZIZFQFNSAYKL-UHFFFAOYSA-N	CCOC(=O)c1c(cn2ccccc12)c3ccc(F)cc3	BroadT	BRD-K94109423	BRD-K94109423-001-05-9	Key Organics Ltd.	1R-0087			CCOC(=O)c1c(cn2ccccc12)-c1ccc(F)cc1	InChI=1S/C17H14FNO2/c1-2-21-17(20)16-14(12-6-8-13(18)9-7-12)11-19-10-4-3-5-15(16)19/h3-11H,2H2,1H3	LBZIZFQFNSAYKL-UHFFFAOYSA-N	283.100856898							120552
ZINC03417862	LSM-31996	BRD-K35614154, SID24840093	2536954	InChI=1S/C13H12BrN3O2S/c14-10-3-1-9(2-4-10)12(19)15-6-5-11(18)17-13-16-7-8-20-13/h1-4,7-8H,5-6H2,(H,15,19)(H,16,17,18)	HOXBJRHQRDMOLA-UHFFFAOYSA-N	Brc1ccc(cc1)C(=O)NCCC(=O)Nc2nccs2	BroadT	BRD-K35614154	BRD-K35614154-001-06-3	Enamine Ltd.	T5329797			Brc1ccc(cc1)C(=O)NCCC(=O)Nc1nccs1	InChI=1S/C13H12BrN3O2S/c14-10-3-1-9(2-4-10)12(19)15-6-5-11(18)17-13-16-7-8-20-13/h1-4,7-8H,5-6H2,(H,15,19)(H,16,17,18)	HOXBJRHQRDMOLA-UHFFFAOYSA-N	352.983359944							120553
AC1NSGTI	LSM-31997	BRD-K01639343, SID7968418	5309395	InChI=1S/C13H15N3O3S/c17-11(15-4-6-19-7-5-15)8-16-10-2-1-3-14-13(10)20-9-12(16)18/h1-3H,4-9H2	JBXSGLUTNLPNKU-UHFFFAOYSA-N	O=C(CN1C(=O)CSc2ncccc12)N3CCOCC3	BroadT	BRD-K01639343	BRD-K01639343-001-04-7	ChemDiv Inc.	C862-0029			O=C(CN1C(=O)CSc2ncccc12)N1CCOCC1	InChI=1S/C13H15N3O3S/c17-11(15-4-6-19-7-5-15)8-16-10-2-1-3-14-13(10)20-9-12(16)18/h1-3H,4-9H2	JBXSGLUTNLPNKU-UHFFFAOYSA-N	293.08341206							120554
SMR000094081	LSM-31998	BRD-K78995236, SID7966702	5308391	InChI=1S/C19H27N3O3/c1-3-7-20-8-10-21(11-9-20)18(23)16-6-4-5-15-14-22(12-13-25-2)19(24)17(15)16/h4-6H,3,7-14H2,1-2H3	AEONYYYVUMADME-UHFFFAOYSA-N	CCCN1CCN(CC1)C(=O)c2cccc3CN(CCOC)C(=O)c23	BroadT	BRD-K78995236	BRD-K78995236-001-05-8	ChemDiv Inc.	C447-0852			CCCN1CCN(CC1)C(=O)c1cccc2CN(CCOC)C(=O)c12	InChI=1S/C19H27N3O3/c1-3-7-20-8-10-21(11-9-20)18(23)16-6-4-5-15-14-22(12-13-25-2)19(24)17(15)16/h4-6H,3,7-14H2,1-2H3	AEONYYYVUMADME-UHFFFAOYSA-N	345.205241754							120555
N'-(2-chlorobenzoyl)-5-(trifluoromethoxy)-1H-indole-2-carbohydrazide	LSM-31999	BRD-K82700281, SID26730876	587550	InChI=1S/C17H11ClF3N3O3/c18-12-4-2-1-3-11(12)15(25)23-24-16(26)14-8-9-7-10(27-17(19,20)21)5-6-13(9)22-14/h1-8,22H,(H,23,25)(H,24,26)	OJJKLENSOJWIBV-UHFFFAOYSA-N	FC(F)(F)Oc1ccc2[nH]c(cc2c1)C(=O)NNC(=O)c3ccccc3Cl	BroadT	BRD-K82700281	BRD-K82700281-001-05-0	Maybridge	KM 09386			FC(F)(F)Oc1ccc2[nH]c(cc2c1)C(=O)NNC(=O)c1ccccc1Cl	InChI=1S/C17H11ClF3N3O3/c18-12-4-2-1-3-11(12)15(25)23-24-16(26)14-8-9-7-10(27-17(19,20)21)5-6-13(9)22-14/h1-8,22H,(H,23,25)(H,24,26)	OJJKLENSOJWIBV-UHFFFAOYSA-N	397.044103552							120556
5-(3,5-Dimethylpiperidin-1-yl)-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile	LSM-32000	BRD-A57594599, SID4263627	2963490	InChI=1S/C15H17N3O2/c1-10-6-11(2)9-18(8-10)15-12(7-16)17-14(20-15)13-4-3-5-19-13/h3-5,10-11H,6,8-9H2,1-2H3	AMVIYBUBHKBEIY-UHFFFAOYSA-N	CC1CC(C)CN(C1)c2oc(nc2C#N)c3occc3	BroadT	BRD-A57594599	BRD-A57594599-001-05-7	ChemBridge Corporation	7910337			CC1CC(C)CN(C1)c1oc(nc1C#N)-c1ccco1	InChI=1S/C15H17N3O2/c1-10-6-11(2)9-18(8-10)15-12(7-16)17-14(20-15)13-4-3-5-19-13/h3-5,10-11H,6,8-9H2,1-2H3	AMVIYBUBHKBEIY-UHFFFAOYSA-N	271.132076814							120557
SMR000011504	LSM-32001	BRD-K65934178, SID848160	650589	InChI=1S/C16H18N2O4/c1-10(2)15(19)17-11-6-7-12(14(9-11)21-3)18-16(20)13-5-4-8-22-13/h4-10H,1-3H3,(H,17,19)(H,18,20)	XQYLAZBXHBOISL-UHFFFAOYSA-N	COc1cc(NC(=O)C(C)C)ccc1NC(=O)c2occc2	BroadT	BRD-K65934178	BRD-K65934178-001-05-2	Asinex Ltd.	BAS 02792440			COc1cc(NC(=O)C(C)C)ccc1NC(=O)c1ccco1	InChI=1S/C16H18N2O4/c1-10(2)15(19)17-11-6-7-12(14(9-11)21-3)18-16(20)13-5-4-8-22-13/h4-10H,1-3H3,(H,17,19)(H,18,20)	XQYLAZBXHBOISL-UHFFFAOYSA-N	302.126657076							120558
N-(4-Methoxyphenyl)-1,3,5-triazaspiro[5.5]undeca-1,4-diene-2,4-diamine	LSM-32002	BRD-K60839995, SID4242671	879096	InChI=1S/C15H21N5O/c1-21-12-7-5-11(6-8-12)17-14-18-13(16)19-15(20-14)9-3-2-4-10-15/h5-8H,2-4,9-10H2,1H3,(H4,16,17,18,19,20)	BIMFDXJOQBGSRY-UHFFFAOYSA-N	COc1ccc(NC2=NC(=NC3(CCCCC3)N2)N)cc1	BroadT	BRD-K60839995	BRD-K60839995-001-05-9	ChemDiv Inc.	5300-0256			COc1ccc(NC2=NC(N)=NC3(CCCCC3)N2)cc1	InChI=1S/C15H21N5O/c1-21-12-7-5-11(6-8-12)17-14-18-13(16)19-15(20-14)9-3-2-4-10-15/h5-8H,2-4,9-10H2,1H3,(H4,16,17,18,19,20)	BIMFDXJOQBGSRY-UHFFFAOYSA-N	287.174610342							120559
SMR000262228	LSM-44377	SID17516504, BRD-K59386816	2328885	InChI=1S/C21H12N4O4S2/c22-11-13(20(26)24-21-23-16(12-31-21)19-6-3-9-30-19)10-14-7-8-18(29-14)15-4-1-2-5-17(15)25(27)28/h1-10,12H,(H,23,24,26)/b13-10+	WJEGUJCOTMRGFR-JLHYYAGUSA-N	[O-][N+](=O)c1ccccc1c2oc(\C=C(/C#N)\C(=O)Nc3nc(cs3)c4cccs4)cc2	BroadT	BRD-K59386816	BRD-K59386816-001-05-1	Enamine Ltd.	T0504-9317			[O-][N+](=O)c1ccccc1-c1ccc(\C=C(/C#N)C(=O)Nc2nc(cs2)-c2cccs2)o1	InChI=1S/C21H12N4O4S2/c22-11-13(20(26)24-21-23-16(12-31-21)19-6-3-9-30-19)10-14-7-8-18(29-14)15-4-1-2-5-17(15)25(27)28/h1-10,12H,(H,23,24,26)/b13-10+	WJEGUJCOTMRGFR-JLHYYAGUSA-N	448.029996284							
AC1N0TAE	LSM-32004	BRD-K78603273	3922473	InChI=1S/C27H29FN4O4/c1-35-25-10-3-19(17-29-30-27(34)20-4-9-24(33)26(16-20)36-2)15-21(25)18-31-11-13-32(14-12-31)23-7-5-22(28)6-8-23/h3-10,15-17,33H,11-14,18H2,1-2H3,(H,30,34)	HBEFWJNIFKXCNE-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)c2ccc(O)c(OC)c2)cc1CN3CCN(CC3)c4ccc(F)cc4	BroadT	BRD-K78603273	BRD-K78603273-001-05-2	ChemDiv Inc.	K087-0198			COc1cc(ccc1O)C(=O)NN=Cc1ccc(OC)c(CN2CCN(CC2)c2ccc(F)cc2)c1	InChI=1S/C27H29FN4O4/c1-35-25-10-3-19(17-29-30-27(34)20-4-9-24(33)26(16-20)36-2)15-21(25)18-31-11-13-32(14-12-31)23-7-5-22(28)6-8-23/h3-10,15-17,33H,11-14,18H2,1-2H3,(H,30,34)	HBEFWJNIFKXCNE-UHFFFAOYSA-N	492.217283648							120561
SMR000128109	LSM-32005	BRD-K17412949, SID14737173	4183436	InChI=1S/C26H29N5O/c1-19-17-24(30-15-13-29(14-16-30)18-21-9-5-4-6-10-21)31-26(27-19)25(20(2)28-31)22-11-7-8-12-23(22)32-3/h4-12,17H,13-16,18H2,1-3H3	FBTWJBDSPSQIHU-UHFFFAOYSA-N	COc1ccccc1c2c(C)nn3c(cc(C)nc23)N4CCN(Cc5ccccc5)CC4	BroadT	BRD-K17412949	BRD-K17412949-001-04-9	ChemDiv Inc.	K788-9282			COc1ccccc1-c1c(C)nn2c(cc(C)nc12)N1CCN(Cc2ccccc2)CC1	InChI=1S/C26H29N5O/c1-19-17-24(30-15-13-29(14-16-30)18-21-9-5-4-6-10-21)31-26(27-19)25(20(2)28-31)22-11-7-8-12-23(22)32-3/h4-12,17H,13-16,18H2,1-3H3	FBTWJBDSPSQIHU-UHFFFAOYSA-N	427.237210598							120562
ST50011285	LSM-32006	BRD-K51461946, SID843106	645386	InChI=1S/C17H16F3N3O3/c1-26-16(25)10-5-2-3-7-12(10)21-14(24)9-23-13-8-4-6-11(13)15(22-23)17(18,19)20/h2-3,5,7H,4,6,8-9H2,1H3,(H,21,24)	QTVNMBRSHMLISR-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)Cn2nc(c3CCCc23)C(F)(F)F	BroadT	BRD-K51461946	BRD-K51461946-001-05-3	Asinex Ltd.	BAS 01939631			COC(=O)c1ccccc1NC(=O)Cn1nc(c2CCCc12)C(F)(F)F	InChI=1S/C17H16F3N3O3/c1-26-16(25)10-5-2-3-7-12(10)21-14(24)9-23-13-8-4-6-11(13)15(22-23)17(18,19)20/h2-3,5,7H,4,6,8-9H2,1H3,(H,21,24)	QTVNMBRSHMLISR-UHFFFAOYSA-N	367.114376002							120563
MLS001018638	LSM-32007	BRD-K16911140, SID24831919	2323138	InChI=1S/C24H29N5O2S/c1-4-28(5-2)16-15-25-24(32)26-23(30)21-17-29(19-9-7-6-8-10-19)27-22(21)18-11-13-20(31-3)14-12-18/h6-14,17H,4-5,15-16H2,1-3H3,(H2,25,26,30,32)	JMWYNZLUZZSLNI-UHFFFAOYSA-N	CCN(CC)CCNC(=S)NC(=O)c1cn(nc1c2ccc(OC)cc2)c3ccccc3	BroadT	BRD-K16911140	BRD-K16911140-001-06-3	Enamine Ltd.	T0504-3121			CCN(CC)CCNC(=S)NC(=O)c1cn(nc1-c1ccc(OC)cc1)-c1ccccc1	InChI=1S/C24H29N5O2S/c1-4-28(5-2)16-15-25-24(32)26-23(30)21-17-29(19-9-7-6-8-10-19)27-22(21)18-11-13-20(31-3)14-12-18/h6-14,17H,4-5,15-16H2,1-3H3,(H2,25,26,30,32)	JMWYNZLUZZSLNI-UHFFFAOYSA-N	451.204195908							120564
AC1OJ3LH	LSM-32008	BRD-K71758378, SID22404094	7313798	InChI=1S/C16H14N6O2/c17-15-14(16(18)22(21-15)11-4-2-1-3-5-11)20-19-10-6-7-12-13(8-10)24-9-23-12/h1-8H,9,18H2,(H2,17,21)	XMHTUTLCTOYCSL-UHFFFAOYSA-N	Nc1nn(c(N)c1N=Nc2ccc3OCOc3c2)c4ccccc4	BroadT	BRD-K71758378	BRD-K71758378-001-05-5	Specs	AO-476/43250116			Nc1nn(c(N)c1N=Nc1ccc2OCOc2c1)-c1ccccc1	InChI=1S/C16H14N6O2/c17-15-14(16(18)22(21-15)11-4-2-1-3-5-11)20-19-10-6-7-12-13(8-10)24-9-23-12/h1-8H,9,18H2,(H2,17,21)	XMHTUTLCTOYCSL-UHFFFAOYSA-N	322.117823748							
AC1NTUUZ	LSM-44378	SID856415, BRD-K34974135	5389028	InChI=1S/C18H21NO3/c1-12-4-6-13(7-5-12)19-9-8-14(20)17-15(21)10-18(2,3)11-16(17)22/h4-9,17,19H,10-11H2,1-3H3/b9-8-	WLZFCGHZFXJZHX-HJWRWDBZSA-N	Cc1ccc(N\C=C/C(=O)C2C(=O)CC(C)(C)CC2=O)cc1	BroadT	BRD-K34974135	BRD-K34974135-001-06-6	InterBioScreen Ltd.	STOCK1S-10927			Cc1ccc(N\C=C/C(=O)C2C(=O)CC(C)(C)CC2=O)cc1	InChI=1S/C18H21NO3/c1-12-4-6-13(7-5-12)19-9-8-14(20)17-15(21)10-18(2,3)11-16(17)22/h4-9,17,19H,10-11H2,1-3H3/b9-8-	WLZFCGHZFXJZHX-HJWRWDBZSA-N	299.152143542							
2-[4-(Dimethylamino)benzylidene]cyclohexanone	LSM-44379	SID124895662, SID22406781, BRD-K39543844	1551607	InChI=1S/C15H19NO/c1-16(2)14-9-7-12(8-10-14)11-13-5-3-4-6-15(13)17/h7-11H,3-6H2,1-2H3/b13-11+	YWWIHHSFVKZDAO-ACCUITESSA-N	CN(C)c1ccc(\C=C\2/CCCCC2=O)cc1	BroadT	BRD-K39543844	BRD-K39543844-001-05-8	Enamine Ltd.	T0507-8334			CN(C)c1ccc(cc1)\C=C1/CCCCC1=O	InChI=1S/C15H19NO/c1-16(2)14-9-7-12(8-10-14)11-13-5-3-4-6-15(13)17/h7-11H,3-6H2,1-2H3/b13-11+	YWWIHHSFVKZDAO-ACCUITESSA-N	229.146664238							
AC1MDL19	LSM-32011	BRD-K04441230	2791392	InChI=1S/C10H9ClN4OS/c1-6-2-3-17-8(6)5-13-14-7-4-12-15-10(16)9(7)11/h2-5H,1H3,(H2,14,15,16)	JCNJPGWVPZKTDO-UHFFFAOYSA-N	Cc1ccsc1C=NNc2cnnc(O)c2Cl	BroadT	BRD-K04441230	BRD-K04441230-001-05-8	ChemDiv Inc.	5173-4391			Cc1ccsc1C=NNc1cnnc(O)c1Cl	InChI=1S/C10H9ClN4OS/c1-6-2-3-17-8(6)5-13-14-7-4-12-15-10(16)9(7)11/h2-5H,1H3,(H2,14,15,16)	JCNJPGWVPZKTDO-UHFFFAOYSA-N	268.018559348							120568
SMR000001876	LSM-32012	BRD-K07368164, SID852622	655259	InChI=1S/C21H21N3O2S/c1-2-23-20(26)16-10-4-5-11-17(16)22-21(23)27-14-19(25)24-13-7-9-15-8-3-6-12-18(15)24/h3-6,8,10-12H,2,7,9,13-14H2,1H3	BUSQYIUUMUMHLP-UHFFFAOYSA-N	CCN1C(=Nc2ccccc2C1=O)SCC(=O)N3CCCc4ccccc34	BroadT	BRD-K07368164	BRD-K07368164-001-05-0	Asinex Ltd.	ASN 02914417			CCn1c(SCC(=O)N2CCCc3ccccc23)nc2ccccc2c1=O	InChI=1S/C21H21N3O2S/c1-2-23-20(26)16-10-4-5-11-17(16)22-21(23)27-14-19(25)24-13-7-9-15-8-3-6-12-18(15)24/h3-6,8,10-12H,2,7,9,13-14H2,1H3	BUSQYIUUMUMHLP-UHFFFAOYSA-N	379.135447632							120569
SBB039651	LSM-32013	BRD-A02214146, SID4262047	2958453	InChI=1S/C15H13N3O3/c19-13(8-12-14(20)18-15(21)17-12)16-11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12H,8H2,(H,16,19)(H2,17,18,20,21)	TYLHRPBDFWODNS-UHFFFAOYSA-N	O=C(CC1NC(=O)NC1=O)Nc2cccc3ccccc23	BroadT	BRD-A02214146	BRD-A02214146-001-06-4	ChemBridge Corporation	7846919			O=C(CC1NC(=O)NC1=O)Nc1cccc2ccccc12	InChI=1S/C15H13N3O3/c19-13(8-12-14(20)18-15(21)17-12)16-11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12H,8H2,(H,16,19)(H2,17,18,20,21)	TYLHRPBDFWODNS-UHFFFAOYSA-N	283.095691306							120570
MLS000882815	LSM-44380	SID26732250, BRD-K79521948	16746413	InChI=1S/C30H28FNO/c1-21-9-8-14-26-28(21)30(33)32(20-23-12-6-3-7-13-23)29(26)25-17-18-27(31)24(19-25)16-15-22-10-4-2-5-11-22/h2-8,10-19,21,26,28-29H,9,20H2,1H3/b16-15+/t21-,26+,28+,29+/m1/s1	IJIJLKCYGJLICK-WACQLOJESA-N	C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc3ccccc3)[C@H]2c4ccc(F)c(\C=C\c5ccccc5)c4	BroadT	BRD-K79521948	BRD-K79521948-001-05-0	University of Kansas CMLD	KUC101281N			C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc1ccccc1)[C@H]2c1ccc(F)c(\C=C\c2ccccc2)c1	InChI=1S/C30H28FNO/c1-21-9-8-14-26-28(21)30(33)32(20-23-12-6-3-7-13-23)29(26)25-17-18-27(31)24(19-25)16-15-22-10-4-2-5-11-22/h2-8,10-19,21,26,28-29H,9,20H2,1H3/b16-15+/t21-,26+,28+,29+/m1/s1	IJIJLKCYGJLICK-WACQLOJESA-N	437.215492726							
MLS000585706	LSM-32015	BRD-K45732260, SID17510066	12005087	InChI=1S/C20H23FN4O2/c1-22-8-10-23(11-9-22)19-13-18(17(21)12-20(19)25(26)27)24-7-6-15-4-2-3-5-16(15)14-24/h2-5,12-13H,6-11,14H2,1H3	HIRFJJHUBGHUDC-UHFFFAOYSA-N	CN1CCN(CC1)c2cc(N3CCc4ccccc4C3)c(F)cc2[N+](=O)[O-]	BroadT	BRD-K45732260	BRD-K45732260-001-05-4	ChemDiv Inc.	6485-2797			CN1CCN(CC1)c1cc(N2CCc3ccccc3C2)c(F)cc1[N+]([O-])=O	InChI=1S/C20H23FN4O2/c1-22-8-10-23(11-9-22)19-13-18(17(21)12-20(19)25(26)27)24-7-6-15-4-2-3-5-16(15)14-24/h2-5,12-13H,6-11,14H2,1H3	HIRFJJHUBGHUDC-UHFFFAOYSA-N	370.180504216							120572
AN-329/41572182	LSM-32016	BRD-K85776843, SID17517433	1014342	InChI=1S/C16H13BrN2OS/c17-13-7-3-2-6-12(13)15(20)18-16(21)19-10-9-11-5-1-4-8-14(11)19/h1-8H,9-10H2,(H,18,20,21)	NLIZZHPFSIROKI-UHFFFAOYSA-N	Brc1ccccc1C(=O)NC(=S)N2CCc3ccccc23	BroadT	BRD-K85776843	BRD-K85776843-001-05-8	Enamine Ltd.	T0512-9470			Brc1ccccc1C(=O)NC(=S)N1CCc2ccccc12	InChI=1S/C16H13BrN2OS/c17-13-7-3-2-6-12(13)15(20)18-16(21)19-10-9-11-5-1-4-8-14(11)19/h1-8H,9-10H2,(H,18,20,21)	NLIZZHPFSIROKI-UHFFFAOYSA-N	359.993196346							120573
SMR000018181	LSM-32017	BRD-K23430426, SID7969664	5310030	InChI=1S/C13H19N3O4/c1-2-16-11(17)9-10(14-12(16)18)15-5-3-13(4-6-15)19-7-8-20-13/h9H,2-8H2,1H3,(H,14,18)	FFJDLOLHSBSSKN-UHFFFAOYSA-N	CCN1C(=O)NC(=CC1=O)N2CCC3(CC2)OCCO3	BroadT	BRD-K23430426	BRD-K23430426-001-06-0	Life Chemicals Inc.	F0693-0897			CCn1c(=O)cc([nH]c1=O)N1CCC2(CC1)OCCO2	InChI=1S/C13H19N3O4/c1-2-16-11(17)9-10(14-12(16)18)15-5-3-13(4-6-15)19-7-8-20-13/h9H,2-8H2,1H3,(H,14,18)	FFJDLOLHSBSSKN-UHFFFAOYSA-N	281.137556118							120574
AC1LTBIZ	LSM-32018	BRD-K67042874	1505629	InChI=1S/C14H10Br2N2O4/c15-10-6-9(22-13(10)16)7-17-18-14(19)8-1-2-11-12(5-8)21-4-3-20-11/h1-2,5-7H,3-4H2,(H,18,19)	NBSXJRVUFKLMBN-UHFFFAOYSA-N	Brc1oc(C=NNC(=O)c2ccc3OCCOc3c2)cc1Br	BroadT	BRD-K67042874	BRD-K67042874-001-06-7	InterBioScreen Ltd.	STOCK2S-05893			Brc1cc(C=NNC(=O)c2ccc3OCCOc3c2)oc1Br	InChI=1S/C14H10Br2N2O4/c15-10-6-9(22-13(10)16)7-17-18-14(19)8-1-2-11-12(5-8)21-4-3-20-11/h1-2,5-7H,3-4H2,(H,18,19)	NBSXJRVUFKLMBN-UHFFFAOYSA-N	427.90073202							120575
BRD-K45265701	LSM-32019	BRD-K45265701		InChI=1S/C18H21NO6/c1-22-12-6-7-15(23-2)14(10-12)19-11-13-16(20)24-18(25-17(13)21)8-4-3-5-9-18/h6-7,10-11,13H,3-5,8-9H2,1-2H3	FHUJLXGEEYYMNZ-UHFFFAOYSA-N	COc1ccc(OC)c(c1)N=CC2C(=O)OC3(CCCCC3)OC2=O	BroadT	BRD-K45265701	BRD-K45265701-001-05-2	InterBioScreen Ltd.	STOCK2S-64440			COc1ccc(OC)c(c1)N=CC1C(=O)OC2(CCCCC2)OC1=O	InChI=1S/C18H21NO6/c1-22-12-6-7-15(23-2)14(10-12)19-11-13-16(20)24-18(25-17(13)21)8-4-3-5-9-18/h6-7,10-11,13H,3-5,8-9H2,1-2H3	FHUJLXGEEYYMNZ-UHFFFAOYSA-N	347.136887402							120576
MLS000572651	LSM-44381	SID17433373, BRD-K58498516	2268128	InChI=1S/C20H14N2O4S2/c21-20-22-19(23)18(27-20)12-15-7-3-4-8-17(15)26-28(24,25)16-10-9-13-5-1-2-6-14(13)11-16/h1-12H,(H2,21,22,23)/b18-12-	WHHBIURMEKIKFL-PDGQHHTCSA-N	NC1=NC(=O)\C(=C\c2ccccc2OS(=O)(=O)c3ccc4ccccc4c3)\S1	BroadT	BRD-K58498516	BRD-K58498516-001-05-8	ChemBridge Corporation	6094927			NC1=NC(=O)\C(S1)=C\c1ccccc1OS(=O)(=O)c1ccc2ccccc2c1	InChI=1S/C20H14N2O4S2/c21-20-22-19(23)18(27-20)12-15-7-3-4-8-17(15)26-28(24,25)16-10-9-13-5-1-2-6-14(13)11-16/h1-12H,(H2,21,22,23)/b18-12-	WHHBIURMEKIKFL-PDGQHHTCSA-N	410.039498328							
ZINC00170334	LSM-32021	BRD-K28601178, SID26728231	2822406	InChI=1S/C15H18Cl2N4O/c1-15(2,3)12-8-13(21(4)20-12)19-14(22)18-11-6-9(16)5-10(17)7-11/h5-8H,1-4H3,(H2,18,19,22)	PGAOLCBUVAGNHE-UHFFFAOYSA-N	Cn1nc(cc1NC(=O)Nc2cc(Cl)cc(Cl)c2)C(C)(C)C	BroadT	BRD-K28601178	BRD-K28601178-001-05-3	Maybridge	KM 08485			Cn1nc(cc1NC(=O)Nc1cc(Cl)cc(Cl)c1)C(C)(C)C	InChI=1S/C15H18Cl2N4O/c1-15(2,3)12-8-13(21(4)20-12)19-14(22)18-11-6-9(16)5-10(17)7-11/h5-8H,1-4H3,(H2,18,19,22)	PGAOLCBUVAGNHE-UHFFFAOYSA-N	340.085766656							120578
AC1MX3R9	LSM-32022	BRD-K91419355	3809482	InChI=1S/C21H23N3O6/c1-13(25)24(2)9-8-14-10-18-20(30-12-29-18)19(28-3)16(14)11-22-23-21(27)15-6-4-5-7-17(15)26/h4-7,10-11,26H,8-9,12H2,1-3H3,(H,23,27)	KLJKYXJKBRDKIO-UHFFFAOYSA-N	COc1c2OCOc2cc(CCN(C)C(=O)C)c1C=NNC(=O)c3ccccc3O	BroadT	BRD-K91419355	BRD-K91419355-001-06-5	InterBioScreen Ltd.	STOCK5S-24416			COc1c2OCOc2cc(CCN(C)C(C)=O)c1C=NNC(=O)c1ccccc1O	InChI=1S/C21H23N3O6/c1-13(25)24(2)9-8-14-10-18-20(30-12-29-18)19(28-3)16(14)11-22-23-21(27)15-6-4-5-7-17(15)26/h4-7,10-11,26H,8-9,12H2,1-3H3,(H,23,27)	KLJKYXJKBRDKIO-UHFFFAOYSA-N	413.158685486							120579
ZINC04195417	LSM-32023	BRD-K35852282, SID3711306	2997588	InChI=1S/C12H13NO5/c1-8(14)16-6-12(15)13-5-9-2-3-10-11(4-9)18-7-17-10/h2-4H,5-7H2,1H3,(H,13,15)	DPBCQZKMQQPPFF-UHFFFAOYSA-N	CC(=O)OCC(=O)NCc1ccc2OCOc2c1	BroadT	BRD-K35852282	BRD-K35852282-001-05-6	Enamine Ltd.	T0508-5963			CC(=O)OCC(=O)NCc1ccc2OCOc2c1	InChI=1S/C12H13NO5/c1-8(14)16-6-12(15)13-5-9-2-3-10-11(4-9)18-7-17-10/h2-4H,5-7H2,1H3,(H,13,15)	DPBCQZKMQQPPFF-UHFFFAOYSA-N	251.079372526							120580
SMR000156330	LSM-32024	BRD-K09074846, SID17407487	11958691	InChI=1S/C21H25N3O3/c1-4-12-24-21(27-5-2)18-11-8-16(13-19(18)23-24)20(25)22-14-15-6-9-17(26-3)10-7-15/h6-11,13H,4-5,12,14H2,1-3H3,(H,22,25)	MAEUCLAFSZSYJR-UHFFFAOYSA-N	CCCn1nc2cc(ccc2c1OCC)C(=O)NCc3ccc(OC)cc3	BroadT	BRD-K09074846	BRD-K09074846-001-05-8	University of California at Davis	UCD_ADM_1-016			CCCn1nc2cc(ccc2c1OCC)C(=O)NCc1ccc(OC)cc1	InChI=1S/C21H25N3O3/c1-4-12-24-21(27-5-2)18-11-8-16(13-19(18)23-24)20(25)22-14-15-6-9-17(26-3)10-7-15/h6-11,13H,4-5,12,14H2,1-3H3,(H,22,25)	MAEUCLAFSZSYJR-UHFFFAOYSA-N	367.18959169							120581
1-(1-Benzofuran-2-yl)-2-[(1-mesityl-1H-1,2,3,4-tetraazol-5-yl)sulfanyl]-1-ethanone	LSM-32025	BRD-K78119702, SID26728865	2810453	InChI=1S/C20H18N4O2S/c1-12-8-13(2)19(14(3)9-12)24-20(21-22-23-24)27-11-16(25)18-10-15-6-4-5-7-17(15)26-18/h4-10H,11H2,1-3H3	ADPWJUQWAIHRON-UHFFFAOYSA-N	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)c3oc4ccccc4c3	BroadT	BRD-K78119702	BRD-K78119702-001-05-0	Maybridge	HTS 01989			Cc1cc(C)c(c(C)c1)-n1nnnc1SCC(=O)c1cc2ccccc2o1	InChI=1S/C20H18N4O2S/c1-12-8-13(2)19(14(3)9-12)24-20(21-22-23-24)27-11-16(25)18-10-15-6-4-5-7-17(15)26-18/h4-10H,11H2,1-3H3	ADPWJUQWAIHRON-UHFFFAOYSA-N	378.115046546							120582
ST50171681	LSM-32026	BRD-K42435237, SID14739258	976971	InChI=1S/C15H17ClN2O3S/c1-10-7-13(21-3)15(11(2)14(10)16)22(19,20)18-9-12-5-4-6-17-8-12/h4-8,18H,9H2,1-3H3	BKAFKBBTBAYYQE-UHFFFAOYSA-N	COc1cc(C)c(Cl)c(C)c1S(=O)(=O)NCc2cccnc2	BroadT	BRD-K42435237	BRD-K42435237-001-06-5	ChemBridge Corporation	7736319			COc1cc(C)c(Cl)c(C)c1S(=O)(=O)NCc1cccnc1	InChI=1S/C15H17ClN2O3S/c1-10-7-13(21-3)15(11(2)14(10)16)22(19,20)18-9-12-5-4-6-17-8-12/h4-8,18H,9H2,1-3H3	BKAFKBBTBAYYQE-UHFFFAOYSA-N	340.064840824							120583
AC1M2QCX	LSM-32027	BRD-K45576113	2122665	InChI=1S/C23H24N4O4S/c1-29-18-9-8-17(14-19(18)30-2)22(28)26-24-15-20-21(16-6-4-3-5-7-16)25-23(32-20)27-10-12-31-13-11-27/h3-9,14-15H,10-13H2,1-2H3,(H,26,28)	IESDEJUEOADSNF-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)NN=Cc2sc(nc2c3ccccc3)N4CCOCC4	BroadT	BRD-K45576113	BRD-K45576113-001-05-4	Enamine Ltd.	T5249573			COc1ccc(cc1OC)C(=O)NN=Cc1sc(nc1-c1ccccc1)N1CCOCC1	InChI=1S/C23H24N4O4S/c1-29-18-9-8-17(14-19(18)30-2)22(28)26-24-15-20-21(16-6-4-3-5-7-16)25-23(32-20)27-10-12-31-13-11-27/h3-9,14-15H,10-13H2,1-2H3,(H,26,28)	IESDEJUEOADSNF-UHFFFAOYSA-N	452.151825978							120584
SMR000173162	LSM-32028	BRD-A67254212, SID17408183	3210614	InChI=1S/C33H32FN3O4/c34-26-12-8-22(9-13-26)21-37(33(39)25-11-15-29-30(20-25)41-18-17-40-29)31(32(38)36-27-6-2-1-3-7-27)24-10-14-28-23(19-24)5-4-16-35-28/h4-5,8-16,19-20,27,31H,1-3,6-7,17-18,21H2,(H,36,38)	SOTNVBWCONYPHY-UHFFFAOYSA-N	Fc1ccc(CN(C(C(=O)NC2CCCCC2)c3ccc4ncccc4c3)C(=O)c5ccc6OCCOc6c5)cc1	BroadT	BRD-A67254212	BRD-A67254212-001-06-1	Asinex Ltd.	ASN 05561944			Fc1ccc(CN(C(C(=O)NC2CCCCC2)c2ccc3ncccc3c2)C(=O)c2ccc3OCCOc3c2)cc1	InChI=1S/C33H32FN3O4/c34-26-12-8-22(9-13-26)21-37(33(39)25-11-15-29-30(20-25)41-18-17-40-29)31(32(38)36-27-6-2-1-3-7-27)24-10-14-28-23(19-24)5-4-16-35-28/h4-5,8-16,19-20,27,31H,1-3,6-7,17-18,21H2,(H,36,38)	SOTNVBWCONYPHY-UHFFFAOYSA-N	553.237684734							120585
(4-Methylphenyl){4-[4-nitro-2-(1H-pyrrol-1-yl)phenyl]piperazino}methanone	LSM-32029	BRD-K59399000, SID26729368	2809896	InChI=1S/C22H22N4O3/c1-17-4-6-18(7-5-17)22(27)25-14-12-24(13-15-25)20-9-8-19(26(28)29)16-21(20)23-10-2-3-11-23/h2-11,16H,12-15H2,1H3	YOTOYGHHWCITRO-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)N2CCN(CC2)c3ccc(cc3n4cccc4)[N+](=O)[O-]	BroadT	BRD-K59399000	BRD-K59399000-001-05-0	Maybridge	HTS 00999			Cc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(cc1-n1cccc1)[N+]([O-])=O	InChI=1S/C22H22N4O3/c1-17-4-6-18(7-5-17)22(27)25-14-12-24(13-15-25)20-9-8-19(26(28)29)16-21(20)23-10-2-3-11-23/h2-11,16H,12-15H2,1H3	YOTOYGHHWCITRO-UHFFFAOYSA-N	390.169190604							120586
BAS 06901193	LSM-32030	BRD-K48406740, SID852765	655405	InChI=1S/C13H11F3N2O2S/c1-20-11(19)6-21-12-8(5-17)9(13(14,15)16)4-10(18-12)7-2-3-7/h4,7H,2-3,6H2,1H3	OEVFMFILPWISDE-UHFFFAOYSA-N	COC(=O)CSc1nc(cc(c1C#N)C(F)(F)F)C2CC2	BroadT	BRD-K48406740	BRD-K48406740-001-05-2	Asinex Ltd.	BAS 06901193			COC(=O)CSc1nc(cc(c1C#N)C(F)(F)F)C1CC1	InChI=1S/C13H11F3N2O2S/c1-20-11(19)6-21-12-8(5-17)9(13(14,15)16)4-10(18-12)7-2-3-7/h4,7H,2-3,6H2,1H3	OEVFMFILPWISDE-UHFFFAOYSA-N	316.049332902							120587
SMR000047513	LSM-32031	BRD-K66807670, SID865072	666318	InChI=1S/C18H15N7S/c1-2-6-13(7-3-1)10-11-17-22-25-16(20-21-18(25)26-17)12-24-15-9-5-4-8-14(15)19-23-24/h1-9H,10-12H2	CRNJMJIRRMJGNJ-UHFFFAOYSA-N	C(Cc1nn2c(Cn3nnc4ccccc34)nnc2s1)c5ccccc5	BroadT	BRD-K66807670	BRD-K66807670-001-05-2	InterBioScreen Ltd.	STOCK5S-33902			C(Cc1ccccc1)c1nn2c(Cn3nnc4ccccc34)nnc2s1	InChI=1S/C18H15N7S/c1-2-6-13(7-3-1)10-11-17-22-25-16(20-21-18(25)26-17)12-24-15-9-5-4-8-14(15)19-23-24/h1-9H,10-12H2	CRNJMJIRRMJGNJ-UHFFFAOYSA-N	361.11096424							120588
T5242645	LSM-32032	BRD-K48059443, SID24839899, SID3713314	2112925	InChI=1S/C20H24F2N2O4/c1-11-18(13(3)25)12(2)23-19(11)15(26)10-24(4)9-14-6-7-16(28-20(21)22)17(8-14)27-5/h6-8,20,23H,9-10H2,1-5H3	JBWDHCGTOVLRIE-UHFFFAOYSA-N	COc1cc(CN(C)CC(=O)c2[nH]c(C)c(C(=O)C)c2C)ccc1OC(F)F	BroadT	BRD-K48059443	BRD-K48059443-001-05-9	Enamine Ltd.	T5242645			COc1cc(CN(C)CC(=O)c2[nH]c(C)c(C(C)=O)c2C)ccc1OC(F)F	InChI=1S/C20H24F2N2O4/c1-11-18(13(3)25)12(2)23-19(11)15(26)10-24(4)9-14-6-7-16(28-20(21)22)17(8-14)27-5/h6-8,20,23H,9-10H2,1-5H3	JBWDHCGTOVLRIE-UHFFFAOYSA-N	394.170413668							120589
BAS 09625331	LSM-32033	BRD-A60487173, SID844427	5295151	InChI=1S/C17H15N3/c1-12-11-16-14-9-5-6-10-15(14)18-17(20(16)19-12)13-7-3-2-4-8-13/h2-11,17-18H,1H3	UOPUWDHABWQXES-UHFFFAOYSA-N	Cc1cc2c3ccccc3NC(c4ccccc4)n2n1	BroadT	BRD-A60487173	BRD-A60487173-001-06-1	Asinex Ltd.	BAS 09625331			Cc1cc2-c3ccccc3NC(c3ccccc3)n2n1	InChI=1S/C17H15N3/c1-12-11-16-14-9-5-6-10-15(14)18-17(20(16)19-12)13-7-3-2-4-8-13/h2-11,17-18H,1H3	UOPUWDHABWQXES-UHFFFAOYSA-N	261.12659751							
T5428373	LSM-32034	BRD-A41199690, SID3716391	2999585	InChI=1S/C15H16F2N2O5/c1-3-23-11(20)8-19-12(21)15(2,18-14(19)22)9-4-6-10(7-5-9)24-13(16)17/h4-7,13H,3,8H2,1-2H3,(H,18,22)	XEVPABXQPFRQRU-UHFFFAOYSA-N	CCOC(=O)CN1C(=O)NC(C)(C1=O)c2ccc(OC(F)F)cc2	BroadT	BRD-A41199690	BRD-A41199690-001-05-2	Enamine Ltd.	ZT-4700401			CCOC(=O)CN1C(=O)NC(C)(C1=O)c1ccc(OC(F)F)cc1	InChI=1S/C15H16F2N2O5/c1-3-23-11(20)8-19-12(21)15(2,18-14(19)22)9-4-6-10(7-5-9)24-13(16)17/h4-7,13H,3,8H2,1-2H3,(H,18,22)	XEVPABXQPFRQRU-UHFFFAOYSA-N	342.102728032							120591
STK579886	LSM-32035	BRD-K29383520, SID26671424	1948239	InChI=1S/C14H8N2O6/c17-7-1-2-10-8(4-7)11(18)6(5-22-10)3-9-12(19)15-14(21)16-13(9)20/h1-5,17H,(H2,15,16,19,20,21)	XUPMGKJTBJKYGZ-UHFFFAOYSA-N	Oc1ccc2OC=C(C=C3C(=O)NC(=O)NC3=O)C(=O)c2c1	BroadT	BRD-K29383520	BRD-K29383520-001-05-2	InterBioScreen Ltd.	STOCK5S-50439			Oc1ccc2occ(C=C3C(=O)NC(=O)NC3=O)c(=O)c2c1	InChI=1S/C14H8N2O6/c17-7-1-2-10-8(4-7)11(18)6(5-22-10)3-9-12(19)15-14(21)16-13(9)20/h1-5,17H,(H2,15,16,19,20,21)	XUPMGKJTBJKYGZ-UHFFFAOYSA-N	300.038235996							120592
MLS000044062	LSM-32036	BRD-K55779851, SID4249858	1521358	InChI=1S/C18H23N7O3/c1-3-27-18(26)15-14(12-23-10-6-13(2)7-11-23)25(22-19-15)17-16(20-28-21-17)24-8-4-5-9-24/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3	SWLRMOYLLOZQCB-UHFFFAOYSA-N	CCOC(=O)c1nnn(c1CN2CCC(C)CC2)c3nonc3n4cccc4	BroadT	BRD-K55779851	BRD-K55779851-001-06-5	ChemDiv Inc.	8015-3543			CCOC(=O)c1nnn(c1CN1CCC(C)CC1)-c1nonc1-n1cccc1	InChI=1S/C18H23N7O3/c1-3-27-18(26)15-14(12-23-10-6-13(2)7-11-23)25(22-19-15)17-16(20-28-21-17)24-8-4-5-9-24/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3	SWLRMOYLLOZQCB-UHFFFAOYSA-N	385.186237666							120593
3-[(4-Ethoxyphenoxy)methyl]-n,n-diethylbenzamide	LSM-32037	BRD-K79697020, SID24785665	891996	InChI=1S/C20H25NO3/c1-4-21(5-2)20(22)17-9-7-8-16(14-17)15-24-19-12-10-18(11-13-19)23-6-3/h7-14H,4-6,15H2,1-3H3	ASYZTKCBDLULEQ-UHFFFAOYSA-N	CCOc1ccc(OCc2cccc(c2)C(=O)N(CC)CC)cc1	BroadT	BRD-K79697020	BRD-K79697020-001-05-9	ChemBridge Corporation	7510722			CCOc1ccc(OCc2cccc(c2)C(=O)N(CC)CC)cc1	InChI=1S/C20H25NO3/c1-4-21(5-2)20(22)17-9-7-8-16(14-17)15-24-19-12-10-18(11-13-19)23-6-3/h7-14H,4-6,15H2,1-3H3	ASYZTKCBDLULEQ-UHFFFAOYSA-N	327.18344367							120594
MLS000525471	LSM-32038	BRD-K74660272, SID14724183	687164	InChI=1S/C14H14N2O2/c1-18-13-6-4-12(5-7-13)14(17)16-10-11-3-2-8-15-9-11/h2-9H,10H2,1H3,(H,16,17)	XMULIGBACJJUTK-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NCc2cccnc2	BroadT	BRD-K74660272	BRD-K74660272-001-11-5	Asinex Ltd.	BAS 00753091			COc1ccc(cc1)C(=O)NCc1cccnc1	InChI=1S/C14H14N2O2/c1-18-13-6-4-12(5-7-13)14(17)16-10-11-3-2-8-15-9-11/h2-9H,10H2,1H3,(H,16,17)	XMULIGBACJJUTK-UHFFFAOYSA-N	242.105527708							120595
BAS 02936847	LSM-32039	BRD-K34277236, SID24806466	746646	InChI=1S/C15H13N3S/c1-2-5-12(6-3-1)9-17-15-18-14(11-19-15)13-7-4-8-16-10-13/h1-8,10-11H,9H2,(H,17,18)	BKJUOMQIAKMYAW-UHFFFAOYSA-N	C(Nc1nc(cs1)c2cccnc2)c3ccccc3	BroadT	BRD-K34277236	BRD-K34277236-001-06-2	Asinex Ltd.	BAS 02936847			C(Nc1nc(cs1)-c1cccnc1)c1ccccc1	InChI=1S/C15H13N3S/c1-2-5-12(6-3-1)9-17-15-18-14(11-19-15)13-7-4-8-16-10-13/h1-8,10-11H,9H2,(H,17,18)	BKJUOMQIAKMYAW-UHFFFAOYSA-N	267.083018136							120596
AK-968/15360409	LSM-32040	BRD-K14116382, SID849416	651902	InChI=1S/C19H17F3N6O2/c1-11-12(10-27(3)24-11)9-26(2)18(29)14-8-17-23-13(15-5-4-6-30-15)7-16(19(20,21)22)28(17)25-14/h4-8,10H,9H2,1-3H3	FRSIPLAECDZWSH-UHFFFAOYSA-N	CN(Cc1cn(C)nc1C)C(=O)c2cc3nc(cc(n3n2)C(F)(F)F)c4occc4	BroadT	BRD-K14116382	BRD-K14116382-001-05-0	Asinex Ltd.	BAS 03612035			CN(Cc1cn(C)nc1C)C(=O)c1cc2nc(cc(n2n1)C(F)(F)F)-c1ccco1	InChI=1S/C19H17F3N6O2/c1-11-12(10-27(3)24-11)9-26(2)18(29)14-8-17-23-13(15-5-4-6-30-15)7-16(19(20,21)22)28(17)25-14/h4-8,10H,9H2,1-3H3	FRSIPLAECDZWSH-UHFFFAOYSA-N	418.136508444							120597
ZINC13282376	LSM-32041	BRD-K45817496	92445746	InChI=1S/C18H18N4O4/c1-12-7-14(10-25-2)15(8-19)18(21-12)26-11-17(24)22-20-9-13-5-3-4-6-16(13)23/h3-7,9,23H,10-11H2,1-2H3,(H,22,24)	RHLWSSJARWLVMC-UHFFFAOYSA-N	COCc1cc(C)nc(OCC(=O)NN=Cc2ccccc2O)c1C#N	BroadT	BRD-K45817496	BRD-K45817496-001-05-9	ChemDiv Inc.	1694-0008			COCc1cc(C)nc(OCC(=O)NN=Cc2ccccc2O)c1C#N	InChI=1S/C18H18N4O4/c1-12-7-14(10-25-2)15(8-19)18(21-12)26-11-17(24)22-20-9-13-5-3-4-6-16(13)23/h3-7,9,23H,10-11H2,1-2H3,(H,22,24)	RHLWSSJARWLVMC-UHFFFAOYSA-N	354.132805096							
BRD-A60076435	LSM-32042	BRD-A60076435		InChI=1S/C20H23N3O3S/c1-3-22(4-2)11-12-23-17(14-8-5-6-10-21-14)16(19(25)20(23)26)18(24)15-9-7-13-27-15/h5-10,13,16-17H,3-4,11-12H2,1-2H3	ORABNGFYUVZAJZ-UHFFFAOYSA-N	CCN(CC)CCN1C(C(C(=O)c2cccs2)C(=O)C1=O)c3ccccn3	BroadT	BRD-A60076435	BRD-A60076435-001-05-8	InterBioScreen Ltd.	STOCK3S-77926			CCN(CC)CCN1C(C(C(=O)c2cccs2)C(=O)C1=O)c1ccccn1	InChI=1S/C20H23N3O3S/c1-3-22(4-2)11-12-23-17(14-8-5-6-10-21-14)16(19(25)20(23)26)18(24)15-9-7-13-27-15/h5-10,13,16-17H,3-4,11-12H2,1-2H3	ORABNGFYUVZAJZ-UHFFFAOYSA-N	385.146012316							120599
AC1LJBPM	LSM-32043	BRD-K36737730	948010	InChI=1S/C11H17N9O/c1-4-19-8(3)9(7(2)16-19)5-13-14-10(21)6-20-11(12)15-17-18-20/h5H,4,6H2,1-3H3,(H,14,21)(H2,12,15,18)	PBQCPSIMELBFAM-UHFFFAOYSA-N	CCn1nc(C)c(C=NNC(=O)Cn2nnnc2N)c1C	BroadT	BRD-K36737730	BRD-K36737730-001-04-9	InterBioScreen Ltd.	STOCK2S-77762			CCn1nc(C)c(C=NNC(=O)Cn2nnnc2N)c1C	InChI=1S/C11H17N9O/c1-4-19-8(3)9(7(2)16-19)5-13-14-10(21)6-20-11(12)15-17-18-20/h5H,4,6H2,1-3H3,(H,14,21)(H2,12,15,18)	PBQCPSIMELBFAM-UHFFFAOYSA-N	291.155606254							120600
AC1NB8MD	LSM-32044	BRD-K18519621, SID22406085	4464197	InChI=1S/C25H24ClN3O/c1-3-17-10-9-11-18(4-2)24(17)28-23(30)16-29-22-15-8-7-14-21(22)27-25(29)19-12-5-6-13-20(19)26/h5-15H,3-4,16H2,1-2H3,(H,28,30)	OUZNWRBYLYXAAP-UHFFFAOYSA-N	CCc1cccc(CC)c1NC(=O)Cn2c(nc3ccccc23)c4ccccc4Cl	BroadT	BRD-K18519621	BRD-K18519621-001-05-2	Enamine Ltd.	T0512-4459			CCc1cccc(CC)c1NC(=O)Cn1c(nc2ccccc12)-c1ccccc1Cl	InChI=1S/C25H24ClN3O/c1-3-17-10-9-11-18(4-2)24(17)28-23(30)16-29-22-15-8-7-14-21(22)27-25(29)19-12-5-6-13-20(19)26/h5-15H,3-4,16H2,1-2H3,(H,28,30)	OUZNWRBYLYXAAP-UHFFFAOYSA-N	417.160790128							120601
1,3-Bis(3-chlorophenyl)urea	LSM-32045	1,3-Bis(3-Chlorophenyl)Urea, BRD-K73430970	139410	InChI=1S/C13H10Cl2N2O/c14-9-3-1-5-11(7-9)16-13(18)17-12-6-2-4-10(15)8-12/h1-8H,(H2,16,17,18)	HMOUVTOOMLBCPQ-UHFFFAOYSA-N	Clc1cccc(NC(=O)Nc2cccc(Cl)c2)c1	BroadT	BRD-K73430970	BRD-K73430970-001-05-1	Asinex Ltd.	BAS 01369577			Clc1cccc(NC(=O)Nc2cccc(Cl)c2)c1	InChI=1S/C13H10Cl2N2O/c14-9-3-1-5-11(7-9)16-13(18)17-12-6-2-4-10(15)8-12/h1-8H,(H2,16,17,18)	HMOUVTOOMLBCPQ-UHFFFAOYSA-N	280.01701838							120602
N-(1,1-Dimethylprop-2-ynyl)-2'-fluoro[1,1'-biphenyl]-4-carboxamide	LSM-32046	BRD-K95941120, SID26729209	2741256	InChI=1S/C18H16FNO/c1-4-18(2,3)20-17(21)14-11-9-13(10-12-14)15-7-5-6-8-16(15)19/h1,5-12H,2-3H3,(H,20,21)	KYEMOYLSRWFQBI-UHFFFAOYSA-N	CC(C)(NC(=O)c1ccc(cc1)c2ccccc2F)C#C	BroadT	BRD-K95941120	BRD-K95941120-001-05-0	Maybridge	SEW 05386			CC(C)(NC(=O)c1ccc(cc1)-c1ccccc1F)C#C	InChI=1S/C18H16FNO/c1-4-18(2,3)20-17(21)14-11-9-13(10-12-14)15-7-5-6-8-16(15)19/h1,5-12H,2-3H3,(H,20,21)	KYEMOYLSRWFQBI-UHFFFAOYSA-N	281.121592342							120603
6287-88-3	LSM-32047	BRD-K83244979, SID4257418	223910	InChI=1S/C11H12O4S/c1-14-10(12)7-16-9-6-4-3-5-8(9)11(13)15-2/h3-6H,7H2,1-2H3	VXMQJUUBNSATNU-UHFFFAOYSA-N	COC(=O)CSc1ccccc1C(=O)OC	BroadT	BRD-K83244979	BRD-K83244979-001-05-5	ChemBridge Corporation	7965768			COC(=O)CSc1ccccc1C(=O)OC	InChI=1S/C11H12O4S/c1-14-10(12)7-16-9-6-4-3-5-8(9)11(13)15-2/h3-6H,7H2,1-2H3	VXMQJUUBNSATNU-UHFFFAOYSA-N	240.045629554							120604
AN-329/41769847	LSM-32048	BRD-K60743396, SID17432286	1015208	InChI=1S/C22H20N2OS/c1-24(16-17-8-4-2-5-9-17)22(26)23-21(25)20-14-12-19(13-15-20)18-10-6-3-7-11-18/h2-15H,16H2,1H3,(H,23,25,26)	VTWVDZGKNMLBDQ-UHFFFAOYSA-N	CN(Cc1ccccc1)C(=S)NC(=O)c2ccc(cc2)c3ccccc3	BroadT	BRD-K60743396	BRD-K60743396-001-05-8	ChemBridge Corporation	7670701			CN(Cc1ccccc1)C(=S)NC(=O)c1ccc(cc1)-c1ccccc1	InChI=1S/C22H20N2OS/c1-24(16-17-8-4-2-5-9-17)22(26)23-21(25)20-14-12-19(13-15-20)18-10-6-3-7-11-18/h2-15H,16H2,1H3,(H,23,25,26)	VTWVDZGKNMLBDQ-UHFFFAOYSA-N	360.12963397							120605
PY-74	LSM-32049	BRD-K99971319, SID26725251	17893	InChI=1S/C11H11N7O2/c12-8-7(9(13)16-11(14)15-8)18-17-6-3-1-5(2-4-6)10(19)20/h1-4H,(H,19,20)(H6,12,13,14,15,16)	KJXBXATYKAWGBL-UHFFFAOYSA-N	Nc1nc(N)c(N=Nc2ccc(cc2)C(=O)O)c(N)n1	BroadT	BRD-K99971319	BRD-K99971319-001-05-4	National Cancer Institute Chemotherapeutic Agents Repository	408734			Nc1nc(N)c(N=Nc2ccc(cc2)C(O)=O)c(N)n1	InChI=1S/C11H11N7O2/c12-8-7(9(13)16-11(14)15-8)18-17-6-3-1-5(2-4-6)10(19)20/h1-4H,(H,19,20)(H6,12,13,14,15,16)	KJXBXATYKAWGBL-UHFFFAOYSA-N	273.097422662							120606
MLS000688661	LSM-32050	BRD-K77706833, SID24818400	804886	InChI=1S/C14H14N4S/c1-9-10(2)19-14-12(9)13(17-8-18-14)16-7-11-4-3-5-15-6-11/h3-6,8H,7H2,1-2H3,(H,16,17,18)	MCTNKYYXTQPWJJ-UHFFFAOYSA-N	Cc1sc2ncnc(NCc3cccnc3)c2c1C	BroadT	BRD-K77706833	BRD-K77706833-001-07-3	Asinex Ltd.	BAS 01890581			Cc1sc2ncnc(NCc3cccnc3)c2c1C	InChI=1S/C14H14N4S/c1-9-10(2)19-14-12(9)13(17-8-18-14)16-7-11-4-3-5-15-6-11/h3-6,8H,7H2,1-2H3,(H,16,17,18)	MCTNKYYXTQPWJJ-UHFFFAOYSA-N	270.093917178							120607
SMR000009277	LSM-3264	BRD-K56697208, SID845174, SID87544796, SID89650206	647508	InChI=1S/C19H24N4O2S/c1-3-4-8-12-23-15-16(22(2)18(25)21-17(15)24)20-19(23)26-13-11-14-9-6-5-7-10-14/h5-7,9-10H,3-4,8,11-13H2,1-2H3,(H,21,24,25)	ZNKHQWGJWCXYRV-UHFFFAOYSA-N	CCCCCn1c(SCCc2ccccc2)nc3N(C)C(=O)NC(=O)c13	BroadT	BRD-K56697208	BRD-K56697208-001-05-0	Asinex Ltd.	BAS 00620115			CCCCCn1c(SCCc2ccccc2)nc2n(C)c(=O)[nH]c(=O)c12	InChI=1S/C19H24N4O2S/c1-3-4-8-12-23-15-16(22(2)18(25)21-17(15)24)20-19(23)26-13-11-14-9-6-5-7-10-14/h5-7,9-10H,3-4,8,11-13H2,1-2H3,(H,21,24,25)	ZNKHQWGJWCXYRV-UHFFFAOYSA-N	372.161996738							92997
F0305-0009	LSM-32051	BRD-K10433727, SID4257343	2056026	InChI=1S/C17H14N2O4S/c20-24(21,16-5-1-3-13-4-2-8-18-17(13)16)19-10-12-6-7-14-15(9-12)23-11-22-14/h1-9,19H,10-11H2	XHGMGANVHATTCQ-UHFFFAOYSA-N	O=S(=O)(NCc1ccc2OCOc2c1)c3cccc4cccnc34	BroadT	BRD-K10433727	BRD-K10433727-001-05-7	ChemBridge Corporation	5807673			O=S(=O)(NCc1ccc2OCOc2c1)c1cccc2cccnc12	InChI=1S/C17H14N2O4S/c20-24(21,16-5-1-3-13-4-2-8-18-17(13)16)19-10-12-6-7-14-15(9-12)23-11-22-14/h1-9,19H,10-11H2	XHGMGANVHATTCQ-UHFFFAOYSA-N	342.067427638							120608
BDBM68439	LSM-32052	BRD-A10417568	75647655	InChI=1S/C20H18N4OS2/c25-15-9-4-8-14-17(15)18(16-10-5-11-26-16)24-19(21-14)22-20(23-24)27-12-13-6-2-1-3-7-13/h1-3,5-7,10-11,17-18H,4,8-9,12H2	OPAODMCTWKLSLB-UHFFFAOYSA-N	O=C1CCCC2=Nc3nc(SCc4ccccc4)nn3C(C12)c5cccs5	BroadT	BRD-A10417568	BRD-A10417568-001-06-2	InterBioScreen Ltd.	STOCK5S-50541			O=C1CCCC2=Nc3nc(SCc4ccccc4)nn3C(C12)c1cccs1	InChI=1S/C20H18N4OS2/c25-15-9-4-8-14-17(15)18(16-10-5-11-26-16)24-19(21-14)22-20(23-24)27-12-13-6-2-1-3-7-13/h1-3,5-7,10-11,17-18H,4,8-9,12H2	OPAODMCTWKLSLB-UHFFFAOYSA-N	394.092202616							120609
AC1LGAVW	LSM-32053	BRD-K62572662, SID24807605	818230	InChI=1S/C19H17N3O2/c1-12-14-9-17(23-2)18(24-3)10-15(14)16-11-20-22(19(16)21-12)13-7-5-4-6-8-13/h4-11H,1-3H3	WFJVPPJMIKWAIJ-UHFFFAOYSA-N	COc1cc2c(C)nc3c(cnn3c4ccccc4)c2cc1OC	BroadT	BRD-K62572662	BRD-K62572662-001-05-6	Asinex Ltd.	BAS 00340121			COc1cc2c(C)nc3n(ncc3c2cc1OC)-c1ccccc1	InChI=1S/C19H17N3O2/c1-12-14-9-17(23-2)18(24-3)10-15(14)16-11-20-22(19(16)21-12)13-7-5-4-6-8-13/h4-11H,1-3H3	WFJVPPJMIKWAIJ-UHFFFAOYSA-N	319.132076814							120610
T5235590	LSM-32054	BRD-K60306319, SID24839893, SID3713137	2102778	InChI=1S/C18H17ClF3N3O3S2/c19-15-10-13(18(20,21)22)11-23-17(15)29-12-16(26)24-6-8-25(9-7-24)30(27,28)14-4-2-1-3-5-14/h1-5,10-11H,6-9,12H2	BLYQANHXALTOAJ-UHFFFAOYSA-N	FC(F)(F)c1cnc(SCC(=O)N2CCN(CC2)S(=O)(=O)c3ccccc3)c(Cl)c1	BroadT	BRD-K60306319	BRD-K60306319-001-05-8	Enamine Ltd.	T5235590			FC(F)(F)c1cnc(SCC(=O)N2CCN(CC2)S(=O)(=O)c2ccccc2)c(Cl)c1	InChI=1S/C18H17ClF3N3O3S2/c19-15-10-13(18(20,21)22)11-23-17(15)29-12-16(26)24-6-8-25(9-7-24)30(27,28)14-4-2-1-3-5-14/h1-5,10-11H,6-9,12H2	BLYQANHXALTOAJ-UHFFFAOYSA-N	479.035195124							120611
SMR000175758	LSM-32055	BRD-K56942203, SID17508197	1074927	InChI=1S/C18H12ClN3O3S/c19-13-5-3-4-12(8-13)18(23)21-14-9-15(22(24)25)11-16(10-14)26-17-6-1-2-7-20-17/h1-11H,(H,21,23)	RRNHSCGHVCZZII-UHFFFAOYSA-N	[O-][N+](=O)c1cc(NC(=O)c2cccc(Cl)c2)cc(Sc3ccccn3)c1	BroadT	BRD-K56942203	BRD-K56942203-001-06-3	Asinex Ltd.	BAS 00666502			[O-][N+](=O)c1cc(NC(=O)c2cccc(Cl)c2)cc(Sc2ccccn2)c1	InChI=1S/C18H12ClN3O3S/c19-13-5-3-4-12(8-13)18(23)21-14-9-15(22(24)25)11-16(10-14)26-17-6-1-2-7-20-17/h1-11H,(H,21,23)	RRNHSCGHVCZZII-UHFFFAOYSA-N	385.028789674							120612
AC1M5NM3	LSM-32056	BRD-K97081185	2332493	InChI=1S/C15H12BrN3OS/c1-19-12-8-4-5-9-13(12)21-15(19)18-17-14(20)10-6-2-3-7-11(10)16/h2-9H,1H3,(H,17,20)	PGGXXGQFUOASSI-UHFFFAOYSA-N	CN1C(=NNC(=O)c2ccccc2Br)Sc3ccccc13	BroadT	BRD-K97081185	BRD-K97081185-001-05-5	Enamine Ltd.	T0500-5752			Cn1c2ccccc2sc1=NNC(=O)c1ccccc1Br	InChI=1S/C15H12BrN3OS/c1-19-12-8-4-5-9-13(12)21-15(19)18-17-14(20)10-6-2-3-7-11(10)16/h2-9H,1H3,(H,17,20)	PGGXXGQFUOASSI-UHFFFAOYSA-N	360.988445324							120613
AC1NJF49	LSM-32057	BRD-A23434937, SID24790727	4871376	InChI=1S/C21H17ClN2O5S2/c22-8-3-1-7(2-4-8)12-13-9-5-10(16(13)30-18-17(12)31-21(29)23-18)15-14(9)19(27)24(20(15)28)6-11(25)26/h1-4,9-10,12-16H,5-6H2,(H,23,29)(H,25,26)	FXXPMNMDMFDBKP-UHFFFAOYSA-N	OC(=O)CN1C(=O)C2C3CC(C4C3Sc5nc(O)sc5C4c6ccc(Cl)cc6)C2C1=O	BroadT	BRD-A23434937	BRD-A23434937-001-05-8	Life Chemicals Inc.	F1734-0067			OC(=O)CN1C(=O)C2C3CC(C4C3Sc3nc(O)sc3C4c3ccc(Cl)cc3)C2C1=O	InChI=1S/C21H17ClN2O5S2/c22-8-3-1-7(2-4-8)12-13-9-5-10(16(13)30-18-17(12)31-21(29)23-18)15-14(9)19(27)24(20(15)28)6-11(25)26/h1-4,9-10,12-16H,5-6H2,(H,23,29)(H,25,26)	FXXPMNMDMFDBKP-UHFFFAOYSA-N	476.026740754							120614
2-(6-Cyano-indol-1-yl)-n-cyclohexyl-acetamide	LSM-32058	BRD-K93543569, SID843163	645441	InChI=1S/C17H19N3O/c18-11-13-6-7-14-8-9-20(16(14)10-13)12-17(21)19-15-4-2-1-3-5-15/h6-10,15H,1-5,12H2,(H,19,21)	RXMIGIZQJGELGV-UHFFFAOYSA-N	O=C(Cn1ccc2ccc(cc12)C#N)NC3CCCCC3	BroadT	BRD-K93543569	BRD-K93543569-001-05-4	Asinex Ltd.	BAS 09623654			O=C(Cn1ccc2ccc(cc12)C#N)NC1CCCCC1	InChI=1S/C17H19N3O/c18-11-13-6-7-14-8-9-20(16(14)10-13)12-17(21)19-15-4-2-1-3-5-15/h6-10,15H,1-5,12H2,(H,19,21)	RXMIGIZQJGELGV-UHFFFAOYSA-N	281.152812258							120615
AC1OAP4U	LSM-32059	BRD-K64591035	6808134	InChI=1S/C16H19NO3/c1-3-4-7-10-17-11(2)14-15(18)12-8-5-6-9-13(12)20-16(14)19/h5-6,8-9,19H,3-4,7,10H2,1-2H3	ZOFVQCPJAPTLEG-UHFFFAOYSA-N	CCCCCN=C(C)C1=C(O)Oc2ccccc2C1=O	BroadT	BRD-K64591035	BRD-K64591035-001-06-2	ChemBridge Corporation	5102865			CCCCCN=C(C)c1c(O)oc2ccccc2c1=O	InChI=1S/C16H19NO3/c1-3-4-7-10-17-11(2)14-15(18)12-8-5-6-9-13(12)20-16(14)19/h5-6,8-9,19H,3-4,7,10H2,1-2H3	ZOFVQCPJAPTLEG-UHFFFAOYSA-N	273.136493478							
ST043756	LSM-32060	BRD-K79712504, SID4261137	670001	InChI=1S/C14H19NO3S/c1-2-18-14(17)11-5-7-15(8-6-11)13(16)10-12-4-3-9-19-12/h3-4,9,11H,2,5-8,10H2,1H3	YWUSFSDLDXNEKF-UHFFFAOYSA-N	CCOC(=O)C1CCN(CC1)C(=O)Cc2cccs2	BroadT	BRD-K79712504	BRD-K79712504-001-05-1	ChemBridge Corporation	6232901			CCOC(=O)C1CCN(CC1)C(=O)Cc1cccs1	InChI=1S/C14H19NO3S/c1-2-18-14(17)11-5-7-15(8-6-11)13(16)10-12-4-3-9-19-12/h3-4,9,11H,2,5-8,10H2,1H3	YWUSFSDLDXNEKF-UHFFFAOYSA-N	281.108564168							120618
SMR000119238	LSM-32061	BRD-A96536816, SID14721651	3219071	InChI=1S/C20H30N4O4S/c1-12(18(25)22-13-8-4-2-5-9-13)28-20(27)17-15(21)16(24-29-17)19(26)23-14-10-6-3-7-11-14/h12-14H,2-11,21H2,1H3,(H,22,25)(H,23,26)	JLMSMGISUYQFSP-UHFFFAOYSA-N	CC(OC(=O)c1snc(C(=O)NC2CCCCC2)c1N)C(=O)NC3CCCCC3	BroadT	BRD-A96536816	BRD-A96536816-001-05-8	Asinex Ltd.	ASN 06264475			CC(OC(=O)c1snc(C(=O)NC2CCCCC2)c1N)C(=O)NC1CCCCC1	InChI=1S/C20H30N4O4S/c1-12(18(25)22-13-8-4-2-5-9-13)28-20(27)17-15(21)16(24-29-17)19(26)23-14-10-6-3-7-11-14/h12-14H,2-11,21H2,1H3,(H,22,25)(H,23,26)	JLMSMGISUYQFSP-UHFFFAOYSA-N	422.19877617							120619
MLS000579442	LSM-32062	BRD-K29820234, SID17506741	1313841	InChI=1S/C21H16ClNO5/c1-14(24)16-7-11-17(12-8-16)27-13-15-5-9-18(10-6-15)28-21-19(22)3-2-4-20(21)23(25)26/h2-12H,13H2,1H3	QOHUQCONBIESPG-UHFFFAOYSA-N	CC(=O)c1ccc(OCc2ccc(Oc3c(Cl)cccc3[N+](=O)[O-])cc2)cc1	BroadT	BRD-K29820234	BRD-K29820234-001-05-0	ChemBridge Corporation	7632832			CC(=O)c1ccc(OCc2ccc(Oc3c(Cl)cccc3[N+]([O-])=O)cc2)cc1	InChI=1S/C21H16ClNO5/c1-14(24)16-7-11-17(12-8-16)27-13-15-5-9-18(10-6-15)28-21-19(22)3-2-4-20(21)23(25)26/h2-12H,13H2,1H3	QOHUQCONBIESPG-UHFFFAOYSA-N	397.071700332							120620
MLS000032454	LSM-32063	BRD-K94346447, SID847932	650350	InChI=1S/C17H21N5O2S/c1-3-22-16(12-4-5-12)20-21-17(22)25-10-15(24)19-14-8-6-13(7-9-14)18-11(2)23/h6-9,12H,3-5,10H2,1-2H3,(H,18,23)(H,19,24)	RCEWNKADOBBYMI-UHFFFAOYSA-N	CCn1c(SCC(=O)Nc2ccc(NC(=O)C)cc2)nnc1C3CC3	BroadT	BRD-K94346447	BRD-K94346447-001-06-7	Asinex Ltd.	ASN 05988771			CCn1c(SCC(=O)Nc2ccc(NC(C)=O)cc2)nnc1C1CC1	InChI=1S/C17H21N5O2S/c1-3-22-16(12-4-5-12)20-21-17(22)25-10-15(24)19-14-8-6-13(7-9-14)18-11(2)23/h6-9,12H,3-5,10H2,1-2H3,(H,18,23)(H,19,24)	RCEWNKADOBBYMI-UHFFFAOYSA-N	359.141595652							120621
ST50831857	LSM-32064	BRD-K98890753, SID14718842	4071290	InChI=1S/C10H15N3O2S/c1-2-3-6-11-10(16)13-12-9(14)8-5-4-7-15-8/h4-5,7H,2-3,6H2,1H3,(H,12,14)(H2,11,13,16)	NOOUPGABZCUYOG-UHFFFAOYSA-N	CCCCN=C(S)NNC(=O)c1occc1	BroadT	BRD-K98890753	BRD-K98890753-001-05-0	Specs	AK-968/41172164			CCCCN=C(S)NNC(=O)c1ccco1	InChI=1S/C10H15N3O2S/c1-2-3-6-11-10(16)13-12-9(14)8-5-4-7-15-8/h4-5,7H,2-3,6H2,1H3,(H,12,14)(H2,11,13,16)	NOOUPGABZCUYOG-UHFFFAOYSA-N	241.08849744							120622
ST50924923	LSM-32065	BRD-K53943097, SID24803051	752806	InChI=1S/C12H12N4O4S/c1-20-12(17)15-9-3-5-10(6-4-9)21(18,19)16-11-13-7-2-8-14-11/h2-8H,1H3,(H,15,17)(H,13,14,16)	UBWGKESGQORLBW-UHFFFAOYSA-N	COC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2ncccn2	BroadT	BRD-K53943097	BRD-K53943097-001-05-5	ChemBridge Corporation	7250008			COC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1	InChI=1S/C12H12N4O4S/c1-20-12(17)15-9-3-5-10(6-4-9)21(18,19)16-11-13-7-2-8-14-11/h2-8H,1H3,(H,15,17)(H,13,14,16)	UBWGKESGQORLBW-UHFFFAOYSA-N	308.057925594							120623
MLS001003696	LSM-32066	BRD-K69594935, SID24825540	4171246	InChI=1S/C18H27N3S/c1-2-6-15-9-11-17(12-10-15)20-21-18(22)19-14-13-16-7-4-3-5-8-16/h3-5,7-8,15H,2,6,9-14H2,1H3,(H2,19,21,22)	MGVCRIARJDLWPT-UHFFFAOYSA-N	CCCC1CCC(=NN=C(S)NCCc2ccccc2)CC1	BroadT	BRD-K69594935	BRD-K69594935-001-05-4	Enamine Ltd.	T0509-9227			CCCC1CCC(CC1)=NN=C(S)NCCc1ccccc1	InChI=1S/C18H27N3S/c1-2-6-15-9-11-17(12-10-15)20-21-18(22)19-14-13-16-7-4-3-5-8-16/h3-5,7-8,15H,2,6,9-14H2,1H3,(H2,19,21,22)	MGVCRIARJDLWPT-UHFFFAOYSA-N	317.192568584							
AC1MXT36	LSM-32067	BRD-A61046366	3770965	InChI=1S/C17H17N5O4/c23-21(24)12-8-9-16(17(11-12)22(25)26)20-19-15-7-2-1-5-13(15)14-6-3-4-10-18-14/h3-4,6,8-11,13,20H,1-2,5,7H2	OXWJCYWFEMNOSV-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NN=C2CCCCC2c3ccccn3)c(c1)[N+](=O)[O-]	BroadT	BRD-A61046366	BRD-A61046366-001-05-3	InterBioScreen Ltd.	STOCK3S-30318			[O-][N+](=O)c1ccc(NN=C2CCCCC2c2ccccn2)c(c1)[N+]([O-])=O	InChI=1S/C17H17N5O4/c23-21(24)12-8-9-16(17(11-12)22(25)26)20-19-15-7-2-1-5-13(15)14-6-3-4-10-18-14/h3-4,6,8-11,13,20H,1-2,5,7H2	OXWJCYWFEMNOSV-UHFFFAOYSA-N	355.128054074							120625
AC1NGUTM	LSM-32068	BRD-A97198094, SID26670488	4780335	InChI=1S/C18H22N2O6/c1-5-24-11-6-7-13-12(8-11)10(4)15(25-13)17(22)26-14(9(2)3)16(21)20-18(19)23/h6-9,14H,5H2,1-4H3,(H3,19,20,21,23)	SYRBMQNGBDFIGM-UHFFFAOYSA-N	CCOc1ccc2oc(C(=O)OC(C(C)C)C(=O)NC(=O)N)c(C)c2c1	BroadT	BRD-A97198094	BRD-A97198094-001-05-9	Enamine Ltd.	T5344283			CCOc1ccc2oc(C(=O)OC(C(C)C)C(=O)NC(N)=O)c(C)c2c1	InChI=1S/C18H22N2O6/c1-5-24-11-6-7-13-12(8-11)10(4)15(25-13)17(22)26-14(9(2)3)16(21)20-18(19)23/h6-9,14H,5H2,1-4H3,(H3,19,20,21,23)	SYRBMQNGBDFIGM-UHFFFAOYSA-N	362.147786444							120626
MLS000334753	LSM-32069	BRD-K80679698, SID22404021	2443410	InChI=1S/C19H21ClN6/c1-13-7-3-6-10-16(13)22-19-24-17(23-18(21)25-19)12-26(2)11-14-8-4-5-9-15(14)20/h3-10H,11-12H2,1-2H3,(H3,21,22,23,24,25)	RQLJXERUHJDFLW-UHFFFAOYSA-N	CN(Cc1ccccc1Cl)Cc2nc(N)nc(Nc3ccccc3C)n2	BroadT	BRD-K80679698	BRD-K80679698-001-06-3	Enamine Ltd.	T5307517			CN(Cc1nc(N)nc(Nc2ccccc2C)n1)Cc1ccccc1Cl	InChI=1S/C19H21ClN6/c1-13-7-3-6-10-16(13)22-19-24-17(23-18(21)25-19)12-26(2)11-14-8-4-5-9-15(14)20/h3-10H,11-12H2,1-2H3,(H3,21,22,23,24,25)	RQLJXERUHJDFLW-UHFFFAOYSA-N	368.151622442							120627
ZINC00468544	LSM-32070	BRD-K15977595, SID17504402	892549	InChI=1S/C14H13N3O2S2/c1-9(18)15-14(20)17-11-6-4-10(5-7-11)16-13(19)12-3-2-8-21-12/h2-8H,1H3,(H,16,19)(H2,15,17,18,20)	WUBOIYCIGKCDMC-UHFFFAOYSA-N	CC(=O)NC(=S)Nc1ccc(NC(=O)c2cccs2)cc1	BroadT	BRD-K15977595	BRD-K15977595-001-05-7	ChemBridge Corporation	7544011			CC(=O)NC(=S)Nc1ccc(NC(=O)c2cccs2)cc1	InChI=1S/C14H13N3O2S2/c1-9(18)15-14(20)17-11-6-4-10(5-7-11)16-13(19)12-3-2-8-21-12/h2-8H,1H3,(H,16,19)(H2,15,17,18,20)	WUBOIYCIGKCDMC-UHFFFAOYSA-N	319.044918066							120628
AC1LRVPA	LSM-32071	BRD-K83218047, SID24808585	1428855	InChI=1S/C20H23N7O2/c1-29-16-8-6-15(7-9-16)25-10-12-26(13-11-25)19(28)14-27-23-20(22-24-27)17-4-2-3-5-18(17)21/h2-9H,10-14,21H2,1H3	KBMZEMFXGFQYSX-UHFFFAOYSA-N	COc1ccc(cc1)N2CCN(CC2)C(=O)Cn3nnc(n3)c4ccccc4N	BroadT	BRD-K83218047	BRD-K83218047-001-05-7	Asinex Ltd.	ASN 04886838			COc1ccc(cc1)N1CCN(CC1)C(=O)Cn1nnc(n1)-c1ccccc1N	InChI=1S/C20H23N7O2/c1-29-16-8-6-15(7-9-16)25-10-12-26(13-11-25)19(28)14-27-23-20(22-24-27)17-4-2-3-5-18(17)21/h2-9H,10-14,21H2,1H3	KBMZEMFXGFQYSX-UHFFFAOYSA-N	393.191323046							120629
SMR000203881	LSM-32072	BRD-K85615919, SID17510781	2877351	InChI=1S/C10H8N4O3S/c15-9(5-18-10-11-6-12-13-10)7-2-1-3-8(4-7)14(16)17/h1-4,6H,5H2,(H,11,12,13)	NEODFQWDNHLXRI-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(c1)C(=O)CSc2nc[nH]n2	BroadT	BRD-K85615919	BRD-K85615919-001-06-5	ChemDiv Inc.	3743-0012			[O-][N+](=O)c1cccc(c1)C(=O)CSc1nc[nH]n1	InChI=1S/C10H8N4O3S/c15-9(5-18-10-11-6-12-13-10)7-2-1-3-8(4-7)14(16)17/h1-4,6H,5H2,(H,11,12,13)	NEODFQWDNHLXRI-UHFFFAOYSA-N	264.031710846							120630
T0505-4751	LSM-32073	BRD-K92913067, SID24828381	2332818	InChI=1S/C15H14F2N2S2/c16-14(17)21-13-8-6-12(7-9-13)19-15(20)18-10-11-4-2-1-3-5-11/h1-9,14H,10H2,(H2,18,19,20)	VGWWZMKRAPIHKI-UHFFFAOYSA-N	FC(F)Sc1ccc(NC(=NCc2ccccc2)S)cc1	BroadT	BRD-K92913067	BRD-K92913067-001-05-7	Enamine Ltd.	T0505-4751			FC(F)Sc1ccc(NC(S)=NCc2ccccc2)cc1	InChI=1S/C15H14F2N2S2/c16-14(17)21-13-8-6-12(7-9-13)19-15(20)18-10-11-4-2-1-3-5-11/h1-9,14H,10H2,(H2,18,19,20)	VGWWZMKRAPIHKI-UHFFFAOYSA-N	324.056646248							120631
MLS000673037	LSM-44382	BRD-K51956957	16193780	InChI=1S/C23H22N4O3S/c1-30-16-8-9-18-17(12-16)19-20(24-18)22(29)27(23(31)25-19)13-14-4-6-15(7-5-14)21(28)26-10-2-3-11-26/h4-9,12,29H,2-3,10-11,13H2,1H3,(H,25,31)	DUMQAXQXEIHHMC-UHFFFAOYSA-N	COc1ccc2nc3c(O)n(Cc4ccc(cc4)C(=O)N5CCCC5)c(S)nc3c2c1	BroadT	BRD-K51956957	BRD-K51956957-001-05-8	ChemDiv Inc.	C674-0090			COc1ccc2nc3c(O)n(Cc4ccc(cc4)C(=O)N4CCCC4)c(S)nc3c2c1	InChI=1S/C23H22N4O3S/c1-30-16-8-9-18-17(12-16)19-20(24-18)22(29)27(23(31)25-19)13-14-4-6-15(7-5-14)21(28)26-10-2-3-11-26/h4-9,12,29H,2-3,10-11,13H2,1H3,(H,25,31)	DUMQAXQXEIHHMC-UHFFFAOYSA-N	434.141261294							
AE-641/30177051	LSM-15527	BRD-K77281588	1716363	InChI=1S/C18H31NO2S/c1-5-6-7-8-9-12-22-18-14-16(20-3)15(10-11-19-2)13-17(18)21-4/h13-14,19H,5-12H2,1-4H3	QHYGSNAGFBDJNF-UHFFFAOYSA-N	CCCCCCCSc1cc(OC)c(CCNC)cc1OC	BroadT	BRD-K77281588	BRD-K77281588-050-06-3	Specs	AE-641/30177051		OC(=O)/C=C\C(=O)O	CCCCCCCSc1cc(OC)c(CCNC)cc1OC.OC(=O)/C=C\C(=O)O	InChI=1S/C18H31NO2S.C4H4O4/c1-5-6-7-8-9-12-22-18-14-16(20-3)15(10-11-19-2)13-17(18)21-4;5-3(6)1-2-4(7)8/h13-14,19H,5-12H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1-	IGGYDCCELBGULX-BTJKTKAUSA-N	325.207549932							104163, 104163
ZINC00665027	LSM-32075	BRD-K12223973, SID26666937	1006392	InChI=1S/C16H15BrN6O2S/c1-2-9-23-21-15(20-22-23)19-16(26)18-14(24)13-8-7-12(25-13)10-3-5-11(17)6-4-10/h3-8H,2,9H2,1H3,(H2,18,19,21,24,26)	MPPNRIHCUHCBFR-UHFFFAOYSA-N	CCCn1nnc(NC(=S)NC(=O)c2oc(cc2)c3ccc(Br)cc3)n1	BroadT	BRD-K12223973	BRD-K12223973-001-05-1	InterBioScreen Ltd.	STOCK4S-28050			CCCn1nnc(NC(=S)NC(=O)c2ccc(o2)-c2ccc(Br)cc2)n1	InChI=1S/C16H15BrN6O2S/c1-2-9-23-21-15(20-22-23)19-16(26)18-14(24)13-8-7-12(25-13)10-3-5-11(17)6-4-10/h3-8H,2,9H2,1H3,(H2,18,19,21,24,26)	MPPNRIHCUHCBFR-UHFFFAOYSA-N	434.01605707							120633
ZINC00235183	LSM-44383	SID7977944, BRD-K37331547	771491	InChI=1S/C15H15NO3/c17-13(5-6-16-7-9-18-10-8-16)15-11-12-3-1-2-4-14(12)19-15/h1-6,11H,7-10H2/b6-5+	PVDOFCYXPIFXML-AATRIKPKSA-N	O=C(\C=C\N1CCOCC1)c2oc3ccccc3c2	BroadT	BRD-K37331547	BRD-K37331547-001-05-0	ChemBridge Corporation	5236696			O=C(\C=C\N1CCOCC1)c1cc2ccccc2o1	InChI=1S/C15H15NO3/c17-13(5-6-16-7-9-18-10-8-16)15-11-12-3-1-2-4-14(12)19-15/h1-6,11H,7-10H2/b6-5+	PVDOFCYXPIFXML-AATRIKPKSA-N	257.10519335							
5391-30-0	LSM-32077	BRD-K98109987, SID26731096	2735618	InChI=1S/C7H7BrN2S/c8-5-3-1-2-4-6(5)10-7(9)11/h1-4H,(H3,9,10,11)	QIGMVYSPXPXCPN-UHFFFAOYSA-N	NC(=Nc1ccccc1Br)S	BroadT	BRD-K98109987	BRD-K98109987-001-05-3	Maybridge	SPB 06634			NC(S)=Nc1ccccc1Br	InChI=1S/C7H7BrN2S/c8-5-3-1-2-4-6(5)10-7(9)11/h1-4H,(H3,9,10,11)	QIGMVYSPXPXCPN-UHFFFAOYSA-N	229.951331534							120635
AMBCB71790090	LSM-32078	BRD-A57174914, SID24790327	16189508	InChI=1S/C19H24N2O4S2/c1-14-9-11-26-18(14)19(22)21-10-3-4-15(13-21)12-20-27(23,24)17-7-5-16(25-2)6-8-17/h5-9,11,15,20H,3-4,10,12-13H2,1-2H3	TZUCLPJPSGNKEJ-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)NCC2CCCN(C2)C(=O)c3sccc3C	BroadT	BRD-A57174914	BRD-A57174914-001-05-6	ChemBridge Corporation	71790090			COc1ccc(cc1)S(=O)(=O)NCC1CCCN(C1)C(=O)c1sccc1C	InChI=1S/C19H24N2O4S2/c1-14-9-11-26-18(14)19(22)21-10-3-4-15(13-21)12-20-27(23,24)17-7-5-16(25-2)6-8-17/h5-9,11,15,20H,3-4,10,12-13H2,1-2H3	TZUCLPJPSGNKEJ-UHFFFAOYSA-N	408.117748648							120636
SMR000030919	LSM-32079	SID26724475, SID4251153, BRD-K40602242	3244875	InChI=1S/C23H23FN4O4S/c24-16-4-1-2-5-18(16)26-8-10-27(11-9-26)21(29)6-3-7-28-22(30)15-12-19-20(32-14-31-19)13-17(15)25-23(28)33/h1-2,4-5,12-13H,3,6-11,14H2,(H,25,33)	NNKLCXSVJNSYGL-UHFFFAOYSA-N	Fc1ccccc1N2CCN(CC2)C(=O)CCCN3C(=S)Nc4cc5OCOc5cc4C3=O	BroadT	BRD-K40602242	BRD-K40602242-001-06-5	ChemDiv Inc.	K284-5275			Fc1ccccc1N1CCN(CC1)C(=O)CCCn1c(=S)[nH]c2cc3OCOc3cc2c1=O	InChI=1S/C23H23FN4O4S/c24-16-4-1-2-5-18(16)26-8-10-27(11-9-26)21(29)6-3-7-28-22(30)15-12-19-20(32-14-31-19)13-17(15)25-23(28)33/h1-2,4-5,12-13H,3,6-11,14H2,(H,25,33)	NNKLCXSVJNSYGL-UHFFFAOYSA-N	470.142404146							120637
SMR000046514	LSM-32080	BRD-K95688447, SID864144	665392	InChI=1S/C17H13N3O4/c1-11(21)16-14(10-24-17(22)12-5-4-8-18-9-12)19-13-6-2-3-7-15(13)20(16)23/h2-9H,10H2,1H3	KCRWYDLSCHKTSX-UHFFFAOYSA-N	CC(=O)c1c(COC(=O)c2cccnc2)nc3ccccc3[n+]1[O-]	BroadT	BRD-K95688447	BRD-K95688447-001-05-3	InterBioScreen Ltd.	STOCK5S-05153			CC(=O)c1c(COC(=O)c2cccnc2)nc2ccccc2[n+]1[O-]	InChI=1S/C17H13N3O4/c1-11(21)16-14(10-24-17(22)12-5-4-8-18-9-12)19-13-6-2-3-7-15(13)20(16)23/h2-9H,10H2,1H3	KCRWYDLSCHKTSX-UHFFFAOYSA-N	323.090605926							120638
1-Bromo-3-(5,5-dimethyl-3-phenyl-4,5-dihydropyrazolo[4,3-a]carbazol-10(3H)-yl)propan-2-ol	LSM-32081	SID14742352, BRD-A77697958	3775737	InChI=1S/C24H24BrN3O/c1-24(2)12-21-19(14-26-28(21)16-8-4-3-5-9-16)23-22(24)18-10-6-7-11-20(18)27(23)15-17(29)13-25/h3-11,14,17,29H,12-13,15H2,1-2H3	IMCIDXDPSMQGLU-UHFFFAOYSA-N	CC1(C)Cc2c(cnn2c3ccccc3)c4c1c5ccccc5n4CC(O)CBr	BroadT	BRD-A77697958	BRD-A77697958-001-05-9	InterBioScreen Ltd.	STOCK1S-31661			CC1(C)Cc2c(cnn2-c2ccccc2)-c2c1c1ccccc1n2CC(O)CBr	InChI=1S/C24H24BrN3O/c1-24(2)12-21-19(14-26-28(21)16-8-4-3-5-9-16)23-22(24)18-10-6-7-11-20(18)27(23)15-17(29)13-25/h3-11,14,17,29H,12-13,15H2,1-2H3	IMCIDXDPSMQGLU-UHFFFAOYSA-N	449.110275018							120639
MLS000539144	LSM-32082	BRD-K19040998, SID17416226	5147767	InChI=1S/C24H16Cl2F5N3O3/c1-10-23(11(2)34(33-10)8-14-18(27)20(29)22(31)21(30)19(14)28)32-24(35)17-6-4-13(37-17)9-36-16-5-3-12(25)7-15(16)26/h3-7H,8-9H2,1-2H3,(H,32,35)	HMAOBYVPCGRUKK-UHFFFAOYSA-N	Cc1nn(Cc2c(F)c(F)c(F)c(F)c2F)c(C)c1NC(=O)c3oc(COc4ccc(Cl)cc4Cl)cc3	BroadT	BRD-K19040998	BRD-K19040998-001-06-1	Specs	AK-968/41923688			Cc1nn(Cc2c(F)c(F)c(F)c(F)c2F)c(C)c1NC(=O)c1ccc(COc2ccc(Cl)cc2Cl)o1	InChI=1S/C24H16Cl2F5N3O3/c1-10-23(11(2)34(33-10)8-14-18(27)20(29)22(31)21(30)19(14)28)32-24(35)17-6-4-13(37-17)9-36-16-5-3-12(25)7-15(16)26/h3-7H,8-9H2,1-2H3,(H,32,35)	HMAOBYVPCGRUKK-UHFFFAOYSA-N	559.048887822							120640
Ethyl 3-(2-chlorophenyl)-3-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)amino]propanoate	LSM-32083	BRD-A42536341, SID24839389, SID4242623	3237453	InChI=1S/C22H29ClN6O4/c1-2-33-19(30)15-18(16-5-3-4-6-17(16)23)24-20-25-21(28-7-11-31-12-8-28)27-22(26-20)29-9-13-32-14-10-29/h3-6,18H,2,7-15H2,1H3,(H,24,25,26,27)	KZBGGLZPIXJGLN-UHFFFAOYSA-N	CCOC(=O)CC(Nc1nc(nc(n1)N2CCOCC2)N3CCOCC3)c4ccccc4Cl	BroadT	BRD-A42536341	BRD-A42536341-001-05-7	ChemDiv Inc.	8015-3468			CCOC(=O)CC(Nc1nc(nc(n1)N1CCOCC1)N1CCOCC1)c1ccccc1Cl	InChI=1S/C22H29ClN6O4/c1-2-33-19(30)15-18(16-5-3-4-6-17(16)23)24-20-25-21(28-7-11-31-12-8-28)27-22(26-20)29-9-13-32-14-10-29/h3-6,18H,2,7-15H2,1H3,(H,24,25,26,27)	KZBGGLZPIXJGLN-UHFFFAOYSA-N	476.193881178							120641
AC1LSOFD	LSM-32084	BRD-K55841827	1491456	InChI=1S/C11H10N4OS/c1-8-4-2-3-5-9(8)6-12-14-11(16)10-7-17-15-13-10/h2-7H,1H3,(H,14,16)	DCHJBOSLQRMIFB-UHFFFAOYSA-N	Cc1ccccc1C=NNC(=O)c2csnn2	BroadT	BRD-K55841827	BRD-K55841827-001-05-6	Key Organics Ltd.	1R-1036			Cc1ccccc1C=NNC(=O)c1csnn1	InChI=1S/C11H10N4OS/c1-8-4-2-3-5-9(8)6-12-14-11(16)10-7-17-15-13-10/h2-7H,1H3,(H,14,16)	DCHJBOSLQRMIFB-UHFFFAOYSA-N	246.05753167							120642
N-Cyclohexyl-1-indolinecarboxamide	LSM-32085	BRD-K06148713, SID4260339	707165	InChI=1S/C15H20N2O/c18-15(16-13-7-2-1-3-8-13)17-11-10-12-6-4-5-9-14(12)17/h4-6,9,13H,1-3,7-8,10-11H2,(H,16,18)	OSIPNWACISSEHG-UHFFFAOYSA-N	O=C(NC1CCCCC1)N2CCc3ccccc23	BroadT	BRD-K06148713	BRD-K06148713-001-05-3	ChemBridge Corporation	6360162			O=C(NC1CCCCC1)N1CCc2ccccc12	InChI=1S/C15H20N2O/c18-15(16-13-7-2-1-3-8-13)17-11-10-12-6-4-5-9-14(12)17/h4-6,9,13H,1-3,7-8,10-11H2,(H,16,18)	OSIPNWACISSEHG-UHFFFAOYSA-N	244.15756328							120643
AC1OAPBO	LSM-32086	BRD-K54621976	6808217	InChI=1S/C15H13ClN4O3/c1-23-15(22)20-17-9-10-8-11(6-7-14(10)21)18-19-13-5-3-2-4-12(13)16/h2-9,21H,1H3,(H,20,22)	RZNFYNKPFDRLLU-UHFFFAOYSA-N	COC(=O)NN=Cc1cc(ccc1O)N=Nc2ccccc2Cl	BroadT	BRD-K54621976	BRD-K54621976-001-05-2	InterBioScreen Ltd.	STOCK2S-03390			COC(=O)NN=Cc1cc(ccc1O)N=Nc1ccccc1Cl	InChI=1S/C15H13ClN4O3/c1-23-15(22)20-17-9-10-8-11(6-7-14(10)21)18-19-13-5-3-2-4-12(13)16/h2-9,21H,1H3,(H,20,22)	RZNFYNKPFDRLLU-UHFFFAOYSA-N	332.067618026							
SMR000045788	LSM-32087	BRD-K42296822, SID863513	664765	InChI=1S/C23H20ClN5O2/c24-19-6-2-17(3-7-19)15-30-20-8-4-18(5-9-20)22-28-21(14-25)23(31-22)27-10-1-12-29-13-11-26-16-29/h2-9,11,13,16,27H,1,10,12,15H2	YZHDZFLNWPDUAT-UHFFFAOYSA-N	Clc1ccc(COc2ccc(cc2)c3oc(NCCCn4ccnc4)c(n3)C#N)cc1	BroadT	BRD-K42296822	BRD-K42296822-001-05-4	InterBioScreen Ltd.	STOCK4S-78836			Clc1ccc(COc2ccc(cc2)-c2nc(C#N)c(NCCCn3ccnc3)o2)cc1	InChI=1S/C23H20ClN5O2/c24-19-6-2-17(3-7-19)15-30-20-8-4-18(5-9-20)22-28-21(14-25)23(31-22)27-10-1-12-29-13-11-26-16-29/h2-9,11,13,16,27H,1,10,12,15H2	YZHDZFLNWPDUAT-UHFFFAOYSA-N	433.13055264							120645
AP-263/43028055	LSM-32088	BRD-K03141963, SID24787796	1256879	InChI=1S/C13H15BrN2O3S/c1-4-19-13-8-11(5-6-12(13)14)20(17,18)16-10(3)7-9(2)15-16/h5-8H,4H2,1-3H3	BYKJNRBBHJHNTG-UHFFFAOYSA-N	CCOc1cc(ccc1Br)S(=O)(=O)n2nc(C)cc2C	BroadT	BRD-K03141963	BRD-K03141963-001-05-8	ChemBridge Corporation	7975198			CCOc1cc(ccc1Br)S(=O)(=O)n1nc(C)cc1C	InChI=1S/C13H15BrN2O3S/c1-4-19-13-8-11(5-6-12(13)14)20(17,18)16-10(3)7-9(2)15-16/h5-8H,4H2,1-3H3	BYKJNRBBHJHNTG-UHFFFAOYSA-N	357.99867565							120646
SMR000030424	LSM-32089	BRD-A47963183, SID26724582, SID4243604	3238304	InChI=1S/C23H25N5O4S2/c1-14(2)20-22(30)28-21(27-20)17-5-3-4-6-18(17)26-23(28)33-13-19(29)25-12-11-15-7-9-16(10-8-15)34(24,31)32/h3-10,14,20H,11-13H2,1-2H3,(H,25,29)(H2,24,31,32)	WKKLXYJSYPCFFA-UHFFFAOYSA-N	CC(C)C1N=C2N(C1=O)C(=Nc3ccccc23)SCC(=O)NCCc4ccc(cc4)S(=O)(=O)N	BroadT	BRD-A47963183	BRD-A47963183-001-05-9	ChemDiv Inc.	K279-0265			CC(C)C1N=C2N(C1=O)C(SCC(=O)NCCc1ccc(cc1)S(N)(=O)=O)=Nc1ccccc21	InChI=1S/C23H25N5O4S2/c1-14(2)20-22(30)28-21(27-20)17-5-3-4-6-18(17)26-23(28)33-13-19(29)25-12-11-15-7-9-16(10-8-15)34(24,31)32/h3-10,14,20H,11-13H2,1-2H3,(H,25,29)(H2,24,31,32)	WKKLXYJSYPCFFA-UHFFFAOYSA-N	499.13479571							120647
AC1ML5RX	LSM-32090	BRD-A76905089, SID17388145	3189726	InChI=1S/C22H22N2OS/c1-14-8-9-19-18(10-14)11-15(2)22(23-19)26-13-21(25)24-16(3)12-17-6-4-5-7-20(17)24/h4-11,16H,12-13H2,1-3H3	DJDYZPPLJNLDDY-UHFFFAOYSA-N	CC1Cc2ccccc2N1C(=O)CSc3nc4ccc(C)cc4cc3C	BroadT	BRD-A76905089	BRD-A76905089-001-05-9	Asinex Ltd.	ASN 04459031			CC1Cc2ccccc2N1C(=O)CSc1nc2ccc(C)cc2cc1C	InChI=1S/C22H22N2OS/c1-14-8-9-19-18(10-14)11-15(2)22(23-19)26-13-21(25)24-16(3)12-17-6-4-5-7-20(17)24/h4-11,16H,12-13H2,1-3H3	DJDYZPPLJNLDDY-UHFFFAOYSA-N	362.145284034							120648
MLS000585052	LSM-32091	BRD-K31960013, SID17511154	12005445	InChI=1S/C22H15BrN2O4/c1-28-17-12-8-15(9-13-17)22(27)29-25-20(14-6-10-16(23)11-7-14)24-19-5-3-2-4-18(19)21(25)26/h2-13H,1H3	AZIQVQCACXYRFM-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)ON2C(=O)c3ccccc3N=C2c4ccc(Br)cc4	BroadT	BRD-K31960013	BRD-K31960013-001-06-5	ChemDiv Inc.	3401-5511			COc1ccc(cc1)C(=O)On1c(nc2ccccc2c1=O)-c1ccc(Br)cc1	InChI=1S/C22H15BrN2O4/c1-28-17-12-8-15(9-13-17)22(27)29-25-20(14-6-10-16(23)11-7-14)24-19-5-3-2-4-18(19)21(25)26/h2-13H,1H3	AZIQVQCACXYRFM-UHFFFAOYSA-N	450.02151958							120649
10L-581S	LSM-32092	SID17410578, BRD-K55742134	1475518	InChI=1S/C18H15N3S/c1-13-8-10-15(11-9-13)22-18-16(12-19)17(20-21(18)2)14-6-4-3-5-7-14/h3-11H,1-2H3	WHFZLUKOOQAAMC-UHFFFAOYSA-N	Cc1ccc(Sc2c(C#N)c(nn2C)c3ccccc3)cc1	BroadT	BRD-K55742134	BRD-K55742134-001-05-4	Key Organics Ltd.	10L-581S			Cc1ccc(Sc2c(C#N)c(nn2C)-c2ccccc2)cc1	InChI=1S/C18H15N3S/c1-13-8-10-15(11-9-13)22-18-16(12-19)17(20-21(18)2)14-6-4-3-5-7-14/h3-11H,1-2H3	WHFZLUKOOQAAMC-UHFFFAOYSA-N	305.0986682							120650
SMR000013675	LSM-32093	BRD-K27050140, SID26668097, SID846491	648879	InChI=1S/C26H34N4O4/c1-19-18-22(29-34-19)28-23(31)14-15-24(32)30(21-12-6-3-7-13-21)26(16-8-9-17-26)25(33)27-20-10-4-2-5-11-20/h3,6-7,12-13,18,20H,2,4-5,8-11,14-17H2,1H3,(H,27,33)(H,28,29,31)	COXNDRJZODRCCW-UHFFFAOYSA-N	Cc1onc(NC(=O)CCC(=O)N(c2ccccc2)C3(CCCC3)C(=O)NC4CCCCC4)c1	BroadT	BRD-K27050140	BRD-K27050140-001-06-7	Asinex Ltd.	BAS 06264834			Cc1cc(NC(=O)CCC(=O)N(c2ccccc2)C2(CCCC2)C(=O)NC2CCCCC2)no1	InChI=1S/C26H34N4O4/c1-19-18-22(29-34-19)28-23(31)14-15-24(32)30(21-12-6-3-7-13-21)26(16-8-9-17-26)25(33)27-20-10-4-2-5-11-20/h3,6-7,12-13,18,20H,2,4-5,8-11,14-17H2,1H3,(H,27,33)(H,28,29,31)	COXNDRJZODRCCW-UHFFFAOYSA-N	466.258005608							120651
N-(2-Chlorophenyl)-5-(2-pyridinyl)-2-thiophenecarboxamide	LSM-32094	BRD-K92795658, SID26726881	2819705	InChI=1S/C16H11ClN2OS/c17-11-5-1-2-6-12(11)19-16(20)15-9-8-14(21-15)13-7-3-4-10-18-13/h1-10H,(H,19,20)	GIFKUSHSCZVGIO-UHFFFAOYSA-N	Clc1ccccc1NC(=O)c2ccc(s2)c3ccccn3	BroadT	BRD-K92795658	BRD-K92795658-001-05-3	Maybridge	KM 02485			Clc1ccccc1NC(=O)c1ccc(s1)-c1ccccn1	InChI=1S/C16H11ClN2OS/c17-11-5-1-2-6-12(11)19-16(20)15-9-8-14(21-15)13-7-3-4-10-18-13/h1-10H,(H,19,20)	GIFKUSHSCZVGIO-UHFFFAOYSA-N	314.028061392							120652
MLS000080225	LSM-32095	BRD-K69453385, SID50103401, SID857766	659121	InChI=1S/C22H31N5O4S/c1-9-31-15-11-10-13(32(29,30)26-22(5,6)7)12-14(15)19-23-16-17(20(28)24-19)27(8)25-18(16)21(2,3)4/h10-12,26H,9H2,1-8H3,(H,23,24,28)	VMVZVLPMWCBOFI-UHFFFAOYSA-N	CCOc1ccc(cc1c2nc(O)c3c(n2)c(nn3C)C(C)(C)C)S(=O)(=O)NC(C)(C)C	BroadT	BRD-K69453385	BRD-K69453385-001-06-6	InterBioScreen Ltd.	STOCK1S-95949			CCOc1ccc(cc1-c1nc(O)c2n(C)nc(c2n1)C(C)(C)C)S(=O)(=O)NC(C)(C)C	InChI=1S/C22H31N5O4S/c1-9-31-15-11-10-13(32(29,30)26-22(5,6)7)12-14(15)19-23-16-17(20(28)24-19)27(8)25-18(16)21(2,3)4/h10-12,26H,9H2,1-8H3,(H,23,24,28)	VMVZVLPMWCBOFI-UHFFFAOYSA-N	461.209675212							120653
T5824774	LSM-32096	BRD-K73831263, SID22406687	2380880	InChI=1S/C15H12F3N3O3S/c1-24-5-4-21-12-11(13(22)20-14(21)23)8(15(16,17)18)7-9(19-12)10-3-2-6-25-10/h2-3,6-7H,4-5H2,1H3,(H,20,22,23)	WGZJEWUMLXCHFA-UHFFFAOYSA-N	COCCN1C(=O)NC(=O)c2c1nc(cc2C(F)(F)F)c3cccs3	BroadT	BRD-K73831263	BRD-K73831263-001-05-6	Enamine Ltd.	T0513-2873			COCCn1c2nc(cc(c2c(=O)[nH]c1=O)C(F)(F)F)-c1cccs1	InChI=1S/C15H12F3N3O3S/c1-24-5-4-21-12-11(13(22)20-14(21)23)8(15(16,17)18)7-9(19-12)10-3-2-6-25-10/h2-3,6-7H,4-5H2,1H3,(H,20,22,23)	WGZJEWUMLXCHFA-UHFFFAOYSA-N	371.055146564							120654
SMR000047795	LSM-32097	BRD-A07944983, SID865331	666585	InChI=1S/C21H25NO3/c1-4-18(15-8-6-5-7-9-15)21(23)22-11-10-16-12-19(24-2)20(25-3)13-17(16)14-22/h5-9,12-13,18H,4,10-11,14H2,1-3H3	UWOLSHMJMVLTMZ-UHFFFAOYSA-N	CCC(C(=O)N1CCc2cc(OC)c(OC)cc2C1)c3ccccc3	BroadT	BRD-A07944983	BRD-A07944983-001-05-9	InterBioScreen Ltd.	STOCK5S-39770			CCC(C(=O)N1CCc2cc(OC)c(OC)cc2C1)c1ccccc1	InChI=1S/C21H25NO3/c1-4-18(15-8-6-5-7-9-15)21(23)22-11-10-16-12-19(24-2)20(25-3)13-17(16)14-22/h5-9,12-13,18H,4,10-11,14H2,1-3H3	UWOLSHMJMVLTMZ-UHFFFAOYSA-N	339.18344367							120655
SMR000116871	LSM-32098	BRD-K67183010, SID14724906	1435338	InChI=1S/C24H24N4O3S2/c1-4-30-20-9-7-18(8-10-20)25-23-26-19(13-32-23)12-22-27-28-24(31-22)33-14-21(29)17-6-5-15(2)16(3)11-17/h5-11,13H,4,12,14H2,1-3H3,(H,25,26)	FSMLQLODAXCEND-UHFFFAOYSA-N	CCOc1ccc(Nc2nc(Cc3oc(SCC(=O)c4ccc(C)c(C)c4)nn3)cs2)cc1	BroadT	BRD-K67183010	BRD-K67183010-001-06-4	Asinex Ltd.	ASN 04889356			CCOc1ccc(Nc2nc(Cc3nnc(SCC(=O)c4ccc(C)c(C)c4)o3)cs2)cc1	InChI=1S/C24H24N4O3S2/c1-4-30-20-9-7-18(8-10-20)25-23-26-19(13-32-23)12-22-27-28-24(31-22)33-14-21(29)17-6-5-15(2)16(3)11-17/h5-11,13H,4,12,14H2,1-3H3,(H,25,26)	FSMLQLODAXCEND-UHFFFAOYSA-N	480.128982048							120656
2-Benzoxazolamine, 5-methyl-n-(4,5,6-trimethyl-2-pyrimidinyl)-	LSM-32099	BRD-K59046641, SID26662259	788271	InChI=1S/C15H16N4O/c1-8-5-6-13-12(7-8)18-15(20-13)19-14-16-10(3)9(2)11(4)17-14/h5-7H,1-4H3,(H,16,17,18,19)	STPKWNFZSPUDJN-UHFFFAOYSA-N	Cc1ccc2oc(Nc3nc(C)c(C)c(C)n3)nc2c1	BroadT	BRD-K59046641	BRD-K59046641-001-06-0	InterBioScreen Ltd.	STOCK1S-78735			Cc1ccc2oc(Nc3nc(C)c(C)c(C)n3)nc2c1	InChI=1S/C15H16N4O/c1-8-5-6-13-12(7-8)18-15(20-13)19-14-16-10(3)9(2)11(4)17-14/h5-7H,1-4H3,(H,16,17,18,19)	STPKWNFZSPUDJN-UHFFFAOYSA-N	268.132411172							120657
AC1MIVA7	LSM-32100	BRD-K25583354	3127086	InChI=1S/C11H12N4O2/c1-6-3-4-9-8(5-6)14-11(17-9)15-10(12)13-7(2)16/h3-5H,1-2H3,(H3,12,13,14,15,16)	FJXIFRYGOHHBGT-UHFFFAOYSA-N	CC(=O)NC(=N)Nc1oc2ccc(C)cc2n1	BroadT	BRD-K25583354	BRD-K25583354-001-06-0	InterBioScreen Ltd.	STOCK1S-42138			CC(=O)NC(=N)Nc1nc2cc(C)ccc2o1	InChI=1S/C11H12N4O2/c1-6-3-4-9-8(5-6)14-11(17-9)15-10(12)13-7(2)16/h3-5H,1-2H3,(H3,12,13,14,15,16)	FJXIFRYGOHHBGT-UHFFFAOYSA-N	232.096025664							120658
ST50881505	LSM-32101	BRD-K37071891, SID4261591	1246933	InChI=1S/C16H21NO3S/c18-15(14-11-12-3-1-2-4-13(12)21-14)17-7-5-16(6-8-17)19-9-10-20-16/h11H,1-10H2	CPVZOFPNHQPMQJ-UHFFFAOYSA-N	O=C(N1CCC2(CC1)OCCO2)c3cc4CCCCc4s3	BroadT	BRD-K37071891	BRD-K37071891-001-05-4	ChemBridge Corporation	7948071			O=C(N1CCC2(CC1)OCCO2)c1cc2CCCCc2s1	InChI=1S/C16H21NO3S/c18-15(14-11-12-3-1-2-4-13(12)21-14)17-7-5-16(6-8-17)19-9-10-20-16/h11H,1-10H2	CPVZOFPNHQPMQJ-UHFFFAOYSA-N	307.124214232							120659
SMR000012273	LSM-32102	BRD-A02612852, SID853709	656368	InChI=1S/C13H26N6O3/c1-5-7-14-11(20)16-9-10(17-12(21)15-8-6-2)19(4)13(22)18(9)3/h9-10H,5-8H2,1-4H3,(H2,14,16,20)(H2,15,17,21)	BJIJZMUZMSFHAB-UHFFFAOYSA-N	CCCNC(=O)NC1C(NC(=O)NCCC)N(C)C(=O)N1C	BroadT	BRD-A02612852	BRD-A02612852-001-06-3	Asinex Ltd.	BAS 03376571			CCCNC(=O)NC1C(NC(=O)NCCC)N(C)C(=O)N1C	InChI=1S/C13H26N6O3/c1-5-7-14-11(20)16-9-10(17-12(21)15-8-6-2)19(4)13(22)18(9)3/h9-10H,5-8H2,1-4H3,(H2,14,16,20)(H2,15,17,21)	BJIJZMUZMSFHAB-UHFFFAOYSA-N	314.206638752							120660
SMR000042027	LSM-32103	BRD-A56427952, SID860162	661471	InChI=1S/C19H19NO4/c1-23-10-3-6-13(14(9-10)24-2)20-17(21)15-11-4-5-12(16(15)18(20)22)19(11)7-8-19/h3-6,9,11-12,15-16H,7-8H2,1-2H3	ZDTCYZIXGXRFNW-UHFFFAOYSA-N	COc1ccc(N2C(=O)C3C4C=CC(C3C2=O)C45CC5)c(OC)c1	BroadT	BRD-A56427952	BRD-A56427952-001-04-5	InterBioScreen Ltd.	STOCK3S-51542			COc1ccc(N2C(=O)C3C(C4C=CC3C43CC3)C2=O)c(OC)c1	InChI=1S/C19H19NO4/c1-23-10-3-6-13(14(9-10)24-2)20-17(21)15-11-4-5-12(16(15)18(20)22)19(11)7-8-19/h3-6,9,11-12,15-16H,7-8H2,1-2H3	ZDTCYZIXGXRFNW-UHFFFAOYSA-N	325.131408098							120661
3-(1H-Benzimidazol-2-yl)-n-(pyridin-3-ylmethyl)aniline	LSM-32104	BRD-K06220918, SID17506145	1951761	InChI=1S/C19H16N4/c1-2-9-18-17(8-1)22-19(23-18)15-6-3-7-16(11-15)21-13-14-5-4-10-20-12-14/h1-12,21H,13H2,(H,22,23)	BVBAHXUGPUGMKJ-UHFFFAOYSA-N	C(Nc1cccc(c1)c2nc3ccccc3[nH]2)c4cccnc4	BroadT	BRD-K06220918	BRD-K06220918-001-05-3	InterBioScreen Ltd.	STOCK5S-51037			C(Nc1cccc(c1)-c1nc2ccccc2[nH]1)c1cccnc1	InChI=1S/C19H16N4/c1-2-9-18-17(8-1)22-19(23-18)15-6-3-7-16(11-15)21-13-14-5-4-10-20-12-14/h1-12,21H,13H2,(H,22,23)	BVBAHXUGPUGMKJ-UHFFFAOYSA-N	300.137496552							120662
SMR000026557	LSM-32105	BRD-K07230804, SID4248176	3242287	InChI=1S/C17H18N2O6/c1-2-25-17(24)18-7-5-11(6-8-18)19-14(20)12-4-3-10(16(22)23)9-13(12)15(19)21/h3-4,9,11H,2,5-8H2,1H3,(H,22,23)	NMUCBRLMURKMQH-UHFFFAOYSA-N	CCOC(=O)N1CCC(CC1)N2C(=O)c3ccc(cc3C2=O)C(=O)O	BroadT	BRD-K07230804	BRD-K07230804-001-06-6	ChemDiv Inc.	C429-0060			CCOC(=O)N1CCC(CC1)N1C(=O)c2ccc(cc2C1=O)C(O)=O	InChI=1S/C17H18N2O6/c1-2-25-17(24)18-7-5-11(6-8-18)19-14(20)12-4-3-10(16(22)23)9-13(12)15(19)21/h3-4,9,11H,2,5-8H2,1H3,(H,22,23)	NMUCBRLMURKMQH-UHFFFAOYSA-N	346.116486316							120663
ST50447895	LSM-32106	BRD-K87990170, SID24792084	855037	InChI=1S/C15H17NOS/c1-11-5-6-13(10-12(11)2)16-8-7-14(17)15-4-3-9-18-15/h3-6,9-10,16H,7-8H2,1-2H3	IPSGMVQTYVHYFL-UHFFFAOYSA-N	Cc1ccc(NCCC(=O)c2cccs2)cc1C	BroadT	BRD-K87990170	BRD-K87990170-001-06-4	ChemBridge Corporation	5924400			Cc1ccc(NCCC(=O)c2cccs2)cc1C	InChI=1S/C15H17NOS/c1-11-5-6-13(10-12(11)2)16-8-7-14(17)15-4-3-9-18-15/h3-6,9-10,16H,7-8H2,1-2H3	IPSGMVQTYVHYFL-UHFFFAOYSA-N	259.103084864							120664
AC1MKGNP	LSM-32107	BRD-K82521339, SID17507270	3203950	InChI=1S/C22H26N4O2S/c1-2-28-14-8-13-23-22(29)26(15-17-9-4-3-5-10-17)16-20-24-19-12-7-6-11-18(19)21(27)25-20/h3-7,9-12H,2,8,13-16H2,1H3,(H,23,29)(H,24,25,27)	RCUFQEKOSIVSRM-UHFFFAOYSA-N	CCOCCCN=C(S)N(Cc1ccccc1)Cc2nc(O)c3ccccc3n2	BroadT	BRD-K82521339	BRD-K82521339-001-05-2	Asinex Ltd.	ASN 05384583			CCOCCCN=C(S)N(Cc1ccccc1)Cc1nc(O)c2ccccc2n1	InChI=1S/C22H26N4O2S/c1-2-28-14-8-13-23-22(29)26(15-17-9-4-3-5-10-17)16-20-24-19-12-7-6-11-18(19)21(27)25-20/h3-7,9-12H,2,8,13-16H2,1H3,(H,23,29)(H,24,25,27)	RCUFQEKOSIVSRM-UHFFFAOYSA-N	410.177646802							120665
SMR000043826	LSM-32108	BRD-A95239561, SID861979	663199	InChI=1S/C16H18Br2N2O4/c17-10-8-11-12(13(18)14(10)21)9-2-1-3-19-15(22)16(9,24-11)20-4-6-23-7-5-20/h8-9,21H,1-7H2,(H,19,22)	BGQRLZNCFLCUPZ-UHFFFAOYSA-N	Oc1c(Br)cc2OC3(C(CCCNC3=O)c2c1Br)N4CCOCC4	BroadT	BRD-A95239561	BRD-A95239561-001-05-7	InterBioScreen Ltd.	STOCK4S-23402			Oc1c(Br)cc2OC3(C(CCCNC3=O)c2c1Br)N1CCOCC1	InChI=1S/C16H18Br2N2O4/c17-10-8-11-12(13(18)14(10)21)9-2-1-3-19-15(22)16(9,24-11)20-4-6-23-7-5-20/h8-9,21H,1-7H2,(H,19,22)	BGQRLZNCFLCUPZ-UHFFFAOYSA-N	459.963332276							120666
AC1LGSHD	LSM-32109	BRD-K40018788	876094	InChI=1S/C16H15FN6O2/c1-24-15-8-12(9-19-23-16(18)20-21-22-23)4-7-14(15)25-10-11-2-5-13(17)6-3-11/h2-9H,10H2,1H3,(H2,18,20,22)	JFNFFOKQIVNSSR-UHFFFAOYSA-N	COc1cc(C=Nn2nnnc2N)ccc1OCc3ccc(F)cc3	BroadT	BRD-K40018788	BRD-K40018788-001-05-6	ChemBridge Corporation	5843557			COc1cc(C=Nn2nnnc2N)ccc1OCc1ccc(F)cc1	InChI=1S/C16H15FN6O2/c1-24-15-8-12(9-19-23-16(18)20-21-22-23)4-7-14(15)25-10-11-2-5-13(17)6-3-11/h2-9H,10H2,1H3,(H2,18,20,22)	JFNFFOKQIVNSSR-UHFFFAOYSA-N	342.12405198							120667
Ethyl 6-amino-5-cyano-2-phenyl-4-(pyridin-4-yl)-4H-pyran-3-carboxylate	LSM-32110	BRD-A76076412, SID24790573	3122238	InChI=1S/C20H17N3O3/c1-2-25-20(24)17-16(13-8-10-23-11-9-13)15(12-21)19(22)26-18(17)14-6-4-3-5-7-14/h3-11,16H,2,22H2,1H3	IDQNMTXQXYTHTB-UHFFFAOYSA-N	CCOC(=O)C1=C(OC(=C(C#N)C1c2ccncc2)N)c3ccccc3	BroadT	BRD-A76076412	BRD-A76076412-001-05-7	Asinex Ltd.	BAS 00899118			CCOC(=O)C1=C(OC(N)=C(C#N)C1c1ccncc1)c1ccccc1	InChI=1S/C20H17N3O3/c1-2-25-20(24)17-16(13-8-10-23-11-9-13)15(12-21)19(22)26-18(17)14-6-4-3-5-7-14/h3-11,16H,2,22H2,1H3	IDQNMTXQXYTHTB-UHFFFAOYSA-N	347.126991434							120668
40016-32-8	LSM-32111	BRD-K50045638, SID14737730	5076486	InChI=1S/C12H16N2O/c1-10-3-5-11(6-4-10)9-14-8-2-7-13-12(14)15/h3-6H,2,7-9H2,1H3,(H,13,15)	XAKRTOIHMJCULO-UHFFFAOYSA-N	Cc1ccc(CN2CCCNC2=O)cc1	BroadT	BRD-K50045638	BRD-K50045638-001-06-6	ChemDiv Inc.	K780-0384			Cc1ccc(CN2CCCNC2=O)cc1	InChI=1S/C12H16N2O/c1-10-3-5-11(6-4-10)9-14-8-2-7-13-12(14)15/h3-6H,2,7-9H2,1H3,(H,13,15)	XAKRTOIHMJCULO-UHFFFAOYSA-N	204.126263152							120669
AC1LFWOL	LSM-32112	BRD-K41878930	761323	InChI=1S/C15H17N3O/c1-12-5-7-13(8-6-12)11-16-17-15(19)10-14-4-3-9-18(14)2/h3-9,11H,10H2,1-2H3,(H,17,19)	GWWOPOHCBNIIAG-UHFFFAOYSA-N	Cc1ccc(C=NNC(=O)Cc2cccn2C)cc1	BroadT	BRD-K41878930	BRD-K41878930-001-05-9	InterBioScreen Ltd.	STOCK2S-86649			Cc1ccc(C=NNC(=O)Cc2cccn2C)cc1	InChI=1S/C15H17N3O/c1-12-5-7-13(8-6-12)11-16-17-15(19)10-14-4-3-9-18(14)2/h3-9,11H,10H2,1-2H3,(H,17,19)	GWWOPOHCBNIIAG-UHFFFAOYSA-N	255.137162194							120670
ZINC00626123	LSM-32113	BRD-K73319967, SID26659563	980996	InChI=1S/C16H15ClN4O4/c1-19-13-12(14(23)20(2)16(19)24)21(15(17)18-13)8-11(22)9-4-6-10(25-3)7-5-9/h4-7H,8H2,1-3H3	KSOGSVFKYBCNOA-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)Cn2c(Cl)nc3N(C)C(=O)N(C)C(=O)c23	BroadT	BRD-K73319967	BRD-K73319967-001-05-1	InterBioScreen Ltd.	STOCK1S-56061			COc1ccc(cc1)C(=O)Cn1c(Cl)nc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C16H15ClN4O4/c1-19-13-12(14(23)20(2)16(19)24)21(15(17)18-13)8-11(22)9-4-6-10(25-3)7-5-9/h4-7H,8H2,1-3H3	KSOGSVFKYBCNOA-UHFFFAOYSA-N	362.07818271							120671
SMR000027762	LSM-32114	BRD-A08363225	3243730	InChI=1S/C24H37N3O3S/c1-17(2)13-27(14-18(3)4)12-11-25-23(28)16-31(29)15-22-20(6)30-24(26-22)21-9-7-19(5)8-10-21/h7-10,17-18H,11-16H2,1-6H3,(H,25,28)	YAQVZKXUXBRCQA-UHFFFAOYSA-N	CC(C)CN(CCNC(=O)CS(=O)Cc1nc(oc1C)c2ccc(C)cc2)CC(C)C	BroadT	BRD-A08363225	BRD-A08363225-001-05-9	ChemDiv Inc.	C527-0781			CC(C)CN(CCNC(=O)CS(=O)Cc1nc(oc1C)-c1ccc(C)cc1)CC(C)C	InChI=1S/C24H37N3O3S/c1-17(2)13-27(14-18(3)4)12-11-25-23(28)16-31(29)15-22-20(6)30-24(26-22)21-9-7-19(5)8-10-21/h7-10,17-18H,11-16H2,1-6H3,(H,25,28)	YAQVZKXUXBRCQA-UHFFFAOYSA-N	447.255562764							120672
AC1MMWQJ	LSM-32115	BRD-K16062794	3245623	InChI=1S/C16H17N3O4/c1-22-8-4-7-17-14(20)10-19-15-11-5-2-3-6-13(11)23-16(21)12(15)9-18-19/h2-3,5-6,9H,4,7-8,10H2,1H3,(H,17,20)	MSMKEGTZPLDCOY-UHFFFAOYSA-N	COCCCNC(=O)Cn1ncc2C(=O)Oc3ccccc3c12	BroadT	BRD-K16062794	BRD-K16062794-001-05-6	ChemDiv Inc.	C434-0061			COCCCNC(=O)Cn1ncc2c1c1ccccc1oc2=O	InChI=1S/C16H17N3O4/c1-22-8-4-7-17-14(20)10-19-15-11-5-2-3-6-13(11)23-16(21)12(15)9-18-19/h2-3,5-6,9H,4,7-8,10H2,1H3,(H,17,20)	MSMKEGTZPLDCOY-UHFFFAOYSA-N	315.121906054							120673
AC1MMOFX	LSM-32116	BRD-A85028244	3264211	InChI=1S/C26H26N2O6S/c1-14-22(15(2)29)23(17-9-7-8-10-18(17)31-3)28-25(30)21(35-26(28)27-14)13-16-11-19(32-4)24(34-6)20(12-16)33-5/h7-13,23H,1-6H3	ZBJSDSFOFZMHBX-UHFFFAOYSA-N	COc1ccccc1C2N3C(=NC(=C2C(=O)C)C)SC(=Cc4cc(OC)c(OC)c(OC)c4)C3=O	BroadT	BRD-A85028244	BRD-A85028244-001-06-9	Specs	AG-205/12549048			COc1ccccc1C1C(C(C)=O)=C(C)N=c2sc(=Cc3cc(OC)c(OC)c(OC)c3)c(=O)n12	InChI=1S/C26H26N2O6S/c1-14-22(15(2)29)23(17-9-7-8-10-18(17)31-3)28-25(30)21(35-26(28)27-14)13-16-11-19(32-4)24(34-6)20(12-16)33-5/h7-13,23H,1-6H3	ZBJSDSFOFZMHBX-UHFFFAOYSA-N	494.151157262							120674
STK083978	LSM-44384	SID22404384, BRD-K20016759	6156578	InChI=1S/C21H18N4O2/c1-14-11-16(15(2)24(14)18-9-6-10-22-13-18)12-19-20(26)25(21(27)23-19)17-7-4-3-5-8-17/h3-13H,1-2H3,(H,23,27)/b19-12+	VZMIMONWQGIZIP-XDHOZWIPSA-N	Cc1cc(\C=C/2\NC(=O)N(C2=O)c3ccccc3)c(C)n1c4cccnc4	BroadT	BRD-K20016759	BRD-K20016759-001-05-9	Specs	AH-487/41138390			Cc1cc(\C=C2\NC(=O)N(C2=O)c2ccccc2)c(C)n1-c1cccnc1	InChI=1S/C21H18N4O2/c1-14-11-16(15(2)24(14)18-9-6-10-22-13-18)12-19-20(26)25(21(27)23-19)17-7-4-3-5-8-17/h3-13H,1-2H3,(H,23,27)/b19-12+	VZMIMONWQGIZIP-XDHOZWIPSA-N	358.142975856							
MLS000042141	LSM-32118	BRD-A64091909, SID863083	664321	InChI=1S/C18H26N2O3/c1-12(2)11-16(17(21)23-3)20-18(22)19-15-10-6-8-13-7-4-5-9-14(13)15/h4-5,7,9,12,15-16H,6,8,10-11H2,1-3H3,(H2,19,20,22)/t15?,16-/m0/s1	UWYYJGGQSCUZOH-LYKKTTPLSA-N	COC(=O)[C@H](CC(C)C)NC(=O)NC1CCCc2ccccc12	BroadT	BRD-A64091909	BRD-A64091909-001-05-0	InterBioScreen Ltd.	STOCK4S-65725			COC(=O)[C@H](CC(C)C)NC(=O)NC1CCCc2ccccc12	InChI=1S/C18H26N2O3/c1-12(2)11-16(17(21)23-3)20-18(22)19-15-10-6-8-13-7-4-5-9-14(13)15/h4-5,7,9,12,15-16H,6,8,10-11H2,1-3H3,(H2,19,20,22)/t15?,16-/m0/s1	UWYYJGGQSCUZOH-LYKKTTPLSA-N	318.194342712							120676
AC1LZBEW	LSM-32119	BRD-K53725468	1918116	InChI=1S/C22H25N3O3/c1-3-27-22(26)24-23-15-18-16-25(21-8-5-4-7-20(18)21)13-6-14-28-19-11-9-17(2)10-12-19/h4-5,7-12,15-16H,3,6,13-14H2,1-2H3,(H,24,26)	AYSNRNQSZBVSDS-UHFFFAOYSA-N	CCOC(=O)NN=Cc1cn(CCCOc2ccc(C)cc2)c3ccccc13	BroadT	BRD-K53725468	BRD-K53725468-001-05-7	InterBioScreen Ltd.	STOCK2S-42558			CCOC(=O)NN=Cc1cn(CCCOc2ccc(C)cc2)c2ccccc12	InChI=1S/C22H25N3O3/c1-3-27-22(26)24-23-15-18-16-25(21-8-5-4-7-20(18)21)13-6-14-28-19-11-9-17(2)10-12-19/h4-5,7-12,15-16H,3,6,13-14H2,1-2H3,(H,24,26)	AYSNRNQSZBVSDS-UHFFFAOYSA-N	379.18959169							120677
STK563050	LSM-32120	BRD-K33420995, SID861786	663013	InChI=1S/C22H30N6O2/c1-3-4-5-9-12-28-18-19(25(2)22(30)24-20(18)29)23-21(28)27-15-13-26(14-16-27)17-10-7-6-8-11-17/h6-8,10-11H,3-5,9,12-16H2,1-2H3,(H,24,29,30)	JXYZGKDPFLRYBL-UHFFFAOYSA-N	CCCCCCn1c(nc2N(C)C(=O)NC(=O)c12)N3CCN(CC3)c4ccccc4	BroadT	BRD-K33420995	BRD-K33420995-001-05-2	InterBioScreen Ltd.	STOCK4S-18954			CCCCCCn1c(nc2n(C)c(=O)[nH]c(=O)c12)N1CCN(CC1)c1ccccc1	InChI=1S/C22H30N6O2/c1-3-4-5-9-12-28-18-19(25(2)22(30)24-20(18)29)23-21(28)27-15-13-26(14-16-27)17-10-7-6-8-11-17/h6-8,10-11H,3-5,9,12-16H2,1-2H3,(H,24,29,30)	JXYZGKDPFLRYBL-UHFFFAOYSA-N	410.24302426							120678
AC1OBE64	LSM-32121	BRD-K26214026	6845547	InChI=1S/C20H16ClN3OS/c1-2-12-7-8-15-17(9-12)26-19(18(15)21)20(25)24-23-11-13-10-22-16-6-4-3-5-14(13)16/h3-11,22H,2H2,1H3,(H,24,25)	ZFKLCCYTODIPAF-UHFFFAOYSA-N	CCc1ccc2c(Cl)c(sc2c1)C(=O)NN=Cc3c[nH]c4ccccc34	BroadT	BRD-K26214026	BRD-K26214026-001-05-1	Specs	AK-968/15603453			CCc1ccc2c(Cl)c(sc2c1)C(=O)NN=Cc1c[nH]c2ccccc12	InChI=1S/C20H16ClN3OS/c1-2-12-7-8-15-17(9-12)26-19(18(15)21)20(25)24-23-11-13-10-22-16-6-4-3-5-14(13)16/h3-11,22H,2H2,1H3,(H,24,25)	ZFKLCCYTODIPAF-UHFFFAOYSA-N	381.070260562							
AC1MGUUZ	LSM-32122	BRD-K63119190, SID24802543	2941858	InChI=1S/C15H11N3O6/c16-14(9-2-1-3-11(6-9)18(20)21)17-24-15(19)10-4-5-12-13(7-10)23-8-22-12/h1-7H,8H2,(H2,16,17)	BEOZHZRIKWOEMV-UHFFFAOYSA-N	NC(=NOC(=O)c1ccc2OCOc2c1)c3cccc(c3)[N+](=O)[O-]	BroadT	BRD-K63119190	BRD-K63119190-001-05-6	ChemBridge Corporation	7534500			NC(=NOC(=O)c1ccc2OCOc2c1)c1cccc(c1)[N+]([O-])=O	InChI=1S/C15H11N3O6/c16-14(9-2-1-3-11(6-9)18(20)21)17-24-15(19)10-4-5-12-13(7-10)23-8-22-12/h1-7H,8H2,(H2,16,17)	BEOZHZRIKWOEMV-UHFFFAOYSA-N	329.064785102							120680
IFLAB1_002927	LSM-32123	SID24816807, BRD-K95788660	4419780	InChI=1S/C15H18N2O3/c1-10-7-12-8-11(3-4-13(12)17(10)2)9-16-14(18)5-6-15(19)20/h3-4,7-8H,5-6,9H2,1-2H3,(H,16,18)(H,19,20)	WTNNBQZMKLUJTA-UHFFFAOYSA-N	Cc1cc2cc(CNC(=O)CCC(=O)O)ccc2n1C	BroadT	BRD-K95788660	BRD-K95788660-001-05-1	Life Chemicals Inc.	F0651-0245			Cc1cc2cc(CNC(=O)CCC(O)=O)ccc2n1C	InChI=1S/C15H18N2O3/c1-10-7-12-8-11(3-4-13(12)17(10)2)9-16-14(18)5-6-15(19)20/h3-4,7-8H,5-6,9H2,1-2H3,(H,16,18)(H,19,20)	WTNNBQZMKLUJTA-UHFFFAOYSA-N	274.131742456							120681
AC1LIX6Q	LSM-32124	BRD-K11730256	939906	InChI=1S/C12H12ClN3O3/c1-3-19-12(17)10(7-14)16-15-9-6-8(13)4-5-11(9)18-2/h4-6,15H,3H2,1-2H3	QNICQODAGRJJEL-UHFFFAOYSA-N	CCOC(=O)C(=NNc1cc(Cl)ccc1OC)C#N	BroadT	BRD-K11730256	BRD-K11730256-001-05-4	InterBioScreen Ltd.	STOCK2S-95132			CCOC(=O)C(=NNc1cc(Cl)ccc1OC)C#N	InChI=1S/C12H12ClN3O3/c1-3-19-12(17)10(7-14)16-15-9-6-8(13)4-5-11(9)18-2/h4-6,15H,3H2,1-2H3	QNICQODAGRJJEL-UHFFFAOYSA-N	281.056718984							120682
AC1MXQ6R	LSM-32125	SID24824274, BRD-A03182941	3769650	InChI=1S/C20H26O5/c1-12(21)24-15-7-6-13(10-16(15)23-5)18(22)25-17-11-14-8-9-20(17,4)19(14,2)3/h6-7,10,14,17H,8-9,11H2,1-5H3	KUGMSYFFXZDRGR-UHFFFAOYSA-N	COc1cc(ccc1OC(=O)C)C(=O)OC2CC3CCC2(C)C3(C)C	BroadT	BRD-A03182941	BRD-A03182941-001-05-1	InterBioScreen Ltd.	STOCK1N-05757			COc1cc(ccc1OC(C)=O)C(=O)OC1CC2CCC1(C)C2(C)C	InChI=1S/C20H26O5/c1-12(21)24-15-7-6-13(10-16(15)23-5)18(22)25-17-11-14-8-9-20(17,4)19(14,2)3/h6-7,10,14,17H,8-9,11H2,1-5H3	KUGMSYFFXZDRGR-UHFFFAOYSA-N	346.178023932							120683
CID 6751527	LSM-32126	BRD-K13798725	6751527	InChI=1S/C25H18N4O3/c1-14-20(25(32)28(27-14)17-5-3-2-4-6-17)13-26-29-23(30)18-11-9-15-7-8-16-10-12-19(24(29)31)22(18)21(15)16/h2-6,9-13,32H,7-8H2,1H3	WSGKMUULFPGWHV-UHFFFAOYSA-N	Cc1nn(c(O)c1C=NN2C(=O)c3ccc4CCc5ccc(C2=O)c3c45)c6ccccc6	BroadT	BRD-K13798725	BRD-K13798725-001-05-2	Asinex Ltd.	BAS 00430379			Cc1nn(c(O)c1C=NN1C(=O)c2ccc3CCc4ccc(C1=O)c2c34)-c1ccccc1	InChI=1S/C25H18N4O3/c1-14-20(25(32)28(27-14)17-5-3-2-4-6-17)13-26-29-23(30)18-11-9-15-7-8-16-10-12-19(24(29)31)22(18)21(15)16/h2-6,9-13,32H,7-8H2,1H3	WSGKMUULFPGWHV-UHFFFAOYSA-N	422.137890476							
SMR000004429	LSM-32127	SID853626, BRD-K81522184	656284	InChI=1S/C19H23N3O4S/c1-26-17-7-9-18(10-8-17)27(24,25)22-13-11-21(12-14-22)19(23)20-15-16-5-3-2-4-6-16/h2-10H,11-15H2,1H3,(H,20,23)	JMOSWCSUAXXELA-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(=O)NCc3ccccc3	BroadT	BRD-K81522184	BRD-K81522184-001-05-7	Asinex Ltd.	ASN 05338618			COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)NCc1ccccc1	InChI=1S/C19H23N3O4S/c1-26-17-7-9-18(10-8-17)27(24,25)22-13-11-21(12-14-22)19(23)20-15-16-5-3-2-4-6-16/h2-10H,11-15H2,1H3,(H,20,23)	JMOSWCSUAXXELA-UHFFFAOYSA-N	389.140926936							120685
SMR000175045	LSM-44385	SID17408094, BRD-K55286508	5340576	InChI=1S/C24H24N6O4/c25-16-18(24-26-19-3-1-2-4-20(19)27-24)13-17-14-23(30(31)32)22(29-7-11-34-12-8-29)15-21(17)28-5-9-33-10-6-28/h1-4,13-15H,5-12H2,(H,26,27)/b18-13+	FENLBYHKIDETIU-QGOAFFKASA-N	[O-][N+](=O)c1cc(\C=C(/C#N)\c2nc3ccccc3[nH]2)c(cc1N4CCOCC4)N5CCOCC5	BroadT	BRD-K55286508	BRD-K55286508-001-06-8	Asinex Ltd.	BAS 00442636			[O-][N+](=O)c1cc(\C=C(/C#N)c2nc3ccccc3[nH]2)c(cc1N1CCOCC1)N1CCOCC1	InChI=1S/C24H24N6O4/c25-16-18(24-26-19-3-1-2-4-20(19)27-24)13-17-14-23(30(31)32)22(29-7-11-34-12-8-29)15-21(17)28-5-9-33-10-6-28/h1-4,13-15H,5-12H2,(H,26,27)/b18-13+	FENLBYHKIDETIU-QGOAFFKASA-N	460.185903308							
GNF-PF-2554	LSM-43624	BRD-K01667746, GNF-PF-2554	827130	InChI=1S/C14H13BrN/c1-16-10-8-13(9-11-16)3-2-12-4-6-14(15)7-5-12/h2-11H,1H3/q+1/b3-2+	BKPYYYGUAPETPF-NSCUHMNNSA-N	C[n+]1ccc(\C=C\c2ccc(Br)cc2)cc1	BroadT	BRD-K01667746	BRD-K01667746-005-05-9	Asinex Ltd.	BAS 00315008		I	C[n+]1ccc(cc1)\C=C\c1ccc(Br)cc1.I	InChI=1S/C14H13BrN.HI/c1-16-10-8-13(9-11-16)3-2-12-4-6-14(15)7-5-12;/h2-11H,1H3;1H/q+1;/b3-2+;	UFYIXCJJBBKNTM-SQQVDAMQSA-N	274.023137026							, 
AA-768/32303032	LSM-32129	SID22412283, BRD-K20624967	727045	InChI=1S/C12H17N3OS2/c16-11(10-7-4-8-18-10)14-15-12(17)13-9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,14,16)(H2,13,15,17)	UGMCLDASMRDHHT-UHFFFAOYSA-N	O=C(NNC(=S)NC1CCCCC1)c2cccs2	BroadT	BRD-K20624967	BRD-K20624967-001-05-8	Specs	AA-768/32303032			O=C(NNC(=S)NC1CCCCC1)c1cccs1	InChI=1S/C12H17N3OS2/c16-11(10-7-4-8-18-10)14-15-12(17)13-9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,14,16)(H2,13,15,17)	UGMCLDASMRDHHT-UHFFFAOYSA-N	283.081303574							120687
AC1OAOL1	LSM-32130	BRD-K64559139	6832943	InChI=1S/C15H11Br2NO3/c16-10-5-9(15(19)12(17)6-10)8-18-11-1-2-13-14(7-11)21-4-3-20-13/h1-2,5-8,19H,3-4H2	FDHJGVYETSGIRG-UHFFFAOYSA-N	Oc1c(Br)cc(Br)cc1C=Nc2ccc3OCCOc3c2	BroadT	BRD-K64559139	BRD-K64559139-001-05-6	ChemDiv Inc.	K048-0082			Oc1c(Br)cc(Br)cc1C=Nc1ccc2OCCOc2c1	InChI=1S/C15H11Br2NO3/c16-10-5-9(15(19)12(17)6-10)8-18-11-1-2-13-14(7-11)21-4-3-20-13/h1-2,5-8,19H,3-4H2	FDHJGVYETSGIRG-UHFFFAOYSA-N	410.910568422							
F0020-0177	LSM-32131	BRD-K20278539, SID4247563	701085	InChI=1S/C12H11N3OS/c16-12(10-4-2-1-3-5-10)15-9-17-11-6-7-13-8-14-11/h1-8H,9H2,(H,15,16)	LJYVVKASBVLJRS-UHFFFAOYSA-N	O=C(NCSc1ccncn1)c2ccccc2	BroadT	BRD-K20278539	BRD-K20278539-001-06-0	ChemDiv Inc.	2280-4033			O=C(NCSc1ccncn1)c1ccccc1	InChI=1S/C12H11N3OS/c16-12(10-4-2-1-3-5-10)15-9-17-11-6-7-13-8-14-11/h1-8H,9H2,(H,15,16)	LJYVVKASBVLJRS-UHFFFAOYSA-N	245.062282692							120689
SMR000047416	LSM-32132	BRD-K01182779, SID864816	666064	InChI=1S/C15H20N6O2/c1-10-7-11(2)19-15(18-10)21(9-16)8-13(22)20-5-3-12(4-6-20)14(17)23/h7,12H,3-6,8H2,1-2H3,(H2,17,23)	PWYSHXWZNMUGTR-UHFFFAOYSA-N	Cc1cc(C)nc(n1)N(CC(=O)N2CCC(CC2)C(=O)N)C#N	BroadT	BRD-K01182779	BRD-K01182779-001-05-8	InterBioScreen Ltd.	STOCK5S-32094			Cc1cc(C)nc(n1)N(CC(=O)N1CCC(CC1)C(N)=O)C#N	InChI=1S/C15H20N6O2/c1-10-7-11(2)19-15(18-10)21(9-16)8-13(22)20-5-3-12(4-6-20)14(17)23/h7,12H,3-6,8H2,1-2H3,(H2,17,23)	PWYSHXWZNMUGTR-UHFFFAOYSA-N	316.16477394							120690
BRD-A01403444	LSM-32133	BRD-A01403444		InChI=1S/C24H26N2O6/c1-25(2)9-10-26-21(15-5-4-6-17(13-15)30-3)20(23(28)24(26)29)22(27)16-7-8-18-19(14-16)32-12-11-31-18/h4-8,13-14,20-21H,9-12H2,1-3H3	XCGKOMSXPSDERT-UHFFFAOYSA-N	COc1cccc(c1)C2C(C(=O)c3ccc4OCCOc4c3)C(=O)C(=O)N2CCN(C)C	BroadT	BRD-A01403444	BRD-A01403444-001-04-8	InterBioScreen Ltd.	STOCK3S-80104			COc1cccc(c1)C1C(C(=O)c2ccc3OCCOc3c2)C(=O)C(=O)N1CCN(C)C	InChI=1S/C24H26N2O6/c1-25(2)9-10-26-21(15-5-4-6-17(13-15)30-3)20(23(28)24(26)29)22(27)16-7-8-18-19(14-16)32-12-11-31-18/h4-8,13-14,20-21H,9-12H2,1-3H3	XCGKOMSXPSDERT-UHFFFAOYSA-N	438.179086572							120691
AC1OAY52	LSM-32134	BRD-A80010944	6837165	InChI=1S/C14H14N4O5S/c19-9-4-2-1-3-8(9)6-16-18-14-17-13(23)10(24-14)5-11(20)15-7-12(21)22/h1-4,6,10,19H,5,7H2,(H,15,20)(H,21,22)(H,17,18,23)	JQKRJUVXPNRGMB-UHFFFAOYSA-N	OC(=O)CNC(=O)CC1SC(=NC1=O)NN=Cc2ccccc2O	BroadT	BRD-A80010944	BRD-A80010944-001-05-7	Life Chemicals Inc.	F1726-0148			OC(=O)CNC(=O)CC1SC(NN=Cc2ccccc2O)=NC1=O	InChI=1S/C14H14N4O5S/c19-9-4-2-1-3-8(9)6-16-18-14-17-13(23)10(24-14)5-11(20)15-7-12(21)22/h1-4,6,10,19H,5,7H2,(H,15,20)(H,21,22)(H,17,18,23)	JQKRJUVXPNRGMB-UHFFFAOYSA-N	350.068490278							
AC1MEWAB	LSM-32135	BRD-A14484404	2910039	InChI=1S/C16H11ClN4O6S/c17-10-3-1-8(5-11(10)21(25)26)12-4-2-9(27-12)7-18-20-16-19-15(24)13(28-16)6-14(22)23/h1-5,7,13H,6H2,(H,22,23)(H,19,20,24)	FMMVOQOHIRLJRS-UHFFFAOYSA-N	OC(=O)CC1SC(=NC1=O)NN=Cc2oc(cc2)c3ccc(Cl)c(c3)[N+](=O)[O-]	BroadT	BRD-A14484404	BRD-A14484404-001-06-6	ChemBridge Corporation	6681744			OC(=O)CC1SC(NN=Cc2ccc(o2)-c2ccc(Cl)c(c2)[N+]([O-])=O)=NC1=O	InChI=1S/C16H11ClN4O6S/c17-10-3-1-8(5-11(10)21(25)26)12-4-2-9(27-12)7-18-20-16-19-15(24)13(28-16)6-14(22)23/h1-5,7,13H,6H2,(H,22,23)(H,19,20,24)	FMMVOQOHIRLJRS-UHFFFAOYSA-N	422.008782512							120693
T5332634	LSM-32136	BRD-K92524632, SID17516896	2604351	InChI=1S/C24H28N2O3/c1-24(2,3)26(16-18-9-5-4-6-10-18)22(27)17-29-23(28)14-13-19-15-25-21-12-8-7-11-20(19)21/h4-12,15,25H,13-14,16-17H2,1-3H3	HZXOWBLBPRWBTK-UHFFFAOYSA-N	CC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)CCc2c[nH]c3ccccc23	BroadT	BRD-K92524632	BRD-K92524632-001-05-8	Enamine Ltd.	T5332634			CC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)CCc1c[nH]c2ccccc12	InChI=1S/C24H28N2O3/c1-24(2,3)26(16-18-9-5-4-6-10-18)22(27)17-29-23(28)14-13-19-15-25-21-12-8-7-11-20(19)21/h4-12,15,25H,13-14,16-17H2,1-3H3	HZXOWBLBPRWBTK-UHFFFAOYSA-N	392.209992776							120694
SMR000026808	LSM-32137	BRD-A22773530, SID4245749	3240186	InChI=1S/C21H22N4O3S2/c1-14-12-15-6-2-3-9-18(15)25(14)21(26)16-7-5-11-24(13-16)30(27,28)19-10-4-8-17-20(19)23-29-22-17/h2-4,6,8-10,14,16H,5,7,11-13H2,1H3	HPODVUDKRMAOMR-UHFFFAOYSA-N	CC1Cc2ccccc2N1C(=O)C3CCCN(C3)S(=O)(=O)c4cccc5nsnc45	BroadT	BRD-A22773530	BRD-A22773530-001-05-1	ChemDiv Inc.	C444-0188			CC1Cc2ccccc2N1C(=O)C1CCCN(C1)S(=O)(=O)c1cccc2nsnc12	InChI=1S/C21H22N4O3S2/c1-14-12-15-6-2-3-9-18(15)25(14)21(26)16-7-5-11-24(13-16)30(27,28)19-10-4-8-17-20(19)23-29-22-17/h2-4,6,8-10,14,16H,5,7,11-13H2,1H3	HPODVUDKRMAOMR-UHFFFAOYSA-N	442.113331984							120695
MLS000040440	LSM-15583	BRD-A99750020	664717	InChI=1S/C17H23NO3/c1-3-6-12-16(15-8-5-10-21-15)18-13(11-17(12,2)19)14-7-4-9-20-14/h4-5,7-10,12-13,16,18-19H,3,6,11H2,1-2H3	KRWCRLSHEPHBQC-UHFFFAOYSA-N	CCCC1C(NC(CC1(C)O)c2occc2)c3occc3	BroadT	BRD-A99750020	BRD-A99750020-034-06-3	InterBioScreen Ltd.	STOCK4S-77767		OC(=O)C(=O)O	CCCC1C(NC(CC1(C)O)c1ccco1)c1ccco1.OC(=O)C(=O)O	InChI=1S/C17H23NO3.C2H2O4/c1-3-6-12-16(15-8-5-10-21-15)18-13(11-17(12,2)19)14-7-4-9-20-14;3-1(4)2(5)6/h4-5,7-10,12-13,16,18-19H,3,6,11H2,1-2H3;(H,3,4)(H,5,6)	BOWDJENQGLZOHW-UHFFFAOYSA-N	289.167793606							104219, 104219
T0504-4985	LSM-32138	BRD-K32040515, SID22409642	2324950	InChI=1S/C14H13BrN2O2S3/c1-2-19-14(20)22-8-12(18)17-13-16-11(7-21-13)9-3-5-10(15)6-4-9/h3-7H,2,8H2,1H3,(H,16,17,18)	UTAPERXSJDJQRV-UHFFFAOYSA-N	CCOC(=S)SCC(=O)Nc1nc(cs1)c2ccc(Br)cc2	BroadT	BRD-K32040515	BRD-K32040515-001-07-6	Enamine Ltd.	T0504-4985			CCOC(=S)SCC(=O)Nc1nc(cs1)-c1ccc(Br)cc1	InChI=1S/C14H13BrN2O2S3/c1-2-19-14(20)22-8-12(18)17-13-16-11(7-21-13)9-3-5-10(15)6-4-9/h3-7H,2,8H2,1H3,(H,16,17,18)	UTAPERXSJDJQRV-UHFFFAOYSA-N	415.932252346							120696
T0514-2283	LSM-32139	BRD-K53802078, SID26669727	5197840	InChI=1S/C23H26N2O7S/c1-17(26)19-5-7-20(8-6-19)24-22(27)16-32-23(28)11-4-18-2-9-21(10-3-18)33(29,30)25-12-14-31-15-13-25/h2-3,5-10H,4,11-16H2,1H3,(H,24,27)	OHFXYPPZZVWAGN-UHFFFAOYSA-N	CC(=O)c1ccc(NC(=O)COC(=O)CCc2ccc(cc2)S(=O)(=O)N3CCOCC3)cc1	BroadT	BRD-K53802078	BRD-K53802078-001-05-6	Enamine Ltd.	T0514-2283			CC(=O)c1ccc(NC(=O)COC(=O)CCc2ccc(cc2)S(=O)(=O)N2CCOCC2)cc1	InChI=1S/C23H26N2O7S/c1-17(26)19-5-7-20(8-6-19)24-22(27)16-32-23(28)11-4-18-2-9-21(10-3-18)33(29,30)25-12-14-31-15-13-25/h2-3,5-10H,4,11-16H2,1H3,(H,24,27)	OHFXYPPZZVWAGN-UHFFFAOYSA-N	474.146071882							120697
N-[5-(2-Chlorophenyl)-1H-1,2,4-triazol-3-yl]-4,6-dimethylpyrimidin-2-amine	LSM-32140	BRD-K21729626, SID24785216	901231	InChI=1S/C14H13ClN6/c1-8-7-9(2)17-13(16-8)19-14-18-12(20-21-14)10-5-3-4-6-11(10)15/h3-7H,1-2H3,(H2,16,17,18,19,20,21)	PQKWRTGLQLSVTI-UHFFFAOYSA-N	Cc1cc(C)nc(Nc2n[nH]c(n2)c3ccccc3Cl)n1	BroadT	BRD-K21729626	BRD-K21729626-001-06-5	ChemBridge Corporation	7790846			Cc1cc(C)nc(Nc2n[nH]c(n2)-c2ccccc2Cl)n1	InChI=1S/C14H13ClN6/c1-8-7-9(2)17-13(16-8)19-14-18-12(20-21-14)10-5-3-4-6-11(10)15/h3-7H,1-2H3,(H2,16,17,18,19,20,21)	PQKWRTGLQLSVTI-UHFFFAOYSA-N	300.089022186							120698
BAS 02072865	LSM-15236	BRD-K59671190	3137535	InChI=1S/C28H36NO3S/c1-20-23(33-19-29(20)12-22(30)21-8-6-5-7-9-21)10-11-32-24(31)28-16-25(2)13-26(3,17-28)15-27(4,14-25)18-28/h5-9,19H,10-18H2,1-4H3/q+1	XUFGIZSDNNALQR-UHFFFAOYSA-N	Cc1c(CCOC(=O)C23CC4(C)CC(C)(CC(C)(C4)C2)C3)sc[n+]1CC(=O)c5ccccc5	BroadT	BRD-K59671190	BRD-K59671190-004-06-4	Asinex Ltd.	BAS 02072865		Br	Cc1c(CCOC(=O)C23CC4(C)CC(C)(CC(C)(C4)C2)C3)sc[n+]1CC(=O)c1ccccc1.Br	InChI=1S/C28H36NO3S.BrH/c1-20-23(33-19-29(20)12-22(30)21-8-6-5-7-9-21)10-11-32-24(31)28-16-25(2)13-26(3,17-28)15-27(4,14-25)18-28;/h5-9,19H,10-18H2,1-4H3;1H/q+1;	VAQYAZNYKHTAEA-UHFFFAOYSA-N	466.241589712							103883, 103883
STK225852	LSM-32141	BRD-K72034681, SID24795649	1293729	InChI=1S/C21H22N2O4/c1-27-16-10-8-15(9-11-16)12-13-22-19(24)7-4-14-23-20(25)17-5-2-3-6-18(17)21(23)26/h2-3,5-6,8-11H,4,7,12-14H2,1H3,(H,22,24)	XACGYGLIPYTZCR-UHFFFAOYSA-N	COc1ccc(CCNC(=O)CCCN2C(=O)c3ccccc3C2=O)cc1	BroadT	BRD-K72034681	BRD-K72034681-001-05-2	ChemBridge Corporation	7778843			COc1ccc(CCNC(=O)CCCN2C(=O)c3ccccc3C2=O)cc1	InChI=1S/C21H22N2O4/c1-27-16-10-8-15(9-11-16)12-13-22-19(24)7-4-14-23-20(25)17-5-2-3-6-18(17)21(23)26/h2-3,5-6,8-11H,4,7,12-14H2,1H3,(H,22,24)	XACGYGLIPYTZCR-UHFFFAOYSA-N	366.157957204							120699
ST51030679	LSM-32142	BRD-K91271834, SID49827475	3704231	InChI=1S/C14H11FN2O3/c15-9-1-3-10(4-2-9)16-14(18)17-11-5-6-12-13(7-11)20-8-19-12/h1-7H,8H2,(H2,16,17,18)	JEPPSPJZVSRPFU-UHFFFAOYSA-N	Fc1ccc(NC(=O)Nc2ccc3OCOc3c2)cc1	BroadT	BRD-K91271834	BRD-K91271834-001-05-3	Chemical Technologies & Investigations	AMNCO-15943			Fc1ccc(NC(=O)Nc2ccc3OCOc3c2)cc1	InChI=1S/C14H11FN2O3/c15-9-1-3-10(4-2-9)16-14(18)17-11-5-6-12-13(7-11)20-8-19-12/h1-7H,8H2,(H2,16,17,18)	JEPPSPJZVSRPFU-UHFFFAOYSA-N	274.075370432							120700
AC1MRO8Q	LSM-15584	BRD-A24714998	3521171	InChI=1S/C21H25N3O2/c1-2-24-19-8-4-3-7-17(19)18-12-15(9-10-20(18)24)23-21(25)14-22-13-16-6-5-11-26-16/h3-4,7-10,12,16,22H,2,5-6,11,13-14H2,1H3,(H,23,25)	WEQMXWTVSYUUSB-UHFFFAOYSA-N	CCn1c2ccccc2c3cc(NC(=O)CNCC4CCCO4)ccc13	BroadT	BRD-A24714998	BRD-A24714998-034-05-9	Enamine Ltd.	T0518-0494		OC(=O)C(=O)O	CCn1c2ccccc2c2cc(NC(=O)CNCC3CCCO3)ccc12.OC(=O)C(=O)O	InChI=1S/C21H25N3O2.C2H2O4/c1-2-24-19-8-4-3-7-17(19)18-12-15(9-10-20(18)24)23-21(25)14-22-13-16-6-5-11-26-16;3-1(4)2(5)6/h3-4,7-10,12,16,22H,2,5-6,11,13-14H2,1H3,(H,23,25);(H,3,4)(H,5,6)	FYSYYJKAIKZXPS-UHFFFAOYSA-N	351.19467707							104220, 104220
MLS000539554	LSM-44386	SID14739835, BRD-K19817946	1475855	InChI=1S/C21H21N5O/c1-27-16-8-6-15(7-9-16)25-10-12-26(13-11-25)21-20-19(22-14-23-21)17-4-2-3-5-18(17)24-20/h2-9,14H,10-13H2,1H3,(H,22,23)	LHCHMNFZVIHXMW-UHFFFAOYSA-N	COc1ccc(cc1)N2CCN(CC2)c3[nH]cnc4c5ccccc5nc34	BroadT	BRD-K19817946	BRD-K19817946-001-05-7	Key Organics Ltd.	4F-929			COc1ccc(cc1)N1CCN(CC1)c1[nH]cnc2c1nc1ccccc21	InChI=1S/C21H21N5O/c1-27-16-8-6-15(7-9-16)25-10-12-26(13-11-25)21-20-19(22-14-23-21)17-4-2-3-5-18(17)24-20/h2-9,14H,10-13H2,1H3,(H,22,23)	LHCHMNFZVIHXMW-UHFFFAOYSA-N	359.174610342							
AC1LQJZU	LSM-32144	BRD-K61660466, SID14740893	1402105	InChI=1S/C15H11FN4O2S/c16-11-1-3-12(4-2-11)22-9-13(21)18-15-20-19-14(23-15)10-5-7-17-8-6-10/h1-8H,9H2,(H,18,20,21)	VTEPZEONRNPAAH-UHFFFAOYSA-N	Fc1ccc(OCC(=O)Nc2nnc(s2)c3ccncc3)cc1	BroadT	BRD-K61660466	BRD-K61660466-001-05-8	InterBioScreen Ltd.	STOCK4S-47542			Fc1ccc(OCC(=O)Nc2nnc(s2)-c2ccncc2)cc1	InChI=1S/C15H11FN4O2S/c16-11-1-3-12(4-2-11)22-9-13(21)18-15-20-19-14(23-15)10-5-7-17-8-6-10/h1-8H,9H2,(H,18,20,21)	VTEPZEONRNPAAH-UHFFFAOYSA-N	330.058674522							120702
CID_3363660	LSM-32145	BRD-A06158172	91899717	InChI=1S/C29H29N3O6/c1-2-31-21-10-5-4-9-20(21)29(28(31)36)24(25(33)23-18-19-8-3-6-11-22(19)38-23)26(34)27(35)32(29)13-7-12-30-14-16-37-17-15-30/h3-6,8-11,18,24H,2,7,12-17H2,1H3	OAOILMMXPXJGST-UHFFFAOYSA-N	CCN1C(=O)C2(C(C(=O)c3oc4ccccc4c3)C(=O)C(=O)N2CCCN5CCOCC5)c6ccccc16	BroadT	BRD-A06158172	BRD-A06158172-001-05-8	InterBioScreen Ltd.	STOCK4S-41779			CCN1C(=O)C2(C(C(=O)c3cc4ccccc4o3)C(=O)C(=O)N2CCCN2CCOCC2)c2ccccc12	InChI=1S/C29H29N3O6/c1-2-31-21-10-5-4-9-20(21)29(28(31)36)24(25(33)23-18-19-8-3-6-11-22(19)38-23)26(34)27(35)32(29)13-7-12-30-14-16-37-17-15-30/h3-6,8-11,18,24H,2,7,12-17H2,1H3	OAOILMMXPXJGST-UHFFFAOYSA-N	515.205635678							120703
SMR000111210	LSM-32146	BRD-A14424697, SID7977927	2846747	InChI=1S/C8H16N4O5S2/c1-10-7-6(9-8(10)13)11(18(2,14)15)4-5-12(7)19(3,16)17/h6-7H,4-5H2,1-3H3,(H,9,13)	VKRZOWHFRCMNEJ-UHFFFAOYSA-N	CN1C2C(NC1=O)N(CCN2S(=O)(=O)C)S(=O)(=O)C	BroadT	BRD-A14424697	BRD-A14424697-001-05-0	ChemBridge Corporation	5466276			CN1C2C(NC1=O)N(CCN2S(C)(=O)=O)S(C)(=O)=O	InChI=1S/C8H16N4O5S2/c1-10-7-6(9-8(10)13)11(18(2,14)15)4-5-12(7)19(3,16)17/h6-7H,4-5H2,1-3H3,(H,9,13)	VKRZOWHFRCMNEJ-UHFFFAOYSA-N	312.056211032							120704
SMR000043748	LSM-32147	BRD-K10181552, SID861737	662970	InChI=1S/C15H16N4/c1-9-7-10(2)19-15(16-9)12-8-11-5-3-4-6-13(11)17-14(12)18-19/h7-8H,3-6H2,1-2H3	YECJAGMZPXEPPD-UHFFFAOYSA-N	Cc1cc(C)n2nc3nc4CCCCc4cc3c2n1	BroadT	BRD-K10181552	BRD-K10181552-001-05-2	InterBioScreen Ltd.	STOCK4S-21499			Cc1cc(C)n2nc3nc4CCCCc4cc3c2n1	InChI=1S/C15H16N4/c1-9-7-10(2)19-15(16-9)12-8-11-5-3-4-6-13(11)17-14(12)18-19/h7-8H,3-6H2,1-2H3	YECJAGMZPXEPPD-UHFFFAOYSA-N	252.137496552							120705
SMR000013396	LSM-32148	BRD-K97921950, SID845315	647659	InChI=1S/C21H20FN3O4/c1-26-18-8-7-14(11-19(18)27-2)9-10-24-21-16(12-23)25-20(29-21)13-28-17-6-4-3-5-15(17)22/h3-8,11,24H,9-10,13H2,1-2H3	VZRIPUUFFWSBSB-UHFFFAOYSA-N	COc1ccc(CCNc2oc(COc3ccccc3F)nc2C#N)cc1OC	BroadT	BRD-K97921950	BRD-K97921950-001-04-8	Asinex Ltd.	BAS 05509640			COc1ccc(CCNc2oc(COc3ccccc3F)nc2C#N)cc1OC	InChI=1S/C21H20FN3O4/c1-26-18-8-7-14(11-19(18)27-2)9-10-24-21-16(12-23)25-20(29-21)13-28-17-6-4-3-5-15(17)22/h3-8,11,24H,9-10,13H2,1-2H3	VZRIPUUFFWSBSB-UHFFFAOYSA-N	397.14378435							120706
AC1MEVOT	LSM-32149	BRD-K36208388, SID17433342	2884968	InChI=1S/C13H12F3N5O2/c1-23-8-4-2-3-7(5-8)18-11(17)21-12-19-9(13(14,15)16)6-10(22)20-12/h2-6H,1H3,(H4,17,18,19,20,21,22)	VWRFVKYVVDZESE-UHFFFAOYSA-N	COc1cccc(NC(=N)Nc2nc(O)cc(n2)C(F)(F)F)c1	BroadT	BRD-K36208388	BRD-K36208388-001-05-3	ChemBridge Corporation	6078500			COc1cccc(NC(=N)Nc2nc(O)cc(n2)C(F)(F)F)c1	InChI=1S/C13H12F3N5O2/c1-23-8-4-2-3-7(5-8)18-11(17)21-12-19-9(13(14,15)16)6-10(22)20-12/h2-6H,1H3,(H4,17,18,19,20,21,22)	VWRFVKYVVDZESE-UHFFFAOYSA-N	327.094309274							120707
4L-310S	LSM-44387	BRD-K24523560, SID17410624	11958837	InChI=1S/C16H14Cl2N2O/c17-14-7-6-13(15(18)10-14)11-20-16(21)19-9-8-12-4-2-1-3-5-12/h1-10H,11H2,(H2,19,20,21)/b9-8-	RVLWPOYDLHJPLJ-HJWRWDBZSA-N	Clc1ccc(CNC(=O)N\C=C/c2ccccc2)c(Cl)c1	BroadT	BRD-K24523560	BRD-K24523560-001-05-9	Key Organics Ltd.	4L-310S			Clc1ccc(CNC(=O)N\C=C/c2ccccc2)c(Cl)c1	InChI=1S/C16H14Cl2N2O/c17-14-7-6-13(15(18)10-14)11-20-16(21)19-9-8-12-4-2-1-3-5-12/h1-10H,11H2,(H2,19,20,21)/b9-8-	RVLWPOYDLHJPLJ-HJWRWDBZSA-N	320.048318508							
SMR000108770	LSM-32151	BRD-K66030669, SID7972991	758269	InChI=1S/C13H14N4S/c1-7-8(2)14-11-5-4-9(6-10(7)11)12-15-16-13(18)17(12)3/h4-6,14H,1-3H3,(H,16,18)	WMEAOFQKCCTHIO-UHFFFAOYSA-N	Cc1[nH]c2ccc(cc2c1C)c3nnc(S)n3C	BroadT	BRD-K66030669	BRD-K66030669-001-07-0	ChemBridge Corporation	6907387			Cc1[nH]c2ccc(cc2c1C)-c1nnc(S)n1C	InChI=1S/C13H14N4S/c1-7-8(2)14-11-5-4-9(6-10(7)11)12-15-16-13(18)17(12)3/h4-6,14H,1-3H3,(H,16,18)	WMEAOFQKCCTHIO-UHFFFAOYSA-N	258.093917178							120709
AN-689/41741257	LSM-32152	BRD-K92374432	838384	InChI=1S/C15H14N2OS/c1-17-13-5-3-4-6-14(13)19-15(17)16-11-7-9-12(18-2)10-8-11/h3-10H,1-2H3	QXANLIAKHBUKKI-UHFFFAOYSA-N	COc1ccc(cc1)N=C2Sc3ccccc3N2C	BroadT	BRD-K92374432	BRD-K92374432-001-05-0	Specs	AN-689/41741257			COc1ccc(cc1)N=c1sc2ccccc2n1C	InChI=1S/C15H14N2OS/c1-17-13-5-3-4-6-14(13)19-15(17)16-11-7-9-12(18-2)10-8-11/h3-10H,1-2H3	QXANLIAKHBUKKI-UHFFFAOYSA-N	270.082683778							120710
SMR000042188	LSM-32153	BRD-K83708628, SID860339	661638	InChI=1S/C14H14N4O3/c1-7-11-12(14(19)18-17-7)16-13(15-11)9-6-8(20-2)4-5-10(9)21-3/h4-6,18-19H,1-3H3	UJXQMYFIPJTVCG-UHFFFAOYSA-N	COc1ccc(OC)c(c1)c2nc3c(C)n[nH]c(O)c3n2	BroadT	BRD-K83708628	BRD-K83708628-001-06-2	InterBioScreen Ltd.	STOCK3S-63924			COc1ccc(OC)c(c1)-c1nc2c(C)n[nH]c(O)c2n1	InChI=1S/C14H14N4O3/c1-7-11-12(14(19)18-17-7)16-13(15-11)9-6-8(20-2)4-5-10(9)21-3/h4-6,18-19H,1-3H3	UJXQMYFIPJTVCG-UHFFFAOYSA-N	286.106590348							
MS-0244	LSM-32154	BRD-K18296568, SID14733365	3871612	InChI=1S/C13H14Cl2N4O/c14-10-2-3-12(11(15)8-10)18-13(20)17-4-1-6-19-7-5-16-9-19/h2-3,5,7-9H,1,4,6H2,(H2,17,18,20)	SXBJRYDXUKRXFV-UHFFFAOYSA-N	Clc1ccc(NC(=O)NCCCn2ccnc2)c(Cl)c1	BroadT	BRD-K18296568	BRD-K18296568-001-05-2	Key Organics Ltd.	MS-0244			Clc1ccc(NC(=O)NCCCn2ccnc2)c(Cl)c1	InChI=1S/C13H14Cl2N4O/c14-10-2-3-12(11(15)8-10)18-13(20)17-4-1-6-19-7-5-16-9-19/h2-3,5,7-9H,1,4,6H2,(H2,17,18,20)	SXBJRYDXUKRXFV-UHFFFAOYSA-N	312.054466528							120712
AC1MCFA8	LSM-32155	BRD-K27147269	2768218	InChI=1S/C20H22N4O4/c1-15-3-6-17(7-4-15)20(25)23-11-9-22(10-12-23)18-8-5-16(14-21-28-2)13-19(18)24(26)27/h3-8,13-14H,9-12H2,1-2H3	XIWVYGPWWJJNFK-UHFFFAOYSA-N	CON=Cc1ccc(N2CCN(CC2)C(=O)c3ccc(C)cc3)c(c1)[N+](=O)[O-]	BroadT	BRD-K27147269	BRD-K27147269-001-06-6	Key Organics Ltd.	11R-1136			CON=Cc1ccc(N2CCN(CC2)C(=O)c2ccc(C)cc2)c(c1)[N+]([O-])=O	InChI=1S/C20H22N4O4/c1-15-3-6-17(7-4-15)20(25)23-11-9-22(10-12-23)18-8-5-16(14-21-28-2)13-19(18)24(26)27/h3-8,13-14H,9-12H2,1-2H3	XIWVYGPWWJJNFK-UHFFFAOYSA-N	382.164105224							120713
STK851921	LSM-32156	SID24787470, BRD-K66909712	934282	InChI=1S/C13H11N5S/c1-9-2-4-10(5-3-9)18-12(16-17-13(18)19)11-8-14-6-7-15-11/h2-8H,1H3,(H,17,19)	QBOIIPXQBZTQPB-UHFFFAOYSA-N	Cc1ccc(cc1)n2c(S)nnc2c3cnccn3	BroadT	BRD-K66909712	BRD-K66909712-001-06-4	ChemBridge Corporation	7905948			Cc1ccc(cc1)-n1c(S)nnc1-c1cnccn1	InChI=1S/C13H11N5S/c1-9-2-4-10(5-3-9)18-12(16-17-13(18)19)11-8-14-6-7-15-11/h2-8H,1H3,(H,17,19)	QBOIIPXQBZTQPB-UHFFFAOYSA-N	269.073516092							120714
AC1LHEWM	LSM-44388	BRD-K21125528	886255	InChI=1S/C17H17NO2/c1-14(18-19)7-8-15-9-11-17(12-10-15)20-13-16-5-3-2-4-6-16/h2-12,19H,13H2,1H3/b8-7+,18-14?	HDPQZESPJMVAAH-GICOEAISSA-N	CC(=NO)\C=C\c1ccc(OCc2ccccc2)cc1	BroadT	BRD-K21125528	BRD-K21125528-001-05-7	ChemBridge Corporation	6648682			CC(\C=C\c1ccc(OCc2ccccc2)cc1)=NO	InChI=1S/C17H17NO2/c1-14(18-19)7-8-15-9-11-17(12-10-15)20-13-16-5-3-2-4-6-16/h2-12,19H,13H2,1H3/b8-7+,18-14?	HDPQZESPJMVAAH-GICOEAISSA-N	267.125928794							
MLS000090057	LSM-32158	BRD-K21355275, SID4242792	3237602	InChI=1S/C11H16N2O4S2/c1-10-3-5-11(6-4-10)19(16,17)13-8-7-12(9-13)18(2,14)15/h3-6H,7-9H2,1-2H3	NDDDMGSZOXUNDX-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N2CCN(C2)S(=O)(=O)C	BroadT	BRD-K21355275	BRD-K21355275-001-06-3	ChemDiv Inc.	4444-0126			Cc1ccc(cc1)S(=O)(=O)N1CCN(C1)S(C)(=O)=O	InChI=1S/C11H16N2O4S2/c1-10-3-5-11(6-4-10)19(16,17)13-8-7-12(9-13)18(2,14)15/h3-6H,7-9H2,1-2H3	NDDDMGSZOXUNDX-UHFFFAOYSA-N	304.055148392							120716
2-Chloro-1-[2,5-dimethyl-1-(5-methylisoxazol-3-yl)-1H-pyrrol-3-yl]ethanone	LSM-32159	SID24830204, BRD-K84794783	2103959	InChI=1S/C12H13ClN2O2/c1-7-4-10(11(16)6-13)9(3)15(7)12-5-8(2)17-14-12/h4-5H,6H2,1-3H3	AQWWIOJBPOBUDQ-UHFFFAOYSA-N	Cc1onc(c1)n2c(C)cc(C(=O)CCl)c2C	BroadT	BRD-K84794783	BRD-K84794783-001-07-0	Enamine Ltd.	T5237189			Cc1cc(no1)-n1c(C)cc(C(=O)CCl)c1C	InChI=1S/C12H13ClN2O2/c1-7-4-10(11(16)6-13)9(3)15(7)12-5-8(2)17-14-12/h4-5H,6H2,1-3H3	AQWWIOJBPOBUDQ-UHFFFAOYSA-N	252.066555386							120717
SMR000140797	LSM-32160	BRD-K21409337, SID14746387	1356336	InChI=1S/C23H14N2O3/c26-14-16-13-25(17-7-2-1-3-8-17)24-22(16)20-12-19-18-9-5-4-6-15(18)10-11-21(19)28-23(20)27/h1-14H	SINOBKFPSJNFGV-UHFFFAOYSA-N	O=Cc1cn(nc1C2=Cc3c(OC2=O)ccc4ccccc34)c5ccccc5	BroadT	BRD-K21409337	BRD-K21409337-001-04-9	ChemBridge Corporation	5922462			O=Cc1cn(nc1-c1cc2c(ccc3ccccc23)oc1=O)-c1ccccc1	InChI=1S/C23H14N2O3/c26-14-16-13-25(17-7-2-1-3-8-17)24-22(16)20-12-19-18-9-5-4-6-15(18)10-11-21(19)28-23(20)27/h1-14H	SINOBKFPSJNFGV-UHFFFAOYSA-N	366.100442328							120718
MLS000911607	LSM-32161	BRD-K07484899, SID26725570, SID49828085	16745791	InChI=1S/C24H15F6N3OS/c25-23(26,27)16-4-1-3-15(11-16)21(34)31-18-9-7-14(8-10-18)20-13-35-22(33-20)32-19-6-2-5-17(12-19)24(28,29)30/h1-13H,(H,31,34)(H,32,33)	GQHHIKPBSIGRQP-UHFFFAOYSA-N	FC(F)(F)c1cccc(Nc2nc(cs2)c3ccc(NC(=O)c4cccc(c4)C(F)(F)F)cc3)c1	BroadT	BRD-K07484899	BRD-K07484899-001-06-5	Dana Farber Cancer Institute	AMY001-077			FC(F)(F)c1cccc(Nc2nc(cs2)-c2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2)c1	InChI=1S/C24H15F6N3OS/c25-23(26,27)16-4-1-3-15(11-16)21(34)31-18-9-7-14(8-10-18)20-13-35-22(33-20)32-19-6-2-5-17(12-19)24(28,29)30/h1-13H,(H,31,34)(H,32,33)	GQHHIKPBSIGRQP-UHFFFAOYSA-N	507.08400202							120719
MLS000572016	LSM-32162	BRD-K98408574, SID17415379	1221629	InChI=1S/C24H17N3O2S/c1-29-16-8-6-7-15(13-16)21-14-18(17-9-2-3-10-19(17)25-21)23(28)27-24-26-20-11-4-5-12-22(20)30-24/h2-14H,1H3,(H,26,27,28)	LTFMFZZHUKXPMV-UHFFFAOYSA-N	COc1cccc(c1)c2cc(C(=O)Nc3nc4ccccc4s3)c5ccccc5n2	BroadT	BRD-K98408574	BRD-K98408574-001-05-8	ChemBridge Corporation	6105046			COc1cccc(c1)-c1cc(C(=O)Nc2nc3ccccc3s2)c2ccccc2n1	InChI=1S/C24H17N3O2S/c1-29-16-8-6-7-15(13-16)21-14-18(17-9-2-3-10-19(17)25-21)23(28)27-24-26-20-11-4-5-12-22(20)30-24/h2-14H,1H3,(H,26,27,28)	LTFMFZZHUKXPMV-UHFFFAOYSA-N	411.104147504							120720
2-{[5-(Furan-2-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-n-(2-methoxyphenyl)acetamide	LSM-32163	BRD-K12239796, SID861627	662865	InChI=1S/C20H18N4O4S/c1-26-16-8-3-2-7-15(16)21-18(25)13-29-20-23-22-19(17-9-5-11-28-17)24(20)12-14-6-4-10-27-14/h2-11H,12-13H2,1H3,(H,21,25)	FUCIAIPGZRXNGA-UHFFFAOYSA-N	COc1ccccc1NC(=O)CSc2nnc(c3occc3)n2Cc4occc4	BroadT	BRD-K12239796	BRD-K12239796-001-05-2	InterBioScreen Ltd.	STOCK4S-15158			COc1ccccc1NC(=O)CSc1nnc(-c2ccco2)n1Cc1ccco1	InChI=1S/C20H18N4O4S/c1-26-16-8-3-2-7-15(16)21-18(25)13-29-20-23-22-19(17-9-5-11-28-17)24(20)12-14-6-4-10-27-14/h2-11H,12-13H2,1H3,(H,21,25)	FUCIAIPGZRXNGA-UHFFFAOYSA-N	410.104875786							120721
AC1LZMIU	LSM-32164	BRD-K48143921, SID14743406	1977834	InChI=1S/C22H24N6O4S/c1-2-32-13-5-12-25-22(29)18-19-21(27-17-7-4-3-6-16(17)26-19)28(20(18)23)14-8-10-15(11-9-14)33(24,30)31/h3-4,6-11H,2,5,12-13,23H2,1H3,(H,25,29)(H2,24,30,31)	ACHPSLMZBQZZJK-UHFFFAOYSA-N	CCOCCCNC(=O)c1c(N)n(c2ccc(cc2)S(=O)(=O)N)c3nc4ccccc4nc13	BroadT	BRD-K48143921	BRD-K48143921-001-05-2	InterBioScreen Ltd.	STOCK4S-16959			CCOCCCNC(=O)c1c(N)n(-c2ccc(cc2)S(N)(=O)=O)c2nc3ccccc3nc12	InChI=1S/C22H24N6O4S/c1-2-32-13-5-12-25-22(29)18-19-21(27-17-7-4-3-6-16(17)26-19)28(20(18)23)14-8-10-15(11-9-14)33(24,30)31/h3-4,6-11H,2,5,12-13,23H2,1H3,(H,25,29)(H2,24,30,31)	ACHPSLMZBQZZJK-UHFFFAOYSA-N	468.157973998							120722
SMR000001084	LSM-32165	BRD-A42246453, SID846456	648844	InChI=1S/C10H24N2O3/c1-3-11-5-9(13)7-15-8-10(14)6-12-4-2/h9-14H,3-8H2,1-2H3	NOWSFZSRGQDPTC-UHFFFAOYSA-N	CCNCC(O)COCC(O)CNCC	BroadT	BRD-A42246453	BRD-A42246453-001-05-7	Asinex Ltd.	BAS 00118916			CCNCC(O)COCC(O)CNCC	InChI=1S/C10H24N2O3/c1-3-11-5-9(13)7-15-8-10(14)6-12-4-2/h9-14H,3-8H2,1-2H3	NOWSFZSRGQDPTC-UHFFFAOYSA-N	220.178692648							120723
MLS000533127	LSM-32166	BRD-K20024676, SID14736349	759169	InChI=1S/C15H12BrN3S/c16-12-6-8-13(9-7-12)19-10-17-14(18-15(19)20)11-4-2-1-3-5-11/h1-9H,10H2,(H,17,18,20)	YDFYWPBKXIXYRB-UHFFFAOYSA-N	SC1=NC(=NCN1c2ccc(Br)cc2)c3ccccc3	BroadT	BRD-K20024676	BRD-K20024676-001-06-1	ChemBridge Corporation	5635244			SC1=NC(=NCN1c1ccc(Br)cc1)c1ccccc1	InChI=1S/C15H12BrN3S/c16-12-6-8-13(9-7-12)19-10-17-14(18-15(19)20)11-4-2-1-3-5-11/h1-9H,10H2,(H,17,18,20)	YDFYWPBKXIXYRB-UHFFFAOYSA-N	344.993530704							120724
AC1LTSXP	LSM-32167	BRD-K98408839	1539494	InChI=1S/C18H17N3O2S2/c1-23-14-8-6-13(7-9-14)12-19-21-17(22)10-11-24-18-20-15-4-2-3-5-16(15)25-18/h2-9,12H,10-11H2,1H3,(H,21,22)	FZIHFQUVDBUZSG-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)CCSc2nc3ccccc3s2)cc1	BroadT	BRD-K98408839	BRD-K98408839-001-05-9	InterBioScreen Ltd.	STOCK3S-34890			COc1ccc(C=NNC(=O)CCSc2nc3ccccc3s2)cc1	InChI=1S/C18H17N3O2S2/c1-23-14-8-6-13(7-9-14)12-19-21-17(22)10-11-24-18-20-15-4-2-3-5-16(15)25-18/h2-9,12H,10-11H2,1H3,(H,21,22)	FZIHFQUVDBUZSG-UHFFFAOYSA-N	371.076218194							120725
AC1MDJY9	LSM-32168	BRD-A53463743, SID26663345	2790804	InChI=1S/C19H18N4O3/c24-23(25)14-9-7-13(8-10-14)18-21-17-6-2-1-5-16(17)19(22-18)20-12-15-4-3-11-26-15/h1-2,5-10,15H,3-4,11-12H2,(H,20,21,22)	WSTYMFXGRCOWBC-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)c2nc(NCC3CCCO3)c4ccccc4n2	BroadT	BRD-A53463743	BRD-A53463743-001-06-2	InterBioScreen Ltd.	STOCK2S-78446			[O-][N+](=O)c1ccc(cc1)-c1nc(NCC2CCCO2)c2ccccc2n1	InChI=1S/C19H18N4O3/c24-23(25)14-9-7-13(8-10-14)18-21-17-6-2-1-5-16(17)19(22-18)20-12-15-4-3-11-26-15/h1-2,5-10,15H,3-4,11-12H2,(H,20,21,22)	WSTYMFXGRCOWBC-UHFFFAOYSA-N	350.137890476							120726
AC1MUFF7	LSM-32169	BRD-K19536737	3617550	InChI=1S/C19H18F3N3O3/c1-12(24-25-18(27)13-6-8-16(28-2)9-7-13)10-17(26)23-15-5-3-4-14(11-15)19(20,21)22/h3-9,11H,10H2,1-2H3,(H,23,26)(H,25,27)	MUHDGRAISUTDPG-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NN=C(C)CC(=O)Nc2cccc(c2)C(F)(F)F	BroadT	BRD-K19536737	BRD-K19536737-001-05-6	InterBioScreen Ltd.	STOCK3S-13844			COc1ccc(cc1)C(=O)NN=C(C)CC(=O)Nc1cccc(c1)C(F)(F)F	InChI=1S/C19H18F3N3O3/c1-12(24-25-18(27)13-6-8-16(28-2)9-7-13)10-17(26)23-15-5-3-4-14(11-15)19(20,21)22/h3-9,11H,10H2,1-2H3,(H,23,26)(H,25,27)	MUHDGRAISUTDPG-UHFFFAOYSA-N	393.130026066							120727
MLS000911560	LSM-32170	BRD-K29975122, SID26731947	16746146	InChI=1S/C32H32BrF3N6O2/c1-3-41-12-14-42(15-13-41)19-23-8-11-25(17-26(23)32(34,35)36)37-30(43)22-5-4-20(2)27(16-22)38-31(44)29-18-28(39-40-29)21-6-9-24(33)10-7-21/h4-11,16-18H,3,12-15,19H2,1-2H3,(H,37,43)(H,38,44)(H,39,40)	LWOQARAPSINWHX-UHFFFAOYSA-N	CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(NC(=O)c4cc([nH]n4)c5ccc(Br)cc5)c3)cc2C(F)(F)F)CC1	BroadT	BRD-K29975122	BRD-K29975122-001-07-3	Dana Farber Cancer Institute	AMY001-091			CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(NC(=O)c4cc([nH]n4)-c4ccc(Br)cc4)c3)cc2C(F)(F)F)CC1	InChI=1S/C32H32BrF3N6O2/c1-3-41-12-14-42(15-13-41)19-23-8-11-25(17-26(23)32(34,35)36)37-30(43)22-5-4-20(2)27(16-22)38-31(44)29-18-28(39-40-29)21-6-9-24(33)10-7-21/h4-11,16-18H,3,12-15,19H2,1-2H3,(H,37,43)(H,38,44)(H,39,40)	LWOQARAPSINWHX-UHFFFAOYSA-N	668.172221524							120728
MLS000713857	LSM-32171	BRD-K83898111, SID24817168	5443722	InChI=1S/C9H6Br2N4OS/c10-3-1-4-6(5(11)2-3)13-8(16)7(4)14-15-9(12)17/h1-2,13,16H,(H2,12,17)	FWZLGEMXULQBBJ-UHFFFAOYSA-N	NC(=S)N=Nc1c(O)[nH]c2c(Br)cc(Br)cc12	BroadT	BRD-K83898111	BRD-K83898111-001-05-7	Asinex Ltd.	BAS 00233511			NC(=S)N=Nc1c(O)[nH]c2c(Br)cc(Br)cc12	InChI=1S/C9H6Br2N4OS/c10-3-1-4-6(5(11)2-3)13-8(16)7(4)14-15-9(12)17/h1-2,13,16H,(H2,12,17)	FWZLGEMXULQBBJ-UHFFFAOYSA-N	375.862906742							
SMR000026810	LSM-32172	BRD-A42433574, SID24838612, SID4251779	3245422	InChI=1S/C21H22N4O5S2/c26-21(22-11-15-13-29-17-7-1-2-8-18(17)30-15)14-5-4-10-25(12-14)32(27,28)19-9-3-6-16-20(19)24-31-23-16/h1-3,6-9,14-15H,4-5,10-13H2,(H,22,26)	VUUNOJLTZTZKLG-UHFFFAOYSA-N	O=C(NCC1COc2ccccc2O1)C3CCCN(C3)S(=O)(=O)c4cccc5nsnc45	BroadT	BRD-A42433574	BRD-A42433574-001-05-5	ChemDiv Inc.	C444-0227			O=C(NCC1COc2ccccc2O1)C1CCCN(C1)S(=O)(=O)c1cccc2nsnc12	InChI=1S/C21H22N4O5S2/c26-21(22-11-15-13-29-17-7-1-2-8-18(17)30-15)14-5-4-10-25(12-14)32(27,28)19-9-3-6-16-20(19)24-31-23-16/h1-3,6-9,14-15H,4-5,10-13H2,(H,22,26)	VUUNOJLTZTZKLG-UHFFFAOYSA-N	474.103161224							120730
ENAMINE_000678	LSM-32173	BRD-A30962679, SID3715966	5742538	InChI=1S/C15H16N4/c1-2-6-11(7-3-1)14-12-8-4-5-9-13(12)18-15-16-10-17-19(14)15/h1-3,6-7,10,14H,4-5,8-9H2,(H,16,17,18)	XHKLBOSRVAECEX-UHFFFAOYSA-N	C1CCC2=C(C1)Nc3ncnn3C2c4ccccc4	BroadT	BRD-A30962679	BRD-A30962679-001-05-1	Enamine Ltd.	T0501-9457			C1CCC2=C(C1)Nc1ncnn1C2c1ccccc1	InChI=1S/C15H16N4/c1-2-6-11(7-3-1)14-12-8-4-5-9-13(12)18-15-16-10-17-19(14)15/h1-3,6-7,10,14H,4-5,8-9H2,(H,16,17,18)	XHKLBOSRVAECEX-UHFFFAOYSA-N	252.137496552							120731
AC1OAC9U	LSM-32174	BRD-A75421526	6802464	InChI=1S/C24H19N3O3/c1-29-18-9-7-17(8-10-18)27-14-16-11-19-22(12-21(16)28)30-24(26)20(13-25)23(19)15-5-3-2-4-6-15/h2-12,14,23,28H,26H2,1H3	XFORXOIKHRUJKY-UHFFFAOYSA-N	COc1ccc(cc1)N=Cc2cc3C(C(=C(N)Oc3cc2O)C#N)c4ccccc4	BroadT	BRD-A75421526	BRD-A75421526-001-06-7	InterBioScreen Ltd.	STOCK1S-11345			COc1ccc(cc1)N=Cc1cc2C(c3ccccc3)C(C#N)=C(N)Oc2cc1O	InChI=1S/C24H19N3O3/c1-29-18-9-7-17(8-10-18)27-14-16-11-19-22(12-21(16)28)30-24(26)20(13-25)23(19)15-5-3-2-4-6-15/h2-12,14,23,28H,26H2,1H3	XFORXOIKHRUJKY-UHFFFAOYSA-N	397.142641498							
MLS000735974	LSM-32175	BRD-A85231803, SID24800192	16191861	InChI=1S/C18H20N4O3S/c1-12(24-14-4-3-9-19-11-14)10-20-16(23)7-8-17-21-22-18(25-17)15-6-5-13(2)26-15/h3-6,9,11-12H,7-8,10H2,1-2H3,(H,20,23)	BLOWEBNRYNTZBA-UHFFFAOYSA-N	CC(CNC(=O)CCc1oc(nn1)c2ccc(C)s2)Oc3cccnc3	BroadT	BRD-A85231803	BRD-A85231803-001-05-4	ChemBridge Corporation	11826754			CC(CNC(=O)CCc1nnc(o1)-c1ccc(C)s1)Oc1cccnc1	InChI=1S/C18H20N4O3S/c1-12(24-14-4-3-9-19-11-14)10-20-16(23)7-8-17-21-22-18(25-17)15-6-5-13(2)26-15/h3-6,9,11-12H,7-8,10H2,1-2H3,(H,20,23)	BLOWEBNRYNTZBA-UHFFFAOYSA-N	372.12561123							120733
MLS000769411	LSM-32176	BRD-K70941976, SID26666729	950682	InChI=1S/C16H13N5O2S/c1-22-14-6-3-2-5-12(14)21-15(19-20-16(21)24)11-9-10(17-18-11)13-7-4-8-23-13/h2-9H,1H3,(H,17,18)(H,20,24)	NXTMOTYZHUYKLO-UHFFFAOYSA-N	COc1ccccc1n2c(S)nnc2c3cc([nH]n3)c4occc4	BroadT	BRD-K70941976	BRD-K70941976-001-05-4	InterBioScreen Ltd.	STOCK3S-52786			COc1ccccc1-n1c(S)nnc1-c1cc([nH]n1)-c1ccco1	InChI=1S/C16H13N5O2S/c1-22-14-6-3-2-5-12(14)21-15(19-20-16(21)24)11-9-10(17-18-11)13-7-4-8-23-13/h2-9H,1H3,(H,17,18)(H,20,24)	NXTMOTYZHUYKLO-UHFFFAOYSA-N	339.078995396							120734
AK-968/41017617	LSM-44389	BRD-K12306640, SID17406679	6015853	InChI=1S/C14H14N2O/c1-11-13(10-15-16(11)2)8-9-14(17)12-6-4-3-5-7-12/h3-10H,1-2H3/b9-8+	XDVKDZVWJIOJBT-CMDGGOBGSA-N	Cc1c(\C=C\C(=O)c2ccccc2)cnn1C	BroadT	BRD-K12306640	BRD-K12306640-001-05-7	Specs	AK-968/41017617			Cc1c(cnn1C)\C=C\C(=O)c1ccccc1	InChI=1S/C14H14N2O/c1-11-13(10-15-16(11)2)8-9-14(17)12-6-4-3-5-7-12/h3-10H,1-2H3/b9-8+	XDVKDZVWJIOJBT-CMDGGOBGSA-N	226.110613088							
HMS2368F05	LSM-32178	BRD-K22608982	1001636	InChI=1S/C22H17N3O6/c1-30-19-11-10-15(12-20(19)31-22(27)16-6-3-2-4-7-16)14-23-24-21(26)17-8-5-9-18(13-17)25(28)29/h2-14H,1H3,(H,24,26)	LOPVZRLCZIXWIQ-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)c2cccc(c2)[N+](=O)[O-])cc1OC(=O)c3ccccc3	BroadT	BRD-K22608982	BRD-K22608982-001-05-0	Specs	AH-487/40686188			COc1ccc(C=NNC(=O)c2cccc(c2)[N+]([O-])=O)cc1OC(=O)c1ccccc1	InChI=1S/C22H17N3O6/c1-30-19-11-10-15(12-20(19)31-22(27)16-6-3-2-4-7-16)14-23-24-21(26)17-8-5-9-18(13-17)25(28)29/h2-14H,1H3,(H,24,26)	LOPVZRLCZIXWIQ-UHFFFAOYSA-N	419.111735294							120736
MLS000068010	LSM-32179	BRD-K81821040, SID26726158, SID846388	648779	InChI=1S/C18H22N6O2S2/c1-2-26-13-8-9-14-15(10-13)28-17(19-14)20-16(25)11-27-18-21-22-23-24(18)12-6-4-3-5-7-12/h8-10,12H,2-7,11H2,1H3,(H,19,20,25)	MTAVMRDIGKGDCV-UHFFFAOYSA-N	CCOc1ccc2nc(NC(=O)CSc3nnnn3C4CCCCC4)sc2c1	BroadT	BRD-K81821040	BRD-K81821040-001-06-5	Asinex Ltd.	ASN 04891430			CCOc1ccc2nc(NC(=O)CSc3nnnn3C3CCCCC3)sc2c1	InChI=1S/C18H22N6O2S2/c1-2-26-13-8-9-14-15(10-13)28-17(19-14)20-16(25)11-27-18-21-22-23-24(18)12-6-4-3-5-7-12/h8-10,12H,2-7,11H2,1H3,(H,19,20,25)	MTAVMRDIGKGDCV-UHFFFAOYSA-N	418.124565384							120737
MLS000105312	LSM-32180	BRD-K37055068, SID7972034	764138	InChI=1S/C21H28N2O2/c1-16-6-5-7-19(17(16)2)23-12-10-22(11-13-23)15-18-8-9-20(24-3)21(14-18)25-4/h5-9,14H,10-13,15H2,1-4H3	BAHKIASSFRAQOP-UHFFFAOYSA-N	COc1ccc(CN2CCN(CC2)c3cccc(C)c3C)cc1OC	BroadT	BRD-K37055068	BRD-K37055068-001-05-4	ChemBridge Corporation	5264410			COc1ccc(CN2CCN(CC2)c2cccc(C)c2C)cc1OC	InChI=1S/C21H28N2O2/c1-16-6-5-7-19(17(16)2)23-12-10-22(11-13-23)15-18-8-9-20(24-3)21(14-18)25-4/h5-9,14H,10-13,15H2,1-4H3	BAHKIASSFRAQOP-UHFFFAOYSA-N	340.215078156							120738
MLS000082034	LSM-32181	BRD-K22418614, SID3713692	2998514	InChI=1S/C16H12N4O3S2/c21-13(19-15-18-11-3-1-2-4-12(11)25-15)9-23-14(22)7-10-8-20-5-6-24-16(20)17-10/h1-6,8H,7,9H2,(H,18,19,21)	WMAPLAQDQVQJKH-UHFFFAOYSA-N	O=C(COC(=O)Cc1cn2ccsc2n1)Nc3nc4ccccc4s3	BroadT	BRD-K22418614	BRD-K22418614-001-06-8	Enamine Ltd.	T0515-7268			O=C(COC(=O)Cc1cn2ccsc2n1)Nc1nc2ccccc2s1	InChI=1S/C16H12N4O3S2/c21-13(19-15-18-11-3-1-2-4-12(11)25-15)9-23-14(22)7-10-8-20-5-6-24-16(20)17-10/h1-6,8H,7,9H2,(H,18,19,21)	WMAPLAQDQVQJKH-UHFFFAOYSA-N	372.035081664							120739
Nipecotamide	LSM-4501	BRD-A96334094, SID3712156, SID481512, SID50086442	92980	InChI=1S/C6H12N2O/c7-6(9)5-2-1-3-8-4-5/h5,8H,1-4H2,(H2,7,9)	BVOCPVIXARZNQN-UHFFFAOYSA-N	NC(=O)C1CCCNC1	BroadT	BRD-A96334094	BRD-A96334094-001-11-9	Sigma-Aldrich	N8105			NC(=O)C1CCCNC1	InChI=1S/C6H12N2O/c7-6(9)5-2-1-3-8-4-5/h5,8H,1-4H2,(H2,7,9)	BVOCPVIXARZNQN-UHFFFAOYSA-N	128.094963024							60116
MLS000112252	LSM-32182	BRD-K59975583, SID7973396	751264	InChI=1S/C18H14O5/c1-10-8-14-16(11-4-2-5-12(11)17(19)22-14)15(9-10)23-18(20)13-6-3-7-21-13/h3,6-9H,2,4-5H2,1H3	GNVMAYLULBCWMI-UHFFFAOYSA-N	Cc1cc(OC(=O)c2occc2)c3C4=C(CCC4)C(=O)Oc3c1	BroadT	BRD-K59975583	BRD-K59975583-001-05-2	ChemBridge Corporation	6744247			Cc1cc(OC(=O)c2ccco2)c2c3CCCc3c(=O)oc2c1	InChI=1S/C18H14O5/c1-10-8-14-16(11-4-2-5-12(11)17(19)22-14)15(9-10)23-18(20)13-6-3-7-21-13/h3,6-9H,2,4-5H2,1H3	GNVMAYLULBCWMI-UHFFFAOYSA-N	310.084123548							120740
MLS000086763	LSM-32183	BRD-K76125116, SID4242871	3237670	InChI=1S/C22H32N4O3/c1-2-3-5-15-26-21(28)18-10-9-17(16-19(18)24-22(26)29)20(27)23-11-8-14-25-12-6-4-7-13-25/h9-10,16H,2-8,11-15H2,1H3,(H,23,27)(H,24,29)	UDCNDFMYRPWAQZ-UHFFFAOYSA-N	CCCCCN1C(=O)Nc2cc(ccc2C1=O)C(=O)NCCCN3CCCCC3	BroadT	BRD-K76125116	BRD-K76125116-001-05-9	ChemDiv Inc.	C190-0084			CCCCCn1c(=O)[nH]c2cc(ccc2c1=O)C(=O)NCCCN1CCCCC1	InChI=1S/C22H32N4O3/c1-2-3-5-15-26-21(28)18-10-9-17(16-19(18)24-22(26)29)20(27)23-11-8-14-25-12-6-4-7-13-25/h9-10,16H,2-8,11-15H2,1H3,(H,23,27)(H,24,29)	UDCNDFMYRPWAQZ-UHFFFAOYSA-N	400.247440924							120741
3-Benzyl-1-cyclopentyl-1-(4-oxo-3,4-dihydro-quinazolin-2-ylmethyl)-urea	LSM-32184	BRD-K05940224, SID852645	655282	InChI=1S/C22H24N4O2/c27-21-18-12-6-7-13-19(18)24-20(25-21)15-26(17-10-4-5-11-17)22(28)23-14-16-8-2-1-3-9-16/h1-3,6-9,12-13,17H,4-5,10-11,14-15H2,(H,23,28)(H,24,25,27)	PWELLBWPPUWAEG-UHFFFAOYSA-N	Oc1nc(CN(C2CCCC2)C(=O)NCc3ccccc3)nc4ccccc14	BroadT	BRD-K05940224	BRD-K05940224-001-04-9	Asinex Ltd.	ASN 05813215			Oc1nc(CN(C2CCCC2)C(=O)NCc2ccccc2)nc2ccccc12	InChI=1S/C22H24N4O2/c27-21-18-12-6-7-13-19(18)24-20(25-21)15-26(17-10-4-5-11-17)22(28)23-14-16-8-2-1-3-9-16/h1-3,6-9,12-13,17H,4-5,10-11,14-15H2,(H,23,28)(H,24,25,27)	PWELLBWPPUWAEG-UHFFFAOYSA-N	376.189926048							120742
MLS000552004	LSM-32185	SID17410858, BRD-K37203382	1164441	InChI=1S/C21H16N4O2S2/c1-12-23-18-9-15(3-6-19(18)29-12)24-20(26)11-28-21-14(10-22)7-13-8-16(27-2)4-5-17(13)25-21/h3-9H,11H2,1-2H3,(H,24,26)	IYKZPWDGUSLDCE-UHFFFAOYSA-N	COc1ccc2nc(SCC(=O)Nc3ccc4sc(C)nc4c3)c(cc2c1)C#N	BroadT	BRD-K37203382	BRD-K37203382-001-06-7	Asinex Ltd.	ASN 02254648			COc1ccc2nc(SCC(=O)Nc3ccc4sc(C)nc4c3)c(cc2c1)C#N	InChI=1S/C21H16N4O2S2/c1-12-23-18-9-15(3-6-19(18)29-12)24-20(26)11-28-21-14(10-22)7-13-8-16(27-2)4-5-17(13)25-21/h3-9H,11H2,1-2H3,(H,24,26)	IYKZPWDGUSLDCE-UHFFFAOYSA-N	420.071467172							120743
AC1LCZ2B	LSM-32186	BRD-K73296174, SID857256	658600	InChI=1S/C21H24N2O2/c1-4-21(25)22-15(2)14-20(18-12-8-9-13-19(18)22)23(16(3)24)17-10-6-5-7-11-17/h5-13,15,20H,4,14H2,1-3H3/t15-,20+/m1/s1	DRQJSDYVORTCEY-QRWLVFNGSA-N	CCC(=O)N1[C@H](C)C[C@H](N(C(=O)C)c2ccccc2)c3ccccc13	BroadT	BRD-K73296174	BRD-K73296174-001-05-0	InterBioScreen Ltd.	STOCK1S-59065			CCC(=O)N1[C@H](C)C[C@H](N(C(C)=O)c2ccccc2)c2ccccc12	InChI=1S/C21H24N2O2/c1-4-21(25)22-15(2)14-20(18-12-8-9-13-19(18)22)23(16(3)24)17-10-6-5-7-11-17/h5-13,15,20H,4,14H2,1-3H3/t15-,20+/m1/s1	DRQJSDYVORTCEY-QRWLVFNGSA-N	336.183778028							120744
T0504-6839	LSM-32187	BRD-K63584084, SID24833292	5128497	InChI=1S/C17H18ClN3O4S/c18-15-7-6-14(20-17(22)19-13-4-2-1-3-5-13)12-16(15)26(23,24)21-8-10-25-11-9-21/h1-7,12H,8-11H2,(H2,19,20,22)	RKAXFNHIHLETJN-UHFFFAOYSA-N	Clc1ccc(NC(=O)Nc2ccccc2)cc1S(=O)(=O)N3CCOCC3	BroadT	BRD-K63584084	BRD-K63584084-001-05-0	Enamine Ltd.	T0504-6839			Clc1ccc(NC(=O)Nc2ccccc2)cc1S(=O)(=O)N1CCOCC1	InChI=1S/C17H18ClN3O4S/c18-15-7-6-14(20-17(22)19-13-4-2-1-3-5-13)12-16(15)26(23,24)21-8-10-25-11-9-21/h1-7,12H,8-11H2,(H2,19,20,22)	RKAXFNHIHLETJN-UHFFFAOYSA-N	395.070654486							120745
N-[2-(1H-Benzimidazol-2-yl)ethyl]-4-chloro-3-nitrobenzamide	LSM-32188	BRD-K65228230, SID17432769	707837	InChI=1S/C16H13ClN4O3/c17-11-6-5-10(9-14(11)21(23)24)16(22)18-8-7-15-19-12-3-1-2-4-13(12)20-15/h1-6,9H,7-8H2,(H,18,22)(H,19,20)	GYWDNVCGQOXZBI-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1Cl)C(=O)NCCc2nc3ccccc3[nH]2	BroadT	BRD-K65228230	BRD-K65228230-001-06-3	ChemBridge Corporation	6048385			[O-][N+](=O)c1cc(ccc1Cl)C(=O)NCCc1nc2ccccc2[nH]1	InChI=1S/C16H13ClN4O3/c17-11-6-5-10(9-14(11)21(23)24)16(22)18-8-7-15-19-12-3-1-2-4-13(12)20-15/h1-6,9H,7-8H2,(H,18,22)(H,19,20)	GYWDNVCGQOXZBI-UHFFFAOYSA-N	344.067618026							120746
MLS000086337	LSM-32189	BRD-K71296038, SID4252033	2158939	InChI=1S/C24H30N4O5S/c1-16(2)14-28(15-17(3)4)34(30,31)21-11-9-18(10-12-21)22(29)25-24-27-26-23(33-24)19-7-6-8-20(13-19)32-5/h6-13,16-17H,14-15H2,1-5H3,(H,25,27,29)	BHZUADXFFCJVJD-UHFFFAOYSA-N	COc1cccc(c1)c2oc(NC(=O)c3ccc(cc3)S(=O)(=O)N(CC(C)C)CC(C)C)nn2	BroadT	BRD-K71296038	BRD-K71296038-001-04-1	ChemDiv Inc.	C079-0115			COc1cccc(c1)-c1nnc(NC(=O)c2ccc(cc2)S(=O)(=O)N(CC(C)C)CC(C)C)o1	InChI=1S/C24H30N4O5S/c1-16(2)14-28(15-17(3)4)34(30,31)21-11-9-18(10-12-21)22(29)25-24-27-26-23(33-24)19-7-6-8-20(13-19)32-5/h6-13,16-17H,14-15H2,1-5H3,(H,25,27,29)	BHZUADXFFCJVJD-UHFFFAOYSA-N	486.19369079							120747
2-[(4-Nitrophenyl)methylsulfanyl]-n-(pyridin-3-ylmethylideneamino)acetamide	LSM-32190	BRD-K28140029	804792	InChI=1S/C15H14N4O3S/c20-15(18-17-9-13-2-1-7-16-8-13)11-23-10-12-3-5-14(6-4-12)19(21)22/h1-9H,10-11H2,(H,18,20)	ZDVHIAYYBDHHHZ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(CSCC(=O)NN=Cc2cccnc2)cc1	BroadT	BRD-K28140029	BRD-K28140029-001-07-9	Asinex Ltd.	BAS 01254212			[O-][N+](=O)c1ccc(CSCC(=O)NN=Cc2cccnc2)cc1	InChI=1S/C15H14N4O3S/c20-15(18-17-9-13-2-1-7-16-8-13)11-23-10-12-3-5-14(6-4-12)19(21)22/h1-9H,10-11H2,(H,18,20)	ZDVHIAYYBDHHHZ-UHFFFAOYSA-N	330.078661038							120748
MLS000716662	LSM-32191	BRD-A96183603, SID24809255	2917066	InChI=1S/C20H23NO6/c1-25-19(23)16-11-21(10-15-7-4-8-27-15)12-17(20(24)26-2)18(16)13-5-3-6-14(22)9-13/h3,5-6,9,11-12,15,18,22H,4,7-8,10H2,1-2H3	HJIWXKDTUCXAKG-UHFFFAOYSA-N	COC(=O)C1=CN(CC2CCCO2)C=C(C1c3cccc(O)c3)C(=O)OC	BroadT	BRD-A96183603	BRD-A96183603-001-08-0	Asinex Ltd.	BAS 04379389			COC(=O)C1=CN(CC2CCCO2)C=C(C1c1cccc(O)c1)C(=O)OC	InChI=1S/C20H23NO6/c1-25-19(23)16-11-21(10-15-7-4-8-27-15)12-17(20(24)26-2)18(16)13-5-3-6-14(22)9-13/h3,5-6,9,11-12,15,18,22H,4,7-8,10H2,1-2H3	HJIWXKDTUCXAKG-UHFFFAOYSA-N	373.152537466							120749
BAS 09531330	LSM-32192	2-[(4-Methylphenyl)amino]-4H-pyrido[3,2-e][1,3]thiazin-4-one, SID4255640, BRD-K47084999	973891	InChI=1S/C14H11N3OS/c1-9-4-6-10(7-5-9)16-14-17-12(18)11-3-2-8-15-13(11)19-14/h2-8H,1H3,(H,16,17,18)	UHVSTJKUHPUVGN-UHFFFAOYSA-N	Cc1ccc(NC2=NC(=O)c3cccnc3S2)cc1	BroadT	BRD-K47084999	BRD-K47084999-001-06-4	ChemBridge Corporation	7905944			Cc1ccc(Nc2nc(=O)c3cccnc3s2)cc1	InChI=1S/C14H11N3OS/c1-9-4-6-10(7-5-9)16-14-17-12(18)11-3-2-8-15-13(11)19-14/h2-8H,1H3,(H,16,17,18)	UHVSTJKUHPUVGN-UHFFFAOYSA-N	269.062282692							120750
MLS000099315	LSM-32193	SID4263637, BRD-K76755209	727030	InChI=1S/C17H20N2/c1-2-4-12-17(11-3-1)18-14-9-5-7-13-8-6-10-15(19-17)16(13)14/h5-10,18-19H,1-4,11-12H2	DHXWVWPVLLJSRG-UHFFFAOYSA-N	C1CCCC2(CC1)Nc3cccc4cccc(N2)c34	BroadT	BRD-K76755209	BRD-K76755209-001-05-1	ChemBridge Corporation	6947630			C1CCCC2(CC1)Nc1cccc3cccc(N2)c13	InChI=1S/C17H20N2/c1-2-4-12-17(11-3-1)18-14-9-5-7-13-8-6-10-15(19-17)16(13)14/h5-10,18-19H,1-4,11-12H2	DHXWVWPVLLJSRG-UHFFFAOYSA-N	252.16264866							120751
SMR000207674	LSM-32194	SID17510798, BRD-K18635665	5122547	InChI=1S/C23H15NO7S2/c1-29-14-8-10-15(11-9-14)33(27,28)24(22(25)19-7-4-12-30-19)18-13-20-21(31-23(26)32-20)17-6-3-2-5-16(17)18/h2-13H,1H3	GQMYZFHAYNKEER-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)N(C(=O)c2occc2)c3cc4SC(=O)Oc4c5ccccc35	BroadT	BRD-K18635665	BRD-K18635665-001-06-1	ChemDiv Inc.	6807-0685			COc1ccc(cc1)S(=O)(=O)N(C(=O)c1ccco1)c1cc2sc(=O)oc2c2ccccc12	InChI=1S/C23H15NO7S2/c1-29-14-8-10-15(11-9-14)33(27,28)24(22(25)19-7-4-12-30-19)18-13-20-21(31-23(26)32-20)17-6-3-2-5-16(17)18/h2-13H,1H3	GQMYZFHAYNKEER-UHFFFAOYSA-N	481.02899321							120752
AG-205/12645071	LSM-32195	BRD-K60781525, SID7976410	799292	InChI=1S/C15H16N2O2S/c1-17(2)20(18,19)16-13-7-8-15-12(10-13)9-11-5-3-4-6-14(11)15/h3-8,10,16H,9H2,1-2H3	CDAYLDNAWVABDZ-UHFFFAOYSA-N	CN(C)S(=O)(=O)Nc1ccc2c(Cc3ccccc23)c1	BroadT	BRD-K60781525	BRD-K60781525-001-05-2	ChemBridge Corporation	6882052			CN(C)S(=O)(=O)Nc1ccc-2c(Cc3ccccc-23)c1	InChI=1S/C15H16N2O2S/c1-17(2)20(18,19)16-13-7-8-15-12(10-13)9-11-5-3-4-6-14(11)15/h3-8,10,16H,9H2,1-2H3	CDAYLDNAWVABDZ-UHFFFAOYSA-N	288.093248462							120753
N-(4-Ethoxyphenyl)-2-(hydroxymethyl)benzamide	LSM-32196	BRD-K41307363, SID4249449	3243401	InChI=1S/C16H17NO3/c1-2-20-14-9-7-13(8-10-14)17-16(19)15-6-4-3-5-12(15)11-18/h3-10,18H,2,11H2,1H3,(H,17,19)	ARAJZPPGAUPOAZ-UHFFFAOYSA-N	CCOc1ccc(NC(=O)c2ccccc2CO)cc1	BroadT	BRD-K41307363	BRD-K41307363-001-05-5	ChemDiv Inc.	C430-0055			CCOc1ccc(NC(=O)c2ccccc2CO)cc1	InChI=1S/C16H17NO3/c1-2-20-14-9-7-13(8-10-14)17-16(19)15-6-4-3-5-12(15)11-18/h3-10,18H,2,11H2,1H3,(H,17,19)	ARAJZPPGAUPOAZ-UHFFFAOYSA-N	271.120843414							120754
2-(Diphenylacetyl)-n-ethylhydrazinecarbothioamide	LSM-32197	BRD-K62758843, SID17415238	2168854	InChI=1S/C17H19N3OS/c1-2-18-17(22)20-19-16(21)15(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12,15H,2H2,1H3,(H,19,21)(H2,18,20,22)	QXYXJIFTKRIAAK-UHFFFAOYSA-N	CCN=C(S)NNC(=O)C(c1ccccc1)c2ccccc2	BroadT	BRD-K62758843	BRD-K62758843-001-05-3	ChemBridge Corporation	6104921			CCN=C(S)NNC(=O)C(c1ccccc1)c1ccccc1	InChI=1S/C17H19N3OS/c1-2-18-17(22)20-19-16(21)15(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12,15H,2H2,1H3,(H,19,21)(H2,18,20,22)	QXYXJIFTKRIAAK-UHFFFAOYSA-N	313.124882948							120755
MLS000034120	LSM-32198	BRD-K47881755, SID844843	647177	InChI=1S/C11H12N4O2S/c1-15(9(16)7-17-2)11-14-13-10(18-11)8-5-3-4-6-12-8/h3-6H,7H2,1-2H3	HKWIHROBVWKWMR-UHFFFAOYSA-N	COCC(=O)N(C)c1nnc(s1)c2ccccn2	BroadT	BRD-K47881755	BRD-K47881755-001-05-9	Asinex Ltd.	ASN 09114446			COCC(=O)N(C)c1nnc(s1)-c1ccccn1	InChI=1S/C11H12N4O2S/c1-15(9(16)7-17-2)11-14-13-10(18-11)8-5-3-4-6-12-8/h3-6H,7H2,1-2H3	HKWIHROBVWKWMR-UHFFFAOYSA-N	264.068096354							120756
6-(3,4-Dimethoxy-phenyl)-8-methoxy-1,3-dimethyl-cyclohepta[c]furan-4-one	LSM-32199	BRD-K61924304, SID849596	652095	InChI=1S/C20H20O5/c1-11-19-15(21)8-14(10-18(24-5)20(19)12(2)25-11)13-6-7-16(22-3)17(9-13)23-4/h6-10H,1-5H3	HBCRLHZCIKXVTG-UHFFFAOYSA-N	COC1=CC(=CC(=O)c2c(C)oc(C)c12)c3ccc(OC)c(OC)c3	BroadT	BRD-K61924304	BRD-K61924304-001-05-4	Asinex Ltd.	BAS 03016779			COc1ccc(cc1OC)-c1cc(OC)c2c(C)oc(C)c2c(=O)c1	InChI=1S/C20H20O5/c1-11-19-15(21)8-14(10-18(24-5)20(19)12(2)25-11)13-6-7-16(22-3)17(9-13)23-4/h6-10H,1-5H3	HBCRLHZCIKXVTG-UHFFFAOYSA-N	340.13107374							120757
MLS000534655	LSM-32200	BRD-K34377350, SID14732591, SID50123157	802513	InChI=1S/C14H19N3S/c1-11-7-9-14(10-8-11)15-13(18)17(16-14)12-5-3-2-4-6-12/h2-6,11,16H,7-10H2,1H3,(H,15,18)	DVZJMOAGWCDCSM-UHFFFAOYSA-N	CC1CCC2(CC1)NN(C(=N2)S)c3ccccc3	BroadT	BRD-K34377350	BRD-K34377350-001-07-8	ChemBridge Corporation	6985111			CC1CCC2(CC1)NN(C(S)=N2)c1ccccc1	InChI=1S/C14H19N3S/c1-11-7-9-14(10-8-11)15-13(18)17(16-14)12-5-3-2-4-6-12/h2-6,11,16H,7-10H2,1H3,(H,15,18)	DVZJMOAGWCDCSM-UHFFFAOYSA-N	261.129968328							120758
ST50942044	LSM-32201	BRD-K34858602, SID24791131	1247475	InChI=1S/C14H14FNOS/c1-10-2-7-13(18-10)14(17)16-9-8-11-3-5-12(15)6-4-11/h2-7H,8-9H2,1H3,(H,16,17)	ZFAVQEMLAQFYGJ-UHFFFAOYSA-N	Cc1ccc(s1)C(=O)NCCc2ccc(F)cc2	BroadT	BRD-K34858602	BRD-K34858602-001-05-7	ChemBridge Corporation	7949133			Cc1ccc(s1)C(=O)NCCc1ccc(F)cc1	InChI=1S/C14H14FNOS/c1-10-2-7-13(18-10)14(17)16-9-8-11-3-5-12(15)6-4-11/h2-7H,8-9H2,1H3,(H,16,17)	ZFAVQEMLAQFYGJ-UHFFFAOYSA-N	263.078012968							120759
2-(3,4-Dimethoxyphenyl)-1-(2,4,6-trihydroxyphenyl)ethanone	LSM-32202	BRD-K38713368, SID14740603	804849	InChI=1S/C16H16O6/c1-21-14-4-3-9(6-15(14)22-2)5-11(18)16-12(19)7-10(17)8-13(16)20/h3-4,6-8,17,19-20H,5H2,1-2H3	YRHMQKSNPQNHRN-UHFFFAOYSA-N	COc1ccc(CC(=O)c2c(O)cc(O)cc2O)cc1OC	BroadT	BRD-K38713368	BRD-K38713368-001-11-2	ChemBridge Corporation	7112640			COc1ccc(CC(=O)c2c(O)cc(O)cc2O)cc1OC	InChI=1S/C16H16O6/c1-21-14-4-3-9(6-15(14)22-2)5-11(18)16-12(19)7-10(17)8-13(16)20/h3-4,6-8,17,19-20H,5H2,1-2H3	YRHMQKSNPQNHRN-UHFFFAOYSA-N	304.094688232							120760
MLS000116792	LSM-32203	BRD-K39809702, SID7965310	5307547	InChI=1S/C22H29N3O3S/c1-4-24(20-8-5-7-17(2)15-20)13-6-12-23-29(27,28)21-9-10-22-19(16-21)11-14-25(22)18(3)26/h5,7-10,15-16,23H,4,6,11-14H2,1-3H3	GJTRBEXKWTUVKV-UHFFFAOYSA-N	CCN(CCCNS(=O)(=O)c1ccc2N(CCc2c1)C(=O)C)c3cccc(C)c3	BroadT	BRD-K39809702	BRD-K39809702-001-05-4	ChemDiv Inc.	C324-2845			CCN(CCCNS(=O)(=O)c1ccc2N(CCc2c1)C(C)=O)c1cccc(C)c1	InChI=1S/C22H29N3O3S/c1-4-24(20-8-5-7-17(2)15-20)13-6-12-23-29(27,28)21-9-10-22-19(16-21)11-14-25(22)18(3)26/h5,7-10,15-16,23H,4,6,11-14H2,1-3H3	GJTRBEXKWTUVKV-UHFFFAOYSA-N	415.192962508							120761
MLS000577627	LSM-32204	BRD-K81522725, SID17415412	493265	InChI=1S/C15H13N3O2S/c1-10-2-7-13-14(8-10)17-15(16-13)21-9-11-3-5-12(6-4-11)18(19)20/h2-8H,9H2,1H3,(H,16,17)	RUAWVULWPTYWLK-UHFFFAOYSA-N	Cc1ccc2[nH]c(SCc3ccc(cc3)[N+](=O)[O-])nc2c1	BroadT	BRD-K81522725	BRD-K81522725-001-05-3	ChemBridge Corporation	5358298			Cc1ccc2[nH]c(SCc3ccc(cc3)[N+]([O-])=O)nc2c1	InChI=1S/C15H13N3O2S/c1-10-2-7-13-14(8-10)17-15(16-13)21-9-11-3-5-12(6-4-11)18(19)20/h2-8H,9H2,1H3,(H,16,17)	RUAWVULWPTYWLK-UHFFFAOYSA-N	299.072847376							120762
SMR000095682	LSM-32205	BRD-K11275619, SID24838225, SID7968435	5309404	InChI=1S/C24H22FN5O3S/c1-29-10-2-3-19(29)14-22-27-28-24(30(22)18-7-4-16(25)5-8-18)34-15-23(31)26-17-6-9-20-21(13-17)33-12-11-32-20/h2-10,13H,11-12,14-15H2,1H3,(H,26,31)	XXNSCVDJXOAZKG-UHFFFAOYSA-N	Cn1cccc1Cc2nnc(SCC(=O)Nc3ccc4OCCOc4c3)n2c5ccc(F)cc5	BroadT	BRD-K11275619	BRD-K11275619-001-04-5	ChemDiv Inc.	C677-0264			Cn1cccc1Cc1nnc(SCC(=O)Nc2ccc3OCCOc3c2)n1-c1ccc(F)cc1	InChI=1S/C24H22FN5O3S/c1-29-10-2-3-19(29)14-22-27-28-24(30(22)18-7-4-16(25)5-8-18)34-15-23(31)26-17-6-9-20-21(13-17)33-12-11-32-20/h2-10,13H,11-12,14-15H2,1H3,(H,26,31)	XXNSCVDJXOAZKG-UHFFFAOYSA-N	479.142738504							120763
6-Methyl-3-(3-toluidinomethylene)-2H-pyran-2,4(3H)-dione	LSM-32206	BRD-K40220562	6832483	InChI=1S/C14H13NO3/c1-9-4-3-5-11(6-9)15-8-12-13(16)7-10(2)18-14(12)17/h3-8,16H,1-2H3	PHWCGUDNVRARSB-UHFFFAOYSA-N	CC1=CC(=C(C=Nc2cccc(C)c2)C(=O)O1)O	BroadT	BRD-K40220562	BRD-K40220562-001-05-0	Key Organics Ltd.	12L-721			Cc1cccc(c1)N=Cc1c(O)cc(C)oc1=O	InChI=1S/C14H13NO3/c1-9-4-3-5-11(6-9)15-8-12-13(16)7-10(2)18-14(12)17/h3-8,16H,1-2H3	PHWCGUDNVRARSB-UHFFFAOYSA-N	243.089543286							
SMR000066992	LSM-32207	BRD-K50815029, SID3715010	2118125	InChI=1S/C13H10N4O5S/c18-13(19)8-2-1-3-9(6-8)15-23(21,22)10-4-5-11-12(7-10)17(20)16-14-11/h1-7,15,20H,(H,18,19)	HRMOAPIJRHILKR-UHFFFAOYSA-N	OC(=O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	BroadT	BRD-K50815029	BRD-K50815029-001-05-1	Enamine Ltd.	T5246255			OC(=O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	InChI=1S/C13H10N4O5S/c18-13(19)8-2-1-3-9(6-8)15-23(21,22)10-4-5-11-12(7-10)17(20)16-14-11/h1-7,15,20H,(H,18,19)	HRMOAPIJRHILKR-UHFFFAOYSA-N	334.03719015							120765
MLS000948280	LSM-6563	BRD-K19196783	1250001	InChI=1S/C17H18BrN9O2/c18-12-6-2-1-5-11(12)9-20-22-17(28)14-13(10-26-7-3-4-8-26)27(25-21-14)16-15(19)23-29-24-16/h1-2,5-6,9H,3-4,7-8,10H2,(H2,19,23)(H,22,28)	AFJWJNWNXFMXPZ-UHFFFAOYSA-N	Nc1nonc1n2nnc(C(=O)NN=Cc3ccccc3Br)c2CN4CCCC4	BroadT	BRD-K19196783	BRD-K19196783-001-07-8	ChemDiv Inc.	8008-2798			Nc1nonc1-n1nnc(C(=O)NN=Cc2ccccc2Br)c1CN1CCCC1	InChI=1S/C17H18BrN9O2/c18-12-6-2-1-5-11(12)9-20-22-17(28)14-13(10-26-7-3-4-8-26)27(25-21-14)16-15(19)23-29-24-16/h1-2,5-6,9H,3-4,7-8,10H2,(H2,19,23)(H,22,28)	AFJWJNWNXFMXPZ-UHFFFAOYSA-N	459.076683506							95243
MLS000034831	LSM-32208	BRD-K46298577, SID850295	652810	InChI=1S/C14H14N4O3/c1-20-8-9-7-12(19)18-13(16-17-14(18)15-9)10-5-3-4-6-11(10)21-2/h3-7,19H,8H2,1-2H3	HERIVCXLGXXCBZ-UHFFFAOYSA-N	COCc1cc(O)n2c(nnc2n1)c3ccccc3OC	BroadT	BRD-K46298577	BRD-K46298577-001-05-3	Asinex Ltd.	BAS 02829633			COCc1cc(O)n2c(nnc2n1)-c1ccccc1OC	InChI=1S/C14H14N4O3/c1-20-8-9-7-12(19)18-13(16-17-14(18)15-9)10-5-3-4-6-11(10)21-2/h3-7,19H,8H2,1-2H3	HERIVCXLGXXCBZ-UHFFFAOYSA-N	286.106590348							
MLS000056267	LSM-32209	BRD-K40776502, SID3717238	2546578	InChI=1S/C11H7NS3/c1-3-9(13-5-1)8-7-15-11(12-8)10-4-2-6-14-10/h1-7H	QZVGIRSOKOZOLV-UHFFFAOYSA-N	c1csc(c1)c2csc(n2)c3cccs3	BroadT	BRD-K40776502	BRD-K40776502-001-05-4	Enamine Ltd.	T5339616			c1csc(c1)-c1csc(n1)-c1cccs1	InChI=1S/C11H7NS3/c1-3-9(13-5-1)8-7-15-11(12-8)10-4-2-6-14-10/h1-7H	QZVGIRSOKOZOLV-UHFFFAOYSA-N	248.974061304							120767
MLS000561692	LSM-32210	BRD-A00776891, SID17508637, SID87218744	3091265	InChI=1S/C17H14Cl5N3O2S/c18-11-7-4-8-12(19)13(11)23-15(28)24-14(17(20,21)22)25-16(26)27-9-10-5-2-1-3-6-10/h1-8,14H,9H2,(H,25,26)(H2,23,24,28)	RETLJHJSLJBNPL-UHFFFAOYSA-N	Clc1cccc(Cl)c1NC(=S)NC(NC(=O)OCc2ccccc2)C(Cl)(Cl)Cl	BroadT	BRD-A00776891	BRD-A00776891-001-07-9	Asinex Ltd.	BAS 00113825			Clc1cccc(Cl)c1NC(=S)NC(NC(=O)OCc1ccccc1)C(Cl)(Cl)Cl	InChI=1S/C17H14Cl5N3O2S/c18-11-7-4-8-12(19)13(11)23-15(28)24-14(17(20,21)22)25-16(26)27-9-10-5-2-1-3-6-10/h1-8,14H,9H2,(H,25,26)(H2,23,24,28)	RETLJHJSLJBNPL-UHFFFAOYSA-N	498.924935958							120768
SMR000081428	LSM-32211	BRD-K39029546, SID4263364	751371	InChI=1S/C17H15NO3S2/c1-2-22-17-16(23(19,20)14-11-7-4-8-12-14)18-15(21-17)13-9-5-3-6-10-13/h3-12H,2H2,1H3	OLQJVXFSFSZYOU-UHFFFAOYSA-N	CCSc1oc(nc1S(=O)(=O)c2ccccc2)c3ccccc3	BroadT	BRD-K39029546	BRD-K39029546-001-05-9	ChemBridge Corporation	7959763			CCSc1oc(nc1S(=O)(=O)c1ccccc1)-c1ccccc1	InChI=1S/C17H15NO3S2/c1-2-22-17-16(23(19,20)14-11-7-4-8-12-14)18-15(21-17)13-9-5-3-6-10-13/h3-12H,2H2,1H3	OLQJVXFSFSZYOU-UHFFFAOYSA-N	345.04933473							120769
CID_980118	LSM-44390	BRD-A52377240	91897719	InChI=1S/C21H25NO4/c1-5-25-20(23)18-14(3)22-15(4)19(21(24)26-6-2)17(18)13-12-16-10-8-7-9-11-16/h7-13,17-18H,5-6H2,1-4H3/b13-12+	UJPAOKAXEKZRNI-OUKQBFOZSA-N	CCOC(=O)C1C(\C=C\c2ccccc2)C(=C(C)N=C1C)C(=O)OCC	BroadT	BRD-A52377240	BRD-A52377240-001-05-5	ChemBridge Corporation	5862387			CCOC(=O)C1C(\C=C\c2ccccc2)C(C(=O)OCC)=C(C)N=C1C	InChI=1S/C21H25NO4/c1-5-25-20(23)18-14(3)22-15(4)19(21(24)26-6-2)17(18)13-12-16-10-8-7-9-11-16/h7-13,17-18H,5-6H2,1-4H3/b13-12+	UJPAOKAXEKZRNI-OUKQBFOZSA-N	355.17835829							
N-(3-Ethylphenyl)-2-phenoxyacetamide	LSM-32213	BRD-K13788250, SID14730943	898185	InChI=1S/C16H17NO2/c1-2-13-7-6-8-14(11-13)17-16(18)12-19-15-9-4-3-5-10-15/h3-11H,2,12H2,1H3,(H,17,18)	CVEIFNMXAKDUFP-UHFFFAOYSA-N	CCc1cccc(NC(=O)COc2ccccc2)c1	BroadT	BRD-K13788250	BRD-K13788250-001-05-6	ChemBridge Corporation	7269014			CCc1cccc(NC(=O)COc2ccccc2)c1	InChI=1S/C16H17NO2/c1-2-13-7-6-8-14(11-13)17-16(18)12-19-15-9-4-3-5-10-15/h3-11H,2,12H2,1H3,(H,17,18)	CVEIFNMXAKDUFP-UHFFFAOYSA-N	255.125928794							120771
352548-58-4	LSM-32214	BRD-K54198678, SID7973626	755475	InChI=1S/C17H14N2O3/c1-11(20)19-10-15(12-6-3-5-9-16(12)19)18-14-8-4-2-7-13(14)17(21)22/h2-10,18H,1H3,(H,21,22)	CQYUJQLWWXSHEK-UHFFFAOYSA-N	CC(=O)n1cc(Nc2ccccc2C(=O)O)c3ccccc13	BroadT	BRD-K54198678	BRD-K54198678-001-05-2	ChemBridge Corporation	6045051			CC(=O)n1cc(Nc2ccccc2C(O)=O)c2ccccc12	InChI=1S/C17H14N2O3/c1-11(20)19-10-15(12-6-3-5-9-16(12)19)18-14-8-4-2-7-13(14)17(21)22/h2-10,18H,1H3,(H,21,22)	CQYUJQLWWXSHEK-UHFFFAOYSA-N	294.100442328							120772
SMR000172134	LSM-32215	BRD-K91944762, SID17507033	1136138	InChI=1S/C18H16ClN3O3S2/c1-12-6-8-14(9-7-12)27(24,25)22-16-10-17(23)21-18(20-16)26-11-13-4-2-3-5-15(13)19/h2-10H,11H2,1H3,(H2,20,21,22,23)	FFPQHAFSNOVCBM-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)Nc2cc(O)nc(SCc3ccccc3Cl)n2	BroadT	BRD-K91944762	BRD-K91944762-001-05-1	Asinex Ltd.	BAS 02749230			Cc1ccc(cc1)S(=O)(=O)Nc1cc(O)nc(SCc2ccccc2Cl)n1	InChI=1S/C18H16ClN3O3S2/c1-12-6-8-14(9-7-12)27(24,25)22-16-10-17(23)21-18(20-16)26-11-13-4-2-3-5-15(13)19/h2-10H,11H2,1H3,(H2,20,21,22,23)	FFPQHAFSNOVCBM-UHFFFAOYSA-N	421.032160492							120773
STK846380	LSM-32216	BRD-K90358614, SID860970	662245	InChI=1S/C22H18N2O3/c1-15-9-10-16-13-17(21(25)23-19(16)12-15)14-24(18-6-3-2-4-7-18)22(26)20-8-5-11-27-20/h2-13H,14H2,1H3,(H,23,25)	GVLPPLYACLUDJH-UHFFFAOYSA-N	Cc1ccc2cc(CN(C(=O)c3occc3)c4ccccc4)c(O)nc2c1	BroadT	BRD-K90358614	BRD-K90358614-001-05-5	InterBioScreen Ltd.	STOCK3S-98889			Cc1ccc2cc(CN(C(=O)c3ccco3)c3ccccc3)c(O)nc2c1	InChI=1S/C22H18N2O3/c1-15-9-10-16-13-17(21(25)23-19(16)12-15)14-24(18-6-3-2-4-7-18)22(26)20-8-5-11-27-20/h2-13H,14H2,1H3,(H,23,25)	GVLPPLYACLUDJH-UHFFFAOYSA-N	358.131742456							120774
SMR000042938	LSM-32217	BRD-K86774687, SID860953	662232	InChI=1S/C17H24N4O2S/c1-11(2)23-14(22)10-24-16-20-19-15(21(16)18)12-6-8-13(9-7-12)17(3,4)5/h6-9,11H,10,18H2,1-5H3	NERMGOLFRVSVAQ-UHFFFAOYSA-N	CC(C)OC(=O)CSc1nnc(c2ccc(cc2)C(C)(C)C)n1N	BroadT	BRD-K86774687	BRD-K86774687-001-05-1	InterBioScreen Ltd.	STOCK3S-99175			CC(C)OC(=O)CSc1nnc(-c2ccc(cc2)C(C)(C)C)n1N	InChI=1S/C17H24N4O2S/c1-11(2)23-14(22)10-24-16-20-19-15(21(16)18)12-6-8-13(9-7-12)17(3,4)5/h6-9,11H,10,18H2,1-5H3	NERMGOLFRVSVAQ-UHFFFAOYSA-N	348.161996738							120775
7-Diethylaminocoumarin	LSM-32218	BRD-K80851151, SID24805056	88598	InChI=1S/C13H15NO2/c1-3-14(4-2)11-7-5-10-6-8-13(15)16-12(10)9-11/h5-9H,3-4H2,1-2H3	QXAMGWKESXGGNV-UHFFFAOYSA-N	CCN(CC)c1ccc2C=CC(=O)Oc2c1	BroadT	BRD-K80851151	BRD-K80851151-001-06-8	Asinex Ltd.	BAS 00212687			CCN(CC)c1ccc2ccc(=O)oc2c1	InChI=1S/C13H15NO2/c1-3-14(4-2)11-7-5-10-6-8-13(15)16-12(10)9-11/h5-9H,3-4H2,1-2H3	QXAMGWKESXGGNV-UHFFFAOYSA-N	217.11027873							120776
2-Chloro-n-[(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]benzamide	LSM-32219	BRD-K03791970	4579255	InChI=1S/C21H19ClN4O2S/c22-17-9-5-4-8-16(17)20(27)25-23-14-18-19(15-6-2-1-3-7-15)24-21(29-18)26-10-12-28-13-11-26/h1-9,14H,10-13H2,(H,25,27)	WEPAXKKVVZDQLR-UHFFFAOYSA-N	Clc1ccccc1C(=O)NN=Cc2sc(nc2c3ccccc3)N4CCOCC4	BroadT	BRD-K03791970	BRD-K03791970-001-06-9	Enamine Ltd.	T0503-4029			Clc1ccccc1C(=O)NN=Cc1sc(nc1-c1ccccc1)N1CCOCC1	InChI=1S/C21H19ClN4O2S/c22-17-9-5-4-8-16(17)20(27)25-23-14-18-19(15-6-2-1-3-7-15)24-21(29-18)26-10-12-28-13-11-26/h1-9,14H,10-13H2,(H,25,27)	WEPAXKKVVZDQLR-UHFFFAOYSA-N	426.091724288							120777
STK055996	LSM-32220	BRD-K30799912, SID17415055	2176759	InChI=1S/C25H21ClO6S/c26-16-9-13-18(14-10-16)33(29,30)32-17-11-7-15(8-12-17)23-24-19(27)3-1-5-21(24)31-22-6-2-4-20(28)25(22)23/h7-14,23H,1-6H2	MLUHBNBLLWQMDJ-UHFFFAOYSA-N	Clc1ccc(cc1)S(=O)(=O)Oc2ccc(cc2)C3C4=C(CCCC4=O)OC5=C3C(=O)CCC5	BroadT	BRD-K30799912	BRD-K30799912-001-06-0	ChemBridge Corporation	7174593			Clc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2	InChI=1S/C25H21ClO6S/c26-16-9-13-18(14-10-16)33(29,30)32-17-11-7-15(8-12-17)23-24-19(27)3-1-5-21(24)31-22-6-2-4-20(28)25(22)23/h7-14,23H,1-6H2	MLUHBNBLLWQMDJ-UHFFFAOYSA-N	484.074736792							120778
F1142-1243	LSM-32221	BRD-K20061970, SID17516650	675433	InChI=1S/C20H25FN2O/c1-14-8-10-22(11-9-14)13-20(24)19-12-15(2)23(16(19)3)18-6-4-17(21)5-7-18/h4-7,12,14H,8-11,13H2,1-3H3	JZCVNTHDAGQJFQ-UHFFFAOYSA-N	CC1CCN(CC(=O)c2cc(C)n(c2C)c3ccc(F)cc3)CC1	BroadT	BRD-K20061970	BRD-K20061970-001-05-8	Enamine Ltd.	T0502-1666			CC1CCN(CC(=O)c2cc(C)n(c2C)-c2ccc(F)cc2)CC1	InChI=1S/C20H25FN2O/c1-14-8-10-22(11-9-14)13-20(24)19-12-15(2)23(16(19)3)18-6-4-17(21)5-7-18/h4-7,12,14H,8-11,13H2,1-3H3	JZCVNTHDAGQJFQ-UHFFFAOYSA-N	328.19509164							120779
AC1NWYB7	LSM-44391	BRD-A16119053, SID24795343	5738911	InChI=1S/C21H18F2N2S/c22-17-10-3-1-6-13(17)12-14-7-5-9-16-19(14)24-21(26)25-20(16)15-8-2-4-11-18(15)23/h1-4,6,8,10-12,20H,5,7,9H2,(H2,24,25,26)/b14-12+	YOEKQKPKLQYUDG-WYMLVPIESA-N	Fc1ccccc1\C=C\2/CCCC3=C2N=C(S)NC3c4ccccc4F	BroadT	BRD-A16119053	BRD-A16119053-001-05-2	ChemBridge Corporation	7702337			Fc1ccccc1\C=C1CCCC2=C/1N=C(S)NC2c1ccccc1F	InChI=1S/C21H18F2N2S/c22-17-10-3-1-6-13(17)12-14-7-5-9-16-19(14)24-21(26)25-20(16)15-8-2-4-11-18(15)23/h1-4,6,8,10-12,20H,5,7,9H2,(H2,24,25,26)/b14-12+	YOEKQKPKLQYUDG-WYMLVPIESA-N	368.115875686							
SMR000129650	LSM-32223	BRD-K88478877, SID14738134, SID24273820	4303657	InChI=1S/C22H25N3O3S/c1-15-7-10-18(13-16(15)2)23-20(26)14-29-22-25-24-21(28-22)6-4-5-17-8-11-19(27-3)12-9-17/h7-13H,4-6,14H2,1-3H3,(H,23,26)	PKJYYOGRHWGJBE-UHFFFAOYSA-N	COc1ccc(CCCc2oc(SCC(=O)Nc3ccc(C)c(C)c3)nn2)cc1	BroadT	BRD-K88478877	BRD-K88478877-001-05-7	ChemDiv Inc.	4921-0127			COc1ccc(CCCc2nnc(SCC(=O)Nc3ccc(C)c(C)c3)o2)cc1	InChI=1S/C22H25N3O3S/c1-15-7-10-18(13-16(15)2)23-20(26)14-29-22-25-24-21(28-22)6-4-5-17-8-11-19(27-3)12-9-17/h7-13H,4-6,14H2,1-3H3,(H,23,26)	PKJYYOGRHWGJBE-UHFFFAOYSA-N	411.16166238							120781
SMR000093030	LSM-32224	BRD-K39227064, SID7968907	3521535	InChI=1S/C17H17N5O4S2/c1-11-12(2)21-26-16(11)22-28(24,25)14-6-4-13(5-7-14)20-15(23)10-27-17-18-8-3-9-19-17/h3-9,22H,10H2,1-2H3,(H,20,23)	ITWOKBFSQVWDTA-UHFFFAOYSA-N	Cc1noc(NS(=O)(=O)c2ccc(NC(=O)CSc3ncccn3)cc2)c1C	BroadT	BRD-K39227064	BRD-K39227064-001-04-4	ChemDiv Inc.	8015-2225			Cc1noc(NS(=O)(=O)c2ccc(NC(=O)CSc3ncccn3)cc2)c1C	InChI=1S/C17H17N5O4S2/c1-11-12(2)21-26-16(11)22-28(24,25)14-6-4-13(5-7-14)20-15(23)10-27-17-18-8-3-9-19-17/h3-9,22H,10H2,1-2H3,(H,20,23)	ITWOKBFSQVWDTA-UHFFFAOYSA-N	419.072195454							120782
GNF-PF-1872	LSM-32225	BRD-K92794990, GNF-PF-1872	3245435	InChI=1S/C15H22N2O2/c18-15(16-11-7-3-1-4-8-11)14-12-9-5-2-6-10-13(12)19-17-14/h11H,1-10H2,(H,16,18)	BHOZEJHIADUIMT-UHFFFAOYSA-N	O=C(NC1CCCCC1)c2noc3CCCCCc23	BroadT	BRD-K92794990	BRD-K92794990-001-06-1	ChemDiv Inc.	C226-3431			O=C(NC1CCCCC1)c1noc2CCCCCc12	InChI=1S/C15H22N2O2/c18-15(16-11-7-3-1-4-8-11)14-12-9-5-2-6-10-13(12)19-17-14/h11H,1-10H2,(H,16,18)	BHOZEJHIADUIMT-UHFFFAOYSA-N	262.168127964							120783
AJ-292/37229016	LSM-32226	BRD-K21036759, SID14724516	668741	InChI=1S/C16H21N3OS/c1-12-6-5-9-14(10-12)20-11-15-17-18-16(21)19(15)13-7-3-2-4-8-13/h5-6,9-10,13H,2-4,7-8,11H2,1H3,(H,18,21)	GKTJCTAQGYUVBZ-UHFFFAOYSA-N	Cc1cccc(OCc2nnc(S)n2C3CCCCC3)c1	BroadT	BRD-K21036759	BRD-K21036759-001-05-6	Asinex Ltd.	BAS 00941781			Cc1cccc(OCc2nnc(S)n2C2CCCCC2)c1	InChI=1S/C16H21N3OS/c1-12-6-5-9-14(10-12)20-11-15-17-18-16(21)19(15)13-7-3-2-4-8-13/h5-6,9-10,13H,2-4,7-8,11H2,1H3,(H,18,21)	GKTJCTAQGYUVBZ-UHFFFAOYSA-N	303.140533012							120784
ZINC00845043	LSM-32227	BRD-K77177732, SID24801237	1111030	InChI=1S/C16H13F3N4O2S/c17-16(18,19)13-8-11(12-2-1-7-26-12)21-14-10(9-20-23(13)14)15(24)22-3-5-25-6-4-22/h1-2,7-9H,3-6H2	PWJHGUSMJFXEKT-UHFFFAOYSA-N	FC(F)(F)c1cc(nc2c(cnn12)C(=O)N3CCOCC3)c4cccs4	BroadT	BRD-K77177732	BRD-K77177732-001-05-3	Asinex Ltd.	BAS 00923974			FC(F)(F)c1cc(nc2c(cnn12)C(=O)N1CCOCC1)-c1cccs1	InChI=1S/C16H13F3N4O2S/c17-16(18,19)13-8-11(12-2-1-7-26-12)21-14-10(9-20-23(13)14)15(24)22-3-5-25-6-4-22/h1-2,7-9H,3-6H2	PWJHGUSMJFXEKT-UHFFFAOYSA-N	382.071130986							120785
ST4018142	LSM-44392	BRD-K67478255, SID24785507	690307	InChI=1S/C16H14N2O4/c1-22-15-4-2-3-13(11-15)17-16(19)10-7-12-5-8-14(9-6-12)18(20)21/h2-11H,1H3,(H,17,19)/b10-7+	GCUQCANQGRIXCD-JXMROGBWSA-N	COc1cccc(NC(=O)\C=C\c2ccc(cc2)[N+](=O)[O-])c1	BroadT	BRD-K67478255	BRD-K67478255-001-05-4	ChemDiv Inc.	8005-0863			COc1cccc(NC(=O)\C=C\c2ccc(cc2)[N+]([O-])=O)c1	InChI=1S/C16H14N2O4/c1-22-15-4-2-3-13(11-15)17-16(19)10-7-12-5-8-14(9-6-12)18(20)21/h2-11H,1H3,(H,17,19)/b10-7+	GCUQCANQGRIXCD-JXMROGBWSA-N	298.095356948							
AC1NIGRZ	LSM-32229	BRD-K96817767	4830841	InChI=1S/C20H19N3O5S/c1-14(22-23-17-8-4-16(5-9-17)20(24)25)15-6-10-19(11-7-15)29(26,27)21-13-18-3-2-12-28-18/h2-12,21,23H,13H2,1H3,(H,24,25)	ZUPDYIPPXNCFBE-UHFFFAOYSA-N	CC(=NNc1ccc(cc1)C(=O)O)c2ccc(cc2)S(=O)(=O)NCc3occc3	BroadT	BRD-K96817767	BRD-K96817767-001-05-9	Enamine Ltd.	T5290245			CC(=NNc1ccc(cc1)C(O)=O)c1ccc(cc1)S(=O)(=O)NCc1ccco1	InChI=1S/C20H19N3O5S/c1-14(22-23-17-8-4-16(5-9-17)20(24)25)15-6-10-19(11-7-15)29(26,27)21-13-18-3-2-12-28-18/h2-12,21,23H,13H2,1H3,(H,24,25)	ZUPDYIPPXNCFBE-UHFFFAOYSA-N	413.104541428							120787
3-Cyano-7-(diethylamino)coumarin	LSM-32230	BRD-K22069962, SID24790280	688937	InChI=1S/C14H14N2O2/c1-3-16(4-2)12-6-5-10-7-11(9-15)14(17)18-13(10)8-12/h5-8H,3-4H2,1-2H3	LOUYEVRVQGFIFB-UHFFFAOYSA-N	CCN(CC)c1ccc2C=C(C#N)C(=O)Oc2c1	BroadT	BRD-K22069962	BRD-K22069962-001-06-7	Asinex Ltd.	BAS 00231845			CCN(CC)c1ccc2cc(C#N)c(=O)oc2c1	InChI=1S/C14H14N2O2/c1-3-16(4-2)12-6-5-10-7-11(9-15)14(17)18-13(10)8-12/h5-8H,3-4H2,1-2H3	LOUYEVRVQGFIFB-UHFFFAOYSA-N	242.105527708							120788
4-Phenyl-5-(thien-2-ylmethyl)-4H-1,2,4-triazole-3-thiol	LSM-32231	BRD-K98089885, SID17408887	963092	InChI=1S/C13H11N3S2/c17-13-15-14-12(9-11-7-4-8-18-11)16(13)10-5-2-1-3-6-10/h1-8H,9H2,(H,15,17)	SKHIDXWELBGNBE-UHFFFAOYSA-N	Sc1nnc(Cc2cccs2)n1c3ccccc3	BroadT	BRD-K98089885	BRD-K98089885-001-05-0	Asinex Ltd.	BAS 07323719			Sc1nnc(Cc2cccs2)n1-c1ccccc1	InChI=1S/C13H11N3S2/c17-13-15-14-12(9-11-7-4-8-18-11)16(13)10-5-2-1-3-6-10/h1-8H,9H2,(H,15,17)	SKHIDXWELBGNBE-UHFFFAOYSA-N	273.039438762							120789
ASN 08223879	LSM-32232	BRD-K06830450, SID848313	650749	InChI=1S/C20H22N2O3S/c1-3-25-20(24)17-12-18-16(11-14(2)26-18)22(17)13-19(23)21-10-9-15-7-5-4-6-8-15/h4-8,11-12H,3,9-10,13H2,1-2H3,(H,21,23)	LHIUGLBENAPLCU-UHFFFAOYSA-N	CCOC(=O)c1cc2sc(C)cc2n1CC(=O)NCCc3ccccc3	BroadT	BRD-K06830450	BRD-K06830450-001-05-3	Asinex Ltd.	ASN 08223879			CCOC(=O)c1cc2sc(C)cc2n1CC(=O)NCCc1ccccc1	InChI=1S/C20H22N2O3S/c1-3-25-20(24)17-12-18-16(11-14(2)26-18)22(17)13-19(23)21-10-9-15-7-5-4-6-8-15/h4-8,11-12H,3,9-10,13H2,1-2H3,(H,21,23)	LHIUGLBENAPLCU-UHFFFAOYSA-N	370.135113274							120790
MLS000767568	LSM-44393	SID26666367, BRD-A96537953	16411900	InChI=1S/C16H15NO2S2/c1-3-17-15(18)14(21-16(17)20)9-12-8-11-6-4-5-7-13(11)19-10(12)2/h4-10H,3H2,1-2H3/b14-9-	AAPHNFJLVIIBFG-ZROIWOOFSA-N	CCN1C(=S)S\C(=C/C2=Cc3ccccc3OC2C)\C1=O	BroadT	BRD-A96537953	BRD-A96537953-001-04-2	InterBioScreen Ltd.	STOCK2S-76060			CCN1C(=S)S\C(=C/C2=Cc3ccccc3OC2C)C1=O	InChI=1S/C16H15NO2S2/c1-3-17-15(18)14(21-16(17)20)9-12-8-11-6-4-5-7-13(11)19-10(12)2/h4-10H,3H2,1-2H3/b14-9-	AAPHNFJLVIIBFG-ZROIWOOFSA-N	317.05442011							
MLS000734798	LSM-32234	BRD-A61778798, SID24786144	16188951	InChI=1S/C25H22N6O/c1-30-13-6-10-22(30)20-15-21(29-28-20)25(32)31-14-11-17-16-7-2-3-8-18(16)27-23(17)24(31)19-9-4-5-12-26-19/h2-10,12-13,15,24,27H,11,14H2,1H3,(H,28,29)	SFBMMSWLODLMIY-UHFFFAOYSA-N	Cn1cccc1c2cc([nH]n2)C(=O)N3CCc4c([nH]c5ccccc45)C3c6ccccn6	BroadT	BRD-A61778798	BRD-A61778798-001-06-7	ChemBridge Corporation	92948969			Cn1cccc1-c1cc([nH]n1)C(=O)N1CCc2c([nH]c3ccccc23)C1c1ccccn1	InChI=1S/C25H22N6O/c1-30-13-6-10-22(30)20-15-21(29-28-20)25(32)31-14-11-17-16-7-2-3-8-18(16)27-23(17)24(31)19-9-4-5-12-26-19/h2-10,12-13,15,24,27H,11,14H2,1H3,(H,28,29)	SFBMMSWLODLMIY-UHFFFAOYSA-N	422.185509384							120792
MLS000882821	LSM-32235	BRD-K87929769, SID26732222	16060503	InChI=1S/C30H31FN2O/c1-30-18-8-7-11-26(30)28(33(29(30)34)20-21-9-5-4-6-10-21)23-14-17-27(31)25(19-23)22-12-15-24(16-13-22)32(2)3/h4-7,9-17,19,26,28H,8,18,20H2,1-3H3/t26-,28-,30+/m0/s1	BRJJFXGRPIFTKK-BTIIJPOSSA-N	CN(C)c1ccc(cc1)c2cc(ccc2F)[C@H]3[C@@H]4C=CCC[C@@]4(C)C(=O)N3Cc5ccccc5	BroadT	BRD-K87929769	BRD-K87929769-001-07-7	University of Kansas CMLD	KUC101273N			CN(C)c1ccc(cc1)-c1cc(ccc1F)[C@H]1[C@@H]2C=CCC[C@@]2(C)C(=O)N1Cc1ccccc1	InChI=1S/C30H31FN2O/c1-30-18-8-7-11-26(30)28(33(29(30)34)20-21-9-5-4-6-10-21)23-14-17-27(31)25(19-23)22-12-15-24(16-13-22)32(2)3/h4-7,9-17,19,26,28H,8,18,20H2,1-3H3/t26-,28-,30+/m0/s1	BRJJFXGRPIFTKK-BTIIJPOSSA-N	454.242041832							
MLS000703596	LSM-32236	BRD-K62226454, SID24786888	3138363	InChI=1S/C15H12N4O5S/c20-12-8-4-2-6-10(12)14(22)17-18-15(25)16-13(21)9-5-1-3-7-11(9)19(23)24/h1-8,20H,(H,17,22)(H2,16,18,21,25)	DZZXFXVYNFXIQD-UHFFFAOYSA-N	Oc1ccccc1C(=O)NNC(=S)NC(=O)c2ccccc2[N+](=O)[O-]	BroadT	BRD-K62226454	BRD-K62226454-001-07-7	Asinex Ltd.	BAS 02136453			Oc1ccccc1C(=O)NNC(=S)NC(=O)c1ccccc1[N+]([O-])=O	InChI=1S/C15H12N4O5S/c20-12-8-4-2-6-10(12)14(22)17-18-15(25)16-13(21)9-5-1-3-7-11(9)19(23)24/h1-8,20H,(H,17,22)(H2,16,18,21,25)	DZZXFXVYNFXIQD-UHFFFAOYSA-N	360.052840214							120793
SMR000092865	LSM-32237	BRD-K90284572, SID7965441	1262256	InChI=1S/C20H26N2O4S/c1-15-6-5-7-16(2)20(15)21-10-12-22(13-11-21)27(23,24)17-8-9-18(25-3)19(14-17)26-4/h5-9,14H,10-13H2,1-4H3	KLVSKFLMGKPHDM-UHFFFAOYSA-N	COc1ccc(cc1OC)S(=O)(=O)N2CCN(CC2)c3c(C)cccc3C	BroadT	BRD-K90284572	BRD-K90284572-001-04-6	ChemDiv Inc.	8013-6580			COc1ccc(cc1OC)S(=O)(=O)N1CCN(CC1)c1c(C)cccc1C	InChI=1S/C20H26N2O4S/c1-15-6-5-7-16(2)20(15)21-10-12-22(13-11-21)27(23,24)17-8-9-18(25-3)19(14-17)26-4/h5-9,14H,10-13H2,1-4H3	KLVSKFLMGKPHDM-UHFFFAOYSA-N	390.161328022							120794
ZINC00500668	LSM-32238	BRD-K35098144, SID14742201	915136	InChI=1S/C11H6Cl2N2/c12-7-5-9-10(6-8(7)13)15-4-2-1-3-11(15)14-9/h1-6H	KGOQVKQJXJLTDN-UHFFFAOYSA-N	Clc1cc2nc3ccccn3c2cc1Cl	BroadT	BRD-K35098144	BRD-K35098144-001-05-4	InterBioScreen Ltd.	STOCK1S-58667			Clc1cc2nc3ccccn3c2cc1Cl	InChI=1S/C11H6Cl2N2/c12-7-5-9-10(6-8(7)13)15-4-2-1-3-11(15)14-9/h1-6H	KGOQVKQJXJLTDN-UHFFFAOYSA-N	235.990803632							120795
AC1NLONT	LSM-32239	BRD-K00914921, SID17510131	4986490	InChI=1S/C27H22N2O4S/c1-33-20-13-11-19(12-14-20)28(27(32)23-10-4-17-34-23)15-5-16-29-25(30)21-8-2-6-18-7-3-9-22(24(18)21)26(29)31/h2-4,6-14,17H,5,15-16H2,1H3	UCXWAMKRFSPWCE-UHFFFAOYSA-N	COc1ccc(cc1)N(CCCN2C(=O)c3cccc4cccc(C2=O)c34)C(=O)c5cccs5	BroadT	BRD-K00914921	BRD-K00914921-001-05-2	ChemDiv Inc.	0423-0504			COc1ccc(cc1)N(CCCN1C(=O)c2cccc3cccc(C1=O)c23)C(=O)c1cccs1	InChI=1S/C27H22N2O4S/c1-33-20-13-11-19(12-14-20)28(27(32)23-10-4-17-34-23)15-5-16-29-25(30)21-8-2-6-18-7-3-9-22(24(18)21)26(29)31/h2-4,6-14,17H,5,15-16H2,1H3	UCXWAMKRFSPWCE-UHFFFAOYSA-N	470.130027894							120796
AC1MDSGA	LSM-32240	BRD-K30013451	2842163	InChI=1S/C11H8ClN5O2/c12-10-11(14-6-5-13-10)16-15-7-8-3-1-2-4-9(8)17(18)19/h1-7H,(H,14,16)	SKFXGBGSVNETSS-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1C=NNc2nccnc2Cl	BroadT	BRD-K30013451	BRD-K30013451-001-05-5	ChemBridge Corporation	5339195			[O-][N+](=O)c1ccccc1C=NNc1nccnc1Cl	InChI=1S/C11H8ClN5O2/c12-10-11(14-6-5-13-10)16-15-7-8-3-1-2-4-9(8)17(18)19/h1-7H,(H,14,16)	SKFXGBGSVNETSS-UHFFFAOYSA-N	277.036652256							120797
MLS000082430	LSM-2601	BRD-K27484191, SID862064, SID87218759	663290	InChI=1S/C19H15BrN4OS/c20-15-8-6-14(7-9-15)13-26-19-23-22-18(17-5-1-2-10-21-17)24(19)12-16-4-3-11-25-16/h1-11H,12-13H2	LUJCSBDPIKBOMN-UHFFFAOYSA-N	Brc1ccc(CSc2nnc(c3ccccn3)n2Cc4occc4)cc1	BroadT	BRD-K27484191	BRD-K27484191-001-06-6	InterBioScreen Ltd.	STOCK4S-29600			Brc1ccc(CSc2nnc(-c3ccccn3)n2Cc2ccco2)cc1	InChI=1S/C19H15BrN4OS/c20-15-8-6-14(7-9-15)13-26-19-23-22-18(17-5-1-2-10-21-17)24(19)12-16-4-3-11-25-16/h1-11H,12-13H2	LUJCSBDPIKBOMN-UHFFFAOYSA-N	426.01499443							92481
AC1LNY7S	LSM-32241	BRD-K91094364	1229739	InChI=1S/C22H21N3O3/c1-2-27-20-8-10-21(11-9-20)28-16-17-5-3-7-19(13-17)22(26)25-24-15-18-6-4-12-23-14-18/h3-15H,2,16H2,1H3,(H,25,26)	KIZAMRQLXKZVTN-UHFFFAOYSA-N	CCOc1ccc(OCc2cccc(c2)C(=O)NN=Cc3cccnc3)cc1	BroadT	BRD-K91094364	BRD-K91094364-001-08-1	Specs	AK-968/41026674			CCOc1ccc(OCc2cccc(c2)C(=O)NN=Cc2cccnc2)cc1	InChI=1S/C22H21N3O3/c1-2-27-20-8-10-21(11-9-20)28-16-17-5-3-7-19(13-17)22(26)25-24-15-18-6-4-12-23-14-18/h3-15H,2,16H2,1H3,(H,25,26)	KIZAMRQLXKZVTN-UHFFFAOYSA-N	375.158291562							120798
N-Cyclopropyl-2,6-difluoro-n-pyridin-2-ylmethyl-benzamide	LSM-15450	BRD-K57778236	3224912	InChI=1S/C16H14F2N2O/c17-13-5-3-6-14(18)15(13)16(21)20(12-7-8-12)10-11-4-1-2-9-19-11/h1-6,9,12H,7-8,10H2	MRYXEFOYTNWSKF-UHFFFAOYSA-N	Fc1cccc(F)c1C(=O)N(Cc2ccccn2)C3CC3	BroadT	BRD-K57778236	BRD-K57778236-003-05-9	Asinex Ltd.	ASN 06884962		Cl	Fc1cccc(F)c1C(=O)N(Cc1ccccn1)C1CC1.Cl	InChI=1S/C16H14F2N2O.ClH/c17-13-5-3-6-14(18)15(13)16(21)20(12-7-8-12)10-11-4-1-2-9-19-11;/h1-6,9,12H,7-8,10H2;1H	JPXWMLJGXNYOHL-UHFFFAOYSA-N	288.107419488							104092, 104092
T0508-9058	LSM-32242	BRD-K58762810, SID22405534	4296334	InChI=1S/C16H12N4O5/c21-14(17-10-5-7-11(8-6-10)20(23)24)9-25-16(22)15-12-3-1-2-4-13(12)18-19-15/h1-8H,9H2,(H,17,21)(H,18,19)	KMAJRGJBFOTMBZ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NC(=O)COC(=O)c2[nH]nc3ccccc23)cc1	BroadT	BRD-K58762810	BRD-K58762810-001-05-0	Enamine Ltd.	T0508-9058			[O-][N+](=O)c1ccc(NC(=O)COC(=O)c2[nH]nc3ccccc23)cc1	InChI=1S/C16H12N4O5/c21-14(17-10-5-7-11(8-6-10)20(23)24)9-25-16(22)15-12-3-1-2-4-13(12)18-19-15/h1-8H,9H2,(H,17,21)(H,18,19)	KMAJRGJBFOTMBZ-UHFFFAOYSA-N	340.080769524							120799
SMR000008135	LSM-32243	BRD-A23345137, SID844197	646509	InChI=1S/C21H28FN5O/c22-16-8-6-15(7-9-16)21(28)12-18-10-11-19(13-21)26(18)14-20-23-24-25-27(20)17-4-2-1-3-5-17/h6-9,17-19,28H,1-5,10-14H2	LWEURLAVRKTZGX-UHFFFAOYSA-N	OC1(CC2CCC(C1)N2Cc3nnnn3C4CCCCC4)c5ccc(F)cc5	BroadT	BRD-A23345137	BRD-A23345137-001-06-2	Asinex Ltd.	ASN 07834396			OC1(CC2CCC(C1)N2Cc1nnnn1C1CCCCC1)c1ccc(F)cc1	InChI=1S/C21H28FN5O/c22-16-8-6-15(7-9-16)21(28)12-18-10-11-19(13-21)26(18)14-20-23-24-25-27(20)17-4-2-1-3-5-17/h6-9,17-19,28H,1-5,10-14H2	LWEURLAVRKTZGX-UHFFFAOYSA-N	385.227788766							120800
F1838-0245	LSM-32244	BRD-A94740628, SID51087539	24892231	InChI=1S/C20H26N4O3S2/c1-20(2,3)14-8-6-13(7-9-14)17(26)22-18-23-24-19(29-18)28-12-16(25)21-11-15-5-4-10-27-15/h6-9,15H,4-5,10-12H2,1-3H3,(H,21,25)(H,22,23,26)	YIPJUFZGMOPEIF-UHFFFAOYSA-N	CC(C)(C)c1ccc(cc1)C(=O)Nc2nnc(SCC(=O)NCC3CCCO3)s2	BroadT	BRD-A94740628	BRD-A94740628-001-05-6	Life Chemicals Inc.	F1838-0245			CC(C)(C)c1ccc(cc1)C(=O)Nc1nnc(SCC(=O)NCC2CCCO2)s1	InChI=1S/C20H26N4O3S2/c1-20(2,3)14-8-6-13(7-9-14)17(26)22-18-23-24-19(29-18)28-12-16(25)21-11-15-5-4-10-27-15/h6-9,15H,4-5,10-12H2,1-3H3,(H,21,25)(H,22,23,26)	YIPJUFZGMOPEIF-UHFFFAOYSA-N	434.144632112							120801
3-Chloro-4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(2-phenylethyl)-1H-pyrrole-2,5-dione	LSM-32245	BRD-K37656403, SID14740706	1191626	InChI=1S/C22H23ClN2O4/c1-28-17-9-8-16(14-18(17)29-2)10-12-24-20-19(23)21(26)25(22(20)27)13-11-15-6-4-3-5-7-15/h3-9,14,24H,10-13H2,1-2H3	FTQOETJXTINDOG-UHFFFAOYSA-N	COc1ccc(CCNC2=C(Cl)C(=O)N(CCc3ccccc3)C2=O)cc1OC	BroadT	BRD-K37656403	BRD-K37656403-001-05-3	ChemBridge Corporation	7446639			COc1ccc(CCNC2=C(Cl)C(=O)N(CCc3ccccc3)C2=O)cc1OC	InChI=1S/C22H23ClN2O4/c1-28-17-9-8-16(14-18(17)29-2)10-12-24-20-19(23)21(26)25(22(20)27)13-11-15-6-4-3-5-7-15/h3-9,14,24H,10-13H2,1-2H3	FTQOETJXTINDOG-UHFFFAOYSA-N	414.134634946							120802
AC1LDCGT	LSM-32246	BRD-A20731954, SID843595	645896	InChI=1S/C22H26N6O3/c1-3-17-14(2)26-22-24-12-25-28(22)21(17)27-8-4-5-16(11-27)20(29)23-10-15-6-7-18-19(9-15)31-13-30-18/h6-7,9,12,16H,3-5,8,10-11,13H2,1-2H3,(H,23,29)	DJVSQJIKQVFYCP-UHFFFAOYSA-N	CCc1c(C)nc2ncnn2c1N3CCCC(C3)C(=O)NCc4ccc5OCOc5c4	BroadT	BRD-A20731954	BRD-A20731954-001-05-8	Asinex Ltd.	ASN 07103965			CCc1c(C)nc2ncnn2c1N1CCCC(C1)C(=O)NCc1ccc2OCOc2c1	InChI=1S/C22H26N6O3/c1-3-17-14(2)26-22-24-12-25-28(22)21(17)27-8-4-5-16(11-27)20(29)23-10-15-6-7-18-19(9-15)31-13-30-18/h6-7,9,12,16H,3-5,8,10-11,13H2,1-2H3,(H,23,29)	DJVSQJIKQVFYCP-UHFFFAOYSA-N	422.206638752							120803
SMR000015652	LSM-32247	BRD-K80858297, SID26670115, SID7971819	1078539	InChI=1S/C19H21N5O2/c1-14-3-2-4-15(11-14)24-18-16(12-22-24)17(20-13-21-18)23-7-5-19(6-8-23)25-9-10-26-19/h2-4,11-13H,5-10H2,1H3	QPAZDBLSPLVXKS-UHFFFAOYSA-N	Cc1cccc(c1)n2ncc3c(ncnc23)N4CCC5(CC4)OCCO5	BroadT	BRD-K80858297	BRD-K80858297-001-04-3	Life Chemicals Inc.	F0521-0082			Cc1cccc(c1)-n1ncc2c(ncnc12)N1CCC2(CC1)OCCO2	InChI=1S/C19H21N5O2/c1-14-3-2-4-15(11-14)24-18-16(12-22-24)17(20-13-21-18)23-7-5-19(6-8-23)25-9-10-26-19/h2-4,11-13H,5-10H2,1H3	QPAZDBLSPLVXKS-UHFFFAOYSA-N	351.169524962							120804
SMR000065446	LSM-32248	BRD-K59744424, SID24839673, SID3717774	2670170	InChI=1S/C20H25ClN4O3S/c1-23(2)29(27,28)17-6-4-5-15(13-17)20(26)22-18-14-16(21)7-8-19(18)25-11-9-24(3)10-12-25/h4-8,13-14H,9-12H2,1-3H3,(H,22,26)	YLXJOFDLKOXOKC-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cccc(c1)C(=O)Nc2cc(Cl)ccc2N3CCN(C)CC3	BroadT	BRD-K59744424	BRD-K59744424-001-05-5	Enamine Ltd.	ZU-4791408			CN(C)S(=O)(=O)c1cccc(c1)C(=O)Nc1cc(Cl)ccc1N1CCN(C)CC1	InChI=1S/C20H25ClN4O3S/c1-23(2)29(27,28)17-6-4-5-15(13-17)20(26)22-18-14-16(21)7-8-19(18)25-11-9-24(3)10-12-25/h4-8,13-14H,9-12H2,1-3H3,(H,22,26)	YLXJOFDLKOXOKC-UHFFFAOYSA-N	436.1335891							120805
STK147735	LSM-32249	BRD-K52731958, SID853330	655989	InChI=1S/C18H17NO3/c20-18(21)11-9-15-8-10-17(14-5-2-1-3-6-14)19(15)13-16-7-4-12-22-16/h1-8,10,12H,9,11,13H2,(H,20,21)	NRHNQLUJFCODBK-UHFFFAOYSA-N	OC(=O)CCc1ccc(c2ccccc2)n1Cc3occc3	BroadT	BRD-K52731958	BRD-K52731958-001-05-3	Asinex Ltd.	BAS 06347689			OC(=O)CCc1ccc(-c2ccccc2)n1Cc1ccco1	InChI=1S/C18H17NO3/c20-18(21)11-9-15-8-10-17(14-5-2-1-3-6-14)19(15)13-16-7-4-12-22-16/h1-8,10,12H,9,11,13H2,(H,20,21)	NRHNQLUJFCODBK-UHFFFAOYSA-N	295.120843414							120806
AC1OB4V8	LSM-32250	BRD-K69347147	6815231	InChI=1S/C19H14N4O3S/c24-15-6-5-13(17(25)9-15)10-21-23-16(18-4-2-8-26-18)12-27-19(23)22-14-3-1-7-20-11-14/h1-12,24-25H	GCIWFUYKVSPVTR-UHFFFAOYSA-N	Oc1ccc(C=NN2C(=Nc3cccnc3)SC=C2c4occc4)c(O)c1	BroadT	BRD-K69347147	BRD-K69347147-001-05-1	Enamine Ltd.	T0519-0265			Oc1ccc(C=Nn2c(csc2=Nc2cccnc2)-c2ccco2)c(O)c1	InChI=1S/C19H14N4O3S/c24-15-6-5-13(17(25)9-15)10-21-23-16(18-4-2-8-26-18)12-27-19(23)22-14-3-1-7-20-11-14/h1-12,24-25H	GCIWFUYKVSPVTR-UHFFFAOYSA-N	378.078661038							
AC1NEATW	LSM-32251	BRD-A26952628, SID24827246	4614480	InChI=1S/C15H18N2O2S/c16-9-11-10-5-2-1-3-7-13(10)20-15(11)17-14(18)12-6-4-8-19-12/h12H,1-8H2,(H,17,18)	RQVDZGHFHUOFIU-UHFFFAOYSA-N	O=C(Nc1sc2CCCCCc2c1C#N)C3CCCO3	BroadT	BRD-A26952628	BRD-A26952628-001-06-8	Enamine Ltd.	T0517-0214			O=C(Nc1sc2CCCCCc2c1C#N)C1CCCO1	InChI=1S/C15H18N2O2S/c16-9-11-10-5-2-1-3-7-13(10)20-15(11)17-14(18)12-6-4-8-19-12/h12H,1-8H2,(H,17,18)	RQVDZGHFHUOFIU-UHFFFAOYSA-N	290.108898526							120808
AC1MFQBD	LSM-32252	BRD-K90444258, SID22415337	2923579	InChI=1S/C13H11N3O4S/c14-13(9-3-5-10(6-4-9)16(18)19)15-20-12(17)8-11-2-1-7-21-11/h1-7H,8H2,(H2,14,15)	KVFICKQAEHURRP-UHFFFAOYSA-N	NC(=NOC(=O)Cc1cccs1)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K90444258	BRD-K90444258-001-05-4	ChemBridge Corporation	7013013			NC(=NOC(=O)Cc1cccs1)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C13H11N3O4S/c14-13(9-3-5-10(6-4-9)16(18)19)15-20-12(17)8-11-2-1-7-21-11/h1-7H,8H2,(H2,14,15)	KVFICKQAEHURRP-UHFFFAOYSA-N	305.047026552							120809
SMR000028361	LSM-32253	BRD-A77328129, SID4251450	3245136	InChI=1S/C16H15N3O3/c1-21-13-6-2-4-11(8-13)14-9-15(22-19-14)16(20)18-12-5-3-7-17-10-12/h2-8,10,15H,9H2,1H3,(H,18,20)	OAYLZJHVKRLXBQ-UHFFFAOYSA-N	COc1cccc(c1)C2=NOC(C2)C(=O)Nc3cccnc3	BroadT	BRD-A77328129	BRD-A77328129-001-05-5	ChemDiv Inc.	C651-0110			COc1cccc(c1)C1=NOC(C1)C(=O)Nc1cccnc1	InChI=1S/C16H15N3O3/c1-21-13-6-2-4-11(8-13)14-9-15(22-19-14)16(20)18-12-5-3-7-17-10-12/h2-8,10,15H,9H2,1H3,(H,18,20)	OAYLZJHVKRLXBQ-UHFFFAOYSA-N	297.11134137							120810
BRD-A57285050	LSM-32254	BRD-A57285050		InChI=1S/C17H24N2O/c1-5-6-7-12-13(10-18)11(2)19-14-8-17(3,4)9-15(20)16(12)14/h12,16H,5-9H2,1-4H3	UUJLJRUZBKHTOQ-UHFFFAOYSA-N	CCCCC1C2C(=O)CC(C)(C)CC2=NC(=C1C#N)C	BroadT	BRD-A57285050	BRD-A57285050-001-05-4	Key Organics Ltd.	10W-0267			CCCCC1C2C(=O)CC(C)(C)CC2=NC(C)=C1C#N	InChI=1S/C17H24N2O/c1-5-6-7-12-13(10-18)11(2)19-14-8-17(3,4)9-15(20)16(12)14/h12,16H,5-9H2,1-4H3	UUJLJRUZBKHTOQ-UHFFFAOYSA-N	272.188863408							120811
263016-08-6	LSM-32255	BRD-K22338979, SID26726549	6796325	InChI=1S/C12H10ClNO3S/c1-2-17-12(16)9-10(15)14-11(18-9)7-3-5-8(13)6-4-7/h3-6,15H,2H2,1H3	GTTLQUWXZGMKGX-UHFFFAOYSA-N	CCOC(=O)c1sc(nc1O)c2ccc(Cl)cc2	BroadT	BRD-K22338979	BRD-K22338979-001-05-9	Maybridge	SPB 02472			CCOC(=O)c1sc(nc1O)-c1ccc(Cl)cc1	InChI=1S/C12H10ClNO3S/c1-2-17-12(16)9-10(15)14-11(18-9)7-3-5-8(13)6-4-7/h3-6,15H,2H2,1H3	GTTLQUWXZGMKGX-UHFFFAOYSA-N	283.00699159							
2-[2-(Pyridin-3-ylmethylidene)hydrazinyl]pyridine	LSM-32256	BRD-K28017317	227124	InChI=1S/C11H10N4/c1-2-7-13-11(5-1)15-14-9-10-4-3-6-12-8-10/h1-9H,(H,13,15)	ZMTRKIYGCKYPTF-UHFFFAOYSA-N	N(N=Cc1cccnc1)c2ccccn2	BroadT	BRD-K28017317	BRD-K28017317-001-05-4	ChemBridge Corporation	5111103			N(N=Cc1cccnc1)c1ccccn1	InChI=1S/C11H10N4/c1-2-7-13-11(5-1)15-14-9-10-4-3-6-12-8-10/h1-9H,(H,13,15)	ZMTRKIYGCKYPTF-UHFFFAOYSA-N	198.09054636							120813
5-[(2-Chlorobenzyl)sulfonyl]-1-(2,6-dimethylphenyl)-1H-tetrazole	LSM-32257	BRD-K97733472, SID4264635	2210679	InChI=1S/C16H15ClN4O2S/c1-11-6-5-7-12(2)15(11)21-16(18-19-20-21)24(22,23)10-13-8-3-4-9-14(13)17/h3-9H,10H2,1-2H3	GUOPMMJQELJQJM-UHFFFAOYSA-N	Cc1cccc(C)c1n2nnnc2S(=O)(=O)Cc3ccccc3Cl	BroadT	BRD-K97733472	BRD-K97733472-001-04-6	ChemBridge Corporation	7824223			Cc1cccc(C)c1-n1nnnc1S(=O)(=O)Cc1ccccc1Cl	InChI=1S/C16H15ClN4O2S/c1-11-6-5-7-12(2)15(11)21-16(18-19-20-21)24(22,23)10-13-8-3-4-9-14(13)17/h3-9H,10H2,1-2H3	GUOPMMJQELJQJM-UHFFFAOYSA-N	362.06042416							120814
AC1LXHLS	LSM-32258	BRD-K56890200, SID14729605	1828022	InChI=1S/C18H29N5O/c1-3-4-5-8-20-18-16-13-23(2)10-7-14(16)15(12-19)17(22-18)21-9-6-11-24/h24H,3-11,13H2,1-2H3,(H2,20,21,22)	BTXROBZDLNQXQQ-UHFFFAOYSA-N	CCCCCNc1nc(NCCCO)c(C#N)c2CCN(C)Cc12	BroadT	BRD-K56890200	BRD-K56890200-001-05-9	InterBioScreen Ltd.	STOCK1S-00664			CCCCCNc1nc(NCCCO)c(C#N)c2CCN(C)Cc12	InChI=1S/C18H29N5O/c1-3-4-5-8-20-18-16-13-23(2)10-7-14(16)15(12-19)17(22-18)21-9-6-11-24/h24H,3-11,13H2,1-2H3,(H2,20,21,22)	BTXROBZDLNQXQQ-UHFFFAOYSA-N	331.237210598							120815
AC1M6DZO	LSM-44394	BRD-K37019305	2371340	InChI=1S/C16H13ClN2O2/c17-15-9-8-13(11-14(15)16(20)21)19-18-10-4-7-12-5-2-1-3-6-12/h1-11,19H,(H,20,21)/b7-4+,18-10?	IIYBXMWVSGZMSX-ONUNCVQHSA-N	OC(=O)c1cc(NN=C\C=C\c2ccccc2)ccc1Cl	BroadT	BRD-K37019305	BRD-K37019305-001-05-3	Enamine Ltd.	T0506-7878			OC(=O)c1cc(NN=C\C=C\c2ccccc2)ccc1Cl	InChI=1S/C16H13ClN2O2/c17-15-9-8-13(11-14(15)16(20)21)19-18-10-4-7-12-5-2-1-3-6-12/h1-11,19H,(H,20,21)/b7-4+,18-10?	IIYBXMWVSGZMSX-ONUNCVQHSA-N	300.066555386							
AC1O9ZDT	LSM-32260	BRD-K09146396, SID24790143	6741849	InChI=1S/C11H11ClN4OS/c12-5-6-16-8-4-2-1-3-7(8)9(10(16)17)14-15-11(13)18/h1-4,17H,5-6H2,(H2,13,18)	HWYRKKLBMQDXHJ-UHFFFAOYSA-N	NC(=S)N=Nc1c(O)n(CCCl)c2ccccc12	BroadT	BRD-K09146396	BRD-K09146396-001-05-8	Asinex Ltd.	BAS 00655138			NC(=S)N=Nc1c(O)n(CCCl)c2ccccc12	InChI=1S/C11H11ClN4OS/c12-5-6-16-8-4-2-1-3-7(8)9(10(16)17)14-15-11(13)18/h1-4,17H,5-6H2,(H2,13,18)	HWYRKKLBMQDXHJ-UHFFFAOYSA-N	282.034209412							
SMR000005290	LSM-32261	BRD-K84769529, SID853485	656142	InChI=1S/C19H20ClN3O2S2/c1-25-9-8-23-17(14-4-6-15(20)7-5-14)12-22-19(23)27-13-18(24)21-11-16-3-2-10-26-16/h2-7,10,12H,8-9,11,13H2,1H3,(H,21,24)	JRFAGZKNWDXQOA-UHFFFAOYSA-N	COCCn1c(SCC(=O)NCc2cccs2)ncc1c3ccc(Cl)cc3	BroadT	BRD-K84769529	BRD-K84769529-001-04-8	Asinex Ltd.	ASN 05638548			COCCn1c(SCC(=O)NCc2cccs2)ncc1-c1ccc(Cl)cc1	InChI=1S/C19H20ClN3O2S2/c1-25-9-8-23-17(14-4-6-15(20)7-5-14)12-22-19(23)27-13-18(24)21-11-16-3-2-10-26-16/h2-7,10,12H,8-9,11,13H2,1H3,(H,21,24)	JRFAGZKNWDXQOA-UHFFFAOYSA-N	421.068546							120818
MLS000889860	LSM-32262	BRD-K93491540, SID124897856, SID49713990	24789370	InChI=1S/C25H33NOS/c1-25(2,3)21-14-15-24(27)26(18-16-21)19-17-23(20-10-6-4-7-11-20)28-22-12-8-5-9-13-22/h4-13,21,23H,14-19H2,1-3H3/t21-,23+/m1/s1	UODHBKAFNBRALE-GGAORHGYSA-N	CC(C)(C)[C@H]1CCN(CC[C@H](Sc2ccccc2)c3ccccc3)C(=O)CC1	BroadT	BRD-K93491540	BRD-K93491540-001-07-6	University of Kansas	KUC102823N			CC(C)(C)[C@H]1CCN(CC[C@H](Sc2ccccc2)c2ccccc2)C(=O)CC1	InChI=1S/C25H33NOS/c1-25(2,3)21-14-15-24(27)26(18-16-21)19-17-23(20-10-6-4-7-11-20)28-22-12-8-5-9-13-22/h4-13,21,23H,14-19H2,1-3H3/t21-,23+/m1/s1	UODHBKAFNBRALE-GGAORHGYSA-N	395.228285376							120819
AC1LDCK1	LSM-15451	BRD-K50210179	664866	InChI=1S/C11H15N3O/c1-8-3-4-10-9(7-8)13-11(14(10)2)12-5-6-15/h3-4,7,15H,5-6H2,1-2H3,(H,12,13)	XKRZGNFAXFAKNC-UHFFFAOYSA-N	Cc1ccc2c(c1)nc(NCCO)n2C	BroadT	BRD-K50210179	BRD-K50210179-003-05-9	InterBioScreen Ltd.	STOCK4S-85124		Cl	Cc1ccc2n(C)c(NCCO)nc2c1.Cl	InChI=1S/C11H15N3O.ClH/c1-8-3-4-10-9(7-8)13-11(14(10)2)12-5-6-15;/h3-4,7,15H,5-6H2,1-2H3,(H,12,13);1H	XNMUOBMMJULYGU-UHFFFAOYSA-N	205.12151213							104093, 104093
ZINC02640243	LSM-32263	BRD-K39267096, SID24837202	2103200	InChI=1S/C18H25N5O3/c1-3-5-11-20-17(25)22(4-2)14-15(19)23(18(26)21-16(14)24)12-13-9-7-6-8-10-13/h6-10H,3-5,11-12,19H2,1-2H3,(H,20,25)(H,21,24,26)	LZWJFQBILOLXMS-UHFFFAOYSA-N	CCCCNC(=O)N(CC)C1=C(N)N(Cc2ccccc2)C(=O)NC1=O	BroadT	BRD-K39267096	BRD-K39267096-001-05-9	Enamine Ltd.	T5236035			CCCCNC(=O)N(CC)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O	InChI=1S/C18H25N5O3/c1-3-5-11-20-17(25)22(4-2)14-15(19)23(18(26)21-16(14)24)12-13-9-7-6-8-10-13/h6-10H,3-5,11-12,19H2,1-2H3,(H,20,25)(H,21,24,26)	LZWJFQBILOLXMS-UHFFFAOYSA-N	359.19573971							120820
ASN 06578816	LSM-32264	BRD-A44990218, SID845966	648334	InChI=1S/C17H19FN4O/c1-12-5-6-14(10-15(12)18)21-16(23)13-4-2-9-22(11-13)17-19-7-3-8-20-17/h3,5-8,10,13H,2,4,9,11H2,1H3,(H,21,23)	XFYWTKXMRZBBIT-UHFFFAOYSA-N	Cc1ccc(NC(=O)C2CCCN(C2)c3ncccn3)cc1F	BroadT	BRD-A44990218	BRD-A44990218-001-07-0	Asinex Ltd.	ASN 06578816			Cc1ccc(NC(=O)C2CCCN(C2)c2ncccn2)cc1F	InChI=1S/C17H19FN4O/c1-12-5-6-14(10-15(12)18)21-16(23)13-4-2-9-22(11-13)17-19-7-3-8-20-17/h3,5-8,10,13H,2,4,9,11H2,1H3,(H,21,23)	XFYWTKXMRZBBIT-UHFFFAOYSA-N	314.154289468							120821
((2,3-Dimethyl-5-oxo-1-phenyl(3-pyrazolin-4-yl))amino)-n-((4-methylphenyl)sulfonyl)formamide	LSM-32265	BRD-K24977393, SID3714581	1241123	InChI=1S/C19H20N4O4S/c1-13-9-11-16(12-10-13)28(26,27)21-19(25)20-17-14(2)22(3)23(18(17)24)15-7-5-4-6-8-15/h4-12H,1-3H3,(H2,20,21,25)	HMSLLBOGVWHAAM-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)NC(=O)NS(=O)(=O)c2ccc(C)cc2)c3ccccc3	BroadT	BRD-K24977393	BRD-K24977393-001-05-0	Enamine Ltd.	T0505-1640			Cc1c(NC(=O)NS(=O)(=O)c2ccc(C)cc2)c(=O)n(-c2ccccc2)n1C	InChI=1S/C19H20N4O4S/c1-13-9-11-16(12-10-13)28(26,27)21-19(25)20-17-14(2)22(3)23(18(17)24)15-7-5-4-6-8-15/h4-12H,1-3H3,(H2,20,21,25)	HMSLLBOGVWHAAM-UHFFFAOYSA-N	400.12052585							120822
BRD-K29475348	LSM-32266		51517478	InChI=1S/C14H14ClNO3/c1-8(2)5-10(17)7-12-14(18)19-13-4-3-9(15)6-11(13)16-12/h3-4,6,8H,5,7H2,1-2H3	YFNVTIBLPDEZCG-UHFFFAOYSA-N	CC(C)CC(=O)CC1=Nc2cc(Cl)ccc2OC1=O	BroadT	BRD-K29475348	BRD-K29475348-001-05-6	InterBioScreen Ltd.	STOCK4S-72659			CC(C)CC(=O)Cc1nc2cc(Cl)ccc2oc1=O	InChI=1S/C14H14ClNO3/c1-8(2)5-10(17)7-12-14(18)19-13-4-3-9(15)6-11(13)16-12/h3-4,6,8H,5,7H2,1-2H3	YFNVTIBLPDEZCG-UHFFFAOYSA-N	279.066221028							120823
MLS000778724	LSM-44395	BRD-K06250424	1382255	InChI=1S/C17H14ClN3O3S/c1-9-3-4-11(18)7-13(9)14-6-5-12(24-14)8-15(16(22)23)25-17-19-10(2)20-21-17/h3-8H,1-2H3,(H,22,23)(H,19,20,21)/b15-8+	HAQIFVQHRZHBAY-OVCLIPMQSA-N	Cc1ccc(Cl)cc1c2oc(\C=C(\Sc3n[nH]c(C)n3)/C(=O)O)cc2	BroadT	BRD-K06250424	BRD-K06250424-001-06-5	InterBioScreen Ltd.	STOCK4S-16659			Cc1nc(S\C(=C\c2ccc(o2)-c2cc(Cl)ccc2C)C(O)=O)n[nH]1	InChI=1S/C17H14ClN3O3S/c1-9-3-4-11(18)7-13(9)14-6-5-12(24-14)8-15(16(22)23)25-17-19-10(2)20-21-17/h3-8H,1-2H3,(H,22,23)(H,19,20,21)/b15-8+	HAQIFVQHRZHBAY-OVCLIPMQSA-N	375.044439738							
2H-Indazole-6-carboxamide, 2-ethyl-3-methoxy-n-[2-(2-thienyl)ethyl]-	LSM-32268	BRD-K32146668, SID17407474	11958678	InChI=1S/C17H19N3O2S/c1-3-20-17(22-2)14-7-6-12(11-15(14)19-20)16(21)18-9-8-13-5-4-10-23-13/h4-7,10-11H,3,8-9H2,1-2H3,(H,18,21)	DYMJQCRRMRKMDW-UHFFFAOYSA-N	CCn1nc2cc(ccc2c1OC)C(=O)NCCc3cccs3	BroadT	BRD-K32146668	BRD-K32146668-001-05-0	University of California at Davis	UCD_ADM_1-199			CCn1nc2cc(ccc2c1OC)C(=O)NCCc1cccs1	InChI=1S/C17H19N3O2S/c1-3-20-17(22-2)14-7-6-12(11-15(14)19-20)16(21)18-9-8-13-5-4-10-23-13/h4-7,10-11H,3,8-9H2,1-2H3,(H,18,21)	DYMJQCRRMRKMDW-UHFFFAOYSA-N	329.119797568							120825
BRD-K07706477	LSM-44396	SID26662276	54742267	InChI=1S/C15H11NO6/c1-9-7-13(18)14(15(19)22-9)12(17)6-5-10-3-2-4-11(8-10)16(20)21/h2-8,18H,1H3/b6-5+	VIJRQPQWTZYIJO-AATRIKPKSA-N	CC1=CC(=C(C(=O)\C=C\c2cccc(c2)[N+](=O)[O-])C(=O)O1)O	BroadT	BRD-K07706477	BRD-K07706477-001-06-1	InterBioScreen Ltd.	STOCK1S-08227			Cc1cc(O)c(C(=O)\C=C\c2cccc(c2)[N+]([O-])=O)c(=O)o1	InChI=1S/C15H11NO6/c1-9-7-13(18)14(15(19)22-9)12(17)6-5-10-3-2-4-11(8-10)16(20)21/h2-8,18H,1H3/b6-5+	VIJRQPQWTZYIJO-AATRIKPKSA-N	301.058637082							
SMR000004672	LSM-32270	BRD-A48913311, SID26726078, SID846753	649146	InChI=1S/C26H29N5O5/c1-17(2)31(24(32)16-30-22-10-6-5-9-21(22)28-29-30)25(26(33)27-15-19-8-7-13-36-19)20-14-18(34-3)11-12-23(20)35-4/h5-14,17,25H,15-16H2,1-4H3,(H,27,33)	XTLVJEYOBABROX-UHFFFAOYSA-N	COc1ccc(OC)c(c1)C(N(C(C)C)C(=O)Cn2nnc3ccccc23)C(=O)NCc4occc4	BroadT	BRD-A48913311	BRD-A48913311-001-05-8	Asinex Ltd.	ASN 05441441			COc1ccc(OC)c(c1)C(N(C(C)C)C(=O)Cn1nnc2ccccc12)C(=O)NCc1ccco1	InChI=1S/C26H29N5O5/c1-17(2)31(24(32)16-30-22-10-6-5-9-21(22)28-29-30)25(26(33)27-15-19-8-7-13-36-19)20-14-18(34-3)11-12-23(20)35-4/h5-14,17,25H,15-16H2,1-4H3,(H,27,33)	XTLVJEYOBABROX-UHFFFAOYSA-N	491.216869078							120827
ZINC05248813	LSM-32271	BRD-K37515001, SID26658544	947754	InChI=1S/C19H20N2O2/c1-12-4-5-13(2)18(8-12)20-11-15-9-14-10-16(23-3)6-7-17(14)21-19(15)22/h4-10,20H,11H2,1-3H3,(H,21,22)	RUBMXZKGYONRSP-UHFFFAOYSA-N	COc1ccc2nc(O)c(CNc3cc(C)ccc3C)cc2c1	BroadT	BRD-K37515001	BRD-K37515001-001-05-7	InterBioScreen Ltd.	STOCK4S-84010			COc1ccc2nc(O)c(CNc3cc(C)ccc3C)cc2c1	InChI=1S/C19H20N2O2/c1-12-4-5-13(2)18(8-12)20-11-15-9-14-10-16(23-3)6-7-17(14)21-19(15)22/h4-10,20H,11H2,1-3H3,(H,21,22)	RUBMXZKGYONRSP-UHFFFAOYSA-N	308.1524779							120828
MLS000073465	LSM-32272	BRD-K51608472, SID844340, SID85304964	646660	InChI=1S/C21H25N7O2/c1-26(2)17-9-7-16(8-10-17)21-23-25-28(24-21)15-20(29)22-18-5-3-4-6-19(18)27-11-13-30-14-12-27/h3-10H,11-15H2,1-2H3,(H,22,29)	SASDCBJYMSBVNQ-UHFFFAOYSA-N	CN(C)c1ccc(cc1)c2nnn(CC(=O)Nc3ccccc3N4CCOCC4)n2	BroadT	BRD-K51608472	BRD-K51608472-001-05-1	Asinex Ltd.	ASN 04449982			CN(C)c1ccc(cc1)-c1nnn(CC(=O)Nc2ccccc2N2CCOCC2)n1	InChI=1S/C21H25N7O2/c1-26(2)17-9-7-16(8-10-17)21-23-25-28(24-21)15-20(29)22-18-5-3-4-6-19(18)27-11-13-30-14-12-27/h3-10H,11-15H2,1-2H3,(H,22,29)	SASDCBJYMSBVNQ-UHFFFAOYSA-N	407.20697311							120829
AC1OBJDT	LSM-32273	BRD-K83690550, SID24814995	6824123	InChI=1S/C23H19FN4OS/c1-15-8-2-3-9-16(15)14-28-20-13-7-4-10-17(20)21(22(28)29)26-27-23(30)25-19-12-6-5-11-18(19)24/h2-13,29H,14H2,1H3,(H,25,30)	XSJVYXNQHHZDJN-UHFFFAOYSA-N	Cc1ccccc1Cn2c(O)c(N=NC(=Nc3ccccc3F)S)c4ccccc24	BroadT	BRD-K83690550	BRD-K83690550-001-05-6	ChemDiv Inc.	K784-8195			Cc1ccccc1Cn1c(O)c(N=NC(S)=Nc2ccccc2F)c2ccccc12	InChI=1S/C23H19FN4OS/c1-15-8-2-3-9-16(15)14-28-20-13-7-4-10-17(20)21(22(28)29)26-27-23(30)25-19-12-6-5-11-18(19)24/h2-13,29H,14H2,1H3,(H,25,30)	XSJVYXNQHHZDJN-UHFFFAOYSA-N	418.126360158							
AC1MDS6O	LSM-32274	BRD-K97977764	2815971	InChI=1S/C24H19N7S/c1-17-7-9-18(10-8-17)22-20(16-30(29-22)21-5-3-2-4-6-21)15-26-31-23(27-28-24(31)32)19-11-13-25-14-12-19/h2-16H,1H3,(H,28,32)	LLCAFOHVAONHIC-UHFFFAOYSA-N	Cc1ccc(cc1)c2nn(cc2C=Nn3c(S)nnc3c4ccncc4)c5ccccc5	BroadT	BRD-K97977764	BRD-K97977764-001-07-9	Maybridge	HTS 11972			Cc1ccc(cc1)-c1c(C=Nn2c(S)nnc2-c2ccncc2)cn(n1)-c1ccccc1	InChI=1S/C24H19N7S/c1-17-7-9-18(10-8-17)22-20(16-30(29-22)21-5-3-2-4-6-21)15-26-31-23(27-28-24(31)32)19-11-13-25-14-12-19/h2-16H,1H3,(H,28,32)	LLCAFOHVAONHIC-UHFFFAOYSA-N	437.142264368							120831
STK390048	LSM-32275	BRD-K20829034, SID4256612	2976724	InChI=1S/C23H21Cl2N3O3/c24-17-5-3-16(4-6-17)14-22(29)26-18-7-8-20(19(25)15-18)27-9-11-28(12-10-27)23(30)21-2-1-13-31-21/h1-8,13,15H,9-12,14H2,(H,26,29)	UWIDUEGOKCNMDL-UHFFFAOYSA-N	Clc1ccc(CC(=O)Nc2ccc(N3CCN(CC3)C(=O)c4occc4)c(Cl)c2)cc1	BroadT	BRD-K20829034	BRD-K20829034-001-05-2	ChemBridge Corporation	7967214			Clc1ccc(CC(=O)Nc2ccc(N3CCN(CC3)C(=O)c3ccco3)c(Cl)c2)cc1	InChI=1S/C23H21Cl2N3O3/c24-17-5-3-16(4-6-17)14-22(29)26-18-7-8-20(19(25)15-18)27-9-11-28(12-10-27)23(30)21-2-1-13-31-21/h1-8,13,15H,9-12,14H2,(H,26,29)	UWIDUEGOKCNMDL-UHFFFAOYSA-N	457.095996982							120832
MLS000040996	LSM-32276	BRD-K40276277, SID864479	665724	InChI=1S/C20H21NO6/c22-18(21-8-6-12(7-9-21)19(23)24)11-26-13-4-5-15-14-2-1-3-16(14)20(25)27-17(15)10-13/h4-5,10,12H,1-3,6-9,11H2,(H,23,24)	GJDXJJJTUCKHMW-UHFFFAOYSA-N	OC(=O)C1CCN(CC1)C(=O)COc2ccc3C4=C(CCC4)C(=O)Oc3c2	BroadT	BRD-K40276277	BRD-K40276277-001-11-6	InterBioScreen Ltd.	STOCK5S-20816			OC(=O)C1CCN(CC1)C(=O)COc1ccc2c3CCCc3c(=O)oc2c1	InChI=1S/C20H21NO6/c22-18(21-8-6-12(7-9-21)19(23)24)11-26-13-4-5-15-14-2-1-3-16(14)20(25)27-17(15)10-13/h4-5,10,12H,1-3,6-9,11H2,(H,23,24)	GJDXJJJTUCKHMW-UHFFFAOYSA-N	371.136887402							120833
AJ-292/42648766	LSM-32277	BRD-K48691513, SID14727128	1094087	InChI=1S/C15H16N2O3S/c1-12-6-5-9-14(16-12)17-15(18)11-21(19,20)10-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3,(H,16,17,18)	VUCOUNLBXVTVMW-UHFFFAOYSA-N	Cc1cccc(NC(=O)CS(=O)(=O)Cc2ccccc2)n1	BroadT	BRD-K48691513	BRD-K48691513-001-05-4	Asinex Ltd.	BAS 09532886			Cc1cccc(NC(=O)CS(=O)(=O)Cc2ccccc2)n1	InChI=1S/C15H16N2O3S/c1-12-6-5-9-14(16-12)17-15(18)11-21(19,20)10-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3,(H,16,17,18)	VUCOUNLBXVTVMW-UHFFFAOYSA-N	304.088163082							120834
ZINC00146801	LSM-32278	BRD-K83952475, SID47198850	732474	InChI=1S/C15H12BrNO2/c16-13-8-6-12(7-9-13)15(19)17-10-14(18)11-4-2-1-3-5-11/h1-9H,10H2,(H,17,19)	UHMOQHJNKKRHSY-UHFFFAOYSA-N	Brc1ccc(cc1)C(=O)NCC(=O)c2ccccc2	BroadT	BRD-K83952475	BRD-K83952475-001-06-0	ChemBridge Corporation	5331171			Brc1ccc(cc1)C(=O)NCC(=O)c1ccccc1	InChI=1S/C15H12BrNO2/c16-13-8-6-12(7-9-13)15(19)17-10-14(18)11-4-2-1-3-5-11/h1-9H,10H2,(H,17,19)	UHMOQHJNKKRHSY-UHFFFAOYSA-N	317.005141234							120835
Chlormadinone Acetate	LSM-4615	Chlormadinone, BRD-K38704569, Chlormadinone Acetate	9324	InChI=1S/C23H29ClO4/c1-13(25)23(28-14(2)26)10-7-18-16-12-20(24)19-11-15(27)5-8-21(19,3)17(16)6-9-22(18,23)4/h11-12,16-18H,5-10H2,1-4H3/t16-,17+,18+,21-,22+,23+/m1/s1	QMBJSIBWORFWQT-DFXBJWIESA-N	CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(=O)C	BroadT	BRD-K38704569	BRD-K38704569-001-11-8	Sigma-Aldrich	C5145			CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=O	InChI=1S/C23H29ClO4/c1-13(25)23(28-14(2)26)10-7-18-16-12-20(24)19-11-15(27)5-8-21(19,3)17(16)6-9-22(18,23)4/h11-12,16-18H,5-10H2,1-4H3/t16-,17+,18+,21-,22+,23+/m1/s1	QMBJSIBWORFWQT-DFXBJWIESA-N	404.175437118							31394
ST50029782	LSM-32279	BRD-K74114857, SID47204831	1094685	InChI=1S/C24H25NO7/c1-29-20-10-5-15(11-21(20)30-2)12-25-13-18(23(27)31-3)22(19(14-25)24(28)32-4)16-6-8-17(26)9-7-16/h5-11,13-14,22,26H,12H2,1-4H3	ACGZYGOJROGDBQ-UHFFFAOYSA-N	COC(=O)C1=CN(Cc2ccc(OC)c(OC)c2)C=C(C1c3ccc(O)cc3)C(=O)OC	BroadT	BRD-K74114857	BRD-K74114857-001-05-8	Asinex Ltd.	BAS 09589468			COC(=O)C1=CN(Cc2ccc(OC)c(OC)c2)C=C(C1c1ccc(O)cc1)C(=O)OC	InChI=1S/C24H25NO7/c1-29-20-10-5-15(11-21(20)30-2)12-25-13-18(23(27)31-3)22(19(14-25)24(28)32-4)16-6-8-17(26)9-7-16/h5-11,13-14,22,26H,12H2,1-4H3	ACGZYGOJROGDBQ-UHFFFAOYSA-N	439.16310215							120836
MLS000560276	LSM-32280	BRD-K28753508, SID17403131	2331811	InChI=1S/C22H17N3O3S/c1-27-20-10-14-13-6-2-5-9-18(13)28-19(14)11-17(20)23-21(26)12-29-22-24-15-7-3-4-8-16(15)25-22/h2-11H,12H2,1H3,(H,23,26)(H,24,25)	ZWXWCOUXFRMHHR-UHFFFAOYSA-N	COc1cc2c(oc3ccccc23)cc1NC(=O)CSc4nc5ccccc5[nH]4	BroadT	BRD-K28753508	BRD-K28753508-001-05-3	Asinex Ltd.	BAS 06261949			COc1cc2c(cc1NC(=O)CSc1nc3ccccc3[nH]1)oc1ccccc21	InChI=1S/C22H17N3O3S/c1-27-20-10-14-13-6-2-5-9-18(13)28-19(14)11-17(20)23-21(26)12-29-22-24-15-7-3-4-8-16(15)25-22/h2-11H,12H2,1H3,(H,23,26)(H,24,25)	ZWXWCOUXFRMHHR-UHFFFAOYSA-N	403.099062124							120837
AC1LHYJF	LSM-32281	BRD-K28483134	871453	InChI=1S/C13H11N3S/c1-16-12-7-3-2-6-11(12)15-13(16)14-9-10-5-4-8-17-10/h2-9H,1H3	DBJPVRXEDJLFDX-UHFFFAOYSA-N	Cn1c(N=Cc2cccs2)nc3ccccc13	BroadT	BRD-K28483134	BRD-K28483134-001-05-9	ChemBridge Corporation	5544751			Cn1c(N=Cc2cccs2)nc2ccccc12	InChI=1S/C13H11N3S/c1-16-12-7-3-2-6-11(12)15-13(16)14-9-10-5-4-8-17-10/h2-9H,1H3	DBJPVRXEDJLFDX-UHFFFAOYSA-N	241.067368072							120838
12/2/5268	LSM-32282	BRD-A71722688, SID14736489	2838535	InChI=1S/C15H21NO/c1-12-7-6-8-13(2)16(12)15(17)11-14-9-4-3-5-10-14/h3-5,9-10,12-13H,6-8,11H2,1-2H3	MLILZFACFPQHDN-UHFFFAOYSA-N	CC1CCCC(C)N1C(=O)Cc2ccccc2	BroadT	BRD-A71722688	BRD-A71722688-001-05-8	ChemBridge Corporation	5268122			CC1CCCC(C)N1C(=O)Cc1ccccc1	InChI=1S/C15H21NO/c1-12-7-6-8-13(2)16(12)15(17)11-14-9-4-3-5-10-14/h3-5,9-10,12-13H,6-8,11H2,1-2H3	MLILZFACFPQHDN-UHFFFAOYSA-N	231.162314302							120839
AC1LBVBJ	LSM-32283	BRD-K77343050	542839	InChI=1S/C11H10N4O2/c1-8-10(15-17-14-8)11(16)13-12-7-9-5-3-2-4-6-9/h2-7H,1H3,(H,13,16)	RUJZIZIQGHPDDL-UHFFFAOYSA-N	Cc1nonc1C(=O)NN=Cc2ccccc2	BroadT	BRD-K77343050	BRD-K77343050-001-05-5	Asinex Ltd.	BAS 00285782			Cc1nonc1C(=O)NN=Cc1ccccc1	InChI=1S/C11H10N4O2/c1-8-10(15-17-14-8)11(16)13-12-7-9-5-3-2-4-6-9/h2-7H,1H3,(H,13,16)	RUJZIZIQGHPDDL-UHFFFAOYSA-N	230.0803756							120840
AC1MMQPA	LSM-32284	BRD-K62504352	3290156	InChI=1S/C18H27N3O3/c1-11-8-12(2)16(13(3)9-11)19-15(22)10-14(4)20-21-17(23)24-18(5,6)7/h8-9H,10H2,1-7H3,(H,19,22)(H,21,23)	JRGFZXQPKSSHQD-UHFFFAOYSA-N	CC(=NNC(=O)OC(C)(C)C)CC(=O)Nc1c(C)cc(C)cc1C	BroadT	BRD-K62504352	BRD-K62504352-001-05-4	Specs	AG-205/36917021			CC(CC(=O)Nc1c(C)cc(C)cc1C)=NNC(=O)OC(C)(C)C	InChI=1S/C18H27N3O3/c1-11-8-12(2)16(13(3)9-11)19-15(22)10-14(4)20-21-17(23)24-18(5,6)7/h8-9H,10H2,1-7H3,(H,19,22)(H,21,23)	JRGFZXQPKSSHQD-UHFFFAOYSA-N	333.205241754							120841
MLS000534988	LSM-32285	BRD-A37105798, SID14733956	2791456	InChI=1S/C17H19ClN2O3/c1-11-4-3-9-19(10-11)15-14(18)16(21)20(17(15)22)12-5-7-13(23-2)8-6-12/h5-8,11H,3-4,9-10H2,1-2H3	PXGIAWSSFXNWBW-UHFFFAOYSA-N	COc1ccc(cc1)N2C(=O)C(=C(N3CCCC(C)C3)C2=O)Cl	BroadT	BRD-A37105798	BRD-A37105798-001-05-6	ChemBridge Corporation	7126524			COc1ccc(cc1)N1C(=O)C(Cl)=C(N2CCCC(C)C2)C1=O	InChI=1S/C17H19ClN2O3/c1-11-4-3-9-19(10-11)15-14(18)16(21)20(17(15)22)12-5-7-13(23-2)8-6-12/h5-8,11H,3-4,9-10H2,1-2H3	PXGIAWSSFXNWBW-UHFFFAOYSA-N	334.108420198							120842
SMR000218605	LSM-32286	BRD-A89471191, SID17514009	4366066	InChI=1S/C25H20ClN3O2S/c1-2-31-18-10-11-20-17(13-18)14-19(24(26)27-20)22-15-21(16-7-4-3-5-8-16)28-29(22)25(30)23-9-6-12-32-23/h3-14,22H,2,15H2,1H3	ISDHNTLTLPEJQF-UHFFFAOYSA-N	CCOc1ccc2nc(Cl)c(cc2c1)C3CC(=NN3C(=O)c4cccs4)c5ccccc5	BroadT	BRD-A89471191	BRD-A89471191-001-05-2	InterBioScreen Ltd.	STOCK3S-36264			CCOc1ccc2nc(Cl)c(cc2c1)C1CC(=NN1C(=O)c1cccs1)c1ccccc1	InChI=1S/C25H20ClN3O2S/c1-2-31-18-10-11-20-17(13-18)14-19(24(26)27-20)22-15-21(16-7-4-3-5-8-16)28-29(22)25(30)23-9-6-12-32-23/h3-14,22H,2,15H2,1H3	ISDHNTLTLPEJQF-UHFFFAOYSA-N	461.09647531							120843
SMR000095966	LSM-32287	BRD-A44068497, SID51088212, SID7966191	5308071	InChI=1S/C16H14BrN3OS/c17-14-11-18-16(22-14)19-15(21)13(20-8-4-5-9-20)10-12-6-2-1-3-7-12/h1-9,11,13H,10H2,(H,18,19,21)	PTAKBWDNPCFDBB-UHFFFAOYSA-N	Brc1cnc(NC(=O)C(Cc2ccccc2)n3cccc3)s1	BroadT	BRD-A44068497	BRD-A44068497-001-05-1	ChemDiv Inc.	C737-0486			Brc1cnc(NC(=O)C(Cc2ccccc2)n2cccc2)s1	InChI=1S/C16H14BrN3OS/c17-14-11-18-16(22-14)19-15(21)13(20-8-4-5-9-20)10-12-6-2-1-3-7-12/h1-9,11,13H,10H2,(H,18,19,21)	PTAKBWDNPCFDBB-UHFFFAOYSA-N	375.004095388							120844
2-(4-Methylphenoxy)-1-[4-(4-phenylcyclohexyl)piperazin-1-yl]ethanone	LSM-15585	BRD-K71194915	1529334	InChI=1S/C25H32N2O2/c1-20-7-13-24(14-8-20)29-19-25(28)27-17-15-26(16-18-27)23-11-9-22(10-12-23)21-5-3-2-4-6-21/h2-8,13-14,22-23H,9-12,15-19H2,1H3	NXGTTWZHODGUFY-UHFFFAOYSA-N	Cc1ccc(OCC(=O)N2CCN(CC2)C3CCC(CC3)c4ccccc4)cc1	BroadT	BRD-K71194915	BRD-K71194915-034-05-4	ChemBridge Corporation	5993254		OC(=O)C(=O)O	Cc1ccc(OCC(=O)N2CCN(CC2)C2CCC(CC2)c2ccccc2)cc1.OC(=O)C(=O)O	InChI=1S/C25H32N2O2.C2H2O4/c1-20-7-13-24(14-8-20)29-19-25(28)27-17-15-26(16-18-27)23-11-9-22(10-12-23)21-5-3-2-4-6-21;3-1(4)2(5)6/h2-8,13-14,22-23H,9-12,15-19H2,1H3;(H,3,4)(H,5,6)	KDOSZSSQWZQYFB-UHFFFAOYSA-N	392.246378284							104221, 104221
T0518-7552	LSM-44397	BRD-K11757577, SID22409030	5959900	InChI=1S/C19H14ClN5O2S/c1-2-16-23-24-19(28-16)22-10-14-12-5-3-4-6-13(12)17(26)25(18(14)27)15-8-7-11(20)9-21-15/h3-10H,2H2,1H3,(H,22,24)/b14-10+	DUIWPEYJHHGEAF-GXDHUFHOSA-N	CCc1nnc(N\C=C/2\C(=O)N(C(=O)c3ccccc23)c4ccc(Cl)cn4)s1	BroadT	BRD-K11757577	BRD-K11757577-001-05-9	Enamine Ltd.	T0518-7552			CCc1nnc(N\C=C2\C(=O)N(C(=O)c3ccccc23)c2ccc(Cl)cn2)s1	InChI=1S/C19H14ClN5O2S/c1-2-16-23-24-19(28-16)22-10-14-12-5-3-4-6-13(12)17(26)25(18(14)27)15-8-7-11(20)9-21-15/h3-10H,2H2,1H3,(H,22,24)/b14-10+	DUIWPEYJHHGEAF-GXDHUFHOSA-N	411.055673138							
CHEMDIV2_003415	LSM-15452	BRD-A32128687	3239849	InChI=1S/C14H17NO2/c1-16-12-6-4-11(5-7-12)14(15)9-8-13-3-2-10-17-13/h2-7,10,14H,8-9,15H2,1H3	AZSMKIIOFLZAOU-UHFFFAOYSA-N	COc1ccc(cc1)C(N)CCc2occc2	BroadT	BRD-A32128687	BRD-A32128687-003-06-1	ChemDiv Inc.	R152-1742		Cl	COc1ccc(cc1)C(N)CCc1ccco1.Cl	InChI=1S/C14H17NO2.ClH/c1-16-12-6-4-11(5-7-12)14(15)9-8-13-3-2-10-17-13;/h2-7,10,14H,8-9,15H2,1H3;1H	BTHRUVDLTANLQR-UHFFFAOYSA-N	231.125928794							104094, 104094
MLS-0202462.0001	LSM-32289	BRD-K04108962, SID17515828, SID87544738	7207114	InChI=1S/C17H15N3O2S/c1-12-4-2-5-13(10-12)18-16(21)11-23-17-8-7-14(19-20-17)15-6-3-9-22-15/h2-10H,11H2,1H3,(H,18,21)	VYTUMEJQBJRYBJ-UHFFFAOYSA-N	Cc1cccc(NC(=O)CSc2ccc(nn2)c3occc3)c1	BroadT	BRD-K04108962	BRD-K04108962-001-05-7	Life Chemicals Inc.	F2004-0028			Cc1cccc(NC(=O)CSc2ccc(nn2)-c2ccco2)c1	InChI=1S/C17H15N3O2S/c1-12-4-2-5-13(10-12)18-16(21)11-23-17-8-7-14(19-20-17)15-6-3-9-22-15/h2-10H,11H2,1H3,(H,18,21)	VYTUMEJQBJRYBJ-UHFFFAOYSA-N	325.08849744							120846
SMR000004112	LSM-32290	BRD-K67426191, SID852037	654643	InChI=1S/C24H23N3O3/c1-16-10-11-17(2)22-21(16)13-18(23(28)26-22)14-27(15-20-9-6-12-30-20)24(29)25-19-7-4-3-5-8-19/h3-13H,14-15H2,1-2H3,(H,25,29)(H,26,28)	XWEZGHRORYUNNC-UHFFFAOYSA-N	Cc1ccc(C)c2nc(O)c(CN(Cc3occc3)C(=O)Nc4ccccc4)cc12	BroadT	BRD-K67426191	BRD-K67426191-001-05-0	Asinex Ltd.	ASN 05112343			Cc1ccc(C)c2nc(O)c(CN(Cc3ccco3)C(=O)Nc3ccccc3)cc12	InChI=1S/C24H23N3O3/c1-16-10-11-17(2)22-21(16)13-18(23(28)26-22)14-27(15-20-9-6-12-30-20)24(29)25-19-7-4-3-5-8-19/h3-13H,14-15H2,1-2H3,(H,25,29)(H,26,28)	XWEZGHRORYUNNC-UHFFFAOYSA-N	401.173941626							120847
ZINC03070301	LSM-44398	BRD-K94992087, SID24829554	2303048	InChI=1S/C14H11NO4/c16-14(6-4-11-2-1-7-17-11)15-10-3-5-12-13(8-10)19-9-18-12/h1-8H,9H2,(H,15,16)/b6-4+	LNNIKLNELUQODG-GQCTYLIASA-N	O=C(Nc1ccc2OCOc2c1)\C=C\c3occc3	BroadT	BRD-K94992087	BRD-K94992087-001-05-5	Enamine Ltd.	T5220644			O=C(Nc1ccc2OCOc2c1)\C=C\c1ccco1	InChI=1S/C14H11NO4/c16-14(6-4-11-2-1-7-17-11)15-10-3-5-12-13(8-10)19-9-18-12/h1-8H,9H2,(H,15,16)/b6-4+	LNNIKLNELUQODG-GQCTYLIASA-N	257.068807842							
MLS000082861	LSM-15453	BRD-K83125173	666019	InChI=1S/C22H16N4O/c1-2-8-16(9-3-1)21-25-19-17-10-4-5-11-18(17)27-20(19)22(26-21)24-14-15-7-6-12-23-13-15/h1-13H,14H2,(H,24,25,26)	FRBYEGJZPFGBKQ-UHFFFAOYSA-N	C(Nc1nc(nc2c1oc3ccccc23)c4ccccc4)c5cccnc5	BroadT	BRD-K83125173	BRD-K83125173-003-07-2	InterBioScreen Ltd.	STOCK5S-31270		Cl	C(Nc1nc(nc2c3ccccc3oc12)-c1ccccc1)c1cccnc1.Cl	InChI=1S/C22H16N4O.ClH/c1-2-8-16(9-3-1)21-25-19-17-10-4-5-11-18(17)27-20(19)22(26-21)24-14-15-7-6-12-23-13-15;/h1-13H,14H2,(H,24,25,26);1H	AVTRVYMFPXMPEA-UHFFFAOYSA-N	352.132411172							104095, 104095
MLS000662211	LSM-32292	BRD-K90151990, SID24794123	1289321	InChI=1S/C18H21F3N6/c19-18(20,21)13-6-5-7-14(12-13)22-15-23-16(26-8-1-2-9-26)25-17(24-15)27-10-3-4-11-27/h5-7,12H,1-4,8-11H2,(H,22,23,24,25)	QXTGQRFFBXWBTN-UHFFFAOYSA-N	FC(F)(F)c1cccc(Nc2nc(nc(n2)N3CCCC3)N4CCCC4)c1	BroadT	BRD-K90151990	BRD-K90151990-001-06-6	ChemBridge Corporation	7740102			FC(F)(F)c1cccc(Nc2nc(nc(n2)N2CCCC2)N2CCCC2)c1	InChI=1S/C18H21F3N6/c19-18(20,21)13-6-5-7-14(12-13)22-15-23-16(26-8-1-2-9-26)25-17(24-15)27-10-3-4-11-27/h5-7,12H,1-4,8-11H2,(H,22,23,24,25)	QXTGQRFFBXWBTN-UHFFFAOYSA-N	378.177979332							120849
MLS000583082	LSM-32293	BRD-K20733942, SID17510446	12005204	InChI=1S/C16H14N4OS2/c1-9-3-6-11(7-4-9)15(21)18-16(22)17-13-10(2)5-8-12-14(13)20-23-19-12/h3-8H,1-2H3,(H2,17,18,21,22)	VFCPXLMCJBBWBV-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)NC(=S)Nc2c(C)ccc3nsnc23	BroadT	BRD-K20733942	BRD-K20733942-001-05-7	ChemDiv Inc.	C301-0692			Cc1ccc(cc1)C(=O)NC(=S)Nc1c(C)ccc2nsnc12	InChI=1S/C16H14N4OS2/c1-9-3-6-11(7-4-9)15(21)18-16(22)17-13-10(2)5-8-12-14(13)20-23-19-12/h3-8H,1-2H3,(H2,17,18,21,22)	VFCPXLMCJBBWBV-UHFFFAOYSA-N	342.060902488							120850
MLS001237819	LSM-32294	BRD-A57457448, SID51090363	24892604	InChI=1S/C18H22N4O4S2/c1-2-25-13-7-5-12(6-8-13)16(24)20-17-21-22-18(28-17)27-11-15(23)19-10-14-4-3-9-26-14/h5-8,14H,2-4,9-11H2,1H3,(H,19,23)(H,20,21,24)	CTYJCTRYAPVVBZ-UHFFFAOYSA-N	CCOc1ccc(cc1)C(=O)Nc2nnc(SCC(=O)NCC3CCCO3)s2	BroadT	BRD-A57457448	BRD-A57457448-001-05-0	Life Chemicals Inc.	F1838-1410			CCOc1ccc(cc1)C(=O)Nc1nnc(SCC(=O)NCC2CCCO2)s1	InChI=1S/C18H22N4O4S2/c1-2-25-13-7-5-12(6-8-13)16(24)20-17-21-22-18(28-17)27-11-15(23)19-10-14-4-3-9-26-14/h5-8,14H,2-4,9-11H2,1H3,(H,19,23)(H,20,21,24)	CTYJCTRYAPVVBZ-UHFFFAOYSA-N	422.108246604							120851
MLS000073457	LSM-32295	BRD-K16387460, SID842797	645070	InChI=1S/C16H14N6O/c23-15(21-10-7-12-3-1-2-4-14(12)21)11-22-19-16(18-20-22)13-5-8-17-9-6-13/h1-6,8-9H,7,10-11H2	XCGWNUBLEGFJEB-UHFFFAOYSA-N	O=C(Cn1nnc(n1)c2ccncc2)N3CCc4ccccc34	BroadT	BRD-K16387460	BRD-K16387460-001-05-0	Asinex Ltd.	ASN 04449881			O=C(Cn1nnc(n1)-c1ccncc1)N1CCc2ccccc12	InChI=1S/C16H14N6O/c23-15(21-10-7-12-3-1-2-4-14(12)21)11-22-19-16(18-20-22)13-5-8-17-9-6-13/h1-6,8-9H,7,10-11H2	XCGWNUBLEGFJEB-UHFFFAOYSA-N	306.122909128							120852
SMR000159596	LSM-32296	BRD-K01121723, SID17386606	1752640	InChI=1S/C15H15N3O5S/c1-21-10-5-2-3-6-11(10)23-9-13(19)17-18-15(24)16-14(20)12-7-4-8-22-12/h2-8H,9H2,1H3,(H,17,19)(H2,16,18,20,24)	AFGUBGJGDLCTHC-UHFFFAOYSA-N	COc1ccccc1OCC(=O)NNC(=S)NC(=O)c2occc2	BroadT	BRD-K01121723	BRD-K01121723-001-06-1	Specs	AK-968/40215937			COc1ccccc1OCC(=O)NNC(=S)NC(=O)c1ccco1	InChI=1S/C15H15N3O5S/c1-21-10-5-2-3-6-11(10)23-9-13(19)17-18-15(24)16-14(20)12-7-4-8-22-12/h2-8H,9H2,1H3,(H,17,19)(H2,16,18,20,24)	AFGUBGJGDLCTHC-UHFFFAOYSA-N	349.0732413							120853
SMR000108909	LSM-32297	SID7972416, BRD-K93933512	2920044	InChI=1S/C19H24N6O2S3/c1-24-16(12-29-19-21-14-4-2-3-5-15(14)30-19)22-23-18(24)28-13-17(26)20-6-7-25-8-10-27-11-9-25/h2-5H,6-13H2,1H3,(H,20,26)	WNHHDFPAYMIDSZ-UHFFFAOYSA-N	Cn1c(CSc2nc3ccccc3s2)nnc1SCC(=O)NCCN4CCOCC4	BroadT	BRD-K93933512	BRD-K93933512-001-06-3	ChemBridge Corporation	6945445			Cn1c(CSc2nc3ccccc3s2)nnc1SCC(=O)NCCN1CCOCC1	InChI=1S/C19H24N6O2S3/c1-24-16(12-29-19-21-14-4-2-3-5-15(14)30-19)22-23-18(24)28-13-17(26)20-6-7-25-8-10-27-11-9-25/h2-5H,6-13H2,1H3,(H,20,26)	WNHHDFPAYMIDSZ-UHFFFAOYSA-N	464.112286138							120854
SMR000016534	LSM-32298	BRD-K44483161, SID4241723	3236662	InChI=1S/C20H15N3O3S/c1-12-18(19(24)21-14-7-8-16-17(9-14)26-11-25-16)27-20-22-15(10-23(12)20)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,21,24)	ZYBGAETWDZWPMW-UHFFFAOYSA-N	Cc1c(sc2nc(cn12)c3ccccc3)C(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K44483161	BRD-K44483161-001-05-5	Life Chemicals Inc.	F0650-0088			Cc1c(sc2nc(cn12)-c1ccccc1)C(=O)Nc1ccc2OCOc2c1	InChI=1S/C20H15N3O3S/c1-12-18(19(24)21-14-7-8-16-17(9-14)26-11-25-16)27-20-22-15(10-23(12)20)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,21,24)	ZYBGAETWDZWPMW-UHFFFAOYSA-N	377.08341206							120855
SMR000074694	LSM-32299	SID4258884, BRD-K78615842	1628636	InChI=1S/C18H20N8O2S/c1-3-28-15(27)12-8-21-18(25-14(12)19)29-9-13-23-16(20)26-17(24-13)22-11-6-4-10(2)5-7-11/h4-8H,3,9H2,1-2H3,(H2,19,21,25)(H3,20,22,23,24,26)	CESOFQSQWIOBJN-UHFFFAOYSA-N	CCOC(=O)c1cnc(SCc2nc(N)nc(Nc3ccc(C)cc3)n2)nc1N	BroadT	BRD-K78615842	BRD-K78615842-001-05-8	ChemBridge Corporation	7681417			CCOC(=O)c1cnc(SCc2nc(N)nc(Nc3ccc(C)cc3)n2)nc1N	InChI=1S/C18H20N8O2S/c1-3-28-15(27)12-8-21-18(25-14(12)19)29-9-13-23-16(20)26-17(24-13)22-11-6-4-10(2)5-7-11/h4-8H,3,9H2,1-2H3,(H2,19,21,25)(H3,20,22,23,24,26)	CESOFQSQWIOBJN-UHFFFAOYSA-N	412.14299265							120856
MLS000756596	LSM-32300	BRD-K75380271, SID26664744	319257	InChI=1S/C13H18N2O/c1-9(2)13(16)15-12-7-5-11(6-8-12)14-10(3)4/h5-8,10,14H,1H2,2-4H3,(H,15,16)	SLHDOPUIZPVUFW-UHFFFAOYSA-N	CC(C)Nc1ccc(NC(=O)C(=C)C)cc1	BroadT	BRD-K75380271	BRD-K75380271-001-12-8	National Cancer Institute Chemotherapeutic Agents Repository	2-Propenamide, 2-methyl-N-[4-[(1-methylethyl)amino1phenyl]- 261610			CC(C)Nc1ccc(NC(=O)C(C)=C)cc1	InChI=1S/C13H18N2O/c1-9(2)13(16)15-12-7-5-11(6-8-12)14-10(3)4/h5-8,10,14H,1H2,2-4H3,(H,15,16)	SLHDOPUIZPVUFW-UHFFFAOYSA-N	218.141913216							120857
4,5-Dichloro-2-methyl-1-(2-phenoxyethyl)-1H-imidazole	LSM-32301	BRD-K06428422, SID26669595	1872879	InChI=1S/C12H12Cl2N2O/c1-9-15-11(13)12(14)16(9)7-8-17-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3	WWJNZYHTONLIKX-UHFFFAOYSA-N	Cc1nc(Cl)c(Cl)n1CCOc2ccccc2	BroadT	BRD-K06428422	BRD-K06428422-001-05-1	InterBioScreen Ltd.	STOCK5S-46486			Cc1nc(Cl)c(Cl)n1CCOc1ccccc1	InChI=1S/C12H12Cl2N2O/c1-9-15-11(13)12(14)16(9)7-8-17-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3	WWJNZYHTONLIKX-UHFFFAOYSA-N	270.032668444							120858
UPCMLD00WMAL2-13	LSM-32302	BRD-A08820802, SID17385305, SID24707891	5461636	InChI=1S/C25H27N3O7/c1-17-22(24(31)35-16-18-8-4-2-5-9-18)23(19-11-13-20(14-12-19)28(33)34)26-25(32)27(17)15-7-3-6-10-21(29)30/h2,4-5,8-9,11-14,23H,3,6-7,10,15-16H2,1H3,(H,26,32)(H,29,30)	RQTQCYHOOHOASI-UHFFFAOYSA-N	CC1=C(C(NC(=O)N1CCCCCC(=O)O)c2ccc(cc2)[N+](=O)[O-])C(=O)OCc3ccccc3	BroadT	BRD-A08820802	BRD-A08820802-001-06-7	University of Pittsburgh CMLD	UPCMLD00WMAL2-13			CC1=C(C(NC(=O)N1CCCCCC(O)=O)c1ccc(cc1)[N+]([O-])=O)C(=O)OCc1ccccc1	InChI=1S/C25H27N3O7/c1-17-22(24(31)35-16-18-8-4-2-5-9-18)23(19-11-13-20(14-12-19)28(33)34)26-25(32)27(17)15-7-3-6-10-21(29)30/h2,4-5,8-9,11-14,23H,3,6-7,10,15-16H2,1H3,(H,26,32)(H,29,30)	RQTQCYHOOHOASI-UHFFFAOYSA-N	481.184900234							120859
AC1MEQ3H	LSM-32303	BRD-K36941678	2882269	InChI=1S/C17H16N6O2/c1-12-11-18-21-22(12)16-7-3-14(4-8-16)13(2)19-20-15-5-9-17(10-6-15)23(24)25/h3-11,20H,1-2H3	KGLXOHXLIZALSS-UHFFFAOYSA-N	CC(=NNc1ccc(cc1)[N+](=O)[O-])c2ccc(cc2)n3nncc3C	BroadT	BRD-K36941678	BRD-K36941678-001-05-8	ChemBridge Corporation	6045615			CC(=NNc1ccc(cc1)[N+]([O-])=O)c1ccc(cc1)-n1nncc1C	InChI=1S/C17H16N6O2/c1-12-11-18-21-22(12)16-7-3-14(4-8-16)13(2)19-20-15-5-9-17(10-6-15)23(24)25/h3-11,20H,1-2H3	KGLXOHXLIZALSS-UHFFFAOYSA-N	336.133473812							120860
ZINC00535948	LSM-32304	BRD-K43624274, SID26665465	940115	InChI=1S/C16H13N3O2/c1-11-4-2-5-12(8-11)15-19-14(9-17)16(21-15)18-10-13-6-3-7-20-13/h2-8,18H,10H2,1H3	NERYIUYDDRORHT-UHFFFAOYSA-N	Cc1cccc(c1)c2oc(NCc3occc3)c(n2)C#N	BroadT	BRD-K43624274	BRD-K43624274-001-06-7	InterBioScreen Ltd.	STOCK3S-35513			Cc1cccc(c1)-c1nc(C#N)c(NCc2ccco2)o1	InChI=1S/C16H13N3O2/c1-11-4-2-5-12(8-11)15-19-14(9-17)16(21-15)18-10-13-6-3-7-20-13/h2-8,18H,10H2,1H3	NERYIUYDDRORHT-UHFFFAOYSA-N	279.100776686							120861
SMR000041424	LSM-32305	BRD-K56253099, SID859391	660688	InChI=1S/C20H34N2O8/c1-27-19(25)7-3-5-17(23)21-9-13-29-15-11-22(12-16-30-14-10-21)18(24)6-4-8-20(26)28-2/h3-16H2,1-2H3	GLDWTAOVLTUKIJ-UHFFFAOYSA-N	COC(=O)CCCC(=O)N1CCOCCN(CCOCC1)C(=O)CCCC(=O)OC	BroadT	BRD-K56253099	BRD-K56253099-001-05-4	InterBioScreen Ltd.	STOCK3S-05849			COC(=O)CCCC(=O)N1CCOCCN(CCOCC1)C(=O)CCCC(=O)OC	InChI=1S/C20H34N2O8/c1-27-19(25)7-3-5-17(23)21-9-13-29-15-11-22(12-16-30-14-10-21)18(24)6-4-8-20(26)28-2/h3-16H2,1-2H3	GLDWTAOVLTUKIJ-UHFFFAOYSA-N	430.231516068							120862
AH-487/42143929	LSM-32306	BRD-K31783598, SID14734703	1006779	InChI=1S/C16H13BrN2O4S2/c17-14-7-8-15(24-14)25(21,22)19-13-6-2-1-5-12(13)16(20)18-10-11-4-3-9-23-11/h1-9,19H,10H2,(H,18,20)	CEIDHFSEEGVCCF-UHFFFAOYSA-N	Brc1ccc(s1)S(=O)(=O)Nc2ccccc2C(=O)NCc3occc3	BroadT	BRD-K31783598	BRD-K31783598-001-06-4	ChemBridge Corporation	7700135			Brc1ccc(s1)S(=O)(=O)Nc1ccccc1C(=O)NCc1ccco1	InChI=1S/C16H13BrN2O4S2/c17-14-7-8-15(24-14)25(21,22)19-13-6-2-1-5-12(13)16(20)18-10-11-4-3-9-23-11/h1-9,19H,10H2,(H,18,20)	CEIDHFSEEGVCCF-UHFFFAOYSA-N	439.950010896							120863
MLS000038681	LSM-32307	BRD-K63859730, SID24841014, SID47193938, SID858513, SID50103477	659822	InChI=1S/C9H7F9N4OS/c1-2-6(8(13,14)15,9(16,17)18)20-4(23)19-5-22-21-3(24-5)7(10,11)12/h2H2,1H3,(H2,19,20,22,23)	QFLKFRPNISNYBS-UHFFFAOYSA-N	CCC(NC(=O)Nc1nnc(s1)C(F)(F)F)(C(F)(F)F)C(F)(F)F	BroadT	BRD-K63859730	BRD-K63859730-001-06-2	InterBioScreen Ltd.	STOCK2S-45265			CCC(NC(=O)Nc1nnc(s1)C(F)(F)F)(C(F)(F)F)C(F)(F)F	InChI=1S/C9H7F9N4OS/c1-2-6(8(13,14)15,9(16,17)18)20-4(23)19-5-22-21-3(24-5)7(10,11)12/h2H2,1H3,(H2,19,20,22,23)	QFLKFRPNISNYBS-UHFFFAOYSA-N	390.019685374							120864
MLS000092073	LSM-32308	BRD-A84764193, SID4241100	3236120	InChI=1S/C19H24N4O3S/c24-19(22-17-7-3-5-14-4-1-2-6-16(14)17)15-8-10-23(11-9-15)27(25,26)18-12-20-13-21-18/h1-2,4,6,12-13,15,17H,3,5,7-11H2,(H,20,21)(H,22,24)	PBHAFCFWZRJQJY-UHFFFAOYSA-N	O=C(NC1CCCc2ccccc12)C3CCN(CC3)S(=O)(=O)c4c[nH]cn4	BroadT	BRD-A84764193	BRD-A84764193-001-05-3	ChemDiv Inc.	C455-0484			O=C(NC1CCCc2ccccc12)C1CCN(CC1)S(=O)(=O)c1c[nH]cn1	InChI=1S/C19H24N4O3S/c24-19(22-17-7-3-5-14-4-1-2-6-16(14)17)15-8-10-23(11-9-15)27(25,26)18-12-20-13-21-18/h1-2,4,6,12-13,15,17H,3,5,7-11H2,(H,20,21)(H,22,24)	PBHAFCFWZRJQJY-UHFFFAOYSA-N	388.156911358							120865
SMR000029093	LSM-32309	BRD-K30699866, SID4241512	3236476	InChI=1S/C20H20N2O4/c1-13-10-16-18(26-13)11-17(20(24)25-2)22(16)12-19(23)21-9-5-7-14-6-3-4-8-15(14)21/h3-4,6,8,10-11H,5,7,9,12H2,1-2H3	HCNZHWJLJVQEKZ-UHFFFAOYSA-N	COC(=O)c1cc2oc(C)cc2n1CC(=O)N3CCCc4ccccc34	BroadT	BRD-K30699866	BRD-K30699866-001-05-0	ChemDiv Inc.	C777-0128			COC(=O)c1cc2oc(C)cc2n1CC(=O)N1CCCc2ccccc12	InChI=1S/C20H20N2O4/c1-13-10-16-18(26-13)11-17(20(24)25-2)22(16)12-19(23)21-9-5-7-14-6-3-4-8-15(14)21/h3-4,6,8,10-11H,5,7,9,12H2,1-2H3	HCNZHWJLJVQEKZ-UHFFFAOYSA-N	352.14230714							120866
AC1LCYVB	LSM-32310	BRD-K31242007	639603	InChI=1S/C14H11Cl2N3O2/c15-10-4-5-13(12(16)7-10)21-9-14(20)19-18-8-11-3-1-2-6-17-11/h1-8H,9H2,(H,19,20)	VCTZGXSKJCCTPE-UHFFFAOYSA-N	Clc1ccc(OCC(=O)NN=Cc2ccccn2)c(Cl)c1	BroadT	BRD-K31242007	BRD-K31242007-001-05-8	ChemBridge Corporation	5632400			Clc1ccc(OCC(=O)NN=Cc2ccccn2)c(Cl)c1	InChI=1S/C14H11Cl2N3O2/c15-10-4-5-13(12(16)7-10)21-9-14(20)19-18-8-11-3-1-2-6-17-11/h1-8H,9H2,(H,19,20)	VCTZGXSKJCCTPE-UHFFFAOYSA-N	323.022832042							120867
AMBCB55111233	LSM-32311	BRD-A64237946, SID24800587	16192256	InChI=1S/C23H23N3OS/c1-15-24-13-16(28-15)14-26-12-11-18-17-7-3-5-9-20(17)25-22(18)23(26)19-8-4-6-10-21(19)27-2/h3-10,13,23,25H,11-12,14H2,1-2H3	HMEWYFTUPMDASV-UHFFFAOYSA-N	COc1ccccc1C2N(Cc3cnc(C)s3)CCc4c2[nH]c5ccccc45	BroadT	BRD-A64237946	BRD-A64237946-001-04-7	ChemBridge Corporation	55111233			COc1ccccc1C1N(Cc2cnc(C)s2)CCc2c1[nH]c1ccccc21	InChI=1S/C23H23N3OS/c1-15-24-13-16(28-15)14-26-12-11-18-17-7-3-5-9-20(17)25-22(18)23(26)19-8-4-6-10-21(19)27-2/h3-10,13,23,25H,11-12,14H2,1-2H3	HMEWYFTUPMDASV-UHFFFAOYSA-N	389.156183076							120868
MLS000074005	LSM-32312	SID847542, BRD-K78866630	649949	InChI=1S/C21H23N3O2S/c25-20(15-27-21-23-17-10-4-6-12-19(17)26-21)22-16-9-3-5-11-18(16)24-13-7-1-2-8-14-24/h3-6,9-12H,1-2,7-8,13-15H2,(H,22,25)	YZVPKTNHPGPCIU-UHFFFAOYSA-N	O=C(CSc1oc2ccccc2n1)Nc3ccccc3N4CCCCCC4	BroadT	BRD-K78866630	BRD-K78866630-001-05-3	Asinex Ltd.	ASN 06534841			O=C(CSc1nc2ccccc2o1)Nc1ccccc1N1CCCCCC1	InChI=1S/C21H23N3O2S/c25-20(15-27-21-23-17-10-4-6-12-19(17)26-21)22-16-9-3-5-11-18(16)24-13-7-1-2-8-14-24/h3-6,9-12H,1-2,7-8,13-15H2,(H,22,25)	YZVPKTNHPGPCIU-UHFFFAOYSA-N	381.151097696							120869
MLS000112743	LSM-32313	BRD-K19645475, SID7972220	988715	InChI=1S/C19H18O7/c1-10-12(7-16(25-10)18(20)22-3)9-24-13-5-6-15-14(8-13)17(11(2)26-15)19(21)23-4/h5-8H,9H2,1-4H3	RKEHNDHIIBVEJV-UHFFFAOYSA-N	COC(=O)c1oc(C)c(COc2ccc3oc(C)c(C(=O)OC)c3c2)c1	BroadT	BRD-K19645475	BRD-K19645475-001-05-1	ChemBridge Corporation	6874158			COC(=O)c1cc(COc2ccc3oc(C)c(C(=O)OC)c3c2)c(C)o1	InChI=1S/C19H18O7/c1-10-12(7-16(25-10)18(20)22-3)9-24-13-5-6-15-14(8-13)17(11(2)26-15)19(21)23-4/h5-8H,9H2,1-4H3	RKEHNDHIIBVEJV-UHFFFAOYSA-N	358.105252916							120870
ST50139084	LSM-32314	BRD-A63342325, SID17515544	3634192	InChI=1S/C24H23N3O3S/c1-4-30-24(28)16(2)31-23-21-20(17-8-6-5-7-9-17)14-27(22(21)25-15-26-23)18-10-12-19(29-3)13-11-18/h5-16H,4H2,1-3H3	OACRKUQJSHASPK-UHFFFAOYSA-N	CCOC(=O)C(C)Sc1ncnc2c1c(cn2c3ccc(OC)cc3)c4ccccc4	BroadT	BRD-A63342325	BRD-A63342325-001-05-4	Life Chemicals Inc.	F0548-0372			CCOC(=O)C(C)Sc1ncnc2n(cc(-c3ccccc3)c12)-c1ccc(OC)cc1	InChI=1S/C24H23N3O3S/c1-4-30-24(28)16(2)31-23-21-20(17-8-6-5-7-9-17)14-27(22(21)25-15-26-23)18-10-12-19(29-3)13-11-18/h5-16H,4H2,1-3H3	OACRKUQJSHASPK-UHFFFAOYSA-N	433.146012316							120871
F1838-1250	LSM-32315	BRD-K61039403, SID24824020	16195633	InChI=1S/C17H14N4O5S2/c22-14(18-7-11-2-1-5-24-11)8-27-17-21-20-16(28-17)19-15(23)10-3-4-12-13(6-10)26-9-25-12/h1-6H,7-9H2,(H,18,22)(H,19,20,23)	LVPFTFPRHGPUHX-UHFFFAOYSA-N	O=C(CSc1nnc(NC(=O)c2ccc3OCOc3c2)s1)NCc4occc4	BroadT	BRD-K61039403	BRD-K61039403-001-06-9	Life Chemicals Inc.	F1838-1250			O=C(CSc1nnc(NC(=O)c2ccc3OCOc3c2)s1)NCc1ccco1	InChI=1S/C17H14N4O5S2/c22-14(18-7-11-2-1-5-24-11)8-27-17-21-20-16(28-17)19-15(23)10-3-4-12-13(6-10)26-9-25-12/h1-6H,7-9H2,(H,18,22)(H,19,20,23)	LVPFTFPRHGPUHX-UHFFFAOYSA-N	418.040560968							120872
T0509-5033	LSM-32316	BRD-K79561909, SID24791749	2359990	InChI=1S/C19H17ClN2O4S2/c1-12-7-8-16(26-2)15(11-12)21-19(23)13-5-3-4-6-14(13)22-28(24,25)18-10-9-17(20)27-18/h3-11,22H,1-2H3,(H,21,23)	LMBAUGFGWDFXIE-UHFFFAOYSA-N	COc1ccc(C)cc1NC(=O)c2ccccc2NS(=O)(=O)c3ccc(Cl)s3	BroadT	BRD-K79561909	BRD-K79561909-001-06-1	Enamine Ltd.	T0509-5033			COc1ccc(C)cc1NC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)s1	InChI=1S/C19H17ClN2O4S2/c1-12-7-8-16(26-2)15(11-12)21-19(23)13-5-3-4-6-14(13)22-28(24,25)18-10-9-17(20)27-18/h3-11,22H,1-2H3,(H,21,23)	LMBAUGFGWDFXIE-UHFFFAOYSA-N	436.031826134							120873
BAS 04843039	LSM-32317	BRD-K09663164, SID14727072	1075571	InChI=1S/C18H20N2O3S/c1-23-15-6-4-14(5-7-15)19-17(21)13-8-10-20(11-9-13)18(22)16-3-2-12-24-16/h2-7,12-13H,8-11H2,1H3,(H,19,21)	JIRLSPOFPGTGNG-UHFFFAOYSA-N	COc1ccc(NC(=O)C2CCN(CC2)C(=O)c3cccs3)cc1	BroadT	BRD-K09663164	BRD-K09663164-001-05-2	Asinex Ltd.	BAS 04843039			COc1ccc(NC(=O)C2CCN(CC2)C(=O)c2cccs2)cc1	InChI=1S/C18H20N2O3S/c1-23-15-6-4-14(5-7-15)19-17(21)13-8-10-20(11-9-13)18(22)16-3-2-12-24-16/h2-7,12-13H,8-11H2,1H3,(H,19,21)	JIRLSPOFPGTGNG-UHFFFAOYSA-N	344.11946321							120874
ST50765517	LSM-32318	BRD-K26634905, SID24796858	1856807	InChI=1S/C16H18N4OS/c1-11(2)12-5-7-14(8-6-12)18-16(22)20-19-15(21)13-4-3-9-17-10-13/h3-11H,1-2H3,(H,19,21)(H2,18,20,22)	PLTDUXXHYQOSGF-UHFFFAOYSA-N	CC(C)c1ccc(NC(=NNC(=O)c2cccnc2)S)cc1	BroadT	BRD-K26634905	BRD-K26634905-001-05-6	ChemBridge Corporation	7848625			CC(C)c1ccc(NC(S)=NNC(=O)c2cccnc2)cc1	InChI=1S/C16H18N4OS/c1-11(2)12-5-7-14(8-6-12)18-16(22)20-19-15(21)13-4-3-9-17-10-13/h3-11H,1-2H3,(H,19,21)(H2,18,20,22)	PLTDUXXHYQOSGF-UHFFFAOYSA-N	314.120131926							120875
STK179611	LSM-32319	BRD-K57782577, SID4250442	3244252	InChI=1S/C21H22N4O4/c1-3-28-16-11-7-5-9-14(16)24-20(26)18-19(23-13-22-18)21(27)25-15-10-6-8-12-17(15)29-4-2/h5-13H,3-4H2,1-2H3,(H,22,23)(H,24,26)(H,25,27)	SZCYGZRZCQFSST-UHFFFAOYSA-N	CCOc1ccccc1NC(=O)c2nc[nH]c2C(=O)Nc3ccccc3OCC	BroadT	BRD-K57782577	BRD-K57782577-001-05-2	ChemDiv Inc.	5208-0148			CCOc1ccccc1NC(=O)c1nc[nH]c1C(=O)Nc1ccccc1OCC	InChI=1S/C21H22N4O4/c1-3-28-16-11-7-5-9-14(16)24-20(26)18-19(23-13-22-18)21(27)25-15-10-6-8-12-17(15)29-4-2/h5-13H,3-4H2,1-2H3,(H,22,23)(H,24,26)(H,25,27)	SZCYGZRZCQFSST-UHFFFAOYSA-N	394.164105224							120876
F0098-0079	LSM-32320	BRD-K07383982, SID17514295	4653419	InChI=1S/C17H8F3N3O2S2/c18-17(19,20)14(24)13-12(11-2-1-7-26-11)22-16(27-13)23-15(25)10-5-3-9(8-21)4-6-10/h1-7H,(H,22,23,25)	XSTDPHXGYBXJLS-UHFFFAOYSA-N	FC(F)(F)C(=O)c1sc(NC(=O)c2ccc(cc2)C#N)nc1c3cccs3	BroadT	BRD-K07383982	BRD-K07383982-001-05-9	Life Chemicals Inc.	F0098-0079			FC(F)(F)C(=O)c1sc(NC(=O)c2ccc(cc2)C#N)nc1-c1cccs1	InChI=1S/C17H8F3N3O2S2/c18-17(19,20)14(24)13-12(11-2-1-7-26-11)22-16(27-13)23-15(25)10-5-3-9(8-21)4-6-10/h1-7H,(H,22,23,25)	XSTDPHXGYBXJLS-UHFFFAOYSA-N	407.001002506							120877
AC1LWL2J	LSM-44399	BRD-K66675422	1752834	InChI=1S/C15H13BrN2O2S/c16-14-8-10-15(11-9-14)21(19,20)18-17-12-4-7-13-5-2-1-3-6-13/h1-12,18H/b7-4+,17-12?	PHCSNSQVABGBHK-RCYQAAHFSA-N	Brc1ccc(cc1)S(=O)(=O)NN=C\C=C\c2ccccc2	BroadT	BRD-K66675422	BRD-K66675422-001-05-4	Specs	AK-968/40280159			Brc1ccc(cc1)S(=O)(=O)NN=C\C=C\c1ccccc1	InChI=1S/C15H13BrN2O2S/c16-14-8-10-15(11-9-14)21(19,20)18-17-12-4-7-13-5-2-1-3-6-13/h1-12,18H/b7-4+,17-12?	PHCSNSQVABGBHK-RCYQAAHFSA-N	363.988110966							
6-Bromo-2-[(3-methoxyphenoxy)methyl]-1H-imidazo[4,5-b]pyridine	LSM-44400	BRD-K17956418, SID862845	664078	InChI=1S/C14H12BrN3O2/c1-19-10-3-2-4-11(6-10)20-8-13-17-12-5-9(15)7-16-14(12)18-13/h2-7H,8H2,1H3,(H,16,17,18)	JFKNDDBIQAPPCB-UHFFFAOYSA-N	COc1cccc(OCc2nc3cc(Br)c[nH]c3n2)c1	BroadT	BRD-K17956418	BRD-K17956418-001-05-4	InterBioScreen Ltd.	STOCK4S-53588			COc1cccc(OCc2nc3cc(Br)c[nH]c3n2)c1	InChI=1S/C14H12BrN3O2/c1-19-10-3-2-4-11(6-10)20-8-13-17-12-5-9(15)7-16-14(12)18-13/h2-7H,8H2,1H3,(H,16,17,18)	JFKNDDBIQAPPCB-UHFFFAOYSA-N	333.011289254							
SMR000003354	LSM-32323	BRD-A71666580, SID26667809, SID846663	649058	InChI=1S/C25H33N7O2/c1-2-17-7-8-22-18(13-17)14-21(25(33)26-22)23(31-11-10-30-9-3-5-19(30)15-31)24-27-28-29-32(24)16-20-6-4-12-34-20/h7-8,13-14,19-20,23H,2-6,9-12,15-16H2,1H3,(H,26,33)	RPSAIRVSTJFWPO-UHFFFAOYSA-N	CCc1ccc2nc(O)c(cc2c1)C(N3CCN4CCCC4C3)c5nnnn5CC6CCCO6	BroadT	BRD-A71666580	BRD-A71666580-001-05-6	Asinex Ltd.	ASN 04418094			CCc1ccc2nc(O)c(cc2c1)C(N1CCN2CCCC2C1)c1nnnn1CC1CCCO1	InChI=1S/C25H33N7O2/c1-2-17-7-8-22-18(13-17)14-21(25(33)26-22)23(31-11-10-30-9-3-5-19(30)15-31)24-27-28-29-32(24)16-20-6-4-12-34-20/h7-8,13-14,19-20,23H,2-6,9-12,15-16H2,1H3,(H,26,33)	RPSAIRVSTJFWPO-UHFFFAOYSA-N	463.269573366							120880
F0646-4092	LSM-32324	BRD-K49681465, SID24815893	7086354	InChI=1S/C13H9FN2S/c14-9-6-7-11-12(8-9)17-13(16-11)15-10-4-2-1-3-5-10/h1-8H,(H,15,16)	LPCVVVLTUPKXIU-UHFFFAOYSA-N	Fc1ccc2nc(Nc3ccccc3)sc2c1	BroadT	BRD-K49681465	BRD-K49681465-001-05-2	Life Chemicals Inc.	F0646-4092			Fc1ccc2nc(Nc3ccccc3)sc2c1	InChI=1S/C13H9FN2S/c14-9-6-7-11-12(8-9)17-13(16-11)15-10-4-2-1-3-5-10/h1-8H,(H,15,16)	LPCVVVLTUPKXIU-UHFFFAOYSA-N	244.047047198							120881
MLS000031980	LSM-32325	BRD-K13086002, SID848007	650432	InChI=1S/C17H21N3O2S/c1-11(2)22-14(21)10-23-16-19-18-15-13-8-6-5-7-12(13)9-17(3,4)20(15)16/h5-8,11H,9-10H2,1-4H3	WLTMKDSPNQYZMV-UHFFFAOYSA-N	CC(C)OC(=O)CSc1nnc2c3ccccc3CC(C)(C)n12	BroadT	BRD-K13086002	BRD-K13086002-001-05-6	Asinex Ltd.	ASN 03108354			CC(C)OC(=O)CSc1nnc2-c3ccccc3CC(C)(C)n12	InChI=1S/C17H21N3O2S/c1-11(2)22-14(21)10-23-16-19-18-15-13-8-6-5-7-12(13)9-17(3,4)20(15)16/h5-8,11H,9-10H2,1-4H3	WLTMKDSPNQYZMV-UHFFFAOYSA-N	331.135447632							120882
MLS000549949	LSM-32326	BRD-A13210451, SID14727443	2747813	InChI=1S/C17H16N4O3S/c1-23-13-6-4-3-5-11(13)15-18-19-17-21(15)20-16(25-17)10-7-8-12(22)14(9-10)24-2/h3-9,16,20,22H,1-2H3	CSEQQWVZCXOADR-UHFFFAOYSA-N	COc1cc(ccc1O)C2Nn3c(S2)nnc3c4ccccc4OC	BroadT	BRD-A13210451	BRD-A13210451-001-07-6	Specs	AA-504/34072046			COc1cc(ccc1O)C1Nn2c(S1)nnc2-c1ccccc1OC	InChI=1S/C17H16N4O3S/c1-23-13-6-4-3-5-11(13)15-18-19-17-21(15)20-16(25-17)10-7-8-12(22)14(9-10)24-2/h3-9,16,20,22H,1-2H3	CSEQQWVZCXOADR-UHFFFAOYSA-N	356.094311102							120883
SMR000026381	LSM-32327	BRD-K55220938, SID4249243	2153108	InChI=1S/C23H21N5O2S/c1-15-8-10-17(11-9-15)28-21-18(13-24-28)22(30)26-23(25-21)31-14-20(29)27-12-4-6-16-5-2-3-7-19(16)27/h2-3,5,7-11,13H,4,6,12,14H2,1H3,(H,25,26,30)	SHNSGYDVGABRJA-UHFFFAOYSA-N	Cc1ccc(cc1)n2ncc3c(O)nc(SCC(=O)N4CCCc5ccccc45)nc23	BroadT	BRD-K55220938	BRD-K55220938-001-04-2	ChemDiv Inc.	C365-0213			Cc1ccc(cc1)-n1ncc2c1nc(SCC(=O)N1CCCc3ccccc13)[nH]c2=O	InChI=1S/C23H21N5O2S/c1-15-8-10-17(11-9-15)28-21-18(13-24-28)22(30)26-23(25-21)31-14-20(29)27-12-4-6-16-5-2-3-7-19(16)27/h2-3,5,7-11,13H,4,6,12,14H2,1H3,(H,25,26,30)	SHNSGYDVGABRJA-UHFFFAOYSA-N	431.141595652							
4-[4-(3-Chlorophenyl)piperazin-1-yl]aniline	LSM-32328	BRD-K24387453, SID22413856	1820369	InChI=1S/C16H18ClN3/c17-13-2-1-3-16(12-13)20-10-8-19(9-11-20)15-6-4-14(18)5-7-15/h1-7,12H,8-11,18H2	IBQKAPDMHHRMRH-UHFFFAOYSA-N	Nc1ccc(cc1)N2CCN(CC2)c3cccc(Cl)c3	BroadT	BRD-K24387453	BRD-K24387453-001-06-7	Specs	AQ-360/43286467			Nc1ccc(cc1)N1CCN(CC1)c1cccc(Cl)c1	InChI=1S/C16H18ClN3/c17-13-2-1-3-16(12-13)20-10-8-19(9-11-20)15-6-4-14(18)5-7-15/h1-7,12H,8-11,18H2	IBQKAPDMHHRMRH-UHFFFAOYSA-N	287.118925316							120885
SMR000201193	LSM-32329	BRD-K51754677, SID17413647	2228347	InChI=1S/C17H17ClO3S/c1-2-20-17-11-13(12-19)3-8-16(17)21-9-10-22-15-6-4-14(18)5-7-15/h3-8,11-12H,2,9-10H2,1H3	LHCPEUGCFXLWOU-UHFFFAOYSA-N	CCOc1cc(C=O)ccc1OCCSc2ccc(Cl)cc2	BroadT	BRD-K51754677	BRD-K51754677-001-05-6	ChemBridge Corporation	7955759			CCOc1cc(C=O)ccc1OCCSc1ccc(Cl)cc1	InChI=1S/C17H17ClO3S/c1-2-20-17-11-13(12-19)3-8-16(17)21-9-10-22-15-6-4-14(18)5-7-15/h3-8,11-12H,2,9-10H2,1H3	LHCPEUGCFXLWOU-UHFFFAOYSA-N	336.058692804							120886
T0520-6908	LSM-32330	BRD-K15393664, SID24827642	2424629	InChI=1S/C16H18BrNO5/c1-10-8-12(11(2)18(10)6-7-21-3)13(19)9-22-16(20)14-4-5-15(17)23-14/h4-5,8H,6-7,9H2,1-3H3	XXVVYSHKWQZBNI-UHFFFAOYSA-N	COCCn1c(C)cc(C(=O)COC(=O)c2oc(Br)cc2)c1C	BroadT	BRD-K15393664	BRD-K15393664-001-05-3	Enamine Ltd.	T0520-6908			COCCn1c(C)cc(C(=O)COC(=O)c2ccc(Br)o2)c1C	InChI=1S/C16H18BrNO5/c1-10-8-12(11(2)18(10)6-7-21-3)13(19)9-22-16(20)14-4-5-15(17)23-14/h4-5,8H,6-7,9H2,1-3H3	XXVVYSHKWQZBNI-UHFFFAOYSA-N	383.036835286							120887
ST51012903	LSM-32331	BRD-K22797212, SID4264841	686289	InChI=1S/C15H10ClFN4O2/c16-11-2-1-3-12(17)10(11)7-21-19-15(18-20-21)9-4-5-13-14(6-9)23-8-22-13/h1-6H,7-8H2	RMCVPFPCKDTWRN-UHFFFAOYSA-N	Fc1cccc(Cl)c1Cn2nnc(n2)c3ccc4OCOc4c3	BroadT	BRD-K22797212	BRD-K22797212-001-05-3	ChemBridge Corporation	6291134			Fc1cccc(Cl)c1Cn1nnc(n1)-c1ccc2OCOc2c1	InChI=1S/C15H10ClFN4O2/c16-11-2-1-3-12(17)10(11)7-21-19-15(18-20-21)9-4-5-13-14(6-9)23-8-22-13/h1-6H,7-8H2	RMCVPFPCKDTWRN-UHFFFAOYSA-N	332.04763151							120888
ZINC01241268	LSM-32332	BRD-K97929312	6759834	InChI=1S/C22H17N3O4/c26-19-11-10-15(12-20(19)27)13-23-25-21(14-29-16-6-2-1-3-7-16)24-18-9-5-4-8-17(18)22(25)28/h1-13,26-27H,14H2	XVNHNKLSZJISOP-UHFFFAOYSA-N	Oc1ccc(C=NN2C(=Nc3ccccc3C2=O)COc4ccccc4)cc1O	BroadT	BRD-K97929312	BRD-K97929312-001-05-1	InterBioScreen Ltd.	STOCK2S-74489			Oc1ccc(C=Nn2c(COc3ccccc3)nc3ccccc3c2=O)cc1O	InChI=1S/C22H17N3O4/c26-19-11-10-15(12-20(19)27)13-23-25-21(14-29-16-6-2-1-3-7-16)24-18-9-5-4-8-17(18)22(25)28/h1-13,26-27H,14H2	XVNHNKLSZJISOP-UHFFFAOYSA-N	387.121906054							
SMR000065594	LSM-32333	BRD-A47416464, SID3712792	2998165	InChI=1S/C17H15N3O2/c21-14-5-1-4-13-15(14)16(20-17(22)19-13)11-6-7-12-10(9-11)3-2-8-18-12/h2-3,6-9,16H,1,4-5H2,(H2,19,20,22)	PNIXQPQRJXJQTD-UHFFFAOYSA-N	O=C1NC(C2=C(CCCC2=O)N1)c3ccc4ncccc4c3	BroadT	BRD-A47416464	BRD-A47416464-001-05-8	Enamine Ltd.	T0502-4540			O=C1NC(c2ccc3ncccc3c2)C2=C(CCCC2=O)N1	InChI=1S/C17H15N3O2/c21-14-5-1-4-13-15(14)16(20-17(22)19-13)11-6-7-12-10(9-11)3-2-8-18-12/h2-3,6-9,16H,1,4-5H2,(H2,19,20,22)	PNIXQPQRJXJQTD-UHFFFAOYSA-N	293.11642675							120890
AC1NXAPY	LSM-32334	BRD-K48756106, SID24804060	5750144	InChI=1S/C21H21N3O2/c1-2-3-8-13-24-17-12-7-4-9-14(17)19(25)18(21(24)26)20-22-15-10-5-6-11-16(15)23-20/h4-7,9-12,25H,2-3,8,13H2,1H3,(H,22,23)	LBDKHEVUFPJWPE-UHFFFAOYSA-N	CCCCCN1C(=O)C(=C(O)c2ccccc12)c3nc4ccccc4[nH]3	BroadT	BRD-K48756106	BRD-K48756106-001-05-8	Asinex Ltd.	BAS 00141364			CCCCCn1c2ccccc2c(O)c(-c2nc3ccccc3[nH]2)c1=O	InChI=1S/C21H21N3O2/c1-2-3-8-13-24-17-12-7-4-9-14(17)19(25)18(21(24)26)20-22-15-10-5-6-11-16(15)23-20/h4-7,9-12,25H,2-3,8,13H2,1H3,(H,22,23)	LBDKHEVUFPJWPE-UHFFFAOYSA-N	347.163376942							
AH-487/42559113	LSM-32335	BRD-K13190943, SID24786001	900788	InChI=1S/C16H17NO2S/c1-12-7-3-5-9-14(12)19-11-16(18)17-13-8-4-6-10-15(13)20-2/h3-10H,11H2,1-2H3,(H,17,18)	OBYDVAPFPGBXFJ-UHFFFAOYSA-N	CSc1ccccc1NC(=O)COc2ccccc2C	BroadT	BRD-K13190943	BRD-K13190943-001-05-8	ChemBridge Corporation	7789681			CSc1ccccc1NC(=O)COc1ccccc1C	InChI=1S/C16H17NO2S/c1-12-7-3-5-9-14(12)19-11-16(18)17-13-8-4-6-10-15(13)20-2/h3-10H,11H2,1-2H3,(H,17,18)	OBYDVAPFPGBXFJ-UHFFFAOYSA-N	287.097999484							120892
AC1N2LEB	LSM-32336	BRD-K91180296, SID24827074	3999418	InChI=1S/C16H13N3O4/c1-10-6-7-15(16(18-10)19(21)22)23-9-14(20)12-8-17-13-5-3-2-4-11(12)13/h2-8,17H,9H2,1H3	UWDHEVGGPCZBIY-UHFFFAOYSA-N	Cc1ccc(OCC(=O)c2c[nH]c3ccccc23)c(n1)[N+](=O)[O-]	BroadT	BRD-K91180296	BRD-K91180296-001-05-7	Enamine Ltd.	T5216789			Cc1ccc(OCC(=O)c2c[nH]c3ccccc23)c(n1)[N+]([O-])=O	InChI=1S/C16H13N3O4/c1-10-6-7-15(16(18-10)19(21)22)23-9-14(20)12-8-17-13-5-3-2-4-11(12)13/h2-8,17H,9H2,1H3	UWDHEVGGPCZBIY-UHFFFAOYSA-N	311.090605926							120893
5423-98-3	LSM-32337	SID22406771, BRD-A71880598	5253159	InChI=1S/C17H17N3O2S/c1-10-11(2)23-17-15(10)16(19-9-20-17)18-7-12-8-21-13-5-3-4-6-14(13)22-12/h3-6,9,12H,7-8H2,1-2H3,(H,18,19,20)	WXGIXNLIJQWFLG-UHFFFAOYSA-N	Cc1sc2ncnc(NCC3COc4ccccc4O3)c2c1C	BroadT	BRD-A71880598	BRD-A71880598-001-06-1	Enamine Ltd.	T0518-4531			Cc1sc2ncnc(NCC3COc4ccccc4O3)c2c1C	InChI=1S/C17H17N3O2S/c1-10-11(2)23-17-15(10)16(19-9-20-17)18-7-12-8-21-13-5-3-4-6-14(13)22-12/h3-6,9,12H,7-8H2,1-2H3,(H,18,19,20)	WXGIXNLIJQWFLG-UHFFFAOYSA-N	327.104147504							120894
SMR000147949	LSM-32338	BRD-K60772078, SID14742558	1542071	InChI=1S/C22H27N5/c1-3-26(4-2)14-13-24-21-17-10-6-5-9-16(17)18(15-23)22-25-19-11-7-8-12-20(19)27(21)22/h7-8,11-12,24H,3-6,9-10,13-14H2,1-2H3	OPPRXNURMZWNBU-UHFFFAOYSA-N	CCN(CC)CCNc1c2CCCCc2c(C#N)c3nc4ccccc4n13	BroadT	BRD-K60772078	BRD-K60772078-001-07-8	InterBioScreen Ltd.	STOCK3S-77789			CCN(CC)CCNc1c2CCCCc2c(C#N)c2nc3ccccc3n12	InChI=1S/C22H27N5/c1-3-26(4-2)14-13-24-21-17-10-6-5-9-16(17)18(15-23)22-25-19-11-7-8-12-20(19)27(21)22/h7-8,11-12,24H,3-6,9-10,13-14H2,1-2H3	OPPRXNURMZWNBU-UHFFFAOYSA-N	361.226645914							120895
ST50110923	LSM-32339	SID4250546, BRD-A67521865	5310352	InChI=1S/C20H19FN4O/c21-16-10-8-14(9-11-16)17-13-18(15-5-2-1-3-6-15)25-20(22-17)23-19(24-25)7-4-12-26/h1-3,5-6,8-11,13,18,26H,4,7,12H2,(H,22,23,24)	DHFFKOLWNNHQHQ-UHFFFAOYSA-N	OCCCc1nc2NC(=CC(c3ccccc3)n2n1)c4ccc(F)cc4	BroadT	BRD-A67521865	BRD-A67521865-001-05-5	Life Chemicals Inc.	F1387-0111			OCCCc1nc2NC(=CC(c3ccccc3)n2n1)c1ccc(F)cc1	InChI=1S/C20H19FN4O/c21-16-10-8-14(9-11-16)17-13-18(15-5-2-1-3-6-15)25-20(22-17)23-19(24-25)7-4-12-26/h1-3,5-6,8-11,13,18,26H,4,7,12H2,(H,22,23,24)	DHFFKOLWNNHQHQ-UHFFFAOYSA-N	350.154289468							120896
T5304831	LSM-32340	SID22409207, BRD-K59747214	2575882	InChI=1S/C23H22N4S/c1-16-9-12-27(13-10-16)22-20-19(17-6-3-2-4-7-17)15-28-23(20)26-21(25-22)18-8-5-11-24-14-18/h2-8,11,14-16H,9-10,12-13H2,1H3	HKKPMGMJGFXPTP-UHFFFAOYSA-N	CC1CCN(CC1)c2nc(nc3scc(c4ccccc4)c23)c5cccnc5	BroadT	BRD-K59747214	BRD-K59747214-001-06-0	Enamine Ltd.	T5304831			CC1CCN(CC1)c1nc(nc2scc(-c3ccccc3)c12)-c1cccnc1	InChI=1S/C23H22N4S/c1-16-9-12-27(13-10-16)22-20-19(17-6-3-2-4-7-17)15-28-23(20)26-21(25-22)18-8-5-11-24-14-18/h2-8,11,14-16H,9-10,12-13H2,1H3	HKKPMGMJGFXPTP-UHFFFAOYSA-N	386.156517434							120897
MLS000042688	LSM-32341	BRD-A80035237, SID865310	666564	InChI=1S/C12H11NO4S/c14-10(15)6-9-11(16)13(12(17)18-9)7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,14,15)	XZHWHTSOQTXOTL-UHFFFAOYSA-N	OC(=O)CC1SC(=O)N(Cc2ccccc2)C1=O	BroadT	BRD-A80035237	BRD-A80035237-001-06-8	InterBioScreen Ltd.	STOCK5S-39691			OC(=O)CC1SC(=O)N(Cc2ccccc2)C1=O	InChI=1S/C12H11NO4S/c14-10(15)6-9-11(16)13(12(17)18-9)7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,14,15)	XZHWHTSOQTXOTL-UHFFFAOYSA-N	265.040878532							120898
3-Methoxy-naphthalene-2-carboxylic acid (4-hydroxy-phenyl)-amide	LSM-32342	SID49642287, BRD-K87951090	808688	InChI=1S/C18H15NO3/c1-22-17-11-13-5-3-2-4-12(13)10-16(17)18(21)19-14-6-8-15(20)9-7-14/h2-11,20H,1H3,(H,19,21)	PWMNGETXBMRAEK-UHFFFAOYSA-N	COc1cc2ccccc2cc1C(=O)Nc3ccc(O)cc3	BroadT	BRD-K87951090	BRD-K87951090-001-05-5	Asinex Ltd.	BAS 01900501			COc1cc2ccccc2cc1C(=O)Nc1ccc(O)cc1	InChI=1S/C18H15NO3/c1-22-17-11-13-5-3-2-4-12(13)10-16(17)18(21)19-14-6-8-15(20)9-7-14/h2-11,20H,1H3,(H,19,21)	PWMNGETXBMRAEK-UHFFFAOYSA-N	293.10519335							120899
AC1M5R0C	LSM-32343	BRD-K39318389	2383795	InChI=1S/C21H27N3OS/c1-15(2)11-12-25-19-8-6-18(7-9-19)14-22-24-21(26)23-20-10-5-16(3)13-17(20)4/h5-10,13-15H,11-12H2,1-4H3,(H2,23,24,26)	YVKXIXIOAZCNKR-UHFFFAOYSA-N	CC(C)CCOc1ccc(C=NN=C(S)Nc2ccc(C)cc2C)cc1	BroadT	BRD-K39318389	BRD-K39318389-001-05-6	Enamine Ltd.	T0510-6389			CC(C)CCOc1ccc(C=NN=C(S)Nc2ccc(C)cc2C)cc1	InChI=1S/C21H27N3OS/c1-15(2)11-12-25-19-8-6-18(7-9-19)14-22-24-21(26)23-20-10-5-16(3)13-17(20)4/h5-10,13-15H,11-12H2,1-4H3,(H2,23,24,26)	YVKXIXIOAZCNKR-UHFFFAOYSA-N	369.187483204							120900
SMR000092873	LSM-32344	SID7968000, BRD-K25256659	1262756	InChI=1S/C22H28N2O4/c1-15-7-6-8-18(16(15)2)23-9-11-24(12-10-23)22(25)17-13-19(26-3)21(28-5)20(14-17)27-4/h6-8,13-14H,9-12H2,1-5H3	HACLGAXVNPAGBB-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)N2CCN(CC2)c3cccc(C)c3C	BroadT	BRD-K25256659	BRD-K25256659-001-07-3	ChemDiv Inc.	8014-1110			COc1cc(cc(OC)c1OC)C(=O)N1CCN(CC1)c1cccc(C)c1C	InChI=1S/C22H28N2O4/c1-15-7-6-8-18(16(15)2)23-9-11-24(12-10-23)22(25)17-13-19(26-3)21(28-5)20(14-17)27-4/h6-8,13-14H,9-12H2,1-5H3	HACLGAXVNPAGBB-UHFFFAOYSA-N	384.204907396							120901
MLS000522360	LSM-32345	SID14735378, BRD-K39961819	9550691	InChI=1S/C20H16N4O2/c1-13-2-4-14(5-3-13)19-20(24-9-8-21-11-18(24)23-19)22-15-6-7-16-17(10-15)26-12-25-16/h2-11,22H,12H2,1H3	KXRSHNBOPLSTBF-UHFFFAOYSA-N	Cc1ccc(cc1)c2nc3cnccn3c2Nc4ccc5OCOc5c4	BroadT	BRD-K39961819	BRD-K39961819-001-05-3	ChemDiv Inc.	C169-0034			Cc1ccc(cc1)-c1nc2cnccn2c1Nc1ccc2OCOc2c1	InChI=1S/C20H16N4O2/c1-13-2-4-14(5-3-13)19-20(24-9-8-21-11-18(24)23-19)22-15-6-7-16-17(10-15)26-12-25-16/h2-11,22H,12H2,1H3	KXRSHNBOPLSTBF-UHFFFAOYSA-N	344.127325792							120902
5-Methyl-2-(4-methylpiperazin-1-yl)-1H-benzimidazole	LSM-15454	BRD-K45947503	658630	InChI=1S/C13H18N4/c1-10-3-4-11-12(9-10)15-13(14-11)17-7-5-16(2)6-8-17/h3-4,9H,5-8H2,1-2H3,(H,14,15)	PRXJRQGRALJKMP-UHFFFAOYSA-N	CN1CCN(CC1)c2nc3cc(C)ccc3[nH]2	BroadT	BRD-K45947503	BRD-K45947503-003-07-7	InterBioScreen Ltd.	STOCK1S-66686		Cl	CN1CCN(CC1)c1nc2cc(C)ccc2[nH]1.Cl	InChI=1S/C13H18N4.ClH/c1-10-3-4-11-12(9-10)15-13(14-11)17-7-5-16(2)6-8-17;/h3-4,9H,5-8H2,1-2H3,(H,14,15);1H	RUQYYVGSGCDEOM-UHFFFAOYSA-N	230.153146616							104096, 104096
T5532837	LSM-32346	BRD-K25638876, SID49729355	9120668	InChI=1S/C15H15N5O2/c1-20-14(22)11-12(19-15(20)16)17-10(13(21)18-11)8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,18,21)(H2,16,17,19)	HRJLWHUNBAQPEX-UHFFFAOYSA-N	CN1C(=Nc2nc(CCc3ccccc3)c(O)nc2C1=O)N	BroadT	BRD-K25638876	BRD-K25638876-001-05-3	Enamine Ltd.	T5532837			Cn1c(N)nc2nc(CCc3ccccc3)c(O)nc2c1=O	InChI=1S/C15H15N5O2/c1-20-14(22)11-12(19-15(20)16)17-10(13(21)18-11)8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,18,21)(H2,16,17,19)	HRJLWHUNBAQPEX-UHFFFAOYSA-N	297.12257477							120903
MLS000720165	LSM-44401	BRD-K18600476, SID24813265	1714948	InChI=1S/C16H16N2OS2/c1-3-17-12-8-6-5-7-11(12)9-10-13(17)14-15(19)18(4-2)16(20)21-14/h5-10H,3-4H2,1-2H3/b14-13+	MHMKWRMLSVEIRZ-BUHFOSPRSA-N	CCN1C(=S)S\C(=C\2/C=Cc3ccccc3N2CC)\C1=O	BroadT	BRD-K18600476	BRD-K18600476-001-06-4	ChemDiv Inc.	1439-0211			CCN1C(=S)S\C(C1=O)=C1/C=Cc2ccccc2N1CC	InChI=1S/C16H16N2OS2/c1-3-17-12-8-6-5-7-11(12)9-10-13(17)14-15(19)18(4-2)16(20)21-14/h5-10H,3-4H2,1-2H3/b14-13+	MHMKWRMLSVEIRZ-BUHFOSPRSA-N	316.070404532							
ST065660	LSM-32348	BRD-A55722685, SID4261544	2942574	InChI=1S/C10H15NO3S2/c1-8-6-11(7-9(2)14-8)16(12,13)10-4-3-5-15-10/h3-5,8-9H,6-7H2,1-2H3	FNFUHIIRUAOWNA-UHFFFAOYSA-N	CC1CN(CC(C)O1)S(=O)(=O)c2cccs2	BroadT	BRD-A55722685	BRD-A55722685-001-04-4	ChemBridge Corporation	7575230			CC1CN(CC(C)O1)S(=O)(=O)c1cccs1	InChI=1S/C10H15NO3S2/c1-8-6-11(7-9(2)14-8)16(12,13)10-4-3-5-15-10/h3-5,8-9H,6-7H2,1-2H3	FNFUHIIRUAOWNA-UHFFFAOYSA-N	261.04933473							120905
MLS000056687	LSM-32349	BRD-K76645599, SID3715311	2630328	InChI=1S/C16H16FN5OS/c1-10-7-14(15(23)9-24-16-18-19-20-21(16)3)11(2)22(10)13-6-4-5-12(17)8-13/h4-8H,9H2,1-3H3	WMPQHBDLTZKKCZ-UHFFFAOYSA-N	Cc1cc(C(=O)CSc2nnnn2C)c(C)n1c3cccc(F)c3	BroadT	BRD-K76645599	BRD-K76645599-001-05-2	Enamine Ltd.	ZU-4158516			Cc1cc(C(=O)CSc2nnnn2C)c(C)n1-c1cccc(F)c1	InChI=1S/C16H16FN5OS/c1-10-7-14(15(23)9-24-16-18-19-20-21(16)3)11(2)22(10)13-6-4-5-12(17)8-13/h4-8H,9H2,1-3H3	WMPQHBDLTZKKCZ-UHFFFAOYSA-N	345.105959072							120906
N-[4-({2-[(5-Bromofuran-2-yl)carbonyl]hydrazinyl}carbonyl)phenyl]benzamide	LSM-32350	BRD-K68072222, SID24793302	1297223	InChI=1S/C19H14BrN3O4/c20-16-11-10-15(27-16)19(26)23-22-18(25)13-6-8-14(9-7-13)21-17(24)12-4-2-1-3-5-12/h1-11H,(H,21,24)(H,22,25)(H,23,26)	MPQDYLJVMYGFRE-UHFFFAOYSA-N	Brc1oc(cc1)C(=O)NNC(=O)c2ccc(NC(=O)c3ccccc3)cc2	BroadT	BRD-K68072222	BRD-K68072222-001-05-4	ChemBridge Corporation	7804634			Brc1ccc(o1)C(=O)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1	InChI=1S/C19H14BrN3O4/c20-16-11-10-15(27-16)19(26)23-22-18(25)13-6-8-14(9-7-13)21-17(24)12-4-2-1-3-5-12/h1-11H,(H,21,24)(H,22,25)(H,23,26)	MPQDYLJVMYGFRE-UHFFFAOYSA-N	427.016768558							120907
STK614870	LSM-32351	BRD-K88016677, SID47204929	1079880	InChI=1S/C15H14ClN3O/c1-2-3-12-8-14(20)19-15(18-12)13(9-17-19)10-4-6-11(16)7-5-10/h4-9,20H,2-3H2,1H3	DUDHANRAJAQRNI-UHFFFAOYSA-N	CCCc1cc(O)n2ncc(c3ccc(Cl)cc3)c2n1	BroadT	BRD-K88016677	BRD-K88016677-001-08-1	Asinex Ltd.	BAS 05427601			CCCc1cc(O)n2ncc(-c3ccc(Cl)cc3)c2n1	InChI=1S/C15H14ClN3O/c1-2-3-12-8-14(20)19-15(18-12)13(9-17-19)10-4-6-11(16)7-5-10/h4-9,20H,2-3H2,1H3	DUDHANRAJAQRNI-UHFFFAOYSA-N	287.082539808							
MLS000052896	LSM-32352	BRD-K84246050, SID4260519	2145539	InChI=1S/C12H12N2OS/c1-8(15)10-4-2-9(3-5-10)6-11-7-14-12(13)16-11/h2-5,7H,6H2,1H3,(H2,13,14)	QILUUSGYHLELNJ-UHFFFAOYSA-N	CC(=O)c1ccc(Cc2cnc(N)s2)cc1	BroadT	BRD-K84246050	BRD-K84246050-001-07-7	ChemBridge Corporation	7990436			CC(=O)c1ccc(Cc2cnc(N)s2)cc1	InChI=1S/C12H12N2OS/c1-8(15)10-4-2-9(3-5-10)6-11-7-14-12(13)16-11/h2-5,7H,6H2,1H3,(H2,13,14)	QILUUSGYHLELNJ-UHFFFAOYSA-N	232.067033714							120909
T5212424	LSM-32353	BRD-A73590800, SID24830848	3942125	InChI=1S/C22H23N3O5/c1-22(10-9-15-5-3-2-4-6-15)20(27)25(21(28)24-22)14-19(26)23-16-7-8-17-18(13-16)30-12-11-29-17/h2-8,13H,9-12,14H2,1H3,(H,23,26)(H,24,28)	DMYQWAOHPQSQJD-UHFFFAOYSA-N	CC1(CCc2ccccc2)NC(=O)N(CC(=O)Nc3ccc4OCCOc4c3)C1=O	BroadT	BRD-A73590800	BRD-A73590800-001-05-0	Enamine Ltd.	T5212424			CC1(CCc2ccccc2)NC(=O)N(CC(=O)Nc2ccc3OCCOc3c2)C1=O	InChI=1S/C22H23N3O5/c1-22(10-9-15-5-3-2-4-6-15)20(27)25(21(28)24-22)14-19(26)23-16-7-8-17-18(13-16)30-12-11-29-17/h2-8,13H,9-12,14H2,1H3,(H,23,26)(H,24,28)	DMYQWAOHPQSQJD-UHFFFAOYSA-N	409.163770866							120910
T0515-7933	LSM-32354	BRD-K54751293, SID24783851	3549345	InChI=1S/C12H17N5O4S2/c1-7-4-5-8(23(20,21)17(2)3)6-9(7)14-12(22)16-15-11(19)10(13)18/h4-6H,1-3H3,(H2,13,18)(H,15,19)(H2,14,16,22)	JFCSHXMHEAGXLU-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(C)c(NC(=NNC(=O)C(=O)N)S)c1	BroadT	BRD-K54751293	BRD-K54751293-001-05-3	Enamine Ltd.	T0515-7933			CN(C)S(=O)(=O)c1ccc(C)c(NC(S)=NNC(=O)C(N)=O)c1	InChI=1S/C12H17N5O4S2/c1-7-4-5-8(23(20,21)17(2)3)6-9(7)14-12(22)16-15-11(19)10(13)18/h4-6H,1-3H3,(H2,13,18)(H,15,19)(H2,14,16,22)	JFCSHXMHEAGXLU-UHFFFAOYSA-N	359.072195454							120911
AK-968/41924862	LSM-32355	BRD-K91084609, SID17386448	1000436	InChI=1S/C15H12F3N3O2S/c16-9-5-7-10(8-6-9)19-15(24)21-20-13(22)11-3-1-2-4-12(11)23-14(17)18/h1-8,14H,(H,20,22)(H2,19,21,24)	QOICAJGOTUWNFD-UHFFFAOYSA-N	FC(F)Oc1ccccc1C(=O)NN=C(S)Nc2ccc(F)cc2	BroadT	BRD-K91084609	BRD-K91084609-001-05-3	Specs	AK-968/41924862			FC(F)Oc1ccccc1C(=O)NN=C(S)Nc1ccc(F)cc1	InChI=1S/C15H12F3N3O2S/c16-9-5-7-10(8-6-9)19-15(24)21-20-13(22)11-3-1-2-4-12(11)23-14(17)18/h1-8,14H,(H,20,22)(H2,19,21,24)	QOICAJGOTUWNFD-UHFFFAOYSA-N	355.060231944							120912
AC1LDSUU	LSM-32356	BRD-K36111748, SID24829591	700360	InChI=1S/C11H17N3S/c12-11(15)14-13-10-8-2-6-1-7(4-8)5-9(10)3-6/h6-9H,1-5H2,(H3,12,14,15)	GTQQBRFIPRJNNW-UHFFFAOYSA-N	NC(=NN=C1C2CC3CC(CC1C3)C2)S	BroadT	BRD-K36111748	BRD-K36111748-001-05-4	Enamine Ltd.	T0500-7506			NC(S)=NN=C1C2CC3CC(C2)CC1C3	InChI=1S/C11H17N3S/c12-11(15)14-13-10-8-2-6-1-7(4-8)5-9(10)3-6/h6-9H,1-5H2,(H3,12,14,15)	GTQQBRFIPRJNNW-UHFFFAOYSA-N	223.114318264							
NCGC00011767	LSM-3280	SID85239691, SID85146053, SID4239238, BRD-K57457519	3234345	InChI=1S/C20H17N3O/c1-14-3-2-4-15(9-14)11-21-20-18-10-16(17-7-8-24-12-17)5-6-19(18)22-13-23-20/h2-10,12-13H,11H2,1H3,(H,21,22,23)	DBTWZLIQIQEKBB-UHFFFAOYSA-N	Cc1cccc(CNc2ncnc3ccc(cc23)c4cocc4)c1	BroadT	BRD-K57457519	BRD-K57457519-001-05-2	National Institutes of Health Chemical Genomics Center	NCGC00011767-02			Cc1cccc(CNc2ncnc3ccc(cc23)-c2ccoc2)c1	InChI=1S/C20H17N3O/c1-14-3-2-4-15(9-14)11-21-20-18-10-16(17-7-8-24-12-17)5-6-19(18)22-13-23-20/h2-10,12-13H,11H2,1H3,(H,21,22,23)	DBTWZLIQIQEKBB-UHFFFAOYSA-N	315.137162194							93009
ZINC03358171	LSM-32357	BRD-K78907873, SID22407366	2475582	InChI=1S/C18H15ClN2O4/c1-11-2-4-14-12(9-24-15(14)6-11)7-18(23)25-10-17(22)21-16-5-3-13(19)8-20-16/h2-6,8-9H,7,10H2,1H3,(H,20,21,22)	COHLULXQBOSZOJ-UHFFFAOYSA-N	Cc1ccc2c(CC(=O)OCC(=O)Nc3ccc(Cl)cn3)coc2c1	BroadT	BRD-K78907873	BRD-K78907873-001-05-1	Enamine Ltd.	T5216172			Cc1ccc2c(CC(=O)OCC(=O)Nc3ccc(Cl)cn3)coc2c1	InChI=1S/C18H15ClN2O4/c1-11-2-4-14-12(9-24-15(14)6-11)7-18(23)25-10-17(22)21-16-5-3-13(19)8-20-16/h2-6,8-9H,7,10H2,1H3,(H,20,21,22)	COHLULXQBOSZOJ-UHFFFAOYSA-N	358.07203469							120914
N-[(5-Chloro-8-hydroxy-quinolin-7-yl)-(4-methoxy-phenyl)-methyl]-acetamide	LSM-32358	BRD-A81407814, SID47202972	2922086	InChI=1S/C19H17ClN2O3/c1-11(23)22-17(12-5-7-13(25-2)8-6-12)15-10-16(20)14-4-3-9-21-18(14)19(15)24/h3-10,17,24H,1-2H3,(H,22,23)	MTDGALZWYHDFPI-UHFFFAOYSA-N	COc1ccc(cc1)C(NC(=O)C)c2cc(Cl)c3cccnc3c2O	BroadT	BRD-A81407814	BRD-A81407814-001-07-7	Asinex Ltd.	BAS 01923175			COc1ccc(cc1)C(NC(C)=O)c1cc(Cl)c2cccnc2c1O	InChI=1S/C19H17ClN2O3/c1-11(23)22-17(12-5-7-13(25-2)8-6-12)15-10-16(20)14-4-3-9-21-18(14)19(15)24/h3-10,17,24H,1-2H3,(H,22,23)	MTDGALZWYHDFPI-UHFFFAOYSA-N	356.092770134							120915
N-[3-(Dimethylamino)propyl]-9H-carbazole-3-carboxamide	LSM-32359	BRD-K73176613, SID4241340	1736507	InChI=1S/C18H21N3O/c1-21(2)11-5-10-19-18(22)13-8-9-17-15(12-13)14-6-3-4-7-16(14)20-17/h3-4,6-9,12,20H,5,10-11H2,1-2H3,(H,19,22)	MDEDEXBBJJVJHL-UHFFFAOYSA-N	CN(C)CCCNC(=O)c1ccc2[nH]c3ccccc3c2c1	BroadT	BRD-K73176613	BRD-K73176613-001-05-3	ChemDiv Inc.	5816-0100			CN(C)CCCNC(=O)c1ccc2[nH]c3ccccc3c2c1	InChI=1S/C18H21N3O/c1-21(2)11-5-10-19-18(22)13-8-9-17-15(12-13)14-6-3-4-7-16(14)20-17/h3-4,6-9,12,20H,5,10-11H2,1-2H3,(H,19,22)	MDEDEXBBJJVJHL-UHFFFAOYSA-N	295.168462322							120916
F0599-0244	LSM-32360	BRD-K12925598, SID24824312	4612901	InChI=1S/C16H16N4O3S/c1-11-8-14(19-23-11)18-15(21)10-24-16-17-6-7-20(16)12-4-3-5-13(9-12)22-2/h3-9H,10H2,1-2H3,(H,18,19,21)	VPVUPMJTXCFVSR-UHFFFAOYSA-N	COc1cccc(c1)n2ccnc2SCC(=O)Nc3cc(C)on3	BroadT	BRD-K12925598	BRD-K12925598-001-05-6	Life Chemicals Inc.	F0599-0244			COc1cccc(c1)-n1ccnc1SCC(=O)Nc1cc(C)on1	InChI=1S/C16H16N4O3S/c1-11-8-14(19-23-11)18-15(21)10-24-16-17-6-7-20(16)12-4-3-5-13(9-12)22-2/h3-9H,10H2,1-2H3,(H,18,19,21)	VPVUPMJTXCFVSR-UHFFFAOYSA-N	344.094311102							120917
MLS000879405	LSM-32361	BRD-A08759443, SID26732125	16746309	InChI=1S/C31H42N2O4/c1-6-7-8-11-23-20-28(34)37-31-29(23)26(35-4)21-27(36-5)30(31)25(16-19-33-17-9-10-18-33)22-12-14-24(15-13-22)32(2)3/h12-15,20-21,25H,6-11,16-19H2,1-5H3	UJMMJZCCXLJDEZ-UHFFFAOYSA-N	CCCCCC1=CC(=O)Oc2c(C(CCN3CCCC3)c4ccc(cc4)N(C)C)c(OC)cc(OC)c12	BroadT	BRD-A08759443	BRD-A08759443-001-05-4	University of Kansas CMLD	KUC101543N			CCCCCc1cc(=O)oc2c(C(CCN3CCCC3)c3ccc(cc3)N(C)C)c(OC)cc(OC)c12	InChI=1S/C31H42N2O4/c1-6-7-8-11-23-20-28(34)37-31-29(23)26(35-4)21-27(36-5)30(31)25(16-19-33-17-9-10-18-33)22-12-14-24(15-13-22)32(2)3/h12-15,20-21,25H,6-11,16-19H2,1-5H3	UJMMJZCCXLJDEZ-UHFFFAOYSA-N	506.314457844							120918
[(1,1-Dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)methyl][4-methoxy-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]cyanamide	LSM-32362	BRD-K59957885, SID26725742	1963766	InChI=1S/C16H17N7O4S/c1-10(2)18-14-19-15(21-16(20-14)27-3)22(8-17)9-23-13(24)11-6-4-5-7-12(11)28(23,25)26/h4-7,10H,9H2,1-3H3,(H,18,19,20,21)	MRLHGQURYDSZJD-UHFFFAOYSA-N	COc1nc(NC(C)C)nc(n1)N(CN2C(=O)c3ccccc3S2(=O)=O)C#N	BroadT	BRD-K59957885	BRD-K59957885-001-06-3	InterBioScreen Ltd.	STOCK1S-23515			COc1nc(NC(C)C)nc(n1)N(CN1C(=O)c2ccccc2S1(=O)=O)C#N	InChI=1S/C16H17N7O4S/c1-10(2)18-14-19-15(21-16(20-14)27-3)22(8-17)9-23-13(24)11-6-4-5-7-12(11)28(23,25)26/h4-7,10H,9H2,1-3H3,(H,18,19,20,21)	MRLHGQURYDSZJD-UHFFFAOYSA-N	403.106272784							120919
SMR000146758	LSM-32363	BRD-K24312231, SID17401725	5391173	InChI=1S/C7H6BrN3S/c1-3-4(8)2-5-6(9-3)11-7(12)10-5/h2H,1H3,(H2,9,10,11,12)	SYOILFGOWAYSAP-UHFFFAOYSA-N	Cc1[nH]c2nc(S)nc2cc1Br	BroadT	BRD-K24312231	BRD-K24312231-001-05-6	InterBioScreen Ltd.	STOCK1S-41350			Cc1[nH]c2nc(S)nc2cc1Br	InChI=1S/C7H6BrN3S/c1-3-4(8)2-5-6(9-3)11-7(12)10-5/h2H,1H3,(H2,9,10,11,12)	SYOILFGOWAYSAP-UHFFFAOYSA-N	242.946580512							120920
MLS000539217	LSM-32364	BRD-K54872884	1231176	InChI=1S/C27H29N3O4/c1-4-33-25-15-22(17-28-30-26(31)16-21-8-6-5-7-9-21)11-13-24(25)34-18-27(32)29-23-12-10-19(2)20(3)14-23/h5-15,17H,4,16,18H2,1-3H3,(H,29,32)(H,30,31)	BONWHZNBACQUGP-UHFFFAOYSA-N	CCOc1cc(C=NNC(=O)Cc2ccccc2)ccc1OCC(=O)Nc3ccc(C)c(C)c3	BroadT	BRD-K54872884	BRD-K54872884-001-05-2	Specs	AN-988/40679750			CCOc1cc(ccc1OCC(=O)Nc1ccc(C)c(C)c1)C=NNC(=O)Cc1ccccc1	InChI=1S/C27H29N3O4/c1-4-33-25-15-22(17-28-30-26(31)16-21-8-6-5-7-9-21)11-13-24(25)34-18-27(32)29-23-12-10-19(2)20(3)14-23/h5-15,17H,4,16,18H2,1-3H3,(H,29,32)(H,30,31)	BONWHZNBACQUGP-UHFFFAOYSA-N	459.215806438							120921
3-Phenyl-6-(trifluoromethyl)-1H-pyrazolo[4,3-b]pyridine	LSM-32365	BRD-K98889734, SID24821507	1480380	InChI=1S/C13H8F3N3/c14-13(15,16)9-6-10-12(17-7-9)11(19-18-10)8-4-2-1-3-5-8/h1-7,17H	MMNAKMWOCMAJNU-UHFFFAOYSA-N	FC(F)(F)c1c[nH]c2c(nnc2c1)c3ccccc3	BroadT	BRD-K98889734	BRD-K98889734-001-05-6	Key Organics Ltd.	10H-050			FC(F)(F)c1c[nH]c2c(nnc2c1)-c1ccccc1	InChI=1S/C13H8F3N3/c14-13(15,16)9-6-10-12(17-7-9)11(19-18-10)8-4-2-1-3-5-8/h1-7,17H	MMNAKMWOCMAJNU-UHFFFAOYSA-N	263.067031886							
AC1LLN9T	LSM-44402	BRD-K30173809	1087235	InChI=1S/C21H15BrN2O5/c22-15-10-14(13-23-24-21(27)18-5-1-2-6-19(18)25)11-17(12-15)29-20(26)8-7-16-4-3-9-28-16/h1-13,25H,(H,24,27)/b8-7+,23-13?	GUJZNUYORLJTAE-CUAYFNFHSA-N	Oc1ccccc1C(=O)NN=Cc2cc(Br)cc(OC(=O)\C=C\c3occc3)c2	BroadT	BRD-K30173809	BRD-K30173809-001-10-6	Asinex Ltd.	BAS 00320363			Oc1ccccc1C(=O)NN=Cc1cc(Br)cc(OC(=O)\C=C\c2ccco2)c1	InChI=1S/C21H15BrN2O5/c22-15-10-14(13-23-24-21(27)18-5-1-2-6-19(18)25)11-17(12-15)29-20(26)8-7-16-4-3-9-28-16/h1-13,25H,(H,24,27)/b8-7+,23-13?	GUJZNUYORLJTAE-CUAYFNFHSA-N	454.0164342							
AC1LEUQQ	LSM-32367	SID24797763, BRD-K12782513	718317	InChI=1S/C18H19FN2O2S/c1-2-23-17(22)14-5-9-16(10-6-14)21-18(24)20-12-11-13-3-7-15(19)8-4-13/h3-10H,2,11-12H2,1H3,(H2,20,21,24)	DESKQVSDJBADCD-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=NCCc2ccc(F)cc2)S)cc1	BroadT	BRD-K12782513	BRD-K12782513-001-05-3	ChemBridge Corporation	7671718			CCOC(=O)c1ccc(NC(S)=NCCc2ccc(F)cc2)cc1	InChI=1S/C18H19FN2O2S/c1-2-23-17(22)14-5-9-16(10-6-14)21-18(24)20-12-11-13-3-7-15(19)8-4-13/h3-10H,2,11-12H2,1H3,(H2,20,21,24)	DESKQVSDJBADCD-UHFFFAOYSA-N	346.115126758							120924
N-(1H-Benzoimidazol-2-yl)-benzene-1,2-diamine	LSM-32368	BRD-K92524823, SID49641564	672245	InChI=1S/C13H12N4/c14-9-5-1-2-6-10(9)15-13-16-11-7-3-4-8-12(11)17-13/h1-8H,14H2,(H2,15,16,17)	ZZDGNBWCSPZNRU-UHFFFAOYSA-N	Nc1ccccc1Nc2nc3ccccc3[nH]2	BroadT	BRD-K92524823	BRD-K92524823-001-05-7	Asinex Ltd.	BAS 00547128			Nc1ccccc1Nc1nc2ccccc2[nH]1	InChI=1S/C13H12N4/c14-9-5-1-2-6-10(9)15-13-16-11-7-3-4-8-12(11)17-13/h1-8H,14H2,(H2,15,16,17)	ZZDGNBWCSPZNRU-UHFFFAOYSA-N	224.106196424							120925
SMR000131454	LSM-32369	BRD-K06152379, SID14737370	4296370	InChI=1S/C19H22N2O5S/c1-12(2)26-19(23)14-6-5-9-20-18(14)27-11-17(22)21-13-7-8-15(24-3)16(10-13)25-4/h5-10,12H,11H2,1-4H3,(H,21,22)	FZAFYEPEEIWNHD-UHFFFAOYSA-N	COc1ccc(NC(=O)CSc2ncccc2C(=O)OC(C)C)cc1OC	BroadT	BRD-K06152379	BRD-K06152379-001-05-0	ChemDiv Inc.	K786-2012			COc1ccc(NC(=O)CSc2ncccc2C(=O)OC(C)C)cc1OC	InChI=1S/C19H22N2O5S/c1-12(2)26-19(23)14-6-5-9-20-18(14)27-11-17(22)21-13-7-8-15(24-3)16(10-13)25-4/h5-10,12H,11H2,1-4H3,(H,21,22)	FZAFYEPEEIWNHD-UHFFFAOYSA-N	390.124942514							120926
ASN 07264269	LSM-32370	BRD-K93486796, SID24804600	1434102	InChI=1S/C15H16N6O2S/c1-9-6-12-19-20-15(21(12)14(16)17-9)24-8-13(22)18-10-4-3-5-11(7-10)23-2/h3-7H,8H2,1-2H3,(H2,16,17)(H,18,22)	OLSUPJRKPJAFBY-UHFFFAOYSA-N	COc1cccc(NC(=O)CSc2nnc3cc(C)nc(N)n23)c1	BroadT	BRD-K93486796	BRD-K93486796-001-05-1	Asinex Ltd.	ASN 07264269			COc1cccc(NC(=O)CSc2nnc3cc(C)nc(N)n23)c1	InChI=1S/C15H16N6O2S/c1-9-6-12-19-20-15(21(12)14(16)17-9)24-8-13(22)18-10-4-3-5-11(7-10)23-2/h3-7H,8H2,1-2H3,(H2,16,17)(H,18,22)	OLSUPJRKPJAFBY-UHFFFAOYSA-N	344.105544502							120927
F3394-0720	LSM-32371	BRD-K28433349, SID7967184	977187	InChI=1S/C14H11N3OS/c18-12(11-6-2-1-3-7-11)10-19-14-16-15-13-8-4-5-9-17(13)14/h1-9H,10H2	SJTGXXJHHAEOCA-UHFFFAOYSA-N	O=C(CSc1nnc2ccccn12)c3ccccc3	BroadT	BRD-K28433349	BRD-K28433349-001-04-8	ChemDiv Inc.	6481-7280			O=C(CSc1nnc2ccccn12)c1ccccc1	InChI=1S/C14H11N3OS/c18-12(11-6-2-1-3-7-11)10-19-14-16-15-13-8-4-5-9-17(13)14/h1-9H,10H2	SJTGXXJHHAEOCA-UHFFFAOYSA-N	269.062282692							120928
MLS000578764	LSM-32372	SID17412632, BRD-K25954314	2856523	InChI=1S/C19H20N4O2/c1-13-5-7-14(8-6-13)20-18-16(23(24)25)10-9-15-17(18)22-19(21-15)11-3-2-4-12-19/h5-10,20H,2-4,11-12H2,1H3	QXFHLLATYJOLGL-UHFFFAOYSA-N	Cc1ccc(NC2=C(C=CC3=NC4(CCCCC4)N=C23)[N+](=O)[O-])cc1	BroadT	BRD-K25954314	BRD-K25954314-001-05-4	ChemBridge Corporation	5625948			Cc1ccc(Nc2c(ccc3=NC4(CCCCC4)N=c23)[N+]([O-])=O)cc1	InChI=1S/C19H20N4O2/c1-13-5-7-14(8-6-13)20-18-16(23(24)25)10-9-15-17(18)22-19(21-15)11-3-2-4-12-19/h5-10,20H,2-4,11-12H2,1H3	QXFHLLATYJOLGL-UHFFFAOYSA-N	336.15862592							120929
SMR000060652	LSM-32373	SID3715365, BRD-K53544328	2323616	InChI=1S/C20H27N3O3S/c1-16-5-6-17(2)23(16)20-15-18(7-8-19(20)21-9-3-4-10-21)27(24,25)22-11-13-26-14-12-22/h5-8,15H,3-4,9-14H2,1-2H3	FSTBUPXNHWRBDP-UHFFFAOYSA-N	Cc1ccc(C)n1c2cc(ccc2N3CCCC3)S(=O)(=O)N4CCOCC4	BroadT	BRD-K53544328	BRD-K53544328-001-05-2	Enamine Ltd.	T0504-3589			Cc1ccc(C)n1-c1cc(ccc1N1CCCC1)S(=O)(=O)N1CCOCC1	InChI=1S/C20H27N3O3S/c1-16-5-6-17(2)23(16)20-15-18(7-8-19(20)21-9-3-4-10-21)27(24,25)22-11-13-26-14-12-22/h5-8,15H,3-4,9-14H2,1-2H3	FSTBUPXNHWRBDP-UHFFFAOYSA-N	389.177312444							120930
F5125-0089	LSM-32374	SID3716644, BRD-K45398957	2310735	InChI=1S/C18H17N3O2/c1-14-12-17(21(20-14)15-8-4-2-5-9-15)19-18(22)13-23-16-10-6-3-7-11-16/h2-12H,13H2,1H3,(H,19,22)	LUOCXXDTDABFKK-UHFFFAOYSA-N	Cc1cc(NC(=O)COc2ccccc2)n(n1)c3ccccc3	BroadT	BRD-K45398957	BRD-K45398957-001-05-2	Enamine Ltd.	T0502-5055			Cc1cc(NC(=O)COc2ccccc2)n(n1)-c1ccccc1	InChI=1S/C18H17N3O2/c1-14-12-17(21(20-14)15-8-4-2-5-9-15)19-18(22)13-23-16-10-6-3-7-11-16/h2-12H,13H2,1H3,(H,19,22)	LUOCXXDTDABFKK-UHFFFAOYSA-N	307.132076814							120931
SMR000065118	LSM-32375	SID3712803, BRD-K41662297	2611539	InChI=1S/C15H16N4O3S2/c1-22-11-6-3-2-5-10(11)16-14-17-18-15(24-14)23-9-13(21)19-8-4-7-12(19)20/h2-3,5-6H,4,7-9H2,1H3,(H,16,17)	VDABWSVDGLDYMB-UHFFFAOYSA-N	COc1ccccc1Nc2nnc(SCC(=O)N3CCCC3=O)s2	BroadT	BRD-K41662297	BRD-K41662297-001-05-4	Enamine Ltd.	ZT-6051499			COc1ccccc1Nc1nnc(SCC(=O)N2CCCC2=O)s1	InChI=1S/C15H16N4O3S2/c1-22-11-6-3-2-5-10(11)16-14-17-18-15(24-14)23-9-13(21)19-8-4-7-12(19)20/h2-3,5-6H,4,7-9H2,1H3,(H,16,17)	VDABWSVDGLDYMB-UHFFFAOYSA-N	364.066381792							120932
HMS3362P14	LSM-32376	BRD-K17416171, SID24822700	51400472	InChI=1S/C18H17N5OS/c1-10(2)7-15-22-23-16(19)13(17(24)21-18(23)25-15)8-11-9-20-14-6-4-3-5-12(11)14/h3-6,8-10,19-20H,7H2,1-2H3/b13-8-,19-16?	MFLNIGJUHNYFBE-STBHAXGISA-N	CC(C)CC1=NN2C(=NC(=O)\C(=C/c3c[nH]c4ccccc34)\C2=N)S1	BroadT	BRD-K17416171	BRD-K17416171-001-07-2	ChemDiv Inc.	4277-0021			CC(C)CC1=NN2C(S1)=NC(=O)\C(=C/c1c[nH]c3ccccc13)C2=N	InChI=1S/C18H17N5OS/c1-10(2)7-15-22-23-16(19)13(17(24)21-18(23)25-15)8-11-9-20-14-6-4-3-5-12(11)14/h3-6,8-10,19-20H,7H2,1-2H3/b13-8-,19-16?	MFLNIGJUHNYFBE-STBHAXGISA-N	351.115380904							
MLS000519029	LSM-32377	BRD-A06149038, SID14737071	6737843	InChI=1S/C29H21N3O4/c33-26(30-20-11-7-17(8-12-20)27-31-22-3-1-2-4-23(22)36-27)16-9-13-21(14-10-16)32-28(34)24-18-5-6-19(15-18)25(24)29(32)35/h1-14,18-19,24-25H,15H2,(H,30,33)	GBAMHVNDWHYNBF-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)c2oc3ccccc3n2)c4ccc(cc4)N5C(=O)C6C7CC(C=C7)C6C5=O	BroadT	BRD-A06149038	BRD-A06149038-001-05-1	ChemDiv Inc.	3226-0661			O=C(Nc1ccc(cc1)-c1nc2ccccc2o1)c1ccc(cc1)N1C(=O)C2C3CC(C=C3)C2C1=O	InChI=1S/C29H21N3O4/c33-26(30-20-11-7-17(8-12-20)27-31-22-3-1-2-4-23(22)36-27)16-9-13-21(14-10-16)32-28(34)24-18-5-6-19(15-18)25(24)29(32)35/h1-14,18-19,24-25H,15H2,(H,30,33)	GBAMHVNDWHYNBF-UHFFFAOYSA-N	475.153206182							120934
SMR000094556	LSM-32378	BRD-A11130173, SID7966878	5308493	InChI=1S/C27H30ClN3O4/c1-17(19-8-9-24-25(14-19)34-12-11-33-24)29-26(32)21-6-4-10-31(15-21)16-23-18(2)35-27(30-23)20-5-3-7-22(28)13-20/h3,5,7-9,13-14,17,21H,4,6,10-12,15-16H2,1-2H3,(H,29,32)	PHMBDSDPJJTNFK-UHFFFAOYSA-N	CC(NC(=O)C1CCCN(Cc2nc(oc2C)c3cccc(Cl)c3)C1)c4ccc5OCCOc5c4	BroadT	BRD-A11130173	BRD-A11130173-001-04-2	ChemDiv Inc.	C522-5016			CC(NC(=O)C1CCCN(Cc2nc(oc2C)-c2cccc(Cl)c2)C1)c1ccc2OCCOc2c1	InChI=1S/C27H30ClN3O4/c1-17(19-8-9-24-25(14-19)34-12-11-33-24)29-26(32)21-6-4-10-31(15-21)16-23-18(2)35-27(30-23)20-5-3-7-22(28)13-20/h3,5,7-9,13-14,17,21H,4,6,10-12,15-16H2,1-2H3,(H,29,32)	PHMBDSDPJJTNFK-UHFFFAOYSA-N	495.19248418							120935
MLS000666780	LSM-32379	BRD-K84836394, SID22415347	1536275	InChI=1S/C17H15N3O2/c1-12-7-8-15-19-16(14(11-21)17(22)20(15)10-12)18-9-13-5-3-2-4-6-13/h2-8,10-11,18H,9H2,1H3	QUIXAOYCLGSUQR-UHFFFAOYSA-N	CC1=CN2C(=NC(=C(C=O)C2=O)NCc3ccccc3)C=C1	BroadT	BRD-K84836394	BRD-K84836394-001-06-2	ChemBridge Corporation	7016763			Cc1ccc2nc(NCc3ccccc3)c(C=O)c(=O)n2c1	InChI=1S/C17H15N3O2/c1-12-7-8-15-19-16(14(11-21)17(22)20(15)10-12)18-9-13-5-3-2-4-6-13/h2-8,10-11,18H,9H2,1H3	QUIXAOYCLGSUQR-UHFFFAOYSA-N	293.11642675							120936
MLS000107983	LSM-32380	BRD-K84348716, SID7974310	1220269	InChI=1S/C24H22N2O2/c27-24(26-16-14-25(15-17-26)18-8-2-1-3-9-18)23-19-10-4-6-12-21(19)28-22-13-7-5-11-20(22)23/h1-13,23H,14-17H2	MYYHZQAOMHHQBR-UHFFFAOYSA-N	O=C(C1c2ccccc2Oc3ccccc13)N4CCN(CC4)c5ccccc5	BroadT	BRD-K84348716	BRD-K84348716-001-05-1	ChemBridge Corporation	5697693			O=C(C1c2ccccc2Oc2ccccc12)N1CCN(CC1)c1ccccc1	InChI=1S/C24H22N2O2/c27-24(26-16-14-25(15-17-26)18-8-2-1-3-9-18)23-19-10-4-6-12-21(19)28-22-13-7-5-11-20(22)23/h1-13,23H,14-17H2	MYYHZQAOMHHQBR-UHFFFAOYSA-N	370.168127964							120937
F2015-1255	LSM-32381	BRD-K74176533, SID24815532	16194643	InChI=1S/C17H12N2O3/c1-10-6-8-11(9-7-10)19-16(20)15-14(18-17(19)21)12-4-2-3-5-13(12)22-15/h2-9H,1H3,(H,18,21)	IWPFDLNJPIKXDJ-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=O)Nc3c(oc4ccccc34)C2=O	BroadT	BRD-K74176533	BRD-K74176533-001-05-9	Life Chemicals Inc.	F2015-1255			Cc1ccc(cc1)-n1c(=O)[nH]c2c3ccccc3oc2c1=O	InChI=1S/C17H12N2O3/c1-10-6-8-11(9-7-10)19-16(20)15-14(18-17(19)21)12-4-2-3-5-13(12)22-15/h2-9H,1H3,(H,18,21)	IWPFDLNJPIKXDJ-UHFFFAOYSA-N	292.084792264							120938
BAS 00170309	LSM-15511	BRD-K34447537	150861	InChI=1S/C7H15N4/c1-11-5-8-2-9(6-11)4-10(3-8)7-11/h2-7H2,1H3/q+1	ZWRDTZZCWMQVJM-UHFFFAOYSA-N	C[N+]12CN3CN(CN(C3)C1)C2	BroadT	BRD-K34447537	BRD-K34447537-005-05-0	Asinex Ltd.	BAS 00170309		I	C[N+]12CN3CN(CN(C3)C1)C2.I	InChI=1S/C7H15N4.HI/c1-11-5-8-2-9(6-11)4-10(3-8)7-11;/h2-7H2,1H3;1H/q+1;	DRVVOFZLVDYJRW-UHFFFAOYSA-N	155.12967152							104152, 104152
F1844-0117	LSM-32382	BRD-K68459574, SID7971492	5310479	InChI=1S/C15H19N3O4S/c1-10(2)11-5-7-12(8-6-11)16-23(21,22)13-9-17(3)15(20)18(4)14(13)19/h5-10,16H,1-4H3	PBGMONRFPQNYDY-UHFFFAOYSA-N	CC(C)c1ccc(NS(=O)(=O)C2=CN(C)C(=O)N(C)C2=O)cc1	BroadT	BRD-K68459574	BRD-K68459574-001-05-7	Life Chemicals Inc.	F1844-0117			CC(C)c1ccc(NS(=O)(=O)c2cn(C)c(=O)n(C)c2=O)cc1	InChI=1S/C15H19N3O4S/c1-10(2)11-5-7-12(8-6-11)16-23(21,22)13-9-17(3)15(20)18(4)14(13)19/h5-10,16H,1-4H3	PBGMONRFPQNYDY-UHFFFAOYSA-N	337.109626808							120939
SMR000060188	LSM-32383	BRD-K02274100, SID3717279	2333053	InChI=1S/C18H31N3O4S/c1-3-4-5-6-21(26(2,24)25)18(23)20-17(22)19-16-14-8-12-7-13(10-14)11-15(16)9-12/h12-16H,3-11H2,1-2H3,(H2,19,20,22,23)	MQHSAUVPLHLUJO-UHFFFAOYSA-N	CCCCCN(C(=O)NC(=O)NC1C2CC3CC(CC1C3)C2)S(=O)(=O)C	BroadT	BRD-K02274100	BRD-K02274100-001-05-2	Enamine Ltd.	T0501-3921			CCCCCN(C(=O)NC(=O)NC1C2CC3CC(C2)CC1C3)S(C)(=O)=O	InChI=1S/C18H31N3O4S/c1-3-4-5-6-21(26(2,24)25)18(23)20-17(22)19-16-14-8-12-7-13(10-14)11-15(16)9-12/h12-16H,3-11H2,1-2H3,(H2,19,20,22,23)	MQHSAUVPLHLUJO-UHFFFAOYSA-N	385.203527192							120940
BAS 07437591	LSM-32384	BRD-K97526959, SID846398	648789	InChI=1S/C22H16N2O5/c1-26-16-6-2-13(3-7-16)22-24-17-11-15(5-9-18(17)29-22)23-21(25)14-4-8-19-20(10-14)28-12-27-19/h2-11H,12H2,1H3,(H,23,25)	GZZGHLIGTODRRW-UHFFFAOYSA-N	COc1ccc(cc1)c2oc3ccc(NC(=O)c4ccc5OCOc5c4)cc3n2	BroadT	BRD-K97526959	BRD-K97526959-001-05-3	Asinex Ltd.	BAS 07437591			COc1ccc(cc1)-c1nc2cc(NC(=O)c3ccc4OCOc4c3)ccc2o1	InChI=1S/C22H16N2O5/c1-26-16-6-2-13(3-7-16)22-24-17-11-15(5-9-18(17)29-22)23-21(25)14-4-8-19-20(10-14)28-12-27-19/h2-11H,12H2,1H3,(H,23,25)	GZZGHLIGTODRRW-UHFFFAOYSA-N	388.105921632							120941
MLS000523022	LSM-32385	BRD-K10705624, SID14738670	9551530	InChI=1S/C15H10ClN5O2S2/c16-10-6-4-9(5-7-10)12-8-14(17)21(18-12)25(22,23)13-3-1-2-11-15(13)20-24-19-11/h1-8H,17H2	GRRMHMWTHQMSEH-UHFFFAOYSA-N	Nc1cc(nn1S(=O)(=O)c2cccc3nsnc23)c4ccc(Cl)cc4	BroadT	BRD-K10705624	BRD-K10705624-001-04-5	ChemDiv Inc.	C665-0034			Nc1cc(nn1S(=O)(=O)c1cccc2nsnc12)-c1ccc(Cl)cc1	InChI=1S/C15H10ClN5O2S2/c16-10-6-4-9(5-7-10)12-8-14(17)21(18-12)25(22,23)13-3-1-2-11-15(13)20-24-19-11/h1-8H,17H2	GRRMHMWTHQMSEH-UHFFFAOYSA-N	390.9964437							120942
STK000466	LSM-32386	BRD-K44426506, SID14725043	737755	InChI=1S/C20H17N5O/c1-13-5-7-16(8-6-13)25-23-18-10-14(2)17(11-19(18)24-25)22-20(26)15-4-3-9-21-12-15/h3-12H,1-2H3,(H,22,26)	WBWNVYGBLGETIH-UHFFFAOYSA-N	Cc1ccc(cc1)n2nc3cc(C)c(NC(=O)c4cccnc4)cc3n2	BroadT	BRD-K44426506	BRD-K44426506-001-05-8	Asinex Ltd.	BAS 02856232			Cc1ccc(cc1)-n1nc2cc(C)c(NC(=O)c3cccnc3)cc2n1	InChI=1S/C20H17N5O/c1-13-5-7-16(8-6-13)25-23-18-10-14(2)17(11-19(18)24-25)22-20(26)15-4-3-9-21-12-15/h3-12H,1-2H3,(H,22,26)	WBWNVYGBLGETIH-UHFFFAOYSA-N	343.143310214							120943
STK686013	LSM-32387	BRD-K59571728, SID24791968	54676489	InChI=1S/C14H8FN3O2S/c15-7-2-1-3-8(4-7)17-14-9(6-16)12-13(21-14)10(19)5-11(20)18-12/h1-5,17H,(H2,18,19,20)	QUYUSYKRTLHZPF-UHFFFAOYSA-N	Oc1cc(O)c2sc(Nc3cccc(F)c3)c(C#N)c2n1	BroadT	BRD-K59571728	BRD-K59571728-001-06-3	ChemBridge Corporation	9040662			Oc1cc(O)c2sc(Nc3cccc(F)c3)c(C#N)c2n1	InChI=1S/C14H8FN3O2S/c15-7-2-1-3-8(4-7)17-14-9(6-16)12-13(21-14)10(19)5-11(20)18-12/h1-5,17H,(H2,18,19,20)	QUYUSYKRTLHZPF-UHFFFAOYSA-N	301.032125416							120944
2-(7-Chloro-2-methyl-4H-[1,3]thiazolo[5,4-b]indol-4-yl)-n,n-diethylethanamine	LSM-15455	BRD-K40001806	1976150	InChI=1S/C16H20ClN3S/c1-4-19(5-2)8-9-20-14-7-6-12(17)10-13(14)15-16(20)21-11(3)18-15/h6-7,10H,4-5,8-9H2,1-3H3	WCIBEZJZJGVGON-UHFFFAOYSA-N	CCN(CC)CCn1c2ccc(Cl)cc2c3nc(C)sc13	BroadT	BRD-K40001806	BRD-K40001806-003-05-6	InterBioScreen Ltd.	STOCK5S-59709		Cl	CCN(CC)CCn1c2ccc(Cl)cc2c2nc(C)sc12.Cl	InChI=1S/C16H20ClN3S.ClH/c1-4-19(5-2)8-9-20-14-7-6-12(17)10-13(14)15-16(20)21-11(3)18-15;/h6-7,10H,4-5,8-9H2,1-3H3;1H	LVHHOSPRPIMJQV-UHFFFAOYSA-N	321.10664607							104097, 104097
ASN 02790790	LSM-32388	BRD-K00377328, SID26667576, SID845611	647966	InChI=1S/C19H14ClN3O3S/c20-13-5-7-14(8-6-13)25-10-18-22-23-19(26-18)27-11-12-9-17(24)21-16-4-2-1-3-15(12)16/h1-9H,10-11H2,(H,21,24)	GTYSYCWYTPLJTK-UHFFFAOYSA-N	Oc1cc(CSc2oc(COc3ccc(Cl)cc3)nn2)c4ccccc4n1	BroadT	BRD-K00377328	BRD-K00377328-001-05-1	Asinex Ltd.	ASN 02790790			Oc1cc(CSc2nnc(COc3ccc(Cl)cc3)o2)c2ccccc2n1	InChI=1S/C19H14ClN3O3S/c20-13-5-7-14(8-6-13)25-10-18-22-23-19(26-18)27-11-12-9-17(24)21-16-4-2-1-3-15(12)16/h1-9H,10-11H2,(H,21,24)	GTYSYCWYTPLJTK-UHFFFAOYSA-N	399.044439738							120945
STK133110	LSM-32389	BRD-K60131990, SID17412014	797184	InChI=1S/C16H16N2O2S/c1-11-4-2-3-5-13(11)18-16(21)17-9-12-6-7-14-15(8-12)20-10-19-14/h2-8H,9-10H2,1H3,(H2,17,18,21)	GRMBIPFDBFYYHD-UHFFFAOYSA-N	Cc1ccccc1N=C(S)NCc2ccc3OCOc3c2	BroadT	BRD-K60131990	BRD-K60131990-001-05-6	ChemBridge Corporation	6662496			Cc1ccccc1N=C(S)NCc1ccc2OCOc2c1	InChI=1S/C16H16N2O2S/c1-11-4-2-3-5-13(11)18-16(21)17-9-12-6-7-14-15(8-12)20-10-19-14/h2-8H,9-10H2,1H3,(H2,17,18,21)	GRMBIPFDBFYYHD-UHFFFAOYSA-N	300.093248462							120946
ST070332	LSM-32390	BRD-A05823365, SID845604	647959	InChI=1S/C16H13F3N2O3S/c1-3-23-15(22)9(2)25-14-10(8-20)11(16(17,18)19)7-12(21-14)13-5-4-6-24-13/h4-7,9H,3H2,1-2H3	UXXNENDSEHTONJ-UHFFFAOYSA-N	CCOC(=O)C(C)Sc1nc(cc(c1C#N)C(F)(F)F)c2occc2	BroadT	BRD-A05823365	BRD-A05823365-001-05-5	Asinex Ltd.	BAS 06901144			CCOC(=O)C(C)Sc1nc(cc(c1C#N)C(F)(F)F)-c1ccco1	InChI=1S/C16H13F3N2O3S/c1-3-23-15(22)9(2)25-14-10(8-20)11(16(17,18)19)7-12(21-14)13-5-4-6-24-13/h4-7,9H,3H2,1-2H3	UXXNENDSEHTONJ-UHFFFAOYSA-N	370.059897586							120947
N-(4-Anilinophenyl)cyclopropanecarboxamide	LSM-32391	BRD-K56408846, SID4259654	730135	InChI=1S/C16H16N2O/c19-16(12-6-7-12)18-15-10-8-14(9-11-15)17-13-4-2-1-3-5-13/h1-5,8-12,17H,6-7H2,(H,18,19)	MWPWBJOBJRJKKU-UHFFFAOYSA-N	O=C(Nc1ccc(Nc2ccccc2)cc1)C3CC3	BroadT	BRD-K56408846	BRD-K56408846-001-06-8	ChemBridge Corporation	6998794			O=C(Nc1ccc(Nc2ccccc2)cc1)C1CC1	InChI=1S/C16H16N2O/c19-16(12-6-7-12)18-15-10-8-14(9-11-15)17-13-4-2-1-3-5-13/h1-5,8-12,17H,6-7H2,(H,18,19)	MWPWBJOBJRJKKU-UHFFFAOYSA-N	252.126263152							120948
ST50021325	LSM-32392	BRD-A43164341, SID842178	644434	InChI=1S/C16H20N2O2/c1-14-10-20-16(8-11(14)5-6-15(14,16)2)13(19)18-12-4-3-7-17-9-12/h3-4,7,9,11H,5-6,8,10H2,1-2H3,(H,18,19)	NQOTWEWBZJOSEX-UHFFFAOYSA-N	CC12COC3(CC1CCC23C)C(=O)Nc4cccnc4	BroadT	BRD-A43164341	BRD-A43164341-001-05-7	Asinex Ltd.	BAS 05229282			CC12COC3(CC1CCC23C)C(=O)Nc1cccnc1	InChI=1S/C16H20N2O2/c1-14-10-20-16(8-11(14)5-6-15(14,16)2)13(19)18-12-4-3-7-17-9-12/h3-4,7,9,11H,5-6,8,10H2,1-2H3,(H,18,19)	NQOTWEWBZJOSEX-UHFFFAOYSA-N	272.1524779							120949
AC1O9C9Q	LSM-32393	BRD-K30530468	6754753	InChI=1S/C14H17N3O2/c1-14(2,3)19-13(18)17-16-9-10-8-15-12-7-5-4-6-11(10)12/h4-9,15H,1-3H3,(H,17,18)	ZXTRHVMIHVMJKJ-UHFFFAOYSA-N	CC(C)(C)OC(=O)NN=Cc1c[nH]c2ccccc12	BroadT	BRD-K30530468	BRD-K30530468-001-05-9	Specs	AG-205/07943024			CC(C)(C)OC(=O)NN=Cc1c[nH]c2ccccc12	InChI=1S/C14H17N3O2/c1-14(2,3)19-13(18)17-16-9-10-8-15-12-7-5-4-6-11(10)12/h4-9,15H,1-3H3,(H,17,18)	ZXTRHVMIHVMJKJ-UHFFFAOYSA-N	259.132076814							
MLS000573559	LSM-32394	BRD-K99302735, SID17506067	2901240	InChI=1S/C15H20N4O3S/c1-2-3-14(20)16-15(23)18-10-8-17(9-11-18)12-4-6-13(7-5-12)19(21)22/h4-7H,2-3,8-11H2,1H3,(H,16,20,23)	FVKYDVOXMWMSIC-UHFFFAOYSA-N	CCCC(=O)NC(=S)N1CCN(CC1)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K99302735	BRD-K99302735-001-05-8	ChemBridge Corporation	6525792			CCCC(=O)NC(=S)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C15H20N4O3S/c1-2-3-14(20)16-15(23)18-10-8-17(9-11-18)12-4-6-13(7-5-12)19(21)22/h4-7H,2-3,8-11H2,1H3,(H,16,20,23)	FVKYDVOXMWMSIC-UHFFFAOYSA-N	336.12561123							120951
SMR000062165	LSM-32395	BRD-K02159791, SID3716559	2999665	InChI=1S/C20H16N4O2S2/c1-24(14-7-3-2-4-8-14)17(25)13-26-20-21-18(15-9-5-11-27-15)19(22-23-20)16-10-6-12-28-16/h2-12H,13H2,1H3	FMWGSZQUFNQLNF-UHFFFAOYSA-N	CN(C(=O)COc1nnc(c2cccs2)c(n1)c3cccs3)c4ccccc4	BroadT	BRD-K02159791	BRD-K02159791-001-05-9	Enamine Ltd.	T0513-2061			CN(C(=O)COc1nnc(-c2cccs2)c(n1)-c1cccs1)c1ccccc1	InChI=1S/C20H16N4O2S2/c1-24(14-7-3-2-4-8-14)17(25)13-26-20-21-18(15-9-5-11-27-15)19(22-23-20)16-10-6-12-28-16/h2-12H,13H2,1H3	FMWGSZQUFNQLNF-UHFFFAOYSA-N	408.071467172							120952
ST50835203	LSM-32396	BRD-K30910725, SID4260594	1244286	InChI=1S/C17H19NO4/c1-12-13-4-2-3-5-14(13)22-15(12)16(19)18-8-6-17(7-9-18)20-10-11-21-17/h2-5H,6-11H2,1H3	ZEKOVYNKVUBESF-UHFFFAOYSA-N	Cc1c(oc2ccccc12)C(=O)N3CCC4(CC3)OCCO4	BroadT	BRD-K30910725	BRD-K30910725-001-05-2	ChemBridge Corporation	7944084			Cc1c(oc2ccccc12)C(=O)N1CCC2(CC1)OCCO2	InChI=1S/C17H19NO4/c1-12-13-4-2-3-5-14(13)22-15(12)16(19)18-8-6-17(7-9-18)20-10-11-21-17/h2-5H,6-11H2,1H3	ZEKOVYNKVUBESF-UHFFFAOYSA-N	301.131408098							120953
AC1LJZDX	LSM-32397	BRD-K35975002	1009177	InChI=1S/C23H24N2O4/c1-15-6-5-7-16(2)22(15)29-14-19-12-18(8-9-21(19)27-4)13-24-25-23(26)20-10-11-28-17(20)3/h5-13H,14H2,1-4H3,(H,25,26)	XKCSUIJPIDKDPV-UHFFFAOYSA-N	COc1ccc(C=NNC(=O)c2ccoc2C)cc1COc3c(C)cccc3C	BroadT	BRD-K35975002	BRD-K35975002-001-05-4	Specs	AK-968/40707597			COc1ccc(C=NNC(=O)c2ccoc2C)cc1COc1c(C)cccc1C	InChI=1S/C23H24N2O4/c1-15-6-5-7-16(2)22(15)29-14-19-12-18(8-9-21(19)27-4)13-24-25-23(26)20-10-11-28-17(20)3/h5-13H,14H2,1-4H3,(H,25,26)	XKCSUIJPIDKDPV-UHFFFAOYSA-N	392.173607268							120954
CID 40616454	LSM-32398	BRD-A78355490	40616454	InChI=1S/C15H15N3O3/c1-9(2)15(20)21-8-13(19)10(7-16)14-17-11-5-3-4-6-12(11)18-14/h3-6,9-10H,8H2,1-2H3,(H,17,18)	SFHWUEJKFVGRGR-UHFFFAOYSA-N	CC(C)C(=O)OCC(=O)C(C#N)c1nc2ccccc2[nH]1	BroadT	BRD-A78355490	BRD-A78355490-001-05-8	Enamine Ltd.	T0520-1488			CC(C)C(=O)OCC(=O)C(C#N)c1nc2ccccc2[nH]1	InChI=1S/C15H15N3O3/c1-9(2)15(20)21-8-13(19)10(7-16)14-17-11-5-3-4-6-12(11)18-14/h3-6,9-10H,8H2,1-2H3,(H,17,18)	SFHWUEJKFVGRGR-UHFFFAOYSA-N	285.11134137							120955
MLS000683583	LSM-32399	BRD-K49443464, SID24790861	16189595	InChI=1S/C26H36N4OS/c1-3-29-12-4-5-23-19-22(8-11-25(23)29)20-30(14-13-28-15-17-31-18-16-28)26(32)27-24-9-6-21(2)7-10-24/h6-11,19H,3-5,12-18,20H2,1-2H3,(H,27,32)	FOJJXKWZYROMHF-UHFFFAOYSA-N	CCN1CCCc2cc(CN(CCN3CCOCC3)C(=Nc4ccc(C)cc4)S)ccc12	BroadT	BRD-K49443464	BRD-K49443464-001-05-8	ChemDiv Inc.	K788-3591			CCN1CCCc2cc(CN(CCN3CCOCC3)C(S)=Nc3ccc(C)cc3)ccc12	InChI=1S/C26H36N4OS/c1-3-29-12-4-5-23-19-22(8-11-25(23)29)20-30(14-13-28-15-17-31-18-16-28)26(32)27-24-9-6-21(2)7-10-24/h6-11,19H,3-5,12-18,20H2,1-2H3,(H,27,32)	FOJJXKWZYROMHF-UHFFFAOYSA-N	452.260982502							120956
MLS000040759	LSM-32400	BRD-K86677819, SID862828	664061	InChI=1S/C15H14N6/c1-20-14-12(9-17-20)15-18-13(19-21(15)10-16-14)8-7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3	PBABZDHXDUJKLR-UHFFFAOYSA-N	Cn1ncc2c1ncn3nc(CCc4ccccc4)nc23	BroadT	BRD-K86677819	BRD-K86677819-001-05-7	InterBioScreen Ltd.	STOCK4S-56608			Cn1ncc2c1ncn1nc(CCc3ccccc3)nc21	InChI=1S/C15H14N6/c1-20-14-12(9-17-20)15-18-13(19-21(15)10-16-14)8-7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3	PBABZDHXDUJKLR-UHFFFAOYSA-N	278.127994508							120957
CID 78424366	LSM-32401	BRD-A65592966	78424366	InChI=1S/C15H16N2O/c16-11-13(14-9-5-2-6-10-17-14)15(18)12-7-3-1-4-8-12/h1,3-4,7-8,13H,2,5-6,9-10H2	MZDFUNVRSVIFMZ-UHFFFAOYSA-N	O=C(C(C#N)C1=NCCCCC1)c2ccccc2	BroadT	BRD-A65592966	BRD-A65592966-001-06-4	InterBioScreen Ltd.	STOCK1S-04854			O=C(C(C#N)C1=NCCCCC1)c1ccccc1	InChI=1S/C15H16N2O/c16-11-13(14-9-5-2-6-10-17-14)15(18)12-7-3-1-4-8-12/h1,3-4,7-8,13H,2,5-6,9-10H2	MZDFUNVRSVIFMZ-UHFFFAOYSA-N	240.126263152							120958
MLS000037422	LSM-32402	SID858858, BRD-K44548010	660165	InChI=1S/C16H20N2O/c1-11-5-6-13-14(9-11)17-12(2)16(13)15(19)10-18-7-3-4-8-18/h5-6,9,17H,3-4,7-8,10H2,1-2H3	ANCIBQYOGDRVEZ-UHFFFAOYSA-N	Cc1ccc2c(C(=O)CN3CCCC3)c(C)[nH]c2c1	BroadT	BRD-K44548010	BRD-K44548010-001-05-8	InterBioScreen Ltd.	STOCK2S-72921			Cc1[nH]c2cc(C)ccc2c1C(=O)CN1CCCC1	InChI=1S/C16H20N2O/c1-11-5-6-13-14(9-11)17-12(2)16(13)15(19)10-18-7-3-4-8-18/h5-6,9,17H,3-4,7-8,10H2,1-2H3	ANCIBQYOGDRVEZ-UHFFFAOYSA-N	256.15756328							120959
BRD-A78982410	LSM-32403	BRD-A78982410		InChI=1S/C21H19N5O2/c1-14-9-7-8-12-17(14)20(27)18(13-22)23-24-19-15(2)25(3)26(21(19)28)16-10-5-4-6-11-16/h4-12,18H,1-3H3	ZBKUWIWYLINKGO-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)N=NC(C#N)C(=O)c2ccccc2C)c3ccccc3	BroadT	BRD-A78982410	BRD-A78982410-001-05-6	Asinex Ltd.	BAS 00523524			Cc1c(N=NC(C#N)C(=O)c2ccccc2C)c(=O)n(-c2ccccc2)n1C	InChI=1S/C21H19N5O2/c1-14-9-7-8-12-17(14)20(27)18(13-22)23-24-19-15(2)25(3)26(21(19)28)16-10-5-4-6-11-16/h4-12,18H,1-3H3	ZBKUWIWYLINKGO-UHFFFAOYSA-N	373.153874898							120960
ST50763656	LSM-32404	SID24797843, BRD-K57734337	2946754	InChI=1S/C27H30N2OS/c30-27(23-12-6-2-7-13-23,24-14-8-3-9-15-24)25-17-20-29(21-18-25)26(31)28-19-16-22-10-4-1-5-11-22/h1-15,25,30H,16-21H2,(H,28,31)	BSFRKOHOTRBBTD-UHFFFAOYSA-N	OC(C1CCN(CC1)C(=NCCc2ccccc2)S)(c3ccccc3)c4ccccc4	BroadT	BRD-K57734337	BRD-K57734337-001-05-4	ChemBridge Corporation	7671046			OC(C1CCN(CC1)C(S)=NCCc1ccccc1)(c1ccccc1)c1ccccc1	InChI=1S/C27H30N2OS/c30-27(23-12-6-2-7-13-23,24-14-8-3-9-15-24)25-17-20-29(21-18-25)26(31)28-19-16-22-10-4-1-5-11-22/h1-15,25,30H,16-21H2,(H,28,31)	BSFRKOHOTRBBTD-UHFFFAOYSA-N	430.20788429							120961
Benzyl n-[(benzyloxy)carbonyl]glycylalanyl-4-hydroxyprolinate	LSM-32405	SID26670653, BRD-A28153253, SID4244099	3238744	InChI=1S/C25H29N3O7/c1-17(27-22(30)13-26-25(33)35-16-19-10-6-3-7-11-19)23(31)28-14-20(29)12-21(28)24(32)34-15-18-8-4-2-5-9-18/h2-11,17,20-21,29H,12-16H2,1H3,(H,26,33)(H,27,30)	WSENEVDQXCUGGQ-UHFFFAOYSA-N	CC(NC(=O)CNC(=O)OCc1ccccc1)C(=O)N2CC(O)CC2C(=O)OCc3ccccc3	BroadT	BRD-A28153253	BRD-A28153253-001-05-5	ChemDiv Inc.	6623-2028			CC(NC(=O)CNC(=O)OCc1ccccc1)C(=O)N1CC(O)CC1C(=O)OCc1ccccc1	InChI=1S/C25H29N3O7/c1-17(27-22(30)13-26-25(33)35-16-19-10-6-3-7-11-19)23(31)28-14-20(29)12-21(28)24(32)34-15-18-8-4-2-5-9-18/h2-11,17,20-21,29H,12-16H2,1H3,(H,26,33)(H,27,30)	WSENEVDQXCUGGQ-UHFFFAOYSA-N	483.200550298							120962
MLS000698632	LSM-32406	BRD-K46269666, SID24781377	843758	InChI=1S/C16H17N3S2/c1-3-5-14-9-12(10-21-14)15-17-18-16(20)19(15)13-7-4-6-11(2)8-13/h4,6-10H,3,5H2,1-2H3,(H,18,20)	ZWTHDTTXRWOJMY-UHFFFAOYSA-N	CCCc1cc(cs1)c2nnc(S)n2c3cccc(C)c3	BroadT	BRD-K46269666	BRD-K46269666-001-05-6	Specs	AK-968/41924192			CCCc1cc(cs1)-c1nnc(S)n1-c1cccc(C)c1	InChI=1S/C16H17N3S2/c1-3-5-14-9-12(10-21-14)15-17-18-16(20)19(15)13-7-4-6-11(2)8-13/h4,6-10H,3,5H2,1-2H3,(H,18,20)	ZWTHDTTXRWOJMY-UHFFFAOYSA-N	315.086388954							120963
SMR000163886	LSM-44403	BRD-K66434795, SID17387142	1796584	InChI=1S/C20H17NO/c1-13-7-10-18-17(11-13)16-9-8-15(20(22)19(16)21-18)12-14-5-3-2-4-6-14/h2-7,10-12,21H,8-9H2,1H3/b15-12-	BELRFZNMVLSEKG-QINSGFPZSA-N	Cc1ccc2[nH]c3C(=O)\C(=C/c4ccccc4)\CCc3c2c1	BroadT	BRD-K66434795	BRD-K66434795-001-05-5	Specs	AI-020/37280244			Cc1ccc2[nH]c3c(CC\C(=C\c4ccccc4)C3=O)c2c1	InChI=1S/C20H17NO/c1-13-7-10-18-17(11-13)16-9-8-15(20(22)19(16)21-18)12-14-5-3-2-4-6-14/h2-7,10-12,21H,8-9H2,1H3/b15-12-	BELRFZNMVLSEKG-QINSGFPZSA-N	287.131014174							
2-(Pyridin-4-yl)benzo[d]thiazole	LSM-32408	BRD-K41382866, SID26664487	236319	InChI=1S/C12H8N2S/c1-2-4-11-10(3-1)14-12(15-11)9-5-7-13-8-6-9/h1-8H	PDSIQRUYAXGTJG-UHFFFAOYSA-N	c1ccc2sc(nc2c1)c3ccncc3	BroadT	BRD-K41382866	BRD-K41382866-001-05-0	National Cancer Institute Chemotherapeutic Agents Repository	38712			c1ccc2sc(nc2c1)-c1ccncc1	InChI=1S/C12H8N2S/c1-2-4-11-10(3-1)14-12(15-11)9-5-7-13-8-6-9/h1-8H	PDSIQRUYAXGTJG-UHFFFAOYSA-N	212.040818966							120965
SMR000171433	LSM-44404	BRD-K50721666, SID17507644	5719932	InChI=1S/C20H17NO2/c1-13-12-14(2)21-20(23)19(13)18(22)11-10-16-8-5-7-15-6-3-4-9-17(15)16/h3-12H,1-2H3,(H,21,23)/b11-10+	LTUAOGFECIPAMP-ZHACJKMWSA-N	Cc1cc(C)c(C(=O)\C=C\c2cccc3ccccc23)c(O)n1	BroadT	BRD-K50721666	BRD-K50721666-001-06-7	Asinex Ltd.	BAS 00413526			Cc1cc(C)c(C(=O)\C=C\c2cccc3ccccc23)c(O)n1	InChI=1S/C20H17NO2/c1-13-12-14(2)21-20(23)19(13)18(22)11-10-16-8-5-7-15-6-3-4-9-17(15)16/h3-12H,1-2H3,(H,21,23)/b11-10+	LTUAOGFECIPAMP-ZHACJKMWSA-N	303.125928794							
AC1OBA78	LSM-32410	SID24814996, BRD-K32000549	6817996	InChI=1S/C22H16ClFN4OS/c23-15-7-5-6-14(12-15)13-28-19-11-4-1-8-16(19)20(21(28)29)26-27-22(30)25-18-10-3-2-9-17(18)24/h1-12,29H,13H2,(H,25,30)	YFDVIUYECSKAOK-UHFFFAOYSA-N	Oc1c(N=NC(=Nc2ccccc2F)S)c3ccccc3n1Cc4cccc(Cl)c4	BroadT	BRD-K32000549	BRD-K32000549-001-08-8	ChemDiv Inc.	K784-8260			Oc1c(N=NC(S)=Nc2ccccc2F)c2ccccc2n1Cc1cccc(Cl)c1	InChI=1S/C22H16ClFN4OS/c23-15-7-5-6-14(12-15)13-28-19-11-4-1-8-16(19)20(21(28)29)26-27-22(30)25-18-10-3-2-9-17(18)24/h1-12,29H,13H2,(H,25,30)	YFDVIUYECSKAOK-UHFFFAOYSA-N	438.071737772							
T5751620	LSM-44405	BRD-K96560179, SID22406248	2688390	InChI=1S/C18H16N2O5S/c1-12-3-6-15(7-4-12)26(22,23)25-16-8-5-13(10-17(16)24-2)9-14(11-19)18(20)21/h3-10H,1-2H3,(H2,20,21)/b14-9+	NUZCZZRTNXONGS-NTEUORMPSA-N	COc1cc(\C=C(/C#N)\C(=O)N)ccc1OS(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K96560179	BRD-K96560179-001-05-7	Enamine Ltd.	ZT-8893476			COc1cc(ccc1OS(=O)(=O)c1ccc(C)cc1)\C=C(/C#N)C(N)=O	InChI=1S/C18H16N2O5S/c1-12-3-6-15(7-4-12)26(22,23)25-16-8-5-13(10-17(16)24-2)9-14(11-19)18(20)21/h3-10H,1-2H3,(H2,20,21)/b14-9+	NUZCZZRTNXONGS-NTEUORMPSA-N	372.077992322							
ST038078	LSM-32412	SID7973605, BRD-K26582498	586998	InChI=1S/C12H14N4O2/c1-9-3-2-4-10(7-9)18-6-5-13-12(17)11-14-8-15-16-11/h2-4,7-8H,5-6H2,1H3,(H,13,17)(H,14,15,16)	NRBQTYGTSXZAJI-UHFFFAOYSA-N	Cc1cccc(OCCNC(=O)c2nc[nH]n2)c1	BroadT	BRD-K26582498	BRD-K26582498-001-05-0	ChemBridge Corporation	6803006			Cc1cccc(OCCNC(=O)c2nc[nH]n2)c1	InChI=1S/C12H14N4O2/c1-9-3-2-4-10(7-9)18-6-5-13-12(17)11-14-8-15-16-11/h2-4,7-8H,5-6H2,1H3,(H,13,17)(H,14,15,16)	NRBQTYGTSXZAJI-UHFFFAOYSA-N	246.111675728							120969
ST50012378	LSM-32413	SID842939, SID50086268, SID124876646, BRD-A03764094	645210	InChI=1S/C20H17FN2O5/c1-11-17(18(23-20(25)22-11)13-3-5-14(21)6-4-13)19(24)26-9-12-2-7-15-16(8-12)28-10-27-15/h2-8,18H,9-10H2,1H3,(H2,22,23,25)	QCGHTRAZOATGMB-UHFFFAOYSA-N	CC1=C(C(NC(=O)N1)c2ccc(F)cc2)C(=O)OCc3ccc4OCOc4c3	BroadT	BRD-A03764094	BRD-A03764094-001-09-3	Asinex Ltd.	BAS 02170363			CC1=C(C(NC(=O)N1)c1ccc(F)cc1)C(=O)OCc1ccc2OCOc2c1	InChI=1S/C20H17FN2O5/c1-11-17(18(23-20(25)22-11)13-3-5-14(21)6-4-13)19(24)26-9-12-2-7-15-16(8-12)28-10-27-15/h2-8,18H,9-10H2,1H3,(H2,22,23,25)	QCGHTRAZOATGMB-UHFFFAOYSA-N	384.112149864							120970
ST50753980	LSM-32414	BRD-K63997411, SID24794187	974996	InChI=1S/C18H21NO2/c1-18(2,3)14-10-12-16(13-11-14)21-17(20)19(4)15-8-6-5-7-9-15/h5-13H,1-4H3	OICHJZBXSCSCLW-UHFFFAOYSA-N	CN(C(=O)Oc1ccc(cc1)C(C)(C)C)c2ccccc2	BroadT	BRD-K63997411	BRD-K63997411-001-05-8	ChemBridge Corporation	7662378			CN(C(=O)Oc1ccc(cc1)C(C)(C)C)c1ccccc1	InChI=1S/C18H21NO2/c1-18(2,3)14-10-12-16(13-11-14)21-17(20)19(4)15-8-6-5-7-9-15/h5-13H,1-4H3	OICHJZBXSCSCLW-UHFFFAOYSA-N	283.157228922							120971
1M-530S	LSM-32415	BRD-K45222498, SID24817981	1489723	InChI=1S/C11H13N5OS/c1-7-3-5-8(6-4-7)13-10(17)16-9(12)14-15-11(16)18-2/h3-6H,1-2H3,(H2,12,14)(H,13,17)	MFAZQFJXOGDEOA-UHFFFAOYSA-N	CSc1nnc(N)n1C(=O)Nc2ccc(C)cc2	BroadT	BRD-K45222498	BRD-K45222498-001-06-8	Key Organics Ltd.	1M-530S			CSc1nnc(N)n1C(=O)Nc1ccc(C)cc1	InChI=1S/C11H13N5OS/c1-7-3-5-8(6-4-7)13-10(17)16-9(12)14-15-11(16)18-2/h3-6H,1-2H3,(H2,12,14)(H,13,17)	MFAZQFJXOGDEOA-UHFFFAOYSA-N	263.084080776							120972
AC1LLQDW	LSM-32416	BRD-K53095870, SID47200780	54704913	InChI=1S/C21H21ClN2O3/c1-2-13-24-17-6-4-3-5-16(17)19(25)18(21(24)27)20(26)23-12-11-14-7-9-15(22)10-8-14/h3-10,25H,2,11-13H2,1H3,(H,23,26)	YUYSPVNHYRIDBV-UHFFFAOYSA-N	CCCN1C(=O)C(=C(O)c2ccccc12)C(=O)NCCc3ccc(Cl)cc3	BroadT	BRD-K53095870	BRD-K53095870-001-05-7	Asinex Ltd.	BAS 03847997			CCCn1c2ccccc2c(O)c(C(=O)NCCc2ccc(Cl)cc2)c1=O	InChI=1S/C21H21ClN2O3/c1-2-13-24-17-6-4-3-5-16(17)19(25)18(21(24)27)20(26)23-12-11-14-7-9-15(22)10-8-14/h3-10,25H,2,11-13H2,1H3,(H,23,26)	YUYSPVNHYRIDBV-UHFFFAOYSA-N	384.124070262							120973
MLS000093556	LSM-32417	BRD-A06578049, SID4244616	3239190	InChI=1S/C16H20N2O3S/c1-4-21-16(20)13-10(3)12-14(22-13)17-11-6-5-9(2)7-8-18(11)15(12)19/h9H,4-8H2,1-3H3	YMDMAOJFSHFBBN-UHFFFAOYSA-N	CCOC(=O)c1sc2N=C3CCC(C)CCN3C(=O)c2c1C	BroadT	BRD-A06578049	BRD-A06578049-001-05-8	ChemDiv Inc.	C790-0075			CCOC(=O)c1sc2nc3CCC(C)CCn3c(=O)c2c1C	InChI=1S/C16H20N2O3S/c1-4-21-16(20)13-10(3)12-14(22-13)17-11-6-5-9(2)7-8-18(11)15(12)19/h9H,4-8H2,1-3H3	YMDMAOJFSHFBBN-UHFFFAOYSA-N	320.11946321							120974
3-(2-Thienyl)imidazo[1,5-a]pyridine	LSM-32418	BRD-K62309465, SID4262365	1266459	InChI=1S/C11H8N2S/c1-2-6-13-9(4-1)8-12-11(13)10-5-3-7-14-10/h1-8H	GIEMOICNGNRDKF-UHFFFAOYSA-N	c1ccn2c(ncc2c1)c3cccs3	BroadT	BRD-K62309465	BRD-K62309465-001-05-2	ChemBridge Corporation	7937684			c1csc(c1)-c1ncc2ccccn12	InChI=1S/C11H8N2S/c1-2-6-13-9(4-1)8-12-11(13)10-5-3-7-14-10/h1-8H	GIEMOICNGNRDKF-UHFFFAOYSA-N	200.040818966							120975
MLS000519117	LSM-44406	BRD-K94629607, SID14733438	1604314	InChI=1S/C16H13F3O5S/c1-3-23-14(21)12-11(9-7-5-4-6-8-9)24-15(25-12)10(13(20)22-2)16(17,18)19/h4-8H,3H2,1-2H3/b15-10+	SOIAWOQSOUAHMP-XNTDXEJSSA-N	CCOC(=O)C1=C(O\C(=C(\C(=O)OC)/C(F)(F)F)\S1)c2ccccc2	BroadT	BRD-K94629607	BRD-K94629607-001-05-4	ChemDiv Inc.	4157-4510			CCOC(=O)C1=C(O\C(S1)=C(\C(=O)OC)C(F)(F)F)c1ccccc1	InChI=1S/C16H13F3O5S/c1-3-23-14(21)12-11(9-7-5-4-6-8-9)24-15(25-12)10(13(20)22-2)16(17,18)19/h4-8H,3H2,1-2H3/b15-10+	SOIAWOQSOUAHMP-XNTDXEJSSA-N	374.043578806							
2,2,3,3-Tetrafluoro-n-(2H-[1,2,4]triazol-3-yl)-propionamide	LSM-32420	BRD-K81200901, SID14725269	3094068	InChI=1S/C5H4F4N4O/c6-2(7)5(8,9)3(14)12-4-10-1-11-13-4/h1-2H,(H2,10,11,12,13,14)	KYEPABKMBWLEQE-UHFFFAOYSA-N	FC(F)C(F)(F)C(=O)Nc1nc[nH]n1	BroadT	BRD-K81200901	BRD-K81200901-001-05-2	Asinex Ltd.	BAS 00167550			FC(F)C(F)(F)C(=O)Nc1nc[nH]n1	InChI=1S/C5H4F4N4O/c6-2(7)5(8,9)3(14)12-4-10-1-11-13-4/h1-2H,(H2,10,11,12,13,14)	KYEPABKMBWLEQE-UHFFFAOYSA-N	212.032123588							120977
N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide	LSM-32421	BRD-K16800391, SID26669001, SID4254982	1264516	InChI=1S/C24H22N4O5S/c29-23(25-17-8-9-20-21(13-17)32-12-11-31-20)16-34-24-27-26-22(15-33-18-5-2-1-3-6-18)28(24)14-19-7-4-10-30-19/h1-10,13H,11-12,14-16H2,(H,25,29)	GIBYBGGRZZHPJA-UHFFFAOYSA-N	O=C(CSc1nnc(COc2ccccc2)n1Cc3occc3)Nc4ccc5OCCOc5c4	BroadT	BRD-K16800391	BRD-K16800391-001-05-6	ChemBridge Corporation	7909184			O=C(CSc1nnc(COc2ccccc2)n1Cc1ccco1)Nc1ccc2OCCOc2c1	InChI=1S/C24H22N4O5S/c29-23(25-17-8-9-20-21(13-17)32-12-11-31-20)16-34-24-27-26-22(15-33-18-5-2-1-3-6-18)28(24)14-19-7-4-10-30-19/h1-10,13H,11-12,14-16H2,(H,25,29)	GIBYBGGRZZHPJA-UHFFFAOYSA-N	478.131090534							120978
8-[3-(3,4-Dimethylphenoxy)propoxy]quinoline	LSM-32422	SID17415924, BRD-K77320034	2291961	InChI=1S/C20H21NO2/c1-15-9-10-18(14-16(15)2)22-12-5-13-23-19-8-3-6-17-7-4-11-21-20(17)19/h3-4,6-11,14H,5,12-13H2,1-2H3	VTOXFJAGHCHRAY-UHFFFAOYSA-N	Cc1ccc(OCCCOc2cccc3cccnc23)cc1C	BroadT	BRD-K77320034	BRD-K77320034-001-05-4	ChemBridge Corporation	6492314			Cc1ccc(OCCCOc2cccc3cccnc23)cc1C	InChI=1S/C20H21NO2/c1-15-9-10-18(14-16(15)2)22-12-5-13-23-19-8-3-6-17-7-4-11-21-20(17)19/h3-4,6-11,14H,5,12-13H2,1-2H3	VTOXFJAGHCHRAY-UHFFFAOYSA-N	307.157228922							120979
MLS000734773	LSM-32423	SID24786137, BRD-K81124412	16188945	InChI=1S/C25H26N4O2/c1-31-23-11-6-5-10-21(23)29-16-18(15-26-29)22-14-19-17-27(20-8-3-2-4-9-20)24(30)25(19)12-7-13-28(22)25/h2-6,8-11,15-16,19,22H,7,12-14,17H2,1H3/t19-,22-,25-/m0/s1	GXTDMBWAWOCPGD-JTJYXVOQSA-N	COc1ccccc1n2cc(cn2)[C@@H]3C[C@H]4CN(C(=O)[C@]45CCCN35)c6ccccc6	BroadT	BRD-K81124412	BRD-K81124412-001-06-4	ChemBridge Corporation	87963973			COc1ccccc1-n1cc(cn1)[C@@H]1C[C@H]2CN(C(=O)[C@]22CCCN12)c1ccccc1	InChI=1S/C25H26N4O2/c1-31-23-11-6-5-10-21(23)29-16-18(15-26-29)22-14-19-17-27(20-8-3-2-4-9-20)24(30)25(19)12-7-13-28(22)25/h2-6,8-11,15-16,19,22H,7,12-14,17H2,1H3/t19-,22-,25-/m0/s1	GXTDMBWAWOCPGD-JTJYXVOQSA-N	414.205576112							120980
SMR000146761	LSM-32424	SID17401782, BRD-A74152721	2852501	InChI=1S/C24H28N2O4/c27-21(15-25-19-7-3-1-4-8-19)17-29-23-11-13-24(14-12-23)30-18-22(28)16-26-20-9-5-2-6-10-20/h1-14,21-22,25-28H,15-18H2	JMWPJVLDRFGSNE-UHFFFAOYSA-N	OC(CNc1ccccc1)COc2ccc(OCC(O)CNc3ccccc3)cc2	BroadT	BRD-A74152721	BRD-A74152721-001-06-2	InterBioScreen Ltd.	STOCK1S-08231			OC(CNc1ccccc1)COc1ccc(OCC(O)CNc2ccccc2)cc1	InChI=1S/C24H28N2O4/c27-21(15-25-19-7-3-1-4-8-19)17-29-23-11-13-24(14-12-23)30-18-22(28)16-26-20-9-5-2-6-10-20/h1-14,21-22,25-28H,15-18H2	JMWPJVLDRFGSNE-UHFFFAOYSA-N	408.204907396							120981
AC1M1J1F	LSM-32425	BRD-K39013648, SID22407375	2098765	InChI=1S/C21H35N3S/c1-20(2,3)16-21(4,5)23-19(25)22-18-11-13-24(14-12-18)15-17-9-7-6-8-10-17/h6-10,18H,11-16H2,1-5H3,(H2,22,23,25)	HNUKTONMTDKSNL-UHFFFAOYSA-N	CC(C)(C)CC(C)(C)N=C(S)NC1CCN(Cc2ccccc2)CC1	BroadT	BRD-K39013648	BRD-K39013648-001-05-0	Enamine Ltd.	T5231510			CC(C)(C)CC(C)(C)N=C(S)NC1CCN(Cc2ccccc2)CC1	InChI=1S/C21H35N3S/c1-20(2,3)16-21(4,5)23-19(25)22-18-11-13-24(14-12-18)15-17-9-7-6-8-10-17/h6-10,18H,11-16H2,1-5H3,(H2,22,23,25)	HNUKTONMTDKSNL-UHFFFAOYSA-N	361.25516884							120982
MLS000325320	LSM-32426	BRD-K44212150, SID17386581	979677	InChI=1S/C18H20BrNO4/c1-3-22-18-14(19)8-12(9-17(18)21-2)11-20-13-4-5-15-16(10-13)24-7-6-23-15/h4-5,8-10,20H,3,6-7,11H2,1-2H3	BQFZEMZEPDSJKL-UHFFFAOYSA-N	CCOc1c(Br)cc(CNc2ccc3OCCOc3c2)cc1OC	BroadT	BRD-K44212150	BRD-K44212150-001-07-7	Specs	AP-970/42525278			CCOc1c(Br)cc(CNc2ccc3OCCOc3c2)cc1OC	InChI=1S/C18H20BrNO4/c1-3-22-18-14(19)8-12(9-17(18)21-2)11-20-13-4-5-15-16(10-13)24-7-6-23-15/h4-5,8-10,20H,3,6-7,11H2,1-2H3	BQFZEMZEPDSJKL-UHFFFAOYSA-N	393.05757073							120983
BAS 02060208	LSM-44407	BRD-K63743653, SID17509023	2270699	InChI=1S/C15H15NO4/c1-4-7-16-10(2)13(15(18)19-3)12(14(16)17)9-11-6-5-8-20-11/h4-6,8-9H,1,7H2,2-3H3/b12-9-	VMENVCZAAQCXDC-XFXZXTDPSA-N	COC(=O)C1=C(C)N(CC=C)C(=O)/C/1=C\c2occc2	BroadT	BRD-K63743653	BRD-K63743653-001-06-1	Asinex Ltd.	BAS 02060208			COC(=O)C1=C(C)N(CC=C)C(=O)C\1=C/c1ccco1	InChI=1S/C15H15NO4/c1-4-7-16-10(2)13(15(18)19-3)12(14(16)17)9-11-6-5-8-20-11/h4-6,8-9H,1,7H2,2-3H3/b12-9-	VMENVCZAAQCXDC-XFXZXTDPSA-N	273.10010797							
TCMDC-124529	LSM-32428	BRD-K69468381	2355923	InChI=1S/C18H18N6O2/c1-11-14-10-13(26-2)8-9-15(14)22-17(20-11)23-16(19)24-18(25)21-12-6-4-3-5-7-12/h3-10H,1-2H3,(H4,19,20,21,22,23,24,25)	XAVPMMOTFNOEMA-UHFFFAOYSA-N	COc1ccc2nc(N=C(N)NC(=O)Nc3ccccc3)nc(C)c2c1	BroadT	BRD-K69468381	BRD-K69468381-001-06-8	ChemBridge Corporation	6194792			COc1ccc2nc(N=C(N)NC(=O)Nc3ccccc3)nc(C)c2c1	InChI=1S/C18H18N6O2/c1-11-14-10-13(26-2)8-9-15(14)22-17(20-11)23-16(19)24-18(25)21-12-6-4-3-5-7-12/h3-10H,1-2H3,(H4,19,20,21,22,23,24,25)	XAVPMMOTFNOEMA-UHFFFAOYSA-N	350.149123876							120985
AC1NIUU7	LSM-32429	BRD-A55408860, SID24834536	4837090	InChI=1S/C22H25ClN2O6S/c23-20-8-5-17(14-21(20)32(27,28)25-9-12-29-13-10-25)24-22(26)16-3-6-18(7-4-16)31-15-19-2-1-11-30-19/h3-8,14,19H,1-2,9-13,15H2,(H,24,26)	SOXGIBOLZDEWNB-UHFFFAOYSA-N	Clc1ccc(NC(=O)c2ccc(OCC3CCCO3)cc2)cc1S(=O)(=O)N4CCOCC4	BroadT	BRD-A55408860	BRD-A55408860-001-06-2	Enamine Ltd.	T5310112			Clc1ccc(NC(=O)c2ccc(OCC3CCCO3)cc2)cc1S(=O)(=O)N1CCOCC1	InChI=1S/C22H25ClN2O6S/c23-20-8-5-17(14-21(20)32(27,28)25-9-12-29-13-10-25)24-22(26)16-3-6-18(7-4-16)31-15-19-2-1-11-30-19/h3-8,14,19H,1-2,9-13,15H2,(H,24,26)	SOXGIBOLZDEWNB-UHFFFAOYSA-N	480.11218494							120986
ST50889435	LSM-32430	BRD-K32506050, SID24783745	2965779	InChI=1S/C27H23BrN4O2/c1-18(33)19-4-7-22(8-5-19)31-11-13-32(14-12-31)27(34)24-16-26(20-3-2-10-29-17-20)30-25-9-6-21(28)15-23(24)25/h2-10,15-17H,11-14H2,1H3	FQQYAYZCVFCEAZ-UHFFFAOYSA-N	CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3cc(nc4ccc(Br)cc34)c5cccnc5	BroadT	BRD-K32506050	BRD-K32506050-001-06-9	ChemBridge Corporation	7924363			CC(=O)c1ccc(cc1)N1CCN(CC1)C(=O)c1cc(nc2ccc(Br)cc12)-c1cccnc1	InChI=1S/C27H23BrN4O2/c1-18(33)19-4-7-22(8-5-19)31-11-13-32(14-12-31)27(34)24-16-26(20-3-2-10-29-17-20)30-25-9-6-21(28)15-23(24)25/h2-10,15-17H,11-14H2,1H3	FQQYAYZCVFCEAZ-UHFFFAOYSA-N	514.100438616							120987
4-[(4-Phenyl-2-thiazolyl)amino]-benzenesulfonamide	LSM-15237	BRD-K14813771	768056	InChI=1S/C15H13N3O2S2/c16-22(19,20)13-8-6-12(7-9-13)17-15-18-14(10-21-15)11-4-2-1-3-5-11/h1-10H,(H,17,18)(H2,16,19,20)	KFJKXRMGGSTLSO-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(Nc2nc(cs2)c3ccccc3)cc1	BroadT	BRD-K14813771	BRD-K14813771-004-06-3	Asinex Ltd.	BAS 01247396		Br	NS(=O)(=O)c1ccc(Nc2nc(cs2)-c2ccccc2)cc1.Br	InChI=1S/C15H13N3O2S2.BrH/c16-22(19,20)13-8-6-12(7-9-13)17-15-18-14(10-21-15)11-4-2-1-3-5-11;/h1-10H,(H,17,18)(H2,16,19,20);1H	ZVGKLEPFHFLOOM-UHFFFAOYSA-N	331.044918066							103884, 103884
MLS000438651	LSM-4441	BRD-A47137250, SID104232268, SID26755978, SID46500177	16759709	InChI=1S/C26H23NO6S/c1-26(33-25(31)21-11-7-13-34-21)22(28)15-17-14-19(10-6-12-23(29)32-2)27(16-20(17)24(26)30)18-8-4-3-5-9-18/h3-5,7-9,11,13-16H,6,10,12H2,1-2H3	CEQQMHJEJHSRJU-UHFFFAOYSA-N	COC(=O)CCCC1=CC2=CC(=O)C(C)(OC(=O)c3cccs3)C(=O)C2=CN1c4ccccc4	BroadT	BRD-A47137250	BRD-A47137250-001-06-6	Boston University CMLD	CMLD004299 CMLD004299			COC(=O)CCCC1=CC2=CC(=O)C(C)(OC(=O)c3cccs3)C(=O)C2=CN1c1ccccc1	InChI=1S/C26H23NO6S/c1-26(33-25(31)21-11-7-13-34-21)22(28)15-17-14-19(10-6-12-23(29)32-2)27(16-20(17)24(26)30)18-8-4-3-5-9-18/h3-5,7-9,11,13-16H,6,10,12H2,1-2H3	CEQQMHJEJHSRJU-UHFFFAOYSA-N	477.124608156							93867
AC1LTGWL	LSM-32431	BRD-K58193973	1560352	InChI=1S/C14H15ClN2O3/c1-8-3-4-10(9(2)7-8)17-13(19)11(15)12(14(17)20)16-5-6-18/h3-4,7,16,18H,5-6H2,1-2H3	IWUGKOQICVHWPE-UHFFFAOYSA-N	Cc1ccc(N2C(=O)C(Cl)=C(NCCO)C2=O)c(C)c1	BroadT	BRD-K58193973	BRD-K58193973-001-06-9	ChemBridge Corporation	6150130			Cc1ccc(N2C(=O)C(Cl)=C(NCCO)C2=O)c(C)c1	InChI=1S/C14H15ClN2O3/c1-8-3-4-10(9(2)7-8)17-13(19)11(15)12(14(17)20)16-5-6-18/h3-4,7,16,18H,5-6H2,1-2H3	IWUGKOQICVHWPE-UHFFFAOYSA-N	294.07712007							120988
SMR000136726	LSM-32432	SID14731286, BRD-K11442063	973206	InChI=1S/C13H10BrNO4/c1-7-8(13(17)18)3-2-4-9(7)15-12(16)10-5-6-11(14)19-10/h2-6H,1H3,(H,15,16)(H,17,18)	DEQCEMWHNABHKA-UHFFFAOYSA-N	Cc1c(NC(=O)c2oc(Br)cc2)cccc1C(=O)O	BroadT	BRD-K11442063	BRD-K11442063-001-05-9	ChemBridge Corporation	7886772			Cc1c(NC(=O)c2ccc(Br)o2)cccc1C(O)=O	InChI=1S/C13H10BrNO4/c1-7-8(13(17)18)3-2-4-9(7)15-12(16)10-5-6-11(14)19-10/h2-6H,1H3,(H,15,16)(H,17,18)	DEQCEMWHNABHKA-UHFFFAOYSA-N	322.97932041							120989
T5283214	LSM-32433	SID24784471, BRD-K29418729	2478326	InChI=1S/C17H12N2O4S/c20-15(19-16(21)11-4-2-1-3-5-11)9-23-17(22)12-6-7-13-14(8-12)24-10-18-13/h1-8,10H,9H2,(H,19,20,21)	NAJUTMBTWCQNPO-UHFFFAOYSA-N	O=C(COC(=O)c1ccc2ncsc2c1)NC(=O)c3ccccc3	BroadT	BRD-K29418729	BRD-K29418729-001-05-5	Enamine Ltd.	T5283214			O=C(COC(=O)c1ccc2ncsc2c1)NC(=O)c1ccccc1	InChI=1S/C17H12N2O4S/c20-15(19-16(21)11-4-2-1-3-5-11)9-23-17(22)12-6-7-13-14(8-12)24-10-18-13/h1-8,10H,9H2,(H,19,20,21)	NAJUTMBTWCQNPO-UHFFFAOYSA-N	340.051777574							120990
MLS000554396	LSM-32434	SID17401557, BRD-K61027868	747315	InChI=1S/C15H13N3S/c16-9-12-14(10-5-7-17-8-6-10)11-3-1-2-4-13(11)18-15(12)19/h5-8H,1-4H2,(H,18,19)	RDDCJKWXCSJOSQ-UHFFFAOYSA-N	Sc1nc2CCCCc2c(c3ccncc3)c1C#N	BroadT	BRD-K61027868	BRD-K61027868-001-05-4	InterBioScreen Ltd.	STOCK1S-24559			Sc1nc2CCCCc2c(-c2ccncc2)c1C#N	InChI=1S/C15H13N3S/c16-9-12-14(10-5-7-17-8-6-10)11-3-1-2-4-13(11)18-15(12)19/h5-8H,1-4H2,(H,18,19)	RDDCJKWXCSJOSQ-UHFFFAOYSA-N	267.083018136							120991
MLS000662034	LSM-32435	BRD-K91421454, SID24803706	1306410	InChI=1S/C17H14N4OS2/c1-9-4-2-5-10(8-9)20-14(22)13-11-6-3-7-12(11)24-15(13)21-16(20)18-19-17(21)23/h2,4-5,8H,3,6-7H2,1H3,(H,19,23)	NNFIWDIVJBUAPK-UHFFFAOYSA-N	Cc1cccc(c1)N2C(=O)c3c4CCCc4sc3n5c(S)nnc25	BroadT	BRD-K91421454	BRD-K91421454-001-05-3	ChemBridge Corporation	7687618			Cc1cccc(c1)-n1c2nnc(S)n2c2sc3CCCc3c2c1=O	InChI=1S/C17H14N4OS2/c1-9-4-2-5-10(8-9)20-14(22)13-11-6-3-7-12(11)24-15(13)21-16(20)18-19-17(21)23/h2,4-5,8H,3,6-7H2,1H3,(H,19,23)	NNFIWDIVJBUAPK-UHFFFAOYSA-N	354.060902488							120992
3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-thioxo-1,2,3,4-tetrahydroquinazolin-4-one	LSM-32436	BRD-K45519638, SID26731674	2731590	InChI=1S/C16H12N2O3S/c19-15-11-3-1-2-4-12(11)17-16(22)18(15)10-5-6-13-14(9-10)21-8-7-20-13/h1-6,9H,7-8H2,(H,17,22)	XCMFACYVJLVWJL-UHFFFAOYSA-N	O=C1N(C(=S)Nc2ccccc12)c3ccc4OCCOc4c3	BroadT	BRD-K45519638	BRD-K45519638-001-05-0	Maybridge	S 05266			O=c1n(-c2ccc3OCCOc3c2)c(=S)[nH]c2ccccc12	InChI=1S/C16H12N2O3S/c19-15-11-3-1-2-4-12(11)17-16(22)18(15)10-5-6-13-14(9-10)21-8-7-20-13/h1-6,9H,7-8H2,(H,17,22)	XCMFACYVJLVWJL-UHFFFAOYSA-N	312.056862954							120993
MLS000520754	LSM-32437	BRD-K54067431, SID14737710	3703257	InChI=1S/C23H16ClN3O3S/c24-17-12-10-15(11-13-17)20(28)14-31-23-25-19-9-5-4-8-18(19)22(30)27(23)26-21(29)16-6-2-1-3-7-16/h1-13H,14H2,(H,26,29)	FGOXEPZAFHIOER-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)CSC2=Nc3ccccc3C(=O)N2NC(=O)c4ccccc4	BroadT	BRD-K54067431	BRD-K54067431-001-06-5	ChemDiv Inc.	K284-2448			Clc1ccc(cc1)C(=O)CSc1nc2ccccc2c(=O)n1NC(=O)c1ccccc1	InChI=1S/C23H16ClN3O3S/c24-17-12-10-15(11-13-17)20(28)14-31-23-25-19-9-5-4-8-18(19)22(30)27(23)26-21(29)16-6-2-1-3-7-16/h1-13H,14H2,(H,26,29)	FGOXEPZAFHIOER-UHFFFAOYSA-N	449.060089802							120994
SMR000115056	LSM-32438	BRD-K37253893, SID14727378	4766173	InChI=1S/C18H16N4O5/c1-26-16-5-7-17(8-6-16)27-12-13-3-2-4-14(9-13)18(23)20-21-11-15(10-19-21)22(24)25/h2-11H,12H2,1H3,(H,20,23)	KZASASKOUULWBZ-UHFFFAOYSA-N	COc1ccc(OCc2cccc(c2)C(=O)Nn3cc(cn3)[N+](=O)[O-])cc1	BroadT	BRD-K37253893	BRD-K37253893-001-06-4	Specs	AK-968/41924921			COc1ccc(OCc2cccc(c2)C(=O)Nn2cc(cn2)[N+]([O-])=O)cc1	InChI=1S/C18H16N4O5/c1-26-16-5-7-17(8-6-16)27-12-13-3-2-4-14(9-13)18(23)20-21-11-15(10-19-21)22(24)25/h2-11H,12H2,1H3,(H,20,23)	KZASASKOUULWBZ-UHFFFAOYSA-N	368.112069652							120995
581781-18-2	LSM-32439	BRD-A01717918, SID17513709	3787351	InChI=1S/C20H22N2O3S2/c1-3-25-19(23)15-4-8-16(9-5-15)21-20(26)22-12-13-27-18(22)14-6-10-17(24-2)11-7-14/h4-11,18H,3,12-13H2,1-2H3,(H,21,26)	JEFNGIWYLXETLU-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=S)N2CCSC2c3ccc(OC)cc3)cc1	BroadT	BRD-A01717918	BRD-A01717918-001-05-5	InterBioScreen Ltd.	STOCK3S-59214			CCOC(=O)c1ccc(NC(=S)N2CCSC2c2ccc(OC)cc2)cc1	InChI=1S/C20H22N2O3S2/c1-3-25-19(23)15-4-8-16(9-5-15)21-20(26)22-12-13-27-18(22)14-6-10-17(24-2)11-7-14/h4-11,18H,3,12-13H2,1-2H3,(H,21,26)	JEFNGIWYLXETLU-UHFFFAOYSA-N	402.107183964							120996
SMR000126419	LSM-32440	BRD-K33767223, SID14729468	6404643	InChI=1S/C15H13N5/c1-16-15-13(11-7-3-2-4-8-11)19-20-14(18-15)12-9-5-6-10-17-12/h2-10H,1H3,(H,16,18,20)	XOPKXVAUECUSFM-UHFFFAOYSA-N	CNc1nc(nnc1c2ccccc2)c3ccccn3	BroadT	BRD-K33767223	BRD-K33767223-001-06-8	Key Organics Ltd.	7L-530S			CNc1nc(nnc1-c1ccccc1)-c1ccccn1	InChI=1S/C15H13N5/c1-16-15-13(11-7-3-2-4-8-11)19-20-14(18-15)12-9-5-6-10-17-12/h2-10H,1H3,(H,16,18,20)	XOPKXVAUECUSFM-UHFFFAOYSA-N	263.117095466							120997
MLS000583194	LSM-32441	BRD-A51540388, SID17509956	12005058	InChI=1S/C21H25ClN2O3/c1-15-6-3-4-7-18(15)24-19(14-23-12-5-13-26-2)20(21(24)25)27-17-10-8-16(22)9-11-17/h3-4,6-11,19-20,23H,5,12-14H2,1-2H3	VRJHWQQXRLCCET-UHFFFAOYSA-N	COCCCNCC1C(Oc2ccc(Cl)cc2)C(=O)N1c3ccccc3C	BroadT	BRD-A51540388	BRD-A51540388-001-05-1	ChemDiv Inc.	C430-0516			COCCCNCC1C(Oc2ccc(Cl)cc2)C(=O)N1c1ccccc1C	InChI=1S/C21H25ClN2O3/c1-15-6-3-4-7-18(15)24-19(14-23-12-5-13-26-2)20(21(24)25)27-17-10-8-16(22)9-11-17/h3-4,6-11,19-20,23H,5,12-14H2,1-2H3	VRJHWQQXRLCCET-UHFFFAOYSA-N	388.15537039							120998
Methyl 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate	LSM-32442	BRD-K28774883, SID26513966, SID4245035	3239557	InChI=1S/C11H9BrN2O2/c1-16-11(15)10-6-9(13-14-10)7-2-4-8(12)5-3-7/h2-6H,1H3,(H,13,14)	IRKMOAWZRZMSCU-UHFFFAOYSA-N	COC(=O)c1cc([nH]n1)c2ccc(Br)cc2	BroadT	BRD-K28774883	BRD-K28774883-001-05-4	ChemDiv Inc.	6047-0021			COC(=O)c1cc([nH]n1)-c1ccc(Br)cc1	InChI=1S/C11H9BrN2O2/c1-16-11(15)10-6-9(13-14-10)7-2-4-8(12)5-3-7/h2-6H,1H3,(H,13,14)	IRKMOAWZRZMSCU-UHFFFAOYSA-N	279.984740148							120999
AC1MJFN4	LSM-32443	BRD-A68949340, SID24805120	3136707	InChI=1S/C15H17F3N2O4/c1-9-8-14(22,15(16,17)18)20(19-9)13(21)7-10-4-5-11(23-2)12(6-10)24-3/h4-6,22H,7-8H2,1-3H3	LHCQUUAAJJVPSX-UHFFFAOYSA-N	COc1ccc(CC(=O)N2N=C(C)CC2(O)C(F)(F)F)cc1OC	BroadT	BRD-A68949340	BRD-A68949340-001-06-0	Asinex Ltd.	BAS 01996561			COc1ccc(CC(=O)N2N=C(C)CC2(O)C(F)(F)F)cc1OC	InChI=1S/C15H17F3N2O4/c1-9-8-14(22,15(16,17)18)20(19-9)13(21)7-10-4-5-11(23-2)12(6-10)24-3/h4-6,22H,7-8H2,1-3H3	LHCQUUAAJJVPSX-UHFFFAOYSA-N	346.114041644							121000
STK208597	LSM-32444	BRD-K59507746, SID104219216, SID4257602	974453	InChI=1S/C14H11N5O2S/c20-12(17-11-5-1-2-7-16-11)9-22-14-19-18-13(21-14)10-4-3-6-15-8-10/h1-8H,9H2,(H,16,17,20)	AEKHNNIENKHATR-UHFFFAOYSA-N	O=C(CSc1oc(nn1)c2cccnc2)Nc3ccccn3	BroadT	BRD-K59507746	BRD-K59507746-001-06-5	ChemBridge Corporation	7914958			O=C(CSc1nnc(o1)-c1cccnc1)Nc1ccccn1	InChI=1S/C14H11N5O2S/c20-12(17-11-5-1-2-7-16-11)9-22-14-19-18-13(21-14)10-4-3-6-15-8-10/h1-8H,9H2,(H,16,17,20)	AEKHNNIENKHATR-UHFFFAOYSA-N	313.063345332							121001
SMR000118091	LSM-32445	SID14725824, BRD-A92549182	3216342	InChI=1S/C23H24F3N3O4/c24-23(25,26)22(31)29(13-15-6-7-18-19(12-15)33-14-32-18)20(16-8-10-27-11-9-16)21(30)28-17-4-2-1-3-5-17/h6-12,17,20H,1-5,13-14H2,(H,28,30)	SJPMJEFOOPSVQC-UHFFFAOYSA-N	FC(F)(F)C(=O)N(Cc1ccc2OCOc2c1)C(C(=O)NC3CCCCC3)c4ccncc4	BroadT	BRD-A92549182	BRD-A92549182-001-06-9	Asinex Ltd.	ASN 05991513			FC(F)(F)C(=O)N(Cc1ccc2OCOc2c1)C(C(=O)NC1CCCCC1)c1ccncc1	InChI=1S/C23H24F3N3O4/c24-23(25,26)22(31)29(13-15-6-7-18-19(12-15)33-14-32-18)20(16-8-10-27-11-9-16)21(30)28-17-4-2-1-3-5-17/h6-12,17,20H,1-5,13-14H2,(H,28,30)	SJPMJEFOOPSVQC-UHFFFAOYSA-N	463.171890878							121002
AC1OB1E5	LSM-32446	SID22406337, BRD-K78176309	6813642	InChI=1S/C20H22N4OS/c1-2-3-13-21-20(26)23-22-18-16-11-7-8-12-17(16)24(19(18)25)14-15-9-5-4-6-10-15/h4-12,25H,2-3,13-14H2,1H3,(H,21,26)	FZBZHBLLUMCJPL-UHFFFAOYSA-N	CCCCN=C(S)N=Nc1c(O)n(Cc2ccccc2)c3ccccc13	BroadT	BRD-K78176309	BRD-K78176309-001-09-9	Enamine Ltd.	T0519-6908			CCCCN=C(S)N=Nc1c(O)n(Cc2ccccc2)c2ccccc12	InChI=1S/C20H22N4OS/c1-2-3-13-21-20(26)23-22-18-16-11-7-8-12-17(16)24(19(18)25)14-15-9-5-4-6-10-15/h4-12,25H,2-3,13-14H2,1H3,(H,21,26)	FZBZHBLLUMCJPL-UHFFFAOYSA-N	366.151432054							
MLS000578309	LSM-32447	SID17433498, BRD-A10385098	2937915	InChI=1S/C24H26N2O3S2/c1-2-3-18-25-31(28,29)22-16-14-20(15-17-22)26-24(27)23(19-10-6-4-7-11-19)30-21-12-8-5-9-13-21/h4-17,23,25H,2-3,18H2,1H3,(H,26,27)	PJHDFVPJMNSKHT-UHFFFAOYSA-N	CCCCNS(=O)(=O)c1ccc(NC(=O)C(Sc2ccccc2)c3ccccc3)cc1	BroadT	BRD-A10385098	BRD-A10385098-001-06-0	ChemBridge Corporation	7382248			CCCCNS(=O)(=O)c1ccc(NC(=O)C(Sc2ccccc2)c2ccccc2)cc1	InChI=1S/C24H26N2O3S2/c1-2-3-18-25-31(28,29)22-16-14-20(15-17-22)26-24(27)23(19-10-6-4-7-11-19)30-21-12-8-5-9-13-21/h4-17,23,25H,2-3,18H2,1H3,(H,26,27)	PJHDFVPJMNSKHT-UHFFFAOYSA-N	454.138484092							121004
4-(Benzyloxy)-n-(2-fluorophenyl)benzamide	LSM-32448	SID104222650, SID22403771, BRD-K73436337	675055	InChI=1S/C20H16FNO2/c21-18-8-4-5-9-19(18)22-20(23)16-10-12-17(13-11-16)24-14-15-6-2-1-3-7-15/h1-13H,14H2,(H,22,23)	LAKFNQDTQMMYJV-UHFFFAOYSA-N	Fc1ccccc1NC(=O)c2ccc(OCc3ccccc3)cc2	BroadT	BRD-K73436337	BRD-K73436337-001-05-6	ChemBridge Corporation	6783096			Fc1ccccc1NC(=O)c1ccc(OCc2ccccc2)cc1	InChI=1S/C20H16FNO2/c21-18-8-4-5-9-19(18)22-20(23)16-10-12-17(13-11-16)24-14-15-6-2-1-3-7-15/h1-13H,14H2,(H,22,23)	LAKFNQDTQMMYJV-UHFFFAOYSA-N	321.116506962							121005
3-[4-(1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]-1-phenylpyrrolidine-2,5-dione	LSM-32449	SID4258259, BRD-A06071649	2839673	InChI=1S/C22H23N3O4/c26-21-13-18(22(27)25(21)17-4-2-1-3-5-17)24-10-8-23(9-11-24)14-16-6-7-19-20(12-16)29-15-28-19/h1-7,12,18H,8-11,13-15H2	RYOSPKVDIDJLCV-UHFFFAOYSA-N	O=C1CC(N2CCN(Cc3ccc4OCOc4c3)CC2)C(=O)N1c5ccccc5	BroadT	BRD-A06071649	BRD-A06071649-001-06-6	ChemBridge Corporation	5301288			O=C1CC(N2CCN(Cc3ccc4OCOc4c3)CC2)C(=O)N1c1ccccc1	InChI=1S/C22H23N3O4/c26-21-13-18(22(27)25(21)17-4-2-1-3-5-17)24-10-8-23(9-11-24)14-16-6-7-19-20(12-16)29-15-28-19/h1-7,12,18H,8-11,13-15H2	RYOSPKVDIDJLCV-UHFFFAOYSA-N	393.168856246							121006
2,6-Diphenylpyrazolo[1,5-a]pyrimidin-7-amine	LSM-32450	SID24810828, BRD-K30476506	4451674	InChI=1S/C18H14N4/c19-18-15(13-7-3-1-4-8-13)12-20-17-11-16(21-22(17)18)14-9-5-2-6-10-14/h1-12H,19H2	LZGYTCYRPUXDRI-UHFFFAOYSA-N	Nc1c(cnc2cc(nn12)c3ccccc3)c4ccccc4	BroadT	BRD-K30476506	BRD-K30476506-001-04-2	ChemDiv Inc.	5638-0356			Nc1c(cnc2cc(nn12)-c1ccccc1)-c1ccccc1	InChI=1S/C18H14N4/c19-18-15(13-7-3-1-4-8-13)12-20-17-11-16(21-22(17)18)14-9-5-2-6-10-14/h1-12H,19H2	LZGYTCYRPUXDRI-UHFFFAOYSA-N	286.121846488							121007
SMR000079348	LSM-32451	SID4265145, BRD-K44076096	934559	InChI=1S/C13H12N4O4/c1-7-8(6-10(18)20-2)12(19)17-13(14-7)15-11(16-17)9-4-3-5-21-9/h3-5,19H,6H2,1-2H3	JYXFYMLWXHYQKC-UHFFFAOYSA-N	COC(=O)Cc1c(C)nc2nc(nn2c1O)c3occc3	BroadT	BRD-K44076096	BRD-K44076096-001-04-0	ChemBridge Corporation	7927445			COC(=O)Cc1c(C)[nH]c2nc(nn2c1=O)-c1ccco1	InChI=1S/C13H12N4O4/c1-7-8(6-10(18)20-2)12(19)17-13(14-7)15-11(16-17)9-4-3-5-21-9/h3-5H,6H2,1-2H3,(H,14,15,16)	XCUSIKFZTPRIQN-UHFFFAOYSA-N	288.085854904							
ST50068115	LSM-44408	SID17407652, BRD-K25107744	3121251	InChI=1S/C16H12F3NO2S/c1-10-4-6-11(7-5-10)20-9-12(15(22)16(17,18)19)14(21)13-3-2-8-23-13/h2-9,20H,1H3/b12-9-	ZWUIXYWYOXPDMQ-XFXZXTDPSA-N	Cc1ccc(N\C=C(\C(=O)c2cccs2)/C(=O)C(F)(F)F)cc1	BroadT	BRD-K25107744	BRD-K25107744-001-05-9	Asinex Ltd.	BAS 00873202			Cc1ccc(N\C=C(\C(=O)c2cccs2)C(=O)C(F)(F)F)cc1	InChI=1S/C16H12F3NO2S/c1-10-4-6-11(7-5-10)20-9-12(15(22)16(17,18)19)14(21)13-3-2-8-23-13/h2-9,20H,1H3/b12-9-	ZWUIXYWYOXPDMQ-XFXZXTDPSA-N	339.054083924							
AC1MITEO	LSM-32453	BRD-K47774303	3101292	InChI=1S/C18H19N5O3/c1-12-7-3-4-8-14(12)20-17(25)18(26)23-22-13(2)11-16(24)21-15-9-5-6-10-19-15/h3-10H,11H2,1-2H3,(H,20,25)(H,23,26)(H,19,21,24)	WEWWHTMQBWVZKB-UHFFFAOYSA-N	CC(=NNC(=O)C(=O)Nc1ccccc1C)CC(=O)Nc2ccccn2	BroadT	BRD-K47774303	BRD-K47774303-001-05-3	Asinex Ltd.	BAS 00341999			CC(CC(=O)Nc1ccccn1)=NNC(=O)C(=O)Nc1ccccc1C	InChI=1S/C18H19N5O3/c1-12-7-3-4-8-14(12)20-17(25)18(26)23-22-13(2)11-16(24)21-15-9-5-6-10-19-15/h3-10H,11H2,1-2H3,(H,20,25)(H,23,26)(H,19,21,24)	WEWWHTMQBWVZKB-UHFFFAOYSA-N	353.148789518							121010
MLS000582952	LSM-32454	SID17433116, BRD-K89622378	735087	InChI=1S/C18H16N2O2S/c1-2-13-8-10-14(11-9-13)16-12-23-17(19-16)20-18(21)22-15-6-4-3-5-7-15/h3-12H,2H2,1H3,(H,19,20,21)	QRANLPFERFBRNN-UHFFFAOYSA-N	CCc1ccc(cc1)c2csc(NC(=O)Oc3ccccc3)n2	BroadT	BRD-K89622378	BRD-K89622378-001-05-3	ChemBridge Corporation	7990051			CCc1ccc(cc1)-c1csc(NC(=O)Oc2ccccc2)n1	InChI=1S/C18H16N2O2S/c1-2-13-8-10-14(11-9-13)16-12-23-17(19-16)20-18(21)22-15-6-4-3-5-7-15/h3-12H,2H2,1H3,(H,19,20,21)	QRANLPFERFBRNN-UHFFFAOYSA-N	324.093248462							121011
T5226768	LSM-32455	SID22406726, BRD-K47186381	2083963	InChI=1S/C19H21ClN4O3S2/c1-2-3-10-21-29(26,27)13-8-9-16-17(11-13)24-19(23-16)28-12-18(25)22-15-7-5-4-6-14(15)20/h4-9,11,21H,2-3,10,12H2,1H3,(H,22,25)(H,23,24)	MSOGYEHDULEQGN-UHFFFAOYSA-N	CCCCNS(=O)(=O)c1ccc2[nH]c(SCC(=O)Nc3ccccc3Cl)nc2c1	BroadT	BRD-K47186381	BRD-K47186381-001-05-5	Enamine Ltd.	T5226768			CCCCNS(=O)(=O)c1ccc2[nH]c(SCC(=O)Nc3ccccc3Cl)nc2c1	InChI=1S/C19H21ClN4O3S2/c1-2-3-10-21-29(26,27)13-8-9-16-17(11-13)24-19(23-16)28-12-18(25)22-15-7-5-4-6-14(15)20/h4-9,11,21H,2-3,10,12H2,1H3,(H,22,25)(H,23,24)	MSOGYEHDULEQGN-UHFFFAOYSA-N	452.074359662							121012
SMR000217948	LSM-44409	SID17513341, BRD-K28365356	1527403	InChI=1S/C25H17F3N4O2/c1-16-12-23(32(31-16)20-8-3-2-4-9-20)30-24(33)18(15-29)14-21-10-11-22(34-21)17-6-5-7-19(13-17)25(26,27)28/h2-14H,1H3,(H,30,33)/b18-14+	IEDCAQRPGLWDLS-NBVRZTHBSA-N	Cc1cc(NC(=O)\C(=C\c2oc(cc2)c3cccc(c3)C(F)(F)F)\C#N)n(n1)c4ccccc4	BroadT	BRD-K28365356	BRD-K28365356-001-05-9	InterBioScreen Ltd.	STOCK2S-86393			Cc1cc(NC(=O)C(=C\c2ccc(o2)-c2cccc(c2)C(F)(F)F)\C#N)n(n1)-c1ccccc1	InChI=1S/C25H17F3N4O2/c1-16-12-23(32(31-16)20-8-3-2-4-9-20)30-24(33)18(15-29)14-21-10-11-22(34-21)17-6-5-7-19(13-17)25(26,27)28/h2-14H,1H3,(H,30,33)/b18-14+	IEDCAQRPGLWDLS-NBVRZTHBSA-N	462.130360424							
F0700-0164	LSM-32457	SID4245568, BRD-K72813089	3240024	InChI=1S/C24H19N3O4/c1-2-26-19-10-9-18(16-7-4-8-17(22(16)19)24(26)31)25-23(30)14-5-3-6-15(13-14)27-20(28)11-12-21(27)29/h3-10,13H,2,11-12H2,1H3,(H,25,30)	JTNUVYOOMCJUPT-UHFFFAOYSA-N	CCN1C(=O)c2cccc3c(NC(=O)c4cccc(c4)N5C(=O)CCC5=O)ccc1c23	BroadT	BRD-K72813089	BRD-K72813089-001-05-7	ChemDiv Inc.	3333-4214			CCN1C(=O)c2cccc3c(NC(=O)c4cccc(c4)N4C(=O)CCC4=O)ccc1c23	InChI=1S/C24H19N3O4/c1-2-26-19-10-9-18(16-7-4-8-17(22(16)19)24(26)31)25-23(30)14-5-3-6-15(13-14)27-20(28)11-12-21(27)29/h3-10,13H,2,11-12H2,1H3,(H,25,30)	JTNUVYOOMCJUPT-UHFFFAOYSA-N	413.137556118							121014
AC1O99UR	LSM-32458	SID843702, BRD-K39704266	6752651	InChI=1S/C23H18N2O5S/c26-20-9-5-4-8-19(20)22-24-25-23(30-22)31-15-21(27)29-18-12-10-17(11-13-18)28-14-16-6-2-1-3-7-16/h1-13,26H,14-15H2	OQHSWXPUCGOBBO-UHFFFAOYSA-N	Oc1ccccc1c2oc(SCC(=O)Oc3ccc(OCc4ccccc4)cc3)nn2	BroadT	BRD-K39704266	BRD-K39704266-001-05-5	Asinex Ltd.	ASN 01107494			Oc1ccccc1-c1nnc(SCC(=O)Oc2ccc(OCc3ccccc3)cc2)o1	InChI=1S/C23H18N2O5S/c26-20-9-5-4-8-19(20)22-24-25-23(30-22)31-15-21(27)29-18-12-10-17(11-13-18)28-14-16-6-2-1-3-7-16/h1-13,26H,14-15H2	OQHSWXPUCGOBBO-UHFFFAOYSA-N	434.093642386							
MLS000714376	LSM-15519	BRD-K41480356	1070882	InChI=1S/C23H27BrN2O3S/c1-6-29-23(28)21-19(13-30-15-9-7-14(2)8-10-15)26(5)18-11-17(24)22(27)16(20(18)21)12-25(3)4/h7-11,27H,6,12-13H2,1-5H3	VLSGAOYACVQQIC-UHFFFAOYSA-N	CCOC(=O)c1c(CSc2ccc(C)cc2)n(C)c3cc(Br)c(O)c(CN(C)C)c13	BroadT	BRD-K41480356	BRD-K41480356-311-05-2	Asinex Ltd.	BAS 02098846		O.Cl	CCOC(=O)c1c(CSc2ccc(C)cc2)n(C)c2cc(Br)c(O)c(CN(C)C)c12.O.Cl	InChI=1S/C23H27BrN2O3S.ClH.H2O/c1-6-29-23(28)21-19(13-30-15-9-7-14(2)8-10-15)26(5)18-11-17(24)22(27)16(20(18)21)12-25(3)4;;/h7-11,27H,6,12-13H2,1-5H3;1H;1H2	ZODJWLOVWIWSTL-UHFFFAOYSA-N	490.092576034							104159, 104159
ST50935525	LSM-32459	SID4260029, BRD-K63346698	1247210	InChI=1S/C15H12ClN5O/c16-12-3-1-11(2-4-12)9-21-10-13(7-19-21)20-15(22)14-8-17-5-6-18-14/h1-8,10H,9H2,(H,20,22)	ABYQWJAEJVXQBO-UHFFFAOYSA-N	Clc1ccc(Cn2cc(NC(=O)c3cnccn3)cn2)cc1	BroadT	BRD-K63346698	BRD-K63346698-001-06-0	ChemBridge Corporation	7948623			Clc1ccc(Cn2cc(NC(=O)c3cnccn3)cn2)cc1	InChI=1S/C15H12ClN5O/c16-12-3-1-11(2-4-12)9-21-10-13(7-19-21)20-15(22)14-8-17-5-6-18-14/h1-8,10H,9H2,(H,20,22)	ABYQWJAEJVXQBO-UHFFFAOYSA-N	313.073037764							121016
T5249590	LSM-32460	SID17516052, BRD-K56598835	2122683	InChI=1S/C21H21ClN2O7/c1-12(2)18(23-20(25)16-5-3-4-6-17(16)22)21(26)30-10-14-8-15(24(27)28)7-13-9-29-11-31-19(13)14/h3-8,12,18H,9-11H2,1-2H3,(H,23,25)/t18-/m0/s1	NGUGKXKGCUGHKI-SFHVURJKSA-N	CC(C)[C@H](NC(=O)c1ccccc1Cl)C(=O)OCc2cc(cc3COCOc23)[N+](=O)[O-]	BroadT	BRD-K56598835	BRD-K56598835-001-05-1	Enamine Ltd.	T5249590			CC(C)[C@H](NC(=O)c1ccccc1Cl)C(=O)OCc1cc(cc2COCOc12)[N+]([O-])=O	InChI=1S/C21H21ClN2O7/c1-12(2)18(23-20(25)16-5-3-4-6-17(16)22)21(26)30-10-14-8-15(24(27)28)7-13-9-29-11-31-19(13)14/h3-8,12,18H,9-11H2,1-2H3,(H,23,25)/t18-/m0/s1	NGUGKXKGCUGHKI-SFHVURJKSA-N	448.103728742							121017
AC1LJEGY	LSM-32461	BRD-K46739714	949363	InChI=1S/C15H13N3OS/c1-18-10-13(12-6-2-3-7-14(12)18)15(19)17-16-9-11-5-4-8-20-11/h2-10H,1H3,(H,17,19)	IPCVPJRZGKXKLR-UHFFFAOYSA-N	Cn1cc(C(=O)NN=Cc2cccs2)c3ccccc13	BroadT	BRD-K46739714	BRD-K46739714-001-05-0	InterBioScreen Ltd.	STOCK2S-57951			Cn1cc(C(=O)NN=Cc2cccs2)c2ccccc12	InChI=1S/C15H13N3OS/c1-18-10-13(12-6-2-3-7-14(12)18)15(19)17-16-9-11-5-4-8-20-11/h2-10H,1H3,(H,17,19)	IPCVPJRZGKXKLR-UHFFFAOYSA-N	283.077932756							121018
AMBCB6798968	LSM-32462	SID22403872, BRD-K24060909	2914402	InChI=1S/C19H18N2O4/c1-25-13-8-6-12(7-9-13)21-17-16(20-10-11-22)18(23)14-4-2-3-5-15(14)19(17)24/h2-9,20-22H,10-11H2,1H3	BNCMEAGMMYNBAL-UHFFFAOYSA-N	COc1ccc(NC2=C(NCCO)C(=O)c3ccccc3C2=O)cc1	BroadT	BRD-K24060909	BRD-K24060909-001-06-0	ChemBridge Corporation	6798968			COc1ccc(NC2=C(NCCO)C(=O)c3ccccc3C2=O)cc1	InChI=1S/C19H18N2O4/c1-25-13-8-6-12(7-9-13)21-17-16(20-10-11-22)18(23)14-4-2-3-5-15(14)19(17)24/h2-9,20-22H,10-11H2,1H3	BNCMEAGMMYNBAL-UHFFFAOYSA-N	338.126657076							121019
4-(6-Methyl-4-phenylquinazolin-2-yl)piperazine-1-carbaldehyde	LSM-32463	SID14724294, BRD-K06054940	776450	InChI=1S/C20H20N4O/c1-15-7-8-18-17(13-15)19(16-5-3-2-4-6-16)22-20(21-18)24-11-9-23(14-25)10-12-24/h2-8,13-14H,9-12H2,1H3	MPBDJZHWZQFXAO-UHFFFAOYSA-N	Cc1ccc2nc(nc(c3ccccc3)c2c1)N4CCN(CC4)C=O	BroadT	BRD-K06054940	BRD-K06054940-001-05-8	Asinex Ltd.	BAS 01118349			Cc1ccc2nc(nc(-c3ccccc3)c2c1)N1CCN(CC1)C=O	InChI=1S/C20H20N4O/c1-15-7-8-18-17(13-15)19(16-5-3-2-4-6-16)22-20(21-18)24-11-9-23(14-25)10-12-24/h2-8,13-14H,9-12H2,1H3	MPBDJZHWZQFXAO-UHFFFAOYSA-N	332.1637113							121020
2-(2-Quinoxalinylsulfanyl)propanoic acid	LSM-32464	SID14730743, BRD-A02850421	4312795	InChI=1S/C11H10N2O2S/c1-7(11(14)15)16-10-6-12-8-4-2-3-5-9(8)13-10/h2-7H,1H3,(H,14,15)	BXEUQCFQLZLPFJ-UHFFFAOYSA-N	CC(Sc1cnc2ccccc2n1)C(=O)O	BroadT	BRD-A02850421	BRD-A02850421-001-06-1	Key Organics Ltd.	2D-093			CC(Sc1cnc2ccccc2n1)C(O)=O	InChI=1S/C11H10N2O2S/c1-7(11(14)15)16-10-6-12-8-4-2-3-5-9(8)13-10/h2-7H,1H3,(H,14,15)	BXEUQCFQLZLPFJ-UHFFFAOYSA-N	234.04629827							121021
AC1NSJ7Q	LSM-32465	SID7972069, BRD-A74325877	5310598	InChI=1S/C17H15N5O/c1-23-16-10-6-5-9-13(16)15-11-14(12-7-3-2-4-8-12)18-17-19-20-21-22(15)17/h2-11,15H,1H3,(H,18,19,21)	QEPAMOFAUJRUIX-UHFFFAOYSA-N	COc1ccccc1C2C=C(Nc3nnnn23)c4ccccc4	BroadT	BRD-A74325877	BRD-A74325877-001-05-8	ChemBridge Corporation	6963785			COc1ccccc1C1C=C(Nc2nnnn12)c1ccccc1	InChI=1S/C17H15N5O/c1-23-16-10-6-5-9-13(16)15-11-14(12-7-3-2-4-8-12)18-17-19-20-21-22(15)17/h2-11,15H,1H3,(H,18,19,21)	QEPAMOFAUJRUIX-UHFFFAOYSA-N	305.12766015							121022
AC1N4EY8	LSM-32466	BRD-K74211578	4177790	InChI=1S/C14H15N3S2/c1-11(13-8-5-9-19-13)16-17-14(18)15-10-12-6-3-2-4-7-12/h2-9H,10H2,1H3,(H2,15,17,18)	IBHLZSUIUYTRFR-UHFFFAOYSA-N	CC(=NN=C(S)NCc1ccccc1)c2cccs2	BroadT	BRD-K74211578	BRD-K74211578-001-05-0	Enamine Ltd.	T0509-9214			CC(=NN=C(S)NCc1ccccc1)c1cccs1	InChI=1S/C14H15N3S2/c1-11(13-8-5-9-19-13)16-17-14(18)15-10-12-6-3-2-4-7-12/h2-9H,10H2,1H3,(H2,15,17,18)	IBHLZSUIUYTRFR-UHFFFAOYSA-N	289.07073889							121023
5-[1-(4-Fluorobenzyl)-1H-pyrazol-3-yl]-2-phenyl-1,3-thiazole	LSM-32467	SID14733040, BRD-K25414283	1476746	InChI=1S/C19H14FN3S/c20-16-8-6-14(7-9-16)13-23-11-10-17(22-23)18-12-21-19(24-18)15-4-2-1-3-5-15/h1-12H,13H2	ZORHVSCAWODFPX-UHFFFAOYSA-N	Fc1ccc(Cn2ccc(n2)c3cnc(s3)c4ccccc4)cc1	BroadT	BRD-K25414283	BRD-K25414283-001-05-6	Key Organics Ltd.	4M-056			Fc1ccc(Cn2ccc(n2)-c2cnc(s2)-c2ccccc2)cc1	InChI=1S/C19H14FN3S/c20-16-8-6-14(7-9-16)13-23-11-10-17(22-23)18-12-21-19(24-18)15-4-2-1-3-5-15/h1-12H,13H2	ZORHVSCAWODFPX-UHFFFAOYSA-N	335.089246368							121024
5-{[(2,4-Dichlorobenzyl)sulfanyl]methyl}-4-isopropyl-4H-1,2,4-triazole-3-thiol	LSM-32468	SID24821502, BRD-K10420089	2764244	InChI=1S/C13H15Cl2N3S2/c1-8(2)18-12(16-17-13(18)19)7-20-6-9-3-4-10(14)5-11(9)15/h3-5,8H,6-7H2,1-2H3,(H,17,19)	HOVAMNOLUNEIKI-UHFFFAOYSA-N	CC(C)n1c(S)nnc1CSCc2ccc(Cl)cc2Cl	BroadT	BRD-K10420089	BRD-K10420089-001-05-6	Key Organics Ltd.	7H-495S			CC(C)n1c(S)nnc1CSCc1ccc(Cl)cc1Cl	InChI=1S/C13H15Cl2N3S2/c1-8(2)18-12(16-17-13(18)19)7-20-6-9-3-4-10(14)5-11(9)15/h3-5,8H,6-7H2,1-2H3,(H,17,19)	HOVAMNOLUNEIKI-UHFFFAOYSA-N	347.00844431							121025
BRD-K70327057	LSM-32469			InChI=1S/C9H4N4O5/c14-10-8-7(12-18-9(8)11-15)5-1-3-6(4-2-5)13(16)17/h1-4H	KVGCLSOWWZUAQD-UHFFFAOYSA-N	O=Nc1c(c2ccc([N+]([O-])=O)cc2)noc1(N=O)	BroadT	BRD-K70327057	BRD-K70327057-001-05-8	ChemDiv Inc.	8011-1453			ONc1c([N+][O-])onc1-c1ccc(cc1)[N+]([O-])=O	InChI=1S/C9H6N4O5/c14-10-8-7(12-18-9(8)11-15)5-1-3-6(4-2-5)13(16)17/h1-4,10,14H	DGIMQPVHCNCGEA-UHFFFAOYSA-N	248.018169268							
UPCMLD04ASTW002136	LSM-32470	SID17384929, SID24707966, BRD-K51635174	3247308	InChI=1S/C33H29N2O2P/c36-33(34-27-21-20-24-12-10-11-15-26(24)22-27)31-23-30(31)32(25-13-4-1-5-14-25)35-38(37,28-16-6-2-7-17-28)29-18-8-3-9-19-29/h1-22,30-32H,23H2,(H,34,36)(H,35,37)/t30-,31-,32+/m1/s1	JTUINJHDTNXECT-IWWXRALLSA-N	O=C(Nc1ccc2ccccc2c1)[C@@H]3C[C@H]3[C@@H](NP(=O)(c4ccccc4)c5ccccc5)c6ccccc6	BroadT	BRD-K51635174	BRD-K51635174-001-05-5	University of Pittsburgh CMLD	UPCMLD04ASTW002136			O=C(Nc1ccc2ccccc2c1)[C@@H]1C[C@H]1[C@@H](NP(=O)(c1ccccc1)c1ccccc1)c1ccccc1	InChI=1S/C33H29N2O2P/c36-33(34-27-21-20-24-12-10-11-15-26(24)22-27)31-23-30(31)32(25-13-4-1-5-14-25)35-38(37,28-16-6-2-7-17-28)29-18-8-3-9-19-29/h1-22,30-32H,23H2,(H,34,36)(H,35,37)/t30-,31-,32+/m1/s1	JTUINJHDTNXECT-IWWXRALLSA-N	516.196664698							121027
AC1LHFM1	LSM-32471	BRD-K28078827	886577	InChI=1S/C13H9ClN4O/c14-12-4-2-1-3-11(12)13-6-5-10(19-13)7-17-18-8-15-16-9-18/h1-9H	ICQOLFREDQWHRD-UHFFFAOYSA-N	Clc1ccccc1c2oc(C=Nn3cnnc3)cc2	BroadT	BRD-K28078827	BRD-K28078827-001-05-9	ChemBridge Corporation	6244983			Clc1ccccc1-c1ccc(C=Nn2cnnc2)o1	InChI=1S/C13H9ClN4O/c14-12-4-2-1-3-11(12)13-6-5-10(19-13)7-17-18-8-15-16-9-18/h1-9H	ICQOLFREDQWHRD-UHFFFAOYSA-N	272.046488658							121028
AC1N9TP0	LSM-32472	SID24820939, BRD-A02101999	4391103	InChI=1S/C26H27N5O3/c1-2-19-10-12-20(13-11-19)31-25(33)28-22-8-4-3-7-21(22)26(31,34)24(32)30-17-15-29(16-18-30)23-9-5-6-14-27-23/h3-14,34H,2,15-18H2,1H3,(H,28,33)	BTIZKDZMKAHNNN-UHFFFAOYSA-N	CCc1ccc(cc1)N2C(=O)Nc3ccccc3C2(O)C(=O)N4CCN(CC4)c5ccccn5	BroadT	BRD-A02101999	BRD-A02101999-001-05-3	ChemDiv Inc.	K784-4903			CCc1ccc(cc1)N1C(=O)Nc2ccccc2C1(O)C(=O)N1CCN(CC1)c1ccccn1	InChI=1S/C26H27N5O3/c1-2-19-10-12-20(13-11-19)31-25(33)28-22-8-4-3-7-21(22)26(31,34)24(32)30-17-15-29(16-18-30)23-9-5-6-14-27-23/h3-14,34H,2,15-18H2,1H3,(H,28,33)	BTIZKDZMKAHNNN-UHFFFAOYSA-N	457.211389774							121029
SMR000559559	LSM-32473	BRD-A22502911, SID49667862	4049589	InChI=1S/C23H18ClFN2O2/c1-14-10-11-19-16(12-14)22(15-6-3-2-4-7-15)27(13-20(28)26-19)23(29)21-17(24)8-5-9-18(21)25/h2-12,22H,13H2,1H3,(H,26,28)	LBRFZKDEOKCHKU-UHFFFAOYSA-N	Cc1ccc2NC(=O)CN(C(c3ccccc3)c2c1)C(=O)c4c(F)cccc4Cl	BroadT	BRD-A22502911	BRD-A22502911-001-05-3	ChemDiv Inc.	C076-0563			Cc1ccc2NC(=O)CN(C(c3ccccc3)c2c1)C(=O)c1c(F)cccc1Cl	InChI=1S/C23H18ClFN2O2/c1-14-10-11-19-16(12-14)22(15-6-3-2-4-7-15)27(13-20(28)26-19)23(29)21-17(24)8-5-9-18(21)25/h2-12,22H,13H2,1H3,(H,26,28)	LBRFZKDEOKCHKU-UHFFFAOYSA-N	408.104083746							121030
MLS002699429	LSM-44942	SID91148452, SID87235625, BRD8391, SID99495773, BRD-K40758391	26871482	InChI=1S/C16H18F3N3O2/c1-10(21-22-14(23)12-4-2-3-5-12)11-6-8-13(9-7-11)20-15(24)16(17,18)19/h6-9,12H,2-5H2,1H3,(H,20,24)(H,22,23)/b21-10+	QXFVQXRFCWCTQE-UFFVCSGVSA-N	C\C(=N/NC(=O)C1CCCC1)\c2ccc(NC(=O)C(F)(F)F)cc2	BroadT	BRD-K40758391	BRD-K40758391-001-03-1	Broad Institute of MIT and Harvard	BRD-K40758391			C\C(c1ccc(NC(=O)C(F)(F)F)cc1)=N/NC(=O)C1CCCC1	InChI=1S/C16H18F3N3O2/c1-10(21-22-14(23)12-4-2-3-5-12)11-6-8-13(9-7-11)20-15(24)16(17,18)19/h6-9,12H,2-5H2,1H3,(H,20,24)(H,22,23)/b21-10+	QXFVQXRFCWCTQE-UFFVCSGVSA-N	341.135111446							
6-(Tert-butyl)-2-hydroxy-4-(trifluoromethyl)nicotinonitrile	LSM-32474	SID14733247, BRD-K19184974	1480186	InChI=1S/C11H11F3N2O/c1-10(2,3)8-4-7(11(12,13)14)6(5-15)9(17)16-8/h4H,1-3H3,(H,16,17)	QVFWPGJSZRZLAM-UHFFFAOYSA-N	CC(C)(C)c1cc(c(C#N)c(O)n1)C(F)(F)F	BroadT	BRD-K19184974	BRD-K19184974-001-05-7	Key Organics Ltd.	5N-373S			CC(C)(C)c1cc(c(C#N)c(O)n1)C(F)(F)F	InChI=1S/C11H11F3N2O/c1-10(2,3)8-4-7(11(12,13)14)6(5-15)9(17)16-8/h4H,1-3H3,(H,16,17)	QVFWPGJSZRZLAM-UHFFFAOYSA-N	244.082347592							121031
MLS-0220978.0001	LSM-32475	SID22410465, SID56373690, BRD-K57038928	2380796	InChI=1S/C15H11Cl2N5O3S/c16-10-2-4-11(5-3-10)22-26(24,25)13-7-9(1-6-12(13)17)14(23)20-15-18-8-19-21-15/h1-8,22H,(H2,18,19,20,21,23)	KKALNLMXTMFBQI-UHFFFAOYSA-N	Clc1ccc(NS(=O)(=O)c2cc(ccc2Cl)C(=O)Nc3nc[nH]n3)cc1	BroadT	BRD-K57038928	BRD-K57038928-001-05-5	Enamine Ltd.	T0506-4645			Clc1ccc(NS(=O)(=O)c2cc(ccc2Cl)C(=O)Nc2nc[nH]n2)cc1	InChI=1S/C15H11Cl2N5O3S/c16-10-2-4-11(5-3-10)22-26(24,25)13-7-9(1-6-12(13)17)14(23)20-15-18-8-19-21-15/h1-8,22H,(H2,18,19,20,21,23)	KKALNLMXTMFBQI-UHFFFAOYSA-N	410.995965372							121032
MLS000071493	LSM-32476	SID856532, BRD-K62880117	657888	InChI=1S/C16H18N2O2/c1-19-13-7-10-11(9-17)15(18)16(5-3-4-6-16)12(10)8-14(13)20-2/h7-8H,3-6,18H2,1-2H3	NFVGRVXAXZDUKO-UHFFFAOYSA-N	COc1cc2C(=C(N)C3(CCCC3)c2cc1OC)C#N	BroadT	BRD-K62880117	BRD-K62880117-001-06-2	InterBioScreen Ltd.	STOCK1S-18031			COc1cc2C(C#N)=C(N)C3(CCCC3)c2cc1OC	InChI=1S/C16H18N2O2/c1-19-13-7-10-11(9-17)15(18)16(5-3-4-6-16)12(10)8-14(13)20-2/h7-8H,3-6,18H2,1-2H3	NFVGRVXAXZDUKO-UHFFFAOYSA-N	270.136827836							121033
Dimethyl 5,5'-methylenedianthranilate	LSM-32477	SID7972064, BRD-K61951913	94419	InChI=1S/C17H18N2O4/c1-22-16(20)12-8-10(3-5-14(12)18)7-11-4-6-15(19)13(9-11)17(21)23-2/h3-6,8-9H,7,18-19H2,1-2H3	XEZPSTVEIZNGRR-UHFFFAOYSA-N	COC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)OC)ccc1N	BroadT	BRD-K61951913	BRD-K61951913-001-05-0	ChemBridge Corporation	5181147			COC(=O)c1cc(Cc2ccc(N)c(c2)C(=O)OC)ccc1N	InChI=1S/C17H18N2O4/c1-22-16(20)12-8-10(3-5-14(12)18)7-11-4-6-15(19)13(9-11)17(21)23-2/h3-6,8-9H,7,18-19H2,1-2H3	XEZPSTVEIZNGRR-UHFFFAOYSA-N	314.126657076							121034
SMR000077177	LSM-32478	SID4255362, BRD-K97432641	2211650	InChI=1S/C18H25NO5S/c1-14-12-16(8-9-17(14)24-13-18(20)23-2)25(21,22)19-11-10-15-6-4-3-5-7-15/h6,8-9,12,19H,3-5,7,10-11,13H2,1-2H3	GJWFAJZZPLUEFK-UHFFFAOYSA-N	COC(=O)COc1ccc(cc1C)S(=O)(=O)NCCC2=CCCCC2	BroadT	BRD-K97432641	BRD-K97432641-001-05-8	ChemBridge Corporation	7835647			COC(=O)COc1ccc(cc1C)S(=O)(=O)NCCC1=CCCCC1	InChI=1S/C18H25NO5S/c1-14-12-16(8-9-17(14)24-13-18(20)23-2)25(21,22)19-11-10-15-6-4-3-5-7-15/h6,8-9,12,19H,3-5,7,10-11,13H2,1-2H3	GJWFAJZZPLUEFK-UHFFFAOYSA-N	367.1453436							121035
ZINC00456115	LSM-32479	SID4257828, BRD-K59486709	884355	InChI=1S/C17H23NO5/c1-21-14-5-4-12(10-15(14)22-2)11-16(19)18-8-6-13(7-9-18)17(20)23-3/h4-5,10,13H,6-9,11H2,1-3H3	CFWSXPAGLLKPMX-UHFFFAOYSA-N	COC(=O)C1CCN(CC1)C(=O)Cc2ccc(OC)c(OC)c2	BroadT	BRD-K59486709	BRD-K59486709-001-05-9	ChemBridge Corporation	6594919			COC(=O)C1CCN(CC1)C(=O)Cc1ccc(OC)c(OC)c1	InChI=1S/C17H23NO5/c1-21-14-5-4-12(10-15(14)22-2)11-16(19)18-8-6-13(7-9-18)17(20)23-3/h4-5,10,13H,6-9,11H2,1-3H3	CFWSXPAGLLKPMX-UHFFFAOYSA-N	321.157622846							121036
SMR000242526	LSM-32480	SID17516874, BRD-K72791694	2453310	InChI=1S/C17H13NO4/c19-12-5-3-4-11(8-12)17(21)22-10-16(20)14-9-18-15-7-2-1-6-13(14)15/h1-9,18-19H,10H2	MZPMLGSADPRUKC-UHFFFAOYSA-N	Oc1cccc(c1)C(=O)OCC(=O)c2c[nH]c3ccccc23	BroadT	BRD-K72791694	BRD-K72791694-001-06-0	Enamine Ltd.	T0520-8212			Oc1cccc(c1)C(=O)OCC(=O)c1c[nH]c2ccccc12	InChI=1S/C17H13NO4/c19-12-5-3-4-11(8-12)17(21)22-10-16(20)14-9-18-15-7-2-1-6-13(14)15/h1-9,18-19H,10H2	MZPMLGSADPRUKC-UHFFFAOYSA-N	295.084457906							121037
MLS000699061	LSM-44410	SID22413702, BRD-K50476476	5431409	InChI=1S/C18H15ClN6OS/c1-3-14-23-25-16(20)13(17(26)21-18(25)27-14)9-12-10(2)22-24(15(12)19)11-7-5-4-6-8-11/h4-9,20H,3H2,1-2H3/b13-9-,20-16?	IWCYENBWEJPXTF-PNZWKLPWSA-N	CCC1=NN2C(=NC(=O)\C(=C/c3c(C)nn(c3Cl)c4ccccc4)\C2=N)S1	BroadT	BRD-K50476476	BRD-K50476476-001-06-8	Specs	AM-900/14908012			CCC1=NN2C(S1)=NC(=O)\C(=C/c1c(C)nn(c1Cl)-c1ccccc1)C2=N	InChI=1S/C18H15ClN6OS/c1-3-14-23-25-16(20)13(17(26)21-18(25)27-14)9-12-10(2)22-24(15(12)19)11-7-5-4-6-8-11/h4-9,20H,3H2,1-2H3/b13-9-,20-16?	IWCYENBWEJPXTF-PNZWKLPWSA-N	398.07165756							
N-[2-(Dimethylamino)ethyl]-2,2-diphenylacetamide	LSM-32482	SID26659969, BRD-K64329996	422051	InChI=1S/C18H22N2O/c1-20(2)14-13-19-18(21)17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3,(H,19,21)	LKWNIOQWLMMGGL-UHFFFAOYSA-N	CN(C)CCNC(=O)C(c1ccccc1)c2ccccc2	BroadT	BRD-K64329996	BRD-K64329996-001-05-6	InterBioScreen Ltd.	STOCK2S-26187			CN(C)CCNC(=O)C(c1ccccc1)c1ccccc1	InChI=1S/C18H22N2O/c1-20(2)14-13-19-18(21)17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3,(H,19,21)	LKWNIOQWLMMGGL-UHFFFAOYSA-N	282.173213344							121039
Methyl 3-{5-[(3-pyridinylamino)carbonyl]-2-furyl}-2-thiophenecarboxylate	LSM-32483	SID17409993, BRD-K28843098	2766439	InChI=1S/C16H12N2O4S/c1-21-16(20)14-11(6-8-23-14)12-4-5-13(22-12)15(19)18-10-3-2-7-17-9-10/h2-9H,1H3,(H,18,19)	LDIUORFGWOBQBG-UHFFFAOYSA-N	COC(=O)c1sccc1c2oc(cc2)C(=O)Nc3cccnc3	BroadT	BRD-K28843098	BRD-K28843098-001-05-8	Key Organics Ltd.	11D-032			COC(=O)c1sccc1-c1ccc(o1)C(=O)Nc1cccnc1	InChI=1S/C16H12N2O4S/c1-21-16(20)14-11(6-8-23-14)12-4-5-13(22-12)15(19)18-10-3-2-7-17-9-10/h2-9H,1H3,(H,18,19)	LDIUORFGWOBQBG-UHFFFAOYSA-N	328.051777574							121040
N-Butyl-5-methoxy-1H-indole-2-carboxamide	LSM-32484	SID26729122, BRD-K12332202	2742895	InChI=1S/C14H18N2O2/c1-3-4-7-15-14(17)13-9-10-8-11(18-2)5-6-12(10)16-13/h5-6,8-9,16H,3-4,7H2,1-2H3,(H,15,17)	RJGMEDBQCQLMBH-UHFFFAOYSA-N	CCCCNC(=O)c1cc2cc(OC)ccc2[nH]1	BroadT	BRD-K12332202	BRD-K12332202-001-04-6	Maybridge	SP 01207			CCCCNC(=O)c1cc2cc(OC)ccc2[nH]1	InChI=1S/C14H18N2O2/c1-3-4-7-15-14(17)13-9-10-8-11(18-2)5-6-12(10)16-13/h5-6,8-9,16H,3-4,7H2,1-2H3,(H,15,17)	RJGMEDBQCQLMBH-UHFFFAOYSA-N	246.136827836							121041
1-(Phenylsulfonyl)-1H-indole	LSM-32485	SID7975555, BRD-K80124587	315017	InChI=1S/C14H11NO2S/c16-18(17,13-7-2-1-3-8-13)15-11-10-12-6-4-5-9-14(12)15/h1-11H	VDWLCYCWLIKWBV-UHFFFAOYSA-N	O=S(=O)(c1ccccc1)n2ccc3ccccc23	BroadT	BRD-K80124587	BRD-K80124587-001-05-6	ChemBridge Corporation	5100169			O=S(=O)(c1ccccc1)n1ccc2ccccc12	InChI=1S/C14H11NO2S/c16-18(17,13-7-2-1-3-8-13)15-11-10-12-6-4-5-9-14(12)15/h1-11H	VDWLCYCWLIKWBV-UHFFFAOYSA-N	257.051049292							121042
AC1MEVWO	LSM-32486	SID24805520, BRD-K09926629	2861958	InChI=1S/C14H11Cl2N3O3/c15-9-4-5-12(10(16)7-9)21-8-13(20)22-19-14(17)11-3-1-2-6-18-11/h1-7H,8H2,(H2,17,19)	AAYBTXIBUFVFKT-UHFFFAOYSA-N	Clc1ccc(OCC(=O)ONC(=N)c2ccccn2)c(Cl)c1	BroadT	BRD-K09926629	BRD-K09926629-001-05-2	Asinex Ltd.	BAS 03191952			Clc1ccc(OCC(=O)ONC(=N)c2ccccn2)c(Cl)c1	InChI=1S/C14H11Cl2N3O3/c15-9-4-5-12(10(16)7-9)21-8-13(20)22-19-14(17)11-3-1-2-6-18-11/h1-7H,8H2,(H2,17,19)	AAYBTXIBUFVFKT-UHFFFAOYSA-N	339.017746662							121043
N-(2-Benzyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl)-4-methylbenzenesulfonamide	LSM-32487	SID4264634, BRD-K13550760	2211754	InChI=1S/C24H24N4O2S/c1-18-7-10-21(11-8-18)31(29,30)26-20-9-12-23-22(15-20)25-24-17-27(13-14-28(23)24)16-19-5-3-2-4-6-19/h2-12,15,26H,13-14,16-17H2,1H3	SKXUNYLMUZTGRV-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)Nc2ccc3c(c2)nc4CN(Cc5ccccc5)CCn34	BroadT	BRD-K13550760	BRD-K13550760-001-05-3	ChemBridge Corporation	7836791			Cc1ccc(cc1)S(=O)(=O)Nc1ccc2n3CCN(Cc4ccccc4)Cc3nc2c1	InChI=1S/C24H24N4O2S/c1-18-7-10-21(11-8-18)31(29,30)26-20-9-12-23-22(15-20)25-24-17-27(13-14-28(23)24)16-19-5-3-2-4-6-19/h2-12,15,26H,13-14,16-17H2,1H3	SKXUNYLMUZTGRV-UHFFFAOYSA-N	432.161996738							121044
AC1L8HPT	LSM-32488	BRD-K59935404	401529	InChI=1S/C16H14N2O3/c19-16(9-12-4-2-1-3-5-12)18-17-10-13-6-7-14-15(8-13)21-11-20-14/h1-8,10H,9,11H2,(H,18,19)	BUJADRAIFAJMLJ-UHFFFAOYSA-N	O=C(Cc1ccccc1)NN=Cc2ccc3OCOc3c2	BroadT	BRD-K59935404	BRD-K59935404-001-06-1	Asinex Ltd.	BAS 00281852			O=C(Cc1ccccc1)NN=Cc1ccc2OCOc2c1	InChI=1S/C16H14N2O3/c19-16(9-12-4-2-1-3-5-12)18-17-10-13-6-7-14-15(8-13)21-11-20-14/h1-8,10H,9,11H2,(H,18,19)	BUJADRAIFAJMLJ-UHFFFAOYSA-N	282.100442328							121045
MLS001222754	LSM-32489	SID49732794, BRD-K97333092	974155	InChI=1S/C15H12N2O6S/c1-22-14(18)9-2-4-10(5-3-9)17-24(20,21)11-6-7-12-13(8-11)23-15(19)16-12/h2-8,17H,1H3,(H,16,19)	SSDDVTVCIMSBTR-UHFFFAOYSA-N	COC(=O)c1ccc(NS(=O)(=O)c2ccc3nc(O)oc3c2)cc1	BroadT	BRD-K97333092	BRD-K97333092-001-05-2	Asinex Ltd.	BAS 09106379			COC(=O)c1ccc(NS(=O)(=O)c2ccc3nc(O)oc3c2)cc1	InChI=1S/C15H12N2O6S/c1-22-14(18)9-2-4-10(5-3-9)17-24(20,21)11-6-7-12-13(8-11)23-15(19)16-12/h2-8,17H,1H3,(H,16,19)	SSDDVTVCIMSBTR-UHFFFAOYSA-N	348.041606814							121046
MLS000388684	LSM-32490	SID22407830, BRD-K42295110	2632577	InChI=1S/C12H14Br2N2O3/c1-7(2)15-12(18)16-11(17)6-19-10-4-3-8(13)5-9(10)14/h3-5,7H,6H2,1-2H3,(H2,15,16,17,18)	DXUSESKZVPFYSV-UHFFFAOYSA-N	CC(C)NC(=O)NC(=O)COc1ccc(Br)cc1Br	BroadT	BRD-K42295110	BRD-K42295110-001-06-5	Enamine Ltd.	Z26350645			CC(C)NC(=O)NC(=O)COc1ccc(Br)cc1Br	InChI=1S/C12H14Br2N2O3/c1-7(2)15-12(18)16-11(17)6-19-10-4-3-8(13)5-9(10)14/h3-5,7H,6H2,1-2H3,(H2,15,16,17,18)	DXUSESKZVPFYSV-UHFFFAOYSA-N	391.937117528							121047
F0647-0313	LSM-32491	SID4244883, BRD-K30431029	3239426	InChI=1S/C11H10F2N2OS/c12-7-5-8(13)10-9(6-7)17-11(14-10)15-1-3-16-4-2-15/h5-6H,1-4H2	KCOMKBVTTUVWAR-UHFFFAOYSA-N	Fc1cc(F)c2nc(sc2c1)N3CCOCC3	BroadT	BRD-K30431029	BRD-K30431029-001-05-2	ChemDiv Inc.	C506-0146			Fc1cc(F)c2nc(sc2c1)N1CCOCC1	InChI=1S/C11H10F2N2OS/c12-7-5-8(13)10-9(6-7)17-11(14-10)15-1-3-16-4-2-15/h5-6H,1-4H2	KCOMKBVTTUVWAR-UHFFFAOYSA-N	256.04819005							121048
MLS000714099	LSM-32492	SID24822521, BRD-A26738626	3127896	InChI=1S/C26H20N2O6/c29-13-5-1-11(2-6-13)27-23(31)19-15-9-10-16(20(19)24(27)32)18-17(15)21-22(18)26(34)28(25(21)33)12-3-7-14(30)8-4-12/h1-10,15-22,29-30H	OBHDAQCTNRIIMV-UHFFFAOYSA-N	Oc1ccc(cc1)N2C(=O)C3C4C=CC(C5C4C6C5C(=O)N(C6=O)c7ccc(O)cc7)C3C2=O	BroadT	BRD-A26738626	BRD-A26738626-001-05-5	Asinex Ltd.	BAS 01217048			Oc1ccc(cc1)N1C(=O)C2C3C(C2C1=O)C1C=CC3C2C1C(=O)N(C2=O)c1ccc(O)cc1	InChI=1S/C26H20N2O6/c29-13-5-1-11(2-6-13)27-23(31)19-15-9-10-16(20(19)24(27)32)18-17(15)21-22(18)26(34)28(25(21)33)12-3-7-14(30)8-4-12/h1-10,15-22,29-30H	OBHDAQCTNRIIMV-UHFFFAOYSA-N	456.13213638							121049
3-(4-Chlorophenyl)-2-methyl-3,3a,4,5-tetrahydro-2H-benzo[g]indazole	LSM-32493	SID26730845, BRD-A45909191	2738084	InChI=1S/C18H17ClN2/c1-21-18(13-6-9-14(19)10-7-13)16-11-8-12-4-2-3-5-15(12)17(16)20-21/h2-7,9-10,16,18H,8,11H2,1H3	SENURBWXHFEHJM-UHFFFAOYSA-N	CN1N=C2C(CCc3ccccc23)C1c4ccc(Cl)cc4	BroadT	BRD-A45909191	BRD-A45909191-001-05-4	Maybridge	S 15440			CN1N=C2C(CCc3ccccc23)C1c1ccc(Cl)cc1	InChI=1S/C18H17ClN2/c1-21-18(13-6-9-14(19)10-7-13)16-11-8-12-4-2-3-5-15(12)17(16)20-21/h2-7,9-10,16,18H,8,11H2,1H3	SENURBWXHFEHJM-UHFFFAOYSA-N	296.108026274							121050
SMR000002461	LSM-32494	SID26667588, SID849679, BRD-A00710263	652186	InChI=1S/C26H28N6O2/c1-17-8-9-23-20(13-17)14-22(26(33)27-23)24(31-11-10-18-5-2-3-6-19(18)15-31)25-28-29-30-32(25)16-21-7-4-12-34-21/h2-3,5-6,8-9,13-14,21,24H,4,7,10-12,15-16H2,1H3,(H,27,33)	HCQQZEQULYWCSL-UHFFFAOYSA-N	Cc1ccc2nc(O)c(cc2c1)C(N3CCc4ccccc4C3)c5nnnn5CC6CCCO6	BroadT	BRD-A00710263	BRD-A00710263-001-05-2	Asinex Ltd.	ASN 03775241			Cc1ccc2nc(O)c(cc2c1)C(N1CCc2ccccc2C1)c1nnnn1CC1CCCO1	InChI=1S/C26H28N6O2/c1-17-8-9-23-20(13-17)14-22(26(33)27-23)24(31-11-10-18-5-2-3-6-19(18)15-31)25-28-29-30-32(25)16-21-7-4-12-34-21/h2-3,5-6,8-9,13-14,21,24H,4,7,10-12,15-16H2,1H3,(H,27,33)	HCQQZEQULYWCSL-UHFFFAOYSA-N	456.227374196							121051
AC1LOX4W	LSM-32495	BRD-K60158033	1249494	InChI=1S/C19H13N3O6/c23-19(13-3-7-17-18(9-13)27-11-26-17)21-20-10-15-6-8-16(28-15)12-1-4-14(5-2-12)22(24)25/h1-10H,11H2,(H,21,23)	UZQVNUQKFRFJTB-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)c2oc(C=NNC(=O)c3ccc4OCOc4c3)cc2	BroadT	BRD-K60158033	BRD-K60158033-001-05-8	ChemDiv Inc.	8007-7694			[O-][N+](=O)c1ccc(cc1)-c1ccc(C=NNC(=O)c2ccc3OCOc3c2)o1	InChI=1S/C19H13N3O6/c23-19(13-3-7-17-18(9-13)27-11-26-17)21-20-10-15-6-8-16(28-15)12-1-4-14(5-2-12)22(24)25/h1-10H,11H2,(H,21,23)	UZQVNUQKFRFJTB-UHFFFAOYSA-N	379.080435166							121052
MLS000072469	LSM-32496	SID842452, BRD-A78139342	644717	InChI=1S/C22H24N2O5/c25-21(23-16-7-2-1-3-8-16)20(18-10-5-13-28-18)24(15-17-9-4-12-27-17)22(26)19-11-6-14-29-19/h4-6,9-14,16,20H,1-3,7-8,15H2,(H,23,25)	HEXMJJGHWGOAEY-UHFFFAOYSA-N	O=C(NC1CCCCC1)C(N(Cc2occc2)C(=O)c3occc3)c4occc4	BroadT	BRD-A78139342	BRD-A78139342-001-05-6	Asinex Ltd.	ASN 04884667			O=C(NC1CCCCC1)C(N(Cc1ccco1)C(=O)c1ccco1)c1ccco1	InChI=1S/C22H24N2O5/c25-21(23-16-7-2-1-3-8-16)20(18-10-5-13-28-18)24(15-17-9-4-12-27-17)22(26)19-11-6-14-29-19/h4-6,9-14,16,20H,1-3,7-8,15H2,(H,23,25)	HEXMJJGHWGOAEY-UHFFFAOYSA-N	396.168521888							121053
AC1NKTWV	LSM-32497	BRD-K74184243	4894174	InChI=1S/C13H14ClN5O2/c1-20-9-4-3-8(5-10(9)21-2)6-18-19-13-11(15)12(14)16-7-17-13/h3-7H,15H2,1-2H3,(H,16,17,19)	LQYLQIVZSCODTL-UHFFFAOYSA-N	COc1ccc(C=NNc2ncnc(Cl)c2N)cc1OC	BroadT	BRD-K74184243	BRD-K74184243-001-06-2	InterBioScreen Ltd.	STOCK5S-51810			COc1ccc(C=NNc2ncnc(Cl)c2N)cc1OC	InChI=1S/C13H14ClN5O2/c1-20-9-4-3-8(5-10(9)21-2)6-18-19-13-11(15)12(14)16-7-17-13/h3-7H,15H2,1-2H3,(H,16,17,19)	LQYLQIVZSCODTL-UHFFFAOYSA-N	307.083602448							121054
ZINC00467575	LSM-32498	SID24792911, BRD-K66959386	891823	InChI=1S/C16H13N3O3/c1-20-12-6-4-11(5-7-12)15-19-14(9-17)16(22-15)18-10-13-3-2-8-21-13/h2-8,18H,10H2,1H3	FSLQMTMAJRMVOR-UHFFFAOYSA-N	COc1ccc(cc1)c2oc(NCc3occc3)c(n2)C#N	BroadT	BRD-K66959386	BRD-K66959386-001-06-4	ChemBridge Corporation	7501725			COc1ccc(cc1)-c1nc(C#N)c(NCc2ccco2)o1	InChI=1S/C16H13N3O3/c1-20-12-6-4-11(5-7-12)15-19-14(9-17)16(22-15)18-10-13-3-2-8-21-13/h2-8,18H,10H2,1H3	FSLQMTMAJRMVOR-UHFFFAOYSA-N	295.095691306							121055
SMR000220862	LSM-32499	SID110722969, SID17505660, BRD-K04319405	1424303	InChI=1S/C23H20N4O3S/c1-16-3-7-18(8-4-16)22-24-25-23(26(22)19-11-13-21(30-2)14-12-19)31-15-17-5-9-20(10-6-17)27(28)29/h3-14H,15H2,1-2H3	JELUGDKNMWECQI-UHFFFAOYSA-N	COc1ccc(cc1)n2c(SCc3ccc(cc3)[N+](=O)[O-])nnc2c4ccc(C)cc4	BroadT	BRD-K04319405	BRD-K04319405-001-10-5	InterBioScreen Ltd.	STOCK4S-94527			COc1ccc(cc1)-n1c(SCc2ccc(cc2)[N+]([O-])=O)nnc1-c1ccc(C)cc1	InChI=1S/C23H20N4O3S/c1-16-3-7-18(8-4-16)22-24-25-23(26(22)19-11-13-21(30-2)14-12-19)31-15-17-5-9-20(10-6-17)27(28)29/h3-14H,15H2,1-2H3	JELUGDKNMWECQI-UHFFFAOYSA-N	432.12561123							121056
SMR000207948	LSM-32500	SID17512513, BRD-K89306458	5169190	InChI=1S/C21H18ClFN2O3S/c1-2-25(18-9-4-3-5-10-18)29(27,28)20-13-15(11-12-19(20)23)21(26)24-17-8-6-7-16(22)14-17/h3-14H,2H2,1H3,(H,24,26)	IRCBCZWNDSWXMQ-UHFFFAOYSA-N	CCN(c1ccccc1)S(=O)(=O)c2cc(ccc2F)C(=O)Nc3cccc(Cl)c3	BroadT	BRD-K89306458	BRD-K89306458-001-05-6	ChemDiv Inc.	K781-6753			CCN(c1ccccc1)S(=O)(=O)c1cc(ccc1F)C(=O)Nc1cccc(Cl)c1	InChI=1S/C21H18ClFN2O3S/c1-2-25(18-9-4-3-5-10-18)29(27,28)20-13-15(11-12-19(20)23)21(26)24-17-8-6-7-16(22)14-17/h3-14H,2H2,1H3,(H,24,26)	IRCBCZWNDSWXMQ-UHFFFAOYSA-N	432.071069056							121057
BAS 07213796	LSM-32501	SID846171, BRD-K98919736	648553	InChI=1S/C11H7F3N2O3S/c12-5-1-2-6(10(14)9(5)13)15-7(17)3-16-8(18)4-20-11(16)19/h1-2H,3-4H2,(H,15,17)	LIUSCLYEBGVJRP-UHFFFAOYSA-N	Fc1ccc(NC(=O)CN2C(=O)CSC2=O)c(F)c1F	BroadT	BRD-K98919736	BRD-K98919736-001-05-9	Asinex Ltd.	BAS 07213796			Fc1ccc(NC(=O)CN2C(=O)CSC2=O)c(F)c1F	InChI=1S/C11H7F3N2O3S/c12-5-1-2-6(10(14)9(5)13)15-7(17)3-16-8(18)4-20-11(16)19/h1-2H,3-4H2,(H,15,17)	LIUSCLYEBGVJRP-UHFFFAOYSA-N	304.012947394							121058
MLS000592052	LSM-32502	SID24783929, BRD-K43158356	1831876	InChI=1S/C12H7BrFNO3/c13-8-5-7(6-18-12(8)17)11(16)15-10-4-2-1-3-9(10)14/h1-6H,(H,15,16)	JVUIIZYAJVJVIZ-UHFFFAOYSA-N	Fc1ccccc1NC(=O)C2=COC(=O)C(=C2)Br	BroadT	BRD-K43158356	BRD-K43158356-001-07-5	InterBioScreen Ltd.	STOCK2S-30591			Fc1ccccc1NC(=O)c1coc(=O)c(Br)c1	InChI=1S/C12H7BrFNO3/c13-8-5-7(6-18-12(8)17)11(16)15-10-4-2-1-3-9(10)14/h1-6H,(H,15,16)	JVUIIZYAJVJVIZ-UHFFFAOYSA-N	310.959333894							121059
MLS000063101	LSM-32503	SID4257222, SID7965285, BRD-K51956656	993259	InChI=1S/C15H11F3N4O3S/c1-8-5-12(22-25-8)21-13(23)7-26-14-19-9(10-3-2-4-24-10)6-11(20-14)15(16,17)18/h2-6H,7H2,1H3,(H,21,22,23)	NALDCJLSQFALCV-UHFFFAOYSA-N	Cc1onc(NC(=O)CSc2nc(cc(n2)C(F)(F)F)c3occc3)c1	BroadT	BRD-K51956656	BRD-K51956656-001-07-8	ChemDiv Inc.	6466-0819			Cc1cc(NC(=O)CSc2nc(cc(n2)C(F)(F)F)-c2ccco2)no1	InChI=1S/C15H11F3N4O3S/c1-8-5-12(22-25-8)21-13(23)7-26-14-19-9(10-3-2-4-24-10)6-11(20-14)15(16,17)18/h2-6H,7H2,1H3,(H,21,22,23)	NALDCJLSQFALCV-UHFFFAOYSA-N	384.050395542							121060
SMR000046419	LSM-32504	SID864170, BRD-K05510364	665417	InChI=1S/C20H18N4O3/c1-12-15-8-9-17(26-11-18-21-23-24-22-18)13(2)19(15)27-20(25)16(12)10-14-6-4-3-5-7-14/h3-9H,10-11H2,1-2H3,(H,21,22,23,24)	STBUDKIRLAIWSI-UHFFFAOYSA-N	CC1=C(Cc2ccccc2)C(=O)Oc3c(C)c(OCc4nn[nH]n4)ccc13	BroadT	BRD-K05510364	BRD-K05510364-001-04-0	InterBioScreen Ltd.	STOCK5S-01859			Cc1c(OCc2nn[nH]n2)ccc2c(C)c(Cc3ccccc3)c(=O)oc12	InChI=1S/C20H18N4O3/c1-12-15-8-9-17(26-11-18-21-23-24-22-18)13(2)19(15)27-20(25)16(12)10-14-6-4-3-5-7-14/h3-9H,10-11H2,1-2H3,(H,21,22,23,24)	STBUDKIRLAIWSI-UHFFFAOYSA-N	362.137890476							121061
2-Chloro-12-[(4-methoxyphenyl)sulfonyl]-12H-quinoxalino[2,3-b][1,4]benzoxazine	LSM-32505	SID14727439, BRD-K01169312	1211576	InChI=1S/C21H14ClN3O4S/c1-28-14-7-9-15(10-8-14)30(26,27)25-18-12-13(22)6-11-19(18)29-21-20(25)23-16-4-2-3-5-17(16)24-21/h2-12H,1H3	NOINQIQOKCGVPO-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)N2c3cc(Cl)ccc3Oc4nc5ccccc5nc24	BroadT	BRD-K01169312	BRD-K01169312-001-11-7	Specs	AI-204/37138005			COc1ccc(cc1)S(=O)(=O)N1c2cc(Cl)ccc2Oc2nc3ccccc3nc12	InChI=1S/C21H14ClN3O4S/c1-28-14-7-9-15(10-8-14)30(26,27)25-18-12-13(22)6-11-19(18)29-21-20(25)23-16-4-2-3-5-17(16)24-21/h2-12H,1H3	NOINQIQOKCGVPO-UHFFFAOYSA-N	439.039354358							121062
T5283762	LSM-32506	SID22402522, BRD-A97560481	4334146	InChI=1S/C19H20FN3O5S/c1-23(13-8-10-29(26,27)12-13)17(24)11-28-19(25)14-5-4-9-21-18(14)22-16-7-3-2-6-15(16)20/h2-7,9,13H,8,10-12H2,1H3,(H,21,22)	NIHXOKKSLJWZOK-UHFFFAOYSA-N	CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)c2cccnc2Nc3ccccc3F	BroadT	BRD-A97560481	BRD-A97560481-001-05-1	Enamine Ltd.	T5283762			CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)c1cccnc1Nc1ccccc1F	InChI=1S/C19H20FN3O5S/c1-23(13-8-10-29(26,27)12-13)17(24)11-28-19(25)14-5-4-9-21-18(14)22-16-7-3-2-6-15(16)20/h2-7,9,13H,8,10-12H2,1H3,(H,21,22)	NIHXOKKSLJWZOK-UHFFFAOYSA-N	421.11076966							121063
ASN 06396459	LSM-32507	SID14721582, BRD-A00983620	3220251	InChI=1S/C19H21NO4/c21-18(20-15-10-5-2-6-11-15)17(14-8-3-1-4-9-14)24-19(22)16-12-7-13-23-16/h1,3-4,7-9,12-13,15,17H,2,5-6,10-11H2,(H,20,21)	MHIKKOAYWFREPC-UHFFFAOYSA-N	O=C(NC1CCCCC1)C(OC(=O)c2occc2)c3ccccc3	BroadT	BRD-A00983620	BRD-A00983620-001-05-3	Asinex Ltd.	ASN 06396459			O=C(NC1CCCCC1)C(OC(=O)c1ccco1)c1ccccc1	InChI=1S/C19H21NO4/c21-18(20-15-10-5-2-6-11-15)17(14-8-3-1-4-9-14)24-19(22)16-12-7-13-23-16/h1,3-4,7-9,12-13,15,17H,2,5-6,10-11H2,(H,20,21)	MHIKKOAYWFREPC-UHFFFAOYSA-N	327.147058162							121064
N,N-Di-but-2-ynyl-3-methoxy-4-tetrazol-1-yl-benzenesulfonamide	LSM-32508	SID845284, BRD-K52116517	647624	InChI=1S/C16H17N5O3S/c1-4-6-10-20(11-7-5-2)25(22,23)14-8-9-15(16(12-14)24-3)21-13-17-18-19-21/h8-9,12-13H,10-11H2,1-3H3	UUTKTPGHPRSOMO-UHFFFAOYSA-N	COc1cc(ccc1n2cnnn2)S(=O)(=O)N(CC#CC)CC#CC	BroadT	BRD-K52116517	BRD-K52116517-001-05-1	Asinex Ltd.	ASN 04887075			COc1cc(ccc1-n1cnnn1)S(=O)(=O)N(CC#CC)CC#CC	InChI=1S/C16H17N5O3S/c1-4-6-10-20(11-7-5-2)25(22,23)14-8-9-15(16(12-14)24-3)21-13-17-18-19-21/h8-9,12-13H,10-11H2,1-3H3	UUTKTPGHPRSOMO-UHFFFAOYSA-N	359.105210144							121065
MLS000080977	LSM-32509	SID863739, BRD-K80185548	664991	InChI=1S/C24H26N4O5/c1-31-24(30)23-22(17-4-2-3-5-18(17)25-23)26-21(29)14-28-10-8-27(9-11-28)13-16-6-7-19-20(12-16)33-15-32-19/h2-7,12,25H,8-11,13-15H2,1H3,(H,26,29)	CJFDUIYFAFOGGV-UHFFFAOYSA-N	COC(=O)c1[nH]c2ccccc2c1NC(=O)CN3CCN(Cc4ccc5OCOc5c4)CC3	BroadT	BRD-K80185548	BRD-K80185548-001-05-5	InterBioScreen Ltd.	STOCK4S-83472			COC(=O)c1[nH]c2ccccc2c1NC(=O)CN1CCN(Cc2ccc3OCOc3c2)CC1	InChI=1S/C24H26N4O5/c1-31-24(30)23-22(17-4-2-3-5-18(17)25-23)26-21(29)14-28-10-8-27(9-11-28)13-16-6-7-19-20(12-16)33-15-32-19/h2-7,12,25H,8-11,13-15H2,1H3,(H,26,29)	CJFDUIYFAFOGGV-UHFFFAOYSA-N	450.190319972							121066
T5306050	LSM-32510	SID26669793, BRD-K52580035	2440240	InChI=1S/C15H8Cl2N4O2S/c16-8-3-10-13(11(17)4-8)18-7-19-14(10)23-6-9-5-12(22)21-1-2-24-15(21)20-9/h1-5,7H,6H2	QMSBGRMIUYUUIW-UHFFFAOYSA-N	Clc1cc(Cl)c2ncnc(OCC3=CC(=O)N4C=CSC4=N3)c2c1	BroadT	BRD-K52580035	BRD-K52580035-001-06-9	Enamine Ltd.	T5306050			Clc1cc(Cl)c2ncnc(OCc3cc(=O)n4ccsc4n3)c2c1	InChI=1S/C15H8Cl2N4O2S/c16-8-3-10-13(11(17)4-8)18-7-19-14(10)23-6-9-5-12(22)21-1-2-24-15(21)20-9/h1-5,7H,6H2	QMSBGRMIUYUUIW-UHFFFAOYSA-N	377.974501646							121067
AC1OAJI8	LSM-32511	SID26660926, BRD-A26173532	6805662	InChI=1S/C22H19N3O/c1-15(16-9-3-2-4-10-16)23-21-17-11-5-7-13-19(17)24-22(25-21)18-12-6-8-14-20(18)26/h2-15,26H,1H3,(H,23,24,25)	BHYGZDWYCCTSHC-UHFFFAOYSA-N	CC(Nc1nc(nc2ccccc12)c3ccccc3O)c4ccccc4	BroadT	BRD-A26173532	BRD-A26173532-001-07-4	InterBioScreen Ltd.	STOCK3S-81925			CC(Nc1nc(nc2ccccc12)-c1ccccc1O)c1ccccc1	InChI=1S/C22H19N3O/c1-15(16-9-3-2-4-10-16)23-21-17-11-5-7-13-19(17)24-22(25-21)18-12-6-8-14-20(18)26/h2-15,26H,1H3,(H,23,24,25)	BHYGZDWYCCTSHC-UHFFFAOYSA-N	341.152812258							
SMR000047604	LSM-32512	SID865065, BRD-A48801944	666311	InChI=1S/C23H23N5O3/c1-15-12-19-21(23(29)28(15)10-5-9-27-11-8-26-14-27)20(17(13-24)22(25)31-19)16-6-3-4-7-18(16)30-2/h3-4,6-8,11-12,14,20H,5,9-10,25H2,1-2H3	YQJOIICSDOBTGW-UHFFFAOYSA-N	COc1ccccc1C2C(=C(N)OC3=C2C(=O)N(CCCn4ccnc4)C(=C3)C)C#N	BroadT	BRD-A48801944	BRD-A48801944-001-05-0	InterBioScreen Ltd.	STOCK5S-35595			COc1ccccc1C1C(C#N)=C(N)Oc2cc(C)n(CCCn3ccnc3)c(=O)c12	InChI=1S/C23H23N5O3/c1-15-12-19-21(23(29)28(15)10-5-9-27-11-8-26-14-27)20(17(13-24)22(25)31-19)16-6-3-4-7-18(16)30-2/h3-4,6-8,11-12,14,20H,5,9-10,25H2,1-2H3	YQJOIICSDOBTGW-UHFFFAOYSA-N	417.180089646							121069
AC1MMPDN	LSM-32513	SID4248242, SID56373602, BRD-K36108011	3242344	InChI=1S/C22H15ClN4OS/c1-26-11-15(17-4-2-3-5-19(17)26)10-25-27-13-24-21-20(22(27)28)18(12-29-21)14-6-8-16(23)9-7-14/h2-13H,1H3	FGPRJQDJDHNLQF-UHFFFAOYSA-N	Cn1cc(C=NN2C=Nc3scc(c4ccc(Cl)cc4)c3C2=O)c5ccccc15	BroadT	BRD-K36108011	BRD-K36108011-001-09-2	ChemDiv Inc.	K018-0023			Cn1cc(C=Nn2cnc3scc(-c4ccc(Cl)cc4)c3c2=O)c2ccccc12	InChI=1S/C22H15ClN4OS/c1-26-11-15(17-4-2-3-5-19(17)26)10-25-27-13-24-21-20(22(27)28)18(12-29-21)14-6-8-16(23)9-7-14/h2-13H,1H3	FGPRJQDJDHNLQF-UHFFFAOYSA-N	418.06550954							121070
NSC688795	LSM-32514	SID522079, SID850730, BRD-K11394824	390799	InChI=1S/C12H12O4/c1-7-4-11(13)16-10-6-8(14-2)5-9(15-3)12(7)10/h4-6H,1-3H3	WFSKVHPOKPQJSU-UHFFFAOYSA-N	COc1cc(OC)c2C(=CC(=O)Oc2c1)C	BroadT	BRD-K11394824	BRD-K11394824-001-06-0	Asinex Ltd.	BAS 00872573			COc1cc(OC)c2c(C)cc(=O)oc2c1	InChI=1S/C12H12O4/c1-7-4-11(13)16-10-6-8(14-2)5-9(15-3)12(7)10/h4-6H,1-3H3	WFSKVHPOKPQJSU-UHFFFAOYSA-N	220.073558864							121071
MLS000590033	LSM-32515	SID17513676, BRD-K04564797	3449788	InChI=1S/C24H25N5O3/c1-18-4-6-20(7-5-18)24(30)28-13-11-27(12-14-28)21-8-9-23(29(31)32)22(15-21)26-17-19-3-2-10-25-16-19/h2-10,15-16,26H,11-14,17H2,1H3	JCYSKWDKOFDAPL-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)N2CCN(CC2)c3ccc(c(NCc4cccnc4)c3)[N+](=O)[O-]	BroadT	BRD-K04564797	BRD-K04564797-001-05-2	InterBioScreen Ltd.	STOCK3S-81170			Cc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(NCc2cccnc2)c1)[N+]([O-])=O	InChI=1S/C24H25N5O3/c1-18-4-6-20(7-5-18)24(30)28-13-11-27(12-14-28)21-8-9-23(29(31)32)22(15-21)26-17-19-3-2-10-25-16-19/h2-10,15-16,26H,11-14,17H2,1H3	JCYSKWDKOFDAPL-UHFFFAOYSA-N	431.19573971							121072
AC1NGTYQ	LSM-32516	SID24828815, BRD-K86087432	4779956	InChI=1S/C13H14BrN5O3S/c1-19-8-15-18-13(19)23-7-12(21)17-16-11(20)6-22-10-4-2-9(14)3-5-10/h2-5,8H,6-7H2,1H3,(H,16,20)(H,17,21)	RFXXXWBNHUKBJR-UHFFFAOYSA-N	Cn1cnnc1SCC(=O)NNC(=O)COc2ccc(Br)cc2	BroadT	BRD-K86087432	BRD-K86087432-001-05-6	Enamine Ltd.	T5342644			Cn1cnnc1SCC(=O)NNC(=O)COc1ccc(Br)cc1	InChI=1S/C13H14BrN5O3S/c1-19-8-15-18-13(19)23-7-12(21)17-16-11(20)6-22-10-4-2-9(14)3-5-10/h2-5,8H,6-7H2,1H3,(H,16,20)(H,17,21)	RFXXXWBNHUKBJR-UHFFFAOYSA-N	399.000072648							121073
T5272172	LSM-32517	SID22410418, BRD-K22677727	4422794	InChI=1S/C22H20Cl2N2O4S/c1-14(2)30-19-10-3-15(4-11-19)22(27)25-18-9-12-20(24)21(13-18)31(28,29)26-17-7-5-16(23)6-8-17/h3-14,26H,1-2H3,(H,25,27)	DMAHLYYAJHRJTF-UHFFFAOYSA-N	CC(C)Oc1ccc(cc1)C(=O)Nc2ccc(Cl)c(c2)S(=O)(=O)Nc3ccc(Cl)cc3	BroadT	BRD-K22677727	BRD-K22677727-001-05-5	Enamine Ltd.	T5272172			CC(C)Oc1ccc(cc1)C(=O)Nc1ccc(Cl)c(c1)S(=O)(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H20Cl2N2O4S/c1-14(2)30-19-10-3-15(4-11-19)22(27)25-18-9-12-20(24)21(13-18)31(28,29)26-17-7-5-16(23)6-8-17/h3-14,26H,1-2H3,(H,25,27)	DMAHLYYAJHRJTF-UHFFFAOYSA-N	478.05208325							121074
MLS000577230	LSM-44411	SID17506104, BRD-K73822510	1320816	InChI=1S/C19H19N3O4/c1-13(2)20-19(24)16-8-3-4-9-17(16)21-18(23)11-10-14-6-5-7-15(12-14)22(25)26/h3-13H,1-2H3,(H,20,24)(H,21,23)/b11-10+	LKFARCIUSZIGKW-ZHACJKMWSA-N	CC(C)NC(=O)c1ccccc1NC(=O)\C=C\c2cccc(c2)[N+](=O)[O-]	BroadT	BRD-K73822510	BRD-K73822510-001-06-4	ChemBridge Corporation	7135034			CC(C)NC(=O)c1ccccc1NC(=O)\C=C\c1cccc(c1)[N+]([O-])=O	InChI=1S/C19H19N3O4/c1-13(2)20-19(24)16-8-3-4-9-17(16)21-18(23)11-10-14-6-5-7-15(12-14)22(25)26/h3-13H,1-2H3,(H,20,24)(H,21,23)/b11-10+	LKFARCIUSZIGKW-ZHACJKMWSA-N	353.137556118							
F0621-0230	LSM-32519	SID24782107, BRD-A94239438	3417745	InChI=1S/C22H27N3O3S/c1-4-16(5-2)22(26)25-21(18-9-7-6-8-10-18)15-20(23-25)17-11-13-19(14-12-17)24-29(3,27)28/h6-14,16,21,24H,4-5,15H2,1-3H3	DFHGKXFEASXWGT-UHFFFAOYSA-N	CCC(CC)C(=O)N1N=C(CC1c2ccccc2)c3ccc(NS(=O)(=O)C)cc3	BroadT	BRD-A94239438	BRD-A94239438-001-05-9	Life Chemicals Inc.	F0621-0230			CCC(CC)C(=O)N1N=C(CC1c1ccccc1)c1ccc(NS(C)(=O)=O)cc1	InChI=1S/C22H27N3O3S/c1-4-16(5-2)22(26)25-21(18-9-7-6-8-10-18)15-20(23-25)17-11-13-19(14-12-17)24-29(3,27)28/h6-14,16,21,24H,4-5,15H2,1-3H3	DFHGKXFEASXWGT-UHFFFAOYSA-N	413.177312444							121076
ST50635383	LSM-44412	SID17433738, BRD-K35940657	890257	InChI=1S/C14H11N3O3/c18-14(16-12-5-3-9-15-10-12)8-7-11-4-1-2-6-13(11)17(19)20/h1-10H,(H,16,18)/b8-7+	RWFVCXGZUUADHP-BQYQJAHWSA-N	[O-][N+](=O)c1ccccc1\C=C\C(=O)Nc2cccnc2	BroadT	BRD-K35940657	BRD-K35940657-001-05-6	ChemBridge Corporation	7417941			[O-][N+](=O)c1ccccc1\C=C\C(=O)Nc1cccnc1	InChI=1S/C14H11N3O3/c18-14(16-12-5-3-9-15-10-12)8-7-11-4-1-2-6-13(11)17(19)20/h1-10H,(H,16,18)/b8-7+	RWFVCXGZUUADHP-BQYQJAHWSA-N	269.080041242							
N-(3,5-Dimethylphenyl)-2,5-dimethyl-1-(2-thienylmethyl)-1H-pyrrole-3-carboxamide	LSM-32521	SID26727351, BRD-K13627137	2742292	InChI=1S/C20H22N2OS/c1-13-8-14(2)10-17(9-13)21-20(23)19-11-15(3)22(16(19)4)12-18-6-5-7-24-18/h5-11H,12H2,1-4H3,(H,21,23)	RBBZRAXJMSUNJB-UHFFFAOYSA-N	Cc1cc(C)cc(NC(=O)c2cc(C)n(Cc3cccs3)c2C)c1	BroadT	BRD-K13627137	BRD-K13627137-001-05-5	Maybridge	SP 00306			Cc1cc(C(=O)Nc2cc(C)cc(C)c2)c(C)n1Cc1cccs1	InChI=1S/C20H22N2OS/c1-13-8-14(2)10-17(9-13)21-20(23)19-11-15(3)22(16(19)4)12-18-6-5-7-24-18/h5-11H,12H2,1-4H3,(H,21,23)	RBBZRAXJMSUNJB-UHFFFAOYSA-N	338.145284034							121078
MLS000335527	LSM-32522	BRD-K66963205	4298260	InChI=1S/C22H25F2N3O4S/c1-3-4-10-26-19(28)16(14-25)21-27(11-7-12-30-2)20(29)18(32-21)13-15-8-5-6-9-17(15)31-22(23)24/h5-6,8-9,13,22H,3-4,7,10-12H2,1-2H3,(H,26,28)	SSWVXUHRIZUHRC-UHFFFAOYSA-N	CCCCNC(=O)C(=C1SC(=Cc2ccccc2OC(F)F)C(=O)N1CCCOC)C#N	BroadT	BRD-K66963205	BRD-K66963205-001-05-7	Enamine Ltd.	T0520-0802			CCCCNC(=O)C(C#N)=c1sc(=Cc2ccccc2OC(F)F)c(=O)n1CCCOC	InChI=1S/C22H25F2N3O4S/c1-3-4-10-26-19(28)16(14-25)21-27(11-7-12-30-2)20(29)18(32-21)13-15-8-5-6-9-17(15)31-22(23)24/h5-6,8-9,13,22H,3-4,7,10-12H2,1-2H3,(H,26,28)	SSWVXUHRIZUHRC-UHFFFAOYSA-N	465.1533834							121079
MLS000389736	LSM-32523	SID22407235, BRD-K80014791	4652865	InChI=1S/C21H25N3O4S/c1-5-28-20(26)19-14(3)22-13(2)18(19)17(25)12-29-21-23-15-8-6-7-9-16(15)24(21)10-11-27-4/h6-9,22H,5,10-12H2,1-4H3	LDBFDCQMIDRGJY-UHFFFAOYSA-N	CCOC(=O)c1c(C)[nH]c(C)c1C(=O)CSc2nc3ccccc3n2CCOC	BroadT	BRD-K80014791	BRD-K80014791-001-06-9	Enamine Ltd.	T5222970			CCOC(=O)c1c(C)[nH]c(C)c1C(=O)CSc1nc2ccccc2n1CCOC	InChI=1S/C21H25N3O4S/c1-5-28-20(26)19-14(3)22-13(2)18(19)17(25)12-29-21-23-15-8-6-7-9-16(15)24(21)10-11-27-4/h6-9,22H,5,10-12H2,1-4H3	LDBFDCQMIDRGJY-UHFFFAOYSA-N	415.156577							121080
AC1M3YQT	LSM-32524	SID24795406, BRD-K28115689	2199293	InChI=1S/C15H20N2O2/c16-15(13-8-2-1-3-9-13)17-19-14(18)11-10-12-6-4-5-7-12/h1-3,8-9,12H,4-7,10-11H2,(H2,16,17)	JPBPZIJXUXANRK-UHFFFAOYSA-N	N=C(NOC(=O)CCC1CCCC1)c2ccccc2	BroadT	BRD-K28115689	BRD-K28115689-001-05-6	ChemBridge Corporation	7707778			N=C(NOC(=O)CCC1CCCC1)c1ccccc1	InChI=1S/C15H20N2O2/c16-15(13-8-2-1-3-9-13)17-19-14(18)11-10-12-6-4-5-7-12/h1-3,8-9,12H,4-7,10-11H2,(H2,16,17)	JPBPZIJXUXANRK-UHFFFAOYSA-N	260.1524779							121081
1-(2,4-Dichlorobenzyl)-3-phenylthiourea	LSM-32525	SID22415127, BRD-K89140453	887034	InChI=1S/C14H12Cl2N2S/c15-11-7-6-10(13(16)8-11)9-17-14(19)18-12-4-2-1-3-5-12/h1-8H,9H2,(H2,17,18,19)	UZZSBHPQFNQHIB-UHFFFAOYSA-N	Clc1ccc(CNC(=S)Nc2ccccc2)c(Cl)c1	BroadT	BRD-K89140453	BRD-K89140453-001-05-4	ChemBridge Corporation	7160581			Clc1ccc(CNC(=S)Nc2ccccc2)c(Cl)c1	InChI=1S/C14H12Cl2N2S/c15-11-7-6-10(13(16)8-11)9-17-14(19)18-12-4-2-1-3-5-12/h1-8H,9H2,(H2,17,18,19)	UZZSBHPQFNQHIB-UHFFFAOYSA-N	310.009824514							121082
ASN 05788967	LSM-32526	SID849324, BRD-K99826671	651813	InChI=1S/C19H21N3O2S2/c1-2-15-21-18(25-11-16(23)20-10-12-6-5-9-24-12)17-13-7-3-4-8-14(13)26-19(17)22-15/h5-6,9H,2-4,7-8,10-11H2,1H3,(H,20,23)	SHVQDYUDVRFCFR-UHFFFAOYSA-N	CCc1nc(SCC(=O)NCc2occc2)c3c4CCCCc4sc3n1	BroadT	BRD-K99826671	BRD-K99826671-001-05-2	Asinex Ltd.	ASN 05788967			CCc1nc(SCC(=O)NCc2ccco2)c2c3CCCCc3sc2n1	InChI=1S/C19H21N3O2S2/c1-2-15-21-18(25-11-16(23)20-10-12-6-5-9-24-12)17-13-7-3-4-8-14(13)26-19(17)22-15/h5-6,9H,2-4,7-8,10-11H2,1H3,(H,20,23)	SHVQDYUDVRFCFR-UHFFFAOYSA-N	387.107518322							121083
OPREA1_380101	LSM-32527	BRD-K28347138	1122347	InChI=1S/C15H14N2O5/c1-21-15-8-12(9-16-18)4-7-14(15)22-10-11-2-5-13(6-3-11)17(19)20/h2-9,18H,10H2,1H3	UNVDOFRLFOJNHX-UHFFFAOYSA-N	COc1cc(C=NO)ccc1OCc2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K28347138	BRD-K28347138-001-06-0	ChemBridge Corporation	6800640			COc1cc(C=NO)ccc1OCc1ccc(cc1)[N+]([O-])=O	InChI=1S/C15H14N2O5/c1-21-15-8-12(9-16-18)4-7-14(15)22-10-11-2-5-13(6-3-11)17(19)20/h2-9,18H,10H2,1H3	UNVDOFRLFOJNHX-UHFFFAOYSA-N	302.090271568							121084
Ethyl 2-[[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetate	LSM-32528	SID852877, BRD-K03159241	655522	InChI=1S/C12H10Cl2N2O3S/c1-2-18-10(17)6-20-12-16-15-11(19-12)8-4-3-7(13)5-9(8)14/h3-5H,2,6H2,1H3	XJUATJBQCZPMSW-UHFFFAOYSA-N	CCOC(=O)CSc1oc(nn1)c2ccc(Cl)cc2Cl	BroadT	BRD-K03159241	BRD-K03159241-001-05-4	Asinex Ltd.	BAS 00243125			CCOC(=O)CSc1nnc(o1)-c1ccc(Cl)cc1Cl	InChI=1S/C12H10Cl2N2O3S/c1-2-18-10(17)6-20-12-16-15-11(19-12)8-4-3-7(13)5-9(8)14/h3-5H,2,6H2,1H3	XJUATJBQCZPMSW-UHFFFAOYSA-N	331.97891831							121085
MLS000033953	LSM-32529	SID847790, BRD-K14988085	54690425	InChI=1S/C18H17N3O3/c1-2-21-14-8-4-3-7-13(14)16(22)15(18(21)24)17(23)20-11-12-6-5-9-19-10-12/h3-10,22H,2,11H2,1H3,(H,20,23)	RVBCZKULBWPCRX-UHFFFAOYSA-N	CCN1C(=O)C(=C(O)c2ccccc12)C(=O)NCc3cccnc3	BroadT	BRD-K14988085	BRD-K14988085-001-06-0	Asinex Ltd.	BAS 00287702			CCn1c2ccccc2c(O)c(C(=O)NCc2cccnc2)c1=O	InChI=1S/C18H17N3O3/c1-2-21-14-8-4-3-7-13(14)16(22)15(18(21)24)17(23)20-11-12-6-5-9-19-10-12/h3-10,22H,2,11H2,1H3,(H,20,23)	RVBCZKULBWPCRX-UHFFFAOYSA-N	323.126991434							121086
SMR000142915	LSM-32530	SID14736122, BRD-K01636123	1296576	InChI=1S/C26H26N4O2S/c1-32-23-15-13-22(14-16-23)30-24(17-12-20-8-4-2-5-9-20)28-29-26(30)33-19-25(31)27-18-21-10-6-3-7-11-21/h2-11,13-16H,12,17-19H2,1H3,(H,27,31)	HICASLFWFAHBOB-UHFFFAOYSA-N	COc1ccc(cc1)n2c(CCc3ccccc3)nnc2SCC(=O)NCc4ccccc4	BroadT	BRD-K01636123	BRD-K01636123-001-05-6	ChemBridge Corporation	7699603			COc1ccc(cc1)-n1c(CCc2ccccc2)nnc1SCC(=O)NCc1ccccc1	InChI=1S/C26H26N4O2S/c1-32-23-15-13-22(14-16-23)30-24(17-12-20-8-4-2-5-9-20)28-29-26(30)33-19-25(31)27-18-21-10-6-3-7-11-21/h2-11,13-16H,12,17-19H2,1H3,(H,27,31)	HICASLFWFAHBOB-UHFFFAOYSA-N	458.177646802							121087
AC1NKOA3	LSM-32531	SID26665598, BRD-K68596131	4891504	InChI=1S/C25H24N4O3/c1-29-21-13-12-18(27-25(31)19-10-6-7-11-22(19)32-2)16-20(21)28-23(29)14-15-26-24(30)17-8-4-3-5-9-17/h3-13,16H,14-15H2,1-2H3,(H,26,30)(H,27,31)	AHZKLLCOCOJCAQ-UHFFFAOYSA-N	COc1ccccc1C(=O)Nc2ccc3c(c2)nc(CCNC(=O)c4ccccc4)n3C	BroadT	BRD-K68596131	BRD-K68596131-001-05-2	InterBioScreen Ltd.	STOCK5S-47290			COc1ccccc1C(=O)Nc1ccc2n(C)c(CCNC(=O)c3ccccc3)nc2c1	InChI=1S/C25H24N4O3/c1-29-21-13-12-18(27-25(31)19-10-6-7-11-22(19)32-2)16-20(21)28-23(29)14-15-26-24(30)17-8-4-3-5-9-17/h3-13,16H,14-15H2,1-2H3,(H,26,30)(H,27,31)	AHZKLLCOCOJCAQ-UHFFFAOYSA-N	428.184840668							121088
3-Nitro-n-phenethyl-2-pyridinamine	LSM-32532	SID24818260, BRD-K34565058	3739008	InChI=1S/C13H13N3O2/c17-16(18)12-7-4-9-14-13(12)15-10-8-11-5-2-1-3-6-11/h1-7,9H,8,10H2,(H,14,15)	NYKXEFZUYFKCAW-UHFFFAOYSA-N	[O-][N+](=O)c1cccnc1NCCc2ccccc2	BroadT	BRD-K34565058	BRD-K34565058-001-06-5	Key Organics Ltd.	MS-3135			[O-][N+](=O)c1cccnc1NCCc1ccccc1	InChI=1S/C13H13N3O2/c17-16(18)12-7-4-9-14-13(12)15-10-8-11-5-2-1-3-6-11/h1-7,9H,8,10H2,(H,14,15)	NYKXEFZUYFKCAW-UHFFFAOYSA-N	243.100776686							121089
T5571299	LSM-32533	SID49680865, BRD-K29950543	6215536	InChI=1S/C18H15ClFNO3/c1-21(9-11-4-2-3-5-15(11)20)10-12-6-18(23)24-17-8-16(22)14(19)7-13(12)17/h2-8,22H,9-10H2,1H3	APEBDJMZLASLIL-UHFFFAOYSA-N	CN(CC1=CC(=O)Oc2cc(O)c(Cl)cc12)Cc3ccccc3F	BroadT	BRD-K29950543	BRD-K29950543-001-05-1	Enamine Ltd.	T5571299			CN(Cc1ccccc1F)Cc1cc(=O)oc2cc(O)c(Cl)cc12	InChI=1S/C18H15ClFNO3/c1-21(9-11-4-2-3-5-15(11)20)10-12-6-18(23)24-17-8-16(22)14(19)7-13(12)17/h2-8,22H,9-10H2,1H3	APEBDJMZLASLIL-UHFFFAOYSA-N	347.07244926							121090
MLS001219458	LSM-32534	SID49725814, BRD-K90362969	1452801	InChI=1S/C15H17N3O3/c1-15(2,3)14(20)17-10-6-7-12(16-9-10)18-13(19)11-5-4-8-21-11/h4-9H,1-3H3,(H,17,20)(H,16,18,19)	GHRFBZFIFYIEKN-UHFFFAOYSA-N	CC(C)(C)C(=O)Nc1ccc(NC(=O)c2occc2)nc1	BroadT	BRD-K90362969	BRD-K90362969-001-08-2	Asinex Ltd.	ASN 05804124			CC(C)(C)C(=O)Nc1ccc(NC(=O)c2ccco2)nc1	InChI=1S/C15H17N3O3/c1-15(2,3)14(20)17-10-6-7-12(16-9-10)18-13(19)11-5-4-8-21-11/h4-9H,1-3H3,(H,17,20)(H,16,18,19)	GHRFBZFIFYIEKN-UHFFFAOYSA-N	287.126991434							121091
T0520-4288	LSM-32535	SID24834697, BRD-K08134163	3892862	InChI=1S/C19H25N5O4/c1-21-17(20)16(18(26)22(2)19(21)27)14(25)12-23-8-10-24(11-9-23)13-6-4-5-7-15(13)28-3/h4-7H,8-12,20H2,1-3H3	VWFMIURXRUMGKE-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC(=O)C3=C(N)N(C)C(=O)N(C)C3=O)CC2	BroadT	BRD-K08134163	BRD-K08134163-001-05-6	Enamine Ltd.	T0520-4288			COc1ccccc1N1CCN(CC(=O)c2c(N)n(C)c(=O)n(C)c2=O)CC1	InChI=1S/C19H25N5O4/c1-21-17(20)16(18(26)22(2)19(21)27)14(25)12-23-8-10-24(11-9-23)13-6-4-5-7-15(13)28-3/h4-7H,8-12,20H2,1-3H3	VWFMIURXRUMGKE-UHFFFAOYSA-N	387.19065433							121092
2-[(2-Chlorophenyl)methylene]-n-phenethylhydrazine-1-carbothioamide	LSM-32536	BRD-K16750210	2725318	InChI=1S/C16H16ClN3S/c17-15-9-5-4-8-14(15)12-19-20-16(21)18-11-10-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H2,18,20,21)	QUKYFVRLDWWACA-UHFFFAOYSA-N	Clc1ccccc1C=NNC(=S)NCCc2ccccc2	BroadT	BRD-K16750210	BRD-K16750210-001-05-2	Life Chemicals Inc.	F0856-0480			Clc1ccccc1C=NNC(=S)NCCc1ccccc1	InChI=1S/C16H16ClN3S/c17-15-9-5-4-8-14(15)12-19-20-16(21)18-11-10-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H2,18,20,21)	QUKYFVRLDWWACA-UHFFFAOYSA-N	317.075345942							121093
F1821-0486	LSM-15456	BRD-K42313368	24892368	InChI=1S/C22H28N2O5S2/c1-4-29-22(26)20-17-10-12-24(15(2)3)14-18(17)30-21(20)23-19(25)11-13-31(27,28)16-8-6-5-7-9-16/h5-9,15H,4,10-14H2,1-3H3,(H,23,25)	PVZLSZVJARPVTO-UHFFFAOYSA-N	CCOC(=O)c1c2CCN(Cc2sc1NC(=O)CCS(=O)(=O)c3ccccc3)C(C)C	BroadT	BRD-K42313368	BRD-K42313368-003-05-3	Life Chemicals Inc.	F1821-0486		Cl	CCOC(=O)c1c(NC(=O)CCS(=O)(=O)c2ccccc2)sc2CN(CCc12)C(C)C.Cl	InChI=1S/C22H28N2O5S2.ClH/c1-4-29-22(26)20-17-10-12-24(15(2)3)14-18(17)30-21(20)23-19(25)11-13-31(27,28)16-8-6-5-7-9-16;/h5-9,15H,4,10-14H2,1-3H3,(H,23,25);1H	DPWJKNSBKRJXMN-UHFFFAOYSA-N	464.143963396							104098, 104098
MLS000083326	LSM-32537	SID131465612, SID865930, BRD-K34577751	667188	InChI=1S/C21H16ClN5OS/c22-15-6-3-5-14(11-15)20-25-26-21(27(20)12-16-7-4-10-28-16)29-13-19-23-17-8-1-2-9-18(17)24-19/h1-11H,12-13H2,(H,23,24)	CFGNRLRSPNPFQP-UHFFFAOYSA-N	Clc1cccc(c1)c2nnc(SCc3nc4ccccc4[nH]3)n2Cc5occc5	BroadT	BRD-K34577751	BRD-K34577751-001-05-2	InterBioScreen Ltd.	STOCK5S-54980			Clc1cccc(c1)-c1nnc(SCc2nc3ccccc3[nH]2)n1Cc1ccco1	InChI=1S/C21H16ClN5OS/c22-15-6-3-5-14(11-15)20-25-26-21(27(20)12-16-7-4-10-28-16)29-13-19-23-17-8-1-2-9-18(17)24-19/h1-11H,12-13H2,(H,23,24)	CFGNRLRSPNPFQP-UHFFFAOYSA-N	421.076408582							121094
AC1M2FBD	LSM-44413	SID22401412, BRD-K69489494	2142582	InChI=1S/C22H18N4O4S/c1-12-6-5-7-14(10-12)23-17(28)11-25-16-9-4-3-8-15(16)18(21(25)30)19-20(29)24-22(31)26(19)13(2)27/h3-10H,11H2,1-2H3,(H,23,28)(H,24,29,31)/b19-18-	LVSZETJUQCVNOM-HNENSFHCSA-N	CC(=O)N1C(=S)NC(=O)/C/1=C\2/C(=O)N(CC(=O)Nc3cccc(C)c3)c4ccccc24	BroadT	BRD-K69489494	BRD-K69489494-001-05-0	Life Chemicals Inc.	F1673-1927			CC(=O)N1C(=S)NC(=O)\C1=C1\C(=O)N(CC(=O)Nc2cccc(C)c2)c2ccccc12	InChI=1S/C22H18N4O4S/c1-12-6-5-7-14(10-12)23-17(28)11-25-16-9-4-3-8-15(16)18(21(25)30)19-20(29)24-22(31)26(19)13(2)27/h3-10H,11H2,1-2H3,(H,23,28)(H,24,29,31)/b19-18-	LVSZETJUQCVNOM-HNENSFHCSA-N	434.104875786							
Ethyl (2R,3S)-4,5-dioxo-2-phenyl-1-(4-sulfamoylphenyl)pyrrolidine-3-carboxylate	LSM-32539	BRD-A87630896	53453177	InChI=1S/C19H18N2O6S/c1-2-27-19(24)15-16(12-6-4-3-5-7-12)21(18(23)17(15)22)13-8-10-14(11-9-13)28(20,25)26/h3-11,15-16H,2H2,1H3,(H2,20,25,26)	TZWXKBFSTRFVFL-UHFFFAOYSA-N	CCOC(=O)C1C(N(C(=O)C1=O)c2ccc(cc2)S(=O)(=O)N)c3ccccc3	BroadT	BRD-A87630896	BRD-A87630896-001-05-3	InterBioScreen Ltd.	STOCK3S-11390			CCOC(=O)C1C(N(C(=O)C1=O)c1ccc(cc1)S(N)(=O)=O)c1ccccc1	InChI=1S/C19H18N2O6S/c1-2-27-19(24)15-16(12-6-4-3-5-7-12)21(18(23)17(15)22)13-8-10-14(11-9-13)28(20,25)26/h3-11,15-16H,2H2,1H3,(H2,20,25,26)	TZWXKBFSTRFVFL-UHFFFAOYSA-N	402.088557006							121096
ZINC03525936	LSM-32540	BRD-K71602333	6816739	InChI=1S/C21H15ClN4O/c22-15-9-7-14(8-10-15)20-12-18(17-5-1-2-6-19(17)25-20)21(27)26-24-13-16-4-3-11-23-16/h1-13,23H,(H,26,27)	JOQSPBHDPMUPDB-UHFFFAOYSA-N	Clc1ccc(cc1)c2cc(C(=O)NN=Cc3ccc[nH]3)c4ccccc4n2	BroadT	BRD-K71602333	BRD-K71602333-001-05-9	Enamine Ltd.	T0508-9790			Clc1ccc(cc1)-c1cc(C(=O)NN=Cc2ccc[nH]2)c2ccccc2n1	InChI=1S/C21H15ClN4O/c22-15-9-7-14(8-10-15)20-12-18(17-5-1-2-6-19(17)25-20)21(27)26-24-13-16-4-3-11-23-16/h1-13,23H,(H,26,27)	JOQSPBHDPMUPDB-UHFFFAOYSA-N	374.09343885							
F1018-0905	LSM-32541	SID14725027, BRD-K43185870	991702	InChI=1S/C22H20N2O5/c1-28-18-9-5-8-16-14-17(22(27)29-19(16)18)21(26)24-12-10-23(11-13-24)20(25)15-6-3-2-4-7-15/h2-9,14H,10-13H2,1H3	OSSFBFDINVYCAT-UHFFFAOYSA-N	COc1cccc2C=C(C(=O)N3CCN(CC3)C(=O)c4ccccc4)C(=O)Oc12	BroadT	BRD-K43185870	BRD-K43185870-001-05-9	Asinex Ltd.	BAS 02911889			COc1cccc2cc(C(=O)N3CCN(CC3)C(=O)c3ccccc3)c(=O)oc12	InChI=1S/C22H20N2O5/c1-28-18-9-5-8-16-14-17(22(27)29-19(16)18)21(26)24-12-10-23(11-13-24)20(25)15-6-3-2-4-7-15/h2-9,14H,10-13H2,1H3	OSSFBFDINVYCAT-UHFFFAOYSA-N	392.13722176							121098
SMR000060512	LSM-32542	SID3711641, BRD-K09412958	700979	InChI=1S/C16H11N3/c17-11-14-12-19(15-9-5-2-6-10-15)18-16(14)13-7-3-1-4-8-13/h1-10,12H	FDDDVYRBXUWWGA-UHFFFAOYSA-N	N#Cc1cn(nc1c2ccccc2)c3ccccc3	BroadT	BRD-K09412958	BRD-K09412958-001-05-4	Enamine Ltd.	T0503-6269			N#Cc1cn(nc1-c1ccccc1)-c1ccccc1	InChI=1S/C16H11N3/c17-11-14-12-19(15-9-5-2-6-10-15)18-16(14)13-7-3-1-4-8-13/h1-10,12H	FDDDVYRBXUWWGA-UHFFFAOYSA-N	245.095297382							121099
ASN 08245406	LSM-15586	BRD-K55178632	651294	InChI=1S/C13H21N5O/c1-11(2)16-12(19)10-17-6-8-18(9-7-17)13-14-4-3-5-15-13/h3-5,11H,6-10H2,1-2H3,(H,16,19)	BMCZMJZSTABISE-UHFFFAOYSA-N	CC(C)NC(=O)CN1CCN(CC1)c2ncccn2	BroadT	BRD-K55178632	BRD-K55178632-034-05-9	Asinex Ltd.	ASN 08245406		OC(=O)C(=O)O	CC(C)NC(=O)CN1CCN(CC1)c1ncccn1.OC(=O)C(=O)O	InChI=1S/C13H21N5O.C2H2O4/c1-11(2)16-12(19)10-17-6-8-18(9-7-17)13-14-4-3-5-15-13;3-1(4)2(5)6/h3-5,11H,6-10H2,1-2H3,(H,16,19);(H,3,4)(H,5,6)	VKXWNYSSXXSXTL-UHFFFAOYSA-N	263.174610342							104222, 104222
AC1O9PR4	LSM-32543	BRD-K02504845	6764456	InChI=1S/C16H12N6OS/c17-15-14(16(23)22(21-15)11-4-2-1-3-5-11)20-19-10-6-7-12-13(8-10)24-9-18-12/h1-9,23H,(H2,17,21)	HIOLFPPIINPUSJ-UHFFFAOYSA-N	Nc1nn(c(O)c1N=Nc2ccc3ncsc3c2)c4ccccc4	BroadT	BRD-K02504845	BRD-K02504845-001-05-2	Enamine Ltd.	T0513-8237			Nc1nn(c(O)c1N=Nc1ccc2ncsc2c1)-c1ccccc1	InChI=1S/C16H12N6OS/c17-15-14(16(23)22(21-15)11-4-2-1-3-5-11)20-19-10-6-7-12-13(8-10)24-9-18-12/h1-9,23H,(H2,17,21)	HIOLFPPIINPUSJ-UHFFFAOYSA-N	336.079329754							
AC1MMKCK	LSM-32544	SID4245658, BRD-K11845740	3240105	InChI=1S/C14H16N2O4/c1-18-7-6-15-14(17)12-9-13(20-16-12)10-4-3-5-11(8-10)19-2/h3-5,8-9H,6-7H2,1-2H3,(H,15,17)	QEQVFGUGFGNWMA-UHFFFAOYSA-N	COCCNC(=O)c1cc(on1)c2cccc(OC)c2	BroadT	BRD-K11845740	BRD-K11845740-001-05-4	ChemDiv Inc.	C226-0829			COCCNC(=O)c1cc(on1)-c1cccc(OC)c1	InChI=1S/C14H16N2O4/c1-18-7-6-15-14(17)12-9-13(20-16-12)10-4-3-5-11(8-10)19-2/h3-5,8-9H,6-7H2,1-2H3,(H,15,17)	QEQVFGUGFGNWMA-UHFFFAOYSA-N	276.111007012							121101
SMR000044419	LSM-32545	SID862415, BRD-K43712702	663640	InChI=1S/C13H16N2O/c1-3-14-8-11-7-10-6-9(2)4-5-12(10)15-13(11)16/h4-7,14H,3,8H2,1-2H3,(H,15,16)	GVQGQJFGRGXSID-UHFFFAOYSA-N	CCNCc1cc2cc(C)ccc2nc1O	BroadT	BRD-K43712702	BRD-K43712702-001-05-4	InterBioScreen Ltd.	STOCK4S-40156			CCNCc1cc2cc(C)ccc2nc1O	InChI=1S/C13H16N2O/c1-3-14-8-11-7-10-6-9(2)4-5-12(10)15-13(11)16/h4-7,14H,3,8H2,1-2H3,(H,15,16)	GVQGQJFGRGXSID-UHFFFAOYSA-N	216.126263152							121102
MLS000591013	LSM-44414	SID17513689, BRD-A47846573	5899555	InChI=1S/C23H20ClN3O2/c1-16(25-22(28)12-11-19-8-5-13-29-19)23-26-20-9-2-3-10-21(20)27(23)15-17-6-4-7-18(24)14-17/h2-14,16H,15H2,1H3,(H,25,28)/b12-11+	CFIIGTSHGQJHCG-VAWYXSNFSA-N	CC(NC(=O)\C=C\c1occc1)c2nc3ccccc3n2Cc4cccc(Cl)c4	BroadT	BRD-A47846573	BRD-A47846573-001-06-2	InterBioScreen Ltd.	STOCK3S-04402			CC(NC(=O)\C=C\c1ccco1)c1nc2ccccc2n1Cc1cccc(Cl)c1	InChI=1S/C23H20ClN3O2/c1-16(25-22(28)12-11-19-8-5-13-29-19)23-26-20-9-2-3-10-21(20)27(23)15-17-6-4-7-18(24)14-17/h2-14,16H,15H2,1H3,(H,25,28)/b12-11+	CFIIGTSHGQJHCG-VAWYXSNFSA-N	405.12440462							
MLS-0378444.0001	LSM-32547	SID49818401, SID85176812, BRD-A57059362	24817336	InChI=1S/C21H25N5O/c1-13-8-9-16(10-14(13)2)26-19-7-5-6-18(17(19)12-22-26)23-21(27)20-11-15(3)24-25(20)4/h8-12,18H,5-7H2,1-4H3,(H,23,27)	YLYBCGXZHNGCHE-UHFFFAOYSA-N	Cc1cc(C(=O)NC2CCCc3c2cnn3c4ccc(C)c(C)c4)n(C)n1	BroadT	BRD-A57059362	BRD-A57059362-001-06-4	ChemBridge Corporation	55536813			Cc1cc(C(=O)NC2CCCc3c2cnn3-c2ccc(C)c(C)c2)n(C)n1	InChI=1S/C21H25N5O/c1-13-8-9-16(10-14(13)2)26-19-7-5-6-18(17(19)12-22-26)23-21(27)20-11-15(3)24-25(20)4/h8-12,18H,5-7H2,1-4H3,(H,23,27)	YLYBCGXZHNGCHE-UHFFFAOYSA-N	363.20591047							121104
F0816-0761	LSM-32548	SID17514254, BRD-K23000467	4188570	InChI=1S/C23H31N3O6S2/c1-31-14-12-26(13-15-32-2)34(29,30)17-10-8-16(9-11-17)22(28)25-23-20(21(24)27)18-6-4-3-5-7-19(18)33-23/h8-11H,3-7,12-15H2,1-2H3,(H2,24,27)(H,25,28)	YNDCIGVPNHQHLU-UHFFFAOYSA-N	COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)Nc2sc3CCCCCc3c2C(=O)N	BroadT	BRD-K23000467	BRD-K23000467-001-05-3	Life Chemicals Inc.	F0816-0761			COCCN(CCOC)S(=O)(=O)c1ccc(cc1)C(=O)Nc1sc2CCCCCc2c1C(N)=O	InChI=1S/C23H31N3O6S2/c1-31-14-12-26(13-15-32-2)34(29,30)17-10-8-16(9-11-17)22(28)25-23-20(21(24)27)18-6-4-3-5-7-19(18)33-23/h8-11H,3-7,12-15H2,1-2H3,(H2,24,27)(H,25,28)	YNDCIGVPNHQHLU-UHFFFAOYSA-N	509.165427122							121105
(3,4-Dimethoxy-benzyl)-methyl-(2-pyridin-2-yl-ethyl)-amine	LSM-15587	BRD-K80485043	644762	InChI=1S/C17H22N2O2/c1-19(11-9-15-6-4-5-10-18-15)13-14-7-8-16(20-2)17(12-14)21-3/h4-8,10,12H,9,11,13H2,1-3H3	JHKSCNYRZDUCHF-UHFFFAOYSA-N	COc1ccc(CN(C)CCc2ccccn2)cc1OC	BroadT	BRD-K80485043	BRD-K80485043-034-11-8	Asinex Ltd.	BAS 04057022		OC(=O)C(=O)O	COc1ccc(CN(C)CCc2ccccn2)cc1OC.OC(=O)C(=O)O	InChI=1S/C17H22N2O2.C2H2O4/c1-19(11-9-15-6-4-5-10-18-15)13-14-7-8-16(20-2)17(12-14)21-3;3-1(4)2(5)6/h4-8,10,12H,9,11,13H2,1-3H3;(H,3,4)(H,5,6)	BLQIXSKOVVTEHM-UHFFFAOYSA-N	286.168127964							104223, 104223
3-[(Diisopropylphosphoryl)methyl]benzonitrile	LSM-32549	SID3716653, BRD-K05640578	539513	InChI=1S/C14H20NOP/c1-11(2)17(16,12(3)4)10-14-7-5-6-13(8-14)9-15/h5-8,11-12H,10H2,1-4H3	XWXLGRKZBVPABR-UHFFFAOYSA-N	CC(C)P(=O)(Cc1cccc(c1)C#N)C(C)C	BroadT	BRD-K05640578	BRD-K05640578-001-05-4	Enamine Ltd.	T0504-6073			CC(C)P(=O)(Cc1cccc(c1)C#N)C(C)C	InChI=1S/C14H20NOP/c1-11(2)17(16,12(3)4)10-14-7-5-6-13(8-14)9-15/h5-8,11-12H,10H2,1-4H3	XWXLGRKZBVPABR-UHFFFAOYSA-N	249.12825078							121106
T5220362	LSM-32550	SID17516314, BRD-K58194228	2423951	InChI=1S/C21H17ClN4/c22-16-12-10-15(11-13-16)20-14-21(24-19-9-5-4-8-18(19)23)26(25-20)17-6-2-1-3-7-17/h1-14,24H,23H2	XBZBKXMBGYHROW-UHFFFAOYSA-N	Nc1ccccc1Nc2cc(nn2c3ccccc3)c4ccc(Cl)cc4	BroadT	BRD-K58194228	BRD-K58194228-001-05-2	Enamine Ltd.	T5220362			Nc1ccccc1Nc1cc(nn1-c1ccccc1)-c1ccc(Cl)cc1	InChI=1S/C21H17ClN4/c22-16-12-10-15(11-13-16)20-14-21(24-19-9-5-4-8-18(19)23)26(25-20)17-6-2-1-3-7-17/h1-14,24H,23H2	XBZBKXMBGYHROW-UHFFFAOYSA-N	360.114174294							121107
MLS000074430	LSM-32551	SID851233, BRD-K54456818	653798	InChI=1S/C16H15N3OS/c1-11-5-6-12(2)14(8-11)10-21-16-19-18-15(20-16)13-4-3-7-17-9-13/h3-9H,10H2,1-2H3	RMMCKEVEQQHBQD-UHFFFAOYSA-N	Cc1ccc(C)c(CSc2oc(nn2)c3cccnc3)c1	BroadT	BRD-K54456818	BRD-K54456818-001-06-3	Asinex Ltd.	ASN 04046394			Cc1ccc(C)c(CSc2nnc(o2)-c2cccnc2)c1	InChI=1S/C16H15N3OS/c1-11-5-6-12(2)14(8-11)10-21-16-19-18-15(20-16)13-4-3-7-17-9-13/h3-9H,10H2,1-2H3	RMMCKEVEQQHBQD-UHFFFAOYSA-N	297.09358282							121108
SMR000067860	LSM-32552	SID3712313, BRD-K72324277	2997979	InChI=1S/C19H19N3O2/c1-4-9-22-13(2)10-17(14(22)3)18(23)12-24-19-16-8-6-5-7-15(16)11-20-21-19/h4-8,10-11H,1,9,12H2,2-3H3	MMHFXBYTLLMELY-UHFFFAOYSA-N	Cc1cc(C(=O)COc2nncc3ccccc23)c(C)n1CC=C	BroadT	BRD-K72324277	BRD-K72324277-001-05-7	Enamine Ltd.	T5330958			Cc1cc(C(=O)COc2nncc3ccccc23)c(C)n1CC=C	InChI=1S/C19H19N3O2/c1-4-9-22-13(2)10-17(14(22)3)18(23)12-24-19-16-8-6-5-7-15(16)11-20-21-19/h4-8,10-11H,1,9,12H2,2-3H3	MMHFXBYTLLMELY-UHFFFAOYSA-N	321.147726878							121109
SMR000006017	LSM-32553	SID50086312, SID852090, BRD-A39201768	654694	InChI=1S/C25H26N4O6/c1-25(2,3)28-24(32)22(16-8-10-26-11-9-16)29(17-6-7-18-20(13-17)35-15-34-18)21(30)14-27-23(31)19-5-4-12-33-19/h4-13,22H,14-15H2,1-3H3,(H,27,31)(H,28,32)	YJDBMFFLQVBFGK-UHFFFAOYSA-N	CC(C)(C)NC(=O)C(N(C(=O)CNC(=O)c1occc1)c2ccc3OCOc3c2)c4ccncc4	BroadT	BRD-A39201768	BRD-A39201768-001-05-7	Asinex Ltd.	ASN 05990516			CC(C)(C)NC(=O)C(N(C(=O)CNC(=O)c1ccco1)c1ccc2OCOc2c1)c1ccncc1	InChI=1S/C25H26N4O6/c1-25(2,3)28-24(32)22(16-8-10-26-11-9-16)29(17-6-7-18-20(13-17)35-15-34-18)21(30)14-27-23(31)19-5-4-12-33-19/h4-13,22H,14-15H2,1-3H3,(H,27,31)(H,28,32)	YJDBMFFLQVBFGK-UHFFFAOYSA-N	478.185234592							121110
MLS000074773	LSM-32554	SID853098, BRD-K91739735	655750	InChI=1S/C17H13ClN6O2S/c18-12-6-2-1-4-10(12)9-24-15-13(22-23-24)16(25)21-14(20-15)17(26)19-8-11-5-3-7-27-11/h1-7H,8-9H2,(H,19,26)(H,20,21,25)	GCEXAEIQIGRZQJ-UHFFFAOYSA-N	Oc1nc(nc2c1nnn2Cc3ccccc3Cl)C(=O)NCc4cccs4	BroadT	BRD-K91739735	BRD-K91739735-001-07-5	Asinex Ltd.	ASN 07162951			Oc1nc(nc2n(Cc3ccccc3Cl)nnc12)C(=O)NCc1cccs1	InChI=1S/C17H13ClN6O2S/c18-12-6-2-1-4-10(12)9-24-15-13(22-23-24)16(25)21-14(20-15)17(26)19-8-11-5-3-7-27-11/h1-7H,8-9H2,(H,19,26)(H,20,21,25)	GCEXAEIQIGRZQJ-UHFFFAOYSA-N	400.050922116							
2-(Benzyloxy)-1-naphthaldehyde	LSM-32555	SID24818181, BRD-K37652682	735460	InChI=1S/C18H14O2/c19-12-17-16-9-5-4-8-15(16)10-11-18(17)20-13-14-6-2-1-3-7-14/h1-12H,13H2	VEMDBXGFPCYWJJ-UHFFFAOYSA-N	O=Cc1c(OCc2ccccc2)ccc3ccccc13	BroadT	BRD-K37652682	BRD-K37652682-001-05-4	Key Organics Ltd.	4H-959			O=Cc1c(OCc2ccccc2)ccc2ccccc12	InChI=1S/C18H14O2/c19-12-17-16-9-5-4-8-15(16)10-11-18(17)20-13-14-6-2-1-3-7-14/h1-12H,13H2	VEMDBXGFPCYWJJ-UHFFFAOYSA-N	262.099379688							121112
2-Methyl-n-(4-oxo-2-thioxo-1,3-thiazolidin-3-yl)benzamide	LSM-32556	SID17508247, BRD-K10039084	1202470	InChI=1S/C11H10N2O2S2/c1-7-4-2-3-5-8(7)10(15)12-13-9(14)6-17-11(13)16/h2-5H,6H2,1H3,(H,12,15)	BEJRBARECMNMAM-UHFFFAOYSA-N	Cc1ccccc1C(=O)NN2C(=O)CSC2=S	BroadT	BRD-K10039084	BRD-K10039084-001-05-9	Asinex Ltd.	BAS 01262559			Cc1ccccc1C(=O)NN1C(=O)CSC1=S	InChI=1S/C11H10N2O2S2/c1-7-4-2-3-5-8(7)10(15)12-13-9(14)6-17-11(13)16/h2-5H,6H2,1H3,(H,12,15)	BEJRBARECMNMAM-UHFFFAOYSA-N	266.01836896							121113
1-(4-Methylbenzyl)-4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine	LSM-32557	SID4255198, BRD-K59864310	895441	InChI=1S/C17H19N5/c1-13-4-6-14(7-5-13)11-22-17-15(10-20-22)16(18-12-19-17)21-8-2-3-9-21/h4-7,10,12H,2-3,8-9,11H2,1H3	FTGIBRSOVXQSRU-UHFFFAOYSA-N	Cc1ccc(Cn2ncc3c(ncnc23)N4CCCC4)cc1	BroadT	BRD-K59864310	BRD-K59864310-001-05-8	ChemBridge Corporation	7643260			Cc1ccc(Cn2ncc3c(ncnc23)N2CCCC2)cc1	InChI=1S/C17H19N5/c1-13-4-6-14(7-5-13)11-22-17-15(10-20-22)16(18-12-19-17)21-8-2-3-9-21/h4-7,10,12H,2-3,8-9,11H2,1H3	FTGIBRSOVXQSRU-UHFFFAOYSA-N	293.164045658							121114
MLS000046810	LSM-32558	SID4244000, BRD-A94249414	3238660	InChI=1S/C18H20FNO5S/c19-14-5-3-13(4-6-14)11-26(22,23)12-16-7-8-17(25-16)18(21)20-10-15-2-1-9-24-15/h3-8,15H,1-2,9-12H2,(H,20,21)	DMOZHKAXMRNTJJ-UHFFFAOYSA-N	Fc1ccc(CS(=O)(=O)Cc2oc(cc2)C(=O)NCC3CCCO3)cc1	BroadT	BRD-A94249414	BRD-A94249414-001-06-4	ChemDiv Inc.	K788-6059			Fc1ccc(CS(=O)(=O)Cc2ccc(o2)C(=O)NCC2CCCO2)cc1	InChI=1S/C18H20FNO5S/c19-14-5-3-13(4-6-14)11-26(22,23)12-16-7-8-17(25-16)18(21)20-10-15-2-1-9-24-15/h3-8,15H,1-2,9-12H2,(H,20,21)	DMOZHKAXMRNTJJ-UHFFFAOYSA-N	381.10462164							121115
ZINC00450225	LSM-32559	BRD-K13748175	6745566	InChI=1S/C15H14N2O2S/c18-14-9-5-4-6-12(14)10-16-17-15(19)11-20-13-7-2-1-3-8-13/h1-10,18H,11H2,(H,17,19)	KAZXHYKPOGAUNF-UHFFFAOYSA-N	Oc1ccccc1C=NNC(=O)CSc2ccccc2	BroadT	BRD-K13748175	BRD-K13748175-001-05-2	ChemBridge Corporation	6232415			Oc1ccccc1C=NNC(=O)CSc1ccccc1	InChI=1S/C15H14N2O2S/c18-14-9-5-4-6-12(14)10-16-17-15(19)11-20-13-7-2-1-3-8-13/h1-10,18H,11H2,(H,17,19)	KAZXHYKPOGAUNF-UHFFFAOYSA-N	286.077598398							
SMR000077178	LSM-32560	SID4260573, BRD-K44571113	971959	InChI=1S/C15H15NO4S2/c1-21-15-5-3-2-4-12(15)16-22(17,18)11-6-7-13-14(10-11)20-9-8-19-13/h2-7,10,16H,8-9H2,1H3	WUFBHTYXSVYGHC-UHFFFAOYSA-N	CSc1ccccc1NS(=O)(=O)c2ccc3OCCOc3c2	BroadT	BRD-K44571113	BRD-K44571113-001-05-6	ChemBridge Corporation	7835673			CSc1ccccc1NS(=O)(=O)c1ccc2OCCOc2c1	InChI=1S/C15H15NO4S2/c1-21-15-5-3-2-4-12(15)16-22(17,18)11-6-7-13-14(10-11)20-9-8-19-13/h2-7,10,16H,8-9H2,1H3	WUFBHTYXSVYGHC-UHFFFAOYSA-N	337.04424935							121117
Phenyl-(4-pyridin-4-yl-thiazol-2-yl)-amine	LSM-32561	SID14725964, BRD-K51239991	746609	InChI=1S/C14H11N3S/c1-2-4-12(5-3-1)16-14-17-13(10-18-14)11-6-8-15-9-7-11/h1-10H,(H,16,17)	DTAVDUKDVHWDGI-UHFFFAOYSA-N	N(c1ccccc1)c2nc(cs2)c3ccncc3	BroadT	BRD-K51239991	BRD-K51239991-001-06-5	Asinex Ltd.	BAS 00679419			N(c1nc(cs1)-c1ccncc1)c1ccccc1	InChI=1S/C14H11N3S/c1-2-4-12(5-3-1)16-14-17-13(10-18-14)11-6-8-15-9-7-11/h1-10H,(H,16,17)	DTAVDUKDVHWDGI-UHFFFAOYSA-N	253.067368072							121118
STK561837	LSM-32562	SID26658694, BRD-K49061478	930987	InChI=1S/C18H12N2O2/c21-18(22)12-6-1-7-13(10-12)19-17-14-8-2-4-11-5-3-9-15(20-17)16(11)14/h1-10H,(H,19,20)(H,21,22)	WFWFLOQMEVXRRK-UHFFFAOYSA-N	OC(=O)c1cccc(NC2=Nc3cccc4cccc2c34)c1	BroadT	BRD-K49061478	BRD-K49061478-001-06-0	InterBioScreen Ltd.	STOCK3S-93251			OC(=O)c1cccc(NC2=Nc3cccc4cccc2c34)c1	InChI=1S/C18H12N2O2/c21-18(22)12-6-1-7-13(10-12)19-17-14-8-2-4-11-5-3-9-15(20-17)16(11)14/h1-10H,(H,19,20)(H,21,22)	WFWFLOQMEVXRRK-UHFFFAOYSA-N	288.089877644							121119
SMR000080419	LSM-32563	SID4262937, BRD-K79505743	1245729	InChI=1S/C18H16N4O6S/c1-11-8-17(21-28-11)22-29(24,25)14-5-2-12(3-6-14)19-18(23)20-13-4-7-15-16(9-13)27-10-26-15/h2-9H,10H2,1H3,(H,21,22)(H2,19,20,23)	GGHKPDJHPHDKCP-UHFFFAOYSA-N	Cc1onc(NS(=O)(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2)c1	BroadT	BRD-K79505743	BRD-K79505743-001-05-0	ChemBridge Corporation	7945693			Cc1cc(NS(=O)(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2)no1	InChI=1S/C18H16N4O6S/c1-11-8-17(21-28-11)22-29(24,25)14-5-2-12(3-6-14)19-18(23)20-13-4-7-15-16(9-13)27-10-26-15/h2-9H,10H2,1H3,(H,21,22)(H2,19,20,23)	GGHKPDJHPHDKCP-UHFFFAOYSA-N	416.079054962							121120
SMR000114928	LSM-32564	SID14728245, BRD-K34039945	841657	InChI=1S/C13H13ClN4O2S/c1-18-10(7(14)5-16-18)12(20)17-13-9(11(15)19)6-3-2-4-8(6)21-13/h5H,2-4H2,1H3,(H2,15,19)(H,17,20)	WXVRUORCEWSQKT-UHFFFAOYSA-N	Cn1ncc(Cl)c1C(=O)Nc2sc3CCCc3c2C(=O)N	BroadT	BRD-K34039945	BRD-K34039945-001-05-0	Specs	AK-968/40940851			Cn1ncc(Cl)c1C(=O)Nc1sc2CCCc2c1C(N)=O	InChI=1S/C13H13ClN4O2S/c1-18-10(7(14)5-16-18)12(20)17-13-9(11(15)19)6-3-2-4-8(6)21-13/h5H,2-4H2,1H3,(H2,15,19)(H,17,20)	WXVRUORCEWSQKT-UHFFFAOYSA-N	324.044774096							121121
STK126859	LSM-32565	SID4259031, BRD-K14893141	893921	InChI=1S/C15H16N2O5S/c1-21-15(18)11-22-13-2-4-14(5-3-13)23(19,20)17-10-12-6-8-16-9-7-12/h2-9,17H,10-11H2,1H3	KWOPGQHDAHERLP-UHFFFAOYSA-N	COC(=O)COc1ccc(cc1)S(=O)(=O)NCc2ccncc2	BroadT	BRD-K14893141	BRD-K14893141-001-05-6	ChemBridge Corporation	7603567			COC(=O)COc1ccc(cc1)S(=O)(=O)NCc1ccncc1	InChI=1S/C15H16N2O5S/c1-21-15(18)11-22-13-2-4-14(5-3-13)23(19,20)17-10-12-6-8-16-9-7-12/h2-9,17H,10-11H2,1H3	KWOPGQHDAHERLP-UHFFFAOYSA-N	336.077992322							121122
OPREA1_643225	LSM-32566	SID24824024, BRD-K14436199	4390376	InChI=1S/C21H17N3O4S/c1-28-16-8-4-13(5-9-16)17-12-29-21(22-17)23-20(27)14-2-6-15(7-3-14)24-18(25)10-11-19(24)26/h2-9,12H,10-11H2,1H3,(H,22,23,27)	HWWGWTVZDVFSSY-UHFFFAOYSA-N	COc1ccc(cc1)c2csc(NC(=O)c3ccc(cc3)N4C(=O)CCC4=O)n2	BroadT	BRD-K14436199	BRD-K14436199-001-05-5	Life Chemicals Inc.	F0327-0326			COc1ccc(cc1)-c1csc(NC(=O)c2ccc(cc2)N2C(=O)CCC2=O)n1	InChI=1S/C21H17N3O4S/c1-28-16-8-4-13(5-9-16)17-12-29-21(22-17)23-20(27)14-2-6-15(7-3-14)24-18(25)10-11-19(24)26/h2-9,12H,10-11H2,1H3,(H,22,23,27)	HWWGWTVZDVFSSY-UHFFFAOYSA-N	407.093976744							121123
AMBCB35694861	LSM-32567	SID24798627, BRD-A67283245	16190298	InChI=1S/C24H24N2O/c27-24(19-6-4-14-26(15-19)16-20-7-1-2-13-25-20)22-12-11-18-10-9-17-5-3-8-21(22)23(17)18/h1-3,5,7-8,11-13,19H,4,6,9-10,14-16H2	LOHJNFDYGMTTSN-UHFFFAOYSA-N	O=C(C1CCCN(Cc2ccccn2)C1)c3ccc4CCc5cccc3c45	BroadT	BRD-A67283245	BRD-A67283245-001-05-3	ChemBridge Corporation	35694861			O=C(C1CCCN(Cc2ccccn2)C1)c1ccc2CCc3cccc1c23	InChI=1S/C24H24N2O/c27-24(19-6-4-14-26(15-19)16-20-7-1-2-13-25-20)22-12-11-18-10-9-17-5-3-8-21(22)23(17)18/h1-3,5,7-8,11-13,19H,4,6,9-10,14-16H2	LOHJNFDYGMTTSN-UHFFFAOYSA-N	356.188863408							121124
SMR000046780	LSM-32568	SID864360, BRD-A90814802	665608	InChI=1S/C18H24N6S/c1-3-22-6-8-23(9-7-22)18-21-17-15(16-19-11-20-24(16)18)13-10-12(2)4-5-14(13)25-17/h11-12H,3-10H2,1-2H3	DOXASNGRDAYCRB-UHFFFAOYSA-N	CCN1CCN(CC1)c2nc3sc4CCC(C)Cc4c3c5ncnn25	BroadT	BRD-A90814802	BRD-A90814802-001-05-1	InterBioScreen Ltd.	STOCK5S-13814			CCN1CCN(CC1)c1nc2sc3CCC(C)Cc3c2c2ncnn12	InChI=1S/C18H24N6S/c1-3-22-6-8-23(9-7-22)18-21-17-15(16-19-11-20-24(16)18)13-10-12(2)4-5-14(13)25-17/h11-12H,3-10H2,1-2H3	DOXASNGRDAYCRB-UHFFFAOYSA-N	356.178315518							121125
CBMICRO_024279	LSM-32569	BRD-K18481974	6400903	InChI=1S/C13H24N2O2/c16-13(12-14-17)8-4-3-7-11-15-9-5-1-2-6-10-15/h12,17H,1-11H2	DLDCIMJAXZRTIB-UHFFFAOYSA-N	ON=CC(=O)CCCCCN1CCCCCC1	BroadT	BRD-K18481974	BRD-K18481974-001-05-8	Asinex Ltd.	BAS 02975899			ON=CC(=O)CCCCCN1CCCCCC1	InChI=1S/C13H24N2O2/c16-13(12-14-17)8-4-3-7-11-15-9-5-1-2-6-10-15/h12,17H,1-11H2	DLDCIMJAXZRTIB-UHFFFAOYSA-N	240.183778028							121126
SMR000045889	LSM-32570	SID863706, BRD-K88728438	664958	InChI=1S/C15H14N4O2/c1-3-20-14-11(8-7-10(2)17-14)13-18-15(21-19-13)12-6-4-5-9-16-12/h4-9H,3H2,1-2H3	MIRTYCBHRCDTEA-UHFFFAOYSA-N	CCOc1nc(C)ccc1c2noc(n2)c3ccccn3	BroadT	BRD-K88728438	BRD-K88728438-001-05-7	InterBioScreen Ltd.	STOCK4S-81656			CCOc1nc(C)ccc1-c1noc(n1)-c1ccccn1	InChI=1S/C15H14N4O2/c1-3-20-14-11(8-7-10(2)17-14)13-18-15(21-19-13)12-6-4-5-9-16-12/h4-9H,3H2,1-2H3	MIRTYCBHRCDTEA-UHFFFAOYSA-N	282.111675728							121127
AC1MLCO7	LSM-32571	SID17507677, BRD-A89789455	3171508	InChI=1S/C22H26N2O3S/c1-13-9-15(25)10-18-19(13)17(14-5-7-16(26-4)8-6-14)11-22(27-18)12-21(2,3)23-20(28)24-22/h5-10,17,25H,11-12H2,1-4H3,(H2,23,24,28)	YKCPJOFNMLHJSR-UHFFFAOYSA-N	COc1ccc(cc1)C2CC3(CC(C)(C)N=C(S)N3)Oc4cc(O)cc(C)c24	BroadT	BRD-A89789455	BRD-A89789455-001-06-6	Asinex Ltd.	ASN 03276622			COc1ccc(cc1)C1CC2(CC(C)(C)N=C(S)N2)Oc2cc(O)cc(C)c12	InChI=1S/C22H26N2O3S/c1-13-9-15(25)10-18-19(13)17(14-5-7-16(26-4)8-6-14)11-22(27-18)12-21(2,3)23-20(28)24-22/h5-10,17,25H,11-12H2,1-4H3,(H2,23,24,28)	YKCPJOFNMLHJSR-UHFFFAOYSA-N	398.166413402							121128
4,5-Dimethyl-1-(tetrahydrofuran-2-ylmethyl)-1H-imidazole-2-thiol	LSM-32572	SID3714765, BRD-A90436752	2998943	InChI=1S/C10H16N2OS/c1-7-8(2)12(10(14)11-7)6-9-4-3-5-13-9/h9H,3-6H2,1-2H3,(H,11,14)	FZABHEWHHBCRSU-UHFFFAOYSA-N	Cc1nc(S)n(CC2CCCO2)c1C	BroadT	BRD-A90436752	BRD-A90436752-001-05-3	Enamine Ltd.	T5333558			Cc1nc(S)n(CC2CCCO2)c1C	InChI=1S/C10H16N2OS/c1-7-8(2)12(10(14)11-7)6-9-4-3-5-13-9/h9H,3-6H2,1-2H3,(H,11,14)	FZABHEWHHBCRSU-UHFFFAOYSA-N	212.098333842							121129
MLS000699452	LSM-32573	SID22405415, BRD-K41362826	1790587	InChI=1S/C19H21N3O5S/c1-11-7-5-6-8-13(11)18(24)20-19(28)22-21-17(23)12-9-14(25-2)16(27-4)15(10-12)26-3/h5-10H,1-4H3,(H,21,23)(H2,20,22,24,28)	YPQWJFBDNDFKGF-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)NNC(=S)NC(=O)c2ccccc2C	BroadT	BRD-K41362826	BRD-K41362826-001-06-9	Specs	AN-329/41563256			COc1cc(cc(OC)c1OC)C(=O)NNC(=S)NC(=O)c1ccccc1C	InChI=1S/C19H21N3O5S/c1-11-7-5-6-8-13(11)18(24)20-19(28)22-21-17(23)12-9-14(25-2)16(27-4)15(10-12)26-3/h5-10H,1-4H3,(H,21,23)(H2,20,22,24,28)	YPQWJFBDNDFKGF-UHFFFAOYSA-N	403.120191492							121130
MLS000083342	LSM-32574	SID866032, BRD-K14942344	667293	InChI=1S/C22H18FN3O3S/c23-17-10-8-16(9-11-17)20(27)15-30-22-25-24-21(14-29-18-5-2-1-3-6-18)26(22)13-19-7-4-12-28-19/h1-12H,13-15H2	LZGGMIYLNQXAPB-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)CSc2nnc(COc3ccccc3)n2Cc4occc4	BroadT	BRD-K14942344	BRD-K14942344-001-05-6	InterBioScreen Ltd.	STOCK5S-57923			Fc1ccc(cc1)C(=O)CSc1nnc(COc2ccccc2)n1Cc1ccco1	InChI=1S/C22H18FN3O3S/c23-17-10-8-16(9-11-17)20(27)15-30-22-25-24-21(14-29-18-5-2-1-3-6-18)26(22)13-19-7-4-12-28-19/h1-12H,13-15H2	LZGGMIYLNQXAPB-UHFFFAOYSA-N	423.105290356							121131
MLS000119298	LSM-32575	SID7967850, BRD-A84879977	5309072	InChI=1S/C23H23N3O3S/c27-23(25-15-12-17-6-1-2-7-19(17)16-25)20-10-5-14-26(20)30(28,29)21-11-3-8-18-9-4-13-24-22(18)21/h1-4,6-9,11,13,20H,5,10,12,14-16H2	ZVVNHGCZSHVFOA-UHFFFAOYSA-N	O=C(C1CCCN1S(=O)(=O)c2cccc3cccnc23)N4CCc5ccccc5C4	BroadT	BRD-A84879977	BRD-A84879977-001-04-4	ChemDiv Inc.	C737-2910			O=C(C1CCCN1S(=O)(=O)c1cccc2cccnc12)N1CCc2ccccc2C1	InChI=1S/C23H23N3O3S/c27-23(25-15-12-17-6-1-2-7-19(17)16-25)20-10-5-14-26(20)30(28,29)21-11-3-8-18-9-4-13-24-22(18)21/h1-4,6-9,11,13,20H,5,10,12,14-16H2	ZVVNHGCZSHVFOA-UHFFFAOYSA-N	421.146012316							121132
SMR000002696	LSM-32576	SID26667726, SID852283, BRD-A97078207	654898	InChI=1S/C23H27N5O5S/c1-13(2)10-11-26-22(30)19(16-9-6-12-33-16)28(14-7-4-5-8-15(14)32-3)23(31)20-17(24)18(21(25)29)27-34-20/h4-9,12-13,19H,10-11,24H2,1-3H3,(H2,25,29)(H,26,30)	JXXGCRJADXYTNC-UHFFFAOYSA-N	COc1ccccc1N(C(C(=O)NCCC(C)C)c2occc2)C(=O)c3snc(C(=O)N)c3N	BroadT	BRD-A97078207	BRD-A97078207-001-05-7	Asinex Ltd.	ASN 03873545			COc1ccccc1N(C(C(=O)NCCC(C)C)c1ccco1)C(=O)c1snc(C(N)=O)c1N	InChI=1S/C23H27N5O5S/c1-13(2)10-11-26-22(30)19(16-9-6-12-33-16)28(14-7-4-5-8-15(14)32-3)23(31)20-17(24)18(21(25)29)27-34-20/h4-9,12-13,19H,10-11,24H2,1-3H3,(H2,25,29)(H,26,30)	JXXGCRJADXYTNC-UHFFFAOYSA-N	485.173289704							121133
MLS000583946	LSM-32577	SID17509723, BRD-K24414287	6079611	InChI=1S/C23H18N4O2/c1-29-20-9-5-2-6-15(20)13-24-23(28)14-10-11-18-19(12-14)25-21-16-7-3-4-8-17(16)26-22(21)27-18/h2-12H,13H2,1H3,(H,24,28)(H,26,27)	SDNBEVPGQRBNEI-UHFFFAOYSA-N	COc1ccccc1CNC(=O)c2ccc3[nH]c4nc5ccccc5c4nc3c2	BroadT	BRD-K24414287	BRD-K24414287-001-05-3	ChemDiv Inc.	K784-2658			COc1ccccc1CNC(=O)c1ccc2[nH]c3nc4ccccc4c3nc2c1	InChI=1S/C23H18N4O2/c1-29-20-9-5-2-6-15(20)13-24-23(28)14-10-11-18-19(12-14)25-21-16-7-3-4-8-17(16)26-22(21)27-18/h2-12H,13H2,1H3,(H,24,28)(H,26,27)	SDNBEVPGQRBNEI-UHFFFAOYSA-N	382.142975856							121134
SMR000004139	LSM-32578	SID849638, BRD-K56761626	652136	InChI=1S/C24H27N3O4/c1-30-19-12-11-16-13-17(23(28)25-21(16)14-19)15-27(18-7-3-4-8-18)24(29)26-20-9-5-6-10-22(20)31-2/h5-6,9-14,18H,3-4,7-8,15H2,1-2H3,(H,25,28)(H,26,29)	BPETUENXAKWTGE-UHFFFAOYSA-N	COc1ccc2cc(CN(C3CCCC3)C(=O)Nc4ccccc4OC)c(O)nc2c1	BroadT	BRD-K56761626	BRD-K56761626-001-05-8	Asinex Ltd.	ASN 05113139			COc1ccc2cc(CN(C3CCCC3)C(=O)Nc3ccccc3OC)c(O)nc2c1	InChI=1S/C24H27N3O4/c1-30-19-12-11-16-13-17(23(28)25-21(16)14-19)15-27(18-7-3-4-8-18)24(29)26-20-9-5-6-10-22(20)31-2/h5-6,9-14,18H,3-4,7-8,15H2,1-2H3,(H,25,28)(H,26,29)	BPETUENXAKWTGE-UHFFFAOYSA-N	421.200156374							121135
STK276059	LSM-32579	SID24809394, BRD-A49460643	2981981	InChI=1S/C19H23NO4/c1-23-16-8-4-14(5-9-16)18-10-6-15(7-11-19(21)22)20(18)13-17-3-2-12-24-17/h4-6,8-10,17H,2-3,7,11-13H2,1H3,(H,21,22)	WUTHILHWWWFWPW-UHFFFAOYSA-N	COc1ccc(cc1)c2ccc(CCC(=O)O)n2CC3CCCO3	BroadT	BRD-A49460643	BRD-A49460643-001-05-8	Asinex Ltd.	BAS 09797044			COc1ccc(cc1)-c1ccc(CCC(O)=O)n1CC1CCCO1	InChI=1S/C19H23NO4/c1-23-16-8-4-14(5-9-16)18-10-6-15(7-11-19(21)22)20(18)13-17-3-2-12-24-17/h4-6,8-10,17H,2-3,7,11-13H2,1H3,(H,21,22)	WUTHILHWWWFWPW-UHFFFAOYSA-N	329.162708226							121136
1-(Naphthalene-2-sulfonyl)-4-(toluene-4-sulfonyl)-[1,4]diazepane	LSM-32580	SID14722812, BRD-K44333155	1460183	InChI=1S/C22H24N2O4S2/c1-18-7-10-21(11-8-18)29(25,26)23-13-4-14-24(16-15-23)30(27,28)22-12-9-19-5-2-3-6-20(19)17-22/h2-3,5-12,17H,4,13-16H2,1H3	MCSWAMRQUGVYPC-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)c3ccc4ccccc4c3	BroadT	BRD-K44333155	BRD-K44333155-001-05-0	Asinex Ltd.	ASN 06977974			Cc1ccc(cc1)S(=O)(=O)N1CCCN(CC1)S(=O)(=O)c1ccc2ccccc2c1	InChI=1S/C22H24N2O4S2/c1-18-7-10-21(11-8-18)29(25,26)23-13-4-14-24(16-15-23)30(27,28)22-12-9-19-5-2-3-6-20(19)17-22/h2-3,5-12,17H,4,13-16H2,1H3	MCSWAMRQUGVYPC-UHFFFAOYSA-N	444.117748648							121137
SMR000004286	LSM-32581	SID849053, BRD-K10140880	651519	InChI=1S/C25H32N4O3/c1-18-13-14-21(16-19(18)2)29(17-24(31)27-20-8-3-4-9-20)25(32)12-7-11-23(30)28-22-10-5-6-15-26-22/h5-6,10,13-16,20H,3-4,7-9,11-12,17H2,1-2H3,(H,27,31)(H,26,28,30)	DTRXTLSLMZNMDD-UHFFFAOYSA-N	Cc1ccc(cc1C)N(CC(=O)NC2CCCC2)C(=O)CCCC(=O)Nc3ccccn3	BroadT	BRD-K10140880	BRD-K10140880-001-05-1	Asinex Ltd.	ASN 05258473			Cc1ccc(cc1C)N(CC(=O)NC1CCCC1)C(=O)CCCC(=O)Nc1ccccn1	InChI=1S/C25H32N4O3/c1-18-13-14-21(16-19(18)2)29(17-24(31)27-20-8-3-4-9-20)25(32)12-7-11-23(30)28-22-10-5-6-15-26-22/h5-6,10,13-16,20H,3-4,7-9,11-12,17H2,1-2H3,(H,27,31)(H,26,28,30)	DTRXTLSLMZNMDD-UHFFFAOYSA-N	436.247440924							121138
AC1M4BHS	LSM-44415	BRD-K01944226	2254835	InChI=1S/C23H16N2O3S/c26-21-20(15-16-11-13-17(14-12-16)22(27)28)29-23(24-18-7-3-1-4-8-18)25(21)19-9-5-2-6-10-19/h1-15H,(H,27,28)/b20-15-,24-23?	SAKYBTFUWBZKRG-UBWZAKNHSA-N	OC(=O)c1ccc(\C=C\2/SC(=Nc3ccccc3)N(C2=O)c4ccccc4)cc1	BroadT	BRD-K01944226	BRD-K01944226-001-06-8	ChemDiv Inc.	2040-0146			OC(=O)c1ccc(\C=C2/SC(=Nc3ccccc3)N(C2=O)c2ccccc2)cc1	InChI=1S/C23H16N2O3S/c26-21-20(15-16-11-13-17(14-12-16)22(27)28)29-23(24-18-7-3-1-4-8-18)25(21)19-9-5-2-6-10-19/h1-15H,(H,27,28)/b20-15-,24-23?	SAKYBTFUWBZKRG-UBWZAKNHSA-N	400.088163082							
3-Methyl-2-methylidene-1,5-diphenylpentane-1,5-dione	LSM-32583	SID17514054, BRD-A83474016	3705611	InChI=1S/C19H18O2/c1-14(13-18(20)16-9-5-3-6-10-16)15(2)19(21)17-11-7-4-8-12-17/h3-12,14H,2,13H2,1H3	OOADQCRZDPSFER-UHFFFAOYSA-N	CC(CC(=O)c1ccccc1)C(=C)C(=O)c2ccccc2	BroadT	BRD-A83474016	BRD-A83474016-001-05-5	InterBioScreen Ltd.	STOCK1S-64645			CC(CC(=O)c1ccccc1)C(=C)C(=O)c1ccccc1	InChI=1S/C19H18O2/c1-14(13-18(20)16-9-5-3-6-10-16)15(2)19(21)17-11-7-4-8-12-17/h3-12,14H,2,13H2,1H3	OOADQCRZDPSFER-UHFFFAOYSA-N	278.130679816							121140
AE-406/41056992	LSM-32584	SID22413953, BRD-K72479084	54708972	InChI=1S/C21H25NO3/c1-11-7-12(2)16(13(3)8-11)18-19(24)17-14(22(6)20(18)25)9-21(4,5)10-15(17)23/h7-8,24H,9-10H2,1-6H3	FNNIBDQTBWLLEO-UHFFFAOYSA-N	CN1C(=O)C(=C(O)C2=C1CC(C)(C)CC2=O)c3c(C)cc(C)cc3C	BroadT	BRD-K72479084	BRD-K72479084-001-05-2	Specs	AE-406/41056992			Cc1cc(C)c(c(C)c1)-c1c(O)c2C(=O)CC(C)(C)Cc2n(C)c1=O	InChI=1S/C21H25NO3/c1-11-7-12(2)16(13(3)8-11)18-19(24)17-14(22(6)20(18)25)9-21(4,5)10-15(17)23/h7-8,24H,9-10H2,1-6H3	FNNIBDQTBWLLEO-UHFFFAOYSA-N	339.18344367							121141
MLS000055995	LSM-32585	SID3715367, SID56320519, BRD-K86579469	2557692	InChI=1S/C22H27N7O/c1-4-16-10-6-8-12-18(16)24-20(30)14-29(3)13-19-26-21(23)28-22(27-19)25-17-11-7-5-9-15(17)2/h5-12H,4,13-14H2,1-3H3,(H,24,30)(H3,23,25,26,27,28)	FIPNHCNUEUSLNP-UHFFFAOYSA-N	CCc1ccccc1NC(=O)CN(C)Cc2nc(N)nc(Nc3ccccc3C)n2	BroadT	BRD-K86579469	BRD-K86579469-001-05-8	Enamine Ltd.	T5341883			CCc1ccccc1NC(=O)CN(C)Cc1nc(N)nc(Nc2ccccc2C)n1	InChI=1S/C22H27N7O/c1-4-16-10-6-8-12-18(16)24-20(30)14-29(3)13-19-26-21(23)28-22(27-19)25-17-11-7-5-9-15(17)2/h5-12H,4,13-14H2,1-3H3,(H,24,30)(H3,23,25,26,27,28)	FIPNHCNUEUSLNP-UHFFFAOYSA-N	405.227708554							121142
1-(4-Fluoro-benzenesulfonyl)-4-[4-(3-methoxy-phenyl)-thiazol-2-yl]-piperazine	LSM-32586	SID26668215, SID845482, BRD-K28370340	647832	InChI=1S/C20H20FN3O3S2/c1-27-17-4-2-3-15(13-17)19-14-28-20(22-19)23-9-11-24(12-10-23)29(25,26)18-7-5-16(21)6-8-18/h2-8,13-14H,9-12H2,1H3	HDCPQQCZIGJHRM-UHFFFAOYSA-N	COc1cccc(c1)c2csc(n2)N3CCN(CC3)S(=O)(=O)c4ccc(F)cc4	BroadT	BRD-K28370340	BRD-K28370340-001-05-8	Asinex Ltd.	ASN 06589449			COc1cccc(c1)-c1csc(n1)N1CCN(CC1)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H20FN3O3S2/c1-27-17-4-2-3-15(13-17)19-14-28-20(22-19)23-9-11-24(12-10-23)29(25,26)18-7-5-16(21)6-8-18/h2-8,13-14H,9-12H2,1H3	HDCPQQCZIGJHRM-UHFFFAOYSA-N	433.09301111							121143
AK-918/37148022	LSM-32587	SID49726163, BRD-K69604135	761867	InChI=1S/C17H18N2O2S/c20-16(15-5-4-12-22-15)18-14-8-6-13(7-9-14)17(21)19-10-2-1-3-11-19/h4-9,12H,1-3,10-11H2,(H,18,20)	MCAIPVUGMRIXBJ-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)C(=O)N2CCCCC2)c3cccs3	BroadT	BRD-K69604135	BRD-K69604135-001-05-9	Asinex Ltd.	BAS 06659286			O=C(Nc1ccc(cc1)C(=O)N1CCCCC1)c1cccs1	InChI=1S/C17H18N2O2S/c20-16(15-5-4-12-22-15)18-14-8-6-13(7-9-14)17(21)19-10-2-1-3-11-19/h4-9,12H,1-3,10-11H2,(H,18,20)	MCAIPVUGMRIXBJ-UHFFFAOYSA-N	314.108898526							121144
AC1LYQEL	LSM-32588	SID17412368, BRD-K82043383	1905468	InChI=1S/C19H21N5O2S/c1-11-5-7-15(8-6-11)27(25,26)24-18(20)23-19-21-14(4)16-9-12(2)13(3)10-17(16)22-19/h5-10H,1-4H3,(H3,20,21,22,23,24)	IIBQJNXNUUYJQZ-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)N=C(N)Nc2nc(C)c3cc(C)c(C)cc3n2	BroadT	BRD-K82043383	BRD-K82043383-001-05-2	ChemBridge Corporation	5880176			Cc1ccc(cc1)S(=O)(=O)N=C(N)Nc1nc(C)c2cc(C)c(C)cc2n1	InChI=1S/C19H21N5O2S/c1-11-5-7-15(8-6-11)27(25,26)24-18(20)23-19-21-14(4)16-9-12(2)13(3)10-17(16)22-19/h5-10H,1-4H3,(H3,20,21,22,23,24)	IIBQJNXNUUYJQZ-UHFFFAOYSA-N	383.141595652							121145
MLS001209287	LSM-32589	BRD-K01601470	5409364	InChI=1S/C15H12N4OS/c20-13-8-6-11(7-9-13)10-16-19-14(17-18-15(19)21)12-4-2-1-3-5-12/h1-10,20H,(H,18,21)	CWMYVVQXCGHEAH-UHFFFAOYSA-N	Oc1ccc(C=Nn2c(S)nnc2c3ccccc3)cc1	BroadT	BRD-K01601470	BRD-K01601470-001-07-5	Asinex Ltd.	BAS 00320655			Oc1ccc(C=Nn2c(S)nnc2-c2ccccc2)cc1	InChI=1S/C15H12N4OS/c20-13-8-6-11(7-9-13)10-16-19-14(17-18-15(19)21)12-4-2-1-3-5-12/h1-10,20H,(H,18,21)	CWMYVVQXCGHEAH-UHFFFAOYSA-N	296.073181734							
MLS000040573	LSM-32590	SID863551, BRD-K77688710	664802	InChI=1S/C19H17NO4/c1-13-6-5-7-14-10-15(19(22)20-18(13)14)11-24-17(21)12-23-16-8-3-2-4-9-16/h2-10H,11-12H2,1H3,(H,20,22)	AARVRAZYIRDYCJ-UHFFFAOYSA-N	Cc1cccc2cc(COC(=O)COc3ccccc3)c(O)nc12	BroadT	BRD-K77688710	BRD-K77688710-001-05-5	InterBioScreen Ltd.	STOCK4S-76795			Cc1cccc2cc(COC(=O)COc3ccccc3)c(O)nc12	InChI=1S/C19H17NO4/c1-13-6-5-7-14-10-15(19(22)20-18(13)14)11-24-17(21)12-23-16-8-3-2-4-9-16/h2-10H,11-12H2,1H3,(H,20,22)	AARVRAZYIRDYCJ-UHFFFAOYSA-N	323.115758034							121147
MLS001235955	LSM-32591	SID51089231, BRD-K76657806	18562296	InChI=1S/C24H25N3O5/c1-3-26(4-2)22(28)15-27-14-18(17-7-5-6-8-19(17)27)23(29)24(30)25-16-9-10-20-21(13-16)32-12-11-31-20/h5-10,13-14H,3-4,11-12,15H2,1-2H3,(H,25,30)	ABBTYIZLBREAAO-UHFFFAOYSA-N	CCN(CC)C(=O)Cn1cc(C(=O)C(=O)Nc2ccc3OCCOc3c2)c4ccccc14	BroadT	BRD-K76657806	BRD-K76657806-001-06-4	Life Chemicals Inc.	F2001-0156			CCN(CC)C(=O)Cn1cc(C(=O)C(=O)Nc2ccc3OCCOc3c2)c2ccccc12	InChI=1S/C24H25N3O5/c1-3-26(4-2)22(28)15-27-14-18(17-7-5-6-8-19(17)27)23(29)24(30)25-16-9-10-20-21(13-16)32-12-11-31-20/h5-10,13-14H,3-4,11-12,15H2,1-2H3,(H,25,30)	ABBTYIZLBREAAO-UHFFFAOYSA-N	435.17942093							121148
MLS000701947	LSM-32592	SID22411602, BRD-K22520312	849397	InChI=1S/C11H8Cl2N2O2/c1-6-2-4-7(5-3-6)15-9(13)8(12)14-10(16)11(15)17/h2-5H,1H3,(H,14,16)	QHEAMMAWYIVSEH-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=C(Cl)NC(=O)C2=O)Cl	BroadT	BRD-K22520312	BRD-K22520312-001-05-8	Specs	AO-638/40907048			Cc1ccc(cc1)-n1c(Cl)c(Cl)[nH]c(=O)c1=O	InChI=1S/C11H8Cl2N2O2/c1-6-2-4-7(5-3-6)15-9(13)8(12)14-10(16)11(15)17/h2-5H,1H3,(H,14,16)	QHEAMMAWYIVSEH-UHFFFAOYSA-N	269.996282936							121149
SMR000106759	LSM-32593	SID7974851, BRD-K69409905	875199	InChI=1S/C13H10O3S/c14-11(12-7-4-8-17-12)9-16-13(15)10-5-2-1-3-6-10/h1-8H,9H2	WTRJBRYIHAPCFN-UHFFFAOYSA-N	O=C(COC(=O)c1ccccc1)c2cccs2	BroadT	BRD-K69409905	BRD-K69409905-001-05-1	ChemBridge Corporation	6165196			O=C(COC(=O)c1ccccc1)c1cccs1	InChI=1S/C13H10O3S/c14-11(12-7-4-8-17-12)9-16-13(15)10-5-2-1-3-6-10/h1-8H,9H2	WTRJBRYIHAPCFN-UHFFFAOYSA-N	246.03506487							121150
BRD-K17695628	LSM-32594			InChI=1S/C15H20N2O/c1-10-4-5-14(13(16)6-10)17-11-7-12(18)9-15(2,3)8-11/h4-6H,7-9,16H2,1-3H3	PICDEHPBNLQVKD-UHFFFAOYSA-N	Cc1ccc(N=C2CC(=O)CC(C)(C)C2)c(N)c1	BroadT	BRD-K17695628	BRD-K17695628-001-05-4	Asinex Ltd.	BAS 01095393			Cc1ccc(N=C2CC(=O)CC(C)(C)C2)c(N)c1	InChI=1S/C15H20N2O/c1-10-4-5-14(13(16)6-10)17-11-7-12(18)9-15(2,3)8-11/h4-6H,7-9,16H2,1-3H3	PICDEHPBNLQVKD-UHFFFAOYSA-N	244.15756328							121151
BRD-A99351631	LSM-32595			InChI=1S/C25H24N2O7/c1-5-33-18-10-9-15(13-19(18)32-4)22-21(23(28)16-7-6-8-17(12-16)31-3)24(29)25(30)27(22)20-11-14(2)34-26-20/h6-13,21-22H,5H2,1-4H3	HWGYYABNNKXDNQ-UHFFFAOYSA-N	CCOc1ccc(cc1OC)C2C(C(=O)c3cccc(OC)c3)C(=O)C(=O)N2c4cc(C)on4	BroadT	BRD-A99351631	BRD-A99351631-001-05-2	InterBioScreen Ltd.	STOCK3S-79285			CCOc1ccc(cc1OC)C1C(C(=O)c2cccc(OC)c2)C(=O)C(=O)N1c1cc(C)on1	InChI=1S/C25H24N2O7/c1-5-33-18-10-9-15(13-19(18)32-4)22-21(23(28)16-7-6-8-17(12-16)31-3)24(29)25(30)27(22)20-11-14(2)34-26-20/h6-13,21-22H,5H2,1-4H3	HWGYYABNNKXDNQ-UHFFFAOYSA-N	464.158351128							121152
SMR000179623	LSM-32596	SID17402241, BRD-K12729673	1479597	InChI=1S/C16H12ClNOS/c17-13-8-6-12(7-9-13)16-10-14(19-18-16)11-20-15-4-2-1-3-5-15/h1-10H,11H2	DCPRBQKGRRCVLV-UHFFFAOYSA-N	Clc1ccc(cc1)c2cc(CSc3ccccc3)on2	BroadT	BRD-K12729673	BRD-K12729673-001-05-0	Key Organics Ltd.	5M-345S			Clc1ccc(cc1)-c1cc(CSc2ccccc2)on1	InChI=1S/C16H12ClNOS/c17-13-8-6-12(7-9-13)16-10-14(19-18-16)11-20-15-4-2-1-3-5-15/h1-10H,11H2	DCPRBQKGRRCVLV-UHFFFAOYSA-N	301.032812414							121153
AC1NVD8K	LSM-44416	SID26725733, BRD-K36226466	5554549	InChI=1S/C20H16FN3O4S/c21-14-4-1-12(2-5-14)10-24-19(26)15(18(25)23-20(24)29)9-22-8-13-3-6-16-17(7-13)28-11-27-16/h1-7,9,22H,8,10-11H2,(H,23,25,29)/b15-9+	AVWBDTSGDBMBDL-OQLLNIDSSA-N	Fc1ccc(CN2C(=S)NC(=O)\C(=C/NCc3ccc4OCOc4c3)\C2=O)cc1	BroadT	BRD-K36226466	BRD-K36226466-001-05-0	InterBioScreen Ltd.	STOCK3S-99865			Fc1ccc(CN2C(=S)NC(=O)\C(=C/NCc3ccc4OCOc4c3)C2=O)cc1	InChI=1S/C20H16FN3O4S/c21-14-4-1-12(2-5-14)10-24-19(26)15(18(25)23-20(24)29)9-22-8-13-3-6-16-17(7-13)28-11-27-16/h1-7,9,22H,8,10-11H2,(H,23,25,29)/b15-9+	AVWBDTSGDBMBDL-OQLLNIDSSA-N	413.084554912							
BDBM37669	LSM-32598	BRD-A64638832	91896321	InChI=1S/C26H27FN2O5/c1-16-14-18-15-17(6-7-21(18)34-16)24(30)22-23(19-4-2-3-5-20(19)27)29(26(32)25(22)31)9-8-28-10-12-33-13-11-28/h2-7,15-16,22-23H,8-14H2,1H3	XSHLCDBIVRVQGJ-UHFFFAOYSA-N	CC1Cc2cc(ccc2O1)C(=O)C3C(N(CCN4CCOCC4)C(=O)C3=O)c5ccccc5F	BroadT	BRD-A64638832	BRD-A64638832-001-05-0	InterBioScreen Ltd.	STOCK5S-15147			CC1Cc2cc(ccc2O1)C(=O)C1C(N(CCN2CCOCC2)C(=O)C1=O)c1ccccc1F	InChI=1S/C26H27FN2O5/c1-16-14-18-15-17(6-7-21(18)34-16)24(30)22-23(19-4-2-3-5-20(19)27)29(26(32)25(22)31)9-8-28-10-12-33-13-11-28/h2-7,15-16,22-23H,8-14H2,1H3	XSHLCDBIVRVQGJ-UHFFFAOYSA-N	466.190400184							121155
F0317-0052	LSM-32599	SID22405953, BRD-K17032898	741732	InChI=1S/C15H17N3O2S/c1-20-11-8-6-10(7-9-11)16-14(19)18-15-17-12-4-2-3-5-13(12)21-15/h6-9H,2-5H2,1H3,(H2,16,17,18,19)	DZJAAIBZJJPNCS-UHFFFAOYSA-N	COc1ccc(NC(=O)Nc2nc3CCCCc3s2)cc1	BroadT	BRD-K17032898	BRD-K17032898-001-06-1	Enamine Ltd.	T0513-3221			COc1ccc(NC(=O)Nc2nc3CCCCc3s2)cc1	InChI=1S/C15H17N3O2S/c1-20-11-8-6-10(7-9-11)16-14(19)18-15-17-12-4-2-3-5-13(12)21-15/h6-9H,2-5H2,1H3,(H2,16,17,18,19)	DZJAAIBZJJPNCS-UHFFFAOYSA-N	303.104147504							121156
MLS001229512	LSM-32600	SID49728291, BRD-K89389568	1092904	InChI=1S/C22H18N2O4/c1-14-11-17(8-9-18(14)24-21(25)15-5-3-2-4-6-15)23-22(26)16-7-10-19-20(12-16)28-13-27-19/h2-12H,13H2,1H3,(H,23,26)(H,24,25)	XULWUJNRHNYSSD-UHFFFAOYSA-N	Cc1cc(NC(=O)c2ccc3OCOc3c2)ccc1NC(=O)c4ccccc4	BroadT	BRD-K89389568	BRD-K89389568-001-05-9	Asinex Ltd.	BAS 08878032			Cc1cc(NC(=O)c2ccc3OCOc3c2)ccc1NC(=O)c1ccccc1	InChI=1S/C22H18N2O4/c1-14-11-17(8-9-18(14)24-21(25)15-5-3-2-4-6-15)23-22(26)16-7-10-19-20(12-16)28-13-27-19/h2-12H,13H2,1H3,(H,23,26)(H,24,25)	XULWUJNRHNYSSD-UHFFFAOYSA-N	374.126657076							121157
HMS2596N17	LSM-32601	BRD-K84169123	12005107	InChI=1S/C20H17Cl2N5O2/c1-13-16(19(22)27(26-13)14-7-3-2-4-8-14)11-24-25-18(28)12-23-20(29)15-9-5-6-10-17(15)21/h2-11H,12H2,1H3,(H,23,29)(H,25,28)	PTQJPIFHXHLRLI-UHFFFAOYSA-N	Cc1nn(c(Cl)c1C=NNC(=O)CNC(=O)c2ccccc2Cl)c3ccccc3	BroadT	BRD-K84169123	BRD-K84169123-001-05-8	ChemDiv Inc.	1548-0678			Cc1nn(c(Cl)c1C=NNC(=O)CNC(=O)c1ccccc1Cl)-c1ccccc1	InChI=1S/C20H17Cl2N5O2/c1-13-16(19(22)27(26-13)14-7-3-2-4-8-14)11-24-25-18(28)12-23-20(29)15-9-5-6-10-17(15)21/h2-11H,12H2,1H3,(H,23,29)(H,25,28)	PTQJPIFHXHLRLI-UHFFFAOYSA-N	429.075930254							121158
MLS000087030	LSM-32602	SID4243571, BRD-K28207794	3238274	InChI=1S/C14H15BrN2O2/c1-3-17(4-2)14(18)12-9-13(19-16-12)10-5-7-11(15)8-6-10/h5-9H,3-4H2,1-2H3	RGPBBNVHNWQLRB-UHFFFAOYSA-N	CCN(CC)C(=O)c1cc(on1)c2ccc(Br)cc2	BroadT	BRD-K28207794	BRD-K28207794-001-06-1	ChemDiv Inc.	C226-0502			CCN(CC)C(=O)c1cc(on1)-c1ccc(Br)cc1	InChI=1S/C14H15BrN2O2/c1-3-17(4-2)14(18)12-9-13(19-16-12)10-5-7-11(15)8-6-10/h5-9H,3-4H2,1-2H3	RGPBBNVHNWQLRB-UHFFFAOYSA-N	322.03169034							121159
MLS000053140	LSM-32603	SID4259531, BRD-K65921553	794276	InChI=1S/C11H11N3O2S/c1-16-11(15)12-10-14-13-9(17-10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,12,14,15)	ZQVIBMPIELPRTQ-UHFFFAOYSA-N	COC(=O)Nc1nnc(Cc2ccccc2)s1	BroadT	BRD-K65921553	BRD-K65921553-001-06-2	ChemBridge Corporation	5313463			COC(=O)Nc1nnc(Cc2ccccc2)s1	InChI=1S/C11H11N3O2S/c1-16-11(15)12-10-14-13-9(17-10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,12,14,15)	ZQVIBMPIELPRTQ-UHFFFAOYSA-N	249.057197312							121160
SMR000236806	LSM-32604	SID17515423, BRD-K41722698	12006034	InChI=1S/C25H19NO5S/c1-16-7-9-17(10-8-16)24(27)20-15-26-21-14-23-22(30-11-12-31-23)13-19(21)25(20)32(28,29)18-5-3-2-4-6-18/h2-10,13-15H,11-12H2,1H3	OJBZUEUAQQWDJV-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)c2cnc3cc4OCCOc4cc3c2S(=O)(=O)c5ccccc5	BroadT	BRD-K41722698	BRD-K41722698-001-07-7	Life Chemicals Inc.	F1605-1056			Cc1ccc(cc1)C(=O)c1cnc2cc3OCCOc3cc2c1S(=O)(=O)c1ccccc1	InChI=1S/C25H19NO5S/c1-16-7-9-17(10-8-16)24(27)20-15-26-21-14-23-22(30-11-12-31-23)13-19(21)25(20)32(28,29)18-5-3-2-4-6-18/h2-10,13-15H,11-12H2,1H3	OJBZUEUAQQWDJV-UHFFFAOYSA-N	445.098393408							121161
AC1LDYGA	LSM-32605	BRD-K04156909	727355	InChI=1S/C18H20ClN3O/c1-23-18-8-3-2-7-17(18)21-9-11-22(12-10-21)20-14-15-5-4-6-16(19)13-15/h2-8,13-14H,9-12H2,1H3	CXXRTSRZMBHJJR-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)N=Cc3cccc(Cl)c3	BroadT	BRD-K04156909	BRD-K04156909-001-06-0	Asinex Ltd.	BAS 01177579			COc1ccccc1N1CCN(CC1)N=Cc1cccc(Cl)c1	InChI=1S/C18H20ClN3O/c1-23-18-8-3-2-7-17(18)21-9-11-22(12-10-21)20-14-15-5-4-6-16(19)13-15/h2-8,13-14H,9-12H2,1H3	CXXRTSRZMBHJJR-UHFFFAOYSA-N	329.12949							121162
AG-670/40728043	LSM-32606	SID17433945, BRD-K33111738	823805	InChI=1S/C11H14ClN3OS/c1-7(2)5-10(16)15-11(17)14-9-4-3-8(12)6-13-9/h3-4,6-7H,5H2,1-2H3,(H2,13,14,15,16,17)	GCQOYVWMKMFUKV-UHFFFAOYSA-N	CC(C)CC(=O)NC(=S)Nc1ccc(Cl)cn1	BroadT	BRD-K33111738	BRD-K33111738-001-05-9	ChemBridge Corporation	6583803			CC(C)CC(=O)NC(=S)Nc1ccc(Cl)cn1	InChI=1S/C11H14ClN3OS/c1-7(2)5-10(16)15-11(17)14-9-4-3-8(12)6-13-9/h3-4,6-7H,5H2,1-2H3,(H2,13,14,15,16,17)	GCQOYVWMKMFUKV-UHFFFAOYSA-N	271.054610498							121163
MLS000553271	LSM-44417	SID17408777, BRD-A64301509	5762712	InChI=1S/C17H19N3O6/c1-24-15-7-11(14(20(22)23)8-16(15)25-2)6-12(9-18)17(21)19-10-13-4-3-5-26-13/h6-8,13H,3-5,10H2,1-2H3,(H,19,21)/b12-6+	HUSSABQFGBWBBS-WUXMJOGZSA-N	COc1cc(\C=C(/C#N)\C(=O)NCC2CCCO2)c(cc1OC)[N+](=O)[O-]	BroadT	BRD-A64301509	BRD-A64301509-001-05-7	Asinex Ltd.	BAS 01255659			COc1cc(\C=C(/C#N)C(=O)NCC2CCCO2)c(cc1OC)[N+]([O-])=O	InChI=1S/C17H19N3O6/c1-24-15-7-11(14(20(22)23)8-16(15)25-2)6-12(9-18)17(21)19-10-13-4-3-5-26-13/h6-8,13H,3-5,10H2,1-2H3,(H,19,21)/b12-6+	HUSSABQFGBWBBS-WUXMJOGZSA-N	361.127385358							
T5472158	LSM-32608	SID14735251, BRD-K88639937	4456434	InChI=1S/C14H13N3O3S2/c1-2-20-12-8-4-3-6-10(12)17-22(18,19)13-9-5-7-11-14(13)16-21-15-11/h3-9,17H,2H2,1H3	KTEMBUIRDOQSMA-UHFFFAOYSA-N	CCOc1ccccc1NS(=O)(=O)c2cccc3nsnc23	BroadT	BRD-K88639937	BRD-K88639937-001-05-2	ChemDiv Inc.	K893-0912			CCOc1ccccc1NS(=O)(=O)c1cccc2nsnc12	InChI=1S/C14H13N3O3S2/c1-2-20-12-8-4-3-6-10(12)17-22(18,19)13-9-5-7-11-14(13)16-21-15-11/h3-9,17H,2H2,1H3	KTEMBUIRDOQSMA-UHFFFAOYSA-N	335.039832686							121165
AJ-030/12105940	LSM-44418	SID22400437, BRD-K50629624	5583842	InChI=1S/C19H20N4O6S/c1-12(2)23-18(25)16(10-21-13-5-7-15(8-6-13)30(20,27)28)17(24)22(19(23)26)11-14-4-3-9-29-14/h3-10,12,21H,11H2,1-2H3,(H2,20,27,28)/b16-10+	KREWFCQOVMXSDO-MHWRWJLKSA-N	CC(C)N1C(=O)N(Cc2occc2)C(=O)\C(=C/Nc3ccc(cc3)S(=O)(=O)N)\C1=O	BroadT	BRD-K50629624	BRD-K50629624-001-05-5	Specs	AJ-030/12105940			CC(C)N1C(=O)N(Cc2ccco2)C(=O)\C(=C/Nc2ccc(cc2)S(N)(=O)=O)C1=O	InChI=1S/C19H20N4O6S/c1-12(2)23-18(25)16(10-21-13-5-7-15(8-6-13)30(20,27)28)17(24)22(19(23)26)11-14-4-3-9-29-14/h3-10,12,21H,11H2,1-2H3,(H2,20,27,28)/b16-10+	KREWFCQOVMXSDO-MHWRWJLKSA-N	432.11035509							
ASN 05111379	LSM-32610	SID26668736, SID845101, BRD-A50925097	647438	InChI=1S/C27H34N4O3/c1-5-30-14-8-9-22(30)17-31(27(33)28-23-10-6-7-11-24(23)34-4)16-21-15-20-13-12-18(2)19(3)25(20)29-26(21)32/h6-7,10-13,15,22H,5,8-9,14,16-17H2,1-4H3,(H,28,33)(H,29,32)	ZMHVUYNUULKBQA-UHFFFAOYSA-N	CCN1CCCC1CN(Cc2cc3ccc(C)c(C)c3nc2O)C(=O)Nc4ccccc4OC	BroadT	BRD-A50925097	BRD-A50925097-001-05-7	Asinex Ltd.	ASN 05111379			CCN1CCCC1CN(Cc1cc2ccc(C)c(C)c2nc1O)C(=O)Nc1ccccc1OC	InChI=1S/C27H34N4O3/c1-5-30-14-8-9-22(30)17-31(27(33)28-23-10-6-7-11-24(23)34-4)16-21-15-20-13-12-18(2)19(3)25(20)29-26(21)32/h6-7,10-13,15,22H,5,8-9,14,16-17H2,1-4H3,(H,28,33)(H,29,32)	ZMHVUYNUULKBQA-UHFFFAOYSA-N	462.263090988							121167
ST50111160	LSM-32611	SID17406638, BRD-A24742577	3542312	InChI=1S/C24H25FN2O2S/c1-2-20-16-21(24(30-20)26-23(28)18-6-4-3-5-7-18)22(27-12-14-29-15-13-27)17-8-10-19(25)11-9-17/h3-11,16,22H,2,12-15H2,1H3,(H,26,28)	NMJLQMBUDFXZOL-UHFFFAOYSA-N	CCc1cc(C(N2CCOCC2)c3ccc(F)cc3)c(NC(=O)c4ccccc4)s1	BroadT	BRD-A24742577	BRD-A24742577-001-05-8	Specs	AP-906/42853904			CCc1cc(C(N2CCOCC2)c2ccc(F)cc2)c(NC(=O)c2ccccc2)s1	InChI=1S/C24H25FN2O2S/c1-2-20-16-21(24(30-20)26-23(28)18-6-4-3-5-7-18)22(27-12-14-29-15-13-27)17-8-10-19(25)11-9-17/h3-11,16,22H,2,12-15H2,1H3,(H,26,28)	NMJLQMBUDFXZOL-UHFFFAOYSA-N	424.16207695							121168
MLS000038870	LSM-15457	BRD-A12726871	657621	InChI=1S/C16H24N2O2/c1-11-8-17-13-6-5-7-14(15(11)13)20-10-12(19)9-18-16(2,3)4/h5-8,12,17-19H,9-10H2,1-4H3	XAIVBZMKIMCTMO-UHFFFAOYSA-N	Cc1c[nH]c2cccc(OCC(O)CNC(C)(C)C)c12	BroadT	BRD-A12726871	BRD-A12726871-003-05-4	InterBioScreen Ltd.	STOCK1S-09484		Cl	Cc1c[nH]c2cccc(OCC(O)CNC(C)(C)C)c12.Cl	InChI=1S/C16H24N2O2.ClH/c1-11-8-17-13-6-5-7-14(15(11)13)20-10-12(19)9-18-16(2,3)4;/h5-8,12,17-19H,9-10H2,1-4H3;1H	RYWYJFFZUWUUIY-UHFFFAOYSA-N	276.183778028							104099, 104099
BAS 05991086	LSM-32612	SID17388273, BRD-K88664490	1081809	InChI=1S/C22H20N6O3S/c1-2-31-16-11-9-15(10-12-16)23-20(29)14-28-26-21(25-27-28)17-6-3-4-7-18(17)24-22(30)19-8-5-13-32-19/h3-13H,2,14H2,1H3,(H,23,29)(H,24,30)	PYMLELABQHUYOZ-UHFFFAOYSA-N	CCOc1ccc(NC(=O)Cn2nnc(n2)c3ccccc3NC(=O)c4cccs4)cc1	BroadT	BRD-K88664490	BRD-K88664490-001-06-7	Asinex Ltd.	BAS 05991086			CCOc1ccc(NC(=O)Cn2nnc(n2)-c2ccccc2NC(=O)c2cccs2)cc1	InChI=1S/C22H20N6O3S/c1-2-31-16-11-9-15(10-12-16)23-20(29)14-28-26-21(25-27-28)17-6-3-4-7-18(17)24-22(30)19-8-5-13-32-19/h3-13H,2,14H2,1H3,(H,23,29)(H,24,30)	PYMLELABQHUYOZ-UHFFFAOYSA-N	448.13175925							121169
TCMDC-124353	LSM-32613	TCMDC-124353, BRD-K76437462	1293420	InChI=1S/C20H29ClN2O4S/c1-14-11-17(21)19(28(25,26)23-16-9-5-6-10-16)12-18(14)27-13-20(24)22-15-7-3-2-4-8-15/h11-12,15-16,23H,2-10,13H2,1H3,(H,22,24)	CUVVFMKRBFEJHR-UHFFFAOYSA-N	Cc1cc(Cl)c(cc1OCC(=O)NC2CCCCC2)S(=O)(=O)NC3CCCC3	BroadT	BRD-K76437462	BRD-K76437462-001-05-8	ChemBridge Corporation	7778183			Cc1cc(Cl)c(cc1OCC(=O)NC1CCCCC1)S(=O)(=O)NC1CCCC1	InChI=1S/C20H29ClN2O4S/c1-14-11-17(21)19(28(25,26)23-16-9-5-6-10-16)12-18(14)27-13-20(24)22-15-7-3-2-4-8-15/h11-12,15-16,23H,2-10,13H2,1H3,(H,22,24)	CUVVFMKRBFEJHR-UHFFFAOYSA-N	428.153655828							121170
AC1LZUGL	LSM-32614	BRD-K25533912	1958963	InChI=1S/C23H20N6O3/c1-31-11-10-28-14-24-21-19(23(28)30)20-22(27-18-9-4-3-8-17(18)26-20)29(21)25-13-15-6-5-7-16(12-15)32-2/h3-9,12-14H,10-11H2,1-2H3	YMAKJOSGQZUPOZ-UHFFFAOYSA-N	COCCN1C=Nc2c(C1=O)c3nc4ccccc4nc3n2N=Cc5cccc(OC)c5	BroadT	BRD-K25533912	BRD-K25533912-001-05-2	InterBioScreen Ltd.	STOCK4S-65710			COCCn1cnc2n(N=Cc3cccc(OC)c3)c3nc4ccccc4nc3c2c1=O	InChI=1S/C23H20N6O3/c1-31-11-10-28-14-24-21-19(23(28)30)20-22(27-18-9-4-3-8-17(18)26-20)29(21)25-13-15-6-5-7-16(12-15)32-2/h3-9,12-14H,10-11H2,1-2H3	YMAKJOSGQZUPOZ-UHFFFAOYSA-N	428.15968856							121171
(3-Fluoro-4-morpholin-4-yl-phenyl)-p-tolyl-methanone	LSM-32615	SID14725216, BRD-K84920420	777541	InChI=1S/C18H18FNO2/c1-13-2-4-14(5-3-13)18(21)15-6-7-17(16(19)12-15)20-8-10-22-11-9-20/h2-7,12H,8-11H2,1H3	WQWFBQFTNKVUJJ-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)c2ccc(N3CCOCC3)c(F)c2	BroadT	BRD-K84920420	BRD-K84920420-001-05-4	Asinex Ltd.	BAS 03153999			Cc1ccc(cc1)C(=O)c1ccc(N2CCOCC2)c(F)c1	InChI=1S/C18H18FNO2/c1-13-2-4-14(5-3-13)18(21)15-6-7-17(16(19)12-15)20-8-10-22-11-9-20/h2-7,12H,8-11H2,1H3	WQWFBQFTNKVUJJ-UHFFFAOYSA-N	299.132157026							121172
AC1MPPCJ	LSM-32616	BRD-K02530627	3439020	InChI=1S/C20H20N4O3/c1-15(16-3-5-17(6-4-16)24-12-11-21-14-24)22-23-20(25)13-27-19-9-7-18(26-2)8-10-19/h3-12,14H,13H2,1-2H3,(H,23,25)	ZPNIUPQYJKSRBU-UHFFFAOYSA-N	COc1ccc(OCC(=O)NN=C(C)c2ccc(cc2)n3ccnc3)cc1	BroadT	BRD-K02530627	BRD-K02530627-001-05-1	Enamine Ltd.	T0510-8367			COc1ccc(OCC(=O)NN=C(C)c2ccc(cc2)-n2ccnc2)cc1	InChI=1S/C20H20N4O3/c1-15(16-3-5-17(6-4-16)24-12-11-21-14-24)22-23-20(25)13-27-19-9-7-18(26-2)8-10-19/h3-12,14H,13H2,1-2H3,(H,23,25)	ZPNIUPQYJKSRBU-UHFFFAOYSA-N	364.15354054							121173
N'-[(1-benzyl-4-piperidinyl)carbonyl]-2,4,6-trimethylbenzenesulfonohydrazide	LSM-32617	SID17410167, BRD-K94631973	1481471	InChI=1S/C22H29N3O3S/c1-16-13-17(2)21(18(3)14-16)29(27,28)24-23-22(26)20-9-11-25(12-10-20)15-19-7-5-4-6-8-19/h4-8,13-14,20,24H,9-12,15H2,1-3H3,(H,23,26)	SUOMPPQLAHWIBL-UHFFFAOYSA-N	Cc1cc(C)c(c(C)c1)S(=O)(=O)NNC(=O)C2CCN(Cc3ccccc3)CC2	BroadT	BRD-K94631973	BRD-K94631973-001-05-6	Key Organics Ltd.	6R-0276			Cc1cc(C)c(c(C)c1)S(=O)(=O)NNC(=O)C1CCN(Cc2ccccc2)CC1	InChI=1S/C22H29N3O3S/c1-16-13-17(2)21(18(3)14-16)29(27,28)24-23-22(26)20-9-11-25(12-10-20)15-19-7-5-4-6-8-19/h4-8,13-14,20,24H,9-12,15H2,1-3H3,(H,23,26)	SUOMPPQLAHWIBL-UHFFFAOYSA-N	415.192962508							121174
SMR000035789	LSM-32618	SID864064, BRD-A18004690	5389931	InChI=1S/C22H16N4O/c1-25-18-12-6-3-9-15(18)22(21(25)27)24-16-10-4-2-8-14(16)20-23-17-11-5-7-13-19(17)26(20)22/h2-13,24H,1H3	SFSPAIAVOJLFOM-UHFFFAOYSA-N	CN1C(=O)C2(Nc3ccccc3c4nc5ccccc5n24)c6ccccc16	BroadT	BRD-A18004690	BRD-A18004690-001-05-3	InterBioScreen Ltd.	STOCK5S-01092			CN1c2ccccc2C2(Nc3ccccc3-c3nc4ccccc4n23)C1=O	InChI=1S/C22H16N4O/c1-25-18-12-6-3-9-15(18)22(21(25)27)24-16-10-4-2-8-14(16)20-23-17-11-5-7-13-19(17)26(20)22/h2-13,24H,1H3	SFSPAIAVOJLFOM-UHFFFAOYSA-N	352.132411172							
ST4027043	LSM-32619	SID17431814, BRD-A06983666	2849057	InChI=1S/C13H16O5/c1-4-7-17-13-8-5-6-9(15-2)11(16-3)10(8)12(14)18-13/h5-6,13H,4,7H2,1-3H3	DYBVVSHEQOSTBT-UHFFFAOYSA-N	CCCOC1OC(=O)c2c(OC)c(OC)ccc12	BroadT	BRD-A06983666	BRD-A06983666-001-05-2	ChemBridge Corporation	5488530			CCCOC1OC(=O)c2c1ccc(OC)c2OC	InChI=1S/C13H16O5/c1-4-7-17-13-8-5-6-9(15-2)11(16-3)10(8)12(14)18-13/h5-6,13H,4,7H2,1-3H3	DYBVVSHEQOSTBT-UHFFFAOYSA-N	252.099773612							121176
Ethyl 3-oxo-2-[(5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]butanoate	LSM-32620	SID26730165, BRD-A46917531	2815914	InChI=1S/C17H16N4O3S/c1-3-24-16(23)15(11(2)22)25-14-9-13(12-7-5-4-6-8-12)20-17-18-10-19-21(14)17/h4-10,15H,3H2,1-2H3	UIRBBRWNVXRMTA-UHFFFAOYSA-N	CCOC(=O)C(Sc1cc(nc2ncnn12)c3ccccc3)C(=O)C	BroadT	BRD-A46917531	BRD-A46917531-001-05-5	Maybridge	HTS 11494			CCOC(=O)C(Sc1cc(nc2ncnn12)-c1ccccc1)C(C)=O	InChI=1S/C17H16N4O3S/c1-3-24-16(23)15(11(2)22)25-14-9-13(12-7-5-4-6-8-12)20-17-18-10-19-21(14)17/h4-10,15H,3H2,1-2H3	UIRBBRWNVXRMTA-UHFFFAOYSA-N	356.094311102							121177
SMR000204251	LSM-32621	SID17509979, BRD-A28599787	4996772	InChI=1S/C18H19N3O4/c1-3-25-18(23)20-21-16(12-8-10-13(24-2)11-9-12)19-15-7-5-4-6-14(15)17(21)22/h4-11,16,19H,3H2,1-2H3,(H,20,23)	IMLYNVSNUPARMP-UHFFFAOYSA-N	CCOC(=O)NN1C(Nc2ccccc2C1=O)c3ccc(OC)cc3	BroadT	BRD-A28599787	BRD-A28599787-001-06-2	ChemDiv Inc.	6267-0007			CCOC(=O)NN1C(Nc2ccccc2C1=O)c1ccc(OC)cc1	InChI=1S/C18H19N3O4/c1-3-25-18(23)20-21-16(12-8-10-13(24-2)11-9-12)19-15-7-5-4-6-14(15)17(21)22/h4-11,16,19H,3H2,1-2H3,(H,20,23)	IMLYNVSNUPARMP-UHFFFAOYSA-N	341.137556118							121178
MLS001224379	LSM-32622	BRD-K75354506	24818506	InChI=1S/C18H13ClN2O5/c1-25-16-6-10(2-4-14(16)22)18(24)21-20-8-11-9-26-15-5-3-12(19)7-13(15)17(11)23/h2-9,22H,1H3,(H,21,24)	JBJQLFAMDJRZTD-UHFFFAOYSA-N	COc1cc(ccc1O)C(=O)NN=CC2=COc3ccc(Cl)cc3C2=O	BroadT	BRD-K75354506	BRD-K75354506-001-06-2	Chemical Technologies & Investigations	DBZA-069840			COc1cc(ccc1O)C(=O)NN=Cc1coc2ccc(Cl)cc2c1=O	InChI=1S/C18H13ClN2O5/c1-25-16-6-10(2-4-14(16)22)18(24)21-20-8-11-9-26-15-5-3-12(19)7-13(15)17(11)23/h2-9,22H,1H3,(H,21,24)	JBJQLFAMDJRZTD-UHFFFAOYSA-N	372.051299246							121179
MLS000560301	LSM-32623	SID17403145, BRD-K12686946	829454	InChI=1S/C20H15N3O2/c1-25-16-10-8-14(9-11-16)19-22-18-7-3-2-6-17(18)20(24)23(19)15-5-4-12-21-13-15/h2-13H,1H3	YODCFPOOWUOURW-UHFFFAOYSA-N	COc1ccc(cc1)C2=Nc3ccccc3C(=O)N2c4cccnc4	BroadT	BRD-K12686946	BRD-K12686946-001-06-1	Asinex Ltd.	BAS 01816884			COc1ccc(cc1)-c1nc2ccccc2c(=O)n1-c1cccnc1	InChI=1S/C20H15N3O2/c1-25-16-10-8-14(9-11-16)19-22-18-7-3-2-6-17(18)20(24)23(19)15-5-4-12-21-13-15/h2-13H,1H3	YODCFPOOWUOURW-UHFFFAOYSA-N	329.11642675							121180
SMR000184514	LSM-32624	SID17413283, BRD-A11055580	2829909	InChI=1S/C17H13Cl3N4O5S/c18-17(19,20)15(22-13(25)10-6-2-4-8-12(10)24(28)29)23-16(30)21-11-7-3-1-5-9(11)14(26)27/h1-8,15H,(H,22,25)(H,26,27)(H2,21,23,30)	LHCKTMKYCCLGFF-UHFFFAOYSA-N	OC(=O)c1ccccc1N=C(S)NC(NC(=O)c2ccccc2[N+](=O)[O-])C(Cl)(Cl)Cl	BroadT	BRD-A11055580	BRD-A11055580-001-05-5	ChemBridge Corporation	5143008			OC(=O)c1ccccc1N=C(S)NC(NC(=O)c1ccccc1[N+]([O-])=O)C(Cl)(Cl)Cl	InChI=1S/C17H13Cl3N4O5S/c18-17(19,20)15(22-13(25)10-6-2-4-8-12(10)24(28)29)23-16(30)21-11-7-3-1-5-9(11)14(26)27/h1-8,15H,(H,22,25)(H,26,27)(H2,21,23,30)	LHCKTMKYCCLGFF-UHFFFAOYSA-N	489.967223376							121181
AC1MDQAG	LSM-32625	BRD-K84138809	2815145	InChI=1S/C12H13N5S/c1-9-10(7-14-15-12(13)18)8-17(16-9)11-5-3-2-4-6-11/h2-8H,1H3,(H3,13,15,18)	IOQKMWJDBWFNJL-UHFFFAOYSA-N	Cc1nn(cc1C=NN=C(N)S)c2ccccc2	BroadT	BRD-K84138809	BRD-K84138809-001-04-7	Maybridge	HTS 09987			Cc1nn(cc1C=NN=C(N)S)-c1ccccc1	InChI=1S/C12H13N5S/c1-9-10(7-14-15-12(13)18)8-17(16-9)11-5-3-2-4-6-11/h2-8H,1H3,(H3,13,15,18)	IOQKMWJDBWFNJL-UHFFFAOYSA-N	259.089166156							121182
ST50676259	LSM-32626	SID24269033, SID49735799, BRD-K61101109	3598619	InChI=1S/C17H15N3O4/c1-22-14-6-5-11(8-16(14)23-2)15-9-13(20-24-15)17(21)19-12-4-3-7-18-10-12/h3-10H,1-2H3,(H,19,21)	UAIKQYGGEYNLIZ-UHFFFAOYSA-N	COc1ccc(cc1OC)c2onc(c2)C(=O)Nc3cccnc3	BroadT	BRD-K61101109	BRD-K61101109-001-05-6	ChemDiv Inc.	C226-1110			COc1ccc(cc1OC)-c1cc(no1)C(=O)Nc1cccnc1	InChI=1S/C17H15N3O4/c1-22-14-6-5-11(8-16(14)23-2)15-9-13(20-24-15)17(21)19-12-4-3-7-18-10-12/h3-10H,1-2H3,(H,19,21)	UAIKQYGGEYNLIZ-UHFFFAOYSA-N	325.10625599							121183
SMR000184559	LSM-32627	SID17413548, BRD-A60400887	2830596	InChI=1S/C18H16Cl3N3O4S/c19-18(20,21)16(23-14(25)10-28-11-6-2-1-3-7-11)24-17(29)22-13-9-5-4-8-12(13)15(26)27/h1-9,16H,10H2,(H,23,25)(H,26,27)(H2,22,24,29)	BNVBSMSTBHBPOG-UHFFFAOYSA-N	OC(=O)c1ccccc1N=C(S)NC(NC(=O)COc2ccccc2)C(Cl)(Cl)Cl	BroadT	BRD-A60400887	BRD-A60400887-001-05-3	ChemBridge Corporation	5148528			OC(=O)c1ccccc1N=C(S)NC(NC(=O)COc1ccccc1)C(Cl)(Cl)Cl	InChI=1S/C18H16Cl3N3O4S/c19-18(20,21)16(23-14(25)10-28-11-6-2-1-3-7-11)24-17(29)22-13-9-5-4-8-12(13)15(26)27/h1-9,16H,10H2,(H,23,25)(H,26,27)(H2,22,24,29)	BNVBSMSTBHBPOG-UHFFFAOYSA-N	474.992709842							121184
STK117633	LSM-32628	SID14746271, BRD-K07693714	2196287	InChI=1S/C19H17N5O2S2/c1-24-17(12-7-9-13(26-2)10-8-12)22-23-19(24)27-11-16(25)21-18-20-14-5-3-4-6-15(14)28-18/h3-10H,11H2,1-2H3,(H,20,21,25)	PYSKJATUHYOBIU-UHFFFAOYSA-N	COc1ccc(cc1)c2nnc(SCC(=O)Nc3nc4ccccc4s3)n2C	BroadT	BRD-K07693714	BRD-K07693714-001-04-9	ChemBridge Corporation	7650929			COc1ccc(cc1)-c1nnc(SCC(=O)Nc2nc3ccccc3s2)n1C	InChI=1S/C19H17N5O2S2/c1-24-17(12-7-9-13(26-2)10-8-12)22-23-19(24)27-11-16(25)21-18-20-14-5-3-4-6-15(14)28-18/h3-10H,11H2,1-2H3,(H,20,21,25)	PYSKJATUHYOBIU-UHFFFAOYSA-N	411.082366214							121185
4-(3,4-Dihydro-2(1H)-isoquinolinylmethyl)-n-(2,6-dimethylphenyl)benzamide	LSM-32629	SID17415817, BRD-K97245222	999345	InChI=1S/C25H26N2O/c1-18-6-5-7-19(2)24(18)26-25(28)22-12-10-20(11-13-22)16-27-15-14-21-8-3-4-9-23(21)17-27/h3-13H,14-17H2,1-2H3,(H,26,28)	JAIFWJBLUVTGTN-UHFFFAOYSA-N	Cc1cccc(C)c1NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2	BroadT	BRD-K97245222	BRD-K97245222-001-05-1	ChemBridge Corporation	6221980			Cc1cccc(C)c1NC(=O)c1ccc(CN2CCc3ccccc3C2)cc1	InChI=1S/C25H26N2O/c1-18-6-5-7-19(2)24(18)26-25(28)22-12-10-20(11-13-22)16-27-15-14-21-8-3-4-9-23(21)17-27/h3-13H,14-17H2,1-2H3,(H,26,28)	JAIFWJBLUVTGTN-UHFFFAOYSA-N	370.204513472							121186
MLS001115838	LSM-32630	SID24395156, SID49730519, BRD-K39045647	16017270	InChI=1S/C18H20N4O2/c1-4-14-8-5-7-12(2)17(14)19-16(23)11-22-18(24)15-9-6-10-21(15)13(3)20-22/h5-10H,4,11H2,1-3H3,(H,19,23)	FKODVKCGKNLISA-UHFFFAOYSA-N	CCc1cccc(C)c1NC(=O)CN2N=C(C)n3cccc3C2=O	BroadT	BRD-K39045647	BRD-K39045647-001-05-3	ChemDiv Inc.	E020-0453			CCc1cccc(C)c1NC(=O)Cn1nc(C)n2cccc2c1=O	InChI=1S/C18H20N4O2/c1-4-14-8-5-7-12(2)17(14)19-16(23)11-22-18(24)15-9-6-10-21(15)13(3)20-22/h5-10H,4,11H2,1-3H3,(H,19,23)	FKODVKCGKNLISA-UHFFFAOYSA-N	324.15862592							121187
AK-928/13228037	LSM-32631	SID22414724, BRD-A96603750	5129581	InChI=1S/C14H14O4/c1-9-6-7-16-14(18-9)11-8-17-12-5-3-2-4-10(12)13(11)15/h2-5,8-9,14H,6-7H2,1H3	ADXCKCOKWMDXRE-UHFFFAOYSA-N	CC1CCOC(O1)C2=COc3ccccc3C2=O	BroadT	BRD-A96603750	BRD-A96603750-001-05-4	Specs	AK-928/13228037			CC1CCOC(O1)c1coc2ccccc2c1=O	InChI=1S/C14H14O4/c1-9-6-7-16-14(18-9)11-8-17-12-5-3-2-4-10(12)13(11)15/h2-5,8-9,14H,6-7H2,1H3	ADXCKCOKWMDXRE-UHFFFAOYSA-N	246.089208928							121188
1-(3,4-Dimethoxy-2-methylphenyl)-2-(3,4-dimethoxyphenyl)ethanone	LSM-32632	SID22412530, BRD-K22163324	825969	InChI=1S/C19H22O5/c1-12-14(7-9-17(22-3)19(12)24-5)15(20)10-13-6-8-16(21-2)18(11-13)23-4/h6-9,11H,10H2,1-5H3	AIAUBLZIUFOPKQ-UHFFFAOYSA-N	COc1ccc(CC(=O)c2ccc(OC)c(OC)c2C)cc1OC	BroadT	BRD-K22163324	BRD-K22163324-001-05-3	Specs	AE-562/12222515			COc1ccc(CC(=O)c2ccc(OC)c(OC)c2C)cc1OC	InChI=1S/C19H22O5/c1-12-14(7-9-17(22-3)19(12)24-5)15(20)10-13-6-8-16(21-2)18(11-13)23-4/h6-9,11H,10H2,1-5H3	AIAUBLZIUFOPKQ-UHFFFAOYSA-N	330.146723804							121189
N-[4-(Sec-butyl)phenyl]-7-nitro-1H-indole-2-carboxamide	LSM-32633	SID26729207, BRD-A11153536	2823667	InChI=1S/C19H19N3O3/c1-3-12(2)14-8-4-5-9-15(14)21-19(23)16-11-13-7-6-10-17(22(24)25)18(13)20-16/h4-12,20H,3H2,1-2H3,(H,21,23)	NKVPZUGKXCVNQJ-UHFFFAOYSA-N	CCC(C)c1ccccc1NC(=O)c2cc3cccc(c3[nH]2)[N+](=O)[O-]	BroadT	BRD-A11153536	BRD-A11153536-001-05-3	Maybridge	KM 11032			CCC(C)c1ccccc1NC(=O)c1cc2cccc([N+]([O-])=O)c2[nH]1	InChI=1S/C19H19N3O3/c1-3-12(2)14-8-4-5-9-15(14)21-19(23)16-11-13-7-6-10-17(22(24)25)18(13)20-16/h4-12,20H,3H2,1-2H3,(H,21,23)	NKVPZUGKXCVNQJ-UHFFFAOYSA-N	337.142641498							121190
AG-690/12869031	LSM-32634	SID17403490, BRD-K00485168	720545	InChI=1S/C15H10O2S/c1-9-6-7-18-13(9)8-12-14(16)10-4-2-3-5-11(10)15(12)17/h2-8H,1H3	DGJMRTAIJBODEK-UHFFFAOYSA-N	Cc1ccsc1C=C2C(=O)c3ccccc3C2=O	BroadT	BRD-K00485168	BRD-K00485168-001-05-5	Asinex Ltd.	BAS 00918326			Cc1ccsc1C=C1C(=O)c2ccccc2C1=O	InChI=1S/C15H10O2S/c1-9-6-7-18-13(9)8-12-14(16)10-4-2-3-5-11(10)15(12)17/h2-8H,1H3	DGJMRTAIJBODEK-UHFFFAOYSA-N	254.04015025							121191
ST50850776	LSM-32635	SID17431941, BRD-K71112180	2205070	InChI=1S/C13H10BrClN4OS/c14-9-1-2-11(10(15)7-9)17-13(21)19-18-12(20)8-3-5-16-6-4-8/h1-7H,(H,18,20)(H2,17,19,21)	YAMLHSJWYJGZCC-UHFFFAOYSA-N	Clc1cc(Br)ccc1NC(=S)NNC(=O)c2ccncc2	BroadT	BRD-K71112180	BRD-K71112180-001-05-3	ChemBridge Corporation	7785345			Clc1cc(Br)ccc1NC(=S)NNC(=O)c1ccncc1	InChI=1S/C13H10BrClN4OS/c14-9-1-2-11(10(15)7-9)17-13(21)19-18-12(20)8-3-5-16-6-4-8/h1-7H,(H,18,20)(H2,17,19,21)	YAMLHSJWYJGZCC-UHFFFAOYSA-N	383.94472198							121192
SMR000046413	LSM-32636	SID864121, BRD-K44477683	665370	InChI=1S/C18H21Cl2N3O3S/c1-18(2,3)26-17(24)23-8-4-5-14(23)15-21-22-16(25-15)27-10-11-6-7-12(19)9-13(11)20/h6-7,9,14H,4-5,8,10H2,1-3H3/t14-/m0/s1	JDZKHMFWSIVDHP-AWEZNQCLSA-N	CC(C)(C)OC(=O)N1CCC[C@H]1c2oc(SCc3ccc(Cl)cc3Cl)nn2	BroadT	BRD-K44477683	BRD-K44477683-001-05-6	InterBioScreen Ltd.	STOCK5S-01485			CC(C)(C)OC(=O)N1CCC[C@H]1c1nnc(SCc2ccc(Cl)cc2Cl)o1	InChI=1S/C18H21Cl2N3O3S/c1-18(2,3)26-17(24)23-8-4-5-14(23)15-21-22-16(25-15)27-10-11-6-7-12(19)9-13(11)20/h6-7,9,14H,4-5,8,10H2,1-3H3/t14-/m0/s1	JDZKHMFWSIVDHP-AWEZNQCLSA-N	429.068067672							121193
SMR000136884	LSM-44419	SID14740454, BRD-K09332934	1556906	InChI=1S/C13H16N2O3/c1-2-9-18-11-6-4-3-5-10(11)15-13(17)8-7-12(14)16/h3-8H,2,9H2,1H3,(H2,14,16)(H,15,17)/b8-7+	ATRRQBZUOKATSJ-BQYQJAHWSA-N	CCCOc1ccccc1NC(=O)\C=C\C(=O)N	BroadT	BRD-K09332934	BRD-K09332934-001-05-3	ChemBridge Corporation	5273139			CCCOc1ccccc1NC(=O)\C=C\C(N)=O	InChI=1S/C13H16N2O3/c1-2-9-18-11-6-4-3-5-10(11)15-13(17)8-7-12(14)16/h3-8H,2,9H2,1H3,(H2,14,16)(H,15,17)/b8-7+	ATRRQBZUOKATSJ-BQYQJAHWSA-N	248.116092392							
AC1N5UGX	LSM-32638	SID17513505, BRD-A86993709	4204460	InChI=1S/C16H11Cl3N2OS/c17-10-4-6-11(7-5-10)20-16-21-15(22)13(23-16)8-9-2-1-3-12(18)14(9)19/h1-7,13H,8H2,(H,20,21,22)	LPFXTJFIRLVDEP-UHFFFAOYSA-N	Clc1ccc(NC2=NC(=O)C(Cc3cccc(Cl)c3Cl)S2)cc1	BroadT	BRD-A86993709	BRD-A86993709-001-08-7	InterBioScreen Ltd.	STOCK2S-97112			Clc1ccc(NC2=NC(=O)C(Cc3cccc(Cl)c3Cl)S2)cc1	InChI=1S/C16H11Cl3N2OS/c17-10-4-6-11(7-5-10)20-16-21-15(22)13(23-16)8-9-2-1-3-12(18)14(9)19/h1-7,13H,8H2,(H,20,21,22)	LPFXTJFIRLVDEP-UHFFFAOYSA-N	383.965766812							121195
Reumycin	LSM-32639	SID403384, SID47193853	5351216	InChI=1S/C6H5N5O2/c1-11-5(12)3-4(9-6(11)13)10-8-2-7-3/h2H,1H3,(H,9,10,13)	ZLLAXLPOOMLVRF-UHFFFAOYSA-N	CN1C(=O)Nc2nncnc2C1=O	BroadT	BRD-K88625883	BRD-K88625883-001-05-5	InterBioScreen Ltd.	STOCK1N-31747			Cn1c(=O)[nH]c2nncnc2c1=O	InChI=1S/C6H5N5O2/c1-11-5(12)3-4(9-6(11)13)10-8-2-7-3/h2H,1H3,(H,9,10,13)	ZLLAXLPOOMLVRF-UHFFFAOYSA-N	179.04432445							121196
ST4111877	LSM-32640	SID24781293, BRD-K10682647	4921006	InChI=1S/C15H17N3O2/c1-11(2)13-5-3-12(4-6-13)9-16-15-8-7-14(10-17-15)18(19)20/h3-8,10-11H,9H2,1-2H3,(H,16,17)	QWKZXOSMZWNWCC-UHFFFAOYSA-N	CC(C)c1ccc(CNc2ccc(cn2)[N+](=O)[O-])cc1	BroadT	BRD-K10682647	BRD-K10682647-001-06-4	ChemDiv Inc.	8016-5577			CC(C)c1ccc(CNc2ccc(cn2)[N+]([O-])=O)cc1	InChI=1S/C15H17N3O2/c1-11(2)13-5-3-12(4-6-13)9-16-15-8-7-14(10-17-15)18(19)20/h3-8,10-11H,9H2,1-2H3,(H,16,17)	QWKZXOSMZWNWCC-UHFFFAOYSA-N	271.132076814							121197
MLS000589617	LSM-32641	SID22400571, BRD-K63960291	910790	InChI=1S/C17H12N4O4/c1-25-12-5-2-10(3-6-12)20-16(19)15(9-18)13-7-4-11(21(23)24)8-14(13)17(20)22/h2-8H,19H2,1H3	SRFPVHYAPYBZLI-UHFFFAOYSA-N	COc1ccc(cc1)N2C(=C(C#N)c3ccc(cc3C2=O)[N+](=O)[O-])N	BroadT	BRD-K63960291	BRD-K63960291-001-05-1	InterBioScreen Ltd.	STOCK1S-08649			COc1ccc(cc1)-n1c(N)c(C#N)c2ccc(cc2c1=O)[N+]([O-])=O	InChI=1S/C17H12N4O4/c1-25-12-5-2-10(3-6-12)20-16(19)15(9-18)13-7-4-11(21(23)24)8-14(13)17(20)22/h2-8H,19H2,1H3	SRFPVHYAPYBZLI-UHFFFAOYSA-N	336.085854904							121198
STK300538	LSM-32642	SID4258410, BRD-K93162616	1258379	InChI=1S/C20H21N3O3/c1-13-9-14(2)15(3)17(10-13)25-12-18(24)21-11-19-22-20(23-26-19)16-7-5-4-6-8-16/h4-10H,11-12H2,1-3H3,(H,21,24)	YUZBSMACDDPQEZ-UHFFFAOYSA-N	Cc1cc(C)c(C)c(OCC(=O)NCc2onc(n2)c3ccccc3)c1	BroadT	BRD-K93162616	BRD-K93162616-001-05-6	ChemBridge Corporation	7986257			Cc1cc(C)c(C)c(OCC(=O)NCc2nc(no2)-c2ccccc2)c1	InChI=1S/C20H21N3O3/c1-13-9-14(2)15(3)17(10-13)25-12-18(24)21-11-19-22-20(23-26-19)16-7-5-4-6-8-16/h4-10H,11-12H2,1-3H3,(H,21,24)	YUZBSMACDDPQEZ-UHFFFAOYSA-N	351.158291562							121199
SMR000004814	LSM-32643	SID846192, BRD-K36944345	648574	InChI=1S/C17H17N3O2S/c1-3-12-9-13-6-4-5-7-14(13)18-17(12)23-10-16(21)19-15-8-11(2)22-20-15/h4-9H,3,10H2,1-2H3,(H,19,20,21)	AJQDJWPKSULOFO-UHFFFAOYSA-N	CCc1cc2ccccc2nc1SCC(=O)Nc3cc(C)on3	BroadT	BRD-K36944345	BRD-K36944345-001-05-5	Asinex Ltd.	ASN 05546498			CCc1cc2ccccc2nc1SCC(=O)Nc1cc(C)on1	InChI=1S/C17H17N3O2S/c1-3-12-9-13-6-4-5-7-14(13)18-17(12)23-10-16(21)19-15-8-11(2)22-20-15/h4-9H,3,10H2,1-2H3,(H,19,20,21)	AJQDJWPKSULOFO-UHFFFAOYSA-N	327.104147504							121200
MLS001203461	LSM-32644	SID47204202, BRD-K92057158	1049793	InChI=1S/C21H16N2O3S/c1-26-19-10-6-5-9-15(19)16-11-18(14-7-3-2-4-8-14)23-21(17(16)12-22)27-13-20(24)25/h2-11H,13H2,1H3,(H,24,25)	HXHZNFAFHFRUIE-UHFFFAOYSA-N	COc1ccccc1c2cc(nc(SCC(=O)O)c2C#N)c3ccccc3	BroadT	BRD-K92057158	BRD-K92057158-001-06-1	Asinex Ltd.	BAS 01279502			COc1ccccc1-c1cc(nc(SCC(O)=O)c1C#N)-c1ccccc1	InChI=1S/C21H16N2O3S/c1-26-19-10-6-5-9-15(19)16-11-18(14-7-3-2-4-8-14)23-21(17(16)12-22)27-13-20(24)25/h2-11H,13H2,1H3,(H,24,25)	HXHZNFAFHFRUIE-UHFFFAOYSA-N	376.088163082							121201
N1-Ethyl-2-phenylhydrazine-1-carbothioamide	LSM-32645	SID26727658, BRD-K73022080	2731067	InChI=1S/C9H13N3S/c1-2-10-9(13)12-11-8-6-4-3-5-7-8/h3-7,11H,2H2,1H3,(H2,10,12,13)	DPELBGAJWVGUJS-UHFFFAOYSA-N	CCN=C(S)NNc1ccccc1	BroadT	BRD-K73022080	BRD-K73022080-001-05-3	Maybridge	S 02279			CCN=C(S)NNc1ccccc1	InChI=1S/C9H13N3S/c1-2-10-9(13)12-11-8-6-4-3-5-7-8/h3-7,11H,2H2,1H3,(H2,10,12,13)	DPELBGAJWVGUJS-UHFFFAOYSA-N	195.083018136							121202
AC1MWKMY	LSM-32646	BRD-K68402828	3750788	InChI=1S/C19H10Cl2F4N4OS2/c20-13-2-1-3-15(22)12(13)9-30-28-5-4-16-11(7-26)17(29-32-16)31-18-14(21)6-10(8-27-18)19(23,24)25/h1-3,5-6,8H,4,9H2	GJAQSWVFYUZJGE-UHFFFAOYSA-N	Fc1cccc(Cl)c1CON=CCc2snc(Sc3ncc(cc3Cl)C(F)(F)F)c2C#N	BroadT	BRD-K68402828	BRD-K68402828-001-05-1	Key Organics Ltd.	3L-016			Fc1cccc(Cl)c1CON=CCc1snc(Sc2ncc(cc2Cl)C(F)(F)F)c1C#N	InChI=1S/C19H10Cl2F4N4OS2/c20-13-2-1-3-15(22)12(13)9-30-28-5-4-16-11(7-26)17(29-32-16)31-18-14(21)6-10(8-27-18)19(23,24)25/h1-3,5-6,8H,4,9H2	GJAQSWVFYUZJGE-UHFFFAOYSA-N	519.96092058							121203
MLS000034870	LSM-32647	SID843973, BRD-K60177480	646279	InChI=1S/C17H15NO3/c1-18(2)17(20)15-13-10-12(19)8-9-14(13)21-16(15)11-6-4-3-5-7-11/h3-10,19H,1-2H3	QZYYHSYJKIKPCM-UHFFFAOYSA-N	CN(C)C(=O)c1c(oc2ccc(O)cc12)c3ccccc3	BroadT	BRD-K60177480	BRD-K60177480-001-05-6	Asinex Ltd.	BAS 02770979			CN(C)C(=O)c1c(oc2ccc(O)cc12)-c1ccccc1	InChI=1S/C17H15NO3/c1-18(2)17(20)15-13-10-12(19)8-9-14(13)21-16(15)11-6-4-3-5-7-11/h3-10,19H,1-2H3	QZYYHSYJKIKPCM-UHFFFAOYSA-N	281.10519335							121204
2-(4-Phenethyl-5-phenoxymethyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetamide	LSM-32648	SID848819, BRD-K67396707	651272	InChI=1S/C19H20N4O2S/c20-17(24)14-26-19-22-21-18(13-25-16-9-5-2-6-10-16)23(19)12-11-15-7-3-1-4-8-15/h1-10H,11-14H2,(H2,20,24)	YCQHXTQHTUFESI-UHFFFAOYSA-N	NC(=O)CSc1nnc(COc2ccccc2)n1CCc3ccccc3	BroadT	BRD-K67396707	BRD-K67396707-001-05-2	Asinex Ltd.	ASN 03980913			NC(=O)CSc1nnc(COc2ccccc2)n1CCc1ccccc1	InChI=1S/C19H20N4O2S/c20-17(24)14-26-19-22-21-18(13-25-16-9-5-2-6-10-16)23(19)12-11-15-7-3-1-4-8-15/h1-10H,11-14H2,(H2,20,24)	YCQHXTQHTUFESI-UHFFFAOYSA-N	368.13069661							121205
AC1NCP2U	LSM-32649	BRD-K37811399	4562437	InChI=1S/C11H8Cl3N3S/c1-6-2-3-7(18-6)5-15-17-11-9(13)4-8(12)10(14)16-11/h2-5H,1H3,(H,16,17)	KVNXFKMMVOABSE-UHFFFAOYSA-N	Cc1ccc(C=NNc2nc(Cl)c(Cl)cc2Cl)s1	BroadT	BRD-K37811399	BRD-K37811399-001-05-0	Enamine Ltd.	T5228744			Cc1ccc(C=NNc2nc(Cl)c(Cl)cc2Cl)s1	InChI=1S/C11H8Cl3N3S/c1-6-2-3-7(18-6)5-15-17-11-9(13)4-8(12)10(14)16-11/h2-5H,1H3,(H,16,17)	KVNXFKMMVOABSE-UHFFFAOYSA-N	318.950451106							121206
BRD-A56141348	LSM-32650			InChI=1S/C26H26N2O8/c1-6-35-18-10-7-15(12-20(18)34-5)23-22(24(29)16-8-9-17(32-3)19(13-16)33-4)25(30)26(31)28(23)21-11-14(2)36-27-21/h7-13,22-23H,6H2,1-5H3	XNEHFHPZKKPOPZ-UHFFFAOYSA-N	CCOc1ccc(cc1OC)C2C(C(=O)c3ccc(OC)c(OC)c3)C(=O)C(=O)N2c4cc(C)on4	BroadT	BRD-A56141348	BRD-A56141348-001-05-2	InterBioScreen Ltd.	STOCK3S-85271			CCOc1ccc(cc1OC)C1C(C(=O)c2ccc(OC)c(OC)c2)C(=O)C(=O)N1c1cc(C)on1	InChI=1S/C26H26N2O8/c1-6-35-18-10-7-15(12-20(18)34-5)23-22(24(29)16-8-9-17(32-3)19(13-16)33-4)25(30)26(31)28(23)21-11-14(2)36-27-21/h7-13,22-23H,6H2,1-5H3	XNEHFHPZKKPOPZ-UHFFFAOYSA-N	494.168915812							121207
N-[2-(1-Cyclohexen-1-yl)ethyl]-4-fluorobenzamide	LSM-32651	SID22415578, BRD-K73196671	695014	InChI=1S/C15H18FNO/c16-14-8-6-13(7-9-14)15(18)17-11-10-12-4-2-1-3-5-12/h4,6-9H,1-3,5,10-11H2,(H,17,18)	FLUJDWNFMMMLFN-UHFFFAOYSA-N	Fc1ccc(cc1)C(=O)NCCC2=CCCCC2	BroadT	BRD-K73196671	BRD-K73196671-001-05-0	ChemBridge Corporation	6969109			Fc1ccc(cc1)C(=O)NCCC1=CCCCC1	InChI=1S/C15H18FNO/c16-14-8-6-13(7-9-14)15(18)17-11-10-12-4-2-1-3-5-12/h4,6-9H,1-3,5,10-11H2,(H,17,18)	FLUJDWNFMMMLFN-UHFFFAOYSA-N	247.137242406							121208
MLS000778563	LSM-32652	SID26658543, BRD-K58181846	1427781	InChI=1S/C19H20N2O4/c1-12(2)21(19(23)17-5-4-8-25-17)11-14-9-13-10-15(24-3)6-7-16(13)20-18(14)22/h4-10,12H,11H2,1-3H3,(H,20,22)	CUDOUIAIWJGDDV-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(C(C)C)C(=O)c3occc3)cc2c1	BroadT	BRD-K58181846	BRD-K58181846-001-11-9	InterBioScreen Ltd.	STOCK4S-45869			COc1ccc2nc(O)c(CN(C(C)C)C(=O)c3ccco3)cc2c1	InChI=1S/C19H20N2O4/c1-12(2)21(19(23)17-5-4-8-25-17)11-14-9-13-10-15(24-3)6-7-16(13)20-18(14)22/h4-10,12H,11H2,1-3H3,(H,20,22)	CUDOUIAIWJGDDV-UHFFFAOYSA-N	340.14230714							121209
ST025254	LSM-44420	SID49819373, BRD-K98453830	1269436	InChI=1S/C16H11NO6S/c1-21-12-7-9(8-13-14(18)17-16(20)24-13)4-5-10(12)23-15(19)11-3-2-6-22-11/h2-8H,1H3,(H,17,18,20)/b13-8+	INEZCFOATYRSBW-MDWZMJQESA-N	COc1cc(\C=C/2\SC(=O)NC2=O)ccc1OC(=O)c3occc3	BroadT	BRD-K98453830	BRD-K98453830-001-05-4	ChemBridge Corporation	5583854			COc1cc(\C=C2\SC(=O)NC2=O)ccc1OC(=O)c1ccco1	InChI=1S/C16H11NO6S/c1-21-12-7-9(8-13-14(18)17-16(20)24-13)4-5-10(12)23-15(19)11-3-2-6-22-11/h2-8H,1H3,(H,17,18,20)/b13-8+	INEZCFOATYRSBW-MDWZMJQESA-N	345.030707772							
STK159324	LSM-32654	SID4255883, BRD-K99873259	1091334	InChI=1S/C21H24N2O3S/c1-2-27-20-6-4-3-5-17(20)21(24)23-11-9-22(10-12-23)14-16-7-8-18-19(13-16)26-15-25-18/h3-8,13H,2,9-12,14-15H2,1H3	KBSRJCKRTGVLKD-UHFFFAOYSA-N	CCSc1ccccc1C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2	BroadT	BRD-K99873259	BRD-K99873259-001-05-4	ChemBridge Corporation	7837572			CCSc1ccccc1C(=O)N1CCN(Cc2ccc3OCOc3c2)CC1	InChI=1S/C21H24N2O3S/c1-2-27-20-6-4-3-5-17(20)21(24)23-11-9-22(10-12-23)14-16-7-8-18-19(13-16)26-15-25-18/h3-8,13H,2,9-12,14-15H2,1H3	KBSRJCKRTGVLKD-UHFFFAOYSA-N	384.150763338							121211
ZINC03504274	LSM-32655	SID22408515, BRD-K67477677	2621404	InChI=1S/C15H12N2O3S/c1-10(18)11-2-4-13(5-3-11)20-9-12-8-14(19)17-6-7-21-15(17)16-12/h2-8H,9H2,1H3	WILZTVLXKRTKNX-UHFFFAOYSA-N	CC(=O)c1ccc(OCC2=CC(=O)N3C=CSC3=N2)cc1	BroadT	BRD-K67477677	BRD-K67477677-001-05-6	Enamine Ltd.	Z26338490			CC(=O)c1ccc(OCc2cc(=O)n3ccsc3n2)cc1	InChI=1S/C15H12N2O3S/c1-10(18)11-2-4-13(5-3-11)20-9-12-8-14(19)17-6-7-21-15(17)16-12/h2-8H,9H2,1H3	WILZTVLXKRTKNX-UHFFFAOYSA-N	300.056862954							121212
AK-968/41925027	LSM-32656	SID24797261, BRD-K42372799	1769284	InChI=1S/C14H16N6O4S/c1-24-12-4-2-3-10(7-12)16-14(25)18-17-13(21)5-6-19-9-11(8-15-19)20(22)23/h2-4,7-9H,5-6H2,1H3,(H,17,21)(H2,16,18,25)	PGKLNIRBCLXTFX-UHFFFAOYSA-N	COc1cccc(NC(=NNC(=O)CCn2cc(cn2)[N+](=O)[O-])S)c1	BroadT	BRD-K42372799	BRD-K42372799-001-05-2	Specs	AK-968/41925027			COc1cccc(NC(S)=NNC(=O)CCn2cc(cn2)[N+]([O-])=O)c1	InChI=1S/C14H16N6O4S/c1-24-12-4-2-3-10(7-12)16-14(25)18-17-13(21)5-6-19-9-11(8-15-19)20(22)23/h2-4,7-9H,5-6H2,1H3,(H,17,21)(H2,16,18,25)	PGKLNIRBCLXTFX-UHFFFAOYSA-N	364.095373742							121213
MLS000527806	LSM-32657	SID14725957, BRD-K03168046	1446976	InChI=1S/C16H11N5OS/c1-21(15(22)12-7-5-11(10-17)6-8-12)16-20-19-14(23-16)13-4-2-3-9-18-13/h2-9H,1H3	QIRCUAHZEDENKZ-UHFFFAOYSA-N	CN(C(=O)c1ccc(cc1)C#N)c2nnc(s2)c3ccccn3	BroadT	BRD-K03168046	BRD-K03168046-001-04-5	Asinex Ltd.	ASN 09114441			CN(C(=O)c1ccc(cc1)C#N)c1nnc(s1)-c1ccccn1	InChI=1S/C16H11N5OS/c1-21(15(22)12-7-5-11(10-17)6-8-12)16-20-19-14(23-16)13-4-2-3-9-18-13/h2-9H,1H3	QIRCUAHZEDENKZ-UHFFFAOYSA-N	321.068430712							121214
ST007932	LSM-32658	SID24818370, BRD-K33846577	753401	InChI=1S/C16H9ClFN3/c17-11-5-3-6-12(18)15(11)16-20-19-14-9-8-10-4-1-2-7-13(10)21(14)16/h1-9H	DPRMBTOOTZWEFW-UHFFFAOYSA-N	Fc1cccc(Cl)c1c2nnc3ccc4ccccc4n23	BroadT	BRD-K33846577	BRD-K33846577-001-06-2	Asinex Ltd.	BAS 02876092			Fc1cccc(Cl)c1-c1nnc2ccc3ccccc3n12	InChI=1S/C16H9ClFN3/c17-11-5-3-6-12(18)15(11)16-20-19-14-9-8-10-4-1-2-7-13(10)21(14)16/h1-9H	DPRMBTOOTZWEFW-UHFFFAOYSA-N	297.046903228							121215
N-Cyclopentyl-2-(6-methoxy-3-methyl-quinolin-2-ylsulfanyl)-acetamide	LSM-32659	SID49713860, BRD-K39064872	862401	InChI=1S/C18H22N2O2S/c1-12-9-13-10-15(22-2)7-8-16(13)20-18(12)23-11-17(21)19-14-5-3-4-6-14/h7-10,14H,3-6,11H2,1-2H3,(H,19,21)	RYGFYCRCJPWIMP-UHFFFAOYSA-N	COc1ccc2nc(SCC(=O)NC3CCCC3)c(C)cc2c1	BroadT	BRD-K39064872	BRD-K39064872-001-05-0	Asinex Ltd.	ASN 03321978			COc1ccc2nc(SCC(=O)NC3CCCC3)c(C)cc2c1	InChI=1S/C18H22N2O2S/c1-12-9-13-10-15(22-2)7-8-16(13)20-18(12)23-11-17(21)19-14-5-3-4-6-14/h7-10,14H,3-6,11H2,1-2H3,(H,19,21)	RYGFYCRCJPWIMP-UHFFFAOYSA-N	330.140198654							121216
AC1MWLKX	LSM-32660	BRD-A89681034	3751218	InChI=1S/C19H21N3O3/c1-19(2,3)14-4-5-15-16(10-14)25-17(12-24-15)18(23)22-21-11-13-6-8-20-9-7-13/h4-11,17H,12H2,1-3H3,(H,22,23)	HAIKPVBPMHLLAJ-UHFFFAOYSA-N	CC(C)(C)c1ccc2OCC(Oc2c1)C(=O)NN=Cc3ccncc3	BroadT	BRD-A89681034	BRD-A89681034-001-05-7	InterBioScreen Ltd.	STOCK2S-58094			CC(C)(C)c1ccc2OCC(Oc2c1)C(=O)NN=Cc1ccncc1	InChI=1S/C19H21N3O3/c1-19(2,3)14-4-5-15-16(10-14)25-17(12-24-15)18(23)22-21-11-13-6-8-20-9-7-13/h4-11,17H,12H2,1-3H3,(H,22,23)	HAIKPVBPMHLLAJ-UHFFFAOYSA-N	339.158291562							121217
ASN 06164291	LSM-32661	SID24787857, BRD-K70431906	1460454	InChI=1S/C18H19N5O4S/c1-3-23-16(14-5-4-10-27-14)20-22-18(23)28-11-15(24)19-21-17(25)12-6-8-13(26-2)9-7-12/h4-10H,3,11H2,1-2H3,(H,19,24)(H,21,25)	RBIPFOIMBKDSBP-UHFFFAOYSA-N	CCn1c(SCC(=O)NNC(=O)c2ccc(OC)cc2)nnc1c3occc3	BroadT	BRD-K70431906	BRD-K70431906-001-05-1	Asinex Ltd.	ASN 06164291			CCn1c(SCC(=O)NNC(=O)c2ccc(OC)cc2)nnc1-c1ccco1	InChI=1S/C18H19N5O4S/c1-3-23-16(14-5-4-10-27-14)20-22-18(23)28-11-15(24)19-21-17(25)12-6-8-13(26-2)9-7-12/h4-10H,3,11H2,1-2H3,(H,19,24)(H,21,25)	RBIPFOIMBKDSBP-UHFFFAOYSA-N	401.115774828							121218
5-Amino-n-(2-methoxy-5-methylphenyl)-1-[3-(trifluoromethyl)benzyl]-1H-1,2,3-triazole-4-carboxamide	LSM-32662	SID24811501, BRD-K74148328	16193337	InChI=1S/C19H18F3N5O2/c1-11-6-7-15(29-2)14(8-11)24-18(28)16-17(23)27(26-25-16)10-12-4-3-5-13(9-12)19(20,21)22/h3-9H,10,23H2,1-2H3,(H,24,28)	WPCLARMZPFMCID-UHFFFAOYSA-N	COc1ccc(C)cc1NC(=O)c2nnn(Cc3cccc(c3)C(F)(F)F)c2N	BroadT	BRD-K74148328	BRD-K74148328-001-05-7	ChemDiv Inc.	C549-0314			COc1ccc(C)cc1NC(=O)c1nnn(Cc2cccc(c2)C(F)(F)F)c1N	InChI=1S/C19H18F3N5O2/c1-11-6-7-15(29-2)14(8-11)24-18(28)16-17(23)27(26-25-16)10-12-4-3-5-13(9-12)19(20,21)22/h3-9H,10,23H2,1-2H3,(H,24,28)	WPCLARMZPFMCID-UHFFFAOYSA-N	405.141259466							121219
T5770198	LSM-32663	SID3712669, BRD-K91007014	2348844	InChI=1S/C12H8N2S2/c1-3-9(7-13-5-1)12-14-10(8-16-12)11-4-2-6-15-11/h1-8H	MQPPHGXKPCJSBY-UHFFFAOYSA-N	c1cncc(c1)c2nc(cs2)c3cccs3	BroadT	BRD-K91007014	BRD-K91007014-001-05-3	Enamine Ltd.	T0508-2833			c1csc(c1)-c1csc(n1)-c1cccnc1	InChI=1S/C12H8N2S2/c1-3-9(7-13-5-1)12-14-10(8-16-12)11-4-2-6-15-11/h1-8H	MQPPHGXKPCJSBY-UHFFFAOYSA-N	244.012889656							121220
N-[5-(3,4-Dimethoxy-benzyl)-[1,3,4]thiadiazol-2-yl]-4-methoxy-benzamide	LSM-32664	SID49641148, BRD-K76739395	1086862	InChI=1S/C19H19N3O4S/c1-24-14-7-5-13(6-8-14)18(23)20-19-22-21-17(27-19)11-12-4-9-15(25-2)16(10-12)26-3/h4-10H,11H2,1-3H3,(H,20,22,23)	GILRLYPSLDSUMR-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)Nc2nnc(Cc3ccc(OC)c(OC)c3)s2	BroadT	BRD-K76739395	BRD-K76739395-001-05-9	Asinex Ltd.	BAS 06980175			COc1ccc(cc1)C(=O)Nc1nnc(Cc2ccc(OC)c(OC)c2)s1	InChI=1S/C19H19N3O4S/c1-24-14-7-5-13(6-8-14)18(23)20-19-22-21-17(27-19)11-12-4-9-15(25-2)16(10-12)26-3/h4-10H,11H2,1-3H3,(H,20,22,23)	GILRLYPSLDSUMR-UHFFFAOYSA-N	385.109626808							121221
ASN 03879204	LSM-32665	SID16952945, BRD-A76293834	3180044	InChI=1S/C25H31FN6O3/c1-2-3-10-22(25(34)27-20-7-4-5-8-20)31(16-21-9-6-15-35-21)23(33)17-32-29-24(28-30-32)18-11-13-19(26)14-12-18/h6,9,11-15,20,22H,2-5,7-8,10,16-17H2,1H3,(H,27,34)	TVQWXWMWSQHPBI-UHFFFAOYSA-N	CCCCC(N(Cc1occc1)C(=O)Cn2nnc(n2)c3ccc(F)cc3)C(=O)NC4CCCC4	BroadT	BRD-A76293834	BRD-A76293834-001-05-8	Asinex Ltd.	ASN 03879204			CCCCC(N(Cc1ccco1)C(=O)Cn1nnc(n1)-c1ccc(F)cc1)C(=O)NC1CCCC1	InChI=1S/C25H31FN6O3/c1-2-3-10-22(25(34)27-20-7-4-5-8-20)31(16-21-9-6-15-35-21)23(33)17-32-29-24(28-30-32)18-11-13-19(26)14-12-18/h6,9,11-15,20,22H,2-5,7-8,10,16-17H2,1H3,(H,27,34)	TVQWXWMWSQHPBI-UHFFFAOYSA-N	482.244167112							121222
STK223940	LSM-32666	SID4262303, BRD-K86203579	893789	InChI=1S/C15H14ClNO3/c1-20-12-5-2-10(3-6-12)8-15(19)17-13-9-11(16)4-7-14(13)18/h2-7,9,18H,8H2,1H3,(H,17,19)	MVLSKDWUTDAVET-UHFFFAOYSA-N	COc1ccc(CC(=O)Nc2cc(Cl)ccc2O)cc1	BroadT	BRD-K86203579	BRD-K86203579-001-05-2	ChemBridge Corporation	7595304			COc1ccc(CC(=O)Nc2cc(Cl)ccc2O)cc1	InChI=1S/C15H14ClNO3/c1-20-12-5-2-10(3-6-12)8-15(19)17-13-9-11(16)4-7-14(13)18/h2-7,9,18H,8H2,1H3,(H,17,19)	MVLSKDWUTDAVET-UHFFFAOYSA-N	291.066221028							121223
MLS001212858	LSM-32667	SID131485214, SID49643463, BRD-K80876892	1462216	InChI=1S/C20H24N4O3S/c1-3-24-19-7-5-4-6-18(19)21-20(24)22-12-14-23(15-13-22)28(25,26)17-10-8-16(27-2)9-11-17/h4-11H,3,12-15H2,1-2H3	LYVCFZODSMSCFI-UHFFFAOYSA-N	CCn1c(nc2ccccc12)N3CCN(CC3)S(=O)(=O)c4ccc(OC)cc4	BroadT	BRD-K80876892	BRD-K80876892-001-05-1	Asinex Ltd.	ASN 06354476			CCn1c(nc2ccccc12)N1CCN(CC1)S(=O)(=O)c1ccc(OC)cc1	InChI=1S/C20H24N4O3S/c1-3-24-19-7-5-4-6-18(19)21-20(24)22-12-14-23(15-13-22)28(25,26)17-10-8-16(27-2)9-11-17/h4-11H,3,12-15H2,1-2H3	LYVCFZODSMSCFI-UHFFFAOYSA-N	400.156911358							121224
MLS001001638	LSM-15458	BRD-A77838472	2843452	InChI=1S/C17H27NO3/c1-12-5-13(2)7-17(6-12)20-11-16(19)10-18-8-14(3)21-15(4)9-18/h5-7,14-16,19H,8-11H2,1-4H3	RBTQZJCHJLPEED-UHFFFAOYSA-N	CC1CN(CC(O)COc2cc(C)cc(C)c2)CC(C)O1	BroadT	BRD-A77838472	BRD-A77838472-003-06-0	ChemBridge Corporation	5358524		Cl	CC1CN(CC(O)COc2cc(C)cc(C)c2)CC(C)O1.Cl	InChI=1S/C17H27NO3.ClH/c1-12-5-13(2)7-17(6-12)20-11-16(19)10-18-8-14(3)21-15(4)9-18;/h5-7,14-16,19H,8-11H2,1-4H3;1H	BJVCHEMWUMOZEC-UHFFFAOYSA-N	293.199093734							104100, 104100
MLS000770839	LSM-32668	SID131485204, SID24830028, BRD-K28558065	2104090	InChI=1S/C18H16ClN3O/c1-13-7-9-14(10-8-13)18-16(20-17(23)11-19)12-22(21-18)15-5-3-2-4-6-15/h2-10,12H,11H2,1H3,(H,20,23)	WTUJTYDYKXFWIR-UHFFFAOYSA-N	Cc1ccc(cc1)c2nn(cc2NC(=O)CCl)c3ccccc3	BroadT	BRD-K28558065	BRD-K28558065-001-05-1	Enamine Ltd.	T5237318			Cc1ccc(cc1)-c1nn(cc1NC(=O)CCl)-c1ccccc1	InChI=1S/C18H16ClN3O/c1-13-7-9-14(10-8-13)18-16(20-17(23)11-19)12-22(21-18)15-5-3-2-4-6-15/h2-10,12H,11H2,1H3,(H,20,23)	WTUJTYDYKXFWIR-UHFFFAOYSA-N	325.098189872							121225
GNF-PF-1878	LSM-44421	GNF-PF-1878, BRD-A28482739	664284	InChI=1S/C17H20FN5/c1-2-23-7-3-4-12(23)9-19-17-16-15(20-10-21-17)13-8-11(18)5-6-14(13)22-16/h5-6,8,10,12,19H,2-4,7,9H2,1H3,(H,20,21)	AJNUWNVGWAWEEQ-UHFFFAOYSA-N	CCN1CCCC1CNc2[nH]cnc3c4cc(F)ccc4nc23	BroadT	BRD-A28482739	BRD-A28482739-001-05-2	InterBioScreen Ltd.	STOCK4S-62391			CCN1CCCC1CNc1[nH]cnc2c3cc(F)ccc3nc12	InChI=1S/C17H20FN5/c1-2-23-7-3-4-12(23)9-19-17-16-15(20-10-21-17)13-8-11(18)5-6-14(13)22-16/h5-6,8,10,12,19H,2-4,7,9H2,1H3,(H,20,21)	AJNUWNVGWAWEEQ-UHFFFAOYSA-N	313.17027389							
SMR000025453	LSM-32670	SID4245640, SID24839291, BRD-K44240630	3240087	InChI=1S/C15H14BrN3O3S3/c1-9-3-4-10-11(7-9)23-15(17-10)18-13(20)8-19(2)25(21,22)14-6-5-12(16)24-14/h3-7H,8H2,1-2H3,(H,17,18,20)	FCQUWWDXGSTWHJ-UHFFFAOYSA-N	CN(CC(=O)Nc1nc2ccc(C)cc2s1)S(=O)(=O)c3ccc(Br)s3	BroadT	BRD-K44240630	BRD-K44240630-001-05-2	ChemDiv Inc.	C274-3314			CN(CC(=O)Nc1nc2ccc(C)cc2s1)S(=O)(=O)c1ccc(Br)s1	InChI=1S/C15H14BrN3O3S3/c1-9-3-4-10-11(7-9)23-15(17-10)18-13(20)8-19(2)25(21,22)14-6-5-12(16)24-14/h3-7H,8H2,1-2H3,(H,17,18,20)	FCQUWWDXGSTWHJ-UHFFFAOYSA-N	458.938066008							121227
MLS000082933	LSM-32671	SID863597, BRD-A73563792	5389894	InChI=1S/C21H22ClN5O3/c1-29-12-19(28)24-20-25-21-23-17(13-5-9-16(30-2)10-6-13)11-18(27(21)26-20)14-3-7-15(22)8-4-14/h3-10,17-18H,11-12H2,1-2H3,(H2,23,24,25,26,28)	IVTWYJRMCCRDBE-UHFFFAOYSA-N	COCC(=O)Nc1nc2NC(CC(c3ccc(Cl)cc3)n2n1)c4ccc(OC)cc4	BroadT	BRD-A73563792	BRD-A73563792-001-05-7	InterBioScreen Ltd.	STOCK4S-77295			COCC(=O)Nc1nc2NC(CC(c3ccc(Cl)cc3)n2n1)c1ccc(OC)cc1	InChI=1S/C21H22ClN5O3/c1-29-12-19(28)24-20-25-21-23-17(13-5-9-16(30-2)10-6-13)11-18(27(21)26-20)14-3-7-15(22)8-4-14/h3-10,17-18H,11-12H2,1-2H3,(H2,23,24,25,26,28)	IVTWYJRMCCRDBE-UHFFFAOYSA-N	427.141117324							121228
CBMICRO_008604	LSM-32672	SID17415021, BRD-K51270200	2225630	InChI=1S/C15H13FN2O2/c1-10-5-7-11(8-6-10)14(17)18-20-15(19)12-3-2-4-13(16)9-12/h2-9H,1H3,(H2,17,18)	HOHVJCDYOJBEQV-UHFFFAOYSA-N	Cc1ccc(cc1)C(=N)NOC(=O)c2cccc(F)c2	BroadT	BRD-K51270200	BRD-K51270200-001-05-9	ChemBridge Corporation	5928834			Cc1ccc(cc1)C(=N)NOC(=O)c1cccc(F)c1	InChI=1S/C15H13FN2O2/c1-10-5-7-11(8-6-10)14(17)18-20-15(19)12-3-2-4-13(16)9-12/h2-9H,1H3,(H2,17,18)	HOHVJCDYOJBEQV-UHFFFAOYSA-N	272.096105876							121229
2-[4-(3-Fluorophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]acetonitrile	LSM-32673	SID14729914, BRD-K21841112	4269177	InChI=1S/C11H9FN4O/c1-8-14-15(6-5-13)11(17)16(8)10-4-2-3-9(12)7-10/h2-4,7H,6H2,1H3	GAZRBGPPBOYNRU-UHFFFAOYSA-N	CC1=NN(CC#N)C(=O)N1c2cccc(F)c2	BroadT	BRD-K21841112	BRD-K21841112-001-05-1	Key Organics Ltd.	12T-0226			Cc1nn(CC#N)c(=O)n1-c1cccc(F)c1	InChI=1S/C11H9FN4O/c1-8-14-15(6-5-13)11(17)16(8)10-4-2-3-9(12)7-10/h2-4,7H,6H2,1H3	GAZRBGPPBOYNRU-UHFFFAOYSA-N	232.076039148							121230
MLS000083236	LSM-15459	BRD-K11957625	1983965	InChI=1S/C22H23N5O2S/c1-13-7-8-18(14(2)9-13)25-20(28)12-30-22-27-26-21(29-22)17(23)10-15-11-24-19-6-4-3-5-16(15)19/h3-9,11,17,24H,10,12,23H2,1-2H3,(H,25,28)/t17-/m0/s1	HFGPIAHGJWWKDI-KRWDZBQOSA-N	Cc1ccc(NC(=O)CSc2oc(nn2)[C@@H](N)Cc3c[nH]c4ccccc34)c(C)c1	BroadT	BRD-K11957625	BRD-K11957625-003-06-1	InterBioScreen Ltd.	STOCK4S-01902		Cl	Cc1ccc(NC(=O)CSc2nnc(o2)[C@@H](N)Cc2c[nH]c3ccccc23)c(C)c1.Cl	InChI=1S/C22H23N5O2S.ClH/c1-13-7-8-18(14(2)9-13)25-20(28)12-30-22-27-26-21(29-22)17(23)10-15-11-24-19-6-4-3-5-16(15)19;/h3-9,11,17,24H,10,12,23H2,1-2H3,(H,25,28);1H/t17-;/m0./s1	LMIZKTXKVFZVCF-LMOVPXPDSA-N	421.157245716							104101, 104101
4-(1,4-Dioxa-spiro[4.11]hexadec-2-ylmethyl)-morpholine	LSM-32674	SID17507262, BRD-A91149807	2879966	InChI=1S/C19H35NO3/c1-2-4-6-8-10-19(11-9-7-5-3-1)22-17-18(23-19)16-20-12-14-21-15-13-20/h18H,1-17H2	AXTKPHAKXVXLKW-UHFFFAOYSA-N	C(C1COC2(CCCCCCCCCCC2)O1)N3CCOCC3	BroadT	BRD-A91149807	BRD-A91149807-001-06-4	Asinex Ltd.	BAS 01306990			C(C1COC2(CCCCCCCCCCC2)O1)N1CCOCC1	InChI=1S/C19H35NO3/c1-2-4-6-8-10-19(11-9-7-5-3-1)22-17-18(23-19)16-20-12-14-21-15-13-20/h18H,1-17H2	AXTKPHAKXVXLKW-UHFFFAOYSA-N	325.26169399							121231
F2019-1588	LSM-15460	BRD-K40703229	16194888	InChI=1S/C24H24N4O5S/c1-26(2)9-4-10-27(24-25-17-12-18-19(33-14-32-18)13-20(17)34-24)23(31)15-5-3-6-16(11-15)28-21(29)7-8-22(28)30/h3,5-6,11-13H,4,7-10,14H2,1-2H3	BUZNYUKONGTFNO-UHFFFAOYSA-N	CN(C)CCCN(C(=O)c1cccc(c1)N2C(=O)CCC2=O)c3nc4cc5OCOc5cc4s3	BroadT	BRD-K40703229	BRD-K40703229-003-05-6	Life Chemicals Inc.	F2019-1588		Cl	CN(C)CCCN(C(=O)c1cccc(c1)N1C(=O)CCC1=O)c1nc2cc3OCOc3cc2s1.Cl	InChI=1S/C24H24N4O5S.ClH/c1-26(2)9-4-10-27(24-25-17-12-18-19(33-14-32-18)13-20(17)34-24)23(31)15-5-3-6-16(11-15)28-21(29)7-8-22(28)30;/h3,5-6,11-13H,4,7-10,14H2,1-2H3;1H	MPEWEGGHTBQZIW-UHFFFAOYSA-N	480.146740598							104102, 104102
T5329136	LSM-32675	SID22407121, BRD-K52865308	4968954	InChI=1S/C14H17N3O5/c1-22-14(19)9-4-6-16(7-5-9)11-3-2-10(13(15)18)8-12(11)17(20)21/h2-3,8-9H,4-7H2,1H3,(H2,15,18)	ZVHOUFHRSMKNSR-UHFFFAOYSA-N	COC(=O)C1CCN(CC1)c2ccc(cc2[N+](=O)[O-])C(=O)N	BroadT	BRD-K52865308	BRD-K52865308-001-05-6	Enamine Ltd.	T5329136			COC(=O)C1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(N)=O	InChI=1S/C14H17N3O5/c1-22-14(19)9-4-6-16(7-5-9)11-3-2-10(13(15)18)8-12(11)17(20)21/h2-3,8-9H,4-7H2,1H3,(H2,15,18)	ZVHOUFHRSMKNSR-UHFFFAOYSA-N	307.116820674							121232
MLS000109166	LSM-32676	SID7975530, BRD-K64657423	767910	InChI=1S/C11H10N4S2/c12-10-13-7(5-16-10)6-17-11-14-8-3-1-2-4-9(8)15-11/h1-5H,6H2,(H2,12,13)(H,14,15)	RJNOQUZPWTYHLI-UHFFFAOYSA-N	Nc1nc(CSc2nc3ccccc3[nH]2)cs1	BroadT	BRD-K64657423	BRD-K64657423-001-05-3	ChemBridge Corporation	5912327			Nc1nc(CSc2nc3ccccc3[nH]2)cs1	InChI=1S/C11H10N4S2/c12-10-13-7(5-16-10)6-17-11-14-8-3-1-2-4-9(8)15-11/h1-5H,6H2,(H2,12,13)(H,14,15)	RJNOQUZPWTYHLI-UHFFFAOYSA-N	262.03468774							121233
ST50143592	LSM-32677	SID47204896, SID24389633, BRD-K39718195	4750171	InChI=1S/C18H20N2O3/c1-22-16-10-13-8-9-20(12-14(13)11-17(16)23-2)18(21)19-15-6-4-3-5-7-15/h3-7,10-11H,8-9,12H2,1-2H3,(H,19,21)	VYWJFEZOCIEGAD-UHFFFAOYSA-N	COc1cc2CCN(Cc2cc1OC)C(=O)Nc3ccccc3	BroadT	BRD-K39718195	BRD-K39718195-001-05-1	Asinex Ltd.	BAS 09877009			COc1cc2CCN(Cc2cc1OC)C(=O)Nc1ccccc1	InChI=1S/C18H20N2O3/c1-22-16-10-13-8-9-20(12-14(13)11-17(16)23-2)18(21)19-15-6-4-3-5-7-15/h3-7,10-11H,8-9,12H2,1-2H3,(H,19,21)	VYWJFEZOCIEGAD-UHFFFAOYSA-N	312.14739252							121234
ST045868	LSM-32678	SID4240867, BRD-K35653711	671564	InChI=1S/C12H10F2N4O2/c1-6-4-10(18-17-6)15-12(20)16-11(19)8-3-2-7(13)5-9(8)14/h2-5H,1H3,(H3,15,16,17,18,19,20)	LTGSQWQGPXSEAT-UHFFFAOYSA-N	Cc1cc(NC(=O)NC(=O)c2ccc(F)cc2F)[nH]n1	BroadT	BRD-K35653711	BRD-K35653711-001-05-9	ChemDiv Inc.	8012-9290			Cc1cc(NC(=O)NC(=O)c2ccc(F)cc2F)[nH]n1	InChI=1S/C12H10F2N4O2/c1-6-4-10(18-17-6)15-12(20)16-11(19)8-3-2-7(13)5-9(8)14/h2-5H,1H3,(H3,15,16,17,18,19,20)	LTGSQWQGPXSEAT-UHFFFAOYSA-N	280.077182							121235
N-(3-Acetylphenyl)-3-ethoxybenzamide	LSM-32679	SID22416869, BRD-K84250827	880361	InChI=1S/C17H17NO3/c1-3-21-16-9-5-7-14(11-16)17(20)18-15-8-4-6-13(10-15)12(2)19/h4-11H,3H2,1-2H3,(H,18,20)	VKIBYPGLACINNB-UHFFFAOYSA-N	CCOc1cccc(c1)C(=O)Nc2cccc(c2)C(=O)C	BroadT	BRD-K84250827	BRD-K84250827-001-05-5	ChemBridge Corporation	6293068			CCOc1cccc(c1)C(=O)Nc1cccc(c1)C(C)=O	InChI=1S/C17H17NO3/c1-3-21-16-9-5-7-14(11-16)17(20)18-15-8-4-6-13(10-15)12(2)19/h4-11H,3H2,1-2H3,(H,18,20)	VKIBYPGLACINNB-UHFFFAOYSA-N	283.120843414							121236
ZINC03555687	LSM-44422	SID22410563, BRD-K19565039	2672927	InChI=1S/C17H17ClN2O3S/c1-20(2)24(22,23)15-10-8-14(9-11-15)19-17(21)12-7-13-5-3-4-6-16(13)18/h3-12H,1-2H3,(H,19,21)/b12-7+	GURBBFVQHCWHMJ-KPKJPENVSA-N	CN(C)S(=O)(=O)c1ccc(NC(=O)\C=C\c2ccccc2Cl)cc1	BroadT	BRD-K19565039	BRD-K19565039-001-08-4	Enamine Ltd.	ZT-3084522			CN(C)S(=O)(=O)c1ccc(NC(=O)\C=C\c2ccccc2Cl)cc1	InChI=1S/C17H17ClN2O3S/c1-20(2)24(22,23)15-10-8-14(9-11-15)19-17(21)12-7-13-5-3-4-6-16(13)18/h3-12H,1-2H3,(H,19,21)/b12-7+	GURBBFVQHCWHMJ-KPKJPENVSA-N	364.064840824							
MLS000063925	LSM-32681	SID4264069, BRD-A06808784	2956109	InChI=1S/C17H22N2O5/c1-3-19-9-10-24-14(16(19)21)11-15(20)18-13-7-5-12(6-8-13)17(22)23-4-2/h5-8,14H,3-4,9-11H2,1-2H3,(H,18,20)	TVUCLNYPQZOOLY-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)CC2OCCN(CC)C2=O)cc1	BroadT	BRD-A06808784	BRD-A06808784-001-05-8	ChemBridge Corporation	7805831			CCOC(=O)c1ccc(NC(=O)CC2OCCN(CC)C2=O)cc1	InChI=1S/C17H22N2O5/c1-3-19-9-10-24-14(16(19)21)11-15(20)18-13-7-5-12(6-8-13)17(22)23-4-2/h5-8,14H,3-4,9-11H2,1-2H3,(H,18,20)	TVUCLNYPQZOOLY-UHFFFAOYSA-N	334.152871824							121238
SMR000172460	LSM-32682	SID17410870, BRD-K64830442	5770187	InChI=1S/C21H18FN5O4S2/c1-4-31-20(30)15-9(2)17(10(3)28)33-19(15)24-14(29)8-32-21-25-18-16(26-27-21)12-7-11(22)5-6-13(12)23-18/h5-7,26H,4,8H2,1-3H3,(H,24,29)	RIVOMZMFCHUXFN-UHFFFAOYSA-N	CCOC(=O)c1c(C)c(sc1NC(=O)CSc2n[nH]c3c(n2)nc4ccc(F)cc34)C(=O)C	BroadT	BRD-K64830442	BRD-K64830442-001-04-6	Asinex Ltd.	ASN 02070567			CCOC(=O)c1c(NC(=O)CSc2n[nH]c3c(nc4ccc(F)cc34)n2)sc(C(C)=O)c1C	InChI=1S/C21H18FN5O4S2/c1-4-31-20(30)15-9(2)17(10(3)28)33-19(15)24-14(29)8-32-21-25-18-16(26-27-21)12-7-11(22)5-6-13(12)23-18/h5-7,26H,4,8H2,1-3H3,(H,24,29)	RIVOMZMFCHUXFN-UHFFFAOYSA-N	487.078423686							
SMR000184625	LSM-32683	SID17431955, BRD-A34658965	2831459	InChI=1S/C21H17Cl4N3OS/c22-16-10-3-4-11-17(16)26-20(30)28-19(21(23,24)25)27-18(29)12-14-8-5-7-13-6-1-2-9-15(13)14/h1-11,19H,12H2,(H,27,29)(H2,26,28,30)	BPKBLWFZGRSWLR-UHFFFAOYSA-N	Clc1ccccc1NC(=S)NC(NC(=O)Cc2cccc3ccccc23)C(Cl)(Cl)Cl	BroadT	BRD-A34658965	BRD-A34658965-001-05-4	ChemBridge Corporation	5159196			Clc1ccccc1NC(=S)NC(NC(=O)Cc1cccc2ccccc12)C(Cl)(Cl)Cl	InChI=1S/C21H17Cl4N3OS/c22-16-10-3-4-11-17(16)26-20(30)28-19(21(23,24)25)27-18(29)12-14-8-5-7-13-6-1-2-9-15(13)14/h1-11,19H,12H2,(H,27,29)(H2,26,28,30)	BPKBLWFZGRSWLR-UHFFFAOYSA-N	498.984643724							121240
SMR000284280	LSM-32684	SID24806115, BRD-A43068973	3175037	InChI=1S/C27H30N6O6/c1-18-7-12-23(39-18)26-29-31-33(30-26)17-24(34)32(16-19-8-10-20(36-2)11-9-19)25(22-6-4-14-38-22)27(35)28-15-21-5-3-13-37-21/h4,6-12,14,21,25H,3,5,13,15-17H2,1-2H3,(H,28,35)	NDOUIQQYMGEAJA-UHFFFAOYSA-N	COc1ccc(CN(C(C(=O)NCC2CCCO2)c3occc3)C(=O)Cn4nnc(n4)c5oc(C)cc5)cc1	BroadT	BRD-A43068973	BRD-A43068973-001-05-5	Asinex Ltd.	ASN 03653918			COc1ccc(CN(C(C(=O)NCC2CCCO2)c2ccco2)C(=O)Cn2nnc(n2)-c2ccc(C)o2)cc1	InChI=1S/C27H30N6O6/c1-18-7-12-23(39-18)26-29-31-33(30-26)17-24(34)32(16-19-8-10-20(36-2)11-9-19)25(22-6-4-14-38-22)27(35)28-15-21-5-3-13-37-21/h4,6-12,14,21,25H,3,5,13,15-17H2,1-2H3,(H,28,35)	NDOUIQQYMGEAJA-UHFFFAOYSA-N	534.22268274							121241
T0519-1750	LSM-44423	SID22408231, BRD-K21553266	2478301	InChI=1S/C16H14N2OS/c1-11-3-4-15(12(2)7-11)18-16(19)14(9-17)8-13-5-6-20-10-13/h3-8,10H,1-2H3,(H,18,19)/b14-8+	OKUJXVMEDWECEW-RIYZIHGNSA-N	Cc1ccc(NC(=O)\C(=C\c2ccsc2)\C#N)c(C)c1	BroadT	BRD-K21553266	BRD-K21553266-001-05-6	Enamine Ltd.	T0519-1750			Cc1ccc(NC(=O)C(=C\c2ccsc2)\C#N)c(C)c1	InChI=1S/C16H14N2OS/c1-11-3-4-15(12(2)7-11)18-16(19)14(9-17)8-13-5-6-20-10-13/h3-8,10H,1-2H3,(H,18,19)/b14-8+	OKUJXVMEDWECEW-RIYZIHGNSA-N	282.082683778							
T5219504	LSM-32686	SID22409356, BRD-K21423879	4568767	InChI=1S/C28H35N3O7/c1-6-35-25-16-23(31-10-12-34-13-11-31)26(36-7-2)15-22(25)29-28(32)20-8-9-24(27(14-20)33-5)37-17-21-18(3)30-38-19(21)4/h8-9,14-16H,6-7,10-13,17H2,1-5H3,(H,29,32)	CUYSQSQFXBRMKT-UHFFFAOYSA-N	CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)c3ccc(OCc4c(C)onc4C)c(OC)c3	BroadT	BRD-K21423879	BRD-K21423879-001-05-1	Enamine Ltd.	T5219504			CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)c1ccc(OCc2c(C)noc2C)c(OC)c1	InChI=1S/C28H35N3O7/c1-6-35-25-16-23(31-10-12-34-13-11-31)26(36-7-2)15-22(25)29-28(32)20-8-9-24(27(14-20)33-5)37-17-21-18(3)30-38-19(21)4/h8-9,14-16H,6-7,10-13,17H2,1-5H3,(H,29,32)	CUYSQSQFXBRMKT-UHFFFAOYSA-N	525.24750049							121243
STK592118	LSM-32687	SID864685, BRD-K55881210	665926	InChI=1S/C15H16N4O3S/c1-18-12-11(13(20)17-14(18)21)19(8-9-22-2)15(16-12)23-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,17,20,21)	NOTJZVQLRMNYII-UHFFFAOYSA-N	COCCn1c(Sc2ccccc2)nc3N(C)C(=O)NC(=O)c13	BroadT	BRD-K55881210	BRD-K55881210-001-05-7	InterBioScreen Ltd.	STOCK5S-26814			COCCn1c(Sc2ccccc2)nc2n(C)c(=O)[nH]c(=O)c12	InChI=1S/C15H16N4O3S/c1-18-12-11(13(20)17-14(18)21)19(8-9-22-2)15(16-12)23-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,17,20,21)	NOTJZVQLRMNYII-UHFFFAOYSA-N	332.094311102							121244
ST50853228	LSM-32688	SID24792933, BRD-K35863762	2206292	InChI=1S/C19H23N3O4S/c1-4-26-15-8-5-13(6-9-15)11-18(23)21-22-19(27)20-14-7-10-16(24-2)17(12-14)25-3/h5-10,12H,4,11H2,1-3H3,(H,21,23)(H2,20,22,27)	NXWPTXIEHDNRQT-UHFFFAOYSA-N	CCOc1ccc(CC(=O)NN=C(S)Nc2ccc(OC)c(OC)c2)cc1	BroadT	BRD-K35863762	BRD-K35863762-001-05-2	ChemBridge Corporation	7790933			CCOc1ccc(CC(=O)NN=C(S)Nc2ccc(OC)c(OC)c2)cc1	InChI=1S/C19H23N3O4S/c1-4-26-15-8-5-13(6-9-15)11-18(23)21-22-19(27)20-14-7-10-16(24-2)17(12-14)25-3/h5-10,12H,4,11H2,1-3H3,(H,21,23)(H2,20,22,27)	NXWPTXIEHDNRQT-UHFFFAOYSA-N	389.140926936							121245
SMR000243488	LSM-32689	SID22401722, BRD-K28403392	4057783	InChI=1S/C26H22ClN3O5S/c1-30(2)36(33,34)18-12-13-21(27)24(14-18)29-25(31)16-35-26(32)20-15-23(17-8-4-3-5-9-17)28-22-11-7-6-10-19(20)22/h3-15H,16H2,1-2H3,(H,29,31)	IFTXYVAKRHAAGR-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(Cl)c(NC(=O)COC(=O)c2cc(nc3ccccc23)c4ccccc4)c1	BroadT	BRD-K28403392	BRD-K28403392-001-05-4	Enamine Ltd.	T0509-6543			CN(C)S(=O)(=O)c1ccc(Cl)c(NC(=O)COC(=O)c2cc(nc3ccccc23)-c2ccccc2)c1	InChI=1S/C26H22ClN3O5S/c1-30(2)36(33,34)18-12-13-21(27)24(14-18)29-25(31)16-35-26(32)20-15-23(17-8-4-3-5-9-17)28-22-11-7-6-10-19(20)22/h3-15H,16H2,1-2H3,(H,29,31)	IFTXYVAKRHAAGR-UHFFFAOYSA-N	523.096869234							121246
SMR000047731	LSM-32690	SID865193, BRD-K69790296	666443	InChI=1S/C21H20N2O5/c1-11-5-7-14(12(2)9-11)23-20(24)17-18(22-28-19(17)21(23)25)13-6-8-15(26-3)16(10-13)27-4/h5-10,17,19H,1-4H3/t17-,19+/m1/s1	MNLFDKMPGGSOKV-MJGOQNOKSA-N	COc1ccc(cc1OC)C2=NO[C@H]3[C@@H]2C(=O)N(C3=O)c4ccc(C)cc4C	BroadT	BRD-K69790296	BRD-K69790296-001-05-1	InterBioScreen Ltd.	STOCK5S-38425			COc1ccc(cc1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(C)cc1C	InChI=1S/C21H20N2O5/c1-11-5-7-14(12(2)9-11)23-20(24)17-18(22-28-19(17)21(23)25)13-6-8-15(26-3)16(10-13)27-4/h5-10,17,19H,1-4H3/t17-,19+/m1/s1	MNLFDKMPGGSOKV-MJGOQNOKSA-N	380.13722176							121247
4,7-Dimethoxy-1-indanone	LSM-32691	SID857947, BRD-K32473712	606012	InChI=1S/C11H12O3/c1-13-9-5-6-10(14-2)11-7(9)3-4-8(11)12/h5-6H,3-4H2,1-2H3	MSGQVFMAKBIPNF-UHFFFAOYSA-N	COc1ccc(OC)c2C(=O)CCc12	BroadT	BRD-K32473712	BRD-K32473712-001-05-4	InterBioScreen Ltd.	STOCK2S-09841			COc1ccc(OC)c2C(=O)CCc12	InChI=1S/C11H12O3/c1-13-9-5-6-10(14-2)11-7(9)3-4-8(11)12/h5-6H,3-4H2,1-2H3	MSGQVFMAKBIPNF-UHFFFAOYSA-N	192.078644244							121248
MLS001237988	LSM-32692	SID51087680, BRD-K13471912	24892243	InChI=1S/C17H14BrN5O4S2/c1-9(24)19-10-2-4-11(5-3-10)20-14(25)8-28-17-23-22-16(29-17)21-15(26)12-6-7-13(18)27-12/h2-7H,8H2,1H3,(H,19,24)(H,20,25)(H,21,22,26)	JGTZKOADSIAIBS-UHFFFAOYSA-N	CC(=O)Nc1ccc(NC(=O)CSc2nnc(NC(=O)c3oc(Br)cc3)s2)cc1	BroadT	BRD-K13471912	BRD-K13471912-001-06-7	Life Chemicals Inc.	F1838-1084			CC(=O)Nc1ccc(NC(=O)CSc2nnc(NC(=O)c3ccc(Br)o3)s2)cc1	InChI=1S/C17H14BrN5O4S2/c1-9(24)19-10-2-4-11(5-3-10)20-14(25)8-28-17-23-22-16(29-17)21-15(26)12-6-7-13(18)27-12/h2-7H,8H2,1H3,(H,19,24)(H,20,25)(H,21,22,26)	JGTZKOADSIAIBS-UHFFFAOYSA-N	494.967057958							121249
ZINC00452302	LSM-32693	SID47198764, BRD-K98660682	881507	InChI=1S/C17H19NOS/c1-13-7-9-16(10-8-13)20-12-17(19)18-11-15-6-4-3-5-14(15)2/h3-10H,11-12H2,1-2H3,(H,18,19)	YDXTWXRSXSNCPW-UHFFFAOYSA-N	Cc1ccc(SCC(=O)NCc2ccccc2C)cc1	BroadT	BRD-K98660682	BRD-K98660682-001-05-3	ChemBridge Corporation	6397215			Cc1ccc(SCC(=O)NCc2ccccc2C)cc1	InChI=1S/C17H19NOS/c1-13-7-9-16(10-8-13)20-12-17(19)18-11-15-6-4-3-5-14(15)2/h3-10H,11-12H2,1-2H3,(H,18,19)	YDXTWXRSXSNCPW-UHFFFAOYSA-N	285.118734928							121250
SMR000154586	LSM-32694	SID14746615, BRD-A43050491	3313091	InChI=1S/C27H28N2O4/c1-3-32-27(31)21-17(2)33-26-20-12-6-5-11-19(20)25(30)23(22(21)26)24(18-10-9-13-28-16-18)29-14-7-4-8-15-29/h5-6,9-13,16,24,30H,3-4,7-8,14-15H2,1-2H3	IAQKXFGPYLIQMT-UHFFFAOYSA-N	CCOC(=O)c1c(C)oc2c3ccccc3c(O)c(C(N4CCCCC4)c5cccnc5)c12	BroadT	BRD-A43050491	BRD-A43050491-001-05-6	Enamine Ltd.	T0509-3969			CCOC(=O)c1c(C)oc2c1c(C(N1CCCCC1)c1cccnc1)c(O)c1ccccc21	InChI=1S/C27H28N2O4/c1-3-32-27(31)21-17(2)33-26-20-12-6-5-11-19(20)25(30)23(22(21)26)24(18-10-9-13-28-16-18)29-14-7-4-8-15-29/h5-6,9-13,16,24,30H,3-4,7-8,14-15H2,1-2H3	IAQKXFGPYLIQMT-UHFFFAOYSA-N	444.204907396							121251
SMR000004489	LSM-32695	SID26668602, SID852839, BRD-A85152084	655486	InChI=1S/C25H31N7O2S/c1-5-25(2,3)32-23(27-28-29-32)22(17-10-11-19(33)20(16-17)34-4)30-12-14-31(15-13-30)24-26-18-8-6-7-9-21(18)35-24/h6-11,16,22,33H,5,12-15H2,1-4H3	LLTDQJRCIJWYTM-UHFFFAOYSA-N	CCC(C)(C)n1nnnc1C(N2CCN(CC2)c3nc4ccccc4s3)c5ccc(O)c(OC)c5	BroadT	BRD-A85152084	BRD-A85152084-001-06-0	Asinex Ltd.	ASN 05346594			CCC(C)(C)n1nnnc1C(N1CCN(CC1)c1nc2ccccc2s1)c1ccc(O)c(OC)c1	InChI=1S/C25H31N7O2S/c1-5-25(2,3)32-23(27-28-29-32)22(17-10-11-19(33)20(16-17)34-4)30-12-14-31(15-13-30)24-26-18-8-6-7-9-21(18)35-24/h6-11,16,22,33H,5,12-15H2,1-4H3	LLTDQJRCIJWYTM-UHFFFAOYSA-N	493.225993992							121252
BDBM66212	LSM-32696	BRD-A38040920	91897637	InChI=1S/C22H16N2O6S/c1-11-9-16(23-30-11)24-18(15-7-4-8-31-15)17(20(26)22(24)27)19(25)14-10-12-5-3-6-13(28-2)21(12)29-14/h3-10,17-18H,1-2H3	GYMZMDRBPDXOMY-UHFFFAOYSA-N	COc1cccc2cc(oc12)C(=O)C3C(N(C(=O)C3=O)c4cc(C)on4)c5cccs5	BroadT	BRD-A38040920	BRD-A38040920-001-06-3	ChemBridge Corporation	7917589			COc1cccc2cc(oc12)C(=O)C1C(N(c2cc(C)on2)C(=O)C1=O)c1cccs1	InChI=1S/C22H16N2O6S/c1-11-9-16(23-30-11)24-18(15-7-4-8-31-15)17(20(26)22(24)27)19(25)14-10-12-5-3-6-13(28-2)21(12)29-14/h3-10,17-18H,1-2H3	GYMZMDRBPDXOMY-UHFFFAOYSA-N	436.072906942							121253
SMR000236966	LSM-32697	SID17515054, BRD-K87431402	1034452	InChI=1S/C19H13FN2O4S/c20-13-8-10-15(11-9-13)27(23,24)19-18(21-14-5-2-1-3-6-14)26-17(22-19)16-7-4-12-25-16/h1-12,21H	BMWWIGCYWLGGJJ-UHFFFAOYSA-N	Fc1ccc(cc1)S(=O)(=O)c2nc(oc2Nc3ccccc3)c4occc4	BroadT	BRD-K87431402	BRD-K87431402-001-06-9	Life Chemicals Inc.	F1790-0039			Fc1ccc(cc1)S(=O)(=O)c1nc(oc1Nc1ccccc1)-c1ccco1	InChI=1S/C19H13FN2O4S/c20-13-8-10-15(11-9-13)27(23,24)19-18(21-14-5-2-1-3-6-14)26-17(22-19)16-7-4-12-25-16/h1-12,21H	BMWWIGCYWLGGJJ-UHFFFAOYSA-N	384.058005806							121254
SMR000253677	LSM-32698	SID17516160, BRD-K33837857	4376343	InChI=1S/C19H15N3O4S/c23-18(13-26-16-10-6-12-20-19(16)22(24)25)21-15-9-4-5-11-17(15)27-14-7-2-1-3-8-14/h1-12H,13H2,(H,21,23)	BXRLXYZTIQWMED-UHFFFAOYSA-N	[O-][N+](=O)c1ncccc1OCC(=O)Nc2ccccc2Sc3ccccc3	BroadT	BRD-K33837857	BRD-K33837857-001-05-4	Enamine Ltd.	T5252719			[O-][N+](=O)c1ncccc1OCC(=O)Nc1ccccc1Sc1ccccc1	InChI=1S/C19H15N3O4S/c23-18(13-26-16-10-6-12-20-19(16)22(24)25)21-15-9-4-5-11-17(15)27-14-7-2-1-3-8-14/h1-12H,13H2,(H,21,23)	BXRLXYZTIQWMED-UHFFFAOYSA-N	381.07832668							121255
AC1MDLUJ	LSM-32699	SID7972420, BRD-A34208953	2839017	InChI=1S/C20H22N2O5/c1-10-5-13(23)19-17(6-10)27-20(22)12(9-21)18(19)11-7-15(25-3)16(26-4)8-14(11)24-2/h7-8,10,18H,5-6,22H2,1-4H3	SQVQEPYBUYDLRQ-UHFFFAOYSA-N	COc1cc(OC)c(cc1OC)C2C(=C(N)OC3=C2C(=O)CC(C)C3)C#N	BroadT	BRD-A34208953	BRD-A34208953-001-06-0	ChemBridge Corporation	5276412			COc1cc(OC)c(cc1OC)C1C(C#N)=C(N)OC2=C1C(=O)CC(C)C2	InChI=1S/C20H22N2O5/c1-10-5-13(23)19-17(6-10)27-20(22)12(9-21)18(19)11-7-15(25-3)16(26-4)8-14(11)24-2/h7-8,10,18H,5-6,22H2,1-4H3	SQVQEPYBUYDLRQ-UHFFFAOYSA-N	370.152871824							121256
MLS000544434	LSM-32700	SID110722957, SID17407198, BRD-K39266851	997451	InChI=1S/C26H24BrN3O2/c1-18-15-19(2)30(29-18)16-20-9-13-23(14-10-20)28-26(31)22-11-7-21(8-12-22)17-32-25-6-4-3-5-24(25)27/h3-15H,16-17H2,1-2H3,(H,28,31)	LSIJVGVQXDFLSS-UHFFFAOYSA-N	Cc1cc(C)n(Cc2ccc(NC(=O)c3ccc(COc4ccccc4Br)cc3)cc2)n1	BroadT	BRD-K39266851	BRD-K39266851-001-10-6	Specs	AK-968/41171773			Cc1cc(C)n(Cc2ccc(NC(=O)c3ccc(COc4ccccc4Br)cc3)cc2)n1	InChI=1S/C26H24BrN3O2/c1-18-15-19(2)30(29-18)16-20-9-13-23(14-10-20)28-26(31)22-11-7-21(8-12-22)17-32-25-6-4-3-5-24(25)27/h3-15H,16-17H2,1-2H3,(H,28,31)	LSIJVGVQXDFLSS-UHFFFAOYSA-N	489.105189638							121257
AH-487/41656303	LSM-44424	SID17387136, BRD-A60726227	11837008	InChI=1S/C17H22N2O4S/c1-9(2)18-10(3)7-13(11(18)4)8-14-15(20)19(17(22)24-14)12(5)16(21)23-6/h7-9,12H,1-6H3/b14-8+	RAFUWYVVLMWDPD-RIYZIHGNSA-N	COC(=O)C(C)N1C(=O)S\C(=C\c2cc(C)n(C(C)C)c2C)\C1=O	BroadT	BRD-A60726227	BRD-A60726227-001-05-0	Specs	AH-487/41656303			COC(=O)C(C)N1C(=O)S\C(=C\c2cc(C)n(C(C)C)c2C)C1=O	InChI=1S/C17H22N2O4S/c1-9(2)18-10(3)7-13(11(18)4)8-14-15(20)19(17(22)24-14)12(5)16(21)23-6/h7-9,12H,1-6H3/b14-8+	RAFUWYVVLMWDPD-RIYZIHGNSA-N	350.130027894							
T5288366	LSM-32702	SID22405270, BRD-K34703863	2499398	InChI=1S/C19H22N4O3S2/c1-14-3-4-15(2)17(11-14)28(25,26)23-8-6-22(7-9-23)13-18(24)21-19-16(12-20)5-10-27-19/h3-5,10-11H,6-9,13H2,1-2H3,(H,21,24)	LKSOXZFPPRSRAO-UHFFFAOYSA-N	Cc1ccc(C)c(c1)S(=O)(=O)N2CCN(CC(=O)Nc3sccc3C#N)CC2	BroadT	BRD-K34703863	BRD-K34703863-001-05-9	Enamine Ltd.	T5288366			Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC(=O)Nc2sccc2C#N)CC1	InChI=1S/C19H22N4O3S2/c1-14-3-4-15(2)17(11-14)28(25,26)23-8-6-22(7-9-23)13-18(24)21-19-16(12-20)5-10-27-19/h3-5,10-11H,6-9,13H2,1-2H3,(H,21,24)	LKSOXZFPPRSRAO-UHFFFAOYSA-N	418.113331984							121259
MLS000710291	LSM-32703	SID24806756, BRD-K07863795	785022	InChI=1S/C17H14N2OS/c1-12-18-16(11-21-12)13-7-9-15(10-8-13)19-17(20)14-5-3-2-4-6-14/h2-11H,1H3,(H,19,20)	JNGXZFTYKGXDPW-UHFFFAOYSA-N	Cc1nc(cs1)c2ccc(NC(=O)c3ccccc3)cc2	BroadT	BRD-K07863795	BRD-K07863795-001-05-7	Asinex Ltd.	BAS 00852568			Cc1nc(cs1)-c1ccc(NC(=O)c2ccccc2)cc1	InChI=1S/C17H14N2OS/c1-12-18-16(11-21-12)13-7-9-15(10-8-13)19-17(20)14-5-3-2-4-6-14/h2-11H,1H3,(H,19,20)	JNGXZFTYKGXDPW-UHFFFAOYSA-N	294.082683778							121260
SMR000147477	LSM-32704	SID14741795, BRD-K63844731	3696592	InChI=1S/C16H14BrClN4O4/c1-20-13-12(14(24)22(16(20)25)8-11(23)26-2)21(15(17)19-13)7-9-5-3-4-6-10(9)18/h3-6H,7-8H2,1-2H3	XXGAOTSQBKOYBL-UHFFFAOYSA-N	COC(=O)CN1C(=O)N(C)c2nc(Br)n(Cc3ccccc3Cl)c2C1=O	BroadT	BRD-K63844731	BRD-K63844731-001-05-5	InterBioScreen Ltd.	STOCK1S-33973			COC(=O)Cn1c(=O)n(C)c2nc(Br)n(Cc3ccccc3Cl)c2c1=O	InChI=1S/C16H14BrClN4O4/c1-20-13-12(14(24)22(16(20)25)8-11(23)26-2)21(15(17)19-13)7-9-5-3-4-6-10(9)18/h3-6H,7-8H2,1-2H3	XXGAOTSQBKOYBL-UHFFFAOYSA-N	439.988695278							121261
F1838-2353	LSM-32705	SID51087098, BRD-K25604742	24892189	InChI=1S/C20H19N5O4S2/c1-12(26)21-14-6-8-15(9-7-14)22-17(27)11-30-20-25-24-19(31-20)23-18(28)13-4-3-5-16(10-13)29-2/h3-10H,11H2,1-2H3,(H,21,26)(H,22,27)(H,23,24,28)	SAMBBLSMANKAFN-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Nc2nnc(SCC(=O)Nc3ccc(NC(=O)C)cc3)s2	BroadT	BRD-K25604742	BRD-K25604742-001-05-7	Life Chemicals Inc.	F1838-2353			COc1cccc(c1)C(=O)Nc1nnc(SCC(=O)Nc2ccc(NC(C)=O)cc2)s1	InChI=1S/C20H19N5O4S2/c1-12(26)21-14-6-8-15(9-7-14)22-17(27)11-30-20-25-24-19(31-20)23-18(28)13-4-3-5-16(10-13)29-2/h3-10H,11H2,1-2H3,(H,21,26)(H,22,27)(H,23,24,28)	SAMBBLSMANKAFN-UHFFFAOYSA-N	457.087845518							121262
MLS000105390	LSM-32706	SID7975806, BRD-K21590915	632765	InChI=1S/C22H27NO4/c1-21(2)8-14(24)19(15(25)9-21)18(13-6-5-7-23-12-13)20-16(26)10-22(3,4)11-17(20)27/h5-7,12,18-20H,8-11H2,1-4H3	ZPDTUZGUAQLSTI-UHFFFAOYSA-N	CC1(C)CC(=O)C(C(C2C(=O)CC(C)(C)CC2=O)c3cccnc3)C(=O)C1	BroadT	BRD-K21590915	BRD-K21590915-001-11-1	ChemBridge Corporation	5269338			CC1(C)CC(=O)C(C(C2C(=O)CC(C)(C)CC2=O)c2cccnc2)C(=O)C1	InChI=1S/C22H27NO4/c1-21(2)8-14(24)19(15(25)9-21)18(13-6-5-7-23-12-13)20-16(26)10-22(3,4)11-17(20)27/h5-7,12,18-20H,8-11H2,1-4H3	ZPDTUZGUAQLSTI-UHFFFAOYSA-N	369.194008354							121263
MLS000912604	LSM-32707	SID49730561, BRD-K76356713	5301257	InChI=1S/C14H15N3O3/c1-9-11(8-15-17(9)2)14(18)16-10-3-4-12-13(7-10)20-6-5-19-12/h3-4,7-8H,5-6H2,1-2H3,(H,16,18)	CNFJQRYOZISEMO-UHFFFAOYSA-N	Cc1c(cnn1C)C(=O)Nc2ccc3OCCOc3c2	BroadT	BRD-K76356713	BRD-K76356713-001-06-5	ChemDiv Inc.	8017-7867			Cc1c(cnn1C)C(=O)Nc1ccc2OCCOc2c1	InChI=1S/C14H15N3O3/c1-9-11(8-15-17(9)2)14(18)16-10-3-4-12-13(7-10)20-6-5-19-12/h3-4,7-8H,5-6H2,1-2H3,(H,16,18)	CNFJQRYOZISEMO-UHFFFAOYSA-N	273.11134137							121264
SMR000031984	LSM-32708	SID4245988, BRD-K41960493	3240387	InChI=1S/C18H17N3O3S/c1-12(2)24-18(23)14-6-5-8-19-17(14)25-11-13-10-16(22)21-9-4-3-7-15(21)20-13/h3-10,12H,11H2,1-2H3	UOTNPZBZBVJXSL-UHFFFAOYSA-N	CC(C)OC(=O)c1cccnc1SCC2=CC(=O)N3C=CC=CC3=N2	BroadT	BRD-K41960493	BRD-K41960493-001-06-2	ChemDiv Inc.	K786-3101			CC(C)OC(=O)c1cccnc1SCc1cc(=O)n2ccccc2n1	InChI=1S/C18H17N3O3S/c1-12(2)24-18(23)14-6-5-8-19-17(14)25-11-13-10-16(22)21-9-4-3-7-15(21)20-13/h3-10,12H,11H2,1-2H3	UOTNPZBZBVJXSL-UHFFFAOYSA-N	355.099062124							121265
1-(2-Fluoro-5-nitrophenyl)-3-phenylurea	LSM-32709	SID22416816, BRD-K05565683	832988	InChI=1S/C13H10FN3O3/c14-11-7-6-10(17(19)20)8-12(11)16-13(18)15-9-4-2-1-3-5-9/h1-8H,(H2,15,16,18)	VCRWTSUAWNVEPD-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(F)c(NC(=O)Nc2ccccc2)c1	BroadT	BRD-K05565683	BRD-K05565683-001-05-5	ChemBridge Corporation	6272638			[O-][N+](=O)c1ccc(F)c(NC(=O)Nc2ccccc2)c1	InChI=1S/C13H10FN3O3/c14-11-7-6-10(17(19)20)8-12(11)16-13(18)15-9-4-2-1-3-5-9/h1-8H,(H2,15,16,18)	VCRWTSUAWNVEPD-UHFFFAOYSA-N	275.07061941							121266
AC1LODYP	LSM-32710	BRD-K14536672	1219035	InChI=1S/C20H14N2O6/c23-19(14-6-7-16-18(10-14)27-12-26-16)22-21-11-13-3-1-4-15(9-13)28-20(24)17-5-2-8-25-17/h1-11H,12H2,(H,22,23)	GNYOHTYZOUTCQW-UHFFFAOYSA-N	O=C(NN=Cc1cccc(OC(=O)c2occc2)c1)c3ccc4OCOc4c3	BroadT	BRD-K14536672	BRD-K14536672-001-05-8	Specs	AK-968/11163047			O=C(Oc1cccc(C=NNC(=O)c2ccc3OCOc3c2)c1)c1ccco1	InChI=1S/C20H14N2O6/c23-19(14-6-7-16-18(10-14)27-12-26-16)22-21-11-13-3-1-4-15(9-13)28-20(24)17-5-2-8-25-17/h1-11H,12H2,(H,22,23)	GNYOHTYZOUTCQW-UHFFFAOYSA-N	378.085186188							121267
BRD-A19996352	LSM-32711			InChI=1S/C22H16BrN3O3/c23-16-8-6-15(7-9-16)20(27)18-19(17-5-1-2-11-25-17)26(22(29)21(18)28)13-14-4-3-10-24-12-14/h1-12,18-19H,13H2	XSVYBECTJDRUKP-UHFFFAOYSA-N	Brc1ccc(cc1)C(=O)C2C(N(Cc3cccnc3)C(=O)C2=O)c4ccccn4	BroadT	BRD-A19996352	BRD-A19996352-001-05-8	InterBioScreen Ltd.	STOCK3S-80043			Brc1ccc(cc1)C(=O)C1C(N(Cc2cccnc2)C(=O)C1=O)c1ccccn1	InChI=1S/C22H16BrN3O3/c23-16-8-6-15(7-9-16)20(27)18-19(17-5-1-2-11-25-17)26(22(29)21(18)28)13-14-4-3-10-24-12-14/h1-12,18-19H,13H2	XSVYBECTJDRUKP-UHFFFAOYSA-N	449.037504002							121268
SMR000054599	LSM-32712	SID7972089, BRD-K34529943	54703727	InChI=1S/C21H23N3O3/c1-2-3-8-13-24-17-11-5-4-10-16(17)19(25)18(21(24)27)20(26)23-14-15-9-6-7-12-22-15/h4-7,9-12,25H,2-3,8,13-14H2,1H3,(H,23,26)	LERMIPDQTUVJBE-UHFFFAOYSA-N	CCCCCN1C(=O)C(=C(O)c2ccccc12)C(=O)NCc3ccccn3	BroadT	BRD-K34529943	BRD-K34529943-001-05-2	ChemBridge Corporation	5238894			CCCCCn1c2ccccc2c(O)c(C(=O)NCc2ccccn2)c1=O	InChI=1S/C21H23N3O3/c1-2-3-8-13-24-17-11-5-4-10-16(17)19(25)18(21(24)27)20(26)23-14-15-9-6-7-12-22-15/h4-7,9-12,25H,2-3,8,13-14H2,1H3,(H,23,26)	LERMIPDQTUVJBE-UHFFFAOYSA-N	365.173941626							121269
MLS000335128	LSM-32713	SID22406383, BRD-K47782432	15945138	InChI=1S/C21H24ClN3O2S/c1-21(2,27-15-10-8-14(22)9-11-15)20(26)25-18(12-13-28-3)19-23-16-6-4-5-7-17(16)24-19/h4-11,18H,12-13H2,1-3H3,(H,23,24)(H,25,26)/t18-/m0/s1	PDHKEIHUWAHPJN-SFHVURJKSA-N	CSCC[C@H](NC(=O)C(C)(C)Oc1ccc(Cl)cc1)c2nc3ccccc3[nH]2	BroadT	BRD-K47782432	BRD-K47782432-001-05-0	Enamine Ltd.	T5272760			CSCC[C@H](NC(=O)C(C)(C)Oc1ccc(Cl)cc1)c1nc2ccccc2[nH]1	InChI=1S/C21H24ClN3O2S/c1-21(2,27-15-10-8-14(22)9-11-15)20(26)25-18(12-13-28-3)19-23-16-6-4-5-7-17(16)24-19/h4-11,18H,12-13H2,1-3H3,(H,23,24)(H,25,26)/t18-/m0/s1	PDHKEIHUWAHPJN-SFHVURJKSA-N	417.127775438							121270
MLS000723855	LSM-32714	SID24782870, BRD-K55912807	16001809	InChI=1S/C20H22N4O3/c25-23-16-9-10-17(24(26)27)18(21-14-11-15-7-3-1-4-8-15)19(16)22-20(23)12-5-2-6-13-20/h1,3-4,7-10,21H,2,5-6,11-14H2	DLICXRANLDJSBY-UHFFFAOYSA-N	[O-][N+](=O)C1=C(NCCc2ccccc2)C3=NC4(CCCCC4)[N+](=C3C=C1)[O-]	BroadT	BRD-K55912807	BRD-K55912807-001-04-2	ChemDiv Inc.	3454-1880			[O-][N+](=O)c1ccc2=[N+]([O-])C3(CCCCC3)N=c2c1NCCc1ccccc1	InChI=1S/C20H22N4O3/c25-23-16-9-10-17(24(26)27)18(21-14-11-15-7-3-1-4-8-15)19(16)22-20(23)12-5-2-6-13-20/h1,3-4,7-10,21H,2,5-6,11-14H2	DLICXRANLDJSBY-UHFFFAOYSA-N	366.169190604							
STK252091	LSM-32715	SID17414171, BRD-K11576561	2949983	InChI=1S/C21H23N5O4S/c1-2-19(27)25-12-10-24(11-13-25)17-8-6-16(7-9-17)22-21(31)23-20(28)15-4-3-5-18(14-15)26(29)30/h3-9,14H,2,10-13H2,1H3,(H2,22,23,28,31)	FTWPVBNVPVUADK-UHFFFAOYSA-N	CCC(=O)N1CCN(CC1)c2ccc(NC(=S)NC(=O)c3cccc(c3)[N+](=O)[O-])cc2	BroadT	BRD-K11576561	BRD-K11576561-001-05-1	ChemBridge Corporation	7725650			CCC(=O)N1CCN(CC1)c1ccc(NC(=S)NC(=O)c2cccc(c2)[N+]([O-])=O)cc1	InChI=1S/C21H23N5O4S/c1-2-19(27)25-12-10-24(11-13-25)17-8-6-16(7-9-17)22-21(31)23-20(28)15-4-3-5-18(14-15)26(29)30/h3-9,14H,2,10-13H2,1H3,(H2,22,23,28,31)	FTWPVBNVPVUADK-UHFFFAOYSA-N	441.147074956							121272
ST51032174	LSM-32716	SID4257906, BRD-K36686281	951577	InChI=1S/C17H24N2O3S/c1-19(23(2,21)22)16-10-8-15(9-11-16)17(20)18-13-12-14-6-4-3-5-7-14/h6,8-11H,3-5,7,12-13H2,1-2H3,(H,18,20)	IPJNOVSANLGMHE-UHFFFAOYSA-N	CN(c1ccc(cc1)C(=O)NCCC2=CCCCC2)S(=O)(=O)C	BroadT	BRD-K36686281	BRD-K36686281-001-05-8	ChemBridge Corporation	7687591			CN(c1ccc(cc1)C(=O)NCCC1=CCCCC1)S(C)(=O)=O	InChI=1S/C17H24N2O3S/c1-19(23(2,21)22)16-10-8-15(9-11-16)17(20)18-13-12-14-6-4-3-5-7-14/h6,8-11H,3-5,7,12-13H2,1-2H3,(H,18,20)	IPJNOVSANLGMHE-UHFFFAOYSA-N	336.150763338							121273
BRD-A69730462	LSM-32717			InChI=1S/C22H23N3O5/c1-24(2)9-10-25-19(15-5-3-4-8-23-15)18(21(27)22(25)28)20(26)14-6-7-16-17(13-14)30-12-11-29-16/h3-8,13,18-19H,9-12H2,1-2H3	CULRBVJGSSAXKJ-UHFFFAOYSA-N	CN(C)CCN1C(C(C(=O)c2ccc3OCCOc3c2)C(=O)C1=O)c4ccccn4	BroadT	BRD-A69730462	BRD-A69730462-001-05-7	InterBioScreen Ltd.	STOCK3S-75599			CN(C)CCN1C(C(C(=O)c2ccc3OCCOc3c2)C(=O)C1=O)c1ccccn1	InChI=1S/C22H23N3O5/c1-24(2)9-10-25-19(15-5-3-4-8-23-15)18(21(27)22(25)28)20(26)14-6-7-16-17(13-14)30-12-11-29-16/h3-8,13,18-19H,9-12H2,1-2H3	CULRBVJGSSAXKJ-UHFFFAOYSA-N	409.163770866							121274
2-Phenyl-4-(3-aminophenyl)-6-(4-aminophenyl)pyrimidine	LSM-32718	SID17432293, BRD-K58688142	630816	InChI=1S/C22H18N4/c23-18-11-9-15(10-12-18)20-14-21(17-7-4-8-19(24)13-17)26-22(25-20)16-5-2-1-3-6-16/h1-14H,23-24H2	NJUJQCABARCLKL-UHFFFAOYSA-N	Nc1ccc(cc1)c2cc(nc(n2)c3ccccc3)c4cccc(N)c4	BroadT	BRD-K58688142	BRD-K58688142-001-05-6	ChemBridge Corporation	7357248			Nc1ccc(cc1)-c1cc(nc(n1)-c1ccccc1)-c1cccc(N)c1	InChI=1S/C22H18N4/c23-18-11-9-15(10-12-18)20-14-21(17-7-4-8-19(24)13-17)26-22(25-20)16-5-2-1-3-6-16/h1-14H,23-24H2	NJUJQCABARCLKL-UHFFFAOYSA-N	338.153146616							121275
(3,5-Dichlorophenyl){4-[2-(trifluoromethyl)quinolin-4-yl]piperazino}methanone	LSM-32719	SID26729426, BRD-K00732328	2809481	InChI=1S/C21H16Cl2F3N3O/c22-14-9-13(10-15(23)11-14)20(30)29-7-5-28(6-8-29)18-12-19(21(24,25)26)27-17-4-2-1-3-16(17)18/h1-4,9-12H,5-8H2	LUUOWXXADLJYNT-UHFFFAOYSA-N	FC(F)(F)c1cc(N2CCN(CC2)C(=O)c3cc(Cl)cc(Cl)c3)c4ccccc4n1	BroadT	BRD-K00732328	BRD-K00732328-001-05-7	Maybridge	HTS 00110			FC(F)(F)c1cc(N2CCN(CC2)C(=O)c2cc(Cl)cc(Cl)c2)c2ccccc2n1	InChI=1S/C21H16Cl2F3N3O/c22-14-9-13(10-15(23)11-14)20(30)29-7-5-28(6-8-29)18-12-19(21(24,25)26)27-17-4-2-1-3-16(17)18/h1-4,9-12H,5-8H2	LUUOWXXADLJYNT-UHFFFAOYSA-N	453.062252182							121276
BAS 08184618	LSM-32720	SID845974, BRD-K82815045	648342	InChI=1S/C21H26N2O5S/c1-27-18-8-9-19(28-2)20(14-18)29(25,26)23-12-10-17(11-13-23)21(24)22-15-16-6-4-3-5-7-16/h3-9,14,17H,10-13,15H2,1-2H3,(H,22,24)	CNBICDBLEIWBIO-UHFFFAOYSA-N	COc1ccc(OC)c(c1)S(=O)(=O)N2CCC(CC2)C(=O)NCc3ccccc3	BroadT	BRD-K82815045	BRD-K82815045-001-05-3	Asinex Ltd.	BAS 08184618			COc1ccc(OC)c(c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccccc1	InChI=1S/C21H26N2O5S/c1-27-18-8-9-19(28-2)20(14-18)29(25,26)23-12-10-17(11-13-23)21(24)22-15-16-6-4-3-5-7-16/h3-9,14,17H,10-13,15H2,1-2H3,(H,22,24)	CNBICDBLEIWBIO-UHFFFAOYSA-N	418.156242642							121277
AC1MD2R5	LSM-32721	BRD-K52093114	2804821	InChI=1S/C18H24N4O3/c1-12-16(13(2)22(21-12)18(3,4)5)11-19-25-17(23)20-14-7-9-15(24-6)10-8-14/h7-11H,1-6H3,(H,20,23)	YLMACGWFMBYHMC-UHFFFAOYSA-N	COc1ccc(NC(=O)ON=Cc2c(C)nn(c2C)C(C)(C)C)cc1	BroadT	BRD-K52093114	BRD-K52093114-001-05-9	Maybridge	CD 07460			COc1ccc(NC(=O)ON=Cc2c(C)nn(c2C)C(C)(C)C)cc1	InChI=1S/C18H24N4O3/c1-12-16(13(2)22(21-12)18(3,4)5)11-19-25-17(23)20-14-7-9-15(24-6)10-8-14/h7-11H,1-6H3,(H,20,23)	YLMACGWFMBYHMC-UHFFFAOYSA-N	344.184840668							121278
AC1MVF41	LSM-32722	SID17513228, BRD-A89402064	3706839	InChI=1S/C22H21N3O7/c1-12-4-6-13(7-5-12)19(27)24-23-17-11-18(26)25(20(17)28)16-9-14(21(29)31-2)8-15(10-16)22(30)32-3/h4-10,17,23H,11H2,1-3H3,(H,24,27)	MRJUFPTYMKONJH-UHFFFAOYSA-N	COC(=O)c1cc(cc(c1)C(=O)OC)N2C(=O)CC(NNC(=O)c3ccc(C)cc3)C2=O	BroadT	BRD-A89402064	BRD-A89402064-001-05-1	InterBioScreen Ltd.	STOCK4S-05780			COC(=O)c1cc(cc(c1)C(=O)OC)N1C(=O)CC(NNC(=O)c2ccc(C)cc2)C1=O	InChI=1S/C22H21N3O7/c1-12-4-6-13(7-5-12)19(27)24-23-17-11-18(26)25(20(17)28)16-9-14(21(29)31-2)8-15(10-16)22(30)32-3/h4-10,17,23H,11H2,1-3H3,(H,24,27)	MRJUFPTYMKONJH-UHFFFAOYSA-N	439.137950042							121279
AC1M6XOG	LSM-32723	BRD-K37867691	2407457	InChI=1S/C16H12FN3S/c17-14-9-5-4-8-13(14)10-18-20-11-15(19-16(20)21)12-6-2-1-3-7-12/h1-11H,(H,19,21)	XHELTRJXBWYPIM-UHFFFAOYSA-N	Fc1ccccc1C=Nn2cc(nc2S)c3ccccc3	BroadT	BRD-K37867691	BRD-K37867691-001-05-7	Enamine Ltd.	T0517-2856			Fc1ccccc1C=Nn1cc(nc1S)-c1ccccc1	InChI=1S/C16H12FN3S/c17-14-9-5-4-8-13(14)10-18-20-11-15(19-16(20)21)12-6-2-1-3-7-12/h1-11H,(H,19,21)	XHELTRJXBWYPIM-UHFFFAOYSA-N	297.073596304							121280
ZINC00484450	LSM-32724	SID22405411, BRD-K77111636	903991	InChI=1S/C17H16N2O3/c1-11-15(6-3-7-16(11)19(21)22)17(20)18-14-9-8-12-4-2-5-13(12)10-14/h3,6-10H,2,4-5H2,1H3,(H,18,20)	GJBYDVXDPYUIJU-UHFFFAOYSA-N	Cc1c(cccc1[N+](=O)[O-])C(=O)Nc2ccc3CCCc3c2	BroadT	BRD-K77111636	BRD-K77111636-001-05-9	Specs	AK-968/15359093			Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1ccc2CCCc2c1	InChI=1S/C17H16N2O3/c1-11-15(6-3-7-16(11)19(21)22)17(20)18-14-9-8-12-4-2-5-13(12)10-14/h3,6-10H,2,4-5H2,1H3,(H,18,20)	GJBYDVXDPYUIJU-UHFFFAOYSA-N	296.116092392							121281
MLS000071370	LSM-32725	SID856503, BRD-A03909373	657862	InChI=1S/C12H14N2O2S2/c1-3-12(2)4-6-7(5-17-12)18-10-8(6)9(15)13-11(16)14-10/h3-5H2,1-2H3,(H2,13,14,15,16)	JUQCFBFVMLSKFD-UHFFFAOYSA-N	CCC1(C)Cc2c(CS1)sc3NC(=O)NC(=O)c23	BroadT	BRD-A03909373	BRD-A03909373-001-05-4	InterBioScreen Ltd.	STOCK1S-21692			CCC1(C)Cc2c(CS1)sc1[nH]c(=O)[nH]c(=O)c21	InChI=1S/C12H14N2O2S2/c1-3-12(2)4-6-7(5-17-12)18-10-8(6)9(15)13-11(16)14-10/h3-5H2,1-2H3,(H2,13,14,15,16)	JUQCFBFVMLSKFD-UHFFFAOYSA-N	282.049669088							121282
SMR000220400	LSM-32726	SID17505025, BRD-K56911865	2005948	InChI=1S/C18H14N2O4S/c1-23-14-4-2-3-12(10-14)17(22)20-18(25)19-13-6-7-15-11(9-13)5-8-16(21)24-15/h2-10H,1H3,(H2,19,20,22,25)	GUHOUQQXGYIIHZ-UHFFFAOYSA-N	COc1cccc(c1)C(=O)NC(=S)Nc2ccc3OC(=O)C=Cc3c2	BroadT	BRD-K56911865	BRD-K56911865-001-05-9	InterBioScreen Ltd.	STOCK4S-68550			COc1cccc(c1)C(=O)NC(=S)Nc1ccc2oc(=O)ccc2c1	InChI=1S/C18H14N2O4S/c1-23-14-4-2-3-12(10-14)17(22)20-18(25)19-13-6-7-15-11(9-13)5-8-16(21)24-15/h2-10H,1H3,(H2,19,20,22,25)	GUHOUQQXGYIIHZ-UHFFFAOYSA-N	354.067427638							121283
SMR000106340	LSM-32727	SID7977865, BRD-A22834033	2898262	InChI=1S/C20H25NO2/c1-13-11-14-7-5-6-8-15(14)21(13)17(23)20-10-9-19(4,16(22)12-20)18(20,2)3/h5-8,13H,9-12H2,1-4H3	UCCZEJKEPKONPP-UHFFFAOYSA-N	CC1Cc2ccccc2N1C(=O)C34CCC(C)(C(=O)C3)C4(C)C	BroadT	BRD-A22834033	BRD-A22834033-001-06-1	ChemBridge Corporation	6433872			CC1Cc2ccccc2N1C(=O)C12CCC(C)(C(=O)C1)C2(C)C	InChI=1S/C20H25NO2/c1-13-11-14-7-5-6-8-15(14)21(13)17(23)20-10-9-19(4,16(22)12-20)18(20,2)3/h5-8,13H,9-12H2,1-4H3	UCCZEJKEPKONPP-UHFFFAOYSA-N	311.18852905							121284
SMR000186927	LSM-32728	SID17412357, BRD-K45834350	869172	InChI=1S/C18H15N3OS/c1-22-12-6-4-10(5-7-12)13-8-14(11-2-3-11)21-18-16(13)17(20)15(9-19)23-18/h4-8,11H,2-3,20H2,1H3	ARTRGOPQCSIMHO-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(nc3sc(C#N)c(N)c23)C4CC4	BroadT	BRD-K45834350	BRD-K45834350-001-05-9	ChemBridge Corporation	5727060			COc1ccc(cc1)-c1cc(nc2sc(C#N)c(N)c12)C1CC1	InChI=1S/C18H15N3OS/c1-22-12-6-4-10(5-7-12)13-8-14(11-2-3-11)21-18-16(13)17(20)15(9-19)23-18/h4-8,11H,2-3,20H2,1H3	ARTRGOPQCSIMHO-UHFFFAOYSA-N	321.09358282							121285
T5271254	LSM-32729	SID14745236, BRD-K85315926	2102767	InChI=1S/C16H14FN3O3S/c1-9-12-7-13(16(22)23-8-14(21)18-2)24-15(12)20(19-9)11-5-3-10(17)4-6-11/h3-7H,8H2,1-2H3,(H,18,21)	OUFVGLKZVQNJBA-UHFFFAOYSA-N	CNC(=O)COC(=O)c1cc2c(C)nn(c3ccc(F)cc3)c2s1	BroadT	BRD-K85315926	BRD-K85315926-001-05-5	Enamine Ltd.	T5271254			CNC(=O)COC(=O)c1cc2c(C)nn(-c3ccc(F)cc3)c2s1	InChI=1S/C16H14FN3O3S/c1-9-12-7-13(16(22)23-8-14(21)18-2)24-15(12)20(19-9)11-5-3-10(17)4-6-11/h3-7H,8H2,1-2H3,(H,18,21)	OUFVGLKZVQNJBA-UHFFFAOYSA-N	347.073990228							121286
ZINC02377790	LSM-32730	SID26661463, BRD-K17846917	1986934	InChI=1S/C14H12BrN3O5/c1-16-10(7-15)11(13(20)17(2)14(16)21)12(19)8-3-5-9(6-4-8)18(22)23/h3-6H,7H2,1-2H3	XFGQREYQRZZCRB-UHFFFAOYSA-N	CN1C(=O)N(C)C(=C(C(=O)c2ccc(cc2)[N+](=O)[O-])C1=O)CBr	BroadT	BRD-K17846917	BRD-K17846917-001-05-3	InterBioScreen Ltd.	STOCK3S-41129			Cn1c(CBr)c(C(=O)c2ccc(cc2)[N+]([O-])=O)c(=O)n(C)c1=O	InChI=1S/C14H12BrN3O5/c1-16-10(7-15)11(13(20)17(2)14(16)21)12(19)8-3-5-9(6-4-8)18(22)23/h3-6H,7H2,1-2H3	XFGQREYQRZZCRB-UHFFFAOYSA-N	380.996033114							121287
STK175385	LSM-32731	SID17415000, BRD-K36606515	2951717	InChI=1S/C19H18Cl2N6O4S2/c1-24-12-22-23-19(24)32-18-10-13(2-5-17(18)27(28)29)25-6-8-26(9-7-25)33(30,31)14-3-4-15(20)16(21)11-14/h2-5,10-12H,6-9H2,1H3	GAYNZZHEYSWPDJ-UHFFFAOYSA-N	Cn1cnnc1Sc2cc(ccc2[N+](=O)[O-])N3CCN(CC3)S(=O)(=O)c4ccc(Cl)c(Cl)c4	BroadT	BRD-K36606515	BRD-K36606515-001-05-4	ChemBridge Corporation	7747544			Cn1cnnc1Sc1cc(ccc1[N+]([O-])=O)N1CCN(CC1)S(=O)(=O)c1ccc(Cl)c(Cl)c1	InChI=1S/C19H18Cl2N6O4S2/c1-24-12-22-23-19(24)32-18-10-13(2-5-17(18)27(28)29)25-6-8-26(9-7-25)33(30,31)14-3-4-15(20)16(21)11-14/h2-5,10-12H,6-9H2,1H3	GAYNZZHEYSWPDJ-UHFFFAOYSA-N	528.020799916							121288
SMR000074197	LSM-32732	SID4262305, SID7964718, BRD-K86614639	1071919	InChI=1S/C19H16N4O2S/c1-2-23-18(25)13-8-4-6-10-15(13)21-19(23)26-11-16-20-14-9-5-3-7-12(14)17(24)22-16/h3-10H,2,11H2,1H3,(H,20,22,24)	YASNQFJBYHTGIZ-UHFFFAOYSA-N	CCN1C(=Nc2ccccc2C1=O)SCc3nc(O)c4ccccc4n3	BroadT	BRD-K86614639	BRD-K86614639-001-06-6	ChemDiv Inc.	6208-0475			CCn1c(SCc2nc(O)c3ccccc3n2)nc2ccccc2c1=O	InChI=1S/C19H16N4O2S/c1-2-23-18(25)13-8-4-6-10-15(13)21-19(23)26-11-16-20-14-9-5-3-7-12(14)17(24)22-16/h3-10H,2,11H2,1H3,(H,20,22,24)	YASNQFJBYHTGIZ-UHFFFAOYSA-N	364.099396482							121289
ZINC03333630	LSM-32733	SID14745613, BRD-K54506447	2449811	InChI=1S/C13H16N2OS2/c1-8-5-6-9(18-8)11(16)15-12-14-10(7-17-12)13(2,3)4/h5-7H,1-4H3,(H,14,15,16)	DNUUFHXNFRPPDX-UHFFFAOYSA-N	Cc1ccc(s1)C(=O)Nc2nc(cs2)C(C)(C)C	BroadT	BRD-K54506447	BRD-K54506447-001-05-6	Enamine Ltd.	T5309481			Cc1ccc(s1)C(=O)Nc1nc(cs1)C(C)(C)C	InChI=1S/C13H16N2OS2/c1-8-5-6-9(18-8)11(16)15-12-14-10(7-17-12)13(2,3)4/h5-7H,1-4H3,(H,14,15,16)	DNUUFHXNFRPPDX-UHFFFAOYSA-N	280.070404532							121290
ZINC00470142	LSM-32734	SID17506700, BRD-K11667509	893634	InChI=1S/C18H18N2OS/c1-12-6-4-5-7-14(12)11-22-18-19-13(2)16-10-15(21-3)8-9-17(16)20-18/h4-10H,11H2,1-3H3	SAHKCOGMTLERGJ-UHFFFAOYSA-N	COc1ccc2nc(SCc3ccccc3C)nc(C)c2c1	BroadT	BRD-K11667509	BRD-K11667509-001-05-3	ChemBridge Corporation	7587109			COc1ccc2nc(SCc3ccccc3C)nc(C)c2c1	InChI=1S/C18H18N2OS/c1-12-6-4-5-7-14(12)11-22-18-19-13(2)16-10-15(21-3)8-9-17(16)20-18/h4-10H,11H2,1-3H3	SAHKCOGMTLERGJ-UHFFFAOYSA-N	310.113983906							121291
MLS000047753	LSM-43619	BRD-K28997626	754773	InChI=1S/C15H15NO2/c1-17-14-5-3-4-13(15(14)18-2)7-6-12-8-10-16-11-9-12/h3-11H,1-2H3/b7-6+	HEWDNEROQMJEKI-VOTSOKGWSA-N	COc1cccc(\C=C\c2ccncc2)c1OC	BroadT	BRD-K28997626	BRD-K28997626-003-05-9	ChemDiv Inc.	3414-0535		Cl	COc1cccc(\C=C\c2ccncc2)c1OC.Cl	InChI=1S/C15H15NO2.ClH/c1-17-14-5-3-4-13(15(14)18-2)7-6-12-8-10-16-11-9-12;/h3-11H,1-2H3;1H/b7-6+;	GRIFLPWVNPSMPW-UHDJGPCESA-N	241.11027873							, 
N-(3-Imidazo[2,1-b][1,3]thiazol-6-ylphenyl)butanamide	LSM-32735	SID4251452, BRD-K36304698	752439	InChI=1S/C15H15N3OS/c1-2-4-14(19)16-12-6-3-5-11(9-12)13-10-18-7-8-20-15(18)17-13/h3,5-10H,2,4H2,1H3,(H,16,19)	GSAMIDYKOPEHCV-UHFFFAOYSA-N	CCCC(=O)Nc1cccc(c1)c2cn3ccsc3n2	BroadT	BRD-K36304698	BRD-K36304698-001-05-5	ChemDiv Inc.	5938-0032			CCCC(=O)Nc1cccc(c1)-c1cn2ccsc2n1	InChI=1S/C15H15N3OS/c1-2-4-14(19)16-12-6-3-5-11(9-12)13-10-18-7-8-20-15(18)17-13/h3,5-10H,2,4H2,1H3,(H,16,19)	GSAMIDYKOPEHCV-UHFFFAOYSA-N	285.09358282							121292
SMR000171176	LSM-32736	SID17508095, BRD-K28134384	1447964	InChI=1S/C21H15ClFN3O2/c1-2-17-19(12-3-6-15(23)7-4-12)21-24-10-13(11-26(21)25-17)20(28)16-9-14(22)5-8-18(16)27/h3-11,27H,2H2,1H3	BQLKZWVQCRRRHM-UHFFFAOYSA-N	CCc1nn2cc(cnc2c1c3ccc(F)cc3)C(=O)c4cc(Cl)ccc4O	BroadT	BRD-K28134384	BRD-K28134384-001-05-5	Asinex Ltd.	ASN 09857919			CCc1nn2cc(cnc2c1-c1ccc(F)cc1)C(=O)c1cc(Cl)ccc1O	InChI=1S/C21H15ClFN3O2/c1-2-17-19(12-3-6-15(23)7-4-12)21-24-10-13(11-26(21)25-17)20(28)16-9-14(22)5-8-18(16)27/h3-11,27H,2H2,1H3	BQLKZWVQCRRRHM-UHFFFAOYSA-N	395.08368266							121293
MLS000392799	LSM-44425	SID22410278, BRD-K80567579	2406810	InChI=1S/C18H19NO6/c1-22-15-7-5-13(10-16(15)23-2)6-8-18(21)25-12-17(20)19-11-14-4-3-9-24-14/h3-10H,11-12H2,1-2H3,(H,19,20)/b8-6+	UHPXVJSRPCHXBM-SOFGYWHQSA-N	COc1ccc(\C=C\C(=O)OCC(=O)NCc2occc2)cc1OC	BroadT	BRD-K80567579	BRD-K80567579-001-05-6	Enamine Ltd.	T0512-1005			COc1ccc(\C=C\C(=O)OCC(=O)NCc2ccco2)cc1OC	InChI=1S/C18H19NO6/c1-22-15-7-5-13(10-16(15)23-2)6-8-18(21)25-12-17(20)19-11-14-4-3-9-24-14/h3-10H,11-12H2,1-2H3,(H,19,20)/b8-6+	UHPXVJSRPCHXBM-SOFGYWHQSA-N	345.121237338							
MLS000590766	LSM-44426	SID17512925, BRD-A35673887	12005671	InChI=1S/C21H25N3OS2/c1-3-5-9-15(4-2)14-24-20(25)18(27-21(24)26)12-17-13-22-23-19(17)16-10-7-6-8-11-16/h6-8,10-13,15H,3-5,9,14H2,1-2H3,(H,22,23)/b18-12-	YJSQRVMSMGLJJR-PDGQHHTCSA-N	CCCCC(CC)CN1C(=S)S\C(=C/c2c[nH]nc2c3ccccc3)\C1=O	BroadT	BRD-A35673887	BRD-A35673887-001-05-7	InterBioScreen Ltd.	STOCK3S-30257			CCCCC(CC)CN1C(=S)S\C(=C/c2c[nH]nc2-c2ccccc2)C1=O	InChI=1S/C21H25N3OS2/c1-3-5-9-15(4-2)14-24-20(25)18(27-21(24)26)12-17-13-22-23-19(17)16-10-7-6-8-11-16/h6-8,10-13,15H,3-5,9,14H2,1-2H3,(H,22,23)/b18-12-	YJSQRVMSMGLJJR-PDGQHHTCSA-N	399.14390383							
STK135790	LSM-32739	SID4257202, BRD-K72510244	1296651	InChI=1S/C25H22ClN3O4/c26-19-8-5-17(6-9-19)25(31)29-13-11-28(12-14-29)21-4-2-1-3-20(21)27-24(30)18-7-10-22-23(15-18)33-16-32-22/h1-10,15H,11-14,16H2,(H,27,30)	ZKGGYNUKEJKAFH-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)N2CCN(CC2)c3ccccc3NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K72510244	BRD-K72510244-001-05-1	ChemBridge Corporation	7798032			Clc1ccc(cc1)C(=O)N1CCN(CC1)c1ccccc1NC(=O)c1ccc2OCOc2c1	InChI=1S/C25H22ClN3O4/c26-19-8-5-17(6-9-19)25(31)29-13-11-28(12-14-29)21-4-2-1-3-20(21)27-24(30)18-7-10-22-23(15-18)33-16-32-22/h1-10,15H,11-14,16H2,(H,27,30)	ZKGGYNUKEJKAFH-UHFFFAOYSA-N	463.129883924							121296
T5235799	LSM-44427	SID22408774, BRD-K60300354	5873904	InChI=1S/C22H16F3N3O2/c23-22(24,25)15-6-3-5-14(11-15)12-17(21(29)26-13-16-7-4-10-30-16)20-27-18-8-1-2-9-19(18)28-20/h1-12H,13H2,(H,26,29)(H,27,28)/b17-12+	VINPCDGKFFXKCS-SFQUDFHCSA-N	FC(F)(F)c1cccc(\C=C(\C(=O)NCc2occc2)/c3nc4ccccc4[nH]3)c1	BroadT	BRD-K60300354	BRD-K60300354-001-06-5	Enamine Ltd.	T5235799			FC(F)(F)c1cccc(\C=C(\C(=O)NCc2ccco2)c2nc3ccccc3[nH]2)c1	InChI=1S/C22H16F3N3O2/c23-22(24,25)15-6-3-5-14(11-15)12-17(21(29)26-13-16-7-4-10-30-16)20-27-18-8-1-2-9-19(18)28-20/h1-12H,13H2,(H,26,29)(H,27,28)/b17-12+	VINPCDGKFFXKCS-SFQUDFHCSA-N	411.119461382							
F1359-1240	LSM-32741	BRD-K37771967	4525295	InChI=1S/C19H16ClN3O4S3/c1-27-9-8-23-13-7-6-11(30(21,25)26)10-15(13)29-19(23)22-18(24)17-16(20)12-4-2-3-5-14(12)28-17/h2-7,10H,8-9H2,1H3,(H2,21,25,26)	LKBPMKXJBSTBQF-UHFFFAOYSA-N	COCCN1C(=NC(=O)c2sc3ccccc3c2Cl)Sc4cc(ccc14)S(=O)(=O)N	BroadT	BRD-K37771967	BRD-K37771967-001-05-8	Life Chemicals Inc.	F1359-1240			COCCn1c2ccc(cc2sc1=NC(=O)c1sc2ccccc2c1Cl)S(N)(=O)=O	InChI=1S/C19H16ClN3O4S3/c1-27-9-8-23-13-7-6-11(30(21,25)26)10-15(13)29-19(23)22-18(24)17-16(20)12-4-2-3-5-14(12)28-17/h2-7,10H,8-9H2,1H3,(H2,21,25,26)	LKBPMKXJBSTBQF-UHFFFAOYSA-N	480.999145802							121298
3-(4-Methoxyphenyl)-1H-pyrazole-5-carbohydrazide	LSM-32742	SID17506027, BRD-K22639527	801126	InChI=1S/C11H12N4O2/c1-17-8-4-2-7(3-5-8)9-6-10(15-14-9)11(16)13-12/h2-6H,12H2,1H3,(H,13,16)(H,14,15)	ISIHBTUBCACZGP-UHFFFAOYSA-N	COc1ccc(cc1)c2cc([nH]n2)C(=O)NN	BroadT	BRD-K22639527	BRD-K22639527-001-05-7	Asinex Ltd.	BAS 00989698			COc1ccc(cc1)-c1cc([nH]n1)C(=O)NN	InChI=1S/C11H12N4O2/c1-17-8-4-2-7(3-5-8)9-6-10(15-14-9)11(16)13-12/h2-6H,12H2,1H3,(H,13,16)(H,14,15)	ISIHBTUBCACZGP-UHFFFAOYSA-N	232.096025664							121299
AC1L8KNB	LSM-32743	BRD-K88869323	403042	InChI=1S/C18H15N5O4S/c1-22-9-8-19-18(22)28-16-7-6-12(10-14(16)23(26)27)11-20-21-17(25)13-4-2-3-5-15(13)24/h2-11,24H,1H3,(H,21,25)	PLHDFTJRGZEFCG-UHFFFAOYSA-N	Cn1ccnc1Sc2ccc(C=NNC(=O)c3ccccc3O)cc2[N+](=O)[O-]	BroadT	BRD-K88869323	BRD-K88869323-001-05-7	ChemDiv Inc.	8007-4829			Cn1ccnc1Sc1ccc(C=NNC(=O)c2ccccc2O)cc1[N+]([O-])=O	InChI=1S/C18H15N5O4S/c1-22-9-8-19-18(22)28-16-7-6-12(10-14(16)23(26)27)11-20-21-17(25)13-4-2-3-5-15(13)24/h2-11,24H,1H3,(H,21,25)	PLHDFTJRGZEFCG-UHFFFAOYSA-N	397.0844747							121300
Methyl 5-fluoro-3-{[(4-methoxyphenyl)sulfonyl]amino}-1H-indole-2-carboxylate	LSM-32744	SID14730386, BRD-K21708906	1872549	InChI=1S/C17H15FN2O5S/c1-24-11-4-6-12(7-5-11)26(22,23)20-15-13-9-10(18)3-8-14(13)19-16(15)17(21)25-2/h3-9,19-20H,1-2H3	CVSSWVXMXIIWJV-UHFFFAOYSA-N	COC(=O)c1[nH]c2ccc(F)cc2c1NS(=O)(=O)c3ccc(OC)cc3	BroadT	BRD-K21708906	BRD-K21708906-001-05-2	InterBioScreen Ltd.	STOCK5S-45415			COC(=O)c1[nH]c2ccc(F)cc2c1NS(=O)(=O)c1ccc(OC)cc1	InChI=1S/C17H15FN2O5S/c1-24-11-4-6-12(7-5-11)26(22,23)20-15-13-9-10(18)3-8-14(13)19-16(15)17(21)25-2/h3-9,19-20H,1-2H3	CVSSWVXMXIIWJV-UHFFFAOYSA-N	378.06857049							121301
5-Pyridin-4-yl-4-o-tolyl-4H-[1,2,4]triazole-3-thiol	LSM-32745	SID4262122, BRD-K98758221	969943	InChI=1S/C14H12N4S/c1-10-4-2-3-5-12(10)18-13(16-17-14(18)19)11-6-8-15-9-7-11/h2-9H,1H3,(H,17,19)	VDOCMXPONDDKGI-UHFFFAOYSA-N	Cc1ccccc1n2c(S)nnc2c3ccncc3	BroadT	BRD-K98758221	BRD-K98758221-001-05-3	ChemBridge Corporation	7790037			Cc1ccccc1-n1c(S)nnc1-c1ccncc1	InChI=1S/C14H12N4S/c1-10-4-2-3-5-12(10)18-13(16-17-14(18)19)11-6-8-15-9-7-11/h2-9H,1H3,(H,17,19)	VDOCMXPONDDKGI-UHFFFAOYSA-N	268.078267114							121302
AC1M0SIC	LSM-32746	SID26657946, BRD-K03505622	2082602	InChI=1S/C17H10BrN5O4/c18-13-4-2-1-3-11(13)17-22-21-15(27-17)8-26-16-12-6-5-10(23(24)25)7-14(12)19-9-20-16/h1-7,9H,8H2	WMBXXLUVJAZNPC-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2c(OCc3oc(nn3)c4ccccc4Br)ncnc2c1	BroadT	BRD-K03505622	BRD-K03505622-001-06-5	Enamine Ltd.	T5260565			[O-][N+](=O)c1ccc2c(OCc3nnc(o3)-c3ccccc3Br)ncnc2c1	InChI=1S/C17H10BrN5O4/c18-13-4-2-1-3-11(13)17-22-21-15(27-17)8-26-16-12-6-5-10(23(24)25)7-14(12)19-9-20-16/h1-7,9H,8H2	WMBXXLUVJAZNPC-UHFFFAOYSA-N	426.99161645							121303
AN-329/43211198	LSM-32747	SID4261767, BRD-K81377888	1093786	InChI=1S/C22H23N3O3/c1-16-7-9-17(10-8-16)21-15-18(23-28-21)22(26)25-13-11-24(12-14-25)19-5-3-4-6-20(19)27-2/h3-10,15H,11-14H2,1-2H3	KNNYXMWJUQXPFM-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)C(=O)c3cc(on3)c4ccc(C)cc4	BroadT	BRD-K81377888	BRD-K81377888-001-05-5	ChemBridge Corporation	7905085			COc1ccccc1N1CCN(CC1)C(=O)c1cc(on1)-c1ccc(C)cc1	InChI=1S/C22H23N3O3/c1-16-7-9-17(10-8-16)21-15-18(23-28-21)22(26)25-13-11-24(12-14-25)19-5-3-4-6-20(19)27-2/h3-10,15H,11-14H2,1-2H3	KNNYXMWJUQXPFM-UHFFFAOYSA-N	377.173941626							121304
AC1MUESP	LSM-32748	BRD-A59285163	3617259	InChI=1S/C18H14FN3O3/c1-11-15(18(25)22(21-11)14-5-3-2-4-6-14)16(23)17(24)20-13-9-7-12(19)8-10-13/h2-10,25H,1H3,(H,20,24)	LCMBYUWUZVRFIL-UHFFFAOYSA-N	Cc1nn(c(O)c1C(=O)C(=O)Nc2ccc(F)cc2)c3ccccc3	BroadT	BRD-A59285163	BRD-A59285163-001-05-6	Enamine Ltd.	T0504-5212			CC1=NN(C(=O)C1C(=O)C(=O)Nc1ccc(F)cc1)c1ccccc1	InChI=1S/C18H14FN3O3/c1-11-15(18(25)22(21-11)14-5-3-2-4-6-14)16(23)17(24)20-13-9-7-12(19)8-10-13/h2-10,15H,1H3,(H,20,24)	HJHDSPBGWYGUTN-UHFFFAOYSA-N	339.101919538							
MLS000733231	LSM-32749	SID24799905, BRD-K43885503	16191575	InChI=1S/C23H37N5O3/c1-17(2)15-19-16-21(25-24-19)23(30)27-9-5-20(6-10-27)26-7-3-18(4-8-26)22(29)28-11-13-31-14-12-28/h16-18,20H,3-15H2,1-2H3,(H,24,25)	PQDROMHCEFPCMS-UHFFFAOYSA-N	CC(C)Cc1cc([nH]n1)C(=O)N2CCC(CC2)N3CCC(CC3)C(=O)N4CCOCC4	BroadT	BRD-K43885503	BRD-K43885503-001-05-9	ChemBridge Corporation	56472098			CC(C)Cc1cc([nH]n1)C(=O)N1CCC(CC1)N1CCC(CC1)C(=O)N1CCOCC1	InChI=1S/C23H37N5O3/c1-17(2)15-19-16-21(25-24-19)23(30)27-9-5-20(6-10-27)26-7-3-18(4-8-26)22(29)28-11-13-31-14-12-28/h16-18,20H,3-15H2,1-2H3,(H,24,25)	PQDROMHCEFPCMS-UHFFFAOYSA-N	431.289640094							121306
4-Chloro-n-(2,5-dichlorophenyl)-1-ethyl-1H-pyrazole-5-carboxamide	LSM-32750	SID4258159, BRD-K96183309	891805	InChI=1S/C12H10Cl3N3O/c1-2-18-11(9(15)6-16-18)12(19)17-10-5-7(13)3-4-8(10)14/h3-6H,2H2,1H3,(H,17,19)	UGBQEMSWVDTYMP-UHFFFAOYSA-N	CCn1ncc(Cl)c1C(=O)Nc2cc(Cl)ccc2Cl	BroadT	BRD-K96183309	BRD-K96183309-001-05-1	ChemBridge Corporation	7500589			CCn1ncc(Cl)c1C(=O)Nc1cc(Cl)ccc1Cl	InChI=1S/C12H10Cl3N3O/c1-2-18-11(9(15)6-16-18)12(19)17-10-5-7(13)3-4-8(10)14/h3-6H,2H2,1H3,(H,17,19)	UGBQEMSWVDTYMP-UHFFFAOYSA-N	316.9889451							121307
AG-205/37153059	LSM-32751	SID7976369, BRD-A86330615	3769831	InChI=1S/C19H15N5O/c1-12-18(24-16-10-6-5-9-15(16)22-23-24)17(13-7-3-2-4-8-13)14(11-20)19(21)25-12/h2-10,17H,21H2,1H3	KCHZSQYIEAAJMH-UHFFFAOYSA-N	CC1=C(C(C(=C(N)O1)C#N)c2ccccc2)n3nnc4ccccc34	BroadT	BRD-A86330615	BRD-A86330615-001-05-1	ChemBridge Corporation	5681275			CC1=C(C(c2ccccc2)C(C#N)=C(N)O1)n1nnc2ccccc12	InChI=1S/C19H15N5O/c1-12-18(24-16-10-6-5-9-15(16)22-23-24)17(13-7-3-2-4-8-13)14(11-20)19(21)25-12/h2-10,17H,21H2,1H3	KCHZSQYIEAAJMH-UHFFFAOYSA-N	329.12766015							121308
AMBCB63451289	LSM-32752	SID24799337, BRD-A36746745	16191008	InChI=1S/C22H25N3O2/c1-3-8-18(9-4-1)14-21-23-22(27-24-21)16-25-13-7-12-20(15-25)26-17-19-10-5-2-6-11-19/h1-6,8-11,20H,7,12-17H2	OXQUWTGXGUJSBI-UHFFFAOYSA-N	C(OC1CCCN(Cc2onc(Cc3ccccc3)n2)C1)c4ccccc4	BroadT	BRD-A36746745	BRD-A36746745-001-05-2	ChemBridge Corporation	63451289			C(OC1CCCN(Cc2nc(Cc3ccccc3)no2)C1)c1ccccc1	InChI=1S/C22H25N3O2/c1-3-8-18(9-4-1)14-21-23-22(27-24-21)16-25-13-7-12-20(15-25)26-17-19-10-5-2-6-11-19/h1-6,8-11,20H,7,12-17H2	OXQUWTGXGUJSBI-UHFFFAOYSA-N	363.19467707							121309
MLS000116117	LSM-32753	SID26746773, SID7967020, BRD-A00722675	4997967	InChI=1S/C21H24N2O3/c1-15-6-5-11-23(13-15)20(16-7-3-2-4-8-16)21(24)22-17-9-10-18-19(12-17)26-14-25-18/h2-4,7-10,12,15,20H,5-6,11,13-14H2,1H3,(H,22,24)	XEGOBYSRTDSXFT-UHFFFAOYSA-N	CC1CCCN(C1)C(C(=O)Nc2ccc3OCOc3c2)c4ccccc4	BroadT	BRD-A00722675	BRD-A00722675-001-04-2	ChemDiv Inc.	C094-0056			CC1CCCN(C1)C(C(=O)Nc1ccc2OCOc2c1)c1ccccc1	InChI=1S/C21H24N2O3/c1-15-6-5-11-23(13-15)20(16-7-3-2-4-8-16)21(24)22-17-9-10-18-19(12-17)26-14-25-18/h2-4,7-10,12,15,20H,5-6,11,13-14H2,1H3,(H,22,24)	XEGOBYSRTDSXFT-UHFFFAOYSA-N	352.178692648							121310
MLS000113614	LSM-32754	SID29216990, SID7973481, BRD-A95571796	2928530	InChI=1S/C19H16N2O2/c22-19-16-10-4-5-11-17(16)20-18(14-7-2-1-3-8-14)21(19)13-15-9-6-12-23-15/h1-12,18,20H,13H2	YPIADJABWAASFX-UHFFFAOYSA-N	O=C1N(Cc2occc2)C(Nc3ccccc13)c4ccccc4	BroadT	BRD-A95571796	BRD-A95571796-001-05-0	ChemBridge Corporation	7151928			O=C1N(Cc2ccco2)C(Nc2ccccc12)c1ccccc1	InChI=1S/C19H16N2O2/c22-19-16-10-4-5-11-17(16)20-18(14-7-2-1-3-8-14)21(19)13-15-9-6-12-23-15/h1-12,18,20H,13H2	YPIADJABWAASFX-UHFFFAOYSA-N	304.121177772							121311
AN-465/42246754	LSM-15462	BRD-K87592441	834261	InChI=1S/C19H19NOS/c1-2-5-17(6-3-1)15-21-18-10-8-16(9-11-18)13-20-14-19-7-4-12-22-19/h1-12,20H,13-15H2	NBJSYTGLGDBHFD-UHFFFAOYSA-N	C(NCc1cccs1)c2ccc(OCc3ccccc3)cc2	BroadT	BRD-K87592441	BRD-K87592441-003-05-9	ChemBridge Corporation	7884485		Cl	C(NCc1ccc(OCc2ccccc2)cc1)c1cccs1.Cl	InChI=1S/C19H19NOS.ClH/c1-2-5-17(6-3-1)15-21-18-10-8-16(9-11-18)13-20-14-19-7-4-12-22-19;/h1-12,20H,13-15H2;1H	VHASHUFOSXMJPQ-UHFFFAOYSA-N	309.118734928							104104, 104104
AC1MCEVS	LSM-32755	BRD-K14814020	2767947	InChI=1S/C12H12N2OS/c1-8-11(9(2)14-15)16-12(13-8)10-6-4-3-5-7-10/h3-7,15H,1-2H3	MQISPQROQJHEJE-UHFFFAOYSA-N	CC(=NO)c1sc(nc1C)c2ccccc2	BroadT	BRD-K14814020	BRD-K14814020-001-04-1	Key Organics Ltd.	11P-545S			CC(=NO)c1sc(nc1C)-c1ccccc1	InChI=1S/C12H12N2OS/c1-8-11(9(2)14-15)16-12(13-8)10-6-4-3-5-7-10/h3-7,15H,1-2H3	MQISPQROQJHEJE-UHFFFAOYSA-N	232.067033714							121312
MLS000049583	LSM-32756	SID4255275, BRD-K95430628	2202614	InChI=1S/C17H20BrNO3/c1-17(2,3)12-6-7-15(14(18)9-12)22-11-16(20)19-10-13-5-4-8-21-13/h4-9H,10-11H2,1-3H3,(H,19,20)	QMEFGYCOGPJKNT-UHFFFAOYSA-N	CC(C)(C)c1ccc(OCC(=O)NCc2occc2)c(Br)c1	BroadT	BRD-K95430628	BRD-K95430628-001-06-9	ChemBridge Corporation	7765453			CC(C)(C)c1ccc(OCC(=O)NCc2ccco2)c(Br)c1	InChI=1S/C17H20BrNO3/c1-17(2,3)12-6-7-15(14(18)9-12)22-11-16(20)19-10-13-5-4-8-21-13/h4-9H,10-11H2,1-3H3,(H,19,20)	QMEFGYCOGPJKNT-UHFFFAOYSA-N	365.06265611							121313
MLS000582692	LSM-32757	SID17413884, BRD-K13318462	2233435	InChI=1S/C18H15BrN2O2/c1-11-12(2)21-17-9-13(7-8-16(17)20-11)18(22)23-10-14-5-3-4-6-15(14)19/h3-9H,10H2,1-2H3	DOFSCDOXIOPXKM-UHFFFAOYSA-N	Cc1nc2ccc(cc2nc1C)C(=O)OCc3ccccc3Br	BroadT	BRD-K13318462	BRD-K13318462-001-06-4	ChemBridge Corporation	7970281			Cc1nc2ccc(cc2nc1C)C(=O)OCc1ccccc1Br	InChI=1S/C18H15BrN2O2/c1-11-12(2)21-17-9-13(7-8-16(17)20-11)18(22)23-10-14-5-3-4-6-15(14)19/h3-9H,10H2,1-2H3	DOFSCDOXIOPXKM-UHFFFAOYSA-N	370.03169034							121314
ZINC00935452	LSM-32758	SID22406778, BRD-K66019884	1177881	InChI=1S/C16H13ClN2O2S2/c1-11-7-9-13(10-8-11)23(20,21)15-14(17)22-16(19-15)18-12-5-3-2-4-6-12/h2-10H,1H3,(H,18,19)	YLEQKMDWMDTCQI-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)c2nc(Nc3ccccc3)sc2Cl	BroadT	BRD-K66019884	BRD-K66019884-001-04-9	Enamine Ltd.	T0507-7704			Cc1ccc(cc1)S(=O)(=O)c1nc(Nc2ccccc2)sc1Cl	InChI=1S/C16H13ClN2O2S2/c1-11-7-9-13(10-8-11)23(20,21)15-14(17)22-16(19-15)18-12-5-3-2-4-6-12/h2-10H,1H3,(H,18,19)	YLEQKMDWMDTCQI-UHFFFAOYSA-N	364.010696766							121315
ST50016792	LSM-32759	SID851005, BRD-K12007831	653558	InChI=1S/C16H11N3O/c1-2-6-12(7-3-1)14-10-13-15(19-8-4-5-9-19)17-11-18-16(13)20-14/h1-11H	YENSLLPLIAMTRS-UHFFFAOYSA-N	o1c(cc2c(ncnc12)n3cccc3)c4ccccc4	BroadT	BRD-K12007831	BRD-K12007831-001-05-0	Asinex Ltd.	BAS 03312235			c1ccn(c1)-c1ncnc2oc(cc12)-c1ccccc1	InChI=1S/C16H11N3O/c1-2-6-12(7-3-1)14-10-13-15(19-8-4-5-9-19)17-11-18-16(13)20-14/h1-11H	YENSLLPLIAMTRS-UHFFFAOYSA-N	261.090212002							121316
MLS001000615	LSM-32760	SID47198058, BRD-K46440900	2839001	InChI=1S/C19H16Cl3NO3/c1-9-13(17(24)10-4-6-11(20)7-5-10)14-12(8-23(2)3)18(25)15(21)16(22)19(14)26-9/h4-7,25H,8H2,1-3H3	VIYMPGWTEWZRDT-UHFFFAOYSA-N	CN(C)Cc1c(O)c(Cl)c(Cl)c2oc(C)c(C(=O)c3ccc(Cl)cc3)c12	BroadT	BRD-K46440900	BRD-K46440900-001-06-7	ChemBridge Corporation	5276070			CN(C)Cc1c(O)c(Cl)c(Cl)c2oc(C)c(C(=O)c3ccc(Cl)cc3)c12	InChI=1S/C19H16Cl3NO3/c1-9-13(17(24)10-4-6-11(20)7-5-10)14-12(8-23(2)3)18(25)15(21)16(22)19(14)26-9/h4-7,25H,8H2,1-3H3	VIYMPGWTEWZRDT-UHFFFAOYSA-N	411.019576512							121317
N-(4-Diethylsulfamoyl-phenyl)-4-morpholin-4-ylmethyl-benzamide	LSM-32761	SID14723536, BRD-K96116345	2207528	InChI=1S/C22H29N3O4S/c1-3-25(4-2)30(27,28)21-11-9-20(10-12-21)23-22(26)19-7-5-18(6-8-19)17-24-13-15-29-16-14-24/h5-12H,3-4,13-17H2,1-2H3,(H,23,26)	SSXHSBALTRXSJL-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2ccc(CN3CCOCC3)cc2)cc1	BroadT	BRD-K96116345	BRD-K96116345-001-05-7	Asinex Ltd.	BAS 07601562			CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2ccc(CN3CCOCC3)cc2)cc1	InChI=1S/C22H29N3O4S/c1-3-25(4-2)30(27,28)21-11-9-20(10-12-21)23-22(26)19-7-5-18(6-8-19)17-24-13-15-29-16-14-24/h5-12H,3-4,13-17H2,1-2H3,(H,23,26)	SSXHSBALTRXSJL-UHFFFAOYSA-N	431.187877128							121318
SMR000156131	LSM-32762	SID17407157, BRD-A55069444	11958458	InChI=1S/C20H24N4O2S2/c1-5-8-12(2)18(25)24-20-21-13(3)17(28-20)15-11-27-19(23-15)22-14-9-6-7-10-16(14)26-4/h6-7,9-12H,5,8H2,1-4H3,(H,22,23)(H,21,24,25)	IHGJLLZSWRNUSF-UHFFFAOYSA-N	CCCC(C)C(=O)Nc1nc(C)c(s1)c2csc(Nc3ccccc3OC)n2	BroadT	BRD-A55069444	BRD-A55069444-001-05-9	University of California at Davis	CLY_Corr_H10			CCCC(C)C(=O)Nc1nc(C)c(s1)-c1csc(Nc2ccccc2OC)n1	InChI=1S/C20H24N4O2S2/c1-5-8-12(2)18(25)24-20-21-13(3)17(28-20)15-11-27-19(23-15)22-14-9-6-7-10-16(14)26-4/h6-7,9-12H,5,8H2,1-4H3,(H,22,23)(H,21,24,25)	IHGJLLZSWRNUSF-UHFFFAOYSA-N	416.134067428							121319
N-[2-Chloro-5-(trifluoromethyl)phenyl]-5-(pyridin-4-yl)-1,3,4-thiadiazol-2-amine	LSM-2109	BRD-K06020002, SID87457165	1294885	InChI=1S/C14H8ClF3N4S/c15-10-2-1-9(14(16,17)18)7-11(10)20-13-22-21-12(23-13)8-3-5-19-6-4-8/h1-7H,(H,20,22)	NELTYWCUMXMUAA-UHFFFAOYSA-N	FC(F)(F)c1ccc(Cl)c(Nc2nnc(s2)c3ccncc3)c1	BroadT	BRD-K06020002	BRD-K06020002-001-02-1	Broad Institute of MIT and Harvard	BRD-K06020002			FC(F)(F)c1ccc(Cl)c(Nc2nnc(s2)-c2ccncc2)c1	InChI=1S/C14H8ClF3N4S/c15-10-2-1-9(14(16,17)18)7-11(10)20-13-22-21-12(23-13)8-3-5-19-6-4-8/h1-7H,(H,20,22)	NELTYWCUMXMUAA-UHFFFAOYSA-N	356.011029296							92108
SMR000206655	LSM-32763	SID17510106, BRD-A33698749	4055124	InChI=1S/C18H19NO4S/c1-21-13-9-7-12(8-10-13)19-16(20)11-24-18(19)14-5-4-6-15(22-2)17(14)23-3/h4-10,18H,11H2,1-3H3	AAKUGLDBNILBQK-UHFFFAOYSA-N	COc1ccc(cc1)N2C(SCC2=O)c3cccc(OC)c3OC	BroadT	BRD-A33698749	BRD-A33698749-001-06-2	ChemDiv Inc.	K205-1842			COc1ccc(cc1)N1C(SCC1=O)c1cccc(OC)c1OC	InChI=1S/C18H19NO4S/c1-21-13-9-7-12(8-10-13)19-16(20)11-24-18(19)14-5-4-6-15(22-2)17(14)23-3/h4-10,18H,11H2,1-3H3	AAKUGLDBNILBQK-UHFFFAOYSA-N	345.103478788							121320
3-(4-Methoxybenzyl)-n-(3-methoxypropyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide	LSM-32764	SID24268254, SID24810638, BRD-K13121141	15988116	InChI=1S/C21H23N3O5/c1-28-11-3-10-22-19(25)15-6-9-17-18(12-15)23-21(27)24(20(17)26)13-14-4-7-16(29-2)8-5-14/h4-9,12H,3,10-11,13H2,1-2H3,(H,22,25)(H,23,27)	YPIIMFTYFCSQLC-UHFFFAOYSA-N	COCCCNC(=O)c1ccc2C(=O)N(Cc3ccc(OC)cc3)C(=O)Nc2c1	BroadT	BRD-K13121141	BRD-K13121141-001-05-3	ChemDiv Inc.	C190-0206			COCCCNC(=O)c1ccc2c(c1)[nH]c(=O)n(Cc1ccc(OC)cc1)c2=O	InChI=1S/C21H23N3O5/c1-28-11-3-10-22-19(25)15-6-9-17-18(12-15)23-21(27)24(20(17)26)13-14-4-7-16(29-2)8-5-14/h4-9,12H,3,10-11,13H2,1-2H3,(H,22,25)(H,23,27)	YPIIMFTYFCSQLC-UHFFFAOYSA-N	397.163770866							121321
MLS000592047	LSM-44428	SID24784287, BRD-K20830923	5604202	InChI=1S/C19H16FN5O4/c20-14-3-1-12(2-4-14)7-10-25-18(28)15(17(27)23-19(25)29)11-22-24-16(26)13-5-8-21-9-6-13/h1-6,8-9,11,22H,7,10H2,(H,24,26)(H,23,27,29)/b15-11+	KGCNNBPDTQBHKJ-RVDMUPIBSA-N	Fc1ccc(CCN2C(=O)NC(=O)\C(=C/NNC(=O)c3ccncc3)\C2=O)cc1	BroadT	BRD-K20830923	BRD-K20830923-001-05-4	InterBioScreen Ltd.	STOCK2S-53932			Fc1ccc(CCN2C(=O)NC(=O)\C(=C/NNC(=O)c3ccncc3)C2=O)cc1	InChI=1S/C19H16FN5O4/c20-14-3-1-12(2-4-14)7-10-25-18(28)15(17(27)23-19(25)29)11-22-24-16(26)13-5-8-21-9-6-13/h1-6,8-9,11,22H,7,10H2,(H,24,26)(H,23,27,29)/b15-11+	KGCNNBPDTQBHKJ-RVDMUPIBSA-N	397.118632242							
AC1O9Y5H	LSM-32766	BRD-K15004580	6740546	InChI=1S/C15H10N2O3/c18-14-10-5-1-2-6-12(10)20-15(19)11(14)9-17-13-7-3-4-8-16-13/h1-9,18H	OFQVMDJUOZPJGE-UHFFFAOYSA-N	OC1=C(C=Nc2ccccn2)C(=O)Oc3ccccc13	BroadT	BRD-K15004580	BRD-K15004580-001-06-5	Enamine Ltd.	T0510-2558			Oc1c(C=Nc2ccccn2)c(=O)oc2ccccc12	InChI=1S/C15H10N2O3/c18-14-10-5-1-2-6-12(10)20-15(19)11(14)9-17-13-7-3-4-8-16-13/h1-9,18H	OFQVMDJUOZPJGE-UHFFFAOYSA-N	266.0691422							
SMR000001630	LSM-32767	SID847031, BRD-K94022646	649426	InChI=1S/C19H19ClN4O2S/c1-2-26-18(25)13-27-19-23-22-17(24(19)14-8-4-3-5-9-14)12-21-16-11-7-6-10-15(16)20/h3-11,21H,2,12-13H2,1H3	MSFQHXLWNFTMRI-UHFFFAOYSA-N	CCOC(=O)CSc1nnc(CNc2ccccc2Cl)n1c3ccccc3	BroadT	BRD-K94022646	BRD-K94022646-001-05-5	Asinex Ltd.	ASN 02107152			CCOC(=O)CSc1nnc(CNc2ccccc2Cl)n1-c1ccccc1	InChI=1S/C19H19ClN4O2S/c1-2-26-18(25)13-27-19-23-22-17(24(19)14-8-4-3-5-9-14)12-21-16-11-7-6-10-15(16)20/h3-11,21H,2,12-13H2,1H3	MSFQHXLWNFTMRI-UHFFFAOYSA-N	402.091724288							121324
72836-33-0	LSM-32768	SID14725195, BRD-K04177806	351887	InChI=1S/C9H8ClN3S2/c10-7-3-1-6(2-4-7)5-14-9-13-12-8(11)15-9/h1-4H,5H2,(H2,11,12)	SPABJFQNGHSGMG-UHFFFAOYSA-N	Nc1nnc(SCc2ccc(Cl)cc2)s1	BroadT	BRD-K04177806	BRD-K04177806-001-06-0	Asinex Ltd.	BAS 01127326			Nc1nnc(SCc2ccc(Cl)cc2)s1	InChI=1S/C9H8ClN3S2/c10-7-3-1-6(2-4-7)5-14-9-13-12-8(11)15-9/h1-4H,5H2,(H2,11,12)	SPABJFQNGHSGMG-UHFFFAOYSA-N	256.984816376							121325
ST025563	LSM-2055	SID85147384, SID56373728, SID24785700, BRD-K03704870	698942	InChI=1S/C12H14N4O2/c1-2-9-3-5-10(6-4-9)18-7-11(17)15-12-13-8-14-16-12/h3-6,8H,2,7H2,1H3,(H2,13,14,15,16,17)	CBURGJOQDWHGSX-UHFFFAOYSA-N	CCc1ccc(OCC(=O)Nc2nc[nH]n2)cc1	BroadT	BRD-K03704870	BRD-K03704870-001-04-8	Sanford-Burnham Medical Research Institute	2-(4-ethylphenoxy)-N-4H-1,2,4-triazol-3-ylacetamide MLS-0265844.0001			CCc1ccc(OCC(=O)Nc2nnc[nH]2)cc1	InChI=1S/C12H14N4O2/c1-2-9-3-5-10(6-4-9)18-7-11(17)15-12-13-8-14-16-12/h3-6,8H,2,7H2,1H3,(H2,13,14,15,16,17)	CBURGJOQDWHGSX-UHFFFAOYSA-N	246.111675728							92064
SMR000003535	LSM-32769	SID842947, BRD-K90689171	645218	InChI=1S/C19H19N5O5S/c1-26-14-6-4-13(10-16(14)27-2)24-19(21-22-23-24)30-11-18(25)20-12-3-5-15-17(9-12)29-8-7-28-15/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,25)	WRRGFFYTLWGXFT-UHFFFAOYSA-N	COc1ccc(cc1OC)n2nnnc2SCC(=O)Nc3ccc4OCCOc4c3	BroadT	BRD-K90689171	BRD-K90689171-001-05-8	Asinex Ltd.	ASN 04455720			COc1ccc(cc1OC)-n1nnnc1SCC(=O)Nc1ccc2OCCOc2c1	InChI=1S/C19H19N5O5S/c1-26-14-6-4-13(10-16(14)27-2)24-19(21-22-23-24)30-11-18(25)20-12-3-5-15-17(9-12)29-8-7-28-15/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,25)	WRRGFFYTLWGXFT-UHFFFAOYSA-N	429.110689448							121326
MLS000083800	LSM-15463	BRD-K37256617	667227	InChI=1S/C19H19BrFN5O3/c20-14-5-6-16(28-11-12-3-1-2-4-15(12)21)13(9-14)10-23-7-8-24-19(27)17-18(22)26-29-25-17/h1-6,9,23H,7-8,10-11H2,(H2,22,26)(H,24,27)	VJTIFSGFGLTUDR-UHFFFAOYSA-N	Nc1nonc1C(=O)NCCNCc2cc(Br)ccc2OCc3ccccc3F	BroadT	BRD-K37256617	BRD-K37256617-003-05-0	InterBioScreen Ltd.	STOCK5S-58210		Cl	Nc1nonc1C(=O)NCCNCc1cc(Br)ccc1OCc1ccccc1F.Cl	InChI=1S/C19H19BrFN5O3.ClH/c20-14-5-6-16(28-11-12-3-1-2-4-15(12)21)13(9-14)10-23-7-8-24-19(27)17-18(22)26-29-25-17;/h1-6,9,23H,7-8,10-11H2,(H2,22,26)(H,24,27);1H	DLTJNAQQRKNCRQ-UHFFFAOYSA-N	463.065530318							104105, 104105
MLS000040696	LSM-32770	SID863211, BRD-K32625107	664458	InChI=1S/C16H10N2O2S2/c19-11(13-6-3-7-21-13)8-22-16-15-14(17-9-18-16)10-4-1-2-5-12(10)20-15/h1-7,9H,8H2	OFQHSVSIMICVEF-UHFFFAOYSA-N	O=C(CSc1ncnc2c1oc3ccccc23)c4cccs4	BroadT	BRD-K32625107	BRD-K32625107-001-05-2	InterBioScreen Ltd.	STOCK4S-68921			O=C(CSc1ncnc2c3ccccc3oc12)c1cccs1	InChI=1S/C16H10N2O2S2/c19-11(13-6-3-7-21-13)8-22-16-15-14(17-9-18-16)10-4-1-2-5-12(10)20-15/h1-7,9H,8H2	OFQHSVSIMICVEF-UHFFFAOYSA-N	326.01836896							121327
MLS000579974	LSM-32771	SID17434131, BRD-K03479034	2948119	InChI=1S/C20H15FN2O3/c1-25-19-10-15-14-4-2-3-5-17(14)26-18(15)11-16(19)23-20(24)22-13-8-6-12(21)7-9-13/h2-11H,1H3,(H2,22,23,24)	HSKJOYIEGWZTJS-UHFFFAOYSA-N	COc1cc2c(oc3ccccc23)cc1NC(=O)Nc4ccc(F)cc4	BroadT	BRD-K03479034	BRD-K03479034-001-06-5	ChemBridge Corporation	7692681			COc1cc2c(cc1NC(=O)Nc1ccc(F)cc1)oc1ccccc21	InChI=1S/C20H15FN2O3/c1-25-19-10-15-14-4-2-3-5-17(14)26-18(15)11-16(19)23-20(24)22-13-8-6-12(21)7-9-13/h2-11H,1H3,(H2,22,23,24)	HSKJOYIEGWZTJS-UHFFFAOYSA-N	350.10667056							121328
AC1LIWOF	LSM-32772	SID26661027, BRD-K40355597	939671	InChI=1S/C14H15NO3S/c1-9-7-13(19-6-5-14(16)17)15-12-4-3-10(18-2)8-11(9)12/h3-4,7-8H,5-6H2,1-2H3,(H,16,17)	UXZCREZQFHJZLJ-UHFFFAOYSA-N	COc1ccc2nc(SCCC(=O)O)cc(C)c2c1	BroadT	BRD-K40355597	BRD-K40355597-001-05-3	InterBioScreen Ltd.	STOCK2S-64468			COc1ccc2nc(SCCC(O)=O)cc(C)c2c1	InChI=1S/C14H15NO3S/c1-9-7-13(19-6-5-14(16)17)15-12-4-3-10(18-2)8-11(9)12/h3-4,7-8H,5-6H2,1-2H3,(H,16,17)	UXZCREZQFHJZLJ-UHFFFAOYSA-N	277.07726404							121329
SMR000065831	LSM-32773	SID3715183, BRD-K16698366	2320295	InChI=1S/C17H13FN4S2/c1-10-15(23-12-8-6-11(18)7-9-12)16(19)22(21-10)17-20-13-4-2-3-5-14(13)24-17/h2-9H,19H2,1H3	WQULVOUQEHSSMH-UHFFFAOYSA-N	Cc1nn(c(N)c1Sc2ccc(F)cc2)c3nc4ccccc4s3	BroadT	BRD-K16698366	BRD-K16698366-001-05-5	Enamine Ltd.	T0503-7486			Cc1nn(-c2nc3ccccc3s2)c(N)c1Sc1ccc(F)cc1	InChI=1S/C17H13FN4S2/c1-10-15(23-12-8-6-11(18)7-9-12)16(19)22(21-10)17-20-13-4-2-3-5-14(13)24-17/h2-9H,19H2,1H3	WQULVOUQEHSSMH-UHFFFAOYSA-N	356.056566036							121330
ST028808	LSM-32774	SID4257548, BRD-K66960346	596773	InChI=1S/C18H23NO5/c1-6-22-17(21)14-8-7-12(24-14)10-19-16(20)13-9-15(18(3,4)5)23-11(13)2/h7-9H,6,10H2,1-5H3,(H,19,20)	BEEZNWLPFBEOPP-UHFFFAOYSA-N	CCOC(=O)c1oc(CNC(=O)c2cc(oc2C)C(C)(C)C)cc1	BroadT	BRD-K66960346	BRD-K66960346-001-05-3	ChemBridge Corporation	6628719			CCOC(=O)c1ccc(CNC(=O)c2cc(oc2C)C(C)(C)C)o1	InChI=1S/C18H23NO5/c1-6-22-17(21)14-8-7-12(24-14)10-19-16(20)13-9-15(18(3,4)5)23-11(13)2/h7-9H,6,10H2,1-5H3,(H,19,20)	BEEZNWLPFBEOPP-UHFFFAOYSA-N	333.157622846							121331
F0611-0563	LSM-32775	SID4249041, BRD-K29764219	3243045	InChI=1S/C16H18N2O3/c1-21-13-5-4-11-8-12(16(20)18-14(11)9-13)6-7-17-15(19)10-2-3-10/h4-5,8-10H,2-3,6-7H2,1H3,(H,17,19)(H,18,20)	HLWFZOLBOOZRFS-UHFFFAOYSA-N	COc1ccc2cc(CCNC(=O)C3CC3)c(O)nc2c1	BroadT	BRD-K29764219	BRD-K29764219-001-05-9	ChemDiv Inc.	C279-0517			COc1ccc2cc(CCNC(=O)C3CC3)c(O)nc2c1	InChI=1S/C16H18N2O3/c1-21-13-5-4-11-8-12(16(20)18-14(11)9-13)6-7-17-15(19)10-2-3-10/h4-5,8-10H,2-3,6-7H2,1H3,(H,17,19)(H,18,20)	HLWFZOLBOOZRFS-UHFFFAOYSA-N	286.131742456							121332
STK344550	LSM-32776	SID17413391, BRD-K39806256	1254644	InChI=1S/C17H18ClN3OS2/c18-12-6-4-7-13(15(12)21-9-2-1-3-10-21)19-17(23)20-16(22)14-8-5-11-24-14/h4-8,11H,1-3,9-10H2,(H2,19,20,22,23)	YFLGDBKFXXZCAR-UHFFFAOYSA-N	Clc1cccc(NC(=S)NC(=O)c2cccs2)c1N3CCCCC3	BroadT	BRD-K39806256	BRD-K39806256-001-06-8	ChemBridge Corporation	7912918			Clc1cccc(NC(=S)NC(=O)c2cccs2)c1N1CCCCC1	InChI=1S/C17H18ClN3OS2/c18-12-6-4-7-13(15(12)21-9-2-1-3-10-21)19-17(23)20-16(22)14-8-5-11-24-14/h4-8,11H,1-3,9-10H2,(H2,19,20,22,23)	YFLGDBKFXXZCAR-UHFFFAOYSA-N	379.057981316							121333
T5576545	LSM-32777	SID49675506, BRD-K01367395	8963733	InChI=1S/C17H19Cl2NO2S/c1-13-5-3-4-6-14(13)12-20(2)9-10-23(21,22)17-11-15(18)7-8-16(17)19/h3-8,11H,9-10,12H2,1-2H3	FGXJBGBJAVEIJE-UHFFFAOYSA-N	CN(CCS(=O)(=O)c1cc(Cl)ccc1Cl)Cc2ccccc2C	BroadT	BRD-K01367395	BRD-K01367395-001-05-9	Enamine Ltd.	T5576545			CN(CCS(=O)(=O)c1cc(Cl)ccc1Cl)Cc1ccccc1C	InChI=1S/C17H19Cl2NO2S/c1-13-5-3-4-6-14(13)12-20(2)9-10-23(21,22)17-11-15(18)7-8-16(17)19/h3-8,11H,9-10,12H2,1-2H3	FGXJBGBJAVEIJE-UHFFFAOYSA-N	371.051354968							121334
MLS000553333	LSM-44429	SID17431627, BRD-K67195390	2829688	InChI=1S/C24H18N4O4S2/c1-13-19(22(31)28(25(13)3)15-9-5-4-6-10-15)27-23(32)20(34-24(27)33)18-16-11-7-8-12-17(16)26(14(2)29)21(18)30/h4-12H,1-3H3/b20-18-	OVIBMPSBOYHXAT-ZZEZOPTASA-N	CN1N(C(=O)C(=C1C)N2C(=S)S\C(=C\3/C(=O)N(C(=O)C)c4ccccc34)\C2=O)c5ccccc5	BroadT	BRD-K67195390	BRD-K67195390-001-05-0	Asinex Ltd.	BAS 00778083			CC(=O)N1C(=O)\C(c2ccccc12)=C1/SC(=S)N(C1=O)c1c(C)n(C)n(-c2ccccc2)c1=O	InChI=1S/C24H18N4O4S2/c1-13-19(22(31)28(25(13)3)15-9-5-4-6-10-15)27-23(32)20(34-24(27)33)18-16-11-7-8-12-17(16)26(14(2)29)21(18)30/h4-12H,1-3H3/b20-18-	OVIBMPSBOYHXAT-ZZEZOPTASA-N	490.076946476							
SMR000025311	LSM-32779	SID4242756, SID24839285, BRD-A45090852	3237570	InChI=1S/C23H24ClN3O6/c1-31-19-10-17-18(11-20(19)32-2)26(13-21(28)25-15-6-3-5-14(24)9-15)23(30)27(22(17)29)12-16-7-4-8-33-16/h3,5-6,9-11,16H,4,7-8,12-13H2,1-2H3,(H,25,28)	MZDMDBABTAJBET-UHFFFAOYSA-N	COc1cc2N(CC(=O)Nc3cccc(Cl)c3)C(=O)N(CC4CCCO4)C(=O)c2cc1OC	BroadT	BRD-A45090852	BRD-A45090852-001-05-3	ChemDiv Inc.	C260-2659			COc1cc2n(CC(=O)Nc3cccc(Cl)c3)c(=O)n(CC3CCCO3)c(=O)c2cc1OC	InChI=1S/C23H24ClN3O6/c1-31-19-10-17-18(11-20(19)32-2)26(13-21(28)25-15-6-3-5-14(24)9-15)23(30)27(22(17)29)12-16-7-4-8-33-16/h3,5-6,9-11,16H,4,7-8,12-13H2,1-2H3,(H,25,28)	MZDMDBABTAJBET-UHFFFAOYSA-N	473.135363228							121336
MLS000777055	LSM-44430	SID26670776, BRD-K27430870	5513575	InChI=1S/C24H15N3O4S/c25-21-18(12-17-9-10-20(31-17)15-7-4-8-16(11-15)23(29)30)22(28)26-24-27(21)19(13-32-24)14-5-2-1-3-6-14/h1-13,25H,(H,29,30)/b18-12+,25-21?	NXVLUZVMQGFUFA-SCORJZKRSA-N	OC(=O)c1cccc(c1)c2oc(\C=C\3/C(=N)N4C(=NC3=O)SC=C4c5ccccc5)cc2	BroadT	BRD-K27430870	BRD-K27430870-001-07-5	InterBioScreen Ltd.	STOCK2S-36933			OC(=O)c1cccc(c1)-c1ccc(\C=C2\C(=O)N=C3SC=C(N3C2=N)c2ccccc2)o1	InChI=1S/C24H15N3O4S/c25-21-18(12-17-9-10-20(31-17)15-7-4-8-16(11-15)23(29)30)22(28)26-24-27(21)19(13-32-24)14-5-2-1-3-6-14/h1-13,25H,(H,29,30)/b18-12+,25-21?	NXVLUZVMQGFUFA-SCORJZKRSA-N	441.07832668							
Phenanthridine-6-thiol	LSM-32781	SID26664654, BRD-K06857049	4329248	InChI=1S/C13H9NS/c15-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)14-13/h1-8H,(H,14,15)	NCIDEKDUBRWLJO-UHFFFAOYSA-N	Sc1nc2ccccc2c3ccccc13	BroadT	BRD-K06857049	BRD-K06857049-001-05-4	National Cancer Institute Chemotherapeutic Agents Repository	6(5H)-Phenanthridinethione 98857			Sc1nc2ccccc2c2ccccc12	InChI=1S/C13H9NS/c15-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)14-13/h1-8H,(H,14,15)	NCIDEKDUBRWLJO-UHFFFAOYSA-N	211.045569988							121338
STK563112	LSM-32782	SID863936, BRD-K78149219	665193	InChI=1S/C22H24N2O4/c1-27-18-9-10-19-15(13-18)12-16(21(25)23-19)14-24(17-6-3-2-4-7-17)22(26)20-8-5-11-28-20/h5,8-13,17H,2-4,6-7,14H2,1H3,(H,23,25)	IXCINVHJYGJTMJ-UHFFFAOYSA-N	COc1ccc2nc(O)c(CN(C3CCCCC3)C(=O)c4occc4)cc2c1	BroadT	BRD-K78149219	BRD-K78149219-001-05-3	InterBioScreen Ltd.	STOCK4S-96844			COc1ccc2nc(O)c(CN(C3CCCCC3)C(=O)c3ccco3)cc2c1	InChI=1S/C22H24N2O4/c1-27-18-9-10-19-15(13-18)12-16(21(25)23-19)14-24(17-6-3-2-4-7-17)22(26)20-8-5-11-28-20/h5,8-13,17H,2-4,6-7,14H2,1H3,(H,23,25)	IXCINVHJYGJTMJ-UHFFFAOYSA-N	380.173607268							121339
SMR000272719	LSM-32783	SID24801254, BRD-A64874602	3176334	InChI=1S/C24H34N4O4S/c1-3-27(4-2)7-8-28(24(33)25-15-19-6-5-9-30-19)16-18-12-17-13-21-22(32-11-10-31-21)14-20(17)26-23(18)29/h12-14,19H,3-11,15-16H2,1-2H3,(H,25,33)(H,26,29)	QICCVORXDPWWGA-UHFFFAOYSA-N	CCN(CC)CCN(Cc1cc2cc3OCCOc3cc2nc1O)C(=NCC4CCCO4)S	BroadT	BRD-A64874602	BRD-A64874602-001-05-9	Asinex Ltd.	ASN 03776856			CCN(CC)CCN(Cc1cc2cc3OCCOc3cc2nc1O)C(S)=NCC1CCCO1	InChI=1S/C24H34N4O4S/c1-3-27(4-2)7-8-28(24(33)25-15-19-6-5-9-30-19)16-18-12-17-13-21-22(32-11-10-31-21)14-20(17)26-23(18)29/h12-14,19H,3-11,15-16H2,1-2H3,(H,25,33)(H,26,29)	QICCVORXDPWWGA-UHFFFAOYSA-N	474.230076298							121340
ST042677	LSM-3404	BRD-K63175663, SID87457114, SID99495710	669117	InChI=1S/C16H16N2O3/c1-11(19)17-13-4-3-5-14(10-13)18-16(20)12-6-8-15(21-2)9-7-12/h3-10H,1-2H3,(H,17,19)(H,18,20)	IVYWSOWWXLXCLS-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)Nc2cccc(NC(=O)C)c2	BroadT	BRD-K63175663	BRD-K63175663-001-02-3	Broad Institute of MIT and Harvard	BRD-K63175663			COc1ccc(cc1)C(=O)Nc1cccc(NC(C)=O)c1	InChI=1S/C16H16N2O3/c1-11(19)17-13-4-3-5-14(10-13)18-16(20)12-6-8-15(21-2)9-7-12/h3-10H,1-2H3,(H,17,19)(H,18,20)	IVYWSOWWXLXCLS-UHFFFAOYSA-N	284.116092392							93102
MLS000098149	LSM-32784	SID3717600, BRD-K98040878	2349433	InChI=1S/C20H18ClN3O4S/c21-16-8-4-15(5-9-16)19-22-23-20(28-19)18(25)14-6-10-17(11-7-14)29(26,27)24-12-2-1-3-13-24/h4-11H,1-3,12-13H2	NFSONIZEOOZGHR-UHFFFAOYSA-N	Clc1ccc(cc1)c2oc(nn2)C(=O)c3ccc(cc3)S(=O)(=O)N4CCCCC4	BroadT	BRD-K98040878	BRD-K98040878-001-04-5	Enamine Ltd.	T0508-3723			Clc1ccc(cc1)-c1nnc(o1)C(=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1	InChI=1S/C20H18ClN3O4S/c21-16-8-4-15(5-9-16)19-22-23-20(28-19)18(25)14-6-10-17(11-7-14)29(26,27)24-12-2-1-3-13-24/h4-11H,1-3,12-13H2	NFSONIZEOOZGHR-UHFFFAOYSA-N	431.070654486							121341
MLS000416851	LSM-32785	SID22408911, BRD-K04116137	2522066	InChI=1S/C17H20N2O4/c1-4-8-19-11(2)9-14(12(19)3)15(20)10-23-17(22)13-6-5-7-18-16(13)21/h5-7,9H,4,8,10H2,1-3H3,(H,18,21)	PFOFUWYTBQFUGI-UHFFFAOYSA-N	CCCn1c(C)cc(C(=O)COC(=O)c2cccnc2O)c1C	BroadT	BRD-K04116137	BRD-K04116137-001-06-8	Enamine Ltd.	T5315466			CCCn1c(C)cc(C(=O)COC(=O)c2cccnc2O)c1C	InChI=1S/C17H20N2O4/c1-4-8-19-11(2)9-14(12(19)3)15(20)10-23-17(22)13-6-5-7-18-16(13)21/h5-7,9H,4,8,10H2,1-3H3,(H,18,21)	PFOFUWYTBQFUGI-UHFFFAOYSA-N	316.14230714							121342
SMR000186640	LSM-32786	SID17411647, BRD-A62263850	2857215	InChI=1S/C25H27NO6S/c1-15(2)13-22(26-33(29,30)18-10-7-16(3)8-11-18)25(28)31-17-9-12-20-19-5-4-6-21(19)24(27)32-23(20)14-17/h7-12,14-15,22,26H,4-6,13H2,1-3H3	DFDYEYULIXRTID-UHFFFAOYSA-N	CC(C)CC(NS(=O)(=O)c1ccc(C)cc1)C(=O)Oc2ccc3C4=C(CCC4)C(=O)Oc3c2	BroadT	BRD-A62263850	BRD-A62263850-001-05-6	ChemBridge Corporation	5636607			CC(C)CC(NS(=O)(=O)c1ccc(C)cc1)C(=O)Oc1ccc2c3CCCc3c(=O)oc2c1	InChI=1S/C25H27NO6S/c1-15(2)13-22(26-33(29,30)18-10-7-16(3)8-11-18)25(28)31-17-9-12-20-19-5-4-6-21(19)24(27)32-23(20)14-17/h7-12,14-15,22,26H,4-6,13H2,1-3H3	DFDYEYULIXRTID-UHFFFAOYSA-N	469.155908284							121343
ST4016860	LSM-32787	SID22403839, BRD-K21269532	759107	InChI=1S/C14H11Cl3N2O/c15-14(16,17)13(20)19-12-8-6-11(7-9-12)18-10-4-2-1-3-5-10/h1-9,18H,(H,19,20)	DXWLHYHAGCVSIA-UHFFFAOYSA-N	ClC(Cl)(Cl)C(=O)Nc1ccc(Nc2ccccc2)cc1	BroadT	BRD-K21269532	BRD-K21269532-001-05-7	ChemBridge Corporation	6633889			ClC(Cl)(Cl)C(=O)Nc1ccc(Nc2ccccc2)cc1	InChI=1S/C14H11Cl3N2O/c15-14(16,17)13(20)19-12-8-6-11(7-9-12)18-10-4-2-1-3-5-10/h1-9,18H,(H,19,20)	DXWLHYHAGCVSIA-UHFFFAOYSA-N	327.993696122							121344
AC1NK7FL	LSM-32788	SID24827525, BRD-A40812237	4883528	InChI=1S/C19H23N3O2/c1-13-4-7-16(8-5-13)22-12-15(10-18(22)23)19(24)20-11-17-9-6-14(2)21(17)3/h4-9,15H,10-12H2,1-3H3,(H,20,24)	WUSZFGNXLYQDHA-UHFFFAOYSA-N	Cc1ccc(cc1)N2CC(CC2=O)C(=O)NCc3ccc(C)n3C	BroadT	BRD-A40812237	BRD-A40812237-001-05-1	Enamine Ltd.	T5330828			Cc1ccc(CNC(=O)C2CN(C(=O)C2)c2ccc(C)cc2)n1C	InChI=1S/C19H23N3O2/c1-13-4-7-16(8-5-13)22-12-15(10-18(22)23)19(24)20-11-17-9-6-14(2)21(17)3/h4-9,15H,10-12H2,1-3H3,(H,20,24)	WUSZFGNXLYQDHA-UHFFFAOYSA-N	325.179027006							121345
AC1OA1RU	LSM-32789	SID24823461, BRD-K45531529	6796758	InChI=1S/C22H16F2N4OS/c23-15-11-9-14(10-12-15)13-28-19-8-4-1-5-16(19)20(21(28)29)26-27-22(30)25-18-7-3-2-6-17(18)24/h1-12,29H,13H2,(H,25,30)	FBFWFJCHJCOIJV-UHFFFAOYSA-N	Oc1c(N=NC(=Nc2ccccc2F)S)c3ccccc3n1Cc4ccc(F)cc4	BroadT	BRD-K45531529	BRD-K45531529-001-07-3	ChemDiv Inc.	K784-9227			Oc1c(N=NC(S)=Nc2ccccc2F)c2ccccc2n1Cc1ccc(F)cc1	InChI=1S/C22H16F2N4OS/c23-15-11-9-14(10-12-15)13-28-19-8-4-1-5-16(19)20(21(28)29)26-27-22(30)25-18-7-3-2-6-17(18)24/h1-12,29H,13H2,(H,25,30)	FBFWFJCHJCOIJV-UHFFFAOYSA-N	422.101288262							
SMR000008025	LSM-32790	SID26668212, SID850217, BRD-K13466771	652727	InChI=1S/C18H21ClFN3O4S2/c1-21(2)28(24,25)16-7-8-18(17(19)13-16)22-9-11-23(12-10-22)29(26,27)15-5-3-14(20)4-6-15/h3-8,13H,9-12H2,1-2H3	HJAPVMMLKRVSJW-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(N2CCN(CC2)S(=O)(=O)c3ccc(F)cc3)c(Cl)c1	BroadT	BRD-K13466771	BRD-K13466771-001-05-9	Asinex Ltd.	ASN 07441685			CN(C)S(=O)(=O)c1ccc(N2CCN(CC2)S(=O)(=O)c2ccc(F)cc2)c(Cl)c1	InChI=1S/C18H21ClFN3O4S2/c1-21(2)28(24,25)16-7-8-18(17(19)13-16)22-9-11-23(12-10-22)29(26,27)15-5-3-14(20)4-6-15/h3-8,13H,9-12H2,1-2H3	HJAPVMMLKRVSJW-UHFFFAOYSA-N	461.064603472							121347
MLS000723172	LSM-32791	SID17515113, BRD-K38129841	3613987	InChI=1S/C14H13N3O/c1-11-3-5-13(6-4-11)18-10-12-9-17-8-2-7-15-14(17)16-12/h2-9H,10H2,1H3	DDEWCEXHOVGPSV-UHFFFAOYSA-N	Cc1ccc(OCc2cn3cccnc3n2)cc1	BroadT	BRD-K38129841	BRD-K38129841-001-05-0	Life Chemicals Inc.	F1177-0023			Cc1ccc(OCc2cn3cccnc3n2)cc1	InChI=1S/C14H13N3O/c1-11-3-5-13(6-4-11)18-10-12-9-17-8-2-7-15-14(17)16-12/h2-9H,10H2,1H3	DDEWCEXHOVGPSV-UHFFFAOYSA-N	239.105862066							121348
MLS000595392	LSM-32792	SID14743552, BRD-K31555375	920390	InChI=1S/C14H18FN3S/c15-11-7-9-12(10-8-11)16-14(19)18-17-13-5-3-1-2-4-6-13/h7-10H,1-6H2,(H2,16,18,19)	OEXXLFXJKWWZAS-UHFFFAOYSA-N	Fc1ccc(NC(=NN=C2CCCCCC2)S)cc1	BroadT	BRD-K31555375	BRD-K31555375-001-05-7	InterBioScreen Ltd.	STOCK2S-21829			Fc1ccc(NC(S)=NN=C2CCCCCC2)cc1	InChI=1S/C14H18FN3S/c15-11-7-9-12(10-8-11)16-14(19)18-17-13-5-3-1-2-4-6-13/h7-10H,1-6H2,(H2,16,18,19)	OEXXLFXJKWWZAS-UHFFFAOYSA-N	279.120546496							121349
SMR000074456	LSM-32793	SID24271775, SID4261895, BRD-K71902827	2162441	InChI=1S/C14H19N5O3S2/c1-2-3-4-12-17-14(19-18-12)23-9-13(20)16-10-5-7-11(8-6-10)24(15,21)22/h5-8H,2-4,9H2,1H3,(H,16,20)(H2,15,21,22)(H,17,18,19)	WYQAGVGFMRRUEE-UHFFFAOYSA-N	CCCCc1n[nH]c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)n1	BroadT	BRD-K71902827	BRD-K71902827-001-05-6	ChemBridge Corporation	7665487			CCCCc1n[nH]c(SCC(=O)Nc2ccc(cc2)S(N)(=O)=O)n1	InChI=1S/C14H19N5O3S2/c1-2-3-4-12-17-14(19-18-12)23-9-13(20)16-10-5-7-11(8-6-10)24(15,21)22/h5-8H,2-4,9H2,1H3,(H,16,20)(H2,15,21,22)(H,17,18,19)	WYQAGVGFMRRUEE-UHFFFAOYSA-N	369.092930898							121350
SMR000288012	LSM-32794	SID24804356, BRD-K11234209	3223626	InChI=1S/C26H30FN5O2S/c1-34-23-8-6-22(7-9-23)30-14-16-31(17-15-30)25(33)18-29-10-12-32(13-11-29)26-28-24(19-35-26)20-2-4-21(27)5-3-20/h2-9,19H,10-18H2,1H3	DTABNUPKFGPCQC-UHFFFAOYSA-N	COc1ccc(cc1)N2CCN(CC2)C(=O)CN3CCN(CC3)c4nc(cs4)c5ccc(F)cc5	BroadT	BRD-K11234209	BRD-K11234209-001-05-5	Asinex Ltd.	ASN 06588216			COc1ccc(cc1)N1CCN(CC1)C(=O)CN1CCN(CC1)c1nc(cs1)-c1ccc(F)cc1	InChI=1S/C26H30FN5O2S/c1-34-23-8-6-22(7-9-23)30-14-16-31(17-15-30)25(33)18-29-10-12-32(13-11-29)26-28-24(19-35-26)20-2-4-21(27)5-3-20/h2-9,19H,10-18H2,1H3	DTABNUPKFGPCQC-UHFFFAOYSA-N	495.21042414							121351
1-[1-(4-Hydroxy-piperidine-1-carbonyl)-cyclohexyl]-3-(2-methoxy-phenyl)-urea	LSM-32795	SID849571, BRD-K73078103	652071	InChI=1S/C20H29N3O4/c1-27-17-8-4-3-7-16(17)21-19(26)22-20(11-5-2-6-12-20)18(25)23-13-9-15(24)10-14-23/h3-4,7-8,15,24H,2,5-6,9-14H2,1H3,(H2,21,22,26)	ZVNOPWORKUQDMY-UHFFFAOYSA-N	COc1ccccc1NC(=O)NC2(CCCCC2)C(=O)N3CCC(O)CC3	BroadT	BRD-K73078103	BRD-K73078103-001-05-8	Asinex Ltd.	ASN 08830941			COc1ccccc1NC(=O)NC1(CCCCC1)C(=O)N1CCC(O)CC1	InChI=1S/C20H29N3O4/c1-27-17-8-4-3-7-16(17)21-19(26)22-20(11-5-2-6-12-20)18(25)23-13-9-15(24)10-14-23/h3-4,7-8,15,24H,2,5-6,9-14H2,1H3,(H2,21,22,26)	ZVNOPWORKUQDMY-UHFFFAOYSA-N	375.215806438							121352
MLS000536229	LSM-32796	SID17388402, BRD-A29833735	3352440	InChI=1S/C25H19ClN4OS2/c1-14-16(26)10-7-12-17(14)29-23(31)22-21(27)20(24(33-22)28-15-8-3-2-4-9-15)25-30-18-11-5-6-13-19(18)32-25/h2-13,22,27-28H,1H3,(H,29,31)	LWYDPGRQTYLOHQ-UHFFFAOYSA-N	Cc1c(Cl)cccc1NC(=O)C2SC(=C(C2=N)c3nc4ccccc4s3)Nc5ccccc5	BroadT	BRD-A29833735	BRD-A29833735-001-06-7	Enamine Ltd.	T0509-4969			Cc1c(Cl)cccc1NC(=O)C1SC(Nc2ccccc2)=C(C1=N)c1nc2ccccc2s1	InChI=1S/C25H19ClN4OS2/c1-14-16(26)10-7-12-17(14)29-23(31)22-21(27)20(24(33-22)28-15-8-3-2-4-9-15)25-30-18-11-5-6-13-19(18)32-25/h2-13,22,27-28H,1H3,(H,29,31)	LWYDPGRQTYLOHQ-UHFFFAOYSA-N	490.068880358							
2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid	LSM-32797	SID26665118, BRD-K23529342	246853	InChI=1S/C16H17ClN2O3/c1-2-3-8-22-15-7-5-12(10-18-15)19-14-9-11(17)4-6-13(14)16(20)21/h4-7,9-10,19H,2-3,8H2,1H3,(H,20,21)	VJFNMPCCIPJOHB-UHFFFAOYSA-N	CCCCOc1ccc(Nc2cc(Cl)ccc2C(=O)O)cn1	BroadT	BRD-K23529342	BRD-K23529342-001-05-2	National Cancer Institute Chemotherapeutic Agents Repository	60423			CCCCOc1ccc(Nc2cc(Cl)ccc2C(O)=O)cn1	InChI=1S/C16H17ClN2O3/c1-2-3-8-22-15-7-5-12(10-18-15)19-14-9-11(17)4-6-13(14)16(20)21/h4-7,9-10,19H,2-3,8H2,1H3,(H,20,21)	VJFNMPCCIPJOHB-UHFFFAOYSA-N	320.092770134							121354
MLS000575102	LSM-44431	SID17415247, BRD-K83179299	1311579	InChI=1S/C19H14N2O3S/c22-18(9-7-13-6-8-16-17(10-13)24-12-23-16)21-19-20-15(11-25-19)14-4-2-1-3-5-14/h1-11H,12H2,(H,20,21,22)/b9-7+	CIOABIWMQSVPTA-VQHVLOKHSA-N	O=C(Nc1nc(cs1)c2ccccc2)\C=C\c3ccc4OCOc4c3	BroadT	BRD-K83179299	BRD-K83179299-001-06-4	ChemBridge Corporation	6809457			O=C(Nc1nc(cs1)-c1ccccc1)\C=C\c1ccc2OCOc2c1	InChI=1S/C19H14N2O3S/c22-18(9-7-13-6-8-16-17(10-13)24-12-23-16)21-19-20-15(11-25-19)14-4-2-1-3-5-14/h1-11H,12H2,(H,20,21,22)/b9-7+	CIOABIWMQSVPTA-VQHVLOKHSA-N	350.072513018							
N-[(4-Bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]-n'-{4-ethoxy-2-nitrophenyl}thiourea	LSM-32799	SID22402087, BRD-K17833952	5009707	InChI=1S/C14H14BrN5O4S/c1-3-24-8-4-5-10(11(6-8)20(22)23)17-14(25)18-13(21)12-9(15)7-16-19(12)2/h4-7H,3H2,1-2H3,(H2,17,18,21,25)	ZLWWJZPOBFTGCW-UHFFFAOYSA-N	CCOc1ccc(NC(=S)NC(=O)c2c(Br)cnn2C)c(c1)[N+](=O)[O-]	BroadT	BRD-K17833952	BRD-K17833952-001-05-7	Specs	AK-968/40220163			CCOc1ccc(NC(=S)NC(=O)c2c(Br)cnn2C)c(c1)[N+]([O-])=O	InChI=1S/C14H14BrN5O4S/c1-3-24-8-4-5-10(11(6-8)20(22)23)17-14(25)18-13(21)12-9(15)7-16-19(12)2/h4-7H,3H2,1-2H3,(H2,17,18,21,25)	ZLWWJZPOBFTGCW-UHFFFAOYSA-N	426.994987268							121356
SMR000040874	LSM-32800	SID858599, BRD-K03810012	659906	InChI=1S/C20H14ClN5O2/c21-13-7-5-12(6-8-13)20(27)28-10-9-26-18(23)14(11-22)17-19(26)25-16-4-2-1-3-15(16)24-17/h1-8H,9-10,23H2	BTHBBLZEGFZFSM-UHFFFAOYSA-N	Nc1c(C#N)c2nc3ccccc3nc2n1CCOC(=O)c4ccc(Cl)cc4	BroadT	BRD-K03810012	BRD-K03810012-001-06-7	InterBioScreen Ltd.	STOCK2S-51770			Nc1c(C#N)c2nc3ccccc3nc2n1CCOC(=O)c1ccc(Cl)cc1	InChI=1S/C20H14ClN5O2/c21-13-7-5-12(6-8-13)20(27)28-10-9-26-18(23)14(11-22)17-19(26)25-16-4-2-1-3-15(16)24-17/h1-8H,9-10,23H2	BTHBBLZEGFZFSM-UHFFFAOYSA-N	391.083602448							121357
MLS000588653	LSM-32801	SID17511848, BRD-K64190772	1912248	InChI=1S/C20H14F3NO5/c1-10-16(8-6-13-12-3-2-4-14(12)19(25)29-18(10)13)28-17-7-5-11(20(21,22)23)9-15(17)24(26)27/h5-9H,2-4H2,1H3	HQIBXJYVNKFCBC-UHFFFAOYSA-N	Cc1c(Oc2ccc(cc2[N+](=O)[O-])C(F)(F)F)ccc3C4=C(CCC4)C(=O)Oc13	BroadT	BRD-K64190772	BRD-K64190772-001-05-2	InterBioScreen Ltd.	STOCK1S-92604			Cc1c(Oc2ccc(cc2[N+]([O-])=O)C(F)(F)F)ccc2c3CCCc3c(=O)oc12	InChI=1S/C20H14F3NO5/c1-10-16(8-6-13-12-3-2-4-14(12)19(25)29-18(10)13)28-17-7-5-11(20(21,22)23)9-15(17)24(26)27/h5-9H,2-4H2,1H3	HQIBXJYVNKFCBC-UHFFFAOYSA-N	405.082407158							121358
AC1NK6PZ	LSM-32802	SID22407200, BRD-A56827406	4883217	InChI=1S/C16H14N2OS3/c1-9-8-10(9)15(19)18-16-17-13(11-4-2-6-20-11)14(22-16)12-5-3-7-21-12/h2-7,9-10H,8H2,1H3,(H,17,18,19)	VYNCMUCZHHZJLJ-UHFFFAOYSA-N	CC1CC1C(=O)Nc2nc(c3cccs3)c(s2)c4cccs4	BroadT	BRD-A56827406	BRD-A56827406-001-05-5	Enamine Ltd.	T5329578			CC1CC1C(=O)Nc1nc(-c2cccs2)c(s1)-c1cccs1	InChI=1S/C16H14N2OS3/c1-9-8-10(9)15(19)18-16-17-13(11-4-2-6-20-11)14(22-16)12-5-3-7-21-12/h2-7,9-10H,8H2,1H3,(H,17,18,19)	VYNCMUCZHHZJLJ-UHFFFAOYSA-N	346.026825158							121359
MLS000117564	LSM-32803	SID7968283, BRD-K44548296	5309325	InChI=1S/C17H21NO6S/c1-22-11-3-10-18-17(19)16-9-6-14(24-16)12-25(20,21)15-7-4-13(23-2)5-8-15/h4-9H,3,10-12H2,1-2H3,(H,18,19)	PGNHEMMGNNRUMA-UHFFFAOYSA-N	COCCCNC(=O)c1oc(CS(=O)(=O)c2ccc(OC)cc2)cc1	BroadT	BRD-K44548296	BRD-K44548296-001-05-3	ChemDiv Inc.	C521-0561			COCCCNC(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)o1	InChI=1S/C17H21NO6S/c1-22-11-3-10-18-17(19)16-9-6-14(24-16)12-25(20,21)15-7-4-13(23-2)5-8-15/h4-9H,3,10-12H2,1-2H3,(H,18,19)	PGNHEMMGNNRUMA-UHFFFAOYSA-N	367.108958092							121360
MLS000114823	LSM-32804	SID7968462, BRD-A09796989	3835861	InChI=1S/C16H16N4/c1-10-4-5-14-12(7-10)15(11-3-2-6-19-9-11)13(8-17)16(18)20-14/h2-3,6,9-10H,4-5,7H2,1H3,(H2,18,20)	QSYBDNXNOJIKML-UHFFFAOYSA-N	CC1CCc2nc(N)c(C#N)c(c2C1)c3cccnc3	BroadT	BRD-A09796989	BRD-A09796989-001-06-3	ChemDiv Inc.	6233-1032			CC1CCc2nc(N)c(C#N)c(-c3cccnc3)c2C1	InChI=1S/C16H16N4/c1-10-4-5-14-12(7-10)15(11-3-2-6-19-9-11)13(8-17)16(18)20-14/h2-3,6,9-10H,4-5,7H2,1H3,(H2,18,20)	QSYBDNXNOJIKML-UHFFFAOYSA-N	264.137496552							121361
2-(2-Cyclohexylidenehydrazinyl)cyclohepta-2,4,6-trien-1-one	LSM-32805	SID26666143, BRD-K57724152	931415	InChI=1S/C13H16N2O/c16-13-10-6-2-5-9-12(13)15-14-11-7-3-1-4-8-11/h2,5-6,9-10H,1,3-4,7-8H2,(H,15,16)	XADINUBCUPOOON-UHFFFAOYSA-N	O=C1C=CC=CC=C1NN=C2CCCCC2	BroadT	BRD-K57724152	BRD-K57724152-001-05-7	InterBioScreen Ltd.	STOCK2S-90751			O=c1cccccc1NN=C1CCCCC1	InChI=1S/C13H16N2O/c16-13-10-6-2-5-9-12(13)15-14-11-7-3-1-4-8-11/h2,5-6,9-10H,1,3-4,7-8H2,(H,15,16)	XADINUBCUPOOON-UHFFFAOYSA-N	216.126263152							121362
F0651-0398	LSM-32806	SID7971760, BRD-K93709973	4299391	InChI=1S/C19H21N3O3S/c1-13-10-16-11-15(4-9-19(16)22(13)3)12-20-26(24,25)18-7-5-17(6-8-18)21-14(2)23/h4-11,20H,12H2,1-3H3,(H,21,23)	WXVMMMZUPCYHGP-UHFFFAOYSA-N	CC(=O)Nc1ccc(cc1)S(=O)(=O)NCc2ccc3c(c2)cc(C)n3C	BroadT	BRD-K93709973	BRD-K93709973-001-05-1	Life Chemicals Inc.	F0651-0398			CC(=O)Nc1ccc(cc1)S(=O)(=O)NCc1ccc2n(C)c(C)cc2c1	InChI=1S/C19H21N3O3S/c1-13-10-16-11-15(4-9-19(16)22(13)3)12-20-26(24,25)18-7-5-17(6-8-18)21-14(2)23/h4-11,20H,12H2,1-3H3,(H,21,23)	WXVMMMZUPCYHGP-UHFFFAOYSA-N	371.130362252							121363
BAS 09528653	LSM-32807	SID846428, BRD-A15779873	648817	InChI=1S/C17H14ClFN2O3/c1-9-5-6-14(22)12(7-9)20-17(23)15-8-13(21-24-15)16-10(18)3-2-4-11(16)19/h2-7,15,22H,8H2,1H3,(H,20,23)	UNGVZHSKMJVWOJ-UHFFFAOYSA-N	Cc1ccc(O)c(NC(=O)C2CC(=NO2)c3c(F)cccc3Cl)c1	BroadT	BRD-A15779873	BRD-A15779873-001-05-2	Asinex Ltd.	BAS 09528653			Cc1ccc(O)c(NC(=O)C2CC(=NO2)c2c(F)cccc2Cl)c1	InChI=1S/C17H14ClFN2O3/c1-9-5-6-14(22)12(7-9)20-17(23)15-8-13(21-24-15)16-10(18)3-2-4-11(16)19/h2-7,15,22H,8H2,1H3,(H,20,23)	UNGVZHSKMJVWOJ-UHFFFAOYSA-N	348.067698238							121364
N-[2,5-Diethoxy-4-(3-phenyl-thioureido)-phenyl]-4-methoxy-benzamide	LSM-32808	SID17408233, BRD-K29272841	1172851	InChI=1S/C25H27N3O4S/c1-4-31-22-16-21(28-25(33)26-18-9-7-6-8-10-18)23(32-5-2)15-20(22)27-24(29)17-11-13-19(30-3)14-12-17/h6-16H,4-5H2,1-3H3,(H,27,29)(H2,26,28,33)	AEGHTOQCTCAWMW-UHFFFAOYSA-N	CCOc1cc(N=C(S)Nc2ccccc2)c(OCC)cc1NC(=O)c3ccc(OC)cc3	BroadT	BRD-K29272841	BRD-K29272841-001-05-9	Asinex Ltd.	ASN 03271003			CCOc1cc(N=C(S)Nc2ccccc2)c(OCC)cc1NC(=O)c1ccc(OC)cc1	InChI=1S/C25H27N3O4S/c1-4-31-22-16-21(28-25(33)26-18-9-7-6-8-10-18)23(32-5-2)15-20(22)27-24(29)17-11-13-19(30-3)14-12-17/h6-16H,4-5H2,1-3H3,(H,27,29)(H2,26,28,33)	AEGHTOQCTCAWMW-UHFFFAOYSA-N	465.172227064							121365
ST50920250	LSM-4230	BRD-K98991361, SID87457115	792012	InChI=1S/C15H13ClN2O2/c1-10(19)17-11-5-4-6-12(9-11)18-15(20)13-7-2-3-8-14(13)16/h2-9H,1H3,(H,17,19)(H,18,20)	WLFFAEBDQNWOJY-UHFFFAOYSA-N	CC(=O)Nc1cccc(NC(=O)c2ccccc2Cl)c1	BroadT	BRD-K98991361	BRD-K98991361-001-02-7	Broad Institute of MIT and Harvard	BRD-K98991361			CC(=O)Nc1cccc(NC(=O)c2ccccc2Cl)c1	InChI=1S/C15H13ClN2O2/c1-10(19)17-11-5-4-6-12(9-11)18-15(20)13-7-2-3-8-14(13)16/h2-9H,1H3,(H,17,19)(H,18,20)	WLFFAEBDQNWOJY-UHFFFAOYSA-N	288.066555386							93733
N-(3-Cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-methyl-benzamide	LSM-32809	SID14726134, BRD-K26249248	958963	InChI=1S/C18H18N2OS/c1-12-6-5-7-13(10-12)17(21)20-18-15(11-19)14-8-3-2-4-9-16(14)22-18/h5-7,10H,2-4,8-9H2,1H3,(H,20,21)	MGTUSCSBWRYSNB-UHFFFAOYSA-N	Cc1cccc(c1)C(=O)Nc2sc3CCCCCc3c2C#N	BroadT	BRD-K26249248	BRD-K26249248-001-05-9	Asinex Ltd.	BAS 04893520			Cc1cccc(c1)C(=O)Nc1sc2CCCCCc2c1C#N	InChI=1S/C18H18N2OS/c1-12-6-5-7-13(10-12)17(21)20-18-15(11-19)14-8-3-2-4-9-16(14)22-18/h5-7,10H,2-4,8-9H2,1H3,(H,20,21)	MGTUSCSBWRYSNB-UHFFFAOYSA-N	310.113983906							121366
SMR000094907	LSM-32810	SID7969280, BRD-K79531896	5309874	InChI=1S/C18H19N5O2/c1-12-6-8-14(9-7-12)20-18(24)16-17(19)23(22-21-16)11-13-4-3-5-15(10-13)25-2/h3-10H,11,19H2,1-2H3,(H,20,24)	HAHGHJJVOORGOK-UHFFFAOYSA-N	COc1cccc(Cn2nnc(C(=O)Nc3ccc(C)cc3)c2N)c1	BroadT	BRD-K79531896	BRD-K79531896-001-04-4	ChemDiv Inc.	C549-0328			COc1cccc(Cn2nnc(C(=O)Nc3ccc(C)cc3)c2N)c1	InChI=1S/C18H19N5O2/c1-12-6-8-14(9-7-12)20-18(24)16-17(19)23(22-21-16)11-13-4-3-5-15(10-13)25-2/h3-10H,11,19H2,1-2H3,(H,20,24)	HAHGHJJVOORGOK-UHFFFAOYSA-N	337.153874898							121367
MLS000043908	LSM-32811	SID4242151, BRD-A27966268	631208	InChI=1S/C18H17NO4S/c20-18-10-13-11-24(21,22)12-17(13)19(18)14-6-8-16(9-7-14)23-15-4-2-1-3-5-15/h1-9,13,17H,10-12H2	GDLCPBKSWGLXRT-UHFFFAOYSA-N	O=C1CC2CS(=O)(=O)CC2N1c3ccc(Oc4ccccc4)cc3	BroadT	BRD-A27966268	BRD-A27966268-001-06-2	ChemDiv Inc.	8012-7231			O=C1CC2CS(=O)(=O)CC2N1c1ccc(Oc2ccccc2)cc1	InChI=1S/C18H17NO4S/c20-18-10-13-11-24(21,22)12-17(13)19(18)14-6-8-16(9-7-14)23-15-4-2-1-3-5-15/h1-9,13,17H,10-12H2	GDLCPBKSWGLXRT-UHFFFAOYSA-N	343.087828724							121368
T0516-6854	LSM-32812	SID16952729, BRD-K51324879	4660909	InChI=1S/C20H20N2O7S/c23-19(21-14-5-6-14)12-29-20(24)13-1-3-15(4-2-13)22-30(25,26)16-7-8-17-18(11-16)28-10-9-27-17/h1-4,7-8,11,14,22H,5-6,9-10,12H2,(H,21,23)	SWMPVBUFKXOMHF-UHFFFAOYSA-N	O=C(COC(=O)c1ccc(NS(=O)(=O)c2ccc3OCCOc3c2)cc1)NC4CC4	BroadT	BRD-K51324879	BRD-K51324879-001-05-4	Enamine Ltd.	T0516-6854			O=C(COC(=O)c1ccc(NS(=O)(=O)c2ccc3OCCOc3c2)cc1)NC1CC1	InChI=1S/C20H20N2O7S/c23-19(21-14-5-6-14)12-29-20(24)13-1-3-15(4-2-13)22-30(25,26)16-7-8-17-18(11-16)28-10-9-27-17/h1-4,7-8,11,14,22H,5-6,9-10,12H2,(H,21,23)	SWMPVBUFKXOMHF-UHFFFAOYSA-N	432.09912169							121369
SMR000075879	LSM-32813	SID4261071, BRD-K70204320	977415	InChI=1S/C17H14N4S/c1-13-19-20-17(21(13)16-9-3-2-4-10-16)22-12-15-8-6-5-7-14(15)11-18/h2-10H,12H2,1H3	LYPDMUWLXFBPQY-UHFFFAOYSA-N	Cc1nnc(SCc2ccccc2C#N)n1c3ccccc3	BroadT	BRD-K70204320	BRD-K70204320-001-06-8	ChemBridge Corporation	7749985			Cc1nnc(SCc2ccccc2C#N)n1-c1ccccc1	InChI=1S/C17H14N4S/c1-13-19-20-17(21(13)16-9-3-2-4-10-16)22-12-15-8-6-5-7-14(15)11-18/h2-10H,12H2,1H3	LYPDMUWLXFBPQY-UHFFFAOYSA-N	306.093917178							121370
F1016-0667	LSM-32814	SID17514311, BRD-A51567286	4068843	InChI=1S/C23H19N3O2S2/c1-15-8-10-16(11-9-15)19-13-18(21-7-4-12-29-21)25-26(19)22(27)14-30-23-24-17-5-2-3-6-20(17)28-23/h2-12,19H,13-14H2,1H3	XYAMIYHXMKVHPN-UHFFFAOYSA-N	Cc1ccc(cc1)C2CC(=NN2C(=O)CSc3oc4ccccc4n3)c5cccs5	BroadT	BRD-A51567286	BRD-A51567286-001-05-7	Life Chemicals Inc.	F1016-0667			Cc1ccc(cc1)C1CC(=NN1C(=O)CSc1nc2ccccc2o1)c1cccs1	InChI=1S/C23H19N3O2S2/c1-15-8-10-16(11-9-15)19-13-18(21-7-4-12-29-21)25-26(19)22(27)14-30-23-24-17-5-2-3-6-20(17)28-23/h2-12,19H,13-14H2,1H3	XYAMIYHXMKVHPN-UHFFFAOYSA-N	433.091868258							121371
AC1N6C7F	LSM-32815	BRD-K94985696	4232615	InChI=1S/C23H26N4O2/c1-16(2)21-13-17(3)5-10-22(21)29-14-23(28)26-25-18(4)19-6-8-20(9-7-19)27-12-11-24-15-27/h5-13,15-16H,14H2,1-4H3,(H,26,28)	IIGUMTCBYXZMRP-UHFFFAOYSA-N	CC(C)c1cc(C)ccc1OCC(=O)NN=C(C)c2ccc(cc2)n3ccnc3	BroadT	BRD-K94985696	BRD-K94985696-001-05-2	Enamine Ltd.	T0505-8848			CC(C)c1cc(C)ccc1OCC(=O)NN=C(C)c1ccc(cc1)-n1ccnc1	InChI=1S/C23H26N4O2/c1-16(2)21-13-17(3)5-10-22(21)29-14-23(28)26-25-18(4)19-6-8-20(9-7-19)27-12-11-24-15-27/h5-13,15-16H,14H2,1-4H3,(H,26,28)	IIGUMTCBYXZMRP-UHFFFAOYSA-N	390.205576112							121372
MLS000117612	LSM-32816	SID7965585, BRD-K72054602	5307710	InChI=1S/C21H29N3O4S/c1-5-23-8-10-24(11-9-23)20(25)14-29-13-17-15(2)28-21(22-17)16-6-7-18(26-3)19(12-16)27-4/h6-7,12H,5,8-11,13-14H2,1-4H3	HUNNUZABMQGNGT-UHFFFAOYSA-N	CCN1CCN(CC1)C(=O)CSCc2nc(oc2C)c3ccc(OC)c(OC)c3	BroadT	BRD-K72054602	BRD-K72054602-001-04-9	ChemDiv Inc.	C523-0563			CCN1CCN(CC1)C(=O)CSCc1nc(oc1C)-c1ccc(OC)c(OC)c1	InChI=1S/C21H29N3O4S/c1-5-23-8-10-24(11-9-23)20(25)14-29-13-17-15(2)28-21(22-17)16-6-7-18(26-3)19(12-16)27-4/h6-7,12H,5,8-11,13-14H2,1-4H3	HUNNUZABMQGNGT-UHFFFAOYSA-N	419.187877128							121373
NSC217091	LSM-44943	BRD-K49403449, SID99495716	9555025	InChI=1S/C17H23N3O2/c1-13(21)19-16-9-7-15(8-10-16)12-18-20-17(22)11-14-5-3-2-4-6-14/h7-10,12,14H,2-6,11H2,1H3,(H,19,21)(H,20,22)/b18-12+	OFLMBTVBZWBGTQ-LDADJPATSA-N	CC(=O)Nc1ccc(\C=N\NC(=O)CC2CCCCC2)cc1	BroadT	BRD-K49403449	BRD-K49403449-001-02-9	Broad Institute of MIT and Harvard	BRD-K49403449			CC(=O)Nc1ccc(cc1)\C=N\NC(=O)CC1CCCCC1	InChI=1S/C17H23N3O2/c1-13(21)19-16-9-7-15(8-10-16)12-18-20-17(22)11-14-5-3-2-4-6-14/h7-10,12,14H,2-6,11H2,1H3,(H,19,21)(H,20,22)/b18-12+	OFLMBTVBZWBGTQ-LDADJPATSA-N	301.179027006							
NSC 21506	LSM-32817	SID17513523, BRD-K67688670	79493	InChI=1S/C12H12N2O3/c1-3-17-12(16)9-7-13-10-6-8(2)4-5-14(10)11(9)15/h4-7H,3H2,1-2H3	BHAQEKYGTIQOGF-UHFFFAOYSA-N	CCOC(=O)C1=CN=C2C=C(C)C=CN2C1=O	BroadT	BRD-K67688670	BRD-K67688670-001-05-5	InterBioScreen Ltd.	STOCK4S-25487			CCOC(=O)c1cnc2cc(C)ccn2c1=O	InChI=1S/C12H12N2O3/c1-3-17-12(16)9-7-13-10-6-8(2)4-5-14(10)11(9)15/h4-7H,3H2,1-2H3	BHAQEKYGTIQOGF-UHFFFAOYSA-N	232.084792264							121374
ZINC05505278	LSM-32818	BRD-M24316212	3552933	InChI=1S/C18H18N4O3S2/c1-22(2)27(24,25)14-7-5-6-13(10-14)21-17(23)11-26-18-15-8-3-4-9-16(15)19-12-20-18/h3-10,12H,11H2,1-2H3,(H,21,23)	DJKJNZZSMRGFNJ-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cccc(NC(=O)CSc2ncnc3ccccc23)c1	BroadT	BRD-M24316212	BRD-M24316212-001-05-8	Enamine Ltd.	T0511-9199		CN(C)C=O.CN(C)S(=O)(=O)c1cccc(NC(=O)CSc2ncnc3ccccc23)c1	CN(C)C=O.CN(C)S(=O)(=O)c1cccc(NC(=O)CSc2ncnc3ccccc23)c1	InChI=1S/C18H18N4O3S2.C3H7NO/c1-22(2)27(24,25)14-7-5-6-13(10-14)21-17(23)11-26-18-15-8-3-4-9-16(15)19-12-20-18;1-4(2)3-5/h3-10,12H,11H2,1-2H3,(H,21,23);3H,1-2H3	KFCWFJKUZJHPLE-UHFFFAOYSA-N	402.082031856							121375
AC1OB9S8	LSM-32819	SID24815348, BRD-K58401476	6817722	InChI=1S/C22H17FN4OS/c23-17-11-5-6-12-18(17)24-22(29)26-25-20-16-10-4-7-13-19(16)27(21(20)28)14-15-8-2-1-3-9-15/h1-13,28H,14H2,(H,24,29)	KKUVBNDJMHSUHC-UHFFFAOYSA-N	Oc1c(N=NC(=Nc2ccccc2F)S)c3ccccc3n1Cc4ccccc4	BroadT	BRD-K58401476	BRD-K58401476-001-06-8	ChemDiv Inc.	K784-8158			Oc1c(N=NC(S)=Nc2ccccc2F)c2ccccc2n1Cc1ccccc1	InChI=1S/C22H17FN4OS/c23-17-11-5-6-12-18(17)24-22(29)26-25-20-16-10-4-7-13-19(16)27(21(20)28)14-15-8-2-1-3-9-15/h1-13,28H,14H2,(H,24,29)	KKUVBNDJMHSUHC-UHFFFAOYSA-N	404.110710094							
MLS000574634	LSM-32820	SID17506932, BRD-A65183678	2910654	InChI=1S/C23H23ClN2O3S2/c1-15-4-13-22(16(2)14-15)26-31(28,29)21-11-7-19(8-12-21)25-23(27)17(3)30-20-9-5-18(24)6-10-20/h4-14,17,26H,1-3H3,(H,25,27)	HLDFWPIEUAKEQL-UHFFFAOYSA-N	CC(Sc1ccc(Cl)cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3ccc(C)cc3C	BroadT	BRD-A65183678	BRD-A65183678-001-05-3	ChemBridge Corporation	6695383			CC(Sc1ccc(Cl)cc1)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(C)cc1C	InChI=1S/C23H23ClN2O3S2/c1-15-4-13-22(16(2)14-15)26-31(28,29)21-11-7-19(8-12-21)25-23(27)17(3)30-20-9-5-18(24)6-10-20/h4-14,17,26H,1-3H3,(H,25,27)	HLDFWPIEUAKEQL-UHFFFAOYSA-N	474.083861706							121377
SMR000111185	LSM-32821	SID7976488, BRD-K81234354	54676686	InChI=1S/C20H21N3O5S/c1-12(2)11-23-15-9-5-3-7-13(15)18(24)17(20(23)26)19(25)22-14-8-4-6-10-16(14)29(21,27)28/h3-10,12,24H,11H2,1-2H3,(H,22,25)(H2,21,27,28)	MLWAJOFPYWTUTE-UHFFFAOYSA-N	CC(C)CN1C(=O)C(=C(O)c2ccccc12)C(=O)Nc3ccccc3S(=O)(=O)N	BroadT	BRD-K81234354	BRD-K81234354-001-06-1	ChemBridge Corporation	5573212			CC(C)Cn1c2ccccc2c(O)c(C(=O)Nc2ccccc2S(N)(=O)=O)c1=O	InChI=1S/C20H21N3O5S/c1-12(2)11-23-15-9-5-3-7-13(15)18(24)17(20(23)26)19(25)22-14-8-4-6-10-16(14)29(21,27)28/h3-10,12,24H,11H2,1-2H3,(H,22,25)(H2,21,27,28)	MLWAJOFPYWTUTE-UHFFFAOYSA-N	415.120191492							121378
AC1ME6FR	LSM-15464	BRD-A33355319	2849384	InChI=1S/C20H23NO3/c1-23-18-9-7-17(8-10-18)20(22)19(16-5-3-2-4-6-16)15-21-11-13-24-14-12-21/h2-10,19H,11-15H2,1H3	QOABVBAPHTTZBQ-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)C(CN2CCOCC2)c3ccccc3	BroadT	BRD-A33355319	BRD-A33355319-003-06-5	ChemBridge Corporation	5510287		Cl	COc1ccc(cc1)C(=O)C(CN1CCOCC1)c1ccccc1.Cl	InChI=1S/C20H23NO3.ClH/c1-23-18-9-7-17(8-10-18)20(22)19(16-5-3-2-4-6-16)15-21-11-13-24-14-12-21;/h2-10,19H,11-15H2,1H3;1H	LYGCHFYRYIDJJI-UHFFFAOYSA-N	325.167793606							104106, 104106
ST50072852	LSM-32822	SID7971087, BRD-A48592360	5310378	InChI=1S/C20H20N4O/c25-13-7-12-19-22-20-21-17(15-8-3-1-4-9-15)14-18(24(20)23-19)16-10-5-2-6-11-16/h1-6,8-11,14,18,25H,7,12-13H2,(H,21,22,23)	XATKXXCDPPBZLW-UHFFFAOYSA-N	OCCCc1nc2NC(=CC(c3ccccc3)n2n1)c4ccccc4	BroadT	BRD-A48592360	BRD-A48592360-001-04-3	Life Chemicals Inc.	F1387-0105			OCCCc1nc2NC(=CC(c3ccccc3)n2n1)c1ccccc1	InChI=1S/C20H20N4O/c25-13-7-12-19-22-20-21-17(15-8-3-1-4-9-15)14-18(24(20)23-19)16-10-5-2-6-11-16/h1-6,8-11,14,18,25H,7,12-13H2,(H,21,22,23)	XATKXXCDPPBZLW-UHFFFAOYSA-N	332.1637113							121379
SMR000141074	LSM-44432	SID14746198, BRD-K13888520	2264155	InChI=1S/C14H12N4O4S/c1-8-11(18(20)22-17-8)7-21-12-5-3-2-4-9(12)6-10-13(19)16-14(23)15-10/h2-6H,7H2,1H3,(H2,15,16,19,23)/b10-6-	BJGFRUXVBYNCNU-POHAHGRESA-N	Cc1no[n+]([O-])c1COc2ccccc2\C=C\3/NC(=S)NC3=O	BroadT	BRD-K13888520	BRD-K13888520-001-05-8	ChemBridge Corporation	6036235			Cc1no[n+]([O-])c1COc1ccccc1\C=C1/NC(=S)NC1=O	InChI=1S/C14H12N4O4S/c1-8-11(18(20)22-17-8)7-21-12-5-3-2-4-9(12)6-10-13(19)16-14(23)15-10/h2-6H,7H2,1H3,(H2,15,16,19,23)/b10-6-	BJGFRUXVBYNCNU-POHAHGRESA-N	332.057925594							
STK115556	LSM-32824	SID7972465, BRD-K24595098	807554	InChI=1S/C14H11N3O/c1-2-6-11(7-3-1)10-13-16-14(17-18-13)12-8-4-5-9-15-12/h1-9H,10H2	PWTJEKDYKXTIIR-UHFFFAOYSA-N	C(c1ccccc1)c2onc(n2)c3ccccn3	BroadT	BRD-K24595098	BRD-K24595098-001-05-8	ChemBridge Corporation	6732775			C(c1nc(no1)-c1ccccn1)c1ccccc1	InChI=1S/C14H11N3O/c1-2-6-11(7-3-1)10-13-16-14(17-18-13)12-8-4-5-9-15-12/h1-9H,10H2	PWTJEKDYKXTIIR-UHFFFAOYSA-N	237.090212002							121381
SMR000130394	LSM-32825	SID14737673, BRD-K98579162	9551115	InChI=1S/C23H31N3O5/c1-3-24-10-12-26(13-11-24)22(29)16-30-18-4-5-21-19(14-18)20(28)15-23(31-21)6-8-25(9-7-23)17(2)27/h4-5,14H,3,6-13,15-16H2,1-2H3	SJYQXSKDUDDADR-UHFFFAOYSA-N	CCN1CCN(CC1)C(=O)COc2ccc3OC4(CCN(CC4)C(=O)C)CC(=O)c3c2	BroadT	BRD-K98579162	BRD-K98579162-001-05-4	ChemDiv Inc.	C214-0604			CCN1CCN(CC1)C(=O)COc1ccc2OC3(CCN(CC3)C(C)=O)CC(=O)c2c1	InChI=1S/C23H31N3O5/c1-3-24-10-12-26(13-11-24)22(29)16-30-18-4-5-21-19(14-18)20(28)15-23(31-21)6-8-25(9-7-23)17(2)27/h4-5,14H,3,6-13,15-16H2,1-2H3	SJYQXSKDUDDADR-UHFFFAOYSA-N	429.226371122							121382
1-[(4-Fluorophenyl)sulfonyl]-4-(2-methoxyphenyl)piperazine	LSM-32826	SID7977458, BRD-K75353792	605569	InChI=1S/C17H19FN2O3S/c1-23-17-5-3-2-4-16(17)19-10-12-20(13-11-19)24(21,22)15-8-6-14(18)7-9-15/h2-9H,10-13H2,1H3	RYWWGZTXJQDMMW-UHFFFAOYSA-N	COc1ccccc1N2CCN(CC2)S(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K75353792	BRD-K75353792-001-05-9	ChemBridge Corporation	5358111			COc1ccccc1N1CCN(CC1)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C17H19FN2O3S/c1-23-17-5-3-2-4-16(17)19-10-12-20(13-11-19)24(21,22)15-8-6-14(18)7-9-15/h2-9H,10-13H2,1H3	RYWWGZTXJQDMMW-UHFFFAOYSA-N	350.110041378							121383
SMR000003231	LSM-32827	SID26667540, SID850307, BRD-K17943933	652822	InChI=1S/C26H26N6O3/c1-2-34-22-10-11-24-20(14-22)13-21(26(33)27-24)16-31(17-23-9-6-12-35-23)18-25-28-29-30-32(25)15-19-7-4-3-5-8-19/h3-14H,2,15-18H2,1H3,(H,27,33)	XGZTTXGMRAOTBG-UHFFFAOYSA-N	CCOc1ccc2nc(O)c(CN(Cc3occc3)Cc4nnnn4Cc5ccccc5)cc2c1	BroadT	BRD-K17943933	BRD-K17943933-001-05-8	Asinex Ltd.	ASN 04370377			CCOc1ccc2nc(O)c(CN(Cc3ccco3)Cc3nnnn3Cc3ccccc3)cc2c1	InChI=1S/C26H26N6O3/c1-2-34-22-10-11-24-20(14-22)13-21(26(33)27-24)16-31(17-23-9-6-12-35-23)18-25-28-29-30-32(25)15-19-7-4-3-5-8-19/h3-14H,2,15-18H2,1H3,(H,27,33)	XGZTTXGMRAOTBG-UHFFFAOYSA-N	470.206638752							121384
AG-219/36833017	LSM-32828	SID7975669, BRD-K51132863	1101933	InChI=1S/C17H11F3N4O2S/c18-17(19,20)14-7-11(13-4-2-6-27-13)22-15-8-12(23-24(14)15)16(25)21-9-10-3-1-5-26-10/h1-8H,9H2,(H,21,25)	RTBYQNZNPHRABM-UHFFFAOYSA-N	FC(F)(F)c1cc(nc2cc(nn12)C(=O)NCc3occc3)c4cccs4	BroadT	BRD-K51132863	BRD-K51132863-001-05-9	ChemBridge Corporation	5671834			FC(F)(F)c1cc(nc2cc(nn12)C(=O)NCc1ccco1)-c1cccs1	InChI=1S/C17H11F3N4O2S/c18-17(19,20)14-7-11(13-4-2-6-27-13)22-15-8-12(23-24(14)15)16(25)21-9-10-3-1-5-26-10/h1-8H,9H2,(H,21,25)	RTBYQNZNPHRABM-UHFFFAOYSA-N	392.055480922							121385
N-(1H-Indazol-6-yl)-2,4-dimethoxybenzamide	LSM-32829	SID24834238, BRD-K12027758	2451997	InChI=1S/C16H15N3O3/c1-21-12-5-6-13(15(8-12)22-2)16(20)18-11-4-3-10-9-17-19-14(10)7-11/h3-9H,1-2H3,(H,17,19)(H,18,20)	ZDSHDKPKSKTZRB-UHFFFAOYSA-N	COc1ccc(C(=O)Nc2ccc3c[nH]nc3c2)c(OC)c1	BroadT	BRD-K12027758	BRD-K12027758-001-05-7	Enamine Ltd.	T5310102			COc1ccc(C(=O)Nc2ccc3c[nH]nc3c2)c(OC)c1	InChI=1S/C16H15N3O3/c1-21-12-5-6-13(15(8-12)22-2)16(20)18-11-4-3-10-9-17-19-14(10)7-11/h3-9H,1-2H3,(H,17,19)(H,18,20)	ZDSHDKPKSKTZRB-UHFFFAOYSA-N	297.11134137							121386
ST50839944	LSM-32830	SID49825916, BRD-K52542133	19654178	InChI=1S/C17H26N2S/c1-14(2)13-18-17(20)19-10-8-16(9-11-19)12-15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,18,20)	TXTGJTDNZIVVAA-UHFFFAOYSA-N	CC(C)CN=C(S)N1CCC(Cc2ccccc2)CC1	BroadT	BRD-K52542133	BRD-K52542133-001-05-2	Chemical Technologies & Investigations	AMNCS-49759			CC(C)CN=C(S)N1CCC(Cc2ccccc2)CC1	InChI=1S/C17H26N2S/c1-14(2)13-18-17(20)19-10-8-16(9-11-19)12-15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,18,20)	TXTGJTDNZIVVAA-UHFFFAOYSA-N	290.181669542							121387
N-(3-Hydroxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide	LSM-32831	SID14746211, BRD-K42422750	1250457	InChI=1S/C13H10N4O2/c18-10-4-1-3-9(7-10)16-13(19)11-8-15-17-6-2-5-14-12(11)17/h1-8,18H,(H,16,19)	ITQMZHAYNOWPSU-UHFFFAOYSA-N	Oc1cccc(NC(=O)c2cnn3cccnc23)c1	BroadT	BRD-K42422750	BRD-K42422750-001-05-2	ChemBridge Corporation	7957120			Oc1cccc(NC(=O)c2cnn3cccnc23)c1	InChI=1S/C13H10N4O2/c18-10-4-1-3-9(7-10)16-13(19)11-8-15-17-6-2-5-14-12(11)17/h1-8,18H,(H,16,19)	ITQMZHAYNOWPSU-UHFFFAOYSA-N	254.0803756							121388
MLS000051518	LSM-32832	SID4256252, BRD-K34728023	935373	InChI=1S/C15H19N3O5/c1-5-13-17-12(18-23-13)8-16-15(19)9-6-10(20-2)14(22-4)11(7-9)21-3/h6-7H,5,8H2,1-4H3,(H,16,19)	LRIOLIRAHBAFRT-UHFFFAOYSA-N	CCc1onc(CNC(=O)c2cc(OC)c(OC)c(OC)c2)n1	BroadT	BRD-K34728023	BRD-K34728023-001-06-1	ChemBridge Corporation	7938455			CCc1nc(CNC(=O)c2cc(OC)c(OC)c(OC)c2)no1	InChI=1S/C15H19N3O5/c1-5-13-17-12(18-23-13)8-16-15(19)9-6-10(20-2)14(22-4)11(7-9)21-3/h6-7H,5,8H2,1-4H3,(H,16,19)	LRIOLIRAHBAFRT-UHFFFAOYSA-N	321.132470738							121389
SMR000094650	LSM-32833	SID7968313, SID87342735, BRD-K85221467	5309336	InChI=1S/C23H24N2O4S/c1-16-7-9-19(10-8-16)23-24-21(17(2)29-23)14-30(27,28)15-22(26)25-12-11-18-5-3-4-6-20(18)13-25/h3-10H,11-15H2,1-2H3	GCVQIGHVKKCWJF-UHFFFAOYSA-N	Cc1ccc(cc1)c2oc(C)c(CS(=O)(=O)CC(=O)N3CCc4ccccc4C3)n2	BroadT	BRD-K85221467	BRD-K85221467-001-04-3	ChemDiv Inc.	C528-0501			Cc1oc(nc1CS(=O)(=O)CC(=O)N1CCc2ccccc2C1)-c1ccc(C)cc1	InChI=1S/C23H24N2O4S/c1-16-7-9-19(10-8-16)23-24-21(17(2)29-23)14-30(27,28)15-22(26)25-12-11-18-5-3-4-6-20(18)13-25/h3-10H,11-15H2,1-2H3	GCVQIGHVKKCWJF-UHFFFAOYSA-N	424.145677958							121390
N-[2-(4-Acetylpiperazin-1-yl)phenyl]-2-(2,4-dichlorophenoxy)acetamide	LSM-32834	SID4259846, BRD-K27517762	2978828	InChI=1S/C20H21Cl2N3O3/c1-14(26)24-8-10-25(11-9-24)18-5-3-2-4-17(18)23-20(27)13-28-19-7-6-15(21)12-16(19)22/h2-7,12H,8-11,13H2,1H3,(H,23,27)	GUGSAGLBZLYZFW-UHFFFAOYSA-N	CC(=O)N1CCN(CC1)c2ccccc2NC(=O)COc3ccc(Cl)cc3Cl	BroadT	BRD-K27517762	BRD-K27517762-001-05-4	ChemBridge Corporation	7973464			CC(=O)N1CCN(CC1)c1ccccc1NC(=O)COc1ccc(Cl)cc1Cl	InChI=1S/C20H21Cl2N3O3/c1-14(26)24-8-10-25(11-9-24)18-5-3-2-4-17(18)23-20(27)13-28-19-7-6-15(21)12-16(19)22/h2-7,12H,8-11,13H2,1H3,(H,23,27)	GUGSAGLBZLYZFW-UHFFFAOYSA-N	421.095996982							121391
AC1LGXHA	LSM-15588	BRD-K25314085	878404	InChI=1S/C15H17N3OS/c19-15(14-5-3-11-20-14)18-9-7-17(8-10-18)12-13-4-1-2-6-16-13/h1-6,11H,7-10,12H2	QOYYOLSPRGBPJY-UHFFFAOYSA-N	O=C(N1CCN(Cc2ccccn2)CC1)c3cccs3	BroadT	BRD-K25314085	BRD-K25314085-034-05-9	Asinex Ltd.	BAS 02500647		OC(=O)C(=O)O	O=C(N1CCN(Cc2ccccn2)CC1)c1cccs1.OC(=O)C(=O)O	InChI=1S/C15H17N3OS.C2H2O4/c19-15(14-5-3-11-20-14)18-9-7-17(8-10-18)12-13-4-1-2-6-16-13;3-1(4)2(5)6/h1-6,11H,7-10,12H2;(H,3,4)(H,5,6)	ZPOFDLMOOQIESH-UHFFFAOYSA-N	287.109232884							104224, 104224
AK-968/12264324	LSM-32835	SID22413588, BRD-K64306150	1222039	InChI=1S/C23H26N4O/c1-3-17-8-10-18(11-9-17)22-16-20(19-6-4-5-7-21(19)24-22)23(28)25-27-14-12-26(2)13-15-27/h4-11,16H,3,12-15H2,1-2H3,(H,25,28)	BXJXHXNSQWRVHT-UHFFFAOYSA-N	CCc1ccc(cc1)c2cc(C(=O)NN3CCN(C)CC3)c4ccccc4n2	BroadT	BRD-K64306150	BRD-K64306150-001-05-6	Specs	AK-968/12264324			CCc1ccc(cc1)-c1cc(C(=O)NN2CCN(C)CC2)c2ccccc2n1	InChI=1S/C23H26N4O/c1-3-17-8-10-18(11-9-17)22-16-20(19-6-4-5-7-21(19)24-22)23(28)25-27-14-12-26(2)13-15-27/h4-11,16H,3,12-15H2,1-2H3,(H,25,28)	BXJXHXNSQWRVHT-UHFFFAOYSA-N	374.210661492							121392
AC1MGUBZ	LSM-32836	SID24785825, BRD-K94927158	2941627	InChI=1S/C20H18N2O2/c1-14-9-11-16(12-10-14)20(21)22-24-19(23)13-17-7-4-6-15-5-2-3-8-18(15)17/h2-12H,13H2,1H3,(H2,21,22)	XOOXMKYGJFEMFJ-UHFFFAOYSA-N	Cc1ccc(cc1)C(=N)NOC(=O)Cc2cccc3ccccc23	BroadT	BRD-K94927158	BRD-K94927158-001-05-5	ChemBridge Corporation	7520402			Cc1ccc(cc1)C(=N)NOC(=O)Cc1cccc2ccccc12	InChI=1S/C20H18N2O2/c1-14-9-11-16(12-10-14)20(21)22-24-19(23)13-17-7-4-6-15-5-2-3-8-18(15)17/h2-12H,13H2,1H3,(H2,21,22)	XOOXMKYGJFEMFJ-UHFFFAOYSA-N	318.136827836							121393
SMR000146316	LSM-32837	SID14742072, BRD-K03725988	1915086	InChI=1S/C23H17Cl2N3O3/c1-31-16-9-6-14(7-10-16)22-17-4-2-3-5-18(17)23(30)28(27-22)13-21(29)26-15-8-11-19(24)20(25)12-15/h2-12H,13H2,1H3,(H,26,29)	QEGDHDNCNZIINM-UHFFFAOYSA-N	COc1ccc(cc1)C2=NN(CC(=O)Nc3ccc(Cl)c(Cl)c3)C(=O)c4ccccc24	BroadT	BRD-K03725988	BRD-K03725988-001-05-9	InterBioScreen Ltd.	STOCK2S-04885			COc1ccc(cc1)-c1nn(CC(=O)Nc2ccc(Cl)c(Cl)c2)c(=O)c2ccccc12	InChI=1S/C23H17Cl2N3O3/c1-31-16-9-6-14(7-10-16)22-17-4-2-3-5-18(17)23(30)28(27-22)13-21(29)26-15-8-11-19(24)20(25)12-15/h2-12H,13H2,1H3,(H,26,29)	QEGDHDNCNZIINM-UHFFFAOYSA-N	453.064696854							121394
MLS000104257	LSM-32838	SID7974544, BRD-K61830307	788156	InChI=1S/C13H14N2S/c1-2-5-11(6-3-1)10-16-13-9-15-8-4-7-12(15)14-13/h1-3,5-6,9H,4,7-8,10H2	MVZRNZSNBHONEQ-UHFFFAOYSA-N	C(Sc1cn2CCCc2n1)c3ccccc3	BroadT	BRD-K61830307	BRD-K61830307-001-05-0	ChemBridge Corporation	5219747			C(Sc1cn2CCCc2n1)c1ccccc1	InChI=1S/C13H14N2S/c1-2-5-11(6-3-1)10-16-13-9-15-8-4-7-12(15)14-13/h1-3,5-6,9H,4,7-8,10H2	MVZRNZSNBHONEQ-UHFFFAOYSA-N	230.087769158							121395
AC1NZEBQ	LSM-32839	SID17513679, BRD-A20953965	5931303	InChI=1S/C18H13N3S/c1-2-7-13-12(6-1)17-20-14-8-3-4-9-15(14)21(17)18(19-13)16-10-5-11-22-16/h1-11,18-19H	XREICUDMBRWIFD-UHFFFAOYSA-N	N1C(c2cccs2)n3c(nc4ccccc34)c5ccccc15	BroadT	BRD-A20953965	BRD-A20953965-001-05-5	InterBioScreen Ltd.	STOCK3S-86282			N1C(c2cccs2)n2c(nc3ccccc23)-c2ccccc12	InChI=1S/C18H13N3S/c1-2-7-13-12(6-1)17-20-14-8-3-4-9-15(14)21(17)18(19-13)16-10-5-11-22-16/h1-11,18-19H	XREICUDMBRWIFD-UHFFFAOYSA-N	303.083018136							
MLS000660595	LSM-32840	SID24813852, BRD-K43702487	16194171	InChI=1S/C23H17F5N4O2/c1-11-14-8-29-32(10-18(33)30-22-20(27)16(25)7-17(26)21(22)28)23(34)19(14)12(2)31(11)9-13-5-3-4-6-15(13)24/h3-8H,9-10H2,1-2H3,(H,30,33)	BESGEGPRGYRHQP-UHFFFAOYSA-N	Cc1c2C=NN(CC(=O)Nc3c(F)c(F)cc(F)c3F)C(=O)c2c(C)n1Cc4ccccc4F	BroadT	BRD-K43702487	BRD-K43702487-001-05-6	ChemDiv Inc.	C891-1957			Cc1n(Cc2ccccc2F)c(C)c2c1cnn(CC(=O)Nc1c(F)c(F)cc(F)c1F)c2=O	InChI=1S/C23H17F5N4O2/c1-11-14-8-29-32(10-18(33)30-22-20(27)16(25)7-17(26)21(22)28)23(34)19(14)12(2)31(11)9-13-5-3-4-6-15(13)24/h3-8H,9-10H2,1-2H3,(H,30,33)	BESGEGPRGYRHQP-UHFFFAOYSA-N	476.127166824							121397
AO-476/43250147	LSM-32841	SID17386288, BRD-K04312617	7313808	InChI=1S/C14H12ClN5O/c1-8-6-9(2)20-13(16-8)12(14(21)19-20)18-17-11-5-3-4-10(15)7-11/h3-7H,1-2H3,(H,19,21)	VIOLTJJTQCXMOC-UHFFFAOYSA-N	CC1=NC2=C(N=Nc3cccc(Cl)c3)C(=O)NN2C(=C1)C	BroadT	BRD-K04312617	BRD-K04312617-001-05-4	Specs	AO-476/43250147			Cc1cc(C)n2[nH]c(=O)c(N=Nc3cccc(Cl)c3)c2n1	InChI=1S/C14H12ClN5O/c1-8-6-9(2)20-13(16-8)12(14(21)19-20)18-17-11-5-3-4-10(15)7-11/h3-7H,1-2H3,(H,19,21)	VIOLTJJTQCXMOC-UHFFFAOYSA-N	301.073037764							121398
AMBCB35244015	LSM-32842	SID24799871, BRD-A25063851	16191541	InChI=1S/C21H26N4/c1-2-6-15(7-3-1)21-20-17(16-8-4-5-9-18(16)24-20)10-13-25(21)14-19-22-11-12-23-19/h4-5,8-9,11-12,15,21,24H,1-3,6-7,10,13-14H2,(H,22,23)	FGRGUJPSVCNTFV-UHFFFAOYSA-N	C(N1CCc2c([nH]c3ccccc23)C1C4CCCCC4)c5ncc[nH]5	BroadT	BRD-A25063851	BRD-A25063851-001-05-5	ChemBridge Corporation	35244015			C(N1CCc2c([nH]c3ccccc23)C1C1CCCCC1)c1ncc[nH]1	InChI=1S/C21H26N4/c1-2-6-15(7-3-1)21-20-17(16-8-4-5-9-18(16)24-20)10-13-25(21)14-19-22-11-12-23-19/h4-5,8-9,11-12,15,21,24H,1-3,6-7,10,13-14H2,(H,22,23)	FGRGUJPSVCNTFV-UHFFFAOYSA-N	334.215746872							121399
F3097-0195	LSM-32843	SID22406543, BRD-K64647292	728278	InChI=1S/C16H12N6/c1-22(11-5-3-2-4-6-11)16-14(10-19)12(7-8-17)13(9-18)15(20)21-16/h2-6H,7H2,1H3,(H2,20,21)	ZRHVVRJSWMFJMC-UHFFFAOYSA-N	CN(c1ccccc1)c2nc(N)c(C#N)c(CC#N)c2C#N	BroadT	BRD-K64647292	BRD-K64647292-001-05-2	Enamine Ltd.	T0512-3762			CN(c1ccccc1)c1nc(N)c(C#N)c(CC#N)c1C#N	InChI=1S/C16H12N6/c1-22(11-5-3-2-4-6-11)16-14(10-19)12(7-8-17)13(9-18)15(20)21-16/h2-6H,7H2,1H3,(H2,20,21)	ZRHVVRJSWMFJMC-UHFFFAOYSA-N	288.112344444							121400
AC1MEG2X	LSM-32844	SID17512067, BRD-A79329682	2877824	InChI=1S/C17H18N2O2S/c1-12(18-17(22)19-13-7-3-2-4-8-13)16-11-20-14-9-5-6-10-15(14)21-16/h2-10,12,16H,11H2,1H3,(H2,18,19,22)	OFWGWRCVTONDAC-UHFFFAOYSA-N	CC(N=C(S)Nc1ccccc1)C2COc3ccccc3O2	BroadT	BRD-A79329682	BRD-A79329682-001-05-0	InterBioScreen Ltd.	STOCK2S-16475			CC(N=C(S)Nc1ccccc1)C1COc2ccccc2O1	InChI=1S/C17H18N2O2S/c1-12(18-17(22)19-13-7-3-2-4-8-13)16-11-20-14-9-5-6-10-15(14)21-16/h2-10,12,16H,11H2,1H3,(H2,18,19,22)	OFWGWRCVTONDAC-UHFFFAOYSA-N	314.108898526							121401
SMR000004014	LSM-32845	SID50086723, SID842380, BRD-K71268006	644648	InChI=1S/C20H21N5O3S2/c1-16-6-8-19(9-7-16)30(26,27)15-25-20(21-22-23-25)14-24(12-17-4-2-10-28-17)13-18-5-3-11-29-18/h2-11H,12-15H2,1H3	VTCCIEMEGJFJRC-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)Cn2nnnc2CN(Cc3occc3)Cc4cccs4	BroadT	BRD-K71268006	BRD-K71268006-001-05-5	Asinex Ltd.	ASN 05093421			Cc1ccc(cc1)S(=O)(=O)Cn1nnnc1CN(Cc1ccco1)Cc1cccs1	InChI=1S/C20H21N5O3S2/c1-16-6-8-19(9-7-16)30(26,27)15-25-20(21-22-23-25)14-24(12-17-4-2-10-28-17)13-18-5-3-11-29-18/h2-11H,12-15H2,1H3	VTCCIEMEGJFJRC-UHFFFAOYSA-N	443.108580962							121402
F0060-0036	LSM-32846	SID24826788, BRD-K21972179	747938	InChI=1S/C14H14N2O2S/c1-8-6-4-5-7-11(8)13(18)16-14-15-9(2)12(19-14)10(3)17/h4-7H,1-3H3,(H,15,16,18)	OTEXMVRSMNKYFS-UHFFFAOYSA-N	CC(=O)c1sc(NC(=O)c2ccccc2C)nc1C	BroadT	BRD-K21972179	BRD-K21972179-001-05-4	Enamine Ltd.	T0501-2018			CC(=O)c1sc(NC(=O)c2ccccc2C)nc1C	InChI=1S/C14H14N2O2S/c1-8-6-4-5-7-11(8)13(18)16-14-15-9(2)12(19-14)10(3)17/h4-7H,1-3H3,(H,15,16,18)	OTEXMVRSMNKYFS-UHFFFAOYSA-N	274.077598398							121403
AK-968/41172107	LSM-32847	SID14719248, BRD-K68761274	5061369	InChI=1S/C13H21N3OS2/c1-4-5-6-14-13(18)16-15-12(17)10-7-11(9(2)3)19-8-10/h7-9H,4-6H2,1-3H3,(H,15,17)(H2,14,16,18)	NSAJSIBOZIQZFR-UHFFFAOYSA-N	CCCCN=C(S)NNC(=O)c1csc(c1)C(C)C	BroadT	BRD-K68761274	BRD-K68761274-001-05-9	Specs	AK-968/41172107			CCCCN=C(S)NNC(=O)c1csc(c1)C(C)C	InChI=1S/C13H21N3OS2/c1-4-5-6-14-13(18)16-15-12(17)10-7-11(9(2)3)19-8-10/h7-9H,4-6H2,1-3H3,(H,15,17)(H2,14,16,18)	NSAJSIBOZIQZFR-UHFFFAOYSA-N	299.112603702							121404
MLS000834475	LSM-32848	SID24779776, BRD-K34927175	16187175	InChI=1S/C34H34N2O6S/c37-19-23-5-7-24(8-6-23)20-39-33-17-26(28-21-43-32-4-2-1-3-27(28)32)16-31(42-33)34(38)36-13-11-35(12-14-36)18-25-9-10-29-30(15-25)41-22-40-29/h1-10,15-16,21,26,33,37H,11-14,17-20,22H2/t26-,33+/m1/s1	CYKOLZWTLFGEPE-NYFMKLKXSA-N	OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6csc7ccccc67)cc1	BroadT	BRD-K34927175	BRD-K34927175-001-08-1	Harvard University	((2S,4S)-4-(benzo[b]thiophen-3-yl)-2-(4-(hydroxymethyl)benzyloxy)-3,4-dihydro-2H-pyran-6-yl)(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)methanone DHPC11_001194			OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)c2csc3ccccc23)cc1	InChI=1S/C34H34N2O6S/c37-19-23-5-7-24(8-6-23)20-39-33-17-26(28-21-43-32-4-2-1-3-27(28)32)16-31(42-33)34(38)36-13-11-35(12-14-36)18-25-9-10-29-30(15-25)41-22-40-29/h1-10,15-16,21,26,33,37H,11-14,17-20,22H2/t26-,33+/m1/s1	CYKOLZWTLFGEPE-NYFMKLKXSA-N	598.213757518							121405
AC1LZ6AC	LSM-32849	BRD-K89626667	1914991	InChI=1S/C17H13ClN2O5/c18-12-7-16-15(24-9-25-16)6-11(12)8-19-20-17(21)10-1-2-13-14(5-10)23-4-3-22-13/h1-2,5-8H,3-4,9H2,(H,20,21)	PHMLBQFRUYRQSN-UHFFFAOYSA-N	Clc1cc2OCOc2cc1C=NNC(=O)c3ccc4OCCOc4c3	BroadT	BRD-K89626667	BRD-K89626667-001-05-4	InterBioScreen Ltd.	STOCK2S-04612			Clc1cc2OCOc2cc1C=NNC(=O)c1ccc2OCCOc2c1	InChI=1S/C17H13ClN2O5/c18-12-7-16-15(24-9-25-16)6-11(12)8-19-20-17(21)10-1-2-13-14(5-10)23-4-3-22-13/h1-2,5-8H,3-4,9H2,(H,20,21)	PHMLBQFRUYRQSN-UHFFFAOYSA-N	360.051299246							121406
AC1MDS7O	LSM-32850	BRD-K34534303	2815983	InChI=1S/C22H16N6S2/c29-22-25-24-21(19-12-7-13-30-19)28(22)23-14-17-15-27(18-10-5-2-6-11-18)26-20(17)16-8-3-1-4-9-16/h1-15H,(H,25,29)	XUABPJVSOFIUNS-UHFFFAOYSA-N	Sc1nnc(c2cccs2)n1N=Cc3cn(nc3c4ccccc4)c5ccccc5	BroadT	BRD-K34534303	BRD-K34534303-001-06-4	Maybridge	HTS 11985			Sc1nnc(-c2cccs2)n1N=Cc1cn(nc1-c1ccccc1)-c1ccccc1	InChI=1S/C22H16N6S2/c29-22-25-24-21(19-12-7-13-30-19)28(22)23-14-17-15-27(18-10-5-2-6-11-18)26-20(17)16-8-3-1-4-9-16/h1-15H,(H,25,29)	XUABPJVSOFIUNS-UHFFFAOYSA-N	428.087785952							121407
MLS000061449	LSM-32851	SID4256708, BRD-K98194853	1101752	InChI=1S/C15H17N3O3S2/c19-14(17-15-16-7-10-22-15)12-5-4-6-13(11-12)23(20,21)18-8-2-1-3-9-18/h4-7,10-11H,1-3,8-9H2,(H,16,17,19)	JYXYORMUHPDZOG-UHFFFAOYSA-N	O=C(Nc1nccs1)c2cccc(c2)S(=O)(=O)N3CCCCC3	BroadT	BRD-K98194853	BRD-K98194853-001-06-4	ChemBridge Corporation	5557589			O=C(Nc1nccs1)c1cccc(c1)S(=O)(=O)N1CCCCC1	InChI=1S/C15H17N3O3S2/c19-14(17-15-16-7-10-22-15)12-5-4-6-13(11-12)23(20,21)18-8-2-1-3-9-18/h4-7,10-11H,1-3,8-9H2,(H,16,17,19)	JYXYORMUHPDZOG-UHFFFAOYSA-N	351.071132814							121408
SMR000003366	LSM-32852	SID26726025, SID853244, BRD-A58309702	655897	InChI=1S/C25H33N7O2/c1-16-11-17(2)20-13-21(25(33)26-22(20)12-16)23(31-9-8-30-7-3-5-18(30)14-31)24-27-28-29-32(24)15-19-6-4-10-34-19/h11-13,18-19,23H,3-10,14-15H2,1-2H3,(H,26,33)	SALFWCHEXNOMBM-UHFFFAOYSA-N	Cc1cc(C)c2cc(C(N3CCN4CCCC4C3)c5nnnn5CC6CCCO6)c(O)nc2c1	BroadT	BRD-A58309702	BRD-A58309702-001-05-3	Asinex Ltd.	ASN 04420974			Cc1cc(C)c2cc(C(N3CCN4CCCC4C3)c3nnnn3CC3CCCO3)c(O)nc2c1	InChI=1S/C25H33N7O2/c1-16-11-17(2)20-13-21(25(33)26-22(20)12-16)23(31-9-8-30-7-3-5-18(30)14-31)24-27-28-29-32(24)15-19-6-4-10-34-19/h11-13,18-19,23H,3-10,14-15H2,1-2H3,(H,26,33)	SALFWCHEXNOMBM-UHFFFAOYSA-N	463.269573366							121409
AC1MQKMZ	LSM-32853	BRD-K32502421	3478244	InChI=1S/C11H9BrN2OS2/c1-7(8-2-4-9(12)5-3-8)13-14-10(15)6-17-11(14)16/h2-5H,6H2,1H3	AEQPPMPJHWBKQA-UHFFFAOYSA-N	CC(=NN1C(=O)CSC1=S)c2ccc(Br)cc2	BroadT	BRD-K32502421	BRD-K32502421-001-06-0	Enamine Ltd.	T0506-8356			CC(=NN1C(=O)CSC1=S)c1ccc(Br)cc1	InChI=1S/C11H9BrN2OS2/c1-7(8-2-4-9(12)5-3-8)13-14-10(15)6-17-11(14)16/h2-5H,6H2,1H3	AEQPPMPJHWBKQA-UHFFFAOYSA-N	327.933966908							121410
CHEMBL1577117	LSM-32854	SID22413928, BRD-K56485697	5237229	InChI=1S/C14H10N2O5/c17-14(9-4-5-12-13(6-9)21-8-20-12)15-10-2-1-3-11(7-10)16(18)19/h1-7H,8H2,(H,15,17)	NRAPTJKMEMMXTF-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(NC(=O)c2ccc3OCOc3c2)c1	BroadT	BRD-K56485697	BRD-K56485697-001-05-8	Specs	AK-968/12386139			[O-][N+](=O)c1cccc(NC(=O)c2ccc3OCOc3c2)c1	InChI=1S/C14H10N2O5/c17-14(9-4-5-12-13(6-9)21-8-20-12)15-10-2-1-3-11(7-10)16(18)19/h1-7H,8H2,(H,15,17)	NRAPTJKMEMMXTF-UHFFFAOYSA-N	286.05897144							121411
MLS000063397	LSM-32855	SID4263203, BRD-K65821359	1281358	InChI=1S/C21H20N2O5S/c24-21(20-7-4-16-27-20)22-12-14-23(15-13-22)29(25,26)19-10-8-18(9-11-19)28-17-5-2-1-3-6-17/h1-11,16H,12-15H2	JSRJHJSVFGCCLW-UHFFFAOYSA-N	O=C(N1CCN(CC1)S(=O)(=O)c2ccc(Oc3ccccc3)cc2)c4occc4	BroadT	BRD-K65821359	BRD-K65821359-001-05-2	ChemBridge Corporation	7445116			O=C(N1CCN(CC1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1)c1ccco1	InChI=1S/C21H20N2O5S/c24-21(20-7-4-16-27-20)22-12-14-23(15-13-22)29(25,26)19-10-8-18(9-11-19)28-17-5-2-1-3-6-17/h1-11,16H,12-15H2	JSRJHJSVFGCCLW-UHFFFAOYSA-N	412.10929245							121412
STK062474	LSM-32856	SID849512, BRD-K43194993	652004	InChI=1S/C20H33N3O2/c1-20(2,15-22(3)4)14-21-19(25)16-9-11-23(12-10-16)13-17-7-5-6-8-18(17)24/h5-8,16,24H,9-15H2,1-4H3,(H,21,25)	LRXLNMZQHZJZBB-UHFFFAOYSA-N	CN(C)CC(C)(C)CNC(=O)C1CCN(Cc2ccccc2O)CC1	BroadT	BRD-K43194993	BRD-K43194993-001-05-3	Asinex Ltd.	BAS 04933978			CN(C)CC(C)(C)CNC(=O)C1CCN(Cc2ccccc2O)CC1	InChI=1S/C20H33N3O2/c1-20(2,15-22(3)4)14-21-19(25)16-9-11-23(12-10-16)13-17-7-5-6-8-18(17)24/h5-8,16,24H,9-15H2,1-4H3,(H,21,25)	LRXLNMZQHZJZBB-UHFFFAOYSA-N	347.257277326							121413
STK158420	LSM-32857	SID17509745, BRD-K94062080	2820213	InChI=1S/C19H16ClNO2/c20-15-6-8-16(9-7-15)21-12-17-18(22)10-14(11-19(17)23)13-4-2-1-3-5-13/h1-9,12,14,21H,10-11H2	WSNOMGCXCMXPNC-UHFFFAOYSA-N	Clc1ccc(NC=C2C(=O)CC(CC2=O)c3ccccc3)cc1	BroadT	BRD-K94062080	BRD-K94062080-001-05-4	ChemDiv Inc.	4302-2382			Clc1ccc(NC=C2C(=O)CC(CC2=O)c2ccccc2)cc1	InChI=1S/C19H16ClNO2/c20-15-6-8-16(9-7-15)21-12-17-18(22)10-14(11-19(17)23)13-4-2-1-3-5-13/h1-9,12,14,21H,10-11H2	WSNOMGCXCMXPNC-UHFFFAOYSA-N	325.086956472							
T5836705	LSM-32858	SID24836817, BRD-K53732600	3310093	InChI=1S/C22H21FN4O2/c1-2-3-13-26-20-18(21(28)25-22(26)29)27(14-15-9-5-4-6-10-15)19(24-20)16-11-7-8-12-17(16)23/h4-12H,2-3,13-14H2,1H3,(H,25,28,29)	UMVBNOGSNZCWCH-UHFFFAOYSA-N	CCCCN1C(=O)NC(=O)c2c1nc(c3ccccc3F)n2Cc4ccccc4	BroadT	BRD-K53732600	BRD-K53732600-001-05-2	Enamine Ltd.	T5274355			CCCCn1c2nc(-c3ccccc3F)n(Cc3ccccc3)c2c(=O)[nH]c1=O	InChI=1S/C22H21FN4O2/c1-2-3-13-26-20-18(21(28)25-22(26)29)27(14-15-9-5-4-6-10-15)19(24-20)16-11-7-8-12-17(16)23/h4-12H,2-3,13-14H2,1H3,(H,25,28,29)	UMVBNOGSNZCWCH-UHFFFAOYSA-N	392.164854152							121415
MLS000101257	LSM-44433	SID124889416, SID7970925, BRD-K79142977	756722	InChI=1S/C13H13N5O/c1-19-10-5-3-2-4-9(10)6-14-12-11-13(16-7-15-11)18-8-17-12/h2-5,7-8H,6H2,1H3,(H2,14,15,16,17,18)	STWJKIOLMNHFIK-UHFFFAOYSA-N	COc1ccccc1CNc2[nH]cnc3ncnc23	BroadT	BRD-K79142977	BRD-K79142977-001-05-9	Life Chemicals Inc.	F0578-0207			COc1ccccc1CNc1[nH]cnc2ncnc12	InChI=1S/C13H13N5O/c1-19-10-5-3-2-4-9(10)6-14-12-11-13(16-7-15-11)18-8-17-12/h2-5,7-8H,6H2,1H3,(H2,14,15,16,17,18)	STWJKIOLMNHFIK-UHFFFAOYSA-N	255.112010086							
ZINC02362359	LSM-32860	SID17513846, BRD-K48074802	1974294	InChI=1S/C17H13ClN2O2S2/c1-10-3-6-13(7-4-10)24(21,22)20-15-8-5-12(18)9-14(15)16-17(20)23-11(2)19-16/h3-9H,1-2H3	ODSGWCRAQSRWFO-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)n2c3ccc(Cl)cc3c4nc(C)sc24	BroadT	BRD-K48074802	BRD-K48074802-001-04-6	InterBioScreen Ltd.	STOCK5S-58890			Cc1nc2c3cc(Cl)ccc3n(c2s1)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C17H13ClN2O2S2/c1-10-3-6-13(7-4-10)24(21,22)20-15-8-5-12(18)9-14(15)16-17(20)23-11(2)19-16/h3-9H,1-2H3	ODSGWCRAQSRWFO-UHFFFAOYSA-N	376.010696766							121417
SMR000249242	LSM-32861	SID22410333, SID89853106, BRD-K64179374	1665919	InChI=1S/C24H23N3O4S2/c1-5-31-24(30)18-13(2)14(3)32-22(18)26-17(28)11-27-12-25-21-20(23(27)29)19(15(4)33-21)16-9-7-6-8-10-16/h6-10,12H,5,11H2,1-4H3,(H,26,28)	WOGKVVBQGSXPPQ-UHFFFAOYSA-N	CCOC(=O)c1c(C)c(C)sc1NC(=O)CN2C=Nc3sc(C)c(c4ccccc4)c3C2=O	BroadT	BRD-K64179374	BRD-K64179374-001-05-7	Enamine Ltd.	T5295292			CCOC(=O)c1c(NC(=O)Cn2cnc3sc(C)c(-c4ccccc4)c3c2=O)sc(C)c1C	InChI=1S/C24H23N3O4S2/c1-5-31-24(30)18-13(2)14(3)32-22(18)26-17(28)11-27-12-25-21-20(23(27)29)19(15(4)33-21)16-9-7-6-8-10-16/h6-10,12H,5,11H2,1-4H3,(H,26,28)	WOGKVVBQGSXPPQ-UHFFFAOYSA-N	481.112997626							121418
STK390457	LSM-44434	SID17416356, BRD-K23389508	875108	InChI=1S/C16H15N3OS/c1-12-9-10-17-14(11-12)18-16(21)19-15(20)8-7-13-5-3-2-4-6-13/h2-11H,1H3,(H2,17,18,19,20,21)/b8-7+	BYKDOZUSBHVCRR-BQYQJAHWSA-N	Cc1ccnc(NC(=S)NC(=O)\C=C\c2ccccc2)c1	BroadT	BRD-K23389508	BRD-K23389508-001-05-1	ChemBridge Corporation	6158529			Cc1ccnc(NC(=S)NC(=O)\C=C\c2ccccc2)c1	InChI=1S/C16H15N3OS/c1-12-9-10-17-14(11-12)18-16(21)19-15(20)8-7-13-5-3-2-4-6-13/h2-11H,1H3,(H2,17,18,19,20,21)/b8-7+	BYKDOZUSBHVCRR-BQYQJAHWSA-N	297.09358282							
MLS000054542	LSM-32863	SID3712183, BRD-A58987482	2997924	InChI=1S/C18H15BrN2O/c19-13-8-5-12(6-9-13)16-17(22)15-10-7-11-3-1-2-4-14(11)21(15)18(16)20/h1-6,8-9,15H,7,10,20H2	SOAYNLAFYDGCPV-UHFFFAOYSA-N	NC1=C(C(=O)C2CCc3ccccc3N12)c4ccc(Br)cc4	BroadT	BRD-A58987482	BRD-A58987482-001-04-5	Enamine Ltd.	T0505-4024			NC1=C(C(=O)C2CCc3ccccc3N12)c1ccc(Br)cc1	InChI=1S/C18H15BrN2O/c19-13-8-5-12(6-9-13)16-17(22)15-10-7-11-3-1-2-4-14(11)21(15)18(16)20/h1-6,8-9,15H,7,10,20H2	SOAYNLAFYDGCPV-UHFFFAOYSA-N	354.03677572							121420
4-Methyl-n-pyridin-4-ylmethyl-benzenesulfonamide	LSM-32864	SID848734, BRD-K04642395	651192	InChI=1S/C13H14N2O2S/c1-11-2-4-13(5-3-11)18(16,17)15-10-12-6-8-14-9-7-12/h2-9,15H,10H2,1H3	XKDJGAPHTFVILP-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NCc2ccncc2	BroadT	BRD-K04642395	BRD-K04642395-001-05-2	Asinex Ltd.	BAS 03585856			Cc1ccc(cc1)S(=O)(=O)NCc1ccncc1	InChI=1S/C13H14N2O2S/c1-11-2-4-13(5-3-11)18(16,17)15-10-12-6-8-14-9-7-12/h2-9,15H,10H2,1H3	XKDJGAPHTFVILP-UHFFFAOYSA-N	262.077598398							121421
MLS002729074	LSM-1256	ARG-TC-41, SID87556799, SID99495772, BRD-A02809788	44629410	InChI=1S/C22H27NO3/c1-25-20-11-10-18(15-21(20)26-2)22(24)19-9-6-13-23(16-19)14-12-17-7-4-3-5-8-17/h3-5,7-8,10-11,15,19H,6,9,12-14,16H2,1-2H3	OSQKAQCOFUNQAK-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)C2CCCN(CCc3ccccc3)C2	BroadT	BRD-A02809788	BRD-A02809788-001-03-1	Broad Institute of MIT and Harvard	BRD-A02809788			COc1ccc(cc1OC)C(=O)C1CCCN(CCc2ccccc2)C1	InChI=1S/C22H27NO3/c1-25-20-11-10-18(15-21(20)26-2)22(24)19-9-6-13-23(16-19)14-12-17-7-4-3-5-8-17/h3-5,7-8,10-11,15,19H,6,9,12-14,16H2,1-2H3	OSQKAQCOFUNQAK-UHFFFAOYSA-N	353.199093734							91487
SMR000030325	LSM-32865	SID4245728, BRD-K78429211	3240166	InChI=1S/C21H23N5O5/c1-28-15-5-3-13(11-17(15)29-2)7-8-23-21(27)19-20(22)26(25-24-19)14-4-6-16-18(12-14)31-10-9-30-16/h3-6,11-12H,7-10,22H2,1-2H3,(H,23,27)	GFTDUGFNPKHYDV-UHFFFAOYSA-N	COc1ccc(CCNC(=O)c2nnn(c2N)c3ccc4OCCOc4c3)cc1OC	BroadT	BRD-K78429211	BRD-K78429211-001-06-5	ChemDiv Inc.	K236-0130			COc1ccc(CCNC(=O)c2nnn(c2N)-c2ccc3OCCOc3c2)cc1OC	InChI=1S/C21H23N5O5/c1-28-15-5-3-13(11-17(15)29-2)7-8-23-21(27)19-20(22)26(25-24-19)14-4-6-16-18(12-14)31-10-9-30-16/h3-6,11-12H,7-10,22H2,1-2H3,(H,23,27)	GFTDUGFNPKHYDV-UHFFFAOYSA-N	425.169918886							121422
ZINC00849817	LSM-32866	SID14724474, BRD-K80416631	1114757	InChI=1S/C20H20N6S2/c1-13-7-3-5-9-15(13)22-17-24-18(23-16-10-6-4-8-14(16)2)26-19(25-17)28-20-21-11-12-27-20/h3-10H,11-12H2,1-2H3,(H2,22,23,24,25,26)	JWOKQHIWSOTUTQ-UHFFFAOYSA-N	Cc1ccccc1Nc2nc(Nc3ccccc3C)nc(SC4=NCCS4)n2	BroadT	BRD-K80416631	BRD-K80416631-001-05-2	Asinex Ltd.	BAS 01095052			Cc1ccccc1Nc1nc(Nc2ccccc2C)nc(SC2=NCCS2)n1	InChI=1S/C20H20N6S2/c1-13-7-3-5-9-15(13)22-17-24-18(23-16-10-6-4-8-14(16)2)26-19(25-17)28-20-21-11-12-27-20/h3-10H,11-12H2,1-2H3,(H2,22,23,24,25,26)	JWOKQHIWSOTUTQ-UHFFFAOYSA-N	408.11908608							121423
ZINC00494219	LSM-32867	SID856355, BRD-K29644138	657722	InChI=1S/C11H15N5/c1-7-6-10(12-4)14-11(13-7)16-9(3)5-8(2)15-16/h5-6H,1-4H3,(H,12,13,14)	GIAYWMGCMGIWGE-UHFFFAOYSA-N	CNc1cc(C)nc(n1)n2nc(C)cc2C	BroadT	BRD-K29644138	BRD-K29644138-001-05-1	InterBioScreen Ltd.	STOCK1S-09652			CNc1cc(C)nc(n1)-n1nc(C)cc1C	InChI=1S/C11H15N5/c1-7-6-10(12-4)14-11(13-7)16-9(3)5-8(2)15-16/h5-6H,1-4H3,(H,12,13,14)	GIAYWMGCMGIWGE-UHFFFAOYSA-N	217.13274553							121424
1-[4-(2-Bromobenzoyl)-1H-pyrrol-2-yl]-2,2,2-trichloro-1-ethanone	LSM-32868	SID24820753, BRD-K80883800	2766522	InChI=1S/C13H7BrCl3NO2/c14-9-4-2-1-3-8(9)11(19)7-5-10(18-6-7)12(20)13(15,16)17/h1-6,18H	ARLGWSBOWGUQGF-UHFFFAOYSA-N	ClC(Cl)(Cl)C(=O)c1cc(c[nH]1)C(=O)c2ccccc2Br	BroadT	BRD-K80883800	BRD-K80883800-001-06-6	Key Organics Ltd.	1.10E-11			ClC(Cl)(Cl)C(=O)c1cc(c[nH]1)C(=O)c1ccccc1Br	InChI=1S/C13H7BrCl3NO2/c14-9-4-2-1-3-8(9)11(19)7-5-10(18-6-7)12(20)13(15,16)17/h1-6,18H	ARLGWSBOWGUQGF-UHFFFAOYSA-N	392.872574204							121425
AC1LD09J	LSM-15515	BRD-K28325124	659157	InChI=1S/C8H6N2O4/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4,13-14H	UOOBPWKQJFEXQO-UHFFFAOYSA-N	ON1C(=O)C(=O)N(O)c2ccccc12	BroadT	BRD-K28325124	BRD-K28325124-002-05-2	InterBioScreen Ltd.	STOCK2S-02801		O	On1c2ccccc2n(O)c(=O)c1=O.O	InChI=1S/C8H6N2O4.H2O/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13;/h1-4,13-14H;1H2	NETAUGHJXXPMOF-UHFFFAOYSA-N	194.032756692							104156, 104156
ST045357	LSM-32869	SID4243493, BRD-K10449879	671455	InChI=1S/C13H11N3O3S/c1-19-11-4-5-12(10-3-2-6-15-13(10)11)20(17,18)16-8-7-14-9-16/h2-9H,1H3	LOSUXKDBEKGFNK-UHFFFAOYSA-N	COc1ccc(c2cccnc12)S(=O)(=O)n3ccnc3	BroadT	BRD-K10449879	BRD-K10449879-001-05-9	ChemDiv Inc.	8012-5575			COc1ccc(c2cccnc12)S(=O)(=O)n1ccnc1	InChI=1S/C13H11N3O3S/c1-19-11-4-5-12(10-3-2-6-15-13(10)11)20(17,18)16-8-7-14-9-16/h2-9H,1H3	LOSUXKDBEKGFNK-UHFFFAOYSA-N	289.052111932							121426
ST50836699	LSM-32870	SID49823606, BRD-K19076854	19654179	InChI=1S/C16H22N2S/c1-2-10-17-16(19)18-11-8-15(9-12-18)13-14-6-4-3-5-7-14/h2-7,15H,1,8-13H2,(H,17,19)	JOWWLIXWCOGMJD-UHFFFAOYSA-N	C=CCNC(=S)N1CCC(Cc2ccccc2)CC1	BroadT	BRD-K19076854	BRD-K19076854-001-05-0	Chemical Technologies & Investigations	AMNCS-49760			C=CCNC(=S)N1CCC(Cc2ccccc2)CC1	InChI=1S/C16H22N2S/c1-2-10-17-16(19)18-11-8-15(9-12-18)13-14-6-4-3-5-7-14/h2-7,15H,1,8-13H2,(H,17,19)	JOWWLIXWCOGMJD-UHFFFAOYSA-N	274.150369414							121427
AC1LI95G	LSM-32871	BRD-K05995426	950314	InChI=1S/C16H11N3O4/c20-16(15-9-12-5-1-2-7-14(12)23-15)18-17-10-11-4-3-6-13(8-11)19(21)22/h1-10H,(H,18,20)	BDJAQWUJIPHDNG-UHFFFAOYSA-N	[O-][N+](=O)c1cccc(C=NNC(=O)c2oc3ccccc3c2)c1	BroadT	BRD-K05995426	BRD-K05995426-001-05-6	InterBioScreen Ltd.	STOCK3S-30106			[O-][N+](=O)c1cccc(C=NNC(=O)c2cc3ccccc3o2)c1	InChI=1S/C16H11N3O4/c20-16(15-9-12-5-1-2-7-14(12)23-15)18-17-10-11-4-3-6-13(8-11)19(21)22/h1-10H,(H,18,20)	BDJAQWUJIPHDNG-UHFFFAOYSA-N	309.074955862							121428
AH-487/41536216	LSM-44435	SID14718825, BRD-K84502236	1004023	InChI=1S/C24H26N2O6S/c1-5-31-20-12-7-16(14-21(20)32-6-2)13-19-23(28)26(17-8-10-18(29-3)11-9-17)24(33)25(19)15-22(27)30-4/h7-14H,5-6,15H2,1-4H3/b19-13-	ICOWMNWFNQFYMK-UYRXBGFRSA-N	CCOc1ccc(\C=C\2/N(CC(=O)OC)C(=S)N(C2=O)c3ccc(OC)cc3)cc1OCC	BroadT	BRD-K84502236	BRD-K84502236-001-06-2	Specs	AH-487/41536216			CCOc1ccc(\C=C2/N(CC(=O)OC)C(=S)N(C2=O)c2ccc(OC)cc2)cc1OCC	InChI=1S/C24H26N2O6S/c1-5-31-20-12-7-16(14-21(20)32-6-2)13-19-23(28)26(17-8-10-18(29-3)11-9-17)24(33)25(19)15-22(27)30-4/h7-14H,5-6,15H2,1-4H3/b19-13-	ICOWMNWFNQFYMK-UYRXBGFRSA-N	470.151157262							
MLS001208407	LSM-32873	SID47203339, BRD-K84240191	1094930	InChI=1S/C17H22N2O3S/c1-5-22-17-12(2)9-16(13(3)14(17)4)23(20,21)19-11-15-7-6-8-18-10-15/h6-10,19H,5,11H2,1-4H3	JXQNCOPBCLMXMO-UHFFFAOYSA-N	CCOc1c(C)cc(c(C)c1C)S(=O)(=O)NCc2cccnc2	BroadT	BRD-K84240191	BRD-K84240191-001-06-2	Asinex Ltd.	BAS 09620814			CCOc1c(C)cc(c(C)c1C)S(=O)(=O)NCc1cccnc1	InChI=1S/C17H22N2O3S/c1-5-22-17-12(2)9-16(13(3)14(17)4)23(20,21)19-11-15-7-6-8-18-10-15/h6-10,19H,5,11H2,1-4H3	JXQNCOPBCLMXMO-UHFFFAOYSA-N	334.135113274							121430
SMR000179153	LSM-32874	SID17409452, BRD-K28720952	1481087	InChI=1S/C17H13ClN2O3/c18-15-9-5-4-8-14(15)16-10-13(20-23-16)11-22-17(21)19-12-6-2-1-3-7-12/h1-10H,11H2,(H,19,21)	UITGCCIJHSVLSQ-UHFFFAOYSA-N	Clc1ccccc1c2onc(COC(=O)Nc3ccccc3)c2	BroadT	BRD-K28720952	BRD-K28720952-001-06-1	Key Organics Ltd.	6N-650S			Clc1ccccc1-c1cc(COC(=O)Nc2ccccc2)no1	InChI=1S/C17H13ClN2O3/c18-15-9-5-4-8-14(15)16-10-13(20-23-16)11-22-17(21)19-12-6-2-1-3-7-12/h1-10H,11H2,(H,19,21)	UITGCCIJHSVLSQ-UHFFFAOYSA-N	328.061470006							121431
2-(2-Methoxyphenyl)-3-phenylbenzo[g]quinoxaline	LSM-32875	SID17506096, BRD-K16741660	1983598	InChI=1S/C25H18N2O/c1-28-23-14-8-7-13-20(23)25-24(17-9-3-2-4-10-17)26-21-15-18-11-5-6-12-19(18)16-22(21)27-25/h2-16H,1H3	YIIAGWJDBLVRLW-UHFFFAOYSA-N	COc1ccccc1c2nc3cc4ccccc4cc3nc2c5ccccc5	BroadT	BRD-K16741660	BRD-K16741660-001-05-6	InterBioScreen Ltd.	STOCK3S-37651			COc1ccccc1-c1nc2cc3ccccc3cc2nc1-c1ccccc1	InChI=1S/C25H18N2O/c1-28-23-14-8-7-13-20(23)25-24(17-9-3-2-4-10-17)26-21-15-18-11-5-6-12-19(18)16-22(21)27-25/h2-16H,1H3	YIIAGWJDBLVRLW-UHFFFAOYSA-N	362.141913216							121432
AC1LGRB4	LSM-44436	SID17416299, BRD-K64235646	875563	InChI=1S/C21H18N4O/c1-15-11-17(16(2)25(15)20-9-6-10-23-14-20)12-18(13-22)21(26)24-19-7-4-3-5-8-19/h3-12,14H,1-2H3,(H,24,26)/b18-12-	BKPISNOVXQINQT-PDGQHHTCSA-N	Cc1cc(\C=C(\C#N)/C(=O)Nc2ccccc2)c(C)n1c3cccnc3	BroadT	BRD-K64235646	BRD-K64235646-001-05-9	ChemBridge Corporation	6186383			Cc1cc(\C=C(\C#N)C(=O)Nc2ccccc2)c(C)n1-c1cccnc1	InChI=1S/C21H18N4O/c1-15-11-17(16(2)25(15)20-9-6-10-23-14-20)12-18(13-22)21(26)24-19-7-4-3-5-8-19/h3-12,14H,1-2H3,(H,24,26)/b18-12-	BKPISNOVXQINQT-PDGQHHTCSA-N	342.148061236							
ST058798	LSM-32877	SID4264638, BRD-K69307797	1253526	InChI=1S/C19H21N3O3S/c1-3-20-17-10-9-15(13-18(17)21(4-2)19(20)23)26(24,25)22-12-11-14-7-5-6-8-16(14)22/h5-10,13H,3-4,11-12H2,1-2H3	FZBLPYSJDSHKAF-UHFFFAOYSA-N	CCN1C(=O)N(CC)c2cc(ccc12)S(=O)(=O)N3CCc4ccccc34	BroadT	BRD-K69307797	BRD-K69307797-001-06-6	ChemBridge Corporation	7963809			CCn1c2ccc(cc2n(CC)c1=O)S(=O)(=O)N1CCc2ccccc12	InChI=1S/C19H21N3O3S/c1-3-20-17-10-9-15(13-18(17)21(4-2)19(20)23)26(24,25)22-12-11-14-7-5-6-8-16(14)22/h5-10,13H,3-4,11-12H2,1-2H3	FZBLPYSJDSHKAF-UHFFFAOYSA-N	371.130362252							121434
BAS 00297206	LSM-32878	SID7973102, BRD-K53264031	843777	InChI=1S/C10H17N9/c1-4-11-8-15-9(14-7(2)3)17-10(16-8)18-19-5-12-13-6-19/h5-7H,4H2,1-3H3,(H3,11,14,15,16,17,18)	FUZLTVDZVKIRKJ-UHFFFAOYSA-N	CCNc1nc(NC(C)C)nc(Nn2cnnc2)n1	BroadT	BRD-K53264031	BRD-K53264031-001-05-5	ChemBridge Corporation	5340065			CCNc1nc(NC(C)C)nc(Nn2cnnc2)n1	InChI=1S/C10H17N9/c1-4-11-8-15-9(14-7(2)3)17-10(16-8)18-19-5-12-13-6-19/h5-7H,4H2,1-3H3,(H3,11,14,15,16,17,18)	FUZLTVDZVKIRKJ-UHFFFAOYSA-N	263.160691634							121435
ZINC03882968	LSM-32879	SID26660963, BRD-K14517277	6802573	InChI=1S/C14H13NO2/c1-17-13-7-4-5-11(14(13)16)8-9-12-6-2-3-10-15-12/h2-10,16H,1H3/b9-8+	GGIVUCSCCYLKPR-CMDGGOBGSA-N	COc1cccc(\C=C\c2ccccn2)c1O	BroadT	BRD-K14517277	BRD-K14517277-001-05-7	InterBioScreen Ltd.	STOCK2S-13428			COc1cccc(\C=C\c2ccccn2)c1O	InChI=1S/C14H13NO2/c1-17-13-7-4-5-11(14(13)16)8-9-12-6-2-3-10-15-12/h2-10,16H,1H3/b9-8+	GGIVUCSCCYLKPR-CMDGGOBGSA-N	227.094628666							
MLS000066762	LSM-32880	SID4256060, BRD-K13548151	1259540	InChI=1S/C24H31N3O3/c1-17(2)20-10-9-18(3)15-23(20)30-16-24(29)25-21-7-5-6-8-22(21)27-13-11-26(12-14-27)19(4)28/h5-10,15,17H,11-14,16H2,1-4H3,(H,25,29)	MDBPWUBAVKPIAN-UHFFFAOYSA-N	CC(C)c1ccc(C)cc1OCC(=O)Nc2ccccc2N3CCN(CC3)C(=O)C	BroadT	BRD-K13548151	BRD-K13548151-001-05-4	ChemBridge Corporation	7991710			CC(C)c1ccc(C)cc1OCC(=O)Nc1ccccc1N1CCN(CC1)C(C)=O	InChI=1S/C24H31N3O3/c1-17(2)20-10-9-18(3)15-23(20)30-16-24(29)25-21-7-5-6-8-22(21)27-13-11-26(12-14-27)19(4)28/h5-10,15,17H,11-14,16H2,1-4H3,(H,25,29)	MDBPWUBAVKPIAN-UHFFFAOYSA-N	409.236541882							121437
AC1MK66U	LSM-32881	SID7978113, BRD-A03486163	3151046	InChI=1S/C19H18N2O3/c1-13(22)20-16-8-5-9-17(12-16)21-18(23)11-15(19(21)24)10-14-6-3-2-4-7-14/h2-9,12,15H,10-11H2,1H3,(H,20,22)	HKEUABYAEWKEAO-UHFFFAOYSA-N	CC(=O)Nc1cccc(c1)N2C(=O)CC(Cc3ccccc3)C2=O	BroadT	BRD-A03486163	BRD-A03486163-001-06-5	ChemBridge Corporation	7161704			CC(=O)Nc1cccc(c1)N1C(=O)CC(Cc2ccccc2)C1=O	InChI=1S/C19H18N2O3/c1-13(22)20-16-8-5-9-17(12-16)21-18(23)11-15(19(21)24)10-14-6-3-2-4-7-14/h2-9,12,15H,10-11H2,1H3,(H,20,22)	HKEUABYAEWKEAO-UHFFFAOYSA-N	322.131742456							121438
BRD-A07407288	LSM-1460	BJM-CSC-15	6802409	InChI=1S/C18H21N3O3/c1-18(2,3)12-6-7-14-15(9-12)24-16(11-23-14)17(22)21-20-10-13-5-4-8-19-13/h4-10,16,19H,11H2,1-3H3,(H,21,22)	CISVJPXUQJEUAP-UHFFFAOYSA-N	CC(C)(C)c1ccc2OCC(Oc2c1)C(=O)NN=Cc3ccc[nH]3	BroadT	BRD-A07407288	BRD-A07407288-001-09-1	InterBioScreen Ltd.	STOCK2S-56980			CC(C)(C)c1ccc2OCC(Oc2c1)C(=O)NN=Cc1ccc[nH]1	InChI=1S/C18H21N3O3/c1-18(2,3)12-6-7-14-15(9-12)24-16(11-23-14)17(22)21-20-10-13-5-4-8-19-13/h4-10,16,19H,11H2,1-3H3,(H,21,22)	CISVJPXUQJEUAP-UHFFFAOYSA-N	327.158291562							
AC1MRQ08	LSM-32882	BRD-A40799850	3521979	InChI=1S/C24H21N3O5S2/c1-32-19-12-8-9-17(15-19)25-22(28)16-21-23(29)27(18-10-4-2-5-11-18)24(33-21)26-34(30,31)20-13-6-3-7-14-20/h2-15,21H,16H2,1H3,(H,25,28)	GEMODPPJYICMKM-UHFFFAOYSA-N	COc1cccc(NC(=O)CC2SC(=NS(=O)(=O)c3ccccc3)N(C2=O)c4ccccc4)c1	BroadT	BRD-A40799850	BRD-A40799850-001-05-6	Enamine Ltd.	T5307339			COc1cccc(NC(=O)CC2SC(=NS(=O)(=O)c3ccccc3)N(C2=O)c2ccccc2)c1	InChI=1S/C24H21N3O5S2/c1-32-19-12-8-9-17(15-19)25-22(28)16-21-23(29)27(18-10-4-2-5-11-18)24(33-21)26-34(30,31)20-13-6-3-7-14-20/h2-15,21H,16H2,1H3,(H,25,28)	GEMODPPJYICMKM-UHFFFAOYSA-N	495.092262182							121439
MLS000068431	LSM-32883	SID50086721, SID844180, BRD-A35420319	646493	InChI=1S/C25H27N7O2/c1-34-23-10-4-19(5-11-23)18-32-25(27-28-29-32)24(20-3-2-12-26-17-20)31-15-13-30(14-16-31)21-6-8-22(33)9-7-21/h2-12,17,24,33H,13-16,18H2,1H3	MSXLTLOPFIFHLJ-UHFFFAOYSA-N	COc1ccc(Cn2nnnc2C(N3CCN(CC3)c4ccc(O)cc4)c5cccnc5)cc1	BroadT	BRD-A35420319	BRD-A35420319-001-05-1	Asinex Ltd.	ASN 07880816			COc1ccc(cc1)Cn1nnnc1C(N1CCN(CC1)c1ccc(O)cc1)c1cccnc1	InChI=1S/C25H27N7O2/c1-34-23-10-4-19(5-11-23)18-32-25(27-28-29-32)24(20-3-2-12-26-17-20)31-15-13-30(14-16-31)21-6-8-22(33)9-7-21/h2-12,17,24,33H,13-16,18H2,1H3	MSXLTLOPFIFHLJ-UHFFFAOYSA-N	457.222623174							121440
MLS000521058	LSM-32884	SID14737365, BRD-K37906624	3632167	InChI=1S/C19H25NO4/c1-19(2)12-16(21)15-11-14(7-8-17(15)24-19)23-13-18(22)20-9-5-3-4-6-10-20/h7-8,11H,3-6,9-10,12-13H2,1-2H3	RZKPEBUKISOUDQ-UHFFFAOYSA-N	CC1(C)CC(=O)c2cc(OCC(=O)N3CCCCCC3)ccc2O1	BroadT	BRD-K37906624	BRD-K37906624-001-05-5	ChemDiv Inc.	K786-3821			CC1(C)CC(=O)c2cc(OCC(=O)N3CCCCCC3)ccc2O1	InChI=1S/C19H25NO4/c1-19(2)12-16(21)15-11-14(7-8-17(15)24-19)23-13-18(22)20-9-5-3-4-6-10-20/h7-8,11H,3-6,9-10,12-13H2,1-2H3	RZKPEBUKISOUDQ-UHFFFAOYSA-N	331.17835829							121441
STK254742	LSM-32885	SID4265828, BRD-K89038400	1294737	InChI=1S/C18H20BrN3O/c1-21-10-12-22(13-11-21)15-8-6-14(7-9-15)20-18(23)16-4-2-3-5-17(16)19/h2-9H,10-13H2,1H3,(H,20,23)	DWMUFSGXDMYDJN-UHFFFAOYSA-N	CN1CCN(CC1)c2ccc(NC(=O)c3ccccc3Br)cc2	BroadT	BRD-K89038400	BRD-K89038400-001-05-4	ChemBridge Corporation	7662194			CN1CCN(CC1)c1ccc(NC(=O)c2ccccc2Br)cc1	InChI=1S/C18H20BrN3O/c1-21-10-12-22(13-11-21)15-8-6-14(7-9-15)20-18(23)16-4-2-3-5-17(16)19/h2-9H,10-13H2,1H3,(H,20,23)	DWMUFSGXDMYDJN-UHFFFAOYSA-N	373.07897489							121442
F2507-0427	LSM-32886	SID24816458, BRD-K45301051	7532083	InChI=1S/C17H12FN5S/c18-14-3-1-12(2-4-14)11-24-17-21-20-16-6-5-15(22-23(16)17)13-7-9-19-10-8-13/h1-10H,11H2	NKQQHGAFJDQEFC-UHFFFAOYSA-N	Fc1ccc(CSc2nnc3ccc(nn23)c4ccncc4)cc1	BroadT	BRD-K45301051	BRD-K45301051-001-05-1	Life Chemicals Inc.	F2507-0427			Fc1ccc(CSc2nnc3ccc(nn23)-c2ccncc2)cc1	InChI=1S/C17H12FN5S/c18-14-3-1-12(2-4-14)11-24-17-21-20-16-6-5-15(22-23(16)17)13-7-9-19-10-8-13/h1-10H,11H2	NKQQHGAFJDQEFC-UHFFFAOYSA-N	337.079744324							121443
MLS000061429	LSM-32887	SID4261623, BRD-K56324963	2249651	InChI=1S/C19H25NO5/c1-21-15-8-13(9-16(10-15)22-2)11-20-12-14-6-7-17(23-3)19(25-5)18(14)24-4/h6-10,20H,11-12H2,1-5H3	VHQABWCDGKANRB-UHFFFAOYSA-N	COc1cc(CNCc2ccc(OC)c(OC)c2OC)cc(OC)c1	BroadT	BRD-K56324963	BRD-K56324963-001-10-6	ChemBridge Corporation	5552067			COc1cc(CNCc2ccc(OC)c(OC)c2OC)cc(OC)c1	InChI=1S/C19H25NO5/c1-21-15-8-13(9-16(10-15)22-2)11-20-12-14-6-7-17(23-3)19(25-5)18(14)24-4/h6-10,20H,11-12H2,1-5H3	VHQABWCDGKANRB-UHFFFAOYSA-N	347.17327291							121444
T0517-9675	LSM-32888	SID22408194, BRD-A64499703	4014963	InChI=1S/C24H23NO3/c1-2-20(18-11-5-3-6-12-18)24(27)28-17-23(26)25-22-16-10-9-15-21(22)19-13-7-4-8-14-19/h3-16,20H,2,17H2,1H3,(H,25,26)	SRZGODNHWWIJAB-UHFFFAOYSA-N	CCC(C(=O)OCC(=O)Nc1ccccc1c2ccccc2)c3ccccc3	BroadT	BRD-A64499703	BRD-A64499703-001-05-3	Enamine Ltd.	T0517-9675			CCC(C(=O)OCC(=O)Nc1ccccc1-c1ccccc1)c1ccccc1	InChI=1S/C24H23NO3/c1-2-20(18-11-5-3-6-12-18)24(27)28-17-23(26)25-22-16-10-9-15-21(22)19-13-7-4-8-14-19/h3-16,20H,2,17H2,1H3,(H,25,26)	SRZGODNHWWIJAB-UHFFFAOYSA-N	373.167793606							121445
ST026790	LSM-32889	SID14726286, BRD-K06364698	725423	InChI=1S/C15H15NO4/c1-10(2)20-15(18)11-5-7-12(8-6-11)16-14(17)13-4-3-9-19-13/h3-10H,1-2H3,(H,16,17)	GVTANYIIXVAFOB-UHFFFAOYSA-N	CC(C)OC(=O)c1ccc(NC(=O)c2occc2)cc1	BroadT	BRD-K06364698	BRD-K06364698-001-05-5	Asinex Ltd.	BAS 02140434			CC(C)OC(=O)c1ccc(NC(=O)c2ccco2)cc1	InChI=1S/C15H15NO4/c1-10(2)20-15(18)11-5-7-12(8-6-11)16-14(17)13-4-3-9-19-13/h3-10H,1-2H3,(H,16,17)	GVTANYIIXVAFOB-UHFFFAOYSA-N	273.10010797							121446
AC1LD7SZ	LSM-32890	BRD-K06513056	662642	InChI=1S/C16H16N6S/c1-10-5-14(7-20-21-8-18-19-9-21)12(3)22(10)16-15(6-17)11(2)13(4)23-16/h5,7-9H,1-4H3	AQVHLVIDHRPCCN-UHFFFAOYSA-N	Cc1sc(c(C#N)c1C)n2c(C)cc(C=Nn3cnnc3)c2C	BroadT	BRD-K06513056	BRD-K06513056-001-05-3	InterBioScreen Ltd.	STOCK4S-11404			Cc1cc(C=Nn2cnnc2)c(C)n1-c1sc(C)c(C)c1C#N	InChI=1S/C16H16N6S/c1-10-5-14(7-20-21-8-18-19-9-21)12(3)22(10)16-15(6-17)11(2)13(4)23-16/h5,7-9H,1-4H3	AQVHLVIDHRPCCN-UHFFFAOYSA-N	324.115715262							121447
SMR000260255	LSM-32891	SID24779943, BRD-A67793680	3486150	InChI=1S/C27H24N4O3S/c1-16-4-9-19(10-5-16)27(3)25(33)31(26(34)30-27)15-23(32)28-20-11-7-18(8-12-20)24-29-21-13-6-17(2)14-22(21)35-24/h4-14H,15H2,1-3H3,(H,28,32)(H,30,34)	YMUSBZHQXYCJLW-UHFFFAOYSA-N	Cc1ccc(cc1)C2(C)NC(=O)N(CC(=O)Nc3ccc(cc3)c4nc5ccc(C)cc5s4)C2=O	BroadT	BRD-A67793680	BRD-A67793680-001-05-3	Enamine Ltd.	T0517-2554			Cc1ccc(cc1)C1(C)NC(=O)N(CC(=O)Nc2ccc(cc2)-c2nc3ccc(C)cc3s2)C1=O	InChI=1S/C27H24N4O3S/c1-16-4-9-19(10-5-16)27(3)25(33)31(26(34)30-27)15-23(32)28-20-11-7-18(8-12-20)24-29-21-13-6-17(2)14-22(21)35-24/h4-14H,15H2,1-3H3,(H,28,32)(H,30,34)	YMUSBZHQXYCJLW-UHFFFAOYSA-N	484.156911358							121448
2-(3,5-Dinitrophenyl)-1-(2-phenylethyl)-1H-imidazo[4,5-b]quinoxaline	LSM-32892	SID17511536, BRD-K76188740	1423235	InChI=1S/C23H16N6O4/c30-28(31)17-12-16(13-18(14-17)29(32)33)22-26-21-23(25-20-9-5-4-8-19(20)24-21)27(22)11-10-15-6-2-1-3-7-15/h1-9,12-14H,10-11H2	WLAPZCBPXKAQTR-UHFFFAOYSA-N	[O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])c2nc3nc4ccccc4nc3n2CCc5ccccc5	BroadT	BRD-K76188740	BRD-K76188740-001-07-7	InterBioScreen Ltd.	STOCK3S-75471			[O-][N+](=O)c1cc(cc(c1)[N+]([O-])=O)-c1nc2nc3ccccc3nc2n1CCc1ccccc1	InChI=1S/C23H16N6O4/c30-28(31)17-12-16(13-18(14-17)29(32)33)22-26-21-23(25-20-9-5-4-8-19(20)24-21)27(22)11-10-15-6-2-1-3-7-15/h1-9,12-14H,10-11H2	WLAPZCBPXKAQTR-UHFFFAOYSA-N	440.123303052							121449
MLS000676065	LSM-2793	BRD-K36111767, SID24793692, SID99245542, SID99376514	1251584	InChI=1S/C20H17Cl2N3O/c21-15-3-1-14(2-4-15)20(26)25-11-9-24(10-12-25)19-7-8-23-18-13-16(22)5-6-17(18)19/h1-8,13H,9-12H2	AAYTXOPXLXAKHP-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)N2CCN(CC2)c3ccnc4cc(Cl)ccc34	BroadT	BRD-K36111767	BRD-K36111767-001-12-6	ChemBridge Corporation	7959790			Clc1ccc(cc1)C(=O)N1CCN(CC1)c1ccnc2cc(Cl)ccc12	InChI=1S/C20H17Cl2N3O/c21-15-3-1-14(2-4-15)20(26)25-11-9-24(10-12-25)19-7-8-23-18-13-16(22)5-6-17(18)19/h1-8,13H,9-12H2	AAYTXOPXLXAKHP-UHFFFAOYSA-N	385.074867614							92634
AC1LG3IU	LSM-32893	BRD-K92387554	764569	InChI=1S/C15H18N4O2/c1-11-6-5-9-19-13(11)17-14(12(10-16-21)15(19)20)18-7-3-2-4-8-18/h5-6,9-10,21H,2-4,7-8H2,1H3	PGSNERQBACUBBO-UHFFFAOYSA-N	CC1=CC=CN2C(=O)C(=C(N=C12)N3CCCCC3)C=NO	BroadT	BRD-K92387554	BRD-K92387554-001-05-4	ChemDiv Inc.	3332-3991			Cc1cccn2c1nc(N1CCCCC1)c(C=NO)c2=O	InChI=1S/C15H18N4O2/c1-11-6-5-9-19-13(11)17-14(12(10-16-21)15(19)20)18-7-3-2-4-8-18/h5-6,9-10,21H,2-4,7-8H2,1H3	PGSNERQBACUBBO-UHFFFAOYSA-N	286.142975856							121450
STK344617	LSM-32894	SID24795958, BRD-K29810154	2227708	InChI=1S/C15H20ClN3OS/c1-2-6-13(20)18-15(21)17-12-8-5-7-11(16)14(12)19-9-3-4-10-19/h5,7-8H,2-4,6,9-10H2,1H3,(H2,17,18,20,21)	AOWRQRVBAUXZMU-UHFFFAOYSA-N	CCCC(=O)NC(=S)Nc1cccc(Cl)c1N2CCCC2	BroadT	BRD-K29810154	BRD-K29810154-001-06-5	ChemBridge Corporation	7953006			CCCC(=O)NC(=S)Nc1cccc(Cl)c1N1CCCC1	InChI=1S/C15H20ClN3OS/c1-2-6-13(20)18-15(21)17-12-8-5-7-11(16)14(12)19-9-3-4-10-19/h5,7-8H,2-4,6,9-10H2,1H3,(H2,17,18,20,21)	AOWRQRVBAUXZMU-UHFFFAOYSA-N	325.10156069							121451
T5333611	LSM-32895	SID24837814, BRD-K28900312	2517907	InChI=1S/C20H23N3O3S/c1-3-9-22(10-4-2)18(24)14-7-8-16-17(12-14)21-20(27)23(19(16)25)13-15-6-5-11-26-15/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,21,27)	QGIAVUQSFVCLRL-UHFFFAOYSA-N	CCCN(CCC)C(=O)c1ccc2C(=O)N(Cc3occc3)C(=S)Nc2c1	BroadT	BRD-K28900312	BRD-K28900312-001-06-4	Enamine Ltd.	T5333611			CCCN(CCC)C(=O)c1ccc2c(c1)[nH]c(=S)n(Cc1ccco1)c2=O	InChI=1S/C20H23N3O3S/c1-3-9-22(10-4-2)18(24)14-7-8-16-17(12-14)21-20(27)23(19(16)25)13-15-6-5-11-26-15/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,21,27)	QGIAVUQSFVCLRL-UHFFFAOYSA-N	385.146012316							121452
AC1OA44E	LSM-32896	SID858631, BRD-K50250963	6747015	InChI=1S/C17H13ClN2O2/c1-10-2-4-11(5-3-10)17(22)14-9-19-20-16(14)13-8-12(18)6-7-15(13)21/h2-9,21H,1H3,(H,19,20)	JEMOKNWRGGZHTL-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)c2c[nH]nc2c3cc(Cl)ccc3O	BroadT	BRD-K50250963	BRD-K50250963-001-05-9	InterBioScreen Ltd.	STOCK2S-51626			Cc1ccc(cc1)C(=O)c1c[nH]nc1-c1cc(Cl)ccc1O	InChI=1S/C17H13ClN2O2/c1-10-2-4-11(5-3-10)17(22)14-9-19-20-16(14)13-8-12(18)6-7-15(13)21/h2-9,21H,1H3,(H,19,20)	JEMOKNWRGGZHTL-UHFFFAOYSA-N	312.066555386							
T0516-6803	LSM-32897	SID3712006, BRD-K51302642	2997847	InChI=1S/C18H17NO5S2/c20-18-17(14(12-24-18)13-4-2-1-3-5-13)15-6-7-16(25-15)26(21,22)19-8-10-23-11-9-19/h1-7H,8-12H2	ZCLAJJPBYPQMJR-UHFFFAOYSA-N	O=C1OCC(=C1c2ccc(s2)S(=O)(=O)N3CCOCC3)c4ccccc4	BroadT	BRD-K51302642	BRD-K51302642-001-05-6	Enamine Ltd.	T0516-6803			O=C1OCC(=C1c1ccc(s1)S(=O)(=O)N1CCOCC1)c1ccccc1	InChI=1S/C18H17NO5S2/c20-18-17(14(12-24-18)13-4-2-1-3-5-13)15-6-7-16(25-15)26(21,22)19-8-10-23-11-9-19/h1-7H,8-12H2	ZCLAJJPBYPQMJR-UHFFFAOYSA-N	391.054814034							121454
N-(5-Phenyl-1,3,4-oxadiazol-2-yl)-1,3-benzothiazole-2-carboxamide	LSM-32898	SID26670119, SID7970403, BRD-K08308978	4121843	InChI=1S/C16H10N4O2S/c21-13(15-17-11-8-4-5-9-12(11)23-15)18-16-20-19-14(22-16)10-6-2-1-3-7-10/h1-9H,(H,18,20,21)	FJTVSMDFNPODDK-UHFFFAOYSA-N	O=C(Nc1oc(nn1)c2ccccc2)c3nc4ccccc4s3	BroadT	BRD-K08308978	BRD-K08308978-001-04-4	Life Chemicals Inc.	F1374-0873			O=C(Nc1nnc(o1)-c1ccccc1)c1nc2ccccc2s1	InChI=1S/C16H10N4O2S/c21-13(15-17-11-8-4-5-9-12(11)23-15)18-16-20-19-14(22-16)10-6-2-1-3-7-10/h1-9H,(H,18,20,21)	FJTVSMDFNPODDK-UHFFFAOYSA-N	322.05244629							121455
MLS000518250	LSM-32899	SID14728541, BRD-K92185040	1351262	InChI=1S/C17H12ClNO2/c18-14-9-5-4-8-13(14)15-10-11-16(21-15)17(20)19-12-6-2-1-3-7-12/h1-11H,(H,19,20)	LEPJYIMGRAIRJN-UHFFFAOYSA-N	Clc1ccccc1c2oc(cc2)C(=O)Nc3ccccc3	BroadT	BRD-K92185040	BRD-K92185040-001-05-4	University of Kansas CMLD	KUC100031			Clc1ccccc1-c1ccc(o1)C(=O)Nc1ccccc1	InChI=1S/C17H12ClNO2/c18-14-9-5-4-8-13(14)15-10-11-16(21-15)17(20)19-12-6-2-1-3-7-12/h1-11H,(H,19,20)	LEPJYIMGRAIRJN-UHFFFAOYSA-N	297.055656344							121456
SMR000131190	LSM-32900	SID14737697, BRD-K86355938	5097789	InChI=1S/C25H26N6O3S/c1-17-14-21(30-29-17)28-23(33)16-35-25-27-20-11-6-5-10-19(20)24(34)31(25)13-7-12-22(32)26-15-18-8-3-2-4-9-18/h2-6,8-11,14H,7,12-13,15-16H2,1H3,(H,26,32)(H2,28,29,30,33)	ZWEOMTILKLVITE-UHFFFAOYSA-N	Cc1cc(NC(=O)CSC2=Nc3ccccc3C(=O)N2CCCC(=O)NCc4ccccc4)[nH]n1	BroadT	BRD-K86355938	BRD-K86355938-001-05-6	ChemDiv Inc.	K284-3766			Cc1cc(NC(=O)CSc2nc3ccccc3c(=O)n2CCCC(=O)NCc2ccccc2)[nH]n1	InChI=1S/C25H26N6O3S/c1-17-14-21(30-29-17)28-23(33)16-35-25-27-20-11-6-5-10-19(20)24(34)31(25)13-7-12-22(32)26-15-18-8-3-2-4-9-18/h2-6,8-11,14H,7,12-13,15-16H2,1H3,(H,26,32)(H2,28,29,30,33)	ZWEOMTILKLVITE-UHFFFAOYSA-N	490.178709442							121457
T0508-6909	LSM-32901	SID24826149, BRD-K33593838	4477836	InChI=1S/C15H16N4O4/c20-15(16-14-6-9-23-17-14)11-4-5-12(13(10-11)19(21)22)18-7-2-1-3-8-18/h4-6,9-10H,1-3,7-8H2,(H,16,17,20)	GMROWGUIVLEKNK-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1N2CCCCC2)C(=O)Nc3ccon3	BroadT	BRD-K33593838	BRD-K33593838-001-05-7	Enamine Ltd.	T0508-6909			[O-][N+](=O)c1cc(ccc1N1CCCCC1)C(=O)Nc1ccon1	InChI=1S/C15H16N4O4/c20-15(16-14-6-9-23-17-14)11-4-5-12(13(10-11)19(21)22)18-7-2-1-3-8-18/h4-6,9-10H,1-3,7-8H2,(H,16,17,20)	GMROWGUIVLEKNK-UHFFFAOYSA-N	316.117155032							121458
F1838-3896	LSM-32902	SID17515196, BRD-K34895509	7191376	InChI=1S/C16H15N3OS3/c1-11-5-2-3-6-12(11)10-22-16-19-18-15(23-16)17-14(20)9-13-7-4-8-21-13/h2-8H,9-10H2,1H3,(H,17,18,20)	RRXRUCYKAYEUQV-UHFFFAOYSA-N	Cc1ccccc1CSc2nnc(NC(=O)Cc3cccs3)s2	BroadT	BRD-K34895509	BRD-K34895509-001-05-3	Life Chemicals Inc.	F1838-3896			Cc1ccccc1CSc1nnc(NC(=O)Cc2cccs2)s1	InChI=1S/C16H15N3OS3/c1-11-5-2-3-6-12(11)10-22-16-19-18-15(23-16)17-14(20)9-13-7-4-8-21-13/h2-8H,9-10H2,1H3,(H,17,18,20)	RRXRUCYKAYEUQV-UHFFFAOYSA-N	361.0377242							121459
MLS000587039	LSM-15243	BRD-K52983564	3653241	InChI=1S/C24H16N2O2S/c27-19-13-7-8-16(14-19)15-20-23(28)26-22(18-11-5-2-6-12-18)21(25-24(26)29-20)17-9-3-1-4-10-17/h1-15,27H	REHFCQCKUSKXCO-UHFFFAOYSA-N	Oc1cccc(C=C2Sc3nc(c4ccccc4)c(c5ccccc5)n3C2=O)c1	BroadT	BRD-K52983564	BRD-K52983564-015-07-2	InterBioScreen Ltd.	STOCK3S-92879		CC(=O)O	Oc1cccc(C=c2sc3nc(c(-c4ccccc4)n3c2=O)-c2ccccc2)c1.CC(=O)O	InChI=1S/C24H16N2O2S.C2H4O2/c27-19-13-7-8-16(14-19)15-20-23(28)26-22(18-11-5-2-6-12-18)21(25-24(26)29-20)17-9-3-1-4-10-17;1-2(3)4/h1-15,27H;1H3,(H,3,4)	IJTDKNGLCFAKAP-UHFFFAOYSA-N	396.093248462							103890
N-(2,3-Dimethylphenyl)-1-methyl-9H-beta-carboline-3-carboxamide	LSM-32903	SID17433004, BRD-K34325104	5400827	InChI=1S/C21H19N3O/c1-12-7-6-10-17(13(12)2)24-21(25)19-11-16-15-8-4-5-9-18(15)23-20(16)14(3)22-19/h4-11,23H,1-3H3,(H,24,25)	NMOFTYLBXGDJGZ-UHFFFAOYSA-N	Cc1cccc(NC(=O)c2cc3c4ccccc4[nH]c3c(C)n2)c1C	BroadT	BRD-K34325104	BRD-K34325104-001-05-0	ChemBridge Corporation	7247635			Cc1cccc(NC(=O)c2cc3c4ccccc4[nH]c3c(C)n2)c1C	InChI=1S/C21H19N3O/c1-12-7-6-10-17(13(12)2)24-21(25)19-11-16-15-8-4-5-9-18(15)23-20(16)14(3)22-19/h4-11,23H,1-3H3,(H,24,25)	NMOFTYLBXGDJGZ-UHFFFAOYSA-N	329.152812258							121460
T0506-0734	LSM-32904	SID3715391, BRD-K44969631	2353609	InChI=1S/C14H12N2O5/c15-7-10-1-3-11(4-2-10)16-13(17)9-21-14(18)12-8-19-5-6-20-12/h1-4,8H,5-6,9H2,(H,16,17)	HWFBGWPNSIJYQA-UHFFFAOYSA-N	O=C(COC(=O)C1=COCCO1)Nc2ccc(cc2)C#N	BroadT	BRD-K44969631	BRD-K44969631-001-05-5	Enamine Ltd.	T0506-0734			O=C(COC(=O)C1=COCCO1)Nc1ccc(cc1)C#N	InChI=1S/C14H12N2O5/c15-7-10-1-3-11(4-2-10)16-13(17)9-21-14(18)12-8-19-5-6-20-12/h1-4,8H,5-6,9H2,(H,16,17)	HWFBGWPNSIJYQA-UHFFFAOYSA-N	288.074621504							121461
AC1OB46V	LSM-32905	SID17401784, BRD-A96787752	6839822	InChI=1S/C23H15N3O5/c27-14-11-9-13(10-12-14)20(28)25-24-19-17-7-3-4-8-18(17)26(21(19)29)22-15-5-1-2-6-16(15)23(30)31-22/h1-12,22,27,29H	AATPPZVLYNXMFT-UHFFFAOYSA-N	Oc1ccc(cc1)C(=O)N=Nc2c(O)n(C3OC(=O)c4ccccc34)c5ccccc25	BroadT	BRD-A96787752	BRD-A96787752-001-05-3	InterBioScreen Ltd.	STOCK5S-46528			Oc1c(N=NC(=O)c2ccc(O)cc2)c2ccccc2n1C1OC(=O)c2ccccc12	InChI=1S/C23H15N3O5/c27-14-11-9-13(10-12-14)20(28)25-24-19-17-7-3-4-8-18(17)26(21(19)29)22-15-5-1-2-6-16(15)23(30)31-22/h1-12,22,27,29H	AATPPZVLYNXMFT-UHFFFAOYSA-N	413.10117061							
AC1M4LHF	LSM-32906	BRD-K58881578	2310259	InChI=1S/C24H22N2O5/c1-30-20-13-11-18(12-14-20)15-25-31-17-23(27)26(16-19-7-3-2-4-8-19)22-10-6-5-9-21(22)24(28)29/h2-15H,16-17H2,1H3,(H,28,29)	QOSMVXJBFXNWCK-UHFFFAOYSA-N	COc1ccc(C=NOCC(=O)N(Cc2ccccc2)c3ccccc3C(=O)O)cc1	BroadT	BRD-K58881578	BRD-K58881578-001-05-0	Enamine Ltd.	T0502-4447			COc1ccc(C=NOCC(=O)N(Cc2ccccc2)c2ccccc2C(O)=O)cc1	InChI=1S/C24H22N2O5/c1-30-20-13-11-18(12-14-20)15-25-31-17-23(27)26(16-19-7-3-2-4-8-19)22-10-6-5-9-21(22)24(28)29/h2-15H,16-17H2,1H3,(H,28,29)	QOSMVXJBFXNWCK-UHFFFAOYSA-N	418.152871824							121463
SMR000027766	LSM-32907	BRD-A19067654	3236698	InChI=1S/C21H26N2O5S/c1-15-5-3-4-6-17(15)20-22-18(16(2)28-20)13-29(25)14-19(24)23-9-7-21(8-10-23)26-11-12-27-21/h3-6H,7-14H2,1-2H3	YRKFVPUHSHIBAT-UHFFFAOYSA-N	Cc1oc(nc1CS(=O)CC(=O)N2CCC3(CC2)OCCO3)c4ccccc4C	BroadT	BRD-A19067654	BRD-A19067654-001-06-1	ChemDiv Inc.	C527-1086			Cc1oc(nc1CS(=O)CC(=O)N1CCC2(CC1)OCCO2)-c1ccccc1C	InChI=1S/C21H26N2O5S/c1-15-5-3-4-6-17(15)20-22-18(16(2)28-20)13-29(25)14-19(24)23-9-7-21(8-10-23)26-11-12-27-21/h3-6H,7-14H2,1-2H3	YRKFVPUHSHIBAT-UHFFFAOYSA-N	418.156242642							121464
BRD-K62988556	LSM-32908			InChI=1S/C17H15N3OS/c1-12(11-15(21)13-7-3-2-4-8-13)19-20-17-18-14-9-5-6-10-16(14)22-17/h2-10H,11H2,1H3,(H,18,20)	BQJYLODSBKXXPB-UHFFFAOYSA-N	CC(=NNc1nc2ccccc2s1)CC(=O)c3ccccc3	BroadT	BRD-K62988556	BRD-K62988556-001-05-3	Asinex Ltd.	BAS 00436357			CC(CC(=O)c1ccccc1)=NNc1nc2ccccc2s1	InChI=1S/C17H15N3OS/c1-12(11-15(21)13-7-3-2-4-8-13)19-20-17-18-14-9-5-6-10-16(14)22-17/h2-10H,11H2,1H3,(H,18,20)	BQJYLODSBKXXPB-UHFFFAOYSA-N	309.09358282							121465
MLS000769179	LSM-44437	SID26671518, BRD-K26647922	5513649	InChI=1S/C18H16N4O5/c1-11(23)20-13-6-4-12(5-7-13)19-9-15-16(24)21-18(26)22(17(15)25)10-14-3-2-8-27-14/h2-9,19H,10H2,1H3,(H,20,23)(H,21,24,26)/b15-9+	VMBOTZDBDOQIBW-OQLLNIDSSA-N	CC(=O)Nc1ccc(N\C=C\2/C(=O)NC(=O)N(Cc3occc3)C2=O)cc1	BroadT	BRD-K26647922	BRD-K26647922-001-05-7	InterBioScreen Ltd.	STOCK2S-43389			CC(=O)Nc1ccc(N\C=C2/C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1	InChI=1S/C18H16N4O5/c1-11(23)20-13-6-4-12(5-7-13)19-9-15-16(24)21-18(26)22(17(15)25)10-14-3-2-8-27-14/h2-9,19H,10H2,1H3,(H,20,23)(H,21,24,26)/b15-9+	VMBOTZDBDOQIBW-OQLLNIDSSA-N	368.112069652							
SMR000152411	LSM-32910	SID14744654, BRD-K39380368	4270502	InChI=1S/C19H18N4S3/c1-2-12-24-18-22-21-17(23(18)14-8-4-3-5-9-14)13-25-19-20-15-10-6-7-11-16(15)26-19/h3-11H,2,12-13H2,1H3	OIAZFFXIXTUXFO-UHFFFAOYSA-N	CCCSc1nnc(CSc2nc3ccccc3s2)n1c4ccccc4	BroadT	BRD-K39380368	BRD-K39380368-001-06-9	Enamine Ltd.	T0519-3108			CCCSc1nnc(CSc2nc3ccccc3s2)n1-c1ccccc1	InChI=1S/C19H18N4S3/c1-2-12-24-18-22-21-17(23(18)14-8-4-3-5-9-14)13-25-19-20-15-10-6-7-11-16(15)26-19/h3-11H,2,12-13H2,1H3	OIAZFFXIXTUXFO-UHFFFAOYSA-N	398.069358686							121467
6-(4-Bromophenyl)-2-methylpyridine-3-carboxylic acid	LSM-32911	SID22414092, BRD-K25140717	7285290	InChI=1S/C13H10BrNO2/c1-8-11(13(16)17)6-7-12(15-8)9-2-4-10(14)5-3-9/h2-7H,1H3,(H,16,17)	CQOTVCGJANBNRT-UHFFFAOYSA-N	Cc1nc(ccc1C(=O)O)c2ccc(Br)cc2	BroadT	BRD-K25140717	BRD-K25140717-001-05-3	Specs	AG-401/42504351			Cc1nc(ccc1C(O)=O)-c1ccc(Br)cc1	InChI=1S/C13H10BrNO2/c1-8-11(13(16)17)6-7-12(15-8)9-2-4-10(14)5-3-9/h2-7H,1H3,(H,16,17)	CQOTVCGJANBNRT-UHFFFAOYSA-N	290.98949117							121468
T0516-6992	LSM-32912	SID16953502, BRD-K66459603	4331920	InChI=1S/C23H32N2O4S/c26-21(24-17-9-3-1-4-10-17)15-29-23(28)19-13-7-8-14-20(19)30-16-22(27)25-18-11-5-2-6-12-18/h7-8,13-14,17-18H,1-6,9-12,15-16H2,(H,24,26)(H,25,27)	TYUJASFJJYCKKS-UHFFFAOYSA-N	O=C(COC(=O)c1ccccc1SCC(=O)NC2CCCCC2)NC3CCCCC3	BroadT	BRD-K66459603	BRD-K66459603-001-05-4	Enamine Ltd.	T0516-6992			O=C(COC(=O)c1ccccc1SCC(=O)NC1CCCCC1)NC1CCCCC1	InChI=1S/C23H32N2O4S/c26-21(24-17-9-3-1-4-10-17)15-29-23(28)19-13-7-8-14-20(19)30-16-22(27)25-18-11-5-2-6-12-18/h7-8,13-14,17-18H,1-6,9-12,15-16H2,(H,24,26)(H,25,27)	TYUJASFJJYCKKS-UHFFFAOYSA-N	432.208278214							121469
MLS001202748	LSM-32913	SID49645367, BRD-K13189410	54678746	InChI=1S/C20H17ClN2O3/c1-2-11-23-16-6-4-3-5-15(16)18(24)17(20(23)26)19(25)22-12-13-7-9-14(21)10-8-13/h2-10,24H,1,11-12H2,(H,22,25)	ZSPNXMNSMFLTLY-UHFFFAOYSA-N	OC1=C(C(=O)NCc2ccc(Cl)cc2)C(=O)N(CC=C)c3ccccc13	BroadT	BRD-K13189410	BRD-K13189410-001-06-2	Asinex Ltd.	BAS 00363984			Oc1c(C(=O)NCc2ccc(Cl)cc2)c(=O)n(CC=C)c2ccccc12	InChI=1S/C20H17ClN2O3/c1-2-11-23-16-6-4-3-5-15(16)18(24)17(20(23)26)19(25)22-12-13-7-9-14(21)10-8-13/h2-10,24H,1,11-12H2,(H,22,25)	ZSPNXMNSMFLTLY-UHFFFAOYSA-N	368.092770134							121470
ASN 03155338	LSM-32914	SID842504, BRD-K54406300	644775	InChI=1S/C22H22N4OS/c1-22(2)13-16-8-3-5-9-17(16)20-23-24-21(26(20)22)28-14-19(27)25-12-11-15-7-4-6-10-18(15)25/h3-10H,11-14H2,1-2H3	DQFOPYSEAVPWQL-UHFFFAOYSA-N	CC1(C)Cc2ccccc2c3nnc(SCC(=O)N4CCc5ccccc45)n13	BroadT	BRD-K54406300	BRD-K54406300-001-05-5	Asinex Ltd.	ASN 03155338			CC1(C)Cc2ccccc2-c2nnc(SCC(=O)N3CCc4ccccc34)n12	InChI=1S/C22H22N4OS/c1-22(2)13-16-8-3-5-9-17(16)20-23-24-21(26(20)22)28-14-19(27)25-12-11-15-7-4-6-10-18(15)25/h3-10H,11-14H2,1-2H3	DQFOPYSEAVPWQL-UHFFFAOYSA-N	390.151432054							121471
AC1LJM3M	LSM-44438	SID24793329, BRD-K84931071	1002798	InChI=1S/C20H21NO5S/c1-11(2)13-5-7-14(8-6-13)17-12(3)27-19(18(17)20(25)26-4)21-15(22)9-10-16(23)24/h5-11H,1-4H3,(H,21,22)(H,23,24)/b10-9+	KNWCZRXQURNYDN-MDZDMXLPSA-N	COC(=O)c1c(NC(=O)\C=C\C(=O)O)sc(C)c1c2ccc(cc2)C(C)C	BroadT	BRD-K84931071	BRD-K84931071-001-06-1	ChemBridge Corporation	7248459			COC(=O)c1c(NC(=O)\C=C\C(O)=O)sc(C)c1-c1ccc(cc1)C(C)C	InChI=1S/C20H21NO5S/c1-11(2)13-5-7-14(8-6-13)17-12(3)27-19(18(17)20(25)26-4)21-15(22)9-10-16(23)24/h5-11H,1-4H3,(H,21,22)(H,23,24)/b10-9+	KNWCZRXQURNYDN-MDZDMXLPSA-N	387.114043472							
MLS000073552	LSM-32916	SID842693, BRD-K92614038	644964	InChI=1S/C25H23N5O3/c31-23-18-7-1-2-8-19(18)24(32)30(23)14-5-11-22-27-21-10-4-3-9-20(21)25(33)29(22)15-6-13-28-16-12-26-17-28/h1-4,7-10,12,16-17H,5-6,11,13-15H2	YBNRLCUXQBXSJX-UHFFFAOYSA-N	O=C1N(CCCn2ccnc2)C(=Nc3ccccc13)CCCN4C(=O)c5ccccc5C4=O	BroadT	BRD-K92614038	BRD-K92614038-001-05-7	Asinex Ltd.	BAS 01817228			O=C1N(CCCc2nc3ccccc3c(=O)n2CCCn2ccnc2)C(=O)c2ccccc12	InChI=1S/C25H23N5O3/c31-23-18-7-1-2-8-19(18)24(32)30(23)14-5-11-22-27-21-10-4-3-9-20(21)25(33)29(22)15-6-13-28-16-12-26-17-28/h1-4,7-10,12,16-17H,5-6,11,13-15H2	YBNRLCUXQBXSJX-UHFFFAOYSA-N	441.180089646							121473
4-(4-Chlorophenyl)-n-(pyridin-3-ylmethyl)-6-(trifluoromethyl)pyrimidin-2-amine	LSM-32917	SID14742769, BRD-K64939875	1952075	InChI=1S/C17H12ClF3N4/c18-13-5-3-12(4-6-13)14-8-15(17(19,20)21)25-16(24-14)23-10-11-2-1-7-22-9-11/h1-9H,10H2,(H,23,24,25)	VGGVWXJWWBYLBZ-UHFFFAOYSA-N	FC(F)(F)c1cc(nc(NCc2cccnc2)n1)c3ccc(Cl)cc3	BroadT	BRD-K64939875	BRD-K64939875-001-07-4	InterBioScreen Ltd.	STOCK5S-51169			FC(F)(F)c1cc(nc(NCc2cccnc2)n1)-c1ccc(Cl)cc1	InChI=1S/C17H12ClF3N4/c18-13-5-3-12(4-6-13)14-8-15(17(19,20)21)25-16(24-14)23-10-11-2-1-7-22-9-11/h1-9H,10H2,(H,23,24,25)	VGGVWXJWWBYLBZ-UHFFFAOYSA-N	364.070258734							121474
5C-087	LSM-44439	SID24817424, BRD-K54336972	5524313	InChI=1S/C13H10FN3S2/c1-18-13-11(8-15)12(19-17-13)6-7-16-10-4-2-9(14)3-5-10/h2-7,16H,1H3/b7-6+	SDAFHXWDHYZMQF-VOTSOKGWSA-N	CSc1nsc(\C=C\Nc2ccc(F)cc2)c1C#N	BroadT	BRD-K54336972	BRD-K54336972-001-05-1	Key Organics Ltd.	5C-087			CSc1nsc(\C=C\Nc2ccc(F)cc2)c1C#N	InChI=1S/C13H10FN3S2/c1-18-13-11(8-15)12(19-17-13)6-7-16-10-4-2-9(14)3-5-10/h2-7,16H,1H3/b7-6+	SDAFHXWDHYZMQF-VOTSOKGWSA-N	291.03001693							
(4-Hydroxy-2-oxo-1,2-dihydro-quinolin-3-yl)-acetic acid propyl ester	LSM-32919	SID843054, BRD-K70175115	54687731	InChI=1S/C14H15NO4/c1-2-7-19-12(16)8-10-13(17)9-5-3-4-6-11(9)15-14(10)18/h3-6H,2,7-8H2,1H3,(H2,15,17,18)	GZGDKWSUKCDQKU-UHFFFAOYSA-N	CCCOC(=O)Cc1c(O)nc2ccccc2c1O	BroadT	BRD-K70175115	BRD-K70175115-001-05-1	Asinex Ltd.	BAS 00505028			CCCOC(=O)Cc1c(O)nc2ccccc2c1O	InChI=1S/C14H15NO4/c1-2-7-19-12(16)8-10-13(17)9-5-3-4-6-11(9)15-14(10)18/h3-6H,2,7-8H2,1H3,(H2,15,17,18)	GZGDKWSUKCDQKU-UHFFFAOYSA-N	261.10010797							121476
4-(4-Fluorophenoxy)-3-nitrobenzenecarbaldehyde oxime	LSM-32920	BRD-K57030672	1480401	InChI=1S/C13H9FN2O4/c14-10-2-4-11(5-3-10)20-13-6-1-9(8-15-17)7-12(13)16(18)19/h1-8,17H	XNWKLFLYESWZIP-UHFFFAOYSA-N	ON=Cc1ccc(Oc2ccc(F)cc2)c(c1)[N+](=O)[O-]	BroadT	BRD-K57030672	BRD-K57030672-001-06-8	Key Organics Ltd.	1D-069			ON=Cc1ccc(Oc2ccc(F)cc2)c(c1)[N+]([O-])=O	InChI=1S/C13H9FN2O4/c14-10-2-4-11(5-3-10)20-13-6-1-9(8-15-17)7-12(13)16(18)19/h1-8,17H	XNWKLFLYESWZIP-UHFFFAOYSA-N	276.054634988							121477
SMR000068485	LSM-32921	SID3712667, BRD-A82607477	2998114	InChI=1S/C20H23F2NO5/c21-18(22)28-15-4-2-1-3-14(15)23-16(24)10-27-17(25)19-6-12-5-13(7-19)9-20(26,8-12)11-19/h1-4,12-13,18,26H,5-11H2,(H,23,24)	VTARJFYRXDMCGG-UHFFFAOYSA-N	OC12CC3CC(C1)CC(C3)(C2)C(=O)OCC(=O)Nc4ccccc4OC(F)F	BroadT	BRD-A82607477	BRD-A82607477-001-05-3	Enamine Ltd.	T5342513			OC12CC3CC(C1)CC(C3)(C2)C(=O)OCC(=O)Nc1ccccc1OC(F)F	InChI=1S/C20H23F2NO5/c21-18(22)28-15-4-2-1-3-14(15)23-16(24)10-27-17(25)19-6-12-5-13(7-19)9-20(26,8-12)11-19/h1-4,12-13,18,26H,5-11H2,(H,23,24)	VTARJFYRXDMCGG-UHFFFAOYSA-N	395.154429246							121478
T0511-6287	LSM-32922	SID3714536, BRD-K94059524	2393143	InChI=1S/C21H21N5O2S/c1-13-9-10-16-17(11-13)23-21(22-16)29-12-18(27)24-19-14(2)25(3)26(20(19)28)15-7-5-4-6-8-15/h4-11H,12H2,1-3H3,(H,22,23)(H,24,27)	GANKKCSDAXWCPT-UHFFFAOYSA-N	CN1N(C(=O)C(=C1C)NC(=O)CSc2nc3cc(C)ccc3[nH]2)c4ccccc4	BroadT	BRD-K94059524	BRD-K94059524-001-05-4	Enamine Ltd.	T0511-6287			Cc1c(NC(=O)CSc2nc3cc(C)ccc3[nH]2)c(=O)n(-c2ccccc2)n1C	InChI=1S/C21H21N5O2S/c1-13-9-10-16-17(11-13)23-21(22-16)29-12-18(27)24-19-14(2)25(3)26(20(19)28)15-7-5-4-6-8-15/h4-11H,12H2,1-3H3,(H,22,23)(H,24,27)	GANKKCSDAXWCPT-UHFFFAOYSA-N	407.141595652							121479
MLS000766555	LSM-32923	SID24841591, BRD-K29448239	16197079	InChI=1S/C22H24BrNO4/c23-18-10-8-16(9-11-18)17-14-20(22(26)24-19-6-2-1-3-7-19)28-21(15-17)27-13-5-4-12-25/h1-3,6-11,14,17,21,25H,4-5,12-13,15H2,(H,24,26)/t17-,21+/m1/s1	LATSOZBAVVRALT-UTKZUKDTSA-N	OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)Nc2ccccc2)c3ccc(Br)cc3	BroadT	BRD-K29448239	BRD-K29448239-001-06-3	Harvard University	DHPC11_000617			OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)Nc1ccccc1)c1ccc(Br)cc1	InChI=1S/C22H24BrNO4/c23-18-10-8-16(9-11-18)17-14-20(22(26)24-19-6-2-1-3-7-19)28-21(15-17)27-13-5-4-12-25/h1-3,6-11,14,17,21,25H,4-5,12-13,15H2,(H,24,26)/t17-,21+/m1/s1	LATSOZBAVVRALT-UTKZUKDTSA-N	445.088870858							121480
SMR000003336	LSM-32924	SID845276, BRD-K09830863	647616	InChI=1S/C23H27N3O4S/c1-23(2,3)26(14-16-9-7-6-8-10-16)20(27)15-31-22-25-24-21(30-22)17-11-18(28-4)13-19(12-17)29-5/h6-13H,14-15H2,1-5H3	FPSXUFWBKQYDAA-UHFFFAOYSA-N	COc1cc(OC)cc(c1)c2oc(SCC(=O)N(Cc3ccccc3)C(C)(C)C)nn2	BroadT	BRD-K09830863	BRD-K09830863-001-06-9	Asinex Ltd.	ASN 04392672			COc1cc(OC)cc(c1)-c1nnc(SCC(=O)N(Cc2ccccc2)C(C)(C)C)o1	InChI=1S/C23H27N3O4S/c1-23(2,3)26(14-16-9-7-6-8-10-16)20(27)15-31-22-25-24-21(30-22)17-11-18(28-4)13-19(12-17)29-5/h6-13H,14-15H2,1-5H3	FPSXUFWBKQYDAA-UHFFFAOYSA-N	441.172227064							121481
N-(3-Methoxybenzyl)-4H-3,1-benzothiazin-2-amine	LSM-32925	SID24821098, BRD-K33250330	3701956	InChI=1S/C16H16N2OS/c1-19-14-7-4-5-12(9-14)10-17-16-18-15-8-3-2-6-13(15)11-20-16/h2-9H,10-11H2,1H3,(H,17,18)	OAXYBUOUIBRUFV-UHFFFAOYSA-N	COc1cccc(CNC2=Nc3ccccc3CS2)c1	BroadT	BRD-K33250330	BRD-K33250330-001-05-7	Key Organics Ltd.	2F-317S			COc1cccc(CNC2=Nc3ccccc3CS2)c1	InChI=1S/C16H16N2OS/c1-19-14-7-4-5-12(9-14)10-17-16-18-15-8-3-2-6-13(15)11-20-16/h2-9H,10-11H2,1H3,(H,17,18)	OAXYBUOUIBRUFV-UHFFFAOYSA-N	284.098333842							121482
MLS000773375	LSM-32926	SID24836108, BRD-K60346898	2429565	InChI=1S/C19H24N2O2S/c1-3-14-6-5-7-15(4-2)18(14)21-19(24)20-11-10-13-8-9-16(22)17(23)12-13/h5-9,12,22-23H,3-4,10-11H2,1-2H3,(H2,20,21,24)	HYQOFLWNPUNPDF-UHFFFAOYSA-N	CCc1cccc(CC)c1N=C(S)NCCc2ccc(O)c(O)c2	BroadT	BRD-K60346898	BRD-K60346898-001-05-3	Enamine Ltd.	T0517-4031			CCc1cccc(CC)c1N=C(S)NCCc1ccc(O)c(O)c1	InChI=1S/C19H24N2O2S/c1-3-14-6-5-7-15(4-2)18(14)21-19(24)20-11-10-13-8-9-16(22)17(23)12-13/h5-9,12,22-23H,3-4,10-11H2,1-2H3,(H2,20,21,24)	HYQOFLWNPUNPDF-UHFFFAOYSA-N	344.155848718							121483
AC1N0G4R	LSM-32927	SID24827583, BRD-A25536415	3916515	InChI=1S/C14H18N4O3S2/c1-2-17(11-6-8-23(20,21)10-11)13(19)9-22-14-16-15-12-5-3-4-7-18(12)14/h3-5,7,11H,2,6,8-10H2,1H3	ZTLXJMGSTKVYOO-UHFFFAOYSA-N	CCN(C1CCS(=O)(=O)C1)C(=O)CSc2nnc3ccccn23	BroadT	BRD-A25536415	BRD-A25536415-001-05-9	Enamine Ltd.	T0520-8033			CCN(C1CCS(=O)(=O)C1)C(=O)CSc1nnc2ccccn12	InChI=1S/C14H18N4O3S2/c1-2-17(11-6-8-23(20,21)10-11)13(19)9-22-14-16-15-12-5-3-4-7-18(12)14/h3-5,7,11H,2,6,8-10H2,1H3	ZTLXJMGSTKVYOO-UHFFFAOYSA-N	354.082031856							121484
MLS000522550	LSM-32928	SID14731712, SID24385134, BRD-K62708658	9550143	InChI=1S/C22H19NO3S/c1-3-23(13-15-7-5-4-6-8-15)21(24)19-12-17-20(27-19)16-11-14(2)9-10-18(16)26-22(17)25/h4-12H,3,13H2,1-2H3	JGQUYOVUWDUVLF-UHFFFAOYSA-N	CCN(Cc1ccccc1)C(=O)c2cc3C(=O)Oc4ccc(C)cc4c3s2	BroadT	BRD-K62708658	BRD-K62708658-001-04-5	ChemDiv Inc.	C593-1228			CCN(Cc1ccccc1)C(=O)c1cc2c(s1)c1cc(C)ccc1oc2=O	InChI=1S/C22H19NO3S/c1-3-23(13-15-7-5-4-6-8-15)21(24)19-12-17-20(27-19)16-11-14(2)9-10-18(16)26-22(17)25/h4-12H,3,13H2,1-2H3	JGQUYOVUWDUVLF-UHFFFAOYSA-N	377.108564168							121485
T5307501	LSM-32929	SID22409970, BRD-A81673942	4877935	InChI=1S/C22H22N2O/c1-16-13-17(2)15-20(14-16)24-22(25)21(18-9-5-3-6-10-18)23-19-11-7-4-8-12-19/h3-15,21,23H,1-2H3,(H,24,25)	LLDVHTHYXJXWQV-UHFFFAOYSA-N	Cc1cc(C)cc(NC(=O)C(Nc2ccccc2)c3ccccc3)c1	BroadT	BRD-A81673942	BRD-A81673942-001-05-3	Enamine Ltd.	T5307501			Cc1cc(C)cc(NC(=O)C(Nc2ccccc2)c2ccccc2)c1	InChI=1S/C22H22N2O/c1-16-13-17(2)15-20(14-16)24-22(25)21(18-9-5-3-6-10-18)23-19-11-7-4-8-12-19/h3-15,21,23H,1-2H3,(H,24,25)	LLDVHTHYXJXWQV-UHFFFAOYSA-N	330.173213344							121486
SMR000094591	LSM-32930	BRD-A96718709	5308220	InChI=1S/C19H24N2O4S/c1-13-5-3-6-15(9-13)19-21-17(14(2)25-19)11-26(23)12-18(22)20-10-16-7-4-8-24-16/h3,5-6,9,16H,4,7-8,10-12H2,1-2H3,(H,20,22)	HYHJNUHKIVRWHY-UHFFFAOYSA-N	Cc1cccc(c1)c2oc(C)c(CS(=O)CC(=O)NCC3CCCO3)n2	BroadT	BRD-A96718709	BRD-A96718709-001-05-2	ChemDiv Inc.	C527-0598			Cc1oc(nc1CS(=O)CC(=O)NCC1CCCO1)-c1cccc(C)c1	InChI=1S/C19H24N2O4S/c1-13-5-3-6-15(9-13)19-21-17(14(2)25-19)11-26(23)12-18(22)20-10-16-7-4-8-24-16/h3,5-6,9,16H,4,7-8,10-12H2,1-2H3,(H,20,22)	HYHJNUHKIVRWHY-UHFFFAOYSA-N	376.145677958							121487
F0651-0191	LSM-32931	SID17515136, BRD-K65534176	3561766	InChI=1S/C19H19N3O3/c1-12-9-15-10-14(7-8-18(15)21(12)3)11-20-19(23)16-5-4-6-17(13(16)2)22(24)25/h4-10H,11H2,1-3H3,(H,20,23)	TYCFPEKQINNRSR-UHFFFAOYSA-N	Cc1cc2cc(CNC(=O)c3cccc(c3C)[N+](=O)[O-])ccc2n1C	BroadT	BRD-K65534176	BRD-K65534176-001-04-5	Life Chemicals Inc.	F0651-0191			Cc1cc2cc(CNC(=O)c3cccc(c3C)[N+]([O-])=O)ccc2n1C	InChI=1S/C19H19N3O3/c1-12-9-15-10-14(7-8-18(15)21(12)3)11-20-19(23)16-5-4-6-17(13(16)2)22(24)25/h4-10H,11H2,1-3H3,(H,20,23)	TYCFPEKQINNRSR-UHFFFAOYSA-N	337.142641498							121488
SMR000072849	LSM-32932	SID4255747, BRD-K89357036	731815	InChI=1S/C13H17NO/c1-11(2)10-13(15)14-9-8-12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3,(H,14,15)	FCKSARQRQMJRHX-UHFFFAOYSA-N	CC(=CC(=O)NCCc1ccccc1)C	BroadT	BRD-K89357036	BRD-K89357036-001-05-0	ChemBridge Corporation	7488856			CC(C)=CC(=O)NCCc1ccccc1	InChI=1S/C13H17NO/c1-11(2)10-13(15)14-9-8-12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3,(H,14,15)	FCKSARQRQMJRHX-UHFFFAOYSA-N	203.131014174							121489
MLS000679860	LSM-32933	SID24795248, BRD-K48996339	2981331	InChI=1S/C17H13N5O2S/c23-16(12-4-1-7-18-10-12)22-17(19-11-13-5-3-9-25-13)20-15(21-22)14-6-2-8-24-14/h1-10H,11H2,(H,19,20,21)	TXWBMUBXCIYFDD-UHFFFAOYSA-N	O=C(c1cccnc1)n2nc(nc2NCc3cccs3)c4occc4	BroadT	BRD-K48996339	BRD-K48996339-001-04-2	ChemBridge Corporation	7981072			O=C(c1cccnc1)n1nc(nc1NCc1cccs1)-c1ccco1	InChI=1S/C17H13N5O2S/c23-16(12-4-1-7-18-10-12)22-17(19-11-13-5-3-9-25-13)20-15(21-22)14-6-2-8-24-14/h1-10H,11H2,(H,19,20,21)	TXWBMUBXCIYFDD-UHFFFAOYSA-N	351.078995396							121490
MLS000576777	LSM-44440	SID17414338, BRD-K36957463	5737412	InChI=1S/C23H20N2O7/c1-4-30-23-20(32-15(3)27)13-10-17(22(23)25(28)29)9-12-18-11-8-16-6-5-7-19(21(16)24-18)31-14(2)26/h5-13H,4H2,1-3H3/b12-9+	KQMWGMYCERRTFP-FMIVXFBMSA-N	CCOc1c(OC(=O)C)ccc(\C=C\c2ccc3cccc(OC(=O)C)c3n2)c1[N+](=O)[O-]	BroadT	BRD-K36957463	BRD-K36957463-001-07-9	ChemBridge Corporation	7349797			CCOc1c(OC(C)=O)ccc(\C=C\c2ccc3cccc(OC(C)=O)c3n2)c1[N+]([O-])=O	InChI=1S/C23H20N2O7/c1-4-30-23-20(32-15(3)27)13-10-17(22(23)25(28)29)9-12-18-11-8-16-6-5-7-19(21(16)24-18)31-14(2)26/h5-13H,4H2,1-3H3/b12-9+	KQMWGMYCERRTFP-FMIVXFBMSA-N	436.127051							
MLS000535320	LSM-32935	SID14746285, BRD-K61347274	704124	InChI=1S/C19H17N3OS/c1-12-13(2)22(17-10-6-3-7-14(12)17)18(23)11-24-19-20-15-8-4-5-9-16(15)21-19/h3-10H,11H2,1-2H3,(H,20,21)	CAPMCIXDPRWVQT-UHFFFAOYSA-N	Cc1c(C)n(C(=O)CSc2nc3ccccc3[nH]2)c4ccccc14	BroadT	BRD-K61347274	BRD-K61347274-001-05-4	ChemBridge Corporation	6997458			Cc1c(C)c2ccccc2n1C(=O)CSc1nc2ccccc2[nH]1	InChI=1S/C19H17N3OS/c1-12-13(2)22(17-10-6-3-7-14(12)17)18(23)11-24-19-20-15-8-4-5-9-16(15)21-19/h3-10H,11H2,1-2H3,(H,20,21)	CAPMCIXDPRWVQT-UHFFFAOYSA-N	335.109232884							121492
AC1MIXDK	LSM-32936	BRD-K58467337	3128019	InChI=1S/C13H10N6O3/c20-12(21)9-3-1-2-8(6-9)11-5-4-10(22-11)7-14-15-13-16-18-19-17-13/h1-7H,(H,20,21)(H2,15,16,17,18,19)	UPZHAFAEPFBISJ-UHFFFAOYSA-N	OC(=O)c1cccc(c1)c2oc(C=NNc3nn[nH]n3)cc2	BroadT	BRD-K58467337	BRD-K58467337-001-05-0	Asinex Ltd.	BAS 01229061			OC(=O)c1cccc(c1)-c1ccc(C=NNc2nn[nH]n2)o1	InChI=1S/C13H10N6O3/c20-12(21)9-3-1-2-8(6-9)11-5-4-10(22-11)7-14-15-13-16-18-19-17-13/h1-7H,(H,20,21)(H2,15,16,17,18,19)	UPZHAFAEPFBISJ-UHFFFAOYSA-N	298.08143824							121493
AF-399/41703387	LSM-44441	SID14735969, BRD-K61364657	5737875	InChI=1S/C16H11FO2S/c1-10-13-9-11(17)4-7-15(13)19-16(10)14(18)6-5-12-3-2-8-20-12/h2-9H,1H3/b6-5+	UWFVQQDZCDAGAY-AATRIKPKSA-N	Cc1c(oc2ccc(F)cc12)C(=O)\C=C\c3cccs3	BroadT	BRD-K61364657	BRD-K61364657-001-06-4	ChemBridge Corporation	7416414			Cc1c(oc2ccc(F)cc12)C(=O)\C=C\c1cccs1	InChI=1S/C16H11FO2S/c1-10-13-9-11(17)4-7-15(13)19-16(10)14(18)6-5-12-3-2-8-20-12/h2-9H,1H3/b6-5+	UWFVQQDZCDAGAY-AATRIKPKSA-N	286.046378482							
51420-72-5	LSM-32938	SID24824554, BRD-K23348840	2783071	InChI=1S/C10H5F6N3/c11-9(12,13)5-3-6(10(14,15)16)18-8-4(5)1-2-7(17)19-8/h1-3H,(H2,17,18,19)	CLSSRJKZGCCBKL-UHFFFAOYSA-N	Nc1ccc2c(cc(nc2n1)C(F)(F)F)C(F)(F)F	BroadT	BRD-K23348840	BRD-K23348840-001-06-2	Key Organics Ltd.	8D-104			Nc1ccc2c(cc(nc2n1)C(F)(F)F)C(F)(F)F	InChI=1S/C10H5F6N3/c11-9(12,13)5-3-6(10(14,15)16)18-8-4(5)1-2-7(17)19-8/h1-3H,(H2,17,18,19)	CLSSRJKZGCCBKL-UHFFFAOYSA-N	281.03876639							121495
ZINC04107409	LSM-32939	SID7970230, BRD-K22292830	4393476	InChI=1S/C19H16ClN3O2/c20-16-8-4-3-7-15(16)17(24)21-19-23-22-18(25-19)14-10-9-12-5-1-2-6-13(12)11-14/h3-4,7-11H,1-2,5-6H2,(H,21,23,24)	FEJNCHNTNHUAMS-UHFFFAOYSA-N	Clc1ccccc1C(=O)Nc2oc(nn2)c3ccc4CCCCc4c3	BroadT	BRD-K22292830	BRD-K22292830-001-04-0	Life Chemicals Inc.	F0608-0658			Clc1ccccc1C(=O)Nc1nnc(o1)-c1ccc2CCCCc2c1	InChI=1S/C19H16ClN3O2/c20-16-8-4-3-7-15(16)17(24)21-19-23-22-18(25-19)14-10-9-12-5-1-2-6-13(12)11-14/h3-4,7-11H,1-2,5-6H2,(H,21,23,24)	FEJNCHNTNHUAMS-UHFFFAOYSA-N	353.093104492							121496
MLS000029758	LSM-32940	SID845090, BRD-K78374611	647427	InChI=1S/C13H16N4O2/c1-3-10-4-6-11(7-5-10)13-14-16-17(15-13)9-8-12(18)19-2/h4-7H,3,8-9H2,1-2H3	SXESLUJHEBYPFX-UHFFFAOYSA-N	CCc1ccc(cc1)c2nnn(CCC(=O)OC)n2	BroadT	BRD-K78374611	BRD-K78374611-001-05-1	Asinex Ltd.	ASN 03780511			CCc1ccc(cc1)-c1nnn(CCC(=O)OC)n1	InChI=1S/C13H16N4O2/c1-3-10-4-6-11(7-5-10)13-14-16-17(15-13)9-8-12(18)19-2/h4-7H,3,8-9H2,1-2H3	SXESLUJHEBYPFX-UHFFFAOYSA-N	260.127325792							121497
AP-906/42286988	LSM-32941	SID4255983, BRD-K43468669	2949719	InChI=1S/C19H17N3O3/c1-13-4-3-5-16(10-13)24-12-18-22-17(11-20)19(25-18)21-14-6-8-15(23-2)9-7-14/h3-10,21H,12H2,1-2H3	VAUQZYVHGDOEDQ-UHFFFAOYSA-N	COc1ccc(Nc2oc(COc3cccc(C)c3)nc2C#N)cc1	BroadT	BRD-K43468669	BRD-K43468669-001-05-4	ChemBridge Corporation	7723277			COc1ccc(Nc2oc(COc3cccc(C)c3)nc2C#N)cc1	InChI=1S/C19H17N3O3/c1-13-4-3-5-16(10-13)24-12-18-22-17(11-20)19(25-18)21-14-6-8-15(23-2)9-7-14/h3-10,21H,12H2,1-2H3	VAUQZYVHGDOEDQ-UHFFFAOYSA-N	335.126991434							121498
M-Aminocinnamic acid	LSM-44442	SID26660916, BRD-K01682574	700673	InChI=1S/C9H9NO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6H,10H2,(H,11,12)/b5-4+	JNXMJSYJCFTLJB-SNAWJCMRSA-N	Nc1cccc(\C=C\C(=O)O)c1	BroadT	BRD-K01682574	BRD-K01682574-001-06-2	InterBioScreen Ltd.	STOCK1S-03610			Nc1cccc(\C=C\C(O)=O)c1	InChI=1S/C9H9NO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6H,10H2,(H,11,12)/b5-4+	JNXMJSYJCFTLJB-SNAWJCMRSA-N	163.063328538							
KUC103424N	LSM-1876	BRD-A86990971, SID99495656	44143700	InChI=1S/C22H21N3O2S/c1-16-6-5-9-18(14-16)22-15-21(17-7-3-2-4-8-17)24-25(22)19-10-12-20(13-11-19)28(23,26)27/h2-14,22H,15H2,1H3,(H2,23,26,27)	SEFPMDWDYXOHAS-UHFFFAOYSA-N	Cc1cccc(c1)C2CC(=NN2c3ccc(cc3)S(=O)(=O)N)c4ccccc4	BroadT	BRD-A86990971	BRD-A86990971-001-01-9	University of Kansas	KUC103424N			Cc1cccc(c1)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccccc1	InChI=1S/C22H21N3O2S/c1-16-6-5-9-18(14-16)22-15-21(17-7-3-2-4-8-17)24-25(22)19-10-12-20(13-11-19)28(23,26)27/h2-14,22H,15H2,1H3,(H2,23,26,27)	SEFPMDWDYXOHAS-UHFFFAOYSA-N	391.135447632							91936
MLS000769752	LSM-44443	SID26725934, BRD-K71030558	1971610	InChI=1S/C17H16N4O3S2/c1-11(22)18-16(25)19-12-4-6-13(7-5-12)20-17(26)21-15(23)9-8-14-3-2-10-24-14/h2-10H,1H3,(H2,18,19,22,25)(H2,20,21,23,26)/b9-8+	NFJGUDCXRIDVNB-CMDGGOBGSA-N	CC(=O)NC(=S)Nc1ccc(NC(=S)NC(=O)\C=C\c2occc2)cc1	BroadT	BRD-K71030558	BRD-K71030558-001-06-9	InterBioScreen Ltd.	STOCK4S-09953			CC(=O)NC(=S)Nc1ccc(NC(=S)NC(=O)\C=C\c2ccco2)cc1	InChI=1S/C17H16N4O3S2/c1-11(22)18-16(25)19-12-4-6-13(7-5-12)20-17(26)21-15(23)9-8-14-3-2-10-24-14/h2-10H,1H3,(H2,18,19,22,25)(H2,20,21,23,26)/b9-8+	NFJGUDCXRIDVNB-CMDGGOBGSA-N	388.066381792							
T5738929	LSM-32944	SID22409604, BRD-K31684015	2699073	InChI=1S/C25H26N2O5/c1-27(14-16-9-10-17(29-2)11-22(16)30-3)15-25(28)26-20-13-23-19(12-24(20)31-4)18-7-5-6-8-21(18)32-23/h5-13H,14-15H2,1-4H3,(H,26,28)	WGBKODZDXBJSKD-UHFFFAOYSA-N	COc1ccc(CN(C)CC(=O)Nc2cc3oc4ccccc4c3cc2OC)c(OC)c1	BroadT	BRD-K31684015	BRD-K31684015-001-05-1	Enamine Ltd.	ZU-0134409			COc1ccc(CN(C)CC(=O)Nc2cc3oc4ccccc4c3cc2OC)c(OC)c1	InChI=1S/C25H26N2O5/c1-27(14-16-9-10-17(29-2)11-22(16)30-3)15-25(28)26-20-13-23-19(12-24(20)31-4)18-7-5-6-8-21(18)32-23/h5-13H,14-15H2,1-4H3,(H,26,28)	WGBKODZDXBJSKD-UHFFFAOYSA-N	434.184171952							121501
SMR000027746	LSM-32945	SID4242948, BRD-K56413268	3237739	InChI=1S/C21H19FN2O4S/c1-13-17(24-21(28-13)15-4-2-3-5-16(15)22)10-29-11-20(25)23-9-14-6-7-18-19(8-14)27-12-26-18/h2-8H,9-12H2,1H3,(H,23,25)	CUFPFUHOCYNHNB-UHFFFAOYSA-N	Cc1oc(nc1CSCC(=O)NCc2ccc3OCOc3c2)c4ccccc4F	BroadT	BRD-K56413268	BRD-K56413268-001-05-9	ChemDiv Inc.	C523-2041			Cc1oc(nc1CSCC(=O)NCc1ccc2OCOc2c1)-c1ccccc1F	InChI=1S/C21H19FN2O4S/c1-13-17(24-21(28-13)15-4-2-3-5-16(15)22)10-29-11-20(25)23-9-14-6-7-18-19(8-14)27-12-26-18/h2-8H,9-12H2,1H3,(H,23,25)	CUFPFUHOCYNHNB-UHFFFAOYSA-N	414.104955998							121502
AC1MDLUG	LSM-32946	SID7975078, BRD-A49582708	2839016	InChI=1S/C20H22N2O5/c1-10-7-13(23)17-15(8-10)27-20(22)12(9-21)16(17)11-5-6-14(24-2)19(26-4)18(11)25-3/h5-6,10,16H,7-8,22H2,1-4H3	OUUZFLSIDLGBDH-UHFFFAOYSA-N	COc1ccc(C2C(=C(N)OC3=C2C(=O)CC(C)C3)C#N)c(OC)c1OC	BroadT	BRD-A49582708	BRD-A49582708-001-06-9	ChemBridge Corporation	5276394			COc1ccc(C2C(C#N)=C(N)OC3=C2C(=O)CC(C)C3)c(OC)c1OC	InChI=1S/C20H22N2O5/c1-10-7-13(23)17-15(8-10)27-20(22)12(9-21)16(17)11-5-6-14(24-2)19(26-4)18(11)25-3/h5-6,10,16H,7-8,22H2,1-4H3	OUUZFLSIDLGBDH-UHFFFAOYSA-N	370.152871824							121503
MLS000556822	LSM-32947	SID17408330, BRD-K35541136	3221581	InChI=1S/C19H23N5O3S/c1-25-7-3-6-23-19(28)22-5-2-4-21-18-14(11-20)8-13-9-16-17(27-12-26-16)10-15(13)24-18/h8-10H,2-7,12H2,1H3,(H,21,24)(H2,22,23,28)	ODSGMEMXLCTXCA-UHFFFAOYSA-N	COCCCN=C(S)NCCCNc1nc2cc3OCOc3cc2cc1C#N	BroadT	BRD-K35541136	BRD-K35541136-001-05-3	Asinex Ltd.	ASN 06536997			COCCCN=C(S)NCCCNc1nc2cc3OCOc3cc2cc1C#N	InChI=1S/C19H23N5O3S/c1-25-7-3-6-23-19(28)22-5-2-4-21-18-14(11-20)8-13-9-16-17(27-12-26-16)10-15(13)24-18/h8-10H,2-7,12H2,1H3,(H,21,24)(H2,22,23,28)	ODSGMEMXLCTXCA-UHFFFAOYSA-N	401.152160336							121504
MLS000518882	LSM-32948	SID14735502, BRD-K65937090	4457075	InChI=1S/C20H23NO4/c1-2-3-4-5-6-14-24-19(22)16-9-11-18(12-10-16)25-20(23)17-8-7-13-21-15-17/h7-13,15H,2-6,14H2,1H3	QCHYILFGPLNBNY-UHFFFAOYSA-N	CCCCCCCOC(=O)c1ccc(OC(=O)c2cccnc2)cc1	BroadT	BRD-K65937090	BRD-K65937090-001-06-8	ChemDiv Inc.	0703-6475			CCCCCCCOC(=O)c1ccc(OC(=O)c2cccnc2)cc1	InChI=1S/C20H23NO4/c1-2-3-4-5-6-14-24-19(22)16-9-11-18(12-10-16)25-20(23)17-8-7-13-21-15-17/h7-13,15H,2-6,14H2,1H3	QCHYILFGPLNBNY-UHFFFAOYSA-N	341.162708226							121505
SMR000096388	LSM-32949	SID7967012, BRD-A16963916	5308568	InChI=1S/C26H34N4O3/c1-18-6-8-23-21(15-18)28-26(32)24(33-23)17-25(31)27-9-4-10-29-11-13-30(14-12-29)22-16-19(2)5-7-20(22)3/h5-8,15-16,24H,4,9-14,17H2,1-3H3,(H,27,31)(H,28,32)	NIQATHJCBKDUBY-UHFFFAOYSA-N	Cc1ccc2OC(CC(=O)NCCCN3CCN(CC3)c4cc(C)ccc4C)C(=O)Nc2c1	BroadT	BRD-A16963916	BRD-A16963916-001-04-3	ChemDiv Inc.	C759-0512			Cc1ccc2OC(CC(=O)NCCCN3CCN(CC3)c3cc(C)ccc3C)C(=O)Nc2c1	InChI=1S/C26H34N4O3/c1-18-6-8-23-21(15-18)28-26(32)24(33-23)17-25(31)27-9-4-10-29-11-13-30(14-12-29)22-16-19(2)5-7-20(22)3/h5-8,15-16,24H,4,9-14,17H2,1-3H3,(H,27,31)(H,28,32)	NIQATHJCBKDUBY-UHFFFAOYSA-N	450.263090988							121506
MLS000688865	LSM-32950	SID24783881, BRD-K61503276	697577	InChI=1S/C12H15N3OS2/c1-8(2)6-11-14-15-12(18-11)13-10(16)7-9-4-3-5-17-9/h3-5,8H,6-7H2,1-2H3,(H,13,15,16)	SIILNOLGPIOEMP-UHFFFAOYSA-N	CC(C)Cc1nnc(NC(=O)Cc2cccs2)s1	BroadT	BRD-K61503276	BRD-K61503276-001-06-8	Asinex Ltd.	BAS 05023895			CC(C)Cc1nnc(NC(=O)Cc2cccs2)s1	InChI=1S/C12H15N3OS2/c1-8(2)6-11-14-15-12(18-11)13-10(16)7-9-4-3-5-17-9/h3-5,8H,6-7H2,1-2H3,(H,13,15,16)	SIILNOLGPIOEMP-UHFFFAOYSA-N	281.06565351							121507
SMR000311764	LSM-32951	SID24811696, BRD-A86383684	16193407	InChI=1S/C27H35N3O3S/c1-19-15-20(2)17-23(16-19)28-27(34)30(10-6-9-29-11-13-32-14-12-29)21(3)25-18-22-7-5-8-24(31-4)26(22)33-25/h5,7-8,15-18,21H,6,9-14H2,1-4H3,(H,28,34)	OQZDZEQCHGFKHZ-UHFFFAOYSA-N	COc1cccc2cc(oc12)C(C)N(CCCN3CCOCC3)C(=Nc4cc(C)cc(C)c4)S	BroadT	BRD-A86383684	BRD-A86383684-001-05-6	ChemDiv Inc.	K788-4609			COc1cccc2cc(oc12)C(C)N(CCCN1CCOCC1)C(S)=Nc1cc(C)cc(C)c1	InChI=1S/C27H35N3O3S/c1-19-15-20(2)17-23(16-19)28-27(34)30(10-6-9-29-11-13-32-14-12-29)21(3)25-18-22-7-5-8-24(31-4)26(22)33-25/h5,7-8,15-18,21H,6,9-14H2,1-4H3,(H,28,34)	OQZDZEQCHGFKHZ-UHFFFAOYSA-N	481.2399127							121508
T5263762	LSM-32952	SID17517264, BRD-K68225257	2086311	InChI=1S/C18H22N4O4/c23-15-5-3-14(4-6-15)22-9-7-21(8-10-22)13-17(24)20-18(25)19-12-16-2-1-11-26-16/h1-6,11,23H,7-10,12-13H2,(H2,19,20,24,25)	OHCDFZMCCJMYTE-UHFFFAOYSA-N	Oc1ccc(cc1)N2CCN(CC(=O)NC(=O)NCc3occc3)CC2	BroadT	BRD-K68225257	BRD-K68225257-001-05-6	Enamine Ltd.	T5263762			Oc1ccc(cc1)N1CCN(CC(=O)NC(=O)NCc2ccco2)CC1	InChI=1S/C18H22N4O4/c23-15-5-3-14(4-6-15)22-9-7-21(8-10-22)13-17(24)20-18(25)19-12-16-2-1-11-26-16/h1-6,11,23H,7-10,12-13H2,(H2,19,20,24,25)	OHCDFZMCCJMYTE-UHFFFAOYSA-N	358.164105224							121509
AH-262/34229018	LSM-44444	SID7973993, BRD-K02328763	788149	InChI=1S/C15H13N3O2/c1-2-20-15(19)13(10-16)14-8-9-18(11-17-14)12-6-4-3-5-7-12/h3-9,11H,2H2,1H3/b14-13-	XUZZXSRZRBGXHG-YPKPFQOOSA-N	CCOC(=O)\C(=C/1\C=CN(C=N1)c2ccccc2)\C#N	BroadT	BRD-K02328763	BRD-K02328763-001-05-4	ChemBridge Corporation	5219705			CCOC(=O)C(\C#N)=C1\C=CN(C=N\1)c1ccccc1	InChI=1S/C15H13N3O2/c1-2-20-15(19)13(10-16)14-8-9-18(11-17-14)12-6-4-3-5-7-12/h3-9,11H,2H2,1H3/b14-13-	XUZZXSRZRBGXHG-YPKPFQOOSA-N	267.100776686							
T5332885	LSM-32954	SID22411163, BRD-K56881946	4969400	InChI=1S/C23H26Cl2N4O5S/c1-4-29(5-2)35(32,33)18-6-7-20-19(13-18)27-21(28(20)3)8-9-23(31)34-14-22(30)26-17-11-15(24)10-16(25)12-17/h6-7,10-13H,4-5,8-9,14H2,1-3H3,(H,26,30)	CZXHKBLFHGFFQK-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)OCC(=O)Nc3cc(Cl)cc(Cl)c3)n2C	BroadT	BRD-K56881946	BRD-K56881946-001-05-7	Enamine Ltd.	T5332885			CCN(CC)S(=O)(=O)c1ccc2n(C)c(CCC(=O)OCC(=O)Nc3cc(Cl)cc(Cl)c3)nc2c1	InChI=1S/C23H26Cl2N4O5S/c1-4-29(5-2)35(32,33)18-6-7-20-19(13-18)27-21(28(20)3)8-9-23(31)34-14-22(30)26-17-11-15(24)10-16(25)12-17/h6-7,10-13H,4-5,8-9,14H2,1-3H3,(H,26,30)	CZXHKBLFHGFFQK-UHFFFAOYSA-N	540.100096082							121511
MLS000106819	LSM-32955	SID7973076, BRD-K17975404	809705	InChI=1S/C16H15NO4/c1-20-16(19)13-9-5-6-10-14(13)17-15(18)11-21-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,17,18)	DJNDEMVSWNRGSC-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)COc2ccccc2	BroadT	BRD-K17975404	BRD-K17975404-001-05-0	ChemBridge Corporation	5575753			COC(=O)c1ccccc1NC(=O)COc1ccccc1	InChI=1S/C16H15NO4/c1-20-16(19)13-9-5-6-10-14(13)17-15(18)11-21-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,17,18)	DJNDEMVSWNRGSC-UHFFFAOYSA-N	285.10010797							121512
T0506-0228	LSM-32956	SID24832618, BRD-K94410782	2338070	InChI=1S/C16H14N2O6/c1-23-14-8-7-11(9-13(14)18(21)22)16(20)24-10-15(19)17-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,19)	ACKHFLCJMXQPFM-UHFFFAOYSA-N	COc1ccc(cc1[N+](=O)[O-])C(=O)OCC(=O)Nc2ccccc2	BroadT	BRD-K94410782	BRD-K94410782-001-05-6	Enamine Ltd.	T0506-0228			COc1ccc(cc1[N+]([O-])=O)C(=O)OCC(=O)Nc1ccccc1	InChI=1S/C16H14N2O6/c1-23-14-8-7-11(9-13(14)18(21)22)16(20)24-10-15(19)17-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,19)	ACKHFLCJMXQPFM-UHFFFAOYSA-N	330.085186188							121513
4-Ethoxy-n-quinolin-3-ylbenzenesulfonamide	LSM-32957	SID26513925, SID49728343, BRD-K06536988	2933345	InChI=1S/C17H16N2O3S/c1-2-22-15-7-9-16(10-8-15)23(20,21)19-14-11-13-5-3-4-6-17(13)18-12-14/h3-12,19H,2H2,1H3	XQTBSEYJZANZKI-UHFFFAOYSA-N	CCOc1ccc(cc1)S(=O)(=O)Nc2cnc3ccccc3c2	BroadT	BRD-K06536988	BRD-K06536988-001-05-7	Asinex Ltd.	BAS 04999116			CCOc1ccc(cc1)S(=O)(=O)Nc1cnc2ccccc2c1	InChI=1S/C17H16N2O3S/c1-2-22-15-7-9-16(10-8-15)23(20,21)19-14-11-13-5-3-4-6-17(13)18-12-14/h3-12,19H,2H2,1H3	XQTBSEYJZANZKI-UHFFFAOYSA-N	328.088163082							121514
SMR000000955	LSM-32958	SID846531, BRD-A28006745	648923	InChI=1S/C25H31N5O3/c1-16-12-17(2)27-24(22(16)15-26)30-10-8-20(9-11-30)29-25(32)23(28-18(3)31)14-19-6-5-7-21(13-19)33-4/h5-7,12-13,20,23H,8-11,14H2,1-4H3,(H,28,31)(H,29,32)	NWUFGLDPGOLEFF-UHFFFAOYSA-N	COc1cccc(CC(NC(=O)C)C(=O)NC2CCN(CC2)c3nc(C)cc(C)c3C#N)c1	BroadT	BRD-A28006745	BRD-A28006745-001-05-1	Asinex Ltd.	ASN 10814090			COc1cccc(CC(NC(C)=O)C(=O)NC2CCN(CC2)c2nc(C)cc(C)c2C#N)c1	InChI=1S/C25H31N5O3/c1-16-12-17(2)27-24(22(16)15-26)30-10-8-20(9-11-30)29-25(32)23(28-18(3)31)14-19-6-5-7-21(13-19)33-4/h5-7,12-13,20,23H,8-11,14H2,1-4H3,(H,28,31)(H,29,32)	NWUFGLDPGOLEFF-UHFFFAOYSA-N	449.242689902							121515
AC1MZLPK	LSM-32959	BRD-K07344917	3874602	InChI=1S/C11H16N2O3/c1-8(9-6-5-7-15-9)12-13-10(14)16-11(2,3)4/h5-7H,1-4H3,(H,13,14)	HWHKIBIMLPQWAL-UHFFFAOYSA-N	CC(=NNC(=O)OC(C)(C)C)c1occc1	BroadT	BRD-K07344917	BRD-K07344917-001-05-1	ChemDiv Inc.	4328-0084			CC(=NNC(=O)OC(C)(C)C)c1ccco1	InChI=1S/C11H16N2O3/c1-8(9-6-5-7-15-9)12-13-10(14)16-11(2,3)4/h5-7H,1-4H3,(H,13,14)	HWHKIBIMLPQWAL-UHFFFAOYSA-N	224.116092392							121516
SMR000064766	LSM-32960	SID3714699, BRD-K27378076	2998918	InChI=1S/C19H25N5O5/c1-5-7-9-24-16-15(17(25)21-19(24)27)23(8-6-2)13(20-16)10-28-18(26)14-11(3)22-29-12(14)4/h5-10H2,1-4H3,(H,21,25,27)	ITPCKJLTMSZYFI-UHFFFAOYSA-N	CCCCN1C(=O)NC(=O)c2c1nc(COC(=O)c3c(C)onc3C)n2CCC	BroadT	BRD-K27378076	BRD-K27378076-001-05-2	Enamine Ltd.	T5346120			CCCCn1c2nc(COC(=O)c3c(C)noc3C)n(CCC)c2c(=O)[nH]c1=O	InChI=1S/C19H25N5O5/c1-5-7-9-24-16-15(17(25)21-19(24)27)23(8-6-2)13(20-16)10-28-18(26)14-11(3)22-29-12(14)4/h5-10H2,1-4H3,(H,21,25,27)	ITPCKJLTMSZYFI-UHFFFAOYSA-N	403.18556895							121517
ZINC00613989	LSM-32961	SID24792320, BRD-K26330968	973395	InChI=1S/C14H8N2O5/c17-10-5-6-12-11(7-10)14(18)21-13(15-12)8-1-3-9(4-2-8)16(19)20/h1-7,17H	WQJHISQILHXRNW-UHFFFAOYSA-N	Oc1ccc2N=C(OC(=O)c2c1)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-K26330968	BRD-K26330968-001-06-3	ChemBridge Corporation	7891933			Oc1ccc2nc(oc(=O)c2c1)-c1ccc(cc1)[N+]([O-])=O	InChI=1S/C14H8N2O5/c17-10-5-6-12-11(7-10)14(18)21-13(15-12)8-1-3-9(4-2-8)16(19)20/h1-7,17H	WQJHISQILHXRNW-UHFFFAOYSA-N	284.043321376							121518
1-Methyl-5-(naphthalen-1-yloxy)-4-nitro-1H-imidazole	LSM-32962	SID17511686, BRD-K30749538	948493	InChI=1S/C14H11N3O3/c1-16-9-15-13(17(18)19)14(16)20-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3	DWMKFHNGYSTTPN-UHFFFAOYSA-N	Cn1cnc(c1Oc2cccc3ccccc23)[N+](=O)[O-]	BroadT	BRD-K30749538	BRD-K30749538-001-06-9	InterBioScreen Ltd.	STOCK2S-83326			Cn1cnc(c1Oc1cccc2ccccc12)[N+]([O-])=O	InChI=1S/C14H11N3O3/c1-16-9-15-13(17(18)19)14(16)20-12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3	DWMKFHNGYSTTPN-UHFFFAOYSA-N	269.080041242							121519
MLS-0084755.0001	LSM-32963	SID14719107, SID56373744, BRD-A35335404	5838621	InChI=1S/C11H11FN4S/c1-7-6-10-14-11(17-16(10)15-7)13-9-4-2-8(12)3-5-9/h2-6,11,13-14H,1H3	FKJFCPIPXDQLID-UHFFFAOYSA-N	Cc1cc2NC(Nc3ccc(F)cc3)Sn2n1	BroadT	BRD-A35335404	BRD-A35335404-001-05-7	Specs	AQ-090/41768883			Cc1cc2NC(Nc3ccc(F)cc3)Sn2n1	InChI=1S/C11H11FN4S/c1-7-6-10-14-11(17-16(10)15-7)13-9-4-2-8(12)3-5-9/h2-6,11,13-14H,1H3	FKJFCPIPXDQLID-UHFFFAOYSA-N	250.068845282							
SMR000029643	LSM-32964	BRD-K19779727	3243049	InChI=1S/C26H35N3O5/c1-33-20-10-7-17(15-21(20)34-2)11-12-27-26(32)19-8-5-18(6-9-19)16-28-22-23(25(31)24(22)30)29-13-3-4-14-29/h7,10,15,18-19,31H,3-6,8-9,11-14,16H2,1-2H3,(H,27,32)	OVUVLJZRCWQGGB-UHFFFAOYSA-N	COc1ccc(CCNC(=O)C2CCC(CN=C3C(=O)C(=C3N4CCCC4)O)CC2)cc1OC	BroadT	BRD-K19779727	BRD-K19779727-001-05-4	ChemDiv Inc.	C906-0278			COc1ccc(CCNC(=O)C2CCC(CN=c3c(N4CCCC4)c(O)c3=O)CC2)cc1OC	InChI=1S/C26H35N3O5/c1-33-20-10-7-17(15-21(20)34-2)11-12-27-26(32)19-8-5-18(6-9-19)16-28-22-23(25(31)24(22)30)29-13-3-4-14-29/h7,10,15,18-19,31H,3-6,8-9,11-14,16H2,1-2H3,(H,27,32)	OVUVLJZRCWQGGB-UHFFFAOYSA-N	469.25767125							
ZINC00185143	LSM-44445	SID4256280, BRD-K67304645	744370	InChI=1S/C15H14O4S/c1-3-18-14(16)8-10(2)20-13-9-15(17)19-12-7-5-4-6-11(12)13/h4-9H,3H2,1-2H3/b10-8+	DSVYARVFQKRRBA-CSKARUKUSA-N	CCOC(=O)\C=C(/C)\SC1=CC(=O)Oc2ccccc12	BroadT	BRD-K67304645	BRD-K67304645-001-08-5	ChemBridge Corporation	5102953			CCOC(=O)\C=C(/C)Sc1cc(=O)oc2ccccc12	InChI=1S/C15H14O4S/c1-3-18-14(16)8-10(2)20-13-9-15(17)19-12-7-5-4-6-11(12)13/h4-9H,3H2,1-2H3/b10-8+	DSVYARVFQKRRBA-CSKARUKUSA-N	290.061279618							
MLS000871744	LSM-32966	SID24384477, SID24782990, BRD-K05350442	16008294	InChI=1S/C26H28N4O3/c1-17-23(10-11-26(31)27-16-19-8-6-5-7-9-19)18(2)30-25(28-17)15-24(29-30)20-12-21(32-3)14-22(13-20)33-4/h5-9,12-15H,10-11,16H2,1-4H3,(H,27,31)	DXKVFFVWZIHJDN-UHFFFAOYSA-N	COc1cc(OC)cc(c1)c2cc3nc(C)c(CCC(=O)NCc4ccccc4)c(C)n3n2	BroadT	BRD-K05350442	BRD-K05350442-001-06-2	ChemDiv Inc.	C561-0549			COc1cc(OC)cc(c1)-c1cc2nc(C)c(CCC(=O)NCc3ccccc3)c(C)n2n1	InChI=1S/C26H28N4O3/c1-17-23(10-11-26(31)27-16-19-8-6-5-7-9-19)18(2)30-25(28-17)15-24(29-30)20-12-21(32-3)14-22(13-20)33-4/h5-9,12-15H,10-11,16H2,1-4H3,(H,27,31)	DXKVFFVWZIHJDN-UHFFFAOYSA-N	444.216140796							121523
MLS000107769	LSM-44446	SID7972794, BRD-K66230433	5310634	InChI=1S/C19H15N5O2/c1-13-6-8-14(9-7-13)24-18(25)16-5-3-2-4-15(16)17(19(24)26)10-22-23-11-20-21-12-23/h2-12,22H,1H3/b17-10-	GBMMWRTXIFFINJ-YVLHZVERSA-N	Cc1ccc(cc1)N2C(=O)\C(=C/Nn3cnnc3)\c4ccccc4C2=O	BroadT	BRD-K66230433	BRD-K66230433-001-05-5	ChemBridge Corporation	5666446			Cc1ccc(cc1)N1C(=O)\C(=C/Nn2cnnc2)c2ccccc2C1=O	InChI=1S/C19H15N5O2/c1-13-6-8-14(9-7-13)24-18(25)16-5-3-2-4-15(16)17(19(24)26)10-22-23-11-20-21-12-23/h2-12,22H,1H3/b17-10-	GBMMWRTXIFFINJ-YVLHZVERSA-N	345.12257477							
AC1O9YNB	LSM-32968	SID7975633, BRD-K10651385	6741056	InChI=1S/C12H15NOS/c14-11-7-3-2-6-10(11)12(15)13-8-4-1-5-9-13/h2-3,6-7,14H,1,4-5,8-9H2	FDEJXMBAYGPUFC-UHFFFAOYSA-N	Oc1ccccc1C(=S)N2CCCCC2	BroadT	BRD-K10651385	BRD-K10651385-001-05-7	ChemBridge Corporation	5713598			Oc1ccccc1C(=S)N1CCCCC1	InChI=1S/C12H15NOS/c14-11-7-3-2-6-10(11)12(15)13-8-4-1-5-9-13/h2-3,6-7,14H,1,4-5,8-9H2	FDEJXMBAYGPUFC-UHFFFAOYSA-N	221.0874348							
SMR000199432	LSM-32969	SID85176608, SID17414727, BRD-K00877464	1288978	InChI=1S/C27H29N3O4S/c31-27(28-25-9-11-26(12-10-25)35(32,33)30-15-17-34-18-16-30)23-7-5-21(6-8-23)19-29-14-13-22-3-1-2-4-24(22)20-29/h1-12H,13-20H2,(H,28,31)	WGQPJPGVHXXIAT-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)S(=O)(=O)N2CCOCC2)c3ccc(CN4CCc5ccccc5C4)cc3	BroadT	BRD-K00877464	BRD-K00877464-001-03-9	ChemBridge Corporation	7736840			O=C(Nc1ccc(cc1)S(=O)(=O)N1CCOCC1)c1ccc(CN2CCc3ccccc3C2)cc1	InChI=1S/C27H29N3O4S/c31-27(28-25-9-11-26(12-10-25)35(32,33)30-15-17-34-18-16-30)23-7-5-21(6-8-23)19-29-14-13-22-3-1-2-4-24(22)20-29/h1-12H,13-20H2,(H,28,31)	WGQPJPGVHXXIAT-UHFFFAOYSA-N	491.187877128							121526
CHEMDIV2_001418	LSM-1970	BRD-A99518825, SID87556801	4207918	InChI=1S/C20H30N2O4/c1-24-17-9-8-15(18(25-2)19(17)26-3)13-21-10-6-7-16(14-21)20(23)22-11-4-5-12-22/h8-9,16H,4-7,10-14H2,1-3H3	QTBFTOLJMPSXCU-UHFFFAOYSA-N	COc1ccc(CN2CCCC(C2)C(=O)N3CCCC3)c(OC)c1OC	BroadT	BRD-A99518825	BRD-A99518825-001-02-9	Broad Institute of MIT and Harvard	BRD-A99518825			COc1ccc(CN2CCCC(C2)C(=O)N2CCCC2)c(OC)c1OC	InChI=1S/C20H30N2O4/c1-24-17-9-8-15(18(25-2)19(17)26-3)13-21-10-6-7-16(14-21)20(23)22-11-4-5-12-22/h8-9,16H,4-7,10-14H2,1-3H3	QTBFTOLJMPSXCU-UHFFFAOYSA-N	362.22055746							92000
MLS000546032	LSM-32970	SID17406610, BRD-K64484241	1046836	InChI=1S/C22H14ClN5/c23-16-11-12-20-18(13-16)21(15-7-3-1-4-8-15)19(14-24-20)22-25-26-27-28(22)17-9-5-2-6-10-17/h1-14H	QCPYMEACPSNFNB-UHFFFAOYSA-N	Clc1ccc2ncc(c(c3ccccc3)c2c1)c4nnnn4c5ccccc5	BroadT	BRD-K64484241	BRD-K64484241-001-05-2	Specs	AG-401/42008207			Clc1ccc2ncc(-c3nnnn3-c3ccccc3)c(-c3ccccc3)c2c1	InChI=1S/C22H14ClN5/c23-16-11-12-20-18(13-16)21(15-7-3-1-4-8-15)19(14-24-20)22-25-26-27-28(22)17-9-5-2-6-10-17/h1-14H	QCPYMEACPSNFNB-UHFFFAOYSA-N	383.093773208							121527
2-Amino-n-(4-ethylphenyl)-4-oxo-5,6-dihydro-4H-1,3-thiazine-6-carboxamide	LSM-32971	SID4257340, BRD-A65798321	2887095	InChI=1S/C13H15N3O2S/c1-2-8-3-5-9(6-4-8)15-12(18)10-7-11(17)16-13(14)19-10/h3-6,10H,2,7H2,1H3,(H,15,18)(H2,14,16,17)	DLULPFLQXSPPHR-UHFFFAOYSA-N	CCc1ccc(NC(=O)C2CC(=O)N=C(N)S2)cc1	BroadT	BRD-A65798321	BRD-A65798321-001-05-9	ChemBridge Corporation	6128343			CCc1ccc(NC(=O)C2CC(=O)N=C(N)S2)cc1	InChI=1S/C13H15N3O2S/c1-2-8-3-5-9(6-4-8)15-12(18)10-7-11(17)16-13(14)19-10/h3-6,10H,2,7H2,1H3,(H,15,18)(H2,14,16,17)	DLULPFLQXSPPHR-UHFFFAOYSA-N	277.08849744							121528
SMR000186984	LSM-44447	BRD-K47034629	2263096	InChI=1S/C26H24N2O3S/c1-30-22-14-13-21(15-23(22)31-2)16-24-25(29)28(18-20-11-7-4-8-12-20)26(32-24)27-17-19-9-5-3-6-10-19/h3-16H,17-18H2,1-2H3/b24-16-,27-26?	LVNLWCCVSQOFEF-GCNWNYGFSA-N	COc1ccc(\C=C\2/SC(=NCc3ccccc3)N(Cc4ccccc4)C2=O)cc1OC	BroadT	BRD-K47034629	BRD-K47034629-001-05-9	ChemBridge Corporation	5742714			COc1ccc(\C=C2/SC(=NCc3ccccc3)N(Cc3ccccc3)C2=O)cc1OC	InChI=1S/C26H24N2O3S/c1-30-22-14-13-21(15-23(22)31-2)16-24-25(29)28(18-20-11-7-4-8-12-20)26(32-24)27-17-19-9-5-3-6-10-19/h3-16H,17-18H2,1-2H3/b24-16-,27-26?	LVNLWCCVSQOFEF-GCNWNYGFSA-N	444.150763338							
AC1N2UQ0	LSM-32973	BRD-K76368702	4054573	InChI=1S/C18H18N4O6S/c23-18(24)14-5-3-13(4-6-14)12-19-20-16-8-7-15(11-17(16)22(25)26)29(27,28)21-9-1-2-10-21/h3-8,11-12,20H,1-2,9-10H2,(H,23,24)	VTZLJDIDMPWOHR-UHFFFAOYSA-N	OC(=O)c1ccc(C=NNc2ccc(cc2[N+](=O)[O-])S(=O)(=O)N3CCCC3)cc1	BroadT	BRD-K76368702	BRD-K76368702-001-05-5	Enamine Ltd.	T0505-1468			OC(=O)c1ccc(C=NNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)N2CCCC2)cc1	InChI=1S/C18H18N4O6S/c23-18(24)14-5-3-13(4-6-14)12-19-20-16-8-7-15(11-17(16)22(25)26)29(27,28)21-9-1-2-10-21/h3-8,11-12,20H,1-2,9-10H2,(H,23,24)	VTZLJDIDMPWOHR-UHFFFAOYSA-N	418.094705026							121530
SMR000082155	LSM-32974	SID4257171, BRD-K91119422	2235831	InChI=1S/C18H15ClF4N2O3/c1-27-17-14(22)12(20)11(13(21)15(17)23)18(26)24-10-4-2-3-9(19)16(10)25-5-7-28-8-6-25/h2-4H,5-8H2,1H3,(H,24,26)	XEKSPVOVAOAEAT-UHFFFAOYSA-N	COc1c(F)c(F)c(C(=O)Nc2cccc(Cl)c2N3CCOCC3)c(F)c1F	BroadT	BRD-K91119422	BRD-K91119422-001-05-2	ChemBridge Corporation	7976354			COc1c(F)c(F)c(C(=O)Nc2cccc(Cl)c2N2CCOCC2)c(F)c1F	InChI=1S/C18H15ClF4N2O3/c1-27-17-14(22)12(20)11(13(21)15(17)23)18(26)24-10-4-2-3-9(19)16(10)25-5-7-28-8-6-25/h2-4H,5-8H2,1H3,(H,24,26)	XEKSPVOVAOAEAT-UHFFFAOYSA-N	418.07073287							121531
SMR000620201	LSM-32975	SID49736760, BRD-A96180743	16435563	InChI=1S/C26H27N5O3/c1-17-9-10-22-29-24-21(26(33)30(22)15-17)14-20(23(27)31(24)16-19-8-5-13-34-19)25(32)28-12-11-18-6-3-2-4-7-18/h2-4,6-7,9-10,14-15,19,27H,5,8,11-13,16H2,1H3,(H,28,32)	IBKRZUNMEOCUIM-UHFFFAOYSA-N	CC1=CN2C(=NC3=C(C=C(C(=O)NCCc4ccccc4)C(=N)N3CC5CCCO5)C2=O)C=C1	BroadT	BRD-A96180743	BRD-A96180743-001-05-3	ChemDiv Inc.	5282-0243			Cc1ccc2nc3n(CC4CCCO4)c(=N)c(cc3c(=O)n2c1)C(=O)NCCc1ccccc1	InChI=1S/C26H27N5O3/c1-17-9-10-22-29-24-21(26(33)30(22)15-17)14-20(23(27)31(24)16-19-8-5-13-34-19)25(32)28-12-11-18-6-3-2-4-7-18/h2-4,6-7,9-10,14-15,19,27H,5,8,11-13,16H2,1H3,(H,28,32)	IBKRZUNMEOCUIM-UHFFFAOYSA-N	457.211389774							121532
MLS000042259	LSM-32976	SID864932, BRD-A50028871	5389997	InChI=1S/C28H26N4O3/c33-25-28(26(34)32(27(35)29-25)18-20-9-3-1-4-10-20)17-21-11-7-8-14-23(21)31-16-15-30(19-24(28)31)22-12-5-2-6-13-22/h1-14,24H,15-19H2,(H,29,33,35)/t24?,28-/m1/s1	BEXWSKNRHHXTRK-ITCMONMYSA-N	O=C1NC(=O)[C@]2(Cc3ccccc3N4CCN(CC24)c5ccccc5)C(=O)N1Cc6ccccc6	BroadT	BRD-A50028871	BRD-A50028871-001-07-8	InterBioScreen Ltd.	STOCK5S-32565			O=C1NC(=O)[C@]2(Cc3ccccc3N3CCN(CC23)c2ccccc2)C(=O)N1Cc1ccccc1	InChI=1S/C28H26N4O3/c33-25-28(26(34)32(27(35)29-25)18-20-9-3-1-4-10-20)17-21-11-7-8-14-23(21)31-16-15-30(19-24(28)31)22-12-5-2-6-13-22/h1-14,24H,15-19H2,(H,29,33,35)/t24?,28-/m1/s1	BEXWSKNRHHXTRK-ITCMONMYSA-N	466.200490732							121533
MLS000066717	LSM-32977	SID4258037, BRD-K24125110	2979368	InChI=1S/C23H22ClN3O3/c24-18-5-3-17(4-6-18)16-22(28)25-19-7-9-20(10-8-19)26-11-13-27(14-12-26)23(29)21-2-1-15-30-21/h1-10,15H,11-14,16H2,(H,25,28)	NYEVYEFQFWJZHT-UHFFFAOYSA-N	Clc1ccc(CC(=O)Nc2ccc(cc2)N3CCN(CC3)C(=O)c4occc4)cc1	BroadT	BRD-K24125110	BRD-K24125110-001-05-8	ChemBridge Corporation	7975146			Clc1ccc(CC(=O)Nc2ccc(cc2)N2CCN(CC2)C(=O)c2ccco2)cc1	InChI=1S/C23H22ClN3O3/c24-18-5-3-17(4-6-18)16-22(28)25-19-7-9-20(10-8-19)26-11-13-27(14-12-26)23(29)21-2-1-15-30-21/h1-10,15H,11-14,16H2,(H,25,28)	NYEVYEFQFWJZHT-UHFFFAOYSA-N	423.134969304							121534
AC1LFWBI	LSM-32978	BRD-K73253836	761154	InChI=1S/C17H18N4O2/c22-21(23)17-9-5-4-6-15(17)14-18-20-12-10-19(11-13-20)16-7-2-1-3-8-16/h1-9,14H,10-13H2	RYVNKLPZPBQMJK-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1C=NN2CCN(CC2)c3ccccc3	BroadT	BRD-K73253836	BRD-K73253836-001-05-1	Asinex Ltd.	BAS 01177487			[O-][N+](=O)c1ccccc1C=NN1CCN(CC1)c1ccccc1	InChI=1S/C17H18N4O2/c22-21(23)17-9-5-4-6-15(17)14-18-20-12-10-19(11-13-20)16-7-2-1-3-8-16/h1-9,14H,10-13H2	RYVNKLPZPBQMJK-UHFFFAOYSA-N	310.142975856							121535
KUC103423N	LSM-1819	SID99495657, BRD-A80386041	13927310	InChI=1S/C22H21N3O2S/c1-16-7-9-18(10-8-16)22-15-21(17-5-3-2-4-6-17)24-25(22)19-11-13-20(14-12-19)28(23,26)27/h2-14,22H,15H2,1H3,(H2,23,26,27)	MBSCPVGGCCNQCY-UHFFFAOYSA-N	Cc1ccc(cc1)C2CC(=NN2c3ccc(cc3)S(=O)(=O)N)c4ccccc4	BroadT	BRD-A80386041	BRD-A80386041-001-01-2	University of Kansas	KUC103423N			Cc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccccc1	InChI=1S/C22H21N3O2S/c1-16-7-9-18(10-8-16)22-15-21(17-5-3-2-4-6-17)24-25(22)19-11-13-20(14-12-19)28(23,26)27/h2-14,22H,15H2,1H3,(H2,23,26,27)	MBSCPVGGCCNQCY-UHFFFAOYSA-N	391.135447632							91884
1-(4-Hydroxyphenyl)-3-[1,1,1-trifluoro-2-(trifluoromethyl)butan-2-yl]urea	LSM-32979	SID50103473, SID859022, BRD-K67142195	660323	InChI=1S/C12H12F6N2O2/c1-2-10(11(13,14)15,12(16,17)18)20-9(22)19-7-3-5-8(21)6-4-7/h3-6,21H,2H2,1H3,(H2,19,20,22)	SIMJYJFBVOCOOU-UHFFFAOYSA-N	CCC(NC(=O)Nc1ccc(O)cc1)(C(F)(F)F)C(F)(F)F	BroadT	BRD-K67142195	BRD-K67142195-001-04-2	InterBioScreen Ltd.	STOCK2S-79945			CCC(NC(=O)Nc1ccc(O)cc1)(C(F)(F)F)C(F)(F)F	InChI=1S/C12H12F6N2O2/c1-2-10(11(13,14)15,12(16,17)18)20-9(22)19-7-3-5-8(21)6-4-7/h3-6,21H,2H2,1H3,(H2,19,20,22)	SIMJYJFBVOCOOU-UHFFFAOYSA-N	330.080296844							121536
STK642265	LSM-32980	SID864574, BRD-A99985127	5389969	InChI=1S/C16H12N4OS/c1-2-5-12-10(4-1)14-11(8-21-12)15(13-6-3-7-22-13)20-16(19-14)17-9-18-20/h1-7,9,15H,8H2,(H,17,18,19)	TXVAHHFZOAPEOR-UHFFFAOYSA-N	C1Oc2ccccc2C3=C1C(c4cccs4)n5ncnc5N3	BroadT	BRD-A99985127	BRD-A99985127-001-05-8	InterBioScreen Ltd.	STOCK5S-24688			C1Oc2ccccc2C2=C1C(c1cccs1)n1ncnc1N2	InChI=1S/C16H12N4OS/c1-2-5-12-10(4-1)14-11(8-21-12)15(13-6-3-7-22-13)20-16(19-14)17-9-18-20/h1-7,9,15H,8H2,(H,17,18,19)	TXVAHHFZOAPEOR-UHFFFAOYSA-N	308.073181734							121537
AC1NYG01	LSM-32981	BRD-K56545046	5879270	InChI=1S/C15H17N5O3S/c1-9(11-12(21)19(2)15(23)20(3)13(11)22)17-18-14(24)16-10-7-5-4-6-8-10/h4-8,17H,1-3H3,(H2,16,18,24)	DAEMVYJRGKQQES-UHFFFAOYSA-N	CN1C(=O)N(C)C(=O)C(=C(C)NNC(=S)Nc2ccccc2)C1=O	BroadT	BRD-K56545046	BRD-K56545046-001-05-7	InterBioScreen Ltd.	STOCK4S-09165			CN1C(=O)N(C)C(=O)C(=C(C)NN=C(S)Nc2ccccc2)C1=O	InChI=1S/C15H17N5O3S/c1-9(11-12(21)19(2)15(23)20(3)13(11)22)17-18-14(24)16-10-7-5-4-6-8-10/h4-8,17H,1-3H3,(H2,16,18,24)	DAEMVYJRGKQQES-UHFFFAOYSA-N	347.105210144							121538
AC1NKOE8	LSM-32982	SID24781151, BRD-A70370886	4916600	InChI=1S/C20H22N2O4/c23-19(21-12-14-25-15-7-2-1-3-8-15)16-9-4-5-10-17(16)22-20(24)18-11-6-13-26-18/h1-5,7-10,18H,6,11-14H2,(H,21,23)(H,22,24)	NEAAQTDWNJDKEY-UHFFFAOYSA-N	O=C(Nc1ccccc1C(=O)NCCOc2ccccc2)C3CCCO3	BroadT	BRD-A70370886	BRD-A70370886-001-05-7	ChemDiv Inc.	8015-7416			O=C(Nc1ccccc1C(=O)NCCOc1ccccc1)C1CCCO1	InChI=1S/C20H22N2O4/c23-19(21-12-14-25-15-7-2-1-3-8-15)16-9-4-5-10-17(16)22-20(24)18-11-6-13-26-18/h1-5,7-10,18H,6,11-14H2,(H,21,23)(H,22,24)	NEAAQTDWNJDKEY-UHFFFAOYSA-N	354.157957204							121539
MLS000770890	LSM-43620	BRD-K78651469	2484997	InChI=1S/C26H25N2O2/c1-26(2)22-11-7-8-12-23(22)27(3)24(26)17-21(29)18-28-15-13-20(14-16-28)25(30)19-9-5-4-6-10-19/h4-17H,18H2,1-3H3/q+1/b24-17-	WODMGVOQYAYICN-ULJHMMPZSA-N	CN1\C(=C/C(=O)C[n+]2ccc(cc2)C(=O)c3ccccc3)\C(C)(C)c4ccccc14	BroadT	BRD-K78651469	BRD-K78651469-003-07-7	Enamine Ltd.	T0519-4563		Cl	CN1c2ccccc2C(C)(C)\C1=C\C(=O)C[n+]1ccc(cc1)C(=O)c1ccccc1.Cl	InChI=1S/C26H25N2O2.ClH/c1-26(2)22-11-7-8-12-23(22)27(3)24(26)17-21(29)18-28-15-13-20(14-16-28)25(30)19-9-5-4-6-10-19;/h4-17H,18H2,1-3H3;1H/q+1;/b24-17-;	KGZIICYCZKVZOP-IJVOEZGUSA-N	397.19160306							, 
SMR000219163	LSM-44448	SID17512923, BRD-K60743244	1984500	InChI=1S/C19H21N3OS2/c1-2-3-4-8-11-22-18(23)16(25-19(22)24)12-15-13-20-21-17(15)14-9-6-5-7-10-14/h5-7,9-10,12-13H,2-4,8,11H2,1H3,(H,20,21)/b16-12-	GEMOAMFASTVPGD-VBKFSLOCSA-N	CCCCCCN1C(=S)S\C(=C/c2c[nH]nc2c3ccccc3)\C1=O	BroadT	BRD-K60743244	BRD-K60743244-001-05-2	InterBioScreen Ltd.	STOCK3S-38628			CCCCCCN1C(=S)S\C(=C/c2c[nH]nc2-c2ccccc2)C1=O	InChI=1S/C19H21N3OS2/c1-2-3-4-8-11-22-18(23)16(25-19(22)24)12-15-13-20-21-17(15)14-9-6-5-7-10-14/h5-7,9-10,12-13H,2-4,8,11H2,1H3,(H,20,21)/b16-12-	GEMOAMFASTVPGD-VBKFSLOCSA-N	371.112603702							
ST50110976	LSM-32984	BRD-A77686158	5087051	InChI=1S/C17H13Cl2N3O4/c18-9-5-6-10(13(19)7-9)12(8-22(25)26)15-16(20-21-17(15)24)11-3-1-2-4-14(11)23/h1-7,12,23H,8H2,(H2,20,21,24)	APQNTBCJKKGZJG-UHFFFAOYSA-N	Oc1ccccc1c2[nH]nc(O)c2C(C[N+](=O)[O-])c3ccc(Cl)cc3Cl	BroadT	BRD-A77686158	BRD-A77686158-001-05-0	Specs	AQ-750/42238162			Oc1n[nH]c(c1C(C[N+]([O-])=O)c1ccc(Cl)cc1Cl)-c1ccccc1O	InChI=1S/C17H13Cl2N3O4/c18-9-5-6-10(13(19)7-9)12(8-22(25)26)15-16(20-21-17(15)24)11-3-1-2-4-14(11)23/h1-7,12,23H,8H2,(H2,20,21,24)	APQNTBCJKKGZJG-UHFFFAOYSA-N	393.028311346							121541
SMR000068707	LSM-32985	SID89853324, SID3717762, BRD-K56873616	2577001	InChI=1S/C23H21N3O5/c1-2-29-23-17(7-5-11-24-23)22(28)26-18-8-4-3-6-16(18)21(27)25-13-15-9-10-19-20(12-15)31-14-30-19/h3-12H,2,13-14H2,1H3,(H,25,27)(H,26,28)	SZJTUBRODALIQW-UHFFFAOYSA-N	CCOc1ncccc1C(=O)Nc2ccccc2C(=O)NCc3ccc4OCOc4c3	BroadT	BRD-K56873616	BRD-K56873616-001-05-3	Enamine Ltd.	T5347420			CCOc1ncccc1C(=O)Nc1ccccc1C(=O)NCc1ccc2OCOc2c1	InChI=1S/C23H21N3O5/c1-2-29-23-17(7-5-11-24-23)22(28)26-18-8-4-3-6-16(18)21(27)25-13-15-9-10-19-20(12-15)31-14-30-19/h3-12H,2,13-14H2,1H3,(H,25,27)(H,26,28)	SZJTUBRODALIQW-UHFFFAOYSA-N	419.148120802							121542
SMR000010034	LSM-32986	SID26667821, SID844321, BRD-A72053433	646641	InChI=1S/C19H24N4O4S/c1-11(2)28-19-20-16-15(17(25)21-18(26)22(16)4)23(19)9-13(24)10-27-14-8-6-5-7-12(14)3/h5-8,11,13,24H,9-10H2,1-4H3,(H,21,25,26)	NVQSEQBVUMYANE-UHFFFAOYSA-N	CC(C)Sc1nc2N(C)C(=O)NC(=O)c2n1CC(O)COc3ccccc3C	BroadT	BRD-A72053433	BRD-A72053433-001-05-5	Asinex Ltd.	BAS 01122557			CC(C)Sc1nc2n(C)c(=O)[nH]c(=O)c2n1CC(O)COc1ccccc1C	InChI=1S/C19H24N4O4S/c1-11(2)28-19-20-16-15(17(25)21-18(26)22(16)4)23(19)9-13(24)10-27-14-8-6-5-7-12(14)3/h5-8,11,13,24H,9-10H2,1-4H3,(H,21,25,26)	NVQSEQBVUMYANE-UHFFFAOYSA-N	404.151825978							121543
SMR000003653	LSM-32987	SID26667743, SID853689, BRD-K38463744	656349	InChI=1S/C19H22ClN5O3S2/c1-27-8-4-7-25-16(23-24-19(25)30-12-17(26)28-2)10-15-11-29-18(22-15)21-14-6-3-5-13(20)9-14/h3,5-6,9,11H,4,7-8,10,12H2,1-2H3,(H,21,22)	FMRHPEFTSDIZEM-UHFFFAOYSA-N	COCCCn1c(Cc2csc(Nc3cccc(Cl)c3)n2)nnc1SCC(=O)OC	BroadT	BRD-K38463744	BRD-K38463744-001-05-1	Asinex Ltd.	ASN 04735777			COCCCn1c(Cc2csc(Nc3cccc(Cl)c3)n2)nnc1SCC(=O)OC	InChI=1S/C19H22ClN5O3S2/c1-27-8-4-7-25-16(23-24-19(25)30-12-17(26)28-2)10-15-11-29-18(22-15)21-14-6-3-5-13(20)9-14/h3,5-6,9,11H,4,7-8,10,12H2,1-2H3,(H,21,22)	FMRHPEFTSDIZEM-UHFFFAOYSA-N	467.085258704							121544
5-(4-Methoxyphenyl)-n-[(5-methyl-2-phenyl-2H-1,2,3-triazol-4-yl)methyl]-1,3-oxazole-4-carboxamide	LSM-32988	SID26730587, BRD-K19848836	2738924	InChI=1S/C21H19N5O3/c1-14-18(25-26(24-14)16-6-4-3-5-7-16)12-22-21(27)19-20(29-13-23-19)15-8-10-17(28-2)11-9-15/h3-11,13H,12H2,1-2H3,(H,22,27)	XQSPWVRPKGJIDF-UHFFFAOYSA-N	COc1ccc(cc1)c2ocnc2C(=O)NCc3nn(nc3C)c4ccccc4	BroadT	BRD-K19848836	BRD-K19848836-001-06-3	Maybridge	SCR 01447			COc1ccc(cc1)-c1ocnc1C(=O)NCc1nn(nc1C)-c1ccccc1	InChI=1S/C21H19N5O3/c1-14-18(25-26(24-14)16-6-4-3-5-7-16)12-22-21(27)19-20(29-13-23-19)15-8-10-17(28-2)11-9-15/h3-11,13H,12H2,1-2H3,(H,22,27)	XQSPWVRPKGJIDF-UHFFFAOYSA-N	389.148789518							121545
Phenyl 8-quinolinecarboxylate	LSM-32989	SID4259958, BRD-K61943989	2227226	InChI=1S/C16H11NO2/c18-16(19-13-8-2-1-3-9-13)14-10-4-6-12-7-5-11-17-15(12)14/h1-11H	GPMDYHKFDVDMLK-UHFFFAOYSA-N	O=C(Oc1ccccc1)c2cccc3cccnc23	BroadT	BRD-K61943989	BRD-K61943989-001-05-6	ChemBridge Corporation	7952431			O=C(Oc1ccccc1)c1cccc2cccnc12	InChI=1S/C16H11NO2/c18-16(19-13-8-2-1-3-9-13)14-10-4-6-12-7-5-11-17-15(12)14/h1-11H	GPMDYHKFDVDMLK-UHFFFAOYSA-N	249.078978602							121546
AC1LJEK5	LSM-32990	BRD-K70982720	949404	InChI=1S/C13H11F2N3OS2/c14-12(15)21-10-4-1-8(2-5-10)11-6-3-9(19-11)7-17-18-13(16)20/h1-7,12H,(H3,16,18,20)	NQVIVKASMXXLDN-UHFFFAOYSA-N	FC(F)Sc1ccc(cc1)c2oc(C=NNC(=N)S)cc2	BroadT	BRD-K70982720	BRD-K70982720-001-06-5	InterBioScreen Ltd.	STOCK3S-18411			FC(F)Sc1ccc(cc1)-c1ccc(C=NNC(S)=N)o1	InChI=1S/C13H11F2N3OS2/c14-12(15)21-10-4-1-8(2-5-10)11-6-3-9(19-11)7-17-18-13(16)20/h1-7,12H,(H3,16,18,20)	NQVIVKASMXXLDN-UHFFFAOYSA-N	327.031159782							121547
MLS000588381	LSM-15238	BRD-K64695087	3277319	InChI=1S/C22H23BrClN4O/c23-17-7-5-16(6-8-17)20(29)15-28-22-4-2-1-3-13-27(22)21(26-28)14-25-19-11-9-18(24)10-12-19/h5-12,25H,1-4,13-15H2/q+1	TXETVFLRKCMROY-UHFFFAOYSA-N	Clc1ccc(NCc2n[n+](CC(=O)c3ccc(Br)cc3)c4CCCCCn24)cc1	BroadT	BRD-K64695087	BRD-K64695087-004-06-2	InterBioScreen Ltd.	STOCK2S-37089		Br	Clc1ccc(NCc2n[n+](CC(=O)c3ccc(Br)cc3)c3CCCCCn23)cc1.Br	InChI=1S/C22H23BrClN4O.BrH/c23-17-7-5-16(6-8-17)20(29)15-28-22-4-2-1-3-13-27(22)21(26-28)14-25-19-11-9-18(24)10-12-19;/h5-12,25H,1-4,13-15H2;1H/q+1;	IKXASPUFVJSIQW-UHFFFAOYSA-N	473.074376706							103885, 103885
4-Hydroxy-7-methyl-9-(trifluoromethyl)pyrido[2',3':4,5]thieno[2,3-b]pyridin-2(1H)-one	LSM-32991	SID14723001, BRD-K35696290	54703200	InChI=1S/C12H7F3N2O2S/c1-4-2-5(12(13,14)15)8-9-10(20-11(8)16-4)6(18)3-7(19)17-9/h2-3H,1H3,(H2,17,18,19)	NSLDQSFCTBXSAU-UHFFFAOYSA-N	Cc1cc(c2c(n1)sc3c(O)cc(O)nc23)C(F)(F)F	BroadT	BRD-K35696290	BRD-K35696290-001-06-5	Asinex Ltd.	BAS 07414378			Cc1cc(c2c(n1)sc1c(O)cc(O)nc21)C(F)(F)F	InChI=1S/C12H7F3N2O2S/c1-4-2-5(12(13,14)15)8-9-10(20-11(8)16-4)6(18)3-7(19)17-9/h2-3H,1H3,(H2,17,18,19)	NSLDQSFCTBXSAU-UHFFFAOYSA-N	300.018032774							121548
SMR000043429	LSM-32992	SID861528, BRD-A70327512	5389588	InChI=1S/C17H21N3O3/c1-5-13(18-11(2)12-9-7-6-8-10-12)14-15(21)19(3)17(23)20(4)16(14)22/h6-11,18H,5H2,1-4H3	VGVRPXDWSAJPOU-UHFFFAOYSA-N	CCC(=C1C(=O)N(C)C(=O)N(C)C1=O)NC(C)c2ccccc2	BroadT	BRD-A70327512	BRD-A70327512-001-06-7	InterBioScreen Ltd.	STOCK4S-12431			CCC(NC(C)c1ccccc1)=C1C(=O)N(C)C(=O)N(C)C1=O	InChI=1S/C17H21N3O3/c1-5-13(18-11(2)12-9-7-6-8-10-12)14-15(21)19(3)17(23)20(4)16(14)22/h6-11,18H,5H2,1-4H3	VGVRPXDWSAJPOU-UHFFFAOYSA-N	315.158291562							121549
BAS 00435589	LSM-32993	SID17507408, BRD-K04993135	1615340	InChI=1S/C18H17N5O3S3/c1-2-15-21-22-18(28-15)23-29(25,26)14-10-8-13(9-11-14)19-17(27)20-16(24)12-6-4-3-5-7-12/h3-11H,2H2,1H3,(H,22,23)(H2,19,20,24,27)	CMSYHNSRNXLHDZ-UHFFFAOYSA-N	CCc1nnc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3ccccc3)cc2)s1	BroadT	BRD-K04993135	BRD-K04993135-001-05-4	Asinex Ltd.	BAS 00435589			CCc1nnc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3ccccc3)cc2)s1	InChI=1S/C18H17N5O3S3/c1-2-15-21-22-18(28-15)23-29(25,26)14-10-8-13(9-11-14)19-17(27)20-16(24)12-6-4-3-5-7-12/h3-11H,2H2,1H3,(H,22,23)(H2,19,20,24,27)	CMSYHNSRNXLHDZ-UHFFFAOYSA-N	447.049351524							121550
AC1MJBQO	LSM-32994	BRD-K95648092	3089422	InChI=1S/C19H19N5O/c1-24(2)16-10-8-14(9-11-16)13-20-23-19-21-17(12-18(25)22-19)15-6-4-3-5-7-15/h3-13H,1-2H3,(H2,21,22,23,25)	UQCKMDXOGINTAC-UHFFFAOYSA-N	CN(C)c1ccc(C=NNc2nc(O)cc(n2)c3ccccc3)cc1	BroadT	BRD-K95648092	BRD-K95648092-001-06-3	Specs	AE-848/32727017			CN(C)c1ccc(C=NNc2nc(O)cc(n2)-c2ccccc2)cc1	InChI=1S/C19H19N5O/c1-24(2)16-10-8-14(9-11-16)13-20-23-19-21-17(12-18(25)22-19)15-6-4-3-5-7-15/h3-13H,1-2H3,(H2,21,22,23,25)	UQCKMDXOGINTAC-UHFFFAOYSA-N	333.158960278							121551
MLS000673948	LSM-44449	SID24803502, BRD-K22609774	1227509	InChI=1S/C19H17N3O4S/c1-10-7-14(9-16-17(24)21-19(27-16)20-12(3)23)11(2)22(10)15-6-4-5-13(8-15)18(25)26/h4-9H,1-3H3,(H,25,26)(H,20,21,23,24)/b16-9-	UNSGQWFLWHHHQO-SXGWCWSVSA-N	CC(=O)NC1=NC(=O)\C(=C\c2cc(C)n(c2C)c3cccc(c3)C(=O)O)\S1	BroadT	BRD-K22609774	BRD-K22609774-001-05-0	ChemBridge Corporation	5976455			CC(=O)NC1=NC(=O)\C(S1)=C\c1cc(C)n(c1C)-c1cccc(c1)C(O)=O	InChI=1S/C19H17N3O4S/c1-10-7-14(9-16-17(24)21-19(27-16)20-12(3)23)11(2)22(10)15-6-4-5-13(8-15)18(25)26/h4-9H,1-3H3,(H,25,26)(H,20,21,23,24)/b16-9-	UNSGQWFLWHHHQO-SXGWCWSVSA-N	383.093976744							
SMR000027863	LSM-32996	SID4243734, BRD-A62095238	3238420	InChI=1S/C22H31N3O3/c1-3-17-9-6-7-13-25(17)14-8-12-23-21(26)16-28-20-15-22(27)24(2)19-11-5-4-10-18(19)20/h4-5,10-11,15,17H,3,6-9,12-14,16H2,1-2H3,(H,23,26)	ZHHJXQQMEAKFPB-UHFFFAOYSA-N	CCC1CCCCN1CCCNC(=O)COC2=CC(=O)N(C)c3ccccc23	BroadT	BRD-A62095238	BRD-A62095238-001-05-5	ChemDiv Inc.	C547-0111			CCC1CCCCN1CCCNC(=O)COc1cc(=O)n(C)c2ccccc12	InChI=1S/C22H31N3O3/c1-3-17-9-6-7-13-25(17)14-8-12-23-21(26)16-28-20-15-22(27)24(2)19-11-5-4-10-18(19)20/h4-5,10-11,15,17H,3,6-9,12-14,16H2,1-2H3,(H,23,26)	ZHHJXQQMEAKFPB-UHFFFAOYSA-N	385.236541882							121553
AC1MYWV2	LSM-32997	SID22409395, BRD-K25260870	3888835	InChI=1S/C26H30N4O4S/c1-19-9-8-10-20(17-19)27-26(31)28-21-13-14-23(30-15-6-3-7-16-30)25(18-21)35(32,33)29-22-11-4-5-12-24(22)34-2/h4-5,8-14,17-18,29H,3,6-7,15-16H2,1-2H3,(H2,27,28,31)	RKMJGHRANJOKPQ-UHFFFAOYSA-N	COc1ccccc1NS(=O)(=O)c2cc(NC(=O)Nc3cccc(C)c3)ccc2N4CCCCC4	BroadT	BRD-K25260870	BRD-K25260870-001-06-0	Enamine Ltd.	T0505-3112			COc1ccccc1NS(=O)(=O)c1cc(NC(=O)Nc2cccc(C)c2)ccc1N1CCCCC1	InChI=1S/C26H30N4O4S/c1-19-9-8-10-20(17-19)27-26(31)28-21-13-14-23(30-15-6-3-7-16-30)25(18-21)35(32,33)29-22-11-4-5-12-24(22)34-2/h4-5,8-14,17-18,29H,3,6-7,15-16H2,1-2H3,(H2,27,28,31)	RKMJGHRANJOKPQ-UHFFFAOYSA-N	494.19877617							121554
MLS000882732	LSM-32998	SID26732347, BRD-K17199516	16060478	InChI=1S/C30H28FNO2/c1-20(33)22-11-13-23(14-12-22)24-15-16-25(27(31)18-24)28-26-10-6-7-17-30(26,2)29(34)32(28)19-21-8-4-3-5-9-21/h3-6,8-16,18,26,28H,7,17,19H2,1-2H3/t26-,28-,30+/m0/s1	CBSFIPZNVMHQDA-BTIIJPOSSA-N	CC(=O)c1ccc(cc1)c2ccc([C@H]3[C@@H]4C=CCC[C@@]4(C)C(=O)N3Cc5ccccc5)c(F)c2	BroadT	BRD-K17199516	BRD-K17199516-001-06-0	University of Kansas CMLD	KUC101248N			CC(=O)c1ccc(cc1)-c1ccc([C@H]2[C@@H]3C=CCC[C@@]3(C)C(=O)N2Cc2ccccc2)c(F)c1	InChI=1S/C30H28FNO2/c1-20(33)22-11-13-23(14-12-22)24-15-16-25(27(31)18-24)28-26-10-6-7-17-30(26,2)29(34)32(28)19-21-8-4-3-5-9-21/h3-6,8-16,18,26,28H,7,17,19H2,1-2H3/t26-,28-,30+/m0/s1	CBSFIPZNVMHQDA-BTIIJPOSSA-N	453.210407346							121555
N-Cyclopentyl-4-[4-(furan-2-carbonyl)-piperazine-1-sulfonyl]-benzenesulfonamide	LSM-32999	SID843248, SID26667986, BRD-K94945014	645529	InChI=1S/C20H25N3O6S2/c24-20(19-6-3-15-29-19)22-11-13-23(14-12-22)31(27,28)18-9-7-17(8-10-18)30(25,26)21-16-4-1-2-5-16/h3,6-10,15-16,21H,1-2,4-5,11-14H2	BRHYGSWEPKBNQL-UHFFFAOYSA-N	O=C(N1CCN(CC1)S(=O)(=O)c2ccc(cc2)S(=O)(=O)NC3CCCC3)c4occc4	BroadT	BRD-K94945014	BRD-K94945014-001-05-1	Asinex Ltd.	ASN 04887475			O=C(N1CCN(CC1)S(=O)(=O)c1ccc(cc1)S(=O)(=O)NC1CCCC1)c1ccco1	InChI=1S/C20H25N3O6S2/c24-20(19-6-3-15-29-19)22-11-13-23(14-12-22)31(27,28)18-9-7-17(8-10-18)30(25,26)21-16-4-1-2-5-16/h3,6-10,15-16,21H,1-2,4-5,11-14H2	BRHYGSWEPKBNQL-UHFFFAOYSA-N	467.11847693							121556
6-Bromo-n-(2-methylphenyl)-2-pyridin-4-ylimidazo[1,2-a]pyridin-3-amine	LSM-33000	SID17510452, BRD-K86379340	7106785	InChI=1S/C19H15BrN4/c1-13-4-2-3-5-16(13)22-19-18(14-8-10-21-11-9-14)23-17-7-6-15(20)12-24(17)19/h2-12,22H,1H3	VVXKMWZZOODTGL-UHFFFAOYSA-N	Cc1ccccc1Nc2c(nc3ccc(Br)cn23)c4ccncc4	BroadT	BRD-K86379340	BRD-K86379340-001-06-6	ChemDiv Inc.	C273-0281			Cc1ccccc1Nc1c(nc2ccc(Br)cn12)-c1ccncc1	InChI=1S/C19H15BrN4/c1-13-4-2-3-5-16(13)22-19-18(14-8-10-21-11-9-14)23-17-7-6-15(20)12-24(17)19/h2-12,22H,1H3	VVXKMWZZOODTGL-UHFFFAOYSA-N	378.04800912							121557
ZINC04867024	LSM-33001	BRD-K90321439	6789541	InChI=1S/C23H25N3O/c1-3-25(4-2)22-16-15-19(23(27)17-22)18-24-26(20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-18,27H,3-4H2,1-2H3	DFRVZIVYWKYYEV-UHFFFAOYSA-N	CCN(CC)c1ccc(C=NN(c2ccccc2)c3ccccc3)c(O)c1	BroadT	BRD-K90321439	BRD-K90321439-001-06-4	Enamine Ltd.	T0506-6860			CCN(CC)c1ccc(C=NN(c2ccccc2)c2ccccc2)c(O)c1	InChI=1S/C23H25N3O/c1-3-25(4-2)22-16-15-19(23(27)17-22)18-24-26(20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-18,27H,3-4H2,1-2H3	DFRVZIVYWKYYEV-UHFFFAOYSA-N	359.19976245							
SMR000027864	LSM-33002	SID4249051, BRD-A23056432	3243055	InChI=1S/C22H31N3O3/c1-16-11-17(2)14-25(13-16)10-6-9-23-21(26)15-28-20-12-22(27)24(3)19-8-5-4-7-18(19)20/h4-5,7-8,12,16-17H,6,9-11,13-15H2,1-3H3,(H,23,26)	SSOWUTBUSRREHD-UHFFFAOYSA-N	CC1CC(C)CN(CCCNC(=O)COC2=CC(=O)N(C)c3ccccc23)C1	BroadT	BRD-A23056432	BRD-A23056432-001-05-9	ChemDiv Inc.	C547-0112			CC1CC(C)CN(CCCNC(=O)COc2cc(=O)n(C)c3ccccc23)C1	InChI=1S/C22H31N3O3/c1-16-11-17(2)14-25(13-16)10-6-9-23-21(26)15-28-20-12-22(27)24(3)19-8-5-4-7-18(19)20/h4-5,7-8,12,16-17H,6,9-11,13-15H2,1-3H3,(H,23,26)	SSOWUTBUSRREHD-UHFFFAOYSA-N	385.236541882							121559
MLS000730255	LSM-33003	SID24785492, BRD-K68853635	16188851	InChI=1S/C15H14N2O3/c1-9(18)10-5-7-11(8-6-10)16-15(19)14-12-3-2-4-13(12)20-17-14/h5-8H,2-4H2,1H3,(H,16,19)	IKFPLCJKATWICF-UHFFFAOYSA-N	CC(=O)c1ccc(NC(=O)c2noc3CCCc23)cc1	BroadT	BRD-K68853635	BRD-K68853635-001-05-8	ChemDiv Inc.	C226-3256			CC(=O)c1ccc(NC(=O)c2noc3CCCc23)cc1	InChI=1S/C15H14N2O3/c1-9(18)10-5-7-11(8-6-10)16-15(19)14-12-3-2-4-13(12)20-17-14/h5-8H,2-4H2,1H3,(H,16,19)	IKFPLCJKATWICF-UHFFFAOYSA-N	270.100442328							121560
F1044-0038	LSM-33004	SID4261841, BRD-A39840326	2917197	InChI=1S/C17H20N2O4S/c1-2-23-17(20)14-8-5-11-19(12-14)24(21,22)15-9-3-6-13-7-4-10-18-16(13)15/h3-4,6-7,9-10,14H,2,5,8,11-12H2,1H3	XABZKASWEGYHPF-UHFFFAOYSA-N	CCOC(=O)C1CCCN(C1)S(=O)(=O)c2cccc3cccnc23	BroadT	BRD-A39840326	BRD-A39840326-001-06-5	ChemBridge Corporation	6876543			CCOC(=O)C1CCCN(C1)S(=O)(=O)c1cccc2cccnc12	InChI=1S/C17H20N2O4S/c1-2-23-17(20)14-8-5-11-19(12-14)24(21,22)15-9-3-6-13-7-4-10-18-16(13)15/h3-4,6-7,9-10,14H,2,5,8,11-12H2,1H3	XABZKASWEGYHPF-UHFFFAOYSA-N	348.11437783							121561
T5279791	LSM-33005	SID24825337, BRD-A08049203	3349140	InChI=1S/C15H21N5O3S2/c1-4-19(12-5-6-25(22,23)9-12)13(21)8-24-15-17-14-16-10(2)7-11(3)20(14)18-15/h7,12H,4-6,8-9H2,1-3H3	GNHAAOVZKNNSKU-UHFFFAOYSA-N	CCN(C1CCS(=O)(=O)C1)C(=O)CSc2nc3nc(C)cc(C)n3n2	BroadT	BRD-A08049203	BRD-A08049203-001-05-0	Enamine Ltd.	T5279791			CCN(C1CCS(=O)(=O)C1)C(=O)CSc1nc2nc(C)cc(C)n2n1	InChI=1S/C15H21N5O3S2/c1-4-19(12-5-6-25(22,23)9-12)13(21)8-24-15-17-14-16-10(2)7-11(3)20(14)18-15/h7,12H,4-6,8-9H2,1-3H3	GNHAAOVZKNNSKU-UHFFFAOYSA-N	383.108580962							121562
SMR000128214	LSM-33006	SID14733493, BRD-A33832751	9550517	InChI=1S/C24H28N4O3S2/c29-24(26-20-8-3-6-17-5-1-2-7-19(17)20)18-13-11-16(12-14-18)15-25-33(30,31)22-10-4-9-21-23(22)28-32-27-21/h1-2,4-5,7,9-10,16,18,20,25H,3,6,8,11-15H2,(H,26,29)	ZICQKNIWGUYGEG-UHFFFAOYSA-N	O=C(NC1CCCc2ccccc12)C3CCC(CNS(=O)(=O)c4cccc5nsnc45)CC3	BroadT	BRD-A33832751	BRD-A33832751-001-04-7	ChemDiv Inc.	C548-3563			O=C(NC1CCCc2ccccc12)C1CCC(CNS(=O)(=O)c2cccc3nsnc23)CC1	InChI=1S/C24H28N4O3S2/c29-24(26-20-8-3-6-17-5-1-2-7-19(17)20)18-13-11-16(12-14-18)15-25-33(30,31)22-10-4-9-21-23(22)28-32-27-21/h1-2,4-5,7,9-10,16,18,20,25H,3,6,8,11-15H2,(H,26,29)	ZICQKNIWGUYGEG-UHFFFAOYSA-N	484.160282176							121563
79559-61-8	LSM-33007	SID24841415, BRD-A48753142	5318228	InChI=1S/C20H24O4/c1-24-20-13-16(9-12-19(20)23)8-11-18(22)14-17(21)10-7-15-5-3-2-4-6-15/h2-6,9,12-13,18,22-23H,7-8,10-11,14H2,1H3	JHJPDDBIHSFERA-UHFFFAOYSA-N	COc1cc(CCC(O)CC(=O)CCc2ccccc2)ccc1O	BroadT	BRD-A48753142	BRD-A48753142-001-05-3	AnalytiCon Discovery GmbH	NP-003332			COc1cc(CCC(O)CC(=O)CCc2ccccc2)ccc1O	InChI=1S/C20H24O4/c1-24-20-13-16(9-12-19(20)23)8-11-18(22)14-17(21)10-7-15-5-3-2-4-6-15/h2-6,9,12-13,18,22-23H,7-8,10-11,14H2,1H3	JHJPDDBIHSFERA-UHFFFAOYSA-N	328.167459248							121564
2-(3-Cyano-5,7-dimethyl-quinolin-2-ylsulfanyl)-n-furan-2-ylmethyl-acetamide	LSM-33008	SID851195, BRD-K89502693	653760	InChI=1S/C19H17N3O2S/c1-12-6-13(2)16-8-14(9-20)19(22-17(16)7-12)25-11-18(23)21-10-15-4-3-5-24-15/h3-8H,10-11H2,1-2H3,(H,21,23)	GLKWLQVECQPEBT-UHFFFAOYSA-N	Cc1cc(C)c2cc(C#N)c(SCC(=O)NCc3occc3)nc2c1	BroadT	BRD-K89502693	BRD-K89502693-001-05-5	Asinex Ltd.	ASN 05588071			Cc1cc(C)c2cc(C#N)c(SCC(=O)NCc3ccco3)nc2c1	InChI=1S/C19H17N3O2S/c1-12-6-13(2)16-8-14(9-20)19(22-17(16)7-12)25-11-18(23)21-10-15-4-3-5-24-15/h3-8H,10-11H2,1-2H3,(H,21,23)	GLKWLQVECQPEBT-UHFFFAOYSA-N	351.104147504							121565
STK131901	LSM-33009	SID4262853, BRD-K40625912	1150542	InChI=1S/C19H19N5O3S/c1-3-27-18(26)14-4-6-15(7-5-14)21-16(25)12-28-19-23-22-17(24(19)2)13-8-10-20-11-9-13/h4-11H,3,12H2,1-2H3,(H,21,25)	XXGVEGOHLBTMHG-UHFFFAOYSA-N	CCOC(=O)c1ccc(NC(=O)CSc2nnc(c3ccncc3)n2C)cc1	BroadT	BRD-K40625912	BRD-K40625912-001-05-7	ChemBridge Corporation	7762250			CCOC(=O)c1ccc(NC(=O)CSc2nnc(-c3ccncc3)n2C)cc1	InChI=1S/C19H19N5O3S/c1-3-27-18(26)14-4-6-15(7-5-14)21-16(25)12-28-19-23-22-17(24(19)2)13-8-10-20-11-9-13/h4-11H,3,12H2,1-2H3,(H,21,25)	XXGVEGOHLBTMHG-UHFFFAOYSA-N	397.120860208							121566
MLS-0435433.0001	LSM-2424	SID99495703, SID87544527, BRD-K19027210	8056641	InChI=1S/C22H22N6/c1-3-7-18(8-4-1)16-28-22-20(15-25-28)21(23-17-24-22)27-13-11-26(12-14-27)19-9-5-2-6-10-19/h1-10,15,17H,11-14,16H2	OBNJYHVKQLPHEM-UHFFFAOYSA-N	C(c1ccccc1)n2ncc3c(ncnc23)N4CCN(CC4)c5ccccc5	BroadT	BRD-K19027210	BRD-K19027210-001-01-1	Sanford-Burnham Medical Research Institute	MLS-0435433			C(c1ccccc1)n1ncc2c(ncnc12)N1CCN(CC1)c1ccccc1	InChI=1S/C22H22N6/c1-3-7-18(8-4-1)16-28-22-20(15-25-28)21(23-17-24-22)27-13-11-26(12-14-27)19-9-5-2-6-10-19/h1-10,15,17H,11-14,16H2	OBNJYHVKQLPHEM-UHFFFAOYSA-N	370.190594764							92347
MLS000537303	LSM-33010	SID14734971, BRD-K96783829	5294544	InChI=1S/C13H15N3OS/c1-2-16-12(17)9-7-8-5-3-4-6-10(8)14-11(9)15-13(16)18/h7H,2-6H2,1H3,(H,14,15,18)	RYMPDWNZCQXSCM-UHFFFAOYSA-N	CCN1C(=S)Nc2nc3CCCCc3cc2C1=O	BroadT	BRD-K96783829	BRD-K96783829-001-05-9	ChemBridge Corporation	7921340			CCn1c(=S)[nH]c2nc3CCCCc3cc2c1=O	InChI=1S/C13H15N3OS/c1-2-16-12(17)9-7-8-5-3-4-6-10(8)14-11(9)15-13(16)18/h7H,2-6H2,1H3,(H,14,15,18)	RYMPDWNZCQXSCM-UHFFFAOYSA-N	261.09358282							121567
SMR000082752	LSM-33011	SID4255070, BRD-K40723868	2243175	InChI=1S/C26H24N4O3/c31-25(29-13-11-26(12-14-29)32-15-16-33-26)22-18-24-27-21(19-7-3-1-4-8-19)17-23(30(24)28-22)20-9-5-2-6-10-20/h1-10,17-18H,11-16H2	KLARLECYBZJKAD-UHFFFAOYSA-N	O=C(N1CCC2(CC1)OCCO2)c3cc4nc(cc(c5ccccc5)n4n3)c6ccccc6	BroadT	BRD-K40723868	BRD-K40723868-001-06-2	ChemBridge Corporation	7990813			O=C(N1CCC2(CC1)OCCO2)c1cc2nc(cc(-c3ccccc3)n2n1)-c1ccccc1	InChI=1S/C26H24N4O3/c31-25(29-13-11-26(12-14-29)32-15-16-33-26)22-18-24-27-21(19-7-3-1-4-8-19)17-23(30(24)28-22)20-9-5-2-6-10-20/h1-10,17-18H,11-16H2	KLARLECYBZJKAD-UHFFFAOYSA-N	440.184840668							121568
AC1N31E8	LSM-33012	BRD-K52062784	4105330	InChI=1S/C15H11F2N3O2/c16-14(17)21-12-7-3-1-5-10(12)9-18-20-15-19-11-6-2-4-8-13(11)22-15/h1-9,14H,(H,19,20)	OSDGXTXDLILUHV-UHFFFAOYSA-N	FC(F)Oc1ccccc1C=NNc2oc3ccccc3n2	BroadT	BRD-K52062784	BRD-K52062784-001-05-3	Enamine Ltd.	T0508-7679			FC(F)Oc1ccccc1C=NNc1nc2ccccc2o1	InChI=1S/C15H11F2N3O2/c16-14(17)21-12-7-3-1-5-10(12)9-18-20-15-19-11-6-2-4-8-13(11)22-15/h1-9,14H,(H,19,20)	OSDGXTXDLILUHV-UHFFFAOYSA-N	303.081933022							121569
SMR000045936	LSM-33013	SID863623, BRD-K16565261	5389897	InChI=1S/C24H28N2O5/c1-16-22(17-5-3-4-6-21(17)30-2)23(29)18-7-8-20(28)19(24(18)31-16)15-26-11-9-25(10-12-26)13-14-27/h3-8,27-28H,9-15H2,1-2H3	KLTSZBAFPQFRLD-UHFFFAOYSA-N	COc1ccccc1C2=C(C)Oc3c(CN4CCN(CCO)CC4)c(O)ccc3C2=O	BroadT	BRD-K16565261	BRD-K16565261-001-04-5	InterBioScreen Ltd.	STOCK4S-83039			COc1ccccc1-c1c(C)oc2c(CN3CCN(CCO)CC3)c(O)ccc2c1=O	InChI=1S/C24H28N2O5/c1-16-22(17-5-3-4-6-21(17)30-2)23(29)18-7-8-20(28)19(24(18)31-16)15-26-11-9-25(10-12-26)13-14-27/h3-8,27-28H,9-15H2,1-2H3	KLTSZBAFPQFRLD-UHFFFAOYSA-N	424.199822016							121570
BRD-A90837308	LSM-33014			InChI=1S/C25H30N2O5/c1-16(2)15-32-19-8-9-20(17(3)13-19)23(28)21-22(18-7-5-10-26-14-18)27(11-6-12-31-4)25(30)24(21)29/h5,7-10,13-14,16,21-22H,6,11-12,15H2,1-4H3	JZHRZOSPEMCQHW-UHFFFAOYSA-N	COCCCN1C(C(C(=O)c2ccc(OCC(C)C)cc2C)C(=O)C1=O)c3cccnc3	BroadT	BRD-A90837308	BRD-A90837308-001-06-9	ChemBridge Corporation	6888983			COCCCN1C(C(C(=O)c2ccc(OCC(C)C)cc2C)C(=O)C1=O)c1cccnc1	InChI=1S/C25H30N2O5/c1-16(2)15-32-19-8-9-20(17(3)13-19)23(28)21-22(18-7-5-10-26-14-18)27(11-6-12-31-4)25(30)24(21)29/h5,7-10,13-14,16,21-22H,6,11-12,15H2,1-4H3	JZHRZOSPEMCQHW-UHFFFAOYSA-N	438.21547208							121571
SMR000037891	LSM-33015	SID858443, BRD-K47187153	659763	InChI=1S/C17H16N4/c1-2-6-15-14(5-1)17(21-11-3-4-12-21)20-16(19-15)13-7-9-18-10-8-13/h1-2,5-10H,3-4,11-12H2	QKLVRDVIYGQGBC-UHFFFAOYSA-N	C1CCN(C1)c2nc(nc3ccccc23)c4ccncc4	BroadT	BRD-K47187153	BRD-K47187153-001-05-9	InterBioScreen Ltd.	STOCK2S-44533			C1CCN(C1)c1nc(nc2ccccc12)-c1ccncc1	InChI=1S/C17H16N4/c1-2-6-15-14(5-1)17(21-11-3-4-12-21)20-16(19-15)13-7-9-18-10-8-13/h1-2,5-10H,3-4,11-12H2	QKLVRDVIYGQGBC-UHFFFAOYSA-N	276.137496552							121572
ST50425932	LSM-44450	BRD-K10688179	1584264	InChI=1S/C21H26N4O2/c1-18(14-20-8-5-13-27-20)15-22-23-21(26)17-25-11-9-24(10-12-25)16-19-6-3-2-4-7-19/h2-8,13-15H,9-12,16-17H2,1H3,(H,23,26)/b18-14+,22-15?	LGRPCGDYYMASJQ-AZORJWNQSA-N	C\C(=C/c1occc1)\C=NNC(=O)CN2CCN(Cc3ccccc3)CC2	BroadT	BRD-K10688179	BRD-K10688179-001-05-9	ChemDiv Inc.	3254-2258			C\C(C=NNC(=O)CN1CCN(Cc2ccccc2)CC1)=C/c1ccco1	InChI=1S/C21H26N4O2/c1-18(14-20-8-5-13-27-20)15-22-23-21(26)17-25-11-9-24(10-12-25)16-19-6-3-2-4-7-19/h2-8,13-15H,9-12,16-17H2,1H3,(H,23,26)/b18-14+,22-15?	LGRPCGDYYMASJQ-AZORJWNQSA-N	366.205576112							
N-(5-Methylisoxazol-3-yl)benzo[d][1,3]dioxole-5-carboxamide	LSM-33017	SID4259327, BRD-K77858004	717564	InChI=1S/C12H10N2O4/c1-7-4-11(14-18-7)13-12(15)8-2-3-9-10(5-8)17-6-16-9/h2-5H,6H2,1H3,(H,13,14,15)	OXODSZPOYQHMPS-UHFFFAOYSA-N	Cc1onc(NC(=O)c2ccc3OCOc3c2)c1	BroadT	BRD-K77858004	BRD-K77858004-001-05-9	ChemBridge Corporation	5245509			Cc1cc(NC(=O)c2ccc3OCOc3c2)no1	InChI=1S/C12H10N2O4/c1-7-4-11(14-18-7)13-12(15)8-2-3-9-10(5-8)17-6-16-9/h2-5H,6H2,1H3,(H,13,14,15)	OXODSZPOYQHMPS-UHFFFAOYSA-N	246.06405682							121574
MLS000882764	LSM-33018	SID26732366, BRD-A41497107	16746502	InChI=1S/C28H26FNO/c1-19-15-16-25(29)24(17-19)27-23-14-8-13-22(21-11-6-3-7-12-21)26(23)28(31)30(27)18-20-9-4-2-5-10-20/h2-12,14-17,22-23,26-27H,13,18H2,1H3/t22?,23?,26?,27-/m1/s1	JKQUHEGFTUFCCP-RHMNNOFSSA-N	Cc1ccc(F)c(c1)[C@H]2C3C=CCC(C3C(=O)N2Cc4ccccc4)c5ccccc5	BroadT	BRD-A41497107	BRD-A41497107-001-07-3	University of Kansas CMLD	KUC101302N			Cc1ccc(F)c(c1)[C@H]1C2C=CCC(C2C(=O)N1Cc1ccccc1)c1ccccc1	InChI=1S/C28H26FNO/c1-19-15-16-25(29)24(17-19)27-23-14-8-13-22(21-11-6-3-7-12-21)26(23)28(31)30(27)18-20-9-4-2-5-10-20/h2-12,14-17,22-23,26-27H,13,18H2,1H3/t22?,23?,26?,27-/m1/s1	JKQUHEGFTUFCCP-RHMNNOFSSA-N	411.199842662							121575
MLS000871826	LSM-33019	SID24385146, SID24783175, BRD-A04445933	16008866	InChI=1S/C21H24ClN3OS/c1-14-6-4-10-25(13-14)11-5-9-23-21(26)18-12-16-19(27-18)15-7-2-3-8-17(15)24-20(16)22/h2-3,7-8,12,14H,4-6,9-11,13H2,1H3,(H,23,26)	KBQSNNCVJNKFHP-UHFFFAOYSA-N	CC1CCCN(CCCNC(=O)c2cc3c(Cl)nc4ccccc4c3s2)C1	BroadT	BRD-A04445933	BRD-A04445933-001-07-7	ChemDiv Inc.	C593-0307			CC1CCCN(CCCNC(=O)c2cc3c(Cl)nc4ccccc4c3s2)C1	InChI=1S/C21H24ClN3OS/c1-14-6-4-10-25(13-14)11-5-9-23-21(26)18-12-16-19(27-18)15-7-2-3-8-17(15)24-20(16)22/h2-3,7-8,12,14H,4-6,9-11,13H2,1H3,(H,23,26)	KBQSNNCVJNKFHP-UHFFFAOYSA-N	401.132860818							121576
MLS000067840	LSM-33020	SID14723748, BRD-K12208406	1442803	InChI=1S/C17H18N4O2S/c1-10(2)16-18-13-7-5-4-6-12(13)17(20-16)24-9-15(22)19-14-8-11(3)23-21-14/h4-8,10H,9H2,1-3H3,(H,19,21,22)	MGDZMXRQAZCEAN-UHFFFAOYSA-N	CC(C)c1nc(SCC(=O)Nc2cc(C)on2)c3ccccc3n1	BroadT	BRD-K12208406	BRD-K12208406-001-05-9	Asinex Ltd.	ASN 06533178			CC(C)c1nc(SCC(=O)Nc2cc(C)on2)c2ccccc2n1	InChI=1S/C17H18N4O2S/c1-10(2)16-18-13-7-5-4-6-12(13)17(20-16)24-9-15(22)19-14-8-11(3)23-21-14/h4-8,10H,9H2,1-3H3,(H,19,21,22)	MGDZMXRQAZCEAN-UHFFFAOYSA-N	342.115046546							121577
BRD-A64419226	LSM-33021			InChI=1S/C18H20N2O3/c1-10-6-4-7-13(19-10)17-15(18(22)23-3)11(2)20-12-8-5-9-14(21)16(12)17/h4,6-7,15,17H,5,8-9H2,1-3H3	KEVKIIUKHWTMSN-UHFFFAOYSA-N	COC(=O)C1C(C2=C(CCCC2=O)N=C1C)c3cccc(C)n3	BroadT	BRD-A64419226	BRD-A64419226-001-06-7	Asinex Ltd.	BAS 09079654			COC(=O)C1C(c2cccc(C)n2)C2=C(CCCC2=O)N=C1C	InChI=1S/C18H20N2O3/c1-10-6-4-7-13(19-10)17-15(18(22)23-3)11(2)20-12-8-5-9-14(21)16(12)17/h4,6-7,15,17H,5,8-9H2,1-3H3	KEVKIIUKHWTMSN-UHFFFAOYSA-N	312.14739252							121578
N-Benzyl-1-(3-chlorobenzyl)-n-methylpiperidine-3-carboxamide	LSM-1845	BRD-A83402799, SID87219049, SID87556792, SID99495804	3500831	InChI=1S/C21H25ClN2O/c1-23(14-17-7-3-2-4-8-17)21(25)19-10-6-12-24(16-19)15-18-9-5-11-20(22)13-18/h2-5,7-9,11,13,19H,6,10,12,14-16H2,1H3	IAZWNNACOSEBDJ-UHFFFAOYSA-N	CN(Cc1ccccc1)C(=O)C2CCCN(Cc3cccc(Cl)c3)C2	BroadT	BRD-A83402799	BRD-A83402799-001-03-4	Broad Institute of MIT and Harvard	BRD-A83402799			CN(Cc1ccccc1)C(=O)C1CCCN(Cc2cccc(Cl)c2)C1	InChI=1S/C21H25ClN2O/c1-23(14-17-7-3-2-4-8-17)21(25)19-10-6-12-24(16-19)15-18-9-5-11-20(22)13-18/h2-5,7-9,11,13,19H,6,10,12,14-16H2,1H3	IAZWNNACOSEBDJ-UHFFFAOYSA-N	356.16554115							91909, 91909
1-[({[4-(Tert-butyl)cyclohexyliden]amino}oxy)carbonyl]-4-fluorobenzene	LSM-33022	SID24819807, BRD-K22616936	1474470	InChI=1S/C17H22FNO2/c1-17(2,3)13-6-10-15(11-7-13)19-21-16(20)12-4-8-14(18)9-5-12/h4-5,8-9,13H,6-7,10-11H2,1-3H3	RRHVKRNPDCPLDF-UHFFFAOYSA-N	CC(C)(C)C1CCC(=NOC(=O)c2ccc(F)cc2)CC1	BroadT	BRD-K22616936	BRD-K22616936-001-05-0	Key Organics Ltd.	3T-1140			CC(C)(C)C1CCC(CC1)=NOC(=O)c1ccc(F)cc1	InChI=1S/C17H22FNO2/c1-17(2,3)13-6-10-15(11-7-13)19-21-16(20)12-4-8-14(18)9-5-12/h4-5,8-9,13H,6-7,10-11H2,1-3H3	RRHVKRNPDCPLDF-UHFFFAOYSA-N	291.163457154							
AMBCB61807213	LSM-33023	SID49732123, BRD-K39004208	24792985	InChI=1S/C19H21ClN2O4/c1-24-18-8-13(20)5-6-17(18)25-11-15-9-16(21-26-15)19(23)22-10-12-3-2-4-14(22)7-12/h5-6,8-9,12,14H,2-4,7,10-11H2,1H3/t12-,14+/m1/s1	RSMMFESIRCIKHU-OCCSQVGLSA-N	COc1cc(Cl)ccc1OCc2onc(c2)C(=O)N3C[C@@H]4CCC[C@H]3C4	BroadT	BRD-K39004208	BRD-K39004208-001-05-1	ChemBridge Corporation	61807213			COc1cc(Cl)ccc1OCc1cc(no1)C(=O)N1C[C@H]2C[C@@H]1CCC2	InChI=1S/C19H21ClN2O4/c1-24-18-8-13(20)5-6-17(18)25-11-15-9-16(21-26-15)19(23)22-10-12-3-2-4-14(22)7-12/h5-6,8-9,12,14H,2-4,7,10-11H2,1H3/t12-,14+/m1/s1	RSMMFESIRCIKHU-OCCSQVGLSA-N	376.118984882							121580
ST50931258	LSM-33024	SID24781388, BRD-K41049580	3577242	InChI=1S/C19H16N4O5/c24-18(12-28-17-11-4-3-10-16(17)23(26)27)21-22-19(25)20-15-9-5-7-13-6-1-2-8-14(13)15/h1-11H,12H2,(H,21,24)(H2,20,22,25)	OUPAOZBBESVOIZ-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1OCC(=O)NNC(=O)Nc2cccc3ccccc23	BroadT	BRD-K41049580	BRD-K41049580-001-05-0	Specs	AK-968/15604086			[O-][N+](=O)c1ccccc1OCC(=O)NNC(=O)Nc1cccc2ccccc12	InChI=1S/C19H16N4O5/c24-18(12-28-17-11-4-3-10-16(17)23(26)27)21-22-19(25)20-15-9-5-7-13-6-1-2-8-14(13)15/h1-11H,12H2,(H,21,24)(H2,20,22,25)	OUPAOZBBESVOIZ-UHFFFAOYSA-N	380.112069652							121581
AC1N7EXF	LSM-33025	BRD-K02171186	4301427	InChI=1S/C15H13FN2O/c1-11(13-9-5-6-10-14(13)16)17-18-15(19)12-7-3-2-4-8-12/h2-10H,1H3,(H,18,19)	LSAPTPWUWQYFGK-UHFFFAOYSA-N	CC(=NNC(=O)c1ccccc1)c2ccccc2F	BroadT	BRD-K02171186	BRD-K02171186-001-05-7	Enamine Ltd.	T0508-5508			CC(=NNC(=O)c1ccccc1)c1ccccc1F	InChI=1S/C15H13FN2O/c1-11(13-9-5-6-10-14(13)16)17-18-15(19)12-7-3-2-4-8-12/h2-10H,1H3,(H,18,19)	LSAPTPWUWQYFGK-UHFFFAOYSA-N	256.101191256							121582
T5343314	LSM-33026	SID22401107, BRD-K92691194	2562489	InChI=1S/C21H23NO7S/c1-3-22(4-2)30(25,26)17-7-5-6-16(12-17)21(24)29-14-18(23)15-8-9-19-20(13-15)28-11-10-27-19/h5-9,12-13H,3-4,10-11,14H2,1-2H3	PTOYVIJBEHHAMP-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)OCC(=O)c2ccc3OCCOc3c2	BroadT	BRD-K92691194	BRD-K92691194-001-05-5	Enamine Ltd.	T5343314			CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)OCC(=O)c1ccc2OCCOc2c1	InChI=1S/C21H23NO7S/c1-3-22(4-2)30(25,26)17-7-5-6-16(12-17)21(24)29-14-18(23)15-8-9-19-20(13-15)28-11-10-27-19/h5-9,12-13H,3-4,10-11,14H2,1-2H3	PTOYVIJBEHHAMP-UHFFFAOYSA-N	433.119522776							121583
SMR000004365	LSM-33027	SID846942, BRD-K22719264	649334	InChI=1S/C22H23FN6O2/c1-15-2-5-17-11-18(22(31)24-20(17)10-15)13-28(8-9-30)14-21-25-26-27-29(21)12-16-3-6-19(23)7-4-16/h2-7,10-11,30H,8-9,12-14H2,1H3,(H,24,31)	GNLUMNUWMHGOMG-UHFFFAOYSA-N	Cc1ccc2cc(CN(CCO)Cc3nnnn3Cc4ccc(F)cc4)c(O)nc2c1	BroadT	BRD-K22719264	BRD-K22719264-001-05-4	Asinex Ltd.	ASN 05298476			Cc1ccc2cc(CN(CCO)Cc3nnnn3Cc3ccc(F)cc3)c(O)nc2c1	InChI=1S/C22H23FN6O2/c1-15-2-5-17-11-18(22(31)24-20(17)10-15)13-28(8-9-30)14-21-25-26-27-29(21)12-16-3-6-19(23)7-4-16/h2-7,10-11,30H,8-9,12-14H2,1H3,(H,24,31)	GNLUMNUWMHGOMG-UHFFFAOYSA-N	422.186652236							121584
4-Cyclohexyl-5-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol	LSM-33028	SID7975606, BRD-K62081812	696380	InChI=1S/C15H19N3OS/c1-19-13-9-7-11(8-10-13)14-16-17-15(20)18(14)12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H,17,20)	NSAJUYMRPAVLGA-UHFFFAOYSA-N	COc1ccc(cc1)c2nnc(S)n2C3CCCCC3	BroadT	BRD-K62081812	BRD-K62081812-001-06-5	ChemBridge Corporation	5954913			COc1ccc(cc1)-c1nnc(S)n1C1CCCCC1	InChI=1S/C15H19N3OS/c1-19-13-9-7-11(8-10-13)14-16-17-15(20)18(14)12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H,17,20)	NSAJUYMRPAVLGA-UHFFFAOYSA-N	289.124882948							121585
AF-399/37326001	LSM-33029	SID843710, BRD-A51476727	646012	InChI=1S/C16H13F3N2O3S/c17-16(18,19)15(24)11(13(22)10-7-4-8-25-10)12(20-14(23)21-15)9-5-2-1-3-6-9/h1-8,11-12,24H,(H2,20,21,23)	OXRRYKXYECAQSB-UHFFFAOYSA-N	OC1(NC(=O)NC(C1C(=O)c2cccs2)c3ccccc3)C(F)(F)F	BroadT	BRD-A51476727	BRD-A51476727-001-06-6	Asinex Ltd.	BAS 03548083			OC1(NC(=O)NC(C1C(=O)c1cccs1)c1ccccc1)C(F)(F)F	InChI=1S/C16H13F3N2O3S/c17-16(18,19)15(24)11(13(22)10-7-4-8-25-10)12(20-14(23)21-15)9-5-2-1-3-6-9/h1-8,11-12,24H,(H2,20,21,23)	OXRRYKXYECAQSB-UHFFFAOYSA-N	370.059897586							121586
6-Ethyl-5-methyl-2-(thiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7(1H)-one	LSM-33030	SID7975091, BRD-K95248561	784809	InChI=1S/C13H13N3OS/c1-3-9-8(2)14-12-7-10(11-5-4-6-18-11)15-16(12)13(9)17/h4-7,17H,3H2,1-2H3	PJPNMOUVUPBKGD-UHFFFAOYSA-N	CCc1c(C)nc2cc(nn2c1O)c3cccs3	BroadT	BRD-K95248561	BRD-K95248561-001-04-9	ChemBridge Corporation	5996383			CCc1c(C)nc2cc(nn2c1O)-c1cccs1	InChI=1S/C13H13N3OS/c1-3-9-8(2)14-12-7-10(11-5-4-6-18-11)15-16(12)13(9)17/h4-7,17H,3H2,1-2H3	PJPNMOUVUPBKGD-UHFFFAOYSA-N	259.077932756							
MLS000676165	LSM-44451	SID24789033, BRD-K50447468	848114	InChI=1S/C18H19N3O2/c1-4-20-12(2)10-14(13(20)3)11-16-17(22)21(18(23)19-16)15-8-6-5-7-9-15/h5-11H,4H2,1-3H3,(H,19,23)/b16-11+	KEUJKDKAKDGXCP-LFIBNONCSA-N	CCn1c(C)cc(\C=C/2\NC(=O)N(C2=O)c3ccccc3)c1C	BroadT	BRD-K50447468	BRD-K50447468-001-08-5	ChemBridge Corporation	7178169			CCn1c(C)cc(\C=C2\NC(=O)N(C2=O)c2ccccc2)c1C	InChI=1S/C18H19N3O2/c1-4-20-12(2)10-14(13(20)3)11-16-17(22)21(18(23)19-16)15-8-6-5-7-9-15/h5-11H,4H2,1-3H3,(H,19,23)/b16-11+	KEUJKDKAKDGXCP-LFIBNONCSA-N	309.147726878							
ZINC03244954	LSM-44452	SID22406413, BRD-K13438055	2362313	InChI=1S/C21H16N2O4S/c1-26-16-9-6-14(7-10-16)8-11-20(25)27-13-15-12-19(24)23-17-4-2-3-5-18(17)28-21(23)22-15/h2-12H,13H2,1H3/b11-8+	UPHLRCWSZFEBCN-DHZHZOJOSA-N	COc1ccc(\C=C\C(=O)OCC2=CC(=O)N3C(=N2)Sc4ccccc34)cc1	BroadT	BRD-K13438055	BRD-K13438055-001-06-3	Enamine Ltd.	T0512-6643			COc1ccc(\C=C\C(=O)OCc2cc(=O)n3c(n2)sc2ccccc32)cc1	InChI=1S/C21H16N2O4S/c1-26-16-9-6-14(7-10-16)8-11-20(25)27-13-15-12-19(24)23-17-4-2-3-5-18(17)28-21(23)22-15/h2-12H,13H2,1H3/b11-8+	UPHLRCWSZFEBCN-DHZHZOJOSA-N	392.083077702							
CHEMDIV2_006311	LSM-33033	SID24785676, BRD-K47517909	6619395	InChI=1S/C25H22N2O6/c1-31-21-13-12-18(14-22(21)32-2)27-24(29)19-10-6-7-11-20(19)26(25(27)30)15-23(28)33-16-17-8-4-3-5-9-17/h3-14H,15-16H2,1-2H3	OVVOBCPUDNVSCO-UHFFFAOYSA-N	COc1ccc(cc1OC)N2C(=O)N(CC(=O)OCc3ccccc3)c4ccccc4C2=O	BroadT	BRD-K47517909	BRD-K47517909-001-05-4	ChemDiv Inc.	C260-0571			COc1ccc(cc1OC)-n1c(=O)n(CC(=O)OCc2ccccc2)c2ccccc2c1=O	InChI=1S/C25H22N2O6/c1-31-21-13-12-18(14-22(21)32-2)27-24(29)19-10-6-7-11-20(19)26(25(27)30)15-23(28)33-16-17-8-4-3-5-9-17/h3-14H,15-16H2,1-2H3	OVVOBCPUDNVSCO-UHFFFAOYSA-N	446.147786444							121590
ST006925	LSM-43621	BRD-K69812950	682937	InChI=1S/C18H20N2O2/c21-18(17-9-5-15-22-17)20-13-11-19(12-14-20)10-4-8-16-6-2-1-3-7-16/h1-9,15H,10-14H2/b8-4+	LLPGQOJUSXJAJH-XBXARRHUSA-N	O=C(N1CCN(C\C=C\c2ccccc2)CC1)c3occc3	BroadT	BRD-K69812950	BRD-K69812950-003-05-6	ChemDiv Inc.	6049-0999		Cl	O=C(N1CCN(C\C=C\c2ccccc2)CC1)c1ccco1.Cl	InChI=1S/C18H20N2O2.ClH/c21-18(17-9-5-15-22-17)20-13-11-19(12-14-20)10-4-8-16-6-2-1-3-7-16;/h1-9,15H,10-14H2;1H/b8-4+;	KSAHYYAXIYRGEQ-ZFXMFRGYSA-N	296.1524779							, 
MLS000590141	LSM-33034	SID17513361, BRD-K85646730	6401698	InChI=1S/C12H14N6/c1-3-18-9-5-4-7(2)6-8(9)10-11(18)14-12(15-13)17-16-10/h4-6H,3,13H2,1-2H3,(H,14,15,17)	UHLRVAPPLDUSOD-UHFFFAOYSA-N	CCn1c2ccc(C)cc2c3nnc(NN)nc13	BroadT	BRD-K85646730	BRD-K85646730-001-05-9	InterBioScreen Ltd.	STOCK3S-94045			CCn1c2ccc(C)cc2c2nnc(NN)nc12	InChI=1S/C12H14N6/c1-3-18-9-5-4-7(2)6-8(9)10-11(18)14-12(15-13)17-16-10/h4-6H,3,13H2,1-2H3,(H,14,15,17)	UHLRVAPPLDUSOD-UHFFFAOYSA-N	242.127994508							121591
MLS001007825	LSM-33035	SID24828195, BRD-A67565174	4877140	InChI=1S/C15H21NO3S/c1-4-11-5-7-12(8-6-11)14(17)16-13(9-10-20-3)15(18)19-2/h5-8,13H,4,9-10H2,1-3H3,(H,16,17)	VDOITQPDRSEOGY-UHFFFAOYSA-N	CCc1ccc(cc1)C(=O)NC(CCSC)C(=O)OC	BroadT	BRD-A67565174	BRD-A67565174-001-06-6	Enamine Ltd.	T5302675			CCc1ccc(cc1)C(=O)NC(CCSC)C(=O)OC	InChI=1S/C15H21NO3S/c1-4-11-5-7-12(8-6-11)14(17)16-13(9-10-20-3)15(18)19-2/h5-8,13H,4,9-10H2,1-3H3,(H,16,17)	VDOITQPDRSEOGY-UHFFFAOYSA-N	295.124214232							121592
MLS001167202	LSM-33036	SID29217396, SID51085271, BRD-A11614220	4294966	InChI=1S/C18H22N4O4S/c1-12-3-2-10-22(11-12)27(24,25)15-8-6-13(7-9-15)16(23)19-18-21-20-17(26-18)14-4-5-14/h6-9,12,14H,2-5,10-11H2,1H3,(H,19,21,23)	DMTOVZGFTXTIIC-UHFFFAOYSA-N	CC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C(=O)Nc3oc(nn3)C4CC4	BroadT	BRD-A11614220	BRD-A11614220-001-06-3	Life Chemicals Inc.	F0593-0067			CC1CCCN(C1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(o1)C1CC1	InChI=1S/C18H22N4O4S/c1-12-3-2-10-22(11-12)27(24,25)15-8-6-13(7-9-15)16(23)19-18-21-20-17(26-18)14-4-5-14/h6-9,12,14H,2-5,10-11H2,1H3,(H,19,21,23)	DMTOVZGFTXTIIC-UHFFFAOYSA-N	390.136175914							121593
MLS000052569	LSM-33037	SID103023221, SID4258745, BRD-K24023169	1713063	InChI=1S/C14H11N7O3S2/c1-23-13(22)10-8(21(20-17-10)12-11(15)18-24-19-12)6-25-14-16-7-4-2-3-5-9(7)26-14/h2-5H,6H2,1H3,(H2,15,18)	ZKGKCBNHBDJDRP-UHFFFAOYSA-N	COC(=O)c1nnn(c1CSc2nc3ccccc3s2)c4nonc4N	BroadT	BRD-K24023169	BRD-K24023169-001-07-1	ChemBridge Corporation	7974256			COC(=O)c1nnn(c1CSc1nc2ccccc2s1)-c1nonc1N	InChI=1S/C14H11N7O3S2/c1-23-13(22)10-8(21(20-17-10)12-11(15)18-24-19-12)6-25-14-16-7-4-2-3-5-9(7)26-14/h2-5H,6H2,1H3,(H2,15,18)	ZKGKCBNHBDJDRP-UHFFFAOYSA-N	389.036478662							121594
SMR000295785	LSM-33038	SID24795337, BRD-K14858891	2969869	InChI=1S/C25H31N9O2/c1-4-33-13-15-34(16-14-33)25-31-23(28-21-9-5-19(6-10-21)26-17(2)35)30-24(32-25)29-22-11-7-20(8-12-22)27-18(3)36/h5-12H,4,13-16H2,1-3H3,(H,26,35)(H,27,36)(H2,28,29,30,31,32)	DKNFDAXWMOSUTI-UHFFFAOYSA-N	CCN1CCN(CC1)c2nc(Nc3ccc(NC(=O)C)cc3)nc(Nc4ccc(NC(=O)C)cc4)n2	BroadT	BRD-K14858891	BRD-K14858891-001-05-1	ChemBridge Corporation	7941807			CCN1CCN(CC1)c1nc(Nc2ccc(NC(C)=O)cc2)nc(Nc2ccc(NC(C)=O)cc2)n1	InChI=1S/C25H31N9O2/c1-4-33-13-15-34(16-14-33)25-31-23(28-21-9-5-19(6-10-21)26-17(2)35)30-24(32-25)29-22-11-7-20(8-12-22)27-18(3)36/h5-12H,4,13-16H2,1-3H3,(H,26,35)(H,27,36)(H2,28,29,30,31,32)	DKNFDAXWMOSUTI-UHFFFAOYSA-N	489.260071322							121595
4-(3-Methyl-isoxazol-5-yl)-5-phenyl-cyclohexane-1,3-dione	LSM-33039	SID851128, BRD-A27997471	653689	InChI=1S/C16H15NO3/c1-10-7-15(20-17-10)16-13(8-12(18)9-14(16)19)11-5-3-2-4-6-11/h2-7,13,16H,8-9H2,1H3	GZGDWGHQWNZRJL-UHFFFAOYSA-N	Cc1cc(on1)C2C(CC(=O)CC2=O)c3ccccc3	BroadT	BRD-A27997471	BRD-A27997471-001-06-0	Asinex Ltd.	BAS 00701535			Cc1cc(on1)C1C(CC(=O)CC1=O)c1ccccc1	InChI=1S/C16H15NO3/c1-10-7-15(20-17-10)16-13(8-12(18)9-14(16)19)11-5-3-2-4-6-11/h2-7,13,16H,8-9H2,1H3	GZGDWGHQWNZRJL-UHFFFAOYSA-N	269.10519335							121596
MLS000724572	LSM-33040	SID17514867, BRD-K87511180	5080687	InChI=1S/C24H25N3O2S/c1-17-21(22-10-3-4-11-23(22)25-17)12-13-27(16-20-9-6-14-29-20)24(30)26-18-7-5-8-19(15-18)28-2/h3-11,14-15,25H,12-13,16H2,1-2H3,(H,26,30)	LGPSGVUVTSJALL-UHFFFAOYSA-N	COc1cccc(NC(=S)N(CCc2c(C)[nH]c3ccccc23)Cc4occc4)c1	BroadT	BRD-K87511180	BRD-K87511180-001-04-1	Life Chemicals Inc.	F0633-0131			COc1cccc(NC(=S)N(CCc2c(C)[nH]c3ccccc23)Cc2ccco2)c1	InChI=1S/C24H25N3O2S/c1-17-21(22-10-3-4-11-23(22)25-17)12-13-27(16-20-9-6-14-29-20)24(30)26-18-7-5-8-19(15-18)28-2/h3-11,14-15,25H,12-13,16H2,1-2H3,(H,26,30)	LGPSGVUVTSJALL-UHFFFAOYSA-N	419.16674776							121597
MLS-0435432.0001	LSM-4242	BRD-K99582188, SID87544526, SID99495702	8056691	InChI=1S/C22H21ClN6/c23-18-8-6-17(7-9-18)15-29-22-20(14-26-29)21(24-16-25-22)28-12-10-27(11-13-28)19-4-2-1-3-5-19/h1-9,14,16H,10-13,15H2	UKHXPLGNOGAENT-UHFFFAOYSA-N	Clc1ccc(Cn2ncc3c(ncnc23)N4CCN(CC4)c5ccccc5)cc1	BroadT	BRD-K99582188	BRD-K99582188-001-01-6	Sanford-Burnham Medical Research Institute	MLS-0435432			Clc1ccc(Cn2ncc3c(ncnc23)N2CCN(CC2)c2ccccc2)cc1	InChI=1S/C22H21ClN6/c23-18-8-6-17(7-9-18)15-29-22-20(14-26-29)21(24-16-25-22)28-12-10-27(11-13-28)19-4-2-1-3-5-19/h1-9,14,16H,10-13,15H2	UKHXPLGNOGAENT-UHFFFAOYSA-N	404.151622442							93743
AB-323/25048475	LSM-15512	BRD-A12381334	4592566	InChI=1S/C22H32N6O2/c1-4-5-6-7-8-9-12-27-13-10-11-17(14-27)21(30)28-16(3)15(2)24-19-18(28)20(29)26-22(23)25-19/h10-11,13-16H,4-9,12H2,1-3H3,(H3-,23,24,25,26,29)/p+1	INZXOUIJUWOAQI-UHFFFAOYSA-O	CCCCCCCC[n+]1cccc(c1)C(=O)N2C(C)C(C)Nc3nc(N)nc(O)c23	BroadT	BRD-A12381334	BRD-A12381334-005-05-4	Specs	AB-323/25048475		I	CCCCCCCC[n+]1cccc(c1)C(=O)N1C(C)C(C)Nc2nc(N)nc(O)c12.I	InChI=1S/C22H32N6O2.HI/c1-4-5-6-7-8-9-12-27-13-10-11-17(14-27)21(30)28-16(3)15(2)24-19-18(28)20(29)26-22(23)25-19;/h10-11,13-16H,4-9,12H2,1-3H3,(H3-,23,24,25,26,29);1H/p+1	QTGYNQBDXIEPHR-UHFFFAOYSA-O	413.266499356							104153, 104153
2-(6-Bromo-quinazolin-4-ylamino)-4-methylsulfanyl-butyric acid	LSM-15467	BRD-A52524838	655842	InChI=1S/C13H14BrN3O2S/c1-20-5-4-11(13(18)19)17-12-9-6-8(14)2-3-10(9)15-7-16-12/h2-3,6-7,11H,4-5H2,1H3,(H,18,19)(H,15,16,17)	IUHZVPMVQBUAIR-UHFFFAOYSA-N	CSCCC(Nc1ncnc2ccc(Br)cc12)C(=O)O	BroadT	BRD-A52524838	BRD-A52524838-003-06-4	Asinex Ltd.	BAS 02168886		Cl	CSCCC(Nc1ncnc2ccc(Br)cc12)C(O)=O.Cl	InChI=1S/C13H14BrN3O2S.ClH/c1-20-5-4-11(13(18)19)17-12-9-6-8(14)2-3-10(9)15-7-16-12;/h2-3,6-7,11H,4-5H2,1H3,(H,18,19)(H,15,16,17);1H	ARVBNOYTORBXAN-UHFFFAOYSA-N	354.999010008							104109, 104109
N-[3-Chloro-4-(isopropylsulfonyl)-2-thienyl]-n'-(3-nitrophenyl)urea	LSM-33041	SID26728650, BRD-K44059833	2820009	InChI=1S/C14H14ClN3O5S2/c1-8(2)25(22,23)11-7-24-13(12(11)15)17-14(19)16-9-4-3-5-10(6-9)18(20)21/h3-8H,1-2H3,(H2,16,17,19)	GADNKVJBROSOAU-UHFFFAOYSA-N	CC(C)S(=O)(=O)c1csc(NC(=O)Nc2cccc(c2)[N+](=O)[O-])c1Cl	BroadT	BRD-K44059833	BRD-K44059833-001-05-1	Maybridge	KM 03246			CC(C)S(=O)(=O)c1csc(NC(=O)Nc2cccc(c2)[N+]([O-])=O)c1Cl	InChI=1S/C14H14ClN3O5S2/c1-8(2)25(22,23)11-7-24-13(12(11)15)17-14(19)16-9-4-3-5-10(6-9)18(20)21/h3-8H,1-2H3,(H2,16,17,19)	GADNKVJBROSOAU-UHFFFAOYSA-N	403.006339668							121598
5-(2,4-Dichloro-phenoxymethyl)-4-phenyl-4H-[1,2,4]triazole-3-thiol	LSM-33042	SID49642711, BRD-K56631443	986207	InChI=1S/C15H11Cl2N3OS/c16-10-6-7-13(12(17)8-10)21-9-14-18-19-15(22)20(14)11-4-2-1-3-5-11/h1-8H,9H2,(H,19,22)	MGYBOASQYQNJPU-UHFFFAOYSA-N	Sc1nnc(COc2ccc(Cl)cc2Cl)n1c3ccccc3	BroadT	BRD-K56631443	BRD-K56631443-001-06-2	Asinex Ltd.	BAS 00898755			Sc1nnc(COc2ccc(Cl)cc2Cl)n1-c1ccccc1	InChI=1S/C15H11Cl2N3OS/c16-10-6-7-13(12(17)8-10)21-9-14-18-19-15(22)20(14)11-4-2-1-3-5-11/h1-8H,9H2,(H,19,22)	MGYBOASQYQNJPU-UHFFFAOYSA-N	350.999988112							121599
ZINC00996553	LSM-33043	SID859054, BRD-K74727561	660359	InChI=1S/C15H16ClN3O3S/c1-19-7-9(16)12(18-19)13(20)17-14-11(15(21)22-2)8-5-3-4-6-10(8)23-14/h7H,3-6H2,1-2H3,(H,17,20)	VXGYSHUXSLXNGW-UHFFFAOYSA-N	COC(=O)c1c2CCCCc2sc1NC(=O)c3nn(C)cc3Cl	BroadT	BRD-K74727561	BRD-K74727561-001-05-4	InterBioScreen Ltd.	STOCK2S-87738			COC(=O)c1c(NC(=O)c2nn(C)cc2Cl)sc2CCCCc12	InChI=1S/C15H16ClN3O3S/c1-19-7-9(16)12(18-19)13(20)17-14-11(15(21)22-2)8-5-3-4-6-10(8)23-14/h7H,3-6H2,1-2H3,(H,17,20)	VXGYSHUXSLXNGW-UHFFFAOYSA-N	353.060089802							121600
AC1MMUOF	LSM-33044	SID4250961, BRD-K56886042	3244706	InChI=1S/C13H7Cl2N3OS/c14-7-1-2-8(10(15)5-7)11-9(6-16)12(19)18-3-4-20-13(18)17-11/h1-2,5H,3-4H2	WMSFKHMQPWDNKG-UHFFFAOYSA-N	Clc1ccc(C2=C(C#N)C(=O)N3CCSC3=N2)c(Cl)c1	BroadT	BRD-K56886042	BRD-K56886042-001-05-9	ChemDiv Inc.	6220-1204			Clc1ccc(c(Cl)c1)-c1nc2SCCn2c(=O)c1C#N	InChI=1S/C13H7Cl2N3OS/c14-7-1-2-8(10(15)5-7)11-9(6-16)12(19)18-3-4-20-13(18)17-11/h1-2,5H,3-4H2	WMSFKHMQPWDNKG-UHFFFAOYSA-N	322.968687984							121601
AK-968/41924508	LSM-33045	SID17387684, BRD-A36245464	3430262	InChI=1S/C15H21N3S2/c1-3-4-7-18-14(16-17-15(18)19)12-9-20-13-8-10(2)5-6-11(12)13/h9-10H,3-8H2,1-2H3,(H,17,19)	QKXHMCGQQAEFLP-UHFFFAOYSA-N	CCCCn1c(S)nnc1c2csc3CC(C)CCc23	BroadT	BRD-A36245464	BRD-A36245464-001-05-4	Specs	AK-968/41924508			CCCCn1c(S)nnc1-c1csc2CC(C)CCc12	InChI=1S/C15H21N3S2/c1-3-4-7-18-14(16-17-15(18)19)12-9-20-13-8-10(2)5-6-11(12)13/h9-10H,3-8H2,1-2H3,(H,17,19)	QKXHMCGQQAEFLP-UHFFFAOYSA-N	307.117689082							121602
SMR000104569	LSM-33046	SID7977074, BRD-A83875254	2872643	InChI=1S/C17H16ClN3O2/c1-10-6-7-11(8-12(10)18)19-16(22)9-15-17(23)21-14-5-3-2-4-13(14)20-15/h2-8,15,20H,9H2,1H3,(H,19,22)(H,21,23)	XFZIRHXRSGOHFQ-UHFFFAOYSA-N	Cc1ccc(NC(=O)CC2Nc3ccccc3NC2=O)cc1Cl	BroadT	BRD-A83875254	BRD-A83875254-001-03-9	ChemBridge Corporation	5850968			Cc1ccc(NC(=O)CC2Nc3ccccc3NC2=O)cc1Cl	InChI=1S/C17H16ClN3O2/c1-10-6-7-11(8-12(10)18)19-16(22)9-15-17(23)21-14-5-3-2-4-13(14)20-15/h2-8,15,20H,9H2,1H3,(H,19,22)(H,21,23)	XFZIRHXRSGOHFQ-UHFFFAOYSA-N	329.093104492							121603
MLS000729518	LSM-33047	BRD-K53458780, SID24810249	3482999	InChI=1S/C18H15N3O2/c1-22-15-5-3-4-14(9-15)20-18-13(11-19)8-12-6-7-16(23-2)10-17(12)21-18/h3-10H,1-2H3,(H,20,21)	FALPIUAALRVQIS-UHFFFAOYSA-N	COc1cccc(Nc2nc3cc(OC)ccc3cc2C#N)c1	BroadT	BRD-K53458780	BRD-K53458780-001-05-6	ChemDiv Inc.	C066-2824			COc1cccc(Nc2nc3cc(OC)ccc3cc2C#N)c1	InChI=1S/C18H15N3O2/c1-22-15-5-3-4-14(9-15)20-18-13(11-19)8-12-6-7-16(23-2)10-17(12)21-18/h3-10H,1-2H3,(H,20,21)	FALPIUAALRVQIS-UHFFFAOYSA-N	305.11642675							121604
AC1MVQRF	LSM-33048	BRD-A70099008, SID26666014	3737168	InChI=1S/C25H31N2O2P/c1-5-19-29-30(28,24-17-15-23(16-18-24)27(3)4)25(21-13-11-20(2)12-14-21)26-22-9-7-6-8-10-22/h6-18,25-26H,5,19H2,1-4H3	PXBLKWLLBSFBBD-UHFFFAOYSA-N	CCCOP(=O)(C(Nc1ccccc1)c2ccc(C)cc2)c3ccc(cc3)N(C)C	BroadT	BRD-A70099008	BRD-A70099008-001-06-3	InterBioScreen Ltd.	STOCK4S-18028			CCCOP(=O)(C(Nc1ccccc1)c1ccc(C)cc1)c1ccc(cc1)N(C)C	InChI=1S/C25H31N2O2P/c1-5-19-29-30(28,24-17-15-23(16-18-24)27(3)4)25(21-13-11-20(2)12-14-21)26-22-9-7-6-8-10-22/h6-18,25-26H,5,19H2,1-4H3	PXBLKWLLBSFBBD-UHFFFAOYSA-N	422.212314762							121605
T5737372	LSM-33049	BRD-K45714931, SID22409665	2487709	InChI=1S/C20H14ClN3O3S/c1-2-9-23-19(27)15-10-12(21)7-8-16(15)22-20(23)28-11-24-17(25)13-5-3-4-6-14(13)18(24)26/h2-8,10H,1,9,11H2	WUWFPTBGJDWSIG-UHFFFAOYSA-N	Clc1ccc2N=C(SCN3C(=O)c4ccccc4C3=O)N(CC=C)C(=O)c2c1	BroadT	BRD-K45714931	BRD-K45714931-001-06-9	Enamine Ltd.	ZU-0921543			Clc1ccc2nc(SCN3C(=O)c4ccccc4C3=O)n(CC=C)c(=O)c2c1	InChI=1S/C20H14ClN3O3S/c1-2-9-23-19(27)15-10-12(21)7-8-16(15)22-20(23)28-11-24-17(25)13-5-3-4-6-14(13)18(24)26/h2-8,10H,1,9,11H2	WUWFPTBGJDWSIG-UHFFFAOYSA-N	411.044439738							121606
1-{2-[2-(2,3-Dihydro-1H-inden-5-yloxy)ethoxy]ethyl}-1H-1,2,4-triazole	LSM-33050	BRD-K55795421, SID4263125	2199754	InChI=1S/C15H19N3O2/c1-2-13-4-5-15(10-14(13)3-1)20-9-8-19-7-6-18-12-16-11-17-18/h4-5,10-12H,1-3,6-9H2	YRSGXVHTUIVZIX-UHFFFAOYSA-N	C(COc1ccc2CCCc2c1)OCCn3cncn3	BroadT	BRD-K55795421	BRD-K55795421-001-05-4	ChemBridge Corporation	7711147			C(COc1ccc2CCCc2c1)OCCn1cncn1	InChI=1S/C15H19N3O2/c1-2-13-4-5-15(10-14(13)3-1)20-9-8-19-7-6-18-12-16-11-17-18/h4-5,10-12H,1-3,6-9H2	YRSGXVHTUIVZIX-UHFFFAOYSA-N	273.147726878							121607
5-Benzyl-1-ethyl-1,3,5-triazinane-2-thione	LSM-33051	SID22416479, BRD-K56034970	686867	InChI=1S/C12H17N3S/c1-2-15-10-14(9-13-12(15)16)8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,13,16)	OXOCBHPYFBVZDH-UHFFFAOYSA-N	CCN1CN(Cc2ccccc2)CN=C1S	BroadT	BRD-K56034970	BRD-K56034970-001-05-2	ChemBridge Corporation	7239441			CCN1CN(Cc2ccccc2)CN=C1S	InChI=1S/C12H17N3S/c1-2-15-10-14(9-13-12(15)16)8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,13,16)	OXOCBHPYFBVZDH-UHFFFAOYSA-N	235.114318264							121608
BAS 01812943	LSM-33052	BRD-A84923154, SID24806600	3133121	InChI=1S/C20H22N2O3/c21-13-16-1-3-17(4-2-16)18-5-7-20(8-6-18)25-15-19(23)14-22-9-11-24-12-10-22/h1-8,19,23H,9-12,14-15H2	WQKZIQOVSHBBLN-UHFFFAOYSA-N	OC(COc1ccc(cc1)c2ccc(cc2)C#N)CN3CCOCC3	BroadT	BRD-A84923154	BRD-A84923154-001-05-2	Asinex Ltd.	BAS 01812943			OC(COc1ccc(cc1)-c1ccc(cc1)C#N)CN1CCOCC1	InChI=1S/C20H22N2O3/c21-13-16-1-3-17(4-2-16)18-5-7-20(8-6-18)25-15-19(23)14-22-9-11-24-12-10-22/h1-8,19,23H,9-12,14-15H2	WQKZIQOVSHBBLN-UHFFFAOYSA-N	338.163042584							121609
MLS000523047	LSM-33053	BRD-K09528868, SID17402073	11957283	InChI=1S/C22H23N3O5S/c26-21(24-13-10-16-6-2-3-7-18(16)24)15-25-19-9-8-17(14-20(19)30-22(25)27)31(28,29)23-11-4-1-5-12-23/h2-3,6-9,14H,1,4-5,10-13,15H2	XTYGCXBGTXKREP-UHFFFAOYSA-N	O=C(CN1C(=O)Oc2cc(ccc12)S(=O)(=O)N3CCCCC3)N4CCc5ccccc45	BroadT	BRD-K09528868	BRD-K09528868-001-04-9	ChemDiv Inc.	C732-0048			O=C(Cn1c2ccc(cc2oc1=O)S(=O)(=O)N1CCCCC1)N1CCc2ccccc12	InChI=1S/C22H23N3O5S/c26-21(24-13-10-16-6-2-3-7-18(16)24)15-25-19-9-8-17(14-20(19)30-22(25)27)31(28,29)23-11-4-1-5-12-23/h2-3,6-9,14H,1,4-5,10-13,15H2	XTYGCXBGTXKREP-UHFFFAOYSA-N	441.135841556							121610
F1651-0080	LSM-33054	BRD-K56441027, SID14738960	1248982	InChI=1S/C17H21N3O4S/c1-13-6-7-14(17(21)18-16-8-11-24-19-16)12-15(13)25(22,23)20-9-4-2-3-5-10-20/h6-8,11-12H,2-5,9-10H2,1H3,(H,18,19,21)	URLWCISXVCUWNU-UHFFFAOYSA-N	Cc1ccc(cc1S(=O)(=O)N2CCCCCC2)C(=O)Nc3ccon3	BroadT	BRD-K56441027	BRD-K56441027-001-05-2	ChemBridge Corporation	7912076			Cc1ccc(cc1S(=O)(=O)N1CCCCCC1)C(=O)Nc1ccon1	InChI=1S/C17H21N3O4S/c1-13-6-7-14(17(21)18-16-8-11-24-19-16)12-15(13)25(22,23)20-9-4-2-3-5-10-20/h6-8,11-12H,2-5,9-10H2,1H3,(H,18,19,21)	URLWCISXVCUWNU-UHFFFAOYSA-N	363.125276872							121611
MLS000834536	LSM-33055	BRD-K25645002, SID24779709	16187125	InChI=1S/C31H36N2O6S/c1-2-36-31-23(7-5-15-34)24(25-19-40-29-8-4-3-6-22(25)29)17-28(39-31)30(35)33-13-11-32(12-14-33)18-21-9-10-26-27(16-21)38-20-37-26/h3-4,6,8-10,16-17,19,23-24,31,34H,2,5,7,11-15,18,20H2,1H3/t23-,24+,31-/m0/s1	HMWUPEBWYBVNQB-JLELKNTQSA-N	CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2csc3ccccc23)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4	BroadT	BRD-K25645002	BRD-K25645002-001-07-1	Harvard University	((2S,3S,4R)-4-(benzo[b]thiophen-3-yl)-2-ethoxy-3-(3-hydroxypropyl)-3,4-dihydro-2H-pyran-6-yl)(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)methanone DHPC11_001302			CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c1csc2ccccc12)C(=O)N1CCN(Cc2ccc3OCOc3c2)CC1	InChI=1S/C31H36N2O6S/c1-2-36-31-23(7-5-15-34)24(25-19-40-29-8-4-3-6-22(25)29)17-28(39-31)30(35)33-13-11-32(12-14-33)18-21-9-10-26-27(16-21)38-20-37-26/h3-4,6,8-10,16-17,19,23-24,31,34H,2,5,7,11-15,18,20H2,1H3/t23-,24+,31-/m0/s1	HMWUPEBWYBVNQB-JLELKNTQSA-N	564.229407582							121612
BRD-K73859343	LSM-44453		12005032	InChI=1S/C22H18N4O2/c1-15(11-19-7-4-10-28-19)14-23-26-22(27)21-13-20(24-25-21)18-9-8-16-5-2-3-6-17(16)12-18/h2-14H,1H3,(H,24,25)(H,26,27)/b15-11+,23-14?	POPNZZMVWVZWBW-PYHDBHTKSA-N	C\C(=C/c1occc1)\C=NNC(=O)c2cc([nH]n2)c3ccc4ccccc4c3	BroadT	BRD-K73859343	BRD-K73859343-001-05-1	ChemDiv Inc.	3254-3285			C\C(C=NNC(=O)c1cc([nH]n1)-c1ccc2ccccc2c1)=C/c1ccco1	InChI=1S/C22H18N4O2/c1-15(11-19-7-4-10-28-19)14-23-26-22(27)21-13-20(24-25-21)18-9-8-16-5-2-3-6-17(16)12-18/h2-14H,1H3,(H,24,25)(H,26,27)/b15-11+,23-14?	POPNZZMVWVZWBW-PYHDBHTKSA-N	370.142975856							
MLS000849636	LSM-33057	BRD-A79316179, SID26725205	16745500	InChI=1S/C17H21N3O/c1-2-6-13(7-3-1)20-16-12(11-21-20)10-19-15-9-5-4-8-14(15)18-17(16)19/h4-5,8-9,12-13,16H,1-3,6-7,10-11H2	MDTQCJOKEKYTAL-UHFFFAOYSA-N	C1CCC(CC1)N2OCC3Cn4c(nc5ccccc45)C23	BroadT	BRD-A79316179	BRD-A79316179-001-05-7	University of California at Davis	LP001004			C1ON(C2C1Cn1c2nc2ccccc12)C1CCCCC1	InChI=1S/C17H21N3O/c1-2-6-13(7-3-1)20-16-12(11-21-20)10-19-15-9-5-4-8-14(15)18-17(16)19/h4-5,8-9,12-13,16H,1-3,6-7,10-11H2	MDTQCJOKEKYTAL-UHFFFAOYSA-N	283.168462322							121614
MLS000389580	LSM-44454	BRD-K63568016, SID22409079	15945296	InChI=1S/C28H27N3O3S/c1-33-24-6-4-5-20(18-24)17-21(28-30-25-7-2-3-8-26(25)35-28)19-27(32)29-22-9-11-23(12-10-22)31-13-15-34-16-14-31/h2-12,17-18H,13-16,19H2,1H3,(H,29,32)/b21-17-	BBRZYKRLSUTSMP-FXBPSFAMSA-N	COc1cccc(\C=C(\CC(=O)Nc2ccc(cc2)N3CCOCC3)/c4nc5ccccc5s4)c1	BroadT	BRD-K63568016	BRD-K63568016-001-05-6	Enamine Ltd.	T5216503			COc1cccc(\C=C(\CC(=O)Nc2ccc(cc2)N2CCOCC2)c2nc3ccccc3s2)c1	InChI=1S/C28H27N3O3S/c1-33-24-6-4-5-20(18-24)17-21(28-30-25-7-2-3-8-26(25)35-28)19-27(32)29-22-9-11-23(12-10-22)31-13-15-34-16-14-31/h2-12,17-18H,13-16,19H2,1H3,(H,29,32)/b21-17-	BBRZYKRLSUTSMP-FXBPSFAMSA-N	485.177312444							
MLS000325253	LSM-33059	SID17401154, BRD-K78192025	6401469	InChI=1S/C13H9Cl2N5/c14-10-2-1-9(7-11(10)15)17-12-3-4-13(19-18-12)20-6-5-16-8-20/h1-8H,(H,17,18)	CENQALGCQDZJLK-UHFFFAOYSA-N	Clc1ccc(Nc2ccc(nn2)n3ccnc3)cc1Cl	BroadT	BRD-K78192025	BRD-K78192025-001-05-7	Specs	AQ-432/42260218			Clc1ccc(Nc2ccc(nn2)-n2ccnc2)cc1Cl	InChI=1S/C13H9Cl2N5/c14-10-2-1-9(7-11(10)15)17-12-3-4-13(19-18-12)20-6-5-16-8-20/h1-8H,(H,17,18)	CENQALGCQDZJLK-UHFFFAOYSA-N	305.023500758							121616
T0507-7320	LSM-33060	BRD-K40222892, SID16952655	2343832	InChI=1S/C22H20ClN3O3S/c1-28-18-8-5-14(9-19(18)29-2)16-12-30-22(25-16)20-17(27)11-26(21(20)24)10-13-3-6-15(23)7-4-13/h3-9,12H,10-11,24H2,1-2H3	COLZYMFYUKUCRH-UHFFFAOYSA-N	COc1ccc(cc1OC)c2csc(n2)C3=C(N)N(Cc4ccc(Cl)cc4)CC3=O	BroadT	BRD-K40222892	BRD-K40222892-001-06-5	Enamine Ltd.	T0507-7320			COc1ccc(cc1OC)-c1csc(n1)C1=C(N)N(Cc2ccc(Cl)cc2)CC1=O	InChI=1S/C22H20ClN3O3S/c1-28-18-8-5-14(9-19(18)29-2)16-12-30-22(25-16)20-17(27)11-26(21(20)24)10-13-3-6-15(23)7-4-13/h3-9,12H,10-11,24H2,1-2H3	COLZYMFYUKUCRH-UHFFFAOYSA-N	441.09138993							121617
AC1MG9U0	LSM-33061	BRD-K84518331, SID22413141	2932630	InChI=1S/C17H19N5O3/c23-17(19-16-3-1-2-8-18-16)13-20-9-11-21(12-10-20)14-4-6-15(7-5-14)22(24)25/h1-8H,9-13H2,(H,18,19,23)	JLUXAQQYENDYCX-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)N2CCN(CC(=O)Nc3ccccn3)CC2	BroadT	BRD-K84518331	BRD-K84518331-001-05-4	Specs	AG-205/36915004			[O-][N+](=O)c1ccc(cc1)N1CCN(CC(=O)Nc2ccccn2)CC1	InChI=1S/C17H19N5O3/c23-17(19-16-3-1-2-8-18-16)13-20-9-11-21(12-10-20)14-4-6-15(7-5-14)22(24)25/h1-8H,9-13H2,(H,18,19,23)	JLUXAQQYENDYCX-UHFFFAOYSA-N	341.148789518							121618
SMR000206182	LSM-33062	BRD-K26634627, SID17509413	4448498	InChI=1S/C22H14ClFN4O3S/c1-12-2-4-15(9-16(12)24)28-21(30)20-17(6-7-32-20)26(22(28)31)11-14-8-19(29)27-10-13(23)3-5-18(27)25-14/h2-10H,11H2,1H3	JLQUIXNDPZUYKC-UHFFFAOYSA-N	Cc1ccc(cc1F)N2C(=O)N(CC3=CC(=O)N4C=C(Cl)C=CC4=N3)c5ccsc5C2=O	BroadT	BRD-K26634627	BRD-K26634627-001-05-3	ChemDiv Inc.	C241-1066			Cc1ccc(cc1F)-n1c(=O)n(Cc2cc(=O)n3cc(Cl)ccc3n2)c2ccsc2c1=O	InChI=1S/C22H14ClFN4O3S/c1-12-2-4-15(9-16(12)24)28-21(30)20-17(6-7-32-20)26(22(28)31)11-14-8-19(29)27-10-13(23)3-5-18(27)25-14/h2-10H,11H2,1H3	JLQUIXNDPZUYKC-UHFFFAOYSA-N	468.045916948							121619
SMR000068332	LSM-33063	BRD-K28656917, SID24839805, SID3711301	2549017	InChI=1S/C25H29N5O4/c1-34-14-13-29(21(31)17-28-12-11-19-9-5-6-10-20(19)16-28)22-23(26)30(25(33)27-24(22)32)15-18-7-3-2-4-8-18/h2-10H,11-17,26H2,1H3,(H,27,32,33)	NHZMLDURHLMAFJ-UHFFFAOYSA-N	COCCN(C(=O)CN1CCc2ccccc2C1)C3=C(N)N(Cc4ccccc4)C(=O)NC3=O	BroadT	BRD-K28656917	BRD-K28656917-001-05-3	Enamine Ltd.	T5340339			COCCN(C(=O)CN1CCc2ccccc2C1)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O	InChI=1S/C25H29N5O4/c1-34-14-13-29(21(31)17-28-12-11-19-9-5-6-10-20(19)16-28)22-23(26)30(25(33)27-24(22)32)15-18-7-3-2-4-8-18/h2-10H,11-17,26H2,1H3,(H,27,32,33)	NHZMLDURHLMAFJ-UHFFFAOYSA-N	463.221954458							121620
ZINC02859229	LSM-33064	BRD-K26976202, SID24791980	2212587	InChI=1S/C14H14BrN3O4S2/c1-18(2)24(20,21)10-5-3-9(4-6-10)16-14(23)17-13(19)11-7-8-12(15)22-11/h3-8H,1-2H3,(H2,16,17,19,23)	SKWQYBPXQMMELA-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)c2oc(Br)cc2)cc1	BroadT	BRD-K26976202	BRD-K26976202-001-03-6	ChemBridge Corporation	7844298			CN(C)S(=O)(=O)c1ccc(NC(=S)NC(=O)c2ccc(Br)o2)cc1	InChI=1S/C14H14BrN3O4S2/c1-18(2)24(20,21)10-5-3-9(4-6-10)16-14(23)17-13(19)11-7-8-12(15)22-11/h3-8H,1-2H3,(H2,16,17,19,23)	SKWQYBPXQMMELA-UHFFFAOYSA-N	430.960909938							121621
ST50918409	LSM-33065	SID7977399, BRD-K89770910	841629	InChI=1S/C13H11NO4/c1-8-2-4-11(18-8)13(15)14-9-3-5-10-12(6-9)17-7-16-10/h2-6H,7H2,1H3,(H,14,15)	XFEPFYBCGILMAN-UHFFFAOYSA-N	Cc1oc(cc1)C(=O)Nc2ccc3OCOc3c2	BroadT	BRD-K89770910	BRD-K89770910-001-05-5	ChemBridge Corporation	6101633			Cc1ccc(o1)C(=O)Nc1ccc2OCOc2c1	InChI=1S/C13H11NO4/c1-8-2-4-11(18-8)13(15)14-9-3-5-10-12(6-9)17-7-16-10/h2-6H,7H2,1H3,(H,14,15)	XFEPFYBCGILMAN-UHFFFAOYSA-N	245.068807842							121622
MLS000332784	LSM-33066	BRD-K48092898	3344442	InChI=1S/C25H26N4O6/c1-4-33-13-8-12-28-21-17(24(31)29-11-6-9-16(3)20(29)26-21)15-18(25(32)34-5-2)22(28)27-23(30)19-10-7-14-35-19/h6-7,9-11,14-15H,4-5,8,12-13H2,1-3H3	LKERLDLDUBRVAF-UHFFFAOYSA-N	CCOCCCN1C2=C(C=C(C(=O)OCC)C1=NC(=O)c3occc3)C(=O)N4C=CC=C(C)C4=N2	BroadT	BRD-K48092898	BRD-K48092898-001-05-0	InterBioScreen Ltd.	STOCK4S-37144			CCOCCCn1c2nc3c(C)cccn3c(=O)c2cc(C(=O)OCC)c1=NC(=O)c1ccco1	InChI=1S/C25H26N4O6/c1-4-33-13-8-12-28-21-17(24(31)29-11-6-9-16(3)20(29)26-21)15-18(25(32)34-5-2)22(28)27-23(30)19-10-7-14-35-19/h6-7,9-11,14-15H,4-5,8,12-13H2,1-3H3	LKERLDLDUBRVAF-UHFFFAOYSA-N	478.185234592							121623
AC1O9U0E	LSM-33067	BRD-K39815998, SID14741292	6772250	InChI=1S/C21H23N3O4/c1-13-4-6-18(25)15(10-13)16-12-17(24-23-16)21(26)22-9-8-14-5-7-19(27-2)20(11-14)28-3/h4-7,10-12,25H,8-9H2,1-3H3,(H,22,26)(H,23,24)	WYVVTERDMSPFBI-UHFFFAOYSA-N	COc1ccc(CCNC(=O)c2cc([nH]n2)c3cc(C)ccc3O)cc1OC	BroadT	BRD-K39815998	BRD-K39815998-001-06-2	InterBioScreen Ltd.	STOCK5S-45365			COc1ccc(CCNC(=O)c2cc([nH]n2)-c2cc(C)ccc2O)cc1OC	InChI=1S/C21H23N3O4/c1-13-4-6-18(25)15(10-13)16-12-17(24-23-16)21(26)22-9-8-14-5-7-19(27-2)20(11-14)28-3/h4-7,10-12,25H,8-9H2,1-3H3,(H,22,26)(H,23,24)	WYVVTERDMSPFBI-UHFFFAOYSA-N	381.168856246							
MLS000068397	LSM-33068	BRD-K61533770, SID849229	651707	InChI=1S/C16H18N4O2/c1-2-3-6-15(21)20-14-8-7-13(11-18-14)19-16(22)12-5-4-9-17-10-12/h4-5,7-11H,2-3,6H2,1H3,(H,19,22)(H,18,20,21)	VOYWEJBMBPOLPO-UHFFFAOYSA-N	CCCCC(=O)Nc1ccc(NC(=O)c2cccnc2)cn1	BroadT	BRD-K61533770	BRD-K61533770-001-05-8	Asinex Ltd.	ASN 05804104			CCCCC(=O)Nc1ccc(NC(=O)c2cccnc2)cn1	InChI=1S/C16H18N4O2/c1-2-3-6-15(21)20-14-8-7-13(11-18-14)19-16(22)12-5-4-9-17-10-12/h4-5,7-11H,2-3,6H2,1H3,(H,19,22)(H,18,20,21)	VOYWEJBMBPOLPO-UHFFFAOYSA-N	298.142975856							121625
AC1LIPKN	LSM-33069	BRD-K69396470	959530	InChI=1S/C18H21N3O4/c1-5-25-18(23)15-11(2)16(20-12(15)3)17(22)21-19-10-13-7-6-8-14(9-13)24-4/h6-10,20H,5H2,1-4H3,(H,21,22)	CKUKILNJBSKZBQ-UHFFFAOYSA-N	CCOC(=O)c1c(C)[nH]c(C(=O)NN=Cc2cccc(OC)c2)c1C	BroadT	BRD-K69396470	BRD-K69396470-001-05-5	Life Chemicals Inc.	F1583-0067			CCOC(=O)c1c(C)[nH]c(C(=O)NN=Cc2cccc(OC)c2)c1C	InChI=1S/C18H21N3O4/c1-5-25-18(23)15-11(2)16(20-12(15)3)17(22)21-19-10-13-7-6-8-14(9-13)24-4/h6-10,20H,5H2,1-4H3,(H,21,22)	CKUKILNJBSKZBQ-UHFFFAOYSA-N	343.153206182							121626
MLS000911906	LSM-33070	BRD-A46317335, SID26731929	16746128	InChI=1S/C20H16ClFN2OS/c1-12-18(26-19(23-12)13-6-8-15(21)9-7-13)20(2)11-17(24-25-20)14-4-3-5-16(22)10-14/h3-10H,11H2,1-2H3	RTHUBEBPNXGEJZ-UHFFFAOYSA-N	Cc1nc(sc1C2(C)CC(=NO2)c3cccc(F)c3)c4ccc(Cl)cc4	BroadT	BRD-A46317335	BRD-A46317335-001-05-6	University of California at Davis	KM-001-2-6			Cc1nc(sc1C1(C)CC(=NO1)c1cccc(F)c1)-c1ccc(Cl)cc1	InChI=1S/C20H16ClFN2OS/c1-12-18(26-19(23-12)13-6-8-15(21)9-7-13)20(2)11-17(24-25-20)14-4-3-5-16(22)10-14/h3-10H,11H2,1-2H3	RTHUBEBPNXGEJZ-UHFFFAOYSA-N	386.065589752							121627
ILP-IV-41	LSM-33071	BRD-K46239950, SID26732653	16746599	InChI=1S/C29H41N5O8/c1-8-40-25(37)18-12-14-19(15-13-18)33-23(35)21-22(32-17-31-21)24(36)34-20(26(38)41-28(2,3)4)11-9-10-16-30-27(39)42-29(5,6)7/h12-15,17,20H,8-11,16H2,1-7H3,(H,30,39)(H,31,32)(H,33,35)(H,34,36)/t20-/m0/s1	XIQFIGDBAIPLCI-FQEVSTJZSA-N	CCOC(=O)c1ccc(NC(=O)c2[nH]cnc2C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc1	BroadT	BRD-K46239950	BRD-K46239950-001-06-2	University of Tulsa	ILP-IV-41 AE10_AN06			CCOC(=O)c1ccc(NC(=O)c2[nH]cnc2C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc1	InChI=1S/C29H41N5O8/c1-8-40-25(37)18-12-14-19(15-13-18)33-23(35)21-22(32-17-31-21)24(36)34-20(26(38)41-28(2,3)4)11-9-10-16-30-27(39)42-29(5,6)7/h12-15,17,20H,8-11,16H2,1-7H3,(H,30,39)(H,31,32)(H,33,35)(H,34,36)/t20-/m0/s1	XIQFIGDBAIPLCI-FQEVSTJZSA-N	587.295513322							121628
1-[(2-Chloro-4-nitro-phenylcarbamoyl)-methyl]-3-methyl-pyridinium	LSM-15468	BRD-K58220038	3128676	InChI=1S/C14H12ClN3O3/c1-10-3-2-6-17(8-10)9-14(19)16-13-5-4-11(18(20)21)7-12(13)15/h2-8H,9H2,1H3/p+1	UGSNLUMKMRAPPZ-UHFFFAOYSA-O	Cc1ccc[n+](CC(=O)Nc2ccc(cc2Cl)[N+](=O)[O-])c1	BroadT	BRD-K58220038	BRD-K58220038-003-06-9	Asinex Ltd.	BAS 01248459		Cl	Cc1ccc[n+](CC(=O)Nc2ccc(cc2Cl)[N+]([O-])=O)c1.Cl	InChI=1S/C14H12ClN3O3.ClH/c1-10-3-2-6-17(8-10)9-14(19)16-13-5-4-11(18(20)21)7-12(13)15;/h2-8H,9H2,1H3;1H/p+1	UCIAWHGUQWZBJA-UHFFFAOYSA-O	306.064544016							104110, 104110
ZINC02645540	LSM-33072	BRD-K01452910, SID3717475	2108576	InChI=1S/C20H20N4O5S/c1-12-5-7-16-14(9-19(25)29-20(16)13(12)2)11-28-24-18-10-15(30(26,27)23(3)4)6-8-17(18)21-22-24/h5-10H,11H2,1-4H3	PPXUJBXRJOJKDM-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc2nnn(OCC3=CC(=O)Oc4c(C)c(C)ccc34)c2c1	BroadT	BRD-K01452910	BRD-K01452910-001-03-0	Enamine Ltd.	T5239337			CN(C)S(=O)(=O)c1ccc2nnn(OCc3cc(=O)oc4c(C)c(C)ccc34)c2c1	InChI=1S/C20H20N4O5S/c1-12-5-7-16-14(9-19(25)29-20(16)13(12)2)11-28-24-18-10-15(30(26,27)23(3)4)6-8-17(18)21-22-24/h5-10H,11H2,1-4H3	PPXUJBXRJOJKDM-UHFFFAOYSA-N	428.11544047							121629
SMR000198720	LSM-33073	SID17506617, BRD-K97624853	2193969	InChI=1S/C26H21N3O3S/c1-16-22-25(33-23(16)24(30)28-20-12-5-6-13-21(20)32-2)27-15-29(26(22)31)14-18-10-7-9-17-8-3-4-11-19(17)18/h3-13,15H,14H2,1-2H3,(H,28,30)	QYAGGNKNMUBSOE-UHFFFAOYSA-N	COc1ccccc1NC(=O)c2sc3N=CN(Cc4cccc5ccccc45)C(=O)c3c2C	BroadT	BRD-K97624853	BRD-K97624853-001-05-3	ChemBridge Corporation	7576338			COc1ccccc1NC(=O)c1sc2ncn(Cc3cccc4ccccc34)c(=O)c2c1C	InChI=1S/C26H21N3O3S/c1-16-22-25(33-23(16)24(30)28-20-12-5-6-13-21(20)32-2)27-15-29(26(22)31)14-18-10-7-9-17-8-3-4-11-19(17)18/h3-13,15H,14H2,1-2H3,(H,28,30)	QYAGGNKNMUBSOE-UHFFFAOYSA-N	455.130362252							121630
STK627272	LSM-33074	BRD-K31363949, SID852674	655309	InChI=1S/C20H25N3O/c1-23(2)13-16-21-18-15-9-5-4-8-14(15)12-20(10-6-3-7-11-20)17(18)19(24)22-16/h4-5,8-9H,3,6-7,10-13H2,1-2H3,(H,21,22,24)	WZMANQMGHXGGLB-UHFFFAOYSA-N	CN(C)Cc1nc(O)c2c(n1)c3ccccc3CC24CCCCC4	BroadT	BRD-K31363949	BRD-K31363949-001-05-3	Asinex Ltd.	BAS 00327492			CN(C)Cc1nc(O)c2c(n1)-c1ccccc1CC21CCCCC1	InChI=1S/C20H25N3O/c1-23(2)13-16-21-18-15-9-5-4-8-14(15)12-20(10-6-3-7-11-20)17(18)19(24)22-16/h4-5,8-9H,3,6-7,10-13H2,1-2H3,(H,21,22,24)	WZMANQMGHXGGLB-UHFFFAOYSA-N	323.19976245							121631
10K-408S	LSM-33075	BRD-K97700172, SID24817314	1475369	InChI=1S/C19H16FN3O3S/c20-15-9-11-17(12-10-15)27(25,26)23(18-8-4-5-13-21-18)14-19(24)22-16-6-2-1-3-7-16/h1-13H,14H2,(H,22,24)	POSKDHUGAAPULA-UHFFFAOYSA-N	Fc1ccc(cc1)S(=O)(=O)N(CC(=O)Nc2ccccc2)c3ccccn3	BroadT	BRD-K97700172	BRD-K97700172-001-05-5	Key Organics Ltd.	10K-408S			Fc1ccc(cc1)S(=O)(=O)N(CC(=O)Nc1ccccc1)c1ccccn1	InChI=1S/C19H16FN3O3S/c20-15-9-11-17(12-10-15)27(25,26)23(18-8-4-5-13-21-18)14-19(24)22-16-6-2-1-3-7-16/h1-13H,14H2,(H,22,24)	POSKDHUGAAPULA-UHFFFAOYSA-N	385.089640292							121632
N-[4-(Methoxymethyl)-6-methyl-2-oxo-1,2-dihydro-7-quinolinyl]cyclopropanecarboxamide	LSM-33076	BRD-K61551681, SID17410284	3401414	InChI=1S/C16H18N2O3/c1-9-5-12-11(8-21-2)6-15(19)17-14(12)7-13(9)18-16(20)10-3-4-10/h5-7,10H,3-4,8H2,1-2H3,(H,17,19)(H,18,20)	CQIUATOREOIZGM-UHFFFAOYSA-N	COCc1cc(O)nc2cc(NC(=O)C3CC3)c(C)cc12	BroadT	BRD-K61551681	BRD-K61551681-001-05-8	Key Organics Ltd.	5W-0891			COCc1cc(O)nc2cc(NC(=O)C3CC3)c(C)cc12	InChI=1S/C16H18N2O3/c1-9-5-12-11(8-21-2)6-15(19)17-14(12)7-13(9)18-16(20)10-3-4-10/h5-7,10H,3-4,8H2,1-2H3,(H,17,19)(H,18,20)	CQIUATOREOIZGM-UHFFFAOYSA-N	286.131742456							121633
AG-670/40735434	LSM-33077	BRD-K76942055, SID49726857	823816	InChI=1S/C20H17N3OS/c1-14-6-5-9-18(21-14)22-20(25)23-19(24)17-12-10-16(11-13-17)15-7-3-2-4-8-15/h2-13H,1H3,(H2,21,22,23,24,25)	MBDKMTNWROYAPG-UHFFFAOYSA-N	Cc1cccc(NC(=S)NC(=O)c2ccc(cc2)c3ccccc3)n1	BroadT	BRD-K76942055	BRD-K76942055-001-05-0	Asinex Ltd.	BAS 03631684			Cc1cccc(NC(=S)NC(=O)c2ccc(cc2)-c2ccccc2)n1	InChI=1S/C20H17N3OS/c1-14-6-5-9-18(21-14)22-20(25)23-19(24)17-12-10-16(11-13-17)15-7-3-2-4-8-15/h2-13H,1H3,(H2,21,22,23,24,25)	MBDKMTNWROYAPG-UHFFFAOYSA-N	347.109232884							121634
MLS000560339	LSM-33078	BRD-K77445233, SID17507155	3170440	InChI=1S/C19H24N4O4/c1-12-11-15(23-27-12)20-16(24)9-10-17(25)21-22-18(26)13-5-7-14(8-6-13)19(2,3)4/h5-8,11H,9-10H2,1-4H3,(H,21,25)(H,22,26)(H,20,23,24)	FZHXYQJKMWDZJH-UHFFFAOYSA-N	Cc1onc(NC(=O)CCC(=O)NNC(=O)c2ccc(cc2)C(C)(C)C)c1	BroadT	BRD-K77445233	BRD-K77445233-001-05-8	Asinex Ltd.	ASN 03212847			Cc1cc(NC(=O)CCC(=O)NNC(=O)c2ccc(cc2)C(C)(C)C)no1	InChI=1S/C19H24N4O4/c1-12-11-15(23-27-12)20-16(24)9-10-17(25)21-22-18(26)13-5-7-14(8-6-13)19(2,3)4/h5-8,11H,9-10H2,1-4H3,(H,21,25)(H,22,26)(H,20,23,24)	FZHXYQJKMWDZJH-UHFFFAOYSA-N	372.179755288							121635
2-(4-Methoxyphenyl)-5-[(2-phenylethyl)amino]-1,3-oxazole-4-carbonitrile	LSM-33079	SID7966323, SID4257126, BRD-K30643363	892204	InChI=1S/C19H17N3O2/c1-23-16-9-7-15(8-10-16)18-22-17(13-20)19(24-18)21-12-11-14-5-3-2-4-6-14/h2-10,21H,11-12H2,1H3	XDDJZSAWXWLKSU-UHFFFAOYSA-N	COc1ccc(cc1)c2oc(NCCc3ccccc3)c(n2)C#N	BroadT	BRD-K30643363	BRD-K30643363-001-05-6	ChemBridge Corporation	7522727			COc1ccc(cc1)-c1nc(C#N)c(NCCc2ccccc2)o1	InChI=1S/C19H17N3O2/c1-23-16-9-7-15(8-10-16)18-22-17(13-20)19(24-18)21-12-11-14-5-3-2-4-6-14/h2-10,21H,11-12H2,1H3	XDDJZSAWXWLKSU-UHFFFAOYSA-N	319.132076814							121636
AC1LQJHT	LSM-43628	BRD-K88948585	1377137	InChI=1S/C21H23N3O4/c25-24(26)19-14-21-20(27-16-28-21)13-18(19)15-23-11-9-22(10-12-23)8-4-7-17-5-2-1-3-6-17/h1-7,13-14H,8-12,15-16H2/b7-4+	WYZVGISWGRQHQB-QPJJXVBHSA-N	[O-][N+](=O)c1cc2OCOc2cc1CN3CCN(C\C=C\c4ccccc4)CC3	BroadT	BRD-K88948585	BRD-K88948585-034-05-3	Vitas-M Laboratory Ltd.	STK121923		OC(=O)C(=O)O	[O-][N+](=O)c1cc2OCOc2cc1CN1CCN(C\C=C\c2ccccc2)CC1.OC(=O)C(=O)O	InChI=1S/C21H23N3O4.C2H2O4/c25-24(26)19-14-21-20(27-16-28-21)13-18(19)15-23-11-9-22(10-12-23)8-4-7-17-5-2-1-3-6-17;3-1(4)2(5)6/h1-7,13-14H,8-12,15-16H2;(H,3,4)(H,5,6)/b7-4+;	CELPSPFMTVHPMC-KQGICBIGSA-N	381.168856246							, 
N,N-Diethyl-2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamide	LSM-33080	BRD-K22298558, SID7969486	726602	InChI=1S/C15H16N2O3S/c1-3-17(4-2)21(19,20)13-9-8-12-14-10(13)6-5-7-11(14)15(18)16-12/h5-9H,3-4H2,1-2H3,(H,16,18)	UJWZNRKOHUOUPL-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc2NC(=O)c3cccc1c23	BroadT	BRD-K22298558	BRD-K22298558-001-04-7	Life Chemicals Inc.	F0433-0507			CCN(CC)S(=O)(=O)c1ccc2NC(=O)c3cccc1c23	InChI=1S/C15H16N2O3S/c1-3-17(4-2)21(19,20)13-9-8-12-14-10(13)6-5-7-11(14)15(18)16-12/h5-9H,3-4H2,1-2H3,(H,16,18)	UJWZNRKOHUOUPL-UHFFFAOYSA-N	304.088163082							121637
1-[2-(1H-Indol-3-yl)ethyl]-5,6,7,8-tetrahydro-4(1H)-quinolinone	LSM-33081	BRD-K03515786, SID24821810	1473014	InChI=1S/C19H20N2O/c22-19-10-12-21(18-8-4-2-6-16(18)19)11-9-14-13-20-17-7-3-1-5-15(14)17/h1,3,5,7,10,12-13,20H,2,4,6,8-9,11H2	KPMWKSNXHKSCLS-UHFFFAOYSA-N	O=C1C=CN(CCc2c[nH]c3ccccc23)C4=C1CCCC4	BroadT	BRD-K03515786	BRD-K03515786-001-05-8	Key Organics Ltd.	2W-0889			O=c1ccn(CCc2c[nH]c3ccccc23)c2CCCCc12	InChI=1S/C19H20N2O/c22-19-10-12-21(18-8-4-2-6-16(18)19)11-9-14-13-20-17-7-3-1-5-15(14)17/h1,3,5,7,10,12-13,20H,2,4,6,8-9,11H2	KPMWKSNXHKSCLS-UHFFFAOYSA-N	292.15756328							121638
T0509-5220	LSM-44455	BRD-K69087429, SID22402790	2360179	InChI=1S/C20H18N4O3/c1-23-17-9-4-13(11-18(17)24(2)20(23)26)10-14(12-21)19(25)22-15-5-7-16(27-3)8-6-15/h4-11H,1-3H3,(H,22,25)/b14-10+	ZJBHOPLSPMOUGE-GXDHUFHOSA-N	COc1ccc(NC(=O)\C(=C\c2ccc3N(C)C(=O)N(C)c3c2)\C#N)cc1	BroadT	BRD-K69087429	BRD-K69087429-001-05-2	Enamine Ltd.	T0509-5220			COc1ccc(NC(=O)C(=C\c2ccc3n(C)c(=O)n(C)c3c2)\C#N)cc1	InChI=1S/C20H18N4O3/c1-23-17-9-4-13(11-18(17)24(2)20(23)26)10-14(12-21)19(25)22-15-5-7-16(27-3)8-6-15/h4-11H,1-3H3,(H,22,25)/b14-10+	ZJBHOPLSPMOUGE-GXDHUFHOSA-N	362.137890476							
MLS000085097	LSM-33083	BRD-K98451611	2049501	InChI=1S/C14H17ClN2OS/c1-9-12(13(18)17(16-9)14(2,3)4)19-11-7-5-10(15)6-8-11/h5-8,18H,1-4H3	IYIGLQSFYOLXCS-UHFFFAOYSA-N	Cc1nn(c(O)c1Sc2ccc(Cl)cc2)C(C)(C)C	BroadT	BRD-K98451611	BRD-K98451611-001-06-1	ChemDiv Inc.	5228-4121			Cc1nn(c(O)c1Sc1ccc(Cl)cc1)C(C)(C)C	InChI=1S/C14H17ClN2OS/c1-9-12(13(18)17(16-9)14(2,3)4)19-11-7-5-10(15)6-8-11/h5-8,18H,1-4H3	IYIGLQSFYOLXCS-UHFFFAOYSA-N	296.075011584							
AMBCB35876254	LSM-44456	BRD-A20248179, SID24784240	16188364	InChI=1S/C23H28ClNO2/c1-27-22-11-3-2-8-20(22)9-5-13-25-14-6-12-23(17-25,18-26)16-19-7-4-10-21(24)15-19/h2-5,7-11,15,26H,6,12-14,16-18H2,1H3/b9-5+	VCCRFAZUYUPLNS-WEVVVXLNSA-N	COc1ccccc1\C=C\CN2CCCC(CO)(Cc3cccc(Cl)c3)C2	BroadT	BRD-A20248179	BRD-A20248179-001-06-0	ChemBridge Corporation	35876254			COc1ccccc1\C=C\CN1CCCC(CO)(Cc2cccc(Cl)c2)C1	InChI=1S/C23H28ClNO2/c1-27-22-11-3-2-8-20(22)9-5-13-25-14-6-12-23(17-25,18-26)16-19-7-4-10-21(24)15-19/h2-5,7-11,15,26H,6,12-14,16-18H2,1H3/b9-5+	VCCRFAZUYUPLNS-WEVVVXLNSA-N	385.180856856							
MLS000044812	LSM-33085	BRD-K10146653, SID4249964	3243839	InChI=1S/C12H11NO2/c1-7-3-4-11-9(5-7)12(15)10(6-13-11)8(2)14/h3-6H,1-2H3,(H,13,15)	HEUUNOJLQNBBHX-UHFFFAOYSA-N	CC(=O)c1cnc2ccc(C)cc2c1O	BroadT	BRD-K10146653	BRD-K10146653-001-11-1	ChemDiv Inc.	C200-1456			CC(=O)c1cnc2ccc(C)cc2c1O	InChI=1S/C12H11NO2/c1-7-3-4-11-9(5-7)12(15)10(6-13-11)8(2)14/h3-6H,1-2H3,(H,13,15)	HEUUNOJLQNBBHX-UHFFFAOYSA-N	201.078978602							121642
MLS001200212	LSM-33086	BRD-K97247086, SID24394535, SID49670261	16016685	InChI=1S/C19H21N3O2S/c1-3-4-11-20-19(24)21-13-9-10-17-15(12-13)22(2)18(23)14-7-5-6-8-16(14)25-17/h5-10,12H,3-4,11H2,1-2H3,(H2,20,21,24)	UGYXUEPBYOKNOL-UHFFFAOYSA-N	CCCCNC(=O)Nc1ccc2Sc3ccccc3C(=O)N(C)c2c1	BroadT	BRD-K97247086	BRD-K97247086-001-05-2	ChemDiv Inc.	E006-0197			CCCCNC(=O)Nc1ccc2Sc3ccccc3C(=O)N(C)c2c1	InChI=1S/C19H21N3O2S/c1-3-4-11-20-19(24)21-13-9-10-17-15(12-13)22(2)18(23)14-7-5-6-8-16(14)25-17/h5-10,12H,3-4,11H2,1-2H3,(H2,20,21,24)	UGYXUEPBYOKNOL-UHFFFAOYSA-N	355.135447632							121643
AK-918/42814184	LSM-33087	SID14732447, BRD-A69110666	2964317	InChI=1S/C15H14ClN3O2S/c1-9-2-3-11(7-12(9)16)19-8-10(6-13(19)20)14(21)18-15-17-4-5-22-15/h2-5,7,10H,6,8H2,1H3,(H,17,18,21)	MVKGEIODWGEBBC-UHFFFAOYSA-N	Cc1ccc(cc1Cl)N2CC(CC2=O)C(=O)Nc3nccs3	BroadT	BRD-A69110666	BRD-A69110666-001-05-6	ChemBridge Corporation	7915603			Cc1ccc(cc1Cl)N1CC(CC1=O)C(=O)Nc1nccs1	InChI=1S/C15H14ClN3O2S/c1-9-2-3-11(7-12(9)16)19-8-10(6-13(19)20)14(21)18-15-17-4-5-22-15/h2-5,7,10H,6,8H2,1H3,(H,17,18,21)	MVKGEIODWGEBBC-UHFFFAOYSA-N	335.049525118							121644
SMR000019439	LSM-33088	BRD-A89983325, SID4243550	2847991	InChI=1S/C12H24N4O5S2/c1-3-5-7-22(18,19)15-9-16(23(20,21)8-6-4-2)11-10(15)13-12(17)14-11/h10-11H,3-9H2,1-2H3,(H2,13,14,17)	OFSWUTIZRAMAAP-UHFFFAOYSA-N	CCCCS(=O)(=O)N1CN(C2NC(=O)NC12)S(=O)(=O)CCCC	BroadT	BRD-A89983325	BRD-A89983325-001-05-5	ChemDiv Inc.	4877-0155			CCCCS(=O)(=O)N1CN(C2NC(=O)NC12)S(=O)(=O)CCCC	InChI=1S/C12H24N4O5S2/c1-3-5-7-22(18,19)15-9-16(23(20,21)8-6-4-2)11-10(15)13-12(17)14-11/h10-11H,3-9H2,1-2H3,(H2,13,14,17)	OFSWUTIZRAMAAP-UHFFFAOYSA-N	368.118811288							121645
N-Ethyl-3-(1H-pyrrol-1-yl)-2-thiophenecarboxamide	LSM-33089	BRD-K36422663	5096643	InChI=1S/C11H12N2OS/c1-2-12-11(14)10-9(5-8-15-10)13-6-3-4-7-13/h3-8H,2H2,1H3,(H,12,14)	IRVILWZBEHFNML-UHFFFAOYSA-N	CCNC(=O)c1sccc1n2cccc2	BroadT	BRD-K36422663	BRD-K36422663-001-05-6	Key Organics Ltd.	5R-1012			CCNC(=O)c1sccc1-n1cccc1	InChI=1S/C11H12N2OS/c1-2-12-11(14)10-9(5-8-15-10)13-6-3-4-7-13/h3-8H,2H2,1H3,(H,12,14)	IRVILWZBEHFNML-UHFFFAOYSA-N	220.067033714							121646
STK173486	LSM-33090	BRD-K64425085, SID17416242	1347240	InChI=1S/C22H19N3O2S2/c1-12-9-14(3)19-17(10-12)23-21(27-19)15-7-6-13(2)16(11-15)24-22(28)25-20(26)18-5-4-8-29-18/h4-11H,1-3H3,(H2,24,25,26,28)	YWYLGHIMYAFGNM-UHFFFAOYSA-N	Cc1cc(C)c2oc(nc2c1)c3ccc(C)c(NC(=S)NC(=O)c4cccs4)c3	BroadT	BRD-K64425085	BRD-K64425085-001-05-4	ChemBridge Corporation	6344183			Cc1cc(C)c2oc(nc2c1)-c1ccc(C)c(NC(=S)NC(=O)c2cccs2)c1	InChI=1S/C22H19N3O2S2/c1-12-9-14(3)19-17(10-12)23-21(27-19)15-7-6-13(2)16(11-15)24-22(28)25-20(26)18-5-4-8-29-18/h4-11H,1-3H3,(H2,24,25,26,28)	YWYLGHIMYAFGNM-UHFFFAOYSA-N	421.091868258							121647
MLS000576709	LSM-33091	BRD-K55869732, SID17414762	2173163	InChI=1S/C22H20N6S/c1-2-11-25-22(29)26-15-9-10-16-19(14-15)28-21(18-8-4-6-13-24-18)20(27-16)17-7-3-5-12-23-17/h3-10,12-14H,2,11H2,1H3,(H2,25,26,29)	HUYCJINUYJOSJL-UHFFFAOYSA-N	CCCN=C(S)Nc1ccc2nc(c3ccccn3)c(nc2c1)c4ccccn4	BroadT	BRD-K55869732	BRD-K55869732-001-05-1	ChemBridge Corporation	7096431			CCCN=C(S)Nc1ccc2nc(-c3ccccn3)c(nc2c1)-c1ccccn1	InChI=1S/C22H20N6S/c1-2-11-25-22(29)26-15-9-10-16-19(14-15)28-21(18-8-4-6-13-24-18)20(27-16)17-7-3-5-12-23-17/h3-10,12-14H,2,11H2,1H3,(H2,25,26,29)	HUYCJINUYJOSJL-UHFFFAOYSA-N	400.14701539							121648
6-(4-Chlorophenyl)-4-(methylsulfanyl)-2-oxo-1,2-dihydro-3-pyridinecarbonitrile	LSM-33092	6-(4-Chlorophenyl)-2-Hydroxy-4-(Methylthio)Nicotinonitrile, SID24824395	2743471	InChI=1S/C13H9ClN2OS/c1-18-12-6-11(16-13(17)10(12)7-15)8-2-4-9(14)5-3-8/h2-6H,1H3,(H,16,17)	VJOADGFNWKRPBG-UHFFFAOYSA-N	CSc1cc(nc(O)c1C#N)c2ccc(Cl)cc2	BroadT	BRD-K69252983	BRD-K69252983-001-05-0	Key Organics Ltd.	4L-544S			CSc1cc(nc(O)c1C#N)-c1ccc(Cl)cc1	InChI=1S/C13H9ClN2OS/c1-18-12-6-11(16-13(17)10(12)7-15)8-2-4-9(14)5-3-8/h2-6H,1H3,(H,16,17)	VJOADGFNWKRPBG-UHFFFAOYSA-N	276.012411328							121649
4-Methyl-3-phenyl-1H-pyrazole-5-carbohydrazide	LSM-33093	BRD-K58586013, SID24821010	3116416	InChI=1S/C11H12N4O/c1-7-9(8-5-3-2-4-6-8)14-15-10(7)11(16)13-12/h2-6H,12H2,1H3,(H,13,16)(H,14,15)	KDLBGTXYFXKNLL-UHFFFAOYSA-N	Cc1c([nH]nc1c2ccccc2)C(=O)NN	BroadT	BRD-K58586013	BRD-K58586013-001-05-8	Asinex Ltd.	BAS 00715882			Cc1c([nH]nc1-c1ccccc1)C(=O)NN	InChI=1S/C11H12N4O/c1-7-9(8-5-3-2-4-6-8)14-15-10(7)11(16)13-12/h2-6H,12H2,1H3,(H,13,16)(H,14,15)	KDLBGTXYFXKNLL-UHFFFAOYSA-N	216.101111044							121650
SMR000031640	LSM-33094	SID4240655, BRD-K55105453	3235741	InChI=1S/C19H21FN2OS/c20-17-6-4-5-16(13-17)14-24-15-19(23)22-11-9-21(10-12-22)18-7-2-1-3-8-18/h1-8,13H,9-12,14-15H2	IFGGFZJNRYBPEH-UHFFFAOYSA-N	Fc1cccc(CSCC(=O)N2CCN(CC2)c3ccccc3)c1	BroadT	BRD-K55105453	BRD-K55105453-001-06-5	ChemDiv Inc.	K784-0964			Fc1cccc(CSCC(=O)N2CCN(CC2)c2ccccc2)c1	InChI=1S/C19H21FN2OS/c20-17-6-4-5-16(13-17)14-24-15-19(23)22-11-9-21(10-12-22)18-7-2-1-3-8-18/h1-8,13H,9-12,14-15H2	IFGGFZJNRYBPEH-UHFFFAOYSA-N	344.135862202							121651
4-(3,5-Dichloro-4-pyridinyl)-n-(1-naphthyl)-1,4-diazepane-1-carboxamide	LSM-33095	BRD-K20831543, SID26728687	2812120	InChI=1S/C21H20Cl2N4O/c22-17-13-24-14-18(23)20(17)26-9-4-10-27(12-11-26)21(28)25-19-8-3-6-15-5-1-2-7-16(15)19/h1-3,5-8,13-14H,4,9-12H2,(H,25,28)	OWYGDKXWHLAZQH-UHFFFAOYSA-N	Clc1cncc(Cl)c1N2CCCN(CC2)C(=O)Nc3cccc4ccccc34	BroadT	BRD-K20831543	BRD-K20831543-001-05-2	Maybridge	HTS 04997			Clc1cncc(Cl)c1N1CCCN(CC1)C(=O)Nc1cccc2ccccc12	InChI=1S/C21H20Cl2N4O/c22-17-13-24-14-18(23)20(17)26-9-4-10-27(12-11-26)21(28)25-19-8-3-6-15-5-1-2-7-16(15)19/h1-3,5-8,13-14H,4,9-12H2,(H,25,28)	OWYGDKXWHLAZQH-UHFFFAOYSA-N	414.10141672							121652
4H-Pyrimido[5,4-b]indol-4-one, 3-amino-3,5-dihydro-	LSM-33096	BRD-K87126326, SID17504210	814497	InChI=1S/C10H8N4O/c11-14-5-12-8-6-3-1-2-4-7(6)13-9(8)10(14)15/h1-5,15H,11H2	BOMMJBOMRZVTHL-UHFFFAOYSA-N	Nn1cnc2c3ccccc3nc2c1O	BroadT	BRD-K87126326	BRD-K87126326-001-05-0	InterBioScreen Ltd.	STOCK1S-03522			Nn1cnc2c(nc3ccccc23)c1O	InChI=1S/C10H8N4O/c11-14-5-12-8-6-3-1-2-4-7(6)13-9(8)10(14)15/h1-5,15H,11H2	BOMMJBOMRZVTHL-UHFFFAOYSA-N	200.069810916							
MLS000576112	LSM-33097	BRD-K95417411, SID17411926	1713557	InChI=1S/C16H12ClN3/c17-16-19-14(11-7-3-1-4-8-11)13(18)15(20-16)12-9-5-2-6-10-12/h1-10H,18H2	SLOSQZWEGNDMAF-UHFFFAOYSA-N	Nc1c(nc(Cl)nc1c2ccccc2)c3ccccc3	BroadT	BRD-K95417411	BRD-K95417411-001-05-9	ChemBridge Corporation	5213119			Nc1c(nc(Cl)nc1-c1ccccc1)-c1ccccc1	InChI=1S/C16H12ClN3/c17-16-19-14(11-7-3-1-4-8-11)13(18)15(20-16)12-9-5-2-6-10-12/h1-10H,18H2	SLOSQZWEGNDMAF-UHFFFAOYSA-N	281.071975124							121654
(2-Chlorophenyl)-(5-hydroxy-3-methyl-5-phenyl-4H-pyrazol-1-yl)methanone	LSM-33098	BRD-A98099470, SID49641063	2868929	InChI=1S/C17H15ClN2O2/c1-12-11-17(22,13-7-3-2-4-8-13)20(19-12)16(21)14-9-5-6-10-15(14)18/h2-10,22H,11H2,1H3	WEFAVDMFIBIUGY-UHFFFAOYSA-N	CC1=NN(C(=O)c2ccccc2Cl)C(O)(C1)c3ccccc3	BroadT	BRD-A98099470	BRD-A98099470-001-05-2	Asinex Ltd.	BAS 00630925			CC1=NN(C(=O)c2ccccc2Cl)C(O)(C1)c1ccccc1	InChI=1S/C17H15ClN2O2/c1-12-11-17(22,13-7-3-2-4-8-13)20(19-12)16(21)14-9-5-6-10-15(14)18/h2-10,22H,11H2,1H3	WEFAVDMFIBIUGY-UHFFFAOYSA-N	314.08220545							121655
3-(4-Bromo-benzyl)-n-(4-methoxy-phenyl)-succinamic acid	LSM-33099	BRD-A77941182, SID49643187	2850074	InChI=1S/C18H18BrNO4/c1-24-16-8-6-15(7-9-16)20-18(23)13(11-17(21)22)10-12-2-4-14(19)5-3-12/h2-9,13H,10-11H2,1H3,(H,20,23)(H,21,22)	LCHRTSINYYBMKD-UHFFFAOYSA-N	COc1ccc(NC(=O)C(CC(=O)O)Cc2ccc(Br)cc2)cc1	BroadT	BRD-A77941182	BRD-A77941182-001-05-9	Asinex Ltd.	BAS 00513770			COc1ccc(NC(=O)C(CC(O)=O)Cc2ccc(Br)cc2)cc1	InChI=1S/C18H18BrNO4/c1-24-16-8-6-15(7-9-16)20-18(23)13(11-17(21)22)10-12-2-4-14(19)5-3-12/h2-9,13H,10-11H2,1H3,(H,20,23)(H,21,22)	LCHRTSINYYBMKD-UHFFFAOYSA-N	391.041920666							121656
AC1N20GI	LSM-33100	BRD-K57274378	4039086	InChI=1S/C24H22N2O5/c1-3-30-22-14-17(15-25-26-19-11-9-18(10-12-19)23(27)28)8-13-21(22)31-24(29)20-7-5-4-6-16(20)2/h4-15,26H,3H2,1-2H3,(H,27,28)	FQNNAFOMUPWSSO-UHFFFAOYSA-N	CCOc1cc(C=NNc2ccc(cc2)C(=O)O)ccc1OC(=O)c3ccccc3C	BroadT	BRD-K57274378	BRD-K57274378-001-05-1	InterBioScreen Ltd.	STOCK4S-71629			CCOc1cc(C=NNc2ccc(cc2)C(O)=O)ccc1OC(=O)c1ccccc1C	InChI=1S/C24H22N2O5/c1-3-30-22-14-17(15-25-26-19-11-9-18(10-12-19)23(27)28)8-13-21(22)31-24(29)20-7-5-4-6-16(20)2/h4-15,26H,3H2,1-2H3,(H,27,28)	FQNNAFOMUPWSSO-UHFFFAOYSA-N	418.152871824							121657
AMBCB43844461	LSM-33101	SID24800298, BRD-A68323834	16191967	InChI=1S/C18H21F3N4O2/c1-3-25-10-12(8-16(25)26)9-24(2)11-15-22-17(23-27-15)13-4-6-14(7-5-13)18(19,20)21/h4-7,12H,3,8-11H2,1-2H3	YGKXSUXTJJEUGF-UHFFFAOYSA-N	CCN1CC(CN(C)Cc2onc(n2)c3ccc(cc3)C(F)(F)F)CC1=O	BroadT	BRD-A68323834	BRD-A68323834-001-05-3	ChemBridge Corporation	43844461			CCN1CC(CN(C)Cc2nc(no2)-c2ccc(cc2)C(F)(F)F)CC1=O	InChI=1S/C18H21F3N4O2/c1-3-25-10-12(8-16(25)26)9-24(2)11-15-22-17(23-27-15)13-4-6-14(7-5-13)18(19,20)21/h4-7,12H,3,8-11H2,1-2H3	YGKXSUXTJJEUGF-UHFFFAOYSA-N	382.161660552							121658
MLS000765729	LSM-33102	BRD-A56909893, SID24807480	3162260	InChI=1S/C23H29N5O4/c1-3-31-10-5-9-24-20-17(22(29)25-13-16-6-4-11-32-16)12-18-21(27-20)26-19-8-7-15(2)14-28(19)23(18)30/h7-8,12,14,16H,3-6,9-11,13H2,1-2H3,(H,24,27)(H,25,29)	FHOSXOVQPWXXSG-UHFFFAOYSA-N	CCOCCCNc1nc2N=C3C=CC(=CN3C(=O)c2cc1C(=O)NCC4CCCO4)C	BroadT	BRD-A56909893	BRD-A56909893-001-06-9	Asinex Ltd.	BAS 12490285			CCOCCCNc1nc2nc3ccc(C)cn3c(=O)c2cc1C(=O)NCC1CCCO1	InChI=1S/C23H29N5O4/c1-3-31-10-5-9-24-20-17(22(29)25-13-16-6-4-11-32-16)12-18-21(27-20)26-19-8-7-15(2)14-28(19)23(18)30/h7-8,12,14,16H,3-6,9-11,13H2,1-2H3,(H,24,27)(H,25,29)	FHOSXOVQPWXXSG-UHFFFAOYSA-N	439.221954458							121659
ASN 04393305	LSM-33103	BRD-K29509140, SID24822516	1173246	InChI=1S/C22H20N4O3S/c1-12-7-8-13(2)19-17(12)9-14(3)20-24-25-22(26(19)20)30-11-18(27)23-16-6-4-5-15(10-16)21(28)29/h4-10H,11H2,1-3H3,(H,23,27)(H,28,29)	HBLVBZWVYVFLJM-UHFFFAOYSA-N	Cc1ccc(C)c2c1cc(C)c3nnc(SCC(=O)Nc4cccc(c4)C(=O)O)n23	BroadT	BRD-K29509140	BRD-K29509140-001-05-2	Asinex Ltd.	ASN 04393305			Cc1cc2c(C)ccc(C)c2n2c(SCC(=O)Nc3cccc(c3)C(O)=O)nnc12	InChI=1S/C22H20N4O3S/c1-12-7-8-13(2)19-17(12)9-14(3)20-24-25-22(26(19)20)30-11-18(27)23-16-6-4-5-15(10-16)21(28)29/h4-10H,11H2,1-3H3,(H,23,27)(H,28,29)	HBLVBZWVYVFLJM-UHFFFAOYSA-N	420.12561123							121660
Peucedanin	LSM-3618	SID24823950, SID26749708	8616	InChI=1S/C15H14O4/c1-8(2)14-15(17-3)10-6-9-4-5-13(16)18-11(9)7-12(10)19-14/h4-8H,1-3H3	YQBNJPACAUPNLV-UHFFFAOYSA-N	COc1c(oc2cc3OC(=O)C=Cc3cc12)C(C)C	BroadT	BRD-K72034655	BRD-K72034655-001-07-0	InterBioScreen Ltd.	STOCK1N-13691			COc1c(oc2cc3oc(=O)ccc3cc12)C(C)C	InChI=1S/C15H14O4/c1-8(2)14-15(17-3)10-6-9-4-5-13(16)18-11(9)7-12(10)19-14/h4-8H,1-3H3	YQBNJPACAUPNLV-UHFFFAOYSA-N	258.089208928							8034
MLS000882791	LSM-33104	BRD-K78625574, SID26732207	16746378	InChI=1S/C31H29NO2S/c1-20-9-8-13-24-29(20)31(33)32(19-21-10-4-3-5-11-21)30(24)25-17-23(15-16-26(25)34-2)28-18-22-12-6-7-14-27(22)35-28/h3-8,10-18,20,24,29-30H,9,19H2,1-2H3/t20-,24+,29+,30-/m1/s1	OAFLRAUVICLSCY-MJQKZAJVSA-N	COc1ccc(cc1[C@H]2[C@H]3C=CC[C@@H](C)[C@@H]3C(=O)N2Cc4ccccc4)c5cc6ccccc6s5	BroadT	BRD-K78625574	BRD-K78625574-001-05-1	University of Kansas CMLD	KUC101341N			COc1ccc(cc1[C@H]1[C@H]2C=CC[C@@H](C)[C@@H]2C(=O)N1Cc1ccccc1)-c1cc2ccccc2s1	InChI=1S/C31H29NO2S/c1-20-9-8-13-24-29(20)31(33)32(19-21-10-4-3-5-11-21)30(24)25-17-23(15-16-26(25)34-2)28-18-22-12-6-7-14-27(22)35-28/h3-8,10-18,20,24,29-30H,9,19H2,1-2H3/t20-,24+,29+,30-/m1/s1	OAFLRAUVICLSCY-MJQKZAJVSA-N	479.191899868							121661
(5-Amino[1,2,3]triazolo[1,5-a]quinazolin-3-yl)(morpholino)methanone	LSM-33105	BRD-K61021741, SID26727472	331820	InChI=1S/C14H14N6O2/c15-12-9-3-1-2-4-10(9)20-13(16-12)11(17-18-20)14(21)19-5-7-22-8-6-19/h1-4H,5-8H2,(H2,15,16)	BOKJRPZPDJRUTN-UHFFFAOYSA-N	Nc1nc2c(nnn2c3ccccc13)C(=O)N4CCOCC4	BroadT	BRD-K61021741	BRD-K61021741-001-07-6	Maybridge	CD 05125			Nc1nc2c(nnn2c2ccccc12)C(=O)N1CCOCC1	InChI=1S/C14H14N6O2/c15-12-9-3-1-2-4-10(9)20-13(16-12)11(17-18-20)14(21)19-5-7-22-8-6-19/h1-4H,5-8H2,(H2,15,16)	BOKJRPZPDJRUTN-UHFFFAOYSA-N	298.117823748							121662
AC1MDI5U	LSM-33106	BRD-A73635700	2837256	InChI=1S/C19H17N3O3/c1-22-11-13(14-6-2-3-7-15(14)22)10-20-21-19(23)18-12-24-16-8-4-5-9-17(16)25-18/h2-11,18H,12H2,1H3,(H,21,23)	FCCDLHINYXHQMR-UHFFFAOYSA-N	Cn1cc(C=NNC(=O)C2COc3ccccc3O2)c4ccccc14	BroadT	BRD-A73635700	BRD-A73635700-001-03-9	ChemBridge Corporation	5249872			Cn1cc(C=NNC(=O)C2COc3ccccc3O2)c2ccccc12	InChI=1S/C19H17N3O3/c1-22-11-13(14-6-2-3-7-15(14)22)10-20-21-19(23)18-12-24-16-8-4-5-9-17(16)25-18/h2-11,18H,12H2,1H3,(H,21,23)	FCCDLHINYXHQMR-UHFFFAOYSA-N	335.126991434							121663
MLS000849557	LSM-33107	BRD-K82570855, SID26732657	16746603	InChI=1S/C20H20N4O3/c1-13(14-6-4-3-5-7-14)23-19(25)17-18(22-12-21-17)20(26)24-15-8-10-16(27-2)11-9-15/h3-13H,1-2H3,(H,21,22)(H,23,25)(H,24,26)/t13-/m0/s1	DERCBWLVMLBEMQ-ZDUSSCGKSA-N	COc1ccc(NC(=O)c2[nH]cnc2C(=O)N[C@@H](C)c3ccccc3)cc1	BroadT	BRD-K82570855	BRD-K82570855-001-05-3	University of Tulsa	ILP-I-75 AN02_PA01			COc1ccc(NC(=O)c2[nH]cnc2C(=O)N[C@@H](C)c2ccccc2)cc1	InChI=1S/C20H20N4O3/c1-13(14-6-4-3-5-7-14)23-19(25)17-18(22-12-21-17)20(26)24-15-8-10-16(27-2)11-9-15/h3-13H,1-2H3,(H,21,22)(H,23,25)(H,24,26)/t13-/m0/s1	DERCBWLVMLBEMQ-ZDUSSCGKSA-N	364.15354054							121664
4-(4-Quinoxalin-2-ylphenoxy)benzene-1,2-dicarbonitrile	LSM-33108	SID17512154, BRD-K85311003	676369	InChI=1S/C22H12N4O/c23-12-16-7-10-19(11-17(16)13-24)27-18-8-5-15(6-9-18)22-14-25-20-3-1-2-4-21(20)26-22/h1-11,14H	IAIXMAGERSFZMA-UHFFFAOYSA-N	N#Cc1ccc(Oc2ccc(cc2)c3cnc4ccccc4n3)cc1C#N	BroadT	BRD-K85311003	BRD-K85311003-001-05-0	InterBioScreen Ltd.	STOCK2S-50188			N#Cc1ccc(Oc2ccc(cc2)-c2cnc3ccccc3n2)cc1C#N	InChI=1S/C22H12N4O/c23-12-16-7-10-19(11-17(16)13-24)27-18-8-5-15(6-9-18)22-14-25-20-3-1-2-4-21(20)26-22/h1-11,14H	IAIXMAGERSFZMA-UHFFFAOYSA-N	348.101111044							121665
ZINC02865841	LSM-33109	BRD-K69678391, SID24783986	2218995	InChI=1S/C17H16O3/c1-2-3-8-20-12-5-7-14-13-6-4-11(18)9-15(13)17(19)16(14)10-12/h4-7,9-10,18H,2-3,8H2,1H3	YNIZLADPUYQUNC-UHFFFAOYSA-N	CCCCOc1ccc2c(c1)C(=O)c3cc(O)ccc23	BroadT	BRD-K69678391	BRD-K69678391-001-05-2	ChemBridge Corporation	7912153			CCCCOc1ccc2-c3ccc(O)cc3C(=O)c2c1	InChI=1S/C17H16O3/c1-2-3-8-20-12-5-7-14-13-6-4-11(18)9-15(13)17(19)16(14)10-12/h4-7,9-10,18H,2-3,8H2,1H3	YNIZLADPUYQUNC-UHFFFAOYSA-N	268.109944372							121666
Ethyl 3-amino-5-phenylthiophene-2-carboxylate	LSM-33110	BRD-K35085740, SID4260777	838333	InChI=1S/C13H13NO2S/c1-2-16-13(15)12-10(14)8-11(17-12)9-6-4-3-5-7-9/h3-8H,2,14H2,1H3	ALFMTFUIVUKCCM-UHFFFAOYSA-N	CCOC(=O)c1sc(cc1N)c2ccccc2	BroadT	BRD-K35085740	BRD-K35085740-001-06-7	ChemBridge Corporation	5175064			CCOC(=O)c1sc(cc1N)-c1ccccc1	InChI=1S/C13H13NO2S/c1-2-16-13(15)12-10(14)8-11(17-12)9-6-4-3-5-7-9/h3-8H,2,14H2,1H3	ALFMTFUIVUKCCM-UHFFFAOYSA-N	247.066699356							121667
T0518-8219	LSM-33111	BRD-K52231520, SID3717619	859114	InChI=1S/C17H17N5OS/c1-11-5-6-14(12(2)8-11)22-16(13-4-3-7-19-9-13)20-21-17(22)24-10-15(18)23/h3-9H,10H2,1-2H3,(H2,18,23)	LLHCVWIEIRPOAK-UHFFFAOYSA-N	Cc1ccc(c(C)c1)n2c(SCC(=O)N)nnc2c3cccnc3	BroadT	BRD-K52231520	BRD-K52231520-001-05-3	Enamine Ltd.	T0518-8219			Cc1ccc(c(C)c1)-n1c(SCC(N)=O)nnc1-c1cccnc1	InChI=1S/C17H17N5OS/c1-11-5-6-14(12(2)8-11)22-16(13-4-3-7-19-9-13)20-21-17(22)24-10-15(18)23/h3-9H,10H2,1-2H3,(H2,18,23)	LLHCVWIEIRPOAK-UHFFFAOYSA-N	339.115380904							121668
T6300449	LSM-33112	BRD-K96624721, SID14746840	1540603	InChI=1S/C13H18N2O4/c1-4-17-12(16)15-13(14-9(2)3)18-10-7-5-6-8-11(10)19-13/h5-9,14H,4H2,1-3H3,(H,15,16)	XIZGDDNAFSHZMA-UHFFFAOYSA-N	CCOC(=O)NC1(NC(C)C)Oc2ccccc2O1	BroadT	BRD-K96624721	BRD-K96624721-001-05-4	Enamine Ltd.	T0513-3124			CCOC(=O)NC1(NC(C)C)Oc2ccccc2O1	InChI=1S/C13H18N2O4/c1-4-17-12(16)15-13(14-9(2)3)18-10-7-5-6-8-11(10)19-13/h5-9,14H,4H2,1-3H3,(H,15,16)	XIZGDDNAFSHZMA-UHFFFAOYSA-N	266.126657076							121669
N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-morpholinecarboxamide	LSM-33113	BRD-K67092184, SID24821908	3613789	InChI=1S/C13H16N2O4/c16-13(15-3-5-17-6-4-15)14-10-1-2-11-12(9-10)19-8-7-18-11/h1-2,9H,3-8H2,(H,14,16)	SOBXSVJYSCXYCW-UHFFFAOYSA-N	O=C(Nc1ccc2OCCOc2c1)N3CCOCC3	BroadT	BRD-K67092184	BRD-K67092184-001-05-9	Key Organics Ltd.	3X-0220			O=C(Nc1ccc2OCCOc2c1)N1CCOCC1	InChI=1S/C13H16N2O4/c16-13(15-3-5-17-6-4-15)14-10-1-2-11-12(9-10)19-8-7-18-11/h1-2,9H,3-8H2,(H,14,16)	SOBXSVJYSCXYCW-UHFFFAOYSA-N	264.111007012							121670
T5523093	LSM-33114	SID49672700, BRD-K80535598	9115581	InChI=1S/C13H12N2S/c1-8-7-9(2)14-12(8)13-15-10-5-3-4-6-11(10)16-13/h3-7,14H,1-2H3	BTCYCZDZXBKHSW-UHFFFAOYSA-N	Cc1cc(C)c([nH]1)c2nc3ccccc3s2	BroadT	BRD-K80535598	BRD-K80535598-001-06-8	Enamine Ltd.	T5523093			Cc1cc(C)c([nH]1)-c1nc2ccccc2s1	InChI=1S/C13H12N2S/c1-8-7-9(2)14-12(8)13-15-10-5-3-4-6-11(10)16-13/h3-7,14H,1-2H3	BTCYCZDZXBKHSW-UHFFFAOYSA-N	228.072119094							121671
SMR000021687	LSM-33115	BRD-K79433629, SID4244145	3238783	InChI=1S/C18H18N4O2/c1-3-8-22-12(2)9-17(23)14-10-13(4-5-16(14)22)21-18(24)15-11-19-6-7-20-15/h4-7,9-11H,3,8H2,1-2H3,(H,21,24)	UQARCGXBFYJUNH-UHFFFAOYSA-N	CCCN1C(=CC(=O)c2cc(NC(=O)c3cnccn3)ccc12)C	BroadT	BRD-K79433629	BRD-K79433629-001-05-4	ChemDiv Inc.	C066-1649			CCCn1c(C)cc(=O)c2cc(NC(=O)c3cnccn3)ccc12	InChI=1S/C18H18N4O2/c1-3-8-22-12(2)9-17(23)14-10-13(4-5-16(14)22)21-18(24)15-11-19-6-7-20-15/h4-7,9-11H,3,8H2,1-2H3,(H,21,24)	UQARCGXBFYJUNH-UHFFFAOYSA-N	322.142975856							121672
8-[(3-Ethoxypropyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione	LSM-33116	BRD-K88323568, SID4257791	1825553	InChI=1S/C12H19N5O3/c1-4-20-7-5-6-13-11-14-8-9(15-11)16(2)12(19)17(3)10(8)18/h4-7H2,1-3H3,(H2,13,14,15)	NSXICLGLBKUSQP-UHFFFAOYSA-N	CCOCCCNc1nc2C(=O)N(C)C(=O)N(C)c2[nH]1	BroadT	BRD-K88323568	BRD-K88323568-001-04-2	ChemBridge Corporation	7654684			CCOCCCNc1nc2n(C)c(=O)n(C)c(=O)c2[nH]1	InChI=1S/C12H19N5O3/c1-4-20-7-5-6-13-11-14-8-9(15-11)16(2)12(19)17(3)10(8)18/h4-7H2,1-3H3,(H2,13,14,15)	NSXICLGLBKUSQP-UHFFFAOYSA-N	281.148789518							121673
N-(2-Fluorophenyl)-4-methoxy-2,5-dimethylbenzenesulfonamide	LSM-33117	BRD-K06157545, SID4258326	2236619	InChI=1S/C15H16FNO3S/c1-10-9-15(11(2)8-14(10)20-3)21(18,19)17-13-7-5-4-6-12(13)16/h4-9,17H,1-3H3	YETZNPBVZWTHHB-UHFFFAOYSA-N	COc1cc(C)c(cc1C)S(=O)(=O)Nc2ccccc2F	BroadT	BRD-K06157545	BRD-K06157545-001-05-8	ChemBridge Corporation	7977527			COc1cc(C)c(cc1C)S(=O)(=O)Nc1ccccc1F	InChI=1S/C15H16FNO3S/c1-10-9-15(11(2)8-14(10)20-3)21(18,19)17-13-7-5-4-6-12(13)16/h4-9,17H,1-3H3	YETZNPBVZWTHHB-UHFFFAOYSA-N	309.083492272							121674
AC1LI22V	LSM-33118	BRD-K28579021, SID7976602	873166	InChI=1S/C15H21NO3/c1-18-12-7-6-11(10-13(12)19-2)15(14(16)17)8-4-3-5-9-15/h6-7,10H,3-5,8-9H2,1-2H3,(H2,16,17)	ZUYMXBMGAFZKDR-UHFFFAOYSA-N	COc1ccc(cc1OC)C2(CCCCC2)C(=O)N	BroadT	BRD-K28579021	BRD-K28579021-001-05-0	ChemBridge Corporation	5806618			COc1ccc(cc1OC)C1(CCCCC1)C(N)=O	InChI=1S/C15H21NO3/c1-18-12-7-6-11(10-13(12)19-2)15(14(16)17)8-4-3-5-9-15/h6-7,10H,3-5,8-9H2,1-2H3,(H2,16,17)	ZUYMXBMGAFZKDR-UHFFFAOYSA-N	263.152143542							121675
MLS000334052	LSM-33119	BRD-K65410345, SID17515976	2111621	InChI=1S/C18H20ClNO2S/c1-13-11-14(19)8-9-17(13)22-10-4-7-18(21)20-15-5-3-6-16(12-15)23-2/h3,5-6,8-9,11-12H,4,7,10H2,1-2H3,(H,20,21)	QYUAQMKYPOOVBA-UHFFFAOYSA-N	CSc1cccc(NC(=O)CCCOc2ccc(Cl)cc2C)c1	BroadT	BRD-K65410345	BRD-K65410345-001-05-1	Enamine Ltd.	T5241914			CSc1cccc(NC(=O)CCCOc2ccc(Cl)cc2C)c1	InChI=1S/C18H20ClNO2S/c1-13-11-14(19)8-9-17(13)22-10-4-7-18(21)20-15-5-3-6-16(12-15)23-2/h3,5-6,8-9,11-12H,4,7,10H2,1-2H3,(H,20,21)	QYUAQMKYPOOVBA-UHFFFAOYSA-N	349.09032729							121676
AC1LFQTH	LSM-33120	BRD-K14144134, SID47198688	782428	InChI=1S/C18H22N2O2/c1-2-22-18(21)20-11-9-19(10-12-20)14-15-7-8-16-5-3-4-6-17(16)13-15/h3-8,13H,2,9-12,14H2,1H3	XFPKYFMNRUXDOP-UHFFFAOYSA-N	CCOC(=O)N1CCN(Cc2ccc3ccccc3c2)CC1	BroadT	BRD-K14144134	BRD-K14144134-001-05-3	ChemBridge Corporation	5421356			CCOC(=O)N1CCN(Cc2ccc3ccccc3c2)CC1	InChI=1S/C18H22N2O2/c1-2-22-18(21)20-11-9-19(10-12-20)14-15-7-8-16-5-3-4-6-17(16)13-15/h3-8,13H,2,9-12,14H2,1H3	XFPKYFMNRUXDOP-UHFFFAOYSA-N	298.168127964							121677
N-(2-Cyanocyclopent-1-en-1-yl)-1-ethyl-1H-pyrazole-3-carboxamide	LSM-33121	SID14727244, BRD-K38240683	891902	InChI=1S/C12H14N4O/c1-2-16-7-6-11(15-16)12(17)14-10-5-3-4-9(10)8-13/h6-7H,2-5H2,1H3,(H,14,17)	UXRZWQHCEIXAAF-UHFFFAOYSA-N	CCn1ccc(n1)C(=O)NC2=C(CCC2)C#N	BroadT	BRD-K38240683	BRD-K38240683-001-05-6	Asinex Ltd.	BAS 08302895			CCn1ccc(n1)C(=O)NC1=C(CCC1)C#N	InChI=1S/C12H14N4O/c1-2-16-7-6-11(15-16)12(17)14-10-5-3-4-9(10)8-13/h6-7H,2-5H2,1H3,(H,14,17)	UXRZWQHCEIXAAF-UHFFFAOYSA-N	230.116761108							121678
MLS000388732	LSM-33122	BRD-K87010860, SID24781096	2415900	InChI=1S/C17H10ClF3N4O4S/c18-10-4-9(17(19,20)21)5-22-14(10)23-13(26)6-30-16-25-24-15(29-16)8-1-2-11-12(3-8)28-7-27-11/h1-5H,6-7H2,(H,22,23,26)	KFKAEUKQQVPHHY-UHFFFAOYSA-N	FC(F)(F)c1cnc(NC(=O)CSc2oc(nn2)c3ccc4OCOc4c3)c(Cl)c1	BroadT	BRD-K87010860	BRD-K87010860-001-07-4	Enamine Ltd.	T0515-5153			FC(F)(F)c1cnc(NC(=O)CSc2nnc(o2)-c2ccc3OCOc3c2)c(Cl)c1	InChI=1S/C17H10ClF3N4O4S/c18-10-4-9(17(19,20)21)5-22-14(10)23-13(26)6-30-16-25-24-15(29-16)8-1-2-11-12(3-8)28-7-27-11/h1-5H,6-7H2,(H,22,23,26)	KFKAEUKQQVPHHY-UHFFFAOYSA-N	458.00633784							121679
T5252331	LSM-33123	BRD-K05444553, SID24840081, SID3713022	2161195	InChI=1S/C20H23N5O3S3/c1-2-25-19(17-9-6-14-29-17)21-22-20(25)30-15-18(26)23-10-12-24(13-11-23)31(27,28)16-7-4-3-5-8-16/h3-9,14H,2,10-13,15H2,1H3	KCJOEEKCOVYHCV-UHFFFAOYSA-N	CCn1c(SCC(=O)N2CCN(CC2)S(=O)(=O)c3ccccc3)nnc1c4cccs4	BroadT	BRD-K05444553	BRD-K05444553-001-05-0	Enamine Ltd.	T5252331			CCn1c(SCC(=O)N2CCN(CC2)S(=O)(=O)c2ccccc2)nnc1-c1cccs1	InChI=1S/C20H23N5O3S3/c1-2-25-19(17-9-6-14-29-17)21-22-20(25)30-15-18(26)23-10-12-24(13-11-23)31(27,28)16-7-4-3-5-8-16/h3-9,14H,2,10-13,15H2,1H3	KCJOEEKCOVYHCV-UHFFFAOYSA-N	477.096301716							121680
AN-329/14724240	LSM-33124	BRD-K69337311, SID17506023	1010542	InChI=1S/C24H23N3O3/c1-2-21(28)25-20-15-13-19(14-16-20)23(29)26-27-24(30)22(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-16,22H,2H2,1H3,(H,25,28)(H,26,29)(H,27,30)	OETHIAWOSWUCCQ-UHFFFAOYSA-N	CCC(=O)Nc1ccc(cc1)C(=O)NNC(=O)C(c2ccccc2)c3ccccc3	BroadT	BRD-K69337311	BRD-K69337311-001-05-2	Asinex Ltd.	BAS 02227380			CCC(=O)Nc1ccc(cc1)C(=O)NNC(=O)C(c1ccccc1)c1ccccc1	InChI=1S/C24H23N3O3/c1-2-21(28)25-20-15-13-19(14-16-20)23(29)26-27-24(30)22(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-16,22H,2H2,1H3,(H,25,28)(H,26,29)(H,27,30)	OETHIAWOSWUCCQ-UHFFFAOYSA-N	401.173941626							121681
T0509-0290	LSM-33125	BRD-K51167279, SID24827341	4070617	InChI=1S/C13H14N4O4S/c1-16-6-5-14-13(16)22-8-12(18)15-10-4-3-9(17(19)20)7-11(10)21-2/h3-7H,8H2,1-2H3,(H,15,18)	CYLFWHNOSNTHJM-UHFFFAOYSA-N	COc1cc(ccc1NC(=O)CSc2nccn2C)[N+](=O)[O-]	BroadT	BRD-K51167279	BRD-K51167279-001-06-1	Enamine Ltd.	T0509-0290			COc1cc(ccc1NC(=O)CSc1nccn1C)[N+]([O-])=O	InChI=1S/C13H14N4O4S/c1-16-6-5-14-13(16)22-8-12(18)15-10-4-3-9(17(19)20)7-11(10)21-2/h3-7H,8H2,1-2H3,(H,15,18)	CYLFWHNOSNTHJM-UHFFFAOYSA-N	322.073575658							121682
SMR000130975	LSM-33126	BRD-A87325732, SID14735310	9550667	InChI=1S/C21H22N4O3/c1-14(20(26)22-11-6-9-16-7-4-3-5-8-16)25-21(27)18-13-19-17(10-12-28-19)24(18)15(2)23-25/h3-5,7-8,10,12-14H,6,9,11H2,1-2H3,(H,22,26)	QUWPWWKCQMOYAM-UHFFFAOYSA-N	CC(N1N=C(C)n2c(cc3occc23)C1=O)C(=O)NCCCc4ccccc4	BroadT	BRD-A87325732	BRD-A87325732-001-06-6	ChemDiv Inc.	C887-0696			CC(C(=O)NCCCc1ccccc1)n1nc(C)n2c3ccoc3cc2c1=O	InChI=1S/C21H22N4O3/c1-14(20(26)22-11-6-9-16-7-4-3-5-8-16)25-21(27)18-13-19-17(10-12-28-19)24(18)15(2)23-25/h3-5,7-8,10,12-14H,6,9,11H2,1-2H3,(H,22,26)	QUWPWWKCQMOYAM-UHFFFAOYSA-N	378.169190604							121683
SMR000471075	LSM-33127	SID49729274, BRD-K49094605	24792614	InChI=1S/C27H29N3O5/c1-15-8-7-9-17(14-15)28-24(33)27(5)20-19(22(31)30(23(20)32)26(2,3)4)21(29(27)25(28)34)16-10-12-18(35-6)13-11-16/h7-14,19-21H,1-6H3/t19-,20-,21-,27-/m1/s1	NERIXVBLWZYAJP-NUFXCCFXSA-N	COc1ccc(cc1)[C@@H]2[C@H]3[C@H](C(=O)N(C3=O)C(C)(C)C)[C@@]4(C)N2C(=O)N(C4=O)c5cccc(C)c5	BroadT	BRD-K49094605	BRD-K49094605-001-05-9	Fluorous Technologies Inc.	FTI0401-076			COc1ccc(cc1)[C@@H]1[C@H]2[C@H](C(=O)N(C2=O)C(C)(C)C)[C@@]2(C)N1C(=O)N(C2=O)c1cccc(C)c1	InChI=1S/C27H29N3O5/c1-15-8-7-9-17(14-15)28-24(33)27(5)20-19(22(31)30(23(20)32)26(2,3)4)21(29(27)25(28)34)16-10-12-18(35-6)13-11-16/h7-14,19-21H,1-6H3/t19-,20-,21-,27-/m1/s1	NERIXVBLWZYAJP-NUFXCCFXSA-N	475.210721058							121684
AC1LP9VV	LSM-33128	BRD-K13973870	1303519	InChI=1S/C16H13N5O3S/c22-21(23)14-9-5-4-6-12(14)10-17-20-15(18-19-16(20)25)11-24-13-7-2-1-3-8-13/h1-10H,11H2,(H,19,25)	OMPGJOQTZBOCKG-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1C=Nn2c(S)nnc2COc3ccccc3	BroadT	BRD-K13973870	BRD-K13973870-001-05-4	ChemBridge Corporation	7175647			[O-][N+](=O)c1ccccc1C=Nn1c(S)nnc1COc1ccccc1	InChI=1S/C16H13N5O3S/c22-21(23)14-9-5-4-6-12(14)10-17-20-15(18-19-16(20)25)11-24-13-7-2-1-3-8-13/h1-10H,11H2,(H,19,25)	OMPGJOQTZBOCKG-UHFFFAOYSA-N	355.073910016							121685
SMR000017337	LSM-33129	BRD-K13436682, SID56436797, SID7969983	1356309	InChI=1S/C16H15N3O3S3/c1-19(2)25(21,22)12-7-5-11(6-8-12)15(20)18-16-17-13(10-24-16)14-4-3-9-23-14/h3-10H,1-2H3,(H,17,18,20)	OZCWRZJOJLPDDW-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc2nc(cs2)c3cccs3	BroadT	BRD-K13436682	BRD-K13436682-001-04-3	Life Chemicals Inc.	F0012-0510			CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nc(cs1)-c1cccs1	InChI=1S/C16H15N3O3S3/c1-19(2)25(21,22)12-7-5-11(6-8-12)15(20)18-16-17-13(10-24-16)14-4-3-9-23-14/h3-10H,1-2H3,(H,17,18,20)	OZCWRZJOJLPDDW-UHFFFAOYSA-N	393.02755344							121686
MLS000698896	LSM-33130	BRD-K06116445, SID22404540	1208701	InChI=1S/C25H21N3O3S/c1-15-5-10-18(11-6-15)28-23(31)13-21(29)27-25(28)32-14-22(30)26-20-12-9-17-8-7-16-3-2-4-19(20)24(16)17/h2-6,9-13,31H,7-8,14H2,1H3,(H,26,30)	ZQNUNQRGOJDGNG-UHFFFAOYSA-N	Cc1ccc(cc1)N2C(=CC(=O)N=C2SCC(=O)Nc3ccc4CCc5cccc3c45)O	BroadT	BRD-K06116445	BRD-K06116445-001-06-3	Specs	AH-487/40669578			Cc1ccc(cc1)-n1c(O)cc(=O)nc1SCC(=O)Nc1ccc2CCc3cccc1c23	InChI=1S/C25H21N3O3S/c1-15-5-10-18(11-6-15)28-23(31)13-21(29)27-25(28)32-14-22(30)26-20-12-9-17-8-7-16-3-2-4-19(20)24(16)17/h2-6,9-13,31H,7-8,14H2,1H3,(H,26,30)	ZQNUNQRGOJDGNG-UHFFFAOYSA-N	443.130362252							121687
AC1O8HVC	LSM-33131	BRD-K10460649, SID24824618	6668566	InChI=1S/C23H27NO7/c25-9-3-4-10-29-21-14-16(13-20(31-21)23(27)24-7-11-28-12-8-24)18-15-30-19-6-2-1-5-17(19)22(18)26/h1-2,5-6,13,15-16,21,25H,3-4,7-12,14H2/t16-,21+/m1/s1	JRNZEKJOUABUSM-IERDGZPVSA-N	OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCOCC2)C3=COc4ccccc4C3=O	BroadT	BRD-K10460649	BRD-K10460649-001-06-3	Harvard University	3-((2S,4S)-2-(4-hydroxybutoxy)-6-(morpholine-4-carbonyl)-3,4-dihydro-2H-pyran-4-yl)-4H-chromen-4-one DHPC11_001235			OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N1CCOCC1)c1coc2ccccc2c1=O	InChI=1S/C23H27NO7/c25-9-3-4-10-29-21-14-16(13-20(31-21)23(27)24-7-11-28-12-8-24)18-15-30-19-6-2-1-5-17(19)22(18)26/h1-2,5-6,13,15-16,21,25H,3-4,7-12,14H2/t16-,21+/m1/s1	JRNZEKJOUABUSM-IERDGZPVSA-N	429.178752214							121688
HMS2899C05	LSM-33132	BRD-K76210487	24789778	InChI=1S/C17H21N9O2/c1-25(2)11-13-14(20-24-26(13)16-15(18)22-28-23-16)17(27)21-19-10-6-9-12-7-4-3-5-8-12/h3-5,7-8,10H,6,9,11H2,1-2H3,(H2,18,22)(H,21,27)	IARUDCZFHJJBRS-UHFFFAOYSA-N	CN(C)Cc1c(nnn1c2nonc2N)C(=O)NN=CCCc3ccccc3	BroadT	BRD-K76210487	BRD-K76210487-001-06-8	ChemDiv Inc.	6011-0545			CN(C)Cc1c(nnn1-c1nonc1N)C(=O)NN=CCCc1ccccc1	InChI=1S/C17H21N9O2/c1-25(2)11-13-14(20-24-26(13)16-15(18)22-28-23-16)17(27)21-19-10-6-9-12-7-4-3-5-8-12/h3-5,7-8,10H,6,9,11H2,1-2H3,(H2,18,22)(H,21,27)	IARUDCZFHJJBRS-UHFFFAOYSA-N	383.181821002							121689
N-(4-Anilinophenyl)-3,4-dimethoxybenzamide	LSM-33133	BRD-K00507184, SID47196247	868113	InChI=1S/C21H20N2O3/c1-25-19-13-8-15(14-20(19)26-2)21(24)23-18-11-9-17(10-12-18)22-16-6-4-3-5-7-16/h3-14,22H,1-2H3,(H,23,24)	BBICUVDUPYBGLP-UHFFFAOYSA-N	COc1ccc(cc1OC)C(=O)Nc2ccc(Nc3ccccc3)cc2	BroadT	BRD-K00507184	BRD-K00507184-001-05-6	ChemBridge Corporation	5689134			COc1ccc(cc1OC)C(=O)Nc1ccc(Nc2ccccc2)cc1	InChI=1S/C21H20N2O3/c1-25-19-13-8-15(14-20(19)26-2)21(24)23-18-11-9-17(10-12-18)22-16-6-4-3-5-7-16/h3-14,22H,1-2H3,(H,23,24)	BBICUVDUPYBGLP-UHFFFAOYSA-N	348.14739252							121690
STK179283	LSM-33134	SID4264223, BRD-K57626519	787692	InChI=1S/C21H20N2O/c24-21(19-11-10-17-6-4-5-7-18(17)16-19)23-14-12-22(13-15-23)20-8-2-1-3-9-20/h1-11,16H,12-15H2	BSUMYVWBDXAJKX-UHFFFAOYSA-N	O=C(N1CCN(CC1)c2ccccc2)c3ccc4ccccc4c3	BroadT	BRD-K57626519	BRD-K57626519-001-05-2	ChemBridge Corporation	5185399			O=C(N1CCN(CC1)c1ccccc1)c1ccc2ccccc2c1	InChI=1S/C21H20N2O/c24-21(19-11-10-17-6-4-5-7-18(17)16-19)23-14-12-22(13-15-23)20-8-2-1-3-9-20/h1-11,16H,12-15H2	BSUMYVWBDXAJKX-UHFFFAOYSA-N	316.15756328							121691
AC1LSXH4	LSM-33135	BRD-K46149271	1473007	InChI=1S/C14H13N3O3/c1-10(13-9-15-7-8-16-13)17-20-14(18)11-3-5-12(19-2)6-4-11/h3-9H,1-2H3	LJQSQFNRJNKCTF-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)ON=C(C)c2cnccn2	BroadT	BRD-K46149271	BRD-K46149271-001-06-5	Key Organics Ltd.	2W-0880			COc1ccc(cc1)C(=O)ON=C(C)c1cnccn1	InChI=1S/C14H13N3O3/c1-10(13-9-15-7-8-16-13)17-20-14(18)11-3-5-12(19-2)6-4-11/h3-9H,1-2H3	LJQSQFNRJNKCTF-UHFFFAOYSA-N	271.095691306							121692
MLS000029600	LSM-33136	BRD-K13049124, SID842333	644592	InChI=1S/C16H14N2O3/c19-15(17-12-6-2-1-3-7-12)10-11-18-13-8-4-5-9-14(13)21-16(18)20/h1-9H,10-11H2,(H,17,19)	IUGHQEKVXISSCI-UHFFFAOYSA-N	O=C(CCN1C(=O)Oc2ccccc12)Nc3ccccc3	BroadT	BRD-K13049124	BRD-K13049124-001-06-5	Asinex Ltd.	BAS 00096958			O=C(CCn1c2ccccc2oc1=O)Nc1ccccc1	InChI=1S/C16H14N2O3/c19-15(17-12-6-2-1-3-7-12)10-11-18-13-8-4-5-9-14(13)21-16(18)20/h1-9H,10-11H2,(H,17,19)	IUGHQEKVXISSCI-UHFFFAOYSA-N	282.100442328							121693
MLS000708699	LSM-33137	BRD-K62102480, SID24806302	894044	InChI=1S/C16H15N3O3/c1-10-17-14-9-12(5-8-15(14)22-10)19-16(20)18-11-3-6-13(21-2)7-4-11/h3-9H,1-2H3,(H2,18,19,20)	CHSUNINMMIQXAL-UHFFFAOYSA-N	COc1ccc(NC(=O)Nc2ccc3oc(C)nc3c2)cc1	BroadT	BRD-K62102480	BRD-K62102480-001-05-2	Asinex Ltd.	BAS 06316514			COc1ccc(NC(=O)Nc2ccc3oc(C)nc3c2)cc1	InChI=1S/C16H15N3O3/c1-10-17-14-9-12(5-8-15(14)22-10)19-16(20)18-11-3-6-13(21-2)7-4-11/h3-9H,1-2H3,(H2,18,19,20)	CHSUNINMMIQXAL-UHFFFAOYSA-N	297.11134137							121694
SMR000031898	LSM-33138	BRD-K95558029, SID4250640	3244424	InChI=1S/C22H24N2O5S/c1-14-5-4-6-19(15(14)2)23-22(25)21-16(3)18-13-17(7-8-20(18)29-21)30(26,27)24-9-11-28-12-10-24/h4-8,13H,9-12H2,1-3H3,(H,23,25)	IVAPURSBEFYBCS-UHFFFAOYSA-N	Cc1cccc(NC(=O)c2oc3ccc(cc3c2C)S(=O)(=O)N4CCOCC4)c1C	BroadT	BRD-K95558029	BRD-K95558029-001-05-4	ChemDiv Inc.	K786-1307			Cc1c(oc2ccc(cc12)S(=O)(=O)N1CCOCC1)C(=O)Nc1cccc(C)c1C	InChI=1S/C22H24N2O5S/c1-14-5-4-6-19(15(14)2)23-22(25)21-16(3)18-13-17(7-8-20(18)29-21)30(26,27)24-9-11-28-12-10-24/h4-8,13H,9-12H2,1-3H3,(H,23,25)	IVAPURSBEFYBCS-UHFFFAOYSA-N	428.140592578							121695
AC1O9F3L	LSM-33139	BRD-K53110645, SID4264467, SID7965986	6756926	InChI=1S/C11H9F3N2O2/c1-5-3-6(2)15-10(17)9(5)7-4-8(16-18-7)11(12,13)14/h3-4H,1-2H3,(H,15,17)	GDFROHHQWZKCGS-UHFFFAOYSA-N	Cc1cc(C)c(c(O)n1)c2onc(c2)C(F)(F)F	BroadT	BRD-K53110645	BRD-K53110645-001-04-1	ChemBridge Corporation	7882740			Cc1cc(C)c(-c2cc(no2)C(F)(F)F)c(=O)[nH]1	InChI=1S/C11H9F3N2O2/c1-5-3-6(2)15-10(17)9(5)7-4-8(16-18-7)11(12,13)14/h3-4H,1-2H3,(H,15,17)	GDFROHHQWZKCGS-UHFFFAOYSA-N	258.061612148							
OPREA1_167349	LSM-33140	SID24821981, BRD-K07861364	4151779	InChI=1S/C16H11FN2O3S/c1-22-15(21)9-6-7-10-12(8-9)18-16(23)19(14(10)20)13-5-3-2-4-11(13)17/h2-8H,1H3,(H,18,23)	ITLBCMGUJLLOCN-UHFFFAOYSA-N	COC(=O)c1ccc2C(=O)N(C(=S)Nc2c1)c3ccccc3F	BroadT	BRD-K07861364	BRD-K07861364-001-05-2	ChemDiv Inc.	A0060788			COC(=O)c1ccc2c(c1)[nH]c(=S)n(-c1ccccc1F)c2=O	InChI=1S/C16H11FN2O3S/c1-22-15(21)9-6-7-10-12(8-9)18-16(23)19(14(10)20)13-5-3-2-4-11(13)17/h2-8H,1H3,(H,18,23)	ITLBCMGUJLLOCN-UHFFFAOYSA-N	330.047441122							121697
MLS001242663	LSM-33141	BRD-K09450441, SID49729259	24792599	InChI=1S/C22H36F3N3O/c1-26-14-20(13-17-6-3-2-4-7-17)28-15-21(16-29)27-11-10-18-8-5-9-19(12-18)22(23,24)25/h5,8-9,12,17,20-21,26-29H,2-4,6-7,10-11,13-16H2,1H3/t20-,21+/m0/s1	QHEJTEZIIWTDPM-LEWJYISDSA-N	CNC[C@H](CC1CCCCC1)NC[C@H](CO)NCCc2cccc(c2)C(F)(F)F	BroadT	BRD-K09450441	BRD-K09450441-001-06-7	Torrey Pines Institute for Molecular Studies	1665-119			CNC[C@H](CC1CCCCC1)NC[C@H](CO)NCCc1cccc(c1)C(F)(F)F	InChI=1S/C22H36F3N3O/c1-26-14-20(13-17-6-3-2-4-7-17)28-15-21(16-29)27-11-10-18-8-5-9-19(12-18)22(23,24)25/h5,8-9,12,17,20-21,26-29H,2-4,6-7,10-11,13-16H2,1H3/t20-,21+/m0/s1	QHEJTEZIIWTDPM-LEWJYISDSA-N	415.281047402							121698
MLS000535370	LSM-33142	BRD-K25137119, SID14738747	897458	InChI=1S/C15H17NO2/c1-9-7-10(2)14(11(3)8-9)16-15(17)13-5-6-18-12(13)4/h5-8H,1-4H3,(H,16,17)	LSIWXDPULIKEFZ-UHFFFAOYSA-N	Cc1cc(C)c(NC(=O)c2ccoc2C)c(C)c1	BroadT	BRD-K25137119	BRD-K25137119-001-05-3	ChemBridge Corporation	7252257			Cc1occc1C(=O)Nc1c(C)cc(C)cc1C	InChI=1S/C15H17NO2/c1-9-7-10(2)14(11(3)8-9)16-15(17)13-5-6-18-12(13)4/h5-8H,1-4H3,(H,16,17)	LSIWXDPULIKEFZ-UHFFFAOYSA-N	243.125928794							121699
SMR000127845	LSM-33143	BRD-K63171151, SID14737309	9550988	InChI=1S/C13H13ClN2O2/c1-3-9-4-6-10(7-5-9)15-13(17)12-11(14)8(2)16-18-12/h4-7H,3H2,1-2H3,(H,15,17)	LJIYYBNCQZTMPA-UHFFFAOYSA-N	CCc1ccc(NC(=O)c2onc(C)c2Cl)cc1	BroadT	BRD-K63171151	BRD-K63171151-001-04-7	ChemDiv Inc.	C625-0117			CCc1ccc(NC(=O)c2onc(C)c2Cl)cc1	InChI=1S/C13H13ClN2O2/c1-3-9-4-6-10(7-5-9)15-13(17)12-11(14)8(2)16-18-12/h4-7H,3H2,1-2H3,(H,15,17)	LJIYYBNCQZTMPA-UHFFFAOYSA-N	264.066555386							121700
AC1LSMMQ	LSM-33144	BRD-K86008496, SID14726610	1441533	InChI=1S/C24H24FN5/c1-2-28-11-13-29(14-12-28)24-17-21(18-7-4-3-5-8-18)26-23-16-22(27-30(23)24)19-9-6-10-20(25)15-19/h3-10,15-17H,2,11-14H2,1H3	KNLBJJWWKPSMLJ-UHFFFAOYSA-N	CCN1CCN(CC1)c2cc(nc3cc(nn23)c4cccc(F)c4)c5ccccc5	BroadT	BRD-K86008496	BRD-K86008496-001-06-3	Asinex Ltd.	ASN 08736330			CCN1CCN(CC1)c1cc(nc2cc(nn12)-c1cccc(F)c1)-c1ccccc1	InChI=1S/C24H24FN5/c1-2-28-11-13-29(14-12-28)24-17-21(18-7-4-3-5-8-18)26-23-16-22(27-30(23)24)19-9-6-10-20(25)15-19/h3-10,15-17H,2,11-14H2,1H3	KNLBJJWWKPSMLJ-UHFFFAOYSA-N	401.201574018							121701
MLS000583053	LSM-33145	BRD-K20355073, SID17510103	3342380	InChI=1S/C14H12F3N3S/c1-9-4-2-7-12(18-9)20-13(21)19-11-6-3-5-10(8-11)14(15,16)17/h2-8H,1H3,(H2,18,19,20,21)	YOLTWYWCCNWVTL-UHFFFAOYSA-N	Cc1cccc(N=C(S)Nc2cccc(c2)C(F)(F)F)n1	BroadT	BRD-K20355073	BRD-K20355073-001-05-0	ChemDiv Inc.	C270-0088			Cc1cccc(N=C(S)Nc2cccc(C(F)(F)F)c2)n1	InChI=1S/C14H12F3N3S/c1-9-4-2-7-12(18-9)20-13(21)19-11-6-3-5-10(8-11)14(15,16)17/h2-8H,1H3,(H2,18,19,20,21)	YOLTWYWCCNWVTL-UHFFFAOYSA-N	311.070402704							121702
N-(2-Ethoxyphenyl)-1H-benzimidazol-2-amine	LSM-33146	BRD-K23860926, SID4264362	923991	InChI=1S/C15H15N3O/c1-2-19-14-10-6-5-9-13(14)18-15-16-11-7-3-4-8-12(11)17-15/h3-10H,2H2,1H3,(H2,16,17,18)	MHDRXRCSSCURNQ-UHFFFAOYSA-N	CCOc1ccccc1Nc2nc3ccccc3[nH]2	BroadT	BRD-K23860926	BRD-K23860926-001-05-5	ChemBridge Corporation	7772044			CCOc1ccccc1Nc1nc2ccccc2[nH]1	InChI=1S/C15H15N3O/c1-2-19-14-10-6-5-9-13(14)18-15-16-11-7-3-4-8-12(11)17-15/h3-10H,2H2,1H3,(H2,16,17,18)	MHDRXRCSSCURNQ-UHFFFAOYSA-N	253.12151213							121703
MLS000097626	LSM-33147	SID3717026, SID124887563, BRD-A59995060	2999845	InChI=1S/C15H17N3OS/c1-4-10(2)18-14(19)12-7-5-6-8-13(12)17-15(18)20-11(3)9-16/h5-8,10-11H,4H2,1-3H3	XQKDWOZTCSCTKC-UHFFFAOYSA-N	CCC(C)N1C(=Nc2ccccc2C1=O)SC(C)C#N	BroadT	BRD-A59995060	BRD-A59995060-001-06-2	Enamine Ltd.	ZT-7254235			CCC(C)n1c(SC(C)C#N)nc2ccccc2c1=O	InChI=1S/C15H17N3OS/c1-4-10(2)18-14(19)12-7-5-6-8-13(12)17-15(18)20-11(3)9-16/h5-8,10-11H,4H2,1-3H3	XQKDWOZTCSCTKC-UHFFFAOYSA-N	287.109232884							121704
SMR000127208	LSM-33148	BRD-K59028365, SID14733408, SID56373906	9550485	InChI=1S/C16H10ClN3O2S3/c17-13-7-8-14(23-13)25(21,22)20-11-5-3-10(4-6-11)15-19-12-2-1-9-18-16(12)24-15/h1-9,20H	QVZKFARLCPMITB-UHFFFAOYSA-N	Clc1ccc(s1)S(=O)(=O)Nc2ccc(cc2)c3nc4cccnc4s3	BroadT	BRD-K59028365	BRD-K59028365-001-05-4	Life Chemicals Inc.	F0695-0008			Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cccnc2s1	InChI=1S/C16H10ClN3O2S3/c17-13-7-8-14(23-13)25(21,22)20-11-5-3-10(4-6-11)15-19-12-2-1-9-18-16(12)24-15/h1-9,20H	QVZKFARLCPMITB-UHFFFAOYSA-N	406.96236637							121705
T0520-8979	LSM-33149	BRD-K33606963, SID14743993	2472510	InChI=1S/C17H16Cl2N2O5S/c1-11-13(18)9-20-17(16(11)19)21-14(22)10-26-15(23)7-8-27(24,25)12-5-3-2-4-6-12/h2-6,9H,7-8,10H2,1H3,(H,20,21,22)	KLKYRRPAKBREKC-UHFFFAOYSA-N	Cc1c(Cl)cnc(NC(=O)COC(=O)CCS(=O)(=O)c2ccccc2)c1Cl	BroadT	BRD-K33606963	BRD-K33606963-001-05-4	Enamine Ltd.	T0520-8979			Cc1c(Cl)cnc(NC(=O)COC(=O)CCS(=O)(=O)c2ccccc2)c1Cl	InChI=1S/C17H16Cl2N2O5S/c1-11-13(18)9-20-17(16(11)19)21-14(22)10-26-15(23)7-8-27(24,25)12-5-3-2-4-6-12/h2-6,9H,7-8,10H2,1H3,(H,20,21,22)	KLKYRRPAKBREKC-UHFFFAOYSA-N	430.015697742							121706
T0518-3825	LSM-33150	BRD-K73355908, SID22408071	4204052	InChI=1S/C22H30N2O8S/c1-4-30-21(28)17-13(3)18(22(29)31-5-2)33-20(17)24-15(25)12-32-16(26)11-23-19(27)14-9-7-6-8-10-14/h14H,4-12H2,1-3H3,(H,23,27)(H,24,25)	NFLAMWCWTZFAFU-UHFFFAOYSA-N	CCOC(=O)c1sc(NC(=O)COC(=O)CNC(=O)C2CCCCC2)c(C(=O)OCC)c1C	BroadT	BRD-K73355908	BRD-K73355908-001-05-7	Enamine Ltd.	T0518-3825			CCOC(=O)c1sc(NC(=O)COC(=O)CNC(=O)C2CCCCC2)c(C(=O)OCC)c1C	InChI=1S/C22H30N2O8S/c1-4-30-21(28)17-13(3)18(22(29)31-5-2)33-20(17)24-15(25)12-32-16(26)11-23-19(27)14-9-7-6-8-10-14/h14H,4-12H2,1-3H3,(H,23,27)(H,24,25)	NFLAMWCWTZFAFU-UHFFFAOYSA-N	482.17228663							121707
5-(3,4-Dimethoxyphenyl)-2-piperidin-1-yl[1,3]thiazolo[4,5-b]pyridine-7-carboxylic acid	LSM-33151	BRD-K34044309, SID22409106	2560376	InChI=1S/C20H21N3O4S/c1-26-15-7-6-12(10-16(15)27-2)14-11-13(19(24)25)17-18(21-14)22-20(28-17)23-8-4-3-5-9-23/h6-7,10-11H,3-5,8-9H2,1-2H3,(H,24,25)	ZBLKPNYMTKPSHR-UHFFFAOYSA-N	COc1ccc(cc1OC)c2cc(C(=O)O)c3sc(nc3n2)N4CCCCC4	BroadT	BRD-K34044309	BRD-K34044309-001-05-0	Enamine Ltd.	T5342188			COc1ccc(cc1OC)-c1cc(C(O)=O)c2sc(nc2n1)N1CCCCC1	InChI=1S/C20H21N3O4S/c1-26-15-7-6-12(10-16(15)27-2)14-11-13(19(24)25)17-18(21-14)22-20(28-17)23-8-4-3-5-9-23/h6-7,10-11H,3-5,8-9H2,1-2H3,(H,24,25)	ZBLKPNYMTKPSHR-UHFFFAOYSA-N	399.125276872							121708
T0519-8303	LSM-33152	SID24829050, BRD-K76215709	3283243	InChI=1S/C16H13NO5S/c18-13(7-22-16(20)5-10-3-4-23-9-10)11-1-2-14-12(6-11)17-15(19)8-21-14/h1-4,6,9H,5,7-8H2,(H,17,19)	RPBLBXIJFQOTJW-UHFFFAOYSA-N	O=C(Cc1ccsc1)OCC(=O)c2ccc3OCC(=O)Nc3c2	BroadT	BRD-K76215709	BRD-K76215709-001-06-9	Enamine Ltd.	T0519-8303			O=C(Cc1ccsc1)OCC(=O)c1ccc2OCC(=O)Nc2c1	InChI=1S/C16H13NO5S/c18-13(7-22-16(20)5-10-3-4-23-9-10)11-1-2-14-12(6-11)17-15(19)8-21-14/h1-4,6,9H,5,7-8H2,(H,17,19)	RPBLBXIJFQOTJW-UHFFFAOYSA-N	331.051443216							121709
MLS000574048	LSM-33153	BRD-K29320859, SID17412844	1925990	InChI=1S/C17H13ClN2S/c1-2-10-21-17-19-15-9-8-13(18)11-14(15)16(20-17)12-6-4-3-5-7-12/h2-9,11H,1,10H2	KEIAOISRJDRXMT-UHFFFAOYSA-N	Clc1ccc2nc(SCC=C)nc(c3ccccc3)c2c1	BroadT	BRD-K29320859	BRD-K29320859-001-06-3	ChemBridge Corporation	6607969			Clc1ccc2nc(SCC=C)nc(-c3ccccc3)c2c1	InChI=1S/C17H13ClN2S/c1-2-10-21-17-19-15-9-8-13(18)11-14(15)16(20-17)12-6-4-3-5-7-12/h2-9,11H,1,10H2	KEIAOISRJDRXMT-UHFFFAOYSA-N	312.048796836							121710
ST50763208	LSM-33154	BRD-K44193634, SID17432831	892179	InChI=1S/C17H20N2OS/c1-13(2)12-18-17(21)19-14-8-10-16(11-9-14)20-15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3,(H2,18,19,21)	CMJMBPUZPUWRII-UHFFFAOYSA-N	CC(C)CN=C(S)Nc1ccc(Oc2ccccc2)cc1	BroadT	BRD-K44193634	BRD-K44193634-001-05-9	ChemBridge Corporation	7521228			CC(C)CN=C(S)Nc1ccc(Oc2ccccc2)cc1	InChI=1S/C17H20N2OS/c1-13(2)12-18-17(21)19-14-8-10-16(11-9-14)20-15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3,(H2,18,19,21)	CMJMBPUZPUWRII-UHFFFAOYSA-N	300.12963397							121711
AC1MDXHJ	LSM-33155	BRD-K16496140	2844520	InChI=1S/C13H18N6/c1-13(2,3)11-6-4-10(5-7-11)8-15-17-12-18-16-9-19(12)14/h4-9H,14H2,1-3H3,(H,17,18)	CZTPFVJLANCIEZ-UHFFFAOYSA-N	CC(C)(C)c1ccc(C=NNc2nncn2N)cc1	BroadT	BRD-K16496140	BRD-K16496140-001-05-7	ChemBridge Corporation	5380975			CC(C)(C)c1ccc(C=NNc2nncn2N)cc1	InChI=1S/C13H18N6/c1-13(2,3)11-6-4-10(5-7-11)8-15-17-12-18-16-9-19(12)14/h4-9H,14H2,1-3H3,(H,17,18)	CZTPFVJLANCIEZ-UHFFFAOYSA-N	258.159294636							121712
MLS000334897	LSM-33156	BRD-K29992178, SID22406262	4693103	InChI=1S/C18H18F2N2O3S/c1-22(2)16(23)11-25-17(24)14-5-3-4-6-15(14)21-12-7-9-13(10-8-12)26-18(19)20/h3-10,18,21H,11H2,1-2H3	JLZDKNJXWPLGFL-UHFFFAOYSA-N	CN(C)C(=O)COC(=O)c1ccccc1Nc2ccc(SC(F)F)cc2	BroadT	BRD-K29992178	BRD-K29992178-001-05-5	Enamine Ltd.	T5225803			CN(C)C(=O)COC(=O)c1ccccc1Nc1ccc(SC(F)F)cc1	InChI=1S/C18H18F2N2O3S/c1-22(2)16(23)11-25-17(24)14-5-3-4-6-15(14)21-12-7-9-13(10-8-12)26-18(19)20/h3-10,18,21H,11H2,1-2H3	JLZDKNJXWPLGFL-UHFFFAOYSA-N	380.100619546							121713
Propionylamino-acetic acid 2-oxo-2-phenyl-ethyl ester	LSM-33157	BRD-K77801455, SID14721197	3101228	InChI=1S/C13H15NO4/c1-2-12(16)14-8-13(17)18-9-11(15)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,14,16)	ZSCYIFHRAOGUKU-UHFFFAOYSA-N	CCC(=O)NCC(=O)OCC(=O)c1ccccc1	BroadT	BRD-K77801455	BRD-K77801455-001-05-3	Asinex Ltd.	BAS 00341381			CCC(=O)NCC(=O)OCC(=O)c1ccccc1	InChI=1S/C13H15NO4/c1-2-12(16)14-8-13(17)18-9-11(15)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,14,16)	ZSCYIFHRAOGUKU-UHFFFAOYSA-N	249.10010797							121714
AC1MF2H8	LSM-33158	BRD-K81266242, SID22404159	2887947	InChI=1S/C18H21N3O/c22-18(10-9-16-6-2-1-3-7-16)21-14-12-20(13-15-21)17-8-4-5-11-19-17/h1-8,11H,9-10,12-15H2	JETNPWIMHULIBO-UHFFFAOYSA-N	O=C(CCc1ccccc1)N2CCN(CC2)c3ccccn3	BroadT	BRD-K81266242	BRD-K81266242-001-05-1	ChemBridge Corporation	6143397			O=C(CCc1ccccc1)N1CCN(CC1)c1ccccn1	InChI=1S/C18H21N3O/c22-18(10-9-16-6-2-1-3-7-16)21-14-12-20(13-15-21)17-8-4-5-11-19-17/h1-8,11H,9-10,12-15H2	JETNPWIMHULIBO-UHFFFAOYSA-N	295.168462322							121715
MLS000570339	LSM-15590	BRD-K31195910	2105504	InChI=1S/C23H34N2O/c26-23(24-16-15-19-9-7-8-10-20(19)17-24)18-25(21-11-3-1-4-12-21)22-13-5-2-6-14-22/h7-10,21-22H,1-6,11-18H2	YJGMGNKJGNMJOH-UHFFFAOYSA-N	O=C(CN(C1CCCCC1)C2CCCCC2)N3CCc4ccccc4C3	BroadT	BRD-K31195910	BRD-K31195910-034-07-1	Enamine Ltd.	T5237518		OC(=O)C(=O)O	O=C(CN(C1CCCCC1)C1CCCCC1)N1CCc2ccccc2C1.OC(=O)C(=O)O	InChI=1S/C23H34N2O.C2H2O4/c26-23(24-16-15-19-9-7-8-10-20(19)17-24)18-25(21-11-3-1-4-12-21)22-13-5-2-6-14-22;3-1(4)2(5)6/h7-10,21-22H,1-6,11-18H2;(H,3,4)(H,5,6)	DSNGHXIQBDBTPE-UHFFFAOYSA-N	354.267113728							104226, 104226
MLS000522875	LSM-33159	SID14733301, BRD-A05635986	9550451	InChI=1S/C21H23N3O5S/c1-15(16-7-3-2-4-8-16)22-20(25)14-24-18-10-9-17(13-19(18)29-21(24)26)30(27,28)23-11-5-6-12-23/h2-4,7-10,13,15H,5-6,11-12,14H2,1H3,(H,22,25)	XSOKSTPLSIIAJS-UHFFFAOYSA-N	CC(NC(=O)CN1C(=O)Oc2cc(ccc12)S(=O)(=O)N3CCCC3)c4ccccc4	BroadT	BRD-A05635986	BRD-A05635986-001-04-5	ChemDiv Inc.	C989-0465			CC(NC(=O)Cn1c2ccc(cc2oc1=O)S(=O)(=O)N1CCCC1)c1ccccc1	InChI=1S/C21H23N3O5S/c1-15(16-7-3-2-4-8-16)22-20(25)14-24-18-10-9-17(13-19(18)29-21(24)26)30(27,28)23-11-5-6-12-23/h2-4,7-10,13,15H,5-6,11-12,14H2,1H3,(H,22,25)	XSOKSTPLSIIAJS-UHFFFAOYSA-N	429.135841556							121716
MLS000679449	LSM-33160	BRD-K16231990, SID24797218	6466475	InChI=1S/C15H16N2O2S/c1-19-12-7-5-6-11(10-12)16-15(18)17-13-8-3-4-9-14(13)20-2/h3-10H,1-2H3,(H2,16,17,18)	JTKXTGXHHYEMKU-UHFFFAOYSA-N	COc1cccc(NC(=O)Nc2ccccc2SC)c1	BroadT	BRD-K16231990	BRD-K16231990-001-05-9	ChemBridge Corporation	9046728			COc1cccc(NC(=O)Nc2ccccc2SC)c1	InChI=1S/C15H16N2O2S/c1-19-12-7-5-6-11(10-12)16-15(18)17-13-8-3-4-9-14(13)20-2/h3-10H,1-2H3,(H2,16,17,18)	JTKXTGXHHYEMKU-UHFFFAOYSA-N	288.093248462							121717
F0537-0883	LSM-15469	BRD-A97608543	4342669	InChI=1S/C18H19N3O4S/c1-21-7-6-10-14(8-21)26-18(15(10)16(19)22)20-17(23)13-9-24-11-4-2-3-5-12(11)25-13/h2-5,13H,6-9H2,1H3,(H2,19,22)(H,20,23)	IOEWCPBBEIVYSM-UHFFFAOYSA-N	CN1CCc2c(C1)sc(NC(=O)C3COc4ccccc4O3)c2C(=O)N	BroadT	BRD-A97608543	BRD-A97608543-003-05-0	Life Chemicals Inc.	F0537-0883		Cl	CN1CCc2c(C1)sc(NC(=O)C1COc3ccccc3O1)c2C(N)=O.Cl	InChI=1S/C18H19N3O4S.ClH/c1-21-7-6-10-14(8-21)26-18(15(10)16(19)22)20-17(23)13-9-24-11-4-2-3-5-12(11)25-13;/h2-5,13H,6-9H2,1H3,(H2,19,22)(H,20,23);1H	QTKDJRXONAIJON-UHFFFAOYSA-N	373.109626808							104111, 104111
MLS000731520	LSM-33161	BRD-K32476586, SID24823136	16195406	InChI=1S/C16H13N5O2/c22-16-17-12-8-4-5-9-14(12)21(23)20(16)15-10-13(18-19-15)11-6-2-1-3-7-11/h1-10,23H,(H,17,22)(H,18,19)	XXQRNOQRMWRZTA-UHFFFAOYSA-N	ON1N(C(=O)Nc2ccccc12)c3cc([nH]n3)c4ccccc4	BroadT	BRD-K32476586	BRD-K32476586-001-05-0	ChemDiv Inc.	C710-0112			ON1N(c2cc([nH]n2)-c2ccccc2)C(=O)Nc2ccccc12	InChI=1S/C16H13N5O2/c22-16-17-12-8-4-5-9-14(12)21(23)20(16)15-10-13(18-19-15)11-6-2-1-3-7-11/h1-10,23H,(H,17,22)(H,18,19)	XXQRNOQRMWRZTA-UHFFFAOYSA-N	307.106924706							121718
MLS000076389	LSM-33162	BRD-K07755570, SID849457	651951	InChI=1S/C21H23F2N3O2/c22-17-6-3-5-15(12-17)21(28)25-18-8-10-26(11-9-18)14-20(27)24-13-16-4-1-2-7-19(16)23/h1-7,12,18H,8-11,13-14H2,(H,24,27)(H,25,28)	LCKPOKXYAUIJPJ-UHFFFAOYSA-N	Fc1cccc(c1)C(=O)NC2CCN(CC(=O)NCc3ccccc3F)CC2	BroadT	BRD-K07755570	BRD-K07755570-001-05-6	Asinex Ltd.	ASN 06468079			Fc1cccc(c1)C(=O)NC1CCN(CC(=O)NCc2ccccc2F)CC1	InChI=1S/C21H23F2N3O2/c22-17-6-3-5-15(12-17)21(28)25-18-8-10-26(11-9-18)14-20(27)24-13-16-4-1-2-7-19(16)23/h1-7,12,18H,8-11,13-14H2,(H,24,27)(H,25,28)	LCKPOKXYAUIJPJ-UHFFFAOYSA-N	387.175833406							121719
1H-926	LSM-44457	BRD-K70305913, SID24816945	6278975	InChI=1S/C13H11Cl2N3O3/c1-2-21-13(20)18-12(19)8(6-16)7-17-11-4-3-9(14)5-10(11)15/h3-5,7,17H,2H2,1H3,(H,18,19,20)/b8-7-	MQYTXOBCVAEPIM-FPLPWBNLSA-N	CCOC(=O)NC(=O)\C(=C/Nc1ccc(Cl)cc1Cl)\C#N	BroadT	BRD-K70305913	BRD-K70305913-001-05-8	Key Organics Ltd.	1H-926			CCOC(=O)NC(=O)C(=C/Nc1ccc(Cl)cc1Cl)\C#N	InChI=1S/C13H11Cl2N3O3/c1-2-21-13(20)18-12(19)8(6-16)7-17-11-4-3-9(14)5-10(11)15/h3-5,7,17H,2H2,1H3,(H,18,19,20)/b8-7-	MQYTXOBCVAEPIM-FPLPWBNLSA-N	327.017746662							
AC1MDYJM	LSM-33164	BRD-K10989535	2845097	InChI=1S/C17H20N2O3/c1-19(14-8-6-5-7-9-14)18-12-13-10-16(21-3)17(22-4)11-15(13)20-2/h5-12H,1-4H3	HXBXALUFSKVNNJ-UHFFFAOYSA-N	COc1cc(OC)c(C=NN(C)c2ccccc2)cc1OC	BroadT	BRD-K10989535	BRD-K10989535-001-05-0	ChemBridge Corporation	5405775			COc1cc(OC)c(C=NN(C)c2ccccc2)cc1OC	InChI=1S/C17H20N2O3/c1-19(14-8-6-5-7-9-14)18-12-13-10-16(21-3)17(22-4)11-15(13)20-2/h5-12H,1-4H3	HXBXALUFSKVNNJ-UHFFFAOYSA-N	300.14739252							121721
SMR000005661	LSM-33165	BRD-K93611325, SID26726066, SID845752	648114	InChI=1S/C28H25N3O6/c1-17-2-5-21(6-3-17)29-28(33)31(14-18-4-7-23-24(10-18)37-16-36-23)15-20-11-19-12-25-26(35-9-8-34-25)13-22(19)30-27(20)32/h2-7,10-13H,8-9,14-16H2,1H3,(H,29,33)(H,30,32)	YDSACXQZQSDTAX-UHFFFAOYSA-N	Cc1ccc(NC(=O)N(Cc2ccc3OCOc3c2)Cc4cc5cc6OCCOc6cc5nc4O)cc1	BroadT	BRD-K93611325	BRD-K93611325-001-05-4	Asinex Ltd.	ASN 05836107			Cc1ccc(NC(=O)N(Cc2ccc3OCOc3c2)Cc2cc3cc4OCCOc4cc3nc2O)cc1	InChI=1S/C28H25N3O6/c1-17-2-5-21(6-3-17)29-28(33)31(14-18-4-7-23-24(10-18)37-16-36-23)15-20-11-19-12-25-26(35-9-8-34-25)13-22(19)30-27(20)32/h2-7,10-13H,8-9,14-16H2,1H3,(H,29,33)(H,30,32)	YDSACXQZQSDTAX-UHFFFAOYSA-N	499.17433555							121722
N'-(4-chloro-2-methylphenyl)-4-methyl-1,2,3-thiadiazole-5-carbohydrazide	LSM-33166	BRD-K16915521, SID26728225	2811345	InChI=1S/C11H11ClN4OS/c1-6-5-8(12)3-4-9(6)14-15-11(17)10-7(2)13-16-18-10/h3-5,14H,1-2H3,(H,15,17)	QUUVZAAUSMJIJD-UHFFFAOYSA-N	Cc1cc(Cl)ccc1NNC(=O)c2snnc2C	BroadT	BRD-K16915521	BRD-K16915521-001-06-3	Maybridge	HTS 03656			Cc1nnsc1C(=O)NNc1ccc(Cl)cc1C	InChI=1S/C11H11ClN4OS/c1-6-5-8(12)3-4-9(6)14-15-11(17)10-7(2)13-16-18-10/h3-5,14H,1-2H3,(H,15,17)	QUUVZAAUSMJIJD-UHFFFAOYSA-N	282.034209412							121723
AC1MMQWB	LSM-33167	SID4249009, BRD-K30558628	3243015	InChI=1S/C21H21BrN2O5S/c1-2-24(16-5-6-17-18(11-16)29-12-28-17)30(26,27)19-10-15(22)9-14-7-8-23(20(14)19)21(25)13-3-4-13/h5-6,9-11,13H,2-4,7-8,12H2,1H3	JJWWCPUSILPAKW-UHFFFAOYSA-N	CCN(c1ccc2OCOc2c1)S(=O)(=O)c3cc(Br)cc4CCN(C(=O)C5CC5)c34	BroadT	BRD-K30558628	BRD-K30558628-001-05-7	ChemDiv Inc.	C137-2093			CCN(c1ccc2OCOc2c1)S(=O)(=O)c1cc(Br)cc2CCN(C(=O)C3CC3)c12	InChI=1S/C21H21BrN2O5S/c1-2-24(16-5-6-17-18(11-16)29-12-28-17)30(26,27)19-10-15(22)9-14-7-8-23(20(14)19)21(25)13-3-4-13/h5-6,9-11,13H,2-4,7-8,12H2,1H3	JJWWCPUSILPAKW-UHFFFAOYSA-N	492.035455082							121724
N-(4-Acetyl-phenyl)-2-thiophen-2-yl-acetamide	LSM-33168	BRD-K69528787, SID49642599	669993	InChI=1S/C14H13NO2S/c1-10(16)11-4-6-12(7-5-11)15-14(17)9-13-3-2-8-18-13/h2-8H,9H2,1H3,(H,15,17)	XJRYZRNVZVLBRJ-UHFFFAOYSA-N	CC(=O)c1ccc(NC(=O)Cc2cccs2)cc1	BroadT	BRD-K69528787	BRD-K69528787-001-05-1	Asinex Ltd.	BAS 02257832			CC(=O)c1ccc(NC(=O)Cc2cccs2)cc1	InChI=1S/C14H13NO2S/c1-10(16)11-4-6-12(7-5-11)15-14(17)9-13-3-2-8-18-13/h2-8H,9H2,1H3,(H,15,17)	XJRYZRNVZVLBRJ-UHFFFAOYSA-N	259.066699356							121725
T0518-0187	LSM-44458	BRD-K40260328, SID22401560	6049501	InChI=1S/C17H11N3O4/c21-19(22)15-10-5-12(6-11-15)4-8-14-9-7-13-2-1-3-16(20(23)24)17(13)18-14/h1-11H/b8-4+	KFAYHVZUOCNDCH-XBXARRHUSA-N	[O-][N+](=O)c1ccc(\C=C\c2ccc3cccc(c3n2)[N+](=O)[O-])cc1	BroadT	BRD-K40260328	BRD-K40260328-001-05-1	Enamine Ltd.	T0518-0187			[O-][N+](=O)c1ccc(\C=C\c2ccc3cccc([N+]([O-])=O)c3n2)cc1	InChI=1S/C17H11N3O4/c21-19(22)15-10-5-12(6-11-15)4-8-14-9-7-13-2-1-3-16(20(23)24)17(13)18-14/h1-11H/b8-4+	KFAYHVZUOCNDCH-XBXARRHUSA-N	321.074955862							
T0516-8594	LSM-33170	BRD-K60216304, SID22411287	2369153	InChI=1S/C32H32N2O6/c1-21-4-13-29(35)27(18-21)30(36)24-19-28(31(37)33-16-14-22-5-9-25(39-2)10-6-22)32(38)34(20-24)17-15-23-7-11-26(40-3)12-8-23/h4-13,18-20,35H,14-17H2,1-3H3,(H,33,37)	IVWLVQQNBWATHO-UHFFFAOYSA-N	COc1ccc(CCNC(=O)C2=CC(=CN(CCc3ccc(OC)cc3)C2=O)C(=O)c4cc(C)ccc4O)cc1	BroadT	BRD-K60216304	BRD-K60216304-001-05-6	Enamine Ltd.	T0516-8594			COc1ccc(CCNC(=O)c2cc(cn(CCc3ccc(OC)cc3)c2=O)C(=O)c2cc(C)ccc2O)cc1	InChI=1S/C32H32N2O6/c1-21-4-13-29(35)27(18-21)30(36)24-19-28(31(37)33-16-14-22-5-9-25(39-2)10-6-22)32(38)34(20-24)17-15-23-7-11-26(40-3)12-8-23/h4-13,18-20,35H,14-17H2,1-3H3,(H,33,37)	IVWLVQQNBWATHO-UHFFFAOYSA-N	540.226036764							121727
SMR000022049	LSM-33171	BRD-K17020860, SID4245889	756407	InChI=1S/C15H12F3N3O3/c16-14(17,18)15(23-11-5-1-2-6-12(11)24-15)21-13(22)20-9-10-4-3-7-19-8-10/h1-8H,9H2,(H2,20,21,22)	MMJOWHXYDSJPAB-UHFFFAOYSA-N	FC(F)(F)C1(NC(=O)NCc2cccnc2)Oc3ccccc3O1	BroadT	BRD-K17020860	BRD-K17020860-001-05-2	ChemDiv Inc.	C097-0107			FC(F)(F)C1(NC(=O)NCc2cccnc2)Oc2ccccc2O1	InChI=1S/C15H12F3N3O3/c16-14(17,18)15(23-11-5-1-2-6-12(11)24-15)21-13(22)20-9-10-4-3-7-19-8-10/h1-8H,9H2,(H2,20,21,22)	MMJOWHXYDSJPAB-UHFFFAOYSA-N	339.083075874							121728
F0648-0117	LSM-33172	BRD-K79232672, SID7971652	4547253	InChI=1S/C17H19N5O2S/c1-10(2)25-17-21-20-14(8-12-9-15(23)19-16(24)18-12)22(17)13-6-4-5-11(3)7-13/h4-7,9-10H,8H2,1-3H3,(H2,18,19,23,24)	JDJUTZIBAZUBRK-UHFFFAOYSA-N	CC(C)Sc1nnc(Cc2cc(O)nc(O)n2)n1c3cccc(C)c3	BroadT	BRD-K79232672	BRD-K79232672-001-04-9	Life Chemicals Inc.	F0648-0117			CC(C)Sc1nnc(Cc2cc(O)nc(O)n2)n1-c1cccc(C)c1	InChI=1S/C17H19N5O2S/c1-10(2)25-17-21-20-14(8-12-9-15(23)19-16(24)18-12)22(17)13-6-4-5-11(3)7-13/h4-7,9-10H,8H2,1-3H3,(H2,18,19,23,24)	JDJUTZIBAZUBRK-UHFFFAOYSA-N	357.125945588							121729
AF-399/15032368	LSM-33173	BRD-A63704386	645658	InChI=1S/C17H18N4O2/c1-3-6-12-15-14(10-7-4-5-8-13(10)22-2)11(9-18)16(19)23-17(15)21-20-12/h4-5,7-8,11,14,19H,3,6H2,1-2H3,(H,20,21)	QIVPVJACDHRRRM-UHFFFAOYSA-N	CCCc1[nH]nc2OC(=N)C(C#N)C(c12)c1ccccc1OC	BroadT	BRD-A63704386	BRD-A63704386-001-06-9	Asinex Ltd.	BAS 07093316			CCCc1n[nH]c2OC(N)=C(C#N)C(c12)c1ccccc1OC	InChI=1S/C17H18N4O2/c1-3-6-12-15-14(10-7-4-5-8-13(10)22-2)11(9-18)16(19)23-17(15)21-20-12/h4-5,7-8,14H,3,6,19H2,1-2H3,(H,20,21)	KPJRRWCLHUKDJO-UHFFFAOYSA-N	310.142975856							
4-Hydroxy-2-oxo-1-pentyl-n-(1-phenylethyl)-1,2-dihydroquinoline-3-carboxamide	LSM-33174	BRD-A61014366, SID49640773	54687736	InChI=1S/C23H26N2O3/c1-3-4-10-15-25-19-14-9-8-13-18(19)21(26)20(23(25)28)22(27)24-16(2)17-11-6-5-7-12-17/h5-9,11-14,16,26H,3-4,10,15H2,1-2H3,(H,24,27)	UHOZNJWKHZFOCI-UHFFFAOYSA-N	CCCCCN1C(=O)C(=C(O)c2ccccc12)C(=O)NC(C)c3ccccc3	BroadT	BRD-A61014366	BRD-A61014366-001-06-9	Asinex Ltd.	BAS 00364014			CCCCCn1c2ccccc2c(O)c(C(=O)NC(C)c2ccccc2)c1=O	InChI=1S/C23H26N2O3/c1-3-4-10-15-25-19-14-9-8-13-18(19)21(26)20(23(25)28)22(27)24-16(2)17-11-6-5-7-12-17/h5-9,11-14,16,26H,3-4,10,15H2,1-2H3,(H,24,27)	UHOZNJWKHZFOCI-UHFFFAOYSA-N	378.194342712							121731
MLS000722915	LSM-33175	SID24810687, BRD-A22089150	2858721	InChI=1S/C13H15N3O5/c1-8-6-9(16(19)20)7-10-11(8)14-12(17)13(10,18)15-2-4-21-5-3-15/h6-7,18H,2-5H2,1H3,(H,14,17)	LLQANBYCBIAPTJ-UHFFFAOYSA-N	Cc1cc(cc2c1NC(=O)C2(O)N3CCOCC3)[N+](=O)[O-]	BroadT	BRD-A22089150	BRD-A22089150-001-06-9	ChemDiv Inc.	2040-0773			Cc1cc(cc2c1NC(=O)C2(O)N1CCOCC1)[N+]([O-])=O	InChI=1S/C13H15N3O5/c1-8-6-9(16(19)20)7-10-11(8)14-12(17)13(10,18)15-2-4-21-5-3-15/h6-7,18H,2-5H2,1H3,(H,14,17)	LLQANBYCBIAPTJ-UHFFFAOYSA-N	293.10117061							121732
N-{4-[(1,1-Dioxo-1lambda~6~,4-thiazinan-4-yl)methyl]phenyl}-3,4-dimethylbenzamide	LSM-33176	BRD-K00359952, SID26728102	2812625	InChI=1S/C20H24N2O3S/c1-15-3-6-18(13-16(15)2)20(23)21-19-7-4-17(5-8-19)14-22-9-11-26(24,25)12-10-22/h3-8,13H,9-12,14H2,1-2H3,(H,21,23)	IYIBNPKZDWNTHA-UHFFFAOYSA-N	Cc1ccc(cc1C)C(=O)Nc2ccc(CN3CCS(=O)(=O)CC3)cc2	BroadT	BRD-K00359952	BRD-K00359952-001-06-0	Maybridge	HTS 05733			Cc1ccc(cc1C)C(=O)Nc1ccc(CN2CCS(=O)(=O)CC2)cc1	InChI=1S/C20H24N2O3S/c1-15-3-6-18(13-16(15)2)20(23)21-19-7-4-17(5-8-19)14-22-9-11-26(24,25)12-10-22/h3-8,13H,9-12,14H2,1-2H3,(H,21,23)	IYIBNPKZDWNTHA-UHFFFAOYSA-N	372.150763338							121733
Methyl Urocanate	LSM-44459	BRD-K08534346, SID49674772	5371085	InChI=1S/C7H8N2O2/c1-11-7(10)3-2-6-4-8-5-9-6/h2-5H,1H3,(H,8,9)/b3-2+	ZXKOENSQFURTSZ-NSCUHMNNSA-N	COC(=O)\C=C\c1c[nH]cn1	BroadT	BRD-K08534346	BRD-K08534346-001-05-7	Stanford University	JDUBOIS_170			COC(=O)\C=C\c1c[nH]cn1	InChI=1S/C7H8N2O2/c1-11-7(10)3-2-6-4-8-5-9-6/h2-5H,1H3,(H,8,9)/b3-2+	ZXKOENSQFURTSZ-NSCUHMNNSA-N	152.058577516							
SMR000212330	LSM-33178	BRD-A35323217, SID17511398	4527708	InChI=1S/C18H17N5O5S/c1-29-7-6-16(17-19-14-4-2-3-5-15(14)20-17)21-18(24)11-8-12(22(25)26)10-13(9-11)23(27)28/h2-5,8-10,16H,6-7H2,1H3,(H,19,20)(H,21,24)	RCVHDOCJQYSEPU-UHFFFAOYSA-N	CSCCC(NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])c2nc3ccccc3[nH]2	BroadT	BRD-A35323217	BRD-A35323217-001-05-0	InterBioScreen Ltd.	STOCK3S-21261			CSCCC(NC(=O)c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)c1nc2ccccc2[nH]1	InChI=1S/C18H17N5O5S/c1-29-7-6-16(17-19-14-4-2-3-5-15(14)20-17)21-18(24)11-8-12(22(25)26)10-13(9-11)23(27)28/h2-5,8-10,16H,6-7H2,1H3,(H,19,20)(H,21,24)	RCVHDOCJQYSEPU-UHFFFAOYSA-N	415.095039384							121735
BAS 09621404	LSM-33179	BRD-A84816049, SID843629	645926	InChI=1S/C22H28ClN3O3/c1-16-3-4-18(23)13-22(16)26-11-9-25(10-12-26)14-20(28)15-29-21-7-5-19(6-8-21)24-17(2)27/h3-8,13,20,28H,9-12,14-15H2,1-2H3,(H,24,27)	CQJWMVQUXRHEJA-UHFFFAOYSA-N	CC(=O)Nc1ccc(OCC(O)CN2CCN(CC2)c3cc(Cl)ccc3C)cc1	BroadT	BRD-A84816049	BRD-A84816049-001-06-5	Asinex Ltd.	BAS 09621404			CC(=O)Nc1ccc(OCC(O)CN2CCN(CC2)c2cc(Cl)ccc2C)cc1	InChI=1S/C22H28ClN3O3/c1-16-3-4-18(23)13-22(16)26-11-9-25(10-12-26)14-20(28)15-29-21-7-5-19(6-8-21)24-17(2)27/h3-8,13,20,28H,9-12,14-15H2,1-2H3,(H,24,27)	CQJWMVQUXRHEJA-UHFFFAOYSA-N	417.181919496							121736
MLS000417818	LSM-33180	BRD-K32802965, SID22411008	701317	InChI=1S/C16H12N6OS/c23-15-12-9-19-22(11-5-2-1-3-6-11)14(12)20-13(21-15)10-24-16-17-7-4-8-18-16/h1-9H,10H2,(H,20,21,23)	GPWBGXQRDCOBSS-UHFFFAOYSA-N	Oc1nc(CSc2ncccn2)nc3c1cnn3c4ccccc4	BroadT	BRD-K32802965	BRD-K32802965-001-06-6	Enamine Ltd.	T5227360			Oc1nc(CSc2ncccn2)nc2n(ncc12)-c1ccccc1	InChI=1S/C16H12N6OS/c23-15-12-9-19-22(11-5-2-1-3-6-11)14(12)20-13(21-15)10-24-16-17-7-4-8-18-16/h1-9H,10H2,(H,20,21,23)	GPWBGXQRDCOBSS-UHFFFAOYSA-N	336.079329754							
AC1NB6YP	LSM-33181	BRD-A11814108	4438573	InChI=1S/C15H15N3O2/c1-12(20-14-8-3-2-4-9-14)15(19)18-17-11-13-7-5-6-10-16-13/h2-12H,1H3,(H,18,19)	VLBHKSYLCYABGB-UHFFFAOYSA-N	CC(Oc1ccccc1)C(=O)NN=Cc2ccccn2	BroadT	BRD-A11814108	BRD-A11814108-001-05-8	ChemDiv Inc.	2061-0022			CC(Oc1ccccc1)C(=O)NN=Cc1ccccn1	InChI=1S/C15H15N3O2/c1-12(20-14-8-3-2-4-9-14)15(19)18-17-11-13-7-5-6-10-16-13/h2-12H,1H3,(H,18,19)	VLBHKSYLCYABGB-UHFFFAOYSA-N	269.11642675							121738
AC1OACK6	LSM-33182	BRD-K12132610, SID14740750	6802592	InChI=1S/C18H16BrN3O3/c1-2-24-11-7-8-12(14(23)9-11)17-16(10-21-18(20)22-17)25-15-6-4-3-5-13(15)19/h3-10,23H,2H2,1H3,(H2,20,21,22)	FWZCPAVCZDSLJB-UHFFFAOYSA-N	CCOc1ccc(c(O)c1)c2nc(N)ncc2Oc3ccccc3Br	BroadT	BRD-K12132610	BRD-K12132610-001-05-3	InterBioScreen Ltd.	STOCK5S-22841			CCOc1ccc(c(O)c1)-c1nc(N)ncc1Oc1ccccc1Br	InChI=1S/C18H16BrN3O3/c1-2-24-11-7-8-12(14(23)9-11)17-16(10-21-18(20)22-17)25-15-6-4-3-5-13(15)19/h3-10,23H,2H2,1H3,(H2,20,21,22)	FWZCPAVCZDSLJB-UHFFFAOYSA-N	401.037504002							
N1-[4-(1,3-Oxazol-5-yl)phenyl]benzamide	LSM-33183	SID26730720, N1-4-(1,3-Oxazol-5-yl)Phenylbenzamide	2739167	InChI=1S/C16H12N2O2/c19-16(13-4-2-1-3-5-13)18-14-8-6-12(7-9-14)15-10-17-11-20-15/h1-11H,(H,18,19)	KCFZUNVAXAAJDD-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)c2ocnc2)c3ccccc3	BroadT	BRD-K87000197	BRD-K87000197-001-05-3	Maybridge	SEW 00753			O=C(Nc1ccc(cc1)-c1cnco1)c1ccccc1	InChI=1S/C16H12N2O2/c19-16(13-4-2-1-3-5-13)18-14-8-6-12(7-9-14)15-10-17-11-20-15/h1-11H,(H,18,19)	KCFZUNVAXAAJDD-UHFFFAOYSA-N	264.089877644							121740
Ethyl 2-amino-4-(2-furyl)thiophene-3-carboxylate	LSM-33184	BRD-K68705041, SID3714150	736628	InChI=1S/C11H11NO3S/c1-2-14-11(13)9-7(6-16-10(9)12)8-4-3-5-15-8/h3-6H,2,12H2,1H3	JMLBJOYPNPOBKV-UHFFFAOYSA-N	CCOC(=O)c1c(N)scc1c2occc2	BroadT	BRD-K68705041	BRD-K68705041-001-05-8	Enamine Ltd.	T5258537			CCOC(=O)c1c(N)scc1-c1ccco1	InChI=1S/C11H11NO3S/c1-2-14-11(13)9-7(6-16-10(9)12)8-4-3-5-15-8/h3-6H,2,12H2,1H3	JMLBJOYPNPOBKV-UHFFFAOYSA-N	237.045963912							131300
2-[(3-Bromo-4-methoxyphenyl)acetyl]-n-phenylhydrazinecarbothioamide	LSM-33185	BRD-K41574232, SID17401595	1237214	InChI=1S/C16H16BrN3O2S/c1-22-14-8-7-11(9-13(14)17)10-15(21)19-20-16(23)18-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,21)(H2,18,20,23)	SLVZCCAZHUWUNK-UHFFFAOYSA-N	COc1ccc(CC(=O)NN=C(S)Nc2ccccc2)cc1Br	BroadT	BRD-K41574232	BRD-K41574232-001-05-9	InterBioScreen Ltd.	STOCK3S-03512			COc1ccc(CC(=O)NN=C(S)Nc2ccccc2)cc1Br	InChI=1S/C16H16BrN3O2S/c1-22-14-8-7-11(9-13(14)17)10-15(21)19-20-16(23)18-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,21)(H2,18,20,23)	SLVZCCAZHUWUNK-UHFFFAOYSA-N	393.014660072							121743
AC1LZ49B	LSM-33186	BRD-K87722624	1913774	InChI=1S/C15H15N3O4/c1-20-11-4-3-5-12(21-2)13(11)15(19)22-18-14(16)10-6-8-17-9-7-10/h3-9H,1-2H3,(H2,16,18)	OZEFPPKPFJGKSL-UHFFFAOYSA-N	COc1cccc(OC)c1C(=O)ONC(=N)c2ccncc2	BroadT	BRD-K87722624	BRD-K87722624-001-05-5	InterBioScreen Ltd.	STOCK2S-41370			COc1cccc(OC)c1C(=O)ONC(=N)c1ccncc1	InChI=1S/C15H15N3O4/c1-20-11-4-3-5-12(21-2)13(11)15(19)22-18-14(16)10-6-8-17-9-7-10/h3-9H,1-2H3,(H2,16,18)	OZEFPPKPFJGKSL-UHFFFAOYSA-N	301.10625599							121744
3-(2,6-Dichlorophenyl)-n-[imino(1-pyrrolidinyl)methyl]-5-methyl-4-isoxazolecarboxamide	LSM-33187	BRD-K83949633, SID26727300	2804933	InChI=1S/C16H16Cl2N4O2/c1-9-12(15(23)20-16(19)22-7-2-3-8-22)14(21-24-9)13-10(17)5-4-6-11(13)18/h4-6H,2-3,7-8H2,1H3,(H2,19,20,23)	NIYGHLFZKWUHJC-UHFFFAOYSA-N	Cc1onc(c1C(=O)N=C(N)N2CCCC2)c3c(Cl)cccc3Cl	BroadT	BRD-K83949633	BRD-K83949633-001-04-0	Maybridge	CD 07790			Cc1onc(c1C(=O)NC(=N)N1CCCC1)-c1c(Cl)cccc1Cl	InChI=1S/C16H16Cl2N4O2/c1-9-12(15(23)20-16(19)22-7-2-3-8-22)14(21-24-9)13-10(17)5-4-6-11(13)18/h4-6H,2-3,7-8H2,1H3,(H2,19,20,23)	NIYGHLFZKWUHJC-UHFFFAOYSA-N	366.065031212							121745
2-[(2,3-Dimethyl-7,8,9,10-tetrahydrophenanthridin-6-yl)sulfanyl]-n-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide	LSM-33188	BRD-K01281780, SID848658	651110	InChI=1S/C20H22N4O2S/c1-11-8-16-14-6-4-5-7-15(14)20(21-17(16)9-12(11)2)27-10-18(25)22-19-13(3)23-26-24-19/h8-9H,4-7,10H2,1-3H3,(H,22,24,25)	VJEIHWFCIBHXTM-UHFFFAOYSA-N	Cc1cc2nc(SCC(=O)Nc3nonc3C)c4CCCCc4c2cc1C	BroadT	BRD-K01281780	BRD-K01281780-001-05-5	Asinex Ltd.	ASN 06865292			Cc1nonc1NC(=O)CSc1nc2cc(C)c(C)cc2c2CCCCc12	InChI=1S/C20H22N4O2S/c1-11-8-16-14-6-4-5-7-15(14)20(21-17(16)9-12(11)2)27-10-18(25)22-19-13(3)23-26-24-19/h8-9H,4-7,10H2,1-3H3,(H,22,24,25)	VJEIHWFCIBHXTM-UHFFFAOYSA-N	382.146346674							121746
F0174-0195	LSM-33189	BRD-K16780806	2054953	InChI=1S/C18H18N2O4S/c1-20-12-7-5-6-8-15(12)25-18(20)19-17(21)11-9-13(22-2)16(24-4)14(10-11)23-3/h5-10H,1-4H3	ZQTAFLWONMGCNQ-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)N=C2Sc3ccccc3N2C	BroadT	BRD-K16780806	BRD-K16780806-001-05-9	Enamine Ltd.	T0510-3632			COc1cc(cc(OC)c1OC)C(=O)N=c1sc2ccccc2n1C	InChI=1S/C18H18N2O4S/c1-20-12-7-5-6-8-15(12)25-18(20)19-17(21)11-9-13(22-2)16(24-4)14(10-11)23-3/h5-10H,1-4H3	ZQTAFLWONMGCNQ-UHFFFAOYSA-N	358.098727766							121747
AC1MEPMU	LSM-15470	BRD-A28932952	2882052	InChI=1S/C17H22N2/c1-3-18-10-11-19-16-12(2)6-4-7-13(16)14-8-5-9-15(18)17(14)19/h4,6-7,15H,3,5,8-11H2,1-2H3	IACMCONNVAWCFT-UHFFFAOYSA-N	CCN1CCn2c3C1CCCc3c4cccc(C)c24	BroadT	BRD-A28932952	BRD-A28932952-003-05-2	ChemBridge Corporation	6044231		Cl	CCN1CCn2c3C1CCCc3c1cccc(C)c21.Cl	InChI=1S/C17H22N2.ClH/c1-3-18-10-11-19-16-12(2)6-4-7-13(16)14-8-5-9-15(18)17(14)19;/h4,6-7,15H,3,5,8-11H2,1-2H3;1H	FNSMVGBQTVAKLJ-UHFFFAOYSA-N	254.178298724							104112, 104112
MLS000882744	LSM-33190	SID26732355, BRD-K77922263	16060492	InChI=1S/C31H33NO4/c1-31-17-9-8-12-25(31)29(32(30(31)33)20-21-10-6-5-7-11-21)24-18-22(13-15-26(24)34-2)23-14-16-27(35-3)28(19-23)36-4/h5-8,10-16,18-19,25,29H,9,17,20H2,1-4H3/t25-,29-,31+/m0/s1	FYWMIHJCACAINX-ZITMISKDSA-N	COc1ccc(cc1OC)c2ccc(OC)c(c2)[C@H]3[C@@H]4C=CCC[C@@]4(C)C(=O)N3Cc5ccccc5	BroadT	BRD-K77922263	BRD-K77922263-001-05-9	University of Kansas CMLD	KUC101262N			COc1ccc(cc1OC)-c1ccc(OC)c(c1)[C@H]1[C@@H]2C=CCC[C@@]2(C)C(=O)N1Cc1ccccc1	InChI=1S/C31H33NO4/c1-31-17-9-8-12-25(31)29(32(30(31)33)20-21-10-6-5-7-11-21)24-18-22(13-15-26(24)34-2)23-14-16-27(35-3)28(19-23)36-4/h5-8,10-16,18-19,25,29H,9,17,20H2,1-4H3/t25-,29-,31+/m0/s1	FYWMIHJCACAINX-ZITMISKDSA-N	483.240958546							
4-[2-(1,3-Dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)ethyl]-n-(4-methylphenyl)-1-piperazinecarbothioamide	LSM-33191	BRD-K35978846, SID17414894	2927347	InChI=1S/C26H26N4O2S/c1-18-8-10-20(11-9-18)27-26(33)29-15-12-28(13-16-29)14-17-30-24(31)21-6-2-4-19-5-3-7-22(23(19)21)25(30)32/h2-11H,12-17H2,1H3,(H,27,33)	MVWVZBVKGFTXOW-UHFFFAOYSA-N	Cc1ccc(NC(=S)N2CCN(CCN3C(=O)c4cccc5cccc(C3=O)c45)CC2)cc1	BroadT	BRD-K35978846	BRD-K35978846-001-06-6	ChemBridge Corporation	7119638			Cc1ccc(NC(=S)N2CCN(CCN3C(=O)c4cccc5cccc(C3=O)c45)CC2)cc1	InChI=1S/C26H26N4O2S/c1-18-8-10-20(11-9-18)27-26(33)29-15-12-28(13-16-29)14-17-30-24(31)21-6-2-4-19-5-3-7-22(23(19)21)25(30)32/h2-11H,12-17H2,1H3,(H,27,33)	MVWVZBVKGFTXOW-UHFFFAOYSA-N	458.177646802							121748
AC1LDBHZ	LSM-44460	SID863136, BRD-K04930806	664373	InChI=1S/C13H12N4/c1-2-7-14-13-12-11(15-8-16-13)9-5-3-4-6-10(9)17-12/h2-6,8,14H,1,7H2,(H,15,16)	ZAUOESZRRGOTDJ-UHFFFAOYSA-N	C=CCNc1[nH]cnc2c3ccccc3nc12	BroadT	BRD-K04930806	BRD-K04930806-001-05-4	InterBioScreen Ltd.	STOCK4S-63980			C=CCNc1[nH]cnc2c1nc1ccccc21	InChI=1S/C13H12N4/c1-2-7-14-13-12-11(15-8-16-13)9-5-3-4-6-10(9)17-12/h2-6,8,14H,1,7H2,(H,15,16)	ZAUOESZRRGOTDJ-UHFFFAOYSA-N	224.106196424							
CBMICRO_023260	LSM-33193	BRD-K92910000	2851054	InChI=1S/C23H23N7O3/c1-31-18-9-5-16(6-10-18)14-25-30-23-28-21(24-15-20-4-3-13-33-20)27-22(29-23)26-17-7-11-19(32-2)12-8-17/h3-14H,15H2,1-2H3,(H3,24,26,27,28,29,30)	DMBNPDBHMPDUSZ-UHFFFAOYSA-N	COc1ccc(Nc2nc(NCc3occc3)nc(NN=Cc4ccc(OC)cc4)n2)cc1	BroadT	BRD-K92910000	BRD-K92910000-001-05-3	Asinex Ltd.	BAS 00442741			COc1ccc(Nc2nc(NCc3ccco3)nc(NN=Cc3ccc(OC)cc3)n2)cc1	InChI=1S/C23H23N7O3/c1-31-18-9-5-16(6-10-18)14-25-30-23-28-21(24-15-20-4-3-13-33-20)27-22(29-23)26-17-7-11-19(32-2)12-8-17/h3-14H,15H2,1-2H3,(H3,24,26,27,28,29,30)	DMBNPDBHMPDUSZ-UHFFFAOYSA-N	445.186237666							121750
AC1O9XNT	LSM-33194	BRD-K16167206	6740031	InChI=1S/C13H8BrCl2NO/c14-9-1-3-11(4-2-9)17-7-8-5-10(15)6-12(16)13(8)18/h1-7,18H	SCFYGKJRFQUEST-UHFFFAOYSA-N	Oc1c(Cl)cc(Cl)cc1C=Nc2ccc(Br)cc2	BroadT	BRD-K16167206	BRD-K16167206-001-05-5	Specs	AG-205/40099478			Oc1c(Cl)cc(Cl)cc1C=Nc1ccc(Br)cc1	InChI=1S/C13H8BrCl2NO/c14-9-1-3-11(4-2-9)17-7-8-5-10(15)6-12(16)13(8)18/h1-7,18H	SCFYGKJRFQUEST-UHFFFAOYSA-N	342.916631906							
T5251685	LSM-33195	BRD-K85554193, SID3711312	2124528	InChI=1S/C16H16N2O3S/c1-10-12(11(2)21-18-10)9-20-16(19)8-7-15-17-13-5-3-4-6-14(13)22-15/h3-6H,7-9H2,1-2H3	FSJOPIGMDBUYEB-UHFFFAOYSA-N	Cc1onc(C)c1COC(=O)CCc2nc3ccccc3s2	BroadT	BRD-K85554193	BRD-K85554193-001-05-5	Enamine Ltd.	T5251685			Cc1noc(C)c1COC(=O)CCc1nc2ccccc2s1	InChI=1S/C16H16N2O3S/c1-10-12(11(2)21-18-10)9-20-16(19)8-7-15-17-13-5-3-4-6-14(13)22-15/h3-6H,7-9H2,1-2H3	FSJOPIGMDBUYEB-UHFFFAOYSA-N	316.088163082							121752
2-Chloro-1-(1-furan-2-ylmethyl-2,5-dimethyl-1H-pyrrol-3-yl)-ethanone	LSM-33196	BRD-K87386611, SID24809064	1537038	InChI=1S/C13H14ClNO2/c1-9-6-12(13(16)7-14)10(2)15(9)8-11-4-3-5-17-11/h3-6H,7-8H2,1-2H3	FESSGZXDFUKCDD-UHFFFAOYSA-N	Cc1cc(C(=O)CCl)c(C)n1Cc2occc2	BroadT	BRD-K87386611	BRD-K87386611-001-06-2	Asinex Ltd.	BAS 04282578			Cc1cc(C(=O)CCl)c(C)n1Cc1ccco1	InChI=1S/C13H14ClNO2/c1-9-6-12(13(16)7-14)10(2)15(9)8-11-4-3-5-17-11/h3-6H,7-8H2,1-2H3	FESSGZXDFUKCDD-UHFFFAOYSA-N	251.071306408							121753
T5221359	LSM-33197	BRD-A73150064, SID22410928	4556344	InChI=1S/C26H29N5O5S/c32-24(28-19-8-7-9-20(15-19)37(35,36)30-12-5-1-2-6-13-30)17-31-25(33)23(29-26(31)34)14-18-16-27-22-11-4-3-10-21(18)22/h3-4,7-11,15-16,23,27H,1-2,5-6,12-14,17H2,(H,28,32)(H,29,34)	ZUPNTFFWGZHVSX-UHFFFAOYSA-N	O=C(CN1C(=O)NC(Cc2c[nH]c3ccccc23)C1=O)Nc4cccc(c4)S(=O)(=O)N5CCCCCC5	BroadT	BRD-A73150064	BRD-A73150064-001-05-4	Enamine Ltd.	T5221359			O=C(CN1C(=O)NC(Cc2c[nH]c3ccccc23)C1=O)Nc1cccc(c1)S(=O)(=O)N1CCCCCC1	InChI=1S/C26H29N5O5S/c32-24(28-19-8-7-9-20(15-19)37(35,36)30-12-5-1-2-6-13-30)17-31-25(33)23(29-26(31)34)14-18-16-27-22-11-4-3-10-21(18)22/h3-4,7-11,15-16,23,27H,1-2,5-6,12-14,17H2,(H,28,32)(H,29,34)	ZUPNTFFWGZHVSX-UHFFFAOYSA-N	523.188939768							121754
AC1NQQY2	LSM-33198	BRD-K52170475	5227269	InChI=1S/C12H9ClFN3/c13-10-4-3-5-11(14)9(10)8-16-17-12-6-1-2-7-15-12/h1-8H,(H,15,17)	DFIAVYFHNNUKLR-UHFFFAOYSA-N	Fc1cccc(Cl)c1C=NNc2ccccn2	BroadT	BRD-K52170475	BRD-K52170475-001-05-8	Enamine Ltd.	T0519-1155			Fc1cccc(Cl)c1C=NNc1ccccn1	InChI=1S/C12H9ClFN3/c13-10-4-3-5-11(14)9(10)8-16-17-12-6-1-2-7-15-12/h1-8H,(H,15,17)	DFIAVYFHNNUKLR-UHFFFAOYSA-N	249.046903228							121755
MLS000520471	LSM-33199	SID14735414, BRD-K45350681	9550709	InChI=1S/C16H11ClN4O3/c17-11-5-3-4-10(8-11)13-9-15(24-19-13)20-16(22)18-12-6-1-2-7-14(12)21(20)23/h1-9,23H,(H,18,22)	QAIWDUVAMGXTMG-UHFFFAOYSA-N	ON1N(C(=O)Nc2ccccc12)c3onc(c3)c4cccc(Cl)c4	BroadT	BRD-K45350681	BRD-K45350681-001-06-4	ChemDiv Inc.	C710-0122			ON1N(c2cc(no2)-c2cccc(Cl)c2)C(=O)Nc2ccccc12	InChI=1S/C16H11ClN4O3/c17-11-5-3-4-10(8-11)13-9-15(24-19-13)20-16(22)18-12-6-1-2-7-14(12)21(20)23/h1-9,23H,(H,18,22)	QAIWDUVAMGXTMG-UHFFFAOYSA-N	342.051967962							121756
SMR000178389	LSM-33200	BRD-A18825024, SID17408806	3153675	InChI=1S/C26H29FN4O4/c1-34-22-12-9-18(15-23(22)35-2)24(25(32)29-20-5-3-4-6-20)31(26(33)21-13-14-28-30-21)16-17-7-10-19(27)11-8-17/h7-15,20,24H,3-6,16H2,1-2H3,(H,28,30)(H,29,32)	CFNNZWFCMGXNGQ-UHFFFAOYSA-N	COc1ccc(cc1OC)C(N(Cc2ccc(F)cc2)C(=O)c3cc[nH]n3)C(=O)NC4CCCC4	BroadT	BRD-A18825024	BRD-A18825024-001-05-8	Asinex Ltd.	BAS 06264681			COc1ccc(cc1OC)C(N(Cc1ccc(F)cc1)C(=O)c1cc[nH]n1)C(=O)NC1CCCC1	InChI=1S/C26H29FN4O4/c1-34-22-12-9-18(15-23(22)35-2)24(25(32)29-20-5-3-4-6-20)31(26(33)21-13-14-28-30-21)16-17-7-10-19(27)11-8-17/h7-15,20,24H,3-6,16H2,1-2H3,(H,28,30)(H,29,32)	CFNNZWFCMGXNGQ-UHFFFAOYSA-N	480.217283648							121757
SMR000093869	LSM-33201	BRD-A66566298, SID7969113	5309776	InChI=1S/C21H20N2O3/c1-2-25-19-12-6-5-11-18(19)22-20-16-9-3-4-10-17(16)21(24)23(20)14-15-8-7-13-26-15/h3-13,20,22H,2,14H2,1H3	TZKNJFPPPUUFLR-UHFFFAOYSA-N	CCOc1ccccc1NC2N(Cc3occc3)C(=O)c4ccccc24	BroadT	BRD-A66566298	BRD-A66566298-001-05-8	ChemDiv Inc.	C429-0151			CCOc1ccccc1NC1N(Cc2ccco2)C(=O)c2ccccc12	InChI=1S/C21H20N2O3/c1-2-25-19-12-6-5-11-18(19)22-20-16-9-3-4-10-17(16)21(24)23(20)14-15-8-7-13-26-15/h3-13,20,22H,2,14H2,1H3	TZKNJFPPPUUFLR-UHFFFAOYSA-N	348.14739252							121758
SMR000196117	LSM-33202	BRD-K31233830, SID17506191	2911774	InChI=1S/C18H10BrNO5S/c19-12-7-9-13(10-8-12)26(23,24)25-20-17(21)14-5-1-3-11-4-2-6-15(16(11)14)18(20)22/h1-10H	XHVCNNBNWOTBRP-UHFFFAOYSA-N	Brc1ccc(cc1)S(=O)(=O)ON2C(=O)c3cccc4cccc(C2=O)c34	BroadT	BRD-K31233830	BRD-K31233830-001-05-0	ChemBridge Corporation	6718919			Brc1ccc(cc1)S(=O)(=O)ON1C(=O)c2cccc3cccc(C1=O)c23	InChI=1S/C18H10BrNO5S/c19-12-7-9-13(10-8-12)26(23,24)25-20-17(21)14-5-1-3-11-4-2-6-15(16(11)14)18(20)22/h1-10H	XHVCNNBNWOTBRP-UHFFFAOYSA-N	430.94630572							121759
CHEMBL590285	LSM-44461	BRD-K57202089, SID49643895	1922265	InChI=1S/C18H15NO4S/c1-22-15-9-13(10-16-17(20)19-18(21)24-16)7-8-14(15)23-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,19,20,21)/b16-10+	ZMPONXGAPWHWCS-MHWRWJLKSA-N	COc1cc(\C=C/2\SC(=O)NC2=O)ccc1OCc3ccccc3	BroadT	BRD-K57202089	BRD-K57202089-001-05-2	Asinex Ltd.	BAS 00330664			COc1cc(\C=C2\SC(=O)NC2=O)ccc1OCc1ccccc1	InChI=1S/C18H15NO4S/c1-22-15-9-13(10-16-17(20)19-18(21)24-16)7-8-14(15)23-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,19,20,21)/b16-10+	ZMPONXGAPWHWCS-MHWRWJLKSA-N	341.07217866							
N-(4-Methylbenzyl)-2-(2-pyridinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxamide	LSM-33204	BRD-K66733186, SID14729824	1475146	InChI=1S/C19H15F3N4O/c1-12-5-7-13(8-6-12)10-25-18(27)14-11-24-17(15-4-2-3-9-23-15)26-16(14)19(20,21)22/h2-9,11H,10H2,1H3,(H,25,27)	RHVTWQDPVGVTME-UHFFFAOYSA-N	Cc1ccc(CNC(=O)c2cnc(nc2C(F)(F)F)c3ccccn3)cc1	BroadT	BRD-K66733186	BRD-K66733186-001-05-7	Key Organics Ltd.	3X-0878			Cc1ccc(CNC(=O)c2cnc(nc2C(F)(F)F)-c2ccccn2)cc1	InChI=1S/C19H15F3N4O/c1-12-5-7-13(8-6-12)10-25-18(27)14-11-24-17(15-4-2-3-9-23-15)26-16(14)19(20,21)22/h2-9,11H,10H2,1H3,(H,25,27)	RHVTWQDPVGVTME-UHFFFAOYSA-N	372.11979574							121761
AC1LXNJ7	LSM-33205	BRD-K67835515, SID26671126	1853758	InChI=1S/C16H20N4O4/c1-11(15(23)17-10-6-2-3-9-14(21)22)20-16(24)12-7-4-5-8-13(12)18-19-20/h4-5,7-8,11H,2-3,6,9-10H2,1H3,(H,17,23)(H,21,22)/t11-/m0/s1	JLDCBCSVNNFBMZ-NSHDSACASA-N	C[C@H](N1N=Nc2ccccc2C1=O)C(=O)NCCCCCC(=O)O	BroadT	BRD-K67835515	BRD-K67835515-001-05-1	InterBioScreen Ltd.	STOCK5S-39168			C[C@@H](C(=O)NCCCCCC(O)=O)n1nnc2ccccc2c1=O	InChI=1S/C16H20N4O4/c1-11(15(23)17-10-6-2-3-9-14(21)22)20-16(24)12-7-4-5-8-13(12)18-19-20/h4-5,7-8,11H,2-3,6,9-10H2,1H3,(H,17,23)(H,21,22)/t11-/m0/s1	JLDCBCSVNNFBMZ-NSHDSACASA-N	332.14845516							121762
AC1MUFY1	LSM-33206	BRD-K22173206	3617792	InChI=1S/C19H21N3O2S/c1-12-4-6-13(7-5-12)20-18(25)22-21-16-11-19(2,3)24-17-9-8-14(23)10-15(16)17/h4-10,23H,11H2,1-3H3,(H2,20,22,25)	RBSSRAAZZZALGM-UHFFFAOYSA-N	Cc1ccc(NC(=NN=C2CC(C)(C)Oc3ccc(O)cc23)S)cc1	BroadT	BRD-K22173206	BRD-K22173206-001-05-5	ChemDiv Inc.	K786-0947			Cc1ccc(NC(S)=NN=C2CC(C)(C)Oc3ccc(O)cc23)cc1	InChI=1S/C19H21N3O2S/c1-12-4-6-13(7-5-12)20-18(25)22-21-16-11-19(2,3)24-17-9-8-14(23)10-15(16)17/h4-10,23H,11H2,1-3H3,(H2,20,22,25)	RBSSRAAZZZALGM-UHFFFAOYSA-N	355.135447632							121763
N-[(3-Cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide	LSM-33207	BRD-K81160595, SID17506181	1869844	InChI=1S/C21H18N4O2S2/c1-12-17(18(25-27-12)13-7-3-2-4-8-13)19(26)23-21(28)24-20-15(11-22)14-9-5-6-10-16(14)29-20/h2-4,7-8H,5-6,9-10H2,1H3,(H2,23,24,26,28)	LTRHHYCDHDAFSE-UHFFFAOYSA-N	Cc1onc(c2ccccc2)c1C(=O)NC(=S)Nc3sc4CCCCc4c3C#N	BroadT	BRD-K81160595	BRD-K81160595-001-05-9	InterBioScreen Ltd.	STOCK3S-74057			Cc1onc(c1C(=O)NC(=S)Nc1sc2CCCCc2c1C#N)-c1ccccc1	InChI=1S/C21H18N4O2S2/c1-12-17(18(25-27-12)13-7-3-2-4-8-13)19(26)23-21(28)24-20-15(11-22)14-9-5-6-10-16(14)29-20/h2-4,7-8H,5-6,9-10H2,1H3,(H2,23,24,26,28)	LTRHHYCDHDAFSE-UHFFFAOYSA-N	422.087117236							121764
T5278597	LSM-33208	BRD-A20314546, SID24831424	5116664	InChI=1S/C21H19N3O6S/c25-18(22-14-10-11-31(28,29)13-14)12-30-21(27)19-16-8-4-5-9-17(16)20(26)24(23-19)15-6-2-1-3-7-15/h1-9,14H,10-13H2,(H,22,25)	LDVMGQIHEPYHJY-UHFFFAOYSA-N	O=C(COC(=O)C1=NN(C(=O)c2ccccc12)c3ccccc3)NC4CCS(=O)(=O)C4	BroadT	BRD-A20314546	BRD-A20314546-001-05-8	Enamine Ltd.	T5278597			O=C(COC(=O)c1nn(-c2ccccc2)c(=O)c2ccccc12)NC1CCS(=O)(=O)C1	InChI=1S/C21H19N3O6S/c25-18(22-14-10-11-31(28,29)13-14)12-30-21(27)19-16-8-4-5-9-17(16)20(26)24(23-19)15-6-2-1-3-7-15/h1-9,14H,10-13H2,(H,22,25)	LDVMGQIHEPYHJY-UHFFFAOYSA-N	441.099456048							121765
MLS000696706	LSM-33209	BRD-K07011015, SID17515860, SID24397239	12006192	InChI=1S/C16H14N2S2/c1-12-4-2-5-13(10-12)11-20-16-8-7-14(17-18-16)15-6-3-9-19-15/h2-10H,11H2,1H3	VAYCVFPOMDYURN-UHFFFAOYSA-N	Cc1cccc(CSc2ccc(nn2)c3cccs3)c1	BroadT	BRD-K07011015	BRD-K07011015-001-06-5	Life Chemicals Inc.	F2004-0007			Cc1cccc(CSc2ccc(nn2)-c2cccs2)c1	InChI=1S/C16H14N2S2/c1-12-4-2-5-13(10-12)11-20-16-8-7-14(17-18-16)15-6-3-9-19-15/h2-10H,11H2,1H3	VAYCVFPOMDYURN-UHFFFAOYSA-N	298.059839848							121766
AC1LR996	LSM-33210	BRD-K91596921	1390688	InChI=1S/C17H14N6S2/c1-11-7-8-25-15(11)10-18-23-16(21-22-17(23)24)14-9-13(19-20-14)12-5-3-2-4-6-12/h2-10H,1H3,(H,19,20)(H,22,24)	JYXBPKCFOJNZEJ-UHFFFAOYSA-N	Cc1ccsc1C=Nn2c(S)nnc2c3cc([nH]n3)c4ccccc4	BroadT	BRD-K91596921	BRD-K91596921-001-05-7	InterBioScreen Ltd.	STOCK5S-06302			Cc1ccsc1C=Nn1c(S)nnc1-c1cc([nH]n1)-c1ccccc1	InChI=1S/C17H14N6S2/c1-11-7-8-25-15(11)10-18-23-16(21-22-17(23)24)14-9-13(19-20-14)12-5-3-2-4-6-12/h2-10H,1H3,(H,19,20)(H,22,24)	JYXBPKCFOJNZEJ-UHFFFAOYSA-N	366.072135888							121767
MLS001002737	LSM-3623	BRD-K72504866, SID24837465, SID87225729	2440433	InChI=1S/C25H34N4O3S/c1-19-8-7-9-23(20(19)2)28-14-16-29(17-15-28)25(30)22-18-21(33(31,32)26(3)4)10-11-24(22)27-12-5-6-13-27/h7-11,18H,5-6,12-17H2,1-4H3	VRSJAHQGJHDACS-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(c1)C(=O)N3CCN(CC3)c4cccc(C)c4C	BroadT	BRD-K72504866	BRD-K72504866-001-05-1	Enamine Ltd.	T5306134			CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(c1)C(=O)N1CCN(CC1)c1cccc(C)c1C	InChI=1S/C25H34N4O3S/c1-19-8-7-9-23(20(19)2)28-14-16-29(17-15-28)25(30)22-18-21(33(31,32)26(3)4)10-11-24(22)27-12-5-6-13-27/h7-11,18H,5-6,12-17H2,1-4H3	VRSJAHQGJHDACS-UHFFFAOYSA-N	470.235161678							93272
2-[4-(Trifluoromethoxy)phenyl]imidazo[1,2-a]pyrimidine	LSM-33211	2-4-(Trifluoromethoxy)Phenylimidazo1,2-Apyrimidine, SID26728703	2812032	InChI=1S/C13H8F3N3O/c14-13(15,16)20-10-4-2-9(3-5-10)11-8-19-7-1-6-17-12(19)18-11/h1-8H	SZQGKYQVQCHWMB-UHFFFAOYSA-N	FC(F)(F)Oc1ccc(cc1)c2cn3cccnc3n2	BroadT	BRD-K56469794	BRD-K56469794-001-06-2	Maybridge	HTS 04844			FC(F)(F)Oc1ccc(cc1)-c1cn2cccnc2n1	InChI=1S/C13H8F3N3O/c14-13(15,16)20-10-4-2-9(3-5-10)11-8-19-7-1-6-17-12(19)18-11/h1-8H	SZQGKYQVQCHWMB-UHFFFAOYSA-N	279.061946506							121768
SMR000074211	LSM-33212	BRD-K90594901, SID4265639, SID7966937	2196358	InChI=1S/C9H14N6S2/c1-6-10-8(14-12-6)16-4-3-5-17-9-11-7(2)13-15-9/h3-5H2,1-2H3,(H,10,12,14)(H,11,13,15)	XAAZFGMYQRCXCR-UHFFFAOYSA-N	Cc1n[nH]c(SCCCSc2n[nH]c(C)n2)n1	BroadT	BRD-K90594901	BRD-K90594901-001-04-0	ChemDiv Inc.	6032-0462			Cc1n[nH]c(SCCCSc2nc(C)n[nH]2)n1	InChI=1S/C9H14N6S2/c1-6-10-8(14-12-6)16-4-3-5-17-9-11-7(2)13-15-9/h3-5H2,1-2H3,(H,10,12,14)(H,11,13,15)	XAAZFGMYQRCXCR-UHFFFAOYSA-N	270.072135888							121769
F1821-0057	LSM-33213	BRD-K67980271, SID17515262	12005977	InChI=1S/C23H20N2O3S2/c1-16-7-12-20-21(15-16)29-23(25-20)17-8-10-18(11-9-17)24-22(26)13-14-30(27,28)19-5-3-2-4-6-19/h2-12,15H,13-14H2,1H3,(H,24,26)	GIFAHHVUDCKIJC-UHFFFAOYSA-N	Cc1ccc2nc(sc2c1)c3ccc(NC(=O)CCS(=O)(=O)c4ccccc4)cc3	BroadT	BRD-K67980271	BRD-K67980271-001-06-7	Life Chemicals Inc.	F1821-0057			Cc1ccc2nc(sc2c1)-c1ccc(NC(=O)CCS(=O)(=O)c2ccccc2)cc1	InChI=1S/C23H20N2O3S2/c1-16-7-12-20-21(15-16)29-23(25-20)17-8-10-18(11-9-17)24-22(26)13-14-30(27,28)19-5-3-2-4-6-19/h2-12,15H,13-14H2,1H3,(H,24,26)	GIFAHHVUDCKIJC-UHFFFAOYSA-N	436.0915339							121770
AC1O9OVR	LSM-33214	BRD-K54384984	6763749	InChI=1S/C25H25N3O2/c1-18(23-8-4-5-9-24(23)29)26-27-25(30)21-12-10-19(11-13-21)16-28-15-14-20-6-2-3-7-22(20)17-28/h2-13,29H,14-17H2,1H3,(H,27,30)	HBZUFNTXGGIEMG-UHFFFAOYSA-N	CC(=NNC(=O)c1ccc(CN2CCc3ccccc3C2)cc1)c4ccccc4O	BroadT	BRD-K54384984	BRD-K54384984-001-06-5	ChemDiv Inc.	8008-0971			CC(=NNC(=O)c1ccc(CN2CCc3ccccc3C2)cc1)c1ccccc1O	InChI=1S/C25H25N3O2/c1-18(23-8-4-5-9-24(23)29)26-27-25(30)21-12-10-19(11-13-21)16-28-15-14-20-6-2-3-7-22(20)17-28/h2-13,29H,14-17H2,1H3,(H,27,30)	HBZUFNTXGGIEMG-UHFFFAOYSA-N	399.19467707							
ST022321	LSM-33215	BRD-K26826253, SID843204	645488	InChI=1S/C15H22ClN3O2/c1-17-7-9-18(10-8-17)13-12(16)14(20)19(15(13)21)11-5-3-2-4-6-11/h11H,2-10H2,1H3	UUJNISKXXQVAEH-UHFFFAOYSA-N	CN1CCN(CC1)C2=C(Cl)C(=O)N(C3CCCCC3)C2=O	BroadT	BRD-K26826253	BRD-K26826253-001-06-4	Asinex Ltd.	BAS 01910803			CN1CCN(CC1)C1=C(Cl)C(=O)N(C2CCCCC2)C1=O	InChI=1S/C15H22ClN3O2/c1-17-7-9-18(10-8-17)13-12(16)14(20)19(15(13)21)11-5-3-2-4-6-11/h11H,2-10H2,1H3	UUJNISKXXQVAEH-UHFFFAOYSA-N	311.140054684							121772
F2004-0010	LSM-33216	BRD-K38766433, SID17515807	7207093	InChI=1S/C15H11FN2OS/c16-12-4-1-3-11(9-12)10-20-15-7-6-13(17-18-15)14-5-2-8-19-14/h1-9H,10H2	WDFLSTQJUFMIIW-UHFFFAOYSA-N	Fc1cccc(CSc2ccc(nn2)c3occc3)c1	BroadT	BRD-K38766433	BRD-K38766433-001-06-1	Life Chemicals Inc.	F2004-0010			Fc1cccc(CSc2ccc(nn2)-c2ccco2)c1	InChI=1S/C15H11FN2OS/c16-12-4-1-3-11(9-12)10-20-15-7-6-13(17-18-15)14-5-2-8-19-14/h1-9H,10H2	WDFLSTQJUFMIIW-UHFFFAOYSA-N	286.057611882							121773
SMR000130955	LSM-33217	BRD-K08247496, SID14735272	6625343	InChI=1S/C24H21N3O2S/c28-23-19-8-4-5-9-21(19)30-22-13-12-18(26-24(29)25-17-10-11-17)14-20(22)27(23)15-16-6-2-1-3-7-16/h1-9,12-14,17H,10-11,15H2,(H2,25,26,29)	KHNSTLWEHCTSHA-UHFFFAOYSA-N	O=C(NC1CC1)Nc2ccc3Sc4ccccc4C(=O)N(Cc5ccccc5)c3c2	BroadT	BRD-K08247496	BRD-K08247496-001-06-2	ChemDiv Inc.	C799-0074			O=C(NC1CC1)Nc1ccc2Sc3ccccc3C(=O)N(Cc3ccccc3)c2c1	InChI=1S/C24H21N3O2S/c28-23-19-8-4-5-9-21(19)30-22-13-12-18(26-24(29)25-17-10-11-17)14-20(22)27(23)15-16-6-2-1-3-7-16/h1-9,12-14,17H,10-11,15H2,(H2,25,26,29)	KHNSTLWEHCTSHA-UHFFFAOYSA-N	415.135447632							121774
ST50024477	LSM-33218	BRD-K48276655, SID842567	644836	InChI=1S/C16H12N2O3/c19-15(18-10-12-6-3-4-8-17-12)13-9-11-5-1-2-7-14(11)21-16(13)20/h1-9H,10H2,(H,18,19)	OPOWDKHBUXIGGC-UHFFFAOYSA-N	O=C(NCc1ccccn1)C2=Cc3ccccc3OC2=O	BroadT	BRD-K48276655	BRD-K48276655-001-05-2	Asinex Ltd.	BAS 06732245			O=C(NCc1ccccn1)c1cc2ccccc2oc1=O	InChI=1S/C16H12N2O3/c19-15(18-10-12-6-3-4-8-17-12)13-9-11-5-1-2-7-14(11)21-16(13)20/h1-9H,10H2,(H,18,19)	OPOWDKHBUXIGGC-UHFFFAOYSA-N	280.084792264							121775
T5235483	LSM-33219	BRD-K84320538, SID3714571, SID87336205	2998855	InChI=1S/C20H20N4O4S2/c1-2-3-10-23-17-9-8-13(30(21,27)28)11-16(17)22-20(23)29-12-24-18(25)14-6-4-5-7-15(14)19(24)26/h4-9,11H,2-3,10,12H2,1H3,(H2,21,27,28)	AFDYPIPHTVUMJL-UHFFFAOYSA-N	CCCCn1c(SCN2C(=O)c3ccccc3C2=O)nc4cc(ccc14)S(=O)(=O)N	BroadT	BRD-K84320538	BRD-K84320538-001-05-6	Enamine Ltd.	T5235483			CCCCn1c(SCN2C(=O)c3ccccc3C2=O)nc2cc(ccc12)S(N)(=O)=O	InChI=1S/C20H20N4O4S2/c1-2-3-10-23-17-9-8-13(30(21,27)28)11-16(17)22-20(23)29-12-24-18(25)14-6-4-5-7-15(14)19(24)26/h4-9,11H,2-3,10,12H2,1H3,(H2,21,27,28)	AFDYPIPHTVUMJL-UHFFFAOYSA-N	444.09259654							121776
ZINC03314136	LSM-33220	BRD-K73088636, SID22406342	2429905	InChI=1S/C20H21NO6S/c1-26-20(25)17-13-8-3-2-4-10-15(13)28-18(17)21-16(23)11-27-19(24)12-7-5-6-9-14(12)22/h5-7,9,22H,2-4,8,10-11H2,1H3,(H,21,23)	IUCLIZICDPQNIF-UHFFFAOYSA-N	COC(=O)c1c2CCCCCc2sc1NC(=O)COC(=O)c3ccccc3O	BroadT	BRD-K73088636	BRD-K73088636-001-05-3	Enamine Ltd.	T0516-0402			COC(=O)c1c(NC(=O)COC(=O)c2ccccc2O)sc2CCCCCc12	InChI=1S/C20H21NO6S/c1-26-20(25)17-13-8-3-2-4-10-15(13)28-18(17)21-16(23)11-27-19(24)12-7-5-6-9-14(12)22/h5-7,9,22H,2-4,8,10-11H2,1H3,(H,21,23)	IUCLIZICDPQNIF-UHFFFAOYSA-N	403.108958092							121777
ZINC01141515	LSM-33221	BRD-K10404799, SID24792752	1314157	InChI=1S/C15H13Cl2N5O2/c1-2-7-22-20-15(19-21-22)18-14(23)13-6-5-12(24-13)10-8-9(16)3-4-11(10)17/h3-6,8H,2,7H2,1H3,(H,18,20,23)	UPKZDJZOSFGVMT-UHFFFAOYSA-N	CCCn1nnc(NC(=O)c2oc(cc2)c3cc(Cl)ccc3Cl)n1	BroadT	BRD-K10404799	BRD-K10404799-001-05-1	ChemBridge Corporation	7590554			CCCn1nnc(NC(=O)c2ccc(o2)-c2cc(Cl)ccc2Cl)n1	InChI=1S/C15H13Cl2N5O2/c1-2-7-22-20-15(19-21-22)18-14(23)13-6-5-12(24-13)10-8-9(16)3-4-11(10)17/h3-6,8H,2,7H2,1H3,(H,18,20,23)	UPKZDJZOSFGVMT-UHFFFAOYSA-N	365.044630126							121778
ZINC03275694	LSM-33222	BRD-K36537572	6844001	InChI=1S/C19H21N3O5S/c23-17-8-7-14(11-18(17)24)13-20-21-19(25)15-5-4-6-16(12-15)28(26,27)22-9-2-1-3-10-22/h4-8,11-13,23-24H,1-3,9-10H2,(H,21,25)	DAIUCFCXLZZLSR-UHFFFAOYSA-N	Oc1ccc(C=NNC(=O)c2cccc(c2)S(=O)(=O)N3CCCCC3)cc1O	BroadT	BRD-K36537572	BRD-K36537572-001-05-1	Enamine Ltd.	T0506-9027			Oc1ccc(C=NNC(=O)c2cccc(c2)S(=O)(=O)N2CCCCC2)cc1O	InChI=1S/C19H21N3O5S/c23-17-8-7-14(11-18(17)24)13-20-21-19(25)15-5-4-6-16(12-15)28(26,27)22-9-2-1-3-10-22/h4-8,11-13,23-24H,1-3,9-10H2,(H,21,25)	DAIUCFCXLZZLSR-UHFFFAOYSA-N	403.120191492							
ST055583	LSM-33223	BRD-K41649962, SID4244318	1513374	InChI=1S/C21H16N8/c1-3-7-17(8-4-1)29(18-9-5-2-6-10-18)21-25-19(27-13-11-22-15-27)24-20(26-21)28-14-12-23-16-28/h1-16H	TVBVXZRVHVVBFL-UHFFFAOYSA-N	c1ccc(cc1)N(c2ccccc2)c3nc(nc(n3)n4ccnc4)n5ccnc5	BroadT	BRD-K41649962	BRD-K41649962-001-05-5	ChemDiv Inc.	8013-7702			c1cn(cn1)-c1nc(nc(n1)-n1ccnc1)N(c1ccccc1)c1ccccc1	InChI=1S/C21H16N8/c1-3-7-17(8-4-1)29(18-9-5-2-6-10-18)21-25-19(27-13-11-22-15-27)24-20(26-21)28-14-12-23-16-28/h1-16H	TVBVXZRVHVVBFL-UHFFFAOYSA-N	380.149792592							121780
ZINC04126878	LSM-33224	BRD-K74971765, SID17505361	3168688	InChI=1S/C16H16N6O3S/c1-10-2-4-12(5-3-10)25-8-13(23)21-22-14(24)9-26-16-19-7-11(6-17)15(18)20-16/h2-5,7H,8-9H2,1H3,(H,21,23)(H,22,24)(H2,18,19,20)	FEPWHJZCQSXKQD-UHFFFAOYSA-N	Cc1ccc(OCC(=O)NNC(=O)CSc2ncc(C#N)c(N)n2)cc1	BroadT	BRD-K74971765	BRD-K74971765-001-05-2	Asinex Ltd.	ASN 03016793			Cc1ccc(OCC(=O)NNC(=O)CSc2ncc(C#N)c(N)n2)cc1	InChI=1S/C16H16N6O3S/c1-10-2-4-12(5-3-10)25-8-13(23)21-22-14(24)9-26-16-19-7-11(6-17)15(18)20-16/h2-5,7H,8-9H2,1H3,(H,21,23)(H,22,24)(H2,18,19,20)	FEPWHJZCQSXKQD-UHFFFAOYSA-N	372.100459122							121781
AK-968/12572115	LSM-33225	BRD-A91931411, SID14727810	4748886	InChI=1S/C19H23NO4S2/c1-12(2)24-19(21)17-15-10-9-13(3)11-16(15)25-18(17)20-26(22,23)14-7-5-4-6-8-14/h4-8,12-13,20H,9-11H2,1-3H3	ANMXERMCPKPWLU-UHFFFAOYSA-N	CC(C)OC(=O)c1c2CCC(C)Cc2sc1NS(=O)(=O)c3ccccc3	BroadT	BRD-A91931411	BRD-A91931411-001-05-5	Specs	AK-968/12572115			CC(C)OC(=O)c1c(NS(=O)(=O)c2ccccc2)sc2CC(C)CCc12	InChI=1S/C19H23NO4S2/c1-12(2)24-19(21)17-15-10-9-13(3)11-16(15)25-18(17)20-26(22,23)14-7-5-4-6-8-14/h4-8,12-13,20H,9-11H2,1-3H3	ANMXERMCPKPWLU-UHFFFAOYSA-N	393.106849606							121782
[4-(2-Methoxyphenyl)piperidino](5-methyl-1-phenyl-1H-pyrazol-4-yl)methanone	LSM-33226	4-(2-Methoxyphenyl)Piperidino(5-Methyl-1-Phenyl-1H-Pyrazol-4-yl)Methanone, SID26726571	2810968	InChI=1S/C23H25N3O2/c1-17-21(16-24-26(17)19-8-4-3-5-9-19)23(27)25-14-12-18(13-15-25)20-10-6-7-11-22(20)28-2/h3-11,16,18H,12-15H2,1-2H3	SFTMVDXPSBQOBJ-UHFFFAOYSA-N	COc1ccccc1C2CCN(CC2)C(=O)c3cnn(c3C)c4ccccc4	BroadT	BRD-K25363217	BRD-K25363217-001-05-6	Maybridge	HTS 02987			COc1ccccc1C1CCN(CC1)C(=O)c1cnn(c1C)-c1ccccc1	InChI=1S/C23H25N3O2/c1-17-21(16-24-26(17)19-8-4-3-5-9-19)23(27)25-14-12-18(13-15-25)20-10-6-7-11-22(20)28-2/h3-11,16,18H,12-15H2,1-2H3	SFTMVDXPSBQOBJ-UHFFFAOYSA-N	375.19467707							121783
MLS000561999	LSM-44462	BRD-A19829191, SID26659793	16681972	InChI=1S/C25H25ClN4O5/c1-2-4-22(31)28-18-6-3-5-16(11-18)20-12-25(35-29-20)13-21(24(27)33)30(15-25)23(32)14-34-19-9-7-17(26)8-10-19/h2-11,21H,12-15H2,1H3,(H2,27,33)(H,28,31)/b4-2-/t21-,25?/m0/s1	FHGYPCDIZJDLGC-OSKHJZBKSA-N	C\C=C/C(=O)Nc1cccc(c1)C2=NOC3(C[C@H](N(C3)C(=O)COc4ccc(Cl)cc4)C(=O)N)C2	BroadT	BRD-A19829191	BRD-A19829191-001-05-6	University of California at Davis	UCD_SMD_1-039			C\C=C/C(=O)Nc1cccc(c1)C1=NOC2(C[C@H](N(C2)C(=O)COc2ccc(Cl)cc2)C(N)=O)C1	InChI=1S/C25H25ClN4O5/c1-2-4-22(31)28-18-6-3-5-16(11-18)20-12-25(35-29-20)13-21(24(27)33)30(15-25)23(32)14-34-19-9-7-17(26)8-10-19/h2-11,21H,12-15H2,1H3,(H2,27,33)(H,28,31)/b4-2-/t21-,25?/m0/s1	FHGYPCDIZJDLGC-OSKHJZBKSA-N	496.15134765							
N-[2-(4-Chloro-benzylsulfanyl)-6-hydroxy-pyrimidin-4-yl]-benzenesulfonamide	LSM-33228	BRD-K72261386, SID17507843	1151682	InChI=1S/C17H14ClN3O3S2/c18-13-8-6-12(7-9-13)11-25-17-19-15(10-16(22)20-17)21-26(23,24)14-4-2-1-3-5-14/h1-10H,11H2,(H2,19,20,21,22)	JLDONEFOBUEJOL-UHFFFAOYSA-N	Oc1cc(NS(=O)(=O)c2ccccc2)nc(SCc3ccc(Cl)cc3)n1	BroadT	BRD-K72261386	BRD-K72261386-001-05-9	Asinex Ltd.	ASN 02749253			Oc1cc(NS(=O)(=O)c2ccccc2)nc(SCc2ccc(Cl)cc2)n1	InChI=1S/C17H14ClN3O3S2/c18-13-8-6-12(7-9-13)11-25-17-19-15(10-16(22)20-17)21-26(23,24)14-4-2-1-3-5-14/h1-10H,11H2,(H2,19,20,21,22)	JLDONEFOBUEJOL-UHFFFAOYSA-N	407.016510428							121785
6,7-Dimethyl-1H-pyrazolo[3,4-b]quinolin-3-ylamine	LSM-33229	BRD-K56802897, SID17410843	1133285	InChI=1S/C12H12N4/c1-6-3-8-5-9-11(13)15-16-12(9)14-10(8)4-7(6)2/h3-5H,1-2H3,(H3,13,14,15,16)	XSYYLQJMAAYYFC-UHFFFAOYSA-N	Cc1cc2cc3c(N)[nH]nc3nc2cc1C	BroadT	BRD-K56802897	BRD-K56802897-001-05-2	Asinex Ltd.	ASN 02538277			Cc1cc2cc3c(N)[nH]nc3nc2cc1C	InChI=1S/C12H12N4/c1-6-3-8-5-9-11(13)15-16-12(9)14-10(8)4-7(6)2/h3-5H,1-2H3,(H3,13,14,15,16)	XSYYLQJMAAYYFC-UHFFFAOYSA-N	212.106196424							121786
Ethylbeta-carboline-3-carboxylate	LSM-3077	Ethyl-Beta-Carboline-3-Carboxylate	105078	InChI=1S/C14H12N2O2/c1-2-18-14(17)12-7-10-9-5-3-4-6-11(9)16-13(10)8-15-12/h3-8,16H,2H2,1H3	KOVRZNUMIKACTB-UHFFFAOYSA-N	CCOC(=O)c1cc2c(cn1)[nH]c3ccccc23	BroadT	BRD-K49061529	BRD-K49061529-001-05-1	Sigma-Aldrich	244309			CCOC(=O)c1cc2c(cn1)[nH]c1ccccc21	InChI=1S/C14H12N2O2/c1-2-18-14(17)12-7-10-9-5-3-4-6-11(9)16-13(10)8-15-12/h3-8,16H,2H2,1H3	KOVRZNUMIKACTB-UHFFFAOYSA-N	240.089877644							92850
2-(2-Methylphenoxy)-n-(pyridin-2-ylmethylideneamino)acetamide	LSM-33230	BRD-K98326977	773829	InChI=1S/C15H15N3O2/c1-12-6-2-3-8-14(12)20-11-15(19)18-17-10-13-7-4-5-9-16-13/h2-10H,11H2,1H3,(H,18,19)	NMOVELUNTQSILU-UHFFFAOYSA-N	Cc1ccccc1OCC(=O)NN=Cc2ccccn2	BroadT	BRD-K98326977	BRD-K98326977-001-06-3	ChemDiv Inc.	2061-0023			Cc1ccccc1OCC(=O)NN=Cc1ccccn1	InChI=1S/C15H15N3O2/c1-12-6-2-3-8-14(12)20-11-15(19)18-17-10-13-7-4-5-9-16-13/h2-10H,11H2,1H3,(H,18,19)	NMOVELUNTQSILU-UHFFFAOYSA-N	269.11642675							121787
AC1LCSYO	LSM-33231	BRD-K62170825, SID852891	655536	InChI=1S/C21H24ClN3O4/c22-15-8-10-17(11-9-15)25(14-19(26)24-16-5-2-1-3-6-16)20(27)13-23-21(28)18-7-4-12-29-18/h4,7-12,16H,1-3,5-6,13-14H2,(H,23,28)(H,24,26)	KTHSMSBHFARDTP-UHFFFAOYSA-N	Clc1ccc(cc1)N(CC(=O)NC2CCCCC2)C(=O)CNC(=O)c3occc3	BroadT	BRD-K62170825	BRD-K62170825-001-05-3	Asinex Ltd.	ASN 05586098			Clc1ccc(cc1)N(CC(=O)NC1CCCCC1)C(=O)CNC(=O)c1ccco1	InChI=1S/C21H24ClN3O4/c22-15-8-10-17(11-9-15)25(14-19(26)24-16-5-2-1-3-6-16)20(27)13-23-21(28)18-7-4-12-29-18/h4,7-12,16H,1-3,5-6,13-14H2,(H,23,28)(H,24,26)	KTHSMSBHFARDTP-UHFFFAOYSA-N	417.145533988							121788
MLS000557233	LSM-33232	SID87346629, SID14743314, BRD-K70594121	3819199	InChI=1S/C27H31N3O2/c31-27(15-16-29-17-19-30(20-18-29)21-23-7-3-1-4-8-23)28-25-11-13-26(14-12-25)32-22-24-9-5-2-6-10-24/h1-14H,15-22H2,(H,28,31)	RWUIVHVVFWEECH-UHFFFAOYSA-N	O=C(CCN1CCN(Cc2ccccc2)CC1)Nc3ccc(OCc4ccccc4)cc3	BroadT	BRD-K70594121	BRD-K70594121-001-05-5	InterBioScreen Ltd.	STOCK4S-00482			O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1ccc(OCc2ccccc2)cc1	InChI=1S/C27H31N3O2/c31-27(15-16-29-17-19-30(20-18-29)21-23-7-3-1-4-8-23)28-25-11-13-26(14-12-25)32-22-24-9-5-2-6-10-24/h1-14H,15-22H2,(H,28,31)	RWUIVHVVFWEECH-UHFFFAOYSA-N	429.241627262							121789
ASN 02562680	LSM-15591	BRD-K02972160	3167818	InChI=1S/C19H22ClN5S/c1-24(2)12-3-13-25-18(16-8-10-21-11-9-16)22-23-19(25)26-14-15-4-6-17(20)7-5-15/h4-11H,3,12-14H2,1-2H3	GURJGBCZYNRYAO-UHFFFAOYSA-N	CN(C)CCCn1c(SCc2ccc(Cl)cc2)nnc1c3ccncc3	BroadT	BRD-K02972160	BRD-K02972160-034-05-9	Asinex Ltd.	ASN 02562680		OC(=O)C(=O)O	CN(C)CCCn1c(SCc2ccc(Cl)cc2)nnc1-c1ccncc1.OC(=O)C(=O)O	InChI=1S/C19H22ClN5S.C2H2O4/c1-24(2)12-3-13-25-18(16-8-10-21-11-9-16)22-23-19(25)26-14-15-4-6-17(20)7-5-15;3-1(4)2(5)6/h4-11H,3,12-14H2,1-2H3;(H,3,4)(H,5,6)	ZDMBQQRDLSKUGI-UHFFFAOYSA-N	387.128444154							104227, 104227
ST50070074	LSM-33233	BRD-K78477132, SID24814221	1522537	InChI=1S/C23H22N4O/c1-17-7-9-19(10-8-17)27-15-20(18-5-3-2-4-6-18)21-22(24-16-25-23(21)27)26-11-13-28-14-12-26/h2-10,15-16H,11-14H2,1H3	YYMGFBJBNRLEOT-UHFFFAOYSA-N	Cc1ccc(cc1)n2cc(c3ccccc3)c4c(ncnc24)N5CCOCC5	BroadT	BRD-K78477132	BRD-K78477132-001-04-5	ChemDiv Inc.	K405-0822			Cc1ccc(cc1)-n1cc(-c2ccccc2)c2c(ncnc12)N1CCOCC1	InChI=1S/C23H22N4O/c1-17-7-9-19(10-8-17)27-15-20(18-5-3-2-4-6-18)21-22(24-16-25-23(21)27)26-11-13-28-14-12-26/h2-10,15-16H,11-14H2,1H3	YYMGFBJBNRLEOT-UHFFFAOYSA-N	370.179361364							121790
ST50371922	LSM-33234	BRD-A37796306, SID22411716	3162315	InChI=1S/C25H25NO5/c1-4-31-25(28)24-22(15-8-6-5-7-9-15)23-18(26-24)12-17(13-19(23)27)16-10-11-20(29-2)21(14-16)30-3/h5-11,14,17,26H,4,12-13H2,1-3H3	AJFINBIBIHGQFB-UHFFFAOYSA-N	CCOC(=O)c1[nH]c2CC(CC(=O)c2c1c3ccccc3)c4ccc(OC)c(OC)c4	BroadT	BRD-A37796306	BRD-A37796306-001-05-7	ChemDiv Inc.	C276-0863			CCOC(=O)c1[nH]c2CC(CC(=O)c2c1-c1ccccc1)c1ccc(OC)c(OC)c1	InChI=1S/C25H25NO5/c1-4-31-25(28)24-22(15-8-6-5-7-9-15)23-18(26-24)12-17(13-19(23)27)16-10-11-20(29-2)21(14-16)30-3/h5-11,14,17,26H,4,12-13H2,1-3H3	AJFINBIBIHGQFB-UHFFFAOYSA-N	419.17327291							121791
SMR000063273	LSM-33235	BRD-A92490200, SID24839857, SID3717227	2999917	InChI=1S/C20H28N4O6S/c1-3-4-9-20(2)18(26)24(19(27)22-20)14-17(25)21-15-5-7-16(8-6-15)31(28,29)23-10-12-30-13-11-23/h5-8H,3-4,9-14H2,1-2H3,(H,21,25)(H,22,27)	ISHJBUDZMOAMBR-UHFFFAOYSA-N	CCCCC1(C)NC(=O)N(CC(=O)Nc2ccc(cc2)S(=O)(=O)N3CCOCC3)C1=O	BroadT	BRD-A92490200	BRD-A92490200-001-05-6	Enamine Ltd.	T5228941			CCCCC1(C)NC(=O)N(CC(=O)Nc2ccc(cc2)S(=O)(=O)N2CCOCC2)C1=O	InChI=1S/C20H28N4O6S/c1-3-4-9-20(2)18(26)24(19(27)22-20)14-17(25)21-15-5-7-16(8-6-15)31(28,29)23-10-12-30-13-11-23/h5-8H,3-4,9-14H2,1-2H3,(H,21,25)(H,22,27)	ISHJBUDZMOAMBR-UHFFFAOYSA-N	452.172955346							121792
1-(5-Nitrothiophen-2-yl)piperidine	LSM-33236	BRD-K63912037, SID24814047	4326087	InChI=1S/C9H12N2O2S/c12-11(13)9-5-4-8(14-9)10-6-2-1-3-7-10/h4-5H,1-3,6-7H2	AHXNCGUEOCEZLI-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(s1)N2CCCCC2	BroadT	BRD-K63912037	BRD-K63912037-001-05-1	ChemDiv Inc.	K906-0987			[O-][N+](=O)c1ccc(s1)N1CCCCC1	InChI=1S/C9H12N2O2S/c12-11(13)9-5-4-8(14-9)10-6-2-1-3-7-10/h4-5H,1-3,6-7H2	AHXNCGUEOCEZLI-UHFFFAOYSA-N	212.061948334							121793
ASN 07154486	LSM-33237	BRD-K77751431, SID26667921, SID851576	654163	InChI=1S/C24H31N3O4S/c1-2-31-23-8-4-3-7-22(23)25-24(28)19-13-17-26(18-14-19)20-9-11-21(12-10-20)32(29,30)27-15-5-6-16-27/h3-4,7-12,19H,2,5-6,13-18H2,1H3,(H,25,28)	VUUGZXQBIDNYNT-UHFFFAOYSA-N	CCOc1ccccc1NC(=O)C2CCN(CC2)c3ccc(cc3)S(=O)(=O)N4CCCC4	BroadT	BRD-K77751431	BRD-K77751431-001-05-9	Asinex Ltd.	ASN 07154486			CCOc1ccccc1NC(=O)C1CCN(CC1)c1ccc(cc1)S(=O)(=O)N1CCCC1	InChI=1S/C24H31N3O4S/c1-2-31-23-8-4-3-7-22(23)25-24(28)19-13-17-26(18-14-19)20-9-11-21(12-10-20)32(29,30)27-15-5-6-16-27/h3-4,7-12,19H,2,5-6,13-18H2,1H3,(H,25,28)	VUUGZXQBIDNYNT-UHFFFAOYSA-N	457.203527192							121794
T0511-9296	LSM-33238	SID22401015, BRD-K22002184	4149513	InChI=1S/C23H26N4O3S2/c1-17-10-11-18(14-21(17)32(29,30)27-12-6-2-3-7-13-27)26-22(28)15-31-23-19-8-4-5-9-20(19)24-16-25-23/h4-5,8-11,14,16H,2-3,6-7,12-13,15H2,1H3,(H,26,28)	BTCGXZHPIJJNKU-UHFFFAOYSA-N	Cc1ccc(NC(=O)CSc2ncnc3ccccc23)cc1S(=O)(=O)N4CCCCCC4	BroadT	BRD-K22002184	BRD-K22002184-001-06-0	Enamine Ltd.	T0511-9296			Cc1ccc(NC(=O)CSc2ncnc3ccccc23)cc1S(=O)(=O)N1CCCCCC1	InChI=1S/C23H26N4O3S2/c1-17-10-11-18(14-21(17)32(29,30)27-12-6-2-3-7-13-27)26-22(28)15-31-23-19-8-4-5-9-20(19)24-16-25-23/h4-5,8-11,14,16H,2-3,6-7,12-13,15H2,1H3,(H,26,28)	BTCGXZHPIJJNKU-UHFFFAOYSA-N	470.144632112							121795
T0502-0053	LSM-33239	BRD-K42943023, SID17388463	694360	InChI=1S/C15H13N3OS2/c16-7-11-10(13-2-1-5-20-13)6-12(9-3-4-9)18-15(11)21-8-14(17)19/h1-2,5-6,9H,3-4,8H2,(H2,17,19)	ZLJVVAGJGBXEHR-UHFFFAOYSA-N	NC(=O)CSc1nc(cc(c2cccs2)c1C#N)C3CC3	BroadT	BRD-K42943023	BRD-K42943023-001-05-8	Enamine Ltd.	T0502-0053			NC(=O)CSc1nc(cc(-c2cccs2)c1C#N)C1CC1	InChI=1S/C15H13N3OS2/c16-7-11-10(13-2-1-5-20-13)6-12(9-3-4-9)18-15(11)21-8-14(17)19/h1-2,5-6,9H,3-4,8H2,(H2,17,19)	ZLJVVAGJGBXEHR-UHFFFAOYSA-N	315.050003446							121796
MLS001239381	LSM-15471	BRD-K10640729	24892084	InChI=1S/C29H32N4O3S2/c1-21-8-6-11-26-27(21)30-29(37-26)33(18-7-17-31(2)3)28(34)23-12-14-25(15-13-23)38(35,36)32-19-16-22-9-4-5-10-24(22)20-32/h4-6,8-15H,7,16-20H2,1-3H3	ULYMEGNMFCTJHO-UHFFFAOYSA-N	CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N2CCc3ccccc3C2)c4nc5c(C)cccc5s4	BroadT	BRD-K10640729	BRD-K10640729-003-05-1	Life Chemicals Inc.	F2019-0956		Cl	CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1)c1nc2c(C)cccc2s1.Cl	InChI=1S/C29H32N4O3S2.ClH/c1-21-8-6-11-26-27(21)30-29(37-26)33(18-7-17-31(2)3)28(34)23-12-14-25(15-13-23)38(35,36)32-19-16-22-9-4-5-10-24(22)20-32;/h4-6,8-15H,7,16-20H2,1-3H3;1H	VDILCQJSDWXJFZ-UHFFFAOYSA-N	548.191582304							104113, 104113
6-(2-Methylpiperidin-1-yl)-5-nitropyrimidin-4-amine	LSM-33240	BRD-A70167453, SID24816248	4321730	InChI=1S/C10H15N5O2/c1-7-4-2-3-5-14(7)10-8(15(16)17)9(11)12-6-13-10/h6-7H,2-5H2,1H3,(H2,11,12,13)	FTJQTRQPROZQMN-UHFFFAOYSA-N	CC1CCCCN1c2ncnc(N)c2[N+](=O)[O-]	BroadT	BRD-A70167453	BRD-A70167453-001-06-8	Life Chemicals Inc.	F0543-0220			CC1CCCCN1c1ncnc(N)c1[N+]([O-])=O	InChI=1S/C10H15N5O2/c1-7-4-2-3-5-14(7)10-8(15(16)17)9(11)12-6-13-10/h6-7H,2-5H2,1H3,(H2,11,12,13)	FTJQTRQPROZQMN-UHFFFAOYSA-N	237.12257477							121797
BAS 07311444	LSM-33241	BRD-A50287893, SID847439	649845	InChI=1S/C14H19NO4S/c1-8-4-5-9-10(6-8)20-13(12(9)14(17)19-3)15-11(16)7-18-2/h8H,4-7H2,1-3H3,(H,15,16)	UUFQPZKQSZMCKL-UHFFFAOYSA-N	COCC(=O)Nc1sc2CC(C)CCc2c1C(=O)OC	BroadT	BRD-A50287893	BRD-A50287893-001-05-8	Asinex Ltd.	BAS 07311444			COCC(=O)Nc1sc2CC(C)CCc2c1C(=O)OC	InChI=1S/C14H19NO4S/c1-8-4-5-9-10(6-8)20-13(12(9)14(17)19-3)15-11(16)7-18-2/h8H,4-7H2,1-3H3,(H,15,16)	UUFQPZKQSZMCKL-UHFFFAOYSA-N	297.103478788							121798
FM19G11	LSM-33242	BRD-K35596700, SID17387839	1730746	InChI=1S/C23H17N3O8/c1-14-5-7-15(8-6-14)21(27)13-34-23(29)16-3-2-4-17(11-16)24-22(28)19-10-9-18(25(30)31)12-20(19)26(32)33/h2-12H,13H2,1H3,(H,24,28)	XVUOIWIIQVGWAJ-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)COC(=O)c2cccc(NC(=O)c3ccc(cc3[N+](=O)[O-])[N+](=O)[O-])c2	BroadT	BRD-K35596700	BRD-K35596700-001-06-1	Specs	AK-918/11884136			Cc1ccc(cc1)C(=O)COC(=O)c1cccc(NC(=O)c2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)c1	InChI=1S/C23H17N3O8/c1-14-5-7-15(8-6-14)21(27)13-34-23(29)16-3-2-4-17(11-16)24-22(28)19-10-9-18(25(30)31)12-20(19)26(32)33/h2-12H,13H2,1H3,(H,24,28)	XVUOIWIIQVGWAJ-UHFFFAOYSA-N	463.101564534							121799
MLS000541483	LSM-33243	BRD-K75672292, SID14733054	2768837	InChI=1S/C12H10Cl2N2/c13-7-4-5-8(10(14)6-7)12-9-2-1-3-11(9)15-16-12/h4-6H,1-3H2,(H,15,16)	JCDSCQIIKBGNMO-UHFFFAOYSA-N	Clc1ccc(c(Cl)c1)c2[nH]nc3CCCc23	BroadT	BRD-K75672292	BRD-K75672292-001-06-5	Key Organics Ltd.	12H-337S			Clc1ccc(-c2[nH]nc3CCCc23)c(Cl)c1	InChI=1S/C12H10Cl2N2/c13-7-4-5-8(10(14)6-7)12-9-2-1-3-11(9)15-16-12/h4-6H,1-3H2,(H,15,16)	JCDSCQIIKBGNMO-UHFFFAOYSA-N	252.02210376							121800
AUSTROBAILIGNAN 6	LSM-4768	Macelignan, Austrobailignan 6, BRD-K94948151	10404245	InChI=1S/C20H24O4/c1-13(8-15-4-6-17(21)19(10-15)22-3)14(2)9-16-5-7-18-20(11-16)24-12-23-18/h4-7,10-11,13-14,21H,8-9,12H2,1-3H3/t13-,14+/m0/s1	QDDILOVMGWUNGD-UONOGXRCSA-N	COc1cc(C[C@H](C)[C@H](C)Cc2ccc3OCOc3c2)ccc1O	BroadT	BRD-K94948151	BRD-K94948151-001-06-6	University of North Carolina at Chapel Hill	(+)-Anwulignan DFC-18			COc1cc(C[C@H](C)[C@H](C)Cc2ccc3OCOc3c2)ccc1O	InChI=1S/C20H24O4/c1-13(8-15-4-6-17(21)19(10-15)22-3)14(2)9-16-5-7-18-20(11-16)24-12-23-18/h4-7,10-11,13-14,21H,8-9,12H2,1-3H3/t13-,14+/m0/s1	QDDILOVMGWUNGD-UONOGXRCSA-N	328.167459248							94153
MLS000663547	LSM-33244	BRD-K22610244, SID24803844	2955071	InChI=1S/C17H16N6O5/c24-17(18-11-1-3-12(4-2-11)23(25)26)19-13-5-6-14(16-15(13)20-28-21-16)22-7-9-27-10-8-22/h1-6H,7-10H2,(H2,18,19,24)	BJJUETIRJVEVLQ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NC(=O)Nc2ccc(N3CCOCC3)c4nonc24)cc1	BroadT	BRD-K22610244	BRD-K22610244-001-06-8	ChemBridge Corporation	7792458			[O-][N+](=O)c1ccc(NC(=O)Nc2ccc(N3CCOCC3)c3nonc23)cc1	InChI=1S/C17H16N6O5/c24-17(18-11-1-3-12(4-2-11)23(25)26)19-13-5-6-14(16-15(13)20-28-21-16)22-7-9-27-10-8-22/h1-6H,7-10H2,(H2,18,19,24)	BJJUETIRJVEVLQ-UHFFFAOYSA-N	384.118217672							121801
AC1NJ2O9	LSM-33245	BRD-A20208638, SID24839581	4840693	InChI=1S/C17H21N3O4S2/c1-11-9-20(10-12(2)24-11)26(22,23)15-6-4-5-14(7-15)16(21)19-17-18-8-13(3)25-17/h4-8,11-12H,9-10H2,1-3H3,(H,18,19,21)	QYEKUAKGOAYUDR-UHFFFAOYSA-N	CC1CN(CC(C)O1)S(=O)(=O)c2cccc(c2)C(=O)Nc3ncc(C)s3	BroadT	BRD-A20208638	BRD-A20208638-001-05-1	Enamine Ltd.	T5341162			CC1CN(CC(C)O1)S(=O)(=O)c1cccc(c1)C(=O)Nc1ncc(C)s1	InChI=1S/C17H21N3O4S2/c1-11-9-20(10-12(2)24-11)26(22,23)15-6-4-5-14(7-15)16(21)19-17-18-8-13(3)25-17/h4-8,11-12H,9-10H2,1-3H3,(H,18,19,21)	QYEKUAKGOAYUDR-UHFFFAOYSA-N	395.097347562							121802
AN-465/41989675	LSM-15472	BRD-K58248315, DNDI1417646	1017312	InChI=1S/C21H26ClNO2/c1-2-24-20-13-17(14-23-18-10-6-7-11-18)12-19(22)21(20)25-15-16-8-4-3-5-9-16/h3-5,8-9,12-13,18,23H,2,6-7,10-11,14-15H2,1H3	OXBGNWDZXDFSIY-UHFFFAOYSA-N	CCOc1cc(CNC2CCCC2)cc(Cl)c1OCc3ccccc3	BroadT	BRD-K58248315	BRD-K58248315-003-05-6	ChemBridge Corporation	7734075		Cl	CCOc1cc(CNC2CCCC2)cc(Cl)c1OCc1ccccc1.Cl	InChI=1S/C21H26ClNO2.ClH/c1-2-24-20-13-17(14-23-18-10-6-7-11-18)12-19(22)21(20)25-15-16-8-4-3-5-9-16;/h3-5,8-9,12-13,18,23H,2,6-7,10-11,14-15H2,1H3;1H	KLSPZLXLGJCLRB-UHFFFAOYSA-N	359.165206792							104114, 104114
MLS000543292	LSM-33246	SID17403043, BRD-K23905877	2764846	InChI=1S/C16H14N4O2/c1-11-5-7-12(8-6-11)15-10-18-19(16(15)17)13-3-2-4-14(9-13)20(21)22/h2-10H,17H2,1H3	ZJRPZJNFUUXQMR-UHFFFAOYSA-N	Cc1ccc(cc1)c2cnn(c2N)c3cccc(c3)[N+](=O)[O-]	BroadT	BRD-K23905877	BRD-K23905877-001-05-7	Key Organics Ltd.	10E-306S			Cc1ccc(cc1)-c1cnn(c1N)-c1cccc(c1)[N+]([O-])=O	InChI=1S/C16H14N4O2/c1-11-5-7-12(8-6-11)15-10-18-19(16(15)17)13-3-2-4-14(9-13)20(21)22/h2-10H,17H2,1H3	ZJRPZJNFUUXQMR-UHFFFAOYSA-N	294.111675728							121803
SMR000121631	LSM-33247	BRD-K81952048, SID14727036	3225093	InChI=1S/C23H20N2OS/c26-23(24-13-6-10-18-9-4-5-11-19(18)24)21-15-22-20(12-14-27-22)25(21)16-17-7-2-1-3-8-17/h1-5,7-9,11-12,14-15H,6,10,13,16H2	PLCNVGWZQKAXCX-UHFFFAOYSA-N	O=C(N1CCCc2ccccc12)c3cc4sccc4n3Cc5ccccc5	BroadT	BRD-K81952048	BRD-K81952048-001-05-2	Asinex Ltd.	ASN 06914659			O=C(N1CCCc2ccccc12)c1cc2sccc2n1Cc1ccccc1	InChI=1S/C23H20N2OS/c26-23(24-13-6-10-18-9-4-5-11-19(18)24)21-15-22-20(12-14-27-22)25(21)16-17-7-2-1-3-8-17/h1-5,7-9,11-12,14-15H,6,10,13,16H2	PLCNVGWZQKAXCX-UHFFFAOYSA-N	372.12963397							121804
1-(10-Methyl-10H-phenothiazin-2-yl)ethanone	LSM-33248	BRD-K06729289, SID14718808, SID90251417, SID92093119	91401	InChI=1S/C15H13NOS/c1-10(17)11-7-8-15-13(9-11)16(2)12-5-3-4-6-14(12)18-15/h3-9H,1-2H3	DGQXIDAJSBKRMJ-UHFFFAOYSA-N	CN1c2ccccc2Sc3ccc(cc13)C(=O)C	BroadT	BRD-K06729289	BRD-K06729289-001-06-2	Specs	AJ-642/37090001			CN1c2ccccc2Sc2ccc(cc12)C(C)=O	InChI=1S/C15H13NOS/c1-10(17)11-7-8-15-13(9-11)16(2)12-5-3-4-6-14(12)18-15/h3-9H,1-2H3	DGQXIDAJSBKRMJ-UHFFFAOYSA-N	255.071784736							121805
8-Benzyl-caffeine	LSM-33249	BRD-K66299486, SID26664335	21551	InChI=1S/C15H16N4O2/c1-17-11(9-10-7-5-4-6-8-10)16-13-12(17)14(20)19(3)15(21)18(13)2/h4-8H,9H2,1-3H3	YWCYMEPBJYACMO-UHFFFAOYSA-N	CN1C(=O)N(C)c2nc(Cc3ccccc3)n(C)c2C1=O	BroadT	BRD-K66299486	BRD-K66299486-001-05-6	National Cancer Institute Chemotherapeutic Agents Repository	1H-Purine-2,6-dione, 3,7-dihydro-1,3, 7-trimethyl-8- (phenylmethyl)- 14396			Cn1c(Cc2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C15H16N4O2/c1-17-11(9-10-7-5-4-6-8-10)16-13-12(17)14(20)19(3)15(21)18(13)2/h4-8H,9H2,1-3H3	YWCYMEPBJYACMO-UHFFFAOYSA-N	284.127325792							121806
Tetracaine	LSM-4633	Tetracaine, Pontocaine, Metraspray, Dicaine, Amethocaine, Medihaler-Tetracaine	5411	InChI=1S/C15H24N2O2/c1-4-5-10-16-14-8-6-13(7-9-14)15(18)19-12-11-17(2)3/h6-9,16H,4-5,10-12H2,1-3H3	GKCBAIGFKIBETG-UHFFFAOYSA-N	CCCCNc1ccc(cc1)C(=O)OCCN(C)C	BroadT	BRD-K45071273	BRD-K45071273-003-17-3	Sigma-Aldrich	T7508		Cl	CCCCNc1ccc(cc1)C(=O)OCCN(C)C.Cl	InChI=1S/C15H24N2O2.ClH/c1-4-5-10-16-14-8-6-13(7-9-14)15(18)19-12-11-17(2)3;/h6-9,16H,4-5,10-12H2,1-3H3;1H	PPWHTZKZQNXVAE-UHFFFAOYSA-N	264.183778028							9468, 9468
2-[2-Nitro-4-(trifluoromethyl)phenoxy]-n-phenylbenzamide	LSM-33250	BRD-K04219533, SID17506422	1251696	InChI=1S/C20H13F3N2O4/c21-20(22,23)13-10-11-18(16(12-13)25(27)28)29-17-9-5-4-8-15(17)19(26)24-14-6-2-1-3-7-14/h1-12H,(H,24,26)	UVRSRDSBVCZOIT-UHFFFAOYSA-N	[O-][N+](=O)c1cc(ccc1Oc2ccccc2C(=O)Nc3ccccc3)C(F)(F)F	BroadT	BRD-K04219533	BRD-K04219533-001-05-2	ChemBridge Corporation	6557445			[O-][N+](=O)c1cc(ccc1Oc1ccccc1C(=O)Nc1ccccc1)C(F)(F)F	InChI=1S/C20H13F3N2O4/c21-20(22,23)13-10-11-18(16(12-13)25(27)28)29-17-9-5-4-8-15(17)19(26)24-14-6-2-1-3-7-14/h1-12H,(H,24,26)	UVRSRDSBVCZOIT-UHFFFAOYSA-N	402.082741516							121807
AC1MG5WG	LSM-33251	BRD-A17043706, SID47198965	2981039	InChI=1S/C24H30N2O2/c1-17(19-9-5-3-6-10-19)25-23(27)21-13-15-22(16-14-21)24(28)26-18(2)20-11-7-4-8-12-20/h3-12,17-18,21-22H,13-16H2,1-2H3,(H,25,27)(H,26,28)	HMNTUKOICIYDGZ-UHFFFAOYSA-N	CC(NC(=O)C1CCC(CC1)C(=O)NC(C)c2ccccc2)c3ccccc3	BroadT	BRD-A17043706	BRD-A17043706-001-07-0	ChemBridge Corporation	7980111			CC(NC(=O)C1CCC(CC1)C(=O)NC(C)c1ccccc1)c1ccccc1	InChI=1S/C24H30N2O2/c1-17(19-9-5-3-6-10-19)25-23(27)21-13-15-22(16-14-21)24(28)26-18(2)20-11-7-4-8-12-20/h3-12,17-18,21-22H,13-16H2,1-2H3,(H,25,27)(H,26,28)	HMNTUKOICIYDGZ-UHFFFAOYSA-N	378.23072822							121808
MLS000067937	LSM-33252	BRD-K64717502, SID14723815	1089009	InChI=1S/C20H21N3O2S/c24-19(22-10-12-25-13-11-22)14-23-18-9-5-4-8-17(18)21-20(23)26-15-16-6-2-1-3-7-16/h1-9H,10-15H2	PYKBZPLFWBHOHH-UHFFFAOYSA-N	O=C(Cn1c(SCc2ccccc2)nc3ccccc13)N4CCOCC4	BroadT	BRD-K64717502	BRD-K64717502-001-05-9	Asinex Ltd.	BAS 07324714			O=C(Cn1c(SCc2ccccc2)nc2ccccc12)N1CCOCC1	InChI=1S/C20H21N3O2S/c24-19(22-10-12-25-13-11-22)14-23-18-9-5-4-8-17(18)21-20(23)26-15-16-6-2-1-3-7-16/h1-9H,10-15H2	PYKBZPLFWBHOHH-UHFFFAOYSA-N	367.135447632							121809
Ethyl 4-{[2-(dimethylamino)ethyl]amino}benzo[h]quinoline-3-carboxylate	LSM-33253	SID49641525, BRD-K98253383	709126	InChI=1S/C20H23N3O2/c1-4-25-20(24)17-13-22-18-15-8-6-5-7-14(15)9-10-16(18)19(17)21-11-12-23(2)3/h5-10,13H,4,11-12H2,1-3H3,(H,21,22)	SBHIFTIUVDWWMO-UHFFFAOYSA-N	CCOC(=O)c1cnc2c(ccc3ccccc23)c1NCCN(C)C	BroadT	BRD-K98253383	BRD-K98253383-001-05-9	Asinex Ltd.	BAS 02778058			CCOC(=O)c1cnc2c(ccc3ccccc23)c1NCCN(C)C	InChI=1S/C20H23N3O2/c1-4-25-20(24)17-13-22-18-15-8-6-5-7-14(15)9-10-16(18)19(17)21-11-12-23(2)3/h5-10,13H,4,11-12H2,1-3H3,(H,21,22)	SBHIFTIUVDWWMO-UHFFFAOYSA-N	337.179027006							121810
AC1NNP6K	LSM-33254	BRD-K43680691	5049283	InChI=1S/C20H25N3OS/c1-14(2)17-7-9-18(10-8-17)21-20(25)23-22-15(3)13-16-5-11-19(24-4)12-6-16/h5-12,14H,13H2,1-4H3,(H2,21,23,25)	RNQAPTVYVQVTDO-UHFFFAOYSA-N	COc1ccc(CC(=NN=C(S)Nc2ccc(cc2)C(C)C)C)cc1	BroadT	BRD-K43680691	BRD-K43680691-001-05-6	Enamine Ltd.	T0510-6406			COc1ccc(CC(C)=NN=C(S)Nc2ccc(cc2)C(C)C)cc1	InChI=1S/C20H25N3OS/c1-14(2)17-7-9-18(10-8-17)21-20(25)23-22-15(3)13-16-5-11-19(24-4)12-6-16/h5-12,14H,13H2,1-4H3,(H2,21,23,25)	RNQAPTVYVQVTDO-UHFFFAOYSA-N	355.17183314							121811
CHEMDIV2_008404	LSM-33255	BRD-K38984040, SID24788636	4596010	InChI=1S/C16H14N2O3S/c1-9-4-6-11(7-5-9)21-16(20)13-10(2)12-14(22-13)17-8-18(3)15(12)19/h4-8H,1-3H3	DKNSZCBIBYGCHE-UHFFFAOYSA-N	CN1C=Nc2sc(C(=O)Oc3ccc(C)cc3)c(C)c2C1=O	BroadT	BRD-K38984040	BRD-K38984040-001-05-7	ChemDiv Inc.	K833-0013			Cc1c(sc2ncn(C)c(=O)c12)C(=O)Oc1ccc(C)cc1	InChI=1S/C16H14N2O3S/c1-9-4-6-11(7-5-9)21-16(20)13-10(2)12-14(22-13)17-8-18(3)15(12)19/h4-8H,1-3H3	DKNSZCBIBYGCHE-UHFFFAOYSA-N	314.072513018							121812
F0612-0201	LSM-33256	BRD-A39407481, SID7969702	4096501	InChI=1S/C19H22ClN3O4S2/c1-11-8-14-17(29-11)18(25)23(6-7-26-2)19(22-14)28-10-16(24)21-13-9-12(20)4-5-15(13)27-3/h4-5,9,11H,6-8,10H2,1-3H3,(H,21,24)	JZHUCHWPOHCVFK-UHFFFAOYSA-N	COCCN1C(=O)C2=C(CC(C)S2)N=C1SCC(=O)Nc3cc(Cl)ccc3OC	BroadT	BRD-A39407481	BRD-A39407481-001-04-9	Life Chemicals Inc.	F0612-0201			COCCn1c(SCC(=O)Nc2cc(Cl)ccc2OC)nc2CC(C)Sc2c1=O	InChI=1S/C19H22ClN3O4S2/c1-11-8-14-17(29-11)18(25)23(6-7-26-2)19(22-14)28-10-16(24)21-13-9-12(20)4-5-15(13)27-3/h4-5,9,11H,6-8,10H2,1-3H3,(H,21,24)	JZHUCHWPOHCVFK-UHFFFAOYSA-N	455.074025304							121813
F1736-0514	LSM-44463	BRD-K24220535, SID17515417	2146435	InChI=1S/C11H11N3O2S/c1-2-10-13-14-11(17-10)12-9(15)6-5-8-4-3-7-16-8/h3-7H,2H2,1H3,(H,12,14,15)/b6-5+	LSBYIDOKZSKXHL-AATRIKPKSA-N	CCc1nnc(NC(=O)\C=C\c2occc2)s1	BroadT	BRD-K24220535	BRD-K24220535-001-06-2	Life Chemicals Inc.	F1736-0514			CCc1nnc(NC(=O)\C=C\c2ccco2)s1	InChI=1S/C11H11N3O2S/c1-2-10-13-14-11(17-10)12-9(15)6-5-8-4-3-7-16-8/h3-7H,2H2,1H3,(H,12,14,15)/b6-5+	LSBYIDOKZSKXHL-AATRIKPKSA-N	249.057197312							
BAS 05884082	LSM-33258	BRD-A46631350, SID49726272	3152733	InChI=1S/C25H25N5O3/c1-16-7-9-17(10-8-16)15-30-22(26)19(24(31)27-14-18-5-4-12-33-18)13-20-23(30)28-21-6-2-3-11-29(21)25(20)32/h2-3,6-11,13,18,26H,4-5,12,14-15H2,1H3,(H,27,31)	BRLHDBQJAXKNDL-UHFFFAOYSA-N	Cc1ccc(CN2C(=N)C(=CC3=C2N=C4C=CC=CN4C3=O)C(=O)NCC5CCCO5)cc1	BroadT	BRD-A46631350	BRD-A46631350-001-06-8	Asinex Ltd.	BAS 05884082			Cc1ccc(Cn2c3nc4ccccn4c(=O)c3cc(C(=O)NCC3CCCO3)c2=N)cc1	InChI=1S/C25H25N5O3/c1-16-7-9-17(10-8-16)15-30-22(26)19(24(31)27-14-18-5-4-12-33-18)13-20-23(30)28-21-6-2-3-11-29(21)25(20)32/h2-3,6-11,13,18,26H,4-5,12,14-15H2,1H3,(H,27,31)	BRLHDBQJAXKNDL-UHFFFAOYSA-N	443.19573971							121815
MLS000105459	LSM-33259	BRD-K70685307, SID7975372	754251	InChI=1S/C16H19N3O/c1-10(2)16(20)18-14-11-6-4-5-7-13(11)17-15-12(14)8-9-19(15)3/h4-7,10H,8-9H2,1-3H3,(H,17,18,20)	KMMOBCXLHOOSGS-UHFFFAOYSA-N	CC(C)C(=O)Nc1c2CCN(C)c2nc3ccccc13	BroadT	BRD-K70685307	BRD-K70685307-001-07-3	ChemBridge Corporation	5275672			CC(C)C(=O)Nc1c2CCN(C)c2nc2ccccc12	InChI=1S/C16H19N3O/c1-10(2)16(20)18-14-11-6-4-5-7-13(11)17-15-12(14)8-9-19(15)3/h4-7,10H,8-9H2,1-3H3,(H,17,18,20)	KMMOBCXLHOOSGS-UHFFFAOYSA-N	269.152812258							121816
ZINC04131152	LSM-33260	BRD-K65259629, SID24786283	3168768	InChI=1S/C14H14N6S/c1-20-13(18-19-14(20)21-9-8-15)7-6-12-16-10-4-2-3-5-11(10)17-12/h2-5H,6-7,9H2,1H3,(H,16,17)	FEHWORQCIIAXDF-UHFFFAOYSA-N	Cn1c(CCc2nc3ccccc3[nH]2)nnc1SCC#N	BroadT	BRD-K65259629	BRD-K65259629-001-05-9	Asinex Ltd.	ASN 03018153			Cn1c(CCc2nc3ccccc3[nH]2)nnc1SCC#N	InChI=1S/C14H14N6S/c1-20-13(18-19-14(20)21-9-8-15)7-6-12-16-10-4-2-3-5-11(10)17-12/h2-5H,6-7,9H2,1H3,(H,16,17)	FEHWORQCIIAXDF-UHFFFAOYSA-N	298.100065198							121817
SMR000264543	LSM-33261	BRD-A89499670, SID22410042	3618972	InChI=1S/C18H22ClN3O3S4/c1-12(2)9-21(15-7-8-29(24,25)11-15)16(23)10-27-17-20-22(18(26)28-17)14-5-3-13(19)4-6-14/h3-6,12,15H,7-11H2,1-2H3	HXEFBYAPNRBENZ-UHFFFAOYSA-N	CC(C)CN(C1CCS(=O)(=O)C1)C(=O)CSC2=NN(C(=S)S2)c3ccc(Cl)cc3	BroadT	BRD-A89499670	BRD-A89499670-001-05-3	Enamine Ltd.	T5339844			CC(C)CN(C1CCS(=O)(=O)C1)C(=O)CSc1nn(-c2ccc(Cl)cc2)c(=S)s1	InChI=1S/C18H22ClN3O3S4/c1-12(2)9-21(15-7-8-29(24,25)11-15)16(23)10-27-17-20-22(18(26)28-17)14-5-3-13(19)4-6-14/h3-6,12,15H,7-11H2,1-2H3	HXEFBYAPNRBENZ-UHFFFAOYSA-N	491.023252064							121818
MLS000062316	LSM-33262	SID4254507, BRD-K74870161	2221144	InChI=1S/C9H8N2O3S/c12-7-6(4-5-2-1-3-15-5)8(13)11-9(14)10-7/h1-3,6H,4H2,(H2,10,11,12,13,14)	HXPAYMYIOOYMRG-UHFFFAOYSA-N	O=C1NC(=O)C(Cc2cccs2)C(=O)N1	BroadT	BRD-K74870161	BRD-K74870161-001-05-6	ChemBridge Corporation	6625264			O=C1NC(=O)C(Cc2cccs2)C(=O)N1	InChI=1S/C9H8N2O3S/c12-7-6(4-5-2-1-3-15-5)8(13)11-9(14)10-7/h1-3,6H,4H2,(H2,10,11,12,13,14)	HXPAYMYIOOYMRG-UHFFFAOYSA-N	224.025562826							121819
SMR000001939	LSM-33263	BRD-K14203360, SID847409	649804	InChI=1S/C17H20FN3OS/c1-20-15(13-5-7-14(18)8-6-13)11-19-17(20)23-12-16(22)21-9-3-2-4-10-21/h5-8,11H,2-4,9-10,12H2,1H3	YKUHIMLLSZRAJY-UHFFFAOYSA-N	Cn1c(SCC(=O)N2CCCCC2)ncc1c3ccc(F)cc3	BroadT	BRD-K14203360	BRD-K14203360-001-05-2	Asinex Ltd.	ASN 03017352			Cn1c(SCC(=O)N2CCCCC2)ncc1-c1ccc(F)cc1	InChI=1S/C17H20FN3OS/c1-20-15(13-5-7-14(18)8-6-13)11-19-17(20)23-12-16(22)21-9-3-2-4-10-21/h5-8,11H,2-4,9-10,12H2,1H3	YKUHIMLLSZRAJY-UHFFFAOYSA-N	333.13111118							121820
(Z) Fluvoxamine	LSM-3625	Fluvoxamine, BRD-K72676686	3404	InChI=1S/C15H21F3N2O2/c1-21-10-3-2-4-14(20-22-11-9-19)12-5-7-13(8-6-12)15(16,17)18/h5-8H,2-4,9-11,19H2,1H3	CJOFXWAVKWHTFT-UHFFFAOYSA-N	COCCCCC(=NOCCN)c1ccc(cc1)C(F)(F)F	BroadT	BRD-K72676686	BRD-K72676686-050-24-3	Sigma-Aldrich	F2802		OC(=O)/C=C\C(=O)O	COCCCCC(=NOCCN)c1ccc(cc1)C(F)(F)F.OC(=O)/C=C\C(=O)O	InChI=1S/C15H21F3N2O2.C4H4O4/c1-21-10-3-2-4-14(20-22-11-9-19)12-5-7-13(8-6-12)15(16,17)18;5-3(6)1-2-4(7)8/h5-8H,2-4,9-11,19H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-	LFMYNZPAVPMEGP-BTJKTKAUSA-N	318.155512532							93274
MLS000522932	LSM-33264	BRD-A39193201, SID17402088	11957292	InChI=1S/C19H19N5O4S3/c1-10(2)16(24-31(26,27)15-6-4-5-13-17(15)23-30-22-13)18(25)21-19-20-12-8-7-11(28-3)9-14(12)29-19/h4-10,16,24H,1-3H3,(H,20,21,25)	LDIVLKNMIXBIOU-UHFFFAOYSA-N	COc1ccc2nc(NC(=O)C(NS(=O)(=O)c3cccc4nsnc34)C(C)C)sc2c1	BroadT	BRD-A39193201	BRD-A39193201-001-03-6	ChemDiv Inc.	C548-2768			COc1ccc2nc(NC(=O)C(NS(=O)(=O)c3cccc4nsnc34)C(C)C)sc2c1	InChI=1S/C19H19N5O4S3/c1-10(2)16(24-31(26,27)15-6-4-5-13-17(15)23-30-22-13)18(25)21-19-20-12-8-7-11(28-3)9-14(12)29-19/h4-10,16,24H,1-3H3,(H,20,21,25)	LDIVLKNMIXBIOU-UHFFFAOYSA-N	477.059916208							121821
ST032160	LSM-33265	BRD-A26640795, SID22413258	5289825	InChI=1S/C23H33NO3/c1-13(25)23-20(24(23)14(2)26)12-19-17-6-5-15-11-16(27)7-9-21(15,3)18(17)8-10-22(19,23)4/h5,16-20,27H,6-12H2,1-4H3/t16-,17?,18?,19?,20+,21-,22-,23+,24?/m0/s1	ZEXKBKAYWZMNJG-SUZOORIFSA-N	CC(=O)N1[C@@H]2CC3C4CC=C5C[C@@H](O)CC[C@]5(C)C4CC[C@]3(C)[C@]12C(=O)C	BroadT	BRD-A26640795	BRD-A26640795-001-05-8	Specs	AG-205/12079116			CC(=O)N1[C@@H]2CC3C4CC=C5C[C@@H](O)CC[C@]5(C)C4CC[C@]3(C)[C@]12C(C)=O	InChI=1S/C23H33NO3/c1-13(25)23-20(24(23)14(2)26)12-19-17-6-5-15-11-16(27)7-9-21(15,3)18(17)8-10-22(19,23)4/h5,16-20,27H,6-12H2,1-4H3/t16-,17?,18?,19?,20+,21-,22-,23+,24?/m0/s1	ZEXKBKAYWZMNJG-SUZOORIFSA-N	371.246043926							121822
ZINC01062097	LSM-33266	BRD-K36196444, SID4258542	1252004	InChI=1S/C12H10N4S/c1-2-5-9-8(4-1)10-11(13-9)16-6-3-7-17-12(16)15-14-10/h1-2,4-5H,3,6-7H2	UIOCWCKDHWUHQQ-UHFFFAOYSA-N	C1CSc2nnc3c4ccccc4nc3n2C1	BroadT	BRD-K36196444	BRD-K36196444-001-05-2	ChemBridge Corporation	7960995			C1CSc2nnc3c(nc4ccccc34)n2C1	InChI=1S/C12H10N4S/c1-2-5-9-8(4-1)10-11(13-9)16-6-3-7-17-12(16)15-14-10/h1-2,4-5H,3,6-7H2	UIOCWCKDHWUHQQ-UHFFFAOYSA-N	242.06261705							121823
STK274719	LSM-33267	BRD-A25883214, SID17387831	4254555	InChI=1S/C19H20Br2N2O3/c1-8-3-5-10(6-4-8)22-17(24)9(2)23-18(25)13-11-7-12(14(13)19(23)26)16(21)15(11)20/h3-6,9,11-16H,7H2,1-2H3,(H,22,24)	KIYFNBKONQMDDJ-UHFFFAOYSA-N	CC(N1C(=O)C2C3CC(C(Br)C3Br)C2C1=O)C(=O)Nc4ccc(C)cc4	BroadT	BRD-A25883214	BRD-A25883214-001-05-8	Specs	AK-918/40864093			CC(N1C(=O)C2C3CC(C(Br)C3Br)C2C1=O)C(=O)Nc1ccc(C)cc1	InChI=1S/C19H20Br2N2O3/c1-8-3-5-10(6-4-8)22-17(24)9(2)23-18(25)13-11-7-12(14(13)19(23)26)16(21)15(11)20/h3-6,9,11-16H,7H2,1-2H3,(H,22,24)	KIYFNBKONQMDDJ-UHFFFAOYSA-N	481.98406772							121824
3-Phenyl-n-pyridin-3-yl-acrylamide	LSM-44464	BRD-K53665750, SID49642439	825474	InChI=1S/C14H12N2O/c17-14(16-13-7-4-10-15-11-13)9-8-12-5-2-1-3-6-12/h1-11H,(H,16,17)/b9-8+	LIKDGODLSLTXFU-CMDGGOBGSA-N	O=C(Nc1cccnc1)\C=C\c2ccccc2	BroadT	BRD-K53665750	BRD-K53665750-001-06-0	Asinex Ltd.	BAS 00321438			O=C(Nc1cccnc1)\C=C\c1ccccc1	InChI=1S/C14H12N2O/c17-14(16-13-7-4-10-15-11-13)9-8-12-5-2-1-3-6-12/h1-11H,(H,16,17)/b9-8+	LIKDGODLSLTXFU-CMDGGOBGSA-N	224.094963024							
MLS001034883	LSM-33269	BRD-K13515483, SID49717976	1309471	InChI=1S/C25H27N7O3/c1-17-4-3-8-31-22(17)29-23-20(25(31)34)14-19(21(26)32(23)16-18-5-2-6-27-15-18)24(33)28-7-9-30-10-12-35-13-11-30/h2-6,8,14-15,26H,7,9-13,16H2,1H3,(H,28,33)	SUJXYFPBVPQZKX-UHFFFAOYSA-N	CC1=CC=CN2C(=O)C3=C(N=C12)N(Cc4cccnc4)C(=N)C(=C3)C(=O)NCCN5CCOCC5	BroadT	BRD-K13515483	BRD-K13515483-001-07-8	ChemBridge Corporation	7164332			Cc1cccn2c1nc1n(Cc3cccnc3)c(=N)c(cc1c2=O)C(=O)NCCN1CCOCC1	InChI=1S/C25H27N7O3/c1-17-4-3-8-31-22(17)29-23-20(25(31)34)14-19(21(26)32(23)16-18-5-2-6-27-15-18)24(33)28-7-9-30-10-12-35-13-11-30/h2-6,8,14-15,26H,7,9-13,16H2,1H3,(H,28,33)	SUJXYFPBVPQZKX-UHFFFAOYSA-N	473.217537794							121826
MLS000590260	LSM-33270	BRD-K06335310, SID17504394	911973	InChI=1S/C19H18O4S/c1-3-22-19(21)18-15-10-13(20)6-9-16(15)23-17(18)11-24-14-7-4-12(2)5-8-14/h4-10,20H,3,11H2,1-2H3	QOKRJIBOZKKPGI-UHFFFAOYSA-N	CCOC(=O)c1c(CSc2ccc(C)cc2)oc3ccc(O)cc13	BroadT	BRD-K06335310	BRD-K06335310-001-06-1	InterBioScreen Ltd.	STOCK1S-25037			CCOC(=O)c1c(CSc2ccc(C)cc2)oc2ccc(O)cc12	InChI=1S/C19H18O4S/c1-3-22-19(21)18-15-10-13(20)6-9-16(15)23-17(18)11-24-14-7-4-12(2)5-8-14/h4-10,20H,3,11H2,1-2H3	QOKRJIBOZKKPGI-UHFFFAOYSA-N	342.092579746							121827
MLS000707018	LSM-33271	SID24819696, BRD-K85716998	1489435	InChI=1S/C24H23N5O2/c1-2-31-24(30)20-16-19(17-25)23(27-22(20)18-8-4-3-5-9-18)29-14-12-28(13-15-29)21-10-6-7-11-26-21/h3-11,16H,2,12-15H2,1H3	JZKXGDVUHZCZAG-UHFFFAOYSA-N	CCOC(=O)c1cc(C#N)c(nc1c2ccccc2)N3CCN(CC3)c4ccccn4	BroadT	BRD-K85716998	BRD-K85716998-001-05-7	Key Organics Ltd.	1L-340S			CCOC(=O)c1cc(C#N)c(nc1-c1ccccc1)N1CCN(CC1)c1ccccn1	InChI=1S/C24H23N5O2/c1-2-31-24(30)20-16-19(17-25)23(27-22(20)18-8-4-3-5-9-18)29-14-12-28(13-15-29)21-10-6-7-11-26-21/h3-11,16H,2,12-15H2,1H3	JZKXGDVUHZCZAG-UHFFFAOYSA-N	413.185175026							121828
SMR000127711	LSM-33272	BRD-K52361779, SID14735529	9550755	InChI=1S/C20H21ClFN3O2/c21-17-7-5-15(6-8-17)9-10-23-19(26)14-25-12-11-24(20(25)27)13-16-3-1-2-4-18(16)22/h1-8H,9-14H2,(H,23,26)	JBQWAJVJFOCKLV-UHFFFAOYSA-N	Fc1ccccc1CN2CCN(CC(=O)NCCc3ccc(Cl)cc3)C2=O	BroadT	BRD-K52361779	BRD-K52361779-001-04-9	ChemDiv Inc.	C305-0841			Fc1ccccc1CN1CCN(CC(=O)NCCc2ccc(Cl)cc2)C1=O	InChI=1S/C20H21ClFN3O2/c21-17-7-5-15(6-8-17)9-10-23-19(26)14-25-12-11-24(20(25)27)13-16-3-1-2-4-18(16)22/h1-8H,9-14H2,(H,23,26)	JBQWAJVJFOCKLV-UHFFFAOYSA-N	389.130632852							121829
AC1OMWMO	LSM-15473	BRD-K79148949	7481616	InChI=1S/C15H17N5O3/c1-9-11(13(21)19-15(23)18-9)8-17-20-14(22)12(16)7-10-5-3-2-4-6-10/h2-6,8,12H,7,16H2,1H3,(H,20,22)(H2,18,19,21,23)/t12-/m0/s1	IEXUGUYYLXFHNR-LBPRGKRZSA-N	Cc1nc(O)nc(O)c1C=NNC(=O)[C@@H](N)Cc2ccccc2	BroadT	BRD-K79148949	BRD-K79148949-003-05-7	InterBioScreen Ltd.	STOCK4S-17663		Cl	Cc1nc(O)nc(O)c1C=NNC(=O)[C@@H](N)Cc1ccccc1.Cl	InChI=1S/C15H17N5O3.ClH/c1-9-11(13(21)19-15(23)18-9)8-17-20-14(22)12(16)7-10-5-3-2-4-6-10;/h2-6,8,12H,7,16H2,1H3,(H,20,22)(H2,18,19,21,23);1H/t12-;/m0./s1	NJZSRIIVKSEXLU-YDALLXLXSA-N	315.133139454							
MLS000082945	LSM-33273	BRD-A57982699, SID864255	665502	InChI=1S/C17H19ClN4O/c1-2-21-8-4-5-11(21)9-22-10-19-15-14-12(18)6-3-7-13(14)20-16(15)17(22)23/h3,6-7,10-11,23H,2,4-5,8-9H2,1H3	AHNGFMANMVPMLG-UHFFFAOYSA-N	CCN1CCCC1Cn2cnc3c(nc4cccc(Cl)c34)c2O	BroadT	BRD-A57982699	BRD-A57982699-001-05-3	InterBioScreen Ltd.	STOCK5S-09269			CCN1CCCC1Cn1cnc2c(nc3cccc(Cl)c23)c1O	InChI=1S/C17H19ClN4O/c1-2-21-8-4-5-11(21)9-22-10-19-15-14-12(18)6-3-7-13(14)20-16(15)17(22)23/h3,6-7,10-11,23H,2,4-5,8-9H2,1H3	AHNGFMANMVPMLG-UHFFFAOYSA-N	330.124738978							
AC1MDY4S	LSM-33274	BRD-A66164310, SID24805373	2844905	InChI=1S/C15H13Br2NO/c1-14(9-15(14,16)17)13(19)18-12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,9H2,1H3,(H,18,19)	HPWXIQNJBDNUCU-UHFFFAOYSA-N	CC1(CC1(Br)Br)C(=O)Nc2ccc3ccccc3c2	BroadT	BRD-A66164310	BRD-A66164310-001-05-6	Asinex Ltd.	BAS 00497837			CC1(CC1(Br)Br)C(=O)Nc1ccc2ccccc2c1	InChI=1S/C15H13Br2NO/c1-14(9-15(14,16)17)13(19)18-12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,9H2,1H3,(H,18,19)	HPWXIQNJBDNUCU-UHFFFAOYSA-N	380.936389246							121831
AC1NK5XW	LSM-33275	BRD-K63984483, SID24835513	4882879	InChI=1S/C25H25N5/c1-2-7-19(8-3-1)18-30-15-12-21(13-16-30)27-25-22-10-4-5-11-23(22)28-24(29-25)20-9-6-14-26-17-20/h1-11,14,17,21H,12-13,15-16,18H2,(H,27,28,29)	FPSNRFFFQDOELT-UHFFFAOYSA-N	C(N1CCC(CC1)Nc2nc(nc3ccccc23)c4cccnc4)c5ccccc5	BroadT	BRD-K63984483	BRD-K63984483-001-07-5	Enamine Ltd.	T5327820			C(N1CCC(CC1)Nc1nc(nc2ccccc12)-c1cccnc1)c1ccccc1	InChI=1S/C25H25N5/c1-2-7-19(8-3-1)18-30-15-12-21(13-16-30)27-25-22-10-4-5-11-23(22)28-24(29-25)20-9-6-14-26-17-20/h1-11,14,17,21H,12-13,15-16,18H2,(H,27,28,29)	FPSNRFFFQDOELT-UHFFFAOYSA-N	395.21099585							121832
1-Indan-2-yl-4-(naphthalene-2-sulfonyl)-piperazine	LSM-15592	BRD-K72666100	1151760	InChI=1S/C23H24N2O2S/c26-28(27,23-10-9-18-5-1-2-8-21(18)17-23)25-13-11-24(12-14-25)22-15-19-6-3-4-7-20(19)16-22/h1-10,17,22H,11-16H2	QPDXRWKGXCXUSS-UHFFFAOYSA-N	O=S(=O)(N1CCN(CC1)C2Cc3ccccc3C2)c4ccc5ccccc5c4	BroadT	BRD-K72666100	BRD-K72666100-034-05-5	Asinex Ltd.	BAS 03153122		OC(=O)C(=O)O	O=S(=O)(N1CCN(CC1)C1Cc2ccccc2C1)c1ccc2ccccc2c1.OC(=O)C(=O)O	InChI=1S/C23H24N2O2S.C2H2O4/c26-28(27,23-10-9-18-5-1-2-8-21(18)17-23)25-13-11-24(12-14-25)22-15-19-6-3-4-7-20(19)16-22;3-1(4)2(5)6/h1-10,17,22H,11-16H2;(H,3,4)(H,5,6)	QJGUPGVZOXRJHO-UHFFFAOYSA-N	392.155848718							104228, 104228
MLS000522545	LSM-33276	SID14731343, BRD-K03608799	6622365	InChI=1S/C22H21N3O3/c1-4-28-15-11-9-14(10-12-15)23-21(26)19-13-17-20(24(19)2)16-7-5-6-8-18(16)25(3)22(17)27/h5-13H,4H2,1-3H3,(H,23,26)	ANDGYYJMMCTBPP-UHFFFAOYSA-N	CCOc1ccc(NC(=O)c2cc3C(=O)N(C)c4ccccc4c3n2C)cc1	BroadT	BRD-K03608799	BRD-K03608799-001-05-6	ChemDiv Inc.	C593-0421			CCOc1ccc(NC(=O)c2cc3c(n2C)c2ccccc2n(C)c3=O)cc1	InChI=1S/C22H21N3O3/c1-4-28-15-11-9-14(10-12-15)23-21(26)19-13-17-20(24(19)2)16-7-5-6-8-18(16)25(3)22(17)27/h5-13H,4H2,1-3H3,(H,23,26)	ANDGYYJMMCTBPP-UHFFFAOYSA-N	375.158291562							121833
BRN 4559411	LSM-33277	BRD-K25284184, SID7971780	4123591	InChI=1S/C14H10F3N3O2S/c15-14(16,17)8-2-1-3-9(6-8)19-11(21)10-7-18-13-20(12(10)22)4-5-23-13/h1-3,6-7H,4-5H2,(H,19,21)	CPMZWDDDPRCVHU-UHFFFAOYSA-N	FC(F)(F)c1cccc(NC(=O)C2=CN=C3SCCN3C2=O)c1	BroadT	BRD-K25284184	BRD-K25284184-001-04-6	Life Chemicals Inc.	F0550-0080			FC(F)(F)c1cccc(NC(=O)c2cnc3SCCn3c2=O)c1	InChI=1S/C14H10F3N3O2S/c15-14(16,17)8-2-1-3-9(6-8)19-11(21)10-7-18-13-20(12(10)22)4-5-23-13/h1-3,6-7H,4-5H2,(H,19,21)	CPMZWDDDPRCVHU-UHFFFAOYSA-N	341.04458188							121834
N-[(2-Benzoyl-4-bromo-phenylcarbamoyl)-methyl]-2-chloro-benzamide	LSM-33278	SID17508998, BRD-K35480932	1357514	InChI=1S/C22H16BrClN2O3/c23-15-10-11-19(17(12-15)21(28)14-6-2-1-3-7-14)26-20(27)13-25-22(29)16-8-4-5-9-18(16)24/h1-12H,13H2,(H,25,29)(H,26,27)	UWGLGCIJYJIUTE-UHFFFAOYSA-N	Clc1ccccc1C(=O)NCC(=O)Nc2ccc(Br)cc2C(=O)c3ccccc3	BroadT	BRD-K35480932	BRD-K35480932-001-05-0	Asinex Ltd.	BAS 00462544			Clc1ccccc1C(=O)NCC(=O)Nc1ccc(Br)cc1C(=O)c1ccccc1	InChI=1S/C22H16BrClN2O3/c23-15-10-11-19(17(12-15)21(28)14-6-2-1-3-7-14)26-20(27)13-25-22(29)16-8-4-5-9-18(16)24/h1-12H,13H2,(H,25,29)(H,26,27)	UWGLGCIJYJIUTE-UHFFFAOYSA-N	470.003282702							121835
SMR000094673	LSM-33279	BRD-K20437312, SID26724468, SID7966600	5308327	InChI=1S/C22H24N2O6S/c1-14-7-5-6-8-17(14)22-24-19(15(2)30-22)12-31(26,27)13-21(25)23-18-11-16(28-3)9-10-20(18)29-4/h5-11H,12-13H2,1-4H3,(H,23,25)	PASLVDANCAJCEE-UHFFFAOYSA-N	COc1ccc(OC)c(NC(=O)CS(=O)(=O)Cc2nc(oc2C)c3ccccc3C)c1	BroadT	BRD-K20437312	BRD-K20437312-001-05-7	ChemDiv Inc.	C528-1084			COc1ccc(OC)c(NC(=O)CS(=O)(=O)Cc2nc(oc2C)-c2ccccc2C)c1	InChI=1S/C22H24N2O6S/c1-14-7-5-6-8-17(14)22-24-19(15(2)30-22)12-31(26,27)13-21(25)23-18-11-16(28-3)9-10-20(18)29-4/h5-11H,12-13H2,1-4H3,(H,23,25)	PASLVDANCAJCEE-UHFFFAOYSA-N	444.135507198							121836
SMR000217585	LSM-33280	BRD-A44438286, SID17512863	4594054	InChI=1S/C26H21N3O5S2/c1-34-25(33)13-4-6-16(7-5-13)27-20(30)12-35-26-28-18-9-8-17(11-19(18)36-26)29-23(31)21-14-2-3-15(10-14)22(21)24(29)32/h2-9,11,14-15,21-22H,10,12H2,1H3,(H,27,30)	XLIZSNQPHLLULU-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=O)CSc2nc3ccc(cc3s2)N4C(=O)C5C6CC(C=C6)C5C4=O)cc1	BroadT	BRD-A44438286	BRD-A44438286-001-05-1	InterBioScreen Ltd.	STOCK2S-93266			COC(=O)c1ccc(NC(=O)CSc2nc3ccc(cc3s2)N2C(=O)C3C4CC(C=C4)C3C2=O)cc1	InChI=1S/C26H21N3O5S2/c1-34-25(33)13-4-6-16(7-5-13)27-20(30)12-35-26-28-18-9-8-17(11-19(18)36-26)29-23(31)21-14-2-3-15(10-14)22(21)24(29)32/h2-9,11,14-15,21-22H,10,12H2,1H3,(H,27,30)	XLIZSNQPHLLULU-UHFFFAOYSA-N	519.092262182							121837
11M-524S	LSM-33281	SID24821891, BRD-K24598235	1474605	InChI=1S/C18H14N2O2S/c1-12-6-5-9-14(10-12)23-17-15(18(21)22)11-19-16(20-17)13-7-3-2-4-8-13/h2-11H,1H3,(H,21,22)	XNZKRLFCDSILPP-UHFFFAOYSA-N	Cc1cccc(Sc2nc(ncc2C(=O)O)c3ccccc3)c1	BroadT	BRD-K24598235	BRD-K24598235-001-06-4	Key Organics Ltd.	11M-524S			Cc1cccc(Sc2nc(ncc2C(O)=O)-c2ccccc2)c1	InChI=1S/C18H14N2O2S/c1-12-6-5-9-14(10-12)23-17-15(18(21)22)11-19-16(20-17)13-7-3-2-4-8-13/h2-11H,1H3,(H,21,22)	XNZKRLFCDSILPP-UHFFFAOYSA-N	322.077598398							121838
SMR000123503	LSM-33282	BRD-A06840811, SID24779184	3201811	InChI=1S/C27H27N7OS/c35-22-12-10-21(11-13-22)25(26-29-30-31-34(26)15-14-20-6-2-1-3-7-20)32-16-18-33(19-17-32)27-28-23-8-4-5-9-24(23)36-27/h1-13,25,35H,14-19H2	VYVKXMZQZSGWEY-UHFFFAOYSA-N	Oc1ccc(cc1)C(N2CCN(CC2)c3nc4ccccc4s3)c5nnnn5CCc6ccccc6	BroadT	BRD-A06840811	BRD-A06840811-001-05-8	Asinex Ltd.	ASN 05346582			Oc1ccc(cc1)C(N1CCN(CC1)c1nc2ccccc2s1)c1nnnn1CCc1ccccc1	InChI=1S/C27H27N7OS/c35-22-12-10-21(11-13-22)25(26-29-30-31-34(26)15-14-20-6-2-1-3-7-20)32-16-18-33(19-17-32)27-28-23-8-4-5-9-24(23)36-27/h1-13,25,35H,14-19H2	VYVKXMZQZSGWEY-UHFFFAOYSA-N	497.199779244							121839
SMR000048457	LSM-33283	BRD-K98431828, SID865954	667210	InChI=1S/C24H25N5O3/c30-23(25-9-11-27-12-14-32-15-13-27)20-16-19-22(29(20)17-18-6-2-1-3-7-18)26-21-8-4-5-10-28(21)24(19)31/h1-8,10,16H,9,11-15,17H2,(H,25,30)	CWFMAHVSOBKHGW-UHFFFAOYSA-N	O=C(NCCN1CCOCC1)c2cc3C(=O)N4C=CC=CC4=Nc3n2Cc5ccccc5	BroadT	BRD-K98431828	BRD-K98431828-001-05-4	InterBioScreen Ltd.	STOCK5S-53827			O=C(NCCN1CCOCC1)c1cc2c(nc3ccccn3c2=O)n1Cc1ccccc1	InChI=1S/C24H25N5O3/c30-23(25-9-11-27-12-14-32-15-13-27)20-16-19-22(29(20)17-18-6-2-1-3-7-18)26-21-8-4-5-10-28(21)24(19)31/h1-8,10,16H,9,11-15,17H2,(H,25,30)	CWFMAHVSOBKHGW-UHFFFAOYSA-N	431.19573971							121840
6-Isopropyl-benzothiazol-2-ylamine	LSM-33284	BRD-K29713418, SID24816734	600983	InChI=1S/C10H12N2S/c1-6(2)7-3-4-8-9(5-7)13-10(11)12-8/h3-6H,1-2H3,(H2,11,12)	JKQDAIVDZXQKCT-UHFFFAOYSA-N	CC(C)c1ccc2nc(N)sc2c1	BroadT	BRD-K29713418	BRD-K29713418-001-05-5	Life Chemicals Inc.	F1911-0012			CC(C)c1ccc2nc(N)sc2c1	InChI=1S/C10H12N2S/c1-6(2)7-3-4-8-9(5-7)13-10(11)12-8/h3-6H,1-2H3,(H2,11,12)	JKQDAIVDZXQKCT-UHFFFAOYSA-N	192.072119094							121841
SMR000026414	LSM-33285	BRD-K97682096, SID4241403	3236382	InChI=1S/C18H20N6O4/c1-2-27-14-8-4-3-7-13(14)21-15(25)11-24-17(19)16(22-23-24)18(26)20-10-12-6-5-9-28-12/h3-9H,2,10-11,19H2,1H3,(H,20,26)(H,21,25)	CXNFECFBSYNUCV-UHFFFAOYSA-N	CCOc1ccccc1NC(=O)Cn2nnc(C(=O)NCc3occc3)c2N	BroadT	BRD-K97682096	BRD-K97682096-001-08-2	ChemDiv Inc.	C368-0159			CCOc1ccccc1NC(=O)Cn1nnc(C(=O)NCc2ccco2)c1N	InChI=1S/C18H20N6O4/c1-2-27-14-8-4-3-7-13(14)21-15(25)11-24-17(19)16(22-23-24)18(26)20-10-12-6-5-9-28-12/h3-9H,2,10-11,19H2,1H3,(H,20,26)(H,21,25)	CXNFECFBSYNUCV-UHFFFAOYSA-N	384.15460318							121842
MLS001096502	LSM-33286	SID49719969, BRD-K07756997	20936238	InChI=1S/C16H14N2O4S2/c1-10-8-14(22-17-10)15-6-7-16(23-15)24(20,21)18-13-5-3-4-12(9-13)11(2)19/h3-9,18H,1-2H3	YMQPEWCAKBIUCC-UHFFFAOYSA-N	CC(=O)c1cccc(NS(=O)(=O)c2ccc(s2)c3onc(C)c3)c1	BroadT	BRD-K07756997	BRD-K07756997-001-06-7	ChemDiv Inc.	G008-4266			CC(=O)c1cccc(NS(=O)(=O)c2ccc(s2)-c2cc(C)no2)c1	InChI=1S/C16H14N2O4S2/c1-10-8-14(22-17-10)15-6-7-16(23-15)24(20,21)18-13-5-3-4-12(9-13)11(2)19/h3-9,18H,1-2H3	YMQPEWCAKBIUCC-UHFFFAOYSA-N	362.039498328							121843
AC1MF2QZ	LSM-33287	BRD-A42612443	2865032	InChI=1S/C22H29N3O3S/c1-3-4-8-11-27-14-19-13-18(21(26)28-19)12-16(2)24-25-22-23-20(15-29-22)17-9-6-5-7-10-17/h5-7,9-10,15,18-19H,3-4,8,11-14H2,1-2H3,(H,23,25)	DVUVPUFNMDMYJB-UHFFFAOYSA-N	CCCCCOCC1CC(CC(=NNc2nc(cs2)c3ccccc3)C)C(=O)O1	BroadT	BRD-A42612443	BRD-A42612443-001-05-3	Asinex Ltd.	BAS 00333781			CCCCCOCC1CC(CC(C)=NNc2nc(cs2)-c2ccccc2)C(=O)O1	InChI=1S/C22H29N3O3S/c1-3-4-8-11-27-14-19-13-18(21(26)28-19)12-16(2)24-25-22-23-20(15-29-22)17-9-6-5-7-10-17/h5-7,9-10,15,18-19H,3-4,8,11-14H2,1-2H3,(H,23,25)	DVUVPUFNMDMYJB-UHFFFAOYSA-N	415.192962508							121844
STK229294	LSM-33288	BRD-K92433833, SID24814140	7338781	InChI=1S/C21H21N5/c1-15-5-9-17(10-6-15)23-20-19(24-21-22-13-4-14-26(20)21)16-7-11-18(12-8-16)25(2)3/h4-14,23H,1-3H3	HQRWDHBXRGKCDN-UHFFFAOYSA-N	CN(C)c1ccc(cc1)c2nc3ncccn3c2Nc4ccc(C)cc4	BroadT	BRD-K92433833	BRD-K92433833-001-05-9	ChemDiv Inc.	C325-0267			CN(C)c1ccc(cc1)-c1nc2ncccn2c1Nc1ccc(C)cc1	InChI=1S/C21H21N5/c1-15-5-9-17(10-6-15)23-20-19(24-21-22-13-4-14-26(20)21)16-7-11-18(12-8-16)25(2)3/h4-14,23H,1-3H3	HQRWDHBXRGKCDN-UHFFFAOYSA-N	343.179695722							121845
SMR000043922	LSM-33289	BRD-K19378563, SID861968	663189	InChI=1S/C11H11NO3S/c1-16-10(14)7-9(13)12-11(15)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,12,13,15)	KXQJKGXGNXBZMB-UHFFFAOYSA-N	CSC(=O)CC(=O)NC(=O)c1ccccc1	BroadT	BRD-K19378563	BRD-K19378563-001-05-2	InterBioScreen Ltd.	STOCK4S-25717			CSC(=O)CC(=O)NC(=O)c1ccccc1	InChI=1S/C11H11NO3S/c1-16-10(14)7-9(13)12-11(15)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,12,13,15)	KXQJKGXGNXBZMB-UHFFFAOYSA-N	237.045963912							121846
AC1NX3H8	LSM-33290	BRD-A55153871, SID3711821	5742462	InChI=1S/C18H11N3O2/c19-10-13-16(22)15(11-6-2-1-3-7-11)21-14-9-5-4-8-12(14)18(23)20-17(13)21/h1-9,15H,(H,20,23)	GPJAFDRFLJPTNU-UHFFFAOYSA-N	O=C1NC2=C(C#N)C(=O)C(N2c3ccccc13)c4ccccc4	BroadT	BRD-A55153871	BRD-A55153871-001-05-3	Enamine Ltd.	T0511-5159			O=C1C(N2C(NC(=O)c3ccccc23)=C1C#N)c1ccccc1	InChI=1S/C18H11N3O2/c19-10-13-16(22)15(11-6-2-1-3-7-11)21-14-9-5-4-8-12(14)18(23)20-17(13)21/h1-9,15H,(H,20,23)	GPJAFDRFLJPTNU-UHFFFAOYSA-N	301.085126622							121847
6-(4-Chlorophenyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazole	LSM-33291	BRD-K20470077, SID24808922	333033	InChI=1S/C11H9ClN2S/c12-9-3-1-8(2-4-9)10-7-14-5-6-15-11(14)13-10/h1-4,7H,5-6H2	RMVBKVLYENHZTQ-UHFFFAOYSA-N	Clc1ccc(cc1)c2cn3CCSc3n2	BroadT	BRD-K20470077	BRD-K20470077-001-05-3	Asinex Ltd.	BAS 00683722			Clc1ccc(cc1)-c1cn2CCSc2n1	InChI=1S/C11H9ClN2S/c12-9-3-1-8(2-4-9)10-7-14-5-6-15-11(14)13-10/h1-4,7H,5-6H2	RMVBKVLYENHZTQ-UHFFFAOYSA-N	236.017496708							121848
CHEMDIV1_019755	LSM-33292	BRD-K93310782	3930629	InChI=1S/C14H11ClN4O4S/c15-11-4-2-1-3-10(11)14(21)16-8-12(20)18-17-7-9-5-6-13(24-9)19(22)23/h1-7H,8H2,(H,16,21)(H,18,20)	JRFSFYPJPILXHZ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(C=NNC(=O)CNC(=O)c2ccccc2Cl)s1	BroadT	BRD-K93310782	BRD-K93310782-001-05-9	ChemDiv Inc.	1805-1341			[O-][N+](=O)c1ccc(C=NNC(=O)CNC(=O)c2ccccc2Cl)s1	InChI=1S/C14H11ClN4O4S/c15-11-4-2-1-3-10(11)14(21)16-8-12(20)18-17-7-9-5-6-13(24-9)19(22)23/h1-7H,8H2,(H,16,21)(H,18,20)	JRFSFYPJPILXHZ-UHFFFAOYSA-N	366.018953272							121849
ZINC02500760	LSM-33293	BRD-K42558179, SID17516354	2059463	InChI=1S/C18H13N3O2S2/c22-16(11-25-18-20-13-8-4-5-9-15(13)23-18)21-17-19-14(10-24-17)12-6-2-1-3-7-12/h1-10H,11H2,(H,19,21,22)	KEJYCNAYHHATKZ-UHFFFAOYSA-N	O=C(CSc1oc2ccccc2n1)Nc3nc(cs3)c4ccccc4	BroadT	BRD-K42558179	BRD-K42558179-001-05-6	Enamine Ltd.	T0511-5571			O=C(CSc1nc2ccccc2o1)Nc1nc(cs1)-c1ccccc1	InChI=1S/C18H13N3O2S2/c22-16(11-25-18-20-13-8-4-5-9-15(13)23-18)21-17-19-14(10-24-17)12-6-2-1-3-7-12/h1-10H,11H2,(H,19,21,22)	KEJYCNAYHHATKZ-UHFFFAOYSA-N	367.044918066							121850
AC1NP3IB	LSM-33294	BRD-K11493601	5149297	InChI=1S/C15H13N3S2/c1-11(14-8-5-9-19-14)17-18-15-16-13(10-20-15)12-6-3-2-4-7-12/h2-10H,1H3,(H,16,18)	KEPULMVYCWUGHG-UHFFFAOYSA-N	CC(=NNc1nc(cs1)c2ccccc2)c3cccs3	BroadT	BRD-K11493601	BRD-K11493601-001-06-9	Enamine Ltd.	T5214512			CC(=NNc1nc(cs1)-c1ccccc1)c1cccs1	InChI=1S/C15H13N3S2/c1-11(14-8-5-9-19-14)17-18-15-16-13(10-20-15)12-6-3-2-4-7-12/h2-10H,1H3,(H,16,18)	KEPULMVYCWUGHG-UHFFFAOYSA-N	299.055088826							121851
ST063078	LSM-33295	SID4261957, BRD-A12725272	2955543	InChI=1S/C18H23NO3/c1-12-5-6-14(13(2)9-12)11-19-17(21)15-10-16(20)22-18(15)7-3-4-8-18/h5-6,9,15H,3-4,7-8,10-11H2,1-2H3,(H,19,21)	YZEWZYRHCLYJCO-UHFFFAOYSA-N	Cc1ccc(CNC(=O)C2CC(=O)OC23CCCC3)c(C)c1	BroadT	BRD-A12725272	BRD-A12725272-001-05-5	ChemBridge Corporation	7798662			Cc1ccc(CNC(=O)C2CC(=O)OC22CCCC2)c(C)c1	InChI=1S/C18H23NO3/c1-12-5-6-14(13(2)9-12)11-19-17(21)15-10-16(20)22-18(15)7-3-4-8-18/h5-6,9,15H,3-4,7-8,10-11H2,1-2H3,(H,19,21)	YZEWZYRHCLYJCO-UHFFFAOYSA-N	301.167793606							121852
MLS001224778	LSM-33296	BRD-K64660038, SID49827328	23288286	InChI=1S/C12H9Cl2N3O/c13-9-2-1-3-10(11(9)14)17-12(18)16-8-4-6-15-7-5-8/h1-7H,(H2,15,16,17,18)	RCZLNXMSMDZGPD-UHFFFAOYSA-N	Clc1cccc(NC(=O)Nc2ccncc2)c1Cl	BroadT	BRD-K64660038	BRD-K64660038-001-07-0	Chemical Technologies & Investigations	AMNCO-30063			Clc1cccc(NC(=O)Nc2ccncc2)c1Cl	InChI=1S/C12H9Cl2N3O/c13-9-2-1-3-10(11(9)14)17-12(18)16-8-4-6-15-7-5-8/h1-7H,(H2,15,16,17,18)	RCZLNXMSMDZGPD-UHFFFAOYSA-N	281.012267358							121853
SMR000212614	LSM-33297	BRD-A62787624, SID17512243	4361486	InChI=1S/C20H17Cl2F3N2O4S/c1-3-31-17(29)19(30,20(23,24)25)11-4-7-15(10(2)8-11)26-18(32)27-16(28)13-6-5-12(21)9-14(13)22/h4-9,30H,3H2,1-2H3,(H2,26,27,28,32)	HNJFNNBIALTGRO-UHFFFAOYSA-N	CCOC(=O)C(O)(c1ccc(NC(=S)NC(=O)c2ccc(Cl)cc2Cl)c(C)c1)C(F)(F)F	BroadT	BRD-A62787624	BRD-A62787624-001-05-9	InterBioScreen Ltd.	STOCK1S-85499			CCOC(=O)C(O)(c1ccc(NC(=S)NC(=O)c2ccc(Cl)cc2Cl)c(C)c1)C(F)(F)F	InChI=1S/C20H17Cl2F3N2O4S/c1-3-31-17(29)19(30,20(23,24)25)11-4-7-15(10(2)8-11)26-18(32)27-16(28)13-6-5-12(21)9-14(13)22/h4-9,30H,3H2,1-2H3,(H2,26,27,28,32)	HNJFNNBIALTGRO-UHFFFAOYSA-N	508.023817754							121854
Methyl 3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate	LSM-33298	BRD-K76738405, SID24805072	753694	InChI=1S/C11H12N2O2S/c1-5-4-6(2)13-10-7(5)8(12)9(16-10)11(14)15-3/h4H,12H2,1-3H3	ZMZJLJJFYBUPKH-UHFFFAOYSA-N	COC(=O)c1sc2nc(C)cc(C)c2c1N	BroadT	BRD-K76738405	BRD-K76738405-001-05-9	Asinex Ltd.	BAS 02053988			COC(=O)c1sc2nc(C)cc(C)c2c1N	InChI=1S/C11H12N2O2S/c1-5-4-6(2)13-10-7(5)8(12)9(16-10)11(14)15-3/h4H,12H2,1-3H3	ZMZJLJJFYBUPKH-UHFFFAOYSA-N	236.061948334							121855
SMR000004711	LSM-33299	SID843412, SID26668584, BRD-K35717699	645700	InChI=1S/C24H26N2O6/c1-4-30-21-15-19(26-24(28)20-10-7-11-32-20)22(31-5-2)14-18(21)25-23(27)13-16-8-6-9-17(12-16)29-3/h6-12,14-15H,4-5,13H2,1-3H3,(H,25,27)(H,26,28)	XKLSLQRIDUZKNN-UHFFFAOYSA-N	CCOc1cc(NC(=O)c2occc2)c(OCC)cc1NC(=O)Cc3cccc(OC)c3	BroadT	BRD-K35717699	BRD-K35717699-001-05-8	Asinex Ltd.	ASN 05448332			CCOc1cc(NC(=O)c2ccco2)c(OCC)cc1NC(=O)Cc1cccc(OC)c1	InChI=1S/C24H26N2O6/c1-4-30-21-15-19(26-24(28)20-10-7-11-32-20)22(31-5-2)14-18(21)25-23(27)13-16-8-6-9-17(12-16)29-3/h6-12,14-15H,4-5,13H2,1-3H3,(H,25,27)(H,26,28)	XKLSLQRIDUZKNN-UHFFFAOYSA-N	438.179086572							121856
SMR000018513	LSM-33300	BRD-K91654532, SID7969890, SID85285690	4443991	InChI=1S/C20H18ClN3O3/c21-16-7-9-17(10-8-16)26-12-18(25)22-20-24-23-19(27-20)15-6-5-13-3-1-2-4-14(13)11-15/h5-11H,1-4,12H2,(H,22,24,25)	PGVSYUVTYNTVPH-UHFFFAOYSA-N	Clc1ccc(OCC(=O)Nc2oc(nn2)c3ccc4CCCCc4c3)cc1	BroadT	BRD-K91654532	BRD-K91654532-001-05-5	Life Chemicals Inc.	F0608-0664			Clc1ccc(OCC(=O)Nc2nnc(o2)-c2ccc3CCCCc3c2)cc1	InChI=1S/C20H18ClN3O3/c21-16-7-9-17(10-8-16)26-12-18(25)22-20-24-23-19(27-20)15-6-5-13-3-1-2-4-14(13)11-15/h5-11H,1-4,12H2,(H,22,24,25)	PGVSYUVTYNTVPH-UHFFFAOYSA-N	383.103669176							121857
MLS000522600	LSM-33301	BRD-K88003497, SID17401927	11957211	InChI=1S/C23H26N2O3/c1-3-27-21-13-11-19(12-14-21)22-15-20(25-28-22)5-4-6-23(26)24-16-18-9-7-17(2)8-10-18/h7-15H,3-6,16H2,1-2H3,(H,24,26)	ILJURSZCZNURRV-UHFFFAOYSA-N	CCOc1ccc(cc1)c2onc(CCCC(=O)NCc3ccc(C)cc3)c2	BroadT	BRD-K88003497	BRD-K88003497-001-04-6	ChemDiv Inc.	C637-0041			CCOc1ccc(cc1)-c1cc(CCCC(=O)NCc2ccc(C)cc2)no1	InChI=1S/C23H26N2O3/c1-3-27-21-13-11-19(12-14-21)22-15-20(25-28-22)5-4-6-23(26)24-16-18-9-7-17(2)8-10-18/h7-15H,3-6,16H2,1-2H3,(H,24,26)	ILJURSZCZNURRV-UHFFFAOYSA-N	378.194342712							121858
ZINC03642534	LSM-33302	BRD-K93662118, SID14737991	4614067	InChI=1S/C20H17N3O2/c1-15-5-4-6-18(13-15)24-14-19-21-20(22-25-19)16-7-9-17(10-8-16)23-11-2-3-12-23/h2-13H,14H2,1H3	NMXNNBMGMUREIP-UHFFFAOYSA-N	Cc1cccc(OCc2onc(n2)c3ccc(cc3)n4cccc4)c1	BroadT	BRD-K93662118	BRD-K93662118-001-04-1	ChemDiv Inc.	6322-0063			Cc1cccc(OCc2nc(no2)-c2ccc(cc2)-n2cccc2)c1	InChI=1S/C20H17N3O2/c1-15-5-4-6-18(13-15)24-14-19-21-20(22-25-19)16-7-9-17(10-8-16)23-11-2-3-12-23/h2-13H,14H2,1H3	NMXNNBMGMUREIP-UHFFFAOYSA-N	331.132076814							121859
MLS000055612	LSM-33303	SID3711710, BRD-K20236423	741385	InChI=1S/C12H14N4/c1-2-4-11-14-15-12(16(11)9-3-1)10-5-7-13-8-6-10/h5-8H,1-4,9H2	RZQQPARKDTYYBY-UHFFFAOYSA-N	C1CCc2nnc(c3ccncc3)n2CC1	BroadT	BRD-K20236423	BRD-K20236423-001-05-9	Enamine Ltd.	T0501-2046			C1CCc2nnc(-c3ccncc3)n2CC1	InChI=1S/C12H14N4/c1-2-4-11-14-15-12(16(11)9-3-1)10-5-7-13-8-6-10/h5-8H,1-4,9H2	RZQQPARKDTYYBY-UHFFFAOYSA-N	214.121846488							121860
AC1M3DIX	LSM-44465	BRD-K16542972, SID24797499	2187898	InChI=1S/C18H23N3O3S/c1-5-20(6-2)13-9-8-12(15(11-13)24-4)10-14-16(22)19-18(25)21(7-3)17(14)23/h8-11H,5-7H2,1-4H3,(H,19,22,25)/b14-10+	NCFYDEOFZYGJSQ-GXDHUFHOSA-N	CCN(CC)c1ccc(\C=C\2/C(=O)NC(=S)N(CC)C2=O)c(OC)c1	BroadT	BRD-K16542972	BRD-K16542972-001-05-1	ChemBridge Corporation	7403206			CCN(CC)c1ccc(\C=C2/C(=O)NC(=S)N(CC)C2=O)c(OC)c1	InChI=1S/C18H23N3O3S/c1-5-20(6-2)13-9-8-12(15(11-13)24-4)10-14-16(22)19-18(25)21(7-3)17(14)23/h8-11H,5-7H2,1-4H3,(H,19,22,25)/b14-10+	NCFYDEOFZYGJSQ-GXDHUFHOSA-N	361.146012316							
ASN 07503874	LSM-33305	BRD-K89652482, SID26667867, SID844024	646334	InChI=1S/C19H18N6O2S2/c1-11-12(2)29-17(14(11)8-20)22-16(27)10-28-19-23-18(21)25(24-19)9-15(26)13-6-4-3-5-7-13/h3-7H,9-10H2,1-2H3,(H,22,27)(H2,21,23,24)	PWUPOYJGWCHPDB-UHFFFAOYSA-N	Cc1sc(NC(=O)CSc2nc(N)n(CC(=O)c3ccccc3)n2)c(C#N)c1C	BroadT	BRD-K89652482	BRD-K89652482-001-05-3	Asinex Ltd.	ASN 07503874			Cc1sc(NC(=O)CSc2nc(N)n(CC(=O)c3ccccc3)n2)c(C#N)c1C	InChI=1S/C19H18N6O2S2/c1-11-12(2)29-17(14(11)8-20)22-16(27)10-28-19-23-18(21)25(24-19)9-15(26)13-6-4-3-5-7-13/h3-7H,9-10H2,1-2H3,(H,22,27)(H2,21,23,24)	PWUPOYJGWCHPDB-UHFFFAOYSA-N	426.093265256							121862
ST50879322	LSM-33306	BRD-K11554989, SID24797156	311503	InChI=1S/C18H21N3O2/c1-12-5-6-16(11-13(12)2)20-18(23)19-15-7-9-17(10-8-15)21(4)14(3)22/h5-11H,1-4H3,(H2,19,20,23)	XHDCZQFZTVJPFF-UHFFFAOYSA-N	CN(C(=O)C)c1ccc(NC(=O)Nc2ccc(C)c(C)c2)cc1	BroadT	BRD-K11554989	BRD-K11554989-001-05-2	ChemBridge Corporation	9051363			CN(C(C)=O)c1ccc(NC(=O)Nc2ccc(C)c(C)c2)cc1	InChI=1S/C18H21N3O2/c1-12-5-6-16(11-13(12)2)20-18(23)19-15-7-9-17(10-8-15)21(4)14(3)22/h5-11H,1-4H3,(H2,19,20,23)	XHDCZQFZTVJPFF-UHFFFAOYSA-N	311.163376942							121863
T5251321	LSM-33307	BRD-K34624391, SID24839726, SID3713800	2998550	InChI=1S/C24H24N2O8/c1-4-31-23(29)19-14(3)20(24(30)32-5-2)25-17(19)13-34-22(28)15-9-6-7-10-16(15)26-21(27)18-11-8-12-33-18/h6-12,25H,4-5,13H2,1-3H3,(H,26,27)	IAJGBQVMVUOWET-UHFFFAOYSA-N	CCOC(=O)c1[nH]c(COC(=O)c2ccccc2NC(=O)c3occc3)c(C(=O)OCC)c1C	BroadT	BRD-K34624391	BRD-K34624391-001-05-8	Enamine Ltd.	T5251321			CCOC(=O)c1[nH]c(COC(=O)c2ccccc2NC(=O)c2ccco2)c(C(=O)OCC)c1C	InChI=1S/C24H24N2O8/c1-4-31-23(29)19-14(3)20(24(30)32-5-2)25-17(19)13-34-22(28)15-9-6-7-10-16(15)26-21(27)18-11-8-12-33-18/h6-12,25H,4-5,13H2,1-3H3,(H,26,27)	IAJGBQVMVUOWET-UHFFFAOYSA-N	468.153265748							121864
MLS-0067115.0001	LSM-33308	BRD-K23296676, SID24708151, SID26514142	16066626	InChI=1S/C17H13N5/c1-12-6-8-15(9-7-12)22-20-17(19-21-22)14-10-13-4-2-3-5-16(13)18-11-14/h2-11H,1H3	SQNTWOJUKZHXKP-UHFFFAOYSA-N	Cc1ccc(cc1)n2nnc(n2)c3cnc4ccccc4c3	BroadT	BRD-K23296676	BRD-K23296676-001-05-4	Sanford-Burnham Medical Research Institute	3-(2-p-tolyl-2H-tetrazol-5-yl)quinoline TZTO04			Cc1ccc(cc1)-n1nnc(n1)-c1cnc2ccccc2c1	InChI=1S/C17H13N5/c1-12-6-8-15(9-7-12)22-20-17(19-21-22)14-10-13-4-2-3-5-16(13)18-11-14/h2-11H,1H3	SQNTWOJUKZHXKP-UHFFFAOYSA-N	287.117095466							121865
STK266418	LSM-33309	BRD-K13461720, SID4261245	888293	InChI=1S/C16H19NO5/c1-10(18)22-12-7-8-14(13(9-12)16(20)21)17-15(19)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,17,19)(H,20,21)	PVYFLNBBMFUKCU-UHFFFAOYSA-N	CC(=O)Oc1ccc(NC(=O)C2CCCCC2)c(c1)C(=O)O	BroadT	BRD-K13461720	BRD-K13461720-001-05-2	ChemBridge Corporation	7345117			CC(=O)Oc1ccc(NC(=O)C2CCCCC2)c(c1)C(O)=O	InChI=1S/C16H19NO5/c1-10(18)22-12-7-8-14(13(9-12)16(20)21)17-15(19)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,17,19)(H,20,21)	PVYFLNBBMFUKCU-UHFFFAOYSA-N	305.126322718							121866
MLS000533186	LSM-33310	SID14740611, BRD-K89900384	2257388	InChI=1S/C17H14BrN3O/c1-12-11-16(19-15-5-3-2-4-6-15)20-21(12)17(22)13-7-9-14(18)10-8-13/h2-11H,1H3,(H,19,20)	RDZYFEYRRMACOX-UHFFFAOYSA-N	Cc1cc(Nc2ccccc2)nn1C(=O)c3ccc(Br)cc3	BroadT	BRD-K89900384	BRD-K89900384-001-06-3	ChemBridge Corporation	5675006			Cc1cc(Nc2ccccc2)nn1C(=O)c1ccc(Br)cc1	InChI=1S/C17H14BrN3O/c1-12-11-16(19-15-5-3-2-4-6-15)20-21(12)17(22)13-7-9-14(18)10-8-13/h2-11H,1H3,(H,19,20)	RDZYFEYRRMACOX-UHFFFAOYSA-N	355.032024698							121867
MLS000888840	LSM-33311	SID26670053, BRD-K59232896	16682609	InChI=1S/C22H31N3O/c23-21-24-14-19(10-15-1-3-20(26)4-2-15)25(21)6-5-22-11-16-7-17(12-22)9-18(8-16)13-22/h1-4,16-19,26H,5-14H2,(H2,23,24)/t16?,17?,18?,19-,22?/m0/s1	FLQJADCPCJPEIP-ONUXSRJRSA-N	NC1=NC[C@H](Cc2ccc(O)cc2)N1CCC34CC5CC(CC(C5)C3)C4	BroadT	BRD-K59232896	BRD-K59232896-001-06-8	Torrey Pines Institute for Molecular Studies	1656-48			NC1=NC[C@H](Cc2ccc(O)cc2)N1CCC12CC3CC(CC(C3)C1)C2	InChI=1S/C22H31N3O/c23-21-24-14-19(10-15-1-3-20(26)4-2-15)25(21)6-5-22-11-16-7-17(12-22)9-18(8-16)13-22/h1-4,16-19,26H,5-14H2,(H2,23,24)/t16?,17?,18?,19-,22?/m0/s1	FLQJADCPCJPEIP-ONUXSRJRSA-N	353.246712642							121868
AC1P7LM5	LSM-33312	BRD-K47474571, SID49822303	8487428	InChI=1S/C14H17N3O3/c1-10-14(17(18)19)11(2)16(15-10)9-8-12-4-6-13(20-3)7-5-12/h4-7H,8-9H2,1-3H3	RGVUIROFBRJIRY-UHFFFAOYSA-N	COc1ccc(CCn2nc(C)c(c2C)[N+](=O)[O-])cc1	BroadT	BRD-K47474571	BRD-K47474571-001-05-5	UkrOrgSynthesis Ltd.	PB87854975			COc1ccc(CCn2nc(C)c(c2C)[N+]([O-])=O)cc1	InChI=1S/C14H17N3O3/c1-10-14(17(18)19)11(2)16(15-10)9-8-12-4-6-13(20-3)7-5-12/h4-7H,8-9H2,1-3H3	RGVUIROFBRJIRY-UHFFFAOYSA-N	275.126991434							121869
N-(4-Methoxyphenyl)-2-(3-methylphenoxy)-n-[(4-methylphenyl)sulfonyl]acetamide	LSM-33313	BRD-K60430111, SID17511274	1544413	InChI=1S/C23H23NO5S/c1-17-7-13-22(14-8-17)30(26,27)24(19-9-11-20(28-3)12-10-19)23(25)16-29-21-6-4-5-18(2)15-21/h4-15H,16H2,1-3H3	LVJPXCCGXRNQFT-UHFFFAOYSA-N	COc1ccc(cc1)N(C(=O)COc2cccc(C)c2)S(=O)(=O)c3ccc(C)cc3	BroadT	BRD-K60430111	BRD-K60430111-001-06-4	ChemDiv Inc.	4388-0055			COc1ccc(cc1)N(C(=O)COc1cccc(C)c1)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C23H23NO5S/c1-17-7-13-22(14-8-17)30(26,27)24(19-9-11-20(28-3)12-10-19)23(25)16-29-21-6-4-5-18(2)15-21/h4-15H,16H2,1-3H3	LVJPXCCGXRNQFT-UHFFFAOYSA-N	425.129693536							121870
MLS000579509	LSM-33314	BRD-K57205873, SID17433243	1189600	InChI=1S/C27H25NO5/c1-4-19-7-9-20(10-8-19)33-25-15-32-24-14-21(11-12-22(24)27(25)30)31-16-26(29)28-23-13-17(2)5-6-18(23)3/h5-15H,4,16H2,1-3H3,(H,28,29)	QOXYGLLNVGFXJW-UHFFFAOYSA-N	CCc1ccc(OC2=COc3cc(OCC(=O)Nc4cc(C)ccc4C)ccc3C2=O)cc1	BroadT	BRD-K57205873	BRD-K57205873-001-08-9	ChemBridge Corporation	7643503			CCc1ccc(Oc2coc3cc(OCC(=O)Nc4cc(C)ccc4C)ccc3c2=O)cc1	InChI=1S/C27H25NO5/c1-4-19-7-9-20(10-8-19)33-25-15-32-24-14-21(11-12-22(24)27(25)30)31-16-26(29)28-23-13-17(2)5-6-18(23)3/h5-15H,4,16H2,1-3H3,(H,28,29)	QOXYGLLNVGFXJW-UHFFFAOYSA-N	443.17327291							121871
ST50918314	LSM-33315	BRD-K55749438, SID17505532	898970	InChI=1S/C18H20N2O3/c1-12-5-10-15(11-16(12)20(22)23)19-17(21)13-6-8-14(9-7-13)18(2,3)4/h5-11H,1-4H3,(H,19,21)	ZMBYWCPUULJLRQ-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2ccc(cc2)C(C)(C)C)cc1[N+](=O)[O-]	BroadT	BRD-K55749438	BRD-K55749438-001-05-2	ChemBridge Corporation	7292926			Cc1ccc(NC(=O)c2ccc(cc2)C(C)(C)C)cc1[N+]([O-])=O	InChI=1S/C18H20N2O3/c1-12-5-10-15(11-16(12)20(22)23)19-17(21)13-6-8-14(9-7-13)18(2,3)4/h5-11H,1-4H3,(H,19,21)	ZMBYWCPUULJLRQ-UHFFFAOYSA-N	312.14739252							121872
ZINC00654858	LSM-33316	BRD-K55835264	6749324	InChI=1S/C17H12ClN5O3/c18-14-5-1-11(2-6-14)16-13(9-19-21-16)10-20-22-17(24)12-3-7-15(8-4-12)23(25)26/h1-10H,(H,19,21)(H,22,24)	YJERBYUDFVAEMY-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)C(=O)NN=Cc2c[nH]nc2c3ccc(Cl)cc3	BroadT	BRD-K55835264	BRD-K55835264-001-05-8	Specs	AK-968/40605299			[O-][N+](=O)c1ccc(cc1)C(=O)NN=Cc1c[nH]nc1-c1ccc(Cl)cc1	InChI=1S/C17H12ClN5O3/c18-14-5-1-11(2-6-14)16-13(9-19-21-16)10-20-22-17(24)12-3-7-15(8-4-12)23(25)26/h1-10H,(H,19,21)(H,22,24)	YJERBYUDFVAEMY-UHFFFAOYSA-N	369.062867004							
MLS001242653	LSM-33317	BRD-K37619154, SID49729256	24792596	InChI=1S/C23H39N3O/c1-24-15-21(14-19-8-4-2-5-9-19)25-16-22(17-27)26-18-23(12-13-23)20-10-6-3-7-11-20/h3,6-7,10-11,19,21-22,24-27H,2,4-5,8-9,12-18H2,1H3/t21-,22+/m0/s1	JWUMTZQBXUPHNJ-FCHUYYIVSA-N	CNC[C@H](CC1CCCCC1)NC[C@H](CO)NCC2(CC2)c3ccccc3	BroadT	BRD-K37619154	BRD-K37619154-001-05-2	Torrey Pines Institute for Molecular Studies	1665-104			CNC[C@H](CC1CCCCC1)NC[C@H](CO)NCC1(CC1)c1ccccc1	InChI=1S/C23H39N3O/c1-24-15-21(14-19-8-4-2-5-9-19)25-16-22(17-27)26-18-23(12-13-23)20-10-6-3-7-11-20/h3,6-7,10-11,19,21-22,24-27H,2,4-5,8-9,12-18H2,1H3/t21-,22+/m0/s1	JWUMTZQBXUPHNJ-FCHUYYIVSA-N	373.309312898							121874
AC1LH3QA	LSM-33318	BRD-K65005459	831709	InChI=1S/C16H15FN2OS/c17-12-5-3-4-11(8-12)9-18-19-16(20)14-10-21-15-7-2-1-6-13(14)15/h3-5,8-10H,1-2,6-7H2,(H,19,20)	FXGPZKOMGUCXQE-UHFFFAOYSA-N	Fc1cccc(C=NNC(=O)c2csc3CCCCc23)c1	BroadT	BRD-K65005459	BRD-K65005459-001-05-1	Specs	AK-968/15603606			Fc1cccc(C=NNC(=O)c2csc3CCCCc23)c1	InChI=1S/C16H15FN2OS/c17-12-5-3-4-11(8-12)9-18-19-16(20)14-10-21-15-7-2-1-6-13(14)15/h3-5,8-10H,1-2,6-7H2,(H,19,20)	FXGPZKOMGUCXQE-UHFFFAOYSA-N	302.08891201							121875
AK-968/41923960	LSM-33319	SID22412280, BRD-K50171760	1767302	InChI=1S/C12H17N3S2/c1-3-5-6-15-11(13-14-12(15)16)9-7-10(4-2)17-8-9/h7-8H,3-6H2,1-2H3,(H,14,16)	FXEKREULHAMJSA-UHFFFAOYSA-N	CCCCn1c(S)nnc1c2csc(CC)c2	BroadT	BRD-K50171760	BRD-K50171760-001-05-2	Specs	AK-968/41923960			CCCCn1c(S)nnc1-c1csc(CC)c1	InChI=1S/C12H17N3S2/c1-3-5-6-15-11(13-14-12(15)16)9-7-10(4-2)17-8-9/h7-8H,3-6H2,1-2H3,(H,14,16)	FXEKREULHAMJSA-UHFFFAOYSA-N	267.086388954							121876
ZINC00571734	LSM-33320	BRD-K66572611, SID24793946	961858	InChI=1S/C15H15NO2S/c1-18-12-9-7-11(8-10-12)16-15(17)13-5-3-4-6-14(13)19-2/h3-10H,1-2H3,(H,16,17)	ORYYJXDJYAGAPG-UHFFFAOYSA-N	COc1ccc(NC(=O)c2ccccc2SC)cc1	BroadT	BRD-K66572611	BRD-K66572611-001-05-4	ChemBridge Corporation	9020096			COc1ccc(NC(=O)c2ccccc2SC)cc1	InChI=1S/C15H15NO2S/c1-18-12-9-7-11(8-10-12)16-15(17)13-5-3-4-6-14(13)19-2/h3-10H,1-2H3,(H,16,17)	ORYYJXDJYAGAPG-UHFFFAOYSA-N	273.08234942							121877
BRD-K16935435	LSM-44466		16682458	InChI=1S/C19H18N4O3/c1-13-9-10-18(26-13)15-12-16(22-21-15)19(24)23-20-11-5-7-14-6-3-4-8-17(14)25-2/h3-12H,1-2H3,(H,21,22)(H,23,24)/b7-5+,20-11?	KMUUYHSRMWYYGP-TZLAGTBTSA-N	COc1ccccc1\C=C\C=NNC(=O)c2cc([nH]n2)c3oc(C)cc3	BroadT	BRD-K16935435	BRD-K16935435-001-05-8	InterBioScreen Ltd.	STOCK3S-35143			COc1ccccc1\C=C\C=NNC(=O)c1cc([nH]n1)-c1ccc(C)o1	InChI=1S/C19H18N4O3/c1-13-9-10-18(26-13)15-12-16(22-21-15)19(24)23-20-11-5-7-14-6-3-4-8-17(14)25-2/h3-12H,1-2H3,(H,21,22)(H,23,24)/b7-5+,20-11?	KMUUYHSRMWYYGP-TZLAGTBTSA-N	350.137890476							
MLS000882919	LSM-33322	BRD-K53770426, SID26732263	16746425	InChI=1S/C26H25NO/c1-18-8-7-13-23-24(18)26(28)27(17-19-9-3-2-4-10-19)25(23)22-15-14-20-11-5-6-12-21(20)16-22/h2-7,9-16,18,23-25H,8,17H2,1H3/t18-,23+,24+,25+/m1/s1	RBOGTOKHHDCLPU-DNQHQPOYSA-N	C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc3ccccc3)[C@H]2c4ccc5ccccc5c4	BroadT	BRD-K53770426	BRD-K53770426-001-06-2	University of Kansas CMLD	KUC101291N			C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc1ccccc1)[C@H]2c1ccc2ccccc2c1	InChI=1S/C26H25NO/c1-18-8-7-13-23-24(18)26(28)27(17-19-9-3-2-4-10-19)25(23)22-15-14-20-11-5-6-12-21(20)16-22/h2-7,9-16,18,23-25H,8,17H2,1H3/t18-,23+,24+,25+/m1/s1	RBOGTOKHHDCLPU-DNQHQPOYSA-N	367.19361443							121879
AC1NMHW7	LSM-33323	BRD-K07665396, SID24812479	5010278	InChI=1S/C18H23N3O2S/c1-3-20-8-10-21(11-9-20)18(23)13-24-16-12-17(22)19(2)15-7-5-4-6-14(15)16/h4-7,12H,3,8-11,13H2,1-2H3	KPDYIDKQARTZQA-UHFFFAOYSA-N	CCN1CCN(CC1)C(=O)CSC2=CC(=O)N(C)c3ccccc23	BroadT	BRD-K07665396	BRD-K07665396-001-05-9	ChemDiv Inc.	C463-0090			CCN1CCN(CC1)C(=O)CSc1cc(=O)n(C)c2ccccc12	InChI=1S/C18H23N3O2S/c1-3-20-8-10-21(11-9-20)18(23)13-24-16-12-17(22)19(2)15-7-5-4-6-14(15)16/h4-7,12H,3,8-11,13H2,1-2H3	KPDYIDKQARTZQA-UHFFFAOYSA-N	345.151097696							121880
UPCMLD04ASTW002106	LSM-33324	BRD-K95428783, SID17384879, SID24707884	3247280	InChI=1S/C28H32N2O4/c1-19-14-15-23(34-19)17-29-26(31)20(2)24-16-28(24,3)25(22-12-8-5-9-13-22)30-27(32)33-18-21-10-6-4-7-11-21/h4-15,20,24-25H,16-18H2,1-3H3,(H,29,31)(H,30,32)/t20-,24-,25-,28+/m1/s1	SRNJFFZNRXKBLI-PFCXFHTISA-N	C[C@H]([C@H]1C[C@]1(C)[C@H](NC(=O)OCc2ccccc2)c3ccccc3)C(=O)NCc4oc(C)cc4	BroadT	BRD-K95428783	BRD-K95428783-001-06-4	University of Pittsburgh CMLD	UPCMLD04ASTW002106			C[C@H]([C@H]1C[C@]1(C)[C@H](NC(=O)OCc1ccccc1)c1ccccc1)C(=O)NCc1ccc(C)o1	InChI=1S/C28H32N2O4/c1-19-14-15-23(34-19)17-29-26(31)20(2)24-16-28(24,3)25(22-12-8-5-9-13-22)30-27(32)33-18-21-10-6-4-7-11-21/h4-15,20,24-25H,16-18H2,1-3H3,(H,29,31)(H,30,32)/t20-,24-,25-,28+/m1/s1	SRNJFFZNRXKBLI-PFCXFHTISA-N	460.236207524							121881
MLS000660625	LSM-33325	BRD-K87073572	16194027	InChI=1S/C26H35N3O4/c1-17-11-13-29(14-12-17)23-22(24(30)25(23)31)27-15-18-7-9-19(10-8-18)26(32)28-16-20-5-3-4-6-21(20)33-2/h3-6,17-19,31H,7-16H2,1-2H3,(H,28,32)	HJSKCODAWHNOGQ-UHFFFAOYSA-N	COc1ccccc1CNC(=O)C2CCC(CN=C3C(=O)C(=C3N4CCC(C)CC4)O)CC2	BroadT	BRD-K87073572	BRD-K87073572-001-05-5	ChemDiv Inc.	C906-0550			COc1ccccc1CNC(=O)C1CCC(CN=c2c(N3CCC(C)CC3)c(O)c2=O)CC1	InChI=1S/C26H35N3O4/c1-17-11-13-29(14-12-17)23-22(24(30)25(23)31)27-15-18-7-9-19(10-8-18)26(32)28-16-20-5-3-4-6-21(20)33-2/h3-6,17-19,31H,7-16H2,1-2H3,(H,28,32)	HJSKCODAWHNOGQ-UHFFFAOYSA-N	453.26275663							
5,6,7-Trimethoxy-1-methyl-1H-indole-2-carboxylic acid	LSM-33326	BRD-K61439332, SID846105	648477	InChI=1S/C13H15NO5/c1-14-8(13(15)16)5-7-6-9(17-2)11(18-3)12(19-4)10(7)14/h5-6H,1-4H3,(H,15,16)	RJCPLLGBXJTSSD-UHFFFAOYSA-N	COc1cc2cc(C(=O)O)n(C)c2c(OC)c1OC	BroadT	BRD-K61439332	BRD-K61439332-001-11-7	Asinex Ltd.	BAS 10142182			COc1cc2cc(C(O)=O)n(C)c2c(OC)c1OC	InChI=1S/C13H15NO5/c1-14-8(13(15)16)5-7-6-9(17-2)11(18-3)12(19-4)10(7)14/h5-6H,1-4H3,(H,15,16)	RJCPLLGBXJTSSD-UHFFFAOYSA-N	265.09502259							121883
N-(3,4-Dihydro-1H-[1,4]thiazino[4,3-a]benzimidazol-8-yl)pentanamide	LSM-33327	BRD-K68134791, SID864983	666231	InChI=1S/C15H19N3OS/c1-2-3-4-15(19)16-11-5-6-13-12(9-11)17-14-10-20-8-7-18(13)14/h5-6,9H,2-4,7-8,10H2,1H3,(H,16,19)	ALLRDXPTMBEELL-UHFFFAOYSA-N	CCCCC(=O)Nc1ccc2c(c1)nc3CSCCn23	BroadT	BRD-K68134791	BRD-K68134791-001-05-3	InterBioScreen Ltd.	STOCK5S-34216			CCCCC(=O)Nc1ccc2n3CCSCc3nc2c1	InChI=1S/C15H19N3OS/c1-2-3-4-15(19)16-11-5-6-13-12(9-11)17-14-10-20-8-7-18(13)14/h5-6,9H,2-4,7-8,10H2,1H3,(H,16,19)	ALLRDXPTMBEELL-UHFFFAOYSA-N	289.124882948							121884
CHEMBL1535354	LSM-33328	SID4257617, BRD-K87879912	576549	InChI=1S/C15H14N2O3S/c18-21(19,11-10-20-12-6-2-1-3-7-12)15-16-13-8-4-5-9-14(13)17-15/h1-9H,10-11H2,(H,16,17)	UFWQPVYIZPUELO-UHFFFAOYSA-N	O=S(=O)(CCOc1ccccc1)c2nc3ccccc3[nH]2	BroadT	BRD-K87879912	BRD-K87879912-001-05-4	ChemBridge Corporation	6731156			O=S(=O)(CCOc1ccccc1)c1nc2ccccc2[nH]1	InChI=1S/C15H14N2O3S/c18-21(19,11-10-20-12-6-2-1-3-7-12)15-16-13-8-4-5-9-14(13)17-15/h1-9H,10-11H2,(H,16,17)	UFWQPVYIZPUELO-UHFFFAOYSA-N	302.072513018							121885
MLS001163353	LSM-33329	BRD-K21786986, SID104222657, SID47197703	800252	InChI=1S/C18H18FNOS/c19-17-6-2-1-5-15(17)13-21-16-9-7-14(8-10-16)18(22)20-11-3-4-12-20/h1-2,5-10H,3-4,11-13H2	JFQIUEJMDJFBSH-UHFFFAOYSA-N	Fc1ccccc1COc2ccc(cc2)C(=S)N3CCCC3	BroadT	BRD-K21786986	BRD-K21786986-001-05-1	ChemBridge Corporation	6914459			Fc1ccccc1COc1ccc(cc1)C(=S)N1CCCC1	InChI=1S/C18H18FNOS/c19-17-6-2-1-5-15(17)13-21-16-9-7-14(8-10-16)18(22)20-11-3-4-12-20/h1-2,5-10H,3-4,11-13H2	JFQIUEJMDJFBSH-UHFFFAOYSA-N	315.109313096							121886
SMR000179615	LSM-33330	BRD-K92018859, SID17402152	1489029	InChI=1S/C19H18Cl3NO2S/c20-14-3-1-13(2-4-14)18(24)23-9-7-19(25,8-10-23)12-26-17-6-5-15(21)11-16(17)22/h1-6,11,25H,7-10,12H2	HJKNTECFBOMCNX-UHFFFAOYSA-N	OC1(CSc2ccc(Cl)cc2Cl)CCN(CC1)C(=O)c3ccc(Cl)cc3	BroadT	BRD-K92018859	BRD-K92018859-001-05-7	Key Organics Ltd.	9P-336S			OC1(CSc2ccc(Cl)cc2Cl)CCN(CC1)C(=O)c1ccc(Cl)cc1	InChI=1S/C19H18Cl3NO2S/c20-14-3-1-13(2-4-14)18(24)23-9-7-19(25,8-10-23)12-26-17-6-5-15(21)11-16(17)22/h1-6,11,25H,7-10,12H2	HJKNTECFBOMCNX-UHFFFAOYSA-N	429.012382646							121887
MLS001232726	LSM-33331	SID49827832, BRD-K96945247	17262229	InChI=1S/C18H20N2O2/c1-2-22-17-9-4-3-8-16(17)20-18(21)19-15-11-10-13-6-5-7-14(13)12-15/h3-4,8-12H,2,5-7H2,1H3,(H2,19,20,21)	FOLFKQXOHAIUBH-UHFFFAOYSA-N	CCOc1ccccc1NC(=O)Nc2ccc3CCCc3c2	BroadT	BRD-K96945247	BRD-K96945247-001-05-8	Chemical Technologies & Investigations	AMNCO-22856			CCOc1ccccc1NC(=O)Nc1ccc2CCCc2c1	InChI=1S/C18H20N2O2/c1-2-22-17-9-4-3-8-16(17)20-18(21)19-15-11-10-13-6-5-7-14(13)12-15/h3-4,8-12H,2,5-7H2,1H3,(H2,19,20,21)	FOLFKQXOHAIUBH-UHFFFAOYSA-N	296.1524779							121888
MLS001230020	LSM-33332	BRD-K56973599, SID49824038	24818668	InChI=1S/C18H22N2O2/c1-22-17-12-7-11-16(14-17)20-18(21)19-13-6-5-10-15-8-3-2-4-9-15/h2-4,7-9,11-12,14H,5-6,10,13H2,1H3,(H2,19,20,21)	TYECHBPQPJADGA-UHFFFAOYSA-N	COc1cccc(NC(=O)NCCCCc2ccccc2)c1	BroadT	BRD-K56973599	BRD-K56973599-001-06-0	Chemical Technologies & Investigations	AMNCO-24351			COc1cccc(NC(=O)NCCCCc2ccccc2)c1	InChI=1S/C18H22N2O2/c1-22-17-12-7-11-16(14-17)20-18(21)19-13-6-5-10-15-8-3-2-4-9-15/h2-4,7-9,11-12,14H,5-6,10,13H2,1H3,(H2,19,20,21)	TYECHBPQPJADGA-UHFFFAOYSA-N	298.168127964							121889
T5265244	LSM-33333	BRD-A73618687, SID3711459	2997644	InChI=1S/C16H20N2O3/c1-2-12-7-5-6-10-17(12)15(19)11-18-13-8-3-4-9-14(13)21-16(18)20/h3-4,8-9,12H,2,5-7,10-11H2,1H3	PDIAAUHHSQSOIN-UHFFFAOYSA-N	CCC1CCCCN1C(=O)CN2C(=O)Oc3ccccc23	BroadT	BRD-A73618687	BRD-A73618687-001-05-7	Enamine Ltd.	T5265244			CCC1CCCCN1C(=O)Cn1c2ccccc2oc1=O	InChI=1S/C16H20N2O3/c1-2-12-7-5-6-10-17(12)15(19)11-18-13-8-3-4-9-14(13)21-16(18)20/h3-4,8-9,12H,2,5-7,10-11H2,1H3	PDIAAUHHSQSOIN-UHFFFAOYSA-N	288.14739252							121890
SMR000026208	LSM-33334	BRD-K30372674, SID4245083	3239597	InChI=1S/C25H29N3O4/c1-26-20-9-5-4-8-18(20)21-19(16-28(24(30)22(21)26)17-6-2-3-7-17)23(29)27-12-10-25(11-13-27)31-14-15-32-25/h4-5,8-9,16-17H,2-3,6-7,10-15H2,1H3	YQGPDIKZNXOOII-UHFFFAOYSA-N	Cn1c2C(=O)N(C=C(C(=O)N3CCC4(CC3)OCCO4)c2c5ccccc15)C6CCCC6	BroadT	BRD-K30372674	BRD-K30372674-001-05-6	ChemDiv Inc.	C329-0318			Cn1c2ccccc2c2c(cn(C3CCCC3)c(=O)c12)C(=O)N1CCC2(CC1)OCCO2	InChI=1S/C25H29N3O4/c1-26-20-9-5-4-8-18(20)21-19(16-28(24(30)22(21)26)17-6-2-3-7-17)23(29)27-12-10-25(11-13-27)31-14-15-32-25/h4-5,8-9,16-17H,2-3,6-7,10-15H2,1H3	YQGPDIKZNXOOII-UHFFFAOYSA-N	435.215806438							121891
SMR000146126	LSM-33335	BRD-K15474464, SID14742294	1841174	InChI=1S/C16H15N3OS/c1-3-8-19-16-12(9-17)13(18)15(21-16)14(20)11-6-4-10(2)5-7-11/h3-7,19H,1,8,18H2,2H3	XMEZUIVLHTUGEP-UHFFFAOYSA-N	Cc1ccc(cc1)C(=O)c2sc(NCC=C)c(C#N)c2N	BroadT	BRD-K15474464	BRD-K15474464-001-05-3	InterBioScreen Ltd.	STOCK1S-26528			Cc1ccc(cc1)C(=O)c1sc(NCC=C)c(C#N)c1N	InChI=1S/C16H15N3OS/c1-3-8-19-16-12(9-17)13(18)15(21-16)14(20)11-6-4-10(2)5-7-11/h3-7,19H,1,8,18H2,2H3	XMEZUIVLHTUGEP-UHFFFAOYSA-N	297.09358282							121892
AC1MY9U2	LSM-33336	SID17504158, BRD-A09961470	3828452	InChI=1S/C17H19Cl3NO4P/c1-3-24-26(23,25-4-2)16(17(18,19)20)21-15(22)14-11-7-9-12-8-5-6-10-13(12)14/h5-11,16H,3-4H2,1-2H3,(H,21,22)	ASVZHKGQNHXEDR-UHFFFAOYSA-N	CCOP(=O)(OCC)C(NC(=O)c1cccc2ccccc12)C(Cl)(Cl)Cl	BroadT	BRD-A09961470	BRD-A09961470-001-05-1	InterBioScreen Ltd.	STOCK1S-19036			CCOP(=O)(OCC)C(NC(=O)c1cccc2ccccc12)C(Cl)(Cl)Cl	InChI=1S/C17H19Cl3NO4P/c1-3-24-26(23,25-4-2)16(17(18,19)20)21-15(22)14-11-7-9-12-8-5-6-10-13(12)14/h5-11,16H,3-4H2,1-2H3,(H,21,22)	ASVZHKGQNHXEDR-UHFFFAOYSA-N	437.011727738							121893
GNF-PF-1918	LSM-15474	BRD-K71672234, GNF-PF-1918	3124456	InChI=1S/C15H19N5/c1-10-4-6-13(7-5-10)9-17-14(16)20-15-18-11(2)8-12(3)19-15/h4-8H,9H2,1-3H3,(H3,16,17,18,19,20)	YXSUMTZEYLAKDC-UHFFFAOYSA-N	Cc1ccc(CN=C(N)Nc2nc(C)cc(C)n2)cc1	BroadT	BRD-K71672234	BRD-K71672234-003-06-6	Asinex Ltd.	BAS 01045004		Cl	Cc1ccc(CN=C(N)Nc2nc(C)cc(C)n2)cc1.Cl	InChI=1S/C15H19N5.ClH/c1-10-4-6-13(7-5-10)9-17-14(16)20-15-18-11(2)8-12(3)19-15;/h4-8H,9H2,1-3H3,(H3,16,17,18,19,20);1H	HSLBSEVYUPPZMY-UHFFFAOYSA-N	269.164045658							104116, 104116
T0512-8298	LSM-33337	BRD-K98941192, SID22406714	2372119	InChI=1S/C22H29N3S/c1-17(2)20-10-6-7-11-21(20)24-22(26)23-19-12-14-25(15-13-19)16-18-8-4-3-5-9-18/h3-11,17,19H,12-16H2,1-2H3,(H2,23,24,26)	QQWPAAYLSWYFAO-UHFFFAOYSA-N	CC(C)c1ccccc1N=C(S)NC2CCN(Cc3ccccc3)CC2	BroadT	BRD-K98941192	BRD-K98941192-001-05-0	Enamine Ltd.	T0512-8298			CC(C)c1ccccc1N=C(S)NC1CCN(Cc2ccccc2)CC1	InChI=1S/C22H29N3S/c1-17(2)20-10-6-7-11-21(20)24-22(26)23-19-12-14-25(15-13-19)16-18-8-4-3-5-9-18/h3-11,17,19H,12-16H2,1-2H3,(H2,23,24,26)	QQWPAAYLSWYFAO-UHFFFAOYSA-N	367.208218648							121894
STK630431	LSM-33338	BRD-K43543979, SID863811, SID87218756	665064	InChI=1S/C21H23N3O3/c1-3-4-11-24(21(26)19-7-5-6-10-22-19)14-16-12-15-13-17(27-2)8-9-18(15)23-20(16)25/h5-10,12-13H,3-4,11,14H2,1-2H3,(H,23,25)	KTIXKAUXLVIDQB-UHFFFAOYSA-N	CCCCN(Cc1cc2cc(OC)ccc2nc1O)C(=O)c3ccccn3	BroadT	BRD-K43543979	BRD-K43543979-001-05-9	InterBioScreen Ltd.	STOCK4S-89382			CCCCN(Cc1cc2cc(OC)ccc2nc1O)C(=O)c1ccccn1	InChI=1S/C21H23N3O3/c1-3-4-11-24(21(26)19-7-5-6-10-22-19)14-16-12-15-13-17(27-2)8-9-18(15)23-20(16)25/h5-10,12-13H,3-4,11,14H2,1-2H3,(H,23,25)	KTIXKAUXLVIDQB-UHFFFAOYSA-N	365.173941626							121895
AC1MN39A	LSM-33339	BRD-A21877498	3270877	InChI=1S/C17H14F2N4OS2/c18-16(19)25-13-5-3-11(4-6-13)8-14-15(24)22-17(26-14)23-21-10-12-2-1-7-20-9-12/h1-7,9-10,14,16H,8H2,(H,22,23,24)	MDZXZLAUBVXCAV-UHFFFAOYSA-N	FC(F)Sc1ccc(CC2SC(=NC2=O)NN=Cc3cccnc3)cc1	BroadT	BRD-A21877498	BRD-A21877498-001-10-1	Enamine Ltd.	T0502-5925			FC(F)Sc1ccc(CC2SC(NN=Cc3cccnc3)=NC2=O)cc1	InChI=1S/C17H14F2N4OS2/c18-16(19)25-13-5-3-11(4-6-13)8-14-15(24)22-17(26-14)23-21-10-12-2-1-7-20-9-12/h1-7,9-10,14,16H,8H2,(H,22,23,24)	MDZXZLAUBVXCAV-UHFFFAOYSA-N	392.057708888							121896
AC1LDKFY	LSM-33340	BRD-K64451677	668589	InChI=1S/C14H12N4OS2/c20-14-17-16-13(10-19-11-5-2-1-3-6-11)18(14)15-9-12-7-4-8-21-12/h1-9H,10H2,(H,17,20)	RCHYOAJESHBWED-UHFFFAOYSA-N	Sc1nnc(COc2ccccc2)n1N=Cc3cccs3	BroadT	BRD-K64451677	BRD-K64451677-001-05-4	InterBioScreen Ltd.	STOCK2S-97941			Sc1nnc(COc2ccccc2)n1N=Cc1cccs1	InChI=1S/C14H12N4OS2/c20-14-17-16-13(10-19-11-5-2-1-3-6-11)18(14)15-9-12-7-4-8-21-12/h1-9H,10H2,(H,17,20)	RCHYOAJESHBWED-UHFFFAOYSA-N	316.045252424							121897
AC1L9VO1	LSM-33341	BRD-K50894381, SID26732535	476810	InChI=1S/C31H38N4O6/c1-30(2,3)40-28(38)22(17-20-13-9-7-10-14-20)34-26(36)24-25(33-19-32-24)27(37)35-23(29(39)41-31(4,5)6)18-21-15-11-8-12-16-21/h7-16,19,22-23H,17-18H2,1-6H3,(H,32,33)(H,34,36)(H,35,37)/t22-,23-/m0/s1	JJOJBADKVUQOSE-GOTSBHOMSA-N	CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)c2nc[nH]c2C(=O)N[C@@H](Cc3ccccc3)C(=O)OC(C)(C)C	BroadT	BRD-K50894381	BRD-K50894381-001-05-8	University of Tulsa	AE07_AE07			CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)c1nc[nH]c1C(=O)N[C@@H](Cc1ccccc1)C(=O)OC(C)(C)C	InChI=1S/C31H38N4O6/c1-30(2,3)40-28(38)22(17-20-13-9-7-10-14-20)34-26(36)24-25(33-19-32-24)27(37)35-23(29(39)41-31(4,5)6)18-21-15-11-8-12-16-21/h7-16,19,22-23H,17-18H2,1-6H3,(H,32,33)(H,34,36)(H,35,37)/t22-,23-/m0/s1	JJOJBADKVUQOSE-GOTSBHOMSA-N	562.279134976							121898
MLS000590765	LSM-44467	SID17512924, BRD-K76015448	1981622	InChI=1S/C17H17N3OS2/c1-11(2)10-20-16(21)14(23-17(20)22)8-13-9-18-19-15(13)12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3,(H,18,19)/b14-8-	XVWNZWUBQWZRRP-ZSOIEALJSA-N	CC(C)CN1C(=S)S\C(=C/c2c[nH]nc2c3ccccc3)\C1=O	BroadT	BRD-K76015448	BRD-K76015448-001-08-5	InterBioScreen Ltd.	STOCK3S-36668			CC(C)CN1C(=S)S\C(=C/c2c[nH]nc2-c2ccccc2)C1=O	InChI=1S/C17H17N3OS2/c1-11(2)10-20-16(21)14(23-17(20)22)8-13-9-18-19-15(13)12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3,(H,18,19)/b14-8-	XVWNZWUBQWZRRP-ZSOIEALJSA-N	343.081303574							
MLS000911503	LSM-33343	BRD-K03370561, SID26725595	16745815	InChI=1S/C21H17F3N4O3/c1-31-17-8-13(20(30)27-15-4-2-3-14(10-15)21(22,23)24)7-16(11-17)28-19(29)12-5-6-26-18(25)9-12/h2-11H,1H3,(H2,25,26)(H,27,30)(H,28,29)	RDZJISXYOIRMMX-UHFFFAOYSA-N	COc1cc(NC(=O)c2ccnc(N)c2)cc(c1)C(=O)Nc3cccc(c3)C(F)(F)F	BroadT	BRD-K03370561	BRD-K03370561-001-06-7	Dana Farber Cancer Institute	AMY001-057			COc1cc(NC(=O)c2ccnc(N)c2)cc(c1)C(=O)Nc1cccc(c1)C(F)(F)F	InChI=1S/C21H17F3N4O3/c1-31-17-8-13(20(30)27-15-4-2-3-14(10-15)21(22,23)24)7-16(11-17)28-19(29)12-5-6-26-18(25)9-12/h2-11H,1H3,(H2,25,26)(H,27,30)(H,28,29)	RDZJISXYOIRMMX-UHFFFAOYSA-N	430.125275044							121900
AC1OB2UZ	LSM-33344	BRD-K32120119, SID24839438	6839240	InChI=1S/C15H22N4OS/c1-8-12(10(3)20)9(2)16-13(8)11-7-21-14(19-18-11)17-15(4,5)6/h16H,7H2,1-6H3,(H,17,19)	YYUGRTSAJIALNI-UHFFFAOYSA-N	CC(=O)c1c(C)[nH]c(C2=NN=C(NC(C)(C)C)SC2)c1C	BroadT	BRD-K32120119	BRD-K32120119-001-05-0	Enamine Ltd.	T5308217			CC(=O)c1c(C)[nH]c(c1C)C1=NN=C(NC(C)(C)C)SC1	InChI=1S/C15H22N4OS/c1-8-12(10(3)20)9(2)16-13(8)11-7-21-14(19-18-11)17-15(4,5)6/h16H,7H2,1-6H3,(H,17,19)	YYUGRTSAJIALNI-UHFFFAOYSA-N	306.151432054							
MLS000517025	LSM-33345	SID24826619, BRD-A00680357	4008202	InChI=1S/C17H21N3O5S3/c1-4-25-17(22)14-9(2)13-15(18-10(3)19-16(13)27-14)26-7-12(21)20-11-5-6-28(23,24)8-11/h11H,4-8H2,1-3H3,(H,20,21)	DDKHDACZNQQLTQ-UHFFFAOYSA-N	CCOC(=O)c1sc2nc(C)nc(SCC(=O)NC3CCS(=O)(=O)C3)c2c1C	BroadT	BRD-A00680357	BRD-A00680357-001-06-2	Enamine Ltd.	T5284294			CCOC(=O)c1sc2nc(C)nc(SCC(=O)NC3CCS(=O)(=O)C3)c2c1C	InChI=1S/C17H21N3O5S3/c1-4-25-17(22)14-9(2)13-15(18-10(3)19-16(13)27-14)26-7-12(21)20-11-5-6-28(23,24)8-11/h11H,4-8H2,1-3H3,(H,20,21)	DDKHDACZNQQLTQ-UHFFFAOYSA-N	443.064332872							121902
AC1O9940	LSM-33346	BRD-K33379484	6751220	InChI=1S/C20H18N4O2S/c1-13-4-6-15(7-5-13)24-20(25)17(14(2)23-24)11-22-18-9-8-16(27-12-21)10-19(18)26-3/h4-11,25H,1-3H3	NYTVBCLDOLWXSC-UHFFFAOYSA-N	COc1cc(SC#N)ccc1N=Cc2c(C)nn(c2O)c3ccc(C)cc3	BroadT	BRD-K33379484	BRD-K33379484-001-09-0	Asinex Ltd.	BAS 00709881			COc1cc(SC#N)ccc1N=Cc1c(C)nn(c1O)-c1ccc(C)cc1	InChI=1S/C20H18N4O2S/c1-13-4-6-15(7-5-13)24-20(25)17(14(2)23-24)11-22-18-9-8-16(27-12-21)10-19(18)26-3/h4-11,25H,1-3H3	NYTVBCLDOLWXSC-UHFFFAOYSA-N	378.115046546							
MLS000535876	LSM-33347	BRD-A98208100, SID16953856	4884765	InChI=1S/C25H28N2O3/c1-29-21-11-9-18(10-12-21)23(27-13-5-6-14-27)17-26-25(28)22-15-19-7-3-4-8-20(19)16-24(22)30-2/h3-4,7-12,15-16,23H,5-6,13-14,17H2,1-2H3,(H,26,28)	YAYHYWWKCFAPKI-UHFFFAOYSA-N	COc1ccc(cc1)C(CNC(=O)c2cc3ccccc3cc2OC)N4CCCC4	BroadT	BRD-A98208100	BRD-A98208100-001-05-7	Enamine Ltd.	T5336465			COc1ccc(cc1)C(CNC(=O)c1cc2ccccc2cc1OC)N1CCCC1	InChI=1S/C25H28N2O3/c1-29-21-11-9-18(10-12-21)23(27-13-5-6-14-27)17-26-25(28)22-15-19-7-3-4-8-20(19)16-24(22)30-2/h3-4,7-12,15-16,23H,5-6,13-14,17H2,1-2H3,(H,26,28)	YAYHYWWKCFAPKI-UHFFFAOYSA-N	404.209992776							121904
MLS000388799	LSM-33348	BRD-K24418561, SID22408535	2585229	InChI=1S/C14H12Cl2F3N3O2/c1-7-3-9(8(2)21(7)6-14(17,18)19)11(23)5-22-13(24)12(16)10(15)4-20-22/h3-4H,5-6H2,1-2H3	KNNBDLXNEJNNSQ-UHFFFAOYSA-N	Cc1cc(C(=O)CN2N=CC(=C(Cl)C2=O)Cl)c(C)n1CC(F)(F)F	BroadT	BRD-K24418561	BRD-K24418561-001-06-9	Enamine Ltd.	ZU-3094765			Cc1cc(C(=O)Cn2ncc(Cl)c(Cl)c2=O)c(C)n1CC(F)(F)F	InChI=1S/C14H12Cl2F3N3O2/c1-7-3-9(8(2)21(7)6-14(17,18)19)11(23)5-22-13(24)12(16)10(15)4-20-22/h3-4H,5-6H2,1-2H3	KNNBDLXNEJNNSQ-UHFFFAOYSA-N	381.025866674							121905
STK331384	LSM-33349	SID24809945, BRD-K83028309	1087278	InChI=1S/C18H13BrN4/c19-14-8-6-13(7-9-14)15-10-17(20)23-18(21-15)11-16(22-23)12-4-2-1-3-5-12/h1-11H,20H2	ZARNPRLVNXTAQH-UHFFFAOYSA-N	Nc1cc(nc2cc(nn12)c3ccccc3)c4ccc(Br)cc4	BroadT	BRD-K83028309	BRD-K83028309-001-05-3	Asinex Ltd.	BAS 00621912			Nc1cc(nc2cc(nn12)-c1ccccc1)-c1ccc(Br)cc1	InChI=1S/C18H13BrN4/c19-14-8-6-13(7-9-14)15-10-17(20)23-18(21-15)11-16(22-23)12-4-2-1-3-5-12/h1-11H,20H2	ZARNPRLVNXTAQH-UHFFFAOYSA-N	364.032359056							121906
BRD-K70868165	LSM-12754		54638650	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18-,19+/m1/s1	LPRUTVLBIHKZIS-QRVBRYPASA-N	COc1cccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@H]2CO)c1	BroadT	BRD-K70868165	BRD-K70868165-001-01-9	Broad Institute of MIT and Harvard	BRD-K70868165			COc1cccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@H]2CO)c1	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18-,19+/m1/s1	LPRUTVLBIHKZIS-QRVBRYPASA-N	405.226371122							101391
BRD-K04643065-001-01-8	LSM-8715	BRD-K04643065	54638618	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18+,19-/m0/s1	JHFKDWZHMFMOKL-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K04643065	BRD-K04643065-001-01-8	Broad Institute of MIT and Harvard	BRD-K04643065			OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18+,19-/m0/s1	JHFKDWZHMFMOKL-OTWHNJEPSA-N	466.18278992							97336
BRD-K97741410	LSM-14435		54638629	InChI=1S/C9H17NO4/c1-13-9(12)4-6-2-3-7(10)8(5-11)14-6/h6-8,11H,2-5,10H2,1H3/t6-,7+,8-/m1/s1	OCLDGUCQSRMFDC-GJMOJQLCSA-N	COC(=O)C[C@H]1CC[C@H](N)[C@@H](CO)O1	BroadT	BRD-K97741410	BRD-K97741410-001-01-0	Broad Institute of MIT and Harvard	BRD-K97741410			COC(=O)C[C@H]1CC[C@H](N)[C@@H](CO)O1	InChI=1S/C9H17NO4/c1-13-9(12)4-6-2-3-7(10)8(5-11)14-6/h6-8,11H,2-5,10H2,1H3/t6-,7+,8-/m1/s1	OCLDGUCQSRMFDC-GJMOJQLCSA-N	203.115758034							103090
BRD-K93007240	LSM-14135		54638565	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17-,19-/m1/s1	BSYBIQMXMHXRRQ-ZHALLVOQSA-N	CCCNC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)c3cccc(F)c3)O[C@@H]1CO	BroadT	BRD-K93007240	BRD-K93007240-001-01-6	Broad Institute of MIT and Harvard	BRD-K93007240			CCCNC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)-c2cccc(F)c2)O[C@@H]1CO	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17-,19-/m1/s1	BSYBIQMXMHXRRQ-ZHALLVOQSA-N	405.217618006							102789
BRD-K82096551	LSM-13444		54638823	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17-,18+/m1/s1	QFAVGRCFIOJHOR-KURKYZTESA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@H]1NC(=O)CC3CC3	BroadT	BRD-K82096551	BRD-K82096551-001-01-5	Broad Institute of MIT and Harvard	BRD-K82096551			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@H]1NC(=O)CC1CC1	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17-,18+/m1/s1	QFAVGRCFIOJHOR-KURKYZTESA-N	394.165935074							102084
BRD-K83322422	LSM-13518		54638756	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12+,13+/m1/s1	OBZPPVVKYJWSJI-WXHSDQCUSA-N	COC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2F)[C@H](CO)O1	BroadT	BRD-K83322422	BRD-K83322422-001-01-1	Broad Institute of MIT and Harvard	BRD-K83322422			COC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2F)[C@H](CO)O1	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12+,13+/m1/s1	OBZPPVVKYJWSJI-WXHSDQCUSA-N	361.09953626							102159
BRD-K71921803	LSM-12836		54638626	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17+,18-/m0/s1	ZHYLMLAAZLDJNG-QGTPRVQTSA-N	CN1CCN(CC1)C(=O)C[C@H]2O[C@@H](CO)[C@H](NC(=O)Nc3ccccc3F)C=C2	BroadT	BRD-K71921803	BRD-K71921803-001-01-3	Broad Institute of MIT and Harvard	BRD-K71921803			CN1CCN(CC1)C(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccccc2F)C=C1	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17+,18-/m0/s1	ZHYLMLAAZLDJNG-QGTPRVQTSA-N	406.201633584							101473
BRD-K93525097	LSM-14164		54638842	InChI=1S/C24H25FN4O5/c25-18-4-2-1-3-17(18)20-12-29(28-27-20)10-9-16-6-7-19(23(13-30)34-16)26-24(31)15-5-8-21-22(11-15)33-14-32-21/h1-5,8,11-12,16,19,23,30H,6-7,9-10,13-14H2,(H,26,31)/t16-,19+,23-/m1/s1	RQZDEGSLOUOYBH-BVZALQNUSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3ccccc3F)CC[C@@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K93525097	BRD-K93525097-001-01-1	Broad Institute of MIT and Harvard	BRD-K93525097			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2F)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C24H25FN4O5/c25-18-4-2-1-3-17(18)20-12-29(28-27-20)10-9-16-6-7-19(23(13-30)34-16)26-24(31)15-5-8-21-22(11-15)33-14-32-21/h1-5,8,11-12,16,19,23,30H,6-7,9-10,13-14H2,(H,26,31)/t16-,19+,23-/m1/s1	RQZDEGSLOUOYBH-BVZALQNUSA-N	468.18089814							102818
BRD-K95352879	LSM-14272		54638663	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19-,20-/m0/s1	PGYGWAGYUXBZHY-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CCCCC2)C=C[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K95352879	BRD-K95352879-001-01-2	Broad Institute of MIT and Harvard	BRD-K95352879			OC[C@@H]1O[C@H](CC(=O)NCC2CCCCC2)C=C[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19-,20-/m0/s1	PGYGWAGYUXBZHY-UFYCRDLUSA-N	419.22203467							102926
BRD-K85528826	LSM-13656		54638763	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22+,23+/m1/s1	URVFCIGKBRHLNA-PUHATCMVSA-N	CC(C)NC(=O)NCC[C@H]1CC[C@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@H](CO)O1	BroadT	BRD-K85528826	BRD-K85528826-001-01-3	Broad Institute of MIT and Harvard	BRD-K85528826			CC(C)NC(=O)NCC[C@H]1CC[C@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@H](CO)O1	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22+,23+/m1/s1	URVFCIGKBRHLNA-PUHATCMVSA-N	491.209006496							102303
BRD-K49595590	LSM-11443		54638543	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17-,19+/m0/s1	UVJMALWFIRFJAR-JENIJYKNSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K49595590	BRD-K49595590-001-01-1	Broad Institute of MIT and Harvard	BRD-K49595590			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@@H]1NC(=O)c1ccccn1	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17-,19+/m0/s1	UVJMALWFIRFJAR-JENIJYKNSA-N	417.150012582							100064
BRD-K39530782	LSM-10830		54638561	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19-/m0/s1	ZEQYNXCYKJRRAG-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K39530782	BRD-K39530782-001-01-8	Broad Institute of MIT and Harvard	BRD-K39530782			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19-/m0/s1	ZEQYNXCYKJRRAG-OTWHNJEPSA-N	423.21694929							99451
BRD-K70874643	LSM-12757		54638610	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20+,22-/m0/s1	AGCDJJGGWAFKHW-DWLFOUALSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)c4cccnc4)O[C@H]2CO	BroadT	BRD-K70874643	BRD-K70874643-001-01-9	Broad Institute of MIT and Harvard	BRD-K70874643			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2cccnc2)O[C@H]1CO	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20+,22-/m0/s1	AGCDJJGGWAFKHW-DWLFOUALSA-N	457.178375084							101394
BRD-K13513398	LSM-9237		54638635	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14-,16-/m0/s1	TWVDNKQJDYICCW-DZKIICNBSA-N	CC(C)c1cn(CC[C@@H]2CC[C@H](NC(=O)C3CC3)[C@H](CO)O2)nn1	BroadT	BRD-K13513398	BRD-K13513398-001-01-0	Broad Institute of MIT and Harvard	BRD-K13513398			CC(C)c1cn(CC[C@@H]2CC[C@H](NC(=O)C3CC3)[C@H](CO)O2)nn1	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14-,16-/m0/s1	TWVDNKQJDYICCW-DZKIICNBSA-N	336.216140796							97858
BRD-K37556205	LSM-10700		54638579	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18+,19+/m0/s1	BBKVVMQWFBDXMC-IPMKNSEASA-N	OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K37556205	BRD-K37556205-001-01-4	Broad Institute of MIT and Harvard	BRD-K37556205			OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18+,19+/m0/s1	BBKVVMQWFBDXMC-IPMKNSEASA-N	458.137527436							99321
BRD-K80232076	LSM-13332		54638539	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17+,19+/m0/s1	UVJMALWFIRFJAR-YQVWRLOYSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K80232076	BRD-K80232076-001-01-4	Broad Institute of MIT and Harvard	BRD-K80232076			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@H]1NC(=O)c1ccccn1	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17+,19+/m0/s1	UVJMALWFIRFJAR-YQVWRLOYSA-N	417.150012582							101971
BRD-K27767004	LSM-10102		54638585	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18+,19-/m1/s1	BBKVVMQWFBDXMC-CEXWTWQISA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K27767004	BRD-K27767004-001-01-2	Broad Institute of MIT and Harvard	BRD-K27767004			OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18+,19-/m1/s1	BBKVVMQWFBDXMC-CEXWTWQISA-N	458.137527436							98723
BRD-K94300226	LSM-14210		54638691	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20-,22+/m1/s1	BOSRLBMZBBTOKS-UZKOGDIHSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K94300226	BRD-K94300226-001-01-2	Broad Institute of MIT and Harvard	BRD-K94300226			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20-,22+/m1/s1	BOSRLBMZBBTOKS-UZKOGDIHSA-N	459.196962774							102864
BRD-K04515815	LSM-8701		54638586	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18+,19-/m0/s1	BBKVVMQWFBDXMC-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K04515815	BRD-K04515815-001-01-1	Broad Institute of MIT and Harvard	BRD-K04515815			OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18+,19-/m0/s1	BBKVVMQWFBDXMC-OTWHNJEPSA-N	458.137527436							97322
BRD-K19487261	LSM-9603		54638687	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20+,22+/m1/s1	BOSRLBMZBBTOKS-CBQOVEMMSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K19487261	BRD-K19487261-001-01-5	Broad Institute of MIT and Harvard	BRD-K19487261			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20+,22+/m1/s1	BOSRLBMZBBTOKS-CBQOVEMMSA-N	459.196962774							98224
BRD-K80101280	LSM-13320		54638735	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12-,13-/m0/s1	QPJNNDOFKLWHFX-XDTLVQLUSA-N	OC[C@@H]1O[C@H](CC(=O)O)C=C[C@@H]1NC(=O)c2ccccc2F	BroadT	BRD-K80101280	BRD-K80101280-001-01-3	Broad Institute of MIT and Harvard	BRD-K80101280			OC[C@@H]1O[C@H](CC(O)=O)C=C[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12-,13-/m0/s1	QPJNNDOFKLWHFX-XDTLVQLUSA-N	309.101250822							101959
BRD-K35957449	LSM-10590		54638679	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18-/m0/s1	UYZCTKNUILRIOW-BZSNNMDCSA-N	CCCNC(=O)N[C@H]1C=C[C@@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	BroadT	BRD-K35957449	BRD-K35957449-001-01-2	Broad Institute of MIT and Harvard	BRD-K35957449			CCCNC(=O)N[C@H]1C=C[C@@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18-/m0/s1	UYZCTKNUILRIOW-BZSNNMDCSA-N	375.215806438							99211
MLS003650076	LSM-12381	BRD-K64682090	53382727	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17-,19+/m0/s1	BSYBIQMXMHXRRQ-JENIJYKNSA-N	CCCNC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)c3cccc(F)c3)O[C@@H]1CO	BroadT	BRD-K64682090	BRD-K64682090-001-01-2	Broad Institute of MIT and Harvard	BRD-K64682090			CCCNC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)-c2cccc(F)c2)O[C@@H]1CO	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17-,19+/m0/s1	BSYBIQMXMHXRRQ-JENIJYKNSA-N	405.217618006							101008
BRD-K41571462	LSM-10953		54638787	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16+,19+/m1/s1	ZKMZGYJTUFHVCC-GJYPPUQNSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K41571462	BRD-K41571462-001-01-5	Broad Institute of MIT and Harvard	BRD-K41571462			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16+,19+/m1/s1	ZKMZGYJTUFHVCC-GJYPPUQNSA-N	402.179086572							99574
BRD-K52149447	LSM-11618		54638708	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14+,15-/m1/s1	UCAVQNBXNWPRQF-QLFBSQMISA-N	OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K52149447	BRD-K52149447-001-01-6	Broad Institute of MIT and Harvard	BRD-K52149447			OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14+,15-/m1/s1	UCAVQNBXNWPRQF-QLFBSQMISA-N	391.100204976							131201
BRD-K74042281	LSM-12959		54638738	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12+,13-/m1/s1	QPJNNDOFKLWHFX-JIMOISOXSA-N	OC[C@H]1O[C@@H](CC(=O)O)C=C[C@@H]1NC(=O)c2ccccc2F	BroadT	BRD-K74042281	BRD-K74042281-001-01-6	Broad Institute of MIT and Harvard	BRD-K74042281			OC[C@H]1O[C@@H](CC(O)=O)C=C[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12+,13-/m1/s1	QPJNNDOFKLWHFX-JIMOISOXSA-N	309.101250822							101596
BRD-K11401851	LSM-9121		54638647	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18-,19-/m1/s1	LPRUTVLBIHKZIS-GUDVDZBRSA-N	COc1cccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@@H]2CO)c1	BroadT	BRD-K11401851	BRD-K11401851-001-01-0	Broad Institute of MIT and Harvard	BRD-K11401851			COc1cccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@@H]2CO)c1	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18-,19-/m1/s1	LPRUTVLBIHKZIS-GUDVDZBRSA-N	405.226371122							97742
BRD-K53263381	LSM-11674		54638587	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18+,19+/m0/s1	VZTWMEPVNSFWIB-QXAKKESOSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K53263381	BRD-K53263381-001-01-2	Broad Institute of MIT and Harvard	BRD-K53263381			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18+,19+/m0/s1	VZTWMEPVNSFWIB-QXAKKESOSA-N	426.162470874							100299
BRD-K85025453	LSM-13621		54638538	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18+,19-/m0/s1	QCIRQJIZWMFOON-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C=C[C@H]1NC(=O)C4CC4	BroadT	BRD-K85025453	BRD-K85025453-001-01-0	Broad Institute of MIT and Harvard	BRD-K85025453			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C=C[C@H]1NC(=O)C1CC1	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18+,19-/m0/s1	QCIRQJIZWMFOON-OTWHNJEPSA-N	370.189257332							102268
BRD-K23584424	LSM-9845		54638839	InChI=1S/C19H30N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h7,11,14-16,24H,1-6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16-/m0/s1	IZCYNDJXNVTGPG-XHSDSOJGSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K23584424	BRD-K23584424-001-01-7	Broad Institute of MIT and Harvard	BRD-K23584424			OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C19H30N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h7,11,14-16,24H,1-6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16-/m0/s1	IZCYNDJXNVTGPG-XHSDSOJGSA-N	410.19877617							98466
BRD-K62465706	LSM-12223		54638813	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15-,16-/m0/s1	XHJSWNOOJCOHJI-JYJNAYRXSA-N	COCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccc(Cl)cc2)O[C@H]1CO	BroadT	BRD-K62465706	BRD-K62465706-001-01-0	Broad Institute of MIT and Harvard	BRD-K62465706			COCC(=O)N[C@H]1C=C[C@H](O[C@H]1CO)CC(=O)NCc1ccc(Cl)cc1	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15-,16-/m0/s1	XHJSWNOOJCOHJI-JYJNAYRXSA-N	382.129549566							100849
BRD-K28358982	LSM-10144		54638777	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13+,14-/m0/s1	PYGNPVIZRZQEAZ-MJBXVCDLSA-N	COC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	BroadT	BRD-K28358982	BRD-K28358982-001-01-5	Broad Institute of MIT and Harvard	BRD-K28358982			COC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13+,14-/m0/s1	PYGNPVIZRZQEAZ-MJBXVCDLSA-N	388.124606328							98765
BRD-K60474343	LSM-12083		54638826	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16+,18+/m0/s1	LFPPDYCBOCBVHR-LZLYRXPVSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCCCC3)O[C@@H]2CO	BroadT	BRD-K60474343	BRD-K60474343-001-01-3	Broad Institute of MIT and Harvard	BRD-K60474343			COc1ccccc1S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16+,18+/m0/s1	LFPPDYCBOCBVHR-LZLYRXPVSA-N	424.166807326							100709
BRD-K69722708	LSM-12685		54638718	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22+,24+/m1/s1	CTEVGNUGMCZMIF-GPXNEJASSA-N	COc1ccc(cc1)c2cn(CC[C@H]3CC[C@H](NC(=O)CCN4CCCCC4)[C@H](CO)O3)nn2	BroadT	BRD-K69722708	BRD-K69722708-001-01-5	Broad Institute of MIT and Harvard	BRD-K69722708			COc1ccc(cc1)-c1cn(CC[C@H]2CC[C@H](NC(=O)CCN3CCCCC3)[C@H](CO)O2)nn1	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22+,24+/m1/s1	CTEVGNUGMCZMIF-GPXNEJASSA-N	471.284554714							101319
BRD-K36513323	LSM-10634		54638774	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13-,14+/m0/s1	PYGNPVIZRZQEAZ-MELADBBJSA-N	COC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	BroadT	BRD-K36513323	BRD-K36513323-001-01-3	Broad Institute of MIT and Harvard	BRD-K36513323			COC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13-,14+/m0/s1	PYGNPVIZRZQEAZ-MELADBBJSA-N	388.124606328							99255
BRD-K94177318	LSM-14199		54638800	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18-,19+/m0/s1	VPHPWASIVZFRRJ-YTQUADARSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]2CC[C@H](NC(=O)CC3CC3)[C@@H](CO)O2	BroadT	BRD-K94177318	BRD-K94177318-001-01-3	Broad Institute of MIT and Harvard	BRD-K94177318			Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]1CC[C@H](NC(=O)CC2CC2)[C@@H](CO)O1	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18-,19+/m0/s1	VPHPWASIVZFRRJ-YTQUADARSA-N	410.18754277							102853
BRD-K28968484	LSM-10185		54638831	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16-,18+/m1/s1	LFPPDYCBOCBVHR-NUJGCVRESA-N	COc1ccccc1S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCCCC3)O[C@H]2CO	BroadT	BRD-K28968484	BRD-K28968484-001-01-4	Broad Institute of MIT and Harvard	BRD-K28968484			COc1ccccc1S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16-,18+/m1/s1	LFPPDYCBOCBVHR-NUJGCVRESA-N	424.166807326							98806
BRD-K21478308	LSM-9732		54638686	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20+,22+/m0/s1	BOSRLBMZBBTOKS-CZTZKLFOSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K21478308	BRD-K21478308-001-01-5	Broad Institute of MIT and Harvard	BRD-K21478308			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20+,22+/m0/s1	BOSRLBMZBBTOKS-CZTZKLFOSA-N	459.196962774							98353
BRD-K24213763	LSM-9895		54638816	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15+,16-/m1/s1	XHJSWNOOJCOHJI-OWCLPIDISA-N	COCC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccc(Cl)cc2)O[C@@H]1CO	BroadT	BRD-K24213763	BRD-K24213763-001-01-1	Broad Institute of MIT and Harvard	BRD-K24213763			COCC(=O)N[C@H]1C=C[C@@H](O[C@@H]1CO)CC(=O)NCc1ccc(Cl)cc1	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15+,16-/m1/s1	XHJSWNOOJCOHJI-OWCLPIDISA-N	382.129549566							98516
BRD-K44229115	LSM-11128		54638781	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18-,19-/m0/s1	XLYDKAUYLYXOHP-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccccc2)C=C[C@@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K44229115	BRD-K44229115-001-01-8	Broad Institute of MIT and Harvard	BRD-K44229115			OC[C@@H]1O[C@@H](C=C[C@@H]1NC(=O)Cc1cccnc1)CC(=O)Nc1ccccc1	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18-,19-/m0/s1	XLYDKAUYLYXOHP-FHWLQOOXSA-N	381.168856246							99749
BRD-K05726929	LSM-8767		54638789	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16-,19-/m0/s1	ZKMZGYJTUFHVCC-BXWFABGCSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K05726929	BRD-K05726929-001-01-6	Broad Institute of MIT and Harvard	BRD-K05726929			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16-,19-/m0/s1	ZKMZGYJTUFHVCC-BXWFABGCSA-N	402.179086572							97388
MLS003649903	LSM-12244	BRD-K62804700	53382571	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12-,13+/m0/s1	OBZPPVVKYJWSJI-WCFLWFBJSA-N	COC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccccc2F)[C@@H](CO)O1	BroadT	BRD-K62804700	BRD-K62804700-001-01-6	Broad Institute of MIT and Harvard	BRD-K62804700			COC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccccc2F)[C@@H](CO)O1	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12-,13+/m0/s1	OBZPPVVKYJWSJI-WCFLWFBJSA-N	361.09953626							100870
BRD-K82003968	LSM-13433		54638655	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18-,19-/m1/s1	QDYPPDFKKOAHDR-GUDVDZBRSA-N	COc1cccc(CNC(=O)C[C@@H]2O[C@H](CO)[C@H](NC(=O)C3CCC3)C=C2)c1	BroadT	BRD-K82003968	BRD-K82003968-001-01-8	Broad Institute of MIT and Harvard	BRD-K82003968			COc1cccc(CNC(=O)C[C@@H]2O[C@H](CO)[C@H](NC(=O)C3CCC3)C=C2)c1	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18-,19-/m1/s1	QDYPPDFKKOAHDR-GUDVDZBRSA-N	388.199822016							102073
BRD-K45496021	LSM-11205		54638545	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17+,19-/m0/s1	UVJMALWFIRFJAR-SCTDSRPQSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K45496021	BRD-K45496021-001-01-5	Broad Institute of MIT and Harvard	BRD-K45496021			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@H]1NC(=O)c1ccccn1	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17+,19-/m0/s1	UVJMALWFIRFJAR-SCTDSRPQSA-N	417.150012582							99826
BRD-K52904986	LSM-11657		54638765	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22+,23-/m1/s1	URVFCIGKBRHLNA-AKIFATBCSA-N	CC(C)NC(=O)NCC[C@H]1CC[C@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@@H](CO)O1	BroadT	BRD-K52904986	BRD-K52904986-001-01-1	Broad Institute of MIT and Harvard	BRD-K52904986			CC(C)NC(=O)NCC[C@H]1CC[C@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@@H](CO)O1	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22+,23-/m1/s1	URVFCIGKBRHLNA-AKIFATBCSA-N	491.209006496							100282
BRD-K51810646	LSM-11597		54638846	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20+/m0/s1	ABKGFAHRWOKBSI-PWIZWCRZSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K51810646	BRD-K51810646-001-01-3	Broad Institute of MIT and Harvard	BRD-K51810646			OC[C@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20+/m0/s1	ABKGFAHRWOKBSI-PWIZWCRZSA-N	421.237684734							100220
BRD-K78227082	LSM-13212		54638746	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19+,20-/m1/s1	CXBDXCVDLXJCMX-HSALFYBXSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K78227082	BRD-K78227082-001-01-0	Broad Institute of MIT and Harvard	BRD-K78227082			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19+,20-/m1/s1	CXBDXCVDLXJCMX-HSALFYBXSA-N	501.168697278							101850
BRD-K87669574	LSM-13803		54638715	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16+/m1/s1	BYMJCSXXYVSKMN-BMFZPTHFSA-N	CCC(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	BroadT	BRD-K87669574	BRD-K87669574-001-01-7	Broad Institute of MIT and Harvard	BRD-K87669574			CCC(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16+/m1/s1	BYMJCSXXYVSKMN-BMFZPTHFSA-N	352.1798355							102452
BRD-K31784555	LSM-10355		54638571	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14+,15+/m0/s1	FUQFZQORNFVFMN-NILFDRSVSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CCN)O[C@@H]2CO	BroadT	BRD-K31784555	BRD-K31784555-001-01-4	Broad Institute of MIT and Harvard	BRD-K31784555			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CCN)O[C@@H]1CO	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14+,15+/m0/s1	FUQFZQORNFVFMN-NILFDRSVSA-N	344.140592578							98976
BRD-K33761091	LSM-10475		54638802	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18+,19+/m0/s1	NKPFHNDONDWVBL-IPMKNSEASA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@@H](NC(=O)Cc3cccnc3)[C@@H](CO)O2)nn1	BroadT	BRD-K33761091	BRD-K33761091-001-01-1	Broad Institute of MIT and Harvard	BRD-K33761091			CN(C)Cc1cn(CC[C@@H]2CC[C@@H](NC(=O)Cc3cccnc3)[C@@H](CO)O2)nn1	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18+,19+/m0/s1	NKPFHNDONDWVBL-IPMKNSEASA-N	402.23793888							99096
BRD-K30361687	LSM-10258		54638645	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18+,19+/m0/s1	LPRUTVLBIHKZIS-IPMKNSEASA-N	COc1cccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@@H]2CO)c1	BroadT	BRD-K30361687	BRD-K30361687-001-01-3	Broad Institute of MIT and Harvard	BRD-K30361687			COc1cccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@@H]2CO)c1	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18+,19+/m0/s1	LPRUTVLBIHKZIS-IPMKNSEASA-N	405.226371122							98879
BRD-K61202234	LSM-12134		54638652	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18+,19-/m0/s1	LPRUTVLBIHKZIS-OTWHNJEPSA-N	COc1cccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@H]2CO)c1	BroadT	BRD-K61202234	BRD-K61202234-001-01-9	Broad Institute of MIT and Harvard	BRD-K61202234			COc1cccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@H]2CO)c1	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18+,19-/m0/s1	LPRUTVLBIHKZIS-OTWHNJEPSA-N	405.226371122							100760
BRD-K50608891	LSM-11507		54638805	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18-,19+/m1/s1	NKPFHNDONDWVBL-QRVBRYPASA-N	CN(C)Cc1cn(CC[C@H]2CC[C@@H](NC(=O)Cc3cccnc3)[C@H](CO)O2)nn1	BroadT	BRD-K50608891	BRD-K50608891-001-01-4	Broad Institute of MIT and Harvard	BRD-K50608891			CN(C)Cc1cn(CC[C@H]2CC[C@@H](NC(=O)Cc3cccnc3)[C@H](CO)O2)nn1	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18-,19+/m1/s1	NKPFHNDONDWVBL-QRVBRYPASA-N	402.23793888							100128
BRD-K22447604	LSM-9788		54638758	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12-,13-/m0/s1	OBZPPVVKYJWSJI-DRZSPHRISA-N	COC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccccc2F)[C@H](CO)O1	BroadT	BRD-K22447604	BRD-K22447604-001-01-0	Broad Institute of MIT and Harvard	BRD-K22447604			COC(=O)C[C@@H]1CC[C@H](NS(=O)(=O)c2ccccc2F)[C@H](CO)O1	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12-,13-/m0/s1	OBZPPVVKYJWSJI-DRZSPHRISA-N	361.09953626							98409
BRD-K55597137	LSM-11795		54638624	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17-,18+/m1/s1	ZHYLMLAAZLDJNG-OLMNPRSZSA-N	CN1CCN(CC1)C(=O)C[C@@H]2O[C@@H](CO)[C@H](NC(=O)Nc3ccccc3F)C=C2	BroadT	BRD-K55597137	BRD-K55597137-001-01-8	Broad Institute of MIT and Harvard	BRD-K55597137			CN1CCN(CC1)C(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccccc2F)C=C1	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17-,18+/m1/s1	ZHYLMLAAZLDJNG-OLMNPRSZSA-N	406.201633584							100420
BRD-K35944577	LSM-10589		54638664	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19-,20+/m0/s1	PGYGWAGYUXBZHY-SLFFLAALSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CCCCC2)C=C[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K35944577	BRD-K35944577-001-01-4	Broad Institute of MIT and Harvard	BRD-K35944577			OC[C@H]1O[C@H](CC(=O)NCC2CCCCC2)C=C[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19-,20+/m0/s1	PGYGWAGYUXBZHY-SLFFLAALSA-N	419.22203467							99210
BRD-K79382100	LSM-13280		54638548	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19-,20+/m1/s1	FXPAFMKRDBMTQM-RLLQIKCJSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K79382100	BRD-K79382100-001-01-0	Broad Institute of MIT and Harvard	BRD-K79382100			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19-,20+/m1/s1	FXPAFMKRDBMTQM-RLLQIKCJSA-N	485.11874753							101919
BRD-K77835518	LSM-13190		54638660	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18+,19-/m0/s1	QDYPPDFKKOAHDR-OTWHNJEPSA-N	COc1cccc(CNC(=O)C[C@H]2O[C@@H](CO)[C@H](NC(=O)C3CCC3)C=C2)c1	BroadT	BRD-K77835518	BRD-K77835518-001-01-5	Broad Institute of MIT and Harvard	BRD-K77835518			COc1cccc(CNC(=O)C[C@H]2O[C@@H](CO)[C@H](NC(=O)C3CCC3)C=C2)c1	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18+,19-/m0/s1	QDYPPDFKKOAHDR-OTWHNJEPSA-N	388.199822016							101828
BRD-K90208654	LSM-13993		54638767	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22-,23-/m0/s1	URVFCIGKBRHLNA-PMVMPFDFSA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@H](CO)O1	BroadT	BRD-K90208654	BRD-K90208654-001-01-2	Broad Institute of MIT and Harvard	BRD-K90208654			CC(C)NC(=O)NCC[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@H](CO)O1	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22-,23-/m0/s1	URVFCIGKBRHLNA-PMVMPFDFSA-N	491.209006496							102646
MLS003649980	LSM-9300	BRD-K14413722	53382643	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17+,19-/m1/s1	UVJMALWFIRFJAR-ZIFCJYIRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K14413722	BRD-K14413722-001-01-9	Broad Institute of MIT and Harvard	BRD-K14413722			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@@H]1NC(=O)c1ccccn1	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17+,19-/m1/s1	UVJMALWFIRFJAR-ZIFCJYIRSA-N	417.150012582							97921
BRD-K43467947	LSM-11073		54638575	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14+,15-/m1/s1	FUQFZQORNFVFMN-BYCMXARLSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@H](CCN)O[C@@H]2CO	BroadT	BRD-K43467947	BRD-K43467947-001-01-9	Broad Institute of MIT and Harvard	BRD-K43467947			COc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@H](CCN)O[C@@H]1CO	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14+,15-/m1/s1	FUQFZQORNFVFMN-BYCMXARLSA-N	344.140592578							99694
BRD-K51050762	LSM-11547		54638693	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20+,22-/m0/s1	BOSRLBMZBBTOKS-DWLFOUALSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K51050762	BRD-K51050762-001-01-4	Broad Institute of MIT and Harvard	BRD-K51050762			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20+,22-/m0/s1	BOSRLBMZBBTOKS-DWLFOUALSA-N	459.196962774							100170
BRD-K73860091	LSM-12953		54638584	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18-,19+/m0/s1	BBKVVMQWFBDXMC-GBESFXJTSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K73860091	BRD-K73860091-001-01-2	Broad Institute of MIT and Harvard	BRD-K73860091			OC[C@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18-,19+/m0/s1	BBKVVMQWFBDXMC-GBESFXJTSA-N	458.137527436							101590
BRD-K47587697	LSM-11329		54638536	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18-,19+/m1/s1	QCIRQJIZWMFOON-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C=C[C@H]1NC(=O)C4CC4	BroadT	BRD-K47587697	BRD-K47587697-001-01-2	Broad Institute of MIT and Harvard	BRD-K47587697			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C=C[C@H]1NC(=O)C1CC1	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18-,19+/m1/s1	QCIRQJIZWMFOON-QRVBRYPASA-N	370.189257332							99950
BRD-K66149656	LSM-12463		54638675	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17+,18-/m0/s1	CZXCLXHYAUMTPI-KSZLIROESA-N	OC[C@@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)C3CCC3	BroadT	BRD-K66149656	BRD-K66149656-001-01-6	Broad Institute of MIT and Harvard	BRD-K66149656			OC[C@@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)C1CCC1	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17+,18-/m0/s1	CZXCLXHYAUMTPI-KSZLIROESA-N	375.215806438							101093
BRD-K82488679	LSM-13467		54638819	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17+,18+/m1/s1	QFAVGRCFIOJHOR-SQNIBIBYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@@H]1NC(=O)CC3CC3	BroadT	BRD-K82488679	BRD-K82488679-001-01-1	Broad Institute of MIT and Harvard	BRD-K82488679			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@@H]1NC(=O)CC1CC1	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17+,18+/m1/s1	QFAVGRCFIOJHOR-SQNIBIBYSA-N	394.165935074							102107
BRD-K49702326-001-01-4	LSM-11451	BRD-K49702326	54638615	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18-,19-/m1/s1	JHFKDWZHMFMOKL-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K49702326	BRD-K49702326-001-01-4	Broad Institute of MIT and Harvard	BRD-K49702326			OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18-,19-/m1/s1	JHFKDWZHMFMOKL-GUDVDZBRSA-N	466.18278992							100072
BRD-K58610656	LSM-11967		54638759	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12-,13+/m1/s1	OBZPPVVKYJWSJI-RTXFEEFZSA-N	COC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccccc2F)[C@H](CO)O1	BroadT	BRD-K58610656	BRD-K58610656-001-01-7	Broad Institute of MIT and Harvard	BRD-K58610656			COC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccccc2F)[C@H](CO)O1	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12-,13+/m1/s1	OBZPPVVKYJWSJI-RTXFEEFZSA-N	361.09953626							100593
BRD-K02041150	LSM-8556		54638745	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19-,20+/m1/s1	CXBDXCVDLXJCMX-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K02041150	BRD-K02041150-001-01-3	Broad Institute of MIT and Harvard	BRD-K02041150			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19-,20+/m1/s1	CXBDXCVDLXJCMX-AQNXPRMDSA-N	501.168697278							97177
BRD-K73400194	LSM-12924		54638783	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18-,19+/m1/s1	XLYDKAUYLYXOHP-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccccc2)C=C[C@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K73400194	BRD-K73400194-001-01-3	Broad Institute of MIT and Harvard	BRD-K73400194			OC[C@@H]1O[C@H](C=C[C@H]1NC(=O)Cc1cccnc1)CC(=O)Nc1ccccc1	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18-,19+/m1/s1	XLYDKAUYLYXOHP-QRVBRYPASA-N	381.168856246							101561
BRD-K15892609	LSM-9378		54638820	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17-,18-/m1/s1	QFAVGRCFIOJHOR-KZNAEPCWSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@H]1NC(=O)CC3CC3	BroadT	BRD-K15892609	BRD-K15892609-001-01-1	Broad Institute of MIT and Harvard	BRD-K15892609			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@H]1NC(=O)CC1CC1	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17-,18-/m1/s1	QFAVGRCFIOJHOR-KZNAEPCWSA-N	394.165935074							97999
BRD-K31545458	LSM-10339		54638830	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16-,18+/m0/s1	LFPPDYCBOCBVHR-XYJFISCASA-N	COc1ccccc1S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCCCC3)O[C@@H]2CO	BroadT	BRD-K31545458	BRD-K31545458-001-01-7	Broad Institute of MIT and Harvard	BRD-K31545458			COc1ccccc1S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16-,18+/m0/s1	LFPPDYCBOCBVHR-XYJFISCASA-N	424.166807326							98960
BRD-K67359324	LSM-12530		54638740	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19+,20+/m1/s1	CXBDXCVDLXJCMX-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K67359324	BRD-K67359324-001-01-2	Broad Institute of MIT and Harvard	BRD-K67359324			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19+,20+/m1/s1	CXBDXCVDLXJCMX-AABGKKOBSA-N	501.168697278							101161
BRD-K99809487	LSM-14563		54638628	InChI=1S/C9H17NO4/c1-13-9(12)4-6-2-3-7(10)8(5-11)14-6/h6-8,11H,2-5,10H2,1H3/t6-,7-,8+/m1/s1	OCLDGUCQSRMFDC-PRJMDXOYSA-N	COC(=O)C[C@H]1CC[C@@H](N)[C@H](CO)O1	BroadT	BRD-K99809487	BRD-K99809487-001-01-1	Broad Institute of MIT and Harvard	BRD-K99809487			COC(=O)C[C@H]1CC[C@@H](N)[C@H](CO)O1	InChI=1S/C9H17NO4/c1-13-9(12)4-6-2-3-7(10)8(5-11)14-6/h6-8,11H,2-5,10H2,1H3/t6-,7-,8+/m1/s1	OCLDGUCQSRMFDC-PRJMDXOYSA-N	203.115758034							103219
BRD-K15013036	LSM-9329		54638534	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18-,19-/m0/s1	QCIRQJIZWMFOON-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C=C[C@@H]1NC(=O)C4CC4	BroadT	BRD-K15013036	BRD-K15013036-001-01-7	Broad Institute of MIT and Harvard	BRD-K15013036			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18-,19-/m0/s1	QCIRQJIZWMFOON-FHWLQOOXSA-N	370.189257332							97950
BRD-K68409203	LSM-12602		54638597	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17-,19-/m1/s1	LUVVHBIYDBULDN-SZVBFZGTSA-N	Cc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CCNC(=O)c3cnccn3)O[C@@H]2CO	BroadT	BRD-K68409203	BRD-K68409203-001-01-0	Broad Institute of MIT and Harvard	BRD-K68409203			Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CCNC(=O)c2cnccn2)O[C@@H]1CO	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17-,19-/m1/s1	LUVVHBIYDBULDN-SZVBFZGTSA-N	434.162390662							101234
BRD-K61636401	LSM-12165		54638627	InChI=1S/C9H17NO4/c1-13-9(12)4-6-2-3-7(10)8(5-11)14-6/h6-8,11H,2-5,10H2,1H3/t6-,7-,8-/m1/s1	OCLDGUCQSRMFDC-BWZBUEFSSA-N	COC(=O)C[C@H]1CC[C@@H](N)[C@@H](CO)O1	BroadT	BRD-K61636401	BRD-K61636401-001-01-5	Broad Institute of MIT and Harvard	BRD-K61636401			COC(=O)C[C@H]1CC[C@@H](N)[C@@H](CO)O1	InChI=1S/C9H17NO4/c1-13-9(12)4-6-2-3-7(10)8(5-11)14-6/h6-8,11H,2-5,10H2,1H3/t6-,7-,8-/m1/s1	OCLDGUCQSRMFDC-BWZBUEFSSA-N	203.115758034							100791
BRD-K74390607	LSM-12984		54638817	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15+,16-/m0/s1	XHJSWNOOJCOHJI-XHSDSOJGSA-N	COCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccc(Cl)cc2)O[C@H]1CO	BroadT	BRD-K74390607	BRD-K74390607-001-01-6	Broad Institute of MIT and Harvard	BRD-K74390607			COCC(=O)N[C@@H]1C=C[C@H](O[C@H]1CO)CC(=O)NCc1ccc(Cl)cc1	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15+,16-/m0/s1	XHJSWNOOJCOHJI-XHSDSOJGSA-N	382.129549566							101621
BRD-K13779607	LSM-9262		54638772	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13-,14-/m1/s1	PYGNPVIZRZQEAZ-MGPQQGTHSA-N	COC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	BroadT	BRD-K13779607	BRD-K13779607-001-01-4	Broad Institute of MIT and Harvard	BRD-K13779607			COC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13-,14-/m1/s1	PYGNPVIZRZQEAZ-MGPQQGTHSA-N	388.124606328							97883
BRD-K40064462	LSM-10873		54638827	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16+,18+/m1/s1	LFPPDYCBOCBVHR-RYRKJORJSA-N	COc1ccccc1S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)N3CCCCC3)O[C@H]2CO	BroadT	BRD-K40064462	BRD-K40064462-001-01-2	Broad Institute of MIT and Harvard	BRD-K40064462			COc1ccccc1S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16+,18+/m1/s1	LFPPDYCBOCBVHR-RYRKJORJSA-N	424.166807326							99494
BRD-K89255395	LSM-13922		54638803	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18+,19+/m1/s1	NKPFHNDONDWVBL-QYZOEREBSA-N	CN(C)Cc1cn(CC[C@H]2CC[C@H](NC(=O)Cc3cccnc3)[C@H](CO)O2)nn1	BroadT	BRD-K89255395	BRD-K89255395-001-01-0	Broad Institute of MIT and Harvard	BRD-K89255395			CN(C)Cc1cn(CC[C@H]2CC[C@H](NC(=O)Cc3cccnc3)[C@H](CO)O2)nn1	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18+,19+/m1/s1	NKPFHNDONDWVBL-QYZOEREBSA-N	402.23793888							102575
BRD-K59404663	LSM-12020		54638640	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19-,20-/m0/s1	LRDWIZFOJOHHOT-YSSFQJQWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K59404663	BRD-K59404663-001-01-5	Broad Institute of MIT and Harvard	BRD-K59404663			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19-,20-/m0/s1	LRDWIZFOJOHHOT-YSSFQJQWSA-N	484.062647934							100646
BRD-K53740625	LSM-11696		54638599	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17-,19-/m0/s1	LUVVHBIYDBULDN-IEZWGBDMSA-N	Cc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CCNC(=O)c3cnccn3)O[C@H]2CO	BroadT	BRD-K53740625	BRD-K53740625-001-01-5	Broad Institute of MIT and Harvard	BRD-K53740625			Cc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CCNC(=O)c2cnccn2)O[C@H]1CO	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17-,19-/m0/s1	LUVVHBIYDBULDN-IEZWGBDMSA-N	434.162390662							100321
BRD-K80457386	LSM-13348		54638593	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18+,19-/m1/s1	VZTWMEPVNSFWIB-NZSAHSFTSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K80457386	BRD-K80457386-001-01-2	Broad Institute of MIT and Harvard	BRD-K80457386			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18+,19-/m1/s1	VZTWMEPVNSFWIB-NZSAHSFTSA-N	426.162470874							101987
BRD-K83072410	LSM-13506		54638784	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18+,19-/m1/s1	XLYDKAUYLYXOHP-CEXWTWQISA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccccc2)C=C[C@@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K83072410	BRD-K83072410-001-01-6	Broad Institute of MIT and Harvard	BRD-K83072410			OC[C@H]1O[C@H](C=C[C@@H]1NC(=O)Cc1cccnc1)CC(=O)Nc1ccccc1	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18+,19-/m1/s1	XLYDKAUYLYXOHP-CEXWTWQISA-N	381.168856246							102147
BRD-K00474848	LSM-8459		54638567	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17+,19-/m1/s1	BSYBIQMXMHXRRQ-ZIFCJYIRSA-N	CCCNC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)c3cccc(F)c3)O[C@@H]1CO	BroadT	BRD-K00474848	BRD-K00474848-001-01-6	Broad Institute of MIT and Harvard	BRD-K00474848			CCCNC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)-c2cccc(F)c2)O[C@@H]1CO	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17+,19-/m1/s1	BSYBIQMXMHXRRQ-ZIFCJYIRSA-N	405.217618006							97080
BRD-K18589989	LSM-9549		54638719	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22-,24+/m1/s1	CTEVGNUGMCZMIF-AKFKNWHVSA-N	COc1ccc(cc1)c2cn(CC[C@H]3CC[C@@H](NC(=O)CCN4CCCCC4)[C@H](CO)O3)nn2	BroadT	BRD-K18589989	BRD-K18589989-001-01-0	Broad Institute of MIT and Harvard	BRD-K18589989			COc1ccc(cc1)-c1cn(CC[C@H]2CC[C@@H](NC(=O)CCN3CCCCC3)[C@H](CO)O2)nn1	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22-,24+/m1/s1	CTEVGNUGMCZMIF-AKFKNWHVSA-N	471.284554714							98170
BRD-K39635618	LSM-10837		54638582	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18-,19+/m1/s1	BBKVVMQWFBDXMC-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K39635618	BRD-K39635618-001-01-5	Broad Institute of MIT and Harvard	BRD-K39635618			OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18-,19+/m1/s1	BBKVVMQWFBDXMC-QRVBRYPASA-N	458.137527436							99458
BRD-K05391634	LSM-8746		54638672	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17+,18-/m1/s1	CZXCLXHYAUMTPI-FGTMMUONSA-N	OC[C@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K05391634	BRD-K05391634-001-01-5	Broad Institute of MIT and Harvard	BRD-K05391634			OC[C@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)C1CCC1	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17+,18-/m1/s1	CZXCLXHYAUMTPI-FGTMMUONSA-N	375.215806438							97367
BRD-K78467731	LSM-13226		54638793	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16+,19-/m0/s1	ZKMZGYJTUFHVCC-FCEWJHQRSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K78467731	BRD-K78467731-001-01-7	Broad Institute of MIT and Harvard	BRD-K78467731			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16+,19-/m0/s1	ZKMZGYJTUFHVCC-FCEWJHQRSA-N	402.179086572							101865
BRD-K24890551	LSM-9942		54638653	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18+,19+/m0/s1	QDYPPDFKKOAHDR-IPMKNSEASA-N	COc1cccc(CNC(=O)C[C@H]2O[C@H](CO)[C@H](NC(=O)C3CCC3)C=C2)c1	BroadT	BRD-K24890551	BRD-K24890551-001-01-2	Broad Institute of MIT and Harvard	BRD-K24890551			COc1cccc(CNC(=O)C[C@H]2O[C@H](CO)[C@H](NC(=O)C3CCC3)C=C2)c1	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18+,19+/m0/s1	QDYPPDFKKOAHDR-IPMKNSEASA-N	388.199822016							98563
BRD-K84321619	LSM-13583		54638703	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14+,15+/m1/s1	UCAVQNBXNWPRQF-ILXRZTDVSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K84321619	BRD-K84321619-001-01-5	Broad Institute of MIT and Harvard	BRD-K84321619			OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14+,15+/m1/s1	UCAVQNBXNWPRQF-ILXRZTDVSA-N	391.100204976							102227
BRD-K77931347	LSM-13196		54638573	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14-,15-/m1/s1	FUQFZQORNFVFMN-KCPJHIHWSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CCN)O[C@@H]2CO	BroadT	BRD-K77931347	BRD-K77931347-001-01-9	Broad Institute of MIT and Harvard	BRD-K77931347			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CCN)O[C@@H]1CO	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14-,15-/m1/s1	FUQFZQORNFVFMN-KCPJHIHWSA-N	344.140592578							101834
BRD-K67663786	LSM-12548		54638733	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12+,13+/m0/s1	QPJNNDOFKLWHFX-ZWKOPEQDSA-N	OC[C@H]1O[C@H](CC(=O)O)C=C[C@H]1NC(=O)c2ccccc2F	BroadT	BRD-K67663786	BRD-K67663786-001-01-8	Broad Institute of MIT and Harvard	BRD-K67663786			OC[C@H]1O[C@H](CC(O)=O)C=C[C@H]1NC(=O)c1ccccc1F	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12+,13+/m0/s1	QPJNNDOFKLWHFX-ZWKOPEQDSA-N	309.101250822							101179
BRD-K82118651	LSM-13445		54638809	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18+,19-/m0/s1	NKPFHNDONDWVBL-OTWHNJEPSA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@@H](NC(=O)Cc3cccnc3)[C@H](CO)O2)nn1	BroadT	BRD-K82118651	BRD-K82118651-001-01-6	Broad Institute of MIT and Harvard	BRD-K82118651			CN(C)Cc1cn(CC[C@@H]2CC[C@@H](NC(=O)Cc3cccnc3)[C@H](CO)O2)nn1	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18+,19-/m0/s1	NKPFHNDONDWVBL-OTWHNJEPSA-N	402.23793888							102085
BRD-K98607641	LSM-14481		54638620	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17+,18+/m1/s1	ZHYLMLAAZLDJNG-JLSDUUJJSA-N	CN1CCN(CC1)C(=O)C[C@@H]2O[C@@H](CO)[C@@H](NC(=O)Nc3ccccc3F)C=C2	BroadT	BRD-K98607641	BRD-K98607641-001-01-3	Broad Institute of MIT and Harvard	BRD-K98607641			CN1CCN(CC1)C(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2ccccc2F)C=C1	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17+,18+/m1/s1	ZHYLMLAAZLDJNG-JLSDUUJJSA-N	406.201633584							103136
BRD-K28585560	LSM-10160		54638696	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17-,18-/m1/s1	VZLRHERICGIZBB-KZNAEPCWSA-N	Cc1onc(C)c1NC(=O)NCC[C@H]2CC[C@@H](NC(=O)c3ccc(F)cc3)[C@@H](CO)O2	BroadT	BRD-K28585560	BRD-K28585560-001-01-3	Broad Institute of MIT and Harvard	BRD-K28585560			Cc1noc(C)c1NC(=O)NCC[C@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17-,18-/m1/s1	VZLRHERICGIZBB-KZNAEPCWSA-N	434.196548204							98781
CHEMBL2361971	LSM-14025	BRD-K90915722, SID131434832	54638552	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19+,20-/m1/s1	FXPAFMKRDBMTQM-YZGWKJHDSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K90915722	BRD-K90915722-001-01-0	Broad Institute of MIT and Harvard	BRD-K90915722			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19+,20-/m1/s1	FXPAFMKRDBMTQM-YZGWKJHDSA-N	485.11874753							102678
BRD-K75111717	LSM-13030		54638656	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18-,19-/m0/s1	QDYPPDFKKOAHDR-FHWLQOOXSA-N	COc1cccc(CNC(=O)C[C@H]2O[C@@H](CO)[C@@H](NC(=O)C3CCC3)C=C2)c1	BroadT	BRD-K75111717	BRD-K75111717-001-01-2	Broad Institute of MIT and Harvard	BRD-K75111717			COc1cccc(CNC(=O)C[C@H]2O[C@@H](CO)[C@@H](NC(=O)C3CCC3)C=C2)c1	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18-,19-/m0/s1	QDYPPDFKKOAHDR-FHWLQOOXSA-N	388.199822016							101667
BRD-K48211564	LSM-11361		54638822	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17-,18+/m0/s1	QFAVGRCFIOJHOR-OKZBNKHCSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@@H]1NC(=O)CC3CC3	BroadT	BRD-K48211564	BRD-K48211564-001-01-8	Broad Institute of MIT and Harvard	BRD-K48211564			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@@H]1NC(=O)CC1CC1	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17-,18+/m0/s1	QFAVGRCFIOJHOR-OKZBNKHCSA-N	394.165935074							99982
BRD-K81954574	LSM-13431		54638559	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19+/m1/s1	ZEQYNXCYKJRRAG-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K81954574	BRD-K81954574-001-01-9	Broad Institute of MIT and Harvard	BRD-K81954574			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19+/m1/s1	ZEQYNXCYKJRRAG-QRVBRYPASA-N	423.21694929							102071
BRD-K35776062-001-01-2	LSM-33350	BRD-K35776062	54638532	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18+,19+/m0/s1	QCIRQJIZWMFOON-IPMKNSEASA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C=C[C@H]1NC(=O)C4CC4	BroadT	BRD-K35776062	BRD-K35776062-001-01-2	Broad Institute of MIT and Harvard	BRD-K35776062			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C=C[C@H]1NC(=O)C1CC1	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18+,19+/m0/s1	QCIRQJIZWMFOON-IPMKNSEASA-N	370.189257332							121907
BRD-K55065943-001-01-0	LSM-11765	BRD-K55065943	54638613	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18-,19+/m1/s1	JHFKDWZHMFMOKL-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K55065943	BRD-K55065943-001-01-0	Broad Institute of MIT and Harvard	BRD-K55065943			OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18-,19+/m1/s1	JHFKDWZHMFMOKL-QRVBRYPASA-N	466.18278992							100390
BRD-K14768863	LSM-9321		54638824	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17+,18-/m1/s1	QFAVGRCFIOJHOR-FGTMMUONSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@@H]1NC(=O)CC3CC3	BroadT	BRD-K14768863	BRD-K14768863-001-01-5	Broad Institute of MIT and Harvard	BRD-K14768863			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@@H]1NC(=O)CC1CC1	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17+,18-/m1/s1	QFAVGRCFIOJHOR-FGTMMUONSA-N	394.165935074							97942
BRD-K57497528	LSM-11908		54638601	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17+,19-/m1/s1	LUVVHBIYDBULDN-HHXXYDBFSA-N	Cc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@H](CCNC(=O)c3cnccn3)O[C@@H]2CO	BroadT	BRD-K57497528	BRD-K57497528-001-01-6	Broad Institute of MIT and Harvard	BRD-K57497528			Cc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@H](CCNC(=O)c2cnccn2)O[C@@H]1CO	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17+,19-/m1/s1	LUVVHBIYDBULDN-HHXXYDBFSA-N	434.162390662							100534
BRD-K35199432	LSM-10547		54638631	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14+,16+/m1/s1	TWVDNKQJDYICCW-YCPHGPKFSA-N	CC(C)c1cn(CC[C@H]2CC[C@H](NC(=O)C3CC3)[C@H](CO)O2)nn1	BroadT	BRD-K35199432	BRD-K35199432-001-01-0	Broad Institute of MIT and Harvard	BRD-K35199432			CC(C)c1cn(CC[C@H]2CC[C@H](NC(=O)C3CC3)[C@H](CO)O2)nn1	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14+,16+/m1/s1	TWVDNKQJDYICCW-YCPHGPKFSA-N	336.216140796							99168
BRD-K96207987	LSM-14332		54638605	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20-,22-/m1/s1	AGCDJJGGWAFKHW-SYYKKAFVSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)c4cccnc4)O[C@@H]2CO	BroadT	BRD-K96207987	BRD-K96207987-001-01-6	Broad Institute of MIT and Harvard	BRD-K96207987			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)-c2cccnc2)O[C@@H]1CO	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20-,22-/m1/s1	AGCDJJGGWAFKHW-SYYKKAFVSA-N	457.178375084							102986
BRD-K62773636	LSM-12243		54638743	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19-,20-/m0/s1	CXBDXCVDLXJCMX-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K62773636	BRD-K62773636-001-01-2	Broad Institute of MIT and Harvard	BRD-K62773636			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19-,20-/m0/s1	CXBDXCVDLXJCMX-UFYCRDLUSA-N	501.168697278							100869
BRD-K00382464	LSM-8450		54638698	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18-/m1/s1	VZLRHERICGIZBB-FGTMMUONSA-N	Cc1onc(C)c1NC(=O)NCC[C@H]2CC[C@H](NC(=O)c3ccc(F)cc3)[C@@H](CO)O2	BroadT	BRD-K00382464	BRD-K00382464-001-01-4	Broad Institute of MIT and Harvard	BRD-K00382464			Cc1noc(C)c1NC(=O)NCC[C@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18-/m1/s1	VZLRHERICGIZBB-FGTMMUONSA-N	434.196548204							97071
BRD-K55341911	LSM-11783		54638841	InChI=1S/C24H25FN4O5/c25-18-4-2-1-3-17(18)20-12-29(28-27-20)10-9-16-6-7-19(23(13-30)34-16)26-24(31)15-5-8-21-22(11-15)33-14-32-21/h1-5,8,11-12,16,19,23,30H,6-7,9-10,13-14H2,(H,26,31)/t16-,19+,23+/m1/s1	RQZDEGSLOUOYBH-ICPLQIHGSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3ccccc3F)CC[C@@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K55341911	BRD-K55341911-001-01-3	Broad Institute of MIT and Harvard	BRD-K55341911			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2F)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C24H25FN4O5/c25-18-4-2-1-3-17(18)20-12-29(28-27-20)10-9-16-6-7-19(23(13-30)34-16)26-24(31)15-5-8-21-22(11-15)33-14-32-21/h1-5,8,11-12,16,19,23,30H,6-7,9-10,13-14H2,(H,26,31)/t16-,19+,23+/m1/s1	RQZDEGSLOUOYBH-ICPLQIHGSA-N	468.18089814							100408
BRD-K18844601	LSM-9559		54638807	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18-,19-/m1/s1	NKPFHNDONDWVBL-GUDVDZBRSA-N	CN(C)Cc1cn(CC[C@H]2CC[C@@H](NC(=O)Cc3cccnc3)[C@@H](CO)O2)nn1	BroadT	BRD-K18844601	BRD-K18844601-001-01-7	Broad Institute of MIT and Harvard	BRD-K18844601			CN(C)Cc1cn(CC[C@H]2CC[C@@H](NC(=O)Cc3cccnc3)[C@@H](CO)O2)nn1	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18-,19-/m1/s1	NKPFHNDONDWVBL-GUDVDZBRSA-N	402.23793888							98180
BRD-K22433696	LSM-9787		54638589	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18-,19-/m1/s1	VZTWMEPVNSFWIB-BHIYHBOVSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K22433696	BRD-K22433696-001-01-9	Broad Institute of MIT and Harvard	BRD-K22433696			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18-,19-/m1/s1	VZTWMEPVNSFWIB-BHIYHBOVSA-N	426.162470874							98408
BRD-K92810472	LSM-14119		54638788	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16-,19-/m1/s1	ZKMZGYJTUFHVCC-GPMSIDNRSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K92810472	BRD-K92810472-001-01-3	Broad Institute of MIT and Harvard	BRD-K92810472			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16-,19-/m1/s1	ZKMZGYJTUFHVCC-GPMSIDNRSA-N	402.179086572							102773
BRD-K42419992	LSM-11001		54638580	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18+,19+/m1/s1	BBKVVMQWFBDXMC-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K42419992	BRD-K42419992-001-01-5	Broad Institute of MIT and Harvard	BRD-K42419992			OC[C@@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18+,19+/m1/s1	BBKVVMQWFBDXMC-QYZOEREBSA-N	458.137527436							99622
BRD-K15750053	LSM-9372		54638723	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22+,24-/m1/s1	CTEVGNUGMCZMIF-AOHZBQACSA-N	COc1ccc(cc1)c2cn(CC[C@H]3CC[C@H](NC(=O)CCN4CCCCC4)[C@@H](CO)O3)nn2	BroadT	BRD-K15750053	BRD-K15750053-001-01-2	Broad Institute of MIT and Harvard	BRD-K15750053			COc1ccc(cc1)-c1cn(CC[C@H]2CC[C@H](NC(=O)CCN3CCCCC3)[C@@H](CO)O2)nn1	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22+,24-/m1/s1	CTEVGNUGMCZMIF-AOHZBQACSA-N	471.284554714							97993
BRD-K15178935	LSM-9338		54638835	InChI=1S/C19H30N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h7,11,14-16,24H,1-6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16+/m1/s1	IZCYNDJXNVTGPG-PMPSAXMXSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K15178935	BRD-K15178935-001-01-0	Broad Institute of MIT and Harvard	BRD-K15178935			OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C19H30N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h7,11,14-16,24H,1-6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16+/m1/s1	IZCYNDJXNVTGPG-PMPSAXMXSA-N	410.19877617							97959
BRD-K77314783	LSM-13155		54638572	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14+,15+/m1/s1	FUQFZQORNFVFMN-UGFHNGPFSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@H](CCN)O[C@H]2CO	BroadT	BRD-K77314783	BRD-K77314783-001-01-9	Broad Institute of MIT and Harvard	BRD-K77314783			COc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@H](CCN)O[C@H]1CO	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14+,15+/m1/s1	FUQFZQORNFVFMN-UGFHNGPFSA-N	344.140592578							101793
BRD-K23564937	LSM-9844		54638551	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19-,20+/m0/s1	FXPAFMKRDBMTQM-YSIASYRMSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K23564937	BRD-K23564937-001-01-9	Broad Institute of MIT and Harvard	BRD-K23564937			OC[C@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19-,20+/m0/s1	FXPAFMKRDBMTQM-YSIASYRMSA-N	485.11874753							98465
BRD-K21630495	LSM-9744		54638699	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17-,18-/m0/s1	VZLRHERICGIZBB-BZSNNMDCSA-N	Cc1onc(C)c1NC(=O)NCC[C@@H]2CC[C@H](NC(=O)c3ccc(F)cc3)[C@H](CO)O2	BroadT	BRD-K21630495	BRD-K21630495-001-01-4	Broad Institute of MIT and Harvard	BRD-K21630495			Cc1noc(C)c1NC(=O)NCC[C@@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17-,18-/m0/s1	VZLRHERICGIZBB-BZSNNMDCSA-N	434.196548204							98365
BRD-K46096244	LSM-11236		54638806	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18+,19-/m1/s1	NKPFHNDONDWVBL-CEXWTWQISA-N	CN(C)Cc1cn(CC[C@H]2CC[C@H](NC(=O)Cc3cccnc3)[C@@H](CO)O2)nn1	BroadT	BRD-K46096244	BRD-K46096244-001-01-3	Broad Institute of MIT and Harvard	BRD-K46096244			CN(C)Cc1cn(CC[C@H]2CC[C@H](NC(=O)Cc3cccnc3)[C@@H](CO)O2)nn1	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18+,19-/m1/s1	NKPFHNDONDWVBL-CEXWTWQISA-N	402.23793888							99857
BRD-K35660899	LSM-10568		54638569	InChI=1S/C15H28N2O5S/c1-2-23(20,21)16-13-7-6-12(22-14(13)11-18)10-15(19)17-8-4-3-5-9-17/h12-14,16,18H,2-11H2,1H3/t12-,13+,14+/m0/s1	RAGICHRDMJGUIX-BFHYXJOUSA-N	CCS(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K35660899	BRD-K35660899-001-01-7	Broad Institute of MIT and Harvard	BRD-K35660899			CCS(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C15H28N2O5S/c1-2-23(20,21)16-13-7-6-12(22-14(13)11-18)10-15(19)17-8-4-3-5-9-17/h12-14,16,18H,2-11H2,1H3/t12-,13+,14+/m0/s1	RAGICHRDMJGUIX-BFHYXJOUSA-N	348.171892706							99189
BRD-K31418530	LSM-10331		54638666	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19+,20-/m1/s1	PGYGWAGYUXBZHY-HSALFYBXSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CCCCC2)C=C[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K31418530	BRD-K31418530-001-01-9	Broad Institute of MIT and Harvard	BRD-K31418530			OC[C@H]1O[C@@H](CC(=O)NCC2CCCCC2)C=C[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19+,20-/m1/s1	PGYGWAGYUXBZHY-HSALFYBXSA-N	419.22203467							98952
BRD-K58962381-001-01-4	LSM-11990	BRD-K58962381	54638611	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18+,19+/m0/s1	JHFKDWZHMFMOKL-IPMKNSEASA-N	OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K58962381	BRD-K58962381-001-01-4	Broad Institute of MIT and Harvard	BRD-K58962381			OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18+,19+/m0/s1	JHFKDWZHMFMOKL-IPMKNSEASA-N	466.18278992							100616
BRD-K33012050	LSM-10434		54638681	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18+/m1/s1	UYZCTKNUILRIOW-KURKYZTESA-N	CCCNC(=O)N[C@@H]1C=C[C@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	BroadT	BRD-K33012050	BRD-K33012050-001-01-8	Broad Institute of MIT and Harvard	BRD-K33012050			CCCNC(=O)N[C@@H]1C=C[C@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18+/m1/s1	UYZCTKNUILRIOW-KURKYZTESA-N	375.215806438							99055
MLS003649975	LSM-14022	BRD-K90873269, SID125305282	53382638	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19-,20-/m1/s1	LRDWIZFOJOHHOT-CDHQVMDDSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K90873269	BRD-K90873269-001-01-0	Broad Institute of MIT and Harvard	BRD-K90873269			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19-,20-/m1/s1	LRDWIZFOJOHHOT-CDHQVMDDSA-N	484.062647934							102675
BRD-K49093373	LSM-11413		54638761	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12+,13-/m0/s1	OBZPPVVKYJWSJI-UHTWSYAYSA-N	COC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccccc2F)[C@H](CO)O1	BroadT	BRD-K49093373	BRD-K49093373-001-01-0	Broad Institute of MIT and Harvard	BRD-K49093373			COC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccccc2F)[C@H](CO)O1	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12+,13-/m0/s1	OBZPPVVKYJWSJI-UHTWSYAYSA-N	361.09953626							100034
BRD-K02847640	LSM-8612		54638700	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17-,18+/m0/s1	VZLRHERICGIZBB-OKZBNKHCSA-N	Cc1onc(C)c1NC(=O)NCC[C@@H]2CC[C@H](NC(=O)c3ccc(F)cc3)[C@@H](CO)O2	BroadT	BRD-K02847640	BRD-K02847640-001-01-1	Broad Institute of MIT and Harvard	BRD-K02847640			Cc1noc(C)c1NC(=O)NCC[C@@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17-,18+/m0/s1	VZLRHERICGIZBB-OKZBNKHCSA-N	434.196548204							97233
BRD-K00150267	LSM-8432		54638688	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20-,22-/m1/s1	BOSRLBMZBBTOKS-SYYKKAFVSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K00150267	BRD-K00150267-001-01-4	Broad Institute of MIT and Harvard	BRD-K00150267			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20-,22-/m1/s1	BOSRLBMZBBTOKS-SYYKKAFVSA-N	459.196962774							97053
CHEMBL3183285	LSM-10801	BRD-K39132590	54638775	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13-,14+/m1/s1	PYGNPVIZRZQEAZ-MCIONIFRSA-N	COC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	BroadT	BRD-K39132590	BRD-K39132590-001-01-5	Broad Institute of MIT and Harvard	BRD-K39132590			COC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13-,14+/m1/s1	PYGNPVIZRZQEAZ-MCIONIFRSA-N	388.124606328							99422
BRD-K64704452	LSM-12385		54638724	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22+,24-/m0/s1	CTEVGNUGMCZMIF-ZDXQCDESSA-N	COc1ccc(cc1)c2cn(CC[C@@H]3CC[C@@H](NC(=O)CCN4CCCCC4)[C@H](CO)O3)nn2	BroadT	BRD-K64704452	BRD-K64704452-001-01-6	Broad Institute of MIT and Harvard	BRD-K64704452			COc1ccc(cc1)-c1cn(CC[C@@H]2CC[C@@H](NC(=O)CCN3CCCCC3)[C@H](CO)O2)nn1	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22+,24-/m0/s1	CTEVGNUGMCZMIF-ZDXQCDESSA-N	471.284554714							101012
BRD-K00695053	LSM-8478		54638795	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18+,19+/m1/s1	VPHPWASIVZFRRJ-NEWSRXKRSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@H]2CC[C@H](NC(=O)CC3CC3)[C@H](CO)O2	BroadT	BRD-K00695053	BRD-K00695053-001-01-6	Broad Institute of MIT and Harvard	BRD-K00695053			Cc1ccc(cc1)S(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)CC2CC2)[C@H](CO)O1	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18+,19+/m1/s1	VPHPWASIVZFRRJ-NEWSRXKRSA-N	410.18754277							97099
BRD-K94172147	LSM-14198		54638555	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19+/m1/s1	ZEQYNXCYKJRRAG-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K94172147	BRD-K94172147-001-01-1	Broad Institute of MIT and Harvard	BRD-K94172147			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19+/m1/s1	ZEQYNXCYKJRRAG-QYZOEREBSA-N	423.21694929							102852
BRD-K03245480	LSM-8634		54638562	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17+,19+/m0/s1	BSYBIQMXMHXRRQ-YQVWRLOYSA-N	CCCNC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)c3cccc(F)c3)O[C@@H]1CO	BroadT	BRD-K03245480	BRD-K03245480-001-01-0	Broad Institute of MIT and Harvard	BRD-K03245480			CCCNC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2cccc(F)c2)O[C@@H]1CO	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17+,19+/m0/s1	BSYBIQMXMHXRRQ-YQVWRLOYSA-N	405.217618006							97255
BRD-K84195984	LSM-13575		54638609	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20+,22-/m1/s1	AGCDJJGGWAFKHW-KAGYGMCKSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CCn3cc(nn3)c4cccnc4)O[C@@H]2CO	BroadT	BRD-K84195984	BRD-K84195984-001-01-0	Broad Institute of MIT and Harvard	BRD-K84195984			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCn2cc(nn2)-c2cccnc2)O[C@@H]1CO	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20+,22-/m1/s1	AGCDJJGGWAFKHW-KAGYGMCKSA-N	457.178375084							102219
BRD-K08040026	LSM-8914		54638754	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20+,21-/m0/s1	QYROUQDLUMQXKE-TYPHKJRUSA-N	OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NS(=O)(=O)c3cccc(Cl)c3	BroadT	BRD-K08040026	BRD-K08040026-001-01-1	Broad Institute of MIT and Harvard	BRD-K08040026			OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20+,21-/m0/s1	QYROUQDLUMQXKE-TYPHKJRUSA-N	487.190769618							97535
BRD-K04680237	LSM-8717		54638682	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18-/m1/s1	UYZCTKNUILRIOW-FGTMMUONSA-N	CCCNC(=O)N[C@H]1C=C[C@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	BroadT	BRD-K04680237	BRD-K04680237-001-01-3	Broad Institute of MIT and Harvard	BRD-K04680237			CCCNC(=O)N[C@H]1C=C[C@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18-/m1/s1	UYZCTKNUILRIOW-FGTMMUONSA-N	375.215806438							97338
BRD-K98909007	LSM-14499		54638540	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17+,19+/m1/s1	UVJMALWFIRFJAR-AOIWGVFYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K98909007	BRD-K98909007-001-01-1	Broad Institute of MIT and Harvard	BRD-K98909007			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@@H]1NC(=O)c1ccccn1	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17+,19+/m1/s1	UVJMALWFIRFJAR-AOIWGVFYSA-N	417.150012582							103154
BRD-K58072864	LSM-11936		54638796	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18-,19-/m1/s1	VPHPWASIVZFRRJ-BHIYHBOVSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@H]2CC[C@@H](NC(=O)CC3CC3)[C@@H](CO)O2	BroadT	BRD-K58072864	BRD-K58072864-001-01-8	Broad Institute of MIT and Harvard	BRD-K58072864			Cc1ccc(cc1)S(=O)(=O)NCC[C@H]1CC[C@@H](NC(=O)CC2CC2)[C@@H](CO)O1	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18-,19-/m1/s1	VPHPWASIVZFRRJ-BHIYHBOVSA-N	410.18754277							100562
BRD-K46709181	LSM-11279		54638633	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14-,16+/m1/s1	TWVDNKQJDYICCW-FMKPAKJESA-N	CC(C)c1cn(CC[C@H]2CC[C@@H](NC(=O)C3CC3)[C@H](CO)O2)nn1	BroadT	BRD-K46709181	BRD-K46709181-001-01-6	Broad Institute of MIT and Harvard	BRD-K46709181			CC(C)c1cn(CC[C@H]2CC[C@@H](NC(=O)C3CC3)[C@H](CO)O2)nn1	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14-,16+/m1/s1	TWVDNKQJDYICCW-FMKPAKJESA-N	336.216140796							99900
BRD-K32049912	LSM-10371		54638714	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16+/m0/s1	BYMJCSXXYVSKMN-CWRNSKLLSA-N	CCC(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	BroadT	BRD-K32049912	BRD-K32049912-001-01-9	Broad Institute of MIT and Harvard	BRD-K32049912			CCC(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16+/m0/s1	BYMJCSXXYVSKMN-CWRNSKLLSA-N	352.1798355							98992
BRD-K41675418	LSM-10961		54638603	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20+,22+/m0/s1	AGCDJJGGWAFKHW-CZTZKLFOSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)c4cccnc4)O[C@@H]2CO	BroadT	BRD-K41675418	BRD-K41675418-001-01-9	Broad Institute of MIT and Harvard	BRD-K41675418			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2cccnc2)O[C@@H]1CO	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20+,22+/m0/s1	AGCDJJGGWAFKHW-CZTZKLFOSA-N	457.178375084							99582
BRD-K17655522	LSM-9489		54638702	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14+,15+/m0/s1	UCAVQNBXNWPRQF-RRFJBIMHSA-N	OC[C@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K17655522	BRD-K17655522-001-01-4	Broad Institute of MIT and Harvard	BRD-K17655522			OC[C@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14+,15+/m0/s1	UCAVQNBXNWPRQF-RRFJBIMHSA-N	391.100204976							98110
BRD-K89029303	LSM-13906		54638837	InChI=1S/C19H30N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h7,11,14-16,24H,1-6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15-,16+/m1/s1	IZCYNDJXNVTGPG-OAGGEKHMSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K89029303	BRD-K89029303-001-01-0	Broad Institute of MIT and Harvard	BRD-K89029303			OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C19H30N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h7,11,14-16,24H,1-6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15-,16+/m1/s1	IZCYNDJXNVTGPG-OAGGEKHMSA-N	410.19877617							102559
BRD-K32350897	LSM-10392		54638811	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15+,16+/m1/s1	XHJSWNOOJCOHJI-PMPSAXMXSA-N	COCC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccc(Cl)cc2)O[C@H]1CO	BroadT	BRD-K32350897	BRD-K32350897-001-01-0	Broad Institute of MIT and Harvard	BRD-K32350897			COCC(=O)N[C@H]1C=C[C@@H](O[C@H]1CO)CC(=O)NCc1ccc(Cl)cc1	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15+,16+/m1/s1	XHJSWNOOJCOHJI-PMPSAXMXSA-N	382.129549566							99013
BRD-K19915020	LSM-9634		54638845	InChI=1S/C24H25FN4O5/c25-18-4-2-1-3-17(18)20-12-29(28-27-20)10-9-16-6-7-19(23(13-30)34-16)26-24(31)15-5-8-21-22(11-15)33-14-32-21/h1-5,8,11-12,16,19,23,30H,6-7,9-10,13-14H2,(H,26,31)/t16-,19+,23-/m0/s1	RQZDEGSLOUOYBH-QUZZAMIASA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3ccccc3F)CC[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K19915020	BRD-K19915020-001-01-7	Broad Institute of MIT and Harvard	BRD-K19915020			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2ccccc2F)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C24H25FN4O5/c25-18-4-2-1-3-17(18)20-12-29(28-27-20)10-9-16-6-7-19(23(13-30)34-16)26-24(31)15-5-8-21-22(11-15)33-14-32-21/h1-5,8,11-12,16,19,23,30H,6-7,9-10,13-14H2,(H,26,31)/t16-,19+,23-/m0/s1	RQZDEGSLOUOYBH-QUZZAMIASA-N	468.18089814							98255
BRD-K39151337	LSM-10805		54638591	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18-,19+/m0/s1	VZTWMEPVNSFWIB-YTQUADARSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K39151337	BRD-K39151337-001-01-3	Broad Institute of MIT and Harvard	BRD-K39151337			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18-,19+/m0/s1	VZTWMEPVNSFWIB-YTQUADARSA-N	426.162470874							99426
BRD-K01572707	LSM-8533		54638632	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14-,16+/m0/s1	TWVDNKQJDYICCW-OFQRWUPVSA-N	CC(C)c1cn(CC[C@@H]2CC[C@H](NC(=O)C3CC3)[C@@H](CO)O2)nn1	BroadT	BRD-K01572707	BRD-K01572707-001-01-6	Broad Institute of MIT and Harvard	BRD-K01572707			CC(C)c1cn(CC[C@@H]2CC[C@H](NC(=O)C3CC3)[C@@H](CO)O2)nn1	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14-,16+/m0/s1	TWVDNKQJDYICCW-OFQRWUPVSA-N	336.216140796							97154
BRD-K22097595	LSM-9766		54638661	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19+,20+/m1/s1	PGYGWAGYUXBZHY-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CCCCC2)C=C[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K22097595	BRD-K22097595-001-01-4	Broad Institute of MIT and Harvard	BRD-K22097595			OC[C@@H]1O[C@@H](CC(=O)NCC2CCCCC2)C=C[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19+,20+/m1/s1	PGYGWAGYUXBZHY-AABGKKOBSA-N	419.22203467							98387
BRD-K27299383	LSM-10078		54638766	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22-,23-/m1/s1	URVFCIGKBRHLNA-YMPZKCBVSA-N	CC(C)NC(=O)NCC[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@@H](CO)O1	BroadT	BRD-K27299383	BRD-K27299383-001-01-7	Broad Institute of MIT and Harvard	BRD-K27299383			CC(C)NC(=O)NCC[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@@H](CO)O1	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22-,23-/m1/s1	URVFCIGKBRHLNA-YMPZKCBVSA-N	491.209006496							98699
BRD-K60462241	LSM-12081		54638576	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14-,15-/m0/s1	FUQFZQORNFVFMN-CQDKDKBSSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CCN)O[C@H]2CO	BroadT	BRD-K60462241	BRD-K60462241-001-01-1	Broad Institute of MIT and Harvard	BRD-K60462241			COc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CCN)O[C@H]1CO	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14-,15-/m0/s1	FUQFZQORNFVFMN-CQDKDKBSSA-N	344.140592578							100707
BRD-K49276305	LSM-11423		54638782	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18-,19+/m0/s1	XLYDKAUYLYXOHP-GBESFXJTSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccccc2)C=C[C@@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K49276305	BRD-K49276305-001-01-4	Broad Institute of MIT and Harvard	BRD-K49276305			OC[C@H]1O[C@@H](C=C[C@@H]1NC(=O)Cc1cccnc1)CC(=O)Nc1ccccc1	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18-,19+/m0/s1	XLYDKAUYLYXOHP-GBESFXJTSA-N	381.168856246							100044
BRD-K87361616	LSM-13787		54638821	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17-,18-/m0/s1	QFAVGRCFIOJHOR-BZSNNMDCSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@@H]1NC(=O)CC3CC3	BroadT	BRD-K87361616	BRD-K87361616-001-01-1	Broad Institute of MIT and Harvard	BRD-K87361616			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@@H]1NC(=O)CC1CC1	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17-,18-/m0/s1	QFAVGRCFIOJHOR-BZSNNMDCSA-N	394.165935074							102436
CHEMBL2359633	LSM-9240	BRD-K13529284, SID131434855	54638574	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14-,15+/m1/s1	FUQFZQORNFVFMN-DFBGVHRSSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CCN)O[C@H]2CO	BroadT	BRD-K13529284	BRD-K13529284-001-01-3	Broad Institute of MIT and Harvard	BRD-K13529284			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CCN)O[C@H]1CO	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14-,15+/m1/s1	FUQFZQORNFVFMN-DFBGVHRSSA-N	344.140592578							97861
BRD-K67694126	LSM-12551		54638560	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19-/m1/s1	ZEQYNXCYKJRRAG-CEXWTWQISA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K67694126	BRD-K67694126-001-01-2	Broad Institute of MIT and Harvard	BRD-K67694126			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19-/m1/s1	ZEQYNXCYKJRRAG-CEXWTWQISA-N	423.21694929							101182
BRD-K25037118	LSM-9951		54638706	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15+/m0/s1	UCAVQNBXNWPRQF-SOUVJXGZSA-N	OC[C@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K25037118	BRD-K25037118-001-01-5	Broad Institute of MIT and Harvard	BRD-K25037118			OC[C@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15+/m0/s1	UCAVQNBXNWPRQF-SOUVJXGZSA-N	391.100204976							98572
BRD-K70630513	LSM-12735		54638595	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17+,19+/m0/s1	LUVVHBIYDBULDN-KVSKMBFKSA-N	Cc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CCNC(=O)c3cnccn3)O[C@@H]2CO	BroadT	BRD-K70630513	BRD-K70630513-001-01-2	Broad Institute of MIT and Harvard	BRD-K70630513			Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNC(=O)c2cnccn2)O[C@@H]1CO	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17+,19+/m0/s1	LUVVHBIYDBULDN-KVSKMBFKSA-N	434.162390662							101371
CHEMBL2356786	LSM-10402	BRD-K32519217, SID131434826	54638546	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19+,20+/m0/s1	FXPAFMKRDBMTQM-DFQSSKMNSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K32519217	BRD-K32519217-001-01-3	Broad Institute of MIT and Harvard	BRD-K32519217			OC[C@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19+,20+/m0/s1	FXPAFMKRDBMTQM-DFQSSKMNSA-N	485.11874753							99023
BRD-K72424685	LSM-12872		54638695	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18+/m1/s1	VZLRHERICGIZBB-SQNIBIBYSA-N	Cc1onc(C)c1NC(=O)NCC[C@H]2CC[C@H](NC(=O)c3ccc(F)cc3)[C@H](CO)O2	BroadT	BRD-K72424685	BRD-K72424685-001-01-0	Broad Institute of MIT and Harvard	BRD-K72424685			Cc1noc(C)c1NC(=O)NCC[C@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18+/m1/s1	VZLRHERICGIZBB-SQNIBIBYSA-N	434.196548204							101509
BRD-K74370838	LSM-12982		54638677	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18+/m1/s1	UYZCTKNUILRIOW-SQNIBIBYSA-N	CCCNC(=O)N[C@H]1C=C[C@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	BroadT	BRD-K74370838	BRD-K74370838-001-01-9	Broad Institute of MIT and Harvard	BRD-K74370838			CCCNC(=O)N[C@H]1C=C[C@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18+/m1/s1	UYZCTKNUILRIOW-SQNIBIBYSA-N	375.215806438							101619
BRD-K44586044	LSM-11142		54638604	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20+,22+/m1/s1	AGCDJJGGWAFKHW-CBQOVEMMSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CCn3cc(nn3)c4cccnc4)O[C@H]2CO	BroadT	BRD-K44586044	BRD-K44586044-001-01-7	Broad Institute of MIT and Harvard	BRD-K44586044			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCn2cc(nn2)-c2cccnc2)O[C@H]1CO	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20+,22+/m1/s1	AGCDJJGGWAFKHW-CBQOVEMMSA-N	457.178375084							99763
BRD-K77273736	LSM-13153		54638773	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13-,14-/m0/s1	PYGNPVIZRZQEAZ-IHRRRGAJSA-N	COC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	BroadT	BRD-K77273736	BRD-K77273736-001-01-5	Broad Institute of MIT and Harvard	BRD-K77273736			COC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13-,14-/m0/s1	PYGNPVIZRZQEAZ-IHRRRGAJSA-N	388.124606328							101791
BRD-K66185487	LSM-12465		54638704	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15-/m1/s1	UCAVQNBXNWPRQF-RBSFLKMASA-N	OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K66185487	BRD-K66185487-001-01-5	Broad Institute of MIT and Harvard	BRD-K66185487			OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15-/m1/s1	UCAVQNBXNWPRQF-RBSFLKMASA-N	391.100204976							101095
BRD-K15142057	LSM-9334		54638797	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18-,19+/m1/s1	VPHPWASIVZFRRJ-QRQLOZEOSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@H]2CC[C@@H](NC(=O)CC3CC3)[C@H](CO)O2	BroadT	BRD-K15142057	BRD-K15142057-001-01-8	Broad Institute of MIT and Harvard	BRD-K15142057			Cc1ccc(cc1)S(=O)(=O)NCC[C@H]1CC[C@@H](NC(=O)CC2CC2)[C@H](CO)O1	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18-,19+/m1/s1	VPHPWASIVZFRRJ-QRQLOZEOSA-N	410.18754277							97955
BRD-K64549867	LSM-12371		54638568	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17+,19-/m0/s1	BSYBIQMXMHXRRQ-SCTDSRPQSA-N	CCCNC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)c3cccc(F)c3)O[C@H]1CO	BroadT	BRD-K64549867	BRD-K64549867-001-01-4	Broad Institute of MIT and Harvard	BRD-K64549867			CCCNC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2cccc(F)c2)O[C@H]1CO	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17+,19-/m0/s1	BSYBIQMXMHXRRQ-SCTDSRPQSA-N	405.217618006							100998
BRD-K93510852	LSM-14163		54638556	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19-/m1/s1	ZEQYNXCYKJRRAG-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K93510852	BRD-K93510852-001-01-8	Broad Institute of MIT and Harvard	BRD-K93510852			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19-/m1/s1	ZEQYNXCYKJRRAG-GUDVDZBRSA-N	423.21694929							102817
BRD-K00575273	LSM-8470		54638588	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18+,19+/m1/s1	VZTWMEPVNSFWIB-NEWSRXKRSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K00575273	BRD-K00575273-001-01-4	Broad Institute of MIT and Harvard	BRD-K00575273			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18+,19+/m1/s1	VZTWMEPVNSFWIB-NEWSRXKRSA-N	426.162470874							97091
BRD-K16195900	LSM-9404		54638757	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12-,13-/m1/s1	OBZPPVVKYJWSJI-RAIGVLPGSA-N	COC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccccc2F)[C@@H](CO)O1	BroadT	BRD-K16195900	BRD-K16195900-001-01-4	Broad Institute of MIT and Harvard	BRD-K16195900			COC(=O)C[C@H]1CC[C@@H](NS(=O)(=O)c2ccccc2F)[C@@H](CO)O1	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12-,13-/m1/s1	OBZPPVVKYJWSJI-RAIGVLPGSA-N	361.09953626							98025
BRD-K03876750	LSM-8670		54638678	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18-/m1/s1	UYZCTKNUILRIOW-KZNAEPCWSA-N	CCCNC(=O)N[C@@H]1C=C[C@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	BroadT	BRD-K03876750	BRD-K03876750-001-01-5	Broad Institute of MIT and Harvard	BRD-K03876750			CCCNC(=O)N[C@@H]1C=C[C@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18-/m1/s1	UYZCTKNUILRIOW-KZNAEPCWSA-N	375.215806438							97291
BRD-K00946569	LSM-8493		54638722	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22-,24+/m0/s1	CTEVGNUGMCZMIF-WPFOTENUSA-N	COc1ccc(cc1)c2cn(CC[C@@H]3CC[C@H](NC(=O)CCN4CCCCC4)[C@@H](CO)O3)nn2	BroadT	BRD-K00946569	BRD-K00946569-001-01-0	Broad Institute of MIT and Harvard	BRD-K00946569			COc1ccc(cc1)-c1cn(CC[C@@H]2CC[C@H](NC(=O)CCN3CCCCC3)[C@@H](CO)O2)nn1	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22-,24+/m0/s1	CTEVGNUGMCZMIF-WPFOTENUSA-N	471.284554714							97114
BRD-K82814298	LSM-13487		54638541	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17-,19-/m1/s1	UVJMALWFIRFJAR-ZHALLVOQSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K82814298	BRD-K82814298-001-01-9	Broad Institute of MIT and Harvard	BRD-K82814298			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@H]1NC(=O)c1ccccn1	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17-,19-/m1/s1	UVJMALWFIRFJAR-ZHALLVOQSA-N	417.150012582							102127
BRD-K73336648	LSM-12922		54638662	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19-,20-/m1/s1	PGYGWAGYUXBZHY-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CCCCC2)C=C[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K73336648	BRD-K73336648-001-01-1	Broad Institute of MIT and Harvard	BRD-K73336648			OC[C@H]1O[C@@H](CC(=O)NCC2CCCCC2)C=C[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19-,20-/m1/s1	PGYGWAGYUXBZHY-VAMGGRTRSA-N	419.22203467							101559
BRD-K31561199	LSM-10341		54638637	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14+,16-/m0/s1	TWVDNKQJDYICCW-LZWOXQAQSA-N	CC(C)c1cn(CC[C@@H]2CC[C@@H](NC(=O)C3CC3)[C@H](CO)O2)nn1	BroadT	BRD-K31561199	BRD-K31561199-001-01-8	Broad Institute of MIT and Harvard	BRD-K31561199			CC(C)c1cn(CC[C@@H]2CC[C@@H](NC(=O)C3CC3)[C@H](CO)O2)nn1	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14+,16-/m0/s1	TWVDNKQJDYICCW-LZWOXQAQSA-N	336.216140796							98962
BRD-K85699864	LSM-13674		54638744	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19-,20+/m0/s1	CXBDXCVDLXJCMX-SLFFLAALSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K85699864	BRD-K85699864-001-01-5	Broad Institute of MIT and Harvard	BRD-K85699864			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19-,20+/m0/s1	CXBDXCVDLXJCMX-SLFFLAALSA-N	501.168697278							102321
BRD-K82462389	LSM-13466		54638747	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19+,20-/m0/s1	CXBDXCVDLXJCMX-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K82462389	BRD-K82462389-001-01-7	Broad Institute of MIT and Harvard	BRD-K82462389			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19+,20-/m0/s1	CXBDXCVDLXJCMX-ZCNNSNEGSA-N	501.168697278							102106
BRD-K74513776	LSM-12991		54638636	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14+,16-/m1/s1	TWVDNKQJDYICCW-IJEWVQPXSA-N	CC(C)c1cn(CC[C@H]2CC[C@H](NC(=O)C3CC3)[C@@H](CO)O2)nn1	BroadT	BRD-K74513776	BRD-K74513776-001-01-8	Broad Institute of MIT and Harvard	BRD-K74513776			CC(C)c1cn(CC[C@H]2CC[C@H](NC(=O)C3CC3)[C@@H](CO)O2)nn1	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14+,16-/m1/s1	TWVDNKQJDYICCW-IJEWVQPXSA-N	336.216140796							101628
BRD-K61531144	LSM-12159		54638608	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20-,22+/m0/s1	AGCDJJGGWAFKHW-RCZSKKKRSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)c4cccnc4)O[C@@H]2CO	BroadT	BRD-K61531144	BRD-K61531144-001-01-0	Broad Institute of MIT and Harvard	BRD-K61531144			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)-c2cccnc2)O[C@@H]1CO	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20-,22+/m0/s1	AGCDJJGGWAFKHW-RCZSKKKRSA-N	457.178375084							100785
BRD-K68644714	LSM-12614		54638689	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20-,22-/m0/s1	BOSRLBMZBBTOKS-VCOUNFBDSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K68644714	BRD-K68644714-001-01-4	Broad Institute of MIT and Harvard	BRD-K68644714			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20-,22-/m0/s1	BOSRLBMZBBTOKS-VCOUNFBDSA-N	459.196962774							101246
BRD-K76688030	LSM-13122		54638778	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18+,19+/m0/s1	XLYDKAUYLYXOHP-IPMKNSEASA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccccc2)C=C[C@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K76688030	BRD-K76688030-001-01-8	Broad Institute of MIT and Harvard	BRD-K76688030			OC[C@H]1O[C@@H](C=C[C@H]1NC(=O)Cc1cccnc1)CC(=O)Nc1ccccc1	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18+,19+/m0/s1	XLYDKAUYLYXOHP-IPMKNSEASA-N	381.168856246							101760
BRD-K90947049	LSM-14026		54638578	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14+,15-/m0/s1	FUQFZQORNFVFMN-GLQYFDAESA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CCN)O[C@H]2CO	BroadT	BRD-K90947049	BRD-K90947049-001-01-9	Broad Institute of MIT and Harvard	BRD-K90947049			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CCN)O[C@H]1CO	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14+,15-/m0/s1	FUQFZQORNFVFMN-GLQYFDAESA-N	344.140592578							102679
BRD-K11081110	LSM-9104		54638790	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16-,19+/m0/s1	ZKMZGYJTUFHVCC-TXPKVOOTSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K11081110	BRD-K11081110-001-01-7	Broad Institute of MIT and Harvard	BRD-K11081110			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16-,19+/m0/s1	ZKMZGYJTUFHVCC-TXPKVOOTSA-N	402.179086572							97725
BRD-K37710486	LSM-10710		54638606	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20-,22+/m1/s1	AGCDJJGGWAFKHW-UZKOGDIHSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)c4cccnc4)O[C@H]2CO	BroadT	BRD-K37710486	BRD-K37710486-001-01-7	Broad Institute of MIT and Harvard	BRD-K37710486			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)-c2cccnc2)O[C@H]1CO	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20-,22+/m1/s1	AGCDJJGGWAFKHW-UZKOGDIHSA-N	457.178375084							99331
BRD-K96160456	LSM-14329		54638791	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16-,19+/m1/s1	ZKMZGYJTUFHVCC-MDZRGWNJSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K96160456	BRD-K96160456-001-01-9	Broad Institute of MIT and Harvard	BRD-K96160456			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16-,19+/m1/s1	ZKMZGYJTUFHVCC-MDZRGWNJSA-N	402.179086572							102983
BRD-K56945204	LSM-11874		54638771	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13+,14+/m1/s1	PYGNPVIZRZQEAZ-RDBSUJKOSA-N	COC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	BroadT	BRD-K56945204	BRD-K56945204-001-01-6	Broad Institute of MIT and Harvard	BRD-K56945204			COC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13+,14+/m1/s1	PYGNPVIZRZQEAZ-RDBSUJKOSA-N	388.124606328							100500
BRD-K92986600	LSM-14133		54638694	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18+/m0/s1	VZLRHERICGIZBB-RCCFBDPRSA-N	Cc1onc(C)c1NC(=O)NCC[C@@H]2CC[C@@H](NC(=O)c3ccc(F)cc3)[C@@H](CO)O2	BroadT	BRD-K92986600	BRD-K92986600-001-01-6	Broad Institute of MIT and Harvard	BRD-K92986600			Cc1noc(C)c1NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18+/m0/s1	VZLRHERICGIZBB-RCCFBDPRSA-N	434.196548204							102787
BRD-K79145303	LSM-13264		54638716	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16-/m0/s1	BYMJCSXXYVSKMN-IMJJTQAJSA-N	CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	BroadT	BRD-K79145303	BRD-K79145303-001-01-6	Broad Institute of MIT and Harvard	BRD-K79145303			CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16-/m0/s1	BYMJCSXXYVSKMN-IMJJTQAJSA-N	352.1798355							101903
BRD-K25096430	LSM-9955		54638625	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17+,18-/m1/s1	ZHYLMLAAZLDJNG-FHLIZLRMSA-N	CN1CCN(CC1)C(=O)C[C@@H]2O[C@H](CO)[C@@H](NC(=O)Nc3ccccc3F)C=C2	BroadT	BRD-K25096430	BRD-K25096430-001-01-2	Broad Institute of MIT and Harvard	BRD-K25096430			CN1CCN(CC1)C(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Nc2ccccc2F)C=C1	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17+,18-/m1/s1	ZHYLMLAAZLDJNG-FHLIZLRMSA-N	406.201633584							98576
BRD-K49907578	LSM-11460		54638770	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13+,14+/m0/s1	PYGNPVIZRZQEAZ-BFHYXJOUSA-N	COC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	BroadT	BRD-K49907578	BRD-K49907578-001-01-4	Broad Institute of MIT and Harvard	BRD-K49907578			COC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13+,14+/m0/s1	PYGNPVIZRZQEAZ-BFHYXJOUSA-N	388.124606328							100081
BRD-K21033948	LSM-9708		54638779	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18+,19+/m1/s1	XLYDKAUYLYXOHP-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccccc2)C=C[C@@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K21033948	BRD-K21033948-001-01-4	Broad Institute of MIT and Harvard	BRD-K21033948			OC[C@@H]1O[C@H](C=C[C@@H]1NC(=O)Cc1cccnc1)CC(=O)Nc1ccccc1	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18+,19+/m1/s1	XLYDKAUYLYXOHP-QYZOEREBSA-N	381.168856246							98329
BRD-K65378566	LSM-12415		54638690	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20-,22+/m0/s1	BOSRLBMZBBTOKS-RCZSKKKRSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K65378566	BRD-K65378566-001-01-1	Broad Institute of MIT and Harvard	BRD-K65378566			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20-,22+/m0/s1	BOSRLBMZBBTOKS-RCZSKKKRSA-N	459.196962774							101042
BRD-K84935712	LSM-13618		54638753	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20+,21-/m1/s1	QYROUQDLUMQXKE-HLAWJBBLSA-N	OC[C@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c3cccc(Cl)c3	BroadT	BRD-K84935712	BRD-K84935712-001-01-8	Broad Institute of MIT and Harvard	BRD-K84935712			OC[C@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20+,21-/m1/s1	QYROUQDLUMQXKE-HLAWJBBLSA-N	487.190769618							102264
BRD-K85079232	LSM-13626		54638742	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19-,20-/m1/s1	CXBDXCVDLXJCMX-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K85079232	BRD-K85079232-001-01-5	Broad Institute of MIT and Harvard	BRD-K85079232			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19-,20-/m1/s1	CXBDXCVDLXJCMX-VAMGGRTRSA-N	501.168697278							102273
BRD-K22070096	LSM-9764		54638617	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18-,19+/m0/s1	JHFKDWZHMFMOKL-GBESFXJTSA-N	OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K22070096	BRD-K22070096-001-01-5	Broad Institute of MIT and Harvard	BRD-K22070096			OC[C@H]1O[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18-,19+/m0/s1	JHFKDWZHMFMOKL-GBESFXJTSA-N	466.18278992							98385
BRD-K36708799	LSM-10649		54638832	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16+,18-/m1/s1	LFPPDYCBOCBVHR-SOLBZPMBSA-N	COc1ccccc1S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)N3CCCCC3)O[C@@H]2CO	BroadT	BRD-K36708799	BRD-K36708799-001-01-4	Broad Institute of MIT and Harvard	BRD-K36708799			COc1ccccc1S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16+,18-/m1/s1	LFPPDYCBOCBVHR-SOLBZPMBSA-N	424.166807326							99270
BRD-K02240493	LSM-8571		54638607	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20-,22-/m0/s1	AGCDJJGGWAFKHW-VCOUNFBDSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)c4cccnc4)O[C@H]2CO	BroadT	BRD-K02240493	BRD-K02240493-001-01-7	Broad Institute of MIT and Harvard	BRD-K02240493			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)-c2cccnc2)O[C@H]1CO	InChI=1S/C22H27N5O4S/c1-16-4-7-19(8-5-16)32(29,30)25-20-9-6-18(31-22(20)15-28)10-12-27-14-21(24-26-27)17-3-2-11-23-13-17/h2-5,7-8,11,13-14,18,20,22,25,28H,6,9-10,12,15H2,1H3/t18-,20-,22-/m0/s1	AGCDJJGGWAFKHW-VCOUNFBDSA-N	457.178375084							97192
BRD-K89299922	LSM-13925		54638709	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14+,15-/m0/s1	UCAVQNBXNWPRQF-ZNMIVQPWSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K89299922	BRD-K89299922-001-01-0	Broad Institute of MIT and Harvard	BRD-K89299922			OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14+,15-/m0/s1	UCAVQNBXNWPRQF-ZNMIVQPWSA-N	391.100204976							102578
BRD-K81559336	LSM-13407		54638751	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20-,21-/m0/s1	QYROUQDLUMQXKE-JBACZVJFSA-N	OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c3cccc(Cl)c3	BroadT	BRD-K81559336	BRD-K81559336-001-01-5	Broad Institute of MIT and Harvard	BRD-K81559336			OC[C@@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20-,21-/m0/s1	QYROUQDLUMQXKE-JBACZVJFSA-N	487.190769618							102047
BRD-K52887203	LSM-11655		54638651	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18+,19-/m1/s1	LPRUTVLBIHKZIS-CEXWTWQISA-N	COc1cccc(NC(=O)N[C@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@@H]2CO)c1	BroadT	BRD-K52887203	BRD-K52887203-001-01-5	Broad Institute of MIT and Harvard	BRD-K52887203			COc1cccc(NC(=O)N[C@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@@H]2CO)c1	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18+,19-/m1/s1	LPRUTVLBIHKZIS-CEXWTWQISA-N	405.226371122							100280
BRD-K48515753-001-01-3	LSM-11380	BRD-K48515753	54638612	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18+,19+/m1/s1	JHFKDWZHMFMOKL-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K48515753	BRD-K48515753-001-01-3	Broad Institute of MIT and Harvard	BRD-K48515753			OC[C@@H]1O[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18+,19+/m1/s1	JHFKDWZHMFMOKL-QYZOEREBSA-N	466.18278992							100001
BRD-K61255273	LSM-12137		54638590	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18-,19-/m0/s1	VZTWMEPVNSFWIB-WDSOQIARSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K61255273	BRD-K61255273-001-01-9	Broad Institute of MIT and Harvard	BRD-K61255273			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18-,19-/m0/s1	VZTWMEPVNSFWIB-WDSOQIARSA-N	426.162470874							100763
BRD-K07493900	LSM-8873		54638646	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18+,19+/m1/s1	LPRUTVLBIHKZIS-QYZOEREBSA-N	COc1cccc(NC(=O)N[C@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@H]2CO)c1	BroadT	BRD-K07493900	BRD-K07493900-001-01-4	Broad Institute of MIT and Harvard	BRD-K07493900			COc1cccc(NC(=O)N[C@H]2CC[C@H](CC(=O)N3CCCCC3)O[C@H]2CO)c1	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18+,19+/m1/s1	LPRUTVLBIHKZIS-QYZOEREBSA-N	405.226371122							97494
BRD-K48703433	LSM-11394		54638810	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15+,16+/m0/s1	XHJSWNOOJCOHJI-ARFHVFGLSA-N	COCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccc(Cl)cc2)O[C@@H]1CO	BroadT	BRD-K48703433	BRD-K48703433-001-01-3	Broad Institute of MIT and Harvard	BRD-K48703433			COCC(=O)N[C@@H]1C=C[C@H](O[C@@H]1CO)CC(=O)NCc1ccc(Cl)cc1	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15+,16+/m0/s1	XHJSWNOOJCOHJI-ARFHVFGLSA-N	382.129549566							100015
BRD-K07563916	LSM-8878		54638833	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16+,18-/m0/s1	LFPPDYCBOCBVHR-JZXOWHBKSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)N3CCCCC3)O[C@H]2CO	BroadT	BRD-K07563916	BRD-K07563916-001-01-6	Broad Institute of MIT and Harvard	BRD-K07563916			COc1ccccc1S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16+,18-/m0/s1	LFPPDYCBOCBVHR-JZXOWHBKSA-N	424.166807326							97499
BRD-K10657952	LSM-9069		54638749	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20-,21-/m1/s1	QYROUQDLUMQXKE-HMXCVIKNSA-N	OC[C@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NS(=O)(=O)c3cccc(Cl)c3	BroadT	BRD-K10657952	BRD-K10657952-001-01-6	Broad Institute of MIT and Harvard	BRD-K10657952			OC[C@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20-,21-/m1/s1	QYROUQDLUMQXKE-HMXCVIKNSA-N	487.190769618							97690
BRD-K74192638	LSM-12970		54638673	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17-,18-/m1/s1	CZXCLXHYAUMTPI-KZNAEPCWSA-N	OC[C@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)C3CCC3	BroadT	BRD-K74192638	BRD-K74192638-001-01-9	Broad Institute of MIT and Harvard	BRD-K74192638			OC[C@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)C1CCC1	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17-,18-/m1/s1	CZXCLXHYAUMTPI-KZNAEPCWSA-N	375.215806438							101607
BRD-K43714262	LSM-11094		54638729	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13-,14+/m0/s1	WYRQMVCVXSYSKJ-MELADBBJSA-N	CN(C)C(=O)C[C@@H]1CC[C@H](NC(=O)C2CCOCC2)[C@@H](CO)O1	BroadT	BRD-K43714262	BRD-K43714262-001-01-1	Broad Institute of MIT and Harvard	BRD-K43714262			CN(C)C(=O)C[C@@H]1CC[C@H](NC(=O)C2CCOCC2)[C@@H](CO)O1	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13-,14+/m0/s1	WYRQMVCVXSYSKJ-MELADBBJSA-N	328.199822016							99715
BRD-K11266478	LSM-9115		54638838	InChI=1S/C19H30N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h7,11,14-16,24H,1-6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16-/m1/s1	IZCYNDJXNVTGPG-OWCLPIDISA-N	OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K11266478	BRD-K11266478-001-01-0	Broad Institute of MIT and Harvard	BRD-K11266478			OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C19H30N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h7,11,14-16,24H,1-6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16-/m1/s1	IZCYNDJXNVTGPG-OWCLPIDISA-N	410.19877617							97736
BRD-K75467206	LSM-13048		54638649	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18-,19+/m0/s1	LPRUTVLBIHKZIS-GBESFXJTSA-N	COc1cccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@@H]2CO)c1	BroadT	BRD-K75467206	BRD-K75467206-001-01-6	Broad Institute of MIT and Harvard	BRD-K75467206			COc1cccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@@H]2CO)c1	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18-,19+/m0/s1	LPRUTVLBIHKZIS-GBESFXJTSA-N	405.226371122							101685
BRD-K36149190	LSM-10610		54638720	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22-,24-/m1/s1	CTEVGNUGMCZMIF-CQOQZXRMSA-N	COc1ccc(cc1)c2cn(CC[C@H]3CC[C@@H](NC(=O)CCN4CCCCC4)[C@@H](CO)O3)nn2	BroadT	BRD-K36149190	BRD-K36149190-001-01-6	Broad Institute of MIT and Harvard	BRD-K36149190			COc1ccc(cc1)-c1cn(CC[C@H]2CC[C@@H](NC(=O)CCN3CCCCC3)[C@@H](CO)O2)nn1	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22-,24-/m1/s1	CTEVGNUGMCZMIF-CQOQZXRMSA-N	471.284554714							99231
BRD-K73639776	LSM-12940		54638563	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17+,19+/m1/s1	BSYBIQMXMHXRRQ-AOIWGVFYSA-N	CCCNC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)c3cccc(F)c3)O[C@H]1CO	BroadT	BRD-K73639776	BRD-K73639776-001-01-2	Broad Institute of MIT and Harvard	BRD-K73639776			CCCNC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)-c2cccc(F)c2)O[C@H]1CO	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17+,19+/m1/s1	BSYBIQMXMHXRRQ-AOIWGVFYSA-N	405.217618006							101577
BRD-K53507509	LSM-11690		54638762	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22+,23+/m0/s1	URVFCIGKBRHLNA-MDNUFGMLSA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@@H](CO)O1	BroadT	BRD-K53507509	BRD-K53507509-001-01-9	Broad Institute of MIT and Harvard	BRD-K53507509			CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@@H](CO)O1	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22+,23+/m0/s1	URVFCIGKBRHLNA-MDNUFGMLSA-N	491.209006496							100315
BRD-K59247792	LSM-12007		54638621	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17-,18-/m1/s1	ZHYLMLAAZLDJNG-ZTFGCOKTSA-N	CN1CCN(CC1)C(=O)C[C@@H]2O[C@H](CO)[C@H](NC(=O)Nc3ccccc3F)C=C2	BroadT	BRD-K59247792	BRD-K59247792-001-01-2	Broad Institute of MIT and Harvard	BRD-K59247792			CN1CCN(CC1)C(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Nc2ccccc2F)C=C1	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17-,18-/m1/s1	ZHYLMLAAZLDJNG-ZTFGCOKTSA-N	406.201633584							100633
BRD-K22643403	LSM-9802		54638619	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17+,18+/m0/s1	ZHYLMLAAZLDJNG-BMGDILEWSA-N	CN1CCN(CC1)C(=O)C[C@H]2O[C@H](CO)[C@H](NC(=O)Nc3ccccc3F)C=C2	BroadT	BRD-K22643403	BRD-K22643403-001-01-7	Broad Institute of MIT and Harvard	BRD-K22643403			CN1CCN(CC1)C(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)Nc2ccccc2F)C=C1	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17+,18+/m0/s1	ZHYLMLAAZLDJNG-BMGDILEWSA-N	406.201633584							98423
BRD-K80213755	LSM-13329		54638843	InChI=1S/C24H25FN4O5/c25-18-4-2-1-3-17(18)20-12-29(28-27-20)10-9-16-6-7-19(23(13-30)34-16)26-24(31)15-5-8-21-22(11-15)33-14-32-21/h1-5,8,11-12,16,19,23,30H,6-7,9-10,13-14H2,(H,26,31)/t16-,19-,23-/m0/s1	RQZDEGSLOUOYBH-NVVBAYIOSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3ccccc3F)CC[C@@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K80213755	BRD-K80213755-001-01-2	Broad Institute of MIT and Harvard	BRD-K80213755			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2ccccc2F)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C24H25FN4O5/c25-18-4-2-1-3-17(18)20-12-29(28-27-20)10-9-16-6-7-19(23(13-30)34-16)26-24(31)15-5-8-21-22(11-15)33-14-32-21/h1-5,8,11-12,16,19,23,30H,6-7,9-10,13-14H2,(H,26,31)/t16-,19-,23-/m0/s1	RQZDEGSLOUOYBH-NVVBAYIOSA-N	468.18089814							101968
BRD-K08005469	LSM-8911		54638726	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13+,14+/m1/s1	WYRQMVCVXSYSKJ-RDBSUJKOSA-N	CN(C)C(=O)C[C@H]1CC[C@H](NC(=O)C2CCOCC2)[C@H](CO)O1	BroadT	BRD-K08005469	BRD-K08005469-001-01-8	Broad Institute of MIT and Harvard	BRD-K08005469			CN(C)C(=O)C[C@H]1CC[C@H](NC(=O)C2CCOCC2)[C@H](CO)O1	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13+,14+/m1/s1	WYRQMVCVXSYSKJ-RDBSUJKOSA-N	328.199822016							97532
BRD-K27927067	LSM-10117		54638692	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20+,22-/m1/s1	BOSRLBMZBBTOKS-KAGYGMCKSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K27927067	BRD-K27927067-001-01-6	Broad Institute of MIT and Harvard	BRD-K27927067			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C24H27F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-5,7,11,18,20,22,30H,6,8-10,12-14H2,(H2,27,28,32)/t18-,20+,22-/m1/s1	BOSRLBMZBBTOKS-KAGYGMCKSA-N	459.196962774							98738
BRD-K91498722	LSM-14049		54638732	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13+,14-/m0/s1	WYRQMVCVXSYSKJ-MJBXVCDLSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H](NC(=O)C2CCOCC2)[C@H](CO)O1	BroadT	BRD-K91498722	BRD-K91498722-001-01-6	Broad Institute of MIT and Harvard	BRD-K91498722			CN(C)C(=O)C[C@@H]1CC[C@@H](NC(=O)C2CCOCC2)[C@H](CO)O1	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13+,14-/m0/s1	WYRQMVCVXSYSKJ-MJBXVCDLSA-N	328.199822016							102702
BRD-K61428915	LSM-12151		54638564	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17-,19+/m1/s1	BSYBIQMXMHXRRQ-LMMKCTJWSA-N	CCCNC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)c3cccc(F)c3)O[C@H]1CO	BroadT	BRD-K61428915	BRD-K61428915-001-01-6	Broad Institute of MIT and Harvard	BRD-K61428915			CCCNC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)-c2cccc(F)c2)O[C@H]1CO	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17-,19+/m1/s1	BSYBIQMXMHXRRQ-LMMKCTJWSA-N	405.217618006							100777
BRD-K40591230	LSM-10907		54638665	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19-,20+/m1/s1	PGYGWAGYUXBZHY-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CCCCC2)C=C[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K40591230	BRD-K40591230-001-01-5	Broad Institute of MIT and Harvard	BRD-K40591230			OC[C@@H]1O[C@@H](CC(=O)NCC2CCCCC2)C=C[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19-,20+/m1/s1	PGYGWAGYUXBZHY-AQNXPRMDSA-N	419.22203467							99528
BRD-K79277758	LSM-13274		54638707	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15+/m1/s1	UCAVQNBXNWPRQF-KFWWJZLASA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K79277758	BRD-K79277758-001-01-7	Broad Institute of MIT and Harvard	BRD-K79277758			OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15+/m1/s1	UCAVQNBXNWPRQF-KFWWJZLASA-N	391.100204976							101913
BRD-K88385750	LSM-13864		54638725	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13+,14+/m0/s1	WYRQMVCVXSYSKJ-BFHYXJOUSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H](NC(=O)C2CCOCC2)[C@@H](CO)O1	BroadT	BRD-K88385750	BRD-K88385750-001-01-5	Broad Institute of MIT and Harvard	BRD-K88385750			CN(C)C(=O)C[C@@H]1CC[C@@H](NC(=O)C2CCOCC2)[C@@H](CO)O1	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13+,14+/m0/s1	WYRQMVCVXSYSKJ-BFHYXJOUSA-N	328.199822016							102515
BRD-K88973556	LSM-13902		54638648	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18-,19-/m0/s1	LPRUTVLBIHKZIS-FHWLQOOXSA-N	COc1cccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@H]2CO)c1	BroadT	BRD-K88973556	BRD-K88973556-001-01-4	Broad Institute of MIT and Harvard	BRD-K88973556			COc1cccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)N3CCCCC3)O[C@H]2CO)c1	InChI=1S/C21H31N3O5/c1-28-16-7-5-6-15(12-16)22-21(27)23-18-9-8-17(29-19(18)14-25)13-20(26)24-10-3-2-4-11-24/h5-7,12,17-19,25H,2-4,8-11,13-14H2,1H3,(H2,22,23,27)/t17-,18-,19-/m0/s1	LPRUTVLBIHKZIS-FHWLQOOXSA-N	405.226371122							102555
BRD-K62372763	LSM-12218		54638634	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14-,16-/m1/s1	TWVDNKQJDYICCW-IIAWOOMASA-N	CC(C)c1cn(CC[C@H]2CC[C@@H](NC(=O)C3CC3)[C@@H](CO)O2)nn1	BroadT	BRD-K62372763	BRD-K62372763-001-01-8	Broad Institute of MIT and Harvard	BRD-K62372763			CC(C)c1cn(CC[C@H]2CC[C@@H](NC(=O)C3CC3)[C@@H](CO)O2)nn1	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14-,16-/m1/s1	TWVDNKQJDYICCW-IIAWOOMASA-N	336.216140796							100844
BRD-K07748118	LSM-8895		54638674	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17-,18-/m0/s1	CZXCLXHYAUMTPI-BZSNNMDCSA-N	OC[C@@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K07748118	BRD-K07748118-001-01-9	Broad Institute of MIT and Harvard	BRD-K07748118			OC[C@@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)C1CCC1	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17-,18-/m0/s1	CZXCLXHYAUMTPI-BZSNNMDCSA-N	375.215806438							97516
BRD-K08920503	LSM-8964		54638780	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18-,19-/m1/s1	XLYDKAUYLYXOHP-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccccc2)C=C[C@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K08920503	BRD-K08920503-001-01-6	Broad Institute of MIT and Harvard	BRD-K08920503			OC[C@H]1O[C@H](C=C[C@H]1NC(=O)Cc1cccnc1)CC(=O)Nc1ccccc1	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18-,19-/m1/s1	XLYDKAUYLYXOHP-GUDVDZBRSA-N	381.168856246							97585
BRD-K85802361	LSM-13686		54638721	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22-,24-/m0/s1	CTEVGNUGMCZMIF-FIXSFTCYSA-N	COc1ccc(cc1)c2cn(CC[C@@H]3CC[C@H](NC(=O)CCN4CCCCC4)[C@H](CO)O3)nn2	BroadT	BRD-K85802361	BRD-K85802361-001-01-3	Broad Institute of MIT and Harvard	BRD-K85802361			COc1ccc(cc1)-c1cn(CC[C@@H]2CC[C@H](NC(=O)CCN3CCCCC3)[C@H](CO)O2)nn1	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22-,24-/m0/s1	CTEVGNUGMCZMIF-FIXSFTCYSA-N	471.284554714							102334
BRD-K67661368	LSM-12547		54638769	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22+,23-/m0/s1	URVFCIGKBRHLNA-WWNPGLIZSA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@H](CO)O1	BroadT	BRD-K67661368	BRD-K67661368-001-01-8	Broad Institute of MIT and Harvard	BRD-K67661368			CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@H](CO)O1	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22+,23-/m0/s1	URVFCIGKBRHLNA-WWNPGLIZSA-N	491.209006496							101178
BRD-K02241254	LSM-8572		54638566	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17-,19-/m0/s1	BSYBIQMXMHXRRQ-LNLFQRSKSA-N	CCCNC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)c3cccc(F)c3)O[C@H]1CO	BroadT	BRD-K02241254	BRD-K02241254-001-01-4	Broad Institute of MIT and Harvard	BRD-K02241254			CCCNC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)-c2cccc(F)c2)O[C@H]1CO	InChI=1S/C20H28FN5O3/c1-2-9-22-20(28)23-17-7-6-16(29-19(17)13-27)8-10-26-12-18(24-25-26)14-4-3-5-15(21)11-14/h3-5,11-12,16-17,19,27H,2,6-10,13H2,1H3,(H2,22,23,28)/t16-,17-,19-/m0/s1	BSYBIQMXMHXRRQ-LNLFQRSKSA-N	405.217618006							97193
BRD-K31931379	LSM-10366		54638799	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18-,19-/m0/s1	VPHPWASIVZFRRJ-WDSOQIARSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]2CC[C@H](NC(=O)CC3CC3)[C@H](CO)O2	BroadT	BRD-K31931379	BRD-K31931379-001-01-5	Broad Institute of MIT and Harvard	BRD-K31931379			Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]1CC[C@H](NC(=O)CC2CC2)[C@H](CO)O1	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18-,19-/m0/s1	VPHPWASIVZFRRJ-WDSOQIARSA-N	410.18754277							98987
BRD-K44806584	LSM-11156		54638667	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19+,20-/m0/s1	PGYGWAGYUXBZHY-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CCCCC2)C=C[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K44806584	BRD-K44806584-001-01-5	Broad Institute of MIT and Harvard	BRD-K44806584			OC[C@@H]1O[C@H](CC(=O)NCC2CCCCC2)C=C[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19+,20-/m0/s1	PGYGWAGYUXBZHY-ZCNNSNEGSA-N	419.22203467							99777
BRD-K85644737	LSM-13666		54638734	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12+,13+/m1/s1	QPJNNDOFKLWHFX-ICCXJUOJSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C=C[C@@H]1NC(=O)c2ccccc2F	BroadT	BRD-K85644737	BRD-K85644737-001-01-6	Broad Institute of MIT and Harvard	BRD-K85644737			OC[C@@H]1O[C@@H](CC(O)=O)C=C[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12+,13+/m1/s1	QPJNNDOFKLWHFX-ICCXJUOJSA-N	309.101250822							102313
BRD-K75996234	LSM-13077		54638736	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12-,13+/m0/s1	QPJNNDOFKLWHFX-TVYUQYBPSA-N	OC[C@H]1O[C@H](CC(=O)O)C=C[C@@H]1NC(=O)c2ccccc2F	BroadT	BRD-K75996234	BRD-K75996234-001-01-0	Broad Institute of MIT and Harvard	BRD-K75996234			OC[C@H]1O[C@H](CC(O)=O)C=C[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12-,13+/m0/s1	QPJNNDOFKLWHFX-TVYUQYBPSA-N	309.101250822							101715
BRD-K22886798	LSM-9819		54638680	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18+/m0/s1	UYZCTKNUILRIOW-OKZBNKHCSA-N	CCCNC(=O)N[C@H]1C=C[C@@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	BroadT	BRD-K22886798	BRD-K22886798-001-01-5	Broad Institute of MIT and Harvard	BRD-K22886798			CCCNC(=O)N[C@H]1C=C[C@@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18+/m0/s1	UYZCTKNUILRIOW-OKZBNKHCSA-N	375.215806438							98440
BRD-K23958338	LSM-9875		54638728	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13-,14-/m0/s1	WYRQMVCVXSYSKJ-IHRRRGAJSA-N	CN(C)C(=O)C[C@@H]1CC[C@H](NC(=O)C2CCOCC2)[C@H](CO)O1	BroadT	BRD-K23958338	BRD-K23958338-001-01-8	Broad Institute of MIT and Harvard	BRD-K23958338			CN(C)C(=O)C[C@@H]1CC[C@H](NC(=O)C2CCOCC2)[C@H](CO)O1	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13-,14-/m0/s1	WYRQMVCVXSYSKJ-IHRRRGAJSA-N	328.199822016							98496
BRD-K19213530	LSM-9584		54638705	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15-/m0/s1	UCAVQNBXNWPRQF-KKUMJFAQSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K19213530	BRD-K19213530-001-01-0	Broad Institute of MIT and Harvard	BRD-K19213530			OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C18H18FN3O4S/c19-12-3-1-2-11(8-12)17(25)21-14-5-4-13(26-15(14)10-23)9-16(24)22-18-20-6-7-27-18/h1-8,13-15,23H,9-10H2,(H,21,25)(H,20,22,24)/t13-,14-,15-/m0/s1	UCAVQNBXNWPRQF-KKUMJFAQSA-N	391.100204976							98205
BRD-K22275321	LSM-9777		54638727	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13-,14-/m1/s1	WYRQMVCVXSYSKJ-MGPQQGTHSA-N	CN(C)C(=O)C[C@H]1CC[C@@H](NC(=O)C2CCOCC2)[C@@H](CO)O1	BroadT	BRD-K22275321	BRD-K22275321-001-01-7	Broad Institute of MIT and Harvard	BRD-K22275321			CN(C)C(=O)C[C@H]1CC[C@@H](NC(=O)C2CCOCC2)[C@@H](CO)O1	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13-,14-/m1/s1	WYRQMVCVXSYSKJ-MGPQQGTHSA-N	328.199822016							98398
BRD-K33368320	LSM-10454		54638644	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19+,20-/m0/s1	LRDWIZFOJOHHOT-BEVDRBHNSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K33368320	BRD-K33368320-001-01-8	Broad Institute of MIT and Harvard	BRD-K33368320			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19+,20-/m0/s1	LRDWIZFOJOHHOT-BEVDRBHNSA-N	484.062647934							99075
BRD-K42182933	LSM-10990		54638670	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17-,18+/m0/s1	CZXCLXHYAUMTPI-OKZBNKHCSA-N	OC[C@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K42182933	BRD-K42182933-001-01-1	Broad Institute of MIT and Harvard	BRD-K42182933			OC[C@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)C1CCC1	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17-,18+/m0/s1	CZXCLXHYAUMTPI-OKZBNKHCSA-N	375.215806438							99611
BRD-K86938339	LSM-13760		54638537	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18+,19-/m1/s1	QCIRQJIZWMFOON-CEXWTWQISA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C=C[C@@H]1NC(=O)C4CC4	BroadT	BRD-K86938339	BRD-K86938339-001-01-3	Broad Institute of MIT and Harvard	BRD-K86938339			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18+,19-/m1/s1	QCIRQJIZWMFOON-CEXWTWQISA-N	370.189257332							102409
BRD-K16974571	LSM-9457		54638717	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22+,24+/m0/s1	CTEVGNUGMCZMIF-WMTXJRDZSA-N	COc1ccc(cc1)c2cn(CC[C@@H]3CC[C@@H](NC(=O)CCN4CCCCC4)[C@@H](CO)O3)nn2	BroadT	BRD-K16974571	BRD-K16974571-001-01-0	Broad Institute of MIT and Harvard	BRD-K16974571			COc1ccc(cc1)-c1cn(CC[C@@H]2CC[C@@H](NC(=O)CCN3CCCCC3)[C@@H](CO)O2)nn1	InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22+,24+/m0/s1	CTEVGNUGMCZMIF-WMTXJRDZSA-N	471.284554714							98078
BRD-K68201904	LSM-12586		54638801	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18+,19-/m0/s1	VPHPWASIVZFRRJ-UHOSZYNNSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]2CC[C@@H](NC(=O)CC3CC3)[C@H](CO)O2	BroadT	BRD-K68201904	BRD-K68201904-001-01-3	Broad Institute of MIT and Harvard	BRD-K68201904			Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)CC2CC2)[C@H](CO)O1	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18+,19-/m0/s1	VPHPWASIVZFRRJ-UHOSZYNNSA-N	410.18754277							101217
BRD-K10562742	LSM-9063		54638581	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18-,19-/m1/s1	BBKVVMQWFBDXMC-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K10562742	BRD-K10562742-001-01-3	Broad Institute of MIT and Harvard	BRD-K10562742			OC[C@H]1O[C@@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18-,19-/m1/s1	BBKVVMQWFBDXMC-GUDVDZBRSA-N	458.137527436							97684
BRD-K02897131	LSM-8615		54638642	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19-,20+/m1/s1	LRDWIZFOJOHHOT-YSGRDPCXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K02897131	BRD-K02897131-001-01-2	Broad Institute of MIT and Harvard	BRD-K02897131			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19-,20+/m1/s1	LRDWIZFOJOHHOT-YSGRDPCXSA-N	484.062647934							97236
BRD-K33537450	LSM-10461		54638570	InChI=1S/C15H28N2O5S/c1-2-23(20,21)16-13-7-6-12(22-14(13)11-18)10-15(19)17-8-4-3-5-9-17/h12-14,16,18H,2-11H2,1H3/t12-,13+,14+/m1/s1	RAGICHRDMJGUIX-RDBSUJKOSA-N	CCS(=O)(=O)N[C@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K33537450	BRD-K33537450-001-01-0	Broad Institute of MIT and Harvard	BRD-K33537450			CCS(=O)(=O)N[C@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C15H28N2O5S/c1-2-23(20,21)16-13-7-6-12(22-14(13)11-18)10-15(19)17-8-4-3-5-9-17/h12-14,16,18H,2-11H2,1H3/t12-,13+,14+/m1/s1	RAGICHRDMJGUIX-RDBSUJKOSA-N	348.171892706							99082
BRD-K62220055	LSM-12208		54638804	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18-,19+/m0/s1	NKPFHNDONDWVBL-GBESFXJTSA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@H](NC(=O)Cc3cccnc3)[C@@H](CO)O2)nn1	BroadT	BRD-K62220055	BRD-K62220055-001-01-6	Broad Institute of MIT and Harvard	BRD-K62220055			CN(C)Cc1cn(CC[C@@H]2CC[C@H](NC(=O)Cc3cccnc3)[C@@H](CO)O2)nn1	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18-,19+/m0/s1	NKPFHNDONDWVBL-GBESFXJTSA-N	402.23793888							100834
MLS003649973	LSM-13110	BRD-K76527818	53382636	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19+,20+/m0/s1	PGYGWAGYUXBZHY-XUVXKRRUSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CCCCC2)C=C[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K76527818	BRD-K76527818-001-01-6	Broad Institute of MIT and Harvard	BRD-K76527818			OC[C@H]1O[C@H](CC(=O)NCC2CCCCC2)C=C[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19+,20+/m0/s1	PGYGWAGYUXBZHY-XUVXKRRUSA-N	419.22203467							101748
BRD-K44338067	LSM-11130		54638535	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18-,19+/m0/s1	QCIRQJIZWMFOON-GBESFXJTSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C=C[C@@H]1NC(=O)C4CC4	BroadT	BRD-K44338067	BRD-K44338067-001-01-5	Broad Institute of MIT and Harvard	BRD-K44338067			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18-,19+/m0/s1	QCIRQJIZWMFOON-GBESFXJTSA-N	370.189257332							99751
BRD-K46206861	LSM-11245		54638676	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18+/m0/s1	UYZCTKNUILRIOW-RCCFBDPRSA-N	CCCNC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	BroadT	BRD-K46206861	BRD-K46206861-001-01-0	Broad Institute of MIT and Harvard	BRD-K46206861			CCCNC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCc2ccccc2)O[C@@H]1CO	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18+/m0/s1	UYZCTKNUILRIOW-RCCFBDPRSA-N	375.215806438							99866
BRD-K47569804-001-01-0	LSM-11326	BRD-K47569804	54638616	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18-,19-/m0/s1	JHFKDWZHMFMOKL-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K47569804	BRD-K47569804-001-01-0	Broad Institute of MIT and Harvard	BRD-K47569804			OC[C@@H]1O[C@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18-,19-/m0/s1	JHFKDWZHMFMOKL-FHWLQOOXSA-N	466.18278992							99947
BRD-K13012607	LSM-9207		54638739	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12+,13-/m0/s1	QPJNNDOFKLWHFX-BIMULSAOSA-N	OC[C@@H]1O[C@H](CC(=O)O)C=C[C@H]1NC(=O)c2ccccc2F	BroadT	BRD-K13012607	BRD-K13012607-001-01-0	Broad Institute of MIT and Harvard	BRD-K13012607			OC[C@@H]1O[C@H](CC(O)=O)C=C[C@H]1NC(=O)c1ccccc1F	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12+,13-/m0/s1	QPJNNDOFKLWHFX-BIMULSAOSA-N	309.101250822							97828
BRD-K78584123	LSM-13231		54638668	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17+,18+/m0/s1	CZXCLXHYAUMTPI-RCCFBDPRSA-N	OC[C@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)C3CCC3	BroadT	BRD-K78584123	BRD-K78584123-001-01-5	Broad Institute of MIT and Harvard	BRD-K78584123			OC[C@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)C1CCC1	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17+,18+/m0/s1	CZXCLXHYAUMTPI-RCCFBDPRSA-N	375.215806438							101870
BRD-K96950016-001-01-6	LSM-33351	BRD-K96950016	54638533	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18+,19+/m1/s1	QCIRQJIZWMFOON-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C=C[C@@H]1NC(=O)C4CC4	BroadT	BRD-K96950016	BRD-K96950016-001-01-6	Broad Institute of MIT and Harvard	BRD-K96950016			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C21H26N2O4/c24-13-19-18(22-21(26)15-5-6-15)8-7-17(27-19)11-20(25)23-10-9-14-3-1-2-4-16(14)12-23/h1-4,7-8,15,17-19,24H,5-6,9-13H2,(H,22,26)/t17-,18+,19+/m1/s1	QCIRQJIZWMFOON-QYZOEREBSA-N	370.189257332							121908
BRD-K36747900	LSM-10653		54638598	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17-,19+/m1/s1	LUVVHBIYDBULDN-SUMDDJOVSA-N	Cc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CCNC(=O)c3cnccn3)O[C@H]2CO	BroadT	BRD-K36747900	BRD-K36747900-001-01-8	Broad Institute of MIT and Harvard	BRD-K36747900			Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CCNC(=O)c2cnccn2)O[C@H]1CO	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17-,19+/m1/s1	LUVVHBIYDBULDN-SUMDDJOVSA-N	434.162390662							99274
BRD-K22291343	LSM-9778		54638630	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14+,16+/m0/s1	TWVDNKQJDYICCW-SQWLQELKSA-N	CC(C)c1cn(CC[C@@H]2CC[C@@H](NC(=O)C3CC3)[C@@H](CO)O2)nn1	BroadT	BRD-K22291343	BRD-K22291343-001-01-8	Broad Institute of MIT and Harvard	BRD-K22291343			CC(C)c1cn(CC[C@@H]2CC[C@@H](NC(=O)C3CC3)[C@@H](CO)O2)nn1	InChI=1S/C17H28N4O3/c1-11(2)15-9-21(20-19-15)8-7-13-5-6-14(16(10-22)24-13)18-17(23)12-3-4-12/h9,11-14,16,22H,3-8,10H2,1-2H3,(H,18,23)/t13-,14+,16+/m0/s1	TWVDNKQJDYICCW-SQWLQELKSA-N	336.216140796							98399
BRD-K38188442	LSM-10742		54638785	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18+,19-/m0/s1	XLYDKAUYLYXOHP-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccccc2)C=C[C@H]1NC(=O)Cc3cccnc3	BroadT	BRD-K38188442	BRD-K38188442-001-01-8	Broad Institute of MIT and Harvard	BRD-K38188442			OC[C@@H]1O[C@@H](C=C[C@H]1NC(=O)Cc1cccnc1)CC(=O)Nc1ccccc1	InChI=1S/C21H23N3O4/c25-14-19-18(24-20(26)11-15-5-4-10-22-13-15)9-8-17(28-19)12-21(27)23-16-6-2-1-3-7-16/h1-10,13,17-19,25H,11-12,14H2,(H,23,27)(H,24,26)/t17-,18+,19-/m0/s1	XLYDKAUYLYXOHP-OTWHNJEPSA-N	381.168856246							99363
BRD-K13626437	LSM-9247		54638577	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14-,15+/m0/s1	FUQFZQORNFVFMN-TUKIKUTGSA-N	COc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CCN)O[C@@H]2CO	BroadT	BRD-K13626437	BRD-K13626437-001-01-3	Broad Institute of MIT and Harvard	BRD-K13626437			COc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CCN)O[C@@H]1CO	InChI=1S/C15H24N2O5S/c1-21-12-3-2-4-13(9-12)23(19,20)17-14-6-5-11(7-8-16)22-15(14)10-18/h2-4,9,11,14-15,17-18H,5-8,10,16H2,1H3/t11-,14-,15+/m0/s1	FUQFZQORNFVFMN-TUKIKUTGSA-N	344.140592578							97868
BRD-K22664171	LSM-9804		54638711	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16+/m1/s1	BYMJCSXXYVSKMN-KBMXLJTQSA-N	CCC(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	BroadT	BRD-K22664171	BRD-K22664171-001-01-3	Broad Institute of MIT and Harvard	BRD-K22664171			CCC(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16+/m1/s1	BYMJCSXXYVSKMN-KBMXLJTQSA-N	352.1798355							98425
BRD-K89321975	LSM-13927		54638731	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13+,14-/m1/s1	WYRQMVCVXSYSKJ-HZSPNIEDSA-N	CN(C)C(=O)C[C@H]1CC[C@H](NC(=O)C2CCOCC2)[C@@H](CO)O1	BroadT	BRD-K89321975	BRD-K89321975-001-01-8	Broad Institute of MIT and Harvard	BRD-K89321975			CN(C)C(=O)C[C@H]1CC[C@H](NC(=O)C2CCOCC2)[C@@H](CO)O1	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13+,14-/m1/s1	WYRQMVCVXSYSKJ-HZSPNIEDSA-N	328.199822016							102580
BRD-K62985789	LSM-12258		54638684	InChI=1S/C16H25N3O5S/c1-2-25(22,23)19-14-7-6-13(24-15(14)11-20)9-16(21)18-10-12-5-3-4-8-17-12/h3-5,8,13-15,19-20H,2,6-7,9-11H2,1H3,(H,18,21)/t13-,14+,15+/m0/s1	MEPVQKQIDHVRNZ-RRFJBIMHSA-N	CCS(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccccn2)O[C@@H]1CO	BroadT	BRD-K62985789	BRD-K62985789-001-01-7	Broad Institute of MIT and Harvard	BRD-K62985789			CCS(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccccn2)O[C@@H]1CO	InChI=1S/C16H25N3O5S/c1-2-25(22,23)19-14-7-6-13(24-15(14)11-20)9-16(21)18-10-12-5-3-4-8-17-12/h3-5,8,13-15,19-20H,2,6-7,9-11H2,1H3,(H,18,21)/t13-,14+,15+/m0/s1	MEPVQKQIDHVRNZ-RRFJBIMHSA-N	371.15149162							100884
BRD-K37344040	LSM-10684		54638643	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19+,20-/m1/s1	LRDWIZFOJOHHOT-UIAACRFSSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K37344040	BRD-K37344040-001-01-4	Broad Institute of MIT and Harvard	BRD-K37344040			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19+,20-/m1/s1	LRDWIZFOJOHHOT-UIAACRFSSA-N	484.062647934							99305
BRD-K45682001	LSM-11214		54638808	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18-,19-/m0/s1	NKPFHNDONDWVBL-FHWLQOOXSA-N	CN(C)Cc1cn(CC[C@@H]2CC[C@H](NC(=O)Cc3cccnc3)[C@H](CO)O2)nn1	BroadT	BRD-K45682001	BRD-K45682001-001-01-4	Broad Institute of MIT and Harvard	BRD-K45682001			CN(C)Cc1cn(CC[C@@H]2CC[C@H](NC(=O)Cc3cccnc3)[C@H](CO)O2)nn1	InChI=1S/C20H30N6O3/c1-25(2)12-16-13-26(24-23-16)9-7-17-5-6-18(19(14-27)29-17)22-20(28)10-15-4-3-8-21-11-15/h3-4,8,11,13,17-19,27H,5-7,9-10,12,14H2,1-2H3,(H,22,28)/t17-,18-,19-/m0/s1	NKPFHNDONDWVBL-FHWLQOOXSA-N	402.23793888							99835
BRD-K69197680	LSM-12648		54638697	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17-,18+/m1/s1	VZLRHERICGIZBB-KURKYZTESA-N	Cc1onc(C)c1NC(=O)NCC[C@H]2CC[C@@H](NC(=O)c3ccc(F)cc3)[C@H](CO)O2	BroadT	BRD-K69197680	BRD-K69197680-001-01-2	Broad Institute of MIT and Harvard	BRD-K69197680			Cc1noc(C)c1NC(=O)NCC[C@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17-,18+/m1/s1	VZLRHERICGIZBB-KURKYZTESA-N	434.196548204							101282
BRD-K92219497	LSM-14093		54638657	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18-,19+/m0/s1	QDYPPDFKKOAHDR-GBESFXJTSA-N	COc1cccc(CNC(=O)C[C@H]2O[C@H](CO)[C@@H](NC(=O)C3CCC3)C=C2)c1	BroadT	BRD-K92219497	BRD-K92219497-001-01-8	Broad Institute of MIT and Harvard	BRD-K92219497			COc1cccc(CNC(=O)C[C@H]2O[C@H](CO)[C@@H](NC(=O)C3CCC3)C=C2)c1	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18-,19+/m0/s1	QDYPPDFKKOAHDR-GBESFXJTSA-N	388.199822016							102747
BRD-K42478399	LSM-11003		54638741	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19+,20+/m0/s1	CXBDXCVDLXJCMX-XUVXKRRUSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@H]1NC(=O)Nc3ccc(cc3)C(F)(F)F	BroadT	BRD-K42478399	BRD-K42478399-001-01-0	Broad Institute of MIT and Harvard	BRD-K42478399			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)CC[C@H]1NC(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C23H24F5N3O4/c24-15-7-13(8-16(25)9-15)11-29-21(33)10-18-5-6-19(20(12-32)35-18)31-22(34)30-17-3-1-14(2-4-17)23(26,27)28/h1-4,7-9,18-20,32H,5-6,10-12H2,(H,29,33)(H2,30,31,34)/t18-,19+,20+/m0/s1	CXBDXCVDLXJCMX-XUVXKRRUSA-N	501.168697278							99624
BRD-K80821495	LSM-13372		54638602	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17+,19-/m0/s1	LUVVHBIYDBULDN-WDYCEAGBSA-N	Cc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CCNC(=O)c3cnccn3)O[C@H]2CO	BroadT	BRD-K80821495	BRD-K80821495-001-01-7	Broad Institute of MIT and Harvard	BRD-K80821495			Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNC(=O)c2cnccn2)O[C@H]1CO	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17+,19-/m0/s1	LUVVHBIYDBULDN-WDYCEAGBSA-N	434.162390662							102011
BRD-K43518940	LSM-11078		54638594	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18+,19-/m0/s1	VZTWMEPVNSFWIB-UHOSZYNNSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K43518940	BRD-K43518940-001-01-6	Broad Institute of MIT and Harvard	BRD-K43518940			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)C=C[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18+,19-/m0/s1	VZTWMEPVNSFWIB-UHOSZYNNSA-N	426.162470874							99699
BRD-K47018052	LSM-11296		54638752	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20-,21+/m0/s1	QYROUQDLUMQXKE-SESVDKBCSA-N	OC[C@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c3cccc(Cl)c3	BroadT	BRD-K47018052	BRD-K47018052-001-01-7	Broad Institute of MIT and Harvard	BRD-K47018052			OC[C@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20-,21+/m0/s1	QYROUQDLUMQXKE-SESVDKBCSA-N	487.190769618							99917
BRD-K61025685	LSM-12121		54638840	InChI=1S/C24H25FN4O5/c25-18-4-2-1-3-17(18)20-12-29(28-27-20)10-9-16-6-7-19(23(13-30)34-16)26-24(31)15-5-8-21-22(11-15)33-14-32-21/h1-5,8,11-12,16,19,23,30H,6-7,9-10,13-14H2,(H,26,31)/t16-,19+,23+/m0/s1	RQZDEGSLOUOYBH-XKDCRVNJSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3ccccc3F)CC[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K61025685	BRD-K61025685-001-01-8	Broad Institute of MIT and Harvard	BRD-K61025685			OC[C@H]1O[C@H](CCn2cc(nn2)-c2ccccc2F)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C24H25FN4O5/c25-18-4-2-1-3-17(18)20-12-29(28-27-20)10-9-16-6-7-19(23(13-30)34-16)26-24(31)15-5-8-21-22(11-15)33-14-32-21/h1-5,8,11-12,16,19,23,30H,6-7,9-10,13-14H2,(H,26,31)/t16-,19+,23+/m0/s1	RQZDEGSLOUOYBH-XKDCRVNJSA-N	468.18089814							100747
BRD-K23191900	LSM-9832		54638641	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19-,20+/m0/s1	LRDWIZFOJOHHOT-RYGJVYDSSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K23191900	BRD-K23191900-001-01-4	Broad Institute of MIT and Harvard	BRD-K23191900			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19-,20+/m0/s1	LRDWIZFOJOHHOT-RYGJVYDSSA-N	484.062647934							98453
BRD-K99944604	LSM-14571		54638654	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18+,19+/m1/s1	QDYPPDFKKOAHDR-QYZOEREBSA-N	COc1cccc(CNC(=O)C[C@@H]2O[C@@H](CO)[C@@H](NC(=O)C3CCC3)C=C2)c1	BroadT	BRD-K99944604	BRD-K99944604-001-01-4	Broad Institute of MIT and Harvard	BRD-K99944604			COc1cccc(CNC(=O)C[C@@H]2O[C@@H](CO)[C@@H](NC(=O)C3CCC3)C=C2)c1	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18+,19+/m1/s1	QDYPPDFKKOAHDR-QYZOEREBSA-N	388.199822016							103227
BRD-K63531989	LSM-12298		54638639	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19+,20+/m1/s1	LRDWIZFOJOHHOT-XPGWFJOJSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K63531989	BRD-K63531989-001-01-6	Broad Institute of MIT and Harvard	BRD-K63531989			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19+,20+/m1/s1	LRDWIZFOJOHHOT-XPGWFJOJSA-N	484.062647934							100925
BRD-K98980304	LSM-14504		54638701	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18-/m0/s1	VZLRHERICGIZBB-KSZLIROESA-N	Cc1onc(C)c1NC(=O)NCC[C@@H]2CC[C@@H](NC(=O)c3ccc(F)cc3)[C@H](CO)O2	BroadT	BRD-K98980304	BRD-K98980304-001-01-2	Broad Institute of MIT and Harvard	BRD-K98980304			Cc1noc(C)c1NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C21H27FN4O5/c1-12-19(13(2)31-26-12)25-21(29)23-10-9-16-7-8-17(18(11-27)30-16)24-20(28)14-3-5-15(22)6-4-14/h3-6,16-18,27H,7-11H2,1-2H3,(H,24,28)(H2,23,25,29)/t16-,17+,18-/m0/s1	VZLRHERICGIZBB-KSZLIROESA-N	434.196548204							103159
BRD-K10578850	LSM-9064		54638583	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18-,19-/m0/s1	BBKVVMQWFBDXMC-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K10578850	BRD-K10578850-001-01-7	Broad Institute of MIT and Harvard	BRD-K10578850			OC[C@@H]1O[C@H](CCNC(=O)c2cc(Cl)cc(Cl)c2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C21H28Cl2N2O5/c22-15-9-14(10-16(23)11-15)20(27)24-6-3-17-1-2-18(19(12-26)30-17)25-21(28)13-4-7-29-8-5-13/h9-11,13,17-19,26H,1-8,12H2,(H,24,27)(H,25,28)/t17-,18-,19-/m0/s1	BBKVVMQWFBDXMC-FHWLQOOXSA-N	458.137527436							97685
BRD-K85471465	LSM-13654		54638592	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18-,19+/m1/s1	VZTWMEPVNSFWIB-QRQLOZEOSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K85471465	BRD-K85471465-001-01-2	Broad Institute of MIT and Harvard	BRD-K85471465			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)C=C[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H27FN2O5S/c21-14-6-9-17(10-7-14)29(26,27)23-18-11-8-16(28-19(18)13-24)12-20(25)22-15-4-2-1-3-5-15/h6-11,15-16,18-19,23-24H,1-5,12-13H2,(H,22,25)/t16-,18-,19+/m1/s1	VZTWMEPVNSFWIB-QRQLOZEOSA-N	426.162470874							102301
BRD-K39241486	LSM-10810		54638658	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18-,19+/m1/s1	QDYPPDFKKOAHDR-QRVBRYPASA-N	COc1cccc(CNC(=O)C[C@@H]2O[C@@H](CO)[C@H](NC(=O)C3CCC3)C=C2)c1	BroadT	BRD-K39241486	BRD-K39241486-001-01-1	Broad Institute of MIT and Harvard	BRD-K39241486			COc1cccc(CNC(=O)C[C@@H]2O[C@@H](CO)[C@H](NC(=O)C3CCC3)C=C2)c1	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18-,19+/m1/s1	QDYPPDFKKOAHDR-QRVBRYPASA-N	388.199822016							99431
BRD-K75894982	LSM-13070		54638713	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16-/m0/s1	BYMJCSXXYVSKMN-BPUTZDHNSA-N	CCC(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	BroadT	BRD-K75894982	BRD-K75894982-001-01-1	Broad Institute of MIT and Harvard	BRD-K75894982			CCC(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16-/m0/s1	BYMJCSXXYVSKMN-BPUTZDHNSA-N	352.1798355							101707
BRD-K57277442	LSM-11899		54638836	InChI=1S/C19H30N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h7,11,14-16,24H,1-6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15-,16+/m0/s1	IZCYNDJXNVTGPG-HRCADAONSA-N	OC[C@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K57277442	BRD-K57277442-001-01-5	Broad Institute of MIT and Harvard	BRD-K57277442			OC[C@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C19H30N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h7,11,14-16,24H,1-6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15-,16+/m0/s1	IZCYNDJXNVTGPG-HRCADAONSA-N	410.19877617							100525
BRD-K29711801	LSM-10229		54638550	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19-,20-/m0/s1	FXPAFMKRDBMTQM-IHPCNDPISA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K29711801	BRD-K29711801-001-01-3	Broad Institute of MIT and Harvard	BRD-K29711801			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19-,20-/m0/s1	FXPAFMKRDBMTQM-IHPCNDPISA-N	485.11874753							98850
BRD-K14952621	LSM-9325		54638730	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13-,14+/m1/s1	WYRQMVCVXSYSKJ-MCIONIFRSA-N	CN(C)C(=O)C[C@H]1CC[C@@H](NC(=O)C2CCOCC2)[C@H](CO)O1	BroadT	BRD-K14952621	BRD-K14952621-001-01-8	Broad Institute of MIT and Harvard	BRD-K14952621			CN(C)C(=O)C[C@H]1CC[C@@H](NC(=O)C2CCOCC2)[C@H](CO)O1	InChI=1S/C16H28N2O5/c1-18(2)15(20)9-12-3-4-13(14(10-19)23-12)17-16(21)11-5-7-22-8-6-11/h11-14,19H,3-10H2,1-2H3,(H,17,21)/t12-,13-,14+/m1/s1	WYRQMVCVXSYSKJ-MCIONIFRSA-N	328.199822016							97946
BRD-K33130522	LSM-10445		54638596	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17+,19+/m1/s1	LUVVHBIYDBULDN-AYBZRNKSSA-N	Cc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@H](CCNC(=O)c3cnccn3)O[C@H]2CO	BroadT	BRD-K33130522	BRD-K33130522-001-01-8	Broad Institute of MIT and Harvard	BRD-K33130522			Cc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@H](CCNC(=O)c2cnccn2)O[C@H]1CO	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17+,19+/m1/s1	LUVVHBIYDBULDN-AYBZRNKSSA-N	434.162390662							99066
BRD-K24217589	LSM-14767		54638547	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19+,20+/m1/s1	FXPAFMKRDBMTQM-HOJAQTOUSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K24217589	BRD-K24217589-001-01-4	Broad Institute of MIT and Harvard	BRD-K24217589			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19+,20+/m1/s1	FXPAFMKRDBMTQM-HOJAQTOUSA-N	485.11874753							103423
BRD-K11868205	LSM-9146		54638638	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19+,20+/m0/s1	LRDWIZFOJOHHOT-CWFSZBLJSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NS(=O)(=O)c3ccccc3	BroadT	BRD-K11868205	BRD-K11868205-001-01-3	Broad Institute of MIT and Harvard	BRD-K11868205			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NS(=O)(=O)c1ccccc1	InChI=1S/C21H22Cl2N2O5S/c22-17-8-6-14(10-18(17)23)12-24-21(27)11-15-7-9-19(20(13-26)30-15)25-31(28,29)16-4-2-1-3-5-16/h1-10,15,19-20,25-26H,11-13H2,(H,24,27)/t15-,19+,20+/m0/s1	LRDWIZFOJOHHOT-CWFSZBLJSA-N	484.062647934							97767
BRD-K31028119	LSM-10300		54638834	InChI=1S/C19H30N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h7,11,14-16,24H,1-6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16+/m0/s1	IZCYNDJXNVTGPG-ARFHVFGLSA-N	OC[C@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K31028119	BRD-K31028119-001-01-5	Broad Institute of MIT and Harvard	BRD-K31028119			OC[C@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C19H30N4O4S/c24-13-16-15(21-17(25)6-10-23-8-2-1-3-9-23)5-4-14(27-16)12-18(26)22-19-20-7-11-28-19/h7,11,14-16,24H,1-6,8-10,12-13H2,(H,21,25)(H,20,22,26)/t14-,15+,16+/m0/s1	IZCYNDJXNVTGPG-ARFHVFGLSA-N	410.19877617							98921
BRD-K21855096	LSM-9754		54638828	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16-,18-/m1/s1	LFPPDYCBOCBVHR-JFIYKMOQSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)N3CCCCC3)O[C@@H]2CO	BroadT	BRD-K21855096	BRD-K21855096-001-01-0	Broad Institute of MIT and Harvard	BRD-K21855096			COc1ccccc1S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16-,18-/m1/s1	LFPPDYCBOCBVHR-JFIYKMOQSA-N	424.166807326							98375
BRD-K78830924	LSM-13241		54638818	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17+,18+/m0/s1	QFAVGRCFIOJHOR-RCCFBDPRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@H]1NC(=O)CC3CC3	BroadT	BRD-K78830924	BRD-K78830924-001-01-3	Broad Institute of MIT and Harvard	BRD-K78830924			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@H]1NC(=O)CC1CC1	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17+,18+/m0/s1	QFAVGRCFIOJHOR-RCCFBDPRSA-N	394.165935074							101880
BRD-K36026160	LSM-10598		54638557	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19-/m0/s1	ZEQYNXCYKJRRAG-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K36026160	BRD-K36026160-001-01-2	Broad Institute of MIT and Harvard	BRD-K36026160			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19-/m0/s1	ZEQYNXCYKJRRAG-FHWLQOOXSA-N	423.21694929							99219
BRD-K22719646	LSM-9809		54638623	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17-,18+/m0/s1	ZHYLMLAAZLDJNG-JCGIZDLHSA-N	CN1CCN(CC1)C(=O)C[C@H]2O[C@H](CO)[C@@H](NC(=O)Nc3ccccc3F)C=C2	BroadT	BRD-K22719646	BRD-K22719646-001-01-2	Broad Institute of MIT and Harvard	BRD-K22719646			CN1CCN(CC1)C(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Nc2ccccc2F)C=C1	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17-,18+/m0/s1	ZHYLMLAAZLDJNG-JCGIZDLHSA-N	406.201633584							98430
BRD-K30377297	LSM-10259		54638669	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17+,18+/m1/s1	CZXCLXHYAUMTPI-SQNIBIBYSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K30377297	BRD-K30377297-001-01-1	Broad Institute of MIT and Harvard	BRD-K30377297			OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NC(=O)C1CCC1	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17+,18+/m1/s1	CZXCLXHYAUMTPI-SQNIBIBYSA-N	375.215806438							98880
BRD-K35786295	LSM-10576		54638710	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16+/m0/s1	BYMJCSXXYVSKMN-NUEKZKHPSA-N	CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	BroadT	BRD-K35786295	BRD-K35786295-001-01-0	Broad Institute of MIT and Harvard	BRD-K35786295			CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16+/m0/s1	BYMJCSXXYVSKMN-NUEKZKHPSA-N	352.1798355							99197
BRD-K50115811	LSM-11475		54638750	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20-,21+/m1/s1	QYROUQDLUMQXKE-NRSPTQNISA-N	OC[C@@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NS(=O)(=O)c3cccc(Cl)c3	BroadT	BRD-K50115811	BRD-K50115811-001-01-7	Broad Institute of MIT and Harvard	BRD-K50115811			OC[C@@H]1O[C@@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20-,21+/m1/s1	QYROUQDLUMQXKE-NRSPTQNISA-N	487.190769618							100096
BRD-K07382790	LSM-8862		54638776	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13+,14-/m1/s1	PYGNPVIZRZQEAZ-HZSPNIEDSA-N	COC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	BroadT	BRD-K07382790	BRD-K07382790-001-01-2	Broad Institute of MIT and Harvard	BRD-K07382790			COC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Nc2ccc(cc2)C(F)(F)F)C=C1	InChI=1S/C17H19F3N2O5/c1-26-15(24)8-12-6-7-13(14(9-23)27-12)22-16(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-7,12-14,23H,8-9H2,1H3,(H2,21,22,25)/t12-,13+,14-/m1/s1	PYGNPVIZRZQEAZ-HZSPNIEDSA-N	388.124606328							97483
BRD-K61834309-001-01-9	LSM-33352	BRD-K61834309	54638553	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19+,20-/m0/s1	FXPAFMKRDBMTQM-SXLOBPIMSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K61834309	BRD-K61834309-001-01-9	Broad Institute of MIT and Harvard	BRD-K61834309			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19+,20-/m0/s1	FXPAFMKRDBMTQM-SXLOBPIMSA-N	485.11874753							121909
BRD-K39929061	LSM-10866		54638755	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12+,13+/m0/s1	OBZPPVVKYJWSJI-CYZMBNFOSA-N	COC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccccc2F)[C@@H](CO)O1	BroadT	BRD-K39929061	BRD-K39929061-001-01-4	Broad Institute of MIT and Harvard	BRD-K39929061			COC(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccccc2F)[C@@H](CO)O1	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12+,13+/m0/s1	OBZPPVVKYJWSJI-CYZMBNFOSA-N	361.09953626							99487
BRD-K61782241	LSM-12173		54638542	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17-,19-/m0/s1	UVJMALWFIRFJAR-LNLFQRSKSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K61782241	BRD-K61782241-001-01-1	Broad Institute of MIT and Harvard	BRD-K61782241			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@@H]1NC(=O)c1ccccn1	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17-,19-/m0/s1	UVJMALWFIRFJAR-LNLFQRSKSA-N	417.150012582							100799
BRD-K12970833	LSM-9199		54638764	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22-,23+/m1/s1	URVFCIGKBRHLNA-MZYLBHOOSA-N	CC(C)NC(=O)NCC[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@H](CO)O1	BroadT	BRD-K12970833	BRD-K12970833-001-01-6	Broad Institute of MIT and Harvard	BRD-K12970833			CC(C)NC(=O)NCC[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@H](CO)O1	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22-,23+/m1/s1	URVFCIGKBRHLNA-MZYLBHOOSA-N	491.209006496							97820
BRD-K45355730	LSM-11190		54638622	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17-,18-/m0/s1	ZHYLMLAAZLDJNG-WBAXXEDZSA-N	CN1CCN(CC1)C(=O)C[C@H]2O[C@@H](CO)[C@@H](NC(=O)Nc3ccccc3F)C=C2	BroadT	BRD-K45355730	BRD-K45355730-001-01-5	Broad Institute of MIT and Harvard	BRD-K45355730			CN1CCN(CC1)C(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2ccccc2F)C=C1	InChI=1S/C20H27FN4O4/c1-24-8-10-25(11-9-24)19(27)12-14-6-7-17(18(13-26)29-14)23-20(28)22-16-5-3-2-4-15(16)21/h2-7,14,17-18,26H,8-13H2,1H3,(H2,22,23,28)/t14-,17-,18-/m0/s1	ZHYLMLAAZLDJNG-WBAXXEDZSA-N	406.201633584							99811
BRD-K18567420	LSM-9547		54638844	InChI=1S/C24H25FN4O5/c25-18-4-2-1-3-17(18)20-12-29(28-27-20)10-9-16-6-7-19(23(13-30)34-16)26-24(31)15-5-8-21-22(11-15)33-14-32-21/h1-5,8,11-12,16,19,23,30H,6-7,9-10,13-14H2,(H,26,31)/t16-,19-,23-/m1/s1	RQZDEGSLOUOYBH-ZDWFVDTJSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3ccccc3F)CC[C@H]1NC(=O)c4ccc5OCOc5c4	BroadT	BRD-K18567420	BRD-K18567420-001-01-3	Broad Institute of MIT and Harvard	BRD-K18567420			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2F)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C24H25FN4O5/c25-18-4-2-1-3-17(18)20-12-29(28-27-20)10-9-16-6-7-19(23(13-30)34-16)26-24(31)15-5-8-21-22(11-15)33-14-32-21/h1-5,8,11-12,16,19,23,30H,6-7,9-10,13-14H2,(H,26,31)/t16-,19-,23-/m1/s1	RQZDEGSLOUOYBH-ZDWFVDTJSA-N	468.18089814							98168
BRD-K56581148	LSM-11848		54638685	InChI=1S/C16H25N3O5S/c1-2-25(22,23)19-14-7-6-13(24-15(14)11-20)9-16(21)18-10-12-5-3-4-8-17-12/h3-5,8,13-15,19-20H,2,6-7,9-11H2,1H3,(H,18,21)/t13-,14-,15-/m0/s1	MEPVQKQIDHVRNZ-KKUMJFAQSA-N	CCS(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccccn2)O[C@H]1CO	BroadT	BRD-K56581148	BRD-K56581148-001-01-8	Broad Institute of MIT and Harvard	BRD-K56581148			CCS(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccccn2)O[C@H]1CO	InChI=1S/C16H25N3O5S/c1-2-25(22,23)19-14-7-6-13(24-15(14)11-20)9-16(21)18-10-12-5-3-4-8-17-12/h3-5,8,13-15,19-20H,2,6-7,9-11H2,1H3,(H,18,21)/t13-,14-,15-/m0/s1	MEPVQKQIDHVRNZ-KKUMJFAQSA-N	371.15149162							100474
BRD-K03088187	LSM-8626		54638737	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12-,13+/m1/s1	QPJNNDOFKLWHFX-WQAKAFBOSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C=C[C@H]1NC(=O)c2ccccc2F	BroadT	BRD-K03088187	BRD-K03088187-001-01-0	Broad Institute of MIT and Harvard	BRD-K03088187			OC[C@@H]1O[C@@H](CC(O)=O)C=C[C@H]1NC(=O)c1ccccc1F	InChI=1S/C15H16FNO5/c16-11-4-2-1-3-10(11)15(21)17-12-6-5-9(7-14(19)20)22-13(12)8-18/h1-6,9,12-13,18H,7-8H2,(H,17,21)(H,19,20)/t9-,12-,13+/m1/s1	QPJNNDOFKLWHFX-WQAKAFBOSA-N	309.101250822							97247
BRD-K46561506	LSM-11270		54638712	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16-/m1/s1	BYMJCSXXYVSKMN-FVQBIDKESA-N	CCC(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	BroadT	BRD-K46561506	BRD-K46561506-001-01-9	Broad Institute of MIT and Harvard	BRD-K46561506			CCC(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C18H25FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-6,13,15-16,22H,2,7-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16-/m1/s1	BYMJCSXXYVSKMN-FVQBIDKESA-N	352.1798355							99891
BRD-K13706246	LSM-9257		54638671	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17-,18+/m1/s1	CZXCLXHYAUMTPI-KURKYZTESA-N	OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)C3CCC3	BroadT	BRD-K13706246	BRD-K13706246-001-01-4	Broad Institute of MIT and Harvard	BRD-K13706246			OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NC(=O)C1CCC1	InChI=1S/C20H29N3O4/c24-13-18-17(23-20(26)15-2-1-3-15)5-4-16(27-18)8-11-22-19(25)12-14-6-9-21-10-7-14/h6-7,9-10,15-18,24H,1-5,8,11-13H2,(H,22,25)(H,23,26)/t16-,17-,18+/m1/s1	CZXCLXHYAUMTPI-KURKYZTESA-N	375.215806438							97878
BRD-K24339152	LSM-9905		54638794	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18+,19+/m0/s1	VPHPWASIVZFRRJ-QXAKKESOSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]2CC[C@@H](NC(=O)CC3CC3)[C@@H](CO)O2	BroadT	BRD-K24339152	BRD-K24339152-001-01-3	Broad Institute of MIT and Harvard	BRD-K24339152			Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)CC2CC2)[C@@H](CO)O1	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18+,19+/m0/s1	VPHPWASIVZFRRJ-QXAKKESOSA-N	410.18754277							98526
BRD-K09130601	LSM-8983		54638812	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15-,16-/m1/s1	XHJSWNOOJCOHJI-BZUAXINKSA-N	COCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccc(Cl)cc2)O[C@@H]1CO	BroadT	BRD-K09130601	BRD-K09130601-001-01-2	Broad Institute of MIT and Harvard	BRD-K09130601			COCC(=O)N[C@@H]1C=C[C@@H](O[C@@H]1CO)CC(=O)NCc1ccc(Cl)cc1	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15-,16-/m1/s1	XHJSWNOOJCOHJI-BZUAXINKSA-N	382.129549566							97604
BRD-K17181267	LSM-9466		54638544	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17-,19+/m1/s1	UVJMALWFIRFJAR-LMMKCTJWSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K17181267	BRD-K17181267-001-01-0	Broad Institute of MIT and Harvard	BRD-K17181267			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)cc(F)c2)C=C[C@H]1NC(=O)c1ccccn1	InChI=1S/C21H21F2N3O4/c22-14-7-13(8-15(23)9-14)11-25-20(28)10-16-4-5-17(19(12-27)30-16)26-21(29)18-3-1-2-6-24-18/h1-9,16-17,19,27H,10-12H2,(H,25,28)(H,26,29)/t16-,17-,19+/m1/s1	UVJMALWFIRFJAR-LMMKCTJWSA-N	417.150012582							98087
BRD-K20163346	LSM-9657		54638748	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20+,21+/m0/s1	QYROUQDLUMQXKE-CEWLAPEOSA-N	OC[C@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NS(=O)(=O)c3cccc(Cl)c3	BroadT	BRD-K20163346	BRD-K20163346-001-01-8	Broad Institute of MIT and Harvard	BRD-K20163346			OC[C@H]1O[C@H](CCNC(=O)CCN2CCCCC2)CC[C@H]1NS(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H34ClN3O5S/c23-17-5-4-6-19(15-17)32(29,30)25-20-8-7-18(31-21(20)16-27)9-11-24-22(28)10-14-26-12-2-1-3-13-26/h4-6,15,18,20-21,25,27H,1-3,7-14,16H2,(H,24,28)/t18-,20+,21+/m0/s1	QYROUQDLUMQXKE-CEWLAPEOSA-N	487.190769618							98278
BRD-K95244186	LSM-14264		54638792	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16+,19-/m1/s1	ZKMZGYJTUFHVCC-JTDSTZFVSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K95244186	BRD-K95244186-001-01-9	Broad Institute of MIT and Harvard	BRD-K95244186			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16+,19-/m1/s1	ZKMZGYJTUFHVCC-JTDSTZFVSA-N	402.179086572							102918
BRD-K19729667	LSM-9621		54638798	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18+,19-/m1/s1	VPHPWASIVZFRRJ-NZSAHSFTSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@H]2CC[C@H](NC(=O)CC3CC3)[C@@H](CO)O2	BroadT	BRD-K19729667	BRD-K19729667-001-01-0	Broad Institute of MIT and Harvard	BRD-K19729667			Cc1ccc(cc1)S(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)CC2CC2)[C@@H](CO)O1	InChI=1S/C20H30N2O5S/c1-14-2-7-17(8-3-14)28(25,26)21-11-10-16-6-9-18(19(13-23)27-16)22-20(24)12-15-4-5-15/h2-3,7-8,15-16,18-19,21,23H,4-6,9-13H2,1H3,(H,22,24)/t16-,18+,19-/m1/s1	VPHPWASIVZFRRJ-NZSAHSFTSA-N	410.18754277							98242
BRD-K86857638	LSM-13756		54638829	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16-,18-/m0/s1	LFPPDYCBOCBVHR-BQFCYCMXSA-N	COc1ccccc1S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)N3CCCCC3)O[C@H]2CO	BroadT	BRD-K86857638	BRD-K86857638-001-01-3	Broad Institute of MIT and Harvard	BRD-K86857638			COc1ccccc1S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C20H28N2O6S/c1-27-17-7-3-4-8-19(17)29(25,26)21-16-10-9-15(28-18(16)14-23)13-20(24)22-11-5-2-6-12-22/h3-4,7-10,15-16,18,21,23H,2,5-6,11-14H2,1H3/t15-,16-,18-/m0/s1	LFPPDYCBOCBVHR-BQFCYCMXSA-N	424.166807326							102405
BRD-K18234030	LSM-9519		54638814	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15-,16+/m0/s1	XHJSWNOOJCOHJI-HRCADAONSA-N	COCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccc(Cl)cc2)O[C@@H]1CO	BroadT	BRD-K18234030	BRD-K18234030-001-01-2	Broad Institute of MIT and Harvard	BRD-K18234030			COCC(=O)N[C@H]1C=C[C@H](O[C@@H]1CO)CC(=O)NCc1ccc(Cl)cc1	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15-,16+/m0/s1	XHJSWNOOJCOHJI-HRCADAONSA-N	382.129549566							98140
BRD-K34407245	LSM-10505		54638683	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18-/m0/s1	UYZCTKNUILRIOW-KSZLIROESA-N	CCCNC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	BroadT	BRD-K34407245	BRD-K34407245-001-01-5	Broad Institute of MIT and Harvard	BRD-K34407245			CCCNC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCc2ccccc2)O[C@H]1CO	InChI=1S/C20H29N3O4/c1-2-11-22-20(26)23-17-9-8-16(27-18(17)14-24)13-19(25)21-12-10-15-6-4-3-5-7-15/h3-9,16-18,24H,2,10-14H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18-/m0/s1	UYZCTKNUILRIOW-KSZLIROESA-N	375.215806438							99126
BRD-K47368357	LSM-11320		54638815	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15-,16+/m1/s1	XHJSWNOOJCOHJI-OAGGEKHMSA-N	COCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccc(Cl)cc2)O[C@H]1CO	BroadT	BRD-K47368357	BRD-K47368357-001-01-8	Broad Institute of MIT and Harvard	BRD-K47368357			COCC(=O)N[C@@H]1C=C[C@@H](O[C@H]1CO)CC(=O)NCc1ccc(Cl)cc1	InChI=1S/C18H23ClN2O5/c1-25-11-18(24)21-15-7-6-14(26-16(15)10-22)8-17(23)20-9-12-2-4-13(19)5-3-12/h2-7,14-16,22H,8-11H2,1H3,(H,20,23)(H,21,24)/t14-,15-,16+/m1/s1	XHJSWNOOJCOHJI-OAGGEKHMSA-N	382.129549566							99941
BRD-K76574148	LSM-13112		54638825	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17+,18-/m0/s1	QFAVGRCFIOJHOR-KSZLIROESA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@H]1NC(=O)CC3CC3	BroadT	BRD-K76574148	BRD-K76574148-001-01-9	Broad Institute of MIT and Harvard	BRD-K76574148			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)CC[C@H]1NC(=O)CC1CC1	InChI=1S/C20H27ClN2O4/c21-15-5-3-14(4-6-15)11-22-19(25)10-16-7-8-17(18(12-24)27-16)23-20(26)9-13-1-2-13/h3-6,13,16-18,24H,1-2,7-12H2,(H,22,25)(H,23,26)/t16-,17+,18-/m0/s1	QFAVGRCFIOJHOR-KSZLIROESA-N	394.165935074							101750
BRD-K93140279	LSM-14142		54638786	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16+,19+/m0/s1	ZKMZGYJTUFHVCC-FRQCXROJSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K93140279	BRD-K93140279-001-01-9	Broad Institute of MIT and Harvard	BRD-K93140279			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H26N2O6/c24-12-19-16(22-21(26)14-4-7-17-18(10-14)28-13-27-17)6-5-15(29-19)11-20(25)23-8-2-1-3-9-23/h4-7,10,15-16,19,24H,1-3,8-9,11-13H2,(H,22,26)/t15-,16+,19+/m0/s1	ZKMZGYJTUFHVCC-FRQCXROJSA-N	402.179086572							102796
BRD-K80019738	LSM-13314		54638549	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19-,20-/m1/s1	FXPAFMKRDBMTQM-MISYRCLQSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)Nc3cccc(F)c3	BroadT	BRD-K80019738	BRD-K80019738-001-01-5	Broad Institute of MIT and Harvard	BRD-K80019738			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2cccc(Cl)c2)CC[C@H]1NC(=O)Nc1cccc(F)c1	InChI=1S/C21H25ClFN3O5S/c22-14-3-1-6-18(11-14)32(29,30)24-10-9-17-7-8-19(20(13-27)31-17)26-21(28)25-16-5-2-4-15(23)12-16/h1-6,11-12,17,19-20,24,27H,7-10,13H2,(H2,25,26,28)/t17-,19-,20-/m1/s1	FXPAFMKRDBMTQM-MISYRCLQSA-N	485.11874753							101953
BRD-K14295062	LSM-9290		54638600	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17-,19+/m0/s1	LUVVHBIYDBULDN-VDZJLULYSA-N	Cc1cccc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CCNC(=O)c3cnccn3)O[C@@H]2CO	BroadT	BRD-K14295062	BRD-K14295062-001-01-8	Broad Institute of MIT and Harvard	BRD-K14295062			Cc1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CCNC(=O)c2cnccn2)O[C@@H]1CO	InChI=1S/C20H26N4O5S/c1-14-3-2-4-16(11-14)30(27,28)24-17-6-5-15(29-19(17)13-25)7-8-23-20(26)18-12-21-9-10-22-18/h2-4,9-12,15,17,19,24-25H,5-8,13H2,1H3,(H,23,26)/t15-,17-,19+/m0/s1	LUVVHBIYDBULDN-VDZJLULYSA-N	434.162390662							97911
BRD-K66184091	LSM-12464		54638768	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22-,23+/m0/s1	URVFCIGKBRHLNA-ACIOBRDBSA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@@H](CO)O1	BroadT	BRD-K66184091	BRD-K66184091-001-01-6	Broad Institute of MIT and Harvard	BRD-K66184091			CC(C)NC(=O)NCC[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)[C@@H](CO)O1	InChI=1S/C24H33N3O6S/c1-17(2)26-24(29)25-15-14-20-10-13-22(23(16-28)33-20)27-34(30,31)21-11-8-19(9-12-21)32-18-6-4-3-5-7-18/h3-9,11-12,17,20,22-23,27-28H,10,13-16H2,1-2H3,(H2,25,26,29)/t20-,22-,23+/m0/s1	URVFCIGKBRHLNA-ACIOBRDBSA-N	491.209006496							101094
BRD-K95578893	LSM-14289		54638558	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19+/m0/s1	ZEQYNXCYKJRRAG-GBESFXJTSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K95578893	BRD-K95578893-001-01-4	Broad Institute of MIT and Harvard	BRD-K95578893			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19+/m0/s1	ZEQYNXCYKJRRAG-GBESFXJTSA-N	423.21694929							102943
BRD-K82041810-001-01-8	LSM-13438	BRD-K82041810	54638614	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18+,19-/m1/s1	JHFKDWZHMFMOKL-CEXWTWQISA-N	OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K82041810	BRD-K82041810-001-01-8	Broad Institute of MIT and Harvard	BRD-K82041810			OC[C@H]1O[C@@H](CCNC(=O)Nc2ccc(cc2)C(F)(F)F)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C22H25F3N4O4/c23-22(24,25)15-3-5-16(6-4-15)28-21(32)27-11-9-17-7-8-18(19(13-30)33-17)29-20(31)14-2-1-10-26-12-14/h1-6,10,12,17-19,30H,7-9,11,13H2,(H,29,31)(H2,27,28,32)/t17-,18+,19-/m1/s1	JHFKDWZHMFMOKL-CEXWTWQISA-N	466.18278992							102078
BRD-K09032125	LSM-8975		54638760	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12+,13-/m1/s1	OBZPPVVKYJWSJI-KGYLQXTDSA-N	COC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2F)[C@@H](CO)O1	BroadT	BRD-K09032125	BRD-K09032125-001-01-7	Broad Institute of MIT and Harvard	BRD-K09032125			COC(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2F)[C@@H](CO)O1	InChI=1S/C15H20FNO6S/c1-22-15(19)8-10-6-7-12(13(9-18)23-10)17-24(20,21)14-5-3-2-4-11(14)16/h2-5,10,12-13,17-18H,6-9H2,1H3/t10-,12+,13-/m1/s1	OBZPPVVKYJWSJI-KGYLQXTDSA-N	361.09953626							97596
BRD-K71567488-001-01-6	LSM-33353	BRD-K71567488	54638554	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19+/m0/s1	ZEQYNXCYKJRRAG-IPMKNSEASA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K71567488	BRD-K71567488-001-01-6	Broad Institute of MIT and Harvard	BRD-K71567488			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-3,10,17-19,26H,4-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19+/m0/s1	ZEQYNXCYKJRRAG-IPMKNSEASA-N	423.21694929							121910
BRD-K69280720	LSM-12651		54638659	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18+,19-/m1/s1	QDYPPDFKKOAHDR-CEXWTWQISA-N	COc1cccc(CNC(=O)C[C@@H]2O[C@H](CO)[C@@H](NC(=O)C3CCC3)C=C2)c1	BroadT	BRD-K69280720	BRD-K69280720-001-01-8	Broad Institute of MIT and Harvard	BRD-K69280720			COc1cccc(CNC(=O)C[C@@H]2O[C@H](CO)[C@@H](NC(=O)C3CCC3)C=C2)c1	InChI=1S/C21H28N2O5/c1-27-16-7-2-4-14(10-16)12-22-20(25)11-17-8-9-18(19(13-24)28-17)23-21(26)15-5-3-6-15/h2,4,7-10,15,17-19,24H,3,5-6,11-13H2,1H3,(H,22,25)(H,23,26)/t17-,18+,19-/m1/s1	QDYPPDFKKOAHDR-CEXWTWQISA-N	388.199822016							101285
T0520-6905	LSM-33354	SID22408320, BRD-K81791146	2424622	InChI=1S/C19H17N3OS/c1-11-7-8-15-16(9-11)22-19(21-15)24-10-17(23)18-12(2)20-14-6-4-3-5-13(14)18/h3-9,20H,10H2,1-2H3,(H,21,22)	OLATYNREAIJLCC-UHFFFAOYSA-N	Cc1ccc2[nH]c(SCC(=O)c3c(C)[nH]c4ccccc34)nc2c1	BroadT	BRD-K81791146	BRD-K81791146-001-05-5	Enamine Ltd.	T0520-6905			Cc1[nH]c2ccccc2c1C(=O)CSc1nc2cc(C)ccc2[nH]1	InChI=1S/C19H17N3OS/c1-11-7-8-15-16(9-11)22-19(21-15)24-10-17(23)18-12(2)20-14-6-4-3-5-13(14)18/h3-9,20H,10H2,1-2H3,(H,21,22)	OLATYNREAIJLCC-UHFFFAOYSA-N	335.109232884							121911
SMR000030253	LSM-33355	SID24838478, SID4249324, BRD-K48808440	3243292	InChI=1S/C24H35N3O6/c1-4-32-20-13-18-19(14-21(20)33-5-2)26-24(30)27(23(18)29)15-16-7-9-17(10-8-16)22(28)25-11-6-12-31-3/h13-14,16-17H,4-12,15H2,1-3H3,(H,25,28)(H,26,30)	UGZXEPWCTNRJAS-UHFFFAOYSA-N	CCOc1cc2NC(=O)N(CC3CCC(CC3)C(=O)NCCCOC)C(=O)c2cc1OCC	BroadT	BRD-K48808440	BRD-K48808440-001-05-2	ChemDiv Inc.	K221-3384			CCOc1cc2[nH]c(=O)n(CC3CCC(CC3)C(=O)NCCCOC)c(=O)c2cc1OCC	InChI=1S/C24H35N3O6/c1-4-32-20-13-18-19(14-21(20)33-5-2)26-24(30)27(23(18)29)15-16-7-9-17(10-8-16)22(28)25-11-6-12-31-3/h13-14,16-17H,4-12,15H2,1-3H3,(H,25,28)(H,26,30)	UGZXEPWCTNRJAS-UHFFFAOYSA-N	461.25258587							121912
AC1OB0TF	LSM-33356	BRD-K28072625	6838341	InChI=1S/C15H15ClN4O2S/c1-9-14(22)13(10(8-21)6-17-9)7-18-20-15(23)19-12-4-2-3-11(16)5-12/h2-7,21-22H,8H2,1H3,(H2,19,20,23)	YFJGFVLHZQRZCR-UHFFFAOYSA-N	Cc1ncc(CO)c(C=NN=C(S)Nc2cccc(Cl)c2)c1O	BroadT	BRD-K28072625	BRD-K28072625-001-05-6	Enamine Ltd.	T5345198			Cc1ncc(CO)c(C=NN=C(S)Nc2cccc(Cl)c2)c1O	InChI=1S/C15H15ClN4O2S/c1-9-14(22)13(10(8-21)6-17-9)7-18-20-15(23)19-12-4-2-3-11(16)5-12/h2-7,21-22H,8H2,1H3,(H2,19,20,23)	YFJGFVLHZQRZCR-UHFFFAOYSA-N	350.06042416							
ST50917445	LSM-33357	SID4260488, BRD-K98516318	2163924	InChI=1S/C17H19NO4/c1-3-4-10-22-17(20)13-5-7-14(8-6-13)18-16(19)15-9-11-21-12(15)2/h5-9,11H,3-4,10H2,1-2H3,(H,18,19)	KCPZCWVTJBSBGN-UHFFFAOYSA-N	CCCCOC(=O)c1ccc(NC(=O)c2ccoc2C)cc1	BroadT	BRD-K98516318	BRD-K98516318-001-05-9	ChemBridge Corporation	7279208			CCCCOC(=O)c1ccc(NC(=O)c2ccoc2C)cc1	InChI=1S/C17H19NO4/c1-3-4-10-22-17(20)13-5-7-14(8-6-13)18-16(19)15-9-11-21-12(15)2/h5-9,11H,3-4,10H2,1-2H3,(H,18,19)	KCPZCWVTJBSBGN-UHFFFAOYSA-N	301.131408098							121914
ST50755045	LSM-33358	SID14746290, BRD-K86299582	1194279	InChI=1S/C17H17N3O4S/c1-9(2)16-19-20-17(25-16)18-14(21)8-23-11-4-5-12-10(3)6-15(22)24-13(12)7-11/h4-7,9H,8H2,1-3H3,(H,18,20,21)	SLYGXKIQTSSLCA-UHFFFAOYSA-N	CC(C)c1nnc(NC(=O)COc2ccc3C(=CC(=O)Oc3c2)C)s1	BroadT	BRD-K86299582	BRD-K86299582-001-05-5	ChemBridge Corporation	7644315			CC(C)c1nnc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)s1	InChI=1S/C17H17N3O4S/c1-9(2)16-19-20-17(25-16)18-14(21)8-23-11-4-5-12-10(3)6-15(22)24-13(12)7-11/h4-7,9H,8H2,1-3H3,(H,18,20,21)	SLYGXKIQTSSLCA-UHFFFAOYSA-N	359.093976744							121915
SMR000148793	LSM-44468	SID14743065, BRD-K15749522	5555320	InChI=1S/C17H21N3O4/c1-5-24-12-8-6-11(7-9-12)18-10-13-14(21)19-16(23)20(15(13)22)17(2,3)4/h6-10,18H,5H2,1-4H3,(H,19,21,23)/b13-10-	ILLBGDBGGTUGGV-RAXLEYEMSA-N	CCOc1ccc(N\C=C/2\C(=O)NC(=O)N(C2=O)C(C)(C)C)cc1	BroadT	BRD-K15749522	BRD-K15749522-001-05-8	InterBioScreen Ltd.	STOCK3S-98157			CCOc1ccc(N\C=C2\C(=O)NC(=O)N(C2=O)C(C)(C)C)cc1	InChI=1S/C17H21N3O4/c1-5-24-12-8-6-11(7-9-12)18-10-13-14(21)19-16(23)20(15(13)22)17(2,3)4/h6-10,18H,5H2,1-4H3,(H,19,21,23)/b13-10-	ILLBGDBGGTUGGV-RAXLEYEMSA-N	331.153206182							
BAS 01065915	LSM-33360	SID24787988, BRD-K57051756	1114260	InChI=1S/C17H16Cl2N2O2/c18-13-3-1-12(2-4-13)17(22)20-14-5-6-16(15(19)11-14)21-7-9-23-10-8-21/h1-6,11H,7-10H2,(H,20,22)	OQWYBMHNBITLBX-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)Nc2ccc(N3CCOCC3)c(Cl)c2	BroadT	BRD-K57051756	BRD-K57051756-001-05-5	Asinex Ltd.	BAS 01065915			Clc1ccc(cc1)C(=O)Nc1ccc(N2CCOCC2)c(Cl)c1	InChI=1S/C17H16Cl2N2O2/c18-13-3-1-12(2-4-13)17(22)20-14-5-6-16(15(19)11-14)21-7-9-23-10-8-21/h1-6,11H,7-10H2,(H,20,22)	OQWYBMHNBITLBX-UHFFFAOYSA-N	350.058883192							121917
MLS001095597	LSM-33361	SID49719381, BRD-K09010757	22576109	InChI=1S/C23H26N4O2S/c1-18-9-11-21(12-10-18)30(28,29)26-20-8-6-7-19(17-20)22-13-14-23(25-24-22)27-15-4-2-3-5-16-27/h6-14,17,26H,2-5,15-16H2,1H3	MXJALHAZCLSOIQ-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)Nc2cccc(c2)c3ccc(nn3)N4CCCCCC4	BroadT	BRD-K09010757	BRD-K09010757-001-05-9	ChemDiv Inc.	G620-0286			Cc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)-c1ccc(nn1)N1CCCCCC1	InChI=1S/C23H26N4O2S/c1-18-9-11-21(12-10-18)30(28,29)26-20-8-6-7-19(17-20)22-13-14-23(25-24-22)27-15-4-2-3-5-16-27/h6-14,17,26H,2-5,15-16H2,1H3	MXJALHAZCLSOIQ-UHFFFAOYSA-N	422.177646802							121918
BAS 05496915	LSM-33362	SID845648, BRD-K05858194	648003	InChI=1S/C17H13N3O3/c21-16(20-15-5-1-2-10-18-15)12-6-8-13(9-7-12)19-17(22)14-4-3-11-23-14/h1-11H,(H,19,22)(H,18,20,21)	WABFRDGZSSCJPD-UHFFFAOYSA-N	O=C(Nc1ccc(cc1)C(=O)Nc2ccccn2)c3occc3	BroadT	BRD-K05858194	BRD-K05858194-001-05-6	Asinex Ltd.	BAS 05496915			O=C(Nc1ccc(cc1)C(=O)Nc1ccccn1)c1ccco1	InChI=1S/C17H13N3O3/c21-16(20-15-5-1-2-10-18-15)12-6-8-13(9-7-12)19-17(22)14-4-3-11-23-14/h1-11H,(H,19,22)(H,18,20,21)	WABFRDGZSSCJPD-UHFFFAOYSA-N	307.095691306							121919
AC1LEUKF	LSM-44469	SID26671495, BRD-K11424490	742170	InChI=1S/C18H13NO4S/c20-15(9-8-13-7-4-10-23-13)19-17-16(18(21)22)14(11-24-17)12-5-2-1-3-6-12/h1-11H,(H,19,20)(H,21,22)/b9-8+	WWJDTCKZONJWRU-CMDGGOBGSA-N	OC(=O)c1c(NC(=O)\C=C\c2occc2)scc1c3ccccc3	BroadT	BRD-K11424490	BRD-K11424490-001-05-0	InterBioScreen Ltd.	STOCK1S-69217			OC(=O)c1c(NC(=O)\C=C\c2ccco2)scc1-c1ccccc1	InChI=1S/C18H13NO4S/c20-15(9-8-13-7-4-10-23-13)19-17-16(18(21)22)14(11-24-17)12-5-2-1-3-6-12/h1-11H,(H,19,20)(H,21,22)/b9-8+	WWJDTCKZONJWRU-CMDGGOBGSA-N	339.056528596							
AP-501/43059465	LSM-33364	SID14728353, BRD-K09643614	1235346	InChI=1S/C16H14N2O2/c1-11-5-4-6-12(9-11)17-16(19)10-14-13-7-2-3-8-15(13)20-18-14/h2-9H,10H2,1H3,(H,17,19)	QWKZSVVDCYCSNO-UHFFFAOYSA-N	Cc1cccc(NC(=O)Cc2noc3ccccc23)c1	BroadT	BRD-K09643614	BRD-K09643614-001-06-8	Specs	AP-501/43059465			Cc1cccc(NC(=O)Cc2noc3ccccc23)c1	InChI=1S/C16H14N2O2/c1-11-5-4-6-12(9-11)17-16(19)10-14-13-7-2-3-8-15(13)20-18-14/h2-9H,10H2,1H3,(H,17,19)	QWKZSVVDCYCSNO-UHFFFAOYSA-N	266.105527708							121921
SMR000241907	LSM-33365	SID22403188, BRD-K71478082	4392091	InChI=1S/C19H18ClN3O4S3/c20-14-6-5-13(30(25,26)23-7-9-27-10-8-23)11-16(14)21-18(24)12-28-19-22-15-3-1-2-4-17(15)29-19/h1-6,11H,7-10,12H2,(H,21,24)	VWDPRWUEDMNQFB-UHFFFAOYSA-N	Clc1ccc(cc1NC(=O)CSc2nc3ccccc3s2)S(=O)(=O)N4CCOCC4	BroadT	BRD-K71478082	BRD-K71478082-001-05-7	Enamine Ltd.	T0518-6838			Clc1ccc(cc1NC(=O)CSc1nc2ccccc2s1)S(=O)(=O)N1CCOCC1	InChI=1S/C19H18ClN3O4S3/c20-14-6-5-13(30(25,26)23-7-9-27-10-8-23)11-16(14)21-18(24)12-28-19-22-15-3-1-2-4-17(15)29-19/h1-6,11H,7-10,12H2,(H,21,24)	VWDPRWUEDMNQFB-UHFFFAOYSA-N	483.014795866							121922
AC1LGD5L	LSM-33366	BRD-K36123624	769076	InChI=1S/C13H11N3O4/c1-9-11(6-7-20-9)13(17)15-14-8-10-4-2-3-5-12(10)16(18)19/h2-8H,1H3,(H,15,17)	YAAUJXYWRCSAAB-UHFFFAOYSA-N	Cc1occc1C(=O)NN=Cc2ccccc2[N+](=O)[O-]	BroadT	BRD-K36123624	BRD-K36123624-001-05-8	InterBioScreen Ltd.	STOCK3S-63012			Cc1occc1C(=O)NN=Cc1ccccc1[N+]([O-])=O	InChI=1S/C13H11N3O4/c1-9-11(6-7-20-9)13(17)15-14-8-10-4-2-3-5-12(10)16(18)19/h2-8H,1H3,(H,15,17)	YAAUJXYWRCSAAB-UHFFFAOYSA-N	273.074955862							121923
MLS000031889	LSM-33367	SID845380, BRD-K60178947	647723	InChI=1S/C13H11N3O/c1-8-7-10(17)14-13-11(8)12(15-16-13)9-5-3-2-4-6-9/h2-7H,1H3,(H2,14,15,16,17)	GVUZTAQXZLRFAL-UHFFFAOYSA-N	Cc1cc(O)[nH]c2nnc(c3ccccc3)c12	BroadT	BRD-K60178947	BRD-K60178947-001-06-9	Asinex Ltd.	BAS 04056702			Cc1cc(O)[nH]c2nnc(-c3ccccc3)c12	InChI=1S/C13H11N3O/c1-8-7-10(17)14-13-11(8)12(15-16-13)9-5-3-2-4-6-9/h2-7H,1H3,(H2,14,15,16,17)	GVUZTAQXZLRFAL-UHFFFAOYSA-N	225.090212002							121924
N-(4-Acetylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide	LSM-33368	SID4250567, BRD-K38262410	3244362	InChI=1S/C17H18N2O3/c1-11(20)12-7-9-13(10-8-12)18-17(21)16-14-5-3-2-4-6-15(14)22-19-16/h7-10H,2-6H2,1H3,(H,18,21)	QUIANYHQAVDUQC-UHFFFAOYSA-N	CC(=O)c1ccc(NC(=O)c2noc3CCCCCc23)cc1	BroadT	BRD-K38262410	BRD-K38262410-001-05-0	ChemDiv Inc.	C226-3484			CC(=O)c1ccc(NC(=O)c2noc3CCCCCc23)cc1	InChI=1S/C17H18N2O3/c1-11(20)12-7-9-13(10-8-12)18-17(21)16-14-5-3-2-4-6-15(14)22-19-16/h7-10H,2-6H2,1H3,(H,18,21)	QUIANYHQAVDUQC-UHFFFAOYSA-N	298.131742456							121925
2-(4-Chlorophenyl)-2-oxoethyl thiomorpholine-4-carbodithioate	LSM-33369	SID24781694, BRD-K59948003	698763	InChI=1S/C13H14ClNOS3/c14-11-3-1-10(2-4-11)12(16)9-19-13(17)15-5-7-18-8-6-15/h1-4H,5-9H2	RKIMPSOYLTWPHX-UHFFFAOYSA-N	Clc1ccc(cc1)C(=O)CSC(=S)N2CCSCC2	BroadT	BRD-K59948003	BRD-K59948003-001-05-1	Asinex Ltd.	BAS 00458729			Clc1ccc(cc1)C(=O)CSC(=S)N1CCSCC1	InChI=1S/C13H14ClNOS3/c14-11-3-1-10(2-4-11)12(16)9-19-13(17)15-5-7-18-8-6-15/h1-4H,5-9H2	RKIMPSOYLTWPHX-UHFFFAOYSA-N	330.992603858							121926
SMR000001949	LSM-33370	SID842261, BRD-K72423481	644520	InChI=1S/C17H18N8OS2/c1-10-21-23-16(28-10)20-15(26)9-27-17-24-22-14(25(17)2)8-7-13-18-11-5-3-4-6-12(11)19-13/h3-6H,7-9H2,1-2H3,(H,18,19)(H,20,23,26)	GAVFOQXGKJGRHC-UHFFFAOYSA-N	Cc1nnc(NC(=O)CSc2nnc(CCc3nc4ccccc4[nH]3)n2C)s1	BroadT	BRD-K72423481	BRD-K72423481-001-05-9	Asinex Ltd.	ASN 03018147			Cc1nnc(NC(=O)CSc2nnc(CCc3nc4ccccc4[nH]3)n2C)s1	InChI=1S/C17H18N8OS2/c1-10-21-23-16(28-10)20-15(26)9-27-17-24-22-14(25(17)2)8-7-13-18-11-5-3-4-6-12(11)19-13/h3-6H,7-9H2,1-2H3,(H,18,19)(H,20,23,26)	GAVFOQXGKJGRHC-UHFFFAOYSA-N	414.104498656							121927
SMR000073580	LSM-33371	SID4255582, BRD-K67079318	893563	InChI=1S/C19H17N3O3/c23-18(20-13-15-9-6-12-25-15)16-10-4-5-11-17(16)22-19(24)21-14-7-2-1-3-8-14/h1-12H,13H2,(H,20,23)(H2,21,22,24)	VQSWUFPVFLZOBR-UHFFFAOYSA-N	O=C(Nc1ccccc1)Nc2ccccc2C(=O)NCc3occc3	BroadT	BRD-K67079318	BRD-K67079318-001-06-3	ChemBridge Corporation	7584037			O=C(Nc1ccccc1)Nc1ccccc1C(=O)NCc1ccco1	InChI=1S/C19H17N3O3/c23-18(20-13-15-9-6-12-25-15)16-10-4-5-11-17(16)22-19(24)21-14-7-2-1-3-8-14/h1-12H,13H2,(H,20,23)(H2,21,22,24)	VQSWUFPVFLZOBR-UHFFFAOYSA-N	335.126991434							121928
AC1LY25X	LSM-33372	BRD-K81788647	1812675	InChI=1S/C21H21N5O2/c1-15-12-17(16(2)26(15)19-9-4-3-5-10-19)13-24-25-21(28)20(27)23-14-18-8-6-7-11-22-18/h3-13H,14H2,1-2H3,(H,23,27)(H,25,28)	ICMOKENNPRPTOP-UHFFFAOYSA-N	Cc1cc(C=NNC(=O)C(=O)NCc2ccccn2)c(C)n1c3ccccc3	BroadT	BRD-K81788647	BRD-K81788647-001-05-5	Specs	AO-081/15245208			Cc1cc(C=NNC(=O)C(=O)NCc2ccccn2)c(C)n1-c1ccccc1	InChI=1S/C21H21N5O2/c1-15-12-17(16(2)26(15)19-9-4-3-5-10-19)13-24-25-21(28)20(27)23-14-18-8-6-7-11-22-18/h3-13H,14H2,1-2H3,(H,23,27)(H,25,28)	ICMOKENNPRPTOP-UHFFFAOYSA-N	375.169524962							121929
AC1MUVB7	LSM-33373	BRD-M64738662	3624739	InChI=1S/C24H21N3O3S2/c1-15-12-16(2)22-21(13-15)31-24(25-22)26-23(28)18-7-5-8-19(14-18)32(29,30)27-11-10-17-6-3-4-9-20(17)27/h3-9,12-14H,10-11H2,1-2H3,(H,25,26,28)	WMYGLONHTYVWGM-UHFFFAOYSA-N	Cc1cc(C)c2nc(NC(=O)c3cccc(c3)S(=O)(=O)N4CCc5ccccc45)sc2c1	BroadT	BRD-M64738662	BRD-M64738662-001-05-9	Enamine Ltd.	T0509-4442		CCO.Cc1cc(C)c2nc(NC(=O)c3cccc(c3)S(=O)(=O)N3CCc4ccccc34)sc2c1	CCO.Cc1cc(C)c2nc(NC(=O)c3cccc(c3)S(=O)(=O)N3CCc4ccccc34)sc2c1	InChI=1S/C24H21N3O3S2.C2H6O/c1-15-12-16(2)22-21(13-15)31-24(25-22)26-23(28)18-7-5-8-19(14-18)32(29,30)27-11-10-17-6-3-4-9-20(17)27;1-2-3/h3-9,12-14H,10-11H2,1-2H3,(H,25,26,28);3H,2H2,1H3	PMPQJWWOOVNMAY-UHFFFAOYSA-N	463.102432942							121930, 121930
MLS000325774	LSM-33374	SID17402223, BRD-K84601654	1470823	InChI=1S/C16H11Cl2N3OS/c1-22-13-9-20-15(12-7-2-3-8-19-12)21-16(13)23-14-10(17)5-4-6-11(14)18/h2-9H,1H3	UUDMVIMMEVTSAD-UHFFFAOYSA-N	COc1cnc(nc1Sc2c(Cl)cccc2Cl)c3ccccn3	BroadT	BRD-K84601654	BRD-K84601654-001-05-7	Key Organics Ltd.	2J-575S			COc1cnc(nc1Sc1c(Cl)cccc1Cl)-c1ccccn1	InChI=1S/C16H11Cl2N3OS/c1-22-13-9-20-15(12-7-2-3-8-19-12)21-16(13)23-14-10(17)5-4-6-11(14)18/h2-9H,1H3	UUDMVIMMEVTSAD-UHFFFAOYSA-N	362.999988112							121931
AC1O9YLN	LSM-33375	BRD-K84935743	6741010	InChI=1S/C21H16N2O3/c24-19-12-6-1-7-14(19)13-22-23-20(25)21(26)17-10-4-2-8-15(17)16-9-3-5-11-18(16)21/h1-13,24,26H,(H,23,25)	RCCCTMMUPJMZLZ-UHFFFAOYSA-N	Oc1ccccc1C=NNC(=O)C2(O)c3ccccc3c4ccccc24	BroadT	BRD-K84935743	BRD-K84935743-001-05-2	Asinex Ltd.	BAS 01416382			Oc1ccccc1C=NNC(=O)C1(O)c2ccccc2-c2ccccc12	InChI=1S/C21H16N2O3/c24-19-12-6-1-7-14(19)13-22-23-20(25)21(26)17-10-4-2-8-15(17)16-9-3-5-11-18(16)21/h1-13,24,26H,(H,23,25)	RCCCTMMUPJMZLZ-UHFFFAOYSA-N	344.116092392							
MLS000768296	LSM-44470	SID26725671, BRD-K04577896	1904598	InChI=1S/C16H11N3O6S/c1-25-10-4-2-3-9(7-10)18-15(21)12(14(20)17-16(18)22)8-11-5-6-13(26-11)19(23)24/h2-8H,1H3,(H,17,20,22)/b12-8-	UMWKECNWLQGLGP-WQLSENKSSA-N	COc1cccc(c1)N2C(=O)NC(=O)\C(=C\c3ccc(s3)[N+](=O)[O-])\C2=O	BroadT	BRD-K04577896	BRD-K04577896-001-06-2	InterBioScreen Ltd.	STOCK1S-72193			COc1cccc(c1)N1C(=O)NC(=O)\C(=C\c2ccc(s2)[N+]([O-])=O)C1=O	InChI=1S/C16H11N3O6S/c1-25-10-4-2-3-9(7-10)18-15(21)12(14(20)17-16(18)22)8-11-5-6-13(26-11)19(23)24/h2-8H,1H3,(H,17,20,22)/b12-8-	UMWKECNWLQGLGP-WQLSENKSSA-N	373.036855792							
ZINC00305951	LSM-33377	SID22415969, BRD-K80211627	799748	InChI=1S/C18H19N3O2S/c1-14-4-2-3-5-17(14)19-10-12-20(13-11-19)18(24)15-6-8-16(9-7-15)21(22)23/h2-9H,10-13H2,1H3	JWSRJFBZZLXWFB-UHFFFAOYSA-N	Cc1ccccc1N2CCN(CC2)C(=S)c3ccc(cc3)[N+](=O)[O-]	BroadT	BRD-K80211627	BRD-K80211627-001-05-3	ChemBridge Corporation	6892770			Cc1ccccc1N1CCN(CC1)C(=S)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C18H19N3O2S/c1-14-4-2-3-5-17(14)19-10-12-20(13-11-19)18(24)15-6-8-16(9-7-15)21(22)23/h2-9H,10-13H2,1H3	JWSRJFBZZLXWFB-UHFFFAOYSA-N	341.119797568							121934
SMR000105054	LSM-33378	SID7977233, BRD-K13576780	798070	InChI=1S/C17H16N4O2/c1-2-23-14-6-3-12(4-7-14)20-17(22)21-13-5-8-15-16(11-13)19-10-9-18-15/h3-11H,2H2,1H3,(H2,20,21,22)	CJZDEQNTXMKDDB-UHFFFAOYSA-N	CCOc1ccc(NC(=O)Nc2ccc3nccnc3c2)cc1	BroadT	BRD-K13576780	BRD-K13576780-001-05-4	ChemBridge Corporation	5883042			CCOc1ccc(NC(=O)Nc2ccc3nccnc3c2)cc1	InChI=1S/C17H16N4O2/c1-2-23-14-6-3-12(4-7-14)20-17(22)21-13-5-8-15-16(11-13)19-10-9-18-15/h3-11H,2H2,1H3,(H2,20,21,22)	CJZDEQNTXMKDDB-UHFFFAOYSA-N	308.127325792							121935
MLS000591844	LSM-33379	GNF-PF-2413, BRD-K50986005	697235	InChI=1S/C18H17ClN4/c1-13-10-17(22-16-9-5-8-15(19)11-16)23-18(21-13)20-12-14-6-3-2-4-7-14/h2-11H,12H2,1H3,(H2,20,21,22,23)	RBCZUNWZGJFAEC-UHFFFAOYSA-N	Cc1cc(Nc2cccc(Cl)c2)nc(NCc3ccccc3)n1	BroadT	BRD-K50986005	BRD-K50986005-001-09-0	InterBioScreen Ltd.	STOCK2S-57241			Cc1cc(Nc2cccc(Cl)c2)nc(NCc2ccccc2)n1	InChI=1S/C18H17ClN4/c1-13-10-17(22-16-9-5-8-15(19)11-16)23-18(21-13)20-12-14-6-3-2-4-7-14/h2-11H,12H2,1H3,(H2,20,21,22,23)	RBCZUNWZGJFAEC-UHFFFAOYSA-N	324.114174294							121936
MLS000562886	LSM-33380	SID26728087, BRD-K27957988	16745923	InChI=1S/C34H32N6O2/c1-25(41-29-19-11-5-12-20-29)31-33(39(37-35-31)23-27-15-7-3-8-16-27)34-32(26(2)42-30-21-13-6-14-22-30)36-38-40(34)24-28-17-9-4-10-18-28/h3-22,25-26H,23-24H2,1-2H3/t25-,26-/m1/s1	VIXNZROKITWYPY-CLJLJLNGSA-N	C[C@@H](Oc1ccccc1)c2nnn(Cc3ccccc3)c2c4c(nnn4Cc5ccccc5)[C@@H](C)Oc6ccccc6	BroadT	BRD-K27957988	BRD-K27957988-001-03-5	Texas A&M University	EK008 KB_YL008			C[C@@H](Oc1ccccc1)c1nnn(Cc2ccccc2)c1-c1c(nnn1Cc1ccccc1)[C@@H](C)Oc1ccccc1	InChI=1S/C34H32N6O2/c1-25(41-29-19-11-5-12-20-29)31-33(39(37-35-31)23-27-15-7-3-8-16-27)34-32(26(2)42-30-21-13-6-14-22-30)36-38-40(34)24-28-17-9-4-10-18-28/h3-22,25-26H,23-24H2,1-2H3/t25-,26-/m1/s1	VIXNZROKITWYPY-CLJLJLNGSA-N	556.258674324							121937
AC1LSJSM	LSM-33381	BRD-K27672592	1440275	InChI=1S/C26H30N4OS/c1-18-5-4-6-23(15-18)27-26-30(10-9-29-11-13-31-14-12-29)17-22-16-21-8-7-19(2)20(3)24(21)28-25(22)32-26/h4-8,15-16H,9-14,17H2,1-3H3	FRJAILGXXXSCHA-UHFFFAOYSA-N	Cc1cccc(c1)N=C2Sc3nc4c(C)c(C)ccc4cc3CN2CCN5CCOCC5	BroadT	BRD-K27672592	BRD-K27672592-001-05-3	Asinex Ltd.	ASN 08708682			Cc1cccc(c1)N=C1Sc2nc3c(C)c(C)ccc3cc2CN1CCN1CCOCC1	InChI=1S/C26H30N4OS/c1-18-5-4-6-23(15-18)27-26-30(10-9-29-11-13-31-14-12-29)17-22-16-21-8-7-19(2)20(3)24(21)28-25(22)32-26/h4-8,15-16H,9-14,17H2,1-3H3	FRJAILGXXXSCHA-UHFFFAOYSA-N	446.21403231							121938
AC1MOSMG	LSM-33382	SID17514168, BRD-A70583889	3374499	InChI=1S/C20H20N4O3S/c1-12-3-7-14(8-4-12)18(26)23-24-20-22-17(25)11-16(28-20)19(27)21-15-9-5-13(2)6-10-15/h3-10,16H,11H2,1-2H3,(H,21,27)(H,23,26)(H,22,24,25)	MIPHGLQKCXJILF-UHFFFAOYSA-N	Cc1ccc(NC(=O)C2CC(=O)N=C(NNC(=O)c3ccc(C)cc3)S2)cc1	BroadT	BRD-A70583889	BRD-A70583889-001-05-2	InterBioScreen Ltd.	STOCK4S-04100			Cc1ccc(NC(=O)C2CC(=O)N=C(NNC(=O)c3ccc(C)cc3)S2)cc1	InChI=1S/C20H20N4O3S/c1-12-3-7-14(8-4-12)18(26)23-24-20-22-17(25)11-16(28-20)19(27)21-15-9-5-13(2)6-10-15/h3-10,16H,11H2,1-2H3,(H,21,27)(H,23,26)(H,22,24,25)	MIPHGLQKCXJILF-UHFFFAOYSA-N	396.12561123							121939
AC1LKDLC	LSM-33383	BRD-K80363113	1041559	InChI=1S/C22H15FN2O5/c23-17-6-3-5-14(10-17)21(26)25-24-12-16-4-1-2-7-18(16)30-22(27)15-8-9-19-20(11-15)29-13-28-19/h1-12H,13H2,(H,25,26)	LYZYSDXWWKZWHH-UHFFFAOYSA-N	Fc1cccc(c1)C(=O)NN=Cc2ccccc2OC(=O)c3ccc4OCOc4c3	BroadT	BRD-K80363113	BRD-K80363113-001-05-3	Specs	AG-205/36940120			Fc1cccc(c1)C(=O)NN=Cc1ccccc1OC(=O)c1ccc2OCOc2c1	InChI=1S/C22H15FN2O5/c23-17-6-3-5-14(10-17)21(26)25-24-12-16-4-1-2-7-18(16)30-22(27)15-8-9-19-20(11-15)29-13-28-19/h1-12H,13H2,(H,25,26)	LYZYSDXWWKZWHH-UHFFFAOYSA-N	406.0964998							121940
SMR000260395	LSM-33384	SID17517177, BRD-K81581075	2442588	InChI=1S/C17H12Cl2F3NO4/c18-13-2-1-3-14(19)12(13)8-16(25)26-9-15(24)23-10-4-6-11(7-5-10)27-17(20,21)22/h1-7H,8-9H2,(H,23,24)	RTGOJNYUSNXXMX-UHFFFAOYSA-N	FC(F)(F)Oc1ccc(NC(=O)COC(=O)Cc2c(Cl)cccc2Cl)cc1	BroadT	BRD-K81581075	BRD-K81581075-001-06-3	Enamine Ltd.	T0517-8742			FC(F)(F)Oc1ccc(NC(=O)COC(=O)Cc2c(Cl)cccc2Cl)cc1	InChI=1S/C17H12Cl2F3NO4/c18-13-2-1-3-14(19)12(13)8-16(25)26-9-15(24)23-10-4-6-11(7-5-10)27-17(20,21)22/h1-7H,8-9H2,(H,23,24)	RTGOJNYUSNXXMX-UHFFFAOYSA-N	421.009547894							121941
AC1MJ5TZ	LSM-33385	BRD-K06454991	3131822	InChI=1S/C22H22N4/c1-4-11-20-17(3)23-21(19-14-9-6-10-15-19)24-22(20)26-25-16(2)18-12-7-5-8-13-18/h4-10,12-15H,1,11H2,2-3H3,(H,23,24,26)	CWZHXNXJIFCDGG-UHFFFAOYSA-N	CC(=NNc1nc(nc(C)c1CC=C)c2ccccc2)c3ccccc3	BroadT	BRD-K06454991	BRD-K06454991-001-05-8	Asinex Ltd.	BAS 01506839			CC(=NNc1nc(nc(C)c1CC=C)-c1ccccc1)c1ccccc1	InChI=1S/C22H22N4/c1-4-11-20-17(3)23-21(19-14-9-6-10-15-19)24-22(20)26-25-16(2)18-12-7-5-8-13-18/h4-10,12-15H,1,11H2,2-3H3,(H,23,24,26)	CWZHXNXJIFCDGG-UHFFFAOYSA-N	342.184446744							121942
2,3-Di(2-pyridyl)quinoxaline	LSM-33386	SID4264805, BRD-K30923778	97023	InChI=1S/C18H12N4/c1-2-8-14-13(7-1)21-17(15-9-3-5-11-19-15)18(22-14)16-10-4-6-12-20-16/h1-12H	ILLTYNYTHFEGHK-UHFFFAOYSA-N	c1ccc(nc1)c2nc3ccccc3nc2c4ccccn4	BroadT	BRD-K30923778	BRD-K30923778-001-05-1	ChemBridge Corporation	5480476			c1ccc(nc1)-c1nc2ccccc2nc1-c1ccccn1	InChI=1S/C18H12N4/c1-2-8-14-13(7-1)21-17(15-9-3-5-11-19-15)18(22-14)16-10-4-6-12-20-16/h1-12H	ILLTYNYTHFEGHK-UHFFFAOYSA-N	284.106196424							121943
MLS000541434	LSM-33387	SID14730102, BRD-K05238641	3749455	InChI=1S/C20H21N5O3/c1-28-16-6-4-14(5-7-16)17-13-18(23-22-17)15-8-11-24(12-9-15)20-19(25(26)27)3-2-10-21-20/h2-7,10,13,15H,8-9,11-12H2,1H3,(H,22,23)	RXYLMVYPPGECAL-UHFFFAOYSA-N	COc1ccc(cc1)c2cc([nH]n2)C3CCN(CC3)c4ncccc4[N+](=O)[O-]	BroadT	BRD-K05238641	BRD-K05238641-001-06-8	Key Organics Ltd.	9X-0017			COc1ccc(cc1)-c1cc([nH]n1)C1CCN(CC1)c1ncccc1[N+]([O-])=O	InChI=1S/C20H21N5O3/c1-28-16-6-4-14(5-7-16)17-13-18(23-22-17)15-8-11-24(12-9-15)20-19(25(26)27)3-2-10-21-20/h2-7,10,13,15H,8-9,11-12H2,1H3,(H,22,23)	RXYLMVYPPGECAL-UHFFFAOYSA-N	379.164439582							121944
MS-3406	LSM-33388	SID14739886, BRD-K79796300	3767572	InChI=1S/C17H19NO3S/c1-12-9-10-15(16-14(12)11-17(2,3)21-16)18-22(19,20)13-7-5-4-6-8-13/h4-10,18H,11H2,1-3H3	XZCATKHLALMKMP-UHFFFAOYSA-N	Cc1ccc(NS(=O)(=O)c2ccccc2)c3OC(C)(C)Cc13	BroadT	BRD-K79796300	BRD-K79796300-001-05-0	Key Organics Ltd.	MS-3406			Cc1ccc(NS(=O)(=O)c2ccccc2)c2OC(C)(C)Cc12	InChI=1S/C17H19NO3S/c1-12-9-10-15(16-14(12)11-17(2,3)21-16)18-22(19,20)13-7-5-4-6-8-13/h4-10,18H,11H2,1-3H3	XZCATKHLALMKMP-UHFFFAOYSA-N	317.108564168							121945
MLS000092326	LSM-33389	SID4249799, BRD-K65767156	3243697	InChI=1S/C22H26N4O4S/c1-14-6-7-18(12-15(14)2)23-21(27)13-26(19-8-10-20(30-5)11-9-19)31(28,29)22-16(3)24-25-17(22)4/h6-12H,13H2,1-5H3,(H,23,27)(H,24,25)	QVTJDAICPQMUMU-UHFFFAOYSA-N	COc1ccc(cc1)N(CC(=O)Nc2ccc(C)c(C)c2)S(=O)(=O)c3c(C)n[nH]c3C	BroadT	BRD-K65767156	BRD-K65767156-001-05-2	ChemDiv Inc.	C517-2525			COc1ccc(cc1)N(CC(=O)Nc1ccc(C)c(C)c1)S(=O)(=O)c1c(C)n[nH]c1C	InChI=1S/C22H26N4O4S/c1-14-6-7-18(12-15(14)2)23-21(27)13-26(19-8-10-20(30-5)11-9-19)31(28,29)22-16(3)24-25-17(22)4/h6-12H,13H2,1-5H3,(H,23,27)(H,24,25)	QVTJDAICPQMUMU-UHFFFAOYSA-N	442.167476042							121946
4-(2-Fluorophenyl)-5-methyl-2-(2-phenoxyethyl)-2,4-dihydro-3H-1,2,4-triazol-3-one	LSM-33390	SID17411488, BRD-K51009748	3849116	InChI=1S/C17H16FN3O2/c1-13-19-20(11-12-23-14-7-3-2-4-8-14)17(22)21(13)16-10-6-5-9-15(16)18/h2-10H,11-12H2,1H3	SNNKFWKQLUZWTD-UHFFFAOYSA-N	CC1=NN(CCOc2ccccc2)C(=O)N1c3ccccc3F	BroadT	BRD-K51009748	BRD-K51009748-001-07-6	Key Organics Ltd.	12T-0308			Cc1nn(CCOc2ccccc2)c(=O)n1-c1ccccc1F	InChI=1S/C17H16FN3O2/c1-13-19-20(11-12-23-14-7-3-2-4-8-14)17(22)21(13)16-10-6-5-9-15(16)18/h2-10H,11-12H2,1H3	SNNKFWKQLUZWTD-UHFFFAOYSA-N	313.122654982							121947
MLS000779074	LSM-44471	SID26659078, BRD-K90518221	1940326	InChI=1S/C20H19NO3/c1-21(2)13-16-17(22)12-11-15-19(23)18(24-20(15)16)10-6-9-14-7-4-3-5-8-14/h3-12,22H,13H2,1-2H3/b9-6+,18-10-	AJSXKTMPEQNQES-CVCOPPNTSA-N	CN(C)Cc1c(O)ccc2C(=O)\C(=C\C=C\c3ccccc3)\Oc12	BroadT	BRD-K90518221	BRD-K90518221-001-07-5	InterBioScreen Ltd.	STOCK5S-47679			CN(C)Cc1c2O\C(=C/C=C/c3ccccc3)C(=O)c2ccc1O	InChI=1S/C20H19NO3/c1-21(2)13-16-17(22)12-11-15-19(23)18(24-20(15)16)10-6-9-14-7-4-3-5-8-14/h3-12,22H,13H2,1-2H3/b9-6+,18-10-	AJSXKTMPEQNQES-CVCOPPNTSA-N	321.136493478							
AO-081/41132595	LSM-44472	SID24806589, BRD-K14995049	5583763	InChI=1S/C21H19FN4O3S/c22-17-3-1-2-4-18(17)26-20(28)16(19(27)24-21(26)30)13-23-14-5-7-15(8-6-14)25-9-11-29-12-10-25/h1-8,13,23H,9-12H2,(H,24,27,30)/b16-13+	CWPOAFZREJLIBY-DTQAZKPQSA-N	Fc1ccccc1N2C(=S)NC(=O)\C(=C/Nc3ccc(cc3)N4CCOCC4)\C2=O	BroadT	BRD-K14995049	BRD-K14995049-001-06-0	ChemBridge Corporation	7075685			Fc1ccccc1N1C(=S)NC(=O)\C(=C/Nc2ccc(cc2)N2CCOCC2)C1=O	InChI=1S/C21H19FN4O3S/c22-17-3-1-2-4-18(17)26-20(28)16(19(27)24-21(26)30)13-23-14-5-7-15(8-6-14)25-9-11-29-12-10-25/h1-8,13,23H,9-12H2,(H,24,27,30)/b16-13+	CWPOAFZREJLIBY-DTQAZKPQSA-N	426.116189398							
F1316-0090	LSM-33393	SID14740894, BRD-K15062483	935829	InChI=1S/C17H21N3OS/c1-12-7-9-20(10-8-12)16(21)11-22-17-13(2)18-14-5-3-4-6-15(14)19-17/h3-6,12H,7-11H2,1-2H3	HVIVNCUXWMPBIJ-UHFFFAOYSA-N	CC1CCN(CC1)C(=O)CSc2nc3ccccc3nc2C	BroadT	BRD-K15062483	BRD-K15062483-001-05-3	InterBioScreen Ltd.	STOCK4S-10873			CC1CCN(CC1)C(=O)CSc1nc2ccccc2nc1C	InChI=1S/C17H21N3OS/c1-12-7-9-20(10-8-12)16(21)11-22-17-13(2)18-14-5-3-4-6-15(14)19-17/h3-6,12H,7-11H2,1-2H3	HVIVNCUXWMPBIJ-UHFFFAOYSA-N	315.140533012							121950
AC1O9WC5	LSM-33394	SID4263570, BRD-K52510091	6738723	InChI=1S/C20H16N2O2/c23-18-11-5-1-7-14(18)13-22-17-10-4-3-9-16(17)21-20(22)15-8-2-6-12-19(15)24/h1-12,23-24H,13H2	AGSGFBQWNNZFBC-UHFFFAOYSA-N	Oc1ccccc1Cn2c(nc3ccccc23)c4ccccc4O	BroadT	BRD-K52510091	BRD-K52510091-001-06-7	ChemBridge Corporation	5185638			Oc1ccccc1Cn1c(nc2ccccc12)-c1ccccc1O	InChI=1S/C20H16N2O2/c23-18-11-5-1-7-14(18)13-22-17-10-4-3-9-16(17)21-20(22)15-8-2-6-12-19(15)24/h1-12,23-24H,13H2	AGSGFBQWNNZFBC-UHFFFAOYSA-N	316.121177772							
AC1O0X6P	LSM-44473	SID17513507, BRD-A68848060	6079942	InChI=1S/C18H14Cl2N2O2/c1-10-6-14(10)17-5-3-13(24-17)7-11(9-21)18(23)22-16-4-2-12(19)8-15(16)20/h2-5,7-8,10,14H,6H2,1H3,(H,22,23)/b11-7+	WZTWKKZBWRGELO-YRNVUSSQSA-N	CC1CC1c2oc(\C=C(/C#N)\C(=O)Nc3ccc(Cl)cc3Cl)cc2	BroadT	BRD-A68848060	BRD-A68848060-001-05-4	InterBioScreen Ltd.	STOCK3S-05535			CC1CC1c1ccc(\C=C(/C#N)C(=O)Nc2ccc(Cl)cc2Cl)o1	InChI=1S/C18H14Cl2N2O2/c1-10-6-14(10)17-5-3-13(24-17)7-11(9-21)18(23)22-16-4-2-12(19)8-15(16)20/h2-5,7-8,10,14H,6H2,1H3,(H,22,23)/b11-7+	WZTWKKZBWRGELO-YRNVUSSQSA-N	360.043233128							
AC1N5MNE	LSM-33396	BRD-K81634971	4174058	InChI=1S/C17H19N3OS/c1-13(15-10-6-7-11-16(15)21-2)19-20-17(22)18-12-14-8-4-3-5-9-14/h3-11H,12H2,1-2H3,(H2,18,20,22)	ZMYLPJFGIDIKKI-UHFFFAOYSA-N	COc1ccccc1C(=NN=C(S)NCc2ccccc2)C	BroadT	BRD-K81634971	BRD-K81634971-001-05-7	Enamine Ltd.	T0511-0853			COc1ccccc1C(C)=NN=C(S)NCc1ccccc1	InChI=1S/C17H19N3OS/c1-13(15-10-6-7-11-16(15)21-2)19-20-17(22)18-12-14-8-4-3-5-9-14/h3-11H,12H2,1-2H3,(H2,18,20,22)	ZMYLPJFGIDIKKI-UHFFFAOYSA-N	313.124882948							121953
SMR000185373	LSM-44474	SID17415420, BRD-K55279790	5332505	InChI=1S/C21H20N2OS/c1-3-4-5-16-7-9-17(10-8-16)20-14-25-21(23-20)18(13-22)12-19-11-6-15(2)24-19/h6-12,14H,3-5H2,1-2H3/b18-12-	NWVQDLPVWVSDPK-PDGQHHTCSA-N	CCCCc1ccc(cc1)c2csc(n2)\C(=C/c3oc(C)cc3)\C#N	BroadT	BRD-K55279790	BRD-K55279790-001-06-0	ChemBridge Corporation	5322699			CCCCc1ccc(cc1)-c1csc(n1)C(=C/c1ccc(C)o1)\C#N	InChI=1S/C21H20N2OS/c1-3-4-5-16-7-9-17(10-8-16)20-14-25-21(23-20)18(13-22)12-19-11-6-15(2)24-19/h6-12,14H,3-5H2,1-2H3/b18-12-	NWVQDLPVWVSDPK-PDGQHHTCSA-N	348.12963397							
MLS000591733	LSM-33398	SID17513722, BRD-K09981426	948150	InChI=1S/C15H13F3N2OS/c16-15(17,18)21-13-8-6-12(7-9-13)20-14(22)19-10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,19,20,22)	LSPKTCDNEYNTJW-UHFFFAOYSA-N	FC(F)(F)Oc1ccc(NC(=NCc2ccccc2)S)cc1	BroadT	BRD-K09981426	BRD-K09981426-001-05-2	InterBioScreen Ltd.	STOCK2S-79578			FC(F)(F)Oc1ccc(NC(S)=NCc2ccccc2)cc1	InChI=1S/C15H13F3N2OS/c16-15(17,18)21-13-8-6-12(7-9-13)20-14(22)19-10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,19,20,22)	LSPKTCDNEYNTJW-UHFFFAOYSA-N	326.070068346							121955
STK138471	LSM-44475	SID17508370, BRD-K22248919	1068903	InChI=1S/C20H16N2O6/c23-17(9-11-19(25)26)21-15-7-3-1-5-13(15)14-6-2-4-8-16(14)22-18(24)10-12-20(27)28/h1-12H,(H,21,23)(H,22,24)(H,25,26)(H,27,28)/b11-9+,12-10+	MJBKJMRZCXDVGX-WGDLNXRISA-N	OC(=O)\C=C\C(=O)Nc1ccccc1c2ccccc2NC(=O)\C=C\C(=O)O	BroadT	BRD-K22248919	BRD-K22248919-001-05-3	Asinex Ltd.	BAS 00546387			OC(=O)\C=C\C(=O)Nc1ccccc1-c1ccccc1NC(=O)\C=C\C(O)=O	InChI=1S/C20H16N2O6/c23-17(9-11-19(25)26)21-15-7-3-1-5-13(15)14-6-2-4-8-16(14)22-18(24)10-12-20(27)28/h1-12H,(H,21,23)(H,22,24)(H,25,26)(H,27,28)/b11-9+,12-10+	MJBKJMRZCXDVGX-WGDLNXRISA-N	380.100836252							
MLS000517148	LSM-44476	SID24831999, BRD-K59169222	6244455	InChI=1S/C16H15N5O3/c17-11-14(10-13-2-4-15(5-3-13)21(23)24)16(22)19-6-1-8-20-9-7-18-12-20/h2-5,7,9-10,12H,1,6,8H2,(H,19,22)/b14-10+	UMSNOTULUFNTKK-GXDHUFHOSA-N	[O-][N+](=O)c1ccc(\C=C(/C#N)\C(=O)NCCCn2ccnc2)cc1	BroadT	BRD-K59169222	BRD-K59169222-001-05-9	Enamine Ltd.	T0516-9511			[O-][N+](=O)c1ccc(cc1)\C=C(/C#N)C(=O)NCCCn1ccnc1	InChI=1S/C16H15N5O3/c17-11-14(10-13-2-4-15(5-3-13)21(23)24)16(22)19-6-1-8-20-9-7-18-12-20/h2-5,7,9-10,12H,1,6,8H2,(H,19,22)/b14-10+	UMSNOTULUFNTKK-GXDHUFHOSA-N	325.11748939							
MLS001229989	LSM-33401	SID49824019, BRD-K09106639	19289050	InChI=1S/C21H22FN3O2/c1-3-25(4-2)17-10-7-15-11-18(20(23)27-19(15)12-17)21(26)24-13-14-5-8-16(22)9-6-14/h5-12,23H,3-4,13H2,1-2H3,(H,24,26)	UYDLEWMYCZRFFW-UHFFFAOYSA-N	CCN(CC)c1ccc2C=C(C(=O)NCc3ccc(F)cc3)C(=N)Oc2c1	BroadT	BRD-K09106639	BRD-K09106639-001-05-9	Chemical Technologies & Investigations	CNALOH-1024			CCN(CC)c1ccc2cc(C(=O)NCc3ccc(F)cc3)c(=N)oc2c1	InChI=1S/C21H22FN3O2/c1-3-25(4-2)17-10-7-15-11-18(20(23)27-19(15)12-17)21(26)24-13-14-5-8-16(22)9-6-14/h5-12,23H,3-4,13H2,1-2H3,(H,24,26)	UYDLEWMYCZRFFW-UHFFFAOYSA-N	367.169605174							121958
DHPC1_000730	LSM-33402	SID24841620, BRD-K68299095	6668464	InChI=1S/C31H30N2O5/c1-21(35)33-18-27(26-9-5-6-10-28(26)33)25-15-29(31(36)32-17-22-7-3-2-4-8-22)38-30(16-25)37-20-24-13-11-23(19-34)12-14-24/h2-15,18,25,30,34H,16-17,19-20H2,1H3,(H,32,36)/t25-,30+/m0/s1	HTBWZVXYGBAYPV-SETSBSEESA-N	CC(=O)n1cc([C@@H]2C[C@H](OCc3ccc(CO)cc3)OC(=C2)C(=O)NCc4ccccc4)c5ccccc15	BroadT	BRD-K68299095	BRD-K68299095-001-06-5	Harvard University	DHPC11_000204			CC(=O)n1cc([C@@H]2C[C@H](OCc3ccc(CO)cc3)OC(=C2)C(=O)NCc2ccccc2)c2ccccc12	InChI=1S/C31H30N2O5/c1-21(35)33-18-27(26-9-5-6-10-28(26)33)25-15-29(31(36)32-17-22-7-3-2-4-8-22)38-30(16-25)37-20-24-13-11-23(19-34)12-14-24/h2-15,18,25,30,34H,16-17,19-20H2,1H3,(H,32,36)/t25-,30+/m0/s1	HTBWZVXYGBAYPV-SETSBSEESA-N	510.21547208							121959
4-Methoxyphenyl 2-quinoxalinyl sulfone	LSM-33403	SID24816952, BRD-K36378500	4209634	InChI=1S/C15H12N2O3S/c1-20-11-6-8-12(9-7-11)21(18,19)15-10-16-13-4-2-3-5-14(13)17-15/h2-10H,1H3	RGXQURWAQNHJPC-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)c2cnc3ccccc3n2	BroadT	BRD-K36378500	BRD-K36378500-001-06-5	Key Organics Ltd.	2D-039			COc1ccc(cc1)S(=O)(=O)c1cnc2ccccc2n1	InChI=1S/C15H12N2O3S/c1-20-11-6-8-12(9-7-11)21(18,19)15-10-16-13-4-2-3-5-14(13)17-15/h2-10H,1H3	RGXQURWAQNHJPC-UHFFFAOYSA-N	300.056862954							121960
2-(1,3-Benzothiazol-2-ylmethoxy)phenol	LSM-33404	SID7975404, BRD-K00250569	761196	InChI=1S/C14H11NO2S/c16-11-6-2-3-7-12(11)17-9-14-15-10-5-1-4-8-13(10)18-14/h1-8,16H,9H2	RBWODSZEUGEGOO-UHFFFAOYSA-N	Oc1ccccc1OCc2nc3ccccc3s2	BroadT	BRD-K00250569	BRD-K00250569-001-05-8	ChemBridge Corporation	5156205			Oc1ccccc1OCc1nc2ccccc2s1	InChI=1S/C14H11NO2S/c16-11-6-2-3-7-12(11)17-9-14-15-10-5-1-4-8-13(10)18-14/h1-8,16H,9H2	RBWODSZEUGEGOO-UHFFFAOYSA-N	257.051049292							121961
SMR000046689	LSM-33405	SID864269, SID87349191, BRD-A18933326	5389943	InChI=1S/C23H20ClN5O3/c1-31-17-10-6-15(7-11-17)19-13-18(14-4-8-16(24)9-5-14)25-23-27-22(28-29(19)23)26-21(30)20-3-2-12-32-20/h2-12,18-19H,13H2,1H3,(H2,25,26,27,28,30)	TVHKAQHCZSRLDN-UHFFFAOYSA-N	COc1ccc(cc1)C2CC(Nc3nc(NC(=O)c4occc4)nn23)c5ccc(Cl)cc5	BroadT	BRD-A18933326	BRD-A18933326-001-04-8	InterBioScreen Ltd.	STOCK5S-10813			COc1ccc(cc1)C1CC(Nc2nc(NC(=O)c3ccco3)nn12)c1ccc(Cl)cc1	InChI=1S/C23H20ClN5O3/c1-31-17-10-6-15(7-11-17)19-13-18(14-4-8-16(24)9-5-14)25-23-27-22(28-29(19)23)26-21(30)20-3-2-12-32-20/h2-12,18-19H,13H2,1H3,(H2,25,26,27,28,30)	TVHKAQHCZSRLDN-UHFFFAOYSA-N	449.12546726							121962
T0513-1771	LSM-33406	SID24826480, BRD-A24331453	4424226	InChI=1S/C21H22BrN3OS/c1-13-3-8-18-16(11-13)17-12-24(2)10-9-19(17)25(18)21(27)23-20(26)14-4-6-15(22)7-5-14/h3-8,11,17,19H,9-10,12H2,1-2H3,(H,23,26,27)	PIZSXFVKTPLNGH-UHFFFAOYSA-N	CN1CCC2C(C1)c3cc(C)ccc3N2C(=S)NC(=O)c4ccc(Br)cc4	BroadT	BRD-A24331453	BRD-A24331453-001-06-7	Enamine Ltd.	T0513-1771			CN1CCC2C(C1)c1cc(C)ccc1N2C(=S)NC(=O)c1ccc(Br)cc1	InChI=1S/C21H22BrN3OS/c1-13-3-8-18-16(11-13)17-12-24(2)10-9-19(17)25(18)21(27)23-20(26)14-4-6-15(22)7-5-14/h3-8,11,17,19H,9-10,12H2,1-2H3,(H,23,26,27)	PIZSXFVKTPLNGH-UHFFFAOYSA-N	443.066695644							121963
8-(Dimethylamino)-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazin-6-one	LSM-33407	SID14742398, BRD-K62034673	1717864	InChI=1S/C9H13N3OS/c1-11(2)7-6-8(13)12-4-3-5-14-9(12)10-7/h6H,3-5H2,1-2H3	GFUSIYBQDRVGCD-UHFFFAOYSA-N	CN(C)C1=CC(=O)N2CCCSC2=N1	BroadT	BRD-K62034673	BRD-K62034673-001-05-4	InterBioScreen Ltd.	STOCK1S-24954			CN(C)c1cc(=O)n2CCCSc2n1	InChI=1S/C9H13N3OS/c1-11(2)7-6-8(13)12-4-3-5-14-9(12)10-7/h6H,3-5H2,1-2H3	GFUSIYBQDRVGCD-UHFFFAOYSA-N	211.077932756							121964
3-Benzyl-2,4-quinolinediol	LSM-33408	SID24801117, SID516120, BRD-K67575087	54680363	InChI=1S/C16H13NO2/c18-15-12-8-4-5-9-14(12)17-16(19)13(15)10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,17,18,19)	NVGZWGUUHGGGEY-UHFFFAOYSA-N	Oc1nc2ccccc2c(O)c1Cc3ccccc3	BroadT	BRD-K67575087	BRD-K67575087-001-05-1	Asinex Ltd.	BAS 00141321			Oc1nc2ccccc2c(O)c1Cc1ccccc1	InChI=1S/C16H13NO2/c18-15-12-8-4-5-9-14(12)17-16(19)13(15)10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,17,18,19)	NVGZWGUUHGGGEY-UHFFFAOYSA-N	251.094628666							121965
ST4054351	LSM-33409	SID7976451, BRD-K29901384	777911	InChI=1S/C15H20FNO/c1-2-15(18)12-7-8-14(13(16)11-12)17-9-5-3-4-6-10-17/h7-8,11H,2-6,9-10H2,1H3	FWEPWVLEYFZGBQ-UHFFFAOYSA-N	CCC(=O)c1ccc(N2CCCCCC2)c(F)c1	BroadT	BRD-K29901384	BRD-K29901384-001-05-6	ChemBridge Corporation	5935605			CCC(=O)c1ccc(N2CCCCCC2)c(F)c1	InChI=1S/C15H20FNO/c1-2-15(18)12-7-8-14(13(16)11-12)17-9-5-3-4-6-10-17/h7-8,11H,2-6,9-10H2,1H3	FWEPWVLEYFZGBQ-UHFFFAOYSA-N	249.15289247							121966
F0818-0023	LSM-33410	SID24809746, BRD-A96123516	2891810	InChI=1S/C16H12N2OS/c19-15-10-14(11-6-2-1-3-7-11)20-16-17-12-8-4-5-9-13(12)18(15)16/h1-9,14H,10H2	GXFUOCQAEIOYDU-UHFFFAOYSA-N	O=C1CC(Sc2nc3ccccc3n12)c4ccccc4	BroadT	BRD-A96123516	BRD-A96123516-001-06-6	Asinex Ltd.	BAS 03353023			O=C1CC(Sc2nc3ccccc3n12)c1ccccc1	InChI=1S/C16H12N2OS/c19-15-10-14(11-6-2-1-3-7-11)20-16-17-12-8-4-5-9-13(12)18(15)16/h1-9,14H,10H2	GXFUOCQAEIOYDU-UHFFFAOYSA-N	280.067033714							121967
BAS 00619398	LSM-33411	SID24806968, BRD-K47995064	799363	InChI=1S/C15H13N3O2/c1-2-4-12-11(3-1)17-15(18-12)16-8-10-5-6-13-14(7-10)20-9-19-13/h1-7H,8-9H2,(H2,16,17,18)	QXKFXLLCKVUQPZ-UHFFFAOYSA-N	C(Nc1nc2ccccc2[nH]1)c3ccc4OCOc4c3	BroadT	BRD-K47995064	BRD-K47995064-001-05-3	Asinex Ltd.	BAS 00619398			C(Nc1nc2ccccc2[nH]1)c1ccc2OCOc2c1	InChI=1S/C15H13N3O2/c1-2-4-12-11(3-1)17-15(18-12)16-8-10-5-6-13-14(7-10)20-9-19-13/h1-7H,8-9H2,(H2,16,17,18)	QXKFXLLCKVUQPZ-UHFFFAOYSA-N	267.100776686							121968
T5224483	LSM-33412	SID3715088, BRD-K85342376	2113123	InChI=1S/C21H22N2O5/c1-4-26-20-17(8-5-9-22-20)21(25)28-13-19(24)18-11-14(2)23(15(18)3)12-16-7-6-10-27-16/h5-11H,4,12-13H2,1-3H3	DUNPAYSIWIBJPH-UHFFFAOYSA-N	CCOc1ncccc1C(=O)OCC(=O)c2cc(C)n(Cc3occc3)c2C	BroadT	BRD-K85342376	BRD-K85342376-001-05-4	Enamine Ltd.	T5224483			CCOc1ncccc1C(=O)OCC(=O)c1cc(C)n(Cc2ccco2)c1C	InChI=1S/C21H22N2O5/c1-4-26-20-17(8-5-9-22-20)21(25)28-13-19(24)18-11-14(2)23(15(18)3)12-16-7-6-10-27-16/h5-11H,4,12-13H2,1-3H3	DUNPAYSIWIBJPH-UHFFFAOYSA-N	382.152871824							121969
5-(4-Methoxyphenyl)-2-[(phenylsulfonyl)methyl]-1,3-cyclohexanedione	LSM-33413	SID24822377, BRD-K42916143	2768907	InChI=1S/C20H20O5S/c1-25-16-9-7-14(8-10-16)15-11-19(21)18(20(22)12-15)13-26(23,24)17-5-3-2-4-6-17/h2-10,15,18H,11-13H2,1H3	OJZAFKHSOAGNHE-UHFFFAOYSA-N	COc1ccc(cc1)C2CC(=O)C(CS(=O)(=O)c3ccccc3)C(=O)C2	BroadT	BRD-K42916143	BRD-K42916143-001-05-9	Key Organics Ltd.	12H-927			COc1ccc(cc1)C1CC(=O)C(CS(=O)(=O)c2ccccc2)C(=O)C1	InChI=1S/C20H20O5S/c1-25-16-9-7-14(8-10-16)15-11-19(21)18(20(22)12-15)13-26(23,24)17-5-3-2-4-6-17/h2-10,15,18H,11-13H2,1H3	OJZAFKHSOAGNHE-UHFFFAOYSA-N	372.10314443							121970
MLS000712161	LSM-33414	SID24805302, BRD-K66826828	842272	InChI=1S/C16H17NO2S/c1-11-4-6-12(7-5-11)17-16(18)14-9-8-13(20-3)10-15(14)19-2/h4-10H,1-3H3,(H,17,18)	SZMZDGRRUAMHNH-UHFFFAOYSA-N	COc1cc(SC)ccc1C(=O)Nc2ccc(C)cc2	BroadT	BRD-K66826828	BRD-K66826828-001-05-3	Asinex Ltd.	BAS 02258303			COc1cc(SC)ccc1C(=O)Nc1ccc(C)cc1	InChI=1S/C16H17NO2S/c1-11-4-6-12(7-5-11)17-16(18)14-9-8-13(20-3)10-15(14)19-2/h4-10H,1-3H3,(H,17,18)	SZMZDGRRUAMHNH-UHFFFAOYSA-N	287.097999484							121971
MLS000588857	LSM-33415	SID17512137, BRD-K65087041	1926033	InChI=1S/C15H11ClF3N3OS/c16-12-7-2-1-6-11(12)13(23)21-22-14(24)20-10-5-3-4-9(8-10)15(17,18)19/h1-8H,(H,21,23)(H2,20,22,24)	DUNLTDLRKRNYCT-UHFFFAOYSA-N	FC(F)(F)c1cccc(NC(=NNC(=O)c2ccccc2Cl)S)c1	BroadT	BRD-K65087041	BRD-K65087041-001-05-4	InterBioScreen Ltd.	STOCK2S-21517			FC(F)(F)c1cccc(NC(S)=NNC(=O)c2ccccc2Cl)c1	InChI=1S/C15H11ClF3N3OS/c16-12-7-2-1-6-11(12)13(23)21-22-14(24)20-10-5-3-4-9(8-10)15(17,18)19/h1-8H,(H,21,23)(H2,20,22,24)	DUNLTDLRKRNYCT-UHFFFAOYSA-N	373.026345002							121972
SMR000136063	LSM-33416	SID14746082, BRD-K84184519	2930458	InChI=1S/C23H24N4O6S/c1-4-32-18-12-15(10-11-17(18)33-34(30,31)16-8-6-5-7-9-16)21(19-13(2)24-26-22(19)28)20-14(3)25-27-23(20)29/h5-12,21H,4H2,1-3H3,(H2,24,26,28)(H2,25,27,29)	LFVIVRYHSVBVAI-UHFFFAOYSA-N	CCOc1cc(ccc1OS(=O)(=O)c2ccccc2)C(c3c(C)n[nH]c3O)c4c(C)n[nH]c4O	BroadT	BRD-K84184519	BRD-K84184519-001-05-9	ChemBridge Corporation	7211761			CCOc1cc(ccc1OS(=O)(=O)c1ccccc1)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O	InChI=1S/C23H24N4O6S/c1-4-32-18-12-15(10-11-17(18)33-34(30,31)16-8-6-5-7-9-16)21(19-13(2)24-26-22(19)28)20-14(3)25-27-23(20)29/h5-12,21H,4H2,1-3H3,(H2,24,26,28)(H2,25,27,29)	LFVIVRYHSVBVAI-UHFFFAOYSA-N	484.141655218							121973
AA-504/06815017	LSM-33417	SID24787955, BRD-K51864673	1715241	InChI=1S/C17H17N3O4S/c1-23-13-9-7-12(8-10-13)16(22)18-17(25)20-19-15(21)11-24-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H,19,21)(H2,18,20,22,25)	IFXFLPMMUOUVJY-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NC(=S)NNC(=O)COc2ccccc2	BroadT	BRD-K51864673	BRD-K51864673-001-06-5	Specs	AA-504/06815017			COc1ccc(cc1)C(=O)NC(=S)NNC(=O)COc1ccccc1	InChI=1S/C17H17N3O4S/c1-23-13-9-7-12(8-10-13)16(22)18-17(25)20-19-15(21)11-24-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H,19,21)(H2,18,20,22,25)	IFXFLPMMUOUVJY-UHFFFAOYSA-N	359.093976744							121974
Methyl 2-morpholino-5-[({2-(trifluoromethyl)-5-[4-(trifluoromethyl)phenyl]-3-furyl}carbonyl)amino]benzoate	LSM-33418	SID26729560, BRD-K04263212	2810078	InChI=1S/C25H20F6N2O5/c1-36-23(35)17-12-16(6-7-19(17)33-8-10-37-11-9-33)32-22(34)18-13-20(38-21(18)25(29,30)31)14-2-4-15(5-3-14)24(26,27)28/h2-7,12-13H,8-11H2,1H3,(H,32,34)	CYNIDOGOUBBKRN-UHFFFAOYSA-N	COC(=O)c1cc(NC(=O)c2cc(oc2C(F)(F)F)c3ccc(cc3)C(F)(F)F)ccc1N4CCOCC4	BroadT	BRD-K04263212	BRD-K04263212-001-05-8	Maybridge	HTS 01354			COC(=O)c1cc(NC(=O)c2cc(oc2C(F)(F)F)-c2ccc(cc2)C(F)(F)F)ccc1N1CCOCC1	InChI=1S/C25H20F6N2O5/c1-36-23(35)17-12-16(6-7-19(17)33-8-10-37-11-9-33)32-22(34)18-13-20(38-21(18)25(29,30)31)14-2-4-15(5-3-14)24(26,27)28/h2-7,12-13H,8-11H2,1H3,(H,32,34)	CYNIDOGOUBBKRN-UHFFFAOYSA-N	542.12764096							121975
MLS000594557	LSM-33419	SID14719253, BRD-K61111348	1774128	InChI=1S/C14H17FN4OS/c1-14(2,3)19-12(20)8-21-13(17-9-16)18-11-7-5-4-6-10(11)15/h4-7H,8H2,1-3H3,(H,17,18)(H,19,20)	VFFBPTSOJOREGU-UHFFFAOYSA-N	CC(C)(C)NC(=O)CSC(=NC#N)Nc1ccccc1F	BroadT	BRD-K61111348	BRD-K61111348-001-05-6	Specs	AM-807/14960400			CC(C)(C)NC(=O)CSC(Nc1ccccc1F)=NC#N	InChI=1S/C14H17FN4OS/c1-14(2,3)19-12(20)8-21-13(17-9-16)18-11-7-5-4-6-10(11)15/h4-7H,8H2,1-3H3,(H,17,18)(H,19,20)	VFFBPTSOJOREGU-UHFFFAOYSA-N	308.110710094							121976
MLS000756626	LSM-33420	SID26664572, BRD-K77703126	322430	InChI=1S/C13H16O4/c1-2-3-4-5-11(15)13(17)10-7-6-9(14)8-12(10)16/h6-8,14,16H,2-5H2,1H3	XPGRGRKFZXQRJZ-UHFFFAOYSA-N	CCCCCC(=O)C(=O)c1ccc(O)cc1O	BroadT	BRD-K77703126	BRD-K77703126-001-05-0	National Cancer Institute Chemotherapeutic Agents Repository	279895			CCCCCC(=O)C(=O)c1ccc(O)cc1O	InChI=1S/C13H16O4/c1-2-3-4-5-11(15)13(17)10-7-6-9(14)8-12(10)16/h6-8,14,16H,2-5H2,1H3	XPGRGRKFZXQRJZ-UHFFFAOYSA-N	236.104858992							121977
AC1MHCPI	LSM-33421	BRD-K97812099	2999877	InChI=1S/C13H8ClN5S/c14-12-11(18-5-6-20-13(18)17-12)7-16-19-8-15-9-3-1-2-4-10(9)19/h1-8H	HPJLFSDWHCCGIL-UHFFFAOYSA-N	Clc1nc2sccn2c1C=Nn3cnc4ccccc34	BroadT	BRD-K97812099	BRD-K97812099-001-05-8	Enamine Ltd.	T0503-3633			Clc1nc2sccn2c1C=Nn1cnc2ccccc12	InChI=1S/C13H8ClN5S/c14-12-11(18-5-6-20-13(18)17-12)7-16-19-8-15-9-3-1-2-4-10(9)19/h1-8H	HPJLFSDWHCCGIL-UHFFFAOYSA-N	301.018893706							121978
ASN 03272530	LSM-33422	SID17507694, BRD-K12021538	1175169	InChI=1S/C25H25N3O3S/c1-16-10-11-18-13-19(24(29)27-23(18)17(16)2)14-28(15-20-7-6-12-31-20)25(32)26-21-8-4-5-9-22(21)30-3/h4-13H,14-15H2,1-3H3,(H,26,32)(H,27,29)	HQGSLGNBGZYIFD-UHFFFAOYSA-N	COc1ccccc1N=C(S)N(Cc2occc2)Cc3cc4ccc(C)c(C)c4nc3O	BroadT	BRD-K12021538	BRD-K12021538-001-06-5	Asinex Ltd.	ASN 03272530			COc1ccccc1N=C(S)N(Cc1ccco1)Cc1cc2ccc(C)c(C)c2nc1O	InChI=1S/C25H25N3O3S/c1-16-10-11-18-13-19(24(29)27-23(18)17(16)2)14-28(15-20-7-6-12-31-20)25(32)26-21-8-4-5-9-22(21)30-3/h4-13H,14-15H2,1-3H3,(H,26,32)(H,27,29)	HQGSLGNBGZYIFD-UHFFFAOYSA-N	447.16166238							121979
SMR000061972	LSM-33423	SID26670403, SID3715033, BRD-K23246129	2412219	InChI=1S/C17H19N9OS/c1-3-18-14-22-15(19-4-2)26-16(23-14)24-25-17(26)28-9-12-20-11-8-6-5-7-10(11)13(27)21-12/h5-8H,3-4,9H2,1-2H3,(H,20,21,27)(H2,18,19,22,23,24)	IECJXZRDSYZSHQ-UHFFFAOYSA-N	CCNc1nc(NCC)n2c(SCc3nc(O)c4ccccc4n3)nnc2n1	BroadT	BRD-K23246129	BRD-K23246129-001-05-2	Enamine Ltd.	T0512-4437			CCNc1nc(NCC)n2c(SCc3nc(O)c4ccccc4n3)nnc2n1	InChI=1S/C17H19N9OS/c1-3-18-14-22-15(19-4-2)26-16(23-14)24-25-17(26)28-9-12-20-11-8-6-5-7-10(11)13(27)21-12/h5-8H,3-4,9H2,1-2H3,(H,20,21,27)(H2,18,19,22,23,24)	IECJXZRDSYZSHQ-UHFFFAOYSA-N	397.143327008							121980
MLS000540802	LSM-33424	SID17385868, BRD-K95454910	1014972	InChI=1S/C20H18BrN3O4S2/c1-12-9-13(2)11-15(10-12)24-30(26,27)16-5-3-14(4-6-16)22-20(29)23-19(25)17-7-8-18(21)28-17/h3-11,24H,1-2H3,(H2,22,23,25,29)	JCZWJROKBALQHR-UHFFFAOYSA-N	Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3oc(Br)cc3)cc2)c1	BroadT	BRD-K95454910	BRD-K95454910-001-05-8	Specs	AN-329/41574572			Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3ccc(Br)o3)cc2)c1	InChI=1S/C20H18BrN3O4S2/c1-12-9-13(2)11-15(10-12)24-30(26,27)16-5-3-14(4-6-16)22-20(29)23-19(25)17-7-8-18(21)28-17/h3-11,24H,1-2H3,(H2,22,23,25,29)	JCZWJROKBALQHR-UHFFFAOYSA-N	506.992210066							121981
1',3'-Dimethyl-7',9'-dihydrospiro[indole-3,8'-purine]-2,2',6'(1H,1'h,3'h)-trione	LSM-33425	SID26666820, BRD-A09645129	272594	InChI=1S/C14H13N5O3/c1-18-10-9(11(20)19(2)13(18)22)16-14(17-10)7-5-3-4-6-8(7)15-12(14)21/h3-6,16-17H,1-2H3,(H,15,21)	GWLRDSXEAJOUHI-UHFFFAOYSA-N	CN1C(=O)N(C)C(=O)C2=C1NC3(N2)C(=O)Nc4ccccc34	BroadT	BRD-A09645129	BRD-A09645129-001-05-5	National Cancer Institute Chemotherapeutic Agents Repository	117197			Cn1c2NC3(Nc2c(=O)n(C)c1=O)C(=O)Nc1ccccc31	InChI=1S/C14H13N5O3/c1-18-10-9(11(20)19(2)13(18)22)16-14(17-10)7-5-3-4-6-8(7)15-12(14)21/h3-6,16-17H,1-2H3,(H,15,21)	GWLRDSXEAJOUHI-UHFFFAOYSA-N	299.101839326							121982
AC1MTGR1	LSM-33426	BRD-K40899925	3600919	InChI=1S/C23H18N4O3/c28-27(29)20-10-13-23(24-15-20)26-25-14-17-8-11-21(12-9-17)30-16-19-6-3-5-18-4-1-2-7-22(18)19/h1-15H,16H2,(H,24,26)	SFOWSFRAUJGEOT-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(NN=Cc2ccc(OCc3cccc4ccccc34)cc2)nc1	BroadT	BRD-K40899925	BRD-K40899925-001-06-1	InterBioScreen Ltd.	STOCK2S-32785			[O-][N+](=O)c1ccc(NN=Cc2ccc(OCc3cccc4ccccc34)cc2)nc1	InChI=1S/C23H18N4O3/c28-27(29)20-10-13-23(24-15-20)26-25-14-17-8-11-21(12-9-17)30-16-19-6-3-5-18-4-1-2-7-22(18)19/h1-15H,16H2,(H,24,26)	SFOWSFRAUJGEOT-UHFFFAOYSA-N	398.137890476							121983
T0510-0796	LSM-33427	SID24834174, BRD-A54602194	4529864	InChI=1S/C25H30N2O7S/c1-15(21-12-16-3-4-17(21)11-16)26-24(29)14-34-25(30)22-13-20(9-10-23(22)28)35(31,32)27-18-5-7-19(33-2)8-6-18/h5-10,13,15-17,21,27-28H,3-4,11-12,14H2,1-2H3,(H,26,29)	NSWHJFJPCSXWJG-UHFFFAOYSA-N	COc1ccc(NS(=O)(=O)c2ccc(O)c(c2)C(=O)OCC(=O)NC(C)C3CC4CCC3C4)cc1	BroadT	BRD-A54602194	BRD-A54602194-001-05-0	Enamine Ltd.	T0510-0796			COc1ccc(NS(=O)(=O)c2ccc(O)c(c2)C(=O)OCC(=O)NC(C)C2CC3CCC2C3)cc1	InChI=1S/C25H30N2O7S/c1-15(21-12-16-3-4-17(21)11-16)26-24(29)14-34-25(30)22-13-20(9-10-23(22)28)35(31,32)27-18-5-7-19(33-2)8-6-18/h5-10,13,15-17,21,27-28H,3-4,11-12,14H2,1-2H3,(H,26,29)	NSWHJFJPCSXWJG-UHFFFAOYSA-N	502.17737201							121984
AM-807/14958013	LSM-33428	SID14727573, BRD-A00430899	4232355	InChI=1S/C25H22FN5O3S/c1-31-8-7-19-16(12-31)9-15(10-27)24(30-19)35-13-20-22(25(32)33-2)21(18(11-28)23(29)34-20)14-3-5-17(26)6-4-14/h3-6,9,21H,7-8,12-13,29H2,1-2H3	MADHSJGAYLGOTF-UHFFFAOYSA-N	COC(=O)C1=C(CSc2nc3CCN(C)Cc3cc2C#N)OC(=C(C#N)C1c4ccc(F)cc4)N	BroadT	BRD-A00430899	BRD-A00430899-001-05-9	Specs	AM-807/14958013			COC(=O)C1=C(CSc2nc3CCN(C)Cc3cc2C#N)OC(N)=C(C#N)C1c1ccc(F)cc1	InChI=1S/C25H22FN5O3S/c1-31-8-7-19-16(12-31)9-15(10-27)24(30-19)35-13-20-22(25(32)33-2)21(18(11-28)23(29)34-20)14-3-5-17(26)6-4-14/h3-6,9,21H,7-8,12-13,29H2,1-2H3	MADHSJGAYLGOTF-UHFFFAOYSA-N	491.142738504							121985
MLS000030735	LSM-33429	SID851536, BRD-A10325891	654111	InChI=1S/C17H19ClN4O2S/c1-4-10(2)25-17-19-14-13(15(23)20-16(24)21(14)3)22(17)9-11-5-7-12(18)8-6-11/h5-8,10H,4,9H2,1-3H3,(H,20,23,24)	HWJUDZZLUIULRG-UHFFFAOYSA-N	CCC(C)Sc1nc2N(C)C(=O)NC(=O)c2n1Cc3ccc(Cl)cc3	BroadT	BRD-A10325891	BRD-A10325891-001-05-7	Asinex Ltd.	BAS 00553004			CCC(C)Sc1nc2n(C)c(=O)[nH]c(=O)c2n1Cc1ccc(Cl)cc1	InChI=1S/C17H19ClN4O2S/c1-4-10(2)25-17-19-14-13(15(23)20-16(24)21(14)3)22(17)9-11-5-7-12(18)8-6-11/h5-8,10H,4,9H2,1-3H3,(H,20,23,24)	HWJUDZZLUIULRG-UHFFFAOYSA-N	378.091724288							121986
SMR000067934	LSM-33430	SID3713010, BRD-K22053600	2620848	InChI=1S/C20H17ClN4O3S2/c1-12-16(13(2)28-24-12)11-29-20-19(22-17-5-3-4-6-18(17)23-20)25-30(26,27)15-9-7-14(21)8-10-15/h3-10H,11H2,1-2H3,(H,22,25)	MLASQECPPSXFLM-UHFFFAOYSA-N	Cc1onc(C)c1CSc2nc3ccccc3nc2NS(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K22053600	BRD-K22053600-001-07-7	Enamine Ltd.	T5331685			Cc1noc(C)c1CSc1nc2ccccc2nc1NS(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C20H17ClN4O3S2/c1-12-16(13(2)28-24-12)11-29-20-19(22-17-5-3-4-6-18(17)23-20)25-30(26,27)15-9-7-14(21)8-10-15/h3-10H,11H2,1-2H3,(H,22,25)	MLASQECPPSXFLM-UHFFFAOYSA-N	460.043059534							121987
T5243820	LSM-33431	SID24837419, BRD-K67390150	4034696	InChI=1S/C26H32FN3O6S/c27-21-6-4-20(5-7-21)10-11-28-25(31)19-36-26(32)23-18-22(37(33,34)30-12-2-1-3-13-30)8-9-24(23)29-14-16-35-17-15-29/h4-9,18H,1-3,10-17,19H2,(H,28,31)	VPIGKJFHIVVXCS-UHFFFAOYSA-N	Fc1ccc(CCNC(=O)COC(=O)c2cc(ccc2N3CCOCC3)S(=O)(=O)N4CCCCC4)cc1	BroadT	BRD-K67390150	BRD-K67390150-001-05-7	Enamine Ltd.	T5243820			Fc1ccc(CCNC(=O)COC(=O)c2cc(ccc2N2CCOCC2)S(=O)(=O)N2CCCCC2)cc1	InChI=1S/C26H32FN3O6S/c27-21-6-4-20(5-7-21)10-11-28-25(31)19-36-26(32)23-18-22(37(33,34)30-12-2-1-3-13-30)8-9-24(23)29-14-16-35-17-15-29/h4-9,18H,1-3,10-17,19H2,(H,28,31)	VPIGKJFHIVVXCS-UHFFFAOYSA-N	533.199584664							121988
SMR000151001	LSM-33432	SID16953628, BRD-A39317952	4235983	InChI=1S/C24H23N3O4S/c1-15-8-9-17-19(12-25)23(32-21(17)11-15)27-22(28)14-31-24(29)18-6-2-3-7-20(18)26-13-16-5-4-10-30-16/h2-7,10,15,26H,8-9,11,13-14H2,1H3,(H,27,28)	SDBYKVFCYXCLGP-UHFFFAOYSA-N	CC1CCc2c(C1)sc(NC(=O)COC(=O)c3ccccc3NCc4occc4)c2C#N	BroadT	BRD-A39317952	BRD-A39317952-001-06-5	Enamine Ltd.	T5284903			CC1CCc2c(C1)sc(NC(=O)COC(=O)c1ccccc1NCc1ccco1)c2C#N	InChI=1S/C24H23N3O4S/c1-15-8-9-17-19(12-25)23(32-21(17)11-15)27-22(28)14-31-24(29)18-6-2-3-7-20(18)26-13-16-5-4-10-30-16/h2-7,10,15,26H,8-9,11,13-14H2,1H3,(H,27,28)	SDBYKVFCYXCLGP-UHFFFAOYSA-N	449.140926936							121989
STK508944	LSM-44477	SID14735737, BRD-K18250782	6401209	InChI=1S/C13H14N4S/c1-8(2)7-18-13-15-12-11(16-17-13)9-5-3-4-6-10(9)14-12/h3-6,8,16H,7H2,1-2H3	IYWZVSXMWXGDFG-UHFFFAOYSA-N	CC(C)CSc1n[nH]c2c3ccccc3nc2n1	BroadT	BRD-K18250782	BRD-K18250782-001-06-7	ChemBridge Corporation	5483569			CC(C)CSc1n[nH]c2c(nc3ccccc23)n1	InChI=1S/C13H14N4S/c1-8(2)7-18-13-15-12-11(16-17-13)9-5-3-4-6-10(9)14-12/h3-6,8,16H,7H2,1-2H3	IYWZVSXMWXGDFG-UHFFFAOYSA-N	258.093917178							
MLS000573087	LSM-33434	SID17432636, BRD-A32933415	2836994	InChI=1S/C17H17ClN2O2S/c18-14-11-3-1-2-4-13(11)23-15(14)17(22)20-19-16(21)12-8-9-5-6-10(12)7-9/h1-4,9-10,12H,5-8H2,(H,19,21)(H,20,22)	LAZRVSMNESJTSW-UHFFFAOYSA-N	Clc1c(sc2ccccc12)C(=O)NNC(=O)C3CC4CCC3C4	BroadT	BRD-A32933415	BRD-A32933415-001-05-9	ChemBridge Corporation	5245335			Clc1c(sc2ccccc12)C(=O)NNC(=O)C1CC2CCC1C2	InChI=1S/C17H17ClN2O2S/c18-14-11-3-1-2-4-13(11)23-15(14)17(22)20-19-16(21)12-8-9-5-6-10(12)7-9/h1-4,9-10,12H,5-8H2,(H,19,21)(H,20,22)	LAZRVSMNESJTSW-UHFFFAOYSA-N	348.069926204							121991
CHEMBL1547372	LSM-33435	SID50102373, SID859733, BRD-K78496035	661037	InChI=1S/C11H8ClN3O/c1-14-11-9(6-13)15-10(16-11)7-2-4-8(12)5-3-7/h2-5,14H,1H3	FOBQPWQGVDGQBL-UHFFFAOYSA-N	CNc1oc(nc1C#N)c2ccc(Cl)cc2	BroadT	BRD-K78496035	BRD-K78496035-001-05-0	InterBioScreen Ltd.	STOCK3S-32901			CNc1oc(nc1C#N)-c1ccc(Cl)cc1	InChI=1S/C11H8ClN3O/c1-14-11-9(6-13)15-10(16-11)7-2-4-8(12)5-3-7/h2-5,14H,1H3	FOBQPWQGVDGQBL-UHFFFAOYSA-N	233.035589616							121992
SMR000172859	LSM-33436	SID17408936, BRD-K04687551	3190117	InChI=1S/C26H31FN6O2/c1-18(2)14-15-28-24(34)16-32(23-13-7-9-19-8-3-4-10-20(19)23)25(35)17-33-30-26(29-31-33)21-11-5-6-12-22(21)27/h5-7,9,11-13,18H,3-4,8,10,14-17H2,1-2H3,(H,28,34)	FSBGJVDQCVGUAA-UHFFFAOYSA-N	CC(C)CCNC(=O)CN(C(=O)Cn1nnc(n1)c2ccccc2F)c3cccc4CCCCc34	BroadT	BRD-K04687551	BRD-K04687551-001-05-7	Asinex Ltd.	ASN 04488258			CC(C)CCNC(=O)CN(C(=O)Cn1nnc(n1)-c1ccccc1F)c1cccc2CCCCc12	InChI=1S/C26H31FN6O2/c1-18(2)14-15-28-24(34)16-32(23-13-7-9-19-8-3-4-10-20(19)23)25(35)17-33-30-26(29-31-33)21-11-5-6-12-22(21)27/h5-7,9,11-13,18H,3-4,8,10,14-17H2,1-2H3,(H,28,34)	FSBGJVDQCVGUAA-UHFFFAOYSA-N	478.249252492							121993
AC1LFV0M	LSM-33437	BRD-K32601620	760424	InChI=1S/C14H14N2O2/c1-10-8-13(11(2)18-10)14(17)16-15-9-12-6-4-3-5-7-12/h3-9H,1-2H3,(H,16,17)	LKDFFNWDRZUSIQ-UHFFFAOYSA-N	Cc1oc(C)c(c1)C(=O)NN=Cc2ccccc2	BroadT	BRD-K32601620	BRD-K32601620-001-05-1	InterBioScreen Ltd.	STOCK3S-69388			Cc1cc(C(=O)NN=Cc2ccccc2)c(C)o1	InChI=1S/C14H14N2O2/c1-10-8-13(11(2)18-10)14(17)16-15-9-12-6-4-3-5-7-12/h3-9H,1-2H3,(H,16,17)	LKDFFNWDRZUSIQ-UHFFFAOYSA-N	242.105527708							121994
MLS000859306	LSM-33438	SID26729165, BRD-K65781692	2742651	InChI=1S/C12H6ClFN4O/c13-9-5-7(14)1-2-8(9)12-17-11(18-19-12)10-6-15-3-4-16-10/h1-6H	UZPLBNVRQRJTAB-UHFFFAOYSA-N	Fc1ccc(c(Cl)c1)c2onc(n2)c3cnccn3	BroadT	BRD-K65781692	BRD-K65781692-001-06-2	Maybridge	SP 00843			Fc1ccc(-c2nc(no2)-c2cnccn2)c(Cl)c1	InChI=1S/C12H6ClFN4O/c13-9-5-7(14)1-2-8(9)12-17-11(18-19-12)10-6-15-3-4-16-10/h1-6H	UZPLBNVRQRJTAB-UHFFFAOYSA-N	276.021416762							121995
MLS000662167	LSM-33439	SID24794202, BRD-A95149992	2945758	InChI=1S/C19H23N3OS/c23-14-15-5-4-12-22(13-15)19(24)21-18-10-8-17(9-11-18)20-16-6-2-1-3-7-16/h1-3,6-11,15,20,23H,4-5,12-14H2,(H,21,24)	HIXBRALZYPDXBM-UHFFFAOYSA-N	OCC1CCCN(C1)C(=Nc2ccc(Nc3ccccc3)cc2)S	BroadT	BRD-A95149992	BRD-A95149992-001-05-7	ChemBridge Corporation	7655364			OCC1CCCN(C1)C(S)=Nc1ccc(Nc2ccccc2)cc1	InChI=1S/C19H23N3OS/c23-14-15-5-4-12-22(13-15)19(24)21-18-10-8-17(9-11-18)20-16-6-2-1-3-7-16/h1-3,6-11,15,20,23H,4-5,12-14H2,(H,21,24)	HIXBRALZYPDXBM-UHFFFAOYSA-N	341.156183076							121996
AC1NSEIR	LSM-33440	SID7966643, BRD-K45326926	5308348	InChI=1S/C18H18N2OS/c1-2-20-15-8-10-22-17(15)11-16(20)18(21)19-9-7-13-5-3-4-6-14(13)12-19/h3-6,8,10-11H,2,7,9,12H2,1H3	JXLPIBCMUXRALJ-UHFFFAOYSA-N	CCn1c(cc2sccc12)C(=O)N3CCc4ccccc4C3	BroadT	BRD-K45326926	BRD-K45326926-001-05-1	ChemDiv Inc.	C703-1154			CCn1c(cc2sccc12)C(=O)N1CCc2ccccc2C1	InChI=1S/C18H18N2OS/c1-2-20-15-8-10-22-17(15)11-16(20)18(21)19-9-7-13-5-3-4-6-14(13)12-19/h3-6,8,10-11H,2,7,9,12H2,1H3	JXLPIBCMUXRALJ-UHFFFAOYSA-N	310.113983906							121997
MLS000113442	LSM-33441	SID26668571, SID7973338, BRD-K72280346	2926725	InChI=1S/C24H30N4O4S/c1-2-32-24(31)27-14-12-26(13-15-27)21(29)18-8-9-19-20(16-18)25-23(33)28(22(19)30)11-10-17-6-4-3-5-7-17/h6,8-9,16H,2-5,7,10-15H2,1H3,(H,25,33)	YJNYMVSEUUODFE-UHFFFAOYSA-N	CCOC(=O)N1CCN(CC1)C(=O)c2ccc3C(=O)N(CCC4=CCCCC4)C(=S)Nc3c2	BroadT	BRD-K72280346	BRD-K72280346-001-06-6	ChemBridge Corporation	7112823			CCOC(=O)N1CCN(CC1)C(=O)c1ccc2c(c1)[nH]c(=S)n(CCC1=CCCCC1)c2=O	InChI=1S/C24H30N4O4S/c1-2-32-24(31)27-14-12-26(13-15-27)21(29)18-8-9-19-20(16-18)25-23(33)28(22(19)30)11-10-17-6-4-3-5-7-17/h6,8-9,16H,2-5,7,10-15H2,1H3,(H,25,33)	YJNYMVSEUUODFE-UHFFFAOYSA-N	470.19877617							121998
MLS000123087	LSM-33442	SID16952960, BRD-K47056313	3205780	InChI=1S/C22H19N3O3/c1-14-8-9-25-20(10-14)24-21(16-3-5-17(26)6-4-16)22(25)23-12-15-2-7-18-19(11-15)28-13-27-18/h2-11,23,26H,12-13H2,1H3	RMNOPEFPXPCWOO-UHFFFAOYSA-N	Cc1ccn2c(NCc3ccc4OCOc4c3)c(nc2c1)c5ccc(O)cc5	BroadT	BRD-K47056313	BRD-K47056313-001-05-3	Asinex Ltd.	ASN 05397250			Cc1ccn2c(NCc3ccc4OCOc4c3)c(nc2c1)-c1ccc(O)cc1	InChI=1S/C22H19N3O3/c1-14-8-9-25-20(10-14)24-21(16-3-5-17(26)6-4-16)22(25)23-12-15-2-7-18-19(11-15)28-13-27-18/h2-11,23,26H,12-13H2,1H3	RMNOPEFPXPCWOO-UHFFFAOYSA-N	373.142641498							121999
T0503-3453	LSM-33443	SID22404894, BRD-K15679248	2317626	InChI=1S/C16H18N4O/c21-16(20-19-15-6-3-9-17-15)11-18-14-8-7-12-4-1-2-5-13(12)10-14/h1-2,4-5,7-8,10,18H,3,6,9,11H2,(H,17,19)(H,20,21)	APJLVPXFLCTIJX-UHFFFAOYSA-N	O=C(CNc1ccc2ccccc2c1)NNC3=NCCC3	BroadT	BRD-K15679248	BRD-K15679248-001-06-8	Enamine Ltd.	T0503-3453			O=C(CNc1ccc2ccccc2c1)NNC1=NCCC1	InChI=1S/C16H18N4O/c21-16(20-19-15-6-3-9-17-15)11-18-14-8-7-12-4-1-2-5-13(12)10-14/h1-2,4-5,7-8,10,18H,3,6,9,11H2,(H,17,19)(H,20,21)	APJLVPXFLCTIJX-UHFFFAOYSA-N	282.148061236							122000
2-[(1,3-Benzothiazol-2-ylsulfanyl)acetyl]-n-phenylhydrazinecarbothioamide	LSM-33444	SID17513742, BRD-K67616172	1553611	InChI=1S/C16H14N4OS3/c21-14(19-20-15(22)17-11-6-2-1-3-7-11)10-23-16-18-12-8-4-5-9-13(12)24-16/h1-9H,10H2,(H,19,21)(H2,17,20,22)	DFAFLKGFRRZSKK-UHFFFAOYSA-N	O=C(CSc1nc2ccccc2s1)NNC(=S)Nc3ccccc3	BroadT	BRD-K67616172	BRD-K67616172-001-05-9	InterBioScreen Ltd.	STOCK3S-63459			O=C(CSc1nc2ccccc2s1)NNC(=S)Nc1ccccc1	InChI=1S/C16H14N4OS3/c21-14(19-20-15(22)17-11-6-2-1-3-7-11)10-23-16-18-12-8-4-5-9-13(12)24-16/h1-9H,10H2,(H,19,21)(H2,17,20,22)	DFAFLKGFRRZSKK-UHFFFAOYSA-N	374.032973178							122001
STK077707	LSM-33445	SID49816480, BRD-K75846607	1230975	InChI=1S/C22H20N2O5/c25-19(23-15-6-4-5-14(11-15)22(28)29)13-9-10-17-18(12-13)21(27)24(20(17)26)16-7-2-1-3-8-16/h4-6,9-12,16H,1-3,7-8H2,(H,23,25)(H,28,29)	FXDLPTVXBDPKOE-UHFFFAOYSA-N	OC(=O)c1cccc(NC(=O)c2ccc3C(=O)N(C4CCCCC4)C(=O)c3c2)c1	BroadT	BRD-K75846607	BRD-K75846607-001-05-7	ChemBridge Corporation	7084279			OC(=O)c1cccc(NC(=O)c2ccc3C(=O)N(C4CCCCC4)C(=O)c3c2)c1	InChI=1S/C22H20N2O5/c25-19(23-15-6-4-5-14(11-15)22(28)29)13-9-10-17-18(12-13)21(27)24(20(17)26)16-7-2-1-3-8-16/h4-6,9-12,16H,1-3,7-8H2,(H,23,25)(H,28,29)	FXDLPTVXBDPKOE-UHFFFAOYSA-N	392.13722176							122002
T5250169	LSM-33446	SID24829233, BRD-K82081984	5149280	InChI=1S/C10H8ClN5S/c11-7-1-2-9-14-8(4-16(9)3-7)5-17-10-12-6-13-15-10/h1-4,6H,5H2,(H,12,13,15)	KUPAUUGPMCWERI-UHFFFAOYSA-N	Clc1ccc2nc(CSc3nc[nH]n3)cn2c1	BroadT	BRD-K82081984	BRD-K82081984-001-05-5	Enamine Ltd.	T5250169			Clc1ccc2nc(CSc3nc[nH]n3)cn2c1	InChI=1S/C10H8ClN5S/c11-7-1-2-9-14-8(4-16(9)3-7)5-17-10-12-6-13-15-10/h1-4,6H,5H2,(H,12,13,15)	KUPAUUGPMCWERI-UHFFFAOYSA-N	265.018893706							122003
MLS000570346	LSM-33447	SID14746921, BRD-K02130669	2100448	InChI=1S/C18H21N3O4/c19-10-13-6-8-15(9-7-13)21-16(22)12-25-17(23)11-20-18(24)14-4-2-1-3-5-14/h6-9,14H,1-5,11-12H2,(H,20,24)(H,21,22)	FNDKZAFZEOXKPT-UHFFFAOYSA-N	O=C(COC(=O)CNC(=O)C1CCCCC1)Nc2ccc(cc2)C#N	BroadT	BRD-K02130669	BRD-K02130669-001-05-9	Enamine Ltd.	T5234469			O=C(COC(=O)CNC(=O)C1CCCCC1)Nc1ccc(cc1)C#N	InChI=1S/C18H21N3O4/c19-10-13-6-8-15(9-7-13)21-16(22)12-25-17(23)11-20-18(24)14-4-2-1-3-5-14/h6-9,14H,1-5,11-12H2,(H,20,24)(H,21,22)	FNDKZAFZEOXKPT-UHFFFAOYSA-N	343.153206182							122004
BAS 09528148	LSM-33448	SID14727253, BRD-K64874334	734580	InChI=1S/C10H14N2O2S/c1-5(2)9(14)12-10-11-6(3)8(15-10)7(4)13/h5H,1-4H3,(H,11,12,14)	ANFXSJDPGZAMEP-UHFFFAOYSA-N	CC(C)C(=O)Nc1nc(C)c(s1)C(=O)C	BroadT	BRD-K64874334	BRD-K64874334-001-05-2	Asinex Ltd.	BAS 09528148			CC(C)C(=O)Nc1nc(C)c(s1)C(C)=O	InChI=1S/C10H14N2O2S/c1-5(2)9(14)12-10-11-6(3)8(15-10)7(4)13/h5H,1-4H3,(H,11,12,14)	ANFXSJDPGZAMEP-UHFFFAOYSA-N	226.077598398							122005
SMR000193743	LSM-33449	SID17413588, BRD-K40672149	1358578	InChI=1S/C25H19N3O3S2/c1-14-6-5-9-19(15(14)2)26-22(29)13-32-25-27-20-11-10-16(12-21(20)33-25)28-23(30)17-7-3-4-8-18(17)24(28)31/h3-12H,13H2,1-2H3,(H,26,29)	QMJJTVUQQJHHJU-UHFFFAOYSA-N	Cc1cccc(NC(=O)CSc2nc3ccc(cc3s2)N4C(=O)c5ccccc5C4=O)c1C	BroadT	BRD-K40672149	BRD-K40672149-001-05-4	ChemBridge Corporation	5961110			Cc1cccc(NC(=O)CSc2nc3ccc(cc3s2)N2C(=O)c3ccccc3C2=O)c1C	InChI=1S/C25H19N3O3S2/c1-14-6-5-9-19(15(14)2)26-22(29)13-32-25-27-20-11-10-16(12-21(20)33-25)28-23(30)17-7-3-4-8-18(17)24(28)31/h3-12H,13H2,1-2H3,(H,26,29)	QMJJTVUQQJHHJU-UHFFFAOYSA-N	473.086782878							122006
MLS000676900	LSM-33450	SID22415511, BRD-K99390369	802370	InChI=1S/C10H8Cl3N5O/c11-10(12,13)7(19)15-9-16-8(14)18(17-9)6-4-2-1-3-5-6/h1-5H,(H3,14,15,16,17,19)	VSFIFIOEYMXOMJ-UHFFFAOYSA-N	Nc1nc(NC(=O)C(Cl)(Cl)Cl)nn1c2ccccc2	BroadT	BRD-K99390369	BRD-K99390369-001-06-4	ChemBridge Corporation	6980078			Nc1nc(NC(=O)C(Cl)(Cl)Cl)nn1-c1ccccc1	InChI=1S/C10H8Cl3N5O/c11-10(12,13)7(19)15-9-16-8(14)18(17-9)6-4-2-1-3-5-6/h1-5H,(H3,14,15,16,17,19)	VSFIFIOEYMXOMJ-UHFFFAOYSA-N	318.979443056							122007
AC1NTUTE	LSM-44478	BRD-K16108472	5389005	InChI=1S/C14H15N3/c1-12-14(11-16-17(12)2)15-10-6-9-13-7-4-3-5-8-13/h3-11H,1-2H3/b9-6+,15-10?	RZKONRBUXFZTJI-DPRQNOTCSA-N	Cc1c(cnn1C)N=C\C=C\c2ccccc2	BroadT	BRD-K16108472	BRD-K16108472-001-05-6	InterBioScreen Ltd.	STOCK1S-06468			Cc1c(cnn1C)N=C\C=C\c1ccccc1	InChI=1S/C14H15N3/c1-12-14(11-16-17(12)2)15-10-6-9-13-7-4-3-5-8-13/h3-11H,1-2H3/b9-6+,15-10?	RZKONRBUXFZTJI-DPRQNOTCSA-N	225.12659751							
AP-970/42784352	LSM-15475	BRD-K38248131	4718593	InChI=1S/C19H21BrFN5O2S/c1-26-19(23-24-25-26)29-8-7-22-11-14-9-16(20)18(17(10-14)27-2)28-12-13-3-5-15(21)6-4-13/h3-6,9-10,22H,7-8,11-12H2,1-2H3	SZWDKYLRWWCXMV-UHFFFAOYSA-N	COc1cc(CNCCSc2nnnn2C)cc(Br)c1OCc3ccc(F)cc3	BroadT	BRD-K38248131	BRD-K38248131-003-05-3	Specs	AP-970/42784352		Cl	COc1cc(CNCCSc2nnnn2C)cc(Br)c1OCc1ccc(F)cc1.Cl	InChI=1S/C19H21BrFN5O2S.ClH/c1-26-19(23-24-25-26)29-8-7-22-11-14-9-16(20)18(17(10-14)27-2)28-12-13-3-5-15(21)6-4-13;/h3-6,9-10,22H,7-8,11-12H2,1-2H3;1H	RQGQWKAKNSUOKV-UHFFFAOYSA-N	481.058336452							104117, 104117
MLS001095136	LSM-33452	SID24403213, SID49731042, BRD-K60884920	16024792	InChI=1S/C25H30N4O2S/c1-20-11-13-29(14-12-20)32(30,31)23-8-9-24-21(19-23)7-10-25(26-24)28-17-15-27(16-18-28)22-5-3-2-4-6-22/h2-10,19-20H,11-18H2,1H3	TWZFJQPLNVVNDH-UHFFFAOYSA-N	CC1CCN(CC1)S(=O)(=O)c2ccc3nc(ccc3c2)N4CCN(CC4)c5ccccc5	BroadT	BRD-K60884920	BRD-K60884920-001-03-0	ChemDiv Inc.	F052-0466			CC1CCN(CC1)S(=O)(=O)c1ccc2nc(ccc2c1)N1CCN(CC1)c1ccccc1	InChI=1S/C25H30N4O2S/c1-20-11-13-29(14-12-20)32(30,31)23-8-9-24-21(19-23)7-10-25(26-24)28-17-15-27(16-18-28)22-5-3-2-4-6-22/h2-10,19-20H,11-18H2,1H3	TWZFJQPLNVVNDH-UHFFFAOYSA-N	450.20894693							122009
BAS 02859604	LSM-43268	BAS-02859604, SID17506018	1140587	InChI=1S/C26H22N4O3/c1-18-6-4-7-21(12-18)29-26(32)19(14-27)13-20-16-30(24-10-3-2-9-23(20)24)17-25(31)28-15-22-8-5-11-33-22/h2-13,16H,15,17H2,1H3,(H,28,31)(H,29,32)/b19-13+	DPRBGPIAKRWMHH-CPNJWEJPSA-N	Cc1cccc(NC(=O)\C(=C\c2cn(CC(=O)NCc3occc3)c4ccccc24)\C#N)c1	BroadT	BRD-K36267058	BRD-K36267058-001-08-2	Asinex Ltd.	BAS 02859604			Cc1cccc(NC(=O)C(=C\c2cn(CC(=O)NCc3ccco3)c3ccccc23)\C#N)c1	InChI=1S/C26H22N4O3/c1-18-6-4-7-21(12-18)29-26(32)19(14-27)13-20-16-30(24-10-3-2-9-23(20)24)17-25(31)28-15-22-8-5-11-33-22/h2-13,16H,15,17H2,1H3,(H,28,31)(H,29,32)/b19-13+	DPRBGPIAKRWMHH-CPNJWEJPSA-N	438.169190604							
ST50775649	LSM-33453	SID14725322, BRD-A12870365	3109981	InChI=1S/C18H16N2O3S/c1-12-6-5-7-13(10-12)19-16(21)11-15-17(22)20(18(23)24-15)14-8-3-2-4-9-14/h2-10,15H,11H2,1H3,(H,19,21)	AYUAUOZBIOAQTG-UHFFFAOYSA-N	Cc1cccc(NC(=O)CC2SC(=O)N(C2=O)c3ccccc3)c1	BroadT	BRD-A12870365	BRD-A12870365-001-06-5	Asinex Ltd.	BAS 00505296			Cc1cccc(NC(=O)CC2SC(=O)N(C2=O)c2ccccc2)c1	InChI=1S/C18H16N2O3S/c1-12-6-5-7-13(10-12)19-16(21)11-15-17(22)20(18(23)24-15)14-8-3-2-4-9-14/h2-10,15H,11H2,1H3,(H,19,21)	AYUAUOZBIOAQTG-UHFFFAOYSA-N	340.088163082							122010
AC1MT1IS	LSM-33454	BRD-A87844399	3543462	InChI=1S/C26H28N2O6S/c1-3-33-25(30)14-24-28(16-23(29)27-15-18-8-6-12-34-18)26(31)22(35-24)13-20-19-9-5-4-7-17(19)10-11-21(20)32-2/h4-5,7,9-11,13-14,18H,3,6,8,12,15-16H2,1-2H3,(H,27,29)	LOZNKRXXJGRBGK-UHFFFAOYSA-N	CCOC(=O)C=C1SC(=Cc2c(OC)ccc3ccccc23)C(=O)N1CC(=O)NCC4CCCO4	BroadT	BRD-A87844399	BRD-A87844399-001-07-8	Enamine Ltd.	T0520-3617			CCOC(=O)C=c1sc(=Cc2c(OC)ccc3ccccc23)c(=O)n1CC(=O)NCC1CCCO1	InChI=1S/C26H28N2O6S/c1-3-33-25(30)14-24-28(16-23(29)27-15-18-8-6-12-34-18)26(31)22(35-24)13-20-19-9-5-4-7-17(19)10-11-21(20)32-2/h4-5,7,9-11,13-14,18H,3,6,8,12,15-16H2,1-2H3,(H,27,29)	LOZNKRXXJGRBGK-UHFFFAOYSA-N	496.166807326							122011
MLS000053724	LSM-33455	SID3711182, BRD-A68903120	2997533	InChI=1S/C20H19N3O3/c1-12-9-13-5-3-4-6-17(13)23(12)11-18-21-16-10-14(20(25)26-2)7-8-15(16)19(24)22-18/h3-8,10,12H,9,11H2,1-2H3,(H,21,22,24)	ARNFWZQDKJZNHV-UHFFFAOYSA-N	COC(=O)c1ccc2c(O)nc(CN3C(C)Cc4ccccc34)nc2c1	BroadT	BRD-A68903120	BRD-A68903120-001-05-5	Enamine Ltd.	T5329553			COC(=O)c1ccc2c(O)nc(CN3C(C)Cc4ccccc34)nc2c1	InChI=1S/C20H19N3O3/c1-12-9-13-5-3-4-6-17(13)23(12)11-18-21-16-10-14(20(25)26-2)7-8-15(16)19(24)22-18/h3-8,10,12H,9,11H2,1-2H3,(H,21,22,24)	ARNFWZQDKJZNHV-UHFFFAOYSA-N	349.142641498							122012
STK273524	LSM-33456	SID14727804, BRD-K78779251	3961677	InChI=1S/C18H14ClN3O4S/c19-13-4-2-1-3-12(13)17-21-22-18(26-17)27-10-16(23)20-11-5-6-14-15(9-11)25-8-7-24-14/h1-6,9H,7-8,10H2,(H,20,23)	BCUSNMPAUSJINK-UHFFFAOYSA-N	Clc1ccccc1c2oc(SCC(=O)Nc3ccc4OCCOc4c3)nn2	BroadT	BRD-K78779251	BRD-K78779251-001-05-6	Specs	AP-853/42941726			Clc1ccccc1-c1nnc(SCC(=O)Nc2ccc3OCCOc3c2)o1	InChI=1S/C18H14ClN3O4S/c19-13-4-2-1-3-12(13)17-21-22-18(26-17)27-10-16(23)20-11-5-6-14-15(9-11)25-8-7-24-14/h1-6,9H,7-8,10H2,(H,20,23)	BCUSNMPAUSJINK-UHFFFAOYSA-N	403.039354358							122013
AC1MNXX0	LSM-33457	SID24815468, BRD-K20808438	3335152	InChI=1S/C25H26N2O4S/c1-17-4-11-21(12-5-17)26-25(32)27(15-18-6-9-20(10-7-18)24(28)29)16-19-8-13-22(30-2)23(14-19)31-3/h4-14H,15-16H2,1-3H3,(H,26,32)(H,28,29)	YXXZISODYHJJAV-UHFFFAOYSA-N	COc1ccc(CN(Cc2ccc(cc2)C(=O)O)C(=Nc3ccc(C)cc3)S)cc1OC	BroadT	BRD-K20808438	BRD-K20808438-001-05-8	ChemDiv Inc.	K784-4712			COc1ccc(CN(Cc2ccc(cc2)C(O)=O)C(S)=Nc2ccc(C)cc2)cc1OC	InChI=1S/C25H26N2O4S/c1-17-4-11-21(12-5-17)26-25(32)27(15-18-6-9-20(10-7-18)24(28)29)16-19-8-13-22(30-2)23(14-19)31-3/h4-14H,15-16H2,1-3H3,(H,26,32)(H,28,29)	YXXZISODYHJJAV-UHFFFAOYSA-N	450.161328022							122014
BRD-A07935941	LSM-33458			InChI=1S/C26H29N3O5/c1-4-28(5-2)14-7-15-29-22(17-10-12-27-13-11-17)21(24(31)26(29)32)23(30)20-16-18-8-6-9-19(33-3)25(18)34-20/h6,8-13,16,21-22H,4-5,7,14-15H2,1-3H3	XAZDYEPMILUFDK-UHFFFAOYSA-N	CCN(CC)CCCN1C(C(C(=O)c2oc3c(OC)cccc3c2)C(=O)C1=O)c4ccncc4	BroadT	BRD-A07935941	BRD-A07935941-001-05-8	InterBioScreen Ltd.	STOCK4S-48986			CCN(CC)CCCN1C(C(C(=O)c2cc3cccc(OC)c3o2)C(=O)C1=O)c1ccncc1	InChI=1S/C26H29N3O5/c1-4-28(5-2)14-7-15-29-22(17-10-12-27-13-11-17)21(24(31)26(29)32)23(30)20-16-18-8-6-9-19(33-3)25(18)34-20/h6,8-13,16,21-22H,4-5,7,14-15H2,1-3H3	XAZDYEPMILUFDK-UHFFFAOYSA-N	463.210721058							122015
SMR000200716	LSM-33459	SID17413464, BRD-K16619620	2220749	InChI=1S/C22H13BrF3N3O/c23-15-5-8-19-17(10-15)18(11-20(29-19)13-2-1-9-27-12-13)21(30)28-16-6-3-14(4-7-16)22(24,25)26/h1-12H,(H,28,30)	WJQVUVPLOIOXNA-UHFFFAOYSA-N	FC(F)(F)c1ccc(NC(=O)c2cc(nc3ccc(Br)cc23)c4cccnc4)cc1	BroadT	BRD-K16619620	BRD-K16619620-001-05-3	ChemBridge Corporation	7922128			FC(F)(F)c1ccc(NC(=O)c2cc(nc3ccc(Br)cc23)-c2cccnc2)cc1	InChI=1S/C22H13BrF3N3O/c23-15-5-8-19-17(10-15)18(11-20(29-19)13-2-1-9-27-12-13)21(30)28-16-6-3-14(4-7-16)22(24,25)26/h1-12H,(H,28,30)	WJQVUVPLOIOXNA-UHFFFAOYSA-N	471.019409266							122016
721426-27-3	LSM-33460	SID24831457, BRD-K66035938	2383452	InChI=1S/C15H17N3O/c1-10(2)12-4-6-13(7-5-12)18-15(19)14-9-16-11(3)8-17-14/h4-10H,1-3H3,(H,18,19)	JTBCFXDDIDPNHA-UHFFFAOYSA-N	CC(C)c1ccc(NC(=O)c2cnc(C)cn2)cc1	BroadT	BRD-K66035938	BRD-K66035938-001-05-8	Enamine Ltd.	T0511-5795			CC(C)c1ccc(NC(=O)c2cnc(C)cn2)cc1	InChI=1S/C15H17N3O/c1-10(2)12-4-6-13(7-5-12)18-15(19)14-9-16-11(3)8-17-14/h4-10H,1-3H3,(H,18,19)	JTBCFXDDIDPNHA-UHFFFAOYSA-N	255.137162194							122017
MLS000756143	LSM-33461	SID24783318, BRD-K30674400	848937	InChI=1S/C15H20N6OS/c22-14(10-21-13-9-5-4-8-12(13)17-20-21)18-19-15(23)16-11-6-2-1-3-7-11/h4-5,8-9,11H,1-3,6-7,10H2,(H,18,22)(H2,16,19,23)	IBPRMHMWTMPCPV-UHFFFAOYSA-N	O=C(Cn1nnc2ccccc12)NNC(=S)NC3CCCCC3	BroadT	BRD-K30674400	BRD-K30674400-001-06-4	Specs	AO-476/41839726			O=C(Cn1nnc2ccccc12)NNC(=S)NC1CCCCC1	InChI=1S/C15H20N6OS/c22-14(10-21-13-9-5-4-8-12(13)17-20-21)18-19-15(23)16-11-6-2-1-3-7-11/h4-5,8-9,11H,1-3,6-7,10H2,(H,18,22)(H2,16,19,23)	IBPRMHMWTMPCPV-UHFFFAOYSA-N	332.14193001							122018
MLS000113954	LSM-33462	SID7978277, BRD-K60332514	844261	InChI=1S/C15H20N2O3/c18-15(16-11-4-2-1-3-5-11)17-12-6-7-13-14(10-12)20-9-8-19-13/h6-7,10-11H,1-5,8-9H2,(H2,16,17,18)	SZYOOVNTPYBCFG-UHFFFAOYSA-N	O=C(NC1CCCCC1)Nc2ccc3OCCOc3c2	BroadT	BRD-K60332514	BRD-K60332514-001-05-7	ChemBridge Corporation	7309721			O=C(NC1CCCCC1)Nc1ccc2OCCOc2c1	InChI=1S/C15H20N2O3/c18-15(16-11-4-2-1-3-5-11)17-12-6-7-13-14(10-12)20-9-8-19-13/h6-7,10-11H,1-5,8-9H2,(H2,16,17,18)	SZYOOVNTPYBCFG-UHFFFAOYSA-N	276.14739252							122019
ASN 02562665	LSM-15593	BRD-K29332245	3167809	InChI=1S/C23H27N7OS2/c1-29(2)12-5-13-30-21(16-8-10-25-11-9-16)27-28-23(30)32-15-20(31)26-22-18(14-24)17-6-3-4-7-19(17)33-22/h8-11H,3-7,12-13,15H2,1-2H3,(H,26,31)	DCGPPJLNPOAXJR-UHFFFAOYSA-N	CN(C)CCCn1c(SCC(=O)Nc2sc3CCCCc3c2C#N)nnc1c4ccncc4	BroadT	BRD-K29332245	BRD-K29332245-034-05-4	Asinex Ltd.	ASN 02562665		OC(=O)C(=O)O	CN(C)CCCn1c(SCC(=O)Nc2sc3CCCCc3c2C#N)nnc1-c1ccncc1.OC(=O)C(=O)O	InChI=1S/C23H27N7OS2.C2H2O4/c1-29(2)12-5-13-30-21(16-8-10-25-11-9-16)27-28-23(30)32-15-20(31)26-22-18(14-24)17-6-3-4-7-19(17)33-22;3-1(4)2(5)6/h8-11H,3-7,12-13,15H2,1-2H3,(H,26,31);(H,3,4)(H,5,6)	ATMYYGLNTVIVQW-UHFFFAOYSA-N	481.171849934							104229, 104229
T0516-7671	LSM-44479	SID17385602, BRD-K08832724	6520797	InChI=1S/C24H24N2O2/c1-3-16-9-11-17(12-10-16)13-18-14-26(4-2)15-20-22(24(27)28)19-7-5-6-8-21(19)25-23(18)20/h5-13H,3-4,14-15H2,1-2H3,(H,27,28)/b18-13+	XGPGJZYXXIXRGK-QGOAFFKASA-N	CCN1C\C(=C/c2ccc(CC)cc2)\c3nc4ccccc4c(C(=O)O)c3C1	BroadT	BRD-K08832724	BRD-K08832724-001-05-7	Enamine Ltd.	T0516-7671			CCN1C\C(=C/c2ccc(CC)cc2)c2nc3ccccc3c(C(O)=O)c2C1	InChI=1S/C24H24N2O2/c1-3-16-9-11-17(12-10-16)13-18-14-26(4-2)15-20-22(24(27)28)19-7-5-6-8-21(19)25-23(18)20/h5-13H,3-4,14-15H2,1-2H3,(H,27,28)/b18-13+	XGPGJZYXXIXRGK-QGOAFFKASA-N	372.183778028							
SMR000102200	LSM-33464	SID7973709, BRD-K69273720	1377033	InChI=1S/C21H28N2O3/c1-15-6-5-7-18(16(15)2)23-10-8-22(9-11-23)14-17-12-19(25-3)21(24)20(13-17)26-4/h5-7,12-13,24H,8-11,14H2,1-4H3	FMKSCNHGTVSCMD-UHFFFAOYSA-N	COc1cc(CN2CCN(CC2)c3cccc(C)c3C)cc(OC)c1O	BroadT	BRD-K69273720	BRD-K69273720-001-06-2	ChemBridge Corporation	5264966			COc1cc(CN2CCN(CC2)c2cccc(C)c2C)cc(OC)c1O	InChI=1S/C21H28N2O3/c1-15-6-5-7-18(16(15)2)23-10-8-22(9-11-23)14-17-12-19(25-3)21(24)20(13-17)26-4/h5-7,12-13,24H,8-11,14H2,1-4H3	FMKSCNHGTVSCMD-UHFFFAOYSA-N	356.209992776							122021
F1751-0037	LSM-44480	SID14740527, BRD-A76870824	5740386	InChI=1S/C22H21N3O4/c1-22(2)17-6-4-5-7-18(17)23(3)19(22)12-14-13-20(26)24(21(14)27)15-8-10-16(11-9-15)25(28)29/h4-12,14H,13H2,1-3H3/b19-12+	JXRMRWYQQYIQGI-XDHOZWIPSA-N	CN1\C(=C\C2CC(=O)N(C2=O)c3ccc(cc3)[N+](=O)[O-])\C(C)(C)c4ccccc14	BroadT	BRD-A76870824	BRD-A76870824-001-05-5	ChemBridge Corporation	7910194			CN1c2ccccc2C(C)(C)\C1=C/C1CC(=O)N(C1=O)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C22H21N3O4/c1-22(2)17-6-4-5-7-18(17)23(3)19(22)12-14-13-20(26)24(21(14)27)15-8-10-16(11-9-15)25(28)29/h4-12,14H,13H2,1-3H3/b19-12+	JXRMRWYQQYIQGI-XDHOZWIPSA-N	391.153206182							
ST50832434	LSM-33466	SID22412196, BRD-K15683845	843658	InChI=1S/C14H15N3OS2/c1-9-5-3-4-6-12(9)15-14(19)17-16-13(18)11-7-10(2)20-8-11/h3-8H,1-2H3,(H,16,18)(H2,15,17,19)	QVZUXRAEAHDNBV-UHFFFAOYSA-N	Cc1cc(cs1)C(=O)NN=C(S)Nc2ccccc2C	BroadT	BRD-K15683845	BRD-K15683845-001-05-9	Specs	AK-968/41923825			Cc1cc(cs1)C(=O)NN=C(S)Nc1ccccc1C	InChI=1S/C14H15N3OS2/c1-9-5-3-4-6-12(9)15-14(19)17-16-13(18)11-7-10(2)20-8-11/h3-8H,1-2H3,(H,16,18)(H2,15,17,19)	QVZUXRAEAHDNBV-UHFFFAOYSA-N	305.06565351							122023
2-Pyridin-4-yl-2,3-dihydro-1H-quinazolin-4-one	LSM-33467	SID847388, BRD-A01315431	649783	InChI=1S/C13H11N3O/c17-13-10-3-1-2-4-11(10)15-12(16-13)9-5-7-14-8-6-9/h1-8,12,15H,(H,16,17)	WHSLICPSSNGCOM-UHFFFAOYSA-N	O=C1NC(Nc2ccccc12)c3ccncc3	BroadT	BRD-A01315431	BRD-A01315431-001-05-6	Asinex Ltd.	BAS 00739655			O=C1NC(Nc2ccccc12)c1ccncc1	InChI=1S/C13H11N3O/c17-13-10-3-1-2-4-11(10)15-12(16-13)9-5-7-14-8-6-9/h1-8,12,15H,(H,16,17)	WHSLICPSSNGCOM-UHFFFAOYSA-N	225.090212002							122024
BAS 07418293	LSM-33468	SID853714, BRD-A51523385	656373	InChI=1S/C17H16N4O4/c1-3-24-11-5-4-9(6-12(11)23-2)13-10(7-18)15(19)25-17-14(13)16(22)20-8-21-17/h4-6,8,13H,3,19H2,1-2H3,(H,20,21,22)	IPGRMIBAUCIMNX-UHFFFAOYSA-N	CCOc1ccc(cc1OC)C2C(=C(N)Oc3ncnc(O)c23)C#N	BroadT	BRD-A51523385	BRD-A51523385-001-05-0	Asinex Ltd.	BAS 07418293			CCOc1ccc(cc1OC)C1C(C#N)=C(N)Oc2ncnc(O)c12	InChI=1S/C17H16N4O4/c1-3-24-11-5-4-9(6-12(11)23-2)13-10(7-18)15(19)25-17-14(13)16(22)20-8-21-17/h4-6,8,13H,3,19H2,1-2H3,(H,20,21,22)	IPGRMIBAUCIMNX-UHFFFAOYSA-N	340.117155032							122025
7-Bromo-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazoline	LSM-3873	BRD-K83213280, SID49646879, SID85285666, SID87219062	928277	InChI=1S/C11H11BrN2/c12-9-3-4-10-8(6-9)7-14-5-1-2-11(14)13-10/h3-4,6H,1-2,5,7H2	IXRIYMMZXPUXNJ-UHFFFAOYSA-N	Brc1ccc2N=C3CCCN3Cc2c1	BroadT	BRD-K83213280	BRD-K83213280-001-05-4	InterBioScreen Ltd.	STOCK1N-06350			Brc1ccc2N=C3CCCN3Cc2c1	InChI=1S/C11H11BrN2/c12-9-3-4-10-8(6-9)7-14-5-1-2-11(14)13-10/h3-4,6H,1-2,5,7H2	IXRIYMMZXPUXNJ-UHFFFAOYSA-N	250.010560972							93461
AC1OA98Z	LSM-33469	BRD-K17751650	6801138	InChI=1S/C15H10Cl2N2O2/c16-11-6-5-9(7-12(11)17)8-19-13-4-2-1-3-10(13)14(18-21)15(19)20/h1-7,20H,8H2	YTQXXHALWAQGSY-UHFFFAOYSA-N	Oc1c(N=O)c2ccccc2n1Cc1ccc(Cl)c(Cl)c1	BroadT	BRD-K17751650	BRD-K17751650-001-07-2	Key Organics Ltd.	11E-405S			Oc1c([N+][O-])c2ccccc2n1Cc1ccc(Cl)c(Cl)c1	InChI=1S/C15H10Cl2N2O2/c16-11-6-5-9(7-12(11)17)8-19-13-4-2-1-3-10(13)14(18-21)15(19)20/h1-7,20H,8H2	YTQXXHALWAQGSY-UHFFFAOYSA-N	320.011933							
T0510-6829	LSM-44481	SID22409656, BRD-K74868855	2384174	InChI=1S/C23H25N3O2/c1-3-28-21-9-7-20(8-10-21)25-23(27)19(16-24)15-18-6-11-22(17(2)14-18)26-12-4-5-13-26/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,25,27)/b19-15+	ITJLTWRCIAAQOM-XDJHFCHBSA-N	CCOc1ccc(NC(=O)\C(=C\c2ccc(N3CCCC3)c(C)c2)\C#N)cc1	BroadT	BRD-K74868855	BRD-K74868855-001-04-4	Enamine Ltd.	T0510-6829			CCOc1ccc(NC(=O)C(=C\c2ccc(N3CCCC3)c(C)c2)\C#N)cc1	InChI=1S/C23H25N3O2/c1-3-28-21-9-7-20(8-10-21)25-23(27)19(16-24)15-18-6-11-22(17(2)14-18)26-12-4-5-13-26/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,25,27)/b19-15+	ITJLTWRCIAAQOM-XDJHFCHBSA-N	375.19467707							
MLS000576719	LSM-44482	SID17414562, BRD-K01289574	1604538	InChI=1S/C16H15N3OS2/c1-2-8-19-15(20)13(22-16(19)21)9-12-10-17-18-14(12)11-6-4-3-5-7-11/h3-7,9-10H,2,8H2,1H3,(H,17,18)/b13-9-	VKBUYHLFYCQFIJ-LCYFTJDESA-N	CCCN1C(=S)S\C(=C/c2c[nH]nc2c3ccccc3)\C1=O	BroadT	BRD-K01289574	BRD-K01289574-001-05-8	ChemBridge Corporation	7100507			CCCN1C(=S)S\C(=C/c2c[nH]nc2-c2ccccc2)C1=O	InChI=1S/C16H15N3OS2/c1-2-8-19-15(20)13(22-16(19)21)9-12-10-17-18-14(12)11-6-4-3-5-7-11/h3-7,9-10H,2,8H2,1H3,(H,17,18)/b13-9-	VKBUYHLFYCQFIJ-LCYFTJDESA-N	329.06565351							
ST50837446	LSM-33472	SID49819176, BRD-K68122544	2965490	InChI=1S/C25H21ClN4O/c26-19-7-5-6-18(16-19)23-17-21(20-8-1-2-9-22(20)28-23)25(31)30-14-12-29(13-15-30)24-10-3-4-11-27-24/h1-11,16-17H,12-15H2	FDCALDHWTLPEDY-UHFFFAOYSA-N	Clc1cccc(c1)c2cc(C(=O)N3CCN(CC3)c4ccccn4)c5ccccc5n2	BroadT	BRD-K68122544	BRD-K68122544-001-06-6	ChemBridge Corporation	7922478			Clc1cccc(c1)-c1cc(C(=O)N2CCN(CC2)c2ccccn2)c2ccccc2n1	InChI=1S/C25H21ClN4O/c26-19-7-5-6-18(16-19)23-17-21(20-8-1-2-9-22(20)28-23)25(31)30-14-12-29(13-15-30)24-10-3-4-11-27-24/h1-11,16-17H,12-15H2	FDCALDHWTLPEDY-UHFFFAOYSA-N	428.140389042							122029
MLS000391652	LSM-33473	SID22410085, BRD-K74853755	2365237	InChI=1S/C17H17NO5/c1-3-22-15-14(5-4-10-18-15)17(20)23-11-12-6-8-13(9-7-12)16(19)21-2/h4-10H,3,11H2,1-2H3	PCTVRHUKEDNDHW-UHFFFAOYSA-N	CCOc1ncccc1C(=O)OCc2ccc(cc2)C(=O)OC	BroadT	BRD-K74853755	BRD-K74853755-001-05-4	Enamine Ltd.	T0509-7732			CCOc1ncccc1C(=O)OCc1ccc(cc1)C(=O)OC	InChI=1S/C17H17NO5/c1-3-22-15-14(5-4-10-18-15)17(20)23-11-12-6-8-13(9-7-12)16(19)21-2/h4-10H,3,11H2,1-2H3	PCTVRHUKEDNDHW-UHFFFAOYSA-N	315.110672654							122030
STK091573	LSM-33474	SID17510225, BRD-K76732417	3935732	InChI=1S/C11H12N4O4/c1-8-11(14-19-13-8)18-7-6-12-9-2-4-10(5-3-9)15(16)17/h2-5,12H,6-7H2,1H3	PNRBLPYPEGSKQR-UHFFFAOYSA-N	Cc1nonc1OCCNc2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K76732417	BRD-K76732417-001-05-8	ChemDiv Inc.	2023-0417			Cc1nonc1OCCNc1ccc(cc1)[N+]([O-])=O	InChI=1S/C11H12N4O4/c1-8-11(14-19-13-8)18-7-6-12-9-2-4-10(5-3-9)15(16)17/h2-5,12H,6-7H2,1H3	PNRBLPYPEGSKQR-UHFFFAOYSA-N	264.085854904							122031
SMR000001571	LSM-33475	SID843448, BRD-K71829532	645744	InChI=1S/C20H23ClN2O4/c1-26-17-10-9-14(21)12-16(17)22-19(24)13-23(15-6-3-2-4-7-15)20(25)18-8-5-11-27-18/h5,8-12,15H,2-4,6-7,13H2,1H3,(H,22,24)	XCLVQUVXXSTHQO-UHFFFAOYSA-N	COc1ccc(Cl)cc1NC(=O)CN(C2CCCCC2)C(=O)c3occc3	BroadT	BRD-K71829532	BRD-K71829532-001-05-7	Asinex Ltd.	ASN 01516573			COc1ccc(Cl)cc1NC(=O)CN(C1CCCCC1)C(=O)c1ccco1	InChI=1S/C20H23ClN2O4/c1-26-17-10-9-14(21)12-16(17)22-19(24)13-23(15-6-3-2-4-7-15)20(25)18-8-5-11-27-18/h5,8-12,15H,2-4,6-7,13H2,1H3,(H,22,24)	XCLVQUVXXSTHQO-UHFFFAOYSA-N	390.134634946							122032
SMR000150131	LSM-44483	SID14746838, BRD-K81745870	6296456	InChI=1S/C23H15NO3/c25-22(23(26)27)19(21-13-12-16-7-2-4-11-20(16)24-21)14-17-9-5-8-15-6-1-3-10-18(15)17/h1-14H,(H,26,27)/b19-14-	GIQGCIWBMMAIEN-RGEXLXHISA-N	OC(=O)C(=O)\C(=C/c1cccc2ccccc12)\c3ccc4ccccc4n3	BroadT	BRD-K81745870	BRD-K81745870-001-06-1	Enamine Ltd.	T0512-8143			OC(=O)C(=O)C(=C/c1cccc2ccccc12)\c1ccc2ccccc2n1	InChI=1S/C23H15NO3/c25-22(23(26)27)19(21-13-12-16-7-2-4-11-20(16)24-21)14-17-9-5-8-15-6-1-3-10-18(15)17/h1-14H,(H,26,27)/b19-14-	GIQGCIWBMMAIEN-RGEXLXHISA-N	353.10519335							
SMR000206922	LSM-33477	SID17509622, BRD-K94696260	4615989	InChI=1S/C16H20N2O5S/c1-23-16(20)11-7-8-14(13(9-11)18(21)22)24-10-15(19)17-12-5-3-2-4-6-12/h7-9,12H,2-6,10H2,1H3,(H,17,19)	RULRIFKPXKSRTF-UHFFFAOYSA-N	COC(=O)c1ccc(SCC(=O)NC2CCCCC2)c(c1)[N+](=O)[O-]	BroadT	BRD-K94696260	BRD-K94696260-001-05-1	ChemDiv Inc.	K784-1055			COC(=O)c1ccc(SCC(=O)NC2CCCCC2)c(c1)[N+]([O-])=O	InChI=1S/C16H20N2O5S/c1-23-16(20)11-7-8-14(13(9-11)18(21)22)24-10-15(19)17-12-5-3-2-4-6-12/h7-9,12H,2-6,10H2,1H3,(H,17,19)	RULRIFKPXKSRTF-UHFFFAOYSA-N	352.10929245							122034
MLS000555963	LSM-33478	SID14741797, BRD-A86473322	3829272	InChI=1S/C18H21ClN2O2/c19-14-7-9-15(10-8-14)20-18(22)21-17-6-2-1-4-13(17)12-16-5-3-11-23-16/h3,5,7-11,13,17H,1-2,4,6,12H2,(H2,20,21,22)	RBZBREHMJDJRDP-UHFFFAOYSA-N	Clc1ccc(NC(=O)NC2CCCCC2Cc3occc3)cc1	BroadT	BRD-A86473322	BRD-A86473322-001-05-3	InterBioScreen Ltd.	STOCK1S-64625			Clc1ccc(NC(=O)NC2CCCCC2Cc2ccco2)cc1	InChI=1S/C18H21ClN2O2/c19-14-7-9-15(10-8-14)20-18(22)21-17-6-2-1-4-13(17)12-16-5-3-11-23-16/h3,5,7-11,13,17H,1-2,4,6,12H2,(H2,20,21,22)	RBZBREHMJDJRDP-UHFFFAOYSA-N	332.129155642							122035
ST50852663	LSM-33479	SID24789018, BRD-K61320284	970084	InChI=1S/C14H12ClN3O3/c1-21-13(19)10-4-2-3-5-11(10)17-14(20)18-12-7-6-9(15)8-16-12/h2-8H,1H3,(H2,16,17,18,20)	JQZQAGGMWIDIOI-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)Nc2ccc(Cl)cn2	BroadT	BRD-K61320284	BRD-K61320284-001-05-9	ChemBridge Corporation	7792862			COC(=O)c1ccccc1NC(=O)Nc1ccc(Cl)cn1	InChI=1S/C14H12ClN3O3/c1-21-13(19)10-4-2-3-5-11(10)17-14(20)18-12-7-6-9(15)8-16-12/h2-8H,1H3,(H2,16,17,18,20)	JQZQAGGMWIDIOI-UHFFFAOYSA-N	305.056718984							122036
AC1NHY7S	LSM-33480	BRD-A76025813	4747415	InChI=1S/C23H22N2O4/c1-14(26)20-21(15-6-5-7-17(12-15)29-2)25(23(28)22(20)27)11-10-16-13-24-19-9-4-3-8-18(16)19/h3-9,12-13,20-21,24H,10-11H2,1-2H3	BUBNEQVDYCGNPB-UHFFFAOYSA-N	COc1cccc(c1)C2C(C(=O)C)C(=O)C(=O)N2CCc3c[nH]c4ccccc34	BroadT	BRD-A76025813	BRD-A76025813-001-06-7	Asinex Ltd.	BAS 08770932			COc1cccc(c1)C1C(C(C)=O)C(=O)C(=O)N1CCc1c[nH]c2ccccc12	InChI=1S/C23H22N2O4/c1-14(26)20-21(15-6-5-7-17(12-15)29-2)25(23(28)22(20)27)11-10-16-13-24-19-9-4-3-8-18(16)19/h3-9,12-13,20-21,24H,10-11H2,1-2H3	BUBNEQVDYCGNPB-UHFFFAOYSA-N	390.157957204							122037
T5343642	LSM-33481	SID49672631, BRD-A58983154	4780123	InChI=1S/C15H14F3N3O2/c16-15(17,18)10-2-1-7-20(9-10)13-3-4-14(21(22)23)12-8-19-6-5-11(12)13/h3-6,8,10H,1-2,7,9H2	JZMDEWVSFFPXGE-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(N2CCCC(C2)C(F)(F)F)c3ccncc13	BroadT	BRD-A58983154	BRD-A58983154-001-07-4	Enamine Ltd.	T5343642			[O-][N+](=O)c1ccc(N2CCCC(C2)C(F)(F)F)c2ccncc12	InChI=1S/C15H14F3N3O2/c16-15(17,18)10-2-1-7-20(9-10)13-3-4-14(21(22)23)12-8-19-6-5-11(12)13/h3-6,8,10H,1-2,7,9H2	JZMDEWVSFFPXGE-UHFFFAOYSA-N	325.103811318							122038
CID-1067700	LSM-33482	BRD-K55763052, SID24798006	1067700	InChI=1S/C18H18N2O4S2/c1-18(2)8-11-12(9-24-18)26-15(13(11)16(22)23)20-17(25)19-14(21)10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,22,23)(H2,19,20,21,25)	ATSWBWHRHAQVFM-UHFFFAOYSA-N	CC1(C)Cc2c(CO1)sc(NC(=S)NC(=O)c3ccccc3)c2C(=O)O	BroadT	BRD-K55763052	BRD-K55763052-001-05-8	ChemBridge Corporation	5922323			CC1(C)Cc2c(CO1)sc(NC(=S)NC(=O)c1ccccc1)c2C(O)=O	InChI=1S/C18H18N2O4S2/c1-18(2)8-11-12(9-24-18)26-15(13(11)16(22)23)20-17(25)19-14(21)10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,22,23)(H2,19,20,21,25)	ATSWBWHRHAQVFM-UHFFFAOYSA-N	390.070798456							122039
MLS000948149	LSM-44484	SID49716581, BRD-A83560897	6150569	InChI=1S/C23H19FN4O5S/c1-14-3-2-9-28-20(14)27-22(33-18-6-4-16(24)5-7-18)19(23(28)30)11-15(12-25)21(29)26-17-8-10-34(31,32)13-17/h2-7,9,11,17H,8,10,13H2,1H3,(H,26,29)/b15-11+	ANTLQBMMFPNGQF-RVDMUPIBSA-N	CC1=CC=CN2C(=O)C(=C(Oc3ccc(F)cc3)N=C12)\C=C(/C#N)\C(=O)NC4CCS(=O)(=O)C4	BroadT	BRD-A83560897	BRD-A83560897-001-06-3	ChemDiv Inc.	6392-0885			Cc1cccn2c1nc(Oc1ccc(F)cc1)c(\C=C(/C#N)C(=O)NC1CCS(=O)(=O)C1)c2=O	InChI=1S/C23H19FN4O5S/c1-14-3-2-9-28-20(14)27-22(33-18-6-4-16(24)5-7-18)19(23(28)30)11-15(12-25)21(29)26-17-8-10-34(31,32)13-17/h2-7,9,11,17H,8,10,13H2,1H3,(H,26,29)/b15-11+	ANTLQBMMFPNGQF-RVDMUPIBSA-N	482.106018638							
4-[4-(4-Fluorophenoxy)butyl]morpholine	LSM-15476	BRD-K37449282	2056439	InChI=1S/C14H20FNO2/c15-13-3-5-14(6-4-13)18-10-2-1-7-16-8-11-17-12-9-16/h3-6H,1-2,7-12H2	BYSZARZHVKVRGF-UHFFFAOYSA-N	Fc1ccc(OCCCCN2CCOCC2)cc1	BroadT	BRD-K37449282	BRD-K37449282-003-05-5	ChemDiv Inc.	6030-4661		Cl	Fc1ccc(OCCCCN2CCOCC2)cc1.Cl	InChI=1S/C14H20FNO2.ClH/c15-13-3-5-14(6-4-13)18-10-2-1-7-16-8-11-17-12-9-16;/h3-6H,1-2,7-12H2;1H	JMPBLZUEPAFNDW-UHFFFAOYSA-N	253.14780709							104118, 104118
AC1O9WJK	LSM-33484	BRD-K05062035	6738936	InChI=1S/C16H13N5O4/c22-13-6-5-9-3-1-2-4-10(9)11(13)8-17-20-14(23)7-12-15(24)18-16(25)21-19-12/h1-6,8,22H,7H2,(H,20,23)(H2,18,21,24,25)	SQGCPNYRAGYYMA-UHFFFAOYSA-N	Oc1ccc2ccccc2c1C=NNC(=O)Cc3nnc(O)nc3O	BroadT	BRD-K05062035	BRD-K05062035-001-06-6	ChemDiv Inc.	1988-0300			Oc1nnc(CC(=O)NN=Cc2c(O)ccc3ccccc23)c(O)n1	InChI=1S/C16H13N5O4/c22-13-6-5-9-3-1-2-4-10(9)11(13)8-17-20-14(23)7-12-15(24)18-16(25)21-19-12/h1-6,8,22H,7H2,(H,20,23)(H2,18,21,24,25)	SQGCPNYRAGYYMA-UHFFFAOYSA-N	339.096753946							
T5225844	LSM-33485	SID16953869, BRD-K75425362	7918965	InChI=1S/C20H22N2O6S/c1-26-13-7-8-14(16(11-13)27-2)21-18(23)12-28-20(25)15-5-3-9-22(15)19(24)17-6-4-10-29-17/h4,6-8,10-11,15H,3,5,9,12H2,1-2H3,(H,21,23)/t15-/m0/s1	YVBGZNLZDQAXIH-HNNXBMFYSA-N	COc1ccc(NC(=O)COC(=O)[C@@H]2CCCN2C(=O)c3cccs3)c(OC)c1	BroadT	BRD-K75425362	BRD-K75425362-001-05-5	Enamine Ltd.	T5225844			COc1ccc(NC(=O)COC(=O)[C@@H]2CCCN2C(=O)c2cccs2)c(OC)c1	InChI=1S/C20H22N2O6S/c1-26-13-7-8-14(16(11-13)27-2)21-18(23)12-28-20(25)15-5-3-9-22(15)19(24)17-6-4-10-29-17/h4,6-8,10-11,15H,3,5,9,12H2,1-2H3,(H,21,23)/t15-/m0/s1	YVBGZNLZDQAXIH-HNNXBMFYSA-N	418.119857134							122042
MLS000574230	LSM-44485	SID17414093, BRD-K20369200	2230620	InChI=1S/C16H12N2O4S2/c1-2-23-16-17-12(15(19)24-16)9-10-7-8-14(22-10)11-5-3-4-6-13(11)18(20)21/h3-9H,2H2,1H3/b12-9-	VYSPHADEYKHZOS-XFXZXTDPSA-N	CCSC1=N\C(=C/c2oc(cc2)c3ccccc3[N+](=O)[O-])\C(=O)S1	BroadT	BRD-K20369200	BRD-K20369200-001-05-7	ChemBridge Corporation	6636065			CCSC1=N\C(=C/c2ccc(o2)-c2ccccc2[N+]([O-])=O)C(=O)S1	InChI=1S/C16H12N2O4S2/c1-2-23-16-17-12(15(19)24-16)9-10-7-8-14(22-10)11-5-3-4-6-13(11)18(20)21/h3-9H,2H2,1H3/b12-9-	VYSPHADEYKHZOS-XFXZXTDPSA-N	360.023848264							
MLS001017600	LSM-44486	SID24828094, BRD-K68831164	5637963	InChI=1S/C20H21N3O2/c1-2-25-20(24)17(14-21)13-16-12-15-8-4-5-9-18(15)22-19(16)23-10-6-3-7-11-23/h4-5,8-9,12-13H,2-3,6-7,10-11H2,1H3/b17-13+	HAFDMQYCXZVSSA-GHRIWEEISA-N	CCOC(=O)\C(=C\c1cc2ccccc2nc1N3CCCCC3)\C#N	BroadT	BRD-K68831164	BRD-K68831164-001-06-1	Enamine Ltd.	T5247628			CCOC(=O)C(=C\c1cc2ccccc2nc1N1CCCCC1)\C#N	InChI=1S/C20H21N3O2/c1-2-25-20(24)17(14-21)13-16-12-15-8-4-5-9-18(15)22-19(16)23-10-6-3-7-11-23/h4-5,8-9,12-13H,2-3,6-7,10-11H2,1H3/b17-13+	HAFDMQYCXZVSSA-GHRIWEEISA-N	335.163376942							
N-[(5-Chloropyridin-2-yl)carbamothioyl]thiophene-2-carboxamide	LSM-33488	SID17415852, BRD-K52264888	739004	InChI=1S/C11H8ClN3OS2/c12-7-3-4-9(13-6-7)14-11(17)15-10(16)8-2-1-5-18-8/h1-6H,(H2,13,14,15,16,17)	UTQNZQXREZQZIG-UHFFFAOYSA-N	Clc1ccc(NC(=S)NC(=O)c2cccs2)nc1	BroadT	BRD-K52264888	BRD-K52264888-001-05-0	ChemBridge Corporation	6328091			Clc1ccc(NC(=S)NC(=O)c2cccs2)nc1	InChI=1S/C11H8ClN3OS2/c12-7-3-4-9(13-6-7)14-11(17)15-10(16)8-2-1-5-18-8/h1-6H,(H2,13,14,15,16,17)	UTQNZQXREZQZIG-UHFFFAOYSA-N	296.979730996							122045
MLS001126441	LSM-33489	SID24400004, SID49724110, BRD-A98296758	16021631	InChI=1S/C28H37N7O/c1-20-7-6-8-23(17-20)34-16-15-33(18-21(34)2)28(36)22-10-13-32(14-11-22)26-25-27(30-19-29-26)35-12-5-3-4-9-24(35)31-25/h6-8,17,19,21-22H,3-5,9-16,18H2,1-2H3	PJMXWGYUYMLFCR-UHFFFAOYSA-N	CC1CN(CCN1c2cccc(C)c2)C(=O)C3CCN(CC3)c4ncnc5c4nc6CCCCCn56	BroadT	BRD-A98296758	BRD-A98296758-001-05-7	ChemDiv Inc.	E715-0651			CC1CN(CCN1c1cccc(C)c1)C(=O)C1CCN(CC1)c1ncnc2n3CCCCCc3nc12	InChI=1S/C28H37N7O/c1-20-7-6-8-23(17-20)34-16-15-33(18-21(34)2)28(36)22-10-13-32(14-11-22)26-25-27(30-19-29-26)35-12-5-3-4-9-24(35)31-25/h6-8,17,19,21-22H,3-5,9-16,18H2,1-2H3	PJMXWGYUYMLFCR-UHFFFAOYSA-N	487.305958874							122046
BAS 05435832	LSM-33490	SID17408831, BRD-A07728944	3152310	InChI=1S/C14H15F3N2O3/c1-3-22-12(20)19-13(21,14(15,16)17)8-11(18-19)10-6-4-9(2)5-7-10/h4-7,21H,3,8H2,1-2H3	WRFRKUUPZBLDQT-UHFFFAOYSA-N	CCOC(=O)N1N=C(CC1(O)C(F)(F)F)c2ccc(C)cc2	BroadT	BRD-A07728944	BRD-A07728944-001-05-4	Asinex Ltd.	BAS 05435832			CCOC(=O)N1N=C(CC1(O)C(F)(F)F)c1ccc(C)cc1	InChI=1S/C14H15F3N2O3/c1-3-22-12(20)19-13(21,14(15,16)17)8-11(18-19)10-6-4-9(2)5-7-10/h4-7,21H,3,8H2,1-2H3	WRFRKUUPZBLDQT-UHFFFAOYSA-N	316.10347696							122047
ZINC05019563	LSM-33491	SID22410806, BRD-K65476316	4286972	InChI=1S/C15H18N4O3S/c1-10-5-6-12(7-14(10)23(21,22)19(3)4)18-15(20)13-9-16-11(2)8-17-13/h5-9H,1-4H3,(H,18,20)	FFSRUABGJBZTJM-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cc(NC(=O)c2cnc(C)cn2)ccc1C	BroadT	BRD-K65476316	BRD-K65476316-001-05-7	Enamine Ltd.	T0509-8755			CN(C)S(=O)(=O)c1cc(NC(=O)c2cnc(C)cn2)ccc1C	InChI=1S/C15H18N4O3S/c1-10-5-6-12(7-14(10)23(21,22)19(3)4)18-15(20)13-9-16-11(2)8-17-13/h5-9H,1-4H3,(H,18,20)	FFSRUABGJBZTJM-UHFFFAOYSA-N	334.109961166							122048
GNF-PF-4097	LSM-33492	GNF-PF-4097, BRD-K30048240	3237215	InChI=1S/C17H25BrN2O3S/c1-4-8-19(9-5-2)24(22,23)15-12-14(18)11-13-7-10-20(17(13)15)16(21)6-3/h11-12H,4-10H2,1-3H3	HGPMNDUVXYWELC-UHFFFAOYSA-N	CCCN(CCC)S(=O)(=O)c1cc(Br)cc2CCN(C(=O)CC)c12	BroadT	BRD-K30048240	BRD-K30048240-001-05-7	ChemDiv Inc.	C137-1335			CCCN(CCC)S(=O)(=O)c1cc(Br)cc2CCN(C(=O)CC)c12	InChI=1S/C17H25BrN2O3S/c1-4-8-19(9-5-2)24(22,23)15-12-14(18)11-13-7-10-20(17(13)15)16(21)6-3/h11-12H,4-10H2,1-3H3	HGPMNDUVXYWELC-UHFFFAOYSA-N	416.07692597							122049
MLS000834655	LSM-33493	SID24833127, BRD-K11016696	16196416	InChI=1S/C28H26N4O4/c33-26(29-17-21-12-6-2-7-13-21)24-25(31-19-30-24)27(34)32-23(16-20-10-4-1-5-11-20)28(35)36-18-22-14-8-3-9-15-22/h1-15,19,23H,16-18H2,(H,29,33)(H,30,31)(H,32,34)/t23-/m0/s1	XUCRLTNRZDEDGH-QHCPKHFHSA-N	O=C(OCc1ccccc1)[C@H](Cc2ccccc2)NC(=O)c3[nH]cnc3C(=O)NCc4ccccc4	BroadT	BRD-K11016696	BRD-K11016696-001-05-6	University of Tulsa	AE03_PA05			O=C(OCc1ccccc1)[C@H](Cc1ccccc1)NC(=O)c1[nH]cnc1C(=O)NCc1ccccc1	InChI=1S/C28H26N4O4/c33-26(29-17-21-12-6-2-7-13-21)24-25(31-19-30-24)27(34)32-23(16-20-10-4-1-5-11-20)28(35)36-18-22-14-8-3-9-15-22/h1-15,19,23H,16-18H2,(H,29,33)(H,30,31)(H,32,34)/t23-/m0/s1	XUCRLTNRZDEDGH-QHCPKHFHSA-N	482.195405352							122050
MLS000571036	LSM-33494	SID16952725, BRD-K50551041	2410320	InChI=1S/C15H14BrNO5S2/c1-10-2-4-11(5-3-10)24(20,21)17-8-15(19)22-9-12(18)13-6-7-14(16)23-13/h2-7,17H,8-9H2,1H3	NHCGYYGTUSDBLJ-UHFFFAOYSA-N	Cc1ccc(cc1)S(=O)(=O)NCC(=O)OCC(=O)c2ccc(Br)s2	BroadT	BRD-K50551041	BRD-K50551041-001-06-4	Enamine Ltd.	T0515-2574			Cc1ccc(cc1)S(=O)(=O)NCC(=O)OCC(=O)c1ccc(Br)s1	InChI=1S/C15H14BrNO5S2/c1-10-2-4-11(5-3-10)24(20,21)17-8-15(19)22-9-12(18)13-6-7-14(16)23-13/h2-7,17H,8-9H2,1H3	NHCGYYGTUSDBLJ-UHFFFAOYSA-N	430.949676538							122051
AK-777/11656079	LSM-33495	BRD-A52069473	644905	InChI=1S/C18H20N4O2/c1-3-7-13-16-15(11-8-5-6-9-14(11)23-4-2)12(10-19)17(20)24-18(16)22-21-13/h5-6,8-9,12,15,20H,3-4,7H2,1-2H3,(H,21,22)	MDYBNLMLDILDNH-UHFFFAOYSA-N	CCCc1[nH]nc2OC(=N)C(C#N)C(c12)c1ccccc1OCC	BroadT	BRD-A52069473	BRD-A52069473-001-06-4	Asinex Ltd.	BAS 07417911			CCCc1n[nH]c2OC(N)=C(C#N)C(c12)c1ccccc1OCC	InChI=1S/C18H20N4O2/c1-3-7-13-16-15(11-8-5-6-9-14(11)23-4-2)12(10-19)17(20)24-18(16)22-21-13/h5-6,8-9,15H,3-4,7,20H2,1-2H3,(H,21,22)	LQVJZDWTGCAAAV-UHFFFAOYSA-N	324.15862592							
N'-benzoyl-5-(3,5-dichlorophenoxy)-2-furohydrazide	LSM-33496	SID26729599, BRD-K01423115	2744558	InChI=1S/C18H12Cl2N2O4/c19-12-8-13(20)10-14(9-12)25-16-7-6-15(26-16)18(24)22-21-17(23)11-4-2-1-3-5-11/h1-10H,(H,21,23)(H,22,24)	ZBADYBKPDJJDAV-UHFFFAOYSA-N	Clc1cc(Cl)cc(Oc2oc(cc2)C(=O)NNC(=O)c3ccccc3)c1	BroadT	BRD-K01423115	BRD-K01423115-001-05-9	Maybridge	SPB 03105			Clc1cc(Cl)cc(Oc2ccc(o2)C(=O)NNC(=O)c2ccccc2)c1	InChI=1S/C18H12Cl2N2O4/c19-12-8-13(20)10-14(9-12)25-16-7-6-15(26-16)18(24)22-21-17(23)11-4-2-1-3-5-11/h1-10H,(H,21,23)(H,22,24)	ZBADYBKPDJJDAV-UHFFFAOYSA-N	390.017412304							122053
AC1M06TS	LSM-33497	BRD-K74311809	1991623	InChI=1S/C8H11N3S2/c1-2-9-8(12)11-10-6-7-4-3-5-13-7/h3-6H,2H2,1H3,(H2,9,11,12)	ZAHRLVBYQPAUMY-UHFFFAOYSA-N	CCN=C(S)NN=Cc1cccs1	BroadT	BRD-K74311809	BRD-K74311809-001-05-9	Enamine Ltd.	T0518-2734			CCN=C(S)NN=Cc1cccs1	InChI=1S/C8H11N3S2/c1-2-9-8(12)11-10-6-7-4-3-5-13-7/h3-6H,2H2,1H3,(H2,9,11,12)	ZAHRLVBYQPAUMY-UHFFFAOYSA-N	213.039438762							122054
MLS000048282	LSM-33498	SID4265038, BRD-K01822814	893687	InChI=1S/C16H17N5O2/c1-20(12-5-7-13(23-3)8-6-12)16(22)17-11-4-9-15-14(10-11)18-19-21(15)2/h4-10H,1-3H3,(H,17,22)	XVMYWSXJMUXOAC-UHFFFAOYSA-N	COc1ccc(cc1)N(C)C(=O)Nc2ccc3c(c2)nnn3C	BroadT	BRD-K01822814	BRD-K01822814-001-05-6	ChemBridge Corporation	7589597			COc1ccc(cc1)N(C)C(=O)Nc1ccc2n(C)nnc2c1	InChI=1S/C16H17N5O2/c1-20(12-5-7-13(23-3)8-6-12)16(22)17-11-4-9-15-14(10-11)18-19-21(15)2/h4-10H,1-3H3,(H,17,22)	XVMYWSXJMUXOAC-UHFFFAOYSA-N	311.138224834							122055
MLS000735497	LSM-33499	SID24800554, BRD-K91655106	16192223	InChI=1S/C24H26FN5/c1-17-4-10-23(11-5-17)30-16-21(24(28-30)20-6-8-22(25)9-7-20)15-26-12-13-29-19(3)14-18(2)27-29/h4-11,14,16,26H,12-13,15H2,1-3H3	SCKXXJKTIMSHFN-UHFFFAOYSA-N	Cc1ccc(cc1)n2cc(CNCCn3nc(C)cc3C)c(n2)c4ccc(F)cc4	BroadT	BRD-K91655106	BRD-K91655106-001-05-8	ChemBridge Corporation	46057927			Cc1cc(C)n(CCNCc2cn(nc2-c2ccc(F)cc2)-c2ccc(C)cc2)n1	InChI=1S/C24H26FN5/c1-17-4-10-23(11-5-17)30-16-21(24(28-30)20-6-8-22(25)9-7-20)15-26-12-13-29-19(3)14-18(2)27-29/h4-11,14,16,26H,12-13,15H2,1-3H3	SCKXXJKTIMSHFN-UHFFFAOYSA-N	403.217224082							122056
ZINC00533866	LSM-33500	SID862288, BRD-K04148681	663511	InChI=1S/C19H18N4O/c1-3-12-23-18(13-8-10-14(24-2)11-9-13)22-17-19(23)21-16-7-5-4-6-15(16)20-17/h4-11H,3,12H2,1-2H3	FFNDQAITXYXHQB-UHFFFAOYSA-N	CCCn1c(nc2nc3ccccc3nc12)c4ccc(OC)cc4	BroadT	BRD-K04148681	BRD-K04148681-001-05-3	InterBioScreen Ltd.	STOCK4S-33600			CCCn1c(nc2nc3ccccc3nc12)-c1ccc(OC)cc1	InChI=1S/C19H18N4O/c1-3-12-23-18(13-8-10-14(24-2)11-9-13)22-17-19(23)21-16-7-5-4-6-15(16)20-17/h4-11H,3,12H2,1-2H3	FFNDQAITXYXHQB-UHFFFAOYSA-N	318.148061236							122057
Methyl 5-({[5-(4-chlorophenyl)-2-(trifluoromethyl)-3-furyl]carbonyl}amino)-2-morpholinobenzoate	LSM-33501	SID26729744, BRD-K31479951	2810079	InChI=1S/C24H20ClF3N2O5/c1-33-23(32)17-12-16(6-7-19(17)30-8-10-34-11-9-30)29-22(31)18-13-20(35-21(18)24(26,27)28)14-2-4-15(25)5-3-14/h2-7,12-13H,8-11H2,1H3,(H,29,31)	WXNZOBPUSXPFAB-UHFFFAOYSA-N	COC(=O)c1cc(NC(=O)c2cc(oc2C(F)(F)F)c3ccc(Cl)cc3)ccc1N4CCOCC4	BroadT	BRD-K31479951	BRD-K31479951-001-06-0	Maybridge	HTS 01355			COC(=O)c1cc(NC(=O)c2cc(oc2C(F)(F)F)-c2ccc(Cl)cc2)ccc1N1CCOCC1	InChI=1S/C24H20ClF3N2O5/c1-33-23(32)17-12-16(6-7-19(17)30-8-10-34-11-9-30)29-22(31)18-13-20(35-21(18)24(26,27)28)14-2-4-15(25)5-3-14/h2-7,12-13H,8-11H2,1H3,(H,29,31)	WXNZOBPUSXPFAB-UHFFFAOYSA-N	508.10128407							122058
N-(2-Pyridin-3-yl-benzooxazol-5-yl)-butyramide	LSM-33502	SID852637, BRD-K24263561	655274	InChI=1S/C16H15N3O2/c1-2-4-15(20)18-12-6-7-14-13(9-12)19-16(21-14)11-5-3-8-17-10-11/h3,5-10H,2,4H2,1H3,(H,18,20)	LOIKNWPFNIRTAC-UHFFFAOYSA-N	CCCC(=O)Nc1ccc2oc(nc2c1)c3cccnc3	BroadT	BRD-K24263561	BRD-K24263561-001-05-1	Asinex Ltd.	BAS 08836081			CCCC(=O)Nc1ccc2oc(nc2c1)-c1cccnc1	InChI=1S/C16H15N3O2/c1-2-4-15(20)18-12-6-7-14-13(9-12)19-16(21-14)11-5-3-8-17-10-11/h3,5-10H,2,4H2,1H3,(H,18,20)	LOIKNWPFNIRTAC-UHFFFAOYSA-N	281.11642675							122059
2-[(Phenylsulfonyl)(2-pyridinyl)amino]acetic acid	LSM-33503	SID14730270, BRD-K02324590	1472180	InChI=1S/C13H12N2O4S/c16-13(17)10-15(12-8-4-5-9-14-12)20(18,19)11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)	VAHXWPCPCXYHCI-UHFFFAOYSA-N	OC(=O)CN(c1ccccn1)S(=O)(=O)c2ccccc2	BroadT	BRD-K02324590	BRD-K02324590-001-05-2	Key Organics Ltd.	10K-306S			OC(=O)CN(c1ccccn1)S(=O)(=O)c1ccccc1	InChI=1S/C13H12N2O4S/c16-13(17)10-15(12-8-4-5-9-14-12)20(18,19)11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)	VAHXWPCPCXYHCI-UHFFFAOYSA-N	292.051777574							122060
F0666-1622	LSM-33504	SID4241917, BRD-K05625761	3236831	InChI=1S/C19H16FNO5/c1-2-24-19(23)18-17(14-5-3-4-6-15(14)26-18)21-16(22)11-25-13-9-7-12(20)8-10-13/h3-10H,2,11H2,1H3,(H,21,22)	JJGFZJWPTMPRCJ-UHFFFAOYSA-N	CCOC(=O)c1oc2ccccc2c1NC(=O)COc3ccc(F)cc3	BroadT	BRD-K05625761	BRD-K05625761-001-05-2	ChemDiv Inc.	C686-1519			CCOC(=O)c1oc2ccccc2c1NC(=O)COc1ccc(F)cc1	InChI=1S/C19H16FNO5/c1-2-24-19(23)18-17(14-5-3-4-6-15(14)26-18)21-16(22)11-25-13-9-7-12(20)8-10-13/h3-10H,2,11H2,1H3,(H,21,22)	JJGFZJWPTMPRCJ-UHFFFAOYSA-N	357.101250822							122061
AC1MQL5V	LSM-33505	BRD-K24671563	3478472	InChI=1S/C16H15ClN2O2/c1-11-2-4-13(9-14(11)17)19-18-10-12-3-5-15-16(8-12)21-7-6-20-15/h2-5,8-10,19H,6-7H2,1H3	AOLNBLUKJHZASN-UHFFFAOYSA-N	Cc1ccc(NN=Cc2ccc3OCCOc3c2)cc1Cl	BroadT	BRD-K24671563	BRD-K24671563-001-07-9	Enamine Ltd.	T0518-3447			Cc1ccc(NN=Cc2ccc3OCCOc3c2)cc1Cl	InChI=1S/C16H15ClN2O2/c1-11-2-4-13(9-14(11)17)19-18-10-12-3-5-15-16(8-12)21-7-6-20-15/h2-5,8-10,19H,6-7H2,1H3	AOLNBLUKJHZASN-UHFFFAOYSA-N	302.08220545							122062
2-(2-Cyclohexyl-quinazolin-4-ylsulfanyl)-n-(4-methyl-furazan-3-yl)-acetamide	LSM-33506	SID850880, BRD-K32505214	653427	InChI=1S/C19H21N5O2S/c1-12-17(24-26-23-12)21-16(25)11-27-19-14-9-5-6-10-15(14)20-18(22-19)13-7-3-2-4-8-13/h5-6,9-10,13H,2-4,7-8,11H2,1H3,(H,21,24,25)	MBMXLACYDMNHQW-UHFFFAOYSA-N	Cc1nonc1NC(=O)CSc2nc(nc3ccccc23)C4CCCCC4	BroadT	BRD-K32505214	BRD-K32505214-001-05-6	Asinex Ltd.	ASN 06532447			Cc1nonc1NC(=O)CSc1nc(nc2ccccc12)C1CCCCC1	InChI=1S/C19H21N5O2S/c1-12-17(24-26-23-12)21-16(25)11-27-19-14-9-5-6-10-15(14)20-18(22-19)13-7-3-2-4-8-13/h5-6,9-10,13H,2-4,7-8,11H2,1H3,(H,21,24,25)	MBMXLACYDMNHQW-UHFFFAOYSA-N	383.141595652							122063
F0521-0048	LSM-33507	SID3713933, SID7969894, BRD-K33728616	697693	InChI=1S/C18H16N6/c1-13-5-4-7-15(9-13)24-18-16(11-23-24)17(21-12-22-18)20-10-14-6-2-3-8-19-14/h2-9,11-12H,10H2,1H3,(H,20,21,22)	JQNVSBKRXFJQIQ-UHFFFAOYSA-N	Cc1cccc(c1)n2ncc3c(NCc4ccccn4)ncnc23	BroadT	BRD-K33728616	BRD-K33728616-001-05-7	Life Chemicals Inc.	F0521-0048			Cc1cccc(c1)-n1ncc2c(NCc3ccccn3)ncnc12	InChI=1S/C18H16N6/c1-13-5-4-7-15(9-13)24-18-16(11-23-24)17(21-12-22-18)20-10-14-6-2-3-8-19-14/h2-9,11-12H,10H2,1H3,(H,20,21,22)	JQNVSBKRXFJQIQ-UHFFFAOYSA-N	316.143644572							122064
STK178825	LSM-33508	SID17433298, BRD-K25746252	2243417	InChI=1S/C21H19N5OS/c27-19(18-12-7-13-28-18)26-21(23-15-17-10-5-2-6-11-17)24-20(25-26)22-14-16-8-3-1-4-9-16/h1-13H,14-15H2,(H2,22,23,24,25)	RYODVQITGKXGGG-UHFFFAOYSA-N	O=C(c1cccs1)n2nc(NCc3ccccc3)nc2NCc4ccccc4	BroadT	BRD-K25746252	BRD-K25746252-001-05-8	ChemBridge Corporation	7991217			O=C(c1cccs1)n1nc(NCc2ccccc2)nc1NCc1ccccc1	InChI=1S/C21H19N5OS/c27-19(18-12-7-13-28-18)26-21(23-15-17-10-5-2-6-11-17)24-20(25-26)22-14-16-8-3-1-4-9-16/h1-13H,14-15H2,(H2,22,23,24,25)	RYODVQITGKXGGG-UHFFFAOYSA-N	389.131030968							122065
1,3-Diphenethylthiourea	LSM-33509	SID22416017, BRD-K14527025	799650	InChI=1S/C17H20N2S/c20-17(18-13-11-15-7-3-1-4-8-15)19-14-12-16-9-5-2-6-10-16/h1-10H,11-14H2,(H2,18,19,20)	HVCLISLMGLZZDM-UHFFFAOYSA-N	S=C(NCCc1ccccc1)NCCc2ccccc2	BroadT	BRD-K14527025	BRD-K14527025-001-05-1	ChemBridge Corporation	6888869			S=C(NCCc1ccccc1)NCCc1ccccc1	InChI=1S/C17H20N2S/c20-17(18-13-11-15-7-3-1-4-8-15)19-14-12-16-9-5-2-6-10-16/h1-10H,11-14H2,(H2,18,19,20)	HVCLISLMGLZZDM-UHFFFAOYSA-N	284.13471935							122066
ST071009	LSM-33510	SID4260124, BRD-K10609802	893444	InChI=1S/C17H21NO3/c1-3-12-18-14(7-11-17(19)20)6-10-16(18)13-4-8-15(21-2)9-5-13/h4-6,8-10H,3,7,11-12H2,1-2H3,(H,19,20)	KLCKOWUTOXPCEW-UHFFFAOYSA-N	CCCn1c(CCC(=O)O)ccc1c2ccc(OC)cc2	BroadT	BRD-K10609802	BRD-K10609802-001-05-0	ChemBridge Corporation	7579099			CCCn1c(CCC(O)=O)ccc1-c1ccc(OC)cc1	InChI=1S/C17H21NO3/c1-3-12-18-14(7-11-17(19)20)6-10-16(18)13-4-8-15(21-2)9-5-13/h4-6,8-10H,3,7,11-12H2,1-2H3,(H,19,20)	KLCKOWUTOXPCEW-UHFFFAOYSA-N	287.152143542							122067
SMR000116179	LSM-33511	SID14724369, SID85302338, BRD-A65735348	3093479	InChI=1S/C17H14Cl4N4O4S/c1-29-11-5-6-12(13(8-11)25(27)28)22-16(30)24-15(17(19,20)21)23-14(26)9-3-2-4-10(18)7-9/h2-8,15H,1H3,(H,23,26)(H2,22,24,30)	ZZNOGSGZWQWJEL-UHFFFAOYSA-N	COc1ccc(N=C(S)NC(NC(=O)c2cccc(Cl)c2)C(Cl)(Cl)Cl)c(c1)[N+](=O)[O-]	BroadT	BRD-A65735348	BRD-A65735348-001-06-8	Asinex Ltd.	BAS 00157743			COc1ccc(N=C(S)NC(NC(=O)c2cccc(Cl)c2)C(Cl)(Cl)Cl)c(c1)[N+]([O-])=O	InChI=1S/C17H14Cl4N4O4S/c1-29-11-5-6-12(13(8-11)25(27)28)22-16(30)24-15(17(19,20)21)23-14(26)9-3-2-4-10(18)7-9/h2-8,15H,1H3,(H,23,26)(H2,22,24,30)	ZZNOGSGZWQWJEL-UHFFFAOYSA-N	509.948986498							122068
MLS001121508	LSM-33512	SID49723179, BRD-K80212885	22518054	InChI=1S/C15H14N4O4S2/c1-10-5-3-6-11(9-10)19(2)25(21,22)15-18-17-14(24-15)16-13(20)12-7-4-8-23-12/h3-9H,1-2H3,(H,16,17,20)	GWXJGMVLZYQQSF-UHFFFAOYSA-N	CN(c1cccc(C)c1)S(=O)(=O)c2nnc(NC(=O)c3occc3)s2	BroadT	BRD-K80212885	BRD-K80212885-001-06-6	ChemDiv Inc.	E157-6077			CN(c1cccc(C)c1)S(=O)(=O)c1nnc(NC(=O)c2ccco2)s1	InChI=1S/C15H14N4O4S2/c1-10-5-3-6-11(9-10)19(2)25(21,22)15-18-17-14(24-15)16-13(20)12-7-4-8-23-12/h3-9H,1-2H3,(H,16,17,20)	GWXJGMVLZYQQSF-UHFFFAOYSA-N	378.045646348							122069
T0515-2859	LSM-33513	SID26724241, BRD-A63834895	4590386	InChI=1S/C20H29N3O4S2/c1-14-10-15(2)13-22(12-14)20(28)21-19(24)18-11-17(5-4-16(18)3)29(25,26)23-6-8-27-9-7-23/h4-5,11,14-15H,6-10,12-13H2,1-3H3,(H,21,24,28)	RABMYPHHSBPPPN-UHFFFAOYSA-N	CC1CC(C)CN(C1)C(=S)NC(=O)c2cc(ccc2C)S(=O)(=O)N3CCOCC3	BroadT	BRD-A63834895	BRD-A63834895-001-05-0	Enamine Ltd.	T0515-2859			CC1CC(C)CN(C1)C(=S)NC(=O)c1cc(ccc1C)S(=O)(=O)N1CCOCC1	InChI=1S/C20H29N3O4S2/c1-14-10-15(2)13-22(12-14)20(28)21-19(24)18-11-17(5-4-16(18)3)29(25,26)23-6-8-27-9-7-23/h4-5,11,14-15H,6-10,12-13H2,1-3H3,(H,21,24,28)	RABMYPHHSBPPPN-UHFFFAOYSA-N	439.159947818							122070
T5286264	LSM-33514	SID22405255, BRD-K48977762	2491151	InChI=1S/C20H21F2N3O6S/c1-12(2)10-23-20(28)24-18(26)11-31-19(27)13-4-3-5-14(8-13)25-32(29,30)15-6-7-16(21)17(22)9-15/h3-9,12,25H,10-11H2,1-2H3,(H2,23,24,26,28)	BWVQPWJYQLXBCM-UHFFFAOYSA-N	CC(C)CNC(=O)NC(=O)COC(=O)c1cccc(NS(=O)(=O)c2ccc(F)c(F)c2)c1	BroadT	BRD-K48977762	BRD-K48977762-001-05-5	Enamine Ltd.	T5286264			CC(C)CNC(=O)NC(=O)COC(=O)c1cccc(NS(=O)(=O)c2ccc(F)c(F)c2)c1	InChI=1S/C20H21F2N3O6S/c1-12(2)10-23-20(28)24-18(26)11-31-19(27)13-4-3-5-14(8-13)25-32(29,30)15-6-7-16(21)17(22)9-15/h3-9,12,25H,10-11H2,1-2H3,(H2,23,24,26,28)	BWVQPWJYQLXBCM-UHFFFAOYSA-N	469.111912512							122071
AC1N9QTW	LSM-33515	SID22405226, BRD-A80553512	4414924	InChI=1S/C20H20N2O3S/c1-3-24-19(23)18-13(2)17(21-20(26)22-18)14-8-7-11-16(12-14)25-15-9-5-4-6-10-15/h4-12,17H,3H2,1-2H3,(H2,21,22,26)	DCPJOTJWFRACTE-UHFFFAOYSA-N	CCOC(=O)C1=C(C)C(NC(=N1)S)c2cccc(Oc3ccccc3)c2	BroadT	BRD-A80553512	BRD-A80553512-001-05-8	Specs	AG-690/36517013			CCOC(=O)C1=C(C)C(NC(S)=N1)c1cccc(Oc2ccccc2)c1	InChI=1S/C20H20N2O3S/c1-3-24-19(23)18-13(2)17(21-20(26)22-18)14-8-7-11-16(12-14)25-15-9-5-4-6-10-15/h4-12,17H,3H2,1-2H3,(H2,21,22,26)	DCPJOTJWFRACTE-UHFFFAOYSA-N	368.11946321							122072
Benzenamine, 4-methoxy-n-(1H-pyrrol-2-ylmethylene)-	LSM-33516	BRD-K42843198	6742685	InChI=1S/C12H12N2O/c1-15-12-6-4-10(5-7-12)14-9-11-3-2-8-13-11/h2-9,13H,1H3	OBFWVPAWQMRFAA-UHFFFAOYSA-N	COc1ccc(cc1)N=Cc2ccc[nH]2	BroadT	BRD-K42843198	BRD-K42843198-001-05-9	ChemBridge Corporation	5214578			COc1ccc(cc1)N=Cc1ccc[nH]1	InChI=1S/C12H12N2O/c1-15-12-6-4-10(5-7-12)14-9-11-3-2-8-13-11/h2-9,13H,1H3	OBFWVPAWQMRFAA-UHFFFAOYSA-N	200.094963024							
ZINC04895858	LSM-33517	SID22410139, BRD-K83741996	5042313	InChI=1S/C20H21N3O5/c1-13-6-8-22(9-7-13)16-4-2-14(10-17(16)23(25)26)20(24)21-15-3-5-18-19(11-15)28-12-27-18/h2-5,10-11,13H,6-9,12H2,1H3,(H,21,24)	BLEXXZVWXZWESJ-UHFFFAOYSA-N	CC1CCN(CC1)c2ccc(cc2[N+](=O)[O-])C(=O)Nc3ccc4OCOc4c3	BroadT	BRD-K83741996	BRD-K83741996-001-05-9	Enamine Ltd.	T5257474			CC1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(=O)Nc1ccc2OCOc2c1	InChI=1S/C20H21N3O5/c1-13-6-8-22(9-7-13)16-4-2-14(10-17(16)23(25)26)20(24)21-15-3-5-18-19(11-15)28-12-27-18/h2-5,10-11,13H,6-9,12H2,1H3,(H,21,24)	BLEXXZVWXZWESJ-UHFFFAOYSA-N	383.148120802							122074
MLS001142638	LSM-33518	SID49819809, BRD-A24881974	4033235	InChI=1S/C17H28N4O2S/c1-11(2)7-15-19-20-17(24-15)18-14(22)5-6-16(23)21-9-12(3)8-13(4)10-21/h11-13H,5-10H2,1-4H3,(H,18,20,22)	XZZFZSVOVSMAEA-UHFFFAOYSA-N	CC(C)Cc1nnc(NC(=O)CCC(=O)N2CC(C)CC(C)C2)s1	BroadT	BRD-A24881974	BRD-A24881974-001-06-1	InterBioScreen Ltd.	STOCK4S-76122			CC(C)Cc1nnc(NC(=O)CCC(=O)N2CC(C)CC(C)C2)s1	InChI=1S/C17H28N4O2S/c1-11(2)7-15-19-20-17(24-15)18-14(22)5-6-16(23)21-9-12(3)8-13(4)10-21/h11-13H,5-10H2,1-4H3,(H,18,20,22)	XZZFZSVOVSMAEA-UHFFFAOYSA-N	352.193296866							122075
MLS000720952	LSM-33519	SID24821467, BRD-K50708548	2767809	InChI=1S/C15H13N3OS/c1-11-4-2-3-5-13(11)10-20-15-18-17-14(19-15)12-6-8-16-9-7-12/h2-9H,10H2,1H3	ILKVIRGQIRHLQF-UHFFFAOYSA-N	Cc1ccccc1CSc2oc(nn2)c3ccncc3	BroadT	BRD-K50708548	BRD-K50708548-001-06-8	Key Organics Ltd.	11P-167			Cc1ccccc1CSc1nnc(o1)-c1ccncc1	InChI=1S/C15H13N3OS/c1-11-4-2-3-5-13(11)10-20-15-18-17-14(19-15)12-6-8-16-9-7-12/h2-9H,10H2,1H3	ILKVIRGQIRHLQF-UHFFFAOYSA-N	283.077932756							122076
SMR000206909	LSM-33520	SID17509773, BRD-K61893788	12004966	InChI=1S/C24H29ClN4OS/c1-27-17-19(22-8-2-3-9-23(22)27)18-29(11-5-10-28-12-14-30-15-13-28)24(31)26-21-7-4-6-20(25)16-21/h2-4,6-9,16-17H,5,10-15,18H2,1H3,(H,26,31)	JZWQVKCQOJKTEF-UHFFFAOYSA-N	Cn1cc(CN(CCCN2CCOCC2)C(=Nc3cccc(Cl)c3)S)c4ccccc14	BroadT	BRD-K61893788	BRD-K61893788-001-05-6	ChemDiv Inc.	K783-5529			Cn1cc(CN(CCCN2CCOCC2)C(S)=Nc2cccc(Cl)c2)c2ccccc12	InChI=1S/C24H29ClN4OS/c1-27-17-19(22-8-2-3-9-23(22)27)18-29(11-5-10-28-12-14-30-15-13-28)24(31)26-21-7-4-6-20(25)16-21/h2-4,6-9,16-17H,5,10-15,18H2,1H3,(H,26,31)	JZWQVKCQOJKTEF-UHFFFAOYSA-N	456.175059988							122077
N-(4-Ethoxyphenyl)-3-hydroxy-2-naphthamide	LSM-33521	NSC-50690, BRD-K24997804	78443	InChI=1S/C19H17NO3/c1-2-23-16-9-7-15(8-10-16)20-19(22)17-11-13-5-3-4-6-14(13)12-18(17)21/h3-12,21H,2H2,1H3,(H,20,22)	FYJKEJZGNQVNLC-UHFFFAOYSA-N	CCOc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1	BroadT	BRD-K24997804	BRD-K24997804-001-05-1	National Cancer Institute Chemotherapeutic Agents Repository	3-Hydroxy-2-naphtho-p-phenetidide 50690			CCOc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1	InChI=1S/C19H17NO3/c1-2-23-16-9-7-15(8-10-16)20-19(22)17-11-13-5-3-4-6-14(13)12-18(17)21/h3-12,21H,2H2,1H3,(H,20,22)	FYJKEJZGNQVNLC-UHFFFAOYSA-N	307.120843414							122078
CHEMBL579219	LSM-33522	SID3716623, BRD-K94721484	2612441	InChI=1S/C15H14N2O3S2/c1-8-9(2)22-14-12(8)13(16-7-17-14)21-6-10-4-5-11(20-10)15(18)19-3/h4-5,7H,6H2,1-3H3	JYASBMHTSQDQDJ-UHFFFAOYSA-N	COC(=O)c1oc(CSc2ncnc3sc(C)c(C)c23)cc1	BroadT	BRD-K94721484	BRD-K94721484-001-05-7	Enamine Ltd.	ZT-6070563			COC(=O)c1ccc(CSc2ncnc3sc(C)c(C)c23)o1	InChI=1S/C15H14N2O3S2/c1-8-9(2)22-14-12(8)13(16-7-17-14)21-6-10-4-5-11(20-10)15(18)19-3/h4-5,7H,6H2,1-3H3	JYASBMHTSQDQDJ-UHFFFAOYSA-N	334.044583708							122079
2-[2-(4-Methoxyphenyl)-2-oxoethyl]-1-methylisoquinolinium	LSM-15239	BRD-K68302507	1563261	InChI=1S/C19H18NO2/c1-14-18-6-4-3-5-15(18)11-12-20(14)13-19(21)16-7-9-17(22-2)10-8-16/h3-12H,13H2,1-2H3/q+1	YJAVIBSBWLCIMY-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)C[n+]2ccc3ccccc3c2C	BroadT	BRD-K68302507	BRD-K68302507-004-07-1	InterBioScreen Ltd.	STOCK1S-86250		Br	COc1ccc(cc1)C(=O)C[n+]1ccc2ccccc2c1C.Br	InChI=1S/C19H18NO2.BrH/c1-14-18-6-4-3-5-15(18)11-12-20(14)13-19(21)16-7-9-17(22-2)10-8-16;/h3-12H,13H2,1-2H3;1H/q+1;	JUFILXHRURZDHX-UHFFFAOYSA-N	292.133753826							103886, 103886
AC1MDHVM	LSM-33523	BRD-K12925848	2789843	InChI=1S/C17H12Cl2N4O/c18-13-8-6-12(7-9-13)10-20-22-15-11-21-23(17(24)16(15)19)14-4-2-1-3-5-14/h1-11,22H	ARIPLIRHYNVNGN-UHFFFAOYSA-N	ClC1=C(NN=Cc2ccc(Cl)cc2)C=NN(C1=O)c3ccccc3	BroadT	BRD-K12925848	BRD-K12925848-001-06-2	ChemDiv Inc.	3057-1712			Clc1ccc(C=NNc2cnn(-c3ccccc3)c(=O)c2Cl)cc1	InChI=1S/C17H12Cl2N4O/c18-13-8-6-12(7-9-13)10-20-22-15-11-21-23(17(24)16(15)19)14-4-2-1-3-5-14/h1-11,22H	ARIPLIRHYNVNGN-UHFFFAOYSA-N	358.038816464							122080
AO-080/43378144	LSM-33524	SID24804503, BRD-K80754278	1511025	InChI=1S/C13H11Cl2NOS/c14-11-4-3-9(8-12(11)15)13(17)16-6-5-10-2-1-7-18-10/h1-4,7-8H,5-6H2,(H,16,17)	FYAHRWNNCHTIRH-UHFFFAOYSA-N	Clc1ccc(cc1Cl)C(=O)NCCc2cccs2	BroadT	BRD-K80754278	BRD-K80754278-001-05-4	Asinex Ltd.	BAS 13091421			Clc1ccc(cc1Cl)C(=O)NCCc1cccs1	InChI=1S/C13H11Cl2NOS/c14-11-4-3-9(8-12(11)15)13(17)16-6-5-10-2-1-7-18-10/h1-4,7-8H,5-6H2,(H,16,17)	FYAHRWNNCHTIRH-UHFFFAOYSA-N	298.993840092							122081
3-(2-Oxo-2-thien-2-ylethyl)quinoxalin-2(1H)-one	LSM-33525	BRD-K19703964	2517661	InChI=1S/C14H10N2O2S/c17-12(13-6-3-7-19-13)8-11-14(18)16-10-5-2-1-4-9(10)15-11/h1-7H,8H2,(H,16,18)	QTHQCKXCYPEECX-UHFFFAOYSA-N	Oc1nc2ccccc2nc1CC(=O)c3cccs3	BroadT	BRD-K19703964	BRD-K19703964-001-05-6	Specs	AF-826/12020016			Oc1nc2ccccc2nc1CC(=O)c1cccs1	InChI=1S/C14H10N2O2S/c17-12(13-6-3-7-19-13)8-11-14(18)16-10-5-2-1-4-9(10)15-11/h1-7H,8H2,(H,16,18)	QTHQCKXCYPEECX-UHFFFAOYSA-N	270.04629827							122082
1-(2-{[4,6-Di(piperidin-1-yl)-1,3,5-triazin-2-yl]oxy}ethyl)-3-phenylurea	LSM-33526	SID24795578, BRD-K33608055	2937108	InChI=1S/C22H31N7O2/c30-21(24-18-10-4-1-5-11-18)23-12-17-31-22-26-19(28-13-6-2-7-14-28)25-20(27-22)29-15-8-3-9-16-29/h1,4-5,10-11H,2-3,6-9,12-17H2,(H2,23,24,30)	LMCCBWSELFUBDN-UHFFFAOYSA-N	O=C(NCCOc1nc(nc(n1)N2CCCCC2)N3CCCCC3)Nc4ccccc4	BroadT	BRD-K33608055	BRD-K33608055-001-05-9	ChemBridge Corporation	7363116			O=C(NCCOc1nc(nc(n1)N1CCCCC1)N1CCCCC1)Nc1ccccc1	InChI=1S/C22H31N7O2/c30-21(24-18-10-4-1-5-11-18)23-12-17-31-22-26-19(28-13-6-2-7-14-28)25-20(27-22)29-15-8-3-9-16-29/h1,4-5,10-11H,2-3,6-9,12-17H2,(H2,23,24,30)	LMCCBWSELFUBDN-UHFFFAOYSA-N	425.253923302							122083
T0516-3614	LSM-33527	SID3717874, BRD-K91447387	2435782	InChI=1S/C13H16ClNO4/c1-3-15-12(16)7-19-13(17)8-18-11-5-4-10(14)6-9(11)2/h4-6H,3,7-8H2,1-2H3,(H,15,16)	ZZCADUONAKAZOW-UHFFFAOYSA-N	CCNC(=O)COC(=O)COc1ccc(Cl)cc1C	BroadT	BRD-K91447387	BRD-K91447387-001-05-0	Enamine Ltd.	T0516-3614			CCNC(=O)COC(=O)COc1ccc(Cl)cc1C	InChI=1S/C13H16ClNO4/c1-3-15-12(16)7-19-13(17)8-18-11-5-4-10(14)6-9(11)2/h4-6H,3,7-8H2,1-2H3,(H,15,16)	ZZCADUONAKAZOW-UHFFFAOYSA-N	285.076785712							122084
MLS000558913	LSM-33528	SID17401763, BRD-A12604874	3527925	InChI=1S/C19H19N3O3/c1-4-24-14-8-6-5-7-12(14)16-13(10-20)18(21)25-15-9-11(2)22(3)19(23)17(15)16/h5-9,16H,4,21H2,1-3H3	DUHYBUYIOGEWLH-UHFFFAOYSA-N	CCOc1ccccc1C2C(=C(N)OC3=C2C(=O)N(C)C(=C3)C)C#N	BroadT	BRD-A12604874	BRD-A12604874-001-05-4	InterBioScreen Ltd.	STOCK5S-30494			CCOc1ccccc1C1C(C#N)=C(N)Oc2cc(C)n(C)c(=O)c12	InChI=1S/C19H19N3O3/c1-4-24-14-8-6-5-7-12(14)16-13(10-20)18(21)25-15-9-11(2)22(3)19(23)17(15)16/h5-9,16H,4,21H2,1-3H3	DUHYBUYIOGEWLH-UHFFFAOYSA-N	337.142641498							122085
T0512-5665	LSM-33529	SID14746623, BRD-K06351180	2305048	InChI=1S/C21H18N2O4/c1-13(24)23-21-18(12-22)19(14-4-8-16(25-2)9-5-14)20(27-21)15-6-10-17(26-3)11-7-15/h4-11H,1-3H3,(H,23,24)	HEYMAWOJWMPZLF-UHFFFAOYSA-N	COc1ccc(cc1)c2oc(NC(=O)C)c(C#N)c2c3ccc(OC)cc3	BroadT	BRD-K06351180	BRD-K06351180-001-05-7	Enamine Ltd.	T0512-5665			COc1ccc(cc1)-c1oc(NC(C)=O)c(C#N)c1-c1ccc(OC)cc1	InChI=1S/C21H18N2O4/c1-13(24)23-21-18(12-22)19(14-4-8-16(25-2)9-5-14)20(27-21)15-6-10-17(26-3)11-7-15/h4-11H,1-3H3,(H,23,24)	HEYMAWOJWMPZLF-UHFFFAOYSA-N	362.126657076							122086
AG-670/41728165	LSM-33530	SID17406579, BRD-K76144394	1048331	InChI=1S/C21H22ClN3O3S/c22-16-13-15(5-6-17(16)25-8-2-1-3-9-25)23-21(29)24-20(26)14-4-7-18-19(12-14)28-11-10-27-18/h4-7,12-13H,1-3,8-11H2,(H2,23,24,26,29)	UIENYKHISAKOLS-UHFFFAOYSA-N	Clc1cc(NC(=S)NC(=O)c2ccc3OCCOc3c2)ccc1N4CCCCC4	BroadT	BRD-K76144394	BRD-K76144394-001-06-1	Specs	AG-670/41728165			Clc1cc(NC(=S)NC(=O)c2ccc3OCCOc3c2)ccc1N1CCCCC1	InChI=1S/C21H22ClN3O3S/c22-16-13-15(5-6-17(16)25-8-2-1-3-9-25)23-21(29)24-20(26)14-4-7-18-19(12-14)28-11-10-27-18/h4-7,12-13H,1-3,8-11H2,(H2,23,24,26,29)	UIENYKHISAKOLS-UHFFFAOYSA-N	431.107039994							122087
T5290572	LSM-33531	SID22402968, BRD-A35987488	4830917	InChI=1S/C25H25NO4/c1-3-18-14-16-20(17-15-18)25(28)30-23(19-10-6-5-7-11-19)24(27)26-21-12-8-9-13-22(21)29-4-2/h5-17,23H,3-4H2,1-2H3,(H,26,27)	TUULDXYKDUVHPC-UHFFFAOYSA-N	CCOc1ccccc1NC(=O)C(OC(=O)c2ccc(CC)cc2)c3ccccc3	BroadT	BRD-A35987488	BRD-A35987488-001-05-4	Enamine Ltd.	T5290572			CCOc1ccccc1NC(=O)C(OC(=O)c1ccc(CC)cc1)c1ccccc1	InChI=1S/C25H25NO4/c1-3-18-14-16-20(17-15-18)25(28)30-23(19-10-6-5-7-11-19)24(27)26-21-12-8-9-13-22(21)29-4-2/h5-17,23H,3-4H2,1-2H3,(H,26,27)	TUULDXYKDUVHPC-UHFFFAOYSA-N	403.17835829							122088
AC1O9JFO	LSM-33532	SID17512583, BRD-K39577752	6759938	InChI=1S/C20H16N2OS/c1-13-8-9-19(23)14(11-13)17-12-18(20-7-4-10-24-20)22-16-6-3-2-5-15(16)21-17/h2-11,23H,12H2,1H3	LDCRJHTVWQFOCB-UHFFFAOYSA-N	Cc1ccc(O)c(c1)C2=Nc3ccccc3N=C(C2)c4cccs4	BroadT	BRD-K39577752	BRD-K39577752-001-05-6	InterBioScreen Ltd.	STOCK2S-32843			Cc1ccc(O)c(c1)C1=Nc2ccccc2N=C(C1)c1cccs1	InChI=1S/C20H16N2OS/c1-13-8-9-19(23)14(11-13)17-12-18(20-7-4-10-24-20)22-16-6-3-2-5-15(16)21-17/h2-11,23H,12H2,1H3	LDCRJHTVWQFOCB-UHFFFAOYSA-N	332.098333842							
Methyl 2-[4-(methylsulfonyl)phenyl]imidazo[1,2-a]pyridine-6-carboxylate	LSM-33533	SID24821591, BRD-K91606815	1482203	InChI=1S/C16H14N2O4S/c1-22-16(19)12-5-8-15-17-14(10-18(15)9-12)11-3-6-13(7-4-11)23(2,20)21/h3-10H,1-2H3	HRYONIHVKTWMKB-UHFFFAOYSA-N	COC(=O)c1ccc2nc(cn2c1)c3ccc(cc3)S(=O)(=O)C	BroadT	BRD-K91606815	BRD-K91606815-001-05-3	Key Organics Ltd.	6X-0864			COC(=O)c1ccc2nc(cn2c1)-c1ccc(cc1)S(C)(=O)=O	InChI=1S/C16H14N2O4S/c1-22-16(19)12-5-8-15-17-14(10-18(15)9-12)11-3-6-13(7-4-11)23(2,20)21/h3-10H,1-2H3	HRYONIHVKTWMKB-UHFFFAOYSA-N	330.067427638							122090
ST50840021	LSM-33534	SID24788505, BRD-K51011518	1246282	InChI=1S/C14H8ClFN2OS/c15-12-11-9(16)4-1-5-10(11)20-13(12)14(19)18-8-3-2-6-17-7-8/h1-7H,(H,18,19)	RLHIURWBOSZJQC-UHFFFAOYSA-N	Fc1cccc2sc(C(=O)Nc3cccnc3)c(Cl)c12	BroadT	BRD-K51011518	BRD-K51011518-001-05-4	ChemBridge Corporation	7946709			Fc1cccc2sc(C(=O)Nc3cccnc3)c(Cl)c12	InChI=1S/C14H8ClFN2OS/c15-12-11-9(16)4-1-5-10(11)20-13(12)14(19)18-8-3-2-6-17-7-8/h1-7H,(H,18,19)	RLHIURWBOSZJQC-UHFFFAOYSA-N	306.002989496							122091
8-Fluoro-4-(4-methylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole	LSM-44487	SID858557, BRD-K90999759	659867	InChI=1S/C15H16FN5/c1-20-4-6-21(7-5-20)15-14-13(17-9-18-15)11-8-10(16)2-3-12(11)19-14/h2-3,8-9H,4-7H2,1H3,(H,17,18)	BQXWVFCTOSXHMK-UHFFFAOYSA-N	CN1CCN(CC1)c2[nH]cnc3c4cc(F)ccc4nc23	BroadT	BRD-K90999759	BRD-K90999759-001-05-1	InterBioScreen Ltd.	STOCK2S-57275			CN1CCN(CC1)c1[nH]cnc2c1nc1ccc(F)cc21	InChI=1S/C15H16FN5/c1-20-4-6-21(7-5-20)15-14-13(17-9-18-15)11-8-10(16)2-3-12(11)19-14/h2-3,8-9H,4-7H2,1H3,(H,17,18)	BQXWVFCTOSXHMK-UHFFFAOYSA-N	285.138973762							
ASN 04197015	LSM-33536	SID843998, BRD-K64641766	646304	InChI=1S/C21H20N4O6S2/c1-12-2-3-15-19(24-32-23-15)20(12)33(28,29)25(4-5-26)11-14-8-13-9-17-18(31-7-6-30-17)10-16(13)22-21(14)27/h2-3,8-10,26H,4-7,11H2,1H3,(H,22,27)	UOTBVRGDDNJCOW-UHFFFAOYSA-N	Cc1ccc2nsnc2c1S(=O)(=O)N(CCO)Cc3cc4cc5OCCOc5cc4nc3O	BroadT	BRD-K64641766	BRD-K64641766-001-06-0	Asinex Ltd.	ASN 04197015			Cc1ccc2nsnc2c1S(=O)(=O)N(CCO)Cc1cc2cc3OCCOc3cc2nc1O	InChI=1S/C21H20N4O6S2/c1-12-2-3-15-19(24-32-23-15)20(12)33(28,29)25(4-5-26)11-14-8-13-9-17-18(31-7-6-30-17)10-16(13)22-21(14)27/h2-3,8-10,26H,4-7,11H2,1H3,(H,22,27)	UOTBVRGDDNJCOW-UHFFFAOYSA-N	488.08242578							122093
SMR000136000	LSM-33537	SID14746331, BRD-K23721146	2929691	InChI=1S/C22H22N4O6S/c1-12-18(21(27)25-23-12)20(19-13(2)24-26-22(19)28)14-9-10-16(17(11-14)31-3)32-33(29,30)15-7-5-4-6-8-15/h4-11,20H,1-3H3,(H2,23,25,27)(H2,24,26,28)	SCHQSZIZNBCSEJ-UHFFFAOYSA-N	COc1cc(ccc1OS(=O)(=O)c2ccccc2)C(c3c(C)n[nH]c3O)c4c(C)n[nH]c4O	BroadT	BRD-K23721146	BRD-K23721146-001-06-1	ChemBridge Corporation	7185608			COc1cc(ccc1OS(=O)(=O)c1ccccc1)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O	InChI=1S/C22H22N4O6S/c1-12-18(21(27)25-23-12)20(19-13(2)24-26-22(19)28)14-9-10-16(17(11-14)31-3)32-33(29,30)15-7-5-4-6-8-15/h4-11,20H,1-3H3,(H2,23,25,27)(H2,24,26,28)	SCHQSZIZNBCSEJ-UHFFFAOYSA-N	470.126005154							122094
MLS000564811	LSM-33538	SID16953745, BRD-A42290620	4134237	InChI=1S/C16H19N3OS/c1-12-5-4-8-19(10-12)16(20)11-21-15-9-17-13-6-2-3-7-14(13)18-15/h2-3,6-7,9,12H,4-5,8,10-11H2,1H3	OOAPYKLARLJPAY-UHFFFAOYSA-N	CC1CCCN(C1)C(=O)CSc2cnc3ccccc3n2	BroadT	BRD-A42290620	BRD-A42290620-001-06-1	Enamine Ltd.	T0510-1793			CC1CCCN(C1)C(=O)CSc1cnc2ccccc2n1	InChI=1S/C16H19N3OS/c1-12-5-4-8-19(10-12)16(20)11-21-15-9-17-13-6-2-3-7-14(13)18-15/h2-3,6-7,9,12H,4-5,8,10-11H2,1H3	OOAPYKLARLJPAY-UHFFFAOYSA-N	301.124882948							122095
BAS 03316327	LSM-33539	SID849941, BRD-K86856433	652451	InChI=1S/C12H14N2O4/c1-4-17-9(15)5-8-6(2)10-7(3)13-14-11(10)18-12(8)16/h16H,4-5H2,1-3H3	JPUBMECPJVTNOW-UHFFFAOYSA-N	CCOC(=O)Cc1c(C)c2c(C)nnc2oc1O	BroadT	BRD-K86856433	BRD-K86856433-001-06-1	Asinex Ltd.	BAS 03316327			CCOC(=O)Cc1c(O)oc2nnc(C)c2c1C	InChI=1S/C12H14N2O4/c1-4-17-9(15)5-8-6(2)10-7(3)13-14-11(10)18-12(8)16/h16H,4-5H2,1-3H3	JPUBMECPJVTNOW-UHFFFAOYSA-N	250.095356948							
AC1N6ZDW	LSM-33540	BRD-K51248860	4223690	InChI=1S/C27H27N7O4S/c1-20-24(27(32-16-8-9-17-32)33(30-20)22-12-6-3-7-13-22)19-28-29-25-15-14-23(18-26(25)34(35)36)39(37,38)31-21-10-4-2-5-11-21/h2-7,10-15,18-19,29,31H,8-9,16-17H2,1H3	VDKLVZLILONIGN-UHFFFAOYSA-N	Cc1nn(c2ccccc2)c(N3CCCC3)c1C=NNc4ccc(cc4[N+](=O)[O-])S(=O)(=O)Nc5ccccc5	BroadT	BRD-K51248860	BRD-K51248860-001-05-6	Enamine Ltd.	T5223511			Cc1nn(c(N2CCCC2)c1C=NNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccccc1)-c1ccccc1	InChI=1S/C27H27N7O4S/c1-20-24(27(32-16-8-9-17-32)33(30-20)22-12-6-3-7-13-22)19-28-29-25-15-14-23(18-26(25)34(35)36)39(37,38)31-21-10-4-2-5-11-21/h2-7,10-15,18-19,29,31H,8-9,16-17H2,1H3	VDKLVZLILONIGN-UHFFFAOYSA-N	545.184523104							122097
MLS001167189	LSM-44488	SID49677709, BRD-K57199154	886509	InChI=1S/C11H8ClNO2/c12-9-3-5-10(6-4-9)13(14)8-11-2-1-7-15-11/h1-8H/b13-8-	MEOPKNOHIKFEFO-JYRVWZFOSA-N	[O-]\[N+](=C/c1occc1)\c2ccc(Cl)cc2	BroadT	BRD-K57199154	BRD-K57199154-001-05-0	Life Chemicals Inc.	F1065-0160			[O-]\[N+](c1ccc(Cl)cc1)=C/c1ccco1	InChI=1S/C11H8ClNO2/c12-9-3-5-10(6-4-9)13(14)8-11-2-1-7-15-11/h1-8H/b13-8-	MEOPKNOHIKFEFO-JYRVWZFOSA-N	221.024356216							
1-Amino-n-methyl-5-morpholin-4-yl-n-phenyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide	LSM-33542	SID24809047, BRD-K16889275	3783816	InChI=1S/C23H26N4O2S/c1-26(15-7-3-2-4-8-15)23(28)20-19(24)18-16-9-5-6-10-17(16)21(25-22(18)30-20)27-11-13-29-14-12-27/h2-4,7-8H,5-6,9-14,24H2,1H3	CQGCFJFNPWNIKV-UHFFFAOYSA-N	CN(C(=O)c1sc2nc(N3CCOCC3)c4CCCCc4c2c1N)c5ccccc5	BroadT	BRD-K16889275	BRD-K16889275-001-05-0	Asinex Ltd.	BAS 10834194			CN(C(=O)c1sc2nc(N3CCOCC3)c3CCCCc3c2c1N)c1ccccc1	InChI=1S/C23H26N4O2S/c1-26(15-7-3-2-4-8-15)23(28)20-19(24)18-16-9-5-6-10-17(16)21(25-22(18)30-20)27-11-13-29-14-12-27/h2-4,7-8H,5-6,9-14,24H2,1H3	CQGCFJFNPWNIKV-UHFFFAOYSA-N	422.177646802							122099
11K-381S	LSM-44489	SID14728975, BRD-K77640302	1471708	InChI=1S/C19H16Cl2N2O/c20-17-10-7-15(12-18(17)21)13-23-19(24)11-9-16(22-23)8-6-14-4-2-1-3-5-14/h1-8,10,12H,9,11,13H2/b8-6+	UGQLQYCGDGFRJZ-SOFGYWHQSA-N	Clc1ccc(CN2N=C(CCC2=O)\C=C\c3ccccc3)cc1Cl	BroadT	BRD-K77640302	BRD-K77640302-001-06-8	Key Organics Ltd.	11K-381S			Clc1ccc(CN2N=C(CCC2=O)\C=C\c2ccccc2)cc1Cl	InChI=1S/C19H16Cl2N2O/c20-17-10-7-15(12-18(17)21)13-23-19(24)11-9-16(22-23)8-6-14-4-2-1-3-5-14/h1-8,10,12H,9,11,13H2/b8-6+	UGQLQYCGDGFRJZ-SOFGYWHQSA-N	358.063968572							
KUC100196	LSM-33544	SID14728578, SID29215981, BRD-K57020902	9547769	InChI=1S/C30H25N3O4/c1-35-24-11-8-20(9-12-24)19-37-29-17-28(21-5-3-7-25(15-21)36-2)33-27-13-10-23(16-26(27)29)32-30(34)22-6-4-14-31-18-22/h3-18H,19H2,1-2H3,(H,32,34)	XHIUGWIYYLIBEY-UHFFFAOYSA-N	COc1ccc(COc2cc(nc3ccc(NC(=O)c4cccnc4)cc23)c5cccc(OC)c5)cc1	BroadT	BRD-K57020902	BRD-K57020902-001-07-9	University of Kansas CMLD	KUC100196			COc1ccc(COc2cc(nc3ccc(NC(=O)c4cccnc4)cc23)-c2cccc(OC)c2)cc1	InChI=1S/C30H25N3O4/c1-35-24-11-8-20(9-12-24)19-37-29-17-28(21-5-3-7-25(15-21)36-2)33-27-13-10-23(16-26(27)29)32-30(34)22-6-4-14-31-18-22/h3-18H,19H2,1-2H3,(H,32,34)	XHIUGWIYYLIBEY-UHFFFAOYSA-N	491.18450631							122101
Ursolic acid	LSM-4889	NSC-4060, Ursolic-Acid	64945	InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1	WCGUUGGRBIKTOS-GPOJBZKASA-N	C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(=O)O	BroadT	BRD-K68185022	BRD-K68185022-001-09-8	Sigma-Aldrich	U6753			C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O	InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1	WCGUUGGRBIKTOS-GPOJBZKASA-N	456.360345396							9908, 9908, 9908, 9908
BAS 01244637	LSM-33545	SID24802196, BRD-K42640804	1117137	InChI=1S/C21H20ClN3O3S/c1-29(27,28)25(15-16-5-9-18(22)10-6-16)20-11-7-17(8-12-20)21(26)24-14-19-4-2-3-13-23-19/h2-13H,14-15H2,1H3,(H,24,26)	BOSYZTKWXLWSQJ-UHFFFAOYSA-N	CS(=O)(=O)N(Cc1ccc(Cl)cc1)c2ccc(cc2)C(=O)NCc3ccccn3	BroadT	BRD-K42640804	BRD-K42640804-001-05-5	Asinex Ltd.	BAS 01244637			CS(=O)(=O)N(Cc1ccc(Cl)cc1)c1ccc(cc1)C(=O)NCc1ccccn1	InChI=1S/C21H20ClN3O3S/c1-29(27,28)25(15-16-5-9-18(22)10-6-16)20-11-7-17(8-12-20)21(26)24-14-19-4-2-3-13-23-19/h2-13H,14-15H2,1H3,(H,24,26)	BOSYZTKWXLWSQJ-UHFFFAOYSA-N	429.09138993							122102
MLS000702954	LSM-44490	SID24786576, BRD-K86813828	6875242	InChI=1S/C19H14FN3O2/c20-15-7-3-1-5-12(15)11-23-18(24)17(22-19(23)25)9-13-10-21-16-8-4-2-6-14(13)16/h1-10,21H,11H2,(H,22,25)/b17-9+	LKEBYYIMIKDDMS-RQZCQDPDSA-N	Fc1ccccc1CN2C(=O)N\C(=C\c3c[nH]c4ccccc34)\C2=O	BroadT	BRD-K86813828	BRD-K86813828-001-05-7	Specs	AH-487/41656544			Fc1ccccc1CN1C(=O)N\C(=C\c2c[nH]c3ccccc23)C1=O	InChI=1S/C19H14FN3O2/c20-15-7-3-1-5-12(15)11-23-18(24)17(22-19(23)25)9-13-10-21-16-8-4-2-6-14(13)16/h1-10,21H,11H2,(H,22,25)/b17-9+	LKEBYYIMIKDDMS-RQZCQDPDSA-N	335.107004918							
Methonalide	LSM-33547	SID7977565, BRD-K95629636	43380	InChI=1S/C18H22N2O4/c1-20(2)14-8-6-13(7-9-14)19-18(21)12-10-15(22-3)17(24-5)16(11-12)23-4/h6-11H,1-5H3,(H,19,21)	AVFGUWZHRCOPMQ-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)Nc2ccc(cc2)N(C)C	BroadT	BRD-K95629636	BRD-K95629636-001-06-6	ChemBridge Corporation	5627344			COc1cc(cc(OC)c1OC)C(=O)Nc1ccc(cc1)N(C)C	InChI=1S/C18H22N2O4/c1-20(2)14-8-6-13(7-9-14)19-18(21)12-10-15(22-3)17(24-5)16(11-12)23-4/h6-11H,1-5H3,(H,19,21)	AVFGUWZHRCOPMQ-UHFFFAOYSA-N	330.157957204							122104
MLS001210232	LSM-43625	BRD-K76353913	6489952	InChI=1S/C23H28N3O/c1-5-25(6-2)23(27)17-26-18(3)20(21-9-7-8-10-22(21)26)12-11-19-13-15-24(4)16-14-19/h7-16H,5-6,17H2,1-4H3/q+1	JMQIUTULSXUGLC-UHFFFAOYSA-N	CCN(CC)C(=O)Cn1c(C)c(\C=C\c2cc[n+](C)cc2)c3ccccc13	BroadT	BRD-K76353913	BRD-K76353913-005-05-3	Asinex Ltd.	ASN 10791042		I	CCN(CC)C(=O)Cn1c(C)c(\C=C\c2cc[n+](C)cc2)c2ccccc12.I	InChI=1S/C23H28N3O.HI/c1-5-25(6-2)23(27)17-26-18(3)20(21-9-7-8-10-22(21)26)12-11-19-13-15-24(4)16-14-19;/h7-16H,5-6,17H2,1-4H3;1H/q+1;	RKRGIYCVJXMEGC-UHFFFAOYSA-N	362.223237546							104154, 104154
AK-968/41923664	LSM-33548	SID17386191, BRD-K82065959	843615	InChI=1S/C16H16N6O3/c1-11-14(22(24)25)15(20(2)19-11)16(23)18-13-6-4-12(5-7-13)10-21-9-3-8-17-21/h3-9H,10H2,1-2H3,(H,18,23)	PAXQVWMFGBWZFG-UHFFFAOYSA-N	Cc1nn(C)c(C(=O)Nc2ccc(Cn3cccn3)cc2)c1[N+](=O)[O-]	BroadT	BRD-K82065959	BRD-K82065959-001-05-9	Specs	AK-968/41923664			Cc1nn(C)c(C(=O)Nc2ccc(Cn3cccn3)cc2)c1[N+]([O-])=O	InChI=1S/C16H16N6O3/c1-11-14(22(24)25)15(20(2)19-11)16(23)18-13-6-4-12(5-7-13)10-21-9-3-8-17-21/h3-9H,10H2,1-2H3,(H,18,23)	PAXQVWMFGBWZFG-UHFFFAOYSA-N	340.128388432							122105
AN-329/41573627	LSM-33549	SID17406858, BRD-K71811334	833411	InChI=1S/C19H20N2O2S/c1-14-6-4-9-16(12-14)23-13-18(22)20-19(24)21-11-5-8-15-7-2-3-10-17(15)21/h2-4,6-7,9-10,12H,5,8,11,13H2,1H3,(H,20,22,24)	MIFCIOSXIXIIRZ-UHFFFAOYSA-N	Cc1cccc(OCC(=O)NC(=S)N2CCCc3ccccc23)c1	BroadT	BRD-K71811334	BRD-K71811334-001-05-5	Specs	AN-329/41573627			Cc1cccc(OCC(=O)NC(=S)N2CCCc3ccccc23)c1	InChI=1S/C19H20N2O2S/c1-14-6-4-9-16(12-14)23-13-18(22)20-19(24)21-11-5-8-15-7-2-3-10-17(15)21/h2-4,6-7,9-10,12H,5,8,11,13H2,1H3,(H,20,22,24)	MIFCIOSXIXIIRZ-UHFFFAOYSA-N	340.12454859							122106
ST50150044	LSM-44491	SID17506503, BRD-K66186275	1371412	InChI=1S/C20H19N3O5S2/c1-26-14-7-12(8-15(27-2)18(14)28-3)9-16-19(25)23(20(29)30-16)11-17(24)22-13-5-4-6-21-10-13/h4-10H,11H2,1-3H3,(H,22,24)/b16-9+	HSCAHGZMFCAKOO-CXUHLZMHSA-N	COc1cc(\C=C/2\SC(=S)N(CC(=O)Nc3cccnc3)C2=O)cc(OC)c1OC	BroadT	BRD-K66186275	BRD-K66186275-001-06-8	ChemBridge Corporation	6120024			COc1cc(\C=C2\SC(=S)N(CC(=O)Nc3cccnc3)C2=O)cc(OC)c1OC	InChI=1S/C20H19N3O5S2/c1-26-14-7-12(8-15(27-2)18(14)28-3)9-16-19(25)23(20(29)30-16)11-17(24)22-13-5-4-6-21-10-13/h4-10H,11H2,1-3H3,(H,22,24)/b16-9+	HSCAHGZMFCAKOO-CXUHLZMHSA-N	445.076612118							
ST51003066	LSM-33551	SID24805413, BRD-K67475012	818234	InChI=1S/C20H19N3O2/c1-12-15-10-17(24-3)18(25-4)11-16(15)19-13(2)22-23(20(19)21-12)14-8-6-5-7-9-14/h5-11H,1-4H3	XCXFZGWTAOVGKY-UHFFFAOYSA-N	COc1cc2c(C)nc3c(c(C)nn3c4ccccc4)c2cc1OC	BroadT	BRD-K67475012	BRD-K67475012-001-05-4	Asinex Ltd.	BAS 00340127			COc1cc2c(C)nc3n(nc(C)c3c2cc1OC)-c1ccccc1	InChI=1S/C20H19N3O2/c1-12-15-10-17(24-3)18(25-4)11-16(15)19-13(2)22-23(20(19)21-12)14-8-6-5-7-9-14/h5-11H,1-4H3	XCXFZGWTAOVGKY-UHFFFAOYSA-N	333.147726878							122108
AN-329/40487563	LSM-33552	SID24806029, BRD-K05251930	680979	InChI=1S/C14H15N3O2S/c1-8-9(2)20-13(11(8)12(15)18)17-14(19)16-10-6-4-3-5-7-10/h3-7H,1-2H3,(H2,15,18)(H2,16,17,19)	MWIROVVCDJHCQY-UHFFFAOYSA-N	Cc1sc(NC(=O)Nc2ccccc2)c(C(=O)N)c1C	BroadT	BRD-K05251930	BRD-K05251930-001-05-3	Asinex Ltd.	BAS 03838369			Cc1sc(NC(=O)Nc2ccccc2)c(C(N)=O)c1C	InChI=1S/C14H15N3O2S/c1-8-9(2)20-13(11(8)12(15)18)17-14(19)16-10-6-4-3-5-7-10/h3-7H,1-2H3,(H2,15,18)(H2,16,17,19)	MWIROVVCDJHCQY-UHFFFAOYSA-N	289.08849744							122109
3-(Azepan-1-ylazo)-benzoic acid	LSM-33553	SID17508377, BRD-K74168355	578057	InChI=1S/C13H17N3O2/c17-13(18)11-6-5-7-12(10-11)14-15-16-8-3-1-2-4-9-16/h5-7,10H,1-4,8-9H2,(H,17,18)	OJPBMUUZGYZDMW-UHFFFAOYSA-N	OC(=O)c1cccc(c1)N=NN2CCCCCC2	BroadT	BRD-K74168355	BRD-K74168355-001-05-1	Asinex Ltd.	BAS 01117753			OC(=O)c1cccc(c1)N=NN1CCCCCC1	InChI=1S/C13H17N3O2/c17-13(18)11-6-5-7-12(10-11)14-15-16-8-3-1-2-4-9-16/h5-7,10H,1-4,8-9H2,(H,17,18)	OJPBMUUZGYZDMW-UHFFFAOYSA-N	247.132076814							122110
T0513-2864	LSM-33554	SID3716030, BRD-K32511553	2999445	InChI=1S/C14H12N2O2S/c17-13(18-10-11-4-2-1-3-5-11)8-12-9-16-6-7-19-14(16)15-12/h1-7,9H,8,10H2	ILVSHUWRJRWHCT-UHFFFAOYSA-N	O=C(Cc1cn2ccsc2n1)OCc3ccccc3	BroadT	BRD-K32511553	BRD-K32511553-001-05-3	Enamine Ltd.	T0513-2864			O=C(Cc1cn2ccsc2n1)OCc1ccccc1	InChI=1S/C14H12N2O2S/c17-13(18-10-11-4-2-1-3-5-11)8-12-9-16-6-7-19-14(16)15-12/h1-7,9H,8,10H2	ILVSHUWRJRWHCT-UHFFFAOYSA-N	272.061948334							122111
MLS000564945	LSM-33555	SID16952740, BRD-K65231122	3907133	InChI=1S/C31H32N4O2/c36-30(25-15-16-26-27(22-25)32-28-14-8-3-9-17-35(28)31(26)37)34-20-18-33(19-21-34)29(23-10-4-1-5-11-23)24-12-6-2-7-13-24/h1-2,4-7,10-13,15-16,22,29H,3,8-9,14,17-21H2	BXSFOIVYQMOQAG-UHFFFAOYSA-N	O=C(N1CCN(CC1)C(c2ccccc2)c3ccccc3)c4ccc5C(=O)N6CCCCCC6=Nc5c4	BroadT	BRD-K65231122	BRD-K65231122-001-07-6	Enamine Ltd.	T0507-6518			O=C(N1CCN(CC1)C(c1ccccc1)c1ccccc1)c1ccc2c(c1)nc1CCCCCn1c2=O	InChI=1S/C31H32N4O2/c36-30(25-15-16-26-27(22-25)32-28-14-8-3-9-17-35(28)31(26)37)34-20-18-33(19-21-34)29(23-10-4-1-5-11-23)24-12-6-2-7-13-24/h1-2,4-7,10-13,15-16,22,29H,3,8-9,14,17-21H2	BXSFOIVYQMOQAG-UHFFFAOYSA-N	492.252526304							122112
ST50130413	LSM-44492	SID17515057, BRD-K31164336	2146892	InChI=1S/C14H10N2O2S/c17-14-16-13(15-10-5-2-1-3-6-10)12(19-14)9-11-7-4-8-18-11/h1-9H,(H,15,16,17)/b12-9-	FVGXXUGQWLGQQG-XFXZXTDPSA-N	O=C1S\C(=C/c2occc2)\C(=N1)Nc3ccccc3	BroadT	BRD-K31164336	BRD-K31164336-001-05-6	Life Chemicals Inc.	F1740-0296			O=C1SC(=C/c2ccco2)\C(Nc2ccccc2)=N1	InChI=1S/C14H10N2O2S/c17-14-16-13(15-10-5-2-1-3-6-10)12(19-14)9-11-7-4-8-18-11/h1-9H,(H,15,16,17)/b12-9-	FVGXXUGQWLGQQG-XFXZXTDPSA-N	270.04629827							
2-Chlorobenzyl 4-(propionylamino)benzoate	LSM-33557	SID17387284, BRD-K16987672	902800	InChI=1S/C17H16ClNO3/c1-2-16(20)19-14-9-7-12(8-10-14)17(21)22-11-13-5-3-4-6-15(13)18/h3-10H,2,11H2,1H3,(H,19,20)	MKEXQWZOWQXPBG-UHFFFAOYSA-N	CCC(=O)Nc1ccc(cc1)C(=O)OCc2ccccc2Cl	BroadT	BRD-K16987672	BRD-K16987672-001-08-5	Specs	AK-918/42179790			CCC(=O)Nc1ccc(cc1)C(=O)OCc1ccccc1Cl	InChI=1S/C17H16ClNO3/c1-2-16(20)19-14-9-7-12(8-10-14)17(21)22-11-13-5-3-4-6-15(13)18/h3-10H,2,11H2,1H3,(H,19,20)	MKEXQWZOWQXPBG-UHFFFAOYSA-N	317.081871092							122114
SMR000029245	LSM-33558	SID4241480, BRD-K34435351	3236449	InChI=1S/C13H14N2OS/c1-9-5-3-6-10(2)12(9)15-13(16)14-11-7-4-8-17-11/h3-8H,1-2H3,(H2,14,15,16)	RFYOTDOOADPFKW-UHFFFAOYSA-N	Cc1cccc(C)c1NC(=O)Nc2cccs2	BroadT	BRD-K34435351	BRD-K34435351-001-05-7	ChemDiv Inc.	C795-0370			Cc1cccc(C)c1NC(=O)Nc1cccs1	InChI=1S/C13H14N2OS/c1-9-5-3-6-10(2)12(9)15-13(16)14-11-7-4-8-17-11/h3-8H,1-2H3,(H2,14,15,16)	RFYOTDOOADPFKW-UHFFFAOYSA-N	246.082683778							122115
MLS000662596	LSM-33559	SID24791312, BRD-K61680257	758305	InChI=1S/C14H10BrN3OS/c15-12-5-3-10(4-6-12)9-20-14-18-17-13(19-14)11-2-1-7-16-8-11/h1-8H,9H2	ALJZALDUCAILCZ-UHFFFAOYSA-N	Brc1ccc(CSc2oc(nn2)c3cccnc3)cc1	BroadT	BRD-K61680257	BRD-K61680257-001-07-5	ChemBridge Corporation	7504448			Brc1ccc(CSc2nnc(o2)-c2cccnc2)cc1	InChI=1S/C14H10BrN3OS/c15-12-5-3-10(4-6-12)9-20-14-18-17-13(19-14)11-2-1-7-16-8-11/h1-8H,9H2	ALJZALDUCAILCZ-UHFFFAOYSA-N	346.97279526							122116
T5276155	LSM-44493	SID22410892, BRD-K13062210	6103428	InChI=1S/C22H24N2O6S/c1-29-19-6-4-5-17(15-19)7-12-22(26)30-16-21(25)23-18-8-10-20(11-9-18)31(27,28)24-13-2-3-14-24/h4-12,15H,2-3,13-14,16H2,1H3,(H,23,25)/b12-7+	JYYPSYNMAPZBIT-KPKJPENVSA-N	COc1cccc(\C=C\C(=O)OCC(=O)Nc2ccc(cc2)S(=O)(=O)N3CCCC3)c1	BroadT	BRD-K13062210	BRD-K13062210-001-05-5	Enamine Ltd.	T5276155			COc1cccc(\C=C\C(=O)OCC(=O)Nc2ccc(cc2)S(=O)(=O)N2CCCC2)c1	InChI=1S/C22H24N2O6S/c1-29-19-6-4-5-17(15-19)7-12-22(26)30-16-21(25)23-18-8-10-20(11-9-18)31(27,28)24-13-2-3-14-24/h4-12,15H,2-3,13-14,16H2,1H3,(H,23,25)/b12-7+	JYYPSYNMAPZBIT-KPKJPENVSA-N	444.135507198							
T0503-7056	LSM-33561	SID3717376, BRD-K03302230	2319975	InChI=1S/C14H15Cl2FN2O2/c1-9-2-3-10(8-11(9)17)12(13(15)16)18-14(20)19-4-6-21-7-5-19/h2-3,8H,4-7H2,1H3,(H,18,20)	ITFFQBXHYNFEIP-UHFFFAOYSA-N	Cc1ccc(cc1F)C(=C(Cl)Cl)NC(=O)N2CCOCC2	BroadT	BRD-K03302230	BRD-K03302230-001-05-3	Enamine Ltd.	T0503-7056			Cc1ccc(cc1F)C(NC(=O)N1CCOCC1)=C(Cl)Cl	InChI=1S/C14H15Cl2FN2O2/c1-9-2-3-10(8-11(9)17)12(13(15)16)18-14(20)19-4-6-21-7-5-19/h2-3,8H,4-7H2,1H3,(H,18,20)	ITFFQBXHYNFEIP-UHFFFAOYSA-N	332.04946136							122118
N-(4,5-Diphenyl-1,3-oxazol-2-yl)-3-methoxybenzamide	LSM-33562	SID17513044, BRD-K75558157	1962096	InChI=1S/C23H18N2O3/c1-27-19-14-8-13-18(15-19)22(26)25-23-24-20(16-9-4-2-5-10-16)21(28-23)17-11-6-3-7-12-17/h2-15H,1H3,(H,24,25,26)	QRIRSUKRGULSJG-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Nc2oc(c3ccccc3)c(n2)c4ccccc4	BroadT	BRD-K75558157	BRD-K75558157-001-06-0	InterBioScreen Ltd.	STOCK3S-21410			COc1cccc(c1)C(=O)Nc1nc(c(o1)-c1ccccc1)-c1ccccc1	InChI=1S/C23H18N2O3/c1-27-19-14-8-13-18(15-19)22(26)25-23-24-20(16-9-4-2-5-10-16)21(28-23)17-11-6-3-7-12-17/h2-15H,1H3,(H,24,25,26)	QRIRSUKRGULSJG-UHFFFAOYSA-N	370.131742456							122119
AC1O99YP	LSM-33563	SID17505434, BRD-K61135001	6775121	InChI=1S/C22H24N4O3S/c1-3-23-21(29)19-13-6-4-5-7-18(13)30-22(19)24-20(28)16-11-15(25-26-16)14-10-12(2)8-9-17(14)27/h8-11,27H,3-7H2,1-2H3,(H,23,29)(H,24,28)(H,25,26)	FROCDKXVIGKGFN-UHFFFAOYSA-N	CCNC(=O)c1c2CCCCc2sc1NC(=O)c3cc([nH]n3)c4cc(C)ccc4O	BroadT	BRD-K61135001	BRD-K61135001-001-07-9	InterBioScreen Ltd.	STOCK5S-55197			CCNC(=O)c1c(NC(=O)c2cc([nH]n2)-c2cc(C)ccc2O)sc2CCCCc12	InChI=1S/C22H24N4O3S/c1-3-23-21(29)19-13-6-4-5-7-18(13)30-22(19)24-20(28)16-11-15(25-26-16)14-10-12(2)8-9-17(14)27/h8-11,27H,3-7H2,1-2H3,(H,23,29)(H,24,28)(H,25,26)	FROCDKXVIGKGFN-UHFFFAOYSA-N	424.156911358							
STK560352	LSM-33564	SID14730889, BRD-K98181614	1418096	InChI=1S/C12H14N2S/c1-2-11-9-6-4-3-5-8(9)10(7-13)12(15)14-11/h2-6H2,1H3,(H,14,15)	SCLRLTJBDNRRCW-UHFFFAOYSA-N	CCc1nc(S)c(C#N)c2CCCCc12	BroadT	BRD-K98181614	BRD-K98181614-001-05-3	InterBioScreen Ltd.	STOCK1S-61164			CCc1nc(S)c(C#N)c2CCCCc12	InChI=1S/C12H14N2S/c1-2-11-9-6-4-3-5-8(9)10(7-13)12(15)14-11/h2-6H2,1H3,(H,14,15)	SCLRLTJBDNRRCW-UHFFFAOYSA-N	218.087769158							122121
Ethyl 5-hydroxy-2-(phenoxymethyl)-1-benzofuran-3-carboxylate	LSM-33565	SID7973879, BRD-K58014084	780040	InChI=1S/C18H16O5/c1-2-21-18(20)17-14-10-12(19)8-9-15(14)23-16(17)11-22-13-6-4-3-5-7-13/h3-10,19H,2,11H2,1H3	WMKWHWVWSKDZQK-UHFFFAOYSA-N	CCOC(=O)c1c(COc2ccccc2)oc3ccc(O)cc13	BroadT	BRD-K58014084	BRD-K58014084-001-04-8	ChemBridge Corporation	6101023			CCOC(=O)c1c(COc2ccccc2)oc2ccc(O)cc12	InChI=1S/C18H16O5/c1-2-21-18(20)17-14-10-12(19)8-9-15(14)23-16(17)11-22-13-6-4-3-5-7-13/h3-10,19H,2,11H2,1H3	WMKWHWVWSKDZQK-UHFFFAOYSA-N	312.099773612							122122
2-(1H-Indol-3-yl)-2-oxo-n-(1,3-thiazol-2-yl)acetamide	LSM-33566	SID14736363, BRD-K77220065	2174681	InChI=1S/C13H9N3O2S/c17-11(12(18)16-13-14-5-6-19-13)9-7-15-10-4-2-1-3-8(9)10/h1-7,15H,(H,14,16,18)	QXWUXNUOPOLUHR-UHFFFAOYSA-N	O=C(Nc1nccs1)C(=O)c2c[nH]c3ccccc23	BroadT	BRD-K77220065	BRD-K77220065-001-05-8	ChemBridge Corporation	7121712			O=C(Nc1nccs1)C(=O)c1c[nH]c2ccccc12	InChI=1S/C13H9N3O2S/c17-11(12(18)16-13-14-5-6-19-13)9-7-15-10-4-2-1-3-8(9)10/h1-7,15H,(H,14,16,18)	QXWUXNUOPOLUHR-UHFFFAOYSA-N	271.041547248							122123
HMS2934I05	LSM-33567	BRD-K86158100	1968191	InChI=1S/C22H21FN8O3/c1-13(2)19-18(26-30-31(19)21-20(24)28-34-29-21)22(32)27-25-11-14-5-9-17(10-6-14)33-12-15-3-7-16(23)8-4-15/h3-11,13H,12H2,1-2H3,(H2,24,28)(H,27,32)	HLJABFBJQPUYLJ-UHFFFAOYSA-N	CC(C)c1c(nnn1c2nonc2N)C(=O)NN=Cc3ccc(OCc4ccc(F)cc4)cc3	BroadT	BRD-K86158100	BRD-K86158100-001-05-6	InterBioScreen Ltd.	STOCK4S-05760			CC(C)c1c(nnn1-c1nonc1N)C(=O)NN=Cc1ccc(OCc2ccc(F)cc2)cc1	InChI=1S/C22H21FN8O3/c1-13(2)19-18(26-30-31(19)21-20(24)28-34-29-21)22(32)27-25-11-14-5-9-17(10-6-14)33-12-15-3-7-16(23)8-4-15/h3-11,13H,12H2,1-2H3,(H2,24,28)(H,27,32)	HLJABFBJQPUYLJ-UHFFFAOYSA-N	464.172064812							122124
F0642-4249	LSM-33568	SID24824003, BRD-K46011307	4248368	InChI=1S/C14H9F2N3OS/c15-9-6-10(16)12-11(7-9)21-14(17-12)19-18-13(20)8-4-2-1-3-5-8/h1-7H,(H,17,19)(H,18,20)	SXGYAZNWAGLBES-UHFFFAOYSA-N	Fc1cc(F)c2nc(NNC(=O)c3ccccc3)sc2c1	BroadT	BRD-K46011307	BRD-K46011307-001-05-7	Life Chemicals Inc.	F0642-4249			Fc1cc(F)c2nc(NNC(=O)c3ccccc3)sc2c1	InChI=1S/C14H9F2N3OS/c15-9-6-10(16)12-11(7-9)21-14(17-12)19-18-13(20)8-4-2-1-3-5-8/h1-7H,(H,17,19)(H,18,20)	SXGYAZNWAGLBES-UHFFFAOYSA-N	305.043439028							122125
MLS000533951	LSM-33569	SID14740141, BRD-K79200350	1039936	InChI=1S/C16H11F3N2OS2/c17-16(18,19)8-6-9(10-2-1-5-23-10)21-15-11(8)12(20)14(24-15)13(22)7-3-4-7/h1-2,5-7H,3-4,20H2	UWBCHNUFEKEGCH-UHFFFAOYSA-N	Nc1c(sc2nc(cc(c12)C(F)(F)F)c3cccs3)C(=O)C4CC4	BroadT	BRD-K79200350	BRD-K79200350-001-06-0	ChemBridge Corporation	6245862			Nc1c(sc2nc(cc(c12)C(F)(F)F)-c1cccs1)C(=O)C1CC1	InChI=1S/C16H11F3N2OS2/c17-16(18,19)8-6-9(10-2-1-5-23-10)21-15-11(8)12(20)14(24-15)13(22)7-3-4-7/h1-2,5-7H,3-4,20H2	UWBCHNUFEKEGCH-UHFFFAOYSA-N	368.026488972							122126
MLS000335621	LSM-33570	SID22407626, BRD-A44350857	5228073	InChI=1S/C26H23N5O3S/c1-33-21-13-12-17(14-22(21)34-2)25-29-30-26(31(25)27)35-24(16-8-4-3-5-9-16)23(32)19-15-28-20-11-7-6-10-18(19)20/h3-15,24,28H,27H2,1-2H3	XEMJLSFPVMSMKU-UHFFFAOYSA-N	COc1ccc(cc1OC)c2nnc(SC(C(=O)c3c[nH]c4ccccc34)c5ccccc5)n2N	BroadT	BRD-A44350857	BRD-A44350857-001-06-5	Enamine Ltd.	T5248170			COc1ccc(cc1OC)-c1nnc(SC(C(=O)c2c[nH]c3ccccc23)c2ccccc2)n1N	InChI=1S/C26H23N5O3S/c1-33-21-13-12-17(14-22(21)34-2)25-29-30-26(31(25)27)35-24(16-8-4-3-5-9-16)23(32)19-15-28-20-11-7-6-10-18(19)20/h3-15,24,28H,27H2,1-2H3	XEMJLSFPVMSMKU-UHFFFAOYSA-N	485.152160336							122127
SMR000043817	LSM-33571	SID861926, BRD-K35340654	663151	InChI=1S/C17H22FN5OS/c1-11-7-8-13(9-14(11)18)20-15(24)10-25-17-22-21-16(23(17)19)12-5-3-2-4-6-12/h7-9,12H,2-6,10,19H2,1H3,(H,20,24)	XHXQDKWGZLPLHS-UHFFFAOYSA-N	Cc1ccc(NC(=O)CSc2nnc(C3CCCCC3)n2N)cc1F	BroadT	BRD-K35340654	BRD-K35340654-001-05-2	InterBioScreen Ltd.	STOCK4S-23096			Cc1ccc(NC(=O)CSc2nnc(C3CCCCC3)n2N)cc1F	InChI=1S/C17H22FN5OS/c1-11-7-8-13(9-14(11)18)20-15(24)10-25-17-22-21-16(23(17)19)12-5-3-2-4-6-12/h7-9,12H,2-6,10,19H2,1H3,(H,20,24)	XHXQDKWGZLPLHS-UHFFFAOYSA-N	363.152909264							122128
SMR000174046	LSM-33572	SID17413103, BRD-K02643263	3094436	InChI=1S/C20H19N7O4/c1-12(28)22-14-3-7-16(8-4-14)24-19-18(27(30)31)11-21-20(26-19)25-17-9-5-15(6-10-17)23-13(2)29/h3-11H,1-2H3,(H,22,28)(H,23,29)(H2,21,24,25,26)	HNJBGZILIPINTO-UHFFFAOYSA-N	CC(=O)Nc1ccc(Nc2ncc(c(Nc3ccc(NC(=O)C)cc3)n2)[N+](=O)[O-])cc1	BroadT	BRD-K02643263	BRD-K02643263-001-05-1	Asinex Ltd.	BAS 00194697			CC(=O)Nc1ccc(Nc2ncc(c(Nc3ccc(NC(C)=O)cc3)n2)[N+]([O-])=O)cc1	InChI=1S/C20H19N7O4/c1-12(28)22-14-3-7-16(8-4-14)24-19-18(27(30)31)11-21-20(26-19)25-17-9-5-15(6-10-17)23-13(2)29/h3-11H,1-2H3,(H,22,28)(H,23,29)(H2,21,24,25,26)	HNJBGZILIPINTO-UHFFFAOYSA-N	421.149852158							122129
SMR000028637	LSM-33573	SID24838725, SID4241140, BRD-K59979696	3236155	InChI=1S/C26H24N2O7/c1-31-16-12-13-18(22(14-16)33-3)27-26(30)25-24(17-8-4-5-9-19(17)35-25)28-23(29)15-34-21-11-7-6-10-20(21)32-2/h4-14H,15H2,1-3H3,(H,27,30)(H,28,29)	ZHMSDLMUONAZKI-UHFFFAOYSA-N	COc1ccc(NC(=O)c2oc3ccccc3c2NC(=O)COc4ccccc4OC)c(OC)c1	BroadT	BRD-K59979696	BRD-K59979696-001-05-8	ChemDiv Inc.	C686-1385			COc1ccc(NC(=O)c2oc3ccccc3c2NC(=O)COc2ccccc2OC)c(OC)c1	InChI=1S/C26H24N2O7/c1-31-16-12-13-18(22(14-16)33-3)27-26(30)25-24(17-8-4-5-9-19(17)35-25)28-23(29)15-34-21-11-7-6-10-20(21)32-2/h4-14H,15H2,1-3H3,(H,27,30)(H,28,29)	ZHMSDLMUONAZKI-UHFFFAOYSA-N	476.158351128							122130
4-({3-[5-(Furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl}carbamoyl)phenyl acetate	LSM-33574	SID26667077, BRD-K76627311	1935420	InChI=1S/C21H15N3O5/c1-13(25)28-17-9-7-14(8-10-17)19(26)22-16-5-2-4-15(12-16)20-23-24-21(29-20)18-6-3-11-27-18/h2-12H,1H3,(H,22,26)	CCEYCFHUDXNHDC-UHFFFAOYSA-N	CC(=O)Oc1ccc(cc1)C(=O)Nc2cccc(c2)c3oc(nn3)c4occc4	BroadT	BRD-K76627311	BRD-K76627311-001-05-7	InterBioScreen Ltd.	STOCK2S-79487			CC(=O)Oc1ccc(cc1)C(=O)Nc1cccc(c1)-c1nnc(o1)-c1ccco1	InChI=1S/C21H15N3O5/c1-13(25)28-17-9-7-14(8-10-17)19(26)22-16-5-2-4-15(12-16)20-23-24-21(29-20)18-6-3-11-27-18/h2-12H,1H3,(H,22,26)	CCEYCFHUDXNHDC-UHFFFAOYSA-N	389.10117061							122131
SMR000148337	LSM-33575	SID14741318, BRD-K52419738	914061	InChI=1S/C14H14ClN3OS/c1-9-7-10(2)18-14(17-9)20-8-16-13(19)11-3-5-12(15)6-4-11/h3-7H,8H2,1-2H3,(H,16,19)	HTHCOFLGFRGATA-UHFFFAOYSA-N	Cc1cc(C)nc(SCNC(=O)c2ccc(Cl)cc2)n1	BroadT	BRD-K52419738	BRD-K52419738-001-05-2	InterBioScreen Ltd.	STOCK4S-19385			Cc1cc(C)nc(SCNC(=O)c2ccc(Cl)cc2)n1	InChI=1S/C14H14ClN3OS/c1-9-7-10(2)18-14(17-9)20-8-16-13(19)11-3-5-12(15)6-4-11/h3-7H,8H2,1-2H3,(H,16,19)	HTHCOFLGFRGATA-UHFFFAOYSA-N	307.054610498							122132
SMR000195884	LSM-44494	SID17411897, BRD-A52212205	5732062	InChI=1S/C17H22N2OS2/c1-3-5-6-13(4-2)12-19-16(20)15(22-17(19)21)11-14-7-9-18-10-8-14/h7-11,13H,3-6,12H2,1-2H3/b15-11-	DIGSBNOZLNNDAQ-PTNGSMBKSA-N	CCCCC(CC)CN1C(=S)S\C(=C/c2ccncc2)\C1=O	BroadT	BRD-A52212205	BRD-A52212205-001-09-9	ChemBridge Corporation	6649004			CCCCC(CC)CN1C(=S)S\C(=C/c2ccncc2)C1=O	InChI=1S/C17H22N2OS2/c1-3-5-6-13(4-2)12-19-16(20)15(22-17(19)21)11-14-7-9-18-10-8-14/h7-11,13H,3-6,12H2,1-2H3/b15-11-	DIGSBNOZLNNDAQ-PTNGSMBKSA-N	334.117354724							
CHEMDIV3_012761	LSM-33577	SID24811805, BRD-K11224142	4088092	InChI=1S/C23H25N3O5S/c1-4-25(5-2)21(27)13-32-23-24-18-11-20-19(30-14-31-20)10-17(18)22(28)26(23)12-15-6-8-16(29-3)9-7-15/h6-11H,4-5,12-14H2,1-3H3	BXNBGCOJYSPASM-UHFFFAOYSA-N	CCN(CC)C(=O)CSC1=Nc2cc3OCOc3cc2C(=O)N1Cc4ccc(OC)cc4	BroadT	BRD-K11224142	BRD-K11224142-001-06-4	ChemDiv Inc.	K284-6163			CCN(CC)C(=O)CSc1nc2cc3OCOc3cc2c(=O)n1Cc1ccc(OC)cc1	InChI=1S/C23H25N3O5S/c1-4-25(5-2)21(27)13-32-23-24-18-11-20-19(30-14-31-20)10-17(18)22(28)26(23)12-15-6-8-16(29-3)9-7-15/h6-11H,4-5,12-14H2,1-3H3	BXNBGCOJYSPASM-UHFFFAOYSA-N	455.15149162							122134
STK330003	LSM-33578	SID47198708, BRD-K88589582	755776	InChI=1S/C15H12FNO2/c16-13-9-5-4-8-12(13)15(19)17-10-14(18)11-6-2-1-3-7-11/h1-9H,10H2,(H,17,19)	MXTIIKZTVMPCNQ-UHFFFAOYSA-N	Fc1ccccc1C(=O)NCC(=O)c2ccccc2	BroadT	BRD-K88589582	BRD-K88589582-001-05-7	ChemBridge Corporation	5332839			Fc1ccccc1C(=O)NCC(=O)c1ccccc1	InChI=1S/C15H12FNO2/c16-13-9-5-4-8-12(13)15(19)17-10-14(18)11-6-2-1-3-7-11/h1-9H,10H2,(H,17,19)	MXTIIKZTVMPCNQ-UHFFFAOYSA-N	257.085206834							122135
MLS000534075	LSM-33579	SID14734847, BRD-K51875826	749682	InChI=1S/C18H17NO2/c20-18(19-13-6-2-3-7-13)17-11-15-14-8-4-1-5-12(14)9-10-16(15)21-17/h1,4-5,8-11,13H,2-3,6-7H2,(H,19,20)	VPROQYQBNVRYST-UHFFFAOYSA-N	O=C(NC1CCCC1)c2oc3ccc4ccccc4c3c2	BroadT	BRD-K51875826	BRD-K51875826-001-06-7	ChemBridge Corporation	6645106			O=C(NC1CCCC1)c1cc2c(ccc3ccccc23)o1	InChI=1S/C18H17NO2/c20-18(19-13-6-2-3-7-13)17-11-15-14-8-4-1-5-12(14)9-10-16(15)21-17/h1,4-5,8-11,13H,2-3,6-7H2,(H,19,20)	VPROQYQBNVRYST-UHFFFAOYSA-N	279.125928794							122136
AC1LGCP9	LSM-33580	BRD-K88758204	768862	InChI=1S/C14H11Cl2N3O2/c15-11-3-4-13(12(16)6-11)21-9-14(20)19-18-8-10-2-1-5-17-7-10/h1-8H,9H2,(H,19,20)	VYTHKVDYIDGEPR-UHFFFAOYSA-N	Clc1ccc(OCC(=O)NN=Cc2cccnc2)c(Cl)c1	BroadT	BRD-K88758204	BRD-K88758204-001-05-6	Asinex Ltd.	BAS 00229594			Clc1ccc(OCC(=O)NN=Cc2cccnc2)c(Cl)c1	InChI=1S/C14H11Cl2N3O2/c15-11-3-4-13(12(16)6-11)21-9-14(20)19-18-8-10-2-1-5-17-7-10/h1-8H,9H2,(H,19,20)	VYTHKVDYIDGEPR-UHFFFAOYSA-N	323.022832042							122137
3-(4-Methoxyphenyl)-6-[(4-methylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole	LSM-33581	SID864325, BRD-K43970149	665573	InChI=1S/C18H16N4O2S/c1-12-3-7-15(8-4-12)24-11-16-21-22-17(19-20-18(22)25-16)13-5-9-14(23-2)10-6-13/h3-10H,11H2,1-2H3	PBIFTXWRTCIGBS-UHFFFAOYSA-N	COc1ccc(cc1)c2nnc3sc(COc4ccc(C)cc4)nn23	BroadT	BRD-K43970149	BRD-K43970149-001-05-9	InterBioScreen Ltd.	STOCK5S-12619			COc1ccc(cc1)-c1nnc2sc(COc3ccc(C)cc3)nn12	InChI=1S/C18H16N4O2S/c1-12-3-7-15(8-4-12)24-11-16-21-22-17(19-20-18(22)25-16)13-5-9-14(23-2)10-6-13/h3-10H,11H2,1-2H3	PBIFTXWRTCIGBS-UHFFFAOYSA-N	352.099396482							122138
SMR000104221	LSM-33582	SID7975127, BRD-K04241934	5310763	InChI=1S/C20H19NO4/c22-18-7-6-15-19(23)17(14-4-2-1-3-5-14)13-25-20(15)16(18)12-21-8-10-24-11-9-21/h1-7,13,22H,8-12H2	VFWZRNWEXUGWGH-UHFFFAOYSA-N	Oc1ccc2C(=O)C(=COc2c1CN3CCOCC3)c4ccccc4	BroadT	BRD-K04241934	BRD-K04241934-001-05-1	ChemBridge Corporation	5744379			Oc1ccc2c(occ(-c3ccccc3)c2=O)c1CN1CCOCC1	InChI=1S/C20H19NO4/c22-18-7-6-15-19(23)17(14-4-2-1-3-5-14)13-25-20(15)16(18)12-21-8-10-24-11-9-21/h1-7,13,22H,8-12H2	VFWZRNWEXUGWGH-UHFFFAOYSA-N	337.131408098							122139
MLS000031524	LSM-33583	SID845926, BRD-K54722259	648294	InChI=1S/C16H16N2O4/c1-3-19-12-8-7-11(10-14(12)20-4-2)15-17-18-16(22-15)13-6-5-9-21-13/h5-10H,3-4H2,1-2H3	OIJQVHJDZUDXCL-UHFFFAOYSA-N	CCOc1ccc(cc1OCC)c2oc(nn2)c3occc3	BroadT	BRD-K54722259	BRD-K54722259-001-05-6	Asinex Ltd.	ASN 02223521			CCOc1ccc(cc1OCC)-c1nnc(o1)-c1ccco1	InChI=1S/C16H16N2O4/c1-3-19-12-8-7-11(10-14(12)20-4-2)15-17-18-16(22-15)13-6-5-9-21-13/h5-10H,3-4H2,1-2H3	OIJQVHJDZUDXCL-UHFFFAOYSA-N	300.111007012							122140
T5295302	LSM-33584	SID22401600, BRD-A64242173	4831941	InChI=1S/C24H30N2O5S2/c1-16-6-9-19-20(15-32-21(19)12-16)24(28)31-14-23(27)25-18-8-7-17(2)22(13-18)33(29,30)26-10-4-3-5-11-26/h7-8,13,15-16H,3-6,9-12,14H2,1-2H3,(H,25,27)	RNLLWNQGDARIPE-UHFFFAOYSA-N	CC1CCc2c(C1)scc2C(=O)OCC(=O)Nc3ccc(C)c(c3)S(=O)(=O)N4CCCCC4	BroadT	BRD-A64242173	BRD-A64242173-001-06-6	Enamine Ltd.	T5295302			CC1CCc2c(C1)scc2C(=O)OCC(=O)Nc1ccc(C)c(c1)S(=O)(=O)N1CCCCC1	InChI=1S/C24H30N2O5S2/c1-16-6-9-19-20(15-32-21(19)12-16)24(28)31-14-23(27)25-18-8-7-17(2)22(13-18)33(29,30)26-10-4-3-5-11-26/h7-8,13,15-16H,3-6,9-12,14H2,1-2H3,(H,25,27)	RNLLWNQGDARIPE-UHFFFAOYSA-N	490.15961346							122141
N,N-Dimethyl-2-[(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]ethanamine	LSM-33585	SID17504170, BRD-K05169437	943582	InChI=1S/C17H21N3S/c1-20(2)11-12-21-17-14-9-6-10-15(14)18-16(19-17)13-7-4-3-5-8-13/h3-5,7-8H,6,9-12H2,1-2H3	IQYRIKYSWUXORO-UHFFFAOYSA-N	CN(C)CCSc1nc(nc2CCCc12)c3ccccc3	BroadT	BRD-K05169437	BRD-K05169437-001-05-5	InterBioScreen Ltd.	STOCK4S-61523			CN(C)CCSc1nc(nc2CCCc12)-c1ccccc1	InChI=1S/C17H21N3S/c1-20(2)11-12-21-17-14-9-6-10-15(14)18-16(19-17)13-7-4-3-5-8-13/h3-5,7-8H,6,9-12H2,1-2H3	IQYRIKYSWUXORO-UHFFFAOYSA-N	299.145618392							122142
2-(1H-Benzimidazol-2-yl)-1-(4-chlorophenyl)ethanamine	LSM-15477	BRD-A01663848	2771999	InChI=1S/C15H14ClN3/c16-11-7-5-10(6-8-11)12(17)9-15-18-13-3-1-2-4-14(13)19-15/h1-8,12H,9,17H2,(H,18,19)	DAMLMDCTLYBKGT-UHFFFAOYSA-N	NC(Cc1nc2ccccc2[nH]1)c3ccc(Cl)cc3	BroadT	BRD-A01663848	BRD-A01663848-003-06-0	InterBioScreen Ltd.	STOCK4S-30711		Cl	NC(Cc1nc2ccccc2[nH]1)c1ccc(Cl)cc1.Cl	InChI=1S/C15H14ClN3.ClH/c16-11-7-5-10(6-8-11)12(17)9-15-18-13-3-1-2-4-14(13)19-15;/h1-8,12H,9,17H2,(H,18,19);1H	SAXLLFCFPMIIRS-UHFFFAOYSA-N	271.087625188							104119, 104119
HMS2623J18	LSM-33586	BRD-K54145947	12004879	InChI=1S/C17H24N8O2/c1-3-16-20-22-17(24(16)18)21-19-11-13-4-5-14(15(10-13)25(26)27)23-8-6-12(2)7-9-23/h4-5,10-12H,3,6-9,18H2,1-2H3,(H,21,22)	RRIABCVKWRTOMY-UHFFFAOYSA-N	CCc1nnc(NN=Cc2ccc(N3CCC(C)CC3)c(c2)[N+](=O)[O-])n1N	BroadT	BRD-K54145947	BRD-K54145947-001-05-8	ChemDiv Inc.	3277-0281			CCc1nnc(NN=Cc2ccc(N3CCC(C)CC3)c(c2)[N+]([O-])=O)n1N	InChI=1S/C17H24N8O2/c1-3-16-20-22-17(24(16)18)21-19-11-13-4-5-14(15(10-13)25(26)27)23-8-6-12(2)7-9-23/h4-5,10-12H,3,6-9,18H2,1-2H3,(H,21,22)	RRIABCVKWRTOMY-UHFFFAOYSA-N	372.202222088							122143
AC1MJPJH	LSM-33587	SID24787956, BRD-A14158096	3116189	InChI=1S/C18H19N5O3S/c1-5-26-17(25)15-12(4)19-18(27-15)23-16(24)14(11(3)22-23)21-20-13-8-6-7-10(2)9-13/h6-9,14H,5H2,1-4H3	VWWACEFJSDMIAT-UHFFFAOYSA-N	CCOC(=O)c1sc(nc1C)N2N=C(C)C(N=Nc3cccc(C)c3)C2=O	BroadT	BRD-A14158096	BRD-A14158096-001-05-1	Specs	AF-886/31107032			CCOC(=O)c1sc(nc1C)N1N=C(C)C(N=Nc2cccc(C)c2)C1=O	InChI=1S/C18H19N5O3S/c1-5-26-17(25)15-12(4)19-18(27-15)23-16(24)14(11(3)22-23)21-20-13-8-6-7-10(2)9-13/h6-9,14H,5H2,1-4H3	VWWACEFJSDMIAT-UHFFFAOYSA-N	385.120860208							122144
SMR000034812	LSM-33588	SID860537, BRD-A19251316	661822	InChI=1S/C13H12N4O3S/c1-20-9-4-2-3-8(5-9)15-12(19)10-6-11(18)17-7-14-16-13(17)21-10/h2-5,7,10H,6H2,1H3,(H,15,19)	BPXXZHVSAQGMTQ-UHFFFAOYSA-N	COc1cccc(NC(=O)C2CC(=O)n3cnnc3S2)c1	BroadT	BRD-A19251316	BRD-A19251316-001-04-6	InterBioScreen Ltd.	STOCK3S-80061			COc1cccc(NC(=O)C2CC(=O)n3cnnc3S2)c1	InChI=1S/C13H12N4O3S/c1-20-9-4-2-3-8(5-9)15-12(19)10-6-11(18)17-7-14-16-13(17)21-10/h2-5,7,10H,6H2,1H3,(H,15,19)	BPXXZHVSAQGMTQ-UHFFFAOYSA-N	304.063010974							122145
8-(Prop-2-en-1-yl)-9-(propylsulfanyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one	LSM-33589	SID17506325, BRD-K30234286	1600135	InChI=1S/C20H20N2OS2/c1-3-11-22-19(23)16-15-10-9-13-7-5-6-8-14(13)17(15)25-18(16)21-20(22)24-12-4-2/h3,5-8H,1,4,9-12H2,2H3	KEVYJDLJLCDSKR-UHFFFAOYSA-N	CCCSC1=Nc2sc3c(CCc4ccccc34)c2C(=O)N1CC=C	BroadT	BRD-K30234286	BRD-K30234286-001-06-6	ChemBridge Corporation	6107943			CCCSc1nc2sc-3c(CCc4ccccc-34)c2c(=O)n1CC=C	InChI=1S/C20H20N2OS2/c1-3-11-22-19(23)16-15-10-9-13-7-5-6-8-14(13)17(15)25-18(16)21-20(22)24-12-4-2/h3,5-8H,1,4,9-12H2,2H3	KEVYJDLJLCDSKR-UHFFFAOYSA-N	368.10170466							122146
T5258044	LSM-33590	SID24835391, BRD-K71608445	2080448	InChI=1S/C18H19FN2O3S2/c19-15-6-8-16(9-7-15)25-14-18(22)20-10-12-21(13-11-20)26(23,24)17-4-2-1-3-5-17/h1-9H,10-14H2	MOAJUWCZSDEERL-UHFFFAOYSA-N	Fc1ccc(SCC(=O)N2CCN(CC2)S(=O)(=O)c3ccccc3)cc1	BroadT	BRD-K71608445	BRD-K71608445-001-05-1	Enamine Ltd.	T5258044			Fc1ccc(SCC(=O)N2CCN(CC2)S(=O)(=O)c2ccccc2)cc1	InChI=1S/C18H19FN2O3S2/c19-15-6-8-16(9-7-15)25-14-18(22)20-10-12-21(13-11-20)26(23,24)17-4-2-1-3-5-17/h1-9H,10-14H2	MOAJUWCZSDEERL-UHFFFAOYSA-N	394.082112068							122147
1-[4-(Dimethylamino)benzyl]-1-(furan-2-ylmethyl)-3-(4-methoxyphenyl)thiourea	LSM-33591	SID17510827, BRD-K12974244	1256804	InChI=1S/C22H25N3O2S/c1-24(2)19-10-6-17(7-11-19)15-25(16-21-5-4-14-27-21)22(28)23-18-8-12-20(26-3)13-9-18/h4-14H,15-16H2,1-3H3,(H,23,28)	IILLRBCLHJABSA-UHFFFAOYSA-N	COc1ccc(NC(=S)N(Cc2occc2)Cc3ccc(cc3)N(C)C)cc1	BroadT	BRD-K12974244	BRD-K12974244-001-05-2	ChemDiv Inc.	8011-9919			COc1ccc(NC(=S)N(Cc2ccco2)Cc2ccc(cc2)N(C)C)cc1	InChI=1S/C22H25N3O2S/c1-24(2)19-10-6-17(7-11-19)15-25(16-21-5-4-14-27-21)22(28)23-18-8-12-20(26-3)13-9-18/h4-14H,15-16H2,1-3H3,(H,23,28)	IILLRBCLHJABSA-UHFFFAOYSA-N	395.16674776							122148
3-Amino-9-ethylcarbazole	LSM-33592	SID857880, BRD-K70333305	8588	InChI=1S/C14H14N2/c1-2-16-13-6-4-3-5-11(13)12-9-10(15)7-8-14(12)16/h3-9H,2,15H2,1H3	OXEUETBFKVCRNP-UHFFFAOYSA-N	CCn1c2ccccc2c3cc(N)ccc13	BroadT	BRD-K70333305	BRD-K70333305-001-05-6	InterBioScreen Ltd.	STOCK2S-04320			CCn1c2ccccc2c2cc(N)ccc12	InChI=1S/C14H14N2/c1-2-16-13-6-4-3-5-11(13)12-9-10(15)7-8-14(12)16/h3-9H,2,15H2,1H3	OXEUETBFKVCRNP-UHFFFAOYSA-N	210.115698468							122149, 122149
SMR000198796	LSM-33593	SID17506716, BRD-K00428484	1193358	InChI=1S/C22H18ClNO4/c1-15-5-9-18(10-6-15)24-22(26)16-7-11-19(12-8-16)28-21(25)14-27-20-4-2-3-17(23)13-20/h2-13H,14H2,1H3,(H,24,26)	NBNJMDYTGMFMFV-UHFFFAOYSA-N	Cc1ccc(NC(=O)c2ccc(OC(=O)COc3cccc(Cl)c3)cc2)cc1	BroadT	BRD-K00428484	BRD-K00428484-001-05-2	ChemBridge Corporation	7613578			Cc1ccc(NC(=O)c2ccc(OC(=O)COc3cccc(Cl)c3)cc2)cc1	InChI=1S/C22H18ClNO4/c1-15-5-9-18(10-6-15)24-22(26)16-7-11-19(12-8-16)28-21(25)14-27-20-4-2-3-17(23)13-20/h2-13H,14H2,1H3,(H,24,26)	NBNJMDYTGMFMFV-UHFFFAOYSA-N	395.092435776							122150
MLS000527535	LSM-33594	SID14725734, BRD-K68379277	803330	InChI=1S/C14H14BrNO2/c1-9(2)10-3-5-11(6-4-10)16-14(17)12-7-8-13(15)18-12/h3-9H,1-2H3,(H,16,17)	AUKGEVZMXPNOHI-UHFFFAOYSA-N	CC(C)c1ccc(NC(=O)c2oc(Br)cc2)cc1	BroadT	BRD-K68379277	BRD-K68379277-001-05-7	Asinex Ltd.	BAS 00541454			CC(C)c1ccc(NC(=O)c2ccc(Br)o2)cc1	InChI=1S/C14H14BrNO2/c1-9(2)10-3-5-11(6-4-10)16-14(17)12-7-8-13(15)18-12/h3-9H,1-2H3,(H,16,17)	AUKGEVZMXPNOHI-UHFFFAOYSA-N	307.020791298							122151
F0920-5744	LSM-33595	SID4251001, BRD-K44925480	3244743	InChI=1S/C17H14N2O3S/c1-23-13-4-2-3-12(8-13)19-9-14(18-17(19)20)11-5-6-15-16(7-11)22-10-21-15/h2-9H,10H2,1H3,(H,18,20)	WUIJWPSJFCCFLN-UHFFFAOYSA-N	CSc1cccc(c1)n2cc(nc2O)c3ccc4OCOc4c3	BroadT	BRD-K44925480	BRD-K44925480-001-05-9	ChemDiv Inc.	C200-1041			CSc1cccc(c1)-n1cc(nc1O)-c1ccc2OCOc2c1	InChI=1S/C17H14N2O3S/c1-23-13-4-2-3-12(8-13)19-9-14(18-17(19)20)11-5-6-15-16(7-11)22-10-21-15/h2-9H,10H2,1H3,(H,18,20)	WUIJWPSJFCCFLN-UHFFFAOYSA-N	326.072513018							122152
SMR000161419	LSM-33596	SID17386862, BRD-K46433551	849564	InChI=1S/C18H17NO4/c1-10-11(2)14-7-5-6-8-19(14)16-12(10)9-13(17(20)22-3)15(16)18(21)23-4/h5-9H,1-4H3	WEBZFFLTBUZLOY-UHFFFAOYSA-N	COC(=O)c1cc2c(C)c(C)c3ccccn3c2c1C(=O)OC	BroadT	BRD-K46433551	BRD-K46433551-001-05-6	Specs	AO-840/42717803			COC(=O)c1cc2c(C)c(C)c3ccccn3c2c1C(=O)OC	InChI=1S/C18H17NO4/c1-10-11(2)14-7-5-6-8-19(14)16-12(10)9-13(17(20)22-3)15(16)18(21)23-4/h5-9H,1-4H3	WEBZFFLTBUZLOY-UHFFFAOYSA-N	311.115758034							122153
MLS000098891	LSM-33597	SID3717467, BRD-A34725553	3000013	InChI=1S/C17H17N3O5S2/c18-14(22)10-5-8-27-15(10)19-13(21)9-25-17(24)11-3-1-6-20(11)16(23)12-4-2-7-26-12/h2,4-5,7-8,11H,1,3,6,9H2,(H2,18,22)(H,19,21)	PKFPSCYJZUISCT-UHFFFAOYSA-N	NC(=O)c1ccsc1NC(=O)COC(=O)C2CCCN2C(=O)c3cccs3	BroadT	BRD-A34725553	BRD-A34725553-001-03-4	Enamine Ltd.	T5331656			NC(=O)c1ccsc1NC(=O)COC(=O)C1CCCN1C(=O)c1cccs1	InChI=1S/C17H17N3O5S2/c18-14(22)10-5-8-27-15(10)19-13(21)9-25-17(24)11-3-1-6-20(11)16(23)12-4-2-7-26-12/h2,4-5,7-8,11H,1,3,6,9H2,(H2,18,22)(H,19,21)	PKFPSCYJZUISCT-UHFFFAOYSA-N	407.060962054							122154
SMR000007494	LSM-33598	SID845429, BRD-A47110361	647780	InChI=1S/C19H19N3O3/c1-13-9-10-16(24-13)17-20-18(25-21-17)15-8-5-11-22(12-15)19(23)14-6-3-2-4-7-14/h2-4,6-7,9-10,15H,5,8,11-12H2,1H3	UFSMSRDTEFNNQA-UHFFFAOYSA-N	Cc1oc(cc1)c2noc(n2)C3CCCN(C3)C(=O)c4ccccc4	BroadT	BRD-A47110361	BRD-A47110361-001-05-1	Asinex Ltd.	ASN 06941691			Cc1ccc(o1)-c1noc(n1)C1CCCN(C1)C(=O)c1ccccc1	InChI=1S/C19H19N3O3/c1-13-9-10-16(24-13)17-20-18(25-21-17)15-8-5-11-22(12-15)19(23)14-6-3-2-4-7-14/h2-4,6-7,9-10,15H,5,8,11-12H2,1H3	UFSMSRDTEFNNQA-UHFFFAOYSA-N	337.142641498							122155
AC1M4MI7	LSM-15240	BRD-K15115425	2310945	InChI=1S/C21H17N2S/c1-2-8-17(9-3-1)23-19(20-11-6-14-24-20)15-22-18-10-5-4-7-16(18)12-13-21(22)23/h1-11,14-15H,12-13H2/q+1	GQURBCLQYBAANB-UHFFFAOYSA-N	C1Cc2[n+](c3ccccc3)c(cn2c4ccccc14)c5cccs5	BroadT	BRD-K15115425	BRD-K15115425-004-06-2	Enamine Ltd.	T0502-5423		Br	C1Cc2ccccc2-n2cc(-c3cccs3)[n+](c12)-c1ccccc1.Br	InChI=1S/C21H17N2S.BrH/c1-2-8-17(9-3-1)23-19(20-11-6-14-24-20)15-22-18-10-5-4-7-16(18)12-13-21(22)23;/h1-11,14-15H,12-13H2;1H/q+1;	FEQLIKIWIDYDGJ-UHFFFAOYSA-N	329.111244254							103887, 103887
2-(3,5-Dichlorophenyl)-1-hydrazinecarbothioamide	LSM-33599	SID14731904, BRD-K15317550	5153151	InChI=1S/C7H7Cl2N3S/c8-4-1-5(9)3-6(2-4)11-12-7(10)13/h1-3,11H,(H3,10,12,13)	KJLLDURTKFHSJE-UHFFFAOYSA-N	NC(=NNc1cc(Cl)cc(Cl)c1)S	BroadT	BRD-K15317550	BRD-K15317550-001-05-9	Key Organics Ltd.	2P-054			NC(S)=NNc1cc(Cl)cc(Cl)c1	InChI=1S/C7H7Cl2N3S/c8-4-1-5(9)3-6(2-4)11-12-7(10)13/h1-3,11H,(H3,10,12,13)	KJLLDURTKFHSJE-UHFFFAOYSA-N	234.973773364							122156
SMR000002477	LSM-33600	SID845215, BRD-A10759058	647557	InChI=1S/C25H28N6O2/c1-33-20-12-11-19-15-21(25(32)26-22(19)16-20)23(30-13-7-2-3-8-14-30)24-27-28-29-31(24)17-18-9-5-4-6-10-18/h4-6,9-12,15-16,23H,2-3,7-8,13-14,17H2,1H3,(H,26,32)	BYYUZGUAGYIVFW-UHFFFAOYSA-N	COc1ccc2cc(C(N3CCCCCC3)c4nnnn4Cc5ccccc5)c(O)nc2c1	BroadT	BRD-A10759058	BRD-A10759058-001-05-6	Asinex Ltd.	ASN 03775756			COc1ccc2cc(C(N3CCCCCC3)c3nnnn3Cc3ccccc3)c(O)nc2c1	InChI=1S/C25H28N6O2/c1-33-20-12-11-19-15-21(25(32)26-22(19)16-20)23(30-13-7-2-3-8-14-30)24-27-28-29-31(24)17-18-9-5-4-6-10-18/h4-6,9-12,15-16,23H,2-3,7-8,13-14,17H2,1H3,(H,26,32)	BYYUZGUAGYIVFW-UHFFFAOYSA-N	444.227374196							122157
MLS000756415	LSM-1695	Methylergometrine, BRD-A63667919, SID26666677	4140	InChI=1S/C20H25N3O2/c1-3-14(11-24)22-20(25)13-7-16-15-5-4-6-17-19(15)12(9-21-17)8-18(16)23(2)10-13/h4-7,9,13-14,18,21,24H,3,8,10-11H2,1-2H3,(H,22,25)	UNBRKDKAWYKMIV-UHFFFAOYSA-N	CCC(CO)NC(=O)C1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34	BroadT	BRD-A63667919	BRD-A63667919-001-05-6	National Cancer Institute Chemotherapeutic Agents Repository	Methergine 186067			CCC(CO)NC(=O)C1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34	InChI=1S/C20H25N3O2/c1-3-14(11-24)22-20(25)13-7-16-15-5-4-6-17-19(15)12(9-21-17)8-18(16)23(2)10-13/h4-7,9,13-14,18,21,24H,3,8,10-11H2,1-2H3,(H,22,25)	UNBRKDKAWYKMIV-UHFFFAOYSA-N	339.19467707							91798, 91798
STK133805	LSM-33601	SID17414156, BRD-K27093637	1288168	InChI=1S/C19H15ClN2OS/c20-14-7-6-8-15(13-14)21-19(24)22-17-11-4-5-12-18(17)23-16-9-2-1-3-10-16/h1-13H,(H2,21,22,24)	SPDVYPXXDOLSOS-UHFFFAOYSA-N	Clc1cccc(NC(=S)Nc2ccccc2Oc3ccccc3)c1	BroadT	BRD-K27093637	BRD-K27093637-001-05-9	ChemBridge Corporation	7727854			Clc1cccc(NC(=S)Nc2ccccc2Oc2ccccc2)c1	InChI=1S/C19H15ClN2OS/c20-14-7-6-8-15(13-14)21-19(24)22-17-11-4-5-12-18(17)23-16-9-2-1-3-10-16/h1-13H,(H2,21,22,24)	SPDVYPXXDOLSOS-UHFFFAOYSA-N	354.05936152							122158
1-[(1-Tert-butyl-1H-tetrazol-5-yl)-p-tolyl-methyl]-4-methyl-piperidine	LSM-15478	BRD-A44812120	3201628	InChI=1S/C19H29N5/c1-14-6-8-16(9-7-14)17(23-12-10-15(2)11-13-23)18-20-21-22-24(18)19(3,4)5/h6-9,15,17H,10-13H2,1-5H3	CSXVYXLMDSGRFU-UHFFFAOYSA-N	CC1CCN(CC1)C(c2ccc(C)cc2)c3nnnn3C(C)(C)C	BroadT	BRD-A44812120	BRD-A44812120-003-05-3	Asinex Ltd.	ASN 05346286		Cl	CC1CCN(CC1)C(c1nnnn1C(C)(C)C)c1ccc(C)cc1.Cl	InChI=1S/C19H29N5.ClH/c1-14-6-8-16(9-7-14)17(23-12-10-15(2)11-13-23)18-20-21-22-24(18)19(3,4)5;/h6-9,15,17H,10-13H2,1-5H3;1H	PKRBNOAFAVKJGP-UHFFFAOYSA-N	327.242295978							131235, 131235
CBMICRO_016111	LSM-33602	SID26658421, BRD-K88993574	827749	InChI=1S/C16H15NO3S/c1-9-4-2-5-10(8-9)14(18)17-15-13(16(19)20)11-6-3-7-12(11)21-15/h2,4-5,8H,3,6-7H2,1H3,(H,17,18)(H,19,20)	ATOWWQNUFHSVDL-UHFFFAOYSA-N	Cc1cccc(c1)C(=O)Nc2sc3CCCc3c2C(=O)O	BroadT	BRD-K88993574	BRD-K88993574-001-05-1	InterBioScreen Ltd.	STOCK3S-01089			Cc1cccc(c1)C(=O)Nc1sc2CCCc2c1C(O)=O	InChI=1S/C16H15NO3S/c1-9-4-2-5-10(8-9)14(18)17-15-13(16(19)20)11-6-3-7-12(11)21-15/h2,4-5,8H,3,6-7H2,1H3,(H,17,18)(H,19,20)	ATOWWQNUFHSVDL-UHFFFAOYSA-N	301.07726404							122159
ST50765425	LSM-33603	SID24794423, BRD-K76820832	972437	InChI=1S/C17H17FN2OS/c1-12(21)14-4-8-16(9-5-14)20-17(22)19-11-10-13-2-6-15(18)7-3-13/h2-9H,10-11H2,1H3,(H2,19,20,22)	NBJVCTQBIHIHGE-UHFFFAOYSA-N	CC(=O)c1ccc(NC(=NCCc2ccc(F)cc2)S)cc1	BroadT	BRD-K76820832	BRD-K76820832-001-05-8	ChemBridge Corporation	7849722			CC(=O)c1ccc(NC(S)=NCCc2ccc(F)cc2)cc1	InChI=1S/C17H17FN2OS/c1-12(21)14-4-8-16(9-5-14)20-17(22)19-11-10-13-2-6-15(18)7-3-13/h2-9H,10-11H2,1H3,(H2,19,20,22)	NBJVCTQBIHIHGE-UHFFFAOYSA-N	316.104562074							122160
MLS000394443	LSM-15594	BRD-K62317754	3966103	InChI=1S/C12H12N4O4S/c1-20-10-6-8(16(18)19)2-3-9(10)14-11(17)7-15-4-5-21-12(15)13/h2-6,13H,7H2,1H3,(H,14,17)	ALPZBOMVALHVNJ-UHFFFAOYSA-N	COc1cc(ccc1NC(=O)CN2C=CSC2=N)[N+](=O)[O-]	BroadT	BRD-K62317754	BRD-K62317754-034-05-6	Enamine Ltd.	T5257818		OC(=O)C(=O)O	COc1cc(ccc1NC(=O)Cn1ccsc1=N)[N+]([O-])=O.OC(=O)C(=O)O	InChI=1S/C12H12N4O4S.C2H2O4/c1-20-10-6-8(16(18)19)2-3-9(10)14-11(17)7-15-4-5-21-12(15)13;3-1(4)2(5)6/h2-6,13H,7H2,1H3,(H,14,17);(H,3,4)(H,5,6)	WUPLJZXJALIISU-UHFFFAOYSA-N	308.057925594							104230, 104230
AC1LFV4S	LSM-33604	BRD-K84637316	760482	InChI=1S/C14H18N4O3/c1-9-16-17-10(2)18(9)15-8-11-6-13(20-4)14(21-5)7-12(11)19-3/h6-8H,1-5H3	UDCZCGWPYUIRIU-UHFFFAOYSA-N	COc1cc(OC)c(C=Nn2c(C)nnc2C)cc1OC	BroadT	BRD-K84637316	BRD-K84637316-001-05-1	ChemBridge Corporation	5783969			COc1cc(OC)c(C=Nn2c(C)nnc2C)cc1OC	InChI=1S/C14H18N4O3/c1-9-16-17-10(2)18(9)15-8-11-6-13(20-4)14(21-5)7-12(11)19-3/h6-8H,1-5H3	UDCZCGWPYUIRIU-UHFFFAOYSA-N	290.137890476							122161
SMR000072224	LSM-33605	SID4261060, BRD-K48978360	1572935	InChI=1S/C17H17FN8O2S/c1-2-28-14(27)11-7-21-17(25-13(11)19)29-8-12-23-15(20)26-16(24-12)22-10-5-3-9(18)4-6-10/h3-7H,2,8H2,1H3,(H2,19,21,25)(H3,20,22,23,24,26)	VLJAIEKCUCADNF-UHFFFAOYSA-N	CCOC(=O)c1cnc(SCc2nc(N)nc(Nc3ccc(F)cc3)n2)nc1N	BroadT	BRD-K48978360	BRD-K48978360-001-05-9	ChemBridge Corporation	7361848			CCOC(=O)c1cnc(SCc2nc(N)nc(Nc3ccc(F)cc3)n2)nc1N	InChI=1S/C17H17FN8O2S/c1-2-28-14(27)11-7-21-17(25-13(11)19)29-8-12-23-15(20)26-16(24-12)22-10-5-3-9(18)4-6-10/h3-7H,2,8H2,1H3,(H2,19,21,25)(H3,20,22,23,24,26)	VLJAIEKCUCADNF-UHFFFAOYSA-N	416.117920754							122162
N,3-Diphenylpyrrolidine-1-carboxamide	LSM-33606	SID4250899, BRD-A77404109	3244652	InChI=1S/C17H18N2O/c20-17(18-16-9-5-2-6-10-16)19-12-11-15(13-19)14-7-3-1-4-8-14/h1-10,15H,11-13H2,(H,18,20)	MZAQOOWXHQBKBK-UHFFFAOYSA-N	O=C(Nc1ccccc1)N2CCC(C2)c3ccccc3	BroadT	BRD-A77404109	BRD-A77404109-001-05-8	ChemDiv Inc.	K788-0578			O=C(Nc1ccccc1)N1CCC(C1)c1ccccc1	InChI=1S/C17H18N2O/c20-17(18-16-9-5-2-6-10-16)19-12-11-15(13-19)14-7-3-1-4-8-14/h1-10,15H,11-13H2,(H,18,20)	MZAQOOWXHQBKBK-UHFFFAOYSA-N	266.141913216							122163
AC1MRW42	LSM-33607	SID26666834, BRD-A33385649	3524739	InChI=1S/C24H27N5OS2/c1-17-22(18-8-4-3-5-9-18)23(26-20-11-7-6-10-19(20)25-17)27-21(30)16-32-24(31)29-14-12-28(2)13-15-29/h3-11,22H,12-16H2,1-2H3,(H,26,27,30)	VBGKZBXJQMLQMT-UHFFFAOYSA-N	CN1CCN(CC1)C(=S)SCC(=O)NC2=Nc3ccccc3N=C(C)C2c4ccccc4	BroadT	BRD-A33385649	BRD-A33385649-001-05-9	InterBioScreen Ltd.	STOCK4S-09183			CN1CCN(CC1)C(=S)SCC(=O)NC1=Nc2ccccc2N=C(C)C1c1ccccc1	InChI=1S/C24H27N5OS2/c1-17-22(18-8-4-3-5-9-18)23(26-20-11-7-6-10-19(20)25-17)27-21(30)16-32-24(31)29-14-12-28(2)13-15-29/h3-11,22H,12-16H2,1-2H3,(H,26,27,30)	VBGKZBXJQMLQMT-UHFFFAOYSA-N	465.165701914							122164
AF-399/40756900	LSM-33608	SID7976864, BRD-K96406002	711153	InChI=1S/C16H13N3O2S/c1-10-5-6-13(21-10)12-9-22-15-14(12)16(20)19(11(2)17-15)18-7-3-4-8-18/h3-9H,1-2H3	HXTYONDTJBEKNC-UHFFFAOYSA-N	CC1=Nc2scc(c3oc(C)cc3)c2C(=O)N1n4cccc4	BroadT	BRD-K96406002	BRD-K96406002-001-05-6	ChemBridge Corporation	7137019			Cc1ccc(o1)-c1csc2nc(C)n(-n3cccc3)c(=O)c12	InChI=1S/C16H13N3O2S/c1-10-5-6-13(21-10)12-9-22-15-14(12)16(20)19(11(2)17-15)18-7-3-4-8-18/h3-9H,1-2H3	HXTYONDTJBEKNC-UHFFFAOYSA-N	311.072847376							122165
AC1MG1P8	LSM-33609	BRD-A99251840	2929059	InChI=1S/C22H16FN3O5/c23-10-1-3-14(17(7-10)26(29)30)18-6-2-11(31-18)9-24-25-21(27)19-12-4-5-13(16-8-15(12)16)20(19)22(25)28/h1-7,9,12-13,15-16,19-20H,8H2	TTXFRXHXLOPRKT-UHFFFAOYSA-N	[O-][N+](=O)c1cc(F)ccc1c2oc(C=NN3C(=O)C4C5C=CC(C6CC56)C4C3=O)cc2	BroadT	BRD-A99251840	BRD-A99251840-001-06-9	ChemBridge Corporation	7171880			[O-][N+](=O)c1cc(F)ccc1-c1ccc(C=NN2C(=O)C3C(C4C=CC3C3CC43)C2=O)o1	InChI=1S/C22H16FN3O5/c23-10-1-3-14(17(7-10)26(29)30)18-6-2-11(31-18)9-24-25-21(27)19-12-4-5-13(16-8-15(12)16)20(19)22(25)28/h1-7,9,12-13,15-16,19-20H,8H2	TTXFRXHXLOPRKT-UHFFFAOYSA-N	421.107398842							122166
ZINC00147922	LSM-33610	SID24785518, BRD-K69388436	733092	InChI=1S/C15H16BrN3O/c16-14-13(18-9-5-2-6-10-18)11-17-19(15(14)20)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2	PFFQYDKLRPGBSH-UHFFFAOYSA-N	BrC1=C(C=NN(C1=O)c2ccccc2)N3CCCCC3	BroadT	BRD-K69388436	BRD-K69388436-001-05-5	ChemDiv Inc.	5976-1426			Brc1c(cnn(-c2ccccc2)c1=O)N1CCCCC1	InChI=1S/C15H16BrN3O/c16-14-13(18-9-5-2-6-10-18)11-17-19(15(14)20)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2	PFFQYDKLRPGBSH-UHFFFAOYSA-N	333.047674762							122167
AC1LPDYZ	LSM-44495	SID24797443, BRD-K48289919	1305511	InChI=1S/C17H19BrN2O5S/c1-5-25-14-8-11(18)10(7-13(14)23-3)6-12-16(22)19(2)17(26)20(12)9-15(21)24-4/h6-8H,5,9H2,1-4H3/b12-6-	SGHIPAGJNXLRIJ-SDQBBNPISA-N	CCOc1cc(Br)c(\C=C\2/N(CC(=O)OC)C(=S)N(C)C2=O)cc1OC	BroadT	BRD-K48289919	BRD-K48289919-001-06-5	ChemBridge Corporation	7402598			CCOc1cc(Br)c(\C=C2/N(CC(=O)OC)C(=S)N(C)C2=O)cc1OC	InChI=1S/C17H19BrN2O5S/c1-5-25-14-8-11(18)10(7-13(14)23-3)6-12-16(22)19(2)17(26)20(12)9-15(21)24-4/h6-8H,5,9H2,1-4H3/b12-6-	SGHIPAGJNXLRIJ-SDQBBNPISA-N	442.019805018							
AC1M7OE8	LSM-33612	SID22408302, BRD-K46270026	2445725	InChI=1S/C15H11Cl2N5OS2/c1-8-5-19-12(6-18-8)13(23)20-14-21-22-15(25-14)24-7-9-10(16)3-2-4-11(9)17/h2-6H,7H2,1H3,(H,20,21,23)	IKIBEZGCHGPZSF-UHFFFAOYSA-N	Cc1cnc(cn1)C(=O)Nc2nnc(SCc3c(Cl)cccc3Cl)s2	BroadT	BRD-K46270026	BRD-K46270026-001-05-9	Enamine Ltd.	T0517-9808			Cc1cnc(cn1)C(=O)Nc1nnc(SCc2c(Cl)cccc2Cl)s1	InChI=1S/C15H11Cl2N5OS2/c1-8-5-19-12(6-18-8)13(23)20-14-21-22-15(25-14)24-7-9-10(16)3-2-4-11(9)17/h2-6H,7H2,1H3,(H,20,21,23)	IKIBEZGCHGPZSF-UHFFFAOYSA-N	410.978206822							122169
MLS000063481	LSM-33613	SID4259987, BRD-K27981654	1300223	InChI=1S/C20H14BrN3O4/c21-14-5-9-16(10-6-14)27-12-18(25)22-15-7-3-13(4-8-15)19-23-24-20(28-19)17-2-1-11-26-17/h1-11H,12H2,(H,22,25)	IRQSFUSXNVUVHL-UHFFFAOYSA-N	Brc1ccc(OCC(=O)Nc2ccc(cc2)c3oc(nn3)c4occc4)cc1	BroadT	BRD-K27981654	BRD-K27981654-001-05-3	ChemBridge Corporation	7362324			Brc1ccc(OCC(=O)Nc2ccc(cc2)-c2nnc(o2)-c2ccco2)cc1	InChI=1S/C20H14BrN3O4/c21-14-5-9-16(10-6-14)27-12-18(25)22-15-7-3-13(4-8-15)19-23-24-20(28-19)17-2-1-11-26-17/h1-11H,12H2,(H,22,25)	IRQSFUSXNVUVHL-UHFFFAOYSA-N	439.016768558							122170
MLS000334369	LSM-33614	SID22401903, BRD-A82460631	3965439	InChI=1S/C21H24N2O5S/c1-12-7-16(14(3)23(12)13(2)9-27-4)18(24)10-28-21(26)15-5-6-19-17(8-15)22-20(25)11-29-19/h5-8,13H,9-11H2,1-4H3,(H,22,25)	SUFFQJSFEGGTBK-UHFFFAOYSA-N	COCC(C)n1c(C)cc(C(=O)COC(=O)c2ccc3SCC(=O)Nc3c2)c1C	BroadT	BRD-A82460631	BRD-A82460631-001-06-8	Enamine Ltd.	T5283890			COCC(C)n1c(C)cc(C(=O)COC(=O)c2ccc3SCC(=O)Nc3c2)c1C	InChI=1S/C21H24N2O5S/c1-12-7-16(14(3)23(12)13(2)9-27-4)18(24)10-28-21(26)15-5-6-19-17(8-15)22-20(25)11-29-19/h5-8,13H,9-11H2,1-4H3,(H,22,25)	SUFFQJSFEGGTBK-UHFFFAOYSA-N	416.140592578							122171
MLS000107116	LSM-33615	SID7975383, BRD-K22928573	869658	InChI=1S/C16H15N3O/c1-11-16(18-12-7-9-13(20-2)10-8-12)19-15-6-4-3-5-14(15)17-11/h3-10H,1-2H3,(H,18,19)	ZRFALEFOAQGSHL-UHFFFAOYSA-N	COc1ccc(Nc2nc3ccccc3nc2C)cc1	BroadT	BRD-K22928573	BRD-K22928573-001-05-7	ChemBridge Corporation	5754217			COc1ccc(Nc2nc3ccccc3nc2C)cc1	InChI=1S/C16H15N3O/c1-11-16(18-12-7-9-13(20-2)10-8-12)19-15-6-4-3-5-14(15)17-11/h3-10H,1-2H3,(H,18,19)	ZRFALEFOAQGSHL-UHFFFAOYSA-N	265.12151213							122172
MLS000860737	LSM-33616	SID26731643, SID50121401, BRD-K89799914	2821359	InChI=1S/C12H10N2OS/c16-12-13-5-3-10(14-12)8-1-2-11-9(7-8)4-6-15-11/h1-3,5,7H,4,6H2,(H,13,14,16)	ILABTJJCSBGTKL-UHFFFAOYSA-N	Sc1nccc(n1)c2ccc3OCCc3c2	BroadT	BRD-K89799914	BRD-K89799914-001-06-8	Maybridge	KM 06173			Sc1nccc(n1)-c1ccc2OCCc2c1	InChI=1S/C12H10N2OS/c16-12-13-5-3-10(14-12)8-1-2-11-9(7-8)4-6-15-11/h1-3,5,7H,4,6H2,(H,13,14,16)	ILABTJJCSBGTKL-UHFFFAOYSA-N	230.05138365							122173
4-[4-(Tert-butyl)phenoxy]-2-phenyl-5-pyrimidinyl methyl ether	LSM-33617	SID17402869, BRD-K00748382	1472559	InChI=1S/C21H22N2O2/c1-21(2,3)16-10-12-17(13-11-16)25-20-18(24-4)14-22-19(23-20)15-8-6-5-7-9-15/h5-14H,1-4H3	UVTPQMAVSUAXIZ-UHFFFAOYSA-N	COc1cnc(nc1Oc2ccc(cc2)C(C)(C)C)c3ccccc3	BroadT	BRD-K00748382	BRD-K00748382-001-05-6	Key Organics Ltd.	2R-1193			COc1cnc(nc1Oc1ccc(cc1)C(C)(C)C)-c1ccccc1	InChI=1S/C21H22N2O2/c1-21(2,3)16-10-12-17(13-11-16)25-20-18(24-4)14-22-19(23-20)15-8-6-5-7-9-15/h5-14H,1-4H3	UVTPQMAVSUAXIZ-UHFFFAOYSA-N	334.168127964							122174
2-(2-Chloro-3-pyridinyl)-1,3-benzothiazole	LSM-33618	SID24820636, BRD-K50989059	2764495	InChI=1S/C12H7ClN2S/c13-11-8(4-3-7-14-11)12-15-9-5-1-2-6-10(9)16-12/h1-7H	BTZQMMNGDIRTEN-UHFFFAOYSA-N	Clc1ncccc1c2nc3ccccc3s2	BroadT	BRD-K50989059	BRD-K50989059-001-05-7	Key Organics Ltd.	9J-320S			Clc1ncccc1-c1nc2ccccc2s1	InChI=1S/C12H7ClN2S/c13-11-8(4-3-7-14-11)12-15-9-5-1-2-6-10(9)16-12/h1-7H	BTZQMMNGDIRTEN-UHFFFAOYSA-N	246.001846644							122175
2,2,2-Trifluoro-n-(5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide	LSM-33619	SID24794923, BRD-K07522305	2169404	InChI=1S/C11H8F3N3O2/c12-11(13,14)10(19)15-8-6-9(18)17(16-8)7-4-2-1-3-5-7/h1-5H,6H2,(H,15,16,19)	DYYFSIIUWVSNMG-UHFFFAOYSA-N	FC(F)(F)C(=O)NC1=NN(C(=O)C1)c2ccccc2	BroadT	BRD-K07522305	BRD-K07522305-001-06-0	ChemBridge Corporation	7688400			FC(F)(F)C(=O)NC1=NN(C(=O)C1)c1ccccc1	InChI=1S/C11H8F3N3O2/c12-11(13,14)10(19)15-8-6-9(18)17(16-8)7-4-2-1-3-5-7/h1-5H,6H2,(H,15,16,19)	DYYFSIIUWVSNMG-UHFFFAOYSA-N	271.056861126							122176
MLS-0109562.0001	LSM-33620	SID85176598, SID17412403, BRD-K39317701	1324805	InChI=1S/C21H22N2OS/c25-21(22-12-6-7-13-22)19-16-23(20-11-5-4-10-18(19)20)14-15-24-17-8-2-1-3-9-17/h1-5,8-11,16H,6-7,12-15H2	CLLDGZJVIZEVBU-UHFFFAOYSA-N	S=C(N1CCCC1)c2cn(CCOc3ccccc3)c4ccccc24	BroadT	BRD-K39317701	BRD-K39317701-001-06-7	ChemBridge Corporation	6933718			S=C(N1CCCC1)c1cn(CCOc2ccccc2)c2ccccc12	InChI=1S/C21H22N2OS/c25-21(22-12-6-7-13-22)19-16-23(20-11-5-4-10-18(19)20)14-15-24-17-8-2-1-3-9-17/h1-5,8-11,16H,6-7,12-15H2	CLLDGZJVIZEVBU-UHFFFAOYSA-N	350.145284034							122177
BAS 00903138	LSM-33621	SID17507138, BRD-K50530988	3122354	InChI=1S/C11H12N4O2/c1-7-4-3-5-9(6-7)12-11-10(15(16)17)8(2)13-14-11/h3-6H,1-2H3,(H2,12,13,14)	WTPOMZKVZLWDAL-UHFFFAOYSA-N	Cc1cccc(Nc2[nH]nc(C)c2[N+](=O)[O-])c1	BroadT	BRD-K50530988	BRD-K50530988-001-05-5	Asinex Ltd.	BAS 00903138			Cc1n[nH]c(Nc2cccc(C)c2)c1[N+]([O-])=O	InChI=1S/C11H12N4O2/c1-7-4-3-5-9(6-7)12-11-10(15(16)17)8(2)13-14-11/h3-6H,1-2H3,(H2,12,13,14)	WTPOMZKVZLWDAL-UHFFFAOYSA-N	232.096025664							122178
F5086-0077	LSM-33622	SID24797358, BRD-K38336487	3521424	InChI=1S/C14H16N4O2S/c1-18-9(6-7-16-18)13(20)17-14-11(12(15)19)8-4-2-3-5-10(8)21-14/h6-7H,2-5H2,1H3,(H2,15,19)(H,17,20)	OADBTQUFJGRQOJ-UHFFFAOYSA-N	Cn1nccc1C(=O)Nc2sc3CCCCc3c2C(=O)N	BroadT	BRD-K38336487	BRD-K38336487-001-05-0	ChemBridge Corporation	9049961			Cn1nccc1C(=O)Nc1sc2CCCCc2c1C(N)=O	InChI=1S/C14H16N4O2S/c1-18-9(6-7-16-18)13(20)17-14-11(12(15)19)8-4-2-3-5-10(8)21-14/h6-7H,2-5H2,1H3,(H2,15,19)(H,17,20)	OADBTQUFJGRQOJ-UHFFFAOYSA-N	304.099396482							122179
AC1OL1A9	LSM-15245	BRD-K27197515	7395844	InChI=1S/C19H21FN2O2S/c1-12-16-11-18(24-3)17(23-2)10-13(16)8-9-22(12)19(25)21-15-6-4-14(20)5-7-15/h4-7,10-12H,8-9H2,1-3H3,(H,21,25)/t12-/m0/s1	NXNWXRXLSFGZDX-LBPRGKRZSA-N	COc1cc2CCN([C@@H](C)c2cc1OC)C(=Nc3ccc(F)cc3)S	BroadT	BRD-K27197515	BRD-K27197515-226-04-1	InterBioScreen Ltd.	STOCK2S-69527		CCN(CC)CC	COc1cc2CCN([C@@H](C)c2cc1OC)C(S)=Nc1ccc(F)cc1.CCN(CC)CC	InChI=1S/C19H21FN2O2S.C6H15N/c1-12-16-11-18(24-3)17(23-2)10-13(16)8-9-22(12)19(25)21-15-6-4-14(20)5-7-15;1-4-7(5-2)6-3/h4-7,10-12H,8-9H2,1-3H3,(H,21,25);4-6H2,1-3H3/t12-;/m0./s1	BAFMXPQETCZAKZ-YDALLXLXSA-N	360.130776822							103892, 103892
N'-[2-(4-bromo-2-methylphenoxy)acetyl]pyrazine-2-carbohydrazide	LSM-33623	SID22400852, BRD-K42067322	1224313	InChI=1S/C14H13BrN4O3/c1-9-6-10(15)2-3-12(9)22-8-13(20)18-19-14(21)11-7-16-4-5-17-11/h2-7H,8H2,1H3,(H,18,20)(H,19,21)	DQKHSRJVWSLFKR-UHFFFAOYSA-N	Cc1cc(Br)ccc1OCC(=O)NNC(=O)c2cnccn2	BroadT	BRD-K42067322	BRD-K42067322-001-05-4	Specs	AG-670/36923013			Cc1cc(Br)ccc1OCC(=O)NNC(=O)c1cnccn1	InChI=1S/C14H13BrN4O3/c1-9-6-10(15)2-3-12(9)22-8-13(20)18-19-14(21)11-7-16-4-5-17-11/h2-7H,8H2,1H3,(H,18,20)(H,19,21)	DQKHSRJVWSLFKR-UHFFFAOYSA-N	364.017102916							122180
BRD-K16263791	LSM-33624			InChI=1S/C27H25N3O4/c1-17-5-3-6-18(13-17)11-12-28-26(32)20-9-10-22-23(15-20)30-27(33)24(29-22)16-25(31)19-7-4-8-21(14-19)34-2/h3-10,13-15H,11-12,16H2,1-2H3,(H,28,32)(H,30,33)	TZQYJYUQWGJYST-UHFFFAOYSA-N	COc1cccc(c1)C(=O)Cc2nc3ccc(cc3nc2O)C(=O)NCCc4cccc(C)c4	BroadT	BRD-K16263791	BRD-K16263791-001-05-3	ChemDiv Inc.	C301-0998			COc1cccc(c1)C(=O)Cc1nc2ccc(cc2nc1O)C(=O)NCCc1cccc(C)c1	InChI=1S/C27H25N3O4/c1-17-5-3-6-18(13-17)11-12-28-26(32)20-9-10-22-23(15-20)30-27(33)24(29-22)16-25(31)19-7-4-8-21(14-19)34-2/h3-10,13-15H,11-12,16H2,1-2H3,(H,28,32)(H,30,33)	TZQYJYUQWGJYST-UHFFFAOYSA-N	455.18450631							122181
MLS000042191	LSM-33625	SID865750, BRD-K02133023	667011	InChI=1S/C18H22N4O2/c1-20-15-6-5-13(24-2)11-14(15)16-17(20)18(23)22(12-19-16)10-9-21-7-3-4-8-21/h5-6,11-12H,3-4,7-10H2,1-2H3	MJOQUPBJAFHXSW-UHFFFAOYSA-N	COc1ccc2c(c1)c3N=CN(CCN4CCCC4)C(=O)c3n2C	BroadT	BRD-K02133023	BRD-K02133023-001-06-2	InterBioScreen Ltd.	STOCK5S-50266			COc1ccc2n(C)c3c(ncn(CCN4CCCC4)c3=O)c2c1	InChI=1S/C18H22N4O2/c1-20-15-6-5-13(24-2)11-14(15)16-17(20)18(23)22(12-19-16)10-9-21-7-3-4-8-21/h5-6,11-12H,3-4,7-10H2,1-2H3	MJOQUPBJAFHXSW-UHFFFAOYSA-N	326.174275984							122182
MLS000576747	LSM-33626	SID17414021, BRD-A98721871	2926436	InChI=1S/C24H21NO4/c1-16-11-13-18(14-12-16)22(27)23(19-7-4-3-5-8-19)29-24(28)20-9-6-10-21(15-20)25-17(2)26/h3-15,23H,1-2H3,(H,25,26)	ZSDOPGCQKBEQLO-UHFFFAOYSA-N	CC(=O)Nc1cccc(c1)C(=O)OC(C(=O)c2ccc(C)cc2)c3ccccc3	BroadT	BRD-A98721871	BRD-A98721871-001-05-6	ChemBridge Corporation	7107528			CC(=O)Nc1cccc(c1)C(=O)OC(C(=O)c1ccc(C)cc1)c1ccccc1	InChI=1S/C24H21NO4/c1-16-11-13-18(14-12-16)22(27)23(19-7-4-3-5-8-19)29-24(28)20-9-6-10-21(15-20)25-17(2)26/h3-15,23H,1-2H3,(H,25,26)	ZSDOPGCQKBEQLO-UHFFFAOYSA-N	387.147058162							122183
STK234636	LSM-33627	SID16952871, BRD-K59406024	1090056	InChI=1S/C19H14N2O5/c22-18(12-3-8-15-17(10-12)26-11-25-15)20-13-4-6-14(7-5-13)21-19(23)16-2-1-9-24-16/h1-10H,11H2,(H,20,22)(H,21,23)	MBPWVWICSKSXNP-UHFFFAOYSA-N	O=C(Nc1ccc(NC(=O)c2ccc3OCOc3c2)cc1)c4occc4	BroadT	BRD-K59406024	BRD-K59406024-001-05-5	Asinex Ltd.	BAS 07437854			O=C(Nc1ccc(NC(=O)c2ccc3OCOc3c2)cc1)c1ccco1	InChI=1S/C19H14N2O5/c22-18(12-3-8-15-17(10-12)26-11-25-15)20-13-4-6-14(7-5-13)21-19(23)16-2-1-9-24-16/h1-10H,11H2,(H,20,22)(H,21,23)	MBPWVWICSKSXNP-UHFFFAOYSA-N	350.090271568							122184
SMR000194860	LSM-33628	SID17415586, BRD-K94875429	1001148	InChI=1S/C24H23N3O3S2/c1-16-5-4-6-20(13-16)27(32(3,29)30)15-23(28)25-19-10-8-18(9-11-19)24-26-21-12-7-17(2)14-22(21)31-24/h4-14H,15H2,1-3H3,(H,25,28)	GSSAXVCDAPTSKY-UHFFFAOYSA-N	Cc1cccc(c1)N(CC(=O)Nc2ccc(cc2)c3nc4ccc(C)cc4s3)S(=O)(=O)C	BroadT	BRD-K94875429	BRD-K94875429-001-05-9	ChemBridge Corporation	6388507			Cc1cccc(c1)N(CC(=O)Nc1ccc(cc1)-c1nc2ccc(C)cc2s1)S(C)(=O)=O	InChI=1S/C24H23N3O3S2/c1-16-5-4-6-20(13-16)27(32(3,29)30)15-23(28)25-19-10-8-18(9-11-19)24-26-21-12-7-17(2)14-22(21)31-24/h4-14H,15H2,1-3H3,(H,25,28)	GSSAXVCDAPTSKY-UHFFFAOYSA-N	465.118083006							122185
MLS000564892	LSM-33629	SID14744298, BRD-K13363673	2429522	InChI=1S/C17H15N7OS/c1-11-7-8-15(12(2)9-11)24-17(19-20-22-24)26-10-23-16(25)13-5-3-4-6-14(13)18-21-23/h3-9H,10H2,1-2H3	GGGABHNGOJPZKD-UHFFFAOYSA-N	Cc1ccc(c(C)c1)n2nnnc2SCN3N=Nc4ccccc4C3=O	BroadT	BRD-K13363673	BRD-K13363673-001-06-5	Enamine Ltd.	T0512-6259			Cc1ccc(c(C)c1)-n1nnnc1SCn1nnc2ccccc2c1=O	InChI=1S/C17H15N7OS/c1-11-7-8-15(12(2)9-11)24-17(19-20-22-24)26-10-23-16(25)13-5-3-4-6-14(13)18-21-23/h3-9H,10H2,1-2H3	GGGABHNGOJPZKD-UHFFFAOYSA-N	365.10587886							122186
SMR000142596	LSM-33630	SID14736473, BRD-K78105553	2937420	InChI=1S/C20H27N7O4/c28-19(22-16-4-2-1-3-5-16)21-6-11-31-20-24-17(26-7-12-29-13-8-26)23-18(25-20)27-9-14-30-15-10-27/h1-5H,6-15H2,(H2,21,22,28)	BRQNSFXYPFYKKF-UHFFFAOYSA-N	O=C(NCCOc1nc(nc(n1)N2CCOCC2)N3CCOCC3)Nc4ccccc4	BroadT	BRD-K78105553	BRD-K78105553-001-05-9	ChemBridge Corporation	7369461			O=C(NCCOc1nc(nc(n1)N1CCOCC1)N1CCOCC1)Nc1ccccc1	InChI=1S/C20H27N7O4/c28-19(22-16-4-2-1-3-5-16)21-6-11-31-20-24-17(26-7-12-29-13-8-26)23-18(25-20)27-9-14-30-15-10-27/h1-5H,6-15H2,(H2,21,22,28)	BRQNSFXYPFYKKF-UHFFFAOYSA-N	429.212452414							122187
STK209837	LSM-33631	SID17415678, BRD-K63190417	881461	InChI=1S/C13H17BrN2O2S/c1-13(2,3)16-12(19)15-11(17)8-5-6-10(18-4)9(14)7-8/h5-7H,1-4H3,(H2,15,16,17,19)	HAKCQNFJULULCS-UHFFFAOYSA-N	COc1ccc(cc1Br)C(=O)NC(=S)NC(C)(C)C	BroadT	BRD-K63190417	BRD-K63190417-001-06-2	ChemBridge Corporation	6394551			COc1ccc(cc1Br)C(=O)NC(=S)NC(C)(C)C	InChI=1S/C13H17BrN2O2S/c1-13(2,3)16-12(19)15-11(17)8-5-6-10(18-4)9(14)7-8/h5-7H,1-4H3,(H2,15,16,17,19)	HAKCQNFJULULCS-UHFFFAOYSA-N	344.019411094							122188
Ethyl 2-{[(4-methylpiperidin-1-yl)carbonothioyl]amino}benzoate	LSM-33632	SID17510921, BRD-K04889889	12005378	InChI=1S/C16H22N2O2S/c1-3-20-15(19)13-6-4-5-7-14(13)17-16(21)18-10-8-12(2)9-11-18/h4-7,12H,3,8-11H2,1-2H3,(H,17,21)	SDYKFBXFPCPMFH-UHFFFAOYSA-N	CCOC(=O)c1ccccc1N=C(S)N2CCC(C)CC2	BroadT	BRD-K04889889	BRD-K04889889-001-05-2	ChemDiv Inc.	C200-1846			CCOC(=O)c1ccccc1N=C(S)N1CCC(C)CC1	InChI=1S/C16H22N2O2S/c1-3-20-15(19)13-6-4-5-7-14(13)17-16(21)18-10-8-12(2)9-11-18/h4-7,12H,3,8-11H2,1-2H3,(H,17,21)	SDYKFBXFPCPMFH-UHFFFAOYSA-N	306.140198654							122189
AC1MHAYF	LSM-15595	BRD-K14672694	2949082	InChI=1S/C23H32N2O3S/c1-18-5-8-20(9-6-18)29-16-15-24-11-13-25(14-12-24)17-19-7-10-21(26-2)23(28-4)22(19)27-3/h5-10H,11-17H2,1-4H3	MAXODDXKVCZCAU-UHFFFAOYSA-N	COc1ccc(CN2CCN(CCSc3ccc(C)cc3)CC2)c(OC)c1OC	BroadT	BRD-K14672694	BRD-K14672694-034-06-4	ChemBridge Corporation	7708094		OC(=O)C(=O)O	COc1ccc(CN2CCN(CCSc3ccc(C)cc3)CC2)c(OC)c1OC.OC(=O)C(=O)O	InChI=1S/C23H32N2O3S.C2H2O4/c1-18-5-8-20(9-6-18)29-16-15-24-11-13-25(14-12-24)17-19-7-10-21(26-2)23(28-4)22(19)27-3;3-1(4)2(5)6/h5-10H,11-17H2,1-4H3;(H,3,4)(H,5,6)	AVGVZLBSYSKFBI-UHFFFAOYSA-N	416.213363594							104231, 104231
AC1LIMK7	LSM-44496	SID22400627, BRD-K73470065	934111	InChI=1S/C19H14N2O5/c22-16(8-6-11-5-7-14-15(9-11)26-10-25-14)21-17-12-3-1-2-4-13(12)20-18(17)19(23)24/h1-9,20H,10H2,(H,21,22)(H,23,24)/b8-6+	JKHKOWTVDYDCFZ-SOFGYWHQSA-N	OC(=O)c1[nH]c2ccccc2c1NC(=O)\C=C\c3ccc4OCOc4c3	BroadT	BRD-K73470065	BRD-K73470065-001-05-3	InterBioScreen Ltd.	STOCK4S-06948			OC(=O)c1[nH]c2ccccc2c1NC(=O)\C=C\c1ccc2OCOc2c1	InChI=1S/C19H14N2O5/c22-16(8-6-11-5-7-14-15(9-11)26-10-25-14)21-17-12-3-1-2-4-13(12)20-18(17)19(23)24/h1-9,20H,10H2,(H,21,22)(H,23,24)/b8-6+	JKHKOWTVDYDCFZ-SOFGYWHQSA-N	350.090271568							
5-Bromo-n-(4-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide	LSM-33634	SID24836565, BRD-K62293954	2477024	InChI=1S/C10H8BrN3OS/c1-6-5-16-10(13-6)14-9(15)7-2-8(11)4-12-3-7/h2-5H,1H3,(H,13,14,15)	SXBQAQYGFHMVQW-UHFFFAOYSA-N	Cc1csc(NC(=O)c2cncc(Br)c2)n1	BroadT	BRD-K62293954	BRD-K62293954-001-05-6	Enamine Ltd.	T5313901			Cc1csc(NC(=O)c2cncc(Br)c2)n1	InChI=1S/C10H8BrN3OS/c1-6-5-16-10(13-6)14-9(15)7-2-8(11)4-12-3-7/h2-5H,1H3,(H,13,14,15)	SXBQAQYGFHMVQW-UHFFFAOYSA-N	296.957145196							122191
MLS000062867	LSM-33635	SID4263555, BRD-K62659013	725348	InChI=1S/C14H13FN2O/c15-11-6-8-13(9-7-11)17-14(18)10-16-12-4-2-1-3-5-12/h1-9,16H,10H2,(H,17,18)	VCMBBOYEMGIVFC-UHFFFAOYSA-N	Fc1ccc(NC(=O)CNc2ccccc2)cc1	BroadT	BRD-K62659013	BRD-K62659013-001-05-7	ChemBridge Corporation	7612764			Fc1ccc(NC(=O)CNc2ccccc2)cc1	InChI=1S/C14H13FN2O/c15-11-6-8-13(9-7-11)17-14(18)10-16-12-4-2-1-3-5-12/h1-9,16H,10H2,(H,17,18)	VCMBBOYEMGIVFC-UHFFFAOYSA-N	244.101191256							122192
4-(3,4-Dimethylphenyl)-5-phenyl-1,3-thiazol-2-amine	LSM-33636	SID22416381, BRD-K25785568	882224	InChI=1S/C17H16N2S/c1-11-8-9-14(10-12(11)2)15-16(20-17(18)19-15)13-6-4-3-5-7-13/h3-10H,1-2H3,(H2,18,19)	LWBBUCGSHRGUKW-UHFFFAOYSA-N	Cc1ccc(cc1C)c2nc(N)sc2c3ccccc3	BroadT	BRD-K25785568	BRD-K25785568-001-05-5	ChemBridge Corporation	6430348			Cc1ccc(cc1C)-c1nc(N)sc1-c1ccccc1	InChI=1S/C17H16N2S/c1-11-8-9-14(10-12(11)2)15-16(20-17(18)19-15)13-6-4-3-5-7-13/h3-10H,1-2H3,(H2,18,19)	LWBBUCGSHRGUKW-UHFFFAOYSA-N	280.103419222							122193
SMR000206302	LSM-44497	SID17510523, BRD-K80814897	12005240	InChI=1S/C26H23FN4O3/c27-20-8-2-1-7-19(20)17-23-26(33)31(21-9-3-4-10-22(21)34-23)18-25(32)30-15-13-29(14-16-30)24-11-5-6-12-28-24/h1-12,17H,13-16,18H2/b23-17-	OWGGRZAOGXBSTA-QJOMJCCJSA-N	Fc1ccccc1\C=C\2/Oc3ccccc3N(CC(=O)N4CCN(CC4)c5ccccn5)C2=O	BroadT	BRD-K80814897	BRD-K80814897-001-05-7	ChemDiv Inc.	C311-0494			Fc1ccccc1\C=C1/Oc2ccccc2N(CC(=O)N2CCN(CC2)c2ccccn2)C1=O	InChI=1S/C26H23FN4O3/c27-20-8-2-1-7-19(20)17-23-26(33)31(21-9-3-4-10-22(21)34-23)18-25(32)30-15-13-29(14-16-30)24-11-5-6-12-28-24/h1-12,17H,13-16,18H2/b23-17-	OWGGRZAOGXBSTA-QJOMJCCJSA-N	458.175418836							
AC1LLIXD	LSM-33638	BRD-K38546158	1085146	InChI=1S/C21H16N4O2/c1-13-14(11-22)20-24-16-7-3-5-9-18(16)25(20)21(26)15(13)12-23-17-8-4-6-10-19(17)27-2/h3-10,12,26H,1-2H3	JMZBDXCPYBTTHJ-UHFFFAOYSA-N	COc1ccccc1N=Cc2c(C)c(C#N)c3nc4ccccc4n3c2O	BroadT	BRD-K38546158	BRD-K38546158-001-06-0	Asinex Ltd.	BAS 06612623			COc1ccccc1N=Cc1c(C)c(C#N)c2nc3ccccc3n2c1O	InChI=1S/C21H16N4O2/c1-13-14(11-22)20-24-16-7-3-5-9-18(16)25(20)21(26)15(13)12-23-17-8-4-6-10-19(17)27-2/h3-10,12,26H,1-2H3	JMZBDXCPYBTTHJ-UHFFFAOYSA-N	356.127325792							
STK017405	LSM-33639	SID17504804, BRD-K78038322	1322277	InChI=1S/C24H25N3O3S2/c1-24(2,3)16-9-7-15(8-10-16)21(28)27-23(31)25-17-11-12-18(19(14-17)30-4)26-22(29)20-6-5-13-32-20/h5-14H,1-4H3,(H,26,29)(H2,25,27,28,31)	DPWSSTXIHXLAII-UHFFFAOYSA-N	COc1cc(NC(=S)NC(=O)c2ccc(cc2)C(C)(C)C)ccc1NC(=O)c3cccs3	BroadT	BRD-K78038322	BRD-K78038322-001-06-0	ChemBridge Corporation	6875565			COc1cc(NC(=S)NC(=O)c2ccc(cc2)C(C)(C)C)ccc1NC(=O)c1cccs1	InChI=1S/C24H25N3O3S2/c1-24(2,3)16-9-7-15(8-10-16)21(28)27-23(31)25-17-11-12-18(19(14-17)30-4)26-22(29)20-6-5-13-32-20/h5-14H,1-4H3,(H,26,29)(H2,25,27,28,31)	DPWSSTXIHXLAII-UHFFFAOYSA-N	467.13373307							122196
CID 16196587	LSM-15479	BRD-K01310931	16196587	InChI=1S/C54H75N17O6/c1-6-25-75-27-29-77-30-28-76-26-16-57-52-59-53(61-54(60-52)69-23-19-67(20-24-69)51(74)49(38(5)7-2)71-36-47(63-65-71)43(55)31-37(3)4)68-21-17-66(18-22-68)50(73)48(34-41-33-40-10-8-9-11-45(40)58-41)70-35-46(62-64-70)44(56)32-39-12-14-42(72)15-13-39/h1,8-15,33,35-38,43-44,48-49,58,72H,7,16-32,34,55-56H2,2-5H3,(H,57,59,60,61)/t38-,43-,44-,48-,49-/m0/s1	LYPJMAWICLVTBU-DFUAESMTSA-N	CC[C@H](C)[C@@H](C(=O)N1CCN(CC1)c2nc(NCCOCCOCCOCC#C)nc(n2)N3CCN(CC3)C(=O)[C@H](Cc4cc5ccccc5[nH]4)n6cc(nn6)[C@@H](N)Cc7ccc(O)cc7)n8cc(nn8)[C@@H](N)CC(C)C	BroadT	BRD-K01310931	BRD-K01310931-003-03-1	Texas A&M University	YW-LI KB-CD241		Cl	CC[C@H](C)[C@@H](C(=O)N1CCN(CC1)c1nc(NCCOCCOCCOCC#C)nc(n1)N1CCN(CC1)C(=O)[C@H](Cc1cc2ccccc2[nH]1)n1cc(nn1)[C@@H](N)Cc1ccc(O)cc1)n1cc(nn1)[C@@H](N)CC(C)C.Cl	InChI=1S/C54H75N17O6.ClH/c1-6-25-75-27-29-77-30-28-76-26-16-57-52-59-53(61-54(60-52)69-23-19-67(20-24-69)51(74)49(38(5)7-2)71-36-47(63-65-71)43(55)31-37(3)4)68-21-17-66(18-22-68)50(73)48(34-41-33-40-10-8-9-11-45(40)58-41)70-35-46(62-64-70)44(56)32-39-12-14-42(72)15-13-39;/h1,8-15,33,35-38,43-44,48-49,58,72H,7,16-32,34,55-56H2,2-5H3,(H,57,59,60,61);1H/t38-,43-,44-,48-,49-;/m0./s1	OOTHMRXVWCLDOU-KFCCXFQQSA-N	1057.60862329							104122
MLS000058645	LSM-33640	SID3711491, BRD-K44235073	2114383	InChI=1S/C11H13N3S2/c1-8(2)15-11-14-13-10(16-11)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H,12,13)	AVTAZXQGCNSUPN-UHFFFAOYSA-N	CC(C)Sc1nnc(Nc2ccccc2)s1	BroadT	BRD-K44235073	BRD-K44235073-001-05-6	Enamine Ltd.	T5243461			CC(C)Sc1nnc(Nc2ccccc2)s1	InChI=1S/C11H13N3S2/c1-8(2)15-11-14-13-10(16-11)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H,12,13)	AVTAZXQGCNSUPN-UHFFFAOYSA-N	251.055088826							122197
STK172182	LSM-44498	SID24796432, BRD-K78142829	2186757	InChI=1S/C24H25N3O5/c1-3-32-20-8-6-18(7-9-20)27-23(29)21(22(28)25-24(27)30)15-17-4-5-19(14-16(17)2)26-10-12-31-13-11-26/h4-9,14-15H,3,10-13H2,1-2H3,(H,25,28,30)/b21-15+	NQZVDBLCAOLRGZ-RCCKNPSSSA-N	CCOc1ccc(cc1)N2C(=O)NC(=O)\C(=C/c3ccc(cc3C)N4CCOCC4)\C2=O	BroadT	BRD-K78142829	BRD-K78142829-001-05-0	ChemBridge Corporation	7379393			CCOc1ccc(cc1)N1C(=O)NC(=O)\C(=C/c2ccc(cc2C)N2CCOCC2)C1=O	InChI=1S/C24H25N3O5/c1-3-32-20-8-6-18(7-9-20)27-23(29)21(22(28)25-24(27)30)15-17-4-5-19(14-16(17)2)26-10-12-31-13-11-26/h4-9,14-15H,3,10-13H2,1-2H3,(H,25,28,30)/b21-15+	NQZVDBLCAOLRGZ-RCCKNPSSSA-N	435.17942093							
SMR000069664	LSM-33642	SID4258213, BRD-K39953583	783344	InChI=1S/C16H18FNO/c17-16-8-4-7-15(11-16)13-18(9-10-19)12-14-5-2-1-3-6-14/h1-8,11,19H,9-10,12-13H2	VLXQNFHVIMKNHX-UHFFFAOYSA-N	OCCN(Cc1ccccc1)Cc2cccc(F)c2	BroadT	BRD-K39953583	BRD-K39953583-001-05-4	ChemBridge Corporation	5429134			OCCN(Cc1ccccc1)Cc1cccc(F)c1	InChI=1S/C16H18FNO/c17-16-8-4-7-15(11-16)13-18(9-10-19)12-14-5-2-1-3-6-14/h1-8,11,19H,9-10,12-13H2	VLXQNFHVIMKNHX-UHFFFAOYSA-N	259.137242406							122199
ZINC03554469	LSM-44499	SID22406874, BRD-K27799165	2671703	InChI=1S/C15H14BrNO2/c1-11-2-4-12(5-3-11)10-17-15(18)9-7-13-6-8-14(16)19-13/h2-9H,10H2,1H3,(H,17,18)/b9-7+	MXCPSRWEMZBKLR-VQHVLOKHSA-N	Cc1ccc(CNC(=O)\C=C\c2oc(Br)cc2)cc1	BroadT	BRD-K27799165	BRD-K27799165-001-06-9	Enamine Ltd.	ZT-1989135			Cc1ccc(CNC(=O)\C=C\c2ccc(Br)o2)cc1	InChI=1S/C15H14BrNO2/c1-11-2-4-12(5-3-11)10-17-15(18)9-7-13-6-8-14(16)19-13/h2-9H,10H2,1H3,(H,17,18)/b9-7+	MXCPSRWEMZBKLR-VQHVLOKHSA-N	319.020791298							
SMR000044789	LSM-33644	SID862607, BRD-K86410548	663841	InChI=1S/C21H18ClN3O3/c22-17-5-1-15(2-6-17)14-27-18-7-3-16(4-8-18)20-24-19(13-23)21(28-20)25-9-11-26-12-10-25/h1-8H,9-12,14H2	ACLJMBVYCCDWSD-UHFFFAOYSA-N	Clc1ccc(COc2ccc(cc2)c3oc(N4CCOCC4)c(n3)C#N)cc1	BroadT	BRD-K86410548	BRD-K86410548-001-05-1	InterBioScreen Ltd.	STOCK4S-51935			Clc1ccc(COc2ccc(cc2)-c2nc(C#N)c(o2)N2CCOCC2)cc1	InChI=1S/C21H18ClN3O3/c22-17-5-1-15(2-6-17)14-27-18-7-3-16(4-8-18)20-24-19(13-23)21(28-20)25-9-11-26-12-10-25/h1-8H,9-12,14H2	ACLJMBVYCCDWSD-UHFFFAOYSA-N	395.103669176							122201
MLS000583272	LSM-33645	SID17506792, BRD-K07871530	979809	InChI=1S/C20H18ClFN2O3S/c21-16-3-10-20(27-13-14-1-4-17(22)5-2-14)15(11-16)12-24-18-6-8-19(9-7-18)28(23,25)26/h1-11,24H,12-13H2,(H2,23,25,26)	XBTZIZHOWTUCKT-UHFFFAOYSA-N	NS(=O)(=O)c1ccc(NCc2cc(Cl)ccc2OCc3ccc(F)cc3)cc1	BroadT	BRD-K07871530	BRD-K07871530-001-05-0	ChemBridge Corporation	7950118			NS(=O)(=O)c1ccc(NCc2cc(Cl)ccc2OCc2ccc(F)cc2)cc1	InChI=1S/C20H18ClFN2O3S/c21-16-3-10-20(27-13-14-1-4-17(22)5-2-14)15(11-16)12-24-18-6-8-19(9-7-18)28(23,25)26/h1-11,24H,12-13H2,(H2,23,25,26)	XBTZIZHOWTUCKT-UHFFFAOYSA-N	420.071069056							122202
BAS 00865699	LSM-33646	SID849007, BRD-A81431990	651473	InChI=1S/C18H22N2O2S/c1-2-3-4-5-10-23-18-16(12-19)15(11-17(22)20-18)13-6-8-14(21)9-7-13/h6-9,15,21H,2-5,10-11H2,1H3,(H,20,22)	HYBLKCYMQMUZPK-UHFFFAOYSA-N	CCCCCCSC1=C(C#N)C(CC(=O)N1)c2ccc(O)cc2	BroadT	BRD-A81431990	BRD-A81431990-001-05-7	Asinex Ltd.	BAS 00865699			CCCCCCSC1=C(C#N)C(CC(=O)N1)c1ccc(O)cc1	InChI=1S/C18H22N2O2S/c1-2-3-4-5-10-23-18-16(12-19)15(11-17(22)20-18)13-6-8-14(21)9-7-13/h6-9,15,21H,2-5,10-11H2,1H3,(H,20,22)	HYBLKCYMQMUZPK-UHFFFAOYSA-N	330.140198654							122203
AC1LZFA4	LSM-33647	BRD-K83457177	1920565	InChI=1S/C28H25N3O4/c1-19-16-22(20(2)31(19)25-15-9-10-21(17-25)26(32)33)18-29-30-27(34)28(35,23-11-5-3-6-12-23)24-13-7-4-8-14-24/h3-18,35H,1-2H3,(H,30,34)(H,32,33)	HAULLHNCCZHJRI-UHFFFAOYSA-N	Cc1cc(C=NNC(=O)C(O)(c2ccccc2)c3ccccc3)c(C)n1c4cccc(c4)C(=O)O	BroadT	BRD-K83457177	BRD-K83457177-001-05-3	InterBioScreen Ltd.	STOCK2S-44349			Cc1cc(C=NNC(=O)C(O)(c2ccccc2)c2ccccc2)c(C)n1-c1cccc(c1)C(O)=O	InChI=1S/C28H25N3O4/c1-19-16-22(20(2)31(19)25-15-9-10-21(17-25)26(32)33)18-29-30-27(34)28(35,23-11-5-3-6-12-23)24-13-7-4-8-14-24/h3-18,35H,1-2H3,(H,30,34)(H,32,33)	HAULLHNCCZHJRI-UHFFFAOYSA-N	467.18450631							122204
AC1OB8CT	LSM-33648	BRD-A62642633	6816785	InChI=1S/C19H18BrN3O3/c20-16-6-7-17(24)14(8-16)10-21-22-18(25)12-23-11-15(9-19(23)26)13-4-2-1-3-5-13/h1-8,10,15,24H,9,11-12H2,(H,22,25)	LSBJKQQJFCXWKZ-UHFFFAOYSA-N	Oc1ccc(Br)cc1C=NNC(=O)CN2CC(CC2=O)c3ccccc3	BroadT	BRD-A62642633	BRD-A62642633-001-05-5	ChemDiv Inc.	4074-0117			Oc1ccc(Br)cc1C=NNC(=O)CN1CC(CC1=O)c1ccccc1	InChI=1S/C19H18BrN3O3/c20-16-6-7-17(24)14(8-16)10-21-22-18(25)12-23-11-15(9-19(23)26)13-4-2-1-3-5-13/h1-8,10,15,24H,9,11-12H2,(H,22,25)	LSBJKQQJFCXWKZ-UHFFFAOYSA-N	415.053154066							
ST50934564	LSM-44500	SID22416335, BRD-K25485767	898768	InChI=1S/C14H14N2O4S/c1-8-4-5-10(20-8)6-7-11(17)16-14-15-9(2)12(21-14)13(18)19-3/h4-7H,1-3H3,(H,15,16,17)/b7-6+	BNCXYFFLKDHSRU-VOTSOKGWSA-N	COC(=O)c1sc(NC(=O)\C=C\c2oc(C)cc2)nc1C	BroadT	BRD-K25485767	BRD-K25485767-001-05-1	ChemBridge Corporation	7286820			COC(=O)c1sc(NC(=O)\C=C\c2ccc(C)o2)nc1C	InChI=1S/C14H14N2O4S/c1-8-4-5-10(20-8)6-7-11(17)16-14-15-9(2)12(21-14)13(18)19-3/h4-7H,1-3H3,(H,15,16,17)/b7-6+	BNCXYFFLKDHSRU-VOTSOKGWSA-N	306.067427638							
AC1N2GXQ	LSM-33650	BRD-K74188571	4046565	InChI=1S/C19H22N2O/c1-14(2)13-18(16-7-5-4-6-8-16)20-21-19(22)17-11-9-15(3)10-12-17/h4-12,14H,13H2,1-3H3,(H,21,22)	YLMSDVHSLHREPW-UHFFFAOYSA-N	CC(C)CC(=NNC(=O)c1ccc(C)cc1)c2ccccc2	BroadT	BRD-K74188571	BRD-K74188571-001-05-7	Specs	AK-968/40710080			CC(C)CC(=NNC(=O)c1ccc(C)cc1)c1ccccc1	InChI=1S/C19H22N2O/c1-14(2)13-18(16-7-5-4-6-8-16)20-21-19(22)17-11-9-15(3)10-12-17/h4-12,14H,13H2,1-3H3,(H,21,22)	YLMSDVHSLHREPW-UHFFFAOYSA-N	294.173213344							122207
T0507-6772	LSM-33651	SID16952912, BRD-K20503111	5190103	InChI=1S/C16H21ClF3N3/c1-15(2,3)10-4-6-12(7-5-10)22-23-14-13(17)8-11(9-21-14)16(18,19)20/h8-10H,4-7H2,1-3H3,(H,21,23)	VIZPMAQETIKTJR-UHFFFAOYSA-N	CC(C)(C)C1CCC(=NNc2ncc(cc2Cl)C(F)(F)F)CC1	BroadT	BRD-K20503111	BRD-K20503111-001-05-9	Enamine Ltd.	T0507-6772			CC(C)(C)C1CCC(CC1)=NNc1ncc(cc1Cl)C(F)(F)F	InChI=1S/C16H21ClF3N3/c1-15(2,3)10-4-6-12(7-5-10)22-23-14-13(17)8-11(9-21-14)16(18,19)20/h8-10H,4-7H2,1-3H3,(H,21,23)	VIZPMAQETIKTJR-UHFFFAOYSA-N	347.137610012							
MLS000521603	LSM-33652	SID14732959, BRD-K04769898	3508287	InChI=1S/C20H20N4O4S/c1-2-18-22-23-20(28-18)21-19(25)15-9-11-16(12-10-15)29(26,27)24-13-5-7-14-6-3-4-8-17(14)24/h3-4,6,8-12H,2,5,7,13H2,1H3,(H,21,23,25)	HWIAAGPFXHCQJS-UHFFFAOYSA-N	CCc1oc(NC(=O)c2ccc(cc2)S(=O)(=O)N3CCCc4ccccc34)nn1	BroadT	BRD-K04769898	BRD-K04769898-001-07-1	ChemDiv Inc.	C079-0387			CCc1nnc(NC(=O)c2ccc(cc2)S(=O)(=O)N2CCCc3ccccc23)o1	InChI=1S/C20H20N4O4S/c1-2-18-22-23-20(28-18)21-19(25)15-9-11-16(12-10-15)29(26,27)24-13-5-7-14-6-3-4-8-17(14)24/h3-4,6,8-12H,2,5,7,13H2,1H3,(H,21,23,25)	HWIAAGPFXHCQJS-UHFFFAOYSA-N	412.12052585							122209
BRD-K77608736	LSM-13171		54637757	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-41-28(20)17-36(3)30(40)35-27-15-9-8-14-26(27)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21+,28-/m0/s1	AAENOGRDWGDRJO-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K77608736	BRD-K77608736-001-01-2	Broad Institute of MIT and Harvard	BRD-K77608736			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-41-28(20)17-36(3)30(40)35-27-15-9-8-14-26(27)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21+,28-/m0/s1	AAENOGRDWGDRJO-GTNJKRJXSA-N	569.250141198							101809
BRD-K51643793	LSM-11588		54637670	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30-,33+/m0/s1	ZXKFKEACMTVYCV-HWQLMJRHSA-N	CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K51643793	BRD-K51643793-001-01-9	Broad Institute of MIT and Harvard	BRD-K51643793			CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30-,33+/m0/s1	ZXKFKEACMTVYCV-HWQLMJRHSA-N	583.304621442							100211
BRD-K04086909	LSM-8681		56835462	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32-,33+/m0/s1	UJZHWGMAKJZUOC-GIFYEKKPSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K04086909	BRD-K04086909-001-01-0	Broad Institute of MIT and Harvard	BRD-K04086909			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32-,33+/m0/s1	UJZHWGMAKJZUOC-GIFYEKKPSA-N	610.351905992							97302
BRD-K11556486	LSM-9132		54637792	InChI=1S/C25H31F3N2O5S/c1-17-12-30(18(2)14-31)24(32)22-11-7-6-10-21(22)20-9-5-4-8-19(20)15-35-23(17)13-29(3)36(33,34)16-25(26,27)28/h4-11,17-18,23,31H,12-16H2,1-3H3/t17-,18-,23-/m0/s1	YLVWKLWKMUPGPR-BSRJHKFKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K11556486	BRD-K11556486-001-01-4	Broad Institute of MIT and Harvard	BRD-K11556486			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C25H31F3N2O5S/c1-17-12-30(18(2)14-31)24(32)22-11-7-6-10-21(22)20-9-5-4-8-19(20)15-35-23(17)13-29(3)36(33,34)16-25(26,27)28/h4-11,17-18,23,31H,12-16H2,1-3H3/t17-,18-,23-/m0/s1	YLVWKLWKMUPGPR-BSRJHKFKSA-N	528.190577402							97753
BRD-K40997335	LSM-10923		54637675	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23-,29-/m0/s1	INXMEFHWZGRULI-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K40997335	BRD-K40997335-001-01-8	Broad Institute of MIT and Harvard	BRD-K40997335			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23-,29-/m0/s1	INXMEFHWZGRULI-BOSRLCDASA-N	560.336255928							99544
BRD-K80391949	LSM-13340		54637746	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29+/m0/s1	RWOMJVAVZPFCIF-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K80391949	BRD-K80391949-001-01-3	Broad Institute of MIT and Harvard	BRD-K80391949			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29+/m0/s1	RWOMJVAVZPFCIF-IHMCZWCLSA-N	547.214091876							101979
BRD-K60841303	LSM-12111		54637758	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-41-28(20)17-36(3)30(40)35-27-15-9-8-14-26(27)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21+,28-/m1/s1	AAENOGRDWGDRJO-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K60841303	BRD-K60841303-001-01-1	Broad Institute of MIT and Harvard	BRD-K60841303			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-41-28(20)17-36(3)30(40)35-27-15-9-8-14-26(27)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21+,28-/m1/s1	AAENOGRDWGDRJO-PHVLTXCSSA-N	569.250141198							100737
BRD-K78542975	LSM-13230		54637721	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21+,28-/m0/s1	VUGFGKFGZUURHO-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K78542975	BRD-K78542975-001-01-2	Broad Institute of MIT and Harvard	BRD-K78542975			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21+,28-/m0/s1	VUGFGKFGZUURHO-GTNJKRJXSA-N	590.206227466							101869
BRD-K11901207	LSM-9150		56835395	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27-,28+/m1/s1	QNPXTRYBNJAKIP-ONUYUPGPSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K11901207	BRD-K11901207-001-01-0	Broad Institute of MIT and Harvard	BRD-K11901207			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27-,28+/m1/s1	QNPXTRYBNJAKIP-ONUYUPGPSA-N	546.320605864							97771
CHEMBL2355437	LSM-33653	SID131434027, BRD-K91306567	54637751	InChI=1S/C33H41N3O4/c1-23-18-36(24(2)21-37)33(38)29-12-8-7-11-28(29)27-10-6-5-9-26(27)22-40-32(23)20-34(3)19-25-13-14-30-31(17-25)39-16-15-35(30)4/h5-14,17,23-24,32,37H,15-16,18-22H2,1-4H3/t23-,24+,32-/m1/s1	LYDBHCHWWOEKQE-MKVNITDJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K91306567	BRD-K91306567-001-01-9	Broad Institute of MIT and Harvard	BRD-K91306567			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H41N3O4/c1-23-18-36(24(2)21-37)33(38)29-12-8-7-11-28(29)27-10-6-5-9-26(27)22-40-32(23)20-34(3)19-25-13-14-30-31(17-25)39-16-15-35(30)4/h5-14,17,23-24,32,37H,15-16,18-22H2,1-4H3/t23-,24+,32-/m1/s1	LYDBHCHWWOEKQE-MKVNITDJSA-N	543.309706822							122210
BRD-K57552506	LSM-11912		54637707	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20+,25-/m1/s1	RDYUFLZMPZQAJV-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K57552506	BRD-K57552506-001-01-4	Broad Institute of MIT and Harvard	BRD-K57552506			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20+,25-/m1/s1	RDYUFLZMPZQAJV-OHUGHZGNSA-N	559.265791262							100538
BRD-K35386853-001-01-3	LSM-33654	BRD-K35386853	54637737	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19+,24-/m1/s1	WKBGSUAXJVLQSN-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K35386853	BRD-K35386853-001-01-3	Broad Institute of MIT and Harvard	BRD-K35386853			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19+,24-/m1/s1	WKBGSUAXJVLQSN-YDIMBITNSA-N	449.26784201							122211
CHEMBL2355867	LSM-13395	BRD-K81332205, SID131434104	54637827	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30-/m1/s1	ZFRPCBGONKGXGW-IQLGONJTSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K81332205	BRD-K81332205-001-01-5	Broad Institute of MIT and Harvard	BRD-K81332205			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30-/m1/s1	ZFRPCBGONKGXGW-IQLGONJTSA-N	605.255956688							102035
BRD-K88866336	LSM-13890		56835362	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20+,25+/m0/s1	RDYUFLZMPZQAJV-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K88866336	BRD-K88866336-001-01-7	Broad Institute of MIT and Harvard	BRD-K88866336			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20+,25+/m0/s1	RDYUFLZMPZQAJV-WZOHSFFVSA-N	559.265791262							102543
BRD-K17139610	LSM-9464		54637648	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(27-14-8-9-15-28(27)36(32)4)26-13-7-5-12-25(26)21-42-29(22)19-35(3)43(40,41)30-16-10-6-11-24(30)17-34/h5-16,22-23,29,38H,18-21H2,1-4H3/t22-,23-,29-/m0/s1	VOTKEIORIBNPMA-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K17139610	BRD-K17139610-001-01-2	Broad Institute of MIT and Harvard	BRD-K17139610			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(27-14-8-9-15-28(27)36(32)4)26-13-7-5-12-25(26)21-42-29(22)19-35(3)43(40,41)30-16-10-6-11-24(30)17-34/h5-16,22-23,29,38H,18-21H2,1-4H3/t22-,23-,29-/m0/s1	VOTKEIORIBNPMA-BOSRLCDASA-N	600.240640982							98085
BRD-K02112931	LSM-8562		54637767	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20-,25+/m0/s1	JSYMGQYFJZOBEJ-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K02112931	BRD-K02112931-001-01-8	Broad Institute of MIT and Harvard	BRD-K02112931			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20-,25+/m0/s1	JSYMGQYFJZOBEJ-ZYLNGJIFSA-N	526.224990918							97183
BRD-K53285126	LSM-11678		54637703	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32+,33-/m0/s1	UJZHWGMAKJZUOC-HUUCPIIISA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K53285126	BRD-K53285126-001-01-5	Broad Institute of MIT and Harvard	BRD-K53285126			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32+,33-/m0/s1	UJZHWGMAKJZUOC-HUUCPIIISA-N	610.351905992							100303
BRD-K95718241	LSM-14298		56835299	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19+,24+/m1/s1	WKBGSUAXJVLQSN-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K95718241	BRD-K95718241-001-01-5	Broad Institute of MIT and Harvard	BRD-K95718241			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19+,24+/m1/s1	WKBGSUAXJVLQSN-IMWIBFENSA-N	449.26784201							102952
BRD-K26425257	LSM-10028		54637759	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-41-28(20)17-36(3)30(40)35-27-15-9-8-14-26(27)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28-/m1/s1	AAENOGRDWGDRJO-UMQWNRPGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K26425257	BRD-K26425257-001-01-2	Broad Institute of MIT and Harvard	BRD-K26425257			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-41-28(20)17-36(3)30(40)35-27-15-9-8-14-26(27)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28-/m1/s1	AAENOGRDWGDRJO-UMQWNRPGSA-N	569.250141198							98649
BRD-K81415316	LSM-13399		56835514	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27+,28+/m0/s1	QNPXTRYBNJAKIP-SHRQFBHGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K81415316	BRD-K81415316-001-01-4	Broad Institute of MIT and Harvard	BRD-K81415316			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27+,28+/m0/s1	QNPXTRYBNJAKIP-SHRQFBHGSA-N	546.320605864							102039
BRD-K60477859	LSM-12085		56835298	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24+,30+,33+/m1/s1	ZXKFKEACMTVYCV-LPUCVJQBSA-N	CO[C@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K60477859	BRD-K60477859-001-01-2	Broad Institute of MIT and Harvard	BRD-K60477859			CO[C@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24+,30+,33+/m1/s1	ZXKFKEACMTVYCV-LPUCVJQBSA-N	583.304621442							100711
BRD-K06892639	LSM-8838		54637669	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24+,30-,33+/m1/s1	ZXKFKEACMTVYCV-NZYBDOMISA-N	CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K06892639	BRD-K06892639-001-01-6	Broad Institute of MIT and Harvard	BRD-K06892639			CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24+,30-,33+/m1/s1	ZXKFKEACMTVYCV-NZYBDOMISA-N	583.304621442							97459
BRD-K58194762	LSM-11942		56835517	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29+/m1/s1	WYYHNXRAZIWUBG-QLVXXPONSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO)c1	BroadT	BRD-K58194762	BRD-K58194762-001-01-3	Broad Institute of MIT and Harvard	BRD-K58194762			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@H](C)CO)c1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29+/m1/s1	WYYHNXRAZIWUBG-QLVXXPONSA-N	531.273321314							100568
BRD-K50347701	LSM-11494		54637676	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23-,29-/m1/s1	INXMEFHWZGRULI-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K50347701	BRD-K50347701-001-01-9	Broad Institute of MIT and Harvard	BRD-K50347701			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23-,29-/m1/s1	INXMEFHWZGRULI-VDWGHMIBSA-N	560.336255928							100115
BRD-K66877406	LSM-12504		54637783	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31-,32-/m1/s1	ZQFGNRPCSITOFH-JAORTXGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K66877406	BRD-K66877406-001-01-5	Broad Institute of MIT and Harvard	BRD-K66877406			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31-,32-/m1/s1	ZQFGNRPCSITOFH-JAORTXGNSA-N	557.325356886							101135
BRD-K97481912	LSM-14420		56835263	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20-,25-/m0/s1	YEGLVGBFCXLPBD-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K97481912	BRD-K97481912-001-01-6	Broad Institute of MIT and Harvard	BRD-K97481912			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20-,25-/m0/s1	YEGLVGBFCXLPBD-RLSLOFABSA-N	528.175263524							103075
BRD-K33116513	LSM-10444		54637730	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m1/s1	ONXKQUJAHGZTDG-IEOSBIPESA-N	COc1ccccc1NC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K33116513	BRD-K33116513-001-01-8	Broad Institute of MIT and Harvard	BRD-K33116513			COc1ccccc1NC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m1/s1	ONXKQUJAHGZTDG-IEOSBIPESA-N	531.273321314							99065
BRD-K73942053	LSM-14919		54637747	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29-/m0/s1	RWOMJVAVZPFCIF-KERYWQKISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K73942053	BRD-K73942053-001-01-4	Broad Institute of MIT and Harvard	BRD-K73942053			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29-/m0/s1	RWOMJVAVZPFCIF-KERYWQKISA-N	547.214091876							103575
BRD-K58719691	LSM-11976		54637705	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32-,33-/m1/s1	UJZHWGMAKJZUOC-GRAPSOOXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K58719691	BRD-K58719691-001-01-3	Broad Institute of MIT and Harvard	BRD-K58719691			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32-,33-/m1/s1	UJZHWGMAKJZUOC-GRAPSOOXSA-N	610.351905992							100602
BRD-K05519665	LSM-8753		54637654	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29-/m1/s1	WYYHNXRAZIWUBG-UETOGOEVSA-N	COc1cccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K05519665	BRD-K05519665-001-01-3	Broad Institute of MIT and Harvard	BRD-K05519665			COc1cccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)c1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29-/m1/s1	WYYHNXRAZIWUBG-UETOGOEVSA-N	531.273321314							97374
CHEMBL2355244	LSM-11778	SID131433992, BRD-K55293774	54637716	InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23+,30+/m0/s1	BRMWAKMKOMKLLH-DDFCPOBKSA-N	COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K55293774	BRD-K55293774-001-01-2	Broad Institute of MIT and Harvard	BRD-K55293774			COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23+,30+/m0/s1	BRMWAKMKOMKLLH-DDFCPOBKSA-N	545.288971378							100403
BRD-K09426613	LSM-9000		56835478	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19+,26+/m1/s1	KKDNYDXSJAWXCE-MVYHEMRASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K09426613	BRD-K09426613-001-01-0	Broad Institute of MIT and Harvard	BRD-K09426613			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19+,26+/m1/s1	KKDNYDXSJAWXCE-MVYHEMRASA-N	505.25767125							97621
BRD-K88318034	LSM-13855		54637661	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29-/m1/s1	RPGWXCDGQSLPTH-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K88318034	BRD-K88318034-001-01-4	Broad Institute of MIT and Harvard	BRD-K88318034			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29-/m1/s1	RPGWXCDGQSLPTH-RLPNJSHFSA-N	526.294391116							102506
BRD-K81799166	LSM-13423		54637791	InChI=1S/C25H31F3N2O5S/c1-17-12-30(18(2)14-31)24(32)22-11-7-6-10-21(22)20-9-5-4-8-19(20)15-35-23(17)13-29(3)36(33,34)16-25(26,27)28/h4-11,17-18,23,31H,12-16H2,1-3H3/t17-,18-,23-/m1/s1	YLVWKLWKMUPGPR-PMAPCBKXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K81799166	BRD-K81799166-001-01-2	Broad Institute of MIT and Harvard	BRD-K81799166			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C25H31F3N2O5S/c1-17-12-30(18(2)14-31)24(32)22-11-7-6-10-21(22)20-9-5-4-8-19(20)15-35-23(17)13-29(3)36(33,34)16-25(26,27)28/h4-11,17-18,23,31H,12-16H2,1-3H3/t17-,18-,23-/m1/s1	YLVWKLWKMUPGPR-PMAPCBKXSA-N	528.190577402							102063
CHEMBL2360805	LSM-9957	BRD-K25148849, SID134962038	56835304	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22+,30+/m1/s1	KFLLAZWDLYDTFJ-DGIFUFQNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5c(C1=O)n(C)c6ccccc56	BroadT	BRD-K25148849	BRD-K25148849-001-01-6	Broad Institute of MIT and Harvard	BRD-K25148849			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22+,30+/m1/s1	KFLLAZWDLYDTFJ-DGIFUFQNSA-N	598.279134976							98578
BRD-K86171512	LSM-13708		56835225	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26-,27+/m1/s1	PIMBJQHAALXIRA-VCKVZLKQSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K86171512	BRD-K86171512-001-01-0	Broad Institute of MIT and Harvard	BRD-K86171512			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26-,27+/m1/s1	PIMBJQHAALXIRA-VCKVZLKQSA-N	493.294056758							102356
BRD-K40907206	LSM-10919		56835458	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20-,25+/m1/s1	JSYMGQYFJZOBEJ-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K40907206	BRD-K40907206-001-01-3	Broad Institute of MIT and Harvard	BRD-K40907206			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20-,25+/m1/s1	JSYMGQYFJZOBEJ-FHAGJXEFSA-N	526.224990918							99540
BRD-K49567165	LSM-11441		54637752	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22+,29+/m0/s1	FTPUTVYFFNSJIR-DKGMKSHISA-N	COc1ccc(OC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K49567165	BRD-K49567165-001-01-5	Broad Institute of MIT and Harvard	BRD-K49567165			COc1ccc(OC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22+,29+/m0/s1	FTPUTVYFFNSJIR-DKGMKSHISA-N	532.257336892							100062
BRD-K04570341	LSM-8705		54637644	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23+,29-,30+/m1/s1	DVGPQCDULGSEFB-SSCOXSIPSA-N	CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO)c4ccccc4	BroadT	BRD-K04570341	BRD-K04570341-001-01-9	Broad Institute of MIT and Harvard	BRD-K04570341			CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23+,29-,30+/m1/s1	DVGPQCDULGSEFB-SSCOXSIPSA-N	530.278072336							97326
BRD-K05448102	LSM-8750		56835394	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20-,27+/m0/s1	WBCPGODJHKXDGU-OWOAZTCBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K05448102	BRD-K05448102-001-01-6	Broad Institute of MIT and Harvard	BRD-K05448102			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20-,27+/m0/s1	WBCPGODJHKXDGU-OWOAZTCBSA-N	573.295119398							97371
BRD-K29385065	LSM-10210		54637813	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23+,24-,30-/m1/s1	VBARFQGDBKSOKL-UTSVKBTJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K29385065	BRD-K29385065-001-01-7	Broad Institute of MIT and Harvard	BRD-K29385065			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23+,24-,30-/m1/s1	VBARFQGDBKSOKL-UTSVKBTJSA-N	529.294056758							98831
BRD-K84104483	LSM-13570		54637646	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29-,30+/m1/s1	DVGPQCDULGSEFB-ALIATHRISA-N	CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO)c4ccccc4	BroadT	BRD-K84104483	BRD-K84104483-001-01-8	Broad Institute of MIT and Harvard	BRD-K84104483			CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29-,30+/m1/s1	DVGPQCDULGSEFB-ALIATHRISA-N	530.278072336							102212
BRD-K18537363-001-01-5	LSM-33655	BRD-K18537363	54637736	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24+/m1/s1	WKBGSUAXJVLQSN-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K18537363	BRD-K18537363-001-01-5	Broad Institute of MIT and Harvard	BRD-K18537363			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24+/m1/s1	WKBGSUAXJVLQSN-IECBHUPTSA-N	449.26784201							122212
BRD-K53621751	LSM-11693		54637734	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22-,30-/m0/s1	KFLLAZWDLYDTFJ-PWWNZBMUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5c(C1=O)n(C)c6ccccc56	BroadT	BRD-K53621751	BRD-K53621751-001-01-3	Broad Institute of MIT and Harvard	BRD-K53621751			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22-,30-/m0/s1	KFLLAZWDLYDTFJ-PWWNZBMUSA-N	598.279134976							100318
BRD-K57659231	LSM-11919		56835369	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30+/m0/s1	ZFRPCBGONKGXGW-ZTNZZFSWSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K57659231	BRD-K57659231-001-01-9	Broad Institute of MIT and Harvard	BRD-K57659231			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30+/m0/s1	ZFRPCBGONKGXGW-ZTNZZFSWSA-N	605.255956688							100545
BRD-K25560306	LSM-9981		56835445	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25-,31+,32-/m0/s1	ZQFGNRPCSITOFH-UVBHQQKPSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K25560306	BRD-K25560306-001-01-8	Broad Institute of MIT and Harvard	BRD-K25560306			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25-,31+,32-/m0/s1	ZQFGNRPCSITOFH-UVBHQQKPSA-N	557.325356886							98602
BRD-K95284932	LSM-14269		54637796	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23+,31-/m0/s1	NTGYADANNGAILP-LWPQGVMLSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45)c(OC)c1	BroadT	BRD-K95284932	BRD-K95284932-001-01-2	Broad Institute of MIT and Harvard	BRD-K95284932			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c2ccccc32)c(OC)c1	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23+,31-/m0/s1	NTGYADANNGAILP-LWPQGVMLSA-N	614.310435104							102923
BRD-K11468634	LSM-9128		54637674	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23+,29-/m1/s1	INXMEFHWZGRULI-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K11468634	BRD-K11468634-001-01-3	Broad Institute of MIT and Harvard	BRD-K11468634			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23+,29-/m1/s1	INXMEFHWZGRULI-RLPNJSHFSA-N	560.336255928							97749
CHEMBL2359567	LSM-11855	BRD-K56712828, SID131434084	54637807	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21+,29-/m1/s1	APWUXYFXBMGRIO-HNMNOHOESA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K56712828	BRD-K56712828-001-01-6	Broad Institute of MIT and Harvard	BRD-K56712828			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21+,29-/m1/s1	APWUXYFXBMGRIO-HNMNOHOESA-N	545.25258587							100481
BRD-K42696220	LSM-11020		56835220	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29+,30+/m1/s1	DVGPQCDULGSEFB-RXSSUGHMSA-N	CO[C@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO)c4ccccc4	BroadT	BRD-K42696220	BRD-K42696220-001-01-2	Broad Institute of MIT and Harvard	BRD-K42696220			CO[C@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29+,30+/m1/s1	DVGPQCDULGSEFB-RXSSUGHMSA-N	530.278072336							99641
BRD-K11171096	LSM-9112		54637761	InChI=1S/C23H30N2O3/c1-16-13-25(17(2)14-26)23(27)21-11-7-6-10-20(21)19-9-5-4-8-18(19)15-28-22(16)12-24-3/h4-11,16-17,22,24,26H,12-15H2,1-3H3/t16-,17-,22+/m0/s1	VMUIUYUBOUUZSN-PNLZDCPESA-N	CNC[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K11171096	BRD-K11171096-001-01-4	Broad Institute of MIT and Harvard	BRD-K11171096			CNC[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H30N2O3/c1-16-13-25(17(2)14-26)23(27)21-11-7-6-10-20(21)19-9-5-4-8-18(19)15-28-22(16)12-24-3/h4-11,16-17,22,24,26H,12-15H2,1-3H3/t16-,17-,22+/m0/s1	VMUIUYUBOUUZSN-PNLZDCPESA-N	382.22564284							97733
BRD-K58663279	LSM-11971		56835197	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21+,26-,27+/m1/s1	PIMBJQHAALXIRA-GOFZDKTCSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K58663279	BRD-K58663279-001-01-3	Broad Institute of MIT and Harvard	BRD-K58663279			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21+,26-,27+/m1/s1	PIMBJQHAALXIRA-GOFZDKTCSA-N	493.294056758							100597
BRD-K57638192	LSM-11916		54637740	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24+,30+/m0/s1	IOQJCBWFRPGQBJ-FVBCXUTKSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K57638192	BRD-K57638192-001-01-0	Broad Institute of MIT and Harvard	BRD-K57638192			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24+,30+/m0/s1	IOQJCBWFRPGQBJ-FVBCXUTKSA-N	587.310769462							100542
BRD-K19597888	LSM-9611		56835468	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32+,33+/m0/s1	UJZHWGMAKJZUOC-PKEWHSBVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K19597888	BRD-K19597888-001-01-4	Broad Institute of MIT and Harvard	BRD-K19597888			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32+,33+/m0/s1	UJZHWGMAKJZUOC-PKEWHSBVSA-N	610.351905992							98232
BRD-K94224651	LSM-14206		54637815	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23-,24+,30-/m1/s1	VBARFQGDBKSOKL-HTWFIQDWSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K94224651	BRD-K94224651-001-01-8	Broad Institute of MIT and Harvard	BRD-K94224651			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23-,24+,30-/m1/s1	VBARFQGDBKSOKL-HTWFIQDWSA-N	529.294056758							102860
BRD-K39635970	LSM-10838		54637668	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30-,33-/m0/s1	ZXKFKEACMTVYCV-MYWPCGIOSA-N	CO[C@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K39635970	BRD-K39635970-001-01-7	Broad Institute of MIT and Harvard	BRD-K39635970			CO[C@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30-,33-/m0/s1	ZXKFKEACMTVYCV-MYWPCGIOSA-N	583.304621442							99459
BRD-K44480417	LSM-11135		56835500	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22+,28+/m1/s1	IDILRECQKBLRIF-WENCSYSZSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K44480417	BRD-K44480417-001-01-2	Broad Institute of MIT and Harvard	BRD-K44480417			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22+,28+/m1/s1	IDILRECQKBLRIF-WENCSYSZSA-N	552.229407582							99756
BRD-K24465933	LSM-9910		56835326	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30+,33+/m0/s1	ZXKFKEACMTVYCV-BAMXSYKFSA-N	CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K24465933	BRD-K24465933-001-01-2	Broad Institute of MIT and Harvard	BRD-K24465933			CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30+,33+/m0/s1	ZXKFKEACMTVYCV-BAMXSYKFSA-N	583.304621442							98531
BRD-K16741885	LSM-9439		54637762	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19+,26+/m0/s1	KKDNYDXSJAWXCE-GNBJCERTSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K16741885	BRD-K16741885-001-01-4	Broad Institute of MIT and Harvard	BRD-K16741885			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19+,26+/m0/s1	KKDNYDXSJAWXCE-GNBJCERTSA-N	505.25767125							98060
BRD-K31494307	LSM-10338		54637756	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-41-28(20)17-36(3)30(40)35-27-15-9-8-14-26(27)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28+/m0/s1	AAENOGRDWGDRJO-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K31494307	BRD-K31494307-001-01-1	Broad Institute of MIT and Harvard	BRD-K31494307			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-41-28(20)17-36(3)30(40)35-27-15-9-8-14-26(27)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28+/m0/s1	AAENOGRDWGDRJO-YHGPEZAFSA-N	569.250141198							98959
BRD-K48877010	LSM-11404		54637687	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20+,27-/m0/s1	HAVPCKYPPPKWEI-VKIDHGPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K48877010	BRD-K48877010-001-01-6	Broad Institute of MIT and Harvard	BRD-K48877010			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20+,27-/m0/s1	HAVPCKYPPPKWEI-VKIDHGPPSA-N	594.251205666							100025
BRD-K61963347	LSM-12186		54637754	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	FTPUTVYFFNSJIR-UETOGOEVSA-N	COc1ccc(OC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K61963347	BRD-K61963347-001-01-0	Broad Institute of MIT and Harvard	BRD-K61963347			COc1ccc(OC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22+,29-/m1/s1	FTPUTVYFFNSJIR-UETOGOEVSA-N	532.257336892							100812
BRD-K34347561	LSM-10499		54637822	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20-,27-/m1/s1	WBCPGODJHKXDGU-SEXOINJZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K34347561	BRD-K34347561-001-01-9	Broad Institute of MIT and Harvard	BRD-K34347561			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20-,27-/m1/s1	WBCPGODJHKXDGU-SEXOINJZSA-N	573.295119398							99120
BRD-K01146969	LSM-8503		56835440	InChI=1S/C31H36N2O4/c1-22-18-33(23(2)20-34)31(36)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-37-29(22)19-32(3)30(35)17-24-11-5-4-6-12-24/h4-16,22-23,29,34H,17-21H2,1-3H3/t22-,23-,29-/m0/s1	VEXUQYCDGUTBQK-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K01146969	BRD-K01146969-001-01-2	Broad Institute of MIT and Harvard	BRD-K01146969			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O4/c1-22-18-33(23(2)20-34)31(36)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-37-29(22)19-32(3)30(35)17-24-11-5-4-6-12-24/h4-16,22-23,29,34H,17-21H2,1-3H3/t22-,23-,29-/m0/s1	VEXUQYCDGUTBQK-BOSRLCDASA-N	500.267507652							97124
BRD-K23373611	LSM-9836		54637784	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-13-7-6-12-26(27)25-11-5-4-10-24(25)20-35-28(21)18-31(3)17-23-9-8-14-30-15-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22+,28+/m0/s1	JEKWQBVWBTUQQJ-PFPZSTESSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K23373611	BRD-K23373611-001-01-8	Broad Institute of MIT and Harvard	BRD-K23373611			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-13-7-6-12-26(27)25-11-5-4-10-24(25)20-35-28(21)18-31(3)17-23-9-8-14-30-15-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22+,28+/m0/s1	JEKWQBVWBTUQQJ-PFPZSTESSA-N	473.26784201							98457
BRD-K09029418	LSM-8974		56835245	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m0/s1	ONXKQUJAHGZTDG-SYZUXVNWSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K09029418	BRD-K09029418-001-01-9	Broad Institute of MIT and Harvard	BRD-K09029418			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m0/s1	ONXKQUJAHGZTDG-SYZUXVNWSA-N	531.273321314							97595
BRD-K55943540	LSM-11817		54637680	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27-,28-/m0/s1	QNPXTRYBNJAKIP-DEQMQSMYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K55943540	BRD-K55943540-001-01-5	Broad Institute of MIT and Harvard	BRD-K55943540			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27-,28-/m0/s1	QNPXTRYBNJAKIP-DEQMQSMYSA-N	546.320605864							100442
BRD-K39114105	LSM-10800		56835439	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19-,26-/m0/s1	KKDNYDXSJAWXCE-DGUDUIIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K39114105	BRD-K39114105-001-01-1	Broad Institute of MIT and Harvard	BRD-K39114105			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19-,26-/m0/s1	KKDNYDXSJAWXCE-DGUDUIIESA-N	505.25767125							99421
BRD-K98168679	LSM-14463		56835414	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27-,28+/m0/s1	QNPXTRYBNJAKIP-ICLSSZMYSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K98168679	BRD-K98168679-001-01-1	Broad Institute of MIT and Harvard	BRD-K98168679			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27-,28+/m0/s1	QNPXTRYBNJAKIP-ICLSSZMYSA-N	546.320605864							103118
BRD-K56890651	LSM-11867		54637671	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30-,33+/m1/s1	ZXKFKEACMTVYCV-VAHUEIHFSA-N	CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K56890651	BRD-K56890651-001-01-2	Broad Institute of MIT and Harvard	BRD-K56890651			CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30-,33+/m1/s1	ZXKFKEACMTVYCV-VAHUEIHFSA-N	583.304621442							100493
BRD-K91379182	LSM-14044		54637650	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(27-14-8-9-15-28(27)36(32)4)26-13-7-5-12-25(26)21-42-29(22)19-35(3)43(40,41)30-16-10-6-11-24(30)17-34/h5-16,22-23,29,38H,18-21H2,1-4H3/t22-,23-,29-/m1/s1	VOTKEIORIBNPMA-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K91379182	BRD-K91379182-001-01-1	Broad Institute of MIT and Harvard	BRD-K91379182			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(27-14-8-9-15-28(27)36(32)4)26-13-7-5-12-25(26)21-42-29(22)19-35(3)43(40,41)30-16-10-6-11-24(30)17-34/h5-16,22-23,29,38H,18-21H2,1-4H3/t22-,23-,29-/m1/s1	VOTKEIORIBNPMA-VDWGHMIBSA-N	600.240640982							102697
BRD-K26835110	LSM-10054		56835436	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25-,31-,32-/m0/s1	ZQFGNRPCSITOFH-KBMMULIDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K26835110	BRD-K26835110-001-01-9	Broad Institute of MIT and Harvard	BRD-K26835110			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25-,31-,32-/m0/s1	ZQFGNRPCSITOFH-KBMMULIDSA-N	557.325356886							98675
BRD-K31975688	LSM-10368		54637725	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28-/m1/s1	CYZHERASHFZITE-PHVLTXCSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K31975688	BRD-K31975688-001-01-8	Broad Institute of MIT and Harvard	BRD-K31975688			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28-/m1/s1	CYZHERASHFZITE-PHVLTXCSSA-N	519.253334798							98989
BRD-K05051567	LSM-8735		56835501	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20+,25+/m1/s1	YEGLVGBFCXLPBD-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K05051567	BRD-K05051567-001-01-6	Broad Institute of MIT and Harvard	BRD-K05051567			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20+,25+/m1/s1	YEGLVGBFCXLPBD-RNHFSVANSA-N	528.175263524							97356
BRD-K38517635	LSM-10761		54637701	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26+,32+,33-/m1/s1	UJZHWGMAKJZUOC-PUUDBQKBSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K38517635	BRD-K38517635-001-01-5	Broad Institute of MIT and Harvard	BRD-K38517635			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26+,32+,33-/m1/s1	UJZHWGMAKJZUOC-PUUDBQKBSA-N	610.351905992							99382
BRD-K56962853	LSM-11877		54637658	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21+,26-/m1/s1	BBROUNWBLSFMDY-YZIHRLCOSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K56962853	BRD-K56962853-001-01-5	Broad Institute of MIT and Harvard	BRD-K56962853			CC(C)COC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21+,26-/m1/s1	BBROUNWBLSFMDY-YZIHRLCOSA-N	482.278072336							100503
BRD-K96612763	LSM-14356		56835237	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22-,28-/m0/s1	IDILRECQKBLRIF-VPYPWEPUSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K96612763	BRD-K96612763-001-01-7	Broad Institute of MIT and Harvard	BRD-K96612763			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22-,28-/m0/s1	IDILRECQKBLRIF-VPYPWEPUSA-N	552.229407582							103010
BRD-K78300612	LSM-13216		54637768	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20+,25-/m0/s1	JSYMGQYFJZOBEJ-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K78300612	BRD-K78300612-001-01-4	Broad Institute of MIT and Harvard	BRD-K78300612			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20+,25-/m0/s1	JSYMGQYFJZOBEJ-DFIYOIEZSA-N	526.224990918							101855
BRD-K66633149	LSM-12485		56835217	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-13-7-6-12-26(27)25-11-5-4-10-24(25)20-35-28(21)18-31(3)17-23-9-8-14-30-15-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22-,28-/m0/s1	JEKWQBVWBTUQQJ-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K66633149	BRD-K66633149-001-01-4	Broad Institute of MIT and Harvard	BRD-K66633149			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-13-7-6-12-26(27)25-11-5-4-10-24(25)20-35-28(21)18-31(3)17-23-9-8-14-30-15-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22-,28-/m0/s1	JEKWQBVWBTUQQJ-VPYPWEPUSA-N	473.26784201							101116
BRD-K54618558	LSM-11745		54637729	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29-/m1/s1	ONXKQUJAHGZTDG-UETOGOEVSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K54618558	BRD-K54618558-001-01-3	Broad Institute of MIT and Harvard	BRD-K54618558			COc1ccccc1NC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29-/m1/s1	ONXKQUJAHGZTDG-UETOGOEVSA-N	531.273321314							100370
BRD-K37398676	LSM-10687		54637770	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21+,26+,27+/m0/s1	PIMBJQHAALXIRA-ZVMNANPCSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K37398676	BRD-K37398676-001-01-1	Broad Institute of MIT and Harvard	BRD-K37398676			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21+,26+,27+/m0/s1	PIMBJQHAALXIRA-ZVMNANPCSA-N	493.294056758							99308
BRD-K20914452	LSM-9703		56835443	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29-,30+/m0/s1	DVGPQCDULGSEFB-TZZQULJZSA-N	CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO)c4ccccc4	BroadT	BRD-K20914452	BRD-K20914452-001-01-4	Broad Institute of MIT and Harvard	BRD-K20914452			CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29-,30+/m0/s1	DVGPQCDULGSEFB-TZZQULJZSA-N	530.278072336							98324
BRD-K83311395	LSM-13517		54637642	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29+,30+/m0/s1	DVGPQCDULGSEFB-QWTJTPASSA-N	CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO)c4ccccc4	BroadT	BRD-K83311395	BRD-K83311395-001-01-7	Broad Institute of MIT and Harvard	BRD-K83311395			CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29+,30+/m0/s1	DVGPQCDULGSEFB-QWTJTPASSA-N	530.278072336							102158
BRD-K96804382	LSM-14375		54637678	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27+,28+/m1/s1	QNPXTRYBNJAKIP-BIQRORRISA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K96804382	BRD-K96804382-001-01-1	Broad Institute of MIT and Harvard	BRD-K96804382			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27+,28+/m1/s1	QNPXTRYBNJAKIP-BIQRORRISA-N	546.320605864							103029
BRD-K99048249	LSM-14510		54637799	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23-,31-/m1/s1	NTGYADANNGAILP-CEFNRUSXSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45)c(OC)c1	BroadT	BRD-K99048249	BRD-K99048249-001-01-5	Broad Institute of MIT and Harvard	BRD-K99048249			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c2ccccc32)c(OC)c1	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23-,31-/m1/s1	NTGYADANNGAILP-CEFNRUSXSA-N	614.310435104							103165
BRD-K71859938	LSM-12832		56835460	InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23-,30+/m1/s1	BRMWAKMKOMKLLH-JWUQWVJQSA-N	COc1ccc(CNC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K71859938	BRD-K71859938-001-01-3	Broad Institute of MIT and Harvard	BRD-K71859938			COc1ccc(CNC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23-,30+/m1/s1	BRMWAKMKOMKLLH-JWUQWVJQSA-N	545.288971378							101469
BRD-K40455893	LSM-10897		54637831	InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19-,26-/m1/s1	UYIXVJNNAXNMSD-LJKQEARRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K40455893	BRD-K40455893-001-01-1	Broad Institute of MIT and Harvard	BRD-K40455893			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19-,26-/m1/s1	UYIXVJNNAXNMSD-LJKQEARRSA-N	541.22465656							99518
BRD-K23871470	LSM-9868		54637782	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31+,32-/m0/s1	ZQFGNRPCSITOFH-NKBCUSNNSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K23871470	BRD-K23871470-001-01-1	Broad Institute of MIT and Harvard	BRD-K23871470			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31+,32-/m0/s1	ZQFGNRPCSITOFH-NKBCUSNNSA-N	557.325356886							98489
BRD-K79652816	LSM-13291		54637749	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29-/m1/s1	RWOMJVAVZPFCIF-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K79652816	BRD-K79652816-001-01-1	Broad Institute of MIT and Harvard	BRD-K79652816			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29-/m1/s1	RWOMJVAVZPFCIF-IEOSBIPESA-N	547.214091876							101930
BRD-K44511222	LSM-11137		54637833	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20-,25+/m0/s1	YEGLVGBFCXLPBD-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K44511222	BRD-K44511222-001-01-9	Broad Institute of MIT and Harvard	BRD-K44511222			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20-,25+/m0/s1	YEGLVGBFCXLPBD-ZYLNGJIFSA-N	528.175263524							99758
BRD-K54457715	LSM-11736		54637663	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29-/m1/s1	RPGWXCDGQSLPTH-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K54457715	BRD-K54457715-001-01-6	Broad Institute of MIT and Harvard	BRD-K54457715			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29-/m1/s1	RPGWXCDGQSLPTH-VDWGHMIBSA-N	526.294391116							100361
BRD-K91244634	LSM-14039		54637804	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22-,28-/m1/s1	IDILRECQKBLRIF-DQCZWYHMSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K91244634	BRD-K91244634-001-01-1	Broad Institute of MIT and Harvard	BRD-K91244634			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22-,28-/m1/s1	IDILRECQKBLRIF-DQCZWYHMSA-N	552.229407582							102692
BRD-K99643744	LSM-14550		56835428	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22-,28+/m1/s1	IDILRECQKBLRIF-XJGOYTCSSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K99643744	BRD-K99643744-001-01-3	Broad Institute of MIT and Harvard	BRD-K99643744			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22-,28+/m1/s1	IDILRECQKBLRIF-XJGOYTCSSA-N	552.229407582							103205
CHEMBL2358923	LSM-9008	SID131433975, BRD-K09526594	54637699	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26+,32-,33-/m0/s1	UJZHWGMAKJZUOC-QRSNXCHESA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K09526594	BRD-K09526594-001-01-0	Broad Institute of MIT and Harvard	BRD-K09526594			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26+,32-,33-/m0/s1	UJZHWGMAKJZUOC-QRSNXCHESA-N	610.351905992							97629
BRD-K29368169	LSM-10208		56835273	InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19-,26-/m0/s1	UYIXVJNNAXNMSD-DGUDUIIESA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K29368169	BRD-K29368169-001-01-8	Broad Institute of MIT and Harvard	BRD-K29368169			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19-,26-/m0/s1	UYIXVJNNAXNMSD-DGUDUIIESA-N	541.22465656							98829
BRD-K99638701	LSM-14549		54637709	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20-,25-/m1/s1	RDYUFLZMPZQAJV-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K99638701	BRD-K99638701-001-01-4	Broad Institute of MIT and Harvard	BRD-K99638701			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20-,25-/m1/s1	RDYUFLZMPZQAJV-UMEGOILYSA-N	559.265791262							103204
BRD-K94988014	LSM-14251		56835452	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20+,27+/m0/s1	WBCPGODJHKXDGU-ASHZAFPQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K94988014	BRD-K94988014-001-01-0	Broad Institute of MIT and Harvard	BRD-K94988014			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20+,27+/m0/s1	WBCPGODJHKXDGU-ASHZAFPQSA-N	573.295119398							102905
BRD-K85957472	LSM-13696		54637780	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31+,32+/m0/s1	ZQFGNRPCSITOFH-UADZGEIMSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K85957472	BRD-K85957472-001-01-1	Broad Institute of MIT and Harvard	BRD-K85957472			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31+,32+/m0/s1	ZQFGNRPCSITOFH-UADZGEIMSA-N	557.325356886							102344
CHEMBL3187380	LSM-10036	BRD-K26545050	54637797	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23+,31-/m1/s1	NTGYADANNGAILP-IKBQMQIHSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45)c(OC)c1	BroadT	BRD-K26545050	BRD-K26545050-001-01-6	Broad Institute of MIT and Harvard	BRD-K26545050			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c2ccccc32)c(OC)c1	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23+,31-/m1/s1	NTGYADANNGAILP-IKBQMQIHSA-N	614.310435104							98657
BRD-K01691627	LSM-8542		54637742	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24+,30-/m0/s1	IOQJCBWFRPGQBJ-BBANNHEPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K01691627	BRD-K01691627-001-01-1	Broad Institute of MIT and Harvard	BRD-K01691627			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24+,30-/m0/s1	IOQJCBWFRPGQBJ-BBANNHEPSA-N	587.310769462							97163
BRD-K21317335	LSM-9724		54637714	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-25(26)20-38-29(21)18-32(3)17-23-9-8-11-24(15-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22-,29+/m0/s1	QELHGDMSGADVOM-IHMCZWCLSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K21317335	BRD-K21317335-001-01-2	Broad Institute of MIT and Harvard	BRD-K21317335			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-25(26)20-38-29(21)18-32(3)17-23-9-8-11-24(15-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22-,29+/m0/s1	QELHGDMSGADVOM-IHMCZWCLSA-N	516.262422272							98345
BRD-K88384060	LSM-13863		54637802	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22+,28-/m0/s1	IDILRECQKBLRIF-TYPXCFOJSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K88384060	BRD-K88384060-001-01-3	Broad Institute of MIT and Harvard	BRD-K88384060			COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22+,28-/m0/s1	IDILRECQKBLRIF-TYPXCFOJSA-N	552.229407582							102514
BRD-K19589763	LSM-9609		54637677	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27-,28+/m1/s1	QNPXTRYBNJAKIP-OOIQZMFUSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K19589763	BRD-K19589763-001-01-1	Broad Institute of MIT and Harvard	BRD-K19589763			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27-,28+/m1/s1	QNPXTRYBNJAKIP-OOIQZMFUSA-N	546.320605864							98230
BRD-K83549059	LSM-13540		56835265	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-41-28(20)17-36(3)30(40)35-27-15-9-8-14-26(27)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28-/m0/s1	AAENOGRDWGDRJO-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K83549059	BRD-K83549059-001-01-9	Broad Institute of MIT and Harvard	BRD-K83549059			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-41-28(20)17-36(3)30(40)35-27-15-9-8-14-26(27)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28-/m0/s1	AAENOGRDWGDRJO-CZBREUMFSA-N	569.250141198							102182
BRD-K00765103	LSM-8482		54637693	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)27-14-8-7-13-26(27)25-12-6-4-11-24(25)20-38-28(21)18-32(3)39(36,37)29-15-9-5-10-23(29)16-31/h4-15,21-22,28,34H,17-20H2,1-3H3/t21-,22+,28-/m0/s1	CWLJLYLZQZUHCH-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K00765103	BRD-K00765103-001-01-7	Broad Institute of MIT and Harvard	BRD-K00765103			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)27-14-8-7-13-26(27)25-12-6-4-11-24(25)20-38-28(21)18-32(3)39(36,37)29-15-9-5-10-23(29)16-31/h4-15,21-22,28,34H,17-20H2,1-3H3/t21-,22+,28-/m0/s1	CWLJLYLZQZUHCH-TYPXCFOJSA-N	547.214091876							97103
BRD-K70377370	LSM-12721		54637776	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26+,27-/m1/s1	PIMBJQHAALXIRA-VFOOCMBXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K70377370	BRD-K70377370-001-01-2	Broad Institute of MIT and Harvard	BRD-K70377370			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26+,27-/m1/s1	PIMBJQHAALXIRA-VFOOCMBXSA-N	493.294056758							101357
BRD-K47811236	LSM-11338		56835223	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21-,29-/m0/s1	APWUXYFXBMGRIO-WURXVLGASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K47811236	BRD-K47811236-001-01-4	Broad Institute of MIT and Harvard	BRD-K47811236			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21-,29-/m0/s1	APWUXYFXBMGRIO-WURXVLGASA-N	545.25258587							99959
CHEMBL2354897	LSM-10788	BRD-K38963656, SID131434094	54637817	InChI=1S/C27H33F3N2O4/c1-18-14-32(19(2)16-33)26(35)23-11-7-6-10-22(23)21-9-5-4-8-20(21)17-36-24(18)15-31(3)25(34)12-13-27(28,29)30/h4-11,18-19,24,33H,12-17H2,1-3H3/t18-,19-,24+/m0/s1	VGVIGMMHZQAXDN-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K38963656	BRD-K38963656-001-01-5	Broad Institute of MIT and Harvard	BRD-K38963656			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H33F3N2O4/c1-18-14-32(19(2)16-33)26(35)23-11-7-6-10-22(23)21-9-5-4-8-20(21)17-36-24(18)15-31(3)25(34)12-13-27(28,29)30/h4-11,18-19,24,33H,12-17H2,1-3H3/t18-,19-,24+/m0/s1	VGVIGMMHZQAXDN-AXHZCLLHSA-N	506.239242156							99409
BRD-K44818533	LSM-11157		56835366	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23+,31+/m0/s1	NTGYADANNGAILP-INEJIFKHSA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45)c(OC)c1	BroadT	BRD-K44818533	BRD-K44818533-001-01-2	Broad Institute of MIT and Harvard	BRD-K44818533			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c2ccccc32)c(OC)c1	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23+,31+/m0/s1	NTGYADANNGAILP-INEJIFKHSA-N	614.310435104							99778
BRD-K39156670	LSM-10806		56835555	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28-/m0/s1	CYZHERASHFZITE-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K39156670	BRD-K39156670-001-01-7	Broad Institute of MIT and Harvard	BRD-K39156670			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28-/m0/s1	CYZHERASHFZITE-CZBREUMFSA-N	519.253334798							99427
BRD-K26301430	LSM-10023		56835203	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23+,29+,30+/m1/s1	DVGPQCDULGSEFB-HVZWOXGHSA-N	CO[C@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO)c4ccccc4	BroadT	BRD-K26301430	BRD-K26301430-001-01-5	Broad Institute of MIT and Harvard	BRD-K26301430			CO[C@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23+,29+,30+/m1/s1	DVGPQCDULGSEFB-HVZWOXGHSA-N	530.278072336							98644
BRD-K21037590	LSM-9709		56835315	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20+,25+/m1/s1	RDYUFLZMPZQAJV-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K21037590	BRD-K21037590-001-01-6	Broad Institute of MIT and Harvard	BRD-K21037590			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20+,25+/m1/s1	RDYUFLZMPZQAJV-RNHFSVANSA-N	559.265791262							98330
BRD-K13060097	LSM-9210		54637808	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21-,29-/m1/s1	APWUXYFXBMGRIO-GVNDJSPXSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K13060097	BRD-K13060097-001-01-6	Broad Institute of MIT and Harvard	BRD-K13060097			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21-,29-/m1/s1	APWUXYFXBMGRIO-GVNDJSPXSA-N	545.25258587							97831
BRD-K27872553	LSM-10113		54637719	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21+,28+/m0/s1	VUGFGKFGZUURHO-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K27872553	BRD-K27872553-001-01-5	Broad Institute of MIT and Harvard	BRD-K27872553			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21+,28+/m0/s1	VUGFGKFGZUURHO-BALWLHIASA-N	590.206227466							98734
BRD-K80195617	LSM-13325		56835476	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29+/m1/s1	ONXKQUJAHGZTDG-BXOOBUKZSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K80195617	BRD-K80195617-001-01-9	Broad Institute of MIT and Harvard	BRD-K80195617			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29+/m1/s1	ONXKQUJAHGZTDG-BXOOBUKZSA-N	531.273321314							101964
CHEMBL2358913	LSM-9521	BRD-K18244645, SID131434103	54637826	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30-/m0/s1	ZFRPCBGONKGXGW-ZRLASMASSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K18244645	BRD-K18244645-001-01-8	Broad Institute of MIT and Harvard	BRD-K18244645			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30-/m0/s1	ZFRPCBGONKGXGW-ZRLASMASSA-N	605.255956688							98142
BRD-K62590938	LSM-12227		54637659	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21-,26-/m1/s1	BBROUNWBLSFMDY-IPVFLDMMSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K62590938	BRD-K62590938-001-01-5	Broad Institute of MIT and Harvard	BRD-K62590938			CC(C)COC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21-,26-/m1/s1	BBROUNWBLSFMDY-IPVFLDMMSA-N	482.278072336							100853
BRD-K56215045	LSM-11828		56835270	InChI=1S/C27H33F3N2O4/c1-18-14-32(19(2)16-33)26(35)23-11-7-6-10-22(23)21-9-5-4-8-20(21)17-36-24(18)15-31(3)25(34)12-13-27(28,29)30/h4-11,18-19,24,33H,12-17H2,1-3H3/t18-,19-,24+/m1/s1	VGVIGMMHZQAXDN-IECBHUPTSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K56215045	BRD-K56215045-001-01-7	Broad Institute of MIT and Harvard	BRD-K56215045			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H33F3N2O4/c1-18-14-32(19(2)16-33)26(35)23-11-7-6-10-22(23)21-9-5-4-8-20(21)17-36-24(18)15-31(3)25(34)12-13-27(28,29)30/h4-11,18-19,24,33H,12-17H2,1-3H3/t18-,19-,24+/m1/s1	VGVIGMMHZQAXDN-IECBHUPTSA-N	506.239242156							100453
BRD-K22778679	LSM-9811		54637787	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-13-7-6-12-26(27)25-11-5-4-10-24(25)20-35-28(21)18-31(3)17-23-9-8-14-30-15-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22-,28-/m1/s1	JEKWQBVWBTUQQJ-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K22778679	BRD-K22778679-001-01-8	Broad Institute of MIT and Harvard	BRD-K22778679			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-13-7-6-12-26(27)25-11-5-4-10-24(25)20-35-28(21)18-31(3)17-23-9-8-14-30-15-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22-,28-/m1/s1	JEKWQBVWBTUQQJ-DQCZWYHMSA-N	473.26784201							98432
BRD-K45785972	LSM-11220		56835391	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23+,29+/m0/s1	INXMEFHWZGRULI-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K45785972	BRD-K45785972-001-01-0	Broad Institute of MIT and Harvard	BRD-K45785972			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23+,29+/m0/s1	INXMEFHWZGRULI-QFWOEDSFSA-N	560.336255928							99841
BRD-K58925245	LSM-11987		54637741	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24-,30+/m0/s1	IOQJCBWFRPGQBJ-FOUYOVOOSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K58925245	BRD-K58925245-001-01-7	Broad Institute of MIT and Harvard	BRD-K58925245			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24-,30+/m0/s1	IOQJCBWFRPGQBJ-FOUYOVOOSA-N	587.310769462							100613
BRD-K80094052	LSM-13319		54637834	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20+,25-/m0/s1	YEGLVGBFCXLPBD-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K80094052	BRD-K80094052-001-01-6	Broad Institute of MIT and Harvard	BRD-K80094052			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20+,25-/m0/s1	YEGLVGBFCXLPBD-DFIYOIEZSA-N	528.175263524							101958
BRD-K32231531	LSM-10381		56835218	InChI=1S/C33H40N2O5/c1-23-18-35(24(2)21-36)33(37)29-14-7-6-13-28(29)27-12-5-4-10-26(27)22-40-31(23)20-34(3)19-25-11-8-15-30-32(25)39-17-9-16-38-30/h4-8,10-15,23-24,31,36H,9,16-22H2,1-3H3/t23-,24-,31-/m0/s1	MEBNTFIGGVDNJI-MKGJDZFWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K32231531	BRD-K32231531-001-01-4	Broad Institute of MIT and Harvard	BRD-K32231531			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H40N2O5/c1-23-18-35(24(2)21-36)33(37)29-14-7-6-13-28(29)27-12-5-4-10-26(27)22-40-31(23)20-34(3)19-25-11-8-15-30-32(25)39-17-9-16-38-30/h4-8,10-15,23-24,31,36H,9,16-22H2,1-3H3/t23-,24-,31-/m0/s1	MEBNTFIGGVDNJI-MKGJDZFWSA-N	544.2937224							99002
BRD-K45892018	LSM-11225		54637832	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20+,25+/m0/s1	YEGLVGBFCXLPBD-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K45892018	BRD-K45892018-001-01-0	Broad Institute of MIT and Harvard	BRD-K45892018			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20+,25+/m0/s1	YEGLVGBFCXLPBD-WZOHSFFVSA-N	528.175263524							99846
BRD-K27718415	LSM-10098		54637778	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25-,31+,32+/m0/s1	ZQFGNRPCSITOFH-VHEJNBBASA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K27718415	BRD-K27718415-001-01-8	Broad Institute of MIT and Harvard	BRD-K27718415			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25-,31+,32+/m0/s1	ZQFGNRPCSITOFH-VHEJNBBASA-N	557.325356886							98719
BRD-K84306552	LSM-13581		54637821	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20-,27-/m0/s1	WBCPGODJHKXDGU-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K84306552	BRD-K84306552-001-01-5	Broad Institute of MIT and Harvard	BRD-K84306552			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20-,27-/m0/s1	WBCPGODJHKXDGU-OSOCVKALSA-N	573.295119398							102225
BRD-K34922409	LSM-10529		54637649	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(27-14-8-9-15-28(27)36(32)4)26-13-7-5-12-25(26)21-42-29(22)19-35(3)43(40,41)30-16-10-6-11-24(30)17-34/h5-16,22-23,29,38H,18-21H2,1-4H3/t22-,23+,29-/m1/s1	VOTKEIORIBNPMA-RLPNJSHFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K34922409	BRD-K34922409-001-01-5	Broad Institute of MIT and Harvard	BRD-K34922409			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(27-14-8-9-15-28(27)36(32)4)26-13-7-5-12-25(26)21-42-29(22)19-35(3)43(40,41)30-16-10-6-11-24(30)17-34/h5-16,22-23,29,38H,18-21H2,1-4H3/t22-,23+,29-/m1/s1	VOTKEIORIBNPMA-RLPNJSHFSA-N	600.240640982							99150
CHEMBL2360361	LSM-13127	BRD-K76749891, SID131434102	54637825	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30-/m1/s1	ZFRPCBGONKGXGW-DUELTEGESA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K76749891	BRD-K76749891-001-01-6	Broad Institute of MIT and Harvard	BRD-K76749891			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30-/m1/s1	ZFRPCBGONKGXGW-DUELTEGESA-N	605.255956688							101765
MLS003129817	LSM-10974	BRD-K41916320	46903255	InChI=1S/C23H30N2O3/c1-16-13-25(17(2)14-26)23(27)21-11-7-6-10-20(21)19-9-5-4-8-18(19)15-28-22(16)12-24-3/h4-11,16-17,22,24,26H,12-15H2,1-3H3/t16-,17-,22-/m0/s1	VMUIUYUBOUUZSN-HOIFWPIMSA-N	CNC[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K41916320	BRD-K41916320-001-03-0	Broad Institute of MIT and Harvard	BRD-K41916320			CNC[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C23H30N2O3/c1-16-13-25(17(2)14-26)23(27)21-11-7-6-10-20(21)19-9-5-4-8-18(19)15-28-22(16)12-24-3/h4-11,16-17,22,24,26H,12-15H2,1-3H3/t16-,17-,22-/m0/s1	VMUIUYUBOUUZSN-HOIFWPIMSA-N	382.22564284							99595
BRD-K45998529	LSM-11230		54637720	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21-,28+/m0/s1	VUGFGKFGZUURHO-YHGPEZAFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K45998529	BRD-K45998529-001-01-7	Broad Institute of MIT and Harvard	BRD-K45998529			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21-,28+/m0/s1	VUGFGKFGZUURHO-YHGPEZAFSA-N	590.206227466							99851
BRD-K10325955	LSM-9055		56835416	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20-,25+/m0/s1	RDYUFLZMPZQAJV-ZYLNGJIFSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K10325955	BRD-K10325955-001-01-7	Broad Institute of MIT and Harvard	BRD-K10325955			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20-,25+/m0/s1	RDYUFLZMPZQAJV-ZYLNGJIFSA-N	559.265791262							97676
BRD-K42610174	LSM-11011		54637710	InChI=1S/C31H36N2O4/c1-22-18-33(23(2)20-34)31(36)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-37-29(22)19-32(3)30(35)17-24-11-5-4-6-12-24/h4-16,22-23,29,34H,17-21H2,1-3H3/t22-,23+,29+/m0/s1	VEXUQYCDGUTBQK-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K42610174	BRD-K42610174-001-01-9	Broad Institute of MIT and Harvard	BRD-K42610174			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O4/c1-22-18-33(23(2)20-34)31(36)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-37-29(22)19-32(3)30(35)17-24-11-5-4-6-12-24/h4-16,22-23,29,34H,17-21H2,1-3H3/t22-,23+,29+/m0/s1	VEXUQYCDGUTBQK-QFWOEDSFSA-N	500.267507652							99632
BRD-K27452198	LSM-10085		54637810	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23+,24+,30-/m0/s1	VBARFQGDBKSOKL-YTNVWYNJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K27452198	BRD-K27452198-001-01-7	Broad Institute of MIT and Harvard	BRD-K27452198			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23+,24+,30-/m0/s1	VBARFQGDBKSOKL-YTNVWYNJSA-N	529.294056758							98706
BRD-K20848134	LSM-9700		56835560	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25-,31-,32+/m1/s1	ZQFGNRPCSITOFH-JPHIWRERSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K20848134	BRD-K20848134-001-01-0	Broad Institute of MIT and Harvard	BRD-K20848134			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25-,31-,32+/m1/s1	ZQFGNRPCSITOFH-JPHIWRERSA-N	557.325356886							98321
BRD-K31487013	LSM-10336		54637836	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20-,25-/m1/s1	YEGLVGBFCXLPBD-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K31487013	BRD-K31487013-001-01-0	Broad Institute of MIT and Harvard	BRD-K31487013			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20-,25-/m1/s1	YEGLVGBFCXLPBD-UMEGOILYSA-N	528.175263524							98957
BRD-K78822642-001-01-1	LSM-13240	BRD-K78822642	54637697	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32+,33+/m1/s1	UJZHWGMAKJZUOC-CJTKCQPWSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K78822642	BRD-K78822642-001-01-1	Broad Institute of MIT and Harvard	BRD-K78822642			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32+,33+/m1/s1	UJZHWGMAKJZUOC-CJTKCQPWSA-N	610.351905992							101879
BRD-K41652832	LSM-10958		56835227	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29+/m1/s1	WYYHNXRAZIWUBG-BXOOBUKZSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K41652832	BRD-K41652832-001-01-6	Broad Institute of MIT and Harvard	BRD-K41652832			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)c1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29+/m1/s1	WYYHNXRAZIWUBG-BXOOBUKZSA-N	531.273321314							99579
BRD-K10279767	LSM-9053		54637704	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32+,33-/m1/s1	UJZHWGMAKJZUOC-GQWBKNFGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K10279767	BRD-K10279767-001-01-4	Broad Institute of MIT and Harvard	BRD-K10279767			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32+,33-/m1/s1	UJZHWGMAKJZUOC-GQWBKNFGSA-N	610.351905992							97674
BRD-K47131467	LSM-11309		54637748	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29-/m1/s1	RWOMJVAVZPFCIF-UETOGOEVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K47131467	BRD-K47131467-001-01-7	Broad Institute of MIT and Harvard	BRD-K47131467			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29-/m1/s1	RWOMJVAVZPFCIF-UETOGOEVSA-N	547.214091876							99930
BRD-K00434250	LSM-8454		54637773	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21+,26+,27-/m0/s1	PIMBJQHAALXIRA-BEYVDOMISA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K00434250	BRD-K00434250-001-01-1	Broad Institute of MIT and Harvard	BRD-K00434250			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21+,26+,27-/m0/s1	PIMBJQHAALXIRA-BEYVDOMISA-N	493.294056758							97075
BRD-K33054146	LSM-10439		54637732	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22+,30-/m0/s1	KFLLAZWDLYDTFJ-ZQLNOWDWSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5c(C1=O)n(C)c6ccccc56	BroadT	BRD-K33054146	BRD-K33054146-001-01-6	Broad Institute of MIT and Harvard	BRD-K33054146			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22+,30-/m0/s1	KFLLAZWDLYDTFJ-ZQLNOWDWSA-N	598.279134976							99060
BRD-K26427778	LSM-10029		54637785	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-13-7-6-12-26(27)25-11-5-4-10-24(25)20-35-28(21)18-31(3)17-23-9-8-14-30-15-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22-,28+/m0/s1	JEKWQBVWBTUQQJ-RXYILKCJSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K26427778	BRD-K26427778-001-01-8	Broad Institute of MIT and Harvard	BRD-K26427778			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-13-7-6-12-26(27)25-11-5-4-10-24(25)20-35-28(21)18-31(3)17-23-9-8-14-30-15-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22-,28+/m0/s1	JEKWQBVWBTUQQJ-RXYILKCJSA-N	473.26784201							98650
BRD-K61190439	LSM-12133		54637790	InChI=1S/C25H31F3N2O5S/c1-17-12-30(18(2)14-31)24(32)22-11-7-6-10-21(22)20-9-5-4-8-19(20)15-35-23(17)13-29(3)36(33,34)16-25(26,27)28/h4-11,17-18,23,31H,12-16H2,1-3H3/t17-,18+,23-/m1/s1	YLVWKLWKMUPGPR-IEGUWTFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K61190439	BRD-K61190439-001-01-9	Broad Institute of MIT and Harvard	BRD-K61190439			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C25H31F3N2O5S/c1-17-12-30(18(2)14-31)24(32)22-11-7-6-10-21(22)20-9-5-4-8-19(20)15-35-23(17)13-29(3)36(33,34)16-25(26,27)28/h4-11,17-18,23,31H,12-16H2,1-3H3/t17-,18+,23-/m1/s1	YLVWKLWKMUPGPR-IEGUWTFLSA-N	528.190577402							100759
BRD-K43556160	LSM-11081		54637728	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29-/m0/s1	ONXKQUJAHGZTDG-KERYWQKISA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K43556160	BRD-K43556160-001-01-9	Broad Institute of MIT and Harvard	BRD-K43556160			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29-/m0/s1	ONXKQUJAHGZTDG-KERYWQKISA-N	531.273321314							99702
BRD-K08963966	LSM-8967		54637829	InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19-,26+/m0/s1	UYIXVJNNAXNMSD-LZJCXSABSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K08963966	BRD-K08963966-001-01-6	Broad Institute of MIT and Harvard	BRD-K08963966			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19-,26+/m0/s1	UYIXVJNNAXNMSD-LZJCXSABSA-N	541.22465656							97588
BRD-K06199632	LSM-8789		56835506	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31+,32+/m1/s1	ZQFGNRPCSITOFH-IYJCOAAISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K06199632	BRD-K06199632-001-01-3	Broad Institute of MIT and Harvard	BRD-K06199632			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31+,32+/m1/s1	ZQFGNRPCSITOFH-IYJCOAAISA-N	557.325356886							97410
BRD-K43874853	LSM-11108		56835507	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21+,29+/m1/s1	APWUXYFXBMGRIO-CGQTXMLISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K43874853	BRD-K43874853-001-01-8	Broad Institute of MIT and Harvard	BRD-K43874853			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21+,29+/m1/s1	APWUXYFXBMGRIO-CGQTXMLISA-N	545.25258587							99729
BRD-K63201679	LSM-12272		54637805	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21+,29+/m0/s1	APWUXYFXBMGRIO-BNJCFXFUSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K63201679	BRD-K63201679-001-01-1	Broad Institute of MIT and Harvard	BRD-K63201679			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21+,29+/m0/s1	APWUXYFXBMGRIO-BNJCFXFUSA-N	545.25258587							100898
BRD-K21852581	LSM-9753		54637664	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30+,33+/m1/s1	ZXKFKEACMTVYCV-WBFZUUJBSA-N	CO[C@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K21852581	BRD-K21852581-001-01-9	Broad Institute of MIT and Harvard	BRD-K21852581			CO[C@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30+,33+/m1/s1	ZXKFKEACMTVYCV-WBFZUUJBSA-N	583.304621442							98374
BRD-K92441219	LSM-14100		54637690	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20-,27-/m1/s1	HAVPCKYPPPKWEI-SEXOINJZSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K92441219	BRD-K92441219-001-01-5	Broad Institute of MIT and Harvard	BRD-K92441219			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20-,27-/m1/s1	HAVPCKYPPPKWEI-SEXOINJZSA-N	594.251205666							102754
BRD-K71204485	LSM-12777		54637651	InChI=1S/C31H38N2O4/c1-22-17-33(23(2)20-34)31(35)28-15-9-8-14-27(28)26-13-7-5-12-25(26)21-37-30(22)19-32(3)18-24-11-6-10-16-29(24)36-4/h5-16,22-23,30,34H,17-21H2,1-4H3/t22-,23+,30-/m0/s1	VZCRYBFAFAJOLC-BURCIIJTSA-N	COc1ccccc1CN(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K71204485	BRD-K71204485-001-01-9	Broad Institute of MIT and Harvard	BRD-K71204485			COc1ccccc1CN(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C31H38N2O4/c1-22-17-33(23(2)20-34)31(35)28-15-9-8-14-27(28)26-13-7-5-12-25(26)21-37-30(22)19-32(3)18-24-11-6-10-16-29(24)36-4/h5-16,22-23,30,34H,17-21H2,1-4H3/t22-,23+,30-/m0/s1	VZCRYBFAFAJOLC-BURCIIJTSA-N	502.283157716							101414
BRD-K95196306	LSM-14261		54637801	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22-,28+/m0/s1	IDILRECQKBLRIF-RXYILKCJSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K95196306	BRD-K95196306-001-01-6	Broad Institute of MIT and Harvard	BRD-K95196306			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22-,28+/m0/s1	IDILRECQKBLRIF-RXYILKCJSA-N	552.229407582							102915
BRD-K90074540	LSM-13986		54637819	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20+,27-/m0/s1	WBCPGODJHKXDGU-VKIDHGPPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K90074540	BRD-K90074540-001-01-6	Broad Institute of MIT and Harvard	BRD-K90074540			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20+,27-/m0/s1	WBCPGODJHKXDGU-VKIDHGPPSA-N	573.295119398							102639
BRD-K64169482	LSM-12347		54637686	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20-,27+/m1/s1	HAVPCKYPPPKWEI-DVHCVUMVSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K64169482	BRD-K64169482-001-01-6	Broad Institute of MIT and Harvard	BRD-K64169482			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20-,27+/m1/s1	HAVPCKYPPPKWEI-DVHCVUMVSA-N	594.251205666							100974
BRD-K35979672	LSM-10592		56835205	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23+,24-,30+/m1/s1	VBARFQGDBKSOKL-IFVFNEAISA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K35979672	BRD-K35979672-001-01-4	Broad Institute of MIT and Harvard	BRD-K35979672			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23+,24-,30+/m1/s1	VBARFQGDBKSOKL-IFVFNEAISA-N	529.294056758							99213
BRD-K94348552	LSM-14212		56835410	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22+,30+/m0/s1	KFLLAZWDLYDTFJ-IABYTQIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5c(C1=O)n(C)c6ccccc56	BroadT	BRD-K94348552	BRD-K94348552-001-01-5	Broad Institute of MIT and Harvard	BRD-K94348552			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22+,30+/m0/s1	KFLLAZWDLYDTFJ-IABYTQIASA-N	598.279134976							102866
BRD-K62337120	LSM-12215		56835219	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22-,29-/m0/s1	FTPUTVYFFNSJIR-SYZUXVNWSA-N	COc1ccc(OC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K62337120	BRD-K62337120-001-01-9	Broad Institute of MIT and Harvard	BRD-K62337120			COc1ccc(OC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22-,29-/m0/s1	FTPUTVYFFNSJIR-SYZUXVNWSA-N	532.257336892							100841
BRD-K28076694	LSM-10131		54637657	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21+,26-/m0/s1	BBROUNWBLSFMDY-UZINWLIJSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K28076694	BRD-K28076694-001-01-2	Broad Institute of MIT and Harvard	BRD-K28076694			CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21+,26-/m0/s1	BBROUNWBLSFMDY-UZINWLIJSA-N	482.278072336							98752
BRD-K96257627	LSM-14334		54637700	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26+,32-,33-/m1/s1	UJZHWGMAKJZUOC-RZKQZDRJSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K96257627	BRD-K96257627-001-01-7	Broad Institute of MIT and Harvard	BRD-K96257627			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26+,32-,33-/m1/s1	UJZHWGMAKJZUOC-RZKQZDRJSA-N	610.351905992							102988
CHEMBL2360970	LSM-10222	BRD-K29568987, SID134961948	56835214	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29-/m0/s1	RWOMJVAVZPFCIF-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K29568987	BRD-K29568987-001-01-3	Broad Institute of MIT and Harvard	BRD-K29568987			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29-/m0/s1	RWOMJVAVZPFCIF-SYZUXVNWSA-N	547.214091876							98843
BRD-K50733069	LSM-11519		56835518	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21-,28+/m1/s1	VUGFGKFGZUURHO-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K50733069	BRD-K50733069-001-01-6	Broad Institute of MIT and Harvard	BRD-K50733069			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21-,28+/m1/s1	VUGFGKFGZUURHO-CJYOKPGZSA-N	590.206227466							100140
BRD-K24855614	LSM-9941		54637722	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21-,28-/m1/s1	VUGFGKFGZUURHO-UMQWNRPGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K24855614	BRD-K24855614-001-01-0	Broad Institute of MIT and Harvard	BRD-K24855614			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21-,28-/m1/s1	VUGFGKFGZUURHO-UMQWNRPGSA-N	590.206227466							98562
BRD-K92604082	LSM-14105		54637835	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20+,25-/m1/s1	YEGLVGBFCXLPBD-OHUGHZGNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K92604082	BRD-K92604082-001-01-2	Broad Institute of MIT and Harvard	BRD-K92604082			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20+,25-/m1/s1	YEGLVGBFCXLPBD-OHUGHZGNSA-N	528.175263524							102759
BRD-K98005081	LSM-14453		54637731	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22-,30+/m1/s1	KFLLAZWDLYDTFJ-WOGZVKCMSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5c(C1=O)n(C)c6ccccc56	BroadT	BRD-K98005081	BRD-K98005081-001-01-7	Broad Institute of MIT and Harvard	BRD-K98005081			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22-,30+/m1/s1	KFLLAZWDLYDTFJ-WOGZVKCMSA-N	598.279134976							103108
BRD-K09276254	LSM-8987		56835411	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30+/m0/s1	ZFRPCBGONKGXGW-DDFCPOBKSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K09276254	BRD-K09276254-001-01-3	Broad Institute of MIT and Harvard	BRD-K09276254			COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30+/m0/s1	ZFRPCBGONKGXGW-DDFCPOBKSA-N	605.255956688							97608
BRD-K84733605	LSM-13608		56835521	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23-,24-,30-/m0/s1	VBARFQGDBKSOKL-CQUCHYGKSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K84733605	BRD-K84733605-001-01-7	Broad Institute of MIT and Harvard	BRD-K84733605			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23-,24-,30-/m0/s1	VBARFQGDBKSOKL-CQUCHYGKSA-N	529.294056758							102253
BRD-K01289045	LSM-8512		56835353	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27+,28+/m1/s1	QNPXTRYBNJAKIP-HDYVOGQZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K01289045	BRD-K01289045-001-01-8	Broad Institute of MIT and Harvard	BRD-K01289045			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27+,28+/m1/s1	QNPXTRYBNJAKIP-HDYVOGQZSA-N	546.320605864							97133
BRD-K50513128	LSM-11501		56835286	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29+/m1/s1	RPGWXCDGQSLPTH-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K50513128	BRD-K50513128-001-01-1	Broad Institute of MIT and Harvard	BRD-K50513128			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29+/m1/s1	RPGWXCDGQSLPTH-AFKLWXAFSA-N	526.294391116							100122
BRD-K99191181	LSM-14523		54637692	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20+,27+/m1/s1	HAVPCKYPPPKWEI-JVAFGIKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K99191181	BRD-K99191181-001-01-3	Broad Institute of MIT and Harvard	BRD-K99191181			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20+,27+/m1/s1	HAVPCKYPPPKWEI-JVAFGIKQSA-N	594.251205666							103178
BRD-K89502948	LSM-13944		54637818	InChI=1S/C27H33F3N2O4/c1-18-14-32(19(2)16-33)26(35)23-11-7-6-10-22(23)21-9-5-4-8-20(21)17-36-24(18)15-31(3)25(34)12-13-27(28,29)30/h4-11,18-19,24,33H,12-17H2,1-3H3/t18-,19+,24-/m1/s1	VGVIGMMHZQAXDN-YDIMBITNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K89502948	BRD-K89502948-001-01-7	Broad Institute of MIT and Harvard	BRD-K89502948			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H33F3N2O4/c1-18-14-32(19(2)16-33)26(35)23-11-7-6-10-22(23)21-9-5-4-8-20(21)17-36-24(18)15-31(3)25(34)12-13-27(28,29)30/h4-11,18-19,24,33H,12-17H2,1-3H3/t18-,19+,24-/m1/s1	VGVIGMMHZQAXDN-YDIMBITNSA-N	506.239242156							102597
BRD-K24167577	LSM-9889		54637653	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29-/m0/s1	WYYHNXRAZIWUBG-KERYWQKISA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO)c1	BroadT	BRD-K24167577	BRD-K24167577-001-01-5	Broad Institute of MIT and Harvard	BRD-K24167577			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)c1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29-/m0/s1	WYYHNXRAZIWUBG-KERYWQKISA-N	531.273321314							98510
BRD-K36109933	LSM-10605		56835475	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	FTPUTVYFFNSJIR-BXOOBUKZSA-N	COc1ccc(OC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K36109933	BRD-K36109933-001-01-2	Broad Institute of MIT and Harvard	BRD-K36109933			COc1ccc(OC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22+,29+/m1/s1	FTPUTVYFFNSJIR-BXOOBUKZSA-N	532.257336892							99226
BRD-K29381365	LSM-10209		54637727	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29+/m0/s1	ONXKQUJAHGZTDG-IHMCZWCLSA-N	COc1ccccc1NC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K29381365	BRD-K29381365-001-01-3	Broad Institute of MIT and Harvard	BRD-K29381365			COc1ccccc1NC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29+/m0/s1	ONXKQUJAHGZTDG-IHMCZWCLSA-N	531.273321314							98830
BRD-K88608081	LSM-13874		56835281	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26+,32-,33+/m1/s1	UJZHWGMAKJZUOC-IHIRBFILSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K88608081	BRD-K88608081-001-01-0	Broad Institute of MIT and Harvard	BRD-K88608081			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26+,32-,33+/m1/s1	UJZHWGMAKJZUOC-IHIRBFILSA-N	610.351905992							102527
BRD-K79780092	LSM-13297		56835302	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30+/m1/s1	ZFRPCBGONKGXGW-HFZPWKHCSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K79780092	BRD-K79780092-001-01-5	Broad Institute of MIT and Harvard	BRD-K79780092			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30+/m1/s1	ZFRPCBGONKGXGW-HFZPWKHCSA-N	605.255956688							101936
BRD-K66771647	LSM-12497		54637820	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20+,27-/m1/s1	WBCPGODJHKXDGU-IOKPGSKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K66771647	BRD-K66771647-001-01-9	Broad Institute of MIT and Harvard	BRD-K66771647			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20+,27-/m1/s1	WBCPGODJHKXDGU-IOKPGSKQSA-N	573.295119398							101128
BRD-K76581294	LSM-13114		56835211	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26+,27+/m1/s1	PIMBJQHAALXIRA-UXUXNBJMSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K76581294	BRD-K76581294-001-01-6	Broad Institute of MIT and Harvard	BRD-K76581294			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26+,27+/m1/s1	PIMBJQHAALXIRA-UXUXNBJMSA-N	493.294056758							101752
BRD-K70433089	LSM-12724		54637647	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(27-14-8-9-15-28(27)36(32)4)26-13-7-5-12-25(26)21-42-29(22)19-35(3)43(40,41)30-16-10-6-11-24(30)17-34/h5-16,22-23,29,38H,18-21H2,1-4H3/t22-,23+,29-/m0/s1	VOTKEIORIBNPMA-CTWZREHQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K70433089	BRD-K70433089-001-01-5	Broad Institute of MIT and Harvard	BRD-K70433089			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(27-14-8-9-15-28(27)36(32)4)26-13-7-5-12-25(26)21-42-29(22)19-35(3)43(40,41)30-16-10-6-11-24(30)17-34/h5-16,22-23,29,38H,18-21H2,1-4H3/t22-,23+,29-/m0/s1	VOTKEIORIBNPMA-CTWZREHQSA-N	600.240640982							101360
BRD-K71397492	LSM-12795		56835417	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24-,30+/m1/s1	IOQJCBWFRPGQBJ-ZLRJYYBNSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K71397492	BRD-K71397492-001-01-2	Broad Institute of MIT and Harvard	BRD-K71397492			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24-,30+/m1/s1	IOQJCBWFRPGQBJ-ZLRJYYBNSA-N	587.310769462							101432
BRD-K67766243	LSM-12557		54637696	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32-,33+/m1/s1	UJZHWGMAKJZUOC-JRRLLMCYSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K67766243	BRD-K67766243-001-01-6	Broad Institute of MIT and Harvard	BRD-K67766243			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32-,33+/m1/s1	UJZHWGMAKJZUOC-JRRLLMCYSA-N	610.351905992							101188
BRD-K50078508	LSM-11473		56835329	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(27-14-8-9-15-28(27)36(32)4)26-13-7-5-12-25(26)21-42-29(22)19-35(3)43(40,41)30-16-10-6-11-24(30)17-34/h5-16,22-23,29,38H,18-21H2,1-4H3/t22-,23-,29+/m0/s1	VOTKEIORIBNPMA-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K50078508	BRD-K50078508-001-01-5	Broad Institute of MIT and Harvard	BRD-K50078508			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H36N4O5S/c1-22-18-37(23(2)20-38)33(39)32-31(27-14-8-9-15-28(27)36(32)4)26-13-7-5-12-25(26)21-42-29(22)19-35(3)43(40,41)30-16-10-6-11-24(30)17-34/h5-16,22-23,29,38H,18-21H2,1-4H3/t22-,23-,29+/m0/s1	VOTKEIORIBNPMA-SBZVUBOMSA-N	600.240640982							100094
BRD-K63946052	LSM-12332		54637789	InChI=1S/C25H31F3N2O5S/c1-17-12-30(18(2)14-31)24(32)22-11-7-6-10-21(22)20-9-5-4-8-19(20)15-35-23(17)13-29(3)36(33,34)16-25(26,27)28/h4-11,17-18,23,31H,12-16H2,1-3H3/t17-,18+,23-/m0/s1	YLVWKLWKMUPGPR-IXFSTUDKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K63946052	BRD-K63946052-001-01-8	Broad Institute of MIT and Harvard	BRD-K63946052			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C25H31F3N2O5S/c1-17-12-30(18(2)14-31)24(32)22-11-7-6-10-21(22)20-9-5-4-8-19(20)15-35-23(17)13-29(3)36(33,34)16-25(26,27)28/h4-11,17-18,23,31H,12-16H2,1-3H3/t17-,18+,23-/m0/s1	YLVWKLWKMUPGPR-IXFSTUDKSA-N	528.190577402							100959
BRD-K98676361	LSM-14486		56835503	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21+,26+/m1/s1	BBROUNWBLSFMDY-SWYRRKHMSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K98676361	BRD-K98676361-001-01-6	Broad Institute of MIT and Harvard	BRD-K98676361			CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21+,26+/m1/s1	BBROUNWBLSFMDY-SWYRRKHMSA-N	482.278072336							103141
BRD-K56322026	LSM-11834		54637763	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19-,26+/m0/s1	KKDNYDXSJAWXCE-LZJCXSABSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K56322026	BRD-K56322026-001-01-4	Broad Institute of MIT and Harvard	BRD-K56322026			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19-,26+/m0/s1	KKDNYDXSJAWXCE-LZJCXSABSA-N	505.25767125							100459
BRD-K02653582	LSM-14684		54637735	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24-,31+/m1/s1	GHOSBDATJBJZOG-GQIGMWPISA-N	COc1ccc(CNC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45)cc1	BroadT	BRD-K02653582	BRD-K02653582-001-01-3	Broad Institute of MIT and Harvard	BRD-K02653582			COc1ccc(CNC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c2ccccc32)cc1	InChI=1S/C35H42N4O5/c1-23-19-39(24(2)21-40)34(41)33-32(29-12-8-9-13-30(29)38(33)4)28-11-7-6-10-26(28)22-44-31(23)20-37(3)35(42)36-18-25-14-16-27(43-5)17-15-25/h6-17,23-24,31,40H,18-22H2,1-5H3,(H,36,42)/t23-,24-,31+/m1/s1	GHOSBDATJBJZOG-GQIGMWPISA-N	598.315520484							103340
BRD-K09796735	LSM-9026		54637803	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22+,28-/m1/s1	IDILRECQKBLRIF-RZIGYZOXSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO	BroadT	BRD-K09796735	BRD-K09796735-001-01-9	Broad Institute of MIT and Harvard	BRD-K09796735			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22+,28-/m1/s1	IDILRECQKBLRIF-RZIGYZOXSA-N	552.229407582							97647
BRD-K40276799	LSM-10887		54637726	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28-/m1/s1	CYZHERASHFZITE-UMQWNRPGSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K40276799	BRD-K40276799-001-01-6	Broad Institute of MIT and Harvard	BRD-K40276799			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28-/m1/s1	CYZHERASHFZITE-UMQWNRPGSA-N	519.253334798							99508
BRD-K49723782	LSM-11452		56835526	InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23+,30+/m1/s1	BRMWAKMKOMKLLH-HFZPWKHCSA-N	COc1ccc(CNC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K49723782	BRD-K49723782-001-01-7	Broad Institute of MIT and Harvard	BRD-K49723782			COc1ccc(CNC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23+,30+/m1/s1	BRMWAKMKOMKLLH-HFZPWKHCSA-N	545.288971378							100073
BRD-K87748653	LSM-13809		54637830	InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19+,26-/m1/s1	UYIXVJNNAXNMSD-UYXZNNOOSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K87748653	BRD-K87748653-001-01-3	Broad Institute of MIT and Harvard	BRD-K87748653			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19+,26-/m1/s1	UYIXVJNNAXNMSD-UYXZNNOOSA-N	541.22465656							102458
BRD-K11296387	LSM-9116		54637793	InChI=1S/C33H40N2O5/c1-23-18-35(24(2)21-36)33(37)29-14-7-6-13-28(29)27-12-5-4-10-26(27)22-40-31(23)20-34(3)19-25-11-8-15-30-32(25)39-17-9-16-38-30/h4-8,10-15,23-24,31,36H,9,16-22H2,1-3H3/t23-,24+,31+/m0/s1	MEBNTFIGGVDNJI-BKZGZDJESA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K11296387	BRD-K11296387-001-01-7	Broad Institute of MIT and Harvard	BRD-K11296387			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H40N2O5/c1-23-18-35(24(2)21-36)33(37)29-14-7-6-13-28(29)27-12-5-4-10-26(27)22-40-31(23)20-34(3)19-25-11-8-15-30-32(25)39-17-9-16-38-30/h4-8,10-15,23-24,31,36H,9,16-22H2,1-3H3/t23-,24+,31+/m0/s1	MEBNTFIGGVDNJI-BKZGZDJESA-N	544.2937224							97737
BRD-K57695422-001-01-2	LSM-33656	BRD-K57695422	54637750	InChI=1S/C33H41N3O4/c1-23-18-36(24(2)21-37)33(38)29-12-8-7-11-28(29)27-10-6-5-9-26(27)22-40-32(23)20-34(3)19-25-13-14-30-31(17-25)39-16-15-35(30)4/h5-14,17,23-24,32,37H,15-16,18-22H2,1-4H3/t23-,24+,32-/m0/s1	LYDBHCHWWOEKQE-XNSHOJTPSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K57695422	BRD-K57695422-001-01-2	Broad Institute of MIT and Harvard	BRD-K57695422			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H41N3O4/c1-23-18-36(24(2)21-37)33(38)29-12-8-7-11-28(29)27-10-6-5-9-26(27)22-40-32(23)20-34(3)19-25-13-14-30-31(17-25)39-16-15-35(30)4/h5-14,17,23-24,32,37H,15-16,18-22H2,1-4H3/t23-,24+,32-/m0/s1	LYDBHCHWWOEKQE-XNSHOJTPSA-N	543.309706822							122213
BRD-K79235289	LSM-13270		56835228	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21+,28+/m1/s1	VUGFGKFGZUURHO-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K79235289	BRD-K79235289-001-01-3	Broad Institute of MIT and Harvard	BRD-K79235289			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21+,28+/m1/s1	VUGFGKFGZUURHO-GGJMMHKRSA-N	590.206227466							101909
BRD-K91572503	LSM-14052		54637681	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27+,28-/m1/s1	QNPXTRYBNJAKIP-BYXJMBFLSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K91572503	BRD-K91572503-001-01-3	Broad Institute of MIT and Harvard	BRD-K91572503			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27+,28-/m1/s1	QNPXTRYBNJAKIP-BYXJMBFLSA-N	546.320605864							102705
BRD-K28663733	LSM-10168		56835554	InChI=1S/C31H38N2O4/c1-22-17-33(23(2)20-34)31(35)28-15-9-8-14-27(28)26-13-7-5-12-25(26)21-37-30(22)19-32(3)18-24-11-6-10-16-29(24)36-4/h5-16,22-23,30,34H,17-21H2,1-4H3/t22-,23-,30-/m0/s1	VZCRYBFAFAJOLC-ZRLASMASSA-N	COc1ccccc1CN(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO	BroadT	BRD-K28663733	BRD-K28663733-001-01-0	Broad Institute of MIT and Harvard	BRD-K28663733			COc1ccccc1CN(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C31H38N2O4/c1-22-17-33(23(2)20-34)31(35)28-15-9-8-14-27(28)26-13-7-5-12-25(26)21-37-30(22)19-32(3)18-24-11-6-10-16-29(24)36-4/h5-16,22-23,30,34H,17-21H2,1-4H3/t22-,23-,30-/m0/s1	VZCRYBFAFAJOLC-ZRLASMASSA-N	502.283157716							98789
BRD-K55129824	LSM-11770		54637673	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23+,29-/m0/s1	INXMEFHWZGRULI-CTWZREHQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K55129824	BRD-K55129824-001-01-8	Broad Institute of MIT and Harvard	BRD-K55129824			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23+,29-/m0/s1	INXMEFHWZGRULI-CTWZREHQSA-N	560.336255928							100395
CHEMBL2355627	LSM-11872	BRD-K56931391, SID134962139	56835405	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26+,32-,33+/m0/s1	UJZHWGMAKJZUOC-ZOWCYTSZSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K56931391	BRD-K56931391-001-01-9	Broad Institute of MIT and Harvard	BRD-K56931391			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26+,32-,33+/m0/s1	UJZHWGMAKJZUOC-ZOWCYTSZSA-N	610.351905992							100498
BRD-K84749975	LSM-13610		54637641	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29+,30-/m0/s1	DVGPQCDULGSEFB-XGMTZGAUSA-N	CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO)c4ccccc4	BroadT	BRD-K84749975	BRD-K84749975-001-01-5	Broad Institute of MIT and Harvard	BRD-K84749975			CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29+,30-/m0/s1	DVGPQCDULGSEFB-XGMTZGAUSA-N	530.278072336							102255
BRD-K84596673	LSM-13599		54637656	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21-,26+/m0/s1	BBROUNWBLSFMDY-ISJBWFOZSA-N	CC(C)COC(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K84596673	BRD-K84596673-001-01-5	Broad Institute of MIT and Harvard	BRD-K84596673			CC(C)COC(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21-,26+/m0/s1	BBROUNWBLSFMDY-ISJBWFOZSA-N	482.278072336							102243
BRD-K64341172	LSM-12354		56835322	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29+/m0/s1	RPGWXCDGQSLPTH-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K64341172	BRD-K64341172-001-01-6	Broad Institute of MIT and Harvard	BRD-K64341172			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29+/m0/s1	RPGWXCDGQSLPTH-SBZVUBOMSA-N	526.294391116							100981
BRD-K93459801	LSM-14159		54637775	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26-,27-/m1/s1	PIMBJQHAALXIRA-RLKINFHOSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K93459801	BRD-K93459801-001-01-0	Broad Institute of MIT and Harvard	BRD-K93459801			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26-,27-/m1/s1	PIMBJQHAALXIRA-RLKINFHOSA-N	493.294056758							102813
BRD-K21787371	LSM-9751		56835421	InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19-,26+/m1/s1	UYIXVJNNAXNMSD-UDCNLSRBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K21787371	BRD-K21787371-001-01-1	Broad Institute of MIT and Harvard	BRD-K21787371			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19-,26+/m1/s1	UYIXVJNNAXNMSD-UDCNLSRBSA-N	541.22465656							98372
BRD-K99219003	LSM-14525		54637779	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25-,31-,32+/m0/s1	ZQFGNRPCSITOFH-PJKYEMGBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K99219003	BRD-K99219003-001-01-8	Broad Institute of MIT and Harvard	BRD-K99219003			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25-,31-,32+/m0/s1	ZQFGNRPCSITOFH-PJKYEMGBSA-N	557.325356886							103180
BRD-K51556413	LSM-11580		54637683	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27+,28-/m0/s1	QNPXTRYBNJAKIP-VPCISXJNSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K51556413	BRD-K51556413-001-01-3	Broad Institute of MIT and Harvard	BRD-K51556413			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27+,28-/m0/s1	QNPXTRYBNJAKIP-VPCISXJNSA-N	546.320605864							100203
BRD-K06688693	LSM-8820		56835545	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20-,25-/m0/s1	JSYMGQYFJZOBEJ-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K06688693	BRD-K06688693-001-01-1	Broad Institute of MIT and Harvard	BRD-K06688693			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20-,25-/m0/s1	JSYMGQYFJZOBEJ-RLSLOFABSA-N	526.224990918							97441
BRD-K84691165	LSM-13604		54637643	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23+,29-,30+/m0/s1	DVGPQCDULGSEFB-WZQNMIHXSA-N	CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO)c4ccccc4	BroadT	BRD-K84691165	BRD-K84691165-001-01-9	Broad Institute of MIT and Harvard	BRD-K84691165			CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23+,29-,30+/m0/s1	DVGPQCDULGSEFB-WZQNMIHXSA-N	530.278072336							102249
BRD-K65968856	LSM-12452		54637814	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23-,24-,30-/m1/s1	VBARFQGDBKSOKL-NULUGNBJSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K65968856	BRD-K65968856-001-01-8	Broad Institute of MIT and Harvard	BRD-K65968856			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23-,24-,30-/m1/s1	VBARFQGDBKSOKL-NULUGNBJSA-N	529.294056758							101080
CHEMBL3188468	LSM-12384	BRD-K64701969	54637733	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22+,30-/m1/s1	KFLLAZWDLYDTFJ-VDZJOXJSSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5c(C1=O)n(C)c6ccccc56	BroadT	BRD-K64701969	BRD-K64701969-001-01-8	Broad Institute of MIT and Harvard	BRD-K64701969			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22+,30-/m1/s1	KFLLAZWDLYDTFJ-VDZJOXJSSA-N	598.279134976							101011
BRD-K45713168	LSM-11216		54637794	InChI=1S/C33H40N2O5/c1-23-18-35(24(2)21-36)33(37)29-14-7-6-13-28(29)27-12-5-4-10-26(27)22-40-31(23)20-34(3)19-25-11-8-15-30-32(25)39-17-9-16-38-30/h4-8,10-15,23-24,31,36H,9,16-22H2,1-3H3/t23-,24+,31-/m0/s1	MEBNTFIGGVDNJI-JLELKNTQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K45713168	BRD-K45713168-001-01-6	Broad Institute of MIT and Harvard	BRD-K45713168			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc3OCCCOc23)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H40N2O5/c1-23-18-35(24(2)21-36)33(37)29-14-7-6-13-28(29)27-12-5-4-10-26(27)22-40-31(23)20-34(3)19-25-11-8-15-30-32(25)39-17-9-16-38-30/h4-8,10-15,23-24,31,36H,9,16-22H2,1-3H3/t23-,24+,31-/m0/s1	MEBNTFIGGVDNJI-JLELKNTQSA-N	544.2937224							99837
BRD-K90630790	LSM-14011		54637652	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29+/m0/s1	WYYHNXRAZIWUBG-DKGMKSHISA-N	COc1cccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO)c1	BroadT	BRD-K90630790	BRD-K90630790-001-01-2	Broad Institute of MIT and Harvard	BRD-K90630790			COc1cccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)c1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22+,29+/m0/s1	WYYHNXRAZIWUBG-DKGMKSHISA-N	531.273321314							102664
BRD-K34433706	LSM-10508		54637706	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20+,25-/m0/s1	RDYUFLZMPZQAJV-DFIYOIEZSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K34433706	BRD-K34433706-001-01-3	Broad Institute of MIT and Harvard	BRD-K34433706			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20+,25-/m0/s1	RDYUFLZMPZQAJV-DFIYOIEZSA-N	559.265791262							99129
BRD-K22324798	LSM-9781		54637812	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23+,24+,30-/m1/s1	VBARFQGDBKSOKL-DLWGQWRRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K22324798	BRD-K22324798-001-01-7	Broad Institute of MIT and Harvard	BRD-K22324798			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23+,24+,30-/m1/s1	VBARFQGDBKSOKL-DLWGQWRRSA-N	529.294056758							98402
BRD-K02475229	LSM-8588		54637665	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30+,33-/m1/s1	ZXKFKEACMTVYCV-OKNJLMBYSA-N	CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K02475229	BRD-K02475229-001-01-0	Broad Institute of MIT and Harvard	BRD-K02475229			CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30+,33-/m1/s1	ZXKFKEACMTVYCV-OKNJLMBYSA-N	583.304621442							97209
BRD-K50325283	LSM-11492		54637769	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20-,25-/m1/s1	JSYMGQYFJZOBEJ-UMEGOILYSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K50325283	BRD-K50325283-001-01-1	Broad Institute of MIT and Harvard	BRD-K50325283			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20-,25-/m1/s1	JSYMGQYFJZOBEJ-UMEGOILYSA-N	526.224990918							100113
BRD-K77579348	LSM-13166		56835482	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23-,24+,30+/m1/s1	VBARFQGDBKSOKL-UCTCLUAXSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K77579348	BRD-K77579348-001-01-5	Broad Institute of MIT and Harvard	BRD-K77579348			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23-,24+,30+/m1/s1	VBARFQGDBKSOKL-UCTCLUAXSA-N	529.294056758							101804
BRD-K20255967	LSM-9665		54637753	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22+,29-/m0/s1	FTPUTVYFFNSJIR-KERYWQKISA-N	COc1ccc(OC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K20255967	BRD-K20255967-001-01-0	Broad Institute of MIT and Harvard	BRD-K20255967			COc1ccc(OC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22+,29-/m0/s1	FTPUTVYFFNSJIR-KERYWQKISA-N	532.257336892							98286
BRD-K62839271	LSM-12249		56835340	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19+,24+/m0/s1	WKBGSUAXJVLQSN-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K62839271	BRD-K62839271-001-01-1	Broad Institute of MIT and Harvard	BRD-K62839271			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19+,24+/m0/s1	WKBGSUAXJVLQSN-XLNZFTOWSA-N	449.26784201							100875
BRD-K42969667	LSM-11040		54637679	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27+,28-/m0/s1	QNPXTRYBNJAKIP-IZHPJMONSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K42969667	BRD-K42969667-001-01-3	Broad Institute of MIT and Harvard	BRD-K42969667			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27+,28-/m0/s1	QNPXTRYBNJAKIP-IZHPJMONSA-N	546.320605864							99661
BRD-K63494246	LSM-12294		54637682	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27-,28-/m1/s1	QNPXTRYBNJAKIP-JGZRHYTASA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K63494246	BRD-K63494246-001-01-6	Broad Institute of MIT and Harvard	BRD-K63494246			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27-,28-/m1/s1	QNPXTRYBNJAKIP-JGZRHYTASA-N	546.320605864							100920
BRD-K82909508	LSM-13492		54637766	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20+,25+/m0/s1	JSYMGQYFJZOBEJ-WZOHSFFVSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K82909508	BRD-K82909508-001-01-3	Broad Institute of MIT and Harvard	BRD-K82909508			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20+,25+/m0/s1	JSYMGQYFJZOBEJ-WZOHSFFVSA-N	526.224990918							102133
BRD-K45231555	LSM-11182		54637702	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32-,33-/m0/s1	UJZHWGMAKJZUOC-SWWUGJJYSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K45231555	BRD-K45231555-001-01-0	Broad Institute of MIT and Harvard	BRD-K45231555			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26-,32-,33-/m0/s1	UJZHWGMAKJZUOC-SWWUGJJYSA-N	610.351905992							99803
BRD-K74712058	LSM-13008		56835312	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24+/m0/s1	WKBGSUAXJVLQSN-AXHZCLLHSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K74712058	BRD-K74712058-001-01-5	Broad Institute of MIT and Harvard	BRD-K74712058			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24+/m0/s1	WKBGSUAXJVLQSN-AXHZCLLHSA-N	449.26784201							101645
BRD-K86219348	LSM-13710		56835489	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-41-28(20)17-36(3)30(40)35-27-15-9-8-14-26(27)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28+/m1/s1	AAENOGRDWGDRJO-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K86219348	BRD-K86219348-001-01-7	Broad Institute of MIT and Harvard	BRD-K86219348			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccccc2C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H34F3N3O4/c1-20-16-37(21(2)18-38)29(39)25-13-7-6-12-24(25)23-11-5-4-10-22(23)19-41-28(20)17-36(3)30(40)35-27-15-9-8-14-26(27)31(32,33)34/h4-15,20-21,28,38H,16-19H2,1-3H3,(H,35,40)/t20-,21-,28+/m1/s1	AAENOGRDWGDRJO-CJYOKPGZSA-N	569.250141198							102358
BRD-K44681861	LSM-11145		56835483	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27-,28+/m0/s1	QNPXTRYBNJAKIP-TVCBXBRYSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K44681861	BRD-K44681861-001-01-6	Broad Institute of MIT and Harvard	BRD-K44681861			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27-,28+/m0/s1	QNPXTRYBNJAKIP-TVCBXBRYSA-N	546.320605864							99766
BRD-K66442181	LSM-12476		54637684	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27+,28-/m1/s1	QNPXTRYBNJAKIP-BWLGUYNBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K66442181	BRD-K66442181-001-01-9	Broad Institute of MIT and Harvard	BRD-K66442181			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27+,28-/m1/s1	QNPXTRYBNJAKIP-BWLGUYNBSA-N	546.320605864							101107
BRD-K63832750	LSM-12317		54637655	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m1/s1	WYYHNXRAZIWUBG-IEOSBIPESA-N	COc1cccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO)c1	BroadT	BRD-K63832750	BRD-K63832750-001-01-5	Broad Institute of MIT and Harvard	BRD-K63832750			COc1cccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@H](C)CO)c1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m1/s1	WYYHNXRAZIWUBG-IEOSBIPESA-N	531.273321314							100944
BRD-K80211979	LSM-13328		54637662	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29-/m0/s1	RPGWXCDGQSLPTH-BOSRLCDASA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K80211979	BRD-K80211979-001-01-6	Broad Institute of MIT and Harvard	BRD-K80211979			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23-,29-/m0/s1	RPGWXCDGQSLPTH-BOSRLCDASA-N	526.294391116							101967
BRD-K10893406	LSM-9094		54637771	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26+,27+/m0/s1	PIMBJQHAALXIRA-YXVKNGOVSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K10893406	BRD-K10893406-001-01-9	Broad Institute of MIT and Harvard	BRD-K10893406			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26+,27+/m0/s1	PIMBJQHAALXIRA-YXVKNGOVSA-N	493.294056758							97715
BRD-K09424864	LSM-8999		54637755	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22-,29-/m1/s1	FTPUTVYFFNSJIR-IEOSBIPESA-N	COc1ccc(OC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K09424864	BRD-K09424864-001-01-1	Broad Institute of MIT and Harvard	BRD-K09424864			COc1ccc(OC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22-,29-/m1/s1	FTPUTVYFFNSJIR-IEOSBIPESA-N	532.257336892							97620
BRD-K77434972	LSM-13164		56835430	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29-,30-/m0/s1	DVGPQCDULGSEFB-HKJOVFRDSA-N	CO[C@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO)c4ccccc4	BroadT	BRD-K77434972	BRD-K77434972-001-01-6	Broad Institute of MIT and Harvard	BRD-K77434972			CO[C@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29-,30-/m0/s1	DVGPQCDULGSEFB-HKJOVFRDSA-N	530.278072336							101802
BRD-K59039774	LSM-11998		56835528	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23+,29+,30-/m1/s1	DVGPQCDULGSEFB-UEABVZRBSA-N	CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO)c4ccccc4	BroadT	BRD-K59039774	BRD-K59039774-001-01-5	Broad Institute of MIT and Harvard	BRD-K59039774			CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23+,29+,30-/m1/s1	DVGPQCDULGSEFB-UEABVZRBSA-N	530.278072336							100624
BRD-K97722864	LSM-14431		56835291	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23+,29+/m1/s1	INXMEFHWZGRULI-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K97722864	BRD-K97722864-001-01-1	Broad Institute of MIT and Harvard	BRD-K97722864			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23+,29+/m1/s1	INXMEFHWZGRULI-AFKLWXAFSA-N	560.336255928							103086
BRD-K41017712	LSM-10925		56835325	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23-,31+/m0/s1	NTGYADANNGAILP-WDCWYOMISA-N	COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45)c(OC)c1	BroadT	BRD-K41017712	BRD-K41017712-001-01-7	Broad Institute of MIT and Harvard	BRD-K41017712			COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c2ccccc32)c(OC)c1	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23-,31+/m0/s1	NTGYADANNGAILP-WDCWYOMISA-N	614.310435104							99546
CHEMBL3185727	LSM-8825	BRD-K06725649	54637672	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30-,33-/m1/s1	ZXKFKEACMTVYCV-IIENPIHPSA-N	CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K06725649	BRD-K06725649-001-01-6	Broad Institute of MIT and Harvard	BRD-K06725649			CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30-,33-/m1/s1	ZXKFKEACMTVYCV-IIENPIHPSA-N	583.304621442							97446
BRD-K83030741	LSM-13503		56835418	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29+/m1/s1	ONXKQUJAHGZTDG-QLVXXPONSA-N	COc1ccccc1NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO	BroadT	BRD-K83030741	BRD-K83030741-001-01-4	Broad Institute of MIT and Harvard	BRD-K83030741			COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-39-29(21)18-33(3)31(37)32-27-15-9-10-16-28(27)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29+/m1/s1	ONXKQUJAHGZTDG-QLVXXPONSA-N	531.273321314							102144
BRD-K72095065	LSM-12846		54637828	InChI=1S/C26H36N2O3/c1-5-14-27(4)16-25-19(2)15-28(20(3)17-29)26(30)24-13-9-8-12-23(24)22-11-7-6-10-21(22)18-31-25/h6-13,19-20,25,29H,5,14-18H2,1-4H3/t19-,20+,25-/m1/s1	ZBAWZCZLBCSXDL-OHUGHZGNSA-N	CCCN(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@@H](C)CO	BroadT	BRD-K72095065	BRD-K72095065-001-01-8	Broad Institute of MIT and Harvard	BRD-K72095065			CCCN(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@@H](C)CO	InChI=1S/C26H36N2O3/c1-5-14-27(4)16-25-19(2)15-28(20(3)17-29)26(30)24-13-9-8-12-23(24)22-11-7-6-10-21(22)18-31-25/h6-13,19-20,25,29H,5,14-18H2,1-4H3/t19-,20+,25-/m1/s1	ZBAWZCZLBCSXDL-OHUGHZGNSA-N	424.272593032							101483
BRD-K03706963	LSM-8659		54637806	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21+,29-/m0/s1	APWUXYFXBMGRIO-FONBTEPMSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K03706963	BRD-K03706963-001-01-7	Broad Institute of MIT and Harvard	BRD-K03706963			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21+,29-/m0/s1	APWUXYFXBMGRIO-FONBTEPMSA-N	545.25258587							97280
BRD-K66559265	LSM-12480		54637760	InChI=1S/C23H30N2O3/c1-16-13-25(17(2)14-26)23(27)21-11-7-6-10-20(21)19-9-5-4-8-18(19)15-28-22(16)12-24-3/h4-11,16-17,22,24,26H,12-15H2,1-3H3/t16-,17+,22+/m0/s1	VMUIUYUBOUUZSN-GSHUGGBRSA-N	CNC[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO	BroadT	BRD-K66559265	BRD-K66559265-001-01-9	Broad Institute of MIT and Harvard	BRD-K66559265			CNC[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C23H30N2O3/c1-16-13-25(17(2)14-26)23(27)21-11-7-6-10-20(21)19-9-5-4-8-18(19)15-28-22(16)12-24-3/h4-11,16-17,22,24,26H,12-15H2,1-3H3/t16-,17+,22+/m0/s1	VMUIUYUBOUUZSN-GSHUGGBRSA-N	382.22564284							101111
BRD-K18883945	LSM-9560		54637685	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27-,28-/m1/s1	QNPXTRYBNJAKIP-TUJIQRHUSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K18883945	BRD-K18883945-001-01-0	Broad Institute of MIT and Harvard	BRD-K18883945			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22-,27-,28-/m1/s1	QNPXTRYBNJAKIP-TUJIQRHUSA-N	546.320605864							98181
BRD-K63164901	LSM-12271		56835516	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	FTPUTVYFFNSJIR-QLVXXPONSA-N	COc1ccc(OC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K63164901	BRD-K63164901-001-01-1	Broad Institute of MIT and Harvard	BRD-K63164901			COc1ccc(OC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C31H36N2O6/c1-21-17-33(22(2)19-34)30(35)28-12-8-7-11-27(28)26-10-6-5-9-23(26)20-38-29(21)18-32(3)31(36)39-25-15-13-24(37-4)14-16-25/h5-16,21-22,29,34H,17-20H2,1-4H3/t21-,22-,29+/m1/s1	FTPUTVYFFNSJIR-QLVXXPONSA-N	532.257336892							100897
BRD-K37960810	LSM-10728		56835230	InChI=1S/C31H36N2O4/c1-22-18-33(23(2)20-34)31(36)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-37-29(22)19-32(3)30(35)17-24-11-5-4-6-12-24/h4-16,22-23,29,34H,17-21H2,1-3H3/t22-,23+,29+/m1/s1	VEXUQYCDGUTBQK-AFKLWXAFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K37960810	BRD-K37960810-001-01-5	Broad Institute of MIT and Harvard	BRD-K37960810			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O4/c1-22-18-33(23(2)20-34)31(36)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-37-29(22)19-32(3)30(35)17-24-11-5-4-6-12-24/h4-16,22-23,29,34H,17-21H2,1-3H3/t22-,23+,29+/m1/s1	VEXUQYCDGUTBQK-AFKLWXAFSA-N	500.267507652							99349
BRD-K75403700	LSM-13042		54637765	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19-,26-/m1/s1	KKDNYDXSJAWXCE-LJKQEARRSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K75403700	BRD-K75403700-001-01-2	Broad Institute of MIT and Harvard	BRD-K75403700			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19-,26-/m1/s1	KKDNYDXSJAWXCE-LJKQEARRSA-N	505.25767125							101679
BRD-K38717348	LSM-10776		56835552	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-25(26)20-38-29(21)18-32(3)17-23-9-8-11-24(15-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22-,29-/m0/s1	QELHGDMSGADVOM-SYZUXVNWSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(=O)O)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K38717348	BRD-K38717348-001-01-9	Broad Institute of MIT and Harvard	BRD-K38717348			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccc(c2)C(O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-25(26)20-38-29(21)18-32(3)17-23-9-8-11-24(15-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22-,29-/m0/s1	QELHGDMSGADVOM-SYZUXVNWSA-N	516.262422272							99397
BRD-K61076106	LSM-12124		56835215	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m0/s1	WYYHNXRAZIWUBG-SYZUXVNWSA-N	COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO)c1	BroadT	BRD-K61076106	BRD-K61076106-001-01-2	Broad Institute of MIT and Harvard	BRD-K61076106			COc1cccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)c1	InChI=1S/C31H37N3O5/c1-21-17-34(22(2)19-35)30(36)28-15-8-7-14-27(28)26-13-6-5-10-23(26)20-39-29(21)18-33(3)31(37)32-24-11-9-12-25(16-24)38-4/h5-16,21-22,29,35H,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m0/s1	WYYHNXRAZIWUBG-SYZUXVNWSA-N	531.273321314							100750
BRD-K15389391	LSM-9347		54637788	InChI=1S/C25H31F3N2O5S/c1-17-12-30(18(2)14-31)24(32)22-11-7-6-10-21(22)20-9-5-4-8-19(20)15-35-23(17)13-29(3)36(33,34)16-25(26,27)28/h4-11,17-18,23,31H,12-16H2,1-3H3/t17-,18+,23+/m0/s1	YLVWKLWKMUPGPR-YZZKKUAISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K15389391	BRD-K15389391-001-01-0	Broad Institute of MIT and Harvard	BRD-K15389391			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C25H31F3N2O5S/c1-17-12-30(18(2)14-31)24(32)22-11-7-6-10-21(22)20-9-5-4-8-19(20)15-35-23(17)13-29(3)36(33,34)16-25(26,27)28/h4-11,17-18,23,31H,12-16H2,1-3H3/t17-,18+,23+/m0/s1	YLVWKLWKMUPGPR-YZZKKUAISA-N	528.190577402							97968
BRD-K55295918	LSM-11779		56835547	InChI=1S/C33H41N3O4/c1-23-18-36(24(2)21-37)33(38)29-12-8-7-11-28(29)27-10-6-5-9-26(27)22-40-32(23)20-34(3)19-25-13-14-30-31(17-25)39-16-15-35(30)4/h5-14,17,23-24,32,37H,15-16,18-22H2,1-4H3/t23-,24-,32-/m0/s1	LYDBHCHWWOEKQE-TWVHRYOLSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K55295918	BRD-K55295918-001-01-4	Broad Institute of MIT and Harvard	BRD-K55295918			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3N(C)CCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H41N3O4/c1-23-18-36(24(2)21-37)33(38)29-12-8-7-11-28(29)27-10-6-5-9-26(27)22-40-32(23)20-34(3)19-25-13-14-30-31(17-25)39-16-15-35(30)4/h5-14,17,23-24,32,37H,15-16,18-22H2,1-4H3/t23-,24-,32-/m0/s1	LYDBHCHWWOEKQE-TWVHRYOLSA-N	543.309706822							100404
BRD-K37847786	LSM-10719		54637645	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29-,30-/m1/s1	DVGPQCDULGSEFB-IIJZBOQJSA-N	CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO)c4ccccc4	BroadT	BRD-K37847786	BRD-K37847786-001-01-4	Broad Institute of MIT and Harvard	BRD-K37847786			CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29-,30-/m1/s1	DVGPQCDULGSEFB-IIJZBOQJSA-N	530.278072336							99340
BRD-K08105592	LSM-8918		54637798	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23-,31-/m0/s1	NTGYADANNGAILP-BVXAZASISA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c5ccccc45)c(OC)c1	BroadT	BRD-K08105592	BRD-K08105592-001-01-6	Broad Institute of MIT and Harvard	BRD-K08105592			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@@H](C)CO)n(C)c2ccccc32)c(OC)c1	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23-,31-/m0/s1	NTGYADANNGAILP-BVXAZASISA-N	614.310435104							97539
BRD-K12415987	LSM-9169		56835480	InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19+,26+/m1/s1	UYIXVJNNAXNMSD-MVYHEMRASA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K12415987	BRD-K12415987-001-01-6	Broad Institute of MIT and Harvard	BRD-K12415987			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C28H35N3O6S/c1-18-14-31(19(2)16-32)28(33)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-30(5)38(34,35)27-20(3)29-37-21(27)4/h6-13,18-19,26,32H,14-17H2,1-5H3/t18-,19+,26+/m1/s1	UYIXVJNNAXNMSD-MVYHEMRASA-N	541.22465656							97790
BRD-K19294102	LSM-9588		56835363	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29+/m0/s1	RPGWXCDGQSLPTH-QFWOEDSFSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K19294102	BRD-K19294102-001-01-8	Broad Institute of MIT and Harvard	BRD-K19294102			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29+/m0/s1	RPGWXCDGQSLPTH-QFWOEDSFSA-N	526.294391116							98209
BRD-K56079297	LSM-11819		56835274	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21-,26-/m0/s1	BBROUNWBLSFMDY-WOVHNISZSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@@H](C)CO	BroadT	BRD-K56079297	BRD-K56079297-001-01-2	Broad Institute of MIT and Harvard	BRD-K56079297			CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@@H](C)CO	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21-,26-/m0/s1	BBROUNWBLSFMDY-WOVHNISZSA-N	482.278072336							100444
BRD-K65752719	LSM-12436		54637764	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19+,26-/m0/s1	KKDNYDXSJAWXCE-ANSQWYIGSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K65752719	BRD-K65752719-001-01-3	Broad Institute of MIT and Harvard	BRD-K65752719			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19+,26-/m0/s1	KKDNYDXSJAWXCE-ANSQWYIGSA-N	505.25767125							131205
BRD-K23731136	LSM-9861		54637743	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24+,30-/m1/s1	IOQJCBWFRPGQBJ-FSGGQHMVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K23731136	BRD-K23731136-001-01-3	Broad Institute of MIT and Harvard	BRD-K23731136			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24+,30-/m1/s1	IOQJCBWFRPGQBJ-FSGGQHMVSA-N	587.310769462							98482
BRD-K77791851	LSM-13184		54637715	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-25(26)20-38-29(21)18-32(3)17-23-9-8-11-24(15-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22-,29-/m1/s1	QELHGDMSGADVOM-IEOSBIPESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K77791851	BRD-K77791851-001-01-5	Broad Institute of MIT and Harvard	BRD-K77791851			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-25(26)20-38-29(21)18-32(3)17-23-9-8-11-24(15-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22-,29-/m1/s1	QELHGDMSGADVOM-IEOSBIPESA-N	516.262422272							101822
BRD-K99128867	LSM-14516		56835336	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23-,29+/m0/s1	INXMEFHWZGRULI-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K99128867	BRD-K99128867-001-01-6	Broad Institute of MIT and Harvard	BRD-K99128867			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C33H44N4O4/c1-22-18-37(23(2)20-38)32(39)31-30(27-16-10-11-17-28(27)36(31)4)26-15-9-8-12-24(26)21-41-29(22)19-35(3)33(40)34-25-13-6-5-7-14-25/h8-12,15-17,22-23,25,29,38H,5-7,13-14,18-21H2,1-4H3,(H,34,40)/t22-,23-,29+/m0/s1	INXMEFHWZGRULI-SBZVUBOMSA-N	560.336255928							103171
BRD-K11577165	LSM-9133		54637694	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)27-14-8-7-13-26(27)25-12-6-4-11-24(25)20-38-28(21)18-32(3)39(36,37)29-15-9-5-10-23(29)16-31/h4-15,21-22,28,34H,17-20H2,1-3H3/t21-,22+,28-/m1/s1	CWLJLYLZQZUHCH-RZIGYZOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K11577165	BRD-K11577165-001-01-8	Broad Institute of MIT and Harvard	BRD-K11577165			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)27-14-8-7-13-26(27)25-12-6-4-11-24(25)20-38-28(21)18-32(3)39(36,37)29-15-9-5-10-23(29)16-31/h4-15,21-22,28,34H,17-20H2,1-3H3/t21-,22+,28-/m1/s1	CWLJLYLZQZUHCH-RZIGYZOXSA-N	547.214091876							97754
BRD-K15530151	LSM-9359		56835431	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26+,27-/m0/s1	PIMBJQHAALXIRA-XMODGQSNSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K15530151	BRD-K15530151-001-01-9	Broad Institute of MIT and Harvard	BRD-K15530151			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26+,27-/m0/s1	PIMBJQHAALXIRA-XMODGQSNSA-N	493.294056758							97980
BRD-K42048463	LSM-10981		56835459	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21-,29+/m1/s1	APWUXYFXBMGRIO-RLCGNTSFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K42048463	BRD-K42048463-001-01-2	Broad Institute of MIT and Harvard	BRD-K42048463			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H35N3O6/c1-20-15-34(21(2)17-35)30(36)26-11-7-6-10-25(26)24-9-5-4-8-22(24)18-38-29(20)16-33(3)31(37)32-23-12-13-27-28(14-23)40-19-39-27/h4-14,20-21,29,35H,15-19H2,1-3H3,(H,32,37)/t20-,21-,29+/m1/s1	APWUXYFXBMGRIO-RLCGNTSFSA-N	545.25258587							99602
BRD-K99349510	LSM-14533		54637811	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23+,24-,30-/m0/s1	VBARFQGDBKSOKL-PUMORYBASA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K99349510	BRD-K99349510-001-01-9	Broad Institute of MIT and Harvard	BRD-K99349510			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23+,24-,30-/m0/s1	VBARFQGDBKSOKL-PUMORYBASA-N	529.294056758							103188
BRD-K80342168	LSM-13338		54637795	InChI=1S/C33H40N2O5/c1-23-18-35(24(2)21-36)33(37)29-14-7-6-13-28(29)27-12-5-4-10-26(27)22-40-31(23)20-34(3)19-25-11-8-15-30-32(25)39-17-9-16-38-30/h4-8,10-15,23-24,31,36H,9,16-22H2,1-3H3/t23-,24+,31-/m1/s1	MEBNTFIGGVDNJI-ULPIOCOXSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K80342168	BRD-K80342168-001-01-0	Broad Institute of MIT and Harvard	BRD-K80342168			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2cccc3OCCCOc23)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H40N2O5/c1-23-18-35(24(2)21-36)33(37)29-14-7-6-13-28(29)27-12-5-4-10-26(27)22-40-31(23)20-34(3)19-25-11-8-15-30-32(25)39-17-9-16-38-30/h4-8,10-15,23-24,31,36H,9,16-22H2,1-3H3/t23-,24+,31-/m1/s1	MEBNTFIGGVDNJI-ULPIOCOXSA-N	544.2937224							101977
BRD-K00064877	LSM-8429		54637689	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20-,27-/m0/s1	HAVPCKYPPPKWEI-OSOCVKALSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K00064877	BRD-K00064877-001-01-9	Broad Institute of MIT and Harvard	BRD-K00064877			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20-,27-/m0/s1	HAVPCKYPPPKWEI-OSOCVKALSA-N	594.251205666							97050
BRD-K08706435	LSM-8955		54637800	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22+,28+/m0/s1	IDILRECQKBLRIF-PFPZSTESSA-N	COc1ccccc1S(=O)(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@H](C)CO	BroadT	BRD-K08706435	BRD-K08706435-001-01-2	Broad Institute of MIT and Harvard	BRD-K08706435			COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO	InChI=1S/C30H36N2O6S/c1-21-17-32(22(2)19-33)30(34)26-14-8-7-13-25(26)24-12-6-5-11-23(24)20-38-28(21)18-31(3)39(35,36)29-16-10-9-15-27(29)37-4/h5-16,21-22,28,33H,17-20H2,1-4H3/t21-,22+,28+/m0/s1	IDILRECQKBLRIF-PFPZSTESSA-N	552.229407582							97576
BRD-K96039110	LSM-14320		56835272	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19-,26+/m1/s1	KKDNYDXSJAWXCE-UDCNLSRBSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2c(C)onc2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K96039110	BRD-K96039110-001-01-3	Broad Institute of MIT and Harvard	BRD-K96039110			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2c(C)noc2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O5/c1-18-14-32(19(2)16-33)28(34)25-13-9-8-12-24(25)23-11-7-6-10-22(23)17-36-26(18)15-31(5)29(35)27-20(3)30-37-21(27)4/h6-13,18-19,26,33H,14-17H2,1-5H3/t18-,19-,26+/m1/s1	KKDNYDXSJAWXCE-UDCNLSRBSA-N	505.25767125							102974
CHEMBL2361829	LSM-12178	BRD-K61873274, SID131434101	54637824	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30-/m0/s1	ZFRPCBGONKGXGW-BURCIIJTSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K61873274	BRD-K61873274-001-01-8	Broad Institute of MIT and Harvard	BRD-K61873274			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23+,30-/m0/s1	ZFRPCBGONKGXGW-BURCIIJTSA-N	605.255956688							100804
BRD-K62561943	LSM-12226		54637745	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24+,30+/m1/s1	IOQJCBWFRPGQBJ-QEGDFHJFSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K62561943	BRD-K62561943-001-01-9	Broad Institute of MIT and Harvard	BRD-K62561943			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24+,30+/m1/s1	IOQJCBWFRPGQBJ-QEGDFHJFSA-N	587.310769462							100852
CHEMBL2361471	LSM-13947	BRD-K89551576, SID131433984	54637708	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20-,25-/m0/s1	RDYUFLZMPZQAJV-RLSLOFABSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K89551576	BRD-K89551576-001-01-3	Broad Institute of MIT and Harvard	BRD-K89551576			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C30H36F3N3O4/c1-19-15-36(20(2)17-37)29(39)28-27(23-11-7-8-12-24(23)35(28)4)22-10-6-5-9-21(22)18-40-25(19)16-34(3)26(38)13-14-30(31,32)33/h5-12,19-20,25,37H,13-18H2,1-4H3/t19-,20-,25-/m0/s1	RDYUFLZMPZQAJV-RLSLOFABSA-N	559.265791262							102600
BRD-K25354424	LSM-9968		56835495	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20+,25+/m1/s1	JSYMGQYFJZOBEJ-RNHFSVANSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K25354424	BRD-K25354424-001-01-3	Broad Institute of MIT and Harvard	BRD-K25354424			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cn(C)cn2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H34N4O5S/c1-19-13-31(20(2)16-32)27(33)24-12-8-7-11-23(24)22-10-6-5-9-21(22)17-36-25(19)14-30(4)37(34,35)26-15-29(3)18-28-26/h5-12,15,18-20,25,32H,13-14,16-17H2,1-4H3/t19-,20+,25+/m1/s1	JSYMGQYFJZOBEJ-RNHFSVANSA-N	526.224990918							98589
BRD-K26626929	LSM-10044		54637711	InChI=1S/C31H36N2O4/c1-22-18-33(23(2)20-34)31(36)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-37-29(22)19-32(3)30(35)17-24-11-5-4-6-12-24/h4-16,22-23,29,34H,17-21H2,1-3H3/t22-,23-,29+/m0/s1	VEXUQYCDGUTBQK-SBZVUBOMSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K26626929	BRD-K26626929-001-01-3	Broad Institute of MIT and Harvard	BRD-K26626929			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O4/c1-22-18-33(23(2)20-34)31(36)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-37-29(22)19-32(3)30(35)17-24-11-5-4-6-12-24/h4-16,22-23,29,34H,17-21H2,1-3H3/t22-,23-,29+/m0/s1	VEXUQYCDGUTBQK-SBZVUBOMSA-N	500.267507652							98665
BRD-K50761336	LSM-11523		54637691	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20+,27+/m0/s1	HAVPCKYPPPKWEI-ASHZAFPQSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K50761336	BRD-K50761336-001-01-4	Broad Institute of MIT and Harvard	BRD-K50761336			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20+,27+/m0/s1	HAVPCKYPPPKWEI-ASHZAFPQSA-N	594.251205666							100144
BRD-K24282403	LSM-9901		54637809	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23-,24-,30+/m0/s1	VBARFQGDBKSOKL-ZUHGBKBGSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K24282403	BRD-K24282403-001-01-2	Broad Institute of MIT and Harvard	BRD-K24282403			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23-,24-,30+/m0/s1	VBARFQGDBKSOKL-ZUHGBKBGSA-N	529.294056758							98522
BRD-K63424643	LSM-12289		54637688	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20+,27-/m1/s1	HAVPCKYPPPKWEI-IOKPGSKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K63424643	BRD-K63424643-001-01-2	Broad Institute of MIT and Harvard	BRD-K63424643			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20+,27-/m1/s1	HAVPCKYPPPKWEI-IOKPGSKQSA-N	594.251205666							100915
BRD-K72303429	LSM-12861		54637712	InChI=1S/C31H36N2O4/c1-22-18-33(23(2)20-34)31(36)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-37-29(22)19-32(3)30(35)17-24-11-5-4-6-12-24/h4-16,22-23,29,34H,17-21H2,1-3H3/t22-,23-,29-/m1/s1	VEXUQYCDGUTBQK-VDWGHMIBSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K72303429	BRD-K72303429-001-01-7	Broad Institute of MIT and Harvard	BRD-K72303429			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O4/c1-22-18-33(23(2)20-34)31(36)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-37-29(22)19-32(3)30(35)17-24-11-5-4-6-12-24/h4-16,22-23,29,34H,17-21H2,1-3H3/t22-,23-,29-/m1/s1	VEXUQYCDGUTBQK-VDWGHMIBSA-N	500.267507652							101498
BRD-K71532462	LSM-12803		54637772	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26-,27+/m0/s1	PIMBJQHAALXIRA-LKSLQULUSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K71532462	BRD-K71532462-001-01-0	Broad Institute of MIT and Harvard	BRD-K71532462			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26-,27+/m0/s1	PIMBJQHAALXIRA-LKSLQULUSA-N	493.294056758							101440
BRD-K75961033	LSM-13073		56835541	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25-,31+,32+/m1/s1	ZQFGNRPCSITOFH-PKVSMLHLSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K75961033	BRD-K75961033-001-01-7	Broad Institute of MIT and Harvard	BRD-K75961033			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25-,31+,32+/m1/s1	ZQFGNRPCSITOFH-PKVSMLHLSA-N	557.325356886							101710
BRD-K13000360	LSM-9204		56835564	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31-,32+/m1/s1	ZQFGNRPCSITOFH-ZQZKFXPUSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K13000360	BRD-K13000360-001-01-2	Broad Institute of MIT and Harvard	BRD-K13000360			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31-,32+/m1/s1	ZQFGNRPCSITOFH-ZQZKFXPUSA-N	557.325356886							97825
BRD-K27525788	LSM-10088		54637738	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24-/m0/s1	WKBGSUAXJVLQSN-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K27525788	BRD-K27525788-001-01-6	Broad Institute of MIT and Harvard	BRD-K27525788			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24-/m0/s1	WKBGSUAXJVLQSN-JXQFQVJHSA-N	449.26784201							98709
BRD-K93738295	LSM-14180		54637667	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24+,30-,33-/m1/s1	ZXKFKEACMTVYCV-GYBKAKGQSA-N	CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K93738295	BRD-K93738295-001-01-0	Broad Institute of MIT and Harvard	BRD-K93738295			CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24+,30-,33-/m1/s1	ZXKFKEACMTVYCV-GYBKAKGQSA-N	583.304621442							102834
BRD-K16561564	LSM-9431		56835419	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21-,26+/m1/s1	BBROUNWBLSFMDY-YPCDYVTLSA-N	CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO	BroadT	BRD-K16561564	BRD-K16561564-001-01-4	Broad Institute of MIT and Harvard	BRD-K16561564			CC(C)COC(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO	InChI=1S/C28H38N2O5/c1-19(2)17-35-28(33)29(5)15-26-20(3)14-30(21(4)16-31)27(32)25-13-9-8-12-24(25)23-11-7-6-10-22(23)18-34-26/h6-13,19-21,26,31H,14-18H2,1-5H3/t20-,21-,26+/m1/s1	BBROUNWBLSFMDY-YPCDYVTLSA-N	482.278072336							98052
BRD-K11022579	LSM-9100		54637713	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-25(26)20-38-29(21)18-32(3)17-23-9-8-11-24(15-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22+,29+/m0/s1	QELHGDMSGADVOM-DKGMKSHISA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(=O)O)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K11022579	BRD-K11022579-001-01-5	Broad Institute of MIT and Harvard	BRD-K11022579			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccc(c2)C(O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-25(26)20-38-29(21)18-32(3)17-23-9-8-11-24(15-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22+,29+/m0/s1	QELHGDMSGADVOM-DKGMKSHISA-N	516.262422272							97721
BRD-K74318028	LSM-12979		56835306	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20+,27+/m1/s1	WBCPGODJHKXDGU-JVAFGIKQSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K74318028	BRD-K74318028-001-01-8	Broad Institute of MIT and Harvard	BRD-K74318028			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20+,27+/m1/s1	WBCPGODJHKXDGU-JVAFGIKQSA-N	573.295119398							101616
BRD-K45714982	LSM-11217		56835269	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24-,30-/m0/s1	IOQJCBWFRPGQBJ-JYUFKMNQSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K45714982	BRD-K45714982-001-01-8	Broad Institute of MIT and Harvard	BRD-K45714982			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24-,30-/m0/s1	IOQJCBWFRPGQBJ-JYUFKMNQSA-N	587.310769462							99838
BRD-K07613753	LSM-8886		54637786	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-13-7-6-12-26(27)25-11-5-4-10-24(25)20-35-28(21)18-31(3)17-23-9-8-14-30-15-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22+,28-/m0/s1	JEKWQBVWBTUQQJ-TYPXCFOJSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K07613753	BRD-K07613753-001-01-5	Broad Institute of MIT and Harvard	BRD-K07613753			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H35N3O3/c1-21-16-32(22(2)19-33)29(34)27-13-7-6-12-26(27)25-11-5-4-10-24(25)20-35-28(21)18-31(3)17-23-9-8-14-30-15-23/h4-15,21-22,28,33H,16-20H2,1-3H3/t21-,22+,28-/m0/s1	JEKWQBVWBTUQQJ-TYPXCFOJSA-N	473.26784201							97507
BRD-K00391235	LSM-8451		56835337	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30+,33-/m0/s1	ZXKFKEACMTVYCV-SNBKOBLESA-N	CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K00391235	BRD-K00391235-001-01-3	Broad Institute of MIT and Harvard	BRD-K00391235			CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24-,30+,33-/m0/s1	ZXKFKEACMTVYCV-SNBKOBLESA-N	583.304621442							97072
BRD-K16619158	LSM-9432		56835386	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24+,30+,33-/m0/s1	ZXKFKEACMTVYCV-UXQGJJPQSA-N	CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K16619158	BRD-K16619158-001-01-2	Broad Institute of MIT and Harvard	BRD-K16619158			CO[C@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24+,30+,33-/m0/s1	ZXKFKEACMTVYCV-UXQGJJPQSA-N	583.304621442							98053
CHEMBL2359661	LSM-14526	BRD-K99224100, SID131433936	54637660	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29-/m0/s1	RPGWXCDGQSLPTH-CTWZREHQSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K99224100	BRD-K99224100-001-01-0	Broad Institute of MIT and Harvard	BRD-K99224100			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2cccnc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C32H38N4O3/c1-22-17-36(23(2)20-37)32(38)31-30(27-13-7-8-14-28(27)35(31)4)26-12-6-5-11-25(26)21-39-29(22)19-34(3)18-24-10-9-15-33-16-24/h5-16,22-23,29,37H,17-21H2,1-4H3/t22-,23+,29-/m0/s1	RPGWXCDGQSLPTH-CTWZREHQSA-N	526.294391116							103181
BRD-K87885716	LSM-13824		56835283	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23+,31+/m1/s1	NTGYADANNGAILP-UDKTZTBJSA-N	COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c5ccccc45)c(OC)c1	BroadT	BRD-K87885716	BRD-K87885716-001-01-8	Broad Institute of MIT and Harvard	BRD-K87885716			COc1ccc(NC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(C(=O)N(C[C@H]2C)[C@@H](C)CO)n(C)c2ccccc32)c(OC)c1	InChI=1S/C35H42N4O6/c1-22-18-39(23(2)20-40)34(41)33-32(27-13-9-10-14-29(27)38(33)4)26-12-8-7-11-24(26)21-45-31(22)19-37(3)35(42)36-28-16-15-25(43-5)17-30(28)44-6/h7-17,22-23,31,40H,18-21H2,1-6H3,(H,36,42)/t22-,23+,31+/m1/s1	NTGYADANNGAILP-UDKTZTBJSA-N	614.310435104							102474
BRD-K86427056	LSM-13721		56835204	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-25(26)20-38-29(21)18-32(3)17-23-9-8-11-24(15-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22+,29+/m1/s1	QELHGDMSGADVOM-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(=O)O)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K86427056	BRD-K86427056-001-01-8	Broad Institute of MIT and Harvard	BRD-K86427056			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccc(c2)C(O)=O)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O5/c1-21-16-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-25(26)20-38-29(21)18-32(3)17-23-9-8-11-24(15-23)31(36)37/h4-15,21-22,29,34H,16-20H2,1-3H3,(H,36,37)/t21-,22+,29+/m1/s1	QELHGDMSGADVOM-BXOOBUKZSA-N	516.262422272							102370
CHEMBL2359362	LSM-12720	SID134962290, BRD-K70358157	56835556	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)27-14-8-7-13-26(27)25-12-6-4-11-24(25)20-38-28(21)18-32(3)39(36,37)29-15-9-5-10-23(29)16-31/h4-15,21-22,28,34H,17-20H2,1-3H3/t21-,22-,28-/m0/s1	CWLJLYLZQZUHCH-VPYPWEPUSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K70358157	BRD-K70358157-001-01-1	Broad Institute of MIT and Harvard	BRD-K70358157			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)27-14-8-7-13-26(27)25-12-6-4-11-24(25)20-38-28(21)18-32(3)39(36,37)29-15-9-5-10-23(29)16-31/h4-15,21-22,28,34H,17-20H2,1-3H3/t21-,22-,28-/m0/s1	CWLJLYLZQZUHCH-VPYPWEPUSA-N	547.214091876							101356
BRD-K46533463	LSM-11269		54637823	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30+/m1/s1	ZFRPCBGONKGXGW-JWUQWVJQSA-N	COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]2OCc3ccccc3c4c(C(=O)N(C[C@H]2C)[C@H](C)CO)n(C)c5ccccc45	BroadT	BRD-K46533463	BRD-K46533463-001-01-9	Broad Institute of MIT and Harvard	BRD-K46533463			COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21	InChI=1S/C33H39N3O6S/c1-22-18-36(23(2)20-37)33(38)32-31(28-15-8-9-16-29(28)35(32)4)27-14-7-6-11-24(27)21-42-30(22)19-34(3)43(39,40)26-13-10-12-25(17-26)41-5/h6-17,22-23,30,37H,18-21H2,1-5H3/t22-,23-,30+/m1/s1	ZFRPCBGONKGXGW-JWUQWVJQSA-N	605.255956688							99890
BRD-K97277752	LSM-14407		54637695	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)27-14-8-7-13-26(27)25-12-6-4-11-24(25)20-38-28(21)18-32(3)39(36,37)29-15-9-5-10-23(29)16-31/h4-15,21-22,28,34H,17-20H2,1-3H3/t21-,22-,28-/m1/s1	CWLJLYLZQZUHCH-DQCZWYHMSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K97277752	BRD-K97277752-001-01-1	Broad Institute of MIT and Harvard	BRD-K97277752			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)27-14-8-7-13-26(27)25-12-6-4-11-24(25)20-38-28(21)18-32(3)39(36,37)29-15-9-5-10-23(29)16-31/h4-15,21-22,28,34H,17-20H2,1-3H3/t21-,22-,28-/m1/s1	CWLJLYLZQZUHCH-DQCZWYHMSA-N	547.214091876							103061
BRD-K22825029	LSM-9815		56835533	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23+,24+,30+/m1/s1	VBARFQGDBKSOKL-QAAVFVPKSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K22825029	BRD-K22825029-001-01-4	Broad Institute of MIT and Harvard	BRD-K22825029			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)N[C@@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23+,24+,30+/m1/s1	VBARFQGDBKSOKL-QAAVFVPKSA-N	529.294056758							98436
BRD-K01727336	LSM-8544		54637698	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26+,32+,33-/m0/s1	UJZHWGMAKJZUOC-PSFRKEHKSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K01727336	BRD-K01727336-001-01-5	Broad Institute of MIT and Harvard	BRD-K01727336			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C37H46N4O4/c1-25-21-41(26(2)23-42)37(44)35-34(30-18-12-13-19-31(30)40(35)6)29-17-11-10-16-28(29)24-45-33(25)22-39(5)36(43)32(38(3)4)20-27-14-8-7-9-15-27/h7-19,25-26,32-33,42H,20-24H2,1-6H3/t25-,26+,32+,33-/m0/s1	UJZHWGMAKJZUOC-PSFRKEHKSA-N	610.351905992							97165
BRD-K71287386	LSM-12785		56835199	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29+/m1/s1	RWOMJVAVZPFCIF-BXOOBUKZSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K71287386	BRD-K71287386-001-01-4	Broad Institute of MIT and Harvard	BRD-K71287386			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22+,29+/m1/s1	RWOMJVAVZPFCIF-BXOOBUKZSA-N	547.214091876							101422
BRD-K32326107	LSM-10389		54637666	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24+,30-,33+/m0/s1	ZXKFKEACMTVYCV-HHUUCLDOSA-N	CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K32326107	BRD-K32326107-001-01-6	Broad Institute of MIT and Harvard	BRD-K32326107			CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24+,30-,33+/m0/s1	ZXKFKEACMTVYCV-HHUUCLDOSA-N	583.304621442							99010
CHEMBL2359335	LSM-10404	BRD-K32559936, SID131434015	54637739	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24-/m1/s1	WKBGSUAXJVLQSN-KHCICDEESA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2ccccc2c3c(C1=O)n(C)c4ccccc34	BroadT	BRD-K32559936	BRD-K32559936-001-01-9	Broad Institute of MIT and Harvard	BRD-K32559936			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C27H35N3O3/c1-18-14-30(19(2)16-31)27(32)26-25(22-12-8-9-13-23(22)29(26)5)21-11-7-6-10-20(21)17-33-24(18)15-28(3)4/h6-13,18-19,24,31H,14-17H2,1-5H3/t18-,19-,24-/m1/s1	WKBGSUAXJVLQSN-KHCICDEESA-N	449.26784201							99025
BRD-K98286370	LSM-14467		56835367	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24+,30+,33+/m0/s1	ZXKFKEACMTVYCV-OXGZXGIMSA-N	CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c4ccccc34)c5ccccc5	BroadT	BRD-K98286370	BRD-K98286370-001-01-3	Broad Institute of MIT and Harvard	BRD-K98286370			CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21)c1ccccc1	InChI=1S/C35H41N3O5/c1-23-19-38(24(2)21-39)34(40)32-31(28-17-11-12-18-29(28)37(32)4)27-16-10-9-15-26(27)22-43-30(23)20-36(3)35(41)33(42-5)25-13-7-6-8-14-25/h6-18,23-24,30,33,39H,19-22H2,1-5H3/t23-,24+,30+,33+/m0/s1	ZXKFKEACMTVYCV-OXGZXGIMSA-N	583.304621442							103122
BRD-K85332209	LSM-13648		54637723	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28+/m0/s1	CYZHERASHFZITE-BALWLHIASA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K85332209	BRD-K85332209-001-01-7	Broad Institute of MIT and Harvard	BRD-K85332209			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28+/m0/s1	CYZHERASHFZITE-BALWLHIASA-N	519.253334798							102295
BRD-K34799054	LSM-10523		54637744	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24-,30-/m1/s1	IOQJCBWFRPGQBJ-BOYVUMAVSA-N	C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N3CCOCC3)OCc4ccccc4c5ccccc5C1=O	BroadT	BRD-K34799054	BRD-K34799054-001-01-5	Broad Institute of MIT and Harvard	BRD-K34799054			C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccnc(c2)N2CCOCC2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C33H41N5O5/c1-23-19-38(24(2)21-39)32(40)29-11-7-6-10-28(29)27-9-5-4-8-25(27)22-43-30(23)20-36(3)33(41)35-26-12-13-34-31(18-26)37-14-16-42-17-15-37/h4-13,18,23-24,30,39H,14-17,19-22H2,1-3H3,(H,34,35,41)/t23-,24-,30-/m1/s1	IOQJCBWFRPGQBJ-BOYVUMAVSA-N	587.310769462							99144
BRD-K80174954	LSM-13323		56835235	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29+,30-/m1/s1	DVGPQCDULGSEFB-ZDEDIGJLSA-N	CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@H]1C)[C@H](C)CO)c4ccccc4	BroadT	BRD-K80174954	BRD-K80174954-001-01-5	Broad Institute of MIT and Harvard	BRD-K80174954			CO[C@@H](C(=O)N(C)C[C@@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@H]1C)[C@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23-,29+,30-/m1/s1	DVGPQCDULGSEFB-ZDEDIGJLSA-N	530.278072336							101962
BRD-K59024058	LSM-11997		56835271	InChI=1S/C31H36N2O4/c1-22-18-33(23(2)20-34)31(36)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-37-29(22)19-32(3)30(35)17-24-11-5-4-6-12-24/h4-16,22-23,29,34H,17-21H2,1-3H3/t22-,23-,29+/m1/s1	VEXUQYCDGUTBQK-SGQNLQFHSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K59024058	BRD-K59024058-001-01-4	Broad Institute of MIT and Harvard	BRD-K59024058			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C31H36N2O4/c1-22-18-33(23(2)20-34)31(36)28-16-10-9-15-27(28)26-14-8-7-13-25(26)21-37-29(22)19-32(3)30(35)17-24-11-5-4-6-12-24/h4-16,22-23,29,34H,17-21H2,1-3H3/t22-,23-,29+/m1/s1	VEXUQYCDGUTBQK-SGQNLQFHSA-N	500.267507652							100623
BRD-K44015831	LSM-11116		56835266	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23-,24+,30-/m0/s1	VBARFQGDBKSOKL-WAHOFHFDSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K44015831	BRD-K44015831-001-01-4	Broad Institute of MIT and Harvard	BRD-K44015831			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)N[C@H](C)c2ccccc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C32H39N3O4/c1-22-18-35(23(2)20-36)31(37)29-17-11-10-16-28(29)27-15-9-8-14-26(27)21-39-30(22)19-34(4)32(38)33-24(3)25-12-6-5-7-13-25/h5-17,22-24,30,36H,18-21H2,1-4H3,(H,33,38)/t22-,23-,24+,30-/m0/s1	VBARFQGDBKSOKL-WAHOFHFDSA-N	529.294056758							99737
BRD-K39629581	LSM-10836		54637640	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23+,29+,30+/m0/s1	DVGPQCDULGSEFB-SBHPWIPZSA-N	CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2c3ccccc3C(=O)N(C[C@@H]1C)[C@H](C)CO)c4ccccc4	BroadT	BRD-K39629581	BRD-K39629581-001-01-1	Broad Institute of MIT and Harvard	BRD-K39629581			CO[C@@H](C(=O)N(C)C[C@H]1OCc2ccccc2-c2ccccc2C(=O)N(C[C@@H]1C)[C@H](C)CO)c1ccccc1	InChI=1S/C32H38N2O5/c1-22-18-34(23(2)20-35)31(36)28-17-11-10-16-27(28)26-15-9-8-14-25(26)21-39-29(22)19-33(3)32(37)30(38-4)24-12-6-5-7-13-24/h5-17,22-23,29-30,35H,18-21H2,1-4H3/t22-,23+,29+,30+/m0/s1	DVGPQCDULGSEFB-SBHPWIPZSA-N	530.278072336							99457
BRD-K87133350	LSM-13772		56835525	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28+/m1/s1	CYZHERASHFZITE-GGJMMHKRSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K87133350	BRD-K87133350-001-01-4	Broad Institute of MIT and Harvard	BRD-K87133350			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28+/m1/s1	CYZHERASHFZITE-GGJMMHKRSA-N	519.253334798							102421
BRD-K81392055	LSM-13397		56835432	InChI=1S/C27H33F3N2O4/c1-18-14-32(19(2)16-33)26(35)23-11-7-6-10-22(23)21-9-5-4-8-20(21)17-36-24(18)15-31(3)25(34)12-13-27(28,29)30/h4-11,18-19,24,33H,12-17H2,1-3H3/t18-,19-,24-/m0/s1	VGVIGMMHZQAXDN-JXQFQVJHSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K81392055	BRD-K81392055-001-01-0	Broad Institute of MIT and Harvard	BRD-K81392055			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H33F3N2O4/c1-18-14-32(19(2)16-33)26(35)23-11-7-6-10-22(23)21-9-5-4-8-20(21)17-36-24(18)15-31(3)25(34)12-13-27(28,29)30/h4-11,18-19,24,33H,12-17H2,1-3H3/t18-,19-,24-/m0/s1	VGVIGMMHZQAXDN-JXQFQVJHSA-N	506.239242156							102037
BRD-K62975098	LSM-12257		54637718	InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23-,30-/m1/s1	BRMWAKMKOMKLLH-IQLGONJTSA-N	COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	BroadT	BRD-K62975098	BRD-K62975098-001-01-4	Broad Institute of MIT and Harvard	BRD-K62975098			COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@H](C)CO)cc1	InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23-,30-/m1/s1	BRMWAKMKOMKLLH-IQLGONJTSA-N	545.288971378							100883
BRD-K20500634	LSM-9678		56835355	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20-,27+/m0/s1	HAVPCKYPPPKWEI-OWOAZTCBSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)onc2C)OCc3ccccc3c4c(C1=O)n(C)c5ccccc45	BroadT	BRD-K20500634	BRD-K20500634-001-01-2	Broad Institute of MIT and Harvard	BRD-K20500634			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C31H38N4O6S/c1-19-15-35(20(2)17-36)31(37)29-28(25-13-9-10-14-26(25)34(29)6)24-12-8-7-11-23(24)18-40-27(19)16-33(5)42(38,39)30-21(3)32-41-22(30)4/h7-14,19-20,27,36H,15-18H2,1-6H3/t19-,20-,27+/m0/s1	HAVPCKYPPPKWEI-OWOAZTCBSA-N	594.251205666							98299
BRD-K39696539	LSM-10844		54637774	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21+,26+,27-/m1/s1	PIMBJQHAALXIRA-KXLSXUBNSA-N	C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K39696539	BRD-K39696539-001-01-3	Broad Institute of MIT and Harvard	BRD-K39696539			C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21+,26+,27-/m1/s1	PIMBJQHAALXIRA-KXLSXUBNSA-N	493.294056758							99465
BRD-K04847305	LSM-8728		56835438	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26-,27-/m0/s1	PIMBJQHAALXIRA-YDNHHRFVSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K04847305	BRD-K04847305-001-01-5	Broad Institute of MIT and Harvard	BRD-K04847305			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21-,26-,27-/m0/s1	PIMBJQHAALXIRA-YDNHHRFVSA-N	493.294056758							97349
BRD-K78778476	LSM-13238		56835404	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20-,25+/m1/s1	YEGLVGBFCXLPBD-FHAGJXEFSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K78778476	BRD-K78778476-001-01-6	Broad Institute of MIT and Harvard	BRD-K78778476			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H32N2O5S2/c1-19-15-29(20(2)17-30)27(31)24-12-7-6-11-23(24)22-10-5-4-9-21(22)18-34-25(19)16-28(3)36(32,33)26-13-8-14-35-26/h4-14,19-20,25,30H,15-18H2,1-3H3/t19-,20-,25+/m1/s1	YEGLVGBFCXLPBD-FHAGJXEFSA-N	528.175263524							101877
BRD-K50342369	LSM-11493		54637816	InChI=1S/C27H33F3N2O4/c1-18-14-32(19(2)16-33)26(35)23-11-7-6-10-22(23)21-9-5-4-8-20(21)17-36-24(18)15-31(3)25(34)12-13-27(28,29)30/h4-11,18-19,24,33H,12-17H2,1-3H3/t18-,19+,24+/m0/s1	VGVIGMMHZQAXDN-XLNZFTOWSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K50342369	BRD-K50342369-001-01-3	Broad Institute of MIT and Harvard	BRD-K50342369			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H33F3N2O4/c1-18-14-32(19(2)16-33)26(35)23-11-7-6-10-22(23)21-9-5-4-8-20(21)17-36-24(18)15-31(3)25(34)12-13-27(28,29)30/h4-11,18-19,24,33H,12-17H2,1-3H3/t18-,19+,24+/m0/s1	VGVIGMMHZQAXDN-XLNZFTOWSA-N	506.239242156							100114
BRD-K64900763	LSM-12392		56835288	InChI=1S/C27H33F3N2O4/c1-18-14-32(19(2)16-33)26(35)23-11-7-6-10-22(23)21-9-5-4-8-20(21)17-36-24(18)15-31(3)25(34)12-13-27(28,29)30/h4-11,18-19,24,33H,12-17H2,1-3H3/t18-,19+,24+/m1/s1	VGVIGMMHZQAXDN-IMWIBFENSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2c3ccccc3C1=O	BroadT	BRD-K64900763	BRD-K64900763-001-01-4	Broad Institute of MIT and Harvard	BRD-K64900763			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CCC(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C27H33F3N2O4/c1-18-14-32(19(2)16-33)26(35)23-11-7-6-10-22(23)21-9-5-4-8-20(21)17-36-24(18)15-31(3)25(34)12-13-27(28,29)30/h4-11,18-19,24,33H,12-17H2,1-3H3/t18-,19+,24+/m1/s1	VGVIGMMHZQAXDN-IMWIBFENSA-N	506.239242156							101019
BRD-K85536714	LSM-13657		54637724	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28-/m0/s1	CYZHERASHFZITE-GTNJKRJXSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K85536714	BRD-K85536714-001-01-1	Broad Institute of MIT and Harvard	BRD-K85536714			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21+,28-/m0/s1	CYZHERASHFZITE-GTNJKRJXSA-N	519.253334798							102304
BRD-K05442673	LSM-8749		56835465	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28+/m1/s1	CYZHERASHFZITE-CJYOKPGZSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K05442673	BRD-K05442673-001-01-8	Broad Institute of MIT and Harvard	BRD-K05442673			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H34FN3O4/c1-20-16-34(21(2)18-35)29(36)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-38-28(20)17-33(3)30(37)32-24-14-12-23(31)13-15-24/h4-15,20-21,28,35H,16-19H2,1-3H3,(H,32,37)/t20-,21-,28+/m1/s1	CYZHERASHFZITE-CJYOKPGZSA-N	519.253334798							97370
BRD-K29987902	LSM-10244		54637717	InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23+,30-/m1/s1	BRMWAKMKOMKLLH-DUELTEGESA-N	COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K29987902	BRD-K29987902-001-01-7	Broad Institute of MIT and Harvard	BRD-K29987902			COc1ccc(CNC(=O)N(C)C[C@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@H]2C)[C@@H](C)CO)cc1	InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23+,30-/m1/s1	BRMWAKMKOMKLLH-DUELTEGESA-N	545.288971378							98865
BRD-K44897098	LSM-11160		56835357	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22-,30+/m0/s1	KFLLAZWDLYDTFJ-MWXNICTNSA-N	C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc4ccccc4c5c(C1=O)n(C)c6ccccc56	BroadT	BRD-K44897098	BRD-K44897098-001-01-3	Broad Institute of MIT and Harvard	BRD-K44897098			C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21	InChI=1S/C34H38N4O6/c1-21-16-38(22(2)18-39)33(40)32-31(26-11-7-8-12-27(26)37(32)4)25-10-6-5-9-23(25)19-42-30(21)17-36(3)34(41)35-24-13-14-28-29(15-24)44-20-43-28/h5-15,21-22,30,39H,16-20H2,1-4H3,(H,35,41)/t21-,22-,30+/m0/s1	KFLLAZWDLYDTFJ-MWXNICTNSA-N	598.279134976							99781
BRD-K15973523	LSM-9385		54637777	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31-,32+/m0/s1	ZQFGNRPCSITOFH-APGDKJRLSA-N	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K15973523	BRD-K15973523-001-01-2	Broad Institute of MIT and Harvard	BRD-K15973523			C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31-,32+/m0/s1	ZQFGNRPCSITOFH-APGDKJRLSA-N	557.325356886							98006
BRD-K89597637	LSM-13951		54637781	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31-,32-/m0/s1	ZQFGNRPCSITOFH-GLGRRZRYSA-N	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K89597637	BRD-K89597637-001-01-3	Broad Institute of MIT and Harvard	BRD-K89597637			C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)[C@H](Cc2ccccc2)N(C)C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C34H43N3O4/c1-24-20-37(25(2)22-38)33(39)30-18-12-11-17-29(30)28-16-10-9-15-27(28)23-41-32(24)21-36(5)34(40)31(35(3)4)19-26-13-7-6-8-14-26/h6-18,24-25,31-32,38H,19-23H2,1-5H3/t24-,25+,31-,32-/m0/s1	ZQFGNRPCSITOFH-GLGRRZRYSA-N	557.325356886							102604
CHEMBL2354415	LSM-14129	SID134962243, BRD-K92953840	56835509	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29+/m1/s1	RWOMJVAVZPFCIF-QLVXXPONSA-N	C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K92953840	BRD-K92953840-001-01-6	Broad Institute of MIT and Harvard	BRD-K92953840			C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33N3O5S/c1-21-17-33(22(2)19-34)30(35)28-14-7-6-13-27(28)26-12-5-4-10-24(26)20-38-29(21)18-32(3)39(36,37)25-11-8-9-23(15-25)16-31/h4-15,21-22,29,34H,17-20H2,1-3H3/t21-,22-,29+/m1/s1	RWOMJVAVZPFCIF-QLVXXPONSA-N	547.214091876							102783
BRD-K31160185	LSM-10311		56835222	InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23-,30-/m0/s1	BRMWAKMKOMKLLH-ZRLASMASSA-N	COc1ccc(CNC(=O)N(C)C[C@@H]2OCc3ccccc3c4ccccc4C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	BroadT	BRD-K31160185	BRD-K31160185-001-01-5	Broad Institute of MIT and Harvard	BRD-K31160185			COc1ccc(CNC(=O)N(C)C[C@@H]2OCc3ccccc3-c3ccccc3C(=O)N(C[C@@H]2C)[C@@H](C)CO)cc1	InChI=1S/C32H39N3O5/c1-22-18-35(23(2)20-36)31(37)29-12-8-7-11-28(29)27-10-6-5-9-25(27)21-40-30(22)19-34(3)32(38)33-17-24-13-15-26(39-4)16-14-24/h5-16,22-23,30,36H,17-21H2,1-4H3,(H,33,38)/t22-,23-,30-/m0/s1	BRMWAKMKOMKLLH-ZRLASMASSA-N	545.288971378							98932
CHEMBL2359418	LSM-12044	BRD-K59848706, SID134961947	56835213	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21-,28-/m0/s1	VUGFGKFGZUURHO-CZBREUMFSA-N	C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K59848706	BRD-K59848706-001-01-2	Broad Institute of MIT and Harvard	BRD-K59848706			C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C30H33F3N2O5S/c1-20-16-35(21(2)18-36)29(37)27-11-7-6-10-26(27)25-9-5-4-8-22(25)19-40-28(20)17-34(3)41(38,39)24-14-12-23(13-15-24)30(31,32)33/h4-15,20-21,28,36H,16-19H2,1-3H3/t20-,21-,28-/m0/s1	VUGFGKFGZUURHO-CZBREUMFSA-N	590.206227466							100670
BRD-K34829873	LSM-10524		56835508	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21+,26+,27+/m1/s1	PIMBJQHAALXIRA-OTOHDBPVSA-N	C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc3ccccc3c4ccccc4C1=O	BroadT	BRD-K34829873	BRD-K34829873-001-01-9	Broad Institute of MIT and Harvard	BRD-K34829873			C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)[C@@H]2CCCN2C)OCc2ccccc2-c2ccccc2C1=O	InChI=1S/C29H39N3O4/c1-20-16-32(21(2)18-33)28(34)25-13-8-7-12-24(25)23-11-6-5-10-22(23)19-36-27(20)17-31(4)29(35)26-14-9-15-30(26)3/h5-8,10-13,20-21,26-27,33H,9,14-19H2,1-4H3/t20-,21+,26+,27+/m1/s1	PIMBJQHAALXIRA-OTOHDBPVSA-N	493.294056758							99145
BRD-K23782109	LSM-33657		54639843	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17+,18+/m0/s1	ZNNAKNJWDLOPKK-RCCFBDPRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C=C[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K23782109	BRD-K23782109-001-01-9	Broad Institute of MIT and Harvard	BRD-K23782109			OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C=C[C@H]1NC(=O)C1CCOCC1	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17+,18+/m0/s1	ZNNAKNJWDLOPKK-RCCFBDPRSA-N	389.195070994							122214
BRD-K02427665-001-01-2	LSM-33658	BRD-K02427665	54639817	InChI=1S/C20H26N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-7,16-18,23H,8-14H2,(H,21,24)/t16-,17-,18+/m1/s1	IQQRIWPPTLHHIL-KURKYZTESA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)Cc3ccccc3	BroadT	BRD-K02427665	BRD-K02427665-001-01-2	Broad Institute of MIT and Harvard	BRD-K02427665			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)Cc1ccccc1	InChI=1S/C20H26N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-7,16-18,23H,8-14H2,(H,21,24)/t16-,17-,18+/m1/s1	IQQRIWPPTLHHIL-KURKYZTESA-N	374.184171952							122215
BRD-K22537050	LSM-33659		54639913	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13-,14-/m0/s1	MHCXBMBZURQYRG-IHRRRGAJSA-N	CN(C)C(=O)C[C@@H]1CC[C@H](NC(=O)NC2CCCC2)[C@H](CO)O1	BroadT	BRD-K22537050	BRD-K22537050-001-01-7	Broad Institute of MIT and Harvard	BRD-K22537050			CN(C)C(=O)C[C@@H]1CC[C@H](NC(=O)NC2CCCC2)[C@H](CO)O1	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13-,14-/m0/s1	MHCXBMBZURQYRG-IHRRRGAJSA-N	327.215806438							122216
BRD-K51568355	LSM-33660		54639802	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17-,18-/m0/s1	ZAWCCEHPCRSVNF-BZSNNMDCSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K51568355	BRD-K51568355-001-01-8	Broad Institute of MIT and Harvard	BRD-K51568355			OC[C@@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)c1ccncc1	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17-,18-/m0/s1	ZAWCCEHPCRSVNF-BZSNNMDCSA-N	391.210721058							122217
BRD-K99581286	LSM-33661		54640062	InChI=1S/C20H30FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-7,14,17-18,25H,5,8-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18-/m1/s1	RNBICINZPSPKFD-FHLIZLRMSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	BroadT	BRD-K99581286	BRD-K99581286-001-01-9	Broad Institute of MIT and Harvard	BRD-K99581286			CN(C)CCCNC(=O)C[C@H]1CC[C@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	InChI=1S/C20H30FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-7,14,17-18,25H,5,8-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18-/m1/s1	RNBICINZPSPKFD-FHLIZLRMSA-N	395.22203467							122218
BRD-K11545984	LSM-33662		54640017	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17+,19+/m0/s1	FRHMAPNXHVZDAK-KVSKMBFKSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccccc2)C=C[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K11545984	BRD-K11545984-001-01-4	Broad Institute of MIT and Harvard	BRD-K11545984			OC[C@H]1O[C@H](CC(=O)Nc2ccccc2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17+,19+/m0/s1	FRHMAPNXHVZDAK-KVSKMBFKSA-N	417.150012582							122219
BRD-K73994499	LSM-33663		54639842	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17+,19-/m0/s1	VLQCPCSLOMVUJP-SCTDSRPQSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K73994499	BRD-K73994499-001-01-7	Broad Institute of MIT and Harvard	BRD-K73994499			OC[C@@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17+,19-/m0/s1	VLQCPCSLOMVUJP-SCTDSRPQSA-N	389.231456502							122220
BRD-K65250438	LSM-33664		54639924	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17+,18-/m0/s1	NIFMHKNMYGHVIX-KSZLIROESA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K65250438	BRD-K65250438-001-01-8	Broad Institute of MIT and Harvard	BRD-K65250438			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17+,18-/m0/s1	NIFMHKNMYGHVIX-KSZLIROESA-N	397.25767125							122221
BRD-K85235446	LSM-33665		54639861	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17-,18+/m1/s1	INOAIBAAQYWPCB-KURKYZTESA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NC(=O)C4CCOCC4	BroadT	BRD-K85235446	BRD-K85235446-001-01-5	Broad Institute of MIT and Harvard	BRD-K85235446			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17-,18+/m1/s1	INOAIBAAQYWPCB-KURKYZTESA-N	422.252920228							122222
BRD-K18888894	LSM-33666		54639935	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19-,22+/m1/s1	PWRMKQUARCEQEU-KNKQGSTJSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K18888894	BRD-K18888894-001-01-0	Broad Institute of MIT and Harvard	BRD-K18888894			OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19-,22+/m1/s1	PWRMKQUARCEQEU-KNKQGSTJSA-N	476.161721946							122223
BRD-K92457070	LSM-33667		54639832	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15+/m0/s1	XCSADXMQLTVTGS-SOUVJXGZSA-N	CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	BroadT	BRD-K92457070	BRD-K92457070-001-01-9	Broad Institute of MIT and Harvard	BRD-K92457070			CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15+/m0/s1	XCSADXMQLTVTGS-SOUVJXGZSA-N	356.242355544							122224
BRD-K60635455	LSM-33668		54640044	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18-,21-/m1/s1	NHCHTYGGSDNPNS-HGHGUNKESA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c4cccc(F)c4	BroadT	BRD-K60635455	BRD-K60635455-001-01-3	Broad Institute of MIT and Harvard	BRD-K60635455			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18-,21-/m1/s1	NHCHTYGGSDNPNS-HGHGUNKESA-N	480.13665005							122225
BRD-K66865641	LSM-33669		54639890	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15-,17-/m1/s1	CJRAIIYLTSRGNA-BFYDXBDKSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K66865641	BRD-K66865641-001-01-5	Broad Institute of MIT and Harvard	BRD-K66865641			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c1ccccn1	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15-,17-/m1/s1	CJRAIIYLTSRGNA-BFYDXBDKSA-N	359.18450631							122226
BRD-K94132559	LSM-33670		54639857	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19+,20-/m0/s1	UXWKWPDPCRHNPI-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C3CCCCC3	BroadT	BRD-K94132559	BRD-K94132559-001-01-6	Broad Institute of MIT and Harvard	BRD-K94132559			OC[C@@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C1CCCCC1	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19+,20-/m0/s1	UXWKWPDPCRHNPI-ZCNNSNEGSA-N	406.226785692							122227
BRD-K19523037	LSM-33671		54640012	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18+,19-/m1/s1	CAYTZIHCJIWWNW-CEXWTWQISA-N	OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K19523037	BRD-K19523037-001-01-0	Broad Institute of MIT and Harvard	BRD-K19523037			OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18+,19-/m1/s1	CAYTZIHCJIWWNW-CEXWTWQISA-N	420.237270164							122228
BRD-K19734887	LSM-33672		54640059	InChI=1S/C20H30FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-7,14,17-18,25H,5,8-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18+/m1/s1	RNBICINZPSPKFD-JLSDUUJJSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@H](NC(=O)c2ccccc2F)[C@H](CO)O1	BroadT	BRD-K19734887	BRD-K19734887-001-01-4	Broad Institute of MIT and Harvard	BRD-K19734887			CN(C)CCCNC(=O)C[C@H]1CC[C@H](NC(=O)c2ccccc2F)[C@H](CO)O1	InChI=1S/C20H30FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-7,14,17-18,25H,5,8-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18+/m1/s1	RNBICINZPSPKFD-JLSDUUJJSA-N	395.22203467							122229
BRD-K42995703	LSM-33673		54639883	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18+,19+/m0/s1	ZYZRAOAZZGCSLT-QXAKKESOSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccncn3)O[C@@H]2CO	BroadT	BRD-K42995703	BRD-K42995703-001-01-4	Broad Institute of MIT and Harvard	BRD-K42995703			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccncn2)O[C@@H]1CO	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18+,19+/m0/s1	ZYZRAOAZZGCSLT-QXAKKESOSA-N	434.162390662							122230
BRD-K15694916	LSM-33674		54639916	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13+,14-/m0/s1	MHCXBMBZURQYRG-MJBXVCDLSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H](NC(=O)NC2CCCC2)[C@H](CO)O1	BroadT	BRD-K15694916	BRD-K15694916-001-01-9	Broad Institute of MIT and Harvard	BRD-K15694916			CN(C)C(=O)C[C@@H]1CC[C@@H](NC(=O)NC2CCCC2)[C@H](CO)O1	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13+,14-/m0/s1	MHCXBMBZURQYRG-MJBXVCDLSA-N	327.215806438							122231
BRD-K73451279	LSM-33675		54640088	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19-/m1/s1	DRBUEWBLJCFPHK-GRGSLBFTSA-N	C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)C2CCC2)C=C1)c3ccccc3	BroadT	BRD-K73451279	BRD-K73451279-001-01-4	Broad Institute of MIT and Harvard	BRD-K73451279			C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)C2CCC2)C=C1)c1ccccc1	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19-/m1/s1	DRBUEWBLJCFPHK-GRGSLBFTSA-N	372.204907396							122232
BRD-K59221664	LSM-33676		54640101	InChI=1S/C19H28N2O6/c1-25-12-19(24)21-15-8-7-14(27-17(15)11-22)9-18(23)20-10-13-5-3-4-6-16(13)26-2/h3-6,14-15,17,22H,7-12H2,1-2H3,(H,20,23)(H,21,24)/t14-,15+,17-/m0/s1	PZSXLCWRMIJETI-UXLLHSPISA-N	COCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccccc2OC)O[C@H]1CO	BroadT	BRD-K59221664	BRD-K59221664-001-01-2	Broad Institute of MIT and Harvard	BRD-K59221664			COCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccccc2OC)O[C@H]1CO	InChI=1S/C19H28N2O6/c1-25-12-19(24)21-15-8-7-14(27-17(15)11-22)9-18(23)20-10-13-5-3-4-6-16(13)26-2/h3-6,14-15,17,22H,7-12H2,1-2H3,(H,20,23)(H,21,24)/t14-,15+,17-/m0/s1	PZSXLCWRMIJETI-UXLLHSPISA-N	380.194736636							122233
BRD-K26395018	LSM-33677		54639956	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15+,16+/m0/s1	KRKFLLVHIFIBNR-ARFHVFGLSA-N	CCCNC(=O)N[C@@H]1C=C[C@@H](CC(=O)NC2CCCCC2)O[C@@H]1CO	BroadT	BRD-K26395018	BRD-K26395018-001-01-7	Broad Institute of MIT and Harvard	BRD-K26395018			CCCNC(=O)N[C@@H]1C=C[C@@H](CC(=O)NC2CCCCC2)O[C@@H]1CO	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15+,16+/m0/s1	KRKFLLVHIFIBNR-ARFHVFGLSA-N	353.231456502							122234
BRD-K15907840	LSM-33678		54640074	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19-,20-/m1/s1	PELUPFPZEXCELD-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K15907840	BRD-K15907840-001-01-6	Broad Institute of MIT and Harvard	BRD-K15907840			OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19-,20-/m1/s1	PELUPFPZEXCELD-VAMGGRTRSA-N	413.175084478							122235
BRD-K08899466	LSM-33679		54639932	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19+,22+/m0/s1	PWRMKQUARCEQEU-NNMXDRDESA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K08899466	BRD-K08899466-001-01-7	Broad Institute of MIT and Harvard	BRD-K08899466			OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19+,22+/m0/s1	PWRMKQUARCEQEU-NNMXDRDESA-N	476.161721946							122236
BRD-K48691065-001-01-5	LSM-33680	BRD-K48691065	54640003	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13+,14+/m1/s1	KZMUEAIOUSMXHL-XBFCOCLRSA-N	NCC[C@H]1CC[C@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@H](CO)O1	BroadT	BRD-K48691065	BRD-K48691065-001-01-5	Broad Institute of MIT and Harvard	BRD-K48691065			NCC[C@H]1CC[C@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@H](CO)O1	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13+,14+/m1/s1	KZMUEAIOUSMXHL-XBFCOCLRSA-N	348.091055572							122237
BRD-K95500312	LSM-33681		54640065	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15+/m1/s1	AVCGIXMUPLIHTE-ILXRZTDVSA-N	CCCNC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	BroadT	BRD-K95500312	BRD-K95500312-001-01-1	Broad Institute of MIT and Harvard	BRD-K95500312			CCCNC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15+/m1/s1	AVCGIXMUPLIHTE-ILXRZTDVSA-N	354.22670548							122238
BRD-K13038935	LSM-33682		54639921	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17-,18+/m0/s1	NIFMHKNMYGHVIX-OKZBNKHCSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K13038935	BRD-K13038935-001-01-8	Broad Institute of MIT and Harvard	BRD-K13038935			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17-,18+/m0/s1	NIFMHKNMYGHVIX-OKZBNKHCSA-N	397.25767125							122239
BRD-K63107801	LSM-33683		54639800	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17-,18+/m0/s1	ZAWCCEHPCRSVNF-OKZBNKHCSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K63107801	BRD-K63107801-001-01-1	Broad Institute of MIT and Harvard	BRD-K63107801			OC[C@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)c1ccncc1	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17-,18+/m0/s1	ZAWCCEHPCRSVNF-OKZBNKHCSA-N	391.210721058							122240
BRD-K88190816	LSM-33684		54640081	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18-,19-/m0/s1	DRBUEWBLJCFPHK-VLQPXKRTSA-N	C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)C2CCC2)C=C1)c3ccccc3	BroadT	BRD-K88190816	BRD-K88190816-001-01-1	Broad Institute of MIT and Harvard	BRD-K88190816			C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)C2CCC2)C=C1)c1ccccc1	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18-,19-/m0/s1	DRBUEWBLJCFPHK-VLQPXKRTSA-N	372.204907396							122241
BRD-K21206585	LSM-33685		54639895	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15+,17-/m1/s1	CJRAIIYLTSRGNA-HLLBOEOZSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K21206585	BRD-K21206585-001-01-4	Broad Institute of MIT and Harvard	BRD-K21206585			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c1ccccn1	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15+,17-/m1/s1	CJRAIIYLTSRGNA-HLLBOEOZSA-N	359.18450631							122242
BRD-K00048792	LSM-33686		54639829	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15+/m1/s1	XCSADXMQLTVTGS-ILXRZTDVSA-N	CCCNC(=O)N[C@H]1CC[C@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	BroadT	BRD-K00048792	BRD-K00048792-001-01-4	Broad Institute of MIT and Harvard	BRD-K00048792			CCCNC(=O)N[C@H]1CC[C@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15+/m1/s1	XCSADXMQLTVTGS-ILXRZTDVSA-N	356.242355544							122243
BRD-K93127164	LSM-33687		54639974	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19-,20-/m0/s1	KHPOILJWMXIQKX-UFYCRDLUSA-N	COc1ccc(NC(=O)N[C@H]2C=C[C@@H](CC(=O)NC3CCCCC3)O[C@H]2CO)cc1	BroadT	BRD-K93127164	BRD-K93127164-001-01-4	Broad Institute of MIT and Harvard	BRD-K93127164			COc1ccc(NC(=O)N[C@H]2C=C[C@@H](CC(=O)NC3CCCCC3)O[C@H]2CO)cc1	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19-,20-/m0/s1	KHPOILJWMXIQKX-UFYCRDLUSA-N	417.226371122							122244
BRD-K17749779	LSM-33688		54640056	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18-/m1/s1	IHGRXRHOBYYXJU-FGTMMUONSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@H](NC(=O)Cc2cccnc2)[C@@H](CO)O1	BroadT	BRD-K17749779	BRD-K17749779-001-01-5	Broad Institute of MIT and Harvard	BRD-K17749779			CN(C)CCCNC(=O)C[C@H]1CC[C@H](NC(=O)Cc2cccnc2)[C@@H](CO)O1	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18-/m1/s1	IHGRXRHOBYYXJU-FGTMMUONSA-N	392.242355544							122245
BRD-K95338817	LSM-33689		54639998	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17-,18+/m0/s1	AFXALTHXBUYGQN-OKZBNKHCSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)CN(C)C)[C@@H](CO)O2)cc1	BroadT	BRD-K95338817	BRD-K95338817-001-01-6	Broad Institute of MIT and Harvard	BRD-K95338817			COc1ccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)CN(C)C)[C@@H](CO)O2)cc1	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17-,18+/m0/s1	AFXALTHXBUYGQN-OKZBNKHCSA-N	393.226371122							122246
BRD-K84457681	LSM-33690		54639850	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19+,20+/m0/s1	UXWKWPDPCRHNPI-XUVXKRRUSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C3CCCCC3	BroadT	BRD-K84457681	BRD-K84457681-001-01-0	Broad Institute of MIT and Harvard	BRD-K84457681			OC[C@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C1CCCCC1	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19+,20+/m0/s1	UXWKWPDPCRHNPI-XUVXKRRUSA-N	406.226785692							122247
BRD-K41972460-001-01-7	LSM-33691	BRD-K41972460	54640002	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13+,14+/m0/s1	KZMUEAIOUSMXHL-IACUBPJLSA-N	NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@@H](CO)O1	BroadT	BRD-K41972460	BRD-K41972460-001-01-7	Broad Institute of MIT and Harvard	BRD-K41972460			NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@@H](CO)O1	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13+,14+/m0/s1	KZMUEAIOUSMXHL-IACUBPJLSA-N	348.091055572							122248
BRD-K27864398	LSM-33692		54639867	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18+,19+/m1/s1	CSAZNKSAKUIKBW-NEWSRXKRSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K27864398	BRD-K27864398-001-01-1	Broad Institute of MIT and Harvard	BRD-K27864398			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18+,19+/m1/s1	CSAZNKSAKUIKBW-NEWSRXKRSA-N	419.15149162							122249
BRD-K04325154	LSM-33693		54640046	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18-,21+/m0/s1	NHCHTYGGSDNPNS-DJPFJPOOSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c4cccc(F)c4	BroadT	BRD-K04325154	BRD-K04325154-001-01-4	Broad Institute of MIT and Harvard	BRD-K04325154			OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18-,21+/m0/s1	NHCHTYGGSDNPNS-DJPFJPOOSA-N	480.13665005							122250
BRD-K98757606	LSM-33694		54639847	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17-,18+/m0/s1	ZNNAKNJWDLOPKK-OKZBNKHCSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C=C[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K98757606	BRD-K98757606-001-01-9	Broad Institute of MIT and Harvard	BRD-K98757606			OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17-,18+/m0/s1	ZNNAKNJWDLOPKK-OKZBNKHCSA-N	389.195070994							122251
BRD-K06876397	LSM-33695		54639896	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15+,17-/m0/s1	CJRAIIYLTSRGNA-UXLLHSPISA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K06876397	BRD-K06876397-001-01-1	Broad Institute of MIT and Harvard	BRD-K06876397			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c1ccccn1	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15+,17-/m0/s1	CJRAIIYLTSRGNA-UXLLHSPISA-N	359.18450631							122252
BRD-K84593579	LSM-33696		54640021	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17-,19+/m0/s1	FRHMAPNXHVZDAK-VDZJLULYSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccccc2)C=C[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K84593579	BRD-K84593579-001-01-7	Broad Institute of MIT and Harvard	BRD-K84593579			OC[C@H]1O[C@H](CC(=O)Nc2ccccc2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17-,19+/m0/s1	FRHMAPNXHVZDAK-VDZJLULYSA-N	417.150012582							122253
BRD-K98355012	LSM-33697		54640045	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18-,21-/m0/s1	NHCHTYGGSDNPNS-MDKPJZGXSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c4cccc(F)c4	BroadT	BRD-K98355012	BRD-K98355012-001-01-0	Broad Institute of MIT and Harvard	BRD-K98355012			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18-,21-/m0/s1	NHCHTYGGSDNPNS-MDKPJZGXSA-N	480.13665005							122254
BRD-K73579545	LSM-33698		54639879	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18+/m1/s1	BFDDYBZFCVNWOI-KYJSFNMBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)C=C[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K73579545	BRD-K73579545-001-01-0	Broad Institute of MIT and Harvard	BRD-K73579545			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)C=C[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18+/m1/s1	BFDDYBZFCVNWOI-KYJSFNMBSA-N	400.154683392							122255
BRD-K03765511	LSM-33699		54639920	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17-,18-/m0/s1	NIFMHKNMYGHVIX-BZSNNMDCSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K03765511	BRD-K03765511-001-01-0	Broad Institute of MIT and Harvard	BRD-K03765511			OC[C@@H]1O[C@H](CC(=O)NC2CCCCC2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17-,18-/m0/s1	NIFMHKNMYGHVIX-BZSNNMDCSA-N	397.25767125							122256
MLS003650071	LSM-33700	BRD-K49303291, SID125305366, SID131436410	53382722	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20+,22+/m0/s1	UESSXGKYQCVSOE-UCNVEGJOSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3CCCCC3)CC[C@H]1NC(=O)Nc4ccc(Cl)c(Cl)c4	BroadT	BRD-K49303291	BRD-K49303291-001-01-2	Broad Institute of MIT and Harvard	BRD-K49303291			OC[C@H]1O[C@H](CCn2cc(nn2)C2CCCCC2)CC[C@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C23H31Cl2N5O3/c24-18-8-6-16(12-19(18)25)26-23(32)27-20-9-7-17(33-22(20)14-31)10-11-30-13-21(28-29-30)15-4-2-1-3-5-15/h6,8,12-13,15,17,20,22,31H,1-5,7,9-11,14H2,(H2,26,27,32)/t17-,20+,22+/m0/s1	UESSXGKYQCVSOE-UCNVEGJOSA-N	495.180395322							122257
BRD-K04147413	LSM-33701		54639937	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19-,22-/m0/s1	PWRMKQUARCEQEU-IPJJNNNSSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K04147413	BRD-K04147413-001-01-9	Broad Institute of MIT and Harvard	BRD-K04147413			OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19-,22-/m0/s1	PWRMKQUARCEQEU-IPJJNNNSSA-N	476.161721946							122258
BRD-K99847716	LSM-33702		54639871	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18-,19-/m1/s1	CSAZNKSAKUIKBW-BHIYHBOVSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K99847716	BRD-K99847716-001-01-4	Broad Institute of MIT and Harvard	BRD-K99847716			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18-,19-/m1/s1	CSAZNKSAKUIKBW-BHIYHBOVSA-N	419.15149162							122259
BRD-K23440419	LSM-33703		54639959	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15-,16-/m0/s1	KRKFLLVHIFIBNR-JYJNAYRXSA-N	CCCNC(=O)N[C@H]1C=C[C@@H](CC(=O)NC2CCCCC2)O[C@H]1CO	BroadT	BRD-K23440419	BRD-K23440419-001-01-9	Broad Institute of MIT and Harvard	BRD-K23440419			CCCNC(=O)N[C@H]1C=C[C@@H](CC(=O)NC2CCCCC2)O[C@H]1CO	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15-,16-/m0/s1	KRKFLLVHIFIBNR-JYJNAYRXSA-N	353.231456502							122260
BRD-K90335150	LSM-33704		54639964	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17+,18+/m1/s1	JMJYAJMXQVZTFW-SQNIBIBYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NC(=O)c3ccccc3	BroadT	BRD-K90335150	BRD-K90335150-001-01-2	Broad Institute of MIT and Harvard	BRD-K90335150			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NC(=O)c1ccccc1	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17+,18+/m1/s1	JMJYAJMXQVZTFW-SQNIBIBYSA-N	382.164105224							122261
BRD-K85503438	LSM-33705		54640023	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17+,19-/m1/s1	FRHMAPNXHVZDAK-HHXXYDBFSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccccc2)C=C[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K85503438	BRD-K85503438-001-01-6	Broad Institute of MIT and Harvard	BRD-K85503438			OC[C@H]1O[C@@H](CC(=O)Nc2ccccc2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17+,19-/m1/s1	FRHMAPNXHVZDAK-HHXXYDBFSA-N	417.150012582							122262
BRD-K48556518	LSM-33706		54640049	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18+,21-/m0/s1	NHCHTYGGSDNPNS-CDXJDZJCSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c4cccc(F)c4	BroadT	BRD-K48556518	BRD-K48556518-001-01-3	Broad Institute of MIT and Harvard	BRD-K48556518			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18+,21-/m0/s1	NHCHTYGGSDNPNS-CDXJDZJCSA-N	480.13665005							122263
BRD-K85977749	LSM-33707		54640084	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19+/m0/s1	DRBUEWBLJCFPHK-JEDBISTDSA-N	C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)C2CCC2)C=C1)c3ccccc3	BroadT	BRD-K85977749	BRD-K85977749-001-01-6	Broad Institute of MIT and Harvard	BRD-K85977749			C[C@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)C2CCC2)C=C1)c1ccccc1	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19+/m0/s1	DRBUEWBLJCFPHK-JEDBISTDSA-N	372.204907396							122264
BRD-K56837922	LSM-33708		54640082	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18+,19+/m1/s1	DRBUEWBLJCFPHK-OAOYMFHYSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)C2CCC2)C=C1)c3ccccc3	BroadT	BRD-K56837922	BRD-K56837922-001-01-6	Broad Institute of MIT and Harvard	BRD-K56837922			C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)C2CCC2)C=C1)c1ccccc1	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18+,19+/m1/s1	DRBUEWBLJCFPHK-OAOYMFHYSA-N	372.204907396							122265
BRD-K27154831	LSM-33709		54640027	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19-,20-/m1/s1	JNAWISBSOJGFKT-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K27154831	BRD-K27154831-001-01-2	Broad Institute of MIT and Harvard	BRD-K27154831			OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19-,20-/m1/s1	JNAWISBSOJGFKT-VAMGGRTRSA-N	432.237270164							122266
BRD-K24848743	LSM-33710		54639958	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15+,16+/m1/s1	KRKFLLVHIFIBNR-PMPSAXMXSA-N	CCCNC(=O)N[C@H]1C=C[C@H](CC(=O)NC2CCCCC2)O[C@H]1CO	BroadT	BRD-K24848743	BRD-K24848743-001-01-9	Broad Institute of MIT and Harvard	BRD-K24848743			CCCNC(=O)N[C@H]1C=C[C@H](CC(=O)NC2CCCCC2)O[C@H]1CO	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15+,16+/m1/s1	KRKFLLVHIFIBNR-PMPSAXMXSA-N	353.231456502							122267
BRD-K91620436	LSM-33711		54639872	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18-,19-/m0/s1	CSAZNKSAKUIKBW-WDSOQIARSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K91620436	BRD-K91620436-001-01-2	Broad Institute of MIT and Harvard	BRD-K91620436			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18-,19-/m0/s1	CSAZNKSAKUIKBW-WDSOQIARSA-N	419.15149162							122268
BRD-K33098168	LSM-33712		54639805	InChI=1S/C15H19N3O4S/c19-8-12-11(17-14(21)9-1-2-9)4-3-10(22-12)7-13(20)18-15-16-5-6-23-15/h3-6,9-12,19H,1-2,7-8H2,(H,17,21)(H,16,18,20)/t10-,11+,12+/m0/s1	RVRNWRREFDZYAW-QJPTWQEYSA-N	OC[C@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)C3CC3	BroadT	BRD-K33098168	BRD-K33098168-001-01-6	Broad Institute of MIT and Harvard	BRD-K33098168			OC[C@H]1O[C@H](CC(=O)Nc2nccs2)C=C[C@H]1NC(=O)C1CC1	InChI=1S/C15H19N3O4S/c19-8-12-11(17-14(21)9-1-2-9)4-3-10(22-12)7-13(20)18-15-16-5-6-23-15/h3-6,9-12,19H,1-2,7-8H2,(H,17,21)(H,16,18,20)/t10-,11+,12+/m0/s1	RVRNWRREFDZYAW-QJPTWQEYSA-N	337.109626808							122269
BRD-K64393896	LSM-33713		54640099	InChI=1S/C19H28N2O6/c1-25-12-19(24)21-15-8-7-14(27-17(15)11-22)9-18(23)20-10-13-5-3-4-6-16(13)26-2/h3-6,14-15,17,22H,7-12H2,1-2H3,(H,20,23)(H,21,24)/t14-,15-,17+/m1/s1	PZSXLCWRMIJETI-INMHGKMJSA-N	COCC(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccccc2OC)O[C@H]1CO	BroadT	BRD-K64393896	BRD-K64393896-001-01-2	Broad Institute of MIT and Harvard	BRD-K64393896			COCC(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccccc2OC)O[C@H]1CO	InChI=1S/C19H28N2O6/c1-25-12-19(24)21-15-8-7-14(27-17(15)11-22)9-18(23)20-10-13-5-3-4-6-16(13)26-2/h3-6,14-15,17,22H,7-12H2,1-2H3,(H,20,23)(H,21,24)/t14-,15-,17+/m1/s1	PZSXLCWRMIJETI-INMHGKMJSA-N	380.194736636							122270
BRD-K61691014-001-01-9	LSM-33714	BRD-K61691014	54640005	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13-,14-/m1/s1	KZMUEAIOUSMXHL-MRVWCRGKSA-N	NCC[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@@H](CO)O1	BroadT	BRD-K61691014	BRD-K61691014-001-01-9	Broad Institute of MIT and Harvard	BRD-K61691014			NCC[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@@H](CO)O1	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13-,14-/m1/s1	KZMUEAIOUSMXHL-MRVWCRGKSA-N	348.091055572							122271
BRD-K68118416	LSM-33715		54639825	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17-,20+/m0/s1	NAHOTKSUDDAWEB-ABSDTBQOSA-N	OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K68118416	BRD-K68118416-001-01-0	Broad Institute of MIT and Harvard	BRD-K68118416			OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17-,20+/m0/s1	NAHOTKSUDDAWEB-ABSDTBQOSA-N	449.216200362							122272
BRD-K54260552	LSM-33716		54639968	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17-,18+/m1/s1	JMJYAJMXQVZTFW-KURKYZTESA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@H]1NC(=O)c3ccccc3	BroadT	BRD-K54260552	BRD-K54260552-001-01-0	Broad Institute of MIT and Harvard	BRD-K54260552			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@H]1NC(=O)c1ccccc1	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17-,18+/m1/s1	JMJYAJMXQVZTFW-KURKYZTESA-N	382.164105224							122273
BRD-K48699175	LSM-33717		54640054	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18+/m0/s1	IHGRXRHOBYYXJU-OKZBNKHCSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NC(=O)Cc2cccnc2)[C@@H](CO)O1	BroadT	BRD-K48699175	BRD-K48699175-001-01-5	Broad Institute of MIT and Harvard	BRD-K48699175			CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NC(=O)Cc2cccnc2)[C@@H](CO)O1	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18+/m0/s1	IHGRXRHOBYYXJU-OKZBNKHCSA-N	392.242355544							122274
BRD-K67460571	LSM-33718		54640040	InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18+,19-/m1/s1	TUNGNDZZYYVKEI-NZSAHSFTSA-N	OC[C@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K67460571	BRD-K67460571-001-01-8	Broad Institute of MIT and Harvard	BRD-K67460571			OC[C@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18+,19-/m1/s1	TUNGNDZZYYVKEI-NZSAHSFTSA-N	467.128169362							122275
BRD-K22246901	LSM-33719		54639905	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22-/m0/s1	WADXMENNSPGANR-ZMUPPCTCSA-N	COc1ccccc1NC(=O)N[C@@H]2C=C[C@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K22246901	BRD-K22246901-001-01-6	Broad Institute of MIT and Harvard	BRD-K22246901			COc1ccccc1NC(=O)N[C@@H]1C=C[C@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22-/m0/s1	WADXMENNSPGANR-ZMUPPCTCSA-N	439.210721058							122276
BRD-K69196951-001-01-6	LSM-33720	BRD-K69196951	54639797	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14+,15-/m0/s1	XITZEOXYAYTYOD-CFVMTHIKSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccccc2)[C@H](CO)O1	BroadT	BRD-K69196951	BRD-K69196951-001-01-6	Broad Institute of MIT and Harvard	BRD-K69196951			CN(C)C(=O)C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccccc2)[C@H](CO)O1	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14+,15-/m0/s1	XITZEOXYAYTYOD-CFVMTHIKSA-N	356.140592578							122277
BRD-K40418847	LSM-33721		54640033	InChI=1S/C17H24N4O3/c1-23-13-4-2-12(3-5-13)16-10-21(20-19-16)9-8-14-6-7-15(18)17(11-22)24-14/h2-5,10,14-15,17,22H,6-9,11,18H2,1H3/t14-,15-,17+/m1/s1	QGKSTFQSSSITBY-INMHGKMJSA-N	COc1ccc(cc1)c2cn(CC[C@H]3CC[C@@H](N)[C@H](CO)O3)nn2	BroadT	BRD-K40418847	BRD-K40418847-001-01-6	Broad Institute of MIT and Harvard	BRD-K40418847			COc1ccc(cc1)-c1cn(CC[C@H]2CC[C@@H](N)[C@H](CO)O2)nn1	InChI=1S/C17H24N4O3/c1-23-13-4-2-12(3-5-13)16-10-21(20-19-16)9-8-14-6-7-15(18)17(11-22)24-14/h2-5,10,14-15,17,22H,6-9,11,18H2,1H3/t14-,15-,17+/m1/s1	QGKSTFQSSSITBY-INMHGKMJSA-N	332.184840668							122278
BRD-K66852478	LSM-33722		54639976	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19-,20+/m1/s1	KHPOILJWMXIQKX-AQNXPRMDSA-N	COc1ccc(NC(=O)N[C@@H]2C=C[C@H](CC(=O)NC3CCCCC3)O[C@H]2CO)cc1	BroadT	BRD-K66852478	BRD-K66852478-001-01-1	Broad Institute of MIT and Harvard	BRD-K66852478			COc1ccc(NC(=O)N[C@@H]2C=C[C@H](CC(=O)NC3CCCCC3)O[C@H]2CO)cc1	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19-,20+/m1/s1	KHPOILJWMXIQKX-AQNXPRMDSA-N	417.226371122							122279
BRD-K36852613	LSM-33723		54639885	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18-,19-/m0/s1	ZYZRAOAZZGCSLT-WDSOQIARSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccncn3)O[C@H]2CO	BroadT	BRD-K36852613	BRD-K36852613-001-01-4	Broad Institute of MIT and Harvard	BRD-K36852613			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccncn2)O[C@H]1CO	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18-,19-/m0/s1	ZYZRAOAZZGCSLT-WDSOQIARSA-N	434.162390662							122280
BRD-K94647035	LSM-33724		54639827	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17+,20-/m0/s1	NAHOTKSUDDAWEB-QKLQHJQFSA-N	OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K94647035	BRD-K94647035-001-01-7	Broad Institute of MIT and Harvard	BRD-K94647035			OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17+,20-/m0/s1	NAHOTKSUDDAWEB-QKLQHJQFSA-N	449.216200362							122281
BRD-K64264263	LSM-33725		54640058	InChI=1S/C20H30FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-7,14,17-18,25H,5,8-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18+/m0/s1	RNBICINZPSPKFD-BMGDILEWSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	BroadT	BRD-K64264263	BRD-K64264263-001-01-0	Broad Institute of MIT and Harvard	BRD-K64264263			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	InChI=1S/C20H30FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-7,14,17-18,25H,5,8-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18+/m0/s1	RNBICINZPSPKFD-BMGDILEWSA-N	395.22203467							122282
BRD-K96547094	LSM-33726		54639880	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18-/m1/s1	BFDDYBZFCVNWOI-UWWQBHOKSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)C=C[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K96547094	BRD-K96547094-001-01-5	Broad Institute of MIT and Harvard	BRD-K96547094			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)C=C[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18-/m1/s1	BFDDYBZFCVNWOI-UWWQBHOKSA-N	400.154683392							122283
BRD-K44908610	LSM-33727		54640032	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19+,20-/m0/s1	JNAWISBSOJGFKT-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K44908610	BRD-K44908610-001-01-7	Broad Institute of MIT and Harvard	BRD-K44908610			OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19+,20-/m0/s1	JNAWISBSOJGFKT-ZCNNSNEGSA-N	432.237270164							122284
BRD-K89524688	LSM-33728		54640004	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13-,14+/m1/s1	KZMUEAIOUSMXHL-BNOWGMLFSA-N	NCC[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@H](CO)O1	BroadT	BRD-K89524688	BRD-K89524688-001-01-5	Broad Institute of MIT and Harvard	BRD-K89524688			NCC[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@H](CO)O1	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13-,14+/m1/s1	KZMUEAIOUSMXHL-BNOWGMLFSA-N	348.091055572							122285
BRD-K67931592	LSM-33729		54639954	InChI=1S/C17H25N3O5S/c21-10-14-13(19-16(23)11-3-6-24-7-4-11)2-1-12(25-14)9-15(22)20-17-18-5-8-26-17/h5,8,11-14,21H,1-4,6-7,9-10H2,(H,19,23)(H,18,20,22)/t12-,13+,14-/m1/s1	BGYIYMFDHNUKRK-HZSPNIEDSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K67931592	BRD-K67931592-001-01-3	Broad Institute of MIT and Harvard	BRD-K67931592			OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C17H25N3O5S/c21-10-14-13(19-16(23)11-3-6-24-7-4-11)2-1-12(25-14)9-15(22)20-17-18-5-8-26-17/h5,8,11-14,21H,1-4,6-7,9-10H2,(H,19,23)(H,18,20,22)/t12-,13+,14-/m1/s1	BGYIYMFDHNUKRK-HZSPNIEDSA-N	383.15149162							122286
BRD-K06147970	LSM-33730		54640087	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19+/m0/s1	DRBUEWBLJCFPHK-UDTPNQRGSA-N	C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)C2CCC2)C=C1)c3ccccc3	BroadT	BRD-K06147970	BRD-K06147970-001-01-2	Broad Institute of MIT and Harvard	BRD-K06147970			C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)C2CCC2)C=C1)c1ccccc1	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19+/m0/s1	DRBUEWBLJCFPHK-UDTPNQRGSA-N	372.204907396							122287
BRD-K46913557	LSM-33731		54640070	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15-/m1/s1	AVCGIXMUPLIHTE-QLFBSQMISA-N	CCCNC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	BroadT	BRD-K46913557	BRD-K46913557-001-01-0	Broad Institute of MIT and Harvard	BRD-K46913557			CCCNC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15-/m1/s1	AVCGIXMUPLIHTE-QLFBSQMISA-N	354.22670548							122288
BRD-K54351101	LSM-33732		54639983	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17+,19-/m1/s1	ULTMRAJJWBMPBO-HHXXYDBFSA-N	OC[C@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K54351101	BRD-K54351101-001-01-3	Broad Institute of MIT and Harvard	BRD-K54351101			OC[C@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17+,19-/m1/s1	ULTMRAJJWBMPBO-HHXXYDBFSA-N	456.2184265							122289
BRD-K02078126	LSM-33733		54640001	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17+,18-/m0/s1	AFXALTHXBUYGQN-KSZLIROESA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)CN(C)C)[C@H](CO)O2)cc1	BroadT	BRD-K02078126	BRD-K02078126-001-01-6	Broad Institute of MIT and Harvard	BRD-K02078126			COc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)CN(C)C)[C@H](CO)O2)cc1	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17+,18-/m0/s1	AFXALTHXBUYGQN-KSZLIROESA-N	393.226371122							122290
BRD-K25878187	LSM-33734		54639884	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18-,19-/m1/s1	ZYZRAOAZZGCSLT-BHIYHBOVSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccncn3)O[C@@H]2CO	BroadT	BRD-K25878187	BRD-K25878187-001-01-8	Broad Institute of MIT and Harvard	BRD-K25878187			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)NCc2ccncn2)O[C@@H]1CO	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18-,19-/m1/s1	ZYZRAOAZZGCSLT-BHIYHBOVSA-N	434.162390662							122291
BRD-K22949587	LSM-33735		54640079	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18-,19-/m1/s1	DRBUEWBLJCFPHK-ZWQIFLOQSA-N	C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)C2CCC2)C=C1)c3ccccc3	BroadT	BRD-K22949587	BRD-K22949587-001-01-6	Broad Institute of MIT and Harvard	BRD-K22949587			C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)C2CCC2)C=C1)c1ccccc1	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18-,19-/m1/s1	DRBUEWBLJCFPHK-ZWQIFLOQSA-N	372.204907396							122292
BRD-K50423606	LSM-33736		54640052	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18-/m1/s1	IHGRXRHOBYYXJU-KZNAEPCWSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2cccnc2)[C@@H](CO)O1	BroadT	BRD-K50423606	BRD-K50423606-001-01-4	Broad Institute of MIT and Harvard	BRD-K50423606			CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2cccnc2)[C@@H](CO)O1	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18-/m1/s1	IHGRXRHOBYYXJU-KZNAEPCWSA-N	392.242355544							122293
CHEMBL2362165	LSM-33737	BRD-K19269952, SID131436197	54639900	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22+/m1/s1	WADXMENNSPGANR-NTPMHYTDSA-N	COc1ccccc1NC(=O)N[C@H]2C=C[C@@H](CC(=O)N[C@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K19269952	BRD-K19269952-001-01-1	Broad Institute of MIT and Harvard	BRD-K19269952			COc1ccccc1NC(=O)N[C@H]1C=C[C@@H](CC(=O)N[C@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22+/m1/s1	WADXMENNSPGANR-NTPMHYTDSA-N	439.210721058							122294
BRD-K43922968	LSM-33738		54639934	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19-,22+/m0/s1	PWRMKQUARCEQEU-CNNODRBYSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K43922968	BRD-K43922968-001-01-7	Broad Institute of MIT and Harvard	BRD-K43922968			OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19-,22+/m0/s1	PWRMKQUARCEQEU-CNNODRBYSA-N	476.161721946							122295
BRD-K12431811	LSM-33739		54639894	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15-,17+/m1/s1	CJRAIIYLTSRGNA-INMHGKMJSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K12431811	BRD-K12431811-001-01-5	Broad Institute of MIT and Harvard	BRD-K12431811			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c1ccccn1	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15-,17+/m1/s1	CJRAIIYLTSRGNA-INMHGKMJSA-N	359.18450631							122296
BRD-K76329122	LSM-33740		54640105	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19-,22+/m0/s1	BXPDQGCNKCQIEP-CNNODRBYSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)cc1	BroadT	BRD-K76329122	BRD-K76329122-001-01-8	Broad Institute of MIT and Harvard	BRD-K76329122			COc1ccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)cc1	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19-,22+/m0/s1	BXPDQGCNKCQIEP-CNNODRBYSA-N	471.200550298							122297
BRD-K20264945	LSM-33741		54639826	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17+,20-/m1/s1	NAHOTKSUDDAWEB-FUHIMQAGSA-N	OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K20264945	BRD-K20264945-001-01-9	Broad Institute of MIT and Harvard	BRD-K20264945			OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17+,20-/m1/s1	NAHOTKSUDDAWEB-FUHIMQAGSA-N	449.216200362							122298
BRD-K96254487	LSM-33742		54640108	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19+,22-/m0/s1	BXPDQGCNKCQIEP-JQVVWYNYSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)cc1	BroadT	BRD-K96254487	BRD-K96254487-001-01-3	Broad Institute of MIT and Harvard	BRD-K96254487			COc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)cc1	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19+,22-/m0/s1	BXPDQGCNKCQIEP-JQVVWYNYSA-N	471.200550298							122299
BRD-K92291448	LSM-33743		54639882	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18+,19+/m1/s1	ZYZRAOAZZGCSLT-NEWSRXKRSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccncn3)O[C@H]2CO	BroadT	BRD-K92291448	BRD-K92291448-001-01-7	Broad Institute of MIT and Harvard	BRD-K92291448			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccncn2)O[C@H]1CO	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18+,19+/m1/s1	ZYZRAOAZZGCSLT-NEWSRXKRSA-N	434.162390662							122300
BRD-K06146578	LSM-33744		54639961	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15-,16+/m1/s1	KRKFLLVHIFIBNR-OAGGEKHMSA-N	CCCNC(=O)N[C@@H]1C=C[C@H](CC(=O)NC2CCCCC2)O[C@H]1CO	BroadT	BRD-K06146578	BRD-K06146578-001-01-0	Broad Institute of MIT and Harvard	BRD-K06146578			CCCNC(=O)N[C@@H]1C=C[C@H](CC(=O)NC2CCCCC2)O[C@H]1CO	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15-,16+/m1/s1	KRKFLLVHIFIBNR-OAGGEKHMSA-N	353.231456502							122301
BRD-K89638177	LSM-33745		54639889	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15+,17+/m0/s1	CJRAIIYLTSRGNA-ZMSDIMECSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K89638177	BRD-K89638177-001-01-1	Broad Institute of MIT and Harvard	BRD-K89638177			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@H]1NC(=O)c1ccccn1	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15+,17+/m0/s1	CJRAIIYLTSRGNA-ZMSDIMECSA-N	359.18450631							122302
BRD-K93459372	LSM-33746		54640053	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18-/m0/s1	IHGRXRHOBYYXJU-BZSNNMDCSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NC(=O)Cc2cccnc2)[C@H](CO)O1	BroadT	BRD-K93459372	BRD-K93459372-001-01-9	Broad Institute of MIT and Harvard	BRD-K93459372			CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NC(=O)Cc2cccnc2)[C@H](CO)O1	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18-/m0/s1	IHGRXRHOBYYXJU-BZSNNMDCSA-N	392.242355544							122303
BRD-K31554491	LSM-33747		54639855	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19-,20+/m0/s1	UXWKWPDPCRHNPI-SLFFLAALSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C3CCCCC3	BroadT	BRD-K31554491	BRD-K31554491-001-01-8	Broad Institute of MIT and Harvard	BRD-K31554491			OC[C@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C1CCCCC1	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19-,20+/m0/s1	UXWKWPDPCRHNPI-SLFFLAALSA-N	406.226785692							122304
BRD-K05657319	LSM-33748		54640038	InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18-,19-/m1/s1	TUNGNDZZYYVKEI-BHIYHBOVSA-N	OC[C@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K05657319	BRD-K05657319-001-01-1	Broad Institute of MIT and Harvard	BRD-K05657319			OC[C@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18-,19-/m1/s1	TUNGNDZZYYVKEI-BHIYHBOVSA-N	467.128169362							122305
BRD-K84048601	LSM-33749		54640025	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19+,20+/m0/s1	JNAWISBSOJGFKT-XUVXKRRUSA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K84048601	BRD-K84048601-001-01-4	Broad Institute of MIT and Harvard	BRD-K84048601			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19+,20+/m0/s1	JNAWISBSOJGFKT-XUVXKRRUSA-N	432.237270164							122306
BRD-K04741797	LSM-33750		54640050	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18+/m0/s1	IHGRXRHOBYYXJU-RCCFBDPRSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2cccnc2)[C@@H](CO)O1	BroadT	BRD-K04741797	BRD-K04741797-001-01-5	Broad Institute of MIT and Harvard	BRD-K04741797			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2cccnc2)[C@@H](CO)O1	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18+/m0/s1	IHGRXRHOBYYXJU-RCCFBDPRSA-N	392.242355544							122307
BRD-K10696228	LSM-33751		54639929	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18-,19-/m0/s1	MGFIPLUDFSCRIT-WDSOQIARSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K10696228	BRD-K10696228-001-01-2	Broad Institute of MIT and Harvard	BRD-K10696228			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18-,19-/m0/s1	MGFIPLUDFSCRIT-WDSOQIARSA-N	470.107848488							122308
BRD-K35588268	LSM-33752		54639836	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17+,19+/m0/s1	VLQCPCSLOMVUJP-YQVWRLOYSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K35588268	BRD-K35588268-001-01-3	Broad Institute of MIT and Harvard	BRD-K35588268			OC[C@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17+,19+/m0/s1	VLQCPCSLOMVUJP-YQVWRLOYSA-N	389.231456502							122309
BRD-K88351048	LSM-33753		54639903	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22+/m0/s1	WADXMENNSPGANR-JXYHXMIBSA-N	COc1ccccc1NC(=O)N[C@H]2C=C[C@@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K88351048	BRD-K88351048-001-01-9	Broad Institute of MIT and Harvard	BRD-K88351048			COc1ccccc1NC(=O)N[C@H]1C=C[C@@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22+/m0/s1	WADXMENNSPGANR-JXYHXMIBSA-N	439.210721058							122310
BRD-K62555617	LSM-33754		54640029	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19-,20+/m0/s1	JNAWISBSOJGFKT-SLFFLAALSA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K62555617	BRD-K62555617-001-01-6	Broad Institute of MIT and Harvard	BRD-K62555617			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19-,20+/m0/s1	JNAWISBSOJGFKT-SLFFLAALSA-N	432.237270164							122311
BRD-K93697231	LSM-33755		54640028	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19-,20-/m0/s1	JNAWISBSOJGFKT-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K93697231	BRD-K93697231-001-01-5	Broad Institute of MIT and Harvard	BRD-K93697231			OC[C@@H]1O[C@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19-,20-/m0/s1	JNAWISBSOJGFKT-UFYCRDLUSA-N	432.237270164							122312
BRD-K68683482	LSM-33756		54640083	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19-/m1/s1	DRBUEWBLJCFPHK-UTRMSSBJSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)C2CCC2)C=C1)c3ccccc3	BroadT	BRD-K68683482	BRD-K68683482-001-01-2	Broad Institute of MIT and Harvard	BRD-K68683482			C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)C2CCC2)C=C1)c1ccccc1	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19-/m1/s1	DRBUEWBLJCFPHK-UTRMSSBJSA-N	372.204907396							122313
BRD-K45073068	LSM-33757		54640106	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19-,22+/m1/s1	BXPDQGCNKCQIEP-KNKQGSTJSA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)cc1	BroadT	BRD-K45073068	BRD-K45073068-001-01-6	Broad Institute of MIT and Harvard	BRD-K45073068			COc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)cc1	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19-,22+/m1/s1	BXPDQGCNKCQIEP-KNKQGSTJSA-N	471.200550298							122314
BRD-K61886116	LSM-33758		54639888	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18+,19-/m0/s1	ZYZRAOAZZGCSLT-UHOSZYNNSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccncn3)O[C@H]2CO	BroadT	BRD-K61886116	BRD-K61886116-001-01-2	Broad Institute of MIT and Harvard	BRD-K61886116			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccncn2)O[C@H]1CO	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18+,19-/m0/s1	ZYZRAOAZZGCSLT-UHOSZYNNSA-N	434.162390662							122315
BRD-K56645451	LSM-33759		54639963	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17+,18+/m0/s1	JMJYAJMXQVZTFW-RCCFBDPRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@H]1NC(=O)c3ccccc3	BroadT	BRD-K56645451	BRD-K56645451-001-01-2	Broad Institute of MIT and Harvard	BRD-K56645451			OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@H]1NC(=O)c1ccccc1	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17+,18+/m0/s1	JMJYAJMXQVZTFW-RCCFBDPRSA-N	382.164105224							122316
CHEMBL2354961	LSM-33760	BRD-K24156533, SID131436201	54639904	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22+/m1/s1	WADXMENNSPGANR-ZLLBNUPZSA-N	COc1ccccc1NC(=O)N[C@@H]2C=C[C@H](CC(=O)N[C@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K24156533	BRD-K24156533-001-01-1	Broad Institute of MIT and Harvard	BRD-K24156533			COc1ccccc1NC(=O)N[C@@H]1C=C[C@H](CC(=O)N[C@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22+/m1/s1	WADXMENNSPGANR-ZLLBNUPZSA-N	439.210721058							122317
BRD-K51760683	LSM-33761		54640048	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18+,21-/m1/s1	NHCHTYGGSDNPNS-PLMTUMEDSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c4cccc(F)c4	BroadT	BRD-K51760683	BRD-K51760683-001-01-4	Broad Institute of MIT and Harvard	BRD-K51760683			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18+,21-/m1/s1	NHCHTYGGSDNPNS-PLMTUMEDSA-N	480.13665005							122318
MLS003650018	LSM-33762	BRD-K47966145	53382680	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17+,18-/m1/s1	ZNNAKNJWDLOPKK-FGTMMUONSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C=C[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K47966145	BRD-K47966145-001-01-6	Broad Institute of MIT and Harvard	BRD-K47966145			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17+,18-/m1/s1	ZNNAKNJWDLOPKK-FGTMMUONSA-N	389.195070994							122319
BRD-K60799989	LSM-33763		54640041	InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18+,19-/m0/s1	TUNGNDZZYYVKEI-UHOSZYNNSA-N	OC[C@@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K60799989	BRD-K60799989-001-01-2	Broad Institute of MIT and Harvard	BRD-K60799989			OC[C@@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18+,19-/m0/s1	TUNGNDZZYYVKEI-UHOSZYNNSA-N	467.128169362							122320
BRD-K61795707	LSM-33764		54639798	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17+,18+/m1/s1	ZAWCCEHPCRSVNF-SQNIBIBYSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K61795707	BRD-K61795707-001-01-0	Broad Institute of MIT and Harvard	BRD-K61795707			OC[C@@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)c1ccncc1	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17+,18+/m1/s1	ZAWCCEHPCRSVNF-SQNIBIBYSA-N	391.210721058							122321
BRD-K14399036	LSM-33765		54639971	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19+,20+/m0/s1	KHPOILJWMXIQKX-XUVXKRRUSA-N	COc1ccc(NC(=O)N[C@@H]2C=C[C@@H](CC(=O)NC3CCCCC3)O[C@@H]2CO)cc1	BroadT	BRD-K14399036	BRD-K14399036-001-01-1	Broad Institute of MIT and Harvard	BRD-K14399036			COc1ccc(NC(=O)N[C@@H]2C=C[C@@H](CC(=O)NC3CCCCC3)O[C@@H]2CO)cc1	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19+,20+/m0/s1	KHPOILJWMXIQKX-XUVXKRRUSA-N	417.226371122							122322
BRD-K96438475	LSM-33766		54639936	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19-,22-/m1/s1	PWRMKQUARCEQEU-WOIUINJBSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K96438475	BRD-K96438475-001-01-6	Broad Institute of MIT and Harvard	BRD-K96438475			OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19-,22-/m1/s1	PWRMKQUARCEQEU-WOIUINJBSA-N	476.161721946							122323
BRD-K32037893	LSM-33767		54639865	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17+,18-/m0/s1	INOAIBAAQYWPCB-KSZLIROESA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NC(=O)C4CCOCC4	BroadT	BRD-K32037893	BRD-K32037893-001-01-7	Broad Institute of MIT and Harvard	BRD-K32037893			OC[C@@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17+,18-/m0/s1	INOAIBAAQYWPCB-KSZLIROESA-N	422.252920228							122324
BRD-K60521891	LSM-33768		54639914	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13-,14+/m0/s1	MHCXBMBZURQYRG-MELADBBJSA-N	CN(C)C(=O)C[C@@H]1CC[C@H](NC(=O)NC2CCCC2)[C@@H](CO)O1	BroadT	BRD-K60521891	BRD-K60521891-001-01-7	Broad Institute of MIT and Harvard	BRD-K60521891			CN(C)C(=O)C[C@@H]1CC[C@H](NC(=O)NC2CCCC2)[C@@H](CO)O1	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13-,14+/m0/s1	MHCXBMBZURQYRG-MELADBBJSA-N	327.215806438							122325
BRD-K29441085	LSM-33769		54639831	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15-/m0/s1	XCSADXMQLTVTGS-KKUMJFAQSA-N	CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	BroadT	BRD-K29441085	BRD-K29441085-001-01-4	Broad Institute of MIT and Harvard	BRD-K29441085			CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15-/m0/s1	XCSADXMQLTVTGS-KKUMJFAQSA-N	356.242355544							122326
BRD-K79072801	LSM-33770		54639835	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15-/m0/s1	XCSADXMQLTVTGS-ZNMIVQPWSA-N	CCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	BroadT	BRD-K79072801	BRD-K79072801-001-01-9	Broad Institute of MIT and Harvard	BRD-K79072801			CCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15-/m0/s1	XCSADXMQLTVTGS-ZNMIVQPWSA-N	356.242355544							122327
BRD-K14375790	LSM-33771		54639988	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16-,17-/m1/s1	HAYHGVRNUREYAI-BRWVUGGUSA-N	CN(C)CC(=O)N[C@@H]1C=C[C@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	BroadT	BRD-K14375790	BRD-K14375790-001-01-7	Broad Institute of MIT and Harvard	BRD-K14375790			CN(C)CC(=O)N[C@@H]1C=C[C@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16-,17-/m1/s1	HAYHGVRNUREYAI-BRWVUGGUSA-N	382.258005608							122328
BRD-K61414850	LSM-33772		54639819	InChI=1S/C20H26N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-7,16-18,23H,8-14H2,(H,21,24)/t16-,17+,18-/m0/s1	IQQRIWPPTLHHIL-KSZLIROESA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)Cc3ccccc3	BroadT	BRD-K61414850	BRD-K61414850-001-01-3	Broad Institute of MIT and Harvard	BRD-K61414850			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C=C[C@H]1NC(=O)Cc1ccccc1	InChI=1S/C20H26N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-7,16-18,23H,8-14H2,(H,21,24)/t16-,17+,18-/m0/s1	IQQRIWPPTLHHIL-KSZLIROESA-N	374.184171952							122329
BRD-K38966099	LSM-33773		54640024	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17+,19-/m0/s1	FRHMAPNXHVZDAK-WDYCEAGBSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccccc2)C=C[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K38966099	BRD-K38966099-001-01-3	Broad Institute of MIT and Harvard	BRD-K38966099			OC[C@@H]1O[C@H](CC(=O)Nc2ccccc2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17+,19-/m0/s1	FRHMAPNXHVZDAK-WDYCEAGBSA-N	417.150012582							122330
BRD-K58025976	LSM-33774		54639969	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17+,18-/m1/s1	JMJYAJMXQVZTFW-FGTMMUONSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NC(=O)c3ccccc3	BroadT	BRD-K58025976	BRD-K58025976-001-01-1	Broad Institute of MIT and Harvard	BRD-K58025976			OC[C@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NC(=O)c1ccccc1	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17+,18-/m1/s1	JMJYAJMXQVZTFW-FGTMMUONSA-N	382.164105224							122331
BRD-K86953192	LSM-33775		54640036	InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18+,19+/m0/s1	TUNGNDZZYYVKEI-QXAKKESOSA-N	OC[C@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K86953192	BRD-K86953192-001-01-8	Broad Institute of MIT and Harvard	BRD-K86953192			OC[C@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@H]1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18+,19+/m0/s1	TUNGNDZZYYVKEI-QXAKKESOSA-N	467.128169362							122332
BRD-K53581215	LSM-33776		54639980	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17+,19+/m1/s1	ULTMRAJJWBMPBO-AYBZRNKSSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K53581215	BRD-K53581215-001-01-9	Broad Institute of MIT and Harvard	BRD-K53581215			OC[C@@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17+,19+/m1/s1	ULTMRAJJWBMPBO-AYBZRNKSSA-N	456.2184265							122333
BRD-K56086519	LSM-33777		54640007	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13+,14-/m1/s1	KZMUEAIOUSMXHL-KWCYVHTRSA-N	NCC[C@H]1CC[C@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@@H](CO)O1	BroadT	BRD-K56086519	BRD-K56086519-001-01-9	Broad Institute of MIT and Harvard	BRD-K56086519			NCC[C@H]1CC[C@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@@H](CO)O1	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13+,14-/m1/s1	KZMUEAIOUSMXHL-KWCYVHTRSA-N	348.091055572							122334
BRD-K53662389	LSM-33778		54639917	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17+,18+/m0/s1	NIFMHKNMYGHVIX-RCCFBDPRSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K53662389	BRD-K53662389-001-01-7	Broad Institute of MIT and Harvard	BRD-K53662389			OC[C@H]1O[C@H](CC(=O)NC2CCCCC2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17+,18+/m0/s1	NIFMHKNMYGHVIX-RCCFBDPRSA-N	397.25767125							122335
BRD-K62229896	LSM-33779		54640026	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19+,20+/m1/s1	JNAWISBSOJGFKT-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K62229896	BRD-K62229896-001-01-0	Broad Institute of MIT and Harvard	BRD-K62229896			OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19+,20+/m1/s1	JNAWISBSOJGFKT-AABGKKOBSA-N	432.237270164							122336
BRD-K47349225	LSM-33780		54639897	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22-/m1/s1	WADXMENNSPGANR-HOQQESESSA-N	COc1ccccc1NC(=O)N[C@@H]2C=C[C@@H](CC(=O)N[C@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K47349225	BRD-K47349225-001-01-8	Broad Institute of MIT and Harvard	BRD-K47349225			COc1ccccc1NC(=O)N[C@@H]1C=C[C@@H](CC(=O)N[C@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22-/m1/s1	WADXMENNSPGANR-HOQQESESSA-N	439.210721058							122337
BRD-K98545272	LSM-33781		54639987	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16+,17+/m1/s1	HAYHGVRNUREYAI-IKGGRYGDSA-N	CN(C)CC(=O)N[C@H]1C=C[C@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	BroadT	BRD-K98545272	BRD-K98545272-001-01-1	Broad Institute of MIT and Harvard	BRD-K98545272			CN(C)CC(=O)N[C@H]1C=C[C@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16+,17+/m1/s1	HAYHGVRNUREYAI-IKGGRYGDSA-N	382.258005608							122338
BRD-K64646189	LSM-33782		54640067	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15-/m0/s1	AVCGIXMUPLIHTE-KKUMJFAQSA-N	CCCNC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	BroadT	BRD-K64646189	BRD-K64646189-001-01-9	Broad Institute of MIT and Harvard	BRD-K64646189			CCCNC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15-/m0/s1	AVCGIXMUPLIHTE-KKUMJFAQSA-N	354.22670548							122339
BRD-K30105551	LSM-33783		54640042	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18+,21+/m0/s1	NHCHTYGGSDNPNS-YRISNDGFSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c4cccc(F)c4	BroadT	BRD-K30105551	BRD-K30105551-001-01-7	Broad Institute of MIT and Harvard	BRD-K30105551			OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18+,21+/m0/s1	NHCHTYGGSDNPNS-YRISNDGFSA-N	480.13665005							122340
BRD-K59149254	LSM-33784		54640016	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18+,19-/m0/s1	CAYTZIHCJIWWNW-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K59149254	BRD-K59149254-001-01-1	Broad Institute of MIT and Harvard	BRD-K59149254			OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18+,19-/m0/s1	CAYTZIHCJIWWNW-OTWHNJEPSA-N	420.237270164							122341
BRD-K91239327	LSM-33785		54639922	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17-,18+/m1/s1	NIFMHKNMYGHVIX-KURKYZTESA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K91239327	BRD-K91239327-001-01-3	Broad Institute of MIT and Harvard	BRD-K91239327			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17-,18+/m1/s1	NIFMHKNMYGHVIX-KURKYZTESA-N	397.25767125							122342
BRD-K37975989	LSM-33786		54639907	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22-/m1/s1	WADXMENNSPGANR-UYKQMDHISA-N	COc1ccccc1NC(=O)N[C@H]2C=C[C@H](CC(=O)N[C@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K37975989	BRD-K37975989-001-01-8	Broad Institute of MIT and Harvard	BRD-K37975989			COc1ccccc1NC(=O)N[C@H]1C=C[C@H](CC(=O)N[C@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22-/m1/s1	WADXMENNSPGANR-UYKQMDHISA-N	439.210721058							122343
BRD-K51272331	LSM-33787		54639833	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15+/m1/s1	XCSADXMQLTVTGS-KFWWJZLASA-N	CCCNC(=O)N[C@@H]1CC[C@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	BroadT	BRD-K51272331	BRD-K51272331-001-01-6	Broad Institute of MIT and Harvard	BRD-K51272331			CCCNC(=O)N[C@@H]1CC[C@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15+/m1/s1	XCSADXMQLTVTGS-KFWWJZLASA-N	356.242355544							122344
BRD-K25596713	LSM-33788		54640015	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18-,19+/m0/s1	CAYTZIHCJIWWNW-GBESFXJTSA-N	OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K25596713	BRD-K25596713-001-01-9	Broad Institute of MIT and Harvard	BRD-K25596713			OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18-,19+/m0/s1	CAYTZIHCJIWWNW-GBESFXJTSA-N	420.237270164							122345
BRD-K02060635	LSM-33789		54639875	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18+/m1/s1	BFDDYBZFCVNWOI-HFTRVMKXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)C=C[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K02060635	BRD-K02060635-001-01-8	Broad Institute of MIT and Harvard	BRD-K02060635			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)C=C[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18+/m1/s1	BFDDYBZFCVNWOI-HFTRVMKXSA-N	400.154683392							122346
BRD-K82504878	LSM-33790		54639960	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15-,16+/m0/s1	KRKFLLVHIFIBNR-HRCADAONSA-N	CCCNC(=O)N[C@H]1C=C[C@@H](CC(=O)NC2CCCCC2)O[C@@H]1CO	BroadT	BRD-K82504878	BRD-K82504878-001-01-4	Broad Institute of MIT and Harvard	BRD-K82504878			CCCNC(=O)N[C@H]1C=C[C@@H](CC(=O)NC2CCCCC2)O[C@@H]1CO	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15-,16+/m0/s1	KRKFLLVHIFIBNR-HRCADAONSA-N	353.231456502							122347
BRD-K67750179	LSM-33791		54640060	InChI=1S/C20H30FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-7,14,17-18,25H,5,8-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17-,18+/m0/s1	RNBICINZPSPKFD-JCGIZDLHSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	BroadT	BRD-K67750179	BRD-K67750179-001-01-8	Broad Institute of MIT and Harvard	BRD-K67750179			CN(C)CCCNC(=O)C[C@@H]1CC[C@H](NC(=O)c2ccccc2F)[C@@H](CO)O1	InChI=1S/C20H30FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-7,14,17-18,25H,5,8-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17-,18+/m0/s1	RNBICINZPSPKFD-JCGIZDLHSA-N	395.22203467							122348
BRD-K26321439	LSM-33792		54639967	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17-,18+/m0/s1	JMJYAJMXQVZTFW-OKZBNKHCSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NC(=O)c3ccccc3	BroadT	BRD-K26321439	BRD-K26321439-001-01-4	Broad Institute of MIT and Harvard	BRD-K26321439			OC[C@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NC(=O)c1ccccc1	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17-,18+/m0/s1	JMJYAJMXQVZTFW-OKZBNKHCSA-N	382.164105224							122349
BRD-K59049340	LSM-33793		54639927	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18-,19+/m1/s1	MGFIPLUDFSCRIT-QRQLOZEOSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K59049340	BRD-K59049340-001-01-9	Broad Institute of MIT and Harvard	BRD-K59049340			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18-,19+/m1/s1	MGFIPLUDFSCRIT-QRQLOZEOSA-N	470.107848488							122350
BRD-K64797043	LSM-33794		54640072	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19+,20+/m0/s1	PELUPFPZEXCELD-XUVXKRRUSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K64797043	BRD-K64797043-001-01-6	Broad Institute of MIT and Harvard	BRD-K64797043			OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19+,20+/m0/s1	PELUPFPZEXCELD-XUVXKRRUSA-N	413.175084478							122351
BRD-K76951235	LSM-33795		54639909	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22-/m0/s1	WADXMENNSPGANR-QTUQIOHYSA-N	COc1ccccc1NC(=O)N[C@@H]2C=C[C@@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K76951235	BRD-K76951235-001-01-3	Broad Institute of MIT and Harvard	BRD-K76951235			COc1ccccc1NC(=O)N[C@@H]1C=C[C@@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22-/m0/s1	WADXMENNSPGANR-QTUQIOHYSA-N	439.210721058							122352
BRD-K24599650	LSM-33796		54639985	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17-,19+/m0/s1	ULTMRAJJWBMPBO-VDZJLULYSA-N	OC[C@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K24599650	BRD-K24599650-001-01-9	Broad Institute of MIT and Harvard	BRD-K24599650			OC[C@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17-,19+/m0/s1	ULTMRAJJWBMPBO-VDZJLULYSA-N	456.2184265							122353
BRD-K86371068	LSM-33797		54639823	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17-,20+/m1/s1	NAHOTKSUDDAWEB-HLIPFELVSA-N	OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K86371068	BRD-K86371068-001-01-4	Broad Institute of MIT and Harvard	BRD-K86371068			OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17-,20+/m1/s1	NAHOTKSUDDAWEB-HLIPFELVSA-N	449.216200362							122354
BRD-K30761927	LSM-33798		54639901	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22-/m0/s1	WADXMENNSPGANR-UZSDIVCKSA-N	COc1ccccc1NC(=O)N[C@H]2C=C[C@@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K30761927	BRD-K30761927-001-01-4	Broad Institute of MIT and Harvard	BRD-K30761927			COc1ccccc1NC(=O)N[C@H]1C=C[C@@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20-,22-/m0/s1	WADXMENNSPGANR-UZSDIVCKSA-N	439.210721058							122355
BRD-K14868348	LSM-33799		54639918	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17+,18+/m1/s1	NIFMHKNMYGHVIX-SQNIBIBYSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K14868348	BRD-K14868348-001-01-8	Broad Institute of MIT and Harvard	BRD-K14868348			OC[C@@H]1O[C@@H](CC(=O)NC2CCCCC2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17+,18+/m1/s1	NIFMHKNMYGHVIX-SQNIBIBYSA-N	397.25767125							122356
BRD-K05060234	LSM-33800		54639999	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17-,18+/m1/s1	AFXALTHXBUYGQN-KURKYZTESA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)CN(C)C)[C@H](CO)O2)cc1	BroadT	BRD-K05060234	BRD-K05060234-001-01-0	Broad Institute of MIT and Harvard	BRD-K05060234			COc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)CN(C)C)[C@H](CO)O2)cc1	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17-,18+/m1/s1	AFXALTHXBUYGQN-KURKYZTESA-N	393.226371122							122357
BRD-K70148902	LSM-33801		54639993	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16+,17-/m0/s1	HAYHGVRNUREYAI-BBWFWOEESA-N	CN(C)CC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	BroadT	BRD-K70148902	BRD-K70148902-001-01-4	Broad Institute of MIT and Harvard	BRD-K70148902			CN(C)CC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16+,17-/m0/s1	HAYHGVRNUREYAI-BBWFWOEESA-N	382.258005608							122358
BRD-K67194214	LSM-33802		54639870	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18+,19-/m1/s1	CSAZNKSAKUIKBW-NZSAHSFTSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K67194214	BRD-K67194214-001-01-6	Broad Institute of MIT and Harvard	BRD-K67194214			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18+,19-/m1/s1	CSAZNKSAKUIKBW-NZSAHSFTSA-N	419.15149162							122359
BRD-K62369921	LSM-33803		54639984	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17-,19-/m0/s1	ULTMRAJJWBMPBO-IEZWGBDMSA-N	OC[C@@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K62369921	BRD-K62369921-001-01-3	Broad Institute of MIT and Harvard	BRD-K62369921			OC[C@@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17-,19-/m0/s1	ULTMRAJJWBMPBO-IEZWGBDMSA-N	456.2184265							122360
BRD-K40621788	LSM-33804		54639910	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13+,14+/m1/s1	MHCXBMBZURQYRG-RDBSUJKOSA-N	CN(C)C(=O)C[C@H]1CC[C@H](NC(=O)NC2CCCC2)[C@H](CO)O1	BroadT	BRD-K40621788	BRD-K40621788-001-01-6	Broad Institute of MIT and Harvard	BRD-K40621788			CN(C)C(=O)C[C@H]1CC[C@H](NC(=O)NC2CCCC2)[C@H](CO)O1	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13+,14+/m1/s1	MHCXBMBZURQYRG-RDBSUJKOSA-N	327.215806438							122361
BRD-K83842535	LSM-33805		54640063	InChI=1S/C20H30FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-7,14,17-18,25H,5,8-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18-/m0/s1	RNBICINZPSPKFD-QGTPRVQTSA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@H](CO)O1	BroadT	BRD-K83842535	BRD-K83842535-001-01-2	Broad Institute of MIT and Harvard	BRD-K83842535			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@H](CO)O1	InChI=1S/C20H30FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-7,14,17-18,25H,5,8-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17+,18-/m0/s1	RNBICINZPSPKFD-QGTPRVQTSA-N	395.22203467							122362
BRD-K99939085	LSM-33806		54639992	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16+,17-/m1/s1	HAYHGVRNUREYAI-IXDOHACOSA-N	CN(C)CC(=O)N[C@H]1C=C[C@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	BroadT	BRD-K99939085	BRD-K99939085-001-01-2	Broad Institute of MIT and Harvard	BRD-K99939085			CN(C)CC(=O)N[C@H]1C=C[C@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16+,17-/m1/s1	HAYHGVRNUREYAI-IXDOHACOSA-N	382.258005608							122363
BRD-K61924932	LSM-33807		54639851	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19+,20+/m1/s1	UXWKWPDPCRHNPI-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C3CCCCC3	BroadT	BRD-K61924932	BRD-K61924932-001-01-3	Broad Institute of MIT and Harvard	BRD-K61924932			OC[C@@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C1CCCCC1	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19+,20+/m1/s1	UXWKWPDPCRHNPI-AABGKKOBSA-N	406.226785692							122364
BRD-K71486304	LSM-33808		54639972	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19+,20+/m1/s1	KHPOILJWMXIQKX-AABGKKOBSA-N	COc1ccc(NC(=O)N[C@H]2C=C[C@H](CC(=O)NC3CCCCC3)O[C@H]2CO)cc1	BroadT	BRD-K71486304	BRD-K71486304-001-01-1	Broad Institute of MIT and Harvard	BRD-K71486304			COc1ccc(NC(=O)N[C@H]2C=C[C@H](CC(=O)NC3CCCCC3)O[C@H]2CO)cc1	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19+,20+/m1/s1	KHPOILJWMXIQKX-AABGKKOBSA-N	417.226371122							122365
BRD-K49040541	LSM-33809		54639821	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17+,20+/m1/s1	NAHOTKSUDDAWEB-UWVAXJGDSA-N	OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K49040541	BRD-K49040541-001-01-8	Broad Institute of MIT and Harvard	BRD-K49040541			OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17+,20+/m1/s1	NAHOTKSUDDAWEB-UWVAXJGDSA-N	449.216200362							122366
BRD-K37912617	LSM-33810		54640014	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18-,19-/m0/s1	CAYTZIHCJIWWNW-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K37912617	BRD-K37912617-001-01-1	Broad Institute of MIT and Harvard	BRD-K37912617			OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18-,19-/m0/s1	CAYTZIHCJIWWNW-FHWLQOOXSA-N	420.237270164							122367
BRD-K54463500	LSM-33811		54639951	InChI=1S/C17H25N3O5S/c21-10-14-13(19-16(23)11-3-6-24-7-4-11)2-1-12(25-14)9-15(22)20-17-18-5-8-26-17/h5,8,11-14,21H,1-4,6-7,9-10H2,(H,19,23)(H,18,20,22)/t12-,13-,14-/m0/s1	BGYIYMFDHNUKRK-IHRRRGAJSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K54463500	BRD-K54463500-001-01-3	Broad Institute of MIT and Harvard	BRD-K54463500			OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C17H25N3O5S/c21-10-14-13(19-16(23)11-3-6-24-7-4-11)2-1-12(25-14)9-15(22)20-17-18-5-8-26-17/h5,8,11-14,21H,1-4,6-7,9-10H2,(H,19,23)(H,18,20,22)/t12-,13-,14-/m0/s1	BGYIYMFDHNUKRK-IHRRRGAJSA-N	383.15149162							122368
BRD-K98169006	LSM-33812		54639926	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18+,19+/m1/s1	MGFIPLUDFSCRIT-NEWSRXKRSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K98169006	BRD-K98169006-001-01-3	Broad Institute of MIT and Harvard	BRD-K98169006			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18+,19+/m1/s1	MGFIPLUDFSCRIT-NEWSRXKRSA-N	470.107848488							122369
BRD-K79376287	LSM-33813		54639887	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18+,19-/m1/s1	ZYZRAOAZZGCSLT-NZSAHSFTSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccncn3)O[C@@H]2CO	BroadT	BRD-K79376287	BRD-K79376287-001-01-7	Broad Institute of MIT and Harvard	BRD-K79376287			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccncn2)O[C@@H]1CO	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18+,19-/m1/s1	ZYZRAOAZZGCSLT-NZSAHSFTSA-N	434.162390662							122370
BRD-K23670243	LSM-33814		54639876	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18-/m1/s1	BFDDYBZFCVNWOI-QGPMSJSTSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)C=C[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K23670243	BRD-K23670243-001-01-3	Broad Institute of MIT and Harvard	BRD-K23670243			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)C=C[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18-/m1/s1	BFDDYBZFCVNWOI-QGPMSJSTSA-N	400.154683392							122371
BRD-K21466747	LSM-33815		54639915	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13+,14-/m1/s1	MHCXBMBZURQYRG-HZSPNIEDSA-N	CN(C)C(=O)C[C@H]1CC[C@H](NC(=O)NC2CCCC2)[C@@H](CO)O1	BroadT	BRD-K21466747	BRD-K21466747-001-01-9	Broad Institute of MIT and Harvard	BRD-K21466747			CN(C)C(=O)C[C@H]1CC[C@H](NC(=O)NC2CCCC2)[C@@H](CO)O1	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13+,14-/m1/s1	MHCXBMBZURQYRG-HZSPNIEDSA-N	327.215806438							122372
BRD-K37015376	LSM-33816		54639858	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17+,18+/m0/s1	INOAIBAAQYWPCB-RCCFBDPRSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NC(=O)C4CCOCC4	BroadT	BRD-K37015376	BRD-K37015376-001-01-4	Broad Institute of MIT and Harvard	BRD-K37015376			OC[C@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17+,18+/m0/s1	INOAIBAAQYWPCB-RCCFBDPRSA-N	422.252920228							122373
BRD-K79887735	LSM-33817		54639981	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17-,19-/m1/s1	ULTMRAJJWBMPBO-SZVBFZGTSA-N	OC[C@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K79887735	BRD-K79887735-001-01-1	Broad Institute of MIT and Harvard	BRD-K79887735			OC[C@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17-,19-/m1/s1	ULTMRAJJWBMPBO-SZVBFZGTSA-N	456.2184265							122374
BRD-K46623934	LSM-33818		54639923	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17+,18-/m1/s1	NIFMHKNMYGHVIX-FGTMMUONSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K46623934	BRD-K46623934-001-01-9	Broad Institute of MIT and Harvard	BRD-K46623934			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17+,18-/m1/s1	NIFMHKNMYGHVIX-FGTMMUONSA-N	397.25767125							122375
BRD-K08006576	LSM-33819		54640068	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15+/m0/s1	AVCGIXMUPLIHTE-SOUVJXGZSA-N	CCCNC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	BroadT	BRD-K08006576	BRD-K08006576-001-01-6	Broad Institute of MIT and Harvard	BRD-K08006576			CCCNC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15+/m0/s1	AVCGIXMUPLIHTE-SOUVJXGZSA-N	354.22670548							122376
BRD-K99119142	LSM-33820		54639886	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18-,19+/m0/s1	ZYZRAOAZZGCSLT-YTQUADARSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccncn3)O[C@@H]2CO	BroadT	BRD-K99119142	BRD-K99119142-001-01-2	Broad Institute of MIT and Harvard	BRD-K99119142			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccncn2)O[C@@H]1CO	InChI=1S/C20H26N4O5S/c1-14-2-5-17(6-3-14)30(27,28)24-18-7-4-16(29-19(18)12-25)10-20(26)22-11-15-8-9-21-13-23-15/h2-3,5-6,8-9,13,16,18-19,24-25H,4,7,10-12H2,1H3,(H,22,26)/t16-,18-,19+/m0/s1	ZYZRAOAZZGCSLT-YTQUADARSA-N	434.162390662							122377
BRD-K74251295	LSM-33821		54639930	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18+,19-/m1/s1	MGFIPLUDFSCRIT-NZSAHSFTSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K74251295	BRD-K74251295-001-01-7	Broad Institute of MIT and Harvard	BRD-K74251295			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18+,19-/m1/s1	MGFIPLUDFSCRIT-NZSAHSFTSA-N	470.107848488							122378
BRD-K75440064	LSM-33822		54640103	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19+,22+/m1/s1	BXPDQGCNKCQIEP-DXIQSLLYSA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)cc1	BroadT	BRD-K75440064	BRD-K75440064-001-01-4	Broad Institute of MIT and Harvard	BRD-K75440064			COc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@H](CO)O2)cc1	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19+,22+/m1/s1	BXPDQGCNKCQIEP-DXIQSLLYSA-N	471.200550298							122379
BRD-K46308702	LSM-33823		54639952	InChI=1S/C17H25N3O5S/c21-10-14-13(19-16(23)11-3-6-24-7-4-11)2-1-12(25-14)9-15(22)20-17-18-5-8-26-17/h5,8,11-14,21H,1-4,6-7,9-10H2,(H,19,23)(H,18,20,22)/t12-,13-,14+/m0/s1	BGYIYMFDHNUKRK-MELADBBJSA-N	OC[C@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K46308702	BRD-K46308702-001-01-7	Broad Institute of MIT and Harvard	BRD-K46308702			OC[C@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C17H25N3O5S/c21-10-14-13(19-16(23)11-3-6-24-7-4-11)2-1-12(25-14)9-15(22)20-17-18-5-8-26-17/h5,8,11-14,21H,1-4,6-7,9-10H2,(H,19,23)(H,18,20,22)/t12-,13-,14+/m0/s1	BGYIYMFDHNUKRK-MELADBBJSA-N	383.15149162							122380
BRD-K97067262	LSM-33824		54640018	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17+,19+/m1/s1	FRHMAPNXHVZDAK-AYBZRNKSSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccccc2)C=C[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K97067262	BRD-K97067262-001-01-9	Broad Institute of MIT and Harvard	BRD-K97067262			OC[C@@H]1O[C@@H](CC(=O)Nc2ccccc2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17+,19+/m1/s1	FRHMAPNXHVZDAK-AYBZRNKSSA-N	417.150012582							122381
BRD-K46458719	LSM-33825		54639997	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17-,18-/m0/s1	AFXALTHXBUYGQN-BZSNNMDCSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)CN(C)C)[C@H](CO)O2)cc1	BroadT	BRD-K46458719	BRD-K46458719-001-01-1	Broad Institute of MIT and Harvard	BRD-K46458719			COc1ccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)CN(C)C)[C@H](CO)O2)cc1	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17-,18-/m0/s1	AFXALTHXBUYGQN-BZSNNMDCSA-N	393.226371122							122382
CHEMBL3184582	LSM-33826	BRD-K84439371	54639925	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18+,19+/m0/s1	MGFIPLUDFSCRIT-QXAKKESOSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K84439371	BRD-K84439371-001-01-3	Broad Institute of MIT and Harvard	BRD-K84439371			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18+,19+/m0/s1	MGFIPLUDFSCRIT-QXAKKESOSA-N	470.107848488							122383
BRD-K45522895	LSM-33827		54639868	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18-,19+/m0/s1	CSAZNKSAKUIKBW-YTQUADARSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)c3cccnc3	BroadT	BRD-K45522895	BRD-K45522895-001-01-1	Broad Institute of MIT and Harvard	BRD-K45522895			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@@H]1NC(=O)c1cccnc1	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18-,19+/m0/s1	CSAZNKSAKUIKBW-YTQUADARSA-N	419.15149162							122384
BRD-K44779670	LSM-33828		54639938	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19+,22-/m1/s1	PWRMKQUARCEQEU-XQBPLPMBSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K44779670	BRD-K44779670-001-01-9	Broad Institute of MIT and Harvard	BRD-K44779670			OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19+,22-/m1/s1	PWRMKQUARCEQEU-XQBPLPMBSA-N	476.161721946							122385
BRD-K00557942	LSM-33829		54639979	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17+,19+/m0/s1	ULTMRAJJWBMPBO-KVSKMBFKSA-N	OC[C@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K00557942	BRD-K00557942-001-01-3	Broad Institute of MIT and Harvard	BRD-K00557942			OC[C@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17+,19+/m0/s1	ULTMRAJJWBMPBO-KVSKMBFKSA-N	456.2184265							122386
BRD-K56041932	LSM-33830		54639996	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17-,18-/m1/s1	AFXALTHXBUYGQN-KZNAEPCWSA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)CN(C)C)[C@@H](CO)O2)cc1	BroadT	BRD-K56041932	BRD-K56041932-001-01-3	Broad Institute of MIT and Harvard	BRD-K56041932			COc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)CN(C)C)[C@@H](CO)O2)cc1	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17-,18-/m1/s1	AFXALTHXBUYGQN-KZNAEPCWSA-N	393.226371122							122387
BRD-K31889353	LSM-33831		54639856	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19+,20-/m1/s1	UXWKWPDPCRHNPI-HSALFYBXSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C3CCCCC3	BroadT	BRD-K31889353	BRD-K31889353-001-01-5	Broad Institute of MIT and Harvard	BRD-K31889353			OC[C@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C1CCCCC1	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19+,20-/m1/s1	UXWKWPDPCRHNPI-HSALFYBXSA-N	406.226785692							122388
BRD-K13888422	LSM-33832		54639899	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22+/m1/s1	WADXMENNSPGANR-MDRHQERFSA-N	COc1ccccc1NC(=O)N[C@H]2C=C[C@H](CC(=O)N[C@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K13888422	BRD-K13888422-001-01-6	Broad Institute of MIT and Harvard	BRD-K13888422			COc1ccccc1NC(=O)N[C@H]1C=C[C@H](CC(=O)N[C@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22+/m1/s1	WADXMENNSPGANR-MDRHQERFSA-N	439.210721058							122389
BRD-K50596260	LSM-33833		54640013	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18-,19-/m1/s1	CAYTZIHCJIWWNW-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K50596260	BRD-K50596260-001-01-4	Broad Institute of MIT and Harvard	BRD-K50596260			OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18-,19-/m1/s1	CAYTZIHCJIWWNW-GUDVDZBRSA-N	420.237270164							122390
BRD-K93023309	LSM-33834		54639849	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17+,18-/m0/s1	ZNNAKNJWDLOPKK-KSZLIROESA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C=C[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K93023309	BRD-K93023309-001-01-1	Broad Institute of MIT and Harvard	BRD-K93023309			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C=C[C@H]1NC(=O)C1CCOCC1	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17+,18-/m0/s1	ZNNAKNJWDLOPKK-KSZLIROESA-N	389.195070994							122391
BRD-K01960204	LSM-33835		54639966	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17-,18-/m0/s1	JMJYAJMXQVZTFW-BZSNNMDCSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NC(=O)c3ccccc3	BroadT	BRD-K01960204	BRD-K01960204-001-01-1	Broad Institute of MIT and Harvard	BRD-K01960204			OC[C@@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@@H]1NC(=O)c1ccccc1	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17-,18-/m0/s1	JMJYAJMXQVZTFW-BZSNNMDCSA-N	382.164105224							122392
BRD-K24343201	LSM-33836		54639830	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15-/m1/s1	XCSADXMQLTVTGS-RBSFLKMASA-N	CCCNC(=O)N[C@@H]1CC[C@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	BroadT	BRD-K24343201	BRD-K24343201-001-01-6	Broad Institute of MIT and Harvard	BRD-K24343201			CCCNC(=O)N[C@@H]1CC[C@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15-/m1/s1	XCSADXMQLTVTGS-RBSFLKMASA-N	356.242355544							122393
BRD-K67408816	LSM-33837		54640010	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18+,19+/m1/s1	CAYTZIHCJIWWNW-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K67408816	BRD-K67408816-001-01-2	Broad Institute of MIT and Harvard	BRD-K67408816			OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18+,19+/m1/s1	CAYTZIHCJIWWNW-QYZOEREBSA-N	420.237270164							122394
BRD-K47794327	LSM-33838		54639869	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18-,19+/m1/s1	CSAZNKSAKUIKBW-QRQLOZEOSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K47794327	BRD-K47794327-001-01-2	Broad Institute of MIT and Harvard	BRD-K47794327			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18-,19+/m1/s1	CSAZNKSAKUIKBW-QRQLOZEOSA-N	419.15149162							122395
BRD-K81932943	LSM-33839		54639874	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18+/m0/s1	BFDDYBZFCVNWOI-YXJHDRRASA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)C=C[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K81932943	BRD-K81932943-001-01-9	Broad Institute of MIT and Harvard	BRD-K81932943			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)C=C[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18+/m0/s1	BFDDYBZFCVNWOI-YXJHDRRASA-N	400.154683392							122396
BRD-K43387144	LSM-33840		54639852	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19-,20+/m1/s1	UXWKWPDPCRHNPI-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C3CCCCC3	BroadT	BRD-K43387144	BRD-K43387144-001-01-0	Broad Institute of MIT and Harvard	BRD-K43387144			OC[C@@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C1CCCCC1	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19-,20+/m1/s1	UXWKWPDPCRHNPI-AQNXPRMDSA-N	406.226785692							122397
BRD-K27723822	LSM-33841		54639953	InChI=1S/C17H25N3O5S/c21-10-14-13(19-16(23)11-3-6-24-7-4-11)2-1-12(25-14)9-15(22)20-17-18-5-8-26-17/h5,8,11-14,21H,1-4,6-7,9-10H2,(H,19,23)(H,18,20,22)/t12-,13-,14+/m1/s1	BGYIYMFDHNUKRK-MCIONIFRSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K27723822	BRD-K27723822-001-01-5	Broad Institute of MIT and Harvard	BRD-K27723822			OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C17H25N3O5S/c21-10-14-13(19-16(23)11-3-6-24-7-4-11)2-1-12(25-14)9-15(22)20-17-18-5-8-26-17/h5,8,11-14,21H,1-4,6-7,9-10H2,(H,19,23)(H,18,20,22)/t12-,13-,14+/m1/s1	BGYIYMFDHNUKRK-MCIONIFRSA-N	383.15149162							122398
BRD-K70262646	LSM-33842		54640104	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19-,22-/m1/s1	BXPDQGCNKCQIEP-WOIUINJBSA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)cc1	BroadT	BRD-K70262646	BRD-K70262646-001-01-4	Broad Institute of MIT and Harvard	BRD-K70262646			COc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)cc1	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19-,22-/m1/s1	BXPDQGCNKCQIEP-WOIUINJBSA-N	471.200550298							122399
BRD-K92433763	LSM-33843		54640008	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13+,14-/m0/s1	KZMUEAIOUSMXHL-YUTCNCBUSA-N	NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@H](CO)O1	BroadT	BRD-K92433763	BRD-K92433763-001-01-2	Broad Institute of MIT and Harvard	BRD-K92433763			NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@H](CO)O1	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13+,14-/m0/s1	KZMUEAIOUSMXHL-YUTCNCBUSA-N	348.091055572							122400
BRD-K22137463	LSM-33844		54639928	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18-,19-/m1/s1	MGFIPLUDFSCRIT-BHIYHBOVSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K22137463	BRD-K22137463-001-01-7	Broad Institute of MIT and Harvard	BRD-K22137463			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18-,19-/m1/s1	MGFIPLUDFSCRIT-BHIYHBOVSA-N	470.107848488							122401
BRD-K47087435	LSM-33845		54639902	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22-/m1/s1	WADXMENNSPGANR-DCZASFAJSA-N	COc1ccccc1NC(=O)N[C@H]2C=C[C@@H](CC(=O)N[C@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K47087435	BRD-K47087435-001-01-0	Broad Institute of MIT and Harvard	BRD-K47087435			COc1ccccc1NC(=O)N[C@H]1C=C[C@@H](CC(=O)N[C@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20+,22-/m1/s1	WADXMENNSPGANR-DCZASFAJSA-N	439.210721058							122402
BRD-K07351191	LSM-33846		54639862	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17-,18-/m0/s1	INOAIBAAQYWPCB-BZSNNMDCSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NC(=O)C4CCOCC4	BroadT	BRD-K07351191	BRD-K07351191-001-01-2	Broad Institute of MIT and Harvard	BRD-K07351191			OC[C@@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17-,18-/m0/s1	INOAIBAAQYWPCB-BZSNNMDCSA-N	422.252920228							122403
BRD-K65875972	LSM-33847		54639994	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17+,18+/m1/s1	AFXALTHXBUYGQN-SQNIBIBYSA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)CN(C)C)[C@H](CO)O2)cc1	BroadT	BRD-K65875972	BRD-K65875972-001-01-4	Broad Institute of MIT and Harvard	BRD-K65875972			COc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)CN(C)C)[C@H](CO)O2)cc1	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17+,18+/m1/s1	AFXALTHXBUYGQN-SQNIBIBYSA-N	393.226371122							122404
BRD-K02395808	LSM-33848		54639840	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17-,19-/m0/s1	VLQCPCSLOMVUJP-LNLFQRSKSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K02395808	BRD-K02395808-001-01-9	Broad Institute of MIT and Harvard	BRD-K02395808			OC[C@@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17-,19-/m0/s1	VLQCPCSLOMVUJP-LNLFQRSKSA-N	389.231456502							122405
BRD-K45717258	LSM-33849		54639822	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17-,20-/m1/s1	NAHOTKSUDDAWEB-MBOZVWFJSA-N	OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K45717258	BRD-K45717258-001-01-8	Broad Institute of MIT and Harvard	BRD-K45717258			OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17-,20-/m1/s1	NAHOTKSUDDAWEB-MBOZVWFJSA-N	449.216200362							122406
BRD-K91397206	LSM-33850		54639892	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15-,17-/m0/s1	CJRAIIYLTSRGNA-ZOBUZTSGSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K91397206	BRD-K91397206-001-01-5	Broad Institute of MIT and Harvard	BRD-K91397206			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c1ccccn1	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15-,17-/m0/s1	CJRAIIYLTSRGNA-ZOBUZTSGSA-N	359.18450631							122407
BRD-K00920341	LSM-33851		54640077	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19-,20+/m1/s1	PELUPFPZEXCELD-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K00920341	BRD-K00920341-001-01-0	Broad Institute of MIT and Harvard	BRD-K00920341			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19-,20+/m1/s1	PELUPFPZEXCELD-AQNXPRMDSA-N	413.175084478							122408
BRD-K63632606-001-01-5	LSM-33852	BRD-K63632606	54639818	InChI=1S/C20H26N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-7,16-18,23H,8-14H2,(H,21,24)/t16-,17+,18-/m1/s1	IQQRIWPPTLHHIL-FGTMMUONSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)Cc3ccccc3	BroadT	BRD-K63632606	BRD-K63632606-001-01-5	Broad Institute of MIT and Harvard	BRD-K63632606			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C=C[C@@H]1NC(=O)Cc1ccccc1	InChI=1S/C20H26N2O5/c23-14-18-17(21-19(24)12-15-4-2-1-3-5-15)7-6-16(27-18)13-20(25)22-8-10-26-11-9-22/h1-7,16-18,23H,8-14H2,(H,21,24)/t16-,17+,18-/m1/s1	IQQRIWPPTLHHIL-FGTMMUONSA-N	374.184171952							122409
BRD-K25447152	LSM-33853		54639991	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16-,17+/m1/s1	HAYHGVRNUREYAI-ZACQAIPSSA-N	CN(C)CC(=O)N[C@@H]1C=C[C@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	BroadT	BRD-K25447152	BRD-K25447152-001-01-3	Broad Institute of MIT and Harvard	BRD-K25447152			CN(C)CC(=O)N[C@@H]1C=C[C@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16-,17+/m1/s1	HAYHGVRNUREYAI-ZACQAIPSSA-N	382.258005608							122410
BRD-K21568472	LSM-33854		54640047	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18-,21+/m1/s1	NHCHTYGGSDNPNS-BLIXFSHQSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c4cccc(F)c4	BroadT	BRD-K21568472	BRD-K21568472-001-01-3	Broad Institute of MIT and Harvard	BRD-K21568472			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18-,21+/m1/s1	NHCHTYGGSDNPNS-BLIXFSHQSA-N	480.13665005							122411
BRD-K93032100	LSM-33855		54639848	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17-,18+/m1/s1	ZNNAKNJWDLOPKK-KURKYZTESA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C=C[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K93032100	BRD-K93032100-001-01-3	Broad Institute of MIT and Harvard	BRD-K93032100			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C=C[C@H]1NC(=O)C1CCOCC1	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17-,18+/m1/s1	ZNNAKNJWDLOPKK-KURKYZTESA-N	389.195070994							122412
BRD-K25718630	LSM-33856		54639962	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15+,16-/m0/s1	KRKFLLVHIFIBNR-XHSDSOJGSA-N	CCCNC(=O)N[C@@H]1C=C[C@@H](CC(=O)NC2CCCCC2)O[C@H]1CO	BroadT	BRD-K25718630	BRD-K25718630-001-01-9	Broad Institute of MIT and Harvard	BRD-K25718630			CCCNC(=O)N[C@@H]1C=C[C@@H](CC(=O)NC2CCCCC2)O[C@H]1CO	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15+,16-/m0/s1	KRKFLLVHIFIBNR-XHSDSOJGSA-N	353.231456502							122413
BRD-K34028745	LSM-33857		54640100	InChI=1S/C19H28N2O6/c1-25-12-19(24)21-15-8-7-14(27-17(15)11-22)9-18(23)20-10-13-5-3-4-6-16(13)26-2/h3-6,14-15,17,22H,7-12H2,1-2H3,(H,20,23)(H,21,24)/t14-,15+,17-/m1/s1	PZSXLCWRMIJETI-HLLBOEOZSA-N	COCC(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccccc2OC)O[C@@H]1CO	BroadT	BRD-K34028745	BRD-K34028745-001-01-4	Broad Institute of MIT and Harvard	BRD-K34028745			COCC(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccccc2OC)O[C@@H]1CO	InChI=1S/C19H28N2O6/c1-25-12-19(24)21-15-8-7-14(27-17(15)11-22)9-18(23)20-10-13-5-3-4-6-16(13)26-2/h3-6,14-15,17,22H,7-12H2,1-2H3,(H,20,23)(H,21,24)/t14-,15+,17-/m1/s1	PZSXLCWRMIJETI-HLLBOEOZSA-N	380.194736636							122414
BRD-K34595193	LSM-33858		54639828	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15+/m0/s1	XCSADXMQLTVTGS-RRFJBIMHSA-N	CCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	BroadT	BRD-K34595193	BRD-K34595193-001-01-9	Broad Institute of MIT and Harvard	BRD-K34595193			CCCNC(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15+/m0/s1	XCSADXMQLTVTGS-RRFJBIMHSA-N	356.242355544							122415
BRD-K76318449	LSM-33859		54639933	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19+,22+/m1/s1	PWRMKQUARCEQEU-DXIQSLLYSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K76318449	BRD-K76318449-001-01-7	Broad Institute of MIT and Harvard	BRD-K76318449			OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19+,22+/m1/s1	PWRMKQUARCEQEU-DXIQSLLYSA-N	476.161721946							122416
BRD-K69453266	LSM-33860		54640069	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15+/m1/s1	AVCGIXMUPLIHTE-KFWWJZLASA-N	CCCNC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	BroadT	BRD-K69453266	BRD-K69453266-001-01-1	Broad Institute of MIT and Harvard	BRD-K69453266			CCCNC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15+/m1/s1	AVCGIXMUPLIHTE-KFWWJZLASA-N	354.22670548							122417
BRD-K50300854	LSM-33861		54640000	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17+,18-/m1/s1	AFXALTHXBUYGQN-FGTMMUONSA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)CN(C)C)[C@@H](CO)O2)cc1	BroadT	BRD-K50300854	BRD-K50300854-001-01-3	Broad Institute of MIT and Harvard	BRD-K50300854			COc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)CN(C)C)[C@@H](CO)O2)cc1	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17+,18-/m1/s1	AFXALTHXBUYGQN-FGTMMUONSA-N	393.226371122							122418
BRD-K36074653	LSM-33862		54639864	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17+,18-/m1/s1	INOAIBAAQYWPCB-FGTMMUONSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NC(=O)C4CCOCC4	BroadT	BRD-K36074653	BRD-K36074653-001-01-6	Broad Institute of MIT and Harvard	BRD-K36074653			OC[C@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17+,18-/m1/s1	INOAIBAAQYWPCB-FGTMMUONSA-N	422.252920228							122419
BRD-K14037093	LSM-33863		54639906	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22+/m0/s1	WADXMENNSPGANR-PBNJOUANSA-N	COc1ccccc1NC(=O)N[C@H]2C=C[C@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K14037093	BRD-K14037093-001-01-7	Broad Institute of MIT and Harvard	BRD-K14037093			COc1ccccc1NC(=O)N[C@H]1C=C[C@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22+/m0/s1	WADXMENNSPGANR-PBNJOUANSA-N	439.210721058							122420
BRD-K92011556	LSM-33864		54639803	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17+,18-/m1/s1	ZAWCCEHPCRSVNF-FGTMMUONSA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K92011556	BRD-K92011556-001-01-7	Broad Institute of MIT and Harvard	BRD-K92011556			OC[C@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@@H]1NC(=O)c1ccncc1	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17+,18-/m1/s1	ZAWCCEHPCRSVNF-FGTMMUONSA-N	391.210721058							122421
BRD-K40565784	LSM-33865		54639866	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18+,19+/m0/s1	CSAZNKSAKUIKBW-QXAKKESOSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K40565784	BRD-K40565784-001-01-9	Broad Institute of MIT and Harvard	BRD-K40565784			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18+,19+/m0/s1	CSAZNKSAKUIKBW-QXAKKESOSA-N	419.15149162							122422
BRD-K10987837	LSM-33866		54639973	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19-,20-/m1/s1	KHPOILJWMXIQKX-VAMGGRTRSA-N	COc1ccc(NC(=O)N[C@@H]2C=C[C@H](CC(=O)NC3CCCCC3)O[C@@H]2CO)cc1	BroadT	BRD-K10987837	BRD-K10987837-001-01-8	Broad Institute of MIT and Harvard	BRD-K10987837			COc1ccc(NC(=O)N[C@@H]2C=C[C@H](CC(=O)NC3CCCCC3)O[C@@H]2CO)cc1	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19-,20-/m1/s1	KHPOILJWMXIQKX-VAMGGRTRSA-N	417.226371122							122423
BRD-K50859531	LSM-33867		54639995	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17+,18+/m0/s1	AFXALTHXBUYGQN-RCCFBDPRSA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)CN(C)C)[C@@H](CO)O2)cc1	BroadT	BRD-K50859531	BRD-K50859531-001-01-9	Broad Institute of MIT and Harvard	BRD-K50859531			COc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)CN(C)C)[C@@H](CO)O2)cc1	InChI=1S/C20H31N3O5/c1-23(2)12-20(26)22-17-9-8-16(28-18(17)13-24)10-19(25)21-11-14-4-6-15(27-3)7-5-14/h4-7,16-18,24H,8-13H2,1-3H3,(H,21,25)(H,22,26)/t16-,17+,18+/m0/s1	AFXALTHXBUYGQN-RCCFBDPRSA-N	393.226371122							122424
BRD-K14041149	LSM-33868		54640076	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19-,20+/m0/s1	PELUPFPZEXCELD-SLFFLAALSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K14041149	BRD-K14041149-001-01-3	Broad Institute of MIT and Harvard	BRD-K14041149			OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19-,20+/m0/s1	PELUPFPZEXCELD-SLFFLAALSA-N	413.175084478							122425
BRD-K01639528	LSM-33869		54639844	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17+,18+/m1/s1	ZNNAKNJWDLOPKK-SQNIBIBYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C=C[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K01639528	BRD-K01639528-001-01-0	Broad Institute of MIT and Harvard	BRD-K01639528			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17+,18+/m1/s1	ZNNAKNJWDLOPKK-SQNIBIBYSA-N	389.195070994							122426
BRD-K27973265	LSM-33870		54640006	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13-,14-/m0/s1	KZMUEAIOUSMXHL-UBHSHLNASA-N	NCC[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@H](CO)O1	BroadT	BRD-K27973265	BRD-K27973265-001-01-0	Broad Institute of MIT and Harvard	BRD-K27973265			NCC[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@H](CO)O1	InChI=1S/C14H21ClN2O4S/c15-10-1-4-12(5-2-10)22(19,20)17-13-6-3-11(7-8-16)21-14(13)9-18/h1-2,4-5,11,13-14,17-18H,3,6-9,16H2/t11-,13-,14-/m0/s1	KZMUEAIOUSMXHL-UBHSHLNASA-N	348.091055572							122427
BRD-K12181036	LSM-33871		54640078	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19+,20-/m0/s1	PELUPFPZEXCELD-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K12181036	BRD-K12181036-001-01-5	Broad Institute of MIT and Harvard	BRD-K12181036			OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19+,20-/m0/s1	PELUPFPZEXCELD-ZCNNSNEGSA-N	413.175084478							122428
BRD-K74817844	LSM-33872		54640061	InChI=1S/C20H30FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-7,14,17-18,25H,5,8-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17-,18+/m1/s1	RNBICINZPSPKFD-OLMNPRSZSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@H](CO)O1	BroadT	BRD-K74817844	BRD-K74817844-001-01-1	Broad Institute of MIT and Harvard	BRD-K74817844			CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NC(=O)c2ccccc2F)[C@H](CO)O1	InChI=1S/C20H30FN3O4/c1-24(2)11-5-10-22-19(26)12-14-8-9-17(18(13-25)28-14)23-20(27)15-6-3-4-7-16(15)21/h3-4,6-7,14,17-18,25H,5,8-13H2,1-2H3,(H,22,26)(H,23,27)/t14-,17-,18+/m1/s1	RNBICINZPSPKFD-OLMNPRSZSA-N	395.22203467							122429
BRD-K42987166	LSM-33873		54639841	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17-,19+/m0/s1	VLQCPCSLOMVUJP-JENIJYKNSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K42987166	BRD-K42987166-001-01-1	Broad Institute of MIT and Harvard	BRD-K42987166			OC[C@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17-,19+/m0/s1	VLQCPCSLOMVUJP-JENIJYKNSA-N	389.231456502							122430
BRD-K74486924	LSM-33874		54640020	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17-,19-/m0/s1	FRHMAPNXHVZDAK-IEZWGBDMSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccccc2)C=C[C@@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K74486924	BRD-K74486924-001-01-8	Broad Institute of MIT and Harvard	BRD-K74486924			OC[C@@H]1O[C@H](CC(=O)Nc2ccccc2)C=C[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17-,19-/m0/s1	FRHMAPNXHVZDAK-IEZWGBDMSA-N	417.150012582							122431
BRD-K11700411	LSM-33875		54639845	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17-,18-/m1/s1	ZNNAKNJWDLOPKK-KZNAEPCWSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C=C[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K11700411	BRD-K11700411-001-01-8	Broad Institute of MIT and Harvard	BRD-K11700411			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C=C[C@H]1NC(=O)C1CCOCC1	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17-,18-/m1/s1	ZNNAKNJWDLOPKK-KZNAEPCWSA-N	389.195070994							122432
BRD-K05228434	LSM-33876		54640043	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18+,21+/m1/s1	NHCHTYGGSDNPNS-MMOPVJDHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c4cccc(F)c4	BroadT	BRD-K05228434	BRD-K05228434-001-01-1	Broad Institute of MIT and Harvard	BRD-K05228434			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NS(=O)(=O)c1cccc(F)c1	InChI=1S/C22H25FN2O7S/c23-15-2-1-3-17(9-15)33(28,29)25-18-6-5-16(32-21(18)12-26)10-22(27)24-11-14-4-7-19-20(8-14)31-13-30-19/h1-4,7-9,16,18,21,25-26H,5-6,10-13H2,(H,24,27)/t16-,18+,21+/m1/s1	NHCHTYGGSDNPNS-MMOPVJDHSA-N	480.13665005							122433
BRD-K20271299	LSM-33877		54639955	InChI=1S/C17H25N3O5S/c21-10-14-13(19-16(23)11-3-6-24-7-4-11)2-1-12(25-14)9-15(22)20-17-18-5-8-26-17/h5,8,11-14,21H,1-4,6-7,9-10H2,(H,19,23)(H,18,20,22)/t12-,13+,14-/m0/s1	BGYIYMFDHNUKRK-MJBXVCDLSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K20271299	BRD-K20271299-001-01-6	Broad Institute of MIT and Harvard	BRD-K20271299			OC[C@@H]1O[C@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C17H25N3O5S/c21-10-14-13(19-16(23)11-3-6-24-7-4-11)2-1-12(25-14)9-15(22)20-17-18-5-8-26-17/h5,8,11-14,21H,1-4,6-7,9-10H2,(H,19,23)(H,18,20,22)/t12-,13+,14-/m0/s1	BGYIYMFDHNUKRK-MJBXVCDLSA-N	383.15149162							122434
BRD-K69775722	LSM-33878		54640073	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19+,20+/m1/s1	PELUPFPZEXCELD-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K69775722	BRD-K69775722-001-01-5	Broad Institute of MIT and Harvard	BRD-K69775722			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19+,20+/m1/s1	PELUPFPZEXCELD-AABGKKOBSA-N	413.175084478							122435
BRD-K38946705	LSM-33879		54639931	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18+,19-/m0/s1	MGFIPLUDFSCRIT-UHOSZYNNSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K38946705	BRD-K38946705-001-01-1	Broad Institute of MIT and Harvard	BRD-K38946705			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C21H24ClFN2O5S/c22-17-3-1-2-4-20(17)31(28,29)24-12-11-16-9-10-18(19(13-26)30-16)25-21(27)14-5-7-15(23)8-6-14/h1-8,16,18-19,24,26H,9-13H2,(H,25,27)/t16-,18+,19-/m0/s1	MGFIPLUDFSCRIT-UHOSZYNNSA-N	470.107848488							122436
BRD-K53720386	LSM-33880		54639860	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17-,18-/m1/s1	INOAIBAAQYWPCB-KZNAEPCWSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NC(=O)C4CCOCC4	BroadT	BRD-K53720386	BRD-K53720386-001-01-6	Broad Institute of MIT and Harvard	BRD-K53720386			OC[C@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17-,18-/m1/s1	INOAIBAAQYWPCB-KZNAEPCWSA-N	422.252920228							122437
BRD-K89832379	LSM-33881		54640037	InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18+,19+/m1/s1	TUNGNDZZYYVKEI-NEWSRXKRSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K89832379	BRD-K89832379-001-01-6	Broad Institute of MIT and Harvard	BRD-K89832379			OC[C@@H]1O[C@@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18+,19+/m1/s1	TUNGNDZZYYVKEI-NEWSRXKRSA-N	467.128169362							122438
BRD-K04628654	LSM-33882		54640064	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15+/m0/s1	AVCGIXMUPLIHTE-RRFJBIMHSA-N	CCCNC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	BroadT	BRD-K04628654	BRD-K04628654-001-01-6	Broad Institute of MIT and Harvard	BRD-K04628654			CCCNC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15+/m0/s1	AVCGIXMUPLIHTE-RRFJBIMHSA-N	354.22670548							122439
BRD-K30964167	LSM-33883		54639908	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22+/m1/s1	WADXMENNSPGANR-BUBGKSFDSA-N	COc1ccccc1NC(=O)N[C@@H]2C=C[C@@H](CC(=O)N[C@H](C)c3ccccc3)O[C@H]2CO	BroadT	BRD-K30964167	BRD-K30964167-001-01-3	Broad Institute of MIT and Harvard	BRD-K30964167			COc1ccccc1NC(=O)N[C@@H]1C=C[C@@H](CC(=O)N[C@H](C)c2ccccc2)O[C@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18+,20-,22+/m1/s1	WADXMENNSPGANR-BUBGKSFDSA-N	439.210721058							122440
BRD-K17659275	LSM-33884		54639799	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17-,18-/m1/s1	ZAWCCEHPCRSVNF-KZNAEPCWSA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K17659275	BRD-K17659275-001-01-5	Broad Institute of MIT and Harvard	BRD-K17659275			OC[C@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17-,18-/m1/s1	ZAWCCEHPCRSVNF-KZNAEPCWSA-N	391.210721058							122441
MLS003650097	LSM-33885	BRD-K22748970	53382747	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17+,18+/m0/s1	ZAWCCEHPCRSVNF-RCCFBDPRSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K22748970	BRD-K22748970-001-01-7	Broad Institute of MIT and Harvard	BRD-K22748970			OC[C@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17+,18+/m0/s1	ZAWCCEHPCRSVNF-RCCFBDPRSA-N	391.210721058							122442
BRD-K23666684	LSM-33886		54640080	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18+,19+/m0/s1	DRBUEWBLJCFPHK-WQANXHIZSA-N	C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)C2CCC2)C=C1)c3ccccc3	BroadT	BRD-K23666684	BRD-K23666684-001-01-7	Broad Institute of MIT and Harvard	BRD-K23666684			C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@H](NC(=O)C2CCC2)C=C1)c1ccccc1	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18+,19+/m0/s1	DRBUEWBLJCFPHK-WQANXHIZSA-N	372.204907396							122443
BRD-K45631723	LSM-33887		54640022	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17-,19+/m1/s1	FRHMAPNXHVZDAK-SUMDDJOVSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccccc2)C=C[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K45631723	BRD-K45631723-001-01-8	Broad Institute of MIT and Harvard	BRD-K45631723			OC[C@@H]1O[C@@H](CC(=O)Nc2ccccc2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17-,19+/m1/s1	FRHMAPNXHVZDAK-SUMDDJOVSA-N	417.150012582							122444
BRD-K14364923	LSM-33888		54639919	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17-,18-/m1/s1	NIFMHKNMYGHVIX-KZNAEPCWSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K14364923	BRD-K14364923-001-01-1	Broad Institute of MIT and Harvard	BRD-K14364923			OC[C@H]1O[C@@H](CC(=O)NC2CCCCC2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C20H35N3O5/c24-14-18-17(22-20(26)13-23-8-10-27-11-9-23)7-6-16(28-18)12-19(25)21-15-4-2-1-3-5-15/h15-18,24H,1-14H2,(H,21,25)(H,22,26)/t16-,17-,18-/m1/s1	NIFMHKNMYGHVIX-KZNAEPCWSA-N	397.25767125							122445
BRD-K00260816	LSM-33889		54639965	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17-,18-/m1/s1	JMJYAJMXQVZTFW-KZNAEPCWSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@H]1NC(=O)c3ccccc3	BroadT	BRD-K00260816	BRD-K00260816-001-01-7	Broad Institute of MIT and Harvard	BRD-K00260816			OC[C@H]1O[C@@H](CC(=O)NCc2ccncn2)C=C[C@H]1NC(=O)c1ccccc1	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17-,18-/m1/s1	JMJYAJMXQVZTFW-KZNAEPCWSA-N	382.164105224							122446
BRD-K04546974	LSM-33890		54639878	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18+/m0/s1	BFDDYBZFCVNWOI-QILLFSRXSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)C=C[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K04546974	BRD-K04546974-001-01-3	Broad Institute of MIT and Harvard	BRD-K04546974			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)C=C[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18+/m0/s1	BFDDYBZFCVNWOI-QILLFSRXSA-N	400.154683392							122447
BRD-K75534737	LSM-33891		54640085	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19-/m0/s1	DRBUEWBLJCFPHK-QZHFEQFPSA-N	C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)C2CCC2)C=C1)c3ccccc3	BroadT	BRD-K75534737	BRD-K75534737-001-01-1	Broad Institute of MIT and Harvard	BRD-K75534737			C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)C2CCC2)C=C1)c1ccccc1	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17-,18-,19-/m0/s1	DRBUEWBLJCFPHK-QZHFEQFPSA-N	372.204907396							122448
BRD-K97359891	LSM-33892		54639806	InChI=1S/C15H19N3O4S/c19-8-12-11(17-14(21)9-1-2-9)4-3-10(22-12)7-13(20)18-15-16-5-6-23-15/h3-6,9-12,19H,1-2,7-8H2,(H,17,21)(H,16,18,20)/t10-,11+,12+/m1/s1	RVRNWRREFDZYAW-WOPDTQHZSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)C3CC3	BroadT	BRD-K97359891	BRD-K97359891-001-01-9	Broad Institute of MIT and Harvard	BRD-K97359891			OC[C@@H]1O[C@@H](CC(=O)Nc2nccs2)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C15H19N3O4S/c19-8-12-11(17-14(21)9-1-2-9)4-3-10(22-12)7-13(20)18-15-16-5-6-23-15/h3-6,9-12,19H,1-2,7-8H2,(H,17,21)(H,16,18,20)/t10-,11+,12+/m1/s1	RVRNWRREFDZYAW-WOPDTQHZSA-N	337.109626808							122449
BRD-K49864183	LSM-33893		54639824	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17-,20-/m0/s1	NAHOTKSUDDAWEB-ZWOKBUDYSA-N	OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K49864183	BRD-K49864183-001-01-4	Broad Institute of MIT and Harvard	BRD-K49864183			OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17-,20-/m0/s1	NAHOTKSUDDAWEB-ZWOKBUDYSA-N	449.216200362							122450
BRD-K95810752	LSM-33894		54640039	InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18-,19-/m0/s1	TUNGNDZZYYVKEI-WDSOQIARSA-N	OC[C@@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NS(=O)(=O)c3ccccc3Cl	BroadT	BRD-K95810752	BRD-K95810752-001-01-1	Broad Institute of MIT and Harvard	BRD-K95810752			OC[C@@H]1O[C@H](CCNC(=O)Cc2ccncc2)CC[C@@H]1NS(=O)(=O)c1ccccc1Cl	InChI=1S/C21H26ClN3O5S/c22-17-3-1-2-4-20(17)31(28,29)25-18-6-5-16(30-19(18)14-26)9-12-24-21(27)13-15-7-10-23-11-8-15/h1-4,7-8,10-11,16,18-19,25-26H,5-6,9,12-14H2,(H,24,27)/t16-,18-,19-/m0/s1	TUNGNDZZYYVKEI-WDSOQIARSA-N	467.128169362							122451
BRD-K78071721-001-01-9	LSM-33895	BRD-K78071721	54639796	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14+,15-/m1/s1	XITZEOXYAYTYOD-VHDGCEQUSA-N	CN(C)C(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2)[C@@H](CO)O1	BroadT	BRD-K78071721	BRD-K78071721-001-01-9	Broad Institute of MIT and Harvard	BRD-K78071721			CN(C)C(=O)C[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2)[C@@H](CO)O1	InChI=1S/C16H24N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-7,12,14-15,17,19H,8-11H2,1-2H3/t12-,14+,15-/m1/s1	XITZEOXYAYTYOD-VHDGCEQUSA-N	356.140592578							122452
BRD-K65887908	LSM-33896		54639982	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17-,19+/m1/s1	ULTMRAJJWBMPBO-SUMDDJOVSA-N	OC[C@@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K65887908	BRD-K65887908-001-01-8	Broad Institute of MIT and Harvard	BRD-K65887908			OC[C@@H]1O[C@@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17-,19+/m1/s1	ULTMRAJJWBMPBO-SUMDDJOVSA-N	456.2184265							122453
BRD-K59182232	LSM-33897		54639801	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17-,18+/m1/s1	ZAWCCEHPCRSVNF-KURKYZTESA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K59182232	BRD-K59182232-001-01-9	Broad Institute of MIT and Harvard	BRD-K59182232			OC[C@@H]1O[C@@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17-,18+/m1/s1	ZAWCCEHPCRSVNF-KURKYZTESA-N	391.210721058							122454
BRD-K40117723	LSM-33898		54640086	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19+/m1/s1	DRBUEWBLJCFPHK-FCLVOEFKSA-N	C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)C2CCC2)C=C1)c3ccccc3	BroadT	BRD-K40117723	BRD-K40117723-001-01-3	Broad Institute of MIT and Harvard	BRD-K40117723			C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)C2CCC2)C=C1)c1ccccc1	InChI=1S/C21H28N2O4/c1-14(15-6-3-2-4-7-15)22-20(25)12-17-10-11-18(19(13-24)27-17)23-21(26)16-8-5-9-16/h2-4,6-7,10-11,14,16-19,24H,5,8-9,12-13H2,1H3,(H,22,25)(H,23,26)/t14-,17+,18+,19+/m1/s1	DRBUEWBLJCFPHK-FCLVOEFKSA-N	372.204907396							122455
BRD-K01759041	LSM-33899		54639970	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17+,18-/m0/s1	JMJYAJMXQVZTFW-KSZLIROESA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@H]1NC(=O)c3ccccc3	BroadT	BRD-K01759041	BRD-K01759041-001-01-4	Broad Institute of MIT and Harvard	BRD-K01759041			OC[C@@H]1O[C@H](CC(=O)NCc2ccncn2)C=C[C@H]1NC(=O)c1ccccc1	InChI=1S/C20H22N4O4/c25-12-18-17(24-20(27)14-4-2-1-3-5-14)7-6-16(28-18)10-19(26)22-11-15-8-9-21-13-23-15/h1-9,13,16-18,25H,10-12H2,(H,22,26)(H,24,27)/t16-,17+,18-/m0/s1	JMJYAJMXQVZTFW-KSZLIROESA-N	382.164105224							122456
BRD-K99859971	LSM-33900		54639990	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16-,17+/m0/s1	HAYHGVRNUREYAI-YESZJQIVSA-N	CN(C)CC(=O)N[C@H]1C=C[C@@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	BroadT	BRD-K99859971	BRD-K99859971-001-01-9	Broad Institute of MIT and Harvard	BRD-K99859971			CN(C)CC(=O)N[C@H]1C=C[C@@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16-,17+/m0/s1	HAYHGVRNUREYAI-YESZJQIVSA-N	382.258005608							122457
BRD-K93488589	LSM-33901		54639893	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15-,17+/m0/s1	CJRAIIYLTSRGNA-YQQAZPJKSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K93488589	BRD-K93488589-001-01-7	Broad Institute of MIT and Harvard	BRD-K93488589			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c1ccccn1	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15-,17+/m0/s1	CJRAIIYLTSRGNA-YQQAZPJKSA-N	359.18450631							122458
MLS003650009	LSM-33902	BRD-K26738018	53382671	InChI=1S/C19H28N2O6/c1-25-12-19(24)21-15-8-7-14(27-17(15)11-22)9-18(23)20-10-13-5-3-4-6-16(13)26-2/h3-6,14-15,17,22H,7-12H2,1-2H3,(H,20,23)(H,21,24)/t14-,15-,17+/m0/s1	PZSXLCWRMIJETI-YQQAZPJKSA-N	COCC(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccccc2OC)O[C@@H]1CO	BroadT	BRD-K26738018	BRD-K26738018-001-01-8	Broad Institute of MIT and Harvard	BRD-K26738018			COCC(=O)N[C@H]1CC[C@@H](CC(=O)NCc2ccccc2OC)O[C@@H]1CO	InChI=1S/C19H28N2O6/c1-25-12-19(24)21-15-8-7-14(27-17(15)11-22)9-18(23)20-10-13-5-3-4-6-16(13)26-2/h3-6,14-15,17,22H,7-12H2,1-2H3,(H,20,23)(H,21,24)/t14-,15-,17+/m0/s1	PZSXLCWRMIJETI-YQQAZPJKSA-N	380.194736636							122459
MLS003649987	LSM-33903	SID125305294, BRD-K16255400	53382650	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15+,16-/m1/s1	KRKFLLVHIFIBNR-OWCLPIDISA-N	CCCNC(=O)N[C@H]1C=C[C@H](CC(=O)NC2CCCCC2)O[C@@H]1CO	BroadT	BRD-K16255400	BRD-K16255400-001-01-1	Broad Institute of MIT and Harvard	BRD-K16255400			CCCNC(=O)N[C@H]1C=C[C@H](CC(=O)NC2CCCCC2)O[C@@H]1CO	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15+,16-/m1/s1	KRKFLLVHIFIBNR-OWCLPIDISA-N	353.231456502							122460
BRD-K94540403	LSM-33904		54640057	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18-/m0/s1	IHGRXRHOBYYXJU-KSZLIROESA-N	CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2cccnc2)[C@H](CO)O1	BroadT	BRD-K94540403	BRD-K94540403-001-01-8	Broad Institute of MIT and Harvard	BRD-K94540403			CN(C)CCCNC(=O)C[C@@H]1CC[C@@H](NC(=O)Cc2cccnc2)[C@H](CO)O1	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18-/m0/s1	IHGRXRHOBYYXJU-KSZLIROESA-N	392.242355544							122461
BRD-K23361743	LSM-33905		54639837	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17+,19+/m1/s1	VLQCPCSLOMVUJP-AOIWGVFYSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K23361743	BRD-K23361743-001-01-4	Broad Institute of MIT and Harvard	BRD-K23361743			OC[C@@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17+,19+/m1/s1	VLQCPCSLOMVUJP-AOIWGVFYSA-N	389.231456502							122462
BRD-K59087082	LSM-33906		54639891	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15+,17+/m1/s1	CJRAIIYLTSRGNA-VYDXJSESSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K59087082	BRD-K59087082-001-01-1	Broad Institute of MIT and Harvard	BRD-K59087082			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C=C[C@@H]1NC(=O)c1ccccn1	InChI=1S/C19H25N3O4/c23-13-17-15(21-19(25)16-6-2-3-9-20-16)8-7-14(26-17)12-18(24)22-10-4-1-5-11-22/h2-3,6-9,14-15,17,23H,1,4-5,10-13H2,(H,21,25)/t14-,15+,17+/m1/s1	CJRAIIYLTSRGNA-VYDXJSESSA-N	359.18450631							122463
BRD-K75136523	LSM-33907		54639957	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15-,16-/m1/s1	KRKFLLVHIFIBNR-BZUAXINKSA-N	CCCNC(=O)N[C@@H]1C=C[C@H](CC(=O)NC2CCCCC2)O[C@@H]1CO	BroadT	BRD-K75136523	BRD-K75136523-001-01-3	Broad Institute of MIT and Harvard	BRD-K75136523			CCCNC(=O)N[C@@H]1C=C[C@H](CC(=O)NC2CCCCC2)O[C@@H]1CO	InChI=1S/C18H31N3O4/c1-2-10-19-18(24)21-15-9-8-14(25-16(15)12-22)11-17(23)20-13-6-4-3-5-7-13/h8-9,13-16,22H,2-7,10-12H2,1H3,(H,20,23)(H2,19,21,24)/t14-,15-,16-/m1/s1	KRKFLLVHIFIBNR-BZUAXINKSA-N	353.231456502							122464
BRD-K73200916	LSM-33908		54640107	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19+,22-/m1/s1	BXPDQGCNKCQIEP-XQBPLPMBSA-N	COc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)cc1	BroadT	BRD-K73200916	BRD-K73200916-001-01-4	Broad Institute of MIT and Harvard	BRD-K73200916			COc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)cc1	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19+,22-/m1/s1	BXPDQGCNKCQIEP-XQBPLPMBSA-N	471.200550298							122465
BRD-K40251180	LSM-33909		54639975	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19-,20+/m0/s1	KHPOILJWMXIQKX-SLFFLAALSA-N	COc1ccc(NC(=O)N[C@H]2C=C[C@@H](CC(=O)NC3CCCCC3)O[C@@H]2CO)cc1	BroadT	BRD-K40251180	BRD-K40251180-001-01-6	Broad Institute of MIT and Harvard	BRD-K40251180			COc1ccc(NC(=O)N[C@H]2C=C[C@@H](CC(=O)NC3CCCCC3)O[C@@H]2CO)cc1	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19-,20+/m0/s1	KHPOILJWMXIQKX-SLFFLAALSA-N	417.226371122							122466
BRD-K56916066	LSM-33910		54640075	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19-,20-/m0/s1	PELUPFPZEXCELD-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K56916066	BRD-K56916066-001-01-4	Broad Institute of MIT and Harvard	BRD-K56916066			OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19-,20-/m0/s1	PELUPFPZEXCELD-UFYCRDLUSA-N	413.175084478							122467
BRD-K58277621	LSM-33911		54639854	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19-,20-/m0/s1	UXWKWPDPCRHNPI-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C3CCCCC3	BroadT	BRD-K58277621	BRD-K58277621-001-01-7	Broad Institute of MIT and Harvard	BRD-K58277621			OC[C@@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)C1CCCCC1	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19-,20-/m0/s1	UXWKWPDPCRHNPI-UFYCRDLUSA-N	406.226785692							122468
BRD-K16943897	LSM-33912		54639820	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17+,20+/m0/s1	NAHOTKSUDDAWEB-SQGPQFPESA-N	OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K16943897	BRD-K16943897-001-01-2	Broad Institute of MIT and Harvard	BRD-K16943897			OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C22H31N3O7/c26-13-20-17(24-22(28)15-1-4-18-19(11-15)31-14-30-18)3-2-16(32-20)5-6-23-21(27)12-25-7-9-29-10-8-25/h1,4,11,16-17,20,26H,2-3,5-10,12-14H2,(H,23,27)(H,24,28)/t16-,17+,20+/m0/s1	NAHOTKSUDDAWEB-SQGPQFPESA-N	449.216200362							122469
BRD-K75410936	LSM-33913		54640102	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19+,22+/m0/s1	BXPDQGCNKCQIEP-NNMXDRDESA-N	COc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)cc1	BroadT	BRD-K75410936	BRD-K75410936-001-01-3	Broad Institute of MIT and Harvard	BRD-K75410936			COc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)Nc3ccc4OCOc4c3)[C@@H](CO)O2)cc1	InChI=1S/C24H29N3O7/c1-31-17-5-2-15(3-6-17)12-25-23(29)11-18-7-8-19(22(13-28)34-18)27-24(30)26-16-4-9-20-21(10-16)33-14-32-20/h2-6,9-10,18-19,22,28H,7-8,11-14H2,1H3,(H,25,29)(H2,26,27,30)/t18-,19+,22+/m0/s1	BXPDQGCNKCQIEP-NNMXDRDESA-N	471.200550298							122470
MLS003649970	LSM-33914	BRD-K91876603	53382633	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16+,17+/m0/s1	HAYHGVRNUREYAI-GVDBMIGSSA-N	CN(C)CC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	BroadT	BRD-K91876603	BRD-K91876603-001-01-7	Broad Institute of MIT and Harvard	BRD-K91876603			CN(C)CC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16+,17+/m0/s1	HAYHGVRNUREYAI-GVDBMIGSSA-N	382.258005608							122471
BRD-K06344882	LSM-33915		54639911	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13+,14+/m0/s1	MHCXBMBZURQYRG-BFHYXJOUSA-N	CN(C)C(=O)C[C@@H]1CC[C@@H](NC(=O)NC2CCCC2)[C@@H](CO)O1	BroadT	BRD-K06344882	BRD-K06344882-001-01-2	Broad Institute of MIT and Harvard	BRD-K06344882			CN(C)C(=O)C[C@@H]1CC[C@@H](NC(=O)NC2CCCC2)[C@@H](CO)O1	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13+,14+/m0/s1	MHCXBMBZURQYRG-BFHYXJOUSA-N	327.215806438							122472
BRD-K28932578	LSM-33916		54639898	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22+/m0/s1	WADXMENNSPGANR-FDGCKHTNSA-N	COc1ccccc1NC(=O)N[C@@H]2C=C[C@@H](CC(=O)N[C@@H](C)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K28932578	BRD-K28932578-001-01-7	Broad Institute of MIT and Harvard	BRD-K28932578			COc1ccccc1NC(=O)N[C@@H]1C=C[C@@H](CC(=O)N[C@@H](C)c2ccccc2)O[C@@H]1CO	InChI=1S/C24H29N3O5/c1-16(17-8-4-3-5-9-17)25-23(29)14-18-12-13-20(22(15-28)32-18)27-24(30)26-19-10-6-7-11-21(19)31-2/h3-13,16,18,20,22,28H,14-15H2,1-2H3,(H,25,29)(H2,26,27,30)/t16-,18-,20+,22+/m0/s1	WADXMENNSPGANR-FDGCKHTNSA-N	439.210721058							122473
BRD-K45097650	LSM-33917		54640009	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18+,19+/m0/s1	CAYTZIHCJIWWNW-IPMKNSEASA-N	OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K45097650	BRD-K45097650-001-01-9	Broad Institute of MIT and Harvard	BRD-K45097650			OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18+,19+/m0/s1	CAYTZIHCJIWWNW-IPMKNSEASA-N	420.237270164							122474
BRD-K43889095	LSM-33918		54640031	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19+,20-/m1/s1	JNAWISBSOJGFKT-HSALFYBXSA-N	OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K43889095	BRD-K43889095-001-01-4	Broad Institute of MIT and Harvard	BRD-K43889095			OC[C@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19+,20-/m1/s1	JNAWISBSOJGFKT-HSALFYBXSA-N	432.237270164							122475
BRD-K81931105	LSM-33919		54639838	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17-,19-/m1/s1	VLQCPCSLOMVUJP-ZHALLVOQSA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K81931105	BRD-K81931105-001-01-5	Broad Institute of MIT and Harvard	BRD-K81931105			OC[C@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17-,19-/m1/s1	VLQCPCSLOMVUJP-ZHALLVOQSA-N	389.231456502							122476
BRD-K34256721	LSM-33920		54640066	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15-/m1/s1	AVCGIXMUPLIHTE-RBSFLKMASA-N	CCCNC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	BroadT	BRD-K34256721	BRD-K34256721-001-01-9	Broad Institute of MIT and Harvard	BRD-K34256721			CCCNC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15-/m1/s1	AVCGIXMUPLIHTE-RBSFLKMASA-N	354.22670548							122477
BRD-K11013450	LSM-33921		54639977	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19+,20-/m1/s1	KHPOILJWMXIQKX-HSALFYBXSA-N	COc1ccc(NC(=O)N[C@H]2C=C[C@H](CC(=O)NC3CCCCC3)O[C@@H]2CO)cc1	BroadT	BRD-K11013450	BRD-K11013450-001-01-8	Broad Institute of MIT and Harvard	BRD-K11013450			COc1ccc(NC(=O)N[C@H]2C=C[C@H](CC(=O)NC3CCCCC3)O[C@@H]2CO)cc1	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19+,20-/m1/s1	KHPOILJWMXIQKX-HSALFYBXSA-N	417.226371122							122478
BRD-K97452545	LSM-33922		54640071	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15-/m0/s1	AVCGIXMUPLIHTE-ZNMIVQPWSA-N	CCCNC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	BroadT	BRD-K97452545	BRD-K97452545-001-01-2	Broad Institute of MIT and Harvard	BRD-K97452545			CCCNC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCN(C)CC2)O[C@H]1CO	InChI=1S/C17H30N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h4-5,13-15,22H,3,6-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15-/m0/s1	AVCGIXMUPLIHTE-ZNMIVQPWSA-N	354.22670548							122479
BRD-K47707657	LSM-33923		54639859	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17+,18+/m1/s1	INOAIBAAQYWPCB-SQNIBIBYSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NC(=O)C4CCOCC4	BroadT	BRD-K47707657	BRD-K47707657-001-01-4	Broad Institute of MIT and Harvard	BRD-K47707657			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17+,18+/m1/s1	INOAIBAAQYWPCB-SQNIBIBYSA-N	422.252920228							122480
BRD-K88278778	LSM-33924		54640011	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18-,19+/m1/s1	CAYTZIHCJIWWNW-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K88278778	BRD-K88278778-001-01-0	Broad Institute of MIT and Harvard	BRD-K88278778			OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C21H32N4O5/c26-15-19-18(24-20(27)13-16-3-1-2-7-22-16)5-4-17(30-19)6-8-23-21(28)14-25-9-11-29-12-10-25/h1-3,7,17-19,26H,4-6,8-15H2,(H,23,28)(H,24,27)/t17-,18-,19+/m1/s1	CAYTZIHCJIWWNW-QRVBRYPASA-N	420.237270164							122481
BRD-K37151525	LSM-33925		54640035	InChI=1S/C17H24N4O3/c1-23-13-4-2-12(3-5-13)16-10-21(20-19-16)9-8-14-6-7-15(18)17(11-22)24-14/h2-5,10,14-15,17,22H,6-9,11,18H2,1H3/t14-,15+,17-/m0/s1	QGKSTFQSSSITBY-UXLLHSPISA-N	COc1ccc(cc1)c2cn(CC[C@@H]3CC[C@@H](N)[C@H](CO)O3)nn2	BroadT	BRD-K37151525	BRD-K37151525-001-01-7	Broad Institute of MIT and Harvard	BRD-K37151525			COc1ccc(cc1)-c1cn(CC[C@@H]2CC[C@@H](N)[C@H](CO)O2)nn1	InChI=1S/C17H24N4O3/c1-23-13-4-2-12(3-5-13)16-10-21(20-19-16)9-8-14-6-7-15(18)17(11-22)24-14/h2-5,10,14-15,17,22H,6-9,11,18H2,1H3/t14-,15+,17-/m0/s1	QGKSTFQSSSITBY-UXLLHSPISA-N	332.184840668							122482
BRD-K60454848	LSM-33926		54639834	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15-/m1/s1	XCSADXMQLTVTGS-QLFBSQMISA-N	CCCNC(=O)N[C@H]1CC[C@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	BroadT	BRD-K60454848	BRD-K60454848-001-01-5	Broad Institute of MIT and Harvard	BRD-K60454848			CCCNC(=O)N[C@H]1CC[C@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO	InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14+,15-/m1/s1	XCSADXMQLTVTGS-QLFBSQMISA-N	356.242355544							122483
BRD-K67120755	LSM-33927		54639863	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17-,18+/m0/s1	INOAIBAAQYWPCB-OKZBNKHCSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NC(=O)C4CCOCC4	BroadT	BRD-K67120755	BRD-K67120755-001-01-6	Broad Institute of MIT and Harvard	BRD-K67120755			OC[C@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C21H34N4O5/c26-14-18-17(22-20(27)15-6-11-29-12-7-15)4-3-16(30-18)5-10-25-13-19(23-24-25)21(28)8-1-2-9-21/h13,15-18,26,28H,1-12,14H2,(H,22,27)/t16-,17-,18+/m0/s1	INOAIBAAQYWPCB-OKZBNKHCSA-N	422.252920228							122484
BRD-K45307863	LSM-33928		54639804	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17+,18-/m0/s1	ZAWCCEHPCRSVNF-KSZLIROESA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K45307863	BRD-K45307863-001-01-5	Broad Institute of MIT and Harvard	BRD-K45307863			OC[C@@H]1O[C@H](CCNC(=O)C2CCOCC2)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C20H29N3O5/c24-13-18-17(23-20(26)14-3-8-21-9-4-14)2-1-16(28-18)5-10-22-19(25)15-6-11-27-12-7-15/h3-4,8-9,15-18,24H,1-2,5-7,10-13H2,(H,22,25)(H,23,26)/t16-,17+,18-/m0/s1	ZAWCCEHPCRSVNF-KSZLIROESA-N	391.210721058							122485
BRD-K10135449	LSM-33929		54640055	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18+/m1/s1	IHGRXRHOBYYXJU-KURKYZTESA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2cccnc2)[C@H](CO)O1	BroadT	BRD-K10135449	BRD-K10135449-001-01-4	Broad Institute of MIT and Harvard	BRD-K10135449			CN(C)CCCNC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2cccnc2)[C@H](CO)O1	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17-,18+/m1/s1	IHGRXRHOBYYXJU-KURKYZTESA-N	392.242355544							122486
BRD-K93210276	LSM-33930		54639839	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17-,19+/m1/s1	VLQCPCSLOMVUJP-LMMKCTJWSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K93210276	BRD-K93210276-001-01-3	Broad Institute of MIT and Harvard	BRD-K93210276			OC[C@@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17-,19+/m1/s1	VLQCPCSLOMVUJP-LMMKCTJWSA-N	389.231456502							122487
BRD-K42361742	LSM-33931		54640019	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17-,19-/m1/s1	FRHMAPNXHVZDAK-SZVBFZGTSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccccc2)C=C[C@H]1NC(=O)Nc3cc(F)ccc3F	BroadT	BRD-K42361742	BRD-K42361742-001-01-2	Broad Institute of MIT and Harvard	BRD-K42361742			OC[C@H]1O[C@@H](CC(=O)Nc2ccccc2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C21H21F2N3O4/c22-13-6-8-16(23)18(10-13)26-21(29)25-17-9-7-15(30-19(17)12-27)11-20(28)24-14-4-2-1-3-5-14/h1-10,15,17,19,27H,11-12H2,(H,24,28)(H2,25,26,29)/t15-,17-,19-/m1/s1	FRHMAPNXHVZDAK-SZVBFZGTSA-N	417.150012582							122488
BRD-K61144709	LSM-33932		54639846	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17-,18-/m0/s1	ZNNAKNJWDLOPKK-BZSNNMDCSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C=C[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K61144709	BRD-K61144709-001-01-9	Broad Institute of MIT and Harvard	BRD-K61144709			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C=C[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C20H27N3O5/c24-13-18-17(23-20(26)15-5-9-27-10-6-15)2-1-16(28-18)11-19(25)22-12-14-3-7-21-8-4-14/h1-4,7-8,15-18,24H,5-6,9-13H2,(H,22,25)(H,23,26)/t16-,17-,18-/m0/s1	ZNNAKNJWDLOPKK-BZSNNMDCSA-N	389.195070994							122489
BRD-K11428617	LSM-33933		54640030	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19-,20+/m1/s1	JNAWISBSOJGFKT-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K11428617	BRD-K11428617-001-01-8	Broad Institute of MIT and Harvard	BRD-K11428617			OC[C@@H]1O[C@@H](CC(=O)NCCCN2CCOCC2)C=C[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H32N4O5/c27-16-20-19(25-22(29)14-17-4-1-2-7-23-17)6-5-18(31-20)15-21(28)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,18-20,27H,3,8-16H2,(H,24,28)(H,25,29)/t18-,19-,20+/m1/s1	JNAWISBSOJGFKT-AQNXPRMDSA-N	432.237270164							122490
BRD-K80198069	LSM-33934		54639881	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18-/m0/s1	BFDDYBZFCVNWOI-LESCRADOSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)C=C[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K80198069	BRD-K80198069-001-01-6	Broad Institute of MIT and Harvard	BRD-K80198069			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)C=C[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16+,18-/m0/s1	BFDDYBZFCVNWOI-LESCRADOSA-N	400.154683392							122491
BRD-K18623962	LSM-33935		54640034	InChI=1S/C17H24N4O3/c1-23-13-4-2-12(3-5-13)16-10-21(20-19-16)9-8-14-6-7-15(18)17(11-22)24-14/h2-5,10,14-15,17,22H,6-9,11,18H2,1H3/t14-,15+,17-/m1/s1	QGKSTFQSSSITBY-HLLBOEOZSA-N	COc1ccc(cc1)c2cn(CC[C@H]3CC[C@H](N)[C@@H](CO)O3)nn2	BroadT	BRD-K18623962	BRD-K18623962-001-01-8	Broad Institute of MIT and Harvard	BRD-K18623962			COc1ccc(cc1)-c1cn(CC[C@H]2CC[C@H](N)[C@@H](CO)O2)nn1	InChI=1S/C17H24N4O3/c1-23-13-4-2-12(3-5-13)16-10-21(20-19-16)9-8-14-6-7-15(18)17(11-22)24-14/h2-5,10,14-15,17,22H,6-9,11,18H2,1H3/t14-,15+,17-/m1/s1	QGKSTFQSSSITBY-HLLBOEOZSA-N	332.184840668							122492
BRD-K84932026	LSM-33936		54639978	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19+,20-/m0/s1	KHPOILJWMXIQKX-ZCNNSNEGSA-N	COc1ccc(NC(=O)N[C@@H]2C=C[C@@H](CC(=O)NC3CCCCC3)O[C@H]2CO)cc1	BroadT	BRD-K84932026	BRD-K84932026-001-01-6	Broad Institute of MIT and Harvard	BRD-K84932026			COc1ccc(NC(=O)N[C@@H]2C=C[C@@H](CC(=O)NC3CCCCC3)O[C@H]2CO)cc1	InChI=1S/C22H31N3O5/c1-29-17-9-7-16(8-10-17)24-22(28)25-19-12-11-18(30-20(19)14-26)13-21(27)23-15-5-3-2-4-6-15/h7-12,15,18-20,26H,2-6,13-14H2,1H3,(H,23,27)(H2,24,25,28)/t18-,19+,20-/m0/s1	KHPOILJWMXIQKX-ZCNNSNEGSA-N	417.226371122							122493
BRD-K79159743	LSM-33937		54640051	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18+/m1/s1	IHGRXRHOBYYXJU-SQNIBIBYSA-N	CN(C)CCCNC(=O)C[C@H]1CC[C@H](NC(=O)Cc2cccnc2)[C@H](CO)O1	BroadT	BRD-K79159743	BRD-K79159743-001-01-5	Broad Institute of MIT and Harvard	BRD-K79159743			CN(C)CCCNC(=O)C[C@H]1CC[C@H](NC(=O)Cc2cccnc2)[C@H](CO)O1	InChI=1S/C20H32N4O4/c1-24(2)10-4-9-22-19(26)12-16-6-7-17(18(14-25)28-16)23-20(27)11-15-5-3-8-21-13-15/h3,5,8,13,16-18,25H,4,6-7,9-12,14H2,1-2H3,(H,22,26)(H,23,27)/t16-,17+,18+/m1/s1	IHGRXRHOBYYXJU-SQNIBIBYSA-N	392.242355544							122494
MLS003649999	LSM-33938	BRD-K53046137	53382662	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19+,20-/m1/s1	PELUPFPZEXCELD-HSALFYBXSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)c3ccc(F)cc3	BroadT	BRD-K53046137	BRD-K53046137-001-01-8	Broad Institute of MIT and Harvard	BRD-K53046137			OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)C=C[C@@H]1NC(=O)c1ccc(F)cc1	InChI=1S/C22H24FN3O4/c23-17-3-1-16(2-4-17)22(29)26-19-6-5-18(30-20(19)14-27)13-21(28)25-12-9-15-7-10-24-11-8-15/h1-8,10-11,18-20,27H,9,12-14H2,(H,25,28)(H,26,29)/t18-,19+,20-/m1/s1	PELUPFPZEXCELD-HSALFYBXSA-N	413.175084478							122495
BRD-K34519525	LSM-33939		54639989	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16-,17-/m0/s1	HAYHGVRNUREYAI-ULQDDVLXSA-N	CN(C)CC(=O)N[C@H]1C=C[C@@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	BroadT	BRD-K34519525	BRD-K34519525-001-01-8	Broad Institute of MIT and Harvard	BRD-K34519525			CN(C)CC(=O)N[C@H]1C=C[C@@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	InChI=1S/C19H34N4O4/c1-22(2)13-19(26)21-16-7-6-15(27-17(16)14-24)12-18(25)20-8-11-23-9-4-3-5-10-23/h6-7,15-17,24H,3-5,8-14H2,1-2H3,(H,20,25)(H,21,26)/t15-,16-,17-/m0/s1	HAYHGVRNUREYAI-ULQDDVLXSA-N	382.258005608							122496
BRD-K76008396	LSM-33940		54639853	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19-,20-/m1/s1	UXWKWPDPCRHNPI-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C3CCCCC3	BroadT	BRD-K76008396	BRD-K76008396-001-01-7	Broad Institute of MIT and Harvard	BRD-K76008396			OC[C@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)C1CCCCC1	InChI=1S/C22H31FN2O4/c23-17-8-6-16(7-9-17)21(27)24-13-12-18-10-11-19(20(14-26)29-18)25-22(28)15-4-2-1-3-5-15/h6-9,15,18-20,26H,1-5,10-14H2,(H,24,27)(H,25,28)/t18-,19-,20-/m1/s1	UXWKWPDPCRHNPI-VAMGGRTRSA-N	406.226785692							122497
BRD-K22377875	LSM-33941		54639873	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18+,19-/m0/s1	CSAZNKSAKUIKBW-UHOSZYNNSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)c3cccnc3	BroadT	BRD-K22377875	BRD-K22377875-001-01-1	Broad Institute of MIT and Harvard	BRD-K22377875			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccccc2)CC[C@H]1NC(=O)c1cccnc1	InChI=1S/C20H25N3O5S/c24-14-19-18(23-20(25)15-5-4-11-21-13-15)9-8-16(28-19)10-12-22-29(26,27)17-6-2-1-3-7-17/h1-7,11,13,16,18-19,22,24H,8-10,12,14H2,(H,23,25)/t16-,18+,19-/m0/s1	CSAZNKSAKUIKBW-UHOSZYNNSA-N	419.15149162							122498
BRD-K31805261	LSM-33942		54639986	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17+,19-/m0/s1	ULTMRAJJWBMPBO-WDYCEAGBSA-N	OC[C@@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K31805261	BRD-K31805261-001-01-2	Broad Institute of MIT and Harvard	BRD-K31805261			OC[C@@H]1O[C@H](CCNC(=O)Nc2cc(F)ccc2F)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H30F2N4O5/c22-14-1-3-16(23)18(11-14)26-21(30)24-6-5-15-2-4-17(19(13-28)32-15)25-20(29)12-27-7-9-31-10-8-27/h1,3,11,15,17,19,28H,2,4-10,12-13H2,(H,25,29)(H2,24,26,30)/t15-,17+,19-/m0/s1	ULTMRAJJWBMPBO-WDYCEAGBSA-N	456.2184265							122499
BRD-K24514314	LSM-33943		54639912	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13-,14-/m1/s1	MHCXBMBZURQYRG-MGPQQGTHSA-N	CN(C)C(=O)C[C@H]1CC[C@@H](NC(=O)NC2CCCC2)[C@@H](CO)O1	BroadT	BRD-K24514314	BRD-K24514314-001-01-6	Broad Institute of MIT and Harvard	BRD-K24514314			CN(C)C(=O)C[C@H]1CC[C@@H](NC(=O)NC2CCCC2)[C@@H](CO)O1	InChI=1S/C16H29N3O4/c1-19(2)15(21)9-12-7-8-13(14(10-20)23-12)18-16(22)17-11-5-3-4-6-11/h11-14,20H,3-10H2,1-2H3,(H2,17,18,22)/t12-,13-,14-/m1/s1	MHCXBMBZURQYRG-MGPQQGTHSA-N	327.215806438							122500
BRD-K59095205	LSM-33944		54639877	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18-/m0/s1	BFDDYBZFCVNWOI-ZVZYQTTQSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)C=C[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K59095205	BRD-K59095205-001-01-6	Broad Institute of MIT and Harvard	BRD-K59095205			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)C=C[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H21FN4O4/c21-15-4-2-1-3-13(15)10-24-19(27)9-14-5-6-16(18(12-26)29-14)25-20(28)17-11-22-7-8-23-17/h1-8,11,14,16,18,26H,9-10,12H2,(H,24,27)(H,25,28)/t14-,16-,18-/m0/s1	BFDDYBZFCVNWOI-ZVZYQTTQSA-N	400.154683392							122501
BRD-K24512597	LSM-33945		54639950	InChI=1S/C17H25N3O5S/c21-10-14-13(19-16(23)11-3-6-24-7-4-11)2-1-12(25-14)9-15(22)20-17-18-5-8-26-17/h5,8,11-14,21H,1-4,6-7,9-10H2,(H,19,23)(H,18,20,22)/t12-,13-,14-/m1/s1	BGYIYMFDHNUKRK-MGPQQGTHSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K24512597	BRD-K24512597-001-01-8	Broad Institute of MIT and Harvard	BRD-K24512597			OC[C@H]1O[C@@H](CC(=O)Nc2nccs2)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C17H25N3O5S/c21-10-14-13(19-16(23)11-3-6-24-7-4-11)2-1-12(25-14)9-15(22)20-17-18-5-8-26-17/h5,8,11-14,21H,1-4,6-7,9-10H2,(H,19,23)(H,18,20,22)/t12-,13-,14-/m1/s1	BGYIYMFDHNUKRK-MGPQQGTHSA-N	383.15149162							122502
BRD-K49108064	LSM-33946		54632783	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25-/m1/s1	LCEYSZSEEBOWFL-FUMQJTLXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K49108064	BRD-K49108064-001-01-0	Broad Institute of MIT and Harvard	BRD-K49108064			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25-/m1/s1	LCEYSZSEEBOWFL-FUMQJTLXSA-N	497.25258587							122503
BRD-K86842652	LSM-33947		54632615	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17-,21+/m1/s1	HECXZILGRZYZSJ-LZJOCLMNSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K86842652	BRD-K86842652-001-01-6	Broad Institute of MIT and Harvard	BRD-K86842652			CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17-,21+/m1/s1	HECXZILGRZYZSJ-LZJOCLMNSA-N	487.265791262							122504
BRD-K12158143	LSM-33948		54632678	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18+,23-/m0/s1	MQBPYFVBIBWVKN-IXFSTUDKSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC3CC3	BroadT	BRD-K12158143	BRD-K12158143-001-01-3	Broad Institute of MIT and Harvard	BRD-K12158143			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC1CC1	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18+,23-/m0/s1	MQBPYFVBIBWVKN-IXFSTUDKSA-N	473.288971378							122505
BRD-K53936012	LSM-33949		54632747	InChI=1S/C25H37N3O6/c1-16-12-28(24(30)10-18-6-7-18)17(2)14-34-21-11-19(26-23(29)15-32-4)8-9-20(21)25(31)27(3)13-22(16)33-5/h8-9,11,16-18,22H,6-7,10,12-15H2,1-5H3,(H,26,29)/t16-,17+,22+/m1/s1	GTQGGUJFCSCMSO-JLHGSKIFSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K53936012	BRD-K53936012-001-01-0	Broad Institute of MIT and Harvard	BRD-K53936012			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O6/c1-16-12-28(24(30)10-18-6-7-18)17(2)14-34-21-11-19(26-23(29)15-32-4)8-9-20(21)25(31)27(3)13-22(16)33-5/h8-9,11,16-18,22H,6-7,10,12-15H2,1-5H3,(H,26,29)/t16-,17+,22+/m1/s1	GTQGGUJFCSCMSO-JLHGSKIFSA-N	475.268235934							122506
BRD-K51618267	LSM-33950		54632851	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16-,20+/m1/s1	WSQGAZSPVHYFJA-QINHECLXSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)COC	BroadT	BRD-K51618267	BRD-K51618267-001-01-8	Broad Institute of MIT and Harvard	BRD-K51618267			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)COC)c1	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16-,20+/m1/s1	WSQGAZSPVHYFJA-QINHECLXSA-N	449.25258587							122507
BRD-K86241681	LSM-33951		54632849	InChI=1S/C27H34F4N4O4/c1-17-14-35(12-11-27(29,30)31)18(2)16-39-23-13-19(32-26(37)33-22-8-6-5-7-21(22)28)9-10-20(23)25(36)34(3)15-24(17)38-4/h5-10,13,17-18,24H,11-12,14-16H2,1-4H3,(H2,32,33,37)/t17-,18-,24-/m1/s1	UWZVFFPZKKJULR-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K86241681	BRD-K86241681-001-01-6	Broad Institute of MIT and Harvard	BRD-K86241681			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccccc3F)cc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C27H34F4N4O4/c1-17-14-35(12-11-27(29,30)31)18(2)16-39-23-13-19(32-26(37)33-22-8-6-5-7-21(22)28)9-10-20(23)25(36)34(3)15-24(17)38-4/h5-10,13,17-18,24H,11-12,14-16H2,1-4H3,(H2,32,33,37)/t17-,18-,24-/m1/s1	UWZVFFPZKKJULR-QZTZHPFYSA-N	554.251618408							122508
BRD-K50272743	LSM-33952		54632805	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-9-11-28-12-10-20)18(2)16-36-23-13-21(29-25(32)19-5-6-19)7-8-22(23)27(34)30(3)15-24(17)35-4/h7-13,17-19,24H,5-6,14-16H2,1-4H3,(H,29,32)/t17-,18+,24-/m0/s1	YAZRVZYRDGQLIX-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccncc4	BroadT	BRD-K50272743	BRD-K50272743-001-01-9	Broad Institute of MIT and Harvard	BRD-K50272743			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccncc1	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-9-11-28-12-10-20)18(2)16-36-23-13-21(29-25(32)19-5-6-19)7-8-22(23)27(34)30(3)15-24(17)35-4/h7-13,17-19,24H,5-6,14-16H2,1-4H3,(H,29,32)/t17-,18+,24-/m0/s1	YAZRVZYRDGQLIX-RHGYRFJNSA-N	494.252920228							122509
BRD-K37790543	LSM-33953		54632821	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15-,21-/m1/s1	TWDPSDBESUIWDD-VTJXTGGHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K37790543	BRD-K37790543-001-01-0	Broad Institute of MIT and Harvard	BRD-K37790543			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15-,21-/m1/s1	TWDPSDBESUIWDD-VTJXTGGHSA-N	473.26381927							122510
BRD-K25608271	LSM-33954		54632706	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16-,20-/m0/s1	WSQGAZSPVHYFJA-FTRWYGJKSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)COC	BroadT	BRD-K25608271	BRD-K25608271-001-01-6	Broad Institute of MIT and Harvard	BRD-K25608271			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)COC)c1	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16-,20-/m0/s1	WSQGAZSPVHYFJA-FTRWYGJKSA-N	449.25258587							122511
BRD-K69918256	LSM-33955		54632650	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16-,20-/m1/s1	WSQGAZSPVHYFJA-JXXFODFXSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)COC	BroadT	BRD-K69918256	BRD-K69918256-001-01-5	Broad Institute of MIT and Harvard	BRD-K69918256			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)COC)c1	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16-,20-/m1/s1	WSQGAZSPVHYFJA-JXXFODFXSA-N	449.25258587							122512
BRD-K87224747	LSM-33956		54632810	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20+,25-/m1/s1	VUNNIGMMXHQHNM-OHUGHZGNSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCCC3	BroadT	BRD-K87224747	BRD-K87224747-001-01-3	Broad Institute of MIT and Harvard	BRD-K87224747			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCCC1	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20+,25-/m1/s1	VUNNIGMMXHQHNM-OHUGHZGNSA-N	516.331170548							122513
BRD-K91470977	LSM-33957		54632610	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16-,20+/m0/s1	WSQGAZSPVHYFJA-TWOQFEAHSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)COC	BroadT	BRD-K91470977	BRD-K91470977-001-01-7	Broad Institute of MIT and Harvard	BRD-K91470977			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)COC)c1	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16-,20+/m0/s1	WSQGAZSPVHYFJA-TWOQFEAHSA-N	449.25258587							122514
BRD-K15832275-001-01-0	LSM-33958	BRD-K15832275	54632680	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-18(5-6-20(21)23(31)30(3)12-22(14)33-4)28-24(32)29-19-8-16(25)7-17(26)9-19/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22+/m1/s1	WLELUPNUISGFRW-HLFMIMNKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K15832275	BRD-K15832275-001-01-0	Broad Institute of MIT and Harvard	BRD-K15832275			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-18(5-6-20(21)23(31)30(3)12-22(14)33-4)28-24(32)29-19-8-16(25)7-17(26)9-19/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22+/m1/s1	WLELUPNUISGFRW-HLFMIMNKSA-N	508.1644109							122515
BRD-K16395143	LSM-33959		54632739	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24-/m1/s1	PGRNYZHGQKBFKV-XVTZWQNCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K16395143	BRD-K16395143-001-01-7	Broad Institute of MIT and Harvard	BRD-K16395143			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24-/m1/s1	PGRNYZHGQKBFKV-XVTZWQNCSA-N	500.243498396							122516
BRD-K00275866	LSM-33960		54632580	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	MAKKLZBPABPJBZ-YDIMBITNSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCC3	BroadT	BRD-K00275866	BRD-K00275866-001-01-4	Broad Institute of MIT and Harvard	BRD-K00275866			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCC1	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	MAKKLZBPABPJBZ-YDIMBITNSA-N	487.304621442							122517
BRD-K36966028	LSM-33961		54632852	InChI=1S/C23H32N4O5/c1-14-11-26(4)15(2)13-31-20-10-17(24-22(28)19-9-16(3)32-25-19)7-8-18(20)23(29)27(5)12-21(14)30-6/h7-10,14-15,21H,11-13H2,1-6H3,(H,24,28)/t14-,15-,21+/m0/s1	SSJRVKKQRIQXRQ-VFCRVFHLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K36966028	BRD-K36966028-001-01-1	Broad Institute of MIT and Harvard	BRD-K36966028			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C23H32N4O5/c1-14-11-26(4)15(2)13-31-20-10-17(24-22(28)19-9-16(3)32-25-19)7-8-18(20)23(29)27(5)12-21(14)30-6/h7-10,14-15,21H,11-13H2,1-6H3,(H,24,28)/t14-,15-,21+/m0/s1	SSJRVKKQRIQXRQ-VFCRVFHLSA-N	444.237270164							122518
BRD-K65297542	LSM-33962		54632736	InChI=1S/C24H34N4O4S/c1-6-22(29)26-18-7-8-19-20(11-18)32-15-17(3)28(14-23-25-9-10-33-23)12-16(2)21(31-5)13-27(4)24(19)30/h7-11,16-17,21H,6,12-15H2,1-5H3,(H,26,29)/t16-,17-,21-/m0/s1	AIGQWRJTRGZNLS-FIKGOQFSSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3nccs3)[C@@H](C)COc2c1	BroadT	BRD-K65297542	BRD-K65297542-001-01-2	Broad Institute of MIT and Harvard	BRD-K65297542			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3nccs3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C24H34N4O4S/c1-6-22(29)26-18-7-8-19-20(11-18)32-15-17(3)28(14-23-25-9-10-33-23)12-16(2)21(31-5)13-27(4)24(19)30/h7-11,16-17,21H,6,12-15H2,1-5H3,(H,26,29)/t16-,17-,21-/m0/s1	AIGQWRJTRGZNLS-FIKGOQFSSA-N	474.230076298							122519
BRD-K72364076	LSM-33963		54632558	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18+,24+/m0/s1	SADWOVYOXJOVIV-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc4cncnc4)C[C@@H]1C	BroadT	BRD-K72364076	BRD-K72364076-001-01-5	Broad Institute of MIT and Harvard	BRD-K72364076			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18+,24+/m0/s1	SADWOVYOXJOVIV-HOOSLVGPSA-N	481.26890465							122520
BRD-K13258766	LSM-33964		54632801	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28+/m1/s1	HUDWACAATGSXNV-CJYOKPGZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K13258766	BRD-K13258766-001-01-6	Broad Institute of MIT and Harvard	BRD-K13258766			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28+/m1/s1	HUDWACAATGSXNV-CJYOKPGZSA-N	517.25767125							122521
BRD-K72120094	LSM-33965		54632571	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18+,25+/m0/s1	UYGLFTDABBDOCR-YYULODDRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K72120094	BRD-K72120094-001-01-9	Broad Institute of MIT and Harvard	BRD-K72120094			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1F	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18+,25+/m0/s1	UYGLFTDABBDOCR-YYULODDRSA-N	511.248249418							122522
BRD-K65913831-001-01-4	LSM-33966	BRD-K65913831	54632590	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-18(5-6-20(21)23(31)30(3)12-22(14)33-4)28-24(32)29-19-8-16(25)7-17(26)9-19/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22-/m1/s1	WLELUPNUISGFRW-ZCCHDVMBSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K65913831	BRD-K65913831-001-01-4	Broad Institute of MIT and Harvard	BRD-K65913831			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-18(5-6-20(21)23(31)30(3)12-22(14)33-4)28-24(32)29-19-8-16(25)7-17(26)9-19/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22-/m1/s1	WLELUPNUISGFRW-ZCCHDVMBSA-N	508.1644109							122523
BRD-K63547380	LSM-33967		54632568	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25-/m0/s1	LCEYSZSEEBOWFL-RPPIVITFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K63547380	BRD-K63547380-001-01-7	Broad Institute of MIT and Harvard	BRD-K63547380			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25-/m0/s1	LCEYSZSEEBOWFL-RPPIVITFSA-N	497.25258587							122524
BRD-K84524247-001-01-4	LSM-33968	BRD-K84524247	54632574	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-18(5-6-20(21)23(31)30(3)12-22(14)33-4)28-24(32)29-19-8-16(25)7-17(26)9-19/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22-/m0/s1	WLELUPNUISGFRW-KIMHZCHSSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K84524247	BRD-K84524247-001-01-4	Broad Institute of MIT and Harvard	BRD-K84524247			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-18(5-6-20(21)23(31)30(3)12-22(14)33-4)28-24(32)29-19-8-16(25)7-17(26)9-19/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22-/m0/s1	WLELUPNUISGFRW-KIMHZCHSSA-N	508.1644109							122525
BRD-K29298614	LSM-33969		54632663	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m0/s1	VMJMIMLZIZXOHC-PONJGIIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K29298614	BRD-K29298614-001-01-8	Broad Institute of MIT and Harvard	BRD-K29298614			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16-,22+/m0/s1	VMJMIMLZIZXOHC-PONJGIIJSA-N	479.18901998							122526
BRD-K54820232	LSM-33970		54632838	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)28-13-16(3)21(32-6)14-27(5)23(30)19-10-9-18(26-22(29)8-2)12-20(19)33-15-17(28)4/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H,25,31)(H,26,29)/t16-,17+,21-/m0/s1	WYILBQVQDSLHTR-FVJLSDCUSA-N	CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CC)cc2OC[C@H]1C)OC	BroadT	BRD-K54820232	BRD-K54820232-001-01-9	Broad Institute of MIT and Harvard	BRD-K54820232			CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CC)cc2OC[C@H]1C)OC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)28-13-16(3)21(32-6)14-27(5)23(30)19-10-9-18(26-22(29)8-2)12-20(19)33-15-17(28)4/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H,25,31)(H,26,29)/t16-,17+,21-/m0/s1	WYILBQVQDSLHTR-FVJLSDCUSA-N	462.284220356							122527
CHEMBL3182402	LSM-33971	BRD-K80167378	54632639	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17-,22+/m0/s1	WEZMNWQXUMSVMO-PNLZDCPESA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K80167378	BRD-K80167378-001-01-7	Broad Institute of MIT and Harvard	BRD-K80167378			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17-,22+/m0/s1	WEZMNWQXUMSVMO-PNLZDCPESA-N	475.268235934							122528
BRD-K92887014	LSM-33972		54632718	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17+,22-/m1/s1	WEZMNWQXUMSVMO-HYFFOGBASA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K92887014	BRD-K92887014-001-01-6	Broad Institute of MIT and Harvard	BRD-K92887014			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17+,22-/m1/s1	WEZMNWQXUMSVMO-HYFFOGBASA-N	475.268235934							122529
BRD-K28107038	LSM-33973		54632792	InChI=1S/C24H34N4O4S/c1-6-22(29)26-18-7-8-19-20(11-18)32-15-17(3)28(14-23-25-9-10-33-23)12-16(2)21(31-5)13-27(4)24(19)30/h7-11,16-17,21H,6,12-15H2,1-5H3,(H,26,29)/t16-,17+,21-/m1/s1	AIGQWRJTRGZNLS-LLGFUMIMSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3nccs3)[C@@H](C)COc2c1	BroadT	BRD-K28107038	BRD-K28107038-001-01-0	Broad Institute of MIT and Harvard	BRD-K28107038			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3nccs3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C24H34N4O4S/c1-6-22(29)26-18-7-8-19-20(11-18)32-15-17(3)28(14-23-25-9-10-33-23)12-16(2)21(31-5)13-27(4)24(19)30/h7-11,16-17,21H,6,12-15H2,1-5H3,(H,26,29)/t16-,17+,21-/m1/s1	AIGQWRJTRGZNLS-LLGFUMIMSA-N	474.230076298							122530
BRD-K88384015	LSM-33974		54632728	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18-/m1/s1	RENPXZBPSBTSHX-FHSNZYRGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K88384015	BRD-K88384015-001-01-9	Broad Institute of MIT and Harvard	BRD-K88384015			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18-/m1/s1	RENPXZBPSBTSHX-FHSNZYRGSA-N	363.215806438							122531
BRD-K32539786	LSM-33975		54632595	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16+,21-/m0/s1	FGFJNWQPGUBCRY-MRUHUIDDSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K32539786	BRD-K32539786-001-01-2	Broad Institute of MIT and Harvard	BRD-K32539786			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16+,21-/m0/s1	FGFJNWQPGUBCRY-MRUHUIDDSA-N	448.268570292							122532
BRD-K27499870	LSM-33976		54632853	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18-,23+/m1/s1	MQBPYFVBIBWVKN-PNCHPQGNSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC3CC3	BroadT	BRD-K27499870	BRD-K27499870-001-01-3	Broad Institute of MIT and Harvard	BRD-K27499870			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC1CC1	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18-,23+/m1/s1	MQBPYFVBIBWVKN-PNCHPQGNSA-N	473.288971378							122533
BRD-K71647210	LSM-33977		54632644	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17+,21+/m0/s1	HECXZILGRZYZSJ-CSODHUTKSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K71647210	BRD-K71647210-001-01-1	Broad Institute of MIT and Harvard	BRD-K71647210			CCCC(=O)Nc1ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17+,21+/m0/s1	HECXZILGRZYZSJ-CSODHUTKSA-N	487.265791262							122534
BRD-K92701606	LSM-33978		54632722	InChI=1S/C22H36N4O6S/c1-7-10-23-22(28)26-12-15(2)20(31-5)13-25(4)21(27)18-11-17(24-33(6,29)30)8-9-19(18)32-14-16(26)3/h8-9,11,15-16,20,24H,7,10,12-14H2,1-6H3,(H,23,28)/t15-,16-,20-/m0/s1	FSCFODAWIHEFCQ-FTRWYGJKSA-N	CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K92701606	BRD-K92701606-001-01-3	Broad Institute of MIT and Harvard	BRD-K92701606			CCCNC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C22H36N4O6S/c1-7-10-23-22(28)26-12-15(2)20(31-5)13-25(4)21(27)18-11-17(24-33(6,29)30)8-9-19(18)32-14-16(26)3/h8-9,11,15-16,20,24H,7,10,12-14H2,1-6H3,(H,23,28)/t15-,16-,20-/m0/s1	FSCFODAWIHEFCQ-FTRWYGJKSA-N	484.235555602							122535
BRD-K92340402	LSM-33979		54632622	InChI=1S/C27H42N4O6/c1-18-14-31(26(33)20-9-11-36-12-10-20)19(2)17-37-23-13-21(28-25(32)16-29(3)4)7-8-22(23)27(34)30(5)15-24(18)35-6/h7-8,13,18-20,24H,9-12,14-17H2,1-6H3,(H,28,32)/t18-,19-,24-/m1/s1	NMFINSBAMPRQRR-KHCICDEESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)CN(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C3CCOCC3	BroadT	BRD-K92340402	BRD-K92340402-001-01-6	Broad Institute of MIT and Harvard	BRD-K92340402			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)CN(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCOCC1	InChI=1S/C27H42N4O6/c1-18-14-31(26(33)20-9-11-36-12-10-20)19(2)17-37-23-13-21(28-25(32)16-29(3)4)7-8-22(23)27(34)30(5)15-24(18)35-6/h7-8,13,18-20,24H,9-12,14-17H2,1-6H3,(H,28,32)/t18-,19-,24-/m1/s1	NMFINSBAMPRQRR-KHCICDEESA-N	518.310435104							122536
BRD-K31564149	LSM-33980		54632760	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20-,25+/m0/s1	VUNNIGMMXHQHNM-ZYLNGJIFSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCCC3	BroadT	BRD-K31564149	BRD-K31564149-001-01-3	Broad Institute of MIT and Harvard	BRD-K31564149			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCCC1	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20-,25+/m0/s1	VUNNIGMMXHQHNM-ZYLNGJIFSA-N	516.331170548							122537
BRD-K47171373	LSM-33981		54632616	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-7-6-10-27-12-20)19(2)16-35-23-11-21(28-25(31)17-33-4)8-9-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	MONOFYZVTFTEBW-YDIMBITNSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3cccnc3)[C@@H](C)COc2c1	BroadT	BRD-K47171373	BRD-K47171373-001-01-6	Broad Institute of MIT and Harvard	BRD-K47171373			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3cccnc3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-7-6-10-27-12-20)19(2)16-35-23-11-21(28-25(31)17-33-4)8-9-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m1/s1	MONOFYZVTFTEBW-YDIMBITNSA-N	484.268570292							122538
BRD-K56761719	LSM-33982		54632605	InChI=1S/C27H39N3O6/c1-17-14-30(26(32)20-9-11-35-12-10-20)18(2)16-36-23-8-7-21(28-25(31)19-5-6-19)13-22(23)27(33)29(3)15-24(17)34-4/h7-8,13,17-20,24H,5-6,9-12,14-16H2,1-4H3,(H,28,31)/t17-,18-,24+/m0/s1	GAPZQUHMQDIXFX-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C4CCOCC4	BroadT	BRD-K56761719	BRD-K56761719-001-01-5	Broad Institute of MIT and Harvard	BRD-K56761719			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CCOCC1	InChI=1S/C27H39N3O6/c1-17-14-30(26(32)20-9-11-35-12-10-20)18(2)16-36-23-8-7-21(28-25(31)19-5-6-19)13-22(23)27(33)29(3)15-24(17)34-4/h7-8,13,17-20,24H,5-6,9-12,14-16H2,1-4H3,(H,28,31)/t17-,18-,24+/m0/s1	GAPZQUHMQDIXFX-LLJLJFOGSA-N	501.283885998							122539
BRD-K85232409	LSM-33983		54632634	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-7-10-23(33-5)11-8-21)19(2)17-35-25-13-22(28-20(3)31)9-12-24(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19-,26-/m0/s1	PBVUUWJEAMTKEB-DGUDUIIESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(Cc3ccc(OC)cc3)C[C@@H]1C	BroadT	BRD-K85232409	BRD-K85232409-001-01-7	Broad Institute of MIT and Harvard	BRD-K85232409			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(Cc2ccc(OC)cc2)C[C@@H]1C	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-7-10-23(33-5)11-8-21)19(2)17-35-25-13-22(28-20(3)31)9-12-24(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19-,26-/m0/s1	PBVUUWJEAMTKEB-DGUDUIIESA-N	483.273321314							122540
BRD-K45057266	LSM-33984		54632861	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23+/m1/s1	DUFFUDYVDPDMOF-QZMQVMSPSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K45057266	BRD-K45057266-001-01-9	Broad Institute of MIT and Harvard	BRD-K45057266			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23+/m1/s1	DUFFUDYVDPDMOF-QZMQVMSPSA-N	470.252920228							122541
BRD-K42341574	LSM-33985		54632653	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m1/s1	IASRPSUKVFSJOB-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K42341574	BRD-K42341574-001-01-7	Broad Institute of MIT and Harvard	BRD-K42341574			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m1/s1	IASRPSUKVFSJOB-NXMSCROESA-N	469.25767125							122542
BRD-K57905936	LSM-33986		54632661	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20+,25+/m1/s1	OXTPNGYEOOIGNP-RNHFSVANSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccccn3)[C@@H](C)COc2c1	BroadT	BRD-K57905936	BRD-K57905936-001-01-4	Broad Institute of MIT and Harvard	BRD-K57905936			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20+,25+/m1/s1	OXTPNGYEOOIGNP-RNHFSVANSA-N	482.289305736							122543
BRD-K54774983	LSM-33987		54632692	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m1/s1	DUFFUDYVDPDMOF-SAHWJRBASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K54774983	BRD-K54774983-001-01-9	Broad Institute of MIT and Harvard	BRD-K54774983			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m1/s1	DUFFUDYVDPDMOF-SAHWJRBASA-N	470.252920228							122544
BRD-K77691991	LSM-33988		54632833	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16-,21+/m1/s1	FGFJNWQPGUBCRY-ZOCZFRKYSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K77691991	BRD-K77691991-001-01-8	Broad Institute of MIT and Harvard	BRD-K77691991			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16-,21+/m1/s1	FGFJNWQPGUBCRY-ZOCZFRKYSA-N	448.268570292							122545
BRD-K28820796	LSM-33989		54632702	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20-,25-/m1/s1	VUNNIGMMXHQHNM-UMEGOILYSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCCC3	BroadT	BRD-K28820796	BRD-K28820796-001-01-0	Broad Institute of MIT and Harvard	BRD-K28820796			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCCC1	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20-,25-/m1/s1	VUNNIGMMXHQHNM-UMEGOILYSA-N	516.331170548							122546
BRD-K03620381	LSM-33990		54632740	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m1/s1	VMJMIMLZIZXOHC-VVBPWWLESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K03620381	BRD-K03620381-001-01-4	Broad Institute of MIT and Harvard	BRD-K03620381			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m1/s1	VMJMIMLZIZXOHC-VVBPWWLESA-N	479.18901998							122547
BRD-K88261861	LSM-33991		54632775	InChI=1S/C27H43N3O5/c1-6-7-26(31)28-22-8-9-23-24(14-22)35-18-20(3)30(16-21-10-12-34-13-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h8-9,14,19-21,25H,6-7,10-13,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	NJXMLEPFNXRBQS-WZOHSFFVSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CC3CCOCC3)[C@H](C)COc2c1	BroadT	BRD-K88261861	BRD-K88261861-001-01-4	Broad Institute of MIT and Harvard	BRD-K88261861			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CCOCC3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O5/c1-6-7-26(31)28-22-8-9-23-24(14-22)35-18-20(3)30(16-21-10-12-34-13-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h8-9,14,19-21,25H,6-7,10-13,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m0/s1	NJXMLEPFNXRBQS-WZOHSFFVSA-N	489.320271506							122548
BRD-K13006766	LSM-33992		54632695	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m0/s1	IASRPSUKVFSJOB-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K13006766	BRD-K13006766-001-01-9	Broad Institute of MIT and Harvard	BRD-K13006766			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m0/s1	IASRPSUKVFSJOB-HOOSLVGPSA-N	469.25767125							122549
BRD-K23975481	LSM-33993		54632768	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,26-/m1/s1	DKSPUDZDLBRLRD-BVFVYWQFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc4ccccn4)C[C@H]1C	BroadT	BRD-K23975481	BRD-K23975481-001-01-7	Broad Institute of MIT and Harvard	BRD-K23975481			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,26-/m1/s1	DKSPUDZDLBRLRD-BVFVYWQFSA-N	494.289305736							122550
BRD-K22974051	LSM-33994		54632829	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,25-/m0/s1	BRQCDNWRPXIVHI-RLSLOFABSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K22974051	BRD-K22974051-001-01-1	Broad Institute of MIT and Harvard	BRD-K22974051			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,25-/m0/s1	BRQCDNWRPXIVHI-RLSLOFABSA-N	528.27702649							122551
BRD-K66117405	LSM-33995		54632834	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23-/m1/s1	UUOIXUNLVHGQEP-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CC3CC3	BroadT	BRD-K66117405	BRD-K66117405-001-01-7	Broad Institute of MIT and Harvard	BRD-K66117405			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23-/m1/s1	UUOIXUNLVHGQEP-IEGUWTFLSA-N	488.29987042							122552
BRD-K26148421	LSM-33996		54632691	InChI=1S/C27H39N3O6/c1-17-14-30(26(32)20-9-11-35-12-10-20)18(2)16-36-23-8-7-21(28-25(31)19-5-6-19)13-22(23)27(33)29(3)15-24(17)34-4/h7-8,13,17-20,24H,5-6,9-12,14-16H2,1-4H3,(H,28,31)/t17-,18-,24-/m1/s1	GAPZQUHMQDIXFX-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CCOCC4	BroadT	BRD-K26148421	BRD-K26148421-001-01-1	Broad Institute of MIT and Harvard	BRD-K26148421			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCOCC1	InChI=1S/C27H39N3O6/c1-17-14-30(26(32)20-9-11-35-12-10-20)18(2)16-36-23-8-7-21(28-25(31)19-5-6-19)13-22(23)27(33)29(3)15-24(17)34-4/h7-8,13,17-20,24H,5-6,9-12,14-16H2,1-4H3,(H,28,31)/t17-,18-,24-/m1/s1	GAPZQUHMQDIXFX-QZTZHPFYSA-N	501.283885998							122553
BRD-K44622259	LSM-33997		54632652	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-13-21(27-19(3)30)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m1/s1	YAGNFVDOBCIATK-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c3ccccc3	BroadT	BRD-K44622259	BRD-K44622259-001-01-0	Broad Institute of MIT and Harvard	BRD-K44622259			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-13-21(27-19(3)30)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18-,24+/m1/s1	YAGNFVDOBCIATK-GGUMNFRJSA-N	467.242021186							122554
BRD-K64860451	LSM-33998		54632685	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-16-23(13-14-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-9-8-12-25(15-22)38-24-10-6-5-7-11-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28-/m1/s1	XTWYRSBCEBGZBY-UMQWNRPGSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(Oc4ccccc4)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K64860451	BRD-K64860451-001-01-7	Broad Institute of MIT and Harvard	BRD-K64860451			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(Oc4ccccc4)c3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-16-23(13-14-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-9-8-12-25(15-22)38-24-10-6-5-7-11-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28-/m1/s1	XTWYRSBCEBGZBY-UMQWNRPGSA-N	517.25767125							122555
BRD-K16791544	LSM-33999		54632749	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-9-11-28-12-10-20)18(2)16-36-23-13-21(29-25(32)19-5-6-19)7-8-22(23)27(34)30(3)15-24(17)35-4/h7-13,17-19,24H,5-6,14-16H2,1-4H3,(H,29,32)/t17-,18+,24-/m1/s1	YAZRVZYRDGQLIX-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccncc4	BroadT	BRD-K16791544	BRD-K16791544-001-01-2	Broad Institute of MIT and Harvard	BRD-K16791544			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccncc1	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-9-11-28-12-10-20)18(2)16-36-23-13-21(29-25(32)19-5-6-19)7-8-22(23)27(34)30(3)15-24(17)35-4/h7-13,17-19,24H,5-6,14-16H2,1-4H3,(H,29,32)/t17-,18+,24-/m1/s1	YAZRVZYRDGQLIX-NXMSCROESA-N	494.252920228							122556
BRD-K22789469	LSM-34000		54632723	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22+/m1/s1	CBWRNOSECAFSLQ-FGSXEWAUSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@@H]1C)OC	BroadT	BRD-K22789469	BRD-K22789469-001-01-9	Broad Institute of MIT and Harvard	BRD-K22789469			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22+/m1/s1	CBWRNOSECAFSLQ-FGSXEWAUSA-N	433.294056758							122557
BRD-K37774987	LSM-34001		54632569	InChI=1S/C27H43N3O5/c1-6-7-26(31)28-22-8-9-23-24(14-22)35-18-20(3)30(16-21-10-12-34-13-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h8-9,14,19-21,25H,6-7,10-13,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	NJXMLEPFNXRBQS-FHAGJXEFSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CC3CCOCC3)[C@H](C)COc2c1	BroadT	BRD-K37774987	BRD-K37774987-001-01-7	Broad Institute of MIT and Harvard	BRD-K37774987			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CCOCC3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O5/c1-6-7-26(31)28-22-8-9-23-24(14-22)35-18-20(3)30(16-21-10-12-34-13-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h8-9,14,19-21,25H,6-7,10-13,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m1/s1	NJXMLEPFNXRBQS-FHAGJXEFSA-N	489.320271506							122558
BRD-K22874335	LSM-34002		54632771	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,25-/m0/s1	BRQCDNWRPXIVHI-DFIYOIEZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K22874335	BRD-K22874335-001-01-1	Broad Institute of MIT and Harvard	BRD-K22874335			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,25-/m0/s1	BRQCDNWRPXIVHI-DFIYOIEZSA-N	528.27702649							122559
BRD-K37356599	LSM-34003		54632567	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-9-11-28-12-10-20)18(2)16-36-23-13-21(29-25(32)19-5-6-19)7-8-22(23)27(34)30(3)15-24(17)35-4/h7-13,17-19,24H,5-6,14-16H2,1-4H3,(H,29,32)/t17-,18+,24+/m1/s1	YAZRVZYRDGQLIX-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccncc4	BroadT	BRD-K37356599	BRD-K37356599-001-01-3	Broad Institute of MIT and Harvard	BRD-K37356599			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccncc1	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-9-11-28-12-10-20)18(2)16-36-23-13-21(29-25(32)19-5-6-19)7-8-22(23)27(34)30(3)15-24(17)35-4/h7-13,17-19,24H,5-6,14-16H2,1-4H3,(H,29,32)/t17-,18+,24+/m1/s1	YAZRVZYRDGQLIX-YTZAWJCFSA-N	494.252920228							122560
BRD-K63987422	LSM-34004		54632560	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15+,21-/m0/s1	TWDPSDBESUIWDD-ZSDSOXJFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K63987422	BRD-K63987422-001-01-5	Broad Institute of MIT and Harvard	BRD-K63987422			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15+,21-/m0/s1	TWDPSDBESUIWDD-ZSDSOXJFSA-N	473.26381927							122561
BRD-K27807469	LSM-34005		54632575	InChI=1S/C27H39N3O6/c1-17-14-30(26(32)20-9-11-35-12-10-20)18(2)16-36-23-8-7-21(28-25(31)19-5-6-19)13-22(23)27(33)29(3)15-24(17)34-4/h7-8,13,17-20,24H,5-6,9-12,14-16H2,1-4H3,(H,28,31)/t17-,18+,24-/m0/s1	GAPZQUHMQDIXFX-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C4CCOCC4	BroadT	BRD-K27807469	BRD-K27807469-001-01-4	Broad Institute of MIT and Harvard	BRD-K27807469			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C1CCOCC1	InChI=1S/C27H39N3O6/c1-17-14-30(26(32)20-9-11-35-12-10-20)18(2)16-36-23-8-7-21(28-25(31)19-5-6-19)13-22(23)27(33)29(3)15-24(17)34-4/h7-8,13,17-20,24H,5-6,9-12,14-16H2,1-4H3,(H,28,31)/t17-,18+,24-/m0/s1	GAPZQUHMQDIXFX-RHGYRFJNSA-N	501.283885998							122562
BRD-K81657242	LSM-34006		54632578	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-23-11-10-20(13-22(23)25(31)30(4)15-24(17)34-6)28-26(32)27-19-8-7-9-21(12-19)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24-/m0/s1	XDWPDFGHDYXRAH-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K81657242	BRD-K81657242-001-01-0	Broad Institute of MIT and Harvard	BRD-K81657242			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-23-11-10-20(13-22(23)25(31)30(4)15-24(17)34-6)28-26(32)27-19-8-7-9-21(12-19)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24-/m0/s1	XDWPDFGHDYXRAH-RHGYRFJNSA-N	484.268570292							122563
BRD-K52842821	LSM-34007		54632785	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18+,25-/m0/s1	UYGLFTDABBDOCR-ATLLOTDBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K52842821	BRD-K52842821-001-01-2	Broad Institute of MIT and Harvard	BRD-K52842821			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1F	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18+,25-/m0/s1	UYGLFTDABBDOCR-ATLLOTDBSA-N	511.248249418							122564
BRD-K75840180	LSM-34008		54632665	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18-,23-/m1/s1	MQBPYFVBIBWVKN-PMAPCBKXSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC3CC3	BroadT	BRD-K75840180	BRD-K75840180-001-01-4	Broad Institute of MIT and Harvard	BRD-K75840180			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC1CC1	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18-,23-/m1/s1	MQBPYFVBIBWVKN-PMAPCBKXSA-N	473.288971378							122565
BRD-K36228696	LSM-34009		54632840	InChI=1S/C25H37N3O6/c1-16-12-28(24(30)10-18-6-7-18)17(2)14-34-21-11-19(26-23(29)15-32-4)8-9-20(21)25(31)27(3)13-22(16)33-5/h8-9,11,16-18,22H,6-7,10,12-15H2,1-5H3,(H,26,29)/t16-,17+,22-/m1/s1	GTQGGUJFCSCMSO-HYFFOGBASA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K36228696	BRD-K36228696-001-01-7	Broad Institute of MIT and Harvard	BRD-K36228696			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O6/c1-16-12-28(24(30)10-18-6-7-18)17(2)14-34-21-11-19(26-23(29)15-32-4)8-9-20(21)25(31)27(3)13-22(16)33-5/h8-9,11,16-18,22H,6-7,10,12-15H2,1-5H3,(H,26,29)/t16-,17+,22-/m1/s1	GTQGGUJFCSCMSO-HYFFOGBASA-N	475.268235934							122566
CHEMBL3184746	LSM-34010	BRD-K19439787	54632762	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28+/m0/s1	HUDWACAATGSXNV-BALWLHIASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K19439787	BRD-K19439787-001-01-1	Broad Institute of MIT and Harvard	BRD-K19439787			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28+/m0/s1	HUDWACAATGSXNV-BALWLHIASA-N	517.25767125							122567
BRD-K07988588	LSM-34011		54632823	InChI=1S/C27H43N3O5/c1-6-7-26(31)28-22-8-9-23-24(14-22)35-18-20(3)30(16-21-10-12-34-13-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h8-9,14,19-21,25H,6-7,10-13,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	NJXMLEPFNXRBQS-RNHFSVANSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(CC3CCOCC3)[C@@H](C)COc2c1	BroadT	BRD-K07988588	BRD-K07988588-001-01-2	Broad Institute of MIT and Harvard	BRD-K07988588			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CCOCC3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O5/c1-6-7-26(31)28-22-8-9-23-24(14-22)35-18-20(3)30(16-21-10-12-34-13-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h8-9,14,19-21,25H,6-7,10-13,15-18H2,1-5H3,(H,28,31)/t19-,20+,25+/m1/s1	NJXMLEPFNXRBQS-RNHFSVANSA-N	489.320271506							122568
BRD-K24533571	LSM-34012		54632815	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28-/m0/s1	SLSVJKSFTBBFSH-TYPXCFOJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc4cccnc4)C[C@@H]1C	BroadT	BRD-K24533571	BRD-K24533571-001-01-4	Broad Institute of MIT and Harvard	BRD-K24533571			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28-/m0/s1	SLSVJKSFTBBFSH-TYPXCFOJSA-N	552.240640982							122569
BRD-K97047764	LSM-34013		54632618	InChI=1S/C24H34N4O4S/c1-6-22(29)26-18-7-8-19-20(11-18)32-15-17(3)28(14-23-25-9-10-33-23)12-16(2)21(31-5)13-27(4)24(19)30/h7-11,16-17,21H,6,12-15H2,1-5H3,(H,26,29)/t16-,17-,21+/m1/s1	AIGQWRJTRGZNLS-LZJOCLMNSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3nccs3)[C@H](C)COc2c1	BroadT	BRD-K97047764	BRD-K97047764-001-01-4	Broad Institute of MIT and Harvard	BRD-K97047764			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3nccs3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C24H34N4O4S/c1-6-22(29)26-18-7-8-19-20(11-18)32-15-17(3)28(14-23-25-9-10-33-23)12-16(2)21(31-5)13-27(4)24(19)30/h7-11,16-17,21H,6,12-15H2,1-5H3,(H,26,29)/t16-,17-,21+/m1/s1	AIGQWRJTRGZNLS-LZJOCLMNSA-N	474.230076298							122570
BRD-K20026212	LSM-34014		54632724	InChI=1S/C23H32N4O5/c1-14-11-26(4)15(2)13-31-20-10-17(24-22(28)19-9-16(3)32-25-19)7-8-18(20)23(29)27(5)12-21(14)30-6/h7-10,14-15,21H,11-13H2,1-6H3,(H,24,28)/t14-,15+,21-/m1/s1	SSJRVKKQRIQXRQ-LRAJWGHMSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K20026212	BRD-K20026212-001-01-8	Broad Institute of MIT and Harvard	BRD-K20026212			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C23H32N4O5/c1-14-11-26(4)15(2)13-31-20-10-17(24-22(28)19-9-16(3)32-25-19)7-8-18(20)23(29)27(5)12-21(14)30-6/h7-10,14-15,21H,11-13H2,1-6H3,(H,24,28)/t14-,15+,21-/m1/s1	SSJRVKKQRIQXRQ-LRAJWGHMSA-N	444.237270164							122571
BRD-K72753750	LSM-34015		54632681	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18+,25+/m1/s1	UYGLFTDABBDOCR-UZEJHQAJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K72753750	BRD-K72753750-001-01-2	Broad Institute of MIT and Harvard	BRD-K72753750			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1F	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18+,25+/m1/s1	UYGLFTDABBDOCR-UZEJHQAJSA-N	511.248249418							122572
BRD-K95014129	LSM-34016		54632720	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m0/s1	DUFFUDYVDPDMOF-MFEFFIJZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K95014129	BRD-K95014129-001-01-6	Broad Institute of MIT and Harvard	BRD-K95014129			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23-/m0/s1	DUFFUDYVDPDMOF-MFEFFIJZSA-N	470.252920228							122573
BRD-K95852319	LSM-34017		54632741	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	MAKKLZBPABPJBZ-IECBHUPTSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCC3	BroadT	BRD-K95852319	BRD-K95852319-001-01-9	Broad Institute of MIT and Harvard	BRD-K95852319			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCC1	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	MAKKLZBPABPJBZ-IECBHUPTSA-N	487.304621442							122574
BRD-K30365768	LSM-34018		54632802	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	MAKKLZBPABPJBZ-AXHZCLLHSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCC3	BroadT	BRD-K30365768	BRD-K30365768-001-01-6	Broad Institute of MIT and Harvard	BRD-K30365768			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCC1	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	MAKKLZBPABPJBZ-AXHZCLLHSA-N	487.304621442							122575
BRD-K24748087	LSM-34019		54632848	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-9-11-28-12-10-20)18(2)16-36-23-13-21(29-25(32)19-5-6-19)7-8-22(23)27(34)30(3)15-24(17)35-4/h7-13,17-19,24H,5-6,14-16H2,1-4H3,(H,29,32)/t17-,18+,24+/m0/s1	YAZRVZYRDGQLIX-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c4ccncc4	BroadT	BRD-K24748087	BRD-K24748087-001-01-5	Broad Institute of MIT and Harvard	BRD-K24748087			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccncc1	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-9-11-28-12-10-20)18(2)16-36-23-13-21(29-25(32)19-5-6-19)7-8-22(23)27(34)30(3)15-24(17)35-4/h7-13,17-19,24H,5-6,14-16H2,1-4H3,(H,29,32)/t17-,18+,24+/m0/s1	YAZRVZYRDGQLIX-HOOSLVGPSA-N	494.252920228							122576
BRD-K79538811	LSM-34020		54632554	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17-,21-/m0/s1	QGILEVYYFFUMMM-FIKGOQFSSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K79538811	BRD-K79538811-001-01-7	Broad Institute of MIT and Harvard	BRD-K79538811			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17-,21-/m0/s1	QGILEVYYFFUMMM-FIKGOQFSSA-N	561.223274528							122577
BRD-K29863828	LSM-34021		54632733	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,26+/m0/s1	DKSPUDZDLBRLRD-OUDXUNEISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc4ccccn4)C[C@@H]1C	BroadT	BRD-K29863828	BRD-K29863828-001-01-1	Broad Institute of MIT and Harvard	BRD-K29863828			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,26+/m0/s1	DKSPUDZDLBRLRD-OUDXUNEISA-N	494.289305736							122578
BRD-K76900919	LSM-34022		54632687	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18+,23+/m0/s1	OBNHYLURRDQSSE-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CC3CC3)C[C@@H]1C	BroadT	BRD-K76900919	BRD-K76900919-001-01-3	Broad Institute of MIT and Harvard	BRD-K76900919			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18+,23+/m0/s1	OBNHYLURRDQSSE-YZZKKUAISA-N	460.3049558							122579
BRD-K23317899	LSM-34023		54632657	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17+,21-/m0/s1	QGILEVYYFFUMMM-FVJLSDCUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K23317899	BRD-K23317899-001-01-8	Broad Institute of MIT and Harvard	BRD-K23317899			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17+,21-/m0/s1	QGILEVYYFFUMMM-FVJLSDCUSA-N	561.223274528							122580
BRD-K24108193	LSM-34024		54632770	InChI=1S/C29H37N3O6/c1-18-14-32(15-21-7-5-6-8-23(21)29(35)36)19(2)17-38-25-12-11-22(30-27(33)20-9-10-20)13-24(25)28(34)31(3)16-26(18)37-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)(H,35,36)/t18-,19-,26-/m1/s1	SNXFSFUYNCNHBP-LJKQEARRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc4ccccc4C(=O)O)C[C@H]1C	BroadT	BRD-K24108193	BRD-K24108193-001-01-3	Broad Institute of MIT and Harvard	BRD-K24108193			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc2ccccc2C(O)=O)C[C@H]1C	InChI=1S/C29H37N3O6/c1-18-14-32(15-21-7-5-6-8-23(21)29(35)36)19(2)17-38-25-12-11-22(30-27(33)20-9-10-20)13-24(25)28(34)31(3)16-26(18)37-4/h5-8,11-13,18-20,26H,9-10,14-17H2,1-4H3,(H,30,33)(H,35,36)/t18-,19-,26-/m1/s1	SNXFSFUYNCNHBP-LJKQEARRSA-N	523.268235934							122581
BRD-K06837383	LSM-34025		54632675	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18+,23+/m0/s1	MQBPYFVBIBWVKN-YZZKKUAISA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC3CC3	BroadT	BRD-K06837383	BRD-K06837383-001-01-9	Broad Institute of MIT and Harvard	BRD-K06837383			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC1CC1	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18+,23+/m0/s1	MQBPYFVBIBWVKN-YZZKKUAISA-N	473.288971378							122582
BRD-K12097074	LSM-34026		54632726	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28+/m1/s1	SLSVJKSFTBBFSH-XJGOYTCSSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K12097074	BRD-K12097074-001-01-6	Broad Institute of MIT and Harvard	BRD-K12097074			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28+/m1/s1	SLSVJKSFTBBFSH-XJGOYTCSSA-N	552.240640982							122583
BRD-K92569554	LSM-34027		54632742	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-8-9-20)19(2)17-35-24-13-21(29-26(32)23-7-5-6-12-28-23)10-11-22(24)27(33)30(3)16-25(18)34-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,29,32)/t18-,19-,25-/m1/s1	FIIFFUFNKKXCFL-MPCDZSKCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K92569554	BRD-K92569554-001-01-6	Broad Institute of MIT and Harvard	BRD-K92569554			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccccn3)cc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C27H36N4O4/c1-18-14-31(15-20-8-9-20)19(2)17-35-24-13-21(29-26(32)23-7-5-6-12-28-23)10-11-22(24)27(33)30(3)16-25(18)34-4/h5-7,10-13,18-20,25H,8-9,14-17H2,1-4H3,(H,29,32)/t18-,19-,25-/m1/s1	FIIFFUFNKKXCFL-MPCDZSKCSA-N	480.273655672							122584
BRD-K34405227	LSM-34028		54632865	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13-,18-/m0/s1	RENPXZBPSBTSHX-LXIYXOSZSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K34405227	BRD-K34405227-001-01-1	Broad Institute of MIT and Harvard	BRD-K34405227			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13-,18-/m0/s1	RENPXZBPSBTSHX-LXIYXOSZSA-N	363.215806438							122585
BRD-K71600285	LSM-34029		54632855	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20-,25+/m1/s1	VUNNIGMMXHQHNM-FHAGJXEFSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCCC3	BroadT	BRD-K71600285	BRD-K71600285-001-01-0	Broad Institute of MIT and Harvard	BRD-K71600285			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCCC1	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20-,25+/m1/s1	VUNNIGMMXHQHNM-FHAGJXEFSA-N	516.331170548							122586
BRD-K65379489	LSM-34030		54632713	InChI=1S/C25H37N3O6/c1-16-12-28(24(30)10-18-6-7-18)17(2)14-34-21-11-19(26-23(29)15-32-4)8-9-20(21)25(31)27(3)13-22(16)33-5/h8-9,11,16-18,22H,6-7,10,12-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m1/s1	GTQGGUJFCSCMSO-YVHKJVDXSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K65379489	BRD-K65379489-001-01-3	Broad Institute of MIT and Harvard	BRD-K65379489			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O6/c1-16-12-28(24(30)10-18-6-7-18)17(2)14-34-21-11-19(26-23(29)15-32-4)8-9-20(21)25(31)27(3)13-22(16)33-5/h8-9,11,16-18,22H,6-7,10,12-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m1/s1	GTQGGUJFCSCMSO-YVHKJVDXSA-N	475.268235934							122587
BRD-K02959126	LSM-34031		54632847	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24+/m1/s1	PGRNYZHGQKBFKV-OJLQRUNKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K02959126	BRD-K02959126-001-01-7	Broad Institute of MIT and Harvard	BRD-K02959126			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24+/m1/s1	PGRNYZHGQKBFKV-OJLQRUNKSA-N	500.243498396							122588
BRD-K61950712	LSM-34032		54632676	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20+,25+/m1/s1	VUNNIGMMXHQHNM-RNHFSVANSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCCC3	BroadT	BRD-K61950712	BRD-K61950712-001-01-4	Broad Institute of MIT and Harvard	BRD-K61950712			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCCC1	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20+,25+/m1/s1	VUNNIGMMXHQHNM-RNHFSVANSA-N	516.331170548							122589
BRD-K35219796	LSM-34033		54632750	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20-,25-/m1/s1	OXTPNGYEOOIGNP-UMEGOILYSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccn3)[C@H](C)COc2c1	BroadT	BRD-K35219796	BRD-K35219796-001-01-6	Broad Institute of MIT and Harvard	BRD-K35219796			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccn3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20-,25-/m1/s1	OXTPNGYEOOIGNP-UMEGOILYSA-N	482.289305736							122590
BRD-K97054359	LSM-34034		54632858	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24+/m0/s1	PGRNYZHGQKBFKV-WOGXIUBCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K97054359	BRD-K97054359-001-01-1	Broad Institute of MIT and Harvard	BRD-K97054359			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24+/m0/s1	PGRNYZHGQKBFKV-WOGXIUBCSA-N	500.243498396							122591
BRD-K93055775	LSM-34035		54632655	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18-,23-/m1/s1	OBNHYLURRDQSSE-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CC3CC3)C[C@H]1C	BroadT	BRD-K93055775	BRD-K93055775-001-01-8	Broad Institute of MIT and Harvard	BRD-K93055775			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18-,23-/m1/s1	OBNHYLURRDQSSE-PMAPCBKXSA-N	460.3049558							122592
BRD-K64200854	LSM-34036		54632671	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18+,23+/m1/s1	MQBPYFVBIBWVKN-STSQHVNTSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC3CC3	BroadT	BRD-K64200854	BRD-K64200854-001-01-9	Broad Institute of MIT and Harvard	BRD-K64200854			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)CC1CC1	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18+,23+/m1/s1	MQBPYFVBIBWVKN-STSQHVNTSA-N	473.288971378							122593
BRD-K38450726	LSM-34037		54632612	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17-,21-/m0/s1	HECXZILGRZYZSJ-FIKGOQFSSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K38450726	BRD-K38450726-001-01-9	Broad Institute of MIT and Harvard	BRD-K38450726			CCCC(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17-,21-/m0/s1	HECXZILGRZYZSJ-FIKGOQFSSA-N	487.265791262							122594
BRD-K11355500	LSM-34038		54632816	InChI=1S/C23H32N4O5/c1-14-11-26(4)15(2)13-31-20-10-17(24-22(28)19-9-16(3)32-25-19)7-8-18(20)23(29)27(5)12-21(14)30-6/h7-10,14-15,21H,11-13H2,1-6H3,(H,24,28)/t14-,15+,21-/m0/s1	SSJRVKKQRIQXRQ-ZSDSOXJFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K11355500	BRD-K11355500-001-01-3	Broad Institute of MIT and Harvard	BRD-K11355500			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C23H32N4O5/c1-14-11-26(4)15(2)13-31-20-10-17(24-22(28)19-9-16(3)32-25-19)7-8-18(20)23(29)27(5)12-21(14)30-6/h7-10,14-15,21H,11-13H2,1-6H3,(H,24,28)/t14-,15+,21-/m0/s1	SSJRVKKQRIQXRQ-ZSDSOXJFSA-N	444.237270164							122595
CHEMBL2132341	LSM-34039	SID131428835, BRD-K33767317	54632586	InChI=1S/C25H32N4O6/c1-15-11-26-16(2)13-33-21-9-17(5-7-19(21)24(30)29(3)12-23(15)32-4)27-25(31)28-18-6-8-20-22(10-18)35-14-34-20/h5-10,15-16,23,26H,11-14H2,1-4H3,(H2,27,28,31)/t15-,16+,23-/m0/s1	SLXXNDOTBOUXJA-PXAQALGRSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K33767317	BRD-K33767317-001-01-6	Broad Institute of MIT and Harvard	BRD-K33767317			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H32N4O6/c1-15-11-26-16(2)13-33-21-9-17(5-7-19(21)24(30)29(3)12-23(15)32-4)27-25(31)28-18-6-8-20-22(10-18)35-14-34-20/h5-10,15-16,23,26H,11-14H2,1-4H3,(H2,27,28,31)/t15-,16+,23-/m0/s1	SLXXNDOTBOUXJA-PXAQALGRSA-N	484.232184784							122596
BRD-K37387086	LSM-34040		54632630	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	MAKKLZBPABPJBZ-GLDPYIMESA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCC3	BroadT	BRD-K37387086	BRD-K37387086-001-01-8	Broad Institute of MIT and Harvard	BRD-K37387086			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCC1	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	MAKKLZBPABPJBZ-GLDPYIMESA-N	487.304621442							122597
BRD-K32466161	LSM-34041		54632620	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)32-13-16(4)26(33(7,29)30)11-15(3)20(31-6)12-25(5)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20-/m1/s1	PQUFACNXJQCPAH-JXXFODFXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K32466161	BRD-K32466161-001-01-3	Broad Institute of MIT and Harvard	BRD-K32466161			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C22H36N4O6S/c1-14(2)23-22(28)24-17-8-9-18-19(10-17)32-13-16(4)26(33(7,29)30)11-15(3)20(31-6)12-25(5)21(18)27/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16-,20-/m1/s1	PQUFACNXJQCPAH-JXXFODFXSA-N	484.235555602							122598
BRD-K48408514	LSM-34042		54632638	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,25-/m1/s1	BRQCDNWRPXIVHI-OHUGHZGNSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K48408514	BRD-K48408514-001-01-1	Broad Institute of MIT and Harvard	BRD-K48408514			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,25-/m1/s1	BRQCDNWRPXIVHI-OHUGHZGNSA-N	528.27702649							122599
BRD-K29723347	LSM-34043		54632735	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22-,28-/m1/s1	NCAOWLICBBXJJW-DQCZWYHMSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K29723347	BRD-K29723347-001-01-9	Broad Institute of MIT and Harvard	BRD-K29723347			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22-,28-/m1/s1	NCAOWLICBBXJJW-DQCZWYHMSA-N	522.320605864							122600
BRD-K99525048	LSM-34044		54632564	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-7-6-14(20-27(5,23)24)8-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13+,17-/m1/s1	BVSUEIBBWDYHCK-IIYDPXPESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K99525048	BRD-K99525048-001-01-5	Broad Institute of MIT and Harvard	BRD-K99525048			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-7-6-14(20-27(5,23)24)8-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13+,17-/m1/s1	BVSUEIBBWDYHCK-IIYDPXPESA-N	399.182791748							122601
BRD-K62306795	LSM-34045		54632579	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16+,21+/m0/s1	FGFJNWQPGUBCRY-GCKMJXCFSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)C	BroadT	BRD-K62306795	BRD-K62306795-001-01-8	Broad Institute of MIT and Harvard	BRD-K62306795			CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16+,21+/m0/s1	FGFJNWQPGUBCRY-GCKMJXCFSA-N	448.268570292							122602
BRD-K83470183	LSM-34046		54632619	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28+/m0/s1	HUDWACAATGSXNV-YHGPEZAFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K83470183	BRD-K83470183-001-01-7	Broad Institute of MIT and Harvard	BRD-K83470183			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28+/m0/s1	HUDWACAATGSXNV-YHGPEZAFSA-N	517.25767125							122603
BRD-K54212583	LSM-34047		54632822	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22-,28+/m0/s1	NCAOWLICBBXJJW-RXYILKCJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H](C)N(Cc4cccnc4)C[C@@H]1C	BroadT	BRD-K54212583	BRD-K54212583-001-01-4	Broad Institute of MIT and Harvard	BRD-K54212583			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22-,28+/m0/s1	NCAOWLICBBXJJW-RXYILKCJSA-N	522.320605864							122604
BRD-K70618663	LSM-34048		54632559	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15-,21-/m0/s1	TWDPSDBESUIWDD-GXZWQRSESA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K70618663	BRD-K70618663-001-01-5	Broad Institute of MIT and Harvard	BRD-K70618663			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15-,21-/m0/s1	TWDPSDBESUIWDD-GXZWQRSESA-N	473.26381927							122605
BRD-K39460811	LSM-34049		54632764	InChI=1S/C24H32N4O6/c1-6-22(29)28-12-15(2)21(32-5)13-27(4)24(31)18-11-17(7-8-19(18)33-14-16(28)3)26-23(30)20-9-10-25-34-20/h7-11,15-16,21H,6,12-14H2,1-5H3,(H,26,30)/t15-,16+,21-/m1/s1	UHTLRATWDOHEGX-VWKPWSFCSA-N	CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3oncc3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K39460811	BRD-K39460811-001-01-3	Broad Institute of MIT and Harvard	BRD-K39460811			CCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)c3ccno3)ccc2OC[C@@H]1C)OC	InChI=1S/C24H32N4O6/c1-6-22(29)28-12-15(2)21(32-5)13-27(4)24(31)18-11-17(7-8-19(18)33-14-16(28)3)26-23(30)20-9-10-25-34-20/h7-11,15-16,21H,6,12-14H2,1-5H3,(H,26,30)/t15-,16+,21-/m1/s1	UHTLRATWDOHEGX-VWKPWSFCSA-N	472.232184784							122606
BRD-K35873184	LSM-34050		54632633	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28+/m0/s1	SLSVJKSFTBBFSH-RXYILKCJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc4cccnc4)C[C@@H]1C	BroadT	BRD-K35873184	BRD-K35873184-001-01-0	Broad Institute of MIT and Harvard	BRD-K35873184			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28+/m0/s1	SLSVJKSFTBBFSH-RXYILKCJSA-N	552.240640982							122607
BRD-K28510065	LSM-34051		54632668	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-8-7-16(21-15(3)24)9-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14-,19-/m1/s1	VZXWWTHKMGUIJI-PJIJBLCYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K28510065	BRD-K28510065-001-01-1	Broad Institute of MIT and Harvard	BRD-K28510065			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-8-7-16(21-15(3)24)9-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14-,19-/m1/s1	VZXWWTHKMGUIJI-PJIJBLCYSA-N	441.193356432							122608
BRD-K86453556	LSM-34052		54632683	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17-,22-/m0/s1	WEZMNWQXUMSVMO-HOIFWPIMSA-N	COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K86453556	BRD-K86453556-001-01-9	Broad Institute of MIT and Harvard	BRD-K86453556			COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17-,22-/m0/s1	WEZMNWQXUMSVMO-HOIFWPIMSA-N	475.268235934							122609
BRD-K70533622	LSM-34053		54632754	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22+,28+/m1/s1	NCAOWLICBBXJJW-WENCSYSZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K70533622	BRD-K70533622-001-01-6	Broad Institute of MIT and Harvard	BRD-K70533622			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22+,28+/m1/s1	NCAOWLICBBXJJW-WENCSYSZSA-N	522.320605864							122610
BRD-K86229759	LSM-34054		54632781	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m1/s1	IASRPSUKVFSJOB-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K86229759	BRD-K86229759-001-01-8	Broad Institute of MIT and Harvard	BRD-K86229759			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m1/s1	IASRPSUKVFSJOB-YTZAWJCFSA-N	469.25767125							122611
BRD-K20895937	LSM-34055		54632844	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)28-13-16(3)21(32-6)14-27(5)23(30)19-10-9-18(26-22(29)8-2)12-20(19)33-15-17(28)4/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H,25,31)(H,26,29)/t16-,17-,21+/m1/s1	WYILBQVQDSLHTR-LZJOCLMNSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CC)cc2OC[C@H]1C)OC	BroadT	BRD-K20895937	BRD-K20895937-001-01-0	Broad Institute of MIT and Harvard	BRD-K20895937			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CC)cc2OC[C@H]1C)OC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)28-13-16(3)21(32-6)14-27(5)23(30)19-10-9-18(26-22(29)8-2)12-20(19)33-15-17(28)4/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H,25,31)(H,26,29)/t16-,17-,21+/m1/s1	WYILBQVQDSLHTR-LZJOCLMNSA-N	462.284220356							122612
BRD-K44167510	LSM-34056		54632570	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18-/m0/s1	RENPXZBPSBTSHX-JCGVRSQUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K44167510	BRD-K44167510-001-01-1	Broad Institute of MIT and Harvard	BRD-K44167510			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18-/m0/s1	RENPXZBPSBTSHX-JCGVRSQUSA-N	363.215806438							122613
BRD-K94801143	LSM-34057		54632699	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17+,22-/m0/s1	WEZMNWQXUMSVMO-JKSBSHDWSA-N	COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	BroadT	BRD-K94801143	BRD-K94801143-001-01-9	Broad Institute of MIT and Harvard	BRD-K94801143			COCC(=O)N1C[C@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17+,22-/m0/s1	WEZMNWQXUMSVMO-JKSBSHDWSA-N	475.268235934							122614
BRD-K57300216	LSM-34058		54632659	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18+/m1/s1	RENPXZBPSBTSHX-VBHSOAQHSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K57300216	BRD-K57300216-001-01-9	Broad Institute of MIT and Harvard	BRD-K57300216			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18+/m1/s1	RENPXZBPSBTSHX-VBHSOAQHSA-N	363.215806438							122615
BRD-K21443215	LSM-34059		54632725	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-8-15(24-32(28,29)12-20(21,22)23)6-7-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14+,18+/m0/s1	PLIZPBUQBLYJFD-PMUMKWKESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K21443215	BRD-K21443215-001-01-1	Broad Institute of MIT and Harvard	BRD-K21443215			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-8-15(24-32(28,29)12-20(21,22)23)6-7-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14+,18+/m0/s1	PLIZPBUQBLYJFD-PMUMKWKESA-N	481.18582638							122616
BRD-K63398969	LSM-34060		54632598	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)28-13-16(3)21(32-6)14-27(5)23(30)19-10-9-18(26-22(29)8-2)12-20(19)33-15-17(28)4/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H,25,31)(H,26,29)/t16-,17+,21+/m1/s1	WYILBQVQDSLHTR-WWMYMODYSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CC)cc2OC[C@@H]1C)OC	BroadT	BRD-K63398969	BRD-K63398969-001-01-4	Broad Institute of MIT and Harvard	BRD-K63398969			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CC)cc2OC[C@@H]1C)OC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)28-13-16(3)21(32-6)14-27(5)23(30)19-10-9-18(26-22(29)8-2)12-20(19)33-15-17(28)4/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H,25,31)(H,26,29)/t16-,17+,21+/m1/s1	WYILBQVQDSLHTR-WWMYMODYSA-N	462.284220356							122617
BRD-K96154586	LSM-34061		54632748	InChI=1S/C26H34N4O6/c1-16-13-30(25(32)18-6-5-7-18)17(2)15-35-22-12-19(28-24(31)21-10-11-27-36-21)8-9-20(22)26(33)29(3)14-23(16)34-4/h8-12,16-18,23H,5-7,13-15H2,1-4H3,(H,28,31)/t16-,17+,23+/m1/s1	LEDDEFHCQXBYIL-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3oncc3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C4CCC4	BroadT	BRD-K96154586	BRD-K96154586-001-01-5	Broad Institute of MIT and Harvard	BRD-K96154586			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccno3)cc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CCC1	InChI=1S/C26H34N4O6/c1-16-13-30(25(32)18-6-5-7-18)17(2)15-35-22-12-19(28-24(31)21-10-11-27-36-21)8-9-20(22)26(33)29(3)14-23(16)34-4/h8-12,16-18,23H,5-7,13-15H2,1-4H3,(H,28,31)/t16-,17+,23+/m1/s1	LEDDEFHCQXBYIL-DGGJZMOXSA-N	498.247834848							122618
BRD-K95845541	LSM-34062		54632819	InChI=1S/C32H39ClN4O5/c1-21-17-37(18-23-10-6-7-11-26(23)33)22(2)20-42-28-15-14-24(16-25(28)31(38)36(3)19-30(21)41-5)34-32(39)35-27-12-8-9-13-29(27)40-4/h6-16,21-22,30H,17-20H2,1-5H3,(H2,34,35,39)/t21-,22-,30-/m1/s1	AGBKMZIZBPHKPY-NPKFRGRUSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)N(Cc4ccccc4Cl)C[C@H]1C	BroadT	BRD-K95845541	BRD-K95845541-001-01-3	Broad Institute of MIT and Harvard	BRD-K95845541			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)N(Cc2ccccc2Cl)C[C@H]1C	InChI=1S/C32H39ClN4O5/c1-21-17-37(18-23-10-6-7-11-26(23)33)22(2)20-42-28-15-14-24(16-25(28)31(38)36(3)19-30(21)41-5)34-32(39)35-27-12-8-9-13-29(27)40-4/h6-16,21-22,30H,17-20H2,1-5H3,(H2,34,35,39)/t21-,22-,30-/m1/s1	AGBKMZIZBPHKPY-NPKFRGRUSA-N	594.260898098							122619
BRD-K31834149	LSM-34063		54632562	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15-,21+/m1/s1	TWDPSDBESUIWDD-PZPWOCDFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K31834149	BRD-K31834149-001-01-0	Broad Institute of MIT and Harvard	BRD-K31834149			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15-,21+/m1/s1	TWDPSDBESUIWDD-PZPWOCDFSA-N	473.26381927							122620
BRD-K87483976-001-01-7	LSM-34064	BRD-K87483976	54632729	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28-/m0/s1	SLSVJKSFTBBFSH-VPYPWEPUSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc4cccnc4)C[C@@H]1C	BroadT	BRD-K87483976	BRD-K87483976-001-01-7	Broad Institute of MIT and Harvard	BRD-K87483976			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28-/m0/s1	SLSVJKSFTBBFSH-VPYPWEPUSA-N	552.240640982							122621
BRD-K46413323	LSM-34065		54632746	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,26-/m0/s1	DKSPUDZDLBRLRD-DYLHXGEVSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc4ccccn4)C[C@@H]1C	BroadT	BRD-K46413323	BRD-K46413323-001-01-4	Broad Institute of MIT and Harvard	BRD-K46413323			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,26-/m0/s1	DKSPUDZDLBRLRD-DYLHXGEVSA-N	494.289305736							122622
BRD-K00191683	LSM-34066		54632608	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)28-13-16(3)21(32-6)14-27(5)23(30)19-10-9-18(26-22(29)8-2)12-20(19)33-15-17(28)4/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H,25,31)(H,26,29)/t16-,17+,21-/m1/s1	WYILBQVQDSLHTR-LLGFUMIMSA-N	CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CC)cc2OC[C@@H]1C)OC	BroadT	BRD-K00191683	BRD-K00191683-001-01-4	Broad Institute of MIT and Harvard	BRD-K00191683			CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CC)cc2OC[C@@H]1C)OC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)28-13-16(3)21(32-6)14-27(5)23(30)19-10-9-18(26-22(29)8-2)12-20(19)33-15-17(28)4/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H,25,31)(H,26,29)/t16-,17+,21-/m1/s1	WYILBQVQDSLHTR-LLGFUMIMSA-N	462.284220356							122623
BRD-K36988621	LSM-34067		54632753	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-7-6-10-27-12-20)19(2)16-35-23-11-21(28-25(31)17-33-4)8-9-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	MONOFYZVTFTEBW-AXHZCLLHSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3cccnc3)[C@@H](C)COc2c1	BroadT	BRD-K36988621	BRD-K36988621-001-01-6	Broad Institute of MIT and Harvard	BRD-K36988621			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3cccnc3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-7-6-10-27-12-20)19(2)16-35-23-11-21(28-25(31)17-33-4)8-9-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m0/s1	MONOFYZVTFTEBW-AXHZCLLHSA-N	484.268570292							122624
BRD-K96250732	LSM-34068		54632682	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20-,25+/m1/s1	OXTPNGYEOOIGNP-FHAGJXEFSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3ccccn3)[C@H](C)COc2c1	BroadT	BRD-K96250732	BRD-K96250732-001-01-4	Broad Institute of MIT and Harvard	BRD-K96250732			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccn3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20-,25+/m1/s1	OXTPNGYEOOIGNP-FHAGJXEFSA-N	482.289305736							122625
BRD-K06859109	LSM-34069		54632731	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23-/m1/s1	UUOIXUNLVHGQEP-PMAPCBKXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC3CC3	BroadT	BRD-K06859109	BRD-K06859109-001-01-6	Broad Institute of MIT and Harvard	BRD-K06859109			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23-/m1/s1	UUOIXUNLVHGQEP-PMAPCBKXSA-N	488.29987042							122626
BRD-K24877937	LSM-34070		54632721	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19-,26+/m1/s1	QXMKZAKCOIHKOR-UDCNLSRBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K24877937	BRD-K24877937-001-01-4	Broad Institute of MIT and Harvard	BRD-K24877937			CO[C@@H]1[C@H](C)CN(CC2CC2)[C@H](C)COc2cc(ccc2C(=O)N(C)C1)NC(=O)c1cccc(F)c1	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19-,26+/m1/s1	QXMKZAKCOIHKOR-UDCNLSRBSA-N	497.268984862							122627
BRD-K87213692	LSM-34071		54632850	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-13-21(27-19(3)30)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m0/s1	YAGNFVDOBCIATK-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c3ccccc3	BroadT	BRD-K87213692	BRD-K87213692-001-01-1	Broad Institute of MIT and Harvard	BRD-K87213692			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-13-21(27-19(3)30)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m0/s1	YAGNFVDOBCIATK-RHGYRFJNSA-N	467.242021186							122628
BRD-K03730769	LSM-34072		54632789	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-7-6-14(20-27(5,23)24)8-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13-,17-/m0/s1	BVSUEIBBWDYHCK-DCGLDWPTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K03730769	BRD-K03730769-001-01-3	Broad Institute of MIT and Harvard	BRD-K03730769			CO[C@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-7-6-14(20-27(5,23)24)8-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13-,17-/m0/s1	BVSUEIBBWDYHCK-DCGLDWPTSA-N	399.182791748							122629
BRD-K02214161	LSM-34073		54632737	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18-,25-/m1/s1	UYGLFTDABBDOCR-QJMRKGMQSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K02214161	BRD-K02214161-001-01-3	Broad Institute of MIT and Harvard	BRD-K02214161			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1F	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18-,25-/m1/s1	UYGLFTDABBDOCR-QJMRKGMQSA-N	511.248249418							122630
BRD-K91645615	LSM-34074		54632648	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,25+/m1/s1	BRQCDNWRPXIVHI-FHAGJXEFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K91645615	BRD-K91645615-001-01-2	Broad Institute of MIT and Harvard	BRD-K91645615			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,25+/m1/s1	BRQCDNWRPXIVHI-FHAGJXEFSA-N	528.27702649							122631
BRD-K08881846	LSM-34075		54632563	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m1/s1	NCKJLHVNZDVZFX-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K08881846	BRD-K08881846-001-01-6	Broad Institute of MIT and Harvard	BRD-K08881846			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m1/s1	NCKJLHVNZDVZFX-YTZAWJCFSA-N	469.25767125							122632
BRD-K43414987	LSM-34076		54632787	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26-/m1/s1	QXMKZAKCOIHKOR-UYXZNNOOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K43414987	BRD-K43414987-001-01-2	Broad Institute of MIT and Harvard	BRD-K43414987			CO[C@H]1[C@H](C)CN(CC2CC2)[C@@H](C)COc2cc(ccc2C(=O)N(C)C1)NC(=O)c1cccc(F)c1	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26-/m1/s1	QXMKZAKCOIHKOR-UYXZNNOOSA-N	497.268984862							122633
BRD-K05041614	LSM-34077		54632707	InChI=1S/C30H41N3O7S/c1-20-6-9-25(10-7-20)41(36,37)33-17-21(2)28(38-5)18-32(4)30(35)26-11-8-24(16-27(26)40-19-22(33)3)31-29(34)23-12-14-39-15-13-23/h6-11,16,21-23,28H,12-15,17-19H2,1-5H3,(H,31,34)/t21-,22-,28-/m1/s1	GVMOHUZBBZUQFC-DQCZWYHMSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c4ccc(C)cc4	BroadT	BRD-K05041614	BRD-K05041614-001-01-0	Broad Institute of MIT and Harvard	BRD-K05041614			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C30H41N3O7S/c1-20-6-9-25(10-7-20)41(36,37)33-17-21(2)28(38-5)18-32(4)30(35)26-11-8-24(16-27(26)40-19-22(33)3)31-29(34)23-12-14-39-15-13-23/h6-11,16,21-23,28H,12-15,17-19H2,1-5H3,(H,31,34)/t21-,22-,28-/m1/s1	GVMOHUZBBZUQFC-DQCZWYHMSA-N	587.266521372							122634
BRD-K26963927	LSM-34078		54632714	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15+,21+/m1/s1	TWDPSDBESUIWDD-WIEQDCTASA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K26963927	BRD-K26963927-001-01-2	Broad Institute of MIT and Harvard	BRD-K26963927			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15+,21+/m1/s1	TWDPSDBESUIWDD-WIEQDCTASA-N	473.26381927							122635
BRD-K76513704	LSM-34079		54632860	InChI=1S/C27H39N3O6/c1-17-14-30(26(32)20-9-11-35-12-10-20)18(2)16-36-23-8-7-21(28-25(31)19-5-6-19)13-22(23)27(33)29(3)15-24(17)34-4/h7-8,13,17-20,24H,5-6,9-12,14-16H2,1-4H3,(H,28,31)/t17-,18-,24+/m1/s1	GAPZQUHMQDIXFX-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CCOCC4	BroadT	BRD-K76513704	BRD-K76513704-001-01-3	Broad Institute of MIT and Harvard	BRD-K76513704			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCOCC1	InChI=1S/C27H39N3O6/c1-17-14-30(26(32)20-9-11-35-12-10-20)18(2)16-36-23-8-7-21(28-25(31)19-5-6-19)13-22(23)27(33)29(3)15-24(17)34-4/h7-8,13,17-20,24H,5-6,9-12,14-16H2,1-4H3,(H,28,31)/t17-,18-,24+/m1/s1	GAPZQUHMQDIXFX-GGUMNFRJSA-N	501.283885998							122636
BRD-K22718522	LSM-34080		54632800	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-8-7-16(21-15(3)24)9-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14+,19+/m1/s1	VZXWWTHKMGUIJI-TYILLQQXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K22718522	BRD-K22718522-001-01-3	Broad Institute of MIT and Harvard	BRD-K22718522			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-8-7-16(21-15(3)24)9-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14+,19+/m1/s1	VZXWWTHKMGUIJI-TYILLQQXSA-N	441.193356432							122637
BRD-K69073492	LSM-34081		54632777	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22-/m1/s1	CBWRNOSECAFSLQ-KGVIQGDOSA-N	CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@@H]1C)OC	BroadT	BRD-K69073492	BRD-K69073492-001-01-3	Broad Institute of MIT and Harvard	BRD-K69073492			CCCN1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22-/m1/s1	CBWRNOSECAFSLQ-KGVIQGDOSA-N	433.294056758							122638
BRD-K33998683	LSM-34082		54632669	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17-,21-/m1/s1	QGILEVYYFFUMMM-CBGDNZLLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K33998683	BRD-K33998683-001-01-3	Broad Institute of MIT and Harvard	BRD-K33998683			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17-,21-/m1/s1	QGILEVYYFFUMMM-CBGDNZLLSA-N	561.223274528							122639
CHEMBL2139987	LSM-34083	BRD-K50150246, SID131428961	54632712	InChI=1S/C25H32N4O6/c1-15-11-26-16(2)13-33-21-9-17(5-7-19(21)24(30)29(3)12-23(15)32-4)27-25(31)28-18-6-8-20-22(10-18)35-14-34-20/h5-10,15-16,23,26H,11-14H2,1-4H3,(H2,27,28,31)/t15-,16+,23+/m0/s1	SLXXNDOTBOUXJA-NXHTTZLHSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K50150246	BRD-K50150246-001-01-9	Broad Institute of MIT and Harvard	BRD-K50150246			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H32N4O6/c1-15-11-26-16(2)13-33-21-9-17(5-7-19(21)24(30)29(3)12-23(15)32-4)27-25(31)28-18-6-8-20-22(10-18)35-14-34-20/h5-10,15-16,23,26H,11-14H2,1-4H3,(H2,27,28,31)/t15-,16+,23+/m0/s1	SLXXNDOTBOUXJA-NXHTTZLHSA-N	484.232184784							122640
BRD-K99558735	LSM-34084		54632697	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m1/s1	NCKJLHVNZDVZFX-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K99558735	BRD-K99558735-001-01-4	Broad Institute of MIT and Harvard	BRD-K99558735			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m1/s1	NCKJLHVNZDVZFX-GGUMNFRJSA-N	469.25767125							122641
BRD-K25710391	LSM-34085		54632863	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23-/m0/s1	DUFFUDYVDPDMOF-QQMNAOGKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K25710391	BRD-K25710391-001-01-5	Broad Institute of MIT and Harvard	BRD-K25710391			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23-/m0/s1	DUFFUDYVDPDMOF-QQMNAOGKSA-N	470.252920228							122642
BRD-K73885376	LSM-34086		54632596	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24-/m1/s1	PGRNYZHGQKBFKV-HOZJOUCCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K73885376	BRD-K73885376-001-01-5	Broad Institute of MIT and Harvard	BRD-K73885376			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24-/m1/s1	PGRNYZHGQKBFKV-HOZJOUCCSA-N	500.243498396							122643
BRD-K77345736	LSM-34087		54632842	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18+,25-/m1/s1	UYGLFTDABBDOCR-FUMQJTLXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K77345736	BRD-K77345736-001-01-1	Broad Institute of MIT and Harvard	BRD-K77345736			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1F	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18+,25-/m1/s1	UYGLFTDABBDOCR-FUMQJTLXSA-N	511.248249418							122644
BRD-K63733257	LSM-34088		54632557	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23+/m1/s1	DUFFUDYVDPDMOF-DGGJZMOXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K63733257	BRD-K63733257-001-01-3	Broad Institute of MIT and Harvard	BRD-K63733257			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23+/m1/s1	DUFFUDYVDPDMOF-DGGJZMOXSA-N	470.252920228							122645
BRD-K68951856	LSM-34089		54632716	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17-,22+/m1/s1	WEZMNWQXUMSVMO-YVHKJVDXSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	BroadT	BRD-K68951856	BRD-K68951856-001-01-1	Broad Institute of MIT and Harvard	BRD-K68951856			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17-,22+/m1/s1	WEZMNWQXUMSVMO-YVHKJVDXSA-N	475.268235934							122646
BRD-K27058632	LSM-34090		54632743	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16+,20+/m0/s1	WSQGAZSPVHYFJA-RZQQEMMASA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)COC	BroadT	BRD-K27058632	BRD-K27058632-001-01-6	Broad Institute of MIT and Harvard	BRD-K27058632			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)COC)c1	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16+,20+/m0/s1	WSQGAZSPVHYFJA-RZQQEMMASA-N	449.25258587							122647
BRD-K76885311	LSM-34091		54632584	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-9-15(20-30(5,24)25)7-8-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m1/s1	JZZOEAQFGXAXSL-QWQRMKEZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K76885311	BRD-K76885311-001-01-0	Broad Institute of MIT and Harvard	BRD-K76885311			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-9-15(20-30(5,24)25)7-8-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m1/s1	JZZOEAQFGXAXSL-QWQRMKEZSA-N	477.160341742							122648
BRD-K59099886	LSM-34092		54632588	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m0/s1	VMJMIMLZIZXOHC-DMPWYTOCSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K59099886	BRD-K59099886-001-01-4	Broad Institute of MIT and Harvard	BRD-K59099886			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m0/s1	VMJMIMLZIZXOHC-DMPWYTOCSA-N	479.18901998							122649
BRD-K70345052	LSM-34093		54632689	InChI=1S/C27H42N4O6/c1-6-7-25(32)28-21-8-9-23-22(14-21)27(34)29(4)16-24(35-5)19(2)15-31(20(3)18-37-23)26(33)17-30-10-12-36-13-11-30/h8-9,14,19-20,24H,6-7,10-13,15-18H2,1-5H3,(H,28,32)/t19-,20-,24-/m1/s1	DTHIKOBEBGZASF-YOSAUDMPSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CN3CCOCC3	BroadT	BRD-K70345052	BRD-K70345052-001-01-4	Broad Institute of MIT and Harvard	BRD-K70345052			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CN1CCOCC1	InChI=1S/C27H42N4O6/c1-6-7-25(32)28-21-8-9-23-22(14-21)27(34)29(4)16-24(35-5)19(2)15-31(20(3)18-37-23)26(33)17-30-10-12-36-13-11-30/h8-9,14,19-20,24H,6-7,10-13,15-18H2,1-5H3,(H,28,32)/t19-,20-,24-/m1/s1	DTHIKOBEBGZASF-YOSAUDMPSA-N	518.310435104							122650
BRD-K26252344	LSM-34094		54632778	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24-/m1/s1	NCKJLHVNZDVZFX-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K26252344	BRD-K26252344-001-01-5	Broad Institute of MIT and Harvard	BRD-K26252344			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24-/m1/s1	NCKJLHVNZDVZFX-QZTZHPFYSA-N	469.25767125							122651
BRD-K68579984	LSM-34095		54632640	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16+,21+/m1/s1	FGFJNWQPGUBCRY-XFQAVAEZSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C	BroadT	BRD-K68579984	BRD-K68579984-001-01-5	Broad Institute of MIT and Harvard	BRD-K68579984			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16+,21+/m1/s1	FGFJNWQPGUBCRY-XFQAVAEZSA-N	448.268570292							122652
BRD-K72353597	LSM-34096		54632551	InChI=1S/C28H36N4O5S2/c1-20-15-32(17-27-29-12-13-38-27)21(2)18-37-25-11-10-23(14-24(25)28(33)31(3)16-26(20)36-4)30-39(34,35)19-22-8-6-5-7-9-22/h5-14,20-21,26,30H,15-19H2,1-4H3/t20-,21-,26-/m1/s1	GIUIXXRLWJXGHN-IPVFLDMMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K72353597	BRD-K72353597-001-01-8	Broad Institute of MIT and Harvard	BRD-K72353597			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)Cc3ccccc3)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C28H36N4O5S2/c1-20-15-32(17-27-29-12-13-38-27)21(2)18-37-25-11-10-23(14-24(25)28(33)31(3)16-26(20)36-4)30-39(34,35)19-22-8-6-5-7-9-22/h5-14,20-21,26,30H,15-19H2,1-4H3/t20-,21-,26-/m1/s1	GIUIXXRLWJXGHN-IPVFLDMMSA-N	572.212711672							122653
BRD-K61422214	LSM-34097		54632856	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23+/m0/s1	DUFFUDYVDPDMOF-YGKZAACZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K61422214	BRD-K61422214-001-01-7	Broad Institute of MIT and Harvard	BRD-K61422214			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17+,23+/m0/s1	DUFFUDYVDPDMOF-YGKZAACZSA-N	470.252920228							122654
BRD-K72217308	LSM-34098		54632677	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-16-23(13-14-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-9-8-12-25(15-22)38-24-10-6-5-7-11-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28-/m1/s1	XTWYRSBCEBGZBY-PHVLTXCSSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(Oc4ccccc4)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K72217308	BRD-K72217308-001-01-5	Broad Institute of MIT and Harvard	BRD-K72217308			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(Oc4ccccc4)c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-16-23(13-14-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-9-8-12-25(15-22)38-24-10-6-5-7-11-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28-/m1/s1	XTWYRSBCEBGZBY-PHVLTXCSSA-N	517.25767125							122655
BRD-K92765714	LSM-34099		54632757	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-16-23(13-14-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-9-8-12-25(15-22)38-24-10-6-5-7-11-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28-/m0/s1	XTWYRSBCEBGZBY-GTNJKRJXSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(Oc4ccccc4)c3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K92765714	BRD-K92765714-001-01-7	Broad Institute of MIT and Harvard	BRD-K92765714			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(Oc4ccccc4)c3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-16-23(13-14-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-9-8-12-25(15-22)38-24-10-6-5-7-11-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28-/m0/s1	XTWYRSBCEBGZBY-GTNJKRJXSA-N	517.25767125							122656
BRD-K84935903	LSM-34100		54632582	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-23-11-10-20(13-22(23)25(31)30(4)15-24(17)34-6)28-26(32)27-19-8-7-9-21(12-19)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24+/m0/s1	XDWPDFGHDYXRAH-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K84935903	BRD-K84935903-001-01-7	Broad Institute of MIT and Harvard	BRD-K84935903			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-23-11-10-20(13-22(23)25(31)30(4)15-24(17)34-6)28-26(32)27-19-8-7-9-21(12-19)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24+/m0/s1	XDWPDFGHDYXRAH-HOOSLVGPSA-N	484.268570292							122657
BRD-K27914478	LSM-34101		54632811	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-9-11-28-12-10-20)18(2)16-36-23-13-21(29-25(32)19-5-6-19)7-8-22(23)27(34)30(3)15-24(17)35-4/h7-13,17-19,24H,5-6,14-16H2,1-4H3,(H,29,32)/t17-,18-,24-/m1/s1	YAZRVZYRDGQLIX-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccncc4	BroadT	BRD-K27914478	BRD-K27914478-001-01-7	Broad Institute of MIT and Harvard	BRD-K27914478			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccncc1	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-9-11-28-12-10-20)18(2)16-36-23-13-21(29-25(32)19-5-6-19)7-8-22(23)27(34)30(3)15-24(17)35-4/h7-13,17-19,24H,5-6,14-16H2,1-4H3,(H,29,32)/t17-,18-,24-/m1/s1	YAZRVZYRDGQLIX-QZTZHPFYSA-N	494.252920228							122658
BRD-K96764878	LSM-34102		54632828	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m0/s1	VMJMIMLZIZXOHC-WJONJSRFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K96764878	BRD-K96764878-001-01-8	Broad Institute of MIT and Harvard	BRD-K96764878			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22+/m0/s1	VMJMIMLZIZXOHC-WJONJSRFSA-N	479.18901998							122659
BRD-K37483469	LSM-34103		54632761	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,26+/m0/s1	DKSPUDZDLBRLRD-CUVVAGTFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc4ccccn4)C[C@@H]1C	BroadT	BRD-K37483469	BRD-K37483469-001-01-2	Broad Institute of MIT and Harvard	BRD-K37483469			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,26+/m0/s1	DKSPUDZDLBRLRD-CUVVAGTFSA-N	494.289305736							122660
BRD-K36806422	LSM-34104		54632617	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13-,18+/m1/s1	RENPXZBPSBTSHX-VFVRVIDISA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K36806422	BRD-K36806422-001-01-1	Broad Institute of MIT and Harvard	BRD-K36806422			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13-,18+/m1/s1	RENPXZBPSBTSHX-VFVRVIDISA-N	363.215806438							122661
BRD-K32727528	LSM-34105		54632607	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18-,24-/m1/s1	SADWOVYOXJOVIV-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc4cncnc4)C[C@H]1C	BroadT	BRD-K32727528	BRD-K32727528-001-01-6	Broad Institute of MIT and Harvard	BRD-K32727528			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18-,24-/m1/s1	SADWOVYOXJOVIV-QZTZHPFYSA-N	481.26890465							122662
BRD-K95033255	LSM-34106		54632666	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m0/s1	IASRPSUKVFSJOB-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K95033255	BRD-K95033255-001-01-2	Broad Institute of MIT and Harvard	BRD-K95033255			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m0/s1	IASRPSUKVFSJOB-LLJLJFOGSA-N	469.25767125							122663
BRD-K45605072	LSM-34107		54632690	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m0/s1	MAKKLZBPABPJBZ-JXQFQVJHSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCC3	BroadT	BRD-K45605072	BRD-K45605072-001-01-9	Broad Institute of MIT and Harvard	BRD-K45605072			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCC1	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19-,24-/m0/s1	MAKKLZBPABPJBZ-JXQFQVJHSA-N	487.304621442							122664
BRD-K94409042	LSM-34108		54632867	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,26+/m1/s1	DKSPUDZDLBRLRD-GOHWNWGWSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc4ccccn4)C[C@H]1C	BroadT	BRD-K94409042	BRD-K94409042-001-01-3	Broad Institute of MIT and Harvard	BRD-K94409042			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,26+/m1/s1	DKSPUDZDLBRLRD-GOHWNWGWSA-N	494.289305736							122665
BRD-K34303900	LSM-34109		54632773	InChI=1S/C22H36N4O6S/c1-7-10-23-22(28)26-12-15(2)20(31-5)13-25(4)21(27)18-11-17(24-33(6,29)30)8-9-19(18)32-14-16(26)3/h8-9,11,15-16,20,24H,7,10,12-14H2,1-6H3,(H,23,28)/t15-,16+,20+/m0/s1	FSCFODAWIHEFCQ-RZQQEMMASA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K34303900	BRD-K34303900-001-01-2	Broad Institute of MIT and Harvard	BRD-K34303900			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H]1C)OC	InChI=1S/C22H36N4O6S/c1-7-10-23-22(28)26-12-15(2)20(31-5)13-25(4)21(27)18-11-17(24-33(6,29)30)8-9-19(18)32-14-16(26)3/h8-9,11,15-16,20,24H,7,10,12-14H2,1-6H3,(H,23,28)/t15-,16+,20+/m0/s1	FSCFODAWIHEFCQ-RZQQEMMASA-N	484.235555602							122666
BRD-K06724886	LSM-34110		54632786	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,26-/m0/s1	DKSPUDZDLBRLRD-UNVFRBQDSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc4ccccn4)C[C@@H]1C	BroadT	BRD-K06724886	BRD-K06724886-001-01-1	Broad Institute of MIT and Harvard	BRD-K06724886			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc2ccccn2)C[C@@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,26-/m0/s1	DKSPUDZDLBRLRD-UNVFRBQDSA-N	494.289305736							122667
BRD-K15378607	LSM-34111		54632552	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24-/m0/s1	PGRNYZHGQKBFKV-UAVUOLJFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K15378607	BRD-K15378607-001-01-3	Broad Institute of MIT and Harvard	BRD-K15378607			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17-,24-/m0/s1	PGRNYZHGQKBFKV-UAVUOLJFSA-N	500.243498396							122668
BRD-K81110981	LSM-34112		54632727	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-8-15(24-32(28,29)12-20(21,22)23)6-7-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14+,18+/m1/s1	PLIZPBUQBLYJFD-GLJUWKHASA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K81110981	BRD-K81110981-001-01-5	Broad Institute of MIT and Harvard	BRD-K81110981			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-8-15(24-32(28,29)12-20(21,22)23)6-7-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14+,18+/m1/s1	PLIZPBUQBLYJFD-GLJUWKHASA-N	481.18582638							122669
BRD-K57749441	LSM-34113		54632594	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16-,21+/m0/s1	FGFJNWQPGUBCRY-CKJXQJPGSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)C	BroadT	BRD-K57749441	BRD-K57749441-001-01-4	Broad Institute of MIT and Harvard	BRD-K57749441			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16-,21+/m0/s1	FGFJNWQPGUBCRY-CKJXQJPGSA-N	448.268570292							122670
BRD-K83684822	LSM-34114		54632651	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20+,25+/m0/s1	OXTPNGYEOOIGNP-WZOHSFFVSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccccn3)[C@H](C)COc2c1	BroadT	BRD-K83684822	BRD-K83684822-001-01-0	Broad Institute of MIT and Harvard	BRD-K83684822			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20+,25+/m0/s1	OXTPNGYEOOIGNP-WZOHSFFVSA-N	482.289305736							122671
BRD-K14098658	LSM-34115		54632587	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24-/m0/s1	NCKJLHVNZDVZFX-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K14098658	BRD-K14098658-001-01-6	Broad Institute of MIT and Harvard	BRD-K14098658			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24-/m0/s1	NCKJLHVNZDVZFX-XFAGBWLFSA-N	469.25767125							122672
BRD-K84151467	LSM-34116		54632641	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-23-11-10-20(13-22(23)25(31)30(4)15-24(17)34-6)28-26(32)27-19-8-7-9-21(12-19)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24+/m0/s1	XDWPDFGHDYXRAH-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K84151467	BRD-K84151467-001-01-9	Broad Institute of MIT and Harvard	BRD-K84151467			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-23-11-10-20(13-22(23)25(31)30(4)15-24(17)34-6)28-26(32)27-19-8-7-9-21(12-19)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24+/m0/s1	XDWPDFGHDYXRAH-LLJLJFOGSA-N	484.268570292							122673
BRD-K86192746	LSM-34117		54632649	InChI=1S/C24H34N4O4S/c1-6-22(29)26-18-7-8-19-20(11-18)32-15-17(3)28(14-23-25-9-10-33-23)12-16(2)21(31-5)13-27(4)24(19)30/h7-11,16-17,21H,6,12-15H2,1-5H3,(H,26,29)/t16-,17+,21+/m0/s1	AIGQWRJTRGZNLS-CSODHUTKSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3nccs3)[C@H](C)COc2c1	BroadT	BRD-K86192746	BRD-K86192746-001-01-4	Broad Institute of MIT and Harvard	BRD-K86192746			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3nccs3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C24H34N4O4S/c1-6-22(29)26-18-7-8-19-20(11-18)32-15-17(3)28(14-23-25-9-10-33-23)12-16(2)21(31-5)13-27(4)24(19)30/h7-11,16-17,21H,6,12-15H2,1-5H3,(H,26,29)/t16-,17+,21+/m0/s1	AIGQWRJTRGZNLS-CSODHUTKSA-N	474.230076298							122674
BRD-K00300115	LSM-34118		54632592	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20+,25-/m0/s1	OXTPNGYEOOIGNP-DFIYOIEZSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3ccccn3)[C@H](C)COc2c1	BroadT	BRD-K00300115	BRD-K00300115-001-01-9	Broad Institute of MIT and Harvard	BRD-K00300115			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3ccccn3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20+,25-/m0/s1	OXTPNGYEOOIGNP-DFIYOIEZSA-N	482.289305736							122675
BRD-K68300789	LSM-34119		54632703	InChI=1S/C31H39F3N4O6/c1-19-16-38(30(41)36-23-7-5-22(6-8-23)31(32,33)34)20(2)18-44-26-15-24(35-28(39)21-11-13-43-14-12-21)9-10-25(26)29(40)37(3)17-27(19)42-4/h5-10,15,19-21,27H,11-14,16-18H2,1-4H3,(H,35,39)(H,36,41)/t19-,20-,27-/m1/s1	QCSCHIURPKLNDX-SEXOINJZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc4ccc(cc4)C(F)(F)F	BroadT	BRD-K68300789	BRD-K68300789-001-01-3	Broad Institute of MIT and Harvard	BRD-K68300789			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCOCC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C31H39F3N4O6/c1-19-16-38(30(41)36-23-7-5-22(6-8-23)31(32,33)34)20(2)18-44-26-15-24(35-28(39)21-11-13-43-14-12-21)9-10-25(26)29(40)37(3)17-27(19)42-4/h5-10,15,19-21,27H,11-14,16-18H2,1-4H3,(H,35,39)(H,36,41)/t19-,20-,27-/m1/s1	QCSCHIURPKLNDX-SEXOINJZSA-N	620.282169608							122676
BRD-K49100313	LSM-34120		54632555	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,25+/m0/s1	BRQCDNWRPXIVHI-ZYLNGJIFSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K49100313	BRD-K49100313-001-01-6	Broad Institute of MIT and Harvard	BRD-K49100313			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,25+/m0/s1	BRQCDNWRPXIVHI-ZYLNGJIFSA-N	528.27702649							122677
BRD-K39734779	LSM-34121		54632600	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20+,25+/m0/s1	VUNNIGMMXHQHNM-WZOHSFFVSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCCC3	BroadT	BRD-K39734779	BRD-K39734779-001-01-1	Broad Institute of MIT and Harvard	BRD-K39734779			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCCC1	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20+,25+/m0/s1	VUNNIGMMXHQHNM-WZOHSFFVSA-N	516.331170548							122678
BRD-K18318274	LSM-34122		54632793	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24-/m0/s1	IASRPSUKVFSJOB-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K18318274	BRD-K18318274-001-01-8	Broad Institute of MIT and Harvard	BRD-K18318274			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24-/m0/s1	IASRPSUKVFSJOB-XFAGBWLFSA-N	469.25767125							122679
BRD-K21450593	LSM-34123		54632744	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17-,21+/m0/s1	HECXZILGRZYZSJ-XGHQBKJUSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K21450593	BRD-K21450593-001-01-8	Broad Institute of MIT and Harvard	BRD-K21450593			CCCC(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17-,21+/m0/s1	HECXZILGRZYZSJ-XGHQBKJUSA-N	487.265791262							122680
BRD-K97315585	LSM-34124		54632710	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-23-11-10-20(13-22(23)25(31)30(4)15-24(17)34-6)28-26(32)27-19-8-7-9-21(12-19)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24+/m1/s1	XDWPDFGHDYXRAH-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K97315585	BRD-K97315585-001-01-2	Broad Institute of MIT and Harvard	BRD-K97315585			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-23-11-10-20(13-22(23)25(31)30(4)15-24(17)34-6)28-26(32)27-19-8-7-9-21(12-19)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24+/m1/s1	XDWPDFGHDYXRAH-GGUMNFRJSA-N	484.268570292							122681
BRD-K15800236	LSM-34125		54632845	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28-/m0/s1	HUDWACAATGSXNV-GTNJKRJXSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K15800236	BRD-K15800236-001-01-5	Broad Institute of MIT and Harvard	BRD-K15800236			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28-/m0/s1	HUDWACAATGSXNV-GTNJKRJXSA-N	517.25767125							122682
BRD-K64317740	LSM-34126		54632701	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18-,22+/m0/s1	CBWRNOSECAFSLQ-NPPFBWRTSA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@@H]1C)OC	BroadT	BRD-K64317740	BRD-K64317740-001-01-9	Broad Institute of MIT and Harvard	BRD-K64317740			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18-,22+/m0/s1	CBWRNOSECAFSLQ-NPPFBWRTSA-N	433.294056758							122683
BRD-K29737435	LSM-34127		54632577	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)28-13-16(3)21(32-6)14-27(5)23(30)19-10-9-18(26-22(29)8-2)12-20(19)33-15-17(28)4/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H,25,31)(H,26,29)/t16-,17+,21+/m0/s1	WYILBQVQDSLHTR-CSODHUTKSA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CC)cc2OC[C@H]1C)OC	BroadT	BRD-K29737435	BRD-K29737435-001-01-2	Broad Institute of MIT and Harvard	BRD-K29737435			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CC)cc2OC[C@H]1C)OC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)28-13-16(3)21(32-6)14-27(5)23(30)19-10-9-18(26-22(29)8-2)12-20(19)33-15-17(28)4/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H,25,31)(H,26,29)/t16-,17+,21+/m0/s1	WYILBQVQDSLHTR-CSODHUTKSA-N	462.284220356							122684
BRD-K41900823	LSM-34128		54632774	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15+,21+/m0/s1	TWDPSDBESUIWDD-PDSXEYIOSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K41900823	BRD-K41900823-001-01-0	Broad Institute of MIT and Harvard	BRD-K41900823			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15+,21+/m0/s1	TWDPSDBESUIWDD-PDSXEYIOSA-N	473.26381927							122685
BRD-K68977895	LSM-34129		54632672	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-9-15(20-30(5,24)25)7-8-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m0/s1	JZZOEAQFGXAXSL-IYOUNJFTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)C	BroadT	BRD-K68977895	BRD-K68977895-001-01-9	Broad Institute of MIT and Harvard	BRD-K68977895			CO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C[C@@H]1C)S(C)(=O)=O	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-9-15(20-30(5,24)25)7-8-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14+,18-/m0/s1	JZZOEAQFGXAXSL-IYOUNJFTSA-N	477.160341742							122686
BRD-K27885839	LSM-34130		54632632	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25-/m0/s1	LCEYSZSEEBOWFL-ATLLOTDBSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K27885839	BRD-K27885839-001-01-3	Broad Institute of MIT and Harvard	BRD-K27885839			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25-/m0/s1	LCEYSZSEEBOWFL-ATLLOTDBSA-N	497.25258587							122687
BRD-K49944837	LSM-34131		54632553	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17-,21+/m0/s1	QGILEVYYFFUMMM-XGHQBKJUSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K49944837	BRD-K49944837-001-01-4	Broad Institute of MIT and Harvard	BRD-K49944837			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17-,21+/m0/s1	QGILEVYYFFUMMM-XGHQBKJUSA-N	561.223274528							122688
BRD-K89801935	LSM-34132		54632763	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23+/m0/s1	DUFFUDYVDPDMOF-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K89801935	BRD-K89801935-001-01-8	Broad Institute of MIT and Harvard	BRD-K89801935			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3OC)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C25H34N4O5/c1-16-13-26-17(2)15-34-21-11-10-18(12-19(21)24(30)29(3)14-23(16)33-5)27-25(31)28-20-8-6-7-9-22(20)32-4/h6-12,16-17,23,26H,13-15H2,1-5H3,(H2,27,28,31)/t16-,17-,23+/m0/s1	DUFFUDYVDPDMOF-HKARXFIJSA-N	470.252920228							122689
CHEMBL2358791	LSM-34133	BRD-K36322496, SID131429007	54632758	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28-/m0/s1	HUDWACAATGSXNV-CZBREUMFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K36322496	BRD-K36322496-001-01-0	Broad Institute of MIT and Harvard	BRD-K36322496			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28-/m0/s1	HUDWACAATGSXNV-CZBREUMFSA-N	517.25767125							122690
BRD-K55218521	LSM-34134		54632603	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17+,22+/m1/s1	WEZMNWQXUMSVMO-JLHGSKIFSA-N	COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	BroadT	BRD-K55218521	BRD-K55218521-001-01-5	Broad Institute of MIT and Harvard	BRD-K55218521			COCC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H]1C)OC	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17+,22+/m1/s1	WEZMNWQXUMSVMO-JLHGSKIFSA-N	475.268235934							122691
BRD-K47784292	LSM-34135		54632704	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23+/m1/s1	UUOIXUNLVHGQEP-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC3CC3	BroadT	BRD-K47784292	BRD-K47784292-001-01-4	Broad Institute of MIT and Harvard	BRD-K47784292			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23+/m1/s1	UUOIXUNLVHGQEP-PNCHPQGNSA-N	488.29987042							122692
BRD-K71253424	LSM-34136		54632664	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,25+/m1/s1	BRQCDNWRPXIVHI-RNHFSVANSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K71253424	BRD-K71253424-001-01-0	Broad Institute of MIT and Harvard	BRD-K71253424			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,25+/m1/s1	BRQCDNWRPXIVHI-RNHFSVANSA-N	528.27702649							122693
BRD-K20724649	LSM-34137		54632719	InChI=1S/C22H36N4O6S/c1-7-10-23-22(28)26-12-15(2)20(31-5)13-25(4)21(27)18-11-17(24-33(6,29)30)8-9-19(18)32-14-16(26)3/h8-9,11,15-16,20,24H,7,10,12-14H2,1-6H3,(H,23,28)/t15-,16-,20+/m1/s1	FSCFODAWIHEFCQ-QINHECLXSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@H]1C)OC	BroadT	BRD-K20724649	BRD-K20724649-001-01-1	Broad Institute of MIT and Harvard	BRD-K20724649			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@H]1C)OC	InChI=1S/C22H36N4O6S/c1-7-10-23-22(28)26-12-15(2)20(31-5)13-25(4)21(27)18-11-17(24-33(6,29)30)8-9-19(18)32-14-16(26)3/h8-9,11,15-16,20,24H,7,10,12-14H2,1-6H3,(H,23,28)/t15-,16-,20+/m1/s1	FSCFODAWIHEFCQ-QINHECLXSA-N	484.235555602							122694
BRD-K71221636	LSM-34138		54632790	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-9-11-28-12-10-20)18(2)16-36-23-13-21(29-25(32)19-5-6-19)7-8-22(23)27(34)30(3)15-24(17)35-4/h7-13,17-19,24H,5-6,14-16H2,1-4H3,(H,29,32)/t17-,18-,24+/m1/s1	YAZRVZYRDGQLIX-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccncc4	BroadT	BRD-K71221636	BRD-K71221636-001-01-1	Broad Institute of MIT and Harvard	BRD-K71221636			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CC3)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccncc1	InChI=1S/C27H34N4O5/c1-17-14-31(26(33)20-9-11-28-12-10-20)18(2)16-36-23-13-21(29-25(32)19-5-6-19)7-8-22(23)27(34)30(3)15-24(17)35-4/h7-13,17-19,24H,5-6,14-16H2,1-4H3,(H,29,32)/t17-,18-,24+/m1/s1	YAZRVZYRDGQLIX-GGUMNFRJSA-N	494.252920228							122695
BRD-K09248459	LSM-34139		54632862	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22+,28-/m0/s1	NCAOWLICBBXJJW-TYPXCFOJSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(Cc4cccnc4)C[C@@H]1C	BroadT	BRD-K09248459	BRD-K09248459-001-01-5	Broad Institute of MIT and Harvard	BRD-K09248459			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22+,28-/m0/s1	NCAOWLICBBXJJW-TYPXCFOJSA-N	522.320605864							122696
BRD-K71053060	LSM-34140		54632549	InChI=1S/C28H37F3N4O5/c1-18-15-35(12-11-28(29,30)31)19(2)17-40-24-10-9-21(14-23(24)26(36)34(3)16-25(18)39-5)33-27(37)32-20-7-6-8-22(13-20)38-4/h6-10,13-14,18-19,25H,11-12,15-17H2,1-5H3,(H2,32,33,37)/t18-,19-,25-/m1/s1	OKHOIMSGWPDIFV-MPCDZSKCSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K71053060	BRD-K71053060-001-01-3	Broad Institute of MIT and Harvard	BRD-K71053060			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C28H37F3N4O5/c1-18-15-35(12-11-28(29,30)31)19(2)17-40-24-10-9-21(14-23(24)26(36)34(3)16-25(18)39-5)33-27(37)32-20-7-6-8-22(13-20)38-4/h6-10,13-14,18-19,25H,11-12,15-17H2,1-5H3,(H2,32,33,37)/t18-,19-,25-/m1/s1	OKHOIMSGWPDIFV-MPCDZSKCSA-N	566.271604924							122697
BRD-K60208734	LSM-34141		54632593	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23-/m0/s1	UUOIXUNLVHGQEP-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC3CC3	BroadT	BRD-K60208734	BRD-K60208734-001-01-2	Broad Institute of MIT and Harvard	BRD-K60208734			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23-/m0/s1	UUOIXUNLVHGQEP-IXFSTUDKSA-N	488.29987042							122698
BRD-K49704392	LSM-34142		54632767	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18-,24+/m0/s1	SADWOVYOXJOVIV-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc4cncnc4)C[C@@H]1C	BroadT	BRD-K49704392	BRD-K49704392-001-01-9	Broad Institute of MIT and Harvard	BRD-K49704392			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18-,24+/m0/s1	SADWOVYOXJOVIV-LLJLJFOGSA-N	481.26890465							122699
BRD-K97740378	LSM-34143		54632601	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23+/m0/s1	UUOIXUNLVHGQEP-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC3CC3	BroadT	BRD-K97740378	BRD-K97740378-001-01-2	Broad Institute of MIT and Harvard	BRD-K97740378			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18-,23+/m0/s1	UUOIXUNLVHGQEP-IUKKYPGJSA-N	488.29987042							122700
BRD-K32434600	LSM-34144		54632626	InChI=1S/C27H39N3O6/c1-17-14-30(26(32)20-9-11-35-12-10-20)18(2)16-36-23-8-7-21(28-25(31)19-5-6-19)13-22(23)27(33)29(3)15-24(17)34-4/h7-8,13,17-20,24H,5-6,9-12,14-16H2,1-4H3,(H,28,31)/t17-,18-,24-/m0/s1	GAPZQUHMQDIXFX-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C4CCOCC4	BroadT	BRD-K32434600	BRD-K32434600-001-01-0	Broad Institute of MIT and Harvard	BRD-K32434600			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CCOCC1	InChI=1S/C27H39N3O6/c1-17-14-30(26(32)20-9-11-35-12-10-20)18(2)16-36-23-8-7-21(28-25(31)19-5-6-19)13-22(23)27(33)29(3)15-24(17)34-4/h7-8,13,17-20,24H,5-6,9-12,14-16H2,1-4H3,(H,28,31)/t17-,18-,24-/m0/s1	GAPZQUHMQDIXFX-XFAGBWLFSA-N	501.283885998							122701
BRD-K90475322	LSM-34145		54632824	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	MAKKLZBPABPJBZ-IMWIBFENSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCC3	BroadT	BRD-K90475322	BRD-K90475322-001-01-9	Broad Institute of MIT and Harvard	BRD-K90475322			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCC1	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	MAKKLZBPABPJBZ-IMWIBFENSA-N	487.304621442							122702
BRD-K40474424	LSM-34146		54632864	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-9-15(20-30(5,24)25)7-8-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18-/m1/s1	JZZOEAQFGXAXSL-HBUWYVDXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)C)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K40474424	BRD-K40474424-001-01-0	Broad Institute of MIT and Harvard	BRD-K40474424			CO[C@@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C19H31N3O7S2/c1-13-10-22(31(6,26)27)14(2)12-29-17-9-15(20-30(5,24)25)7-8-16(17)19(23)21(3)11-18(13)28-4/h7-9,13-14,18,20H,10-12H2,1-6H3/t13-,14-,18-/m1/s1	JZZOEAQFGXAXSL-HBUWYVDXSA-N	477.160341742							122703
BRD-K97227180-001-01-8	LSM-34147	BRD-K97227180	54632597	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-18(5-6-20(21)23(31)30(3)12-22(14)33-4)28-24(32)29-19-8-16(25)7-17(26)9-19/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22+/m1/s1	WLELUPNUISGFRW-GTQRCTGISA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K97227180	BRD-K97227180-001-01-8	Broad Institute of MIT and Harvard	BRD-K97227180			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-18(5-6-20(21)23(31)30(3)12-22(14)33-4)28-24(32)29-19-8-16(25)7-17(26)9-19/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15+,22+/m1/s1	WLELUPNUISGFRW-GTQRCTGISA-N	508.1644109							122704
BRD-K06529600	LSM-34148		54632825	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m0/s1	NCKJLHVNZDVZFX-HOOSLVGPSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K06529600	BRD-K06529600-001-01-9	Broad Institute of MIT and Harvard	BRD-K06529600			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24+/m0/s1	NCKJLHVNZDVZFX-HOOSLVGPSA-N	469.25767125							122705
BRD-K17061569	LSM-34149		54632583	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17+,21+/m0/s1	QGILEVYYFFUMMM-CSODHUTKSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	BroadT	BRD-K17061569	BRD-K17061569-001-01-9	Broad Institute of MIT and Harvard	BRD-K17061569			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@@H]1C	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17+,21+/m0/s1	QGILEVYYFFUMMM-CSODHUTKSA-N	561.223274528							122706
BRD-K14266419	LSM-34150		54632643	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m1/s1	VMJMIMLZIZXOHC-ZMPRRUGASA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K14266419	BRD-K14266419-001-01-9	Broad Institute of MIT and Harvard	BRD-K14266419			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C23H30FN3O5S/c1-15-12-25-16(2)14-32-21-11-18(26-33(29,30)19-8-5-17(24)6-9-19)7-10-20(21)23(28)27(3)13-22(15)31-4/h5-11,15-16,22,25-26H,12-14H2,1-4H3/t15-,16+,22-/m1/s1	VMJMIMLZIZXOHC-ZMPRRUGASA-N	479.18901998							122707
BRD-K99681648	LSM-34151		54632772	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-7-6-14(20-27(5,23)24)8-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13-,17-/m1/s1	BVSUEIBBWDYHCK-PBFPGSCMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K99681648	BRD-K99681648-001-01-0	Broad Institute of MIT and Harvard	BRD-K99681648			CO[C@@H]1CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C18H29N3O5S/c1-12-9-19-13(2)11-26-16-7-6-14(20-27(5,23)24)8-15(16)18(22)21(3)10-17(12)25-4/h6-8,12-13,17,19-20H,9-11H2,1-5H3/t12-,13-,17-/m1/s1	BVSUEIBBWDYHCK-PBFPGSCMSA-N	399.182791748							122708
BRD-K21419800	LSM-34152		54632673	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18+,23-/m1/s1	OBNHYLURRDQSSE-IEGUWTFLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CC3CC3)C[C@H]1C	BroadT	BRD-K21419800	BRD-K21419800-001-01-2	Broad Institute of MIT and Harvard	BRD-K21419800			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18+,23-/m1/s1	OBNHYLURRDQSSE-IEGUWTFLSA-N	460.3049558							122709
BRD-K69659917	LSM-34153		54632788	InChI=1S/C23H32N4O5/c1-14-11-26(4)15(2)13-31-20-10-17(24-22(28)19-9-16(3)32-25-19)7-8-18(20)23(29)27(5)12-21(14)30-6/h7-10,14-15,21H,11-13H2,1-6H3,(H,24,28)/t14-,15+,21+/m0/s1	SSJRVKKQRIQXRQ-PDSXEYIOSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K69659917	BRD-K69659917-001-01-6	Broad Institute of MIT and Harvard	BRD-K69659917			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C23H32N4O5/c1-14-11-26(4)15(2)13-31-20-10-17(24-22(28)19-9-16(3)32-25-19)7-8-18(20)23(29)27(5)12-21(14)30-6/h7-10,14-15,21H,11-13H2,1-6H3,(H,24,28)/t14-,15+,21+/m0/s1	SSJRVKKQRIQXRQ-PDSXEYIOSA-N	444.237270164							122710
BRD-K77493974	LSM-34154		54632796	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-8-7-16(21-15(3)24)9-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14+,19+/m0/s1	VZXWWTHKMGUIJI-IQUTYRLHSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)C	BroadT	BRD-K77493974	BRD-K77493974-001-01-0	Broad Institute of MIT and Harvard	BRD-K77493974			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)S(C)(=O)=O	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-8-7-16(21-15(3)24)9-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14+,19+/m0/s1	VZXWWTHKMGUIJI-IQUTYRLHSA-N	441.193356432							122711
BRD-K84846130	LSM-34155		54632624	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18-,23+/m1/s1	OBNHYLURRDQSSE-PNCHPQGNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CC3CC3)C[C@H]1C	BroadT	BRD-K84846130	BRD-K84846130-001-01-1	Broad Institute of MIT and Harvard	BRD-K84846130			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18-,23+/m1/s1	OBNHYLURRDQSSE-PNCHPQGNSA-N	460.3049558							122712
CHEMBL2133144	LSM-34156	BRD-K67146164, SID131428935	54632686	InChI=1S/C25H32N4O6/c1-15-11-26-16(2)13-33-21-9-17(5-7-19(21)24(30)29(3)12-23(15)32-4)27-25(31)28-18-6-8-20-22(10-18)35-14-34-20/h5-10,15-16,23,26H,11-14H2,1-4H3,(H2,27,28,31)/t15-,16+,23-/m1/s1	SLXXNDOTBOUXJA-VBURHUQHSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K67146164	BRD-K67146164-001-01-6	Broad Institute of MIT and Harvard	BRD-K67146164			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2OC[C@H](C)NC[C@H]1C	InChI=1S/C25H32N4O6/c1-15-11-26-16(2)13-33-21-9-17(5-7-19(21)24(30)29(3)12-23(15)32-4)27-25(31)28-18-6-8-20-22(10-18)35-14-34-20/h5-10,15-16,23,26H,11-14H2,1-4H3,(H2,27,28,31)/t15-,16+,23-/m1/s1	SLXXNDOTBOUXJA-VBURHUQHSA-N	484.232184784							122713
BRD-K54660148	LSM-34157		54632708	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-16-23(13-14-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-9-8-12-25(15-22)38-24-10-6-5-7-11-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28+/m1/s1	XTWYRSBCEBGZBY-CJYOKPGZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(Oc4ccccc4)c3)cc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K54660148	BRD-K54660148-001-01-2	Broad Institute of MIT and Harvard	BRD-K54660148			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(Oc4ccccc4)c3)cc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-16-23(13-14-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-9-8-12-25(15-22)38-24-10-6-5-7-11-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28+/m1/s1	XTWYRSBCEBGZBY-CJYOKPGZSA-N	517.25767125							122714
BRD-K76933846	LSM-34158		54632660	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17+,21-/m1/s1	QGILEVYYFFUMMM-LLGFUMIMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K76933846	BRD-K76933846-001-01-2	Broad Institute of MIT and Harvard	BRD-K76933846			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17+,21-/m1/s1	QGILEVYYFFUMMM-LLGFUMIMSA-N	561.223274528							122715
BRD-K26316075	LSM-34159		54632717	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-13-21(27-19(3)30)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m1/s1	YAGNFVDOBCIATK-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccccc3	BroadT	BRD-K26316075	BRD-K26316075-001-01-3	Broad Institute of MIT and Harvard	BRD-K26316075			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-13-21(27-19(3)30)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24+/m1/s1	YAGNFVDOBCIATK-YTZAWJCFSA-N	467.242021186							122716
BRD-K51207618	LSM-34160		54632684	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24-/m0/s1	PGRNYZHGQKBFKV-SRGWNRLKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K51207618	BRD-K51207618-001-01-6	Broad Institute of MIT and Harvard	BRD-K51207618			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24-/m0/s1	PGRNYZHGQKBFKV-SRGWNRLKSA-N	500.243498396							122717
BRD-K84657389	LSM-34161		54632573	InChI=1S/C22H36N4O6S/c1-7-10-23-22(28)26-12-15(2)20(31-5)13-25(4)21(27)18-11-17(24-33(6,29)30)8-9-19(18)32-14-16(26)3/h8-9,11,15-16,20,24H,7,10,12-14H2,1-6H3,(H,23,28)/t15-,16+,20+/m1/s1	FSCFODAWIHEFCQ-GUXCAODWSA-N	CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K84657389	BRD-K84657389-001-01-0	Broad Institute of MIT and Harvard	BRD-K84657389			CCCNC(=O)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C22H36N4O6S/c1-7-10-23-22(28)26-12-15(2)20(31-5)13-25(4)21(27)18-11-17(24-33(6,29)30)8-9-19(18)32-14-16(26)3/h8-9,11,15-16,20,24H,7,10,12-14H2,1-6H3,(H,23,28)/t15-,16+,20+/m1/s1	FSCFODAWIHEFCQ-GUXCAODWSA-N	484.235555602							122718
BRD-K21990363	LSM-34162		54632809	InChI=1S/C22H36N4O6S/c1-7-10-23-22(28)26-12-15(2)20(31-5)13-25(4)21(27)18-11-17(24-33(6,29)30)8-9-19(18)32-14-16(26)3/h8-9,11,15-16,20,24H,7,10,12-14H2,1-6H3,(H,23,28)/t15-,16+,20-/m1/s1	FSCFODAWIHEFCQ-GQIGUUNPSA-N	CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K21990363	BRD-K21990363-001-01-1	Broad Institute of MIT and Harvard	BRD-K21990363			CCCNC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C22H36N4O6S/c1-7-10-23-22(28)26-12-15(2)20(31-5)13-25(4)21(27)18-11-17(24-33(6,29)30)8-9-19(18)32-14-16(26)3/h8-9,11,15-16,20,24H,7,10,12-14H2,1-6H3,(H,23,28)/t15-,16+,20-/m1/s1	FSCFODAWIHEFCQ-GQIGUUNPSA-N	484.235555602							122719
BRD-K35792251	LSM-34163		54632627	InChI=1S/C23H32N4O5/c1-14-11-26(4)15(2)13-31-20-10-17(24-22(28)19-9-16(3)32-25-19)7-8-18(20)23(29)27(5)12-21(14)30-6/h7-10,14-15,21H,11-13H2,1-6H3,(H,24,28)/t14-,15-,21+/m1/s1	SSJRVKKQRIQXRQ-PZPWOCDFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K35792251	BRD-K35792251-001-01-0	Broad Institute of MIT and Harvard	BRD-K35792251			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C23H32N4O5/c1-14-11-26(4)15(2)13-31-20-10-17(24-22(28)19-9-16(3)32-25-19)7-8-18(20)23(29)27(5)12-21(14)30-6/h7-10,14-15,21H,11-13H2,1-6H3,(H,24,28)/t14-,15-,21+/m1/s1	SSJRVKKQRIQXRQ-PZPWOCDFSA-N	444.237270164							122720
BRD-K69671285	LSM-34164		54632843	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25+/m1/s1	LCEYSZSEEBOWFL-GAKIBJFNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K69671285	BRD-K69671285-001-01-5	Broad Institute of MIT and Harvard	BRD-K69671285			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25+/m1/s1	LCEYSZSEEBOWFL-GAKIBJFNSA-N	497.25258587							122721
BRD-K80591672	LSM-34165		54632667	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22+,28-/m1/s1	NCAOWLICBBXJJW-RZIGYZOXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K80591672	BRD-K80591672-001-01-1	Broad Institute of MIT and Harvard	BRD-K80591672			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22+,28-/m1/s1	NCAOWLICBBXJJW-RZIGYZOXSA-N	522.320605864							122722
BRD-K27384243	LSM-34166		54632589	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18+,23+/m1/s1	OBNHYLURRDQSSE-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CC3CC3)C[C@H]1C	BroadT	BRD-K27384243	BRD-K27384243-001-01-7	Broad Institute of MIT and Harvard	BRD-K27384243			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CC2CC2)C[C@H]1C	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18+,23+/m1/s1	OBNHYLURRDQSSE-STSQHVNTSA-N	460.3049558							122723
BRD-K04696985	LSM-34167		54632820	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19-,26+/m0/s1	QXMKZAKCOIHKOR-LZJCXSABSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K04696985	BRD-K04696985-001-01-3	Broad Institute of MIT and Harvard	BRD-K04696985			CO[C@H]1[C@@H](C)CN(CC2CC2)[C@@H](C)COc2cc(ccc2C(=O)N(C)C1)NC(=O)c1cccc(F)c1	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19-,26+/m0/s1	QXMKZAKCOIHKOR-LZJCXSABSA-N	497.268984862							122724
BRD-K65932559	LSM-34168		54632804	InChI=1S/C25H37N3O6/c1-16-12-28(24(30)10-18-6-7-18)17(2)14-34-21-11-19(26-23(29)15-32-4)8-9-20(21)25(31)27(3)13-22(16)33-5/h8-9,11,16-18,22H,6-7,10,12-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m0/s1	GTQGGUJFCSCMSO-PNLZDCPESA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN([C@@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K65932559	BRD-K65932559-001-01-4	Broad Institute of MIT and Harvard	BRD-K65932559			COCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O6/c1-16-12-28(24(30)10-18-6-7-18)17(2)14-34-21-11-19(26-23(29)15-32-4)8-9-20(21)25(31)27(3)13-22(16)33-5/h8-9,11,16-18,22H,6-7,10,12-15H2,1-5H3,(H,26,29)/t16-,17-,22+/m0/s1	GTQGGUJFCSCMSO-PNLZDCPESA-N	475.268235934							122725
BRD-K69093885	LSM-34169		54632705	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-13-21(27-19(3)30)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m1/s1	YAGNFVDOBCIATK-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c3ccccc3	BroadT	BRD-K69093885	BRD-K69093885-001-01-6	Broad Institute of MIT and Harvard	BRD-K69093885			CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-13-21(27-19(3)30)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18+,24-/m1/s1	YAGNFVDOBCIATK-NXMSCROESA-N	467.242021186							122726
BRD-K70923850	LSM-34170		54632609	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,25+/m0/s1	BRQCDNWRPXIVHI-WZOHSFFVSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(Cc4nccs4)C[C@@H]1C	BroadT	BRD-K70923850	BRD-K70923850-001-01-2	Broad Institute of MIT and Harvard	BRD-K70923850			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@@H]1C	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20+,25+/m0/s1	BRQCDNWRPXIVHI-WZOHSFFVSA-N	528.27702649							122727
BRD-K63277230	LSM-34171		54632566	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28+/m1/s1	SLSVJKSFTBBFSH-WENCSYSZSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K63277230	BRD-K63277230-001-01-3	Broad Institute of MIT and Harvard	BRD-K63277230			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28+/m1/s1	SLSVJKSFTBBFSH-WENCSYSZSA-N	552.240640982							122728
BRD-K26690065	LSM-34172		54632572	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16+,20+/m1/s1	WSQGAZSPVHYFJA-GUXCAODWSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)COC	BroadT	BRD-K26690065	BRD-K26690065-001-01-3	Broad Institute of MIT and Harvard	BRD-K26690065			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)COC)c1	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16+,20+/m1/s1	WSQGAZSPVHYFJA-GUXCAODWSA-N	449.25258587							122729
BRD-K33315581	LSM-34173		54632613	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18-,25-/m0/s1	UYGLFTDABBDOCR-RPPIVITFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K33315581	BRD-K33315581-001-01-3	Broad Institute of MIT and Harvard	BRD-K33315581			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccc1F	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18-,25-/m0/s1	UYGLFTDABBDOCR-RPPIVITFSA-N	511.248249418							122730
BRD-K67161258-001-01-2	LSM-34174	BRD-K67161258	54632591	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28+/m1/s1	HUDWACAATGSXNV-GGJMMHKRSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K67161258	BRD-K67161258-001-01-2	Broad Institute of MIT and Harvard	BRD-K67161258			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28+/m1/s1	HUDWACAATGSXNV-GGJMMHKRSA-N	517.25767125							122731
BRD-K02927989	LSM-34175		54632839	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22+,28+/m0/s1	NCAOWLICBBXJJW-PFPZSTESSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(Cc4cccnc4)C[C@@H]1C	BroadT	BRD-K02927989	BRD-K02927989-001-01-0	Broad Institute of MIT and Harvard	BRD-K02927989			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22+,28+/m0/s1	NCAOWLICBBXJJW-PFPZSTESSA-N	522.320605864							122732
BRD-K03852663	LSM-34176		54632784	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m0/s1	NCKJLHVNZDVZFX-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K03852663	BRD-K03852663-001-01-2	Broad Institute of MIT and Harvard	BRD-K03852663			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m0/s1	NCKJLHVNZDVZFX-RHGYRFJNSA-N	469.25767125							122733
BRD-K33151492	LSM-34177		54632803	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20+,25-/m0/s1	VUNNIGMMXHQHNM-DFIYOIEZSA-N	CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCCC3	BroadT	BRD-K33151492	BRD-K33151492-001-01-0	Broad Institute of MIT and Harvard	BRD-K33151492			CCCNC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCCC1	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20+,25-/m0/s1	VUNNIGMMXHQHNM-DFIYOIEZSA-N	516.331170548							122734
BRD-K39617634	LSM-34178		54632645	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26-/m0/s1	QXMKZAKCOIHKOR-ANSQWYIGSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K39617634	BRD-K39617634-001-01-3	Broad Institute of MIT and Harvard	BRD-K39617634			CO[C@@H]1[C@@H](C)CN(CC2CC2)[C@H](C)COc2cc(ccc2C(=O)N(C)C1)NC(=O)c1cccc(F)c1	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26-/m0/s1	QXMKZAKCOIHKOR-ANSQWYIGSA-N	497.268984862							122735
BRD-K30467307	LSM-34179		54632623	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18+/m0/s1	RENPXZBPSBTSHX-VEVIJQCQSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)NC[C@@H]1C	BroadT	BRD-K30467307	BRD-K30467307-001-01-8	Broad Institute of MIT and Harvard	BRD-K30467307			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)NC[C@@H]1C	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13+,18+/m0/s1	RENPXZBPSBTSHX-VEVIJQCQSA-N	363.215806438							122736
BRD-K71537579	LSM-34180		54632604	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16+,21-/m1/s1	FGFJNWQPGUBCRY-VWKPWSFCSA-N	CCCNC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)C	BroadT	BRD-K71537579	BRD-K71537579-001-01-9	Broad Institute of MIT and Harvard	BRD-K71537579			CCCNC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(C)=O)c1	InChI=1S/C23H36N4O5/c1-7-10-24-23(30)25-18-8-9-19-20(11-18)32-14-16(3)27(17(4)28)12-15(2)21(31-6)13-26(5)22(19)29/h8-9,11,15-16,21H,7,10,12-14H2,1-6H3,(H2,24,25,30)/t15-,16+,21-/m1/s1	FGFJNWQPGUBCRY-VWKPWSFCSA-N	448.268570292							122737
BRD-K10313926	LSM-34181		54632831	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22-,28+/m1/s1	NCAOWLICBBXJJW-XJGOYTCSSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K10313926	BRD-K10313926-001-01-9	Broad Institute of MIT and Harvard	BRD-K10313926			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C30H42N4O4/c1-21-17-34(18-23-9-8-14-31-16-23)22(2)20-38-27-15-25(32-29(35)24-10-6-5-7-11-24)12-13-26(27)30(36)33(3)19-28(21)37-4/h8-9,12-16,21-22,24,28H,5-7,10-11,17-20H2,1-4H3,(H,32,35)/t21-,22-,28+/m1/s1	NCAOWLICBBXJJW-XJGOYTCSSA-N	522.320605864							122738
BRD-K40471860	LSM-34182		54632818	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-8-7-16(21-15(3)24)9-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14+,19-/m1/s1	VZXWWTHKMGUIJI-BIENJYKASA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)N(C[C@H]1C)S(=O)(=O)C	BroadT	BRD-K40471860	BRD-K40471860-001-01-7	Broad Institute of MIT and Harvard	BRD-K40471860			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)N(C[C@H]1C)S(C)(=O)=O	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-8-7-16(21-15(3)24)9-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14+,19-/m1/s1	VZXWWTHKMGUIJI-BIENJYKASA-N	441.193356432							122739
BRD-K48946249	LSM-34183		54632832	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16+,20-/m1/s1	WSQGAZSPVHYFJA-GQIGUUNPSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@@H](C)COc2c1)C(=O)COC	BroadT	BRD-K48946249	BRD-K48946249-001-01-2	Broad Institute of MIT and Harvard	BRD-K48946249			CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)COC)c1	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16+,20-/m1/s1	WSQGAZSPVHYFJA-GQIGUUNPSA-N	449.25258587							122740
BRD-K71415389	LSM-34184		54632826	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18+,24-/m1/s1	SADWOVYOXJOVIV-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc4cncnc4)C[C@H]1C	BroadT	BRD-K71415389	BRD-K71415389-001-01-8	Broad Institute of MIT and Harvard	BRD-K71415389			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18+,24-/m1/s1	SADWOVYOXJOVIV-NXMSCROESA-N	481.26890465							122741
BRD-K31407552	LSM-34185		54632806	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-8-15(24-32(28,29)12-20(21,22)23)6-7-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14-,18+/m1/s1	PLIZPBUQBLYJFD-LBTNJELSSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K31407552	BRD-K31407552-001-01-5	Broad Institute of MIT and Harvard	BRD-K31407552			CO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-8-15(24-32(28,29)12-20(21,22)23)6-7-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14-,18+/m1/s1	PLIZPBUQBLYJFD-LBTNJELSSA-N	481.18582638							122742
BRD-K24090480	LSM-34186		54632795	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28-/m1/s1	SLSVJKSFTBBFSH-RZIGYZOXSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K24090480	BRD-K24090480-001-01-5	Broad Institute of MIT and Harvard	BRD-K24090480			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28-/m1/s1	SLSVJKSFTBBFSH-RZIGYZOXSA-N	552.240640982							122743
BRD-K32201912	LSM-34187		54632857	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18-,22-/m0/s1	CBWRNOSECAFSLQ-SPEDKVCISA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@@H]1C)OC	BroadT	BRD-K32201912	BRD-K32201912-001-01-6	Broad Institute of MIT and Harvard	BRD-K32201912			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18-,22-/m0/s1	CBWRNOSECAFSLQ-SPEDKVCISA-N	433.294056758							122744
BRD-K25467556	LSM-34188		54632658	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28-/m1/s1	HUDWACAATGSXNV-PHVLTXCSSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@H](C)NC[C@H]1C	BroadT	BRD-K25467556	BRD-K25467556-001-01-3	Broad Institute of MIT and Harvard	BRD-K25467556			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@H](C)NC[C@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21+,28-/m1/s1	HUDWACAATGSXNV-PHVLTXCSSA-N	517.25767125							122745
CHEMBL2355535	LSM-34189	BRD-K61944729, SID131429062	54632813	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18-,24+/m1/s1	SADWOVYOXJOVIV-GGUMNFRJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc4cncnc4)C[C@H]1C	BroadT	BRD-K61944729	BRD-K61944729-001-01-8	Broad Institute of MIT and Harvard	BRD-K61944729			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18-,24+/m1/s1	SADWOVYOXJOVIV-GGUMNFRJSA-N	481.26890465							122746
BRD-K17997527	LSM-34190		54632732	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17-,21+/m1/s1	QGILEVYYFFUMMM-LZJOCLMNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K17997527	BRD-K17997527-001-01-5	Broad Institute of MIT and Harvard	BRD-K17997527			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17-,21+/m1/s1	QGILEVYYFFUMMM-LZJOCLMNSA-N	561.223274528							122747
BRD-K46424704	LSM-34191		54632576	InChI=1S/C22H36N4O6S/c1-7-10-23-22(28)26-12-15(2)20(31-5)13-25(4)21(27)18-11-17(24-33(6,29)30)8-9-19(18)32-14-16(26)3/h8-9,11,15-16,20,24H,7,10,12-14H2,1-6H3,(H,23,28)/t15-,16-,20+/m0/s1	FSCFODAWIHEFCQ-TWOQFEAHSA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(=O)(=O)C)ccc2OC[C@@H]1C)OC	BroadT	BRD-K46424704	BRD-K46424704-001-01-0	Broad Institute of MIT and Harvard	BRD-K46424704			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NS(C)(=O)=O)ccc2OC[C@@H]1C)OC	InChI=1S/C22H36N4O6S/c1-7-10-23-22(28)26-12-15(2)20(31-5)13-25(4)21(27)18-11-17(24-33(6,29)30)8-9-19(18)32-14-16(26)3/h8-9,11,15-16,20,24H,7,10,12-14H2,1-6H3,(H,23,28)/t15-,16-,20+/m0/s1	FSCFODAWIHEFCQ-TWOQFEAHSA-N	484.235555602							122748
BRD-K44817056	LSM-34192		54632782	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18+,24-/m0/s1	SADWOVYOXJOVIV-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc4cncnc4)C[C@@H]1C	BroadT	BRD-K44817056	BRD-K44817056-001-01-1	Broad Institute of MIT and Harvard	BRD-K44817056			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18+,24-/m0/s1	SADWOVYOXJOVIV-RHGYRFJNSA-N	481.26890465							122749
BRD-K53988643	LSM-34193		54632814	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17+,22+/m0/s1	WEZMNWQXUMSVMO-GSHUGGBRSA-N	COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	BroadT	BRD-K53988643	BRD-K53988643-001-01-8	Broad Institute of MIT and Harvard	BRD-K53988643			COCC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17+,22+/m0/s1	WEZMNWQXUMSVMO-GSHUGGBRSA-N	475.268235934							122750
BRD-K05251636	LSM-34194		54632614	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18-,24-/m0/s1	SADWOVYOXJOVIV-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc4cncnc4)C[C@@H]1C	BroadT	BRD-K05251636	BRD-K05251636-001-01-9	Broad Institute of MIT and Harvard	BRD-K05251636			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@@H]1C	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18-,24-/m0/s1	SADWOVYOXJOVIV-XFAGBWLFSA-N	481.26890465							122751
BRD-K10058823	LSM-34195		54632646	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25+/m1/s1	LCEYSZSEEBOWFL-UZEJHQAJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K10058823	BRD-K10058823-001-01-4	Broad Institute of MIT and Harvard	BRD-K10058823			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25+/m1/s1	LCEYSZSEEBOWFL-UZEJHQAJSA-N	497.25258587							122752
BRD-K81222311	LSM-34196		54632637	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26+/m0/s1	QXMKZAKCOIHKOR-GNBJCERTSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K81222311	BRD-K81222311-001-01-9	Broad Institute of MIT and Harvard	BRD-K81222311			CO[C@H]1[C@@H](C)CN(CC2CC2)[C@H](C)COc2cc(ccc2C(=O)N(C)C1)NC(=O)c1cccc(F)c1	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26+/m0/s1	QXMKZAKCOIHKOR-GNBJCERTSA-N	497.268984862							122753
BRD-K62774895	LSM-34197		54632835	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20+,25-/m1/s1	OXTPNGYEOOIGNP-OHUGHZGNSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(Cc3ccccn3)[C@@H](C)COc2c1	BroadT	BRD-K62774895	BRD-K62774895-001-01-6	Broad Institute of MIT and Harvard	BRD-K62774895			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccn3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20+,25-/m1/s1	OXTPNGYEOOIGNP-OHUGHZGNSA-N	482.289305736							122754
BRD-K62945025	LSM-34198		54632656	InChI=1S/C26H34N4O6/c1-16-13-30(25(32)18-6-5-7-18)17(2)15-35-22-12-19(28-24(31)21-10-11-27-36-21)8-9-20(22)26(33)29(3)14-23(16)34-4/h8-12,16-18,23H,5-7,13-15H2,1-4H3,(H,28,31)/t16-,17-,23+/m0/s1	LEDDEFHCQXBYIL-HKARXFIJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3oncc3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C4CCC4	BroadT	BRD-K62945025	BRD-K62945025-001-01-5	Broad Institute of MIT and Harvard	BRD-K62945025			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccno3)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)C1CCC1	InChI=1S/C26H34N4O6/c1-16-13-30(25(32)18-6-5-7-18)17(2)15-35-22-12-19(28-24(31)21-10-11-27-36-21)8-9-20(22)26(33)29(3)14-23(16)34-4/h8-12,16-18,23H,5-7,13-15H2,1-4H3,(H,28,31)/t16-,17-,23+/m0/s1	LEDDEFHCQXBYIL-HKARXFIJSA-N	498.247834848							122755
BRD-K17553342	LSM-34199		54632837	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24+/m0/s1	PGRNYZHGQKBFKV-OBWXTZQISA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K17553342	BRD-K17553342-001-01-9	Broad Institute of MIT and Harvard	BRD-K17553342			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24+/m0/s1	PGRNYZHGQKBFKV-OBWXTZQISA-N	500.243498396							122756
BRD-K04256929	LSM-34200		54632836	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25+/m0/s1	LCEYSZSEEBOWFL-DPOKWSEZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K04256929	BRD-K04256929-001-01-5	Broad Institute of MIT and Harvard	BRD-K04256929			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18-,25+/m0/s1	LCEYSZSEEBOWFL-DPOKWSEZSA-N	497.25258587							122757
BRD-K11404512	LSM-34201		54632866	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28-/m1/s1	HUDWACAATGSXNV-UMQWNRPGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@@H](C)NC[C@H]1C	BroadT	BRD-K11404512	BRD-K11404512-001-01-5	Broad Institute of MIT and Harvard	BRD-K11404512			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(Oc4ccccc4)cc3)ccc2OC[C@@H](C)NC[C@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-15-12-23(16-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-10-13-25(14-11-22)38-24-8-6-5-7-9-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28-/m1/s1	HUDWACAATGSXNV-UMQWNRPGSA-N	517.25767125							122758
BRD-K46994278	LSM-34202		54632830	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-23-11-10-20(13-22(23)25(31)30(4)15-24(17)34-6)28-26(32)27-19-8-7-9-21(12-19)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24+/m1/s1	XDWPDFGHDYXRAH-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K46994278	BRD-K46994278-001-01-8	Broad Institute of MIT and Harvard	BRD-K46994278			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-23-11-10-20(13-22(23)25(31)30(4)15-24(17)34-6)28-26(32)27-19-8-7-9-21(12-19)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18+,24+/m1/s1	XDWPDFGHDYXRAH-YTZAWJCFSA-N	484.268570292							122759
BRD-K49472569	LSM-34203		54632846	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17-,22-/m1/s1	WEZMNWQXUMSVMO-DRSNIGMVSA-N	COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	BroadT	BRD-K49472569	BRD-K49472569-001-01-0	Broad Institute of MIT and Harvard	BRD-K49472569			COCC(=O)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@H]1C)OC	InChI=1S/C25H37N3O6/c1-16-12-28(23(29)15-32-4)17(2)14-34-21-10-9-19(26-24(30)18-7-6-8-18)11-20(21)25(31)27(3)13-22(16)33-5/h9-11,16-18,22H,6-8,12-15H2,1-5H3,(H,26,30)/t16-,17-,22-/m1/s1	WEZMNWQXUMSVMO-DRSNIGMVSA-N	475.268235934							122760
BRD-K35664036	LSM-34204		54632734	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m0/s1	MAKKLZBPABPJBZ-XLNZFTOWSA-N	CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCC3	BroadT	BRD-K35664036	BRD-K35664036-001-01-3	Broad Institute of MIT and Harvard	BRD-K35664036			CCCC(=O)Nc1ccc2OC[C@@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCC1	InChI=1S/C27H41N3O5/c1-6-9-25(31)28-21-12-13-23-22(14-21)27(33)29(4)16-24(34-5)18(2)15-30(19(3)17-35-23)26(32)20-10-7-8-11-20/h12-14,18-20,24H,6-11,15-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m0/s1	MAKKLZBPABPJBZ-XLNZFTOWSA-N	487.304621442							122761
BRD-K71636088	LSM-34205		54632654	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20-,25+/m0/s1	OXTPNGYEOOIGNP-ZYLNGJIFSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(Cc3ccccn3)[C@@H](C)COc2c1	BroadT	BRD-K71636088	BRD-K71636088-001-01-3	Broad Institute of MIT and Harvard	BRD-K71636088			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3ccccn3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H38N4O4/c1-6-9-26(32)29-21-11-12-23-24(14-21)35-18-20(3)31(16-22-10-7-8-13-28-22)15-19(2)25(34-5)17-30(4)27(23)33/h7-8,10-14,19-20,25H,6,9,15-18H2,1-5H3,(H,29,32)/t19-,20-,25+/m0/s1	OXTPNGYEOOIGNP-ZYLNGJIFSA-N	482.289305736							122762
BRD-K18951817	LSM-34206		54632817	InChI=1S/C24H34N4O4S/c1-6-22(29)26-18-7-8-19-20(11-18)32-15-17(3)28(14-23-25-9-10-33-23)12-16(2)21(31-5)13-27(4)24(19)30/h7-11,16-17,21H,6,12-15H2,1-5H3,(H,26,29)/t16-,17+,21+/m1/s1	AIGQWRJTRGZNLS-WWMYMODYSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3nccs3)[C@@H](C)COc2c1	BroadT	BRD-K18951817	BRD-K18951817-001-01-0	Broad Institute of MIT and Harvard	BRD-K18951817			CCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3nccs3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C24H34N4O4S/c1-6-22(29)26-18-7-8-19-20(11-18)32-15-17(3)28(14-23-25-9-10-33-23)12-16(2)21(31-5)13-27(4)24(19)30/h7-11,16-17,21H,6,12-15H2,1-5H3,(H,26,29)/t16-,17+,21+/m1/s1	AIGQWRJTRGZNLS-WWMYMODYSA-N	474.230076298							122763
BRD-K79270741	LSM-34207		54632621	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m1/s1	NCKJLHVNZDVZFX-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K79270741	BRD-K79270741-001-01-2	Broad Institute of MIT and Harvard	BRD-K79270741			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m1/s1	NCKJLHVNZDVZFX-NXMSCROESA-N	469.25767125							122764
BRD-K17367110	LSM-34208		54632745	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-8-15(24-32(28,29)12-20(21,22)23)6-7-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14+,18-/m1/s1	PLIZPBUQBLYJFD-QWQRMKEZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K17367110	BRD-K17367110-001-01-4	Broad Institute of MIT and Harvard	BRD-K17367110			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-8-15(24-32(28,29)12-20(21,22)23)6-7-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14+,18-/m1/s1	PLIZPBUQBLYJFD-QWQRMKEZSA-N	481.18582638							122765
BRD-K81881801-001-01-9	LSM-34209	BRD-K81881801	54632647	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-18(5-6-20(21)23(31)30(3)12-22(14)33-4)28-24(32)29-19-8-16(25)7-17(26)9-19/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22+/m0/s1	WLELUPNUISGFRW-AYSMAOOMSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K81881801	BRD-K81881801-001-01-9	Broad Institute of MIT and Harvard	BRD-K81881801			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C24H30Cl2N4O4/c1-14-11-27-15(2)13-34-21-10-18(5-6-20(21)23(31)30(3)12-22(14)33-4)28-24(32)29-19-8-16(25)7-17(26)9-19/h5-10,14-15,22,27H,11-13H2,1-4H3,(H2,28,29,32)/t14-,15-,22+/m0/s1	WLELUPNUISGFRW-AYSMAOOMSA-N	508.1644109							122766
BRD-K05841284	LSM-34210		54632765	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18+,24+/m1/s1	SADWOVYOXJOVIV-YTZAWJCFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc4cncnc4)C[C@H]1C	BroadT	BRD-K05841284	BRD-K05841284-001-01-2	Broad Institute of MIT and Harvard	BRD-K05841284			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(Cc2cncnc2)C[C@H]1C	InChI=1S/C26H35N5O4/c1-17-12-31(13-19-10-27-16-28-11-19)18(2)15-35-23-8-7-21(29-25(32)20-5-6-20)9-22(23)26(33)30(3)14-24(17)34-4/h7-11,16-18,20,24H,5-6,12-15H2,1-4H3,(H,29,32)/t17-,18+,24+/m1/s1	SADWOVYOXJOVIV-YTZAWJCFSA-N	481.26890465							122767
BRD-K37961770	LSM-34211		54632766	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22+/m0/s1	CBWRNOSECAFSLQ-NJNPRVFISA-N	CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@H]1C)OC	BroadT	BRD-K37961770	BRD-K37961770-001-01-1	Broad Institute of MIT and Harvard	BRD-K37961770			CCCN1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22+/m0/s1	CBWRNOSECAFSLQ-NJNPRVFISA-N	433.294056758							122768
BRD-K53470221	LSM-34212		54632635	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26+/m1/s1	QXMKZAKCOIHKOR-MVYHEMRASA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)N(CC4CC4)C[C@H]1C	BroadT	BRD-K53470221	BRD-K53470221-001-01-7	Broad Institute of MIT and Harvard	BRD-K53470221			CO[C@@H]1[C@H](C)CN(CC2CC2)[C@@H](C)COc2cc(ccc2C(=O)N(C)C1)NC(=O)c1cccc(F)c1	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19+,26+/m1/s1	QXMKZAKCOIHKOR-MVYHEMRASA-N	497.268984862							122769
BRD-K63212062	LSM-34213		54632841	InChI=1S/C27H43N3O5/c1-6-7-26(31)28-22-8-9-23-24(14-22)35-18-20(3)30(16-21-10-12-34-13-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h8-9,14,19-21,25H,6-7,10-13,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	NJXMLEPFNXRBQS-OHUGHZGNSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN(CC3CCOCC3)[C@@H](C)COc2c1	BroadT	BRD-K63212062	BRD-K63212062-001-01-3	Broad Institute of MIT and Harvard	BRD-K63212062			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CCOCC3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O5/c1-6-7-26(31)28-22-8-9-23-24(14-22)35-18-20(3)30(16-21-10-12-34-13-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h8-9,14,19-21,25H,6-7,10-13,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m1/s1	NJXMLEPFNXRBQS-OHUGHZGNSA-N	489.320271506							122770
BRD-K06743007	LSM-34214		54632738	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)28-13-16(3)21(32-6)14-27(5)23(30)19-10-9-18(26-22(29)8-2)12-20(19)33-15-17(28)4/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H,25,31)(H,26,29)/t16-,17-,21+/m0/s1	WYILBQVQDSLHTR-XGHQBKJUSA-N	CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CC)cc2OC[C@@H]1C)OC	BroadT	BRD-K06743007	BRD-K06743007-001-01-5	Broad Institute of MIT and Harvard	BRD-K06743007			CCCNC(=O)N1C[C@H](C)[C@@H](CN(C)C(=O)c2ccc(NC(=O)CC)cc2OC[C@@H]1C)OC	InChI=1S/C24H38N4O5/c1-7-11-25-24(31)28-13-16(3)21(32-6)14-27(5)23(30)19-10-9-18(26-22(29)8-2)12-20(19)33-15-17(28)4/h9-10,12,16-17,21H,7-8,11,13-15H2,1-6H3,(H,25,31)(H,26,29)/t16-,17-,21+/m0/s1	WYILBQVQDSLHTR-XGHQBKJUSA-N	462.284220356							122771
BRD-K07414059	LSM-34215		54632629	InChI=1S/C24H34N4O4S/c1-6-22(29)26-18-7-8-19-20(11-18)32-15-17(3)28(14-23-25-9-10-33-23)12-16(2)21(31-5)13-27(4)24(19)30/h7-11,16-17,21H,6,12-15H2,1-5H3,(H,26,29)/t16-,17+,21-/m0/s1	AIGQWRJTRGZNLS-FVJLSDCUSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3nccs3)[C@H](C)COc2c1	BroadT	BRD-K07414059	BRD-K07414059-001-01-9	Broad Institute of MIT and Harvard	BRD-K07414059			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3nccs3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C24H34N4O4S/c1-6-22(29)26-18-7-8-19-20(11-18)32-15-17(3)28(14-23-25-9-10-33-23)12-16(2)21(31-5)13-27(4)24(19)30/h7-11,16-17,21H,6,12-15H2,1-5H3,(H,26,29)/t16-,17+,21-/m0/s1	AIGQWRJTRGZNLS-FVJLSDCUSA-N	474.230076298							122772
BRD-K82073510-001-01-4	LSM-34216	BRD-K82073510	54632730	InChI=1S/C27H43N3O5/c1-6-7-26(31)28-22-8-9-23-24(14-22)35-18-20(3)30(16-21-10-12-34-13-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h8-9,14,19-21,25H,6-7,10-13,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	NJXMLEPFNXRBQS-DFIYOIEZSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(CC3CCOCC3)[C@H](C)COc2c1	BroadT	BRD-K82073510	BRD-K82073510-001-01-4	Broad Institute of MIT and Harvard	BRD-K82073510			CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CCOCC3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O5/c1-6-7-26(31)28-22-8-9-23-24(14-22)35-18-20(3)30(16-21-10-12-34-13-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h8-9,14,19-21,25H,6-7,10-13,15-18H2,1-5H3,(H,28,31)/t19-,20+,25-/m0/s1	NJXMLEPFNXRBQS-DFIYOIEZSA-N	489.320271506							122773
BRD-K83551126	LSM-34217		54632776	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m0/s1	NCKJLHVNZDVZFX-LLJLJFOGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K83551126	BRD-K83551126-001-01-4	Broad Institute of MIT and Harvard	BRD-K83551126			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccc(OC)cc3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-9-20(13-22(23)26(31)29(4)15-24(17)33-6)27-25(30)19-7-10-21(32-5)11-8-19/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24+/m0/s1	NCKJLHVNZDVZFX-LLJLJFOGSA-N	469.25767125							122774
BRD-K49254011	LSM-34218		54632674	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-13-21(27-19(3)30)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m0/s1	YAGNFVDOBCIATK-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c3ccccc3	BroadT	BRD-K49254011	BRD-K49254011-001-01-6	Broad Institute of MIT and Harvard	BRD-K49254011			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccc1	InChI=1S/C26H33N3O5/c1-17-14-29(25(31)20-9-7-6-8-10-20)18(2)16-34-23-13-21(27-19(3)30)11-12-22(23)26(32)28(4)15-24(17)33-5/h6-13,17-18,24H,14-16H2,1-5H3,(H,27,30)/t17-,18-,24-/m0/s1	YAGNFVDOBCIATK-XFAGBWLFSA-N	467.242021186							122775
BRD-K13249233	LSM-34219		54632780	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24-/m1/s1	IASRPSUKVFSJOB-QZTZHPFYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@H]1C	BroadT	BRD-K13249233	BRD-K13249233-001-01-0	Broad Institute of MIT and Harvard	BRD-K13249233			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18-,24-/m1/s1	IASRPSUKVFSJOB-QZTZHPFYSA-N	469.25767125							122776
BRD-K17308485	LSM-34220		54632636	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24+/m1/s1	PGRNYZHGQKBFKV-KCYKTTMJSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C	BroadT	BRD-K17308485	BRD-K17308485-001-01-5	Broad Institute of MIT and Harvard	BRD-K17308485			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@H](C)N(C[C@H]1C)C(C)=O	InChI=1S/C26H33FN4O5/c1-16-13-31(18(3)32)17(2)15-36-23-11-10-19(12-20(23)25(33)30(4)14-24(16)35-5)28-26(34)29-22-9-7-6-8-21(22)27/h6-12,16-17,24H,13-15H2,1-5H3,(H2,28,29,34)/t16-,17+,24+/m1/s1	PGRNYZHGQKBFKV-KCYKTTMJSA-N	500.243498396							122777
BRD-K57443386	LSM-34221		54632625	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18-,22+/m1/s1	CBWRNOSECAFSLQ-HMFYCAOWSA-N	CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@H]1C)OC	BroadT	BRD-K57443386	BRD-K57443386-001-01-1	Broad Institute of MIT and Harvard	BRD-K57443386			CCCN1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18-,22+/m1/s1	CBWRNOSECAFSLQ-HMFYCAOWSA-N	433.294056758							122778
BRD-K32259584	LSM-34222		54632585	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18-,23+/m0/s1	OBNHYLURRDQSSE-IUKKYPGJSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CC3CC3)C[C@@H]1C	BroadT	BRD-K32259584	BRD-K32259584-001-01-1	Broad Institute of MIT and Harvard	BRD-K32259584			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18-,23+/m0/s1	OBNHYLURRDQSSE-IUKKYPGJSA-N	460.3049558							122779
BRD-K14671528	LSM-34223		54632791	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-16-23(13-14-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-9-8-12-25(15-22)38-24-10-6-5-7-11-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28+/m0/s1	XTWYRSBCEBGZBY-YHGPEZAFSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(Oc4ccccc4)c3)cc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K14671528	BRD-K14671528-001-01-8	Broad Institute of MIT and Harvard	BRD-K14671528			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(Oc4ccccc4)c3)cc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C30H35N3O5/c1-20-17-31-21(2)19-37-27-16-23(13-14-26(27)30(35)33(3)18-28(20)36-4)32-29(34)22-9-8-12-25(15-22)38-24-10-6-5-7-11-24/h5-16,20-21,28,31H,17-19H2,1-4H3,(H,32,34)/t20-,21-,28+/m0/s1	XTWYRSBCEBGZBY-YHGPEZAFSA-N	517.25767125							122780
BRD-K15086454	LSM-34224		54632797	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-7-6-10-27-12-20)19(2)16-35-23-11-21(28-25(31)17-33-4)8-9-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	MONOFYZVTFTEBW-IECBHUPTSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3cccnc3)[C@H](C)COc2c1	BroadT	BRD-K15086454	BRD-K15086454-001-01-6	Broad Institute of MIT and Harvard	BRD-K15086454			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cccnc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-7-6-10-27-12-20)19(2)16-35-23-11-21(28-25(31)17-33-4)8-9-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19-,24+/m1/s1	MONOFYZVTFTEBW-IECBHUPTSA-N	484.268570292							122781
BRD-K11607947	LSM-34225		54632556	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15-,21+/m0/s1	TWDPSDBESUIWDD-VFCRVFHLSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K11607947	BRD-K11607947-001-01-8	Broad Institute of MIT and Harvard	BRD-K11607947			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15-,21+/m0/s1	TWDPSDBESUIWDD-VFCRVFHLSA-N	473.26381927							122782
BRD-K41289356	LSM-34226		54632581	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18-,25+/m1/s1	UYGLFTDABBDOCR-GAKIBJFNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K41289356	BRD-K41289356-001-01-3	Broad Institute of MIT and Harvard	BRD-K41289356			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1F	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18-,25+/m1/s1	UYGLFTDABBDOCR-GAKIBJFNSA-N	511.248249418							122783
BRD-K34718147	LSM-34227		54632642	InChI=1S/C25H37N3O6/c1-16-12-28(24(30)10-18-6-7-18)17(2)14-34-21-11-19(26-23(29)15-32-4)8-9-20(21)25(31)27(3)13-22(16)33-5/h8-9,11,16-18,22H,6-7,10,12-15H2,1-5H3,(H,26,29)/t16-,17+,22-/m0/s1	GTQGGUJFCSCMSO-JKSBSHDWSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K34718147	BRD-K34718147-001-01-4	Broad Institute of MIT and Harvard	BRD-K34718147			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O6/c1-16-12-28(24(30)10-18-6-7-18)17(2)14-34-21-11-19(26-23(29)15-32-4)8-9-20(21)25(31)27(3)13-22(16)33-5/h8-9,11,16-18,22H,6-7,10,12-15H2,1-5H3,(H,26,29)/t16-,17+,22-/m0/s1	GTQGGUJFCSCMSO-JKSBSHDWSA-N	475.268235934							122784
BRD-K10189430	LSM-34228		54632631	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18+,23-/m0/s1	OBNHYLURRDQSSE-IXFSTUDKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CC3CC3)C[C@@H]1C	BroadT	BRD-K10189430	BRD-K10189430-001-01-2	Broad Institute of MIT and Harvard	BRD-K10189430			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18+,23-/m0/s1	OBNHYLURRDQSSE-IXFSTUDKSA-N	460.3049558							122785
BRD-K33956247	LSM-34229		54632769	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15+,21-/m1/s1	TWDPSDBESUIWDD-LRAJWGHMSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)onc3C)ccc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K33956247	BRD-K33956247-001-01-0	Broad Institute of MIT and Harvard	BRD-K33956247			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3c(C)noc3C)ccc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C24H35N5O5/c1-14-11-28(5)15(2)13-33-20-9-8-18(10-19(20)23(30)29(6)12-21(14)32-7)25-24(31)26-22-16(3)27-34-17(22)4/h8-10,14-15,21H,11-13H2,1-7H3,(H2,25,26,31)/t14-,15+,21-/m1/s1	TWDPSDBESUIWDD-LRAJWGHMSA-N	473.26381927							122786
BRD-K00396506	LSM-34230		54632550	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25+/m0/s1	LCEYSZSEEBOWFL-YYULODDRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(=O)C	BroadT	BRD-K00396506	BRD-K00396506-001-01-4	Broad Institute of MIT and Harvard	BRD-K00396506			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(C[C@@H]1C)C(C)=O	InChI=1S/C27H35N3O6/c1-17-14-30(19(3)31)18(2)16-36-24-11-10-21(13-23(24)27(33)29(4)15-25(17)35-6)28-26(32)20-8-7-9-22(12-20)34-5/h7-13,17-18,25H,14-16H2,1-6H3,(H,28,32)/t17-,18+,25+/m0/s1	LCEYSZSEEBOWFL-YYULODDRSA-N	497.25258587							122787
BRD-K64657389	LSM-34231		54632696	InChI=1S/C28H33ClN4O7S/c1-17-14-33(41(36,37)22-8-6-7-20(29)12-22)18(2)16-39-25-13-21(30-27(34)24-11-19(3)40-31-24)9-10-23(25)28(35)32(4)15-26(17)38-5/h6-13,17-18,26H,14-16H2,1-5H3,(H,30,34)/t17-,18-,26-/m1/s1	MZLGDOJSDLVZKY-UYPAYLBCSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c4cccc(Cl)c4	BroadT	BRD-K64657389	BRD-K64657389-001-01-4	Broad Institute of MIT and Harvard	BRD-K64657389			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C28H33ClN4O7S/c1-17-14-33(41(36,37)22-8-6-7-20(29)12-22)18(2)16-39-25-13-21(30-27(34)24-11-19(3)40-31-24)9-10-23(25)28(35)32(4)15-26(17)38-5/h6-13,17-18,26H,14-16H2,1-5H3,(H,30,34)/t17-,18-,26-/m1/s1	MZLGDOJSDLVZKY-UYPAYLBCSA-N	604.175847836							122788
BRD-K76500652	LSM-34232		54632628	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18-,23+/m0/s1	MQBPYFVBIBWVKN-IUKKYPGJSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC3CC3	BroadT	BRD-K76500652	BRD-K76500652-001-01-2	Broad Institute of MIT and Harvard	BRD-K76500652			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC1CC1	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18-,23+/m0/s1	MQBPYFVBIBWVKN-IUKKYPGJSA-N	473.288971378							122789
BRD-K21139023	LSM-34233		54632827	InChI=1S/C31H41N3O7/c1-20-17-34(30(36)22-11-13-40-14-12-22)21(2)19-41-27-10-9-24(16-26(27)31(37)33(3)18-28(20)39-5)32-29(35)23-7-6-8-25(15-23)38-4/h6-10,15-16,20-22,28H,11-14,17-19H2,1-5H3,(H,32,35)/t20-,21-,28-/m1/s1	JXILDVLFAGVHGQ-UMQWNRPGSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C4CCOCC4	BroadT	BRD-K21139023	BRD-K21139023-001-01-7	Broad Institute of MIT and Harvard	BRD-K21139023			CO[C@@H]1CN(C)C(=O)c2cc(ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)C1CCOCC1)NC(=O)c1cccc(OC)c1	InChI=1S/C31H41N3O7/c1-20-17-34(30(36)22-11-13-40-14-12-22)21(2)19-41-27-10-9-24(16-26(27)31(37)33(3)18-28(20)39-5)32-29(35)23-7-6-8-25(15-23)38-4/h6-10,15-16,20-22,28H,11-14,17-19H2,1-5H3,(H,32,35)/t20-,21-,28-/m1/s1	JXILDVLFAGVHGQ-UMQWNRPGSA-N	567.294450682							122790
BRD-K74705119	LSM-34234		54632688	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-23-11-10-20(13-22(23)25(31)30(4)15-24(17)34-6)28-26(32)27-19-8-7-9-21(12-19)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24-/m0/s1	XDWPDFGHDYXRAH-XFAGBWLFSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K74705119	BRD-K74705119-001-01-6	Broad Institute of MIT and Harvard	BRD-K74705119			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)Nc3cccc(OC)c3)ccc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C26H36N4O5/c1-17-14-29(3)18(2)16-35-23-11-10-20(13-22(23)25(31)30(4)15-24(17)34-6)28-26(32)27-19-8-7-9-21(12-19)33-5/h7-13,17-18,24H,14-16H2,1-6H3,(H2,27,28,32)/t17-,18-,24-/m0/s1	XDWPDFGHDYXRAH-XFAGBWLFSA-N	484.268570292							122791
BRD-K21128465	LSM-34235		54632694	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23+/m0/s1	UUOIXUNLVHGQEP-YZZKKUAISA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC3CC3	BroadT	BRD-K21128465	BRD-K21128465-001-01-5	Broad Institute of MIT and Harvard	BRD-K21128465			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@@H](C)N(C[C@@H]1C)C(=O)CC1CC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23+/m0/s1	UUOIXUNLVHGQEP-YZZKKUAISA-N	488.29987042							122792
BRD-K38901607	LSM-34236		54632709	InChI=1S/C33H37N3O8/c1-20-14-36(15-22-5-9-26-29(11-22)43-18-41-26)21(2)17-40-28-13-24(7-8-25(28)33(38)35(3)16-31(20)39-4)34-32(37)23-6-10-27-30(12-23)44-19-42-27/h5-13,20-21,31H,14-19H2,1-4H3,(H,34,37)/t20-,21-,31-/m1/s1	RAUAIKRQHBPTMD-PAZSBGSYSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@@H](C)N(Cc5ccc6OCOc6c5)C[C@H]1C	BroadT	BRD-K38901607	BRD-K38901607-001-01-5	Broad Institute of MIT and Harvard	BRD-K38901607			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc4OCOc4c3)cc2OC[C@@H](C)N(Cc2ccc3OCOc3c2)C[C@H]1C	InChI=1S/C33H37N3O8/c1-20-14-36(15-22-5-9-26-29(11-22)43-18-41-26)21(2)17-40-28-13-24(7-8-25(28)33(38)35(3)16-31(20)39-4)34-32(37)23-6-10-27-30(12-23)44-19-42-27/h5-13,20-21,31H,14-19H2,1-4H3,(H,34,37)/t20-,21-,31-/m1/s1	RAUAIKRQHBPTMD-PAZSBGSYSA-N	603.258065174							122793
BRD-K59870481	LSM-34237		54632859	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,26+/m1/s1	DKSPUDZDLBRLRD-KYTVRQNUSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc4ccccn4)C[C@H]1C	BroadT	BRD-K59870481	BRD-K59870481-001-01-7	Broad Institute of MIT and Harvard	BRD-K59870481			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C3CCC3)ccc2OC[C@@H](C)N(Cc2ccccn2)C[C@H]1C	InChI=1S/C28H38N4O4/c1-19-15-32(16-23-10-5-6-13-29-23)20(2)18-36-25-12-11-22(30-27(33)21-8-7-9-21)14-24(25)28(34)31(3)17-26(19)35-4/h5-6,10-14,19-21,26H,7-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,26+/m1/s1	DKSPUDZDLBRLRD-KYTVRQNUSA-N	494.289305736							122794
BRD-K21848736	LSM-34238		54632662	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28+/m0/s1	SLSVJKSFTBBFSH-PFPZSTESSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc4cccnc4)C[C@@H]1C	BroadT	BRD-K21848736	BRD-K21848736-001-01-1	Broad Institute of MIT and Harvard	BRD-K21848736			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22+,28+/m0/s1	SLSVJKSFTBBFSH-PFPZSTESSA-N	552.240640982							122795
BRD-K52551495	LSM-34239		54632700	InChI=1S/C29H38ClN3O6S/c1-19-16-33(40(36,37)24-12-9-22(30)10-13-24)20(2)18-39-26-15-23(31-28(34)21-7-5-6-8-21)11-14-25(26)29(35)32(3)17-27(19)38-4/h9-15,19-21,27H,5-8,16-18H2,1-4H3,(H,31,34)/t19-,20-,27-/m1/s1	JCMHFEDFJVIEET-SEXOINJZSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c4ccc(Cl)cc4	BroadT	BRD-K52551495	BRD-K52551495-001-01-4	Broad Institute of MIT and Harvard	BRD-K52551495			CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)C3CCCC3)cc2OC[C@@H](C)N(C[C@H]1C)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C29H38ClN3O6S/c1-19-16-33(40(36,37)24-12-9-22(30)10-13-24)20(2)18-39-26-15-23(31-28(34)21-7-5-6-8-21)11-14-25(26)29(35)32(3)17-27(19)38-4/h9-15,19-21,27H,5-8,16-18H2,1-4H3,(H,31,34)/t19-,20-,27-/m1/s1	JCMHFEDFJVIEET-SEXOINJZSA-N	591.216984366							122796
BRD-K19439598	LSM-34240		54632698	InChI=1S/C25H37N3O6/c1-16-12-28(24(30)10-18-6-7-18)17(2)14-34-21-11-19(26-23(29)15-32-4)8-9-20(21)25(31)27(3)13-22(16)33-5/h8-9,11,16-18,22H,6-7,10,12-15H2,1-5H3,(H,26,29)/t16-,17-,22-/m1/s1	GTQGGUJFCSCMSO-DRSNIGMVSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@H](C)CN([C@H](C)COc2c1)C(=O)CC3CC3	BroadT	BRD-K19439598	BRD-K19439598-001-01-0	Broad Institute of MIT and Harvard	BRD-K19439598			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@@H](C)[C@@H](CN(C)C2=O)OC)C(=O)CC2CC2)c1	InChI=1S/C25H37N3O6/c1-16-12-28(24(30)10-18-6-7-18)17(2)14-34-21-11-19(26-23(29)15-32-4)8-9-20(21)25(31)27(3)13-22(16)33-5/h8-9,11,16-18,22H,6-7,10,12-15H2,1-5H3,(H,26,29)/t16-,17-,22-/m1/s1	GTQGGUJFCSCMSO-DRSNIGMVSA-N	475.268235934							122797
BRD-K00491559	LSM-34241		54632756	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18+,23-/m1/s1	MQBPYFVBIBWVKN-IEGUWTFLSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC3CC3	BroadT	BRD-K00491559	BRD-K00491559-001-01-9	Broad Institute of MIT and Harvard	BRD-K00491559			CCCC(=O)Nc1ccc2OC[C@H](C)N(C[C@@H](C)[C@@H](CN(C)C(=O)c2c1)OC)C(=O)CC1CC1	InChI=1S/C26H39N3O5/c1-6-7-24(30)27-20-10-11-22-21(13-20)26(32)28(4)15-23(33-5)17(2)14-29(18(3)16-34-22)25(31)12-19-8-9-19/h10-11,13,17-19,23H,6-9,12,14-16H2,1-5H3,(H,27,30)/t17-,18+,23-/m1/s1	MQBPYFVBIBWVKN-IEGUWTFLSA-N	473.288971378							122798
BRD-K15732820	LSM-34242		54632711	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28-/m1/s1	SLSVJKSFTBBFSH-DQCZWYHMSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc4cccnc4)C[C@H]1C	BroadT	BRD-K15732820	BRD-K15732820-001-01-2	Broad Institute of MIT and Harvard	BRD-K15732820			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C	InChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28-/m1/s1	SLSVJKSFTBBFSH-DQCZWYHMSA-N	552.240640982							122799
BRD-K23244363	LSM-34243		54632812	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23+/m1/s1	UUOIXUNLVHGQEP-STSQHVNTSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CC3CC3	BroadT	BRD-K23244363	BRD-K23244363-001-01-1	Broad Institute of MIT and Harvard	BRD-K23244363			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)NC(C)C)cc2OC[C@H](C)N(C[C@H]1C)C(=O)CC1CC1	InChI=1S/C26H40N4O5/c1-16(2)27-26(33)28-20-9-10-21-22(12-20)35-15-18(4)30(24(31)11-19-7-8-19)13-17(3)23(34-6)14-29(5)25(21)32/h9-10,12,16-19,23H,7-8,11,13-15H2,1-6H3,(H2,27,28,33)/t17-,18+,23+/m1/s1	UUOIXUNLVHGQEP-STSQHVNTSA-N	488.29987042							122800
BRD-K03923461	LSM-34244		54632807	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18-,25+/m0/s1	UYGLFTDABBDOCR-DPOKWSEZSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c4ccccc4F	BroadT	BRD-K03923461	BRD-K03923461-001-01-5	Broad Institute of MIT and Harvard	BRD-K03923461			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@@H]1C)C(=O)c1ccccc1F	InChI=1S/C28H34FN3O5/c1-17-14-32(28(35)21-7-5-6-8-23(21)29)18(2)16-37-24-12-11-20(30-26(33)19-9-10-19)13-22(24)27(34)31(3)15-25(17)36-4/h5-8,11-13,17-19,25H,9-10,14-16H2,1-4H3,(H,30,33)/t17-,18-,25+/m0/s1	UYGLFTDABBDOCR-DPOKWSEZSA-N	511.248249418							122801
BRD-K27203177-001-01-9	LSM-34245	BRD-K27203177	54632752	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m0/s1	IASRPSUKVFSJOB-RHGYRFJNSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@@H]1C	BroadT	BRD-K27203177	BRD-K27203177-001-01-9	Broad Institute of MIT and Harvard	BRD-K27203177			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)c3ccccc3OC)ccc2OC[C@@H](C)N(C)C[C@@H]1C	InChI=1S/C26H35N3O5/c1-17-14-28(3)18(2)16-34-23-12-11-19(13-21(23)26(31)29(4)15-24(17)33-6)27-25(30)20-9-7-8-10-22(20)32-5/h7-13,17-18,24H,14-16H2,1-6H3,(H,27,30)/t17-,18+,24-/m0/s1	IASRPSUKVFSJOB-RHGYRFJNSA-N	469.25767125							122802
BRD-K92470355	LSM-34246		54632799	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-7-6-10-27-12-20)19(2)16-35-23-11-21(28-25(31)17-33-4)8-9-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	MONOFYZVTFTEBW-IMWIBFENSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3cccnc3)[C@@H](C)COc2c1	BroadT	BRD-K92470355	BRD-K92470355-001-01-8	Broad Institute of MIT and Harvard	BRD-K92470355			COCC(=O)Nc1ccc2c(OC[C@H](C)N(Cc3cccnc3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-7-6-10-27-12-20)19(2)16-35-23-11-21(28-25(31)17-33-4)8-9-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24+/m1/s1	MONOFYZVTFTEBW-IMWIBFENSA-N	484.268570292							122803
BRD-K26272845	LSM-34247		54632565	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20-,25-/m0/s1	VUNNIGMMXHQHNM-RLSLOFABSA-N	CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C3CCCCC3	BroadT	BRD-K26272845	BRD-K26272845-001-01-7	Broad Institute of MIT and Harvard	BRD-K26272845			CCCNC(=O)Nc1ccc2OC[C@H](C)N(C[C@H](C)[C@H](CN(C)C(=O)c2c1)OC)C(=O)C1CCCCC1	InChI=1S/C28H44N4O5/c1-6-14-29-28(35)30-22-12-13-24-23(15-22)27(34)31(4)17-25(36-5)19(2)16-32(20(3)18-37-24)26(33)21-10-8-7-9-11-21/h12-13,15,19-21,25H,6-11,14,16-18H2,1-5H3,(H2,29,30,35)/t19-,20-,25-/m0/s1	VUNNIGMMXHQHNM-RLSLOFABSA-N	516.331170548							122804
BRD-K16279128	LSM-34248		54632808	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-7-10-23(33-5)11-8-21)19(2)17-35-25-13-22(28-20(3)31)9-12-24(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19-,26+/m1/s1	PBVUUWJEAMTKEB-UDCNLSRBSA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)C)cc2OC[C@@H](C)N(Cc3ccc(OC)cc3)C[C@H]1C	BroadT	BRD-K16279128	BRD-K16279128-001-01-2	Broad Institute of MIT and Harvard	BRD-K16279128			CO[C@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(Cc2ccc(OC)cc2)C[C@H]1C	InChI=1S/C27H37N3O5/c1-18-14-30(15-21-7-10-23(33-5)11-8-21)19(2)17-35-25-13-22(28-20(3)31)9-12-24(25)27(32)29(4)16-26(18)34-6/h7-13,18-19,26H,14-17H2,1-6H3,(H,28,31)/t18-,19-,26+/m1/s1	PBVUUWJEAMTKEB-UDCNLSRBSA-N	483.273321314							122805
BRD-K30347134	LSM-34249		54632670	InChI=1S/C29H33FN6O5/c1-18-15-36(28(38)24-14-31-11-12-32-24)19(2)17-41-25-10-9-20(13-21(25)27(37)35(3)16-26(18)40-4)33-29(39)34-23-8-6-5-7-22(23)30/h5-14,18-19,26H,15-17H2,1-4H3,(H2,33,34,39)/t18-,19-,26-/m1/s1	QJGUAZBCTOWVDG-LJKQEARRSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c4cnccn4	BroadT	BRD-K30347134	BRD-K30347134-001-01-1	Broad Institute of MIT and Harvard	BRD-K30347134			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccccc3F)ccc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1cnccn1	InChI=1S/C29H33FN6O5/c1-18-15-36(28(38)24-14-31-11-12-32-24)19(2)17-41-25-10-9-20(13-21(25)27(37)35(3)16-26(18)40-4)33-29(39)34-23-8-6-5-7-22(23)30/h5-14,18-19,26H,15-17H2,1-4H3,(H2,33,34,39)/t18-,19-,26-/m1/s1	QJGUAZBCTOWVDG-LJKQEARRSA-N	564.249646416							122806
BRD-K90736603	LSM-34250		54632561	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18-,23-/m0/s1	OBNHYLURRDQSSE-BSRJHKFKSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CC3CC3)C[C@@H]1C	BroadT	BRD-K90736603	BRD-K90736603-001-01-4	Broad Institute of MIT and Harvard	BRD-K90736603			CO[C@H]1CN(C)C(=O)c2cc(NC(=O)NC(C)C)ccc2OC[C@H](C)N(CC2CC2)C[C@@H]1C	InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18-,23-/m0/s1	OBNHYLURRDQSSE-BSRJHKFKSA-N	460.3049558							122807
BRD-K21765169	LSM-34251		54632679	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19-,26-/m0/s1	QXMKZAKCOIHKOR-DGUDUIIESA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2OC[C@H](C)N(CC4CC4)C[C@@H]1C	BroadT	BRD-K21765169	BRD-K21765169-001-01-3	Broad Institute of MIT and Harvard	BRD-K21765169			CO[C@@H]1[C@@H](C)CN(CC2CC2)[C@@H](C)COc2cc(ccc2C(=O)N(C)C1)NC(=O)c1cccc(F)c1	InChI=1S/C28H36FN3O4/c1-18-14-32(15-20-8-9-20)19(2)17-36-25-13-23(30-27(33)21-6-5-7-22(29)12-21)10-11-24(25)28(34)31(3)16-26(18)35-4/h5-7,10-13,18-20,26H,8-9,14-17H2,1-4H3,(H,30,33)/t18-,19-,26-/m0/s1	QXMKZAKCOIHKOR-DGUDUIIESA-N	497.268984862							122808
BRD-K32168165	LSM-34252		54632779	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17+,21+/m1/s1	QGILEVYYFFUMMM-WWMYMODYSA-N	CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	BroadT	BRD-K32168165	BRD-K32168165-001-01-1	Broad Institute of MIT and Harvard	BRD-K32168165			CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@H]1C	InChI=1S/C24H34F3N5O5S/c1-16-11-32(9-8-24(25,26)27)17(2)14-37-20-7-6-18(29-38(34,35)22-13-30(3)15-28-22)10-19(20)23(33)31(4)12-21(16)36-5/h6-7,10,13,15-17,21,29H,8-9,11-12,14H2,1-5H3/t16-,17+,21+/m1/s1	QGILEVYYFFUMMM-WWMYMODYSA-N	561.223274528							122809
CHEMBL2354940	LSM-34253	BRD-K53687734, SID131429043	54632794	InChI=1S/C29H36F3N5O5S/c1-19-13-37(14-21-6-8-22(9-7-21)29(30,31)32)20(2)17-42-25-11-10-23(34-43(39,40)27-16-35(3)18-33-27)12-24(25)28(38)36(4)15-26(19)41-5/h6-12,16,18-20,26,34H,13-15,17H2,1-5H3/t19-,20-,26-/m1/s1	PFYWUDHNGCJFOI-XMERXJNXSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(Cc4ccc(cc4)C(F)(F)F)C[C@H]1C	BroadT	BRD-K53687734	BRD-K53687734-001-01-6	Broad Institute of MIT and Harvard	BRD-K53687734			CO[C@@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3cn(C)cn3)ccc2OC[C@@H](C)N(Cc2ccc(cc2)C(F)(F)F)C[C@H]1C	InChI=1S/C29H36F3N5O5S/c1-19-13-37(14-21-6-8-22(9-7-21)29(30,31)32)20(2)17-42-25-11-10-23(34-43(39,40)27-16-35(3)18-33-27)12-24(25)28(38)36(4)15-26(19)41-5/h6-12,16,18-20,26,34H,13-15,17H2,1-5H3/t19-,20-,26-/m1/s1	PFYWUDHNGCJFOI-XMERXJNXSA-N	623.238924592							122810
BRD-K54881917	LSM-34254		54632606	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-8-15(24-32(28,29)12-20(21,22)23)6-7-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14-,18+/m0/s1	PLIZPBUQBLYJFD-SUNYJGFJSA-N	CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(C)C[C@@H]1C	BroadT	BRD-K54881917	BRD-K54881917-001-01-3	Broad Institute of MIT and Harvard	BRD-K54881917			CO[C@@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)CC(F)(F)F)cc2OC[C@H](C)N(C)C[C@@H]1C	InChI=1S/C20H30F3N3O5S/c1-13-9-25(3)14(2)11-31-17-8-15(24-32(28,29)12-20(21,22)23)6-7-16(17)19(27)26(4)10-18(13)30-5/h6-8,13-14,18,24H,9-12H2,1-5H3/t13-,14-,18+/m0/s1	PLIZPBUQBLYJFD-SUNYJGFJSA-N	481.18582638							122811
BRD-K04425475-001-01-4	LSM-34255	BRD-K04425475	54632751	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17+,21+/m1/s1	HECXZILGRZYZSJ-WWMYMODYSA-N	CCCC(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	BroadT	BRD-K04425475	BRD-K04425475-001-01-4	Broad Institute of MIT and Harvard	BRD-K04425475			CCCC(=O)Nc1ccc2OC[C@H](C)N(CCC(F)(F)F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC	InChI=1S/C24H36F3N3O4/c1-6-7-22(31)28-18-8-9-20-19(12-18)23(32)29(4)14-21(33-5)16(2)13-30(17(3)15-34-20)11-10-24(25,26)27/h8-9,12,16-17,21H,6-7,10-11,13-15H2,1-5H3,(H,28,31)/t16-,17+,21+/m1/s1	HECXZILGRZYZSJ-WWMYMODYSA-N	487.265791262							122812
BRD-K86422406	LSM-34256		54632599	InChI=1S/C27H43N3O5/c1-6-7-26(31)28-22-8-9-23-24(14-22)35-18-20(3)30(16-21-10-12-34-13-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h8-9,14,19-21,25H,6-7,10-13,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	NJXMLEPFNXRBQS-ZYLNGJIFSA-N	CCCC(=O)Nc1ccc2C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(CC3CCOCC3)[C@@H](C)COc2c1	BroadT	BRD-K86422406	BRD-K86422406-001-01-6	Broad Institute of MIT and Harvard	BRD-K86422406			CCCC(=O)Nc1ccc2c(OC[C@H](C)N(CC3CCOCC3)C[C@H](C)[C@@H](CN(C)C2=O)OC)c1	InChI=1S/C27H43N3O5/c1-6-7-26(31)28-22-8-9-23-24(14-22)35-18-20(3)30(16-21-10-12-34-13-11-21)15-19(2)25(33-5)17-29(4)27(23)32/h8-9,14,19-21,25H,6-7,10-13,15-18H2,1-5H3,(H,28,31)/t19-,20-,25+/m0/s1	NJXMLEPFNXRBQS-ZYLNGJIFSA-N	489.320271506							122813
BRD-K29681850	LSM-34257		54632759	InChI=1S/C24H34N4O6/c1-16-9-28(10-19-13-33-15-25-19)17(2)12-34-21-8-18(26-23(29)14-31-4)6-7-20(21)24(30)27(3)11-22(16)32-5/h6-8,13,15-17,22H,9-12,14H2,1-5H3,(H,26,29)/t16-,17-,22+/m1/s1	XLCLXRHITHQMGS-YVHKJVDXSA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@H](C)CN(Cc3cocn3)[C@H](C)COc2c1	BroadT	BRD-K29681850	BRD-K29681850-001-01-8	Broad Institute of MIT and Harvard	BRD-K29681850			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cocn3)C[C@@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C24H34N4O6/c1-16-9-28(10-19-13-33-15-25-19)17(2)12-34-21-8-18(26-23(29)14-31-4)6-7-20(21)24(30)27(3)11-22(16)32-5/h6-8,13,15-17,22H,9-12,14H2,1-5H3,(H,26,29)/t16-,17-,22+/m1/s1	XLCLXRHITHQMGS-YVHKJVDXSA-N	474.247834848							122814
BRD-K45199298	LSM-34258		54632602	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16+,20-/m0/s1	WSQGAZSPVHYFJA-YRNRMSPPSA-N	CCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN([C@H](C)COc2c1)C(=O)COC	BroadT	BRD-K45199298	BRD-K45199298-001-01-1	Broad Institute of MIT and Harvard	BRD-K45199298			CCC(=O)Nc1ccc2c(OC[C@@H](C)N(C[C@H](C)[C@H](CN(C)C2=O)OC)C(=O)COC)c1	InChI=1S/C23H35N3O6/c1-7-21(27)24-17-8-9-18-19(10-17)32-13-16(3)26(22(28)14-30-5)11-15(2)20(31-6)12-25(4)23(18)29/h8-10,15-16,20H,7,11-14H2,1-6H3,(H,24,27)/t15-,16+,20-/m0/s1	WSQGAZSPVHYFJA-YRNRMSPPSA-N	449.25258587							122815
BRD-K02032383	LSM-34259		54632755	InChI=1S/C27H39N3O6/c1-17-14-30(26(32)20-9-11-35-12-10-20)18(2)16-36-23-8-7-21(28-25(31)19-5-6-19)13-22(23)27(33)29(3)15-24(17)34-4/h7-8,13,17-20,24H,5-6,9-12,14-16H2,1-4H3,(H,28,31)/t17-,18+,24-/m1/s1	GAPZQUHMQDIXFX-NXMSCROESA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C4CCOCC4	BroadT	BRD-K02032383	BRD-K02032383-001-01-1	Broad Institute of MIT and Harvard	BRD-K02032383			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CC3)ccc2OC[C@H](C)N(C[C@H]1C)C(=O)C1CCOCC1	InChI=1S/C27H39N3O6/c1-17-14-30(26(32)20-9-11-35-12-10-20)18(2)16-36-23-8-7-21(28-25(31)19-5-6-19)13-22(23)27(33)29(3)15-24(17)34-4/h7-8,13,17-20,24H,5-6,9-12,14-16H2,1-4H3,(H,28,31)/t17-,18+,24-/m1/s1	GAPZQUHMQDIXFX-NXMSCROESA-N	501.283885998							122816
BRD-K68403934	LSM-34260		54632715	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13-,18+/m0/s1	RENPXZBPSBTSHX-ZJNRKIDTSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@H](C)NC[C@@H]1C	BroadT	BRD-K68403934	BRD-K68403934-001-01-9	Broad Institute of MIT and Harvard	BRD-K68403934			CO[C@@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@H](C)NC[C@@H]1C	InChI=1S/C19H29N3O4/c1-12-9-20-13(2)11-26-17-7-6-15(21-14(3)23)8-16(17)19(24)22(4)10-18(12)25-5/h6-8,12-13,18,20H,9-11H2,1-5H3,(H,21,23)/t12-,13-,18+/m0/s1	RENPXZBPSBTSHX-ZJNRKIDTSA-N	363.215806438							122817
BRD-K69763908	LSM-34261		54632854	InChI=1S/C23H32N4O5/c1-14-11-26(4)15(2)13-31-20-10-17(24-22(28)19-9-16(3)32-25-19)7-8-18(20)23(29)27(5)12-21(14)30-6/h7-10,14-15,21H,11-13H2,1-6H3,(H,24,28)/t14-,15+,21+/m1/s1	SSJRVKKQRIQXRQ-WIEQDCTASA-N	CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H](C)N(C)C[C@H]1C	BroadT	BRD-K69763908	BRD-K69763908-001-01-7	Broad Institute of MIT and Harvard	BRD-K69763908			CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3cc(C)on3)cc2OC[C@H](C)N(C)C[C@H]1C	InChI=1S/C23H32N4O5/c1-14-11-26(4)15(2)13-31-20-10-17(24-22(28)19-9-16(3)32-25-19)7-8-18(20)23(29)27(5)12-21(14)30-6/h7-10,14-15,21H,11-13H2,1-6H3,(H,24,28)/t14-,15+,21+/m1/s1	SSJRVKKQRIQXRQ-WIEQDCTASA-N	444.237270164							122818
BRD-K35527855	LSM-34262		54632611	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22-/m0/s1	CBWRNOSECAFSLQ-SVMVAKDDSA-N	CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@H]1C)OC	BroadT	BRD-K35527855	BRD-K35527855-001-01-0	Broad Institute of MIT and Harvard	BRD-K35527855			CCCN1C[C@H](C)[C@H](CN(C)C(=O)c2ccc(NC(=O)CCC)cc2OC[C@H]1C)OC	InChI=1S/C24H39N3O4/c1-7-9-23(28)25-19-10-11-20-21(13-19)31-16-18(4)27(12-8-2)14-17(3)22(30-6)15-26(5)24(20)29/h10-11,13,17-18,22H,7-9,12,14-16H2,1-6H3,(H,25,28)/t17-,18+,22-/m0/s1	CBWRNOSECAFSLQ-SVMVAKDDSA-N	433.294056758							122819
BRD-K23047317	LSM-34263		54632798	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-8-7-16(21-15(3)24)9-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14+,19-/m0/s1	VZXWWTHKMGUIJI-KSMMKXTCSA-N	CO[C@H]1CN(C)C(=O)c2cc(NC(=O)C)ccc2OC[C@@H](C)N(C[C@@H]1C)S(=O)(=O)C	BroadT	BRD-K23047317	BRD-K23047317-001-01-5	Broad Institute of MIT and Harvard	BRD-K23047317			CO[C@H]1CN(C)C(=O)c2cc(NC(C)=O)ccc2OC[C@@H](C)N(C[C@@H]1C)S(C)(=O)=O	InChI=1S/C20H31N3O6S/c1-13-10-23(30(6,26)27)14(2)12-29-18-8-7-16(21-15(3)24)9-17(18)20(25)22(4)11-19(13)28-5/h7-9,13-14,19H,10-12H2,1-6H3,(H,21,24)/t13-,14+,19-/m0/s1	VZXWWTHKMGUIJI-KSMMKXTCSA-N	441.193356432							122820
BRD-K13901498	LSM-34264		54632868	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,25-/m1/s1	BRQCDNWRPXIVHI-UMEGOILYSA-N	CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(Cc4nccs4)C[C@H]1C	BroadT	BRD-K13901498	BRD-K13901498-001-01-6	Broad Institute of MIT and Harvard	BRD-K13901498			CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2OC[C@@H](C)N(Cc2nccs2)C[C@H]1C	InChI=1S/C28H40N4O4S/c1-19-15-32(17-26-29-12-13-37-26)20(2)18-36-24-11-10-22(30-27(33)21-8-6-5-7-9-21)14-23(24)28(34)31(3)16-25(19)35-4/h10-14,19-21,25H,5-9,15-18H2,1-4H3,(H,30,33)/t19-,20-,25-/m1/s1	BRQCDNWRPXIVHI-UMEGOILYSA-N	528.27702649							122821
BRD-K51429036	LSM-34265		54632693	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-7-6-10-27-12-20)19(2)16-35-23-11-21(28-25(31)17-33-4)8-9-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	MONOFYZVTFTEBW-GLDPYIMESA-N	COCC(=O)Nc1ccc2C(=O)N(C)C[C@H](OC)[C@@H](C)CN(Cc3cccnc3)[C@H](C)COc2c1	BroadT	BRD-K51429036	BRD-K51429036-001-01-0	Broad Institute of MIT and Harvard	BRD-K51429036			COCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cccnc3)C[C@H](C)[C@H](CN(C)C2=O)OC)c1	InChI=1S/C26H36N4O5/c1-18-13-30(14-20-7-6-10-27-12-20)19(2)16-35-23-11-21(28-25(31)17-33-4)8-9-22(23)26(32)29(3)15-24(18)34-5/h6-12,18-19,24H,13-17H2,1-5H3,(H,28,31)/t18-,19+,24-/m0/s1	MONOFYZVTFTEBW-GLDPYIMESA-N	484.268570292							122822
BRD-K47237224	LSM-34266		54647235	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17-,19+,21+/m0/s1	DXZPRIFIKXELJX-ICSUOEFDSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K47237224	BRD-K47237224-001-01-6	Broad Institute of MIT and Harvard	BRD-K47237224			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17-,19+,21+/m0/s1	DXZPRIFIKXELJX-ICSUOEFDSA-N	418.2103867							122823
BRD-K41548770	LSM-34267		54647151	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20+,22+,25-/m0/s1	GQOLZDUAMZVUJK-PMTIONAUSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(OC)cc4)C[C@@H]3c2c1	BroadT	BRD-K41548770	BRD-K41548770-001-01-0	Broad Institute of MIT and Harvard	BRD-K41548770			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(OC)cc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20+,22+,25-/m0/s1	GQOLZDUAMZVUJK-PMTIONAUSA-N	470.20530132							122824
BRD-K93101873	LSM-34268		54647094	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21+,26+,28-/m0/s1	QPCDPRLGXJQWSH-BNGZEQNASA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccccc5F)cc34)[C@@H](CO)O2	BroadT	BRD-K93101873	BRD-K93101873-001-01-1	Broad Institute of MIT and Harvard	BRD-K93101873			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21+,26+,28-/m0/s1	QPCDPRLGXJQWSH-BNGZEQNASA-N	535.21186391							122825
BRD-K20196153	LSM-34269		54647083	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26+,28+/m0/s1	HIMABYNGDRMZAM-PWGWJTMSSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K20196153	BRD-K20196153-001-01-0	Broad Institute of MIT and Harvard	BRD-K20196153			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26+,28+/m0/s1	HIMABYNGDRMZAM-PWGWJTMSSA-N	534.180229424							122826
BRD-K65780164	LSM-34270		54647101	InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21-,23-,25+/m0/s1	SRZDSTZFHOVQBI-YALMDMJRSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NCC5CC5)C[C@H]4c3c2)cc1	BroadT	BRD-K65780164	BRD-K65780164-001-01-4	Broad Institute of MIT and Harvard	BRD-K65780164			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NCC5CC5)O[C@H]4CO)c3c2)cc1	InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21-,23-,25+/m0/s1	SRZDSTZFHOVQBI-YALMDMJRSA-N	481.221285742							122827
BRD-K54317642	LSM-34271		54647267	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27-,29-,31+/m0/s1	DTKVBNZNKFXGOR-CJAQZQCDSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCC6)cc45	BroadT	BRD-K54317642	BRD-K54317642-001-01-0	Broad Institute of MIT and Harvard	BRD-K54317642			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27-,29-,31+/m0/s1	DTKVBNZNKFXGOR-CJAQZQCDSA-N	526.246772208							122828
BRD-K75775113	LSM-34272		54647184	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26-,28-,30+/m1/s1	XMRNAPLDHHXMNZ-UPQWRWMQSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)N5CCc6ccccc6C5)C[C@@H]4c3c2)cc1	BroadT	BRD-K75775113	BRD-K75775113-001-01-4	Broad Institute of MIT and Harvard	BRD-K75775113			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)N5CCc6ccccc6C5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26-,28-,30+/m1/s1	XMRNAPLDHHXMNZ-UPQWRWMQSA-N	543.236935806							122829
BRD-K36460699	LSM-34273		54647144	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21+,23+,25-/m1/s1	CWTFRDOIHJRUHI-IQKBUIRBSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@H](CO)O2	BroadT	BRD-K36460699	BRD-K36460699-001-01-3	Broad Institute of MIT and Harvard	BRD-K36460699			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21+,23+,25-/m1/s1	CWTFRDOIHJRUHI-IQKBUIRBSA-N	548.224654732							122830
BRD-K40452322	LSM-34274		54647234	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17+,19-,21-/m0/s1	DXZPRIFIKXELJX-MRCYXTNMSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	BroadT	BRD-K40452322	BRD-K40452322-001-01-9	Broad Institute of MIT and Harvard	BRD-K40452322			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17+,19-,21-/m0/s1	DXZPRIFIKXELJX-MRCYXTNMSA-N	418.2103867							122831
BRD-K89324382	LSM-34275		54647277	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16-,18-/m1/s1	NJJKNLQQLZQTIZ-DPHWQOANSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K89324382	BRD-K89324382-001-01-9	Broad Institute of MIT and Harvard	BRD-K89324382			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16-,18-/m1/s1	NJJKNLQQLZQTIZ-DPHWQOANSA-N	414.146071882							122832
BRD-K52423731	LSM-34276		54647282	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19-,21-,23+/m0/s1	ZRCRXWGBTMXJDJ-RAKJYXHLSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K52423731	BRD-K52423731-001-01-0	Broad Institute of MIT and Harvard	BRD-K52423731			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19-,21-,23+/m0/s1	ZRCRXWGBTMXJDJ-RAKJYXHLSA-N	443.242021186							122833
BRD-K06296238	LSM-15105		54647209	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21+,24+/m0/s1	AXSMPGQCOGKKGU-NOOBJOLFSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K06296238	BRD-K06296238-001-01-5	Broad Institute of MIT and Harvard	BRD-K06296238			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccncc4)O[C@@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21+,24+/m0/s1	AXSMPGQCOGKKGU-NOOBJOLFSA-N	454.2216201							103761
BRD-K06308228	LSM-34277		54647384	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20-,22-,24+/m0/s1	FIOSTBRHNPGFJR-UYLMIGBBSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34	BroadT	BRD-K06308228	BRD-K06308228-001-01-0	Broad Institute of MIT and Harvard	BRD-K06308228			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20-,22-,24+/m0/s1	FIOSTBRHNPGFJR-UYLMIGBBSA-N	485.196213846							122834
CHEMBL2360811	LSM-34278	SID131443540, BRD-K02788568	54647166	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24-,26-,28+/m0/s1	DXWDIHWCVARGHC-AJWNWGNMSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@H]3c2c1	BroadT	BRD-K02788568	BRD-K02788568-001-01-5	Broad Institute of MIT and Harvard	BRD-K02788568			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@H]3CO)c2c1	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24-,26-,28+/m0/s1	DXWDIHWCVARGHC-AJWNWGNMSA-N	538.17737201							122835
BRD-K24025166	LSM-34279		54647275	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16+,18-/m0/s1	NJJKNLQQLZQTIZ-VYOUMLOHSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K24025166	BRD-K24025166-001-01-2	Broad Institute of MIT and Harvard	BRD-K24025166			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16+,18-/m0/s1	NJJKNLQQLZQTIZ-VYOUMLOHSA-N	414.146071882							122836
CHEMBL2354710	LSM-34280	BRD-K15236933, SID131443542	54647168	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24+,26+,28-/m1/s1	DXWDIHWCVARGHC-PWKYGKGFSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@H]3c2c1	BroadT	BRD-K15236933	BRD-K15236933-001-01-8	Broad Institute of MIT and Harvard	BRD-K15236933			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@H]3CO)c2c1	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24+,26+,28-/m1/s1	DXWDIHWCVARGHC-PWKYGKGFSA-N	538.17737201							122837
BRD-K38724926	LSM-34281		54647211	InChI=1S/C23H23F4N3O5/c24-16-3-1-2-4-17(16)30-22(33)29-12-5-6-18-14(7-12)15-8-13(34-19(10-31)21(15)35-18)9-20(32)28-11-23(25,26)27/h1-7,13,15,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t13-,15-,19-,21+/m1/s1	JNBFYQYHHCPVEU-CKJDJMSUSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccccc4F)cc23	BroadT	BRD-K38724926	BRD-K38724926-001-01-5	Broad Institute of MIT and Harvard	BRD-K38724926			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C23H23F4N3O5/c24-16-3-1-2-4-17(16)30-22(33)29-12-5-6-18-14(7-12)15-8-13(34-19(10-31)21(15)35-18)9-20(32)28-11-23(25,26)27/h1-7,13,15,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t13-,15-,19-,21+/m1/s1	JNBFYQYHHCPVEU-CKJDJMSUSA-N	497.157383666							122838
BRD-K29420358	LSM-34282		54647326	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21-,23+,26+/m0/s1	DDTMCUFVLBWJID-UUHYGDNJSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K29420358	BRD-K29420358-001-01-8	Broad Institute of MIT and Harvard	BRD-K29420358			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21-,23+,26+/m0/s1	DDTMCUFVLBWJID-UUHYGDNJSA-N	467.242021186							122839
BRD-K96133500	LSM-34283		54647299	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14+,16+,19-/m0/s1	WISUKBIGDPLILZ-AXJQOJOCSA-N	OC[C@H]1O[C@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K96133500	BRD-K96133500-001-01-2	Broad Institute of MIT and Harvard	BRD-K96133500			OC[C@H]1O[C@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14+,16+,19-/m0/s1	WISUKBIGDPLILZ-AXJQOJOCSA-N	361.152537466							122840
BRD-K16604405	LSM-34284		54647216	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,24+/m0/s1	RDOSCOXXMIXCDB-UYLMIGBBSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K16604405	BRD-K16604405-001-01-5	Broad Institute of MIT and Harvard	BRD-K16604405			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,24+/m0/s1	RDOSCOXXMIXCDB-UYLMIGBBSA-N	451.210721058							122841
BRD-K55343670	LSM-34285		54647160	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19+,23+,25-/m1/s1	GLTVTIDBZPANQC-LBEPQCADSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K55343670	BRD-K55343670-001-01-0	Broad Institute of MIT and Harvard	BRD-K55343670			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19+,23+,25-/m1/s1	GLTVTIDBZPANQC-LBEPQCADSA-N	480.189651256							122842
BRD-K78656517	LSM-34286		54647179	InChI=1S/C20H25NO6/c1-25-19(24)9-13-8-15-14-7-12(21-18(23)6-11-2-3-11)4-5-16(14)27-20(15)17(10-22)26-13/h4-5,7,11,13,15,17,20,22H,2-3,6,8-10H2,1H3,(H,21,23)/t13-,15-,17-,20+/m0/s1	RBGXSVUHPLBJIK-NUADTHGBSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K78656517	BRD-K78656517-001-01-5	Broad Institute of MIT and Harvard	BRD-K78656517			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C20H25NO6/c1-25-19(24)9-13-8-15-14-7-12(21-18(23)6-11-2-3-11)4-5-16(14)27-20(15)17(10-22)26-13/h4-5,7,11,13,15,17,20,22H,2-3,6,8-10H2,1H3,(H,21,23)/t13-,15-,17-,20+/m0/s1	RBGXSVUHPLBJIK-NUADTHGBSA-N	375.16818753							122843
BRD-K92365616	LSM-34287		54647341	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22-,24-,26+/m0/s1	OGUMJARTEHRGNP-IFPZXYOKSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K92365616	BRD-K92365616-001-01-5	Broad Institute of MIT and Harvard	BRD-K92365616			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22-,24-,26+/m0/s1	OGUMJARTEHRGNP-IFPZXYOKSA-N	491.185649162							122844
CHEMBL2362889	LSM-34288	BRD-K39134386, SID131443472	54647098	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21-,26+,28+/m0/s1	QPCDPRLGXJQWSH-BJSMQDGRSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccccc5F)cc34)[C@@H](CO)O2	BroadT	BRD-K39134386	BRD-K39134386-001-01-9	Broad Institute of MIT and Harvard	BRD-K39134386			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21-,26+,28+/m0/s1	QPCDPRLGXJQWSH-BJSMQDGRSA-N	535.21186391							122845
BRD-K92460921	LSM-34289		54647157	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19-,23-,25+/m1/s1	GLTVTIDBZPANQC-CUARHSKXSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K92460921	BRD-K92460921-001-01-4	Broad Institute of MIT and Harvard	BRD-K92460921			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19-,23-,25+/m1/s1	GLTVTIDBZPANQC-CUARHSKXSA-N	480.189651256							122846
BRD-K74896637	LSM-34290		54647156	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20-,22+,25+/m1/s1	GQOLZDUAMZVUJK-NARIEAHCSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(OC)cc4)C[C@@H]3c2c1	BroadT	BRD-K74896637	BRD-K74896637-001-01-6	Broad Institute of MIT and Harvard	BRD-K74896637			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(OC)cc4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20-,22+,25+/m1/s1	GQOLZDUAMZVUJK-NARIEAHCSA-N	470.20530132							122847
BRD-K38558166	LSM-34291		54647304	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14-,16+,19+/m1/s1	WISUKBIGDPLILZ-FYHWNKSOSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K38558166	BRD-K38558166-001-01-6	Broad Institute of MIT and Harvard	BRD-K38558166			OC[C@@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14-,16+,19+/m1/s1	WISUKBIGDPLILZ-FYHWNKSOSA-N	361.152537466							122848
BRD-K32214429	LSM-34292		54647104	InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21-,23+,25+/m0/s1	SRZDSTZFHOVQBI-FEGXGRLVSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)NCC5CC5)C[C@H]4c3c2)cc1	BroadT	BRD-K32214429	BRD-K32214429-001-01-5	Broad Institute of MIT and Harvard	BRD-K32214429			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NCC5CC5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21-,23+,25+/m0/s1	SRZDSTZFHOVQBI-FEGXGRLVSA-N	481.221285742							122849
BRD-K99516890	LSM-34293		54647318	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24+,27+/m1/s1	YWCZLJIWAJYPHK-YDGNWZKSSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K99516890	BRD-K99516890-001-01-3	Broad Institute of MIT and Harvard	BRD-K99516890			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24+,27+/m1/s1	YWCZLJIWAJYPHK-YDGNWZKSSA-N	464.231122144							122850
BRD-K83135157	LSM-34294		54647391	InChI=1S/C25H31N3O7/c1-32-10-9-26-23(30)13-18-12-20-19-11-16(5-8-21(19)35-24(20)22(14-29)34-18)28-25(31)27-15-3-6-17(33-2)7-4-15/h3-8,11,18,20,22,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H2,27,28,31)/t18-,20-,22-,24+/m1/s1	DSSRCRDYJCNLRE-YWWGLXIYSA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(OC)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K83135157	BRD-K83135157-001-01-8	Broad Institute of MIT and Harvard	BRD-K83135157			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(OC)cc4)cc23)[C@@H](CO)O1	InChI=1S/C25H31N3O7/c1-32-10-9-26-23(30)13-18-12-20-19-11-16(5-8-21(19)35-24(20)22(14-29)34-18)28-25(31)27-15-3-6-17(33-2)7-4-15/h3-8,11,18,20,22,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H2,27,28,31)/t18-,20-,22-,24+/m1/s1	DSSRCRDYJCNLRE-YWWGLXIYSA-N	485.216200362							122851
BRD-K42960858	LSM-34295		54647172	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24-,26+,28+/m1/s1	DXWDIHWCVARGHC-GJPOJPNFSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@@H]3c2c1	BroadT	BRD-K42960858	BRD-K42960858-001-01-1	Broad Institute of MIT and Harvard	BRD-K42960858			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@H]3CO)c2c1	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24-,26+,28+/m1/s1	DXWDIHWCVARGHC-GJPOJPNFSA-N	538.17737201							122852
BRD-K56119660	LSM-34296		54647292	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16+,18-,20-/m1/s1	BVUMLAQBIXIYMI-IHMNZUQTSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)NC4CCCCC4)cc23	BroadT	BRD-K56119660	BRD-K56119660-001-01-5	Broad Institute of MIT and Harvard	BRD-K56119660			OC[C@H]1O[C@@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16+,18-,20-/m1/s1	BVUMLAQBIXIYMI-IHMNZUQTSA-N	404.194736636							122853
BRD-K95573463	LSM-34297		54647336	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-17-11-19-18-10-16(7-8-20(18)33-23(19)21(13-29)32-17)28-24(31)27-15-5-3-14(25)4-6-15/h3-8,10,17,19,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t17-,19+,21+,23-/m1/s1	UMXSQZGGXDMCPL-QXPQREGVSA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K95573463	BRD-K95573463-001-01-5	Broad Institute of MIT and Harvard	BRD-K95573463			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-17-11-19-18-10-16(7-8-20(18)33-23(19)21(13-29)32-17)28-24(31)27-15-5-3-14(25)4-6-15/h3-8,10,17,19,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t17-,19+,21+,23-/m1/s1	UMXSQZGGXDMCPL-QXPQREGVSA-N	457.201299226							122854
BRD-K03883227	LSM-15102		54647198	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24+,26-/m1/s1	NNNMMCMDOXLHLD-GRTAZNFBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K03883227	BRD-K03883227-001-01-6	Broad Institute of MIT and Harvard	BRD-K03883227			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24+,26-/m1/s1	NNNMMCMDOXLHLD-GRTAZNFBSA-N	556.193354604							103758
BRD-K21713052	LSM-34298		54647380	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16+,18-,20-/m0/s1	VBPXJTQPFOPDPZ-HUOQQOJOSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccccc4)cc23	BroadT	BRD-K21713052	BRD-K21713052-001-01-3	Broad Institute of MIT and Harvard	BRD-K21713052			OC[C@@H]1O[C@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16+,18-,20-/m0/s1	VBPXJTQPFOPDPZ-HUOQQOJOSA-N	398.147786444							122855
BRD-K95735693	LSM-34299		54647255	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19+,21+,23-/m1/s1	LGHYMYOTKHNHQJ-QXPQREGVSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K95735693	BRD-K95735693-001-01-2	Broad Institute of MIT and Harvard	BRD-K95735693			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19+,21+,23-/m1/s1	LGHYMYOTKHNHQJ-QXPQREGVSA-N	437.195070994							122856
BRD-K73376409	LSM-34300		54647178	InChI=1S/C20H25NO6/c1-25-19(24)9-13-8-15-14-7-12(21-18(23)6-11-2-3-11)4-5-16(14)27-20(15)17(10-22)26-13/h4-5,7,11,13,15,17,20,22H,2-3,6,8-10H2,1H3,(H,21,23)/t13-,15-,17-,20+/m1/s1	RBGXSVUHPLBJIK-PCFVDWANSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K73376409	BRD-K73376409-001-01-6	Broad Institute of MIT and Harvard	BRD-K73376409			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C20H25NO6/c1-25-19(24)9-13-8-15-14-7-12(21-18(23)6-11-2-3-11)4-5-16(14)27-20(15)17(10-22)26-13/h4-5,7,11,13,15,17,20,22H,2-3,6,8-10H2,1H3,(H,21,23)/t13-,15-,17-,20+/m1/s1	RBGXSVUHPLBJIK-PCFVDWANSA-N	375.16818753							122857
BRD-K49528360	LSM-34301		54647120	InChI=1S/C29H30FN3O6/c1-37-20-9-6-18(7-10-20)32-29(36)33-19-8-11-25-22(12-19)23-13-21(38-26(16-34)28(23)39-25)14-27(35)31-15-17-4-2-3-5-24(17)30/h2-12,21,23,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,26-,28+/m1/s1	CTJBWDZBZUSCES-AUPUHMMDSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NCc5ccccc5F)C[C@@H]4c3c2)cc1	BroadT	BRD-K49528360	BRD-K49528360-001-01-0	Broad Institute of MIT and Harvard	BRD-K49528360			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NCc5ccccc5F)O[C@@H]4CO)c3c2)cc1	InChI=1S/C29H30FN3O6/c1-37-20-9-6-18(7-10-20)32-29(36)33-19-8-11-25-22(12-19)23-13-21(38-26(16-34)28(23)39-25)14-27(35)31-15-17-4-2-3-5-24(17)30/h2-12,21,23,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,26-,28+/m1/s1	CTJBWDZBZUSCES-AUPUHMMDSA-N	535.21186391							122858
BRD-K89668690	LSM-34302		54647137	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,22-/m1/s1	IZHKYGZZVSGRFT-DCZASFAJSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	BroadT	BRD-K89668690	BRD-K89668690-001-01-6	Broad Institute of MIT and Harvard	BRD-K89668690			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,22-/m1/s1	IZHKYGZZVSGRFT-DCZASFAJSA-N	441.189985614							122859
BRD-K91467861	LSM-34303		54647368	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22-,26+,28+/m0/s1	DCKQIPUZKHPVQM-PWGWJTMSSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K91467861	BRD-K91467861-001-01-2	Broad Institute of MIT and Harvard	BRD-K91467861			OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22-,26+,28+/m0/s1	DCKQIPUZKHPVQM-PWGWJTMSSA-N	599.187934866							122860
BRD-K09975619	LSM-34304		54647286	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19+,21-,23-/m0/s1	ZRCRXWGBTMXJDJ-FTJYFCJYSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K09975619	BRD-K09975619-001-01-0	Broad Institute of MIT and Harvard	BRD-K09975619			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19+,21-,23-/m0/s1	ZRCRXWGBTMXJDJ-FTJYFCJYSA-N	443.242021186							122861
BRD-K26461918	LSM-34305		54647372	InChI=1S/C27H28N4O5/c32-16-24-27-22(12-20(35-24)13-25(33)30-15-18-2-1-7-29-14-18)21-11-19(3-4-23(21)36-27)31-26(34)10-17-5-8-28-9-6-17/h1-9,11,14,20,22,24,27,32H,10,12-13,15-16H2,(H,30,33)(H,31,34)/t20-,22+,24-,27-/m1/s1	YINZFYFDFIPTOU-YIPBLFEHSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K26461918	BRD-K26461918-001-01-8	Broad Institute of MIT and Harvard	BRD-K26461918			OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(12-20(35-24)13-25(33)30-15-18-2-1-7-29-14-18)21-11-19(3-4-23(21)36-27)31-26(34)10-17-5-8-28-9-6-17/h1-9,11,14,20,22,24,27,32H,10,12-13,15-16H2,(H,30,33)(H,31,34)/t20-,22+,24-,27-/m1/s1	YINZFYFDFIPTOU-YIPBLFEHSA-N	488.205970036							122862
BRD-K30283890	LSM-34306		54647354	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22-,24-,26+/m1/s1	OKSBXXIUCLCGOM-DFICYWPVSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K30283890	BRD-K30283890-001-01-2	Broad Institute of MIT and Harvard	BRD-K30283890			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22-,24-,26+/m1/s1	OKSBXXIUCLCGOM-DFICYWPVSA-N	514.187064442							122863
BRD-K95501793	LSM-34307		54647307	InChI=1S/C21H22N2O6/c1-27-19(25)9-14-8-16-15-7-13(23-21(26)12-3-2-6-22-10-12)4-5-17(15)29-20(16)18(11-24)28-14/h2-7,10,14,16,18,20,24H,8-9,11H2,1H3,(H,23,26)/t14-,16+,18-,20-/m1/s1	RMTKIWQMYKPUOR-IHMNZUQTSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	BroadT	BRD-K95501793	BRD-K95501793-001-01-7	Broad Institute of MIT and Harvard	BRD-K95501793			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C21H22N2O6/c1-27-19(25)9-14-8-16-15-7-13(23-21(26)12-3-2-6-22-10-12)4-5-17(15)29-20(16)18(11-24)28-14/h2-7,10,14,16,18,20,24H,8-9,11H2,1H3,(H,23,26)/t14-,16+,18-,20-/m1/s1	RMTKIWQMYKPUOR-IHMNZUQTSA-N	398.147786444							122864
BRD-K73290515	LSM-34308		54647259	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19-,21+,23+/m1/s1	LGHYMYOTKHNHQJ-YZBYQZESSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K73290515	BRD-K73290515-001-01-0	Broad Institute of MIT and Harvard	BRD-K73290515			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19-,21+,23+/m1/s1	LGHYMYOTKHNHQJ-YZBYQZESSA-N	437.195070994							122865
BRD-K70532227	LSM-34309		54647153	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20+,22-,25-/m1/s1	GQOLZDUAMZVUJK-DPQLKAKJSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(OC)cc4)C[C@H]3c2c1	BroadT	BRD-K70532227	BRD-K70532227-001-01-7	Broad Institute of MIT and Harvard	BRD-K70532227			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(OC)cc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20+,22-,25-/m1/s1	GQOLZDUAMZVUJK-DPQLKAKJSA-N	470.20530132							122866
BRD-K10925833	LSM-34310		54647271	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29-,31-/m0/s1	DTKVBNZNKFXGOR-VIVMLURYSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCC6)cc45	BroadT	BRD-K10925833	BRD-K10925833-001-01-2	Broad Institute of MIT and Harvard	BRD-K10925833			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29-,31-/m0/s1	DTKVBNZNKFXGOR-VIVMLURYSA-N	526.246772208							122867
BRD-K70378808	LSM-34311		54647393	InChI=1S/C25H31N3O7/c1-32-10-9-26-23(30)13-18-12-20-19-11-16(5-8-21(19)35-24(20)22(14-29)34-18)28-25(31)27-15-3-6-17(33-2)7-4-15/h3-8,11,18,20,22,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H2,27,28,31)/t18-,20+,22+,24-/m1/s1	DSSRCRDYJCNLRE-HJBWUJCXSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(OC)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K70378808	BRD-K70378808-001-01-2	Broad Institute of MIT and Harvard	BRD-K70378808			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(OC)cc4)cc23)[C@H](CO)O1	InChI=1S/C25H31N3O7/c1-32-10-9-26-23(30)13-18-12-20-19-11-16(5-8-21(19)35-24(20)22(14-29)34-18)28-25(31)27-15-3-6-17(33-2)7-4-15/h3-8,11,18,20,22,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H2,27,28,31)/t18-,20+,22+,24-/m1/s1	DSSRCRDYJCNLRE-HJBWUJCXSA-N	485.216200362							122868
BRD-K51050934	LSM-34312		54647245	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19-,21-,23+/m1/s1	XRZWMSINEDMJNA-WACMXJRTSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K51050934	BRD-K51050934-001-01-7	Broad Institute of MIT and Harvard	BRD-K51050934			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19-,21-,23+/m1/s1	XRZWMSINEDMJNA-WACMXJRTSA-N	478.157385494							122869
BRD-K59638683	LSM-34313		54647351	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13+,15-,17-/m1/s1	LRUFLDYNMXBWAO-HQHYIBOGSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	BroadT	BRD-K59638683	BRD-K59638683-001-01-4	Broad Institute of MIT and Harvard	BRD-K59638683			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13+,15-,17-/m1/s1	LRUFLDYNMXBWAO-HQHYIBOGSA-N	321.157622846							122870
BRD-K61335814-001-01-5	LSM-34314	BRD-K61335814	54647349	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13+,15+,17-/m0/s1	LRUFLDYNMXBWAO-IYDIDCQVSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	BroadT	BRD-K61335814	BRD-K61335814-001-01-5	Broad Institute of MIT and Harvard	BRD-K61335814			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13+,15+,17-/m0/s1	LRUFLDYNMXBWAO-IYDIDCQVSA-N	321.157622846							122871
BRD-K32402344	LSM-34315		54647285	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19+,21-,23-/m1/s1	ZRCRXWGBTMXJDJ-GUBFDYSESA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K32402344	BRD-K32402344-001-01-8	Broad Institute of MIT and Harvard	BRD-K32402344			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19+,21-,23-/m1/s1	ZRCRXWGBTMXJDJ-GUBFDYSESA-N	443.242021186							122872
BRD-K96382853	LSM-34316		54647248	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19+,21+,23-/m1/s1	XRZWMSINEDMJNA-CTZMOBNVSA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K96382853	BRD-K96382853-001-01-8	Broad Institute of MIT and Harvard	BRD-K96382853			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19+,21+,23-/m1/s1	XRZWMSINEDMJNA-CTZMOBNVSA-N	478.157385494							122873
BRD-K68450812	LSM-34317		54647386	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20+,22+,24-/m1/s1	FIOSTBRHNPGFJR-HJBWUJCXSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34	BroadT	BRD-K68450812	BRD-K68450812-001-01-7	Broad Institute of MIT and Harvard	BRD-K68450812			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20+,22+,24-/m1/s1	FIOSTBRHNPGFJR-HJBWUJCXSA-N	485.196213846							122874
BRD-K71561082	LSM-34318		54647293	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16+,18-,20-/m0/s1	BVUMLAQBIXIYMI-HUOQQOJOSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)NC4CCCCC4)cc23	BroadT	BRD-K71561082	BRD-K71561082-001-01-9	Broad Institute of MIT and Harvard	BRD-K71561082			OC[C@@H]1O[C@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16+,18-,20-/m0/s1	BVUMLAQBIXIYMI-HUOQQOJOSA-N	404.194736636							122875
BRD-K60084530	LSM-34319		54647294	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18+,20+/m0/s1	BVUMLAQBIXIYMI-LBLLVPRASA-N	OC[C@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)NC4CCCCC4)cc23	BroadT	BRD-K60084530	BRD-K60084530-001-01-3	Broad Institute of MIT and Harvard	BRD-K60084530			OC[C@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18+,20+/m0/s1	BVUMLAQBIXIYMI-LBLLVPRASA-N	404.194736636							122876
BRD-K44955380	LSM-34320		54647228	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19-,21+,23+/m1/s1	HOUMZMKGURXYQW-YZBYQZESSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K44955380	BRD-K44955380-001-01-6	Broad Institute of MIT and Harvard	BRD-K44955380			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19-,21+,23+/m1/s1	HOUMZMKGURXYQW-YZBYQZESSA-N	453.189985614							122877
BRD-K60716223	LSM-34321		54647279	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16+,18+/m0/s1	NJJKNLQQLZQTIZ-BMGTVUPLSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K60716223	BRD-K60716223-001-01-2	Broad Institute of MIT and Harvard	BRD-K60716223			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16+,18+/m0/s1	NJJKNLQQLZQTIZ-BMGTVUPLSA-N	414.146071882							122878
BRD-K95900761	LSM-34322		54647155	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20-,22+,25+/m0/s1	GQOLZDUAMZVUJK-FZIATNMDSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(OC)cc4)C[C@H]3c2c1	BroadT	BRD-K95900761	BRD-K95900761-001-01-9	Broad Institute of MIT and Harvard	BRD-K95900761			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(OC)cc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20-,22+,25+/m0/s1	GQOLZDUAMZVUJK-FZIATNMDSA-N	470.20530132							122879
BRD-K34590335	LSM-34323		54647288	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19-,21+,23+/m1/s1	ZRCRXWGBTMXJDJ-YZBYQZESSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K34590335	BRD-K34590335-001-01-9	Broad Institute of MIT and Harvard	BRD-K34590335			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19-,21+,23+/m1/s1	ZRCRXWGBTMXJDJ-YZBYQZESSA-N	443.242021186							122880
BRD-K47848960	LSM-34324		54647091	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27-,31+,33+/m1/s1	DKMWIPSTNBBBEH-WVNBZDDVSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K47848960	BRD-K47848960-001-01-8	Broad Institute of MIT and Harvard	BRD-K47848960			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27-,31+,33+/m1/s1	DKMWIPSTNBBBEH-WVNBZDDVSA-N	597.227513974							122881
BRD-K41192068	LSM-34325		54647359	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22+,24-,26-/m0/s1	OKSBXXIUCLCGOM-YXOQKGKWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K41192068	BRD-K41192068-001-01-8	Broad Institute of MIT and Harvard	BRD-K41192068			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22+,24-,26-/m0/s1	OKSBXXIUCLCGOM-YXOQKGKWSA-N	514.187064442							122882
BRD-K14449601	LSM-34326		54647175	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-1-2-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-5-7-26-8-6-15/h3-8,10,16,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m0/s1	VGFNAMSCNMBZFO-GPYREICYSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K14449601	BRD-K14449601-001-01-9	Broad Institute of MIT and Harvard	BRD-K14449601			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-1-2-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-5-7-26-8-6-15/h3-8,10,16,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,25-/m0/s1	VGFNAMSCNMBZFO-GPYREICYSA-N	451.210721058							122883
BRD-K44582497	LSM-34327		54647327	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21+,23-,26-/m1/s1	DDTMCUFVLBWJID-ZGJLUCCASA-N	C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K44582497	BRD-K44582497-001-01-8	Broad Institute of MIT and Harvard	BRD-K44582497			C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21+,23-,26-/m1/s1	DDTMCUFVLBWJID-ZGJLUCCASA-N	467.242021186							122884
BRD-K53274037	LSM-34328		54647252	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19-,21+,23+/m1/s1	XRZWMSINEDMJNA-ZLTNCQPASA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K53274037	BRD-K53274037-001-01-7	Broad Institute of MIT and Harvard	BRD-K53274037			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19-,21+,23+/m1/s1	XRZWMSINEDMJNA-ZLTNCQPASA-N	478.157385494							122885
BRD-K26306512	LSM-34329		54647202	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24+,26+/m1/s1	NNNMMCMDOXLHLD-GUAAGHCTSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K26306512	BRD-K26306512-001-01-5	Broad Institute of MIT and Harvard	BRD-K26306512			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24+,26+/m1/s1	NNNMMCMDOXLHLD-GUAAGHCTSA-N	556.193354604							122886
BRD-K95035301	LSM-34330		54647105	InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21-,23+,25+/m1/s1	SRZDSTZFHOVQBI-ASASOQJESA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)NCC5CC5)C[C@@H]4c3c2)cc1	BroadT	BRD-K95035301	BRD-K95035301-001-01-1	Broad Institute of MIT and Harvard	BRD-K95035301			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NCC5CC5)O[C@H]4CO)c3c2)cc1	InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21-,23+,25+/m1/s1	SRZDSTZFHOVQBI-ASASOQJESA-N	481.221285742							122887
BRD-K12986105	LSM-34331		54647314	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24+,27-/m1/s1	YWCZLJIWAJYPHK-LQZFSELZSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K12986105	BRD-K12986105-001-01-3	Broad Institute of MIT and Harvard	BRD-K12986105			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24+,27-/m1/s1	YWCZLJIWAJYPHK-LQZFSELZSA-N	464.231122144							122888
BRD-K51140037	LSM-34332		54647225	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19+,21-,23-/m1/s1	HOUMZMKGURXYQW-GUBFDYSESA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K51140037	BRD-K51140037-001-01-2	Broad Institute of MIT and Harvard	BRD-K51140037			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19+,21-,23-/m1/s1	HOUMZMKGURXYQW-GUBFDYSESA-N	453.189985614							122889
BRD-K70969650	LSM-34333		54647382	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18+,20+/m1/s1	VBPXJTQPFOPDPZ-BIJSTVTOSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccccc4)cc23	BroadT	BRD-K70969650	BRD-K70969650-001-01-7	Broad Institute of MIT and Harvard	BRD-K70969650			OC[C@@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18+,20+/m1/s1	VBPXJTQPFOPDPZ-BIJSTVTOSA-N	398.147786444							122890
BRD-K88200581	LSM-34334		54647187	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26+,28-,30-/m1/s1	XMRNAPLDHHXMNZ-OENSZVHPSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)N5CCc6ccccc6C5)C[C@H]4c3c2)cc1	BroadT	BRD-K88200581	BRD-K88200581-001-01-1	Broad Institute of MIT and Harvard	BRD-K88200581			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)N5CCc6ccccc6C5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26+,28-,30-/m1/s1	XMRNAPLDHHXMNZ-OENSZVHPSA-N	543.236935806							122891
BRD-K63964208	LSM-34335		54647276	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16+,18-/m1/s1	NJJKNLQQLZQTIZ-BSXOQXRQSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K63964208	BRD-K63964208-001-01-4	Broad Institute of MIT and Harvard	BRD-K63964208			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16+,18-/m1/s1	NJJKNLQQLZQTIZ-BSXOQXRQSA-N	414.146071882							122892
BRD-K97487406	LSM-34336		54647080	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26+,28-/m1/s1	HIMABYNGDRMZAM-HAGKMHAYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K97487406	BRD-K97487406-001-01-6	Broad Institute of MIT and Harvard	BRD-K97487406			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26+,28-/m1/s1	HIMABYNGDRMZAM-HAGKMHAYSA-N	534.180229424							122893
BRD-K32475622	LSM-34337		54647208	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21-,24-/m0/s1	AXSMPGQCOGKKGU-PMSBSAKUSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K32475622	BRD-K32475622-001-01-7	Broad Institute of MIT and Harvard	BRD-K32475622			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccncc4)O[C@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21-,24-/m0/s1	AXSMPGQCOGKKGU-PMSBSAKUSA-N	454.2216201							122894
BRD-K40265664	LSM-34338		54647343	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22+,24+,26-/m1/s1	OGUMJARTEHRGNP-GRTAZNFBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K40265664	BRD-K40265664-001-01-1	Broad Institute of MIT and Harvard	BRD-K40265664			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22+,24+,26-/m1/s1	OGUMJARTEHRGNP-GRTAZNFBSA-N	491.185649162							122895
BRD-K21635957	LSM-34339		54647146	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21+,23-,25-/m0/s1	CWTFRDOIHJRUHI-PYTYSOFPSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@H](CO)O2	BroadT	BRD-K21635957	BRD-K21635957-001-01-4	Broad Institute of MIT and Harvard	BRD-K21635957			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21+,23-,25-/m0/s1	CWTFRDOIHJRUHI-PYTYSOFPSA-N	548.224654732							122896
BRD-K72533381	LSM-34340		54647174	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-1-2-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-5-7-26-8-6-15/h3-8,10,16,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m1/s1	VGFNAMSCNMBZFO-XOQZDTPSSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K72533381	BRD-K72533381-001-01-5	Broad Institute of MIT and Harvard	BRD-K72533381			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-1-2-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-5-7-26-8-6-15/h3-8,10,16,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m1/s1	VGFNAMSCNMBZFO-XOQZDTPSSA-N	451.210721058							122897
BRD-K27599706	LSM-34341		54647116	InChI=1S/C30H31N3O8/c1-37-20-6-3-18(4-7-20)32-30(36)33-19-5-9-24-22(11-19)23-12-21(40-27(15-34)29(23)41-24)13-28(35)31-14-17-2-8-25-26(10-17)39-16-38-25/h2-11,21,23,27,29,34H,12-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23+,27+,29-/m1/s1	JXDOTDJWTJAHDX-ZDOYKXOFSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NCc5ccc6OCOc6c5)C[C@H]4c3c2)cc1	BroadT	BRD-K27599706	BRD-K27599706-001-01-0	Broad Institute of MIT and Harvard	BRD-K27599706			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)NCc5ccc6OCOc6c5)O[C@H]4CO)c3c2)cc1	InChI=1S/C30H31N3O8/c1-37-20-6-3-18(4-7-20)32-30(36)33-19-5-9-24-22(11-19)23-12-21(40-27(15-34)29(23)41-24)13-28(35)31-14-17-2-8-25-26(10-17)39-16-38-25/h2-11,21,23,27,29,34H,12-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23+,27+,29-/m1/s1	JXDOTDJWTJAHDX-ZDOYKXOFSA-N	561.211114982							122898
BRD-K16047442	LSM-34342		54647364	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22+,26+,28-/m0/s1	DCKQIPUZKHPVQM-PJDAHJOFSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K16047442	BRD-K16047442-001-01-2	Broad Institute of MIT and Harvard	BRD-K16047442			OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22+,26+,28-/m0/s1	DCKQIPUZKHPVQM-PJDAHJOFSA-N	599.187934866							122899
BRD-K86467057	LSM-34343		54647305	InChI=1S/C21H22N2O6/c1-27-19(25)9-14-8-16-15-7-13(23-21(26)12-3-2-6-22-10-12)4-5-17(15)29-20(16)18(11-24)28-14/h2-7,10,14,16,18,20,24H,8-9,11H2,1H3,(H,23,26)/t14-,16-,18-,20+/m0/s1	RMTKIWQMYKPUOR-PFSLXQJOSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	BroadT	BRD-K86467057	BRD-K86467057-001-01-3	Broad Institute of MIT and Harvard	BRD-K86467057			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C21H22N2O6/c1-27-19(25)9-14-8-16-15-7-13(23-21(26)12-3-2-6-22-10-12)4-5-17(15)29-20(16)18(11-24)28-14/h2-7,10,14,16,18,20,24H,8-9,11H2,1H3,(H,23,26)/t14-,16-,18-,20+/m0/s1	RMTKIWQMYKPUOR-PFSLXQJOSA-N	398.147786444							122900
BRD-K29673910	LSM-34344		54647256	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19+,21-,23-/m1/s1	LGHYMYOTKHNHQJ-GUBFDYSESA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K29673910	BRD-K29673910-001-01-3	Broad Institute of MIT and Harvard	BRD-K29673910			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19+,21-,23-/m1/s1	LGHYMYOTKHNHQJ-GUBFDYSESA-N	437.195070994							122901
BRD-K30176130	LSM-34345		54647261	InChI=1S/C30H33N3O6/c1-18(19-6-4-3-5-7-19)31-28(35)16-23-15-25-24-14-21(10-13-26(24)39-29(25)27(17-34)38-23)33-30(36)32-20-8-11-22(37-2)12-9-20/h3-14,18,23,25,27,29,34H,15-17H2,1-2H3,(H,31,35)(H2,32,33,36)/t18-,23-,25+,27+,29-/m0/s1	HXJPIEDLBOYUCY-BANPNDNXSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)N[C@@H](C)c5ccccc5)C[C@@H]4c3c2)cc1	BroadT	BRD-K30176130	BRD-K30176130-001-01-8	Broad Institute of MIT and Harvard	BRD-K30176130			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)N[C@@H](C)c5ccccc5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-18(19-6-4-3-5-7-19)31-28(35)16-23-15-25-24-14-21(10-13-26(24)39-29(25)27(17-34)38-23)33-30(36)32-20-8-11-22(37-2)12-9-20/h3-14,18,23,25,27,29,34H,15-17H2,1-2H3,(H,31,35)(H2,32,33,36)/t18-,23-,25+,27+,29-/m0/s1	HXJPIEDLBOYUCY-BANPNDNXSA-N	531.236935806							122902
BRD-K70039231	LSM-34346		54647236	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17-,19+,21+/m1/s1	DXZPRIFIKXELJX-DOSUHQCWSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	BroadT	BRD-K70039231	BRD-K70039231-001-01-7	Broad Institute of MIT and Harvard	BRD-K70039231			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17-,19+,21+/m1/s1	DXZPRIFIKXELJX-DOSUHQCWSA-N	418.2103867							122903
BRD-K04257723	LSM-34347		54647079	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26+,28-/m0/s1	HIMABYNGDRMZAM-PJDAHJOFSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K04257723	BRD-K04257723-001-01-1	Broad Institute of MIT and Harvard	BRD-K04257723			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26+,28-/m0/s1	HIMABYNGDRMZAM-PJDAHJOFSA-N	534.180229424							122904
BRD-K19862308	LSM-34348		54647345	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22+,24-,26-/m0/s1	OGUMJARTEHRGNP-YXOQKGKWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K19862308	BRD-K19862308-001-01-4	Broad Institute of MIT and Harvard	BRD-K19862308			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22+,24-,26-/m0/s1	OGUMJARTEHRGNP-YXOQKGKWSA-N	491.185649162							122905
BRD-K18136154	LSM-34349		54647135	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,22+/m0/s1	IZHKYGZZVSGRFT-JXYHXMIBSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	BroadT	BRD-K18136154	BRD-K18136154-001-01-9	Broad Institute of MIT and Harvard	BRD-K18136154			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,22+/m0/s1	IZHKYGZZVSGRFT-JXYHXMIBSA-N	441.189985614							122906
BRD-K23637241	LSM-34350		54647390	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20-,22+,24+/m1/s1	FIOSTBRHNPGFJR-NROSNUSPSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34	BroadT	BRD-K23637241	BRD-K23637241-001-01-4	Broad Institute of MIT and Harvard	BRD-K23637241			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20-,22+,24+/m1/s1	FIOSTBRHNPGFJR-NROSNUSPSA-N	485.196213846							122907
BRD-K87146261	LSM-34351		54647247	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19+,21+,23-/m0/s1	XRZWMSINEDMJNA-DLBBVRJLSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K87146261	BRD-K87146261-001-01-4	Broad Institute of MIT and Harvard	BRD-K87146261			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19+,21+,23-/m0/s1	XRZWMSINEDMJNA-DLBBVRJLSA-N	478.157385494							122908
BRD-K73042446	LSM-34352		54647338	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-17-11-19-18-10-16(7-8-20(18)33-23(19)21(13-29)32-17)28-24(31)27-15-5-3-14(25)4-6-15/h3-8,10,17,19,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t17-,19-,21+,23+/m0/s1	UMXSQZGGXDMCPL-VARILPKDSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K73042446	BRD-K73042446-001-01-9	Broad Institute of MIT and Harvard	BRD-K73042446			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-17-11-19-18-10-16(7-8-20(18)33-23(19)21(13-29)32-17)28-24(31)27-15-5-3-14(25)4-6-15/h3-8,10,17,19,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t17-,19-,21+,23+/m0/s1	UMXSQZGGXDMCPL-VARILPKDSA-N	457.201299226							122909
BRD-K40646662	LSM-34353		54647332	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21-,23+,26+/m1/s1	DDTMCUFVLBWJID-USNGTCDTSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K40646662	BRD-K40646662-001-01-4	Broad Institute of MIT and Harvard	BRD-K40646662			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21-,23+,26+/m1/s1	DDTMCUFVLBWJID-USNGTCDTSA-N	467.242021186							122910
BRD-K30772101	LSM-34354		54647082	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26-,28-/m0/s1	HIMABYNGDRMZAM-HYRFHYEVSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K30772101	BRD-K30772101-001-01-9	Broad Institute of MIT and Harvard	BRD-K30772101			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26-,28-/m0/s1	HIMABYNGDRMZAM-HYRFHYEVSA-N	534.180229424							122911
BRD-K63504496	LSM-34355		54647321	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21+,23+,26-/m1/s1	DDTMCUFVLBWJID-MOQXBFPCSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K63504496	BRD-K63504496-001-01-9	Broad Institute of MIT and Harvard	BRD-K63504496			C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21+,23+,26-/m1/s1	DDTMCUFVLBWJID-MOQXBFPCSA-N	467.242021186							122912
BRD-K45859834	LSM-34356		54647262	InChI=1S/C30H33N3O6/c1-18(19-6-4-3-5-7-19)31-28(35)16-23-15-25-24-14-21(10-13-26(24)39-29(25)27(17-34)38-23)33-30(36)32-20-8-11-22(37-2)12-9-20/h3-14,18,23,25,27,29,34H,15-17H2,1-2H3,(H,31,35)(H2,32,33,36)/t18-,23+,25-,27-,29+/m0/s1	HXJPIEDLBOYUCY-PCIULKPKSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)N[C@@H](C)c5ccccc5)C[C@H]4c3c2)cc1	BroadT	BRD-K45859834	BRD-K45859834-001-01-1	Broad Institute of MIT and Harvard	BRD-K45859834			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)N[C@@H](C)c5ccccc5)O[C@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-18(19-6-4-3-5-7-19)31-28(35)16-23-15-25-24-14-21(10-13-26(24)39-29(25)27(17-34)38-23)33-30(36)32-20-8-11-22(37-2)12-9-20/h3-14,18,23,25,27,29,34H,15-17H2,1-2H3,(H,31,35)(H2,32,33,36)/t18-,23+,25-,27-,29+/m0/s1	HXJPIEDLBOYUCY-PCIULKPKSA-N	531.236935806							122913
BRD-K51858914	LSM-34357		54647193	InChI=1S/C28H27F2N3O5/c29-18-1-3-23(30)17(10-18)14-32-26(35)13-20-12-22-21-11-19(33-27(36)9-16-5-7-31-8-6-16)2-4-24(21)38-28(22)25(15-34)37-20/h1-8,10-11,20,22,25,28,34H,9,12-15H2,(H,32,35)(H,33,36)/t20-,22+,25-,28-/m1/s1	QUIMTGQEYLWUJB-HYBZQTAMSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K51858914	BRD-K51858914-001-01-7	Broad Institute of MIT and Harvard	BRD-K51858914			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H27F2N3O5/c29-18-1-3-23(30)17(10-18)14-32-26(35)13-20-12-22-21-11-19(33-27(36)9-16-5-7-31-8-6-16)2-4-24(21)38-28(22)25(15-34)37-20/h1-8,10-11,20,22,25,28,34H,9,12-15H2,(H,32,35)(H,33,36)/t20-,22+,25-,28-/m1/s1	QUIMTGQEYLWUJB-HYBZQTAMSA-N	523.191877394							122914
BRD-K00562490	LSM-34358		54647233	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17+,19-,21-/m1/s1	DXZPRIFIKXELJX-UKHYVGRKSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K00562490	BRD-K00562490-001-01-9	Broad Institute of MIT and Harvard	BRD-K00562490			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17+,19-,21-/m1/s1	DXZPRIFIKXELJX-UKHYVGRKSA-N	418.2103867							122915
BRD-K89423851	LSM-34359		54647365	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22+,26+,28-/m1/s1	DCKQIPUZKHPVQM-HAGKMHAYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K89423851	BRD-K89423851-001-01-1	Broad Institute of MIT and Harvard	BRD-K89423851			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22+,26+,28-/m1/s1	DCKQIPUZKHPVQM-HAGKMHAYSA-N	599.187934866							122916
BRD-K63145472	LSM-34360		54647325	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21-,23-,26+/m0/s1	DDTMCUFVLBWJID-DFJAKQEMSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K63145472	BRD-K63145472-001-01-9	Broad Institute of MIT and Harvard	BRD-K63145472			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21-,23-,26+/m0/s1	DDTMCUFVLBWJID-DFJAKQEMSA-N	467.242021186							122917
BRD-K25081034	LSM-34361		54647196	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24-,26+/m0/s1	NNNMMCMDOXLHLD-IFPZXYOKSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K25081034	BRD-K25081034-001-01-4	Broad Institute of MIT and Harvard	BRD-K25081034			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24-,26+/m0/s1	NNNMMCMDOXLHLD-IFPZXYOKSA-N	556.193354604							122918
BRD-K45984211	LSM-34362		54647110	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24+,26-,28-/m1/s1	HHORGFBYQNPTJA-UQCMEGJUSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K45984211	BRD-K45984211-001-01-0	Broad Institute of MIT and Harvard	BRD-K45984211			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24+,26-,28-/m1/s1	HHORGFBYQNPTJA-UQCMEGJUSA-N	569.21375569							122919
BRD-K09376533	LSM-34363		54647301	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14+,16-,19-/m1/s1	WISUKBIGDPLILZ-MGPHVCOZSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K09376533	BRD-K09376533-001-01-4	Broad Institute of MIT and Harvard	BRD-K09376533			OC[C@H]1O[C@@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14+,16-,19-/m1/s1	WISUKBIGDPLILZ-MGPHVCOZSA-N	361.152537466							122920
BRD-K23694339	LSM-34364		54647113	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24-,26+,28+/m1/s1	HHORGFBYQNPTJA-GJPOJPNFSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K23694339	BRD-K23694339-001-01-8	Broad Institute of MIT and Harvard	BRD-K23694339			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24-,26+,28+/m1/s1	HHORGFBYQNPTJA-GJPOJPNFSA-N	569.21375569							122921
BRD-K29135120	LSM-34365		54647389	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20-,22+,24+/m0/s1	FIOSTBRHNPGFJR-YCYVKTGYSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34	BroadT	BRD-K29135120	BRD-K29135120-001-01-9	Broad Institute of MIT and Harvard	BRD-K29135120			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20-,22+,24+/m0/s1	FIOSTBRHNPGFJR-YCYVKTGYSA-N	485.196213846							122922
BRD-K12115687	LSM-34366		54647229	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17-,19-,21+/m1/s1	DXZPRIFIKXELJX-WELBPKCISA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K12115687	BRD-K12115687-001-01-5	Broad Institute of MIT and Harvard	BRD-K12115687			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17-,19-,21+/m1/s1	DXZPRIFIKXELJX-WELBPKCISA-N	418.2103867							122923
BRD-K35472285	LSM-34367		54647129	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18+,21+,23-/m1/s1	SVPAUNQWUYQQNC-FKVPHHQGSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@H](CO)O2	BroadT	BRD-K35472285	BRD-K35472285-001-01-9	Broad Institute of MIT and Harvard	BRD-K35472285			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)NS(C)(=O)=O)[C@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18+,21+,23-/m1/s1	SVPAUNQWUYQQNC-FKVPHHQGSA-N	476.161721946							122924
BRD-K37431309	LSM-34368		54647371	InChI=1S/C27H28N4O5/c32-16-24-27-22(12-20(35-24)13-25(33)30-15-18-2-1-7-29-14-18)21-11-19(3-4-23(21)36-27)31-26(34)10-17-5-8-28-9-6-17/h1-9,11,14,20,22,24,27,32H,10,12-13,15-16H2,(H,30,33)(H,31,34)/t20-,22+,24+,27-/m1/s1	YINZFYFDFIPTOU-LQZFSELZSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K37431309	BRD-K37431309-001-01-5	Broad Institute of MIT and Harvard	BRD-K37431309			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(12-20(35-24)13-25(33)30-15-18-2-1-7-29-14-18)21-11-19(3-4-23(21)36-27)31-26(34)10-17-5-8-28-9-6-17/h1-9,11,14,20,22,24,27,32H,10,12-13,15-16H2,(H,30,33)(H,31,34)/t20-,22+,24+,27-/m1/s1	YINZFYFDFIPTOU-LQZFSELZSA-N	488.205970036							122925
BRD-K53388755	LSM-34369		54647257	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19+,21-,23-/m0/s1	LGHYMYOTKHNHQJ-FTJYFCJYSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K53388755	BRD-K53388755-001-01-5	Broad Institute of MIT and Harvard	BRD-K53388755			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19+,21-,23-/m0/s1	LGHYMYOTKHNHQJ-FTJYFCJYSA-N	437.195070994							122926
BRD-K09271653	LSM-34370		54647320	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21+,23+,26-/m0/s1	DDTMCUFVLBWJID-XBQOOLIGSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K09271653	BRD-K09271653-001-01-1	Broad Institute of MIT and Harvard	BRD-K09271653			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21+,23+,26-/m0/s1	DDTMCUFVLBWJID-XBQOOLIGSA-N	467.242021186							122927
BRD-K17285234	LSM-34371		54647102	InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21+,23+,25-/m1/s1	SRZDSTZFHOVQBI-IQKBUIRBSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NCC5CC5)C[C@H]4c3c2)cc1	BroadT	BRD-K17285234	BRD-K17285234-001-01-9	Broad Institute of MIT and Harvard	BRD-K17285234			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)NCC5CC5)O[C@H]4CO)c3c2)cc1	InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21+,23+,25-/m1/s1	SRZDSTZFHOVQBI-IQKBUIRBSA-N	481.221285742							122928
BRD-K71452126	LSM-34372		54647274	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16-,18+/m0/s1	NJJKNLQQLZQTIZ-WIRVQXDCSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K71452126	BRD-K71452126-001-01-9	Broad Institute of MIT and Harvard	BRD-K71452126			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16-,18+/m0/s1	NJJKNLQQLZQTIZ-WIRVQXDCSA-N	414.146071882							122929
BRD-K55164454	LSM-34373		54647085	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27-,31-,33+/m1/s1	DKMWIPSTNBBBEH-OJWGAMAXSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K55164454	BRD-K55164454-001-01-2	Broad Institute of MIT and Harvard	BRD-K55164454			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27-,31-,33+/m1/s1	DKMWIPSTNBBBEH-OJWGAMAXSA-N	597.227513974							122930
BRD-K44675576	LSM-34374		54647347	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22-,24+,26+/m1/s1	OGUMJARTEHRGNP-GUAAGHCTSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K44675576	BRD-K44675576-001-01-4	Broad Institute of MIT and Harvard	BRD-K44675576			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22-,24+,26+/m1/s1	OGUMJARTEHRGNP-GUAAGHCTSA-N	491.185649162							122931
BRD-K85572169	LSM-34375		54647142	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21-,23-,25+/m0/s1	CWTFRDOIHJRUHI-YALMDMJRSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@H](CO)O2	BroadT	BRD-K85572169	BRD-K85572169-001-01-6	Broad Institute of MIT and Harvard	BRD-K85572169			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21-,23-,25+/m0/s1	CWTFRDOIHJRUHI-YALMDMJRSA-N	548.224654732							122932
BRD-K58066822	LSM-34376		54647230	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17-,19-,21+/m0/s1	DXZPRIFIKXELJX-WRGRXTPVSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	BroadT	BRD-K58066822	BRD-K58066822-001-01-1	Broad Institute of MIT and Harvard	BRD-K58066822			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17-,19-,21+/m0/s1	DXZPRIFIKXELJX-WRGRXTPVSA-N	418.2103867							122933
BRD-K24946412	LSM-15123		54647362	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22-,26-,28+/m1/s1	DCKQIPUZKHPVQM-DFQMGKBUSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K24946412	BRD-K24946412-001-01-1	Broad Institute of MIT and Harvard	BRD-K24946412			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22-,26-,28+/m1/s1	DCKQIPUZKHPVQM-DFQMGKBUSA-N	599.187934866							103779
BRD-K33268483	LSM-34377		54647300	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14+,16+,19-/m1/s1	WISUKBIGDPLILZ-BDOZRKEQSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K33268483	BRD-K33268483-001-01-3	Broad Institute of MIT and Harvard	BRD-K33268483			OC[C@@H]1O[C@@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14+,16+,19-/m1/s1	WISUKBIGDPLILZ-BDOZRKEQSA-N	361.152537466							122934
BRD-K21384875	LSM-34378		54647088	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27+,31+,33-/m1/s1	DKMWIPSTNBBBEH-HJKILOPXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K21384875	BRD-K21384875-001-01-8	Broad Institute of MIT and Harvard	BRD-K21384875			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27+,31+,33-/m1/s1	DKMWIPSTNBBBEH-HJKILOPXSA-N	597.227513974							122935
BRD-K06279388	LSM-34379		54647121	InChI=1S/C29H30FN3O6/c1-37-20-9-6-18(7-10-20)32-29(36)33-19-8-11-25-22(12-19)23-13-21(38-26(16-34)28(23)39-25)14-27(35)31-15-17-4-2-3-5-24(17)30/h2-12,21,23,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,26-,28+/m0/s1	CTJBWDZBZUSCES-ZVMBZZGVSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NCc5ccccc5F)C[C@H]4c3c2)cc1	BroadT	BRD-K06279388	BRD-K06279388-001-01-9	Broad Institute of MIT and Harvard	BRD-K06279388			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NCc5ccccc5F)O[C@H]4CO)c3c2)cc1	InChI=1S/C29H30FN3O6/c1-37-20-9-6-18(7-10-20)32-29(36)33-19-8-11-25-22(12-19)23-13-21(38-26(16-34)28(23)39-25)14-27(35)31-15-17-4-2-3-5-24(17)30/h2-12,21,23,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,26-,28+/m0/s1	CTJBWDZBZUSCES-ZVMBZZGVSA-N	535.21186391							122936
BRD-K43918778	LSM-34380		54647189	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26-,28+,30+/m0/s1	XMRNAPLDHHXMNZ-QHBLOKIQSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)N5CCc6ccccc6C5)C[C@H]4c3c2)cc1	BroadT	BRD-K43918778	BRD-K43918778-001-01-5	Broad Institute of MIT and Harvard	BRD-K43918778			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)N5CCc6ccccc6C5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26-,28+,30+/m0/s1	XMRNAPLDHHXMNZ-QHBLOKIQSA-N	543.236935806							122937
BRD-K61092554	LSM-34381		54647329	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21-,23+,26+/m1/s1	DDTMCUFVLBWJID-OJEVSNHRSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K61092554	BRD-K61092554-001-01-6	Broad Institute of MIT and Harvard	BRD-K61092554			C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21-,23+,26+/m1/s1	DDTMCUFVLBWJID-OJEVSNHRSA-N	467.242021186							122938
BRD-K45471346	LSM-34382		54647148	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21-,23+,25+/m1/s1	CWTFRDOIHJRUHI-ASASOQJESA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@H](CO)O2	BroadT	BRD-K45471346	BRD-K45471346-001-01-6	Broad Institute of MIT and Harvard	BRD-K45471346			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21-,23+,25+/m1/s1	CWTFRDOIHJRUHI-ASASOQJESA-N	548.224654732							122939
BRD-K09078201	LSM-34383		54647213	InChI=1S/C23H23F4N3O5/c24-16-3-1-2-4-17(16)30-22(33)29-12-5-6-18-14(7-12)15-8-13(34-19(10-31)21(15)35-18)9-20(32)28-11-23(25,26)27/h1-7,13,15,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t13-,15+,19-,21-/m0/s1	JNBFYQYHHCPVEU-FPDBKICDSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccccc4F)cc23	BroadT	BRD-K09078201	BRD-K09078201-001-01-7	Broad Institute of MIT and Harvard	BRD-K09078201			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C23H23F4N3O5/c24-16-3-1-2-4-17(16)30-22(33)29-12-5-6-18-14(7-12)15-8-13(34-19(10-31)21(15)35-18)9-20(32)28-11-23(25,26)27/h1-7,13,15,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t13-,15+,19-,21-/m0/s1	JNBFYQYHHCPVEU-FPDBKICDSA-N	497.157383666							122940
BRD-K09367542	LSM-34384		54647251	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19-,21+,23+/m0/s1	XRZWMSINEDMJNA-PZMSFCMUSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K09367542	BRD-K09367542-001-01-2	Broad Institute of MIT and Harvard	BRD-K09367542			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19-,21+,23+/m0/s1	XRZWMSINEDMJNA-PZMSFCMUSA-N	478.157385494							122941
BRD-K62219570	LSM-34385		54647310	InChI=1S/C21H22N2O6/c1-27-19(25)9-14-8-16-15-7-13(23-21(26)12-3-2-6-22-10-12)4-5-17(15)29-20(16)18(11-24)28-14/h2-7,10,14,16,18,20,24H,8-9,11H2,1H3,(H,23,26)/t14-,16-,18+,20+/m1/s1	RMTKIWQMYKPUOR-BIJSTVTOSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	BroadT	BRD-K62219570	BRD-K62219570-001-01-4	Broad Institute of MIT and Harvard	BRD-K62219570			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C21H22N2O6/c1-27-19(25)9-14-8-16-15-7-13(23-21(26)12-3-2-6-22-10-12)4-5-17(15)29-20(16)18(11-24)28-14/h2-7,10,14,16,18,20,24H,8-9,11H2,1H3,(H,23,26)/t14-,16-,18+,20+/m1/s1	RMTKIWQMYKPUOR-BIJSTVTOSA-N	398.147786444							122942
BRD-K43292469	LSM-34386		54647180	InChI=1S/C20H25NO6/c1-25-19(24)9-13-8-15-14-7-12(21-18(23)6-11-2-3-11)4-5-16(14)27-20(15)17(10-22)26-13/h4-5,7,11,13,15,17,20,22H,2-3,6,8-10H2,1H3,(H,21,23)/t13-,15+,17+,20-/m0/s1	RBGXSVUHPLBJIK-XEQBAVFLSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K43292469	BRD-K43292469-001-01-9	Broad Institute of MIT and Harvard	BRD-K43292469			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C20H25NO6/c1-25-19(24)9-13-8-15-14-7-12(21-18(23)6-11-2-3-11)4-5-16(14)27-20(15)17(10-22)26-13/h4-5,7,11,13,15,17,20,22H,2-3,6,8-10H2,1H3,(H,21,23)/t13-,15+,17+,20-/m0/s1	RBGXSVUHPLBJIK-XEQBAVFLSA-N	375.16818753							122943
BRD-K95648552	LSM-34387		54647334	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-17-11-19-18-10-16(7-8-20(18)33-23(19)21(13-29)32-17)28-24(31)27-15-5-3-14(25)4-6-15/h3-8,10,17,19,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t17-,19-,21-,23+/m1/s1	UMXSQZGGXDMCPL-LHWDRQQYSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K95648552	BRD-K95648552-001-01-7	Broad Institute of MIT and Harvard	BRD-K95648552			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-17-11-19-18-10-16(7-8-20(18)33-23(19)21(13-29)32-17)28-24(31)27-15-5-3-14(25)4-6-15/h3-8,10,17,19,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t17-,19-,21-,23+/m1/s1	UMXSQZGGXDMCPL-LHWDRQQYSA-N	457.201299226							122944
BRD-K74317118	LSM-34388		54647152	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20+,22+,25-/m1/s1	GQOLZDUAMZVUJK-XOQZDTPSSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc(OC)cc4)C[C@H]3c2c1	BroadT	BRD-K74317118	BRD-K74317118-001-01-1	Broad Institute of MIT and Harvard	BRD-K74317118			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(OC)cc4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20+,22+,25-/m1/s1	GQOLZDUAMZVUJK-XOQZDTPSSA-N	470.20530132							122945
BRD-K95963125	LSM-34389		54647328	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21+,23-,26-/m0/s1	DDTMCUFVLBWJID-YPQJORDQSA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K95963125	BRD-K95963125-001-01-8	Broad Institute of MIT and Harvard	BRD-K95963125			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21+,23-,26-/m0/s1	DDTMCUFVLBWJID-YPQJORDQSA-N	467.242021186							122946
BRD-K13849015	LSM-34390		54647297	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14-,16-,19+/m1/s1	WISUKBIGDPLILZ-QNDNMDDASA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K13849015	BRD-K13849015-001-01-1	Broad Institute of MIT and Harvard	BRD-K13849015			OC[C@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14-,16-,19+/m1/s1	WISUKBIGDPLILZ-QNDNMDDASA-N	361.152537466							122947
BRD-K51054234	LSM-34391		54647313	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24+,27-/m0/s1	YWCZLJIWAJYPHK-YRGRZTQCSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K51054234	BRD-K51054234-001-01-6	Broad Institute of MIT and Harvard	BRD-K51054234			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24+,27-/m0/s1	YWCZLJIWAJYPHK-YRGRZTQCSA-N	464.231122144							122948
BRD-K64317863	LSM-34392		54647238	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20-,22+/m0/s1	RVCZJXOSFIZTQF-JXYHXMIBSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K64317863	BRD-K64317863-001-01-0	Broad Institute of MIT and Harvard	BRD-K64317863			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20-,22+/m0/s1	RVCZJXOSFIZTQF-JXYHXMIBSA-N	414.21547208							122949
BRD-K05329107	LSM-34393		54647122	InChI=1S/C29H30FN3O6/c1-37-20-9-6-18(7-10-20)32-29(36)33-19-8-11-25-22(12-19)23-13-21(38-26(16-34)28(23)39-25)14-27(35)31-15-17-4-2-3-5-24(17)30/h2-12,21,23,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23+,26+,28-/m1/s1	CTJBWDZBZUSCES-DTZJUZMMSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NCc5ccccc5F)C[C@H]4c3c2)cc1	BroadT	BRD-K05329107	BRD-K05329107-001-01-3	Broad Institute of MIT and Harvard	BRD-K05329107			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)NCc5ccccc5F)O[C@H]4CO)c3c2)cc1	InChI=1S/C29H30FN3O6/c1-37-20-9-6-18(7-10-20)32-29(36)33-19-8-11-25-22(12-19)23-13-21(38-26(16-34)28(23)39-25)14-27(35)31-15-17-4-2-3-5-24(17)30/h2-12,21,23,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23+,26+,28-/m1/s1	CTJBWDZBZUSCES-DTZJUZMMSA-N	535.21186391							122950
BRD-K74512976	LSM-34394		54647123	InChI=1S/C29H30FN3O6/c1-37-20-9-6-18(7-10-20)32-29(36)33-19-8-11-25-22(12-19)23-13-21(38-26(16-34)28(23)39-25)14-27(35)31-15-17-4-2-3-5-24(17)30/h2-12,21,23,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23+,26-,28-/m0/s1	CTJBWDZBZUSCES-UKEKDYKDSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NCc5ccccc5F)C[C@@H]4c3c2)cc1	BroadT	BRD-K74512976	BRD-K74512976-001-01-8	Broad Institute of MIT and Harvard	BRD-K74512976			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)NCc5ccccc5F)O[C@H]4CO)c3c2)cc1	InChI=1S/C29H30FN3O6/c1-37-20-9-6-18(7-10-20)32-29(36)33-19-8-11-25-22(12-19)23-13-21(38-26(16-34)28(23)39-25)14-27(35)31-15-17-4-2-3-5-24(17)30/h2-12,21,23,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23+,26-,28-/m0/s1	CTJBWDZBZUSCES-UKEKDYKDSA-N	535.21186391							122951
BRD-K25538169	LSM-34395		54647192	InChI=1S/C28H27F2N3O5/c29-18-1-3-23(30)17(10-18)14-32-26(35)13-20-12-22-21-11-19(33-27(36)9-16-5-7-31-8-6-16)2-4-24(21)38-28(22)25(15-34)37-20/h1-8,10-11,20,22,25,28,34H,9,12-15H2,(H,32,35)(H,33,36)/t20-,22+,25+,28-/m1/s1	QUIMTGQEYLWUJB-QITUIKSUSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K25538169	BRD-K25538169-001-01-0	Broad Institute of MIT and Harvard	BRD-K25538169			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H27F2N3O5/c29-18-1-3-23(30)17(10-18)14-32-26(35)13-20-12-22-21-11-19(33-27(36)9-16-5-7-31-8-6-16)2-4-24(21)38-28(22)25(15-34)37-20/h1-8,10-11,20,22,25,28,34H,9,12-15H2,(H,32,35)(H,33,36)/t20-,22+,25+,28-/m1/s1	QUIMTGQEYLWUJB-QITUIKSUSA-N	523.191877394							122952
BRD-K09977699	LSM-34396		54647177	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-1-2-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-5-7-26-8-6-15/h3-8,10,16,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m1/s1	VGFNAMSCNMBZFO-NARIEAHCSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K09977699	BRD-K09977699-001-01-9	Broad Institute of MIT and Harvard	BRD-K09977699			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-1-2-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-5-7-26-8-6-15/h3-8,10,16,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m1/s1	VGFNAMSCNMBZFO-NARIEAHCSA-N	451.210721058							122953
BRD-K55510118	LSM-34397		54647131	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18+,21-,23-/m0/s1	SVPAUNQWUYQQNC-WKABAGCOSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@H](CO)O2	BroadT	BRD-K55510118	BRD-K55510118-001-01-4	Broad Institute of MIT and Harvard	BRD-K55510118			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(cc23)NS(C)(=O)=O)[C@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18+,21-,23-/m0/s1	SVPAUNQWUYQQNC-WKABAGCOSA-N	476.161721946							122954
BRD-K66432757	LSM-34398		54647385	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20+,22+,24-/m0/s1	FIOSTBRHNPGFJR-AYEZKCMBSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34	BroadT	BRD-K66432757	BRD-K66432757-001-01-4	Broad Institute of MIT and Harvard	BRD-K66432757			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20+,22+,24-/m0/s1	FIOSTBRHNPGFJR-AYEZKCMBSA-N	485.196213846							122955
BRD-K31559225	LSM-34399		54647387	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20+,22-,24-/m1/s1	FIOSTBRHNPGFJR-USHXRURQSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34	BroadT	BRD-K31559225	BRD-K31559225-001-01-0	Broad Institute of MIT and Harvard	BRD-K31559225			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20+,22-,24-/m1/s1	FIOSTBRHNPGFJR-USHXRURQSA-N	485.196213846							122956
BRD-K91079447	LSM-34400		54647143	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21+,23+,25-/m0/s1	CWTFRDOIHJRUHI-VUHNXCBZSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@@H](CO)O2	BroadT	BRD-K91079447	BRD-K91079447-001-01-8	Broad Institute of MIT and Harvard	BRD-K91079447			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21+,23+,25-/m0/s1	CWTFRDOIHJRUHI-VUHNXCBZSA-N	548.224654732							122957
BRD-K10317744	LSM-34401		54647218	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,24-/m1/s1	RDOSCOXXMIXCDB-USHXRURQSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K10317744	BRD-K10317744-001-01-0	Broad Institute of MIT and Harvard	BRD-K10317744			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,24-/m1/s1	RDOSCOXXMIXCDB-USHXRURQSA-N	451.210721058							122958
BRD-K08190558	LSM-34402		54647303	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14-,16+,19+/m0/s1	WISUKBIGDPLILZ-UETVFIHBSA-N	OC[C@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K08190558	BRD-K08190558-001-01-0	Broad Institute of MIT and Harvard	BRD-K08190558			OC[C@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14-,16+,19+/m0/s1	WISUKBIGDPLILZ-UETVFIHBSA-N	361.152537466							122959
CHEMBL2361342	LSM-34403	BRD-K27638063, SID131443480	54647106	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24-,26-,28+/m1/s1	HHORGFBYQNPTJA-HXCADUBKSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K27638063	BRD-K27638063-001-01-3	Broad Institute of MIT and Harvard	BRD-K27638063			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24-,26-,28+/m1/s1	HHORGFBYQNPTJA-HXCADUBKSA-N	569.21375569							122960
BRD-K86912219	LSM-34404		54647097	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21+,26-,28-/m0/s1	QPCDPRLGXJQWSH-HCJMUSFBSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccccc5F)cc34)[C@H](CO)O2	BroadT	BRD-K86912219	BRD-K86912219-001-01-3	Broad Institute of MIT and Harvard	BRD-K86912219			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21+,26-,28-/m0/s1	QPCDPRLGXJQWSH-HCJMUSFBSA-N	535.21186391							122961
BRD-K87803080	LSM-34405		54647290	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18-,20+/m0/s1	BVUMLAQBIXIYMI-PFSLXQJOSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)NC4CCCCC4)cc23	BroadT	BRD-K87803080	BRD-K87803080-001-01-9	Broad Institute of MIT and Harvard	BRD-K87803080			OC[C@@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18-,20+/m0/s1	BVUMLAQBIXIYMI-PFSLXQJOSA-N	404.194736636							122962
BRD-K35308744	LSM-34406		54647115	InChI=1S/C30H31N3O8/c1-37-20-6-3-18(4-7-20)32-30(36)33-19-5-9-24-22(11-19)23-12-21(40-27(15-34)29(23)41-24)13-28(35)31-14-17-2-8-25-26(10-17)39-16-38-25/h2-11,21,23,27,29,34H,12-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,27-,29+/m0/s1	JXDOTDJWTJAHDX-AVRHNVJQSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NCc5ccc6OCOc6c5)C[C@H]4c3c2)cc1	BroadT	BRD-K35308744	BRD-K35308744-001-01-0	Broad Institute of MIT and Harvard	BRD-K35308744			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NCc5ccc6OCOc6c5)O[C@H]4CO)c3c2)cc1	InChI=1S/C30H31N3O8/c1-37-20-6-3-18(4-7-20)32-30(36)33-19-5-9-24-22(11-19)23-12-21(40-27(15-34)29(23)41-24)13-28(35)31-14-17-2-8-25-26(10-17)39-16-38-25/h2-11,21,23,27,29,34H,12-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,27-,29+/m0/s1	JXDOTDJWTJAHDX-AVRHNVJQSA-N	561.211114982							122963
BRD-K93942001	LSM-34407		54647207	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21-,24-/m1/s1	AXSMPGQCOGKKGU-RMIRKMSDSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K93942001	BRD-K93942001-001-01-3	Broad Institute of MIT and Harvard	BRD-K93942001			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccncc4)O[C@@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21-,24-/m1/s1	AXSMPGQCOGKKGU-RMIRKMSDSA-N	454.2216201							122964
BRD-K75073699	LSM-34408		54647090	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27+,31-,33-/m0/s1	DKMWIPSTNBBBEH-PAVOZPKOSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K75073699	BRD-K75073699-001-01-6	Broad Institute of MIT and Harvard	BRD-K75073699			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27+,31-,33-/m0/s1	DKMWIPSTNBBBEH-PAVOZPKOSA-N	597.227513974							122965
BRD-K13719101	LSM-34409		54647164	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19-,23+,25+/m1/s1	GLTVTIDBZPANQC-WAAPLTFYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K13719101	BRD-K13719101-001-01-1	Broad Institute of MIT and Harvard	BRD-K13719101			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19-,23+,25+/m1/s1	GLTVTIDBZPANQC-WAAPLTFYSA-N	480.189651256							122966
BRD-K57271749	LSM-34410		54647369	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22-,26+,28+/m1/s1	DCKQIPUZKHPVQM-OEZGUAFWSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K57271749	BRD-K57271749-001-01-8	Broad Institute of MIT and Harvard	BRD-K57271749			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22-,26+,28+/m1/s1	DCKQIPUZKHPVQM-OEZGUAFWSA-N	599.187934866							122967
BRD-K77498991	LSM-34411		54647119	InChI=1S/C30H31N3O8/c1-37-20-6-3-18(4-7-20)32-30(36)33-19-5-9-24-22(11-19)23-12-21(40-27(15-34)29(23)41-24)13-28(35)31-14-17-2-8-25-26(10-17)39-16-38-25/h2-11,21,23,27,29,34H,12-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,27+,29+/m1/s1	JXDOTDJWTJAHDX-YNXFXDROSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)NCc5ccc6OCOc6c5)C[C@@H]4c3c2)cc1	BroadT	BRD-K77498991	BRD-K77498991-001-01-8	Broad Institute of MIT and Harvard	BRD-K77498991			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NCc5ccc6OCOc6c5)O[C@H]4CO)c3c2)cc1	InChI=1S/C30H31N3O8/c1-37-20-6-3-18(4-7-20)32-30(36)33-19-5-9-24-22(11-19)23-12-21(40-27(15-34)29(23)41-24)13-28(35)31-14-17-2-8-25-26(10-17)39-16-38-25/h2-11,21,23,27,29,34H,12-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,27+,29+/m1/s1	JXDOTDJWTJAHDX-YNXFXDROSA-N	561.211114982							122968
BRD-K01358985	LSM-34412		54647089	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27+,31-,33-/m1/s1	DKMWIPSTNBBBEH-RABBPKIPSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K01358985	BRD-K01358985-001-01-3	Broad Institute of MIT and Harvard	BRD-K01358985			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27+,31-,33-/m1/s1	DKMWIPSTNBBBEH-RABBPKIPSA-N	597.227513974							122969
BRD-K81656074	LSM-34413		54647185	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26-,28-,30+/m0/s1	XMRNAPLDHHXMNZ-CWHYYPOISA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)N5CCc6ccccc6C5)C[C@H]4c3c2)cc1	BroadT	BRD-K81656074	BRD-K81656074-001-01-5	Broad Institute of MIT and Harvard	BRD-K81656074			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)N5CCc6ccccc6C5)O[C@H]4CO)c3c2)cc1	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26-,28-,30+/m0/s1	XMRNAPLDHHXMNZ-CWHYYPOISA-N	543.236935806							122970
BRD-K84792324	LSM-34414		54647383	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20-,22-,24+/m1/s1	FIOSTBRHNPGFJR-YWWGLXIYSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34	BroadT	BRD-K84792324	BRD-K84792324-001-01-3	Broad Institute of MIT and Harvard	BRD-K84792324			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20-,22-,24+/m1/s1	FIOSTBRHNPGFJR-YWWGLXIYSA-N	485.196213846							122971
BRD-K56868780	LSM-34415		54647280	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16+,18+/m1/s1	NJJKNLQQLZQTIZ-CAGXHZNZSA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K56868780	BRD-K56868780-001-01-2	Broad Institute of MIT and Harvard	BRD-K56868780			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16+,18+/m1/s1	NJJKNLQQLZQTIZ-CAGXHZNZSA-N	414.146071882							122972
BRD-K45569026	LSM-34416		54647163	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19-,23+,25+/m0/s1	GLTVTIDBZPANQC-WPSJIRAHSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K45569026	BRD-K45569026-001-01-4	Broad Institute of MIT and Harvard	BRD-K45569026			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19-,23+,25+/m0/s1	GLTVTIDBZPANQC-WPSJIRAHSA-N	480.189651256							122973
BRD-K27885385	LSM-34417		54647376	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18-,20+/m1/s1	VBPXJTQPFOPDPZ-ODZKNYGOSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccccc4)cc23	BroadT	BRD-K27885385	BRD-K27885385-001-01-1	Broad Institute of MIT and Harvard	BRD-K27885385			OC[C@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18-,20+/m1/s1	VBPXJTQPFOPDPZ-ODZKNYGOSA-N	398.147786444							122974
BRD-K73680186	LSM-34418		54647309	InChI=1S/C21H22N2O6/c1-27-19(25)9-14-8-16-15-7-13(23-21(26)12-3-2-6-22-10-12)4-5-17(15)29-20(16)18(11-24)28-14/h2-7,10,14,16,18,20,24H,8-9,11H2,1H3,(H,23,26)/t14-,16-,18+,20+/m0/s1	RMTKIWQMYKPUOR-LBLLVPRASA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	BroadT	BRD-K73680186	BRD-K73680186-001-01-0	Broad Institute of MIT and Harvard	BRD-K73680186			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C21H22N2O6/c1-27-19(25)9-14-8-16-15-7-13(23-21(26)12-3-2-6-22-10-12)4-5-17(15)29-20(16)18(11-24)28-14/h2-7,10,14,16,18,20,24H,8-9,11H2,1H3,(H,23,26)/t14-,16-,18+,20+/m0/s1	RMTKIWQMYKPUOR-LBLLVPRASA-N	398.147786444							122975
BRD-K75076471	LSM-34419		54647396	InChI=1S/C25H31N3O7/c1-32-10-9-26-23(30)13-18-12-20-19-11-16(5-8-21(19)35-24(20)22(14-29)34-18)28-25(31)27-15-3-6-17(33-2)7-4-15/h3-8,11,18,20,22,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H2,27,28,31)/t18-,20-,22+,24+/m1/s1	DSSRCRDYJCNLRE-NROSNUSPSA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(OC)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K75076471	BRD-K75076471-001-01-3	Broad Institute of MIT and Harvard	BRD-K75076471			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(OC)cc4)cc23)[C@H](CO)O1	InChI=1S/C25H31N3O7/c1-32-10-9-26-23(30)13-18-12-20-19-11-16(5-8-21(19)35-24(20)22(14-29)34-18)28-25(31)27-15-3-6-17(33-2)7-4-15/h3-8,11,18,20,22,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H2,27,28,31)/t18-,20-,22+,24+/m1/s1	DSSRCRDYJCNLRE-NROSNUSPSA-N	485.216200362							122976
BRD-K79334072	LSM-34420		54647272	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27-,29+,31+/m1/s1	DTKVBNZNKFXGOR-FKUMXQRRSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCC6)cc45	BroadT	BRD-K79334072	BRD-K79334072-001-01-5	Broad Institute of MIT and Harvard	BRD-K79334072			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27-,29+,31+/m1/s1	DTKVBNZNKFXGOR-FKUMXQRRSA-N	526.246772208							122977
BRD-K08000110	LSM-34421		54647296	InChI=1S/C35H35N3O6/c1-42-27-14-11-25(12-15-27)37-35(41)38-26-13-16-31-29(17-26)30-18-28(43-32(21-39)34(30)44-31)19-33(40)36-20-22-7-9-24(10-8-22)23-5-3-2-4-6-23/h2-17,28,30,32,34,39H,18-21H2,1H3,(H,36,40)(H2,37,38,41)/t28-,30+,32+,34-/m1/s1	TZDANBXLWORGOS-WXLSAOMQSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NCc5ccc(cc5)c6ccccc6)C[C@H]4c3c2)cc1	BroadT	BRD-K08000110	BRD-K08000110-001-01-2	Broad Institute of MIT and Harvard	BRD-K08000110			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)NCc5ccc(cc5)-c5ccccc5)O[C@H]4CO)c3c2)cc1	InChI=1S/C35H35N3O6/c1-42-27-14-11-25(12-15-27)37-35(41)38-26-13-16-31-29(17-26)30-18-28(43-32(21-39)34(30)44-31)19-33(40)36-20-22-7-9-24(10-8-22)23-5-3-2-4-6-23/h2-17,28,30,32,34,39H,18-21H2,1H3,(H,36,40)(H2,37,38,41)/t28-,30+,32+,34-/m1/s1	TZDANBXLWORGOS-WXLSAOMQSA-N	593.25258587							122978
BRD-K34095226	LSM-34422		54647224	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19+,21+,23-/m1/s1	HOUMZMKGURXYQW-QXPQREGVSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K34095226	BRD-K34095226-001-01-1	Broad Institute of MIT and Harvard	BRD-K34095226			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19+,21+,23-/m1/s1	HOUMZMKGURXYQW-QXPQREGVSA-N	453.189985614							122979
BRD-K49203165	LSM-34423		54647323	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21+,23+,26-/m1/s1	DDTMCUFVLBWJID-UYBWFFGASA-N	C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K49203165	BRD-K49203165-001-01-7	Broad Institute of MIT and Harvard	BRD-K49203165			C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21+,23+,26-/m1/s1	DDTMCUFVLBWJID-UYBWFFGASA-N	467.242021186							122980
BRD-K00020149	LSM-34424		54647250	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19+,21-,23-/m0/s1	XRZWMSINEDMJNA-RZNKLVQRSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K00020149	BRD-K00020149-001-01-3	Broad Institute of MIT and Harvard	BRD-K00020149			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19+,21-,23-/m0/s1	XRZWMSINEDMJNA-RZNKLVQRSA-N	478.157385494							122981
BRD-K45734531	LSM-34425		54647287	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19-,21+,23+/m0/s1	ZRCRXWGBTMXJDJ-VARILPKDSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K45734531	BRD-K45734531-001-01-2	Broad Institute of MIT and Harvard	BRD-K45734531			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19-,21+,23+/m0/s1	ZRCRXWGBTMXJDJ-VARILPKDSA-N	443.242021186							122982
BRD-K53186055	LSM-34426		54647295	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18+,20+/m1/s1	BVUMLAQBIXIYMI-BIJSTVTOSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)NC4CCCCC4)cc23	BroadT	BRD-K53186055	BRD-K53186055-001-01-0	Broad Institute of MIT and Harvard	BRD-K53186055			OC[C@@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18+,20+/m1/s1	BVUMLAQBIXIYMI-BIJSTVTOSA-N	404.194736636							122983
BRD-K40610042	LSM-34427		54647378	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16+,18+,20-/m1/s1	VBPXJTQPFOPDPZ-VKSDOSABSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccccc4)cc23	BroadT	BRD-K40610042	BRD-K40610042-001-01-1	Broad Institute of MIT and Harvard	BRD-K40610042			OC[C@@H]1O[C@@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16+,18+,20-/m1/s1	VBPXJTQPFOPDPZ-VKSDOSABSA-N	398.147786444							122984
BRD-K55852567	LSM-34428		54647220	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,24+/m0/s1	RDOSCOXXMIXCDB-YCYVKTGYSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K55852567	BRD-K55852567-001-01-6	Broad Institute of MIT and Harvard	BRD-K55852567			OC[C@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,24+/m0/s1	RDOSCOXXMIXCDB-YCYVKTGYSA-N	451.210721058							122985
BRD-K07396550	LSM-34429		54647096	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21+,26-,28-/m1/s1	QPCDPRLGXJQWSH-ZAESVHBDSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccccc5F)cc34)[C@@H](CO)O2	BroadT	BRD-K07396550	BRD-K07396550-001-01-2	Broad Institute of MIT and Harvard	BRD-K07396550			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21+,26-,28-/m1/s1	QPCDPRLGXJQWSH-ZAESVHBDSA-N	535.21186391							122986
BRD-K32947579	LSM-34430		54647337	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-17-11-19-18-10-16(7-8-20(18)33-23(19)21(13-29)32-17)28-24(31)27-15-5-3-14(25)4-6-15/h3-8,10,17,19,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t17-,19+,21-,23-/m0/s1	UMXSQZGGXDMCPL-FTJYFCJYSA-N	CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K32947579	BRD-K32947579-001-01-8	Broad Institute of MIT and Harvard	BRD-K32947579			CCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-17-11-19-18-10-16(7-8-20(18)33-23(19)21(13-29)32-17)28-24(31)27-15-5-3-14(25)4-6-15/h3-8,10,17,19,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t17-,19+,21-,23-/m0/s1	UMXSQZGGXDMCPL-FTJYFCJYSA-N	457.201299226							122987
BRD-K74667984	LSM-15160		54647077	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26-,28+/m1/s1	HIMABYNGDRMZAM-DFQMGKBUSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K74667984	BRD-K74667984-001-01-0	Broad Institute of MIT and Harvard	BRD-K74667984			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26-,28+/m1/s1	HIMABYNGDRMZAM-DFQMGKBUSA-N	534.180229424							103816
BRD-K33505770	LSM-34431		54647084	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26+,28+/m1/s1	HIMABYNGDRMZAM-OEZGUAFWSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K33505770	BRD-K33505770-001-01-0	Broad Institute of MIT and Harvard	BRD-K33505770			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26+,28+/m1/s1	HIMABYNGDRMZAM-OEZGUAFWSA-N	534.180229424							122988
CHEMBL2358401	LSM-15117	BRD-K17712926, SID131443481	54647107	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24-,26-,28+/m0/s1	HHORGFBYQNPTJA-AJWNWGNMSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K17712926	BRD-K17712926-001-01-5	Broad Institute of MIT and Harvard	BRD-K17712926			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24-,26-,28+/m0/s1	HHORGFBYQNPTJA-AJWNWGNMSA-N	569.21375569							103773
BRD-K22839533	LSM-34432		54647260	InChI=1S/C30H33N3O6/c1-18(19-6-4-3-5-7-19)31-28(35)16-23-15-25-24-14-21(10-13-26(24)39-29(25)27(17-34)38-23)33-30(36)32-20-8-11-22(37-2)12-9-20/h3-14,18,23,25,27,29,34H,15-17H2,1-2H3,(H,31,35)(H2,32,33,36)/t18-,23-,25-,27-,29+/m0/s1	HXJPIEDLBOYUCY-PFPGSGFYSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)N[C@@H](C)c5ccccc5)C[C@H]4c3c2)cc1	BroadT	BRD-K22839533	BRD-K22839533-001-01-4	Broad Institute of MIT and Harvard	BRD-K22839533			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)N[C@@H](C)c5ccccc5)O[C@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-18(19-6-4-3-5-7-19)31-28(35)16-23-15-25-24-14-21(10-13-26(24)39-29(25)27(17-34)38-23)33-30(36)32-20-8-11-22(37-2)12-9-20/h3-14,18,23,25,27,29,34H,15-17H2,1-2H3,(H,31,35)(H2,32,33,36)/t18-,23-,25-,27-,29+/m0/s1	HXJPIEDLBOYUCY-PFPGSGFYSA-N	531.236935806							122989
BRD-K92723208	LSM-34433		54647136	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,22-/m0/s1	IZHKYGZZVSGRFT-ZMUPPCTCSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	BroadT	BRD-K92723208	BRD-K92723208-001-01-9	Broad Institute of MIT and Harvard	BRD-K92723208			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20+,22-/m0/s1	IZHKYGZZVSGRFT-ZMUPPCTCSA-N	441.189985614							122990
BRD-K56708236	LSM-34434		54647370	InChI=1S/C27H28N4O5/c32-16-24-27-22(12-20(35-24)13-25(33)30-15-18-2-1-7-29-14-18)21-11-19(3-4-23(21)36-27)31-26(34)10-17-5-8-28-9-6-17/h1-9,11,14,20,22,24,27,32H,10,12-13,15-16H2,(H,30,33)(H,31,34)/t20-,22+,24+,27-/m0/s1	YINZFYFDFIPTOU-YRGRZTQCSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K56708236	BRD-K56708236-001-01-0	Broad Institute of MIT and Harvard	BRD-K56708236			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(12-20(35-24)13-25(33)30-15-18-2-1-7-29-14-18)21-11-19(3-4-23(21)36-27)31-26(34)10-17-5-8-28-9-6-17/h1-9,11,14,20,22,24,27,32H,10,12-13,15-16H2,(H,30,33)(H,31,34)/t20-,22+,24+,27-/m0/s1	YINZFYFDFIPTOU-YRGRZTQCSA-N	488.205970036							122991
BRD-K92803674	LSM-34435		54647212	InChI=1S/C23H23F4N3O5/c24-16-3-1-2-4-17(16)30-22(33)29-12-5-6-18-14(7-12)15-8-13(34-19(10-31)21(15)35-18)9-20(32)28-11-23(25,26)27/h1-7,13,15,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t13-,15+,19-,21-/m1/s1	JNBFYQYHHCPVEU-DIZIXXEVSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccccc4F)cc23	BroadT	BRD-K92803674	BRD-K92803674-001-01-4	Broad Institute of MIT and Harvard	BRD-K92803674			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C23H23F4N3O5/c24-16-3-1-2-4-17(16)30-22(33)29-12-5-6-18-14(7-12)15-8-13(34-19(10-31)21(15)35-18)9-20(32)28-11-23(25,26)27/h1-7,13,15,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t13-,15+,19-,21-/m1/s1	JNBFYQYHHCPVEU-DIZIXXEVSA-N	497.157383666							122992
BRD-K64939364	LSM-34436		54647134	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,22+/m1/s1	IZHKYGZZVSGRFT-ZLLBNUPZSA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	BroadT	BRD-K64939364	BRD-K64939364-001-01-5	Broad Institute of MIT and Harvard	BRD-K64939364			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20-,22+/m1/s1	IZHKYGZZVSGRFT-ZLLBNUPZSA-N	441.189985614							122993
BRD-K90744477	LSM-34437		54647232	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17+,19+,21-/m1/s1	DXZPRIFIKXELJX-ZWVMGRIOSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	BroadT	BRD-K90744477	BRD-K90744477-001-01-1	Broad Institute of MIT and Harvard	BRD-K90744477			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17+,19+,21-/m1/s1	DXZPRIFIKXELJX-ZWVMGRIOSA-N	418.2103867							122994
BRD-K12824862	LSM-34438		54647227	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19-,21+,23+/m0/s1	HOUMZMKGURXYQW-VARILPKDSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K12824862	BRD-K12824862-001-01-9	Broad Institute of MIT and Harvard	BRD-K12824862			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19-,21+,23+/m0/s1	HOUMZMKGURXYQW-VARILPKDSA-N	453.189985614							122995
BRD-K52582315	LSM-34439		54647346	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22-,24+,26+/m0/s1	OGUMJARTEHRGNP-LFSKCEFNSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K52582315	BRD-K52582315-001-01-7	Broad Institute of MIT and Harvard	BRD-K52582315			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22-,24+,26+/m0/s1	OGUMJARTEHRGNP-LFSKCEFNSA-N	491.185649162							122996
BRD-K88856685	LSM-34440		54647239	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20+,22-/m0/s1	RVCZJXOSFIZTQF-ZMUPPCTCSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K88856685	BRD-K88856685-001-01-5	Broad Institute of MIT and Harvard	BRD-K88856685			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20+,22-/m0/s1	RVCZJXOSFIZTQF-ZMUPPCTCSA-N	414.21547208							122997
BRD-K85951787	LSM-34441		54647289	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18-,20+/m1/s1	BVUMLAQBIXIYMI-ODZKNYGOSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)NC4CCCCC4)cc23	BroadT	BRD-K85951787	BRD-K85951787-001-01-4	Broad Institute of MIT and Harvard	BRD-K85951787			OC[C@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18-,20+/m1/s1	BVUMLAQBIXIYMI-ODZKNYGOSA-N	404.194736636							122998
BRD-K36170758	LSM-34442		54647330	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21+,23-,26-/m1/s1	DDTMCUFVLBWJID-VXNXIIOGSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K36170758	BRD-K36170758-001-01-6	Broad Institute of MIT and Harvard	BRD-K36170758			C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21+,23-,26-/m1/s1	DDTMCUFVLBWJID-VXNXIIOGSA-N	467.242021186							122999
BRD-K07781799	LSM-34443		54647112	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24-,26+,28+/m0/s1	HHORGFBYQNPTJA-SFNAGVRGSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K07781799	BRD-K07781799-001-01-6	Broad Institute of MIT and Harvard	BRD-K07781799			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24-,26+,28+/m0/s1	HHORGFBYQNPTJA-SFNAGVRGSA-N	569.21375569							123000
BRD-K19712167	LSM-34444		54647215	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,24+/m1/s1	RDOSCOXXMIXCDB-YWWGLXIYSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K19712167	BRD-K19712167-001-01-1	Broad Institute of MIT and Harvard	BRD-K19712167			OC[C@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,24+/m1/s1	RDOSCOXXMIXCDB-YWWGLXIYSA-N	451.210721058							123001
CHEMBL2134571	LSM-34445	SID131443716, BRD-K89014570	54647342	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22+,24+,26-/m0/s1	OGUMJARTEHRGNP-RXDHMRHRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K89014570	BRD-K89014570-001-01-8	Broad Institute of MIT and Harvard	BRD-K89014570			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22+,24+,26-/m0/s1	OGUMJARTEHRGNP-RXDHMRHRSA-N	491.185649162							123002
BRD-K80028364	LSM-34446		54647358	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22+,24-,26-/m1/s1	OKSBXXIUCLCGOM-FWSIMYTDSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K80028364	BRD-K80028364-001-01-7	Broad Institute of MIT and Harvard	BRD-K80028364			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22+,24-,26-/m1/s1	OKSBXXIUCLCGOM-FWSIMYTDSA-N	514.187064442							123003
BRD-K83139520	LSM-34447		54647182	InChI=1S/C20H25NO6/c1-25-19(24)9-13-8-15-14-7-12(21-18(23)6-11-2-3-11)4-5-16(14)27-20(15)17(10-22)26-13/h4-5,7,11,13,15,17,20,22H,2-3,6,8-10H2,1H3,(H,21,23)/t13-,15+,17-,20-/m0/s1	RBGXSVUHPLBJIK-IDVHHABFSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K83139520	BRD-K83139520-001-01-0	Broad Institute of MIT and Harvard	BRD-K83139520			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C20H25NO6/c1-25-19(24)9-13-8-15-14-7-12(21-18(23)6-11-2-3-11)4-5-16(14)27-20(15)17(10-22)26-13/h4-5,7,11,13,15,17,20,22H,2-3,6,8-10H2,1H3,(H,21,23)/t13-,15+,17-,20-/m0/s1	RBGXSVUHPLBJIK-IDVHHABFSA-N	375.16818753							123004
BRD-K31437957	LSM-34448		54647333	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21+,23-,26-/m0/s1	DDTMCUFVLBWJID-PGLPDAPXSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K31437957	BRD-K31437957-001-01-3	Broad Institute of MIT and Harvard	BRD-K31437957			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21+,23-,26-/m0/s1	DDTMCUFVLBWJID-PGLPDAPXSA-N	467.242021186							123005
BRD-K70148257	LSM-34449		54647241	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20-,22-/m1/s1	RVCZJXOSFIZTQF-HOQQESESSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K70148257	BRD-K70148257-001-01-5	Broad Institute of MIT and Harvard	BRD-K70148257			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20-,22-/m1/s1	RVCZJXOSFIZTQF-HOQQESESSA-N	414.21547208							123006
BRD-K13472433	LSM-34450		54647253	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19-,21-,23+/m0/s1	LGHYMYOTKHNHQJ-RAKJYXHLSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K13472433	BRD-K13472433-001-01-6	Broad Institute of MIT and Harvard	BRD-K13472433			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19-,21-,23+/m0/s1	LGHYMYOTKHNHQJ-RAKJYXHLSA-N	437.195070994							123007
BRD-K03953354	LSM-34451		54647081	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26-,28-/m1/s1	HIMABYNGDRMZAM-UKTDVOJESA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K03953354	BRD-K03953354-001-01-2	Broad Institute of MIT and Harvard	BRD-K03953354			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22+,26-,28-/m1/s1	HIMABYNGDRMZAM-UKTDVOJESA-N	534.180229424							123008
BRD-K50247051	LSM-34452		54647214	InChI=1S/C23H23F4N3O5/c24-16-3-1-2-4-17(16)30-22(33)29-12-5-6-18-14(7-12)15-8-13(34-19(10-31)21(15)35-18)9-20(32)28-11-23(25,26)27/h1-7,13,15,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t13-,15-,19+,21+/m1/s1	JNBFYQYHHCPVEU-WAXPWZKESA-N	OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccccc4F)cc23	BroadT	BRD-K50247051	BRD-K50247051-001-01-7	Broad Institute of MIT and Harvard	BRD-K50247051			OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C23H23F4N3O5/c24-16-3-1-2-4-17(16)30-22(33)29-12-5-6-18-14(7-12)15-8-13(34-19(10-31)21(15)35-18)9-20(32)28-11-23(25,26)27/h1-7,13,15,19,21,31H,8-11H2,(H,28,32)(H2,29,30,33)/t13-,15-,19+,21+/m1/s1	JNBFYQYHHCPVEU-WAXPWZKESA-N	497.157383666							123009
BRD-K55538850	LSM-34453		54647284	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19+,21+,23-/m1/s1	ZRCRXWGBTMXJDJ-QXPQREGVSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K55538850	BRD-K55538850-001-01-7	Broad Institute of MIT and Harvard	BRD-K55538850			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19+,21+,23-/m1/s1	ZRCRXWGBTMXJDJ-QXPQREGVSA-N	443.242021186							123010
BRD-K87205390	LSM-34454		54647140	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,22+/m0/s1	IZHKYGZZVSGRFT-FDGCKHTNSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	BroadT	BRD-K87205390	BRD-K87205390-001-01-2	Broad Institute of MIT and Harvard	BRD-K87205390			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18-,20+,22+/m0/s1	IZHKYGZZVSGRFT-FDGCKHTNSA-N	441.189985614							123011
BRD-K66955555	LSM-34455		54647147	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21-,23+,25+/m0/s1	CWTFRDOIHJRUHI-FEGXGRLVSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@@H](CO)O2	BroadT	BRD-K66955555	BRD-K66955555-001-01-8	Broad Institute of MIT and Harvard	BRD-K66955555			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21-,23+,25+/m0/s1	CWTFRDOIHJRUHI-FEGXGRLVSA-N	548.224654732							123012
BRD-K02614439	LSM-34456		54647109	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24+,26+,28-/m1/s1	HHORGFBYQNPTJA-PWKYGKGFSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K02614439	BRD-K02614439-001-01-0	Broad Institute of MIT and Harvard	BRD-K02614439			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24+,26+,28-/m1/s1	HHORGFBYQNPTJA-PWKYGKGFSA-N	569.21375569							123013
BRD-K91354770	LSM-34457		54647165	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24-,26-,28+/m1/s1	DXWDIHWCVARGHC-HXCADUBKSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@@H]3c2c1	BroadT	BRD-K91354770	BRD-K91354770-001-01-2	Broad Institute of MIT and Harvard	BRD-K91354770			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@@H]3CO)c2c1	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24-,26-,28+/m1/s1	DXWDIHWCVARGHC-HXCADUBKSA-N	538.17737201							123014
BRD-K29260599	LSM-34458		54647186	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26+,28+,30-/m1/s1	XMRNAPLDHHXMNZ-AVMCHKJZSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)N5CCc6ccccc6C5)C[C@H]4c3c2)cc1	BroadT	BRD-K29260599	BRD-K29260599-001-01-7	Broad Institute of MIT and Harvard	BRD-K29260599			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)N5CCc6ccccc6C5)O[C@H]4CO)c3c2)cc1	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26+,28+,30-/m1/s1	XMRNAPLDHHXMNZ-AVMCHKJZSA-N	543.236935806							123015
BRD-K61877191	LSM-34459		54647191	InChI=1S/C28H27F2N3O5/c29-18-1-3-23(30)17(10-18)14-32-26(35)13-20-12-22-21-11-19(33-27(36)9-16-5-7-31-8-6-16)2-4-24(21)38-28(22)25(15-34)37-20/h1-8,10-11,20,22,25,28,34H,9,12-15H2,(H,32,35)(H,33,36)/t20-,22-,25-,28+/m0/s1	QUIMTGQEYLWUJB-DVUKNSKVSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K61877191	BRD-K61877191-001-01-9	Broad Institute of MIT and Harvard	BRD-K61877191			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H27F2N3O5/c29-18-1-3-23(30)17(10-18)14-32-26(35)13-20-12-22-21-11-19(33-27(36)9-16-5-7-31-8-6-16)2-4-24(21)38-28(22)25(15-34)37-20/h1-8,10-11,20,22,25,28,34H,9,12-15H2,(H,32,35)(H,33,36)/t20-,22-,25-,28+/m0/s1	QUIMTGQEYLWUJB-DVUKNSKVSA-N	523.191877394							123016
BRD-K48145537	LSM-34460		54647388	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20+,22-,24-/m0/s1	FIOSTBRHNPGFJR-FVSDWULHSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(F)cc5)cc34	BroadT	BRD-K48145537	BRD-K48145537-001-01-2	Broad Institute of MIT and Harvard	BRD-K48145537			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21	InChI=1S/C25H28FN3O6/c26-15-1-3-16(4-2-15)27-25(32)28-17-5-6-21-19(11-17)20-12-18(34-22(14-30)24(20)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,18,20,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t18-,20+,22-,24-/m0/s1	FIOSTBRHNPGFJR-FVSDWULHSA-N	485.196213846							123017
BRD-K56857396	LSM-34461		54647348	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13-,15-,17+/m1/s1	LRUFLDYNMXBWAO-MDRZDLKXSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	BroadT	BRD-K56857396	BRD-K56857396-001-01-1	Broad Institute of MIT and Harvard	BRD-K56857396			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13-,15-,17+/m1/s1	LRUFLDYNMXBWAO-MDRZDLKXSA-N	321.157622846							123018
BRD-K35671498	LSM-34462		54647312	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24-,27+/m0/s1	YWCZLJIWAJYPHK-MWLAQPAQSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K35671498	BRD-K35671498-001-01-9	Broad Institute of MIT and Harvard	BRD-K35671498			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24-,27+/m0/s1	YWCZLJIWAJYPHK-MWLAQPAQSA-N	464.231122144							123019
BRD-K67830713	LSM-34463		54647311	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24-,27+/m1/s1	YWCZLJIWAJYPHK-BBVHREJBSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K67830713	BRD-K67830713-001-01-1	Broad Institute of MIT and Harvard	BRD-K67830713			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24-,27+/m1/s1	YWCZLJIWAJYPHK-BBVHREJBSA-N	464.231122144							123020
BRD-K14216093	LSM-34464		54647268	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29+,31-/m0/s1	DTKVBNZNKFXGOR-YQXDBROVSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCC6)cc45	BroadT	BRD-K14216093	BRD-K14216093-001-01-7	Broad Institute of MIT and Harvard	BRD-K14216093			OC[C@H]1O[C@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29+,31-/m0/s1	DTKVBNZNKFXGOR-YQXDBROVSA-N	526.246772208							123021
BRD-K12862541	LSM-34465		54647222	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19-,21-,23+/m1/s1	HOUMZMKGURXYQW-LHWDRQQYSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K12862541	BRD-K12862541-001-01-8	Broad Institute of MIT and Harvard	BRD-K12862541			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19-,21-,23+/m1/s1	HOUMZMKGURXYQW-LHWDRQQYSA-N	453.189985614							123022
BRD-K57502201	LSM-34466		54647204	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21-,24+/m0/s1	AXSMPGQCOGKKGU-JBIZMDSKSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K57502201	BRD-K57502201-001-01-7	Broad Institute of MIT and Harvard	BRD-K57502201			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccncc4)O[C@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21-,24+/m0/s1	AXSMPGQCOGKKGU-JBIZMDSKSA-N	454.2216201							123023
BRD-K11893906	LSM-34467		54647125	InChI=1S/C29H30FN3O6/c1-37-20-9-6-18(7-10-20)32-29(36)33-19-8-11-25-22(12-19)23-13-21(38-26(16-34)28(23)39-25)14-27(35)31-15-17-4-2-3-5-24(17)30/h2-12,21,23,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,26+,28+/m1/s1	CTJBWDZBZUSCES-YZJMKMORSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)NCc5ccccc5F)C[C@@H]4c3c2)cc1	BroadT	BRD-K11893906	BRD-K11893906-001-01-3	Broad Institute of MIT and Harvard	BRD-K11893906			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NCc5ccccc5F)O[C@H]4CO)c3c2)cc1	InChI=1S/C29H30FN3O6/c1-37-20-9-6-18(7-10-20)32-29(36)33-19-8-11-25-22(12-19)23-13-21(38-26(16-34)28(23)39-25)14-27(35)31-15-17-4-2-3-5-24(17)30/h2-12,21,23,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,26+,28+/m1/s1	CTJBWDZBZUSCES-YZJMKMORSA-N	535.21186391							123024
BRD-K81706364	LSM-34468		54647395	InChI=1S/C25H31N3O7/c1-32-10-9-26-23(30)13-18-12-20-19-11-16(5-8-21(19)35-24(20)22(14-29)34-18)28-25(31)27-15-3-6-17(33-2)7-4-15/h3-8,11,18,20,22,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H2,27,28,31)/t18-,20-,22+,24+/m0/s1	DSSRCRDYJCNLRE-YCYVKTGYSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(OC)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K81706364	BRD-K81706364-001-01-7	Broad Institute of MIT and Harvard	BRD-K81706364			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(OC)cc4)cc23)[C@@H](CO)O1	InChI=1S/C25H31N3O7/c1-32-10-9-26-23(30)13-18-12-20-19-11-16(5-8-21(19)35-24(20)22(14-29)34-18)28-25(31)27-15-3-6-17(33-2)7-4-15/h3-8,11,18,20,22,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H2,27,28,31)/t18-,20-,22+,24+/m0/s1	DSSRCRDYJCNLRE-YCYVKTGYSA-N	485.216200362							123025
BRD-K03116010	LSM-34469		54647124	InChI=1S/C29H30FN3O6/c1-37-20-9-6-18(7-10-20)32-29(36)33-19-8-11-25-22(12-19)23-13-21(38-26(16-34)28(23)39-25)14-27(35)31-15-17-4-2-3-5-24(17)30/h2-12,21,23,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,26+,28+/m0/s1	CTJBWDZBZUSCES-CEDAICPMSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)NCc5ccccc5F)C[C@H]4c3c2)cc1	BroadT	BRD-K03116010	BRD-K03116010-001-01-2	Broad Institute of MIT and Harvard	BRD-K03116010			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NCc5ccccc5F)O[C@@H]4CO)c3c2)cc1	InChI=1S/C29H30FN3O6/c1-37-20-9-6-18(7-10-20)32-29(36)33-19-8-11-25-22(12-19)23-13-21(38-26(16-34)28(23)39-25)14-27(35)31-15-17-4-2-3-5-24(17)30/h2-12,21,23,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,26+,28+/m0/s1	CTJBWDZBZUSCES-CEDAICPMSA-N	535.21186391							123026
BRD-K03562091	LSM-34470		54647199	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24-,26-/m1/s1	NNNMMCMDOXLHLD-FWSIMYTDSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K03562091	BRD-K03562091-001-01-9	Broad Institute of MIT and Harvard	BRD-K03562091			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24-,26-/m1/s1	NNNMMCMDOXLHLD-FWSIMYTDSA-N	556.193354604							123027
BRD-K99692850	LSM-15174		54647099	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21-,26+,28+/m1/s1	QPCDPRLGXJQWSH-MECTWPEFSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccccc5F)cc34)[C@H](CO)O2	BroadT	BRD-K99692850	BRD-K99692850-001-01-0	Broad Institute of MIT and Harvard	BRD-K99692850			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21-,26+,28+/m1/s1	QPCDPRLGXJQWSH-MECTWPEFSA-N	535.21186391							103830
BRD-K84220215	LSM-34471		54647200	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24-,26-/m0/s1	NNNMMCMDOXLHLD-YXOQKGKWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K84220215	BRD-K84220215-001-01-7	Broad Institute of MIT and Harvard	BRD-K84220215			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24-,26-/m0/s1	NNNMMCMDOXLHLD-YXOQKGKWSA-N	556.193354604							123028
BRD-K86070914	LSM-34472		54647169	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24+,26-,28-/m1/s1	DXWDIHWCVARGHC-UQCMEGJUSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@H]3c2c1	BroadT	BRD-K86070914	BRD-K86070914-001-01-8	Broad Institute of MIT and Harvard	BRD-K86070914			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@@H]3CO)c2c1	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24+,26-,28-/m1/s1	DXWDIHWCVARGHC-UQCMEGJUSA-N	538.17737201							123029
BRD-K70537701	LSM-34473		54647171	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24-,26+,28+/m0/s1	DXWDIHWCVARGHC-SFNAGVRGSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@H]3c2c1	BroadT	BRD-K70537701	BRD-K70537701-001-01-1	Broad Institute of MIT and Harvard	BRD-K70537701			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@@H]3CO)c2c1	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24-,26+,28+/m0/s1	DXWDIHWCVARGHC-SFNAGVRGSA-N	538.17737201							123030
BRD-K29760532	LSM-34474		54647111	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24+,26-,28-/m0/s1	HHORGFBYQNPTJA-BQGAEBSMSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K29760532	BRD-K29760532-001-01-6	Broad Institute of MIT and Harvard	BRD-K29760532			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24+,26-,28-/m0/s1	HHORGFBYQNPTJA-BQGAEBSMSA-N	569.21375569							123031
BRD-K43186783	LSM-34475		54647161	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19+,23-,25-/m1/s1	GLTVTIDBZPANQC-DFNUNTEISA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K43186783	BRD-K43186783-001-01-2	Broad Institute of MIT and Harvard	BRD-K43186783			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19+,23-,25-/m1/s1	GLTVTIDBZPANQC-DFNUNTEISA-N	480.189651256							123032
BRD-K66559139	LSM-34476		54647254	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19+,21+,23-/m0/s1	LGHYMYOTKHNHQJ-GBPFJNKXSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K66559139	BRD-K66559139-001-01-3	Broad Institute of MIT and Harvard	BRD-K66559139			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19+,21+,23-/m0/s1	LGHYMYOTKHNHQJ-GBPFJNKXSA-N	437.195070994							123033
BRD-K74988798	LSM-34477		54647190	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26-,28+,30+/m1/s1	XMRNAPLDHHXMNZ-NGEINMRJSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)N5CCc6ccccc6C5)C[C@@H]4c3c2)cc1	BroadT	BRD-K74988798	BRD-K74988798-001-01-6	Broad Institute of MIT and Harvard	BRD-K74988798			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)N5CCc6ccccc6C5)O[C@H]4CO)c3c2)cc1	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26-,28+,30+/m1/s1	XMRNAPLDHHXMNZ-NGEINMRJSA-N	543.236935806							123034
BRD-K57498440	LSM-34478		54647149	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20-,22-,25+/m1/s1	GQOLZDUAMZVUJK-HWZPKBPFSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc(OC)cc4)C[C@@H]3c2c1	BroadT	BRD-K57498440	BRD-K57498440-001-01-9	Broad Institute of MIT and Harvard	BRD-K57498440			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc(OC)cc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20-,22-,25+/m1/s1	GQOLZDUAMZVUJK-HWZPKBPFSA-N	470.20530132							123035
BRD-K38557431	LSM-34479		54647221	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,24+/m1/s1	RDOSCOXXMIXCDB-NROSNUSPSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K38557431	BRD-K38557431-001-01-7	Broad Institute of MIT and Harvard	BRD-K38557431			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,24+/m1/s1	RDOSCOXXMIXCDB-NROSNUSPSA-N	451.210721058							123036
BRD-K15523383	LSM-34480		54647162	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19+,23-,25-/m0/s1	GLTVTIDBZPANQC-VEROOCSVSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K15523383	BRD-K15523383-001-01-4	Broad Institute of MIT and Harvard	BRD-K15523383			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19+,23-,25-/m0/s1	GLTVTIDBZPANQC-VEROOCSVSA-N	480.189651256							123037
BRD-K30301272	LSM-34481		54647203	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21-,24+/m1/s1	AXSMPGQCOGKKGU-ISYUWZRGSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K30301272	BRD-K30301272-001-01-0	Broad Institute of MIT and Harvard	BRD-K30301272			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccncc4)O[C@@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21-,24+/m1/s1	AXSMPGQCOGKKGU-ISYUWZRGSA-N	454.2216201							123038
BRD-K51490423	LSM-34482		54647093	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21-,26-,28+/m0/s1	QPCDPRLGXJQWSH-LSQWXYBESA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccccc5F)cc34)[C@H](CO)O2	BroadT	BRD-K51490423	BRD-K51490423-001-01-3	Broad Institute of MIT and Harvard	BRD-K51490423			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21-,26-,28+/m0/s1	QPCDPRLGXJQWSH-LSQWXYBESA-N	535.21186391							123039
BRD-K50045741	LSM-34483		54647360	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22-,24+,26+/m0/s1	OKSBXXIUCLCGOM-LFSKCEFNSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K50045741	BRD-K50045741-001-01-1	Broad Institute of MIT and Harvard	BRD-K50045741			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22-,24+,26+/m0/s1	OKSBXXIUCLCGOM-LFSKCEFNSA-N	514.187064442							123040
BRD-K75990394	LSM-34484		54647095	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21+,26+,28-/m1/s1	QPCDPRLGXJQWSH-GGUBSOLTSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccccc5F)cc34)[C@H](CO)O2	BroadT	BRD-K75990394	BRD-K75990394-001-01-9	Broad Institute of MIT and Harvard	BRD-K75990394			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21+,26+,28-/m1/s1	QPCDPRLGXJQWSH-GGUBSOLTSA-N	535.21186391							123041
BRD-K66497480	LSM-34485		54647375	InChI=1S/C27H28N4O5/c32-16-24-27-22(12-20(35-24)13-25(33)30-15-18-2-1-7-29-14-18)21-11-19(3-4-23(21)36-27)31-26(34)10-17-5-8-28-9-6-17/h1-9,11,14,20,22,24,27,32H,10,12-13,15-16H2,(H,30,33)(H,31,34)/t20-,22-,24+,27+/m1/s1	YINZFYFDFIPTOU-YDGNWZKSSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K66497480	BRD-K66497480-001-01-1	Broad Institute of MIT and Harvard	BRD-K66497480			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(12-20(35-24)13-25(33)30-15-18-2-1-7-29-14-18)21-11-19(3-4-23(21)36-27)31-26(34)10-17-5-8-28-9-6-17/h1-9,11,14,20,22,24,27,32H,10,12-13,15-16H2,(H,30,33)(H,31,34)/t20-,22-,24+,27+/m1/s1	YINZFYFDFIPTOU-YDGNWZKSSA-N	488.205970036							123042
BRD-K54785691-001-01-8	LSM-34486	BRD-K54785691	54647352	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13+,15-,17-/m0/s1	LRUFLDYNMXBWAO-QOOGKBOQSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1	BroadT	BRD-K54785691	BRD-K54785691-001-01-8	Broad Institute of MIT and Harvard	BRD-K54785691			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13+,15-,17-/m0/s1	LRUFLDYNMXBWAO-QOOGKBOQSA-N	321.157622846							123043
BRD-K74482064	LSM-34487		54647266	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27-,29-,31+/m1/s1	DTKVBNZNKFXGOR-ZAVRPYQWSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@H]4[C@@H]1Oc5ccc(NC(=O)C6CCC6)cc45	BroadT	BRD-K74482064	BRD-K74482064-001-01-7	Broad Institute of MIT and Harvard	BRD-K74482064			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27-,29-,31+/m1/s1	DTKVBNZNKFXGOR-ZAVRPYQWSA-N	526.246772208							123044
BRD-K88069191	LSM-34488		54647244	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20+,22+/m1/s1	RVCZJXOSFIZTQF-MDRHQERFSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K88069191	BRD-K88069191-001-01-2	Broad Institute of MIT and Harvard	BRD-K88069191			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20+,22+/m1/s1	RVCZJXOSFIZTQF-MDRHQERFSA-N	414.21547208							123045
BRD-K92124212	LSM-34489		54647145	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21+,23-,25-/m1/s1	CWTFRDOIHJRUHI-RIPRBREISA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@@H](CO)O2	BroadT	BRD-K92124212	BRD-K92124212-001-01-4	Broad Institute of MIT and Harvard	BRD-K92124212			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21+,23-,25-/m1/s1	CWTFRDOIHJRUHI-RIPRBREISA-N	548.224654732							123046
BRD-K02565327	LSM-34490		54647273	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16-,18+/m1/s1	NJJKNLQQLZQTIZ-BQUDOFGOSA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@@H](CO)O1	BroadT	BRD-K02565327	BRD-K02565327-001-01-9	Broad Institute of MIT and Harvard	BRD-K02565327			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14-,16-,18+/m1/s1	NJJKNLQQLZQTIZ-BQUDOFGOSA-N	414.146071882							123047
BRD-K36726853	LSM-34491		54647264	InChI=1S/C30H33N3O6/c1-18(19-6-4-3-5-7-19)31-28(35)16-23-15-25-24-14-21(10-13-26(24)39-29(25)27(17-34)38-23)33-30(36)32-20-8-11-22(37-2)12-9-20/h3-14,18,23,25,27,29,34H,15-17H2,1-2H3,(H,31,35)(H2,32,33,36)/t18-,23-,25-,27+,29+/m0/s1	HXJPIEDLBOYUCY-YFMXTKGLSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)N[C@@H](C)c5ccccc5)C[C@H]4c3c2)cc1	BroadT	BRD-K36726853	BRD-K36726853-001-01-9	Broad Institute of MIT and Harvard	BRD-K36726853			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)N[C@@H](C)c5ccccc5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-18(19-6-4-3-5-7-19)31-28(35)16-23-15-25-24-14-21(10-13-26(24)39-29(25)27(17-34)38-23)33-30(36)32-20-8-11-22(37-2)12-9-20/h3-14,18,23,25,27,29,34H,15-17H2,1-2H3,(H,31,35)(H2,32,33,36)/t18-,23-,25-,27+,29+/m0/s1	HXJPIEDLBOYUCY-YFMXTKGLSA-N	531.236935806							123048
BRD-K79627231	LSM-34492		54647167	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24+,26+,28-/m0/s1	DXWDIHWCVARGHC-XABOBXATSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@@H]3c2c1	BroadT	BRD-K79627231	BRD-K79627231-001-01-0	Broad Institute of MIT and Harvard	BRD-K79627231			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@@H]3CO)c2c1	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24+,26+,28-/m0/s1	DXWDIHWCVARGHC-XABOBXATSA-N	538.17737201							123049
BRD-K70712582	LSM-34493		54647217	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,24-/m1/s1	RDOSCOXXMIXCDB-HJBWUJCXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K70712582	BRD-K70712582-001-01-4	Broad Institute of MIT and Harvard	BRD-K70712582			OC[C@@H]1O[C@@H](CC(=O)NCc2ccncc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,24-/m1/s1	RDOSCOXXMIXCDB-HJBWUJCXSA-N	451.210721058							123050
BRD-K21579116	LSM-34494		54647210	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21+,24+/m1/s1	AXSMPGQCOGKKGU-GOSIJUEPSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K21579116	BRD-K21579116-001-01-2	Broad Institute of MIT and Harvard	BRD-K21579116			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccncc4)O[C@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19-,21+,24+/m1/s1	AXSMPGQCOGKKGU-GOSIJUEPSA-N	454.2216201							123051
BRD-K06392309	LSM-34495		54647357	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22+,24+,26-/m1/s1	OKSBXXIUCLCGOM-GRTAZNFBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K06392309	BRD-K06392309-001-01-6	Broad Institute of MIT and Harvard	BRD-K06392309			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22+,24+,26-/m1/s1	OKSBXXIUCLCGOM-GRTAZNFBSA-N	514.187064442							123052
BRD-K18094884	LSM-34496		54647322	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21-,23-,26+/m0/s1	DDTMCUFVLBWJID-LTBBQRNISA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K18094884	BRD-K18094884-001-01-7	Broad Institute of MIT and Harvard	BRD-K18094884			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21-,23-,26+/m0/s1	DDTMCUFVLBWJID-LTBBQRNISA-N	467.242021186							123053
BRD-K39979171	LSM-34497		54647197	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24+,26-/m0/s1	NNNMMCMDOXLHLD-RXDHMRHRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K39979171	BRD-K39979171-001-01-6	Broad Institute of MIT and Harvard	BRD-K39979171			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22+,24+,26-/m0/s1	NNNMMCMDOXLHLD-RXDHMRHRSA-N	556.193354604							123054
BRD-K64337372	LSM-34498		54647158	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19-,23-,25+/m0/s1	GLTVTIDBZPANQC-CKRMUJODSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K64337372	BRD-K64337372-001-01-2	Broad Institute of MIT and Harvard	BRD-K64337372			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19-,23-,25+/m0/s1	GLTVTIDBZPANQC-CKRMUJODSA-N	480.189651256							123055
BRD-K82187446	LSM-34499		54647201	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24+,26+/m0/s1	NNNMMCMDOXLHLD-LFSKCEFNSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K82187446	BRD-K82187446-001-01-1	Broad Institute of MIT and Harvard	BRD-K82187446			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24+,26+/m0/s1	NNNMMCMDOXLHLD-LFSKCEFNSA-N	556.193354604							123056
BRD-K59078001	LSM-34500		54647159	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19+,23+,25-/m0/s1	GLTVTIDBZPANQC-PGFDOFGXSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K59078001	BRD-K59078001-001-01-8	Broad Institute of MIT and Harvard	BRD-K59078001			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C26H28N2O7/c29-12-23-25-19(9-17(34-23)10-24(30)27-11-14-1-2-14)18-8-16(4-6-20(18)35-25)28-26(31)15-3-5-21-22(7-15)33-13-32-21/h3-8,14,17,19,23,25,29H,1-2,9-13H2,(H,27,30)(H,28,31)/t17-,19+,23+,25-/m0/s1	GLTVTIDBZPANQC-PGFDOFGXSA-N	480.189651256							123057
BRD-K74302837	LSM-34501		54647103	InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21+,23-,25-/m0/s1	SRZDSTZFHOVQBI-PYTYSOFPSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NCC5CC5)C[C@@H]4c3c2)cc1	BroadT	BRD-K74302837	BRD-K74302837-001-01-3	Broad Institute of MIT and Harvard	BRD-K74302837			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)NCC5CC5)O[C@H]4CO)c3c2)cc1	InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21+,23-,25-/m0/s1	SRZDSTZFHOVQBI-PYTYSOFPSA-N	481.221285742							123058
BRD-K87141723	LSM-34502		54647319	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21-,23-,26+/m1/s1	DDTMCUFVLBWJID-YIKCQRERSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K87141723	BRD-K87141723-001-01-7	Broad Institute of MIT and Harvard	BRD-K87141723			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21-,23-,26+/m1/s1	DDTMCUFVLBWJID-YIKCQRERSA-N	467.242021186							123059
BRD-K87404495	LSM-34503		54647339	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-17-11-19-18-10-16(7-8-20(18)33-23(19)21(13-29)32-17)28-24(31)27-15-5-3-14(25)4-6-15/h3-8,10,17,19,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t17-,19-,21+,23+/m1/s1	UMXSQZGGXDMCPL-YZBYQZESSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K87404495	BRD-K87404495-001-01-5	Broad Institute of MIT and Harvard	BRD-K87404495			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-17-11-19-18-10-16(7-8-20(18)33-23(19)21(13-29)32-17)28-24(31)27-15-5-3-14(25)4-6-15/h3-8,10,17,19,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t17-,19-,21+,23+/m1/s1	UMXSQZGGXDMCPL-YZBYQZESSA-N	457.201299226							123060
BRD-K99078335	LSM-34504		54647138	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,22-/m1/s1	IZHKYGZZVSGRFT-HOQQESESSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	BroadT	BRD-K99078335	BRD-K99078335-001-01-7	Broad Institute of MIT and Harvard	BRD-K99078335			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,22-/m1/s1	IZHKYGZZVSGRFT-HOQQESESSA-N	441.189985614							123061
BRD-K16621460	LSM-34505		54647373	InChI=1S/C27H28N4O5/c32-16-24-27-22(12-20(35-24)13-25(33)30-15-18-2-1-7-29-14-18)21-11-19(3-4-23(21)36-27)31-26(34)10-17-5-8-28-9-6-17/h1-9,11,14,20,22,24,27,32H,10,12-13,15-16H2,(H,30,33)(H,31,34)/t20-,22+,24-,27-/m0/s1	YINZFYFDFIPTOU-QNKJOHNESA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K16621460	BRD-K16621460-001-01-1	Broad Institute of MIT and Harvard	BRD-K16621460			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(12-20(35-24)13-25(33)30-15-18-2-1-7-29-14-18)21-11-19(3-4-23(21)36-27)31-26(34)10-17-5-8-28-9-6-17/h1-9,11,14,20,22,24,27,32H,10,12-13,15-16H2,(H,30,33)(H,31,34)/t20-,22+,24-,27-/m0/s1	YINZFYFDFIPTOU-QNKJOHNESA-N	488.205970036							123062
CHEMBL2139665	LSM-34506	BRD-K57323824, SID131443680	54647306	InChI=1S/C21H22N2O6/c1-27-19(25)9-14-8-16-15-7-13(23-21(26)12-3-2-6-22-10-12)4-5-17(15)29-20(16)18(11-24)28-14/h2-7,10,14,16,18,20,24H,8-9,11H2,1H3,(H,23,26)/t14-,16+,18+,20-/m0/s1	RMTKIWQMYKPUOR-UQWBFEFOSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	BroadT	BRD-K57323824	BRD-K57323824-001-01-5	Broad Institute of MIT and Harvard	BRD-K57323824			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C21H22N2O6/c1-27-19(25)9-14-8-16-15-7-13(23-21(26)12-3-2-6-22-10-12)4-5-17(15)29-20(16)18(11-24)28-14/h2-7,10,14,16,18,20,24H,8-9,11H2,1H3,(H,23,26)/t14-,16+,18+,20-/m0/s1	RMTKIWQMYKPUOR-UQWBFEFOSA-N	398.147786444							123063
BRD-K04044480	LSM-34507		54647263	InChI=1S/C30H33N3O6/c1-18(19-6-4-3-5-7-19)31-28(35)16-23-15-25-24-14-21(10-13-26(24)39-29(25)27(17-34)38-23)33-30(36)32-20-8-11-22(37-2)12-9-20/h3-14,18,23,25,27,29,34H,15-17H2,1-2H3,(H,31,35)(H2,32,33,36)/t18-,23-,25+,27-,29-/m0/s1	HXJPIEDLBOYUCY-DLOOROLJSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)N[C@@H](C)c5ccccc5)C[C@@H]4c3c2)cc1	BroadT	BRD-K04044480	BRD-K04044480-001-01-6	Broad Institute of MIT and Harvard	BRD-K04044480			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)N[C@@H](C)c5ccccc5)O[C@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-18(19-6-4-3-5-7-19)31-28(35)16-23-15-25-24-14-21(10-13-26(24)39-29(25)27(17-34)38-23)33-30(36)32-20-8-11-22(37-2)12-9-20/h3-14,18,23,25,27,29,34H,15-17H2,1-2H3,(H,31,35)(H2,32,33,36)/t18-,23-,25+,27-,29-/m0/s1	HXJPIEDLBOYUCY-DLOOROLJSA-N	531.236935806							123064
BRD-K72646819	LSM-34508		54647258	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19-,21+,23+/m0/s1	LGHYMYOTKHNHQJ-VARILPKDSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K72646819	BRD-K72646819-001-01-7	Broad Institute of MIT and Harvard	BRD-K72646819			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O5/c28-13-21-23-19(9-17(31-21)10-22(29)26-11-14-3-4-14)18-8-16(5-6-20(18)32-23)27-24(30)15-2-1-7-25-12-15/h1-2,5-8,12,14,17,19,21,23,28H,3-4,9-11,13H2,(H,26,29)(H,27,30)/t17-,19-,21+,23+/m0/s1	LGHYMYOTKHNHQJ-VARILPKDSA-N	437.195070994							123065
BRD-K35616093	LSM-15137		54647366	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22+,26-,28-/m1/s1	DCKQIPUZKHPVQM-UKTDVOJESA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K35616093	BRD-K35616093-001-01-3	Broad Institute of MIT and Harvard	BRD-K35616093			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22+,26-,28-/m1/s1	DCKQIPUZKHPVQM-UKTDVOJESA-N	599.187934866							103793
BRD-K18294143	LSM-34509		54647394	InChI=1S/C25H31N3O7/c1-32-10-9-26-23(30)13-18-12-20-19-11-16(5-8-21(19)35-24(20)22(14-29)34-18)28-25(31)27-15-3-6-17(33-2)7-4-15/h3-8,11,18,20,22,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H2,27,28,31)/t18-,20+,22-,24-/m0/s1	DSSRCRDYJCNLRE-FVSDWULHSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(OC)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K18294143	BRD-K18294143-001-01-0	Broad Institute of MIT and Harvard	BRD-K18294143			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(OC)cc4)cc23)[C@H](CO)O1	InChI=1S/C25H31N3O7/c1-32-10-9-26-23(30)13-18-12-20-19-11-16(5-8-21(19)35-24(20)22(14-29)34-18)28-25(31)27-15-3-6-17(33-2)7-4-15/h3-8,11,18,20,22,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H2,27,28,31)/t18-,20+,22-,24-/m0/s1	DSSRCRDYJCNLRE-FVSDWULHSA-N	485.216200362							123066
BRD-K56915252	LSM-34510		54647270	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29-,31-/m1/s1	DTKVBNZNKFXGOR-YRSCAGJNSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCC6)cc45	BroadT	BRD-K56915252	BRD-K56915252-001-01-0	Broad Institute of MIT and Harvard	BRD-K56915252			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29-,31-/m1/s1	DTKVBNZNKFXGOR-YRSCAGJNSA-N	526.246772208							123067
BRD-K81884775	LSM-34511		54647392	InChI=1S/C25H31N3O7/c1-32-10-9-26-23(30)13-18-12-20-19-11-16(5-8-21(19)35-24(20)22(14-29)34-18)28-25(31)27-15-3-6-17(33-2)7-4-15/h3-8,11,18,20,22,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H2,27,28,31)/t18-,20-,22-,24+/m0/s1	DSSRCRDYJCNLRE-UYLMIGBBSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(OC)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K81884775	BRD-K81884775-001-01-5	Broad Institute of MIT and Harvard	BRD-K81884775			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(OC)cc4)cc23)[C@H](CO)O1	InChI=1S/C25H31N3O7/c1-32-10-9-26-23(30)13-18-12-20-19-11-16(5-8-21(19)35-24(20)22(14-29)34-18)28-25(31)27-15-3-6-17(33-2)7-4-15/h3-8,11,18,20,22,24,29H,9-10,12-14H2,1-2H3,(H,26,30)(H2,27,28,31)/t18-,20-,22-,24+/m0/s1	DSSRCRDYJCNLRE-UYLMIGBBSA-N	485.216200362							123068
BRD-K53257307	LSM-34512		54647350	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13+,15+,17-/m1/s1	LRUFLDYNMXBWAO-RKHKHNFPSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1	BroadT	BRD-K53257307	BRD-K53257307-001-01-5	Broad Institute of MIT and Harvard	BRD-K53257307			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13+,15+,17-/m1/s1	LRUFLDYNMXBWAO-RKHKHNFPSA-N	321.157622846							123069
BRD-K76415727	LSM-34513		54647141	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21-,23-,25+/m1/s1	CWTFRDOIHJRUHI-YTAKYCMFSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@@H](CO)O2	BroadT	BRD-K76415727	BRD-K76415727-001-01-4	Broad Institute of MIT and Harvard	BRD-K76415727			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C27H31F3N4O5/c1-33-8-10-34(11-9-33)24(36)14-19-13-21-20-12-18(6-7-22(20)39-25(21)23(15-35)38-19)32-26(37)31-17-4-2-16(3-5-17)27(28,29)30/h2-7,12,19,21,23,25,35H,8-11,13-15H2,1H3,(H2,31,32,37)/t19-,21-,23-,25+/m1/s1	CWTFRDOIHJRUHI-YTAKYCMFSA-N	548.224654732							123070
BRD-K32930844	LSM-34514		54647344	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22+,24-,26-/m1/s1	OGUMJARTEHRGNP-FWSIMYTDSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K32930844	BRD-K32930844-001-01-3	Broad Institute of MIT and Harvard	BRD-K32930844			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22+,24-,26-/m1/s1	OGUMJARTEHRGNP-FWSIMYTDSA-N	491.185649162							123071
BRD-K12886565	LSM-34515		54647249	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19+,21-,23-/m1/s1	XRZWMSINEDMJNA-LQOJQYNMSA-N	CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K12886565	BRD-K12886565-001-01-8	Broad Institute of MIT and Harvard	BRD-K12886565			CCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19+,21-,23-/m1/s1	XRZWMSINEDMJNA-LQOJQYNMSA-N	478.157385494							123072
BRD-K96778609	LSM-34516		54647356	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22+,24+,26-/m0/s1	OKSBXXIUCLCGOM-RXDHMRHRSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K96778609	BRD-K96778609-001-01-4	Broad Institute of MIT and Harvard	BRD-K96778609			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22+,24+,26-/m0/s1	OKSBXXIUCLCGOM-RXDHMRHRSA-N	514.187064442							123073
BRD-K75807319	LSM-34517		54647278	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16-,18-/m0/s1	NJJKNLQQLZQTIZ-QUCGAITQSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)C)cc23)[C@H](CO)O1	BroadT	BRD-K75807319	BRD-K75807319-001-01-7	Broad Institute of MIT and Harvard	BRD-K75807319			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C18H26N2O7S/c1-25-6-5-19-17(22)9-12-8-14-13-7-11(20-28(2,23)24)3-4-15(13)27-18(14)16(10-21)26-12/h3-4,7,12,14,16,18,20-21H,5-6,8-10H2,1-2H3,(H,19,22)/t12-,14+,16-,18-/m0/s1	NJJKNLQQLZQTIZ-QUCGAITQSA-N	414.146071882							123074
BRD-K67898193	LSM-34518		54647132	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,21+,23+/m0/s1	SVPAUNQWUYQQNC-JOXJFCDYSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@@H](CO)O2	BroadT	BRD-K67898193	BRD-K67898193-001-01-7	Broad Institute of MIT and Harvard	BRD-K67898193			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)NS(C)(=O)=O)[C@@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,21+,23+/m0/s1	SVPAUNQWUYQQNC-JOXJFCDYSA-N	476.161721946							123075
BRD-K78944047	LSM-34519		54647316	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24-,27-/m0/s1	YWCZLJIWAJYPHK-QNKJOHNESA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K78944047	BRD-K78944047-001-01-4	Broad Institute of MIT and Harvard	BRD-K78944047			OC[C@@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24-,27-/m0/s1	YWCZLJIWAJYPHK-QNKJOHNESA-N	464.231122144							123076
BRD-K87939000	LSM-34520		54647206	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21+,24-/m1/s1	AXSMPGQCOGKKGU-OFYLTFBOSA-N	CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccncc4)C[C@H]3c2c1	BroadT	BRD-K87939000	BRD-K87939000-001-01-8	Broad Institute of MIT and Harvard	BRD-K87939000			CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccncc4)O[C@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21+,24-/m1/s1	AXSMPGQCOGKKGU-OFYLTFBOSA-N	454.2216201							123077
BRD-K89394474	LSM-34521		54647315	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24-,27-/m1/s1	YWCZLJIWAJYPHK-YIPBLFEHSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K89394474	BRD-K89394474-001-01-1	Broad Institute of MIT and Harvard	BRD-K89394474			OC[C@H]1O[C@@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22+,24-,27-/m1/s1	YWCZLJIWAJYPHK-YIPBLFEHSA-N	464.231122144							123078
BRD-K17602350	LSM-34522		54647317	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24+,27+/m0/s1	YWCZLJIWAJYPHK-ZMQLRHKASA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K17602350	BRD-K17602350-001-01-3	Broad Institute of MIT and Harvard	BRD-K17602350			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C27H32N2O5/c30-16-24-27-22(14-20(33-24)15-25(31)28-11-10-17-4-2-1-3-5-17)21-13-19(8-9-23(21)34-27)29-26(32)12-18-6-7-18/h1-5,8-9,13,18,20,22,24,27,30H,6-7,10-12,14-16H2,(H,28,31)(H,29,32)/t20-,22-,24+,27+/m0/s1	YWCZLJIWAJYPHK-ZMQLRHKASA-N	464.231122144							123079
BRD-K37062347	LSM-34523		54647308	InChI=1S/C21H22N2O6/c1-27-19(25)9-14-8-16-15-7-13(23-21(26)12-3-2-6-22-10-12)4-5-17(15)29-20(16)18(11-24)28-14/h2-7,10,14,16,18,20,24H,8-9,11H2,1H3,(H,23,26)/t14-,16+,18-,20-/m0/s1	RMTKIWQMYKPUOR-HUOQQOJOSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	BroadT	BRD-K37062347	BRD-K37062347-001-01-2	Broad Institute of MIT and Harvard	BRD-K37062347			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C21H22N2O6/c1-27-19(25)9-14-8-16-15-7-13(23-21(26)12-3-2-6-22-10-12)4-5-17(15)29-20(16)18(11-24)28-14/h2-7,10,14,16,18,20,24H,8-9,11H2,1H3,(H,23,26)/t14-,16+,18-,20-/m0/s1	RMTKIWQMYKPUOR-HUOQQOJOSA-N	398.147786444							123080
BRD-K96353852	LSM-34524		54647374	InChI=1S/C27H28N4O5/c32-16-24-27-22(12-20(35-24)13-25(33)30-15-18-2-1-7-29-14-18)21-11-19(3-4-23(21)36-27)31-26(34)10-17-5-8-28-9-6-17/h1-9,11,14,20,22,24,27,32H,10,12-13,15-16H2,(H,30,33)(H,31,34)/t20-,22-,24+,27+/m0/s1	YINZFYFDFIPTOU-ZMQLRHKASA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K96353852	BRD-K96353852-001-01-0	Broad Institute of MIT and Harvard	BRD-K96353852			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C27H28N4O5/c32-16-24-27-22(12-20(35-24)13-25(33)30-15-18-2-1-7-29-14-18)21-11-19(3-4-23(21)36-27)31-26(34)10-17-5-8-28-9-6-17/h1-9,11,14,20,22,24,27,32H,10,12-13,15-16H2,(H,30,33)(H,31,34)/t20-,22-,24+,27+/m0/s1	YINZFYFDFIPTOU-ZMQLRHKASA-N	488.205970036							123081
BRD-K88421348	LSM-34525		54647231	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17+,19+,21-/m0/s1	DXZPRIFIKXELJX-RWCSOYMTSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K88421348	BRD-K88421348-001-01-7	Broad Institute of MIT and Harvard	BRD-K88421348			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	InChI=1S/C22H30N2O6/c1-24(2)20(26)11-15-10-17-16-9-14(23-22(27)13-5-7-28-8-6-13)3-4-18(16)30-21(17)19(12-25)29-15/h3-4,9,13,15,17,19,21,25H,5-8,10-12H2,1-2H3,(H,23,27)/t15-,17+,19+,21-/m0/s1	DXZPRIFIKXELJX-RWCSOYMTSA-N	418.2103867							123082
BRD-K77965546	LSM-34526		54647335	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-17-11-19-18-10-16(7-8-20(18)33-23(19)21(13-29)32-17)28-24(31)27-15-5-3-14(25)4-6-15/h3-8,10,17,19,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t17-,19-,21-,23+/m0/s1	UMXSQZGGXDMCPL-RAKJYXHLSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K77965546	BRD-K77965546-001-01-6	Broad Institute of MIT and Harvard	BRD-K77965546			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-17-11-19-18-10-16(7-8-20(18)33-23(19)21(13-29)32-17)28-24(31)27-15-5-3-14(25)4-6-15/h3-8,10,17,19,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t17-,19-,21-,23+/m0/s1	UMXSQZGGXDMCPL-RAKJYXHLSA-N	457.201299226							123083
BRD-K51972131	LSM-34527		54647108	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24+,26+,28-/m0/s1	HHORGFBYQNPTJA-XABOBXATSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K51972131	BRD-K51972131-001-01-3	Broad Institute of MIT and Harvard	BRD-K51972131			OC[C@H]1O[C@H](CC(=O)NCCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H30F3N3O5/c31-30(32,33)19-6-8-20(9-7-19)35-29(39)36-21-10-11-25-23(14-21)24-15-22(40-26(17-37)28(24)41-25)16-27(38)34-13-12-18-4-2-1-3-5-18/h1-11,14,22,24,26,28,37H,12-13,15-17H2,(H,34,38)(H2,35,36,39)/t22-,24+,26+,28-/m0/s1	HHORGFBYQNPTJA-XABOBXATSA-N	569.21375569							123084
BRD-K77518191	LSM-34528		54647117	InChI=1S/C30H31N3O8/c1-37-20-6-3-18(4-7-20)32-30(36)33-19-5-9-24-22(11-19)23-12-21(40-27(15-34)29(23)41-24)13-28(35)31-14-17-2-8-25-26(10-17)39-16-38-25/h2-11,21,23,27,29,34H,12-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23+,27-,29-/m1/s1	JXDOTDJWTJAHDX-PEUORWFRSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)NCc5ccc6OCOc6c5)C[C@H]4c3c2)cc1	BroadT	BRD-K77518191	BRD-K77518191-001-01-1	Broad Institute of MIT and Harvard	BRD-K77518191			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@H](CC(=O)NCc5ccc6OCOc6c5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C30H31N3O8/c1-37-20-6-3-18(4-7-20)32-30(36)33-19-5-9-24-22(11-19)23-12-21(40-27(15-34)29(23)41-24)13-28(35)31-14-17-2-8-25-26(10-17)39-16-38-25/h2-11,21,23,27,29,34H,12-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23+,27-,29-/m1/s1	JXDOTDJWTJAHDX-PEUORWFRSA-N	561.211114982							123085
BRD-K66838902	LSM-34529		54647367	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22+,26-,28-/m0/s1	DCKQIPUZKHPVQM-HYRFHYEVSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K66838902	BRD-K66838902-001-01-6	Broad Institute of MIT and Harvard	BRD-K66838902			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22+,26-,28-/m0/s1	DCKQIPUZKHPVQM-HYRFHYEVSA-N	599.187934866							123086
BRD-K90060707	LSM-34530		54647243	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20+,22+/m0/s1	RVCZJXOSFIZTQF-FDGCKHTNSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K90060707	BRD-K90060707-001-01-4	Broad Institute of MIT and Harvard	BRD-K90060707			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20+,22+/m0/s1	RVCZJXOSFIZTQF-FDGCKHTNSA-N	414.21547208							123087
BRD-K61182411	LSM-34531		54647302	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14+,16-,19-/m0/s1	WISUKBIGDPLILZ-YIYSPXCVSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K61182411	BRD-K61182411-001-01-8	Broad Institute of MIT and Harvard	BRD-K61182411			OC[C@@H]1O[C@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14+,16-,19-/m0/s1	WISUKBIGDPLILZ-YIYSPXCVSA-N	361.152537466							123088
BRD-K42663371	LSM-34532		54647181	InChI=1S/C20H25NO6/c1-25-19(24)9-13-8-15-14-7-12(21-18(23)6-11-2-3-11)4-5-16(14)27-20(15)17(10-22)26-13/h4-5,7,11,13,15,17,20,22H,2-3,6,8-10H2,1H3,(H,21,23)/t13-,15+,17-,20-/m1/s1	RBGXSVUHPLBJIK-YBLQJDFOSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	BroadT	BRD-K42663371	BRD-K42663371-001-01-9	Broad Institute of MIT and Harvard	BRD-K42663371			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@@H](CO)O1	InChI=1S/C20H25NO6/c1-25-19(24)9-13-8-15-14-7-12(21-18(23)6-11-2-3-11)4-5-16(14)27-20(15)17(10-22)26-13/h4-5,7,11,13,15,17,20,22H,2-3,6,8-10H2,1H3,(H,21,23)/t13-,15+,17-,20-/m1/s1	RBGXSVUHPLBJIK-YBLQJDFOSA-N	375.16818753							123089
BRD-K83004759-001-01-8	LSM-34533	BRD-K83004759	54647078	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26-,28+/m0/s1	HIMABYNGDRMZAM-UCAWGOPWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K83004759	BRD-K83004759-001-01-8	Broad Institute of MIT and Harvard	BRD-K83004759			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H27FN2O7/c30-18-3-1-2-16(8-18)13-31-27(34)12-20-11-22-21-10-19(5-7-23(21)39-28(22)26(14-33)38-20)32-29(35)17-4-6-24-25(9-17)37-15-36-24/h1-10,20,22,26,28,33H,11-15H2,(H,31,34)(H,32,35)/t20-,22-,26-,28+/m0/s1	HIMABYNGDRMZAM-UCAWGOPWSA-N	534.180229424							123090
BRD-K82068522	LSM-34534		54647150	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20-,22-,25+/m0/s1	GQOLZDUAMZVUJK-XZFMWLAQSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(OC)cc4)C[C@H]3c2c1	BroadT	BRD-K82068522	BRD-K82068522-001-01-0	Broad Institute of MIT and Harvard	BRD-K82068522			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(OC)cc4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20-,22-,25+/m0/s1	GQOLZDUAMZVUJK-XZFMWLAQSA-N	470.20530132							123091
BRD-K20199304	LSM-34535		54647269	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29+,31-/m1/s1	DTKVBNZNKFXGOR-ORLWEAGESA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)c3ccccc3)C[C@@H]4[C@H]1Oc5ccc(NC(=O)C6CCC6)cc45	BroadT	BRD-K20199304	BRD-K20199304-001-01-2	Broad Institute of MIT and Harvard	BRD-K20199304			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(cc2)-c2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C32H34N2O5/c35-19-29-31-27(26-15-24(13-14-28(26)39-31)34-32(37)23-7-4-8-23)16-25(38-29)17-30(36)33-18-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-3,5-6,9-15,23,25,27,29,31,35H,4,7-8,16-19H2,(H,33,36)(H,34,37)/t25-,27+,29+,31-/m1/s1	DTKVBNZNKFXGOR-ORLWEAGESA-N	526.246772208							123092
BRD-K72216066	LSM-34536		54647183	InChI=1S/C20H25NO6/c1-25-19(24)9-13-8-15-14-7-12(21-18(23)6-11-2-3-11)4-5-16(14)27-20(15)17(10-22)26-13/h4-5,7,11,13,15,17,20,22H,2-3,6,8-10H2,1H3,(H,21,23)/t13-,15-,17+,20+/m1/s1	RBGXSVUHPLBJIK-HMPASCQOSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	BroadT	BRD-K72216066	BRD-K72216066-001-01-9	Broad Institute of MIT and Harvard	BRD-K72216066			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CC4CC4)cc23)[C@H](CO)O1	InChI=1S/C20H25NO6/c1-25-19(24)9-13-8-15-14-7-12(21-18(23)6-11-2-3-11)4-5-16(14)27-20(15)17(10-22)26-13/h4-5,7,11,13,15,17,20,22H,2-3,6,8-10H2,1H3,(H,21,23)/t13-,15-,17+,20+/m1/s1	RBGXSVUHPLBJIK-HMPASCQOSA-N	375.16818753							123093
BRD-K08353229	LSM-34537		54647205	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21+,24-/m0/s1	AXSMPGQCOGKKGU-FCMRVMJTSA-N	CN(C)CC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccncc4)C[C@@H]3c2c1	BroadT	BRD-K08353229	BRD-K08353229-001-01-3	Broad Institute of MIT and Harvard	BRD-K08353229			CN(C)CC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccncc4)O[C@@H]3CO)c2c1	InChI=1S/C24H30N4O5/c1-28(2)13-23(31)27-16-3-4-20-18(9-16)19-10-17(32-21(14-29)24(19)33-20)11-22(30)26-12-15-5-7-25-8-6-15/h3-9,17,19,21,24,29H,10-14H2,1-2H3,(H,26,30)(H,27,31)/t17-,19+,21+,24-/m0/s1	AXSMPGQCOGKKGU-FCMRVMJTSA-N	454.2216201							123094
BRD-K91836330	LSM-34538		54647331	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21-,23+,26+/m0/s1	DDTMCUFVLBWJID-NYKLVWHYSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K91836330	BRD-K91836330-001-01-1	Broad Institute of MIT and Harvard	BRD-K91836330			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19-,21-,23+,26+/m0/s1	DDTMCUFVLBWJID-NYKLVWHYSA-N	467.242021186							123095
BRD-K86711517	LSM-34539		54647127	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,21-,23+/m0/s1	SVPAUNQWUYQQNC-DJTDUFQSSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@H](CO)O2	BroadT	BRD-K86711517	BRD-K86711517-001-01-8	Broad Institute of MIT and Harvard	BRD-K86711517			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)NS(C)(=O)=O)[C@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,21-,23+/m0/s1	SVPAUNQWUYQQNC-DJTDUFQSSA-N	476.161721946							123096
BRD-K37132815	LSM-34540		54647223	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19+,21+,23-/m0/s1	HOUMZMKGURXYQW-GBPFJNKXSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K37132815	BRD-K37132815-001-01-6	Broad Institute of MIT and Harvard	BRD-K37132815			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19+,21+,23-/m0/s1	HOUMZMKGURXYQW-GBPFJNKXSA-N	453.189985614							123097
BRD-K66654463	LSM-34541		54647126	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,21-,23+/m1/s1	SVPAUNQWUYQQNC-LBJGLMTLSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@@H](CO)O2	BroadT	BRD-K66654463	BRD-K66654463-001-01-8	Broad Institute of MIT and Harvard	BRD-K66654463			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)NS(C)(=O)=O)[C@@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,21-,23+/m1/s1	SVPAUNQWUYQQNC-LBJGLMTLSA-N	476.161721946							123098
BRD-K13087600	LSM-34542		54647237	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20-,22+/m1/s1	RVCZJXOSFIZTQF-ZLLBNUPZSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K13087600	BRD-K13087600-001-01-9	Broad Institute of MIT and Harvard	BRD-K13087600			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20-,22+/m1/s1	RVCZJXOSFIZTQF-ZLLBNUPZSA-N	414.21547208							123099
BRD-K63188051	LSM-34543		54647324	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21-,23-,26+/m1/s1	DDTMCUFVLBWJID-FNOOYVSXSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K63188051	BRD-K63188051-001-01-8	Broad Institute of MIT and Harvard	BRD-K63188051			C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C26H33N3O5/c1-16(17-7-5-4-6-8-17)27-24(31)13-19-12-21-20-11-18(28-25(32)14-29(2)3)9-10-22(20)34-26(21)23(15-30)33-19/h4-11,16,19,21,23,26,30H,12-15H2,1-3H3,(H,27,31)(H,28,32)/t16-,19+,21-,23-,26+/m1/s1	DDTMCUFVLBWJID-FNOOYVSXSA-N	467.242021186							123100
BRD-K23434564	LSM-34544		54647133	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,21+,23+/m1/s1	SVPAUNQWUYQQNC-XKAWVMRWSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@H](CO)O2	BroadT	BRD-K23434564	BRD-K23434564-001-01-5	Broad Institute of MIT and Harvard	BRD-K23434564			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)NS(C)(=O)=O)[C@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18-,21+,23+/m1/s1	SVPAUNQWUYQQNC-XKAWVMRWSA-N	476.161721946							123101
BRD-K64730761	LSM-34545		54647173	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-1-2-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-5-7-26-8-6-15/h3-8,10,16,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m0/s1	VGFNAMSCNMBZFO-PMTIONAUSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K64730761	BRD-K64730761-001-01-7	Broad Institute of MIT and Harvard	BRD-K64730761			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-1-2-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-5-7-26-8-6-15/h3-8,10,16,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,25-/m0/s1	VGFNAMSCNMBZFO-PMTIONAUSA-N	451.210721058							123102
BRD-K16682693	LSM-34546		54647188	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26+,28-,30-/m0/s1	XMRNAPLDHHXMNZ-VANZEMCSSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)N5CCc6ccccc6C5)C[C@@H]4c3c2)cc1	BroadT	BRD-K16682693	BRD-K16682693-001-01-2	Broad Institute of MIT and Harvard	BRD-K16682693			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)N5CCc6ccccc6C5)O[C@H]4CO)c3c2)cc1	InChI=1S/C31H33N3O6/c1-38-23-9-6-21(7-10-23)32-31(37)33-22-8-11-27-25(14-22)26-15-24(39-28(18-35)30(26)40-27)16-29(36)34-13-12-19-4-2-3-5-20(19)17-34/h2-11,14,24,26,28,30,35H,12-13,15-18H2,1H3,(H2,32,33,37)/t24-,26+,28-,30-/m0/s1	XMRNAPLDHHXMNZ-VANZEMCSSA-N	543.236935806							123103
BRD-K67261586	LSM-34547		54647242	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20-,22-/m0/s1	RVCZJXOSFIZTQF-UPSSIMKTSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K67261586	BRD-K67261586-001-01-3	Broad Institute of MIT and Harvard	BRD-K67261586			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20-,22-/m0/s1	RVCZJXOSFIZTQF-UPSSIMKTSA-N	414.21547208							123104
BRD-K24369860	LSM-34548		54647219	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,24-/m0/s1	RDOSCOXXMIXCDB-FVSDWULHSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K24369860	BRD-K24369860-001-01-3	Broad Institute of MIT and Harvard	BRD-K24369860			OC[C@@H]1O[C@H](CC(=O)NCc2ccncc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-15-6-8-26-9-7-15)19-10-17(4-5-21(19)33-24)28-25(31)16-2-1-3-16/h4-10,16,18,20,22,24,29H,1-3,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,24-/m0/s1	RDOSCOXXMIXCDB-FVSDWULHSA-N	451.210721058							123105
BRD-K46715415	LSM-34549		54647363	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22-,26-,28+/m0/s1	DCKQIPUZKHPVQM-UCAWGOPWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K46715415	BRD-K46715415-001-01-1	Broad Institute of MIT and Harvard	BRD-K46715415			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C30H28F3N3O7/c31-30(32,33)17-2-4-18(5-3-17)35-29(39)36-19-6-8-23-21(10-19)22-11-20(42-26(14-37)28(22)43-23)12-27(38)34-13-16-1-7-24-25(9-16)41-15-40-24/h1-10,20,22,26,28,37H,11-15H2,(H,34,38)(H2,35,36,39)/t20-,22-,26-,28+/m0/s1	DCKQIPUZKHPVQM-UCAWGOPWSA-N	599.187934866							123106
BRD-K75576005	LSM-34550		54647291	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16+,18+,20-/m1/s1	BVUMLAQBIXIYMI-VKSDOSABSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)NC4CCCCC4)cc23	BroadT	BRD-K75576005	BRD-K75576005-001-01-7	Broad Institute of MIT and Harvard	BRD-K75576005			OC[C@@H]1O[C@@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCCC3)cc21	InChI=1S/C21H28N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h6-8,12,14,16,18,20,24H,1-5,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16+,18+,20-/m1/s1	BVUMLAQBIXIYMI-VKSDOSABSA-N	404.194736636							123107
BRD-K22693056	LSM-34551		54647128	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18+,21+,23-/m0/s1	SVPAUNQWUYQQNC-RADBSXNGSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@@H](CO)O2	BroadT	BRD-K22693056	BRD-K22693056-001-01-2	Broad Institute of MIT and Harvard	BRD-K22693056			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(cc23)NS(C)(=O)=O)[C@@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18+,21+,23-/m0/s1	SVPAUNQWUYQQNC-RADBSXNGSA-N	476.161721946							123108
BRD-K44287054	LSM-34552		54647377	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18-,20+/m0/s1	VBPXJTQPFOPDPZ-PFSLXQJOSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccccc4)cc23	BroadT	BRD-K44287054	BRD-K44287054-001-01-9	Broad Institute of MIT and Harvard	BRD-K44287054			OC[C@@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18-,20+/m0/s1	VBPXJTQPFOPDPZ-PFSLXQJOSA-N	398.147786444							123109
BRD-K60107240	LSM-34553		54647381	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18+,20+/m0/s1	VBPXJTQPFOPDPZ-LBLLVPRASA-N	OC[C@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccccc4)cc23	BroadT	BRD-K60107240	BRD-K60107240-001-01-3	Broad Institute of MIT and Harvard	BRD-K60107240			OC[C@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16-,18+,20+/m0/s1	VBPXJTQPFOPDPZ-LBLLVPRASA-N	398.147786444							123110
BRD-K12360898	LSM-15110		54647195	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24-,26+/m1/s1	NNNMMCMDOXLHLD-DFICYWPVSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34	BroadT	BRD-K12360898	BRD-K12360898-001-01-2	Broad Institute of MIT and Harvard	BRD-K12360898			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C28H27F3N4O5/c29-28(30,31)16-4-6-17(7-5-16)34-27(38)35-18-8-9-23-21(11-18)22-12-20(39-24(15-36)26(22)40-23)13-25(37)33-14-19-3-1-2-10-32-19/h1-11,20,22,24,26,36H,12-15H2,(H,33,37)(H2,34,35,38)/t20-,22-,24-,26+/m1/s1	NNNMMCMDOXLHLD-DFICYWPVSA-N	556.193354604							103766
BRD-K07281036	LSM-34554		54647226	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19+,21-,23-/m0/s1	HOUMZMKGURXYQW-FTJYFCJYSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K07281036	BRD-K07281036-001-01-0	Broad Institute of MIT and Harvard	BRD-K07281036			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C24H27N3O6/c28-14-21-23-19(11-17(32-21)12-22(29)27-6-8-31-9-7-27)18-10-16(3-4-20(18)33-23)26-24(30)15-2-1-5-25-13-15/h1-5,10,13,17,19,21,23,28H,6-9,11-12,14H2,(H,26,30)/t17-,19+,21-,23-/m0/s1	HOUMZMKGURXYQW-FTJYFCJYSA-N	453.189985614							123111
BRD-K03540982	LSM-34555		54647114	InChI=1S/C30H31N3O8/c1-37-20-6-3-18(4-7-20)32-30(36)33-19-5-9-24-22(11-19)23-12-21(40-27(15-34)29(23)41-24)13-28(35)31-14-17-2-8-25-26(10-17)39-16-38-25/h2-11,21,23,27,29,34H,12-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,27-,29+/m1/s1	JXDOTDJWTJAHDX-HMISVTBFSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NCc5ccc6OCOc6c5)C[C@@H]4c3c2)cc1	BroadT	BRD-K03540982	BRD-K03540982-001-01-7	Broad Institute of MIT and Harvard	BRD-K03540982			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NCc5ccc6OCOc6c5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C30H31N3O8/c1-37-20-6-3-18(4-7-20)32-30(36)33-19-5-9-24-22(11-19)23-12-21(40-27(15-34)29(23)41-24)13-28(35)31-14-17-2-8-25-26(10-17)39-16-38-25/h2-11,21,23,27,29,34H,12-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,27-,29+/m1/s1	JXDOTDJWTJAHDX-HMISVTBFSA-N	561.211114982							123112
BRD-K05223209	LSM-34556		54647246	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19-,21-,23+/m0/s1	XRZWMSINEDMJNA-RAQQXGOJSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K05223209	BRD-K05223209-001-01-5	Broad Institute of MIT and Harvard	BRD-K05223209			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1	InChI=1S/C23H27FN2O6S/c1-2-9-25-22(28)12-16-11-19-18-10-15(5-8-20(18)32-23(19)21(13-27)31-16)26-33(29,30)17-6-3-14(24)4-7-17/h3-8,10,16,19,21,23,26-27H,2,9,11-13H2,1H3,(H,25,28)/t16-,19-,21-,23+/m0/s1	XRZWMSINEDMJNA-RAQQXGOJSA-N	478.157385494							123113
BRD-K88504000	LSM-34557		54647281	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19-,21-,23+/m1/s1	ZRCRXWGBTMXJDJ-LHWDRQQYSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K88504000	BRD-K88504000-001-01-9	Broad Institute of MIT and Harvard	BRD-K88504000			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19-,21-,23+/m1/s1	ZRCRXWGBTMXJDJ-LHWDRQQYSA-N	443.242021186							123114
BRD-K02154334	LSM-34558		54647340	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22-,24-,26+/m1/s1	OGUMJARTEHRGNP-DFICYWPVSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K02154334	BRD-K02154334-001-01-3	Broad Institute of MIT and Harvard	BRD-K02154334			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H26FN3O5/c28-18-5-1-3-16(9-18)13-30-25(33)12-20-11-22-21-10-19(31-27(34)17-4-2-8-29-14-17)6-7-23(21)36-26(22)24(15-32)35-20/h1-10,14,20,22,24,26,32H,11-13,15H2,(H,30,33)(H,31,34)/t20-,22-,24-,26+/m1/s1	OGUMJARTEHRGNP-DFICYWPVSA-N	491.185649162							131301
BRD-K52977489	LSM-34559		54647118	InChI=1S/C30H31N3O8/c1-37-20-6-3-18(4-7-20)32-30(36)33-19-5-9-24-22(11-19)23-12-21(40-27(15-34)29(23)41-24)13-28(35)31-14-17-2-8-25-26(10-17)39-16-38-25/h2-11,21,23,27,29,34H,12-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,27+,29+/m0/s1	JXDOTDJWTJAHDX-KMQHBQLASA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)NCc5ccc6OCOc6c5)C[C@H]4c3c2)cc1	BroadT	BRD-K52977489	BRD-K52977489-001-01-9	Broad Institute of MIT and Harvard	BRD-K52977489			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NCc5ccc6OCOc6c5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C30H31N3O8/c1-37-20-6-3-18(4-7-20)32-30(36)33-19-5-9-24-22(11-19)23-12-21(40-27(15-34)29(23)41-24)13-28(35)31-14-17-2-8-25-26(10-17)39-16-38-25/h2-11,21,23,27,29,34H,12-16H2,1H3,(H,31,35)(H2,32,33,36)/t21-,23-,27+,29+/m0/s1	JXDOTDJWTJAHDX-KMQHBQLASA-N	561.211114982							123117
BRD-K19264579	LSM-34560		54647283	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19+,21+,23-/m0/s1	ZRCRXWGBTMXJDJ-GBPFJNKXSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K19264579	BRD-K19264579-001-01-5	Broad Institute of MIT and Harvard	BRD-K19264579			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C24H33N3O5/c28-13-21-23-19(10-17(31-21)11-22(29)25-12-14-5-6-14)18-9-16(7-8-20(18)32-23)27-24(30)26-15-3-1-2-4-15/h7-9,14-15,17,19,21,23,28H,1-6,10-13H2,(H,25,29)(H2,26,27,30)/t17-,19+,21+,23-/m0/s1	ZRCRXWGBTMXJDJ-GBPFJNKXSA-N	443.242021186							123118
BRD-K24640918-001-01-9	LSM-34561	BRD-K24640918	54647353	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13-,15+,17+/m0/s1	LRUFLDYNMXBWAO-QDFMMOOJSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	BroadT	BRD-K24640918	BRD-K24640918-001-01-9	Broad Institute of MIT and Harvard	BRD-K24640918			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	InChI=1S/C17H23NO5/c1-18(2)10-4-5-14-12(6-10)13-7-11(8-16(20)21-3)22-15(9-19)17(13)23-14/h4-6,11,13,15,17,19H,7-9H2,1-3H3/t11-,13-,15+,17+/m0/s1	LRUFLDYNMXBWAO-QDFMMOOJSA-N	321.157622846							123119
BRD-K06180841-001-01-0	LSM-34562	BRD-K06180841	54647100	InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21-,23-,25+/m1/s1	SRZDSTZFHOVQBI-YTAKYCMFSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NCC5CC5)C[C@@H]4c3c2)cc1	BroadT	BRD-K06180841	BRD-K06180841-001-01-0	Broad Institute of MIT and Harvard	BRD-K06180841			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NCC5CC5)O[C@@H]4CO)c3c2)cc1	InChI=1S/C26H31N3O6/c1-33-18-7-4-16(5-8-18)28-26(32)29-17-6-9-22-20(10-17)21-11-19(34-23(14-30)25(21)35-22)12-24(31)27-13-15-2-3-15/h4-10,15,19,21,23,25,30H,2-3,11-14H2,1H3,(H,27,31)(H2,28,29,32)/t19-,21-,23-,25+/m1/s1	SRZDSTZFHOVQBI-YTAKYCMFSA-N	481.221285742							123120
BRD-K48113764	LSM-34563		54647194	InChI=1S/C28H27F2N3O5/c29-18-1-3-23(30)17(10-18)14-32-26(35)13-20-12-22-21-11-19(33-27(36)9-16-5-7-31-8-6-16)2-4-24(21)38-28(22)25(15-34)37-20/h1-8,10-11,20,22,25,28,34H,9,12-15H2,(H,32,35)(H,33,36)/t20-,22+,25-,28-/m0/s1	QUIMTGQEYLWUJB-SIKUFVKPSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K48113764	BRD-K48113764-001-01-4	Broad Institute of MIT and Harvard	BRD-K48113764			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C28H27F2N3O5/c29-18-1-3-23(30)17(10-18)14-32-26(35)13-20-12-22-21-11-19(33-27(36)9-16-5-7-31-8-6-16)2-4-24(21)38-28(22)25(15-34)37-20/h1-8,10-11,20,22,25,28,34H,9,12-15H2,(H,32,35)(H,33,36)/t20-,22+,25-,28-/m0/s1	QUIMTGQEYLWUJB-SIKUFVKPSA-N	523.191877394							123121
BRD-K55465787	LSM-34564		54647240	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20+,22-/m1/s1	RVCZJXOSFIZTQF-DCZASFAJSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K55465787	BRD-K55465787-001-01-1	Broad Institute of MIT and Harvard	BRD-K55465787			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-22-18(9-16(29-20)10-21(27)24-11-13-4-5-13)17-8-15(6-7-19(17)30-22)25-23(28)14-2-1-3-14/h6-8,13-14,16,18,20,22,26H,1-5,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20+,22-/m1/s1	RVCZJXOSFIZTQF-DCZASFAJSA-N	414.21547208							123122
BRD-K99609051	LSM-34565		54647379	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16+,18-,20-/m1/s1	VBPXJTQPFOPDPZ-IHMNZUQTSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccccc4)cc23	BroadT	BRD-K99609051	BRD-K99609051-001-01-1	Broad Institute of MIT and Harvard	BRD-K99609051			OC[C@H]1O[C@@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C21H22N2O6/c24-11-18-20-16(9-14(28-18)10-19(25)26)15-8-13(6-7-17(15)29-20)23-21(27)22-12-4-2-1-3-5-12/h1-8,14,16,18,20,24H,9-11H2,(H,25,26)(H2,22,23,27)/t14-,16+,18-,20-/m1/s1	VBPXJTQPFOPDPZ-IHMNZUQTSA-N	398.147786444							123123
BRD-K23299829	LSM-34566		54647361	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22-,24+,26+/m1/s1	OKSBXXIUCLCGOM-GUAAGHCTSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K23299829	BRD-K23299829-001-01-3	Broad Institute of MIT and Harvard	BRD-K23299829			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22-,24+,26+/m1/s1	OKSBXXIUCLCGOM-GUAAGHCTSA-N	514.187064442							123124
BRD-K13977555	LSM-34567		54647092	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21-,26-,28+/m1/s1	QPCDPRLGXJQWSH-ACEAMVEQSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccccc5F)cc34)[C@@H](CO)O2	BroadT	BRD-K13977555	BRD-K13977555-001-01-6	Broad Institute of MIT and Harvard	BRD-K13977555			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	InChI=1S/C29H30FN3O6/c1-37-24-9-5-2-6-17(24)15-31-27(35)14-19-13-21-20-12-18(10-11-25(20)39-28(21)26(16-34)38-19)32-29(36)33-23-8-4-3-7-22(23)30/h2-12,19,21,26,28,34H,13-16H2,1H3,(H,31,35)(H2,32,33,36)/t19-,21-,26-,28+/m1/s1	QPCDPRLGXJQWSH-ACEAMVEQSA-N	535.21186391							123125
BRD-K56357490	LSM-34568		54647265	InChI=1S/C30H33N3O6/c1-18(19-6-4-3-5-7-19)31-28(35)16-23-15-25-24-14-21(10-13-26(24)39-29(25)27(17-34)38-23)33-30(36)32-20-8-11-22(37-2)12-9-20/h3-14,18,23,25,27,29,34H,15-17H2,1-2H3,(H,31,35)(H2,32,33,36)/t18-,23+,25+,27-,29-/m0/s1	HXJPIEDLBOYUCY-FCUVHQDBSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)N[C@@H](C)c5ccccc5)C[C@@H]4c3c2)cc1	BroadT	BRD-K56357490	BRD-K56357490-001-01-7	Broad Institute of MIT and Harvard	BRD-K56357490			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)N[C@@H](C)c5ccccc5)O[C@H]4CO)c3c2)cc1	InChI=1S/C30H33N3O6/c1-18(19-6-4-3-5-7-19)31-28(35)16-23-15-25-24-14-21(10-13-26(24)39-29(25)27(17-34)38-23)33-30(36)32-20-8-11-22(37-2)12-9-20/h3-14,18,23,25,27,29,34H,15-17H2,1-2H3,(H,31,35)(H2,32,33,36)/t18-,23+,25+,27-,29-/m0/s1	HXJPIEDLBOYUCY-FCUVHQDBSA-N	531.236935806							123126
BRD-K21671578	LSM-34569		54647170	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24+,26-,28-/m0/s1	DXWDIHWCVARGHC-BQGAEBSMSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)C[C@@H]3c2c1	BroadT	BRD-K21671578	BRD-K21671578-001-01-8	Broad Institute of MIT and Harvard	BRD-K21671578			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@H]3CO)c2c1	InChI=1S/C28H30N2O7S/c1-38(33,34)30-19-9-12-25-23(13-19)24-14-22(36-26(17-31)28(24)37-25)15-27(32)29-16-18-7-10-21(11-8-18)35-20-5-3-2-4-6-20/h2-13,22,24,26,28,30-31H,14-17H2,1H3,(H,29,32)/t22-,24+,26-,28-/m0/s1	DXWDIHWCVARGHC-BQGAEBSMSA-N	538.17737201							123127
BRD-K87259147	LSM-34570		54647176	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-1-2-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-5-7-26-8-6-15/h3-8,10,16,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m0/s1	VGFNAMSCNMBZFO-FZIATNMDSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Cc5ccncc5)cc34	BroadT	BRD-K87259147	BRD-K87259147-001-01-5	Broad Institute of MIT and Harvard	BRD-K87259147			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C25H29N3O5/c29-14-22-25-20(11-18(32-22)12-23(30)27-13-16-1-2-16)19-10-17(3-4-21(19)33-25)28-24(31)9-15-5-7-26-8-6-15/h3-8,10,16,18,20,22,25,29H,1-2,9,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,25+/m0/s1	VGFNAMSCNMBZFO-FZIATNMDSA-N	451.210721058							123128
BRD-K97711917	LSM-34571		54647139	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,22-/m0/s1	IZHKYGZZVSGRFT-UPSSIMKTSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	BroadT	BRD-K97711917	BRD-K97711917-001-01-1	Broad Institute of MIT and Harvard	BRD-K97711917			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C23H27N3O6/c1-30-8-7-25-21(28)11-16-10-18-17-9-15(26-23(29)14-3-2-6-24-12-14)4-5-19(17)32-22(18)20(13-27)31-16/h2-6,9,12,16,18,20,22,27H,7-8,10-11,13H2,1H3,(H,25,28)(H,26,29)/t16-,18+,20-,22-/m0/s1	IZHKYGZZVSGRFT-UPSSIMKTSA-N	441.189985614							123129
BRD-K00350773	LSM-34572		54647086	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27-,31-,33+/m0/s1	DKMWIPSTNBBBEH-XVROWLGISA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K00350773	BRD-K00350773-001-01-7	Broad Institute of MIT and Harvard	BRD-K00350773			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27-,31-,33+/m0/s1	DKMWIPSTNBBBEH-XVROWLGISA-N	597.227513974							123130
BRD-K01605333	LSM-34573		54647087	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27+,31+,33-/m0/s1	DKMWIPSTNBBBEH-KZGYLPGGSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccccc6F)cc45	BroadT	BRD-K01605333	BRD-K01605333-001-01-6	Broad Institute of MIT and Harvard	BRD-K01605333			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C34H32FN3O6/c35-28-8-4-5-9-29(28)38-34(41)37-22-12-15-30-26(16-22)27-17-25(43-31(20-39)33(27)44-30)18-32(40)36-19-21-10-13-24(14-11-21)42-23-6-2-1-3-7-23/h1-16,25,27,31,33,39H,17-20H2,(H,36,40)(H2,37,38,41)/t25-,27+,31+,33-/m0/s1	DKMWIPSTNBBBEH-KZGYLPGGSA-N	597.227513974							123131
BRD-K04407772	LSM-34574		54647298	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14-,16-,19+/m0/s1	WISUKBIGDPLILZ-BCRCDCHUSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)CC4CC4)cc23	BroadT	BRD-K04407772	BRD-K04407772-001-01-2	Broad Institute of MIT and Harvard	BRD-K04407772			OC[C@@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C19H23NO6/c21-9-16-19-14(7-12(25-16)8-18(23)24)13-6-11(3-4-15(13)26-19)20-17(22)5-10-1-2-10/h3-4,6,10,12,14,16,19,21H,1-2,5,7-9H2,(H,20,22)(H,23,24)/t12-,14-,16-,19+/m0/s1	WISUKBIGDPLILZ-BCRCDCHUSA-N	361.152537466							123132
BRD-K33748896	LSM-34575		54647130	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18+,21-,23-/m1/s1	SVPAUNQWUYQQNC-QBXAIUQQSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@@H](CO)O2	BroadT	BRD-K33748896	BRD-K33748896-001-01-5	Broad Institute of MIT and Harvard	BRD-K33748896			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)NS(C)(=O)=O)[C@@H](CO)O1	InChI=1S/C23H28N2O7S/c1-30-19-6-4-3-5-14(19)12-24-22(27)11-16-10-18-17-9-15(25-33(2,28)29)7-8-20(17)32-23(18)21(13-26)31-16/h3-9,16,18,21,23,25-26H,10-13H2,1-2H3,(H,24,27)/t16-,18+,21-,23-/m1/s1	SVPAUNQWUYQQNC-QBXAIUQQSA-N	476.161721946							123133
BRD-K24929039	LSM-34576		54647355	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22-,24-,26+/m0/s1	OKSBXXIUCLCGOM-IFPZXYOKSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K24929039	BRD-K24929039-001-01-0	Broad Institute of MIT and Harvard	BRD-K24929039			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H31ClN2O6/c28-18-3-1-16(2-4-18)14-29-25(32)13-20-12-22-21-11-19(30-27(33)17-7-9-34-10-8-17)5-6-23(21)36-26(22)24(15-31)35-20/h1-6,11,17,20,22,24,26,31H,7-10,12-15H2,(H,29,32)(H,30,33)/t20-,22-,24-,26+/m0/s1	OKSBXXIUCLCGOM-IFPZXYOKSA-N	514.187064442							123134
BRD-K96788889	LSM-34577		54647154	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20+,22-,25-/m0/s1	GQOLZDUAMZVUJK-GPYREICYSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc(OC)cc4)C[C@@H]3c2c1	BroadT	BRD-K96788889	BRD-K96788889-001-01-4	Broad Institute of MIT and Harvard	BRD-K96788889			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc(OC)cc4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O7/c1-31-14-24(30)27-16-5-8-21-19(9-16)20-10-18(33-22(13-28)25(20)34-21)11-23(29)26-12-15-3-6-17(32-2)7-4-15/h3-9,18,20,22,25,28H,10-14H2,1-2H3,(H,26,29)(H,27,30)/t18-,20+,22-,25-/m0/s1	GQOLZDUAMZVUJK-GPYREICYSA-N	470.20530132							123135
CHEMBL2134127	LSM-11793	BRD-K55578148, SID131435344	54639059	InChI=1S/C15H21N5O2/c16-12-5-4-11(22-15(12)10-21)6-8-20-9-14(18-19-20)13-3-1-2-7-17-13/h1-3,7,9,11-12,15,21H,4-6,8,10,16H2/t11-,12-,15-/m0/s1	UZCFPAZMYSFTCU-HUBLWGQQSA-N	N[C@H]1CC[C@@H](CCn2cc(nn2)c3ccccn3)O[C@H]1CO	BroadT	BRD-K55578148	BRD-K55578148-001-01-5	Broad Institute of MIT and Harvard	BRD-K55578148			N[C@H]1CC[C@@H](CCn2cc(nn2)-c2ccccn2)O[C@H]1CO	InChI=1S/C15H21N5O2/c16-12-5-4-11(22-15(12)10-21)6-8-20-9-14(18-19-20)13-3-1-2-7-17-13/h1-3,7,9,11-12,15,21H,4-6,8,10,16H2/t11-,12-,15-/m0/s1	UZCFPAZMYSFTCU-HUBLWGQQSA-N	303.169524962							100418
BRD-K08972808	LSM-8970		54638859	InChI=1S/C24H30N4O5S/c1-32-21-9-5-8-19(14-21)23-15-28(27-25-23)13-12-20-10-11-22(24(16-29)33-20)26-34(30,31)17-18-6-3-2-4-7-18/h2-9,14-15,20,22,24,26,29H,10-13,16-17H2,1H3/t20-,22+,24-/m0/s1	LQIYJTVMCFCXBS-FJIJXJHWSA-N	COc1cccc(c1)c2cn(CC[C@@H]3CC[C@@H](NS(=O)(=O)Cc4ccccc4)[C@H](CO)O3)nn2	BroadT	BRD-K08972808	BRD-K08972808-001-01-9	Broad Institute of MIT and Harvard	BRD-K08972808			COc1cccc(c1)-c1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)Cc3ccccc3)[C@H](CO)O2)nn1	InChI=1S/C24H30N4O5S/c1-32-21-9-5-8-19(14-21)23-15-28(27-25-23)13-12-20-10-11-22(24(16-29)33-20)26-34(30,31)17-18-6-3-2-4-7-18/h2-9,14-15,20,22,24,26,29H,10-13,16-17H2,1H3/t20-,22+,24-/m0/s1	LQIYJTVMCFCXBS-FJIJXJHWSA-N	486.19369079							97591
BRD-K98638910	LSM-14483		54639041	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20+,21-/m0/s1	VUOOERVJSWLFKU-TYPHKJRUSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2CO	BroadT	BRD-K98638910	BRD-K98638910-001-01-2	Broad Institute of MIT and Harvard	BRD-K98638910			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20+,21-/m0/s1	VUOOERVJSWLFKU-TYPHKJRUSA-N	451.214091876							103138
MLS003649966	LSM-14492	BRD-K98814272	53382629	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17-,18+/m0/s1	BAJOMULNWMTCGT-RYQLBKOJSA-N	CN1CCN(CC1)C(=O)C[C@H]2O[C@H](CO)[C@@H](NS(=O)(=O)c3cccc(F)c3)C=C2	BroadT	BRD-K98814272	BRD-K98814272-001-01-1	Broad Institute of MIT and Harvard	BRD-K98814272			CN1CCN(CC1)C(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17-,18+/m0/s1	BAJOMULNWMTCGT-RYQLBKOJSA-N	427.157719852							103147
BRD-K61388502	LSM-12147		54639082	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18+,20-/m1/s1	ZNMNRMGCWQWZTD-WSTZPKSXSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@H](CC(=O)NCc3cccc(F)c3)O[C@@H]2CO	BroadT	BRD-K61388502	BRD-K61388502-001-01-1	Broad Institute of MIT and Harvard	BRD-K61388502			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@H](CC(=O)NCc2cccc(F)c2)O[C@@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18+,20-/m1/s1	ZNMNRMGCWQWZTD-WSTZPKSXSA-N	466.157385494							100773
BRD-K77603027	LSM-13170		54639137	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24+,25+/m1/s1	JZSLTRUJUOZFGD-DSITVLBTSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K77603027	BRD-K77603027-001-01-1	Broad Institute of MIT and Harvard	BRD-K77603027			OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24+,25+/m1/s1	JZSLTRUJUOZFGD-DSITVLBTSA-N	459.215806438							101808
BRD-K26128727	LSM-10012		54638976	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19-,21+/m1/s1	XDPGLRIFEVLTPI-BSIFCXSSSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CCNS(=O)(=O)c3ccccc3)O[C@H]2CO	BroadT	BRD-K26128727	BRD-K26128727-001-01-4	Broad Institute of MIT and Harvard	BRD-K26128727			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CCNS(=O)(=O)c2ccccc2)O[C@H]1CO	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19-,21+/m1/s1	XDPGLRIFEVLTPI-BSIFCXSSSA-N	463.177706368							98633
BRD-K67673602	LSM-12549		54638877	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16+/m1/s1	UGRHUCUWEJLITN-PMPSAXMXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K67673602	BRD-K67673602-001-01-9	Broad Institute of MIT and Harvard	BRD-K67673602			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)c1ccncc1	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16+/m1/s1	UGRHUCUWEJLITN-PMPSAXMXSA-N	345.168856246							101180
BRD-K94241935	LSM-14207		54639115	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20-,21+/m0/s1	SBFIZHFYYISGJV-ORYQWCPZSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CCNC(=O)c3ccccc3F)O[C@@H]2CO	BroadT	BRD-K94241935	BRD-K94241935-001-01-0	Broad Institute of MIT and Harvard	BRD-K94241935			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CCNC(=O)c2ccccc2F)O[C@@H]1CO	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20-,21+/m0/s1	SBFIZHFYYISGJV-ORYQWCPZSA-N	450.162470874							102861
BRD-K82991167	LSM-13498		54638960	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19-,22+/m1/s1	UDMIDSQAUXVXMN-YHFKFMBFSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c4ccccc4	BroadT	BRD-K82991167	BRD-K82991167-001-01-3	Broad Institute of MIT and Harvard	BRD-K82991167			C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c1ccccc1	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19-,22+/m1/s1	UDMIDSQAUXVXMN-YHFKFMBFSA-N	453.189985614							102139
BRD-K54627309	LSM-11746		54638953	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22-/m0/s1	HKZRXKNGDCOEMV-VWPQPMDRSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3ccccc3)CC[C@H]1NC(=O)Cc4ccccn4	BroadT	BRD-K54627309	BRD-K54627309-001-01-6	Broad Institute of MIT and Harvard	BRD-K54627309			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2ccccc2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22-/m0/s1	HKZRXKNGDCOEMV-VWPQPMDRSA-N	421.211389774							100371
BRD-K28540419	LSM-10157		54639163	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18-,19+/m0/s1	FKDHCSBIQDWEMT-YTQUADARSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2Cl)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K28540419	BRD-K28540419-001-01-1	Broad Institute of MIT and Harvard	BRD-K28540419			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2Cl)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18-,19+/m0/s1	FKDHCSBIQDWEMT-YTQUADARSA-N	424.176499758							98778
BRD-K21643869	LSM-9745		54638855	InChI=1S/C24H30N4O5S/c1-32-21-9-5-8-19(14-21)23-15-28(27-25-23)13-12-20-10-11-22(24(16-29)33-20)26-34(30,31)17-18-6-3-2-4-7-18/h2-9,14-15,20,22,24,26,29H,10-13,16-17H2,1H3/t20-,22+,24+/m1/s1	LQIYJTVMCFCXBS-SFLYRZDNSA-N	COc1cccc(c1)c2cn(CC[C@H]3CC[C@H](NS(=O)(=O)Cc4ccccc4)[C@H](CO)O3)nn2	BroadT	BRD-K21643869	BRD-K21643869-001-01-5	Broad Institute of MIT and Harvard	BRD-K21643869			COc1cccc(c1)-c1cn(CC[C@H]2CC[C@H](NS(=O)(=O)Cc3ccccc3)[C@H](CO)O2)nn1	InChI=1S/C24H30N4O5S/c1-32-21-9-5-8-19(14-21)23-15-28(27-25-23)13-12-20-10-11-22(24(16-29)33-20)26-34(30,31)17-18-6-3-2-4-7-18/h2-9,14-15,20,22,24,26,29H,10-13,16-17H2,1H3/t20-,22+,24+/m1/s1	LQIYJTVMCFCXBS-SFLYRZDNSA-N	486.19369079							98366
BRD-K02492147	LSM-8589		54639126	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17+,18-/m1/s1	BAJOMULNWMTCGT-BPQIPLTHSA-N	CN1CCN(CC1)C(=O)C[C@@H]2O[C@H](CO)[C@@H](NS(=O)(=O)c3cccc(F)c3)C=C2	BroadT	BRD-K02492147	BRD-K02492147-001-01-4	Broad Institute of MIT and Harvard	BRD-K02492147			CN1CCN(CC1)C(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17+,18-/m1/s1	BAJOMULNWMTCGT-BPQIPLTHSA-N	427.157719852							97210
BRD-K77429897	LSM-13163		54639108	InChI=1S/C14H18N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h3-6,10-12,17H,1-2,7-8H2,(H,16,20)(H,18,19)/t10-,11+,12+/m1/s1	PLQUATFCVTZMJC-WOPDTQHZSA-N	OC[C@@H]1O[C@@H](CC(=O)O)CC[C@@H]1NC(=O)c2ccncc2	BroadT	BRD-K77429897	BRD-K77429897-001-01-8	Broad Institute of MIT and Harvard	BRD-K77429897			OC[C@@H]1O[C@@H](CC(O)=O)CC[C@@H]1NC(=O)c1ccncc1	InChI=1S/C14H18N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h3-6,10-12,17H,1-2,7-8H2,(H,16,20)(H,18,19)/t10-,11+,12+/m1/s1	PLQUATFCVTZMJC-WOPDTQHZSA-N	294.121571696							101801
BRD-K71799397	LSM-12827		54638974	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19+,21+/m1/s1	XDPGLRIFEVLTPI-PBEJRMEISA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CCNS(=O)(=O)c3ccccc3)O[C@H]2CO	BroadT	BRD-K71799397	BRD-K71799397-001-01-5	Broad Institute of MIT and Harvard	BRD-K71799397			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CCNS(=O)(=O)c2ccccc2)O[C@H]1CO	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19+,21+/m1/s1	XDPGLRIFEVLTPI-PBEJRMEISA-N	463.177706368							101464
BRD-K74830065	LSM-13015		54639122	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17+,18+/m1/s1	BAJOMULNWMTCGT-NJAFHUGGSA-N	CN1CCN(CC1)C(=O)C[C@@H]2O[C@@H](CO)[C@@H](NS(=O)(=O)c3cccc(F)c3)C=C2	BroadT	BRD-K74830065	BRD-K74830065-001-01-6	Broad Institute of MIT and Harvard	BRD-K74830065			CN1CCN(CC1)C(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17+,18+/m1/s1	BAJOMULNWMTCGT-NJAFHUGGSA-N	427.157719852							101652
BRD-K32972218	LSM-10431		54638918	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16+,19-/m1/s1	HBSXUOUHADHDTK-SIXWZSSISA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3CC3)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K32972218	BRD-K32972218-001-01-3	Broad Institute of MIT and Harvard	BRD-K32972218			OC[C@H]1O[C@@H](CCn2cc(nn2)C2CC2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16+,19-/m1/s1	HBSXUOUHADHDTK-SIXWZSSISA-N	421.19254611							99052
BRD-K10645566	LSM-9067		54638991	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20-/m1/s1	GUCCOCGWZUYAMY-VAMGGRTRSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K10645566	BRD-K10645566-001-01-9	Broad Institute of MIT and Harvard	BRD-K10645566			OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20-/m1/s1	GUCCOCGWZUYAMY-VAMGGRTRSA-N	412.211055416							97688
BRD-K54199214	LSM-11725		54638907	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17+,19+/m0/s1	VBSGUKREVIUPDG-KVSKMBFKSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K54199214	BRD-K54199214-001-01-0	Broad Institute of MIT and Harvard	BRD-K54199214			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17+,19+/m0/s1	VBSGUKREVIUPDG-KVSKMBFKSA-N	453.112519298							100350
BRD-K45919129	LSM-11226		54639078	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18-,20-/m1/s1	ZNMNRMGCWQWZTD-QWFCFKBJSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)NCc3cccc(F)c3)O[C@@H]2CO	BroadT	BRD-K45919129	BRD-K45919129-001-01-7	Broad Institute of MIT and Harvard	BRD-K45919129			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)NCc2cccc(F)c2)O[C@@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18-,20-/m1/s1	ZNMNRMGCWQWZTD-QWFCFKBJSA-N	466.157385494							99847
BRD-K70689011	LSM-12741		54639117	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20-,21-/m1/s1	SBFIZHFYYISGJV-MAODMQOUSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CCNC(=O)c3ccccc3F)O[C@@H]2CO	BroadT	BRD-K70689011	BRD-K70689011-001-01-5	Broad Institute of MIT and Harvard	BRD-K70689011			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CCNC(=O)c2ccccc2F)O[C@@H]1CO	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20-,21-/m1/s1	SBFIZHFYYISGJV-MAODMQOUSA-N	450.162470874							101377
BRD-K32068846	LSM-10373		54638984	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18-,19-/m0/s1	DCVAKYLGJMAIQD-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K32068846	BRD-K32068846-001-01-0	Broad Institute of MIT and Harvard	BRD-K32068846			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18-,19-/m0/s1	DCVAKYLGJMAIQD-FHWLQOOXSA-N	407.22203467							98994
BRD-K08995626	LSM-8972		54639009	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18-,19+/m0/s1	JNXYUDJSGYXBCY-YTQUADARSA-N	OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K08995626	BRD-K08995626-001-01-0	Broad Institute of MIT and Harvard	BRD-K08995626			OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18-,19+/m0/s1	JNXYUDJSGYXBCY-YTQUADARSA-N	459.1839346							97593
BRD-K67328514	LSM-12527		54639010	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14+,15+/m0/s1	MSNHHRRUCLPTHC-RRFJBIMHSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)C3CCC3	BroadT	BRD-K67328514	BRD-K67328514-001-01-7	Broad Institute of MIT and Harvard	BRD-K67328514			OC[C@H]1O[C@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)C1CCC1	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14+,15+/m0/s1	MSNHHRRUCLPTHC-RRFJBIMHSA-N	324.204907396							101158
BRD-K99268544	LSM-14527		54639028	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22-,23+/m0/s1	QIJBHKKZJCMHEO-RJGXRXQPSA-N	OC[C@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)Nc4cccc(Cl)c4	BroadT	BRD-K99268544	BRD-K99268544-001-01-1	Broad Institute of MIT and Harvard	BRD-K99268544			OC[C@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22-,23+/m0/s1	QIJBHKKZJCMHEO-RJGXRXQPSA-N	469.188067516							103182
BRD-K21660676	LSM-9746		54639131	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22-,23-/m0/s1	YSHLOQAWMNLOEI-PMVMPFDFSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2CO	BroadT	BRD-K21660676	BRD-K21660676-001-01-2	Broad Institute of MIT and Harvard	BRD-K21660676			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)N2CCc3ccccc3C2)O[C@H]1CO	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22-,23-/m0/s1	YSHLOQAWMNLOEI-PMVMPFDFSA-N	458.18754277							98367
BRD-K77918164	LSM-13195		54638957	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19+,22+/m1/s1	UDMIDSQAUXVXMN-KRDZULTMSA-N	C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c4ccccc4	BroadT	BRD-K77918164	BRD-K77918164-001-01-6	Broad Institute of MIT and Harvard	BRD-K77918164			C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c1ccccc1	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19+,22+/m1/s1	UDMIDSQAUXVXMN-KRDZULTMSA-N	453.189985614							101833
BRD-K77709215	LSM-13178		54639023	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16-,19+/m1/s1	OCHDOPTVTSINTO-MDZRGWNJSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H](NC(=O)c3ccc4OCOc4c3)[C@H](CO)O2	BroadT	BRD-K77709215	BRD-K77709215-001-01-8	Broad Institute of MIT and Harvard	BRD-K77709215			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H](NC(=O)c2ccc3OCOc3c2)[C@H](CO)O1	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16-,19+/m1/s1	OCHDOPTVTSINTO-MDZRGWNJSA-N	419.205635678							101816
BRD-K15477190	LSM-9357		54638956	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19-,22-/m0/s1	UDMIDSQAUXVXMN-BCSOYYNPSA-N	C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c4ccccc4	BroadT	BRD-K15477190	BRD-K15477190-001-01-6	Broad Institute of MIT and Harvard	BRD-K15477190			C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c1ccccc1	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19-,22-/m0/s1	UDMIDSQAUXVXMN-BCSOYYNPSA-N	453.189985614							97978
BRD-K88652561	LSM-13878		54638857	InChI=1S/C24H30N4O5S/c1-32-21-9-5-8-19(14-21)23-15-28(27-25-23)13-12-20-10-11-22(24(16-29)33-20)26-34(30,31)17-18-6-3-2-4-7-18/h2-9,14-15,20,22,24,26,29H,10-13,16-17H2,1H3/t20-,22-,24-/m0/s1	LQIYJTVMCFCXBS-SSPYTLHUSA-N	COc1cccc(c1)c2cn(CC[C@@H]3CC[C@H](NS(=O)(=O)Cc4ccccc4)[C@H](CO)O3)nn2	BroadT	BRD-K88652561	BRD-K88652561-001-01-7	Broad Institute of MIT and Harvard	BRD-K88652561			COc1cccc(c1)-c1cn(CC[C@@H]2CC[C@H](NS(=O)(=O)Cc3ccccc3)[C@H](CO)O2)nn1	InChI=1S/C24H30N4O5S/c1-32-21-9-5-8-19(14-21)23-15-28(27-25-23)13-12-20-10-11-22(24(16-29)33-20)26-34(30,31)17-18-6-3-2-4-7-18/h2-9,14-15,20,22,24,26,29H,10-13,16-17H2,1H3/t20-,22-,24-/m0/s1	LQIYJTVMCFCXBS-SSPYTLHUSA-N	486.19369079							102531
BRD-K70237789	LSM-12716		54638966	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19+,20+/m1/s1	ONEMPWMAPHHZJV-UXPWSPDFSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)Nc3ccc(Cl)c(Cl)c3	BroadT	BRD-K70237789	BRD-K70237789-001-01-3	Broad Institute of MIT and Harvard	BRD-K70237789			OC[C@@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19+,20+/m1/s1	ONEMPWMAPHHZJV-UXPWSPDFSA-N	483.112789898							101351
BRD-K20121890	LSM-9653		54639121	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17+,18+/m0/s1	BAJOMULNWMTCGT-CGTJXYLNSA-N	CN1CCN(CC1)C(=O)C[C@H]2O[C@H](CO)[C@H](NS(=O)(=O)c3cccc(F)c3)C=C2	BroadT	BRD-K20121890	BRD-K20121890-001-01-6	Broad Institute of MIT and Harvard	BRD-K20121890			CN1CCN(CC1)C(=O)C[C@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17+,18+/m0/s1	BAJOMULNWMTCGT-CGTJXYLNSA-N	427.157719852							98274
BRD-K72261411	LSM-12856		54638987	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18+,19-/m1/s1	DCVAKYLGJMAIQD-CEXWTWQISA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K72261411	BRD-K72261411-001-01-7	Broad Institute of MIT and Harvard	BRD-K72261411			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18+,19-/m1/s1	DCVAKYLGJMAIQD-CEXWTWQISA-N	407.22203467							101493
BRD-K49931834	LSM-11465		54639098	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15-,19+/m0/s1	OAEJMSHQDKFBTQ-YZVOILCLSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K49931834	BRD-K49931834-001-01-4	Broad Institute of MIT and Harvard	BRD-K49931834			OC[C@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15-,19+/m0/s1	OAEJMSHQDKFBTQ-YZVOILCLSA-N	428.169584528							100086
BRD-K38037265	LSM-10732		54638865	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18-,20+/m0/s1	OLUPXTRBOWIZHH-XKGZKEIXSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)C4(O)CCCC4)O[C@@H]2CO	BroadT	BRD-K38037265	BRD-K38037265-001-01-1	Broad Institute of MIT and Harvard	BRD-K38037265			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)C2(O)CCCC2)O[C@@H]1CO	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18-,20+/m0/s1	OLUPXTRBOWIZHH-XKGZKEIXSA-N	459.248169206							99353
BRD-K77564294	LSM-13165		54638950	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22-/m0/s1	HKZRXKNGDCOEMV-ONTIZHBOSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)c3ccccc3)CC[C@@H]1NC(=O)Cc4ccccn4	BroadT	BRD-K77564294	BRD-K77564294-001-01-1	Broad Institute of MIT and Harvard	BRD-K77564294			OC[C@@H]1O[C@H](CCn2cc(nn2)-c2ccccc2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22-/m0/s1	HKZRXKNGDCOEMV-ONTIZHBOSA-N	421.211389774							101803
BRD-K05645732	LSM-8760		54639080	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18-,20-/m0/s1	ZNMNRMGCWQWZTD-BJLQDIEVSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)NCc3cccc(F)c3)O[C@H]2CO	BroadT	BRD-K05645732	BRD-K05645732-001-01-5	Broad Institute of MIT and Harvard	BRD-K05645732			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCc2cccc(F)c2)O[C@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18-,20-/m0/s1	ZNMNRMGCWQWZTD-BJLQDIEVSA-N	466.157385494							97381
BRD-K62213032	LSM-12205		54638902	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20+/m1/s1	YSDDRAAKFDNITG-XLNTUCKNSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)c2cccnc2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K62213032	BRD-K62213032-001-01-9	Broad Institute of MIT and Harvard	BRD-K62213032			C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)c2cccnc2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20+/m1/s1	YSDDRAAKFDNITG-XLNTUCKNSA-N	397.200156374							100831
BRD-K64497770	LSM-12366		54638928	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10-,11-/m0/s1	RKCCKXKETMZMSY-DCAQKATOSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CCN)O[C@H]1CO	BroadT	BRD-K64497770	BRD-K64497770-001-01-2	Broad Institute of MIT and Harvard	BRD-K64497770			CC(C)NC(=O)N[C@H]1CC[C@@H](CCN)O[C@H]1CO	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10-,11-/m0/s1	RKCCKXKETMZMSY-DCAQKATOSA-N	259.18959169							100993
BRD-K01352631	LSM-8519		54638995	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20-/m1/s1	GUCCOCGWZUYAMY-HSALFYBXSA-N	OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K01352631	BRD-K01352631-001-01-4	Broad Institute of MIT and Harvard	BRD-K01352631			OC[C@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20-/m1/s1	GUCCOCGWZUYAMY-HSALFYBXSA-N	412.211055416							97140
BRD-K88045846	LSM-13834		54639154	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17-,19+/m1/s1	JKKDNXFJBMMQFP-LMMKCTJWSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K88045846	BRD-K88045846-001-01-1	Broad Institute of MIT and Harvard	BRD-K88045846			OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17-,19+/m1/s1	JKKDNXFJBMMQFP-LMMKCTJWSA-N	434.162390662							131227
BRD-K95265783	LSM-14266		54639112	InChI=1S/C14H18N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h3-6,10-12,17H,1-2,7-8H2,(H,16,20)(H,18,19)/t10-,11+,12-/m0/s1	PLQUATFCVTZMJC-TUAOUCFPSA-N	OC[C@@H]1O[C@H](CC(=O)O)CC[C@H]1NC(=O)c2ccncc2	BroadT	BRD-K95265783	BRD-K95265783-001-01-1	Broad Institute of MIT and Harvard	BRD-K95265783			OC[C@@H]1O[C@H](CC(O)=O)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C14H18N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h3-6,10-12,17H,1-2,7-8H2,(H,16,20)(H,18,19)/t10-,11+,12-/m0/s1	PLQUATFCVTZMJC-TUAOUCFPSA-N	294.121571696							102920
BRD-K54980807	LSM-11761		54639005	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18+,19+/m1/s1	JNXYUDJSGYXBCY-NEWSRXKRSA-N	OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K54980807	BRD-K54980807-001-01-6	Broad Institute of MIT and Harvard	BRD-K54980807			OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18+,19+/m1/s1	JNXYUDJSGYXBCY-NEWSRXKRSA-N	459.1839346							100386
BRD-K12857449	LSM-9190		54639159	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18+,19+/m0/s1	FKDHCSBIQDWEMT-QXAKKESOSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2Cl)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K12857449	BRD-K12857449-001-01-1	Broad Institute of MIT and Harvard	BRD-K12857449			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2Cl)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18+,19+/m0/s1	FKDHCSBIQDWEMT-QXAKKESOSA-N	424.176499758							97811
BRD-K19203541	LSM-9582		54639062	InChI=1S/C28H28N2O5/c31-19-26-25(30-28(33)21-7-3-1-4-8-21)16-15-24(35-26)17-27(32)29-18-20-11-13-23(14-12-20)34-22-9-5-2-6-10-22/h1-16,24-26,31H,17-19H2,(H,29,32)(H,30,33)/t24-,25+,26+/m0/s1	KKHGDJJULHRULI-JIMJEQGWSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C=C[C@H]1NC(=O)c4ccccc4	BroadT	BRD-K19203541	BRD-K19203541-001-01-8	Broad Institute of MIT and Harvard	BRD-K19203541			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C=C[C@H]1NC(=O)c1ccccc1	InChI=1S/C28H28N2O5/c31-19-26-25(30-28(33)21-7-3-1-4-8-21)16-15-24(35-26)17-27(32)29-18-20-11-13-23(14-12-20)34-22-9-5-2-6-10-22/h1-16,24-26,31H,17-19H2,(H,29,32)(H,30,33)/t24-,25+,26+/m0/s1	KKHGDJJULHRULI-JIMJEQGWSA-N	472.199822016							98203
BRD-K97045804	LSM-14390		54639123	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17-,18-/m1/s1	BAJOMULNWMTCGT-KBAYOESNSA-N	CN1CCN(CC1)C(=O)C[C@@H]2O[C@H](CO)[C@H](NS(=O)(=O)c3cccc(F)c3)C=C2	BroadT	BRD-K97045804	BRD-K97045804-001-01-0	Broad Institute of MIT and Harvard	BRD-K97045804			CN1CCN(CC1)C(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17-,18-/m1/s1	BAJOMULNWMTCGT-KBAYOESNSA-N	427.157719852							103044
BRD-K94454791	LSM-14219		54639090	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25+,26-/m1/s1	HBACCIGQRKGJSE-UODIDJSMSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K94454791	BRD-K94454791-001-01-2	Broad Institute of MIT and Harvard	BRD-K94454791			OC[C@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25+,26-/m1/s1	HBACCIGQRKGJSE-UODIDJSMSA-N	485.325356886							102873
BRD-K73118655	LSM-12906		54639104	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18-/m1/s1	OPNJNCHASNUPJL-FGTMMUONSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@H](CC(=O)NC3CCC3)O[C@@H]2CO)cc1	BroadT	BRD-K73118655	BRD-K73118655-001-01-3	Broad Institute of MIT and Harvard	BRD-K73118655			COc1ccc(NC(=O)N[C@H]2CC[C@H](CC(=O)NC3CCC3)O[C@@H]2CO)cc1	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18-/m1/s1	OPNJNCHASNUPJL-FGTMMUONSA-N	391.210721058							101543
BRD-K46040098	LSM-11234		54639042	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16+,17+/m0/s1	QHWKOKDSIMAAGX-GVDBMIGSSA-N	COc1cccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)C)[C@@H](CO)O2)c1	BroadT	BRD-K46040098	BRD-K46040098-001-01-8	Broad Institute of MIT and Harvard	BRD-K46040098			COc1cccc(CNC(=O)C[C@@H]2CC[C@@H](NC(C)=O)[C@@H](CO)O2)c1	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16+,17+/m0/s1	QHWKOKDSIMAAGX-GVDBMIGSSA-N	350.184171952							99855
BRD-K77182083	LSM-13148		54638895	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20-/m1/s1	YSDDRAAKFDNITG-HUYLIWGRSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K77182083	BRD-K77182083-001-01-7	Broad Institute of MIT and Harvard	BRD-K77182083			C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20-/m1/s1	YSDDRAAKFDNITG-HUYLIWGRSA-N	397.200156374							101786
BRD-K19890875	LSM-9633		54639100	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18+/m0/s1	OPNJNCHASNUPJL-RCCFBDPRSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)NC3CCC3)O[C@@H]2CO)cc1	BroadT	BRD-K19890875	BRD-K19890875-001-01-8	Broad Institute of MIT and Harvard	BRD-K19890875			COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)NC3CCC3)O[C@@H]2CO)cc1	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18+/m0/s1	OPNJNCHASNUPJL-RCCFBDPRSA-N	391.210721058							98254
BRD-K24172839	LSM-9890		54639021	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16-,19-/m0/s1	OCHDOPTVTSINTO-BXWFABGCSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H](NC(=O)c3ccc4OCOc4c3)[C@H](CO)O2	BroadT	BRD-K24172839	BRD-K24172839-001-01-9	Broad Institute of MIT and Harvard	BRD-K24172839			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H](NC(=O)c2ccc3OCOc3c2)[C@H](CO)O1	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16-,19-/m0/s1	OCHDOPTVTSINTO-BXWFABGCSA-N	419.205635678							98511
BRD-K25644061	LSM-9985		54639048	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16+,17-/m1/s1	QHWKOKDSIMAAGX-IXDOHACOSA-N	COc1cccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)C)[C@@H](CO)O2)c1	BroadT	BRD-K25644061	BRD-K25644061-001-01-5	Broad Institute of MIT and Harvard	BRD-K25644061			COc1cccc(CNC(=O)C[C@H]2CC[C@H](NC(C)=O)[C@@H](CO)O2)c1	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16+,17-/m1/s1	QHWKOKDSIMAAGX-IXDOHACOSA-N	350.184171952							98606
BRD-K56943062	LSM-11873		54639088	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25-,26+/m0/s1	HBACCIGQRKGJSE-KKUQBAQOSA-N	OC[C@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K56943062	BRD-K56943062-001-01-2	Broad Institute of MIT and Harvard	BRD-K56943062			OC[C@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25-,26+/m0/s1	HBACCIGQRKGJSE-KKUQBAQOSA-N	485.325356886							100499
BRD-K31830316	LSM-10361		54639134	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22+,23-/m1/s1	YSHLOQAWMNLOEI-AKIFATBCSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2CO	BroadT	BRD-K31830316	BRD-K31830316-001-01-5	Broad Institute of MIT and Harvard	BRD-K31830316			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)N2CCc3ccccc3C2)O[C@@H]1CO	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22+,23-/m1/s1	YSHLOQAWMNLOEI-AKIFATBCSA-N	458.18754277							98982
BRD-K13275849	LSM-9225		54638872	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16+,17-/m1/s1	CARWJPWJJJMDHW-IXDOHACOSA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K13275849	BRD-K13275849-001-01-1	Broad Institute of MIT and Harvard	BRD-K13275849			OC[C@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16+,17-/m1/s1	CARWJPWJJJMDHW-IXDOHACOSA-N	383.242021186							97846
BRD-K10721194	LSM-9077		54638978	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19-,21-/m1/s1	XDPGLRIFEVLTPI-OZOXKJRCSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CCNS(=O)(=O)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K10721194	BRD-K10721194-001-01-8	Broad Institute of MIT and Harvard	BRD-K10721194			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CCNS(=O)(=O)c2ccccc2)O[C@@H]1CO	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19-,21-/m1/s1	XDPGLRIFEVLTPI-OZOXKJRCSA-N	463.177706368							97698
BRD-K45138525	LSM-11175		54639132	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22-,23+/m0/s1	YSHLOQAWMNLOEI-ACIOBRDBSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2CO	BroadT	BRD-K45138525	BRD-K45138525-001-01-4	Broad Institute of MIT and Harvard	BRD-K45138525			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)N2CCc3ccccc3C2)O[C@@H]1CO	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22-,23+/m0/s1	YSHLOQAWMNLOEI-ACIOBRDBSA-N	458.18754277							99796
BRD-K19426893	LSM-9600		54638850	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20-/m0/s1	ABKGFAHRWOKBSI-VDGAXYAQSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K19426893	BRD-K19426893-001-01-9	Broad Institute of MIT and Harvard	BRD-K19426893			OC[C@@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20-/m0/s1	ABKGFAHRWOKBSI-VDGAXYAQSA-N	421.237684734							98221
BRD-K64120525	LSM-12342		54638881	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16-/m1/s1	UGRHUCUWEJLITN-OWCLPIDISA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K64120525	BRD-K64120525-001-01-8	Broad Institute of MIT and Harvard	BRD-K64120525			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)c1ccncc1	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16-/m1/s1	UGRHUCUWEJLITN-OWCLPIDISA-N	345.168856246							100969
BRD-K19466708	LSM-9602		54639151	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17+,19+/m0/s1	JKKDNXFJBMMQFP-YQVWRLOYSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K19466708	BRD-K19466708-001-01-0	Broad Institute of MIT and Harvard	BRD-K19466708			OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17+,19+/m0/s1	JKKDNXFJBMMQFP-YQVWRLOYSA-N	434.162390662							98223
BRD-K31705167	LSM-10351		54638917	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16-,19+/m1/s1	HBSXUOUHADHDTK-OGWOLHLISA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3CC3)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K31705167	BRD-K31705167-001-01-9	Broad Institute of MIT and Harvard	BRD-K31705167			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2CC2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16-,19+/m1/s1	HBSXUOUHADHDTK-OGWOLHLISA-N	421.19254611							98972
BRD-K51241952	LSM-11562		54639030	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22-,23-/m1/s1	QIJBHKKZJCMHEO-DNVJHFABSA-N	OC[C@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)Nc4cccc(Cl)c4	BroadT	BRD-K51241952	BRD-K51241952-001-01-9	Broad Institute of MIT and Harvard	BRD-K51241952			OC[C@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22-,23-/m1/s1	QIJBHKKZJCMHEO-DNVJHFABSA-N	469.188067516							100185
BRD-K73261664	LSM-12914		54639140	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24-,25+/m0/s1	JZSLTRUJUOZFGD-CCDWMCETSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K73261664	BRD-K73261664-001-01-0	Broad Institute of MIT and Harvard	BRD-K73261664			OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24-,25+/m0/s1	JZSLTRUJUOZFGD-CCDWMCETSA-N	459.215806438							101551
BRD-K62039221	LSM-12193		54639053	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18-,19+/m0/s1	FGKXCNJDDMNFOM-GBESFXJTSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@@H]1NS(=O)(=O)Cc3ccccc3	BroadT	BRD-K62039221	BRD-K62039221-001-01-9	Broad Institute of MIT and Harvard	BRD-K62039221			OC[C@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@@H]1NS(=O)(=O)Cc1ccccc1	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18-,19+/m0/s1	FGKXCNJDDMNFOM-GBESFXJTSA-N	410.18754277							100819
BRD-K00342680	LSM-8445		54639025	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16+,19-/m0/s1	OCHDOPTVTSINTO-FCEWJHQRSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H](NC(=O)c3ccc4OCOc4c3)[C@H](CO)O2	BroadT	BRD-K00342680	BRD-K00342680-001-01-6	Broad Institute of MIT and Harvard	BRD-K00342680			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccc3OCOc3c2)[C@H](CO)O1	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16+,19-/m0/s1	OCHDOPTVTSINTO-FCEWJHQRSA-N	419.205635678							97066
BRD-K52971351	LSM-11661		54638941	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13-,14-/m0/s1	RGLUKSSVDYQFDC-IHRRRGAJSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCC2)C=C[C@@H]1NC(=O)C3CC3	BroadT	BRD-K52971351	BRD-K52971351-001-01-7	Broad Institute of MIT and Harvard	BRD-K52971351			OC[C@@H]1O[C@H](CC(=O)NC2CCC2)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13-,14-/m0/s1	RGLUKSSVDYQFDC-IHRRRGAJSA-N	308.173607268							100286
BRD-K09804899	LSM-9027		54638926	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10+,11-/m1/s1	RKCCKXKETMZMSY-OUAUKWLOSA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CCN)O[C@@H]1CO	BroadT	BRD-K09804899	BRD-K09804899-001-01-3	Broad Institute of MIT and Harvard	BRD-K09804899			CC(C)NC(=O)N[C@H]1CC[C@H](CCN)O[C@@H]1CO	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10+,11-/m1/s1	RKCCKXKETMZMSY-OUAUKWLOSA-N	259.18959169							97648
BRD-K93569571	LSM-14165		54639139	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24-,25-/m0/s1	JZSLTRUJUOZFGD-SDHOMARFSA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K93569571	BRD-K93569571-001-01-4	Broad Institute of MIT and Harvard	BRD-K93569571			OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@@H]1NC(=O)Cc1cccnc1	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24-,25-/m0/s1	JZSLTRUJUOZFGD-SDHOMARFSA-N	459.215806438							102819
BRD-K24017250	LSM-9878		54639109	InChI=1S/C14H18N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h3-6,10-12,17H,1-2,7-8H2,(H,16,20)(H,18,19)/t10-,11-,12-/m1/s1	PLQUATFCVTZMJC-IJLUTSLNSA-N	OC[C@H]1O[C@@H](CC(=O)O)CC[C@H]1NC(=O)c2ccncc2	BroadT	BRD-K24017250	BRD-K24017250-001-01-6	Broad Institute of MIT and Harvard	BRD-K24017250			OC[C@H]1O[C@@H](CC(O)=O)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C14H18N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h3-6,10-12,17H,1-2,7-8H2,(H,16,20)(H,18,19)/t10-,11-,12-/m1/s1	PLQUATFCVTZMJC-IJLUTSLNSA-N	294.121571696							98499
BRD-K67518269	LSM-12539		54638999	InChI=1S/C23H34N4O5S/c1-31-21-9-5-6-10-23(21)33(29,30)25-19-12-11-18(32-22(19)16-28)13-14-27-15-20(24-26-27)17-7-3-2-4-8-17/h5-6,9-10,15,17-19,22,25,28H,2-4,7-8,11-14,16H2,1H3/t18-,19-,22-/m1/s1	HBWIVVUPODMQBV-WOIUINJBSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)C4CCCCC4)O[C@@H]2CO	BroadT	BRD-K67518269	BRD-K67518269-001-01-0	Broad Institute of MIT and Harvard	BRD-K67518269			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)C2CCCCC2)O[C@@H]1CO	InChI=1S/C23H34N4O5S/c1-31-21-9-5-6-10-23(21)33(29,30)25-19-12-11-18(32-22(19)16-28)13-14-27-15-20(24-26-27)17-7-3-2-4-8-17/h5-6,9-10,15,17-19,22,25,28H,2-4,7-8,11-14,16H2,1H3/t18-,19-,22-/m1/s1	HBWIVVUPODMQBV-WOIUINJBSA-N	478.224990918							101170
BRD-K22173650	LSM-9769		54639158	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17+,19-/m0/s1	JKKDNXFJBMMQFP-SCTDSRPQSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K22173650	BRD-K22173650-001-01-5	Broad Institute of MIT and Harvard	BRD-K22173650			OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17+,19-/m0/s1	JKKDNXFJBMMQFP-SCTDSRPQSA-N	434.162390662							98390
BRD-K41597316	LSM-10955		54638860	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18+,20+/m0/s1	OLUPXTRBOWIZHH-ILZDJORESA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)C4(O)CCCC4)O[C@@H]2CO	BroadT	BRD-K41597316	BRD-K41597316-001-01-8	Broad Institute of MIT and Harvard	BRD-K41597316			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)C2(O)CCCC2)O[C@@H]1CO	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18+,20+/m0/s1	OLUPXTRBOWIZHH-ILZDJORESA-N	459.248169206							99576
BRD-K34839715	LSM-10525		54639045	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16-,17-/m0/s1	QHWKOKDSIMAAGX-ULQDDVLXSA-N	COc1cccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)C)[C@H](CO)O2)c1	BroadT	BRD-K34839715	BRD-K34839715-001-01-0	Broad Institute of MIT and Harvard	BRD-K34839715			COc1cccc(CNC(=O)C[C@@H]2CC[C@H](NC(C)=O)[C@H](CO)O2)c1	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16-,17-/m0/s1	QHWKOKDSIMAAGX-ULQDDVLXSA-N	350.184171952							99146
BRD-K83400219	LSM-13527		54638947	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22+/m1/s1	HKZRXKNGDCOEMV-URVUXULASA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3ccccc3)CC[C@@H]1NC(=O)Cc4ccccn4	BroadT	BRD-K83400219	BRD-K83400219-001-01-2	Broad Institute of MIT and Harvard	BRD-K83400219			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22+/m1/s1	HKZRXKNGDCOEMV-URVUXULASA-N	421.211389774							102169
BRD-K38481268	LSM-10756		54639092	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15+,19+/m0/s1	OAEJMSHQDKFBTQ-QMTMVMCOSA-N	OC[C@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K38481268	BRD-K38481268-001-01-8	Broad Institute of MIT and Harvard	BRD-K38481268			OC[C@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15+,19+/m0/s1	OAEJMSHQDKFBTQ-QMTMVMCOSA-N	428.169584528							99377
BRD-K46155530	LSM-11240		54639162	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18-,19-/m0/s1	FKDHCSBIQDWEMT-WDSOQIARSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2Cl)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K46155530	BRD-K46155530-001-01-0	Broad Institute of MIT and Harvard	BRD-K46155530			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2Cl)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18-,19-/m0/s1	FKDHCSBIQDWEMT-WDSOQIARSA-N	424.176499758							99861
BRD-K30033690	LSM-10246		54639038	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20-,21+/m0/s1	VUOOERVJSWLFKU-SESVDKBCSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2CO	BroadT	BRD-K30033690	BRD-K30033690-001-01-3	Broad Institute of MIT and Harvard	BRD-K30033690			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20-,21+/m0/s1	VUOOERVJSWLFKU-SESVDKBCSA-N	451.214091876							98867
BRD-K73573525	LSM-12937		54638961	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19+,22-/m0/s1	UDMIDSQAUXVXMN-KBZIOIMTSA-N	C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c4ccccc4	BroadT	BRD-K73573525	BRD-K73573525-001-01-7	Broad Institute of MIT and Harvard	BRD-K73573525			C[C@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c1ccccc1	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19+,22-/m0/s1	UDMIDSQAUXVXMN-KBZIOIMTSA-N	453.189985614							101574
BRD-K11097458	LSM-9106		54638971	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19-,20+/m0/s1	ONEMPWMAPHHZJV-FFZOFVMBSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)Nc3ccc(Cl)c(Cl)c3	BroadT	BRD-K11097458	BRD-K11097458-001-01-3	Broad Institute of MIT and Harvard	BRD-K11097458			OC[C@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19-,20+/m0/s1	ONEMPWMAPHHZJV-FFZOFVMBSA-N	483.112789898							97727
BRD-K35196676	LSM-10546		54639019	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16+,19+/m1/s1	OCHDOPTVTSINTO-GJYPPUQNSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H](NC(=O)c3ccc4OCOc4c3)[C@H](CO)O2	BroadT	BRD-K35196676	BRD-K35196676-001-01-1	Broad Institute of MIT and Harvard	BRD-K35196676			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H](NC(=O)c2ccc3OCOc3c2)[C@H](CO)O1	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16+,19+/m1/s1	OCHDOPTVTSINTO-GJYPPUQNSA-N	419.205635678							99167
BRD-K62456065	LSM-12222		54639077	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18+,20+/m1/s1	ZNMNRMGCWQWZTD-HBFSDRIKSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@H](CC(=O)NCc3cccc(F)c3)O[C@H]2CO	BroadT	BRD-K62456065	BRD-K62456065-001-01-4	Broad Institute of MIT and Harvard	BRD-K62456065			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@H](CC(=O)NCc2cccc(F)c2)O[C@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18+,20+/m1/s1	ZNMNRMGCWQWZTD-HBFSDRIKSA-N	466.157385494							100848
BRD-K08173649	LSM-8922		54639072	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13-,14+/m1/s1	BHRCWANBCSKYFS-MCIONIFRSA-N	COCC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K08173649	BRD-K08173649-001-01-7	Broad Institute of MIT and Harvard	BRD-K08173649			COCC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13-,14+/m1/s1	BHRCWANBCSKYFS-MCIONIFRSA-N	326.184171952							97543
BRD-K94317551	LSM-14211		54639017	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14+,15-/m0/s1	MSNHHRRUCLPTHC-ZNMIVQPWSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)C3CCC3	BroadT	BRD-K94317551	BRD-K94317551-001-01-1	Broad Institute of MIT and Harvard	BRD-K94317551			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)C1CCC1	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14+,15-/m0/s1	MSNHHRRUCLPTHC-ZNMIVQPWSA-N	324.204907396							102865
BRD-K36232819	LSM-10618		54638934	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19-,20+/m0/s1	IBEFNTNFDPOULD-RYGJVYDSSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K36232819	BRD-K36232819-001-01-1	Broad Institute of MIT and Harvard	BRD-K36232819			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19-,20+/m0/s1	IBEFNTNFDPOULD-RYGJVYDSSA-N	504.068876166							99239
BRD-K27757818	LSM-10101		54639143	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21+,22+/m0/s1	BQXPJFPCKYJDQK-BHDDXSALSA-N	OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@H]1NC(=O)c4ccncc4	BroadT	BRD-K27757818	BRD-K27757818-001-01-9	Broad Institute of MIT and Harvard	BRD-K27757818			OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@H]1NC(=O)c1ccncc1	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21+,22+/m0/s1	BQXPJFPCKYJDQK-BHDDXSALSA-N	436.211055416							98722
BRD-K76462626	LSM-13106		54638867	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18+,20-/m0/s1	OLUPXTRBOWIZHH-HQRMLTQVSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)C4(O)CCCC4)O[C@H]2CO	BroadT	BRD-K76462626	BRD-K76462626-001-01-8	Broad Institute of MIT and Harvard	BRD-K76462626			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)C2(O)CCCC2)O[C@H]1CO	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18+,20-/m0/s1	OLUPXTRBOWIZHH-HQRMLTQVSA-N	459.248169206							101744
BRD-K22778942	LSM-9812		54639084	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25+,26+/m0/s1	HBACCIGQRKGJSE-JIMJEQGWSA-N	OC[C@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K22778942	BRD-K22778942-001-01-9	Broad Institute of MIT and Harvard	BRD-K22778942			OC[C@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25+,26+/m0/s1	HBACCIGQRKGJSE-JIMJEQGWSA-N	485.325356886							98433
BRD-K58539957	LSM-11962		54638876	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16+/m0/s1	UGRHUCUWEJLITN-ARFHVFGLSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K58539957	BRD-K58539957-001-01-4	Broad Institute of MIT and Harvard	BRD-K58539957			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)c1ccncc1	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16+/m0/s1	UGRHUCUWEJLITN-ARFHVFGLSA-N	345.168856246							100588
BRD-K63285694	LSM-12279		54638861	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18+,20+/m1/s1	OLUPXTRBOWIZHH-KPFFTGBYSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CCn3cc(nn3)C4(O)CCCC4)O[C@H]2CO	BroadT	BRD-K63285694	BRD-K63285694-001-01-5	Broad Institute of MIT and Harvard	BRD-K63285694			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)C2(O)CCCC2)O[C@H]1CO	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18+,20+/m1/s1	OLUPXTRBOWIZHH-KPFFTGBYSA-N	459.248169206							100905
BRD-K29452018	LSM-10214		54639068	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13+,14+/m0/s1	BHRCWANBCSKYFS-BFHYXJOUSA-N	COCC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K29452018	BRD-K29452018-001-01-3	Broad Institute of MIT and Harvard	BRD-K29452018			COCC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13+,14+/m0/s1	BHRCWANBCSKYFS-BFHYXJOUSA-N	326.184171952							98835
BRD-K67285049	LSM-12524		54639049	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16+,17-/m0/s1	QHWKOKDSIMAAGX-BBWFWOEESA-N	COc1cccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)C)[C@H](CO)O2)c1	BroadT	BRD-K67285049	BRD-K67285049-001-01-3	Broad Institute of MIT and Harvard	BRD-K67285049			COc1cccc(CNC(=O)C[C@@H]2CC[C@@H](NC(C)=O)[C@H](CO)O2)c1	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16+,17-/m0/s1	QHWKOKDSIMAAGX-BBWFWOEESA-N	350.184171952							101155
BRD-K25688236	LSM-9987		54638887	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19-,20-/m1/s1	NMMAJMJUDCVZMW-VAMGGRTRSA-N	Cc1ccccc1S(=O)(=O)NCC[C@H]2CC[C@@H](NS(=O)(=O)c3ccccc3C)[C@@H](CO)O2	BroadT	BRD-K25688236	BRD-K25688236-001-01-2	Broad Institute of MIT and Harvard	BRD-K25688236			Cc1ccccc1S(=O)(=O)NCC[C@H]1CC[C@@H](NS(=O)(=O)c2ccccc2C)[C@@H](CO)O1	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19-,20-/m1/s1	NMMAJMJUDCVZMW-VAMGGRTRSA-N	482.15452808							98608
BRD-K41863121	LSM-10970		54638993	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20+/m1/s1	GUCCOCGWZUYAMY-AQNXPRMDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K41863121	BRD-K41863121-001-01-9	Broad Institute of MIT and Harvard	BRD-K41863121			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20+/m1/s1	GUCCOCGWZUYAMY-AQNXPRMDSA-N	412.211055416							99591
BRD-K22215387	LSM-9774		54638879	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16+/m0/s1	UGRHUCUWEJLITN-HRCADAONSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K22215387	BRD-K22215387-001-01-4	Broad Institute of MIT and Harvard	BRD-K22215387			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)c1ccncc1	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16+/m0/s1	UGRHUCUWEJLITN-HRCADAONSA-N	345.168856246							98395
BRD-K09845511	LSM-9029		54638913	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17-,19-/m0/s1	VBSGUKREVIUPDG-IEZWGBDMSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K09845511	BRD-K09845511-001-01-4	Broad Institute of MIT and Harvard	BRD-K09845511			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17-,19-/m0/s1	VBSGUKREVIUPDG-IEZWGBDMSA-N	453.112519298							97650
BRD-K41927787	LSM-10975		54638889	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19+,20-/m1/s1	NMMAJMJUDCVZMW-HSALFYBXSA-N	Cc1ccccc1S(=O)(=O)NCC[C@H]2CC[C@H](NS(=O)(=O)c3ccccc3C)[C@@H](CO)O2	BroadT	BRD-K41927787	BRD-K41927787-001-01-7	Broad Institute of MIT and Harvard	BRD-K41927787			Cc1ccccc1S(=O)(=O)NCC[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2C)[C@@H](CO)O1	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19+,20-/m1/s1	NMMAJMJUDCVZMW-HSALFYBXSA-N	482.15452808							99596
BRD-K34898196	LSM-10527		54638972	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19+,20-/m0/s1	ONEMPWMAPHHZJV-DBVUQKKJSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)Nc3ccc(Cl)c(Cl)c3	BroadT	BRD-K34898196	BRD-K34898196-001-01-4	Broad Institute of MIT and Harvard	BRD-K34898196			OC[C@@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19+,20-/m0/s1	ONEMPWMAPHHZJV-DBVUQKKJSA-N	483.112789898							99148
BRD-K66378473	LSM-12473		54638882	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16-/m0/s1	UGRHUCUWEJLITN-XHSDSOJGSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K66378473	BRD-K66378473-001-01-2	Broad Institute of MIT and Harvard	BRD-K66378473			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)c1ccncc1	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15+,16-/m0/s1	UGRHUCUWEJLITN-XHSDSOJGSA-N	345.168856246							101104
BRD-K74900896	LSM-13020		54639057	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18+,19-/m0/s1	FGKXCNJDDMNFOM-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@H]1NS(=O)(=O)Cc3ccccc3	BroadT	BRD-K74900896	BRD-K74900896-001-01-2	Broad Institute of MIT and Harvard	BRD-K74900896			OC[C@@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@H]1NS(=O)(=O)Cc1ccccc1	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18+,19-/m0/s1	FGKXCNJDDMNFOM-OTWHNJEPSA-N	410.18754277							101657
BRD-K19325173	LSM-9590		54638937	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19+,20-/m0/s1	IBEFNTNFDPOULD-BEVDRBHNSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K19325173	BRD-K19325173-001-01-4	Broad Institute of MIT and Harvard	BRD-K19325173			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19+,20-/m0/s1	IBEFNTNFDPOULD-BEVDRBHNSA-N	504.068876166							98211
BRD-K56345641	LSM-11838		54639039	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20-,21+/m1/s1	VUOOERVJSWLFKU-NRSPTQNISA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2CO	BroadT	BRD-K56345641	BRD-K56345641-001-01-0	Broad Institute of MIT and Harvard	BRD-K56345641			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20-,21+/m1/s1	VUOOERVJSWLFKU-NRSPTQNISA-N	451.214091876							100464
BRD-K65368843	LSM-12413		54639111	InChI=1S/C14H18N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h3-6,10-12,17H,1-2,7-8H2,(H,16,20)(H,18,19)/t10-,11+,12-/m1/s1	PLQUATFCVTZMJC-GRYCIOLGSA-N	OC[C@H]1O[C@@H](CC(=O)O)CC[C@@H]1NC(=O)c2ccncc2	BroadT	BRD-K65368843	BRD-K65368843-001-01-7	Broad Institute of MIT and Harvard	BRD-K65368843			OC[C@H]1O[C@@H](CC(O)=O)CC[C@@H]1NC(=O)c1ccncc1	InChI=1S/C14H18N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h3-6,10-12,17H,1-2,7-8H2,(H,16,20)(H,18,19)/t10-,11+,12-/m1/s1	PLQUATFCVTZMJC-GRYCIOLGSA-N	294.121571696							101040
MLS003649994	LSM-10268	BRD-K30571172	53382657	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16-/m1/s1	UGRHUCUWEJLITN-BZUAXINKSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K30571172	BRD-K30571172-001-01-9	Broad Institute of MIT and Harvard	BRD-K30571172			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)c1ccncc1	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16-/m1/s1	UGRHUCUWEJLITN-BZUAXINKSA-N	345.168856246							98889
BRD-K20307883	LSM-9668		54638970	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19-,20-/m0/s1	ONEMPWMAPHHZJV-VDGAXYAQSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)Nc3ccc(Cl)c(Cl)c3	BroadT	BRD-K20307883	BRD-K20307883-001-01-0	Broad Institute of MIT and Harvard	BRD-K20307883			OC[C@@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19-,20-/m0/s1	ONEMPWMAPHHZJV-VDGAXYAQSA-N	483.112789898							98289
BRD-K73701301	LSM-12945		54638858	InChI=1S/C24H30N4O5S/c1-32-21-9-5-8-19(14-21)23-15-28(27-25-23)13-12-20-10-11-22(24(16-29)33-20)26-34(30,31)17-18-6-3-2-4-7-18/h2-9,14-15,20,22,24,26,29H,10-13,16-17H2,1H3/t20-,22+,24-/m1/s1	LQIYJTVMCFCXBS-JCTONOIOSA-N	COc1cccc(c1)c2cn(CC[C@H]3CC[C@H](NS(=O)(=O)Cc4ccccc4)[C@@H](CO)O3)nn2	BroadT	BRD-K73701301	BRD-K73701301-001-01-4	Broad Institute of MIT and Harvard	BRD-K73701301			COc1cccc(c1)-c1cn(CC[C@H]2CC[C@H](NS(=O)(=O)Cc3ccccc3)[C@@H](CO)O2)nn1	InChI=1S/C24H30N4O5S/c1-32-21-9-5-8-19(14-21)23-15-28(27-25-23)13-12-20-10-11-22(24(16-29)33-20)26-34(30,31)17-18-6-3-2-4-7-18/h2-9,14-15,20,22,24,26,29H,10-13,16-17H2,1H3/t20-,22+,24-/m1/s1	LQIYJTVMCFCXBS-JCTONOIOSA-N	486.19369079							101582
BRD-K27699706	LSM-10096		54638943	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13-,14+/m1/s1	RGLUKSSVDYQFDC-MCIONIFRSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCC2)C=C[C@H]1NC(=O)C3CC3	BroadT	BRD-K27699706	BRD-K27699706-001-01-8	Broad Institute of MIT and Harvard	BRD-K27699706			OC[C@@H]1O[C@@H](CC(=O)NC2CCC2)C=C[C@H]1NC(=O)C1CC1	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13-,14+/m1/s1	RGLUKSSVDYQFDC-MCIONIFRSA-N	308.173607268							98717
BRD-K00544996	LSM-8466		54638939	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13+,14+/m1/s1	RGLUKSSVDYQFDC-RDBSUJKOSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCC2)C=C[C@@H]1NC(=O)C3CC3	BroadT	BRD-K00544996	BRD-K00544996-001-01-6	Broad Institute of MIT and Harvard	BRD-K00544996			OC[C@@H]1O[C@@H](CC(=O)NC2CCC2)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13+,14+/m1/s1	RGLUKSSVDYQFDC-RDBSUJKOSA-N	308.173607268							97087
BRD-K73483999	LSM-12930		54639096	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15-,19-/m1/s1	OAEJMSHQDKFBTQ-SPYBWZPUSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K73483999	BRD-K73483999-001-01-6	Broad Institute of MIT and Harvard	BRD-K73483999			OC[C@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15-,19-/m1/s1	OAEJMSHQDKFBTQ-SPYBWZPUSA-N	428.169584528							101567
BRD-K75809222	LSM-13064		54639113	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20+,21+/m0/s1	SBFIZHFYYISGJV-ZLGUVYLKSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CCNC(=O)c3ccccc3F)O[C@@H]2CO	BroadT	BRD-K75809222	BRD-K75809222-001-01-9	Broad Institute of MIT and Harvard	BRD-K75809222			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNC(=O)c2ccccc2F)O[C@@H]1CO	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20+,21+/m0/s1	SBFIZHFYYISGJV-ZLGUVYLKSA-N	450.162470874							101701
BRD-K59958061	LSM-12052		54639034	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20+,21+/m0/s1	VUOOERVJSWLFKU-CEWLAPEOSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@@H](CC(=O)NCCN3CCCCC3)O[C@@H]2CO	BroadT	BRD-K59958061	BRD-K59958061-001-01-8	Broad Institute of MIT and Harvard	BRD-K59958061			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20+,21+/m0/s1	VUOOERVJSWLFKU-CEWLAPEOSA-N	451.214091876							100678
BRD-K71552149	LSM-12807		54638905	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19-,20+/m1/s1	YSDDRAAKFDNITG-NMLACTOBSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)c2cccnc2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K71552149	BRD-K71552149-001-01-9	Broad Institute of MIT and Harvard	BRD-K71552149			C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)c2cccnc2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19-,20+/m1/s1	YSDDRAAKFDNITG-NMLACTOBSA-N	397.200156374							101444
BRD-K45383509	LSM-11194		54638997	InChI=1S/C23H34N4O5S/c1-31-21-9-5-6-10-23(21)33(29,30)25-19-12-11-18(32-22(19)16-28)13-14-27-15-20(24-26-27)17-7-3-2-4-8-17/h5-6,9-10,15,17-19,22,25,28H,2-4,7-8,11-14,16H2,1H3/t18-,19+,22+/m0/s1	HBWIVVUPODMQBV-NNMXDRDESA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)C4CCCCC4)O[C@@H]2CO	BroadT	BRD-K45383509	BRD-K45383509-001-01-6	Broad Institute of MIT and Harvard	BRD-K45383509			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)C2CCCCC2)O[C@@H]1CO	InChI=1S/C23H34N4O5S/c1-31-21-9-5-6-10-23(21)33(29,30)25-19-12-11-18(32-22(19)16-28)13-14-27-15-20(24-26-27)17-7-3-2-4-8-17/h5-6,9-10,15,17-19,22,25,28H,2-4,7-8,11-14,16H2,1H3/t18-,19+,22+/m0/s1	HBWIVVUPODMQBV-NNMXDRDESA-N	478.224990918							99815
BRD-K81189877	LSM-13392		54638965	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19+,20+/m0/s1	ONEMPWMAPHHZJV-PWIZWCRZSA-N	OC[C@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)Nc3ccc(Cl)c(Cl)c3	BroadT	BRD-K81189877	BRD-K81189877-001-01-6	Broad Institute of MIT and Harvard	BRD-K81189877			OC[C@H]1O[C@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19+,20+/m0/s1	ONEMPWMAPHHZJV-PWIZWCRZSA-N	483.112789898							102032
BRD-K08039553	LSM-8913		54639015	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14-,15+/m1/s1	MSNHHRRUCLPTHC-KFWWJZLASA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)C3CCC3	BroadT	BRD-K08039553	BRD-K08039553-001-01-4	Broad Institute of MIT and Harvard	BRD-K08039553			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)C1CCC1	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14-,15+/m1/s1	MSNHHRRUCLPTHC-KFWWJZLASA-N	324.204907396							97534
BRD-K75395214	LSM-13041		54639075	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13+,14-/m0/s1	BHRCWANBCSKYFS-MJBXVCDLSA-N	COCC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K75395214	BRD-K75395214-001-01-9	Broad Institute of MIT and Harvard	BRD-K75395214			COCC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13+,14-/m0/s1	BHRCWANBCSKYFS-MJBXVCDLSA-N	326.184171952							101678
BRD-K52653383	LSM-11643		54639032	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22+,23-/m1/s1	QIJBHKKZJCMHEO-XPWALMASSA-N	OC[C@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)Nc4cccc(Cl)c4	BroadT	BRD-K52653383	BRD-K52653383-001-01-3	Broad Institute of MIT and Harvard	BRD-K52653383			OC[C@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22+,23-/m1/s1	QIJBHKKZJCMHEO-XPWALMASSA-N	469.188067516							100268
BRD-K68095812	LSM-12577		54639086	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25-,26-/m1/s1	HBACCIGQRKGJSE-TWJOJJKGSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K68095812	BRD-K68095812-001-01-0	Broad Institute of MIT and Harvard	BRD-K68095812			OC[C@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25-,26-/m1/s1	HBACCIGQRKGJSE-TWJOJJKGSA-N	485.325356886							101208
BRD-K13002201	LSM-9205		54639013	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14-,15-/m0/s1	MSNHHRRUCLPTHC-KKUMJFAQSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K13002201	BRD-K13002201-001-01-1	Broad Institute of MIT and Harvard	BRD-K13002201			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)C1CCC1	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14-,15-/m0/s1	MSNHHRRUCLPTHC-KKUMJFAQSA-N	324.204907396							97826
BRD-K00262667	LSM-8443		54638930	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19+,20+/m0/s1	IBEFNTNFDPOULD-CWFSZBLJSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K00262667	BRD-K00262667-001-01-3	Broad Institute of MIT and Harvard	BRD-K00262667			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19+,20+/m0/s1	IBEFNTNFDPOULD-CWFSZBLJSA-N	504.068876166							97064
BRD-K83407176	LSM-13528		54639147	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21-,22+/m0/s1	BQXPJFPCKYJDQK-FDFHNCONSA-N	OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@@H]1NC(=O)c4ccncc4	BroadT	BRD-K83407176	BRD-K83407176-001-01-8	Broad Institute of MIT and Harvard	BRD-K83407176			OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@@H]1NC(=O)c1ccncc1	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21-,22+/m0/s1	BQXPJFPCKYJDQK-FDFHNCONSA-N	436.211055416							102170
BRD-K24656059	LSM-9924		54639142	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24+,25-/m0/s1	JZSLTRUJUOZFGD-GVAUOCQISA-N	OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K24656059	BRD-K24656059-001-01-4	Broad Institute of MIT and Harvard	BRD-K24656059			OC[C@@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24+,25-/m0/s1	JZSLTRUJUOZFGD-GVAUOCQISA-N	459.215806438							98545
BRD-K50657769	LSM-11511		54639119	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20+,21-/m1/s1	SBFIZHFYYISGJV-TYCQWZJGSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CCNC(=O)c3ccccc3F)O[C@@H]2CO	BroadT	BRD-K50657769	BRD-K50657769-001-01-0	Broad Institute of MIT and Harvard	BRD-K50657769			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCNC(=O)c2ccccc2F)O[C@@H]1CO	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20+,21-/m1/s1	SBFIZHFYYISGJV-TYCQWZJGSA-N	450.162470874							100132
BRD-K82399474	LSM-13463		54639064	InChI=1S/C28H28N2O5/c31-19-26-25(30-28(33)21-7-3-1-4-8-21)16-15-24(35-26)17-27(32)29-18-20-11-13-23(14-12-20)34-22-9-5-2-6-10-22/h1-16,24-26,31H,17-19H2,(H,29,32)(H,30,33)/t24-,25-,26+/m0/s1	KKHGDJJULHRULI-KKUQBAQOSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C=C[C@@H]1NC(=O)c4ccccc4	BroadT	BRD-K82399474	BRD-K82399474-001-01-7	Broad Institute of MIT and Harvard	BRD-K82399474			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C=C[C@@H]1NC(=O)c1ccccc1	InChI=1S/C28H28N2O5/c31-19-26-25(30-28(33)21-7-3-1-4-8-21)16-15-24(35-26)17-27(32)29-18-20-11-13-23(14-12-20)34-22-9-5-2-6-10-22/h1-16,24-26,31H,17-19H2,(H,29,32)(H,30,33)/t24-,25-,26+/m0/s1	KKHGDJJULHRULI-KKUQBAQOSA-N	472.199822016							102103
BRD-K44801029	LSM-11155		54638932	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19-,20-/m1/s1	IBEFNTNFDPOULD-CDHQVMDDSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K44801029	BRD-K44801029-001-01-9	Broad Institute of MIT and Harvard	BRD-K44801029			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19-,20-/m1/s1	IBEFNTNFDPOULD-CDHQVMDDSA-N	504.068876166							99776
BRD-K90505752	LSM-14002		54639003	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18+,19+/m0/s1	JNXYUDJSGYXBCY-QXAKKESOSA-N	OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K90505752	BRD-K90505752-001-01-2	Broad Institute of MIT and Harvard	BRD-K90505752			OC[C@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18+,19+/m0/s1	JNXYUDJSGYXBCY-QXAKKESOSA-N	459.1839346							102655
BRD-K95041551	LSM-14254		54638892	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19-,20-/m0/s1	YSDDRAAKFDNITG-LDTOTXGLSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)c2cccnc2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K95041551	BRD-K95041551-001-01-6	Broad Institute of MIT and Harvard	BRD-K95041551			C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)c2cccnc2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19-,20-/m0/s1	YSDDRAAKFDNITG-LDTOTXGLSA-N	397.200156374							102908
BRD-K62917551	LSM-12252		54638885	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19-,20+/m0/s1	NMMAJMJUDCVZMW-SLFFLAALSA-N	Cc1ccccc1S(=O)(=O)NCC[C@@H]2CC[C@H](NS(=O)(=O)c3ccccc3C)[C@@H](CO)O2	BroadT	BRD-K62917551	BRD-K62917551-001-01-6	Broad Institute of MIT and Harvard	BRD-K62917551			Cc1ccccc1S(=O)(=O)NCC[C@@H]1CC[C@H](NS(=O)(=O)c2ccccc2C)[C@@H](CO)O1	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19-,20+/m0/s1	NMMAJMJUDCVZMW-SLFFLAALSA-N	482.15452808							100878
BRD-K06155953	LSM-8784		54638968	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19+,20-/m1/s1	ONEMPWMAPHHZJV-LSTHTHJFSA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)Nc3ccc(Cl)c(Cl)c3	BroadT	BRD-K06155953	BRD-K06155953-001-01-6	Broad Institute of MIT and Harvard	BRD-K06155953			OC[C@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19+,20-/m1/s1	ONEMPWMAPHHZJV-LSTHTHJFSA-N	483.112789898							97405
BRD-K92036763	LSM-14084		54638924	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10+,11+/m1/s1	RKCCKXKETMZMSY-VWYCJHECSA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CCN)O[C@H]1CO	BroadT	BRD-K92036763	BRD-K92036763-001-01-3	Broad Institute of MIT and Harvard	BRD-K92036763			CC(C)NC(=O)N[C@H]1CC[C@H](CCN)O[C@H]1CO	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10+,11+/m1/s1	RKCCKXKETMZMSY-VWYCJHECSA-N	259.18959169							102738
BRD-K44029853	LSM-11119		54639071	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13-,14-/m0/s1	BHRCWANBCSKYFS-IHRRRGAJSA-N	COCC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K44029853	BRD-K44029853-001-01-8	Broad Institute of MIT and Harvard	BRD-K44029853			COCC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13-,14-/m0/s1	BHRCWANBCSKYFS-IHRRRGAJSA-N	326.184171952							99740
BRD-K19752742	LSM-9623		54638914	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17+,19-/m0/s1	VBSGUKREVIUPDG-WDYCEAGBSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K19752742	BRD-K19752742-001-01-1	Broad Institute of MIT and Harvard	BRD-K19752742			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17+,19-/m0/s1	VBSGUKREVIUPDG-WDYCEAGBSA-N	453.112519298							98244
BRD-K34324287	LSM-10495		54639035	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20+,21+/m1/s1	VUOOERVJSWLFKU-GIVPXCGWSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NCCN3CCCCC3)O[C@H]2CO	BroadT	BRD-K34324287	BRD-K34324287-001-01-1	Broad Institute of MIT and Harvard	BRD-K34324287			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20+,21+/m1/s1	VUOOERVJSWLFKU-GIVPXCGWSA-N	451.214091876							99116
BRD-K73061717	LSM-12900		54639031	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22-,23-/m0/s1	QIJBHKKZJCMHEO-VABKMULXSA-N	OC[C@@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)Nc4cccc(Cl)c4	BroadT	BRD-K73061717	BRD-K73061717-001-01-1	Broad Institute of MIT and Harvard	BRD-K73061717			OC[C@@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22-,23-/m0/s1	QIJBHKKZJCMHEO-VABKMULXSA-N	469.188067516							101537
BRD-K28421747	LSM-10147		54639007	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18+,19-/m1/s1	JNXYUDJSGYXBCY-NZSAHSFTSA-N	OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K28421747	BRD-K28421747-001-01-7	Broad Institute of MIT and Harvard	BRD-K28421747			OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18+,19-/m1/s1	JNXYUDJSGYXBCY-NZSAHSFTSA-N	459.1839346							98768
BRD-K59183712	LSM-12004		54638903	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20-/m1/s1	YSDDRAAKFDNITG-GEALJGNFSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K59183712	BRD-K59183712-001-01-6	Broad Institute of MIT and Harvard	BRD-K59183712			C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20-/m1/s1	YSDDRAAKFDNITG-GEALJGNFSA-N	397.200156374							100630
BRD-K62531236-001-01-8	LSM-34578	BRD-K62531236	54638870	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16-,17+/m0/s1	CARWJPWJJJMDHW-YESZJQIVSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K62531236	BRD-K62531236-001-01-8	Broad Institute of MIT and Harvard	BRD-K62531236			OC[C@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16-,17+/m0/s1	CARWJPWJJJMDHW-YESZJQIVSA-N	383.242021186							123136
BRD-K92951265	LSM-14128		54638909	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17-,19+/m0/s1	VBSGUKREVIUPDG-VDZJLULYSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K92951265	BRD-K92951265-001-01-6	Broad Institute of MIT and Harvard	BRD-K92951265			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17-,19+/m0/s1	VBSGUKREVIUPDG-VDZJLULYSA-N	453.112519298							102782
BRD-K60201835-001-01-5	LSM-34579	BRD-K60201835	54638847	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20+/m1/s1	ABKGFAHRWOKBSI-UXPWSPDFSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K60201835	BRD-K60201835-001-01-5	Broad Institute of MIT and Harvard	BRD-K60201835			OC[C@@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20+/m1/s1	ABKGFAHRWOKBSI-UXPWSPDFSA-N	421.237684734							123137
BRD-K70766049	LSM-12745		54638946	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22+/m0/s1	HKZRXKNGDCOEMV-TUNNFDKTSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3ccccc3)CC[C@H]1NC(=O)Cc4ccccn4	BroadT	BRD-K70766049	BRD-K70766049-001-01-7	Broad Institute of MIT and Harvard	BRD-K70766049			OC[C@H]1O[C@H](CCn2cc(nn2)-c2ccccc2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22+/m0/s1	HKZRXKNGDCOEMV-TUNNFDKTSA-N	421.211389774							101382
BRD-K45358679	LSM-11191		54638952	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22-/m1/s1	HKZRXKNGDCOEMV-RZUBCFFCSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3ccccc3)CC[C@@H]1NC(=O)Cc4ccccn4	BroadT	BRD-K45358679	BRD-K45358679-001-01-2	Broad Institute of MIT and Harvard	BRD-K45358679			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20+,22-/m1/s1	HKZRXKNGDCOEMV-RZUBCFFCSA-N	421.211389774							99812
BRD-K05481476-001-01-5	LSM-34580	BRD-K05481476	54638848	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20+/m1/s1	ABKGFAHRWOKBSI-AHRSYUTCSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K05481476	BRD-K05481476-001-01-5	Broad Institute of MIT and Harvard	BRD-K05481476			OC[C@@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20+/m1/s1	ABKGFAHRWOKBSI-AHRSYUTCSA-N	421.237684734							123138
BRD-K93763482	LSM-14184		54638893	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20+/m0/s1	YSDDRAAKFDNITG-KCUHQSDYSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K93763482	BRD-K93763482-001-01-1	Broad Institute of MIT and Harvard	BRD-K93763482			C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20+/m0/s1	YSDDRAAKFDNITG-KCUHQSDYSA-N	397.200156374							102838
BRD-K71035792	LSM-12764		54639052	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18-,19-/m1/s1	FGKXCNJDDMNFOM-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@H]1NS(=O)(=O)Cc3ccccc3	BroadT	BRD-K71035792	BRD-K71035792-001-01-5	Broad Institute of MIT and Harvard	BRD-K71035792			OC[C@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@H]1NS(=O)(=O)Cc1ccccc1	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18-,19-/m1/s1	FGKXCNJDDMNFOM-GUDVDZBRSA-N	410.18754277							101401
BRD-K98830854	LSM-14493		54638989	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20+/m1/s1	GUCCOCGWZUYAMY-AABGKKOBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K98830854	BRD-K98830854-001-01-3	Broad Institute of MIT and Harvard	BRD-K98830854			OC[C@@H]1O[C@@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20+/m1/s1	GUCCOCGWZUYAMY-AABGKKOBSA-N	412.211055416							103148
BRD-K83546471	LSM-13537		54639146	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21-,22-/m0/s1	BQXPJFPCKYJDQK-FKBYEOEOSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@@H]1NC(=O)c4ccncc4	BroadT	BRD-K83546471	BRD-K83546471-001-01-5	Broad Institute of MIT and Harvard	BRD-K83546471			OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@@H]1NC(=O)c1ccncc1	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21-,22-/m0/s1	BQXPJFPCKYJDQK-FKBYEOEOSA-N	436.211055416							102179
BRD-K54792609	LSM-11752		54639047	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16-,17+/m1/s1	QHWKOKDSIMAAGX-ZACQAIPSSA-N	COc1cccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)C)[C@H](CO)O2)c1	BroadT	BRD-K54792609	BRD-K54792609-001-01-5	Broad Institute of MIT and Harvard	BRD-K54792609			COc1cccc(CNC(=O)C[C@H]2CC[C@@H](NC(C)=O)[C@H](CO)O2)c1	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16-,17+/m1/s1	QHWKOKDSIMAAGX-ZACQAIPSSA-N	350.184171952							100377
BRD-K96977391	LSM-14383		54639130	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22-,23-/m1/s1	YSHLOQAWMNLOEI-YMPZKCBVSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2CO	BroadT	BRD-K96977391	BRD-K96977391-001-01-4	Broad Institute of MIT and Harvard	BRD-K96977391			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)N2CCc3ccccc3C2)O[C@@H]1CO	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22-,23-/m1/s1	YSHLOQAWMNLOEI-YMPZKCBVSA-N	458.18754277							103037
BRD-K29567467	LSM-10221		54638915	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16+,19+/m0/s1	HBSXUOUHADHDTK-ZSZQSSIHSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3CC3)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K29567467	BRD-K29567467-001-01-4	Broad Institute of MIT and Harvard	BRD-K29567467			OC[C@H]1O[C@H](CCn2cc(nn2)C2CC2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16+,19+/m0/s1	HBSXUOUHADHDTK-ZSZQSSIHSA-N	421.19254611							98842
BRD-K25234731	LSM-9962		54638896	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19+,20+/m0/s1	YSDDRAAKFDNITG-YGWPLHOASA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K25234731	BRD-K25234731-001-01-5	Broad Institute of MIT and Harvard	BRD-K25234731			C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19+,20+/m0/s1	YSDDRAAKFDNITG-YGWPLHOASA-N	397.200156374							98583
BRD-K40892926	LSM-10918		54639155	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17-,19-/m1/s1	JKKDNXFJBMMQFP-ZHALLVOQSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c3cnccn3	BroadT	BRD-K40892926	BRD-K40892926-001-01-6	Broad Institute of MIT and Harvard	BRD-K40892926			OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c1cnccn1	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17-,19-/m1/s1	JKKDNXFJBMMQFP-ZHALLVOQSA-N	434.162390662							99539
BRD-K20220643	LSM-9663		54638964	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19-,22+/m1/s1	UDMIDSQAUXVXMN-LRYKZCBQSA-N	C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c4ccccc4	BroadT	BRD-K20220643	BRD-K20220643-001-01-6	Broad Institute of MIT and Harvard	BRD-K20220643			C[C@@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c1ccccc1	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19-,22+/m1/s1	UDMIDSQAUXVXMN-LRYKZCBQSA-N	453.189985614							98284
BRD-K32453902	LSM-10399		54639001	InChI=1S/C23H34N4O5S/c1-31-21-9-5-6-10-23(21)33(29,30)25-19-12-11-18(32-22(19)16-28)13-14-27-15-20(24-26-27)17-7-3-2-4-8-17/h5-6,9-10,15,17-19,22,25,28H,2-4,7-8,11-14,16H2,1H3/t18-,19+,22-/m1/s1	HBWIVVUPODMQBV-XQBPLPMBSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@H](CCn3cc(nn3)C4CCCCC4)O[C@@H]2CO	BroadT	BRD-K32453902	BRD-K32453902-001-01-5	Broad Institute of MIT and Harvard	BRD-K32453902			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@H](CCn2cc(nn2)C2CCCCC2)O[C@@H]1CO	InChI=1S/C23H34N4O5S/c1-31-21-9-5-6-10-23(21)33(29,30)25-19-12-11-18(32-22(19)16-28)13-14-27-15-20(24-26-27)17-7-3-2-4-8-17/h5-6,9-10,15,17-19,22,25,28H,2-4,7-8,11-14,16H2,1H3/t18-,19+,22-/m1/s1	HBWIVVUPODMQBV-XQBPLPMBSA-N	478.224990918							99020
BRD-K01979737	LSM-8553		54639106	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18-/m0/s1	OPNJNCHASNUPJL-KSZLIROESA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)NC3CCC3)O[C@H]2CO)cc1	BroadT	BRD-K01979737	BRD-K01979737-001-01-7	Broad Institute of MIT and Harvard	BRD-K01979737			COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)NC3CCC3)O[C@H]2CO)cc1	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18-/m0/s1	OPNJNCHASNUPJL-KSZLIROESA-N	391.210721058							97174
BRD-K40478655	LSM-10898		54638910	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17-,19+/m1/s1	VBSGUKREVIUPDG-SUMDDJOVSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K40478655	BRD-K40478655-001-01-1	Broad Institute of MIT and Harvard	BRD-K40478655			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17-,19+/m1/s1	VBSGUKREVIUPDG-SUMDDJOVSA-N	453.112519298							99519
BRD-K22109269	LSM-9767		54638883	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19+,20+/m0/s1	NMMAJMJUDCVZMW-XUVXKRRUSA-N	Cc1ccccc1S(=O)(=O)NCC[C@@H]2CC[C@@H](NS(=O)(=O)c3ccccc3C)[C@@H](CO)O2	BroadT	BRD-K22109269	BRD-K22109269-001-01-2	Broad Institute of MIT and Harvard	BRD-K22109269			Cc1ccccc1S(=O)(=O)NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2ccccc2C)[C@@H](CO)O1	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19+,20+/m0/s1	NMMAJMJUDCVZMW-XUVXKRRUSA-N	482.15452808							98388
BRD-K74511610	LSM-12990		54638874	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16-,17-/m0/s1	CARWJPWJJJMDHW-ULQDDVLXSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K74511610	BRD-K74511610-001-01-2	Broad Institute of MIT and Harvard	BRD-K74511610			OC[C@@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16-,17-/m0/s1	CARWJPWJJJMDHW-ULQDDVLXSA-N	383.242021186							101627
BRD-K06163447	LSM-8787		54639114	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20+,21+/m1/s1	SBFIZHFYYISGJV-CZAAIQMYSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CCNC(=O)c3ccccc3F)O[C@H]2CO	BroadT	BRD-K06163447	BRD-K06163447-001-01-4	Broad Institute of MIT and Harvard	BRD-K06163447			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCNC(=O)c2ccccc2F)O[C@H]1CO	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20+,21+/m1/s1	SBFIZHFYYISGJV-CZAAIQMYSA-N	450.162470874							97408
BRD-K09397553	LSM-8995		54638851	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20+/m0/s1	ABKGFAHRWOKBSI-FFZOFVMBSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K09397553	BRD-K09397553-001-01-5	Broad Institute of MIT and Harvard	BRD-K09397553			OC[C@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20+/m0/s1	ABKGFAHRWOKBSI-FFZOFVMBSA-N	421.237684734							97616
BRD-K85806228	LSM-13688		54638948	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22-/m1/s1	HKZRXKNGDCOEMV-KCZVDYSFSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)c3ccccc3)CC[C@H]1NC(=O)Cc4ccccn4	BroadT	BRD-K85806228	BRD-K85806228-001-01-7	Broad Institute of MIT and Harvard	BRD-K85806228			OC[C@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22-/m1/s1	HKZRXKNGDCOEMV-KCZVDYSFSA-N	421.211389774							102336
BRD-K87517219	LSM-13796		54638852	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20-/m1/s1	ABKGFAHRWOKBSI-LSTHTHJFSA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K87517219	BRD-K87517219-001-01-9	Broad Institute of MIT and Harvard	BRD-K87517219			OC[C@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20-/m1/s1	ABKGFAHRWOKBSI-LSTHTHJFSA-N	421.237684734							102445
BRD-K62130095	LSM-12200		54639074	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13+,14-/m1/s1	BHRCWANBCSKYFS-HZSPNIEDSA-N	COCC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K62130095	BRD-K62130095-001-01-9	Broad Institute of MIT and Harvard	BRD-K62130095			COCC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13+,14-/m1/s1	BHRCWANBCSKYFS-HZSPNIEDSA-N	326.184171952							100826
BRD-K08731287	LSM-8958		54639026	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22+,23+/m0/s1	QIJBHKKZJCMHEO-YTFSRNRJSA-N	OC[C@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)Nc4cccc(Cl)c4	BroadT	BRD-K08731287	BRD-K08731287-001-01-9	Broad Institute of MIT and Harvard	BRD-K08731287			OC[C@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22+,23+/m0/s1	QIJBHKKZJCMHEO-YTFSRNRJSA-N	469.188067516							97579
BRD-K61649900	LSM-12166		54639069	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13+,14+/m1/s1	BHRCWANBCSKYFS-RDBSUJKOSA-N	COCC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K61649900	BRD-K61649900-001-01-4	Broad Institute of MIT and Harvard	BRD-K61649900			COCC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13+,14+/m1/s1	BHRCWANBCSKYFS-RDBSUJKOSA-N	326.184171952							100792
BRD-K10927790	LSM-9096		54639085	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25+,26+/m1/s1	HBACCIGQRKGJSE-ZNZIZOMTSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K10927790	BRD-K10927790-001-01-9	Broad Institute of MIT and Harvard	BRD-K10927790			OC[C@@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25+,26+/m1/s1	HBACCIGQRKGJSE-ZNZIZOMTSA-N	485.325356886							97717
BRD-K96660315	LSM-14364		54639150	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21+,22-/m0/s1	BQXPJFPCKYJDQK-BDTNDASRSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@H]1NC(=O)c4ccncc4	BroadT	BRD-K96660315	BRD-K96660315-001-01-9	Broad Institute of MIT and Harvard	BRD-K96660315			OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@H]1NC(=O)c1ccncc1	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21+,22-/m0/s1	BQXPJFPCKYJDQK-BDTNDASRSA-N	436.211055416							103018
BRD-K14654869	LSM-9317		54639051	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18+,19+/m1/s1	FGKXCNJDDMNFOM-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@@H]1NS(=O)(=O)Cc3ccccc3	BroadT	BRD-K14654869	BRD-K14654869-001-01-1	Broad Institute of MIT and Harvard	BRD-K14654869			OC[C@@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@@H]1NS(=O)(=O)Cc1ccccc1	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18+,19+/m1/s1	FGKXCNJDDMNFOM-QYZOEREBSA-N	410.18754277							97938
BRD-K10134498	LSM-9047		54638933	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19-,20-/m0/s1	IBEFNTNFDPOULD-YSSFQJQWSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K10134498	BRD-K10134498-001-01-7	Broad Institute of MIT and Harvard	BRD-K10134498			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19-,20-/m0/s1	IBEFNTNFDPOULD-YSSFQJQWSA-N	504.068876166							97668
BRD-K13539834	LSM-9241		54639070	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13-,14-/m1/s1	BHRCWANBCSKYFS-MGPQQGTHSA-N	COCC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K13539834	BRD-K13539834-001-01-7	Broad Institute of MIT and Harvard	BRD-K13539834			COCC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13-,14-/m1/s1	BHRCWANBCSKYFS-MGPQQGTHSA-N	326.184171952							97862
BRD-K04937680	LSM-8730		54639135	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22+,23-/m0/s1	YSHLOQAWMNLOEI-WWNPGLIZSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2CO	BroadT	BRD-K04937680	BRD-K04937680-001-01-9	Broad Institute of MIT and Harvard	BRD-K04937680			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCc3ccccc3C2)O[C@H]1CO	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22+,23-/m0/s1	YSHLOQAWMNLOEI-WWNPGLIZSA-N	458.18754277							97351
BRD-K02545368	LSM-8596		54638911	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17+,19-/m1/s1	VBSGUKREVIUPDG-HHXXYDBFSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K02545368	BRD-K02545368-001-01-1	Broad Institute of MIT and Harvard	BRD-K02545368			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17+,19-/m1/s1	VBSGUKREVIUPDG-HHXXYDBFSA-N	453.112519298							97217
BRD-K07601300	LSM-8884		54639148	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21-,22+/m1/s1	BQXPJFPCKYJDQK-VSKRKVRLSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@H]1NC(=O)c4ccncc4	BroadT	BRD-K07601300	BRD-K07601300-001-01-8	Broad Institute of MIT and Harvard	BRD-K07601300			OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@H]1NC(=O)c1ccncc1	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21-,22+/m1/s1	BQXPJFPCKYJDQK-VSKRKVRLSA-N	436.211055416							97505
BRD-K31462841	LSM-10335		54639102	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18-/m1/s1	OPNJNCHASNUPJL-KZNAEPCWSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)NC3CCC3)O[C@@H]2CO)cc1	BroadT	BRD-K31462841	BRD-K31462841-001-01-1	Broad Institute of MIT and Harvard	BRD-K31462841			COc1ccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)NC3CCC3)O[C@@H]2CO)cc1	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18-/m1/s1	OPNJNCHASNUPJL-KZNAEPCWSA-N	391.210721058							98956
BRD-K31774852	LSM-10354		54639103	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18-/m0/s1	OPNJNCHASNUPJL-BZSNNMDCSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)NC3CCC3)O[C@H]2CO)cc1	BroadT	BRD-K31774852	BRD-K31774852-001-01-5	Broad Institute of MIT and Harvard	BRD-K31774852			COc1ccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)NC3CCC3)O[C@H]2CO)cc1	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18-/m0/s1	OPNJNCHASNUPJL-BZSNNMDCSA-N	391.210721058							98975
BRD-K83325143	LSM-13519		54639094	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15-,19+/m1/s1	OAEJMSHQDKFBTQ-CLCXKQKWSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K83325143	BRD-K83325143-001-01-2	Broad Institute of MIT and Harvard	BRD-K83325143			OC[C@@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15-,19+/m1/s1	OAEJMSHQDKFBTQ-CLCXKQKWSA-N	428.169584528							102160
BRD-K25165092	LSM-9960		54639091	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25+,26-/m0/s1	HBACCIGQRKGJSE-NXCFDTQHSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K25165092	BRD-K25165092-001-01-4	Broad Institute of MIT and Harvard	BRD-K25165092			OC[C@@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25+,26-/m0/s1	HBACCIGQRKGJSE-NXCFDTQHSA-N	485.325356886							98581
BRD-K27483344	LSM-10087		54638862	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18-,20+/m1/s1	OLUPXTRBOWIZHH-POAQFYNOSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)C4(O)CCCC4)O[C@H]2CO	BroadT	BRD-K27483344	BRD-K27483344-001-01-5	Broad Institute of MIT and Harvard	BRD-K27483344			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)C2(O)CCCC2)O[C@H]1CO	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18-,20+/m1/s1	OLUPXTRBOWIZHH-POAQFYNOSA-N	459.248169206							98708
BRD-K89062214	LSM-13908		54638899	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20+/m0/s1	YSDDRAAKFDNITG-MVJPYGJCSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K89062214	BRD-K89062214-001-01-9	Broad Institute of MIT and Harvard	BRD-K89062214			C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20+/m0/s1	YSDDRAAKFDNITG-MVJPYGJCSA-N	397.200156374							102561
BRD-K63269129	LSM-12276		54638979	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19-,21-/m0/s1	XDPGLRIFEVLTPI-LRQRDZAKSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CCNS(=O)(=O)c3ccccc3)O[C@H]2CO	BroadT	BRD-K63269129	BRD-K63269129-001-01-4	Broad Institute of MIT and Harvard	BRD-K63269129			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CCNS(=O)(=O)c2ccccc2)O[C@H]1CO	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19-,21-/m0/s1	XDPGLRIFEVLTPI-LRQRDZAKSA-N	463.177706368							100902
BRD-K97440159	LSM-14416		54638900	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19+,20-/m1/s1	YSDDRAAKFDNITG-XFWGSAIBSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K97440159	BRD-K97440159-001-01-4	Broad Institute of MIT and Harvard	BRD-K97440159			C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19+,20-/m1/s1	YSDDRAAKFDNITG-XFWGSAIBSA-N	397.200156374							103071
BRD-K59598504	LSM-12029		54639124	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17-,18-/m0/s1	BAJOMULNWMTCGT-SZMVWBNQSA-N	CN1CCN(CC1)C(=O)C[C@H]2O[C@@H](CO)[C@@H](NS(=O)(=O)c3cccc(F)c3)C=C2	BroadT	BRD-K59598504	BRD-K59598504-001-01-7	Broad Institute of MIT and Harvard	BRD-K59598504			CN1CCN(CC1)C(=O)C[C@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17-,18-/m0/s1	BAJOMULNWMTCGT-SZMVWBNQSA-N	427.157719852							100655
BRD-K76896049	LSM-13135		54639065	InChI=1S/C28H28N2O5/c31-19-26-25(30-28(33)21-7-3-1-4-8-21)16-15-24(35-26)17-27(32)29-18-20-11-13-23(14-12-20)34-22-9-5-2-6-10-22/h1-16,24-26,31H,17-19H2,(H,29,32)(H,30,33)/t24-,25-,26+/m1/s1	KKHGDJJULHRULI-CYXNTTPDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C=C[C@H]1NC(=O)c4ccccc4	BroadT	BRD-K76896049	BRD-K76896049-001-01-6	Broad Institute of MIT and Harvard	BRD-K76896049			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C=C[C@H]1NC(=O)c1ccccc1	InChI=1S/C28H28N2O5/c31-19-26-25(30-28(33)21-7-3-1-4-8-21)16-15-24(35-26)17-27(32)29-18-20-11-13-23(14-12-20)34-22-9-5-2-6-10-22/h1-16,24-26,31H,17-19H2,(H,29,32)(H,30,33)/t24-,25-,26+/m1/s1	KKHGDJJULHRULI-CYXNTTPDSA-N	472.199822016							101773
BRD-K44547539	LSM-11138		54638977	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19+,21-/m1/s1	XDPGLRIFEVLTPI-LKUPVBHCSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CCNS(=O)(=O)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K44547539	BRD-K44547539-001-01-1	Broad Institute of MIT and Harvard	BRD-K44547539			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CCNS(=O)(=O)c2ccccc2)O[C@@H]1CO	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19+,21-/m1/s1	XDPGLRIFEVLTPI-LKUPVBHCSA-N	463.177706368							99759
BRD-K35035541	LSM-10534		54638922	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16+,19-/m0/s1	HBSXUOUHADHDTK-GMBSWORKSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3CC3)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K35035541	BRD-K35035541-001-01-4	Broad Institute of MIT and Harvard	BRD-K35035541			OC[C@@H]1O[C@H](CCn2cc(nn2)C2CC2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16+,19-/m0/s1	HBSXUOUHADHDTK-GMBSWORKSA-N	421.19254611							99155
BRD-K75938736	LSM-13072		54638962	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22-/m1/s1	UDMIDSQAUXVXMN-HCBXPFHNSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c4ccccc4	BroadT	BRD-K75938736	BRD-K75938736-001-01-5	Broad Institute of MIT and Harvard	BRD-K75938736			C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c1ccccc1	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22-/m1/s1	UDMIDSQAUXVXMN-HCBXPFHNSA-N	453.189985614							101709
BRD-K37106459	LSM-10672		54639129	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22+,23+/m1/s1	YSHLOQAWMNLOEI-PUHATCMVSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2CO	BroadT	BRD-K37106459	BRD-K37106459-001-01-1	Broad Institute of MIT and Harvard	BRD-K37106459			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)N2CCc3ccccc3C2)O[C@H]1CO	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22+,23+/m1/s1	YSHLOQAWMNLOEI-PUHATCMVSA-N	458.18754277							99293
BRD-K66910993	LSM-12505		54638897	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19+,20+/m1/s1	YSDDRAAKFDNITG-TTYHFUOFSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)c2cccnc2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K66910993	BRD-K66910993-001-01-3	Broad Institute of MIT and Harvard	BRD-K66910993			C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)c2cccnc2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19+,20+/m1/s1	YSDDRAAKFDNITG-TTYHFUOFSA-N	397.200156374							101136
BRD-K42960483	LSM-11038		54638985	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18-,19+/m0/s1	DCVAKYLGJMAIQD-GBESFXJTSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K42960483	BRD-K42960483-001-01-4	Broad Institute of MIT and Harvard	BRD-K42960483			OC[C@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18-,19+/m0/s1	DCVAKYLGJMAIQD-GBESFXJTSA-N	407.22203467							99659
BRD-K53421673	LSM-11688		54639066	InChI=1S/C28H28N2O5/c31-19-26-25(30-28(33)21-7-3-1-4-8-21)16-15-24(35-26)17-27(32)29-18-20-11-13-23(14-12-20)34-22-9-5-2-6-10-22/h1-16,24-26,31H,17-19H2,(H,29,32)(H,30,33)/t24-,25+,26-/m1/s1	KKHGDJJULHRULI-UODIDJSMSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C=C[C@@H]1NC(=O)c4ccccc4	BroadT	BRD-K53421673	BRD-K53421673-001-01-3	Broad Institute of MIT and Harvard	BRD-K53421673			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C=C[C@@H]1NC(=O)c1ccccc1	InChI=1S/C28H28N2O5/c31-19-26-25(30-28(33)21-7-3-1-4-8-21)16-15-24(35-26)17-27(32)29-18-20-11-13-23(14-12-20)34-22-9-5-2-6-10-22/h1-16,24-26,31H,17-19H2,(H,29,32)(H,30,33)/t24-,25+,26-/m1/s1	KKHGDJJULHRULI-UODIDJSMSA-N	472.199822016							100313
BRD-K23876588	LSM-9870		54638929	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10+,11-/m0/s1	RKCCKXKETMZMSY-AXFHLTTASA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CCN)O[C@H]1CO	BroadT	BRD-K23876588	BRD-K23876588-001-01-9	Broad Institute of MIT and Harvard	BRD-K23876588			CC(C)NC(=O)N[C@@H]1CC[C@@H](CCN)O[C@H]1CO	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10+,11-/m0/s1	RKCCKXKETMZMSY-AXFHLTTASA-N	259.18959169							98491
BRD-K77053153	LSM-13141		54639118	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20-,21-/m0/s1	SBFIZHFYYISGJV-NDXORKPFSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2CC[C@@H](CCNC(=O)c3ccccc3F)O[C@H]2CO	BroadT	BRD-K77053153	BRD-K77053153-001-01-5	Broad Institute of MIT and Harvard	BRD-K77053153			Cc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@@H](CCNC(=O)c2ccccc2F)O[C@H]1CO	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20-,21-/m0/s1	SBFIZHFYYISGJV-NDXORKPFSA-N	450.162470874							101779
BRD-K04395157	LSM-8698		54639093	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15+,19+/m1/s1	OAEJMSHQDKFBTQ-VCBZYWHSSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K04395157	BRD-K04395157-001-01-4	Broad Institute of MIT and Harvard	BRD-K04395157			OC[C@@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15+,19+/m1/s1	OAEJMSHQDKFBTQ-VCBZYWHSSA-N	428.169584528							97319
BRD-K24742410	LSM-9929		54639149	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21+,22-/m1/s1	BQXPJFPCKYJDQK-BHIFYINESA-N	OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@@H]1NC(=O)c4ccncc4	BroadT	BRD-K24742410	BRD-K24742410-001-01-6	Broad Institute of MIT and Harvard	BRD-K24742410			OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@@H]1NC(=O)c1ccncc1	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21+,22-/m1/s1	BQXPJFPCKYJDQK-BHIFYINESA-N	436.211055416							98550
BRD-K80893668	LSM-13380		54638942	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13-,14+/m0/s1	RGLUKSSVDYQFDC-MELADBBJSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCC2)C=C[C@@H]1NC(=O)C3CC3	BroadT	BRD-K80893668	BRD-K80893668-001-01-7	Broad Institute of MIT and Harvard	BRD-K80893668			OC[C@H]1O[C@H](CC(=O)NC2CCC2)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13-,14+/m0/s1	RGLUKSSVDYQFDC-MELADBBJSA-N	308.173607268							102019
BRD-K96431673	LSM-14343		54639024	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16+,19-/m1/s1	OCHDOPTVTSINTO-JTDSTZFVSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@H](NC(=O)c3ccc4OCOc4c3)[C@@H](CO)O2	BroadT	BRD-K96431673	BRD-K96431673-001-01-1	Broad Institute of MIT and Harvard	BRD-K96431673			CN1CCN(CC1)C(=O)C[C@H]1CC[C@H](NC(=O)c2ccc3OCOc3c2)[C@@H](CO)O1	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16+,19-/m1/s1	OCHDOPTVTSINTO-JTDSTZFVSA-N	419.205635678							102997
BRD-K82925070	LSM-13493		54639006	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18-,19+/m1/s1	JNXYUDJSGYXBCY-QRQLOZEOSA-N	OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K82925070	BRD-K82925070-001-01-7	Broad Institute of MIT and Harvard	BRD-K82925070			OC[C@@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18-,19+/m1/s1	JNXYUDJSGYXBCY-QRQLOZEOSA-N	459.1839346							102134
BRD-K77221189	LSM-13149		54638901	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19+,20-/m0/s1	YSDDRAAKFDNITG-OBZTUIKSSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)c2cccnc2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K77221189	BRD-K77221189-001-01-6	Broad Institute of MIT and Harvard	BRD-K77221189			C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)c2cccnc2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19+,20-/m0/s1	YSDDRAAKFDNITG-OBZTUIKSSA-N	397.200156374							101787
BRD-K26127000	LSM-10011		54639125	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17-,18+/m1/s1	BAJOMULNWMTCGT-NXHRZFHOSA-N	CN1CCN(CC1)C(=O)C[C@@H]2O[C@@H](CO)[C@H](NS(=O)(=O)c3cccc(F)c3)C=C2	BroadT	BRD-K26127000	BRD-K26127000-001-01-4	Broad Institute of MIT and Harvard	BRD-K26127000			CN1CCN(CC1)C(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17-,18+/m1/s1	BAJOMULNWMTCGT-NXHRZFHOSA-N	427.157719852							98632
BRD-K25955619	LSM-10000		54639138	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24-,25-/m1/s1	JZSLTRUJUOZFGD-UBFVSLLYSA-N	OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K25955619	BRD-K25955619-001-01-2	Broad Institute of MIT and Harvard	BRD-K25955619			OC[C@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24-,25-/m1/s1	JZSLTRUJUOZFGD-UBFVSLLYSA-N	459.215806438							98621
BRD-K63211622	LSM-12273		54638975	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19-,21+/m0/s1	XDPGLRIFEVLTPI-NBHGPNQESA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CCNS(=O)(=O)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K63211622	BRD-K63211622-001-01-8	Broad Institute of MIT and Harvard	BRD-K63211622			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CCNS(=O)(=O)c2ccccc2)O[C@@H]1CO	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19-,21+/m0/s1	XDPGLRIFEVLTPI-NBHGPNQESA-N	463.177706368							100899
BRD-K74140407	LSM-12966		54638951	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22+/m0/s1	HKZRXKNGDCOEMV-JAXLGGSGSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)c3ccccc3)CC[C@@H]1NC(=O)Cc4ccccn4	BroadT	BRD-K74140407	BRD-K74140407-001-01-7	Broad Institute of MIT and Harvard	BRD-K74140407			OC[C@H]1O[C@H](CCn2cc(nn2)-c2ccccc2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22+/m0/s1	HKZRXKNGDCOEMV-JAXLGGSGSA-N	421.211389774							101603
CHEMBL2355783	LSM-9185	SID131435348, BRD-K12791594	54639063	InChI=1S/C28H28N2O5/c31-19-26-25(30-28(33)21-7-3-1-4-8-21)16-15-24(35-26)17-27(32)29-18-20-11-13-23(14-12-20)34-22-9-5-2-6-10-22/h1-16,24-26,31H,17-19H2,(H,29,32)(H,30,33)/t24-,25-,26-/m0/s1	KKHGDJJULHRULI-GSDHBNRESA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C=C[C@@H]1NC(=O)c4ccccc4	BroadT	BRD-K12791594	BRD-K12791594-001-01-5	Broad Institute of MIT and Harvard	BRD-K12791594			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C=C[C@@H]1NC(=O)c1ccccc1	InChI=1S/C28H28N2O5/c31-19-26-25(30-28(33)21-7-3-1-4-8-21)16-15-24(35-26)17-27(32)29-18-20-11-13-23(14-12-20)34-22-9-5-2-6-10-22/h1-16,24-26,31H,17-19H2,(H,29,32)(H,30,33)/t24-,25-,26-/m0/s1	KKHGDJJULHRULI-GSDHBNRESA-N	472.199822016							97806
BRD-K91021522	LSM-14032		54639050	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18+,19+/m0/s1	FGKXCNJDDMNFOM-IPMKNSEASA-N	OC[C@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@H]1NS(=O)(=O)Cc3ccccc3	BroadT	BRD-K91021522	BRD-K91021522-001-01-8	Broad Institute of MIT and Harvard	BRD-K91021522			OC[C@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@H]1NS(=O)(=O)Cc1ccccc1	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18+,19+/m0/s1	FGKXCNJDDMNFOM-IPMKNSEASA-N	410.18754277							102685
BRD-K88968415	LSM-13900		54638973	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19+,21+/m0/s1	XDPGLRIFEVLTPI-LDQXTDLNSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CCNS(=O)(=O)c3ccccc3)O[C@@H]2CO	BroadT	BRD-K88968415	BRD-K88968415-001-01-5	Broad Institute of MIT and Harvard	BRD-K88968415			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CCNS(=O)(=O)c2ccccc2)O[C@@H]1CO	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19+,21+/m0/s1	XDPGLRIFEVLTPI-LDQXTDLNSA-N	463.177706368							102553
BRD-K06380464	LSM-8799		54638920	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16-,19-/m0/s1	HBSXUOUHADHDTK-QOKNQOGYSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3CC3)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K06380464	BRD-K06380464-001-01-2	Broad Institute of MIT and Harvard	BRD-K06380464			OC[C@@H]1O[C@H](CCn2cc(nn2)C2CC2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16-,19-/m0/s1	HBSXUOUHADHDTK-QOKNQOGYSA-N	421.19254611							97420
BRD-K79596575	LSM-13289		54639089	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25-,26+/m1/s1	HBACCIGQRKGJSE-CYXNTTPDSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K79596575	BRD-K79596575-001-01-1	Broad Institute of MIT and Harvard	BRD-K79596575			OC[C@@H]1O[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25-,26+/m1/s1	HBACCIGQRKGJSE-CYXNTTPDSA-N	485.325356886							101928
BRD-K82062373	LSM-13440		54638908	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17+,19+/m1/s1	VBSGUKREVIUPDG-AYBZRNKSSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)c3ccccn3	BroadT	BRD-K82062373	BRD-K82062373-001-01-3	Broad Institute of MIT and Harvard	BRD-K82062373			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)c1ccccn1	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17+,19+/m1/s1	VBSGUKREVIUPDG-AYBZRNKSSA-N	453.112519298							102080
BRD-K18947893-001-01-5	LSM-34581	BRD-K18947893	54638869	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16+,17+/m1/s1	CARWJPWJJJMDHW-IKGGRYGDSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K18947893	BRD-K18947893-001-01-5	Broad Institute of MIT and Harvard	BRD-K18947893			OC[C@@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16+,17+/m1/s1	CARWJPWJJJMDHW-IKGGRYGDSA-N	383.242021186							123139
BRD-K18480277	LSM-9542		54638849	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20-/m1/s1	ABKGFAHRWOKBSI-NSISKUIASA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K18480277	BRD-K18480277-001-01-3	Broad Institute of MIT and Harvard	BRD-K18480277			OC[C@H]1O[C@@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19-,20-/m1/s1	ABKGFAHRWOKBSI-NSISKUIASA-N	421.237684734							98163
BRD-K36558227	LSM-10637		54639056	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18+,19-/m1/s1	FGKXCNJDDMNFOM-CEXWTWQISA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@@H]1NS(=O)(=O)Cc3ccccc3	BroadT	BRD-K36558227	BRD-K36558227-001-01-5	Broad Institute of MIT and Harvard	BRD-K36558227			OC[C@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@@H]1NS(=O)(=O)Cc1ccccc1	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18+,19-/m1/s1	FGKXCNJDDMNFOM-CEXWTWQISA-N	410.18754277							99258
BRD-K23301583	LSM-9835		54638921	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16-,19+/m0/s1	HBSXUOUHADHDTK-URLQWDBASA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3CC3)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K23301583	BRD-K23301583-001-01-3	Broad Institute of MIT and Harvard	BRD-K23301583			OC[C@H]1O[C@H](CCn2cc(nn2)C2CC2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16-,19+/m0/s1	HBSXUOUHADHDTK-URLQWDBASA-N	421.19254611							98456
BRD-K26862028	LSM-10057		54638856	InChI=1S/C24H30N4O5S/c1-32-21-9-5-8-19(14-21)23-15-28(27-25-23)13-12-20-10-11-22(24(16-29)33-20)26-34(30,31)17-18-6-3-2-4-7-18/h2-9,14-15,20,22,24,26,29H,10-13,16-17H2,1H3/t20-,22-,24-/m1/s1	LQIYJTVMCFCXBS-KIFXHHALSA-N	COc1cccc(c1)c2cn(CC[C@H]3CC[C@@H](NS(=O)(=O)Cc4ccccc4)[C@@H](CO)O3)nn2	BroadT	BRD-K26862028	BRD-K26862028-001-01-4	Broad Institute of MIT and Harvard	BRD-K26862028			COc1cccc(c1)-c1cn(CC[C@H]2CC[C@@H](NS(=O)(=O)Cc3ccccc3)[C@@H](CO)O2)nn1	InChI=1S/C24H30N4O5S/c1-32-21-9-5-8-19(14-21)23-15-28(27-25-23)13-12-20-10-11-22(24(16-29)33-20)26-34(30,31)17-18-6-3-2-4-7-18/h2-9,14-15,20,22,24,26,29H,10-13,16-17H2,1H3/t20-,22-,24-/m1/s1	LQIYJTVMCFCXBS-KIFXHHALSA-N	486.19369079							98678
BRD-K17742539	LSM-9495		54639099	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15+,19-/m0/s1	OAEJMSHQDKFBTQ-KHYOSLBOSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K17742539	BRD-K17742539-001-01-1	Broad Institute of MIT and Harvard	BRD-K17742539			OC[C@@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15+,19-/m0/s1	OAEJMSHQDKFBTQ-KHYOSLBOSA-N	428.169584528							98116
BRD-K52473019	LSM-11637		54638864	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18-,20-/m0/s1	OLUPXTRBOWIZHH-QRFRQXIXSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)C4(O)CCCC4)O[C@H]2CO	BroadT	BRD-K52473019	BRD-K52473019-001-01-8	Broad Institute of MIT and Harvard	BRD-K52473019			COc1ccccc1NC(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)C2(O)CCCC2)O[C@H]1CO	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18-,20-/m0/s1	OLUPXTRBOWIZHH-QRFRQXIXSA-N	459.248169206							100262
BRD-K93713304	LSM-14177		54638938	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13+,14+/m0/s1	RGLUKSSVDYQFDC-BFHYXJOUSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCC2)C=C[C@H]1NC(=O)C3CC3	BroadT	BRD-K93713304	BRD-K93713304-001-01-2	Broad Institute of MIT and Harvard	BRD-K93713304			OC[C@H]1O[C@H](CC(=O)NC2CCC2)C=C[C@H]1NC(=O)C1CC1	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13+,14+/m0/s1	RGLUKSSVDYQFDC-BFHYXJOUSA-N	308.173607268							102831
BRD-K76285876	LSM-13095		54639079	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18-,20+/m0/s1	ZNMNRMGCWQWZTD-CMKODMSKSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)NCc3cccc(F)c3)O[C@@H]2CO	BroadT	BRD-K76285876	BRD-K76285876-001-01-0	Broad Institute of MIT and Harvard	BRD-K76285876			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)NCc2cccc(F)c2)O[C@@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18-,20+/m0/s1	ZNMNRMGCWQWZTD-CMKODMSKSA-N	466.157385494							101733
BRD-K42256568	LSM-10993		54638927	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10-,11-/m1/s1	RKCCKXKETMZMSY-GMTAPVOTSA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CCN)O[C@@H]1CO	BroadT	BRD-K42256568	BRD-K42256568-001-01-5	Broad Institute of MIT and Harvard	BRD-K42256568			CC(C)NC(=O)N[C@@H]1CC[C@H](CCN)O[C@@H]1CO	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10-,11-/m1/s1	RKCCKXKETMZMSY-GMTAPVOTSA-N	259.18959169							99614
BRD-K95286989	LSM-14270		54639110	InChI=1S/C14H18N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h3-6,10-12,17H,1-2,7-8H2,(H,16,20)(H,18,19)/t10-,11-,12+/m0/s1	PLQUATFCVTZMJC-SDDRHHMPSA-N	OC[C@H]1O[C@H](CC(=O)O)CC[C@@H]1NC(=O)c2ccncc2	BroadT	BRD-K95286989	BRD-K95286989-001-01-9	Broad Institute of MIT and Harvard	BRD-K95286989			OC[C@H]1O[C@H](CC(O)=O)CC[C@@H]1NC(=O)c1ccncc1	InChI=1S/C14H18N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h3-6,10-12,17H,1-2,7-8H2,(H,16,20)(H,18,19)/t10-,11-,12+/m0/s1	PLQUATFCVTZMJC-SDDRHHMPSA-N	294.121571696							102924
BRD-K60360711	LSM-12077		54638994	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20+/m0/s1	GUCCOCGWZUYAMY-SLFFLAALSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K60360711	BRD-K60360711-001-01-8	Broad Institute of MIT and Harvard	BRD-K60360711			OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20+/m0/s1	GUCCOCGWZUYAMY-SLFFLAALSA-N	412.211055416							100703
BRD-K33711030	LSM-10472		54639153	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17-,19+/m0/s1	JKKDNXFJBMMQFP-JENIJYKNSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K33711030	BRD-K33711030-001-01-0	Broad Institute of MIT and Harvard	BRD-K33711030			OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17-,19+/m0/s1	JKKDNXFJBMMQFP-JENIJYKNSA-N	434.162390662							99093
BRD-K97829610	LSM-14442		54639105	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18+/m1/s1	OPNJNCHASNUPJL-KURKYZTESA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)NC3CCC3)O[C@H]2CO)cc1	BroadT	BRD-K97829610	BRD-K97829610-001-01-1	Broad Institute of MIT and Harvard	BRD-K97829610			COc1ccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)NC3CCC3)O[C@H]2CO)cc1	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18+/m1/s1	OPNJNCHASNUPJL-KURKYZTESA-N	391.210721058							103097
BRD-K31327364	LSM-10325		54639018	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16+,19+/m0/s1	OCHDOPTVTSINTO-FRQCXROJSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@@H](NC(=O)c3ccc4OCOc4c3)[C@@H](CO)O2	BroadT	BRD-K31327364	BRD-K31327364-001-01-3	Broad Institute of MIT and Harvard	BRD-K31327364			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@@H](NC(=O)c2ccc3OCOc3c2)[C@@H](CO)O1	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16+,19+/m0/s1	OCHDOPTVTSINTO-FRQCXROJSA-N	419.205635678							98946
BRD-K03116835	LSM-8627		54639022	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16-,19+/m0/s1	OCHDOPTVTSINTO-TXPKVOOTSA-N	CN1CCN(CC1)C(=O)C[C@@H]2CC[C@H](NC(=O)c3ccc4OCOc4c3)[C@@H](CO)O2	BroadT	BRD-K03116835	BRD-K03116835-001-01-5	Broad Institute of MIT and Harvard	BRD-K03116835			CN1CCN(CC1)C(=O)C[C@@H]1CC[C@H](NC(=O)c2ccc3OCOc3c2)[C@@H](CO)O1	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16-,19+/m0/s1	OCHDOPTVTSINTO-TXPKVOOTSA-N	419.205635678							97248
BRD-K04402444	LSM-8699		54639133	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22-,23+/m1/s1	YSHLOQAWMNLOEI-MZYLBHOOSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)N3CCc4ccccc4C3)O[C@H]2CO	BroadT	BRD-K04402444	BRD-K04402444-001-01-1	Broad Institute of MIT and Harvard	BRD-K04402444			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)N2CCc3ccccc3C2)O[C@H]1CO	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22-,23+/m1/s1	YSHLOQAWMNLOEI-MZYLBHOOSA-N	458.18754277							97320
BRD-K13299591	LSM-9227		54638873	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16-,17-/m1/s1	CARWJPWJJJMDHW-BRWVUGGUSA-N	OC[C@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K13299591	BRD-K13299591-001-01-1	Broad Institute of MIT and Harvard	BRD-K13299591			OC[C@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16-,17-/m1/s1	CARWJPWJJJMDHW-BRWVUGGUSA-N	383.242021186							97848
BRD-K12564766	LSM-9176		54639120	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20+,21-/m0/s1	SBFIZHFYYISGJV-DQLDELGASA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CCNC(=O)c3ccccc3F)O[C@H]2CO	BroadT	BRD-K12564766	BRD-K12564766-001-01-8	Broad Institute of MIT and Harvard	BRD-K12564766			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNC(=O)c2ccccc2F)O[C@H]1CO	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20+,21-/m0/s1	SBFIZHFYYISGJV-DQLDELGASA-N	450.162470874							97797
BRD-K76166520	LSM-13083		54638853	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20-/m0/s1	ABKGFAHRWOKBSI-DBVUQKKJSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K76166520	BRD-K76166520-001-01-2	Broad Institute of MIT and Harvard	BRD-K76166520			OC[C@@H]1O[C@H](CCNC(=O)C2CCCCC2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C22H32FN3O4/c23-17-8-4-5-9-18(17)25-22(29)26-19-11-10-16(30-20(19)14-27)12-13-24-21(28)15-6-2-1-3-7-15/h4-5,8-9,15-16,19-20,27H,1-3,6-7,10-14H2,(H,24,28)(H2,25,26,29)/t16-,19+,20-/m0/s1	ABKGFAHRWOKBSI-DBVUQKKJSA-N	421.237684734							101721
BRD-K70765133	LSM-12744		54639011	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14+,15+/m1/s1	MSNHHRRUCLPTHC-ILXRZTDVSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K70765133	BRD-K70765133-001-01-6	Broad Institute of MIT and Harvard	BRD-K70765133			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)C1CCC1	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14+,15+/m1/s1	MSNHHRRUCLPTHC-ILXRZTDVSA-N	324.204907396							131214
BRD-K54202584	LSM-11726		54638916	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16+,19+/m1/s1	HBSXUOUHADHDTK-ALKREAHSSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3CC3)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K54202584	BRD-K54202584-001-01-4	Broad Institute of MIT and Harvard	BRD-K54202584			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2CC2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16+,19+/m1/s1	HBSXUOUHADHDTK-ALKREAHSSA-N	421.19254611							100351
BRD-K03807141	LSM-8666		54639029	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22-,23+/m1/s1	QIJBHKKZJCMHEO-ZLNRFVROSA-N	OC[C@@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)Nc4cccc(Cl)c4	BroadT	BRD-K03807141	BRD-K03807141-001-01-8	Broad Institute of MIT and Harvard	BRD-K03807141			OC[C@@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22-,23+/m1/s1	QIJBHKKZJCMHEO-ZLNRFVROSA-N	469.188067516							97287
CHEMBL2131329	LSM-11151	BRD-K44760520, SID131435343	54639058	InChI=1S/C15H21N5O2/c16-12-5-4-11(22-15(12)10-21)6-8-20-9-14(18-19-20)13-3-1-2-7-17-13/h1-3,7,9,11-12,15,21H,4-6,8,10,16H2/t11-,12-,15+/m1/s1	UZCFPAZMYSFTCU-JMSVASOKSA-N	N[C@@H]1CC[C@H](CCn2cc(nn2)c3ccccn3)O[C@H]1CO	BroadT	BRD-K44760520	BRD-K44760520-001-01-1	Broad Institute of MIT and Harvard	BRD-K44760520			N[C@@H]1CC[C@H](CCn2cc(nn2)-c2ccccn2)O[C@H]1CO	InChI=1S/C15H21N5O2/c16-12-5-4-11(22-15(12)10-21)6-8-20-9-14(18-19-20)13-3-1-2-7-17-13/h1-3,7,9,11-12,15,21H,4-6,8,10,16H2/t11-,12-,15+/m1/s1	UZCFPAZMYSFTCU-JMSVASOKSA-N	303.169524962							99772
BRD-K23872111	LSM-9869		54638919	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16-,19-/m1/s1	HBSXUOUHADHDTK-IDHHARJASA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3CC3)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K23872111	BRD-K23872111-001-01-4	Broad Institute of MIT and Harvard	BRD-K23872111			OC[C@H]1O[C@@H](CCn2cc(nn2)C2CC2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C20H25F2N5O3/c21-13-3-5-15(22)17(9-13)24-20(29)23-16-6-4-14(30-19(16)11-28)7-8-27-10-18(25-26-27)12-1-2-12/h3,5,9-10,12,14,16,19,28H,1-2,4,6-8,11H2,(H2,23,24,29)/t14-,16-,19-/m1/s1	HBSXUOUHADHDTK-IDHHARJASA-N	421.19254611							98490
BRD-K70447364	LSM-12726		54638936	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19+,20-/m1/s1	IBEFNTNFDPOULD-UIAACRFSSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K70447364	BRD-K70447364-001-01-1	Broad Institute of MIT and Harvard	BRD-K70447364			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19+,20-/m1/s1	IBEFNTNFDPOULD-UIAACRFSSA-N	504.068876166							101362
CHEMBL2358058	LSM-9015	BRD-K09623383, SID131435152	54638868	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16+,17+/m0/s1	CARWJPWJJJMDHW-GVDBMIGSSA-N	OC[C@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K09623383	BRD-K09623383-001-01-0	Broad Institute of MIT and Harvard	BRD-K09623383			OC[C@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16+,17+/m0/s1	CARWJPWJJJMDHW-GVDBMIGSSA-N	383.242021186							97636
BRD-K28649344	LSM-10165		54639101	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18+/m1/s1	OPNJNCHASNUPJL-SQNIBIBYSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@H](CC(=O)NC3CCC3)O[C@H]2CO)cc1	BroadT	BRD-K28649344	BRD-K28649344-001-01-0	Broad Institute of MIT and Harvard	BRD-K28649344			COc1ccc(NC(=O)N[C@H]2CC[C@H](CC(=O)NC3CCC3)O[C@H]2CO)cc1	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17+,18+/m1/s1	OPNJNCHASNUPJL-SQNIBIBYSA-N	391.210721058							98786
BRD-K56298028	LSM-11833		54638925	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10-,11+/m1/s1	RKCCKXKETMZMSY-MXWKQRLJSA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CCN)O[C@H]1CO	BroadT	BRD-K56298028	BRD-K56298028-001-01-4	Broad Institute of MIT and Harvard	BRD-K56298028			CC(C)NC(=O)N[C@@H]1CC[C@H](CCN)O[C@H]1CO	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10-,11+/m1/s1	RKCCKXKETMZMSY-MXWKQRLJSA-N	259.18959169							100458
BRD-K22181332	LSM-9772		54639044	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16-,17-/m1/s1	QHWKOKDSIMAAGX-BRWVUGGUSA-N	COc1cccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)C)[C@@H](CO)O2)c1	BroadT	BRD-K22181332	BRD-K22181332-001-01-4	Broad Institute of MIT and Harvard	BRD-K22181332			COc1cccc(CNC(=O)C[C@H]2CC[C@@H](NC(C)=O)[C@@H](CO)O2)c1	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16-,17-/m1/s1	QHWKOKDSIMAAGX-BRWVUGGUSA-N	350.184171952							98393
BRD-K82830100	LSM-13490		54638998	InChI=1S/C23H34N4O5S/c1-31-21-9-5-6-10-23(21)33(29,30)25-19-12-11-18(32-22(19)16-28)13-14-27-15-20(24-26-27)17-7-3-2-4-8-17/h5-6,9-10,15,17-19,22,25,28H,2-4,7-8,11-14,16H2,1H3/t18-,19+,22+/m1/s1	HBWIVVUPODMQBV-DXIQSLLYSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@H](CCn3cc(nn3)C4CCCCC4)O[C@H]2CO	BroadT	BRD-K82830100	BRD-K82830100-001-01-3	Broad Institute of MIT and Harvard	BRD-K82830100			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@H](CCn2cc(nn2)C2CCCCC2)O[C@H]1CO	InChI=1S/C23H34N4O5S/c1-31-21-9-5-6-10-23(21)33(29,30)25-19-12-11-18(32-22(19)16-28)13-14-27-15-20(24-26-27)17-7-3-2-4-8-17/h5-6,9-10,15,17-19,22,25,28H,2-4,7-8,11-14,16H2,1H3/t18-,19+,22+/m1/s1	HBWIVVUPODMQBV-DXIQSLLYSA-N	478.224990918							131218
BRD-K10270435	LSM-9051		54639157	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17+,19-/m1/s1	JKKDNXFJBMMQFP-ZIFCJYIRSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K10270435	BRD-K10270435-001-01-5	Broad Institute of MIT and Harvard	BRD-K10270435			OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17+,19-/m1/s1	JKKDNXFJBMMQFP-ZIFCJYIRSA-N	434.162390662							97672
CHEMBL2142072	LSM-10239	BRD-K29911749, SID131435346	54639061	InChI=1S/C15H21N5O2/c16-12-5-4-11(22-15(12)10-21)6-8-20-9-14(18-19-20)13-3-1-2-7-17-13/h1-3,7,9,11-12,15,21H,4-6,8,10,16H2/t11-,12+,15-/m0/s1	UZCFPAZMYSFTCU-ZOWXZIJZSA-N	N[C@@H]1CC[C@@H](CCn2cc(nn2)c3ccccn3)O[C@H]1CO	BroadT	BRD-K29911749	BRD-K29911749-001-01-4	Broad Institute of MIT and Harvard	BRD-K29911749			N[C@@H]1CC[C@@H](CCn2cc(nn2)-c2ccccn2)O[C@H]1CO	InChI=1S/C15H21N5O2/c16-12-5-4-11(22-15(12)10-21)6-8-20-9-14(18-19-20)13-3-1-2-7-17-13/h1-3,7,9,11-12,15,21H,4-6,8,10,16H2/t11-,12+,15-/m0/s1	UZCFPAZMYSFTCU-ZOWXZIJZSA-N	303.169524962							98860
BRD-K59330510	LSM-12014		54639004	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18-,19-/m1/s1	JNXYUDJSGYXBCY-BHIYHBOVSA-N	OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K59330510	BRD-K59330510-001-01-7	Broad Institute of MIT and Harvard	BRD-K59330510			OC[C@H]1O[C@@H](CCNC(=O)CN2CCOCC2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18-,19-/m1/s1	JNXYUDJSGYXBCY-BHIYHBOVSA-N	459.1839346							100640
BRD-K21472896	LSM-9730		54638904	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19-,20+/m0/s1	YSDDRAAKFDNITG-JOCLIGHLSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K21472896	BRD-K21472896-001-01-6	Broad Institute of MIT and Harvard	BRD-K21472896			C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19-,20+/m0/s1	YSDDRAAKFDNITG-JOCLIGHLSA-N	397.200156374							98351
BRD-K40985138	LSM-10922		54639083	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18+,20-/m0/s1	ZNMNRMGCWQWZTD-NSHGMRRFSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3cccc(F)c3)O[C@H]2CO	BroadT	BRD-K40985138	BRD-K40985138-001-01-2	Broad Institute of MIT and Harvard	BRD-K40985138			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2cccc(F)c2)O[C@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18+,20-/m0/s1	ZNMNRMGCWQWZTD-NSHGMRRFSA-N	466.157385494							99543
BRD-K20342806	LSM-9671		54639127	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17+,18-/m0/s1	BAJOMULNWMTCGT-JQHSSLGASA-N	CN1CCN(CC1)C(=O)C[C@H]2O[C@@H](CO)[C@H](NS(=O)(=O)c3cccc(F)c3)C=C2	BroadT	BRD-K20342806	BRD-K20342806-001-01-1	Broad Institute of MIT and Harvard	BRD-K20342806			CN1CCN(CC1)C(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2cccc(F)c2)C=C1	InChI=1S/C19H26FN3O5S/c1-22-7-9-23(10-8-22)19(25)12-15-5-6-17(18(13-24)28-15)21-29(26,27)16-4-2-3-14(20)11-16/h2-6,11,15,17-18,21,24H,7-10,12-13H2,1H3/t15-,17+,18-/m0/s1	BAJOMULNWMTCGT-JQHSSLGASA-N	427.157719852							98292
BRD-K03727241	LSM-8661		54639161	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18-,19-/m1/s1	FKDHCSBIQDWEMT-BHIYHBOVSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)CC[C@H]1NC(=O)C3CCOCC3	BroadT	BRD-K03727241	BRD-K03727241-001-01-7	Broad Institute of MIT and Harvard	BRD-K03727241			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)CC[C@H]1NC(=O)C1CCOCC1	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18-,19-/m1/s1	FKDHCSBIQDWEMT-BHIYHBOVSA-N	424.176499758							97282
BRD-K64556793	LSM-12373		54638981	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18+,19+/m0/s1	DCVAKYLGJMAIQD-IPMKNSEASA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K64556793	BRD-K64556793-001-01-8	Broad Institute of MIT and Harvard	BRD-K64556793			OC[C@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18+,19+/m0/s1	DCVAKYLGJMAIQD-IPMKNSEASA-N	407.22203467							101000
BRD-K27635561	LSM-10092		54639128	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22+,23+/m0/s1	YSHLOQAWMNLOEI-MDNUFGMLSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)N3CCc4ccccc4C3)O[C@@H]2CO	BroadT	BRD-K27635561	BRD-K27635561-001-01-6	Broad Institute of MIT and Harvard	BRD-K27635561			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCc3ccccc3C2)O[C@@H]1CO	InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22+,23+/m0/s1	YSHLOQAWMNLOEI-MDNUFGMLSA-N	458.18754277							98713
BRD-K68737064	LSM-12622		54639037	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20-,21-/m0/s1	VUOOERVJSWLFKU-JBACZVJFSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@@H](CC(=O)NCCN3CCCCC3)O[C@H]2CO	BroadT	BRD-K68737064	BRD-K68737064-001-01-2	Broad Institute of MIT and Harvard	BRD-K68737064			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)NCCN2CCCCC2)O[C@H]1CO	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20-,21-/m0/s1	VUOOERVJSWLFKU-JBACZVJFSA-N	451.214091876							101254
BRD-K43249401	LSM-11058		54639014	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14-,15+/m0/s1	MSNHHRRUCLPTHC-SOUVJXGZSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K43249401	BRD-K43249401-001-01-0	Broad Institute of MIT and Harvard	BRD-K43249401			OC[C@H]1O[C@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)C1CCC1	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14-,15+/m0/s1	MSNHHRRUCLPTHC-SOUVJXGZSA-N	324.204907396							99679
BRD-K85664836	LSM-13669		54638949	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22+/m1/s1	HKZRXKNGDCOEMV-SJBKTWHCSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)c3ccccc3)CC[C@H]1NC(=O)Cc4ccccn4	BroadT	BRD-K85664836	BRD-K85664836-001-01-4	Broad Institute of MIT and Harvard	BRD-K85664836			OC[C@@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C23H27N5O3/c29-16-22-20(25-23(30)14-18-8-4-5-12-24-18)10-9-19(31-22)11-13-28-15-21(26-27-28)17-6-2-1-3-7-17/h1-8,12,15,19-20,22,29H,9-11,13-14,16H2,(H,25,30)/t19-,20-,22+/m1/s1	HKZRXKNGDCOEMV-SJBKTWHCSA-N	421.211389774							102316
BRD-K70581786	LSM-12733		54639087	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25-,26-/m0/s1	HBACCIGQRKGJSE-GSDHBNRESA-N	OC[C@@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@@H]1NC(=O)CCN4CCCCC4	BroadT	BRD-K70581786	BRD-K70581786-001-01-7	Broad Institute of MIT and Harvard	BRD-K70581786			OC[C@@H]1O[C@H](CC(=O)N2CCC(Cc3ccccc3)CC2)CC[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C28H43N3O4/c32-21-26-25(29-27(33)13-16-30-14-5-2-6-15-30)10-9-24(35-26)20-28(34)31-17-11-23(12-18-31)19-22-7-3-1-4-8-22/h1,3-4,7-8,23-26,32H,2,5-6,9-21H2,(H,29,33)/t24-,25-,26-/m0/s1	HBACCIGQRKGJSE-GSDHBNRESA-N	485.325356886							101369
BRD-K07456098	LSM-8868		54638931	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19+,20+/m1/s1	IBEFNTNFDPOULD-XPGWFJOJSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K07456098	BRD-K07456098-001-01-3	Broad Institute of MIT and Harvard	BRD-K07456098			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19+,20+/m1/s1	IBEFNTNFDPOULD-XPGWFJOJSA-N	504.068876166							97489
BRD-K62143565	LSM-12201		54638990	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20+/m0/s1	GUCCOCGWZUYAMY-XUVXKRRUSA-N	OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K62143565	BRD-K62143565-001-01-3	Broad Institute of MIT and Harvard	BRD-K62143565			OC[C@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20+/m0/s1	GUCCOCGWZUYAMY-XUVXKRRUSA-N	412.211055416							100827
BRD-K19965545	LSM-9639		54639116	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20-,21+/m1/s1	SBFIZHFYYISGJV-HBGVWJBISA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CC[C@H](CCNC(=O)c3ccccc3F)O[C@H]2CO	BroadT	BRD-K19965545	BRD-K19965545-001-01-8	Broad Institute of MIT and Harvard	BRD-K19965545			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1CC[C@H](CCNC(=O)c2ccccc2F)O[C@H]1CO	InChI=1S/C22H27FN2O5S/c1-15-6-9-17(10-7-15)31(28,29)25-20-11-8-16(30-21(20)14-26)12-13-24-22(27)18-4-2-3-5-19(18)23/h2-7,9-10,16,20-21,25-26H,8,11-14H2,1H3,(H,24,27)/t16-,20-,21+/m1/s1	SBFIZHFYYISGJV-HBGVWJBISA-N	450.162470874							98260
CHEMBL2355983	LSM-12640	BRD-K69006460, SID131435352	54639067	InChI=1S/C28H28N2O5/c31-19-26-25(30-28(33)21-7-3-1-4-8-21)16-15-24(35-26)17-27(32)29-18-20-11-13-23(14-12-20)34-22-9-5-2-6-10-22/h1-16,24-26,31H,17-19H2,(H,29,32)(H,30,33)/t24-,25+,26-/m0/s1	KKHGDJJULHRULI-NXCFDTQHSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C=C[C@H]1NC(=O)c4ccccc4	BroadT	BRD-K69006460	BRD-K69006460-001-01-1	Broad Institute of MIT and Harvard	BRD-K69006460			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C=C[C@H]1NC(=O)c1ccccc1	InChI=1S/C28H28N2O5/c31-19-26-25(30-28(33)21-7-3-1-4-8-21)16-15-24(35-26)17-27(32)29-18-20-11-13-23(14-12-20)34-22-9-5-2-6-10-22/h1-16,24-26,31H,17-19H2,(H,29,32)(H,30,33)/t24-,25+,26-/m0/s1	KKHGDJJULHRULI-NXCFDTQHSA-N	472.199822016							101273
BRD-K24084946	LSM-9884		54638888	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19-,20-/m0/s1	NMMAJMJUDCVZMW-UFYCRDLUSA-N	Cc1ccccc1S(=O)(=O)NCC[C@@H]2CC[C@H](NS(=O)(=O)c3ccccc3C)[C@H](CO)O2	BroadT	BRD-K24084946	BRD-K24084946-001-01-6	Broad Institute of MIT and Harvard	BRD-K24084946			Cc1ccccc1S(=O)(=O)NCC[C@@H]1CC[C@H](NS(=O)(=O)c2ccccc2C)[C@H](CO)O1	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19-,20-/m0/s1	NMMAJMJUDCVZMW-UFYCRDLUSA-N	482.15452808							98505
BRD-K26399147	LSM-10027		54638912	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17-,19-/m1/s1	VBSGUKREVIUPDG-SZVBFZGTSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)c3ccccn3	BroadT	BRD-K26399147	BRD-K26399147-001-01-3	Broad Institute of MIT and Harvard	BRD-K26399147			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)c1ccccn1	InChI=1S/C20H24ClN3O5S/c21-14-4-7-16(8-5-14)30(27,28)23-12-10-15-6-9-17(19(13-25)29-15)24-20(26)18-3-1-2-11-22-18/h1-5,7-8,11,15,17,19,23,25H,6,9-10,12-13H2,(H,24,26)/t15-,17-,19-/m1/s1	VBSGUKREVIUPDG-SZVBFZGTSA-N	453.112519298							98648
BRD-K88328468	LSM-13857		54638940	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13-,14-/m1/s1	RGLUKSSVDYQFDC-MGPQQGTHSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCC2)C=C[C@H]1NC(=O)C3CC3	BroadT	BRD-K88328468	BRD-K88328468-001-01-8	Broad Institute of MIT and Harvard	BRD-K88328468			OC[C@H]1O[C@@H](CC(=O)NC2CCC2)C=C[C@H]1NC(=O)C1CC1	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13-,14-/m1/s1	RGLUKSSVDYQFDC-MGPQQGTHSA-N	308.173607268							102508
BRD-K45221651	LSM-11180		54639008	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18-,19-/m0/s1	JNXYUDJSGYXBCY-WDSOQIARSA-N	OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K45221651	BRD-K45221651-001-01-4	Broad Institute of MIT and Harvard	BRD-K45221651			OC[C@@H]1O[C@H](CCNC(=O)CN2CCOCC2)CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C20H30FN3O6S/c21-15-1-4-17(5-2-15)31(27,28)23-18-6-3-16(30-19(18)14-25)7-8-22-20(26)13-24-9-11-29-12-10-24/h1-2,4-5,16,18-19,23,25H,3,6-14H2,(H,22,26)/t16-,18-,19-/m0/s1	JNXYUDJSGYXBCY-WDSOQIARSA-N	459.1839346							99801
BRD-K28430035	LSM-10148		54639040	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20+,21-/m1/s1	VUOOERVJSWLFKU-HLAWJBBLSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@H]2C=C[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2CO	BroadT	BRD-K28430035	BRD-K28430035-001-01-9	Broad Institute of MIT and Harvard	BRD-K28430035			Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20+,21-/m1/s1	VUOOERVJSWLFKU-HLAWJBBLSA-N	451.214091876							98769
BRD-K82765406	LSM-13482		54639097	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15-,19-/m0/s1	OAEJMSHQDKFBTQ-DOXZYTNZSA-N	OC[C@@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K82765406	BRD-K82765406-001-01-2	Broad Institute of MIT and Harvard	BRD-K82765406			OC[C@@H]1O[C@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15-,19-/m0/s1	OAEJMSHQDKFBTQ-DOXZYTNZSA-N	428.169584528							102122
BRD-K47995524	LSM-11347		54638969	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19-,20-/m1/s1	ONEMPWMAPHHZJV-NSISKUIASA-N	OC[C@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)Nc3ccc(Cl)c(Cl)c3	BroadT	BRD-K47995524	BRD-K47995524-001-01-6	Broad Institute of MIT and Harvard	BRD-K47995524			OC[C@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19-,20-/m1/s1	ONEMPWMAPHHZJV-NSISKUIASA-N	483.112789898							99968
BRD-K00175211	LSM-8434		54638944	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13+,14-/m1/s1	RGLUKSSVDYQFDC-HZSPNIEDSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCC2)C=C[C@@H]1NC(=O)C3CC3	BroadT	BRD-K00175211	BRD-K00175211-001-01-8	Broad Institute of MIT and Harvard	BRD-K00175211			OC[C@H]1O[C@@H](CC(=O)NC2CCC2)C=C[C@@H]1NC(=O)C1CC1	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13+,14-/m1/s1	RGLUKSSVDYQFDC-HZSPNIEDSA-N	308.173607268							97055
BRD-K94913400	LSM-14248		54639033	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22+,23-/m0/s1	QIJBHKKZJCMHEO-ZRBLBEILSA-N	OC[C@@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)Nc4cccc(Cl)c4	BroadT	BRD-K94913400	BRD-K94913400-001-01-0	Broad Institute of MIT and Harvard	BRD-K94913400			OC[C@@H]1O[C@H](CCn2cc(Cc3ccccc3)nn2)CC[C@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22+,23-/m0/s1	QIJBHKKZJCMHEO-ZRBLBEILSA-N	469.188067516							102902
BRD-K22562809	LSM-9795		54638986	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18-,19+/m1/s1	DCVAKYLGJMAIQD-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K22562809	BRD-K22562809-001-01-9	Broad Institute of MIT and Harvard	BRD-K22562809			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18-,19+/m1/s1	DCVAKYLGJMAIQD-QRVBRYPASA-N	407.22203467							98416
BRD-K88114920	LSM-13841		54638890	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19+,20-/m0/s1	NMMAJMJUDCVZMW-ZCNNSNEGSA-N	Cc1ccccc1S(=O)(=O)NCC[C@@H]2CC[C@@H](NS(=O)(=O)c3ccccc3C)[C@H](CO)O2	BroadT	BRD-K88114920	BRD-K88114920-001-01-4	Broad Institute of MIT and Harvard	BRD-K88114920			Cc1ccccc1S(=O)(=O)NCC[C@@H]1CC[C@@H](NS(=O)(=O)c2ccccc2C)[C@H](CO)O1	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19+,20-/m0/s1	NMMAJMJUDCVZMW-ZCNNSNEGSA-N	482.15452808							102492
BRD-K41096823	LSM-10929		54639152	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17+,19+/m1/s1	JKKDNXFJBMMQFP-AOIWGVFYSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K41096823	BRD-K41096823-001-01-7	Broad Institute of MIT and Harvard	BRD-K41096823			OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17+,19+/m1/s1	JKKDNXFJBMMQFP-AOIWGVFYSA-N	434.162390662							99550
BRD-K36618106	LSM-10639		54639144	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21+,22+/m1/s1	BQXPJFPCKYJDQK-FSSWDIPSSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@@H]1NC(=O)c4ccncc4	BroadT	BRD-K36618106	BRD-K36618106-001-01-3	Broad Institute of MIT and Harvard	BRD-K36618106			OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@@H]1NC(=O)c1ccncc1	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21+,22+/m1/s1	BQXPJFPCKYJDQK-FSSWDIPSSA-N	436.211055416							99260
BRD-K07359994	LSM-8860		54639036	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20-,21-/m1/s1	VUOOERVJSWLFKU-HMXCVIKNSA-N	Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C=C[C@H](CC(=O)NCCN3CCCCC3)O[C@@H]2CO	BroadT	BRD-K07359994	BRD-K07359994-001-01-4	Broad Institute of MIT and Harvard	BRD-K07359994			Cc1ccc(cc1)S(=O)(=O)N[C@@H]1C=C[C@H](CC(=O)NCCN2CCCCC2)O[C@@H]1CO	InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20-,21-/m1/s1	VUOOERVJSWLFKU-HMXCVIKNSA-N	451.214091876							97481
BRD-K31099173	LSM-10304		54638967	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19-,20+/m1/s1	ONEMPWMAPHHZJV-AHRSYUTCSA-N	OC[C@@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)Nc3ccc(Cl)c(Cl)c3	BroadT	BRD-K31099173	BRD-K31099173-001-01-9	Broad Institute of MIT and Harvard	BRD-K31099173			OC[C@@H]1O[C@@H](CCNC(=O)c2ccc(F)cc2)CC[C@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C22H24Cl2FN3O4/c23-17-7-5-15(11-18(17)24)27-22(31)28-19-8-6-16(32-20(19)12-29)9-10-26-21(30)13-1-3-14(25)4-2-13/h1-5,7,11,16,19-20,29H,6,8-10,12H2,(H,26,30)(H2,27,28,31)/t16-,19-,20+/m1/s1	ONEMPWMAPHHZJV-AHRSYUTCSA-N	483.112789898							98925
BRD-K29371459	LSM-14784		54638863	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18-,20-/m1/s1	OLUPXTRBOWIZHH-YVWKXTFCSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@H](CCn3cc(nn3)C4(O)CCCC4)O[C@@H]2CO	BroadT	BRD-K29371459	BRD-K29371459-001-01-1	Broad Institute of MIT and Harvard	BRD-K29371459			COc1ccccc1NC(=O)N[C@@H]1CC[C@H](CCn2cc(nn2)C2(O)CCCC2)O[C@@H]1CO	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18-,20-/m1/s1	OLUPXTRBOWIZHH-YVWKXTFCSA-N	459.248169206							103440
BRD-K36160951	LSM-10613		54638988	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18+,19-/m0/s1	DCVAKYLGJMAIQD-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K36160951	BRD-K36160951-001-01-2	Broad Institute of MIT and Harvard	BRD-K36160951			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18+,19-/m0/s1	DCVAKYLGJMAIQD-OTWHNJEPSA-N	407.22203467							99234
BRD-K55078218	LSM-11766		54639145	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21-,22-/m1/s1	BQXPJFPCKYJDQK-YPAWHYETSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@H]1NC(=O)c4ccncc4	BroadT	BRD-K55078218	BRD-K55078218-001-01-1	Broad Institute of MIT and Harvard	BRD-K55078218			OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@H]1NC(=O)c1ccncc1	InChI=1S/C24H28N4O4/c29-17-22-21(26-24(31)18-8-10-25-11-9-18)7-6-20(32-22)16-23(30)28-14-12-27(13-15-28)19-4-2-1-3-5-19/h1-11,20-22,29H,12-17H2,(H,26,31)/t20-,21-,22-/m1/s1	BQXPJFPCKYJDQK-YPAWHYETSA-N	436.211055416							100391
BRD-K27161987	LSM-10072		54639046	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16-,17+/m0/s1	QHWKOKDSIMAAGX-YESZJQIVSA-N	COc1cccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)C)[C@@H](CO)O2)c1	BroadT	BRD-K27161987	BRD-K27161987-001-01-9	Broad Institute of MIT and Harvard	BRD-K27161987			COc1cccc(CNC(=O)C[C@@H]2CC[C@H](NC(C)=O)[C@@H](CO)O2)c1	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16-,17+/m0/s1	QHWKOKDSIMAAGX-YESZJQIVSA-N	350.184171952							98693
BRD-K24277661	LSM-9900		54639107	InChI=1S/C14H18N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h3-6,10-12,17H,1-2,7-8H2,(H,16,20)(H,18,19)/t10-,11+,12+/m0/s1	PLQUATFCVTZMJC-QJPTWQEYSA-N	OC[C@H]1O[C@H](CC(=O)O)CC[C@H]1NC(=O)c2ccncc2	BroadT	BRD-K24277661	BRD-K24277661-001-01-9	Broad Institute of MIT and Harvard	BRD-K24277661			OC[C@H]1O[C@H](CC(O)=O)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C14H18N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h3-6,10-12,17H,1-2,7-8H2,(H,16,20)(H,18,19)/t10-,11+,12+/m0/s1	PLQUATFCVTZMJC-QJPTWQEYSA-N	294.121571696							98521
BRD-K60092199	LSM-12063		54638923	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10+,11+/m0/s1	RKCCKXKETMZMSY-HBNTYKKESA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CCN)O[C@@H]1CO	BroadT	BRD-K60092199	BRD-K60092199-001-01-8	Broad Institute of MIT and Harvard	BRD-K60092199			CC(C)NC(=O)N[C@@H]1CC[C@@H](CCN)O[C@@H]1CO	InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10+,11+/m0/s1	RKCCKXKETMZMSY-HBNTYKKESA-N	259.18959169							100689
BRD-K23911230	LSM-9873		54639156	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17-,19-/m0/s1	JKKDNXFJBMMQFP-LNLFQRSKSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c3cnccn3	BroadT	BRD-K23911230	BRD-K23911230-001-01-6	Broad Institute of MIT and Harvard	BRD-K23911230			OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c1cnccn1	InChI=1S/C20H26N4O5S/c25-13-19-17(24-20(26)18-12-21-10-11-22-18)7-6-16(29-19)8-9-23-30(27,28)14-15-4-2-1-3-5-15/h1-5,10-12,16-17,19,23,25H,6-9,13-14H2,(H,24,26)/t16-,17-,19-/m0/s1	JKKDNXFJBMMQFP-LNLFQRSKSA-N	434.162390662							98494
BRD-K07678162	LSM-8891		54638963	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22-/m0/s1	UDMIDSQAUXVXMN-XCRNZQRYSA-N	C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c4ccccc4	BroadT	BRD-K07678162	BRD-K07678162-001-01-3	Broad Institute of MIT and Harvard	BRD-K07678162			C[C@H](NC(=O)C[C@H]1O[C@@H](CO)[C@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c1ccccc1	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22-/m0/s1	UDMIDSQAUXVXMN-XCRNZQRYSA-N	453.189985614							97512
BRD-K52938793	LSM-11659		54638958	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19-,22+/m0/s1	UDMIDSQAUXVXMN-SXTKRDDTSA-N	C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c4ccccc4	BroadT	BRD-K52938793	BRD-K52938793-001-01-2	Broad Institute of MIT and Harvard	BRD-K52938793			C[C@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c1ccccc1	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19-,22+/m0/s1	UDMIDSQAUXVXMN-SXTKRDDTSA-N	453.189985614							100284
BRD-K63366817	LSM-12284		54639012	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14-,15-/m1/s1	MSNHHRRUCLPTHC-RBSFLKMASA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)C3CCC3	BroadT	BRD-K63366817	BRD-K63366817-001-01-5	Broad Institute of MIT and Harvard	BRD-K63366817			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@H]1NC(=O)C1CCC1	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14-,15-/m1/s1	MSNHHRRUCLPTHC-RBSFLKMASA-N	324.204907396							100910
BRD-K84024786	LSM-13563		54638871	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16-,17+/m1/s1	CARWJPWJJJMDHW-ZACQAIPSSA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K84024786	BRD-K84024786-001-01-2	Broad Institute of MIT and Harvard	BRD-K84024786			OC[C@@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16-,17+/m1/s1	CARWJPWJJJMDHW-ZACQAIPSSA-N	383.242021186							102205
BRD-K90233481	LSM-13994		54639002	InChI=1S/C23H34N4O5S/c1-31-21-9-5-6-10-23(21)33(29,30)25-19-12-11-18(32-22(19)16-28)13-14-27-15-20(24-26-27)17-7-3-2-4-8-17/h5-6,9-10,15,17-19,22,25,28H,2-4,7-8,11-14,16H2,1H3/t18-,19+,22-/m0/s1	HBWIVVUPODMQBV-JQVVWYNYSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@@H](CCn3cc(nn3)C4CCCCC4)O[C@H]2CO	BroadT	BRD-K90233481	BRD-K90233481-001-01-9	Broad Institute of MIT and Harvard	BRD-K90233481			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@@H](CCn2cc(nn2)C2CCCCC2)O[C@H]1CO	InChI=1S/C23H34N4O5S/c1-31-21-9-5-6-10-23(21)33(29,30)25-19-12-11-18(32-22(19)16-28)13-14-27-15-20(24-26-27)17-7-3-2-4-8-17/h5-6,9-10,15,17-19,22,25,28H,2-4,7-8,11-14,16H2,1H3/t18-,19+,22-/m0/s1	HBWIVVUPODMQBV-JQVVWYNYSA-N	478.224990918							102647
BRD-K85861721	LSM-13690		54638992	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20-/m0/s1	GUCCOCGWZUYAMY-UFYCRDLUSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K85861721	BRD-K85861721-001-01-4	Broad Institute of MIT and Harvard	BRD-K85861721			OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19-,20-/m0/s1	GUCCOCGWZUYAMY-UFYCRDLUSA-N	412.211055416							102338
BRD-K30377815	LSM-10260		54638935	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19-,20+/m1/s1	IBEFNTNFDPOULD-YSGRDPCXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NS(=O)(=O)c3ccc(F)cc3	BroadT	BRD-K30377815	BRD-K30377815-001-01-4	Broad Institute of MIT and Harvard	BRD-K30377815			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)CC[C@H]1NS(=O)(=O)c1ccc(F)cc1	InChI=1S/C21H23Cl2FN2O5S/c22-17-7-1-13(9-18(17)23)11-25-21(28)10-15-4-8-19(20(12-27)31-15)26-32(29,30)16-5-2-14(24)3-6-16/h1-3,5-7,9,15,19-20,26-27H,4,8,10-12H2,(H,25,28)/t15-,19-,20+/m1/s1	IBEFNTNFDPOULD-YSGRDPCXSA-N	504.068876166							98881
BRD-K99700039	LSM-14553		54638980	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19+,21-/m0/s1	XDPGLRIFEVLTPI-SCWSEQNSSA-N	COc1ccccc1NC(=O)N[C@@H]2CC[C@@H](CCNS(=O)(=O)c3ccccc3)O[C@H]2CO	BroadT	BRD-K99700039	BRD-K99700039-001-01-5	Broad Institute of MIT and Harvard	BRD-K99700039			COc1ccccc1NC(=O)N[C@@H]1CC[C@@H](CCNS(=O)(=O)c2ccccc2)O[C@H]1CO	InChI=1S/C22H29N3O6S/c1-30-20-10-6-5-9-18(20)24-22(27)25-19-12-11-16(31-21(19)15-26)13-14-23-32(28,29)17-7-3-2-4-8-17/h2-10,16,19,21,23,26H,11-15H2,1H3,(H2,24,25,27)/t16-,19+,21-/m0/s1	XDPGLRIFEVLTPI-SCWSEQNSSA-N	463.177706368							103208
MLS003649996	LSM-9281	BRD-K14151426	53382659	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18+/m0/s1	OPNJNCHASNUPJL-OKZBNKHCSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)NC3CCC3)O[C@@H]2CO)cc1	BroadT	BRD-K14151426	BRD-K14151426-001-01-4	Broad Institute of MIT and Harvard	BRD-K14151426			COc1ccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)NC3CCC3)O[C@@H]2CO)cc1	InChI=1S/C20H29N3O5/c1-27-15-7-5-14(6-8-15)22-20(26)23-17-10-9-16(28-18(17)12-24)11-19(25)21-13-3-2-4-13/h5-8,13,16-18,24H,2-4,9-12H2,1H3,(H,21,25)(H2,22,23,26)/t16-,17-,18+/m0/s1	OPNJNCHASNUPJL-OKZBNKHCSA-N	391.210721058							97902
BRD-K89112856	LSM-13913		54638959	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19+,22-/m1/s1	UDMIDSQAUXVXMN-JHGBEIFQSA-N	C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c4ccccc4	BroadT	BRD-K89112856	BRD-K89112856-001-01-5	Broad Institute of MIT and Harvard	BRD-K89112856			C[C@@H](NC(=O)C[C@H]1O[C@H](CO)[C@@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c1ccccc1	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19+,22-/m1/s1	UDMIDSQAUXVXMN-JHGBEIFQSA-N	453.189985614							102566
BRD-K73340768	LSM-12923		54638886	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19-,20+/m1/s1	NMMAJMJUDCVZMW-AQNXPRMDSA-N	Cc1ccccc1S(=O)(=O)NCC[C@H]2CC[C@@H](NS(=O)(=O)c3ccccc3C)[C@H](CO)O2	BroadT	BRD-K73340768	BRD-K73340768-001-01-7	Broad Institute of MIT and Harvard	BRD-K73340768			Cc1ccccc1S(=O)(=O)NCC[C@H]1CC[C@@H](NS(=O)(=O)c2ccccc2C)[C@H](CO)O1	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19-,20+/m1/s1	NMMAJMJUDCVZMW-AQNXPRMDSA-N	482.15452808							101560
BRD-K94711641	LSM-14234		54638945	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13+,14-/m0/s1	RGLUKSSVDYQFDC-MJBXVCDLSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCC2)C=C[C@H]1NC(=O)C3CC3	BroadT	BRD-K94711641	BRD-K94711641-001-01-7	Broad Institute of MIT and Harvard	BRD-K94711641			OC[C@@H]1O[C@H](CC(=O)NC2CCC2)C=C[C@H]1NC(=O)C1CC1	InChI=1S/C16H24N2O4/c19-9-14-13(18-16(21)10-4-5-10)7-6-12(22-14)8-15(20)17-11-2-1-3-11/h6-7,10-14,19H,1-5,8-9H2,(H,17,20)(H,18,21)/t12-,13+,14-/m0/s1	RGLUKSSVDYQFDC-MJBXVCDLSA-N	308.173607268							102888
BRD-K41440211	LSM-10946		54638954	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22+/m1/s1	UDMIDSQAUXVXMN-UUIWEUTOSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c4ccccc4	BroadT	BRD-K41440211	BRD-K41440211-001-01-7	Broad Institute of MIT and Harvard	BRD-K41440211			C[C@@H](NC(=O)C[C@@H]1O[C@@H](CO)[C@@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c1ccccc1	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22+/m1/s1	UDMIDSQAUXVXMN-UUIWEUTOSA-N	453.189985614							99567
BRD-K12718908	LSM-9182		54638875	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16+,17-/m0/s1	CARWJPWJJJMDHW-BBWFWOEESA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K12718908	BRD-K12718908-001-01-9	Broad Institute of MIT and Harvard	BRD-K12718908			OC[C@@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C19H33N3O5/c23-13-17-16(21-18(24)12-22-8-10-26-11-9-22)5-4-15(27-17)6-7-20-19(25)14-2-1-3-14/h14-17,23H,1-13H2,(H,20,25)(H,21,24)/t15-,16+,17-/m0/s1	CARWJPWJJJMDHW-BBWFWOEESA-N	383.242021186							97803
BRD-K08926145	LSM-8965		54639076	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18+,20+/m0/s1	ZNMNRMGCWQWZTD-NLWGTHIKSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3cccc(F)c3)O[C@@H]2CO	BroadT	BRD-K08926145	BRD-K08926145-001-01-7	Broad Institute of MIT and Harvard	BRD-K08926145			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2cccc(F)c2)O[C@@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18+,20+/m0/s1	ZNMNRMGCWQWZTD-NLWGTHIKSA-N	466.157385494							97586
BRD-K22668950	LSM-9805		54639016	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14+,15-/m1/s1	MSNHHRRUCLPTHC-QLFBSQMISA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)C3CCC3	BroadT	BRD-K22668950	BRD-K22668950-001-01-1	Broad Institute of MIT and Harvard	BRD-K22668950			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)CC[C@@H]1NC(=O)C1CCC1	InChI=1S/C17H28N2O4/c20-10-15-14(19-17(22)12-2-1-3-12)7-6-13(23-15)8-16(21)18-9-11-4-5-11/h11-15,20H,1-10H2,(H,18,21)(H,19,22)/t13-,14+,15-/m1/s1	MSNHHRRUCLPTHC-QLFBSQMISA-N	324.204907396							98426
BRD-K64706654	LSM-12386		54639136	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24+,25+/m0/s1	JZSLTRUJUOZFGD-ISJGIBHGSA-N	OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K64706654	BRD-K64706654-001-01-7	Broad Institute of MIT and Harvard	BRD-K64706654			OC[C@H]1O[C@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24+,25+/m0/s1	JZSLTRUJUOZFGD-ISJGIBHGSA-N	459.215806438							101013
BRD-K98881366	LSM-14498		54638982	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18+,19+/m1/s1	DCVAKYLGJMAIQD-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K98881366	BRD-K98881366-001-01-7	Broad Institute of MIT and Harvard	BRD-K98881366			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@@H]1NC(=O)c1cccc(F)c1	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18+,19+/m1/s1	DCVAKYLGJMAIQD-QYZOEREBSA-N	407.22203467							103153
BRD-K78419283	LSM-13222		54638898	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20-/m0/s1	YSDDRAAKFDNITG-KNTRFNDTSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)c2cccnc2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K78419283	BRD-K78419283-001-01-0	Broad Institute of MIT and Harvard	BRD-K78419283			C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)c2cccnc2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19-,20-/m0/s1	YSDDRAAKFDNITG-KNTRFNDTSA-N	397.200156374							101861
BRD-K13190592	LSM-9221		54639055	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18-,19-/m0/s1	FGKXCNJDDMNFOM-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@@H]1NS(=O)(=O)Cc3ccccc3	BroadT	BRD-K13190592	BRD-K13190592-001-01-1	Broad Institute of MIT and Harvard	BRD-K13190592			OC[C@@H]1O[C@H](CCNC(=O)C2CCC2)CC[C@@H]1NS(=O)(=O)Cc1ccccc1	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18-,19-/m0/s1	FGKXCNJDDMNFOM-FHWLQOOXSA-N	410.18754277							97842
BRD-K74083848	LSM-12963		54639043	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16+,17+/m1/s1	QHWKOKDSIMAAGX-IKGGRYGDSA-N	COc1cccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)C)[C@H](CO)O2)c1	BroadT	BRD-K74083848	BRD-K74083848-001-01-6	Broad Institute of MIT and Harvard	BRD-K74083848			COc1cccc(CNC(=O)C[C@H]2CC[C@H](NC(C)=O)[C@H](CO)O2)c1	InChI=1S/C18H26N2O5/c1-12(22)20-16-7-6-15(25-17(16)11-21)9-18(23)19-10-13-4-3-5-14(8-13)24-2/h3-5,8,15-17,21H,6-7,9-11H2,1-2H3,(H,19,23)(H,20,22)/t15-,16+,17+/m1/s1	QHWKOKDSIMAAGX-IKGGRYGDSA-N	350.184171952							101600
BRD-K36250651	LSM-10619		54639141	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24-,25+/m1/s1	JZSLTRUJUOZFGD-SDHSZQHLSA-N	OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)c3ccccc3)CC[C@H]1NC(=O)Cc4cccnc4	BroadT	BRD-K36250651	BRD-K36250651-001-01-4	Broad Institute of MIT and Harvard	BRD-K36250651			OC[C@@H]1O[C@@H](CC(=O)Nc2ccc(cc2)-c2ccccc2)CC[C@H]1NC(=O)Cc1cccnc1	InChI=1S/C27H29N3O4/c31-18-25-24(30-26(32)15-19-5-4-14-28-17-19)13-12-23(34-25)16-27(33)29-22-10-8-21(9-11-22)20-6-2-1-3-7-20/h1-11,14,17,23-25,31H,12-13,15-16,18H2,(H,29,33)(H,30,32)/t23-,24-,25+/m1/s1	JZSLTRUJUOZFGD-SDHSZQHLSA-N	459.215806438							99240
BRD-K94025757	LSM-14191		54639160	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18+,19+/m1/s1	FKDHCSBIQDWEMT-NEWSRXKRSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)CC[C@@H]1NC(=O)C3CCOCC3	BroadT	BRD-K94025757	BRD-K94025757-001-01-2	Broad Institute of MIT and Harvard	BRD-K94025757			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2Cl)CC[C@@H]1NC(=O)C1CCOCC1	InChI=1S/C21H29ClN2O5/c22-17-4-2-1-3-15(17)12-23-20(26)11-16-5-6-18(19(13-25)29-16)24-21(27)14-7-9-28-10-8-14/h1-4,14,16,18-19,25H,5-13H2,(H,23,26)(H,24,27)/t16-,18+,19+/m1/s1	FKDHCSBIQDWEMT-NEWSRXKRSA-N	424.176499758							102845
BRD-K60188503	LSM-12069		54638955	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19-,22-/m1/s1	UDMIDSQAUXVXMN-CIVUBGFFSA-N	C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c4ccccc4	BroadT	BRD-K60188503	BRD-K60188503-001-01-5	Broad Institute of MIT and Harvard	BRD-K60188503			C[C@@H](NC(=O)C[C@@H]1O[C@H](CO)[C@H](NC(=O)Nc2ccc3OCOc3c2)C=C1)c1ccccc1	InChI=1S/C24H27N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-11,15,18-19,22,28H,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19-,22-/m1/s1	UDMIDSQAUXVXMN-CIVUBGFFSA-N	453.189985614							100695
BRD-K73127443	LSM-12907		54639081	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18-,20+/m1/s1	ZNMNRMGCWQWZTD-GGPKGHCWSA-N	COc1ccccc1S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)NCc3cccc(F)c3)O[C@H]2CO	BroadT	BRD-K73127443	BRD-K73127443-001-01-1	Broad Institute of MIT and Harvard	BRD-K73127443			COc1ccccc1S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)NCc2cccc(F)c2)O[C@H]1CO	InChI=1S/C22H27FN2O6S/c1-30-19-7-2-3-8-21(19)32(28,29)25-18-10-9-17(31-20(18)14-26)12-22(27)24-13-15-5-4-6-16(23)11-15/h2-8,11,17-18,20,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,18-,20+/m1/s1	ZNMNRMGCWQWZTD-GGPKGHCWSA-N	466.157385494							101544
BRD-K63813530	LSM-12314		54638891	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20+/m1/s1	YSDDRAAKFDNITG-XCLNPWKQSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)c2cccnc2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K63813530	BRD-K63813530-001-01-2	Broad Institute of MIT and Harvard	BRD-K63813530			C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)c2cccnc2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20+/m1/s1	YSDDRAAKFDNITG-XCLNPWKQSA-N	397.200156374							100941
BRD-K77660367	LSM-13176		54638894	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19-,20-/m1/s1	YSDDRAAKFDNITG-XWPNQZOQSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c3ccccc3	BroadT	BRD-K77660367	BRD-K77660367-001-01-9	Broad Institute of MIT and Harvard	BRD-K77660367			C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)c2cccnc2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18+,19-,20-/m1/s1	YSDDRAAKFDNITG-XWPNQZOQSA-N	397.200156374							101814
BRD-K84715825	LSM-13606		54638880	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16+/m1/s1	UGRHUCUWEJLITN-OAGGEKHMSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K84715825	BRD-K84715825-001-01-8	Broad Institute of MIT and Harvard	BRD-K84715825			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C=C[C@H]1NC(=O)c1ccncc1	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16+/m1/s1	UGRHUCUWEJLITN-OAGGEKHMSA-N	345.168856246							102251
BRD-K04585040	LSM-8709		54638983	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18-,19-/m1/s1	DCVAKYLGJMAIQD-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)c3cccc(F)c3	BroadT	BRD-K04585040	BRD-K04585040-001-01-1	Broad Institute of MIT and Harvard	BRD-K04585040			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCC2)CC[C@H]1NC(=O)c1cccc(F)c1	InChI=1S/C21H30FN3O4/c22-16-5-3-4-15(12-16)21(28)24-18-7-6-17(29-19(18)14-26)13-20(27)23-8-11-25-9-1-2-10-25/h3-5,12,17-19,26H,1-2,6-11,13-14H2,(H,23,27)(H,24,28)/t17-,18-,19-/m1/s1	DCVAKYLGJMAIQD-GUDVDZBRSA-N	407.22203467							97330
BRD-K29063218	LSM-10191		54639073	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13-,14+/m0/s1	BHRCWANBCSKYFS-MELADBBJSA-N	COCC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K29063218	BRD-K29063218-001-01-6	Broad Institute of MIT and Harvard	BRD-K29063218			COCC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C16H26N2O5/c1-22-11-15(20)17-13-6-5-12(23-14(13)10-19)9-16(21)18-7-3-2-4-8-18/h5-6,12-14,19H,2-4,7-11H2,1H3,(H,17,20)/t12-,13-,14+/m0/s1	BHRCWANBCSKYFS-MELADBBJSA-N	326.184171952							98812
BRD-K37684537	LSM-10709		54638878	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16-/m0/s1	UGRHUCUWEJLITN-JYJNAYRXSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K37684537	BRD-K37684537-001-01-3	Broad Institute of MIT and Harvard	BRD-K37684537			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C=C[C@@H]1NC(=O)c1ccncc1	InChI=1S/C18H23N3O4/c22-11-16-15(21-18(24)13-5-7-19-8-6-13)4-3-14(25-16)9-17(23)20-10-12-1-2-12/h3-8,12,14-16,22H,1-2,9-11H2,(H,20,23)(H,21,24)/t14-,15-,16-/m0/s1	UGRHUCUWEJLITN-JYJNAYRXSA-N	345.168856246							99330
BRD-K74009886	LSM-12958		54638996	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20-/m0/s1	GUCCOCGWZUYAMY-ZCNNSNEGSA-N	OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K74009886	BRD-K74009886-001-01-4	Broad Institute of MIT and Harvard	BRD-K74009886			OC[C@@H]1O[C@H](CC(=O)NCCc2ccncc2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C22H28N4O4/c27-15-20-19(26-22(29)13-17-3-1-2-9-24-17)5-4-18(30-20)14-21(28)25-12-8-16-6-10-23-11-7-16/h1-3,6-7,9-11,18-20,27H,4-5,8,12-15H2,(H,25,28)(H,26,29)/t18-,19+,20-/m0/s1	GUCCOCGWZUYAMY-ZCNNSNEGSA-N	412.211055416							101595
BRD-K13304927	LSM-9228		54638884	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19+,20+/m1/s1	NMMAJMJUDCVZMW-AABGKKOBSA-N	Cc1ccccc1S(=O)(=O)NCC[C@H]2CC[C@H](NS(=O)(=O)c3ccccc3C)[C@H](CO)O2	BroadT	BRD-K13304927	BRD-K13304927-001-01-4	Broad Institute of MIT and Harvard	BRD-K13304927			Cc1ccccc1S(=O)(=O)NCC[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2C)[C@H](CO)O1	InChI=1S/C22H30N2O6S2/c1-16-7-3-5-9-21(16)31(26,27)23-14-13-18-11-12-19(20(15-25)30-18)24-32(28,29)22-10-6-4-8-17(22)2/h3-10,18-20,23-25H,11-15H2,1-2H3/t18-,19+,20+/m1/s1	NMMAJMJUDCVZMW-AABGKKOBSA-N	482.15452808							97849
CHEMBL2130663	LSM-10042	BRD-K26606423, SID131435345	54639060	InChI=1S/C15H21N5O2/c16-12-5-4-11(22-15(12)10-21)6-8-20-9-14(18-19-20)13-3-1-2-7-17-13/h1-3,7,9,11-12,15,21H,4-6,8,10,16H2/t11-,12+,15-/m1/s1	UZCFPAZMYSFTCU-TYNCELHUSA-N	N[C@H]1CC[C@H](CCn2cc(nn2)c3ccccn3)O[C@@H]1CO	BroadT	BRD-K26606423	BRD-K26606423-001-01-6	Broad Institute of MIT and Harvard	BRD-K26606423			N[C@H]1CC[C@H](CCn2cc(nn2)-c2ccccn2)O[C@@H]1CO	InChI=1S/C15H21N5O2/c16-12-5-4-11(22-15(12)10-21)6-8-20-9-14(18-19-20)13-3-1-2-7-17-13/h1-3,7,9,11-12,15,21H,4-6,8,10,16H2/t11-,12+,15-/m1/s1	UZCFPAZMYSFTCU-TYNCELHUSA-N	303.169524962							98663
BRD-K75095704	LSM-13029		54638854	InChI=1S/C24H30N4O5S/c1-32-21-9-5-8-19(14-21)23-15-28(27-25-23)13-12-20-10-11-22(24(16-29)33-20)26-34(30,31)17-18-6-3-2-4-7-18/h2-9,14-15,20,22,24,26,29H,10-13,16-17H2,1H3/t20-,22+,24+/m0/s1	LQIYJTVMCFCXBS-BGWNEDDSSA-N	COc1cccc(c1)c2cn(CC[C@@H]3CC[C@@H](NS(=O)(=O)Cc4ccccc4)[C@@H](CO)O3)nn2	BroadT	BRD-K75095704	BRD-K75095704-001-01-2	Broad Institute of MIT and Harvard	BRD-K75095704			COc1cccc(c1)-c1cn(CC[C@@H]2CC[C@@H](NS(=O)(=O)Cc3ccccc3)[C@@H](CO)O2)nn1	InChI=1S/C24H30N4O5S/c1-32-21-9-5-8-19(14-21)23-15-28(27-25-23)13-12-20-10-11-22(24(16-29)33-20)26-34(30,31)17-18-6-3-2-4-7-18/h2-9,14-15,20,22,24,26,29H,10-13,16-17H2,1H3/t20-,22+,24+/m0/s1	LQIYJTVMCFCXBS-BGWNEDDSSA-N	486.19369079							101666
BRD-K50149017	LSM-11478		54639095	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15+,19-/m1/s1	OAEJMSHQDKFBTQ-ZRGWGRIASA-N	OC[C@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)c3ccc4OCOc4c3	BroadT	BRD-K50149017	BRD-K50149017-001-01-8	Broad Institute of MIT and Harvard	BRD-K50149017			OC[C@H]1O[C@@H](CCNC(=O)c2cnccn2)CC[C@@H]1NC(=O)c1ccc2OCOc2c1	InChI=1S/C21H24N4O6/c26-11-19-15(25-20(27)13-1-4-17-18(9-13)30-12-29-17)3-2-14(31-19)5-6-24-21(28)16-10-22-7-8-23-16/h1,4,7-10,14-15,19,26H,2-3,5-6,11-12H2,(H,24,28)(H,25,27)/t14-,15+,19-/m1/s1	OAEJMSHQDKFBTQ-ZRGWGRIASA-N	428.169584528							100099
BRD-K16704189	LSM-9435		54639027	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22+,23+/m1/s1	QIJBHKKZJCMHEO-VJBWXMMDSA-N	OC[C@@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)Nc4cccc(Cl)c4	BroadT	BRD-K16704189	BRD-K16704189-001-01-5	Broad Institute of MIT and Harvard	BRD-K16704189			OC[C@@H]1O[C@@H](CCn2cc(Cc3ccccc3)nn2)CC[C@@H]1NC(=O)Nc1cccc(Cl)c1	InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22+,23+/m1/s1	QIJBHKKZJCMHEO-VJBWXMMDSA-N	469.188067516							98056
BRD-K21536131	LSM-9735		54638866	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18+,20-/m1/s1	OLUPXTRBOWIZHH-IMFGXOCKSA-N	COc1ccccc1NC(=O)N[C@H]2CC[C@H](CCn3cc(nn3)C4(O)CCCC4)O[C@@H]2CO	BroadT	BRD-K21536131	BRD-K21536131-001-01-3	Broad Institute of MIT and Harvard	BRD-K21536131			COc1ccccc1NC(=O)N[C@H]1CC[C@H](CCn2cc(nn2)C2(O)CCCC2)O[C@@H]1CO	InChI=1S/C23H33N5O5/c1-32-19-7-3-2-6-17(19)24-22(30)25-18-9-8-16(33-20(18)15-29)10-13-28-14-21(26-27-28)23(31)11-4-5-12-23/h2-3,6-7,14,16,18,20,29,31H,4-5,8-13,15H2,1H3,(H2,24,25,30)/t16-,18+,20-/m1/s1	OLUPXTRBOWIZHH-IMFGXOCKSA-N	459.248169206							98356
BRD-K88104720	LSM-13840		54638906	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20-/m0/s1	YSDDRAAKFDNITG-QLIIJSOBSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)c2cccnc2)[C@H](CO)O1)c3ccccc3	BroadT	BRD-K88104720	BRD-K88104720-001-01-7	Broad Institute of MIT and Harvard	BRD-K88104720			C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)c2cccnc2)[C@H](CO)O1)c1ccccc1	InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)24-21(27)12-18-9-10-19(20(14-26)29-18)25-22(28)17-8-5-11-23-13-17/h2-8,11,13,15,18-20,26H,9-10,12,14H2,1H3,(H,24,27)(H,25,28)/t15-,18-,19+,20-/m0/s1	YSDDRAAKFDNITG-QLIIJSOBSA-N	397.200156374							102491
BRD-K12884539	LSM-9194		54639020	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16-,19-/m1/s1	OCHDOPTVTSINTO-GPMSIDNRSA-N	CN1CCN(CC1)C(=O)C[C@H]2CC[C@@H](NC(=O)c3ccc4OCOc4c3)[C@@H](CO)O2	BroadT	BRD-K12884539	BRD-K12884539-001-01-6	Broad Institute of MIT and Harvard	BRD-K12884539			CN1CCN(CC1)C(=O)C[C@H]1CC[C@@H](NC(=O)c2ccc3OCOc3c2)[C@@H](CO)O1	InChI=1S/C21H29N3O6/c1-23-6-8-24(9-7-23)20(26)11-15-3-4-16(19(12-25)30-15)22-21(27)14-2-5-17-18(10-14)29-13-28-17/h2,5,10,15-16,19,25H,3-4,6-9,11-13H2,1H3,(H,22,27)/t15-,16-,19-/m1/s1	OCHDOPTVTSINTO-GPMSIDNRSA-N	419.205635678							97815
BRD-K82822203	LSM-13488		54639054	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18-,19+/m1/s1	FGKXCNJDDMNFOM-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@H]1NS(=O)(=O)Cc3ccccc3	BroadT	BRD-K82822203	BRD-K82822203-001-01-6	Broad Institute of MIT and Harvard	BRD-K82822203			OC[C@@H]1O[C@@H](CCNC(=O)C2CCC2)CC[C@H]1NS(=O)(=O)Cc1ccccc1	InChI=1S/C20H30N2O5S/c23-13-19-18(22-28(25,26)14-15-5-2-1-3-6-15)10-9-17(27-19)11-12-21-20(24)16-7-4-8-16/h1-3,5-6,16-19,22-23H,4,7-14H2,(H,21,24)/t17-,18-,19+/m1/s1	FGKXCNJDDMNFOM-QRVBRYPASA-N	410.18754277							102128
BRD-K31487253	LSM-10337		54639000	InChI=1S/C23H34N4O5S/c1-31-21-9-5-6-10-23(21)33(29,30)25-19-12-11-18(32-22(19)16-28)13-14-27-15-20(24-26-27)17-7-3-2-4-8-17/h5-6,9-10,15,17-19,22,25,28H,2-4,7-8,11-14,16H2,1H3/t18-,19-,22-/m0/s1	HBWIVVUPODMQBV-IPJJNNNSSA-N	COc1ccccc1S(=O)(=O)N[C@H]2CC[C@@H](CCn3cc(nn3)C4CCCCC4)O[C@H]2CO	BroadT	BRD-K31487253	BRD-K31487253-001-01-9	Broad Institute of MIT and Harvard	BRD-K31487253			COc1ccccc1S(=O)(=O)N[C@H]1CC[C@@H](CCn2cc(nn2)C2CCCCC2)O[C@H]1CO	InChI=1S/C23H34N4O5S/c1-31-21-9-5-6-10-23(21)33(29,30)25-19-12-11-18(32-22(19)16-28)13-14-27-15-20(24-26-27)17-7-3-2-4-8-17/h5-6,9-10,15,17-19,22,25,28H,2-4,7-8,11-14,16H2,1H3/t18-,19-,22-/m0/s1	HBWIVVUPODMQBV-IPJJNNNSSA-N	478.224990918							98958
ST037349	LSM-34582	SID24813257, BRD-K47910511	723174	InChI=1S/C20H17N3O2/c24-19-13-7-3-2-6-12(13)18-16-14(20(25)22-21-18)8-9-15(17(16)19)23-10-4-1-5-11-23/h2-3,6-9,24H,1,4-5,10-11H2	KCMDZSIUPJHYKH-UHFFFAOYSA-N	Oc1c2ccccc2c3N=NC(=O)c4ccc(N5CCCCC5)c1c34	BroadT	BRD-K47910511	BRD-K47910511-001-05-1	ChemDiv Inc.	8010-7090			Oc1c2ccccc2c2N=NC(=O)c3ccc(N4CCCCC4)c1c23	InChI=1S/C20H17N3O2/c24-19-13-7-3-2-6-12(13)18-16-14(20(25)22-21-18)8-9-15(17(16)19)23-10-4-1-5-11-23/h2-3,6-9,24H,1,4-5,10-11H2	KCMDZSIUPJHYKH-UHFFFAOYSA-N	331.132076814							
AN-329/42581110	LSM-34583	SID17387580, BRD-K26252468	1791579	InChI=1S/C12H15BrN2O2S/c1-7(2)14-12(18)15-11(16)8-4-5-10(17-3)9(13)6-8/h4-7H,1-3H3,(H2,14,15,16,18)	MBVNCKWMUMLRFQ-UHFFFAOYSA-N	COc1ccc(cc1Br)C(=O)NC(=S)NC(C)C	BroadT	BRD-K26252468	BRD-K26252468-001-05-6	Specs	AN-329/42581110			COc1ccc(cc1Br)C(=O)NC(=S)NC(C)C	InChI=1S/C12H15BrN2O2S/c1-7(2)14-12(18)15-11(16)8-4-5-10(17-3)9(13)6-8/h4-7H,1-3H3,(H2,14,15,16,18)	MBVNCKWMUMLRFQ-UHFFFAOYSA-N	330.00376103							123141
AC1LQBD5	LSM-34584	BRD-K14921248	1321695	InChI=1S/C14H11BrN6O3/c1-23-13(22)11-6-8(15)2-4-10(11)12-5-3-9(24-12)7-17-21-14(16)18-19-20-21/h2-7H,1H3,(H2,16,18,20)	RLRMMAQSZVIICE-UHFFFAOYSA-N	COC(=O)c1cc(Br)ccc1c2oc(C=Nn3nnnc3N)cc2	BroadT	BRD-K14921248	BRD-K14921248-001-05-7	ChemBridge Corporation	6855972			COC(=O)c1cc(Br)ccc1-c1ccc(C=Nn2nnnc2N)o1	InChI=1S/C14H11BrN6O3/c1-23-13(22)11-6-8(15)2-4-10(11)12-5-3-9(24-12)7-17-21-14(16)18-19-20-21/h2-7H,1H3,(H2,16,18,20)	RLRMMAQSZVIICE-UHFFFAOYSA-N	390.007600872							123142
T5220363	LSM-34585	SID17516232, BRD-K48691025	2423952	InChI=1S/C22H20N4/c1-16-11-13-18(14-12-16)26-22(24-20-10-6-5-9-19(20)23)15-21(25-26)17-7-3-2-4-8-17/h2-15,24H,23H2,1H3	PMUPQNIDIMQBFR-UHFFFAOYSA-N	Cc1ccc(cc1)n2nc(cc2Nc3ccccc3N)c4ccccc4	BroadT	BRD-K48691025	BRD-K48691025-001-05-5	Enamine Ltd.	T5220363			Cc1ccc(cc1)-n1nc(cc1Nc1ccccc1N)-c1ccccc1	InChI=1S/C22H20N4/c1-16-11-13-18(14-12-16)26-22(24-20-10-6-5-9-19(20)23)15-21(25-26)17-7-3-2-4-8-17/h2-15,24H,23H2,1H3	PMUPQNIDIMQBFR-UHFFFAOYSA-N	340.16879668							123143
BDBM37837	LSM-34586	BRD-A56061970	44510588	InChI=1S/C20H15NO4S/c22-18(15-9-5-11-26-15)16-17(13-6-2-1-3-7-13)21(20(24)19(16)23)12-14-8-4-10-25-14/h1-11,16-17H,12H2	RDDSSNCMUUKINF-UHFFFAOYSA-N	O=C(C1C(N(Cc2occc2)C(=O)C1=O)c3ccccc3)c4cccs4	BroadT	BRD-A56061970	BRD-A56061970-001-06-5	ChemBridge Corporation	7319572			O=C(C1C(N(Cc2ccco2)C(=O)C1=O)c1ccccc1)c1cccs1	InChI=1S/C20H15NO4S/c22-18(15-9-5-11-26-15)16-17(13-6-2-1-3-7-13)21(20(24)19(16)23)12-14-8-4-10-25-14/h1-11,16-17H,12H2	RDDSSNCMUUKINF-UHFFFAOYSA-N	365.07217866							123144
MLS000096952	LSM-34587	SID4263674, BRD-K65416179	1305820	InChI=1S/C20H15ClN4O3S/c1-12-17(18(25-28-12)13-5-3-2-4-6-13)19(26)22-20-24-23-16(29-20)11-27-15-9-7-14(21)8-10-15/h2-10H,11H2,1H3,(H,22,24,26)	VWQXRTXWFPMFHU-UHFFFAOYSA-N	Cc1onc(c2ccccc2)c1C(=O)Nc3nnc(COc4ccc(Cl)cc4)s3	BroadT	BRD-K65416179	BRD-K65416179-001-05-9	ChemBridge Corporation	7683494			Cc1onc(c1C(=O)Nc1nnc(COc2ccc(Cl)cc2)s1)-c1ccccc1	InChI=1S/C20H15ClN4O3S/c1-12-17(18(25-28-12)13-5-3-2-4-6-13)19(26)22-20-24-23-16(29-20)11-27-15-9-7-14(21)8-10-15/h2-10H,11H2,1H3,(H,22,24,26)	VWQXRTXWFPMFHU-UHFFFAOYSA-N	426.05533878							123145
STK612974	LSM-44501	SID26671260, BRD-K02090812	1354480	InChI=1S/C18H16BrN3O3/c1-10-8-12(11(2)21(10)3)9-15-16(23)20-18(25)22(17(15)24)14-6-4-13(19)5-7-14/h4-9H,1-3H3,(H,20,23,25)/b15-9-	SQNZSJFUVRJCCH-DHDCSXOGSA-N	Cc1cc(\C=C/2\C(=O)NC(=O)N(C2=O)c3ccc(Br)cc3)c(C)n1C	BroadT	BRD-K02090812	BRD-K02090812-001-06-9	InterBioScreen Ltd.	STOCK2S-37323			Cc1cc(\C=C2\C(=O)NC(=O)N(C2=O)c2ccc(Br)cc2)c(C)n1C	InChI=1S/C18H16BrN3O3/c1-10-8-12(11(2)21(10)3)9-15-16(23)20-18(25)22(17(15)24)14-6-4-13(19)5-7-14/h4-9H,1-3H3,(H,20,23,25)/b15-9-	SQNZSJFUVRJCCH-DHDCSXOGSA-N	401.037504002							
MLS000032196	LSM-34589	SID842521, BRD-K80092929	644791	InChI=1S/C18H21N5O3/c1-2-3-10-25-15-8-6-14(7-9-15)18-20-22-23(21-18)13-17(24)19-12-16-5-4-11-26-16/h4-9,11H,2-3,10,12-13H2,1H3,(H,19,24)	JUHBAVDRLGEFCZ-UHFFFAOYSA-N	CCCCOc1ccc(cc1)c2nnn(CC(=O)NCc3occc3)n2	BroadT	BRD-K80092929	BRD-K80092929-001-06-0	Asinex Ltd.	ASN 04247384			CCCCOc1ccc(cc1)-c1nnn(CC(=O)NCc2ccco2)n1	InChI=1S/C18H21N5O3/c1-2-3-10-25-15-8-6-14(7-9-15)18-20-22-23(21-18)13-17(24)19-12-16-5-4-11-26-16/h4-9,11H,2-3,10,12-13H2,1H3,(H,19,24)	JUHBAVDRLGEFCZ-UHFFFAOYSA-N	355.164439582							123147
T5376318	LSM-34590	SID26658032, BRD-K16942891	6212642	InChI=1S/C23H21NO5/c1-28-18-11-13(12-19(29-2)22(18)25)10-14-6-5-8-16-20(23(26)27)15-7-3-4-9-17(15)24-21(14)16/h3-4,7,9-12,25H,5-6,8H2,1-2H3,(H,26,27)/b14-10+	HHQNQCNSFXXARE-GXDHUFHOSA-N	COc1cc(\C=C\2/CCCc3c(C(=O)O)c4ccccc4nc23)cc(OC)c1O	BroadT	BRD-K16942891	BRD-K16942891-001-06-9	Enamine Ltd.	ZT-2706600			COc1cc(cc(OC)c1O)\C=C1/CCCc2c1nc1ccccc1c2C(O)=O	InChI=1S/C23H21NO5/c1-28-18-11-13(12-19(29-2)22(18)25)10-14-6-5-8-16-20(23(26)27)15-7-3-4-9-17(15)24-21(14)16/h3-4,7,9-12,25H,5-6,8H2,1-2H3,(H,26,27)/b14-10+	HHQNQCNSFXXARE-GXDHUFHOSA-N	391.141972782							
AC1LZOFW	LSM-34591	BRD-K70220242	1979248	InChI=1S/C19H16BrN4O2S2/c1-12-9-13(2)11-24(10-12)19-18(21-14-5-3-4-6-15(14)22-19)23-28(25,26)17-8-7-16(20)27-17/h3-11H,1-2H3,(H,21,23)/q+1	LDIIKRJIDKASJP-UHFFFAOYSA-N	Cc1cc(C)c[n+](c1)c2nc3ccccc3nc2NS(=O)(=O)c4ccc(Br)s4	BroadT	BRD-K70220242	BRD-K70220242-001-07-7	InterBioScreen Ltd.	STOCK3S-33704			Cc1cc(C)c[n+](c1)-c1nc2ccccc2nc1NS(=O)(=O)c1ccc(Br)s1	InChI=1S/C19H16BrN4O2S2/c1-12-9-13(2)11-24(10-12)19-18(21-14-5-3-4-6-15(14)22-19)23-28(25,26)17-8-7-16(20)27-17/h3-11H,1-2H3,(H,21,23)/q+1	LDIIKRJIDKASJP-UHFFFAOYSA-N	474.989804772							123149
ZINC00450188	LSM-34592	SID14740138, BRD-K38279663	879962	InChI=1S/C15H12ClN3O2S/c1-2-13-18-19-15(22-13)17-14(20)12-8-7-11(21-12)9-3-5-10(16)6-4-9/h3-8H,2H2,1H3,(H,17,19,20)	UKRYSXLSWSVBHE-UHFFFAOYSA-N	CCc1nnc(NC(=O)c2oc(cc2)c3ccc(Cl)cc3)s1	BroadT	BRD-K38279663	BRD-K38279663-001-05-8	ChemBridge Corporation	6230549			CCc1nnc(NC(=O)c2ccc(o2)-c2ccc(Cl)cc2)s1	InChI=1S/C15H12ClN3O2S/c1-2-13-18-19-15(22-13)17-14(20)12-8-7-11(21-12)9-3-5-10(16)6-4-9/h3-8H,2H2,1H3,(H,17,19,20)	UKRYSXLSWSVBHE-UHFFFAOYSA-N	333.033875054							123150
AC1NTWO1	LSM-34593	SID863358, BRD-A37420437	5389857	InChI=1S/C20H16N4/c1-20(14-10-12-21-13-11-14)23-16-7-3-2-6-15(16)19-22-17-8-4-5-9-18(17)24(19)20/h2-13,23H,1H3	ZRZMLKAZUBVMMI-UHFFFAOYSA-N	CC1(Nc2ccccc2c3nc4ccccc4n13)c5ccncc5	BroadT	BRD-A37420437	BRD-A37420437-001-06-4	InterBioScreen Ltd.	STOCK4S-71362			CC1(Nc2ccccc2-c2nc3ccccc3n12)c1ccncc1	InChI=1S/C20H16N4/c1-20(14-10-12-21-13-11-14)23-16-7-3-2-6-15(16)19-22-17-8-4-5-9-18(17)24(19)20/h2-13,23H,1H3	ZRZMLKAZUBVMMI-UHFFFAOYSA-N	312.137496552							
STK330363	LSM-34594	SID24780947, BRD-K97506154	3327769	InChI=1S/C19H15N3O2S/c1-12(23)15-17(21-18(24)14-10-6-3-7-11-14)20-16(22-19(15)25)13-8-4-2-5-9-13/h2-11H,1H3,(H2,20,21,22,24,25)	RKNWDNVKVPSWCW-UHFFFAOYSA-N	CC(=O)c1c(S)nc(nc1NC(=O)c2ccccc2)c3ccccc3	BroadT	BRD-K97506154	BRD-K97506154-001-05-8	ChemDiv Inc.	6623-0923			CC(=O)c1c(S)nc(nc1NC(=O)c1ccccc1)-c1ccccc1	InChI=1S/C19H15N3O2S/c1-12(23)15-17(21-18(24)14-10-6-3-7-11-14)20-16(22-19(15)25)13-8-4-2-5-9-13/h2-11H,1H3,(H2,20,21,22,24,25)	RKNWDNVKVPSWCW-UHFFFAOYSA-N	349.08849744							123152
MLS000571322	LSM-44502	SID17412396, BRD-K34708533	718487	InChI=1S/C16H22BrNO2/c1-11(2)18(12(3)4)16(19)9-7-13-6-8-15(20-5)14(17)10-13/h6-12H,1-5H3/b9-7+	APDMHZKESGQPPV-VQHVLOKHSA-N	COc1ccc(\C=C\C(=O)N(C(C)C)C(C)C)cc1Br	BroadT	BRD-K34708533	BRD-K34708533-001-06-6	ChemBridge Corporation	5937225			COc1ccc(cc1Br)\C=C\C(=O)N(C(C)C)C(C)C	InChI=1S/C16H22BrNO2/c1-11(2)18(12(3)4)16(19)9-7-13-6-8-15(20-5)14(17)10-13/h6-12H,1-5H3/b9-7+	APDMHZKESGQPPV-VQHVLOKHSA-N	339.083391554							
MLS-0240968.0001	LSM-34596	SID24385325, SID24813168, SID56373491, BRD-K59908227	16009021	InChI=1S/C21H30N8O2/c1-4-28(5-2)14-8-13-22-18(30)11-12-19(31)25-26-21-24-17-10-7-6-9-16(17)20-23-15(3)27-29(20)21/h6-7,9-10H,4-5,8,11-14H2,1-3H3,(H,22,30)(H,24,26)(H,25,31)	AALPWUGBAOXTOC-UHFFFAOYSA-N	CCN(CC)CCCNC(=O)CCC(=O)NNc1nc2ccccc2c3nc(C)nn13	BroadT	BRD-K59908227	BRD-K59908227-001-07-1	ChemDiv Inc.	C600-0039			CCN(CC)CCCNC(=O)CCC(=O)NNc1nc2ccccc2c2nc(C)nn12	InChI=1S/C21H30N8O2/c1-4-28(5-2)14-8-13-22-18(30)11-12-19(31)25-26-21-24-17-10-7-6-9-16(17)20-23-15(3)27-29(20)21/h6-7,9-10H,4-5,8,11-14H2,1-3H3,(H,22,30)(H,24,26)(H,25,31)	AALPWUGBAOXTOC-UHFFFAOYSA-N	426.24917228							123154
AC1LH1M5	LSM-34597	BRD-K76031922	830636	InChI=1S/C15H13N3O4/c1-11(19)15(17-16-12-5-3-2-4-6-12)22-14-9-7-13(8-10-14)18(20)21/h2-10,16H,1H3	STIQDWNLCUIMME-UHFFFAOYSA-N	CC(=O)C(=NNc1ccccc1)Oc2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-K76031922	BRD-K76031922-001-05-3	Specs	AF-886/30762055			CC(=O)C(Oc1ccc(cc1)[N+]([O-])=O)=NNc1ccccc1	InChI=1S/C15H13N3O4/c1-11(19)15(17-16-12-5-3-2-4-6-12)22-14-9-7-13(8-10-14)18(20)21/h2-10,16H,1H3	STIQDWNLCUIMME-UHFFFAOYSA-N	299.090605926							123155
MLS000538065	LSM-34598	SID17388595, BRD-K04125748	850682	InChI=1S/C18H16N2O3/c1-13-17(12-19-20(13)14-6-4-3-5-7-14)18(21)23-16-10-8-15(22-2)9-11-16/h3-12H,1-2H3	KECZBGOYTMZNHZ-UHFFFAOYSA-N	COc1ccc(OC(=O)c2cnn(c2C)c3ccccc3)cc1	BroadT	BRD-K04125748	BRD-K04125748-001-06-0	Specs	AP-501/42818406			COc1ccc(OC(=O)c2cnn(c2C)-c2ccccc2)cc1	InChI=1S/C18H16N2O3/c1-13-17(12-19-20(13)14-6-4-3-5-7-14)18(21)23-16-10-8-15(22-2)9-11-16/h3-12H,1-2H3	KECZBGOYTMZNHZ-UHFFFAOYSA-N	308.116092392							123156
ST50073235	LSM-34599	SID4240923, BRD-K03987599	1582019	InChI=1S/C20H25N3O4S/c1-2-23-17-7-8-18(15-5-3-6-16(19(15)17)20(23)24)28(25,26)21-9-4-10-22-11-13-27-14-12-22/h3,5-8,21H,2,4,9-14H2,1H3	MOSVYFYSQBDGJR-UHFFFAOYSA-N	CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)NCCCN4CCOCC4	BroadT	BRD-K03987599	BRD-K03987599-001-05-6	ChemDiv Inc.	4550-6445			CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)NCCCN1CCOCC1	InChI=1S/C20H25N3O4S/c1-2-23-17-7-8-18(15-5-3-6-16(19(15)17)20(23)24)28(25,26)21-9-4-10-22-11-13-27-14-12-22/h3,5-8,21H,2,4,9-14H2,1H3	MOSVYFYSQBDGJR-UHFFFAOYSA-N	403.156577							123157
STK287059	LSM-44503	SID14734729, BRD-A20320131	5739891	InChI=1S/C18H21N3O6/c1-4-11(3)27-14-9-7-12(10-15(14)26-5-2)6-8-13-16(21(24)25)17(22)20-18(23)19-13/h6-11H,4-5H2,1-3H3,(H2,19,20,22,23)/b8-6-	DSADXIMEVUBUNH-VURMDHGXSA-N	CCOc1cc(\C=C/c2nc(O)nc(O)c2[N+](=O)[O-])ccc1OC(C)CC	BroadT	BRD-A20320131	BRD-A20320131-001-05-6	ChemBridge Corporation	7819072			CCOc1cc(\C=C/c2nc(O)nc(O)c2[N+]([O-])=O)ccc1OC(C)CC	InChI=1S/C18H21N3O6/c1-4-11(3)27-14-9-7-12(10-15(14)26-5-2)6-8-13-16(21(24)25)17(22)20-18(23)19-13/h6-11H,4-5H2,1-3H3,(H2,19,20,22,23)/b8-6-	DSADXIMEVUBUNH-VURMDHGXSA-N	375.143035422							
AC1M07WZ	LSM-34601	BRD-K21259159	1992382	InChI=1S/C23H19N5O4S2/c1-31-17-10-9-14(12-18(17)32-2)13-25-28-22(24)21(34(29,30)19-8-5-11-33-19)20-23(28)27-16-7-4-3-6-15(16)26-20/h3-13H,24H2,1-2H3	JJXANODGAGQYSU-UHFFFAOYSA-N	COc1ccc(C=Nn2c(N)c(c3nc4ccccc4nc23)S(=O)(=O)c5cccs5)cc1OC	BroadT	BRD-K21259159	BRD-K21259159-001-05-0	InterBioScreen Ltd.	STOCK4S-67019			COc1ccc(C=Nn2c(N)c(c3nc4ccccc4nc23)S(=O)(=O)c2cccs2)cc1OC	InChI=1S/C23H19N5O4S2/c1-31-17-10-9-14(12-18(17)32-2)13-25-28-22(24)21(34(29,30)19-8-5-11-33-19)20-23(28)27-16-7-4-3-6-15(16)26-20/h3-13H,24H2,1-2H3	JJXANODGAGQYSU-UHFFFAOYSA-N	493.087845518							123159
N~4~-(4-fluorophenyl)-n~5~-(2-nitrophenyl)-1H-imidazole-4,5-dicarboxamide	LSM-34602	SID17503943, BRD-K30347452	2947008	InChI=1S/C17H12FN5O4/c18-10-5-7-11(8-6-10)21-16(24)14-15(20-9-19-14)17(25)22-12-3-1-2-4-13(12)23(26)27/h1-9H,(H,19,20)(H,21,24)(H,22,25)	NKOGVOYFHSQZEN-UHFFFAOYSA-N	[O-][N+](=O)c1ccccc1NC(=O)c2[nH]cnc2C(=O)Nc3ccc(F)cc3	BroadT	BRD-K30347452	BRD-K30347452-001-05-6	ChemBridge Corporation	7676876			[O-][N+](=O)c1ccccc1NC(=O)c1[nH]cnc1C(=O)Nc1ccc(F)cc1	InChI=1S/C17H12FN5O4/c18-10-5-7-11(8-6-10)21-16(24)14-15(20-9-19-14)17(25)22-12-3-1-2-4-13(12)23(26)27/h1-9H,(H,19,20)(H,21,24)(H,22,25)	NKOGVOYFHSQZEN-UHFFFAOYSA-N	369.087332114							123160
(4-Methoxyphenyl)(1-methyl-2-propyl-1H-imidazol-5-yl)methanone	LSM-34603	SID4264174, BRD-K86163796	791826	InChI=1S/C15H18N2O2/c1-4-5-14-16-10-13(17(14)2)15(18)11-6-8-12(19-3)9-7-11/h6-10H,4-5H2,1-3H3	XBWPIZLRRZNKAD-UHFFFAOYSA-N	CCCc1ncc(C(=O)c2ccc(OC)cc2)n1C	BroadT	BRD-K86163796	BRD-K86163796-001-05-5	ChemBridge Corporation	5561441			CCCc1ncc(C(=O)c2ccc(OC)cc2)n1C	InChI=1S/C15H18N2O2/c1-4-5-14-16-10-13(17(14)2)15(18)11-6-8-12(19-3)9-7-11/h6-10H,4-5H2,1-3H3	XBWPIZLRRZNKAD-UHFFFAOYSA-N	258.136827836							123161
AC1MCCPM	LSM-44504	BRD-K36221820	2766442	InChI=1S/C19H17Cl4N3O2/c1-26(2)10-13(19(27)25-15-5-6-16(21)18(23)8-15)9-24-28-11-12-3-4-14(20)7-17(12)22/h3-10H,11H2,1-2H3,(H,25,27)/b13-10+,24-9?	FXJMTWDBKRIUPT-DVZRBVNFSA-N	CN(C)\C=C(/C=NOCc1ccc(Cl)cc1Cl)\C(=O)Nc2ccc(Cl)c(Cl)c2	BroadT	BRD-K36221820	BRD-K36221820-001-07-8	Key Organics Ltd.	11D-035			CN(C)\C=C(/C=NOCc1ccc(Cl)cc1Cl)C(=O)Nc1ccc(Cl)c(Cl)c1	InChI=1S/C19H17Cl4N3O2/c1-26(2)10-13(19(27)25-15-5-6-16(21)18(23)8-15)9-24-28-11-12-3-4-14(20)7-17(12)22/h3-10H,11H2,1-2H3,(H,25,27)/b13-10+,24-9?	FXJMTWDBKRIUPT-DVZRBVNFSA-N	459.007487654							
T5235042	LSM-34605	SID3716109, BRD-A83852736	2999476	InChI=1S/C20H17N3O4S2/c1-24-14-5-2-12(3-6-14)19-21-9-15(29-19)10-28-20-23-22-18(27-20)13-4-7-16-17(8-13)26-11-25-16/h2-8,15H,9-11H2,1H3	VMUIILLRSVYCCU-UHFFFAOYSA-N	COc1ccc(cc1)C2=NCC(CSc3oc(nn3)c4ccc5OCOc5c4)S2	BroadT	BRD-A83852736	BRD-A83852736-001-06-9	Enamine Ltd.	T5235042			COc1ccc(cc1)C1=NCC(CSc2nnc(o2)-c2ccc3OCOc3c2)S1	InChI=1S/C20H17N3O4S2/c1-24-14-5-2-12(3-6-14)19-21-9-15(29-19)10-28-20-23-22-18(27-20)13-4-7-16-17(8-13)26-11-25-16/h2-8,15H,9-11H2,1H3	VMUIILLRSVYCCU-UHFFFAOYSA-N	427.066047434							123163
MLS001017528	LSM-34606	SID24825371, BRD-K39425984	4832447	InChI=1S/C15H13N3O6S/c19-12(17-15(21)16-8-10-4-2-1-3-5-10)9-24-14(20)11-6-7-13(25-11)18(22)23/h1-7H,8-9H2,(H2,16,17,19,21)	AAORDTZDTMACMK-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(s1)C(=O)OCC(=O)NC(=O)NCc2ccccc2	BroadT	BRD-K39425984	BRD-K39425984-001-05-8	Enamine Ltd.	T5296696			[O-][N+](=O)c1ccc(s1)C(=O)OCC(=O)NC(=O)NCc1ccccc1	InChI=1S/C15H13N3O6S/c19-12(17-15(21)16-8-10-4-2-1-3-5-10)9-24-14(20)11-6-7-13(25-11)18(22)23/h1-7H,8-9H2,(H2,16,17,19,21)	AAORDTZDTMACMK-UHFFFAOYSA-N	363.052505856							123164
MLS000552765	LSM-44505	SID14742457, BRD-K98073502	744701	InChI=1S/C13H13NO2S/c1-3-12(15)14(2)8-11-13(16)9-6-4-5-7-10(9)17-11/h4-8H,3H2,1-2H3/b11-8-	GRUBXNOZRDXRIR-FLIBITNWSA-N	CCC(=O)N(C)\C=C\1/Sc2ccccc2C1=O	BroadT	BRD-K98073502	BRD-K98073502-001-06-5	InterBioScreen Ltd.	STOCK1S-70849			CCC(=O)N(C)\C=C1/Sc2ccccc2C1=O	InChI=1S/C13H13NO2S/c1-3-12(15)14(2)8-11-13(16)9-6-4-5-7-10(9)17-11/h4-8H,3H2,1-2H3/b11-8-	GRUBXNOZRDXRIR-FLIBITNWSA-N	247.066699356							
1-(Furan-2-ylmethyl)-3-(2-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea	LSM-34608	SID17509515, BRD-K19411733	3372998	InChI=1S/C19H19N3OS/c1-15-6-2-3-9-18(15)21-19(24)22(14-17-8-5-11-23-17)13-16-7-4-10-20-12-16/h2-12H,13-14H2,1H3,(H,21,24)	SCKDJBQVQXLHRG-UHFFFAOYSA-N	Cc1ccccc1N=C(S)N(Cc2occc2)Cc3cccnc3	BroadT	BRD-K19411733	BRD-K19411733-001-05-6	ChemDiv Inc.	K784-4469			Cc1ccccc1N=C(S)N(Cc1ccco1)Cc1cccnc1	InChI=1S/C19H19N3OS/c1-15-6-2-3-9-18(15)21-19(24)22(14-17-8-5-11-23-17)13-16-7-4-10-20-12-16/h2-12H,13-14H2,1H3,(H,21,24)	SCKDJBQVQXLHRG-UHFFFAOYSA-N	337.124882948							123166
F0630-0914	LSM-34609	SID4248386, BRD-K18653300	3242469	InChI=1S/C15H12ClFN2O2S/c16-11-3-1-4-12(17)10(11)9-22-15-18-6-7-19(15)14(20)13-5-2-8-21-13/h1-5,8H,6-7,9H2	MZFCXQDDVQVWJX-UHFFFAOYSA-N	Fc1cccc(Cl)c1CSC2=NCCN2C(=O)c3occc3	BroadT	BRD-K18653300	BRD-K18653300-001-05-7	ChemDiv Inc.	C441-0562			Fc1cccc(Cl)c1CSC1=NCCN1C(=O)c1ccco1	InChI=1S/C15H12ClFN2O2S/c16-11-3-1-4-12(17)10(11)9-22-15-18-6-7-19(15)14(20)13-5-2-8-21-13/h1-5,8H,6-7,9H2	MZFCXQDDVQVWJX-UHFFFAOYSA-N	338.029204244							123167
T0516-0994	LSM-34610	SID22404556, BRD-K30486862	2430921	InChI=1S/C22H18N4O3S2/c1-14(27)26-12-17(28)24-22(26)30-13-18(29)23-21-25-19(15-8-4-2-5-9-15)20(31-21)16-10-6-3-7-11-16/h2-11H,12-13H2,1H3,(H,23,25,29)	HBQHPKOIOXLHHD-UHFFFAOYSA-N	CC(=O)N1CC(=O)N=C1SCC(=O)Nc2nc(c3ccccc3)c(s2)c4ccccc4	BroadT	BRD-K30486862	BRD-K30486862-001-06-4	Enamine Ltd.	T0516-0994			CC(=O)N1CC(=O)N=C1SCC(=O)Nc1nc(c(s1)-c1ccccc1)-c1ccccc1	InChI=1S/C22H18N4O3S2/c1-14(27)26-12-17(28)24-22(26)30-13-18(29)23-21-25-19(15-8-4-2-5-9-15)20(31-21)16-10-6-3-7-11-16/h2-11H,12-13H2,1H3,(H,23,25,29)	HBQHPKOIOXLHHD-UHFFFAOYSA-N	450.082031856							123168
2-(2-Thienyl)-1,2,3-trihydroquinazolin-4-one	LSM-34611	SID856755, BRD-A74588876	658113	InChI=1S/C12H10N2OS/c15-12-8-4-1-2-5-9(8)13-11(14-12)10-6-3-7-16-10/h1-7,11,13H,(H,14,15)	ZYBQITBKNGCUHV-UHFFFAOYSA-N	O=C1NC(Nc2ccccc12)c3cccs3	BroadT	BRD-A74588876	BRD-A74588876-001-05-2	InterBioScreen Ltd.	STOCK1S-32161			O=C1NC(Nc2ccccc12)c1cccs1	InChI=1S/C12H10N2OS/c15-12-8-4-1-2-5-9(8)13-11(14-12)10-6-3-7-16-10/h1-7,11,13H,(H,14,15)	ZYBQITBKNGCUHV-UHFFFAOYSA-N	230.05138365							123169
ST030001	LSM-34612	SID7977269, BRD-K45711183	693062	InChI=1S/C17H21NO5/c19-15(10-11-16(20)21)18-13-8-6-12(7-9-13)17(22)23-14-4-2-1-3-5-14/h6-9,14H,1-5,10-11H2,(H,18,19)(H,20,21)	YFICWXXIIZUJIY-UHFFFAOYSA-N	OC(=O)CCC(=O)Nc1ccc(cc1)C(=O)OC2CCCCC2	BroadT	BRD-K45711183	BRD-K45711183-001-05-2	ChemBridge Corporation	6877194			OC(=O)CCC(=O)Nc1ccc(cc1)C(=O)OC1CCCCC1	InChI=1S/C17H21NO5/c19-15(10-11-16(20)21)18-13-8-6-12(7-9-13)17(22)23-14-4-2-1-3-5-14/h6-9,14H,1-5,10-11H2,(H,18,19)(H,20,21)	YFICWXXIIZUJIY-UHFFFAOYSA-N	319.141972782							123170
AC1LIRRZ	LSM-34613	BRD-K16166741	910122	InChI=1S/C15H16N4O/c1-10-9-11(2)17-14(16-10)15(20)19-18-12(3)13-7-5-4-6-8-13/h4-9H,1-3H3,(H,19,20)	XAKZHPBNDQBHSV-UHFFFAOYSA-N	CC(=NNC(=O)c1nc(C)cc(C)n1)c2ccccc2	BroadT	BRD-K16166741	BRD-K16166741-001-05-9	InterBioScreen Ltd.	STOCK1S-04953			CC(=NNC(=O)c1nc(C)cc(C)n1)c1ccccc1	InChI=1S/C15H16N4O/c1-10-9-11(2)17-14(16-10)15(20)19-18-12(3)13-7-5-4-6-8-13/h4-9H,1-3H3,(H,19,20)	XAKZHPBNDQBHSV-UHFFFAOYSA-N	268.132411172							123171
MLS000118847	LSM-34614	SID7968242, BRD-K06083005	5309301	InChI=1S/C22H27N3O2S/c26-22(23-8-9-24-10-13-27-14-11-24)19-6-7-21-20(16-19)25(12-15-28-21)17-18-4-2-1-3-5-18/h1-7,16H,8-15,17H2,(H,23,26)	DTSWECZIQSCKFV-UHFFFAOYSA-N	O=C(NCCN1CCOCC1)c2ccc3SCCN(Cc4ccccc4)c3c2	BroadT	BRD-K06083005	BRD-K06083005-001-04-2	ChemDiv Inc.	C699-0134			O=C(NCCN1CCOCC1)c1ccc2SCCN(Cc3ccccc3)c2c1	InChI=1S/C22H27N3O2S/c26-22(23-8-9-24-10-13-27-14-11-24)19-6-7-21-20(16-19)25(12-15-28-21)17-18-4-2-1-3-5-18/h1-7,16H,8-15,17H2,(H,23,26)	DTSWECZIQSCKFV-UHFFFAOYSA-N	397.182397824							123172
F0579-0378	LSM-34615	SID7970796, BRD-K87499087	2155316	InChI=1S/C17H18N2O4S2/c1-3-23-14(20)10-25-17-18-13-8-9-24-15(13)16(21)19(17)11-4-6-12(22-2)7-5-11/h4-7H,3,8-10H2,1-2H3	HACFZLKPIVLXCH-UHFFFAOYSA-N	CCOC(=O)CSC1=NC2=C(SCC2)C(=O)N1c3ccc(OC)cc3	BroadT	BRD-K87499087	BRD-K87499087-001-05-0	Life Chemicals Inc.	F0579-0378			CCOC(=O)CSc1nc2CCSc2c(=O)n1-c1ccc(OC)cc1	InChI=1S/C17H18N2O4S2/c1-3-23-14(20)10-25-17-18-13-8-9-24-15(13)16(21)19(17)11-4-6-12(22-2)7-5-11/h4-7H,3,8-10H2,1-2H3	HACFZLKPIVLXCH-UHFFFAOYSA-N	378.070798456							123173
MLS000048351	LSM-34616	SID3714926, BRD-K90408246	2422317	InChI=1S/C16H14N4O2S/c1-7-6-10(8(2)22-7)13-17-14-12-9-4-3-5-11(9)23-15(12)18-16(21)20(14)19-13/h6H,3-5H2,1-2H3,(H,18,21)	YGPJLKQZLKAVBZ-UHFFFAOYSA-N	Cc1oc(C)c(c1)c2nc3c4c5CCCc5sc4nc(O)n3n2	BroadT	BRD-K90408246	BRD-K90408246-001-05-4	Enamine Ltd.	T0515-7739			Cc1cc(-c2nc3c4c5CCCc5sc4nc(O)n3n2)c(C)o1	InChI=1S/C16H14N4O2S/c1-7-6-10(8(2)22-7)13-17-14-12-9-4-3-5-11(9)23-15(12)18-16(21)20(14)19-13/h6H,3-5H2,1-2H3,(H,18,21)	YGPJLKQZLKAVBZ-UHFFFAOYSA-N	326.083746418							
MLS000673882	LSM-44506	SID24803988, BRD-K91321179	5337291	InChI=1S/C23H15ClN2O6/c1-12-2-5-14(6-3-12)26-21(28)17(20(27)25-23(26)31)11-15-7-9-19(32-15)13-4-8-16(22(29)30)18(24)10-13/h2-11H,1H3,(H,29,30)(H,25,27,31)/b17-11-	SJUSNSIEIKNHNB-BOPFTXTBSA-N	Cc1ccc(cc1)N2C(=O)NC(=O)\C(=C\c3oc(cc3)c4ccc(C(=O)O)c(Cl)c4)\C2=O	BroadT	BRD-K91321179	BRD-K91321179-001-05-9	ChemBridge Corporation	5904359			Cc1ccc(cc1)N1C(=O)NC(=O)\C(=C\c2ccc(o2)-c2ccc(C(O)=O)c(Cl)c2)C1=O	InChI=1S/C23H15ClN2O6/c1-12-2-5-14(6-3-12)26-21(28)17(20(27)25-23(26)31)11-15-7-9-19(32-15)13-4-8-16(22(29)30)18(24)10-13/h2-11H,1H3,(H,29,30)(H,25,27,31)/b17-11-	SJUSNSIEIKNHNB-BOPFTXTBSA-N	450.06186393							
N-Cyclopentyl-3,4-dimethylbenzenesulfonamide	LSM-34618	BRD-K77214724, SID16952972	2442814	InChI=1S/C13H19NO2S/c1-10-7-8-13(9-11(10)2)17(15,16)14-12-5-3-4-6-12/h7-9,12,14H,3-6H2,1-2H3	XDTGQZFNVJFFDI-UHFFFAOYSA-N	Cc1ccc(cc1C)S(=O)(=O)NC2CCCC2	BroadT	BRD-K77214724	BRD-K77214724-001-05-4	Enamine Ltd.	T0517-8872			Cc1ccc(cc1C)S(=O)(=O)NC1CCCC1	InChI=1S/C13H19NO2S/c1-10-7-8-13(9-11(10)2)17(15,16)14-12-5-3-4-6-12/h7-9,12,14H,3-6H2,1-2H3	XDTGQZFNVJFFDI-UHFFFAOYSA-N	253.113649548							123176
SMR000076286	LSM-34619	SID4256806, BRD-K33158584	993362	InChI=1S/C20H19F3N4O2/c1-12-10-13(2)16-14(11-12)17(25-19(24-16)20(21,22)23)26-5-7-27(8-6-26)18(28)15-4-3-9-29-15/h3-4,9-11H,5-8H2,1-2H3	JHONAAPETLFWPL-UHFFFAOYSA-N	Cc1cc(C)c2nc(nc(N3CCN(CC3)C(=O)c4occc4)c2c1)C(F)(F)F	BroadT	BRD-K33158584	BRD-K33158584-001-06-3	ChemBridge Corporation	7776882			Cc1cc(C)c2nc(nc(N3CCN(CC3)C(=O)c3ccco3)c2c1)C(F)(F)F	InChI=1S/C20H19F3N4O2/c1-12-10-13(2)16-14(11-12)17(25-19(24-16)20(21,22)23)26-5-7-27(8-6-26)18(28)15-4-3-9-29-15/h3-4,9-11H,5-8H2,1-2H3	JHONAAPETLFWPL-UHFFFAOYSA-N	404.146010488							123177
SMR000092771	LSM-34620	SID7967678, BRD-A41298308	4416981	InChI=1S/C18H14N4O3S/c1-2-6-12(7-3-1)23-11-16-19-20-18-22(16)21-17(26-18)15-10-24-13-8-4-5-9-14(13)25-15/h1-9,15H,10-11H2	VZTALPISVQFMIG-UHFFFAOYSA-N	C(Oc1ccccc1)c2nnc3sc(nn23)C4COc5ccccc5O4	BroadT	BRD-A41298308	BRD-A41298308-001-04-9	ChemDiv Inc.	7009-0632			C(Oc1ccccc1)c1nnc2sc(nn12)C1COc2ccccc2O1	InChI=1S/C18H14N4O3S/c1-2-6-12(7-3-1)23-11-16-19-20-18-22(16)21-17(26-18)15-10-24-13-8-4-5-9-14(13)25-15/h1-9,15H,10-11H2	VZTALPISVQFMIG-UHFFFAOYSA-N	366.078661038							123178
AC1LIA00	LSM-34621	BRD-K60600410	950728	InChI=1S/C12H12N2O2S/c1-8(2)9-3-5-14(6-4-9)11-10(7-15)17-12(16)13-11/h3-8H,1-2H3/p+1	BDXWHICFUGOXGI-UHFFFAOYSA-O	CC(C)c1cc[n+](cc1)C2=C(SC(=O)N2)C=O	BroadT	BRD-K60600410	BRD-K60600410-001-06-0	InterBioScreen Ltd.	STOCK3S-53612			CC(C)c1cc[n+](cc1)-c1[nH]c(=O)sc1C=O	InChI=1S/C12H12N2O2S/c1-8(2)9-3-5-14(6-4-9)11-10(7-15)17-12(16)13-11/h3-8H,1-2H3/p+1	BDXWHICFUGOXGI-UHFFFAOYSA-O	249.069773366							123179
MLS001242645	LSM-34622	SID49729255, BRD-K89715754	24792595	InChI=1S/C26H41N3O2/c1-4-6-7-23(19-27-3)29-20-24(18-22-8-12-25(30)13-9-22)28-17-16-21-10-14-26(15-11-21)31-5-2/h8-15,23-24,27-30H,4-7,16-20H2,1-3H3/t23-,24-/m0/s1	UKJJBOIZPUYFDB-ZEQRLZLVSA-N	CCCC[C@@H](CNC)NC[C@H](Cc1ccc(O)cc1)NCCc2ccc(OCC)cc2	BroadT	BRD-K89715754	BRD-K89715754-001-06-7	Torrey Pines Institute for Molecular Studies	1665-129			CCCC[C@@H](CNC)NC[C@H](Cc1ccc(O)cc1)NCCc1ccc(OCC)cc1	InChI=1S/C26H41N3O2/c1-4-6-7-23(19-27-3)29-20-24(18-22-8-12-25(30)13-9-22)28-17-16-21-10-14-26(15-11-21)31-5-2/h8-15,23-24,27-30H,4-7,16-20H2,1-3H3/t23-,24-/m0/s1	UKJJBOIZPUYFDB-ZEQRLZLVSA-N	427.319877582							123180
SMR000008495	LSM-34623	SID851046, BRD-A84024491	653598	InChI=1S/C20H21ClN4O/c21-14-5-1-4-13(10-14)18-11-19-22-17-8-2-7-16(17)20(25(19)23-18)24-9-3-6-15(26)12-24/h1,4-5,10-11,15,26H,2-3,6-9,12H2	DXXJMHKBQYKSBP-UHFFFAOYSA-N	OC1CCCN(C1)c2c3CCCc3nc4cc(nn24)c5cccc(Cl)c5	BroadT	BRD-A84024491	BRD-A84024491-001-05-1	Asinex Ltd.	ASN 08735295			OC1CCCN(C1)c1c2CCCc2nc2cc(nn12)-c1cccc(Cl)c1	InChI=1S/C20H21ClN4O/c21-14-5-1-4-13(10-14)18-11-19-22-17-8-2-7-16(17)20(25(19)23-18)24-9-3-6-15(26)12-24/h1,4-5,10-11,15,26H,2-3,6-9,12H2	DXXJMHKBQYKSBP-UHFFFAOYSA-N	368.140389042							123181
ST50375038	LSM-34624	SID49734961, BRD-A66502073	6497503	InChI=1S/C23H29N3O5S/c1-17-4-2-12-26(16-17)32(29,30)20-8-6-19(7-9-20)24-22(27)18-10-13-25(14-11-18)23(28)21-5-3-15-31-21/h3,5-9,15,17-18H,2,4,10-14,16H2,1H3,(H,24,27)	IKFHAHSBVMFWKT-UHFFFAOYSA-N	CC1CCCN(C1)S(=O)(=O)c2ccc(NC(=O)C3CCN(CC3)C(=O)c4occc4)cc2	BroadT	BRD-A66502073	BRD-A66502073-001-05-4	Asinex Ltd.	ASN 13781307			CC1CCCN(C1)S(=O)(=O)c1ccc(NC(=O)C2CCN(CC2)C(=O)c2ccco2)cc1	InChI=1S/C23H29N3O5S/c1-17-4-2-12-26(16-17)32(29,30)20-8-6-19(7-9-20)24-22(27)18-10-13-25(14-11-18)23(28)21-5-3-15-31-21/h3,5-9,15,17-18H,2,4,10-14,16H2,1H3,(H,24,27)	IKFHAHSBVMFWKT-UHFFFAOYSA-N	459.182791748							123182
MLS000675283	LSM-34625	SID24814424, BRD-K04226465	4097870	InChI=1S/C18H15N3O8S/c1-20-14-4-3-12(8-13(14)15(22)21(2)18(20)27)30(28,29)19-11-6-9(16(23)24)5-10(7-11)17(25)26/h3-8,19H,1-2H3,(H,23,24)(H,25,26)	GWEWBNCJANBPIC-UHFFFAOYSA-N	CN1C(=O)N(C)c2ccc(cc2C1=O)S(=O)(=O)Nc3cc(cc(c3)C(=O)O)C(=O)O	BroadT	BRD-K04226465	BRD-K04226465-001-05-9	ChemDiv Inc.	C341-0152			Cn1c2ccc(cc2c(=O)n(C)c1=O)S(=O)(=O)Nc1cc(cc(c1)C(O)=O)C(O)=O	InChI=1S/C18H15N3O8S/c1-20-14-4-3-12(8-13(14)15(22)21(2)18(20)27)30(28,29)19-11-6-9(16(23)24)5-10(7-11)17(25)26/h3-8,19H,1-2H3,(H,23,24)(H,25,26)	GWEWBNCJANBPIC-UHFFFAOYSA-N	433.05798516							123183
BAS 09902345	LSM-15480	BRD-K38175504	934964	InChI=1S/C13H19NO3/c1-2-5-11-10(8-12(17-11)13(15)16)9-14-6-3-4-7-14/h8H,2-7,9H2,1H3,(H,15,16)	BEVFYPNHCDGTJQ-UHFFFAOYSA-N	CCCc1oc(cc1CN2CCCC2)C(=O)O	BroadT	BRD-K38175504	BRD-K38175504-003-05-7	Asinex Ltd.	BAS 09902345		Cl	CCCc1oc(cc1CN1CCCC1)C(O)=O.Cl	InChI=1S/C13H19NO3.ClH/c1-2-5-11-10(8-12(17-11)13(15)16)9-14-6-3-4-7-14;/h8H,2-7,9H2,1H3,(H,15,16);1H	OHJWLPUSJAAASW-UHFFFAOYSA-N	237.136493478							104123, 104123
SMR000073458	LSM-34626	SID4259177, BRD-K68582701	713129	InChI=1S/C12H11NO4S2/c14-19(15,12-2-1-7-18-12)13-9-3-4-10-11(8-9)17-6-5-16-10/h1-4,7-8,13H,5-6H2	FUFDOFLEKZHCCC-UHFFFAOYSA-N	O=S(=O)(Nc1ccc2OCCOc2c1)c3cccs3	BroadT	BRD-K68582701	BRD-K68582701-001-07-8	ChemBridge Corporation	7571211			O=S(=O)(Nc1ccc2OCCOc2c1)c1cccs1	InChI=1S/C12H11NO4S2/c14-19(15,12-2-1-7-18-12)13-9-3-4-10-11(8-9)17-6-5-16-10/h1-4,7-8,13H,5-6H2	FUFDOFLEKZHCCC-UHFFFAOYSA-N	297.012949222							123184
MLS000731532	LSM-34627	SID24822973, BRD-K23940360	16195347	InChI=1S/C17H11ClN2O2S/c18-11-5-6-15(19-8-11)20-17(21)14-7-10-9-22-13-4-2-1-3-12(13)16(10)23-14/h1-8H,9H2,(H,19,20,21)	MQEIINXDSUUUBD-UHFFFAOYSA-N	Clc1ccc(NC(=O)c2cc3COc4ccccc4c3s2)nc1	BroadT	BRD-K23940360	BRD-K23940360-001-05-8	ChemDiv Inc.	C712-1251			Clc1ccc(NC(=O)c2cc3COc4ccccc4-c3s2)nc1	InChI=1S/C17H11ClN2O2S/c18-11-5-6-15(19-8-11)20-17(21)14-7-10-9-22-13-4-2-1-3-12(13)16(10)23-14/h1-8H,9H2,(H,19,20,21)	MQEIINXDSUUUBD-UHFFFAOYSA-N	342.022976012							123185
MLS000028226	LSM-34628	SID846919, BRD-K59500062	649312	InChI=1S/C17H15N9O/c1-2-26-21-16(20-23-26)14-8-3-4-9-15(14)19-17(27)12-6-5-7-13(10-12)25-11-18-22-24-25/h3-11H,2H2,1H3,(H,19,27)	JMWGMTCVVLATBC-UHFFFAOYSA-N	CCn1nnc(n1)c2ccccc2NC(=O)c3cccc(c3)n4cnnn4	BroadT	BRD-K59500062	BRD-K59500062-001-06-6	Asinex Ltd.	ASN 04935849			CCn1nnc(n1)-c1ccccc1NC(=O)c1cccc(c1)-n1cnnn1	InChI=1S/C17H15N9O/c1-2-26-21-16(20-23-26)14-8-3-4-9-15(14)19-17(27)12-6-5-7-13(10-12)25-11-18-22-24-25/h3-11H,2H2,1H3,(H,19,27)	JMWGMTCVVLATBC-UHFFFAOYSA-N	361.13995619							123186
AC1LZEK5	LSM-34629	BRD-K82298592	1898664	InChI=1S/C24H18ClN5O3S/c25-18-10-12-19(13-11-18)30-22(16-6-2-1-3-7-16)28-29-24(30)34-15-21(31)27-26-14-17-8-4-5-9-20(17)23(32)33/h1-14H,15H2,(H,27,31)(H,32,33)	JYLNAYGPMKWVCZ-UHFFFAOYSA-N	OC(=O)c1ccccc1C=NNC(=O)CSc2nnc(c3ccccc3)n2c4ccc(Cl)cc4	BroadT	BRD-K82298592	BRD-K82298592-001-05-9	InterBioScreen Ltd.	STOCK3S-10090			OC(=O)c1ccccc1C=NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(Cl)cc1	InChI=1S/C24H18ClN5O3S/c25-18-10-12-19(13-11-18)30-22(16-6-2-1-3-7-16)28-29-24(30)34-15-21(31)27-26-14-17-8-4-5-9-20(17)23(32)33/h1-14H,15H2,(H,27,31)(H,32,33)	JYLNAYGPMKWVCZ-UHFFFAOYSA-N	491.081887886							123187
N-Butyl-1H-benzo[d]imidazol-2-amine	LSM-34630	SID14745457, BRD-K06172453	284016	InChI=1S/C11H15N3/c1-2-3-8-12-11-13-9-6-4-5-7-10(9)14-11/h4-7H,2-3,8H2,1H3,(H2,12,13,14)	OKKUCNXCFWODOE-UHFFFAOYSA-N	CCCCNc1nc2ccccc2[nH]1	BroadT	BRD-K06172453	BRD-K06172453-001-05-7	Enamine Ltd.	T5311464			CCCCNc1nc2ccccc2[nH]1	InChI=1S/C11H15N3/c1-2-3-8-12-11-13-9-6-4-5-7-10(9)14-11/h4-7H,2-3,8H2,1H3,(H2,12,13,14)	OKKUCNXCFWODOE-UHFFFAOYSA-N	189.12659751							123188
AC1O0ZUY	LSM-44507	SID24810141, BRD-K86873914	6107078	InChI=1S/C18H13FN4OS/c19-13-5-3-12(4-6-13)11-22-7-1-2-14(22)10-15-16(20)23-8-9-25-18(23)21-17(15)24/h1-10,20H,11H2/b15-10-,20-16?	JBRAXOVHXFNSOM-YERBQUFUSA-N	Fc1ccc(Cn2cccc2\C=C/3\C(=N)N4C=CSC4=NC3=O)cc1	BroadT	BRD-K86873914	BRD-K86873914-001-05-6	ChemDiv Inc.	5234-0154			Fc1ccc(Cn2cccc2\C=C2/C(=O)N=C3SC=CN3C2=N)cc1	InChI=1S/C18H13FN4OS/c19-13-5-3-12(4-6-13)11-22-7-1-2-14(22)10-15-16(20)23-8-9-25-18(23)21-17(15)24/h1-10,20H,11H2/b15-10-,20-16?	JBRAXOVHXFNSOM-YERBQUFUSA-N	352.079409966							
MLS000042201	LSM-34632	SID864354, BRD-K64449654	665602	InChI=1S/C18H18N4O4/c1-24-14-6-5-12(10-15(14)25-2)18-21-17(26-22-18)8-7-16(23)20-13-4-3-9-19-11-13/h3-6,9-11H,7-8H2,1-2H3,(H,20,23)	INMGIBPBZFWYIO-UHFFFAOYSA-N	COc1ccc(cc1OC)c2noc(CCC(=O)Nc3cccnc3)n2	BroadT	BRD-K64449654	BRD-K64449654-001-05-5	InterBioScreen Ltd.	STOCK5S-16176			COc1ccc(cc1OC)-c1noc(CCC(=O)Nc2cccnc2)n1	InChI=1S/C18H18N4O4/c1-24-14-6-5-12(10-15(14)25-2)18-21-17(26-22-18)8-7-16(23)20-13-4-3-9-19-11-13/h3-6,9-11H,7-8H2,1-2H3,(H,20,23)	INMGIBPBZFWYIO-UHFFFAOYSA-N	354.132805096							123190
50290-51-2	LSM-34633	SID14722737, BRD-K04627490	486631	InChI=1S/C11H9N3O/c1-7-6-10(15)14-9-5-3-2-4-8(9)13-11(14)12-7/h2-6,15H,1H3	GDUPORKSABXXOG-UHFFFAOYSA-N	Cc1cc(O)n2c3ccccc3nc2n1	BroadT	BRD-K04627490	BRD-K04627490-001-05-7	Asinex Ltd.	BAS 06978831			Cc1cc(O)n2c(nc3ccccc23)n1	InChI=1S/C11H9N3O/c1-7-6-10(15)14-9-5-3-2-4-8(9)13-11(14)12-7/h2-6,15H,1H3	GDUPORKSABXXOG-UHFFFAOYSA-N	199.074561938							
MLS000097904	LSM-34634	SID3713503, BRD-K60425711	739861	InChI=1S/C13H19N3S/c1-2-8-12(14-9-5-1)16-13-15-10-6-3-4-7-11(10)17-13/h1-9H2,(H,14,15,16)	GHUOKLVMULNZKL-UHFFFAOYSA-N	C1CCN=C(CC1)Nc2nc3CCCCc3s2	BroadT	BRD-K60425711	BRD-K60425711-001-05-0	Enamine Ltd.	T0503-9400			C1CCc2sc(NC3=NCCCCC3)nc2C1	InChI=1S/C13H19N3S/c1-2-8-12(14-9-5-1)16-13-15-10-6-3-4-7-11(10)17-13/h1-9H2,(H,14,15,16)	GHUOKLVMULNZKL-UHFFFAOYSA-N	249.129968328							123192
BAS 01078354	LSM-6469	BRD-A58482795, SID847813	650228	InChI=1S/C19H28ClNO2/c20-18-8-6-17(7-9-18)19(22,16-4-2-1-3-5-16)10-11-21-12-14-23-15-13-21/h6-9,16,22H,1-5,10-15H2	WWXFMWHVRFPDMU-UHFFFAOYSA-N	OC(CCN1CCOCC1)(C2CCCCC2)c3ccc(Cl)cc3	BroadT	BRD-A58482795	BRD-A58482795-001-05-6	Asinex Ltd.	BAS 01078354			OC(CCN1CCOCC1)(C1CCCCC1)c1ccc(Cl)cc1	InChI=1S/C19H28ClNO2/c20-18-8-6-17(7-9-18)19(22,16-4-2-1-3-5-16)10-11-21-12-14-23-15-13-21/h6-9,16,22H,1-5,10-15H2	WWXFMWHVRFPDMU-UHFFFAOYSA-N	337.180856856							95188
SMR000003226	LSM-34635	SID26667887, SID850271, BRD-K24110913	652788	InChI=1S/C23H28N6O2S/c1-5-31-18-8-9-20-16(12-18)11-17(22(30)24-20)13-28(14-19-7-6-10-32-19)15-21-25-26-27-29(21)23(2,3)4/h6-12H,5,13-15H2,1-4H3,(H,24,30)	QURJSJMDOQGACP-UHFFFAOYSA-N	CCOc1ccc2nc(O)c(CN(Cc3cccs3)Cc4nnnn4C(C)(C)C)cc2c1	BroadT	BRD-K24110913	BRD-K24110913-001-05-9	Asinex Ltd.	ASN 04370303			CCOc1ccc2nc(O)c(CN(Cc3cccs3)Cc3nnnn3C(C)(C)C)cc2c1	InChI=1S/C23H28N6O2S/c1-5-31-18-8-9-20-16(12-18)11-17(22(30)24-20)13-28(14-19-7-6-10-32-19)15-21-25-26-27-29(21)23(2,3)4/h6-12H,5,13-15H2,1-4H3,(H,24,30)	QURJSJMDOQGACP-UHFFFAOYSA-N	452.199444886							123193
ST50192147	LSM-34636	SID14735136, BRD-K94572539	705527	InChI=1S/C16H15N3/c1-2-11-7-9-12(10-8-11)18-16-14-6-4-3-5-13(14)15(17)19-16/h3-10H,2H2,1H3,(H2,17,18,19)	SLJCMMGFIBWMMQ-UHFFFAOYSA-N	CCc1ccc(NC2=NC(=N)c3ccccc23)cc1	BroadT	BRD-K94572539	BRD-K94572539-001-04-2	ChemBridge Corporation	6828371			CCc1ccc(cc1)\N=C1/NC(=N)c2ccccc12	InChI=1S/C16H15N3/c1-2-11-7-9-12(10-8-11)18-16-14-6-4-3-5-13(14)15(17)19-16/h3-10H,2H2,1H3,(H2,17,18,19)	SLJCMMGFIBWMMQ-UHFFFAOYSA-N	249.12659751							123194
AC1OA0O0	LSM-34637	BRD-K01457332	6743202	InChI=1S/C14H12FNO2/c1-9-2-4-11(6-13(9)15)16-8-10-3-5-12(17)7-14(10)18/h2-8,17-18H,1H3	GMKGSMLWXBWFSQ-UHFFFAOYSA-N	Cc1ccc(cc1F)N=Cc2ccc(O)cc2O	BroadT	BRD-K01457332	BRD-K01457332-001-05-4	ChemBridge Corporation	5318708			Cc1ccc(cc1F)N=Cc1ccc(O)cc1O	InChI=1S/C14H12FNO2/c1-9-2-4-11(6-13(9)15)16-8-10-3-5-12(17)7-14(10)18/h2-8,17-18H,1H3	GMKGSMLWXBWFSQ-UHFFFAOYSA-N	245.085206834							
184177-81-9	LSM-34638	SID4262762, BRD-K69337385	1317528	InChI=1S/C23H23N3O3/c27-21-12-10-20(11-13-21)26-16-14-25(15-17-26)19-8-6-18(7-9-19)24-23(28)29-22-4-2-1-3-5-22/h1-13,27H,14-17H2,(H,24,28)	IKRKMYDCUZYKHX-UHFFFAOYSA-N	Oc1ccc(cc1)N2CCN(CC2)c3ccc(NC(=O)Oc4ccccc4)cc3	BroadT	BRD-K69337385	BRD-K69337385-001-06-1	ChemBridge Corporation	7610715			Oc1ccc(cc1)N1CCN(CC1)c1ccc(NC(=O)Oc2ccccc2)cc1	InChI=1S/C23H23N3O3/c27-21-12-10-20(11-13-21)26-16-14-25(15-17-26)19-8-6-18(7-9-19)24-23(28)29-22-4-2-1-3-5-22/h1-13,27H,14-17H2,(H,24,28)	IKRKMYDCUZYKHX-UHFFFAOYSA-N	389.173941626							123196
T5497660	LSM-34639	SID3717725, BRD-A81007728	3000115	InChI=1S/C12H15NO4S/c14-11(13-7-9-3-1-5-16-9)8-17-12(15)10-4-2-6-18-10/h2,4,6,9H,1,3,5,7-8H2,(H,13,14)	OUNUIZSNLSUMQS-UHFFFAOYSA-N	O=C(COC(=O)c1cccs1)NCC2CCCO2	BroadT	BRD-A81007728	BRD-A81007728-001-05-4	Enamine Ltd.	T0508-9104			O=C(COC(=O)c1cccs1)NCC1CCCO1	InChI=1S/C12H15NO4S/c14-11(13-7-9-3-1-5-16-9)8-17-12(15)10-4-2-6-18-10/h2,4,6,9H,1,3,5,7-8H2,(H,13,14)	OUNUIZSNLSUMQS-UHFFFAOYSA-N	269.07217866							123197
AC1NII59	LSM-34640	BRD-A37739876	4831444	InChI=1S/C22H20F2N4O3S/c1-3-10-31-16-7-4-14(5-8-16)13-26-28-21(30)19(32-22(28)25-2)12-20(29)27-18-9-6-15(23)11-17(18)24/h3-9,11,13,19H,1,10,12H2,2H3,(H,27,29)	PIKZZSSQQVXWPF-UHFFFAOYSA-N	CN=C1SC(CC(=O)Nc2ccc(F)cc2F)C(=O)N1N=Cc3ccc(OCC=C)cc3	BroadT	BRD-A37739876	BRD-A37739876-001-05-7	Enamine Ltd.	T5292933			CN=C1SC(CC(=O)Nc2ccc(F)cc2F)C(=O)N1N=Cc1ccc(OCC=C)cc1	InChI=1S/C22H20F2N4O3S/c1-3-10-31-16-7-4-14(5-8-16)13-26-28-21(30)19(32-22(28)25-2)12-20(29)27-18-9-6-15(23)11-17(18)24/h3-9,11,13,19H,1,10,12H2,2H3,(H,27,29)	PIKZZSSQQVXWPF-UHFFFAOYSA-N	458.12241763							123198
T5337199	LSM-34641	SID24828450, BRD-K88482185	4885463	InChI=1S/C10H9N5O2S2/c1-2-5-12-9-13-14-10(19-9)18-8-7(15(16)17)4-3-6-11-8/h2-4,6H,1,5H2,(H,12,13)	GQTQOVVLIYWWGP-UHFFFAOYSA-N	[O-][N+](=O)c1cccnc1Sc2nnc(NCC=C)s2	BroadT	BRD-K88482185	BRD-K88482185-001-06-4	Enamine Ltd.	T5337199			[O-][N+](=O)c1cccnc1Sc1nnc(NCC=C)s1	InChI=1S/C10H9N5O2S2/c1-2-5-12-9-13-14-10(19-9)18-8-7(15(16)17)4-3-6-11-8/h2-4,6H,1,5H2,(H,12,13)	GQTQOVVLIYWWGP-UHFFFAOYSA-N	295.019765958							123199
SMR000108467	LSM-34642	SID7972847, BRD-K17956344	2290906	InChI=1S/C19H30N2O4S/c1-16-9-11-18(12-10-16)26(23,24)21(17-7-4-3-5-8-17)15-19(22)20-13-6-14-25-2/h9-12,17H,3-8,13-15H2,1-2H3,(H,20,22)	HUTKPNIRZDSCFI-UHFFFAOYSA-N	COCCCNC(=O)CN(C1CCCCC1)S(=O)(=O)c2ccc(C)cc2	BroadT	BRD-K17956344	BRD-K17956344-001-05-3	ChemBridge Corporation	6872625			COCCCNC(=O)CN(C1CCCCC1)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C19H30N2O4S/c1-16-9-11-18(12-10-16)26(23,24)21(17-7-4-3-5-8-17)15-19(22)20-13-6-14-25-2/h9-12,17H,3-8,13-15H2,1-2H3,(H,20,22)	HUTKPNIRZDSCFI-UHFFFAOYSA-N	382.19262815							123200
SMR000170989	LSM-34643	SID17508674, BRD-A69926435	3190113	InChI=1S/C29H28FN7O3/c1-29(2,3)32-28(40)26(23-16-31-24-10-5-4-9-22(23)24)37(20-7-6-8-21(38)15-20)25(39)17-36-34-27(33-35-36)18-11-13-19(30)14-12-18/h4-16,26,31,38H,17H2,1-3H3,(H,32,40)	UEKYUOSUPQTNRH-UHFFFAOYSA-N	CC(C)(C)NC(=O)C(N(C(=O)Cn1nnc(n1)c2ccc(F)cc2)c3cccc(O)c3)c4c[nH]c5ccccc45	BroadT	BRD-A69926435	BRD-A69926435-001-05-5	Asinex Ltd.	ASN 04487945			CC(C)(C)NC(=O)C(N(C(=O)Cn1nnc(n1)-c1ccc(F)cc1)c1cccc(O)c1)c1c[nH]c2ccccc12	InChI=1S/C29H28FN7O3/c1-29(2,3)32-28(40)26(23-16-31-24-10-5-4-9-22(23)24)37(20-7-6-8-21(38)15-20)25(39)17-36-34-27(33-35-36)18-11-13-19(30)14-12-18/h4-16,26,31,38H,17H2,1-3H3,(H,32,40)	UEKYUOSUPQTNRH-UHFFFAOYSA-N	541.223766026							123201
F1553-0167	LSM-44508	SID49677571, BRD-K76312695	1419029	InChI=1S/C21H18N2O4S/c24-17-11-9-16(10-12-17)22-19(25)13-14-23-20(26)18(28-21(23)27)8-4-7-15-5-2-1-3-6-15/h1-12,24H,13-14H2,(H,22,25)/b7-4+,18-8-	XNXMXBBJJJNVPV-DFBITEFZSA-N	Oc1ccc(NC(=O)CCN2C(=O)S\C(=C/C=C/c3ccccc3)\C2=O)cc1	BroadT	BRD-K76312695	BRD-K76312695-001-06-0	Life Chemicals Inc.	F1553-0167			Oc1ccc(NC(=O)CCN2C(=O)S\C(=C/C=C/c3ccccc3)C2=O)cc1	InChI=1S/C21H18N2O4S/c24-17-11-9-16(10-12-17)22-19(25)13-14-23-20(26)18(28-21(23)27)8-4-7-15-5-2-1-3-6-15/h1-12,24H,13-14H2,(H,22,25)/b7-4+,18-8-	XNXMXBBJJJNVPV-DFBITEFZSA-N	394.098727766							
SMR000130393	LSM-34645	SID14737674, BRD-A21569010	4695008	InChI=1S/C18H20N2O3S/c1-12-5-6-16-15(10-12)20(18(22)13(2)23-16)8-7-17(21)19-11-14-4-3-9-24-14/h3-6,9-10,13H,7-8,11H2,1-2H3,(H,19,21)	FEGBLJMVULMYGE-UHFFFAOYSA-N	CC1Oc2ccc(C)cc2N(CCC(=O)NCc3cccs3)C1=O	BroadT	BRD-A21569010	BRD-A21569010-001-05-3	ChemDiv Inc.	C205-0330			CC1Oc2ccc(C)cc2N(CCC(=O)NCc2cccs2)C1=O	InChI=1S/C18H20N2O3S/c1-12-5-6-16-15(10-12)20(18(22)13(2)23-16)8-7-17(21)19-11-14-4-3-9-24-14/h3-6,9-10,13H,7-8,11H2,1-2H3,(H,19,21)	FEGBLJMVULMYGE-UHFFFAOYSA-N	344.11946321							123203
MLS000101845	LSM-34646	SID7969698, BRD-K41949810	1089310	InChI=1S/C20H23ClFN5O2/c1-24-18-17(19(28)25(2)20(24)29)27(11-13-14(21)7-6-8-15(13)22)16(23-18)12-26-9-4-3-5-10-26/h6-8H,3-5,9-12H2,1-2H3	GQYNQHXEXRNBOH-UHFFFAOYSA-N	CN1C(=O)N(C)c2nc(CN3CCCCC3)n(Cc4c(F)cccc4Cl)c2C1=O	BroadT	BRD-K41949810	BRD-K41949810-001-03-8	Life Chemicals Inc.	F0634-0218			Cn1c2nc(CN3CCCCC3)n(Cc3c(F)cccc3Cl)c2c(=O)n(C)c1=O	InChI=1S/C20H23ClFN5O2/c1-24-18-17(19(28)25(2)20(24)29)27(11-13-14(21)7-6-8-15(13)22)16(23-18)12-26-9-4-3-5-10-26/h6-8H,3-5,9-12H2,1-2H3	GQYNQHXEXRNBOH-UHFFFAOYSA-N	419.152430936							123204
6-Nitroquipazine	LSM-15528	6-Nitroquipazine	5012	InChI=1S/C13H14N4O2/c18-17(19)11-2-3-12-10(9-11)1-4-13(15-12)16-7-5-14-6-8-16/h1-4,9,14H,5-8H2	GGDBEAVVGFNWIA-UHFFFAOYSA-N	[O-][N+](=O)c1ccc2nc(ccc2c1)N3CCNCC3	BroadT	BRD-K95821857	BRD-K95821857-050-03-5	Sigma-Aldrich	Q109		OC(=O)/C=C\C(=O)O	[O-][N+](=O)c1ccc2nc(ccc2c1)N1CCNCC1.OC(=O)/C=C\C(=O)O	InChI=1S/C13H14N4O2.C4H4O4/c18-17(19)11-2-3-12-10(9-11)1-4-13(15-12)16-7-5-14-6-8-16;5-3(6)1-2-4(7)8/h1-4,9,14H,5-8H2;1-2H,(H,5,6)(H,7,8)/b;2-1-	LXOHMGALVZOYRF-BTJKTKAUSA-N	258.111675728							104164, 104164
STK177924	LSM-44509	SID17386152, BRD-K64205686	1819576	InChI=1S/C20H15N3OS/c24-19-18(25-20(22-19)21-15-8-3-1-4-9-15)14-17-12-7-13-23(17)16-10-5-2-6-11-16/h1-14H,(H,21,22,24)/b18-14-	QXJUEICLCKPRFJ-JXAWBTAJSA-N	O=C1N=C(Nc2ccccc2)S/C/1=C\c3cccn3c4ccccc4	BroadT	BRD-K64205686	BRD-K64205686-001-06-1	Specs	AP-828/40997071			O=C1N=C(Nc2ccccc2)S\C1=C/c1cccn1-c1ccccc1	InChI=1S/C20H15N3OS/c24-19-18(25-20(22-19)21-15-8-3-1-4-9-15)14-17-12-7-13-23(17)16-10-5-2-6-11-16/h1-14H,(H,21,22,24)/b18-14-	QXJUEICLCKPRFJ-JXAWBTAJSA-N	345.09358282							
MLS000533752	LSM-34648	SID14734578, BRD-K07617524	878806	InChI=1S/C12H12N4S/c13-6-8-9-4-2-1-3-5-16(9)11-10(8)14-7-15-12(11)17/h7H,1-5H2,(H,14,15,17)	UFOBHGWLEPTLSI-UHFFFAOYSA-N	Sc1ncnc2c(C#N)c3CCCCCn3c12	BroadT	BRD-K07617524	BRD-K07617524-001-07-1	ChemBridge Corporation	6050267			Sc1ncnc2c(C#N)c3CCCCCn3c12	InChI=1S/C12H12N4S/c13-6-8-9-4-2-1-3-5-16(9)11-10(8)14-7-15-12(11)17/h7H,1-5H2,(H,14,15,17)	UFOBHGWLEPTLSI-UHFFFAOYSA-N	244.078267114							123206
T5297905	LSM-34649	SID17515929, BRD-K87995482	2543146	InChI=1S/C10H10N4O/c1-7(15)13-14-10-8-4-2-3-5-9(8)11-6-12-10/h2-6H,1H3,(H,13,15)(H,11,12,14)	IZDHKBHNSSFKTE-UHFFFAOYSA-N	CC(=O)NNc1ncnc2ccccc12	BroadT	BRD-K87995482	BRD-K87995482-001-06-6	Enamine Ltd.	T5297905			CC(=O)NNc1ncnc2ccccc12	InChI=1S/C10H10N4O/c1-7(15)13-14-10-8-4-2-3-5-9(8)11-6-12-10/h2-6H,1H3,(H,13,15)(H,11,12,14)	IZDHKBHNSSFKTE-UHFFFAOYSA-N	202.08546098							123207
MLS000925104	LSM-44510	SID49736476, BRD-K80885084	24793769	InChI=1S/C26H24N4O2S/c1-18-5-7-19(8-6-18)16-23-25(31)28-21-17-20(9-10-22(21)33-23)26(32)30-14-12-29(13-15-30)24-4-2-3-11-27-24/h2-11,16-17H,12-15H2,1H3,(H,28,31)/b23-16+	UDSNFGLUSKDPJU-XQNSMLJCSA-N	Cc1ccc(\C=C/2\Sc3ccc(cc3NC2=O)C(=O)N4CCN(CC4)c5ccccn5)cc1	BroadT	BRD-K80885084	BRD-K80885084-001-07-6	ChemDiv Inc.	C700-0539			Cc1ccc(\C=C2\Sc3ccc(cc3NC2=O)C(=O)N2CCN(CC2)c2ccccn2)cc1	InChI=1S/C26H24N4O2S/c1-18-5-7-19(8-6-18)16-23-25(31)28-21-17-20(9-10-22(21)33-23)26(32)30-14-12-29(13-15-30)24-4-2-3-11-27-24/h2-11,16-17H,12-15H2,1H3,(H,28,31)/b23-16+	UDSNFGLUSKDPJU-XQNSMLJCSA-N	456.161996738							
AC1MOPUE	LSM-34651	BRD-K19953419	3373000	InChI=1S/C20H18FN3O/c1-14-11-17(15(2)24(14)19-9-4-3-5-10-19)13-22-23-20(25)16-7-6-8-18(21)12-16/h3-13H,1-2H3,(H,23,25)	WXCOJRXKZHRIGE-UHFFFAOYSA-N	Cc1cc(C=NNC(=O)c2cccc(F)c2)c(C)n1c3ccccc3	BroadT	BRD-K19953419	BRD-K19953419-001-07-4	ChemDiv Inc.	2149-0085			Cc1cc(C=NNC(=O)c2cccc(F)c2)c(C)n1-c1ccccc1	InChI=1S/C20H18FN3O/c1-14-11-17(15(2)24(14)19-9-4-3-5-10-19)13-22-23-20(25)16-7-6-8-18(21)12-16/h3-13H,1-2H3,(H,23,25)	WXCOJRXKZHRIGE-UHFFFAOYSA-N	335.143390426							123209
T6682546	LSM-34652	SID7971656, BRD-K34056853	5310523	InChI=1S/C17H17N3O4S/c21-25(22,14-4-5-15-16(11-14)24-10-9-23-15)18-7-6-13-12-20-8-2-1-3-17(20)19-13/h1-5,8,11-12,18H,6-7,9-10H2	SRWNHANMALZBDC-UHFFFAOYSA-N	O=S(=O)(NCCc1cn2ccccc2n1)c3ccc4OCCOc4c3	BroadT	BRD-K34056853	BRD-K34056853-001-05-4	Life Chemicals Inc.	F1840-0058			O=S(=O)(NCCc1cn2ccccc2n1)c1ccc2OCCOc2c1	InChI=1S/C17H17N3O4S/c21-25(22,14-4-5-15-16(11-14)24-10-9-23-15)18-7-6-13-12-20-8-2-1-3-17(20)19-13/h1-5,8,11-12,18H,6-7,9-10H2	SRWNHANMALZBDC-UHFFFAOYSA-N	359.093976744							123210
AN-465/41673086	LSM-34653	SID842331, BRD-K92039714	644590	InChI=1S/C20H25N3O/c1-16-3-5-18(6-4-16)15-21-19-7-9-20(10-8-19)23-13-11-22(12-14-23)17(2)24/h3-10,21H,11-15H2,1-2H3	WHSMJXZOCVNHPH-UHFFFAOYSA-N	CC(=O)N1CCN(CC1)c2ccc(NCc3ccc(C)cc3)cc2	BroadT	BRD-K92039714	BRD-K92039714-001-05-8	Asinex Ltd.	BAS 07021448			CC(=O)N1CCN(CC1)c1ccc(NCc2ccc(C)cc2)cc1	InChI=1S/C20H25N3O/c1-16-3-5-18(6-4-16)15-21-19-7-9-20(10-8-19)23-13-11-22(12-14-23)17(2)24/h3-10,21H,11-15H2,1-2H3	WHSMJXZOCVNHPH-UHFFFAOYSA-N	323.19976245							123211
ST50104159	LSM-34654	SID4255050, BRD-K23837656	874396	InChI=1S/C16H14N2O4/c1-21-13-8-11-12(9-14(13)22-2)17-16(20)18(15(11)19)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,17,20)	SCUPETBKKWPPTA-UHFFFAOYSA-N	COc1cc2NC(=O)N(C(=O)c2cc1OC)c3ccccc3	BroadT	BRD-K23837656	BRD-K23837656-001-05-9	ChemBridge Corporation	6122655			COc1cc2[nH]c(=O)n(-c3ccccc3)c(=O)c2cc1OC	InChI=1S/C16H14N2O4/c1-21-13-8-11-12(9-14(13)22-2)17-16(20)18(15(11)19)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,17,20)	SCUPETBKKWPPTA-UHFFFAOYSA-N	298.095356948							123212
3,6-Dimethoxy-9H-carbazole	LSM-34655	SID842209, BRD-K86774058	644464	InChI=1S/C14H13NO2/c1-16-9-3-5-13-11(7-9)12-8-10(17-2)4-6-14(12)15-13/h3-8,15H,1-2H3	YQKMWXHJSIEAEX-UHFFFAOYSA-N	COc1ccc2[nH]c3ccc(OC)cc3c2c1	BroadT	BRD-K86774058	BRD-K86774058-001-06-0	Asinex Ltd.	BAS 00119444			COc1ccc2[nH]c3ccc(OC)cc3c2c1	InChI=1S/C14H13NO2/c1-16-9-3-5-13-11(7-9)12-8-10(17-2)4-6-14(12)15-13/h3-8,15H,1-2H3	YQKMWXHJSIEAEX-UHFFFAOYSA-N	227.094628666							123213
AG-670/36898013	LSM-34656	SID17412626, BRD-K39339838	2854661	InChI=1S/C19H23N3O4/c1-15-3-2-4-17(13-15)26-10-7-20-18-14-16(5-6-19(18)22(23)24)21-8-11-25-12-9-21/h2-6,13-14,20H,7-12H2,1H3	ZRDDDLMFVDMLDV-UHFFFAOYSA-N	Cc1cccc(OCCNc2cc(ccc2[N+](=O)[O-])N3CCOCC3)c1	BroadT	BRD-K39339838	BRD-K39339838-001-05-9	ChemBridge Corporation	5603161			Cc1cccc(OCCNc2cc(ccc2[N+]([O-])=O)N2CCOCC2)c1	InChI=1S/C19H23N3O4/c1-15-3-2-4-17(13-15)26-10-7-20-18-14-16(5-6-19(18)22(23)24)21-8-11-25-12-9-21/h2-6,13-14,20H,7-12H2,1H3	ZRDDDLMFVDMLDV-UHFFFAOYSA-N	357.168856246							123214
MLS001045864	LSM-34657	SID26725546, BRD-A18164959	16745768	InChI=1S/C33H27N3O4/c1-33(40-31(38)15-12-23-7-3-2-4-8-23)30(37)20-26-19-29(25-13-10-24(21-34)11-14-25)36(22-28(26)32(33)39)18-16-27-9-5-6-17-35-27/h2-11,13-14,17,19-20,22H,12,15-16,18H2,1H3	WZURRFVQEXUPMJ-UHFFFAOYSA-N	CC1(OC(=O)CCc2ccccc2)C(=O)C=C3C=C(N(CCc4ccccn4)C=C3C1=O)c5ccc(cc5)C#N	BroadT	BRD-A18164959	BRD-A18164959-001-07-7	Boston University CMLD	CMLD003545 CMLD003545			CC1(OC(=O)CCc2ccccc2)C(=O)C=C2C=C(N(CCc3ccccn3)C=C2C1=O)c1ccc(cc1)C#N	InChI=1S/C33H27N3O4/c1-33(40-31(38)15-12-23-7-3-2-4-8-23)30(37)20-26-19-29(25-13-10-24(21-34)11-14-25)36(22-28(26)32(33)39)18-16-27-9-5-6-17-35-27/h2-11,13-14,17,19-20,22H,12,15-16,18H2,1H3	WZURRFVQEXUPMJ-UHFFFAOYSA-N	529.200156374							123215
3-[5-(4-Propyl-cyclohexyl)-[1,2,4]oxadiazol-3-yl]-pyridine	LSM-34658	SID844365, BRD-K25128421	646685	InChI=1S/C16H21N3O/c1-2-4-12-6-8-13(9-7-12)16-18-15(19-20-16)14-5-3-10-17-11-14/h3,5,10-13H,2,4,6-9H2,1H3	QGUCBSXNMDKGML-UHFFFAOYSA-N	CCCC1CCC(CC1)c2onc(n2)c3cccnc3	BroadT	BRD-K25128421	BRD-K25128421-001-05-5	Asinex Ltd.	BAS 01416206			CCCC1CCC(CC1)c1nc(no1)-c1cccnc1	InChI=1S/C16H21N3O/c1-2-4-12-6-8-13(9-7-12)16-18-15(19-20-16)14-5-3-10-17-11-14/h3,5,10-13H,2,4,6-9H2,1H3	QGUCBSXNMDKGML-UHFFFAOYSA-N	271.168462322							123216
CHEMBL148072	LSM-34659	SID22413451, BRD-A71649063	4139010	InChI=1S/C15H16ClN5O3/c16-10-5-9(12-13(18-7-17-12)14(10)21(23)24)15(22)19-11-6-20-3-1-8(11)2-4-20/h5,7-8,11H,1-4,6H2,(H,17,18)(H,19,22)	YTMAQHHWGOVABH-UHFFFAOYSA-N	[O-][N+](=O)c1c(Cl)cc(C(=O)NC2CN3CCC2CC3)c4[nH]cnc14	BroadT	BRD-A71649063	BRD-A71649063-001-05-8	Specs	AP-685/41280831			[O-][N+](=O)c1c(Cl)cc(C(=O)NC2CN3CCC2CC3)c2[nH]cnc12	InChI=1S/C15H16ClN5O3/c16-10-5-9(12-13(18-7-17-12)14(10)21(23)24)15(22)19-11-6-20-3-1-8(11)2-4-20/h5,7-8,11H,1-4,6H2,(H,17,18)(H,19,22)	YTMAQHHWGOVABH-UHFFFAOYSA-N	349.094167132							123217
ST073015	LSM-34660	SID4244149, BRD-A68766327	3238786	InChI=1S/C10H10N4O2/c15-10(16)6-9(14-7-11-12-13-14)8-4-2-1-3-5-8/h1-5,7,9H,6H2,(H,15,16)	IPEATIREFBKQKS-UHFFFAOYSA-N	OC(=O)CC(c1ccccc1)n2cnnn2	BroadT	BRD-A68766327	BRD-A68766327-001-06-5	ChemDiv Inc.	8015-2093			OC(=O)CC(c1ccccc1)n1cnnn1	InChI=1S/C10H10N4O2/c15-10(16)6-9(14-7-11-12-13-14)8-4-2-1-3-5-8/h1-5,7,9H,6H2,(H,15,16)	IPEATIREFBKQKS-UHFFFAOYSA-N	218.0803756							123218
4-(5-Chloro-6-methyl-2-pyridin-2-ylpyrimidin-4-yl)morpholine	LSM-34661	SID26728083, BRD-K09278413	2796262	InChI=1S/C14H15ClN4O/c1-10-12(15)14(19-6-8-20-9-7-19)18-13(17-10)11-4-2-3-5-16-11/h2-5H,6-9H2,1H3	UYVGXGWXFNSCNB-UHFFFAOYSA-N	Cc1nc(nc(N2CCOCC2)c1Cl)c3ccccn3	BroadT	BRD-K09278413	BRD-K09278413-001-05-8	Maybridge	AW 01183			Cc1nc(nc(N2CCOCC2)c1Cl)-c1ccccn1	InChI=1S/C14H15ClN4O/c1-10-12(15)14(19-6-8-20-9-7-19)18-13(17-10)11-4-2-3-5-16-11/h2-5H,6-9H2,1H3	UYVGXGWXFNSCNB-UHFFFAOYSA-N	290.09343885							123219
SMR000220915	LSM-44511	SID17505806, BRD-K12513553	5846538	InChI=1S/C31H26N6O4/c1-19-11-8-9-15-25(19)41-29-24(30(39)36-16-10-12-20(2)27(36)34-29)17-22(18-32)28(38)33-26-21(3)35(4)37(31(26)40)23-13-6-5-7-14-23/h5-17H,1-4H3,(H,33,38)/b22-17+	HQQPWBLJSLTCET-OQKWZONESA-N	CN1N(C(=O)C(=C1C)NC(=O)\C(=C\C2=C(Oc3ccccc3C)N=C4N(C=CC=C4C)C2=O)\C#N)c5ccccc5	BroadT	BRD-K12513553	BRD-K12513553-001-06-1	InterBioScreen Ltd.	STOCK5S-20766			Cc1c(NC(=O)C(=C\c2c(Oc3ccccc3C)nc3c(C)cccn3c2=O)\C#N)c(=O)n(-c2ccccc2)n1C	InChI=1S/C31H26N6O4/c1-19-11-8-9-15-25(19)41-29-24(30(39)36-16-10-12-20(2)27(36)34-29)17-22(18-32)28(38)33-26-21(3)35(4)37(31(26)40)23-13-6-5-7-14-23/h5-17H,1-4H3,(H,33,38)/b22-17+	HQQPWBLJSLTCET-OQKWZONESA-N	546.201553372							
SMR000022333	LSM-34663	SID4251314, BRD-K73042423	3245016	InChI=1S/C18H20F3N3O2/c1-25-14-8-7-11(9-15(14)26-2)13-10-16(18(19,20)21)24-17(23-13)22-12-5-3-4-6-12/h7-10,12H,3-6H2,1-2H3,(H,22,23,24)	ZJJDJLGQQSIOGL-UHFFFAOYSA-N	COc1ccc(cc1OC)c2cc(nc(NC3CCCC3)n2)C(F)(F)F	BroadT	BRD-K73042423	BRD-K73042423-001-05-7	ChemDiv Inc.	C130-0388			COc1ccc(cc1OC)-c1cc(nc(NC2CCCC2)n1)C(F)(F)F	InChI=1S/C18H20F3N3O2/c1-25-14-8-7-11(9-15(14)26-2)13-10-16(18(19,20)21)24-17(23-13)22-12-5-3-4-6-12/h7-10,12H,3-6H2,1-2H3,(H,22,23,24)	ZJJDJLGQQSIOGL-UHFFFAOYSA-N	367.15076151							123221
T5321448	LSM-34664	SID26658139, BRD-K62246028	2485743	InChI=1S/C9H6N4/c10-4-8(5-11)6-13-9-2-1-3-12-7-9/h1-3,6-7,13H	BBGXNSAUVNOZEC-UHFFFAOYSA-N	N#CC(=CNc1cccnc1)C#N	BroadT	BRD-K62246028	BRD-K62246028-001-05-6	Enamine Ltd.	T5321448			N#CC(=CNc1cccnc1)C#N	InChI=1S/C9H6N4/c10-4-8(5-11)6-13-9-2-1-3-12-7-9/h1-3,6-7,13H	BBGXNSAUVNOZEC-UHFFFAOYSA-N	170.059246232							123222
AN-023/12771002	LSM-34665	SID850693, BRD-K94624488	653222	InChI=1S/C15H20N4OS/c1-3-7-13(8-4-1)19-15(16-17-18-19)21-12-11-20-14-9-5-2-6-10-14/h2,5-6,9-10,13H,1,3-4,7-8,11-12H2	OBEVICZVSRHMBU-UHFFFAOYSA-N	C(CSc1nnnn1C2CCCCC2)Oc3ccccc3	BroadT	BRD-K94624488	BRD-K94624488-001-06-7	Asinex Ltd.	BAS 01063654			C(CSc1nnnn1C1CCCCC1)Oc1ccccc1	InChI=1S/C15H20N4OS/c1-3-7-13(8-4-1)19-15(16-17-18-19)21-12-11-20-14-9-5-2-6-10-14/h2,5-6,9-10,13H,1,3-4,7-8,11-12H2	OBEVICZVSRHMBU-UHFFFAOYSA-N	304.13578199							123223
CHEMBL1622911	LSM-15481	BRD-A60972564	16807220	InChI=1S/C20H27N3O2/c1-16-6-5-7-19(17(16)2)25-15-18(24)14-22-10-12-23(13-11-22)20-8-3-4-9-21-20/h3-9,18,24H,10-15H2,1-2H3	JVTUIUBKUWYEBL-UHFFFAOYSA-N	Cc1cccc(OCC(O)CN2CCN(CC2)c3ccccn3)c1C	BroadT	BRD-A60972564	BRD-A60972564-003-06-5	Life Chemicals Inc.	F1562-0091		Cl	Cc1cccc(OCC(O)CN2CCN(CC2)c2ccccn2)c1C.Cl	InChI=1S/C20H27N3O2.ClH/c1-16-6-5-7-19(17(16)2)25-15-18(24)14-22-10-12-23(13-11-22)20-8-3-4-9-21-20;/h3-9,18,24H,10-15H2,1-2H3;1H	KAMMUORHNORUTQ-UHFFFAOYSA-N	341.210327134							104124, 104124
AC1LP8MW	LSM-34666	SID17415335, BRD-K68501905	1327906	InChI=1S/C22H18N2O3S/c25-20(24-22(28)23-18-13-7-12-17(14-18)21(26)27)19(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-14,19H,(H,26,27)(H2,23,24,25,28)	CFTAIKMODCWZDW-UHFFFAOYSA-N	OC(=O)c1cccc(NC(=S)NC(=O)C(c2ccccc2)c3ccccc3)c1	BroadT	BRD-K68501905	BRD-K68501905-001-05-6	ChemBridge Corporation	7000846			OC(=O)c1cccc(NC(=S)NC(=O)C(c2ccccc2)c2ccccc2)c1	InChI=1S/C22H18N2O3S/c25-20(24-22(28)23-18-13-7-12-17(14-18)21(26)27)19(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-14,19H,(H,26,27)(H2,23,24,25,28)	CFTAIKMODCWZDW-UHFFFAOYSA-N	390.103813146							123224
SMR000095943	LSM-34667	SID7967378, BRD-K36913136	5308793	InChI=1S/C21H18N6O2/c28-18-12-25(13-19(29)26(18)11-10-15-6-2-1-3-7-15)20-21-24-22-14-27(21)17-9-5-4-8-16(17)23-20/h1-9,14H,10-13H2	SMWBUXZLLHGKHV-UHFFFAOYSA-N	O=C1CN(CC(=O)N1CCc2ccccc2)c3nc4ccccc4n5cnnc35	BroadT	BRD-K36913136	BRD-K36913136-001-04-6	ChemDiv Inc.	C735-0066			O=C1CN(CC(=O)N1CCc1ccccc1)c1nc2ccccc2n2cnnc12	InChI=1S/C21H18N6O2/c28-18-12-25(13-19(29)26(18)11-10-15-6-2-1-3-7-15)20-21-24-22-14-27(21)17-9-5-4-8-16(17)23-20/h1-9,14H,10-13H2	SMWBUXZLLHGKHV-UHFFFAOYSA-N	386.149123876							123225
MLS000882831	LSM-34668	SID26732170, BRD-A14828191	16746349	InChI=1S/C28H24F3NO/c29-28(30,31)22-16-14-21(15-17-22)26-24-13-7-12-23(20-10-5-2-6-11-20)25(24)27(33)32(26)18-19-8-3-1-4-9-19/h1-11,13-17,23-26H,12,18H2/t23?,24?,25?,26-/m0/s1	WYYXBFAZCDHMPY-ILVMPNSOSA-N	FC(F)(F)c1ccc(cc1)[C@H]2C3C=CCC(C3C(=O)N2Cc4ccccc4)c5ccccc5	BroadT	BRD-A14828191	BRD-A14828191-001-06-1	University of Kansas CMLD	KUC101301N			FC(F)(F)c1ccc(cc1)[C@H]1C2C=CCC(C2C(=O)N1Cc1ccccc1)c1ccccc1	InChI=1S/C28H24F3NO/c29-28(30,31)22-16-14-21(15-17-22)26-24-13-7-12-23(20-10-5-2-6-11-20)25(24)27(33)32(26)18-19-8-3-1-4-9-19/h1-11,13-17,23-26H,12,18H2/t23?,24?,25?,26-/m0/s1	WYYXBFAZCDHMPY-ILVMPNSOSA-N	447.180998998							123226
1-(2,4-Dichlorobenzyl)-4-(methylsulfanyl)-2-oxo-6-phenyl-1,2-dihydro-3-pyridinecarbonitrile	LSM-34669	SID14729286, BRD-K97802708	4269829	InChI=1S/C20H14Cl2N2OS/c1-26-19-10-18(13-5-3-2-4-6-13)24(20(25)16(19)11-23)12-14-7-8-15(21)9-17(14)22/h2-10H,12H2,1H3	AWRHBIJUBLUIGV-UHFFFAOYSA-N	CSC1=C(C#N)C(=O)N(Cc2ccc(Cl)cc2Cl)C(=C1)c3ccccc3	BroadT	BRD-K97802708	BRD-K97802708-001-05-2	Key Organics Ltd.	4L-526S			CSc1cc(-c2ccccc2)n(Cc2ccc(Cl)cc2Cl)c(=O)c1C#N	InChI=1S/C20H14Cl2N2OS/c1-26-19-10-18(13-5-3-2-4-6-13)24(20(25)16(19)11-23)12-14-7-8-15(21)9-17(14)22/h2-10H,12H2,1H3	AWRHBIJUBLUIGV-UHFFFAOYSA-N	400.020389198							123227
SMR000082299	LSM-34670	SID4262997, BRD-K83547087	2980923	InChI=1S/C19H21NO5/c1-12(2)25-16-6-4-13(10-17(16)22-3)19(21)20-14-5-7-15-18(11-14)24-9-8-23-15/h4-7,10-12H,8-9H2,1-3H3,(H,20,21)	SSOQYRTVEFFMIO-UHFFFAOYSA-N	COc1cc(ccc1OC(C)C)C(=O)Nc2ccc3OCCOc3c2	BroadT	BRD-K83547087	BRD-K83547087-001-05-0	ChemBridge Corporation	7979883			COc1cc(ccc1OC(C)C)C(=O)Nc1ccc2OCCOc2c1	InChI=1S/C19H21NO5/c1-12(2)25-16-6-4-13(10-17(16)22-3)19(21)20-14-5-7-15-18(11-14)24-9-8-23-15/h4-7,10-12H,8-9H2,1-3H3,(H,20,21)	SSOQYRTVEFFMIO-UHFFFAOYSA-N	343.141972782							123228
MLS000574241	LSM-44512	SID17414262, BRD-K79408225	1337412	InChI=1S/C22H20N4O2S/c1-3-28-18-10-9-15(11-14(18)2)20-16(12-19-21(27)24-22(23)29-19)13-26(25-20)17-7-5-4-6-8-17/h4-13H,3H2,1-2H3,(H2,23,24,27)/b19-12-	XLGZUCLOYKPZHM-UNOMPAQXSA-N	CCOc1ccc(cc1C)c2nn(cc2\C=C\3/SC(=NC3=O)N)c4ccccc4	BroadT	BRD-K79408225	BRD-K79408225-001-05-4	ChemBridge Corporation	6638537			CCOc1ccc(cc1C)-c1nn(cc1\C=C1/SC(N)=NC1=O)-c1ccccc1	InChI=1S/C22H20N4O2S/c1-3-28-18-10-9-15(11-14(18)2)20-16(12-19-21(27)24-22(23)29-19)13-26(25-20)17-7-5-4-6-8-17/h4-13H,3H2,1-2H3,(H2,23,24,27)/b19-12-	XLGZUCLOYKPZHM-UNOMPAQXSA-N	404.13069661							
TCMDC-124506	LSM-34672	GNF-PF-3704, TCMDC-124506, BRD-K96794388	2810695	InChI=1S/C18H13F5N4O/c1-27-16(25-17(28)24-13-8-6-12(20)7-9-13)14(15(26-27)18(21,22)23)10-2-4-11(19)5-3-10/h2-9H,1H3,(H2,24,25,28)	BJWCFFZTMUBHLH-UHFFFAOYSA-N	Cn1nc(c(c2ccc(F)cc2)c1NC(=O)Nc3ccc(F)cc3)C(F)(F)F	BroadT	BRD-K96794388	BRD-K96794388-001-05-9	Maybridge	HTS 02417			Cn1nc(c(c1NC(=O)Nc1ccc(F)cc1)-c1ccc(F)cc1)C(F)(F)F	InChI=1S/C18H13F5N4O/c1-27-16(25-17(28)24-13-8-6-12(20)7-9-13)14(15(26-27)18(21,22)23)10-2-4-11(19)5-3-10/h2-9H,1H3,(H2,24,25,28)	BJWCFFZTMUBHLH-UHFFFAOYSA-N	396.100952076							123230
F1813-0349	LSM-34673	SID22400417, BRD-K66630097	7172915	InChI=1S/C20H17N3O3S/c1-11-3-4-12(2)18-17(11)21-20(27-18)22-19(26)13-5-7-14(8-6-13)23-15(24)9-10-16(23)25/h3-8H,9-10H2,1-2H3,(H,21,22,26)	MESADALDHZDWFQ-UHFFFAOYSA-N	Cc1ccc(C)c2sc(NC(=O)c3ccc(cc3)N4C(=O)CCC4=O)nc12	BroadT	BRD-K66630097	BRD-K66630097-001-04-6	Life Chemicals Inc.	F1813-0349			Cc1ccc(C)c2sc(NC(=O)c3ccc(cc3)N3C(=O)CCC3=O)nc12	InChI=1S/C20H17N3O3S/c1-11-3-4-12(2)18-17(11)21-20(27-18)22-19(26)13-5-7-14(8-6-13)23-15(24)9-10-16(23)25/h3-8H,9-10H2,1-2H3,(H,21,22,26)	MESADALDHZDWFQ-UHFFFAOYSA-N	379.099062124							123231
MLS000530567	LSM-34674	SID14746439, BRD-A40851264	2885307	InChI=1S/C21H18N2O6/c24-18(22-14-4-1-3-13(9-14)21(27)28)12-6-7-16-17(10-12)20(26)23(19(16)25)11-15-5-2-8-29-15/h1,3-4,6-7,9-10,15H,2,5,8,11H2,(H,22,24)(H,27,28)	KPXBFDNDBXNEAQ-UHFFFAOYSA-N	OC(=O)c1cccc(NC(=O)c2ccc3C(=O)N(CC4CCCO4)C(=O)c3c2)c1	BroadT	BRD-A40851264	BRD-A40851264-001-05-5	ChemBridge Corporation	6085556			OC(=O)c1cccc(NC(=O)c2ccc3C(=O)N(CC4CCCO4)C(=O)c3c2)c1	InChI=1S/C21H18N2O6/c24-18(22-14-4-1-3-13(9-14)21(27)28)12-6-7-16-17(10-12)20(26)23(19(16)25)11-15-5-2-8-29-15/h1,3-4,6-7,9-10,15H,2,5,8,11H2,(H,22,24)(H,27,28)	KPXBFDNDBXNEAQ-UHFFFAOYSA-N	394.116486316							123232
MLS000048462	LSM-34675	SID3717446, BRD-K98858172	3000003	InChI=1S/C15H11N3O2S2/c19-14(7-10-8-18-5-6-21-15(18)16-10)20-9-13-17-11-3-1-2-4-12(11)22-13/h1-6,8H,7,9H2	ODXZMIYAIOAUCQ-UHFFFAOYSA-N	O=C(Cc1cn2ccsc2n1)OCc3nc4ccccc4s3	BroadT	BRD-K98858172	BRD-K98858172-001-03-5	Enamine Ltd.	T0513-3320			O=C(Cc1cn2ccsc2n1)OCc1nc2ccccc2s1	InChI=1S/C15H11N3O2S2/c19-14(7-10-8-18-5-6-21-15(18)16-10)20-9-13-17-11-3-1-2-4-12(11)22-13/h1-6,8H,7,9H2	ODXZMIYAIOAUCQ-UHFFFAOYSA-N	329.029268002							123233
6-Amino-1-benzyl-5-methylaminouracil	LSM-34676	SID14745260, BRD-K50189220	726225	InChI=1S/C12H14N4O2/c1-14-9-10(13)16(12(18)15-11(9)17)7-8-5-3-2-4-6-8/h2-6,14H,7,13H2,1H3,(H,15,17,18)	HMRFBSJXLDMJAC-UHFFFAOYSA-N	CNC1=C(N)N(Cc2ccccc2)C(=O)NC1=O	BroadT	BRD-K50189220	BRD-K50189220-001-06-6	Enamine Ltd.	T0514-1549			CNc1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O	InChI=1S/C12H14N4O2/c1-14-9-10(13)16(12(18)15-11(9)17)7-8-5-3-2-4-6-8/h2-6,14H,7,13H2,1H3,(H,15,17,18)	HMRFBSJXLDMJAC-UHFFFAOYSA-N	246.111675728							123234
ST50340086	LSM-34677	SID3714188, BRD-A37190730	2998698	InChI=1S/C12H12N2O2S/c15-11(9-5-3-7-16-9)14-12-13-8-4-1-2-6-10(8)17-12/h1-2,4,6,9H,3,5,7H2,(H,13,14,15)	MPAIHQCCOOPREO-UHFFFAOYSA-N	O=C(Nc1nc2ccccc2s1)C3CCCO3	BroadT	BRD-A37190730	BRD-A37190730-001-05-9	Enamine Ltd.	T5264255			O=C(Nc1nc2ccccc2s1)C1CCCO1	InChI=1S/C12H12N2O2S/c15-11(9-5-3-7-16-9)14-12-13-8-4-1-2-6-10(8)17-12/h1-2,4,6,9H,3,5,7H2,(H,13,14,15)	MPAIHQCCOOPREO-UHFFFAOYSA-N	248.061948334							123235
MLS000531387	LSM-34678	SID14731013, BRD-K61230178	2187354	InChI=1S/C20H28N2O3S2/c1-3-5-13-22(14-6-4-2)27(24,25)19-11-9-17(10-12-19)21-20(23)16-18-8-7-15-26-18/h7-12,15H,3-6,13-14,16H2,1-2H3,(H,21,23)	QEJHLSBDMXBLQO-UHFFFAOYSA-N	CCCCN(CCCC)S(=O)(=O)c1ccc(NC(=O)Cc2cccs2)cc1	BroadT	BRD-K61230178	BRD-K61230178-001-05-9	ChemBridge Corporation	7385532			CCCCN(CCCC)S(=O)(=O)c1ccc(NC(=O)Cc2cccs2)cc1	InChI=1S/C20H28N2O3S2/c1-3-5-13-22(14-6-4-2)27(24,25)19-11-9-17(10-12-19)21-20(23)16-18-8-7-15-26-18/h7-12,15H,3-6,13-14,16H2,1-2H3,(H,21,23)	QEJHLSBDMXBLQO-UHFFFAOYSA-N	408.154134156							123236
AC1LCOSY	LSM-34679	SID851063, BRD-K12970024	653615	InChI=1S/C15H14N6O2S2/c1-7-4-10(20-23-7)17-11(22)5-24-15-19-18-13-12-8(2)9(3)25-14(12)16-6-21(13)15/h4,6H,5H2,1-3H3,(H,17,20,22)	UUTFLOOIJMDNEY-UHFFFAOYSA-N	Cc1onc(NC(=O)CSc2nnc3c4c(C)c(C)sc4ncn23)c1	BroadT	BRD-K12970024	BRD-K12970024-001-05-6	Asinex Ltd.	ASN 05044705			Cc1cc(NC(=O)CSc2nnc3c4c(C)c(C)sc4ncn23)no1	InChI=1S/C15H14N6O2S2/c1-7-4-10(20-23-7)17-11(22)5-24-15-19-18-13-12-8(2)9(3)25-14(12)16-6-21(13)15/h4,6H,5H2,1-3H3,(H,17,20,22)	UUTFLOOIJMDNEY-UHFFFAOYSA-N	374.061965128							123237
MLS000062466	LSM-34680	SID4263145, BRD-K32682384	892396	InChI=1S/C12H11N3O2S/c13-8-9-12(15-3-5-16-6-4-15)17-11(14-9)10-2-1-7-18-10/h1-2,7H,3-6H2	XAGWXZRVFOZLMS-UHFFFAOYSA-N	N#Cc1nc(oc1N2CCOCC2)c3cccs3	BroadT	BRD-K32682384	BRD-K32682384-001-05-7	ChemBridge Corporation	7533942			N#Cc1nc(oc1N1CCOCC1)-c1cccs1	InChI=1S/C12H11N3O2S/c13-8-9-12(15-3-5-16-6-4-15)17-11(14-9)10-2-1-7-18-10/h1-2,7H,3-6H2	XAGWXZRVFOZLMS-UHFFFAOYSA-N	261.057197312							123238
SMR000147204	LSM-34681	SID14729384, SID87348297, BRD-K39488700	54698364	InChI=1S/C29H30N4O4/c1-18(2)17-32-23-15-9-7-13-21(23)26(34)25(29(32)37)27(35)31-33-24(16-19-10-4-3-5-11-19)30-22-14-8-6-12-20(22)28(33)36/h3-6,8,10-12,14,18,34H,7,9,13,15-17H2,1-2H3,(H,31,35)	LOTXDUWATXMTKQ-UHFFFAOYSA-N	CC(C)CN1C2=C(CCCC2)C(=C(C(=O)NN3C(=Nc4ccccc4C3=O)Cc5ccccc5)C1=O)O	BroadT	BRD-K39488700	BRD-K39488700-001-05-9	InterBioScreen Ltd.	STOCK3S-13257			CC(C)Cn1c2CCCCc2c(O)c(C(=O)Nn2c(Cc3ccccc3)nc3ccccc3c2=O)c1=O	InChI=1S/C29H30N4O4/c1-18(2)17-32-23-15-9-7-13-21(23)26(34)25(29(32)37)27(35)31-33-24(16-19-10-4-3-5-11-19)30-22-14-8-6-12-20(22)28(33)36/h3-6,8,10-12,14,18,34H,7,9,13,15-17H2,1-2H3,(H,31,35)	LOTXDUWATXMTKQ-UHFFFAOYSA-N	498.22670548							123239
5-Isopropyl-2-methoxy-n-pyridin-2-yl-benzenesulfonamide	LSM-34682	SID14723004, BRD-K82639245	977116	InChI=1S/C15H18N2O3S/c1-11(2)12-7-8-13(20-3)14(10-12)21(18,19)17-15-6-4-5-9-16-15/h4-11H,1-3H3,(H,16,17)	WNAQXBSCHKSRNI-UHFFFAOYSA-N	COc1ccc(cc1S(=O)(=O)Nc2ccccn2)C(C)C	BroadT	BRD-K82639245	BRD-K82639245-001-06-3	Asinex Ltd.	BAS 07243584			COc1ccc(cc1S(=O)(=O)Nc1ccccn1)C(C)C	InChI=1S/C15H18N2O3S/c1-11(2)12-7-8-13(20-3)14(10-12)21(18,19)17-15-6-4-5-9-16-15/h4-11H,1-3H3,(H,16,17)	WNAQXBSCHKSRNI-UHFFFAOYSA-N	306.103813146							123240
1-(2-Methoxyphenyl)-5-phenyl-1H-imidazole-2-thiol	LSM-34683	SID24828682, BRD-K51781055	4962043	InChI=1S/C16H14N2OS/c1-19-15-10-6-5-9-13(15)18-14(11-17-16(18)20)12-7-3-2-4-8-12/h2-11H,1H3,(H,17,20)	LCWBURIJWSVRGX-UHFFFAOYSA-N	COc1ccccc1n2c(S)ncc2c3ccccc3	BroadT	BRD-K51781055	BRD-K51781055-001-05-1	Enamine Ltd.	T5342212			COc1ccccc1-n1c(S)ncc1-c1ccccc1	InChI=1S/C16H14N2OS/c1-19-15-10-6-5-9-13(15)18-14(11-17-16(18)20)12-7-3-2-4-8-12/h2-11H,1H3,(H,17,20)	LCWBURIJWSVRGX-UHFFFAOYSA-N	282.082683778							123241
AC1NBFAW	LSM-34684	SID7971555, BRD-K36152845	4442363	InChI=1S/C19H21N3O4/c1-12-6-5-7-22-11-14(21-18(12)22)10-20-19(23)13-8-15(24-2)17(26-4)16(9-13)25-3/h5-9,11H,10H2,1-4H3,(H,20,23)	TYOWZJQWJYOTRT-UHFFFAOYSA-N	COc1cc(cc(OC)c1OC)C(=O)NCc2cn3cccc(C)c3n2	BroadT	BRD-K36152845	BRD-K36152845-001-04-3	Life Chemicals Inc.	F1836-0198			COc1cc(cc(OC)c1OC)C(=O)NCc1cn2cccc(C)c2n1	InChI=1S/C19H21N3O4/c1-12-6-5-7-22-11-14(21-18(12)22)10-20-19(23)13-8-15(24-2)17(26-4)16(9-13)25-3/h5-9,11H,10H2,1-4H3,(H,20,23)	TYOWZJQWJYOTRT-UHFFFAOYSA-N	355.153206182							123242
MLS000047899	LSM-15596	BRD-A18801385	3242226	InChI=1S/C17H25N3O/c21-17(20-10-2-1-3-11-20)16-7-5-9-19(14-16)13-15-6-4-8-18-12-15/h4,6,8,12,16H,1-3,5,7,9-11,13-14H2	UCTQQTQLEJOYLT-UHFFFAOYSA-N	O=C(C1CCCN(Cc2cccnc2)C1)N3CCCCC3	BroadT	BRD-A18801385	BRD-A18801385-034-05-3	ChemDiv Inc.	5979-0234		OC(=O)C(=O)O	O=C(C1CCCN(Cc2cccnc2)C1)N1CCCCC1.OC(=O)C(=O)O	InChI=1S/C17H25N3O.C2H2O4/c21-17(20-10-2-1-3-11-20)16-7-5-9-19(14-16)13-15-6-4-8-18-12-15;3-1(4)2(5)6/h4,6,8,12,16H,1-3,5,7,9-11,13-14H2;(H,3,4)(H,5,6)	UBQYVMUMPWWKPU-UHFFFAOYSA-N	287.19976245							104232, 104232
SMR000073856	LSM-34685	SID4261494, BRD-K14066884	768895	InChI=1S/C16H23NO4S/c1-20-14-8-9-15(21-2)16(12-14)22(18,19)17-11-10-13-6-4-3-5-7-13/h6,8-9,12,17H,3-5,7,10-11H2,1-2H3	AUTAHAXBVMFIRR-UHFFFAOYSA-N	COc1ccc(OC)c(c1)S(=O)(=O)NCCC2=CCCCC2	BroadT	BRD-K14066884	BRD-K14066884-001-05-0	ChemBridge Corporation	7618156			COc1ccc(OC)c(c1)S(=O)(=O)NCCC1=CCCCC1	InChI=1S/C16H23NO4S/c1-20-14-8-9-15(21-2)16(12-14)22(18,19)17-11-10-13-6-4-3-5-7-13/h6,8-9,12,17H,3-5,7,10-11H2,1-2H3	AUTAHAXBVMFIRR-UHFFFAOYSA-N	325.134778916							123243
AC1M5LJ3	LSM-34686	BRD-K83816927	2356045	InChI=1S/C17H14N4S/c22-17(20-15-6-2-1-3-7-15)21-19-12-13-8-9-16-14(11-13)5-4-10-18-16/h1-12H,(H2,20,21,22)	FAKZZIYGYDHZGZ-UHFFFAOYSA-N	S=C(NN=Cc1ccc2ncccc2c1)Nc3ccccc3	BroadT	BRD-K83816927	BRD-K83816927-001-06-1	Enamine Ltd.	T0509-1066			S=C(NN=Cc1ccc2ncccc2c1)Nc1ccccc1	InChI=1S/C17H14N4S/c22-17(20-15-6-2-1-3-7-15)21-19-12-13-8-9-16-14(11-13)5-4-10-18-16/h1-12H,(H2,20,21,22)	FAKZZIYGYDHZGZ-UHFFFAOYSA-N	306.093917178							123244
HMS2305G18	LSM-44513	BRD-K31945831	11958895	InChI=1S/C18H20N4/c1-2-7-17(8-3-1)9-6-12-20-22-15-13-21(14-16-22)18-10-4-5-11-19-18/h1-12H,13-16H2/b9-6+,20-12?	DYJPBWZMZVMRSW-TUFICTCESA-N	C1CN(CCN1N=C\C=C\c2ccccc2)c3ccccn3	BroadT	BRD-K31945831	BRD-K31945831-001-05-8	ChemBridge Corporation	5792461			C1CN(CCN1N=C\C=C\c1ccccc1)c1ccccn1	InChI=1S/C18H20N4/c1-2-7-17(8-3-1)9-6-12-20-22-15-13-21(14-16-22)18-10-4-5-11-19-18/h1-12H,13-16H2/b9-6+,20-12?	DYJPBWZMZVMRSW-TUFICTCESA-N	292.16879668							
2,5-Dimethyl-4-(4-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxylic acid	LSM-34688	SID4250152, BRD-K04118064	3244005	InChI=1S/C15H19N3O2S/c1-8-4-6-18(7-5-8)13-11-9(2)12(15(19)20)21-14(11)17-10(3)16-13/h8H,4-7H2,1-3H3,(H,19,20)	ZAYBTAGWQGMXRC-UHFFFAOYSA-N	CC1CCN(CC1)c2nc(C)nc3sc(C(=O)O)c(C)c23	BroadT	BRD-K04118064	BRD-K04118064-001-05-3	ChemDiv Inc.	3909-8483			CC1CCN(CC1)c1nc(C)nc2sc(C(O)=O)c(C)c12	InChI=1S/C15H19N3O2S/c1-8-4-6-18(7-5-8)13-11-9(2)12(15(19)20)21-14(11)17-10(3)16-13/h8H,4-7H2,1-3H3,(H,19,20)	ZAYBTAGWQGMXRC-UHFFFAOYSA-N	305.119797568							123246
AC1M1WNU	LSM-34689	SID7971309, BRD-K61649146	2157363	InChI=1S/C17H22N2O3/c1-5-22-16(21)15-14(19-13(20)10-17(2,3)4)11-8-6-7-9-12(11)18-15/h6-9,18H,5,10H2,1-4H3,(H,19,20)	LDUFOWFRGBGJGT-UHFFFAOYSA-N	CCOC(=O)c1[nH]c2ccccc2c1NC(=O)CC(C)(C)C	BroadT	BRD-K61649146	BRD-K61649146-001-04-2	Life Chemicals Inc.	F0588-0141			CCOC(=O)c1[nH]c2ccccc2c1NC(=O)CC(C)(C)C	InChI=1S/C17H22N2O3/c1-5-22-16(21)15-14(19-13(20)10-17(2,3)4)11-8-6-7-9-12(11)18-15/h6-9,18H,5,10H2,1-4H3,(H,19,20)	LDUFOWFRGBGJGT-UHFFFAOYSA-N	302.163042584							123247
MLS000047943	LSM-15482	BRD-K75913608	2982237	InChI=1S/C19H20BrFN2O/c20-16-7-5-15(6-8-16)19(24)9-10-22-11-13-23(14-12-22)18-4-2-1-3-17(18)21/h1-8H,9-14H2	COYPQWFXZVIOEG-UHFFFAOYSA-N	Fc1ccccc1N2CCN(CCC(=O)c3ccc(Br)cc3)CC2	BroadT	BRD-K75913608	BRD-K75913608-003-05-0	ChemDiv Inc.	6350-0016		Cl	Fc1ccccc1N1CCN(CCC(=O)c2ccc(Br)cc2)CC1.Cl	InChI=1S/C19H20BrFN2O.ClH/c20-16-7-5-15(6-8-16)19(24)9-10-22-11-13-23(14-12-22)18-4-2-1-3-17(18)21;/h1-8H,9-14H2;1H	JCLPXVJZHRFTNI-UHFFFAOYSA-N	390.07430408							104125, 104125
MLS000530761	LSM-34690	SID14739806, BRD-K10991081	1332299	InChI=1S/C25H23NO5S/c1-25(2)13-21(27)23-19-12-20(26-32(28,29)16-10-8-15(30-3)9-11-16)17-6-4-5-7-18(17)24(19)31-22(23)14-25/h4-12,26H,13-14H2,1-3H3	VQIHVNJYEXYLGL-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)Nc2cc3c4C(=O)CC(C)(C)Cc4oc3c5ccccc25	BroadT	BRD-K10991081	BRD-K10991081-001-06-2	ChemBridge Corporation	6738721			COc1ccc(cc1)S(=O)(=O)Nc1cc2c3c(CC(C)(C)CC3=O)oc2c2ccccc12	InChI=1S/C25H23NO5S/c1-25(2)13-21(27)23-19-12-20(26-32(28,29)16-10-8-15(30-3)9-11-16)17-6-4-5-7-18(17)24(19)31-22(23)14-25/h4-12,26H,13-14H2,1-3H3	VQIHVNJYEXYLGL-UHFFFAOYSA-N	449.129693536							123248
SMR000044389	LSM-34691	SID862409, BRD-A39166114	663634	InChI=1S/C17H24N2O3/c1-3-11(2)15(16(20)21)19-17(22)18-14-10-6-8-12-7-4-5-9-13(12)14/h4-5,7,9,11,14-15H,3,6,8,10H2,1-2H3,(H,20,21)(H2,18,19,22)/t11?,14?,15-/m0/s1	JBXTXIBJTZOOPH-KWCHVYNWSA-N	CCC(C)[C@H](NC(=O)NC1CCCc2ccccc12)C(=O)O	BroadT	BRD-A39166114	BRD-A39166114-001-05-3	InterBioScreen Ltd.	STOCK4S-39261			CCC(C)[C@H](NC(=O)NC1CCCc2ccccc12)C(O)=O	InChI=1S/C17H24N2O3/c1-3-11(2)15(16(20)21)19-17(22)18-14-10-6-8-12-7-4-5-9-13(12)14/h4-5,7,9,11,14-15H,3,6,8,10H2,1-2H3,(H,20,21)(H2,18,19,22)/t11?,14?,15-/m0/s1	JBXTXIBJTZOOPH-KWCHVYNWSA-N	304.178692648							123249
ZINC05841912	LSM-34692	SID24837911, BRD-K70264441	3972180	InChI=1S/C19H19N3O3S/c1-13-8-10-15(12-18(13)26(24,25)22(2)3)20-19(23)17-11-9-14-6-4-5-7-16(14)21-17/h4-12H,1-3H3,(H,20,23)	REWOYCGJXJSSRQ-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cc(NC(=O)c2ccc3ccccc3n2)ccc1C	BroadT	BRD-K70264441	BRD-K70264441-001-05-8	Enamine Ltd.	T5267840			CN(C)S(=O)(=O)c1cc(NC(=O)c2ccc3ccccc3n2)ccc1C	InChI=1S/C19H19N3O3S/c1-13-8-10-15(12-18(13)26(24,25)22(2)3)20-19(23)17-11-9-14-6-4-5-7-16(14)21-17/h4-12H,1-3H3,(H,20,23)	REWOYCGJXJSSRQ-UHFFFAOYSA-N	369.114712188							123250
AC1MDX2R	LSM-34693	BRD-K70162048	2818166	InChI=1S/C20H20N4O2S/c1-3-26-19(25)18(24-23-16-7-5-4-6-8-16)17-13-27-20(22-17)21-15-11-9-14(2)10-12-15/h4-13,23H,3H2,1-2H3,(H,21,22)	IBMOVHOVJBNVIH-UHFFFAOYSA-N	CCOC(=O)C(=NNc1ccccc1)c2csc(Nc3ccc(C)cc3)n2	BroadT	BRD-K70162048	BRD-K70162048-001-06-9	ChemBridge Corporation	5148815			CCOC(=O)C(=NNc1ccccc1)c1csc(Nc2ccc(C)cc2)n1	InChI=1S/C20H20N4O2S/c1-3-26-19(25)18(24-23-16-7-5-4-6-8-16)17-13-27-20(22-17)21-15-11-9-14(2)10-12-15/h4-13,23H,3H2,1-2H3,(H,21,22)	IBMOVHOVJBNVIH-UHFFFAOYSA-N	380.13069661							123251
MLS000573411	LSM-34694	SID17415481, BRD-K15626441	2281387	InChI=1S/C17H15F3N2OS/c1-10-7-8-12(9-11(10)2)15(23)22-16(24)21-14-6-4-3-5-13(14)17(18,19)20/h3-9H,1-2H3,(H2,21,22,23,24)	SEZGQWZDAFYNQP-UHFFFAOYSA-N	Cc1ccc(cc1C)C(=O)NC(=S)Nc2ccccc2C(F)(F)F	BroadT	BRD-K15626441	BRD-K15626441-001-05-6	ChemBridge Corporation	6407216			Cc1ccc(cc1C)C(=O)NC(=S)Nc1ccccc1C(F)(F)F	InChI=1S/C17H15F3N2OS/c1-10-7-8-12(9-11(10)2)15(23)22-16(24)21-14-6-4-3-5-13(14)17(18,19)20/h3-9H,1-2H3,(H2,21,22,23,24)	SEZGQWZDAFYNQP-UHFFFAOYSA-N	352.08571841							123252
BAS 03613921	LSM-34695	SID24838347, SID7965180, BRD-K35632260	1166185	InChI=1S/C20H16F3N3O4S/c21-20(22,23)17-9-14(12-3-4-15-16(8-12)30-11-29-15)25-19(26-17)31-7-5-18(27)24-10-13-2-1-6-28-13/h1-4,6,8-9H,5,7,10-11H2,(H,24,27)	AVRLWTHPEGLUJT-UHFFFAOYSA-N	FC(F)(F)c1cc(nc(SCCC(=O)NCc2occc2)n1)c3ccc4OCOc4c3	BroadT	BRD-K35632260	BRD-K35632260-001-05-8	ChemDiv Inc.	6466-1142			FC(F)(F)c1cc(nc(SCCC(=O)NCc2ccco2)n1)-c1ccc2OCOc2c1	InChI=1S/C20H16F3N3O4S/c21-20(22,23)17-9-14(12-3-4-15-16(8-12)30-11-29-15)25-19(26-17)31-7-5-18(27)24-10-13-2-1-6-28-13/h1-4,6,8-9H,5,7,10-11H2,(H,24,27)	AVRLWTHPEGLUJT-UHFFFAOYSA-N	451.081361312							123253
T0509-3020	LSM-34696	SID24825027, BRD-K78842668	2358432	InChI=1S/C18H19NO4/c1-19(2)14-10-8-13(9-11-14)18(21)23-12-16(20)15-6-4-5-7-17(15)22-3/h4-11H,12H2,1-3H3	YXZDNMPVEHOJQO-UHFFFAOYSA-N	COc1ccccc1C(=O)COC(=O)c2ccc(cc2)N(C)C	BroadT	BRD-K78842668	BRD-K78842668-001-06-7	Enamine Ltd.	T0509-3020			COc1ccccc1C(=O)COC(=O)c1ccc(cc1)N(C)C	InChI=1S/C18H19NO4/c1-19(2)14-10-8-13(9-11-14)18(21)23-12-16(20)15-6-4-5-7-17(15)22-3/h4-11H,12H2,1-3H3	YXZDNMPVEHOJQO-UHFFFAOYSA-N	313.131408098							123254
T0502-3326	LSM-34697	SID24830934, BRD-K93245543	4593003	InChI=1S/C18H23N5O2/c1-3-25-15-6-4-13(5-7-15)16-12-17(21-20-16)18(24)22-19-14-8-10-23(2)11-9-14/h4-7,12H,3,8-11H2,1-2H3,(H,20,21)(H,22,24)	WREKJUWZXXPTJJ-UHFFFAOYSA-N	CCOc1ccc(cc1)c2cc([nH]n2)C(=O)NN=C3CCN(C)CC3	BroadT	BRD-K93245543	BRD-K93245543-001-05-7	Enamine Ltd.	T0502-3326			CCOc1ccc(cc1)-c1cc([nH]n1)C(=O)NN=C1CCN(C)CC1	InChI=1S/C18H23N5O2/c1-3-25-15-6-4-13(5-7-15)16-12-17(21-20-16)18(24)22-19-14-8-10-23(2)11-9-14/h4-7,12H,3,8-11H2,1-2H3,(H,20,21)(H,22,24)	WREKJUWZXXPTJJ-UHFFFAOYSA-N	341.185175026							123255
SMR000016670	LSM-34698	SID4250715, SID7970610, BRD-A94184316	3244483	InChI=1S/C19H22N6O3/c1-13-4-6-14(7-5-13)10-25-18-17(22-23-25)19(27)24(12-21-18)11-16(26)20-9-15-3-2-8-28-15/h4-7,12,15H,2-3,8-11H2,1H3,(H,20,26)	QVHGNTPRWOGBOT-UHFFFAOYSA-N	Cc1ccc(Cn2nnc3C(=O)N(CC(=O)NCC4CCCO4)C=Nc23)cc1	BroadT	BRD-A94184316	BRD-A94184316-001-05-4	Life Chemicals Inc.	F0656-0171			Cc1ccc(Cn2nnc3c2ncn(CC(=O)NCC2CCCO2)c3=O)cc1	InChI=1S/C19H22N6O3/c1-13-4-6-14(7-5-13)10-25-18-17(22-23-25)19(27)24(12-21-18)11-16(26)20-9-15-3-2-8-28-15/h4-7,12,15H,2-3,8-11H2,1H3,(H,20,26)	QVHGNTPRWOGBOT-UHFFFAOYSA-N	382.175338624							123256
T0508-1031	LSM-34699	SID14746719, BRD-K98774963	2347537	InChI=1S/C16H14N2O2S/c1-11-8-15(18-20-11)17-16(19)10-21-14-7-6-12-4-2-3-5-13(12)9-14/h2-9H,10H2,1H3,(H,17,18,19)	BBXRMYRMSRLARV-UHFFFAOYSA-N	Cc1onc(NC(=O)CSc2ccc3ccccc3c2)c1	BroadT	BRD-K98774963	BRD-K98774963-001-05-2	Enamine Ltd.	T0508-1031			Cc1cc(NC(=O)CSc2ccc3ccccc3c2)no1	InChI=1S/C16H14N2O2S/c1-11-8-15(18-20-11)17-16(19)10-21-14-7-6-12-4-2-3-5-13(12)9-14/h2-9H,10H2,1H3,(H,17,18,19)	BBXRMYRMSRLARV-UHFFFAOYSA-N	298.077598398							123257
4-Hydroxy-1-phenylpyrazole	LSM-34700	SID7974342, BRD-K73416114	555359	InChI=1S/C9H8N2O/c12-9-6-10-11(7-9)8-4-2-1-3-5-8/h1-7,12H	PAIIFXHEHLRVNC-UHFFFAOYSA-N	Oc1cnn(c1)c2ccccc2	BroadT	BRD-K73416114	BRD-K73416114-001-06-5	ChemBridge Corporation	5102354			Oc1cnn(c1)-c1ccccc1	InChI=1S/C9H8N2O/c12-9-6-10-11(7-9)8-4-2-1-3-5-8/h1-7,12H	PAIIFXHEHLRVNC-UHFFFAOYSA-N	160.063662896							123258
SMR000143544	LSM-34701	SID14739409, BRD-K06459909	2200813	InChI=1S/C18H13N3O2S2/c22-17(15-9-5-11-24-15)21-18(25-12-13-6-2-1-3-7-13)19-16(20-21)14-8-4-10-23-14/h1-11H,12H2	MXRHYHHUIYFVKZ-UHFFFAOYSA-N	O=C(c1cccs1)n2nc(nc2SCc3ccccc3)c4occc4	BroadT	BRD-K06459909	BRD-K06459909-001-05-8	ChemBridge Corporation	7742090			O=C(c1cccs1)n1nc(nc1SCc1ccccc1)-c1ccco1	InChI=1S/C18H13N3O2S2/c22-17(15-9-5-11-24-15)21-18(25-12-13-6-2-1-3-7-13)19-16(20-21)14-8-4-10-23-14/h1-11H,12H2	MXRHYHHUIYFVKZ-UHFFFAOYSA-N	367.044918066							123259
ST048229	LSM-34702	SID4247313, BRD-K81081205	672009	InChI=1S/C12H13N3OS2/c1-15-10(13)9(18-12(15)17)11(16)14-7-8-5-3-2-4-6-8/h2-6H,7,13H2,1H3,(H,14,16)	IJVWQJNUYZJSPG-UHFFFAOYSA-N	CN1C(=S)SC(=C1N)C(=O)NCc2ccccc2	BroadT	BRD-K81081205	BRD-K81081205-001-05-9	ChemDiv Inc.	8013-0109			Cn1c(N)c(sc1=S)C(=O)NCc1ccccc1	InChI=1S/C12H13N3OS2/c1-15-10(13)9(18-12(15)17)11(16)14-7-8-5-3-2-4-6-8/h2-6H,7,13H2,1H3,(H,14,16)	IJVWQJNUYZJSPG-UHFFFAOYSA-N	279.050003446							123260
ST50992798	LSM-34703	SID17432561, BRD-K16877735	792875	InChI=1S/C20H29NO3/c1-20(2,3)15-9-11-17(12-10-15)24-19(23)14-13-18(22)21-16-7-5-4-6-8-16/h4-8,15,17H,9-14H2,1-3H3,(H,21,22)	DECAYRMSMUUPRB-UHFFFAOYSA-N	CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)Nc2ccccc2	BroadT	BRD-K16877735	BRD-K16877735-001-05-9	ChemBridge Corporation	5106177			CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)Nc1ccccc1	InChI=1S/C20H29NO3/c1-20(2,3)15-9-11-17(12-10-15)24-19(23)14-13-18(22)21-16-7-5-4-6-8-16/h4-8,15,17H,9-14H2,1-3H3,(H,21,22)	DECAYRMSMUUPRB-UHFFFAOYSA-N	331.214743798							123261
MLS000099916	LSM-34704	SID4254877, BRD-K82210234	2028808	InChI=1S/C16H11N7S/c1-2-6-11(7-3-1)15-20-23-14(18-19-16(23)24-15)10-22-13-9-5-4-8-12(13)17-21-22/h1-9H,10H2	IFRYKBXNKQBFIE-UHFFFAOYSA-N	C(c1nnc2sc(nn12)c3ccccc3)n4nnc5ccccc45	BroadT	BRD-K82210234	BRD-K82210234-001-05-8	ChemBridge Corporation	7953497			C(c1nnc2sc(nn12)-c1ccccc1)n1nnc2ccccc12	InChI=1S/C16H11N7S/c1-2-6-11(7-3-1)15-20-23-14(18-19-16(23)24-15)10-22-13-9-5-4-8-12(13)17-21-22/h1-9H,10H2	IFRYKBXNKQBFIE-UHFFFAOYSA-N	333.079664112							123262
SMR000314650	LSM-44514	SID24812785, BRD-A21394172	16193793	InChI=1S/C25H22N2O8S/c1-3-35-20-10-8-18(9-11-20)26-24(29)23(14-16-7-12-22(34-2)21(28)13-16)36(32,33)25(26)17-5-4-6-19(15-17)27(30)31/h4-15,25,28H,3H2,1-2H3/b23-14+	LNKICYFZMXUPEP-OEAKJJBVSA-N	CCOc1ccc(cc1)N2C(c3cccc(c3)[N+](=O)[O-])S(=O)(=O)\C(=C\c4ccc(OC)c(O)c4)\C2=O	BroadT	BRD-A21394172	BRD-A21394172-001-06-8	ChemDiv Inc.	K506-0021			CCOc1ccc(cc1)N1C(c2cccc(c2)[N+]([O-])=O)S(=O)(=O)\C(=C\c2ccc(OC)c(O)c2)C1=O	InChI=1S/C25H22N2O8S/c1-3-35-20-10-8-18(9-11-20)26-24(29)23(14-16-7-12-22(34-2)21(28)13-16)36(32,33)25(26)17-5-4-6-19(15-17)27(30)31/h4-15,25,28H,3H2,1-2H3/b23-14+	LNKICYFZMXUPEP-OEAKJJBVSA-N	510.109686374							
10P-579S	LSM-34706	SID17410666, BRD-K88583892	2765921	InChI=1S/C21H14ClNO2S/c1-12-6-8-18-15(10-12)20(24)16-11-13(7-9-19(16)26-18)23-21(25)14-4-2-3-5-17(14)22/h2-11H,1H3,(H,23,25)	GSMNZUUOWHOTGB-UHFFFAOYSA-N	Cc1ccc2Sc3ccc(NC(=O)c4ccccc4Cl)cc3C(=O)c2c1	BroadT	BRD-K88583892	BRD-K88583892-001-05-5	Key Organics Ltd.	10P-579S			Cc1ccc2sc3ccc(NC(=O)c4ccccc4Cl)cc3c(=O)c2c1	InChI=1S/C21H14ClNO2S/c1-12-6-8-18-15(10-12)20(24)16-11-13(7-9-19(16)26-18)23-21(25)14-4-2-3-5-17(14)22/h2-11H,1H3,(H,23,25)	GSMNZUUOWHOTGB-UHFFFAOYSA-N	379.043377098							123264
ZINC00658896	LSM-34707	SID14728073, BRD-K07825766	1002423	InChI=1S/C21H19N3OS2/c1-14(2)23-20(25)13-27-21-17(12-22)16(15-7-4-3-5-8-15)11-18(24-21)19-9-6-10-26-19/h3-11,14H,13H2,1-2H3,(H,23,25)	QEKMLMMPLXJHEL-UHFFFAOYSA-N	CC(C)NC(=O)CSc1nc(cc(c2ccccc2)c1C#N)c3cccs3	BroadT	BRD-K07825766	BRD-K07825766-001-05-1	Specs	AM-807/12740327			CC(C)NC(=O)CSc1nc(cc(-c2ccccc2)c1C#N)-c1cccs1	InChI=1S/C21H19N3OS2/c1-14(2)23-20(25)13-27-21-17(12-22)16(15-7-4-3-5-8-15)11-18(24-21)19-9-6-10-26-19/h3-11,14H,13H2,1-2H3,(H,23,25)	QEKMLMMPLXJHEL-UHFFFAOYSA-N	393.096953638							123265
MLS001125520	LSM-34708	SID49723362, BRD-K24293663	1302084	InChI=1S/C18H20N2O3S/c1-22-15-10-14(11-16(12-15)23-2)19-18(24)20-17(21)9-8-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3,(H2,19,20,21,24)	PUHTZCALJKETCU-UHFFFAOYSA-N	COc1cc(NC(=S)NC(=O)CCc2ccccc2)cc(OC)c1	BroadT	BRD-K24293663	BRD-K24293663-001-05-5	ChemBridge Corporation	7904674			COc1cc(NC(=S)NC(=O)CCc2ccccc2)cc(OC)c1	InChI=1S/C18H20N2O3S/c1-22-15-10-14(11-16(12-15)23-2)19-18(24)20-17(21)9-8-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3,(H2,19,20,21,24)	PUHTZCALJKETCU-UHFFFAOYSA-N	344.11946321							123266
F1001-0006	LSM-34709	SID3716878, BRD-K02087286	1181729	InChI=1S/C12H10BrN5OS/c1-7-5-9(19)17-12(15-7)20-6-8-10(13)18-4-2-3-14-11(18)16-8/h2-5H,6H2,1H3,(H,15,17,19)	PCAJUEPABCGDBG-UHFFFAOYSA-N	Cc1cc(O)nc(SCc2nc3ncccn3c2Br)n1	BroadT	BRD-K02087286	BRD-K02087286-001-05-4	Enamine Ltd.	T0500-9504			Cc1cc(O)nc(SCc2nc3ncccn3c2Br)n1	InChI=1S/C12H10BrN5OS/c1-7-5-9(19)17-12(15-7)20-6-8-10(13)18-4-2-3-14-11(18)16-8/h2-5H,6H2,1H3,(H,15,17,19)	PCAJUEPABCGDBG-UHFFFAOYSA-N	350.97894328							123267
F0396-0213	LSM-34710	SID24816021, BRD-K54569414	4343914	InChI=1S/C23H20N4O4S/c1-31-17-8-6-16(7-9-17)27-22(18-12-32-13-19(18)25-27)24-23(30)14-2-4-15(5-3-14)26-20(28)10-11-21(26)29/h2-9H,10-13H2,1H3,(H,24,30)	SWYRPMKZMBENEA-UHFFFAOYSA-N	COc1ccc(cc1)n2nc3CSCc3c2NC(=O)c4ccc(cc4)N5C(=O)CCC5=O	BroadT	BRD-K54569414	BRD-K54569414-001-05-3	Life Chemicals Inc.	F0396-0213			COc1ccc(cc1)-n1nc2CSCc2c1NC(=O)c1ccc(cc1)N1C(=O)CCC1=O	InChI=1S/C23H20N4O4S/c1-31-17-8-6-16(7-9-17)27-22(18-12-32-13-19(18)25-27)24-23(30)14-2-4-15(5-3-14)26-20(28)10-11-21(26)29/h2-9H,10-13H2,1H3,(H,24,30)	SWYRPMKZMBENEA-UHFFFAOYSA-N	448.12052585							123268
4-Nitroso-2,5-diphenyl-1H-pyrazol-3-one	LSM-34711	BRD-K88060792	3450311	InChI=1S/C15H11N3O2/c19-15-14(17-20)13(11-7-3-1-4-8-11)16-18(15)12-9-5-2-6-10-12/h1-10,19H	QUFKMILGZLNSNQ-UHFFFAOYSA-N	Oc1c(N=O)c(nn1-c1ccccc1)c1ccccc1	BroadT	BRD-K88060792	BRD-K88060792-001-06-3	Asinex Ltd.	BAS 00245292			Oc1c([N+][O-])c(nn1-c1ccccc1)-c1ccccc1	InChI=1S/C15H11N3O2/c19-15-14(17-20)13(11-7-3-1-4-8-11)16-18(15)12-9-5-2-6-10-12/h1-10,19H	QUFKMILGZLNSNQ-UHFFFAOYSA-N	265.085126622							
MLS000586803	LSM-34712	SID22411742, BRD-K88978226	15945505	InChI=1S/C27H25N3O3/c1-3-15-29-26(32)23-14-13-22(25(31)28-17-20-7-5-4-6-8-20)16-24(23)30(27(29)33)18-21-11-9-19(2)10-12-21/h3-14,16H,1,15,17-18H2,2H3,(H,28,31)	WPNKDUDJIYYWAC-UHFFFAOYSA-N	Cc1ccc(CN2C(=O)N(CC=C)C(=O)c3ccc(cc23)C(=O)NCc4ccccc4)cc1	BroadT	BRD-K88978226	BRD-K88978226-001-04-7	ChemDiv Inc.	C487-0255			Cc1ccc(Cn2c3cc(ccc3c(=O)n(CC=C)c2=O)C(=O)NCc2ccccc2)cc1	InChI=1S/C27H25N3O3/c1-3-15-29-26(32)23-14-13-22(25(31)28-17-20-7-5-4-6-8-20)16-24(23)30(27(29)33)18-21-11-9-19(2)10-12-21/h3-14,16H,1,15,17-18H2,2H3,(H,28,31)	WPNKDUDJIYYWAC-UHFFFAOYSA-N	439.18959169							123270
SMR000035752	LSM-34713	SID860054, BRD-K42408461	661360	InChI=1S/C18H20N6O2/c1-26-14-4-2-13(3-5-14)24-18-15(10-22-24)17(20-11-21-18)23-8-6-12(7-9-23)16(19)25/h2-5,10-12H,6-9H2,1H3,(H2,19,25)	YWFYZVSYSGCWRK-UHFFFAOYSA-N	COc1ccc(cc1)n2ncc3c(ncnc23)N4CCC(CC4)C(=O)N	BroadT	BRD-K42408461	BRD-K42408461-001-05-1	InterBioScreen Ltd.	STOCK3S-43176			COc1ccc(cc1)-n1ncc2c(ncnc12)N1CCC(CC1)C(N)=O	InChI=1S/C18H20N6O2/c1-26-14-4-2-13(3-5-14)24-18-15(10-22-24)17(20-11-21-18)23-8-6-12(7-9-23)16(19)25/h2-5,10-12H,6-9H2,1H3,(H2,19,25)	YWFYZVSYSGCWRK-UHFFFAOYSA-N	352.16477394							123271
N-[3-(Trifluoromethyl)phenyl]quinazolin-4-amine	LSM-15483	BRD-K96925768	651672	InChI=1S/C15H10F3N3/c16-15(17,18)10-4-3-5-11(8-10)21-14-12-6-1-2-7-13(12)19-9-20-14/h1-9H,(H,19,20,21)	VCOMYMMMFREKQC-UHFFFAOYSA-N	FC(F)(F)c1cccc(Nc2ncnc3ccccc23)c1	BroadT	BRD-K96925768	BRD-K96925768-003-06-3	Asinex Ltd.	BAS 01292601		Cl	FC(F)(F)c1cccc(Nc2ncnc3ccccc23)c1.Cl	InChI=1S/C15H10F3N3.ClH/c16-15(17,18)10-4-3-5-11(8-10)21-14-12-6-1-2-7-13(12)19-9-20-14;/h1-9H,(H,19,20,21);1H	HRBLUGZRNSNMAX-UHFFFAOYSA-N	289.08268195							104126, 104126
CID 40785828	LSM-34714	BRD-A46326708	40785828	InChI=1S/C21H17ClN4O2S/c1-12-7-8-14(9-17(12)22)26-20(28)15-5-3-4-6-18(15)25-21(26)29-11-19(27)16(10-23)13(2)24/h3-9,16,24H,11H2,1-2H3	CWTOZORLKRUCJC-UHFFFAOYSA-N	CC(=N)C(C#N)C(=O)CSC1=Nc2ccccc2C(=O)N1c3ccc(C)c(Cl)c3	BroadT	BRD-A46326708	BRD-A46326708-001-05-6	Enamine Ltd.	T5212417			CC(=N)C(C#N)C(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(C)c(Cl)c1	InChI=1S/C21H17ClN4O2S/c1-12-7-8-14(9-17(12)22)26-20(28)15-5-3-4-6-18(15)25-21(26)29-11-19(27)16(10-23)13(2)24/h3-9,16,24H,11H2,1-2H3	CWTOZORLKRUCJC-UHFFFAOYSA-N	424.076074224							123272
N-[4-[methyl(Phenyl)carbamoyl]phenyl]furan-2-carboxamide	LSM-34715	SID49827255, BRD-K31656904	1242166	InChI=1S/C19H16N2O3/c1-21(16-6-3-2-4-7-16)19(23)14-9-11-15(12-10-14)20-18(22)17-8-5-13-24-17/h2-13H,1H3,(H,20,22)	SMGFONHDSCMGHG-UHFFFAOYSA-N	CN(C(=O)c1ccc(NC(=O)c2occc2)cc1)c3ccccc3	BroadT	BRD-K31656904	BRD-K31656904-001-05-3	ChemBridge Corporation	7940340			CN(C(=O)c1ccc(NC(=O)c2ccco2)cc1)c1ccccc1	InChI=1S/C19H16N2O3/c1-21(16-6-3-2-4-7-16)19(23)14-9-11-15(12-10-14)20-18(22)17-8-5-13-24-17/h2-13H,1H3,(H,20,22)	SMGFONHDSCMGHG-UHFFFAOYSA-N	320.116092392							123273
AC1LWTSW	LSM-34716	BRD-K22120450	1738429	InChI=1S/C23H21ClN2O6S/c1-2-30-22-14-17(8-13-21(22)32-33(28,29)20-6-4-3-5-7-20)15-25-26-23(27)16-31-19-11-9-18(24)10-12-19/h3-15H,2,16H2,1H3,(H,26,27)	GDMCLJAXLQBOAD-UHFFFAOYSA-N	CCOc1cc(C=NNC(=O)COc2ccc(Cl)cc2)ccc1OS(=O)(=O)c3ccccc3	BroadT	BRD-K22120450	BRD-K22120450-001-05-9	Specs	AH-487/40687192			CCOc1cc(C=NNC(=O)COc2ccc(Cl)cc2)ccc1OS(=O)(=O)c1ccccc1	InChI=1S/C23H21ClN2O6S/c1-2-30-22-14-17(8-13-21(22)32-33(28,29)20-6-4-3-5-7-20)15-25-26-23(27)16-31-19-11-9-18(24)10-12-19/h3-15H,2,16H2,1H3,(H,26,27)	GDMCLJAXLQBOAD-UHFFFAOYSA-N	488.080884812							123274
AC1LDG8L	LSM-34717	SID845257, BRD-A65548384	647597	InChI=1S/C17H21N5O2S/c1-17(2,3)19-15(23)14(11-6-8-18-9-7-11)22(12-4-5-12)16(24)13-10-25-21-20-13/h6-10,12,14H,4-5H2,1-3H3,(H,19,23)	DZQARRMUCUCLEH-UHFFFAOYSA-N	CC(C)(C)NC(=O)C(N(C1CC1)C(=O)c2csnn2)c3ccncc3	BroadT	BRD-A65548384	BRD-A65548384-001-05-2	Asinex Ltd.	ASN 06292119			CC(C)(C)NC(=O)C(N(C1CC1)C(=O)c1csnn1)c1ccncc1	InChI=1S/C17H21N5O2S/c1-17(2,3)19-15(23)14(11-6-8-18-9-7-11)22(12-4-5-12)16(24)13-10-25-21-20-13/h6-10,12,14H,4-5H2,1-3H3,(H,19,23)	DZQARRMUCUCLEH-UHFFFAOYSA-N	359.141595652							123275
AO-476/43250149	LSM-34718	SID17388564, BRD-K64559563	3803612	InChI=1S/C14H13N5O/c1-9-8-10(2)19-13(15-9)12(14(20)18-19)17-16-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,18,20)	PTFOPVVIQROFDJ-UHFFFAOYSA-N	CC1=NC2=C(N=Nc3ccccc3)C(=O)NN2C(=C1)C	BroadT	BRD-K64559563	BRD-K64559563-001-05-1	Specs	AO-476/43250149			Cc1cc(C)n2[nH]c(=O)c(N=Nc3ccccc3)c2n1	InChI=1S/C14H13N5O/c1-9-8-10(2)19-13(15-9)12(14(20)18-19)17-16-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,18,20)	PTFOPVVIQROFDJ-UHFFFAOYSA-N	267.112010086							123276
AC1OIVAH	LSM-34719	SID22414186, BRD-K30935732	7309427	InChI=1S/C13H11FN6O/c1-7-6-10(21)20-13(16-7)11(12(15)19-20)18-17-9-5-3-2-4-8(9)14/h2-6,21H,1H3,(H2,15,19)	OGYDIZMADSHSOF-UHFFFAOYSA-N	Cc1cc(O)n2nc(N)c(N=Nc3ccccc3F)c2n1	BroadT	BRD-K30935732	BRD-K30935732-001-06-8	Specs	AO-476/43250169			Cc1cc(O)n2nc(N)c(N=Nc3ccccc3F)c2n1	InChI=1S/C13H11FN6O/c1-7-6-10(21)20-13(16-7)11(12(15)19-20)18-17-9-5-3-2-4-8(9)14/h2-6,21H,1H3,(H2,15,19)	OGYDIZMADSHSOF-UHFFFAOYSA-N	286.097837232							
SMR000163868	LSM-44515	SID17386860, BRD-K31520182	6258770	InChI=1S/C18H16BrN3O3S/c19-12-3-4-14-13(8-12)11(9-20-14)7-15-17(24)22(18(25)26-15)10-16(23)21-5-1-2-6-21/h3-4,7-9,20H,1-2,5-6,10H2/b15-7-	GUBVZTSCOCHZJU-CHHVJCJISA-N	Brc1ccc2[nH]cc(\C=C\3/SC(=O)N(CC(=O)N4CCCC4)C3=O)c2c1	BroadT	BRD-K31520182	BRD-K31520182-001-05-4	Specs	AH-487/41977955			Brc1ccc2[nH]cc(\C=C3/SC(=O)N(CC(=O)N4CCCC4)C3=O)c2c1	InChI=1S/C18H16BrN3O3S/c19-12-3-4-14-13(8-12)11(9-20-14)7-15-17(24)22(18(25)26-15)10-16(23)21-5-1-2-6-21/h3-4,7-9,20H,1-2,5-6,10H2/b15-7-	GUBVZTSCOCHZJU-CHHVJCJISA-N	433.009574692							
SMR000078606	LSM-34721	SID4264237, BRD-K54553357	1242501	InChI=1S/C23H23N3O/c24-17-21-23(27-22(25-21)16-19-9-5-2-6-10-19)26-13-11-20(12-14-26)15-18-7-3-1-4-8-18/h1-10,20H,11-16H2	LXEMPRNXHOVTQT-UHFFFAOYSA-N	N#Cc1nc(Cc2ccccc2)oc1N3CCC(Cc4ccccc4)CC3	BroadT	BRD-K54553357	BRD-K54553357-001-05-6	ChemBridge Corporation	7910410			N#Cc1nc(Cc2ccccc2)oc1N1CCC(Cc2ccccc2)CC1	InChI=1S/C23H23N3O/c24-17-21-23(27-22(25-21)16-19-9-5-2-6-10-19)26-13-11-20(12-14-26)15-18-7-3-1-4-8-18/h1-10,20H,11-16H2	LXEMPRNXHOVTQT-UHFFFAOYSA-N	357.184112386							123279
Safrole II	LSM-34722	SID14737105, BRD-K13862456	147354	InChI=1S/C15H19NO3/c17-13(6-9-16-7-2-1-3-8-16)12-4-5-14-15(10-12)19-11-18-14/h4-5,10H,1-3,6-9,11H2	DJXZMJWCDITTEO-UHFFFAOYSA-N	O=C(CCN1CCCCC1)c2ccc3OCOc3c2	BroadT	BRD-K13862456	BRD-K13862456-001-05-1	ChemBridge Corporation	5789934			O=C(CCN1CCCCC1)c1ccc2OCOc2c1	InChI=1S/C15H19NO3/c17-13(6-9-16-7-2-1-3-8-16)12-4-5-14-15(10-12)19-11-18-14/h4-5,10H,1-3,6-9,11H2	DJXZMJWCDITTEO-UHFFFAOYSA-N	261.136493478							123280
N-(3,5-Dimethylphenyl)-2-(2-nitroethyl)benzenecarboxamide	LSM-34723	SID17402556, BRD-K19370816	3848613	InChI=1S/C17H18N2O3/c1-12-9-13(2)11-15(10-12)18-17(20)16-6-4-3-5-14(16)7-8-19(21)22/h3-6,9-11H,7-8H2,1-2H3,(H,18,20)	CDBOVUJVTMSCMF-UHFFFAOYSA-N	Cc1cc(C)cc(NC(=O)c2ccccc2CC[N+](=O)[O-])c1	BroadT	BRD-K19370816	BRD-K19370816-001-05-4	Key Organics Ltd.	6M-047			Cc1cc(C)cc(NC(=O)c2ccccc2CC[N+]([O-])=O)c1	InChI=1S/C17H18N2O3/c1-12-9-13(2)11-15(10-12)18-17(20)16-6-4-3-5-14(16)7-8-19(21)22/h3-6,9-11H,7-8H2,1-2H3,(H,18,20)	CDBOVUJVTMSCMF-UHFFFAOYSA-N	298.131742456							123281
MLS000557844	LSM-34724	BRD-K77797915	3524797	InChI=1S/C27H22N4O5/c1-3-35-27(34)21-15-20-23(28-22-17(2)9-7-13-30(22)26(20)33)31(16-19-12-8-14-36-19)24(21)29-25(32)18-10-5-4-6-11-18/h4-15H,3,16H2,1-2H3	BJNFTLNVRZKOSQ-UHFFFAOYSA-N	CCOC(=O)C1=CC2=C(N=C3N(C=CC=C3C)C2=O)N(Cc4occc4)C1=NC(=O)c5ccccc5	BroadT	BRD-K77797915	BRD-K77797915-001-06-5	InterBioScreen Ltd.	STOCK4S-60739			CCOC(=O)c1cc2c(nc3c(C)cccn3c2=O)n(Cc2ccco2)c1=NC(=O)c1ccccc1	InChI=1S/C27H22N4O5/c1-3-35-27(34)21-15-20-23(28-22-17(2)9-7-13-30(22)26(20)33)31(16-19-12-8-14-36-19)24(21)29-25(32)18-10-5-4-6-11-18/h4-15H,3,16H2,1-2H3	BJNFTLNVRZKOSQ-UHFFFAOYSA-N	482.159019844							123282
MLS000074158	LSM-34725	SID853684, BRD-K01015290	656344	InChI=1S/C21H22N4O2S/c1-16-7-9-17(10-8-16)20-22-23-21(27-20)28-15-19(26)25-13-11-24(12-14-25)18-5-3-2-4-6-18/h2-10H,11-15H2,1H3	AAQJAJYYYBNGNE-UHFFFAOYSA-N	Cc1ccc(cc1)c2oc(SCC(=O)N3CCN(CC3)c4ccccc4)nn2	BroadT	BRD-K01015290	BRD-K01015290-001-05-0	Asinex Ltd.	BAS 06482478			Cc1ccc(cc1)-c1nnc(SCC(=O)N2CCN(CC2)c2ccccc2)o1	InChI=1S/C21H22N4O2S/c1-16-7-9-17(10-8-16)20-22-23-21(27-20)28-15-19(26)25-13-11-24(12-14-25)18-5-3-2-4-6-18/h2-10H,11-15H2,1H3	AAQJAJYYYBNGNE-UHFFFAOYSA-N	394.146346674							123283
MLS001167155	LSM-34726	SID49677792, BRD-K61150831	2929432	InChI=1S/C16H23N3O3S/c20-16(17-9-5-2-6-10-17)18-11-13-19(14-12-18)23(21,22)15-7-3-1-4-8-15/h1,3-4,7-8H,2,5-6,9-14H2	OTMFPIMAVATJCD-UHFFFAOYSA-N	O=C(N1CCCCC1)N2CCN(CC2)S(=O)(=O)c3ccccc3	BroadT	BRD-K61150831	BRD-K61150831-001-06-6	Life Chemicals Inc.	F1243-0125			O=C(N1CCCCC1)N1CCN(CC1)S(=O)(=O)c1ccccc1	InChI=1S/C16H23N3O3S/c20-16(17-9-5-2-6-10-17)18-11-13-19(14-12-18)23(21,22)15-7-3-1-4-8-15/h1,3-4,7-8H,2,5-6,9-14H2	OTMFPIMAVATJCD-UHFFFAOYSA-N	337.146012316							123284
3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine	LSM-34727	SID847834, BRD-K49215186	650248	InChI=1S/C13H16N2/c1-9-4-7-12(14)8-13(9)15-10(2)5-6-11(15)3/h4-8H,14H2,1-3H3	RKORJKONKLIMLO-UHFFFAOYSA-N	Cc1ccc(N)cc1n2c(C)ccc2C	BroadT	BRD-K49215186	BRD-K49215186-001-05-7	Asinex Ltd.	BAS 01305899			Cc1ccc(C)n1-c1cc(N)ccc1C	InChI=1S/C13H16N2/c1-9-4-7-12(14)8-13(9)15-10(2)5-6-11(15)3/h4-8H,14H2,1-3H3	RKORJKONKLIMLO-UHFFFAOYSA-N	200.131348532							123285
6-(3,4,5-Triethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole	LSM-34728	SID864817, BRD-K48356852	666065	InChI=1S/C15H18N4O3S/c1-4-20-11-7-10(8-12(21-5-2)13(11)22-6-3)14-18-19-9-16-17-15(19)23-14/h7-9H,4-6H2,1-3H3	AYDDWMFQUATJEM-UHFFFAOYSA-N	CCOc1cc(cc(OCC)c1OCC)c2nn3cnnc3s2	BroadT	BRD-K48356852	BRD-K48356852-001-05-3	InterBioScreen Ltd.	STOCK5S-29961			CCOc1cc(cc(OCC)c1OCC)-c1nn2cnnc2s1	InChI=1S/C15H18N4O3S/c1-4-20-11-7-10(8-12(21-5-2)13(11)22-6-3)14-18-19-9-16-17-15(19)23-14/h7-9H,4-6H2,1-3H3	AYDDWMFQUATJEM-UHFFFAOYSA-N	334.109961166							123286
MLS000035930	LSM-34729	SID849907, BRD-K92111971	652419	InChI=1S/C23H20N4O5S/c1-27-22(30)15-6-3-4-7-16(15)26-23(27)33-13-20(28)24-14-9-10-17(19(12-14)31-2)25-21(29)18-8-5-11-32-18/h3-12H,13H2,1-2H3,(H,24,28)(H,25,29)	DGHNJYFIBSFUOC-UHFFFAOYSA-N	COc1cc(NC(=O)CSC2=Nc3ccccc3C(=O)N2C)ccc1NC(=O)c4occc4	BroadT	BRD-K92111971	BRD-K92111971-001-05-3	Asinex Ltd.	ASN 04049259			COc1cc(NC(=O)CSc2nc3ccccc3c(=O)n2C)ccc1NC(=O)c1ccco1	InChI=1S/C23H20N4O5S/c1-27-22(30)15-6-3-4-7-16(15)26-23(27)33-13-20(28)24-14-9-10-17(19(12-14)31-2)25-21(29)18-8-5-11-32-18/h3-12H,13H2,1-2H3,(H,24,28)(H,25,29)	DGHNJYFIBSFUOC-UHFFFAOYSA-N	464.11544047							123287
SMR000041977	LSM-44516	SID24840876, SID860059, BRD-K10852405	1835336	InChI=1S/C24H25N5O3S/c1-17-6-8-19(9-7-17)33(31,32)20(16-25)15-21-23(28-13-11-27(3)12-14-28)26-22-18(2)5-4-10-29(22)24(21)30/h4-10,15H,11-14H2,1-3H3/b20-15+	HRZIKHFUKPSGLA-HMMYKYKNSA-N	CN1CCN(CC1)C2=C(\C=C(/C#N)\S(=O)(=O)c3ccc(C)cc3)C(=O)N4C=CC=C(C)C4=N2	BroadT	BRD-K10852405	BRD-K10852405-001-05-7	InterBioScreen Ltd.	STOCK3S-47647			CN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1\C=C(/C#N)S(=O)(=O)c1ccc(C)cc1	InChI=1S/C24H25N5O3S/c1-17-6-8-19(9-7-17)33(31,32)20(16-25)15-21-23(28-13-11-27(3)12-14-28)26-22-18(2)5-4-10-29(22)24(21)30/h4-10,15H,11-14H2,1-3H3/b20-15+	HRZIKHFUKPSGLA-HMMYKYKNSA-N	463.1678104							
AC1M7FE6	LSM-15597	BRD-K28418015	2441063	InChI=1S/C18H19ClFN3O2/c1-12-3-5-13(6-4-12)21-17(24)10-23(2)11-18(25)22-14-7-8-16(20)15(19)9-14/h3-9H,10-11H2,1-2H3,(H,21,24)(H,22,25)	LKENTIOOFDTILV-UHFFFAOYSA-N	CN(CC(=O)Nc1ccc(C)cc1)CC(=O)Nc2ccc(F)c(Cl)c2	BroadT	BRD-K28418015	BRD-K28418015-034-05-0	Enamine Ltd.	T0517-0020		OC(=O)C(=O)O	CN(CC(=O)Nc1ccc(C)cc1)CC(=O)Nc1ccc(F)c(Cl)c1.OC(=O)C(=O)O	InChI=1S/C18H19ClFN3O2.C2H2O4/c1-12-3-5-13(6-4-12)21-17(24)10-23(2)11-18(25)22-14-7-8-16(20)15(19)9-14;3-1(4)2(5)6/h3-9H,10-11H2,1-2H3,(H,21,24)(H,22,25);(H,3,4)(H,5,6)	UBGWPAMBXPKPMV-UHFFFAOYSA-N	363.114982788							104233, 104233
N-(3-Bromo-4,5-diethoxybenzyl)-n-[4-(4-morpholinyl)phenyl]amine	LSM-34731	SID22413645, BRD-K63628728	979600	InChI=1S/C21H27BrN2O3/c1-3-26-20-14-16(13-19(22)21(20)27-4-2)15-23-17-5-7-18(8-6-17)24-9-11-25-12-10-24/h5-8,13-14,23H,3-4,9-12,15H2,1-2H3	RGEGCNAFEBALIM-UHFFFAOYSA-N	CCOc1cc(CNc2ccc(cc2)N3CCOCC3)cc(Br)c1OCC	BroadT	BRD-K63628728	BRD-K63628728-001-05-7	Specs	AP-970/42524576			CCOc1cc(CNc2ccc(cc2)N2CCOCC2)cc(Br)c1OCC	InChI=1S/C21H27BrN2O3/c1-3-26-20-14-16(13-19(22)21(20)27-4-2)15-23-17-5-7-18(8-6-17)24-9-11-25-12-10-24/h5-8,13-14,23H,3-4,9-12,15H2,1-2H3	RGEGCNAFEBALIM-UHFFFAOYSA-N	434.120505344							123289
MLS000077573	LSM-34732	SID859327, BRD-K45471681	660631	InChI=1S/C9H12N2O3S/c1-5-6(3-4-7(12)14-2)8(13)11-9(15)10-5/h3-4H2,1-2H3,(H2,10,11,13,15)	ISRRLTIEWOHRNX-UHFFFAOYSA-N	COC(=O)CCc1c(C)nc(S)nc1O	BroadT	BRD-K45471681	BRD-K45471681-001-04-3	InterBioScreen Ltd.	STOCK3S-06422			COC(=O)CCc1c(C)[nH]c(=S)[nH]c1=O	InChI=1S/C9H12N2O3S/c1-5-6(3-4-7(12)14-2)8(13)11-9(15)10-5/h3-4H2,1-2H3,(H2,10,11,13,15)	ISRRLTIEWOHRNX-UHFFFAOYSA-N	228.056862954							123290
BAS 06969494	LSM-34733	SID847455, BRD-A98673575	649860	InChI=1S/C20H22N2O4/c1-20(2,3)22-18(23)13-8-10-14(11-9-13)21-19(24)17-12-25-15-6-4-5-7-16(15)26-17/h4-11,17H,12H2,1-3H3,(H,21,24)(H,22,23)	PTFVLKUZOCJAQV-UHFFFAOYSA-N	CC(C)(C)NC(=O)c1ccc(NC(=O)C2COc3ccccc3O2)cc1	BroadT	BRD-A98673575	BRD-A98673575-001-05-8	Asinex Ltd.	BAS 06969494			CC(C)(C)NC(=O)c1ccc(NC(=O)C2COc3ccccc3O2)cc1	InChI=1S/C20H22N2O4/c1-20(2,3)22-18(23)13-8-10-14(11-9-13)21-19(24)17-12-25-15-6-4-5-7-16(15)26-17/h4-11,17H,12H2,1-3H3,(H,21,24)(H,22,23)	PTFVLKUZOCJAQV-UHFFFAOYSA-N	354.157957204							123291
MLS000554850	LSM-34734	SID14742132, BRD-A75559911	9551755	InChI=1S/C24H16N2O/c27-24-22-20-15-9-3-1-7-13(15)19(14-8-2-4-10-16(14)20)21(22)23-25-17-11-5-6-12-18(17)26(23)24/h1-12,19-22H/t19?,20?,21-,22?/m0/s1	YKWULJVVXOGHSJ-GMONCZTGSA-N	O=C1C2[C@H](C3c4ccccc4C2c5ccccc35)c6nc7ccccc7n16	BroadT	BRD-A75559911	BRD-A75559911-001-05-9	InterBioScreen Ltd.	STOCK1S-11305			O=C1C2[C@H](C3c4ccccc4C2c2ccccc32)c2nc3ccccc3n12	InChI=1S/C24H16N2O/c27-24-22-20-15-9-3-1-7-13(15)19(14-8-2-4-10-16(14)20)21(22)23-25-17-11-5-6-12-18(17)26(23)24/h1-12,19-22H/t19?,20?,21-,22?/m0/s1	YKWULJVVXOGHSJ-GMONCZTGSA-N	348.126263152							123292
MLS000041790	LSM-44517	SID861738, BRD-K36376089	5389619	InChI=1S/C15H16N4O3/c1-3-7-19-14(21)12(13(20)18-15(19)22)10(2)17-9-11-5-4-6-16-8-11/h3-6,8,17H,1,7,9H2,2H3,(H,18,20,22)/b12-10+	FAOGPNQOIVOTRS-ZRDIBKRKSA-N	C\C(=C/1\C(=O)NC(=O)N(CC=C)C1=O)\NCc2cccnc2	BroadT	BRD-K36376089	BRD-K36376089-001-05-0	InterBioScreen Ltd.	STOCK4S-19206			C\C(NCc1cccnc1)=C1\C(=O)NC(=O)N(CC=C)C1=O	InChI=1S/C15H16N4O3/c1-3-7-19-14(21)12(13(20)18-15(19)22)10(2)17-9-11-5-4-6-16-8-11/h3-6,8,17H,1,7,9H2,2H3,(H,18,20,22)/b12-10+	FAOGPNQOIVOTRS-ZRDIBKRKSA-N	300.122240412							
SMR000201268	LSM-34736	SID17413566, BRD-K73551814	2974685	InChI=1S/C21H25N3O5S/c1-29-18-7-9-20(21(15-18)24(25)26)22-10-12-23(13-11-22)30(27,28)19-8-6-16-4-2-3-5-17(16)14-19/h6-9,14-15H,2-5,10-13H2,1H3	FNKWINMDYOJBHR-UHFFFAOYSA-N	COc1ccc(N2CCN(CC2)S(=O)(=O)c3ccc4CCCCc4c3)c(c1)[N+](=O)[O-]	BroadT	BRD-K73551814	BRD-K73551814-001-05-4	ChemBridge Corporation	7960405			COc1ccc(N2CCN(CC2)S(=O)(=O)c2ccc3CCCCc3c2)c(c1)[N+]([O-])=O	InChI=1S/C21H25N3O5S/c1-29-18-7-9-20(21(15-18)24(25)26)22-10-12-23(13-11-22)30(27,28)19-8-6-16-4-2-3-5-17(16)14-19/h6-9,14-15H,2-5,10-13H2,1H3	FNKWINMDYOJBHR-UHFFFAOYSA-N	431.15149162							123294
STK185199	LSM-34737	SID17415952, BRD-K04357662	2273874	InChI=1S/C17H10ClN3O2S/c18-11-4-1-3-10(9-11)14-7-8-15(23-14)17(22)19-12-5-2-6-13-16(12)21-24-20-13/h1-9H,(H,19,22)	IPTGRSACOGFTEC-UHFFFAOYSA-N	Clc1cccc(c1)c2oc(cc2)C(=O)Nc3cccc4nsnc34	BroadT	BRD-K04357662	BRD-K04357662-001-04-6	ChemBridge Corporation	6230128			Clc1cccc(c1)-c1ccc(o1)C(=O)Nc1cccc2nsnc12	InChI=1S/C17H10ClN3O2S/c18-11-4-1-3-10(9-11)14-7-8-15(23-14)17(22)19-12-5-2-6-13-16(12)21-24-20-13/h1-9H,(H,19,22)	IPTGRSACOGFTEC-UHFFFAOYSA-N	355.01822499							123295
T5234567	LSM-34738	SID22410223, BRD-K13429670	4618135	InChI=1S/C27H29N3O6S/c1-19-13-20(2)15-23(14-19)27(33)28-17-26(32)36-18-25(31)29-9-11-30(12-10-29)37(34,35)24-8-7-21-5-3-4-6-22(21)16-24/h3-8,13-16H,9-12,17-18H2,1-2H3,(H,28,33)	NWXUUVZWNJIURR-UHFFFAOYSA-N	Cc1cc(C)cc(c1)C(=O)NCC(=O)OCC(=O)N2CCN(CC2)S(=O)(=O)c3ccc4ccccc4c3	BroadT	BRD-K13429670	BRD-K13429670-001-05-9	Enamine Ltd.	T5234567			Cc1cc(C)cc(c1)C(=O)NCC(=O)OCC(=O)N1CCN(CC1)S(=O)(=O)c1ccc2ccccc2c1	InChI=1S/C27H29N3O6S/c1-19-13-20(2)15-23(14-19)27(33)28-17-26(32)36-18-25(31)29-9-11-30(12-10-29)37(34,35)24-8-7-21-5-3-4-6-22(21)16-24/h3-8,13-16H,9-12,17-18H2,1-2H3,(H,28,33)	NWXUUVZWNJIURR-UHFFFAOYSA-N	523.177706368							123296
ASN 06196353	LSM-34739	SID24784647, BRD-A54668105	3217272	InChI=1S/C28H30FN3O/c29-22-15-13-20(14-16-22)19-32-24-9-6-10-25(32)18-23(17-24)30-28(33)31-27-12-5-4-11-26(27)21-7-2-1-3-8-21/h1-5,7-8,11-16,23-25H,6,9-10,17-19H2,(H2,30,31,33)	JVXQTICAQRFDBP-UHFFFAOYSA-N	Fc1ccc(CN2C3CCCC2CC(C3)NC(=O)Nc4ccccc4c5ccccc5)cc1	BroadT	BRD-A54668105	BRD-A54668105-001-05-9	Asinex Ltd.	ASN 06196353			Fc1ccc(CN2C3CCCC2CC(C3)NC(=O)Nc2ccccc2-c2ccccc2)cc1	InChI=1S/C28H30FN3O/c29-22-15-13-20(14-16-22)19-32-24-9-6-10-25(32)18-23(17-24)30-28(33)31-27-12-5-4-11-26(27)21-7-2-1-3-8-21/h1-5,7-8,11-16,23-25H,6,9-10,17-19H2,(H2,30,31,33)	JVXQTICAQRFDBP-UHFFFAOYSA-N	443.23729081							123297
ST50853050	LSM-34740	SID49826819, BRD-K71983755	3853846	InChI=1S/C18H18ClN5O5S/c1-29-15-10-11(24(27)28)6-7-14(15)21-18(30)23-22-17(26)9-8-16(25)20-13-5-3-2-4-12(13)19/h2-7,10H,8-9H2,1H3,(H,20,25)(H,22,26)(H2,21,23,30)	IFCVNIZISSOMNT-UHFFFAOYSA-N	COc1cc(ccc1N=C(S)NNC(=O)CCC(=O)Nc2ccccc2Cl)[N+](=O)[O-]	BroadT	BRD-K71983755	BRD-K71983755-001-05-2	ChemBridge Corporation	7844213			COc1cc(ccc1N=C(S)NNC(=O)CCC(=O)Nc1ccccc1Cl)[N+]([O-])=O	InChI=1S/C18H18ClN5O5S/c1-29-15-10-11(24(27)28)6-7-14(15)21-18(30)23-22-17(26)9-8-16(25)20-13-5-3-2-4-12(13)19/h2-7,10H,8-9H2,1H3,(H,20,25)(H,22,26)(H2,21,23,30)	IFCVNIZISSOMNT-UHFFFAOYSA-N	451.071717126							123298
2-[5-(4-Morpholin-4-yl-phenyl)-tetrazol-2-yl]-n-o-tolyl-acetamide	LSM-34741	SID850408, BRD-K48497606	652930	InChI=1S/C20H22N6O2/c1-15-4-2-3-5-18(15)21-19(27)14-26-23-20(22-24-26)16-6-8-17(9-7-16)25-10-12-28-13-11-25/h2-9H,10-14H2,1H3,(H,21,27)	PZHLOUOCQPUNQV-UHFFFAOYSA-N	Cc1ccccc1NC(=O)Cn2nnc(n2)c3ccc(cc3)N4CCOCC4	BroadT	BRD-K48497606	BRD-K48497606-001-05-4	Asinex Ltd.	ASN 03364838			Cc1ccccc1NC(=O)Cn1nnc(n1)-c1ccc(cc1)N1CCOCC1	InChI=1S/C20H22N6O2/c1-15-4-2-3-5-18(15)21-19(27)14-26-23-20(22-24-26)16-6-8-17(9-7-16)25-10-12-28-13-11-25/h2-9H,10-14H2,1H3,(H,21,27)	PZHLOUOCQPUNQV-UHFFFAOYSA-N	378.180424004							123299
4-Benzyl-5-[2-(4-propoxy-phenyl)-ethyl]-4H-[1,2,4]triazole-3-thiol	LSM-34742	SID17411575, BRD-K98303556	1903751	InChI=1S/C20H23N3OS/c1-2-14-24-18-11-8-16(9-12-18)10-13-19-21-22-20(25)23(19)15-17-6-4-3-5-7-17/h3-9,11-12H,2,10,13-15H2,1H3,(H,22,25)	HLLISCVDCWRUHT-UHFFFAOYSA-N	CCCOc1ccc(CCc2nnc(S)n2Cc3ccccc3)cc1	BroadT	BRD-K98303556	BRD-K98303556-001-05-3	Asinex Ltd.	BAS 01506446			CCCOc1ccc(CCc2nnc(S)n2Cc2ccccc2)cc1	InChI=1S/C20H23N3OS/c1-2-14-24-18-11-8-16(9-12-18)10-13-19-21-22-20(25)23(19)15-17-6-4-3-5-7-17/h3-9,11-12H,2,10,13-15H2,1H3,(H,22,25)	HLLISCVDCWRUHT-UHFFFAOYSA-N	353.156183076							123300
3-[4-(4-Chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)pyrrolidine-2,5-dione	LSM-34743	SID49644104, BRD-A10630028	2833604	InChI=1S/C21H22ClN3O3/c1-28-18-8-6-17(7-9-18)25-20(26)14-19(21(25)27)24-12-10-23(11-13-24)16-4-2-15(22)3-5-16/h2-9,19H,10-14H2,1H3	VRAPZTFJWHSKHS-UHFFFAOYSA-N	COc1ccc(cc1)N2C(=O)CC(N3CCN(CC3)c4ccc(Cl)cc4)C2=O	BroadT	BRD-A10630028	BRD-A10630028-001-05-6	Asinex Ltd.	BAS 00345445			COc1ccc(cc1)N1C(=O)CC(N2CCN(CC2)c2ccc(Cl)cc2)C1=O	InChI=1S/C21H22ClN3O3/c1-28-18-8-6-17(7-9-18)25-20(26)14-19(21(25)27)24-12-10-23(11-13-24)16-4-2-15(22)3-5-16/h2-9,19H,10-14H2,1H3	VRAPZTFJWHSKHS-UHFFFAOYSA-N	399.134969304							123301
Cefazolin	LSM-34744	Cefazolin, Cephazolin, SK&F-41558	33255	InChI=1S/C14H14N8O4S3/c1-6-17-18-14(29-6)28-4-7-3-27-12-9(11(24)22(12)10(7)13(25)26)16-8(23)2-21-5-15-19-20-21/h5,9,12H,2-4H2,1H3,(H,16,23)(H,25,26)/t9-,12-/m1/s1	MLYYVTUWGNIJIB-BXKDBHETSA-N	Cc1nnc(SCC2=C(N3[C@H](SC2)[C@H](NC(=O)Cn4cnnn4)C3=O)C(=O)O)s1	BroadT	BRD-K99750640	BRD-K99750640-001-04-5	InterBioScreen Ltd.	STOCK1N-00790			Cc1nnc(SCC2=C(N3[C@H](SC2)[C@H](NC(=O)Cn2cnnn2)C3=O)C(O)=O)s1	InChI=1S/C14H14N8O4S3/c1-6-17-18-14(29-6)28-4-7-3-27-12-9(11(24)22(12)10(7)13(25)26)16-8(23)2-21-5-15-19-20-21/h5,9,12H,2-4H2,1H3,(H,16,23)(H,25,26)/t9-,12-/m1/s1	MLYYVTUWGNIJIB-BXKDBHETSA-N	454.030013078							474053, 474053
SMR000075928	LSM-34745	SID4264455, BRD-K28790092	977491	InChI=1S/C14H18N2O3/c1-19-12-7-5-11(6-8-12)13(17)15-14(18)16-9-3-2-4-10-16/h5-8H,2-4,9-10H2,1H3,(H,15,17,18)	TXHWTHMJPDRWQP-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)NC(=O)N2CCCCC2	BroadT	BRD-K28790092	BRD-K28790092-001-05-7	ChemBridge Corporation	7752411			COc1ccc(cc1)C(=O)NC(=O)N1CCCCC1	InChI=1S/C14H18N2O3/c1-19-12-7-5-11(6-8-12)13(17)15-14(18)16-9-3-2-4-10-16/h5-8H,2-4,9-10H2,1H3,(H,15,17,18)	TXHWTHMJPDRWQP-UHFFFAOYSA-N	262.131742456							123302
4-((4-Ethylpiperazin-1-yl)methyl)-5,7-dimethyl-2H-chromen-2-one	LSM-34746	SID865979, BRD-K01662866	667242	InChI=1S/C18H24N2O2/c1-4-19-5-7-20(8-6-19)12-15-11-17(21)22-16-10-13(2)9-14(3)18(15)16/h9-11H,4-8,12H2,1-3H3	WLHYEUXZPBRNTQ-UHFFFAOYSA-N	CCN1CCN(CC2=CC(=O)Oc3cc(C)cc(C)c23)CC1	BroadT	BRD-K01662866	BRD-K01662866-001-05-3	InterBioScreen Ltd.	STOCK5S-56074			CCN1CCN(Cc2cc(=O)oc3cc(C)cc(C)c23)CC1	InChI=1S/C18H24N2O2/c1-4-19-5-7-20(8-6-19)12-15-11-17(21)22-16-10-13(2)9-14(3)18(15)16/h9-11H,4-8,12H2,1-3H3	WLHYEUXZPBRNTQ-UHFFFAOYSA-N	300.183778028							123303
ZINC12410484	LSM-34747	BRD-K77196406	51506467	InChI=1S/C11H9NO3/c1-7(13)6-9-11(14)15-10-5-3-2-4-8(10)12-9/h2-5H,6H2,1H3	VPUOSGTXVYASNZ-UHFFFAOYSA-N	CC(=O)CC1=Nc2ccccc2OC1=O	BroadT	BRD-K77196406	BRD-K77196406-001-05-8	Asinex Ltd.	BAS 00702132			CC(=O)Cc1nc2ccccc2oc1=O	InChI=1S/C11H9NO3/c1-7(13)6-9-11(14)15-10-5-3-2-4-8(10)12-9/h2-5H,6H2,1H3	VPUOSGTXVYASNZ-UHFFFAOYSA-N	203.058243158							123304
T0511-4137	LSM-44518	SID22407551, BRD-K18750949	2361091	InChI=1S/C15H15N3O2/c1-2-3-8-18-12-7-5-4-6-10(12)13(15(18)20)11(9-16)14(17)19/h4-7H,2-3,8H2,1H3,(H2,17,19)/b13-11-	WDZJTYHGYYRFOK-QBFSEMIESA-N	CCCCN1C(=O)\C(=C(\C#N)/C(=O)N)\c2ccccc12	BroadT	BRD-K18750949	BRD-K18750949-001-05-8	Enamine Ltd.	T0511-4137			CCCCN1C(=O)\C(=C(\C#N)C(N)=O)c2ccccc12	InChI=1S/C15H15N3O2/c1-2-3-8-18-12-7-5-4-6-10(12)13(15(18)20)11(9-16)14(17)19/h4-7H,2-3,8H2,1H3,(H2,17,19)/b13-11-	WDZJTYHGYYRFOK-QBFSEMIESA-N	269.11642675							
T0504-9301	LSM-34749	SID14743903, BRD-K26636876	2328852	InChI=1S/C16H18N2/c1-3-4-11-18(2)16-13-9-5-7-12-8-6-10-14(17-16)15(12)13/h5-10H,3-4,11H2,1-2H3	FVFQAOLAVZQGJR-UHFFFAOYSA-N	CCCCN(C)C1=Nc2cccc3cccc1c23	BroadT	BRD-K26636876	BRD-K26636876-001-05-6	Enamine Ltd.	T0504-9301			CCCCN(C)C1=Nc2cccc3cccc1c23	InChI=1S/C16H18N2/c1-3-4-11-18(2)16-13-9-5-7-12-8-6-10-14(17-16)15(12)13/h5-10H,3-4,11H2,1-2H3	FVFQAOLAVZQGJR-UHFFFAOYSA-N	238.146998596							123306
Ethyl 5-cyano-6-phenoxy-2-phenylnicotinate	LSM-34750	SID17402330, BRD-K59044902	2769125	InChI=1S/C21H16N2O3/c1-2-25-21(24)18-13-16(14-22)20(26-17-11-7-4-8-12-17)23-19(18)15-9-5-3-6-10-15/h3-13H,2H2,1H3	VTKBDLHBAOQTAO-UHFFFAOYSA-N	CCOC(=O)c1cc(C#N)c(Oc2ccccc2)nc1c3ccccc3	BroadT	BRD-K59044902	BRD-K59044902-001-05-1	Key Organics Ltd.	12K-362S			CCOC(=O)c1cc(C#N)c(Oc2ccccc2)nc1-c1ccccc1	InChI=1S/C21H16N2O3/c1-2-25-21(24)18-13-16(14-22)20(26-17-11-7-4-8-12-17)23-19(18)15-9-5-3-6-10-15/h3-13H,2H2,1H3	VTKBDLHBAOQTAO-UHFFFAOYSA-N	344.116092392							123307
ST50134193	LSM-34751	SID14746618, BRD-K17708248	1276757	InChI=1S/C18H22N2O5S/c1-3-24-18(22)16-13(14-5-4-12(2)25-14)11-26-17(16)19-15(21)10-20-6-8-23-9-7-20/h4-5,11H,3,6-10H2,1-2H3,(H,19,21)	GIKHIJAMYRIXKY-UHFFFAOYSA-N	CCOC(=O)c1c(NC(=O)CN2CCOCC2)scc1c3oc(C)cc3	BroadT	BRD-K17708248	BRD-K17708248-001-05-5	Enamine Ltd.	T0511-6007			CCOC(=O)c1c(NC(=O)CN2CCOCC2)scc1-c1ccc(C)o1	InChI=1S/C18H22N2O5S/c1-3-24-18(22)16-13(14-5-4-12(2)25-14)11-26-17(16)19-15(21)10-20-6-8-23-9-7-20/h4-5,11H,3,6-10H2,1-2H3,(H,19,21)	GIKHIJAMYRIXKY-UHFFFAOYSA-N	378.124942514							123308
Methyl 3-[5-(anilinocarbonyl)-2-furyl]-2-thiophenecarboxylate	LSM-34752	SID17410007, BRD-K00244800	2764721	InChI=1S/C17H13NO4S/c1-21-17(20)15-12(9-10-23-15)13-7-8-14(22-13)16(19)18-11-5-3-2-4-6-11/h2-10H,1H3,(H,18,19)	RLESMLWWGMYSAV-UHFFFAOYSA-N	COC(=O)c1sccc1c2oc(cc2)C(=O)Nc3ccccc3	BroadT	BRD-K00244800	BRD-K00244800-001-05-0	Key Organics Ltd.	10D-014			COC(=O)c1sccc1-c1ccc(o1)C(=O)Nc1ccccc1	InChI=1S/C17H13NO4S/c1-21-17(20)15-12(9-10-23-15)13-7-8-14(22-13)16(19)18-11-5-3-2-4-6-11/h2-10H,1H3,(H,18,19)	RLESMLWWGMYSAV-UHFFFAOYSA-N	327.056528596							123309
3-Isobutyl-1H-pyrazole-5-carboxylic acid	LSM-34753	SID851584, BRD-K06639672	654171	InChI=1S/C8H12N2O2/c1-5(2)3-6-4-7(8(11)12)10-9-6/h4-5H,3H2,1-2H3,(H,9,10)(H,11,12)	OCAWPZXEVMMJMI-UHFFFAOYSA-N	CC(C)Cc1cc([nH]n1)C(=O)O	BroadT	BRD-K06639672	BRD-K06639672-001-05-0	Asinex Ltd.	BAS 01543592			CC(C)Cc1cc([nH]n1)C(O)=O	InChI=1S/C8H12N2O2/c1-5(2)3-6-4-7(8(11)12)10-9-6/h4-5H,3H2,1-2H3,(H,9,10)(H,11,12)	OCAWPZXEVMMJMI-UHFFFAOYSA-N	168.089877644							123310
STK337024	LSM-34754	SID17432102, BRD-K02496105	2958808	InChI=1S/C15H13BrClN3O2S/c1-9-10(16)6-7-13(18-9)19-15(23)20-14(21)8-22-12-5-3-2-4-11(12)17/h2-7H,8H2,1H3,(H2,18,19,20,21,23)	ZBORWMGMPYPADV-UHFFFAOYSA-N	Cc1nc(NC(=S)NC(=O)COc2ccccc2Cl)ccc1Br	BroadT	BRD-K02496105	BRD-K02496105-001-05-6	ChemBridge Corporation	7849171			Cc1nc(NC(=S)NC(=O)COc2ccccc2Cl)ccc1Br	InChI=1S/C15H13BrClN3O2S/c1-9-10(16)6-7-13(18-9)19-15(23)20-14(21)8-22-12-5-3-2-4-11(12)17/h2-7H,8H2,1H3,(H2,18,19,20,21,23)	ZBORWMGMPYPADV-UHFFFAOYSA-N	412.960037686							123311
SMR000107606	LSM-34755	SID7974120, BRD-K58160405	1181447	InChI=1S/C20H21ClN4O/c21-16-7-5-15(6-8-16)19-23-18-4-2-1-3-17(18)20(24-19)22-9-10-25-11-13-26-14-12-25/h1-8H,9-14H2,(H,22,23,24)	ZKLIZFZMABEAFN-UHFFFAOYSA-N	Clc1ccc(cc1)c2nc(NCCN3CCOCC3)c4ccccc4n2	BroadT	BRD-K58160405	BRD-K58160405-001-06-6	ChemBridge Corporation	6371542			Clc1ccc(cc1)-c1nc(NCCN2CCOCC2)c2ccccc2n1	InChI=1S/C20H21ClN4O/c21-16-7-5-15(6-8-16)19-23-18-4-2-1-3-17(18)20(24-19)22-9-10-25-11-13-26-14-12-25/h1-8H,9-14H2,(H,22,23,24)	ZKLIZFZMABEAFN-UHFFFAOYSA-N	368.140389042							123312
N-(7-Propanoyl-2,3-dihydro-1,4-benzodioxin-6-yl)benzamide	LSM-34756	SID14746316, BRD-K06740846	769170	InChI=1S/C18H17NO4/c1-2-15(20)13-10-16-17(23-9-8-22-16)11-14(13)19-18(21)12-6-4-3-5-7-12/h3-7,10-11H,2,8-9H2,1H3,(H,19,21)	QKBNPRMECRQFOQ-UHFFFAOYSA-N	CCC(=O)c1cc2OCCOc2cc1NC(=O)c3ccccc3	BroadT	BRD-K06740846	BRD-K06740846-001-05-7	ChemBridge Corporation	5216242			CCC(=O)c1cc2OCCOc2cc1NC(=O)c1ccccc1	InChI=1S/C18H17NO4/c1-2-15(20)13-10-16-17(23-9-8-22-16)11-14(13)19-18(21)12-6-4-3-5-7-12/h3-7,10-11H,2,8-9H2,1H3,(H,19,21)	QKBNPRMECRQFOQ-UHFFFAOYSA-N	311.115758034							123313
SMR000020593	LSM-34757	SID4243435, BRD-K38698188	1263575	InChI=1S/C15H16N6O4/c1-3-23-10-7-5-9(6-8-10)12-11(15(22)24-4-2)17-20-21(12)14-13(16)18-25-19-14/h5-8H,3-4H2,1-2H3,(H2,16,18)	MWGHVHQXSRFZSB-UHFFFAOYSA-N	CCOC(=O)c1nnn(c1c2ccc(OCC)cc2)c3nonc3N	BroadT	BRD-K38698188	BRD-K38698188-001-06-3	ChemDiv Inc.	6703-1672			CCOC(=O)c1nnn(-c2nonc2N)c1-c1ccc(OCC)cc1	InChI=1S/C15H16N6O4/c1-3-23-10-7-5-9(6-8-10)12-11(15(22)24-4-2)17-20-21(12)14-13(16)18-25-19-14/h5-8H,3-4H2,1-2H3,(H2,16,18)	MWGHVHQXSRFZSB-UHFFFAOYSA-N	344.123303052							123314
AC1NXCDH	LSM-44519	SID24806281, BRD-K46264154	5750985	InChI=1S/C25H26N4O5/c1-28(2)15-7-14-26-25(31)22(27-24(30)18-8-4-3-5-9-18)17-21-12-13-23(34-21)19-10-6-11-20(16-19)29(32)33/h3-6,8-13,16-17H,7,14-15H2,1-2H3,(H,26,31)(H,27,30)/b22-17+	TWRPZXXICFBNEP-OQKWZONESA-N	CN(C)CCCNC(=O)\C(=C/c1oc(cc1)c2cccc(c2)[N+](=O)[O-])\NC(=O)c3ccccc3	BroadT	BRD-K46264154	BRD-K46264154-001-05-6	Asinex Ltd.	BAS 00246293			CN(C)CCCNC(=O)C(\NC(=O)c1ccccc1)=C/c1ccc(o1)-c1cccc(c1)[N+]([O-])=O	InChI=1S/C25H26N4O5/c1-28(2)15-7-14-26-25(31)22(27-24(30)18-8-4-3-5-9-18)17-21-12-13-23(34-21)19-10-6-11-20(16-19)29(32)33/h3-6,8-13,16-17H,7,14-15H2,1-2H3,(H,26,31)(H,27,30)/b22-17+	TWRPZXXICFBNEP-OQKWZONESA-N	462.190319972							
STK191694	LSM-34759	SID24780749, BRD-K49546117	754733	InChI=1S/C18H19N3O2/c1-4-23-17(22)10-15-12(2)20-18-16(11-19-21(18)13(15)3)14-8-6-5-7-9-14/h5-9,11H,4,10H2,1-3H3	IEERSKHYYZMTDX-UHFFFAOYSA-N	CCOC(=O)Cc1c(C)nc2c(cnn2c1C)c3ccccc3	BroadT	BRD-K49546117	BRD-K49546117-001-05-9	Asinex Ltd.	BAS 05427424			CCOC(=O)Cc1c(C)nc2c(cnn2c1C)-c1ccccc1	InChI=1S/C18H19N3O2/c1-4-23-17(22)10-15-12(2)20-18-16(11-19-21(18)13(15)3)14-8-6-5-7-9-14/h5-9,11H,4,10H2,1-3H3	IEERSKHYYZMTDX-UHFFFAOYSA-N	309.147726878							123316
MLS000555284	LSM-34760	SID17407615, BRD-K87436594	1430845	InChI=1S/C23H27N7/c1-16-12-20-21(13-17(16)2)25-23(24-20)19-8-10-29(11-9-19)15-22-26-27-28-30(22)14-18-6-4-3-5-7-18/h3-7,12-13,19H,8-11,14-15H2,1-2H3,(H,24,25)	BKIOGOWYGSGBSJ-UHFFFAOYSA-N	Cc1cc2nc([nH]c2cc1C)C3CCN(Cc4nnnn4Cc5ccccc5)CC3	BroadT	BRD-K87436594	BRD-K87436594-001-05-8	Asinex Ltd.	ASN 06580711			Cc1cc2nc([nH]c2cc1C)C1CCN(Cc2nnnn2Cc2ccccc2)CC1	InChI=1S/C23H27N7/c1-16-12-20-21(13-17(16)2)25-23(24-20)19-8-10-29(11-9-19)15-22-26-27-28-30(22)14-18-6-4-3-5-7-18/h3-7,12-13,19H,8-11,14-15H2,1-2H3,(H,24,25)	BKIOGOWYGSGBSJ-UHFFFAOYSA-N	401.232793934							123317
SMR000162564	LSM-34761	SID17385738, BRD-A33105987	4204964	InChI=1S/C28H33N3O4/c1-19(2)20-11-13-21(14-12-20)30-15-17-31(18-16-30)27(33)24-9-5-6-10-25(24)29-26(32)22-7-3-4-8-23(22)28(34)35/h3-6,9-14,19,22-23H,7-8,15-18H2,1-2H3,(H,29,32)(H,34,35)	DWTOCLBWWMVAPJ-UHFFFAOYSA-N	CC(C)c1ccc(cc1)N2CCN(CC2)C(=O)c3ccccc3NC(=O)C4CC=CCC4C(=O)O	BroadT	BRD-A33105987	BRD-A33105987-001-05-1	Specs	AQ-360/42570790			CC(C)c1ccc(cc1)N1CCN(CC1)C(=O)c1ccccc1NC(=O)C1CC=CCC1C(O)=O	InChI=1S/C28H33N3O4/c1-19(2)20-11-13-21(14-12-20)30-15-17-31(18-16-30)27(33)24-9-5-6-10-25(24)29-26(32)22-7-3-4-8-23(22)28(34)35/h3-6,9-14,19,22-23H,7-8,15-18H2,1-2H3,(H,29,32)(H,34,35)	DWTOCLBWWMVAPJ-UHFFFAOYSA-N	475.247106566							123318
SMR000073877	LSM-34762	SID4256199, BRD-K79167571	1319471	InChI=1S/C22H18N4O2S2/c1-2-25-21(17-10-7-13-28-17)23-24-22(25)29-14-20(27)26-15-8-3-5-11-18(15)30-19-12-6-4-9-16(19)26/h3-13H,2,14H2,1H3	ASZRHXKUEMHBKN-UHFFFAOYSA-N	CCn1c(SCC(=O)N2c3ccccc3Sc4ccccc24)nnc1c5occc5	BroadT	BRD-K79167571	BRD-K79167571-001-06-4	ChemBridge Corporation	7621047			CCn1c(SCC(=O)N2c3ccccc3Sc3ccccc23)nnc1-c1ccco1	InChI=1S/C22H18N4O2S2/c1-2-25-21(17-10-7-13-28-17)23-24-22(25)29-14-20(27)26-15-8-3-5-11-18(15)30-19-12-6-4-9-16(19)26/h3-13H,2,14H2,1H3	ASZRHXKUEMHBKN-UHFFFAOYSA-N	434.087117236							123319
N-(3-Fluorophenyl)benzamide	LSM-34763	SID14723950, BRD-K96528978	242888	InChI=1S/C13H10FNO/c14-11-7-4-8-12(9-11)15-13(16)10-5-2-1-3-6-10/h1-9H,(H,15,16)	KOUNOYCEOGJXJH-UHFFFAOYSA-N	Fc1cccc(NC(=O)c2ccccc2)c1	BroadT	BRD-K96528978	BRD-K96528978-001-05-7	Asinex Ltd.	BAS 00337065			Fc1cccc(NC(=O)c2ccccc2)c1	InChI=1S/C13H10FNO/c14-11-7-4-8-12(9-11)15-13(16)10-5-2-1-3-6-10/h1-9H,(H,15,16)	KOUNOYCEOGJXJH-UHFFFAOYSA-N	215.07464215							123320
SMR000074054	LSM-34764	SID4255071, BRD-K76639431	1305519	InChI=1S/C19H26N4O3S/c1-19(2)9-13-14(10-20)18(27-12-16(24)25-4)21-17(15(13)11-22(19)3)23-5-7-26-8-6-23/h5-9,11-12H2,1-4H3	NLMOFRMJBLFWOB-UHFFFAOYSA-N	COC(=O)CSc1nc(N2CCOCC2)c3CN(C)C(C)(C)Cc3c1C#N	BroadT	BRD-K76639431	BRD-K76639431-001-06-5	ChemBridge Corporation	7643079			COC(=O)CSc1nc(N2CCOCC2)c2CN(C)C(C)(C)Cc2c1C#N	InChI=1S/C19H26N4O3S/c1-19(2)9-13-14(10-20)18(27-12-16(24)25-4)21-17(15(13)11-22(19)3)23-5-7-26-8-6-23/h5-9,11-12H2,1-4H3	NLMOFRMJBLFWOB-UHFFFAOYSA-N	390.172561422							123321
1-Ethyl-6-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid	LSM-34765	SID857874, BRD-K06351586	659219	InChI=1S/C13H13NO4/c1-3-14-7-10(13(16)17)12(15)9-6-8(18-2)4-5-11(9)14/h4-7H,3H2,1-2H3,(H,16,17)	YTWMJESCVWECIP-UHFFFAOYSA-N	CCN1C=C(C(=O)O)C(=O)c2cc(OC)ccc12	BroadT	BRD-K06351586	BRD-K06351586-001-05-7	InterBioScreen Ltd.	STOCK2S-01786			CCn1cc(C(O)=O)c(=O)c2cc(OC)ccc12	InChI=1S/C13H13NO4/c1-3-14-7-10(13(16)17)12(15)9-6-8(18-2)4-5-11(9)14/h4-7H,3H2,1-2H3,(H,16,17)	YTWMJESCVWECIP-UHFFFAOYSA-N	247.084457906							123322
BAS 02378805	LSM-34766	SID7971452, BRD-K22198931	980701	InChI=1S/C21H27N5O2S/c1-15-6-8-16(9-7-15)14-26-17-18(24(2)20(28)23-19(17)27)22-21(26)29-13-12-25-10-4-3-5-11-25/h6-9H,3-5,10-14H2,1-2H3,(H,23,27,28)	FIMLBRNZJKDEJN-UHFFFAOYSA-N	CN1C(=O)NC(=O)c2c1nc(SCCN3CCCCC3)n2Cc4ccc(C)cc4	BroadT	BRD-K22198931	BRD-K22198931-001-05-4	Life Chemicals Inc.	F0823-0016			Cc1ccc(Cn2c(SCCN3CCCCC3)nc3n(C)c(=O)[nH]c(=O)c23)cc1	InChI=1S/C21H27N5O2S/c1-15-6-8-16(9-7-15)14-26-17-18(24(2)20(28)23-19(17)27)22-21(26)29-13-12-25-10-4-3-5-11-25/h6-9H,3-5,10-14H2,1-2H3,(H,23,27,28)	FIMLBRNZJKDEJN-UHFFFAOYSA-N	413.188545844							123323
CID 54214199	LSM-34767	BRD-A18942562	54214199	InChI=1S/C19H22N2O5/c1-10-15(18(23)25-4)17(16(11(2)20-10)19(24)26-5)13-6-8-14(9-7-13)21-12(3)22/h6-9,15,17H,1-5H3,(H,21,22)	PXZRIXDGURKZLX-UHFFFAOYSA-N	COC(=O)C1C(C(=C(C)N=C1C)C(=O)OC)c2ccc(NC(=O)C)cc2	BroadT	BRD-A18942562	BRD-A18942562-001-05-9	ChemBridge Corporation	7636019			COC(=O)C1C(c2ccc(NC(C)=O)cc2)C(C(=O)OC)=C(C)N=C1C	InChI=1S/C19H22N2O5/c1-10-15(18(23)25-4)17(16(11(2)20-10)19(24)26-5)13-6-8-14(9-7-13)21-12(3)22/h6-9,15,17H,1-5H3,(H,21,22)	PXZRIXDGURKZLX-UHFFFAOYSA-N	358.152871824							123324
SMR000066727	LSM-34768	SID3716675, BRD-K67632015	2110030	InChI=1S/C16H17NO6/c1-8-13(10(3)18)9(2)17-14(8)16(20)22-7-11-5-6-12(23-11)15(19)21-4/h5-6,17H,7H2,1-4H3	QOGPCCHEQXERHZ-UHFFFAOYSA-N	COC(=O)c1oc(COC(=O)c2[nH]c(C)c(C(=O)C)c2C)cc1	BroadT	BRD-K67632015	BRD-K67632015-001-05-7	Enamine Ltd.	T5240216			COC(=O)c1ccc(COC(=O)c2[nH]c(C)c(C(C)=O)c2C)o1	InChI=1S/C16H17NO6/c1-8-13(10(3)18)9(2)17-14(8)16(20)22-7-11-5-6-12(23-11)15(19)21-4/h5-6,17H,7H2,1-4H3	QOGPCCHEQXERHZ-UHFFFAOYSA-N	319.105587274							123325
AC1LDBKU	LSM-34769	SID843202, BRD-K39757002	645486	InChI=1S/C23H25N3O5/c1-23(2)22(29)26(15-20(27)24-17-6-4-3-5-7-17)18-14-16(8-9-19(18)31-23)21(28)25-10-12-30-13-11-25/h3-9,14H,10-13,15H2,1-2H3,(H,24,27)	KNZFEJSUNZLZCG-UHFFFAOYSA-N	CC1(C)Oc2ccc(cc2N(CC(=O)Nc3ccccc3)C1=O)C(=O)N4CCOCC4	BroadT	BRD-K39757002	BRD-K39757002-001-05-2	Asinex Ltd.	ASN 05597347			CC1(C)Oc2ccc(cc2N(CC(=O)Nc2ccccc2)C1=O)C(=O)N1CCOCC1	InChI=1S/C23H25N3O5/c1-23(2)22(29)26(15-20(27)24-17-6-4-3-5-7-17)18-14-16(8-9-19(18)31-23)21(28)25-10-12-30-13-11-25/h3-9,14H,10-13,15H2,1-2H3,(H,24,27)	KNZFEJSUNZLZCG-UHFFFAOYSA-N	423.17942093							123326
AC1LCIEZ	LSM-34770	SID848266, BRD-K01174769	650704	InChI=1S/C22H24N2O7S/c1-3-31-22(27)15-5-4-6-19(13-15)32(28,29)24(9-10-25)14-17-11-16-12-18(30-2)7-8-20(16)23-21(17)26/h4-8,11-13,25H,3,9-10,14H2,1-2H3,(H,23,26)	ZPQBYZNZLXLTPX-UHFFFAOYSA-N	CCOC(=O)c1cccc(c1)S(=O)(=O)N(CCO)Cc2cc3cc(OC)ccc3nc2O	BroadT	BRD-K01174769	BRD-K01174769-001-05-7	Asinex Ltd.	ASN 04195318			CCOC(=O)c1cccc(c1)S(=O)(=O)N(CCO)Cc1cc2cc(OC)ccc2nc1O	InChI=1S/C22H24N2O7S/c1-3-31-22(27)15-5-4-6-19(13-15)32(28,29)24(9-10-25)14-17-11-16-12-18(30-2)7-8-20(16)23-21(17)26/h4-8,11-13,25H,3,9-10,14H2,1-2H3,(H,23,26)	ZPQBYZNZLXLTPX-UHFFFAOYSA-N	460.130421818							123327
MLS000718604	LSM-34771	SID24804225, BRD-K56395851	1835925	InChI=1S/C18H17N3O4S/c1-22-13-5-3-11(9-15(13)23-2)17-19-20-18(26)21(17)12-4-6-14-16(10-12)25-8-7-24-14/h3-6,9-10H,7-8H2,1-2H3,(H,20,26)	BKKSNCRYGVQVQL-UHFFFAOYSA-N	COc1ccc(cc1OC)c2nnc(S)n2c3ccc4OCCOc4c3	BroadT	BRD-K56395851	BRD-K56395851-001-05-1	Asinex Ltd.	BAS 12915188			COc1ccc(cc1OC)-c1nnc(S)n1-c1ccc2OCCOc2c1	InChI=1S/C18H17N3O4S/c1-22-13-5-3-11(9-15(13)23-2)17-19-20-18(26)21(17)12-4-6-14-16(10-12)25-8-7-24-14/h3-6,9-10H,7-8H2,1-2H3,(H,20,26)	BKKSNCRYGVQVQL-UHFFFAOYSA-N	371.093976744							123328
AC1LDE1U	LSM-34772	BRD-K38575746	665549	InChI=1S/C21H17N3O5S/c1-13-5-7-14(8-6-13)24-20(27)17(10-18(25)28-2)30-21(24)16(11-22)19(26)23-12-15-4-3-9-29-15/h3-10H,12H2,1-2H3,(H,23,26)	OVWWMYXCLRNJCT-UHFFFAOYSA-N	COC(=O)C=C1SC(=C(C#N)C(=O)NCc2occc2)N(C1=O)c3ccc(C)cc3	BroadT	BRD-K38575746	BRD-K38575746-001-05-0	InterBioScreen Ltd.	STOCK5S-08455			COC(=O)C=c1sc(=C(C#N)C(=O)NCc2ccco2)n(-c2ccc(C)cc2)c1=O	InChI=1S/C21H17N3O5S/c1-13-5-7-14(8-6-13)24-20(27)17(10-18(25)28-2)30-21(24)16(11-22)19(26)23-12-15-4-3-9-29-15/h3-10H,12H2,1-2H3,(H,23,26)	OVWWMYXCLRNJCT-UHFFFAOYSA-N	423.088891364							123329
MLS000567538	LSM-34773	SID17505343, BRD-K80165244	3138383	InChI=1S/C17H16N4O5S/c1-11-6-2-5-9-14(11)26-10-15(22)19-20-17(27)18-16(23)12-7-3-4-8-13(12)21(24)25/h2-9H,10H2,1H3,(H,19,22)(H2,18,20,23,27)	FIGJPPPBXJXISW-UHFFFAOYSA-N	Cc1ccccc1OCC(=O)NNC(=S)NC(=O)c2ccccc2[N+](=O)[O-]	BroadT	BRD-K80165244	BRD-K80165244-001-05-4	Asinex Ltd.	BAS 02136640			Cc1ccccc1OCC(=O)NNC(=S)NC(=O)c1ccccc1[N+]([O-])=O	InChI=1S/C17H16N4O5S/c1-11-6-2-5-9-14(11)26-10-15(22)19-20-17(27)18-16(23)12-7-3-4-8-13(12)21(24)25/h2-9H,10H2,1H3,(H,19,22)(H2,18,20,23,27)	FIGJPPPBXJXISW-UHFFFAOYSA-N	388.084140342							123330
2-Butoxy-3-phenylquinazolin-4-one	LSM-34774	SID22404799, BRD-K13424486	1816029	InChI=1S/C18H18N2O2/c1-2-3-13-22-18-19-16-12-8-7-11-15(16)17(21)20(18)14-9-5-4-6-10-14/h4-12H,2-3,13H2,1H3	WPWUMAZTBQXSIV-UHFFFAOYSA-N	CCCCOC1=Nc2ccccc2C(=O)N1c3ccccc3	BroadT	BRD-K13424486	BRD-K13424486-001-05-4	Specs	AO-294/42730416			CCCCOc1nc2ccccc2c(=O)n1-c1ccccc1	InChI=1S/C18H18N2O2/c1-2-3-13-22-18-19-16-12-8-7-11-15(16)17(21)20(18)14-9-5-4-6-10-14/h4-12H,2-3,13H2,1H3	WPWUMAZTBQXSIV-UHFFFAOYSA-N	294.136827836							123331
AC1LCWVV	LSM-34775	SID856217, BRD-A59528596	657588	InChI=1S/C13H24N4O5/c1-5-7-21-11(18)14-9-10(15-12(19)22-8-6-2)17(4)13(20)16(9)3/h9-10H,5-8H2,1-4H3,(H,14,18)(H,15,19)	FWSWMSADSURGNY-UHFFFAOYSA-N	CCCOC(=O)NC1C(NC(=O)OCCC)N(C)C(=O)N1C	BroadT	BRD-A59528596	BRD-A59528596-001-06-4	InterBioScreen Ltd.	STOCK1S-05847			CCCOC(=O)NC1C(NC(=O)OCCC)N(C)C(=O)N1C	InChI=1S/C13H24N4O5/c1-5-7-21-11(18)14-9-10(15-12(19)22-8-6-2)17(4)13(20)16(9)3/h9-10H,5-8H2,1-4H3,(H,14,18)(H,15,19)	FWSWMSADSURGNY-UHFFFAOYSA-N	316.174669908							123332
(1H-Benzoimidazol-2-ylmethylene)-[1,2,4]triazol-4-yl-amine	LSM-34776	BRD-K89418019	5759591	InChI=1S/C10H8N6/c1-2-4-9-8(3-1)14-10(15-9)5-13-16-6-11-12-7-16/h1-7H,(H,14,15)	UNIWRTPPHYVIFV-UHFFFAOYSA-N	C(=Nn1cnnc1)c2nc3ccccc3[nH]2	BroadT	BRD-K89418019	BRD-K89418019-001-05-1	Asinex Ltd.	BAS 00714499			C(=Nn1cnnc1)c1nc2ccccc2[nH]1	InChI=1S/C10H8N6/c1-2-4-9-8(3-1)14-10(15-9)5-13-16-6-11-12-7-16/h1-7H,(H,14,15)	UNIWRTPPHYVIFV-UHFFFAOYSA-N	212.081044316							
MLS000590881	LSM-34777	SID17512809, BRD-K12251087	1543050	InChI=1S/C23H19ClN6OS2/c24-17-11-13-19(14-12-17)30-21(16-7-3-1-4-8-16)27-29-23(30)33-15-20(31)26-28-22(32)25-18-9-5-2-6-10-18/h1-14H,15H2,(H,26,31)(H2,25,28,32)	OFPIMIXOXATTEG-UHFFFAOYSA-N	Clc1ccc(cc1)n2c(SCC(=O)NNC(=S)Nc3ccccc3)nnc2c4ccccc4	BroadT	BRD-K12251087	BRD-K12251087-001-05-5	InterBioScreen Ltd.	STOCK2S-93768			Clc1ccc(cc1)-n1c(SCC(=O)NNC(=S)Nc2ccccc2)nnc1-c1ccccc1	InChI=1S/C23H19ClN6OS2/c24-17-11-13-19(14-12-17)30-21(16-7-3-1-4-8-16)27-29-23(30)33-15-20(31)26-28-22(32)25-18-9-5-2-6-10-18/h1-14H,15H2,(H,26,31)(H2,25,28,32)	OFPIMIXOXATTEG-UHFFFAOYSA-N	494.075028378							123334
MLS000555982	LSM-34778	SID14741455, BRD-A21093023	3794572	InChI=1S/C17H16N4OS/c18-9-11-13(10-5-2-1-3-6-10)14-15(12-7-4-8-23-12)20-21-17(14)22-16(11)19/h2,4-5,7-8,10,13H,1,3,6,19H2,(H,20,21)	CSUSGCVWHUAESF-UHFFFAOYSA-N	NC1=C(C#N)C(C2CCCC=C2)c3c(O1)[nH]nc3c4cccs4	BroadT	BRD-A21093023	BRD-A21093023-001-05-9	InterBioScreen Ltd.	STOCK2S-99378			NC1=C(C#N)C(C2CCCC=C2)c2c(O1)[nH]nc2-c1cccs1	InChI=1S/C17H16N4OS/c18-9-11-13(10-5-2-1-3-6-10)14-15(12-7-4-8-23-12)20-21-17(14)22-16(11)19/h2,4-5,7-8,10,13H,1,3,6,19H2,(H,20,21)	CSUSGCVWHUAESF-UHFFFAOYSA-N	324.104481862							123335
AC1M57GS	LSM-34779	BRD-K83389690	2274702	InChI=1S/C18H18N4O3/c1-23-16-5-3-7-18(11-16)25-9-8-24-17-6-2-4-15(10-17)12-21-22-13-19-20-14-22/h2-7,10-14H,8-9H2,1H3	QPKPUHZRQCMNLP-UHFFFAOYSA-N	COc1cccc(OCCOc2cccc(C=Nn3cnnc3)c2)c1	BroadT	BRD-K83389690	BRD-K83389690-001-05-6	ChemBridge Corporation	6257115			COc1cccc(OCCOc2cccc(C=Nn3cnnc3)c2)c1	InChI=1S/C18H18N4O3/c1-23-16-5-3-7-18(11-16)25-9-8-24-17-6-2-4-15(10-17)12-21-22-13-19-20-14-22/h2-7,10-14H,8-9H2,1H3	QPKPUHZRQCMNLP-UHFFFAOYSA-N	338.137890476							123336
T0512-6967	LSM-34780	SID24836496, BRD-K76286249	4392744	InChI=1S/C14H17N3O3S2/c1-17(2)22(18,19)13-7-3-5-11(9-13)16-14(21)15-10-12-6-4-8-20-12/h3-9H,10H2,1-2H3,(H2,15,16,21)	HREGNJSBSZZDHT-UHFFFAOYSA-N	CN(C)S(=O)(=O)c1cccc(NC(=NCc2occc2)S)c1	BroadT	BRD-K76286249	BRD-K76286249-001-05-9	Enamine Ltd.	T0512-6967			CN(C)S(=O)(=O)c1cccc(NC(S)=NCc2ccco2)c1	InChI=1S/C14H17N3O3S2/c1-17(2)22(18,19)13-7-3-5-11(9-13)16-14(21)15-10-12-6-4-8-20-12/h3-9H,10H2,1-2H3,(H2,15,16,21)	HREGNJSBSZZDHT-UHFFFAOYSA-N	339.071132814							123337
MLS000104081	LSM-34781	SID7971193, BRD-K42583869	5310408	InChI=1S/C19H25N3O4/c1-26-11-10-22-18(24)15-9-8-13(12-16(15)21-19(22)25)17(23)20-14-6-4-2-3-5-7-14/h8-9,12,14H,2-7,10-11H2,1H3,(H,20,23)(H,21,25)	NIRGQTSJBIMHSJ-UHFFFAOYSA-N	COCCN1C(=O)Nc2cc(ccc2C1=O)C(=O)NC3CCCCCC3	BroadT	BRD-K42583869	BRD-K42583869-001-05-9	Life Chemicals Inc.	F1601-0046			COCCn1c(=O)[nH]c2cc(ccc2c1=O)C(=O)NC1CCCCCC1	InChI=1S/C19H25N3O4/c1-26-11-10-22-18(24)15-9-8-13(12-16(15)21-19(22)25)17(23)20-14-6-4-2-3-5-7-14/h8-9,12,14H,2-7,10-11H2,1H3,(H,20,23)(H,21,25)	NIRGQTSJBIMHSJ-UHFFFAOYSA-N	359.18450631							123338
SMR000264223	LSM-34782	SID22406650, BRD-K03884498	3530658	InChI=1S/C21H16BrN3OS2/c1-12-13(2)27-20-18(12)21(24-11-23-20)28-17-6-4-3-5-16(17)19(26)25-15-9-7-14(22)8-10-15/h3-11H,1-2H3,(H,25,26)	XVONCLBBPYXJHJ-UHFFFAOYSA-N	Cc1sc2ncnc(Sc3ccccc3C(=O)Nc4ccc(Br)cc4)c2c1C	BroadT	BRD-K03884498	BRD-K03884498-001-05-7	Enamine Ltd.	T0513-4597			Cc1sc2ncnc(Sc3ccccc3C(=O)Nc3ccc(Br)cc3)c2c1C	InChI=1S/C21H16BrN3OS2/c1-12-13(2)27-20-18(12)21(24-11-23-20)28-17-6-4-3-5-16(17)19(26)25-15-9-7-14(22)8-10-15/h3-11H,1-2H3,(H,25,26)	XVONCLBBPYXJHJ-UHFFFAOYSA-N	468.991816142							123339
5-(1,3-Benzodioxol-5-yl)-4-(2,5-dimethylphenyl)-4H-1,2,4-triazole-3-thiol	LSM-34783	SID17387738, BRD-K40765561	843793	InChI=1S/C17H15N3O2S/c1-10-3-4-11(2)13(7-10)20-16(18-19-17(20)23)12-5-6-14-15(8-12)22-9-21-14/h3-8H,9H2,1-2H3,(H,19,23)	UUUBHSDLUIDMLH-UHFFFAOYSA-N	Cc1ccc(C)c(c1)n2c(S)nnc2c3ccc4OCOc4c3	BroadT	BRD-K40765561	BRD-K40765561-001-05-5	Specs	AK-968/41924249			Cc1ccc(C)c(c1)-n1c(S)nnc1-c1ccc2OCOc2c1	InChI=1S/C17H15N3O2S/c1-10-3-4-11(2)13(7-10)20-16(18-19-17(20)23)12-5-6-14-15(8-12)22-9-21-14/h3-8H,9H2,1-2H3,(H,19,23)	UUUBHSDLUIDMLH-UHFFFAOYSA-N	325.08849744							123340
ASN 03156996	LSM-34784	SID849593, BRD-K39512711	652093	InChI=1S/C23H20N2O4/c1-26-18-10-8-16(9-11-18)15-4-6-17(7-5-15)22-24-25-23(29-22)20-14-19(27-2)12-13-21(20)28-3/h4-14H,1-3H3	RAHPVBUEPPVRKE-UHFFFAOYSA-N	COc1ccc(cc1)c2ccc(cc2)c3oc(nn3)c4cc(OC)ccc4OC	BroadT	BRD-K39512711	BRD-K39512711-001-06-1	Asinex Ltd.	ASN 03156996			COc1ccc(cc1)-c1ccc(cc1)-c1nnc(o1)-c1cc(OC)ccc1OC	InChI=1S/C23H20N2O4/c1-26-18-10-8-16(9-11-18)15-4-6-17(7-5-15)22-24-25-23(29-22)20-14-19(27-2)12-13-21(20)28-3/h4-14H,1-3H3	RAHPVBUEPPVRKE-UHFFFAOYSA-N	388.14230714							123341
AC1O992O	LSM-34785	BRD-K92411514	6751156	InChI=1S/C18H12BrClN2O3/c19-15-8-12(20)7-11(17(15)23)10-21-13-3-1-4-14(9-13)22-18(24)16-5-2-6-25-16/h1-10,23H,(H,22,24)	QWMBWLLSPJNPDR-UHFFFAOYSA-N	Oc1c(Br)cc(Cl)cc1C=Nc2cccc(NC(=O)c3occc3)c2	BroadT	BRD-K92411514	BRD-K92411514-001-05-1	Asinex Ltd.	BAS 00326682			Oc1c(Br)cc(Cl)cc1C=Nc1cccc(NC(=O)c2ccco2)c1	InChI=1S/C18H12BrClN2O3/c19-15-8-12(20)7-11(17(15)23)10-21-13-3-1-4-14(9-13)22-18(24)16-5-2-6-25-16/h1-10,23H,(H,22,24)	QWMBWLLSPJNPDR-UHFFFAOYSA-N	417.971982574							
STK225804	LSM-34786	SID4263379, BRD-K20046844	2944626	InChI=1S/C19H23N3O2/c23-19(10-6-16-24-17-7-2-1-3-8-17)22-14-12-21(13-15-22)18-9-4-5-11-20-18/h1-5,7-9,11H,6,10,12-16H2	UNLWICQMOUCWDM-UHFFFAOYSA-N	O=C(CCCOc1ccccc1)N2CCN(CC2)c3ccccn3	BroadT	BRD-K20046844	BRD-K20046844-001-05-3	ChemBridge Corporation	7638245			O=C(CCCOc1ccccc1)N1CCN(CC1)c1ccccn1	InChI=1S/C19H23N3O2/c23-19(10-6-16-24-17-7-2-1-3-8-17)22-14-12-21(13-15-22)18-9-4-5-11-20-18/h1-5,7-9,11H,6,10,12-16H2	UNLWICQMOUCWDM-UHFFFAOYSA-N	325.179027006							123343
MLS000041608	LSM-34787	SID125163727, SID864026, SID87349190, BRD-K57067035	665278	InChI=1S/C20H20N4O3/c1-26-17-9-13-6-8-24-16(15(13)10-18(17)27-2)11-19(23-20(24)25)22-12-14-5-3-4-7-21-14/h3-5,7,9-11H,6,8,12H2,1-2H3,(H,22,23,25)	GDMHFHBNDVRFCG-UHFFFAOYSA-N	COc1cc2CCN3C(=O)N=C(NCc4ccccn4)C=C3c2cc1OC	BroadT	BRD-K57067035	BRD-K57067035-001-05-4	InterBioScreen Ltd.	STOCK4S-99018			COc1cc2CCn3c(cc(NCc4ccccn4)nc3=O)-c2cc1OC	InChI=1S/C20H20N4O3/c1-26-17-9-13-6-8-24-16(15(13)10-18(17)27-2)11-19(23-20(24)25)22-12-14-5-3-4-7-21-14/h3-5,7,9-11H,6,8,12H2,1-2H3,(H,22,23,25)	GDMHFHBNDVRFCG-UHFFFAOYSA-N	364.15354054							123344
SMR000137358	LSM-34788	SID14732532, BRD-K33773774	792664	InChI=1S/C19H23ClN2O/c1-2-21-10-12-22(13-11-21)15-16-4-3-5-19(14-16)23-18-8-6-17(20)7-9-18/h3-9,14H,2,10-13,15H2,1H3	TWFBQVYJVVPGEV-UHFFFAOYSA-N	CCN1CCN(Cc2cccc(Oc3ccc(Cl)cc3)c2)CC1	BroadT	BRD-K33773774	BRD-K33773774-001-05-1	ChemBridge Corporation	5263240			CCN1CCN(Cc2cccc(Oc3ccc(Cl)cc3)c2)CC1	InChI=1S/C19H23ClN2O/c1-2-21-10-12-22(13-11-21)15-16-4-3-5-19(14-16)23-18-8-6-17(20)7-9-18/h3-9,14H,2,10-13,15H2,1H3	TWFBQVYJVVPGEV-UHFFFAOYSA-N	330.149891086							123345
AC1LP29A	LSM-34789	BRD-K75085581	1279951	InChI=1S/C15H12Cl2N6O/c16-12-6-5-11(13(17)7-12)9-24-14-4-2-1-3-10(14)8-19-23-15(18)20-21-22-23/h1-8H,9H2,(H2,18,20,22)	QUVAZGORKGQISZ-UHFFFAOYSA-N	Nc1nnnn1N=Cc2ccccc2OCc3ccc(Cl)cc3Cl	BroadT	BRD-K75085581	BRD-K75085581-001-07-8	ChemDiv Inc.	2144-0779			Nc1nnnn1N=Cc1ccccc1OCc1ccc(Cl)cc1Cl	InChI=1S/C15H12Cl2N6O/c16-12-6-5-11(13(17)7-12)9-24-14-4-2-1-3-10(14)8-19-23-15(18)20-21-22-23/h1-8H,9H2,(H2,18,20,22)	QUVAZGORKGQISZ-UHFFFAOYSA-N	362.044964484							123346
SMR000076439	LSM-34790	SID4256969, BRD-K87790977	2204910	InChI=1S/C18H20N2OS/c21-17-8-4-7-16(13-17)18(22)20-11-9-19(10-12-20)14-15-5-2-1-3-6-15/h1-8,13,21H,9-12,14H2	YAFAIISMUIZKNL-UHFFFAOYSA-N	Oc1cccc(c1)C(=S)N2CCN(Cc3ccccc3)CC2	BroadT	BRD-K87790977	BRD-K87790977-001-05-5	ChemBridge Corporation	7784869			Oc1cccc(c1)C(=S)N1CCN(Cc2ccccc2)CC1	InChI=1S/C18H20N2OS/c21-17-8-4-7-16(13-17)18(22)20-11-9-19(10-12-20)14-15-5-2-1-3-6-15/h1-8,13,21H,9-12,14H2	YAFAIISMUIZKNL-UHFFFAOYSA-N	312.12963397							123347
SMR000153314	LSM-34791	SID14744997, BRD-K67023565	2121796	InChI=1S/C14H12N4OS2/c1-2-20-14-18-17-13(21-14)16-12(19)11-8-7-9-5-3-4-6-10(9)15-11/h3-8H,2H2,1H3,(H,16,17,19)	DUUWHYWCCQNXKS-UHFFFAOYSA-N	CCSc1nnc(NC(=O)c2ccc3ccccc3n2)s1	BroadT	BRD-K67023565	BRD-K67023565-001-06-1	Enamine Ltd.	T5267174			CCSc1nnc(NC(=O)c2ccc3ccccc3n2)s1	InChI=1S/C14H12N4OS2/c1-2-20-14-18-17-13(21-14)16-12(19)11-8-7-9-5-3-4-6-10(9)15-11/h3-8H,2H2,1H3,(H,16,17,19)	DUUWHYWCCQNXKS-UHFFFAOYSA-N	316.045252424							123348
MLS000703473	LSM-6571	SID24779699, SID103023222, BRD-K25144184	4432160	InChI=1S/C14H11N3O5/c18-9(6-17-10(19)4-5-11(17)20)15-8-3-1-2-7-12(8)14(22)16-13(7)21/h1-3H,4-6H2,(H,15,18)(H,16,21,22)	ICBGDABTHZCPDN-UHFFFAOYSA-N	O=C(CN1C(=O)CCC1=O)Nc2cccc3C(=O)NC(=O)c23	BroadT	BRD-K25144184	BRD-K25144184-001-07-5	Life Chemicals Inc.	F0440-0373			O=C(CN1C(=O)CCC1=O)Nc1cccc2C(=O)NC(=O)c12	InChI=1S/C14H11N3O5/c18-9(6-17-10(19)4-5-11(17)20)15-8-3-1-2-7-12(8)14(22)16-13(7)21/h1-3H,4-6H2,(H,15,18)(H,16,21,22)	ICBGDABTHZCPDN-UHFFFAOYSA-N	301.069870482							95249
Ethyl 2-(3-oxo-3,4-dihydroquinoxalin-2-yl)propanoate	LSM-34792	SID857004, BRD-A18330262	599428	InChI=1S/C13H14N2O3/c1-3-18-13(17)8(2)11-12(16)15-10-7-5-4-6-9(10)14-11/h4-8H,3H2,1-2H3,(H,15,16)	CVOVFRILKMNGBC-UHFFFAOYSA-N	CCOC(=O)C(C)c1nc2ccccc2nc1O	BroadT	BRD-A18330262	BRD-A18330262-001-05-0	InterBioScreen Ltd.	STOCK1S-42737			CCOC(=O)C(C)c1nc2ccccc2nc1O	InChI=1S/C13H14N2O3/c1-3-18-13(17)8(2)11-12(16)15-10-7-5-4-6-9(10)14-11/h4-8H,3H2,1-2H3,(H,15,16)	CVOVFRILKMNGBC-UHFFFAOYSA-N	246.100442328							123349
25700-63-4	LSM-34793	SID4257821, BRD-K00701913	746807	InChI=1S/C12H9NO3S/c14-11(10-2-1-7-17-10)13-9-5-3-8(4-6-9)12(15)16/h1-7H,(H,13,14)(H,15,16)	MFWXTLPJAFKOSC-UHFFFAOYSA-N	OC(=O)c1ccc(NC(=O)c2cccs2)cc1	BroadT	BRD-K00701913	BRD-K00701913-001-05-3	ChemBridge Corporation	5267549			OC(=O)c1ccc(NC(=O)c2cccs2)cc1	InChI=1S/C12H9NO3S/c14-11(10-2-1-7-17-10)13-9-5-3-8(4-6-9)12(15)16/h1-7H,(H,13,14)(H,15,16)	MFWXTLPJAFKOSC-UHFFFAOYSA-N	247.030313848							123350
MLS000519912	LSM-34794	SID14738512, BRD-K20790683	9551469	InChI=1S/C17H23N3O4/c1-3-4-5-8-18-15(21)12-6-7-13-14(11-12)19-17(23)20(16(13)22)9-10-24-2/h6-7,11H,3-5,8-10H2,1-2H3,(H,18,21)(H,19,23)	SJFSCJXFRKSETM-UHFFFAOYSA-N	CCCCCNC(=O)c1ccc2C(=O)N(CCOC)C(=O)Nc2c1	BroadT	BRD-K20790683	BRD-K20790683-001-05-0	ChemDiv Inc.	C190-0103			CCCCCNC(=O)c1ccc2c(c1)[nH]c(=O)n(CCOC)c2=O	InChI=1S/C17H23N3O4/c1-3-4-5-8-18-15(21)12-6-7-13-14(11-12)19-17(23)20(16(13)22)9-10-24-2/h6-7,11H,3-5,8-10H2,1-2H3,(H,18,21)(H,19,23)	SJFSCJXFRKSETM-UHFFFAOYSA-N	333.168856246							123351
AC1N5SIA	LSM-34795	SID26663213, BRD-K96497746	4201789	InChI=1S/C23H17FN4O4S/c1-14-4-2-10-27-21(14)26-22-18(23(27)29)12-19(20(25)28(22)13-16-5-3-11-32-16)33(30,31)17-8-6-15(24)7-9-17/h2-12,25H,13H2,1H3	LSNBRXNBIYYOLX-UHFFFAOYSA-N	CC1=CC=CN2C(=O)C3=C(N=C12)N(Cc4occc4)C(=N)C(=C3)S(=O)(=O)c5ccc(F)cc5	BroadT	BRD-K96497746	BRD-K96497746-001-05-6	InterBioScreen Ltd.	STOCK5S-15203			Cc1cccn2c1nc1n(Cc3ccco3)c(=N)c(cc1c2=O)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H17FN4O4S/c1-14-4-2-10-27-21(14)26-22-18(23(27)29)12-19(20(25)28(22)13-16-5-3-11-32-16)33(30,31)17-8-6-15(24)7-9-17/h2-12,25H,13H2,1H3	LSNBRXNBIYYOLX-UHFFFAOYSA-N	464.095453954							123352
ZINC12625478	LSM-34796	BRD-K62703930	6821159	InChI=1S/C17H16N4O2S/c1-23-13-7-10(5-6-12(13)22)8-20-21-16-15-11-3-2-4-14(11)24-17(15)19-9-18-16/h5-9,22H,2-4H2,1H3,(H,18,19,21)	ZEQVPYCTTMNPIL-UHFFFAOYSA-N	COc1cc(C=NNc2ncnc3sc4CCCc4c23)ccc1O	BroadT	BRD-K62703930	BRD-K62703930-001-05-3	Enamine Ltd.	T0513-9744			COc1cc(C=NNc2ncnc3sc4CCCc4c23)ccc1O	InChI=1S/C17H16N4O2S/c1-23-13-7-10(5-6-12(13)22)8-20-21-16-15-11-3-2-4-14(11)24-17(15)19-9-18-16/h5-9,22H,2-4H2,1H3,(H,18,19,21)	ZEQVPYCTTMNPIL-UHFFFAOYSA-N	340.099396482							
MLS000557299	LSM-34797	SID14743495, BRD-K35581544	937062	InChI=1S/C10H11N3OS/c1-13-10(14)8-6-4-2-3-5-7(6)15-9(8)11-12-13/h2-5H2,1H3	JRNMITOICVFZHK-UHFFFAOYSA-N	CN1N=Nc2sc3CCCCc3c2C1=O	BroadT	BRD-K35581544	BRD-K35581544-001-06-3	InterBioScreen Ltd.	STOCK4S-20464			Cn1nnc2sc3CCCCc3c2c1=O	InChI=1S/C10H11N3OS/c1-13-10(14)8-6-4-2-3-5-7(6)15-9(8)11-12-13/h2-5H2,1H3	JRNMITOICVFZHK-UHFFFAOYSA-N	221.062282692							123354
AC1LDACU	LSM-34798	SID842670, BRD-K11275290	644941	InChI=1S/C14H12ClN5/c15-9-3-1-4-10(7-9)18-13-11-5-2-6-12(11)19-14-16-8-17-20(13)14/h1,3-4,7-8,18H,2,5-6H2	KYYXEPVJTZNLJM-UHFFFAOYSA-N	Clc1cccc(Nc2c3CCCc3nc4ncnn24)c1	BroadT	BRD-K11275290	BRD-K11275290-001-05-8	Asinex Ltd.	ASN 07101388			Clc1cccc(Nc2c3CCCc3nc3ncnn23)c1	InChI=1S/C14H12ClN5/c15-9-3-1-4-10(7-9)18-13-11-5-2-6-12(11)19-14-16-8-17-20(13)14/h1,3-4,7-8,18H,2,5-6H2	KYYXEPVJTZNLJM-UHFFFAOYSA-N	285.078123144							131302
MAYBRIDGE1_006752	LSM-34799	BRD-K25753310	571751	InChI=1S/C12H15N3O/c1-9-4-6-10(7-5-9)14-15-11-3-2-8-13-12(11)16/h4-7,14H,2-3,8H2,1H3,(H,13,16)	BWCYYCWSCABXGH-UHFFFAOYSA-N	Cc1ccc(NN=C2CCCNC2=O)cc1	BroadT	BRD-K25753310	BRD-K25753310-001-07-0	Key Organics Ltd.	1L-923			Cc1ccc(NN=C2CCCNC2=O)cc1	InChI=1S/C12H15N3O/c1-9-4-6-10(7-5-9)14-15-11-3-2-8-13-12(11)16/h4-7,14H,2-3,8H2,1H3,(H,13,16)	BWCYYCWSCABXGH-UHFFFAOYSA-N	217.12151213							123357
MLS000888833	LSM-34800	SID26670057, BRD-K56757219	16682613	InChI=1S/C19H29N3/c20-19-21-15-18(17-12-5-2-6-13-17)22(19)14-8-7-11-16-9-3-1-4-10-16/h2,5-6,12-13,16,18H,1,3-4,7-11,14-15H2,(H2,20,21)/t18-/m1/s1	OWCJTQHZMVKDLV-GOSISDBHSA-N	NC1=NC[C@@H](N1CCCCC2CCCCC2)c3ccccc3	BroadT	BRD-K56757219	BRD-K56757219-001-05-9	Torrey Pines Institute for Molecular Studies	1656-87			NC1=NC[C@@H](N1CCCCC1CCCCC1)c1ccccc1	InChI=1S/C19H29N3/c20-19-21-15-18(17-12-5-2-6-13-17)22(19)14-8-7-11-16-9-3-1-4-10-16/h2,5-6,12-13,16,18H,1,3-4,7-11,14-15H2,(H2,20,21)/t18-/m1/s1	OWCJTQHZMVKDLV-GOSISDBHSA-N	299.236147958							123358
MLS000099971	LSM-34801	SID4256143, BRD-K83097268	2973241	InChI=1S/C13H13N3O3S3/c1-8(17)14-9-3-5-10(6-4-9)19-11(18)7-21-13-15-12(20-2)16-22-13/h3-6H,7H2,1-2H3,(H,14,17)	WYXLBPTZZJUUSF-UHFFFAOYSA-N	CSc1nsc(SCC(=O)Oc2ccc(NC(=O)C)cc2)n1	BroadT	BRD-K83097268	BRD-K83097268-001-06-5	ChemBridge Corporation	7955373			CSc1nsc(SCC(=O)Oc2ccc(NC(C)=O)cc2)n1	InChI=1S/C13H13N3O3S3/c1-8(17)14-9-3-5-10(6-4-9)19-11(18)7-21-13-15-12(20-2)16-22-13/h3-6H,7H2,1-2H3,(H,14,17)	WYXLBPTZZJUUSF-UHFFFAOYSA-N	355.011903376							123359
SMR000078331	LSM-34802	SID4257351, BRD-K76656820	742132	InChI=1S/C18H20N4O3/c1-6-9-22-14-15(20(4)18(24)21(5)16(14)23)19-17(22)25-13-10-11(2)7-8-12(13)3/h6-8,10H,1,9H2,2-5H3	JJVPINNJXFOOJE-UHFFFAOYSA-N	CN1C(=O)N(C)c2nc(Oc3cc(C)ccc3C)n(CC=C)c2C1=O	BroadT	BRD-K76656820	BRD-K76656820-001-05-0	ChemBridge Corporation	7906105			Cc1ccc(C)c(Oc2nc3n(C)c(=O)n(C)c(=O)c3n2CC=C)c1	InChI=1S/C18H20N4O3/c1-6-9-22-14-15(20(4)18(24)21(5)16(14)23)19-17(22)25-13-10-11(2)7-8-12(13)3/h6-8,10H,1,9H2,2-5H3	JJVPINNJXFOOJE-UHFFFAOYSA-N	340.15354054							123360
ZINC03894097	LSM-44520	SID14737391, BRD-K12891884	5291813	InChI=1S/C19H17N3O3/c1-12-6-5-8-14(10-12)20-11-15-17(23)21-19(25)22(18(15)24)16-9-4-3-7-13(16)2/h3-11,20H,1-2H3,(H,21,23,25)/b15-11+	PYUSZIKCGINRMK-RVDMUPIBSA-N	Cc1cccc(N\C=C\2/C(=O)NC(=O)N(C2=O)c3ccccc3C)c1	BroadT	BRD-K12891884	BRD-K12891884-001-05-3	ChemDiv Inc.	3448-7420			Cc1cccc(N\C=C2/C(=O)NC(=O)N(C2=O)c2ccccc2C)c1	InChI=1S/C19H17N3O3/c1-12-6-5-8-14(10-12)20-11-15-17(23)21-19(25)22(18(15)24)16-9-4-3-7-13(16)2/h3-11,20H,1-2H3,(H,21,23,25)/b15-11+	PYUSZIKCGINRMK-RVDMUPIBSA-N	335.126991434							
Ethyl 1-(4-chlorobenzyl)-4-(phenylsulfonyl)-4-piperidinecarboxylate	LSM-34804	SID17403076, BRD-K89103882	2766331	InChI=1S/C21H24ClNO4S/c1-2-27-20(24)21(28(25,26)19-6-4-3-5-7-19)12-14-23(15-13-21)16-17-8-10-18(22)11-9-17/h3-11H,2,12-16H2,1H3	RDQPGXJOUZSIHR-UHFFFAOYSA-N	CCOC(=O)C1(CCN(Cc2ccc(Cl)cc2)CC1)S(=O)(=O)c3ccccc3	BroadT	BRD-K89103882	BRD-K89103882-001-05-3	Key Organics Ltd.	10X-0943			CCOC(=O)C1(CCN(Cc2ccc(Cl)cc2)CC1)S(=O)(=O)c1ccccc1	InChI=1S/C21H24ClNO4S/c1-2-27-20(24)21(28(25,26)19-6-4-3-5-7-19)12-14-23(15-13-21)16-17-8-10-18(22)11-9-17/h3-11H,2,12-16H2,1H3	RDQPGXJOUZSIHR-UHFFFAOYSA-N	421.111456658							123362
ZINC13496258	LSM-34805	BRD-K09726443	73175900	InChI=1S/C19H18N4O3/c1-12-15(14-4-2-3-5-16(14)22-12)9-21-23-19(24)10-20-13-6-7-17-18(8-13)26-11-25-17/h2-9,20,22H,10-11H2,1H3,(H,23,24)	WJZKZBJPEOMXAJ-UHFFFAOYSA-N	Cc1[nH]c2ccccc2c1C=NNC(=O)CNc3ccc4OCOc4c3	BroadT	BRD-K09726443	BRD-K09726443-001-05-0	ChemDiv Inc.	5408-2005			Cc1[nH]c2ccccc2c1C=NNC(=O)CNc1ccc2OCOc2c1	InChI=1S/C19H18N4O3/c1-12-15(14-4-2-3-5-16(14)22-12)9-21-23-19(24)10-20-13-6-7-17-18(8-13)26-11-25-17/h2-9,20,22H,10-11H2,1H3,(H,23,24)	WJZKZBJPEOMXAJ-UHFFFAOYSA-N	350.137890476							
AC1MVRAB	LSM-15484	BRD-A15216796	3687726	InChI=1S/C23H23ClN4O6S2/c24-18-8-7-16(28(30)31)14-22(18)36(32,33)26-19-5-2-1-4-17(19)23(29)25-15-20(21-6-3-13-35-21)27-9-11-34-12-10-27/h1-8,13-14,20,26H,9-12,15H2,(H,25,29)	FRVCAGRHVBRWTQ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(Cl)c(c1)S(=O)(=O)Nc2ccccc2C(=O)NCC(N3CCOCC3)c4cccs4	BroadT	BRD-A15216796	BRD-A15216796-003-06-3	Enamine Ltd.	T0503-2999		Cl	[O-][N+](=O)c1ccc(Cl)c(c1)S(=O)(=O)Nc1ccccc1C(=O)NCC(N1CCOCC1)c1cccs1.Cl	InChI=1S/C23H23ClN4O6S2.ClH/c24-18-8-7-16(28(30)31)14-22(18)36(32,33)26-19-5-2-1-4-17(19)23(29)25-15-20(21-6-3-13-35-21)27-9-11-34-12-10-27;/h1-8,13-14,20,26H,9-12,15H2,(H,25,29);1H	GXTYOIYWTVGYKM-UHFFFAOYSA-N	550.074753586							104127, 104127
MLS000080417	LSM-34806	SID860587, BRD-K12559128	661870	InChI=1S/C20H13ClN4O/c21-14-9-7-13(8-10-14)19-24-18-20(25(19)12-15-4-3-11-26-15)23-17-6-2-1-5-16(17)22-18/h1-11H,12H2	ZSDWKLSARSJGSZ-UHFFFAOYSA-N	Clc1ccc(cc1)c2nc3nc4ccccc4nc3n2Cc5occc5	BroadT	BRD-K12559128	BRD-K12559128-001-04-5	InterBioScreen Ltd.	STOCK3S-80678			Clc1ccc(cc1)-c1nc2nc3ccccc3nc2n1Cc1ccco1	InChI=1S/C20H13ClN4O/c21-14-9-7-13(8-10-14)19-24-18-20(25(19)12-15-4-3-11-26-15)23-17-6-2-1-5-16(17)22-18/h1-11H,12H2	ZSDWKLSARSJGSZ-UHFFFAOYSA-N	360.077788786							123364
SMR000039646	LSM-34807	SID857372, BRD-K76545480	658718	InChI=1S/C17H23N5O/c1-3-5-19-16-15-12-21(2)6-4-13(15)14(11-18)17(20-16)22-7-9-23-10-8-22/h3H,1,4-10,12H2,2H3,(H,19,20)	FBBFGAKNXBWOEG-UHFFFAOYSA-N	CN1CCc2c(C1)c(NCC=C)nc(N3CCOCC3)c2C#N	BroadT	BRD-K76545480	BRD-K76545480-001-05-6	InterBioScreen Ltd.	STOCK1S-62895			CN1CCc2c(C1)c(NCC=C)nc(N1CCOCC1)c2C#N	InChI=1S/C17H23N5O/c1-3-5-19-16-15-12-21(2)6-4-13(15)14(11-18)17(20-16)22-7-9-23-10-8-22/h3H,1,4-10,12H2,2H3,(H,19,20)	FBBFGAKNXBWOEG-UHFFFAOYSA-N	313.190260406							123365
MLS000041145	LSM-34808	SID861177, BRD-K52527310	662435	InChI=1S/C14H11Cl2N3S2/c1-19-13(12-6-3-7-20-12)17-18-14(19)21-8-9-10(15)4-2-5-11(9)16/h2-7H,8H2,1H3	ARJLOLQLNXHOOC-UHFFFAOYSA-N	Cn1c(SCc2c(Cl)cccc2Cl)nnc1c3cccs3	BroadT	BRD-K52527310	BRD-K52527310-001-05-8	InterBioScreen Ltd.	STOCK4S-04460			Cn1c(SCc2c(Cl)cccc2Cl)nnc1-c1cccs1	InChI=1S/C14H11Cl2N3S2/c1-19-13(12-6-3-7-20-12)17-18-14(19)21-8-9-10(15)4-2-5-11(9)16/h2-7H,8H2,1H3	ARJLOLQLNXHOOC-UHFFFAOYSA-N	354.977144182							123366
N-(3-Chloro-4-methoxyphenyl)-4,6-dimethoxy-1,3,5-triazin-2-amine	LSM-34809	SID4258291, BRD-K32545447	975799	InChI=1S/C12H13ClN4O3/c1-18-9-5-4-7(6-8(9)13)14-10-15-11(19-2)17-12(16-10)20-3/h4-6H,1-3H3,(H,14,15,16,17)	GICVTFYKGKMNFM-UHFFFAOYSA-N	COc1ccc(Nc2nc(OC)nc(OC)n2)cc1Cl	BroadT	BRD-K32545447	BRD-K32545447-001-05-1	ChemBridge Corporation	7694837			COc1nc(Nc2ccc(OC)c(Cl)c2)nc(OC)n1	InChI=1S/C12H13ClN4O3/c1-18-9-5-4-7(6-8(9)13)14-10-15-11(19-2)17-12(16-10)20-3/h4-6H,1-3H3,(H,14,15,16,17)	GICVTFYKGKMNFM-UHFFFAOYSA-N	296.067618026							123367
AC1LQJTQ	LSM-34810	BRD-K94635121	1377287	InChI=1S/C22H17N3OS/c26-20-22(18-12-6-2-7-13-18,19-14-8-3-9-15-19)27-21(24-20)25-23-16-17-10-4-1-5-11-17/h1-16H,(H,24,25,26)	GQZWIZWRCBWZIN-UHFFFAOYSA-N	O=C1N=C(NN=Cc2ccccc2)SC1(c3ccccc3)c4ccccc4	BroadT	BRD-K94635121	BRD-K94635121-001-05-8	ChemBridge Corporation	5268518			O=C1N=C(NN=Cc2ccccc2)SC1(c1ccccc1)c1ccccc1	InChI=1S/C22H17N3OS/c26-20-22(18-12-6-2-7-13-18,19-14-8-3-9-15-19)27-21(24-20)25-23-16-17-10-4-1-5-11-17/h1-16H,(H,24,25,26)	GQZWIZWRCBWZIN-UHFFFAOYSA-N	371.109232884							123368
MLS-0342317.0001	LSM-2539	BRD-K24632213, SID49643095, SID87544799, SID89650209	814607	InChI=1S/C16H18N4O2S/c1-10(2)23-16-17-13-12(14(21)18-15(22)19(13)3)20(16)9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3,(H,18,21,22)	GZMLOYHLICCMMS-UHFFFAOYSA-N	CC(C)Sc1nc2N(C)C(=O)NC(=O)c2n1Cc3ccccc3	BroadT	BRD-K24632213	BRD-K24632213-001-05-9	Asinex Ltd.	BAS 00411663			CC(C)Sc1nc2n(C)c(=O)[nH]c(=O)c2n1Cc1ccccc1	InChI=1S/C16H18N4O2S/c1-10(2)23-16-17-13-12(14(21)18-15(22)19(13)3)20(16)9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3,(H,18,21,22)	GZMLOYHLICCMMS-UHFFFAOYSA-N	330.115046546							92434
MLS000324487	LSM-34811	SID17386761, SID24274232, BRD-K35911906	1004085	InChI=1S/C23H20N2O4S/c1-27-15-7-4-13(5-8-15)17-10-9-16-20(24)22(30-23(16)25-17)21(26)14-6-11-18(28-2)19(12-14)29-3/h4-12H,24H2,1-3H3	OEFWIJZKAIUFBL-UHFFFAOYSA-N	COc1ccc(cc1)c2ccc3c(N)c(sc3n2)C(=O)c4ccc(OC)c(OC)c4	BroadT	BRD-K35911906	BRD-K35911906-001-06-4	Specs	AM-807/13615586			COc1ccc(cc1)-c1ccc2c(N)c(sc2n1)C(=O)c1ccc(OC)c(OC)c1	InChI=1S/C23H20N2O4S/c1-27-15-7-4-13(5-8-15)17-10-9-16-20(24)22(30-23(16)25-17)21(26)14-6-11-18(28-2)19(12-14)29-3/h4-12H,24H2,1-3H3	OEFWIJZKAIUFBL-UHFFFAOYSA-N	420.11437783							123369
SMR000097143	LSM-34812	SID24838866, SID7966725, BRD-K95351944	4092553	InChI=1S/C25H28N2O5S/c1-18-5-4-6-23(19(18)2)26-13-15-27(16-14-26)25(28)24-12-9-21(32-24)17-33(29,30)22-10-7-20(31-3)8-11-22/h4-12H,13-17H2,1-3H3	PDNWQTIPSVDUJE-UHFFFAOYSA-N	COc1ccc(cc1)S(=O)(=O)Cc2oc(cc2)C(=O)N3CCN(CC3)c4cccc(C)c4C	BroadT	BRD-K95351944	BRD-K95351944-001-05-6	ChemDiv Inc.	K788-8203			COc1ccc(cc1)S(=O)(=O)Cc1ccc(o1)C(=O)N1CCN(CC1)c1cccc(C)c1C	InChI=1S/C25H28N2O5S/c1-18-5-4-6-23(19(18)2)26-13-15-27(16-14-26)25(28)24-12-9-21(32-24)17-33(29,30)22-10-7-20(31-3)8-11-22/h4-12H,13-17H2,1-3H3	PDNWQTIPSVDUJE-UHFFFAOYSA-N	468.171892706							123370
ST50591150	LSM-34813	SID7973540, BRD-K48966181	760119	InChI=1S/C15H21NO2S/c1-18-14-11-12(19-2)7-8-13(14)15(17)16-9-5-3-4-6-10-16/h7-8,11H,3-6,9-10H2,1-2H3	CCHNNQACJOGRSX-UHFFFAOYSA-N	COc1cc(SC)ccc1C(=O)N2CCCCCC2	BroadT	BRD-K48966181	BRD-K48966181-001-06-9	ChemBridge Corporation	6217399			COc1cc(SC)ccc1C(=O)N1CCCCCC1	InChI=1S/C15H21NO2S/c1-18-14-11-12(19-2)7-8-13(14)15(17)16-9-5-3-4-6-10-16/h7-8,11H,3-6,9-10H2,1-2H3	CCHNNQACJOGRSX-UHFFFAOYSA-N	279.129299612							123371
MLS000537583	LSM-34814	SID17386649, SID56373593, BRD-K77709544	851892	InChI=1S/C18H14N2O3S/c1-23-18(22)20-17-19-14(12-8-4-2-5-9-12)16(24-17)15(21)13-10-6-3-7-11-13/h2-11H,1H3,(H,19,20,22)	LEXZXNMSSMJPKV-UHFFFAOYSA-N	COC(=O)Nc1nc(c2ccccc2)c(s1)C(=O)c3ccccc3	BroadT	BRD-K77709544	BRD-K77709544-001-08-5	Specs	AQ-360/42595665			COC(=O)Nc1nc(c(s1)C(=O)c1ccccc1)-c1ccccc1	InChI=1S/C18H14N2O3S/c1-23-18(22)20-17-19-14(12-8-4-2-5-9-12)16(24-17)15(21)13-10-6-3-7-11-13/h2-11H,1H3,(H,19,20,22)	LEXZXNMSSMJPKV-UHFFFAOYSA-N	338.072513018							123372
ST50675471	LSM-34815	SID4244180, BRD-K07587736	3238808	InChI=1S/C22H20N2O3/c1-26-16-9-11-17-15(13-16)8-10-18-20(23-27-21(17)18)22(25)24-12-4-6-14-5-2-3-7-19(14)24/h2-3,5,7,9,11,13H,4,6,8,10,12H2,1H3	FTHJGBUEJVSENS-UHFFFAOYSA-N	COc1ccc2c(CCc3c2onc3C(=O)N4CCCc5ccccc45)c1	BroadT	BRD-K07587736	BRD-K07587736-001-05-4	ChemDiv Inc.	C226-4012			COc1ccc2-c3onc(C(=O)N4CCCc5ccccc45)c3CCc2c1	InChI=1S/C22H20N2O3/c1-26-16-9-11-17-15(13-16)8-10-18-20(23-27-21(17)18)22(25)24-12-4-6-14-5-2-3-7-19(14)24/h2-3,5,7,9,11,13H,4,6,8,10,12H2,1H3	FTHJGBUEJVSENS-UHFFFAOYSA-N	360.14739252							123373
STK131324	LSM-34816	SID14723893, BRD-K59866979	1096812	InChI=1S/C23H26N4O2/c1-17-9-11-19(12-10-17)20-15-24-23(27(20)3)25-21(28)13-14-22(29)26(2)16-18-7-5-4-6-8-18/h4-12,15H,13-14,16H2,1-3H3,(H,24,25,28)	JSKMAUMKMVZHBA-UHFFFAOYSA-N	CN(Cc1ccccc1)C(=O)CCC(=O)Nc2ncc(c3ccc(C)cc3)n2C	BroadT	BRD-K59866979	BRD-K59866979-001-06-3	Asinex Ltd.	BAS 11101839			CN(Cc1ccccc1)C(=O)CCC(=O)Nc1ncc(-c2ccc(C)cc2)n1C	InChI=1S/C23H26N4O2/c1-17-9-11-19(12-10-17)20-15-24-23(27(20)3)25-21(28)13-14-22(29)26(2)16-18-7-5-4-6-8-18/h4-12,15H,13-14,16H2,1-3H3,(H,24,25,28)	JSKMAUMKMVZHBA-UHFFFAOYSA-N	390.205576112							123374
MLS000724771	LSM-34817	SID17514792, BRD-A58851360	4906535	InChI=1S/C20H19NO5S/c1-25-20(24)16-13-8-4-5-9-15(13)27-18(16)21-17(22)14-10-11-6-2-3-7-12(11)19(23)26-14/h2-3,6-7,14H,4-5,8-10H2,1H3,(H,21,22)	RZHQKEHUOJBXON-UHFFFAOYSA-N	COC(=O)c1c2CCCCc2sc1NC(=O)C3Cc4ccccc4C(=O)O3	BroadT	BRD-A58851360	BRD-A58851360-001-05-7	Life Chemicals Inc.	F1736-0806			COC(=O)c1c(NC(=O)C2Cc3ccccc3C(=O)O2)sc2CCCCc12	InChI=1S/C20H19NO5S/c1-25-20(24)16-13-8-4-5-9-15(13)27-18(16)21-17(22)14-10-11-6-2-3-7-12(11)19(23)26-14/h2-3,6-7,14H,4-5,8-10H2,1H3,(H,21,22)	RZHQKEHUOJBXON-UHFFFAOYSA-N	385.098393408							123375
MLS000100927	LSM-34818	SID7971865, BRD-K78659179	3285954	InChI=1S/C21H26N4O5S2/c1-2-24-8-7-16-17(13-24)31-21(18(16)19(22)26)23-20(27)14-3-5-15(6-4-14)32(28,29)25-9-11-30-12-10-25/h3-6H,2,7-13H2,1H3,(H2,22,26)(H,23,27)	XNOWJSPFPQOOGL-UHFFFAOYSA-N	CCN1CCc2c(C1)sc(NC(=O)c3ccc(cc3)S(=O)(=O)N4CCOCC4)c2C(=O)N	BroadT	BRD-K78659179	BRD-K78659179-001-05-9	Life Chemicals Inc.	F0539-0397			CCN1CCc2c(C1)sc(NC(=O)c1ccc(cc1)S(=O)(=O)N1CCOCC1)c2C(N)=O	InChI=1S/C21H26N4O5S2/c1-2-24-8-7-16-17(13-24)31-21(18(16)19(22)26)23-20(27)14-3-5-15(6-4-14)32(28,29)25-9-11-30-12-10-25/h3-6H,2,7-13H2,1H3,(H2,22,26)(H,23,27)	XNOWJSPFPQOOGL-UHFFFAOYSA-N	478.134461352							123376
ZINC00366916	LSM-34819	SID47195982, BRD-K97424736	838857	InChI=1S/C13H10N2O4/c1-2-18-12(17)8-7-14-13-15(11(8)16)9-5-3-4-6-10(9)19-13/h3-7H,2H2,1H3	GXIUTNSKSHBGLA-UHFFFAOYSA-N	CCOC(=O)C1=CN=C2Oc3ccccc3N2C1=O	BroadT	BRD-K97424736	BRD-K97424736-001-06-9	Specs	AN-829/37328012			CCOC(=O)c1cnc2oc3ccccc3n2c1=O	InChI=1S/C13H10N2O4/c1-2-18-12(17)8-7-14-13-15(11(8)16)9-5-3-4-6-10(9)19-13/h3-7H,2H2,1H3	GXIUTNSKSHBGLA-UHFFFAOYSA-N	258.06405682							123377
MLS000081990	LSM-34820	SID3717850, BRD-A35275545	3000162	InChI=1S/C21H24N4O/c1-14-19(16-6-2-3-7-17(16)24-14)20(18-8-4-5-11-23-18)25-12-9-15(10-13-25)21(22)26/h2-8,11,15,20,24H,9-10,12-13H2,1H3,(H2,22,26)	FMNVUAXKHPGQSN-UHFFFAOYSA-N	Cc1[nH]c2ccccc2c1C(N3CCC(CC3)C(=O)N)c4ccccn4	BroadT	BRD-A35275545	BRD-A35275545-001-05-5	Enamine Ltd.	T0508-6889			Cc1[nH]c2ccccc2c1C(N1CCC(CC1)C(N)=O)c1ccccn1	InChI=1S/C21H24N4O/c1-14-19(16-6-2-3-7-17(16)24-14)20(18-8-4-5-11-23-18)25-12-9-15(10-13-25)21(22)26/h2-8,11,15,20,24H,9-10,12-13H2,1H3,(H2,22,26)	FMNVUAXKHPGQSN-UHFFFAOYSA-N	348.195011428							123378
MLS000063852	LSM-34821	SID4261169, SID85267420, BRD-K22079266	977208	InChI=1S/C17H19NO3/c1-11-5-7-15(19)14(8-11)18-17(20)10-21-16-9-12(2)4-6-13(16)3/h4-9,19H,10H2,1-3H3,(H,18,20)	STLMRZYEXUSEDC-UHFFFAOYSA-N	Cc1ccc(O)c(NC(=O)COc2cc(C)ccc2C)c1	BroadT	BRD-K22079266	BRD-K22079266-001-06-9	ChemBridge Corporation	7745229			Cc1ccc(O)c(NC(=O)COc2cc(C)ccc2C)c1	InChI=1S/C17H19NO3/c1-11-5-7-15(19)14(8-11)18-17(20)10-21-16-9-12(2)4-6-13(16)3/h4-9,19H,10H2,1-3H3,(H,18,20)	STLMRZYEXUSEDC-UHFFFAOYSA-N	285.136493478							123379
AK-968/15605709	LSM-34822	SID17407083, BRD-K62750255	1012378	InChI=1S/C19H16ClN3O2/c20-15-10-8-13(9-11-15)12-18(24)22-23-19(25)21-17-7-3-5-14-4-1-2-6-16(14)17/h1-11H,12H2,(H,22,24)(H2,21,23,25)	AZYXKCMLQANZFV-UHFFFAOYSA-N	Clc1ccc(CC(=O)NNC(=O)Nc2cccc3ccccc23)cc1	BroadT	BRD-K62750255	BRD-K62750255-001-05-1	Specs	AK-968/15605709			Clc1ccc(CC(=O)NNC(=O)Nc2cccc3ccccc23)cc1	InChI=1S/C19H16ClN3O2/c20-15-10-8-13(9-11-15)12-18(24)22-23-19(25)21-17-7-3-5-14-4-1-2-6-16(14)17/h1-11H,12H2,(H,22,24)(H2,21,23,25)	AZYXKCMLQANZFV-UHFFFAOYSA-N	353.093104492							123380
2,3-Dichloro-4-methoxy-n-(3-methoxypropyl)benzenesulfonamide	LSM-34823	SID4258178, BRD-K78143320	2194432	InChI=1S/C11H15Cl2NO4S/c1-17-7-3-6-14-19(15,16)9-5-4-8(18-2)10(12)11(9)13/h4-5,14H,3,6-7H2,1-2H3	BSDWKDDXEHRSJN-UHFFFAOYSA-N	COCCCNS(=O)(=O)c1ccc(OC)c(Cl)c1Cl	BroadT	BRD-K78143320	BRD-K78143320-001-05-2	ChemBridge Corporation	7609453			COCCCNS(=O)(=O)c1ccc(OC)c(Cl)c1Cl	InChI=1S/C11H15Cl2NO4S/c1-17-7-3-6-14-19(15,16)9-5-4-8(18-2)10(12)11(9)13/h4-5,14H,3,6-7H2,1-2H3	BSDWKDDXEHRSJN-UHFFFAOYSA-N	327.00988408							123381
MLS000030326	LSM-34824	SID845357, SID26668328, BRD-K00699603	647700	InChI=1S/C24H19FN6O2S/c25-18-12-10-17(11-13-18)14-30(19-6-2-1-3-7-19)23(32)16-34-24-28-27-22(33-24)15-31-21-9-5-4-8-20(21)26-29-31/h1-13H,14-16H2	LZMWKHMCXZOKLD-UHFFFAOYSA-N	Fc1ccc(CN(C(=O)CSc2oc(Cn3nnc4ccccc34)nn2)c5ccccc5)cc1	BroadT	BRD-K00699603	BRD-K00699603-001-06-2	Asinex Ltd.	ASN 04753126			Fc1ccc(CN(C(=O)CSc2nnc(Cn3nnc4ccccc34)o2)c2ccccc2)cc1	InChI=1S/C24H19FN6O2S/c25-18-12-10-17(11-13-18)14-30(19-6-2-1-3-7-19)23(32)16-34-24-28-27-22(33-24)15-31-21-9-5-4-8-20(21)26-29-31/h1-13H,14-16H2	LZMWKHMCXZOKLD-UHFFFAOYSA-N	474.127422798							123382
AC1MCGIX	LSM-34825	SID26728763, BRD-K11964654	2743341	InChI=1S/C15H23N3O3/c1-15(2,3)11-6-8-12(9-7-11)20-10-13(16)17-21-14(19)18(4)5/h6-9H,10H2,1-5H3,(H2,16,17)	HRVRYNJJISKOTJ-UHFFFAOYSA-N	CN(C)C(=O)ON=C(N)COc1ccc(cc1)C(C)(C)C	BroadT	BRD-K11964654	BRD-K11964654-001-05-7	Maybridge	SPB 00834			CN(C)C(=O)ON=C(N)COc1ccc(cc1)C(C)(C)C	InChI=1S/C15H23N3O3/c1-15(2,3)11-6-8-12(9-7-11)20-10-13(16)17-21-14(19)18(4)5/h6-9H,10H2,1-5H3,(H2,16,17)	HRVRYNJJISKOTJ-UHFFFAOYSA-N	293.173941626							123383
SMR000045762	LSM-34826	SID863614, BRD-K47050863	664863	InChI=1S/C19H14N4O2S3/c20-18-17(28(24,25)15-8-4-10-27-15)16-19(23(18)11-12-5-3-9-26-12)22-14-7-2-1-6-13(14)21-16/h1-10H,11,20H2	VPGCSZUTXPNTKT-UHFFFAOYSA-N	Nc1c(c2nc3ccccc3nc2n1Cc4cccs4)S(=O)(=O)c5cccs5	BroadT	BRD-K47050863	BRD-K47050863-001-06-8	InterBioScreen Ltd.	STOCK4S-78079			Nc1c(c2nc3ccccc3nc2n1Cc1cccs1)S(=O)(=O)c1cccs1	InChI=1S/C19H14N4O2S3/c20-18-17(28(24,25)15-8-4-10-27-15)16-19(23(18)11-12-5-3-9-26-12)22-14-7-2-1-6-13(14)21-16/h1-10H,11,20H2	VPGCSZUTXPNTKT-UHFFFAOYSA-N	426.027887798							123384
AC1MNHLV	LSM-34827	SID17516747, BRD-K21586219	3304102	InChI=1S/C12H8ClNO3S/c13-11-5-4-10(18-11)9(15)7-17-12(16)8-3-1-2-6-14-8/h1-6H,7H2	AKQCRDHWBDZILH-UHFFFAOYSA-N	Clc1ccc(s1)C(=O)COC(=O)c2ccccn2	BroadT	BRD-K21586219	BRD-K21586219-001-05-4	Enamine Ltd.	T0519-8661			Clc1ccc(s1)C(=O)COC(=O)c1ccccn1	InChI=1S/C12H8ClNO3S/c13-11-5-4-10(18-11)9(15)7-17-12(16)8-3-1-2-6-14-8/h1-6H,7H2	AKQCRDHWBDZILH-UHFFFAOYSA-N	280.991341526							123385
F1872-0554	LSM-34828	SID24409700, SID51090655, BRD-K35560380	7150995	InChI=1S/C15H15N5OS2/c1-11-18-19-14(23-11)17-13(21)10-22-15-16-7-8-20(15)9-12-5-3-2-4-6-12/h2-8H,9-10H2,1H3,(H,17,19,21)	YANVLEDCDFYZII-UHFFFAOYSA-N	Cc1nnc(NC(=O)CSc2nccn2Cc3ccccc3)s1	BroadT	BRD-K35560380	BRD-K35560380-001-05-6	Life Chemicals Inc.	F1872-0554			Cc1nnc(NC(=O)CSc2nccn2Cc2ccccc2)s1	InChI=1S/C15H15N5OS2/c1-11-18-19-14(23-11)17-13(21)10-22-15-16-7-8-20(15)9-12-5-3-2-4-6-12/h2-8H,9-10H2,1H3,(H,17,19,21)	YANVLEDCDFYZII-UHFFFAOYSA-N	345.07180153							123386
5-(Dimethylamino)-2-phenyl-1,3-oxazole-4-carbonitrile	LSM-34829	SID4245646, BRD-K40307564	3240093	InChI=1S/C12H11N3O/c1-15(2)12-10(8-13)14-11(16-12)9-6-4-3-5-7-9/h3-7H,1-2H3	YXOHQILNFAPXOO-UHFFFAOYSA-N	CN(C)c1oc(nc1C#N)c2ccccc2	BroadT	BRD-K40307564	BRD-K40307564-001-05-3	ChemDiv Inc.	1491-0950			CN(C)c1oc(nc1C#N)-c1ccccc1	InChI=1S/C12H11N3O/c1-15(2)12-10(8-13)14-11(16-12)9-6-4-3-5-7-9/h3-7H,1-2H3	YXOHQILNFAPXOO-UHFFFAOYSA-N	213.090212002							123387
T5324991	LSM-34830	SID24836204, BRD-K08105809	4967908	InChI=1S/C20H27N3O5S/c24-18(22-15-8-4-2-1-3-5-9-15)14-28-19(25)12-13-21-20-16-10-6-7-11-17(16)29(26,27)23-20/h6-7,10-11,15H,1-5,8-9,12-14H2,(H,21,23)(H,22,24)	HBPXDRUBDPGVTB-UHFFFAOYSA-N	O=C(COC(=O)CCNC1=NS(=O)(=O)c2ccccc12)NC3CCCCCCC3	BroadT	BRD-K08105809	BRD-K08105809-001-05-6	Enamine Ltd.	T5324991			O=C(COC(=O)CCNC1=NS(=O)(=O)c2ccccc12)NC1CCCCCCC1	InChI=1S/C20H27N3O5S/c24-18(22-15-8-4-2-1-3-5-9-15)14-28-19(25)12-13-21-20-16-10-6-7-11-17(16)29(26,27)23-20/h6-7,10-11,15H,1-5,8-9,12-14H2,(H,21,23)(H,22,24)	HBPXDRUBDPGVTB-UHFFFAOYSA-N	421.167141684							123388
MLS000030897	LSM-34831	SID844579, BRD-K82498852	646906	InChI=1S/C17H13ClN4OS/c18-13-7-5-12(6-8-13)10-24-17-21-20-16(23-17)9-22-11-19-14-3-1-2-4-15(14)22/h1-8,11H,9-10H2	WKLPJFOCHXMHHO-UHFFFAOYSA-N	Clc1ccc(CSc2oc(Cn3cnc4ccccc34)nn2)cc1	BroadT	BRD-K82498852	BRD-K82498852-001-05-0	Asinex Ltd.	ASN 01915828			Clc1ccc(CSc2nnc(Cn3cnc4ccccc34)o2)cc1	InChI=1S/C17H13ClN4OS/c18-13-7-5-12(6-8-13)10-24-17-21-20-16(23-17)9-22-11-19-14-3-1-2-4-15(14)22/h1-8,11H,9-10H2	WKLPJFOCHXMHHO-UHFFFAOYSA-N	356.049859476							123389
AC1MFNCZ	LSM-34832	SID47203145, BRD-A34156147	2874396	InChI=1S/C28H27NO5/c1-28(2)13-19-25-18-7-5-4-6-16(18)8-10-20(25)29-27(26(19)21(30)14-28)17-9-11-22(23(12-17)33-3)34-15-24(31)32/h4-12,27,29H,13-15H2,1-3H3,(H,31,32)	DWKIGRRXRTZSPG-UHFFFAOYSA-N	COc1cc(ccc1OCC(=O)O)C2Nc3ccc4ccccc4c3C5=C2C(=O)CC(C)(C)C5	BroadT	BRD-A34156147	BRD-A34156147-001-05-0	Asinex Ltd.	BAS 00548291			COc1cc(ccc1OCC(O)=O)C1Nc2ccc3ccccc3c2C2=C1C(=O)CC(C)(C)C2	InChI=1S/C28H27NO5/c1-28(2)13-19-25-18-7-5-4-6-16(18)8-10-20(25)29-27(26(19)21(30)14-28)17-9-11-22(23(12-17)33-3)34-15-24(31)32/h4-12,27,29H,13-15H2,1-3H3,(H,31,32)	DWKIGRRXRTZSPG-UHFFFAOYSA-N	457.188922974							123390
5-Nitro-6-(3-nitrophenyl)piperidin-2-one	LSM-34833	SID24785475, BRD-A29114023	5130978	InChI=1S/C11H11N3O5/c15-10-5-4-9(14(18)19)11(12-10)7-2-1-3-8(6-7)13(16)17/h1-3,6,9,11H,4-5H2,(H,12,15)	HNPKDEDJNOBPTB-UHFFFAOYSA-N	[O-][N+](=O)C1CCC(=O)NC1c2cccc(c2)[N+](=O)[O-]	BroadT	BRD-A29114023	BRD-A29114023-001-05-5	ChemDiv Inc.	5991-0184			[O-][N+](=O)C1CCC(=O)NC1c1cccc(c1)[N+]([O-])=O	InChI=1S/C11H11N3O5/c15-10-5-4-9(14(18)19)11(12-10)7-2-1-3-8(6-7)13(16)17/h1-3,6,9,11H,4-5H2,(H,12,15)	HNPKDEDJNOBPTB-UHFFFAOYSA-N	265.069870482							123391
MLS000551235	LSM-34834	SID14742538, BRD-K28979265	4552534	InChI=1S/C18H25N5O2S/c1-18(2)8-11(19-7-5-6-13(24)25)15-12(9-18)22-14-16(23(3)4)20-10-21-17(14)26-15/h10,19H,5-9H2,1-4H3,(H,24,25)	WSFNMZBBWZWOCD-UHFFFAOYSA-N	CN(C)c1ncnc2SC3=C(CC(C)(C)CC3=Nc12)NCCCC(=O)O	BroadT	BRD-K28979265	BRD-K28979265-001-06-5	InterBioScreen Ltd.	STOCK1S-57365			CN(C)c1ncnc2SC3=C(CC(C)(C)CC3=Nc12)NCCCC(O)=O	InChI=1S/C18H25N5O2S/c1-18(2)8-11(19-7-5-6-13(24)25)15-12(9-18)22-14-16(23(3)4)20-10-21-17(14)26-15/h10,19H,5-9H2,1-4H3,(H,24,25)	WSFNMZBBWZWOCD-UHFFFAOYSA-N	375.17289578							123392
4-Chloro-n-(1,2-dimethyl-1H-benzoimidazol-5-yl)-benzamide	LSM-34835	SID49642316, BRD-K27123305	949216	InChI=1S/C16H14ClN3O/c1-10-18-14-9-13(7-8-15(14)20(10)2)19-16(21)11-3-5-12(17)6-4-11/h3-9H,1-2H3,(H,19,21)	GNKUAHZWKXWCJQ-UHFFFAOYSA-N	Cc1nc2cc(NC(=O)c3ccc(Cl)cc3)ccc2n1C	BroadT	BRD-K27123305	BRD-K27123305-001-05-5	Asinex Ltd.	BAS 05022401			Cc1nc2cc(NC(=O)c3ccc(Cl)cc3)ccc2n1C	InChI=1S/C16H14ClN3O/c1-10-18-14-9-13(7-8-15(14)20(10)2)19-16(21)11-3-5-12(17)6-4-11/h3-9H,1-2H3,(H,19,21)	GNKUAHZWKXWCJQ-UHFFFAOYSA-N	299.082539808							123393
AC1O9VJB	LSM-34836	SID26660410, BRD-K20234911	6774983	InChI=1S/C20H21N3O2/c1-12-4-6-15(7-5-12)11-21-20(25)18-10-17(22-23-18)16-9-13(2)8-14(3)19(16)24/h4-10,24H,11H2,1-3H3,(H,21,25)(H,22,23)	XCYGMOCSLBGADA-UHFFFAOYSA-N	Cc1ccc(CNC(=O)c2cc([nH]n2)c3cc(C)cc(C)c3O)cc1	BroadT	BRD-K20234911	BRD-K20234911-001-05-3	InterBioScreen Ltd.	STOCK5S-54079			Cc1ccc(CNC(=O)c2cc([nH]n2)-c2cc(C)cc(C)c2O)cc1	InChI=1S/C20H21N3O2/c1-12-4-6-15(7-5-12)11-21-20(25)18-10-17(22-23-18)16-9-13(2)8-14(3)19(16)24/h4-10,24H,11H2,1-3H3,(H,21,25)(H,22,23)	XCYGMOCSLBGADA-UHFFFAOYSA-N	335.163376942							
MLS001033025	LSM-44521	SID24834038, BRD-K52186758	2370673	InChI=1S/C17H17NO4/c1-18(12-14-6-3-2-4-7-14)16(19)13-22-17(20)10-9-15-8-5-11-21-15/h2-11H,12-13H2,1H3/b10-9+	GVQCLYXAXQEALH-MDZDMXLPSA-N	CN(Cc1ccccc1)C(=O)COC(=O)\C=C\c2occc2	BroadT	BRD-K52186758	BRD-K52186758-001-05-2	Enamine Ltd.	T0511-9535			CN(Cc1ccccc1)C(=O)COC(=O)\C=C\c1ccco1	InChI=1S/C17H17NO4/c1-18(12-14-6-3-2-4-7-14)16(19)13-22-17(20)10-9-15-8-5-11-21-15/h2-11H,12-13H2,1H3/b10-9+	GVQCLYXAXQEALH-MDZDMXLPSA-N	299.115758034							
AP-064/41684749	LSM-34838	SID4258834, BRD-K49416011	1081839	InChI=1S/C20H17ClN2O4/c1-2-26-17-7-4-3-6-16(17)23-19(24)14-12-13(21)9-10-15(14)22-20(25)18-8-5-11-27-18/h3-12H,2H2,1H3,(H,22,25)(H,23,24)	SKCLVNTZOWQSMK-UHFFFAOYSA-N	CCOc1ccccc1NC(=O)c2cc(Cl)ccc2NC(=O)c3occc3	BroadT	BRD-K49416011	BRD-K49416011-001-05-2	ChemBridge Corporation	7504561			CCOc1ccccc1NC(=O)c1cc(Cl)ccc1NC(=O)c1ccco1	InChI=1S/C20H17ClN2O4/c1-2-26-17-7-4-3-6-16(17)23-19(24)14-12-13(21)9-10-15(14)22-20(25)18-8-5-11-27-18/h3-12H,2H2,1H3,(H,22,25)(H,23,24)	SKCLVNTZOWQSMK-UHFFFAOYSA-N	384.087684754							123396
SMR000150188	LSM-34839	SID16953274, BRD-K47171976	2439838	InChI=1S/C26H24N2O5/c1-17-9-10-23(31-2)22(12-17)28-26(30)21-13-18-6-3-4-7-19(18)14-24(21)33-16-25(29)27-15-20-8-5-11-32-20/h3-14H,15-16H2,1-2H3,(H,27,29)(H,28,30)	VQJVQZOWXREMCW-UHFFFAOYSA-N	COc1ccc(C)cc1NC(=O)c2cc3ccccc3cc2OCC(=O)NCc4occc4	BroadT	BRD-K47171976	BRD-K47171976-001-05-8	Enamine Ltd.	T0516-9850			COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCC(=O)NCc1ccco1	InChI=1S/C26H24N2O5/c1-17-9-10-23(31-2)22(12-17)28-26(30)21-13-18-6-3-4-7-19(18)14-24(21)33-16-25(29)27-15-20-8-5-11-32-20/h3-14H,15-16H2,1-2H3,(H,27,29)(H,28,30)	VQJVQZOWXREMCW-UHFFFAOYSA-N	444.168521888							123397
ZINC00859180	LSM-34840	SID17403349, BRD-K36924889	1121556	InChI=1S/C21H18N2O2S/c1-13-6-8-14(9-7-13)17(11-22)20-23-18(12-26-20)16-10-15-4-2-3-5-19(15)25-21(16)24/h2-5,10,12-13H,6-9H2,1H3	GUOSVWHMHFUXPT-UHFFFAOYSA-N	CC1CCC(=C(C#N)c2nc(cs2)C3=Cc4ccccc4OC3=O)CC1	BroadT	BRD-K36924889	BRD-K36924889-001-06-7	Asinex Ltd.	BAS 01369599			CC1CCC(CC1)=C(C#N)c1nc(cs1)-c1cc2ccccc2oc1=O	InChI=1S/C21H18N2O2S/c1-13-6-8-14(9-7-13)17(11-22)20-23-18(12-26-20)16-10-15-4-2-3-5-19(15)25-21(16)24/h2-5,10,12-13H,6-9H2,1H3	GUOSVWHMHFUXPT-UHFFFAOYSA-N	362.108898526							
BAS 01171233	LSM-34841	SID850664, BRD-K78865413	653194	InChI=1S/C13H14N4O4/c1-7-4-3-5-8(2)10(7)15-9(18)6-20-13(19)11-12(14)17-21-16-11/h3-5H,6H2,1-2H3,(H2,14,17)(H,15,18)	OBUYGPOVKSSWCJ-UHFFFAOYSA-N	Cc1cccc(C)c1NC(=O)COC(=O)c2nonc2N	BroadT	BRD-K78865413	BRD-K78865413-001-05-8	Asinex Ltd.	BAS 01171233			Cc1cccc(C)c1NC(=O)COC(=O)c1nonc1N	InChI=1S/C13H14N4O4/c1-7-4-3-5-8(2)10(7)15-9(18)6-20-13(19)11-12(14)17-21-16-11/h3-5H,6H2,1-2H3,(H2,14,17)(H,15,18)	OBUYGPOVKSSWCJ-UHFFFAOYSA-N	290.101504968							123399
BDBM55068	LSM-34842	BRD-A60010026	91897206	InChI=1S/C25H25NO6/c1-3-4-13-30-18-10-8-17(9-11-18)22-21(23(27)20-12-7-16(2)32-20)24(28)25(29)26(22)15-19-6-5-14-31-19/h5-12,14,21-22H,3-4,13,15H2,1-2H3	ZUYSDPGBHGKERN-UHFFFAOYSA-N	CCCCOc1ccc(cc1)C2C(C(=O)c3oc(C)cc3)C(=O)C(=O)N2Cc4occc4	BroadT	BRD-A60010026	BRD-A60010026-001-06-0	Specs	AF-399/41900999			CCCCOc1ccc(cc1)C1C(C(=O)c2ccc(C)o2)C(=O)C(=O)N1Cc1ccco1	InChI=1S/C25H25NO6/c1-3-4-13-30-18-10-8-17(9-11-18)22-21(23(27)20-12-7-16(2)32-20)24(28)25(29)26(22)15-19-6-5-14-31-19/h5-12,14,21-22H,3-4,13,15H2,1-2H3	ZUYSDPGBHGKERN-UHFFFAOYSA-N	435.16818753							123400
MLS-0310259.0001	LSM-44522	SID24784813, SID87544492, BRD-K56458402	1356906	InChI=1S/C21H20N2O4S2/c1-27-17-10-4-14(5-11-17)13-18-20(26)23(21(28)29-18)12-2-3-19(25)22-15-6-8-16(24)9-7-15/h4-11,13,24H,2-3,12H2,1H3,(H,22,25)/b18-13+	OERXBCCROVVZJG-QGOAFFKASA-N	COc1ccc(\C=C/2\SC(=S)N(CCCC(=O)Nc3ccc(O)cc3)C2=O)cc1	BroadT	BRD-K56458402	BRD-K56458402-001-05-1	Asinex Ltd.	BAS 00779180			COc1ccc(\C=C2\SC(=S)N(CCCC(=O)Nc3ccc(O)cc3)C2=O)cc1	InChI=1S/C21H20N2O4S2/c1-27-17-10-4-14(5-11-17)13-18-20(26)23(21(28)29-18)12-2-3-19(25)22-15-6-8-16(24)9-7-15/h4-11,13,24H,2-3,12H2,1H3,(H,22,25)/b18-13+	OERXBCCROVVZJG-QGOAFFKASA-N	428.08644852							
BRD-A73647558	LSM-34844			InChI=1S/C28H29N3O5/c1-28(2)13-18-23(19(32)14-28)22(17-10-11-20(35-3)21(12-17)36-4)24-25(29-18)31(27(34)30-26(24)33)15-16-8-6-5-7-9-16/h5-12,22-23H,13-15H2,1-4H3,(H,30,33,34)	GQFNSLCDWJCOPM-UHFFFAOYSA-N	COc1ccc(cc1OC)C2C3C(=O)CC(C)(C)CC3=NC4=C2C(=O)NC(=O)N4Cc5ccccc5	BroadT	BRD-A73647558	BRD-A73647558-001-05-2	ChemBridge Corporation	7452498			COc1ccc(cc1OC)C1C2C(=O)CC(C)(C)CC2=Nc2c1c(=O)[nH]c(=O)n2Cc1ccccc1	InChI=1S/C28H29N3O5/c1-28(2)13-18-23(19(32)14-28)22(17-10-11-20(35-3)21(12-17)36-4)24-25(29-18)31(27(34)30-26(24)33)15-16-8-6-5-7-9-16/h5-12,22-23H,13-15H2,1-4H3,(H,30,33,34)	GQFNSLCDWJCOPM-UHFFFAOYSA-N	487.210721058							123402
T0520-4945	LSM-34845	SID24837318, BRD-K96435577	3449510	InChI=1S/C20H21F3N2O7S/c1-3-25(4-2)33(29,30)15-9-10-17(26)16(11-15)19(28)31-12-18(27)24-13-5-7-14(8-6-13)32-20(21,22)23/h5-11,26H,3-4,12H2,1-2H3,(H,24,27)	DTZCKVUONCWFFC-UHFFFAOYSA-N	CCN(CC)S(=O)(=O)c1ccc(O)c(c1)C(=O)OCC(=O)Nc2ccc(OC(F)(F)F)cc2	BroadT	BRD-K96435577	BRD-K96435577-001-05-0	Enamine Ltd.	T0520-4945			CCN(CC)S(=O)(=O)c1ccc(O)c(c1)C(=O)OCC(=O)Nc1ccc(OC(F)(F)F)cc1	InChI=1S/C20H21F3N2O7S/c1-3-25(4-2)33(29,30)15-9-10-17(26)16(11-15)19(28)31-12-18(27)24-13-5-7-14(8-6-13)32-20(21,22)23/h5-11,26H,3-4,12H2,1-2H3,(H,24,27)	DTZCKVUONCWFFC-UHFFFAOYSA-N	490.102156322							123403
1-(4,6-Dimethylpyrimidin-2-yl)piperidine-4-carboxylic acid	LSM-34846	SID853159, BRD-K78487581	655810	InChI=1S/C12H17N3O2/c1-8-7-9(2)14-12(13-8)15-5-3-10(4-6-15)11(16)17/h7,10H,3-6H2,1-2H3,(H,16,17)	HKGJIAQYOSHPHU-UHFFFAOYSA-N	Cc1cc(C)nc(n1)N2CCC(CC2)C(=O)O	BroadT	BRD-K78487581	BRD-K78487581-001-05-7	Asinex Ltd.	BAS 07441664			Cc1cc(C)nc(n1)N1CCC(CC1)C(O)=O	InChI=1S/C12H17N3O2/c1-8-7-9(2)14-12(13-8)15-5-3-10(4-6-15)11(16)17/h7,10H,3-6H2,1-2H3,(H,16,17)	HKGJIAQYOSHPHU-UHFFFAOYSA-N	235.132076814							123404
ST50835223	LSM-34847	SID49827066, BRD-K86045340	3861140	InChI=1S/C19H26N2O2S/c1-22-16-4-3-15(8-17(16)23-2)20-18(24)21-19-9-12-5-13(10-19)7-14(6-12)11-19/h3-4,8,12-14H,5-7,9-11H2,1-2H3,(H2,20,21,24)	NESZUUSZWXHIBH-UHFFFAOYSA-N	COc1ccc(NC(=NC23CC4CC(CC(C4)C2)C3)S)cc1OC	BroadT	BRD-K86045340	BRD-K86045340-001-05-5	Chemical Technologies & Investigations	AMNCS-45137			COc1ccc(NC(S)=NC23CC4CC(CC(C4)C2)C3)cc1OC	InChI=1S/C19H26N2O2S/c1-22-16-4-3-15(8-17(16)23-2)20-18(24)21-19-9-12-5-13(10-19)7-14(6-12)11-19/h3-4,8,12-14H,5-7,9-11H2,1-2H3,(H2,20,21,24)	NESZUUSZWXHIBH-UHFFFAOYSA-N	346.171498782							123405
MLS000107960	LSM-34848	SID7977705, BRD-A60640164	2862450	InChI=1S/C16H19NO5/c18-15(11-3-1-2-4-12(11)16(19)20)17-10-5-6-13-14(9-10)22-8-7-21-13/h5-6,9,11-12H,1-4,7-8H2,(H,17,18)(H,19,20)	LWYYYWNLCLHWQV-UHFFFAOYSA-N	OC(=O)C1CCCCC1C(=O)Nc2ccc3OCCOc3c2	BroadT	BRD-A60640164	BRD-A60640164-001-06-6	ChemBridge Corporation	5692729			OC(=O)C1CCCCC1C(=O)Nc1ccc2OCCOc2c1	InChI=1S/C16H19NO5/c18-15(11-3-1-2-4-12(11)16(19)20)17-10-5-6-13-14(9-10)22-8-7-21-13/h5-6,9,11-12H,1-4,7-8H2,(H,17,18)(H,19,20)	LWYYYWNLCLHWQV-UHFFFAOYSA-N	305.126322718							123406
AG-205/37107180	LSM-34849	SID7977936, BRD-A38548216	2855196	InChI=1S/C21H22N2O6/c1-12-18(20(25)29-11-13-4-7-15(27-2)8-5-13)19(23-21(26)22-12)14-6-9-16(24)17(10-14)28-3/h4-10,19,24H,11H2,1-3H3,(H2,22,23,26)	ITNSGLCHRFJDOV-UHFFFAOYSA-N	COc1ccc(COC(=O)C2=C(C)NC(=O)NC2c3ccc(O)c(OC)c3)cc1	BroadT	BRD-A38548216	BRD-A38548216-001-06-8	ChemBridge Corporation	5609586			COc1ccc(COC(=O)C2=C(C)NC(=O)NC2c2ccc(O)c(OC)c2)cc1	InChI=1S/C21H22N2O6/c1-12-18(20(25)29-11-13-4-7-15(27-2)8-5-13)19(23-21(26)22-12)14-6-9-16(24)17(10-14)28-3/h4-10,19,24H,11H2,1-3H3,(H2,22,23,26)	ITNSGLCHRFJDOV-UHFFFAOYSA-N	398.147786444							123407
MLS000556394	LSM-34850	SID14741180, BRD-K72326510	951060	InChI=1S/C16H14N2O5/c1-21-15(19)11-4-2-3-5-12(11)18-16(20)17-10-6-7-13-14(8-10)23-9-22-13/h2-8H,9H2,1H3,(H2,17,18,20)	SEOQVRQVJFXJGL-UHFFFAOYSA-N	COC(=O)c1ccccc1NC(=O)Nc2ccc3OCOc3c2	BroadT	BRD-K72326510	BRD-K72326510-001-08-3	InterBioScreen Ltd.	STOCK3S-60176			COC(=O)c1ccccc1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C16H14N2O5/c1-21-15(19)11-4-2-3-5-12(11)18-16(20)17-10-6-7-13-14(8-10)23-9-22-13/h2-8H,9H2,1H3,(H2,17,18,20)	SEOQVRQVJFXJGL-UHFFFAOYSA-N	314.090271568							123408
N-(Furan-2-ylmethyl)-5-methyl-4-phenylthiophene-3-carboxamide	LSM-34851	SID4254461, BRD-K73391494	1245893	InChI=1S/C17H15NO2S/c1-12-16(13-6-3-2-4-7-13)15(11-21-12)17(19)18-10-14-8-5-9-20-14/h2-9,11H,10H2,1H3,(H,18,19)	JQEFTCJFMFNWAJ-UHFFFAOYSA-N	Cc1scc(C(=O)NCc2occc2)c1c3ccccc3	BroadT	BRD-K73391494	BRD-K73391494-001-05-2	ChemBridge Corporation	7945948			Cc1scc(C(=O)NCc2ccco2)c1-c1ccccc1	InChI=1S/C17H15NO2S/c1-12-16(13-6-3-2-4-7-13)15(11-21-12)17(19)18-10-14-8-5-9-20-14/h2-9,11H,10H2,1H3,(H,18,19)	JQEFTCJFMFNWAJ-UHFFFAOYSA-N	297.08234942							123409
AC1NKLYM	LSM-34852	SID7970014, BRD-K11992975	4890354	InChI=1S/C25H28N6O4/c1-17-7-4-5-8-18(17)15-31-20(26-22-21(31)24(33)28(3)25(34)27(22)2)16-29-10-12-30(13-11-29)23(32)19-9-6-14-35-19/h4-9,14H,10-13,15-16H2,1-3H3	YVUYRLYPJGYXHU-UHFFFAOYSA-N	CN1C(=O)N(C)c2nc(CN3CCN(CC3)C(=O)c4occc4)n(Cc5ccccc5C)c2C1=O	BroadT	BRD-K11992975	BRD-K11992975-001-05-0	Life Chemicals Inc.	F0634-0190			Cc1ccccc1Cn1c(CN2CCN(CC2)C(=O)c2ccco2)nc2n(C)c(=O)n(C)c(=O)c12	InChI=1S/C25H28N6O4/c1-17-7-4-5-8-18(17)15-31-20(26-22-21(31)24(33)28(3)25(34)27(22)2)16-29-10-12-30(13-11-29)23(32)19-9-6-14-35-19/h4-9,14H,10-13,15-16H2,1-3H3	YVUYRLYPJGYXHU-UHFFFAOYSA-N	476.217203436							123410
AC1MZ2Y8	LSM-34853	BRD-K71678381	3891644	InChI=1S/C12H10ClN3/c13-11-2-1-3-12(8-11)16-15-9-10-4-6-14-7-5-10/h1-9,16H	XUFFHMYGXVOKDB-UHFFFAOYSA-N	Clc1cccc(NN=Cc2ccncc2)c1	BroadT	BRD-K71678381	BRD-K71678381-001-06-8	ChemDiv Inc.	K072-0098			Clc1cccc(NN=Cc2ccncc2)c1	InChI=1S/C12H10ClN3/c13-11-2-1-3-12(8-11)16-15-9-10-4-6-14-7-5-10/h1-9,16H	XUFFHMYGXVOKDB-UHFFFAOYSA-N	231.05632506							123411
SMR000199717	LSM-34854	SID17414296, BRD-K48276916	2204777	InChI=1S/C17H21N3OS2/c1-3-14-12(2)23-11-15(14)16(21)19-20-17(22)18-10-9-13-7-5-4-6-8-13/h4-8,11H,3,9-10H2,1-2H3,(H,19,21)(H2,18,20,22)	SXBJYYWZXKGNLH-UHFFFAOYSA-N	CCc1c(C)scc1C(=O)NN=C(S)NCCc2ccccc2	BroadT	BRD-K48276916	BRD-K48276916-001-05-7	ChemBridge Corporation	7784295			CCc1c(C)scc1C(=O)NN=C(S)NCCc1ccccc1	InChI=1S/C17H21N3OS2/c1-3-14-12(2)23-11-15(14)16(21)19-20-17(22)18-10-9-13-7-5-4-6-8-13/h4-8,11H,3,9-10H2,1-2H3,(H,19,21)(H2,18,20,22)	SXBJYYWZXKGNLH-UHFFFAOYSA-N	347.112603702							123412
N-[(5-Chloro-2,1,3-benzothiadiazol-4-yl)carbamothioyl]furan-2-carboxamide	LSM-34855	SID17505624, BRD-K95869084	1839395	InChI=1S/C12H7ClN4O2S2/c13-6-3-4-7-10(17-21-16-7)9(6)14-12(20)15-11(18)8-2-1-5-19-8/h1-5H,(H2,14,15,18,20)	OQXWYEIXTWDOGX-UHFFFAOYSA-N	Clc1ccc2nsnc2c1NC(=S)NC(=O)c3occc3	BroadT	BRD-K95869084	BRD-K95869084-001-05-7	InterBioScreen Ltd.	STOCK5S-34540			Clc1ccc2nsnc2c1NC(=S)NC(=O)c1ccco1	InChI=1S/C12H7ClN4O2S2/c13-6-3-4-7-10(17-21-16-7)9(6)14-12(20)15-11(18)8-2-1-5-19-8/h1-5H,(H2,14,15,18,20)	OQXWYEIXTWDOGX-UHFFFAOYSA-N	337.969894594							123413
MLS000070329	LSM-34856	SID853431, BRD-K50219394	656090	InChI=1S/C15H18N2O3S/c1-9(2)20-14(19)6-12(18)8-21-15-13(7-16)10(3)5-11(4)17-15/h5,9H,6,8H2,1-4H3	OKMAODFZGKOCAH-UHFFFAOYSA-N	CC(C)OC(=O)CC(=O)CSc1nc(C)cc(C)c1C#N	BroadT	BRD-K50219394	BRD-K50219394-001-05-3	Asinex Ltd.	BAS 01107825			CC(C)OC(=O)CC(=O)CSc1nc(C)cc(C)c1C#N	InChI=1S/C15H18N2O3S/c1-9(2)20-14(19)6-12(18)8-21-15-13(7-16)10(3)5-11(4)17-15/h5,9H,6,8H2,1-4H3	OKMAODFZGKOCAH-UHFFFAOYSA-N	306.103813146							123414
2-Ethoxy-n-(2-hydroxyphenyl)benzamide	LSM-34857	SID4259146, BRD-K20918360	836564	InChI=1S/C15H15NO3/c1-2-19-14-10-6-3-7-11(14)15(18)16-12-8-4-5-9-13(12)17/h3-10,17H,2H2,1H3,(H,16,18)	IRLUOHGSVLDVLW-UHFFFAOYSA-N	CCOc1ccccc1C(=O)Nc2ccccc2O	BroadT	BRD-K20918360	BRD-K20918360-001-05-7	ChemBridge Corporation	7779787			CCOc1ccccc1C(=O)Nc1ccccc1O	InChI=1S/C15H15NO3/c1-2-19-14-10-6-3-7-11(14)15(18)16-12-8-4-5-9-13(12)17/h3-10,17H,2H2,1H3,(H,16,18)	IRLUOHGSVLDVLW-UHFFFAOYSA-N	257.10519335							123415
SMR000102781	LSM-34858	SID7978069, BRD-K42019392	747731	InChI=1S/C15H15N3O3S/c1-2-21-14(20)11-8-17-15(18-13(11)16)22-9-12(19)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H2,16,17,18)	KVJQVOWSLKHYOA-UHFFFAOYSA-N	CCOC(=O)c1cnc(SCC(=O)c2ccccc2)nc1N	BroadT	BRD-K42019392	BRD-K42019392-001-06-8	ChemBridge Corporation	5193621			CCOC(=O)c1cnc(SCC(=O)c2ccccc2)nc1N	InChI=1S/C15H15N3O3S/c1-2-21-14(20)11-8-17-15(18-13(11)16)22-9-12(19)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H2,16,17,18)	KVJQVOWSLKHYOA-UHFFFAOYSA-N	317.08341206							123416
AC1MELUG	LSM-34859	SID49826933, BRD-A61437901	2905407	InChI=1S/C15H17N3O5S2/c1-3-4-10(2)14(19)17-15-16-9-13(24-15)25(22,23)12-7-5-11(6-8-12)18(20)21/h5-10H,3-4H2,1-2H3,(H,16,17,19)	WEEIACNYUMMZHT-UHFFFAOYSA-N	CCCC(C)C(=O)Nc1ncc(s1)S(=O)(=O)c2ccc(cc2)[N+](=O)[O-]	BroadT	BRD-A61437901	BRD-A61437901-001-06-4	ChemBridge Corporation	6612987			CCCC(C)C(=O)Nc1ncc(s1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O	InChI=1S/C15H17N3O5S2/c1-3-4-10(2)14(19)17-15-16-9-13(24-15)25(22,23)12-7-5-11(6-8-12)18(20)21/h5-10H,3-4H2,1-2H3,(H,16,17,19)	WEEIACNYUMMZHT-UHFFFAOYSA-N	383.060962054							123417
AC1MH89Z	LSM-34860	BRD-K05696087	2997861	InChI=1S/C21H24N2O6S/c1-3-29-20(25)13-19-23(14-18(24)22-8-10-28-11-9-22)21(26)17(30-19)12-15-6-4-5-7-16(15)27-2/h4-7,12-13H,3,8-11,14H2,1-2H3	PQNJBECFPBDTKM-UHFFFAOYSA-N	CCOC(=O)C=C1SC(=Cc2ccccc2OC)C(=O)N1CC(=O)N3CCOCC3	BroadT	BRD-K05696087	BRD-K05696087-001-05-0	Enamine Ltd.	T5240337			CCOC(=O)C=c1sc(=Cc2ccccc2OC)c(=O)n1CC(=O)N1CCOCC1	InChI=1S/C21H24N2O6S/c1-3-29-20(25)13-19-23(14-18(24)22-8-10-28-11-9-22)21(26)17(30-19)12-15-6-4-5-7-16(15)27-2/h4-7,12-13H,3,8-11,14H2,1-2H3	PQNJBECFPBDTKM-UHFFFAOYSA-N	432.135507198							123418
(1-Benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-furan-2-ylmethyl-amine	LSM-34861	SID848745, BRD-K12166247	651202	InChI=1S/C17H15N5O/c1-2-5-13(6-3-1)11-22-17-15(10-21-22)16(19-12-20-17)18-9-14-7-4-8-23-14/h1-8,10,12H,9,11H2,(H,18,19,20)	JMAQRWJDTVOWEA-UHFFFAOYSA-N	C(Nc1ncnc2c1cnn2Cc3ccccc3)c4occc4	BroadT	BRD-K12166247	BRD-K12166247-001-05-2	Asinex Ltd.	BAS 02224735			C(Nc1ncnc2n(Cc3ccccc3)ncc12)c1ccco1	InChI=1S/C17H15N5O/c1-2-5-13(6-3-1)11-22-17-15(10-21-22)16(19-12-20-17)18-9-14-7-4-8-23-14/h1-8,10,12H,9,11H2,(H,18,19,20)	JMAQRWJDTVOWEA-UHFFFAOYSA-N	305.12766015							123419
SMR000127857	LSM-34862	SID14732242, BRD-K26322171	6619633	InChI=1S/C21H18N2O2/c1-13-7-9-15(10-8-13)12-22-21(24)19-11-17-14(2)23-18-6-4-3-5-16(18)20(17)25-19/h3-11H,12H2,1-2H3,(H,22,24)	AASCFXUFOVMIDS-UHFFFAOYSA-N	Cc1ccc(CNC(=O)c2oc3c4ccccc4nc(C)c3c2)cc1	BroadT	BRD-K26322171	BRD-K26322171-001-05-5	ChemDiv Inc.	C629-0207			Cc1ccc(CNC(=O)c2cc3c(C)nc4ccccc4c3o2)cc1	InChI=1S/C21H18N2O2/c1-13-7-9-15(10-8-13)12-22-21(24)19-11-17-14(2)23-18-6-4-3-5-16(18)20(17)25-19/h3-11H,12H2,1-2H3,(H,22,24)	AASCFXUFOVMIDS-UHFFFAOYSA-N	330.136827836							123420
MLS000879426	LSM-34863	SID26732115, BRD-A72105556	16746299	InChI=1S/C32H34N2O6/c1-21-17-29(35)40-32-30(21)27(36-2)19-28(37-3)31(32)24(22-9-10-25-26(18-22)39-20-38-25)11-12-33-13-15-34(16-14-33)23-7-5-4-6-8-23/h4-10,17-19,24H,11-16,20H2,1-3H3	RUGOEWKUIVRDKO-UHFFFAOYSA-N	COc1cc(OC)c2C(=CC(=O)Oc2c1C(CCN3CCN(CC3)c4ccccc4)c5ccc6OCOc6c5)C	BroadT	BRD-A72105556	BRD-A72105556-001-05-4	University of Kansas CMLD	KUC101566N			COc1cc(OC)c2c(C)cc(=O)oc2c1C(CCN1CCN(CC1)c1ccccc1)c1ccc2OCOc2c1	InChI=1S/C32H34N2O6/c1-21-17-29(35)40-32-30(21)27(36-2)19-28(37-3)31(32)24(22-9-10-25-26(18-22)39-20-38-25)11-12-33-13-15-34(16-14-33)23-7-5-4-6-8-23/h4-10,17-19,24H,11-16,20H2,1-3H3	RUGOEWKUIVRDKO-UHFFFAOYSA-N	542.241686828							123421
AC1LYIX0	LSM-34864	BRD-K24916595	1925867	InChI=1S/C19H15N3O4/c23-19(12-14-4-2-1-3-5-14)21-20-13-17-10-11-18(26-17)15-6-8-16(9-7-15)22(24)25/h1-11,13H,12H2,(H,21,23)	MMRCYJSCKXDLSJ-UHFFFAOYSA-N	[O-][N+](=O)c1ccc(cc1)c2oc(C=NNC(=O)Cc3ccccc3)cc2	BroadT	BRD-K24916595	BRD-K24916595-001-05-4	Asinex Ltd.	BAS 01850160			[O-][N+](=O)c1ccc(cc1)-c1ccc(C=NNC(=O)Cc2ccccc2)o1	InChI=1S/C19H15N3O4/c23-19(12-14-4-2-1-3-5-14)21-20-13-17-10-11-18(26-17)15-6-8-16(9-7-15)22(24)25/h1-11,13H,12H2,(H,21,23)	MMRCYJSCKXDLSJ-UHFFFAOYSA-N	349.10625599							123422
ST50853027	LSM-34865	SID24798290, BRD-K89988457	970268	InChI=1S/C16H16N2O4/c1-21-14-9-7-13(8-10-14)18-16(20)17-12-5-3-11(4-6-12)15(19)22-2/h3-10H,1-2H3,(H2,17,18,20)	FMONKRKYOKEDQX-UHFFFAOYSA-N	COC(=O)c1ccc(NC(=O)Nc2ccc(OC)cc2)cc1	BroadT	BRD-K89988457	BRD-K89988457-001-05-2	ChemBridge Corporation	7796209			COC(=O)c1ccc(NC(=O)Nc2ccc(OC)cc2)cc1	InChI=1S/C16H16N2O4/c1-21-14-9-7-13(8-10-14)18-16(20)17-12-5-3-11(4-6-12)15(19)22-2/h3-10H,1-2H3,(H2,17,18,20)	FMONKRKYOKEDQX-UHFFFAOYSA-N	300.111007012							123423
AC1LDAUF	LSM-34866	SID842889, BRD-A50011428	645162	InChI=1S/C17H22N4O3S/c1-4-12(2)21(17(23)15-11-25-20-19-15)10-16(22)18-9-13-5-7-14(24-3)8-6-13/h5-8,11-12H,4,9-10H2,1-3H3,(H,18,22)	CFAQSQUURJCGNX-UHFFFAOYSA-N	CCC(C)N(CC(=O)NCc1ccc(OC)cc1)C(=O)c2csnn2	BroadT	BRD-A50011428	BRD-A50011428-001-05-6	Asinex Ltd.	ASN 06568508			CCC(C)N(CC(=O)NCc1ccc(OC)cc1)C(=O)c1csnn1	InChI=1S/C17H22N4O3S/c1-4-12(2)21(17(23)15-11-25-20-19-15)10-16(22)18-9-13-5-7-14(24-3)8-6-13/h5-8,11-12H,4,9-10H2,1-3H3,(H,18,22)	CFAQSQUURJCGNX-UHFFFAOYSA-N	362.141261294							123424
5-[(2-Chlorobenzyl)amino]-2-(4-methoxyphenyl)-1,3-oxazole-4-carbonitrile	LSM-34867	SID4265818, BRD-K84496741	891780	InChI=1S/C18H14ClN3O2/c1-23-14-8-6-12(7-9-14)17-22-16(10-20)18(24-17)21-11-13-4-2-3-5-15(13)19/h2-9,21H,11H2,1H3	VCBWJDWXAWWSMM-UHFFFAOYSA-N	COc1ccc(cc1)c2oc(NCc3ccccc3Cl)c(n2)C#N	BroadT	BRD-K84496741	BRD-K84496741-001-05-7	ChemBridge Corporation	7498921			COc1ccc(cc1)-c1nc(C#N)c(NCc2ccccc2Cl)o1	InChI=1S/C18H14ClN3O2/c1-23-14-8-6-12(7-9-14)17-22-16(10-20)18(24-17)21-11-13-4-2-3-5-15(13)19/h2-9,21H,11H2,1H3	VCBWJDWXAWWSMM-UHFFFAOYSA-N	339.077454428							123425
MLS000517420	LSM-44523	SID24827799, BRD-K48496310	2101434	InChI=1S/C19H16N4O7S2/c1-32(29,30)16-5-4-13(10-14(16)23(27)28)17(24)21-7-8-22-18(25)15(31-19(22)26)9-12-3-2-6-20-11-12/h2-6,9-11H,7-8H2,1H3,(H,21,24)/b15-9-	GIMQNYKJMCNDAX-DHDCSXOGSA-N	CS(=O)(=O)c1ccc(cc1[N+](=O)[O-])C(=O)NCCN2C(=O)S\C(=C/c3cccnc3)\C2=O	BroadT	BRD-K48496310	BRD-K48496310-001-05-3	Enamine Ltd.	T5265742			CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCN1C(=O)S\C(=C/c2cccnc2)C1=O	InChI=1S/C19H16N4O7S2/c1-32(29,30)16-5-4-13(10-14(16)23(27)28)17(24)21-7-8-22-18(25)15(31-19(22)26)9-12-3-2-6-20-11-12/h2-6,9-11H,7-8H2,1H3,(H,21,24)/b15-9-	GIMQNYKJMCNDAX-DHDCSXOGSA-N	476.046040272							
F3097-3180	LSM-34869	SID7973604, BRD-K92657102	730698	InChI=1S/C15H11NO4S/c17-13-10-4-1-2-5-11(10)14(18)16(13)7-8-20-15(19)12-6-3-9-21-12/h1-6,9H,7-8H2	TZDQVHLIIZAVBC-UHFFFAOYSA-N	O=C(OCCN1C(=O)c2ccccc2C1=O)c3cccs3	BroadT	BRD-K92657102	BRD-K92657102-001-05-7	ChemBridge Corporation	6945650			O=C(OCCN1C(=O)c2ccccc2C1=O)c1cccs1	InChI=1S/C15H11NO4S/c17-13-10-4-1-2-5-11(10)14(18)16(13)7-8-20-15(19)12-6-3-9-21-12/h1-6,9H,7-8H2	TZDQVHLIIZAVBC-UHFFFAOYSA-N	301.040878532							123427
AC1LIPHF	LSM-34870	SID4258981, BRD-K98576982	935556	InChI=1S/C17H14N2O3S/c20-16(21)14-8-4-7-13(9-14)11-23-17-19-18-15(22-17)10-12-5-2-1-3-6-12/h1-9H,10-11H2,(H,20,21)	MRFYYQYSTHLYGO-UHFFFAOYSA-N	OC(=O)c1cccc(CSc2oc(Cc3ccccc3)nn2)c1	BroadT	BRD-K98576982	BRD-K98576982-001-06-6	ChemBridge Corporation	7940999			OC(=O)c1cccc(CSc2nnc(Cc3ccccc3)o2)c1	InChI=1S/C17H14N2O3S/c20-16(21)14-8-4-7-13(9-14)11-23-17-19-18-15(22-17)10-12-5-2-1-3-6-12/h1-9H,10-11H2,(H,20,21)	MRFYYQYSTHLYGO-UHFFFAOYSA-N	326.072513018							123428
1-(4-Fluoro-naphthalene-1-sulfonyl)-piperidine	LSM-34871	SID849455, BRD-K04725043	558772	InChI=1S/C15H16FNO2S/c16-14-8-9-15(13-7-3-2-6-12(13)14)20(18,19)17-10-4-1-5-11-17/h2-3,6-9H,1,4-5,10-11H2	QXJQYGMSKPCECK-UHFFFAOYSA-N	Fc1ccc(c2ccccc12)S(=O)(=O)N3CCCCC3	BroadT	BRD-K04725043	BRD-K04725043-001-05-1	Asinex Ltd.	BAS 04850649			Fc1ccc(c2ccccc12)S(=O)(=O)N1CCCCC1	InChI=1S/C15H16FNO2S/c16-14-8-9-15(13-7-3-2-6-12(13)14)20(18,19)17-10-4-1-5-11-17/h2-3,6-9H,1,4-5,10-11H2	QXJQYGMSKPCECK-UHFFFAOYSA-N	293.088577652							123429
SMR000033095	LSM-34872	SID4249822, BRD-K26752104	3243717	InChI=1S/C21H22F2N4O2/c1-14-25-18-12-15(21(28)24-6-7-26-8-10-29-11-9-26)2-4-20(18)27(14)19-5-3-16(22)13-17(19)23/h2-5,12-13H,6-11H2,1H3,(H,24,28)	HPAKOGINWWBKLC-UHFFFAOYSA-N	Cc1nc2cc(ccc2n1c3ccc(F)cc3F)C(=O)NCCN4CCOCC4	BroadT	BRD-K26752104	BRD-K26752104-001-05-5	ChemDiv Inc.	K894-1031			Cc1nc2cc(ccc2n1-c1ccc(F)cc1F)C(=O)NCCN1CCOCC1	InChI=1S/C21H22F2N4O2/c1-14-25-18-12-15(21(28)24-6-7-26-8-10-29-11-9-26)2-4-20(18)27(14)19-5-3-16(22)13-17(19)23/h2-5,12-13H,6-11H2,1H3,(H,24,28)	HPAKOGINWWBKLC-UHFFFAOYSA-N	400.171082384							123430
N-Methyl-2-(4-methylphenyl)-n-(1-methylpiperidin-4-yl)quinazolin-4-amine	LSM-34873	SID14738059, BRD-K57901428	822306	InChI=1S/C22H26N4/c1-16-8-10-17(11-9-16)21-23-20-7-5-4-6-19(20)22(24-21)26(3)18-12-14-25(2)15-13-18/h4-11,18H,12-15H2,1-3H3	ZOXGTPAJSZQQQL-UHFFFAOYSA-N	CN(C1CCN(C)CC1)c2nc(nc3ccccc23)c4ccc(C)cc4	BroadT	BRD-K57901428	BRD-K57901428-001-05-9	ChemDiv Inc.	4593-2694			CN(C1CCN(C)CC1)c1nc(nc2ccccc12)-c1ccc(C)cc1	InChI=1S/C22H26N4/c1-16-8-10-17(11-9-16)21-23-20-7-5-4-6-19(20)22(24-21)26(3)18-12-14-25(2)15-13-18/h4-11,18H,12-15H2,1-3H3	ZOXGTPAJSZQQQL-UHFFFAOYSA-N	346.215746872							123431
ST50738392	LSM-34874	SID17504991, BRD-K32423284	5494815	InChI=1S/C16H13N5OS/c1-2-9-7-11-14(17-8-18-16(11)23-9)21-20-13-10-5-3-4-6-12(10)19-15(13)22/h3-8,19,22H,2H2,1H3	XSUZDTDXCBFOBM-UHFFFAOYSA-N	CCc1cc2c(N=Nc3c(O)[nH]c4ccccc34)ncnc2s1	BroadT	BRD-K32423284	BRD-K32423284-001-05-7	Asinex Ltd.	BAS 00287799			CCc1cc2c(N=Nc3c(O)[nH]c4ccccc34)ncnc2s1	InChI=1S/C16H13N5OS/c1-2-9-7-11-14(17-8-18-16(11)23-9)21-20-13-10-5-3-4-6-12(10)19-15(13)22/h3-8,19,22H,2H2,1H3	XSUZDTDXCBFOBM-UHFFFAOYSA-N	323.084080776							
SMR000006898	LSM-34875	SID842402, BRD-K36345680	644670	InChI=1S/C16H21N5O3S/c1-23-15-18-14(19-16(20-15)24-2)21-7-5-11(6-8-21)13(22)17-10-12-4-3-9-25-12/h3-4,9,11H,5-8,10H2,1-2H3,(H,17,22)	HOUIYLFONKQQNB-UHFFFAOYSA-N	COc1nc(OC)nc(n1)N2CCC(CC2)C(=O)NCc3cccs3	BroadT	BRD-K36345680	BRD-K36345680-001-05-8	Asinex Ltd.	ASN 06571284			COc1nc(OC)nc(n1)N1CCC(CC1)C(=O)NCc1cccs1	InChI=1S/C16H21N5O3S/c1-23-15-18-14(19-16(20-15)24-2)21-7-5-11(6-8-21)13(22)17-10-12-4-3-9-25-12/h3-4,9,11H,5-8,10H2,1-2H3,(H,17,22)	HOUIYLFONKQQNB-UHFFFAOYSA-N	363.136510272							123433
2H-454S	LSM-34876	SID14729063, BRD-K17819647	3262583	InChI=1S/C16H11ClN2O2S/c1-10-14(19-15(22-10)11-6-8-18-9-7-11)21-16(20)12-2-4-13(17)5-3-12/h2-9H,1H3	PVTGOMVXNKUOMJ-UHFFFAOYSA-N	Cc1sc(nc1OC(=O)c2ccc(Cl)cc2)c3ccncc3	BroadT	BRD-K17819647	BRD-K17819647-001-05-7	Key Organics Ltd.	2H-454S			Cc1sc(nc1OC(=O)c1ccc(Cl)cc1)-c1ccncc1	InChI=1S/C16H11ClN2O2S/c1-10-14(19-15(22-10)11-6-8-18-9-7-11)21-16(20)12-2-4-13(17)5-3-12/h2-9H,1H3	PVTGOMVXNKUOMJ-UHFFFAOYSA-N	330.022976012							123434
STK850428	LSM-34877	SID865403, BRD-K60956746	666658	InChI=1S/C20H20N4O2S/c1-14(2)13-24-20-17(12-15-8-6-7-11-18(15)21-20)19(22-24)23-27(25,26)16-9-4-3-5-10-16/h3-12,14H,13H2,1-2H3,(H,22,23)	BVSPYKBPVONFLP-UHFFFAOYSA-N	CC(C)Cn1nc(NS(=O)(=O)c2ccccc2)c3cc4ccccc4nc13	BroadT	BRD-K60956746	BRD-K60956746-001-05-3	InterBioScreen Ltd.	STOCK5S-44372			CC(C)Cn1nc(NS(=O)(=O)c2ccccc2)c2cc3ccccc3nc12	InChI=1S/C20H20N4O2S/c1-14(2)13-24-20-17(12-15-8-6-7-11-18(15)21-20)19(22-24)23-27(25,26)16-9-4-3-5-10-16/h3-12,14H,13H2,1-2H3,(H,22,23)	BVSPYKBPVONFLP-UHFFFAOYSA-N	380.13069661							123435
AC1NTVZB	LSM-34878	SID861273, BRD-K99595806	5389538	InChI=1S/C18H23NO3/c1-3-13-10-16(20)22-15-9-12(2)14(18(21)17(13)15)11-19-7-5-4-6-8-19/h9-10,21H,3-8,11H2,1-2H3	DPVJOADKPAHYPA-UHFFFAOYSA-N	CCC1=CC(=O)Oc2cc(C)c(CN3CCCCC3)c(O)c12	BroadT	BRD-K99595806	BRD-K99595806-001-05-1	InterBioScreen Ltd.	STOCK4S-05166			CCc1cc(=O)oc2cc(C)c(CN3CCCCC3)c(O)c12	InChI=1S/C18H23NO3/c1-3-13-10-16(20)22-15-9-12(2)14(18(21)17(13)15)11-19-7-5-4-6-8-19/h9-10,21H,3-8,11H2,1-2H3	DPVJOADKPAHYPA-UHFFFAOYSA-N	301.167793606							123436
AC1LKGV9	LSM-34879	BRD-K34165685	1018094	InChI=1S/C16H15FN6OS/c1-10-7-11(2)23-15(19-10)20-16(22-23)25-9-14(24)21-18-8-12-5-3-4-6-13(12)17/h3-8H,9H2,1-2H3,(H,21,24)	MJCRUGNTUHDFME-UHFFFAOYSA-N	Cc1cc(C)n2nc(SCC(=O)NN=Cc3ccccc3F)nc2n1	BroadT	BRD-K34165685	BRD-K34165685-001-05-7	Specs	AN-646/14363003			Cc1cc(C)n2nc(SCC(=O)NN=Cc3ccccc3F)nc2n1	InChI=1S/C16H15FN6OS/c1-10-7-11(2)23-15(19-10)20-16(22-23)25-9-14(24)21-18-8-12-5-3-4-6-13(12)17/h3-8H,9H2,1-2H3,(H,21,24)	MJCRUGNTUHDFME-UHFFFAOYSA-N	358.10120805							123437
SMR000092365	LSM-34880	SID7967084, BRD-K05915713	3406810	InChI=1S/C7H10N2O2S3/c1-3-11-5(10)4-13-6-8-9(2)7(12)14-6/h3-4H2,1-2H3	ZDEDDTGFWSAFBB-UHFFFAOYSA-N	CCOC(=O)CSC1=NN(C)C(=S)S1	BroadT	BRD-K05915713	BRD-K05915713-001-04-9	ChemDiv Inc.	6453-0118			CCOC(=O)CSc1nn(C)c(=S)s1	InChI=1S/C7H10N2O2S3/c1-3-11-5(10)4-13-6-8-9(2)7(12)14-6/h3-4H2,1-2H3	ZDEDDTGFWSAFBB-UHFFFAOYSA-N	249.99043965							123438
F0643-0327	LSM-34881	SID4246591, SID7971595, BRD-K21583401	767720	InChI=1S/C18H22N2O2S/c21-17(19-12-10-14-6-2-1-3-7-14)11-13-20-15-8-4-5-9-16(15)23-18(20)22/h4-6,8-9H,1-3,7,10-13H2,(H,19,21)	FRXNHCCKWVWUPQ-UHFFFAOYSA-N	O=C(CCN1C(=O)Sc2ccccc12)NCCC3=CCCCC3	BroadT	BRD-K21583401	BRD-K21583401-001-05-9	Life Chemicals Inc.	F0643-0327			O=C(CCn1c2ccccc2sc1=O)NCCC1=CCCCC1	InChI=1S/C18H22N2O2S/c21-17(19-12-10-14-6-2-1-3-7-14)11-13-20-15-8-4-5-9-16(15)23-18(20)22/h4-6,8-9H,1-3,7,10-13H2,(H,19,21)	FRXNHCCKWVWUPQ-UHFFFAOYSA-N	330.140198654							123439
AC1NA517	LSM-15485	BRD-A31835455	4396182	InChI=1S/C12H12Cl3N3S/c1-7-3-5-8(6-4-7)9-16-10(12(13,14)15)18-11(17-9)19-2/h3-6,10H,1-2H3,(H,16,17,18)	OJZPXUOLAGELTQ-UHFFFAOYSA-N	CSC1=NC(=NC(N1)C(Cl)(Cl)Cl)c2ccc(C)cc2	BroadT	BRD-A31835455	BRD-A31835455-003-05-4	Enamine Ltd.	T0400-3520		Cl	CSC1=NC(=NC(N1)C(Cl)(Cl)Cl)c1ccc(C)cc1.Cl	InChI=1S/C12H12Cl3N3S.ClH/c1-7-3-5-8(6-4-7)9-16-10(12(13,14)15)18-11(17-9)19-2;/h3-6,10H,1-2H3,(H,16,17,18);1H	AIJAIZGGEDYLSD-UHFFFAOYSA-N	334.981751234							104128, 104128
F3394-0721	LSM-34882	SID4240933, BRD-K80434314	2243196	InChI=1S/C16H13N3O3S/c20-12(11-4-5-13-14(9-11)22-8-7-21-13)10-23-16-18-17-15-3-1-2-6-19(15)16/h1-6,9H,7-8,10H2	YYCYXEXMCIMKLK-UHFFFAOYSA-N	O=C(CSc1nnc2ccccn12)c3ccc4OCCOc4c3	BroadT	BRD-K80434314	BRD-K80434314-001-05-9	ChemDiv Inc.	6481-7281			O=C(CSc1nnc2ccccn12)c1ccc2OCCOc2c1	InChI=1S/C16H13N3O3S/c20-12(11-4-5-13-14(9-11)22-8-7-21-13)10-23-16-18-17-15-3-1-2-6-19(15)16/h1-6,9H,7-8,10H2	YYCYXEXMCIMKLK-UHFFFAOYSA-N	327.067761996							123440
2-[(4-Chlorophenyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde	LSM-34883	SID17410873, BRD-K08440092	2763795	InChI=1S/C16H12ClNOS/c1-18-15-5-3-2-4-13(15)14(10-19)16(18)20-12-8-6-11(17)7-9-12/h2-10H,1H3	YWJPKXRAUPCQFC-UHFFFAOYSA-N	Cn1c(Sc2ccc(Cl)cc2)c(C=O)c3ccccc13	BroadT	BRD-K08440092	BRD-K08440092-001-05-3	Key Organics Ltd.	3N-309S			Cn1c(Sc2ccc(Cl)cc2)c(C=O)c2ccccc12	InChI=1S/C16H12ClNOS/c1-18-15-5-3-2-4-13(15)14(10-19)16(18)20-12-8-6-11(17)7-9-12/h2-10H,1H3	YWJPKXRAUPCQFC-UHFFFAOYSA-N	301.032812414							123441
T5307242	LSM-34884	SID22410142, BRD-A35945150	4877915	InChI=1S/C21H20N2O/c1-16-12-14-19(15-13-16)23-21(24)20(17-8-4-2-5-9-17)22-18-10-6-3-7-11-18/h2-15,20,22H,1H3,(H,23,24)	AASLYBMLLLNNCD-UHFFFAOYSA-N	Cc1ccc(NC(=O)C(Nc2ccccc2)c3ccccc3)cc1	BroadT	BRD-A35945150	BRD-A35945150-001-05-9	Enamine Ltd.	T5307242			Cc1ccc(NC(=O)C(Nc2ccccc2)c2ccccc2)cc1	InChI=1S/C21H20N2O/c1-16-12-14-19(15-13-16)23-21(24)20(17-8-4-2-5-9-17)22-18-10-6-3-7-11-18/h2-15,20,22H,1H3,(H,23,24)	AASLYBMLLLNNCD-UHFFFAOYSA-N	316.15756328							123442
SMR000204831	LSM-34885	SID17509293, BRD-K66514953	12004777	InChI=1S/C21H21N5O6/c1-14-5-7-18(8-6-14)32-19-12-16(11-17(13-19)25(28)29)22-21(27)4-3-9-24-15(2)10-20(23-24)26(30)31/h5-8,10-13H,3-4,9H2,1-2H3,(H,22,27)	VZXQLBZUZNULIW-UHFFFAOYSA-N	Cc1ccc(Oc2cc(NC(=O)CCCn3nc(cc3C)[N+](=O)[O-])cc(c2)[N+](=O)[O-])cc1	BroadT	BRD-K66514953	BRD-K66514953-001-05-2	ChemDiv Inc.	C163-0214			Cc1cc(nn1CCCC(=O)Nc1cc(Oc2ccc(C)cc2)cc(c1)[N+]([O-])=O)[N+]([O-])=O	InChI=1S/C21H21N5O6/c1-14-5-7-18(8-6-14)32-19-12-16(11-17(13-19)25(28)29)22-21(27)4-3-9-24-15(2)10-20(23-24)26(30)31/h5-8,10-13H,3-4,9H2,1-2H3,(H,22,27)	VZXQLBZUZNULIW-UHFFFAOYSA-N	439.149183442							123443
MLS000091835	LSM-34886	SID4250766, BRD-K74505281	2153037	InChI=1S/C22H18ClN5O2S/c23-15-7-9-16(10-8-15)28-20-17(12-24-28)21(30)26-22(25-20)31-13-19(29)27-11-3-5-14-4-1-2-6-18(14)27/h1-2,4,6-10,12H,3,5,11,13H2,(H,25,26,30)	SMRHLNJJUWZCFN-UHFFFAOYSA-N	Oc1nc(SCC(=O)N2CCCc3ccccc23)nc4c1cnn4c5ccc(Cl)cc5	BroadT	BRD-K74505281	BRD-K74505281-001-05-3	ChemDiv Inc.	C365-0133			Oc1nc(SCC(=O)N2CCCc3ccccc23)nc2n(ncc12)-c1ccc(Cl)cc1	InChI=1S/C22H18ClN5O2S/c23-15-7-9-16(10-8-15)28-20-17(12-24-28)21(30)26-22(25-20)31-13-19(29)27-11-3-5-14-4-1-2-6-18(14)27/h1-2,4,6-10,12H,3,5,11,13H2,(H,25,26,30)	SMRHLNJJUWZCFN-UHFFFAOYSA-N	451.086973266							
MLS000546190	LSM-44524	SID17409116, BRD-K03545839	1233035	InChI=1S/C22H20N4O3S2/c1-14-12-16(15(2)26(14)18-8-10-19(11-9-18)31(23,28)29)13-20-21(27)25-22(30-20)24-17-6-4-3-5-7-17/h3-13H,1-2H3,(H2,23,28,29)(H,24,25,27)/b20-13-	ODRSSOQWOHNABY-MOSHPQCFSA-N	Cc1cc(\C=C\2/SC(=NC2=O)Nc3ccccc3)c(C)n1c4ccc(cc4)S(=O)(=O)N	BroadT	BRD-K03545839	BRD-K03545839-001-05-2	Specs	AO-081/15569089			Cc1cc(\C=C2/SC(Nc3ccccc3)=NC2=O)c(C)n1-c1ccc(cc1)S(N)(=O)=O	InChI=1S/C22H20N4O3S2/c1-14-12-16(15(2)26(14)18-8-10-19(11-9-18)31(23,28)29)13-20-21(27)25-22(30-20)24-17-6-4-3-5-7-17/h3-13H,1-2H3,(H2,23,28,29)(H,24,25,27)/b20-13-	ODRSSOQWOHNABY-MOSHPQCFSA-N	452.09768192							
322-97-4	LSM-34888	SID4240618, BRD-K27985733	67582	InChI=1S/C10H6F3NO/c11-10(12,13)6-1-2-7-8(5-6)14-4-3-9(7)15/h1-5H,(H,14,15)	OWPLFJSQLPTCHS-UHFFFAOYSA-N	Oc1ccnc2cc(ccc12)C(F)(F)F	BroadT	BRD-K27985733	BRD-K27985733-001-05-9	ChemDiv Inc.	3002-1299			Oc1ccnc2cc(ccc12)C(F)(F)F	InChI=1S/C10H6F3NO/c11-10(12,13)6-1-2-7-8(5-6)14-4-3-9(7)15/h1-5H,(H,14,15)	OWPLFJSQLPTCHS-UHFFFAOYSA-N	213.040148422							123446
BRD-K42959654	LSM-11036		54646040	InChI=1S/C21H31N3O6/c1-24(2)11-20(27)23-13-4-5-17-15(8-13)16-9-14(10-19(26)22-6-7-28-3)29-18(12-25)21(16)30-17/h4-5,8,14,16,18,21,25H,6-7,9-12H2,1-3H3,(H,22,26)(H,23,27)/t14-,16-,18-,21+/m1/s1	ZSBYESKXZOGBOW-OQBJRAFVSA-N	COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	BroadT	BRD-K42959654	BRD-K42959654-001-01-9	Broad Institute of MIT and Harvard	BRD-K42959654			COCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	InChI=1S/C21H31N3O6/c1-24(2)11-20(27)23-13-4-5-17-15(8-13)16-9-14(10-19(26)22-6-7-28-3)29-18(12-25)21(16)30-17/h4-5,8,14,16,18,21,25H,6-7,9-12H2,1-3H3,(H,22,26)(H,23,27)/t14-,16-,18-,21+/m1/s1	ZSBYESKXZOGBOW-OQBJRAFVSA-N	421.221285742							99657
BRD-K61533941	LSM-12160		54646051	InChI=1S/C24H30N2O5/c1-26(2)16-8-9-21-18(10-16)19-11-17(30-22(14-27)24(19)31-21)12-23(28)25-13-15-6-4-5-7-20(15)29-3/h4-10,17,19,22,24,27H,11-14H2,1-3H3,(H,25,28)/t17-,19-,22+,24+/m0/s1	YXRWVZTUBKEEPU-XZGZTLBWSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(cc34)N(C)C)[C@@H](CO)O2	BroadT	BRD-K61533941	BRD-K61533941-001-01-1	Broad Institute of MIT and Harvard	BRD-K61533941			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(cc23)N(C)C)[C@@H](CO)O1	InChI=1S/C24H30N2O5/c1-26(2)16-8-9-21-18(10-16)19-11-17(30-22(14-27)24(19)31-21)12-23(28)25-13-15-6-4-5-7-20(15)29-3/h4-10,17,19,22,24,27H,11-14H2,1-3H3,(H,25,28)/t17-,19-,22+,24+/m0/s1	YXRWVZTUBKEEPU-XZGZTLBWSA-N	426.21547208							100786
BRD-K70868272	LSM-12755		54645816	InChI=1S/C27H39N3O6/c31-17-24-26-22(15-20(35-24)16-25(32)28-8-11-30-9-2-1-3-10-30)21-14-19(4-5-23(21)36-26)29-27(33)18-6-12-34-13-7-18/h4-5,14,18,20,22,24,26,31H,1-3,6-13,15-17H2,(H,28,32)(H,29,33)/t20-,22+,24+,26-/m1/s1	XIMMKRXXDKAOMK-GRTAZNFBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K70868272	BRD-K70868272-001-01-9	Broad Institute of MIT and Harvard	BRD-K70868272			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H39N3O6/c31-17-24-26-22(15-20(35-24)16-25(32)28-8-11-30-9-2-1-3-10-30)21-14-19(4-5-23(21)36-26)29-27(33)18-6-12-34-13-7-18/h4-5,14,18,20,22,24,26,31H,1-3,6-13,15-17H2,(H,28,32)(H,29,33)/t20-,22+,24+,26-/m1/s1	XIMMKRXXDKAOMK-GRTAZNFBSA-N	501.283885998							101392
BRD-K89735991	LSM-13967		54645864	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,22+,25-/m0/s1	ZGEAGHWTKPKCOK-BXCPNTJMSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc5OCOc5c4)C[C@@H]3c2c1	BroadT	BRD-K89735991	BRD-K89735991-001-01-9	Broad Institute of MIT and Harvard	BRD-K89735991			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc5OCOc5c4)O[C@@H]3CO)c2c1	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,22+,25-/m0/s1	ZGEAGHWTKPKCOK-BXCPNTJMSA-N	484.184565876							102620
BRD-K61907493	LSM-12182		54646084	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,24-/m0/s1	WYDHQCWIOCTAOJ-AYEZKCMBSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K61907493	BRD-K61907493-001-01-9	Broad Institute of MIT and Harvard	BRD-K61907493			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,24-/m0/s1	WYDHQCWIOCTAOJ-AYEZKCMBSA-N	451.210721058							100808
BRD-K28851694	LSM-10179		54645876	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24-,28+,30+/m0/s1	DMKXNQOLMYQXCN-XQBMNTQMSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K28851694	BRD-K28851694-001-01-8	Broad Institute of MIT and Harvard	BRD-K28851694			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24-,28+,30+/m0/s1	DMKXNQOLMYQXCN-XQBMNTQMSA-N	542.20530132							98800
BRD-K29474997	LSM-10215		54645845	InChI=1S/C22H32N2O4/c1-24(2)15-8-9-19-17(10-15)18-11-16(27-20(13-25)22(18)28-19)12-21(26)23-14-6-4-3-5-7-14/h8-10,14,16,18,20,22,25H,3-7,11-13H2,1-2H3,(H,23,26)/t16-,18-,20-,22+/m0/s1	FNFGUCPTYHKNGE-JXYHXMIBSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NC4CCCCC4)C[C@H]3c2c1	BroadT	BRD-K29474997	BRD-K29474997-001-01-2	Broad Institute of MIT and Harvard	BRD-K29474997			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NC4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C22H32N2O4/c1-24(2)15-8-9-19-17(10-15)18-11-16(27-20(13-25)22(18)28-19)12-21(26)23-14-6-4-3-5-7-14/h8-10,14,16,18,20,22,25H,3-7,11-13H2,1-2H3,(H,23,26)/t16-,18-,20-,22+/m0/s1	FNFGUCPTYHKNGE-JXYHXMIBSA-N	388.236207524							98836
BRD-K88239034	LSM-13848		54645926	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23+,25-,27-/m0/s1	PHBUKTREHITDBU-OGMXRKNYSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K88239034	BRD-K88239034-001-01-2	Broad Institute of MIT and Harvard	BRD-K88239034			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23+,25-,27-/m0/s1	PHBUKTREHITDBU-OGMXRKNYSA-N	547.215234728							102499
BRD-K65778372	LSM-12440		54646021	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22-,26+,28+/m1/s1	WXIRIDSMDJYJEU-OEZGUAFWSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K65778372	BRD-K65778372-001-01-6	Broad Institute of MIT and Harvard	BRD-K65778372			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22-,26+,28+/m1/s1	WXIRIDSMDJYJEU-OEZGUAFWSA-N	537.24750049							101068
CHEMBL2360987	LSM-12931	BRD-K73500089, SID131442203	54645830	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25+,27+,29-/m0/s1	HHNPVBFCYHNCMG-ZVFGGPEJSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K73500089	BRD-K73500089-001-01-8	Broad Institute of MIT and Harvard	BRD-K73500089			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25+,27+,29-/m0/s1	HHNPVBFCYHNCMG-ZVFGGPEJSA-N	581.21375569							101568
CHEMBL2361679	LSM-14000	BRD-K90466405, SID131442485	54646111	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16-,18+,20+/m0/s1	RRHNJWQDAKAZMZ-LBLLVPRASA-N	OC[C@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23	BroadT	BRD-K90466405	BRD-K90466405-001-01-8	Broad Institute of MIT and Harvard	BRD-K90466405			OC[C@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16-,18+,20+/m0/s1	RRHNJWQDAKAZMZ-LBLLVPRASA-N	466.135171012							102653
BRD-K87304811	LSM-13781		54646056	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20+,22+,25-/m1/s1	ALLGXHRZPBERLG-SQQWRJQYSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)N[C@H](C)c4ccccc4)C[C@H]3c2c1	BroadT	BRD-K87304811	BRD-K87304811-001-01-4	Broad Institute of MIT and Harvard	BRD-K87304811			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N[C@H](C)c4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20+,22+,25-/m1/s1	ALLGXHRZPBERLG-SQQWRJQYSA-N	454.2103867							102430
BRD-K86979665	LSM-13762		54646022	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20-,22-,24+/m1/s1	GFIPGJIGSRXJBU-YWWGLXIYSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K86979665	BRD-K86979665-001-01-1	Broad Institute of MIT and Harvard	BRD-K86979665			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20-,22-,24+/m1/s1	GFIPGJIGSRXJBU-YWWGLXIYSA-N	457.25767125							102411
BRD-K19108281	LSM-9578		54645936	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24-,26-,28+/m1/s1	SUQCIPRCFCPKOO-HEEWVZCSSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K19108281	BRD-K19108281-001-01-3	Broad Institute of MIT and Harvard	BRD-K19108281			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24-,26-,28+/m1/s1	SUQCIPRCFCPKOO-HEEWVZCSSA-N	540.173035558							98199
BRD-K75091523	LSM-13026		54645839	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22+,24+,26-/m1/s1	QQFSWHWRRZLIPD-GRTAZNFBSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K75091523	BRD-K75091523-001-01-0	Broad Institute of MIT and Harvard	BRD-K75091523			COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@H](CO)O2)cc1	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22+,24+,26-/m1/s1	QQFSWHWRRZLIPD-GRTAZNFBSA-N	480.226036764							101663
BRD-K23396987	LSM-9837		54646027	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20+,22-,24-/m0/s1	GFIPGJIGSRXJBU-FVSDWULHSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K23396987	BRD-K23396987-001-01-5	Broad Institute of MIT and Harvard	BRD-K23396987			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20+,22-,24-/m0/s1	GFIPGJIGSRXJBU-FVSDWULHSA-N	457.25767125							98458
BRD-K07408742	LSM-8864		54645929	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21-,24-,26+/m1/s1	MRHMXTIRULDPKA-UNMCOINBSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K07408742	BRD-K07408742-001-01-4	Broad Institute of MIT and Harvard	BRD-K07408742			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21-,24-,26+/m1/s1	MRHMXTIRULDPKA-UNMCOINBSA-N	509.17622733							97485
BRD-K74636477	LSM-13001		54646098	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21-,23+/m1/s1	GJVLYDQXVFQAHZ-WACMXJRTSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)N(C)C)C[C@@H]4c3c2	BroadT	BRD-K74636477	BRD-K74636477-001-01-9	Broad Institute of MIT and Harvard	BRD-K74636477			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21-,23+/m1/s1	GJVLYDQXVFQAHZ-WACMXJRTSA-N	476.161721946							101638
BRD-K52309792	LSM-11627		54645961	InChI=1S/C21H28N2O7/c1-27-12-19(25)22-13-2-3-17-15(8-13)16-9-14(29-18(11-24)21(16)30-17)10-20(26)23-4-6-28-7-5-23/h2-3,8,14,16,18,21,24H,4-7,9-12H2,1H3,(H,22,25)/t14-,16+,18-,21-/m1/s1	YLZXNIXKCHRFQK-HRWHDRTOSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)N4CCOCC4)C[C@H]3c2c1	BroadT	BRD-K52309792	BRD-K52309792-001-01-7	Broad Institute of MIT and Harvard	BRD-K52309792			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCOCC4)O[C@@H]3CO)c2c1	InChI=1S/C21H28N2O7/c1-27-12-19(25)22-13-2-3-17-15(8-13)16-9-14(29-18(11-24)21(16)30-17)10-20(26)23-4-6-28-7-5-23/h2-3,8,14,16,18,21,24H,4-7,9-12H2,1H3,(H,22,25)/t14-,16+,18-,21-/m1/s1	YLZXNIXKCHRFQK-HRWHDRTOSA-N	420.189651256							100252
BRD-K15650895	LSM-9364		54645879	InChI=1S/C24H26F3N3O6/c1-34-15-5-2-13(3-6-15)29-23(33)30-14-4-7-19-17(8-14)18-9-16(35-20(11-31)22(18)36-19)10-21(32)28-12-24(25,26)27/h2-8,16,18,20,22,31H,9-12H2,1H3,(H,28,32)(H2,29,30,33)/t16-,18-,20-,22+/m0/s1	SPGVKSWBRQENOP-JXYHXMIBSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NCC(F)(F)F)C[C@H]4c3c2)cc1	BroadT	BRD-K15650895	BRD-K15650895-001-01-6	Broad Institute of MIT and Harvard	BRD-K15650895			COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](C[C@@H](CC(=O)NCC(F)(F)F)O[C@H]4CO)c3c2)cc1	InChI=1S/C24H26F3N3O6/c1-34-15-5-2-13(3-6-15)29-23(33)30-14-4-7-19-17(8-14)18-9-16(35-20(11-31)22(18)36-19)10-21(32)28-12-24(25,26)27/h2-8,16,18,20,22,31H,9-12H2,1H3,(H,28,32)(H2,29,30,33)/t16-,18-,20-,22+/m0/s1	SPGVKSWBRQENOP-JXYHXMIBSA-N	509.177370182							97985
BRD-K32234234	LSM-10383		54645901	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21+,23-,25-/m1/s1	UAPJRYKULVRBJS-RIPRBREISA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K32234234	BRD-K32234234-001-01-8	Broad Institute of MIT and Harvard	BRD-K32234234			OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21+,23-,25-/m1/s1	UAPJRYKULVRBJS-RIPRBREISA-N	481.221285742							99004
BRD-K86631008	LSM-13734		54645998	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23+,25-,27-/m1/s1	MPXYHEQTTLDTMZ-MBHFTIIHSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)NC5CCCCC5)C[C@H]4c3c2	BroadT	BRD-K86631008	BRD-K86631008-001-01-4	Broad Institute of MIT and Harvard	BRD-K86631008			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NC4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23+,25-,27-/m1/s1	MPXYHEQTTLDTMZ-MBHFTIIHSA-N	530.208672138							102383
BRD-K29326878	LSM-10207		54646053	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20+,22+,25-/m0/s1	ALLGXHRZPBERLG-SPKYLNSMSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)N[C@@H](C)c4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K29326878	BRD-K29326878-001-01-8	Broad Institute of MIT and Harvard	BRD-K29326878			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N[C@@H](C)c4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20+,22+,25-/m0/s1	ALLGXHRZPBERLG-SPKYLNSMSA-N	454.2103867							98828
CHEMBL2362001	LSM-11218	SID131442360, BRD-K45723650	54645987	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25-,27-,29+/m1/s1	RHYJRBPAXZYDBS-AMOMVJEUSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K45723650	BRD-K45723650-001-01-0	Broad Institute of MIT and Harvard	BRD-K45723650			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25-,27-,29+/m1/s1	RHYJRBPAXZYDBS-AMOMVJEUSA-N	552.173035558							99839
BRD-K30781800	LSM-10282		54646044	InChI=1S/C21H31N3O6/c1-24(2)11-20(27)23-13-4-5-17-15(8-13)16-9-14(10-19(26)22-6-7-28-3)29-18(12-25)21(16)30-17/h4-5,8,14,16,18,21,25H,6-7,9-12H2,1-3H3,(H,22,26)(H,23,27)/t14-,16+,18-,21-/m1/s1	ZSBYESKXZOGBOW-HRWHDRTOSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	BroadT	BRD-K30781800	BRD-K30781800-001-01-4	Broad Institute of MIT and Harvard	BRD-K30781800			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	InChI=1S/C21H31N3O6/c1-24(2)11-20(27)23-13-4-5-17-15(8-13)16-9-14(10-19(26)22-6-7-28-3)29-18(12-25)21(16)30-17/h4-5,8,14,16,18,21,25H,6-7,9-12H2,1-3H3,(H,22,26)(H,23,27)/t14-,16+,18-,21-/m1/s1	ZSBYESKXZOGBOW-HRWHDRTOSA-N	421.221285742							98903
BRD-K75750101	LSM-13063		54645813	InChI=1S/C27H39N3O6/c31-17-24-26-22(15-20(35-24)16-25(32)28-8-11-30-9-2-1-3-10-30)21-14-19(4-5-23(21)36-26)29-27(33)18-6-12-34-13-7-18/h4-5,14,18,20,22,24,26,31H,1-3,6-13,15-17H2,(H,28,32)(H,29,33)/t20-,22-,24-,26+/m1/s1	XIMMKRXXDKAOMK-DFICYWPVSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K75750101	BRD-K75750101-001-01-1	Broad Institute of MIT and Harvard	BRD-K75750101			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H39N3O6/c31-17-24-26-22(15-20(35-24)16-25(32)28-8-11-30-9-2-1-3-10-30)21-14-19(4-5-23(21)36-26)29-27(33)18-6-12-34-13-7-18/h4-5,14,18,20,22,24,26,31H,1-3,6-13,15-17H2,(H,28,32)(H,29,33)/t20-,22-,24-,26+/m1/s1	XIMMKRXXDKAOMK-DFICYWPVSA-N	501.283885998							101700
BRD-K74639017	LSM-13002		54645800	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16-,20-,22+/m0/s1	HFIMGBHSBJMCIP-OZOIZYBVSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	BroadT	BRD-K74639017	BRD-K74639017-001-01-0	Broad Institute of MIT and Harvard	BRD-K74639017			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16-,20-,22+/m0/s1	HFIMGBHSBJMCIP-OZOIZYBVSA-N	441.142366706							101639
BRD-K12483497	LSM-9172		54645834	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25-,27+,29+/m0/s1	HHNPVBFCYHNCMG-IBNCXQOKSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K12483497	BRD-K12483497-001-01-7	Broad Institute of MIT and Harvard	BRD-K12483497			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25-,27+,29+/m0/s1	HHNPVBFCYHNCMG-IBNCXQOKSA-N	581.21375569							97793
BRD-K75576199	LSM-13050		54645862	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,22-,25+/m1/s1	ZGEAGHWTKPKCOK-DORSAVSOSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc5OCOc5c4)C[C@@H]3c2c1	BroadT	BRD-K75576199	BRD-K75576199-001-01-3	Broad Institute of MIT and Harvard	BRD-K75576199			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc5OCOc5c4)O[C@@H]3CO)c2c1	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,22-,25+/m1/s1	ZGEAGHWTKPKCOK-DORSAVSOSA-N	484.184565876							101687
BRD-K61499353	LSM-12156		54645982	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23+,25-,27-/m1/s1	HYQMBLXITOJPAN-WWUYVNTOSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K61499353	BRD-K61499353-001-01-6	Broad Institute of MIT and Harvard	BRD-K61499353			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23+,25-,27-/m1/s1	HYQMBLXITOJPAN-WWUYVNTOSA-N	487.210721058							100782
BRD-K71674109	LSM-12815		54645863	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,22-,25+/m0/s1	ZGEAGHWTKPKCOK-ZRIJYVCPSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc5OCOc5c4)C[C@H]3c2c1	BroadT	BRD-K71674109	BRD-K71674109-001-01-9	Broad Institute of MIT and Harvard	BRD-K71674109			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc5OCOc5c4)O[C@H]3CO)c2c1	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,22-,25+/m0/s1	ZGEAGHWTKPKCOK-ZRIJYVCPSA-N	484.184565876							101452
BRD-K01326303	LSM-8516		54646023	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20-,22-,24+/m0/s1	GFIPGJIGSRXJBU-UYLMIGBBSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K01326303	BRD-K01326303-001-01-5	Broad Institute of MIT and Harvard	BRD-K01326303			OC[C@@H]1O[C@H](CC(=O)N2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20-,22-,24+/m0/s1	GFIPGJIGSRXJBU-UYLMIGBBSA-N	457.25767125							97137
BRD-K68682056	LSM-12617		54646006	InChI=1S/C22H25N3O5/c1-25(2)20(27)10-15-9-17-16-8-14(24-22(28)13-4-3-7-23-11-13)5-6-18(16)30-21(17)19(12-26)29-15/h3-8,11,15,17,19,21,26H,9-10,12H2,1-2H3,(H,24,28)/t15-,17+,19-,21-/m1/s1	IUZUJTQXZTXMFN-UKHYVGRKSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	BroadT	BRD-K68682056	BRD-K68682056-001-01-0	Broad Institute of MIT and Harvard	BRD-K68682056			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C22H25N3O5/c1-25(2)20(27)10-15-9-17-16-8-14(24-22(28)13-4-3-7-23-11-13)5-6-18(16)30-21(17)19(12-26)29-15/h3-8,11,15,17,19,21,26H,9-10,12H2,1-2H3,(H,24,28)/t15-,17+,19-,21-/m1/s1	IUZUJTQXZTXMFN-UKHYVGRKSA-N	411.17942093							101249
BRD-K73334096-001-01-3	LSM-12921	BRD-K73334096	54645843	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11-,13+,15+/m0/s1	HQNYHUFQGPMYGV-SQWGHXPGSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(N)cc23)[C@@H](CO)O1	BroadT	BRD-K73334096	BRD-K73334096-001-01-3	Broad Institute of MIT and Harvard	BRD-K73334096			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(N)cc23)[C@@H](CO)O1	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11-,13+,15+/m0/s1	HQNYHUFQGPMYGV-SQWGHXPGSA-N	293.126322718							101558
BRD-K80777319	LSM-13368		54645847	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22-,24-,26+/m0/s1	MZNDQAVBBCTOIA-CLKGCZJISA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K80777319	BRD-K80777319-001-01-5	Broad Institute of MIT and Harvard	BRD-K80777319			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22-,24-,26+/m0/s1	MZNDQAVBBCTOIA-CLKGCZJISA-N	527.152634472							102007
BRD-K00347265	LSM-8447		54645953	InChI=1S/C24H32N2O5/c27-13-21-23-19(11-17(30-21)12-22(28)25-15-6-1-2-7-15)18-10-16(8-9-20(18)31-23)26-24(29)14-4-3-5-14/h8-10,14-15,17,19,21,23,27H,1-7,11-13H2,(H,25,28)(H,26,29)/t17-,19+,21-,23-/m1/s1	MOMUNQNAFOIKEQ-GUBFDYSESA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K00347265	BRD-K00347265-001-01-8	Broad Institute of MIT and Harvard	BRD-K00347265			OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C24H32N2O5/c27-13-21-23-19(11-17(30-21)12-22(28)25-15-6-1-2-7-15)18-10-16(8-9-20(18)31-23)26-24(29)14-4-3-5-14/h8-10,14-15,17,19,21,23,27H,1-7,11-13H2,(H,25,28)(H,26,29)/t17-,19+,21-,23-/m1/s1	MOMUNQNAFOIKEQ-GUBFDYSESA-N	428.231122144							97068
BRD-K88092133	LSM-13838		54645881	InChI=1S/C24H26F3N3O6/c1-34-15-5-2-13(3-6-15)29-23(33)30-14-4-7-19-17(8-14)18-9-16(35-20(11-31)22(18)36-19)10-21(32)28-12-24(25,26)27/h2-8,16,18,20,22,31H,9-12H2,1H3,(H,28,32)(H2,29,30,33)/t16-,18-,20+,22+/m1/s1	SPGVKSWBRQENOP-MDRHQERFSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]4c3c2)cc1	BroadT	BRD-K88092133	BRD-K88092133-001-01-5	Broad Institute of MIT and Harvard	BRD-K88092133			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NCC(F)(F)F)O[C@H]4CO)c3c2)cc1	InChI=1S/C24H26F3N3O6/c1-34-15-5-2-13(3-6-15)29-23(33)30-14-4-7-19-17(8-14)18-9-16(35-20(11-31)22(18)36-19)10-21(32)28-12-24(25,26)27/h2-8,16,18,20,22,31H,9-12H2,1H3,(H,28,32)(H2,29,30,33)/t16-,18-,20+,22+/m1/s1	SPGVKSWBRQENOP-MDRHQERFSA-N	509.177370182							102489
BRD-K29737933	LSM-10232		54646058	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20-,22-,25+/m1/s1	ALLGXHRZPBERLG-IFWXUIPSSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)N[C@H](C)c4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K29737933	BRD-K29737933-001-01-9	Broad Institute of MIT and Harvard	BRD-K29737933			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N[C@H](C)c4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20-,22-,25+/m1/s1	ALLGXHRZPBERLG-IFWXUIPSSA-N	454.2103867							98853
BRD-K99785919	LSM-14559		54645964	InChI=1S/C21H28N2O7/c1-27-12-19(25)22-13-2-3-17-15(8-13)16-9-14(29-18(11-24)21(16)30-17)10-20(26)23-4-6-28-7-5-23/h2-3,8,14,16,18,21,24H,4-7,9-12H2,1H3,(H,22,25)/t14-,16-,18+,21+/m1/s1	YLZXNIXKCHRFQK-GXLIZGDTSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)N4CCOCC4)C[C@@H]3c2c1	BroadT	BRD-K99785919	BRD-K99785919-001-01-1	Broad Institute of MIT and Harvard	BRD-K99785919			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N4CCOCC4)O[C@H]3CO)c2c1	InChI=1S/C21H28N2O7/c1-27-12-19(25)22-13-2-3-17-15(8-13)16-9-14(29-18(11-24)21(16)30-17)10-20(26)23-4-6-28-7-5-23/h2-3,8,14,16,18,21,24H,4-7,9-12H2,1H3,(H,22,25)/t14-,16-,18+,21+/m1/s1	YLZXNIXKCHRFQK-GXLIZGDTSA-N	420.189651256							103215
BRD-K93667957	LSM-14171		54646086	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,24-/m1/s1	WYDHQCWIOCTAOJ-USHXRURQSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K93667957	BRD-K93667957-001-01-0	Broad Institute of MIT and Harvard	BRD-K93667957			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,24-/m1/s1	WYDHQCWIOCTAOJ-USHXRURQSA-N	451.210721058							102825
CHEMBL2357838	LSM-11974	BRD-K58703114, SID131442206	54645833	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25+,27-,29-/m0/s1	HHNPVBFCYHNCMG-KLPDMWAPSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K58703114	BRD-K58703114-001-01-6	Broad Institute of MIT and Harvard	BRD-K58703114			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25+,27-,29-/m0/s1	HHNPVBFCYHNCMG-KLPDMWAPSA-N	581.21375569							100600
BRD-K49597140	LSM-11444		54645984	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23-,25+,27+/m0/s1	HYQMBLXITOJPAN-JZEPBHRJSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K49597140	BRD-K49597140-001-01-2	Broad Institute of MIT and Harvard	BRD-K49597140			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23-,25+,27+/m0/s1	HYQMBLXITOJPAN-JZEPBHRJSA-N	487.210721058							100065
BRD-K82794234	LSM-13485		54645946	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21+,24+,26-,28-/m1/s1	SUQCIPRCFCPKOO-KMTUSBKWSA-N	C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K82794234	BRD-K82794234-001-01-0	Broad Institute of MIT and Harvard	BRD-K82794234			C[C@@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21+,24+,26-,28-/m1/s1	SUQCIPRCFCPKOO-KMTUSBKWSA-N	540.173035558							102125
BRD-K69792693-001-01-5	LSM-12689	BRD-K69792693	54645844	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11-,13+,15+/m1/s1	HQNYHUFQGPMYGV-RNKJKDHYSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(N)cc23)[C@H](CO)O1	BroadT	BRD-K69792693	BRD-K69792693-001-01-5	Broad Institute of MIT and Harvard	BRD-K69792693			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(N)cc23)[C@H](CO)O1	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11-,13+,15+/m1/s1	HQNYHUFQGPMYGV-RNKJKDHYSA-N	293.126322718							101323
BRD-K93763244	LSM-14183		54646076	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16+,18+,20-/m0/s1	LHGLZDQGJZRLBC-UQWBFEFOSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@@H](CO)O2	BroadT	BRD-K93763244	BRD-K93763244-001-01-0	Broad Institute of MIT and Harvard	BRD-K93763244			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16+,18+,20-/m0/s1	LHGLZDQGJZRLBC-UQWBFEFOSA-N	439.177706368							102837
BRD-K43776433	LSM-11100		54645798	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20-,22+,24+/m0/s1	CJNJMLGGDUQPOS-HYWXBTQMSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K43776433	BRD-K43776433-001-01-4	Broad Institute of MIT and Harvard	BRD-K43776433			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20-,22+,24+/m0/s1	CJNJMLGGDUQPOS-HYWXBTQMSA-N	488.161721946							99721
BRD-K92925409	LSM-14125		54646095	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18+,22-,24-/m0/s1	RREKHFLFIWGNNG-YDGOEMPPSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K92925409	BRD-K92925409-001-01-7	Broad Institute of MIT and Harvard	BRD-K92925409			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18+,22-,24-/m0/s1	RREKHFLFIWGNNG-YDGOEMPPSA-N	485.196213846							102779
BRD-K38122103	LSM-10736		54645883	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21-,24-,26+/m0/s1	MSBIHNOYSLVJHR-YKNOVDGGSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K38122103	BRD-K38122103-001-01-7	Broad Institute of MIT and Harvard	BRD-K38122103			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21-,24-,26+/m0/s1	MSBIHNOYSLVJHR-YKNOVDGGSA-N	497.232599354							99357
BRD-K62106945-001-01-1	LSM-34889	BRD-K62106945	54645978	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23-,25-,27+/m1/s1	HYQMBLXITOJPAN-UFUIAINPSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K62106945	BRD-K62106945-001-01-1	Broad Institute of MIT and Harvard	BRD-K62106945			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23-,25-,27+/m1/s1	HYQMBLXITOJPAN-UFUIAINPSA-N	487.210721058							123447
BRD-K26666618	LSM-10047		54645996	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23+,25+,27-/m0/s1	MPXYHEQTTLDTMZ-NOGZMFEUSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@H](CC(=O)NC5CCCCC5)C[C@@H]4c3c2	BroadT	BRD-K26666618	BRD-K26666618-001-01-5	Broad Institute of MIT and Harvard	BRD-K26666618			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NC4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23+,25+,27-/m0/s1	MPXYHEQTTLDTMZ-NOGZMFEUSA-N	530.208672138							98668
BRD-K06532738	LSM-8810		54646002	InChI=1S/C22H25N3O5/c1-25(2)20(27)10-15-9-17-16-8-14(24-22(28)13-4-3-7-23-11-13)5-6-18(16)30-21(17)19(12-26)29-15/h3-8,11,15,17,19,21,26H,9-10,12H2,1-2H3,(H,24,28)/t15-,17-,19-,21+/m1/s1	IUZUJTQXZTXMFN-WELBPKCISA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	BroadT	BRD-K06532738	BRD-K06532738-001-01-8	Broad Institute of MIT and Harvard	BRD-K06532738			CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C22H25N3O5/c1-25(2)20(27)10-15-9-17-16-8-14(24-22(28)13-4-3-7-23-11-13)5-6-18(16)30-21(17)19(12-26)29-15/h3-8,11,15,17,19,21,26H,9-10,12H2,1-2H3,(H,24,28)/t15-,17-,19-,21+/m1/s1	IUZUJTQXZTXMFN-WELBPKCISA-N	411.17942093							97431
BRD-K61825138	LSM-12177		54646018	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22+,26-,28-/m1/s1	WXIRIDSMDJYJEU-UKTDVOJESA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K61825138	BRD-K61825138-001-01-4	Broad Institute of MIT and Harvard	BRD-K61825138			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22+,26-,28-/m1/s1	WXIRIDSMDJYJEU-UKTDVOJESA-N	537.24750049							100803
BRD-K43786699	LSM-11101		54646106	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16-,18-,20+/m0/s1	RRHNJWQDAKAZMZ-PFSLXQJOSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23	BroadT	BRD-K43786699	BRD-K43786699-001-01-2	Broad Institute of MIT and Harvard	BRD-K43786699			OC[C@@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16-,18-,20+/m0/s1	RRHNJWQDAKAZMZ-PFSLXQJOSA-N	466.135171012							99722
BRD-K45098285	LSM-11171		54646093	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18+,22+,24-/m1/s1	RREKHFLFIWGNNG-CXJARPSQSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K45098285	BRD-K45098285-001-01-0	Broad Institute of MIT and Harvard	BRD-K45098285			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18+,22+,24-/m1/s1	RREKHFLFIWGNNG-CXJARPSQSA-N	485.196213846							99792
BRD-K08668362	LSM-8953		54646090	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18-,22-,24+/m1/s1	RREKHFLFIWGNNG-MJHBTERZSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K08668362	BRD-K08668362-001-01-1	Broad Institute of MIT and Harvard	BRD-K08668362			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18-,22-,24+/m1/s1	RREKHFLFIWGNNG-MJHBTERZSA-N	485.196213846							97574
BRD-K46192888	LSM-11244		54645975	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20+,22+,24-/m1/s1	CJNJMLGGDUQPOS-HLPIXKIESA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K46192888	BRD-K46192888-001-01-1	Broad Institute of MIT and Harvard	BRD-K46192888			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20+,22+,24-/m1/s1	CJNJMLGGDUQPOS-HLPIXKIESA-N	488.161721946							99865
BRD-K74455073	LSM-12987		54646071	InChI=1S/C22H23F3N2O6S/c23-22(24,25)12-26-20(29)10-14-9-17-16-8-13(27-34(30,31)15-4-2-1-3-5-15)6-7-18(16)33-21(17)19(11-28)32-14/h1-8,14,17,19,21,27-28H,9-12H2,(H,26,29)/t14-,17+,19+,21-/m1/s1	AWBUKOBMSNOSJG-CUYZEOOHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NS(=O)(=O)c4ccccc4)cc23	BroadT	BRD-K74455073	BRD-K74455073-001-01-2	Broad Institute of MIT and Harvard	BRD-K74455073			OC[C@@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C22H23F3N2O6S/c23-22(24,25)12-26-20(29)10-14-9-17-16-8-13(27-34(30,31)15-4-2-1-3-5-15)6-7-18(16)33-21(17)19(11-28)32-14/h1-8,14,17,19,21,27-28H,9-12H2,(H,26,29)/t14-,17+,19+,21-/m1/s1	AWBUKOBMSNOSJG-CUYZEOOHSA-N	500.122891766							101624
BRD-K21384842	LSM-9726		54645807	InChI=1S/C23H27FN2O4/c1-26(2)16-6-7-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-4-3-5-15(24)8-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19-,21-,23+/m0/s1	WXYXTVXIMWIJFY-RAKJYXHLSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4cccc(F)c4)C[C@H]3c2c1	BroadT	BRD-K21384842	BRD-K21384842-001-01-8	Broad Institute of MIT and Harvard	BRD-K21384842			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cccc(F)c4)O[C@H]3CO)c2c1	InChI=1S/C23H27FN2O4/c1-26(2)16-6-7-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-4-3-5-15(24)8-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19-,21-,23+/m0/s1	WXYXTVXIMWIJFY-RAKJYXHLSA-N	414.195485564							98347
BRD-K10287818-001-01-6	LSM-9054	BRD-K10287818	54645842	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11+,13-,15-/m0/s1	HQNYHUFQGPMYGV-PWXJCGIASA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(N)cc23)[C@H](CO)O1	BroadT	BRD-K10287818	BRD-K10287818-001-01-6	Broad Institute of MIT and Harvard	BRD-K10287818			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(N)cc23)[C@H](CO)O1	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11+,13-,15-/m0/s1	HQNYHUFQGPMYGV-PWXJCGIASA-N	293.126322718							97675
BRD-K31556224	LSM-10340		54645942	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21+,24-,26+,28+/m1/s1	SUQCIPRCFCPKOO-SFIFTMJASA-N	C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K31556224	BRD-K31556224-001-01-7	Broad Institute of MIT and Harvard	BRD-K31556224			C[C@@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21+,24-,26+,28+/m1/s1	SUQCIPRCFCPKOO-SFIFTMJASA-N	540.173035558							98961
BRD-K96165286	LSM-14330		54645911	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19-,21+,23+/m0/s1	TVZJESBMTOHXDE-VARILPKDSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCCc4ccccc4)C[C@H]3c2c1	BroadT	BRD-K96165286	BRD-K96165286-001-01-4	Broad Institute of MIT and Harvard	BRD-K96165286			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCCc4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19-,21+,23+/m0/s1	TVZJESBMTOHXDE-VARILPKDSA-N	460.166807326							102984
BRD-K03864628	LSM-8669		54645995	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23-,25-,27+/m0/s1	MPXYHEQTTLDTMZ-WHTZKJIOSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)NC5CCCCC5)C[C@H]4c3c2	BroadT	BRD-K03864628	BRD-K03864628-001-01-1	Broad Institute of MIT and Harvard	BRD-K03864628			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NC4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23-,25-,27+/m0/s1	MPXYHEQTTLDTMZ-WHTZKJIOSA-N	530.208672138							97290
BRD-K83644384	LSM-13543		54645840	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22+,24-,26-/m1/s1	QQFSWHWRRZLIPD-FWSIMYTDSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K83644384	BRD-K83644384-001-01-4	Broad Institute of MIT and Harvard	BRD-K83644384			COc1ccc(CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@@H](CO)O2)cc1	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22+,24-,26-/m1/s1	QQFSWHWRRZLIPD-FWSIMYTDSA-N	480.226036764							102185
BRD-K09563163	LSM-9013		54645852	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22-,24+,26+/m0/s1	MZNDQAVBBCTOIA-TUTLFNSSSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K09563163	BRD-K09563163-001-01-4	Broad Institute of MIT and Harvard	BRD-K09563163			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22-,24+,26+/m0/s1	MZNDQAVBBCTOIA-TUTLFNSSSA-N	527.152634472							97634
BRD-K98259048	LSM-14466		54645860	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20+,23+/m0/s1	WARQVQDGSWZACN-VSCJKUSUSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K98259048	BRD-K98259048-001-01-2	Broad Institute of MIT and Harvard	BRD-K98259048			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20+,23+/m0/s1	WARQVQDGSWZACN-VSCJKUSUSA-N	414.21547208							103121
BRD-K88686946	LSM-13881		54646013	InChI=1S/C21H27NO7/c1-26-19(24)10-14-9-16-15-8-13(22-21(25)12-4-6-27-7-5-12)2-3-17(15)29-20(16)18(11-23)28-14/h2-3,8,12,14,16,18,20,23H,4-7,9-11H2,1H3,(H,22,25)/t14-,16-,18+,20+/m1/s1	CYYYAXPAVULRAL-BIJSTVTOSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	BroadT	BRD-K88686946	BRD-K88686946-001-01-1	Broad Institute of MIT and Harvard	BRD-K88686946			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	InChI=1S/C21H27NO7/c1-26-19(24)10-14-9-16-15-8-13(22-21(25)12-4-6-27-7-5-12)2-3-17(15)29-20(16)18(11-23)28-14/h2-3,8,12,14,16,18,20,23H,4-7,9-11H2,1H3,(H,22,25)/t14-,16-,18+,20+/m1/s1	CYYYAXPAVULRAL-BIJSTVTOSA-N	405.178752214							102534
BRD-K22356478	LSM-9783		54645858	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20-,23-/m1/s1	WARQVQDGSWZACN-RWSUSOHTSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K22356478	BRD-K22356478-001-01-6	Broad Institute of MIT and Harvard	BRD-K22356478			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20-,23-/m1/s1	WARQVQDGSWZACN-RWSUSOHTSA-N	414.21547208							98404
BRD-K74287511	LSM-12976		54645804	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16+,20-,22-/m0/s1	HFIMGBHSBJMCIP-NEDPJEHSSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	BroadT	BRD-K74287511	BRD-K74287511-001-01-9	Broad Institute of MIT and Harvard	BRD-K74287511			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16+,20-,22-/m0/s1	HFIMGBHSBJMCIP-NEDPJEHSSA-N	441.142366706							101613
BRD-K40509566-001-01-1	LSM-34890	BRD-K40509566	54646001	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23-,25+,27+/m1/s1	MPXYHEQTTLDTMZ-BQLGRQSHSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)NC5CCCCC5)C[C@@H]4c3c2	BroadT	BRD-K40509566	BRD-K40509566-001-01-1	Broad Institute of MIT and Harvard	BRD-K40509566			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NC4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23-,25+,27+/m1/s1	MPXYHEQTTLDTMZ-BQLGRQSHSA-N	530.208672138							123448
BRD-K40442760	LSM-10895		54645809	InChI=1S/C23H27FN2O4/c1-26(2)16-6-7-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-4-3-5-15(24)8-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19+,21-,23-/m1/s1	WXYXTVXIMWIJFY-GUBFDYSESA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4cccc(F)c4)C[C@H]3c2c1	BroadT	BRD-K40442760	BRD-K40442760-001-01-9	Broad Institute of MIT and Harvard	BRD-K40442760			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cccc(F)c4)O[C@@H]3CO)c2c1	InChI=1S/C23H27FN2O4/c1-26(2)16-6-7-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-4-3-5-15(24)8-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19+,21-,23-/m1/s1	WXYXTVXIMWIJFY-GUBFDYSESA-N	414.195485564							99516
BRD-K68368772	LSM-12599		54645992	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25-,27+,29+/m0/s1	RHYJRBPAXZYDBS-RMBZFECLSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K68368772	BRD-K68368772-001-01-9	Broad Institute of MIT and Harvard	BRD-K68368772			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25-,27+,29+/m0/s1	RHYJRBPAXZYDBS-RMBZFECLSA-N	552.173035558							101231
BRD-K40694355	LSM-10914		54645980	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23+,25+,27-/m0/s1	HYQMBLXITOJPAN-BBVYRSAVSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K40694355	BRD-K40694355-001-01-6	Broad Institute of MIT and Harvard	BRD-K40694355			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23+,25+,27-/m0/s1	HYQMBLXITOJPAN-BBVYRSAVSA-N	487.210721058							99535
BRD-K05315233	LSM-8743		54646114	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11+,13+,15-/m0/s1	HQNYHUFQGPMYGV-XKFJNSEWSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(N)cc23)[C@@H](CO)O1	BroadT	BRD-K05315233	BRD-K05315233-001-01-9	Broad Institute of MIT and Harvard	BRD-K05315233			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(N)cc23)[C@@H](CO)O1	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11+,13+,15-/m0/s1	HQNYHUFQGPMYGV-XKFJNSEWSA-N	293.126322718							97364
BRD-K01248935	LSM-8510		54645867	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,22-,25-/m0/s1	ZGEAGHWTKPKCOK-YCJKLMQJSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4ccc5OCOc5c4)C[C@@H]3c2c1	BroadT	BRD-K01248935	BRD-K01248935-001-01-7	Broad Institute of MIT and Harvard	BRD-K01248935			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4ccc5OCOc5c4)O[C@H]3CO)c2c1	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,22-,25-/m0/s1	ZGEAGHWTKPKCOK-YCJKLMQJSA-N	484.184565876							97131
BRD-K28169522	LSM-10136		54645925	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23+,25-,27-/m1/s1	PHBUKTREHITDBU-MBHFTIIHSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K28169522	BRD-K28169522-001-01-3	Broad Institute of MIT and Harvard	BRD-K28169522			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23+,25-,27-/m1/s1	PHBUKTREHITDBU-MBHFTIIHSA-N	547.215234728							98757
CHEMBL3183466	LSM-13284	BRD-K79498538	54645835	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25-,27+,29+/m1/s1	HHNPVBFCYHNCMG-UXLOVFDUSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K79498538	BRD-K79498538-001-01-6	Broad Institute of MIT and Harvard	BRD-K79498538			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25-,27+,29+/m1/s1	HHNPVBFCYHNCMG-UXLOVFDUSA-N	581.21375569							101923
CHEMBL3184317	LSM-11742	BRD-K54589358	54645986	InChI=1S/C20H28N2O5/c1-21(2)13-3-4-17-15(9-13)16-10-14(26-18(12-23)20(16)27-17)11-19(24)22-5-7-25-8-6-22/h3-4,9,14,16,18,20,23H,5-8,10-12H2,1-2H3/t14-,16-,18-,20+/m0/s1	DDTRWXBYMDYHEQ-PFSLXQJOSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)N4CCOCC4)C[C@H]3c2c1	BroadT	BRD-K54589358	BRD-K54589358-001-01-8	Broad Institute of MIT and Harvard	BRD-K54589358			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCOCC4)O[C@H]3CO)c2c1	InChI=1S/C20H28N2O5/c1-21(2)13-3-4-17-15(9-13)16-10-14(26-18(12-23)20(16)27-17)11-19(24)22-5-7-25-8-6-22/h3-4,9,14,16,18,20,23H,5-8,10-12H2,1-2H3/t14-,16-,18-,20+/m0/s1	DDTRWXBYMDYHEQ-PFSLXQJOSA-N	376.199822016							100367
BRD-K81658952	LSM-13413		54645902	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21+,23-,25-/m0/s1	UAPJRYKULVRBJS-PYTYSOFPSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K81658952	BRD-K81658952-001-01-8	Broad Institute of MIT and Harvard	BRD-K81658952			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21+,23-,25-/m0/s1	UAPJRYKULVRBJS-PYTYSOFPSA-N	481.221285742							102053
BRD-K78948132	LSM-13250		54646011	InChI=1S/C21H27NO7/c1-26-19(24)10-14-9-16-15-8-13(22-21(25)12-4-6-27-7-5-12)2-3-17(15)29-20(16)18(11-23)28-14/h2-3,8,12,14,16,18,20,23H,4-7,9-11H2,1H3,(H,22,25)/t14-,16+,18-,20-/m0/s1	CYYYAXPAVULRAL-HUOQQOJOSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	BroadT	BRD-K78948132	BRD-K78948132-001-01-1	Broad Institute of MIT and Harvard	BRD-K78948132			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	InChI=1S/C21H27NO7/c1-26-19(24)10-14-9-16-15-8-13(22-21(25)12-4-6-27-7-5-12)2-3-17(15)29-20(16)18(11-23)28-14/h2-3,8,12,14,16,18,20,23H,4-7,9-11H2,1H3,(H,22,25)/t14-,16+,18-,20-/m0/s1	CYYYAXPAVULRAL-HUOQQOJOSA-N	405.178752214							101889
BRD-K89952884	LSM-13974		54646054	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20-,22-,25+/m1/s1	ALLGXHRZPBERLG-ZAWIEKPNSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)N[C@H](C)c4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K89952884	BRD-K89952884-001-01-0	Broad Institute of MIT and Harvard	BRD-K89952884			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N[C@H](C)c4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20-,22-,25+/m1/s1	ALLGXHRZPBERLG-ZAWIEKPNSA-N	454.2103867							102627
BRD-K66836247	LSM-12500		54646069	InChI=1S/C22H23F3N2O6S/c23-22(24,25)12-26-20(29)10-14-9-17-16-8-13(27-34(30,31)15-4-2-1-3-5-15)6-7-18(16)33-21(17)19(11-28)32-14/h1-8,14,17,19,21,27-28H,9-12H2,(H,26,29)/t14-,17-,19-,21+/m1/s1	AWBUKOBMSNOSJG-QTRJSKNGSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NS(=O)(=O)c4ccccc4)cc23	BroadT	BRD-K66836247	BRD-K66836247-001-01-4	Broad Institute of MIT and Harvard	BRD-K66836247			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C22H23F3N2O6S/c23-22(24,25)12-26-20(29)10-14-9-17-16-8-13(27-34(30,31)15-4-2-1-3-5-15)6-7-18(16)33-21(17)19(11-28)32-14/h1-8,14,17,19,21,27-28H,9-12H2,(H,26,29)/t14-,17-,19-,21+/m1/s1	AWBUKOBMSNOSJG-QTRJSKNGSA-N	500.122891766							101131
BRD-K16792691	LSM-9446		54645889	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18-,20-,22+/m1/s1	HTNOASUNFPMBNX-ZLLBNUPZSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K16792691	BRD-K16792691-001-01-1	Broad Institute of MIT and Harvard	BRD-K16792691			OC[C@H]1O[C@H](C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21)CC(=O)N(C)C	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18-,20-,22+/m1/s1	HTNOASUNFPMBNX-ZLLBNUPZSA-N	443.185649162							98067
BRD-K89585847	LSM-13950		54645854	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20-,23+/m1/s1	WARQVQDGSWZACN-WVVHNUNQSA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K89585847	BRD-K89585847-001-01-4	Broad Institute of MIT and Harvard	BRD-K89585847			OC[C@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20-,23+/m1/s1	WARQVQDGSWZACN-WVVHNUNQSA-N	414.21547208							102603
BRD-K72066167	LSM-14910		54645994	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23-,25-,27+/m1/s1	MPXYHEQTTLDTMZ-BQGNDZODSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NC5CCCCC5)C[C@@H]4c3c2	BroadT	BRD-K72066167	BRD-K72066167-001-01-6	Broad Institute of MIT and Harvard	BRD-K72066167			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NC4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23-,25-,27+/m1/s1	MPXYHEQTTLDTMZ-BQGNDZODSA-N	530.208672138							103566
BRD-K60334624	LSM-12075		54645914	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28-,32-,34+/m0/s1	HZYAIKCNCGBDKG-MBVGZTCASA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K60334624	BRD-K60334624-001-01-9	Broad Institute of MIT and Harvard	BRD-K60334624			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28-,32-,34+/m0/s1	HZYAIKCNCGBDKG-MBVGZTCASA-N	608.215866004							100701
BRD-K22013971	LSM-9761		54645977	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20+,22-,24-/m0/s1	CJNJMLGGDUQPOS-ZDUIBRFZSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K22013971	BRD-K22013971-001-01-5	Broad Institute of MIT and Harvard	BRD-K22013971			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20+,22-,24-/m0/s1	CJNJMLGGDUQPOS-ZDUIBRFZSA-N	488.161721946							98382
BRD-K10821756	LSM-9086		54646005	InChI=1S/C22H25N3O5/c1-25(2)20(27)10-15-9-17-16-8-14(24-22(28)13-4-3-7-23-11-13)5-6-18(16)30-21(17)19(12-26)29-15/h3-8,11,15,17,19,21,26H,9-10,12H2,1-2H3,(H,24,28)/t15-,17+,19+,21-/m1/s1	IUZUJTQXZTXMFN-ZWVMGRIOSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	BroadT	BRD-K10821756	BRD-K10821756-001-01-6	Broad Institute of MIT and Harvard	BRD-K10821756			CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C22H25N3O5/c1-25(2)20(27)10-15-9-17-16-8-14(24-22(28)13-4-3-7-23-11-13)5-6-18(16)30-21(17)19(12-26)29-15/h3-8,11,15,17,19,21,26H,9-10,12H2,1-2H3,(H,24,28)/t15-,17+,19+,21-/m1/s1	IUZUJTQXZTXMFN-ZWVMGRIOSA-N	411.17942093							97707
BRD-K55082119	LSM-11767		54645848	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22+,24+,26-/m0/s1	MZNDQAVBBCTOIA-JFXHBBLLSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K55082119	BRD-K55082119-001-01-3	Broad Institute of MIT and Harvard	BRD-K55082119			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22+,24+,26-/m0/s1	MZNDQAVBBCTOIA-JFXHBBLLSA-N	527.152634472							100392
BRD-K41667061	LSM-10960		54645865	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,22+,25-/m1/s1	ZGEAGHWTKPKCOK-YONGWMJJSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc5OCOc5c4)C[C@H]3c2c1	BroadT	BRD-K41667061	BRD-K41667061-001-01-6	Broad Institute of MIT and Harvard	BRD-K41667061			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc5OCOc5c4)O[C@H]3CO)c2c1	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,22+,25-/m1/s1	ZGEAGHWTKPKCOK-YONGWMJJSA-N	484.184565876							99581
BRD-K22253301	LSM-9776		54645969	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23+,26-,28-/m0/s1	SYQUHMCSVCULSJ-UKEKDYKDSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@H](CO)O2	BroadT	BRD-K22253301	BRD-K22253301-001-01-8	Broad Institute of MIT and Harvard	BRD-K22253301			COc1ccccc1CNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23+,26-,28-/m0/s1	SYQUHMCSVCULSJ-UKEKDYKDSA-N	585.20867031							98397
BRD-K62014585	LSM-12192		54645921	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23-,25-,27+/m1/s1	PHBUKTREHITDBU-BQGNDZODSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K62014585	BRD-K62014585-001-01-2	Broad Institute of MIT and Harvard	BRD-K62014585			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23-,25-,27+/m1/s1	PHBUKTREHITDBU-BQGNDZODSA-N	547.215234728							100818
BRD-K78761249	LSM-13237		54645870	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24-,28-,30+/m1/s1	DMKXNQOLMYQXCN-YEHIPITKSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K78761249	BRD-K78761249-001-01-8	Broad Institute of MIT and Harvard	BRD-K78761249			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24-,28-,30+/m1/s1	DMKXNQOLMYQXCN-YEHIPITKSA-N	542.20530132							101876
BRD-K77953075	LSM-13199		54646077	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16+,18+,20-/m1/s1	LHGLZDQGJZRLBC-VKSDOSABSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@H](CO)O2	BroadT	BRD-K77953075	BRD-K77953075-001-01-1	Broad Institute of MIT and Harvard	BRD-K77953075			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16+,18+,20-/m1/s1	LHGLZDQGJZRLBC-VKSDOSABSA-N	439.177706368							101837
BRD-K16121755	LSM-9400		54646052	InChI=1S/C24H30N2O5/c1-26(2)16-8-9-21-18(10-16)19-11-17(30-22(14-27)24(19)31-21)12-23(28)25-13-15-6-4-5-7-20(15)29-3/h4-10,17,19,22,24,27H,11-14H2,1-3H3,(H,25,28)/t17-,19-,22+,24+/m1/s1	YXRWVZTUBKEEPU-ZNMLIKKZSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(cc34)N(C)C)[C@H](CO)O2	BroadT	BRD-K16121755	BRD-K16121755-001-01-6	Broad Institute of MIT and Harvard	BRD-K16121755			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(cc23)N(C)C)[C@H](CO)O1	InChI=1S/C24H30N2O5/c1-26(2)16-8-9-21-18(10-16)19-11-17(30-22(14-27)24(19)31-21)12-23(28)25-13-15-6-4-5-7-20(15)29-3/h4-10,17,19,22,24,27H,11-14H2,1-3H3,(H,25,28)/t17-,19-,22+,24+/m1/s1	YXRWVZTUBKEEPU-ZNMLIKKZSA-N	426.21547208							98021
BRD-K74625930	LSM-13000		54645893	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18+,20-,22-/m1/s1	HTNOASUNFPMBNX-HOQQESESSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K74625930	BRD-K74625930-001-01-3	Broad Institute of MIT and Harvard	BRD-K74625930			OC[C@H]1O[C@H](C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21)CC(=O)N(C)C	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18+,20-,22-/m1/s1	HTNOASUNFPMBNX-HOQQESESSA-N	443.185649162							101637
BRD-K00740489	LSM-8480		54646085	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,24-/m1/s1	WYDHQCWIOCTAOJ-HJBWUJCXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K00740489	BRD-K00740489-001-01-4	Broad Institute of MIT and Harvard	BRD-K00740489			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22+,24-/m1/s1	WYDHQCWIOCTAOJ-HJBWUJCXSA-N	451.210721058							97101
BRD-K72081524	LSM-12845		54645905	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19-,21-,23+/m1/s1	TVZJESBMTOHXDE-LHWDRQQYSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCCc4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K72081524	BRD-K72081524-001-01-3	Broad Institute of MIT and Harvard	BRD-K72081524			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCCc4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19-,21-,23+/m1/s1	TVZJESBMTOHXDE-LHWDRQQYSA-N	460.166807326							101482
BRD-K86846131	LSM-13754		54645940	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21+,24-,26-,28+/m0/s1	SUQCIPRCFCPKOO-MNMPLEIHSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K86846131	BRD-K86846131-001-01-8	Broad Institute of MIT and Harvard	BRD-K86846131			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21+,24-,26-,28+/m0/s1	SUQCIPRCFCPKOO-MNMPLEIHSA-N	540.173035558							102403
BRD-K96121225	LSM-14327		54646066	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20-,22+,25+/m0/s1	ALLGXHRZPBERLG-WTCIDABWSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)N[C@@H](C)c4ccccc4)C[C@H]3c2c1	BroadT	BRD-K96121225	BRD-K96121225-001-01-1	Broad Institute of MIT and Harvard	BRD-K96121225			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N[C@@H](C)c4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20-,22+,25+/m0/s1	ALLGXHRZPBERLG-WTCIDABWSA-N	454.2103867							102981
BRD-K31680744	LSM-10348		54645903	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21-,23+,25+/m0/s1	UAPJRYKULVRBJS-FEGXGRLVSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K31680744	BRD-K31680744-001-01-6	Broad Institute of MIT and Harvard	BRD-K31680744			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21-,23+,25+/m0/s1	UAPJRYKULVRBJS-FEGXGRLVSA-N	481.221285742							98969
BRD-K10680649	LSM-9072		54645811	InChI=1S/C23H27FN2O4/c1-26(2)16-6-7-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-4-3-5-15(24)8-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19-,21+,23+/m0/s1	WXYXTVXIMWIJFY-VARILPKDSA-N	CN(C)c1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cccc(F)c4)C[C@H]3c2c1	BroadT	BRD-K10680649	BRD-K10680649-001-01-7	Broad Institute of MIT and Harvard	BRD-K10680649			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cccc(F)c4)O[C@@H]3CO)c2c1	InChI=1S/C23H27FN2O4/c1-26(2)16-6-7-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-4-3-5-15(24)8-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19-,21+,23+/m0/s1	WXYXTVXIMWIJFY-VARILPKDSA-N	414.195485564							97693
BRD-K74796495	LSM-13011		54645882	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21-,24-,26+/m1/s1	MSBIHNOYSLVJHR-UNMCOINBSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K74796495	BRD-K74796495-001-01-9	Broad Institute of MIT and Harvard	BRD-K74796495			OC[C@H]1O[C@@H](CC(=O)NCc2ccccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21-,24-,26+/m1/s1	MSBIHNOYSLVJHR-UNMCOINBSA-N	497.232599354							101648
BRD-K64380185	LSM-12356		54645912	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19-,21+,23+/m1/s1	TVZJESBMTOHXDE-YZBYQZESSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCCc4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K64380185	BRD-K64380185-001-01-9	Broad Institute of MIT and Harvard	BRD-K64380185			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCCc4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19-,21+,23+/m1/s1	TVZJESBMTOHXDE-YZBYQZESSA-N	460.166807326							100983
BRD-K10894258	LSM-9095		54645973	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20-,22-,24+/m0/s1	CJNJMLGGDUQPOS-LGCHTUQSSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K10894258	BRD-K10894258-001-01-6	Broad Institute of MIT and Harvard	BRD-K10894258			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20-,22-,24+/m0/s1	CJNJMLGGDUQPOS-LGCHTUQSSA-N	488.161721946							97716
BRD-K18132838	LSM-9514		54646060	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20-,22-,25+/m0/s1	ALLGXHRZPBERLG-GNSKSMBTSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)N[C@@H](C)c4ccccc4)C[C@H]3c2c1	BroadT	BRD-K18132838	BRD-K18132838-001-01-2	Broad Institute of MIT and Harvard	BRD-K18132838			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N[C@@H](C)c4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20-,22-,25+/m0/s1	ALLGXHRZPBERLG-GNSKSMBTSA-N	454.2103867							98135
CHEMBL3560047	LSM-34891	BRD-K71337947	54645979	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23-,25-,27+/m0/s1	HYQMBLXITOJPAN-NTYBTQPHSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K71337947	BRD-K71337947-001-01-9	Broad Institute of MIT and Harvard	BRD-K71337947			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23-,25-,27+/m0/s1	HYQMBLXITOJPAN-NTYBTQPHSA-N	487.210721058							123449
BRD-K03210181	LSM-8631		54646097	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18-,22+,24+/m1/s1	RREKHFLFIWGNNG-SDZNXMPUSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K03210181	BRD-K03210181-001-01-6	Broad Institute of MIT and Harvard	BRD-K03210181			OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18-,22+,24+/m1/s1	RREKHFLFIWGNNG-SDZNXMPUSA-N	485.196213846							97252
BRD-K24077273	LSM-9883		54645967	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23+,26+,28-/m1/s1	SYQUHMCSVCULSJ-DTZJUZMMSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@H](CO)O2	BroadT	BRD-K24077273	BRD-K24077273-001-01-3	Broad Institute of MIT and Harvard	BRD-K24077273			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23+,26+,28-/m1/s1	SYQUHMCSVCULSJ-DTZJUZMMSA-N	585.20867031							98504
BRD-K81736443	LSM-13421		54645966	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23-,26-,28+/m0/s1	SYQUHMCSVCULSJ-ZVMBZZGVSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@H](CO)O2	BroadT	BRD-K81736443	BRD-K81736443-001-01-9	Broad Institute of MIT and Harvard	BRD-K81736443			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23-,26-,28+/m0/s1	SYQUHMCSVCULSJ-ZVMBZZGVSA-N	585.20867031							102061
BRD-K52460145	LSM-11636		54645899	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21+,23+,25-/m0/s1	UAPJRYKULVRBJS-VUHNXCBZSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K52460145	BRD-K52460145-001-01-2	Broad Institute of MIT and Harvard	BRD-K52460145			OC[C@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21+,23+,25-/m0/s1	UAPJRYKULVRBJS-VUHNXCBZSA-N	481.221285742							100261
BRD-K74458364	LSM-12988		54646020	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22-,26+,28+/m0/s1	WXIRIDSMDJYJEU-PWGWJTMSSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K74458364	BRD-K74458364-001-01-4	Broad Institute of MIT and Harvard	BRD-K74458364			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22-,26+,28+/m0/s1	WXIRIDSMDJYJEU-PWGWJTMSSA-N	537.24750049							101625
BRD-K01520595	LSM-8527		54645829	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25-,27-,29+/m0/s1	HHNPVBFCYHNCMG-HGAMEBRSSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K01520595	BRD-K01520595-001-01-0	Broad Institute of MIT and Harvard	BRD-K01520595			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25-,27-,29+/m0/s1	HHNPVBFCYHNCMG-HGAMEBRSSA-N	581.21375569							97148
BRD-K56452877	LSM-11843		54645846	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22-,24-,26+/m1/s1	MZNDQAVBBCTOIA-DBSKKGOSSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K56452877	BRD-K56452877-001-01-9	Broad Institute of MIT and Harvard	BRD-K56452877			OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22-,24-,26+/m1/s1	MZNDQAVBBCTOIA-DBSKKGOSSA-N	527.152634472							100469
BRD-K60700659	LSM-12096		54645818	InChI=1S/C27H39N3O6/c31-17-24-26-22(15-20(35-24)16-25(32)28-8-11-30-9-2-1-3-10-30)21-14-19(4-5-23(21)36-26)29-27(33)18-6-12-34-13-7-18/h4-5,14,18,20,22,24,26,31H,1-3,6-13,15-17H2,(H,28,32)(H,29,33)/t20-,22+,24-,26-/m0/s1	XIMMKRXXDKAOMK-YXOQKGKWSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K60700659	BRD-K60700659-001-01-9	Broad Institute of MIT and Harvard	BRD-K60700659			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H39N3O6/c31-17-24-26-22(15-20(35-24)16-25(32)28-8-11-30-9-2-1-3-10-30)21-14-19(4-5-23(21)36-26)29-27(33)18-6-12-34-13-7-18/h4-5,14,18,20,22,24,26,31H,1-3,6-13,15-17H2,(H,28,32)(H,29,33)/t20-,22+,24-,26-/m0/s1	XIMMKRXXDKAOMK-YXOQKGKWSA-N	501.283885998							100722
BRD-K78939963	LSM-13249		54646082	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,24+/m1/s1	WYDHQCWIOCTAOJ-YWWGLXIYSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K78939963	BRD-K78939963-001-01-4	Broad Institute of MIT and Harvard	BRD-K78939963			OC[C@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,24+/m1/s1	WYDHQCWIOCTAOJ-YWWGLXIYSA-N	451.210721058							101888
BRD-K24550549	LSM-9917		54645874	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24+,28-,30-/m1/s1	DMKXNQOLMYQXCN-HHMXAWFKSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K24550549	BRD-K24550549-001-01-7	Broad Institute of MIT and Harvard	BRD-K24550549			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24+,28-,30-/m1/s1	DMKXNQOLMYQXCN-HHMXAWFKSA-N	542.20530132							98538
BRD-K19825378	LSM-9627		54645856	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20+,23-/m0/s1	WARQVQDGSWZACN-MVIJMRCYSA-N	OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K19825378	BRD-K19825378-001-01-6	Broad Institute of MIT and Harvard	BRD-K19825378			OC[C@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20+,23-/m0/s1	WARQVQDGSWZACN-MVIJMRCYSA-N	414.21547208							98248
CHEMBL2356697	LSM-11433	BRD-K49434056, SID131442372	54645999	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23+,25-,27-/m0/s1	MPXYHEQTTLDTMZ-OGMXRKNYSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NC5CCCCC5)C[C@@H]4c3c2	BroadT	BRD-K49434056	BRD-K49434056-001-01-0	Broad Institute of MIT and Harvard	BRD-K49434056			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NC4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23+,25-,27-/m0/s1	MPXYHEQTTLDTMZ-OGMXRKNYSA-N	530.208672138							100054
BRD-K09935385	LSM-9040		54645897	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21-,23-,25+/m1/s1	UAPJRYKULVRBJS-YTAKYCMFSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K09935385	BRD-K09935385-001-01-6	Broad Institute of MIT and Harvard	BRD-K09935385			OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21-,23-,25+/m1/s1	UAPJRYKULVRBJS-YTAKYCMFSA-N	481.221285742							97661
BRD-K55713064	LSM-11802		54645944	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24+,26-,28-/m1/s1	SUQCIPRCFCPKOO-YFSMRKRJSA-N	C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K55713064	BRD-K55713064-001-01-8	Broad Institute of MIT and Harvard	BRD-K55713064			C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24+,26-,28-/m1/s1	SUQCIPRCFCPKOO-YFSMRKRJSA-N	540.173035558							100427
BRD-K42170810	LSM-10988		54646102	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21-,23-/m0/s1	GJVLYDQXVFQAHZ-RZNKLVQRSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)N(C)C)C[C@@H]4c3c2	BroadT	BRD-K42170810	BRD-K42170810-001-01-4	Broad Institute of MIT and Harvard	BRD-K42170810			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21-,23-/m0/s1	GJVLYDQXVFQAHZ-RZNKLVQRSA-N	476.161721946							99609
BRD-K06228572	LSM-8792		54645949	InChI=1S/C24H32N2O5/c27-13-21-23-19(11-17(30-21)12-22(28)25-15-6-1-2-7-15)18-10-16(8-9-20(18)31-23)26-24(29)14-4-3-5-14/h8-10,14-15,17,19,21,23,27H,1-7,11-13H2,(H,25,28)(H,26,29)/t17-,19-,21-,23+/m1/s1	MOMUNQNAFOIKEQ-LHWDRQQYSA-N	OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K06228572	BRD-K06228572-001-01-2	Broad Institute of MIT and Harvard	BRD-K06228572			OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C24H32N2O5/c27-13-21-23-19(11-17(30-21)12-22(28)25-15-6-1-2-7-15)18-10-16(8-9-20(18)31-23)26-24(29)14-4-3-5-14/h8-10,14-15,17,19,21,23,27H,1-7,11-13H2,(H,25,28)(H,26,29)/t17-,19-,21-,23+/m1/s1	MOMUNQNAFOIKEQ-LHWDRQQYSA-N	428.231122144							97413
BRD-K27706744	LSM-10097		54645907	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19+,21+,23-/m0/s1	TVZJESBMTOHXDE-GBPFJNKXSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCCc4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K27706744	BRD-K27706744-001-01-5	Broad Institute of MIT and Harvard	BRD-K27706744			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCCc4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19+,21+,23-/m0/s1	TVZJESBMTOHXDE-GBPFJNKXSA-N	460.166807326							98718
BRD-K44341698	LSM-11131		54645988	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25-,27-,29+/m0/s1	RHYJRBPAXZYDBS-JZRJJGTOSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K44341698	BRD-K44341698-001-01-6	Broad Institute of MIT and Harvard	BRD-K44341698			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25-,27-,29+/m0/s1	RHYJRBPAXZYDBS-JZRJJGTOSA-N	552.173035558							99752
CHEMBL3184376	LSM-12566	BRD-K67862512	54645919	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28-,32+,34+/m0/s1	HZYAIKCNCGBDKG-WDLXLEKTSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K67862512	BRD-K67862512-001-01-7	Broad Institute of MIT and Harvard	BRD-K67862512			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28-,32+,34+/m0/s1	HZYAIKCNCGBDKG-WDLXLEKTSA-N	608.215866004							101197
BRD-K58358247	LSM-11948		54645827	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-15-11-17-16-10-14(7-8-20(16)33-23(17)21(13-29)32-15)27-24(31)28-19-6-4-3-5-18(19)25/h3-8,10,15,17,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,17-,21+,23+/m1/s1	KFOACEMMMUKWEO-UNXOBOICSA-N	CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	BroadT	BRD-K58358247	BRD-K58358247-001-01-9	Broad Institute of MIT and Harvard	BRD-K58358247			CCCNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@H](CO)O1	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-15-11-17-16-10-14(7-8-20(16)33-23(17)21(13-29)32-15)27-24(31)28-19-6-4-3-5-18(19)25/h3-8,10,15,17,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,17-,21+,23+/m1/s1	KFOACEMMMUKWEO-UNXOBOICSA-N	457.201299226							100574
BRD-K37255594	LSM-10677		54645900	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21+,23+,25-/m1/s1	UAPJRYKULVRBJS-IQKBUIRBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K37255594	BRD-K37255594-001-01-2	Broad Institute of MIT and Harvard	BRD-K37255594			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21+,23+,25-/m1/s1	UAPJRYKULVRBJS-IQKBUIRBSA-N	481.221285742							99298
BRD-K74659043	LSM-13004		54646039	InChI=1S/C21H22N2O6/c24-11-18-21-16(9-14(28-18)10-20(26)27)15-8-13(1-2-17(15)29-21)23-19(25)7-12-3-5-22-6-4-12/h1-6,8,14,16,18,21,24H,7,9-11H2,(H,23,25)(H,26,27)/t14-,16-,18-,21+/m0/s1	ZIYVXDMGZAADAL-YZZRYBLGSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Cc4ccncc4)cc23	BroadT	BRD-K74659043	BRD-K74659043-001-01-6	Broad Institute of MIT and Harvard	BRD-K74659043			OC[C@@H]1O[C@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C21H22N2O6/c24-11-18-21-16(9-14(28-18)10-20(26)27)15-8-13(1-2-17(15)29-21)23-19(25)7-12-3-5-22-6-4-12/h1-6,8,14,16,18,21,24H,7,9-11H2,(H,23,25)(H,26,27)/t14-,16-,18-,21+/m0/s1	ZIYVXDMGZAADAL-YZZRYBLGSA-N	398.147786444							101641
BRD-K03496708	LSM-8650		54645817	InChI=1S/C27H39N3O6/c31-17-24-26-22(15-20(35-24)16-25(32)28-8-11-30-9-2-1-3-10-30)21-14-19(4-5-23(21)36-26)29-27(33)18-6-12-34-13-7-18/h4-5,14,18,20,22,24,26,31H,1-3,6-13,15-17H2,(H,28,32)(H,29,33)/t20-,22+,24-,26-/m1/s1	XIMMKRXXDKAOMK-FWSIMYTDSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K03496708	BRD-K03496708-001-01-5	Broad Institute of MIT and Harvard	BRD-K03496708			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H39N3O6/c31-17-24-26-22(15-20(35-24)16-25(32)28-8-11-30-9-2-1-3-10-30)21-14-19(4-5-23(21)36-26)29-27(33)18-6-12-34-13-7-18/h4-5,14,18,20,22,24,26,31H,1-3,6-13,15-17H2,(H,28,32)(H,29,33)/t20-,22+,24-,26-/m1/s1	XIMMKRXXDKAOMK-FWSIMYTDSA-N	501.283885998							97271
BRD-K23897871	LSM-9871		54646099	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21-,23+/m0/s1	GJVLYDQXVFQAHZ-RAQQXGOJSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@H](CC(=O)N(C)C)C[C@H]4c3c2	BroadT	BRD-K23897871	BRD-K23897871-001-01-1	Broad Institute of MIT and Harvard	BRD-K23897871			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21-,23+/m0/s1	GJVLYDQXVFQAHZ-RAQQXGOJSA-N	476.161721946							98492
BRD-K49948755	LSM-11466		54645803	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16+,20-,22-/m1/s1	HFIMGBHSBJMCIP-SQKDIAQBSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	BroadT	BRD-K49948755	BRD-K49948755-001-01-3	Broad Institute of MIT and Harvard	BRD-K49948755			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16+,20-,22-/m1/s1	HFIMGBHSBJMCIP-SQKDIAQBSA-N	441.142366706							100087
CHEMBL2356313	LSM-9823	BRD-K23018071, SID131442204	54645831	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25+,27+,29-/m1/s1	HHNPVBFCYHNCMG-KYYACDKCSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K23018071	BRD-K23018071-001-01-2	Broad Institute of MIT and Harvard	BRD-K23018071			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25+,27+,29-/m1/s1	HHNPVBFCYHNCMG-KYYACDKCSA-N	581.21375569							98444
BRD-K15260875	LSM-9344		54646110	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16+,18-,20-/m0/s1	RRHNJWQDAKAZMZ-HUOQQOJOSA-N	OC[C@@H]1O[C@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23	BroadT	BRD-K15260875	BRD-K15260875-001-01-8	Broad Institute of MIT and Harvard	BRD-K15260875			OC[C@@H]1O[C@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16+,18-,20-/m0/s1	RRHNJWQDAKAZMZ-HUOQQOJOSA-N	466.135171012							97965
BRD-K53406626	LSM-11685		54645896	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18-,20+,22+/m1/s1	HTNOASUNFPMBNX-MDRHQERFSA-N	CN(C)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K53406626	BRD-K53406626-001-01-2	Broad Institute of MIT and Harvard	BRD-K53406626			OC[C@@H]1O[C@H](C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21)CC(=O)N(C)C	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18-,20+,22+/m1/s1	HTNOASUNFPMBNX-MDRHQERFSA-N	443.185649162							100310
BRD-K02280251	LSM-8574		54645878	InChI=1S/C24H26F3N3O6/c1-34-15-5-2-13(3-6-15)29-23(33)30-14-4-7-19-17(8-14)18-9-16(35-20(11-31)22(18)36-19)10-21(32)28-12-24(25,26)27/h2-8,16,18,20,22,31H,9-12H2,1H3,(H,28,32)(H2,29,30,33)/t16-,18-,20-,22+/m1/s1	SPGVKSWBRQENOP-ZLLBNUPZSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@@H](CO)O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]4c3c2)cc1	BroadT	BRD-K02280251	BRD-K02280251-001-01-5	Broad Institute of MIT and Harvard	BRD-K02280251			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)NCC(F)(F)F)O[C@@H]4CO)c3c2)cc1	InChI=1S/C24H26F3N3O6/c1-34-15-5-2-13(3-6-15)29-23(33)30-14-4-7-19-17(8-14)18-9-16(35-20(11-31)22(18)36-19)10-21(32)28-12-24(25,26)27/h2-8,16,18,20,22,31H,9-12H2,1H3,(H,28,32)(H2,29,30,33)/t16-,18-,20-,22+/m1/s1	SPGVKSWBRQENOP-ZLLBNUPZSA-N	509.177370182							97195
BRD-K28508449	LSM-10154		54645935	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21-,24+,26+/m1/s1	MRHMXTIRULDPKA-HUZKPYMCSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K28508449	BRD-K28508449-001-01-2	Broad Institute of MIT and Harvard	BRD-K28508449			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21-,24+,26+/m1/s1	MRHMXTIRULDPKA-HUZKPYMCSA-N	509.17622733							98775
BRD-K07877451	LSM-8903		54646108	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16+,18+,20-/m1/s1	RRHNJWQDAKAZMZ-VKSDOSABSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23	BroadT	BRD-K07877451	BRD-K07877451-001-01-1	Broad Institute of MIT and Harvard	BRD-K07877451			OC[C@@H]1O[C@@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16+,18+,20-/m1/s1	RRHNJWQDAKAZMZ-VKSDOSABSA-N	466.135171012							97524
BRD-K96634415	LSM-14359		54646028	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20-,22+,24+/m0/s1	GFIPGJIGSRXJBU-YCYVKTGYSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K96634415	BRD-K96634415-001-01-3	Broad Institute of MIT and Harvard	BRD-K96634415			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20-,22+,24+/m0/s1	GFIPGJIGSRXJBU-YCYVKTGYSA-N	457.25767125							103013
BRD-K60776198	LSM-12103		54645930	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21-,24-,26+/m0/s1	MRHMXTIRULDPKA-YKNOVDGGSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K60776198	BRD-K60776198-001-01-7	Broad Institute of MIT and Harvard	BRD-K60776198			OC[C@@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21-,24-,26+/m0/s1	MRHMXTIRULDPKA-YKNOVDGGSA-N	509.17622733							100729
BRD-K73171326	LSM-12911		54646079	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16+,18-,20-/m0/s1	LHGLZDQGJZRLBC-HUOQQOJOSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@H](CO)O2	BroadT	BRD-K73171326	BRD-K73171326-001-01-1	Broad Institute of MIT and Harvard	BRD-K73171326			CN1CCN(CC1)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16+,18-,20-/m0/s1	LHGLZDQGJZRLBC-HUOQQOJOSA-N	439.177706368							101548
CHEMBL2355314	LSM-9253	BRD-K13691358, SID131442320	54645947	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24-,26+,28+/m1/s1	SUQCIPRCFCPKOO-CPKADCMZSA-N	C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K13691358	BRD-K13691358-001-01-2	Broad Institute of MIT and Harvard	BRD-K13691358			C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24-,26+,28+/m1/s1	SUQCIPRCFCPKOO-CPKADCMZSA-N	540.173035558							97874
BRD-K65456352	LSM-12420		54645909	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19+,21-,23-/m1/s1	TVZJESBMTOHXDE-GUBFDYSESA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCCc4ccccc4)C[C@H]3c2c1	BroadT	BRD-K65456352	BRD-K65456352-001-01-3	Broad Institute of MIT and Harvard	BRD-K65456352			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCCc4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19+,21-,23-/m1/s1	TVZJESBMTOHXDE-GUBFDYSESA-N	460.166807326							101047
BRD-K33451389	LSM-10456		54645962	InChI=1S/C21H28N2O7/c1-27-12-19(25)22-13-2-3-17-15(8-13)16-9-14(29-18(11-24)21(16)30-17)10-20(26)23-4-6-28-7-5-23/h2-3,8,14,16,18,21,24H,4-7,9-12H2,1H3,(H,22,25)/t14-,16+,18-,21-/m0/s1	YLZXNIXKCHRFQK-WTFQOOOSSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)N4CCOCC4)C[C@@H]3c2c1	BroadT	BRD-K33451389	BRD-K33451389-001-01-0	Broad Institute of MIT and Harvard	BRD-K33451389			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N4CCOCC4)O[C@H]3CO)c2c1	InChI=1S/C21H28N2O7/c1-27-12-19(25)22-13-2-3-17-15(8-13)16-9-14(29-18(11-24)21(16)30-17)10-20(26)23-4-6-28-7-5-23/h2-3,8,14,16,18,21,24H,4-7,9-12H2,1H3,(H,22,25)/t14-,16+,18-,21-/m0/s1	YLZXNIXKCHRFQK-WTFQOOOSSA-N	420.189651256							99077
BRD-K66328731	LSM-12469		54645888	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21-,24+,26+/m1/s1	MSBIHNOYSLVJHR-HUZKPYMCSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K66328731	BRD-K66328731-001-01-5	Broad Institute of MIT and Harvard	BRD-K66328731			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21-,24+,26+/m1/s1	MSBIHNOYSLVJHR-HUZKPYMCSA-N	497.232599354							101100
BRD-K82204596	LSM-13453		54645805	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16-,20+,22+/m0/s1	HFIMGBHSBJMCIP-MFYXDEDASA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	BroadT	BRD-K82204596	BRD-K82204596-001-01-2	Broad Institute of MIT and Harvard	BRD-K82204596			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16-,20+,22+/m0/s1	HFIMGBHSBJMCIP-MFYXDEDASA-N	441.142366706							102093
BRD-K33057338	LSM-10440		54646057	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20+,22+,25-/m0/s1	ALLGXHRZPBERLG-NRWGMYOFSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)N[C@@H](C)c4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K33057338	BRD-K33057338-001-01-7	Broad Institute of MIT and Harvard	BRD-K33057338			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N[C@@H](C)c4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20+,22+,25-/m0/s1	ALLGXHRZPBERLG-NRWGMYOFSA-N	454.2103867							99061
BRD-K54729370	LSM-11749		54645880	InChI=1S/C24H26F3N3O6/c1-34-15-5-2-13(3-6-15)29-23(33)30-14-4-7-19-17(8-14)18-9-16(35-20(11-31)22(18)36-19)10-21(32)28-12-24(25,26)27/h2-8,16,18,20,22,31H,9-12H2,1H3,(H,28,32)(H2,29,30,33)/t16-,18+,20-,22-/m0/s1	SPGVKSWBRQENOP-UPSSIMKTSA-N	COc1ccc(NC(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]4c3c2)cc1	BroadT	BRD-K54729370	BRD-K54729370-001-01-4	Broad Institute of MIT and Harvard	BRD-K54729370			COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@@H](CC(=O)NCC(F)(F)F)O[C@H]4CO)c3c2)cc1	InChI=1S/C24H26F3N3O6/c1-34-15-5-2-13(3-6-15)29-23(33)30-14-4-7-19-17(8-14)18-9-16(35-20(11-31)22(18)36-19)10-21(32)28-12-24(25,26)27/h2-8,16,18,20,22,31H,9-12H2,1H3,(H,28,32)(H2,29,30,33)/t16-,18+,20-,22-/m0/s1	SPGVKSWBRQENOP-UPSSIMKTSA-N	509.177370182							100374
BRD-K21558506	LSM-9738		54645853	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22-,24+,26+/m1/s1	MZNDQAVBBCTOIA-IXVWUCSXSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K21558506	BRD-K21558506-001-01-4	Broad Institute of MIT and Harvard	BRD-K21558506			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22-,24+,26+/m1/s1	MZNDQAVBBCTOIA-IXVWUCSXSA-N	527.152634472							98359
BRD-K75383594	LSM-13039		54646055	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20-,22-,25+/m0/s1	ALLGXHRZPBERLG-ZSIZCVMNSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)N[C@@H](C)c4ccccc4)C[C@H]3c2c1	BroadT	BRD-K75383594	BRD-K75383594-001-01-5	Broad Institute of MIT and Harvard	BRD-K75383594			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N[C@@H](C)c4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20-,22-,25+/m0/s1	ALLGXHRZPBERLG-ZSIZCVMNSA-N	454.2103867							101676
BRD-K19416218	LSM-9599		54645799	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16-,20-,22+/m1/s1	HFIMGBHSBJMCIP-YKHKRFOZSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	BroadT	BRD-K19416218	BRD-K19416218-001-01-8	Broad Institute of MIT and Harvard	BRD-K19416218			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16-,20-,22+/m1/s1	HFIMGBHSBJMCIP-YKHKRFOZSA-N	441.142366706							98220
BRD-K65504774	LSM-12426		54646096	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18-,22+,24+/m0/s1	RREKHFLFIWGNNG-IGSZLMQBSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K65504774	BRD-K65504774-001-01-0	Broad Institute of MIT and Harvard	BRD-K65504774			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18-,22+,24+/m0/s1	RREKHFLFIWGNNG-IGSZLMQBSA-N	485.196213846							101053
BRD-K63602071	LSM-12302		54645983	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23+,25-,27-/m0/s1	HYQMBLXITOJPAN-HFFYFMGZSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K63602071	BRD-K63602071-001-01-4	Broad Institute of MIT and Harvard	BRD-K63602071			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23+,25-,27-/m0/s1	HYQMBLXITOJPAN-HFFYFMGZSA-N	487.210721058							100929
BRD-K82502275	LSM-13470		54646016	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22+,26+,28-/m0/s1	WXIRIDSMDJYJEU-PJDAHJOFSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K82502275	BRD-K82502275-001-01-7	Broad Institute of MIT and Harvard	BRD-K82502275			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22+,26+,28-/m0/s1	WXIRIDSMDJYJEU-PJDAHJOFSA-N	537.24750049							102110
BRD-K90830329	LSM-14018		54646024	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20+,22+,24-/m0/s1	GFIPGJIGSRXJBU-AYEZKCMBSA-N	OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K90830329	BRD-K90830329-001-01-8	Broad Institute of MIT and Harvard	BRD-K90830329			OC[C@H]1O[C@H](CC(=O)N2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20+,22+,24-/m0/s1	GFIPGJIGSRXJBU-AYEZKCMBSA-N	457.25767125							102671
BRD-K83486374	LSM-13534		54645932	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21+,24+,26-/m1/s1	MRHMXTIRULDPKA-ZHRNDHIYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K83486374	BRD-K83486374-001-01-2	Broad Institute of MIT and Harvard	BRD-K83486374			OC[C@@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21+,24+,26-/m1/s1	MRHMXTIRULDPKA-ZHRNDHIYSA-N	509.17622733							102176
BRD-K25994126	LSM-10004		54645954	InChI=1S/C24H32N2O5/c27-13-21-23-19(11-17(30-21)12-22(28)25-15-6-1-2-7-15)18-10-16(8-9-20(18)31-23)26-24(29)14-4-3-5-14/h8-10,14-15,17,19,21,23,27H,1-7,11-13H2,(H,25,28)(H,26,29)/t17-,19+,21-,23-/m0/s1	MOMUNQNAFOIKEQ-FTJYFCJYSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K25994126	BRD-K25994126-001-01-7	Broad Institute of MIT and Harvard	BRD-K25994126			OC[C@@H]1O[C@H](CC(=O)NC2CCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C24H32N2O5/c27-13-21-23-19(11-17(30-21)12-22(28)25-15-6-1-2-7-15)18-10-16(8-9-20(18)31-23)26-24(29)14-4-3-5-14/h8-10,14-15,17,19,21,23,27H,1-7,11-13H2,(H,25,28)(H,26,29)/t17-,19+,21-,23-/m0/s1	MOMUNQNAFOIKEQ-FTJYFCJYSA-N	428.231122144							98625
BRD-K47102646	LSM-11305		54645963	InChI=1S/C21H28N2O7/c1-27-12-19(25)22-13-2-3-17-15(8-13)16-9-14(29-18(11-24)21(16)30-17)10-20(26)23-4-6-28-7-5-23/h2-3,8,14,16,18,21,24H,4-7,9-12H2,1H3,(H,22,25)/t14-,16-,18+,21+/m0/s1	YLZXNIXKCHRFQK-XYPVVTQSSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)N4CCOCC4)C[C@H]3c2c1	BroadT	BRD-K47102646	BRD-K47102646-001-01-2	Broad Institute of MIT and Harvard	BRD-K47102646			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N4CCOCC4)O[C@@H]3CO)c2c1	InChI=1S/C21H28N2O7/c1-27-12-19(25)22-13-2-3-17-15(8-13)16-9-14(29-18(11-24)21(16)30-17)10-20(26)23-4-6-28-7-5-23/h2-3,8,14,16,18,21,24H,4-7,9-12H2,1H3,(H,22,25)/t14-,16-,18+,21+/m0/s1	YLZXNIXKCHRFQK-XYPVVTQSSA-N	420.189651256							99926
BRD-K48306626	LSM-11368		54646087	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,24-/m0/s1	WYDHQCWIOCTAOJ-FVSDWULHSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K48306626	BRD-K48306626-001-01-2	Broad Institute of MIT and Harvard	BRD-K48306626			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20+,22-,24-/m0/s1	WYDHQCWIOCTAOJ-FVSDWULHSA-N	451.210721058							99989
BRD-K61123818	LSM-12128		54645849	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22+,24+,26-/m1/s1	MZNDQAVBBCTOIA-WUHHYYHUSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K61123818	BRD-K61123818-001-01-1	Broad Institute of MIT and Harvard	BRD-K61123818			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22+,24+,26-/m1/s1	MZNDQAVBBCTOIA-WUHHYYHUSA-N	527.152634472							100754
BRD-K28043081	LSM-10129		54646083	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,24+/m0/s1	WYDHQCWIOCTAOJ-UYLMIGBBSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K28043081	BRD-K28043081-001-01-3	Broad Institute of MIT and Harvard	BRD-K28043081			OC[C@@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22-,24+/m0/s1	WYDHQCWIOCTAOJ-UYLMIGBBSA-N	451.210721058							98750
BRD-K66646581	LSM-12488		54645945	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24-,26+,28+/m0/s1	SUQCIPRCFCPKOO-WIHQZPQOSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K66646581	BRD-K66646581-001-01-1	Broad Institute of MIT and Harvard	BRD-K66646581			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24-,26+,28+/m0/s1	SUQCIPRCFCPKOO-WIHQZPQOSA-N	540.173035558							101119
BRD-K68701561	LSM-12619		54645841	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22+,24-,26-/m0/s1	QQFSWHWRRZLIPD-YXOQKGKWSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K68701561	BRD-K68701561-001-01-6	Broad Institute of MIT and Harvard	BRD-K68701561			COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@H](CO)O2)cc1	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22+,24-,26-/m0/s1	QQFSWHWRRZLIPD-YXOQKGKWSA-N	480.226036764							101251
BRD-K28223745	LSM-10137		54646012	InChI=1S/C21H27NO7/c1-26-19(24)10-14-9-16-15-8-13(22-21(25)12-4-6-27-7-5-12)2-3-17(15)29-20(16)18(11-23)28-14/h2-3,8,12,14,16,18,20,23H,4-7,9-11H2,1H3,(H,22,25)/t14-,16-,18+,20+/m0/s1	CYYYAXPAVULRAL-LBLLVPRASA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K28223745	BRD-K28223745-001-01-9	Broad Institute of MIT and Harvard	BRD-K28223745			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	InChI=1S/C21H27NO7/c1-26-19(24)10-14-9-16-15-8-13(22-21(25)12-4-6-27-7-5-12)2-3-17(15)29-20(16)18(11-23)28-14/h2-3,8,12,14,16,18,20,23H,4-7,9-11H2,1H3,(H,22,25)/t14-,16-,18+,20+/m0/s1	CYYYAXPAVULRAL-LBLLVPRASA-N	405.178752214							98758
BRD-K13891716	LSM-9269		54646036	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17-,20+,22+/m0/s1	IELDZLYSVNRCSJ-RRZHCZHMSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cc(F)ccc4F)C[C@H]3c2c1	BroadT	BRD-K13891716	BRD-K13891716-001-01-5	Broad Institute of MIT and Harvard	BRD-K13891716			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cc(F)ccc4F)O[C@@H]3CO)c2c1	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17-,20+,22+/m0/s1	IELDZLYSVNRCSJ-RRZHCZHMSA-N	482.132313598							97890
BRD-K60011163	LSM-12056		54646019	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22+,26-,28-/m0/s1	WXIRIDSMDJYJEU-HYRFHYEVSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K60011163	BRD-K60011163-001-01-0	Broad Institute of MIT and Harvard	BRD-K60011163			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22+,26-,28-/m0/s1	WXIRIDSMDJYJEU-HYRFHYEVSA-N	537.24750049							100682
BRD-K61741250	LSM-12169		54645859	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20-,23-/m0/s1	WARQVQDGSWZACN-IRLNJFMJSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K61741250	BRD-K61741250-001-01-5	Broad Institute of MIT and Harvard	BRD-K61741250			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20-,23-/m0/s1	WARQVQDGSWZACN-IRLNJFMJSA-N	414.21547208							100795
BRD-K57275439	LSM-11898		54646059	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20+,22+,25-/m1/s1	ALLGXHRZPBERLG-PJJGQHEOSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)N[C@H](C)c4ccccc4)C[C@H]3c2c1	BroadT	BRD-K57275439	BRD-K57275439-001-01-4	Broad Institute of MIT and Harvard	BRD-K57275439			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N[C@H](C)c4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20+,22+,25-/m1/s1	ALLGXHRZPBERLG-PJJGQHEOSA-N	454.2103867							100524
BRD-K24325779	LSM-9902		54646107	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16+,18+,20-/m0/s1	RRHNJWQDAKAZMZ-UQWBFEFOSA-N	OC[C@H]1O[C@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23	BroadT	BRD-K24325779	BRD-K24325779-001-01-5	Broad Institute of MIT and Harvard	BRD-K24325779			OC[C@H]1O[C@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16+,18+,20-/m0/s1	RRHNJWQDAKAZMZ-UQWBFEFOSA-N	466.135171012							98523
BRD-K80324403	LSM-13337		54646101	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21-,23-/m1/s1	GJVLYDQXVFQAHZ-LQOJQYNMSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@@H](CC(=O)N(C)C)C[C@H]4c3c2	BroadT	BRD-K80324403	BRD-K80324403-001-01-3	Broad Institute of MIT and Harvard	BRD-K80324403			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21-,23-/m1/s1	GJVLYDQXVFQAHZ-LQOJQYNMSA-N	476.161721946							101976
BRD-K11833731	LSM-9143		54646092	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18+,22+,24-/m0/s1	RREKHFLFIWGNNG-YAFQURIPSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K11833731	BRD-K11833731-001-01-0	Broad Institute of MIT and Harvard	BRD-K11833731			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18+,22+,24-/m0/s1	RREKHFLFIWGNNG-YAFQURIPSA-N	485.196213846							97764
BRD-K61979066	LSM-12188		54645976	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20+,22-,24-/m1/s1	CJNJMLGGDUQPOS-LWSJSWBQSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K61979066	BRD-K61979066-001-01-5	Broad Institute of MIT and Harvard	BRD-K61979066			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20+,22-,24-/m1/s1	CJNJMLGGDUQPOS-LWSJSWBQSA-N	488.161721946							100814
BRD-K34336958	LSM-10498		54645808	InChI=1S/C23H27FN2O4/c1-26(2)16-6-7-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-4-3-5-15(24)8-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19+,21+,23-/m1/s1	WXYXTVXIMWIJFY-QXPQREGVSA-N	CN(C)c1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cccc(F)c4)C[C@H]3c2c1	BroadT	BRD-K34336958	BRD-K34336958-001-01-3	Broad Institute of MIT and Harvard	BRD-K34336958			CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cccc(F)c4)O[C@H]3CO)c2c1	InChI=1S/C23H27FN2O4/c1-26(2)16-6-7-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-4-3-5-15(24)8-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19+,21+,23-/m1/s1	WXYXTVXIMWIJFY-QXPQREGVSA-N	414.195485564							99119
BRD-K25566775	LSM-9983		54645993	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25-,27+,29+/m1/s1	RHYJRBPAXZYDBS-DFXUFIHISA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K25566775	BRD-K25566775-001-01-7	Broad Institute of MIT and Harvard	BRD-K25566775			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25-,27+,29+/m1/s1	RHYJRBPAXZYDBS-DFXUFIHISA-N	552.173035558							98604
BRD-K86800060	LSM-13749		54646094	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18+,22-,24-/m1/s1	RREKHFLFIWGNNG-KLYAEHFASA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K86800060	BRD-K86800060-001-01-0	Broad Institute of MIT and Harvard	BRD-K86800060			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18+,22-,24-/m1/s1	RREKHFLFIWGNNG-KLYAEHFASA-N	485.196213846							102398
BRD-K22676415	LSM-9806		54645877	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24-,28+,30+/m1/s1	DMKXNQOLMYQXCN-CVKAHQGVSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K22676415	BRD-K22676415-001-01-3	Broad Institute of MIT and Harvard	BRD-K22676415			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24-,28+,30+/m1/s1	DMKXNQOLMYQXCN-CVKAHQGVSA-N	542.20530132							98427
BRD-K59176197	LSM-12003		54645941	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21+,24-,26+,28+/m0/s1	SUQCIPRCFCPKOO-LYQXATBPSA-N	C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K59176197	BRD-K59176197-001-01-4	Broad Institute of MIT and Harvard	BRD-K59176197			C[C@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21+,24-,26+,28+/m0/s1	SUQCIPRCFCPKOO-LYQXATBPSA-N	540.173035558							100629
BRD-K68494763	LSM-12606		54645837	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22-,24-,26+/m0/s1	QQFSWHWRRZLIPD-IFPZXYOKSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@H](CO)O2)cc1	BroadT	BRD-K68494763	BRD-K68494763-001-01-4	Broad Institute of MIT and Harvard	BRD-K68494763			COc1ccc(CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@H](CO)O2)cc1	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22-,24-,26+/m0/s1	QQFSWHWRRZLIPD-IFPZXYOKSA-N	480.226036764							101238
BRD-K39144966	LSM-10803		54645861	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20+,23+/m1/s1	WARQVQDGSWZACN-DUCQWWKISA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K39144966	BRD-K39144966-001-01-6	Broad Institute of MIT and Harvard	BRD-K39144966			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20+,23+/m1/s1	WARQVQDGSWZACN-DUCQWWKISA-N	414.21547208							99424
BRD-K24465470	LSM-9909		54645851	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22+,24-,26-/m0/s1	MZNDQAVBBCTOIA-SFUHPXFESA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K24465470	BRD-K24465470-001-01-1	Broad Institute of MIT and Harvard	BRD-K24465470			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22+,24-,26-/m0/s1	MZNDQAVBBCTOIA-SFUHPXFESA-N	527.152634472							98530
BRD-K50174388	LSM-11481		54646010	InChI=1S/C21H27NO7/c1-26-19(24)10-14-9-16-15-8-13(22-21(25)12-4-6-27-7-5-12)2-3-17(15)29-20(16)18(11-23)28-14/h2-3,8,12,14,16,18,20,23H,4-7,9-11H2,1H3,(H,22,25)/t14-,16+,18+,20-/m0/s1	CYYYAXPAVULRAL-UQWBFEFOSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K50174388	BRD-K50174388-001-01-7	Broad Institute of MIT and Harvard	BRD-K50174388			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	InChI=1S/C21H27NO7/c1-26-19(24)10-14-9-16-15-8-13(22-21(25)12-4-6-27-7-5-12)2-3-17(15)29-20(16)18(11-23)28-14/h2-3,8,12,14,16,18,20,23H,4-7,9-11H2,1H3,(H,22,25)/t14-,16+,18+,20-/m0/s1	CYYYAXPAVULRAL-UQWBFEFOSA-N	405.178752214							100102
BRD-K51126488	LSM-11552		54645892	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18+,20+,22-/m1/s1	HTNOASUNFPMBNX-DCZASFAJSA-N	CN(C)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K51126488	BRD-K51126488-001-01-5	Broad Institute of MIT and Harvard	BRD-K51126488			OC[C@@H]1O[C@H](C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21)CC(=O)N(C)C	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18+,20+,22-/m1/s1	HTNOASUNFPMBNX-DCZASFAJSA-N	443.185649162							100175
BRD-K67788404	LSM-12562		54645812	InChI=1S/C23H27FN2O4/c1-26(2)16-6-7-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-4-3-5-15(24)8-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19-,21+,23+/m1/s1	WXYXTVXIMWIJFY-YZBYQZESSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cccc(F)c4)C[C@@H]3c2c1	BroadT	BRD-K67788404	BRD-K67788404-001-01-5	Broad Institute of MIT and Harvard	BRD-K67788404			CN(C)c1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cccc(F)c4)O[C@H]3CO)c2c1	InChI=1S/C23H27FN2O4/c1-26(2)16-6-7-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-4-3-5-15(24)8-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19-,21+,23+/m1/s1	WXYXTVXIMWIJFY-YZBYQZESSA-N	414.195485564							101193
BRD-K02125996-001-01-2	LSM-8564	BRD-K02125996	54646115	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11+,13+,15-/m1/s1	HQNYHUFQGPMYGV-WRPZCXLFSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(N)cc23)[C@H](CO)O1	BroadT	BRD-K02125996	BRD-K02125996-001-01-2	Broad Institute of MIT and Harvard	BRD-K02125996			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(N)cc23)[C@H](CO)O1	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11+,13+,15-/m1/s1	HQNYHUFQGPMYGV-WRPZCXLFSA-N	293.126322718							97185
BRD-K89627562	LSM-13956		54645868	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,22+,25+/m0/s1	ZGEAGHWTKPKCOK-HNJJPSDCSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)NCc4ccc5OCOc5c4)C[C@H]3c2c1	BroadT	BRD-K89627562	BRD-K89627562-001-01-7	Broad Institute of MIT and Harvard	BRD-K89627562			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc5OCOc5c4)O[C@@H]3CO)c2c1	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,22+,25+/m0/s1	ZGEAGHWTKPKCOK-HNJJPSDCSA-N	484.184565876							102609
BRD-K81678234	LSM-13417		54645904	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21-,23+,25+/m1/s1	UAPJRYKULVRBJS-ASASOQJESA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K81678234	BRD-K81678234-001-01-6	Broad Institute of MIT and Harvard	BRD-K81678234			OC[C@@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21-,23+,25+/m1/s1	UAPJRYKULVRBJS-ASASOQJESA-N	481.221285742							102057
BRD-K34435836	LSM-10509		54645836	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22-,24-,26+/m1/s1	QQFSWHWRRZLIPD-DFICYWPVSA-N	COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K34435836	BRD-K34435836-001-01-1	Broad Institute of MIT and Harvard	BRD-K34435836			COc1ccc(CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@@H](CO)O2)cc1	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22-,24-,26+/m1/s1	QQFSWHWRRZLIPD-DFICYWPVSA-N	480.226036764							99130
BRD-K65730939	LSM-12433		54646037	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17-,20+,22+/m1/s1	IELDZLYSVNRCSJ-KHNCNGADSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cc(F)ccc4F)C[C@@H]3c2c1	BroadT	BRD-K65730939	BRD-K65730939-001-01-3	Broad Institute of MIT and Harvard	BRD-K65730939			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cc(F)ccc4F)O[C@H]3CO)c2c1	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17-,20+,22+/m1/s1	IELDZLYSVNRCSJ-KHNCNGADSA-N	482.132313598							101060
BRD-K78891011	LSM-13245		54645890	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18-,20-,22+/m0/s1	HTNOASUNFPMBNX-JXYHXMIBSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K78891011	BRD-K78891011-001-01-9	Broad Institute of MIT and Harvard	BRD-K78891011			OC[C@@H]1O[C@@H](C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21)CC(=O)N(C)C	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18-,20-,22+/m0/s1	HTNOASUNFPMBNX-JXYHXMIBSA-N	443.185649162							101884
BRD-K58469266	LSM-11954		54646063	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20-,22+,25+/m1/s1	ALLGXHRZPBERLG-BOKITCOWSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)N[C@H](C)c4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K58469266	BRD-K58469266-001-01-0	Broad Institute of MIT and Harvard	BRD-K58469266			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N[C@H](C)c4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20-,22+,25+/m1/s1	ALLGXHRZPBERLG-BOKITCOWSA-N	454.2103867							100580
BRD-K26785978	LSM-10051		54646009	InChI=1S/C21H27NO7/c1-26-19(24)10-14-9-16-15-8-13(22-21(25)12-4-6-27-7-5-12)2-3-17(15)29-20(16)18(11-23)28-14/h2-3,8,12,14,16,18,20,23H,4-7,9-11H2,1H3,(H,22,25)/t14-,16-,18-,20+/m0/s1	CYYYAXPAVULRAL-PFSLXQJOSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	BroadT	BRD-K26785978	BRD-K26785978-001-01-7	Broad Institute of MIT and Harvard	BRD-K26785978			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@H](CO)O1	InChI=1S/C21H27NO7/c1-26-19(24)10-14-9-16-15-8-13(22-21(25)12-4-6-27-7-5-12)2-3-17(15)29-20(16)18(11-23)28-14/h2-3,8,12,14,16,18,20,23H,4-7,9-11H2,1H3,(H,22,25)/t14-,16-,18-,20+/m0/s1	CYYYAXPAVULRAL-PFSLXQJOSA-N	405.178752214							98672
BRD-K47826846	LSM-11340		54645857	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20+,23-/m1/s1	WARQVQDGSWZACN-MRKDIWJRSA-N	OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K47826846	BRD-K47826846-001-01-4	Broad Institute of MIT and Harvard	BRD-K47826846			OC[C@@H]1O[C@@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18+,20+,23-/m1/s1	WARQVQDGSWZACN-MRKDIWJRSA-N	414.21547208							99961
BRD-K51971121	LSM-11609		54645968	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23+,26-,28-/m1/s1	SYQUHMCSVCULSJ-PKZARACNSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@@H](CO)O2	BroadT	BRD-K51971121	BRD-K51971121-001-01-7	Broad Institute of MIT and Harvard	BRD-K51971121			COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23+,26-,28-/m1/s1	SYQUHMCSVCULSJ-PKZARACNSA-N	585.20867031							100232
BRD-K32889681	LSM-10425		54645838	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22+,24+,26-/m0/s1	QQFSWHWRRZLIPD-RXDHMRHRSA-N	COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@@H](CO)O2)cc1	BroadT	BRD-K32889681	BRD-K32889681-001-01-7	Broad Institute of MIT and Harvard	BRD-K32889681			COc1ccc(CNC(=O)C[C@@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)C5CCC5)cc34)[C@@H](CO)O2)cc1	InChI=1S/C27H32N2O6/c1-33-19-8-5-16(6-9-19)14-28-25(31)13-20-12-22-21-11-18(29-27(32)17-3-2-4-17)7-10-23(21)35-26(22)24(15-30)34-20/h5-11,17,20,22,24,26,30H,2-4,12-15H2,1H3,(H,28,31)(H,29,32)/t20-,22+,24+,26-/m0/s1	QQFSWHWRRZLIPD-RXDHMRHRSA-N	480.226036764							99046
BRD-K67780580	LSM-12560		54645922	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23-,25-,27+/m0/s1	PHBUKTREHITDBU-WHTZKJIOSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K67780580	BRD-K67780580-001-01-8	Broad Institute of MIT and Harvard	BRD-K67780580			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23-,25-,27+/m0/s1	PHBUKTREHITDBU-WHTZKJIOSA-N	547.215234728							101191
BRD-K98376600	LSM-14473		54646081	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16-,18+,20+/m1/s1	LHGLZDQGJZRLBC-BIJSTVTOSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@H](CO)O2	BroadT	BRD-K98376600	BRD-K98376600-001-01-4	Broad Institute of MIT and Harvard	BRD-K98376600			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16-,18+,20+/m1/s1	LHGLZDQGJZRLBC-BIJSTVTOSA-N	439.177706368							103128
BRD-K45475981	LSM-11201		54645869	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,22+,25+/m1/s1	ZGEAGHWTKPKCOK-AVBSYJKISA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)NCc4ccc5OCOc5c4)C[C@@H]3c2c1	BroadT	BRD-K45475981	BRD-K45475981-001-01-7	Broad Institute of MIT and Harvard	BRD-K45475981			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccc5OCOc5c4)O[C@H]3CO)c2c1	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18-,22+,25+/m1/s1	ZGEAGHWTKPKCOK-AVBSYJKISA-N	484.184565876							99822
BRD-K49906853	LSM-11459		54645802	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16+,20+,22-/m1/s1	HFIMGBHSBJMCIP-BJKXHWDHSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	BroadT	BRD-K49906853	BRD-K49906853-001-01-2	Broad Institute of MIT and Harvard	BRD-K49906853			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16+,20+,22-/m1/s1	HFIMGBHSBJMCIP-BJKXHWDHSA-N	441.142366706							100080
BRD-K36110199	LSM-10606		54646070	InChI=1S/C22H23F3N2O6S/c23-22(24,25)12-26-20(29)10-14-9-17-16-8-13(27-34(30,31)15-4-2-1-3-5-15)6-7-18(16)33-21(17)19(11-28)32-14/h1-8,14,17,19,21,27-28H,9-12H2,(H,26,29)/t14-,17-,19-,21+/m0/s1	AWBUKOBMSNOSJG-HIUUTZCYSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NS(=O)(=O)c4ccccc4)cc23	BroadT	BRD-K36110199	BRD-K36110199-001-01-9	Broad Institute of MIT and Harvard	BRD-K36110199			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C22H23F3N2O6S/c23-22(24,25)12-26-20(29)10-14-9-17-16-8-13(27-34(30,31)15-4-2-1-3-5-15)6-7-18(16)33-21(17)19(11-28)32-14/h1-8,14,17,19,21,27-28H,9-12H2,(H,26,29)/t14-,17-,19-,21+/m0/s1	AWBUKOBMSNOSJG-HIUUTZCYSA-N	500.122891766							99227
BRD-K13583181	LSM-9244		54645894	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18+,20-,22-/m0/s1	HTNOASUNFPMBNX-UPSSIMKTSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@H](CO)O1	BroadT	BRD-K13583181	BRD-K13583181-001-01-4	Broad Institute of MIT and Harvard	BRD-K13583181			OC[C@@H]1O[C@@H](C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21)CC(=O)N(C)C	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18+,20-,22-/m0/s1	HTNOASUNFPMBNX-UPSSIMKTSA-N	443.185649162							97865
BRD-K80789291	LSM-13369		54645952	InChI=1S/C24H32N2O5/c27-13-21-23-19(11-17(30-21)12-22(28)25-15-6-1-2-7-15)18-10-16(8-9-20(18)31-23)26-24(29)14-4-3-5-14/h8-10,14-15,17,19,21,23,27H,1-7,11-13H2,(H,25,28)(H,26,29)/t17-,19+,21+,23-/m1/s1	MOMUNQNAFOIKEQ-QXPQREGVSA-N	OC[C@@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K80789291	BRD-K80789291-001-01-2	Broad Institute of MIT and Harvard	BRD-K80789291			OC[C@@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C24H32N2O5/c27-13-21-23-19(11-17(30-21)12-22(28)25-15-6-1-2-7-15)18-10-16(8-9-20(18)31-23)26-24(29)14-4-3-5-14/h8-10,14-15,17,19,21,23,27H,1-7,11-13H2,(H,25,28)(H,26,29)/t17-,19+,21+,23-/m1/s1	MOMUNQNAFOIKEQ-QXPQREGVSA-N	428.231122144							102008
BRD-K10837204	LSM-9089		54645918	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28+,32-,34-/m0/s1	HZYAIKCNCGBDKG-XIIGQTTJSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K10837204	BRD-K10837204-001-01-0	Broad Institute of MIT and Harvard	BRD-K10837204			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28+,32-,34-/m0/s1	HZYAIKCNCGBDKG-XIIGQTTJSA-N	608.215866004							97710
BRD-K56176052	LSM-11824		54645974	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20+,22+,24-/m0/s1	CJNJMLGGDUQPOS-ZUAOHOGDSA-N	OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K56176052	BRD-K56176052-001-01-1	Broad Institute of MIT and Harvard	BRD-K56176052			OC[C@H]1O[C@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20+,22+,24-/m0/s1	CJNJMLGGDUQPOS-ZUAOHOGDSA-N	488.161721946							100449
BRD-K83859448	LSM-13555		54646038	InChI=1S/C21H22N2O6/c24-11-18-21-16(9-14(28-18)10-20(26)27)15-8-13(1-2-17(15)29-21)23-19(25)7-12-3-5-22-6-4-12/h1-6,8,14,16,18,21,24H,7,9-11H2,(H,23,25)(H,26,27)/t14-,16-,18-,21+/m1/s1	ZIYVXDMGZAADAL-OQBJRAFVSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Cc4ccncc4)cc23	BroadT	BRD-K83859448	BRD-K83859448-001-01-2	Broad Institute of MIT and Harvard	BRD-K83859448			OC[C@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Cc3ccncc3)cc21	InChI=1S/C21H22N2O6/c24-11-18-21-16(9-14(28-18)10-20(26)27)15-8-13(1-2-17(15)29-21)23-19(25)7-12-3-5-22-6-4-12/h1-6,8,14,16,18,21,24H,7,9-11H2,(H,23,25)(H,26,27)/t14-,16-,18-,21+/m1/s1	ZIYVXDMGZAADAL-OQBJRAFVSA-N	398.147786444							102197
BRD-K46241566	LSM-11247		54646062	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20-,22+,25+/m0/s1	ALLGXHRZPBERLG-ZWLMRGNXSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)N[C@@H](C)c4ccccc4)C[C@H]3c2c1	BroadT	BRD-K46241566	BRD-K46241566-001-01-5	Broad Institute of MIT and Harvard	BRD-K46241566			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N[C@@H](C)c4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20-,22+,25+/m0/s1	ALLGXHRZPBERLG-ZWLMRGNXSA-N	454.2103867							99868
BRD-K00199686	LSM-8436		54646100	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21+,23-/m1/s1	GJVLYDQXVFQAHZ-CTZMOBNVSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)N(C)C)C[C@H]4c3c2	BroadT	BRD-K00199686	BRD-K00199686-001-01-4	Broad Institute of MIT and Harvard	BRD-K00199686			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19+,21+,23-/m1/s1	GJVLYDQXVFQAHZ-CTZMOBNVSA-N	476.161721946							97057
BRD-K53148273	LSM-11668		54645855	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20-,23+/m0/s1	WARQVQDGSWZACN-LUFCQUEKSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)CC5CC5)cc34	BroadT	BRD-K53148273	BRD-K53148273-001-01-6	Broad Institute of MIT and Harvard	BRD-K53148273			OC[C@@H]1O[C@H](CC(=O)NCC2CC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)CC3CC3)cc21	InChI=1S/C23H30N2O5/c26-12-20-23-18(9-16(29-20)10-21(27)24-11-14-3-4-14)17-8-15(5-6-19(17)30-23)25-22(28)7-13-1-2-13/h5-6,8,13-14,16,18,20,23,26H,1-4,7,9-12H2,(H,24,27)(H,25,28)/t16-,18-,20-,23+/m0/s1	WARQVQDGSWZACN-LUFCQUEKSA-N	414.21547208							100293
BRD-K94136966	LSM-14196		54645801	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16+,20+,22-/m0/s1	HFIMGBHSBJMCIP-VGOBXOCWSA-N	COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	BroadT	BRD-K94136966	BRD-K94136966-001-01-4	Broad Institute of MIT and Harvard	BRD-K94136966			COC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@@H](CO)O1	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16+,20+,22-/m0/s1	HFIMGBHSBJMCIP-VGOBXOCWSA-N	441.142366706							102850
BRD-K89076662	LSM-13909		54645866	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,22-,25-/m1/s1	ZGEAGHWTKPKCOK-ZIGQSTSDSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4ccc5OCOc5c4)C[C@H]3c2c1	BroadT	BRD-K89076662	BRD-K89076662-001-01-6	Broad Institute of MIT and Harvard	BRD-K89076662			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc5OCOc5c4)O[C@@H]3CO)c2c1	InChI=1S/C25H28N2O8/c1-31-12-24(30)27-15-3-5-19-17(7-15)18-8-16(34-22(11-28)25(18)35-19)9-23(29)26-10-14-2-4-20-21(6-14)33-13-32-20/h2-7,16,18,22,25,28H,8-13H2,1H3,(H,26,29)(H,27,30)/t16-,18+,22-,25-/m1/s1	ZGEAGHWTKPKCOK-ZIGQSTSDSA-N	484.184565876							102562
CHEMBL2144727	LSM-13144	BRD-K77100270, SID131442246	54645873	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24+,28+,30-/m1/s1	DMKXNQOLMYQXCN-KKGYKCSESA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K77100270	BRD-K77100270-001-01-2	Broad Institute of MIT and Harvard	BRD-K77100270			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24+,28+,30-/m1/s1	DMKXNQOLMYQXCN-KKGYKCSESA-N	542.20530132							101782
BRD-K43357772	LSM-11064		54645826	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-15-11-17-16-10-14(7-8-20(16)33-23(17)21(13-29)32-15)27-24(31)28-19-6-4-3-5-18(19)25/h3-8,10,15,17,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,17-,21+,23+/m0/s1	KFOACEMMMUKWEO-SSTRHAATSA-N	CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	BroadT	BRD-K43357772	BRD-K43357772-001-01-2	Broad Institute of MIT and Harvard	BRD-K43357772			CCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1	InChI=1S/C24H28FN3O5/c1-2-9-26-22(30)12-15-11-17-16-10-14(7-8-20(16)33-23(17)21(13-29)32-15)27-24(31)28-19-6-4-3-5-18(19)25/h3-8,10,15,17,21,23,29H,2,9,11-13H2,1H3,(H,26,30)(H2,27,28,31)/t15-,17-,21+,23+/m0/s1	KFOACEMMMUKWEO-SSTRHAATSA-N	457.201299226							99685
BRD-K84639586	LSM-13602		54645898	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21-,23-,25+/m0/s1	UAPJRYKULVRBJS-YALMDMJRSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K84639586	BRD-K84639586-001-01-9	Broad Institute of MIT and Harvard	BRD-K84639586			OC[C@@H]1O[C@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C26H31N3O6/c30-15-23-25-21(11-19(34-23)12-24(31)28-14-16-2-1-7-27-13-16)20-10-18(3-4-22(20)35-25)29-26(32)17-5-8-33-9-6-17/h1-4,7,10,13,17,19,21,23,25,30H,5-6,8-9,11-12,14-15H2,(H,28,31)(H,29,32)/t19-,21-,23-,25+/m0/s1	UAPJRYKULVRBJS-YALMDMJRSA-N	481.221285742							102246
BRD-K44953633	LSM-11164		54646080	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16-,18+,20+/m0/s1	LHGLZDQGJZRLBC-LBLLVPRASA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@@H](CO)O2	BroadT	BRD-K44953633	BRD-K44953633-001-01-6	Broad Institute of MIT and Harvard	BRD-K44953633			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16-,18+,20+/m0/s1	LHGLZDQGJZRLBC-LBLLVPRASA-N	439.177706368							99785
BRD-K08306736	LSM-8929		54645948	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21+,24+,26-,28-/m0/s1	SUQCIPRCFCPKOO-YTQFHREGSA-N	C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K08306736	BRD-K08306736-001-01-7	Broad Institute of MIT and Harvard	BRD-K08306736			C[C@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21+,24+,26-,28-/m0/s1	SUQCIPRCFCPKOO-YTQFHREGSA-N	540.173035558							97550
BRD-K60109523	LSM-12064		54645928	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23-,25+,27+/m1/s1	PHBUKTREHITDBU-BQLGRQSHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K60109523	BRD-K60109523-001-01-7	Broad Institute of MIT and Harvard	BRD-K60109523			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23-,25+,27+/m1/s1	PHBUKTREHITDBU-BQLGRQSHSA-N	547.215234728							100690
BRD-K02311587	LSM-8576		54645885	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21+,24+,26-/m1/s1	MSBIHNOYSLVJHR-ZHRNDHIYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K02311587	BRD-K02311587-001-01-3	Broad Institute of MIT and Harvard	BRD-K02311587			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21+,24+,26-/m1/s1	MSBIHNOYSLVJHR-ZHRNDHIYSA-N	497.232599354							97197
BRD-K31108633	LSM-10306		54646042	InChI=1S/C21H31N3O6/c1-24(2)11-20(27)23-13-4-5-17-15(8-13)16-9-14(10-19(26)22-6-7-28-3)29-18(12-25)21(16)30-17/h4-5,8,14,16,18,21,25H,6-7,9-12H2,1-3H3,(H,22,26)(H,23,27)/t14-,16+,18+,21-/m0/s1	ZSBYESKXZOGBOW-QYDULMRYSA-N	COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	BroadT	BRD-K31108633	BRD-K31108633-001-01-2	Broad Institute of MIT and Harvard	BRD-K31108633			COCCNC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@@H](CO)O1	InChI=1S/C21H31N3O6/c1-24(2)11-20(27)23-13-4-5-17-15(8-13)16-9-14(10-19(26)22-6-7-28-3)29-18(12-25)21(16)30-17/h4-5,8,14,16,18,21,25H,6-7,9-12H2,1-3H3,(H,22,26)(H,23,27)/t14-,16+,18+,21-/m0/s1	ZSBYESKXZOGBOW-QYDULMRYSA-N	421.221285742							98927
CHEMBL2358962	LSM-12379	SID131442205, BRD-K64645183	54645832	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25+,27-,29-/m1/s1	HHNPVBFCYHNCMG-SYBYNBCQSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K64645183	BRD-K64645183-001-01-7	Broad Institute of MIT and Harvard	BRD-K64645183			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25+,27-,29-/m1/s1	HHNPVBFCYHNCMG-SYBYNBCQSA-N	581.21375569							101006
BRD-K62836687	LSM-12248		54646025	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20+,22+,24-/m1/s1	GFIPGJIGSRXJBU-HJBWUJCXSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K62836687	BRD-K62836687-001-01-5	Broad Institute of MIT and Harvard	BRD-K62836687			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20+,22+,24-/m1/s1	GFIPGJIGSRXJBU-HJBWUJCXSA-N	457.25767125							100874
BRD-K82284120	LSM-13458		54645927	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23-,25+,27+/m0/s1	PHBUKTREHITDBU-MUUNGVPUSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K82284120	BRD-K82284120-001-01-9	Broad Institute of MIT and Harvard	BRD-K82284120			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23-,25+,27+/m0/s1	PHBUKTREHITDBU-MUUNGVPUSA-N	547.215234728							102098
BRD-K59704843	LSM-12035		54646008	InChI=1S/C21H27NO7/c1-26-19(24)10-14-9-16-15-8-13(22-21(25)12-4-6-27-7-5-12)2-3-17(15)29-20(16)18(11-23)28-14/h2-3,8,12,14,16,18,20,23H,4-7,9-11H2,1H3,(H,22,25)/t14-,16-,18-,20+/m1/s1	CYYYAXPAVULRAL-ODZKNYGOSA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	BroadT	BRD-K59704843	BRD-K59704843-001-01-1	Broad Institute of MIT and Harvard	BRD-K59704843			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)C4CCOCC4)cc23)[C@@H](CO)O1	InChI=1S/C21H27NO7/c1-26-19(24)10-14-9-16-15-8-13(22-21(25)12-4-6-27-7-5-12)2-3-17(15)29-20(16)18(11-23)28-14/h2-3,8,12,14,16,18,20,23H,4-7,9-11H2,1H3,(H,22,25)/t14-,16-,18-,20+/m1/s1	CYYYAXPAVULRAL-ODZKNYGOSA-N	405.178752214							100661
BRD-K42729412	LSM-11025		54645908	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19+,21+,23-/m1/s1	TVZJESBMTOHXDE-QXPQREGVSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCCc4ccccc4)C[C@H]3c2c1	BroadT	BRD-K42729412	BRD-K42729412-001-01-9	Broad Institute of MIT and Harvard	BRD-K42729412			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCCc4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19+,21+,23-/m1/s1	TVZJESBMTOHXDE-QXPQREGVSA-N	460.166807326							99646
BRD-K65922289	LSM-12449		54645887	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21-,24+,26+/m0/s1	MSBIHNOYSLVJHR-FBNDAJROSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K65922289	BRD-K65922289-001-01-2	Broad Institute of MIT and Harvard	BRD-K65922289			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21-,24+,26+/m0/s1	MSBIHNOYSLVJHR-FBNDAJROSA-N	497.232599354							101077
BRD-K24502634	LSM-9914		54645806	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16-,20+,22+/m1/s1	HFIMGBHSBJMCIP-ZTVUFDKISA-N	COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	BroadT	BRD-K24502634	BRD-K24502634-001-01-4	Broad Institute of MIT and Harvard	BRD-K24502634			COC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4ccc5OCOc5c4)cc23)[C@H](CO)O1	InChI=1S/C23H23NO8/c1-28-21(26)9-14-8-16-15-7-13(3-5-17(15)32-22(16)20(10-25)31-14)24-23(27)12-2-4-18-19(6-12)30-11-29-18/h2-7,14,16,20,22,25H,8-11H2,1H3,(H,24,27)/t14-,16-,20+,22+/m1/s1	HFIMGBHSBJMCIP-ZTVUFDKISA-N	441.142366706							98535
BRD-K98716460	LSM-14488		54646067	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20+,22-,25-/m0/s1	ALLGXHRZPBERLG-OOKMIWCSSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)N[C@@H](C)c4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K98716460	BRD-K98716460-001-01-0	Broad Institute of MIT and Harvard	BRD-K98716460			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N[C@@H](C)c4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20+,22-,25-/m0/s1	ALLGXHRZPBERLG-OOKMIWCSSA-N	454.2103867							103143
BRD-K20200700	LSM-9661		54646072	InChI=1S/C22H23F3N2O6S/c23-22(24,25)12-26-20(29)10-14-9-17-16-8-13(27-34(30,31)15-4-2-1-3-5-15)6-7-18(16)33-21(17)19(11-28)32-14/h1-8,14,17,19,21,27-28H,9-12H2,(H,26,29)/t14-,17+,19-,21-/m1/s1	AWBUKOBMSNOSJG-JLGOVJKGSA-N	OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc3ccc(NS(=O)(=O)c4ccccc4)cc23	BroadT	BRD-K20200700	BRD-K20200700-001-01-8	Broad Institute of MIT and Harvard	BRD-K20200700			OC[C@H]1O[C@@H](CC(=O)NCC(F)(F)F)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C22H23F3N2O6S/c23-22(24,25)12-26-20(29)10-14-9-17-16-8-13(27-34(30,31)15-4-2-1-3-5-15)6-7-18(16)33-21(17)19(11-28)32-14/h1-8,14,17,19,21,27-28H,9-12H2,(H,26,29)/t14-,17+,19-,21-/m1/s1	AWBUKOBMSNOSJG-JLGOVJKGSA-N	500.122891766							98282
BRD-K49911380	LSM-11462		54645972	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20-,22-,24+/m1/s1	CJNJMLGGDUQPOS-QSOCRCLWSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccccc5)cc34	BroadT	BRD-K49911380	BRD-K49911380-001-01-4	Broad Institute of MIT and Harvard	BRD-K49911380			OC[C@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C24H28N2O7S/c27-15-22-24-20(13-17(32-22)14-23(28)26-8-10-31-11-9-26)19-12-16(6-7-21(19)33-24)25-34(29,30)18-4-2-1-3-5-18/h1-7,12,17,20,22,24-25,27H,8-11,13-15H2/t17-,20-,22-,24+/m1/s1	CJNJMLGGDUQPOS-QSOCRCLWSA-N	488.161721946							100083
BRD-K06804050	LSM-8833		54646015	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22-,26-,28+/m0/s1	WXIRIDSMDJYJEU-UCAWGOPWSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K06804050	BRD-K06804050-001-01-1	Broad Institute of MIT and Harvard	BRD-K06804050			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22-,26-,28+/m0/s1	WXIRIDSMDJYJEU-UCAWGOPWSA-N	537.24750049							97454
BRD-K23822091	LSM-9867		54645931	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21+,24+,26-/m0/s1	MRHMXTIRULDPKA-RDCZCFFCSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K23822091	BRD-K23822091-001-01-3	Broad Institute of MIT and Harvard	BRD-K23822091			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21+,24+,26-/m0/s1	MRHMXTIRULDPKA-RDCZCFFCSA-N	509.17622733							98488
CHEMBL2133308	LSM-10745	BRD-K38289428, SID131442377	54646004	InChI=1S/C22H25N3O5/c1-25(2)20(27)10-15-9-17-16-8-14(24-22(28)13-4-3-7-23-11-13)5-6-18(16)30-21(17)19(12-26)29-15/h3-8,11,15,17,19,21,26H,9-10,12H2,1-2H3,(H,24,28)/t15-,17+,19+,21-/m0/s1	IUZUJTQXZTXMFN-RWCSOYMTSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	BroadT	BRD-K38289428	BRD-K38289428-001-01-2	Broad Institute of MIT and Harvard	BRD-K38289428			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@@H](CO)O1	InChI=1S/C22H25N3O5/c1-25(2)20(27)10-15-9-17-16-8-14(24-22(28)13-4-3-7-23-11-13)5-6-18(16)30-21(17)19(12-26)29-15/h3-8,11,15,17,19,21,26H,9-10,12H2,1-2H3,(H,24,28)/t15-,17+,19+,21-/m0/s1	IUZUJTQXZTXMFN-RWCSOYMTSA-N	411.17942093							99366
BRD-K68864067	LSM-12632		54646116	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11+,13-,15-/m1/s1	HQNYHUFQGPMYGV-VDYMJLGFSA-N	COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(N)cc23)[C@@H](CO)O1	BroadT	BRD-K68864067	BRD-K68864067-001-01-1	Broad Institute of MIT and Harvard	BRD-K68864067			COC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(N)cc23)[C@@H](CO)O1	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11+,13-,15-/m1/s1	HQNYHUFQGPMYGV-VDYMJLGFSA-N	293.126322718							101265
BRD-K17088043	LSM-9460		54646104	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21+,23+/m1/s1	GJVLYDQXVFQAHZ-ZLTNCQPASA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@@H]4[C@H](CO)O[C@@H](CC(=O)N(C)C)C[C@@H]4c3c2	BroadT	BRD-K17088043	BRD-K17088043-001-01-8	Broad Institute of MIT and Harvard	BRD-K17088043			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N(C)C)O[C@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21+,23+/m1/s1	GJVLYDQXVFQAHZ-ZLTNCQPASA-N	476.161721946							98081
CHEMBL2144559	LSM-13162	BRD-K77425389, SID131442307	54645934	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21-,24+,26+/m0/s1	MRHMXTIRULDPKA-FBNDAJROSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K77425389	BRD-K77425389-001-01-1	Broad Institute of MIT and Harvard	BRD-K77425389			OC[C@H]1O[C@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21-,24+,26+/m0/s1	MRHMXTIRULDPKA-FBNDAJROSA-N	509.17622733							101800
BRD-K85433055	LSM-13652		54645850	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22+,24-,26-/m1/s1	MZNDQAVBBCTOIA-OLTCJGHMSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K85433055	BRD-K85433055-001-01-8	Broad Institute of MIT and Harvard	BRD-K85433055			OC[C@H]1O[C@@H](CC(=O)NCc2cccnc2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C26H26FN3O6S/c27-17-3-6-20(7-4-17)37(33,34)30-18-5-8-23-21(10-18)22-11-19(35-24(15-31)26(22)36-23)12-25(32)29-14-16-2-1-9-28-13-16/h1-10,13,19,22,24,26,30-31H,11-12,14-15H2,(H,29,32)/t19-,22+,24-,26-/m1/s1	MZNDQAVBBCTOIA-OLTCJGHMSA-N	527.152634472							102299
BRD-K77106209	LSM-13145		54646007	InChI=1S/C22H25N3O5/c1-25(2)20(27)10-15-9-17-16-8-14(24-22(28)13-4-3-7-23-11-13)5-6-18(16)30-21(17)19(12-26)29-15/h3-8,11,15,17,19,21,26H,9-10,12H2,1-2H3,(H,24,28)/t15-,17+,19-,21-/m0/s1	IUZUJTQXZTXMFN-MRCYXTNMSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	BroadT	BRD-K77106209	BRD-K77106209-001-01-5	Broad Institute of MIT and Harvard	BRD-K77106209			CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C22H25N3O5/c1-25(2)20(27)10-15-9-17-16-8-14(24-22(28)13-4-3-7-23-11-13)5-6-18(16)30-21(17)19(12-26)29-15/h3-8,11,15,17,19,21,26H,9-10,12H2,1-2H3,(H,24,28)/t15-,17+,19-,21-/m0/s1	IUZUJTQXZTXMFN-MRCYXTNMSA-N	411.17942093							101783
BRD-K22387508	LSM-9785		54646033	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17+,20+,22-/m1/s1	IELDZLYSVNRCSJ-ITKSXJDCSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@@H](CC(=O)NCc4cc(F)ccc4F)C[C@H]3c2c1	BroadT	BRD-K22387508	BRD-K22387508-001-01-5	Broad Institute of MIT and Harvard	BRD-K22387508			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cc(F)ccc4F)O[C@H]3CO)c2c1	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17+,20+,22-/m1/s1	IELDZLYSVNRCSJ-ITKSXJDCSA-N	482.132313598							98406
BRD-K17713237	LSM-9494		54646074	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16-,18-,20+/m1/s1	LHGLZDQGJZRLBC-ODZKNYGOSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@@H](CO)O2	BroadT	BRD-K17713237	BRD-K17713237-001-01-7	Broad Institute of MIT and Harvard	BRD-K17713237			CN1CCN(CC1)C(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16-,18-,20+/m1/s1	LHGLZDQGJZRLBC-ODZKNYGOSA-N	439.177706368							98115
BRD-K60873020	LSM-12115		54645933	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21+,24-,26-/m1/s1	MRHMXTIRULDPKA-LTOPPJTRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5cccnc5)cc34	BroadT	BRD-K60873020	BRD-K60873020-001-01-6	Broad Institute of MIT and Harvard	BRD-K60873020			OC[C@H]1O[C@@H](CC(=O)NCc2cc(F)ccc2F)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3cccnc3)cc21	InChI=1S/C27H25F2N3O5/c28-17-3-5-22(29)16(8-17)13-31-25(34)11-19-10-21-20-9-18(32-27(35)15-2-1-7-30-12-15)4-6-23(20)37-26(21)24(14-33)36-19/h1-9,12,19,21,24,26,33H,10-11,13-14H2,(H,31,34)(H,32,35)/t19-,21+,24-,26-/m1/s1	MRHMXTIRULDPKA-LTOPPJTRSA-N	509.17622733							100741
BRD-K37482798	LSM-10694		54645924	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23+,25+,27-/m1/s1	PHBUKTREHITDBU-DJOAJLSESA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K37482798	BRD-K37482798-001-01-6	Broad Institute of MIT and Harvard	BRD-K37482798			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23+,25+,27-/m1/s1	PHBUKTREHITDBU-DJOAJLSESA-N	547.215234728							99315
BRD-K17834240-001-01-6	LSM-34892	BRD-K17834240	54646000	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23-,25+,27+/m0/s1	MPXYHEQTTLDTMZ-MUUNGVPUSA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)NC5CCCCC5)C[C@H]4c3c2	BroadT	BRD-K17834240	BRD-K17834240-001-01-6	Broad Institute of MIT and Harvard	BRD-K17834240			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NC4CCCCC4)O[C@@H]3CO)c2c1	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23-,25+,27+/m0/s1	MPXYHEQTTLDTMZ-MUUNGVPUSA-N	530.208672138							123450
BRD-K64147688	LSM-12346		54646088	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,24+/m0/s1	WYDHQCWIOCTAOJ-YCYVKTGYSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K64147688	BRD-K64147688-001-01-4	Broad Institute of MIT and Harvard	BRD-K64147688			OC[C@H]1O[C@H](CC(=O)NCc2ccccn2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,24+/m0/s1	WYDHQCWIOCTAOJ-YCYVKTGYSA-N	451.210721058							100973
BRD-K03935278	LSM-8673		54646073	InChI=1S/C22H23F3N2O6S/c23-22(24,25)12-26-20(29)10-14-9-17-16-8-13(27-34(30,31)15-4-2-1-3-5-15)6-7-18(16)33-21(17)19(11-28)32-14/h1-8,14,17,19,21,27-28H,9-12H2,(H,26,29)/t14-,17+,19-,21-/m0/s1	AWBUKOBMSNOSJG-TVLKCDEOSA-N	OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc3ccc(NS(=O)(=O)c4ccccc4)cc23	BroadT	BRD-K03935278	BRD-K03935278-001-01-2	Broad Institute of MIT and Harvard	BRD-K03935278			OC[C@@H]1O[C@H](CC(=O)NCC(F)(F)F)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21	InChI=1S/C22H23F3N2O6S/c23-22(24,25)12-26-20(29)10-14-9-17-16-8-13(27-34(30,31)15-4-2-1-3-5-15)6-7-18(16)33-21(17)19(11-28)32-14/h1-8,14,17,19,21,27-28H,9-12H2,(H,26,29)/t14-,17+,19-,21-/m0/s1	AWBUKOBMSNOSJG-TVLKCDEOSA-N	500.122891766							97294
SCHEMBL16980366	LSM-6847	BRD-K67774729	54645916	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28+,32+,34-/m1/s1	HZYAIKCNCGBDKG-AMMNGQDBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K67774729	BRD-K67774729-001-01-3	Broad Institute of MIT and Harvard	BRD-K67774729			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28+,32+,34-/m1/s1	HZYAIKCNCGBDKG-AMMNGQDBSA-N	608.215866004							95468
BRD-K76988892	LSM-13138		54646031	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17-,20-,22+/m0/s1	IELDZLYSVNRCSJ-HSSHKJKNSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCc4cc(F)ccc4F)C[C@H]3c2c1	BroadT	BRD-K76988892	BRD-K76988892-001-01-9	Broad Institute of MIT and Harvard	BRD-K76988892			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4cc(F)ccc4F)O[C@H]3CO)c2c1	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17-,20-,22+/m0/s1	IELDZLYSVNRCSJ-HSSHKJKNSA-N	482.132313598							101776
CHEMBL2361379	LSM-10520	BRD-K34781184, SID131442286	54645913	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28-,32-,34+/m1/s1	HZYAIKCNCGBDKG-AXMQAMFRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K34781184	BRD-K34781184-001-01-6	Broad Institute of MIT and Harvard	BRD-K34781184			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28-,32-,34+/m1/s1	HZYAIKCNCGBDKG-AXMQAMFRSA-N	608.215866004							99141
BRD-K63233328	LSM-12275		54645923	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23+,25+,27-/m0/s1	PHBUKTREHITDBU-NOGZMFEUSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NS(=O)(=O)c5ccc(F)cc5)cc34	BroadT	BRD-K63233328	BRD-K63233328-001-01-9	Broad Institute of MIT and Harvard	BRD-K63233328			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C27H34FN3O6S/c28-18-4-7-21(8-5-18)38(34,35)30-19-6-9-24-22(14-19)23-15-20(36-25(17-32)27(23)37-24)16-26(33)29-10-13-31-11-2-1-3-12-31/h4-9,14,20,23,25,27,30,32H,1-3,10-13,15-17H2,(H,29,33)/t20-,23+,25+,27-/m0/s1	PHBUKTREHITDBU-NOGZMFEUSA-N	547.215234728							100901
BRD-K57054528	LSM-11884		54645997	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23+,25+,27-/m1/s1	MPXYHEQTTLDTMZ-DJOAJLSESA-N	COc1cccc(c1)S(=O)(=O)Nc2ccc3O[C@H]4[C@H](CO)O[C@@H](CC(=O)NC5CCCCC5)C[C@H]4c3c2	BroadT	BRD-K57054528	BRD-K57054528-001-01-5	Broad Institute of MIT and Harvard	BRD-K57054528			COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NC4CCCCC4)O[C@H]3CO)c2c1	InChI=1S/C27H34N2O7S/c1-34-19-8-5-9-21(13-19)37(32,33)29-18-10-11-24-22(12-18)23-14-20(35-25(16-30)27(23)36-24)15-26(31)28-17-6-3-2-4-7-17/h5,8-13,17,20,23,25,27,29-30H,2-4,6-7,14-16H2,1H3,(H,28,31)/t20-,23+,25+,27-/m1/s1	MPXYHEQTTLDTMZ-DJOAJLSESA-N	530.208672138							100510
BRD-K69845975	LSM-12692		54646029	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20-,22+,24+/m1/s1	GFIPGJIGSRXJBU-NROSNUSPSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K69845975	BRD-K69845975-001-01-0	Broad Institute of MIT and Harvard	BRD-K69845975			OC[C@@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20-,22+,24+/m1/s1	GFIPGJIGSRXJBU-NROSNUSPSA-N	457.25767125							101326
BRD-K30822915	LSM-10286		54646061	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20+,22-,25-/m1/s1	ALLGXHRZPBERLG-ICPKNLHRSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)N[C@H](C)c4ccccc4)C[C@H]3c2c1	BroadT	BRD-K30822915	BRD-K30822915-001-01-8	Broad Institute of MIT and Harvard	BRD-K30822915			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N[C@H](C)c4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20+,22-,25-/m1/s1	ALLGXHRZPBERLG-ICPKNLHRSA-N	454.2103867							98907
BRD-K26484639	LSM-10031		54645891	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18+,20+,22-/m0/s1	HTNOASUNFPMBNX-ZMUPPCTCSA-N	CN(C)C(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K26484639	BRD-K26484639-001-01-8	Broad Institute of MIT and Harvard	BRD-K26484639			OC[C@H]1O[C@@H](C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21)CC(=O)N(C)C	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18+,20+,22-/m0/s1	HTNOASUNFPMBNX-ZMUPPCTCSA-N	443.185649162							98652
BRD-K94694331	LSM-14232		54645990	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25+,27+,29-/m1/s1	RHYJRBPAXZYDBS-CMRYXKCBSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K94694331	BRD-K94694331-001-01-0	Broad Institute of MIT and Harvard	BRD-K94694331			OC[C@@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25+,27+,29-/m1/s1	RHYJRBPAXZYDBS-CMRYXKCBSA-N	552.173035558							102886
BRD-K09301754	LSM-8990		54645991	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25+,27-,29-/m1/s1	RHYJRBPAXZYDBS-FLMHHTSDSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K09301754	BRD-K09301754-001-01-4	Broad Institute of MIT and Harvard	BRD-K09301754			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25+,27-,29-/m1/s1	RHYJRBPAXZYDBS-FLMHHTSDSA-N	552.173035558							97611
BRD-K59830209	LSM-12043		54645872	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24+,28+,30-/m0/s1	DMKXNQOLMYQXCN-HHGBJQJNSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K59830209	BRD-K59830209-001-01-2	Broad Institute of MIT and Harvard	BRD-K59830209			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24+,28+,30-/m0/s1	DMKXNQOLMYQXCN-HHGBJQJNSA-N	542.20530132							100669
BRD-K82365559	LSM-13461		54645938	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24+,26+,28-/m0/s1	SUQCIPRCFCPKOO-VULYSIACSA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1)c5ccccc5	BroadT	BRD-K82365559	BRD-K82365559-001-01-6	Broad Institute of MIT and Harvard	BRD-K82365559			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24+,26+,28-/m0/s1	SUQCIPRCFCPKOO-VULYSIACSA-N	540.173035558							102101
BRD-K11468724	LSM-9129		54646064	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20+,22-,25-/m0/s1	ALLGXHRZPBERLG-OBJXVINMSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)N[C@@H](C)c4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K11468724	BRD-K11468724-001-01-4	Broad Institute of MIT and Harvard	BRD-K11468724			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)N[C@@H](C)c4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20+,22-,25-/m0/s1	ALLGXHRZPBERLG-OBJXVINMSA-N	454.2103867							97750
BRD-K91123606	LSM-14033		54645895	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18-,20+,22+/m0/s1	HTNOASUNFPMBNX-FDGCKHTNSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(F)cc4)cc23)[C@@H](CO)O1	BroadT	BRD-K91123606	BRD-K91123606-001-01-1	Broad Institute of MIT and Harvard	BRD-K91123606			OC[C@H]1O[C@@H](C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(F)cc3)cc21)CC(=O)N(C)C	InChI=1S/C23H26FN3O5/c1-27(2)21(29)11-16-10-18-17-9-15(7-8-19(17)32-22(18)20(12-28)31-16)26-23(30)25-14-5-3-13(24)4-6-14/h3-9,16,18,20,22,28H,10-12H2,1-2H3,(H2,25,26,30)/t16-,18-,20+,22+/m0/s1	HTNOASUNFPMBNX-FDGCKHTNSA-N	443.185649162							102686
BRD-K93612606	LSM-14167		54645910	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19+,21-,23-/m0/s1	TVZJESBMTOHXDE-FTJYFCJYSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCCc4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K93612606	BRD-K93612606-001-01-1	Broad Institute of MIT and Harvard	BRD-K93612606			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCCc4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19+,21-,23-/m0/s1	TVZJESBMTOHXDE-FTJYFCJYSA-N	460.166807326							102821
BRD-K58180017	LSM-11940		54646003	InChI=1S/C22H25N3O5/c1-25(2)20(27)10-15-9-17-16-8-14(24-22(28)13-4-3-7-23-11-13)5-6-18(16)30-21(17)19(12-26)29-15/h3-8,11,15,17,19,21,26H,9-10,12H2,1-2H3,(H,24,28)/t15-,17-,19-,21+/m0/s1	IUZUJTQXZTXMFN-WRGRXTPVSA-N	CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	BroadT	BRD-K58180017	BRD-K58180017-001-01-5	Broad Institute of MIT and Harvard	BRD-K58180017			CN(C)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)c4cccnc4)cc23)[C@H](CO)O1	InChI=1S/C22H25N3O5/c1-25(2)20(27)10-15-9-17-16-8-14(24-22(28)13-4-3-7-23-11-13)5-6-18(16)30-21(17)19(12-26)29-15/h3-8,11,15,17,19,21,26H,9-10,12H2,1-2H3,(H,24,28)/t15-,17-,19-,21+/m0/s1	IUZUJTQXZTXMFN-WRGRXTPVSA-N	411.17942093							100566
BRD-K64537516	LSM-12369		54646035	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17+,20-,22-/m0/s1	IELDZLYSVNRCSJ-XFSCSUFISA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4cc(F)ccc4F)C[C@@H]3c2c1	BroadT	BRD-K64537516	BRD-K64537516-001-01-4	Broad Institute of MIT and Harvard	BRD-K64537516			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cc(F)ccc4F)O[C@H]3CO)c2c1	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17+,20-,22-/m0/s1	IELDZLYSVNRCSJ-XFSCSUFISA-N	482.132313598							100996
BRD-K16705018	LSM-9436		54646075	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16-,18-,20+/m0/s1	LHGLZDQGJZRLBC-PFSLXQJOSA-N	CN1CCN(CC1)C(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@H](CO)O2	BroadT	BRD-K16705018	BRD-K16705018-001-01-9	Broad Institute of MIT and Harvard	BRD-K16705018			CN1CCN(CC1)C(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@H](CO)O1	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16-,18-,20+/m0/s1	LHGLZDQGJZRLBC-PFSLXQJOSA-N	439.177706368							98057
BRD-K39504007	LSM-10828		54645951	InChI=1S/C24H32N2O5/c27-13-21-23-19(11-17(30-21)12-22(28)25-15-6-1-2-7-15)18-10-16(8-9-20(18)31-23)26-24(29)14-4-3-5-14/h8-10,14-15,17,19,21,23,27H,1-7,11-13H2,(H,25,28)(H,26,29)/t17-,19+,21+,23-/m0/s1	MOMUNQNAFOIKEQ-GBPFJNKXSA-N	OC[C@H]1O[C@H](CC(=O)NC2CCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K39504007	BRD-K39504007-001-01-2	Broad Institute of MIT and Harvard	BRD-K39504007			OC[C@H]1O[C@H](CC(=O)NC2CCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C24H32N2O5/c27-13-21-23-19(11-17(30-21)12-22(28)25-15-6-1-2-7-15)18-10-16(8-9-20(18)31-23)26-24(29)14-4-3-5-14/h8-10,14-15,17,19,21,23,27H,1-7,11-13H2,(H,25,28)(H,26,29)/t17-,19+,21+,23-/m0/s1	MOMUNQNAFOIKEQ-GBPFJNKXSA-N	428.231122144							99449
BRD-K42960120	LSM-11037		54645917	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28+,32-,34-/m1/s1	HZYAIKCNCGBDKG-CJZAXMMYSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K42960120	BRD-K42960120-001-01-3	Broad Institute of MIT and Harvard	BRD-K42960120			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28+,32-,34-/m1/s1	HZYAIKCNCGBDKG-CJZAXMMYSA-N	608.215866004							99658
BRD-K71334452	LSM-12787		54645884	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21+,24+,26-/m0/s1	MSBIHNOYSLVJHR-RDCZCFFCSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K71334452	BRD-K71334452-001-01-3	Broad Institute of MIT and Harvard	BRD-K71334452			OC[C@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21+,24+,26-/m0/s1	MSBIHNOYSLVJHR-RDCZCFFCSA-N	497.232599354							101424
BRD-K65981470	LSM-12454		54645815	InChI=1S/C27H39N3O6/c31-17-24-26-22(15-20(35-24)16-25(32)28-8-11-30-9-2-1-3-10-30)21-14-19(4-5-23(21)36-26)29-27(33)18-6-12-34-13-7-18/h4-5,14,18,20,22,24,26,31H,1-3,6-13,15-17H2,(H,28,32)(H,29,33)/t20-,22+,24+,26-/m0/s1	XIMMKRXXDKAOMK-RXDHMRHRSA-N	OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K65981470	BRD-K65981470-001-01-7	Broad Institute of MIT and Harvard	BRD-K65981470			OC[C@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H39N3O6/c31-17-24-26-22(15-20(35-24)16-25(32)28-8-11-30-9-2-1-3-10-30)21-14-19(4-5-23(21)36-26)29-27(33)18-6-12-34-13-7-18/h4-5,14,18,20,22,24,26,31H,1-3,6-13,15-17H2,(H,28,32)(H,29,33)/t20-,22+,24+,26-/m0/s1	XIMMKRXXDKAOMK-RXDHMRHRSA-N	501.283885998							101082
BRD-K30436233	LSM-10262		54645937	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24-,26-,28+/m0/s1	SUQCIPRCFCPKOO-NEYRPFOQSA-N	C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K30436233	BRD-K30436233-001-01-2	Broad Institute of MIT and Harvard	BRD-K30436233			C[C@H](NC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24-,26-,28+/m0/s1	SUQCIPRCFCPKOO-NEYRPFOQSA-N	540.173035558							98883
BRD-K26594332	LSM-10040		54645906	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19-,21-,23+/m0/s1	TVZJESBMTOHXDE-RAKJYXHLSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](CO)O[C@H](CC(=O)NCCc4ccccc4)C[C@H]3c2c1	BroadT	BRD-K26594332	BRD-K26594332-001-01-4	Broad Institute of MIT and Harvard	BRD-K26594332			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCCc4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C23H28N2O6S/c1-32(28,29)25-16-7-8-20-18(11-16)19-12-17(30-21(14-26)23(19)31-20)13-22(27)24-10-9-15-5-3-2-4-6-15/h2-8,11,17,19,21,23,25-26H,9-10,12-14H2,1H3,(H,24,27)/t17-,19-,21-,23+/m0/s1	TVZJESBMTOHXDE-RAKJYXHLSA-N	460.166807326							98661
BRD-K14652476	LSM-9316		54645886	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21+,24-,26-/m0/s1	MSBIHNOYSLVJHR-YPLHNQGHSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@H]3[C@@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K14652476	BRD-K14652476-001-01-0	Broad Institute of MIT and Harvard	BRD-K14652476			OC[C@@H]1O[C@H](CC(=O)NCc2ccccc2F)C[C@H]2[C@@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C27H32FN3O5/c28-22-8-4-1-5-16(22)14-29-25(33)13-19-12-21-20-11-18(31-27(34)30-17-6-2-3-7-17)9-10-23(20)36-26(21)24(15-32)35-19/h1,4-5,8-11,17,19,21,24,26,32H,2-3,6-7,12-15H2,(H,29,33)(H2,30,31,34)/t19-,21+,24-,26-/m0/s1	MSBIHNOYSLVJHR-YPLHNQGHSA-N	497.232599354							97937
BRD-K67502058	LSM-12537		54646068	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20-,22+,25+/m1/s1	ALLGXHRZPBERLG-UUTHAWMKSA-N	COCC(=O)Nc1ccc2O[C@@H]3[C@H](CO)O[C@@H](CC(=O)N[C@H](C)c4ccccc4)C[C@@H]3c2c1	BroadT	BRD-K67502058	BRD-K67502058-001-01-9	Broad Institute of MIT and Harvard	BRD-K67502058			COCC(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)N[C@H](C)c4ccccc4)O[C@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18-,20-,22+,25+/m1/s1	ALLGXHRZPBERLG-UUTHAWMKSA-N	454.2103867							101168
BRD-K84787606	LSM-13611		54646041	InChI=1S/C21H31N3O6/c1-24(2)11-20(27)23-13-4-5-17-15(8-13)16-9-14(10-19(26)22-6-7-28-3)29-18(12-25)21(16)30-17/h4-5,8,14,16,18,21,25H,6-7,9-12H2,1-3H3,(H,22,26)(H,23,27)/t14-,16-,18-,21+/m0/s1	ZSBYESKXZOGBOW-YZZRYBLGSA-N	COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	BroadT	BRD-K84787606	BRD-K84787606-001-01-2	Broad Institute of MIT and Harvard	BRD-K84787606			COCCNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	InChI=1S/C21H31N3O6/c1-24(2)11-20(27)23-13-4-5-17-15(8-13)16-9-14(10-19(26)22-6-7-28-3)29-18(12-25)21(16)30-17/h4-5,8,14,16,18,21,25H,6-7,9-12H2,1-3H3,(H,22,26)(H,23,27)/t14-,16-,18-,21+/m0/s1	ZSBYESKXZOGBOW-YZZRYBLGSA-N	421.221285742							131222
BRD-K45440108	LSM-11197		54646043	InChI=1S/C21H31N3O6/c1-24(2)11-20(27)23-13-4-5-17-15(8-13)16-9-14(10-19(26)22-6-7-28-3)29-18(12-25)21(16)30-17/h4-5,8,14,16,18,21,25H,6-7,9-12H2,1-3H3,(H,22,26)(H,23,27)/t14-,16+,18+,21-/m1/s1	ZSBYESKXZOGBOW-NHAHXKBOSA-N	COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	BroadT	BRD-K45440108	BRD-K45440108-001-01-9	Broad Institute of MIT and Harvard	BRD-K45440108			COCCNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)CN(C)C)cc23)[C@H](CO)O1	InChI=1S/C21H31N3O6/c1-24(2)11-20(27)23-13-4-5-17-15(8-13)16-9-14(10-19(26)22-6-7-28-3)29-18(12-25)21(16)30-17/h4-5,8,14,16,18,21,25H,6-7,9-12H2,1-3H3,(H,22,26)(H,23,27)/t14-,16+,18+,21-/m1/s1	ZSBYESKXZOGBOW-NHAHXKBOSA-N	421.221285742							99818
BRD-K00959946	LSM-8496		54645814	InChI=1S/C27H39N3O6/c31-17-24-26-22(15-20(35-24)16-25(32)28-8-11-30-9-2-1-3-10-30)21-14-19(4-5-23(21)36-26)29-27(33)18-6-12-34-13-7-18/h4-5,14,18,20,22,24,26,31H,1-3,6-13,15-17H2,(H,28,32)(H,29,33)/t20-,22-,24-,26+/m0/s1	XIMMKRXXDKAOMK-IFPZXYOKSA-N	OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCOCC5)cc34	BroadT	BRD-K00959946	BRD-K00959946-001-01-7	Broad Institute of MIT and Harvard	BRD-K00959946			OC[C@@H]1O[C@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCOCC3)cc21	InChI=1S/C27H39N3O6/c31-17-24-26-22(15-20(35-24)16-25(32)28-8-11-30-9-2-1-3-10-30)21-14-19(4-5-23(21)36-26)29-27(33)18-6-12-34-13-7-18/h4-5,14,18,20,22,24,26,31H,1-3,6-13,15-17H2,(H,28,32)(H,29,33)/t20-,22-,24-,26+/m0/s1	XIMMKRXXDKAOMK-IFPZXYOKSA-N	501.283885998							97117
BRD-K19061245	LSM-9574		54646112	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16-,18+,20+/m1/s1	RRHNJWQDAKAZMZ-BIJSTVTOSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23	BroadT	BRD-K19061245	BRD-K19061245-001-01-9	Broad Institute of MIT and Harvard	BRD-K19061245			OC[C@@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16-,18+,20+/m1/s1	RRHNJWQDAKAZMZ-BIJSTVTOSA-N	466.135171012							98195
BRD-K59191656	LSM-12005		54645981	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23+,25+,27-/m1/s1	HYQMBLXITOJPAN-WFHOOFKDSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K59191656	BRD-K59191656-001-01-7	Broad Institute of MIT and Harvard	BRD-K59191656			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23+,25+,27-/m1/s1	HYQMBLXITOJPAN-WFHOOFKDSA-N	487.210721058							100631
BRD-K81543190	LSM-13405		54646026	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20+,22-,24-/m1/s1	GFIPGJIGSRXJBU-USHXRURQSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)NC5CCCC5)cc34	BroadT	BRD-K81543190	BRD-K81543190-001-01-4	Broad Institute of MIT and Harvard	BRD-K81543190			OC[C@H]1O[C@@H](CC(=O)N2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)NC3CCCC3)cc21	InChI=1S/C25H35N3O5/c29-15-22-24-20(13-18(32-22)14-23(30)28-10-4-1-5-11-28)19-12-17(8-9-21(19)33-24)27-25(31)26-16-6-2-3-7-16/h8-9,12,16,18,20,22,24,29H,1-7,10-11,13-15H2,(H2,26,27,31)/t18-,20+,22-,24-/m1/s1	GFIPGJIGSRXJBU-USHXRURQSA-N	457.25767125							102045
BRD-K76662562	LSM-13119		54645971	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23-,26+,28+/m1/s1	SYQUHMCSVCULSJ-YZJMKMORSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@H](CO)O2	BroadT	BRD-K76662562	BRD-K76662562-001-01-9	Broad Institute of MIT and Harvard	BRD-K76662562			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@H](CO)O1	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23-,26+,28+/m1/s1	SYQUHMCSVCULSJ-YZJMKMORSA-N	585.20867031							101757
BRD-K54166087	LSM-11723		54646109	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16+,18-,20-/m1/s1	RRHNJWQDAKAZMZ-IHMNZUQTSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@@H]2[C@H]1Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23	BroadT	BRD-K54166087	BRD-K54166087-001-01-3	Broad Institute of MIT and Harvard	BRD-K54166087			OC[C@H]1O[C@@H](CC(O)=O)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16+,18-,20-/m1/s1	RRHNJWQDAKAZMZ-IHMNZUQTSA-N	466.135171012							100348
BRD-K56719502	LSM-11856		54646017	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22+,26+,28-/m1/s1	WXIRIDSMDJYJEU-HAGKMHAYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K56719502	BRD-K56719502-001-01-4	Broad Institute of MIT and Harvard	BRD-K56719502			OC[C@@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22+,26+,28-/m1/s1	WXIRIDSMDJYJEU-HAGKMHAYSA-N	537.24750049							100482
BRD-K94843767	LSM-14244		54646105	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16-,18-,20+/m1/s1	RRHNJWQDAKAZMZ-ODZKNYGOSA-N	OC[C@H]1O[C@@H](CC(=O)O)C[C@H]2[C@@H]1Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23	BroadT	BRD-K94843767	BRD-K94843767-001-01-6	Broad Institute of MIT and Harvard	BRD-K94843767			OC[C@H]1O[C@@H](CC(O)=O)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C22H21F3N2O6/c23-22(24,25)11-1-3-12(4-2-11)26-21(31)27-13-5-6-17-15(7-13)16-8-14(9-19(29)30)32-18(10-28)20(16)33-17/h1-7,14,16,18,20,28H,8-10H2,(H,29,30)(H2,26,27,31)/t14-,16-,18-,20+/m1/s1	RRHNJWQDAKAZMZ-ODZKNYGOSA-N	466.135171012							102898
BRD-K71346068	LSM-12788		54646034	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17+,20-,22-/m1/s1	IELDZLYSVNRCSJ-WEMWZYORSA-N	CS(=O)(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4cc(F)ccc4F)C[C@H]3c2c1	BroadT	BRD-K71346068	BRD-K71346068-001-01-3	Broad Institute of MIT and Harvard	BRD-K71346068			CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4cc(F)ccc4F)O[C@@H]3CO)c2c1	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17+,20-,22-/m1/s1	IELDZLYSVNRCSJ-WEMWZYORSA-N	482.132313598							101425
BRD-K62990480	LSM-12259		54646014	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22-,26-,28+/m1/s1	WXIRIDSMDJYJEU-DFQMGKBUSA-N	OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)c5ccc6OCOc6c5)cc34	BroadT	BRD-K62990480	BRD-K62990480-001-01-9	Broad Institute of MIT and Harvard	BRD-K62990480			OC[C@H]1O[C@@H](CC(=O)NCCN2CCCCC2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C29H35N3O7/c33-16-26-28-22(14-20(38-26)15-27(34)30-8-11-32-9-2-1-3-10-32)21-13-19(5-7-23(21)39-28)31-29(35)18-4-6-24-25(12-18)37-17-36-24/h4-7,12-13,20,22,26,28,33H,1-3,8-11,14-17H2,(H,30,34)(H,31,35)/t20-,22-,26-,28+/m1/s1	WXIRIDSMDJYJEU-DFQMGKBUSA-N	537.24750049							100885
CHEMBL2357977	LSM-13113	BRD-K76578350, SID131442201	54645828	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25-,27-,29+/m1/s1	HHNPVBFCYHNCMG-ACEYUQJJSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)Nc6ccc(cc6)C(F)(F)F)cc45	BroadT	BRD-K76578350	BRD-K76578350-001-01-3	Broad Institute of MIT and Harvard	BRD-K76578350			OC[C@H]1O[C@@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21	InChI=1S/C31H30F3N3O5/c32-31(33,34)20-5-7-21(8-6-20)35-30(40)36-22-9-10-26-24(13-22)25-14-23(41-27(17-38)29(25)42-26)15-28(39)37-12-11-18-3-1-2-4-19(18)16-37/h1-10,13,23,25,27,29,38H,11-12,14-17H2,(H2,35,36,40)/t23-,25-,27-,29+/m1/s1	HHNPVBFCYHNCMG-ACEYUQJJSA-N	581.21375569							101751
BRD-K00935206	LSM-8492		54645965	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23-,26-,28+/m1/s1	SYQUHMCSVCULSJ-AUPUHMMDSA-N	COc1ccccc1CNC(=O)C[C@H]2C[C@H]3[C@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@@H](CO)O2	BroadT	BRD-K00935206	BRD-K00935206-001-01-2	Broad Institute of MIT and Harvard	BRD-K00935206			COc1ccccc1CNC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23-,26-,28+/m1/s1	SYQUHMCSVCULSJ-AUPUHMMDSA-N	585.20867031							97113
BRD-K74149575	LSM-12967		54646089	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,24+/m1/s1	WYDHQCWIOCTAOJ-NROSNUSPSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K74149575	BRD-K74149575-001-01-4	Broad Institute of MIT and Harvard	BRD-K74149575			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccn2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C25H29N3O5/c29-14-22-24-20(11-18(32-22)12-23(30)27-13-17-6-1-2-9-26-17)19-10-16(7-8-21(19)33-24)28-25(31)15-4-3-5-15/h1-2,6-10,15,18,20,22,24,29H,3-5,11-14H2,(H,27,30)(H,28,31)/t18-,20-,22+,24+/m1/s1	WYDHQCWIOCTAOJ-NROSNUSPSA-N	451.210721058							101604
BRD-K70783031	LSM-12746		54646032	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17+,20+,22-/m0/s1	IELDZLYSVNRCSJ-QBLKZJFASA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@H](CC(=O)NCc4cc(F)ccc4F)C[C@@H]3c2c1	BroadT	BRD-K70783031	BRD-K70783031-001-01-2	Broad Institute of MIT and Harvard	BRD-K70783031			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cc(F)ccc4F)O[C@@H]3CO)c2c1	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17+,20+,22-/m0/s1	IELDZLYSVNRCSJ-QBLKZJFASA-N	482.132313598							101383
BRD-K42383812	LSM-10998		54645810	InChI=1S/C23H27FN2O4/c1-26(2)16-6-7-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-4-3-5-15(24)8-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19+,21-,23-/m0/s1	WXYXTVXIMWIJFY-FTJYFCJYSA-N	CN(C)c1ccc2O[C@@H]3[C@H](CO)O[C@H](CC(=O)NCc4cccc(F)c4)C[C@@H]3c2c1	BroadT	BRD-K42383812	BRD-K42383812-001-01-1	Broad Institute of MIT and Harvard	BRD-K42383812			CN(C)c1ccc2O[C@H]3[C@H](C[C@@H](CC(=O)NCc4cccc(F)c4)O[C@H]3CO)c2c1	InChI=1S/C23H27FN2O4/c1-26(2)16-6-7-20-18(9-16)19-10-17(29-21(13-27)23(19)30-20)11-22(28)25-12-14-4-3-5-15(24)8-14/h3-9,17,19,21,23,27H,10-13H2,1-2H3,(H,25,28)/t17-,19+,21-,23-/m0/s1	WXYXTVXIMWIJFY-FTJYFCJYSA-N	414.195485564							99619
BRD-K31230167-001-01-8	LSM-10317	BRD-K31230167	54646113	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11-,13-,15+/m0/s1	HQNYHUFQGPMYGV-YARBFKLUSA-N	COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(N)cc23)[C@H](CO)O1	BroadT	BRD-K31230167	BRD-K31230167-001-01-8	Broad Institute of MIT and Harvard	BRD-K31230167			COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(N)cc23)[C@H](CO)O1	InChI=1S/C15H19NO5/c1-19-14(18)6-9-5-11-10-4-8(16)2-3-12(10)21-15(11)13(7-17)20-9/h2-4,9,11,13,15,17H,5-7,16H2,1H3/t9-,11-,13-,15+/m0/s1	HQNYHUFQGPMYGV-YARBFKLUSA-N	293.126322718							98938
BRD-K96900359	LSM-14378		54645943	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24+,26-,28-/m0/s1	SUQCIPRCFCPKOO-WINGKJCMSA-N	C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K96900359	BRD-K96900359-001-01-6	Broad Institute of MIT and Harvard	BRD-K96900359			C[C@H](NC(=O)C[C@@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24+,26-,28-/m0/s1	SUQCIPRCFCPKOO-WINGKJCMSA-N	540.173035558							103032
BRD-K53183074	LSM-11671		54645985	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23-,25+,27+/m1/s1	HYQMBLXITOJPAN-RESCMLIYSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2)C[C@H]3[C@@H]1Oc4ccc(NC(=O)Nc5ccccc5)cc34	BroadT	BRD-K53183074	BRD-K53183074-001-01-4	Broad Institute of MIT and Harvard	BRD-K53183074			OC[C@@H]1O[C@@H](CC(=O)NCc2ccccc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21	InChI=1S/C28H29N3O5/c32-17-25-27-23(14-21(35-25)15-26(33)29-16-18-7-3-1-4-8-18)22-13-20(11-12-24(22)36-27)31-28(34)30-19-9-5-2-6-10-19/h1-13,21,23,25,27,32H,14-17H2,(H,29,33)(H2,30,31,34)/t21-,23-,25+,27+/m1/s1	HYQMBLXITOJPAN-RESCMLIYSA-N	487.210721058							100296
BRD-K88187036	LSM-13846		54646030	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17-,20-,22+/m1/s1	IELDZLYSVNRCSJ-HHRWBCNNSA-N	CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](CO)O[C@@H](CC(=O)NCc4cc(F)ccc4F)C[C@@H]3c2c1	BroadT	BRD-K88187036	BRD-K88187036-001-01-1	Broad Institute of MIT and Harvard	BRD-K88187036			CS(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4cc(F)ccc4F)O[C@@H]3CO)c2c1	InChI=1S/C22H24F2N2O6S/c1-33(29,30)26-14-3-5-19-16(7-14)17-8-15(31-20(11-27)22(17)32-19)9-21(28)25-10-12-6-13(23)2-4-18(12)24/h2-7,15,17,20,22,26-27H,8-11H2,1H3,(H,25,28)/t15-,17-,20-,22+/m1/s1	IELDZLYSVNRCSJ-HHRWBCNNSA-N	482.132313598							102497
BRD-K18001731	LSM-9509		54646091	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18-,22-,24+/m0/s1	RREKHFLFIWGNNG-GODDJFOZSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)Nc5ccccc5F)cc34	BroadT	BRD-K18001731	BRD-K18001731-001-01-7	Broad Institute of MIT and Harvard	BRD-K18001731			OC[C@@H]1O[C@H](CC(=O)N2CCOCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3F)cc21	InChI=1S/C25H28FN3O6/c26-19-3-1-2-4-20(19)28-25(32)27-15-5-6-21-17(11-15)18-12-16(34-22(14-30)24(18)35-21)13-23(31)29-7-9-33-10-8-29/h1-6,11,16,18,22,24,30H,7-10,12-14H2,(H2,27,28,32)/t16-,18-,22-,24+/m0/s1	RREKHFLFIWGNNG-GODDJFOZSA-N	485.196213846							98130
BRD-K98240084	LSM-14465		54645989	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25+,27+,29-/m0/s1	RHYJRBPAXZYDBS-VWGZZBOQSA-N	OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NS(=O)(=O)c6ccc(F)cc6)cc45	BroadT	BRD-K98240084	BRD-K98240084-001-01-7	Broad Institute of MIT and Harvard	BRD-K98240084			OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21	InChI=1S/C29H29FN2O6S/c30-20-5-8-23(9-6-20)39(35,36)31-21-7-10-26-24(13-21)25-14-22(37-27(17-33)29(25)38-26)15-28(34)32-12-11-18-3-1-2-4-19(18)16-32/h1-10,13,22,25,27,29,31,33H,11-12,14-17H2/t22-,25+,27+,29-/m0/s1	RHYJRBPAXZYDBS-VWGZZBOQSA-N	552.173035558							103120
BRD-K15414305	LSM-9350		54645970	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23-,26+,28+/m0/s1	SYQUHMCSVCULSJ-CEDAICPMSA-N	COc1ccccc1CNC(=O)C[C@@H]2C[C@@H]3[C@@H](Oc4ccc(NC(=O)Nc5ccc(cc5)C(F)(F)F)cc34)[C@@H](CO)O2	BroadT	BRD-K15414305	BRD-K15414305-001-01-1	Broad Institute of MIT and Harvard	BRD-K15414305			COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccc(cc4)C(F)(F)F)cc23)[C@@H](CO)O1	InChI=1S/C30H30F3N3O6/c1-40-24-5-3-2-4-17(24)15-34-27(38)14-21-13-23-22-12-20(10-11-25(22)42-28(23)26(16-37)41-21)36-29(39)35-19-8-6-18(7-9-19)30(31,32)33/h2-12,21,23,26,28,37H,13-16H2,1H3,(H,34,38)(H2,35,36,39)/t21-,23-,26+,28+/m0/s1	SYQUHMCSVCULSJ-CEDAICPMSA-N	585.20867031							97971
BRD-K52184420	LSM-11620		54645920	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28-,32+,34+/m1/s1	HZYAIKCNCGBDKG-QHMPLAMHSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K52184420	BRD-K52184420-001-01-4	Broad Institute of MIT and Harvard	BRD-K52184420			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C35H32N2O8/c38-19-32-34-28(27-15-23(9-13-29(27)45-34)37-35(40)22-8-12-30-31(14-22)42-20-41-30)16-26(44-32)17-33(39)36-18-21-6-10-25(11-7-21)43-24-4-2-1-3-5-24/h1-15,26,28,32,34,38H,16-20H2,(H,36,39)(H,37,40)/t26-,28-,32+,34+/m1/s1	HZYAIKCNCGBDKG-QHMPLAMHSA-N	608.215866004							100244
BRD-K15778794	LSM-9374		54645871	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24-,28-,30+/m0/s1	DMKXNQOLMYQXCN-DDPIJVRDSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]4[C@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K15778794	BRD-K15778794-001-01-7	Broad Institute of MIT and Harvard	BRD-K15778794			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24-,28-,30+/m0/s1	DMKXNQOLMYQXCN-DDPIJVRDSA-N	542.20530132							97995
BRD-K84625203	LSM-13600		54646078	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16+,18-,20-/m1/s1	LHGLZDQGJZRLBC-IHMNZUQTSA-N	CN1CCN(CC1)C(=O)C[C@H]2C[C@@H]3[C@@H](Oc4ccc(NS(=O)(=O)C)cc34)[C@@H](CO)O2	BroadT	BRD-K84625203	BRD-K84625203-001-01-1	Broad Institute of MIT and Harvard	BRD-K84625203			CN1CCN(CC1)C(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(C)(=O)=O)cc23)[C@@H](CO)O1	InChI=1S/C20H29N3O6S/c1-22-5-7-23(8-6-22)19(25)11-14-10-16-15-9-13(21-30(2,26)27)3-4-17(15)29-20(16)18(12-24)28-14/h3-4,9,14,16,18,20-21,24H,5-8,10-12H2,1-2H3/t14-,16+,18-,20-/m1/s1	LHGLZDQGJZRLBC-IHMNZUQTSA-N	439.177706368							102244
BRD-K88908047	LSM-13895		54645939	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24+,26+,28-/m1/s1	SUQCIPRCFCPKOO-RXYIMMQSSA-N	C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c5ccccc5	BroadT	BRD-K88908047	BRD-K88908047-001-01-7	Broad Institute of MIT and Harvard	BRD-K88908047			C[C@@H](NC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c1ccccc1	InChI=1S/C28H29FN2O6S/c1-17(18-5-3-2-4-6-18)30-27(33)15-21-14-24-23-13-20(9-12-25(23)37-28(24)26(16-32)36-21)31-38(34,35)22-10-7-19(29)8-11-22/h2-13,17,21,24,26,28,31-32H,14-16H2,1H3,(H,30,33)/t17-,21-,24+,26+,28-/m1/s1	SUQCIPRCFCPKOO-RXYIMMQSSA-N	540.173035558							102548
BRD-K62943397	LSM-12254		54646065	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20+,22-,25-/m1/s1	ALLGXHRZPBERLG-ITTMOLIUSA-N	COCC(=O)Nc1ccc2O[C@H]3[C@@H](CO)O[C@H](CC(=O)N[C@H](C)c4ccccc4)C[C@H]3c2c1	BroadT	BRD-K62943397	BRD-K62943397-001-01-0	Broad Institute of MIT and Harvard	BRD-K62943397			COCC(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N[C@H](C)c4ccccc4)O[C@@H]3CO)c2c1	InChI=1S/C25H30N2O6/c1-15(16-6-4-3-5-7-16)26-23(29)12-18-11-20-19-10-17(27-24(30)14-31-2)8-9-21(19)33-25(20)22(13-28)32-18/h3-10,15,18,20,22,25,28H,11-14H2,1-2H3,(H,26,29)(H,27,30)/t15-,18+,20+,22-,25-/m1/s1	ALLGXHRZPBERLG-ITTMOLIUSA-N	454.2103867							100880
BRD-K43820987	LSM-11102		54645875	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24+,28-,30-/m0/s1	DMKXNQOLMYQXCN-HGYUMDDNSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]4[C@@H]1Oc5ccc(NC(=O)c6ccc7OCOc7c6)cc45	BroadT	BRD-K43820987	BRD-K43820987-001-01-0	Broad Institute of MIT and Harvard	BRD-K43820987			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21	InChI=1S/C31H30N2O7/c34-16-28-30-24(13-22(39-28)14-29(35)33-10-9-18-3-1-2-4-20(18)15-33)23-12-21(6-8-25(23)40-30)32-31(36)19-5-7-26-27(11-19)38-17-37-26/h1-8,11-12,22,24,28,30,34H,9-10,13-17H2,(H,32,36)/t22-,24+,28-,30-/m0/s1	DMKXNQOLMYQXCN-HGYUMDDNSA-N	542.20530132							99723
BRD-K09170549	LSM-8984		54646103	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21+,23+/m0/s1	GJVLYDQXVFQAHZ-PZMSFCMUSA-N	COc1ccc(cc1)S(=O)(=O)Nc2ccc3O[C@H]4[C@@H](CO)O[C@H](CC(=O)N(C)C)C[C@H]4c3c2	BroadT	BRD-K09170549	BRD-K09170549-001-01-3	Broad Institute of MIT and Harvard	BRD-K09170549			COc1ccc(cc1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)N(C)C)O[C@@H]3CO)c2c1	InChI=1S/C23H28N2O7S/c1-25(2)22(27)12-16-11-19-18-10-14(4-9-20(18)32-23(19)21(13-26)31-16)24-33(28,29)17-7-5-15(30-3)6-8-17/h4-10,16,19,21,23-24,26H,11-13H2,1-3H3/t16-,19-,21+,23+/m0/s1	GJVLYDQXVFQAHZ-PZMSFCMUSA-N	476.161721946							97605
BRD-K97101742	LSM-14393		54645950	InChI=1S/C24H32N2O5/c27-13-21-23-19(11-17(30-21)12-22(28)25-15-6-1-2-7-15)18-10-16(8-9-20(18)31-23)26-24(29)14-4-3-5-14/h8-10,14-15,17,19,21,23,27H,1-7,11-13H2,(H,25,28)(H,26,29)/t17-,19-,21-,23+/m0/s1	MOMUNQNAFOIKEQ-RAKJYXHLSA-N	OC[C@@H]1O[C@H](CC(=O)NC2CCCC2)C[C@@H]3[C@H]1Oc4ccc(NC(=O)C5CCC5)cc34	BroadT	BRD-K97101742	BRD-K97101742-001-01-6	Broad Institute of MIT and Harvard	BRD-K97101742			OC[C@@H]1O[C@H](CC(=O)NC2CCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)C3CCC3)cc21	InChI=1S/C24H32N2O5/c27-13-21-23-19(11-17(30-21)12-22(28)25-15-6-1-2-7-15)18-10-16(8-9-20(18)31-23)26-24(29)14-4-3-5-14/h8-10,14-15,17,19,21,23,27H,1-7,11-13H2,(H,25,28)(H,26,29)/t17-,19-,21-,23+/m0/s1	MOMUNQNAFOIKEQ-RAKJYXHLSA-N	428.231122144							103047
BRD-K23140656-001-01-7	LSM-34893	BRD-K23140656	54641217	InChI=1S/C22H28N4O5/c1-30-17-7-5-15(6-8-17)25-22(29)26-19-10-9-18(31-20(19)14-27)12-21(28)24-13-16-4-2-3-11-23-16/h2-8,11,18-20,27H,9-10,12-14H2,1H3,(H,24,28)(H2,25,26,29)/t18-,19+,20+/m0/s1	GEVYJHFWGQLEQA-XUVXKRRUSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccccn3)O[C@@H]2CO)cc1	BroadT	BRD-K23140656	BRD-K23140656-001-01-7	Broad Institute of MIT and Harvard	BRD-K23140656			COc1ccc(NC(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccccn3)O[C@@H]2CO)cc1	InChI=1S/C22H28N4O5/c1-30-17-7-5-15(6-8-17)25-22(29)26-19-10-9-18(31-20(19)14-27)12-21(28)24-13-16-4-2-3-11-23-16/h2-8,11,18-20,27H,9-10,12-14H2,1H3,(H,24,28)(H2,25,26,29)/t18-,19+,20+/m0/s1	GEVYJHFWGQLEQA-XUVXKRRUSA-N	428.205970036							123451
BRD-K25222259-001-01-2	LSM-34894	BRD-K25222259	54641245	InChI=1S/C16H21FN2O5S/c1-2-18-16(21)9-12-5-8-14(15(10-20)24-12)19-25(22,23)13-6-3-11(17)4-7-13/h3-8,12,14-15,19-20H,2,9-10H2,1H3,(H,18,21)/t12-,14+,15-/m0/s1	UOWXRGDLFUDMAF-CFVMTHIKSA-N	CCNC(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccc(F)cc2)C=C1	BroadT	BRD-K25222259	BRD-K25222259-001-01-2	Broad Institute of MIT and Harvard	BRD-K25222259			CCNC(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccc(F)cc2)C=C1	InChI=1S/C16H21FN2O5S/c1-2-18-16(21)9-12-5-8-14(15(10-20)24-12)19-25(22,23)13-6-3-11(17)4-7-13/h3-8,12,14-15,19-20H,2,9-10H2,1H3,(H,18,21)/t12-,14+,15-/m0/s1	UOWXRGDLFUDMAF-CFVMTHIKSA-N	372.115520682							123452
BRD-K83484928-001-01-8	LSM-34895	BRD-K83484928	54641192	InChI=1S/C16H22N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-9,12,14-15,17,19H,10-11H2,1-2H3/t12-,14+,15-/m1/s1	ACJRMYKVRUMDSA-VHDGCEQUSA-N	CN(C)C(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K83484928	BRD-K83484928-001-01-8	Broad Institute of MIT and Harvard	BRD-K83484928			CN(C)C(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C16H22N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-9,12,14-15,17,19H,10-11H2,1-2H3/t12-,14+,15-/m1/s1	ACJRMYKVRUMDSA-VHDGCEQUSA-N	354.124942514							123453
BRD-K63636299-001-01-8	LSM-34896	BRD-K63636299	54641323	InChI=1S/C14H16N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h1-6,10-12,17H,7-8H2,(H,16,20)(H,18,19)/t10-,11+,12-/m0/s1	IZKTYYLZYIIGGX-TUAOUCFPSA-N	OC[C@@H]1O[C@H](CC(=O)O)C=C[C@H]1NC(=O)c2ccncc2	BroadT	BRD-K63636299	BRD-K63636299-001-01-8	Broad Institute of MIT and Harvard	BRD-K63636299			OC[C@@H]1O[C@H](CC(O)=O)C=C[C@H]1NC(=O)c1ccncc1	InChI=1S/C14H16N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h1-6,10-12,17H,7-8H2,(H,16,20)(H,18,19)/t10-,11+,12-/m0/s1	IZKTYYLZYIIGGX-TUAOUCFPSA-N	292.105921632							123454
BRD-K74987780-001-01-8	LSM-34897	BRD-K74987780	54641089	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19+/m1/s1	YBKWUZNDQMZJNP-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K74987780	BRD-K74987780-001-01-8	Broad Institute of MIT and Harvard	BRD-K74987780			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19+/m1/s1	YBKWUZNDQMZJNP-QRVBRYPASA-N	421.201299226							123455
BRD-K08739006-001-01-2	LSM-34898	BRD-K08739006	54641243	InChI=1S/C16H21FN2O5S/c1-2-18-16(21)9-12-5-8-14(15(10-20)24-12)19-25(22,23)13-6-3-11(17)4-7-13/h3-8,12,14-15,19-20H,2,9-10H2,1H3,(H,18,21)/t12-,14-,15+/m1/s1	UOWXRGDLFUDMAF-YUELXQCFSA-N	CCNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccc(F)cc2)C=C1	BroadT	BRD-K08739006	BRD-K08739006-001-01-2	Broad Institute of MIT and Harvard	BRD-K08739006			CCNC(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccc(F)cc2)C=C1	InChI=1S/C16H21FN2O5S/c1-2-18-16(21)9-12-5-8-14(15(10-20)24-12)19-25(22,23)13-6-3-11(17)4-7-13/h3-8,12,14-15,19-20H,2,9-10H2,1H3,(H,18,21)/t12-,14-,15+/m1/s1	UOWXRGDLFUDMAF-YUELXQCFSA-N	372.115520682							123456
BRD-K37032043-001-01-2	LSM-34899	BRD-K37032043	54641078	InChI=1S/C16H32N4O4/c1-11(2)18-16(23)17-8-7-12-5-6-13(14(10-21)24-12)19-15(22)9-20(3)4/h11-14,21H,5-10H2,1-4H3,(H,19,22)(H2,17,18,23)/t12-,13+,14+/m0/s1	FRJVFPJDQFXUHI-BFHYXJOUSA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)CN(C)C)[C@@H](CO)O1	BroadT	BRD-K37032043	BRD-K37032043-001-01-2	Broad Institute of MIT and Harvard	BRD-K37032043			CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)CN(C)C)[C@@H](CO)O1	InChI=1S/C16H32N4O4/c1-11(2)18-16(23)17-8-7-12-5-6-13(14(10-21)24-12)19-15(22)9-20(3)4/h11-14,21H,5-10H2,1-4H3,(H,19,22)(H2,17,18,23)/t12-,13+,14+/m0/s1	FRJVFPJDQFXUHI-BFHYXJOUSA-N	344.242355544							123457
BRD-K27403344-001-01-3	LSM-34900	BRD-K27403344	54641281	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24-/m0/s1	JSIXEHNVWQRETH-IMSXRSKXSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K27403344	BRD-K27403344-001-01-3	Broad Institute of MIT and Harvard	BRD-K27403344			OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24-/m0/s1	JSIXEHNVWQRETH-IMSXRSKXSA-N	494.21653472							123458
BRD-K83289448-001-01-2	LSM-34901	BRD-K83289448	54641174	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19-/m0/s1	VEDLKNWKQGCWOE-FHWLQOOXSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	BroadT	BRD-K83289448	BRD-K83289448-001-01-2	Broad Institute of MIT and Harvard	BRD-K83289448			CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19-/m0/s1	VEDLKNWKQGCWOE-FHWLQOOXSA-N	389.231456502							123459
BRD-K39341253-001-01-0	LSM-34902	BRD-K39341253	54641284	InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19-,20-/m1/s1	RVDWTGCIOVVFDR-VAMGGRTRSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K39341253	BRD-K39341253-001-01-0	Broad Institute of MIT and Harvard	BRD-K39341253			Cn1cnc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@@H]1CO	InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19-,20-/m1/s1	RVDWTGCIOVVFDR-VAMGGRTRSA-N	477.204589832							123460
BRD-K36527604-001-01-3	LSM-34903	BRD-K36527604	54641088	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19+/m0/s1	YBKWUZNDQMZJNP-GBESFXJTSA-N	OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K36527604	BRD-K36527604-001-01-3	Broad Institute of MIT and Harvard	BRD-K36527604			OC[C@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19+/m0/s1	YBKWUZNDQMZJNP-GBESFXJTSA-N	421.201299226							123461
BRD-K57345620-001-01-4	LSM-34904	BRD-K57345620	54641115	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19-,22+/m0/s1	IDXOYAHYVHCYJQ-SXTKRDDTSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)Nc2ccc3OCOc3c2)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K57345620	BRD-K57345620-001-01-4	Broad Institute of MIT and Harvard	BRD-K57345620			C[C@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)Nc2ccc3OCOc3c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19-,22+/m0/s1	IDXOYAHYVHCYJQ-SXTKRDDTSA-N	455.205635678							123462
BRD-K29887111-001-01-6	LSM-34905	BRD-K29887111	54641117	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19-,22+/m1/s1	IDXOYAHYVHCYJQ-YHFKFMBFSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Nc2ccc3OCOc3c2)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K29887111	BRD-K29887111-001-01-6	Broad Institute of MIT and Harvard	BRD-K29887111			C[C@@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Nc2ccc3OCOc3c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19-,22+/m1/s1	IDXOYAHYVHCYJQ-YHFKFMBFSA-N	455.205635678							123463
BRD-K54901885-001-01-7	LSM-34906	BRD-K54901885	54641318	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15+/m1/s1	BEBDRHVABAQOSM-KFWWJZLASA-N	CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K54901885	BRD-K54901885-001-01-7	Broad Institute of MIT and Harvard	BRD-K54901885			CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15+/m1/s1	BEBDRHVABAQOSM-KFWWJZLASA-N	339.215806438							123464
BRD-K43695862-001-01-6	LSM-34907	BRD-K43695862	54641228	InChI=1S/C17H31N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h12-15,21H,3-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15+/m1/s1	GTWYPIFYOHIWKX-KFWWJZLASA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K43695862	BRD-K43695862-001-01-6	Broad Institute of MIT and Harvard	BRD-K43695862			CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C17H31N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h12-15,21H,3-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15+/m1/s1	GTWYPIFYOHIWKX-KFWWJZLASA-N	341.231456502							123465
BRD-K90829984-001-01-6	LSM-34908	BRD-K90829984	54641175	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19+/m0/s1	VEDLKNWKQGCWOE-GBESFXJTSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	BroadT	BRD-K90829984	BRD-K90829984-001-01-6	Broad Institute of MIT and Harvard	BRD-K90829984			CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19+/m0/s1	VEDLKNWKQGCWOE-GBESFXJTSA-N	389.231456502							123466
BRD-K31691428-001-01-6	LSM-34909	BRD-K31691428	54641125	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19-,20+/m1/s1	FXQPIHLBIKTXQP-YSGRDPCXSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K31691428	BRD-K31691428-001-01-6	Broad Institute of MIT and Harvard	BRD-K31691428			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19-,20+/m1/s1	FXQPIHLBIKTXQP-YSGRDPCXSA-N	485.11874753							123467
MLS003650002	LSM-34910	BRD-K69073107	53382665	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16+/m0/s1	DLMKWWGZUXJMAT-NUEKZKHPSA-N	CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	BroadT	BRD-K69073107	BRD-K69073107-001-01-0	Broad Institute of MIT and Harvard	BRD-K69073107			CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16+/m0/s1	DLMKWWGZUXJMAT-NUEKZKHPSA-N	350.164185436							123468
BRD-K09048421-001-01-4	LSM-34911	BRD-K09048421	54641121	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22-/m0/s1	IDXOYAHYVHCYJQ-XCRNZQRYSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2ccc3OCOc3c2)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K09048421	BRD-K09048421-001-01-4	Broad Institute of MIT and Harvard	BRD-K09048421			C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2ccc3OCOc3c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22-/m0/s1	IDXOYAHYVHCYJQ-XCRNZQRYSA-N	455.205635678							123469
BRD-K70088258-001-01-2	LSM-34912	BRD-K70088258	54641360	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18+,19+/m1/s1	CRKZLQDDCDYEJL-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K70088258	BRD-K70088258-001-01-2	Broad Institute of MIT and Harvard	BRD-K70088258			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18+,19+/m1/s1	CRKZLQDDCDYEJL-QYZOEREBSA-N	463.1986322							123470
BRD-K29655604-001-01-1	LSM-34913	BRD-K29655604	54641216	InChI=1S/C19H28FN3O4/c1-12(2)22-19(26)21-10-9-15-7-8-16(17(11-24)27-15)23-18(25)13-3-5-14(20)6-4-13/h3-6,12,15-17,24H,7-11H2,1-2H3,(H,23,25)(H2,21,22,26)/t15-,16+,17-/m0/s1	ZZEIDMWSYAIZDJ-BBWFWOEESA-N	CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	BroadT	BRD-K29655604	BRD-K29655604-001-01-1	Broad Institute of MIT and Harvard	BRD-K29655604			CC(C)NC(=O)NCC[C@@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1	InChI=1S/C19H28FN3O4/c1-12(2)22-19(26)21-10-9-15-7-8-16(17(11-24)27-15)23-18(25)13-3-5-14(20)6-4-13/h3-6,12,15-17,24H,7-11H2,1-2H3,(H,23,25)(H2,21,22,26)/t15-,16+,17-/m0/s1	ZZEIDMWSYAIZDJ-BBWFWOEESA-N	381.206384606							123471
BRD-K81665719-001-01-7	LSM-34914	BRD-K81665719	54641280	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24-/m1/s1	JSIXEHNVWQRETH-ZFGGDYGUSA-N	OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K81665719	BRD-K81665719-001-01-7	Broad Institute of MIT and Harvard	BRD-K81665719			OC[C@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24-/m1/s1	JSIXEHNVWQRETH-ZFGGDYGUSA-N	494.21653472							123472
BRD-K20101441-001-01-2	LSM-34915	BRD-K20101441	54641108	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19-,22-/m0/s1	IDXOYAHYVHCYJQ-AKYGZRSFSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Nc2ccc3OCOc3c2)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K20101441	BRD-K20101441-001-01-2	Broad Institute of MIT and Harvard	BRD-K20101441			C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Nc2ccc3OCOc3c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19-,22-/m0/s1	IDXOYAHYVHCYJQ-AKYGZRSFSA-N	455.205635678							123473
BRD-K57567857-001-01-7	LSM-34916	BRD-K57567857	54641219	InChI=1S/C22H28N4O5/c1-30-17-7-5-15(6-8-17)25-22(29)26-19-10-9-18(31-20(19)14-27)12-21(28)24-13-16-4-2-3-11-23-16/h2-8,11,18-20,27H,9-10,12-14H2,1H3,(H,24,28)(H2,25,26,29)/t18-,19-,20-/m1/s1	GEVYJHFWGQLEQA-VAMGGRTRSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccccn3)O[C@@H]2CO)cc1	BroadT	BRD-K57567857	BRD-K57567857-001-01-7	Broad Institute of MIT and Harvard	BRD-K57567857			COc1ccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccccn3)O[C@@H]2CO)cc1	InChI=1S/C22H28N4O5/c1-30-17-7-5-15(6-8-17)25-22(29)26-19-10-9-18(31-20(19)14-27)12-21(28)24-13-16-4-2-3-11-23-16/h2-8,11,18-20,27H,9-10,12-14H2,1H3,(H,24,28)(H2,25,26,29)/t18-,19-,20-/m1/s1	GEVYJHFWGQLEQA-VAMGGRTRSA-N	428.205970036							123474
BRD-K78246835-001-01-0	LSM-34917	BRD-K78246835	54641306	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20+,21+/m1/s1	GXRAKWRWAOCDKZ-QMMLZNLJSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c3ccccc3F	BroadT	BRD-K78246835	BRD-K78246835-001-01-0	Broad Institute of MIT and Harvard	BRD-K78246835			OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20+,21+/m1/s1	GXRAKWRWAOCDKZ-QMMLZNLJSA-N	450.162470874							123475
BRD-K69236751-001-01-2	LSM-34918	BRD-K69236751	54641312	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20+,21-/m0/s1	GXRAKWRWAOCDKZ-WMQCIHAUSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c3ccccc3F	BroadT	BRD-K69236751	BRD-K69236751-001-01-2	Broad Institute of MIT and Harvard	BRD-K69236751			OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20+,21-/m0/s1	GXRAKWRWAOCDKZ-WMQCIHAUSA-N	450.162470874							123476
BRD-K55748528-001-01-4	LSM-34919	BRD-K55748528	54641116	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19+,22-/m0/s1	IDXOYAHYVHCYJQ-KBZIOIMTSA-N	C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Nc2ccc3OCOc3c2)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K55748528	BRD-K55748528-001-01-4	Broad Institute of MIT and Harvard	BRD-K55748528			C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Nc2ccc3OCOc3c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19+,22-/m0/s1	IDXOYAHYVHCYJQ-KBZIOIMTSA-N	455.205635678							123477
BRD-K79848778-001-01-1	LSM-34920	BRD-K79848778	54641224	InChI=1S/C17H31N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h12-15,21H,3-11H2,1-2H3,(H2,18,19,23)/t13-,14+,15+/m1/s1	GTWYPIFYOHIWKX-ILXRZTDVSA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K79848778	BRD-K79848778-001-01-1	Broad Institute of MIT and Harvard	BRD-K79848778			CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C17H31N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h12-15,21H,3-11H2,1-2H3,(H2,18,19,23)/t13-,14+,15+/m1/s1	GTWYPIFYOHIWKX-ILXRZTDVSA-N	341.231456502							123478
BRD-K76158076-001-01-7	LSM-34921	BRD-K76158076	54641118	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22-/m1/s1	IDXOYAHYVHCYJQ-HCBXPFHNSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Nc2ccc3OCOc3c2)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K76158076	BRD-K76158076-001-01-7	Broad Institute of MIT and Harvard	BRD-K76158076			C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Nc2ccc3OCOc3c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22-/m1/s1	IDXOYAHYVHCYJQ-HCBXPFHNSA-N	455.205635678							123479
BRD-K62269054-001-01-4	LSM-34922	BRD-K62269054	54641204	InChI=1S/C20H27Cl2N5O3/c1-12(2)18-10-27(26-25-18)6-5-16-3-4-17(19(11-28)30-16)24-20(29)23-15-8-13(21)7-14(22)9-15/h7-10,12,16-17,19,28H,3-6,11H2,1-2H3,(H2,23,24,29)/t16-,17-,19+/m1/s1	WAMQJZQECGGADK-LMMKCTJWSA-N	CC(C)c1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3cc(Cl)cc(Cl)c3)[C@H](CO)O2)nn1	BroadT	BRD-K62269054	BRD-K62269054-001-01-4	Broad Institute of MIT and Harvard	BRD-K62269054			CC(C)c1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3cc(Cl)cc(Cl)c3)[C@H](CO)O2)nn1	InChI=1S/C20H27Cl2N5O3/c1-12(2)18-10-27(26-25-18)6-5-16-3-4-17(19(11-28)30-16)24-20(29)23-15-8-13(21)7-14(22)9-15/h7-10,12,16-17,19,28H,3-6,11H2,1-2H3,(H2,23,24,29)/t16-,17-,19+/m1/s1	WAMQJZQECGGADK-LMMKCTJWSA-N	455.149095194							123480
BRD-K13778782-001-01-3	LSM-34923	BRD-K13778782	54641104	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17-,19+/m0/s1	DDPFGBWVBZCTOM-VDZJLULYSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]2CC[C@H](NC(=O)c3cnccn3)[C@@H](CO)O2	BroadT	BRD-K13778782	BRD-K13778782-001-01-3	Broad Institute of MIT and Harvard	BRD-K13778782			Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]1CC[C@H](NC(=O)c2cnccn2)[C@@H](CO)O1	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17-,19+/m0/s1	DDPFGBWVBZCTOM-VDZJLULYSA-N	434.162390662							123481
BRD-K79287319-001-01-8	LSM-34924	BRD-K79287319	54641095	InChI=1S/C23H31Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4-7,12,17,20-21,29H,1-3,8-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21+/m1/s1	FPUISOVZIDCXHC-UIFIKXQLSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K79287319	BRD-K79287319-001-01-8	Broad Institute of MIT and Harvard	BRD-K79287319			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H31Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4-7,12,17,20-21,29H,1-3,8-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21+/m1/s1	FPUISOVZIDCXHC-UIFIKXQLSA-N	483.169161922							123482
BRD-K33337505-001-01-0	LSM-34925	BRD-K33337505	54641315	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14+,15+/m1/s1	BEBDRHVABAQOSM-ILXRZTDVSA-N	CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K33337505	BRD-K33337505-001-01-0	Broad Institute of MIT and Harvard	BRD-K33337505			CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14+,15+/m1/s1	BEBDRHVABAQOSM-ILXRZTDVSA-N	339.215806438							123483
BRD-K59193920-001-01-3	LSM-34926	BRD-K59193920	54641310	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20-,21-/m1/s1	GXRAKWRWAOCDKZ-DUXKGJEZSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c3ccccc3F	BroadT	BRD-K59193920	BRD-K59193920-001-01-3	Broad Institute of MIT and Harvard	BRD-K59193920			OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20-,21-/m1/s1	GXRAKWRWAOCDKZ-DUXKGJEZSA-N	450.162470874							123484
BRD-K56300782-001-01-4	LSM-34927	BRD-K56300782	54641200	InChI=1S/C21H31N3O4/c25-14-19-18(24-21(27)16-8-10-22-11-9-16)7-6-17(28-19)12-20(26)23-13-15-4-2-1-3-5-15/h8-11,15,17-19,25H,1-7,12-14H2,(H,23,26)(H,24,27)/t17-,18+,19-/m1/s1	BHIMCRWNSGTPOE-CEXWTWQISA-N	OC[C@H]1O[C@@H](CC(=O)NCC2CCCCC2)CC[C@@H]1NC(=O)c3ccncc3	BroadT	BRD-K56300782	BRD-K56300782-001-01-4	Broad Institute of MIT and Harvard	BRD-K56300782			OC[C@H]1O[C@@H](CC(=O)NCC2CCCCC2)CC[C@@H]1NC(=O)c1ccncc1	InChI=1S/C21H31N3O4/c25-14-19-18(24-21(27)16-8-10-22-11-9-16)7-6-17(28-19)12-20(26)23-13-15-4-2-1-3-5-15/h8-11,15,17-19,25H,1-7,12-14H2,(H,23,26)(H,24,27)/t17-,18+,19-/m1/s1	BHIMCRWNSGTPOE-CEXWTWQISA-N	389.231456502							123485
BRD-K70485249-001-01-2	LSM-34928	BRD-K70485249	54641366	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18+,19-/m0/s1	CRKZLQDDCDYEJL-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K70485249	BRD-K70485249-001-01-2	Broad Institute of MIT and Harvard	BRD-K70485249			OC[C@@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18+,19-/m0/s1	CRKZLQDDCDYEJL-OTWHNJEPSA-N	463.1986322							123486
BRD-K45566213-001-01-3	LSM-34929	BRD-K45566213	54641069	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16+,17-/m1/s1	XXVQYUMJVNBNLA-IXDOHACOSA-N	CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccc(OC)cc2)O[C@@H]1CO	BroadT	BRD-K45566213	BRD-K45566213-001-01-3	Broad Institute of MIT and Harvard	BRD-K45566213			CCC(=O)N[C@H]1C=C[C@@H](O[C@@H]1CO)CC(=O)NCc1ccc(OC)cc1	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16+,17-/m1/s1	XXVQYUMJVNBNLA-IXDOHACOSA-N	362.184171952							123487
BRD-K29764789-001-01-8	LSM-34930	BRD-K29764789	54641279	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24+/m1/s1	JSIXEHNVWQRETH-LGVFNWMJSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K29764789	BRD-K29764789-001-01-8	Broad Institute of MIT and Harvard	BRD-K29764789			OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24+/m1/s1	JSIXEHNVWQRETH-LGVFNWMJSA-N	494.21653472							123488
BRD-K89009198-001-01-0	LSM-34931	BRD-K89009198	54641370	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-2,4,6-8,15,17,21,29H,3,5,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21-/m0/s1	RFHDZNJROOVZQK-WJPUGNRLSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K89009198	BRD-K89009198-001-01-0	Broad Institute of MIT and Harvard	BRD-K89009198			OC[C@@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-2,4,6-8,15,17,21,29H,3,5,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21-/m0/s1	RFHDZNJROOVZQK-WJPUGNRLSA-N	477.17114195							123489
BRD-K30311018-001-01-8	LSM-34932	BRD-K30311018	54641086	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19-/m1/s1	YBKWUZNDQMZJNP-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K30311018	BRD-K30311018-001-01-8	Broad Institute of MIT and Harvard	BRD-K30311018			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19-/m1/s1	YBKWUZNDQMZJNP-GUDVDZBRSA-N	421.201299226							123490
BRD-K54662875-001-01-7	LSM-34933	BRD-K54662875	54641260	InChI=1S/C14H24N2O4/c1-2-15-13(18)7-10-5-6-11(12(8-17)20-10)16-14(19)9-3-4-9/h9-12,17H,2-8H2,1H3,(H,15,18)(H,16,19)/t10-,11+,12-/m1/s1	BTMFLGLOUFNMEW-GRYCIOLGSA-N	CCNC(=O)C[C@H]1CC[C@H](NC(=O)C2CC2)[C@@H](CO)O1	BroadT	BRD-K54662875	BRD-K54662875-001-01-7	Broad Institute of MIT and Harvard	BRD-K54662875			CCNC(=O)C[C@H]1CC[C@H](NC(=O)C2CC2)[C@@H](CO)O1	InChI=1S/C14H24N2O4/c1-2-15-13(18)7-10-5-6-11(12(8-17)20-10)16-14(19)9-3-4-9/h9-12,17H,2-8H2,1H3,(H,15,18)(H,16,19)/t10-,11+,12-/m1/s1	BTMFLGLOUFNMEW-GRYCIOLGSA-N	284.173607268							123491
BRD-K30048461-001-01-8	LSM-34934	BRD-K30048461	54641129	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19+,20-/m0/s1	FXQPIHLBIKTXQP-BEVDRBHNSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K30048461	BRD-K30048461-001-01-8	Broad Institute of MIT and Harvard	BRD-K30048461			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19+,20-/m0/s1	FXQPIHLBIKTXQP-BEVDRBHNSA-N	485.11874753							123492
BRD-K14896981-001-01-1	LSM-34935	BRD-K14896981	54641286	InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19-,20+/m0/s1	RVDWTGCIOVVFDR-SLFFLAALSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K14896981	BRD-K14896981-001-01-1	Broad Institute of MIT and Harvard	BRD-K14896981			Cn1cnc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@@H]1CO	InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19-,20+/m0/s1	RVDWTGCIOVVFDR-SLFFLAALSA-N	477.204589832							123493
BRD-K84760360-001-01-5	LSM-34936	BRD-K84760360	54641098	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17+,19+/m0/s1	DDPFGBWVBZCTOM-KVSKMBFKSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]2CC[C@@H](NC(=O)c3cnccn3)[C@@H](CO)O2	BroadT	BRD-K84760360	BRD-K84760360-001-01-5	Broad Institute of MIT and Harvard	BRD-K84760360			Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)c2cnccn2)[C@@H](CO)O1	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17+,19+/m0/s1	DDPFGBWVBZCTOM-KVSKMBFKSA-N	434.162390662							123494
BRD-K55367197-001-01-3	LSM-34937	BRD-K55367197	54641101	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17-,19+/m1/s1	DDPFGBWVBZCTOM-SUMDDJOVSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@H]2CC[C@@H](NC(=O)c3cnccn3)[C@H](CO)O2	BroadT	BRD-K55367197	BRD-K55367197-001-01-3	Broad Institute of MIT and Harvard	BRD-K55367197			Cc1ccc(cc1)S(=O)(=O)NCC[C@H]1CC[C@@H](NC(=O)c2cnccn2)[C@H](CO)O1	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17-,19+/m1/s1	DDPFGBWVBZCTOM-SUMDDJOVSA-N	434.162390662							123495
BRD-K59223592-001-01-5	LSM-34938	BRD-K59223592	54641275	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24+/m0/s1	JSIXEHNVWQRETH-YZUZCNPQSA-N	OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K59223592	BRD-K59223592-001-01-5	Broad Institute of MIT and Harvard	BRD-K59223592			OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24+/m0/s1	JSIXEHNVWQRETH-YZUZCNPQSA-N	494.21653472							123496
BRD-K40048343-001-01-0	LSM-34939	BRD-K40048343	54641179	InChI=1S/C18H24F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h5-7,14-16,23H,2-4,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15+,16+/m0/s1	BITJSMRNWQFMEI-ARFHVFGLSA-N	CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@@H]1CO	BroadT	BRD-K40048343	BRD-K40048343-001-01-0	Broad Institute of MIT and Harvard	BRD-K40048343			CCC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2cc(F)cc(F)c2)O[C@@H]1CO	InChI=1S/C18H24F2N2O4/c1-2-17(24)22-15-4-3-14(26-16(15)10-23)8-18(25)21-9-11-5-12(19)7-13(20)6-11/h5-7,14-16,23H,2-4,8-10H2,1H3,(H,21,25)(H,22,24)/t14-,15+,16+/m0/s1	BITJSMRNWQFMEI-ARFHVFGLSA-N	370.170413668							123497
BRD-K02775862-001-01-5	LSM-34940	BRD-K02775862	54641193	InChI=1S/C16H22N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-9,12,14-15,17,19H,10-11H2,1-2H3/t12-,14+,15-/m0/s1	ACJRMYKVRUMDSA-CFVMTHIKSA-N	CN(C)C(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K02775862	BRD-K02775862-001-01-5	Broad Institute of MIT and Harvard	BRD-K02775862			CN(C)C(=O)C[C@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C16H22N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-9,12,14-15,17,19H,10-11H2,1-2H3/t12-,14+,15-/m0/s1	ACJRMYKVRUMDSA-CFVMTHIKSA-N	354.124942514							123498
BRD-K62909018-001-01-0	LSM-34941	BRD-K62909018	54641221	InChI=1S/C22H28N4O5/c1-30-17-7-5-15(6-8-17)25-22(29)26-19-10-9-18(31-20(19)14-27)12-21(28)24-13-16-4-2-3-11-23-16/h2-8,11,18-20,27H,9-10,12-14H2,1H3,(H,24,28)(H2,25,26,29)/t18-,19-,20+/m0/s1	GEVYJHFWGQLEQA-SLFFLAALSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccccn3)O[C@@H]2CO)cc1	BroadT	BRD-K62909018	BRD-K62909018-001-01-0	Broad Institute of MIT and Harvard	BRD-K62909018			COc1ccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccccn3)O[C@@H]2CO)cc1	InChI=1S/C22H28N4O5/c1-30-17-7-5-15(6-8-17)25-22(29)26-19-10-9-18(31-20(19)14-27)12-21(28)24-13-16-4-2-3-11-23-16/h2-8,11,18-20,27H,9-10,12-14H2,1H3,(H,24,28)(H2,25,26,29)/t18-,19-,20+/m0/s1	GEVYJHFWGQLEQA-SLFFLAALSA-N	428.205970036							123499
BRD-K56903978-001-01-9	LSM-34942	BRD-K56903978	54641188	InChI=1S/C16H22N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-9,12,14-15,17,19H,10-11H2,1-2H3/t12-,14+,15+/m1/s1	ACJRMYKVRUMDSA-SNPRPXQTSA-N	CN(C)C(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K56903978	BRD-K56903978-001-01-9	Broad Institute of MIT and Harvard	BRD-K56903978			CN(C)C(=O)C[C@@H]1O[C@@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C16H22N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-9,12,14-15,17,19H,10-11H2,1-2H3/t12-,14+,15+/m1/s1	ACJRMYKVRUMDSA-SNPRPXQTSA-N	354.124942514							123500
BRD-K26767410-001-01-1	LSM-34943	BRD-K26767410	54641073	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16-/m0/s1	DLMKWWGZUXJMAT-BPUTZDHNSA-N	CCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	BroadT	BRD-K26767410	BRD-K26767410-001-01-1	Broad Institute of MIT and Harvard	BRD-K26767410			CCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16-/m0/s1	DLMKWWGZUXJMAT-BPUTZDHNSA-N	350.164185436							123501
BRD-K73980669-001-01-0	LSM-34944	BRD-K73980669	54641250	InChI=1S/C23H32N4O5/c1-30-21-5-3-2-4-18(21)20-14-27(26-25-20)11-8-17-6-7-19(22(15-28)32-17)24-23(29)16-9-12-31-13-10-16/h2-5,14,16-17,19,22,28H,6-13,15H2,1H3,(H,24,29)/t17-,19-,22-/m1/s1	BDZIUCAOVCBDSU-SFGWALBWSA-N	COc1ccccc1c2cn(CC[C@H]3CC[C@@H](NC(=O)C4CCOCC4)[C@@H](CO)O3)nn2	BroadT	BRD-K73980669	BRD-K73980669-001-01-0	Broad Institute of MIT and Harvard	BRD-K73980669			COc1ccccc1-c1cn(CC[C@H]2CC[C@@H](NC(=O)C3CCOCC3)[C@@H](CO)O2)nn1	InChI=1S/C23H32N4O5/c1-30-21-5-3-2-4-18(21)20-14-27(26-25-20)11-8-17-6-7-19(22(15-28)32-17)24-23(29)16-9-12-31-13-10-16/h2-5,14,16-17,19,22,28H,6-13,15H2,1H3,(H,24,29)/t17-,19-,22-/m1/s1	BDZIUCAOVCBDSU-SFGWALBWSA-N	444.237270164							123502
BRD-K41072697-001-01-1	LSM-34945	BRD-K41072697	54641178	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19-/m0/s1	VEDLKNWKQGCWOE-OTWHNJEPSA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	BroadT	BRD-K41072697	BRD-K41072697-001-01-1	Broad Institute of MIT and Harvard	BRD-K41072697			CC(C)NC(=O)N[C@@H]1CC[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19-/m0/s1	VEDLKNWKQGCWOE-OTWHNJEPSA-N	389.231456502							123503
BRD-K29205927-001-01-5	LSM-34946	BRD-K29205927	54641075	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16+/m1/s1	DLMKWWGZUXJMAT-BMFZPTHFSA-N	CCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	BroadT	BRD-K29205927	BRD-K29205927-001-01-5	Broad Institute of MIT and Harvard	BRD-K29205927			CCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16+/m1/s1	DLMKWWGZUXJMAT-BMFZPTHFSA-N	350.164185436							123504
BRD-K33979639-001-01-8	LSM-34947	BRD-K33979639	54641317	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15+/m0/s1	BEBDRHVABAQOSM-SOUVJXGZSA-N	CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K33979639	BRD-K33979639-001-01-8	Broad Institute of MIT and Harvard	BRD-K33979639			CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15+/m0/s1	BEBDRHVABAQOSM-SOUVJXGZSA-N	339.215806438							123505
BRD-K82451136-001-01-6	LSM-34948	BRD-K82451136	54641177	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19-/m1/s1	VEDLKNWKQGCWOE-CEXWTWQISA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	BroadT	BRD-K82451136	BRD-K82451136-001-01-6	Broad Institute of MIT and Harvard	BRD-K82451136			CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19-/m1/s1	VEDLKNWKQGCWOE-CEXWTWQISA-N	389.231456502							123506
BRD-K09155468-001-01-1	LSM-34949	BRD-K09155468	54641246	InChI=1S/C23H32N4O5/c1-30-21-5-3-2-4-18(21)20-14-27(26-25-20)11-8-17-6-7-19(22(15-28)32-17)24-23(29)16-9-12-31-13-10-16/h2-5,14,16-17,19,22,28H,6-13,15H2,1H3,(H,24,29)/t17-,19+,22+/m0/s1	BDZIUCAOVCBDSU-LRXVAGHRSA-N	COc1ccccc1c2cn(CC[C@@H]3CC[C@@H](NC(=O)C4CCOCC4)[C@@H](CO)O3)nn2	BroadT	BRD-K09155468	BRD-K09155468-001-01-1	Broad Institute of MIT and Harvard	BRD-K09155468			COc1ccccc1-c1cn(CC[C@@H]2CC[C@@H](NC(=O)C3CCOCC3)[C@@H](CO)O2)nn1	InChI=1S/C23H32N4O5/c1-30-21-5-3-2-4-18(21)20-14-27(26-25-20)11-8-17-6-7-19(22(15-28)32-17)24-23(29)16-9-12-31-13-10-16/h2-5,14,16-17,19,22,28H,6-13,15H2,1H3,(H,24,29)/t17-,19+,22+/m0/s1	BDZIUCAOVCBDSU-LRXVAGHRSA-N	444.237270164							123507
BRD-K06907095-001-01-9	LSM-34950	BRD-K06907095	54641324	InChI=1S/C21H26FN3O5S/c22-15-4-3-6-18(12-15)31(28,29)24-11-9-17-7-8-19(20(14-26)30-17)25-21(27)13-16-5-1-2-10-23-16/h1-6,10,12,17,19-20,24,26H,7-9,11,13-14H2,(H,25,27)/t17-,19+,20+/m0/s1	OMLBRAKSFMXGRQ-DFQSSKMNSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2cccc(F)c2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K06907095	BRD-K06907095-001-01-9	Broad Institute of MIT and Harvard	BRD-K06907095			OC[C@H]1O[C@H](CCNS(=O)(=O)c2cccc(F)c2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C21H26FN3O5S/c22-15-4-3-6-18(12-15)31(28,29)24-11-9-17-7-8-19(20(14-26)30-17)25-21(27)13-16-5-1-2-10-23-16/h1-6,10,12,17,19-20,24,26H,7-9,11,13-14H2,(H,25,27)/t17-,19+,20+/m0/s1	OMLBRAKSFMXGRQ-DFQSSKMNSA-N	451.157719852							123508
BRD-K14166322-001-01-7	LSM-34951	BRD-K14166322	54641090	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19-/m1/s1	YBKWUZNDQMZJNP-CEXWTWQISA-N	OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K14166322	BRD-K14166322-001-01-7	Broad Institute of MIT and Harvard	BRD-K14166322			OC[C@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19-/m1/s1	YBKWUZNDQMZJNP-CEXWTWQISA-N	421.201299226							123509
BRD-K79047281-001-01-0	LSM-34952	BRD-K79047281	54641242	InChI=1S/C16H21FN2O5S/c1-2-18-16(21)9-12-5-8-14(15(10-20)24-12)19-25(22,23)13-6-3-11(17)4-7-13/h3-8,12,14-15,19-20H,2,9-10H2,1H3,(H,18,21)/t12-,14-,15+/m0/s1	UOWXRGDLFUDMAF-AEGPPILISA-N	CCNC(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccc(F)cc2)C=C1	BroadT	BRD-K79047281	BRD-K79047281-001-01-0	Broad Institute of MIT and Harvard	BRD-K79047281			CCNC(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccc(F)cc2)C=C1	InChI=1S/C16H21FN2O5S/c1-2-18-16(21)9-12-5-8-14(15(10-20)24-12)19-25(22,23)13-6-3-11(17)4-7-13/h3-8,12,14-15,19-20H,2,9-10H2,1H3,(H,18,21)/t12-,14-,15+/m0/s1	UOWXRGDLFUDMAF-AEGPPILISA-N	372.115520682							123510
BRD-K39628918-001-01-7	LSM-34953	BRD-K39628918	54641173	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19-/m1/s1	VEDLKNWKQGCWOE-GUDVDZBRSA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	BroadT	BRD-K39628918	BRD-K39628918-001-01-7	Broad Institute of MIT and Harvard	BRD-K39628918			CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19-/m1/s1	VEDLKNWKQGCWOE-GUDVDZBRSA-N	389.231456502							123511
BRD-K86324038-001-01-0	LSM-34954	BRD-K86324038	54641285	InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19-,20-/m0/s1	RVDWTGCIOVVFDR-UFYCRDLUSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K86324038	BRD-K86324038-001-01-0	Broad Institute of MIT and Harvard	BRD-K86324038			Cn1cnc(c1)S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@H]1CO	InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19-,20-/m0/s1	RVDWTGCIOVVFDR-UFYCRDLUSA-N	477.204589832							123512
BRD-K90748516-001-01-5	LSM-34955	BRD-K90748516	54641363	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18-,19-/m1/s1	CRKZLQDDCDYEJL-GUDVDZBRSA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K90748516	BRD-K90748516-001-01-5	Broad Institute of MIT and Harvard	BRD-K90748516			OC[C@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18-,19-/m1/s1	CRKZLQDDCDYEJL-GUDVDZBRSA-N	463.1986322							123513
BRD-K11182882-001-01-9	LSM-34956	BRD-K11182882	54641087	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19-/m0/s1	YBKWUZNDQMZJNP-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K11182882	BRD-K11182882-001-01-9	Broad Institute of MIT and Harvard	BRD-K11182882			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18-,19-/m0/s1	YBKWUZNDQMZJNP-FHWLQOOXSA-N	421.201299226							123514
BRD-K90488649-001-01-8	LSM-34957	BRD-K90488649	54641359	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18+,19+/m0/s1	CRKZLQDDCDYEJL-IPMKNSEASA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K90488649	BRD-K90488649-001-01-8	Broad Institute of MIT and Harvard	BRD-K90488649			OC[C@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18+,19+/m0/s1	CRKZLQDDCDYEJL-IPMKNSEASA-N	463.1986322							123515
BRD-K03028108-001-01-2	LSM-34958	BRD-K03028108	54641227	InChI=1S/C17H31N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h12-15,21H,3-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15+/m0/s1	GTWYPIFYOHIWKX-SOUVJXGZSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K03028108	BRD-K03028108-001-01-2	Broad Institute of MIT and Harvard	BRD-K03028108			CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C17H31N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h12-15,21H,3-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15+/m0/s1	GTWYPIFYOHIWKX-SOUVJXGZSA-N	341.231456502							123516
CHEMBL2360008	LSM-34959	SID131437418, BRD-K37037521	54641105	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17+,19-/m0/s1	DDPFGBWVBZCTOM-WDYCEAGBSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]2CC[C@@H](NC(=O)c3cnccn3)[C@H](CO)O2	BroadT	BRD-K37037521	BRD-K37037521-001-01-2	Broad Institute of MIT and Harvard	BRD-K37037521			Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)c2cnccn2)[C@H](CO)O1	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17+,19-/m0/s1	DDPFGBWVBZCTOM-WDYCEAGBSA-N	434.162390662							123517
BRD-K41151625-001-01-0	LSM-34960	BRD-K41151625	54641128	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19+,20-/m1/s1	FXQPIHLBIKTXQP-UIAACRFSSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K41151625	BRD-K41151625-001-01-0	Broad Institute of MIT and Harvard	BRD-K41151625			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19+,20-/m1/s1	FXQPIHLBIKTXQP-UIAACRFSSA-N	485.11874753							123518
BRD-K66211801-001-01-8	LSM-34961	BRD-K66211801	54641311	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20-,21-/m0/s1	GXRAKWRWAOCDKZ-YYWHXJBOSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c3ccccc3F	BroadT	BRD-K66211801	BRD-K66211801-001-01-8	Broad Institute of MIT and Harvard	BRD-K66211801			OC[C@@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20-,21-/m0/s1	GXRAKWRWAOCDKZ-YYWHXJBOSA-N	450.162470874							123519
BRD-K36569842-001-01-7	LSM-34962	BRD-K36569842	54641119	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19-,22+/m0/s1	IDXOYAHYVHCYJQ-TUXJCPBXSA-N	C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Nc2ccc3OCOc3c2)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K36569842	BRD-K36569842-001-01-7	Broad Institute of MIT and Harvard	BRD-K36569842			C[C@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Nc2ccc3OCOc3c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19-,22+/m0/s1	IDXOYAHYVHCYJQ-TUXJCPBXSA-N	455.205635678							123520
BRD-K08075306-001-01-8	LSM-34963	BRD-K08075306	54641313	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14+,15+/m0/s1	BEBDRHVABAQOSM-RRFJBIMHSA-N	CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K08075306	BRD-K08075306-001-01-8	Broad Institute of MIT and Harvard	BRD-K08075306			CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14+,15+/m0/s1	BEBDRHVABAQOSM-RRFJBIMHSA-N	339.215806438							123521
BRD-K48818351-001-01-7	LSM-34964	BRD-K48818351	54641364	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18-,19-/m0/s1	CRKZLQDDCDYEJL-FHWLQOOXSA-N	OC[C@@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K48818351	BRD-K48818351-001-01-7	Broad Institute of MIT and Harvard	BRD-K48818351			OC[C@@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18-,19-/m0/s1	CRKZLQDDCDYEJL-FHWLQOOXSA-N	463.1986322							123522
BRD-K45134947-001-01-3	LSM-34965	BRD-K45134947	54641064	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16+,17+/m1/s1	XXVQYUMJVNBNLA-IKGGRYGDSA-N	CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccc(OC)cc2)O[C@H]1CO	BroadT	BRD-K45134947	BRD-K45134947-001-01-3	Broad Institute of MIT and Harvard	BRD-K45134947			CCC(=O)N[C@H]1C=C[C@@H](O[C@H]1CO)CC(=O)NCc1ccc(OC)cc1	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16+,17+/m1/s1	XXVQYUMJVNBNLA-IKGGRYGDSA-N	362.184171952							123523
BRD-K55627667-001-01-1	LSM-34966	BRD-K55627667	54641215	InChI=1S/C19H28FN3O4/c1-12(2)22-19(26)21-10-9-15-7-8-16(17(11-24)27-15)23-18(25)13-3-5-14(20)6-4-13/h3-6,12,15-17,24H,7-11H2,1-2H3,(H,23,25)(H2,21,22,26)/t15-,16+,17-/m1/s1	ZZEIDMWSYAIZDJ-IXDOHACOSA-N	CC(C)NC(=O)NCC[C@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	BroadT	BRD-K55627667	BRD-K55627667-001-01-1	Broad Institute of MIT and Harvard	BRD-K55627667			CC(C)NC(=O)NCC[C@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1	InChI=1S/C19H28FN3O4/c1-12(2)22-19(26)21-10-9-15-7-8-16(17(11-24)27-15)23-18(25)13-3-5-14(20)6-4-13/h3-6,12,15-17,24H,7-11H2,1-2H3,(H,23,25)(H2,21,22,26)/t15-,16+,17-/m1/s1	ZZEIDMWSYAIZDJ-IXDOHACOSA-N	381.206384606							123524
BRD-K39784035-001-01-6	LSM-34967	BRD-K39784035	54641194	InChI=1S/C21H31N3O4/c25-14-19-18(24-21(27)16-8-10-22-11-9-16)7-6-17(28-19)12-20(26)23-13-15-4-2-1-3-5-15/h8-11,15,17-19,25H,1-7,12-14H2,(H,23,26)(H,24,27)/t17-,18+,19+/m0/s1	BHIMCRWNSGTPOE-IPMKNSEASA-N	OC[C@H]1O[C@H](CC(=O)NCC2CCCCC2)CC[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K39784035	BRD-K39784035-001-01-6	Broad Institute of MIT and Harvard	BRD-K39784035			OC[C@H]1O[C@H](CC(=O)NCC2CCCCC2)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C21H31N3O4/c25-14-19-18(24-21(27)16-8-10-22-11-9-16)7-6-17(28-19)12-20(26)23-13-15-4-2-1-3-5-15/h8-11,15,17-19,25H,1-7,12-14H2,(H,23,26)(H,24,27)/t17-,18+,19+/m0/s1	BHIMCRWNSGTPOE-IPMKNSEASA-N	389.231456502							123525
BRD-K79446376-001-01-0	LSM-34968	BRD-K79446376	54641206	InChI=1S/C20H27Cl2N5O3/c1-12(2)18-10-27(26-25-18)6-5-16-3-4-17(19(11-28)30-16)24-20(29)23-15-8-13(21)7-14(22)9-15/h7-10,12,16-17,19,28H,3-6,11H2,1-2H3,(H2,23,24,29)/t16-,17-,19-/m0/s1	WAMQJZQECGGADK-LNLFQRSKSA-N	CC(C)c1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3cc(Cl)cc(Cl)c3)[C@H](CO)O2)nn1	BroadT	BRD-K79446376	BRD-K79446376-001-01-0	Broad Institute of MIT and Harvard	BRD-K79446376			CC(C)c1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3cc(Cl)cc(Cl)c3)[C@H](CO)O2)nn1	InChI=1S/C20H27Cl2N5O3/c1-12(2)18-10-27(26-25-18)6-5-16-3-4-17(19(11-28)30-16)24-20(29)23-15-8-13(21)7-14(22)9-15/h7-10,12,16-17,19,28H,3-6,11H2,1-2H3,(H2,23,24,29)/t16-,17-,19-/m0/s1	WAMQJZQECGGADK-LNLFQRSKSA-N	455.149095194							123526
BRD-K65859637-001-01-5	LSM-34969	BRD-K65859637	54641124	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19-,20+/m0/s1	FXQPIHLBIKTXQP-RYGJVYDSSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K65859637	BRD-K65859637-001-01-5	Broad Institute of MIT and Harvard	BRD-K65859637			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19-,20+/m0/s1	FXQPIHLBIKTXQP-RYGJVYDSSA-N	485.11874753							123527
BRD-K38862476-001-01-7	LSM-34970	BRD-K38862476	54641220	InChI=1S/C22H28N4O5/c1-30-17-7-5-15(6-8-17)25-22(29)26-19-10-9-18(31-20(19)14-27)12-21(28)24-13-16-4-2-3-11-23-16/h2-8,11,18-20,27H,9-10,12-14H2,1H3,(H,24,28)(H2,25,26,29)/t18-,19-,20-/m0/s1	GEVYJHFWGQLEQA-UFYCRDLUSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccccn3)O[C@H]2CO)cc1	BroadT	BRD-K38862476	BRD-K38862476-001-01-7	Broad Institute of MIT and Harvard	BRD-K38862476			COc1ccc(NC(=O)N[C@H]2CC[C@@H](CC(=O)NCc3ccccn3)O[C@H]2CO)cc1	InChI=1S/C22H28N4O5/c1-30-17-7-5-15(6-8-17)25-22(29)26-19-10-9-18(31-20(19)14-27)12-21(28)24-13-16-4-2-3-11-23-16/h2-8,11,18-20,27H,9-10,12-14H2,1H3,(H,24,28)(H2,25,26,29)/t18-,19-,20-/m0/s1	GEVYJHFWGQLEQA-UFYCRDLUSA-N	428.205970036							123528
BRD-K20152345-001-01-2	LSM-34971	BRD-K20152345	54641316	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15-/m0/s1	BEBDRHVABAQOSM-KKUMJFAQSA-N	CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K20152345	BRD-K20152345-001-01-2	Broad Institute of MIT and Harvard	BRD-K20152345			CC(C)NC(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15-/m0/s1	BEBDRHVABAQOSM-KKUMJFAQSA-N	339.215806438							123529
BRD-K20361496-001-01-6	LSM-34972	BRD-K20361496	54641307	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20-,21+/m0/s1	GXRAKWRWAOCDKZ-DZFGPLHGSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c3ccccc3F	BroadT	BRD-K20361496	BRD-K20361496-001-01-6	Broad Institute of MIT and Harvard	BRD-K20361496			OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20-,21+/m0/s1	GXRAKWRWAOCDKZ-DZFGPLHGSA-N	450.162470874							123530
BRD-K01358448-001-01-4	LSM-34973	BRD-K01358448	54641203	InChI=1S/C20H27Cl2N5O3/c1-12(2)18-10-27(26-25-18)6-5-16-3-4-17(19(11-28)30-16)24-20(29)23-15-8-13(21)7-14(22)9-15/h7-10,12,16-17,19,28H,3-6,11H2,1-2H3,(H2,23,24,29)/t16-,17+,19+/m1/s1	WAMQJZQECGGADK-AOIWGVFYSA-N	CC(C)c1cn(CC[C@H]2CC[C@H](NC(=O)Nc3cc(Cl)cc(Cl)c3)[C@H](CO)O2)nn1	BroadT	BRD-K01358448	BRD-K01358448-001-01-4	Broad Institute of MIT and Harvard	BRD-K01358448			CC(C)c1cn(CC[C@H]2CC[C@H](NC(=O)Nc3cc(Cl)cc(Cl)c3)[C@H](CO)O2)nn1	InChI=1S/C20H27Cl2N5O3/c1-12(2)18-10-27(26-25-18)6-5-16-3-4-17(19(11-28)30-16)24-20(29)23-15-8-13(21)7-14(22)9-15/h7-10,12,16-17,19,28H,3-6,11H2,1-2H3,(H2,23,24,29)/t16-,17+,19+/m1/s1	WAMQJZQECGGADK-AOIWGVFYSA-N	455.149095194							123531
BRD-K34257113-001-01-3	LSM-34974	BRD-K34257113	54641256	InChI=1S/C14H24N2O4/c1-2-15-13(18)7-10-5-6-11(12(8-17)20-10)16-14(19)9-3-4-9/h9-12,17H,2-8H2,1H3,(H,15,18)(H,16,19)/t10-,11-,12-/m1/s1	BTMFLGLOUFNMEW-IJLUTSLNSA-N	CCNC(=O)C[C@H]1CC[C@@H](NC(=O)C2CC2)[C@@H](CO)O1	BroadT	BRD-K34257113	BRD-K34257113-001-01-3	Broad Institute of MIT and Harvard	BRD-K34257113			CCNC(=O)C[C@H]1CC[C@@H](NC(=O)C2CC2)[C@@H](CO)O1	InChI=1S/C14H24N2O4/c1-2-15-13(18)7-10-5-6-11(12(8-17)20-10)16-14(19)9-3-4-9/h9-12,17H,2-8H2,1H3,(H,15,18)(H,16,19)/t10-,11-,12-/m1/s1	BTMFLGLOUFNMEW-IJLUTSLNSA-N	284.173607268							123532
BRD-K53357510-001-01-6	LSM-34975	BRD-K53357510	54641278	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24+/m0/s1	JSIXEHNVWQRETH-AWRGLXIESA-N	OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K53357510	BRD-K53357510-001-01-6	Broad Institute of MIT and Harvard	BRD-K53357510			OC[C@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24+/m0/s1	JSIXEHNVWQRETH-AWRGLXIESA-N	494.21653472							123533
BRD-K89691421-001-01-4	LSM-34976	BRD-K89691421	54641257	InChI=1S/C14H24N2O4/c1-2-15-13(18)7-10-5-6-11(12(8-17)20-10)16-14(19)9-3-4-9/h9-12,17H,2-8H2,1H3,(H,15,18)(H,16,19)/t10-,11-,12-/m0/s1	BTMFLGLOUFNMEW-SRVKXCTJSA-N	CCNC(=O)C[C@@H]1CC[C@H](NC(=O)C2CC2)[C@H](CO)O1	BroadT	BRD-K89691421	BRD-K89691421-001-01-4	Broad Institute of MIT and Harvard	BRD-K89691421			CCNC(=O)C[C@@H]1CC[C@H](NC(=O)C2CC2)[C@H](CO)O1	InChI=1S/C14H24N2O4/c1-2-15-13(18)7-10-5-6-11(12(8-17)20-10)16-14(19)9-3-4-9/h9-12,17H,2-8H2,1H3,(H,15,18)(H,16,19)/t10-,11-,12-/m0/s1	BTMFLGLOUFNMEW-SRVKXCTJSA-N	284.173607268							123534
BRD-K92163754-001-01-6	LSM-34977	BRD-K92163754	54641096	InChI=1S/C23H31Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4-7,12,17,20-21,29H,1-3,8-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21-/m1/s1	FPUISOVZIDCXHC-JRGCBEDISA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K92163754	BRD-K92163754-001-01-6	Broad Institute of MIT and Harvard	BRD-K92163754			OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H31Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4-7,12,17,20-21,29H,1-3,8-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21-/m1/s1	FPUISOVZIDCXHC-JRGCBEDISA-N	483.169161922							123535
BRD-K09541394-001-01-1	LSM-34978	BRD-K09541394	54641287	InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19-,20+/m1/s1	RVDWTGCIOVVFDR-AQNXPRMDSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2CC[C@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K09541394	BRD-K09541394-001-01-1	Broad Institute of MIT and Harvard	BRD-K09541394			Cn1cnc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@H]1CO	InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19-,20+/m1/s1	RVDWTGCIOVVFDR-AQNXPRMDSA-N	477.204589832							123536
BRD-K99766666-001-01-6	LSM-34979	BRD-K99766666	54641114	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19+,22-/m1/s1	IDXOYAHYVHCYJQ-JHGBEIFQSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)Nc2ccc3OCOc3c2)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K99766666	BRD-K99766666-001-01-6	Broad Institute of MIT and Harvard	BRD-K99766666			C[C@@H](NC(=O)C[C@@H]1CC[C@H](NC(=O)Nc2ccc3OCOc3c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19+,22-/m1/s1	IDXOYAHYVHCYJQ-JHGBEIFQSA-N	455.205635678							123537
BRD-K82622700-001-01-8	LSM-34980	BRD-K82622700	54641068	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16-,17+/m1/s1	XXVQYUMJVNBNLA-ZACQAIPSSA-N	CCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccc(OC)cc2)O[C@H]1CO	BroadT	BRD-K82622700	BRD-K82622700-001-01-8	Broad Institute of MIT and Harvard	BRD-K82622700			CCC(=O)N[C@@H]1C=C[C@@H](O[C@H]1CO)CC(=O)NCc1ccc(OC)cc1	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16-,17+/m1/s1	XXVQYUMJVNBNLA-ZACQAIPSSA-N	362.184171952							123538
BRD-K74971043-001-01-5	LSM-34981	BRD-K74971043	54641274	InChI=1S/C24H25F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-8,11,18,20,22,30H,9-10,12-14H2,(H2,27,28,32)/t18-,20+,22-/m0/s1	VFYUOAWVFXISPO-DWLFOUALSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C=C[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K74971043	BRD-K74971043-001-01-5	Broad Institute of MIT and Harvard	BRD-K74971043			OC[C@@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C=C[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C24H25F2N3O4/c25-17-5-7-19(26)21(11-17)28-24(32)27-20-8-6-18(33-22(20)14-30)12-23(31)29-10-9-15-3-1-2-4-16(15)13-29/h1-8,11,18,20,22,30H,9-10,12-14H2,(H2,27,28,32)/t18-,20+,22-/m0/s1	VFYUOAWVFXISPO-DWLFOUALSA-N	457.18131271							123539
BRD-K43766497-001-01-8	LSM-34982	BRD-K43766497	54641109	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22+/m1/s1	IDXOYAHYVHCYJQ-UUIWEUTOSA-N	C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Nc2ccc3OCOc3c2)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K43766497	BRD-K43766497-001-01-8	Broad Institute of MIT and Harvard	BRD-K43766497			C[C@@H](NC(=O)C[C@H]1CC[C@H](NC(=O)Nc2ccc3OCOc3c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22+/m1/s1	IDXOYAHYVHCYJQ-UUIWEUTOSA-N	455.205635678							123540
BRD-K45664515-001-01-1	LSM-34983	BRD-K45664515	54641261	InChI=1S/C14H24N2O4/c1-2-15-13(18)7-10-5-6-11(12(8-17)20-10)16-14(19)9-3-4-9/h9-12,17H,2-8H2,1H3,(H,15,18)(H,16,19)/t10-,11+,12-/m0/s1	BTMFLGLOUFNMEW-TUAOUCFPSA-N	CCNC(=O)C[C@@H]1CC[C@@H](NC(=O)C2CC2)[C@H](CO)O1	BroadT	BRD-K45664515	BRD-K45664515-001-01-1	Broad Institute of MIT and Harvard	BRD-K45664515			CCNC(=O)C[C@@H]1CC[C@@H](NC(=O)C2CC2)[C@H](CO)O1	InChI=1S/C14H24N2O4/c1-2-15-13(18)7-10-5-6-11(12(8-17)20-10)16-14(19)9-3-4-9/h9-12,17H,2-8H2,1H3,(H,15,18)(H,16,19)/t10-,11+,12-/m0/s1	BTMFLGLOUFNMEW-TUAOUCFPSA-N	284.173607268							123541
BRD-K05367966-001-01-3	LSM-34984	BRD-K05367966	54641218	InChI=1S/C22H28N4O5/c1-30-17-7-5-15(6-8-17)25-22(29)26-19-10-9-18(31-20(19)14-27)12-21(28)24-13-16-4-2-3-11-23-16/h2-8,11,18-20,27H,9-10,12-14H2,1H3,(H,24,28)(H2,25,26,29)/t18-,19+,20+/m1/s1	GEVYJHFWGQLEQA-AABGKKOBSA-N	COc1ccc(NC(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccccn3)O[C@H]2CO)cc1	BroadT	BRD-K05367966	BRD-K05367966-001-01-3	Broad Institute of MIT and Harvard	BRD-K05367966			COc1ccc(NC(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccccn3)O[C@H]2CO)cc1	InChI=1S/C22H28N4O5/c1-30-17-7-5-15(6-8-17)25-22(29)26-19-10-9-18(31-20(19)14-27)12-21(28)24-13-16-4-2-3-11-23-16/h2-8,11,18-20,27H,9-10,12-14H2,1H3,(H,24,28)(H2,25,26,29)/t18-,19+,20+/m1/s1	GEVYJHFWGQLEQA-AABGKKOBSA-N	428.205970036							123542
BRD-K65337672-001-01-8	LSM-34985	BRD-K65337672	54641097	InChI=1S/C23H31Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4-7,12,17,20-21,29H,1-3,8-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21-/m0/s1	FPUISOVZIDCXHC-WMQCIHAUSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K65337672	BRD-K65337672-001-01-8	Broad Institute of MIT and Harvard	BRD-K65337672			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H31Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4-7,12,17,20-21,29H,1-3,8-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21-/m0/s1	FPUISOVZIDCXHC-WMQCIHAUSA-N	483.169161922							123543
BRD-K93021322-001-01-8	LSM-34986	BRD-K93021322	54641368	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-2,4,6-8,15,17,21,29H,3,5,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17+,21+/m1/s1	RFHDZNJROOVZQK-KUDFPVQQSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K93021322	BRD-K93021322-001-01-8	Broad Institute of MIT and Harvard	BRD-K93021322			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-2,4,6-8,15,17,21,29H,3,5,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17+,21+/m1/s1	RFHDZNJROOVZQK-KUDFPVQQSA-N	477.17114195							123544
BRD-K68867948-001-01-9	LSM-34987	BRD-K68867948	54641189	InChI=1S/C16H22N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-9,12,14-15,17,19H,10-11H2,1-2H3/t12-,14-,15-/m1/s1	ACJRMYKVRUMDSA-BPLDGKMQSA-N	CN(C)C(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K68867948	BRD-K68867948-001-01-9	Broad Institute of MIT and Harvard	BRD-K68867948			CN(C)C(=O)C[C@@H]1O[C@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C16H22N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-9,12,14-15,17,19H,10-11H2,1-2H3/t12-,14-,15-/m1/s1	ACJRMYKVRUMDSA-BPLDGKMQSA-N	354.124942514							123545
BRD-K58312590-001-01-9	LSM-34988	BRD-K58312590	54641326	InChI=1S/C21H26FN3O5S/c22-15-4-3-6-18(12-15)31(28,29)24-11-9-17-7-8-19(20(14-26)30-17)25-21(27)13-16-5-1-2-10-23-16/h1-6,10,12,17,19-20,24,26H,7-9,11,13-14H2,(H,25,27)/t17-,19-,20-/m1/s1	OMLBRAKSFMXGRQ-MISYRCLQSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2cccc(F)c2)CC[C@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K58312590	BRD-K58312590-001-01-9	Broad Institute of MIT and Harvard	BRD-K58312590			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2cccc(F)c2)CC[C@H]1NC(=O)Cc1ccccn1	InChI=1S/C21H26FN3O5S/c22-15-4-3-6-18(12-15)31(28,29)24-11-9-17-7-8-19(20(14-26)30-17)25-21(27)13-16-5-1-2-10-23-16/h1-6,10,12,17,19-20,24,26H,7-9,11,13-14H2,(H,25,27)/t17-,19-,20-/m1/s1	OMLBRAKSFMXGRQ-MISYRCLQSA-N	451.157719852							123546
BRD-K95882018-001-01-0	LSM-34989	BRD-K95882018	54641157	InChI=1S/C18H28FN3O5S/c1-2-9-20-18(24)22-16-7-6-14(27-17(16)12-23)8-10-21-28(25,26)15-5-3-4-13(19)11-15/h3-5,11,14,16-17,21,23H,2,6-10,12H2,1H3,(H2,20,22,24)/t14-,16-,17+/m0/s1	QCWCRAHEENXEDE-BHYGNILZSA-N	CCCNC(=O)N[C@H]1CC[C@@H](CCNS(=O)(=O)c2cccc(F)c2)O[C@@H]1CO	BroadT	BRD-K95882018	BRD-K95882018-001-01-0	Broad Institute of MIT and Harvard	BRD-K95882018			CCCNC(=O)N[C@H]1CC[C@@H](CCNS(=O)(=O)c2cccc(F)c2)O[C@@H]1CO	InChI=1S/C18H28FN3O5S/c1-2-9-20-18(24)22-16-7-6-14(27-17(16)12-23)8-10-21-28(25,26)15-5-3-4-13(19)11-15/h3-5,11,14,16-17,21,23H,2,6-10,12H2,1H3,(H2,20,22,24)/t14-,16-,17+/m0/s1	QCWCRAHEENXEDE-BHYGNILZSA-N	417.173369916							123547
BRD-K28073972-001-01-2	LSM-34990	BRD-K28073972	54641222	InChI=1S/C22H28N4O5/c1-30-17-7-5-15(6-8-17)25-22(29)26-19-10-9-18(31-20(19)14-27)12-21(28)24-13-16-4-2-3-11-23-16/h2-8,11,18-20,27H,9-10,12-14H2,1H3,(H,24,28)(H2,25,26,29)/t18-,19-,20+/m1/s1	GEVYJHFWGQLEQA-AQNXPRMDSA-N	COc1ccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccccn3)O[C@H]2CO)cc1	BroadT	BRD-K28073972	BRD-K28073972-001-01-2	Broad Institute of MIT and Harvard	BRD-K28073972			COc1ccc(NC(=O)N[C@@H]2CC[C@H](CC(=O)NCc3ccccn3)O[C@H]2CO)cc1	InChI=1S/C22H28N4O5/c1-30-17-7-5-15(6-8-17)25-22(29)26-19-10-9-18(31-20(19)14-27)12-21(28)24-13-16-4-2-3-11-23-16/h2-8,11,18-20,27H,9-10,12-14H2,1H3,(H,24,28)(H2,25,26,29)/t18-,19-,20+/m1/s1	GEVYJHFWGQLEQA-AQNXPRMDSA-N	428.205970036							123548
BRD-K32683110-001-01-5	LSM-34991	BRD-K32683110	54641154	InChI=1S/C18H28FN3O5S/c1-2-9-20-18(24)22-16-7-6-14(27-17(16)12-23)8-10-21-28(25,26)15-5-3-4-13(19)11-15/h3-5,11,14,16-17,21,23H,2,6-10,12H2,1H3,(H2,20,22,24)/t14-,16+,17+/m1/s1	QCWCRAHEENXEDE-PVAVHDDUSA-N	CCCNC(=O)N[C@H]1CC[C@H](CCNS(=O)(=O)c2cccc(F)c2)O[C@H]1CO	BroadT	BRD-K32683110	BRD-K32683110-001-01-5	Broad Institute of MIT and Harvard	BRD-K32683110			CCCNC(=O)N[C@H]1CC[C@H](CCNS(=O)(=O)c2cccc(F)c2)O[C@H]1CO	InChI=1S/C18H28FN3O5S/c1-2-9-20-18(24)22-16-7-6-14(27-17(16)12-23)8-10-21-28(25,26)15-5-3-4-13(19)11-15/h3-5,11,14,16-17,21,23H,2,6-10,12H2,1H3,(H2,20,22,24)/t14-,16+,17+/m1/s1	QCWCRAHEENXEDE-PVAVHDDUSA-N	417.173369916							123549
BRD-K29548095-001-01-4	LSM-34992	BRD-K29548095	54641321	InChI=1S/C14H16N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h1-6,10-12,17H,7-8H2,(H,16,20)(H,18,19)/t10-,11-,12+/m0/s1	IZKTYYLZYIIGGX-SDDRHHMPSA-N	OC[C@H]1O[C@H](CC(=O)O)C=C[C@@H]1NC(=O)c2ccncc2	BroadT	BRD-K29548095	BRD-K29548095-001-01-4	Broad Institute of MIT and Harvard	BRD-K29548095			OC[C@H]1O[C@H](CC(O)=O)C=C[C@@H]1NC(=O)c1ccncc1	InChI=1S/C14H16N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h1-6,10-12,17H,7-8H2,(H,16,20)(H,18,19)/t10-,11-,12+/m0/s1	IZKTYYLZYIIGGX-SDDRHHMPSA-N	292.105921632							123550
BRD-K16573415-001-01-0	LSM-34993	BRD-K16573415	54641091	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19-/m0/s1	YBKWUZNDQMZJNP-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K16573415	BRD-K16573415-001-01-0	Broad Institute of MIT and Harvard	BRD-K16573415			OC[C@@H]1O[C@H](CC(=O)NCc2cccc(F)c2)C=C[C@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19-/m0/s1	YBKWUZNDQMZJNP-OTWHNJEPSA-N	421.201299226							123551
BRD-K30158311-001-01-7	LSM-34994	BRD-K30158311	54641076	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16-/m1/s1	DLMKWWGZUXJMAT-VNQPRFMTSA-N	CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	BroadT	BRD-K30158311	BRD-K30158311-001-01-7	Broad Institute of MIT and Harvard	BRD-K30158311			CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16-/m1/s1	DLMKWWGZUXJMAT-VNQPRFMTSA-N	350.164185436							123552
BRD-K20546229-001-01-6	LSM-34995	BRD-K20546229	54641131	InChI=1S/C21H26Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3,5,7,14,17-18,28H,4,6,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17+,18+/m0/s1	PLXQZJRBLQQGKU-BMGDILEWSA-N	Cc1onc(C)c1NC(=O)N[C@@H]2CC[C@@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@@H]2CO	BroadT	BRD-K20546229	BRD-K20546229-001-01-6	Broad Institute of MIT and Harvard	BRD-K20546229			Cc1noc(C)c1NC(=O)N[C@@H]1CC[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@@H]1CO	InChI=1S/C21H26Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3,5,7,14,17-18,28H,4,6,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17+,18+/m0/s1	PLXQZJRBLQQGKU-BMGDILEWSA-N	484.128025392							123553
BRD-K89838866-001-01-3	LSM-34996	BRD-K89838866	54641283	InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19+,20+/m1/s1	RVDWTGCIOVVFDR-AABGKKOBSA-N	Cn1cnc(c1)S(=O)(=O)N[C@H]2CC[C@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@H]2CO	BroadT	BRD-K89838866	BRD-K89838866-001-01-3	Broad Institute of MIT and Harvard	BRD-K89838866			Cn1cnc(c1)S(=O)(=O)N[C@H]1CC[C@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@H]1CO	InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19+,20+/m1/s1	RVDWTGCIOVVFDR-AABGKKOBSA-N	477.204589832							123554
BRD-K43664564-001-01-3	LSM-34997	BRD-K43664564	54641176	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19+/m1/s1	VEDLKNWKQGCWOE-QRVBRYPASA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	BroadT	BRD-K43664564	BRD-K43664564-001-01-3	Broad Institute of MIT and Harvard	BRD-K43664564			CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18-,19+/m1/s1	VEDLKNWKQGCWOE-QRVBRYPASA-N	389.231456502							123555
BRD-K34495942-001-01-6	LSM-34998	BRD-K34495942	54641282	InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19+,20+/m0/s1	RVDWTGCIOVVFDR-XUVXKRRUSA-N	Cn1cnc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)N3CCN(CC3)c4ccccc4)O[C@@H]2CO	BroadT	BRD-K34495942	BRD-K34495942-001-01-6	Broad Institute of MIT and Harvard	BRD-K34495942			Cn1cnc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)O[C@@H]1CO	InChI=1S/C22H31N5O5S/c1-25-14-21(23-16-25)33(30,31)24-19-8-7-18(32-20(19)15-28)13-22(29)27-11-9-26(10-12-27)17-5-3-2-4-6-17/h2-6,14,16,18-20,24,28H,7-13,15H2,1H3/t18-,19+,20+/m0/s1	RVDWTGCIOVVFDR-XUVXKRRUSA-N	477.204589832							123556
BRD-K10072705-001-01-8	LSM-34999	BRD-K10072705	54641247	InChI=1S/C23H32N4O5/c1-30-21-5-3-2-4-18(21)20-14-27(26-25-20)11-8-17-6-7-19(22(15-28)32-17)24-23(29)16-9-12-31-13-10-16/h2-5,14,16-17,19,22,28H,6-13,15H2,1H3,(H,24,29)/t17-,19+,22+/m1/s1	BDZIUCAOVCBDSU-LZNRXBQRSA-N	COc1ccccc1c2cn(CC[C@H]3CC[C@H](NC(=O)C4CCOCC4)[C@H](CO)O3)nn2	BroadT	BRD-K10072705	BRD-K10072705-001-01-8	Broad Institute of MIT and Harvard	BRD-K10072705			COc1ccccc1-c1cn(CC[C@H]2CC[C@H](NC(=O)C3CCOCC3)[C@H](CO)O2)nn1	InChI=1S/C23H32N4O5/c1-30-21-5-3-2-4-18(21)20-14-27(26-25-20)11-8-17-6-7-19(22(15-28)32-17)24-23(29)16-9-12-31-13-10-16/h2-5,14,16-17,19,22,28H,6-13,15H2,1H3,(H,24,29)/t17-,19+,22+/m1/s1	BDZIUCAOVCBDSU-LZNRXBQRSA-N	444.237270164							123557
BRD-K99027107-001-01-0	LSM-35000	BRD-K99027107	54641325	InChI=1S/C21H26FN3O5S/c22-15-4-3-6-18(12-15)31(28,29)24-11-9-17-7-8-19(20(14-26)30-17)25-21(27)13-16-5-1-2-10-23-16/h1-6,10,12,17,19-20,24,26H,7-9,11,13-14H2,(H,25,27)/t17-,19+,20+/m1/s1	OMLBRAKSFMXGRQ-HOJAQTOUSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2cccc(F)c2)CC[C@@H]1NC(=O)Cc3ccccn3	BroadT	BRD-K99027107	BRD-K99027107-001-01-0	Broad Institute of MIT and Harvard	BRD-K99027107			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2cccc(F)c2)CC[C@@H]1NC(=O)Cc1ccccn1	InChI=1S/C21H26FN3O5S/c22-15-4-3-6-18(12-15)31(28,29)24-11-9-17-7-8-19(20(14-26)30-17)25-21(27)13-16-5-1-2-10-23-16/h1-6,10,12,17,19-20,24,26H,7-9,11,13-14H2,(H,25,27)/t17-,19+,20+/m1/s1	OMLBRAKSFMXGRQ-HOJAQTOUSA-N	451.157719852							123558
BRD-K24873600-001-01-9	LSM-35001	BRD-K24873600	54641067	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16-,17+/m0/s1	XXVQYUMJVNBNLA-YESZJQIVSA-N	CCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccc(OC)cc2)O[C@@H]1CO	BroadT	BRD-K24873600	BRD-K24873600-001-01-9	Broad Institute of MIT and Harvard	BRD-K24873600			CCC(=O)N[C@H]1C=C[C@H](O[C@@H]1CO)CC(=O)NCc1ccc(OC)cc1	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16-,17+/m0/s1	XXVQYUMJVNBNLA-YESZJQIVSA-N	362.184171952							123559
BRD-K42358458-001-01-2	LSM-35002	BRD-K42358458	54641226	InChI=1S/C17H31N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h12-15,21H,3-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15-/m0/s1	GTWYPIFYOHIWKX-KKUMJFAQSA-N	CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K42358458	BRD-K42358458-001-01-2	Broad Institute of MIT and Harvard	BRD-K42358458			CC(C)NC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C17H31N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h12-15,21H,3-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15-/m0/s1	GTWYPIFYOHIWKX-KKUMJFAQSA-N	341.231456502							123560
BRD-K29081836-001-01-0	LSM-35003	BRD-K29081836	54641093	InChI=1S/C23H31Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4-7,12,17,20-21,29H,1-3,8-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21-/m0/s1	FPUISOVZIDCXHC-YYWHXJBOSA-N	OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K29081836	BRD-K29081836-001-01-0	Broad Institute of MIT and Harvard	BRD-K29081836			OC[C@@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H31Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4-7,12,17,20-21,29H,1-3,8-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21-/m0/s1	FPUISOVZIDCXHC-YYWHXJBOSA-N	483.169161922							123561
BRD-K74568880-001-01-5	LSM-35004	BRD-K74568880	54641358	InChI=1S/C21H25N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-9,13,17-19,27H,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18+,19-/m0/s1	IZDDEQQHNYWURQ-OTWHNJEPSA-N	COc1cccc(NC(=O)N[C@@H]2C=C[C@@H](CC(=O)NCc3ccncn3)O[C@H]2CO)c1	BroadT	BRD-K74568880	BRD-K74568880-001-01-5	Broad Institute of MIT and Harvard	BRD-K74568880			COc1cccc(NC(=O)N[C@@H]2C=C[C@@H](CC(=O)NCc3ccncn3)O[C@H]2CO)c1	InChI=1S/C21H25N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-9,13,17-19,27H,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18+,19-/m0/s1	IZDDEQQHNYWURQ-OTWHNJEPSA-N	427.18556895							123562
BRD-K71709348-001-01-4	LSM-35005	BRD-K71709348	54641106	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22+/m0/s1	IDXOYAHYVHCYJQ-FTFYGEEPSA-N	C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2ccc3OCOc3c2)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K71709348	BRD-K71709348-001-01-4	Broad Institute of MIT and Harvard	BRD-K71709348			C[C@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2ccc3OCOc3c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18-,19+,22+/m0/s1	IDXOYAHYVHCYJQ-FTFYGEEPSA-N	455.205635678							123563
BRD-K90201499-001-01-6	LSM-35006	BRD-K90201499	54641127	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19-,20-/m0/s1	FXQPIHLBIKTXQP-YSSFQJQWSA-N	OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K90201499	BRD-K90201499-001-01-6	Broad Institute of MIT and Harvard	BRD-K90201499			OC[C@@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19-,20-/m0/s1	FXQPIHLBIKTXQP-YSSFQJQWSA-N	485.11874753							123564
BRD-K14867418-001-01-5	LSM-35007	BRD-K14867418	54641120	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19-,22+/m1/s1	IDXOYAHYVHCYJQ-LRYKZCBQSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2ccc3OCOc3c2)[C@H](CO)O1)c4ccccc4	BroadT	BRD-K14867418	BRD-K14867418-001-01-5	Broad Institute of MIT and Harvard	BRD-K14867418			C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2ccc3OCOc3c2)[C@H](CO)O1)c1ccccc1	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19-,22+/m1/s1	IDXOYAHYVHCYJQ-LRYKZCBQSA-N	455.205635678							123565
BRD-K76407984-001-01-9	LSM-35008	BRD-K76407984	54641072	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16-/m1/s1	DLMKWWGZUXJMAT-FVQBIDKESA-N	CCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	BroadT	BRD-K76407984	BRD-K76407984-001-01-9	Broad Institute of MIT and Harvard	BRD-K76407984			CCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16-/m1/s1	DLMKWWGZUXJMAT-FVQBIDKESA-N	350.164185436							123566
BRD-K16064600-001-01-5	LSM-35009	BRD-K16064600	54641365	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18-,19+/m0/s1	CRKZLQDDCDYEJL-GBESFXJTSA-N	OC[C@H]1O[C@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K16064600	BRD-K16064600-001-01-5	Broad Institute of MIT and Harvard	BRD-K16064600			OC[C@H]1O[C@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18-,19+/m0/s1	CRKZLQDDCDYEJL-GBESFXJTSA-N	463.1986322							123567
BRD-K57199866-001-01-8	LSM-35010	BRD-K57199866	54641065	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16-,17-/m1/s1	XXVQYUMJVNBNLA-BRWVUGGUSA-N	CCC(=O)N[C@@H]1C=C[C@H](CC(=O)NCc2ccc(OC)cc2)O[C@@H]1CO	BroadT	BRD-K57199866	BRD-K57199866-001-01-8	Broad Institute of MIT and Harvard	BRD-K57199866			CCC(=O)N[C@@H]1C=C[C@@H](O[C@@H]1CO)CC(=O)NCc1ccc(OC)cc1	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16-,17-/m1/s1	XXVQYUMJVNBNLA-BRWVUGGUSA-N	362.184171952							123568
BRD-K81429168-001-01-4	LSM-35011	BRD-K81429168	54641102	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17+,19-/m1/s1	DDPFGBWVBZCTOM-HHXXYDBFSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@H]2CC[C@H](NC(=O)c3cnccn3)[C@@H](CO)O2	BroadT	BRD-K81429168	BRD-K81429168-001-01-4	Broad Institute of MIT and Harvard	BRD-K81429168			Cc1ccc(cc1)S(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)c2cnccn2)[C@@H](CO)O1	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17+,19-/m1/s1	DDPFGBWVBZCTOM-HHXXYDBFSA-N	434.162390662							123569
BRD-K30278324-001-01-8	LSM-35012	BRD-K30278324	54641258	InChI=1S/C14H24N2O4/c1-2-15-13(18)7-10-5-6-11(12(8-17)20-10)16-14(19)9-3-4-9/h9-12,17H,2-8H2,1H3,(H,15,18)(H,16,19)/t10-,11-,12+/m0/s1	BTMFLGLOUFNMEW-SDDRHHMPSA-N	CCNC(=O)C[C@@H]1CC[C@H](NC(=O)C2CC2)[C@@H](CO)O1	BroadT	BRD-K30278324	BRD-K30278324-001-01-8	Broad Institute of MIT and Harvard	BRD-K30278324			CCNC(=O)C[C@@H]1CC[C@H](NC(=O)C2CC2)[C@@H](CO)O1	InChI=1S/C14H24N2O4/c1-2-15-13(18)7-10-5-6-11(12(8-17)20-10)16-14(19)9-3-4-9/h9-12,17H,2-8H2,1H3,(H,15,18)(H,16,19)/t10-,11-,12+/m0/s1	BTMFLGLOUFNMEW-SDDRHHMPSA-N	284.173607268							123570
BRD-K65895220-001-01-2	LSM-35013	BRD-K65895220	54641123	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19+,20+/m1/s1	FXQPIHLBIKTXQP-XPGWFJOJSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K65895220	BRD-K65895220-001-01-2	Broad Institute of MIT and Harvard	BRD-K65895220			OC[C@@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@@H]1NC(=O)Nc1ccccc1F	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19+,20+/m1/s1	FXQPIHLBIKTXQP-XPGWFJOJSA-N	485.11874753							123571
BRD-K93452754-001-01-2	LSM-35014	BRD-K93452754	54641308	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20-,21+/m1/s1	GXRAKWRWAOCDKZ-UIFIKXQLSA-N	OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c3ccccc3F	BroadT	BRD-K93452754	BRD-K93452754-001-01-2	Broad Institute of MIT and Harvard	BRD-K93452754			OC[C@@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20-,21+/m1/s1	GXRAKWRWAOCDKZ-UIFIKXQLSA-N	450.162470874							123572
BRD-K90178727-001-01-0	LSM-35015	BRD-K90178727	54641202	InChI=1S/C20H27Cl2N5O3/c1-12(2)18-10-27(26-25-18)6-5-16-3-4-17(19(11-28)30-16)24-20(29)23-15-8-13(21)7-14(22)9-15/h7-10,12,16-17,19,28H,3-6,11H2,1-2H3,(H2,23,24,29)/t16-,17+,19+/m0/s1	WAMQJZQECGGADK-YQVWRLOYSA-N	CC(C)c1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3cc(Cl)cc(Cl)c3)[C@@H](CO)O2)nn1	BroadT	BRD-K90178727	BRD-K90178727-001-01-0	Broad Institute of MIT and Harvard	BRD-K90178727			CC(C)c1cn(CC[C@@H]2CC[C@@H](NC(=O)Nc3cc(Cl)cc(Cl)c3)[C@@H](CO)O2)nn1	InChI=1S/C20H27Cl2N5O3/c1-12(2)18-10-27(26-25-18)6-5-16-3-4-17(19(11-28)30-16)24-20(29)23-15-8-13(21)7-14(22)9-15/h7-10,12,16-17,19,28H,3-6,11H2,1-2H3,(H2,23,24,29)/t16-,17+,19+/m0/s1	WAMQJZQECGGADK-YQVWRLOYSA-N	455.149095194							123573
BRD-K80190213-001-01-8	LSM-35016	BRD-K80190213	54641277	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24-/m0/s1	JSIXEHNVWQRETH-HFMPRLQTSA-N	OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K80190213	BRD-K80190213-001-01-8	Broad Institute of MIT and Harvard	BRD-K80190213			OC[C@@H]1O[C@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21-,24-/m0/s1	JSIXEHNVWQRETH-HFMPRLQTSA-N	494.21653472							123574
BRD-K69655916-001-01-5	LSM-35017	BRD-K69655916	54641262	InChI=1S/C21H32FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-5,16,18-19,24,26H,3,6-15H2,(H,23,27)/t16-,18+,19+/m0/s1	UJHVJOLUCVEDGK-QXAKKESOSA-N	OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NS(=O)(=O)c3ccccc3F	BroadT	BRD-K69655916	BRD-K69655916-001-01-5	Broad Institute of MIT and Harvard	BRD-K69655916			OC[C@H]1O[C@H](CC(=O)NCCCN2CCOCC2)CC[C@H]1NS(=O)(=O)c1ccccc1F	InChI=1S/C21H32FN3O6S/c22-17-4-1-2-5-20(17)32(28,29)24-18-7-6-16(31-19(18)15-26)14-21(27)23-8-3-9-25-10-12-30-13-11-25/h1-2,4-5,16,18-19,24,26H,3,6-15H2,(H,23,27)/t16-,18+,19+/m0/s1	UJHVJOLUCVEDGK-QXAKKESOSA-N	473.199584664							123575
BRD-K67947209-001-01-4	LSM-35018	BRD-K67947209	54641158	InChI=1S/C18H28FN3O5S/c1-2-9-20-18(24)22-16-7-6-14(27-17(16)12-23)8-10-21-28(25,26)15-5-3-4-13(19)11-15/h3-5,11,14,16-17,21,23H,2,6-10,12H2,1H3,(H2,20,22,24)/t14-,16+,17-/m0/s1	QCWCRAHEENXEDE-UAGQMJEPSA-N	CCCNC(=O)N[C@@H]1CC[C@@H](CCNS(=O)(=O)c2cccc(F)c2)O[C@H]1CO	BroadT	BRD-K67947209	BRD-K67947209-001-01-4	Broad Institute of MIT and Harvard	BRD-K67947209			CCCNC(=O)N[C@@H]1CC[C@@H](CCNS(=O)(=O)c2cccc(F)c2)O[C@H]1CO	InChI=1S/C18H28FN3O5S/c1-2-9-20-18(24)22-16-7-6-14(27-17(16)12-23)8-10-21-28(25,26)15-5-3-4-13(19)11-15/h3-5,11,14,16-17,21,23H,2,6-10,12H2,1H3,(H2,20,22,24)/t14-,16+,17-/m0/s1	QCWCRAHEENXEDE-UAGQMJEPSA-N	417.173369916							123576
BRD-K49933702-001-01-9	LSM-35019	BRD-K49933702	54641314	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15-/m1/s1	BEBDRHVABAQOSM-RBSFLKMASA-N	CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K49933702	BRD-K49933702-001-01-9	Broad Institute of MIT and Harvard	BRD-K49933702			CC(C)NC(=O)N[C@@H]1C=C[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15-/m1/s1	BEBDRHVABAQOSM-RBSFLKMASA-N	339.215806438							123577
BRD-K85612613-001-01-2	LSM-35020	BRD-K85612613	54641305	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20+,21+/m0/s1	GXRAKWRWAOCDKZ-IOMROCGXSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c3ccccc3F	BroadT	BRD-K85612613	BRD-K85612613-001-01-2	Broad Institute of MIT and Harvard	BRD-K85612613			OC[C@H]1O[C@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@H]1NC(=O)c1ccccc1F	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20+,21+/m0/s1	GXRAKWRWAOCDKZ-IOMROCGXSA-N	450.162470874							123578
BRD-K52525325-001-01-4	LSM-35021	BRD-K52525325	54641100	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17-,19-/m1/s1	DDPFGBWVBZCTOM-SZVBFZGTSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@H]2CC[C@@H](NC(=O)c3cnccn3)[C@@H](CO)O2	BroadT	BRD-K52525325	BRD-K52525325-001-01-4	Broad Institute of MIT and Harvard	BRD-K52525325			Cc1ccc(cc1)S(=O)(=O)NCC[C@H]1CC[C@@H](NC(=O)c2cnccn2)[C@@H](CO)O1	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17-,19-/m1/s1	DDPFGBWVBZCTOM-SZVBFZGTSA-N	434.162390662							123579
BRD-K73989661-001-01-9	LSM-35022	BRD-K73989661	54641369	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-2,4,6-8,15,17,21,29H,3,5,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21-/m1/s1	RFHDZNJROOVZQK-QLVMHMETSA-N	OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K73989661	BRD-K73989661-001-01-9	Broad Institute of MIT and Harvard	BRD-K73989661			OC[C@H]1O[C@@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-2,4,6-8,15,17,21,29H,3,5,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17-,21-/m1/s1	RFHDZNJROOVZQK-QLVMHMETSA-N	477.17114195							123580
BRD-K12188384-001-01-8	LSM-35023	BRD-K12188384	54641085	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19+/m1/s1	YBKWUZNDQMZJNP-QYZOEREBSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)CN3CCOCC3	BroadT	BRD-K12188384	BRD-K12188384-001-01-8	Broad Institute of MIT and Harvard	BRD-K12188384			OC[C@@H]1O[C@@H](CC(=O)NCc2cccc(F)c2)C=C[C@@H]1NC(=O)CN1CCOCC1	InChI=1S/C21H28FN3O5/c22-16-3-1-2-15(10-16)12-23-20(27)11-17-4-5-18(19(14-26)30-17)24-21(28)13-25-6-8-29-9-7-25/h1-5,10,17-19,26H,6-9,11-14H2,(H,23,27)(H,24,28)/t17-,18+,19+/m1/s1	YBKWUZNDQMZJNP-QYZOEREBSA-N	421.201299226							123581
BRD-K28635638-001-01-4	LSM-35024	BRD-K28635638	54641248	InChI=1S/C23H32N4O5/c1-30-21-5-3-2-4-18(21)20-14-27(26-25-20)11-8-17-6-7-19(22(15-28)32-17)24-23(29)16-9-12-31-13-10-16/h2-5,14,16-17,19,22,28H,6-13,15H2,1H3,(H,24,29)/t17-,19-,22+/m0/s1	BDZIUCAOVCBDSU-LQBOVUBWSA-N	COc1ccccc1c2cn(CC[C@@H]3CC[C@H](NC(=O)C4CCOCC4)[C@@H](CO)O3)nn2	BroadT	BRD-K28635638	BRD-K28635638-001-01-4	Broad Institute of MIT and Harvard	BRD-K28635638			COc1ccccc1-c1cn(CC[C@@H]2CC[C@H](NC(=O)C3CCOCC3)[C@@H](CO)O2)nn1	InChI=1S/C23H32N4O5/c1-30-21-5-3-2-4-18(21)20-14-27(26-25-20)11-8-17-6-7-19(22(15-28)32-17)24-23(29)16-9-12-31-13-10-16/h2-5,14,16-17,19,22,28H,6-13,15H2,1H3,(H,24,29)/t17-,19-,22+/m0/s1	BDZIUCAOVCBDSU-LQBOVUBWSA-N	444.237270164							123582
BRD-K41639971-001-01-4	LSM-35025	BRD-K41639971	54641367	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-2,4,6-8,15,17,21,29H,3,5,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17+,21+/m0/s1	RFHDZNJROOVZQK-LUQKVYGDSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NC(=O)Nc4cc(F)ccc4F	BroadT	BRD-K41639971	BRD-K41639971-001-01-4	Broad Institute of MIT and Harvard	BRD-K41639971			OC[C@H]1O[C@H](CC(=O)NCc2ccc3OCOc3c2)CC[C@H]1NC(=O)Nc1cc(F)ccc1F	InChI=1S/C23H25F2N3O6/c24-14-2-4-16(25)18(8-14)28-23(31)27-17-5-3-15(34-21(17)11-29)9-22(30)26-10-13-1-6-19-20(7-13)33-12-32-19/h1-2,4,6-8,15,17,21,29H,3,5,9-12H2,(H,26,30)(H2,27,28,31)/t15-,17+,21+/m0/s1	RFHDZNJROOVZQK-LUQKVYGDSA-N	477.17114195							123583
BRD-K65474083-001-01-2	LSM-35026	BRD-K65474083	54641320	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14+,15-/m0/s1	BEBDRHVABAQOSM-ZNMIVQPWSA-N	CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	BroadT	BRD-K65474083	BRD-K65474083-001-01-2	Broad Institute of MIT and Harvard	BRD-K65474083			CC(C)NC(=O)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO	InChI=1S/C17H29N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h6-7,12-15,21H,3-5,8-11H2,1-2H3,(H2,18,19,23)/t13-,14+,15-/m0/s1	BEBDRHVABAQOSM-ZNMIVQPWSA-N	339.215806438							123584
BRD-K98096505-001-01-4	LSM-35027	BRD-K98096505	54641205	InChI=1S/C20H27Cl2N5O3/c1-12(2)18-10-27(26-25-18)6-5-16-3-4-17(19(11-28)30-16)24-20(29)23-15-8-13(21)7-14(22)9-15/h7-10,12,16-17,19,28H,3-6,11H2,1-2H3,(H2,23,24,29)/t16-,17-,19-/m1/s1	WAMQJZQECGGADK-ZHALLVOQSA-N	CC(C)c1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3cc(Cl)cc(Cl)c3)[C@@H](CO)O2)nn1	BroadT	BRD-K98096505	BRD-K98096505-001-01-4	Broad Institute of MIT and Harvard	BRD-K98096505			CC(C)c1cn(CC[C@H]2CC[C@@H](NC(=O)Nc3cc(Cl)cc(Cl)c3)[C@@H](CO)O2)nn1	InChI=1S/C20H27Cl2N5O3/c1-12(2)18-10-27(26-25-18)6-5-16-3-4-17(19(11-28)30-16)24-20(29)23-15-8-13(21)7-14(22)9-15/h7-10,12,16-17,19,28H,3-6,11H2,1-2H3,(H2,23,24,29)/t16-,17-,19-/m1/s1	WAMQJZQECGGADK-ZHALLVOQSA-N	455.149095194							123585
BRD-K16469239-001-01-5	LSM-35028	BRD-K16469239	54641244	InChI=1S/C16H21FN2O5S/c1-2-18-16(21)9-12-5-8-14(15(10-20)24-12)19-25(22,23)13-6-3-11(17)4-7-13/h3-8,12,14-15,19-20H,2,9-10H2,1H3,(H,18,21)/t12-,14+,15-/m1/s1	UOWXRGDLFUDMAF-VHDGCEQUSA-N	CCNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccc(F)cc2)C=C1	BroadT	BRD-K16469239	BRD-K16469239-001-01-5	Broad Institute of MIT and Harvard	BRD-K16469239			CCNC(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccc(F)cc2)C=C1	InChI=1S/C16H21FN2O5S/c1-2-18-16(21)9-12-5-8-14(15(10-20)24-12)19-25(22,23)13-6-3-11(17)4-7-13/h3-8,12,14-15,19-20H,2,9-10H2,1H3,(H,18,21)/t12-,14+,15-/m1/s1	UOWXRGDLFUDMAF-VHDGCEQUSA-N	372.115520682							123586
BRD-K64243825-001-01-5	LSM-35029	BRD-K64243825	54641063	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16+,17+/m0/s1	XXVQYUMJVNBNLA-GVDBMIGSSA-N	CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccc(OC)cc2)O[C@@H]1CO	BroadT	BRD-K64243825	BRD-K64243825-001-01-5	Broad Institute of MIT and Harvard	BRD-K64243825			CCC(=O)N[C@@H]1C=C[C@H](O[C@@H]1CO)CC(=O)NCc1ccc(OC)cc1	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16+,17+/m0/s1	XXVQYUMJVNBNLA-GVDBMIGSSA-N	362.184171952							123587
BRD-K89162199-001-01-6	LSM-35030	BRD-K89162199	54641322	InChI=1S/C14H16N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h1-6,10-12,17H,7-8H2,(H,16,20)(H,18,19)/t10-,11-,12+/m1/s1	IZKTYYLZYIIGGX-UTUOFQBUSA-N	OC[C@@H]1O[C@@H](CC(=O)O)C=C[C@H]1NC(=O)c2ccncc2	BroadT	BRD-K89162199	BRD-K89162199-001-01-6	Broad Institute of MIT and Harvard	BRD-K89162199			OC[C@@H]1O[C@@H](CC(O)=O)C=C[C@H]1NC(=O)c1ccncc1	InChI=1S/C14H16N2O5/c17-8-12-11(2-1-10(21-12)7-13(18)19)16-14(20)9-3-5-15-6-4-9/h1-6,10-12,17H,7-8H2,(H,16,20)(H,18,19)/t10-,11-,12+/m1/s1	IZKTYYLZYIIGGX-UTUOFQBUSA-N	292.105921632							123588
BRD-K11667007-001-01-9	LSM-35031	BRD-K11667007	54641077	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16-/m0/s1	DLMKWWGZUXJMAT-IMJJTQAJSA-N	CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	BroadT	BRD-K11667007	BRD-K11667007-001-01-9	Broad Institute of MIT and Harvard	BRD-K11667007			CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16-/m0/s1	DLMKWWGZUXJMAT-IMJJTQAJSA-N	350.164185436							123589
BRD-K03811780-001-01-6	LSM-35032	BRD-K03811780	54641191	InChI=1S/C16H22N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-9,12,14-15,17,19H,10-11H2,1-2H3/t12-,14-,15+/m1/s1	ACJRMYKVRUMDSA-YUELXQCFSA-N	CN(C)C(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K03811780	BRD-K03811780-001-01-6	Broad Institute of MIT and Harvard	BRD-K03811780			CN(C)C(=O)C[C@@H]1O[C@@H](CO)[C@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C16H22N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-9,12,14-15,17,19H,10-11H2,1-2H3/t12-,14-,15+/m1/s1	ACJRMYKVRUMDSA-YUELXQCFSA-N	354.124942514							123590
BRD-K32797868-001-01-7	LSM-35033	BRD-K32797868	54641357	InChI=1S/C21H25N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-9,13,17-19,27H,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18+,19-/m1/s1	IZDDEQQHNYWURQ-CEXWTWQISA-N	COc1cccc(NC(=O)N[C@H]2C=C[C@H](CC(=O)NCc3ccncn3)O[C@@H]2CO)c1	BroadT	BRD-K32797868	BRD-K32797868-001-01-7	Broad Institute of MIT and Harvard	BRD-K32797868			COc1cccc(NC(=O)N[C@H]2C=C[C@H](CC(=O)NCc3ccncn3)O[C@@H]2CO)c1	InChI=1S/C21H25N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-9,13,17-19,27H,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18+,19-/m1/s1	IZDDEQQHNYWURQ-CEXWTWQISA-N	427.18556895							123591
BRD-K30417169-001-01-0	LSM-35034	BRD-K30417169	54641225	InChI=1S/C17H31N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h12-15,21H,3-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15-/m1/s1	GTWYPIFYOHIWKX-RBSFLKMASA-N	CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K30417169	BRD-K30417169-001-01-0	Broad Institute of MIT and Harvard	BRD-K30417169			CC(C)NC(=O)N[C@@H]1CC[C@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C17H31N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h12-15,21H,3-11H2,1-2H3,(H2,18,19,23)/t13-,14-,15-/m1/s1	GTWYPIFYOHIWKX-RBSFLKMASA-N	341.231456502							123592
BRD-K65975183-001-01-7	LSM-35035	BRD-K65975183	54641092	InChI=1S/C23H31Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4-7,12,17,20-21,29H,1-3,8-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21+/m1/s1	FPUISOVZIDCXHC-QMMLZNLJSA-N	OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K65975183	BRD-K65975183-001-01-7	Broad Institute of MIT and Harvard	BRD-K65975183			OC[C@@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H31Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4-7,12,17,20-21,29H,1-3,8-11,13-15H2,(H,26,31)(H,27,30)/t17-,20+,21+/m1/s1	FPUISOVZIDCXHC-QMMLZNLJSA-N	483.169161922							123593
BRD-K92404768-001-01-8	LSM-35036	BRD-K92404768	54641094	InChI=1S/C23H31Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4-7,12,17,20-21,29H,1-3,8-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21+/m0/s1	FPUISOVZIDCXHC-DZFGPLHGSA-N	OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)CCN3CCCCC3	BroadT	BRD-K92404768	BRD-K92404768-001-01-8	Broad Institute of MIT and Harvard	BRD-K92404768			OC[C@H]1O[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@@H]1NC(=O)CCN1CCCCC1	InChI=1S/C23H31Cl2N3O4/c24-18-6-4-16(12-19(18)25)14-26-23(31)13-17-5-7-20(21(15-29)32-17)27-22(30)8-11-28-9-2-1-3-10-28/h4-7,12,17,20-21,29H,1-3,8-11,13-15H2,(H,26,31)(H,27,30)/t17-,20-,21+/m0/s1	FPUISOVZIDCXHC-DZFGPLHGSA-N	483.169161922							123594
BRD-K95760526-001-01-3	LSM-35037	BRD-K95760526	54641126	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19-,20-/m1/s1	FXQPIHLBIKTXQP-CDHQVMDDSA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K95760526	BRD-K95760526-001-01-3	Broad Institute of MIT and Harvard	BRD-K95760526			OC[C@H]1O[C@@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19-,20-/m1/s1	FXQPIHLBIKTXQP-CDHQVMDDSA-N	485.11874753							123595
BRD-K04830910-001-01-8	LSM-35038	BRD-K04830910	54641362	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18+,19-/m1/s1	CRKZLQDDCDYEJL-CEXWTWQISA-N	OC[C@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K04830910	BRD-K04830910-001-01-8	Broad Institute of MIT and Harvard	BRD-K04830910			OC[C@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18+,19-/m1/s1	CRKZLQDDCDYEJL-CEXWTWQISA-N	463.1986322							123596
BRD-K25367375-001-01-4	LSM-35039	BRD-K25367375	54641172	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19+/m1/s1	VEDLKNWKQGCWOE-QYZOEREBSA-N	CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	BroadT	BRD-K25367375	BRD-K25367375-001-01-4	Broad Institute of MIT and Harvard	BRD-K25367375			CC(C)NC(=O)N[C@H]1CC[C@H](CC(=O)NC2Cc3ccccc3C2)O[C@H]1CO	InChI=1S/C21H31N3O4/c1-13(2)22-21(27)24-18-8-7-17(28-19(18)12-25)11-20(26)23-16-9-14-5-3-4-6-15(14)10-16/h3-6,13,16-19,25H,7-12H2,1-2H3,(H,23,26)(H2,22,24,27)/t17-,18+,19+/m1/s1	VEDLKNWKQGCWOE-QYZOEREBSA-N	389.231456502							123597
BRD-K30562320-001-01-9	LSM-35040	BRD-K30562320	54641066	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16-,17-/m0/s1	XXVQYUMJVNBNLA-ULQDDVLXSA-N	CCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccc(OC)cc2)O[C@H]1CO	BroadT	BRD-K30562320	BRD-K30562320-001-01-9	Broad Institute of MIT and Harvard	BRD-K30562320			CCC(=O)N[C@H]1C=C[C@H](O[C@H]1CO)CC(=O)NCc1ccc(OC)cc1	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16-,17-/m0/s1	XXVQYUMJVNBNLA-ULQDDVLXSA-N	362.184171952							123598
BRD-K97780373-001-01-3	LSM-35041	BRD-K97780373	54641361	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18-,19+/m1/s1	CRKZLQDDCDYEJL-QRVBRYPASA-N	OC[C@@H]1O[C@@H](CCn2cc(nn2)C3(O)CCCC3)CC[C@H]1NC(=O)Nc4ccc(Cl)cc4	BroadT	BRD-K97780373	BRD-K97780373-001-01-3	Broad Institute of MIT and Harvard	BRD-K97780373			OC[C@@H]1O[C@@H](CCn2cc(nn2)C2(O)CCCC2)CC[C@H]1NC(=O)Nc1ccc(Cl)cc1	InChI=1S/C22H30ClN5O4/c23-15-3-5-16(6-4-15)24-21(30)25-18-8-7-17(32-19(18)14-29)9-12-28-13-20(26-27-28)22(31)10-1-2-11-22/h3-6,13,17-19,29,31H,1-2,7-12,14H2,(H2,24,25,30)/t17-,18-,19+/m1/s1	CRKZLQDDCDYEJL-QRVBRYPASA-N	463.1986322							123599
BRD-K26177519-001-01-3	LSM-35042	BRD-K26177519	54641207	InChI=1S/C20H27Cl2N5O3/c1-12(2)18-10-27(26-25-18)6-5-16-3-4-17(19(11-28)30-16)24-20(29)23-15-8-13(21)7-14(22)9-15/h7-10,12,16-17,19,28H,3-6,11H2,1-2H3,(H2,23,24,29)/t16-,17-,19+/m0/s1	WAMQJZQECGGADK-JENIJYKNSA-N	CC(C)c1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3cc(Cl)cc(Cl)c3)[C@@H](CO)O2)nn1	BroadT	BRD-K26177519	BRD-K26177519-001-01-3	Broad Institute of MIT and Harvard	BRD-K26177519			CC(C)c1cn(CC[C@@H]2CC[C@H](NC(=O)Nc3cc(Cl)cc(Cl)c3)[C@@H](CO)O2)nn1	InChI=1S/C20H27Cl2N5O3/c1-12(2)18-10-27(26-25-18)6-5-16-3-4-17(19(11-28)30-16)24-20(29)23-15-8-13(21)7-14(22)9-15/h7-10,12,16-17,19,28H,3-6,11H2,1-2H3,(H2,23,24,29)/t16-,17-,19+/m0/s1	WAMQJZQECGGADK-JENIJYKNSA-N	455.149095194							123600
BRD-K31267215-001-01-2	LSM-35043	BRD-K31267215	54641107	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19-,22-/m1/s1	IDXOYAHYVHCYJQ-TWSMVNEUSA-N	C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2ccc3OCOc3c2)[C@@H](CO)O1)c4ccccc4	BroadT	BRD-K31267215	BRD-K31267215-001-01-2	Broad Institute of MIT and Harvard	BRD-K31267215			C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)Nc2ccc3OCOc3c2)[C@@H](CO)O1)c1ccccc1	InChI=1S/C24H29N3O6/c1-15(16-5-3-2-4-6-16)25-23(29)12-18-8-9-19(22(13-28)33-18)27-24(30)26-17-7-10-20-21(11-17)32-14-31-20/h2-7,10-11,15,18-19,22,28H,8-9,12-14H2,1H3,(H,25,29)(H2,26,27,30)/t15-,18+,19-,22-/m1/s1	IDXOYAHYVHCYJQ-TWSMVNEUSA-N	455.205635678							123601
BRD-K57844337-001-01-0	LSM-35044	BRD-K57844337	54641122	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19+,20+/m0/s1	FXQPIHLBIKTXQP-CWFSZBLJSA-N	OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)Nc3ccccc3F	BroadT	BRD-K57844337	BRD-K57844337-001-01-0	Broad Institute of MIT and Harvard	BRD-K57844337			OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccc(Cl)cc2)CC[C@H]1NC(=O)Nc1ccccc1F	InChI=1S/C21H25ClFN3O5S/c22-14-5-8-16(9-6-14)32(29,30)24-12-11-15-7-10-19(20(13-27)31-15)26-21(28)25-18-4-2-1-3-17(18)23/h1-6,8-9,15,19-20,24,27H,7,10-13H2,(H2,25,26,28)/t15-,19+,20+/m0/s1	FXQPIHLBIKTXQP-CWFSZBLJSA-N	485.11874753							123602
BRD-K56259876-001-01-9	LSM-35045	BRD-K56259876	54641223	InChI=1S/C17H31N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h12-15,21H,3-11H2,1-2H3,(H2,18,19,23)/t13-,14+,15+/m0/s1	GTWYPIFYOHIWKX-RRFJBIMHSA-N	CC(C)NC(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	BroadT	BRD-K56259876	BRD-K56259876-001-01-9	Broad Institute of MIT and Harvard	BRD-K56259876			CC(C)NC(=O)N[C@@H]1CC[C@@H](CC(=O)N2CCCCC2)O[C@@H]1CO	InChI=1S/C17H31N3O4/c1-12(2)18-17(23)19-14-7-6-13(24-15(14)11-21)10-16(22)20-8-4-3-5-9-20/h12-15,21H,3-11H2,1-2H3,(H2,18,19,23)/t13-,14+,15+/m0/s1	GTWYPIFYOHIWKX-RRFJBIMHSA-N	341.231456502							123603
BRD-K71511528-001-01-6	LSM-35046	BRD-K71511528	54641071	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16+/m1/s1	DLMKWWGZUXJMAT-KBMXLJTQSA-N	CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	BroadT	BRD-K71511528	BRD-K71511528-001-01-6	Broad Institute of MIT and Harvard	BRD-K71511528			CCC(=O)N[C@H]1C=C[C@H](CC(=O)NCc2ccccc2F)O[C@H]1CO	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15+,16+/m1/s1	DLMKWWGZUXJMAT-KBMXLJTQSA-N	350.164185436							123604
BRD-K24318151-001-01-8	LSM-35047	BRD-K24318151	54641103	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17-,19-/m0/s1	DDPFGBWVBZCTOM-IEZWGBDMSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]2CC[C@H](NC(=O)c3cnccn3)[C@H](CO)O2	BroadT	BRD-K24318151	BRD-K24318151-001-01-8	Broad Institute of MIT and Harvard	BRD-K24318151			Cc1ccc(cc1)S(=O)(=O)NCC[C@@H]1CC[C@H](NC(=O)c2cnccn2)[C@H](CO)O1	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17-,19-/m0/s1	DDPFGBWVBZCTOM-IEZWGBDMSA-N	434.162390662							123605
BRD-K31200284-001-01-9	LSM-35048	BRD-K31200284	54641259	InChI=1S/C14H24N2O4/c1-2-15-13(18)7-10-5-6-11(12(8-17)20-10)16-14(19)9-3-4-9/h9-12,17H,2-8H2,1H3,(H,15,18)(H,16,19)/t10-,11-,12+/m1/s1	BTMFLGLOUFNMEW-UTUOFQBUSA-N	CCNC(=O)C[C@H]1CC[C@@H](NC(=O)C2CC2)[C@H](CO)O1	BroadT	BRD-K31200284	BRD-K31200284-001-01-9	Broad Institute of MIT and Harvard	BRD-K31200284			CCNC(=O)C[C@H]1CC[C@@H](NC(=O)C2CC2)[C@H](CO)O1	InChI=1S/C14H24N2O4/c1-2-15-13(18)7-10-5-6-11(12(8-17)20-10)16-14(19)9-3-4-9/h9-12,17H,2-8H2,1H3,(H,15,18)(H,16,19)/t10-,11-,12+/m1/s1	BTMFLGLOUFNMEW-UTUOFQBUSA-N	284.173607268							123606
BRD-K43364503-001-01-4	LSM-35049	BRD-K43364503	54641309	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20+,21-/m1/s1	GXRAKWRWAOCDKZ-JRGCBEDISA-N	OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c3ccccc3F	BroadT	BRD-K43364503	BRD-K43364503-001-01-4	Broad Institute of MIT and Harvard	BRD-K43364503			OC[C@H]1O[C@@H](CCNS(=O)(=O)Cc2ccccc2)CC[C@@H]1NC(=O)c1ccccc1F	InChI=1S/C22H27FN2O5S/c23-19-9-5-4-8-18(19)22(27)25-20-11-10-17(30-21(20)14-26)12-13-24-31(28,29)15-16-6-2-1-3-7-16/h1-9,17,20-21,24,26H,10-15H2,(H,25,27)/t17-,20+,21-/m1/s1	GXRAKWRWAOCDKZ-JRGCBEDISA-N	450.162470874							123607
BRD-K09975896-001-01-4	LSM-35050	BRD-K09975896	54641155	InChI=1S/C18H28FN3O5S/c1-2-9-20-18(24)22-16-7-6-14(27-17(16)12-23)8-10-21-28(25,26)15-5-3-4-13(19)11-15/h3-5,11,14,16-17,21,23H,2,6-10,12H2,1H3,(H2,20,22,24)/t14-,16-,17+/m1/s1	QCWCRAHEENXEDE-OIISXLGYSA-N	CCCNC(=O)N[C@@H]1CC[C@H](CCNS(=O)(=O)c2cccc(F)c2)O[C@H]1CO	BroadT	BRD-K09975896	BRD-K09975896-001-01-4	Broad Institute of MIT and Harvard	BRD-K09975896			CCCNC(=O)N[C@@H]1CC[C@H](CCNS(=O)(=O)c2cccc(F)c2)O[C@H]1CO	InChI=1S/C18H28FN3O5S/c1-2-9-20-18(24)22-16-7-6-14(27-17(16)12-23)8-10-21-28(25,26)15-5-3-4-13(19)11-15/h3-5,11,14,16-17,21,23H,2,6-10,12H2,1H3,(H2,20,22,24)/t14-,16-,17+/m1/s1	QCWCRAHEENXEDE-OIISXLGYSA-N	417.173369916							123608
BRD-K29073962-001-01-3	LSM-35051	BRD-K29073962	54641201	InChI=1S/C21H31N3O4/c25-14-19-18(24-21(27)16-8-10-22-11-9-16)7-6-17(28-19)12-20(26)23-13-15-4-2-1-3-5-15/h8-11,15,17-19,25H,1-7,12-14H2,(H,23,26)(H,24,27)/t17-,18+,19-/m0/s1	BHIMCRWNSGTPOE-OTWHNJEPSA-N	OC[C@@H]1O[C@H](CC(=O)NCC2CCCCC2)CC[C@H]1NC(=O)c3ccncc3	BroadT	BRD-K29073962	BRD-K29073962-001-01-3	Broad Institute of MIT and Harvard	BRD-K29073962			OC[C@@H]1O[C@H](CC(=O)NCC2CCCCC2)CC[C@H]1NC(=O)c1ccncc1	InChI=1S/C21H31N3O4/c25-14-19-18(24-21(27)16-8-10-22-11-9-16)7-6-17(28-19)12-20(26)23-13-15-4-2-1-3-5-15/h8-11,15,17-19,25H,1-7,12-14H2,(H,23,26)(H,24,27)/t17-,18+,19-/m0/s1	BHIMCRWNSGTPOE-OTWHNJEPSA-N	389.231456502							123609
BRD-K93783788-001-01-0	LSM-35052	BRD-K93783788	54641130	InChI=1S/C21H26Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3,5,7,14,17-18,28H,4,6,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17+,18+/m1/s1	PLXQZJRBLQQGKU-JLSDUUJJSA-N	Cc1onc(C)c1NC(=O)N[C@H]2CC[C@H](CC(=O)NCc3ccc(Cl)c(Cl)c3)O[C@H]2CO	BroadT	BRD-K93783788	BRD-K93783788-001-01-0	Broad Institute of MIT and Harvard	BRD-K93783788			Cc1noc(C)c1NC(=O)N[C@H]1CC[C@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)O[C@H]1CO	InChI=1S/C21H26Cl2N4O5/c1-11-20(12(2)32-27-11)26-21(30)25-17-6-4-14(31-18(17)10-28)8-19(29)24-9-13-3-5-15(22)16(23)7-13/h3,5,7,14,17-18,28H,4,6,8-10H2,1-2H3,(H,24,29)(H2,25,26,30)/t14-,17+,18+/m1/s1	PLXQZJRBLQQGKU-JLSDUUJJSA-N	484.128025392							123610
BRD-K93441605-001-01-6	LSM-35053	BRD-K93441605	54641156	InChI=1S/C18H28FN3O5S/c1-2-9-20-18(24)22-16-7-6-14(27-17(16)12-23)8-10-21-28(25,26)15-5-3-4-13(19)11-15/h3-5,11,14,16-17,21,23H,2,6-10,12H2,1H3,(H2,20,22,24)/t14-,16+,17-/m1/s1	QCWCRAHEENXEDE-HYVNUMGLSA-N	CCCNC(=O)N[C@H]1CC[C@H](CCNS(=O)(=O)c2cccc(F)c2)O[C@@H]1CO	BroadT	BRD-K93441605	BRD-K93441605-001-01-6	Broad Institute of MIT and Harvard	BRD-K93441605			CCCNC(=O)N[C@H]1CC[C@H](CCNS(=O)(=O)c2cccc(F)c2)O[C@@H]1CO	InChI=1S/C18H28FN3O5S/c1-2-9-20-18(24)22-16-7-6-14(27-17(16)12-23)8-10-21-28(25,26)15-5-3-4-13(19)11-15/h3-5,11,14,16-17,21,23H,2,6-10,12H2,1H3,(H2,20,22,24)/t14-,16+,17-/m1/s1	QCWCRAHEENXEDE-HYVNUMGLSA-N	417.173369916							123611
BRD-K61231367-001-01-7	LSM-35054	BRD-K61231367	54641159	InChI=1S/C24H30N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-8,13,18,20,22-23,26-27H,9-12,14-15H2,1H3,(H,25,28)/t20-,22+,23+/m0/s1	QZPITBHLAOJJSG-MDNUFGMLSA-N	COc1cccc(c1)S(=O)(=O)N[C@@H]2CC[C@@H](CC(=O)NC3Cc4ccccc4C3)O[C@@H]2CO	BroadT	BRD-K61231367	BRD-K61231367-001-01-7	Broad Institute of MIT and Harvard	BRD-K61231367			COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CC(=O)NC2Cc3ccccc3C2)O[C@@H]1CO	InChI=1S/C24H30N2O6S/c1-31-19-7-4-8-21(13-19)33(29,30)26-22-10-9-20(32-23(22)15-27)14-24(28)25-18-11-16-5-2-3-6-17(16)12-18/h2-8,13,18,20,22-23,26-27H,9-12,14-15H2,1H3,(H,25,28)/t20-,22+,23+/m0/s1	QZPITBHLAOJJSG-MDNUFGMLSA-N	474.18245739							123612
BRD-K40566022-001-01-9	LSM-35055	BRD-K40566022	54641070	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16+,17-/m0/s1	XXVQYUMJVNBNLA-BBWFWOEESA-N	CCC(=O)N[C@@H]1C=C[C@@H](CC(=O)NCc2ccc(OC)cc2)O[C@H]1CO	BroadT	BRD-K40566022	BRD-K40566022-001-01-9	Broad Institute of MIT and Harvard	BRD-K40566022			CCC(=O)N[C@@H]1C=C[C@H](O[C@H]1CO)CC(=O)NCc1ccc(OC)cc1	InChI=1S/C19H26N2O5/c1-3-18(23)21-16-9-8-15(26-17(16)12-22)10-19(24)20-11-13-4-6-14(25-2)7-5-13/h4-9,15-17,22H,3,10-12H2,1-2H3,(H,20,24)(H,21,23)/t15-,16+,17-/m0/s1	XXVQYUMJVNBNLA-BBWFWOEESA-N	362.184171952							123613
BRD-K44736866-001-01-3	LSM-35056	BRD-K44736866	54641276	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24+/m1/s1	JSIXEHNVWQRETH-DPLHUUCSSA-N	OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c3ccccc3)C=C[C@@H]1NC(=O)Nc4ccc5OCOc5c4	BroadT	BRD-K44736866	BRD-K44736866-001-01-3	Broad Institute of MIT and Harvard	BRD-K44736866			OC[C@@H]1O[C@@H](CC(=O)N2CCN(CC2)c2ccccc2)C=C[C@@H]1NC(=O)Nc1ccc2OCOc2c1	InChI=1S/C26H30N4O6/c31-16-24-21(28-26(33)27-18-6-9-22-23(14-18)35-17-34-22)8-7-20(36-24)15-25(32)30-12-10-29(11-13-30)19-4-2-1-3-5-19/h1-9,14,20-21,24,31H,10-13,15-17H2,(H2,27,28,33)/t20-,21+,24+/m1/s1	JSIXEHNVWQRETH-DPLHUUCSSA-N	494.21653472							123614
BRD-K94647778-001-01-8	LSM-35057	BRD-K94647778	54641304	InChI=1S/C22H28ClN3O5S/c1-15-5-2-3-8-21(15)32(29,30)24-12-11-18-9-10-19(20(14-27)31-18)26-22(28)25-17-7-4-6-16(23)13-17/h2-8,13,18-20,24,27H,9-12,14H2,1H3,(H2,25,26,28)/t18-,19+,20-/m0/s1	APSVDPZHEKUSQF-ZCNNSNEGSA-N	Cc1ccccc1S(=O)(=O)NCC[C@@H]2CC[C@@H](NC(=O)Nc3cccc(Cl)c3)[C@H](CO)O2	BroadT	BRD-K94647778	BRD-K94647778-001-01-8	Broad Institute of MIT and Harvard	BRD-K94647778			Cc1ccccc1S(=O)(=O)NCC[C@@H]1CC[C@@H](NC(=O)Nc2cccc(Cl)c2)[C@H](CO)O1	InChI=1S/C22H28ClN3O5S/c1-15-5-2-3-8-21(15)32(29,30)24-12-11-18-9-10-19(20(14-27)31-18)26-22(28)25-17-7-4-6-16(23)13-17/h2-8,13,18-20,24,27H,9-12,14H2,1H3,(H2,25,26,28)/t18-,19+,20-/m0/s1	APSVDPZHEKUSQF-ZCNNSNEGSA-N	481.143819426							123615
BRD-K98689898-001-01-1	LSM-35058	BRD-K98689898	54641099	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17+,19+/m1/s1	DDPFGBWVBZCTOM-AYBZRNKSSA-N	Cc1ccc(cc1)S(=O)(=O)NCC[C@H]2CC[C@H](NC(=O)c3cnccn3)[C@H](CO)O2	BroadT	BRD-K98689898	BRD-K98689898-001-01-1	Broad Institute of MIT and Harvard	BRD-K98689898			Cc1ccc(cc1)S(=O)(=O)NCC[C@H]1CC[C@H](NC(=O)c2cnccn2)[C@H](CO)O1	InChI=1S/C20H26N4O5S/c1-14-2-5-16(6-3-14)30(27,28)23-9-8-15-4-7-17(19(13-25)29-15)24-20(26)18-12-21-10-11-22-18/h2-3,5-6,10-12,15,17,19,23,25H,4,7-9,13H2,1H3,(H,24,26)/t15-,17+,19+/m1/s1	DDPFGBWVBZCTOM-AYBZRNKSSA-N	434.162390662							123616
BRD-K18092396-001-01-2	LSM-35059	BRD-K18092396	54641074	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16+/m0/s1	DLMKWWGZUXJMAT-CWRNSKLLSA-N	CCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	BroadT	BRD-K18092396	BRD-K18092396-001-01-2	Broad Institute of MIT and Harvard	BRD-K18092396			CCC(=O)N[C@H]1C=C[C@@H](CC(=O)NCc2ccccc2F)O[C@@H]1CO	InChI=1S/C18H23FN2O4/c1-2-17(23)21-15-8-7-13(25-16(15)11-22)9-18(24)20-10-12-5-3-4-6-14(12)19/h3-8,13,15-16,22H,2,9-11H2,1H3,(H,20,24)(H,21,23)/t13-,15-,16+/m0/s1	DLMKWWGZUXJMAT-CWRNSKLLSA-N	350.164185436							123617
BRD-K55011281-001-01-4	LSM-35060	BRD-K55011281	54641249	InChI=1S/C23H32N4O5/c1-30-21-5-3-2-4-18(21)20-14-27(26-25-20)11-8-17-6-7-19(22(15-28)32-17)24-23(29)16-9-12-31-13-10-16/h2-5,14,16-17,19,22,28H,6-13,15H2,1H3,(H,24,29)/t17-,19-,22+/m1/s1	BDZIUCAOVCBDSU-JUXOCIIHSA-N	COc1ccccc1c2cn(CC[C@H]3CC[C@@H](NC(=O)C4CCOCC4)[C@H](CO)O3)nn2	BroadT	BRD-K55011281	BRD-K55011281-001-01-4	Broad Institute of MIT and Harvard	BRD-K55011281			COc1ccccc1-c1cn(CC[C@H]2CC[C@@H](NC(=O)C3CCOCC3)[C@H](CO)O2)nn1	InChI=1S/C23H32N4O5/c1-30-21-5-3-2-4-18(21)20-14-27(26-25-20)11-8-17-6-7-19(22(15-28)32-17)24-23(29)16-9-12-31-13-10-16/h2-5,14,16-17,19,22,28H,6-13,15H2,1H3,(H,24,29)/t17-,19-,22+/m1/s1	BDZIUCAOVCBDSU-JUXOCIIHSA-N	444.237270164							123618
BRD-K70039065-001-01-8	LSM-35061	BRD-K70039065	54641190	InChI=1S/C16H22N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-9,12,14-15,17,19H,10-11H2,1-2H3/t12-,14-,15+/m0/s1	ACJRMYKVRUMDSA-AEGPPILISA-N	CN(C)C(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	BroadT	BRD-K70039065	BRD-K70039065-001-01-8	Broad Institute of MIT and Harvard	BRD-K70039065			CN(C)C(=O)C[C@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2ccccc2)C=C1	InChI=1S/C16H22N2O5S/c1-18(2)16(20)10-12-8-9-14(15(11-19)23-12)17-24(21,22)13-6-4-3-5-7-13/h3-9,12,14-15,17,19H,10-11H2,1-2H3/t12-,14-,15+/m0/s1	ACJRMYKVRUMDSA-AEGPPILISA-N	354.124942514							123619
BRD-K71151012	LSM-12772		54649529	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22+,23-/m1/s1	YDHXSWOLXDIZHC-CIGBUEHFSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K71151012	BRD-K71151012-001-01-4	Broad Institute of MIT and Harvard	BRD-K71151012			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22+,23-/m1/s1	YDHXSWOLXDIZHC-CIGBUEHFSA-N	473.25258587							101409
BRD-K89606138	LSM-13953		54649467	InChI=1S/C35H44N4O4S/c1-35(2,3)44(43)39-22-27-21-29(33(41)36-28-12-7-6-8-13-28)37-32(31(27)30(39)18-19-40)26-11-9-10-25(20-26)23-14-16-24(17-15-23)34(42)38(4)5/h9-11,14-17,20-21,28,30,40H,6-8,12-13,18-19,22H2,1-5H3,(H,36,41)/t30-,44-/m0/s1	BMIDXELBLGAQFU-PDWOKFFSSA-N	CN(C)C(=O)c1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)NC5CCCCC5	BroadT	BRD-K89606138	BRD-K89606138-001-01-6	Broad Institute of MIT and Harvard	BRD-K89606138			CN(C)C(=O)c1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NC1CCCCC1	InChI=1S/C35H44N4O4S/c1-35(2,3)44(43)39-22-27-21-29(33(41)36-28-12-7-6-8-13-28)37-32(31(27)30(39)18-19-40)26-11-9-10-25(20-26)23-14-16-24(17-15-23)34(42)38(4)5/h9-11,14-17,20-21,28,30,40H,6-8,12-13,18-19,22H2,1-5H3,(H,36,41)/t30-,44-/m0/s1	BMIDXELBLGAQFU-PDWOKFFSSA-N	616.308326618							102606
BRD-K19011062	LSM-9566		54649548	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25+,26-/m1/s1	DIIJYNJFSHJSFY-MFYWSIJSSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@H]1O2)c4ccccc4)C#N	BroadT	BRD-K19011062	BRD-K19011062-001-01-4	Broad Institute of MIT and Harvard	BRD-K19011062			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25+,26-/m1/s1	DIIJYNJFSHJSFY-MFYWSIJSSA-N	505.25767125							98187
BRD-K27887926	LSM-10114		54649575	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19+,20+/m1/s1	WNHZFTQVONQUSH-LQJIQPLVSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K27887926	BRD-K27887926-001-01-3	Broad Institute of MIT and Harvard	BRD-K27887926			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19+,20+/m1/s1	WNHZFTQVONQUSH-LQJIQPLVSA-N	429.226371122							98735
CHEMBL3183224	LSM-12312	BRD-K63809549	54649427	InChI=1S/C33H34N4O5S/c1-33(2,3)43(40)37-19-25-17-26(32(39)35-18-21-7-8-28-29(15-21)42-20-41-28)36-31(30(25)27(37)11-14-38)24-6-4-5-23(16-24)22-9-12-34-13-10-22/h4-10,12-13,15-17,27,38H,11,14,18-20H2,1-3H3,(H,35,39)/t27-,43-/m1/s1	OLAATLBQFXJPIK-ACXULAKISA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccncc4)c2[C@H]1CCO)C(=O)NCc5ccc6OCOc6c5	BroadT	BRD-K63809549	BRD-K63809549-001-01-9	Broad Institute of MIT and Harvard	BRD-K63809549			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccncc1)C(=O)NCc1ccc2OCOc2c1	InChI=1S/C33H34N4O5S/c1-33(2,3)43(40)37-19-25-17-26(32(39)35-18-21-7-8-28-29(15-21)42-20-41-28)36-31(30(25)27(37)11-14-38)24-6-4-5-23(16-24)22-9-12-34-13-10-22/h4-10,12-13,15-17,27,38H,11,14,18-20H2,1-3H3,(H,35,39)/t27-,43-/m1/s1	OLAATLBQFXJPIK-ACXULAKISA-N	598.224990918							100939
BRD-K60558875	LSM-12087		54649406	InChI=1S/C33H33N5O3S/c1-33(2,3)42(41)38-21-27-18-28(32(40)36-20-22-10-13-35-14-11-22)37-31(30(27)29(38)12-15-39)26-9-5-8-25(17-26)24-7-4-6-23(16-24)19-34/h4-11,13-14,16-18,29,39H,12,15,20-21H2,1-3H3,(H,36,40)/t29-,42-/m0/s1	AXJWSZCRWHPALT-WHAQVLKXSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(c4)C#N)c2[C@@H]1CCO)C(=O)NCc5ccncc5	BroadT	BRD-K60558875	BRD-K60558875-001-01-9	Broad Institute of MIT and Harvard	BRD-K60558875			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccc(c1)C#N)C(=O)NCc1ccncc1	InChI=1S/C33H33N5O3S/c1-33(2,3)42(41)38-21-27-18-28(32(40)36-20-22-10-13-35-14-11-22)37-31(30(27)29(38)12-15-39)26-9-5-8-25(17-26)24-7-4-6-23(16-24)19-34/h4-11,13-14,16-18,29,39H,12,15,20-21H2,1-3H3,(H,36,40)/t29-,42-/m0/s1	AXJWSZCRWHPALT-WHAQVLKXSA-N	579.230410656							100713
BRD-K45883686	LSM-11223		54649331	InChI=1S/C31H33N5O3S/c1-31(2,3)40(39)36-20-25-18-26(30(38)34-19-21-7-12-32-13-8-21)35-29(28(25)27(36)11-16-37)24-6-4-5-23(17-24)22-9-14-33-15-10-22/h4-10,12-15,17-18,27,37H,11,16,19-20H2,1-3H3,(H,34,38)/t27-,40-/m1/s1	VKWMOKPZZRMWDJ-KSTXALNGSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccncc4)c2[C@H]1CCO)C(=O)NCc5ccncc5	BroadT	BRD-K45883686	BRD-K45883686-001-01-0	Broad Institute of MIT and Harvard	BRD-K45883686			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccncc1)C(=O)NCc1ccncc1	InChI=1S/C31H33N5O3S/c1-31(2,3)40(39)36-20-25-18-26(30(38)34-19-21-7-12-32-13-8-21)35-29(28(25)27(36)11-16-37)24-6-4-5-23(17-24)22-9-14-33-15-10-22/h4-10,12-15,17-18,27,37H,11,16,19-20H2,1-3H3,(H,34,38)/t27-,40-/m1/s1	VKWMOKPZZRMWDJ-KSTXALNGSA-N	555.230410656							99844
BRD-K31103241	LSM-10305		54649460	InChI=1S/C34H35N5O3S/c1-34(2,3)43(42)39-22-28-20-29(33(41)37-16-12-23-10-14-36-15-11-23)38-32(31(28)30(39)13-17-40)27-9-5-8-26(19-27)25-7-4-6-24(18-25)21-35/h4-11,14-15,18-20,30,40H,12-13,16-17,22H2,1-3H3,(H,37,41)/t30-,43-/m0/s1	VJIZUSRNHDZCJF-IPKWWJLYSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(c4)C#N)c2[C@@H]1CCO)C(=O)NCCc5ccncc5	BroadT	BRD-K31103241	BRD-K31103241-001-01-7	Broad Institute of MIT and Harvard	BRD-K31103241			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccc(c1)C#N)C(=O)NCCc1ccncc1	InChI=1S/C34H35N5O3S/c1-34(2,3)43(42)39-22-28-20-29(33(41)37-16-12-23-10-14-36-15-11-23)38-32(31(28)30(39)13-17-40)27-9-5-8-26(19-27)25-7-4-6-24(18-25)21-35/h4-11,14-15,18-20,30,40H,12-13,16-17,22H2,1-3H3,(H,37,41)/t30-,43-/m0/s1	VJIZUSRNHDZCJF-IPKWWJLYSA-N	593.24606072							98926
BRD-K58999044	LSM-11993		56835574	InChI=1S/C32H40N4O4S/c1-32(2,3)41(39)36-21-25-20-27(31(38)35-15-13-34(4)14-16-35)33-30(29(25)28(36)12-17-37)24-10-6-8-22(18-24)23-9-7-11-26(19-23)40-5/h6-11,18-20,28,37H,12-17,21H2,1-5H3/t28-,41?/m1/s1	COBDXBQOFDTBIX-MEUHZGSUSA-N	COc1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)S(=O)C(C)(C)C)C(=O)N5CCN(C)CC5	BroadT	BRD-K58999044	BRD-K58999044-001-03-1	Broad Institute of MIT and Harvard	BRD-K58999044			COc1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)S(=O)C(C)(C)C)C(=O)N1CCN(C)CC1	InChI=1S/C32H40N4O4S/c1-32(2,3)41(39)36-21-25-20-27(31(38)35-15-13-34(4)14-16-35)33-30(29(25)28(36)12-17-37)24-10-6-8-22(18-24)23-9-7-11-26(19-23)40-5/h6-11,18-20,28,37H,12-17,21H2,1-5H3/t28-,41?/m1/s1	COBDXBQOFDTBIX-MEUHZGSUSA-N	576.27702649							100619
BRD-K11977286	LSM-9151		54649527	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22+,23-/m1/s1	YDHXSWOLXDIZHC-ZLMPMGTESA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K11977286	BRD-K11977286-001-01-4	Broad Institute of MIT and Harvard	BRD-K11977286			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22+,23-/m1/s1	YDHXSWOLXDIZHC-ZLMPMGTESA-N	473.25258587							97772
CHEMBL3183095	LSM-9699	BRD-K20834925	54649383	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-23-11-13-29(43-4)14-12-23)38-33(32(28)31(39)15-16-40)27-10-6-9-26(18-27)25-8-5-7-24(17-25)20-36/h5-14,17-19,31,40H,15-16,21-22H2,1-4H3,(H,37,41)/t31-,44-/m0/s1	NEVKZQRLDPRUMB-JCFUSDQVSA-N	COc1ccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)c4cccc(c4)c5cccc(c5)C#N)[S@@](=O)C(C)(C)C)cc1	BroadT	BRD-K20834925	BRD-K20834925-001-01-3	Broad Institute of MIT and Harvard	BRD-K20834925			COc1ccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)-c2cccc(c2)-c2cccc(c2)C#N)[S@@](=O)C(C)(C)C)cc1	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-23-11-13-29(43-4)14-12-23)38-33(32(28)31(39)15-16-40)27-10-6-9-26(18-27)25-8-5-7-24(17-25)20-36/h5-14,17-19,31,40H,15-16,21-22H2,1-4H3,(H,37,41)/t31-,44-/m0/s1	NEVKZQRLDPRUMB-JCFUSDQVSA-N	608.245726362							98320
BRD-K88899439	LSM-13892		54649495	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21+,22+/m1/s1	XYLRKRISJMFHFX-GKADJBRLSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K88899439	BRD-K88899439-001-01-4	Broad Institute of MIT and Harvard	BRD-K88899439			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21+,22+/m1/s1	XYLRKRISJMFHFX-GKADJBRLSA-N	473.25258587							102545
BRD-K25379780	LSM-9970		54649414	InChI=1S/C32H33FN4O3S/c1-32(2,3)41(40)37-20-25-18-27(31(39)35-19-24-7-4-5-10-26(24)33)36-30(29(25)28(37)13-16-38)23-9-6-8-22(17-23)21-11-14-34-15-12-21/h4-12,14-15,17-18,28,38H,13,16,19-20H2,1-3H3,(H,35,39)/t28-,41-/m0/s1	SOFJTHGIOAEHFZ-VELXTTODSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccncc4)c2[C@@H]1CCO)C(=O)NCc5ccccc5F	BroadT	BRD-K25379780	BRD-K25379780-001-01-8	Broad Institute of MIT and Harvard	BRD-K25379780			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccncc1)C(=O)NCc1ccccc1F	InChI=1S/C32H33FN4O3S/c1-32(2,3)41(40)37-20-25-18-27(31(39)35-19-24-7-4-5-10-26(24)33)36-30(29(25)28(37)13-16-38)23-9-6-8-22(17-23)21-11-14-34-15-12-21/h4-12,14-15,17-18,28,38H,13,16,19-20H2,1-3H3,(H,35,39)/t28-,41-/m0/s1	SOFJTHGIOAEHFZ-VELXTTODSA-N	572.225739846							98591
BRD-K40555995	LSM-10906		54649567	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19-,20+/m0/s1	WNHZFTQVONQUSH-LWCVALJOSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K40555995	BRD-K40555995-001-01-5	Broad Institute of MIT and Harvard	BRD-K40555995			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19-,20+/m0/s1	WNHZFTQVONQUSH-LWCVALJOSA-N	429.226371122							99527
BRD-K95919017	LSM-14312		54649477	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21-,22+/m1/s1	XYLRKRISJMFHFX-RRJBWHJASA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K95919017	BRD-K95919017-001-01-1	Broad Institute of MIT and Harvard	BRD-K95919017			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21-,22+/m1/s1	XYLRKRISJMFHFX-RRJBWHJASA-N	473.25258587							102966
BRD-K16636143	LSM-9433		54649316	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	ZQAIRSWGSLNDJM-DRSNIGMVSA-N	CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K16636143	BRD-K16636143-001-01-4	Broad Institute of MIT and Harvard	BRD-K16636143			CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	ZQAIRSWGSLNDJM-DRSNIGMVSA-N	552.0922335							98054
BRD-K72282141	LSM-12859		54649475	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21+,22-/m0/s1	XYLRKRISJMFHFX-GMOZNSKDSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K72282141	BRD-K72282141-001-01-0	Broad Institute of MIT and Harvard	BRD-K72282141			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21+,22-/m0/s1	XYLRKRISJMFHFX-GMOZNSKDSA-N	473.25258587							101496
BRD-K42733037	LSM-11026		54649304	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15+,19+/m0/s1	GUZASBNVYSIPQO-QMTMVMCOSA-N	CO[C@H](CN(C)C(=O)C1CC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K42733037	BRD-K42733037-001-01-6	Broad Institute of MIT and Harvard	BRD-K42733037			CO[C@H](CN(C)C(=O)C1CC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15+,19+/m0/s1	GUZASBNVYSIPQO-QMTMVMCOSA-N	459.234491134							99647
BRD-K44993940	LSM-11166		54649321	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	ZQAIRSWGSLNDJM-JKSBSHDWSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K44993940	BRD-K44993940-001-01-0	Broad Institute of MIT and Harvard	BRD-K44993940			CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	ZQAIRSWGSLNDJM-JKSBSHDWSA-N	552.0922335							99787
BRD-K46597784	LSM-11274		54649558	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19+,20-/m0/s1	DXVJXLONGZUJOS-SXLOBPIMSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K46597784	BRD-K46597784-001-01-6	Broad Institute of MIT and Harvard	BRD-K46597784			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19+,20-/m0/s1	DXVJXLONGZUJOS-SXLOBPIMSA-N	429.226371122							99895
BRD-K85426712	LSM-13651		54649408	InChI=1S/C31H37FN4O3S/c1-31(2,3)40(39)36-20-23-19-26(30(38)35-15-13-34(4)14-16-35)33-29(28(23)27(36)12-17-37)22-9-7-8-21(18-22)24-10-5-6-11-25(24)32/h5-11,18-19,27,37H,12-17,20H2,1-4H3/t27-,40-/m0/s1	SXBHHBYKOFATQA-PDBZVODSSA-N	CN1CCN(CC1)C(=O)c2cc3CN([C@@H](CCO)c3c(n2)c4cccc(c4)c5ccccc5F)[S@@](=O)C(C)(C)C	BroadT	BRD-K85426712	BRD-K85426712-001-01-7	Broad Institute of MIT and Harvard	BRD-K85426712			CN1CCN(CC1)C(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1ccccc1F)[S@@](=O)C(C)(C)C	InChI=1S/C31H37FN4O3S/c1-31(2,3)40(39)36-20-23-19-26(30(38)35-15-13-34(4)14-16-35)33-29(28(23)27(36)12-17-37)22-9-7-8-21(18-22)24-10-5-6-11-25(24)32/h5-11,18-19,27,37H,12-17,20H2,1-4H3/t27-,40-/m0/s1	SXBHHBYKOFATQA-PDBZVODSSA-N	564.257039974							102298
BRD-K72014243	LSM-12840		56835577	InChI=1S/C31H37FN4O3S/c1-31(2,3)40(39)36-20-24-19-26(30(38)35-14-12-34(4)13-15-35)33-29(28(24)27(36)11-16-37)23-9-5-7-21(17-23)22-8-6-10-25(32)18-22/h5-10,17-19,27,37H,11-16,20H2,1-4H3/t27-,40?/m0/s1	BKCTXULBENSKFX-OVCFAJSKSA-N	CN1CCN(CC1)C(=O)c2cc3CN([C@@H](CCO)c3c(n2)c4cccc(c4)c5cccc(F)c5)S(=O)C(C)(C)C	BroadT	BRD-K72014243	BRD-K72014243-001-03-0	Broad Institute of MIT and Harvard	BRD-K72014243			CN1CCN(CC1)C(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(F)c1)S(=O)C(C)(C)C	InChI=1S/C31H37FN4O3S/c1-31(2,3)40(39)36-20-24-19-26(30(38)35-14-12-34(4)13-15-35)33-29(28(24)27(36)11-16-37)23-9-5-7-21(17-23)22-8-6-10-25(32)18-22/h5-10,17-19,27,37H,11-16,20H2,1-4H3/t27-,40?/m0/s1	BKCTXULBENSKFX-OVCFAJSKSA-N	564.257039974							101477
BRD-K18246949	LSM-9522		54649300	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15-,19-/m0/s1	GUZASBNVYSIPQO-DOXZYTNZSA-N	CO[C@@H](CN(C)C(=O)C1CC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K18246949	BRD-K18246949-001-01-6	Broad Institute of MIT and Harvard	BRD-K18246949			CO[C@@H](CN(C)C(=O)C1CC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15-,19-/m0/s1	GUZASBNVYSIPQO-DOXZYTNZSA-N	459.234491134							98143
BRD-K43519318	LSM-11079		54649420	InChI=1S/C31H37N3O5S/c1-31(2,3)40(37)34-20-23-19-25(30(36)33-13-16-39-17-14-33)32-29(28(23)26(34)12-15-35)22-9-7-8-21(18-22)24-10-5-6-11-27(24)38-4/h5-11,18-19,26,35H,12-17,20H2,1-4H3/t26-,40-/m0/s1	BNSXJPHXNABYAG-YKPJRVAWSA-N	COc1ccccc1c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)N5CCOCC5	BroadT	BRD-K43519318	BRD-K43519318-001-01-8	Broad Institute of MIT and Harvard	BRD-K43519318			COc1ccccc1-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)N1CCOCC1	InChI=1S/C31H37N3O5S/c1-31(2,3)40(37)34-20-23-19-25(30(36)33-13-16-39-17-14-33)32-29(28(23)26(34)12-15-35)22-9-7-8-21(18-22)24-10-5-6-11-27(24)38-4/h5-11,18-19,26,35H,12-17,20H2,1-4H3/t26-,40-/m0/s1	BNSXJPHXNABYAG-YKPJRVAWSA-N	563.245392004							99700
BRD-K35571012	LSM-10564		54649520	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22-,23-/m0/s1	YDHXSWOLXDIZHC-DYCPSGBQSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K35571012	BRD-K35571012-001-01-8	Broad Institute of MIT and Harvard	BRD-K35571012			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22-,23-/m0/s1	YDHXSWOLXDIZHC-DYCPSGBQSA-N	473.25258587							99185
BRD-K32310489	LSM-10386		54649382	InChI=1S/C33H36N4O4S/c1-33(2,3)42(40)37-21-25-19-27(32(39)35-20-22-12-15-34-16-13-22)36-31(30(25)28(37)14-17-38)24-9-7-8-23(18-24)26-10-5-6-11-29(26)41-4/h5-13,15-16,18-19,28,38H,14,17,20-21H2,1-4H3,(H,35,39)/t28-,42-/m1/s1	VTKOTAQLGFRVGB-VOLSFDEHSA-N	COc1ccccc1c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)NCc5ccncc5	BroadT	BRD-K32310489	BRD-K32310489-001-01-8	Broad Institute of MIT and Harvard	BRD-K32310489			COc1ccccc1-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)NCc1ccncc1	InChI=1S/C33H36N4O4S/c1-33(2,3)42(40)37-21-25-19-27(32(39)35-20-22-12-15-34-16-13-22)36-31(30(25)28(37)14-17-38)24-9-7-8-23(18-24)26-10-5-6-11-29(26)41-4/h5-13,15-16,18-19,28,38H,14,17,20-21H2,1-4H3,(H,35,39)/t28-,42-/m1/s1	VTKOTAQLGFRVGB-VOLSFDEHSA-N	584.245726362							99007
BRD-K31060354	LSM-10302		54649551	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25+,26-/m1/s1	DIIJYNJFSHJSFY-VHCQPULKSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@H]1O2)c4ccccc4)C#N	BroadT	BRD-K31060354	BRD-K31060354-001-01-2	Broad Institute of MIT and Harvard	BRD-K31060354			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25+,26-/m1/s1	DIIJYNJFSHJSFY-VHCQPULKSA-N	505.25767125							98923
BRD-K50194167	LSM-11483		54649398	InChI=1S/C29H34FN3O4S/c1-29(2,3)38(36)33-18-22-17-24(28(35)31-12-14-37-4)32-27(26(22)25(33)11-13-34)21-9-5-7-19(15-21)20-8-6-10-23(30)16-20/h5-10,15-17,25,34H,11-14,18H2,1-4H3,(H,31,35)/t25-,38-/m1/s1	RYACMGXBLHGDBX-GWEXNCIJSA-N	COCCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)c4cccc(F)c4)[S@](=O)C(C)(C)C	BroadT	BRD-K50194167	BRD-K50194167-001-01-2	Broad Institute of MIT and Harvard	BRD-K50194167			COCCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(F)c1)[S@](=O)C(C)(C)C	InChI=1S/C29H34FN3O4S/c1-29(2,3)38(36)33-18-22-17-24(28(35)31-12-14-37-4)32-27(26(22)25(33)11-13-34)21-9-5-7-19(15-21)20-8-6-10-23(30)16-20/h5-10,15-17,25,34H,11-14,18H2,1-4H3,(H,31,35)/t25-,38-/m1/s1	RYACMGXBLHGDBX-GWEXNCIJSA-N	539.225405488							100104
BRD-K35881842-001-01-7	LSM-35062	BRD-K35881842	54649292	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22-/m1/s1	DYSXQKGXYVAXRN-DRSNIGMVSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K35881842	BRD-K35881842-001-01-7	Broad Institute of MIT and Harvard	BRD-K35881842			CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22-/m1/s1	DYSXQKGXYVAXRN-DRSNIGMVSA-N	499.195248212							123620
BRD-K17507122	LSM-9480		54649506	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22-,23-/m0/s1	YDHXSWOLXDIZHC-ZHIWGVNJSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K17507122	BRD-K17507122-001-01-1	Broad Institute of MIT and Harvard	BRD-K17507122			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22-,23-/m0/s1	YDHXSWOLXDIZHC-ZHIWGVNJSA-N	473.25258587							98101
BRD-K99307487	LSM-14529		54649538	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25+,26-/m0/s1	DIIJYNJFSHJSFY-LJCOXQHRSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@@H]1O2)c4ccccc4)C#N	BroadT	BRD-K99307487	BRD-K99307487-001-02-4	Broad Institute of MIT and Harvard	BRD-K99307487			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25+,26-/m0/s1	DIIJYNJFSHJSFY-LJCOXQHRSA-N	505.25767125							103184
BRD-K28437309	LSM-10150		54649559	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19+,20+/m0/s1	DXVJXLONGZUJOS-DFQSSKMNSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K28437309	BRD-K28437309-001-01-3	Broad Institute of MIT and Harvard	BRD-K28437309			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19+,20+/m0/s1	DXVJXLONGZUJOS-DFQSSKMNSA-N	429.226371122							98771
BRD-K37405154	LSM-10688		54649410	InChI=1S/C31H34N4O4S/c1-31(2,3)40(38)35-20-25-18-26(30(37)34-12-15-39-16-13-34)33-29(28(25)27(35)11-14-36)24-6-4-5-23(17-24)22-9-7-21(19-32)8-10-22/h4-10,17-18,27,36H,11-16,20H2,1-3H3/t27-,40-/m1/s1	IMNSYTYGXZBRLR-KSTXALNGSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(cc4)C#N)c2[C@H]1CCO)C(=O)N5CCOCC5	BroadT	BRD-K37405154	BRD-K37405154-001-01-5	Broad Institute of MIT and Harvard	BRD-K37405154			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccc(cc1)C#N)C(=O)N1CCOCC1	InChI=1S/C31H34N4O4S/c1-31(2,3)40(38)35-20-25-18-26(30(37)34-12-15-39-16-13-34)33-29(28(25)27(35)11-14-36)24-6-4-5-23(17-24)22-9-7-21(19-32)8-10-22/h4-10,17-18,27,36H,11-16,20H2,1-3H3/t27-,40-/m1/s1	IMNSYTYGXZBRLR-KSTXALNGSA-N	558.230076298							99309
CHEMBL3188835	LSM-9353	BRD-K15453459	54649349	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-24-7-5-10-29(17-24)43-4)38-33(32(28)31(39)15-16-40)27-9-6-8-26(18-27)25-13-11-23(20-36)12-14-25/h5-14,17-19,31,40H,15-16,21-22H2,1-4H3,(H,37,41)/t31-,44-/m0/s1	PAVPSZKVOXNNCU-JCFUSDQVSA-N	COc1cccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)c4cccc(c4)c5ccc(cc5)C#N)[S@@](=O)C(C)(C)C)c1	BroadT	BRD-K15453459	BRD-K15453459-001-01-3	Broad Institute of MIT and Harvard	BRD-K15453459			COc1cccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)-c2cccc(c2)-c2ccc(cc2)C#N)[S@@](=O)C(C)(C)C)c1	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-24-7-5-10-29(17-24)43-4)38-33(32(28)31(39)15-16-40)27-9-6-8-26(18-27)25-13-11-23(20-36)12-14-25/h5-14,17-19,31,40H,15-16,21-22H2,1-4H3,(H,37,41)/t31-,44-/m0/s1	PAVPSZKVOXNNCU-JCFUSDQVSA-N	608.245726362							97974
BRD-K01490356	LSM-8526		56835576	InChI=1S/C28H28N2O5S/c1-28(2,3)36(34)30-16-20-14-21(27(32)33)29-26(25(20)22(30)11-12-31)19-9-6-8-17(13-19)24-15-18-7-4-5-10-23(18)35-24/h4-10,13-15,22,31H,11-12,16H2,1-3H3,(H,32,33)/t22-,36?/m0/s1	WYZIXXCOOAVGGW-SABIYNJPSA-N	CC(C)(C)S(=O)N1Cc2cc(nc(c3cccc(c3)c4oc5ccccc5c4)c2[C@@H]1CCO)C(=O)O	BroadT	BRD-K01490356	BRD-K01490356-001-03-1	Broad Institute of MIT and Harvard	BRD-K01490356			CC(C)(C)S(=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cc2ccccc2o1)C(O)=O	InChI=1S/C28H28N2O5S/c1-28(2,3)36(34)30-16-20-14-21(27(32)33)29-26(25(20)22(30)11-12-31)19-9-6-8-17(13-19)24-15-18-7-4-5-10-23(18)35-24/h4-10,13-15,22,31H,11-12,16H2,1-3H3,(H,32,33)/t22-,36?/m0/s1	WYZIXXCOOAVGGW-SABIYNJPSA-N	504.171892706							97147
CHEMBL2360034	LSM-10650	BRD-K36721554, SID131445833	54649434	InChI=1S/C32H33FN4O3S/c1-32(2,3)41(40)37-20-25-17-27(31(39)35-19-24-8-4-5-12-26(24)33)36-30(29(25)28(37)13-15-38)22-10-6-9-21(16-22)23-11-7-14-34-18-23/h4-12,14,16-18,28,38H,13,15,19-20H2,1-3H3,(H,35,39)/t28-,41-/m1/s1	YOONRACURWGVIS-GIEABIOQSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccnc4)c2[C@H]1CCO)C(=O)NCc5ccccc5F	BroadT	BRD-K36721554	BRD-K36721554-001-01-2	Broad Institute of MIT and Harvard	BRD-K36721554			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccnc1)C(=O)NCc1ccccc1F	InChI=1S/C32H33FN4O3S/c1-32(2,3)41(40)37-20-25-17-27(31(39)35-19-24-8-4-5-12-26(24)33)36-30(29(25)28(37)13-15-38)22-10-6-9-21(16-22)23-11-7-14-34-18-23/h4-12,14,16-18,28,38H,13,15,19-20H2,1-3H3,(H,35,39)/t28-,41-/m1/s1	YOONRACURWGVIS-GIEABIOQSA-N	572.225739846							99271
BRD-K20721504	LSM-9683		54649305	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15+,19-/m0/s1	GUZASBNVYSIPQO-KHYOSLBOSA-N	CO[C@@H](CN(C)C(=O)C1CC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K20721504	BRD-K20721504-001-01-1	Broad Institute of MIT and Harvard	BRD-K20721504			CO[C@@H](CN(C)C(=O)C1CC1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15+,19-/m0/s1	GUZASBNVYSIPQO-KHYOSLBOSA-N	459.234491134							98304
BRD-K96534186	LSM-14348		54649509	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22+,23+/m1/s1	YDHXSWOLXDIZHC-UNVSHWJJSA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K96534186	BRD-K96534186-001-01-2	Broad Institute of MIT and Harvard	BRD-K96534186			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22+,23+/m1/s1	YDHXSWOLXDIZHC-UNVSHWJJSA-N	473.25258587							103002
BRD-K06370852	LSM-8797		54649440	InChI=1S/C32H35N5O3S/c1-32(2,3)41(40)37-21-26-20-27(31(39)35-17-9-22-7-13-33-14-8-22)36-30(29(26)28(37)12-18-38)25-6-4-5-24(19-25)23-10-15-34-16-11-23/h4-8,10-11,13-16,19-20,28,38H,9,12,17-18,21H2,1-3H3,(H,35,39)/t28-,41-/m0/s1	UNXBJJPJSXSVQI-VELXTTODSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccncc4)c2[C@@H]1CCO)C(=O)NCCc5ccncc5	BroadT	BRD-K06370852	BRD-K06370852-001-01-3	Broad Institute of MIT and Harvard	BRD-K06370852			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccncc1)C(=O)NCCc1ccncc1	InChI=1S/C32H35N5O3S/c1-32(2,3)41(40)37-21-26-20-27(31(39)35-17-9-22-7-13-33-14-8-22)36-30(29(26)28(37)12-18-38)25-6-4-5-24(19-25)23-10-15-34-16-11-23/h4-8,10-11,13-16,19-20,28,38H,9,12,17-18,21H2,1-3H3,(H,35,39)/t28-,41-/m0/s1	UNXBJJPJSXSVQI-VELXTTODSA-N	569.24606072							97418
BRD-K61431779	LSM-12152		54649373	InChI=1S/C36H41N5O3S/c1-36(2,3)45(44)41-23-29-20-31(35(43)38-30-14-17-40(24-30)22-25-9-5-4-6-10-25)39-34(33(29)32(41)15-18-42)27-12-7-11-26(19-27)28-13-8-16-37-21-28/h4-13,16,19-21,30,32,42H,14-15,17-18,22-24H2,1-3H3,(H,38,43)/t30-,32+,45+/m0/s1	OXCAKDYULKMTMJ-MSSXPUBGSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccnc4)c2[C@H]1CCO)C(=O)N[C@H]5CCN(Cc6ccccc6)C5	BroadT	BRD-K61431779	BRD-K61431779-001-01-5	Broad Institute of MIT and Harvard	BRD-K61431779			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccnc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	InChI=1S/C36H41N5O3S/c1-36(2,3)45(44)41-23-29-20-31(35(43)38-30-14-17-40(24-30)22-25-9-5-4-6-10-25)39-34(33(29)32(41)15-18-42)27-12-7-11-26(19-27)28-13-8-16-37-21-28/h4-13,16,19-21,30,32,42H,14-15,17-18,22-24H2,1-3H3,(H,38,43)/t30-,32+,45+/m0/s1	OXCAKDYULKMTMJ-MSSXPUBGSA-N	623.293010912							100778
BRD-K65373229	LSM-12414		54649502	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21+,22-/m1/s1	XYLRKRISJMFHFX-RCUFNAHASA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K65373229	BRD-K65373229-001-01-1	Broad Institute of MIT and Harvard	BRD-K65373229			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21+,22-/m1/s1	XYLRKRISJMFHFX-RCUFNAHASA-N	473.25258587							101041
BRD-K31262969	LSM-10319		54649487	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21+,22+/m0/s1	XYLRKRISJMFHFX-QXPVWKFPSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K31262969	BRD-K31262969-001-01-1	Broad Institute of MIT and Harvard	BRD-K31262969			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21+,22+/m0/s1	XYLRKRISJMFHFX-QXPVWKFPSA-N	473.25258587							98940
BRD-K26277326	LSM-10021		54649468	InChI=1S/C34H42N4O4S/c1-34(2,3)43(42)38-21-26-20-28(32(40)35-27-11-6-7-12-27)36-31(30(26)29(38)17-18-39)25-10-8-9-24(19-25)22-13-15-23(16-14-22)33(41)37(4)5/h8-10,13-16,19-20,27,29,39H,6-7,11-12,17-18,21H2,1-5H3,(H,35,40)/t29-,43-/m0/s1	BQTKZBMOPJVAHJ-SDSPLPIBSA-N	CN(C)C(=O)c1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)NC5CCCC5	BroadT	BRD-K26277326	BRD-K26277326-001-01-4	Broad Institute of MIT and Harvard	BRD-K26277326			CN(C)C(=O)c1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NC1CCCC1	InChI=1S/C34H42N4O4S/c1-34(2,3)43(42)38-21-26-20-28(32(40)35-27-11-6-7-12-27)36-31(30(26)29(38)17-18-39)25-10-8-9-24(19-25)22-13-15-23(16-14-22)33(41)37(4)5/h8-10,13-16,19-20,27,29,39H,6-7,11-12,17-18,21H2,1-5H3,(H,35,40)/t29-,43-/m0/s1	BQTKZBMOPJVAHJ-SDSPLPIBSA-N	602.292676554							98642
BRD-K69947829	LSM-12697		56835595	InChI=1S/C33H44N4O3S/c1-33(2,3)41(40)37-23-27-22-28(32(39)36-18-16-35(4)17-19-36)34-31(30(27)29(37)15-20-38)26-14-8-13-25(21-26)12-7-11-24-9-5-6-10-24/h8,13-14,21-22,24,29,38H,5-6,9-11,15-20,23H2,1-4H3/t29-,41?/m0/s1	LIWWQJPEXSZFEM-XLSVDPLXSA-N	CN1CCN(CC1)C(=O)c2cc3CN([C@@H](CCO)c3c(n2)c4cccc(c4)C#CCC5CCCC5)S(=O)C(C)(C)C	BroadT	BRD-K69947829	BRD-K69947829-001-02-0	Broad Institute of MIT and Harvard	BRD-K69947829			CN1CCN(CC1)C(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)C#CCC1CCCC1)S(=O)C(C)(C)C	InChI=1S/C33H44N4O3S/c1-33(2,3)41(40)37-23-27-22-28(32(39)36-18-16-35(4)17-19-36)34-31(30(27)29(37)15-20-38)26-14-8-13-25(21-26)12-7-11-24-9-5-6-10-24/h8,13-14,21-22,24,29,38H,5-6,9-11,15-20,23H2,1-4H3/t29-,41?/m0/s1	LIWWQJPEXSZFEM-XLSVDPLXSA-N	576.313411998							101331
BRD-K75179331	LSM-13031		54649493	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21-,22+/m1/s1	XYLRKRISJMFHFX-FEHPBONCSA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K75179331	BRD-K75179331-001-01-5	Broad Institute of MIT and Harvard	BRD-K75179331			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21-,22+/m1/s1	XYLRKRISJMFHFX-FEHPBONCSA-N	473.25258587							101668
BRD-K06718821	LSM-43446		54649334	InChI=1S/C25H33N3O3S/c1-7-9-17-10-8-11-18(14-17)23-22-19(15-20(26-23)24(30)27(5)6)16-28(21(22)12-13-29)32(31)25(2,3)4/h7-11,14-15,21,29H,12-13,16H2,1-6H3/b9-7+/t21-,32-/m0/s1	RNMVFZAVZZIVNY-IMZODUIDSA-N	C\C=C\c1cccc(c1)c2nc(cc3CN([C@@H](CCO)c23)[S@@](=O)C(C)(C)C)C(=O)N(C)C	BroadT	BRD-K06718821	BRD-K06718821-001-01-1	Broad Institute of MIT and Harvard	BRD-K06718821			C\C=C\c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)N(C)C	InChI=1S/C25H33N3O3S/c1-7-9-17-10-8-11-18(14-17)23-22-19(15-20(26-23)24(30)27(5)6)16-28(21(22)12-13-29)32(31)25(2,3)4/h7-11,14-15,21,29H,12-13,16H2,1-6H3/b9-7+/t21-,32-/m0/s1	RNMVFZAVZZIVNY-IMZODUIDSA-N	455.224262636							
BRD-K87167564	LSM-13774		54649518	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22-,23+/m1/s1	YDHXSWOLXDIZHC-BCLDRZJSSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K87167564	BRD-K87167564-001-01-4	Broad Institute of MIT and Harvard	BRD-K87167564			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22-,23+/m1/s1	YDHXSWOLXDIZHC-BCLDRZJSSA-N	473.25258587							102423
BRD-K61051532	LSM-12123		54649426	InChI=1S/C31H36FN3O3S/c1-31(2,3)39(38)35-20-23-19-26(30(37)34-15-7-4-8-16-34)33-29(28(23)27(35)14-17-36)22-11-9-10-21(18-22)24-12-5-6-13-25(24)32/h5-6,9-13,18-19,27,36H,4,7-8,14-17,20H2,1-3H3/t27-,39-/m0/s1	LDKZHRSADHZSDU-XGFTYPEHSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccccc4F)c2[C@@H]1CCO)C(=O)N5CCCCC5	BroadT	BRD-K61051532	BRD-K61051532-001-01-9	Broad Institute of MIT and Harvard	BRD-K61051532			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccccc1F)C(=O)N1CCCCC1	InChI=1S/C31H36FN3O3S/c1-31(2,3)39(38)35-20-23-19-26(30(37)34-15-7-4-8-16-34)33-29(28(23)27(35)14-17-36)22-11-9-10-21(18-22)24-12-5-6-13-25(24)32/h5-6,9-13,18-19,27,36H,4,7-8,14-17,20H2,1-3H3/t27-,39-/m0/s1	LDKZHRSADHZSDU-XGFTYPEHSA-N	549.246140932							100749
BRD-K13299110	LSM-9226		54649471	InChI=1S/C33H39N5O3S/c1-33(2,3)42(41)38-22-27-20-28(32(40)35-13-16-37-14-4-5-15-37)36-31(30(27)29(38)12-17-39)26-11-7-10-25(19-26)24-9-6-8-23(18-24)21-34/h6-11,18-20,29,39H,4-5,12-17,22H2,1-3H3,(H,35,40)/t29-,42-/m0/s1	RNFNRXMTASYMQO-WHAQVLKXSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(c4)C#N)c2[C@@H]1CCO)C(=O)NCCN5CCCC5	BroadT	BRD-K13299110	BRD-K13299110-001-01-3	Broad Institute of MIT and Harvard	BRD-K13299110			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccc(c1)C#N)C(=O)NCCN1CCCC1	InChI=1S/C33H39N5O3S/c1-33(2,3)42(41)38-22-27-20-28(32(40)35-13-16-37-14-4-5-15-37)36-31(30(27)29(38)12-17-39)26-11-7-10-25(19-26)24-9-6-8-23(18-24)21-34/h6-11,18-20,29,39H,4-5,12-17,22H2,1-3H3,(H,35,40)/t29-,42-/m0/s1	RNFNRXMTASYMQO-WHAQVLKXSA-N	585.277360848							97847
BRD-K96006237	LSM-14317		54649563	InChI=1S/C28H39N3O5/c1-30-18-24-23(34-3)11-10-21(36-24)12-15-35-26-20(17-29)8-7-9-22(26)27(33)31(2)19-28(16-25(30)32)13-5-4-6-14-28/h7-9,21,23-24H,4-6,10-16,18-19H2,1-3H3/t21-,23-,24-/m0/s1	NNLRSZHLKPFWRY-XWGVYQGASA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CC4(CCCCC4)CC(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K96006237	BRD-K96006237-001-01-0	Broad Institute of MIT and Harvard	BRD-K96006237			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CC3(CCCCC3)CC(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C28H39N3O5/c1-30-18-24-23(34-3)11-10-21(36-24)12-15-35-26-20(17-29)8-7-9-22(26)27(33)31(2)19-28(16-25(30)32)13-5-4-6-14-28/h7-9,21,23-24H,4-6,10-16,18-19H2,1-3H3/t21-,23-,24-/m0/s1	NNLRSZHLKPFWRY-XWGVYQGASA-N	497.288971378							102971
BRD-K87621813	LSM-13801		56835590	InChI=1S/C33H44N4O3S/c1-33(2,3)41(40)37-23-27-22-28(32(39)36-18-16-35(4)17-19-36)34-31(30(27)29(37)15-20-38)26-14-8-13-25(21-26)12-7-11-24-9-5-6-10-24/h8,13-14,21-22,24,29,38H,5-6,9-11,15-20,23H2,1-4H3/t29-,41?/m1/s1	LIWWQJPEXSZFEM-BWCOESTKSA-N	CN1CCN(CC1)C(=O)c2cc3CN([C@H](CCO)c3c(n2)c4cccc(c4)C#CCC5CCCC5)S(=O)C(C)(C)C	BroadT	BRD-K87621813	BRD-K87621813-001-03-5	Broad Institute of MIT and Harvard	BRD-K87621813			CN1CCN(CC1)C(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)C#CCC1CCCC1)S(=O)C(C)(C)C	InChI=1S/C33H44N4O3S/c1-33(2,3)41(40)37-23-27-22-28(32(39)36-18-16-35(4)17-19-36)34-31(30(27)29(37)15-20-38)26-14-8-13-25(21-26)12-7-11-24-9-5-6-10-24/h8,13-14,21-22,24,29,38H,5-6,9-11,15-20,23H2,1-4H3/t29-,41?/m1/s1	LIWWQJPEXSZFEM-BWCOESTKSA-N	576.313411998							102450
BRD-K27865298	LSM-10112		56835578	InChI=1S/C31H37FN4O3S/c1-31(2,3)40(39)36-20-24-19-26(30(38)35-14-12-34(4)13-15-35)33-29(28(24)27(36)11-16-37)23-9-5-7-21(17-23)22-8-6-10-25(32)18-22/h5-10,17-19,27,37H,11-16,20H2,1-4H3/t27-,40?/m1/s1	BKCTXULBENSKFX-SBQKCOLHSA-N	CN1CCN(CC1)C(=O)c2cc3CN([C@H](CCO)c3c(n2)c4cccc(c4)c5cccc(F)c5)S(=O)C(C)(C)C	BroadT	BRD-K27865298	BRD-K27865298-001-03-5	Broad Institute of MIT and Harvard	BRD-K27865298			CN1CCN(CC1)C(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(F)c1)S(=O)C(C)(C)C	InChI=1S/C31H37FN4O3S/c1-31(2,3)40(39)36-20-24-19-26(30(38)35-14-12-34(4)13-15-35)33-29(28(24)27(36)11-16-37)23-9-5-7-21(17-23)22-8-6-10-25(32)18-22/h5-10,17-19,27,37H,11-16,20H2,1-4H3/t27-,40?/m1/s1	BKCTXULBENSKFX-SBQKCOLHSA-N	564.257039974							98733
BRD-K84238725	LSM-13578		54649485	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21-,22-/m1/s1	XYLRKRISJMFHFX-QKINTPNGSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K84238725	BRD-K84238725-001-01-2	Broad Institute of MIT and Harvard	BRD-K84238725			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21-,22-/m1/s1	XYLRKRISJMFHFX-QKINTPNGSA-N	473.25258587							102222
BRD-K93410778	LSM-14157		54649564	InChI=1S/C28H39N3O5/c1-30-18-24-23(34-3)11-10-21(36-24)12-15-35-26-20(17-29)8-7-9-22(26)27(33)31(2)19-28(16-25(30)32)13-5-4-6-14-28/h7-9,21,23-24H,4-6,10-16,18-19H2,1-3H3/t21-,23+,24-/m1/s1	NNLRSZHLKPFWRY-YFNKSVMNSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CC4(CCCCC4)CC(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K93410778	BRD-K93410778-001-01-2	Broad Institute of MIT and Harvard	BRD-K93410778			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CC3(CCCCC3)CC(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C28H39N3O5/c1-30-18-24-23(34-3)11-10-21(36-24)12-15-35-26-20(17-29)8-7-9-22(26)27(33)31(2)19-28(16-25(30)32)13-5-4-6-14-28/h7-9,21,23-24H,4-6,10-16,18-19H2,1-3H3/t21-,23+,24-/m1/s1	NNLRSZHLKPFWRY-YFNKSVMNSA-N	497.288971378							102811
BRD-K51088127	LSM-11551		54649523	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22-,23+/m0/s1	YDHXSWOLXDIZHC-PIXNORKHSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K51088127	BRD-K51088127-001-01-4	Broad Institute of MIT and Harvard	BRD-K51088127			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22-,23+/m0/s1	YDHXSWOLXDIZHC-PIXNORKHSA-N	473.25258587							100174
BRD-K37766746	LSM-10714		54649310	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17-,23-/m1/s1	HABLAPXLJDLSLY-SEPYTNNBSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K37766746	BRD-K37766746-001-01-5	Broad Institute of MIT and Harvard	BRD-K37766746			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17-,23-/m1/s1	HABLAPXLJDLSLY-SEPYTNNBSA-N	488.195662782							99335
BRD-K55808012	LSM-11809		54649401	InChI=1S/C27H35N3O3S/c1-27(2,3)34(33)30-17-21-16-22(26(32)29(4)5)28-25(24(21)23(30)13-14-31)20-12-8-11-19(15-20)18-9-6-7-10-18/h8-9,11-12,15-16,23,31H,6-7,10,13-14,17H2,1-5H3/t23-,34-/m1/s1	PGDAOJJPUPXGSS-GRMGDBHTSA-N	CN(C)C(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)C4=CCCC4)[S@](=O)C(C)(C)C	BroadT	BRD-K55808012	BRD-K55808012-001-01-9	Broad Institute of MIT and Harvard	BRD-K55808012			CN(C)C(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)C1=CCCC1)[S@](=O)C(C)(C)C	InChI=1S/C27H35N3O3S/c1-27(2,3)34(33)30-17-21-16-22(26(32)29(4)5)28-25(24(21)23(30)13-14-31)20-12-8-11-19(15-20)18-9-6-7-10-18/h8-9,11-12,15-16,23,31H,6-7,10,13-14,17H2,1-5H3/t23-,34-/m1/s1	PGDAOJJPUPXGSS-GRMGDBHTSA-N	481.2399127							100434
BRD-K72760455	LSM-12882		54649535	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22-,23-/m1/s1	YDHXSWOLXDIZHC-OXFDMBILSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K72760455	BRD-K72760455-001-01-5	Broad Institute of MIT and Harvard	BRD-K72760455			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22-,23-/m1/s1	YDHXSWOLXDIZHC-OXFDMBILSA-N	473.25258587							101519
CHEMBL2361154	LSM-14115	BRD-K92773691, SID131445855	54649456	InChI=1S/C36H40N4O4S/c1-36(2,3)45(44)40-23-29-21-30(34(42)37-22-24-10-7-6-8-11-24)38-33(32(29)31(40)18-19-41)28-13-9-12-27(20-28)25-14-16-26(17-15-25)35(43)39(4)5/h6-17,20-21,31,41H,18-19,22-23H2,1-5H3,(H,37,42)/t31-,45-/m1/s1	WJAYFAVILWHXQO-OJFHYHFNSA-N	CN(C)C(=O)c1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)NCc5ccccc5	BroadT	BRD-K92773691	BRD-K92773691-001-01-8	Broad Institute of MIT and Harvard	BRD-K92773691			CN(C)C(=O)c1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)NCc1ccccc1	InChI=1S/C36H40N4O4S/c1-36(2,3)45(44)40-23-29-21-30(34(42)37-22-24-10-7-6-8-11-24)38-33(32(29)31(40)18-19-41)28-13-9-12-27(20-28)25-14-16-26(17-15-25)35(43)39(4)5/h6-17,20-21,31,41H,18-19,22-23H2,1-5H3,(H,37,42)/t31-,45-/m1/s1	WJAYFAVILWHXQO-OJFHYHFNSA-N	624.27702649							102769
BRD-K18102341	LSM-9513		54649574	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19-,20-/m1/s1	WNHZFTQVONQUSH-RARDXLECSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K18102341	BRD-K18102341-001-01-5	Broad Institute of MIT and Harvard	BRD-K18102341			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19-,20-/m1/s1	WNHZFTQVONQUSH-RARDXLECSA-N	429.226371122							98134
BRD-K76439996	LSM-13104		54649405	InChI=1S/C33H33N5O3S/c1-33(2,3)42(41)38-21-27-18-28(32(40)36-20-22-10-13-35-14-11-22)37-31(30(27)29(38)12-15-39)26-9-5-8-25(17-26)24-7-4-6-23(16-24)19-34/h4-11,13-14,16-18,29,39H,12,15,20-21H2,1-3H3,(H,36,40)/t29-,42-/m1/s1	AXJWSZCRWHPALT-LIIBOVGXSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(c4)C#N)c2[C@H]1CCO)C(=O)NCc5ccncc5	BroadT	BRD-K76439996	BRD-K76439996-001-01-8	Broad Institute of MIT and Harvard	BRD-K76439996			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccc(c1)C#N)C(=O)NCc1ccncc1	InChI=1S/C33H33N5O3S/c1-33(2,3)42(41)38-21-27-18-28(32(40)36-20-22-10-13-35-14-11-22)37-31(30(27)29(38)12-15-39)26-9-5-8-25(17-26)24-7-4-6-23(16-24)19-34/h4-11,13-14,16-18,29,39H,12,15,20-21H2,1-3H3,(H,36,40)/t29-,42-/m1/s1	AXJWSZCRWHPALT-LIIBOVGXSA-N	579.230410656							101742
CHEMBL3185285	LSM-13896	BRD-K88937432	54649428	InChI=1S/C33H34N4O5S/c1-33(2,3)43(40)37-19-25-17-26(32(39)35-18-21-7-8-28-29(15-21)42-20-41-28)36-31(30(25)27(37)11-14-38)24-6-4-5-23(16-24)22-9-12-34-13-10-22/h4-10,12-13,15-17,27,38H,11,14,18-20H2,1-3H3,(H,35,39)/t27-,43-/m0/s1	OLAATLBQFXJPIK-AMDSOUHQSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccncc4)c2[C@@H]1CCO)C(=O)NCc5ccc6OCOc6c5	BroadT	BRD-K88937432	BRD-K88937432-001-01-9	Broad Institute of MIT and Harvard	BRD-K88937432			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccncc1)C(=O)NCc1ccc2OCOc2c1	InChI=1S/C33H34N4O5S/c1-33(2,3)43(40)37-19-25-17-26(32(39)35-18-21-7-8-28-29(15-21)42-20-41-28)36-31(30(25)27(37)11-14-38)24-6-4-5-23(16-24)22-9-12-34-13-10-22/h4-10,12-13,15-17,27,38H,11,14,18-20H2,1-3H3,(H,35,39)/t27-,43-/m0/s1	OLAATLBQFXJPIK-AMDSOUHQSA-N	598.224990918							102549
BRD-K96551169	LSM-14351		54649508	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22+,23-/m0/s1	YDHXSWOLXDIZHC-OMYJKWGRSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K96551169	BRD-K96551169-001-01-7	Broad Institute of MIT and Harvard	BRD-K96551169			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22+,23-/m0/s1	YDHXSWOLXDIZHC-OMYJKWGRSA-N	473.25258587							103005
BRD-K02665621	LSM-8603		54649511	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22-,23-/m0/s1	YDHXSWOLXDIZHC-LBNRHDOMSA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K02665621	BRD-K02665621-001-01-0	Broad Institute of MIT and Harvard	BRD-K02665621			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22-,23-/m0/s1	YDHXSWOLXDIZHC-LBNRHDOMSA-N	473.25258587							97224
BRD-K10449938	LSM-9059		54649329	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m1/s1	JTCZGLOUSBJUER-YVHKJVDXSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K10449938	BRD-K10449938-001-01-7	Broad Institute of MIT and Harvard	BRD-K10449938			CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m1/s1	JTCZGLOUSBJUER-YVHKJVDXSA-N	552.0922335							97680
BRD-K62189562	LSM-12203		56835568	InChI=1S/C30H37N3O5S/c1-30(2,3)39(36)33-19-23-18-25(29(35)31-13-15-37-4)32-28(27(23)26(33)12-14-34)22-10-6-8-20(16-22)21-9-7-11-24(17-21)38-5/h6-11,16-18,26,34H,12-15,19H2,1-5H3,(H,31,35)/t26-,39?/m1/s1	NSGNWJNYRBQKFH-ZFPLWWAGSA-N	COCCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)c4cccc(OC)c4)S(=O)C(C)(C)C	BroadT	BRD-K62189562	BRD-K62189562-001-03-5	Broad Institute of MIT and Harvard	BRD-K62189562			COCCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(OC)c1)S(=O)C(C)(C)C	InChI=1S/C30H37N3O5S/c1-30(2,3)39(36)33-19-23-18-25(29(35)31-13-15-37-4)32-28(27(23)26(33)12-14-34)22-10-6-8-20(16-22)21-9-7-11-24(17-21)38-5/h6-11,16-18,26,34H,12-15,19H2,1-5H3,(H,31,35)/t26-,39?/m1/s1	NSGNWJNYRBQKFH-ZFPLWWAGSA-N	551.245392004							100829
BRD-K81658138	LSM-13412		54649583	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16-,18+,19+/m0/s1	LYYREMJMDQKNES-IAAVTCLWSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K81658138	BRD-K81658138-001-01-5	Broad Institute of MIT and Harvard	BRD-K81658138			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16-,18+,19+/m0/s1	LYYREMJMDQKNES-IAAVTCLWSA-N	415.210721058							102052
BRD-K08373870	LSM-8933		54649322	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	JTCZGLOUSBJUER-HOIFWPIMSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K08373870	BRD-K08373870-001-01-3	Broad Institute of MIT and Harvard	BRD-K08373870			CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	JTCZGLOUSBJUER-HOIFWPIMSA-N	552.0922335							97554
BRD-K54410116	LSM-11732		54649374	InChI=1S/C36H41N5O3S/c1-36(2,3)45(44)41-23-29-20-31(35(43)38-30-14-17-40(24-30)22-25-9-5-4-6-10-25)39-34(33(29)32(41)15-18-42)27-12-7-11-26(19-27)28-13-8-16-37-21-28/h4-13,16,19-21,30,32,42H,14-15,17-18,22-24H2,1-3H3,(H,38,43)/t30-,32-,45-/m1/s1	OXCAKDYULKMTMJ-PFFFZIHFSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccnc4)c2[C@H]1CCO)C(=O)N[C@@H]5CCN(Cc6ccccc6)C5	BroadT	BRD-K54410116	BRD-K54410116-001-01-0	Broad Institute of MIT and Harvard	BRD-K54410116			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccnc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	InChI=1S/C36H41N5O3S/c1-36(2,3)45(44)41-23-29-20-31(35(43)38-30-14-17-40(24-30)22-25-9-5-4-6-10-25)39-34(33(29)32(41)15-18-42)27-12-7-11-26(19-27)28-13-8-16-37-21-28/h4-13,16,19-21,30,32,42H,14-15,17-18,22-24H2,1-3H3,(H,38,43)/t30-,32-,45-/m1/s1	OXCAKDYULKMTMJ-PFFFZIHFSA-N	623.293010912							100357
BRD-K82328933	LSM-13459		54649325	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m0/s1	JTCZGLOUSBJUER-GSHUGGBRSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K82328933	BRD-K82328933-001-01-1	Broad Institute of MIT and Harvard	BRD-K82328933			CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m0/s1	JTCZGLOUSBJUER-GSHUGGBRSA-N	552.0922335							102099
BRD-K89222451	LSM-13919		54649497	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21-,22+/m1/s1	XYLRKRISJMFHFX-QKTCQZCWSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K89222451	BRD-K89222451-001-01-1	Broad Institute of MIT and Harvard	BRD-K89222451			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21-,22+/m1/s1	XYLRKRISJMFHFX-QKTCQZCWSA-N	473.25258587							102572
CHEMBL2355072	LSM-12713	BRD-K70201679, SID131445764	54649365	InChI=1S/C36H40N4O4S/c1-36(2,3)45(44)40-23-29-21-30(34(42)37-22-24-11-7-6-8-12-24)38-33(32(29)31(40)17-18-41)27-15-9-13-25(19-27)26-14-10-16-28(20-26)35(43)39(4)5/h6-16,19-21,31,41H,17-18,22-23H2,1-5H3,(H,37,42)/t31-,45-/m1/s1	LFBXRJWXGRWLKM-OJFHYHFNSA-N	CN(C)C(=O)c1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)NCc5ccccc5	BroadT	BRD-K70201679	BRD-K70201679-001-01-2	Broad Institute of MIT and Harvard	BRD-K70201679			CN(C)C(=O)c1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)NCc1ccccc1	InChI=1S/C36H40N4O4S/c1-36(2,3)45(44)40-23-29-21-30(34(42)37-22-24-11-7-6-8-12-24)38-33(32(29)31(40)17-18-41)27-15-9-13-25(19-27)26-14-10-16-28(20-26)35(43)39(4)5/h6-16,19-21,31,41H,17-18,22-23H2,1-5H3,(H,37,42)/t31-,45-/m1/s1	LFBXRJWXGRWLKM-OJFHYHFNSA-N	624.27702649							101348
BRD-K59015387	LSM-11995		54649484	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21-,22-/m1/s1	XYLRKRISJMFHFX-PZMMLYQQSA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K59015387	BRD-K59015387-001-01-4	Broad Institute of MIT and Harvard	BRD-K59015387			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21-,22-/m1/s1	XYLRKRISJMFHFX-PZMMLYQQSA-N	473.25258587							100621
BRD-K77811363	LSM-13187		54649359	InChI=1S/C28H32FN3O3S/c1-28(2,3)36(35)32-17-21-16-23(27(34)31(4)5)30-26(25(21)24(32)13-14-33)20-8-6-7-19(15-20)18-9-11-22(29)12-10-18/h6-12,15-16,24,33H,13-14,17H2,1-5H3/t24-,36-/m1/s1	AGIZNZOEGDEWTD-GPJMPKJXSA-N	CN(C)C(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)c4ccc(F)cc4)[S@](=O)C(C)(C)C	BroadT	BRD-K77811363	BRD-K77811363-001-01-2	Broad Institute of MIT and Harvard	BRD-K77811363			CN(C)C(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1ccc(F)cc1)[S@](=O)C(C)(C)C	InChI=1S/C28H32FN3O3S/c1-28(2,3)36(35)32-17-21-16-23(27(34)31(4)5)30-26(25(21)24(32)13-14-33)20-8-6-7-19(15-20)18-9-11-22(29)12-10-18/h6-12,15-16,24,33H,13-14,17H2,1-5H3/t24-,36-/m1/s1	AGIZNZOEGDEWTD-GPJMPKJXSA-N	509.214840804							101825
CHEMBL2359872	LSM-13378	BRD-K80881992, SID131445847	54649448	InChI=1S/C29H34FN3O3S/c1-5-13-31-28(35)24-17-22-18-33(37(36)29(2,3)4)25(12-14-34)26(22)27(32-24)21-10-6-8-19(15-21)20-9-7-11-23(30)16-20/h6-11,15-17,25,34H,5,12-14,18H2,1-4H3,(H,31,35)/t25-,37-/m0/s1	FSCHPCZBUZXFPL-RSUXDYMJSA-N	CCCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)c4cccc(F)c4)[S@@](=O)C(C)(C)C	BroadT	BRD-K80881992	BRD-K80881992-001-01-9	Broad Institute of MIT and Harvard	BRD-K80881992			CCCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(F)c1)[S@@](=O)C(C)(C)C	InChI=1S/C29H34FN3O3S/c1-5-13-31-28(35)24-17-22-18-33(37(36)29(2,3)4)25(12-14-34)26(22)27(32-24)21-10-6-8-19(15-21)20-9-7-11-23(30)16-20/h6-11,15-17,25,34H,5,12-14,18H2,1-4H3,(H,31,35)/t25-,37-/m0/s1	FSCHPCZBUZXFPL-RSUXDYMJSA-N	523.230490868							102017
BRD-K37434447	LSM-10690		54649369	InChI=1S/C33H40N4O5S/c1-33(2,3)43(41)37-21-26-20-27(32(40)36-13-16-42-17-14-36)34-30(29(26)28(37)12-15-38)24-10-6-8-22(18-24)23-9-7-11-25(19-23)31(39)35(4)5/h6-11,18-20,28,38H,12-17,21H2,1-5H3/t28-,43-/m1/s1	FSDPWXFWDMXQOK-HOHRNCFUSA-N	CN(C)C(=O)c1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)N5CCOCC5	BroadT	BRD-K37434447	BRD-K37434447-001-01-2	Broad Institute of MIT and Harvard	BRD-K37434447			CN(C)C(=O)c1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)N1CCOCC1	InChI=1S/C33H40N4O5S/c1-33(2,3)43(41)37-21-26-20-27(32(40)36-13-16-42-17-14-36)34-30(29(26)28(37)12-15-38)24-10-6-8-22(18-24)23-9-7-11-25(19-23)31(39)35(4)5/h6-11,18-20,28,38H,12-17,21H2,1-5H3/t28-,43-/m1/s1	FSDPWXFWDMXQOK-HOHRNCFUSA-N	604.27194111							99311
BRD-K95367721	LSM-14275		54649528	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22+,23+/m0/s1	YDHXSWOLXDIZHC-MMORHLLASA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K95367721	BRD-K95367721-001-01-0	Broad Institute of MIT and Harvard	BRD-K95367721			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22+,23+/m0/s1	YDHXSWOLXDIZHC-MMORHLLASA-N	473.25258587							102929
CHEMBL2357938	LSM-12380	BRD-K64649040, SID131445727	54649328	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	JTCZGLOUSBJUER-JKSBSHDWSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K64649040	BRD-K64649040-001-01-2	Broad Institute of MIT and Harvard	BRD-K64649040			CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m0/s1	JTCZGLOUSBJUER-JKSBSHDWSA-N	552.0922335							101007
BRD-K82005490	LSM-13435		54649560	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19-,20+/m0/s1	DXVJXLONGZUJOS-YSIASYRMSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K82005490	BRD-K82005490-001-01-0	Broad Institute of MIT and Harvard	BRD-K82005490			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19-,20+/m0/s1	DXVJXLONGZUJOS-YSIASYRMSA-N	429.226371122							102075
BRD-K67433929	LSM-12534		54649307	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17-,23-/m0/s1	HABLAPXLJDLSLY-QQMNAOGKSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K67433929	BRD-K67433929-001-01-4	Broad Institute of MIT and Harvard	BRD-K67433929			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17-,23-/m0/s1	HABLAPXLJDLSLY-QQMNAOGKSA-N	488.195662782							101165
BRD-K92014112	LSM-14081		54649391	InChI=1S/C27H35N3O3S/c1-5-28-26(32)22-16-21-17-30(34(33)27(2,3)4)23(13-14-31)24(21)25(29-22)20-12-8-11-19(15-20)18-9-6-7-10-18/h8-9,11-12,15-16,23,31H,5-7,10,13-14,17H2,1-4H3,(H,28,32)/t23-,34-/m0/s1	YCIQMCUMVSMOGA-HUBRWUETSA-N	CCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)C4=CCCC4)[S@@](=O)C(C)(C)C	BroadT	BRD-K92014112	BRD-K92014112-001-01-8	Broad Institute of MIT and Harvard	BRD-K92014112			CCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)C1=CCCC1)[S@@](=O)C(C)(C)C	InChI=1S/C27H35N3O3S/c1-5-28-26(32)22-16-21-17-30(34(33)27(2,3)4)23(13-14-31)24(21)25(29-22)20-12-8-11-19(15-20)18-9-6-7-10-18/h8-9,11-12,15-16,23,31H,5-7,10,13-14,17H2,1-4H3,(H,28,32)/t23-,34-/m0/s1	YCIQMCUMVSMOGA-HUBRWUETSA-N	481.2399127							102735
BRD-K33591392	LSM-10464		54649530	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22+,23+/m0/s1	YDHXSWOLXDIZHC-QZWSAVPRSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K33591392	BRD-K33591392-001-01-8	Broad Institute of MIT and Harvard	BRD-K33591392			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22+,23+/m0/s1	YDHXSWOLXDIZHC-QZWSAVPRSA-N	473.25258587							99085
CHEMBL2140651	LSM-13022	BRD-K74951051, SID131445832	54649433	InChI=1S/C32H33FN4O3S/c1-32(2,3)41(40)37-20-25-17-27(31(39)35-19-24-8-4-5-12-26(24)33)36-30(29(25)28(37)13-15-38)22-10-6-9-21(16-22)23-11-7-14-34-18-23/h4-12,14,16-18,28,38H,13,15,19-20H2,1-3H3,(H,35,39)/t28-,41-/m0/s1	YOONRACURWGVIS-VELXTTODSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccnc4)c2[C@@H]1CCO)C(=O)NCc5ccccc5F	BroadT	BRD-K74951051	BRD-K74951051-001-01-6	Broad Institute of MIT and Harvard	BRD-K74951051			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccnc1)C(=O)NCc1ccccc1F	InChI=1S/C32H33FN4O3S/c1-32(2,3)41(40)37-20-25-17-27(31(39)35-19-24-8-4-5-12-26(24)33)36-30(29(25)28(37)13-15-38)22-10-6-9-21(16-22)23-11-7-14-34-18-23/h4-12,14,16-18,28,38H,13,15,19-20H2,1-3H3,(H,35,39)/t28-,41-/m0/s1	YOONRACURWGVIS-VELXTTODSA-N	572.225739846							101659
BRD-K34160774	LSM-10492		54649436	InChI=1S/C30H37N3O4S/c1-6-14-31-29(35)25-18-23-19-33(38(36)30(2,3)4)26(13-15-34)27(23)28(32-25)22-11-7-9-20(16-22)21-10-8-12-24(17-21)37-5/h7-12,16-18,26,34H,6,13-15,19H2,1-5H3,(H,31,35)/t26-,38-/m1/s1	JHQAUIJERWBYSS-UOBPVEMNSA-N	CCCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)c4cccc(OC)c4)[S@](=O)C(C)(C)C	BroadT	BRD-K34160774	BRD-K34160774-001-01-9	Broad Institute of MIT and Harvard	BRD-K34160774			CCCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(OC)c1)[S@](=O)C(C)(C)C	InChI=1S/C30H37N3O4S/c1-6-14-31-29(35)25-18-23-19-33(38(36)30(2,3)4)26(13-15-34)27(23)28(32-25)22-11-7-9-20(16-22)21-10-8-12-24(17-21)37-5/h7-12,16-18,26,34H,6,13-15,19H2,1-5H3,(H,31,35)/t26-,38-/m1/s1	JHQAUIJERWBYSS-UOBPVEMNSA-N	535.250477384							99113
BRD-K71387353	LSM-12794		54649313	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17-,23+/m0/s1	HABLAPXLJDLSLY-HKARXFIJSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K71387353	BRD-K71387353-001-01-1	Broad Institute of MIT and Harvard	BRD-K71387353			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17-,23+/m0/s1	HABLAPXLJDLSLY-HKARXFIJSA-N	488.195662782							101431
BRD-K44235509	LSM-11129		54649393	InChI=1S/C31H36FN3O3S/c1-31(2,3)39(38)35-20-24-19-26(30(37)34-15-5-4-6-16-34)33-29(28(24)27(35)14-17-36)23-9-7-8-22(18-23)21-10-12-25(32)13-11-21/h7-13,18-19,27,36H,4-6,14-17,20H2,1-3H3/t27-,39-/m0/s1	OMSQUWKQKRPVCL-XGFTYPEHSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(F)cc4)c2[C@@H]1CCO)C(=O)N5CCCCC5	BroadT	BRD-K44235509	BRD-K44235509-001-01-9	Broad Institute of MIT and Harvard	BRD-K44235509			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccc(F)cc1)C(=O)N1CCCCC1	InChI=1S/C31H36FN3O3S/c1-31(2,3)39(38)35-20-24-19-26(30(37)34-15-5-4-6-16-34)33-29(28(24)27(35)14-17-36)23-9-7-8-22(18-23)21-10-12-25(32)13-11-21/h7-13,18-19,27,36H,4-6,14-17,20H2,1-3H3/t27-,39-/m0/s1	OMSQUWKQKRPVCL-XGFTYPEHSA-N	549.246140932							99750
BRD-K69073546	LSM-12643		54649578	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19+,20-/m0/s1	WNHZFTQVONQUSH-UUXHPUJUSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K69073546	BRD-K69073546-001-01-9	Broad Institute of MIT and Harvard	BRD-K69073546			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19+,20-/m0/s1	WNHZFTQVONQUSH-UUXHPUJUSA-N	429.226371122							101276
BRD-K16778485	LSM-9443		54649395	InChI=1S/C31H38N4O4S/c1-7-32-29(37)25-18-24-19-35(40(39)31(2,3)4)26(14-15-36)27(24)28(33-25)22-12-8-10-20(16-22)21-11-9-13-23(17-21)30(38)34(5)6/h8-13,16-18,26,36H,7,14-15,19H2,1-6H3,(H,32,37)/t26-,40-/m0/s1	TYBSUWGSJMEJTO-YKPJRVAWSA-N	CCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)c4cccc(c4)C(=O)N(C)C)[S@@](=O)C(C)(C)C	BroadT	BRD-K16778485	BRD-K16778485-001-01-0	Broad Institute of MIT and Harvard	BRD-K16778485			CCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(c1)C(=O)N(C)C)[S@@](=O)C(C)(C)C	InChI=1S/C31H38N4O4S/c1-7-32-29(37)25-18-24-19-35(40(39)31(2,3)4)26(14-15-36)27(24)28(33-25)22-12-8-10-20(16-22)21-11-9-13-23(17-21)30(38)34(5)6/h8-13,16-18,26,36H,7,14-15,19H2,1-6H3,(H,32,37)/t26-,40-/m0/s1	TYBSUWGSJMEJTO-YKPJRVAWSA-N	562.261376426							98064
BRD-K36656125	LSM-10644		54649415	InChI=1S/C34H42N4O4S/c1-34(2,3)43(42)38-22-27-21-28(33(41)37-16-7-6-8-17-37)35-31(30(27)29(38)15-18-39)25-13-9-11-23(19-25)24-12-10-14-26(20-24)32(40)36(4)5/h9-14,19-21,29,39H,6-8,15-18,22H2,1-5H3/t29-,43-/m0/s1	KPHKCBNGEDAQEL-SDSPLPIBSA-N	CN(C)C(=O)c1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)N5CCCCC5	BroadT	BRD-K36656125	BRD-K36656125-001-01-0	Broad Institute of MIT and Harvard	BRD-K36656125			CN(C)C(=O)c1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)N1CCCCC1	InChI=1S/C34H42N4O4S/c1-34(2,3)43(42)38-22-27-21-28(33(41)37-16-7-6-8-17-37)35-31(30(27)29(38)15-18-39)25-13-9-11-23(19-25)24-12-10-14-26(20-24)32(40)36(4)5/h9-14,19-21,29,39H,6-8,15-18,22H2,1-5H3/t29-,43-/m0/s1	KPHKCBNGEDAQEL-SDSPLPIBSA-N	602.292676554							99265
BRD-K88176535	LSM-13843		56835570	InChI=1S/C27H30N2O5S/c1-27(2,3)35(33)29-16-20-15-22(26(31)32)28-25(24(20)23(29)11-12-30)19-9-5-7-17(13-19)18-8-6-10-21(14-18)34-4/h5-10,13-15,23,30H,11-12,16H2,1-4H3,(H,31,32)/t23-,35?/m0/s1	SQSYVIJPLUBFQG-MYJVBWMHSA-N	COc1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)S(=O)C(C)(C)C)C(=O)O	BroadT	BRD-K88176535	BRD-K88176535-001-03-6	Broad Institute of MIT and Harvard	BRD-K88176535			COc1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)S(=O)C(C)(C)C)C(O)=O	InChI=1S/C27H30N2O5S/c1-27(2,3)35(33)29-16-20-15-22(26(31)32)28-25(24(20)23(29)11-12-30)19-9-5-7-17(13-19)18-8-6-10-21(14-18)34-4/h5-10,13-15,23,30H,11-12,16H2,1-4H3,(H,31,32)/t23-,35?/m0/s1	SQSYVIJPLUBFQG-MYJVBWMHSA-N	494.18754277							102494
BRD-K65603160	LSM-12429		54649591	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16-,18+,19-/m0/s1	LYYREMJMDQKNES-WQCNXYOZSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)[C@@H](C)C(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K65603160	BRD-K65603160-001-01-2	Broad Institute of MIT and Harvard	BRD-K65603160			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)[C@@H](C)C(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16-,18+,19-/m0/s1	LYYREMJMDQKNES-WQCNXYOZSA-N	415.210721058							101056
BRD-K86786416	LSM-13748		54649541	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25+,26+/m0/s1	DIIJYNJFSHJSFY-BKJQLSFMSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@H]1O2)c4ccccc4)C#N	BroadT	BRD-K86786416	BRD-K86786416-001-01-2	Broad Institute of MIT and Harvard	BRD-K86786416			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25+,26+/m0/s1	DIIJYNJFSHJSFY-BKJQLSFMSA-N	505.25767125							102397
BRD-K66521855	LSM-12478		54649450	InChI=1S/C34H43N5O4S/c1-34(2,3)44(43)39-22-27-21-28(33(42)38-16-14-37(6)15-17-38)35-31(30(27)29(39)13-18-40)25-11-7-9-23(19-25)24-10-8-12-26(20-24)32(41)36(4)5/h7-12,19-21,29,40H,13-18,22H2,1-6H3/t29-,44-/m0/s1	JAGKHPQTGSVHMY-RGLUPAHUSA-N	CN(C)C(=O)c1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)N5CCN(C)CC5	BroadT	BRD-K66521855	BRD-K66521855-001-01-5	Broad Institute of MIT and Harvard	BRD-K66521855			CN(C)C(=O)c1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)N1CCN(C)CC1	InChI=1S/C34H43N5O4S/c1-34(2,3)44(43)39-22-27-21-28(33(42)38-16-14-37(6)15-17-38)35-31(30(27)29(39)13-18-40)25-11-7-9-23(19-25)24-10-8-12-26(20-24)32(41)36(4)5/h7-12,19-21,29,40H,13-18,22H2,1-6H3/t29-,44-/m0/s1	JAGKHPQTGSVHMY-RGLUPAHUSA-N	617.303575596							101109
BRD-K10558099	LSM-9062		54649297	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m0/s1	DYSXQKGXYVAXRN-JKSBSHDWSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K10558099	BRD-K10558099-001-01-0	Broad Institute of MIT and Harvard	BRD-K10558099			CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m0/s1	DYSXQKGXYVAXRN-JKSBSHDWSA-N	499.195248212							97683
CHEMBL2357052	LSM-12880	SID131445726, BRD-K72694250	54649327	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m0/s1	JTCZGLOUSBJUER-PNLZDCPESA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K72694250	BRD-K72694250-001-01-3	Broad Institute of MIT and Harvard	BRD-K72694250			CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m0/s1	JTCZGLOUSBJUER-PNLZDCPESA-N	552.0922335							101517
BRD-K77328005	LSM-13158		54649557	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19-,20+/m1/s1	DXVJXLONGZUJOS-RLLQIKCJSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K77328005	BRD-K77328005-001-01-1	Broad Institute of MIT and Harvard	BRD-K77328005			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19-,20+/m1/s1	DXVJXLONGZUJOS-RLLQIKCJSA-N	429.226371122							101796
BRD-K81156227	LSM-13391		54649470	InChI=1S/C33H39N5O3S/c1-33(2,3)42(41)38-22-27-20-28(32(40)35-13-16-37-14-4-5-15-37)36-31(30(27)29(38)12-17-39)26-11-7-10-25(19-26)24-9-6-8-23(18-24)21-34/h6-11,18-20,29,39H,4-5,12-17,22H2,1-3H3,(H,35,40)/t29-,42-/m1/s1	RNFNRXMTASYMQO-LIIBOVGXSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(c4)C#N)c2[C@H]1CCO)C(=O)NCCN5CCCC5	BroadT	BRD-K81156227	BRD-K81156227-001-01-2	Broad Institute of MIT and Harvard	BRD-K81156227			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccc(c1)C#N)C(=O)NCCN1CCCC1	InChI=1S/C33H39N5O3S/c1-33(2,3)42(41)38-22-27-20-28(32(40)35-13-16-37-14-4-5-15-37)36-31(30(27)29(38)12-17-39)26-11-7-10-25(19-26)24-9-6-8-23(18-24)21-34/h6-11,18-20,29,39H,4-5,12-17,22H2,1-3H3,(H,35,40)/t29-,42-/m1/s1	RNFNRXMTASYMQO-LIIBOVGXSA-N	585.277360848							102031
BRD-K19969523	LSM-9640		54649499	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21-,22+/m0/s1	XYLRKRISJMFHFX-ORDMVQLLSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K19969523	BRD-K19969523-001-01-6	Broad Institute of MIT and Harvard	BRD-K19969523			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21-,22+/m0/s1	XYLRKRISJMFHFX-ORDMVQLLSA-N	473.25258587							98261
BRD-K46343228	LSM-11255		54649464	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-24-9-6-13-29(17-24)43-4)38-33(32(28)31(39)14-15-40)27-12-7-11-26(18-27)25-10-5-8-23(16-25)20-36/h5-13,16-19,31,40H,14-15,21-22H2,1-4H3,(H,37,41)/t31-,44-/m0/s1	ARPJWHDFQDPYLK-JCFUSDQVSA-N	COc1cccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)c4cccc(c4)c5cccc(c5)C#N)[S@@](=O)C(C)(C)C)c1	BroadT	BRD-K46343228	BRD-K46343228-001-01-9	Broad Institute of MIT and Harvard	BRD-K46343228			COc1cccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)-c2cccc(c2)-c2cccc(c2)C#N)[S@@](=O)C(C)(C)C)c1	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-24-9-6-13-29(17-24)43-4)38-33(32(28)31(39)14-15-40)27-12-7-11-26(18-27)25-10-5-8-23(16-25)20-36/h5-13,16-19,31,40H,14-15,21-22H2,1-4H3,(H,37,41)/t31-,44-/m0/s1	ARPJWHDFQDPYLK-JCFUSDQVSA-N	608.245726362							99876
BRD-K68907515	LSM-12636		54649561	InChI=1S/C28H39N3O5/c1-30-18-24-23(34-3)11-10-21(36-24)12-15-35-26-20(17-29)8-7-9-22(26)27(33)31(2)19-28(16-25(30)32)13-5-4-6-14-28/h7-9,21,23-24H,4-6,10-16,18-19H2,1-3H3/t21-,23+,24+/m1/s1	NNLRSZHLKPFWRY-NHTMILBNSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CC4(CCCCC4)CC(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K68907515	BRD-K68907515-001-01-6	Broad Institute of MIT and Harvard	BRD-K68907515			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CC3(CCCCC3)CC(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C28H39N3O5/c1-30-18-24-23(34-3)11-10-21(36-24)12-15-35-26-20(17-29)8-7-9-22(26)27(33)31(2)19-28(16-25(30)32)13-5-4-6-14-28/h7-9,21,23-24H,4-6,10-16,18-19H2,1-3H3/t21-,23+,24+/m1/s1	NNLRSZHLKPFWRY-NHTMILBNSA-N	497.288971378							101269
BRD-K65862059	LSM-12445		54649424	InChI=1S/C31H38N4O4S/c1-31(2,3)40(39)35-19-24-18-25(30(38)34(6)7)32-28(27(24)26(35)15-16-36)23-10-8-9-22(17-23)20-11-13-21(14-12-20)29(37)33(4)5/h8-14,17-18,26,36H,15-16,19H2,1-7H3/t26-,40-/m1/s1	WMNVIWBOXVWRSQ-ZCQGCHJCSA-N	CN(C)C(=O)c1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)N(C)C	BroadT	BRD-K65862059	BRD-K65862059-001-01-8	Broad Institute of MIT and Harvard	BRD-K65862059			CN(C)C(=O)c1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)N(C)C	InChI=1S/C31H38N4O4S/c1-31(2,3)40(39)35-19-24-18-25(30(38)34(6)7)32-28(27(24)26(35)15-16-36)23-10-8-9-22(17-23)20-11-13-21(14-12-20)29(37)33(4)5/h8-14,17-18,26,36H,15-16,19H2,1-7H3/t26-,40-/m1/s1	WMNVIWBOXVWRSQ-ZCQGCHJCSA-N	562.261376426							101073
BRD-K93894185	LSM-14993		54649308	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23+/m1/s1	HABLAPXLJDLSLY-DGGJZMOXSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K93894185	BRD-K93894185-001-01-4	Broad Institute of MIT and Harvard	BRD-K93894185			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23+/m1/s1	HABLAPXLJDLSLY-DGGJZMOXSA-N	488.195662782							103649
BRD-K24106654	LSM-9885		54649550	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25-,26+/m0/s1	DIIJYNJFSHJSFY-ALNDXVPUSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@H]1O2)c4ccccc4)C#N	BroadT	BRD-K24106654	BRD-K24106654-001-01-9	Broad Institute of MIT and Harvard	BRD-K24106654			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25-,26+/m0/s1	DIIJYNJFSHJSFY-ALNDXVPUSA-N	505.25767125							98506
BRD-K62732912	LSM-12237		54649361	InChI=1S/C30H40N4O3S/c1-30(2,3)38(37)34-20-24-19-25(29(36)33-15-13-32(4)14-16-33)31-28(27(24)26(34)12-17-35)23-11-7-10-22(18-23)21-8-5-6-9-21/h7-8,10-11,18-19,26,35H,5-6,9,12-17,20H2,1-4H3/t26-,38-/m0/s1	VSPYGNDYHLSTDT-WTMVGVENSA-N	CN1CCN(CC1)C(=O)c2cc3CN([C@@H](CCO)c3c(n2)c4cccc(c4)C5=CCCC5)[S@@](=O)C(C)(C)C	BroadT	BRD-K62732912	BRD-K62732912-001-01-3	Broad Institute of MIT and Harvard	BRD-K62732912			CN1CCN(CC1)C(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)C1=CCCC1)[S@@](=O)C(C)(C)C	InChI=1S/C30H40N4O3S/c1-30(2,3)38(37)34-20-24-19-25(29(36)33-15-13-32(4)14-16-33)31-28(27(24)26(34)12-17-35)23-11-7-10-22(18-23)21-8-5-6-9-21/h7-8,10-11,18-19,26,35H,5-6,9,12-17,20H2,1-4H3/t26-,38-/m0/s1	VSPYGNDYHLSTDT-WTMVGVENSA-N	536.28211187							100863
BRD-K13118793	LSM-9214		54649482	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21-,22-/m1/s1	XYLRKRISJMFHFX-AFSNDHJISA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K13118793	BRD-K13118793-001-01-9	Broad Institute of MIT and Harvard	BRD-K13118793			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21-,22-/m1/s1	XYLRKRISJMFHFX-AFSNDHJISA-N	473.25258587							97835
BRD-K89676402	LSM-13960		54649479	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21+,22-/m1/s1	XYLRKRISJMFHFX-HTFPWXHTSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K89676402	BRD-K89676402-001-01-8	Broad Institute of MIT and Harvard	BRD-K89676402			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21+,22-/m1/s1	XYLRKRISJMFHFX-HTFPWXHTSA-N	473.25258587							102613
BRD-K51361049-001-01-0	LSM-11571	BRD-K51361049	54649465	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-24-9-6-13-29(17-24)43-4)38-33(32(28)31(39)14-15-40)27-12-7-11-26(18-27)25-10-5-8-23(16-25)20-36/h5-13,16-19,31,40H,14-15,21-22H2,1-4H3,(H,37,41)/t31-,44-/m1/s1	ARPJWHDFQDPYLK-VRESAINUSA-N	COc1cccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)c4cccc(c4)c5cccc(c5)C#N)[S@](=O)C(C)(C)C)c1	BroadT	BRD-K51361049	BRD-K51361049-001-01-0	Broad Institute of MIT and Harvard	BRD-K51361049			COc1cccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)-c2cccc(c2)-c2cccc(c2)C#N)[S@](=O)C(C)(C)C)c1	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-24-9-6-13-29(17-24)43-4)38-33(32(28)31(39)14-15-40)27-12-7-11-26(18-27)25-10-5-8-23(16-25)20-36/h5-13,16-19,31,40H,14-15,21-22H2,1-4H3,(H,37,41)/t31-,44-/m1/s1	ARPJWHDFQDPYLK-VRESAINUSA-N	608.245726362							100194
BRD-K78918239	LSM-13248		54649366	InChI=1S/C36H40N4O4S/c1-36(2,3)45(44)40-23-29-21-30(34(42)37-22-24-11-7-6-8-12-24)38-33(32(29)31(40)17-18-41)27-15-9-13-25(19-27)26-14-10-16-28(20-26)35(43)39(4)5/h6-16,19-21,31,41H,17-18,22-23H2,1-5H3,(H,37,42)/t31-,45-/m0/s1	LFBXRJWXGRWLKM-LPCUMCRCSA-N	CN(C)C(=O)c1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)NCc5ccccc5	BroadT	BRD-K78918239	BRD-K78918239-001-01-6	Broad Institute of MIT and Harvard	BRD-K78918239			CN(C)C(=O)c1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NCc1ccccc1	InChI=1S/C36H40N4O4S/c1-36(2,3)45(44)40-23-29-21-30(34(42)37-22-24-11-7-6-8-12-24)38-33(32(29)31(40)17-18-41)27-15-9-13-25(19-27)26-14-10-16-28(20-26)35(43)39(4)5/h6-16,19-21,31,41H,17-18,22-23H2,1-5H3,(H,37,42)/t31-,45-/m0/s1	LFBXRJWXGRWLKM-LPCUMCRCSA-N	624.27702649							101887
BRD-K36741877	LSM-10652		54649462	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-24-10-14-29(43-4)15-11-24)38-33(32(28)31(39)16-17-40)27-7-5-6-26(18-27)25-12-8-23(20-36)9-13-25/h5-15,18-19,31,40H,16-17,21-22H2,1-4H3,(H,37,41)/t31-,44-/m0/s1	JYXARMWTMOZTGK-JCFUSDQVSA-N	COc1ccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)c4cccc(c4)c5ccc(cc5)C#N)[S@@](=O)C(C)(C)C)cc1	BroadT	BRD-K36741877	BRD-K36741877-001-01-0	Broad Institute of MIT and Harvard	BRD-K36741877			COc1ccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)-c2cccc(c2)-c2ccc(cc2)C#N)[S@@](=O)C(C)(C)C)cc1	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-24-10-14-29(43-4)15-11-24)38-33(32(28)31(39)16-17-40)27-7-5-6-26(18-27)25-12-8-23(20-36)9-13-25/h5-15,18-19,31,40H,16-17,21-22H2,1-4H3,(H,37,41)/t31-,44-/m0/s1	JYXARMWTMOZTGK-JCFUSDQVSA-N	608.245726362							99273
BRD-K07481948	LSM-8872		54649555	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19+,20-/m1/s1	DXVJXLONGZUJOS-YZGWKJHDSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K07481948	BRD-K07481948-001-01-3	Broad Institute of MIT and Harvard	BRD-K07481948			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19+,20-/m1/s1	DXVJXLONGZUJOS-YZGWKJHDSA-N	429.226371122							97493
BRD-K96742509	LSM-14371		56835586	InChI=1S/C29H34N2O5S/c1-6-36-28(33)24-17-22-18-31(37(34)29(2,3)4)25(13-14-32)26(22)27(30-24)21-11-7-9-19(15-21)20-10-8-12-23(16-20)35-5/h7-12,15-17,25,32H,6,13-14,18H2,1-5H3/t25-,37?/m1/s1	DOYGEULPHZGEAI-JWPKJQAESA-N	CCOC(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)c4cccc(OC)c4)S(=O)C(C)(C)C	BroadT	BRD-K96742509	BRD-K96742509-001-03-7	Broad Institute of MIT and Harvard	BRD-K96742509			CCOC(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(OC)c1)S(=O)C(C)(C)C	InChI=1S/C29H34N2O5S/c1-6-36-28(33)24-17-22-18-31(37(34)29(2,3)4)25(13-14-32)26(22)27(30-24)21-11-7-9-19(15-21)20-10-8-12-23(16-20)35-5/h7-12,15-17,25,32H,6,13-14,18H2,1-5H3/t25-,37?/m1/s1	DOYGEULPHZGEAI-JWPKJQAESA-N	522.218842898							103025
BRD-K63521250	LSM-12295		54649342	InChI=1S/C28H37N3O4S/c1-28(2,3)36(34)31-18-22-17-23(27(33)29-13-15-35-4)30-26(25(22)24(31)12-14-32)21-11-7-10-20(16-21)19-8-5-6-9-19/h7-8,10-11,16-17,24,32H,5-6,9,12-15,18H2,1-4H3,(H,29,33)/t24-,36-/m0/s1	RKRNHXQJFJMDQI-TVYQXRCNSA-N	COCCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)C4=CCCC4)[S@@](=O)C(C)(C)C	BroadT	BRD-K63521250	BRD-K63521250-001-01-9	Broad Institute of MIT and Harvard	BRD-K63521250			COCCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)C1=CCCC1)[S@@](=O)C(C)(C)C	InChI=1S/C28H37N3O4S/c1-28(2,3)36(34)31-18-22-17-23(27(33)29-13-15-35-4)30-26(25(22)24(31)12-14-32)21-11-7-10-20(16-21)19-8-5-6-9-19/h7-8,10-11,16-17,24,32H,5-6,9,12-15,18H2,1-4H3,(H,29,33)/t24-,36-/m0/s1	RKRNHXQJFJMDQI-TVYQXRCNSA-N	511.250477384							131204
BRD-K61694653-001-01-9	LSM-35063	BRD-K61694653	54649314	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17-,23+/m1/s1	HABLAPXLJDLSLY-QZMQVMSPSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K61694653	BRD-K61694653-001-01-9	Broad Institute of MIT and Harvard	BRD-K61694653			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17-,23+/m1/s1	HABLAPXLJDLSLY-QZMQVMSPSA-N	488.195662782							123621
BRD-K85123694	LSM-13629		56835592	InChI=1S/C25H31N3O4S/c1-25(2,3)33(32)28-16-19-15-20(24(30)31)26-23(22(19)21(28)11-13-29)18-10-6-8-17(14-18)9-7-12-27(4)5/h6,8,10,14-15,21,29H,11-13,16H2,1-5H3,(H,30,31)/t21-,33?/m0/s1	DIAWSVIFYKTHOJ-KEDGCLKXSA-N	CN(C)CC#Cc1cccc(c1)c2nc(cc3CN([C@@H](CCO)c23)S(=O)C(C)(C)C)C(=O)O	BroadT	BRD-K85123694	BRD-K85123694-001-03-8	Broad Institute of MIT and Harvard	BRD-K85123694			CN(C)CC#Cc1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)S(=O)C(C)(C)C)C(O)=O	InChI=1S/C25H31N3O4S/c1-25(2,3)33(32)28-16-19-15-20(24(30)31)26-23(22(19)21(28)11-13-29)18-10-6-8-17(14-18)9-7-12-27(4)5/h6,8,10,14-15,21,29H,11-13,16H2,1-5H3,(H,30,31)/t21-,33?/m0/s1	DIAWSVIFYKTHOJ-KEDGCLKXSA-N	469.203527192							102276
BRD-K07796595	LSM-8898		54649503	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21+,22+/m0/s1	XYLRKRISJMFHFX-ADZZIANESA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K07796595	BRD-K07796595-001-01-0	Broad Institute of MIT and Harvard	BRD-K07796595			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21+,22+/m0/s1	XYLRKRISJMFHFX-ADZZIANESA-N	473.25258587							97519
BRD-K00541818	LSM-43443		54649442	InChI=1S/C30H35N3O3S/c1-5-10-21-13-9-14-23(17-21)28-27-24(20-33(26(27)15-16-34)37(36)30(2,3)4)18-25(32-28)29(35)31-19-22-11-7-6-8-12-22/h5-14,17-18,26,34H,15-16,19-20H2,1-4H3,(H,31,35)/b10-5+/t26-,37-/m0/s1	RNIGAGNWOYTJAX-SDNWWYRDSA-N	C\C=C\c1cccc(c1)c2nc(cc3CN([C@@H](CCO)c23)[S@@](=O)C(C)(C)C)C(=O)NCc4ccccc4	BroadT	BRD-K00541818	BRD-K00541818-001-01-8	Broad Institute of MIT and Harvard	BRD-K00541818			C\C=C\c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NCc1ccccc1	InChI=1S/C30H35N3O3S/c1-5-10-21-13-9-14-23(17-21)28-27-24(20-33(26(27)15-16-34)37(36)30(2,3)4)18-25(32-28)29(35)31-19-22-11-7-6-8-12-22/h5-14,17-18,26,34H,15-16,19-20H2,1-4H3,(H,31,35)/b10-5+/t26-,37-/m0/s1	RNIGAGNWOYTJAX-SDNWWYRDSA-N	517.2399127							
BRD-K28513938	LSM-10155		54649522	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22+,23-/m1/s1	YDHXSWOLXDIZHC-MYCSGDSKSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K28513938	BRD-K28513938-001-01-0	Broad Institute of MIT and Harvard	BRD-K28513938			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22+,23-/m1/s1	YDHXSWOLXDIZHC-MYCSGDSKSA-N	473.25258587							98776
BRD-K45850755	LSM-11221		54649544	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25+,26+/m1/s1	DIIJYNJFSHJSFY-OSNGURLVSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@@H]1O2)c4ccccc4)C#N	BroadT	BRD-K45850755	BRD-K45850755-001-01-5	Broad Institute of MIT and Harvard	BRD-K45850755			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25+,26+/m1/s1	DIIJYNJFSHJSFY-OSNGURLVSA-N	505.25767125							99842
CHEMBL2354559	LSM-12071	SID131445785, BRD-K60242118	54649386	InChI=1S/C29H32F3N3O4S/c1-28(2,3)40(38)35-16-21-15-23(27(37)33-17-29(30,31)32)34-26(25(21)24(35)12-13-36)20-7-5-6-19(14-20)18-8-10-22(39-4)11-9-18/h5-11,14-15,24,36H,12-13,16-17H2,1-4H3,(H,33,37)/t24-,40-/m0/s1	KLCJYDRSSANISD-KHMLVVKISA-N	COc1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)NCC(F)(F)F	BroadT	BRD-K60242118	BRD-K60242118-001-01-7	Broad Institute of MIT and Harvard	BRD-K60242118			COc1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NCC(F)(F)F	InChI=1S/C29H32F3N3O4S/c1-28(2,3)40(38)35-16-21-15-23(27(37)33-17-29(30,31)32)34-26(25(21)24(35)12-13-36)20-7-5-6-19(14-20)18-8-10-22(39-4)11-9-18/h5-11,14-15,24,36H,12-13,16-17H2,1-4H3,(H,33,37)/t24-,40-/m0/s1	KLCJYDRSSANISD-KHMLVVKISA-N	575.206561824							100697
BRD-K53674232	LSM-11695		54649489	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21-,22-/m0/s1	XYLRKRISJMFHFX-VJMBVAOUSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K53674232	BRD-K53674232-001-01-1	Broad Institute of MIT and Harvard	BRD-K53674232			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21-,22-/m0/s1	XYLRKRISJMFHFX-VJMBVAOUSA-N	473.25258587							100320
BRD-K42595694	LSM-11009		54649474	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21+,22+/m1/s1	XYLRKRISJMFHFX-UYIOJHFGSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K42595694	BRD-K42595694-001-01-3	Broad Institute of MIT and Harvard	BRD-K42595694			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21+,22+/m1/s1	XYLRKRISJMFHFX-UYIOJHFGSA-N	473.25258587							99630
BRD-K52225919	LSM-11625		54649547	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25-,26-/m1/s1	DIIJYNJFSHJSFY-OQUNMALSSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@H]1O2)c4ccccc4)C#N	BroadT	BRD-K52225919	BRD-K52225919-001-01-3	Broad Institute of MIT and Harvard	BRD-K52225919			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25-,26-/m1/s1	DIIJYNJFSHJSFY-OQUNMALSSA-N	505.25767125							100250
BRD-K76243603	LSM-13086		54649552	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25-,26-/m1/s1	DIIJYNJFSHJSFY-PZXVYJQKSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@H]1O2)c4ccccc4)C#N	BroadT	BRD-K76243603	BRD-K76243603-001-01-9	Broad Institute of MIT and Harvard	BRD-K76243603			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25-,26-/m1/s1	DIIJYNJFSHJSFY-PZXVYJQKSA-N	505.25767125							101724
CHEMBL3185432	LSM-11327	BRD-K47570616	54649347	InChI=1S/C28H29F4N3O3S/c1-27(2,3)39(38)35-15-20-14-22(26(37)33-16-28(30,31)32)34-25(24(20)23(35)10-11-36)19-8-4-6-17(12-19)18-7-5-9-21(29)13-18/h4-9,12-14,23,36H,10-11,15-16H2,1-3H3,(H,33,37)/t23-,39-/m1/s1	WZDAFVZLMKVKDS-QFGCMMRWSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(F)c4)c2[C@H]1CCO)C(=O)NCC(F)(F)F	BroadT	BRD-K47570616	BRD-K47570616-001-01-6	Broad Institute of MIT and Harvard	BRD-K47570616			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccc(F)c1)C(=O)NCC(F)(F)F	InChI=1S/C28H29F4N3O3S/c1-27(2,3)39(38)35-15-20-14-22(26(37)33-16-28(30,31)32)34-25(24(20)23(35)10-11-36)19-8-4-6-17(12-19)18-7-5-9-21(29)13-18/h4-9,12-14,23,36H,10-11,15-16H2,1-3H3,(H,33,37)/t23-,39-/m1/s1	WZDAFVZLMKVKDS-QFGCMMRWSA-N	563.186575308							99948
CHEMBL2361787	LSM-13210	BRD-K78133682, SID131445853	54649454	InChI=1S/C29H32F3N3O4S/c1-28(2,3)40(38)35-16-21-15-23(27(37)33-17-29(30,31)32)34-26(25(21)24(35)11-12-36)20-9-5-7-18(13-20)19-8-6-10-22(14-19)39-4/h5-10,13-15,24,36H,11-12,16-17H2,1-4H3,(H,33,37)/t24-,40-/m0/s1	ZACPEVQRHPQJRQ-KHMLVVKISA-N	COc1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)NCC(F)(F)F	BroadT	BRD-K78133682	BRD-K78133682-001-01-4	Broad Institute of MIT and Harvard	BRD-K78133682			COc1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NCC(F)(F)F	InChI=1S/C29H32F3N3O4S/c1-28(2,3)40(38)35-16-21-15-23(27(37)33-17-29(30,31)32)34-26(25(21)24(35)11-12-36)20-9-5-7-18(13-20)19-8-6-10-22(14-19)39-4/h5-10,13-15,24,36H,11-12,16-17H2,1-4H3,(H,33,37)/t24-,40-/m0/s1	ZACPEVQRHPQJRQ-KHMLVVKISA-N	575.206561824							101848
BRD-K11068374	LSM-9103		54649430	InChI=1S/C33H35N5O3S/c1-33(2,3)42(41)38-20-26-16-28(32(40)37-13-11-22-7-4-5-8-25(22)19-37)36-31(30(26)29(38)12-14-39)24-10-6-9-23(15-24)27-17-34-21-35-18-27/h4-10,15-18,21,29,39H,11-14,19-20H2,1-3H3/t29-,42-/m1/s1	YCXBLOUOQVZMFH-LIIBOVGXSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cncnc4)c2[C@H]1CCO)C(=O)N5CCc6ccccc6C5	BroadT	BRD-K11068374	BRD-K11068374-001-01-5	Broad Institute of MIT and Harvard	BRD-K11068374			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cncnc1)C(=O)N1CCc2ccccc2C1	InChI=1S/C33H35N5O3S/c1-33(2,3)42(41)38-20-26-16-28(32(40)37-13-11-22-7-4-5-8-25(22)19-37)36-31(30(26)29(38)12-14-39)24-10-6-9-23(15-24)27-17-34-21-35-18-27/h4-10,15-18,21,29,39H,11-14,19-20H2,1-3H3/t29-,42-/m1/s1	YCXBLOUOQVZMFH-LIIBOVGXSA-N	581.24606072							97724
BRD-K54636101	LSM-11747		54649570	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19+,20+/m0/s1	WNHZFTQVONQUSH-SMMRIJLZSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K54636101	BRD-K54636101-001-01-7	Broad Institute of MIT and Harvard	BRD-K54636101			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19+,20+/m0/s1	WNHZFTQVONQUSH-SMMRIJLZSA-N	429.226371122							100372
BRD-K60391168	LSM-12079		54649397	InChI=1S/C29H34FN3O4S/c1-29(2,3)38(36)33-18-22-17-24(28(35)31-12-14-37-4)32-27(26(22)25(33)11-13-34)21-9-5-7-19(15-21)20-8-6-10-23(30)16-20/h5-10,15-17,25,34H,11-14,18H2,1-4H3,(H,31,35)/t25-,38-/m0/s1	RYACMGXBLHGDBX-KUPGCWECSA-N	COCCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)c4cccc(F)c4)[S@@](=O)C(C)(C)C	BroadT	BRD-K60391168	BRD-K60391168-001-01-1	Broad Institute of MIT and Harvard	BRD-K60391168			COCCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(F)c1)[S@@](=O)C(C)(C)C	InChI=1S/C29H34FN3O4S/c1-29(2,3)38(36)33-18-22-17-24(28(35)31-12-14-37-4)32-27(26(22)25(33)11-13-34)21-9-5-7-19(15-21)20-8-6-10-23(30)16-20/h5-10,15-17,25,34H,11-14,18H2,1-4H3,(H,31,35)/t25-,38-/m0/s1	RYACMGXBLHGDBX-KUPGCWECSA-N	539.225405488							100705
CHEMBL3183442	LSM-10359	BRD-K31829694	54649367	InChI=1S/C33H34N4O5S/c1-33(2,3)43(40)37-19-25-16-26(32(39)35-17-21-9-10-28-29(14-21)42-20-41-28)36-31(30(25)27(37)11-13-38)23-7-4-6-22(15-23)24-8-5-12-34-18-24/h4-10,12,14-16,18,27,38H,11,13,17,19-20H2,1-3H3,(H,35,39)/t27-,43-/m1/s1	JSQFWOWYOCZIMF-ACXULAKISA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccnc4)c2[C@H]1CCO)C(=O)NCc5ccc6OCOc6c5	BroadT	BRD-K31829694	BRD-K31829694-001-01-9	Broad Institute of MIT and Harvard	BRD-K31829694			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccnc1)C(=O)NCc1ccc2OCOc2c1	InChI=1S/C33H34N4O5S/c1-33(2,3)43(40)37-19-25-16-26(32(39)35-17-21-9-10-28-29(14-21)42-20-41-28)36-31(30(25)27(37)11-13-38)23-7-4-6-22(15-23)24-8-5-12-34-18-24/h4-10,12,14-16,18,27,38H,11,13,17,19-20H2,1-3H3,(H,35,39)/t27-,43-/m1/s1	JSQFWOWYOCZIMF-ACXULAKISA-N	598.224990918							98980
BRD-K29736077	LSM-10231		54649435	InChI=1S/C30H37N3O4S/c1-6-14-31-29(35)25-18-23-19-33(38(36)30(2,3)4)26(13-15-34)27(23)28(32-25)22-11-7-9-20(16-22)21-10-8-12-24(17-21)37-5/h7-12,16-18,26,34H,6,13-15,19H2,1-5H3,(H,31,35)/t26-,38-/m0/s1	JHQAUIJERWBYSS-WTMVGVENSA-N	CCCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)c4cccc(OC)c4)[S@@](=O)C(C)(C)C	BroadT	BRD-K29736077	BRD-K29736077-001-01-7	Broad Institute of MIT and Harvard	BRD-K29736077			CCCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(OC)c1)[S@@](=O)C(C)(C)C	InChI=1S/C30H37N3O4S/c1-6-14-31-29(35)25-18-23-19-33(38(36)30(2,3)4)26(13-15-34)27(23)28(32-25)22-11-7-9-20(16-22)21-10-8-12-24(17-21)37-5/h7-12,16-18,26,34H,6,13-15,19H2,1-5H3,(H,31,35)/t26-,38-/m0/s1	JHQAUIJERWBYSS-WTMVGVENSA-N	535.250477384							98852
BRD-K05713002	LSM-8764		54649553	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19+,20+/m1/s1	DXVJXLONGZUJOS-HOJAQTOUSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K05713002	BRD-K05713002-001-01-4	Broad Institute of MIT and Harvard	BRD-K05713002			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19+,20+/m1/s1	DXVJXLONGZUJOS-HOJAQTOUSA-N	429.226371122							97385
BRD-K49441594	LSM-11434		54649445	InChI=1S/C33H39N5O3S/c1-33(2,3)42(41)38-22-27-20-28(32(40)35-14-17-37-15-4-5-16-37)36-31(30(27)29(38)13-18-39)26-8-6-7-25(19-26)24-11-9-23(21-34)10-12-24/h6-12,19-20,29,39H,4-5,13-18,22H2,1-3H3,(H,35,40)/t29-,42-/m1/s1	KRBOYVJOHNAAFC-LIIBOVGXSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(cc4)C#N)c2[C@H]1CCO)C(=O)NCCN5CCCC5	BroadT	BRD-K49441594	BRD-K49441594-001-01-4	Broad Institute of MIT and Harvard	BRD-K49441594			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccc(cc1)C#N)C(=O)NCCN1CCCC1	InChI=1S/C33H39N5O3S/c1-33(2,3)42(41)38-22-27-20-28(32(40)35-14-17-37-15-4-5-16-37)36-31(30(27)29(38)13-18-39)26-8-6-7-25(19-26)24-11-9-23(21-34)10-12-24/h6-12,19-20,29,39H,4-5,13-18,22H2,1-3H3,(H,35,40)/t29-,42-/m1/s1	KRBOYVJOHNAAFC-LIIBOVGXSA-N	585.277360848							100055
BRD-K97473407	LSM-14419		54649443	InChI=1S/C29H35N3O4S/c1-29(2,3)37(35)32-18-22-17-24(28(34)31(4)5)30-27(26(22)25(32)13-14-33)21-11-7-9-19(15-21)20-10-8-12-23(16-20)36-6/h7-12,15-17,25,33H,13-14,18H2,1-6H3/t25-,37-/m1/s1	FLZDWOWASDTEHK-TWEZTRHFSA-N	COc1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)N(C)C	BroadT	BRD-K97473407	BRD-K97473407-001-01-5	Broad Institute of MIT and Harvard	BRD-K97473407			COc1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)N(C)C	InChI=1S/C29H35N3O4S/c1-29(2,3)37(35)32-18-22-17-24(28(34)31(4)5)30-27(26(22)25(32)13-14-33)21-11-7-9-19(15-21)20-10-8-12-23(16-20)36-6/h7-12,15-17,25,33H,13-14,18H2,1-6H3/t25-,37-/m1/s1	FLZDWOWASDTEHK-TWEZTRHFSA-N	521.23482732							103074
BRD-K61484514	LSM-12154		54649582	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19-,20+/m1/s1	WNHZFTQVONQUSH-VUBSUSDNSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K61484514	BRD-K61484514-001-01-4	Broad Institute of MIT and Harvard	BRD-K61484514			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19-,20+/m1/s1	WNHZFTQVONQUSH-VUBSUSDNSA-N	429.226371122							100780
BRD-K41721791	LSM-10964		54649404	InChI=1S/C29H35N3O4S/c1-6-30-28(34)24-17-22-18-32(37(35)29(2,3)4)25(13-14-33)26(22)27(31-24)21-11-7-9-19(15-21)20-10-8-12-23(16-20)36-5/h7-12,15-17,25,33H,6,13-14,18H2,1-5H3,(H,30,34)/t25-,37-/m1/s1	YHQIULRSPQCSKT-TWEZTRHFSA-N	CCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)c4cccc(OC)c4)[S@](=O)C(C)(C)C	BroadT	BRD-K41721791	BRD-K41721791-001-01-8	Broad Institute of MIT and Harvard	BRD-K41721791			CCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(OC)c1)[S@](=O)C(C)(C)C	InChI=1S/C29H35N3O4S/c1-6-30-28(34)24-17-22-18-32(37(35)29(2,3)4)25(13-14-33)26(22)27(31-24)21-11-7-9-19(15-21)20-10-8-12-23(16-20)36-5/h7-12,15-17,25,33H,6,13-14,18H2,1-5H3,(H,30,34)/t25-,37-/m1/s1	YHQIULRSPQCSKT-TWEZTRHFSA-N	521.23482732							99585
BRD-K07568447	LSM-8879		54649569	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19-,20-/m1/s1	WNHZFTQVONQUSH-MCYKXBRJSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K07568447	BRD-K07568447-001-01-3	Broad Institute of MIT and Harvard	BRD-K07568447			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19-,20-/m1/s1	WNHZFTQVONQUSH-MCYKXBRJSA-N	429.226371122							97500
BRD-K41763142	LSM-10967		54649510	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22-,23+/m1/s1	YDHXSWOLXDIZHC-JPPXYHIZSA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K41763142	BRD-K41763142-001-01-6	Broad Institute of MIT and Harvard	BRD-K41763142			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22-,23+/m1/s1	YDHXSWOLXDIZHC-JPPXYHIZSA-N	473.25258587							99588
BRD-K65065275	LSM-12401		54649576	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19+,20-/m0/s1	WNHZFTQVONQUSH-ZSXHRAQDSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K65065275	BRD-K65065275-001-01-6	Broad Institute of MIT and Harvard	BRD-K65065275			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19+,20-/m0/s1	WNHZFTQVONQUSH-ZSXHRAQDSA-N	429.226371122							101028
BRD-K36313546	LSM-10622		54649399	InChI=1S/C33H36N4O4S/c1-33(2,3)42(40)37-21-26-19-28(32(39)35-20-22-7-5-10-27(17-22)41-4)36-31(30(26)29(37)13-16-38)25-9-6-8-24(18-25)23-11-14-34-15-12-23/h5-12,14-15,17-19,29,38H,13,16,20-21H2,1-4H3,(H,35,39)/t29-,42-/m1/s1	GIUILNXHKTVBSA-LIIBOVGXSA-N	COc1cccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)c4cccc(c4)c5ccncc5)[S@](=O)C(C)(C)C)c1	BroadT	BRD-K36313546	BRD-K36313546-001-01-9	Broad Institute of MIT and Harvard	BRD-K36313546			COc1cccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)-c2cccc(c2)-c2ccncc2)[S@](=O)C(C)(C)C)c1	InChI=1S/C33H36N4O4S/c1-33(2,3)42(40)37-21-26-19-28(32(39)35-20-22-7-5-10-27(17-22)41-4)36-31(30(26)29(37)13-16-38)25-9-6-8-24(18-25)23-11-14-34-15-12-23/h5-12,14-15,17-19,29,38H,13,16,20-21H2,1-4H3,(H,35,39)/t29-,42-/m1/s1	GIUILNXHKTVBSA-LIIBOVGXSA-N	584.245726362							99243
BRD-K69174517	LSM-12646		54649504	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21+,22+/m0/s1	XYLRKRISJMFHFX-HRZDXHFQSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K69174517	BRD-K69174517-001-01-0	Broad Institute of MIT and Harvard	BRD-K69174517			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21+,22+/m0/s1	XYLRKRISJMFHFX-HRZDXHFQSA-N	473.25258587							101280
CHEMBL2357864	LSM-14102	BRD-K92523103, SID134962299	56835565	InChI=1S/C35H48N4O4S/c1-35(2,3)44(42)39-25-29-24-30(34(41)36-16-8-17-38-18-21-43-22-19-38)37-33(32(29)31(39)15-20-40)28-14-7-13-27(23-28)12-6-11-26-9-4-5-10-26/h7,13-14,23-24,26,31,40H,4-5,8-11,15-22,25H2,1-3H3,(H,36,41)/t31-,44?/m0/s1	OLTIGOGRQNQZFN-RQPUMPGKSA-N	CC(C)(C)S(=O)N1Cc2cc(nc(c3cccc(c3)C#CCC4CCCC4)c2[C@@H]1CCO)C(=O)NCCCN5CCOCC5	BroadT	BRD-K92523103	BRD-K92523103-001-03-5	Broad Institute of MIT and Harvard	BRD-K92523103			CC(C)(C)S(=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)C#CCC1CCCC1)C(=O)NCCCN1CCOCC1	InChI=1S/C35H48N4O4S/c1-35(2,3)44(42)39-25-29-24-30(34(41)36-16-8-17-38-18-21-43-22-19-38)37-33(32(29)31(39)15-20-40)28-14-7-13-27(23-28)12-6-11-26-9-4-5-10-26/h7,13-14,23-24,26,31,40H,4-5,8-11,15-22,25H2,1-3H3,(H,36,41)/t31-,44?/m0/s1	OLTIGOGRQNQZFN-RQPUMPGKSA-N	620.339626746							102756
BRD-K93210686	LSM-14146		54649376	InChI=1S/C29H34FN3O3S/c1-5-14-31-28(35)24-17-22-18-33(37(36)29(2,3)4)25(13-15-34)26(22)27(32-24)21-8-6-7-20(16-21)19-9-11-23(30)12-10-19/h6-12,16-17,25,34H,5,13-15,18H2,1-4H3,(H,31,35)/t25-,37-/m1/s1	HVPPUANJBVTFMA-TWEZTRHFSA-N	CCCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)c4ccc(F)cc4)[S@](=O)C(C)(C)C	BroadT	BRD-K93210686	BRD-K93210686-001-01-7	Broad Institute of MIT and Harvard	BRD-K93210686			CCCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1ccc(F)cc1)[S@](=O)C(C)(C)C	InChI=1S/C29H34FN3O3S/c1-5-14-31-28(35)24-17-22-18-33(37(36)29(2,3)4)25(13-15-34)26(22)27(32-24)21-8-6-7-20(16-21)19-9-11-23(30)12-10-19/h6-12,16-17,25,34H,5,13-15,18H2,1-4H3,(H,31,35)/t25-,37-/m1/s1	HVPPUANJBVTFMA-TWEZTRHFSA-N	523.230490868							102800
BRD-K16331350	LSM-9411		54649516	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22+,23-/m0/s1	YDHXSWOLXDIZHC-GUNTVATQSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K16331350	BRD-K16331350-001-01-0	Broad Institute of MIT and Harvard	BRD-K16331350			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22+,23-/m0/s1	YDHXSWOLXDIZHC-GUNTVATQSA-N	473.25258587							98032
BRD-K18925740	LSM-9562		54649494	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21-,22-/m0/s1	XYLRKRISJMFHFX-WVNMJAPOSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K18925740	BRD-K18925740-001-01-6	Broad Institute of MIT and Harvard	BRD-K18925740			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21-,22-/m0/s1	XYLRKRISJMFHFX-WVNMJAPOSA-N	473.25258587							98183
BRD-K33620583	LSM-10467		54649476	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21+,22+/m1/s1	XYLRKRISJMFHFX-QOVBHOHNSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K33620583	BRD-K33620583-001-01-4	Broad Institute of MIT and Harvard	BRD-K33620583			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21+,22+/m1/s1	XYLRKRISJMFHFX-QOVBHOHNSA-N	473.25258587							99088
BRD-K45409613	LSM-11195		54649505	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21-,22-/m1/s1	XYLRKRISJMFHFX-IXXBJLTKSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K45409613	BRD-K45409613-001-01-2	Broad Institute of MIT and Harvard	BRD-K45409613			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21-,22-/m1/s1	XYLRKRISJMFHFX-IXXBJLTKSA-N	473.25258587							99816
BRD-K92137277	LSM-14089		54649303	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15+,19-/m1/s1	GUZASBNVYSIPQO-ZRGWGRIASA-N	CO[C@H](CN(C)C(=O)C1CC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K92137277	BRD-K92137277-001-01-8	Broad Institute of MIT and Harvard	BRD-K92137277			CO[C@H](CN(C)C(=O)C1CC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15+,19-/m1/s1	GUZASBNVYSIPQO-ZRGWGRIASA-N	459.234491134							102743
BRD-K79841204	LSM-13301		54649566	InChI=1S/C28H39N3O5/c1-30-18-24-23(34-3)11-10-21(36-24)12-15-35-26-20(17-29)8-7-9-22(26)27(33)31(2)19-28(16-25(30)32)13-5-4-6-14-28/h7-9,21,23-24H,4-6,10-16,18-19H2,1-3H3/t21-,23+,24+/m0/s1	NNLRSZHLKPFWRY-QPTUXGOLSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CC4(CCCCC4)CC(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K79841204	BRD-K79841204-001-01-0	Broad Institute of MIT and Harvard	BRD-K79841204			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CC3(CCCCC3)CC(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C28H39N3O5/c1-30-18-24-23(34-3)11-10-21(36-24)12-15-35-26-20(17-29)8-7-9-22(26)27(33)31(2)19-28(16-25(30)32)13-5-4-6-14-28/h7-9,21,23-24H,4-6,10-16,18-19H2,1-3H3/t21-,23+,24+/m0/s1	NNLRSZHLKPFWRY-QPTUXGOLSA-N	497.288971378							101940
BRD-K54432046	LSM-11734		54649411	InChI=1S/C28H32FN3O3S/c1-5-30-27(34)23-16-21-17-32(36(35)28(2,3)4)24(12-13-33)25(21)26(31-23)20-10-6-8-18(14-20)19-9-7-11-22(29)15-19/h6-11,14-16,24,33H,5,12-13,17H2,1-4H3,(H,30,34)/t24-,36-/m1/s1	NQAKFRRPCXCRFS-GPJMPKJXSA-N	CCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)c4cccc(F)c4)[S@](=O)C(C)(C)C	BroadT	BRD-K54432046	BRD-K54432046-001-01-9	Broad Institute of MIT and Harvard	BRD-K54432046			CCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(F)c1)[S@](=O)C(C)(C)C	InChI=1S/C28H32FN3O3S/c1-5-30-27(34)23-16-21-17-32(36(35)28(2,3)4)24(12-13-33)25(21)26(31-23)20-10-6-8-18(14-20)19-9-7-11-22(29)15-19/h6-11,14-16,24,33H,5,12-13,17H2,1-4H3,(H,30,34)/t24-,36-/m1/s1	NQAKFRRPCXCRFS-GPJMPKJXSA-N	509.214840804							100359
BRD-K68085828	LSM-12576		54649421	InChI=1S/C33H40N4O4S/c1-33(2,3)42(41)37-20-25-19-27(31(39)34-26-10-7-11-26)35-30(29(25)28(37)16-17-38)24-9-6-8-23(18-24)21-12-14-22(15-13-21)32(40)36(4)5/h6,8-9,12-15,18-19,26,28,38H,7,10-11,16-17,20H2,1-5H3,(H,34,39)/t28-,42-/m0/s1	XRIKJANOQKUWJP-PJVIOAIDSA-N	CN(C)C(=O)c1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)NC5CCC5	BroadT	BRD-K68085828	BRD-K68085828-001-01-3	Broad Institute of MIT and Harvard	BRD-K68085828			CN(C)C(=O)c1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NC1CCC1	InChI=1S/C33H40N4O4S/c1-33(2,3)42(41)37-20-25-19-27(31(39)34-26-10-7-11-26)35-30(29(25)28(37)16-17-38)24-9-6-8-23(18-24)21-12-14-22(15-13-21)32(40)36(4)5/h6,8-9,12-15,18-19,26,28,38H,7,10-11,16-17,20H2,1-5H3,(H,34,39)/t28-,42-/m0/s1	XRIKJANOQKUWJP-PJVIOAIDSA-N	588.27702649							101207
BRD-K50799972	LSM-11526		54649381	InChI=1S/C33H36N4O4S/c1-33(2,3)42(40)37-21-25-19-27(32(39)35-20-22-12-15-34-16-13-22)36-31(30(25)28(37)14-17-38)24-9-7-8-23(18-24)26-10-5-6-11-29(26)41-4/h5-13,15-16,18-19,28,38H,14,17,20-21H2,1-4H3,(H,35,39)/t28-,42-/m0/s1	VTKOTAQLGFRVGB-PJVIOAIDSA-N	COc1ccccc1c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)NCc5ccncc5	BroadT	BRD-K50799972	BRD-K50799972-001-01-3	Broad Institute of MIT and Harvard	BRD-K50799972			COc1ccccc1-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NCc1ccncc1	InChI=1S/C33H36N4O4S/c1-33(2,3)42(40)37-21-25-19-27(32(39)35-20-22-12-15-34-16-13-22)36-31(30(25)28(37)14-17-38)24-9-7-8-23(18-24)26-10-5-6-11-29(26)41-4/h5-13,15-16,18-19,28,38H,14,17,20-21H2,1-4H3,(H,35,39)/t28-,42-/m0/s1	VTKOTAQLGFRVGB-PJVIOAIDSA-N	584.245726362							100149
BRD-K03354784	LSM-8643		54649513	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22+,23-/m0/s1	YDHXSWOLXDIZHC-IJGBCQEOSA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K03354784	BRD-K03354784-001-01-3	Broad Institute of MIT and Harvard	BRD-K03354784			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22+,23-/m0/s1	YDHXSWOLXDIZHC-IJGBCQEOSA-N	473.25258587							97264
BRD-K04753511	LSM-8723		54649429	InChI=1S/C33H35N5O3S/c1-33(2,3)42(41)38-20-26-16-28(32(40)37-13-11-22-7-4-5-8-25(22)19-37)36-31(30(26)29(38)12-14-39)24-10-6-9-23(15-24)27-17-34-21-35-18-27/h4-10,15-18,21,29,39H,11-14,19-20H2,1-3H3/t29-,42-/m0/s1	YCXBLOUOQVZMFH-WHAQVLKXSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cncnc4)c2[C@@H]1CCO)C(=O)N5CCc6ccccc6C5	BroadT	BRD-K04753511	BRD-K04753511-001-01-5	Broad Institute of MIT and Harvard	BRD-K04753511			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cncnc1)C(=O)N1CCc2ccccc2C1	InChI=1S/C33H35N5O3S/c1-33(2,3)42(41)38-20-26-16-28(32(40)37-13-11-22-7-4-5-8-25(22)19-37)36-31(30(26)29(38)12-14-39)24-10-6-9-23(15-24)27-17-34-21-35-18-27/h4-10,15-18,21,29,39H,11-14,19-20H2,1-3H3/t29-,42-/m0/s1	YCXBLOUOQVZMFH-WHAQVLKXSA-N	581.24606072							97344
BRD-K84567604	LSM-13597		54649338	InChI=1S/C34H36N4O3S/c1-34(2,3)42(41)38-22-28-19-29(33(40)37-16-13-23-8-4-5-9-27(23)21-37)36-32(31(28)30(38)14-17-39)25-11-6-10-24(18-25)26-12-7-15-35-20-26/h4-12,15,18-20,30,39H,13-14,16-17,21-22H2,1-3H3/t30-,42-/m1/s1	MWNPJFSJRUIJTE-SBEKKQRLSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccnc4)c2[C@H]1CCO)C(=O)N5CCc6ccccc6C5	BroadT	BRD-K84567604	BRD-K84567604-001-01-0	Broad Institute of MIT and Harvard	BRD-K84567604			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccnc1)C(=O)N1CCc2ccccc2C1	InChI=1S/C34H36N4O3S/c1-34(2,3)42(41)38-22-28-19-29(33(40)37-16-13-23-8-4-5-9-27(23)21-37)36-32(31(28)30(38)14-17-39)25-11-6-10-24(18-25)26-12-7-15-35-20-26/h4-12,15,18-20,30,39H,13-14,16-17,21-22H2,1-3H3/t30-,42-/m1/s1	MWNPJFSJRUIJTE-SBEKKQRLSA-N	580.250811742							102241
BRD-K39507473	LSM-10829		54649409	InChI=1S/C31H34N4O4S/c1-31(2,3)40(38)35-20-25-18-26(30(37)34-12-15-39-16-13-34)33-29(28(25)27(35)11-14-36)24-6-4-5-23(17-24)22-9-7-21(19-32)8-10-22/h4-10,17-18,27,36H,11-16,20H2,1-3H3/t27-,40-/m0/s1	IMNSYTYGXZBRLR-PDBZVODSSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(cc4)C#N)c2[C@@H]1CCO)C(=O)N5CCOCC5	BroadT	BRD-K39507473	BRD-K39507473-001-01-0	Broad Institute of MIT and Harvard	BRD-K39507473			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccc(cc1)C#N)C(=O)N1CCOCC1	InChI=1S/C31H34N4O4S/c1-31(2,3)40(38)35-20-25-18-26(30(37)34-12-15-39-16-13-34)33-29(28(25)27(35)11-14-36)24-6-4-5-23(17-24)22-9-7-21(19-32)8-10-22/h4-10,17-18,27,36H,11-16,20H2,1-3H3/t27-,40-/m0/s1	IMNSYTYGXZBRLR-PDBZVODSSA-N	558.230076298							99450
BRD-K92685052	LSM-14109		54649392	InChI=1S/C31H36FN3O3S/c1-31(2,3)39(38)35-20-24-19-26(30(37)34-15-5-4-6-16-34)33-29(28(24)27(35)14-17-36)23-9-7-8-22(18-23)21-10-12-25(32)13-11-21/h7-13,18-19,27,36H,4-6,14-17,20H2,1-3H3/t27-,39-/m1/s1	OMSQUWKQKRPVCL-GAZSAWIUSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(F)cc4)c2[C@H]1CCO)C(=O)N5CCCCC5	BroadT	BRD-K92685052	BRD-K92685052-001-01-7	Broad Institute of MIT and Harvard	BRD-K92685052			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccc(F)cc1)C(=O)N1CCCCC1	InChI=1S/C31H36FN3O3S/c1-31(2,3)39(38)35-20-24-19-26(30(37)34-15-5-4-6-16-34)33-29(28(24)27(35)14-17-36)23-9-7-8-22(18-23)21-10-12-25(32)13-11-21/h7-13,18-19,27,36H,4-6,14-17,20H2,1-3H3/t27-,39-/m1/s1	OMSQUWKQKRPVCL-GAZSAWIUSA-N	549.246140932							102763
BRD-K99628932	LSM-14548		54649543	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25-,26-/m0/s1	DIIJYNJFSHJSFY-LCGRTSHQSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@@H]1O2)c4ccccc4)C#N	BroadT	BRD-K99628932	BRD-K99628932-001-02-4	Broad Institute of MIT and Harvard	BRD-K99628932			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25-,26-/m0/s1	DIIJYNJFSHJSFY-LCGRTSHQSA-N	505.25767125							103203
BRD-K96586144	LSM-14354		54649306	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15-,19+/m0/s1	GUZASBNVYSIPQO-YZVOILCLSA-N	CO[C@H](CN(C)C(=O)C1CC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K96586144	BRD-K96586144-001-01-3	Broad Institute of MIT and Harvard	BRD-K96586144			CO[C@H](CN(C)C(=O)C1CC1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15-,19+/m0/s1	GUZASBNVYSIPQO-YZVOILCLSA-N	459.234491134							103008
BRD-K83675132	LSM-13545		54649372	InChI=1S/C36H41N5O3S/c1-36(2,3)45(44)41-23-29-20-31(35(43)38-30-14-17-40(24-30)22-25-9-5-4-6-10-25)39-34(33(29)32(41)15-18-42)27-12-7-11-26(19-27)28-13-8-16-37-21-28/h4-13,16,19-21,30,32,42H,14-15,17-18,22-24H2,1-3H3,(H,38,43)/t30-,32+,45+/m1/s1	OXCAKDYULKMTMJ-AECJBDNTSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccnc4)c2[C@@H]1CCO)C(=O)N[C@@H]5CCN(Cc6ccccc6)C5	BroadT	BRD-K83675132	BRD-K83675132-001-01-3	Broad Institute of MIT and Harvard	BRD-K83675132			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccnc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	InChI=1S/C36H41N5O3S/c1-36(2,3)45(44)41-23-29-20-31(35(43)38-30-14-17-40(24-30)22-25-9-5-4-6-10-25)39-34(33(29)32(41)15-18-42)27-12-7-11-26(19-27)28-13-8-16-37-21-28/h4-13,16,19-21,30,32,42H,14-15,17-18,22-24H2,1-3H3,(H,38,43)/t30-,32+,45+/m1/s1	OXCAKDYULKMTMJ-AECJBDNTSA-N	623.293010912							102187
BRD-K95631838	LSM-14293		54649526	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22-,23-/m1/s1	YDHXSWOLXDIZHC-QREOPNFFSA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K95631838	BRD-K95631838-001-01-9	Broad Institute of MIT and Harvard	BRD-K95631838			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22-,23-/m1/s1	YDHXSWOLXDIZHC-QREOPNFFSA-N	473.25258587							102947
BRD-K87182158	LSM-13776		54649407	InChI=1S/C31H37FN4O3S/c1-31(2,3)40(39)36-20-23-19-26(30(38)35-15-13-34(4)14-16-35)33-29(28(23)27(36)12-17-37)22-9-7-8-21(18-22)24-10-5-6-11-25(24)32/h5-11,18-19,27,37H,12-17,20H2,1-4H3/t27-,40-/m1/s1	SXBHHBYKOFATQA-KSTXALNGSA-N	CN1CCN(CC1)C(=O)c2cc3CN([C@H](CCO)c3c(n2)c4cccc(c4)c5ccccc5F)[S@](=O)C(C)(C)C	BroadT	BRD-K87182158	BRD-K87182158-001-01-5	Broad Institute of MIT and Harvard	BRD-K87182158			CN1CCN(CC1)C(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1ccccc1F)[S@](=O)C(C)(C)C	InChI=1S/C31H37FN4O3S/c1-31(2,3)40(39)36-20-23-19-26(30(38)35-15-13-34(4)14-16-35)33-29(28(23)27(36)12-17-37)22-9-7-8-21(18-22)24-10-5-6-11-25(24)32/h5-11,18-19,27,37H,12-17,20H2,1-4H3/t27-,40-/m1/s1	SXBHHBYKOFATQA-KSTXALNGSA-N	564.257039974							102425
BRD-K57206606	LSM-43480		54649394	InChI=1S/C29H34N4O3S/c1-5-7-20-8-6-9-22(16-20)27-26-23(19-33(25(26)12-15-34)37(36)29(2,3)4)17-24(32-27)28(35)31-18-21-10-13-30-14-11-21/h5-11,13-14,16-17,25,34H,12,15,18-19H2,1-4H3,(H,31,35)/b7-5+/t25-,37-/m0/s1	DWWWKKNSQALGRT-AEUINSAUSA-N	C\C=C\c1cccc(c1)c2nc(cc3CN([C@@H](CCO)c23)[S@@](=O)C(C)(C)C)C(=O)NCc4ccncc4	BroadT	BRD-K57206606	BRD-K57206606-001-01-6	Broad Institute of MIT and Harvard	BRD-K57206606			C\C=C\c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NCc1ccncc1	InChI=1S/C29H34N4O3S/c1-5-7-20-8-6-9-22(16-20)27-26-23(19-33(25(26)12-15-34)37(36)29(2,3)4)17-24(32-27)28(35)31-18-21-10-13-30-14-11-21/h5-11,13-14,16-17,25,34H,12,15,18-19H2,1-4H3,(H,31,35)/b7-5+/t25-,37-/m0/s1	DWWWKKNSQALGRT-AEUINSAUSA-N	518.235161678							
CHEMBL2357707	LSM-13116	BRD-K76636716, SID131445711	54649312	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23-/m0/s1	HABLAPXLJDLSLY-MFEFFIJZSA-N	CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K76636716	BRD-K76636716-001-01-8	Broad Institute of MIT and Harvard	BRD-K76636716			CO[C@@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23-/m0/s1	HABLAPXLJDLSLY-MFEFFIJZSA-N	488.195662782							101754
BRD-K49685495	LSM-11449		54649355	InChI=1S/C32H39N3O4S/c1-32(2,3)40(38)35-21-24-20-26(31(37)34-16-8-5-9-17-34)33-30(29(24)27(35)15-18-36)23-12-10-11-22(19-23)25-13-6-7-14-28(25)39-4/h6-7,10-14,19-20,27,36H,5,8-9,15-18,21H2,1-4H3/t27-,40-/m0/s1	FUQOGNZPPRJWQM-PDBZVODSSA-N	COc1ccccc1c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)N5CCCCC5	BroadT	BRD-K49685495	BRD-K49685495-001-01-6	Broad Institute of MIT and Harvard	BRD-K49685495			COc1ccccc1-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)N1CCCCC1	InChI=1S/C32H39N3O4S/c1-32(2,3)40(38)35-21-24-20-26(31(37)34-16-8-5-9-17-34)33-30(29(24)27(35)15-18-36)23-12-10-11-22(19-23)25-13-6-7-14-28(25)39-4/h6-7,10-14,19-20,27,36H,5,8-9,15-18,21H2,1-4H3/t27-,40-/m0/s1	FUQOGNZPPRJWQM-PDBZVODSSA-N	561.266127448							100070
BRD-K79781870	LSM-13298		54649362	InChI=1S/C30H40N4O3S/c1-30(2,3)38(37)34-20-24-19-25(29(36)33-15-13-32(4)14-16-33)31-28(27(24)26(34)12-17-35)23-11-7-10-22(18-23)21-8-5-6-9-21/h7-8,10-11,18-19,26,35H,5-6,9,12-17,20H2,1-4H3/t26-,38-/m1/s1	VSPYGNDYHLSTDT-UOBPVEMNSA-N	CN1CCN(CC1)C(=O)c2cc3CN([C@H](CCO)c3c(n2)c4cccc(c4)C5=CCCC5)[S@](=O)C(C)(C)C	BroadT	BRD-K79781870	BRD-K79781870-001-01-1	Broad Institute of MIT and Harvard	BRD-K79781870			CN1CCN(CC1)C(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)C1=CCCC1)[S@](=O)C(C)(C)C	InChI=1S/C30H40N4O3S/c1-30(2,3)38(37)34-20-24-19-25(29(36)33-15-13-32(4)14-16-33)31-28(27(24)26(34)12-17-35)23-11-7-10-22(18-23)21-8-5-6-9-21/h7-8,10-11,18-19,26,35H,5-6,9,12-17,20H2,1-4H3/t26-,38-/m1/s1	VSPYGNDYHLSTDT-UOBPVEMNSA-N	536.28211187							101937
BRD-K19167425	LSM-9580		54649425	InChI=1S/C31H36FN3O3S/c1-31(2,3)39(38)35-20-23-19-26(30(37)34-15-7-4-8-16-34)33-29(28(23)27(35)14-17-36)22-11-9-10-21(18-22)24-12-5-6-13-25(24)32/h5-6,9-13,18-19,27,36H,4,7-8,14-17,20H2,1-3H3/t27-,39-/m1/s1	LDKZHRSADHZSDU-GAZSAWIUSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccccc4F)c2[C@H]1CCO)C(=O)N5CCCCC5	BroadT	BRD-K19167425	BRD-K19167425-001-01-6	Broad Institute of MIT and Harvard	BRD-K19167425			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccccc1F)C(=O)N1CCCCC1	InChI=1S/C31H36FN3O3S/c1-31(2,3)39(38)35-20-23-19-26(30(37)34-15-7-4-8-16-34)33-29(28(23)27(35)14-17-36)22-11-9-10-21(18-22)24-12-5-6-13-25(24)32/h5-6,9-13,18-19,27,36H,4,7-8,14-17,20H2,1-3H3/t27-,39-/m1/s1	LDKZHRSADHZSDU-GAZSAWIUSA-N	549.246140932							98201
BRD-K05961870	LSM-43445		54649354	InChI=1S/C31H37N3O4S/c1-6-8-21-9-7-10-23(17-21)29-28-24(20-34(27(28)15-16-35)39(37)31(2,3)4)18-26(33-29)30(36)32-19-22-11-13-25(38-5)14-12-22/h6-14,17-18,27,35H,15-16,19-20H2,1-5H3,(H,32,36)/b8-6+/t27-,39-/m0/s1	CHUUKIFYUQSEQP-WXUURRTBSA-N	COc1ccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)c4cccc(\C=C\C)c4)[S@@](=O)C(C)(C)C)cc1	BroadT	BRD-K05961870	BRD-K05961870-001-01-8	Broad Institute of MIT and Harvard	BRD-K05961870			COc1ccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)-c2cccc(\C=C\C)c2)[S@@](=O)C(C)(C)C)cc1	InChI=1S/C31H37N3O4S/c1-6-8-21-9-7-10-23(17-21)29-28-24(20-34(27(28)15-16-35)39(37)31(2,3)4)18-26(33-29)30(36)32-19-22-11-13-25(38-5)14-12-22/h6-14,17-18,27,35H,15-16,19-20H2,1-5H3,(H,32,36)/b8-6+/t27-,39-/m0/s1	CHUUKIFYUQSEQP-WXUURRTBSA-N	547.250477384							
BRD-K36928794	LSM-10662		54649385	InChI=1S/C29H32F3N3O4S/c1-28(2,3)40(38)35-16-21-15-23(27(37)33-17-29(30,31)32)34-26(25(21)24(35)12-13-36)20-7-5-6-19(14-20)18-8-10-22(39-4)11-9-18/h5-11,14-15,24,36H,12-13,16-17H2,1-4H3,(H,33,37)/t24-,40-/m1/s1	KLCJYDRSSANISD-MMVPYHRJSA-N	COc1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)NCC(F)(F)F	BroadT	BRD-K36928794	BRD-K36928794-001-01-3	Broad Institute of MIT and Harvard	BRD-K36928794			COc1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)NCC(F)(F)F	InChI=1S/C29H32F3N3O4S/c1-28(2,3)40(38)35-16-21-15-23(27(37)33-17-29(30,31)32)34-26(25(21)24(35)12-13-36)20-7-5-6-19(14-20)18-8-10-22(39-4)11-9-18/h5-11,14-15,24,36H,12-13,16-17H2,1-4H3,(H,33,37)/t24-,40-/m1/s1	KLCJYDRSSANISD-MMVPYHRJSA-N	575.206561824							99283
BRD-K60477597	LSM-12084		54649585	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16+,18+,19-/m1/s1	LYYREMJMDQKNES-TWKWOARYSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)[C@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K60477597	BRD-K60477597-001-01-9	Broad Institute of MIT and Harvard	BRD-K60477597			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)[C@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16+,18+,19-/m1/s1	LYYREMJMDQKNES-TWKWOARYSA-N	415.210721058							100710
BRD-K25164076	LSM-9959		54649311	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23-/m1/s1	HABLAPXLJDLSLY-SAHWJRBASA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K25164076	BRD-K25164076-001-01-7	Broad Institute of MIT and Harvard	BRD-K25164076			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23-/m1/s1	HABLAPXLJDLSLY-SAHWJRBASA-N	488.195662782							98580
BRD-K49480198	LSM-11437		54649301	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15-,19-/m1/s1	GUZASBNVYSIPQO-SPYBWZPUSA-N	CO[C@H](CN(C)C(=O)C1CC1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K49480198	BRD-K49480198-001-01-2	Broad Institute of MIT and Harvard	BRD-K49480198			CO[C@H](CN(C)C(=O)C1CC1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15-,19-/m1/s1	GUZASBNVYSIPQO-SPYBWZPUSA-N	459.234491134							100058
BRD-K55194575	LSM-11773		54649455	InChI=1S/C36H40N4O4S/c1-36(2,3)45(44)40-23-29-21-30(34(42)37-22-24-10-7-6-8-11-24)38-33(32(29)31(40)18-19-41)28-13-9-12-27(20-28)25-14-16-26(17-15-25)35(43)39(4)5/h6-17,20-21,31,41H,18-19,22-23H2,1-5H3,(H,37,42)/t31-,45-/m0/s1	WJAYFAVILWHXQO-LPCUMCRCSA-N	CN(C)C(=O)c1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)NCc5ccccc5	BroadT	BRD-K55194575	BRD-K55194575-001-01-3	Broad Institute of MIT and Harvard	BRD-K55194575			CN(C)C(=O)c1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NCc1ccccc1	InChI=1S/C36H40N4O4S/c1-36(2,3)45(44)40-23-29-21-30(34(42)37-22-24-10-7-6-8-11-24)38-33(32(29)31(40)18-19-41)28-13-9-12-27(20-28)25-14-16-26(17-15-25)35(43)39(4)5/h6-17,20-21,31,41H,18-19,22-23H2,1-5H3,(H,37,42)/t31-,45-/m0/s1	WJAYFAVILWHXQO-LPCUMCRCSA-N	624.27702649							100398
BRD-K01478916	LSM-8525		54649333	InChI=1S/C30H34FN3O4S/c1-30(2,3)39(37)34-19-22-18-25(29(36)33-12-15-38-16-13-33)32-28(27(22)26(34)11-14-35)21-8-6-7-20(17-21)23-9-4-5-10-24(23)31/h4-10,17-18,26,35H,11-16,19H2,1-3H3/t26-,39-/m0/s1	WDBGCMALGZQRLR-BNCXPCJNSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccccc4F)c2[C@@H]1CCO)C(=O)N5CCOCC5	BroadT	BRD-K01478916	BRD-K01478916-001-01-3	Broad Institute of MIT and Harvard	BRD-K01478916			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccccc1F)C(=O)N1CCOCC1	InChI=1S/C30H34FN3O4S/c1-30(2,3)39(37)34-19-22-18-25(29(36)33-12-15-38-16-13-33)32-28(27(22)26(34)11-14-35)21-8-6-7-20(17-21)23-9-4-5-10-24(23)31/h4-10,17-18,26,35H,11-16,19H2,1-3H3/t26-,39-/m0/s1	WDBGCMALGZQRLR-BNCXPCJNSA-N	551.225405488							97146
BRD-K13079805	LSM-9211		54649577	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19-,20-/m0/s1	WNHZFTQVONQUSH-UHMOLFJZSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K13079805	BRD-K13079805-001-01-9	Broad Institute of MIT and Harvard	BRD-K13079805			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19-,20-/m0/s1	WNHZFTQVONQUSH-UHMOLFJZSA-N	429.226371122							97832
BRD-K95666496	LSM-14296		54649384	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-23-11-13-29(43-4)14-12-23)38-33(32(28)31(39)15-16-40)27-10-6-9-26(18-27)25-8-5-7-24(17-25)20-36/h5-14,17-19,31,40H,15-16,21-22H2,1-4H3,(H,37,41)/t31-,44-/m1/s1	NEVKZQRLDPRUMB-VRESAINUSA-N	COc1ccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)c4cccc(c4)c5cccc(c5)C#N)[S@](=O)C(C)(C)C)cc1	BroadT	BRD-K95666496	BRD-K95666496-001-01-8	Broad Institute of MIT and Harvard	BRD-K95666496			COc1ccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)-c2cccc(c2)-c2cccc(c2)C#N)[S@](=O)C(C)(C)C)cc1	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-23-11-13-29(43-4)14-12-23)38-33(32(28)31(39)15-16-40)27-10-6-9-26(18-27)25-8-5-7-24(17-25)20-36/h5-14,17-19,31,40H,15-16,21-22H2,1-4H3,(H,37,41)/t31-,44-/m1/s1	NEVKZQRLDPRUMB-VRESAINUSA-N	608.245726362							102950
BRD-K57061210	LSM-11887		54649299	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22+/m1/s1	DYSXQKGXYVAXRN-YVHKJVDXSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K57061210	BRD-K57061210-001-01-3	Broad Institute of MIT and Harvard	BRD-K57061210			CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22+/m1/s1	DYSXQKGXYVAXRN-YVHKJVDXSA-N	499.195248212							100513
BRD-K80976693	LSM-13384		54649514	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22-,23-/m0/s1	YDHXSWOLXDIZHC-RETDLFGGSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K80976693	BRD-K80976693-001-01-9	Broad Institute of MIT and Harvard	BRD-K80976693			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22-,23-/m0/s1	YDHXSWOLXDIZHC-RETDLFGGSA-N	473.25258587							102023
BRD-K63374765	LSM-12285		54649363	InChI=1S/C34H35N5O3S/c1-34(2,3)43(42)39-22-28-20-29(33(41)37-17-13-23-11-15-36-16-12-23)38-32(31(28)30(39)14-18-40)27-6-4-5-26(19-27)25-9-7-24(21-35)8-10-25/h4-12,15-16,19-20,30,40H,13-14,17-18,22H2,1-3H3,(H,37,41)/t30-,43-/m1/s1	SEESJXJXYIRQQP-QHKNHCAJSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(cc4)C#N)c2[C@H]1CCO)C(=O)NCCc5ccncc5	BroadT	BRD-K63374765	BRD-K63374765-001-01-1	Broad Institute of MIT and Harvard	BRD-K63374765			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccc(cc1)C#N)C(=O)NCCc1ccncc1	InChI=1S/C34H35N5O3S/c1-34(2,3)43(42)39-22-28-20-29(33(41)37-17-13-23-11-15-36-16-12-23)38-32(31(28)30(39)14-18-40)27-6-4-5-26(19-27)25-9-7-24(21-35)8-10-25/h4-12,15-16,19-20,30,40H,13-14,17-18,22H2,1-3H3,(H,37,41)/t30-,43-/m1/s1	SEESJXJXYIRQQP-QHKNHCAJSA-N	593.24606072							100911
BRD-K20099363	LSM-9651		54649452	InChI=1S/C32H36N4O3S/c1-32(2,3)40(39)36-21-26-19-27(31(38)35-15-5-4-6-16-35)34-30(29(26)28(36)14-17-37)25-9-7-8-24(18-25)23-12-10-22(20-33)11-13-23/h7-13,18-19,28,37H,4-6,14-17,21H2,1-3H3/t28-,40-/m0/s1	XBUYKONZLQYBJN-KJKFISAKSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(cc4)C#N)c2[C@@H]1CCO)C(=O)N5CCCCC5	BroadT	BRD-K20099363	BRD-K20099363-001-01-2	Broad Institute of MIT and Harvard	BRD-K20099363			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccc(cc1)C#N)C(=O)N1CCCCC1	InChI=1S/C32H36N4O3S/c1-32(2,3)40(39)36-21-26-19-27(31(38)35-15-5-4-6-16-35)34-30(29(26)28(36)14-17-37)25-9-7-8-24(18-25)23-12-10-22(20-33)11-13-23/h7-13,18-19,28,37H,4-6,14-17,21H2,1-3H3/t28-,40-/m0/s1	XBUYKONZLQYBJN-KJKFISAKSA-N	556.250811742							98272
BRD-K71631401	LSM-12813		54649439	InChI=1S/C32H35N5O3S/c1-32(2,3)41(40)37-21-26-20-27(31(39)35-17-9-22-7-13-33-14-8-22)36-30(29(26)28(37)12-18-38)25-6-4-5-24(19-25)23-10-15-34-16-11-23/h4-8,10-11,13-16,19-20,28,38H,9,12,17-18,21H2,1-3H3,(H,35,39)/t28-,41-/m1/s1	UNXBJJPJSXSVQI-GIEABIOQSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccncc4)c2[C@H]1CCO)C(=O)NCCc5ccncc5	BroadT	BRD-K71631401	BRD-K71631401-001-01-4	Broad Institute of MIT and Harvard	BRD-K71631401			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccncc1)C(=O)NCCc1ccncc1	InChI=1S/C32H35N5O3S/c1-32(2,3)41(40)37-21-26-20-27(31(39)35-17-9-22-7-13-33-14-8-22)36-30(29(26)28(37)12-18-38)25-6-4-5-24(19-25)23-10-15-34-16-11-23/h4-8,10-11,13-16,19-20,28,38H,9,12,17-18,21H2,1-3H3,(H,35,39)/t28-,41-/m1/s1	UNXBJJPJSXSVQI-GIEABIOQSA-N	569.24606072							101450
BRD-K30695296	LSM-10274		56835597	InChI=1S/C29H34FN3O4S/c1-29(2,3)38(36)33-18-22-17-24(28(35)31-12-14-37-4)32-27(26(22)25(33)11-13-34)21-9-5-7-19(15-21)20-8-6-10-23(30)16-20/h5-10,15-17,25,34H,11-14,18H2,1-4H3,(H,31,35)/t25-,38?/m0/s1	RYACMGXBLHGDBX-RAMHPWKZSA-N	COCCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)c4cccc(F)c4)S(=O)C(C)(C)C	BroadT	BRD-K30695296	BRD-K30695296-001-02-5	Broad Institute of MIT and Harvard	BRD-K30695296			COCCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(F)c1)S(=O)C(C)(C)C	InChI=1S/C29H34FN3O4S/c1-29(2,3)38(36)33-18-22-17-24(28(35)31-12-14-37-4)32-27(26(22)25(33)11-13-34)21-9-5-7-19(15-21)20-8-6-10-23(30)16-20/h5-10,15-17,25,34H,11-14,18H2,1-4H3,(H,31,35)/t25-,38?/m0/s1	RYACMGXBLHGDBX-RAMHPWKZSA-N	539.225405488							98895
BRD-K35691352	LSM-10569		56835566	InChI=1S/C27H30N2O5S/c1-27(2,3)35(33)29-16-20-15-22(26(31)32)28-25(24(20)23(29)11-12-30)19-9-5-7-17(13-19)18-8-6-10-21(14-18)34-4/h5-10,13-15,23,30H,11-12,16H2,1-4H3,(H,31,32)/t23-,35?/m1/s1	SQSYVIJPLUBFQG-MMHRDOBHSA-N	COc1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)S(=O)C(C)(C)C)C(=O)O	BroadT	BRD-K35691352	BRD-K35691352-001-03-8	Broad Institute of MIT and Harvard	BRD-K35691352			COc1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)S(=O)C(C)(C)C)C(O)=O	InChI=1S/C27H30N2O5S/c1-27(2,3)35(33)29-16-20-15-22(26(31)32)28-25(24(20)23(29)11-12-30)19-9-5-7-17(13-19)18-8-6-10-21(14-18)34-4/h5-10,13-15,23,30H,11-12,16H2,1-4H3,(H,31,32)/t23-,35?/m1/s1	SQSYVIJPLUBFQG-MMHRDOBHSA-N	494.18754277							99190
CHEMBL2362426	LSM-11189	BRD-K45340761, SID131445745	54649346	InChI=1S/C32H33FN4O3S/c1-32(2,3)41(40)37-20-23-18-27(31(39)35-19-24-11-6-7-15-34-24)36-30(29(23)28(37)14-16-38)22-10-8-9-21(17-22)25-12-4-5-13-26(25)33/h4-13,15,17-18,28,38H,14,16,19-20H2,1-3H3,(H,35,39)/t28-,41-/m1/s1	CHKDYTPBRLZLPJ-GIEABIOQSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccccc4F)c2[C@H]1CCO)C(=O)NCc5ccccn5	BroadT	BRD-K45340761	BRD-K45340761-001-01-9	Broad Institute of MIT and Harvard	BRD-K45340761			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccccc1F)C(=O)NCc1ccccn1	InChI=1S/C32H33FN4O3S/c1-32(2,3)41(40)37-20-23-18-27(31(39)35-19-24-11-6-7-15-34-24)36-30(29(23)28(37)14-16-38)22-10-8-9-21(17-22)25-12-4-5-13-26(25)33/h4-13,15,17-18,28,38H,14,16,19-20H2,1-3H3,(H,35,39)/t28-,41-/m1/s1	CHKDYTPBRLZLPJ-GIEABIOQSA-N	572.225739846							99810
BRD-K37014875	LSM-10668		54649542	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25+,26+/m1/s1	DIIJYNJFSHJSFY-IWOFBJJHSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@@H]1O2)c4ccccc4)C#N	BroadT	BRD-K37014875	BRD-K37014875-001-01-3	Broad Institute of MIT and Harvard	BRD-K37014875			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25+,26+/m1/s1	DIIJYNJFSHJSFY-IWOFBJJHSA-N	505.25767125							99289
CHEMBL2359309	LSM-12674	BRD-K69586787, SID131445725	54649326	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	JTCZGLOUSBJUER-HYFFOGBASA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K69586787	BRD-K69586787-001-01-8	Broad Institute of MIT and Harvard	BRD-K69586787			CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	JTCZGLOUSBJUER-HYFFOGBASA-N	552.0922335							101308
CHEMBL2361187	LSM-12338	SID131445862, BRD-K64034190	54649463	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-24-10-14-29(43-4)15-11-24)38-33(32(28)31(39)16-17-40)27-7-5-6-26(18-27)25-12-8-23(20-36)9-13-25/h5-15,18-19,31,40H,16-17,21-22H2,1-4H3,(H,37,41)/t31-,44-/m1/s1	JYXARMWTMOZTGK-VRESAINUSA-N	COc1ccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)c4cccc(c4)c5ccc(cc5)C#N)[S@](=O)C(C)(C)C)cc1	BroadT	BRD-K64034190	BRD-K64034190-001-01-5	Broad Institute of MIT and Harvard	BRD-K64034190			COc1ccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)-c2cccc(c2)-c2ccc(cc2)C#N)[S@](=O)C(C)(C)C)cc1	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-24-10-14-29(43-4)15-11-24)38-33(32(28)31(39)16-17-40)27-7-5-6-26(18-27)25-12-8-23(20-36)9-13-25/h5-15,18-19,31,40H,16-17,21-22H2,1-4H3,(H,37,41)/t31-,44-/m1/s1	JYXARMWTMOZTGK-VRESAINUSA-N	608.245726362							100965
BRD-K97554220	LSM-14422		54649423	InChI=1S/C31H38N4O4S/c1-31(2,3)40(39)35-19-24-18-25(30(38)34(6)7)32-28(27(24)26(35)15-16-36)23-10-8-9-22(17-23)20-11-13-21(14-12-20)29(37)33(4)5/h8-14,17-18,26,36H,15-16,19H2,1-7H3/t26-,40-/m0/s1	WMNVIWBOXVWRSQ-YKPJRVAWSA-N	CN(C)C(=O)c1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)N(C)C	BroadT	BRD-K97554220	BRD-K97554220-001-01-7	Broad Institute of MIT and Harvard	BRD-K97554220			CN(C)C(=O)c1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)N(C)C	InChI=1S/C31H38N4O4S/c1-31(2,3)40(39)35-19-24-18-25(30(38)34(6)7)32-28(27(24)26(35)15-16-36)23-10-8-9-22(17-23)20-11-13-21(14-12-20)29(37)33(4)5/h8-14,17-18,26,36H,15-16,19H2,1-7H3/t26-,40-/m0/s1	WMNVIWBOXVWRSQ-YKPJRVAWSA-N	562.261376426							103077
BRD-K36471847	LSM-10632		54649549	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25+,26+/m0/s1	DIIJYNJFSHJSFY-IHBRBHLJSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@H]1O2)c4ccccc4)C#N	BroadT	BRD-K36471847	BRD-K36471847-001-01-1	Broad Institute of MIT and Harvard	BRD-K36471847			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25+,26+/m0/s1	DIIJYNJFSHJSFY-IHBRBHLJSA-N	505.25767125							99253
BRD-K50358328	LSM-11495		54649360	InChI=1S/C28H32FN3O3S/c1-28(2,3)36(35)32-17-21-16-23(27(34)31(4)5)30-26(25(21)24(32)13-14-33)20-8-6-7-19(15-20)18-9-11-22(29)12-10-18/h6-12,15-16,24,33H,13-14,17H2,1-5H3/t24-,36-/m0/s1	AGIZNZOEGDEWTD-TVYQXRCNSA-N	CN(C)C(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)c4ccc(F)cc4)[S@@](=O)C(C)(C)C	BroadT	BRD-K50358328	BRD-K50358328-001-01-9	Broad Institute of MIT and Harvard	BRD-K50358328			CN(C)C(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1ccc(F)cc1)[S@@](=O)C(C)(C)C	InChI=1S/C28H32FN3O3S/c1-28(2,3)36(35)32-17-21-16-23(27(34)31(4)5)30-26(25(21)24(32)13-14-33)20-8-6-7-19(15-20)18-9-11-22(29)12-10-18/h6-12,15-16,24,33H,13-14,17H2,1-5H3/t24-,36-/m0/s1	AGIZNZOEGDEWTD-TVYQXRCNSA-N	509.214840804							100116
BRD-K43460092	LSM-11072		54649483	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21-,22-/m0/s1	XYLRKRISJMFHFX-CPNAEOBWSA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K43460092	BRD-K43460092-001-01-7	Broad Institute of MIT and Harvard	BRD-K43460092			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21-,22-/m0/s1	XYLRKRISJMFHFX-CPNAEOBWSA-N	473.25258587							99693
BRD-K73716473	LSM-12947		54649579	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19-,20+/m1/s1	WNHZFTQVONQUSH-QOJCHSLYSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K73716473	BRD-K73716473-001-01-4	Broad Institute of MIT and Harvard	BRD-K73716473			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19-,20+/m1/s1	WNHZFTQVONQUSH-QOJCHSLYSA-N	429.226371122							101584
CHEMBL2358959	LSM-9274	BRD-K14002526, SID131445747	54649348	InChI=1S/C28H29F4N3O3S/c1-27(2,3)39(38)35-15-20-14-22(26(37)33-16-28(30,31)32)34-25(24(20)23(35)10-11-36)19-8-4-6-17(12-19)18-7-5-9-21(29)13-18/h4-9,12-14,23,36H,10-11,15-16H2,1-3H3,(H,33,37)/t23-,39-/m0/s1	WZDAFVZLMKVKDS-YMUVDJRFSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(F)c4)c2[C@@H]1CCO)C(=O)NCC(F)(F)F	BroadT	BRD-K14002526	BRD-K14002526-001-01-8	Broad Institute of MIT and Harvard	BRD-K14002526			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccc(F)c1)C(=O)NCC(F)(F)F	InChI=1S/C28H29F4N3O3S/c1-27(2,3)39(38)35-15-20-14-22(26(37)33-16-28(30,31)32)34-25(24(20)23(35)10-11-36)19-8-4-6-17(12-19)18-7-5-9-21(29)13-18/h4-9,12-14,23,36H,10-11,15-16H2,1-3H3,(H,33,37)/t23-,39-/m0/s1	WZDAFVZLMKVKDS-YMUVDJRFSA-N	563.186575308							97895
BRD-K60836534	LSM-12110		54649589	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16+,18+,19+/m1/s1	LYYREMJMDQKNES-XIVBQZFQSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)[C@H](C)C(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K60836534	BRD-K60836534-001-01-2	Broad Institute of MIT and Harvard	BRD-K60836534			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)[C@H](C)C(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16+,18+,19+/m1/s1	LYYREMJMDQKNES-XIVBQZFQSA-N	415.210721058							100736
BRD-K35535652-001-01-8	LSM-10560	BRD-K35535652	54649351	InChI=1S/C31H32FN5O3S/c1-31(2,3)41(40)37-18-23-14-26(30(39)35-17-22-7-4-5-10-25(22)32)36-29(28(23)27(37)11-12-38)21-9-6-8-20(13-21)24-15-33-19-34-16-24/h4-10,13-16,19,27,38H,11-12,17-18H2,1-3H3,(H,35,39)/t27-,41-/m1/s1	YBJDMCPYPJWKRF-KWAZPYRMSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cncnc4)c2[C@H]1CCO)C(=O)NCc5ccccc5F	BroadT	BRD-K35535652	BRD-K35535652-001-01-8	Broad Institute of MIT and Harvard	BRD-K35535652			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cncnc1)C(=O)NCc1ccccc1F	InChI=1S/C31H32FN5O3S/c1-31(2,3)41(40)37-18-23-14-26(30(39)35-17-22-7-4-5-10-25(22)32)36-29(28(23)27(37)11-12-38)21-9-6-8-20(13-21)24-15-33-19-34-16-24/h4-10,13-16,19,27,38H,11-12,17-18H2,1-3H3,(H,35,39)/t27-,41-/m1/s1	YBJDMCPYPJWKRF-KWAZPYRMSA-N	573.220988824							99181
BRD-K60879194	LSM-12116		54649568	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19+,20-/m1/s1	WNHZFTQVONQUSH-WSTLGDPDSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K60879194	BRD-K60879194-001-01-3	Broad Institute of MIT and Harvard	BRD-K60879194			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19+,20-/m1/s1	WNHZFTQVONQUSH-WSTLGDPDSA-N	429.226371122							100742
CHEMBL3185502	LSM-12707	BRD-K70074151	54649461	InChI=1S/C34H35N5O3S/c1-34(2,3)43(42)39-22-28-20-29(33(41)37-16-12-23-10-14-36-15-11-23)38-32(31(28)30(39)13-17-40)27-9-5-8-26(19-27)25-7-4-6-24(18-25)21-35/h4-11,14-15,18-20,30,40H,12-13,16-17,22H2,1-3H3,(H,37,41)/t30-,43-/m1/s1	VJIZUSRNHDZCJF-QHKNHCAJSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(c4)C#N)c2[C@H]1CCO)C(=O)NCCc5ccncc5	BroadT	BRD-K70074151	BRD-K70074151-001-01-0	Broad Institute of MIT and Harvard	BRD-K70074151			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccc(c1)C#N)C(=O)NCCc1ccncc1	InChI=1S/C34H35N5O3S/c1-34(2,3)43(42)39-22-28-20-29(33(41)37-16-12-23-10-14-36-15-11-23)38-32(31(28)30(39)13-17-40)27-9-5-8-26(19-27)25-7-4-6-24(18-25)21-35/h4-11,14-15,18-20,30,40H,12-13,16-17,22H2,1-3H3,(H,37,41)/t30-,43-/m1/s1	VJIZUSRNHDZCJF-QHKNHCAJSA-N	593.24606072							101342
BRD-K95275773	LSM-14268		54649554	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19-,20-/m1/s1	DXVJXLONGZUJOS-MISYRCLQSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K95275773	BRD-K95275773-001-01-2	Broad Institute of MIT and Harvard	BRD-K95275773			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19-,20-/m1/s1	DXVJXLONGZUJOS-MISYRCLQSA-N	429.226371122							102922
BRD-K87536251	LSM-13798		54649515	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22-,23+/m1/s1	YDHXSWOLXDIZHC-RUSSTMTCSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K87536251	BRD-K87536251-001-01-8	Broad Institute of MIT and Harvard	BRD-K87536251			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22-,23+/m1/s1	YDHXSWOLXDIZHC-RUSSTMTCSA-N	473.25258587							102447
BRD-K72382350	LSM-12870		54649466	InChI=1S/C35H44N4O4S/c1-35(2,3)44(43)39-22-27-21-29(33(41)36-28-12-7-6-8-13-28)37-32(31(27)30(39)18-19-40)26-11-9-10-25(20-26)23-14-16-24(17-15-23)34(42)38(4)5/h9-11,14-17,20-21,28,30,40H,6-8,12-13,18-19,22H2,1-5H3,(H,36,41)/t30-,44-/m1/s1	BMIDXELBLGAQFU-FSZSIQPOSA-N	CN(C)C(=O)c1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)NC5CCCCC5	BroadT	BRD-K72382350	BRD-K72382350-001-01-4	Broad Institute of MIT and Harvard	BRD-K72382350			CN(C)C(=O)c1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)NC1CCCCC1	InChI=1S/C35H44N4O4S/c1-35(2,3)44(43)39-22-27-21-29(33(41)36-28-12-7-6-8-13-28)37-32(31(27)30(39)18-19-40)26-11-9-10-25(20-26)23-14-16-24(17-15-23)34(42)38(4)5/h9-11,14-17,20-21,28,30,40H,6-8,12-13,18-19,22H2,1-5H3,(H,36,41)/t30-,44-/m1/s1	BMIDXELBLGAQFU-FSZSIQPOSA-N	616.308326618							101507
BRD-K18440865	LSM-9540		54649319	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	ZQAIRSWGSLNDJM-HYFFOGBASA-N	CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K18440865	BRD-K18440865-001-01-5	Broad Institute of MIT and Harvard	BRD-K18440865			CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22-/m1/s1	ZQAIRSWGSLNDJM-HYFFOGBASA-N	552.0922335							98161
BRD-K36835942	LSM-10656		54649389	InChI=1S/C29H35N3O4S/c1-29(2,3)37(35)32-18-22-17-24(28(34)31(4)5)30-27(26(22)25(32)14-15-33)21-9-7-8-20(16-21)19-10-12-23(36-6)13-11-19/h7-13,16-17,25,33H,14-15,18H2,1-6H3/t25-,37-/m1/s1	QYSQYMZBXYWZNF-TWEZTRHFSA-N	COc1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)N(C)C	BroadT	BRD-K36835942	BRD-K36835942-001-01-1	Broad Institute of MIT and Harvard	BRD-K36835942			COc1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)N(C)C	InChI=1S/C29H35N3O4S/c1-29(2,3)37(35)32-18-22-17-24(28(34)31(4)5)30-27(26(22)25(32)14-15-33)21-9-7-8-20(16-21)19-10-12-23(36-6)13-11-19/h7-13,16-17,25,33H,14-15,18H2,1-6H3/t25-,37-/m1/s1	QYSQYMZBXYWZNF-TWEZTRHFSA-N	521.23482732							99277
BRD-K05791917	LSM-8770		54649345	InChI=1S/C32H33FN4O3S/c1-32(2,3)41(40)37-20-23-18-27(31(39)35-19-24-11-6-7-15-34-24)36-30(29(23)28(37)14-16-38)22-10-8-9-21(17-22)25-12-4-5-13-26(25)33/h4-13,15,17-18,28,38H,14,16,19-20H2,1-3H3,(H,35,39)/t28-,41-/m0/s1	CHKDYTPBRLZLPJ-VELXTTODSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccccc4F)c2[C@@H]1CCO)C(=O)NCc5ccccn5	BroadT	BRD-K05791917	BRD-K05791917-001-01-4	Broad Institute of MIT and Harvard	BRD-K05791917			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccccc1F)C(=O)NCc1ccccn1	InChI=1S/C32H33FN4O3S/c1-32(2,3)41(40)37-20-23-18-27(31(39)35-19-24-11-6-7-15-34-24)36-30(29(23)28(37)14-16-38)22-10-8-9-21(17-22)25-12-4-5-13-26(25)33/h4-13,15,17-18,28,38H,14,16,19-20H2,1-3H3,(H,35,39)/t28-,41-/m0/s1	CHKDYTPBRLZLPJ-VELXTTODSA-N	572.225739846							97391
BRD-K45114520	LSM-11172		54649458	InChI=1S/C33H33N5O3S/c1-33(2,3)42(41)38-21-27-18-28(32(40)36-20-23-11-14-35-15-12-23)37-31(30(27)29(38)13-16-39)26-6-4-5-25(17-26)24-9-7-22(19-34)8-10-24/h4-12,14-15,17-18,29,39H,13,16,20-21H2,1-3H3,(H,36,40)/t29-,42-/m1/s1	SIVBIYNXLDZPKJ-LIIBOVGXSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(cc4)C#N)c2[C@H]1CCO)C(=O)NCc5ccncc5	BroadT	BRD-K45114520	BRD-K45114520-001-01-0	Broad Institute of MIT and Harvard	BRD-K45114520			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccc(cc1)C#N)C(=O)NCc1ccncc1	InChI=1S/C33H33N5O3S/c1-33(2,3)42(41)38-21-27-18-28(32(40)36-20-23-11-14-35-15-12-23)37-31(30(27)29(38)13-16-39)26-6-4-5-25(17-26)24-9-7-22(19-34)8-10-24/h4-12,14-15,17-18,29,39H,13,16,20-21H2,1-3H3,(H,36,40)/t29-,42-/m1/s1	SIVBIYNXLDZPKJ-LIIBOVGXSA-N	579.230410656							99793
BRD-K28305693	LSM-43460		54649438	InChI=1S/C31H37N3O4S/c1-6-9-21-10-7-12-23(16-21)29-28-24(20-34(27(28)14-15-35)39(37)31(2,3)4)18-26(33-29)30(36)32-19-22-11-8-13-25(17-22)38-5/h6-13,16-18,27,35H,14-15,19-20H2,1-5H3,(H,32,36)/b9-6+/t27-,39-/m1/s1	NHZALIQGAPONCQ-XCHBOIJWSA-N	COc1cccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)c4cccc(\C=C\C)c4)[S@](=O)C(C)(C)C)c1	BroadT	BRD-K28305693	BRD-K28305693-001-01-6	Broad Institute of MIT and Harvard	BRD-K28305693			COc1cccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)-c2cccc(\C=C\C)c2)[S@](=O)C(C)(C)C)c1	InChI=1S/C31H37N3O4S/c1-6-9-21-10-7-12-23(16-21)29-28-24(20-34(27(28)14-15-35)39(37)31(2,3)4)18-26(33-29)30(36)32-19-22-11-8-13-25(17-22)38-5/h6-13,16-18,27,35H,14-15,19-20H2,1-5H3,(H,32,36)/b9-6+/t27-,39-/m1/s1	NHZALIQGAPONCQ-XCHBOIJWSA-N	547.250477384							
BRD-K37638153	LSM-10704		54649344	InChI=1S/C34H41N5O3S/c1-34(2,3)43(42)39-23-28-21-29(33(41)36-14-17-38-15-5-4-6-16-38)37-32(31(28)30(39)13-18-40)27-12-8-11-26(20-27)25-10-7-9-24(19-25)22-35/h7-12,19-21,30,40H,4-6,13-18,23H2,1-3H3,(H,36,41)/t30-,43-/m0/s1	APUVMPYXYOEPCI-IPKWWJLYSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(c4)C#N)c2[C@@H]1CCO)C(=O)NCCN5CCCCC5	BroadT	BRD-K37638153	BRD-K37638153-001-01-2	Broad Institute of MIT and Harvard	BRD-K37638153			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccc(c1)C#N)C(=O)NCCN1CCCCC1	InChI=1S/C34H41N5O3S/c1-34(2,3)43(42)39-23-28-21-29(33(41)36-14-17-38-15-5-4-6-16-38)37-32(31(28)30(39)13-18-40)27-12-8-11-26(20-27)25-10-7-9-24(19-25)22-35/h7-12,19-21,30,40H,4-6,13-18,23H2,1-3H3,(H,36,41)/t30-,43-/m0/s1	APUVMPYXYOEPCI-IPKWWJLYSA-N	599.293010912							99325
BRD-K37299375	LSM-10679		54649473	InChI=1S/C34H41N5O3S/c1-34(2,3)43(42)39-23-28-21-29(33(41)36-15-18-38-16-5-4-6-17-38)37-32(31(28)30(39)14-19-40)27-9-7-8-26(20-27)25-12-10-24(22-35)11-13-25/h7-13,20-21,30,40H,4-6,14-19,23H2,1-3H3,(H,36,41)/t30-,43-/m1/s1	TZEAMANOEIDNTF-QHKNHCAJSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(cc4)C#N)c2[C@H]1CCO)C(=O)NCCN5CCCCC5	BroadT	BRD-K37299375	BRD-K37299375-001-01-5	Broad Institute of MIT and Harvard	BRD-K37299375			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccc(cc1)C#N)C(=O)NCCN1CCCCC1	InChI=1S/C34H41N5O3S/c1-34(2,3)43(42)39-23-28-21-29(33(41)36-15-18-38-16-5-4-6-17-38)37-32(31(28)30(39)14-19-40)27-9-7-8-26(20-27)25-12-10-24(22-35)11-13-25/h7-13,20-21,30,40H,4-6,14-19,23H2,1-3H3,(H,36,41)/t30-,43-/m1/s1	TZEAMANOEIDNTF-QHKNHCAJSA-N	599.293010912							99300
BRD-K73837493	LSM-12951		54649447	InChI=1S/C29H34FN3O3S/c1-5-13-31-28(35)24-17-22-18-33(37(36)29(2,3)4)25(12-14-34)26(22)27(32-24)21-10-6-8-19(15-21)20-9-7-11-23(30)16-20/h6-11,15-17,25,34H,5,12-14,18H2,1-4H3,(H,31,35)/t25-,37-/m1/s1	FSCHPCZBUZXFPL-TWEZTRHFSA-N	CCCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)c4cccc(F)c4)[S@](=O)C(C)(C)C	BroadT	BRD-K73837493	BRD-K73837493-001-01-4	Broad Institute of MIT and Harvard	BRD-K73837493			CCCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(F)c1)[S@](=O)C(C)(C)C	InChI=1S/C29H34FN3O3S/c1-5-13-31-28(35)24-17-22-18-33(37(36)29(2,3)4)25(12-14-34)26(22)27(32-24)21-10-6-8-19(15-21)20-9-7-11-23(30)16-20/h6-11,15-17,25,34H,5,12-14,18H2,1-4H3,(H,31,35)/t25-,37-/m1/s1	FSCHPCZBUZXFPL-TWEZTRHFSA-N	523.230490868							101588
BRD-K74094800	LSM-12964		54649400	InChI=1S/C33H36N4O4S/c1-33(2,3)42(40)37-21-26-19-28(32(39)35-20-22-7-5-10-27(17-22)41-4)36-31(30(26)29(37)13-16-38)25-9-6-8-24(18-25)23-11-14-34-15-12-23/h5-12,14-15,17-19,29,38H,13,16,20-21H2,1-4H3,(H,35,39)/t29-,42-/m0/s1	GIUILNXHKTVBSA-WHAQVLKXSA-N	COc1cccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)c4cccc(c4)c5ccncc5)[S@@](=O)C(C)(C)C)c1	BroadT	BRD-K74094800	BRD-K74094800-001-01-9	Broad Institute of MIT and Harvard	BRD-K74094800			COc1cccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)-c2cccc(c2)-c2ccncc2)[S@@](=O)C(C)(C)C)c1	InChI=1S/C33H36N4O4S/c1-33(2,3)42(40)37-21-26-19-28(32(39)35-20-22-7-5-10-27(17-22)41-4)36-31(30(26)29(37)13-16-38)25-9-6-8-24(18-25)23-11-14-34-15-12-23/h5-12,14-15,17-19,29,38H,13,16,20-21H2,1-4H3,(H,35,39)/t29-,42-/m0/s1	GIUILNXHKTVBSA-WHAQVLKXSA-N	584.245726362							101601
BRD-K68774060	LSM-12624		54649298	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22+/m0/s1	DYSXQKGXYVAXRN-PNLZDCPESA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K68774060	BRD-K68774060-001-01-9	Broad Institute of MIT and Harvard	BRD-K68774060			CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22+/m0/s1	DYSXQKGXYVAXRN-PNLZDCPESA-N	499.195248212							131210
BRD-K88306467	LSM-13854		54649390	InChI=1S/C29H35N3O4S/c1-29(2,3)37(35)32-18-22-17-24(28(34)31(4)5)30-27(26(22)25(32)14-15-33)21-9-7-8-20(16-21)19-10-12-23(36-6)13-11-19/h7-13,16-17,25,33H,14-15,18H2,1-6H3/t25-,37-/m0/s1	QYSQYMZBXYWZNF-RSUXDYMJSA-N	COc1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)N(C)C	BroadT	BRD-K88306467	BRD-K88306467-001-01-5	Broad Institute of MIT and Harvard	BRD-K88306467			COc1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)N(C)C	InChI=1S/C29H35N3O4S/c1-29(2,3)37(35)32-18-22-17-24(28(34)31(4)5)30-27(26(22)25(32)14-15-33)21-9-7-8-20(16-21)19-10-12-23(36-6)13-11-19/h7-13,16-17,25,33H,14-15,18H2,1-6H3/t25-,37-/m0/s1	QYSQYMZBXYWZNF-RSUXDYMJSA-N	521.23482732							102505
BRD-K01568615	LSM-8531		54649396	InChI=1S/C31H38N4O4S/c1-7-32-29(37)25-18-24-19-35(40(39)31(2,3)4)26(14-15-36)27(24)28(33-25)22-12-8-10-20(16-22)21-11-9-13-23(17-21)30(38)34(5)6/h8-13,16-18,26,36H,7,14-15,19H2,1-6H3,(H,32,37)/t26-,40-/m1/s1	TYBSUWGSJMEJTO-ZCQGCHJCSA-N	CCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)c4cccc(c4)C(=O)N(C)C)[S@](=O)C(C)(C)C	BroadT	BRD-K01568615	BRD-K01568615-001-01-5	Broad Institute of MIT and Harvard	BRD-K01568615			CCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(c1)C(=O)N(C)C)[S@](=O)C(C)(C)C	InChI=1S/C31H38N4O4S/c1-7-32-29(37)25-18-24-19-35(40(39)31(2,3)4)26(14-15-36)27(24)28(33-25)22-12-8-10-20(16-22)21-11-9-13-23(17-21)30(38)34(5)6/h8-13,16-18,26,36H,7,14-15,19H2,1-6H3,(H,32,37)/t26-,40-/m1/s1	TYBSUWGSJMEJTO-ZCQGCHJCSA-N	562.261376426							97152
CHEMBL3187411	LSM-13168	BRD-K77596469	54649368	InChI=1S/C33H34N4O5S/c1-33(2,3)43(40)37-19-25-16-26(32(39)35-17-21-9-10-28-29(14-21)42-20-41-28)36-31(30(25)27(37)11-13-38)23-7-4-6-22(15-23)24-8-5-12-34-18-24/h4-10,12,14-16,18,27,38H,11,13,17,19-20H2,1-3H3,(H,35,39)/t27-,43-/m0/s1	JSQFWOWYOCZIMF-AMDSOUHQSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccnc4)c2[C@@H]1CCO)C(=O)NCc5ccc6OCOc6c5	BroadT	BRD-K77596469	BRD-K77596469-001-01-2	Broad Institute of MIT and Harvard	BRD-K77596469			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccnc1)C(=O)NCc1ccc2OCOc2c1	InChI=1S/C33H34N4O5S/c1-33(2,3)43(40)37-19-25-16-26(32(39)35-17-21-9-10-28-29(14-21)42-20-41-28)36-31(30(25)27(37)11-13-38)23-7-4-6-22(15-23)24-8-5-12-34-18-24/h4-10,12,14-16,18,27,38H,11,13,17,19-20H2,1-3H3,(H,35,39)/t27-,43-/m0/s1	JSQFWOWYOCZIMF-AMDSOUHQSA-N	598.224990918							101806
BRD-K62320150	LSM-12214		54649536	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22-,23+/m0/s1	YDHXSWOLXDIZHC-KJYLGWKASA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K62320150	BRD-K62320150-001-01-8	Broad Institute of MIT and Harvard	BRD-K62320150			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22-,23+/m0/s1	YDHXSWOLXDIZHC-KJYLGWKASA-N	473.25258587							100840
BRD-K04759195	LSM-8724		54649380	InChI=1S/C32H35N5O3S/c1-32(2,3)41(40)37-21-26-19-27(31(39)35-16-11-22-9-14-33-15-10-22)36-30(29(26)28(37)12-17-38)24-7-4-6-23(18-24)25-8-5-13-34-20-25/h4-10,13-15,18-20,28,38H,11-12,16-17,21H2,1-3H3,(H,35,39)/t28-,41-/m0/s1	YESIXAXFOCXQOM-VELXTTODSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccnc4)c2[C@@H]1CCO)C(=O)NCCc5ccncc5	BroadT	BRD-K04759195	BRD-K04759195-001-01-5	Broad Institute of MIT and Harvard	BRD-K04759195			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccnc1)C(=O)NCCc1ccncc1	InChI=1S/C32H35N5O3S/c1-32(2,3)41(40)37-21-26-19-27(31(39)35-16-11-22-9-14-33-15-10-22)36-30(29(26)28(37)12-17-38)24-7-4-6-23(18-24)25-8-5-13-34-20-25/h4-10,13-15,18-20,28,38H,11-12,16-17,21H2,1-3H3,(H,35,39)/t28-,41-/m0/s1	YESIXAXFOCXQOM-VELXTTODSA-N	569.24606072							97345
BRD-K35743871	LSM-10574		54649537	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25-,26+/m1/s1	DIIJYNJFSHJSFY-RYJQUDHMSA-N	CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@@H]1O2)c4ccccc4)C#N	BroadT	BRD-K35743871	BRD-K35743871-001-01-3	Broad Institute of MIT and Harvard	BRD-K35743871			CO[C@@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25-,26+/m1/s1	DIIJYNJFSHJSFY-RYJQUDHMSA-N	505.25767125							99195
BRD-K70179603	LSM-12711		54649375	InChI=1S/C29H34FN3O3S/c1-5-14-31-28(35)24-17-22-18-33(37(36)29(2,3)4)25(13-15-34)26(22)27(32-24)21-8-6-7-20(16-21)19-9-11-23(30)12-10-19/h6-12,16-17,25,34H,5,13-15,18H2,1-4H3,(H,31,35)/t25-,37-/m0/s1	HVPPUANJBVTFMA-RSUXDYMJSA-N	CCCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)c4ccc(F)cc4)[S@@](=O)C(C)(C)C	BroadT	BRD-K70179603	BRD-K70179603-001-01-1	Broad Institute of MIT and Harvard	BRD-K70179603			CCCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1ccc(F)cc1)[S@@](=O)C(C)(C)C	InChI=1S/C29H34FN3O3S/c1-5-14-31-28(35)24-17-22-18-33(37(36)29(2,3)4)25(13-15-34)26(22)27(32-24)21-8-6-7-20(16-21)19-9-11-23(30)12-10-19/h6-12,16-17,25,34H,5,13-15,18H2,1-4H3,(H,31,35)/t25-,37-/m0/s1	HVPPUANJBVTFMA-RSUXDYMJSA-N	523.230490868							101346
BRD-K78386932	LSM-13221		54649486	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21+,22+/m0/s1	XYLRKRISJMFHFX-WROXGLCASA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K78386932	BRD-K78386932-001-01-6	Broad Institute of MIT and Harvard	BRD-K78386932			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21+,22+/m0/s1	XYLRKRISJMFHFX-WROXGLCASA-N	473.25258587							101860
BRD-K54805796	LSM-11753		54649446	InChI=1S/C33H39N5O3S/c1-33(2,3)42(41)38-22-27-20-28(32(40)35-14-17-37-15-4-5-16-37)36-31(30(27)29(38)13-18-39)26-8-6-7-25(19-26)24-11-9-23(21-34)10-12-24/h6-12,19-20,29,39H,4-5,13-18,22H2,1-3H3,(H,35,40)/t29-,42-/m0/s1	KRBOYVJOHNAAFC-WHAQVLKXSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(cc4)C#N)c2[C@@H]1CCO)C(=O)NCCN5CCCC5	BroadT	BRD-K54805796	BRD-K54805796-001-01-8	Broad Institute of MIT and Harvard	BRD-K54805796			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccc(cc1)C#N)C(=O)NCCN1CCCC1	InChI=1S/C33H39N5O3S/c1-33(2,3)42(41)38-22-27-20-28(32(40)35-14-17-37-15-4-5-16-37)36-31(30(27)29(38)13-18-39)26-8-6-7-25(19-26)24-11-9-23(21-34)10-12-24/h6-12,19-20,29,39H,4-5,13-18,22H2,1-3H3,(H,35,40)/t29-,42-/m0/s1	KRBOYVJOHNAAFC-WHAQVLKXSA-N	585.277360848							100378
BRD-K42654448	LSM-11017		54649444	InChI=1S/C29H35N3O4S/c1-29(2,3)37(35)32-18-22-17-24(28(34)31(4)5)30-27(26(22)25(32)13-14-33)21-11-7-9-19(15-21)20-10-8-12-23(16-20)36-6/h7-12,15-17,25,33H,13-14,18H2,1-6H3/t25-,37-/m0/s1	FLZDWOWASDTEHK-RSUXDYMJSA-N	COc1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)N(C)C	BroadT	BRD-K42654448	BRD-K42654448-001-01-7	Broad Institute of MIT and Harvard	BRD-K42654448			COc1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)N(C)C	InChI=1S/C29H35N3O4S/c1-29(2,3)37(35)32-18-22-17-24(28(34)31(4)5)30-27(26(22)25(32)13-14-33)21-11-7-9-19(15-21)20-10-8-12-23(16-20)36-6/h7-12,15-17,25,33H,13-14,18H2,1-6H3/t25-,37-/m0/s1	FLZDWOWASDTEHK-RSUXDYMJSA-N	521.23482732							99638
BRD-K94217081	LSM-14203		54649590	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16-,18-,19+/m1/s1	LYYREMJMDQKNES-OPNNQBFTSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)[C@H](C)C(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K94217081	BRD-K94217081-001-01-2	Broad Institute of MIT and Harvard	BRD-K94217081			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)[C@H](C)C(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16-,18-,19+/m1/s1	LYYREMJMDQKNES-OPNNQBFTSA-N	415.210721058							102857
BRD-K14535500	LSM-9311		54649332	InChI=1S/C30H34FN3O4S/c1-30(2,3)39(37)34-19-22-18-25(29(36)33-12-15-38-16-13-33)32-28(27(22)26(34)11-14-35)21-8-6-7-20(17-21)23-9-4-5-10-24(23)31/h4-10,17-18,26,35H,11-16,19H2,1-3H3/t26-,39-/m1/s1	WDBGCMALGZQRLR-FMARWTIOSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccccc4F)c2[C@H]1CCO)C(=O)N5CCOCC5	BroadT	BRD-K14535500	BRD-K14535500-001-01-7	Broad Institute of MIT and Harvard	BRD-K14535500			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccccc1F)C(=O)N1CCOCC1	InChI=1S/C30H34FN3O4S/c1-30(2,3)39(37)34-19-22-18-25(29(36)33-12-15-38-16-13-33)32-28(27(22)26(34)11-14-35)21-8-6-7-20(17-21)23-9-4-5-10-24(23)31/h4-10,17-18,26,35H,11-16,19H2,1-3H3/t26-,39-/m1/s1	WDBGCMALGZQRLR-FMARWTIOSA-N	551.225405488							97932
BRD-K19106401	LSM-9577		54649378	InChI=1S/C32H36N4O3S/c1-32(2,3)40(39)36-21-26-19-27(31(38)35-14-5-4-6-15-35)34-30(29(26)28(36)13-16-37)25-12-8-11-24(18-25)23-10-7-9-22(17-23)20-33/h7-12,17-19,28,37H,4-6,13-16,21H2,1-3H3/t28-,40-/m1/s1	QJZRVXNBJYVZFW-VAJZRNNVSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(c4)C#N)c2[C@H]1CCO)C(=O)N5CCCCC5	BroadT	BRD-K19106401	BRD-K19106401-001-01-2	Broad Institute of MIT and Harvard	BRD-K19106401			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccc(c1)C#N)C(=O)N1CCCCC1	InChI=1S/C32H36N4O3S/c1-32(2,3)40(39)36-21-26-19-27(31(38)35-14-5-4-6-15-35)34-30(29(26)28(36)13-16-37)25-12-8-11-24(18-25)23-10-7-9-22(17-23)20-33/h7-12,17-19,28,37H,4-6,13-16,21H2,1-3H3/t28-,40-/m1/s1	QJZRVXNBJYVZFW-VAJZRNNVSA-N	556.250811742							98198
BRD-K00472408	LSM-8458		56835589	InChI=1S/C32H44N4O5S/c1-31(2,3)42(40)36-22-25-21-26(30(38)33-13-7-14-35-15-18-41-19-16-35)34-29(28(25)27(36)11-17-37)24-9-6-8-23(20-24)10-12-32(4,5)39/h6,8-9,20-21,27,37,39H,7,11,13-19,22H2,1-5H3,(H,33,38)/t27-,42?/m1/s1	UFLNOMSZNUMDSV-IJEDNORESA-N	CC(C)(O)C#Cc1cccc(c1)c2nc(cc3CN([C@H](CCO)c23)S(=O)C(C)(C)C)C(=O)NCCCN4CCOCC4	BroadT	BRD-K00472408	BRD-K00472408-001-03-8	Broad Institute of MIT and Harvard	BRD-K00472408			CC(C)(O)C#Cc1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)S(=O)C(C)(C)C)C(=O)NCCCN1CCOCC1	InChI=1S/C32H44N4O5S/c1-31(2,3)42(40)36-22-25-21-26(30(38)33-13-7-14-35-15-18-41-19-16-35)34-29(28(25)27(36)11-17-37)24-9-6-8-23(20-24)10-12-32(4,5)39/h6,8-9,20-21,27,37,39H,7,11,13-19,22H2,1-5H3,(H,33,38)/t27-,42?/m1/s1	UFLNOMSZNUMDSV-IJEDNORESA-N	596.303241238							97079
BRD-K55038865	LSM-11764		54649341	InChI=1S/C28H37N3O4S/c1-28(2,3)36(34)31-18-22-17-23(27(33)29-13-15-35-4)30-26(25(22)24(31)12-14-32)21-11-7-10-20(16-21)19-8-5-6-9-19/h7-8,10-11,16-17,24,32H,5-6,9,12-15,18H2,1-4H3,(H,29,33)/t24-,36-/m1/s1	RKRNHXQJFJMDQI-GPJMPKJXSA-N	COCCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)C4=CCCC4)[S@](=O)C(C)(C)C	BroadT	BRD-K55038865	BRD-K55038865-001-01-1	Broad Institute of MIT and Harvard	BRD-K55038865			COCCNC(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)C1=CCCC1)[S@](=O)C(C)(C)C	InChI=1S/C28H37N3O4S/c1-28(2,3)36(34)31-18-22-17-23(27(33)29-13-15-35-4)30-26(25(22)24(31)12-14-32)21-11-7-10-20(16-21)19-8-5-6-9-19/h7-8,10-11,16-17,24,32H,5-6,9,12-15,18H2,1-4H3,(H,29,33)/t24-,36-/m1/s1	RKRNHXQJFJMDQI-GPJMPKJXSA-N	511.250477384							100389
BRD-K54839171	LSM-11755		54649519	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22+,23-/m0/s1	YDHXSWOLXDIZHC-HUDOHWAWSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K54839171	BRD-K54839171-001-01-2	Broad Institute of MIT and Harvard	BRD-K54839171			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22+,23-/m0/s1	YDHXSWOLXDIZHC-HUDOHWAWSA-N	473.25258587							100380
BRD-K02159117	LSM-8566		54649416	InChI=1S/C34H42N4O4S/c1-34(2,3)43(42)38-22-27-21-28(33(41)37-16-7-6-8-17-37)35-31(30(27)29(38)15-18-39)25-13-9-11-23(19-25)24-12-10-14-26(20-24)32(40)36(4)5/h9-14,19-21,29,39H,6-8,15-18,22H2,1-5H3/t29-,43-/m1/s1	KPHKCBNGEDAQEL-WXTZLZKPSA-N	CN(C)C(=O)c1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)N5CCCCC5	BroadT	BRD-K02159117	BRD-K02159117-001-01-5	Broad Institute of MIT and Harvard	BRD-K02159117			CN(C)C(=O)c1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)N1CCCCC1	InChI=1S/C34H42N4O4S/c1-34(2,3)43(42)38-22-27-21-28(33(41)37-16-7-6-8-17-37)35-31(30(27)29(38)15-18-39)25-13-9-11-23(19-25)24-12-10-14-26(20-24)32(40)36(4)5/h9-14,19-21,29,39H,6-8,15-18,22H2,1-5H3/t29-,43-/m1/s1	KPHKCBNGEDAQEL-WXTZLZKPSA-N	602.292676554							97187
BRD-K36070105	LSM-10602		54649573	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19+,20+/m0/s1	WNHZFTQVONQUSH-JQERWDHBSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K36070105	BRD-K36070105-001-01-8	Broad Institute of MIT and Harvard	BRD-K36070105			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19+,20+/m0/s1	WNHZFTQVONQUSH-JQERWDHBSA-N	429.226371122							99223
CHEMBL2360118	LSM-12682	BRD-K69705756, SID131445723	54649324	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m1/s1	JTCZGLOUSBJUER-JLHGSKIFSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K69705756	BRD-K69705756-001-01-1	Broad Institute of MIT and Harvard	BRD-K69705756			CO[C@@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m1/s1	JTCZGLOUSBJUER-JLHGSKIFSA-N	552.0922335							101316
BRD-K07700224	LSM-8893		54649521	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22-,23+/m0/s1	YDHXSWOLXDIZHC-CSGCFWLZSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K07700224	BRD-K07700224-001-01-1	Broad Institute of MIT and Harvard	BRD-K07700224			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22-,23+/m0/s1	YDHXSWOLXDIZHC-CSGCFWLZSA-N	473.25258587							97514
BRD-K22174526	LSM-9770		54649565	InChI=1S/C28H39N3O5/c1-30-18-24-23(34-3)11-10-21(36-24)12-15-35-26-20(17-29)8-7-9-22(26)27(33)31(2)19-28(16-25(30)32)13-5-4-6-14-28/h7-9,21,23-24H,4-6,10-16,18-19H2,1-3H3/t21-,23-,24+/m0/s1	NNLRSZHLKPFWRY-OEMFJLHTSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CC4(CCCCC4)CC(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K22174526	BRD-K22174526-001-01-5	Broad Institute of MIT and Harvard	BRD-K22174526			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CC3(CCCCC3)CC(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C28H39N3O5/c1-30-18-24-23(34-3)11-10-21(36-24)12-15-35-26-20(17-29)8-7-9-22(26)27(33)31(2)19-28(16-25(30)32)13-5-4-6-14-28/h7-9,21,23-24H,4-6,10-16,18-19H2,1-3H3/t21-,23-,24+/m0/s1	NNLRSZHLKPFWRY-OEMFJLHTSA-N	497.288971378							98391
BRD-K96451524	LSM-14344		54649533	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22+,23-/m1/s1	YDHXSWOLXDIZHC-NHYSTBNRSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K96451524	BRD-K96451524-001-01-0	Broad Institute of MIT and Harvard	BRD-K96451524			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22+,23-/m1/s1	YDHXSWOLXDIZHC-NHYSTBNRSA-N	473.25258587							102998
BRD-K42704273	LSM-11022		54649507	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22+,23+/m1/s1	YDHXSWOLXDIZHC-MRNSCZIKSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K42704273	BRD-K42704273-001-01-0	Broad Institute of MIT and Harvard	BRD-K42704273			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22+,23+/m1/s1	YDHXSWOLXDIZHC-MRNSCZIKSA-N	473.25258587							99643
BRD-K56583519	LSM-11849		54649457	InChI=1S/C33H33N5O3S/c1-33(2,3)42(41)38-21-27-18-28(32(40)36-20-23-11-14-35-15-12-23)37-31(30(27)29(38)13-16-39)26-6-4-5-25(17-26)24-9-7-22(19-34)8-10-24/h4-12,14-15,17-18,29,39H,13,16,20-21H2,1-3H3,(H,36,40)/t29-,42-/m0/s1	SIVBIYNXLDZPKJ-WHAQVLKXSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(cc4)C#N)c2[C@@H]1CCO)C(=O)NCc5ccncc5	BroadT	BRD-K56583519	BRD-K56583519-001-01-5	Broad Institute of MIT and Harvard	BRD-K56583519			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccc(cc1)C#N)C(=O)NCc1ccncc1	InChI=1S/C33H33N5O3S/c1-33(2,3)42(41)38-21-27-18-28(32(40)36-20-23-11-14-35-15-12-23)37-31(30(27)29(38)13-16-39)26-6-4-5-25(17-26)24-9-7-22(19-34)8-10-24/h4-12,14-15,17-18,29,39H,13,16,20-21H2,1-3H3,(H,36,40)/t29-,42-/m0/s1	SIVBIYNXLDZPKJ-WHAQVLKXSA-N	579.230410656							100475
BRD-K21107294	LSM-9713		54649422	InChI=1S/C33H40N4O4S/c1-33(2,3)42(41)37-20-25-19-27(31(39)34-26-10-7-11-26)35-30(29(25)28(37)16-17-38)24-9-6-8-23(18-24)21-12-14-22(15-13-21)32(40)36(4)5/h6,8-9,12-15,18-19,26,28,38H,7,10-11,16-17,20H2,1-5H3,(H,34,39)/t28-,42-/m1/s1	XRIKJANOQKUWJP-VOLSFDEHSA-N	CN(C)C(=O)c1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)NC5CCC5	BroadT	BRD-K21107294	BRD-K21107294-001-01-6	Broad Institute of MIT and Harvard	BRD-K21107294			CN(C)C(=O)c1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)NC1CCC1	InChI=1S/C33H40N4O4S/c1-33(2,3)42(41)37-20-25-19-27(31(39)34-26-10-7-11-26)35-30(29(25)28(37)16-17-38)24-9-6-8-23(18-24)21-12-14-22(15-13-21)32(40)36(4)5/h6,8-9,12-15,18-19,26,28,38H,7,10-11,16-17,20H2,1-5H3,(H,34,39)/t28-,42-/m1/s1	XRIKJANOQKUWJP-VOLSFDEHSA-N	588.27702649							98334
BRD-K36462169	LSM-10630		54649294	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22+/m1/s1	DYSXQKGXYVAXRN-JLHGSKIFSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K36462169	BRD-K36462169-001-01-0	Broad Institute of MIT and Harvard	BRD-K36462169			CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22+/m1/s1	DYSXQKGXYVAXRN-JLHGSKIFSA-N	499.195248212							99251
BRD-K76784707	LSM-13129		54649336	InChI=1S/C35H44N4O4S/c1-35(2,3)44(43)39-22-27-21-29(33(41)36-28-15-7-6-8-16-28)37-32(31(27)30(39)17-18-40)25-13-9-11-23(19-25)24-12-10-14-26(20-24)34(42)38(4)5/h9-14,19-21,28,30,40H,6-8,15-18,22H2,1-5H3,(H,36,41)/t30-,44-/m0/s1	YEVZUBCSLLXCKN-PDWOKFFSSA-N	CN(C)C(=O)c1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)NC5CCCCC5	BroadT	BRD-K76784707	BRD-K76784707-001-01-7	Broad Institute of MIT and Harvard	BRD-K76784707			CN(C)C(=O)c1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NC1CCCCC1	InChI=1S/C35H44N4O4S/c1-35(2,3)44(43)39-22-27-21-29(33(41)36-28-15-7-6-8-16-28)37-32(31(27)30(39)17-18-40)25-13-9-11-23(19-25)24-12-10-14-26(20-24)34(42)38(4)5/h9-14,19-21,28,30,40H,6-8,15-18,22H2,1-5H3,(H,36,41)/t30-,44-/m0/s1	YEVZUBCSLLXCKN-PDWOKFFSSA-N	616.308326618							101767
BRD-K55896440	LSM-11815		54649343	InChI=1S/C34H41N5O3S/c1-34(2,3)43(42)39-23-28-21-29(33(41)36-14-17-38-15-5-4-6-16-38)37-32(31(28)30(39)13-18-40)27-12-8-11-26(20-27)25-10-7-9-24(19-25)22-35/h7-12,19-21,30,40H,4-6,13-18,23H2,1-3H3,(H,36,41)/t30-,43-/m1/s1	APUVMPYXYOEPCI-QHKNHCAJSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(c4)C#N)c2[C@H]1CCO)C(=O)NCCN5CCCCC5	BroadT	BRD-K55896440	BRD-K55896440-001-01-6	Broad Institute of MIT and Harvard	BRD-K55896440			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccc(c1)C#N)C(=O)NCCN1CCCCC1	InChI=1S/C34H41N5O3S/c1-34(2,3)43(42)39-23-28-21-29(33(41)36-14-17-38-15-5-4-6-16-38)37-32(31(28)30(39)13-18-40)27-12-8-11-26(20-27)25-10-7-9-24(19-25)22-35/h7-12,19-21,30,40H,4-6,13-18,23H2,1-3H3,(H,36,41)/t30-,43-/m1/s1	APUVMPYXYOEPCI-QHKNHCAJSA-N	599.293010912							100440
BRD-K95779464	LSM-14302		54649540	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25-,26+/m0/s1	DIIJYNJFSHJSFY-NLJWQWLVSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@H]1O2)c4ccccc4)C#N	BroadT	BRD-K95779464	BRD-K95779464-001-01-7	Broad Institute of MIT and Harvard	BRD-K95779464			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25-,26+/m0/s1	DIIJYNJFSHJSFY-NLJWQWLVSA-N	505.25767125							102956
CHEMBL2358850	LSM-13206	SID131445778, BRD-K78097639	54649379	InChI=1S/C32H35N5O3S/c1-32(2,3)41(40)37-21-26-19-27(31(39)35-16-11-22-9-14-33-15-10-22)36-30(29(26)28(37)12-17-38)24-7-4-6-23(18-24)25-8-5-13-34-20-25/h4-10,13-15,18-20,28,38H,11-12,16-17,21H2,1-3H3,(H,35,39)/t28-,41-/m1/s1	YESIXAXFOCXQOM-GIEABIOQSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccnc4)c2[C@H]1CCO)C(=O)NCCc5ccncc5	BroadT	BRD-K78097639	BRD-K78097639-001-01-5	Broad Institute of MIT and Harvard	BRD-K78097639			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccnc1)C(=O)NCCc1ccncc1	InChI=1S/C32H35N5O3S/c1-32(2,3)41(40)37-21-26-19-27(31(39)35-16-11-22-9-14-33-15-10-22)36-30(29(26)28(37)12-17-38)24-7-4-6-23(18-24)25-8-5-13-34-20-25/h4-10,13-15,18-20,28,38H,11-12,16-17,21H2,1-3H3,(H,35,39)/t28-,41-/m1/s1	YESIXAXFOCXQOM-GIEABIOQSA-N	569.24606072							101844
BRD-K11238413	LSM-9114		54649480	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21-,22+/m0/s1	XYLRKRISJMFHFX-XXBFSGCESA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K11238413	BRD-K11238413-001-01-7	Broad Institute of MIT and Harvard	BRD-K11238413			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21-,22+/m0/s1	XYLRKRISJMFHFX-XXBFSGCESA-N	473.25258587							97735
BRD-K33013391	LSM-43467		54649371	InChI=1S/C29H34N4O3S/c1-5-9-20-10-8-11-21(16-20)27-26-22(19-33(25(26)13-15-34)37(36)29(2,3)4)17-24(32-27)28(35)31-18-23-12-6-7-14-30-23/h5-12,14,16-17,25,34H,13,15,18-19H2,1-4H3,(H,31,35)/b9-5+/t25-,37-/m0/s1	NLVITHYZUKLHNS-BDQSVISFSA-N	C\C=C\c1cccc(c1)c2nc(cc3CN([C@@H](CCO)c23)[S@@](=O)C(C)(C)C)C(=O)NCc4ccccn4	BroadT	BRD-K33013391	BRD-K33013391-001-01-4	Broad Institute of MIT and Harvard	BRD-K33013391			C\C=C\c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NCc1ccccn1	InChI=1S/C29H34N4O3S/c1-5-9-20-10-8-11-21(16-20)27-26-22(19-33(25(26)13-15-34)37(36)29(2,3)4)17-24(32-27)28(35)31-18-23-12-6-7-14-30-23/h5-12,14,16-17,25,34H,13,15,18-19H2,1-4H3,(H,31,35)/b9-5+/t25-,37-/m0/s1	NLVITHYZUKLHNS-BDQSVISFSA-N	518.235161678							
BRD-K84935204	LSM-13617		54649330	InChI=1S/C31H33N5O3S/c1-31(2,3)40(39)36-20-25-18-26(30(38)34-19-21-7-12-32-13-8-21)35-29(28(25)27(36)11-16-37)24-6-4-5-23(17-24)22-9-14-33-15-10-22/h4-10,12-15,17-18,27,37H,11,16,19-20H2,1-3H3,(H,34,38)/t27-,40-/m0/s1	VKWMOKPZZRMWDJ-PDBZVODSSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccncc4)c2[C@@H]1CCO)C(=O)NCc5ccncc5	BroadT	BRD-K84935204	BRD-K84935204-001-01-3	Broad Institute of MIT and Harvard	BRD-K84935204			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccncc1)C(=O)NCc1ccncc1	InChI=1S/C31H33N5O3S/c1-31(2,3)40(39)36-20-25-18-26(30(38)34-19-21-7-12-32-13-8-21)35-29(28(25)27(36)11-16-37)24-6-4-5-23(17-24)22-9-14-33-15-10-22/h4-10,12-15,17-18,27,37H,11,16,19-20H2,1-3H3,(H,34,38)/t27-,40-/m0/s1	VKWMOKPZZRMWDJ-PDBZVODSSA-N	555.230410656							102263
BRD-K98850601	LSM-14496		54649525	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22+,23+/m0/s1	YDHXSWOLXDIZHC-JWRSUQAPSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K98850601	BRD-K98850601-001-01-7	Broad Institute of MIT and Harvard	BRD-K98850601			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21+,22+,23+/m0/s1	YDHXSWOLXDIZHC-JWRSUQAPSA-N	473.25258587							103151
BRD-K52971552	LSM-11662		54649501	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21+,22-/m1/s1	XYLRKRISJMFHFX-XHCHQYRPSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K52971552	BRD-K52971552-001-01-4	Broad Institute of MIT and Harvard	BRD-K52971552			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21+,22-/m1/s1	XYLRKRISJMFHFX-XHCHQYRPSA-N	473.25258587							100287
BRD-K54051742	LSM-11719		56835567	InChI=1S/C30H41N5O3S/c1-30(2,3)39(38)35-21-24-20-25(29(37)34-16-14-33(6)15-17-34)31-28(27(24)26(35)12-18-36)23-11-7-9-22(19-23)10-8-13-32(4)5/h7,9,11,19-20,26,36H,12-18,21H2,1-6H3/t26-,39?/m1/s1	QCNBEPOSGGBTKG-ZFPLWWAGSA-N	CN(C)CC#Cc1cccc(c1)c2nc(cc3CN([C@H](CCO)c23)S(=O)C(C)(C)C)C(=O)N4CCN(C)CC4	BroadT	BRD-K54051742	BRD-K54051742-001-03-0	Broad Institute of MIT and Harvard	BRD-K54051742			CN(C)CC#Cc1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)S(=O)C(C)(C)C)C(=O)N1CCN(C)CC1	InChI=1S/C30H41N5O3S/c1-30(2,3)39(38)35-21-24-20-25(29(37)34-16-14-33(6)15-17-34)31-28(27(24)26(35)12-18-36)23-11-7-9-22(19-23)10-8-13-32(4)5/h7,9,11,19-20,26,36H,12-18,21H2,1-6H3/t26-,39?/m1/s1	QCNBEPOSGGBTKG-ZFPLWWAGSA-N	551.293010912							100344
BRD-K64801282	LSM-12388		54649356	InChI=1S/C32H39N3O4S/c1-32(2,3)40(38)35-21-24-20-26(31(37)34-16-8-5-9-17-34)33-30(29(24)27(35)15-18-36)23-12-10-11-22(19-23)25-13-6-7-14-28(25)39-4/h6-7,10-14,19-20,27,36H,5,8-9,15-18,21H2,1-4H3/t27-,40-/m1/s1	FUQOGNZPPRJWQM-KSTXALNGSA-N	COc1ccccc1c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)N5CCCCC5	BroadT	BRD-K64801282	BRD-K64801282-001-01-6	Broad Institute of MIT and Harvard	BRD-K64801282			COc1ccccc1-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)N1CCCCC1	InChI=1S/C32H39N3O4S/c1-32(2,3)40(38)35-21-24-20-26(31(37)34-16-8-5-9-17-34)33-30(29(24)27(35)15-18-36)23-12-10-11-22(19-23)25-13-6-7-14-28(25)39-4/h6-7,10-14,19-20,27,36H,5,8-9,15-18,21H2,1-4H3/t27-,40-/m1/s1	FUQOGNZPPRJWQM-KSTXALNGSA-N	561.266127448							101015
BRD-K40073746	LSM-10874		54649498	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21+,22-/m0/s1	XYLRKRISJMFHFX-PVBJTCARSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K40073746	BRD-K40073746-001-01-1	Broad Institute of MIT and Harvard	BRD-K40073746			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21+,22-/m0/s1	XYLRKRISJMFHFX-PVBJTCARSA-N	473.25258587							99495
BRD-K73104592	LSM-43493		54649353	InChI=1S/C31H37N3O4S/c1-6-8-21-9-7-10-23(17-21)29-28-24(20-34(27(28)15-16-35)39(37)31(2,3)4)18-26(33-29)30(36)32-19-22-11-13-25(38-5)14-12-22/h6-14,17-18,27,35H,15-16,19-20H2,1-5H3,(H,32,36)/b8-6+/t27-,39-/m1/s1	CHUUKIFYUQSEQP-GVRDOCPOSA-N	COc1ccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)c4cccc(\C=C\C)c4)[S@](=O)C(C)(C)C)cc1	BroadT	BRD-K73104592	BRD-K73104592-001-01-9	Broad Institute of MIT and Harvard	BRD-K73104592			COc1ccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)-c2cccc(\C=C\C)c2)[S@](=O)C(C)(C)C)cc1	InChI=1S/C31H37N3O4S/c1-6-8-21-9-7-10-23(17-21)29-28-24(20-34(27(28)15-16-35)39(37)31(2,3)4)18-26(33-29)30(36)32-19-22-11-13-25(38-5)14-12-22/h6-14,17-18,27,35H,15-16,19-20H2,1-5H3,(H,32,36)/b8-6+/t27-,39-/m1/s1	CHUUKIFYUQSEQP-GVRDOCPOSA-N	547.250477384							
BRD-K70435062	LSM-12725		54649449	InChI=1S/C34H43N5O4S/c1-34(2,3)44(43)39-22-27-21-28(33(42)38-16-14-37(6)15-17-38)35-31(30(27)29(39)13-18-40)25-11-7-9-23(19-25)24-10-8-12-26(20-24)32(41)36(4)5/h7-12,19-21,29,40H,13-18,22H2,1-6H3/t29-,44-/m1/s1	JAGKHPQTGSVHMY-FUGCVYLMSA-N	CN(C)C(=O)c1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)N5CCN(C)CC5	BroadT	BRD-K70435062	BRD-K70435062-001-01-1	Broad Institute of MIT and Harvard	BRD-K70435062			CN(C)C(=O)c1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)N1CCN(C)CC1	InChI=1S/C34H43N5O4S/c1-34(2,3)44(43)39-22-27-21-28(33(42)38-16-14-37(6)15-17-38)35-31(30(27)29(39)13-18-40)25-11-7-9-23(19-25)24-10-8-12-26(20-24)32(41)36(4)5/h7-12,19-21,29,40H,13-18,22H2,1-6H3/t29-,44-/m1/s1	JAGKHPQTGSVHMY-FUGCVYLMSA-N	617.303575596							101361
BRD-K30214283	LSM-10252		54649556	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19-,20-/m0/s1	DXVJXLONGZUJOS-IHPCNDPISA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K30214283	BRD-K30214283-001-01-2	Broad Institute of MIT and Harvard	BRD-K30214283			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)CCCC(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-25-12-5-8-21(27)26(2)15-20-19(29-3)10-9-17(31-20)11-13-30-22-16(14-24)6-4-7-18(22)23(25)28/h4,6-7,17,19-20H,5,8-13,15H2,1-3H3/t17-,19-,20-/m0/s1	DXVJXLONGZUJOS-IHPCNDPISA-N	429.226371122							98873
BRD-K79333016	LSM-13277		54649584	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16-,18-,19+/m0/s1	LYYREMJMDQKNES-OYSPMZIOSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K79333016	BRD-K79333016-001-01-6	Broad Institute of MIT and Harvard	BRD-K79333016			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16-,18-,19+/m0/s1	LYYREMJMDQKNES-OYSPMZIOSA-N	415.210721058							101916
BRD-K57962577	LSM-11931		54649302	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15+,19+/m1/s1	GUZASBNVYSIPQO-VCBZYWHSSA-N	CO[C@@H](CN(C)C(=O)C1CC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccc(cc2)C(F)(F)F	BroadT	BRD-K57962577	BRD-K57962577-001-01-9	Broad Institute of MIT and Harvard	BRD-K57962577			CO[C@@H](CN(C)C(=O)C1CC1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccc(cc1)C(F)(F)F	InChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15+,19+/m1/s1	GUZASBNVYSIPQO-VCBZYWHSSA-N	459.234491134							100557
BRD-K97523213-001-01-1	LSM-35064	BRD-K97523213	54649315	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	ZQAIRSWGSLNDJM-HOIFWPIMSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K97523213	BRD-K97523213-001-01-1	Broad Institute of MIT and Harvard	BRD-K97523213			CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m0/s1	ZQAIRSWGSLNDJM-HOIFWPIMSA-N	552.0922335							123622
CHEMBL2362317	LSM-12520	SID131445802, BRD-K67236950	54649403	InChI=1S/C29H35N3O4S/c1-6-30-28(34)24-17-22-18-32(37(35)29(2,3)4)25(13-14-33)26(22)27(31-24)21-11-7-9-19(15-21)20-10-8-12-23(16-20)36-5/h7-12,15-17,25,33H,6,13-14,18H2,1-5H3,(H,30,34)/t25-,37-/m0/s1	YHQIULRSPQCSKT-RSUXDYMJSA-N	CCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)c4cccc(OC)c4)[S@@](=O)C(C)(C)C	BroadT	BRD-K67236950	BRD-K67236950-001-01-3	Broad Institute of MIT and Harvard	BRD-K67236950			CCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(OC)c1)[S@@](=O)C(C)(C)C	InChI=1S/C29H35N3O4S/c1-6-30-28(34)24-17-22-18-32(37(35)29(2,3)4)25(13-14-33)26(22)27(31-24)21-11-7-9-19(15-21)20-10-8-12-23(16-20)36-5/h7-12,15-17,25,33H,6,13-14,18H2,1-5H3,(H,30,34)/t25-,37-/m0/s1	YHQIULRSPQCSKT-RSUXDYMJSA-N	521.23482732							101151
BRD-K81940726	LSM-13428		54649586	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16+,18-,19+/m0/s1	LYYREMJMDQKNES-QNDJGXFYSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K81940726	BRD-K81940726-001-01-5	Broad Institute of MIT and Harvard	BRD-K81940726			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16+,18-,19+/m0/s1	LYYREMJMDQKNES-QNDJGXFYSA-N	415.210721058							102068
BRD-K71795383	LSM-12826		54649377	InChI=1S/C32H36N4O3S/c1-32(2,3)40(39)36-21-26-19-27(31(38)35-14-5-4-6-15-35)34-30(29(26)28(36)13-16-37)25-12-8-11-24(18-25)23-10-7-9-22(17-23)20-33/h7-12,17-19,28,37H,4-6,13-16,21H2,1-3H3/t28-,40-/m0/s1	QJZRVXNBJYVZFW-KJKFISAKSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(c4)C#N)c2[C@@H]1CCO)C(=O)N5CCCCC5	BroadT	BRD-K71795383	BRD-K71795383-001-01-9	Broad Institute of MIT and Harvard	BRD-K71795383			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccc(c1)C#N)C(=O)N1CCCCC1	InChI=1S/C32H36N4O3S/c1-32(2,3)40(39)36-21-26-19-27(31(38)35-14-5-4-6-15-35)34-30(29(26)28(36)13-16-37)25-12-8-11-24(18-25)23-10-7-9-22(17-23)20-33/h7-12,17-19,28,37H,4-6,13-16,21H2,1-3H3/t28-,40-/m0/s1	QJZRVXNBJYVZFW-KJKFISAKSA-N	556.250811742							101463
BRD-K07442049	LSM-8867		54649581	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19-,20-/m0/s1	WNHZFTQVONQUSH-RKOGWWSCSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K07442049	BRD-K07442049-001-01-3	Broad Institute of MIT and Harvard	BRD-K07442049			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19-,20-/m0/s1	WNHZFTQVONQUSH-RKOGWWSCSA-N	429.226371122							97488
BRD-K81527737	LSM-13404		54649490	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21+,22-/m0/s1	XYLRKRISJMFHFX-DIMUUIPOSA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K81527737	BRD-K81527737-001-01-7	Broad Institute of MIT and Harvard	BRD-K81527737			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20-,21+,22-/m0/s1	XYLRKRISJMFHFX-DIMUUIPOSA-N	473.25258587							102044
BRD-K18982118	LSM-9564		54649478	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21-,22-/m0/s1	XYLRKRISJMFHFX-GPXNVTIDSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K18982118	BRD-K18982118-001-01-1	Broad Institute of MIT and Harvard	BRD-K18982118			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21-,22-/m0/s1	XYLRKRISJMFHFX-GPXNVTIDSA-N	473.25258587							98185
BRD-K85650383	LSM-13667		54649388	InChI=1S/C34H43N5O4S/c1-34(2,3)44(43)39-22-27-21-28(33(42)38-17-15-37(6)16-18-38)35-31(30(27)29(39)14-19-40)26-9-7-8-25(20-26)23-10-12-24(13-11-23)32(41)36(4)5/h7-13,20-21,29,40H,14-19,22H2,1-6H3/t29-,44-/m1/s1	IQZRUSWQLPQALK-FUGCVYLMSA-N	CN(C)C(=O)c1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)N5CCN(C)CC5	BroadT	BRD-K85650383	BRD-K85650383-001-01-0	Broad Institute of MIT and Harvard	BRD-K85650383			CN(C)C(=O)c1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)N1CCN(C)CC1	InChI=1S/C34H43N5O4S/c1-34(2,3)44(43)39-22-27-21-28(33(42)38-17-15-37(6)16-18-38)35-31(30(27)29(39)14-19-40)26-9-7-8-25(20-26)23-10-12-24(13-11-23)32(41)36(4)5/h7-13,20-21,29,40H,14-19,22H2,1-6H3/t29-,44-/m1/s1	IQZRUSWQLPQALK-FUGCVYLMSA-N	617.303575596							102314
BRD-K98471960	LSM-14479		54649488	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21+,22-/m1/s1	XYLRKRISJMFHFX-DOYHNPMNSA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K98471960	BRD-K98471960-001-01-7	Broad Institute of MIT and Harvard	BRD-K98471960			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21+,22-/m1/s1	XYLRKRISJMFHFX-DOYHNPMNSA-N	473.25258587							103134
BRD-K80841398	LSM-13374		54649512	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22+,23+/m1/s1	YDHXSWOLXDIZHC-FFLNWOAESA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K80841398	BRD-K80841398-001-01-3	Broad Institute of MIT and Harvard	BRD-K80841398			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22+,23+/m1/s1	YDHXSWOLXDIZHC-FFLNWOAESA-N	473.25258587							102013
BRD-K86535717	LSM-13729		54649500	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21-,22+/m0/s1	XYLRKRISJMFHFX-OAVQTBGQSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K86535717	BRD-K86535717-001-01-9	Broad Institute of MIT and Harvard	BRD-K86535717			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21-,22+/m0/s1	XYLRKRISJMFHFX-OAVQTBGQSA-N	473.25258587							102378
BRD-K45336346	LSM-11187		54649320	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m0/s1	ZQAIRSWGSLNDJM-PNLZDCPESA-N	CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K45336346	BRD-K45336346-001-01-1	Broad Institute of MIT and Harvard	BRD-K45336346			CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22+/m0/s1	ZQAIRSWGSLNDJM-PNLZDCPESA-N	552.0922335							99808
BRD-K47071092	LSM-11302		56835591	InChI=1S/C29H34N2O5S/c1-6-36-28(33)24-17-22-18-31(37(34)29(2,3)4)25(13-14-32)26(22)27(30-24)21-11-7-9-19(15-21)20-10-8-12-23(16-20)35-5/h7-12,15-17,25,32H,6,13-14,18H2,1-5H3/t25-,37?/m0/s1	DOYGEULPHZGEAI-OAWRCXNGSA-N	CCOC(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)c4cccc(OC)c4)S(=O)C(C)(C)C	BroadT	BRD-K47071092	BRD-K47071092-001-03-4	Broad Institute of MIT and Harvard	BRD-K47071092			CCOC(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(OC)c1)S(=O)C(C)(C)C	InChI=1S/C29H34N2O5S/c1-6-36-28(33)24-17-22-18-31(37(34)29(2,3)4)25(13-14-32)26(22)27(30-24)21-11-7-9-19(15-21)20-10-8-12-23(16-20)35-5/h7-12,15-17,25,32H,6,13-14,18H2,1-5H3/t25-,37?/m0/s1	DOYGEULPHZGEAI-OAWRCXNGSA-N	522.218842898							99923
BRD-K81438250	LSM-13400		54649496	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21+,22+/m1/s1	XYLRKRISJMFHFX-ZGFYZEPBSA-N	CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K81438250	BRD-K81438250-001-01-4	Broad Institute of MIT and Harvard	BRD-K81438250			CO[C@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21+,22+/m1/s1	XYLRKRISJMFHFX-ZGFYZEPBSA-N	473.25258587							102040
BRD-K64920356	LSM-12393		54649339	InChI=1S/C32H37N5O3S/c1-32(2,3)41(40)37-21-26-19-27(31(39)36-15-13-35(4)14-16-36)34-30(29(26)28(37)12-17-38)25-7-5-6-24(18-25)23-10-8-22(20-33)9-11-23/h5-11,18-19,28,38H,12-17,21H2,1-4H3/t28-,41-/m0/s1	QBIQCDDCSMFVTJ-VELXTTODSA-N	CN1CCN(CC1)C(=O)c2cc3CN([C@@H](CCO)c3c(n2)c4cccc(c4)c5ccc(cc5)C#N)[S@@](=O)C(C)(C)C	BroadT	BRD-K64920356	BRD-K64920356-001-01-5	Broad Institute of MIT and Harvard	BRD-K64920356			CN1CCN(CC1)C(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1ccc(cc1)C#N)[S@@](=O)C(C)(C)C	InChI=1S/C32H37N5O3S/c1-32(2,3)41(40)37-21-26-19-27(31(39)36-15-13-35(4)14-16-36)34-30(29(26)28(37)12-17-38)25-7-5-6-24(18-25)23-10-8-22(20-33)9-11-23/h5-11,18-19,28,38H,12-17,21H2,1-4H3/t28-,41-/m0/s1	QBIQCDDCSMFVTJ-VELXTTODSA-N	571.261710784							101020
BRD-K04206413	LSM-8685		54649572	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19-,20+/m0/s1	WNHZFTQVONQUSH-MFHCWRBVSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K04206413	BRD-K04206413-001-01-3	Broad Institute of MIT and Harvard	BRD-K04206413			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19-,20+/m0/s1	WNHZFTQVONQUSH-MFHCWRBVSA-N	429.226371122							97306
BRD-K71401720	LSM-43492		54649437	InChI=1S/C31H37N3O4S/c1-6-9-21-10-7-12-23(16-21)29-28-24(20-34(27(28)14-15-35)39(37)31(2,3)4)18-26(33-29)30(36)32-19-22-11-8-13-25(17-22)38-5/h6-13,16-18,27,35H,14-15,19-20H2,1-5H3,(H,32,36)/b9-6+/t27-,39-/m0/s1	NHZALIQGAPONCQ-SRGLDOPLSA-N	COc1cccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)c4cccc(\C=C\C)c4)[S@@](=O)C(C)(C)C)c1	BroadT	BRD-K71401720	BRD-K71401720-001-01-6	Broad Institute of MIT and Harvard	BRD-K71401720			COc1cccc(CNC(=O)c2cc3CN([C@@H](CCO)c3c(n2)-c2cccc(\C=C\C)c2)[S@@](=O)C(C)(C)C)c1	InChI=1S/C31H37N3O4S/c1-6-9-21-10-7-12-23(16-21)29-28-24(20-34(27(28)14-15-35)39(37)31(2,3)4)18-26(33-29)30(36)32-19-22-11-8-13-25(17-22)38-5/h6-13,16-18,27,35H,14-15,19-20H2,1-5H3,(H,32,36)/b9-6+/t27-,39-/m0/s1	NHZALIQGAPONCQ-SRGLDOPLSA-N	547.250477384							
BRD-K79657514	LSM-13292		54649472	InChI=1S/C34H41N5O3S/c1-34(2,3)43(42)39-23-28-21-29(33(41)36-15-18-38-16-5-4-6-17-38)37-32(31(28)30(39)14-19-40)27-9-7-8-26(20-27)25-12-10-24(22-35)11-13-25/h7-13,20-21,30,40H,4-6,14-19,23H2,1-3H3,(H,36,41)/t30-,43-/m0/s1	TZEAMANOEIDNTF-IPKWWJLYSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(cc4)C#N)c2[C@@H]1CCO)C(=O)NCCN5CCCCC5	BroadT	BRD-K79657514	BRD-K79657514-001-01-5	Broad Institute of MIT and Harvard	BRD-K79657514			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccc(cc1)C#N)C(=O)NCCN1CCCCC1	InChI=1S/C34H41N5O3S/c1-34(2,3)43(42)39-23-28-21-29(33(41)36-15-18-38-16-5-4-6-17-38)37-32(31(28)30(39)14-19-40)27-9-7-8-26(20-27)25-12-10-24(22-35)11-13-25/h7-13,20-21,30,40H,4-6,14-19,23H2,1-3H3,(H,36,41)/t30-,43-/m0/s1	TZEAMANOEIDNTF-IPKWWJLYSA-N	599.293010912							101931
BRD-K29547084	LSM-10220		54649451	InChI=1S/C32H36N4O3S/c1-32(2,3)40(39)36-21-26-19-27(31(38)35-15-5-4-6-16-35)34-30(29(26)28(36)14-17-37)25-9-7-8-24(18-25)23-12-10-22(20-33)11-13-23/h7-13,18-19,28,37H,4-6,14-17,21H2,1-3H3/t28-,40-/m1/s1	XBUYKONZLQYBJN-VAJZRNNVSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(cc4)C#N)c2[C@H]1CCO)C(=O)N5CCCCC5	BroadT	BRD-K29547084	BRD-K29547084-001-01-9	Broad Institute of MIT and Harvard	BRD-K29547084			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccc(cc1)C#N)C(=O)N1CCCCC1	InChI=1S/C32H36N4O3S/c1-32(2,3)40(39)36-21-26-19-27(31(38)35-15-5-4-6-16-35)34-30(29(26)28(36)14-17-37)25-9-7-8-24(18-25)23-12-10-22(20-33)11-13-23/h7-13,18-19,28,37H,4-6,14-17,21H2,1-3H3/t28-,40-/m1/s1	XBUYKONZLQYBJN-VAJZRNNVSA-N	556.250811742							98841
BRD-K73575094	LSM-12938		54649340	InChI=1S/C32H37N5O3S/c1-32(2,3)41(40)37-21-26-19-27(31(39)36-15-13-35(4)14-16-36)34-30(29(26)28(37)12-17-38)25-7-5-6-24(18-25)23-10-8-22(20-33)9-11-23/h5-11,18-19,28,38H,12-17,21H2,1-4H3/t28-,41-/m1/s1	QBIQCDDCSMFVTJ-GIEABIOQSA-N	CN1CCN(CC1)C(=O)c2cc3CN([C@H](CCO)c3c(n2)c4cccc(c4)c5ccc(cc5)C#N)[S@](=O)C(C)(C)C	BroadT	BRD-K73575094	BRD-K73575094-001-01-3	Broad Institute of MIT and Harvard	BRD-K73575094			CN1CCN(CC1)C(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)-c1ccc(cc1)C#N)[S@](=O)C(C)(C)C	InChI=1S/C32H37N5O3S/c1-32(2,3)41(40)37-21-26-19-27(31(39)36-15-13-35(4)14-16-36)34-30(29(26)28(37)12-17-38)25-7-5-6-24(18-25)23-10-8-22(20-33)9-11-23/h5-11,18-19,28,38H,12-17,21H2,1-4H3/t28-,41-/m1/s1	QBIQCDDCSMFVTJ-GIEABIOQSA-N	571.261710784							101575
BRD-K00381581	LSM-8449		54649295	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m1/s1	DYSXQKGXYVAXRN-HYFFOGBASA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K00381581	BRD-K00381581-001-01-4	Broad Institute of MIT and Harvard	BRD-K00381581			CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22-/m1/s1	DYSXQKGXYVAXRN-HYFFOGBASA-N	499.195248212							97070
BRD-K04237106	LSM-8688		54649517	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22+,23+/m1/s1	YDHXSWOLXDIZHC-MQRVUQIVSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	BroadT	BRD-K04237106	BRD-K04237106-001-01-0	Broad Institute of MIT and Harvard	BRD-K04237106			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18+,21-,22+,23+/m1/s1	YDHXSWOLXDIZHC-MQRVUQIVSA-N	473.25258587							97309
BRD-K69649444	LSM-12677		54649539	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25+,26-/m0/s1	DIIJYNJFSHJSFY-JMQONQOQSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@@H]1O2)c4ccccc4)C#N	BroadT	BRD-K69649444	BRD-K69649444-001-02-7	Broad Institute of MIT and Harvard	BRD-K69649444			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25+,26-/m0/s1	DIIJYNJFSHJSFY-JMQONQOQSA-N	505.25767125							101311
BRD-K84586204	LSM-13598		56835575	InChI=1S/C33H41FN4O4S/c1-33(2,3)43(41)38-22-26-21-28(32(40)35-12-6-13-37-14-17-42-18-15-37)36-31(30(26)29(38)11-16-39)25-9-4-7-23(19-25)24-8-5-10-27(34)20-24/h4-5,7-10,19-21,29,39H,6,11-18,22H2,1-3H3,(H,35,40)/t29-,43?/m1/s1	LANWNDDZUXSLHG-CSOJFCJSSA-N	CC(C)(C)S(=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(F)c4)c2[C@H]1CCO)C(=O)NCCCN5CCOCC5	BroadT	BRD-K84586204	BRD-K84586204-001-03-0	Broad Institute of MIT and Harvard	BRD-K84586204			CC(C)(C)S(=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccc(F)c1)C(=O)NCCCN1CCOCC1	InChI=1S/C33H41FN4O4S/c1-33(2,3)43(41)38-22-26-21-28(32(40)35-12-6-13-37-14-17-42-18-15-37)36-31(30(26)29(38)11-16-39)25-9-4-7-23(19-25)24-8-5-10-27(34)20-24/h4-5,7-10,19-21,29,39H,6,11-18,22H2,1-3H3,(H,35,40)/t29-,43?/m1/s1	LANWNDDZUXSLHG-CSOJFCJSSA-N	608.283254722							102242
BRD-K00449983	LSM-43442		54649441	InChI=1S/C30H35N3O3S/c1-5-10-21-13-9-14-23(17-21)28-27-24(20-33(26(27)15-16-34)37(36)30(2,3)4)18-25(32-28)29(35)31-19-22-11-7-6-8-12-22/h5-14,17-18,26,34H,15-16,19-20H2,1-4H3,(H,31,35)/b10-5+/t26-,37-/m1/s1	RNIGAGNWOYTJAX-FVKILAAISA-N	C\C=C\c1cccc(c1)c2nc(cc3CN([C@H](CCO)c23)[S@](=O)C(C)(C)C)C(=O)NCc4ccccc4	BroadT	BRD-K00449983	BRD-K00449983-001-01-3	Broad Institute of MIT and Harvard	BRD-K00449983			C\C=C\c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)NCc1ccccc1	InChI=1S/C30H35N3O3S/c1-5-10-21-13-9-14-23(17-21)28-27-24(20-33(26(27)15-16-34)37(36)30(2,3)4)18-25(32-28)29(35)31-19-22-11-7-6-8-12-22/h5-14,17-18,26,34H,15-16,19-20H2,1-4H3,(H,31,35)/b10-5+/t26-,37-/m1/s1	RNIGAGNWOYTJAX-FVKILAAISA-N	517.2399127							
BRD-K60073229	LSM-12061		54649587	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16-,18+,19-/m1/s1	LYYREMJMDQKNES-SKWUIDRYSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)[C@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K60073229	BRD-K60073229-001-01-2	Broad Institute of MIT and Harvard	BRD-K60073229			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)[C@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16-,18+,19-/m1/s1	LYYREMJMDQKNES-SKWUIDRYSA-N	415.210721058							100687
BRD-K02785641	LSM-8609		54649357	InChI=1S/C30H34FN3O3S/c1-30(2,3)38(37)34-18-21-17-25(29(36)32-22-10-7-11-22)33-28(27(21)26(34)14-15-35)20-9-6-8-19(16-20)23-12-4-5-13-24(23)31/h4-6,8-9,12-13,16-17,22,26,35H,7,10-11,14-15,18H2,1-3H3,(H,32,36)/t26-,38-/m0/s1	PZROTEJUFYWVHW-WTMVGVENSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccccc4F)c2[C@@H]1CCO)C(=O)NC5CCC5	BroadT	BRD-K02785641	BRD-K02785641-001-01-2	Broad Institute of MIT and Harvard	BRD-K02785641			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccccc1F)C(=O)NC1CCC1	InChI=1S/C30H34FN3O3S/c1-30(2,3)38(37)34-18-21-17-25(29(36)32-22-10-7-11-22)33-28(27(21)26(34)14-15-35)20-9-6-8-19(16-20)23-12-4-5-13-24(23)31/h4-6,8-9,12-13,16-17,22,26,35H,7,10-11,14-15,18H2,1-3H3,(H,32,36)/t26-,38-/m0/s1	PZROTEJUFYWVHW-WTMVGVENSA-N	535.230490868							97230
BRD-K17525686	LSM-9481		54649364	InChI=1S/C34H35N5O3S/c1-34(2,3)43(42)39-22-28-20-29(33(41)37-17-13-23-11-15-36-16-12-23)38-32(31(28)30(39)14-18-40)27-6-4-5-26(19-27)25-9-7-24(21-35)8-10-25/h4-12,15-16,19-20,30,40H,13-14,17-18,22H2,1-3H3,(H,37,41)/t30-,43-/m0/s1	SEESJXJXYIRQQP-IPKWWJLYSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccc(cc4)C#N)c2[C@@H]1CCO)C(=O)NCCc5ccncc5	BroadT	BRD-K17525686	BRD-K17525686-001-01-1	Broad Institute of MIT and Harvard	BRD-K17525686			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccc(cc1)C#N)C(=O)NCCc1ccncc1	InChI=1S/C34H35N5O3S/c1-34(2,3)43(42)39-22-28-20-29(33(41)37-17-13-23-11-15-36-16-12-23)38-32(31(28)30(39)14-18-40)27-6-4-5-26(19-27)25-9-7-24(21-35)8-10-25/h4-12,15-16,19-20,30,40H,13-14,17-18,22H2,1-3H3,(H,37,41)/t30-,43-/m0/s1	SEESJXJXYIRQQP-IPKWWJLYSA-N	593.24606072							98102
BRD-K29054201	LSM-10190		54649492	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21-,22+/m1/s1	XYLRKRISJMFHFX-GBKCLDHKSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K29054201	BRD-K29054201-001-01-4	Broad Institute of MIT and Harvard	BRD-K29054201			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18-,20+,21-,22+/m1/s1	XYLRKRISJMFHFX-GBKCLDHKSA-N	473.25258587							98811
BRD-K98419480	LSM-14476		54649358	InChI=1S/C30H34FN3O3S/c1-30(2,3)38(37)34-18-21-17-25(29(36)32-22-10-7-11-22)33-28(27(21)26(34)14-15-35)20-9-6-8-19(16-20)23-12-4-5-13-24(23)31/h4-6,8-9,12-13,16-17,22,26,35H,7,10-11,14-15,18H2,1-3H3,(H,32,36)/t26-,38-/m1/s1	PZROTEJUFYWVHW-UOBPVEMNSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccccc4F)c2[C@H]1CCO)C(=O)NC5CCC5	BroadT	BRD-K98419480	BRD-K98419480-001-01-7	Broad Institute of MIT and Harvard	BRD-K98419480			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccccc1F)C(=O)NC1CCC1	InChI=1S/C30H34FN3O3S/c1-30(2,3)38(37)34-18-21-17-25(29(36)32-22-10-7-11-22)33-28(27(21)26(34)14-15-35)20-9-6-8-19(16-20)23-12-4-5-13-24(23)31/h4-6,8-9,12-13,16-17,22,26,35H,7,10-11,14-15,18H2,1-3H3,(H,32,36)/t26-,38-/m1/s1	PZROTEJUFYWVHW-UOBPVEMNSA-N	535.230490868							103131
BRD-K48719132	LSM-11397		56835580	InChI=1S/C33H41FN4O4S/c1-33(2,3)43(41)38-22-26-21-28(32(40)35-12-6-13-37-14-17-42-18-15-37)36-31(30(26)29(38)11-16-39)25-9-4-7-23(19-25)24-8-5-10-27(34)20-24/h4-5,7-10,19-21,29,39H,6,11-18,22H2,1-3H3,(H,35,40)/t29-,43?/m0/s1	LANWNDDZUXSLHG-APZRGAJHSA-N	CC(C)(C)S(=O)N1Cc2cc(nc(c3cccc(c3)c4cccc(F)c4)c2[C@@H]1CCO)C(=O)NCCCN5CCOCC5	BroadT	BRD-K48719132	BRD-K48719132-001-03-9	Broad Institute of MIT and Harvard	BRD-K48719132			CC(C)(C)S(=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccc(F)c1)C(=O)NCCCN1CCOCC1	InChI=1S/C33H41FN4O4S/c1-33(2,3)43(41)38-22-26-21-28(32(40)35-12-6-13-37-14-17-42-18-15-37)36-31(30(26)29(38)11-16-39)25-9-4-7-23(19-25)24-8-5-10-27(34)20-24/h4-5,7-10,19-21,29,39H,6,11-18,22H2,1-3H3,(H,35,40)/t29-,43?/m0/s1	LANWNDDZUXSLHG-APZRGAJHSA-N	608.283254722							100018
BRD-K16813995	LSM-9448		54649534	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22+,23+/m0/s1	YDHXSWOLXDIZHC-VCWCBOTFSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K16813995	BRD-K16813995-001-01-8	Broad Institute of MIT and Harvard	BRD-K16813995			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22+,23+/m0/s1	YDHXSWOLXDIZHC-VCWCBOTFSA-N	473.25258587							98069
BRD-K29493594-001-01-9	LSM-35065	BRD-K29493594	54649293	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22-/m0/s1	DYSXQKGXYVAXRN-HOIFWPIMSA-N	CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K29493594	BRD-K29493594-001-01-9	Broad Institute of MIT and Harvard	BRD-K29493594			CO[C@@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17-,22-/m0/s1	DYSXQKGXYVAXRN-HOIFWPIMSA-N	499.195248212							123623
BRD-K08663380	LSM-8951		54649335	InChI=1S/C35H44N4O4S/c1-35(2,3)44(43)39-22-27-21-29(33(41)36-28-15-7-6-8-16-28)37-32(31(27)30(39)17-18-40)25-13-9-11-23(19-25)24-12-10-14-26(20-24)34(42)38(4)5/h9-14,19-21,28,30,40H,6-8,15-18,22H2,1-5H3,(H,36,41)/t30-,44-/m1/s1	YEVZUBCSLLXCKN-FSZSIQPOSA-N	CN(C)C(=O)c1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)NC5CCCCC5	BroadT	BRD-K08663380	BRD-K08663380-001-01-0	Broad Institute of MIT and Harvard	BRD-K08663380			CN(C)C(=O)c1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)NC1CCCCC1	InChI=1S/C35H44N4O4S/c1-35(2,3)44(43)39-22-27-21-29(33(41)36-28-15-7-6-8-16-28)37-32(31(27)30(39)17-18-40)25-13-9-11-23(19-25)24-12-10-14-26(20-24)34(42)38(4)5/h9-14,19-21,28,30,40H,6-8,15-18,22H2,1-5H3,(H,36,41)/t30-,44-/m1/s1	YEVZUBCSLLXCKN-FSZSIQPOSA-N	616.308326618							97572
BRD-K85297660	LSM-13645		54649580	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19+,20+/m1/s1	WNHZFTQVONQUSH-BEKAIBRUSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@@H]1O2)C#N	BroadT	BRD-K85297660	BRD-K85297660-001-01-4	Broad Institute of MIT and Harvard	BRD-K85297660			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17-,19+,20+/m1/s1	WNHZFTQVONQUSH-BEKAIBRUSA-N	429.226371122							102292
BRD-K38186418	LSM-10740		54649481	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21-,22+/m0/s1	XYLRKRISJMFHFX-FVQLTZBISA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	BroadT	BRD-K38186418	BRD-K38186418-001-01-2	Broad Institute of MIT and Harvard	BRD-K38186418			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20+,21-,22+/m0/s1	XYLRKRISJMFHFX-FVQLTZBISA-N	473.25258587							99361
BRD-K40521754	LSM-10904		54649387	InChI=1S/C34H43N5O4S/c1-34(2,3)44(43)39-22-27-21-28(33(42)38-17-15-37(6)16-18-38)35-31(30(27)29(39)14-19-40)26-9-7-8-25(20-26)23-10-12-24(13-11-23)32(41)36(4)5/h7-13,20-21,29,40H,14-19,22H2,1-6H3/t29-,44-/m0/s1	IQZRUSWQLPQALK-RGLUPAHUSA-N	CN(C)C(=O)c1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)N5CCN(C)CC5	BroadT	BRD-K40521754	BRD-K40521754-001-01-8	Broad Institute of MIT and Harvard	BRD-K40521754			CN(C)C(=O)c1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)N1CCN(C)CC1	InChI=1S/C34H43N5O4S/c1-34(2,3)44(43)39-22-27-21-28(33(42)38-17-15-37(6)16-18-38)35-31(30(27)29(39)14-19-40)26-9-7-8-25(20-26)23-10-12-24(13-11-23)32(41)36(4)5/h7-13,20-21,29,40H,14-19,22H2,1-6H3/t29-,44-/m0/s1	IQZRUSWQLPQALK-RGLUPAHUSA-N	617.303575596							99525
BRD-K05733208	LSM-8768		54649323	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	JTCZGLOUSBJUER-DRSNIGMVSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c2cccc(Cl)c2	BroadT	BRD-K05733208	BRD-K05733208-001-01-4	Broad Institute of MIT and Harvard	BRD-K05733208			CO[C@H](CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)CN([C@H](C)CO)S(=O)(=O)c1cccc(Cl)c1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)21-7-5-6-19(24)12-21)22(32-4)14-25(3)33(28,29)20-10-8-18(23)9-11-20/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17-,22-/m1/s1	JTCZGLOUSBJUER-DRSNIGMVSA-N	552.0922335							97389
BRD-K70469022	LSM-12728		54649370	InChI=1S/C33H40N4O5S/c1-33(2,3)43(41)37-21-26-20-27(32(40)36-13-16-42-17-14-36)34-30(29(26)28(37)12-15-38)24-10-6-8-22(18-24)23-9-7-11-25(19-23)31(39)35(4)5/h6-11,18-20,28,38H,12-17,21H2,1-5H3/t28-,43-/m0/s1	FSDPWXFWDMXQOK-SBWXIOHRSA-N	CN(C)C(=O)c1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)N5CCOCC5	BroadT	BRD-K70469022	BRD-K70469022-001-01-9	Broad Institute of MIT and Harvard	BRD-K70469022			CN(C)C(=O)c1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)N1CCOCC1	InChI=1S/C33H40N4O5S/c1-33(2,3)43(41)37-21-26-20-27(32(40)36-13-16-42-17-14-36)34-30(29(26)28(37)12-15-38)24-10-6-8-22(18-24)23-9-7-11-25(19-23)31(39)35(4)5/h6-11,18-20,28,38H,12-17,21H2,1-5H3/t28-,43-/m0/s1	FSDPWXFWDMXQOK-SBWXIOHRSA-N	604.27194111							101364
BRD-K63607326	LSM-12303		54649524	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22-,23-/m1/s1	YDHXSWOLXDIZHC-PQRDQUNWSA-N	CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K63607326	BRD-K63607326-001-01-6	Broad Institute of MIT and Harvard	BRD-K63607326			CO[C@@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21-,22-,23-/m1/s1	YDHXSWOLXDIZHC-PQRDQUNWSA-N	473.25258587							100930
BRD-K05356589	LSM-8745		54649417	InChI=1S/C34H36N4O3S/c1-34(2,3)42(41)38-22-28-20-29(33(40)37-17-13-23-7-4-5-8-27(23)21-37)36-32(31(28)30(38)14-18-39)26-10-6-9-25(19-26)24-11-15-35-16-12-24/h4-12,15-16,19-20,30,39H,13-14,17-18,21-22H2,1-3H3/t30-,42-/m0/s1	HAAGBLBLWADVDZ-MIKJVJEASA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccncc4)c2[C@@H]1CCO)C(=O)N5CCc6ccccc6C5	BroadT	BRD-K05356589	BRD-K05356589-001-01-3	Broad Institute of MIT and Harvard	BRD-K05356589			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccncc1)C(=O)N1CCc2ccccc2C1	InChI=1S/C34H36N4O3S/c1-34(2,3)42(41)38-22-28-20-29(33(40)37-17-13-23-7-4-5-8-27(23)21-37)36-32(31(28)30(38)14-18-39)26-10-6-9-25(19-26)24-11-15-35-16-12-24/h4-12,15-16,19-20,30,39H,13-14,17-18,21-22H2,1-3H3/t30-,42-/m0/s1	HAAGBLBLWADVDZ-MIKJVJEASA-N	580.250811742							97366
CHEMBL3184674	LSM-8534	BRD-K01594626	54649352	InChI=1S/C31H32FN5O3S/c1-31(2,3)41(40)37-18-23-14-26(30(39)35-17-22-7-4-5-10-25(22)32)36-29(28(23)27(37)11-12-38)21-9-6-8-20(13-21)24-15-33-19-34-16-24/h4-10,13-16,19,27,38H,11-12,17-18H2,1-3H3,(H,35,39)/t27-,41-/m0/s1	YBJDMCPYPJWKRF-JNGYJVBXSA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cncnc4)c2[C@@H]1CCO)C(=O)NCc5ccccc5F	BroadT	BRD-K01594626	BRD-K01594626-001-01-8	Broad Institute of MIT and Harvard	BRD-K01594626			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cncnc1)C(=O)NCc1ccccc1F	InChI=1S/C31H32FN5O3S/c1-31(2,3)41(40)37-18-23-14-26(30(39)35-17-22-7-4-5-10-25(22)32)36-29(28(23)27(37)11-12-38)21-9-6-8-20(13-21)24-15-33-19-34-16-24/h4-10,13-16,19,27,38H,11-12,17-18H2,1-3H3,(H,35,39)/t27-,41-/m0/s1	YBJDMCPYPJWKRF-JNGYJVBXSA-N	573.220988824							97155
CHEMBL2358300	LSM-11768	BRD-K55100062, SID131445717	54649318	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m0/s1	ZQAIRSWGSLNDJM-GSHUGGBRSA-N	CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K55100062	BRD-K55100062-001-01-0	Broad Institute of MIT and Harvard	BRD-K55100062			CO[C@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m0/s1	ZQAIRSWGSLNDJM-GSHUGGBRSA-N	552.0922335							100393
BRD-K63521663	LSM-12296		54649453	InChI=1S/C29H32F3N3O4S/c1-28(2,3)40(38)35-16-21-15-23(27(37)33-17-29(30,31)32)34-26(25(21)24(35)11-12-36)20-9-5-7-18(13-20)19-8-6-10-22(14-19)39-4/h5-10,13-15,24,36H,11-12,16-17H2,1-4H3,(H,33,37)/t24-,40-/m1/s1	ZACPEVQRHPQJRQ-MMVPYHRJSA-N	COc1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)NCC(F)(F)F	BroadT	BRD-K63521663	BRD-K63521663-001-01-0	Broad Institute of MIT and Harvard	BRD-K63521663			COc1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)NCC(F)(F)F	InChI=1S/C29H32F3N3O4S/c1-28(2,3)40(38)35-16-21-15-23(27(37)33-17-29(30,31)32)34-26(25(21)24(35)11-12-36)20-9-5-7-18(13-20)19-8-6-10-22(14-19)39-4/h5-10,13-15,24,36H,11-12,16-17H2,1-4H3,(H,33,37)/t24-,40-/m1/s1	ZACPEVQRHPQJRQ-MMVPYHRJSA-N	575.206561824							100923
BRD-K68849294	LSM-12631		54649402	InChI=1S/C27H35N3O3S/c1-27(2,3)34(33)30-17-21-16-22(26(32)29(4)5)28-25(24(21)23(30)13-14-31)20-12-8-11-19(15-20)18-9-6-7-10-18/h8-9,11-12,15-16,23,31H,6-7,10,13-14,17H2,1-5H3/t23-,34-/m0/s1	PGDAOJJPUPXGSS-HUBRWUETSA-N	CN(C)C(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)C4=CCCC4)[S@@](=O)C(C)(C)C	BroadT	BRD-K68849294	BRD-K68849294-001-01-7	Broad Institute of MIT and Harvard	BRD-K68849294			CN(C)C(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)C1=CCCC1)[S@@](=O)C(C)(C)C	InChI=1S/C27H35N3O3S/c1-27(2,3)34(33)30-17-21-16-22(26(32)29(4)5)28-25(24(21)23(30)13-14-31)20-12-8-11-19(15-20)18-9-6-7-10-18/h8-9,11-12,15-16,23,31H,6-7,10,13-14,17H2,1-5H3/t23-,34-/m0/s1	PGDAOJJPUPXGSS-HUBRWUETSA-N	481.2399127							101264
BRD-K15935695	LSM-9381		54649491	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21+,22-/m0/s1	XYLRKRISJMFHFX-KRIDKZTMSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	BroadT	BRD-K15935695	BRD-K15935695-001-01-3	Broad Institute of MIT and Harvard	BRD-K15935695			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@@H](C)[C@@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@@H]1O2)OC	InChI=1S/C25H35N3O6/c1-16-21(32-5)14-28(3)25(30)19-8-6-7-17(13-26)23(19)33-15-22-20(31-4)10-9-18(34-22)11-12-27(2)24(16)29/h6-8,16,18,20-22H,9-12,14-15H2,1-5H3/t16-,18+,20-,21+,22-/m0/s1	XYLRKRISJMFHFX-KRIDKZTMSA-N	473.25258587							98002
BRD-K87920375	LSM-13827		54649571	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19+,20-/m1/s1	WNHZFTQVONQUSH-DJABAAGCSA-N	CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K87920375	BRD-K87920375-001-01-5	Broad Institute of MIT and Harvard	BRD-K87920375			CO[C@H]1CC[C@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C23H31N3O5/c1-15-13-25(2)23(28)18-7-5-6-16(12-24)21(18)30-11-10-17-8-9-19(29-4)20(31-17)14-26(3)22(15)27/h5-7,15,17,19-20H,8-11,13-14H2,1-4H3/t15-,17+,19+,20-/m1/s1	WNHZFTQVONQUSH-DJABAAGCSA-N	429.226371122							102477
BRD-K16348047	LSM-9416		54649350	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-24-7-5-10-29(17-24)43-4)38-33(32(28)31(39)15-16-40)27-9-6-8-26(18-27)25-13-11-23(20-36)12-14-25/h5-14,17-19,31,40H,15-16,21-22H2,1-4H3,(H,37,41)/t31-,44-/m1/s1	PAVPSZKVOXNNCU-VRESAINUSA-N	COc1cccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)c4cccc(c4)c5ccc(cc5)C#N)[S@](=O)C(C)(C)C)c1	BroadT	BRD-K16348047	BRD-K16348047-001-01-3	Broad Institute of MIT and Harvard	BRD-K16348047			COc1cccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)-c2cccc(c2)-c2ccc(cc2)C#N)[S@](=O)C(C)(C)C)c1	InChI=1S/C35H36N4O4S/c1-35(2,3)44(42)39-22-28-19-30(34(41)37-21-24-7-5-10-29(17-24)43-4)38-33(32(28)31(39)15-16-40)27-9-6-8-26(18-27)25-13-11-23(20-36)12-14-25/h5-14,17-19,31,40H,15-16,21-22H2,1-4H3,(H,37,41)/t31-,44-/m1/s1	PAVPSZKVOXNNCU-VRESAINUSA-N	608.245726362							98037
CHEMBL3182780	LSM-13024	BRD-K75012089	56835569	InChI=1S/C27H35N3O4S/c1-7-34-26(32)22-17-21-18-30(35(33)27(2,3)4)23(13-15-31)24(21)25(28-22)20-12-8-10-19(16-20)11-9-14-29(5)6/h8,10,12,16-17,23,31H,7,13-15,18H2,1-6H3/t23-,35?/m1/s1	GWVPGXSETGAAGJ-MMHRDOBHSA-N	CCOC(=O)c1cc2CN([C@H](CCO)c2c(n1)c3cccc(c3)C#CCN(C)C)S(=O)C(C)(C)C	BroadT	BRD-K75012089	BRD-K75012089-001-03-8	Broad Institute of MIT and Harvard	BRD-K75012089			CCOC(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)C#CCN(C)C)S(=O)C(C)(C)C	InChI=1S/C27H35N3O4S/c1-7-34-26(32)22-17-21-18-30(35(33)27(2,3)4)23(13-15-31)24(21)25(28-22)20-12-8-10-19(16-20)11-9-14-29(5)6/h8,10,12,16-17,23,31H,7,13-15,18H2,1-6H3/t23-,35?/m1/s1	GWVPGXSETGAAGJ-MMHRDOBHSA-N	497.23482732							101661
BRD-K36777393	LSM-10654		54649317	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m1/s1	ZQAIRSWGSLNDJM-JLHGSKIFSA-N	CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c2ccc(Cl)cc2	BroadT	BRD-K36777393	BRD-K36777393-001-01-9	Broad Institute of MIT and Harvard	BRD-K36777393			CO[C@@H](CN(C)S(=O)(=O)c1cccc(Cl)c1)[C@H](C)CN([C@@H](C)CO)S(=O)(=O)c1ccc(Cl)cc1	InChI=1S/C22H30Cl2N2O6S2/c1-16(13-26(17(2)15-27)34(30,31)20-10-8-18(23)9-11-20)22(32-4)14-25(3)33(28,29)21-7-5-6-19(24)12-21/h5-12,16-17,22,27H,13-15H2,1-4H3/t16-,17+,22+/m1/s1	ZQAIRSWGSLNDJM-JLHGSKIFSA-N	552.0922335							99275
BRD-K06935006	LSM-8841		54649546	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25-,26+/m1/s1	DIIJYNJFSHJSFY-YUEVXQQWSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@@H]1O2)c4ccccc4)C#N	BroadT	BRD-K06935006	BRD-K06935006-001-01-8	Broad Institute of MIT and Harvard	BRD-K06935006			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@@H](CC(=O)N(C)C[C@@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23-,25-,26+/m1/s1	DIIJYNJFSHJSFY-YUEVXQQWSA-N	505.25767125							97462
BRD-K93602295	LSM-14166		54649562	InChI=1S/C28H39N3O5/c1-30-18-24-23(34-3)11-10-21(36-24)12-15-35-26-20(17-29)8-7-9-22(26)27(33)31(2)19-28(16-25(30)32)13-5-4-6-14-28/h7-9,21,23-24H,4-6,10-16,18-19H2,1-3H3/t21-,23-,24-/m1/s1	NNLRSZHLKPFWRY-GMKZXUHWSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CC4(CCCCC4)CC(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K93602295	BRD-K93602295-001-01-8	Broad Institute of MIT and Harvard	BRD-K93602295			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)CC3(CCCCC3)CC(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C28H39N3O5/c1-30-18-24-23(34-3)11-10-21(36-24)12-15-35-26-20(17-29)8-7-9-22(26)27(33)31(2)19-28(16-25(30)32)13-5-4-6-14-28/h7-9,21,23-24H,4-6,10-16,18-19H2,1-3H3/t21-,23-,24-/m1/s1	NNLRSZHLKPFWRY-GMKZXUHWSA-N	497.288971378							102820
BRD-K77316712	LSM-13156		54649296	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22+/m0/s1	DYSXQKGXYVAXRN-GSHUGGBRSA-N	CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc2ccccc2F	BroadT	BRD-K77316712	BRD-K77316712-001-01-0	Broad Institute of MIT and Harvard	BRD-K77316712			CO[C@H](CN(C)S(=O)(=O)c1ccc(F)cc1)[C@@H](C)CN([C@H](C)CO)C(=O)Nc1ccccc1F	InChI=1S/C23H31F2N3O5S/c1-16(13-28(17(2)15-29)23(30)26-21-8-6-5-7-20(21)25)22(33-4)14-27(3)34(31,32)19-11-9-18(24)10-12-19/h5-12,16-17,22,29H,13-15H2,1-4H3,(H,26,30)/t16-,17+,22+/m0/s1	DYSXQKGXYVAXRN-GSHUGGBRSA-N	499.195248212							101794
BRD-K78420710	LSM-13223		54649588	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16+,18+,19+/m0/s1	LYYREMJMDQKNES-RGIVZKHGSA-N	CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	BroadT	BRD-K78420710	BRD-K78420710-001-01-1	Broad Institute of MIT and Harvard	BRD-K78420710			CO[C@@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)[C@@H](C)C(=O)N(C)C[C@H]1O2)C#N	InChI=1S/C22H29N3O5/c1-14-21(26)24(2)13-19-18(28-4)9-8-16(30-19)10-11-29-20-15(12-23)6-5-7-17(20)22(27)25(14)3/h5-7,14,16,18-19H,8-11,13H2,1-4H3/t14-,16+,18+,19+/m0/s1	LYYREMJMDQKNES-RGIVZKHGSA-N	415.210721058							101862
BRD-K93112400	LSM-14140		54649412	InChI=1S/C28H32FN3O3S/c1-5-30-27(34)23-16-21-17-32(36(35)28(2,3)4)24(12-13-33)25(21)26(31-23)20-10-6-8-18(14-20)19-9-7-11-22(29)15-19/h6-11,14-16,24,33H,5,12-13,17H2,1-4H3,(H,30,34)/t24-,36-/m0/s1	NQAKFRRPCXCRFS-TVYQXRCNSA-N	CCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)c3cccc(c3)c4cccc(F)c4)[S@@](=O)C(C)(C)C	BroadT	BRD-K93112400	BRD-K93112400-001-01-0	Broad Institute of MIT and Harvard	BRD-K93112400			CCNC(=O)c1cc2CN([C@@H](CCO)c2c(n1)-c1cccc(c1)-c1cccc(F)c1)[S@@](=O)C(C)(C)C	InChI=1S/C28H32FN3O3S/c1-5-30-27(34)23-16-21-17-32(36(35)28(2,3)4)24(12-13-33)25(21)26(31-23)20-10-6-8-18(14-20)19-9-7-11-22(29)15-19/h6-11,14-16,24,33H,5,12-13,17H2,1-4H3,(H,30,34)/t24-,36-/m0/s1	NQAKFRRPCXCRFS-TVYQXRCNSA-N	509.214840804							102794
BRD-K70918484	LSM-12760		54649531	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22-,23-/m1/s1	YDHXSWOLXDIZHC-SSPLDBJCSA-N	CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K70918484	BRD-K70918484-001-01-6	Broad Institute of MIT and Harvard	BRD-K70918484			CO[C@H]1CC[C@@H]2CCN(C)C(=O)[C@H](C)[C@@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22-,23-/m1/s1	YDHXSWOLXDIZHC-SSPLDBJCSA-N	473.25258587							101397
BRD-K68796015	LSM-12628		54649432	InChI=1S/C32H40N4O4S/c1-32(2,3)41(39)36-21-24-20-26(31(38)35-16-14-34(4)15-17-35)33-30(29(24)27(36)13-18-37)23-10-8-9-22(19-23)25-11-6-7-12-28(25)40-5/h6-12,19-20,27,37H,13-18,21H2,1-5H3/t27-,41-/m0/s1	XPPDMEIYHITZLE-JNGYJVBXSA-N	COc1ccccc1c2cccc(c2)c3nc(cc4CN([C@@H](CCO)c34)[S@@](=O)C(C)(C)C)C(=O)N5CCN(C)CC5	BroadT	BRD-K68796015	BRD-K68796015-001-01-8	Broad Institute of MIT and Harvard	BRD-K68796015			COc1ccccc1-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)N1CCN(C)CC1	InChI=1S/C32H40N4O4S/c1-32(2,3)41(39)36-21-24-20-26(31(38)35-16-14-34(4)15-17-35)33-30(29(24)27(36)13-18-37)23-10-8-9-22(19-23)25-11-6-7-12-28(25)40-5/h6-12,19-20,27,37H,13-18,21H2,1-5H3/t27-,41-/m0/s1	XPPDMEIYHITZLE-JNGYJVBXSA-N	576.27702649							101261
BRD-K66857873	LSM-12502		54649532	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22-,23+/m0/s1	YDHXSWOLXDIZHC-UOXSANAJSA-N	CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	BroadT	BRD-K66857873	BRD-K66857873-001-01-1	Broad Institute of MIT and Harvard	BRD-K66857873			CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cc(ccc3OC[C@H]1O2)C#N)OC	InChI=1S/C25H35N3O6/c1-16-22(32-5)14-28(3)25(30)19-12-17(13-26)6-8-20(19)33-15-23-21(31-4)9-7-18(34-23)10-11-27(2)24(16)29/h6,8,12,16,18,21-23H,7,9-11,14-15H2,1-5H3/t16-,18-,21+,22-,23+/m0/s1	YDHXSWOLXDIZHC-UOXSANAJSA-N	473.25258587							101133
BRD-K51041684	LSM-11546		54649337	InChI=1S/C34H36N4O3S/c1-34(2,3)42(41)38-22-28-19-29(33(40)37-16-13-23-8-4-5-9-27(23)21-37)36-32(31(28)30(38)14-17-39)25-11-6-10-24(18-25)26-12-7-15-35-20-26/h4-12,15,18-20,30,39H,13-14,16-17,21-22H2,1-3H3/t30-,42-/m0/s1	MWNPJFSJRUIJTE-MIKJVJEASA-N	CC(C)(C)[S@](=O)N1Cc2cc(nc(c3cccc(c3)c4cccnc4)c2[C@@H]1CCO)C(=O)N5CCc6ccccc6C5	BroadT	BRD-K51041684	BRD-K51041684-001-01-8	Broad Institute of MIT and Harvard	BRD-K51041684			CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccnc1)C(=O)N1CCc2ccccc2C1	InChI=1S/C34H36N4O3S/c1-34(2,3)42(41)38-22-28-19-29(33(40)37-16-13-23-8-4-5-9-27(23)21-37)36-32(31(28)30(38)14-17-39)25-11-6-10-24(18-25)26-12-7-15-35-20-26/h4-12,15,18-20,30,39H,13-14,16-17,21-22H2,1-3H3/t30-,42-/m0/s1	MWNPJFSJRUIJTE-MIKJVJEASA-N	580.250811742							100169
BRD-K31449336	LSM-10334		56835573	InChI=1S/C34H44N4O5S/c1-34(2,3)44(41)38-23-27-22-29(33(40)35-13-7-14-37-15-18-43-19-16-37)36-32(31(27)30(38)12-17-39)26-10-5-8-24(20-26)25-9-6-11-28(21-25)42-4/h5-6,8-11,20-22,30,39H,7,12-19,23H2,1-4H3,(H,35,40)/t30-,44?/m1/s1	NZSCNZRATUWXGR-RMCGNSPKSA-N	COc1cccc(c1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)S(=O)C(C)(C)C)C(=O)NCCCN5CCOCC5	BroadT	BRD-K31449336	BRD-K31449336-001-03-6	Broad Institute of MIT and Harvard	BRD-K31449336			COc1cccc(c1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)S(=O)C(C)(C)C)C(=O)NCCCN1CCOCC1	InChI=1S/C34H44N4O5S/c1-34(2,3)44(41)38-23-27-22-29(33(40)35-13-7-14-37-15-18-43-19-16-37)36-32(31(27)30(38)12-17-39)26-10-5-8-24(20-26)25-9-6-11-28(21-25)42-4/h5-6,8-11,20-22,30,39H,7,12-19,23H2,1-4H3,(H,35,40)/t30-,44?/m1/s1	NZSCNZRATUWXGR-RMCGNSPKSA-N	620.303241238							98955
BRD-K03416270	LSM-8645		54649309	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23+/m0/s1	HABLAPXLJDLSLY-YGKZAACZSA-N	CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c2ccc(F)cc2	BroadT	BRD-K03416270	BRD-K03416270-001-01-1	Broad Institute of MIT and Harvard	BRD-K03416270			CO[C@H](CN(C)Cc1cc(F)ccc1F)[C@@H](C)CN([C@H](C)CO)S(=O)(=O)c1ccc(F)cc1	InChI=1S/C23H31F3N2O4S/c1-16(23(32-4)14-27(3)13-18-11-20(25)7-10-22(18)26)12-28(17(2)15-29)33(30,31)21-8-5-19(24)6-9-21/h5-11,16-17,23,29H,12-15H2,1-4H3/t16-,17+,23+/m0/s1	HABLAPXLJDLSLY-YGKZAACZSA-N	488.195662782							97266
CHEMBL2359288	LSM-13632	BRD-K85134515, SID131445812	54649413	InChI=1S/C32H33FN4O3S/c1-32(2,3)41(40)37-20-25-18-27(31(39)35-19-24-7-4-5-10-26(24)33)36-30(29(25)28(37)13-16-38)23-9-6-8-22(17-23)21-11-14-34-15-12-21/h4-12,14-15,17-18,28,38H,13,16,19-20H2,1-3H3,(H,35,39)/t28-,41-/m1/s1	SOFJTHGIOAEHFZ-GIEABIOQSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccncc4)c2[C@H]1CCO)C(=O)NCc5ccccc5F	BroadT	BRD-K85134515	BRD-K85134515-001-01-6	Broad Institute of MIT and Harvard	BRD-K85134515			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccncc1)C(=O)NCc1ccccc1F	InChI=1S/C32H33FN4O3S/c1-32(2,3)41(40)37-20-25-18-27(31(39)35-19-24-7-4-5-10-26(24)33)36-30(29(25)28(37)13-16-38)23-9-6-8-22(17-23)21-11-14-34-15-12-21/h4-12,14-15,17-18,28,38H,13,16,19-20H2,1-3H3,(H,35,39)/t28-,41-/m1/s1	SOFJTHGIOAEHFZ-GIEABIOQSA-N	572.225739846							102279
BRD-K86326967	LSM-13715		54649418	InChI=1S/C34H36N4O3S/c1-34(2,3)42(41)38-22-28-20-29(33(40)37-17-13-23-7-4-5-8-27(23)21-37)36-32(31(28)30(38)14-18-39)26-10-6-9-25(19-26)24-11-15-35-16-12-24/h4-12,15-16,19-20,30,39H,13-14,17-18,21-22H2,1-3H3/t30-,42-/m1/s1	HAAGBLBLWADVDZ-SBEKKQRLSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccncc4)c2[C@H]1CCO)C(=O)N5CCc6ccccc6C5	BroadT	BRD-K86326967	BRD-K86326967-001-01-0	Broad Institute of MIT and Harvard	BRD-K86326967			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccncc1)C(=O)N1CCc2ccccc2C1	InChI=1S/C34H36N4O3S/c1-34(2,3)42(41)38-22-28-20-29(33(40)37-17-13-23-7-4-5-8-27(23)21-37)36-32(31(28)30(38)14-18-39)26-10-6-9-25(19-26)24-11-15-35-16-12-24/h4-12,15-16,19-20,30,39H,13-14,17-18,21-22H2,1-3H3/t30-,42-/m1/s1	HAAGBLBLWADVDZ-SBEKKQRLSA-N	580.250811742							102363
BRD-K71552321	LSM-12808		54649469	InChI=1S/C34H42N4O4S/c1-34(2,3)43(42)38-21-26-20-28(32(40)35-27-11-6-7-12-27)36-31(30(26)29(38)17-18-39)25-10-8-9-24(19-25)22-13-15-23(16-14-22)33(41)37(4)5/h8-10,13-16,19-20,27,29,39H,6-7,11-12,17-18,21H2,1-5H3,(H,35,40)/t29-,43-/m1/s1	BQTKZBMOPJVAHJ-WXTZLZKPSA-N	CN(C)C(=O)c1ccc(cc1)c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)NC5CCCC5	BroadT	BRD-K71552321	BRD-K71552321-001-01-9	Broad Institute of MIT and Harvard	BRD-K71552321			CN(C)C(=O)c1ccc(cc1)-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)NC1CCCC1	InChI=1S/C34H42N4O4S/c1-34(2,3)43(42)38-21-26-20-28(32(40)35-27-11-6-7-12-27)36-31(30(26)29(38)17-18-39)25-10-8-9-24(19-25)22-13-15-23(16-14-22)33(41)37(4)5/h8-10,13-16,19-20,27,29,39H,6-7,11-12,17-18,21H2,1-5H3,(H,35,40)/t29-,43-/m1/s1	BQTKZBMOPJVAHJ-WXTZLZKPSA-N	602.292676554							101445
BRD-K99913693	LSM-14568		54649431	InChI=1S/C32H40N4O4S/c1-32(2,3)41(39)36-21-24-20-26(31(38)35-16-14-34(4)15-17-35)33-30(29(24)27(36)13-18-37)23-10-8-9-22(19-23)25-11-6-7-12-28(25)40-5/h6-12,19-20,27,37H,13-18,21H2,1-5H3/t27-,41-/m1/s1	XPPDMEIYHITZLE-KWAZPYRMSA-N	COc1ccccc1c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)N5CCN(C)CC5	BroadT	BRD-K99913693	BRD-K99913693-001-01-1	Broad Institute of MIT and Harvard	BRD-K99913693			COc1ccccc1-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)N1CCN(C)CC1	InChI=1S/C32H40N4O4S/c1-32(2,3)41(39)36-21-24-20-26(31(38)35-16-14-34(4)15-17-35)33-30(29(24)27(36)13-18-37)23-10-8-9-22(19-23)25-11-6-7-12-28(25)40-5/h6-12,19-20,27,37H,13-18,21H2,1-5H3/t27-,41-/m1/s1	XPPDMEIYHITZLE-KWAZPYRMSA-N	576.27702649							103224
CHEMBL3182469	LSM-12253	BRD-K62917576	54649459	InChI=1S/C34H35N3O5S/c1-34(2,3)43(40)37-20-26-18-27(33(39)35-19-22-12-13-29-30(16-22)42-21-41-29)36-32(31(26)28(37)14-15-38)25-11-7-10-24(17-25)23-8-5-4-6-9-23/h4-13,16-18,28,38H,14-15,19-21H2,1-3H3,(H,35,39)/t28-,43-/m1/s1	ONCHJBADZSUODG-HOHRNCFUSA-N	CC(C)(C)[S@@](=O)N1Cc2cc(nc(c3cccc(c3)c4ccccc4)c2[C@H]1CCO)C(=O)NCc5ccc6OCOc6c5	BroadT	BRD-K62917576	BRD-K62917576-001-01-7	Broad Institute of MIT and Harvard	BRD-K62917576			CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1ccccc1)C(=O)NCc1ccc2OCOc2c1	InChI=1S/C34H35N3O5S/c1-34(2,3)43(40)37-20-26-18-27(33(39)35-19-22-12-13-29-30(16-22)42-21-41-29)36-32(31(26)28(37)14-15-38)25-11-7-10-24(17-25)23-8-5-4-6-9-23/h4-13,16-18,28,38H,14-15,19-21H2,1-3H3,(H,35,39)/t28-,43-/m1/s1	ONCHJBADZSUODG-HOHRNCFUSA-N	597.22974194							100879
BRD-K50576452	LSM-11504		54649419	InChI=1S/C31H37N3O5S/c1-31(2,3)40(37)34-20-23-19-25(30(36)33-13-16-39-17-14-33)32-29(28(23)26(34)12-15-35)22-9-7-8-21(18-22)24-10-5-6-11-27(24)38-4/h5-11,18-19,26,35H,12-17,20H2,1-4H3/t26-,40-/m1/s1	BNSXJPHXNABYAG-ZCQGCHJCSA-N	COc1ccccc1c2cccc(c2)c3nc(cc4CN([C@H](CCO)c34)[S@](=O)C(C)(C)C)C(=O)N5CCOCC5	BroadT	BRD-K50576452	BRD-K50576452-001-01-4	Broad Institute of MIT and Harvard	BRD-K50576452			COc1ccccc1-c1cccc(c1)-c1nc(cc2CN([C@H](CCO)c12)[S@](=O)C(C)(C)C)C(=O)N1CCOCC1	InChI=1S/C31H37N3O5S/c1-31(2,3)40(37)34-20-23-19-25(30(36)33-13-16-39-17-14-33)32-29(28(23)26(34)12-15-35)22-9-7-8-21(18-22)24-10-5-6-11-27(24)38-4/h5-11,18-19,26,35H,12-17,20H2,1-4H3/t26-,40-/m1/s1	BNSXJPHXNABYAG-ZCQGCHJCSA-N	563.245392004							100125
BRD-K45929778	LSM-11228		54649545	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25-,26-/m0/s1	DIIJYNJFSHJSFY-AYEHBTSNSA-N	CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@@H]1O2)c4ccccc4)C#N	BroadT	BRD-K45929778	BRD-K45929778-001-02-8	Broad Institute of MIT and Harvard	BRD-K45929778			CO[C@H]1CC[C@@H]2CCOc3c(cccc3C(=O)N(C)C[C@H](CC(=O)N(C)C[C@@H]1O2)c1ccccc1)C#N	InChI=1S/C29H35N3O5/c1-31-19-26-25(35-3)13-12-23(37-26)14-15-36-28-21(17-30)10-7-11-24(28)29(34)32(2)18-22(16-27(31)33)20-8-5-4-6-9-20/h4-11,22-23,25-26H,12-16,18-19H2,1-3H3/t22-,23+,25-,26-/m0/s1	DIIJYNJFSHJSFY-AYEHBTSNSA-N	505.25767125							99849
